COC1(CNC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CCC1	ZINC000450500005	FG	On-Demand	Anodyne	KCNK3	44	36
COC(=O)c1cccc(CN(C)[C@H](C)Cc2ccc(O)cc2)c1Cl	ZINC000450500009	EH	On-Demand	Anodyne	CCR3	0	40
COC(=O)c1cccc(CN(C)[C@@H](C)Cc2ccc(O)cc2)c1Cl	ZINC000450500011	EH	On-Demand	Anodyne	CCR3	0	40
CN=c1[nH]c(N2CCC[C@@H]2[C@H]2CCCC[C@H]2O)nc2ccccc12	ZINC000450500036	EF	On-Demand	Anodyne	KCNN3	17	44
CN=c1[nH]c(N2CCC[C@@H]2[C@H]2CCCC[C@@H]2O)nc2ccccc12	ZINC000450500037	EF	On-Demand	Anodyne	KCNN3	17	44
CN=c1[nH]c(N2CCC[C@@H]2[C@@H]2CCCC[C@@H]2O)nc2ccccc12	ZINC000450500038	EF	On-Demand	Anodyne	KCNN3	17	44
CN=c1[nH]c(N2CCC[C@@H]2[C@@H]2CCCC[C@H]2O)nc2ccccc12	ZINC000450500040	EF	On-Demand	Anodyne	KCNN3	17	44
CC(F)(F)c1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)cn1	ZINC000450500063	FH	On-Demand	Anodyne	SFRP1	32	42
CC(F)(F)c1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)cn1	ZINC000450500063	FH	On-Demand	Anodyne	MAP3K7	46	32
CC(F)(F)c1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)cn1	ZINC000450500063	FH	On-Demand	Anodyne	L3MBTL1	0	42
CC(F)(F)c1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)cn1	ZINC000450500063	FH	On-Demand	Anodyne	L3MBTL3	59	36
CCC[C@H](O)CN1CC[C@@H](Oc2ccncc2)C1	ZINC000450500065	CD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@H](O)CN1CC[C@H](Oc2ccncc2)C1	ZINC000450500066	CD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(C)(C#N)CC1	ZINC000450500069	DH	On-Demand	Mild	CACNA1B	39	40
CCCCCN(CC(N)=O)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450500070	ED	On-Demand	Anodyne	PDEC	0	43
CCCCCN(CC(N)=O)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450500071	ED	On-Demand	Anodyne	PDEC	0	43
Cc1ccc(F)c(CC(=O)NCCNC(=O)c2cc[nH]n2)c1	ZINC000450500107	DC	On-Demand	Anodyne	ALPL	41	34
CCCCCN(CC(N)=O)C(=O)Cc1cc(C)ccc1F	ZINC000450500111	CE	On-Demand	Anodyne	TSPO	27	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)c1ncon1	ZINC000450500112	CF	On-Demand	Anodyne	SORT1	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ncon1	ZINC000450500113	CF	On-Demand	Anodyne	SORT1	15	41
O=C(Cc1ccc(O)c(F)c1)Nc1nnc2n1CCCC2	ZINC000450500119	CD	On-Demand	Anodyne	TNKS2	18	40
CC(C)NC(=O)c1ccc(SCCC(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450500130	FH	On-Demand	Bother	GSTM2	63	35
CC(C)NC(=O)c1ccc(SCCC(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450500130	FH	On-Demand	Bother	GSTP1	46	39
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450500145	CF	On-Demand	Anodyne	ERBB2	0	40
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450500145	CF	On-Demand	Anodyne	ADAM10	23	40
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450500146	CF	On-Demand	Anodyne	ERBB2	0	40
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450500146	CF	On-Demand	Anodyne	ADAM10	23	40
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450500147	CF	On-Demand	Anodyne	ERBB2	0	40
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450500147	CF	On-Demand	Anodyne	ADAM10	23	40
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450500148	CF	On-Demand	Anodyne	ERBB2	0	40
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450500148	CF	On-Demand	Anodyne	ADAM10	23	40
COC(=O)c1cccc(CN2CCn3c(nnc3C3CCCC3)C2)c1Cl	ZINC000450500159	FG	On-Demand	Anodyne	P2RX7	0	50
COc1cc(CC(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500160	FH	On-Demand	Anodyne	ABCC8	19	40
COc1cc(CC(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500160	FH	On-Demand	Anodyne	TRPV1	22	47
COc1cc(CC(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500160	FH	On-Demand	Anodyne	PTPRA	48	31
COc1cc(CC(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500160	FH	On-Demand	Anodyne	TTR	0	45
COc1cc(CC(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500160	FH	On-Demand	Anodyne	NCE103	25	45
COc1cc(CC(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500160	FH	On-Demand	Anodyne	MTCA1	16	45
COc1cc(CC(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500160	FH	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500161	FH	On-Demand	Anodyne	ABCC8	19	40
COc1cc(CC(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500161	FH	On-Demand	Anodyne	TRPV1	22	47
COc1cc(CC(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500161	FH	On-Demand	Anodyne	PTPRA	48	31
COc1cc(CC(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500161	FH	On-Demand	Anodyne	TTR	0	45
COc1cc(CC(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500161	FH	On-Demand	Anodyne	NCE103	25	45
COc1cc(CC(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500161	FH	On-Demand	Anodyne	MTCA1	16	45
COc1cc(CC(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)ccc1O	ZINC000450500161	FH	On-Demand	Anodyne	CAN2	0	45
Cc1ccc(CC(=O)N2CCC(n3cc(Cl)cn3)CC2)c(Br)c1	ZINC000450500164	GI	On-Demand	Anodyne	MAP3K7	47	34
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500173	GE	On-Demand	Anodyne	DRD4	34	41
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500173	GE	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500173	GE	On-Demand	Anodyne	OPRK1	36	40
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500173	GE	On-Demand	Anodyne	HTR4	67	38
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500173	GE	On-Demand	Anodyne	CCR3	38	41
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500173	GE	On-Demand	Anodyne	MCHR1	25	44
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500174	GE	On-Demand	Anodyne	DRD4	34	41
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500174	GE	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500174	GE	On-Demand	Anodyne	OPRK1	36	40
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500174	GE	On-Demand	Anodyne	HTR4	67	38
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500174	GE	On-Demand	Anodyne	CCR3	38	41
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1Cl	ZINC000450500174	GE	On-Demand	Anodyne	MCHR1	25	44
COc1cc(CC(=O)NCC2(C)CCN(C)CC2)ccc1Cl	ZINC000450500176	DF	On-Demand	Anodyne	TRPV1	25	40
COc1cc(CC(=O)NCC2(C)CCN(C)CC2)ccc1Cl	ZINC000450500176	DF	On-Demand	Anodyne	NCE103	23	43
COc1cc(CC(=O)NCC2(C)CCN(C)CC2)ccc1Cl	ZINC000450500176	DF	On-Demand	Anodyne	CAN2	0	43
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450500184	EG	On-Demand	Anodyne	TACR1	15	42
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450500185	EG	On-Demand	Anodyne	TACR1	15	42
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450500186	EG	On-Demand	Anodyne	TACR1	15	42
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450500187	EG	On-Demand	Anodyne	TACR1	15	42
COC(=O)[C@@H]1CN(c2ccc3nnc([C@H]4C[C@H]4C)n3n2)C[C@H]1c1ccccc1	ZINC000450500192	GF	On-Demand	Anodyne	SLC6A1	64	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@H]4C[C@H]4C)n3n2)C[C@H]1c1ccccc1	ZINC000450500192	GF	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@@H]4C[C@H]4C)n3n2)C[C@H]1c1ccccc1	ZINC000450500193	GF	On-Demand	Anodyne	SLC6A1	64	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@@H]4C[C@H]4C)n3n2)C[C@H]1c1ccccc1	ZINC000450500193	GF	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@@H]4C[C@@H]4C)n3n2)C[C@H]1c1ccccc1	ZINC000450500194	GF	On-Demand	Anodyne	SLC6A1	64	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@@H]4C[C@@H]4C)n3n2)C[C@H]1c1ccccc1	ZINC000450500194	GF	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@H]4C[C@@H]4C)n3n2)C[C@H]1c1ccccc1	ZINC000450500195	GF	On-Demand	Anodyne	SLC6A1	64	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@H]4C[C@@H]4C)n3n2)C[C@H]1c1ccccc1	ZINC000450500195	GF	On-Demand	Anodyne	SLC6A4	19	40
CCOC(=O)[C@@H]1CC[C@H](N=c2[nH]ccc3cc([N+](=O)[O-])ccc23)C1	ZINC000450500200	EF	On-Demand	Bother	SLC27A4	44	32
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450500210	EF	On-Demand	Anodyne	SCN9A	24	40
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450500211	EF	On-Demand	Anodyne	SCN9A	24	40
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450500212	EF	On-Demand	Anodyne	SCN9A	24	40
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450500213	EF	On-Demand	Anodyne	SCN9A	24	40
CC(C)N(CCC(=O)O)C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450500214	FD	On-Demand	Bother	COLA	65	32
CN(CCCN1CCCC1)c1ncnc2[nH]c3ccccc3c12	ZINC000450500217	DG	On-Demand	Anodyne	HRH3	27	40
CN(CCCN1CCCC1)c1ncnc2[nH]c3ccccc3c12	ZINC000450500217	DG	On-Demand	Anodyne	SIGMAR1	15	42
CN(CCCN1CCCC1)c1ncnc2[nH]c3ccccc3c12	ZINC000450500217	DG	On-Demand	Anodyne	TUBB3	30	40
CN(CCCN1CCCC1)c1ncnc2[nH]c3ccccc3c12	ZINC000450500217	DG	On-Demand	Anodyne	HNMT	85	49
COc1cc(CN2CCO[C@@H](c3cccc(O)c3)C2)ccc1Cl	ZINC000450500218	EH	On-Demand	Anodyne	DRD4	28	52
COc1cc(CN2CCO[C@@H](c3cccc(O)c3)C2)ccc1Cl	ZINC000450500218	EH	On-Demand	Anodyne	DRD3	0	53
COc1cc(CN2CCO[C@H](c3cccc(O)c3)C2)ccc1Cl	ZINC000450500219	EH	On-Demand	Anodyne	DRD4	28	52
COc1cc(CN2CCO[C@H](c3cccc(O)c3)C2)ccc1Cl	ZINC000450500219	EH	On-Demand	Anodyne	DRD3	0	53
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)[C@H]1CCCOC1	ZINC000450500229	DH	On-Demand	Anodyne	CCR2	50	38
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450500266	GG	On-Demand	Anodyne	RBP4	76	36
CN(C(=O)Cc1ccc(Cl)c(F)c1)C(C)(C)C(=O)O	ZINC000450500268	CE	On-Demand	Anodyne	OPRK1	0	47
CNc1nc(N2CC[C@H](Oc3cccnc3N(C)C)C2)nc2ccccc12	ZINC000450500274	FE	On-Demand	Anodyne	PDE3A	45	36
CNc1nc(N2CC[C@H](Oc3cccnc3N(C)C)C2)nc2ccccc12	ZINC000450500274	FE	On-Demand	Anodyne	PDE3B	67	36
CNc1nc(N2CC[C@@H](Oc3cccnc3N(C)C)C2)nc2ccccc12	ZINC000450500276	FE	On-Demand	Anodyne	PDE3A	45	36
CNc1nc(N2CC[C@@H](Oc3cccnc3N(C)C)C2)nc2ccccc12	ZINC000450500276	FE	On-Demand	Anodyne	PDE3B	67	36
CC(C)(C)OC(=O)CCSc1c(Br)cncc1[N+](=O)[O-]	ZINC000450500281	FH	On-Demand	Bother	GSTM2	38	42
CCOc1ccnc(N2CCCN(CC[C@@H](C)O)CC2)n1	ZINC000450500285	CD	On-Demand	Anodyne	SORD	46	36
O=C(CCCN1CCn2c(nnc2-c2cccnc2)C1)c1ccccc1	ZINC000450500286	EF	On-Demand	Anodyne	CYP2J2	50	37
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500287	GH	On-Demand	Anodyne	PTGER4	29	40
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500287	GH	On-Demand	Anodyne	PTGER3	80	42
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500287	GH	On-Demand	Anodyne	TACR3	38	40
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500287	GH	On-Demand	Anodyne	SOAT1	0	43
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500287	GH	On-Demand	Anodyne	CCKBR	25	44
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500287	GH	On-Demand	Anodyne	UTS2	78	41
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500287	GH	On-Demand	Anodyne	CTSA	50	36
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500288	GH	On-Demand	Anodyne	PTGER4	29	40
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500288	GH	On-Demand	Anodyne	PTGER3	80	42
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500288	GH	On-Demand	Anodyne	TACR3	38	40
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500288	GH	On-Demand	Anodyne	SOAT1	0	43
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500288	GH	On-Demand	Anodyne	CCKBR	25	44
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500288	GH	On-Demand	Anodyne	UTS2	78	41
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)c2ccccc2)cc1OC	ZINC000450500288	GH	On-Demand	Anodyne	CTSA	50	36
CCOc1ccnc(N2CCCN(CC[C@H](C)O)CC2)n1	ZINC000450500290	CD	On-Demand	Anodyne	SORD	46	36
C[S@](=O)C1(CNc2ncnc3cc(Br)ccc23)CCC1	ZINC000450500293	FF	On-Demand	Anodyne	EGFR	75	38
C[S@@](=O)C1(CNc2ncnc3cc(Br)ccc23)CCC1	ZINC000450500294	FF	On-Demand	Anodyne	EGFR	75	38
CSCCCN(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450500297	CG	On-Demand	Anodyne	TUBB3	32	42
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450500300	GG	On-Demand	Anodyne	TACR1	23	43
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450500300	GG	On-Demand	Anodyne	GPR88	0	40
O=C(CCCC(=O)N1CCC(CCCN2CCOCC2)CC1)C1CC1	ZINC000450500302	FE	On-Demand	Anodyne	PAOX	17	40
O=C(O)CN(C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000450500304	EC	On-Demand	Bother	ACE	42	44
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccccc1	ZINC000450500331	GG	On-Demand	Anodyne	SLC6A1	62	44
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccccc1	ZINC000450500331	GG	On-Demand	Anodyne	SLC6A4	16	44
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccccc1	ZINC000450500331	GG	On-Demand	Anodyne	SLC6A3	29	44
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccccc1	ZINC000450500331	GG	On-Demand	Anodyne	COLA	28	42
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccccc1	ZINC000450500331	GG	On-Demand	Anodyne	CPT1A	21	42
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccccc1	ZINC000450500331	GG	On-Demand	Anodyne	S1PR4	24	41
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccccc1	ZINC000450500331	GG	On-Demand	Anodyne	S1PR1	22	41
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	ESR1	39	41
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	ESR2	28	41
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	LTA4H	44	49
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	HRH3	44	59
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	SIGMAR1	19	42
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	EBP	53	38
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	CHRNA10	68	51
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	PSMB2	46	35
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	PSMB5	16	40
COc1cccc(OCCN2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500335	GF	On-Demand	Anodyne	PSMB1	42	40
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	ESR1	39	41
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	ESR2	28	41
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	LTA4H	44	49
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	HRH3	44	59
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	SIGMAR1	19	42
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	EBP	53	38
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	CHRNA10	68	51
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	PSMB2	46	35
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	PSMB5	16	40
COc1cccc(OCCN2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450500340	GF	On-Demand	Anodyne	PSMB1	42	40
CCOc1ccc(NC(=O)CN2CCN(CCc3cscn3)CC2)cc1	ZINC000450500341	FE	On-Demand	Anodyne	LTA4H	18	40
CCOc1ccc(NC(=O)CN2CCN(CCc3cscn3)CC2)cc1	ZINC000450500341	FE	On-Demand	Anodyne	ACOX1	49	38
COc1cc(Cl)c(C(=O)N(CC(=O)O)C2CC2)cc1OC	ZINC000450500345	DE	On-Demand	Anodyne	ACE	70	51
COc1cc(Cl)c(C(=O)N(CC(=O)O)C2CC2)cc1OC	ZINC000450500345	DE	On-Demand	Anodyne	HTR4	55	35
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1	ZINC000450500376	EF	On-Demand	Anodyne	CCR5	36	40
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1	ZINC000450500381	EF	On-Demand	Anodyne	CCR5	36	40
Cc1cccc(Cl)c1C(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1	ZINC000450500383	EF	On-Demand	Anodyne	CCR5	36	40
Cc1cccc(Cl)c1C(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1	ZINC000450500385	EF	On-Demand	Anodyne	CCR5	36	40
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450500395	FH	On-Demand	Anodyne	FABP4	17	41
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450500396	FH	On-Demand	Anodyne	FABP4	17	41
Cc1nc(N[C@H]2CC[C@@H](c3ccccc3F)C2)ncc1[N+](=O)[O-]	ZINC000450500404	DH	On-Demand	Bother	PRKCQ	43	39
Cc1nc(N[C@@H]2CC[C@H](c3ccccc3F)C2)ncc1[N+](=O)[O-]	ZINC000450500405	DH	On-Demand	Bother	PRKCQ	43	39
Cc1nc(N[C@H]2CC[C@H](c3ccccc3F)C2)ncc1[N+](=O)[O-]	ZINC000450500406	DH	On-Demand	Bother	PRKCQ	43	39
Cc1nc(N[C@@H]2CC[C@@H](c3ccccc3F)C2)ncc1[N+](=O)[O-]	ZINC000450500407	DH	On-Demand	Bother	PRKCQ	43	39
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	ESR1	19	40
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	HTR1A	20	44
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	DRD4	44	35
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	SLC6A4	25	47
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	SLC6A3	29	49
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	LTA4H	40	45
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	HRH3	18	49
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	SIGMAR1	18	42
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	ABCB1	33	44
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	HSP90AB1	31	46
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	PSMB2	47	38
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	PSMB1	41	38
COc1cccc(OCCN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500408	GF	On-Demand	Anodyne	NET	0	41
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	ESR1	19	40
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	HTR1A	20	44
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	DRD4	44	35
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	SLC6A4	25	47
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	SLC6A3	29	49
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	LTA4H	40	45
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	HRH3	18	49
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	SIGMAR1	18	42
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	ABCB1	33	44
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	HSP90AB1	31	46
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	PSMB2	47	38
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	PSMB1	41	38
COc1cccc(OCCN2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500409	GF	On-Demand	Anodyne	NET	0	41
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	ESR1	19	40
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	HTR1A	20	44
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	DRD4	44	35
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	SLC6A4	25	47
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	SLC6A3	29	49
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	LTA4H	40	45
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	HRH3	18	49
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	SIGMAR1	18	42
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	ABCB1	33	44
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	HSP90AB1	31	46
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	PSMB2	47	38
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	PSMB1	41	38
COc1cccc(OCCN2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450500410	GF	On-Demand	Anodyne	NET	0	41
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	ESR1	19	40
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	HTR1A	20	44
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	DRD4	44	35
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	SLC6A4	25	47
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	SLC6A3	29	49
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	LTA4H	40	45
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	HRH3	18	49
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	SIGMAR1	18	42
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	ABCB1	33	44
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	HSP90AB1	31	46
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	PSMB2	47	38
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	PSMB1	41	38
COc1cccc(OCCN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450500411	GF	On-Demand	Anodyne	NET	0	41
CN(CCN1CCOC2(CCCC2)C1)Cc1ccccc1	ZINC000450500417	CF	On-Demand	Anodyne	SIGMAR1	25	42
CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCCc2ncc(C)o2)c1	ZINC000450500419	FI	On-Demand	Anodyne	MSR1	0	40
COC(=O)c1coc(CN2CCN(Cc3cccc(F)c3)CC2)n1	ZINC000450500423	ED	On-Demand	Anodyne	CACNA1G	29	55
CC(=O)[C@@](C)(O)CN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450500428	FD	On-Demand	Anodyne	SIGMAR1	20	43
CC(=O)[C@@](C)(O)CN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450500428	FD	On-Demand	Anodyne	CACNA1G	21	41
CC(=O)[C@](C)(O)CN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450500429	FD	On-Demand	Anodyne	SIGMAR1	20	43
CC(=O)[C@](C)(O)CN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450500429	FD	On-Demand	Anodyne	CACNA1G	21	41
COc1cccc(OCCC(=O)NCC2(c3ccncc3)CCCC2)c1	ZINC000450500487	FG	On-Demand	Anodyne	MTNR1A	37	45
COc1cccc(OCCC(=O)NCC2(c3ccncc3)CCCC2)c1	ZINC000450500487	FG	On-Demand	Anodyne	MTNR1B	37	41
COc1cccc(OCCC(=O)NCC2(c3ccncc3)CCCC2)c1	ZINC000450500487	FG	On-Demand	Anodyne	ACAT	0	56
CN(C)S(=O)(=O)CC(=O)N[C@H](CC(=O)O)c1cccc(Br)c1	ZINC000450500489	GC	On-Demand	Anodyne	KCNA5	25	41
CC1(C#N)CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450500490	FF	On-Demand	Mild	AR	21	42
CN(C)S(=O)(=O)CC(=O)N[C@@H](CC(=O)O)c1cccc(Br)c1	ZINC000450500491	GC	On-Demand	Anodyne	KCNA5	25	41
CC1(C#N)CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450500496	FF	On-Demand	Mild	AR	21	42
O=C(CCCN1CCn2c(nnc2-c2cccnc2)C1)c1ccc(F)cc1	ZINC000450500497	FF	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCn2c(nnc2-c2cccnc2)C1)c1ccc(F)cc1	ZINC000450500497	FF	On-Demand	Anodyne	DRD1	0	47
O=C(CCCN1CCn2c(nnc2-c2cccnc2)C1)c1ccc(F)cc1	ZINC000450500497	FF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCn2c(nnc2-c2cccnc2)C1)c1ccc(F)cc1	ZINC000450500497	FF	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCn2c(nnc2-c2cccnc2)C1)c1ccc(F)cc1	ZINC000450500497	FF	On-Demand	Anodyne	CYP2J2	45	33
c1ccc(CCn2ccc(CN3CC[C@H](Oc4ccncc4)C3)n2)cc1	ZINC000450500504	EG	On-Demand	Anodyne	SCN5A	48	33
c1ccc(CCn2ccc(CN3CC[C@@H](Oc4ccncc4)C3)n2)cc1	ZINC000450500505	EG	On-Demand	Anodyne	SCN5A	48	33
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450500551	FG	On-Demand	Anodyne	TACR1	15	42
CCOc1ccnc(N2CCCN(C[C@H](O)COCCOC)CC2)n1	ZINC000450500555	FC	On-Demand	Anodyne	ABCB1	44	33
CCOc1ccnc(N2CCCN(C[C@H](O)COCCOC)CC2)n1	ZINC000450500555	FC	On-Demand	Anodyne	HSP90AB1	40	43
CCOc1ccnc(N2CCCN(C[C@@H](O)COCCOC)CC2)n1	ZINC000450500558	FC	On-Demand	Anodyne	ABCB1	44	33
CCOc1ccnc(N2CCCN(C[C@@H](O)COCCOC)CC2)n1	ZINC000450500558	FC	On-Demand	Anodyne	HSP90AB1	40	43
Cc1ccn(-c2ccccc2C(=O)NCC2(C)CCN(C)CC2)n1	ZINC000450500580	EF	On-Demand	Anodyne	HCN1	52	32
CCc1cc(N(C)CCCN2CCCC2)ccn1	ZINC000450500586	BF	On-Demand	Anodyne	HNMT	81	41
COc1cc(SCCC(=O)OC(C)(C)C)c(F)cc1[N+](=O)[O-]	ZINC000450500592	EH	On-Demand	Bother	GSTM2	33	43
COc1ccc(-c2ccnc(N3CCC[C@@H](F)C3)n2)cc1	ZINC000450500595	CG	On-Demand	Anodyne	DKK1	0	45
COc1ccc(-c2ccnc(N3CCC[C@H](F)C3)n2)cc1	ZINC000450500597	CG	On-Demand	Anodyne	DKK1	0	45
COCC1(CNc2nccc(-c3ccc(OC)cc3)n2)CCC1	ZINC000450500600	DG	On-Demand	Anodyne	CLK4	25	52
COCC1(CNc2nccc(-c3ccc(OC)cc3)n2)CCC1	ZINC000450500600	DG	On-Demand	Anodyne	DYRK1B	15	57
CO[C@H]1COCC[C@@H]1CC(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450500606	EE	On-Demand	Anodyne	MAP3K7	40	33
CN1CCN(CCNc2ccnc3cc(F)c(Cl)cc23)CC1(C)C	ZINC000450500608	FG	On-Demand	Anodyne	HRP1_PLAFA	109	41
CN1CCN(CCNc2ccnc3cc(F)c(Cl)cc23)CC1(C)C	ZINC000450500608	FG	On-Demand	Anodyne	HNMT	72	44
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450500610	EE	On-Demand	Anodyne	MAP3K7	40	33
CO[C@@H]1COCC[C@H]1CC(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450500611	EE	On-Demand	Anodyne	MAP3K7	40	33
CO[C@H]1COCC[C@H]1CC(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450500612	EE	On-Demand	Anodyne	MAP3K7	40	33
COCc1cccc(CC(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)c1	ZINC000450500629	FG	On-Demand	Anodyne	PTGES	23	41
COCc1cccc(CC(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)c1	ZINC000450500630	FG	On-Demand	Anodyne	PTGES	23	41
CCC[C@H](CC(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450500631	CD	On-Demand	Anodyne	CAPN2	58	35
O[C@H](CNc1ccnc2cc(F)c(Cl)cc12)C(F)F	ZINC000450500632	CG	On-Demand	Anodyne	HRP1_PLAFA	53	33
O[C@H](CNc1ccnc2cc(F)c(Cl)cc12)C(F)F	ZINC000450500632	CG	On-Demand	Anodyne	HNMT	44	34
CCC[C@@H](CC(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450500633	CD	On-Demand	Anodyne	CAPN2	58	35
O[C@@H](CNc1ccnc2cc(F)c(Cl)cc12)C(F)F	ZINC000450500635	CG	On-Demand	Anodyne	HRP1_PLAFA	53	33
O[C@@H](CNc1ccnc2cc(F)c(Cl)cc12)C(F)F	ZINC000450500635	CG	On-Demand	Anodyne	HNMT	44	34
CN(C)c1ncccc1O[C@H]1CCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450500652	GF	On-Demand	Anodyne	PDE3A	48	39
CN(C)c1ncccc1O[C@H]1CCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450500652	GF	On-Demand	Anodyne	PDE3B	71	39
CN(C)c1ncccc1O[C@@H]1CCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450500653	GF	On-Demand	Anodyne	PDE3A	48	39
CN(C)c1ncccc1O[C@@H]1CCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450500653	GF	On-Demand	Anodyne	PDE3B	71	39
COc1cc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500654	FE	On-Demand	Anodyne	DRD4	30	42
COc1cc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500654	FE	On-Demand	Anodyne	ACHE	17	42
COc1cc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500654	FE	On-Demand	Anodyne	AVPR1B	40	34
COc1cc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500654	FE	On-Demand	Anodyne	HTR4	56	38
COc1cc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500654	FE	On-Demand	Anodyne	SSTR5	51	39
COc1cc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500654	FE	On-Demand	Anodyne	CCR3	24	41
COc1cc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500654	FE	On-Demand	Anodyne	UTS2R	32	41
COc1cc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500655	FE	On-Demand	Anodyne	DRD4	30	42
COc1cc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500655	FE	On-Demand	Anodyne	ACHE	17	42
COc1cc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500655	FE	On-Demand	Anodyne	AVPR1B	40	34
COc1cc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500655	FE	On-Demand	Anodyne	HTR4	56	38
COc1cc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500655	FE	On-Demand	Anodyne	SSTR5	51	39
COc1cc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500655	FE	On-Demand	Anodyne	CCR3	24	41
COc1cc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)ccc1Cl	ZINC000450500655	FE	On-Demand	Anodyne	UTS2R	32	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccc(Br)cc1	ZINC000450500660	GC	On-Demand	Anodyne	FOLH1	41	34
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccc(Br)cc1	ZINC000450500661	GC	On-Demand	Anodyne	FOLH1	41	34
COC(=O)C1(CN2CCN(Cc3ccccc3Cl)CC2)CC1	ZINC000450500667	DE	On-Demand	Anodyne	SIGMAR1	22	50
CC(C)(C)Oc1ccc(C(=O)Nc2cc(C(F)(F)F)ccn2)nc1	ZINC000450500675	EH	On-Demand	Anodyne	RAF1	47	36
CC(C)(C)Oc1ccc(C(=O)Nc2cc(C(F)(F)F)ccn2)nc1	ZINC000450500675	EH	On-Demand	Anodyne	PYGM	18	44
CC(C)(C)Oc1ccc(C(=O)Nc2cc(C(F)(F)F)ccn2)nc1	ZINC000450500675	EH	On-Demand	Anodyne	Q8MMZ8_EIMTE	62	36
CC(C)(C)Oc1ccc(C(=O)Nc2cc(C(F)(F)F)ccn2)nc1	ZINC000450500675	EH	On-Demand	Anodyne	SCD1	0	40
FC(F)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450500677	CI	On-Demand	Anodyne	SIGMAR1	15	44
FC(F)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450500678	CI	On-Demand	Anodyne	SIGMAR1	16	44
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	HTR1A	28	64
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	DRD2	40	64
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	DRD1	30	62
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	DRD4	30	55
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	HRH2	0	51
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	HTR2A	45	64
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	HTR2C	28	64
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	DRD3	21	57
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	ERG2	23	51
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	HTR7	33	51
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	HRH3	32	52
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	SIGMAR1	42	62
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	CCR3	26	41
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	SLC18A3	0	50
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	EBP	31	51
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	HTR3B	0	62
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	NET	0	56
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	L3MBTL1	0	42
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	L3MBTL3	92	41
O=C(CCCN1CCN(C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450500687	EH	On-Demand	Anodyne	AP2S1	0	51
O=C1CC[C@H](CN2CCN(Cc3ccc(Br)cc3)CC2)CCN1	ZINC000450500688	GE	On-Demand	Anodyne	SIGMAR1	22	45
O=C1CC[C@H](CN2CCN(Cc3ccc(Br)cc3)CC2)CCN1	ZINC000450500688	GE	On-Demand	Anodyne	CXCR3	18	53
O=C1CC[C@@H](CN2CCN(Cc3ccc(Br)cc3)CC2)CCN1	ZINC000450500689	GE	On-Demand	Anodyne	SIGMAR1	22	45
O=C1CC[C@@H](CN2CCN(Cc3ccc(Br)cc3)CC2)CCN1	ZINC000450500689	GE	On-Demand	Anodyne	CXCR3	18	53
CCCC(=O)Nc1ccc(Cl)c(NC(=O)Cn2ccc(C)n2)c1	ZINC000450500690	EG	On-Demand	Anodyne	IMDH_CRYPV	40	37
COC1(CNC(=O)c2cc3ccncc3s2)CCC1	ZINC000450500691	CF	On-Demand	Anodyne	SELE	45	32
COC1(CNC(=O)c2cc3ccncc3s2)CCC1	ZINC000450500691	CF	On-Demand	Anodyne	VCAM1	52	37
COc1cccc(OCCC(=O)N2CC[C@H](C3CC3)C2)c1	ZINC000450500693	CF	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CC[C@H](C3CC3)C2)c1	ZINC000450500693	CF	On-Demand	Anodyne	MTNR1A	29	44
COc1cccc(OCCC(=O)N2CC[C@H](C3CC3)C2)c1	ZINC000450500693	CF	On-Demand	Anodyne	MTNR1B	35	40
COc1cccc(OCCC(=O)N2CC[C@H](C3CC3)C2)c1	ZINC000450500693	CF	On-Demand	Anodyne	CHRNA10	23	43
COc1cccc(OCCC(=O)N2CC[C@@H](C3CC3)C2)c1	ZINC000450500694	CF	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CC[C@@H](C3CC3)C2)c1	ZINC000450500694	CF	On-Demand	Anodyne	MTNR1A	29	44
COc1cccc(OCCC(=O)N2CC[C@@H](C3CC3)C2)c1	ZINC000450500694	CF	On-Demand	Anodyne	MTNR1B	35	40
COc1cccc(OCCC(=O)N2CC[C@@H](C3CC3)C2)c1	ZINC000450500694	CF	On-Demand	Anodyne	CHRNA10	23	43
CC(=O)[C@@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500695	GF	On-Demand	Anodyne	SLC6A1	0	53
CC(=O)[C@@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500695	GF	On-Demand	Anodyne	SLC6A4	50	61
CC(=O)[C@@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500695	GF	On-Demand	Anodyne	SLC6A3	79	64
CC(=O)[C@@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500695	GF	On-Demand	Anodyne	CHRM4	16	41
CC(=O)[C@@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500695	GF	On-Demand	Anodyne	AMY2	51	29
CC(=O)[C@@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500695	GF	On-Demand	Anodyne	NET	0	44
CC(=O)[C@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500696	GF	On-Demand	Anodyne	SLC6A1	0	53
CC(=O)[C@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500696	GF	On-Demand	Anodyne	SLC6A4	50	61
CC(=O)[C@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500696	GF	On-Demand	Anodyne	SLC6A3	79	64
CC(=O)[C@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500696	GF	On-Demand	Anodyne	CHRM4	16	41
CC(=O)[C@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500696	GF	On-Demand	Anodyne	AMY2	51	29
CC(=O)[C@](C)(O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450500696	GF	On-Demand	Anodyne	NET	0	44
Brc1ccc(CN2CCN(Cc3cnns3)CC2)cc1	ZINC000450500698	FF	On-Demand	Anodyne	SIGMAR1	15	48
Clc1ccccc1CN1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450500702	EF	On-Demand	Anodyne	DRD4	15	40
Clc1ccccc1CN1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450500702	EF	On-Demand	Anodyne	SIGMAR1	16	52
CCC[C@H](O)CN1CCN(Cc2ccccc2Cl)CC1	ZINC000450500703	CF	On-Demand	Anodyne	ABCB1	27	40
CCC[C@@H](O)CN1CCN(Cc2ccccc2Cl)CC1	ZINC000450500704	CF	On-Demand	Anodyne	ABCB1	27	40
CCOc1ccc(NC(=O)CN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450500705	GD	On-Demand	Anodyne	LTA4H	19	43
C1=C(CN2CCN(C3CCCCC3)CC2)CCCC1	ZINC000450500718	CG	On-Demand	Anodyne	EBP	15	46
Cc1cc(C(=O)Nc2cc(C(F)(F)F)ccn2)nn1C(C)C	ZINC000450500719	DG	On-Demand	Anodyne	NPY5R	20	46
CCC(=O)CCCN1CCN(CC(=O)Nc2ccc(Br)cc2)CC1	ZINC000450500724	GF	On-Demand	Anodyne	CHRNA7	32	44
CCC(=O)CCCN1CCN(CC(=O)Nc2ccc(Br)cc2)CC1	ZINC000450500724	GF	On-Demand	Anodyne	CACNA1G	18	47
COC(=O)C1(CN2CCN(c3cc(C)ccn3)CC2)CC1	ZINC000450500728	CD	On-Demand	Anodyne	DRD4	23	51
Fc1cc(CN2CCN(CCc3cscn3)CC2)ccc1Br	ZINC000450500732	GG	On-Demand	Anodyne	ABCC1	77	34
Fc1cc(CN2CCN(CCc3cscn3)CC2)ccc1Br	ZINC000450500732	GG	On-Demand	Anodyne	SCN5A	40	34
Fc1cc(CN2CCN(CCc3cscn3)CC2)ccc1Br	ZINC000450500732	GG	On-Demand	Anodyne	ABCB1A	43	31
COC1(CNC(=O)c2cccc(SC)c2)CCC1	ZINC000450500744	CF	On-Demand	Anodyne	DRD4	41	31
Cc1c(C(=O)Nc2cc(C(F)(F)F)ccn2)ccn1C(C)C	ZINC000450500748	DI	On-Demand	Anodyne	SORT1	21	40
COc1cccc(OCCN2CCN(CC3(C#N)CCC3)CC2)c1	ZINC000450500749	EE	On-Demand	Mild	DRD4	44	34
COc1cccc(OCCN2CCN(CC3(C#N)CCC3)CC2)c1	ZINC000450500749	EE	On-Demand	Mild	LTA4H	32	48
COc1cccc(OCCN2CCN(CC3(C#N)CCC3)CC2)c1	ZINC000450500749	EE	On-Demand	Mild	HRH3	18	53
COc1cccc(OCCN2CCN(CC3(C#N)CCC3)CC2)c1	ZINC000450500749	EE	On-Demand	Mild	PSMB2	46	36
C[C@H](O)CCN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450500751	DF	On-Demand	Anodyne	DRD2	0	41
C[C@H](O)CCN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450500751	DF	On-Demand	Anodyne	HRH3	0	41
C[C@H](O)CCN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450500751	DF	On-Demand	Anodyne	BIRC2	69	38
C[C@H](O)CCN1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450500752	DF	On-Demand	Anodyne	DRD2	0	41
C[C@H](O)CCN1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450500752	DF	On-Demand	Anodyne	HRH3	0	41
C[C@H](O)CCN1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450500752	DF	On-Demand	Anodyne	BIRC2	69	38
C[C@H](O)CCN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450500753	DF	On-Demand	Anodyne	DRD2	0	41
C[C@H](O)CCN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450500753	DF	On-Demand	Anodyne	HRH3	0	41
C[C@H](O)CCN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450500753	DF	On-Demand	Anodyne	BIRC2	69	38
C[C@H](O)CCN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450500754	DF	On-Demand	Anodyne	DRD2	0	41
C[C@H](O)CCN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450500754	DF	On-Demand	Anodyne	HRH3	0	41
C[C@H](O)CCN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450500754	DF	On-Demand	Anodyne	BIRC2	69	38
CCOC(=O)C1(COC)CCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450500762	FE	On-Demand	Bother	CACNA1C	53	37
CCOC(=O)C1(COC)CCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450500762	FE	On-Demand	Bother	CACNA1D	81	35
COc1cccc(OCCN2CCN(Cc3nnc(C(C)C)s3)CC2)c1	ZINC000450500763	GF	On-Demand	Anodyne	DRD4	42	33
COc1cccc(OCCN2CCN(Cc3nnc(C(C)C)s3)CC2)c1	ZINC000450500763	GF	On-Demand	Anodyne	LTA4H	29	44
CC(C)(C)OC(=O)CCSc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450500767	GF	On-Demand	Bother	GSTM2	70	42
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	NR3C1	0	49
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	NR3C2	0	46
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	ACE	34	64
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	GNRHR	0	48
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	OPRM1	0	48
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	OPRD1	0	48
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MME	57	59
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	EDNRB	69	52
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	EDNRA	53	52
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	TACR1	31	47
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MC4R	42	41
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	BMP1	30	46
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	TACR2	36	45
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	CCKAR	101	46
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	CTSL	32	44
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	BRS3	28	52
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	NMBR	47	39
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MC3R	62	39
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MC5R	61	37
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MMP2	30	49
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MMP8	46	49
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MMP14	26	45
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	GRPR	78	40
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	ECE1	79	59
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	LNPEP	28	46
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	SSTR3	37	43
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MMP11	77	36
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	CCKBR	76	44
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	GHSR	77	46
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MMP9	29	53
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	ACE2	56	39
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MC1R	79	42
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	ADAM9	46	48
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MMP1	25	50
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	NPR	51	60
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	MAGI3	0	41
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	SSSIM	31	47
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	SLC15A2	0	67
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	KISS1R	70	38
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	ERAP2	50	47
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	PSMB8	22	40
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	ERAP1	0	47
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	LASB	0	51
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	CD36	0	40
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500768	FC	On-Demand	Anodyne	NRDE	0	49
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	NR3C1	0	49
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	NR3C2	0	46
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	ACE	34	64
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	GNRHR	0	48
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	OPRM1	0	48
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	OPRD1	0	48
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MME	57	59
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	EDNRB	69	52
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	EDNRA	53	52
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	TACR1	31	47
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MC4R	42	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	BMP1	30	46
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	TACR2	36	45
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	CCKAR	101	46
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	CTSL	32	44
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	BRS3	28	52
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	NMBR	47	39
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MC3R	62	39
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MC5R	61	37
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MMP2	30	49
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MMP8	46	49
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MMP14	26	45
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	GRPR	78	40
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	ECE1	79	59
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	LNPEP	28	46
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	SSTR3	37	43
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MMP11	77	36
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	CCKBR	76	44
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	GHSR	77	46
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MMP9	29	53
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	ACE2	56	39
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MC1R	79	42
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	ADAM9	46	48
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MMP1	25	50
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	NPR	51	60
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	MAGI3	0	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	SSSIM	31	47
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	SLC15A2	0	67
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	KISS1R	70	38
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	ERAP2	50	47
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	PSMB8	22	40
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	ERAP1	0	47
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	LASB	0	51
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	CD36	0	40
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	ZINC000450500769	FC	On-Demand	Anodyne	NRDE	0	49
CC(C)(CCC(=O)O)NC(=O)Cc1c[nH]c2ccc(Cl)cc12	ZINC000450500775	DG	On-Demand	Anodyne	MPO	46	39
CCS(=O)(=O)c1ccc(CN2CC[C@H](Oc3ccncc3)C2)cc1	ZINC000450500802	EF	On-Demand	Anodyne	HRH3	16	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Oc3ccncc3)C2)cc1	ZINC000450500803	EF	On-Demand	Anodyne	HRH3	16	41
O=C(CCCN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500815	DG	On-Demand	Anodyne	DRD4	18	48
O=C(CCCN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500815	DG	On-Demand	Anodyne	HTR2A	19	48
O=C(CCCN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500815	DG	On-Demand	Anodyne	HTR2C	21	51
O=C(CCCN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500815	DG	On-Demand	Anodyne	SLC6A1	65	38
O=C(CCCN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500815	DG	On-Demand	Anodyne	HTR7	16	43
O=C(CCCN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500815	DG	On-Demand	Anodyne	CCR3	21	42
O=C(CCCN1CC[C@@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500815	DG	On-Demand	Anodyne	CYP2J2	65	46
O=C(CCCN1CC[C@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500816	DG	On-Demand	Anodyne	DRD4	18	48
O=C(CCCN1CC[C@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500816	DG	On-Demand	Anodyne	HTR2A	19	48
O=C(CCCN1CC[C@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500816	DG	On-Demand	Anodyne	HTR2C	21	51
O=C(CCCN1CC[C@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500816	DG	On-Demand	Anodyne	SLC6A1	65	38
O=C(CCCN1CC[C@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500816	DG	On-Demand	Anodyne	HTR7	16	43
O=C(CCCN1CC[C@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500816	DG	On-Demand	Anodyne	CCR3	21	42
O=C(CCCN1CC[C@H](Oc2ccncc2)C1)c1ccccc1	ZINC000450500816	DG	On-Demand	Anodyne	CYP2J2	65	46
CCCCCN(CC(N)=O)C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450500820	FE	On-Demand	Anodyne	P2RY12	91	36
CCCCCN(CC(N)=O)C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450500821	FE	On-Demand	Anodyne	P2RY12	91	36
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)[C@@H](C)C1	ZINC000450500822	EG	On-Demand	Anodyne	PDE3A	48	36
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)[C@@H](C)C1	ZINC000450500823	EG	On-Demand	Anodyne	PDE3A	48	36
O=C(CC1(O)CCC1)Nc1ccc2[nH]nc(NC(=O)CC3(O)CCC3)c2c1	ZINC000450500824	FE	On-Demand	Anodyne	GSK3A	35	45
O=C(CC1(O)CCC1)Nc1ccc2[nH]nc(NC(=O)CC3(O)CCC3)c2c1	ZINC000450500824	FE	On-Demand	Anodyne	CDK1	23	43
O=C(CC1(O)CCC1)Nc1ccc2[nH]nc(NC(=O)CC3(O)CCC3)c2c1	ZINC000450500824	FE	On-Demand	Anodyne	TTK	27	44
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)[C@H](C)C1	ZINC000450500826	EG	On-Demand	Anodyne	PDE3A	48	36
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)[C@H](C)C1	ZINC000450500827	EG	On-Demand	Anodyne	PDE3A	48	36
CC1(C#N)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450500828	FH	On-Demand	Mild	PDE6D	65	39
CC1(C#N)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450500828	FH	On-Demand	Mild	IMDH_CRYPV	30	47
CC1(C#N)CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450500840	FF	On-Demand	Mild	HTR1D	15	45
CC1(C#N)CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450500840	FF	On-Demand	Mild	HTR1B	18	45
CC1(C#N)CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450500840	FF	On-Demand	Mild	TRPV4	41	32
CC1(C#N)CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450500840	FF	On-Demand	Mild	GPR183	0	42
CC(F)(F)c1ccc(C(=O)N2CCC(CCCN3CCOCC3)CC2)cn1	ZINC000450500843	GG	On-Demand	Anodyne	HRH3	15	44
CC(F)(F)c1ccc(C(=O)N2CCC(CCCN3CCOCC3)CC2)cn1	ZINC000450500843	GG	On-Demand	Anodyne	SFRP1	27	41
COc1ccc(CNC(=O)CCN(CC(N)=O)C(C)(C)C)c(OC)c1	ZINC000450500856	FD	On-Demand	Anodyne	MTNR1A	57	38
COc1ccc(CNC(=O)CCN(CC(N)=O)C(C)(C)C)c(OC)c1	ZINC000450500856	FD	On-Demand	Anodyne	MTNR1B	42	35
COc1ccc(CNC(=O)CCN(CC(N)=O)C(C)(C)C)c(OC)c1	ZINC000450500856	FD	On-Demand	Anodyne	MT-ND1	22	40
CC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@H]1N1CCOCC1	ZINC000450500858	EF	On-Demand	Anodyne	KCNB1	0	40
CC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@H]1N1CCOCC1	ZINC000450500859	EF	On-Demand	Anodyne	KCNB1	0	40
CC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1N1CCOCC1	ZINC000450500860	EF	On-Demand	Anodyne	KCNB1	0	40
CC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1N1CCOCC1	ZINC000450500861	EF	On-Demand	Anodyne	KCNB1	0	40
CC(F)(F)c1ccc(C(=O)NCCNC(=O)c2cc[nH]n2)cn1	ZINC000450500872	DD	On-Demand	Anodyne	EPHX2	0	40
Cc1nc(C2CC2)ccc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450500880	FH	On-Demand	Bother	SLC27A4	48	32
O=C(NCC(=O)N1CCOC[C@@H]1c1ncon1)Nc1cccc(Cl)c1	ZINC000450500888	FD	On-Demand	Anodyne	EPHX2	21	41
O=C(NCC(=O)N1CCOC[C@H]1c1ncon1)Nc1cccc(Cl)c1	ZINC000450500892	FD	On-Demand	Anodyne	EPHX2	21	41
CC(=O)c1nc(N2CC[C@@H](Oc3cccnc3N(C)C)C2)sc1C	ZINC000450500912	EF	On-Demand	Anodyne	SCD	22	42
CC(=O)c1nc(N2CC[C@H](Oc3cccnc3N(C)C)C2)sc1C	ZINC000450500913	EF	On-Demand	Anodyne	SCD	22	42
CN1CCC(C)(CNC(=O)c2ccccc2-n2cc(Br)cn2)CC1	ZINC000450500922	GG	On-Demand	Anodyne	HCN1	78	40
CN1CCC(C)(CNC(=O)c2ccccc2-n2cc(Br)cn2)CC1	ZINC000450500922	GG	On-Demand	Anodyne	HCN4	51	33
CCOC(=O)c1csc(N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)n1	ZINC000450500934	FE	On-Demand	Anodyne	TRPC6	56	36
C[C@H](CN(Cc1ccccc1)C(=O)Cc1ccc(F)cc1Cl)C(=O)O	ZINC000450500935	FH	On-Demand	Anodyne	P2RX7	46	39
C[C@@H](CN(Cc1ccccc1)C(=O)Cc1ccc(F)cc1Cl)C(=O)O	ZINC000450500936	FH	On-Demand	Anodyne	P2RX7	46	39
CC[C@H]1CN(CCN(C)Cc2ccccc2)C[C@@H]1N1CCOCC1	ZINC000450500942	EE	On-Demand	Anodyne	SIGMAR1	17	41
CC[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@@H]1N1CCOCC1	ZINC000450500943	EE	On-Demand	Anodyne	SIGMAR1	17	41
CC[C@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1N1CCOCC1	ZINC000450500944	EE	On-Demand	Anodyne	SIGMAR1	17	41
CC[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1N1CCOCC1	ZINC000450500945	EE	On-Demand	Anodyne	SIGMAR1	17	41
Cc1ccc(Br)cc1CC(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450500946	GI	On-Demand	Anodyne	MAP3K7	49	35
CN(CCCN1CCCC1)c1ccc2nncn2n1	ZINC000450500947	CD	On-Demand	Anodyne	HNMT	19	40
CN1CCC(C)(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450500948	FH	On-Demand	Anodyne	RBP4	71	42
C[C@@H](CN(Cc1ccccc1)C(=O)Cc1ccccc1S(C)(=O)=O)C(=O)O	ZINC000450500957	GE	On-Demand	Anodyne	MME	48	35
C[C@@H](CN(Cc1ccccc1)C(=O)Cc1ccccc1S(C)(=O)=O)C(=O)O	ZINC000450500957	GE	On-Demand	Anodyne	ACE2	43	33
C[C@H](CN(Cc1ccccc1)C(=O)Cc1ccccc1S(C)(=O)=O)C(=O)O	ZINC000450500958	GE	On-Demand	Anodyne	MME	48	35
C[C@H](CN(Cc1ccccc1)C(=O)Cc1ccccc1S(C)(=O)=O)C(=O)O	ZINC000450500958	GE	On-Demand	Anodyne	ACE2	43	33
Cc1ccccc1[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])c(C)n2)C1	ZINC000450500963	CG	On-Demand	Bother	PRKCQ	25	40
CN1CCC[C@@H]2CN(CC/C=C\c3ccccc3)CC[C@H]21	ZINC000450500973	CH	On-Demand	Anodyne	SLC6A1	70	37
CN1CCC[C@@H]2CN(CC/C=C\c3ccccc3)CC[C@@H]21	ZINC000450500974	CH	On-Demand	Anodyne	SLC6A1	70	37
CN1CCC[C@@H]2CN(CC/C=C/c3ccccc3)CC[C@@H]21	ZINC000450500975	CH	On-Demand	Anodyne	SLC6A1	70	37
CN1CCC[C@@H]2CN(CC/C=C/c3ccccc3)CC[C@H]21	ZINC000450500976	CH	On-Demand	Anodyne	SLC6A1	70	37
CCOC(=O)c1ccc(CN2CCN(C(=O)[C@@H]3CCCN3C)CC2)nc1	ZINC000450500977	FC	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CCN(C(=O)[C@H]3CCCN3C)CC2)nc1	ZINC000450500978	FC	On-Demand	Anodyne	SSTR5	42	35
COC(=O)c1ccc(CN2CC[C@]3(O)CCCC[C@H]3C2)cc1Cl	ZINC000450500979	EG	On-Demand	Anodyne	OPRK1	26	43
COC(=O)c1ccc(CN2CC[C@@]3(O)CCCC[C@@H]3C2)cc1Cl	ZINC000450500980	EG	On-Demand	Anodyne	OPRK1	26	43
COC(=O)c1ccc(CN2CC[C@@]3(O)CCCC[C@H]3C2)cc1Cl	ZINC000450500981	EG	On-Demand	Anodyne	OPRK1	26	43
COC(=O)c1ccc(CN2CC[C@]3(O)CCCC[C@@H]3C2)cc1Cl	ZINC000450500982	EG	On-Demand	Anodyne	OPRK1	26	43
COC(=O)[C@@H](C)N(C)c1nc(-c2ccc(OC)cc2)no1	ZINC000450501013	CD	On-Demand	Anodyne	LUCI_PHOPE	17	42
COC(=O)[C@H](C)N(C)c1nc(-c2ccc(OC)cc2)no1	ZINC000450501014	CD	On-Demand	Anodyne	LUCI_PHOPE	17	42
COc1cc(CC(=O)N2CC3(CCCCC3)C2)ccc1Cl	ZINC000450501025	DH	On-Demand	Anodyne	CCR1	30	40
COc1cc(CC(=O)N2CC3(CCCCC3)C2)ccc1Cl	ZINC000450501025	DH	On-Demand	Anodyne	GHSR	0	41
COc1ccc(CNC(=O)CCN2CC[C@H]3[C@@H](CCCN3C)C2)c(OC)c1	ZINC000450501029	GE	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CC[C@H]3[C@@H](CCCN3C)C2)c(OC)c1	ZINC000450501029	GE	On-Demand	Anodyne	HTR7	30	41
COc1ccc(CNC(=O)CCN2CC[C@H]3[C@@H](CCCN3C)C2)c(OC)c1	ZINC000450501029	GE	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(CNC(=O)CCN2CC[C@@H]3[C@H](CCCN3C)C2)c(OC)c1	ZINC000450501030	GE	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CC[C@@H]3[C@H](CCCN3C)C2)c(OC)c1	ZINC000450501030	GE	On-Demand	Anodyne	HTR7	30	41
COc1ccc(CNC(=O)CCN2CC[C@@H]3[C@H](CCCN3C)C2)c(OC)c1	ZINC000450501030	GE	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(CNC(=O)CCN2CC[C@H]3[C@H](CCCN3C)C2)c(OC)c1	ZINC000450501031	GE	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CC[C@H]3[C@H](CCCN3C)C2)c(OC)c1	ZINC000450501031	GE	On-Demand	Anodyne	HTR7	30	41
COc1ccc(CNC(=O)CCN2CC[C@H]3[C@H](CCCN3C)C2)c(OC)c1	ZINC000450501031	GE	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(CNC(=O)CCN2CC[C@@H]3[C@@H](CCCN3C)C2)c(OC)c1	ZINC000450501032	GE	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CC[C@@H]3[C@@H](CCCN3C)C2)c(OC)c1	ZINC000450501032	GE	On-Demand	Anodyne	HTR7	30	41
COc1ccc(CNC(=O)CCN2CC[C@@H]3[C@@H](CCCN3C)C2)c(OC)c1	ZINC000450501032	GE	On-Demand	Anodyne	ACKR3	42	32
CCc1cc(CCCN2CCN(Cc3cccc(F)c3)CC2)on1	ZINC000450501039	EG	On-Demand	Anodyne	SIGMAR1	24	44
Cc1cccc(Cl)c1CN1CCn2c(nnc2-c2cccnc2)C1	ZINC000450501083	EG	On-Demand	Anodyne	P2RX7	0	47
COc1cc(CN2CCn3c(nnc3C3CCCC3)C2)ccc1Cl	ZINC000450501089	EH	On-Demand	Anodyne	SSTR5	42	36
COc1ccc(-c2ccnc(NCC3CCC(C#N)CC3)n2)cc1	ZINC000450501104	DH	On-Demand	Mild	CLK4	24	51
COc1ccc(-c2ccnc(NCC3CCC(C#N)CC3)n2)cc1	ZINC000450501104	DH	On-Demand	Mild	VCP	55	51
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccccc1	ZINC000450501123	EG	On-Demand	Anodyne	HTR3B	0	41
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccccc1	ZINC000450501123	EG	On-Demand	Anodyne	CYP2J2	57	40
COc1cc(CN2CCC[C@@H]2CSC)ccc1Cl	ZINC000450501131	CH	On-Demand	Anodyne	DRD2	36	40
COc1cc(CN2CCC[C@H]2CSC)ccc1Cl	ZINC000450501133	CH	On-Demand	Anodyne	DRD2	36	40
C[C@H](c1ccc(CN2CCO[C@@H](c3cccc(O)c3)C2)cc1)C(F)(F)F	ZINC000450501135	FJ	On-Demand	Anodyne	OPRM1	15	42
C[C@H](c1ccc(CN2CCO[C@@H](c3cccc(O)c3)C2)cc1)C(F)(F)F	ZINC000450501135	FJ	On-Demand	Anodyne	OPRK1	16	42
C[C@@H](c1ccc(CN2CCO[C@@H](c3cccc(O)c3)C2)cc1)C(F)(F)F	ZINC000450501139	FJ	On-Demand	Anodyne	OPRM1	15	42
C[C@@H](c1ccc(CN2CCO[C@@H](c3cccc(O)c3)C2)cc1)C(F)(F)F	ZINC000450501139	FJ	On-Demand	Anodyne	OPRK1	16	42
C[C@H](c1ccc(CN2CCO[C@H](c3cccc(O)c3)C2)cc1)C(F)(F)F	ZINC000450501140	FJ	On-Demand	Anodyne	OPRM1	15	42
C[C@H](c1ccc(CN2CCO[C@H](c3cccc(O)c3)C2)cc1)C(F)(F)F	ZINC000450501140	FJ	On-Demand	Anodyne	OPRK1	16	42
C[C@@H](c1ccc(CN2CCO[C@H](c3cccc(O)c3)C2)cc1)C(F)(F)F	ZINC000450501141	FJ	On-Demand	Anodyne	OPRM1	15	42
C[C@@H](c1ccc(CN2CCO[C@H](c3cccc(O)c3)C2)cc1)C(F)(F)F	ZINC000450501141	FJ	On-Demand	Anodyne	OPRK1	16	42
O=C(c1ccc2c(c1)OC(F)(F)O2)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450501142	FG	On-Demand	Anodyne	MAP3K7	45	31
O=C(c1ccc2c(c1)OC(F)(F)O2)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450501142	FG	On-Demand	Anodyne	L3MBTL3	59	36
COc1cc(Cl)c(C(=O)N[C@H](CC(C)C)C(=O)O)cc1OC	ZINC000450501143	EF	On-Demand	Anodyne	FOLH1	60	47
COc1cc(Cl)c(C(=O)N[C@H](CC(C)C)C(=O)O)cc1OC	ZINC000450501143	EF	On-Demand	Anodyne	CCKAR	22	45
COc1cc(Cl)c(C(=O)N[C@@H](CC(C)C)C(=O)O)cc1OC	ZINC000450501144	EF	On-Demand	Anodyne	FOLH1	60	47
COc1cc(Cl)c(C(=O)N[C@@H](CC(C)C)C(=O)O)cc1OC	ZINC000450501144	EF	On-Demand	Anodyne	CCKAR	22	45
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501151	GH	On-Demand	Anodyne	ACE	22	41
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501151	GH	On-Demand	Anodyne	PPARA	19	40
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501151	GH	On-Demand	Anodyne	MME	39	44
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501151	GH	On-Demand	Anodyne	ECE1	15	41
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501151	GH	On-Demand	Anodyne	ACE2	41	32
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501151	GH	On-Demand	Anodyne	HCRTR2	23	40
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501151	GH	On-Demand	Anodyne	PTGES	23	42
COCCn1cc(CNc2ncnc3cc(Br)ccc23)cn1	ZINC000450501154	FE	On-Demand	Anodyne	EGFR	57	43
COCCn1cc(CNc2ncnc3cc(Br)ccc23)cn1	ZINC000450501154	FE	On-Demand	Anodyne	CLK4	48	36
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501155	GH	On-Demand	Anodyne	ACE	22	41
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501155	GH	On-Demand	Anodyne	PPARA	19	40
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501155	GH	On-Demand	Anodyne	MME	39	44
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501155	GH	On-Demand	Anodyne	ECE1	15	41
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501155	GH	On-Demand	Anodyne	ACE2	41	32
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501155	GH	On-Demand	Anodyne	HCRTR2	23	40
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501155	GH	On-Demand	Anodyne	PTGES	23	42
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501156	GH	On-Demand	Anodyne	ACE	22	41
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501156	GH	On-Demand	Anodyne	PPARA	19	40
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501156	GH	On-Demand	Anodyne	MME	39	44
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501156	GH	On-Demand	Anodyne	ECE1	15	41
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501156	GH	On-Demand	Anodyne	ACE2	41	32
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501156	GH	On-Demand	Anodyne	HCRTR2	23	40
COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501156	GH	On-Demand	Anodyne	PTGES	23	42
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501157	GH	On-Demand	Anodyne	ACE	22	41
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501157	GH	On-Demand	Anodyne	PPARA	19	40
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501157	GH	On-Demand	Anodyne	MME	39	44
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501157	GH	On-Demand	Anodyne	ECE1	15	41
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501157	GH	On-Demand	Anodyne	ACE2	41	32
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501157	GH	On-Demand	Anodyne	HCRTR2	23	40
COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501157	GH	On-Demand	Anodyne	PTGES	23	42
CN(Cc1cnc(N(C)C)nc1)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450501165	FE	On-Demand	Anodyne	TSPO	16	40
CCCn1c(C(=O)NC(C)(C)CCC(=O)O)cc2ccccc21	ZINC000450501169	DG	On-Demand	Anodyne	ECE1	26	41
Cc1sccc1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450501180	DG	On-Demand	Anodyne	MAP3K7	47	34
Cc1sccc1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450501180	DG	On-Demand	Anodyne	L3MBTL3	51	37
C/C=C\COc1cccc(CC(=O)N2CCC(C)(C#N)CC2)c1	ZINC000450501197	DG	On-Demand	Mild	GPR183	0	41
CCOC(=O)c1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1	ZINC000450501217	FG	On-Demand	Bother	CACNA1C	68	45
CCOC(=O)c1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1	ZINC000450501217	FG	On-Demand	Bother	CACNA1D	92	41
CC(C)(C(=O)N1CCC(n2cc(Cl)cn2)CC1)C1CCC1	ZINC000450501218	DH	On-Demand	Anodyne	MAP3K7	45	31
CN(C)S(=O)(=O)CC(=O)N(CC(=O)O)Cc1ccc(Cl)cc1	ZINC000450501221	EC	On-Demand	Anodyne	FFAR2	35	40
C[C@H](Oc1ccccn1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450501226	FE	On-Demand	Anodyne	HTR4	36	41
C[C@@H](Oc1ccccn1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450501227	FE	On-Demand	Anodyne	HTR4	36	41
Cc1nc(NCCN(C)S(=O)(=O)c2ccc(F)cc2)ncc1[N+](=O)[O-]	ZINC000450501232	FC	On-Demand	Bother	PRKCQ	29	40
COC(=O)c1csc(CN2CCC[C@@H]2CCCc2ccccc2)n1	ZINC000450501238	EH	On-Demand	Anodyne	SLC18A2	33	41
COC(=O)c1csc(CN2CCC[C@@H]2CCCc2ccccc2)n1	ZINC000450501238	EH	On-Demand	Anodyne	PREP	53	38
COC(=O)c1csc(CN2CCC[C@H]2CCCc2ccccc2)n1	ZINC000450501239	EH	On-Demand	Anodyne	SLC18A2	33	41
COC(=O)c1csc(CN2CCC[C@H]2CCCc2ccccc2)n1	ZINC000450501239	EH	On-Demand	Anodyne	PREP	53	38
COc1ccc(CC(=O)N2CCC(n3cc(Cl)cn3)CC2)c(Cl)c1OC	ZINC000450501243	GH	On-Demand	Anodyne	MAP3K7	46	33
COc1ccc(OC(F)(F)F)c(C(=O)NCC2(C)CCN(C)CC2)c1	ZINC000450501252	FG	On-Demand	Anodyne	MMP2	17	40
COc1ccc(OC(F)(F)F)c(C(=O)NCC2(C)CCN(C)CC2)c1	ZINC000450501252	FG	On-Demand	Anodyne	SLC6A9	18	41
COc1ccc(OC(F)(F)F)c(C(=O)NCC2(C)CCN(C)CC2)c1	ZINC000450501252	FG	On-Demand	Anodyne	HCN1	58	40
C=C(C)[C@@H]1OCC[C@H]1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450501254	DF	On-Demand	Mild	ADRA2A	17	52
C=C(C)[C@@H]1OCC[C@@H]1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450501255	DF	On-Demand	Mild	ADRA2A	17	52
C=C(C)[C@H]1OCC[C@@H]1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450501256	DF	On-Demand	Mild	ADRA2A	17	52
C=C(C)[C@H]1OCC[C@H]1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450501257	DF	On-Demand	Mild	ADRA2A	17	52
COC1(CNC(=O)COc2ccc(C#N)c(Br)c2)CCC1	ZINC000450501264	FE	On-Demand	Mild	TRPV4	42	33
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450501268	CG	On-Demand	Anodyne	TYK2	70	42
CN1CCC[C@@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501279	FE	On-Demand	Anodyne	HTR1A	23	60
CN1CCC[C@@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501279	FE	On-Demand	Anodyne	DRD2	35	47
CN1CCC[C@@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501279	FE	On-Demand	Anodyne	DRD1	27	52
CN1CCC[C@@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501279	FE	On-Demand	Anodyne	HTR2A	35	51
CN1CCC[C@@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501279	FE	On-Demand	Anodyne	HTR2C	28	58
CN1CCC[C@@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501279	FE	On-Demand	Anodyne	ERG2	22	47
CN1CCC[C@@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501279	FE	On-Demand	Anodyne	HTR7	28	47
CN1CCC[C@@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501279	FE	On-Demand	Anodyne	CYP2J2	58	41
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	HTR1A	26	60
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	DRD2	35	47
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	DRD1	27	52
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	DRD4	26	52
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	HTR2A	41	52
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	HTR2C	28	58
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	ADRA1B	17	47
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	DRD3	21	52
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	ERG2	22	47
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	HTR7	35	47
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	HRH3	18	43
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	SIGMAR1	20	55
CN1CCC[C@H]1C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450501280	FE	On-Demand	Anodyne	CYP2J2	58	41
COC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1Cl	ZINC000450501281	DH	On-Demand	Anodyne	DRD4	39	40
COC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1Cl	ZINC000450501281	DH	On-Demand	Anodyne	HRH1	24	41
COC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1Cl	ZINC000450501281	DH	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1Cl	ZINC000450501281	DH	On-Demand	Anodyne	SIGMAR1	38	44
COC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1Cl	ZINC000450501281	DH	On-Demand	Anodyne	SSTR5	65	40
COC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1Cl	ZINC000450501281	DH	On-Demand	Anodyne	CCR3	51	41
COC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1Cl	ZINC000450501281	DH	On-Demand	Anodyne	MCHR1	45	47
COC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1Cl	ZINC000450501281	DH	On-Demand	Anodyne	CACNA1I	33	40
CCOC(=O)CC(C)(C)N(C)C(=O)Cc1cc2ccccc2s1	ZINC000450501290	EH	On-Demand	Anodyne	LTB4R	0	43
Cc1ccc(C)c(N2CCN(C[C@H]3COCCO3)CC2)c1	ZINC000450501291	CD	On-Demand	Anodyne	ADRA1D	15	44
Cc1ccc(C)c(N2CCN(C[C@@H]3COCCO3)CC2)c1	ZINC000450501292	CD	On-Demand	Anodyne	ADRA1D	15	44
CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCCC(C)C)c1	ZINC000450501298	DJ	On-Demand	Anodyne	MSR1	0	50
COc1ccc(C(=O)NCCC(=O)O)c(OC2CCCC2)c1	ZINC000450501305	DE	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(C(=O)NCCC(=O)O)c(OC2CCCC2)c1	ZINC000450501305	DE	On-Demand	Anodyne	MTNR1B	41	34
COc1cc(CN2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)ccc1Cl	ZINC000450501313	GD	On-Demand	Anodyne	ADORA2B	44	36
COc1cc(CN2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)ccc1Cl	ZINC000450501313	GD	On-Demand	Anodyne	SSTR5	49	37
O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)[C@@H](O)C1CCC1	ZINC000450501322	EE	On-Demand	Anodyne	ENV	44	34
O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)[C@H](O)C1CCC1	ZINC000450501323	EE	On-Demand	Anodyne	ENV	44	34
O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)[C@@H](O)C1CCC1	ZINC000450501324	EE	On-Demand	Anodyne	ENV	44	34
O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)[C@H](O)C1CCC1	ZINC000450501325	EE	On-Demand	Anodyne	ENV	44	34
CCC(=O)CCCN1CCN(C2CCCCC2)CC1	ZINC000450501330	CF	On-Demand	Anodyne	EBP	19	53
COc1cccc([C@H]2CN(C[C@H](Cc3ccccc3)OC)CCO2)c1	ZINC000450501341	EG	On-Demand	Anodyne	VACHT_TETCF	0	48
COc1cccc([C@H]2CN(C[C@@H](Cc3ccccc3)OC)CCO2)c1	ZINC000450501342	EG	On-Demand	Anodyne	VACHT_TETCF	0	48
COc1cccc([C@@H]2CN(C[C@@H](Cc3ccccc3)OC)CCO2)c1	ZINC000450501343	EG	On-Demand	Anodyne	VACHT_TETCF	0	48
COc1cccc([C@@H]2CN(C[C@H](Cc3ccccc3)OC)CCO2)c1	ZINC000450501344	EG	On-Demand	Anodyne	VACHT_TETCF	0	48
CCOc1ccc(NC(=O)CN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450501352	GH	On-Demand	Anodyne	LTA4H	58	46
CCOc1ccc(NC(=O)CN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450501352	GH	On-Demand	Anodyne	KCNA5	0	57
CCOc1ccc(NC(=O)CN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450501352	GH	On-Demand	Anodyne	ACOX1	37	40
CCOc1ccc(NC(=O)CN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450501352	GH	On-Demand	Anodyne	CHRNA7	20	41
CCOc1ccc(NC(=O)CN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450501352	GH	On-Demand	Anodyne	NOD2	33	43
CCOc1ccc(NC(=O)CN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450501353	GH	On-Demand	Anodyne	LTA4H	58	46
CCOc1ccc(NC(=O)CN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450501353	GH	On-Demand	Anodyne	KCNA5	0	57
CCOc1ccc(NC(=O)CN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450501353	GH	On-Demand	Anodyne	ACOX1	37	40
CCOc1ccc(NC(=O)CN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450501353	GH	On-Demand	Anodyne	CHRNA7	20	41
CCOc1ccc(NC(=O)CN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450501353	GH	On-Demand	Anodyne	NOD2	33	43
CN(CCN1CCC(C(F)F)CC1)Cc1ccccc1	ZINC000450501354	CG	On-Demand	Anodyne	DRD2	24	41
CN(CCN1CCC(C(F)F)CC1)Cc1ccccc1	ZINC000450501354	CG	On-Demand	Anodyne	SIGMAR1	79	49
CN(CCN1CCC(C(F)F)CC1)Cc1ccccc1	ZINC000450501354	CG	On-Demand	Anodyne	CCR5	60	42
COC(=O)c1ccc(CNC(=O)c2cncc(Cl)c2)nc1C1CC1	ZINC000450501355	EF	On-Demand	Anodyne	SCN10A	44	41
COC(=O)c1ccc(CNC(=O)c2cncc(Cl)c2)nc1C1CC1	ZINC000450501355	EF	On-Demand	Anodyne	CACNA1I	41	31
O=C(CC1CC(F)(F)C1)Nc1cc(C(F)(F)F)ccn1	ZINC000450501361	CG	On-Demand	Anodyne	TYK2	49	33
COc1cnccc1N1CCN(c2nccc(C#N)n2)CC1	ZINC000450501362	CD	On-Demand	Mild	TNIK	45	36
CCOC(=O)c1ccc(CN2CC[C@H](Oc3ccncc3)C2)nc1	ZINC000450501364	EE	On-Demand	Anodyne	SSTR5	43	34
CC[C@H](CC(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450501399	CD	On-Demand	Anodyne	CAPN2	61	34
CC[C@@H](CC(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450501400	CD	On-Demand	Anodyne	CAPN2	61	34
C[S@](=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450501402	DG	On-Demand	Anodyne	HRP1_PLAFA	99	37
C[S@](=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450501402	DG	On-Demand	Anodyne	HNMT	44	34
C[S@@](=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450501403	DG	On-Demand	Anodyne	HRP1_PLAFA	99	37
C[S@@](=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450501403	DG	On-Demand	Anodyne	HNMT	44	34
O=C(O)CC[C@@H](NC(=O)CCCc1cc(F)ccc1F)c1ccccc1	ZINC000450501408	FI	On-Demand	Anodyne	PTGER3	49	37
O=C(O)CC[C@H](NC(=O)CCCc1cc(F)ccc1F)c1ccccc1	ZINC000450501409	FI	On-Demand	Anodyne	PTGER3	49	37
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1nnc2n1CCCC2	ZINC000450501442	DF	On-Demand	Anodyne	SORT1	18	45
C[C@@H]1NC(=O)CC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450501450	EE	On-Demand	Anodyne	EGFR	44	36
C[C@@H]1NC(=O)CC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450501450	EE	On-Demand	Anodyne	CD38	56	41
C[C@H]1NC(=O)CC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450501451	EE	On-Demand	Anodyne	EGFR	44	36
C[C@H]1NC(=O)CC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450501451	EE	On-Demand	Anodyne	CD38	56	41
C[C@@H]1NC(=O)CC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450501452	EE	On-Demand	Anodyne	EGFR	44	36
C[C@@H]1NC(=O)CC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450501452	EE	On-Demand	Anodyne	CD38	56	41
C[C@H]1NC(=O)CC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450501453	EE	On-Demand	Anodyne	EGFR	44	36
C[C@H]1NC(=O)CC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450501453	EE	On-Demand	Anodyne	CD38	56	41
CC(C)CCCC(=O)Nc1nnc2n1CCCC2	ZINC000450501459	CE	On-Demand	Anodyne	TNKS2	18	45
C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@H]1CCCOC1	ZINC000450501462	FG	On-Demand	Anodyne	PRCP	18	46
C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@@H]1CCCOC1	ZINC000450501463	FG	On-Demand	Anodyne	PRCP	18	46
CCS(=O)(=O)c1ccc(CN2CCO[C@H](c3cccc(O)c3)C2)cc1	ZINC000450501468	FF	On-Demand	Anodyne	OPRK1	15	41
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](c3cccc(O)c3)C2)cc1	ZINC000450501469	FF	On-Demand	Anodyne	OPRK1	15	41
COc1ccccc1CCNC(=O)CNc1ncc([N+](=O)[O-])c(C)n1	ZINC000450501472	ED	On-Demand	Bother	PRKCQ	30	49
Cc1cc(F)c(CC(=O)N2CCC(n3cc(Cl)cn3)CC2)cc1F	ZINC000450501485	FH	On-Demand	Anodyne	MAP3K7	40	33
C[C@H](CN(Cc1ccccc1)C(=O)c1cccc(C(F)F)c1)C(=O)O	ZINC000450501486	EH	On-Demand	Anodyne	OPRD1	16	41
C[C@H](CN(Cc1ccccc1)C(=O)c1cccc(C(F)F)c1)C(=O)O	ZINC000450501486	EH	On-Demand	Anodyne	SLC22A7	0	41
C[C@@H](CN(Cc1ccccc1)C(=O)c1cccc(C(F)F)c1)C(=O)O	ZINC000450501487	EH	On-Demand	Anodyne	OPRD1	16	41
C[C@@H](CN(Cc1ccccc1)C(=O)c1cccc(C(F)F)c1)C(=O)O	ZINC000450501487	EH	On-Demand	Anodyne	SLC22A7	0	41
Cc1ccc(C(=O)N2CCC(CCCN3CCOCC3)CC2)c2c1CCC2	ZINC000450501489	FG	On-Demand	Anodyne	L3MBTL1	0	40
Cc1ccc(C(=O)N2CCC(CCCN3CCOCC3)CC2)c2c1CCC2	ZINC000450501489	FG	On-Demand	Anodyne	L3MBTL3	54	38
N#CC1(CN2CCO[C@H](c3cccc(O)c3)C2)CCC1	ZINC000450501490	CE	On-Demand	Mild	OPRM1	15	40
N#CC1(CN2CCO[C@@H](c3cccc(O)c3)C2)CCC1	ZINC000450501491	CE	On-Demand	Mild	OPRM1	15	40
COc1cccc(CCC(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)c1F	ZINC000450501494	FH	On-Demand	Anodyne	ABCB1	0	42
COc1cccc(CCC(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)c1F	ZINC000450501494	FH	On-Demand	Anodyne	PTGES	0	42
COc1cccc(CCC(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)c1F	ZINC000450501495	FH	On-Demand	Anodyne	ABCB1	0	42
COc1cccc(CCC(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)c1F	ZINC000450501495	FH	On-Demand	Anodyne	PTGES	0	42
CC[C@H](C)[C@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450501496	CB	On-Demand	Anodyne	ENPEP	66	43
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H](C)Cc1ccc(O)cc1	ZINC000450501509	DG	On-Demand	Anodyne	ACE	15	42
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H](C)Cc1ccc(O)cc1	ZINC000450501509	DG	On-Demand	Anodyne	MME	20	42
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H](C)Cc1ccc(O)cc1	ZINC000450501510	DG	On-Demand	Anodyne	ACE	15	42
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H](C)Cc1ccc(O)cc1	ZINC000450501510	DG	On-Demand	Anodyne	MME	20	42
C[C@@H](Cc1ccc(O)cc1)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450501511	DG	On-Demand	Anodyne	ACE	15	42
C[C@@H](Cc1ccc(O)cc1)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450501511	DG	On-Demand	Anodyne	MME	20	42
C[C@@H](Cc1ccc(O)cc1)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450501512	DG	On-Demand	Anodyne	ACE	15	42
C[C@@H](Cc1ccc(O)cc1)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450501512	DG	On-Demand	Anodyne	MME	20	42
CN1CCC(C)(CNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450501517	FG	On-Demand	Anodyne	SLC6A1	22	40
CCS(=O)(=O)c1cccc(CNc2nc(N(C)C)c3ccccc3n2)c1	ZINC000450501518	FF	On-Demand	Anodyne	ADRA2A	17	51
CCS(=O)(=O)c1cccc(CNc2nc(N(C)C)c3ccccc3n2)c1	ZINC000450501518	FF	On-Demand	Anodyne	NPY2R	15	51
CCS(=O)(=O)c1cccc(CNc2nc(N(C)C)c3ccccc3n2)c1	ZINC000450501518	FF	On-Demand	Anodyne	NPY5R	24	48
COC(=O)c1ccc(CN2CCO[C@@H](c3cccc(O)c3)C2)cc1Cl	ZINC000450501521	FG	On-Demand	Anodyne	DRD4	25	41
COC(=O)c1ccc(CN2CCO[C@@H](c3cccc(O)c3)C2)cc1Cl	ZINC000450501521	FG	On-Demand	Anodyne	DRD3	0	51
COC(=O)c1ccc(CN2CCO[C@H](c3cccc(O)c3)C2)cc1Cl	ZINC000450501522	FG	On-Demand	Anodyne	DRD4	25	41
COC(=O)c1ccc(CN2CCO[C@H](c3cccc(O)c3)C2)cc1Cl	ZINC000450501522	FG	On-Demand	Anodyne	DRD3	0	51
Cc1cccc2c1C[C@@H](C(=O)N1CCC(n3cc(Cl)cn3)CC1)O2	ZINC000450501528	EG	On-Demand	Anodyne	MAP3K7	46	35
Cc1cccc2c1C[C@H](C(=O)N1CCC(n3cc(Cl)cn3)CC1)O2	ZINC000450501529	EG	On-Demand	Anodyne	MAP3K7	46	35
O=C(c1cccc2c1CCCC2)N1CCC(CCCN2CCOCC2)CC1	ZINC000450501545	FH	On-Demand	Anodyne	CYP2J2	44	31
COc1cc(Cl)c(C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450501550	GH	On-Demand	Anodyne	PTGES	22	43
COc1cc(Cl)c(C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450501551	GH	On-Demand	Anodyne	PTGES	22	43
CN1CCC(C)(CNC(=O)c2ccsc2Br)CC1	ZINC000450501552	EF	On-Demand	Anodyne	HCN1	54	39
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](S(=O)(=O)N2CCCC2)C1	ZINC000450501562	FD	On-Demand	Anodyne	OPRK1	28	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](S(=O)(=O)N2CCCC2)C1	ZINC000450501562	FD	On-Demand	Anodyne	CCR5	44	37
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](S(=O)(=O)N2CCCC2)C1	ZINC000450501563	FD	On-Demand	Anodyne	OPRK1	28	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](S(=O)(=O)N2CCCC2)C1	ZINC000450501563	FD	On-Demand	Anodyne	CCR5	44	37
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@H]1CCCOC1	ZINC000450501564	FG	On-Demand	Anodyne	PRCP	18	46
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@@H]1CCCOC1	ZINC000450501565	FG	On-Demand	Anodyne	PRCP	18	46
CCCCCN(CC(N)=O)C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450501567	EG	On-Demand	Anodyne	PLM2_PLAFA	27	42
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450501584	FI	On-Demand	Anodyne	SLC16A1	46	32
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H]1CC12CCSCC2	ZINC000450501585	FI	On-Demand	Anodyne	SLC16A1	46	32
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H]1CC12CCSCC2	ZINC000450501586	FI	On-Demand	Anodyne	SLC16A1	46	32
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450501587	FI	On-Demand	Anodyne	SLC16A1	46	32
CN1CCO[C@@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501600	CD	On-Demand	Anodyne	DRD1	17	40
CN1CCO[C@@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501600	CD	On-Demand	Anodyne	DRD4	16	40
CN1CCO[C@@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501600	CD	On-Demand	Anodyne	HTR2A	16	45
CN1CCO[C@@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501600	CD	On-Demand	Anodyne	HTR2C	19	45
CN1CCO[C@@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501600	CD	On-Demand	Anodyne	DRD3	16	40
CN1CCO[C@@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501600	CD	On-Demand	Anodyne	CYP2J2	66	47
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@@H]21	ZINC000450501601	CD	On-Demand	Anodyne	DRD1	17	40
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@@H]21	ZINC000450501601	CD	On-Demand	Anodyne	DRD4	16	40
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@@H]21	ZINC000450501601	CD	On-Demand	Anodyne	HTR2A	16	45
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@@H]21	ZINC000450501601	CD	On-Demand	Anodyne	HTR2C	19	45
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@@H]21	ZINC000450501601	CD	On-Demand	Anodyne	DRD3	16	40
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@@H]21	ZINC000450501601	CD	On-Demand	Anodyne	CYP2J2	66	47
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501602	CD	On-Demand	Anodyne	DRD1	17	40
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501602	CD	On-Demand	Anodyne	DRD4	16	40
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501602	CD	On-Demand	Anodyne	HTR2A	16	45
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501602	CD	On-Demand	Anodyne	HTR2C	19	45
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501602	CD	On-Demand	Anodyne	DRD3	16	40
CN1CCO[C@H]2CN(CCCC(=O)c3ccccc3)C[C@H]21	ZINC000450501602	CD	On-Demand	Anodyne	CYP2J2	66	47
CC(C)c1nnc(N2CCC(N3CCc4ccccc43)CC2)o1	ZINC000450501605	DG	On-Demand	Anodyne	SCD1	21	41
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450501612	GI	On-Demand	Anodyne	MMP13	0	41
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450501613	GI	On-Demand	Anodyne	MMP13	0	41
CC[C@@](C)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450501614	CE	On-Demand	Anodyne	NCE103	26	47
CC[C@](C)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450501615	CE	On-Demand	Anodyne	NCE103	26	47
Cc1cc(OCc2ccccc2)nc(N2CCN(c3nccnc3C)CC2)n1	ZINC000450501617	GF	On-Demand	Anodyne	SORD	32	40
c1ccc2c(c1)CCN2C1CCN(c2nncs2)CC1	ZINC000450501625	CF	On-Demand	Anodyne	SCD1	17	43
Cc1ccnc(-c2noc(CN3CCN(c4cc(C)ccn4)CC3)n2)c1	ZINC000450501662	FE	On-Demand	Anodyne	DRD4	17	42
CC(C)(C(=O)Nc1cc(C(F)(F)F)ccn1)C1CCC1	ZINC000450501668	CH	On-Demand	Anodyne	TYK2	41	33
CC(C)(C(=O)Nc1cc(C(F)(F)F)ccn1)C1CCC1	ZINC000450501668	CH	On-Demand	Anodyne	MAP3K12	31	41
CCC[C@@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501690	GH	On-Demand	Anodyne	SLC6A1	23	55
CCC[C@@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501690	GH	On-Demand	Anodyne	SLC6A4	54	69
CCC[C@@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501690	GH	On-Demand	Anodyne	SLC6A3	87	71
CCC[C@@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501690	GH	On-Demand	Anodyne	CYP2D6	0	40
CCC[C@@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501690	GH	On-Demand	Anodyne	ABCB1	43	37
CCC[C@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501691	GH	On-Demand	Anodyne	SLC6A1	23	55
CCC[C@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501691	GH	On-Demand	Anodyne	SLC6A4	54	69
CCC[C@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501691	GH	On-Demand	Anodyne	SLC6A3	87	71
CCC[C@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501691	GH	On-Demand	Anodyne	CYP2D6	0	40
CCC[C@H](O)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450501691	GH	On-Demand	Anodyne	ABCB1	43	37
COC(=O)[C@H](C)N(C)c1nc2cc(C)cc(C)c2o1	ZINC000450501693	CE	On-Demand	Anodyne	CETP	0	40
COC(=O)[C@@H](C)N(C)c1nc2cc(C)cc(C)c2o1	ZINC000450501694	CE	On-Demand	Anodyne	CETP	0	40
COC1(CNC(=O)Cc2ccc(O)c(F)c2)CCC1	ZINC000450501700	CD	On-Demand	Anodyne	NCE103	26	42
COC1(CNC(=O)Cc2ccc(O)c(F)c2)CCC1	ZINC000450501700	CD	On-Demand	Anodyne	CAN2	0	42
C[C@@H]1Cc2cccc(C(=O)Nc3cc(C(F)(F)F)ccn3)c2O1	ZINC000450501701	DH	On-Demand	Anodyne	MTTP	50	37
C[C@@H]1Cc2cccc(C(=O)Nc3cc(C(F)(F)F)ccn3)c2O1	ZINC000450501701	DH	On-Demand	Anodyne	G2YM83_BOTF4	54	37
C[C@H]1Cc2cccc(C(=O)Nc3cc(C(F)(F)F)ccn3)c2O1	ZINC000450501702	DH	On-Demand	Anodyne	MTTP	45	36
C[C@H]1Cc2cccc(C(=O)Nc3cc(C(F)(F)F)ccn3)c2O1	ZINC000450501702	DH	On-Demand	Anodyne	G2YM83_BOTF4	54	37
CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCOc2cccc(OC)c2)c1	ZINC000450501704	GI	On-Demand	Anodyne	MTNR1A	53	58
CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCOc2cccc(OC)c2)c1	ZINC000450501704	GI	On-Demand	Anodyne	MTNR1B	52	60
CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCOc2cccc(OC)c2)c1	ZINC000450501704	GI	On-Demand	Anodyne	TAAR1	21	43
CCc1cc(CCCN2CCN(c3cc(C)ccn3)CC2)on1	ZINC000450501711	DF	On-Demand	Anodyne	DRD4	24	42
COC1(CNC(=O)c2cc(Cl)c(F)cc2Br)CCC1	ZINC000450501715	FH	On-Demand	Anodyne	SLC6A9	42	37
O=C(Nc1cc(C(F)(F)F)ccn1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450501716	GG	On-Demand	Anodyne	EPHX2	16	40
O=C(Nc1cc(C(F)(F)F)ccn1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450501716	GG	On-Demand	Anodyne	BRAF	31	47
O=C(Nc1cc(C(F)(F)F)ccn1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450501716	GG	On-Demand	Anodyne	MAP3K12	26	46
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	HTR1A	42	43
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	ADRA1D	31	43
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	ADRA1A	29	44
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	ADRA1B	23	43
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	AVPR1B	44	32
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	HTR4	55	40
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	HRP1_PLAFA	47	38
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	HTR7	47	36
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	COLA	91	41
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	CPT1A	85	41
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	CPT2	53	39
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	CPT1B	82	39
CCC(=O)CCCN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450501717	GE	On-Demand	Anodyne	PTGDR2	24	42
COc1cccc(OCCN2CCN(Cc3nnc(C4CC4)s3)CC2)c1	ZINC000450501724	FF	On-Demand	Anodyne	DRD4	40	30
Cc1nc(N[C@@H]2C[C@H]2C2CC2)ncc1[N+](=O)[O-]	ZINC000450501734	BD	On-Demand	Bother	PRKCQ	45	36
COc1cccc([C@@H]2CN(C[C@H](O)[C@H](C)c3ccccc3)CCO2)c1	ZINC000450501735	EG	On-Demand	Anodyne	CASR	0	41
COc1cccc([C@@H]2CN(C[C@H](O)[C@H](C)c3ccccc3)CCO2)c1	ZINC000450501735	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
COc1cccc([C@@H]2CN(C[C@@H](O)[C@@H](C)c3ccccc3)CCO2)c1	ZINC000450501736	EG	On-Demand	Anodyne	CASR	0	41
COc1cccc([C@@H]2CN(C[C@@H](O)[C@@H](C)c3ccccc3)CCO2)c1	ZINC000450501736	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
COc1cccc([C@@H]2CN(C[C@@H](O)[C@H](C)c3ccccc3)CCO2)c1	ZINC000450501737	EG	On-Demand	Anodyne	CASR	0	41
COc1cccc([C@@H]2CN(C[C@@H](O)[C@H](C)c3ccccc3)CCO2)c1	ZINC000450501737	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
COc1cccc([C@@H]2CN(C[C@H](O)[C@@H](C)c3ccccc3)CCO2)c1	ZINC000450501738	EG	On-Demand	Anodyne	CASR	0	41
COc1cccc([C@@H]2CN(C[C@H](O)[C@@H](C)c3ccccc3)CCO2)c1	ZINC000450501738	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
CCOC(=O)CC(C)(C)N(C)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450501753	EG	On-Demand	Anodyne	OPRK1	0	47
CCOC(=O)CC(C)(C)N(C)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450501753	EG	On-Demand	Anodyne	PDE6A	41	32
OC[C@@H](CNc1ccnc2cc(F)c(Cl)cc12)[C@@H]1CCOC1	ZINC000450501762	DG	On-Demand	Anodyne	HRP1_PLAFA	87	34
OC[C@@H](CNc1ccnc2cc(F)c(Cl)cc12)[C@@H]1CCOC1	ZINC000450501762	DG	On-Demand	Anodyne	HNMT	44	34
OC[C@H](CNc1ccnc2cc(F)c(Cl)cc12)[C@@H]1CCOC1	ZINC000450501763	DG	On-Demand	Anodyne	HRP1_PLAFA	87	34
OC[C@H](CNc1ccnc2cc(F)c(Cl)cc12)[C@@H]1CCOC1	ZINC000450501763	DG	On-Demand	Anodyne	HNMT	44	34
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](S(=O)(=O)N2CCCC2)C1	ZINC000450501764	FD	On-Demand	Anodyne	OPRK1	28	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](S(=O)(=O)N2CCCC2)C1	ZINC000450501764	FD	On-Demand	Anodyne	CCR5	44	37
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](S(=O)(=O)N2CCCC2)C1	ZINC000450501765	FD	On-Demand	Anodyne	OPRK1	28	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](S(=O)(=O)N2CCCC2)C1	ZINC000450501765	FD	On-Demand	Anodyne	CCR5	44	37
COc1cccc(-n2cc(C(=O)N(C)Cc3cnc(N(C)C)nc3)nn2)c1	ZINC000450501769	FD	On-Demand	Anodyne	ESRRA	21	40
COc1cccc(-n2cc(C(=O)N(C)Cc3cnc(N(C)C)nc3)nn2)c1	ZINC000450501769	FD	On-Demand	Anodyne	HSD17B2	22	41
COC(=O)c1cccc(CN(CCCO)Cc2ccccc2)c1Cl	ZINC000450501792	EH	On-Demand	Anodyne	NR1H3	15	41
CCOC(=O)c1cc(C(=O)N2CCC(CCCN3CCOCC3)CC2)[nH]c1C	ZINC000450501795	GE	On-Demand	Anodyne	AKR1C3	0	42
O=C(c1ccc2cnccc2c1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450501805	FG	On-Demand	Anodyne	HRH3	0	40
O=C(c1ccc2cnccc2c1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450501805	FG	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc2cnccc2c1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450501805	FG	On-Demand	Anodyne	L3MBTL3	42	40
C[C@@H]1Cc2cccc(C(=O)NCC3(C)CCN(C)CC3)c2O1	ZINC000450501807	DE	On-Demand	Anodyne	HCN1	55	34
C[C@@H]1Cc2cccc(C(=O)NCC3(C)CCN(C)CC3)c2O1	ZINC000450501807	DE	On-Demand	Anodyne	HCN4	53	34
C[C@H]1Cc2cccc(C(=O)NCC3(C)CCN(C)CC3)c2O1	ZINC000450501808	DE	On-Demand	Anodyne	HCN1	55	34
C[C@H]1Cc2cccc(C(=O)NCC3(C)CCN(C)CC3)c2O1	ZINC000450501808	DE	On-Demand	Anodyne	HCN4	53	34
CCCc1cc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)no1	ZINC000450501809	DF	On-Demand	Anodyne	MAP3K7	46	32
CN(CCCN1CCCC1)c1ccc(I)cn1	ZINC000450501810	EF	On-Demand	Anodyne	HNMT	60	40
COC(=O)CCCN(Cc1ccccc1)Cc1ccc(C(C)=O)cc1	ZINC000450501814	EH	On-Demand	Anodyne	ACHE	0	46
COC(=O)CCCN(Cc1ccccc1)Cc1ccc(C(C)=O)cc1	ZINC000450501814	EH	On-Demand	Anodyne	LTA4H	29	49
Cc1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)c(Cl)c1Cl	ZINC000450501819	FJ	On-Demand	Anodyne	MAP3K7	46	32
Cc1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)c(Cl)c1Cl	ZINC000450501819	FJ	On-Demand	Anodyne	L3MBTL1	0	40
Cc1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)c(Cl)c1Cl	ZINC000450501819	FJ	On-Demand	Anodyne	L3MBTL3	63	40
O=C(c1cccc(C(F)(F)F)n1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450501833	FG	On-Demand	Anodyne	SFRP1	49	37
CSc1cccc(C(=O)N(C)Cc2cnc(N(C)C)nc2)c1	ZINC000450501848	DF	On-Demand	Anodyne	HSD17B2	23	43
CCS(=O)(=O)c1cccc(CNc2ncc([N+](=O)[O-])c(C)n2)c1	ZINC000450501849	ED	On-Demand	Bother	PRKCQ	44	47
O=C(Cc1ccc(O)c(F)c1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450501855	FE	On-Demand	Anodyne	EPHX2	16	42
CCCCCN(CC(N)=O)C(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450501870	EE	On-Demand	Anodyne	TSPO	24	58
CCCCCN(CC(N)=O)C(=O)c1ccc(I)cc1F	ZINC000450501871	GF	On-Demand	Anodyne	SOAT1	20	43
CCN(CC(=O)O)C(=O)C1(Oc2ccccc2F)CC1	ZINC000450501874	CD	On-Demand	Anodyne	CXCL8	17	43
CC(C)(C)OC(=O)CCSc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450501878	FG	On-Demand	Bother	GSTM2	63	36
CCCCCN(CC(N)=O)C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450501879	ED	On-Demand	Anodyne	TSPO	42	46
Cc1nccnc1N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450501896	GF	On-Demand	Anodyne	PDE3A	42	33
Cc1nccnc1N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450501896	GF	On-Demand	Anodyne	PDGFRB	40	43
Cc1nccnc1N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450501896	GF	On-Demand	Anodyne	PDE3B	63	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(C)(C#N)CC1	ZINC000450501923	DF	On-Demand	Mild	GHRHR	43	32
CCCCCN(CC(N)=O)C(=O)c1cc(C(=O)OCC)no1	ZINC000450501924	DC	On-Demand	Anodyne	TSPO	21	48
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccccc1	ZINC000450501940	DB	On-Demand	Anodyne	NAALAD2	20	43
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccccc1	ZINC000450501940	DB	On-Demand	Anodyne	GSTP1	16	40
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccccc1	ZINC000450501941	DB	On-Demand	Anodyne	NAALAD2	20	43
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccccc1	ZINC000450501941	DB	On-Demand	Anodyne	GSTP1	16	40
C[S@@](=O)C1(CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1	ZINC000450501943	EE	On-Demand	Bother	MAOB	25	53
C[S@](=O)C1(CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1	ZINC000450501944	EE	On-Demand	Bother	MAOB	25	53
C=CCOc1ccc(CC(=O)N2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450501964	FH	On-Demand	Mild	MAP3K7	46	33
C=CCOc1ccc(CC(=O)N2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450501964	FH	On-Demand	Mild	GPR183	0	43
COc1ccccc1CCNC(=O)CNc1nc2cc(C)cc(C)c2o1	ZINC000450501965	FF	On-Demand	Anodyne	CETP	26	49
COc1ccccc1CCNC(=O)CNc1nc2cc(C)cc(C)c2o1	ZINC000450501965	FF	On-Demand	Anodyne	MTNR1A	40	36
COc1ccccc1CCNC(=O)CNc1nc2cc(C)cc(C)c2o1	ZINC000450501965	FF	On-Demand	Anodyne	RPS6KA2	46	34
OC[C@H](CNc1ccnc2cc(F)c(Cl)cc12)[C@H]1CCOC1	ZINC000450501966	DG	On-Demand	Anodyne	HRP1_PLAFA	87	34
OC[C@H](CNc1ccnc2cc(F)c(Cl)cc12)[C@H]1CCOC1	ZINC000450501966	DG	On-Demand	Anodyne	HNMT	44	34
OC[C@@H](CNc1ccnc2cc(F)c(Cl)cc12)[C@H]1CCOC1	ZINC000450501967	DG	On-Demand	Anodyne	HRP1_PLAFA	87	34
OC[C@@H](CNc1ccnc2cc(F)c(Cl)cc12)[C@H]1CCOC1	ZINC000450501967	DG	On-Demand	Anodyne	HNMT	44	34
CC[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@H]1N1CCOCC1	ZINC000450501970	EF	On-Demand	Anodyne	DRD2	28	40
CC[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@H]1N1CCOCC1	ZINC000450501970	EF	On-Demand	Anodyne	THRB	0	41
CC[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@H]1N1CCOCC1	ZINC000450501971	EF	On-Demand	Anodyne	DRD2	28	40
CC[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@H]1N1CCOCC1	ZINC000450501971	EF	On-Demand	Anodyne	THRB	0	41
CC[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@H]1N1CCOCC1	ZINC000450501972	EF	On-Demand	Anodyne	DRD2	28	40
CC[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@H]1N1CCOCC1	ZINC000450501972	EF	On-Demand	Anodyne	THRB	0	41
CC[C@H]1CN(CCCC(=O)c2ccccc2)C[C@H]1N1CCOCC1	ZINC000450501973	EF	On-Demand	Anodyne	DRD2	28	40
CC[C@H]1CN(CCCC(=O)c2ccccc2)C[C@H]1N1CCOCC1	ZINC000450501973	EF	On-Demand	Anodyne	THRB	0	41
CC(=O)c1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1	ZINC000450501979	DH	On-Demand	Bother	CACNA1C	50	38
CC(=O)c1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1	ZINC000450501979	DH	On-Demand	Bother	CACNA1D	83	36
CC(=O)c1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1	ZINC000450501979	DH	On-Demand	Bother	LUXR	17	44
CN(C)S(=O)(=O)CC(=O)N[C@H](CC(=O)O)c1ccc(OC(F)(F)F)cc1	ZINC000450502008	GD	On-Demand	Anodyne	MMP2	21	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](CC(=O)O)c1ccc(OC(F)(F)F)cc1	ZINC000450502009	GD	On-Demand	Anodyne	MMP2	21	41
CCN(CCC(=O)O)C(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450502021	DE	On-Demand	Anodyne	HTR4	26	40
CCOC(=O)c1ccc(CN2CCc3c(F)cc(F)cc3C2)nc1	ZINC000450502027	EG	On-Demand	Anodyne	NOD1	26	42
CCOC(=O)c1ccc(CN2CCc3c(F)cc(F)cc3C2)nc1	ZINC000450502027	EG	On-Demand	Anodyne	NOD2	41	42
COc1cccc2c(N3CC[C@H](C(=O)N(C)c4ccccc4)C3)nccc12	ZINC000450502028	FH	On-Demand	Anodyne	PDE3A	45	36
COc1cccc2c(N3CC[C@H](C(=O)N(C)c4ccccc4)C3)nccc12	ZINC000450502028	FH	On-Demand	Anodyne	PDE3B	67	36
COc1cccc2c(N3CC[C@@H](C(=O)N(C)c4ccccc4)C3)nccc12	ZINC000450502029	FH	On-Demand	Anodyne	PDE3A	45	36
COc1cccc2c(N3CC[C@@H](C(=O)N(C)c4ccccc4)C3)nccc12	ZINC000450502029	FH	On-Demand	Anodyne	PDE3B	67	36
Fc1cccc(CN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450502047	EE	On-Demand	Anodyne	DRD4	15	43
Fc1cccc(CN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450502047	EE	On-Demand	Anodyne	SIGMAR1	24	50
CCOC(=O)c1ccc(CN(CCCO)Cc2ccccc2)nc1	ZINC000450502071	EF	On-Demand	Anodyne	PLM2_PLAFA	33	41
CCOC(=O)[C@@H]1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450502073	DE	On-Demand	Anodyne	MAPK1	52	35
CCOC(=O)[C@@H]1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450502073	DE	On-Demand	Anodyne	MAPK9	30	44
CCOC(=O)[C@@H]1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450502073	DE	On-Demand	Anodyne	MAPK8	30	44
CCOC(=O)c1ccc(CN2CCc3ccc(F)c(F)c3C2)nc1	ZINC000450502118	EG	On-Demand	Anodyne	NOD1	26	42
CCOC(=O)c1ccc(CN2CCc3ccc(F)c(F)c3C2)nc1	ZINC000450502118	EG	On-Demand	Anodyne	NOD2	41	42
COc1ccc(S(=O)(=O)N2CCCN(CC[C@H](C)O)CC2)cc1	ZINC000450502131	ED	On-Demand	Anodyne	ADORA2B	25	40
COc1ccc(S(=O)(=O)N2CCCN(CC[C@H](C)O)CC2)cc1	ZINC000450502131	ED	On-Demand	Anodyne	MMP13	53	45
COc1ccc(S(=O)(=O)N2CCCN(CC[C@H](C)O)CC2)cc1	ZINC000450502131	ED	On-Demand	Anodyne	MMP3	51	45
COc1ccc(S(=O)(=O)N2CCCN(CC[C@H](C)O)CC2)cc1	ZINC000450502131	ED	On-Demand	Anodyne	MMP9	49	45
COc1ccc(S(=O)(=O)N2CCCN(CC[C@H](C)O)CC2)cc1	ZINC000450502131	ED	On-Demand	Anodyne	MMP7	60	44
COc1ccc(S(=O)(=O)N2CCCN(CC[C@H](C)O)CC2)cc1	ZINC000450502131	ED	On-Demand	Anodyne	MMP1	59	43
COc1ccc(S(=O)(=O)N2CCCN(CC[C@@H](C)O)CC2)cc1	ZINC000450502132	ED	On-Demand	Anodyne	ADORA2B	25	40
COc1ccc(S(=O)(=O)N2CCCN(CC[C@@H](C)O)CC2)cc1	ZINC000450502132	ED	On-Demand	Anodyne	MMP13	53	45
COc1ccc(S(=O)(=O)N2CCCN(CC[C@@H](C)O)CC2)cc1	ZINC000450502132	ED	On-Demand	Anodyne	MMP3	51	45
COc1ccc(S(=O)(=O)N2CCCN(CC[C@@H](C)O)CC2)cc1	ZINC000450502132	ED	On-Demand	Anodyne	MMP9	49	45
COc1ccc(S(=O)(=O)N2CCCN(CC[C@@H](C)O)CC2)cc1	ZINC000450502132	ED	On-Demand	Anodyne	MMP7	60	44
COc1ccc(S(=O)(=O)N2CCCN(CC[C@@H](C)O)CC2)cc1	ZINC000450502132	ED	On-Demand	Anodyne	MMP1	59	43
COCCn1cc(CNc2ccnc3cc(F)c(Br)cc23)cn1	ZINC000450502160	GH	On-Demand	Anodyne	HRP1_PLAFA	59	34
COCCn1cc(CNc2ccnc3cc(F)c(Br)cc23)cn1	ZINC000450502160	GH	On-Demand	Anodyne	HNMT	40	31
N#Cc1cccc(NCC2CCC(C#N)CC2)c1[N+](=O)[O-]	ZINC000450502175	CG	On-Demand	Mild	PRKCQ	40	34
COC(=O)Cc1ccc(SCCC(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450502227	FG	On-Demand	Bother	GSTM2	82	54
COC(=O)Cc1ccc(SCCC(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450502227	FG	On-Demand	Bother	GSTP1	60	42
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ncon1	ZINC000450502248	EG	On-Demand	Anodyne	RBP4	56	40
COc1cccc(-n2cc(C(=O)N3CCC(C)(C#N)CC3)nn2)c1	ZINC000450502254	EE	On-Demand	Mild	DRD4	40	31
COc1cccc(-n2cc(C(=O)N3CCC(C)(C#N)CC3)nn2)c1	ZINC000450502254	EE	On-Demand	Mild	CCKAR	15	41
CC(C)(C)N(CCCC(=O)c1ccc(Br)cc1)CC(N)=O	ZINC000450502257	FF	On-Demand	Anodyne	HDAC8	17	42
COc1ccc2c(c1)C[C@@H](C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O)CO2	ZINC000450502273	GF	On-Demand	Anodyne	BMP1	60	38
COc1ccc2c(c1)C[C@@H](C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O)CO2	ZINC000450502273	GF	On-Demand	Anodyne	ROCK2	29	41
COc1ccc2c(c1)C[C@@H](C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O)CO2	ZINC000450502274	GF	On-Demand	Anodyne	BMP1	60	38
COc1ccc2c(c1)C[C@@H](C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O)CO2	ZINC000450502274	GF	On-Demand	Anodyne	ROCK2	29	41
COc1ccc2c(c1)C[C@H](C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O)CO2	ZINC000450502275	GF	On-Demand	Anodyne	BMP1	60	38
COc1ccc2c(c1)C[C@H](C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O)CO2	ZINC000450502275	GF	On-Demand	Anodyne	ROCK2	29	41
COc1ccc2c(c1)C[C@H](C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O)CO2	ZINC000450502276	GF	On-Demand	Anodyne	BMP1	60	38
COc1ccc2c(c1)C[C@H](C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O)CO2	ZINC000450502276	GF	On-Demand	Anodyne	ROCK2	29	41
COC(=O)[C@@H]1CN(c2nnc(C(C)C)o2)C[C@H]1c1ccccc1	ZINC000450502296	DF	On-Demand	Anodyne	SLC6A1	68	42
O=C(c1cc2n(n1)CCCC2)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502297	FE	On-Demand	Anodyne	L3MBTL3	48	35
Cc1ccc(F)c(CC(=O)N2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450502298	EG	On-Demand	Anodyne	MAP3K7	48	34
CC(=O)c1cccc(CN2CCc3ccc(F)c(F)c3C2)c1	ZINC000450502305	DH	On-Demand	Anodyne	NOD2	42	36
OCCCN(Cc1ccccc1)Cc1cn(CC2CC2)nn1	ZINC000450502316	DE	On-Demand	Anodyne	HSP90AB1	0	43
C[C@H]1C[C@H](CNc2nccc3c([N+](=O)[O-])cccc23)C[C@@H](C)O1	ZINC000450502317	DH	On-Demand	Bother	PRKCQ	46	36
C[C@H]1CC(CNc2nccc3c([N+](=O)[O-])cccc23)C[C@H](C)O1	ZINC000450502318	DH	On-Demand	Bother	PRKCQ	46	36
C[C@@H]1CC(CNc2nccc3c([N+](=O)[O-])cccc23)C[C@@H](C)O1	ZINC000450502319	DH	On-Demand	Bother	PRKCQ	46	36
CN1CCC(C)(CNC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450502321	FH	On-Demand	Anodyne	TRPM8	44	34
CC(=O)N[C@H](C(=O)N1CCC(CCCN2CCOCC2)CC1)C(C)(C)C	ZINC000450502327	FD	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
COc1cccc(-n2cc(C(=O)N3CCC(n4cc(Cl)cn4)CC3)nn2)c1	ZINC000450502335	GF	On-Demand	Anodyne	DRD4	41	34
COc1cccc(-n2cc(C(=O)N3CCC(n4cc(Cl)cn4)CC3)nn2)c1	ZINC000450502335	GF	On-Demand	Anodyne	CCKAR	15	41
CN1CCC(C)(CNC(=O)c2cc(Cl)c(Br)cc2F)CC1	ZINC000450502339	GH	On-Demand	Anodyne	SLC6A9	49	35
COc1cccc2c(N3CCC[C@H](c4ncc5n4CCCC5)C3)nccc12	ZINC000450502340	FI	On-Demand	Anodyne	PDE3A	31	41
COc1cccc2c(N3CCC[C@H](c4ncc5n4CCCC5)C3)nccc12	ZINC000450502340	FI	On-Demand	Anodyne	PDE3B	49	32
COc1cccc2c(N3CCC[C@@H](c4ncc5n4CCCC5)C3)nccc12	ZINC000450502341	FI	On-Demand	Anodyne	PDE3A	31	41
COc1cccc2c(N3CCC[C@@H](c4ncc5n4CCCC5)C3)nccc12	ZINC000450502341	FI	On-Demand	Anodyne	PDE3B	49	32
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502343	FF	On-Demand	Anodyne	ACHE	24	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502343	FF	On-Demand	Anodyne	GRIN2B	55	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502343	FF	On-Demand	Anodyne	TACR2	40	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502343	FF	On-Demand	Anodyne	REN	39	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502343	FF	On-Demand	Anodyne	ST14	43	32
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502343	FF	On-Demand	Anodyne	CYP2J2	48	34
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502345	FF	On-Demand	Anodyne	ACHE	24	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502345	FF	On-Demand	Anodyne	GRIN2B	55	34
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502345	FF	On-Demand	Anodyne	TACR2	40	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502345	FF	On-Demand	Anodyne	REN	39	44
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502345	FF	On-Demand	Anodyne	ST14	43	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502345	FF	On-Demand	Anodyne	CYP2J2	48	34
O=C(Cc1cc2ccccc2s1)NCC1(c2ccncc2)CCCC1	ZINC000450502361	FI	On-Demand	Anodyne	ACAT	0	42
COC(=O)[C@@H]1CN(c2nc(C(C)=O)c(C)s2)C[C@H]1c1ccccc1	ZINC000450502367	EG	On-Demand	Anodyne	SLC6A1	37	41
CC(C)(C)OC(=O)CCSc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000450502373	FE	On-Demand	Bother	TBXA2R	26	41
CC(C)(C)OC(=O)CCSc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000450502373	FE	On-Demand	Bother	GSTM2	32	41
C[C@H]1C[C@]1(C#N)C(=O)Nc1ccc2[nH]nc(NC(=O)[C@@]3(C#N)C[C@H]3C)c2c1	ZINC000450502374	FD	On-Demand	Mild	CDK2	15	44
C[C@@H]1C[C@]1(C#N)C(=O)Nc1ccc2[nH]nc(NC(=O)[C@@]3(C#N)C[C@H]3C)c2c1	ZINC000450502375	FD	On-Demand	Mild	CDK2	15	44
C[C@@H]1C[C@]1(C#N)C(=O)Nc1n[nH]c2ccc(NC(=O)[C@]3(C#N)C[C@H]3C)cc12	ZINC000450502376	FD	On-Demand	Mild	CDK2	15	44
C[C@H]1C[C@@]1(C#N)C(=O)Nc1ccc2[nH]nc(NC(=O)[C@@]3(C#N)C[C@H]3C)c2c1	ZINC000450502378	FD	On-Demand	Mild	CDK2	15	44
CCCCCN(CC(N)=O)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450502386	FG	On-Demand	Anodyne	MTNR1A	22	43
CCN1C[C@H](C)N(C(=O)CCOc2cccc(OC)c2)C[C@H]1C	ZINC000450502390	DE	On-Demand	Anodyne	MTNR1A	24	43
CCN1C[C@H](C)N(C(=O)CCOc2cccc(OC)c2)C[C@@H]1C	ZINC000450502393	DE	On-Demand	Anodyne	MTNR1A	24	43
CCN1C[C@@H](C)N(C(=O)CCOc2cccc(OC)c2)C[C@H]1C	ZINC000450502394	DE	On-Demand	Anodyne	MTNR1A	24	43
CCN1C[C@@H](C)N(C(=O)CCOc2cccc(OC)c2)C[C@@H]1C	ZINC000450502395	DE	On-Demand	Anodyne	MTNR1A	24	43
CC(=O)N1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)CC12CCCCC2	ZINC000450502405	GI	On-Demand	Anodyne	SLC12A5	59	36
C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@@H]1CCCOC1	ZINC000450502415	EH	On-Demand	Anodyne	RBP4	77	40
C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@H]1CCCOC1	ZINC000450502416	EH	On-Demand	Anodyne	RBP4	77	40
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@H]1CCCOC1	ZINC000450502417	EH	On-Demand	Anodyne	RBP4	77	40
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@@H]1CCCOC1	ZINC000450502418	EH	On-Demand	Anodyne	RBP4	77	40
CCCCCN(CC(N)=O)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450502428	GG	On-Demand	Anodyne	PLK1	51	37
CCCCCN(CC(N)=O)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450502428	GG	On-Demand	Anodyne	HPGD	38	53
CCCCCN(CC(N)=O)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450502428	GG	On-Demand	Anodyne	ACKR3	54	34
CC(C)(C)OC(=O)CCSc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450502429	FF	On-Demand	Anodyne	NPY2R	54	35
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@@H](CC)CC(F)(F)F)c1	ZINC000450502437	FJ	On-Demand	Anodyne	SLC1A2	43	33
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@H](CC)CC(F)(F)F)c1	ZINC000450502449	FJ	On-Demand	Anodyne	SLC1A2	43	33
C[C@@H]1OCCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450502462	CF	On-Demand	Anodyne	HRH3	15	40
C[C@H]1[C@@H](C)OCCN1CCc1ccc(Cl)cc1	ZINC000450502463	CF	On-Demand	Anodyne	HRH3	15	40
C[C@@H]1OCCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450502464	CF	On-Demand	Anodyne	HRH3	15	40
C[C@H]1OCCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450502465	CF	On-Demand	Anodyne	HRH3	15	40
CCOc1ccc(NC(=O)CN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450502467	FE	On-Demand	Anodyne	LTA4H	21	42
CCOc1ccc(NC(=O)CN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450502468	FE	On-Demand	Anodyne	LTA4H	21	42
CN(C)S(=O)(=O)CC(=O)Nc1ccc(C(=O)O)cc1	ZINC000450502471	CC	On-Demand	Anodyne	CA2	26	43
CN(C)S(=O)(=O)CC(=O)Nc1ccc(C(=O)O)cc1	ZINC000450502471	CC	On-Demand	Anodyne	LTA4H	31	44
CN(C)S(=O)(=O)CC(=O)Nc1ccc(C(=O)O)cc1	ZINC000450502471	CC	On-Demand	Anodyne	PFK	0	42
COc1cccc(OCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)c1	ZINC000450502474	FG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)c1	ZINC000450502474	FG	On-Demand	Anodyne	LTA4H	33	45
COc1cccc(OCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)c1	ZINC000450502474	FG	On-Demand	Anodyne	HRH3	18	55
COc1cccc(OCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)c1	ZINC000450502475	FG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)c1	ZINC000450502475	FG	On-Demand	Anodyne	LTA4H	33	45
COc1cccc(OCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)c1	ZINC000450502475	FG	On-Demand	Anodyne	HRH3	18	55
CCS(=O)(=O)c1ccc(CN2CC[C@H]3[C@H](CCCN3C)C2)cc1	ZINC000450502477	EE	On-Demand	Anodyne	HRH3	17	45
CCS(=O)(=O)c1ccc(CN2CC[C@@H]3[C@@H](CCCN3C)C2)cc1	ZINC000450502478	EE	On-Demand	Anodyne	HRH3	17	45
CCS(=O)(=O)c1ccc(CN2CC[C@@H]3[C@H](CCCN3C)C2)cc1	ZINC000450502479	EE	On-Demand	Anodyne	HRH3	17	45
CCS(=O)(=O)c1ccc(CN2CC[C@H]3[C@@H](CCCN3C)C2)cc1	ZINC000450502480	EE	On-Demand	Anodyne	HRH3	17	45
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450502481	GD	On-Demand	Bother	OPRD1	30	41
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450502481	GD	On-Demand	Bother	AGTR2	64	42
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450502481	GD	On-Demand	Bother	PREP	17	40
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450502484	GD	On-Demand	Bother	OPRD1	30	41
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450502484	GD	On-Demand	Bother	AGTR2	64	42
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450502484	GD	On-Demand	Bother	PREP	17	40
COc1ccc(C(=O)N2CCC(CC(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450502488	FG	On-Demand	Anodyne	OXTR	29	41
COc1ccc(C(=O)N2CCC(CC(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450502488	FG	On-Demand	Anodyne	GRIN2B	20	43
COc1ccc(C(=O)N2CCC(CC(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450502488	FG	On-Demand	Anodyne	PRSS2	43	30
O=C(O)CCNC(=O)C1(Oc2ccccc2F)CC1	ZINC000450502505	CD	On-Demand	Anodyne	CXCL8	19	45
CCc1cc(CCCN2CCN(CCOc3cccc(OC)c3)CC2)on1	ZINC000450502521	FF	On-Demand	Anodyne	DRD4	40	31
CCc1cc(CCCN2CCN(CCOc3cccc(OC)c3)CC2)on1	ZINC000450502521	FF	On-Demand	Anodyne	DRD3	24	45
CCc1cc(CCCN2CCN(CCOc3cccc(OC)c3)CC2)on1	ZINC000450502521	FF	On-Demand	Anodyne	EBP	42	38
C[C@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502526	FG	On-Demand	Anodyne	SLC6A2	15	61
C[C@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502526	FG	On-Demand	Anodyne	SLC6A4	64	78
C[C@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502526	FG	On-Demand	Anodyne	SLC6A3	77	78
C[C@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502526	FG	On-Demand	Anodyne	LTA4H	26	40
C[C@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502526	FG	On-Demand	Anodyne	SIGMAR1	20	61
C[C@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502526	FG	On-Demand	Anodyne	CCR5	37	40
C[C@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502526	FG	On-Demand	Anodyne	NET	0	51
C[C@@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502527	FG	On-Demand	Anodyne	SLC6A2	15	61
C[C@@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502527	FG	On-Demand	Anodyne	SLC6A4	64	78
C[C@@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502527	FG	On-Demand	Anodyne	SLC6A3	77	78
C[C@@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502527	FG	On-Demand	Anodyne	LTA4H	26	40
C[C@@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502527	FG	On-Demand	Anodyne	SIGMAR1	20	61
C[C@@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502527	FG	On-Demand	Anodyne	CCR5	37	40
C[C@@H](O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1	ZINC000450502527	FG	On-Demand	Anodyne	NET	0	51
Fc1cccc(CN2CCN(Cc3cnns3)CC2)c1	ZINC000450502536	CD	On-Demand	Anodyne	SIGMAR1	22	51
c1ccc(C(OCCN2CCN(Cc3cnn[nH]3)CC2)c2ccccc2)cc1	ZINC000450502545	GF	On-Demand	Anodyne	SLC6A4	49	59
c1ccc(C(OCCN2CCN(Cc3cnn[nH]3)CC2)c2ccccc2)cc1	ZINC000450502545	GF	On-Demand	Anodyne	SLC6A3	82	66
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450502546	GF	On-Demand	Anodyne	ADRA1D	15	40
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450502546	GF	On-Demand	Anodyne	AVPR1B	46	32
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450502546	GF	On-Demand	Anodyne	COLA	72	39
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450502546	GF	On-Demand	Anodyne	CPT1A	68	39
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450502546	GF	On-Demand	Anodyne	CPT2	49	37
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450502546	GF	On-Demand	Anodyne	CPT1B	62	38
CCOC(=O)CC(C)(C)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450502550	EF	On-Demand	Anodyne	MTNR1A	27	45
CCOC(=O)CC(C)(C)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450502550	EF	On-Demand	Anodyne	MTNR1B	27	41
Cc1ccc(C)c(N2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450502551	EF	On-Demand	Anodyne	DRD4	17	47
COc1cccc(C(=O)CCCC(=O)Nc2cc(C(F)(F)F)ccn2)c1	ZINC000450502562	FI	On-Demand	Anodyne	LCK	20	44
COc1cccc(C(=O)CCCC(=O)Nc2cc(C(F)(F)F)ccn2)c1	ZINC000450502562	FI	On-Demand	Anodyne	CSNK1D	31	43
COc1cccc(C(=O)CCCC(=O)Nc2cc(C(F)(F)F)ccn2)c1	ZINC000450502562	FI	On-Demand	Anodyne	MTNR1A	25	40
COc1cccc(C(=O)CCCC(=O)Nc2cc(C(F)(F)F)ccn2)c1	ZINC000450502562	FI	On-Demand	Anodyne	MTNR1B	28	42
COc1cccc(C(=O)CCCC(=O)Nc2cc(C(F)(F)F)ccn2)c1	ZINC000450502562	FI	On-Demand	Anodyne	BTK	21	44
COc1cccc(C(=O)CCCC(=O)Nc2cc(C(F)(F)F)ccn2)c1	ZINC000450502562	FI	On-Demand	Anodyne	SCD1	27	48
COc1cccc(C(=O)CCCC(=O)Nc2cc(C(F)(F)F)ccn2)c1	ZINC000450502562	FI	On-Demand	Anodyne	SCD	29	40
COc1cccc(C(=O)CCCC(=O)Nc2cc(C(F)(F)F)ccn2)c1	ZINC000450502562	FI	On-Demand	Anodyne	PDS	40	36
CCCN(C(=O)c1cccs1)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450502585	GJ	On-Demand	Anodyne	DRD1	15	42
CCCN(C(=O)c1cccs1)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450502585	GJ	On-Demand	Anodyne	DRD4	16	42
CCCN(C(=O)c1cccs1)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450502585	GJ	On-Demand	Anodyne	HTR2A	20	47
CCCN(C(=O)c1cccs1)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450502585	GJ	On-Demand	Anodyne	HTR2C	18	47
CCCN(C(=O)c1cccs1)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450502585	GJ	On-Demand	Anodyne	DRD3	25	42
CCCN(C(=O)c1cccs1)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450502585	GJ	On-Demand	Anodyne	CCR5	35	46
CCCN(C(=O)c1cccs1)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450502585	GJ	On-Demand	Anodyne	CYP2J2	65	46
COc1cc(CN2CC[C@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502603	DG	On-Demand	Anodyne	HRH1	30	41
COc1cc(CN2CC[C@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502603	DG	On-Demand	Anodyne	PDE3A	42	45
COc1cc(CN2CC[C@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502603	DG	On-Demand	Anodyne	SSTR5	64	41
COc1cc(CN2CC[C@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502603	DG	On-Demand	Anodyne	CCR3	33	40
COc1cc(CN2CC[C@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502603	DG	On-Demand	Anodyne	UTS2R	36	45
COc1cc(CN2CC[C@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502603	DG	On-Demand	Anodyne	PDE3B	65	45
COc1cc(CN2CC[C@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502603	DG	On-Demand	Anodyne	MCHR1	15	41
COc1cc(CN2CC[C@@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502604	DG	On-Demand	Anodyne	HRH1	30	41
COc1cc(CN2CC[C@@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502604	DG	On-Demand	Anodyne	PDE3A	42	45
COc1cc(CN2CC[C@@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502604	DG	On-Demand	Anodyne	SSTR5	64	41
COc1cc(CN2CC[C@@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502604	DG	On-Demand	Anodyne	CCR3	33	40
COc1cc(CN2CC[C@@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502604	DG	On-Demand	Anodyne	UTS2R	36	45
COc1cc(CN2CC[C@@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502604	DG	On-Demand	Anodyne	PDE3B	65	45
COc1cc(CN2CC[C@@H](Oc3ccncc3)C2)ccc1Cl	ZINC000450502604	DG	On-Demand	Anodyne	MCHR1	15	41
C[C@H]1NC(=O)CC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450502609	EE	On-Demand	Bother	MAOA	16	51
C[C@H]1NC(=O)CC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450502609	EE	On-Demand	Bother	MAOB	34	57
C[C@@H]1NC(=O)CC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450502610	EE	On-Demand	Bother	MAOA	16	51
C[C@@H]1NC(=O)CC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450502610	EE	On-Demand	Bother	MAOB	34	57
C[C@@H]1NC(=O)CC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450502611	EE	On-Demand	Bother	MAOA	16	51
C[C@@H]1NC(=O)CC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450502611	EE	On-Demand	Bother	MAOB	34	57
C[C@H]1NC(=O)CC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450502612	EE	On-Demand	Bother	MAOA	16	51
C[C@H]1NC(=O)CC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450502612	EE	On-Demand	Bother	MAOB	34	57
CC(C)OC(C)(C)C(=O)N[C@H](C)Cc1ccccc1C(F)(F)F	ZINC000450502614	EH	On-Demand	Anodyne	SLC16A1	48	33
CC(C)OC(C)(C)C(=O)N[C@@H](C)Cc1ccccc1C(F)(F)F	ZINC000450502616	EH	On-Demand	Anodyne	SLC16A1	48	33
CCc1cccc(C(=O)N[C@H](C)c2ncon2)n1	ZINC000450502627	BD	On-Demand	Anodyne	PDE5A	25	40
CN1CCC(C)(CNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450502628	EF	On-Demand	Anodyne	CTSV	43	29
COC(=O)c1ccc(CN2CCC[C@@H]2CSC)cc1Cl	ZINC000450502629	DG	On-Demand	Anodyne	DRD2	49	41
COC(=O)c1ccc(CN2CCC[C@H]2CSC)cc1Cl	ZINC000450502630	DG	On-Demand	Anodyne	DRD2	49	41
CCc1cccc(C(=O)N[C@@H](C)c2ncon2)n1	ZINC000450502632	BD	On-Demand	Anodyne	PDE5A	25	40
CCS(=O)(=O)c1ccc(CN2CCc3ccc(F)c(F)c3C2)cc1	ZINC000450502637	FG	On-Demand	Anodyne	NOD2	41	35
CC(=O)c1cccc(CN(C)[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000450502639	CH	On-Demand	Anodyne	HSD17B2	20	43
CC(=O)c1cccc(CN(C)[C@H](C)Cc2ccc(O)cc2)c1	ZINC000450502640	CH	On-Demand	Anodyne	HSD17B2	20	43
CC1(C#N)CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450502643	EF	On-Demand	Mild	CACNA1D	48	35
CC1(C#N)CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450502643	EF	On-Demand	Mild	MGLL	0	42
CC1(C#N)CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450502659	FH	On-Demand	Mild	HRH4	32	52
CN(C)S(=O)(=O)CC(=O)N[C@H](CCC(=O)O)c1ccccc1	ZINC000450502679	EC	On-Demand	Anodyne	UTS2	55	37
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502683	DF	On-Demand	Anodyne	MAP3K7	42	32
CC(C)CCCC(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502684	DG	On-Demand	Anodyne	PAOX	17	40
CC(C)CCCC(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502684	DG	On-Demand	Anodyne	GNAI1	0	41
CC(C)CCCC(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502684	DG	On-Demand	Anodyne	GNAI3	0	45
CC(C)CCCC(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502684	DG	On-Demand	Anodyne	GNAO1	0	41
COC(=O)CCCN(Cc1ccccc1)Cc1cccc(C(C)=O)c1	ZINC000450502688	EH	On-Demand	Anodyne	ACHE	0	42
COC(=O)CCCN(Cc1ccccc1)Cc1cccc(C(C)=O)c1	ZINC000450502688	EH	On-Demand	Anodyne	LTA4H	15	45
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502702	GF	On-Demand	Anodyne	HTR1A	21	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502702	GF	On-Demand	Anodyne	DRD2	16	42
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502702	GF	On-Demand	Anodyne	ACHE	16	42
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502702	GF	On-Demand	Anodyne	DRD3	17	42
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502702	GF	On-Demand	Anodyne	CASR	42	34
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502702	GF	On-Demand	Anodyne	SIGMAR1	18	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502702	GF	On-Demand	Anodyne	MMP2	0	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502702	GF	On-Demand	Anodyne	CYP2J2	46	32
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502703	GF	On-Demand	Anodyne	HTR1A	21	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502703	GF	On-Demand	Anodyne	DRD2	16	42
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502703	GF	On-Demand	Anodyne	ACHE	16	42
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502703	GF	On-Demand	Anodyne	DRD3	17	42
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502703	GF	On-Demand	Anodyne	CASR	42	34
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502703	GF	On-Demand	Anodyne	SIGMAR1	18	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502703	GF	On-Demand	Anodyne	MMP2	0	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502703	GF	On-Demand	Anodyne	CYP2J2	46	32
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502704	GJ	On-Demand	Anodyne	MC4R	38	43
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502704	GJ	On-Demand	Anodyne	PRCP	61	45
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502704	GJ	On-Demand	Anodyne	MAP3K7	47	33
CN(C)S(=O)(=O)CC(=O)N[C@@H](CCC(=O)O)c1ccccc1	ZINC000450502705	EC	On-Demand	Anodyne	UTS2	55	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502711	GJ	On-Demand	Anodyne	MC4R	38	43
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502711	GJ	On-Demand	Anodyne	PRCP	61	45
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502711	GJ	On-Demand	Anodyne	MAP3K7	47	33
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502713	GJ	On-Demand	Anodyne	MC4R	38	43
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502713	GJ	On-Demand	Anodyne	PRCP	61	45
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502713	GJ	On-Demand	Anodyne	MAP3K7	47	33
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502715	GJ	On-Demand	Anodyne	MC4R	38	43
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502715	GJ	On-Demand	Anodyne	PRCP	61	45
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502715	GJ	On-Demand	Anodyne	MAP3K7	47	33
CSC[C@@H]1CCCN1Cc1ccc(C(C)=O)cc1	ZINC000450502717	CG	On-Demand	Anodyne	HRH3	15	40
CSC[C@H]1CCCN1Cc1ccc(C(C)=O)cc1	ZINC000450502718	CG	On-Demand	Anodyne	HRH3	15	40
CCCCCN(CC(N)=O)C(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450502742	GG	On-Demand	Anodyne	TSPO	39	46
CN1CCC(C)(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450502746	GH	On-Demand	Anodyne	HRH4	15	45
CN1CCC(C)(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450502746	GH	On-Demand	Anodyne	PYGL	48	33
CN1CCC(C)(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450502746	GH	On-Demand	Anodyne	PLD2	46	36
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502755	GG	On-Demand	Anodyne	SLC6A4	17	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502755	GG	On-Demand	Anodyne	SLC6A3	25	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502755	GG	On-Demand	Anodyne	CCR3	44	38
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502755	GG	On-Demand	Anodyne	EPHX2	19	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502756	GG	On-Demand	Anodyne	SLC6A4	17	41
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502756	GG	On-Demand	Anodyne	SLC6A3	25	41
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502756	GG	On-Demand	Anodyne	CCR3	44	38
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450502756	GG	On-Demand	Anodyne	EPHX2	19	40
FC(F)c1cnc(NCc2cc(Cl)ccc2N2CCOCC2)nc1	ZINC000450502759	FF	On-Demand	Anodyne	STAT6	56	37
CN1CCC(C)(CNC(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450502762	GF	On-Demand	Mild	TRPV4	44	33
CC(C)(C(=O)Nc1cc(C(F)(F)F)ccn1)c1ccc2c(c1)OCO2	ZINC000450502767	FH	On-Demand	Anodyne	CLK2	25	44
CC(C)(C(=O)Nc1cc(C(F)(F)F)ccn1)c1ccc2c(c1)OCO2	ZINC000450502767	FH	On-Demand	Anodyne	CLK4	22	44
COC(=O)c1ccc(CN2CCN(c3cc(C)ccn3)CC2)cc1Cl	ZINC000450502799	FG	On-Demand	Anodyne	DRD4	38	46
COC(=O)c1ccc(CN2CCN(c3cc(C)ccn3)CC2)cc1Cl	ZINC000450502799	FG	On-Demand	Anodyne	MCHR1	19	41
CN1CCC[C@H]1C(=O)N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450502802	GD	On-Demand	Anodyne	PREP	90	42
CN1CCC[C@@H]1C(=O)N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450502803	GD	On-Demand	Anodyne	PREP	90	42
COC(=O)[C@@H](C)N(C)c1nc(C)cc(OCc2ccccc2)n1	ZINC000450502805	DE	On-Demand	Anodyne	NPR	42	31
COC(=O)[C@H](C)N(C)c1nc(C)cc(OCc2ccccc2)n1	ZINC000450502806	DE	On-Demand	Anodyne	NPR	42	31
N#CCC1(CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1	ZINC000450502815	DG	On-Demand	Mild	MAOB	17	51
COc1cccc(OCCN2CCN(Cc3cnns3)CC2)c1	ZINC000450502816	ED	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCN2CCN(Cc3cnns3)CC2)c1	ZINC000450502816	ED	On-Demand	Anodyne	PSMB2	42	31
N#CC1(CN2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)CCC1	ZINC000450502820	GI	On-Demand	Mild	SLC6A4	42	53
N#CC1(CN2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)CCC1	ZINC000450502820	GI	On-Demand	Mild	SLC6A3	70	64
C[C@H](CN1CCN(C2CCCCC2)CC1)S(C)(=O)=O	ZINC000450502829	CD	On-Demand	Anodyne	EBP	15	51
C[C@@H](CN1CCN(C2CCCCC2)CC1)S(C)(=O)=O	ZINC000450502830	CD	On-Demand	Anodyne	EBP	15	51
COC1(CNC(=O)c2ccc(C(F)(F)F)cc2C)CCC1	ZINC000450502831	DG	On-Demand	Anodyne	PPARD	20	41
Cc1ccn(-c2ccccc2C(=O)N2CC3(CCCCC3)C2)n1	ZINC000450502836	DH	On-Demand	Anodyne	AVPR2	19	41
CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(C)nc2C(C)C)c1	ZINC000450502841	FK	On-Demand	Anodyne	SHH	32	40
N#CCC1(CNc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450502842	CI	On-Demand	Mild	HRP1_PLAFA	47	31
N#CCC1(CNc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450502842	CI	On-Demand	Mild	HNMT	43	34
COc1cccc(OCCC(=O)N2CCOC[C@H]2c2ncon2)c1	ZINC000450502870	ED	On-Demand	Anodyne	COLA	80	39
COc1cccc(OCCC(=O)N2CCOC[C@H]2c2ncon2)c1	ZINC000450502870	ED	On-Demand	Anodyne	CPT1A	60	39
COc1cccc(OCCC(=O)N2CCOC[C@@H]2c2ncon2)c1	ZINC000450502871	ED	On-Demand	Anodyne	COLA	80	39
COc1cccc(OCCC(=O)N2CCOC[C@@H]2c2ncon2)c1	ZINC000450502871	ED	On-Demand	Anodyne	CPT1A	60	39
CC(C)(C)OC(=O)CCSc1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450502881	DG	On-Demand	Bother	CYP1A2	15	41
CC(C)(C)OC(=O)CCSc1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450502881	DG	On-Demand	Bother	TXN	19	48
CCCN(C(=O)c1cccs1)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450502882	GI	On-Demand	Anodyne	DRD2	18	42
CCCN(C(=O)c1cccs1)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450502882	GI	On-Demand	Anodyne	DRD3	26	42
CCCN(C(=O)c1cccs1)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450502882	GI	On-Demand	Anodyne	SIGMAR1	29	41
CCCN(C(=O)c1cccs1)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450502882	GI	On-Demand	Anodyne	CCR5	57	47
C[C@H](O)[C@H]1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450502890	FD	On-Demand	Mild	AR	18	43
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450502891	FD	On-Demand	Mild	AR	18	43
C[C@H](O)[C@H]1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450502892	FD	On-Demand	Mild	AR	18	43
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450502893	FD	On-Demand	Mild	AR	18	43
COc1cc(CC(=O)Nc2nnc3n2CCCC3)ccc1Cl	ZINC000450502902	DE	On-Demand	Anodyne	OPRM1	15	41
COc1cc(CC(=O)Nc2nnc3n2CCCC3)ccc1Cl	ZINC000450502902	DE	On-Demand	Anodyne	OPRK1	42	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](CC(=O)O)c1ccc(C(C)(C)C)cc1	ZINC000450502938	FD	On-Demand	Anodyne	TRPV1	15	40
CN(C)S(=O)(=O)CC(=O)N[C@H](CC(=O)O)c1ccc(C(C)(C)C)cc1	ZINC000450502939	FD	On-Demand	Anodyne	TRPV1	15	40
CCCN(C(=O)c1cccs1)C1CCN(CC[C@H](C)O)CC1	ZINC000450502940	DF	On-Demand	Anodyne	CCR5	51	43
CCCN(C(=O)c1cccs1)C1CCN(CC[C@@H](C)O)CC1	ZINC000450502941	DF	On-Demand	Anodyne	CCR5	51	43
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)CCCC(=O)C1CC1	ZINC000450502949	EH	On-Demand	Anodyne	SLC16A1	49	33
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)CCCC(=O)C1CC1	ZINC000450502950	EH	On-Demand	Anodyne	SLC16A1	49	33
Cc1nc(NCc2cccc(N3CCC3=O)c2)ncc1[N+](=O)[O-]	ZINC000450502960	DD	On-Demand	Bother	PRKCQ	46	46
COCC[C@H](CO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450502963	CF	On-Demand	Anodyne	HRP1_PLAFA	43	30
COCC[C@H](CO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450502963	CF	On-Demand	Anodyne	HNMT	46	32
CCC(=O)CCCN1CCc2ccc(F)c(F)c2C1	ZINC000450502965	CG	On-Demand	Anodyne	HTR5A	22	40
O=C(c1cccc2c1CCCC2)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502971	EH	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1cccc2c1CCCC2)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502971	EH	On-Demand	Anodyne	L3MBTL3	76	41
O=C(c1cccc2c1CCCC2)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450502971	EH	On-Demand	Anodyne	TP53BP1	0	41
CCOC(=O)c1cc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)on1	ZINC000450502975	FE	On-Demand	Anodyne	MAP3K7	49	34
O=[N+]([O-])c1ccc(-c2csc(NC[C@H](O)C(F)F)n2)cc1	ZINC000450502979	DE	On-Demand	Bother	MAOB	21	53
O=[N+]([O-])c1ccc(-c2csc(NC[C@@H](O)C(F)F)n2)cc1	ZINC000450502980	DE	On-Demand	Bother	MAOB	21	53
CN1CCC(C)(CNC(=O)c2cc(Cl)c(F)cc2Br)CC1	ZINC000450502992	GH	On-Demand	Anodyne	SLC6A9	50	38
COc1ccc(-c2noc(N3C[C@@H]4OCCN(Cc5ccccc5)[C@@H]4C3)n2)cc1	ZINC000450502999	GF	On-Demand	Anodyne	SIGMAR1	18	42
COc1ccc(-c2noc(N3C[C@@H]4OCCN(Cc5ccccc5)[C@@H]4C3)n2)cc1	ZINC000450502999	GF	On-Demand	Anodyne	COLA	0	40
COc1ccc(-c2noc(N3C[C@@H]4OCCN(Cc5ccccc5)[C@@H]4C3)n2)cc1	ZINC000450502999	GF	On-Demand	Anodyne	S1PR4	15	41
COc1ccc(-c2noc(N3C[C@@H]4OCCN(Cc5ccccc5)[C@@H]4C3)n2)cc1	ZINC000450502999	GF	On-Demand	Anodyne	S1PR1	15	41
C[C@H]1C[C@H](CNc2ncc(C#N)cc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000450503018	CE	On-Demand	Mild	PRKCQ	46	35
C[C@@H]1CC(CNc2ncc(C#N)cc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000450503019	CE	On-Demand	Mild	PRKCQ	46	35
C[C@H]1CC(CNc2ncc(C#N)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC000450503020	CE	On-Demand	Mild	PRKCQ	46	35
COc1ccc(-c2ccnc(NCC3C[C@H](C)O[C@@H](C)C3)n2)cc1	ZINC000450503024	EH	On-Demand	Anodyne	CLK4	29	52
COc1ccc(-c2ccnc(NCC3C[C@H](C)O[C@@H](C)C3)n2)cc1	ZINC000450503024	EH	On-Demand	Anodyne	DYRK1B	17	54
COc1ccc(-c2ccnc(NCC3C[C@H](C)O[C@@H](C)C3)n2)cc1	ZINC000450503024	EH	On-Demand	Anodyne	VCP	33	44
COc1ccc(-c2ccnc(NC[C@H]3C[C@H](C)O[C@H](C)C3)n2)cc1	ZINC000450503025	EH	On-Demand	Anodyne	CLK4	29	52
COc1ccc(-c2ccnc(NC[C@H]3C[C@H](C)O[C@H](C)C3)n2)cc1	ZINC000450503025	EH	On-Demand	Anodyne	DYRK1B	17	54
COc1ccc(-c2ccnc(NC[C@H]3C[C@H](C)O[C@H](C)C3)n2)cc1	ZINC000450503025	EH	On-Demand	Anodyne	VCP	33	44
COc1ccc(-c2ccnc(NCC3C[C@@H](C)O[C@H](C)C3)n2)cc1	ZINC000450503026	EH	On-Demand	Anodyne	CLK4	29	52
COc1ccc(-c2ccnc(NCC3C[C@@H](C)O[C@H](C)C3)n2)cc1	ZINC000450503026	EH	On-Demand	Anodyne	DYRK1B	17	54
COc1ccc(-c2ccnc(NCC3C[C@@H](C)O[C@H](C)C3)n2)cc1	ZINC000450503026	EH	On-Demand	Anodyne	VCP	33	44
CN1CCC(C)(CNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450503031	GE	On-Demand	Mild	AR	21	40
CN1CCC(C)(CNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450503032	GE	On-Demand	Mild	AR	21	40
O=C(c1cc2c([nH]1)CCCC2)N1CCC(CCCN2CCOCC2)CC1	ZINC000450503042	FF	On-Demand	Anodyne	AKR1C3	19	40
COCC[C@@H](CO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450503064	CF	On-Demand	Anodyne	HRP1_PLAFA	43	30
COCC[C@@H](CO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450503064	CF	On-Demand	Anodyne	HNMT	46	32
c1nn[nH]c1CN1CCN(C2CCCCC2)CC1	ZINC000450503068	BD	On-Demand	Anodyne	EBP	15	46
Fc1cccc(CN2CCN(Cc3nnc(C4CC4)s3)CC2)c1	ZINC000450503073	EF	On-Demand	Anodyne	DRD4	15	44
Fc1cccc(CN2CCN(Cc3nnc(C4CC4)s3)CC2)c1	ZINC000450503073	EF	On-Demand	Anodyne	SIGMAR1	20	47
CCCC(=O)Nc1ccc(Cl)c(NC(=O)CC2CC(F)(F)C2)c1	ZINC000450503078	EI	On-Demand	Anodyne	ENV	45	36
COc1ccc(CNC(=O)CCN2CCc3c(F)cc(F)cc3C2)c(OC)c1	ZINC000450503079	GG	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCc3c(F)cc(F)cc3C2)c(OC)c1	ZINC000450503079	GG	On-Demand	Anodyne	HTR7	29	41
CC1(C#N)CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450503087	DI	On-Demand	Mild	CTSB	31	40
CC1(C#N)CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450503087	DI	On-Demand	Mild	CTSK	24	47
C[C@H](NC(=O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)[C@@H]1CCCOC1	ZINC000450503089	GH	On-Demand	Anodyne	CCR2	25	42
C[C@H](NC(=O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)[C@H]1CCCOC1	ZINC000450503090	GH	On-Demand	Anodyne	CCR2	25	42
C[C@H](NC(=O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)[C@H]1CCCOC1	ZINC000450503091	GH	On-Demand	Anodyne	CCR2	25	42
C[C@H](NC(=O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)[C@@H]1CCCOC1	ZINC000450503093	GH	On-Demand	Anodyne	CCR2	25	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450503096	FC	On-Demand	Anodyne	CTSK	25	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450503096	FC	On-Demand	Anodyne	CTSL	28	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450503096	FC	On-Demand	Anodyne	CTSS	30	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450503096	FC	On-Demand	Anodyne	CAPN1	46	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450503096	FC	On-Demand	Anodyne	CAPN2	70	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450503096	FC	On-Demand	Anodyne	NPR	58	35
CC(=O)[C@@](C)(O)CN1CCN(C2CCCCC2)CC1	ZINC000450503110	CD	On-Demand	Anodyne	EBP	15	50
CC(=O)[C@](C)(O)CN1CCN(C2CCCCC2)CC1	ZINC000450503111	CD	On-Demand	Anodyne	EBP	15	50
Cc1nc(N[C@@H]2C[C@H]2c2cccc(Cl)c2)ncc1[N+](=O)[O-]	ZINC000450503119	DG	On-Demand	Bother	PRKCQ	31	44
FC(F)c1cnc(N2CCC(N3CCc4ccccc43)CC2)nc1	ZINC000450503121	EG	On-Demand	Anodyne	SCD1	27	40
FC(F)c1cnc(N2CCC(N3CCc4ccccc43)CC2)nc1	ZINC000450503121	EG	On-Demand	Anodyne	SCD	24	40
c1nc(CCN2CCN(C3CCCCC3)CC2)cs1	ZINC000450503125	CF	On-Demand	Anodyne	EBP	15	41
CCCCCN(CC(N)=O)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450503129	FD	On-Demand	Anodyne	PLM2_PLAFA	69	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]([C@H](C)O)C2)c1	ZINC000450503153	CE	On-Demand	Anodyne	CCR5	51	35
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]([C@H](C)O)C2)c1	ZINC000450503153	CE	On-Demand	Anodyne	NPBWR1	51	29
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H]([C@H](C)O)C2)c1	ZINC000450503154	CE	On-Demand	Anodyne	CCR5	51	35
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H]([C@H](C)O)C2)c1	ZINC000450503154	CE	On-Demand	Anodyne	NPBWR1	51	29
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]([C@@H](C)O)C2)c1	ZINC000450503155	CE	On-Demand	Anodyne	CCR5	51	35
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H]([C@@H](C)O)C2)c1	ZINC000450503155	CE	On-Demand	Anodyne	NPBWR1	51	29
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H]([C@@H](C)O)C2)c1	ZINC000450503156	CE	On-Demand	Anodyne	CCR5	51	35
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H]([C@@H](C)O)C2)c1	ZINC000450503156	CE	On-Demand	Anodyne	NPBWR1	51	29
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450503176	FI	On-Demand	Anodyne	SDH1	0	51
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450503178	FI	On-Demand	Anodyne	SDH1	0	51
C[C@@H](C(=O)O)N(C(=O)CCCc1cc(F)ccc1F)C1CC1	ZINC000450503182	DF	On-Demand	Anodyne	DPP4	22	48
Cc1ccnc(N2CCN(Cc3ccccc3OC3CC3)CC2)c1	ZINC000450503183	DG	On-Demand	Anodyne	DRD2	17	40
Cc1ccnc(N2CCN(Cc3ccccc3OC3CC3)CC2)c1	ZINC000450503183	DG	On-Demand	Anodyne	DRD4	36	47
Cc1ccnc(N2CCN(Cc3ccccc3OC3CC3)CC2)c1	ZINC000450503183	DG	On-Demand	Anodyne	SCD1	34	42
C[C@H](C(=O)O)N(C(=O)CCCc1cc(F)ccc1F)C1CC1	ZINC000450503184	DF	On-Demand	Anodyne	DPP4	22	48
Cc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cnc1N1CCCC[C@@H]1C	ZINC000450503194	GI	On-Demand	Anodyne	MMP13	0	44
Cc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cnc1N1CCCC[C@H]1C	ZINC000450503195	GI	On-Demand	Anodyne	MMP13	0	44
CCS(=O)(=O)c1ccc(CN(CC(N)=O)C(C)(C)C)cc1	ZINC000450503208	DD	On-Demand	Anodyne	RORC	22	43
C[C@@H](O)CCN1CCN(CC(=O)Nc2ccc(Br)cc2)CC1	ZINC000450503212	FD	On-Demand	Anodyne	LTA4H	15	40
C[C@@H](O)CCN1CCN(CC(=O)Nc2ccc(Br)cc2)CC1	ZINC000450503212	FD	On-Demand	Anodyne	CHRNA7	23	40
C[C@H](O)CCN1CCN(CC(=O)Nc2ccc(Br)cc2)CC1	ZINC000450503213	FD	On-Demand	Anodyne	LTA4H	15	40
C[C@H](O)CCN1CCN(CC(=O)Nc2ccc(Br)cc2)CC1	ZINC000450503213	FD	On-Demand	Anodyne	CHRNA7	23	40
Cc1cccc(Cl)c1C(=O)NCC1(c2ccncc2)CCCC1	ZINC000450503214	EI	On-Demand	Anodyne	KCNA3	41	37
Cc1cccc(Cl)c1C(=O)NCC1(c2ccncc2)CCCC1	ZINC000450503214	EI	On-Demand	Anodyne	SLC6A9	35	43
Cc1cccc(Cl)c1C(=O)NCC1(c2ccncc2)CCCC1	ZINC000450503214	EI	On-Demand	Anodyne	ACAT	0	53
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1	ZINC000450503222	EH	On-Demand	Anodyne	MAPK14	22	41
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1	ZINC000450503222	EH	On-Demand	Anodyne	CSNK1D	19	41
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1	ZINC000450503222	EH	On-Demand	Anodyne	P2RY1	16	42
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1	ZINC000450503223	EH	On-Demand	Anodyne	MAPK14	22	41
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1	ZINC000450503223	EH	On-Demand	Anodyne	CSNK1D	19	41
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1	ZINC000450503223	EH	On-Demand	Anodyne	P2RY1	16	42
CCC(=O)CCCN1CCc2c(F)cc(F)cc2C1	ZINC000450503231	CG	On-Demand	Anodyne	HTR5A	24	43
COc1cccc(OCCN2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503238	FD	On-Demand	Anodyne	HTR1A	18	42
COc1cccc(OCCN2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503238	FD	On-Demand	Anodyne	DRD2	15	48
COc1cccc(OCCN2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503238	FD	On-Demand	Anodyne	DRD4	46	35
COc1cccc(OCCN2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503238	FD	On-Demand	Anodyne	LTA4H	28	47
COc1cccc(OCCN2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503238	FD	On-Demand	Anodyne	HTR7	19	41
COc1cccc(OCCN2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503238	FD	On-Demand	Anodyne	HRH3	24	52
COc1cccc(OCCN2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503238	FD	On-Demand	Anodyne	ABCB1	25	43
COc1cccc(OCCN2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503238	FD	On-Demand	Anodyne	CHRNA10	18	41
COc1cccc(OCCN2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503240	FD	On-Demand	Anodyne	HTR1A	18	42
COc1cccc(OCCN2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503240	FD	On-Demand	Anodyne	DRD2	15	48
COc1cccc(OCCN2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503240	FD	On-Demand	Anodyne	DRD4	46	35
COc1cccc(OCCN2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503240	FD	On-Demand	Anodyne	LTA4H	28	47
COc1cccc(OCCN2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503240	FD	On-Demand	Anodyne	HTR7	19	41
COc1cccc(OCCN2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503240	FD	On-Demand	Anodyne	HRH3	24	52
COc1cccc(OCCN2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503240	FD	On-Demand	Anodyne	ABCB1	25	43
COc1cccc(OCCN2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450503240	FD	On-Demand	Anodyne	CHRNA10	18	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC(C)(C#N)CC1	ZINC000450503256	DF	On-Demand	Mild	GHRHR	57	34
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(C)(C#N)CC1	ZINC000450503257	DF	On-Demand	Mild	GHRHR	57	34
COc1cc(CC(=O)N2CCC(CCCN3CCOCC3)CC2)ccc1Cl	ZINC000450503271	GG	On-Demand	Anodyne	ACHE	18	41
COc1cc(CC(=O)N2CCC(CCCN3CCOCC3)CC2)ccc1Cl	ZINC000450503271	GG	On-Demand	Anodyne	OPRK1	41	39
COc1cc(CC(=O)N2CCC(CCCN3CCOCC3)CC2)ccc1Cl	ZINC000450503271	GG	On-Demand	Anodyne	HTR4	76	41
COc1cc(CC(=O)N2CCC(CCCN3CCOCC3)CC2)ccc1Cl	ZINC000450503271	GG	On-Demand	Anodyne	SIGMAR1	25	46
COc1cc(CC(=O)N2CCC(CCCN3CCOCC3)CC2)ccc1Cl	ZINC000450503271	GG	On-Demand	Anodyne	CCR3	30	42
CC(=O)c1cccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1	ZINC000450503272	DH	On-Demand	Bother	CACNA1C	51	38
CC(=O)c1cccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1	ZINC000450503272	DH	On-Demand	Bother	CACNA1D	81	36
CC(=O)c1cccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1	ZINC000450503272	DH	On-Demand	Bother	LUXR	17	45
COc1cc(C)c(C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450503275	FG	On-Demand	Anodyne	OXTR	0	42
COc1cc(C)c(C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)cc1OC	ZINC000450503275	FG	On-Demand	Anodyne	PTGES	0	43
COc1cc(C)c(C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450503276	FG	On-Demand	Anodyne	OXTR	0	42
COc1cc(C)c(C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)cc1OC	ZINC000450503276	FG	On-Demand	Anodyne	PTGES	0	43
CNS(=O)(=O)NCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450503284	EC	On-Demand	Bother	COLA	22	40
CNS(=O)(=O)NCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450503284	EC	On-Demand	Bother	MMP8	26	41
CNS(=O)(=O)NCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450503284	EC	On-Demand	Bother	MMP1	36	44
CNS(=O)(=O)NCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450503284	EC	On-Demand	Bother	SLC27A4	50	33
CN(C)c1ncccc1O[C@H]1CCN(c2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450503295	GG	On-Demand	Bother	PDE3A	46	38
CN(C)c1ncccc1O[C@H]1CCN(c2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450503295	GG	On-Demand	Bother	PDE3B	69	38
CN(C)c1ncccc1O[C@@H]1CCN(c2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450503296	GG	On-Demand	Bother	PDE3A	46	38
CN(C)c1ncccc1O[C@@H]1CCN(c2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450503296	GG	On-Demand	Bother	PDE3B	69	38
CC(C)CC(CC(C)C)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503297	EI	On-Demand	Anodyne	CCR1	24	40
CC(C)CC(CC(C)C)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503297	EI	On-Demand	Anodyne	MAP3K7	42	31
COc1ccc(F)cc1CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503302	FG	On-Demand	Anodyne	TSPO	42	45
COc1ccc(F)cc1CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503302	FG	On-Demand	Anodyne	PTGDR2	15	40
COc1ccc(F)cc1CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503302	FG	On-Demand	Anodyne	PTGES	23	44
COc1ccc(F)cc1CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503303	FG	On-Demand	Anodyne	TSPO	42	45
COc1ccc(F)cc1CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503303	FG	On-Demand	Anodyne	PTGDR2	15	40
COc1ccc(F)cc1CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503303	FG	On-Demand	Anodyne	PTGES	23	44
CC1(O)CC(C(=O)Nc2ccc3[nH]nc(NC(=O)C4CC(C)(O)C4)c3c2)C1	ZINC000450503316	FD	On-Demand	Anodyne	GSK3B	25	45
CC1(O)CC(C(=O)Nc2ccc3[nH]nc(NC(=O)C4CC(C)(O)C4)c3c2)C1	ZINC000450503316	FD	On-Demand	Anodyne	ITK	17	44
CC1(O)CC(C(=O)Nc2ccc3[nH]nc(NC(=O)C4CC(C)(O)C4)c3c2)C1	ZINC000450503316	FD	On-Demand	Anodyne	GSK3A	54	45
CC1(O)CC(C(=O)Nc2ccc3[nH]nc(NC(=O)C4CC(C)(O)C4)c3c2)C1	ZINC000450503316	FD	On-Demand	Anodyne	CDK2	18	45
Cc1csc(C(=O)N(C)Cc2cnc(N(C)C)nc2)c1	ZINC000450503318	CE	On-Demand	Anodyne	HSD17B2	19	42
O=C(C[C@H]1CSc2ccccc2O1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503323	GH	On-Demand	Anodyne	MAP3K7	48	34
O=C(C[C@@H]1CSc2ccccc2O1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503324	GH	On-Demand	Anodyne	MAP3K7	48	34
Oc1cccc([C@H]2CN(C[C@H]3CCCCC3(F)F)CCO2)c1	ZINC000450503330	DH	On-Demand	Anodyne	OPRM1	24	44
Oc1cccc([C@H]2CN(C[C@H]3CCCCC3(F)F)CCO2)c1	ZINC000450503330	DH	On-Demand	Anodyne	OPRK1	26	44
Oc1cccc([C@H]2CN(C[C@@H]3CCCCC3(F)F)CCO2)c1	ZINC000450503331	DH	On-Demand	Anodyne	OPRM1	24	44
Oc1cccc([C@H]2CN(C[C@@H]3CCCCC3(F)F)CCO2)c1	ZINC000450503331	DH	On-Demand	Anodyne	OPRK1	26	44
Oc1cccc([C@@H]2CN(C[C@@H]3CCCCC3(F)F)CCO2)c1	ZINC000450503332	DH	On-Demand	Anodyne	OPRM1	24	44
Oc1cccc([C@@H]2CN(C[C@@H]3CCCCC3(F)F)CCO2)c1	ZINC000450503332	DH	On-Demand	Anodyne	OPRK1	26	44
Oc1cccc([C@@H]2CN(C[C@H]3CCCCC3(F)F)CCO2)c1	ZINC000450503333	DH	On-Demand	Anodyne	OPRM1	24	44
Oc1cccc([C@@H]2CN(C[C@H]3CCCCC3(F)F)CCO2)c1	ZINC000450503333	DH	On-Demand	Anodyne	OPRK1	26	44
CN(C)c1ncccc1O[C@H]1CCN(c2nc3c(cc2C#N)COCC3)C1	ZINC000450503341	FE	On-Demand	Mild	PDE3A	30	41
CN(C)c1ncccc1O[C@H]1CCN(c2nc3c(cc2C#N)COCC3)C1	ZINC000450503341	FE	On-Demand	Mild	PDE3B	53	34
CN(C)c1ncccc1O[C@@H]1CCN(c2nc3c(cc2C#N)COCC3)C1	ZINC000450503342	FE	On-Demand	Mild	PDE3A	30	41
CN(C)c1ncccc1O[C@@H]1CCN(c2nc3c(cc2C#N)COCC3)C1	ZINC000450503342	FE	On-Demand	Mild	PDE3B	53	34
C[C@@H]1Cc2cccc(C(=O)N3CCC(n4cc(Cl)cn4)CC3)c2O1	ZINC000450503345	EG	On-Demand	Anodyne	MAP3K7	47	33
C[C@H]1Cc2cccc(C(=O)N3CCC(n4cc(Cl)cn4)CC3)c2O1	ZINC000450503346	EG	On-Demand	Anodyne	MAP3K7	47	33
CC(=O)c1ccc(CN(C)[C@@H](C)Cc2ccc(O)cc2)cc1	ZINC000450503351	CH	On-Demand	Anodyne	SLC15A2	0	40
CC(=O)c1ccc(CN(C)[C@H](C)Cc2ccc(O)cc2)cc1	ZINC000450503352	CH	On-Demand	Anodyne	SLC15A2	0	40
CC(C)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450503356	CE	On-Demand	Anodyne	PTGES2	57	33
CC(C)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450503356	CE	On-Demand	Anodyne	NCE103	27	50
CC(=O)N1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)CC12CCCCC2	ZINC000450503372	GG	On-Demand	Anodyne	SLC12A5	76	40
CCc1cccc(C(=O)NCCNC(=O)c2cc[nH]n2)n1	ZINC000450503377	CC	On-Demand	Anodyne	PDE5A	28	43
COCCn1cc(CNc2ccnc3cc(F)c(Cl)cc23)cn1	ZINC000450503378	EG	On-Demand	Anodyne	HRP1_PLAFA	67	36
COCCn1cc(CNc2ccnc3cc(F)c(Cl)cc23)cn1	ZINC000450503378	EG	On-Demand	Anodyne	HNMT	48	33
Cc1nc(NCc2ccncc2OCC(F)F)ncc1[N+](=O)[O-]	ZINC000450503411	ED	On-Demand	Bother	PRKCQ	45	39
COCCn1cc(CNc2nc(N(C)C)c3ccccc3n2)cn1	ZINC000450503416	ED	On-Demand	Anodyne	ADRA2A	15	44
COc1cc(Cl)c(C(=O)N(C2CC2)[C@H](C)C(=O)O)cc1OC	ZINC000450503426	EE	On-Demand	Anodyne	HTR4	46	37
COc1cc(Cl)c(C(=O)N(C2CC2)[C@@H](C)C(=O)O)cc1OC	ZINC000450503427	EE	On-Demand	Anodyne	HTR4	46	37
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	DRD1	16	48
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	HTR2A	20	48
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	HTR2C	17	51
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCn2c(nnc2C2CCCC2)C1)c1ccc(F)cc1	ZINC000450503429	FH	On-Demand	Anodyne	CYP2J2	49	35
CC(=O)c1ccc(CN2CC[C@@H](Oc3ccncc3)C2)cc1	ZINC000450503450	CF	On-Demand	Anodyne	SIGMAR1	22	42
CC(=O)c1ccc(CN2CC[C@H](Oc3ccncc3)C2)cc1	ZINC000450503451	CF	On-Demand	Anodyne	SIGMAR1	22	42
CNC(=O)c1cc([N+](=O)[O-])ccc1SCCC(=O)OC(C)(C)C	ZINC000450503461	EF	On-Demand	Bother	GSTM2	24	42
COc1ccc(S(=O)(=O)N2CCCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503467	GC	On-Demand	Anodyne	MMP13	39	41
COc1ccc(S(=O)(=O)N2CCCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503467	GC	On-Demand	Anodyne	MMP3	35	41
COc1ccc(S(=O)(=O)N2CCCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503467	GC	On-Demand	Anodyne	MMP8	26	42
COc1ccc(S(=O)(=O)N2CCCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503467	GC	On-Demand	Anodyne	MMP9	36	41
COc1ccc(S(=O)(=O)N2CCCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503467	GC	On-Demand	Anodyne	PKM	20	61
COc1ccc(S(=O)(=O)N2CCCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503467	GC	On-Demand	Anodyne	MMP7	46	42
COc1ccc(S(=O)(=O)N2CCCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503467	GC	On-Demand	Anodyne	MMP1	41	39
COc1ccc(S(=O)(=O)N2CCCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503468	GC	On-Demand	Anodyne	MMP13	39	41
COc1ccc(S(=O)(=O)N2CCCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503468	GC	On-Demand	Anodyne	MMP3	35	41
COc1ccc(S(=O)(=O)N2CCCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503468	GC	On-Demand	Anodyne	MMP8	26	42
COc1ccc(S(=O)(=O)N2CCCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503468	GC	On-Demand	Anodyne	MMP9	36	41
COc1ccc(S(=O)(=O)N2CCCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503468	GC	On-Demand	Anodyne	PKM	20	61
COc1ccc(S(=O)(=O)N2CCCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503468	GC	On-Demand	Anodyne	MMP7	46	42
COc1ccc(S(=O)(=O)N2CCCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450503468	GC	On-Demand	Anodyne	MMP1	41	39
Cc1ccc(C)c(N2CCN(CC[C@H](C)O)CC2)c1	ZINC000450503477	CE	On-Demand	Anodyne	HTR1A	23	43
Cc1ccc(C)c(N2CCN(CC[C@@H](C)O)CC2)c1	ZINC000450503478	CE	On-Demand	Anodyne	HTR1A	23	43
COc1cc(Cl)c(C(=O)N2CCC(CC(=O)O)CC2)cc1OC	ZINC000450503479	EF	On-Demand	Anodyne	DRD2	20	40
COc1cc(Cl)c(C(=O)N2CCC(CC(=O)O)CC2)cc1OC	ZINC000450503479	EF	On-Demand	Anodyne	HTR4	75	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)[C@H]2CCCN2C)CC1	ZINC000450503480	ED	On-Demand	Anodyne	PREP	52	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)[C@@H]2CCCN2C)CC1	ZINC000450503481	ED	On-Demand	Anodyne	PREP	52	39
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)[C@@H]2CCCN2C)CC1	ZINC000450503482	ED	On-Demand	Anodyne	PREP	52	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)[C@H]2CCCN2C)CC1	ZINC000450503483	ED	On-Demand	Anodyne	PREP	52	39
CCOC(=O)CC(C)(C)N(C)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450503487	EF	On-Demand	Anodyne	AMY2	42	29
CCOC(=O)CC(C)(C)N(C)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450503488	EF	On-Demand	Anodyne	AMY2	42	29
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC2(CCCCC2)C1	ZINC000450503493	EJ	On-Demand	Anodyne	RBP4	90	43
COC1(CNC(=O)c2ccc(I)cc2F)CCC1	ZINC000450503497	FF	On-Demand	Anodyne	MAP2K1	52	32
COc1cccc(OCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450503514	FD	On-Demand	Anodyne	ADRB1	0	41
COc1cccc(OCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450503514	FD	On-Demand	Anodyne	DRD2	15	41
COc1cccc(OCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450503514	FD	On-Demand	Anodyne	DRD4	42	33
COc1cccc(OCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450503514	FD	On-Demand	Anodyne	DRD3	15	40
COc1cccc(OCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450503514	FD	On-Demand	Anodyne	LTA4H	26	42
COc1cccc(OCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450503514	FD	On-Demand	Anodyne	HRH3	22	53
COc1cccc(OCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450503514	FD	On-Demand	Anodyne	SIGMAR1	17	41
COc1cccc(OCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450503514	FD	On-Demand	Anodyne	CHRNA10	22	41
CN(Cc1cnc(N(C)C)nc1)C(=O)C[C@H]1COc2ccccc2O1	ZINC000450503529	ED	On-Demand	Anodyne	ADRA2B	20	40
CN(Cc1cnc(N(C)C)nc1)C(=O)C[C@@H]1COc2ccccc2O1	ZINC000450503530	ED	On-Demand	Anodyne	ADRA2B	20	40
CC(C)(CC(=O)Nc1cc(C(F)(F)F)ccn1)C1CC1	ZINC000450503533	CH	On-Demand	Anodyne	CCR2	46	35
CC(C)(CC(=O)Nc1cc(C(F)(F)F)ccn1)C1CC1	ZINC000450503533	CH	On-Demand	Anodyne	TYK2	54	35
COC(=O)c1coc(CN2CCN(c3cc(C)ccc3C)CC2)n1	ZINC000450503540	EE	On-Demand	Anodyne	DRD2	23	48
COC(=O)c1coc(CN2CCN(c3cc(C)ccc3C)CC2)n1	ZINC000450503540	EE	On-Demand	Anodyne	DRD1	17	48
CCOc1ccc(NC(=O)CN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450503553	FH	On-Demand	Anodyne	LTA4H	25	42
CCOc1ccc(NC(=O)CN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450503553	FH	On-Demand	Anodyne	NOD2	24	41
CCS(=O)(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1	ZINC000450503571	DF	On-Demand	Anodyne	SIGMAR1	38	41
CCS(=O)(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1	ZINC000450503571	DF	On-Demand	Anodyne	SSTR5	34	41
CCOC(=O)c1csc(N2Cc3ccc(C)cc3C2)n1	ZINC000450503577	CG	On-Demand	Anodyne	DPP9	15	43
Cc1nc(N[C@@H]2C[C@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-]	ZINC000450503585	DG	On-Demand	Bother	PRKCQ	23	42
Cc1csc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450503591	DG	On-Demand	Anodyne	MAP3K7	49	36
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503597	EH	On-Demand	Anodyne	MAP3K7	50	38
Clc1ccc(N2CCOCC2)c(CNc2nccc(-c3cnccn3)n2)c1	ZINC000450503601	GG	On-Demand	Anodyne	MAPK1	42	35
Clc1ccc(N2CCOCC2)c(CNc2nccc(-c3cnccn3)n2)c1	ZINC000450503601	GG	On-Demand	Anodyne	EPHB4	53	36
Clc1ccc(N2CCOCC2)c(CNc2nccc(-c3cnccn3)n2)c1	ZINC000450503601	GG	On-Demand	Anodyne	STAT6	53	34
Clc1ccc(N2CCOCC2)c(CNc2nccc(-c3cnccn3)n2)c1	ZINC000450503601	GG	On-Demand	Anodyne	SMG1	55	45
CN(C)c1ncccc1O[C@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc23)C1	ZINC000450503604	GG	On-Demand	Bother	PDE3A	48	41
CN(C)c1ncccc1O[C@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc23)C1	ZINC000450503604	GG	On-Demand	Bother	PDE3B	72	41
CN(C)c1ncccc1O[C@@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc23)C1	ZINC000450503605	GG	On-Demand	Bother	PDE3A	48	41
CN(C)c1ncccc1O[C@@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc23)C1	ZINC000450503605	GG	On-Demand	Bother	PDE3B	72	41
O=C(CCc1ccc2ccccc2c1O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503610	GI	On-Demand	Anodyne	MAP3K7	43	35
COc1cccc(C2(F)CCN(c3ccc4c(n3)CCCC4=O)CC2)c1	ZINC000450503611	FI	On-Demand	Anodyne	GALR2	42	34
CN(C)c1ncccc1O[C@H]1CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450503612	FF	On-Demand	Mild	PDE3A	22	42
CN(C)c1ncccc1O[C@H]1CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450503612	FF	On-Demand	Mild	PDE3B	33	42
CN(C)c1ncccc1O[C@@H]1CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450503613	FF	On-Demand	Mild	PDE3A	22	42
CN(C)c1ncccc1O[C@@H]1CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450503613	FF	On-Demand	Mild	PDE3B	33	42
Cn1nc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)c2c1CCCC2	ZINC000450503614	EF	On-Demand	Anodyne	MAP3K7	46	32
CN1CCC(C)(CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450503615	EH	On-Demand	Anodyne	SLC6A1	22	40
CN1CCC(C)(CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450503615	EH	On-Demand	Anodyne	SLC6A3	15	44
CN1CCC(C)(CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450503615	EH	On-Demand	Anodyne	EPHX2	23	45
C[C@@H](Oc1ccccn1)C(=O)NCC1(C)CCN(C)CC1	ZINC000450503623	CD	On-Demand	Anodyne	HCN1	44	33
C[C@H](Oc1ccccn1)C(=O)NCC1(C)CCN(C)CC1	ZINC000450503624	CD	On-Demand	Anodyne	HCN1	44	33
CC(C)(C(=O)N1CCC(n2cc(Cl)cn2)CC1)c1cccc2ccccc12	ZINC000450503629	GJ	On-Demand	Anodyne	MAP3K7	49	35
O=C(c1cccc(C(F)(F)F)n1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450503630	GG	On-Demand	Anodyne	CASR	41	41
O=C(c1cccc(C(F)(F)F)n1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450503630	GG	On-Demand	Anodyne	EPHX2	21	42
CSCC[C@H](O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450503631	DE	On-Demand	Bother	COLA	22	40
CSCC[C@H](O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450503631	DE	On-Demand	Bother	SLC27A4	48	31
CSCC[C@@H](O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450503632	DE	On-Demand	Bother	COLA	22	40
CSCC[C@@H](O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450503632	DE	On-Demand	Bother	SLC27A4	48	31
COC(=O)c1ccc(CNC(=O)Cc2ccc(O)c(OC)c2)nc1C1CC1	ZINC000450503635	FE	On-Demand	Anodyne	TRPV1	29	51
O=C(c1cc(Cl)c2ccccc2n1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503636	GI	On-Demand	Anodyne	CCR3	22	43
O=C(c1cc(Cl)c2ccccc2n1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503636	GI	On-Demand	Anodyne	MAP3K7	48	37
O=C(c1ocnc1-c1ccccc1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450503659	GG	On-Demand	Anodyne	CYP2J2	43	32
COC(=O)[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccccc1	ZINC000450503660	EF	On-Demand	Anodyne	SLC6A1	121	46
COC(=O)[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccccc1	ZINC000450503660	EF	On-Demand	Anodyne	SLC6A3	48	46
Cc1ccncc1N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450503662	GG	On-Demand	Anodyne	PDE3B	42	35
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	HTR1A	44	42
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	DRD2	35	46
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	DRD1	22	41
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	DRD4	40	33
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	ADRA1A	24	41
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	DRD3	53	46
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	CPT1A	47	34
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	HCN1	72	40
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	HCN4	47	33
COc1ccccc1-n1cnc2cc(C(=O)NCC3(C)CCN(C)CC3)ccc21	ZINC000450503663	GG	On-Demand	Anodyne	HPGD	48	58
CN1CCO[C@H]2CN(C[C@H](O)Cc3ccccc3)C[C@H]21	ZINC000450503692	CC	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cc(CC(=O)N[C@@H](C)[C@H]2CCCOC2)ccc1Cl	ZINC000450503700	DF	On-Demand	Anodyne	AVPR1A	0	40
COc1cc(CC(=O)N[C@H](C)[C@@H]2CCCOC2)ccc1Cl	ZINC000450503701	DF	On-Demand	Anodyne	AVPR1A	0	40
COc1cc(CC(=O)N[C@@H](C)[C@@H]2CCCOC2)ccc1Cl	ZINC000450503702	DF	On-Demand	Anodyne	AVPR1A	0	40
COc1cc(CC(=O)N[C@H](C)[C@H]2CCCOC2)ccc1Cl	ZINC000450503703	DF	On-Demand	Anodyne	AVPR1A	0	40
CC[C@@](NC(=O)c1cc(OC)c(OC)cc1Cl)(C(=O)O)c1ccccc1	ZINC000450503715	GG	On-Demand	Anodyne	ECR	40	37
CC[C@](NC(=O)c1cc(OC)c(OC)cc1Cl)(C(=O)O)c1ccccc1	ZINC000450503716	GG	On-Demand	Anodyne	ECR	40	37
Cc1onc(C2CC2)c1C(=O)N[C@@H](C)Cc1ccccc1C(F)(F)F	ZINC000450503717	FI	On-Demand	Anodyne	P2RX7	15	40
Cc1onc(C2CC2)c1C(=O)N[C@H](C)Cc1ccccc1C(F)(F)F	ZINC000450503718	FI	On-Demand	Anodyne	P2RX7	15	40
C[C@H](O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450503727	EG	On-Demand	Anodyne	RBP4	73	40
C[C@@H](O)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450503728	EG	On-Demand	Anodyne	RBP4	73	40
C[C@@H](O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450503729	EG	On-Demand	Anodyne	RBP4	73	40
CC(C)CC(CC(C)C)C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000450503736	DD	On-Demand	Anodyne	ALPL	40	35
C[C@H](C(=O)O)N(C(=O)Cc1ccc(Cl)c(F)c1)C1CC1	ZINC000450503748	CE	On-Demand	Anodyne	OPRK1	23	41
C[C@H](C(=O)O)N(C(=O)Cc1ccc(Cl)c(F)c1)C1CC1	ZINC000450503748	CE	On-Demand	Anodyne	ENV	41	32
C[C@@H](C(=O)O)N(C(=O)Cc1ccc(Cl)c(F)c1)C1CC1	ZINC000450503749	CE	On-Demand	Anodyne	OPRK1	23	41
C[C@@H](C(=O)O)N(C(=O)Cc1ccc(Cl)c(F)c1)C1CC1	ZINC000450503749	CE	On-Demand	Anodyne	ENV	41	32
CC(C)(CCC(=O)O)NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1	ZINC000450503750	GI	On-Demand	Anodyne	MAP	0	61
COc1cc(-c2noc(CN3CC[C@@H](Oc4ccncc4)C3)n2)ncn1	ZINC000450503759	FD	On-Demand	Anodyne	PDE3A	38	41
COc1cc(-c2noc(CN3CC[C@@H](Oc4ccncc4)C3)n2)ncn1	ZINC000450503759	FD	On-Demand	Anodyne	PDE3B	33	41
COc1cc(-c2noc(CN3CC[C@H](Oc4ccncc4)C3)n2)ncn1	ZINC000450503760	FD	On-Demand	Anodyne	PDE3A	38	41
COc1cc(-c2noc(CN3CC[C@H](Oc4ccncc4)C3)n2)ncn1	ZINC000450503760	FD	On-Demand	Anodyne	PDE3B	33	41
CC(C)(CCC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450503761	DF	On-Demand	Anodyne	NCE103	25	46
CC(C)(CCC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450503761	DF	On-Demand	Anodyne	PFK	0	41
CC(C)(CCC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450503761	DF	On-Demand	Anodyne	CAN2	0	46
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503762	EI	On-Demand	Mild	MC4R	38	41
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503762	EI	On-Demand	Mild	PRCP	54	40
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503762	EI	On-Demand	Mild	MC3R	47	41
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503762	EI	On-Demand	Mild	MC5R	33	41
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503762	EI	On-Demand	Mild	MTNR1B	0	41
CC1(C#N)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503763	EI	On-Demand	Mild	MC4R	38	41
CC1(C#N)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503763	EI	On-Demand	Mild	PRCP	54	40
CC1(C#N)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503763	EI	On-Demand	Mild	MC3R	47	41
CC1(C#N)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503763	EI	On-Demand	Mild	MC5R	33	41
CC1(C#N)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503763	EI	On-Demand	Mild	MTNR1B	0	41
COc1ccccc1CCNC(=O)CNc1ccc2c(n1)CCCC2=O	ZINC000450503770	FD	On-Demand	Anodyne	MBTPS1	44	35
Cc1ccn(-c2ccccc2C(=O)N2CCC(n3cc(Cl)cn3)CC2)n1	ZINC000450503784	FH	On-Demand	Anodyne	AVPR2	18	40
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	DRD2	27	50
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	DRD4	60	50
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	ACHE	26	48
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	DRD3	22	45
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	CHRM3	23	43
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	FABP4	39	47
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	SIGMAR1	59	54
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	CCR3	52	39
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	MLNR	51	39
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	MCHR1	33	43
CC(=O)c1ccc(CN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC000450503788	EG	On-Demand	Anodyne	CACNA1G	37	45
COC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCC1	ZINC000450503805	DE	On-Demand	Anodyne	PDEC	0	42
COC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCC1	ZINC000450503806	DE	On-Demand	Anodyne	PDEC	0	42
O=C(CCC(=O)N1CCC(n2cc(Cl)cn2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000450503807	GG	On-Demand	Bother	MAP3K7	35	42
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503818	DH	On-Demand	Anodyne	MME	35	42
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503818	DH	On-Demand	Anodyne	CTSK	22	40
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503818	DH	On-Demand	Anodyne	PAM	0	40
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503818	DH	On-Demand	Anodyne	CTSH	26	40
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503818	DH	On-Demand	Anodyne	ACE2	48	38
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503818	DH	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503820	DH	On-Demand	Anodyne	ACE	24	43
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503820	DH	On-Demand	Anodyne	MME	44	43
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503820	DH	On-Demand	Anodyne	CTSK	26	40
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503820	DH	On-Demand	Anodyne	MMP3	17	40
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503820	DH	On-Demand	Anodyne	PAM	0	40
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503820	DH	On-Demand	Anodyne	CTSH	26	40
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503820	DH	On-Demand	Anodyne	ACE2	48	38
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450503820	DH	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503822	DH	On-Demand	Anodyne	MME	35	42
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503822	DH	On-Demand	Anodyne	CTSK	22	40
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503822	DH	On-Demand	Anodyne	PAM	0	40
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503822	DH	On-Demand	Anodyne	CTSH	26	40
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503822	DH	On-Demand	Anodyne	ACE2	48	38
CCCC[C@@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503822	DH	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503823	DH	On-Demand	Anodyne	MME	35	42
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503823	DH	On-Demand	Anodyne	CTSK	22	40
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503823	DH	On-Demand	Anodyne	PAM	0	40
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503823	DH	On-Demand	Anodyne	CTSH	26	40
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503823	DH	On-Demand	Anodyne	ACE2	48	38
CCCC[C@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450503823	DH	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
CCCOc1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)c(OC)c1	ZINC000450503825	GH	On-Demand	Anodyne	OXTR	32	47
N#Cc1ccnc(NC2CC(F)(c3cccc(Cl)c3)C2)n1	ZINC000450503829	DG	On-Demand	Mild	CTSZ	0	40
Fc1ccc(CN2CCC(C(F)F)CC2)cc1CN1CCC(C(F)F)CC1	ZINC000450503842	GJ	On-Demand	Anodyne	SIGMAR1	31	44
CCOc1ccc(NC(=O)CN2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450503847	GE	On-Demand	Anodyne	ACOX1	52	40
CCOc1ccc(NC(=O)CN2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450503849	GE	On-Demand	Anodyne	ACOX1	52	40
CCOC(=O)[C@@H]1CC[C@H](Nc2ncnc3[nH]c4ccccc4c23)C1	ZINC000450503874	DG	On-Demand	Anodyne	UTS2R	15	42
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@@H](C)Oc2ccccn2)c1	ZINC000450503885	FH	On-Demand	Anodyne	GRM4	42	38
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@@H](C)Oc2ccccn2)c1	ZINC000450503885	FH	On-Demand	Anodyne	IMDH_CRYPV	61	40
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@H](C)Oc2ccccn2)c1	ZINC000450503887	FH	On-Demand	Anodyne	GRM4	42	38
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@H](C)Oc2ccccn2)c1	ZINC000450503887	FH	On-Demand	Anodyne	IMDH_CRYPV	61	40
COCCOC[C@@H](O)CN1CCN(c2cc(C)ccn2)CC1	ZINC000450503895	DC	On-Demand	Anodyne	ACOX1	71	33
COCCOC[C@@H](O)CN1CCN(c2cc(C)ccn2)CC1	ZINC000450503895	DC	On-Demand	Anodyne	ABCB1	49	40
COCCOC[C@@H](O)CN1CCN(c2cc(C)ccn2)CC1	ZINC000450503895	DC	On-Demand	Anodyne	HSP90AB1	44	48
COCCOC[C@H](O)CN1CCN(c2cc(C)ccn2)CC1	ZINC000450503897	DC	On-Demand	Anodyne	ACOX1	71	33
COCCOC[C@H](O)CN1CCN(c2cc(C)ccn2)CC1	ZINC000450503897	DC	On-Demand	Anodyne	ABCB1	49	40
COCCOC[C@H](O)CN1CCN(c2cc(C)ccn2)CC1	ZINC000450503897	DC	On-Demand	Anodyne	HSP90AB1	44	48
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450503900	DE	On-Demand	Mild	MAP3K7	48	33
CC(=O)c1ccc(CN2CCN(C(=O)[C@H]3CCCN3C)CC2)cc1	ZINC000450503907	ED	On-Demand	Anodyne	HRH3	29	44
CC(=O)c1ccc(CN2CCN(C(=O)[C@H]3CCCN3C)CC2)cc1	ZINC000450503907	ED	On-Demand	Anodyne	PREP	41	42
CC(=O)c1ccc(CN2CCN(C(=O)[C@H]3CCCN3C)CC2)cc1	ZINC000450503907	ED	On-Demand	Anodyne	L3MBTL1	0	43
CC(=O)c1ccc(CN2CCN(C(=O)[C@@H]3CCCN3C)CC2)cc1	ZINC000450503909	ED	On-Demand	Anodyne	HRH3	29	44
CC(=O)c1ccc(CN2CCN(C(=O)[C@@H]3CCCN3C)CC2)cc1	ZINC000450503909	ED	On-Demand	Anodyne	PREP	41	42
CC(=O)c1ccc(CN2CCN(C(=O)[C@@H]3CCCN3C)CC2)cc1	ZINC000450503909	ED	On-Demand	Anodyne	L3MBTL1	0	43
COC(=O)c1csc(CN2CCN(Cc3cccc(F)c3)CC2)n1	ZINC000450503911	EE	On-Demand	Anodyne	SIGMAR1	26	45
COC(=O)c1csc(CN2CCN(Cc3cccc(F)c3)CC2)n1	ZINC000450503911	EE	On-Demand	Anodyne	FAAH	19	40
COC(=O)c1csc(CN2CCN(Cc3cccc(F)c3)CC2)n1	ZINC000450503911	EE	On-Demand	Anodyne	MCHR1	19	40
COC(=O)c1csc(CN2CCN(Cc3cccc(F)c3)CC2)n1	ZINC000450503911	EE	On-Demand	Anodyne	CACNA1G	31	43
CN(C(=O)[C@@H]1CCN(c2nc3cccc(F)c3s2)C1)c1ccccc1	ZINC000450503912	FH	On-Demand	Anodyne	FASN	40	34
CSc1cccc(C(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450503914	FG	On-Demand	Anodyne	ITGAL	41	34
CSc1cccc(C(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450503914	FG	On-Demand	Anodyne	CASR	20	41
CN(C(=O)[C@H]1CCN(c2nc3cccc(F)c3s2)C1)c1ccccc1	ZINC000450503916	FH	On-Demand	Anodyne	FASN	40	34
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCc2nncn2C1	ZINC000450503928	DD	On-Demand	Anodyne	TYK2	62	38
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCc2nncn2C1	ZINC000450503929	DD	On-Demand	Anodyne	TYK2	62	38
CCOC(=O)c1ccc(CN2CCO[C@@H](c3cccc(O)c3)C2)nc1	ZINC000450503933	EF	On-Demand	Anodyne	KIF11	0	40
CCOC(=O)c1ccc(CN2CCO[C@H](c3cccc(O)c3)C2)nc1	ZINC000450503934	EF	On-Demand	Anodyne	KIF11	0	40
COC1(CNC(=O)c2ccsc2Br)CCC1	ZINC000450503941	DF	On-Demand	Anodyne	HCN1	49	32
COC1(CNC(=O)c2ccsc2Br)CCC1	ZINC000450503941	DF	On-Demand	Anodyne	HCN4	47	32
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503964	EI	On-Demand	Mild	MC4R	38	41
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503964	EI	On-Demand	Mild	PRCP	54	40
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503964	EI	On-Demand	Mild	MC3R	47	41
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503964	EI	On-Demand	Mild	MC5R	33	41
CC1(C#N)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503964	EI	On-Demand	Mild	MTNR1B	0	41
CC1(C#N)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503965	EI	On-Demand	Mild	MC4R	38	41
CC1(C#N)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503965	EI	On-Demand	Mild	PRCP	54	40
CC1(C#N)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503965	EI	On-Demand	Mild	MC3R	47	41
CC1(C#N)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503965	EI	On-Demand	Mild	MC5R	33	41
CC1(C#N)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450503965	EI	On-Demand	Mild	MTNR1B	0	41
CC1(C#N)CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450503985	EH	On-Demand	Mild	RBP4	90	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@H]2CCCOC2)cc1	ZINC000450503991	GF	On-Demand	Anodyne	MMP13	19	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@H]2CCCOC2)cc1	ZINC000450503991	GF	On-Demand	Anodyne	CAPNS1	20	50
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@H]2CCCOC2)cc1	ZINC000450503991	GF	On-Demand	Anodyne	MMP3	15	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@H]2CCCOC2)cc1	ZINC000450503991	GF	On-Demand	Anodyne	CAPN1	30	45
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@H]2CCCOC2)cc1	ZINC000450503991	GF	On-Demand	Anodyne	CAPN2	24	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@H]2CCCOC2)cc1	ZINC000450503991	GF	On-Demand	Anodyne	FPR1	32	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@H]2CCCOC2)cc1	ZINC000450503991	GF	On-Demand	Anodyne	LEF	48	38
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503992	GF	On-Demand	Anodyne	MMP13	19	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503992	GF	On-Demand	Anodyne	CAPNS1	20	50
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503992	GF	On-Demand	Anodyne	MMP3	15	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503992	GF	On-Demand	Anodyne	CAPN1	30	45
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503992	GF	On-Demand	Anodyne	CAPN2	24	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503992	GF	On-Demand	Anodyne	FPR1	32	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503992	GF	On-Demand	Anodyne	LEF	48	38
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@H]2CCCOC2)cc1	ZINC000450503993	GF	On-Demand	Anodyne	MMP13	19	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@H]2CCCOC2)cc1	ZINC000450503993	GF	On-Demand	Anodyne	CAPNS1	20	50
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@H]2CCCOC2)cc1	ZINC000450503993	GF	On-Demand	Anodyne	MMP3	15	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@H]2CCCOC2)cc1	ZINC000450503993	GF	On-Demand	Anodyne	CAPN1	30	45
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@H]2CCCOC2)cc1	ZINC000450503993	GF	On-Demand	Anodyne	CAPN2	24	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@H]2CCCOC2)cc1	ZINC000450503993	GF	On-Demand	Anodyne	FPR1	32	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@H]2CCCOC2)cc1	ZINC000450503993	GF	On-Demand	Anodyne	LEF	48	38
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503994	GF	On-Demand	Anodyne	MMP13	19	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503994	GF	On-Demand	Anodyne	CAPNS1	20	50
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503994	GF	On-Demand	Anodyne	MMP3	15	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503994	GF	On-Demand	Anodyne	CAPN1	30	45
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503994	GF	On-Demand	Anodyne	CAPN2	24	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503994	GF	On-Demand	Anodyne	FPR1	32	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)[C@@H]2CCCOC2)cc1	ZINC000450503994	GF	On-Demand	Anodyne	LEF	48	38
Cc1nc(N[C@H]2CCO[C@@H]2c2cccnc2)ncc1[N+](=O)[O-]	ZINC000450504016	DE	On-Demand	Bother	PRKCQ	45	36
CCOCCN(Cc1ccc(C(=O)O)o1)C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC000450504021	GG	On-Demand	Anodyne	TUBB2B	38	42
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ncon1	ZINC000450504037	EF	On-Demand	Anodyne	PRCP	17	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)c1ncon1	ZINC000450504060	DD	On-Demand	Anodyne	FPR1	42	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)c1ncon1	ZINC000450504061	DD	On-Demand	Anodyne	FPR1	42	33
Cc1ccc(C(=O)NCC2(C)CCN(C)CC2)c(Cl)c1Cl	ZINC000450504065	EH	On-Demand	Anodyne	SLC6A9	50	34
Cc1ccc(C(=O)NCC2(C)CCN(C)CC2)c(Cl)c1Cl	ZINC000450504065	EH	On-Demand	Anodyne	HCN1	59	37
COC(=O)c1csc(CN2CCc3ccc(F)c(F)c3C2)n1	ZINC000450504072	DF	On-Demand	Anodyne	NOD2	40	35
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CSC)cc1	ZINC000450504076	DF	On-Demand	Anodyne	HRH3	0	51
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CSC)cc1	ZINC000450504076	DF	On-Demand	Anodyne	CASP7	40	33
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CSC)cc1	ZINC000450504077	DF	On-Demand	Anodyne	HRH3	0	51
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CSC)cc1	ZINC000450504077	DF	On-Demand	Anodyne	CASP7	40	33
O=C(Cc1sccc1Br)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504084	GI	On-Demand	Bother	SLC27A4	42	31
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)Cc1cnc(N(C)C)nc1	ZINC000450504109	FG	On-Demand	Anodyne	TACR1	19	44
CC[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H](O)C(F)(F)F	ZINC000450504125	DD	On-Demand	Anodyne	HPGDS	31	48
CC[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H](O)C(F)(F)F	ZINC000450504128	DD	On-Demand	Anodyne	HPGDS	31	48
CN1CCC(C)(CNC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450504129	FH	On-Demand	Anodyne	SLC6A1	23	41
CC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H](O)C(F)(F)F	ZINC000450504130	DD	On-Demand	Anodyne	HPGDS	31	48
CC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H](O)C(F)(F)F	ZINC000450504131	DD	On-Demand	Anodyne	HPGDS	31	48
CN1CCC(C)(CNC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450504134	FH	On-Demand	Anodyne	SLC6A1	23	41
CN1CCC(C)(CNC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450504135	FH	On-Demand	Anodyne	SLC6A1	23	41
CN1CCC(C)(CNC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450504136	FH	On-Demand	Anodyne	SLC6A1	23	41
CN(CCCN1CCCC1)c1nccc2c([N+](=O)[O-])cccc12	ZINC000450504139	DG	On-Demand	Bother	HNMT	64	44
CN(CCCN1CCCC1)c1nncs1	ZINC000450504140	BD	On-Demand	Anodyne	HNMT	22	45
O=C(CNC(=O)Nc1cccc(Cl)c1)NCC1(c2ccncc2)CCCC1	ZINC000450504149	GG	On-Demand	Anodyne	NMBR	42	34
O=C(CNC(=O)Nc1cccc(Cl)c1)NCC1(c2ccncc2)CCCC1	ZINC000450504149	GG	On-Demand	Anodyne	EPHB4	24	42
O=C(CNC(=O)Nc1cccc(Cl)c1)NCC1(c2ccncc2)CCCC1	ZINC000450504149	GG	On-Demand	Anodyne	ACAT	0	57
O=C(CNC(=O)Nc1cccc(Cl)c1)NCC1(c2ccncc2)CCCC1	ZINC000450504149	GG	On-Demand	Anodyne	NPFFR1	40	38
CCCCCN(CC(N)=O)C(=O)c1cccc(CC)n1	ZINC000450504161	CD	On-Demand	Anodyne	TSPO	27	44
CN1CCO[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504162	DD	On-Demand	Anodyne	DRD2	31	47
CN1CCO[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504162	DD	On-Demand	Anodyne	DRD4	23	50
CN1CCO[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504162	DD	On-Demand	Anodyne	HTR2A	24	48
CN1CCO[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504162	DD	On-Demand	Anodyne	HTR2C	22	52
CN1CCO[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504162	DD	On-Demand	Anodyne	ERG2	22	47
CN1CCO[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504162	DD	On-Demand	Anodyne	SLC18A3	0	46
CN1CCO[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504162	DD	On-Demand	Anodyne	CYP2J2	58	41
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450504163	DD	On-Demand	Anodyne	DRD2	31	47
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450504163	DD	On-Demand	Anodyne	DRD4	23	50
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450504163	DD	On-Demand	Anodyne	HTR2A	24	48
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450504163	DD	On-Demand	Anodyne	HTR2C	22	52
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450504163	DD	On-Demand	Anodyne	ERG2	22	47
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450504163	DD	On-Demand	Anodyne	SLC18A3	0	46
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450504163	DD	On-Demand	Anodyne	CYP2J2	58	41
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504164	DD	On-Demand	Anodyne	DRD2	31	47
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504164	DD	On-Demand	Anodyne	DRD4	23	50
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504164	DD	On-Demand	Anodyne	HTR2A	24	48
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504164	DD	On-Demand	Anodyne	HTR2C	22	52
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504164	DD	On-Demand	Anodyne	ERG2	22	47
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504164	DD	On-Demand	Anodyne	SLC18A3	0	46
CN1CCO[C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450504164	DD	On-Demand	Anodyne	CYP2J2	58	41
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	ACE	22	59
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	OPRM1	22	45
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	OPRD1	53	43
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	AGTR2	94	45
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	PREP	38	50
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	MMP3	43	39
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	CFTR	54	34
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	ADAM9	53	39
O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504177	FG	On-Demand	Anodyne	NR1D1	31	42
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	ACE	22	59
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	OPRM1	22	45
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	OPRD1	53	43
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	AGTR2	94	45
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	PREP	38	50
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	MMP3	43	39
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	CFTR	54	34
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	ADAM9	53	39
O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1cc(F)ccc1F	ZINC000450504178	FG	On-Demand	Anodyne	NR1D1	31	42
CCC[C@H](O)CN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450504186	GD	On-Demand	Anodyne	COLA	85	40
CCC[C@H](O)CN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450504186	GD	On-Demand	Anodyne	CPT1A	74	39
CCC[C@H](O)CN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450504186	GD	On-Demand	Anodyne	CPT2	52	39
CCC[C@H](O)CN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450504186	GD	On-Demand	Anodyne	CPT1B	78	39
CCC[C@@H](O)CN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450504187	GD	On-Demand	Anodyne	COLA	85	40
CCC[C@@H](O)CN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450504187	GD	On-Demand	Anodyne	CPT1A	74	39
CCC[C@@H](O)CN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450504187	GD	On-Demand	Anodyne	CPT2	52	39
CCC[C@@H](O)CN1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1	ZINC000450504187	GD	On-Demand	Anodyne	CPT1B	78	39
O=[N+]([O-])c1cccc2c(NC[C@H]3CCC(F)(F)C3)nccc12	ZINC000450504193	DH	On-Demand	Bother	PRKCQ	47	38
O=[N+]([O-])c1cccc2c(NC[C@@H]3CCC(F)(F)C3)nccc12	ZINC000450504195	DH	On-Demand	Bother	PRKCQ	47	38
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]([C@H](C)O)C3)cc2)c1	ZINC000450504197	FF	On-Demand	Anodyne	MMP13	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]([C@H](C)O)C3)cc2)c1	ZINC000450504197	FF	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]([C@H](C)O)C3)cc2)c1	ZINC000450504197	FF	On-Demand	Anodyne	CCR1	27	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]([C@H](C)O)C3)cc2)c1	ZINC000450504197	FF	On-Demand	Anodyne	L3MBTL3	55	35
Cc1ccn(-c2ccccc2C(=O)N2CCC(CCCN3CCOCC3)CC2)n1	ZINC000450504201	GG	On-Demand	Anodyne	CNR1	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]([C@H](C)O)C3)cc2)c1	ZINC000450504202	FF	On-Demand	Anodyne	MMP13	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]([C@H](C)O)C3)cc2)c1	ZINC000450504202	FF	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]([C@H](C)O)C3)cc2)c1	ZINC000450504202	FF	On-Demand	Anodyne	CCR1	27	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]([C@H](C)O)C3)cc2)c1	ZINC000450504202	FF	On-Demand	Anodyne	L3MBTL3	55	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)cc2)c1	ZINC000450504204	FF	On-Demand	Anodyne	MMP13	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)cc2)c1	ZINC000450504204	FF	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)cc2)c1	ZINC000450504204	FF	On-Demand	Anodyne	CCR1	27	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)cc2)c1	ZINC000450504204	FF	On-Demand	Anodyne	L3MBTL3	55	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]([C@@H](C)O)C3)cc2)c1	ZINC000450504207	FF	On-Demand	Anodyne	MMP13	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]([C@@H](C)O)C3)cc2)c1	ZINC000450504207	FF	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]([C@@H](C)O)C3)cc2)c1	ZINC000450504207	FF	On-Demand	Anodyne	CCR1	27	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]([C@@H](C)O)C3)cc2)c1	ZINC000450504207	FF	On-Demand	Anodyne	L3MBTL3	55	35
CC[C@@H]1C[C@H]1C(=O)N[C@H](C)Cc1ccccc1C(F)(F)F	ZINC000450504216	CH	On-Demand	Anodyne	SLC16A1	41	32
CC(=O)c1ccc(CN2CCc3ccc(F)c(F)c3C2)cc1	ZINC000450504221	DH	On-Demand	Anodyne	NOD1	34	46
CC(=O)c1ccc(CN2CCc3ccc(F)c(F)c3C2)cc1	ZINC000450504221	DH	On-Demand	Anodyne	NOD2	50	43
CCOC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)N3CCCC3)C2)nc1	ZINC000450504223	FD	On-Demand	Anodyne	SSTR5	37	40
CCOC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)nc1	ZINC000450504225	FD	On-Demand	Anodyne	SSTR5	37	40
COC1(CNC(=O)c2cccc(C#N)c2Br)CCC1	ZINC000450504226	DF	On-Demand	Mild	HCN1	52	33
COC1(CNC(=O)c2cccc(C#N)c2Br)CCC1	ZINC000450504226	DF	On-Demand	Mild	HCN4	50	33
CO[C@@H]1CCC[C@H](C(=O)Nc2cc(C(F)(F)F)ccn2)C1	ZINC000450504247	DG	On-Demand	Anodyne	TYK2	67	40
CO[C@H]1CCC[C@@H](C(=O)Nc2cc(C(F)(F)F)ccn2)C1	ZINC000450504249	DG	On-Demand	Anodyne	TYK2	67	40
CO[C@@H]1CCC[C@@H](C(=O)Nc2cc(C(F)(F)F)ccn2)C1	ZINC000450504251	DG	On-Demand	Anodyne	TYK2	67	40
CO[C@H]1CCC[C@H](C(=O)Nc2cc(C(F)(F)F)ccn2)C1	ZINC000450504252	DG	On-Demand	Anodyne	TYK2	67	40
CCC(=O)CCCN1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450504253	EH	On-Demand	Anodyne	SLC6A1	116	38
CCC(=O)CCCN1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450504253	EH	On-Demand	Anodyne	SIGMAR1	48	40
CCC(=O)CCCN1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450504253	EH	On-Demand	Anodyne	CYP2J2	50	36
CCC(=O)CCCN1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450504253	EH	On-Demand	Anodyne	BIRC2	45	35
CCCCCN(CC(N)=O)C(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450504254	EE	On-Demand	Anodyne	PLM2_PLAFA	68	36
CCC(=O)CCCN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450504256	EH	On-Demand	Anodyne	SLC6A1	116	38
CCC(=O)CCCN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450504256	EH	On-Demand	Anodyne	SIGMAR1	48	40
CCC(=O)CCCN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450504256	EH	On-Demand	Anodyne	CYP2J2	50	36
CCC(=O)CCCN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450504256	EH	On-Demand	Anodyne	BIRC2	45	35
CCC(=O)CCCN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450504257	EH	On-Demand	Anodyne	SLC6A1	116	38
CCC(=O)CCCN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450504257	EH	On-Demand	Anodyne	SIGMAR1	48	40
CCC(=O)CCCN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450504257	EH	On-Demand	Anodyne	CYP2J2	50	36
CCC(=O)CCCN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1	ZINC000450504257	EH	On-Demand	Anodyne	BIRC2	45	35
CCC(=O)CCCN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450504258	EH	On-Demand	Anodyne	SLC6A1	116	38
CCC(=O)CCCN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450504258	EH	On-Demand	Anodyne	SIGMAR1	48	40
CCC(=O)CCCN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450504258	EH	On-Demand	Anodyne	CYP2J2	50	36
CCC(=O)CCCN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1	ZINC000450504258	EH	On-Demand	Anodyne	BIRC2	45	35
COc1cccc(OCCC(=O)NCc2ccn(C)n2)c1	ZINC000450504265	CD	On-Demand	Anodyne	DRD4	44	33
COc1cccc(OCCC(=O)NCc2ccn(C)n2)c1	ZINC000450504265	CD	On-Demand	Anodyne	MTNR1A	76	44
COc1cccc(OCCC(=O)NCc2ccn(C)n2)c1	ZINC000450504265	CD	On-Demand	Anodyne	MTNR1B	61	44
N#CC1(CN2CCN(Cc3ccc(Br)cc3)CC2)CCC1	ZINC000450504267	EG	On-Demand	Mild	SIGMAR1	17	43
c1ccc2c(c1)CCN2C1CCN(c2nc(C3CCC3)no2)CC1	ZINC000450504271	DG	On-Demand	Anodyne	SCD1	15	41
CC[C@H](O)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504275	CE	On-Demand	Bother	COLA	24	42
CC[C@H](O)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504275	CE	On-Demand	Bother	MMP8	32	40
CC[C@H](O)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504275	CE	On-Demand	Bother	MMP1	33	40
CC[C@H](O)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504275	CE	On-Demand	Bother	SLC27A4	54	36
CC[C@@H](O)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504276	CE	On-Demand	Bother	COLA	24	42
CC[C@@H](O)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504276	CE	On-Demand	Bother	MMP8	32	40
CC[C@@H](O)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504276	CE	On-Demand	Bother	MMP1	33	40
CC[C@@H](O)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450504276	CE	On-Demand	Bother	SLC27A4	54	36
C[S@](=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CCC1	ZINC000450504286	EH	On-Demand	Anodyne	HRP1_PLAFA	100	36
C[S@](=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CCC1	ZINC000450504286	EH	On-Demand	Anodyne	HNMT	45	35
C[S@@](=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CCC1	ZINC000450504288	EH	On-Demand	Anodyne	HRP1_PLAFA	100	36
C[S@@](=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CCC1	ZINC000450504288	EH	On-Demand	Anodyne	HNMT	45	35
O=C(CCCN(CCCO)Cc1ccccc1)c1ccccc1	ZINC000450504289	DH	On-Demand	Anodyne	CES1	49	33
O=C(CCCN(CCCO)Cc1ccccc1)c1ccccc1	ZINC000450504289	DH	On-Demand	Anodyne	CYP2J2	42	30
CCc1c(C(=O)N2CCC(n3cc(Cl)cn3)CC2)oc2ccccc12	ZINC000450504298	FI	On-Demand	Anodyne	MAP3K7	51	37
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(C)(C)C2CCC2)c1	ZINC000450504303	EJ	On-Demand	Anodyne	LDLR	0	40
CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(C)(C)C2CCC2)c1	ZINC000450504303	EJ	On-Demand	Anodyne	MSR1	0	41
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	HTR1A	28	45
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	DRD2	29	46
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	DRD1	15	40
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	DRD4	55	42
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	ACHE	27	43
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	HRH2	64	52
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	HTR1D	15	45
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	HTR2A	16	45
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	HRH1	22	45
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	DRD3	21	40
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	HTR2B	15	42
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	LTA4H	39	50
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	HTR7	18	42
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	KCNA5	0	43
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	HRH3	28	49
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	SIGMAR1	33	47
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	ADAM17	18	44
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	MTNR1A	24	45
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	FAAH	23	43
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	ABCB1	33	46
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	MCHR1	31	42
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	MGLL	0	41
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	PSMB2	47	38
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	PSMB1	41	38
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	ABHD6	0	41
COc1cccc(OCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450504304	FG	On-Demand	Anodyne	ALPHA-1A	0	40
CCC[C@H](O)CN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450504315	FE	On-Demand	Anodyne	KCNQ2	28	41
CCC[C@H](O)CN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450504315	FE	On-Demand	Anodyne	NPY2R	26	41
CCC[C@@H](O)CN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450504316	FE	On-Demand	Anodyne	KCNQ2	28	41
CCC[C@@H](O)CN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450504316	FE	On-Demand	Anodyne	NPY2R	26	41
CCC[C@H](O)CN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450504317	FE	On-Demand	Anodyne	KCNQ2	28	41
CCC[C@H](O)CN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450504317	FE	On-Demand	Anodyne	NPY2R	26	41
CCC[C@@H](O)CN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450504318	FE	On-Demand	Anodyne	KCNQ2	28	41
CCC[C@@H](O)CN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450504318	FE	On-Demand	Anodyne	NPY2R	26	41
Cc1ccnc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450504336	EF	On-Demand	Anodyne	DRD4	29	47
Cc1ccnc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450504336	EF	On-Demand	Anodyne	SORD	85	38
Cc1ccnc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450504337	EF	On-Demand	Anodyne	DRD4	29	47
Cc1ccnc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450504337	EF	On-Demand	Anodyne	SORD	85	38
Cc1ccnc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450504338	EF	On-Demand	Anodyne	DRD4	29	47
Cc1ccnc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450504338	EF	On-Demand	Anodyne	SORD	85	38
Cc1ccnc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450504339	EF	On-Demand	Anodyne	DRD4	29	47
Cc1ccnc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450504339	EF	On-Demand	Anodyne	SORD	85	38
O=C(O)CC1CCN(C(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC000450504340	DF	On-Demand	Anodyne	OPRK1	35	40
O=C(O)CC1CCN(C(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC000450504340	DF	On-Demand	Anodyne	CCR3	24	55
O=C(O)CC1CCN(C(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC000450504340	DF	On-Demand	Anodyne	GPR183	0	40
CN(Cc1cnc(N(C)C)nc1)C(=O)c1cc(Br)c(F)cc1O	ZINC000450504362	GE	On-Demand	Anodyne	HSP90AB1	48	38
C[C@H]1C[C@H](C(=O)N2CCC(n3cc(Cl)cn3)CC2)CC[C@H]1C	ZINC000450504369	DH	On-Demand	Anodyne	MAP3K7	42	31
C[C@@H]1CC[C@H](C(=O)N2CCC(n3cc(Cl)cn3)CC2)C[C@H]1C	ZINC000450504370	DH	On-Demand	Anodyne	MAP3K7	42	31
C[C@@H]1CC[C@@H](C(=O)N2CCC(n3cc(Cl)cn3)CC2)C[C@H]1C	ZINC000450504371	DH	On-Demand	Anodyne	MAP3K7	42	31
C[C@H]1C[C@@H](C(=O)N2CCC(n3cc(Cl)cn3)CC2)CC[C@H]1C	ZINC000450504372	DH	On-Demand	Anodyne	MAP3K7	42	31
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccccc1	ZINC000450504398	EG	On-Demand	Anodyne	OPRM1	24	51
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccccc1	ZINC000450504398	EG	On-Demand	Anodyne	OPRK1	24	51
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccccc1	ZINC000450504398	EG	On-Demand	Anodyne	CYP2J2	57	40
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccccc1	ZINC000450504399	EG	On-Demand	Anodyne	OPRM1	24	51
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccccc1	ZINC000450504399	EG	On-Demand	Anodyne	OPRK1	24	51
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccccc1	ZINC000450504399	EG	On-Demand	Anodyne	CYP2J2	57	40
COC(=O)[C@@H]1CN(c2nc(C3CCC3)no2)C[C@H]1c1ccccc1	ZINC000450504400	EF	On-Demand	Anodyne	SLC6A1	58	43
COC(=O)[C@@H]1CN(c2nc(C3CCC3)no2)C[C@H]1c1ccccc1	ZINC000450504400	EF	On-Demand	Anodyne	COLA	0	41
CCS(=O)(=O)c1ccc(CN(CC(F)F)C(C)C)cc1	ZINC000450504401	DF	On-Demand	Anodyne	RORC	18	40
CCC(=O)CCCN(C)[C@H](C)Cc1ccc(O)cc1	ZINC000450504404	CG	On-Demand	Anodyne	ACE2	25	40
CCC(=O)CCCN(C)[C@@H](C)Cc1ccc(O)cc1	ZINC000450504405	CG	On-Demand	Anodyne	ACE2	25	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504407	EF	On-Demand	Anodyne	MC4R	51	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504407	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504407	EF	On-Demand	Anodyne	MAP3K7	40	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504408	EF	On-Demand	Anodyne	MC4R	51	34
CO[C@H](Cc1ccccc1)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504408	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504408	EF	On-Demand	Anodyne	MAP3K7	40	35
CC[C@H](C)CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450504411	CG	On-Demand	Anodyne	CPA1	44	37
CC[C@H](C)CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450504411	CG	On-Demand	Anodyne	PAM	0	41
CC[C@H](C)CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450504411	CG	On-Demand	Anodyne	ACE2	52	37
CC[C@@H](C)CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450504412	CG	On-Demand	Anodyne	CPA1	44	37
CC[C@@H](C)CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450504412	CG	On-Demand	Anodyne	PAM	0	41
CC[C@@H](C)CC(=O)N(Cc1ccccc1)C[C@H](C)C(=O)O	ZINC000450504412	CG	On-Demand	Anodyne	ACE2	52	37
CC[C@H](C)CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450504413	CG	On-Demand	Anodyne	CPA1	44	37
CC[C@H](C)CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450504413	CG	On-Demand	Anodyne	PAM	0	41
CC[C@H](C)CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450504413	CG	On-Demand	Anodyne	ACE2	52	37
CC[C@@H](C)CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450504414	CG	On-Demand	Anodyne	CPA1	44	37
CC[C@@H](C)CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450504414	CG	On-Demand	Anodyne	PAM	0	41
CC[C@@H](C)CC(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)O	ZINC000450504414	CG	On-Demand	Anodyne	ACE2	52	37
COc1ccc(-c2noc(N3CCC[C@@H]3[C@@H]3CCCC[C@@H]3O)n2)cc1	ZINC000450504416	EG	On-Demand	Anodyne	COLA	0	43
COc1ccc(-c2noc(N3CCC[C@@H]3[C@H]3CCCC[C@H]3O)n2)cc1	ZINC000450504417	EG	On-Demand	Anodyne	COLA	0	43
COc1ccc(-c2noc(N3CCC[C@@H]3[C@@H]3CCCC[C@H]3O)n2)cc1	ZINC000450504418	EG	On-Demand	Anodyne	COLA	0	43
COc1ccc(-c2noc(N3CCC[C@@H]3[C@H]3CCCC[C@@H]3O)n2)cc1	ZINC000450504419	EG	On-Demand	Anodyne	COLA	0	43
c1ccc(CN2CCO[C@H]3CN(c4ncnc5[nH]c6ccccc6c45)C[C@H]32)cc1	ZINC000450504420	GG	On-Demand	Anodyne	ADK	15	44
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450504428	FG	On-Demand	Anodyne	PAOX	17	40
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450504428	FG	On-Demand	Anodyne	GNAI1	0	42
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450504428	FG	On-Demand	Anodyne	GNAI3	0	46
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450504428	FG	On-Demand	Anodyne	GNAO1	0	42
COC(=O)c1coc(CN2CCC[C@@H]2CCCc2ccccc2)n1	ZINC000450504442	EG	On-Demand	Anodyne	SLC18A2	33	41
COC(=O)c1coc(CN2CCC[C@@H]2CCCc2ccccc2)n1	ZINC000450504442	EG	On-Demand	Anodyne	PREP	47	36
COC(=O)c1coc(CN2CCC[C@H]2CCCc2ccccc2)n1	ZINC000450504443	EG	On-Demand	Anodyne	SLC18A2	33	41
COC(=O)c1coc(CN2CCC[C@H]2CCCc2ccccc2)n1	ZINC000450504443	EG	On-Demand	Anodyne	PREP	47	36
CN1CCC(C)(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450504453	DE	On-Demand	Anodyne	ADAM10	34	40
CN1CCC(C)(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450504454	DE	On-Demand	Anodyne	ADAM10	34	40
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504456	EH	On-Demand	Anodyne	DRD2	33	43
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504456	EH	On-Demand	Anodyne	DRD4	15	49
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504456	EH	On-Demand	Anodyne	HTR2A	28	49
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504456	EH	On-Demand	Anodyne	HTR2C	25	49
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504456	EH	On-Demand	Anodyne	ERG2	21	46
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504456	EH	On-Demand	Anodyne	SLC18A3	0	42
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504456	EH	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCO[C@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504456	EH	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504457	EH	On-Demand	Anodyne	DRD2	33	43
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504457	EH	On-Demand	Anodyne	DRD4	15	49
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504457	EH	On-Demand	Anodyne	HTR2A	28	49
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504457	EH	On-Demand	Anodyne	HTR2C	25	49
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504457	EH	On-Demand	Anodyne	ERG2	21	46
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504457	EH	On-Demand	Anodyne	SLC18A3	0	42
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504457	EH	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCO[C@@H](c2cccc(O)c2)C1)c1ccc(F)cc1	ZINC000450504457	EH	On-Demand	Anodyne	CYP2J2	51	36
OC[C@@H](CNc1ccnc2cc(F)c(Br)cc12)[C@@H]1CCOC1	ZINC000450504461	FG	On-Demand	Anodyne	HRP1_PLAFA	52	30
OC[C@H](CNc1ccnc2cc(F)c(Br)cc12)[C@@H]1CCOC1	ZINC000450504462	FG	On-Demand	Anodyne	HRP1_PLAFA	52	30
OC[C@H](CNc1ccnc2cc(F)c(Br)cc12)[C@H]1CCOC1	ZINC000450504463	FG	On-Demand	Anodyne	HRP1_PLAFA	52	30
OC[C@@H](CNc1ccnc2cc(F)c(Br)cc12)[C@H]1CCOC1	ZINC000450504464	FG	On-Demand	Anodyne	HRP1_PLAFA	52	30
COC1(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCC1	ZINC000450504465	FG	On-Demand	Anodyne	PYGL	50	37
CC(=O)c1cccc(CN2CCN(c3cc(C)ccn3)CC2)c1	ZINC000450504466	DF	On-Demand	Anodyne	HTR1A	23	44
CC(=O)c1cccc(CN2CCN(c3cc(C)ccn3)CC2)c1	ZINC000450504466	DF	On-Demand	Anodyne	DRD2	22	43
CC(=O)c1cccc(CN2CCN(c3cc(C)ccn3)CC2)c1	ZINC000450504466	DF	On-Demand	Anodyne	DRD4	51	52
CC(=O)c1cccc(CN2CCN(c3cc(C)ccn3)CC2)c1	ZINC000450504466	DF	On-Demand	Anodyne	ABCB1	0	40
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	ACHE	16	45
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	HRH2	16	44
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	LTA4H	58	60
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	ADORA2B	34	40
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	HRH3	24	56
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	SIGMAR1	23	44
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	SSTR5	42	34
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	PRNP	43	37
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	FAAH	19	44
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	MCHR1	32	41
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	CACNA1G	16	44
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	NOD1	31	42
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	NOD2	52	55
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	ADIPOR1	0	41
CCOc1ccc(NC(=O)CN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450504474	GG	On-Demand	Anodyne	ADIPOR2	0	41
CC(=O)[C@@](C)(O)CN1CCN(Cc2ccccc2Cl)CC1	ZINC000450504478	DD	On-Demand	Anodyne	DRD4	19	46
CC(=O)[C@](C)(O)CN1CCN(Cc2ccccc2Cl)CC1	ZINC000450504479	DD	On-Demand	Anodyne	DRD4	19	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC2(CCCCC2)C1	ZINC000450504492	DG	On-Demand	Anodyne	CCKBR	32	40
C[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2[nH]1)C(=O)OC(C)(C)C	ZINC000450504506	DG	On-Demand	Bother	TXN	19	49
C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2[nH]1)C(=O)OC(C)(C)C	ZINC000450504507	DG	On-Demand	Bother	TXN	19	49
COc1cnccc1N1CCN(c2nccc3cc([N+](=O)[O-])ccc23)CC1	ZINC000450504508	FF	On-Demand	Bother	PDGFRB	21	43
COC(=O)[C@@H](C)N(C)c1ncnc2cc(Br)ccc12	ZINC000450504509	DE	On-Demand	Anodyne	EGFR	43	35
COC(=O)[C@H](C)N(C)c1ncnc2cc(Br)ccc12	ZINC000450504510	DE	On-Demand	Anodyne	EGFR	43	35
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@]2(C)CCC[C@@H]2C)c1	ZINC000450504523	EJ	On-Demand	Anodyne	ENV	40	30
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@]2(C)CCC[C@H]2C)c1	ZINC000450504524	EJ	On-Demand	Anodyne	ENV	40	30
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@@]2(C)CCC[C@@H]2C)c1	ZINC000450504525	EJ	On-Demand	Anodyne	ENV	40	30
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@@]2(C)CCC[C@H]2C)c1	ZINC000450504526	EJ	On-Demand	Anodyne	ENV	40	30
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	ESR1	18	41
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	HTR1A	26	43
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	DRD2	33	47
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	DRD1	0	41
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	DRD4	55	42
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	ACHE	34	44
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	HRH2	41	45
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	HTR2A	20	44
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	KCNH2	16	41
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	HTR4	19	42
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	LTA4H	47	43
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	HTR7	17	40
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	KCNA5	0	49
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	HRH3	42	50
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	SIGMAR1	40	45
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	MMP13	15	43
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	ADAM17	20	43
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	SLC9A1	58	33
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	ABCB1	31	44
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	MCHR1	39	43
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	PSMB2	50	39
COc1cccc(OCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450504552	FG	On-Demand	Anodyne	PSMB1	43	39
COc1ccc(-c2noc(N3CC[C@H](Oc4cccnc4N(C)C)C3)n2)cc1	ZINC000450504571	GF	On-Demand	Anodyne	PDE3A	44	38
COc1ccc(-c2noc(N3CC[C@H](Oc4cccnc4N(C)C)C3)n2)cc1	ZINC000450504571	GF	On-Demand	Anodyne	PDE3B	66	38
COc1ccc(-c2noc(N3CC[C@@H](Oc4cccnc4N(C)C)C3)n2)cc1	ZINC000450504572	GF	On-Demand	Anodyne	PDE3A	44	38
COc1ccc(-c2noc(N3CC[C@@H](Oc4cccnc4N(C)C)C3)n2)cc1	ZINC000450504572	GF	On-Demand	Anodyne	PDE3B	66	38
COc1ccc(CNC(=O)CCN(CC(F)F)C(C)C)c(OC)c1	ZINC000450504579	EF	On-Demand	Anodyne	MTNR1A	52	40
COc1ccc(CNC(=O)CCN(CC(F)F)C(C)C)c(OC)c1	ZINC000450504579	EF	On-Demand	Anodyne	MTNR1B	33	40
CCC(CC)Oc1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450504583	GJ	On-Demand	Anodyne	L3MBTL3	72	38
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504603	EG	On-Demand	Anodyne	L3MBTL3	49	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504604	GG	On-Demand	Anodyne	MC4R	46	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504604	GG	On-Demand	Anodyne	CCR1	37	43
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	DRD2	32	47
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	DRD1	15	50
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	DRD4	18	51
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	HTR2A	43	63
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	HTR2C	31	62
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	SLC6A1	88	36
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	ERG2	21	47
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	HTR7	15	47
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	SIGMAR1	18	60
O=C(CCCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504614	FE	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	DRD2	32	47
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	DRD1	15	50
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	DRD4	18	51
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	HTR2A	43	63
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	HTR2C	31	62
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	SLC6A1	88	36
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	ERG2	21	47
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	HTR7	15	47
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	SIGMAR1	18	60
O=C(CCCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450504615	FE	On-Demand	Anodyne	CYP2J2	59	42
CN(CCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450504631	FD	On-Demand	Anodyne	SLC6A1	53	37
CN(CCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450504631	FD	On-Demand	Anodyne	SIGMAR1	42	47
CN(CCN1CC[C@@H](S(=O)(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450504631	FD	On-Demand	Anodyne	CCR5	44	36
CN(CCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450504632	FD	On-Demand	Anodyne	SLC6A1	53	37
CN(CCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450504632	FD	On-Demand	Anodyne	SIGMAR1	42	47
CN(CCN1CC[C@H](S(=O)(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450504632	FD	On-Demand	Anodyne	CCR5	44	36
Cc1ccc2[nH]c(C(=O)NCCC(=O)O)c(C)c2c1	ZINC000450504682	CD	On-Demand	Anodyne	NCE103	53	40
Cc1ccc2[nH]c(C(=O)NCCC(=O)O)c(C)c2c1	ZINC000450504682	CD	On-Demand	Anodyne	MTCA1	43	34
Cc1ccc2[nH]c(C(=O)NCCC(=O)O)c(C)c2c1	ZINC000450504682	CD	On-Demand	Anodyne	HIVRT	0	40
CC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1	ZINC000450504687	CG	On-Demand	Anodyne	ACHE	24	50
CC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1	ZINC000450504687	CG	On-Demand	Anodyne	SIGMAR1	51	49
CC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1	ZINC000450504687	CG	On-Demand	Anodyne	SSTR5	45	37
CC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1	ZINC000450504687	CG	On-Demand	Anodyne	MCHR1	41	38
CC(=O)c1ccc(CN2CCC(C(F)F)CC2)cc1	ZINC000450504687	CG	On-Demand	Anodyne	NOD2	41	36
C[C@H](CN1CCN(Cc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450504688	DD	On-Demand	Anodyne	ADORA2B	21	42
C[C@H](CN1CCN(Cc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450504688	DD	On-Demand	Anodyne	FABP4	18	41
C[C@H](CN1CCN(Cc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450504688	DD	On-Demand	Anodyne	SIGMAR1	17	50
C[C@@H](CN1CCN(Cc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450504689	DD	On-Demand	Anodyne	ADORA2B	21	42
C[C@@H](CN1CCN(Cc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450504689	DD	On-Demand	Anodyne	FABP4	18	41
C[C@@H](CN1CCN(Cc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450504689	DD	On-Demand	Anodyne	SIGMAR1	17	50
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](C2CC2)C1	ZINC000450504692	CH	On-Demand	Anodyne	CCR5	34	48
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](C2CC2)C1	ZINC000450504692	CH	On-Demand	Anodyne	L3MBTL3	69	38
Cc1cccc(Cl)c1C(=O)N1CC[C@H](C2CC2)C1	ZINC000450504693	CH	On-Demand	Anodyne	CCR5	34	48
Cc1cccc(Cl)c1C(=O)N1CC[C@H](C2CC2)C1	ZINC000450504693	CH	On-Demand	Anodyne	L3MBTL3	69	38
O=C(CCCN1CCOC2(CCCC2)C1)c1ccccc1	ZINC000450504696	CG	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1CCOC2(CCCC2)C1)c1ccccc1	ZINC000450504696	CG	On-Demand	Anodyne	CYP2J2	59	42
OC[C@H](Nc1ccnc2cc(F)c(Cl)cc12)C1CCOCC1	ZINC000450504705	DG	On-Demand	Anodyne	HRP1_PLAFA	50	31
OC[C@H](Nc1ccnc2cc(F)c(Cl)cc12)C1CCOCC1	ZINC000450504705	DG	On-Demand	Anodyne	MAPK1	54	36
OC[C@@H](Nc1ccnc2cc(F)c(Cl)cc12)C1CCOCC1	ZINC000450504706	DG	On-Demand	Anodyne	HRP1_PLAFA	50	31
OC[C@@H](Nc1ccnc2cc(F)c(Cl)cc12)C1CCOCC1	ZINC000450504706	DG	On-Demand	Anodyne	MAPK1	54	36
CNC(=O)[C@@]1(C)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450504709	EE	On-Demand	Anodyne	PDGFRB	35	42
CNC(=O)[C@]1(C)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450504710	EE	On-Demand	Anodyne	PDGFRB	35	42
COC(=O)c1ccc(CN2CCO[C@H](c3cccc(OC)c3)C2)cc1Cl	ZINC000450504711	GH	On-Demand	Anodyne	DRD4	44	35
COC(=O)c1ccc(CN2CCO[C@H](c3cccc(OC)c3)C2)cc1Cl	ZINC000450504711	GH	On-Demand	Anodyne	DRD3	22	41
COC(=O)c1ccc(CN2CCO[C@H](c3cccc(OC)c3)C2)cc1Cl	ZINC000450504711	GH	On-Demand	Anodyne	MCHR1	31	40
COC(=O)c1ccc(CN2CCO[C@@H](c3cccc(OC)c3)C2)cc1Cl	ZINC000450504712	GH	On-Demand	Anodyne	DRD4	44	35
COC(=O)c1ccc(CN2CCO[C@@H](c3cccc(OC)c3)C2)cc1Cl	ZINC000450504712	GH	On-Demand	Anodyne	DRD3	22	41
COC(=O)c1ccc(CN2CCO[C@@H](c3cccc(OC)c3)C2)cc1Cl	ZINC000450504712	GH	On-Demand	Anodyne	MCHR1	31	40
COC1(CNC(=O)c2cn3nccc3nc2C)CCC1	ZINC000450504717	CD	On-Demand	Anodyne	HCN1	53	34
COC1(CNC(=O)c2cn3nccc3nc2C)CCC1	ZINC000450504717	CD	On-Demand	Anodyne	HCN4	50	34
COc1cccc(OCCN2CCN(CC3=CCCCC3)CC2)c1	ZINC000450504721	EG	On-Demand	Anodyne	DRD4	45	34
COc1cccc(OCCN2CCN(CC3=CCCCC3)CC2)c1	ZINC000450504721	EG	On-Demand	Anodyne	LTA4H	36	52
COc1cccc(OCCN2CCN(CC3=CCCCC3)CC2)c1	ZINC000450504721	EG	On-Demand	Anodyne	PSMB2	46	37
COc1cccc(OCCN2CCN(CC3=CCCCC3)CC2)c1	ZINC000450504721	EG	On-Demand	Anodyne	PSMB1	41	37
COC(=O)c1ccc(CNC(=O)[C@@H](Cc2ccccc2)OC)nc1C1CC1	ZINC000450504723	FF	On-Demand	Anodyne	AMP1_PLAFQ	46	36
COC(=O)c1ccc(CNC(=O)[C@H](Cc2ccccc2)OC)nc1C1CC1	ZINC000450504724	FF	On-Demand	Anodyne	AMP1_PLAFQ	46	36
CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450504746	GJ	On-Demand	Anodyne	SHH	45	36
CNC(=O)C[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)c1ccccc1	ZINC000450504747	DD	On-Demand	Bother	METAP1	47	37
CNC(=O)C[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)c1ccccc1	ZINC000450504747	DD	On-Demand	Bother	PRKCQ	28	42
CNC(=O)C[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)c1ccccc1	ZINC000450504748	DD	On-Demand	Bother	METAP1	47	37
CNC(=O)C[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)c1ccccc1	ZINC000450504748	DD	On-Demand	Bother	PRKCQ	28	42
O=C([C@@H]1CC[C@H](Nc2ccnc3cc(F)c(Cl)cc23)C1)N1CCCC1	ZINC000450504766	FI	On-Demand	Anodyne	HRP1_PLAFA	54	38
O=C([C@@H]1CC[C@H](Nc2ccnc3cc(F)c(Cl)cc23)C1)N1CCCC1	ZINC000450504766	FI	On-Demand	Anodyne	HNMT	49	35
Cn1cc(-c2ccc(C(=O)N3CCC(n4cc(Cl)cn4)CC3)o2)cn1	ZINC000450504777	FG	On-Demand	Anodyne	SCN10A	18	48
Cn1cc(-c2ccc(C(=O)N3CCC(n4cc(Cl)cn4)CC3)o2)cn1	ZINC000450504777	FG	On-Demand	Anodyne	MAP3K7	56	39
Cn1cc(-c2ccc(C(=O)N3CCC(n4cc(Cl)cn4)CC3)o2)cn1	ZINC000450504777	FG	On-Demand	Anodyne	L3MBTL1	0	42
Cn1cc(-c2ccc(C(=O)N3CCC(n4cc(Cl)cn4)CC3)o2)cn1	ZINC000450504777	FG	On-Demand	Anodyne	L3MBTL3	23	42
COc1ccc(CNC(=O)CCN2CCc3ccc(F)c(F)c3C2)c(OC)c1	ZINC000450504787	GG	On-Demand	Anodyne	DRD4	41	33
CCS[C@@H](C)c1noc(CN(C)CCCC(=O)c2ccccc2)n1	ZINC000450504794	EH	On-Demand	Anodyne	TSPO	15	40
CCS[C@H](C)c1noc(CN(C)CCCC(=O)c2ccccc2)n1	ZINC000450504795	EH	On-Demand	Anodyne	TSPO	15	40
CCc1cc(N2CC[C@H](Oc3cccnc3N(C)C)C2)ccn1	ZINC000450504796	DF	On-Demand	Anodyne	PDE3B	55	35
CCc1cc(N2CC[C@@H](Oc3cccnc3N(C)C)C2)ccn1	ZINC000450504797	DF	On-Demand	Anodyne	PDE3B	55	35
COc1cc(CC(=O)N(C)Cc2cnc(N(C)C)nc2)ccc1Cl	ZINC000450504820	EE	On-Demand	Anodyne	PDE6A	41	32
Cn1ncc(Br)c1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450504828	FF	On-Demand	Anodyne	MAP3K7	48	34
CC[C@H]1CN(Cc2cccnc2N)C[C@H]1N1CCOCC1	ZINC000450504836	CD	On-Demand	Anodyne	MTAP	0	40
CC[C@@H]1CN(Cc2cccnc2N)C[C@@H]1N1CCOCC1	ZINC000450504837	CD	On-Demand	Anodyne	MTAP	0	40
CC[C@@H]1CN(Cc2cccnc2N)C[C@H]1N1CCOCC1	ZINC000450504838	CD	On-Demand	Anodyne	MTAP	0	40
CC[C@H]1CN(Cc2cccnc2N)C[C@@H]1N1CCOCC1	ZINC000450504839	CD	On-Demand	Anodyne	MTAP	0	40
C[C@@H](O)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450504843	DG	On-Demand	Anodyne	ADAM10	23	40
C[C@H](O)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450504844	DG	On-Demand	Anodyne	ADAM10	23	40
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450504845	DG	On-Demand	Anodyne	ADAM10	23	40
C[C@@H](O)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450504846	DG	On-Demand	Anodyne	ADAM10	23	40
COc1cc2c(c(OC)c1OC)CCN(CCc1cscn1)CC2	ZINC000450504848	EF	On-Demand	Anodyne	ABCB1B	45	31
COc1cc(C(=O)O)cc(NC(=O)CCCc2cc(F)ccc2F)c1OC	ZINC000450504882	GH	On-Demand	Anodyne	ACKR3	48	34
NC(=O)C1(O)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450504887	FD	On-Demand	Anodyne	PDGFRB	35	43
NC(=O)C1(O)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450504887	FD	On-Demand	Anodyne	AKT2	44	44
NC(=O)C1(O)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450504887	FD	On-Demand	Anodyne	AKT3	34	44
NC(=O)C1(O)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450504887	FD	On-Demand	Anodyne	AKT1	34	44
NC(=O)C1(O)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450504887	FD	On-Demand	Anodyne	SIRT3	82	35
NC(=O)C1(O)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450504887	FD	On-Demand	Anodyne	SIRT2	68	34
NC(=O)C1(O)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450504887	FD	On-Demand	Anodyne	SIRT1	59	34
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450504895	GG	On-Demand	Anodyne	GRIN2B	19	43
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450504895	GG	On-Demand	Anodyne	CPT2	29	42
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450504895	GG	On-Demand	Anodyne	ITGA4	43	35
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450504896	GG	On-Demand	Anodyne	GRIN2B	19	43
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450504896	GG	On-Demand	Anodyne	CPT2	29	42
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450504896	GG	On-Demand	Anodyne	ITGA4	43	35
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450504897	GG	On-Demand	Anodyne	GRIN2B	19	43
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450504897	GG	On-Demand	Anodyne	CPT2	29	42
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450504897	GG	On-Demand	Anodyne	ITGA4	43	35
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450504898	GG	On-Demand	Anodyne	GRIN2B	19	43
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450504898	GG	On-Demand	Anodyne	CPT2	29	42
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450504898	GG	On-Demand	Anodyne	ITGA4	43	35
COC(=O)C1(NC(=O)CCOc2cccc(OC)c2)CC1	ZINC000450504899	CD	On-Demand	Anodyne	DRD4	40	30
COC(=O)C1(NC(=O)CCOc2cccc(OC)c2)CC1	ZINC000450504899	CD	On-Demand	Anodyne	MTNR1A	55	41
COC(=O)C1(NC(=O)CCOc2cccc(OC)c2)CC1	ZINC000450504899	CD	On-Demand	Anodyne	MTNR1B	49	41
CNc1nc(N2CCC[C@@H](S(C)(=O)=O)CC2)nc2ccccc12	ZINC000450504908	ED	On-Demand	Anodyne	HRH4	21	44
CNc1nc(N2CCC[C@H](S(C)(=O)=O)CC2)nc2ccccc12	ZINC000450504909	ED	On-Demand	Anodyne	HRH4	21	44
C[C@@H](O)C(=O)N1CCN(C(=O)Cc2scnc2-c2ccccc2)CC1	ZINC000450504910	FD	On-Demand	Anodyne	P2RY12	40	33
C[C@H](O)C(=O)N1CCN(C(=O)Cc2scnc2-c2ccccc2)CC1	ZINC000450504911	FD	On-Demand	Anodyne	P2RY12	40	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450504913	FH	On-Demand	Anodyne	SLC6A1	29	47
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450504913	FH	On-Demand	Anodyne	NPBWR1	44	31
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450504913	FH	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450504914	FH	On-Demand	Anodyne	SLC6A1	29	47
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450504914	FH	On-Demand	Anodyne	NPBWR1	44	31
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450504914	FH	On-Demand	Anodyne	GPR88	0	42
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1Oc1ccc(C)nn1	ZINC000450504927	GJ	On-Demand	Anodyne	ENPP1	72	37
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1Oc1ccc(C)nn1	ZINC000450504927	GJ	On-Demand	Anodyne	DRTS_TRYCR	43	30
COc1cc2c(c(OC)c1OC)CCN(CC[C@@H](C)O)CC2	ZINC000450504929	DD	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(c(OC)c1OC)CCN(CC[C@H](C)O)CC2	ZINC000450504930	DD	On-Demand	Anodyne	SLC18A2	48	37
N#Cc1cccc(N2CCC(N3CCc4cc(F)ccc43)CC2)c1[N+](=O)[O-]	ZINC000450504933	FH	On-Demand	Mild	SCD	30	42
C1=C(CCN2CCN(C3CCCCC3)CC2)CCCC1	ZINC000450504940	CH	On-Demand	Anodyne	SIGMAR1	15	46
C1=C(CCN2CCN(C3CCCCC3)CC2)CCCC1	ZINC000450504940	CH	On-Demand	Anodyne	EBP	18	46
C1=C(CCN2CCN(C3CCCCC3)CC2)CCCC1	ZINC000450504940	CH	On-Demand	Anodyne	L3MBTL3	33	42
O=C(O)CC1CCN(C(=O)CCCc2cc(F)ccc2F)CC1	ZINC000450504945	EG	On-Demand	Anodyne	DPP4	24	43
COc1cnccc1N1CCN(c2ncc(C#N)cc2[N+](=O)[O-])CC1	ZINC000450504966	ED	On-Demand	Mild	TNIK	45	37
COC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCC1	ZINC000450504983	CE	On-Demand	Anodyne	CTSV	47	33
COC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCC1	ZINC000450504983	CE	On-Demand	Anodyne	NPPA	45	35
COC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCC1	ZINC000450504983	CE	On-Demand	Anodyne	HCN1	43	34
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504991	DG	On-Demand	Anodyne	SLC6A3	16	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504991	DG	On-Demand	Anodyne	SIGMAR1	18	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504991	DG	On-Demand	Anodyne	CCR3	25	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504991	DG	On-Demand	Anodyne	SLC18A3	22	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504991	DG	On-Demand	Anodyne	EBP	23	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504992	DG	On-Demand	Anodyne	SLC6A3	16	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504992	DG	On-Demand	Anodyne	SIGMAR1	18	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504992	DG	On-Demand	Anodyne	CCR3	25	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504992	DG	On-Demand	Anodyne	SLC18A3	22	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504992	DG	On-Demand	Anodyne	EBP	23	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504993	DG	On-Demand	Anodyne	SLC6A3	16	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504993	DG	On-Demand	Anodyne	SIGMAR1	18	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504993	DG	On-Demand	Anodyne	CCR3	25	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504993	DG	On-Demand	Anodyne	SLC18A3	22	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504993	DG	On-Demand	Anodyne	EBP	23	43
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504994	DG	On-Demand	Anodyne	SLC6A3	16	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504994	DG	On-Demand	Anodyne	SIGMAR1	18	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504994	DG	On-Demand	Anodyne	CCR3	25	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504994	DG	On-Demand	Anodyne	SLC18A3	22	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2CCCCC2)CC1	ZINC000450504994	DG	On-Demand	Anodyne	EBP	23	43
O=C1CCC(CN2CCN(Cc3ccc(Br)cc3)CC2)CC1	ZINC000450505006	FG	On-Demand	Anodyne	DRD4	16	42
O=C1CCC(CN2CCN(Cc3ccc(Br)cc3)CC2)CC1	ZINC000450505006	FG	On-Demand	Anodyne	SIGMAR1	40	44
O=C1CCC(CN2CCN(Cc3ccc(Br)cc3)CC2)CC1	ZINC000450505006	FG	On-Demand	Anodyne	CXCR3	20	47
Cc1nc(N[C@H]2C[C@@H]2c2ccccc2OC(F)F)ncc1[N+](=O)[O-]	ZINC000450505011	EG	On-Demand	Bother	PRKCQ	45	37
N#CC1(CN2CCN(Cc3cccc(F)c3)CC2)CCC1	ZINC000450505020	CF	On-Demand	Mild	SIGMAR1	18	40
COC1(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CCC1	ZINC000450505028	CG	On-Demand	Anodyne	SCN9A	0	40
COC1(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)CCC1	ZINC000450505029	CG	On-Demand	Anodyne	SCN9A	0	40
COC1(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CCC1	ZINC000450505030	CG	On-Demand	Anodyne	SCN9A	0	40
COC1(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CCC1	ZINC000450505031	CG	On-Demand	Anodyne	SCN9A	0	40
O=C(O)[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505038	DF	On-Demand	Anodyne	ACE	44	49
O=C(O)[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505038	DF	On-Demand	Anodyne	FKBP1A	56	38
O=C(O)[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505038	DF	On-Demand	Anodyne	SLC6A1	36	40
O=C(O)[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505038	DF	On-Demand	Anodyne	COLA	30	42
O=C(O)[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505038	DF	On-Demand	Anodyne	CPT1A	29	42
O=C(O)[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505038	DF	On-Demand	Anodyne	CPT2	47	42
O=C(O)[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505038	DF	On-Demand	Anodyne	DPP4	22	43
O=C(O)[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505038	DF	On-Demand	Anodyne	PREP	70	46
O=C(O)[C@@H]1c2ccccc2CCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505039	FG	On-Demand	Anodyne	MTNR1B	22	41
O=C(O)[C@H]1c2ccccc2CCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505040	FG	On-Demand	Anodyne	MTNR1B	22	41
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc2c1OCCC2=O	ZINC000450505047	EF	On-Demand	Anodyne	PSMB8	45	33
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc2c1OCCC2=O	ZINC000450505048	EF	On-Demand	Anodyne	PSMB8	45	33
CCC[C@@H](OC)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505049	CF	On-Demand	Anodyne	P2RY12	40	38
CCC[C@@H](OC)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505049	CF	On-Demand	Anodyne	CHRNA10	38	40
CCC[C@@H](OC)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505050	CF	On-Demand	Anodyne	P2RY12	40	38
CCC[C@@H](OC)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505050	CF	On-Demand	Anodyne	CHRNA10	38	40
CCC[C@H](OC)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505051	CF	On-Demand	Anodyne	P2RY12	40	38
CCC[C@H](OC)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505051	CF	On-Demand	Anodyne	CHRNA10	38	40
CCC[C@H](OC)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505052	CF	On-Demand	Anodyne	P2RY12	40	38
CCC[C@H](OC)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505052	CF	On-Demand	Anodyne	CHRNA10	38	40
COc1cc(Cl)c(C(=O)N[C@@H](c2ccccc2)[C@H](C)C(=O)O)cc1OC	ZINC000450505055	GH	On-Demand	Anodyne	DAC	30	40
COc1cc(Cl)c(C(=O)N[C@@H](c2ccccc2)[C@H](C)C(=O)O)cc1OC	ZINC000450505055	GH	On-Demand	Anodyne	KCNK3	40	40
COc1cc(Cl)c(C(=O)N[C@@H](c2ccccc2)[C@H](C)C(=O)O)cc1OC	ZINC000450505055	GH	On-Demand	Anodyne	KCNK9	35	40
COc1cc(Cl)c(C(=O)N[C@H](c2ccccc2)[C@@H](C)C(=O)O)cc1OC	ZINC000450505056	GH	On-Demand	Anodyne	DAC	30	40
COc1cc(Cl)c(C(=O)N[C@H](c2ccccc2)[C@@H](C)C(=O)O)cc1OC	ZINC000450505056	GH	On-Demand	Anodyne	KCNK3	40	40
COc1cc(Cl)c(C(=O)N[C@H](c2ccccc2)[C@@H](C)C(=O)O)cc1OC	ZINC000450505056	GH	On-Demand	Anodyne	KCNK9	35	40
COc1cc(Cl)c(C(=O)N[C@H](c2ccccc2)[C@H](C)C(=O)O)cc1OC	ZINC000450505057	GH	On-Demand	Anodyne	DAC	30	40
COc1cc(Cl)c(C(=O)N[C@H](c2ccccc2)[C@H](C)C(=O)O)cc1OC	ZINC000450505057	GH	On-Demand	Anodyne	KCNK3	40	40
COc1cc(Cl)c(C(=O)N[C@H](c2ccccc2)[C@H](C)C(=O)O)cc1OC	ZINC000450505057	GH	On-Demand	Anodyne	KCNK9	35	40
COc1cc(Cl)c(C(=O)N[C@@H](c2ccccc2)[C@@H](C)C(=O)O)cc1OC	ZINC000450505058	GH	On-Demand	Anodyne	DAC	30	40
COc1cc(Cl)c(C(=O)N[C@@H](c2ccccc2)[C@@H](C)C(=O)O)cc1OC	ZINC000450505058	GH	On-Demand	Anodyne	KCNK3	40	40
COc1cc(Cl)c(C(=O)N[C@@H](c2ccccc2)[C@@H](C)C(=O)O)cc1OC	ZINC000450505058	GH	On-Demand	Anodyne	KCNK9	35	40
O=C(O)[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505062	DF	On-Demand	Anodyne	ACE	44	49
O=C(O)[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505062	DF	On-Demand	Anodyne	FKBP1A	56	38
O=C(O)[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505062	DF	On-Demand	Anodyne	SLC6A1	36	40
O=C(O)[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505062	DF	On-Demand	Anodyne	COLA	30	42
O=C(O)[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505062	DF	On-Demand	Anodyne	CPT1A	29	42
O=C(O)[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505062	DF	On-Demand	Anodyne	CPT2	47	42
O=C(O)[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505062	DF	On-Demand	Anodyne	DPP4	22	43
O=C(O)[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450505062	DF	On-Demand	Anodyne	PREP	70	46
CCC(=O)CCCN1CCN(c2cc(C)ccn2)CC1	ZINC000450505066	CE	On-Demand	Anodyne	HTR1A	39	50
CCC(=O)CCCN1CCN(c2cc(C)ccn2)CC1	ZINC000450505066	CE	On-Demand	Anodyne	DRD2	36	46
CCC(=O)CCCN1CCN(c2cc(C)ccn2)CC1	ZINC000450505066	CE	On-Demand	Anodyne	DRD4	38	50
CCC(=O)CCCN1CCN(c2cc(C)ccn2)CC1	ZINC000450505066	CE	On-Demand	Anodyne	HTR2A	29	46
CCC(=O)CCCN1CCN(c2cc(C)ccn2)CC1	ZINC000450505066	CE	On-Demand	Anodyne	DRD3	31	45
CCC(=O)CCCN1CCN(c2cc(C)ccn2)CC1	ZINC000450505066	CE	On-Demand	Anodyne	HTR7	42	38
CNc1nc(N2CCN(c3ccncc3OC)CC2)nc2ccccc12	ZINC000450505070	FD	On-Demand	Anodyne	HRH4	15	42
CNc1nc(N2CCN(c3ccncc3OC)CC2)nc2ccccc12	ZINC000450505070	FD	On-Demand	Anodyne	CCR4	40	36
CNc1nc(N2CCN(c3ccncc3OC)CC2)nc2ccccc12	ZINC000450505070	FD	On-Demand	Anodyne	EHMT2	45	40
O=C(O)CCNC(=O)c1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450505087	GF	On-Demand	Anodyne	GCGR	87	43
O=C(O)CCNC(=O)c1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450505087	GF	On-Demand	Anodyne	EPHX2	17	42
O=C(O)CCNC(=O)c1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450505087	GF	On-Demand	Anodyne	GIPR	63	40
COC(=O)c1coc(CN2CCN(Cc3ccc(Br)cc3)CC2)n1	ZINC000450505097	GF	On-Demand	Anodyne	SIGMAR1	15	40
COC(=O)c1coc(CN2CCN(Cc3ccc(Br)cc3)CC2)n1	ZINC000450505097	GF	On-Demand	Anodyne	CACNA1G	23	64
CC(C)(CNC(=O)[C@@H](CO)NC(N)=O)C1CCCCC1	ZINC000450505101	CC	On-Demand	Anodyne	NMT1	32	42
CC(C)(CNC(=O)[C@H](CO)NC(N)=O)C1CCCCC1	ZINC000450505108	CC	On-Demand	Anodyne	NMT1	32	42
CCOC(=O)CC(C)(C)N(C)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450505112	DE	On-Demand	Anodyne	NCE103	27	41
CCOC(=O)CC(C)(C)N(C)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450505112	DE	On-Demand	Anodyne	CAN2	0	41
Fc1cccc(CN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505117	DF	On-Demand	Anodyne	SIGMAR1	19	47
Fc1cccc(CN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505118	DF	On-Demand	Anodyne	SIGMAR1	19	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc(C(F)(F)F)ccn1	ZINC000450505141	FH	On-Demand	Anodyne	ANPEP	29	40
CCC(=O)CCCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505147	FF	On-Demand	Anodyne	HTR1A	37	42
CCC(=O)CCCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505147	FF	On-Demand	Anodyne	DRD2	32	41
CCC(=O)CCCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505147	FF	On-Demand	Anodyne	HTR2A	30	42
CCC(=O)CCCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505147	FF	On-Demand	Anodyne	DRD3	54	39
CCC(=O)CCCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505147	FF	On-Demand	Anodyne	HRP1_PLAFA	44	35
CCC(=O)CCCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505147	FF	On-Demand	Anodyne	HTR7	47	35
CCC(=O)CCCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505147	FF	On-Demand	Anodyne	NPY2R	24	40
CCC(=O)CCCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505147	FF	On-Demand	Anodyne	CACNA1G	29	42
CCC(=O)CCCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505149	FF	On-Demand	Anodyne	HTR1A	37	42
CCC(=O)CCCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505149	FF	On-Demand	Anodyne	DRD2	32	41
CCC(=O)CCCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505149	FF	On-Demand	Anodyne	HTR2A	30	42
CCC(=O)CCCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505149	FF	On-Demand	Anodyne	DRD3	54	39
CCC(=O)CCCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505149	FF	On-Demand	Anodyne	HRP1_PLAFA	44	35
CCC(=O)CCCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505149	FF	On-Demand	Anodyne	HTR7	47	35
CCC(=O)CCCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505149	FF	On-Demand	Anodyne	NPY2R	24	40
CCC(=O)CCCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000450505149	FF	On-Demand	Anodyne	CACNA1G	29	42
COCC[C@@H](NC(=O)C1(C(=O)C2CC2)CC1)c1ccco1	ZINC000450505155	CE	On-Demand	Anodyne	NPPA	44	35
COCC[C@H](NC(=O)C1(C(=O)C2CC2)CC1)c1ccco1	ZINC000450505156	CE	On-Demand	Anodyne	NPPA	44	35
CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc3c2O[C@H](C)C3)c1	ZINC000450505161	FJ	On-Demand	Anodyne	PTPRF	40	30
CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc3c2O[C@H](C)C3)c1	ZINC000450505161	FJ	On-Demand	Anodyne	G2YM83_BOTF4	63	38
CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc3c2O[C@@H](C)C3)c1	ZINC000450505164	FJ	On-Demand	Anodyne	PTPRF	40	30
CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc3c2O[C@@H](C)C3)c1	ZINC000450505164	FJ	On-Demand	Anodyne	G2YM83_BOTF4	63	38
CC1(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)CCC(=O)CC1	ZINC000450505170	FG	On-Demand	Anodyne	ENV	48	37
CC1(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)CCC(=O)CC1	ZINC000450505173	FG	On-Demand	Anodyne	ENV	48	37
C[C@@H]1Cc2cccc(C(=O)N3CC[C@H](COc4ccccc4)C3)c2O1	ZINC000450505177	EH	On-Demand	Anodyne	COLA	54	35
C[C@@H]1Cc2cccc(C(=O)N3CC[C@H](COc4ccccc4)C3)c2O1	ZINC000450505177	EH	On-Demand	Anodyne	CPT1A	49	35
C[C@@H]1Cc2cccc(C(=O)N3CC[C@H](COc4ccccc4)C3)c2O1	ZINC000450505177	EH	On-Demand	Anodyne	NR1D1	39	42
C[C@H]1Cc2cccc(C(=O)N3CC[C@H](COc4ccccc4)C3)c2O1	ZINC000450505178	EH	On-Demand	Anodyne	COLA	54	35
C[C@H]1Cc2cccc(C(=O)N3CC[C@H](COc4ccccc4)C3)c2O1	ZINC000450505178	EH	On-Demand	Anodyne	CPT1A	49	35
C[C@H]1Cc2cccc(C(=O)N3CC[C@H](COc4ccccc4)C3)c2O1	ZINC000450505178	EH	On-Demand	Anodyne	NR1D1	39	42
C[C@@H]1Cc2cccc(C(=O)N3CC[C@@H](COc4ccccc4)C3)c2O1	ZINC000450505179	EH	On-Demand	Anodyne	COLA	54	35
C[C@@H]1Cc2cccc(C(=O)N3CC[C@@H](COc4ccccc4)C3)c2O1	ZINC000450505179	EH	On-Demand	Anodyne	CPT1A	49	35
C[C@@H]1Cc2cccc(C(=O)N3CC[C@@H](COc4ccccc4)C3)c2O1	ZINC000450505179	EH	On-Demand	Anodyne	NR1D1	39	42
C[C@H]1Cc2cccc(C(=O)N3CC[C@@H](COc4ccccc4)C3)c2O1	ZINC000450505180	EH	On-Demand	Anodyne	COLA	54	35
C[C@H]1Cc2cccc(C(=O)N3CC[C@@H](COc4ccccc4)C3)c2O1	ZINC000450505180	EH	On-Demand	Anodyne	CPT1A	49	35
C[C@H]1Cc2cccc(C(=O)N3CC[C@@H](COc4ccccc4)C3)c2O1	ZINC000450505180	EH	On-Demand	Anodyne	NR1D1	39	42
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	PTGER2	25	40
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	EPOR	0	42
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	PTGER4	26	40
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	FDFT1	0	48
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	PTGER3	51	35
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	CTSB	23	44
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	MTNR1A	44	42
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	ABCB1	24	43
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	CAPN1	32	44
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	CAPN2	63	44
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	ACE2	32	48
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	PLM1_PLAFA	22	41
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	PLM2_PLAFA	25	47
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	FFAR1	40	46
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	CRTM	62	42
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	PTGES	0	47
CC[C@@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505182	EG	On-Demand	Anodyne	PDS	97	49
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	PTGER2	25	40
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	EPOR	0	42
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	PTGER4	26	40
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	FDFT1	0	48
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	PTGER3	51	35
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	CTSB	23	44
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	MTNR1A	44	42
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	ABCB1	24	43
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	CAPN1	32	44
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	CAPN2	63	44
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	ACE2	32	48
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	PLM1_PLAFA	22	41
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	PLM2_PLAFA	25	47
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	FFAR1	40	46
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	CRTM	62	42
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	PTGES	0	47
CC[C@H](O)CC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505184	EG	On-Demand	Anodyne	PDS	97	49
C[C@H](CC(=O)O)NC(=O)CCCc1cc(F)ccc1F	ZINC000450505187	CE	On-Demand	Anodyne	MPO	24	42
C[C@@H](CC(=O)O)NC(=O)CCCc1cc(F)ccc1F	ZINC000450505188	CE	On-Demand	Anodyne	MPO	24	42
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	EPOR	0	41
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	AGTR2	43	35
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	PTGER3	46	34
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	MTNR1B	42	38
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	FAAH	27	42
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	CAPN1	31	41
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	CAPN2	36	41
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	ACE2	27	44
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	POL	0	45
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	AMP1_PLAFQ	45	38
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	FFAR1	40	38
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	CRTM	53	38
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@@H](O)C1CCC1	ZINC000450505189	EG	On-Demand	Anodyne	PDS	63	39
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	EPOR	0	41
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	AGTR2	43	35
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	PTGER3	46	34
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	MTNR1B	42	38
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	FAAH	27	42
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	CAPN1	31	41
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	CAPN2	36	41
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	ACE2	27	44
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	POL	0	45
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	AMP1_PLAFQ	45	38
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	FFAR1	40	38
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	CRTM	53	38
O=C(NCCc1cccc(OCc2ccccc2)c1)[C@H](O)C1CCC1	ZINC000450505190	EG	On-Demand	Anodyne	PDS	63	39
C[C@@H]1CC[C@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C[C@H]1C	ZINC000450505191	DH	On-Demand	Anodyne	COLA	49	38
C[C@@H]1CC[C@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C[C@H]1C	ZINC000450505191	DH	On-Demand	Anodyne	CPT1A	47	38
C[C@@H]1CC[C@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C[C@H]1C	ZINC000450505191	DH	On-Demand	Anodyne	CPT2	42	38
C[C@H]1C[C@@H](C(=O)N2CC[C@H](COc3ccccc3)C2)CC[C@H]1C	ZINC000450505192	DH	On-Demand	Anodyne	GRIN2B	26	42
C[C@H]1C[C@@H](C(=O)N2CC[C@H](COc3ccccc3)C2)CC[C@H]1C	ZINC000450505192	DH	On-Demand	Anodyne	COLA	49	38
C[C@H]1C[C@@H](C(=O)N2CC[C@H](COc3ccccc3)C2)CC[C@H]1C	ZINC000450505192	DH	On-Demand	Anodyne	CPT1A	47	38
C[C@H]1C[C@@H](C(=O)N2CC[C@H](COc3ccccc3)C2)CC[C@H]1C	ZINC000450505192	DH	On-Demand	Anodyne	CPT2	42	38
C[C@@H]1CC[C@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C[C@H]1C	ZINC000450505193	DH	On-Demand	Anodyne	COLA	49	38
C[C@@H]1CC[C@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C[C@H]1C	ZINC000450505193	DH	On-Demand	Anodyne	CPT1A	47	38
C[C@@H]1CC[C@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C[C@H]1C	ZINC000450505193	DH	On-Demand	Anodyne	CPT2	42	38
C[C@H]1C[C@@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)CC[C@H]1C	ZINC000450505194	DH	On-Demand	Anodyne	COLA	49	38
C[C@H]1C[C@@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)CC[C@H]1C	ZINC000450505194	DH	On-Demand	Anodyne	CPT1A	47	38
C[C@H]1C[C@@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)CC[C@H]1C	ZINC000450505194	DH	On-Demand	Anodyne	CPT2	42	38
CCOc1ccc(NC(=O)CN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450505207	ED	On-Demand	Anodyne	LTA4H	40	42
CCOc1ccc(NC(=O)CN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450505207	ED	On-Demand	Anodyne	KCNA5	0	57
CCOc1ccc(NC(=O)CN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450505207	ED	On-Demand	Anodyne	ACOX1	57	42
CCOc1ccc(NC(=O)CN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450505207	ED	On-Demand	Anodyne	NOD2	24	41
CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)C1CCC1	ZINC000450505209	DH	On-Demand	Anodyne	CHRM2	21	43
CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)C1CCC1	ZINC000450505209	DH	On-Demand	Anodyne	CHRM3	37	43
CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)C1CCC1	ZINC000450505209	DH	On-Demand	Anodyne	GRIN2B	37	43
CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)C1CCC1	ZINC000450505209	DH	On-Demand	Anodyne	SIGMAR1	16	45
CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)C1CCC1	ZINC000450505209	DH	On-Demand	Anodyne	COLA	54	37
CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)C1CCC1	ZINC000450505209	DH	On-Demand	Anodyne	CPT1A	53	37
CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)C1CCC1	ZINC000450505209	DH	On-Demand	Anodyne	AMY2	47	33
CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)C1CCC1	ZINC000450505209	DH	On-Demand	Anodyne	CHRNA10	65	42
CC(C)(C(=O)N1CC[C@@H](COc2ccccc2)C1)C1CCC1	ZINC000450505210	DH	On-Demand	Anodyne	GRIN2B	25	43
CC(C)(C(=O)N1CC[C@@H](COc2ccccc2)C1)C1CCC1	ZINC000450505210	DH	On-Demand	Anodyne	COLA	54	37
CC(C)(C(=O)N1CC[C@@H](COc2ccccc2)C1)C1CCC1	ZINC000450505210	DH	On-Demand	Anodyne	CPT1A	53	37
CC(C)(C(=O)N1CC[C@@H](COc2ccccc2)C1)C1CCC1	ZINC000450505210	DH	On-Demand	Anodyne	AMY2	47	33
CC(C)(C(=O)N1CC[C@@H](COc2ccccc2)C1)C1CCC1	ZINC000450505210	DH	On-Demand	Anodyne	CHRNA10	59	42
CCOc1ccc(NC(=O)CN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450505212	ED	On-Demand	Anodyne	LTA4H	40	42
CCOc1ccc(NC(=O)CN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450505212	ED	On-Demand	Anodyne	KCNA5	0	57
CCOc1ccc(NC(=O)CN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450505212	ED	On-Demand	Anodyne	ACOX1	57	42
CCOc1ccc(NC(=O)CN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450505212	ED	On-Demand	Anodyne	NOD2	24	41
COC(=O)C1(CN(C)[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000450505219	CE	On-Demand	Anodyne	YARS	41	32
COC(=O)C1(CN(C)[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000450505220	CE	On-Demand	Anodyne	YARS	41	32
O=C(CNc1ncnc2cc(Br)ccc12)NCC(F)F	ZINC000450505221	ED	On-Demand	Anodyne	EGFR	66	38
COC1(CNC(=O)c2cccc3c2CCCC3)CCC1	ZINC000450505228	CF	On-Demand	Anodyne	KCNA3	38	41
COC1(CNC(=O)c2cccc3c2CCCC3)CCC1	ZINC000450505228	CF	On-Demand	Anodyne	HCN1	66	39
COC1(CNC(=O)c2cccc3c2CCCC3)CCC1	ZINC000450505228	CF	On-Demand	Anodyne	HCN4	53	37
COC(=O)C1(CN2CCN(Cc3ccc(Br)cc3)CC2)CC1	ZINC000450505232	FF	On-Demand	Anodyne	SIGMAR1	29	43
COC(=O)C1(CN2CCN(Cc3ccc(Br)cc3)CC2)CC1	ZINC000450505232	FF	On-Demand	Anodyne	NPFFR2	27	43
COC(=O)C1(CN2CCN(Cc3ccc(Br)cc3)CC2)CC1	ZINC000450505232	FF	On-Demand	Anodyne	ADAM17	24	43
COC(=O)C1(CN2CCN(Cc3ccc(Br)cc3)CC2)CC1	ZINC000450505232	FF	On-Demand	Anodyne	CACNA1G	31	44
COC(=O)C1(CN2CCN(Cc3ccc(Br)cc3)CC2)CC1	ZINC000450505232	FF	On-Demand	Anodyne	NPFFR1	48	43
Cn1ccc(C(=O)Nc2cc(C(F)(F)F)ccn2)c1C1CCC1	ZINC000450505233	DH	On-Demand	Anodyne	MAP3K12	31	41
Cc1cccc(Cl)c1C(=O)N1CCN(C(=O)[C@@H](C)O)CC1	ZINC000450505240	DD	On-Demand	Anodyne	CCR5	0	40
Cc1cccc(Cl)c1C(=O)N1CCN(C(=O)[C@H](C)O)CC1	ZINC000450505241	DD	On-Demand	Anodyne	CCR5	0	40
COCCCS(=O)(=O)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450505257	GD	On-Demand	Anodyne	SSTR5	41	35
CN(C)c1nc(NCc2ncnn2C(C)(C)C)nc2ccccc12	ZINC000450505260	EE	On-Demand	Anodyne	ADRA2A	15	46
CCC(=O)C1(C(=O)N[C@H](CCOC)c2ccco2)CC1	ZINC000450505263	CE	On-Demand	Anodyne	NPPA	44	36
CCC(=O)C1(C(=O)N[C@@H](CCOC)c2ccco2)CC1	ZINC000450505264	CE	On-Demand	Anodyne	NPPA	44	36
N#CC1(CN[C@@H](Cc2ccccc2)c2ccccc2)CCC1	ZINC000450505267	CI	On-Demand	Mild	SCN9A	0	42
N#CC1(CN[C@H](Cc2ccccc2)c2ccccc2)CCC1	ZINC000450505268	CI	On-Demand	Mild	SCN9A	0	42
C[C@H](CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450505284	CE	On-Demand	Anodyne	AVPR1A	0	42
C[C@@H](CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450505285	CE	On-Demand	Anodyne	AVPR1A	0	42
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505292	EH	On-Demand	Anodyne	GRIN2B	21	40
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505293	EH	On-Demand	Anodyne	GRIN2B	21	40
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505294	EH	On-Demand	Anodyne	GRIN2B	21	40
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505295	EH	On-Demand	Anodyne	GRIN2B	21	40
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	HTR1A	21	55
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	DRD2	35	55
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	DRD1	34	51
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	DRD4	28	51
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	HTR2A	29	51
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	HTR2C	21	51
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	DRD3	30	51
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	DRD5	19	42
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	ERG2	22	46
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	HTR7	20	46
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	SLC18A3	0	47
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	HTR3B	0	44
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	CYP2J2	54	38
COCCCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450505296	GD	On-Demand	Anodyne	AP2S1	0	46
CC[C@H](CC(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505299	DH	On-Demand	Anodyne	GRIN2B	27	41
CC[C@H](CC(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505299	DH	On-Demand	Anodyne	CHRNA10	41	38
CC[C@H](CC(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505299	DH	On-Demand	Anodyne	AMP1_PLAFQ	15	43
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505300	DH	On-Demand	Anodyne	GRIN2B	27	41
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505300	DH	On-Demand	Anodyne	CHRNA10	41	38
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505300	DH	On-Demand	Anodyne	AMP1_PLAFQ	15	43
CC[C@@H](CC(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505301	DH	On-Demand	Anodyne	GRIN2B	27	41
CC[C@@H](CC(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505301	DH	On-Demand	Anodyne	CHRNA10	41	38
CC[C@@H](CC(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450505301	DH	On-Demand	Anodyne	AMP1_PLAFQ	15	43
CC[C@@H](CC(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505302	DH	On-Demand	Anodyne	AMP1_PLAFQ	15	43
O=C(CN=c1[nH]ncs1)N[C@H]1CCOc2ccccc21	ZINC000450505308	CD	On-Demand	Anodyne	LUXR	64	35
O=C(CN=c1[nH]ncs1)N[C@H]1CCOc2ccccc21	ZINC000450505308	CD	On-Demand	Anodyne	TRAR	71	35
O=C(CN=c1[nH]ncs1)N[C@@H]1CCOc2ccccc21	ZINC000450505309	CD	On-Demand	Anodyne	LUXR	64	35
O=C(CN=c1[nH]ncs1)N[C@@H]1CCOc2ccccc21	ZINC000450505309	CD	On-Demand	Anodyne	TRAR	71	35
COC(=O)Cc1ccc(NCC(=O)N[C@H]2CCOc3ccccc32)c([N+](=O)[O-])c1	ZINC000450505314	GE	On-Demand	Bother	LUXR	61	45
COC(=O)Cc1ccc(NCC(=O)N[C@H]2CCOc3ccccc32)c([N+](=O)[O-])c1	ZINC000450505314	GE	On-Demand	Bother	TRAR	40	45
COC(=O)Cc1ccc(NCC(=O)N[C@H]2CCOc3ccccc32)c([N+](=O)[O-])c1	ZINC000450505314	GE	On-Demand	Bother	LASR	32	45
COC(=O)Cc1ccc(NCC(=O)N[C@@H]2CCOc3ccccc32)c([N+](=O)[O-])c1	ZINC000450505315	GE	On-Demand	Bother	LUXR	61	45
COC(=O)Cc1ccc(NCC(=O)N[C@@H]2CCOc3ccccc32)c([N+](=O)[O-])c1	ZINC000450505315	GE	On-Demand	Bother	TRAR	40	45
COC(=O)Cc1ccc(NCC(=O)N[C@@H]2CCOc3ccccc32)c([N+](=O)[O-])c1	ZINC000450505315	GE	On-Demand	Bother	LASR	32	45
N#Cc1cccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c1Br	ZINC000450505332	GH	On-Demand	Mild	GRIN2B	20	41
N#Cc1cccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1Br	ZINC000450505333	GH	On-Demand	Mild	GRIN2B	20	41
O=C(Nc1ccccc1O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450505334	EG	On-Demand	Anodyne	CHRM3	25	43
O=C(Nc1ccccc1O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450505334	EG	On-Demand	Anodyne	TACR3	50	31
O=C(Nc1ccccc1O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450505335	EG	On-Demand	Anodyne	CHRM3	25	43
O=C(Nc1ccccc1O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450505335	EG	On-Demand	Anodyne	TACR3	50	31
Cc1ccc(C)c(N2CCN(Cc3cnns3)CC2)c1	ZINC000450505337	CE	On-Demand	Anodyne	DRD4	16	50
Cc1cccc(Cl)c1CN1CCN(C(=O)[C@@H]2CCCN2C)CC1	ZINC000450505341	EE	On-Demand	Anodyne	SLC6A1	52	37
Cc1cccc(Cl)c1CN1CCN(C(=O)[C@H]2CCCN2C)CC1	ZINC000450505343	EE	On-Demand	Anodyne	SLC6A1	52	37
O=C(CCCC(=O)C1CC1)Nc1cc(C(F)(F)F)ccn1	ZINC000450505350	DG	On-Demand	Anodyne	CCR2	40	34
O=C(CCCC(=O)C1CC1)Nc1cc(C(F)(F)F)ccn1	ZINC000450505350	DG	On-Demand	Anodyne	TYK2	51	36
COc1cccc(OCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505352	EE	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505352	EE	On-Demand	Anodyne	LTA4H	27	44
COc1cccc(OCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505352	EE	On-Demand	Anodyne	HRH3	16	54
COc1cccc(OCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505352	EE	On-Demand	Anodyne	CHRNA10	29	43
COc1cccc(OCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505353	EE	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505353	EE	On-Demand	Anodyne	LTA4H	27	44
COc1cccc(OCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505353	EE	On-Demand	Anodyne	HRH3	16	54
COc1cccc(OCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450505353	EE	On-Demand	Anodyne	CHRNA10	29	43
CCC(=O)CCCN1CCN(Cc2ccccc2Cl)CC1	ZINC000450505362	DG	On-Demand	Anodyne	DRD2	33	42
CCC(=O)CCCN1CCN(Cc2ccccc2Cl)CC1	ZINC000450505362	DG	On-Demand	Anodyne	DRD4	31	46
CCC(=O)CCCN1CCN(Cc2ccccc2Cl)CC1	ZINC000450505362	DG	On-Demand	Anodyne	HTR2A	35	42
CCC(=O)CCCN1CCN(Cc2ccccc2Cl)CC1	ZINC000450505362	DG	On-Demand	Anodyne	DRD3	31	40
CCC(=O)CCCN1CCN(Cc2ccccc2Cl)CC1	ZINC000450505362	DG	On-Demand	Anodyne	HTR7	49	42
CCC(=O)CCCN1CCN(Cc2ccccc2Cl)CC1	ZINC000450505362	DG	On-Demand	Anodyne	SIGMAR1	31	52
CCC(=O)CCCN1CCN(Cc2ccccc2Cl)CC1	ZINC000450505362	DG	On-Demand	Anodyne	CACNA1G	25	43
CCC(=O)CCCN1CCN(Cc2ccccc2Cl)CC1	ZINC000450505362	DG	On-Demand	Anodyne	CYP2J2	40	33
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@H]2Cc3c(C)cccc3O2)c1	ZINC000450505363	FI	On-Demand	Anodyne	PTPRF	40	31
CCCC(=O)Nc1ccc(Cl)c(NC(=O)[C@@H]2Cc3c(C)cccc3O2)c1	ZINC000450505364	FI	On-Demand	Anodyne	PTPRF	40	31
COC(=O)Cc1ccc(S[C@@H](C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450505365	FG	On-Demand	Bother	GSTM2	43	42
COC(=O)Cc1ccc(S[C@@H](C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450505365	FG	On-Demand	Bother	COLA	65	33
COC(=O)Cc1ccc(S[C@@H](C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450505365	FG	On-Demand	Bother	GSTP1	37	42
COC(=O)Cc1ccc(S[C@H](C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450505366	FG	On-Demand	Bother	GSTM2	43	42
COC(=O)Cc1ccc(S[C@H](C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450505366	FG	On-Demand	Bother	COLA	65	33
COC(=O)Cc1ccc(S[C@H](C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450505366	FG	On-Demand	Bother	GSTP1	37	42
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450505371	GE	On-Demand	Mild	AVPR1B	43	30
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450505371	GE	On-Demand	Mild	COLA	65	38
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450505371	GE	On-Demand	Mild	CPT1A	62	37
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450505371	GE	On-Demand	Mild	CPT2	47	35
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450505371	GE	On-Demand	Mild	TRPV4	45	41
COc1ccc(Cl)cc1S(=O)(=O)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450505371	GE	On-Demand	Mild	CPT1B	53	37
CN1CCC[C@@H]2CN(Cc3ccn(CCc4ccccc4)n3)CC[C@@H]21	ZINC000450505384	EG	On-Demand	Anodyne	SIGMAR1	17	41
CN1CCC[C@H]2CN(Cc3ccn(CCc4ccccc4)n3)CC[C@@H]21	ZINC000450505385	EG	On-Demand	Anodyne	SIGMAR1	17	41
CN1CCC[C@H]2CN(Cc3ccn(CCc4ccccc4)n3)CC[C@H]21	ZINC000450505386	EG	On-Demand	Anodyne	SIGMAR1	17	41
CN1CCC[C@@H]2CN(Cc3ccn(CCc4ccccc4)n3)CC[C@H]21	ZINC000450505387	EG	On-Demand	Anodyne	SIGMAR1	17	41
Cc1cncc(-c2nc(CN3CCN(c4cc(C)ccn4)CC3)no2)c1	ZINC000450505388	FE	On-Demand	Anodyne	ACOX1	33	40
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CC12CCSCC2	ZINC000450505406	DH	On-Demand	Anodyne	TYK2	48	32
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CC12CCSCC2	ZINC000450505407	DH	On-Demand	Anodyne	TYK2	48	32
CC(=O)[C@@](C)(O)CN1CCN(c2cc(C)ccc2C)CC1	ZINC000450505422	CD	On-Demand	Anodyne	ABCB1	18	40
CC(=O)[C@](C)(O)CN1CCN(c2cc(C)ccc2C)CC1	ZINC000450505423	CD	On-Demand	Anodyne	ABCB1	18	40
O=C1CCC(CN2CCN(Cc3ccc(Br)c(F)c3)CC2)CC1	ZINC000450505424	GG	On-Demand	Anodyne	SIGMAR1	23	40
COCCOC[C@H](O)CN1CCc2c(F)cc(F)cc2C1	ZINC000450505429	DD	On-Demand	Anodyne	HSP90AB1	34	40
COCCOC[C@@H](O)CN1CCc2c(F)cc(F)cc2C1	ZINC000450505430	DD	On-Demand	Anodyne	HSP90AB1	34	40
COc1cccc([C@@H]2CN(Cc3ccc(Cl)c(OC)c3)CCO2)c1	ZINC000450505434	EH	On-Demand	Anodyne	DRD4	33	52
COc1cccc([C@@H]2CN(Cc3ccc(Cl)c(OC)c3)CCO2)c1	ZINC000450505434	EH	On-Demand	Anodyne	DRD3	0	44
COc1cccc([C@H]2CN(Cc3ccc(Cl)c(OC)c3)CCO2)c1	ZINC000450505435	EH	On-Demand	Anodyne	DRD4	33	52
COc1cccc([C@H]2CN(Cc3ccc(Cl)c(OC)c3)CCO2)c1	ZINC000450505435	EH	On-Demand	Anodyne	DRD3	0	44
COc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccn2)c(Cl)c1OC	ZINC000450505437	FH	On-Demand	Anodyne	CSNK1D	34	43
COc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccn2)c(Cl)c1OC	ZINC000450505437	FH	On-Demand	Anodyne	KDR	44	39
CCCOc1cccc(CN2C[C@@H](C(=O)NC)Oc3ccccc32)c1	ZINC000450505455	EF	On-Demand	Anodyne	CYSLTR2	40	35
CCCOc1cccc(CN2C[C@H](C(=O)NC)Oc3ccccc32)c1	ZINC000450505456	EF	On-Demand	Anodyne	CYSLTR2	40	35
COC[C@]1(C(=O)N2CC[C@@H](COc3ccccc3)C2)CCOC1	ZINC000450505465	DD	On-Demand	Anodyne	CPT2	43	37
COC[C@]1(C(=O)N2CC[C@H](COc3ccccc3)C2)CCOC1	ZINC000450505466	DD	On-Demand	Anodyne	CPT2	43	37
COC[C@@]1(C(=O)N2CC[C@@H](COc3ccccc3)C2)CCOC1	ZINC000450505467	DD	On-Demand	Anodyne	CPT2	43	37
COC[C@@]1(C(=O)N2CC[C@H](COc3ccccc3)C2)CCOC1	ZINC000450505468	DD	On-Demand	Anodyne	CPT2	43	37
COc1ccc(Oc2ccc(C(=O)N3CC[C@H]([C@H](C)O)C3)nc2)cc1	ZINC000450505494	EF	On-Demand	Anodyne	TRPC6	31	40
COc1ccc(Oc2ccc(C(=O)N3CC[C@H]([C@H](C)O)C3)nc2)cc1	ZINC000450505494	EF	On-Demand	Anodyne	TRPC3	16	40
COc1ccc(Oc2ccc(C(=O)N3CC[C@H]([C@@H](C)O)C3)nc2)cc1	ZINC000450505495	EF	On-Demand	Anodyne	TRPC6	31	40
COc1ccc(Oc2ccc(C(=O)N3CC[C@H]([C@@H](C)O)C3)nc2)cc1	ZINC000450505495	EF	On-Demand	Anodyne	TRPC3	16	40
COc1ccc(Oc2ccc(C(=O)N3CC[C@@H]([C@H](C)O)C3)nc2)cc1	ZINC000450505496	EF	On-Demand	Anodyne	TRPC6	31	40
COc1ccc(Oc2ccc(C(=O)N3CC[C@@H]([C@H](C)O)C3)nc2)cc1	ZINC000450505496	EF	On-Demand	Anodyne	TRPC3	16	40
COc1ccc(Oc2ccc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)nc2)cc1	ZINC000450505497	EF	On-Demand	Anodyne	TRPC6	31	40
COc1ccc(Oc2ccc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)nc2)cc1	ZINC000450505497	EF	On-Demand	Anodyne	TRPC3	16	40
CC(=O)c1cn(CC(=O)N2CC[C@H](COc3ccccc3)C2)nn1	ZINC000450505510	ED	On-Demand	Anodyne	COLA	62	37
CC(=O)c1cn(CC(=O)N2CC[C@@H](COc3ccccc3)C2)nn1	ZINC000450505511	ED	On-Demand	Anodyne	COLA	62	37
COCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)c1ccco1	ZINC000450505516	GF	On-Demand	Anodyne	NPPA	41	32
COCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)c1ccco1	ZINC000450505517	GF	On-Demand	Anodyne	NPPA	41	32
COCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)c1ccco1	ZINC000450505518	GF	On-Demand	Anodyne	NPPA	41	32
COCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)c1ccco1	ZINC000450505519	GF	On-Demand	Anodyne	NPPA	41	32
Cc1ccn(CC(=O)N2CC[C@H](COc3ccccc3)C2)n1	ZINC000450505520	CE	On-Demand	Anodyne	COLA	89	36
Cc1ccn(CC(=O)N2CC[C@H](COc3ccccc3)C2)n1	ZINC000450505520	CE	On-Demand	Anodyne	CPT1A	82	36
Cc1ccn(CC(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450505521	CE	On-Demand	Anodyne	COLA	89	36
Cc1ccn(CC(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450505521	CE	On-Demand	Anodyne	CPT1A	82	36
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	DRD2	23	44
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	DRD4	32	46
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	SLC6A1	0	46
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	HRH1	15	44
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	CHRM3	15	41
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	LTA4H	19	41
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	KCNQ2	28	43
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	SIGMAR1	45	47
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	CCR3	30	43
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	C5AR1	16	40
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	MCHR1	19	40
O=C(Nc1ccccc1O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450505533	FH	On-Demand	Anodyne	CACNA1G	41	43
O=C(CCCN1CCOC2(CCCC2)C1)c1ccc(F)cc1	ZINC000450505550	DG	On-Demand	Anodyne	DRD2	33	51
O=C(CCCN1CCOC2(CCCC2)C1)c1ccc(F)cc1	ZINC000450505550	DG	On-Demand	Anodyne	DRD1	19	48
O=C(CCCN1CCOC2(CCCC2)C1)c1ccc(F)cc1	ZINC000450505550	DG	On-Demand	Anodyne	HTR2A	20	48
O=C(CCCN1CCOC2(CCCC2)C1)c1ccc(F)cc1	ZINC000450505550	DG	On-Demand	Anodyne	HTR2C	16	54
O=C(CCCN1CCOC2(CCCC2)C1)c1ccc(F)cc1	ZINC000450505550	DG	On-Demand	Anodyne	ERG2	24	51
O=C(CCCN1CCOC2(CCCC2)C1)c1ccc(F)cc1	ZINC000450505550	DG	On-Demand	Anodyne	EBP	22	51
O=C(CCCN1CCOC2(CCCC2)C1)c1ccc(F)cc1	ZINC000450505550	DG	On-Demand	Anodyne	CYP2J2	51	36
O=C(CSC1CC1)Nc1cc(C(F)(F)F)ccn1	ZINC000450505551	CF	On-Demand	Anodyne	CCR2	45	34
O=C(CSC1CC1)Nc1cc(C(F)(F)F)ccn1	ZINC000450505551	CF	On-Demand	Anodyne	TYK2	40	33
C[C@@H](O)CCN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450505552	EE	On-Demand	Anodyne	IGF1R	15	51
C[C@@H](O)CCN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450505552	EE	On-Demand	Anodyne	SIGMAR1	25	47
C[C@@H](O)CCN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450505552	EE	On-Demand	Anodyne	CCR5	19	43
C[C@@H](O)CCN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450505552	EE	On-Demand	Anodyne	CACNA1G	24	46
C[C@H](O)CCN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450505553	EE	On-Demand	Anodyne	IGF1R	15	51
C[C@H](O)CCN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450505553	EE	On-Demand	Anodyne	SIGMAR1	25	47
C[C@H](O)CCN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450505553	EE	On-Demand	Anodyne	CCR5	19	43
C[C@H](O)CCN1CCN(Cc2ccc(Br)cc2)CC1	ZINC000450505553	EE	On-Demand	Anodyne	CACNA1G	24	46
CC[C@@H]1C[C@H]1C(=O)Nc1cc(C(F)(F)F)ccn1	ZINC000450505563	CG	On-Demand	Anodyne	TYK2	67	42
COc1cccc(Oc2ccc(C(=O)NCC3(OC)CCC3)nc2)c1	ZINC000450505568	EG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(Oc2ccc(C(=O)NCC3(OC)CCC3)nc2)c1	ZINC000450505568	EG	On-Demand	Anodyne	MTNR1A	40	40
COc1cccc(Oc2ccc(C(=O)NCC3(OC)CCC3)nc2)c1	ZINC000450505568	EG	On-Demand	Anodyne	MTNR1B	35	40
COc1cccc(OCCC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450505573	GD	On-Demand	Anodyne	CHRNA10	25	42
COc1cccc(OCCC(=O)N2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450505574	GD	On-Demand	Anodyne	CHRNA10	25	42
COc1cccc(OCCC(=O)N2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450505575	GD	On-Demand	Anodyne	CHRNA10	25	42
COc1cccc(OCCC(=O)N2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450505576	GD	On-Demand	Anodyne	CHRNA10	25	42
CN(C)S(=O)(=O)CC(=O)Nc1ccc(C(=O)O)c(Cl)c1	ZINC000450505587	DC	On-Demand	Anodyne	PPX1	0	41
CCC1(CO)CCN(C(=O)CCOc2cccc(OC)c2)CC1	ZINC000450505588	DE	On-Demand	Anodyne	MTNR1A	25	43
FC(F)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450505595	CH	On-Demand	Anodyne	SIGMAR1	21	41
O=[N+]([O-])c1ccc2c(NC[C@H]3CCC(F)(F)C3)nccc2c1	ZINC000450505600	DG	On-Demand	Bother	PRKCQ	42	33
O=[N+]([O-])c1ccc2c(NC[C@@H]3CCC(F)(F)C3)nccc2c1	ZINC000450505601	DG	On-Demand	Bother	PRKCQ	42	33
CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc(CC)n2)c1	ZINC000450505604	EI	On-Demand	Anodyne	GRM4	57	38
CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc(CC)n2)c1	ZINC000450505604	EI	On-Demand	Anodyne	SHH	40	33
COc1cccc(OCCN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450505607	FH	On-Demand	Anodyne	DRD4	44	33
COc1cccc(OCCN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450505607	FH	On-Demand	Anodyne	SLC6A4	15	42
COc1cccc(OCCN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450505607	FH	On-Demand	Anodyne	ESR2	19	40
COc1cccc(OCCN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450505607	FH	On-Demand	Anodyne	LTA4H	37	47
COc1cccc(OCCN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450505607	FH	On-Demand	Anodyne	HRH3	28	42
COc1cccc(OCCN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450505607	FH	On-Demand	Anodyne	EBP	54	38
COc1cccc(OCCN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450505607	FH	On-Demand	Anodyne	CHRNA10	47	36
COc1cccc(OCCN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450505607	FH	On-Demand	Anodyne	PSMB2	45	38
COc1cccc(OCCN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450505608	FH	On-Demand	Anodyne	DRD4	44	33
COc1cccc(OCCN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450505608	FH	On-Demand	Anodyne	SLC6A4	15	42
COc1cccc(OCCN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450505608	FH	On-Demand	Anodyne	ESR2	19	40
COc1cccc(OCCN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450505608	FH	On-Demand	Anodyne	LTA4H	37	47
COc1cccc(OCCN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450505608	FH	On-Demand	Anodyne	HRH3	28	42
COc1cccc(OCCN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450505608	FH	On-Demand	Anodyne	EBP	54	38
COc1cccc(OCCN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450505608	FH	On-Demand	Anodyne	CHRNA10	47	36
COc1cccc(OCCN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450505608	FH	On-Demand	Anodyne	PSMB2	45	38
CCOC(=O)C1(COC)CCN(c2nc(C)cc(OCc3ccccc3)n2)CC1	ZINC000450505620	GG	On-Demand	Anodyne	SLC12A5	61	36
COc1cc(CC(=O)NCC2(OC)CCC2)ccc1Cl	ZINC000450505626	CF	On-Demand	Anodyne	TRPV1	24	45
COc1cc(CC(=O)NCC2(OC)CCC2)ccc1Cl	ZINC000450505626	CF	On-Demand	Anodyne	NCE103	26	46
COc1cc(CC(=O)NCC2(OC)CCC2)ccc1Cl	ZINC000450505626	CF	On-Demand	Anodyne	CAN2	0	46
C[C@H](C(=O)Nc1cc(C(F)(F)F)ccn1)[C@H]1OCCc2sccc21	ZINC000450505627	FI	On-Demand	Anodyne	MAP3K12	26	40
C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccn1)[C@@H]1OCCc2sccc21	ZINC000450505628	FI	On-Demand	Anodyne	MAP3K12	26	40
C[C@H](C(=O)Nc1cc(C(F)(F)F)ccn1)[C@@H]1OCCc2sccc21	ZINC000450505629	FI	On-Demand	Anodyne	MAP3K12	26	40
C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccn1)[C@H]1OCCc2sccc21	ZINC000450505630	FI	On-Demand	Anodyne	MAP3K12	26	40
CCCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2ccc(Cl)c(OC)c2)c1	ZINC000450505636	GJ	On-Demand	Anodyne	GRM4	15	42
CCCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2ccc(Cl)c(OC)c2)c1	ZINC000450505636	GJ	On-Demand	Anodyne	MTNR1A	15	46
CCCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2ccc(Cl)c(OC)c2)c1	ZINC000450505636	GJ	On-Demand	Anodyne	MTNR1B	22	46
CCCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2ccc(Cl)c(OC)c2)c1	ZINC000450505636	GJ	On-Demand	Anodyne	PFK	0	41
CCCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2ccc(Cl)c(OC)c2)c1	ZINC000450505636	GJ	On-Demand	Anodyne	ENPP1	59	32
CCCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2ccc(Cl)c(OC)c2)c1	ZINC000450505636	GJ	On-Demand	Anodyne	IMDH_CRYPV	21	48
COC(=O)c1csc(CN2CCN(c3cc(C)ccc3C)CC2)n1	ZINC000450505638	EF	On-Demand	Anodyne	DRD2	15	45
COC(=O)c1csc(CN2CCN(c3cc(C)ccc3C)CC2)n1	ZINC000450505638	EF	On-Demand	Anodyne	ADRA1D	15	40
COC(=O)c1csc(CN2CCN(c3cc(C)ccc3C)CC2)n1	ZINC000450505638	EF	On-Demand	Anodyne	DRD3	18	45
COC(=O)C1(NC(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450505660	CD	On-Demand	Anodyne	E3UJZ5_SPOLI	20	40
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450505662	EH	On-Demand	Anodyne	TRPV1	15	57
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450505662	EH	On-Demand	Anodyne	LIPC	0	41
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450505662	EH	On-Demand	Anodyne	MAPK10	15	47
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450505662	EH	On-Demand	Anodyne	CCR2	40	40
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450505662	EH	On-Demand	Anodyne	EPHX2	23	42
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450505662	EH	On-Demand	Anodyne	TYK2	62	39
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450505662	EH	On-Demand	Anodyne	LIPG	59	41
O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450505662	EH	On-Demand	Anodyne	MAP3K12	48	44
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCN(c2ccccc2)C1	ZINC000450505663	EH	On-Demand	Anodyne	TRPV1	15	57
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCN(c2ccccc2)C1	ZINC000450505663	EH	On-Demand	Anodyne	LIPC	0	41
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCN(c2ccccc2)C1	ZINC000450505663	EH	On-Demand	Anodyne	MAPK10	15	47
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCN(c2ccccc2)C1	ZINC000450505663	EH	On-Demand	Anodyne	CCR2	40	40
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCN(c2ccccc2)C1	ZINC000450505663	EH	On-Demand	Anodyne	EPHX2	23	42
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCN(c2ccccc2)C1	ZINC000450505663	EH	On-Demand	Anodyne	TYK2	62	39
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCN(c2ccccc2)C1	ZINC000450505663	EH	On-Demand	Anodyne	LIPG	59	41
O=C(Nc1cc(C(F)(F)F)ccn1)[C@H]1CCN(c2ccccc2)C1	ZINC000450505663	EH	On-Demand	Anodyne	MAP3K12	48	44
COc1ccc(C(=O)NCC2(OC)CCC2)cc1S(C)(=O)=O	ZINC000450505671	ED	On-Demand	Anodyne	COLA	58	37
COc1ccc(C(=O)NCC2(OC)CCC2)cc1S(C)(=O)=O	ZINC000450505671	ED	On-Demand	Anodyne	CPT1A	52	36
COc1ccc(C(=O)NCC2(OC)CCC2)cc1S(C)(=O)=O	ZINC000450505671	ED	On-Demand	Anodyne	CPT1B	41	33
C(=C\c1ccccc1)\CCN1CCN(C2CCCCC2)CC1	ZINC000450505674	CI	On-Demand	Anodyne	SIGMAR1	33	49
C(=C\c1ccccc1)\CCN1CCN(C2CCCCC2)CC1	ZINC000450505674	CI	On-Demand	Anodyne	EBP	22	50
C(=C/c1ccccc1)\CCN1CCN(C2CCCCC2)CC1	ZINC000450505675	CI	On-Demand	Anodyne	SIGMAR1	33	49
C(=C/c1ccccc1)\CCN1CCN(C2CCCCC2)CC1	ZINC000450505675	CI	On-Demand	Anodyne	EBP	22	50
O=C(Nc1cc(C(F)(F)F)ccn1)c1cc2n(n1)CCCC2	ZINC000450505688	DF	On-Demand	Anodyne	TYK2	58	33
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	ADORA2B	36	41
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	MMP13	61	43
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	MMP2	32	43
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	MMP3	62	43
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	MMP8	30	43
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	MMP9	43	43
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	PKM	18	57
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	MMP7	60	43
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505692	FD	On-Demand	Anodyne	MMP1	58	43
COc1ccc(OC(F)(F)F)c(C(=O)N2CCN(C(C)C)C(=O)C2)c1	ZINC000450505694	FE	On-Demand	Anodyne	P2RX7	17	51
COc1ccc(OC(F)(F)F)c(C(=O)N2CCN(C(C)C)C(=O)C2)c1	ZINC000450505694	FE	On-Demand	Anodyne	SLC6A9	30	45
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	ADORA2B	36	41
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	MMP13	61	43
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	MMP2	32	43
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	MMP3	62	43
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	MMP8	30	43
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	MMP9	43	43
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	PKM	18	57
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	MMP7	60	43
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000450505695	FD	On-Demand	Anodyne	MMP1	58	43
CCOC(=O)c1ccc(CN2CCC(C(F)F)CC2)nc1	ZINC000450505699	CF	On-Demand	Anodyne	SSTR5	49	41
CNC(=O)[C@@]1(C)CCN(c2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000450505706	EE	On-Demand	Anodyne	SLC12A5	55	33
CNC(=O)[C@]1(C)CCN(c2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000450505707	EE	On-Demand	Anodyne	SLC12A5	55	33
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	HTR1A	24	42
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	DRD2	20	44
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	DRD4	48	36
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	HTR2A	18	42
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	DRD3	29	42
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	LTA4H	23	41
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	HRH3	22	44
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	SIGMAR1	15	40
COC(=O)c1coc(CN2CCN(CCOc3cccc(OC)c3)CC2)n1	ZINC000450505708	GD	On-Demand	Anodyne	MTNR1B	15	41
C[C@]1(C(N)=O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450505709	EE	On-Demand	Anodyne	SIRT3	40	31
C[C@]1(C(N)=O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450505709	EE	On-Demand	Anodyne	SIRT2	42	31
C[C@]1(C(N)=O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450505709	EE	On-Demand	Anodyne	SIRT1	40	32
C[C@@]1(C(N)=O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450505710	EE	On-Demand	Anodyne	SIRT3	40	31
C[C@@]1(C(N)=O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450505710	EE	On-Demand	Anodyne	SIRT2	42	31
C[C@@]1(C(N)=O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450505710	EE	On-Demand	Anodyne	SIRT1	40	32
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC(=O)N1C	ZINC000450505715	EE	On-Demand	Anodyne	PDE3B	52	33
C[C@H]1CN(c2ncnc3cc(Br)ccc23)CC(=O)N1C	ZINC000450505717	EE	On-Demand	Anodyne	PDE3B	52	33
Cn1nc(C(=O)N2CC[C@H](COc3ccccc3)C2)c2c1CCCC2	ZINC000450505718	EF	On-Demand	Anodyne	COLA	50	36
Cn1nc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c2c1CCCC2	ZINC000450505719	EF	On-Demand	Anodyne	COLA	50	36
O=C(O)CCCCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450505720	DF	On-Demand	Anodyne	GRIA1	51	34
O=C(O)CCCCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450505720	DF	On-Demand	Anodyne	HDAC9	26	40
O=C(O)CCCCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450505720	DF	On-Demand	Anodyne	HDA106	0	42
O=C(O)CCCCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450505720	DF	On-Demand	Anodyne	NCE103	29	47
O=C(O)CCCCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450505720	DF	On-Demand	Anodyne	CAN2	0	47
COCCO[C@H]1CCCN(c2ccnc3ccc(OC(C)C)cc23)C1	ZINC000450505734	EH	On-Demand	Anodyne	PDE3B	49	31
COCCO[C@H]1CCCN(c2ccnc3ccc(OC(C)C)cc23)C1	ZINC000450505734	EH	On-Demand	Anodyne	FAP	0	40
COCCO[C@@H]1CCCN(c2ccnc3ccc(OC(C)C)cc23)C1	ZINC000450505735	EH	On-Demand	Anodyne	PDE3B	49	31
COCCO[C@@H]1CCCN(c2ccnc3ccc(OC(C)C)cc23)C1	ZINC000450505735	EH	On-Demand	Anodyne	FAP	0	40
Cc1nc(C)n(CCCC(=O)N2CC[C@H](COc3ccccc3)C2)n1	ZINC000450505754	EF	On-Demand	Anodyne	COLA	61	35
Cc1nc(C)n(CCCC(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450505755	EF	On-Demand	Anodyne	COLA	61	35
Cc1nn(C)cc1CC(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450505787	DE	On-Demand	Anodyne	P2RX7	48	40
Cc1cccc2c1C[C@@H](C(=O)N1CC[C@H](COc3ccccc3)C1)O2	ZINC000450505797	EG	On-Demand	Anodyne	COLA	53	35
Cc1cccc2c1C[C@H](C(=O)N1CC[C@H](COc3ccccc3)C1)O2	ZINC000450505798	EG	On-Demand	Anodyne	COLA	53	35
Cc1cccc2c1C[C@H](C(=O)N1CC[C@@H](COc3ccccc3)C1)O2	ZINC000450505799	EG	On-Demand	Anodyne	COLA	53	35
Cc1cccc2c1C[C@@H](C(=O)N1CC[C@@H](COc3ccccc3)C1)O2	ZINC000450505800	EG	On-Demand	Anodyne	COLA	53	35
CCc1cccc(C(=O)N2CC[C@H](COc3ccccc3)C2)n1	ZINC000450505839	DG	On-Demand	Anodyne	GRIN2B	37	44
CCc1cccc(C(=O)N2CC[C@H](COc3ccccc3)C2)n1	ZINC000450505839	DG	On-Demand	Anodyne	CCKAR	48	33
CCc1cccc(C(=O)N2CC[C@H](COc3ccccc3)C2)n1	ZINC000450505839	DG	On-Demand	Anodyne	CPT1A	70	35
CCc1cccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450505840	DG	On-Demand	Anodyne	GRIN2B	37	44
CCc1cccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450505840	DG	On-Demand	Anodyne	CCKAR	48	33
CCc1cccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450505840	DG	On-Demand	Anodyne	CHEK2	21	40
CCc1cccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450505840	DG	On-Demand	Anodyne	CPT1A	70	35
C[C@@H](OCCc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450505853	FG	On-Demand	Anodyne	ANPEP	30	44
C[C@@H](OCCc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450505853	FG	On-Demand	Anodyne	AMP1_PLAFQ	39	44
C[C@H](OCCc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450505854	FG	On-Demand	Anodyne	ANPEP	30	44
C[C@H](OCCc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450505854	FG	On-Demand	Anodyne	AMP1_PLAFQ	39	44
COCCO[C@H]1CCCN(c2cc3nccc(Br)c3cc2C)C1	ZINC000450505864	GH	On-Demand	Anodyne	PDE3B	42	31
COCCO[C@@H]1CCCN(c2cc3nccc(Br)c3cc2C)C1	ZINC000450505865	GH	On-Demand	Anodyne	PDE3B	42	31
CCOCc1nc(C)c(C(=O)NCCc2cc(F)c(F)c(F)c2)s1	ZINC000450505869	FG	On-Demand	Anodyne	SCD1	26	43
CCOCc1nc(C)c(C(=O)NCCc2cc(F)c(F)c(F)c2)s1	ZINC000450505869	FG	On-Demand	Anodyne	SCD	18	43
O=C(CS(=O)(=O)C1CC1)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505892	FF	On-Demand	Anodyne	MMP26	0	43
O=C(CS(=O)(=O)C1CC1)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505892	FF	On-Demand	Anodyne	MMP15	0	43
O=C(CS(=O)(=O)C1CC1)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505892	FF	On-Demand	Anodyne	MMP16	0	43
O=C(CS(=O)(=O)C1CC1)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505892	FF	On-Demand	Anodyne	FFAR1	47	40
O=C(CS(=O)(=O)C1CC1)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505892	FF	On-Demand	Anodyne	CRTM	62	50
O=C(CS(=O)(=O)C1CC1)NCCc1cccc(OCc2ccccc2)c1	ZINC000450505892	FF	On-Demand	Anodyne	PDS	44	35
O=C(CCCc1cc(F)ccc1F)N[C@H](C(=O)O)C1CC1	ZINC000450505894	CE	On-Demand	Anodyne	DPP4	19	42
O=C(CCCc1cc(F)ccc1F)N[C@@H](C(=O)O)C1CC1	ZINC000450505895	CE	On-Demand	Anodyne	DPP4	19	42
O=C(O)CCNC(=O)c1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450505899	GG	On-Demand	Anodyne	GCGR	69	40
O=C(O)CCNC(=O)c1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450505899	GG	On-Demand	Anodyne	GIPR	54	36
CCOC(=O)c1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)on1	ZINC000450505901	EE	On-Demand	Anodyne	P2RY12	57	38
CCOC(=O)c1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)on1	ZINC000450505901	EE	On-Demand	Anodyne	GRIN2B	41	41
CCOC(=O)c1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)on1	ZINC000450505901	EE	On-Demand	Anodyne	COLA	92	41
CCOC(=O)c1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)on1	ZINC000450505901	EE	On-Demand	Anodyne	CPT1A	72	36
CCOC(=O)c1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)on1	ZINC000450505902	EE	On-Demand	Anodyne	P2RY12	57	38
CCOC(=O)c1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)on1	ZINC000450505902	EE	On-Demand	Anodyne	GRIN2B	41	41
CCOC(=O)c1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)on1	ZINC000450505902	EE	On-Demand	Anodyne	COLA	92	41
CCOC(=O)c1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)on1	ZINC000450505902	EE	On-Demand	Anodyne	CPT1A	72	36
Cc1ccc(F)c(CC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450505912	EH	On-Demand	Anodyne	GRIN2B	25	41
Cc1ccc(F)c(CC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450505912	EH	On-Demand	Anodyne	CCR3	26	42
Cc1ccc(F)c(CC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450505912	EH	On-Demand	Anodyne	CPT1A	41	36
Cc1ccc(F)c(CC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450505912	EH	On-Demand	Anodyne	ITGA4	52	39
Cc1ccc(F)c(CC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450505912	EH	On-Demand	Anodyne	CHRNA10	53	36
Cc1ccc(F)c(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450505913	EH	On-Demand	Anodyne	GRIN2B	25	41
Cc1ccc(F)c(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450505913	EH	On-Demand	Anodyne	CCR3	26	42
Cc1ccc(F)c(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450505913	EH	On-Demand	Anodyne	CPT1A	41	36
Cc1ccc(F)c(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450505913	EH	On-Demand	Anodyne	ITGA4	52	39
Cc1ccc(F)c(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450505913	EH	On-Demand	Anodyne	CHRNA10	53	36
CC(=O)N[C@H](C(=O)N1CC[C@H](COc2ccccc2)C1)C(C)(C)C	ZINC000450505915	EE	On-Demand	Anodyne	SLC6A1	17	42
CC(=O)N[C@H](C(=O)N1CC[C@H](COc2ccccc2)C1)C(C)(C)C	ZINC000450505915	EE	On-Demand	Anodyne	CTRB1	42	32
CC(=O)N[C@H](C(=O)N1CC[C@H](COc2ccccc2)C1)C(C)(C)C	ZINC000450505915	EE	On-Demand	Anodyne	GAG-PRO	45	34
CC(=O)N[C@H](C(=O)N1CC[C@@H](COc2ccccc2)C1)C(C)(C)C	ZINC000450505916	EE	On-Demand	Anodyne	SLC6A1	17	42
CC(=O)N[C@H](C(=O)N1CC[C@@H](COc2ccccc2)C1)C(C)(C)C	ZINC000450505916	EE	On-Demand	Anodyne	CTRB1	42	32
CC(=O)N[C@H](C(=O)N1CC[C@@H](COc2ccccc2)C1)C(C)(C)C	ZINC000450505916	EE	On-Demand	Anodyne	GAG-PRO	45	34
O=C(CC1CC(F)(F)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505918	DG	On-Demand	Anodyne	SIGMAR1	15	45
O=C(CC1CC(F)(F)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505918	DG	On-Demand	Anodyne	CPT1A	41	37
O=C(CC1CC(F)(F)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505918	DG	On-Demand	Anodyne	ITGA4	42	31
O=C(CC1CC(F)(F)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450505919	DG	On-Demand	Anodyne	SIGMAR1	15	45
O=C(CC1CC(F)(F)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450505919	DG	On-Demand	Anodyne	CPT1A	41	37
O=C(CC1CC(F)(F)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450505919	DG	On-Demand	Anodyne	ITGA4	42	31
COC(=O)c1csc(CN2CC[C@@H](C)Sc3ccccc32)n1	ZINC000450505925	EH	On-Demand	Anodyne	TRPC6	42	34
COC(=O)c1csc(CN2CC[C@@H](C)Sc3ccccc32)n1	ZINC000450505925	EH	On-Demand	Anodyne	TRPC3	41	34
COC(=O)c1csc(CN2CC[C@H](C)Sc3ccccc32)n1	ZINC000450505926	EH	On-Demand	Anodyne	TRPC6	42	34
COC(=O)c1csc(CN2CC[C@H](C)Sc3ccccc32)n1	ZINC000450505926	EH	On-Demand	Anodyne	TRPC3	41	34
O=C(c1ccsc1Br)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505927	FI	On-Demand	Anodyne	GRIN2B	35	45
O=C(c1ccsc1Br)N1CC[C@H](COc2ccccc2)C1	ZINC000450505928	FI	On-Demand	Anodyne	GRIN2B	35	45
CN1CCC[C@@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C1=O	ZINC000450505931	DD	On-Demand	Anodyne	COLA	40	37
CN1CCC[C@@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C1=O	ZINC000450505931	DD	On-Demand	Anodyne	CPT1A	40	37
CN1CCC[C@@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C1=O	ZINC000450505931	DD	On-Demand	Anodyne	CHRNA10	73	44
CN1CCC[C@@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C1=O	ZINC000450505932	DD	On-Demand	Anodyne	COLA	40	37
CN1CCC[C@@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C1=O	ZINC000450505932	DD	On-Demand	Anodyne	CPT1A	40	37
CN1CCC[C@@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C1=O	ZINC000450505932	DD	On-Demand	Anodyne	CHRNA10	73	44
CN1CCC[C@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C1=O	ZINC000450505933	DD	On-Demand	Anodyne	COLA	40	37
CN1CCC[C@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C1=O	ZINC000450505933	DD	On-Demand	Anodyne	CPT1A	40	37
CN1CCC[C@H](C(=O)N2CC[C@H](COc3ccccc3)C2)C1=O	ZINC000450505933	DD	On-Demand	Anodyne	CHRNA10	73	44
CN1CCC[C@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C1=O	ZINC000450505934	DD	On-Demand	Anodyne	COLA	40	37
CN1CCC[C@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C1=O	ZINC000450505934	DD	On-Demand	Anodyne	CPT1A	40	37
CN1CCC[C@H](C(=O)N2CC[C@@H](COc3ccccc3)C2)C1=O	ZINC000450505934	DD	On-Demand	Anodyne	CHRNA10	73	44
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450505941	GF	On-Demand	Anodyne	PYGL	57	35
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450505941	GF	On-Demand	Anodyne	PLD1	48	35
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450505941	GF	On-Demand	Anodyne	PLD2	40	35
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450505942	GF	On-Demand	Anodyne	PYGL	57	35
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450505942	GF	On-Demand	Anodyne	PLD1	48	35
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450505942	GF	On-Demand	Anodyne	PLD2	40	35
C[C@@H](C(=O)O)[C@@H](NC(=O)CCCc1cc(F)ccc1F)c1ccccc1	ZINC000450505943	FH	On-Demand	Anodyne	MPO	24	40
C[C@H](C(=O)O)[C@H](NC(=O)CCCc1cc(F)ccc1F)c1ccccc1	ZINC000450505944	FH	On-Demand	Anodyne	MPO	24	40
C[C@H](C(=O)O)[C@@H](NC(=O)CCCc1cc(F)ccc1F)c1ccccc1	ZINC000450505945	FH	On-Demand	Anodyne	MPO	24	40
C[C@@H](C(=O)O)[C@H](NC(=O)CCCc1cc(F)ccc1F)c1ccccc1	ZINC000450505946	FH	On-Demand	Anodyne	MPO	24	40
N#Cc1ccc(OCC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)cc1Br	ZINC000450505952	GD	On-Demand	Mild	TRPV4	42	33
N#Cc1ccc(OCC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)cc1Br	ZINC000450505953	GD	On-Demand	Mild	TRPV4	42	33
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CC[C@H](COc2ccccc2)C1	ZINC000450505975	GH	On-Demand	Anodyne	GRIN2B	28	40
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CC[C@H](COc2ccccc2)C1	ZINC000450505975	GH	On-Demand	Anodyne	ITGA4	51	38
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505976	GH	On-Demand	Anodyne	GRIN2B	28	40
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450505976	GH	On-Demand	Anodyne	ITGA4	51	38
COCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505986	FG	On-Demand	Anodyne	CAPNS1	44	31
COCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505986	FG	On-Demand	Anodyne	CAPN1	37	40
COCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505986	FG	On-Demand	Anodyne	CAPN2	44	35
COCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505986	FG	On-Demand	Anodyne	FPR1	48	35
COCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505986	FG	On-Demand	Anodyne	NPR	42	32
COCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505987	FG	On-Demand	Anodyne	CAPNS1	44	31
COCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505987	FG	On-Demand	Anodyne	CAPN1	37	40
COCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505987	FG	On-Demand	Anodyne	CAPN2	44	35
COCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505987	FG	On-Demand	Anodyne	FPR1	48	35
COCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1ccco1	ZINC000450505987	FG	On-Demand	Anodyne	NPR	42	32
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H]([C@H](C)O)C2)cc1	ZINC000450505991	DG	On-Demand	Anodyne	SLC18A3	18	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H]([C@H](C)O)C2)cc1	ZINC000450505991	DG	On-Demand	Anodyne	L3MBTL3	62	38
CCC(CC)Oc1ccc(C(=O)N2CC[C@H]([C@@H](C)O)C2)cc1	ZINC000450505992	DG	On-Demand	Anodyne	SLC18A3	18	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@H]([C@@H](C)O)C2)cc1	ZINC000450505992	DG	On-Demand	Anodyne	L3MBTL3	62	38
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H]([C@@H](C)O)C2)cc1	ZINC000450505993	DG	On-Demand	Anodyne	SLC18A3	18	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H]([C@@H](C)O)C2)cc1	ZINC000450505993	DG	On-Demand	Anodyne	L3MBTL3	62	38
CCC(CC)Oc1ccc(C(=O)N2CC[C@H]([C@H](C)O)C2)cc1	ZINC000450505994	DG	On-Demand	Anodyne	SLC18A3	18	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@H]([C@H](C)O)C2)cc1	ZINC000450505994	DG	On-Demand	Anodyne	L3MBTL3	62	38
OCCOC1(CNc2ncnc3cc(Br)ccc23)CCOCC1	ZINC000450506003	GD	On-Demand	Anodyne	EGFR	53	38
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H](C(=O)O)C1CC1	ZINC000450506016	CE	On-Demand	Anodyne	ENV	41	32
O=C(Cc1ccc(Cl)c(F)c1)N[C@H](C(=O)O)C1CC1	ZINC000450506017	CE	On-Demand	Anodyne	ENV	41	32
COc1cccc2c(N3CCC[C@@H](S(C)(=O)=O)CC3)nccc12	ZINC000450506021	EF	On-Demand	Anodyne	PDE3A	45	36
COc1cccc2c(N3CCC[C@@H](S(C)(=O)=O)CC3)nccc12	ZINC000450506021	EF	On-Demand	Anodyne	PDE3B	68	36
COc1cccc2c(N3CCC[C@H](S(C)(=O)=O)CC3)nccc12	ZINC000450506022	EF	On-Demand	Anodyne	PDE3A	45	36
COc1cccc2c(N3CCC[C@H](S(C)(=O)=O)CC3)nccc12	ZINC000450506022	EF	On-Demand	Anodyne	PDE3B	68	36
CC(=O)c1nc(NCC(=O)N[C@@H]2CCOc3ccccc32)sc1C	ZINC000450506036	EE	On-Demand	Anodyne	BDKRB1	15	40
CC(=O)c1nc(NCC(=O)N[C@@H]2CCOc3ccccc32)sc1C	ZINC000450506036	EE	On-Demand	Anodyne	LUXR	54	36
CC(=O)c1nc(NCC(=O)N[C@@H]2CCOc3ccccc32)sc1C	ZINC000450506036	EE	On-Demand	Anodyne	TRAR	66	36
CC(=O)c1nc(NCC(=O)N[C@@H]2CCOc3ccccc32)sc1C	ZINC000450506036	EE	On-Demand	Anodyne	LASR	45	36
CC(=O)c1nc(NCC(=O)N[C@H]2CCOc3ccccc32)sc1C	ZINC000450506037	EE	On-Demand	Anodyne	BDKRB1	15	40
CC(=O)c1nc(NCC(=O)N[C@H]2CCOc3ccccc32)sc1C	ZINC000450506037	EE	On-Demand	Anodyne	LUXR	54	36
CC(=O)c1nc(NCC(=O)N[C@H]2CCOc3ccccc32)sc1C	ZINC000450506037	EE	On-Demand	Anodyne	TRAR	66	36
CC(=O)c1nc(NCC(=O)N[C@H]2CCOc3ccccc32)sc1C	ZINC000450506037	EE	On-Demand	Anodyne	LASR	45	36
COc1cccc(C(=O)NCCCCCC(=O)O)c1[N+](=O)[O-]	ZINC000450506049	DD	On-Demand	Bother	DRD2	19	40
CC1(O)CC(C(=O)N2CC[C@H](COc3ccccc3)C2)C1	ZINC000450506067	CE	On-Demand	Anodyne	COLA	55	39
CC1(O)CC(C(=O)N2CC[C@H](COc3ccccc3)C2)C1	ZINC000450506067	CE	On-Demand	Anodyne	CPT1A	53	39
CC1(O)CC(C(=O)N2CC[C@H](COc3ccccc3)C2)C1	ZINC000450506067	CE	On-Demand	Anodyne	CPT2	42	39
CC1(O)CC(C(=O)N2CC[C@H](COc3ccccc3)C2)C1	ZINC000450506067	CE	On-Demand	Anodyne	L3MBTL3	40	36
CC1(O)CC(C(=O)N2CC[C@@H](COc3ccccc3)C2)C1	ZINC000450506068	CE	On-Demand	Anodyne	COLA	55	39
CC1(O)CC(C(=O)N2CC[C@@H](COc3ccccc3)C2)C1	ZINC000450506068	CE	On-Demand	Anodyne	CPT1A	53	39
CC1(O)CC(C(=O)N2CC[C@@H](COc3ccccc3)C2)C1	ZINC000450506068	CE	On-Demand	Anodyne	CPT2	42	39
CC1(O)CC(C(=O)N2CC[C@@H](COc3ccccc3)C2)C1	ZINC000450506068	CE	On-Demand	Anodyne	L3MBTL3	40	36
COCCO[C@H]1CCCN(c2nccc(-c3ccc(OC)cc3)n2)C1	ZINC000450506116	EF	On-Demand	Anodyne	DKK1	0	42
COCCO[C@@H]1CCCN(c2nccc(-c3ccc(OC)cc3)n2)C1	ZINC000450506117	EF	On-Demand	Anodyne	DKK1	0	42
O=C(CCCC(=O)N1CC[C@H](COc2ccccc2)C1)C1CC1	ZINC000450506146	DG	On-Demand	Anodyne	CPT1A	79	41
O=C(CCCC(=O)N1CC[C@H](COc2ccccc2)C1)C1CC1	ZINC000450506146	DG	On-Demand	Anodyne	CPT2	45	41
O=C(CCCC(=O)N1CC[C@@H](COc2ccccc2)C1)C1CC1	ZINC000450506147	DG	On-Demand	Anodyne	CPT1A	79	41
O=C(CCCC(=O)N1CC[C@@H](COc2ccccc2)C1)C1CC1	ZINC000450506147	DG	On-Demand	Anodyne	CPT2	45	41
CC[C@@H](C)[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506150	DF	On-Demand	Anodyne	ACE2	54	39
CC[C@@H](C)[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506150	DF	On-Demand	Anodyne	PFK	0	40
CC[C@@H](C)[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506150	DF	On-Demand	Anodyne	PDS	44	33
CC[C@H](C)[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506151	DF	On-Demand	Anodyne	ACE2	54	39
CC[C@H](C)[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506151	DF	On-Demand	Anodyne	PFK	0	40
CC[C@H](C)[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506151	DF	On-Demand	Anodyne	PDS	44	33
CC[C@@H](C)[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506152	DF	On-Demand	Anodyne	ACE2	54	39
CC[C@@H](C)[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506152	DF	On-Demand	Anodyne	PFK	0	40
CC[C@@H](C)[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450506152	DF	On-Demand	Anodyne	PDS	44	33
COc1cc(Cl)c(C(=O)N2CCc3ccccc3[C@H]2C(=O)O)cc1OC	ZINC000450506161	GG	On-Demand	Anodyne	MTNR1B	26	43
COc1cc(Cl)c(C(=O)N2CCc3ccccc3[C@@H]2C(=O)O)cc1OC	ZINC000450506162	GG	On-Demand	Anodyne	MTNR1B	26	43
C[C@@H]1C[C@]1(C#N)C(=O)NCCCOCCOCc1ccccc1	ZINC000450506163	DE	On-Demand	Mild	ALPHA-1A	0	40
C[C@H]1C[C@]1(C#N)C(=O)NCCCOCCOCc1ccccc1	ZINC000450506164	DE	On-Demand	Mild	ALPHA-1A	0	40
C[C@@H]1C[C@@]1(C#N)C(=O)NCCCOCCOCc1ccccc1	ZINC000450506165	DE	On-Demand	Mild	ALPHA-1A	0	40
C[C@H]1C[C@@]1(C#N)C(=O)NCCCOCCOCc1ccccc1	ZINC000450506166	DE	On-Demand	Mild	ALPHA-1A	0	40
O=C([C@@H]1C[C@H]1c1ccccc1Cl)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506177	FI	On-Demand	Anodyne	GRIN2B	21	40
O=C([C@@H]1C[C@H]1c1ccccc1Cl)N1CC[C@H](COc2ccccc2)C1	ZINC000450506178	FI	On-Demand	Anodyne	GRIN2B	21	40
CC[C@@H](CC(C)C)C(=O)N[C@@H](CCOC)c1ccco1	ZINC000450506185	CH	On-Demand	Anodyne	CAPN1	16	40
CC[C@H](CC(C)C)C(=O)N[C@@H](CCOC)c1ccco1	ZINC000450506186	CH	On-Demand	Anodyne	CAPN1	16	40
CC[C@@H](CC(C)C)C(=O)N[C@H](CCOC)c1ccco1	ZINC000450506187	CH	On-Demand	Anodyne	CAPN1	16	40
CC[C@@H](CC(C)C)C(=O)N[C@H](CCOC)c1ccco1	ZINC000450506187	CH	On-Demand	Anodyne	CAPN2	28	40
CC[C@H](CC(C)C)C(=O)N[C@H](CCOC)c1ccco1	ZINC000450506188	CH	On-Demand	Anodyne	CAPN1	16	40
CC[C@H](CC(C)C)C(=O)N[C@H](CCOC)c1ccco1	ZINC000450506188	CH	On-Demand	Anodyne	CAPN2	28	40
Cc1nc(N[C@@H]2CCC[C@H]2OC(F)F)ncc1[N+](=O)[O-]	ZINC000450506190	CE	On-Demand	Bother	PRKCQ	45	35
CC(C)c1nnc(N2CCC(N3CCc4cc(F)ccc43)CC2)o1	ZINC000450506198	EG	On-Demand	Anodyne	SCD1	34	48
CC(C)c1nnc(N2CCC(N3CCc4cc(F)ccc43)CC2)o1	ZINC000450506198	EG	On-Demand	Anodyne	SCD	28	45
C[C@@H]1CN(c2ccnc3cc(F)c(Cl)cc23)CC(=O)N1C	ZINC000450506199	DF	On-Demand	Anodyne	HRP1_PLAFA	62	32
C[C@H]1CN(c2ccnc3cc(F)c(Cl)cc23)CC(=O)N1C	ZINC000450506200	DF	On-Demand	Anodyne	HRP1_PLAFA	62	32
CC(C)(C)n1ncnc1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450506206	EH	On-Demand	Anodyne	HRP1_PLAFA	96	33
CC(C)(C)n1ncnc1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450506206	EH	On-Demand	Anodyne	HNMT	44	34
CCC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506207	DI	On-Demand	Anodyne	COLA	66	36
CCC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506207	DI	On-Demand	Anodyne	CPT1A	62	36
CCC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506208	DI	On-Demand	Anodyne	COLA	66	36
CCC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506208	DI	On-Demand	Anodyne	CPT1A	62	36
CCC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506209	DI	On-Demand	Anodyne	COLA	66	36
CCC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506209	DI	On-Demand	Anodyne	CPT1A	62	36
CCC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506210	DI	On-Demand	Anodyne	COLA	66	36
CCC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506210	DI	On-Demand	Anodyne	CPT1A	62	36
O=C(O)CCNC(=O)c1ccc(NC(=O)C2(C3CC3)CCOCC2)cc1	ZINC000450506222	FE	On-Demand	Anodyne	GCGR	68	42
O=C(O)CCNC(=O)c1ccc(NC(=O)C2(C3CC3)CCOCC2)cc1	ZINC000450506222	FE	On-Demand	Anodyne	GIPR	56	41
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450506224	DD	On-Demand	Anodyne	MTNR1A	27	40
CNC(=O)[C@H]1CCC[C@@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450506225	DD	On-Demand	Anodyne	MTNR1A	27	40
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450506226	DD	On-Demand	Anodyne	MTNR1A	27	40
CNC(=O)[C@H]1CCC[C@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450506227	DD	On-Demand	Anodyne	MTNR1A	27	40
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450506254	EG	On-Demand	Anodyne	GPBAR1	41	46
O=C(NCCc1cc(F)c(F)c(F)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450506255	EG	On-Demand	Anodyne	GPBAR1	41	46
COCCO[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450506275	FG	On-Demand	Anodyne	PDE3A	56	42
COCCO[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450506275	FG	On-Demand	Anodyne	PDE3B	82	42
COCCO[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450506276	FG	On-Demand	Anodyne	PDE3A	56	42
COCCO[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450506276	FG	On-Demand	Anodyne	PDE3B	82	42
COCC[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ccco1	ZINC000450506280	EF	On-Demand	Anodyne	MMP13	0	40
COCC[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ccco1	ZINC000450506281	EF	On-Demand	Anodyne	MMP13	0	40
C[C@@H](OCc1ccc(F)cc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450506298	FH	On-Demand	Anodyne	LEF	64	38
C[C@H](OCc1ccc(F)cc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450506299	FH	On-Demand	Anodyne	LEF	64	38
CC1(C(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CCC(=O)CC1	ZINC000450506305	GH	On-Demand	Anodyne	OPRK1	33	40
CC1(C(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CCC(=O)CC1	ZINC000450506305	GH	On-Demand	Anodyne	SIGMAR1	26	56
CC1(C(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CCC(=O)CC1	ZINC000450506305	GH	On-Demand	Anodyne	KCNJ1	86	38
COC(=O)c1coc(CN[C@@H](CCCc2ccccc2)c2ccccc2)n1	ZINC000450506319	FI	On-Demand	Anodyne	FAAH	27	53
COC(=O)c1coc(CN[C@H](CCCc2ccccc2)c2ccccc2)n1	ZINC000450506320	FI	On-Demand	Anodyne	FAAH	27	53
COC(=O)[C@]1(C)CN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450506322	FG	On-Demand	Anodyne	PDE3A	43	32
COC(=O)[C@]1(C)CN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450506322	FG	On-Demand	Anodyne	PDGFRB	50	42
COC(=O)[C@]1(C)CN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450506322	FG	On-Demand	Anodyne	PDE3B	64	32
COC(=O)C1(NC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450506326	FE	On-Demand	Anodyne	DRD2	15	41
COC(=O)C1(NC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450506326	FE	On-Demand	Anodyne	DRD3	22	41
COC(=O)C1(NC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450506326	FE	On-Demand	Anodyne	CPT1A	45	32
COC(=O)C1(NC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450506326	FE	On-Demand	Anodyne	HPGD	50	62
COCCOC[C@@H](O)CN[C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000450506340	EF	On-Demand	Anodyne	ADRB2	16	45
COCCOC[C@H](O)CN[C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000450506341	EF	On-Demand	Anodyne	ADRB2	16	45
COCCOC[C@@H](O)CN[C@H](c1ccccc1)c1ccc(C)cc1	ZINC000450506342	EF	On-Demand	Anodyne	ADRB2	16	45
COCCOC[C@H](O)CN[C@H](c1ccccc1)c1ccc(C)cc1	ZINC000450506343	EF	On-Demand	Anodyne	ADRB2	16	45
COc1cc(Br)cc(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450506344	FG	On-Demand	Anodyne	PRNP	34	41
COc1cc(Br)cc(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450506344	FG	On-Demand	Anodyne	TAAR1	41	43
COc1cc(Br)cc(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450506344	FG	On-Demand	Anodyne	DGAT1	45	43
CC(C)Cn1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(C(F)F)n1	ZINC000450506345	GI	On-Demand	Anodyne	GRIN2B	21	42
CC(C)Cn1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(C(F)F)n1	ZINC000450506346	GI	On-Demand	Anodyne	GRIN2B	21	42
Cc1cc(OCc2ccccc2)nc(N2CCC(O)(C(N)=O)CC2)n1	ZINC000450506355	ED	On-Demand	Anodyne	SLC12A5	65	35
COCC[C@@H](NC(=O)C(C)(C)C1CCC1)c1ccco1	ZINC000450506356	CG	On-Demand	Anodyne	AMY2	44	30
COCC[C@H](NC(=O)C(C)(C)C1CCC1)c1ccco1	ZINC000450506357	CG	On-Demand	Anodyne	AMY2	44	30
COc1cc2c(c(OC)c1OC)CCN(C[C@H](Cc1ccccc1)OC)CC2	ZINC000450506384	GG	On-Demand	Anodyne	ABCB1B	49	36
COc1cc2c(c(OC)c1OC)CCN(C[C@@H](Cc1ccccc1)OC)CC2	ZINC000450506385	GG	On-Demand	Anodyne	ABCB1B	49	36
COc1cccc(Oc2ccc(C(=O)NC[C@@H]3CC(=O)N(C4CC4)C3)nc2)c1	ZINC000450506386	GF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(Oc2ccc(C(=O)NC[C@H]3CC(=O)N(C4CC4)C3)nc2)c1	ZINC000450506387	GF	On-Demand	Anodyne	DRD4	40	31
COCCO[C@@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1	ZINC000450506393	GG	On-Demand	Anodyne	LIPG	33	41
COCCO[C@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1	ZINC000450506394	GG	On-Demand	Anodyne	LIPG	33	41
C[C@H](CN1CCN(Cc2nc3ccccc3s2)CC1)S(C)(=O)=O	ZINC000450506400	FD	On-Demand	Anodyne	ACOX1	47	32
C[C@@H](CN1CCN(Cc2nc3ccccc3s2)CC1)S(C)(=O)=O	ZINC000450506401	FD	On-Demand	Anodyne	ACOX1	47	32
C[C@H](CC(=O)O)NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450506404	CD	On-Demand	Anodyne	CXCL8	18	43
C[C@H](CC(=O)O)NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450506404	CD	On-Demand	Anodyne	SDH1	0	47
C[C@H](CC(=O)O)NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450506404	CD	On-Demand	Anodyne	TIMP3	40	33
C[C@@H](CC(=O)O)NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450506405	CD	On-Demand	Anodyne	CXCL8	18	43
C[C@@H](CC(=O)O)NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450506405	CD	On-Demand	Anodyne	SDH1	0	47
C[C@@H](CC(=O)O)NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450506405	CD	On-Demand	Anodyne	TIMP3	40	33
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506447	FH	On-Demand	Anodyne	GRIN2B	40	42
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506447	FH	On-Demand	Anodyne	LTA4H	23	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506447	FH	On-Demand	Anodyne	SIGMAR1	21	43
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506448	FH	On-Demand	Anodyne	GRIN2B	40	42
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506448	FH	On-Demand	Anodyne	LTA4H	23	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506448	FH	On-Demand	Anodyne	SIGMAR1	21	43
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506449	FH	On-Demand	Anodyne	GRIN2B	40	42
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506449	FH	On-Demand	Anodyne	LTA4H	23	40
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506449	FH	On-Demand	Anodyne	SIGMAR1	21	43
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506450	FH	On-Demand	Anodyne	GRIN2B	40	42
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506450	FH	On-Demand	Anodyne	LTA4H	23	40
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506450	FH	On-Demand	Anodyne	SIGMAR1	21	43
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCCC[C@H]1OC(F)F	ZINC000450506467	FF	On-Demand	Bother	TBXA2R	20	40
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506468	DH	On-Demand	Anodyne	COLA	52	38
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506468	DH	On-Demand	Anodyne	CPT1A	48	38
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506468	DH	On-Demand	Anodyne	CPT2	41	38
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506468	DH	On-Demand	Anodyne	ITGA4	43	33
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506468	DH	On-Demand	Anodyne	CHRNA10	43	40
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506469	DH	On-Demand	Anodyne	COLA	52	38
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506469	DH	On-Demand	Anodyne	CPT1A	48	38
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506469	DH	On-Demand	Anodyne	CPT2	41	38
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506469	DH	On-Demand	Anodyne	ITGA4	43	33
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506469	DH	On-Demand	Anodyne	CHRNA10	43	40
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506470	DH	On-Demand	Anodyne	COLA	52	38
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506470	DH	On-Demand	Anodyne	CPT1A	48	38
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506470	DH	On-Demand	Anodyne	CPT2	41	38
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506470	DH	On-Demand	Anodyne	ITGA4	43	33
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506470	DH	On-Demand	Anodyne	CHRNA10	43	40
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506471	DH	On-Demand	Anodyne	COLA	52	38
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506471	DH	On-Demand	Anodyne	CPT1A	48	38
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506471	DH	On-Demand	Anodyne	CPT2	41	38
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506471	DH	On-Demand	Anodyne	ITGA4	43	33
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506471	DH	On-Demand	Anodyne	CHRNA10	43	40
CC[C@H](C)[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450506472	DG	On-Demand	Anodyne	NCE103	46	38
CC[C@@H](C)[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450506473	DG	On-Demand	Anodyne	NCE103	46	38
CC[C@@H](C)[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450506474	DG	On-Demand	Anodyne	NCE103	46	38
NS(=O)(=O)c1ccc(S(=O)(=O)N2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450506476	GD	On-Demand	Anodyne	CA2	18	40
NS(=O)(=O)c1ccc(S(=O)(=O)N2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450506476	GD	On-Demand	Anodyne	CA12	20	40
O=C(c1cc2cccnc2s1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506477	EH	On-Demand	Anodyne	GRIN2B	47	44
O=C(c1cc2cccnc2s1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506477	EH	On-Demand	Anodyne	COLA	44	35
O=C(c1cc2cccnc2s1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506477	EH	On-Demand	Anodyne	CPT1A	47	35
O=C(c1cc2cccnc2s1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506478	EH	On-Demand	Anodyne	GRIN2B	47	44
O=C(c1cc2cccnc2s1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506478	EH	On-Demand	Anodyne	COLA	44	35
O=C(c1cc2cccnc2s1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506478	EH	On-Demand	Anodyne	CPT1A	47	35
Cc1ccn(-c2ccccc2C(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450506491	FH	On-Demand	Anodyne	HCRTR1	24	40
Cc1ccn(-c2ccccc2C(=O)N2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450506491	FH	On-Demand	Anodyne	HCRTR2	23	40
Cc1ccn(-c2ccccc2C(=O)N2CC[C@H](COc3ccccc3)C2)n1	ZINC000450506492	FH	On-Demand	Anodyne	HCRTR1	24	40
Cc1ccn(-c2ccccc2C(=O)N2CC[C@H](COc3ccccc3)C2)n1	ZINC000450506492	FH	On-Demand	Anodyne	HCRTR2	23	40
CCC[C@@H](OC)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450506497	CF	On-Demand	Anodyne	LEF	46	33
CCC[C@H](OC)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450506498	CF	On-Demand	Anodyne	LEF	46	33
COC(=O)C1(NC(=O)c2cc3ccncc3s2)CC1	ZINC000450506505	CD	On-Demand	Anodyne	SELE	50	33
COC(=O)C1(NC(=O)c2cc3ccncc3s2)CC1	ZINC000450506505	CD	On-Demand	Anodyne	ICAM1	45	33
COC(=O)C1(NC(=O)c2cc3ccncc3s2)CC1	ZINC000450506505	CD	On-Demand	Anodyne	VCAM1	54	37
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)ccc21	ZINC000450506511	FF	On-Demand	Anodyne	PLK1	41	32
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]([C@@H](C)O)C3)ccc21	ZINC000450506511	FF	On-Demand	Anodyne	HPGD	63	70
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]([C@H](C)O)C3)ccc21	ZINC000450506512	FF	On-Demand	Anodyne	PLK1	41	32
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]([C@H](C)O)C3)ccc21	ZINC000450506512	FF	On-Demand	Anodyne	HPGD	63	70
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]([C@H](C)O)C3)ccc21	ZINC000450506513	FF	On-Demand	Anodyne	PLK1	41	32
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]([C@H](C)O)C3)ccc21	ZINC000450506513	FF	On-Demand	Anodyne	HPGD	63	70
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]([C@@H](C)O)C3)ccc21	ZINC000450506514	FF	On-Demand	Anodyne	PLK1	41	32
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]([C@@H](C)O)C3)ccc21	ZINC000450506514	FF	On-Demand	Anodyne	HPGD	63	70
CN(C)c1nc(N[C@@H]2CCC[C@H]2OC(F)F)nc2ccccc12	ZINC000450506539	DG	On-Demand	Anodyne	ADRA2A	18	48
Cc1cc(OCc2ccccc2)nc(N[C@H](C)C(=O)NCCF)n1	ZINC000450506542	EE	On-Demand	Anodyne	CAPN2	47	31
Cc1cc(OCc2ccccc2)nc(N[C@@H](C)C(=O)NCCF)n1	ZINC000450506543	EE	On-Demand	Anodyne	CAPN2	47	31
O=C(Nc1ccccc1O)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450506550	GG	On-Demand	Anodyne	CACNA1G	36	40
C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)C(=O)NCCF	ZINC000450506577	EE	On-Demand	Bother	MAOB	17	47
C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)C(=O)NCCF	ZINC000450506578	EE	On-Demand	Bother	MAOB	17	47
COC(=O)[C@]1(C)CN(c2nc(N(C)C)c3ccccc3n2)C[C@H]1C	ZINC000450506592	EE	On-Demand	Anodyne	ADRA2A	15	41
CNC(=O)[C@@H]1CN(CC[C@H](C)O)c2ccccc2O1	ZINC000450506595	CC	On-Demand	Anodyne	SCD1	0	41
CNC(=O)[C@H]1CN(CC[C@H](C)O)c2ccccc2O1	ZINC000450506596	CC	On-Demand	Anodyne	SCD1	0	41
CNC(=O)[C@@H]1CN(CC[C@@H](C)O)c2ccccc2O1	ZINC000450506597	CC	On-Demand	Anodyne	SCD1	0	41
CNC(=O)[C@H]1CN(CC[C@@H](C)O)c2ccccc2O1	ZINC000450506598	CC	On-Demand	Anodyne	SCD1	0	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450506624	FG	On-Demand	Anodyne	KCNQ2	54	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450506625	FG	On-Demand	Anodyne	KCNQ2	54	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450506626	FG	On-Demand	Anodyne	KCNQ2	54	37
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450506627	FG	On-Demand	Anodyne	KCNQ2	54	37
O=C([C@@H]1CC1(F)F)N1CC[C@H](COc2ccccc2)C1	ZINC000450506628	CF	On-Demand	Anodyne	SIGMAR1	15	46
O=C([C@H]1CC1(F)F)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506629	CF	On-Demand	Anodyne	SIGMAR1	15	46
O=C([C@H]1CC1(F)F)N1CC[C@H](COc2ccccc2)C1	ZINC000450506630	CF	On-Demand	Anodyne	SIGMAR1	15	46
O=C([C@@H]1CC1(F)F)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506631	CF	On-Demand	Anodyne	SIGMAR1	15	46
O=C(O)CC1(NC(=O)Cc2ccc(Cl)c(F)c2)CCC1	ZINC000450506635	CF	On-Demand	Anodyne	ENV	41	34
O=C(O)CC1(NC(=O)Cc2ccc(Cl)c(F)c2)CCC1	ZINC000450506635	CF	On-Demand	Anodyne	PFK	0	40
O=C1CCCc2nc(N3CCC(N4CCc5cc(F)ccc54)CC3)ccc21	ZINC000450506642	FH	On-Demand	Anodyne	SCD1	34	44
O=C1CCCc2nc(N3CCC(N4CCc5cc(F)ccc54)CC3)ccc21	ZINC000450506642	FH	On-Demand	Anodyne	SCD	28	44
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC[C@H](COc2ccccc2)C1	ZINC000450506645	DG	On-Demand	Anodyne	CPT2	41	39
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC[C@H](COc2ccccc2)C1	ZINC000450506645	DG	On-Demand	Anodyne	ITGA4	46	35
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506646	DG	On-Demand	Anodyne	CPT2	41	39
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506646	DG	On-Demand	Anodyne	ITGA4	46	35
Cc1c(C(=O)NCCCOCCOCc2ccccc2)nn2c1OCCC2	ZINC000450506649	FE	On-Demand	Anodyne	HTR4	40	40
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[C@@H](COc2ccccc2)C1	ZINC000450506660	GI	On-Demand	Bother	LIPG	56	39
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[C@@H](COc2ccccc2)C1	ZINC000450506660	GI	On-Demand	Bother	PPXII	0	42
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[C@H](COc2ccccc2)C1	ZINC000450506661	GI	On-Demand	Bother	LIPG	56	39
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[C@H](COc2ccccc2)C1	ZINC000450506661	GI	On-Demand	Bother	PPXII	0	42
CC(F)(F)c1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cn1	ZINC000450506667	EH	On-Demand	Anodyne	GRIN2B	34	40
CC(F)(F)c1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cn1	ZINC000450506667	EH	On-Demand	Anodyne	CHEK2	17	40
CC(F)(F)c1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cn1	ZINC000450506667	EH	On-Demand	Anodyne	ITGA4	43	33
CC(F)(F)c1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cn1	ZINC000450506667	EH	On-Demand	Anodyne	SFRP1	82	43
CC(F)(F)c1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cn1	ZINC000450506667	EH	On-Demand	Anodyne	WNT3	48	31
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cn1	ZINC000450506668	EH	On-Demand	Anodyne	GRIN2B	34	40
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cn1	ZINC000450506668	EH	On-Demand	Anodyne	CHEK2	17	40
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cn1	ZINC000450506668	EH	On-Demand	Anodyne	ITGA4	43	33
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cn1	ZINC000450506668	EH	On-Demand	Anodyne	SFRP1	82	43
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cn1	ZINC000450506668	EH	On-Demand	Anodyne	WNT3	48	31
COC(=O)c1coc(CN2CCN(Cc3nc4ccccc4s3)CC2)n1	ZINC000450506680	FE	On-Demand	Anodyne	LTA4H	26	40
COC(=O)c1coc(CN2CCN(Cc3nc4ccccc4s3)CC2)n1	ZINC000450506680	FE	On-Demand	Anodyne	AKR1B1	25	40
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450506694	EG	On-Demand	Anodyne	INHA	42	43
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450506695	EG	On-Demand	Anodyne	INHA	42	43
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@H]([C@@H](C)O)C2)c1	ZINC000450506698	EE	On-Demand	Anodyne	CACNA1B	21	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@H]([C@@H](C)O)C2)c1	ZINC000450506698	EE	On-Demand	Anodyne	SLC6A9	28	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@H]([C@H](C)O)C2)c1	ZINC000450506699	EE	On-Demand	Anodyne	CACNA1B	21	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@H]([C@H](C)O)C2)c1	ZINC000450506699	EE	On-Demand	Anodyne	SLC6A9	28	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@H]([C@H](C)O)C2)c1	ZINC000450506700	EE	On-Demand	Anodyne	CACNA1B	21	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@H]([C@H](C)O)C2)c1	ZINC000450506700	EE	On-Demand	Anodyne	SLC6A9	28	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@H]([C@@H](C)O)C2)c1	ZINC000450506701	EE	On-Demand	Anodyne	CACNA1B	21	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@H]([C@@H](C)O)C2)c1	ZINC000450506701	EE	On-Demand	Anodyne	SLC6A9	28	42
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506742	DH	On-Demand	Anodyne	ITGA4	43	33
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506742	DH	On-Demand	Anodyne	CHRNA10	43	40
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506743	DH	On-Demand	Anodyne	ITGA4	43	33
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506743	DH	On-Demand	Anodyne	CHRNA10	43	40
COCC[C@@H](NC(=O)CC1(O)CCC1)c1ccco1	ZINC000450506762	CD	On-Demand	Anodyne	NPPA	42	34
COCC[C@H](NC(=O)CC1(O)CCC1)c1ccco1	ZINC000450506763	CD	On-Demand	Anodyne	NPPA	42	34
C[C@@H]1CN(c2nc(N(C)C)c3ccccc3n2)CC(=O)N1C	ZINC000450506766	CD	On-Demand	Anodyne	ADRA2A	17	40
C[C@H]1CN(c2nc(N(C)C)c3ccccc3n2)CC(=O)N1C	ZINC000450506767	CD	On-Demand	Anodyne	ADRA2A	17	40
COc1cc(Cl)c(C(=O)N[C@H](C)CC(=O)O)cc1OC	ZINC000450506769	DD	On-Demand	Anodyne	HTR4	42	34
COc1cc(Cl)c(C(=O)N[C@@H](C)CC(=O)O)cc1OC	ZINC000450506770	DD	On-Demand	Anodyne	HTR4	42	34
O=C(C[C@H]1COc2ccccc2O1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506777	FG	On-Demand	Anodyne	ADRA2B	21	40
O=C(C[C@H]1COc2ccccc2O1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506777	FG	On-Demand	Anodyne	COLA	36	42
O=C(C[C@H]1COc2ccccc2O1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506777	FG	On-Demand	Anodyne	CPT1A	31	42
O=C(C[C@H]1COc2ccccc2O1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506777	FG	On-Demand	Anodyne	PTGDR	45	42
O=C(C[C@@H]1COc2ccccc2O1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506778	FG	On-Demand	Anodyne	ADRA2B	21	40
O=C(C[C@@H]1COc2ccccc2O1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506778	FG	On-Demand	Anodyne	COLA	36	42
O=C(C[C@@H]1COc2ccccc2O1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506778	FG	On-Demand	Anodyne	CPT1A	31	42
O=C(C[C@@H]1COc2ccccc2O1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506778	FG	On-Demand	Anodyne	PTGDR	45	42
O=C(C[C@@H]1COc2ccccc2O1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506779	FG	On-Demand	Anodyne	ADRA2B	21	40
O=C(C[C@@H]1COc2ccccc2O1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506779	FG	On-Demand	Anodyne	COLA	36	42
O=C(C[C@@H]1COc2ccccc2O1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506779	FG	On-Demand	Anodyne	CPT1A	31	42
O=C(C[C@@H]1COc2ccccc2O1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506779	FG	On-Demand	Anodyne	PTGDR	45	42
O=C(C[C@H]1COc2ccccc2O1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506780	FG	On-Demand	Anodyne	ADRA2B	21	40
O=C(C[C@H]1COc2ccccc2O1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506780	FG	On-Demand	Anodyne	COLA	36	42
O=C(C[C@H]1COc2ccccc2O1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506780	FG	On-Demand	Anodyne	CPT1A	31	42
O=C(C[C@H]1COc2ccccc2O1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506780	FG	On-Demand	Anodyne	PTGDR	45	42
CN(C)S(=O)(=O)CC(=O)N1CCc2ccccc2[C@@H]1C(=O)O	ZINC000450506789	EC	On-Demand	Anodyne	MTNR1B	0	46
CN(C)S(=O)(=O)CC(=O)N1CCc2ccccc2[C@@H]1C(=O)O	ZINC000450506789	EC	On-Demand	Anodyne	KEAP1	0	40
CN(C)S(=O)(=O)CC(=O)N1CCc2ccccc2[C@H]1C(=O)O	ZINC000450506790	EC	On-Demand	Anodyne	MTNR1B	0	46
CN(C)S(=O)(=O)CC(=O)N1CCc2ccccc2[C@H]1C(=O)O	ZINC000450506790	EC	On-Demand	Anodyne	KEAP1	0	40
CC[C@@H](O)CC(=O)Nc1ccc(OC)c(Oc2ccc(C)nn2)c1	ZINC000450506794	EF	On-Demand	Anodyne	ENPP1	67	39
CC[C@@H](O)CC(=O)Nc1ccc(OC)c(Oc2ccc(C)nn2)c1	ZINC000450506794	EF	On-Demand	Anodyne	DRTS_TRYCR	46	35
CC[C@H](O)CC(=O)Nc1ccc(OC)c(Oc2ccc(C)nn2)c1	ZINC000450506795	EF	On-Demand	Anodyne	ENPP1	67	39
CC[C@H](O)CC(=O)Nc1ccc(OC)c(Oc2ccc(C)nn2)c1	ZINC000450506795	EF	On-Demand	Anodyne	DRTS_TRYCR	46	35
CC[C@H](CC(C)C)C(=O)Nc1cccc2c1OCCC2=O	ZINC000450506796	CH	On-Demand	Anodyne	KCNQ2	41	32
CC[C@@H](CC(C)C)C(=O)Nc1cccc2c1OCCC2=O	ZINC000450506797	CH	On-Demand	Anodyne	KCNQ2	41	32
Cc1cccc(Cl)c1CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450506826	FI	On-Demand	Anodyne	DRD4	29	41
Cc1cccc(Cl)c1CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450506826	FI	On-Demand	Anodyne	SIGMAR1	21	49
Cc1cccc(Cl)c1CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450506826	FI	On-Demand	Anodyne	P2RX7	19	41
Cc1cccc(Cl)c1CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450506826	FI	On-Demand	Anodyne	EPHX2	29	45
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506828	FH	On-Demand	Anodyne	GRIN2B	42	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506828	FH	On-Demand	Anodyne	SIGMAR1	23	46
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506828	FH	On-Demand	Anodyne	CCR3	50	39
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506829	FH	On-Demand	Anodyne	GRIN2B	42	42
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506829	FH	On-Demand	Anodyne	SIGMAR1	23	46
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506829	FH	On-Demand	Anodyne	CCR3	50	39
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506830	FH	On-Demand	Anodyne	GRIN2B	42	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506830	FH	On-Demand	Anodyne	SIGMAR1	23	46
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506830	FH	On-Demand	Anodyne	CCR3	50	39
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506831	FH	On-Demand	Anodyne	GRIN2B	42	42
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506831	FH	On-Demand	Anodyne	SIGMAR1	23	46
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450506831	FH	On-Demand	Anodyne	CCR3	50	39
O=C(CO)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506832	DD	On-Demand	Anodyne	OPRK1	43	47
O=C(CO)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506832	DD	On-Demand	Anodyne	SIGMAR1	31	69
O=C(CO)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506832	DD	On-Demand	Anodyne	PYGL	0	40
O=C(CO)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506832	DD	On-Demand	Anodyne	KCNJ1	89	43
O=C(O)CC1(NC(=O)Cc2ccc(Cl)c(F)c2)CCOCC1	ZINC000450506834	EE	On-Demand	Anodyne	ENV	40	33
CC1(C(=O)NCCc2cccc(OCc3ccccc3)c2)CCC(=O)CC1	ZINC000450506837	FI	On-Demand	Anodyne	ALOX5	19	40
CC1(C(=O)NCCc2cccc(OCc3ccccc3)c2)CCC(=O)CC1	ZINC000450506837	FI	On-Demand	Anodyne	PTGER3	43	32
CC1(C(=O)NCCc2cccc(OCc3ccccc3)c2)CCC(=O)CC1	ZINC000450506837	FI	On-Demand	Anodyne	FFAR1	55	46
CC1(C(=O)NCCc2cccc(OCc3ccccc3)c2)CCC(=O)CC1	ZINC000450506837	FI	On-Demand	Anodyne	CRTM	57	38
CC1(C(=O)NCCc2cccc(OCc3ccccc3)c2)CCC(=O)CC1	ZINC000450506837	FI	On-Demand	Anodyne	PDS	52	37
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506849	GJ	On-Demand	Anodyne	RBP4	97	45
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@H](COc2ccccc2)C1	ZINC000450506850	GJ	On-Demand	Anodyne	RBP4	97	45
COc1cc(Cl)c(C(=O)NCCCCCC(=O)O)cc1OC	ZINC000450506853	EF	On-Demand	Anodyne	DRD2	15	44
COc1cc(Cl)c(C(=O)NCCCCCC(=O)O)cc1OC	ZINC000450506853	EF	On-Demand	Anodyne	HTR4	51	40
COC(=O)C1(NC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450506860	CC	On-Demand	Anodyne	HDAC1	27	40
COC(=O)C1(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450506861	FD	On-Demand	Anodyne	CA9	25	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000450506874	EF	On-Demand	Anodyne	CCR2	52	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000450506875	EF	On-Demand	Anodyne	CCR2	52	40
O=[N+]([O-])c1ccc(-c2csc(N[C@H]3CCCC34CCOCC4)n2)cc1	ZINC000450506878	FI	On-Demand	Bother	MAOB	15	49
O=[N+]([O-])c1ccc(-c2csc(N[C@@H]3CCCC34CCOCC4)n2)cc1	ZINC000450506879	FI	On-Demand	Bother	MAOB	15	49
COC(=O)C1(NC(=O)[C@H]2CCc3nnc(-c4cccc(C)c4)n3C2)CC1	ZINC000450506909	FD	On-Demand	Anodyne	TACR3	44	31
COC(=O)C1(NC(=O)[C@@H]2CCc3nnc(-c4cccc(C)c4)n3C2)CC1	ZINC000450506910	FD	On-Demand	Anodyne	TACR3	44	31
COc1ccc(-c2noc(N3CCC(n4cnc(C(N)=O)c4N)CC3)n2)cc1	ZINC000450506913	GD	On-Demand	Anodyne	COLA	22	41
COc1ccc(-c2noc(N3CCC(n4cnc(C(N)=O)c4N)CC3)n2)cc1	ZINC000450506913	GD	On-Demand	Anodyne	CPT1A	18	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]([C@@H](C)O)C1	ZINC000450506917	DF	On-Demand	Anodyne	CACNA1B	53	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]([C@@H](C)O)C1	ZINC000450506917	DF	On-Demand	Anodyne	LIPG	52	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]([C@@H](C)O)C1	ZINC000450506918	DF	On-Demand	Anodyne	CACNA1B	53	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]([C@@H](C)O)C1	ZINC000450506918	DF	On-Demand	Anodyne	LIPG	52	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]([C@H](C)O)C1	ZINC000450506919	DF	On-Demand	Anodyne	CACNA1B	53	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]([C@H](C)O)C1	ZINC000450506919	DF	On-Demand	Anodyne	LIPG	52	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]([C@H](C)O)C1	ZINC000450506920	DF	On-Demand	Anodyne	CACNA1B	53	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]([C@H](C)O)C1	ZINC000450506920	DF	On-Demand	Anodyne	LIPG	52	37
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506921	CG	On-Demand	Anodyne	ITGA4	43	33
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CC[C@H](COc2ccccc2)C1	ZINC000450506922	CG	On-Demand	Anodyne	ITGA4	43	33
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC[C@H](COc2ccccc2)C1	ZINC000450506923	CG	On-Demand	Anodyne	GRIN2B	19	41
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC[C@H](COc2ccccc2)C1	ZINC000450506923	CG	On-Demand	Anodyne	ITGA4	43	33
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506924	CG	On-Demand	Anodyne	GRIN2B	19	41
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506924	CG	On-Demand	Anodyne	ITGA4	43	33
CCc1cc(CCCN2CCN(Cc3nc4ccccc4s3)CC2)on1	ZINC000450506925	FH	On-Demand	Anodyne	DRD4	17	48
CCC(CC)Oc1ccc(C(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)cc1	ZINC000450506936	EF	On-Demand	Anodyne	CACNA1I	42	36
CCC(CC)Oc1ccc(C(=O)NC[C@H]2CC(=O)N(C3CC3)C2)cc1	ZINC000450506937	EF	On-Demand	Anodyne	CACNA1I	42	36
CC[C@H](O)CC(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506945	FF	On-Demand	Anodyne	OPRK1	40	41
CC[C@H](O)CC(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506945	FF	On-Demand	Anodyne	SIGMAR1	26	59
CC[C@H](O)CC(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506945	FF	On-Demand	Anodyne	ABCC1	40	31
CC[C@H](O)CC(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506945	FF	On-Demand	Anodyne	KCNJ1	84	39
CC[C@@H](O)CC(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506946	FF	On-Demand	Anodyne	OPRK1	40	41
CC[C@@H](O)CC(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506946	FF	On-Demand	Anodyne	SIGMAR1	26	59
CC[C@@H](O)CC(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506946	FF	On-Demand	Anodyne	ABCC1	40	31
CC[C@@H](O)CC(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450506946	FF	On-Demand	Anodyne	KCNJ1	84	39
COCC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccco1	ZINC000450506957	FI	On-Demand	Anodyne	RBP4	65	39
COCC[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccco1	ZINC000450506958	FI	On-Demand	Anodyne	RBP4	65	39
Cc1ccc2[nH]c(C(=O)NCCCCCC(=O)O)c(C)c2c1	ZINC000450506963	DG	On-Demand	Anodyne	NCE103	58	41
Cc1ccc2[nH]c(C(=O)NCCCCCC(=O)O)c(C)c2c1	ZINC000450506963	DG	On-Demand	Anodyne	MTCA1	44	35
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506964	FH	On-Demand	Anodyne	FKBP1A	47	33
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506964	FH	On-Demand	Anodyne	COLA	99	48
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506964	FH	On-Demand	Anodyne	CPT1A	92	48
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506964	FH	On-Demand	Anodyne	CPT2	52	48
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506964	FH	On-Demand	Anodyne	PREP	67	40
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506965	FH	On-Demand	Anodyne	FKBP1A	47	33
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506965	FH	On-Demand	Anodyne	COLA	99	48
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506965	FH	On-Demand	Anodyne	CPT1A	92	48
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506965	FH	On-Demand	Anodyne	CPT2	52	48
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506965	FH	On-Demand	Anodyne	PREP	67	40
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506966	FH	On-Demand	Anodyne	FKBP1A	47	33
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506966	FH	On-Demand	Anodyne	COLA	99	48
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506966	FH	On-Demand	Anodyne	CPT1A	92	48
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506966	FH	On-Demand	Anodyne	CPT2	52	48
O=C([C@@H]1CCCCN1C1CCCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450506966	FH	On-Demand	Anodyne	PREP	67	40
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506967	FH	On-Demand	Anodyne	FKBP1A	47	33
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506967	FH	On-Demand	Anodyne	COLA	99	48
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506967	FH	On-Demand	Anodyne	CPT1A	92	48
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506967	FH	On-Demand	Anodyne	CPT2	52	48
O=C([C@H]1CCCCN1C1CCCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450506967	FH	On-Demand	Anodyne	PREP	67	40
COC(=O)C1(NC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450506980	FE	On-Demand	Anodyne	CHRM3	15	44
COC(=O)C1(NC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450506980	FE	On-Demand	Anodyne	MMP13	16	49
COC(=O)C1(NC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450506980	FE	On-Demand	Anodyne	ROCK2	21	40
CSc1cccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450506991	EH	On-Demand	Anodyne	GRIN2B	41	44
CSc1cccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450506991	EH	On-Demand	Anodyne	CHRNA10	50	36
CSc1cccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450506991	EH	On-Demand	Anodyne	RHOA	0	41
CSc1cccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450506992	EH	On-Demand	Anodyne	GRIN2B	41	44
CSc1cccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450506992	EH	On-Demand	Anodyne	CHRNA10	50	36
CSc1cccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450506992	EH	On-Demand	Anodyne	RHOA	0	41
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	F2	70	40
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	FKBP1A	36	40
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	OPRM1	21	41
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	ELANE	46	39
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	TRY1_BOVIN	68	39
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	DPP4	19	44
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	PREP	100	44
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	LGMN	44	35
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	XIAP	43	49
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	SFRP1	40	38
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	WNT3	44	38
O=C(NCCc1cc(F)c(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450506994	GG	On-Demand	Anodyne	TMPRSS11D	69	38
COc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507010	GH	On-Demand	Anodyne	CCR3	18	41
COc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507010	GH	On-Demand	Anodyne	COLA	22	43
COc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507010	GH	On-Demand	Anodyne	CPT1A	17	43
COc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507010	GH	On-Demand	Anodyne	ITGA4	40	35
COc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507010	GH	On-Demand	Anodyne	ACKR3	44	34
COc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507011	GH	On-Demand	Anodyne	CCR3	18	41
COc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507011	GH	On-Demand	Anodyne	COLA	22	43
COc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507011	GH	On-Demand	Anodyne	CPT1A	17	43
COc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507011	GH	On-Demand	Anodyne	ITGA4	40	35
COc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)c(Cl)c1OC	ZINC000450507011	GH	On-Demand	Anodyne	ACKR3	44	34
COc1cc2c(c(OC)c1OC)CCN(Cc1cnn[nH]1)CC2	ZINC000450507017	DD	On-Demand	Anodyne	ABCB1B	45	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	ANPEP	39	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	CTSK	26	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	CTSL	29	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	GRIA1	30	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	CTSS	29	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	CAPN1	44	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	CAPN2	57	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	FPR1	41	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507040	FG	On-Demand	Anodyne	NPR	53	34
O=C(NCC1(c2ccc(F)cc2Cl)CC1)c1ccc(N2CCC2)nc1	ZINC000450507050	FH	On-Demand	Anodyne	HDAC1	0	40
O=C(NCC1(c2ccc(F)cc2Cl)CC1)c1ccc(N2CCC2)nc1	ZINC000450507050	FH	On-Demand	Anodyne	HPGDS	19	41
Cc1nc(N[C@H]2CCN(Cc3ccccc3)CC2(C)C)ncc1[N+](=O)[O-]	ZINC000450507051	FG	On-Demand	Bother	SIGMAR1	18	40
Cc1nc(N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)ncc1[N+](=O)[O-]	ZINC000450507052	FG	On-Demand	Bother	SIGMAR1	18	40
CCN(CCOCCO)c1ncnc2[nH]c3ccccc3c12	ZINC000450507053	DD	On-Demand	Anodyne	TUBB3	32	42
CCN(CCOCCO)c1ncnc2[nH]c3ccccc3c12	ZINC000450507053	DD	On-Demand	Anodyne	UTS2R	25	42
O=C(CCc1ccc2ccccc2c1O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507054	GI	On-Demand	Anodyne	GRIN2B	30	45
O=C(CCc1ccc2ccccc2c1O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507055	GI	On-Demand	Anodyne	GRIN2B	30	45
CN(C)c1nc(NCC2(OCCO)CCOCC2)nc2ccccc12	ZINC000450507065	ED	On-Demand	Anodyne	ADRA2A	15	45
CCCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507072	FI	On-Demand	Anodyne	OXTR	31	47
CCCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507072	FI	On-Demand	Anodyne	GRIN2B	22	41
CCCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507072	FI	On-Demand	Anodyne	LTA4H	15	42
CCCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507072	FI	On-Demand	Anodyne	SIGMAR1	15	40
CCCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507072	FI	On-Demand	Anodyne	PLA2G4B	41	35
CCCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507072	FI	On-Demand	Anodyne	CHRNA10	48	34
CCCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507072	FI	On-Demand	Anodyne	HCRTR2	15	40
CCCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507072	FI	On-Demand	Anodyne	L3MBTL3	22	40
CCCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507073	FI	On-Demand	Anodyne	OXTR	31	47
CCCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507073	FI	On-Demand	Anodyne	GRIN2B	22	41
CCCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507073	FI	On-Demand	Anodyne	LTA4H	15	42
CCCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507073	FI	On-Demand	Anodyne	SIGMAR1	15	40
CCCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507073	FI	On-Demand	Anodyne	PLA2G4B	41	35
CCCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507073	FI	On-Demand	Anodyne	CHRNA10	48	34
CCCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507073	FI	On-Demand	Anodyne	HCRTR2	15	40
CCCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450507073	FI	On-Demand	Anodyne	L3MBTL3	22	40
Cc1ccc(CC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)c(Br)c1	ZINC000450507075	FE	On-Demand	Anodyne	P2RX7	18	44
Cc1ccc(CC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)c(Br)c1	ZINC000450507076	FE	On-Demand	Anodyne	P2RX7	18	44
COCCO[C@H]1CCCN(c2c([N+](=O)[O-])cnc3cc(OC)ccc23)C1	ZINC000450507089	FF	On-Demand	Bother	PDE3B	42	33
COCCO[C@@H]1CCCN(c2c([N+](=O)[O-])cnc3cc(OC)ccc23)C1	ZINC000450507090	FF	On-Demand	Bother	PDE3B	42	33
Brc1ccc2c(N[C@H]3CCCC34CCOCC4)ncnc2c1	ZINC000450507093	FI	On-Demand	Anodyne	EGFR	29	40
Brc1ccc2c(N[C@@H]3CCCC34CCOCC4)ncnc2c1	ZINC000450507094	FI	On-Demand	Anodyne	EGFR	29	40
COC(=O)C1(NC(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450507117	FD	On-Demand	Mild	TRPV4	42	34
COC(=O)C1(NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450507120	EE	On-Demand	Anodyne	MTNR1A	23	43
COC(=O)C1(NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450507120	EE	On-Demand	Anodyne	MTNR1B	23	43
COc1cccc([C@@H]2C[C@@H](O)CN2c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)c1	ZINC000450507131	GI	On-Demand	Bother	EGFR	0	52
COc1cccc([C@@H]2C[C@H](O)CN2c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)c1	ZINC000450507132	GI	On-Demand	Bother	EGFR	0	52
COc1cccc([C@H]2C[C@H](O)CN2c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)c1	ZINC000450507133	GI	On-Demand	Bother	EGFR	0	52
COc1cccc([C@H]2C[C@@H](O)CN2c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)c1	ZINC000450507134	GI	On-Demand	Bother	EGFR	0	52
Cn1nc(C(=O)NCCCOCCOCc2ccccc2)c2c1CCCC2	ZINC000450507135	FF	On-Demand	Anodyne	FABP4	40	32
Cn1nc(C(=O)NCCCOCCOCc2ccccc2)c2c1CCCC2	ZINC000450507135	FF	On-Demand	Anodyne	ALPHA-1A	0	46
COCCOC[C@@H](O)CN1CCc2cc(OC)c(OC)c(OC)c2CC1	ZINC000450507181	FD	On-Demand	Anodyne	HSP90AB1	34	40
COCCOC[C@H](O)CN1CCc2cc(OC)c(OC)c(OC)c2CC1	ZINC000450507182	FD	On-Demand	Anodyne	HSP90AB1	34	40
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507187	GJ	On-Demand	Anodyne	LIPE	17	41
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507187	GJ	On-Demand	Anodyne	EPHX2	15	45
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507187	GJ	On-Demand	Anodyne	LIPG	46	36
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507188	GJ	On-Demand	Anodyne	LIPE	17	41
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507188	GJ	On-Demand	Anodyne	EPHX2	15	45
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507188	GJ	On-Demand	Anodyne	LIPG	46	36
O=C(c1cc2n(n1)CCCC2)N1CC[C@H](COc2ccccc2)C1	ZINC000450507195	EF	On-Demand	Anodyne	COLA	90	38
O=C(c1cc2n(n1)CCCC2)N1CC[C@H](COc2ccccc2)C1	ZINC000450507195	EF	On-Demand	Anodyne	GRM5	23	47
O=C(c1cc2n(n1)CCCC2)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507196	EF	On-Demand	Anodyne	COLA	90	38
O=C(c1cc2n(n1)CCCC2)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507196	EF	On-Demand	Anodyne	GRM5	23	47
CC(C)c1ncsc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507201	EH	On-Demand	Anodyne	GRIN2B	27	41
CC(C)c1ncsc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507202	EH	On-Demand	Anodyne	GRIN2B	27	41
COCC[C@@H](NC(=O)CCCc1ncc(C)o1)c1ccco1	ZINC000450507205	DF	On-Demand	Anodyne	NPPA	42	34
COCC[C@H](NC(=O)CCCc1ncc(C)o1)c1ccco1	ZINC000450507206	DF	On-Demand	Anodyne	NPPA	42	34
CC[C@@H](C)[C@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450507209	CB	On-Demand	Anodyne	ENPEP	66	43
CC[C@H](C)[C@@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450507210	CB	On-Demand	Anodyne	ENPEP	66	43
CC[C@@H](C)[C@@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450507211	CB	On-Demand	Anodyne	ENPEP	66	43
C=CCOc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507216	FH	On-Demand	Mild	SIGMAR1	18	42
C=CCOc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507216	FH	On-Demand	Mild	CCR3	19	40
C=CCOc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507216	FH	On-Demand	Mild	ITGA4	50	36
C=CCOc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507216	FH	On-Demand	Mild	MMP7	16	40
C=CCOc1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507216	FH	On-Demand	Mild	GPR183	0	43
C=CCOc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507217	FH	On-Demand	Mild	SIGMAR1	18	42
C=CCOc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507217	FH	On-Demand	Mild	CCR3	19	40
C=CCOc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507217	FH	On-Demand	Mild	ITGA4	50	36
C=CCOc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507217	FH	On-Demand	Mild	MMP7	16	40
C=CCOc1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507217	FH	On-Demand	Mild	GPR183	0	43
CCOCc1nc(C)c(C(=O)N2CC[C@H](COc3ccccc3)C2)s1	ZINC000450507222	FH	On-Demand	Anodyne	CPT1A	40	34
CCOCc1nc(C)c(C(=O)N2CC[C@@H](COc3ccccc3)C2)s1	ZINC000450507223	FH	On-Demand	Anodyne	CPT1A	40	34
CNC(=O)[C@@H]1CN(CC/C=C\c2ccccc2)c2ccccc2O1	ZINC000450507230	DG	On-Demand	Anodyne	CYSLTR2	52	38
CNC(=O)[C@H]1CN(CC/C=C/c2ccccc2)c2ccccc2O1	ZINC000450507231	DG	On-Demand	Anodyne	CYSLTR2	52	38
CNC(=O)[C@H]1CN(CC/C=C\c2ccccc2)c2ccccc2O1	ZINC000450507232	DG	On-Demand	Anodyne	CYSLTR2	52	38
CNC(=O)[C@@H]1CN(CC/C=C/c2ccccc2)c2ccccc2O1	ZINC000450507233	DG	On-Demand	Anodyne	CYSLTR2	52	38
C[C@H](O)[C@@H]1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450507244	FD	On-Demand	Mild	HTR1B	15	40
C[C@H](O)[C@H]1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450507245	FD	On-Demand	Mild	HTR1B	15	40
C[C@@H](O)[C@H]1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450507246	FD	On-Demand	Mild	HTR1B	15	40
C[C@@H](O)[C@@H]1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450507247	FD	On-Demand	Mild	HTR1B	15	40
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	DRD2	31	54
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	DRD4	66	54
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	ACHE	39	44
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	HRH2	23	41
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	HRH1	30	43
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	DRD3	29	52
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	HTR4	62	41
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	SIGMAR1	43	45
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	SSTR5	76	43
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	CCR1	22	42
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	CCR3	65	45
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	PDK1	48	37
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	MCHR1	45	45
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	CACNA1G	46	45
COc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1Cl	ZINC000450507274	FH	On-Demand	Anodyne	CCR8	31	42
Cc1ccc(Br)cc1CC(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000450507275	FE	On-Demand	Anodyne	INHA	31	40
Cc1ccc(Br)cc1CC(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000450507275	FE	On-Demand	Anodyne	P2RX7	15	42
Cc1ccc(Br)cc1CC(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000450507276	FE	On-Demand	Anodyne	INHA	31	40
Cc1ccc(Br)cc1CC(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000450507276	FE	On-Demand	Anodyne	P2RX7	15	42
Cc1ccc(C(=O)N2CC[C@@H]([C@@H](C)O)C2)c(Cl)c1Cl	ZINC000450507277	DG	On-Demand	Anodyne	P2RX7	19	41
Cc1ccc(C(=O)N2CC[C@H]([C@H](C)O)C2)c(Cl)c1Cl	ZINC000450507278	DG	On-Demand	Anodyne	P2RX7	19	41
Cc1ccc(C(=O)N2CC[C@@H]([C@H](C)O)C2)c(Cl)c1Cl	ZINC000450507279	DG	On-Demand	Anodyne	P2RX7	19	41
Cc1ccc(C(=O)N2CC[C@H]([C@@H](C)O)C2)c(Cl)c1Cl	ZINC000450507280	DG	On-Demand	Anodyne	P2RX7	19	41
COc1ccc(F)cc1CC(=O)N(CCC(=O)O)Cc1cccc(F)c1F	ZINC000450507281	GG	On-Demand	Anodyne	TSPO	50	43
COc1ccc(F)cc1CC(=O)N(CCC(=O)O)Cc1cccc(F)c1F	ZINC000450507281	GG	On-Demand	Anodyne	PTGDR2	19	45
COc1ccc(F)cc1CC(=O)N(CCC(=O)O)Cc1cccc(F)c1F	ZINC000450507281	GG	On-Demand	Anodyne	ACKR3	50	32
COC(=O)C1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450507286	EF	On-Demand	Anodyne	PDE6D	73	41
COC(=O)C1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450507286	EF	On-Demand	Anodyne	IMDH_CRYPV	36	54
COc1cc2c(c(OC)c1OC)CCN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450507287	GG	On-Demand	Anodyne	ABCB1B	42	37
COc1cc2c(c(OC)c1OC)CCN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450507287	GG	On-Demand	Anodyne	MTNR1B	22	41
COc1cc2c(c(OC)c1OC)CCN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450507288	GG	On-Demand	Anodyne	ABCB1B	42	37
COc1cc2c(c(OC)c1OC)CCN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450507288	GG	On-Demand	Anodyne	MTNR1B	22	41
COc1cc2c(c(OC)c1OC)CCN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450507289	GG	On-Demand	Anodyne	ABCB1B	42	37
COc1cc2c(c(OC)c1OC)CCN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450507289	GG	On-Demand	Anodyne	MTNR1B	22	41
COc1cc2c(c(OC)c1OC)CCN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450507290	GG	On-Demand	Anodyne	ABCB1B	42	37
COc1cc2c(c(OC)c1OC)CCN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450507290	GG	On-Demand	Anodyne	MTNR1B	22	41
COCC[C@H](NC(=O)C1=C(C)CC(C)(C)CC1)c1ccco1	ZINC000450507294	DI	On-Demand	Anodyne	NPPA	41	32
COCC[C@@H](NC(=O)C1=C(C)CC(C)(C)CC1)c1ccco1	ZINC000450507295	DI	On-Demand	Anodyne	NPPA	41	32
Cc1nc(N[C@@H]2CCCC[C@H]2OC(F)F)ncc1[N+](=O)[O-]	ZINC000450507296	DF	On-Demand	Bother	PRKCQ	41	35
COC(=O)c1csc(CN2CCN(Cc3nc4ccccc4s3)CC2)n1	ZINC000450507307	GF	On-Demand	Anodyne	LTA4H	24	40
COC(=O)c1csc(CN2CCN(Cc3nc4ccccc4s3)CC2)n1	ZINC000450507307	GF	On-Demand	Anodyne	AKR1B1	28	41
COC(=O)c1csc(CN2CCN(Cc3nc4ccccc4s3)CC2)n1	ZINC000450507307	GF	On-Demand	Anodyne	ACOX1	44	33
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507312	FH	On-Demand	Anodyne	P2RY12	72	40
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507312	FH	On-Demand	Anodyne	GRIN2B	32	43
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507312	FH	On-Demand	Anodyne	COLA	119	39
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507312	FH	On-Demand	Anodyne	CPT1A	101	39
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507312	FH	On-Demand	Anodyne	CPT2	41	37
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507312	FH	On-Demand	Anodyne	MT-CYB	40	30
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507313	FH	On-Demand	Anodyne	P2RY12	72	40
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507313	FH	On-Demand	Anodyne	GRIN2B	32	43
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507313	FH	On-Demand	Anodyne	COLA	119	39
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507313	FH	On-Demand	Anodyne	CPT1A	101	39
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507313	FH	On-Demand	Anodyne	CPT2	41	37
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507313	FH	On-Demand	Anodyne	MT-CYB	40	30
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	EPOR	0	43
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	MME	19	44
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	PTGER3	52	35
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	CTSB	15	41
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	CTSL	0	40
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	CAPN1	21	41
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	CAPN2	32	41
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	ACE2	20	44
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	AMP1_PLAFQ	41	38
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	FFAR1	31	45
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	CRTM	52	36
CSCC[C@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507316	FG	On-Demand	Anodyne	PDS	81	41
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	EPOR	0	43
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	MME	19	44
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	PTGER3	52	35
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	CTSB	15	41
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	CTSL	0	40
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	CAPN1	21	41
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	CAPN2	32	41
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	ACE2	20	44
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	AMP1_PLAFQ	41	38
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	FFAR1	31	45
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	CRTM	52	36
CSCC[C@@H](O)C(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450507317	FG	On-Demand	Anodyne	PDS	81	41
Cc1nn(C)cc1CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507318	DE	On-Demand	Anodyne	CPT1A	48	36
Cc1nn(C)cc1CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507319	DE	On-Demand	Anodyne	CPT1A	48	36
COc1ccc(-c2ccnc(NCC3(OCCO)CCOCC3)n2)cc1	ZINC000450507320	FE	On-Demand	Anodyne	CLK4	20	48
COc1ccc(-c2ccnc(NCC3(OCCO)CCOCC3)n2)cc1	ZINC000450507320	FE	On-Demand	Anodyne	SMG1	45	32
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	THRA	34	46
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	MME	15	43
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	THRB	28	46
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	AGTR2	40	37
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	TRPV1	25	42
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	CAPN2	53	38
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	POL	0	40
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	AMP1_PLAFQ	53	39
COc1cc(CNC(=O)[C@@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507329	GG	On-Demand	Anodyne	PDS	46	35
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	THRA	34	46
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	MME	15	43
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	THRB	28	46
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	AGTR2	40	37
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	TRPV1	25	42
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	CAPN2	53	38
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	POL	0	40
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	AMP1_PLAFQ	53	39
COc1cc(CNC(=O)[C@H](C)O)cc(Br)c1OCc1ccccc1	ZINC000450507330	GG	On-Demand	Anodyne	PDS	46	35
COC(=O)[C@]1(C)CN(c2nccc(-c3ccc(OC)cc3)n2)C[C@H]1C	ZINC000450507343	EF	On-Demand	Anodyne	DKK1	0	40
Fc1ccc2c(c1)CCN2C1CCN(c2ncc(C(F)F)cn2)CC1	ZINC000450507350	EH	On-Demand	Anodyne	SCD1	35	46
Fc1ccc2c(c1)CCN2C1CCN(c2ncc(C(F)F)cn2)CC1	ZINC000450507350	EH	On-Demand	Anodyne	SCD	33	52
COc1cccc([C@@H]2C[C@H]2C(=O)NCCc2cc(F)c(F)c(F)c2)c1	ZINC000450507360	EH	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@@H]2C[C@H]2C(=O)NCCc2cc(F)c(F)c(F)c2)c1	ZINC000450507360	EH	On-Demand	Anodyne	MTNR1A	79	41
COc1cccc([C@@H]2C[C@H]2C(=O)NCCc2cc(F)c(F)c(F)c2)c1	ZINC000450507360	EH	On-Demand	Anodyne	MTNR1B	69	39
Cc1cc(C)c(C(=O)N2CC[C@H]([C@@H](C)O)C2)cc1Br	ZINC000450507361	EF	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C)c(C(=O)N2CC[C@@H]([C@H](C)O)C2)cc1Br	ZINC000450507362	EF	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C)c(C(=O)N2CC[C@H]([C@H](C)O)C2)cc1Br	ZINC000450507363	EF	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C)c(C(=O)N2CC[C@@H]([C@@H](C)O)C2)cc1Br	ZINC000450507364	EF	On-Demand	Anodyne	L3MBTL1	0	43
O=C([C@H]1CCN(c2ccccc2)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507365	FG	On-Demand	Anodyne	SIGMAR1	15	44
O=C([C@H]1CCN(c2ccccc2)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507365	FG	On-Demand	Anodyne	COLA	47	39
O=C([C@H]1CCN(c2ccccc2)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507365	FG	On-Demand	Anodyne	CPT1A	43	39
O=C([C@H]1CCN(c2ccccc2)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507365	FG	On-Demand	Anodyne	CPT2	43	39
O=C([C@H]1CCN(c2ccccc2)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507366	FG	On-Demand	Anodyne	SIGMAR1	15	44
O=C([C@H]1CCN(c2ccccc2)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507366	FG	On-Demand	Anodyne	COLA	47	39
O=C([C@H]1CCN(c2ccccc2)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507366	FG	On-Demand	Anodyne	CPT1A	43	39
O=C([C@H]1CCN(c2ccccc2)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507366	FG	On-Demand	Anodyne	CPT2	43	39
O=C([C@@H]1CCN(c2ccccc2)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507367	FG	On-Demand	Anodyne	SIGMAR1	15	44
O=C([C@@H]1CCN(c2ccccc2)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507367	FG	On-Demand	Anodyne	COLA	47	39
O=C([C@@H]1CCN(c2ccccc2)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507367	FG	On-Demand	Anodyne	CPT1A	43	39
O=C([C@@H]1CCN(c2ccccc2)C1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507367	FG	On-Demand	Anodyne	CPT2	43	39
O=C([C@@H]1CCN(c2ccccc2)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507368	FG	On-Demand	Anodyne	SIGMAR1	15	44
O=C([C@@H]1CCN(c2ccccc2)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507368	FG	On-Demand	Anodyne	COLA	47	39
O=C([C@@H]1CCN(c2ccccc2)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507368	FG	On-Demand	Anodyne	CPT1A	43	39
O=C([C@@H]1CCN(c2ccccc2)C1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507368	FG	On-Demand	Anodyne	CPT2	43	39
Cc1cc(C)c2oc(N3CCC[C@@H](S(C)(=O)=O)CC3)nc2c1	ZINC000450507377	DF	On-Demand	Anodyne	PTGES	24	40
Cc1cc(C)c2oc(N3CCC[C@H](S(C)(=O)=O)CC3)nc2c1	ZINC000450507378	DF	On-Demand	Anodyne	PTGES	24	40
Cc1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)nn1C(C)C	ZINC000450507381	EG	On-Demand	Anodyne	GRIN2B	29	42
Cc1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)nn1C(C)C	ZINC000450507381	EG	On-Demand	Anodyne	COLA	84	35
Cc1cc(C(=O)N2CC[C@H](COc3ccccc3)C2)nn1C(C)C	ZINC000450507381	EG	On-Demand	Anodyne	CPT1A	49	33
Cc1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)nn1C(C)C	ZINC000450507382	EG	On-Demand	Anodyne	GRIN2B	29	42
Cc1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)nn1C(C)C	ZINC000450507382	EG	On-Demand	Anodyne	COLA	84	35
Cc1cc(C(=O)N2CC[C@@H](COc3ccccc3)C2)nn1C(C)C	ZINC000450507382	EG	On-Demand	Anodyne	CPT1A	49	33
COCCO[C@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450507383	FH	On-Demand	Anodyne	PDE3B	45	30
COCCO[C@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450507383	FH	On-Demand	Anodyne	LIPG	62	49
COCCO[C@@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450507384	FH	On-Demand	Anodyne	PDE3B	45	30
COCCO[C@@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450507384	FH	On-Demand	Anodyne	LIPG	62	49
Cc1nc(NCC(=O)N[C@@H]2CCOc3ccccc32)ncc1[N+](=O)[O-]	ZINC000450507393	ED	On-Demand	Bother	LUXR	60	39
Cc1nc(NCC(=O)N[C@@H]2CCOc3ccccc32)ncc1[N+](=O)[O-]	ZINC000450507393	ED	On-Demand	Bother	TRAR	69	39
Cc1nc(NCC(=O)N[C@@H]2CCOc3ccccc32)ncc1[N+](=O)[O-]	ZINC000450507393	ED	On-Demand	Bother	LASR	47	39
Cc1nc(NCC(=O)N[C@H]2CCOc3ccccc32)ncc1[N+](=O)[O-]	ZINC000450507394	ED	On-Demand	Bother	LUXR	60	39
Cc1nc(NCC(=O)N[C@H]2CCOc3ccccc32)ncc1[N+](=O)[O-]	ZINC000450507394	ED	On-Demand	Bother	TRAR	69	39
Cc1nc(NCC(=O)N[C@H]2CCOc3ccccc32)ncc1[N+](=O)[O-]	ZINC000450507394	ED	On-Demand	Bother	LASR	47	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H]([C@H](C)O)C1	ZINC000450507403	DD	On-Demand	Anodyne	RIR1_HHV11	46	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H]([C@@H](C)O)C1	ZINC000450507404	DD	On-Demand	Anodyne	RIR1_HHV11	46	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H]([C@H](C)O)C1	ZINC000450507405	DD	On-Demand	Anodyne	RIR1_HHV11	46	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H]([C@@H](C)O)C1	ZINC000450507406	DD	On-Demand	Anodyne	RIR1_HHV11	46	34
CS(=O)(=O)[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450507415	FE	On-Demand	Anodyne	PDE3A	52	39
CS(=O)(=O)[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450507415	FE	On-Demand	Anodyne	PDE3B	77	39
CS(=O)(=O)[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450507416	FE	On-Demand	Anodyne	PDE3A	52	39
CS(=O)(=O)[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450507416	FE	On-Demand	Anodyne	PDE3B	77	39
Cc1ccc(C(=O)O)cc1NC(=O)CS(=O)(=O)N(C)C	ZINC000450507433	DC	On-Demand	Anodyne	NEU3	0	41
NC(=O)c1ncn(C2CCN(c3ncnc4[nH]c5ccccc5c34)CC2)c1N	ZINC000450507444	GD	On-Demand	Anodyne	SIRT3	46	30
COc1cc2c(c(OC)c1OC)CCN(Cc1cccnc1N)CC2	ZINC000450507448	EE	On-Demand	Anodyne	SLC9A1	44	32
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccccc3O)CC2)nc1	ZINC000450507451	GF	On-Demand	Anodyne	SSTR5	51	40
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507456	CF	On-Demand	Anodyne	ITGA4	42	32
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507457	CF	On-Demand	Anodyne	ITGA4	42	32
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cccn2C)c(OC)c1	ZINC000450507467	FF	On-Demand	Anodyne	HTR7	27	43
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cccn2C)c(OC)c1	ZINC000450507468	FF	On-Demand	Anodyne	HTR7	27	43
COc1ccc(CC(=O)NCCc2cc(F)c(F)c(F)c2)c(Cl)c1OC	ZINC000450507469	GH	On-Demand	Anodyne	P2RX7	40	38
COc1ccc(CC(=O)NCCc2cc(F)c(F)c(F)c2)c(Cl)c1OC	ZINC000450507469	GH	On-Demand	Anodyne	MTNR1A	48	39
COc1ccc(CC(=O)NCCc2cc(F)c(F)c(F)c2)c(Cl)c1OC	ZINC000450507469	GH	On-Demand	Anodyne	NCE103	21	48
COc1ccc(CC(=O)NCCc2cc(F)c(F)c(F)c2)c(Cl)c1OC	ZINC000450507469	GH	On-Demand	Anodyne	P96878_MYCTU	18	48
COC(=O)C1(NC(=O)c2cc3ccc(Br)cc3s2)CC1	ZINC000450507470	FG	On-Demand	Anodyne	TACR2	42	34
O=C(NCCCOCCOCc1ccccc1)c1cc2n(n1)CCCC2	ZINC000450507487	FF	On-Demand	Anodyne	ALPHA-1A	0	42
CC(C)N1CCN(C(=O)c2cccc3c2O[C@H](C)C3)CC1=O	ZINC000450507492	DD	On-Demand	Anodyne	P2RX7	0	57
CC(C)N1CCN(C(=O)c2cccc3c2O[C@@H](C)C3)CC1=O	ZINC000450507493	DD	On-Demand	Anodyne	P2RX7	0	57
O=C(C1CC1)C1(C(=O)N2CC[C@H](COc3ccccc3)C2)CC1	ZINC000450507499	DF	On-Demand	Anodyne	SIGMAR1	15	45
O=C(C1CC1)C1(C(=O)N2CC[C@@H](COc3ccccc3)C2)CC1	ZINC000450507500	DF	On-Demand	Anodyne	SIGMAR1	15	45
CO[C@@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507503	EG	On-Demand	Anodyne	MME	62	40
CO[C@@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507503	EG	On-Demand	Anodyne	ANPEP	33	40
CO[C@@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507503	EG	On-Demand	Anodyne	PAPA1_CARPA	43	36
CO[C@@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507503	EG	On-Demand	Anodyne	ACE2	40	33
CO[C@@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507503	EG	On-Demand	Anodyne	AMP1_PLAFQ	57	47
CO[C@@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507503	EG	On-Demand	Anodyne	HDA106	0	42
CO[C@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507504	EG	On-Demand	Anodyne	MME	62	40
CO[C@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507504	EG	On-Demand	Anodyne	ANPEP	33	40
CO[C@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507504	EG	On-Demand	Anodyne	PAPA1_CARPA	43	36
CO[C@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507504	EG	On-Demand	Anodyne	ACE2	40	33
CO[C@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507504	EG	On-Demand	Anodyne	AMP1_PLAFQ	57	47
CO[C@H](Cc1ccccc1)C(=O)NCCc1cc(F)c(F)c(F)c1	ZINC000450507504	EG	On-Demand	Anodyne	HDA106	0	42
COCCO[C@H]1CCCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450507506	EE	On-Demand	Anodyne	COLA	30	44
COCCO[C@H]1CCCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450507506	EE	On-Demand	Anodyne	CPT1A	21	40
COCCO[C@@H]1CCCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450507507	EE	On-Demand	Anodyne	COLA	30	44
COCCO[C@@H]1CCCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450507507	EE	On-Demand	Anodyne	CPT1A	21	40
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450507508	FF	On-Demand	Anodyne	RBP4	68	40
C[C@@H]1C[C@@H]1c1nnc2ccc(=NCCCc3c[nH]c4ccc(F)cc34)[nH]n12	ZINC000450507509	FG	On-Demand	Anodyne	SLC6A4	26	43
C[C@@H]1C[C@@H]1c1nnc2ccc(=NCCCc3c[nH]c4ccc(F)cc34)[nH]n12	ZINC000450507509	FG	On-Demand	Anodyne	MPO	83	42
C[C@@H]1C[C@H]1c1nnc2ccc(=NCCCc3c[nH]c4ccc(F)cc34)[nH]n12	ZINC000450507510	FG	On-Demand	Anodyne	SLC6A4	26	43
C[C@@H]1C[C@H]1c1nnc2ccc(=NCCCc3c[nH]c4ccc(F)cc34)[nH]n12	ZINC000450507510	FG	On-Demand	Anodyne	MPO	83	42
C[C@H]1C[C@H]1c1nnc2ccc(=NCCCc3c[nH]c4ccc(F)cc34)[nH]n12	ZINC000450507511	FG	On-Demand	Anodyne	SLC6A4	26	43
C[C@H]1C[C@H]1c1nnc2ccc(=NCCCc3c[nH]c4ccc(F)cc34)[nH]n12	ZINC000450507511	FG	On-Demand	Anodyne	MPO	83	42
C[C@H]1C[C@@H]1c1nnc2ccc(=NCCCc3c[nH]c4ccc(F)cc34)[nH]n12	ZINC000450507512	FG	On-Demand	Anodyne	SLC6A4	26	43
C[C@H]1C[C@@H]1c1nnc2ccc(=NCCCc3c[nH]c4ccc(F)cc34)[nH]n12	ZINC000450507512	FG	On-Demand	Anodyne	MPO	83	42
Cc1nc(N[C@@H]2CCC[C@@H]2CNS(C)(=O)=O)ncc1[N+](=O)[O-]	ZINC000450507513	EC	On-Demand	Bother	PRKCQ	46	36
Cc1nc(N[C@H]2CCC[C@H]2CNS(C)(=O)=O)ncc1[N+](=O)[O-]	ZINC000450507514	EC	On-Demand	Bother	PRKCQ	46	36
Cc1nc(N[C@@H]2CCC[C@H]2CNS(C)(=O)=O)ncc1[N+](=O)[O-]	ZINC000450507515	EC	On-Demand	Bother	PRKCQ	46	36
Cc1nc(N[C@H]2CCC[C@@H]2CNS(C)(=O)=O)ncc1[N+](=O)[O-]	ZINC000450507516	EC	On-Demand	Bother	PRKCQ	46	36
COCC[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccco1	ZINC000450507522	EG	On-Demand	Anodyne	GPR88	0	43
COC(=O)c1csc(CN2CCc3cc(OC)c(OC)c(OC)c3CC2)n1	ZINC000450507528	GF	On-Demand	Anodyne	ABCB1B	47	32
C[C@H]1C[C@H]1c1nnc2ccc(N3CCC(N4CCc5cc(F)ccc54)CC3)nn12	ZINC000450507529	GG	On-Demand	Anodyne	SCD1	34	47
C[C@H]1C[C@H]1c1nnc2ccc(N3CCC(N4CCc5cc(F)ccc54)CC3)nn12	ZINC000450507529	GG	On-Demand	Anodyne	SCD	33	54
C[C@@H]1C[C@@H]1c1nnc2ccc(N3CCC(N4CCc5cc(F)ccc54)CC3)nn12	ZINC000450507530	GG	On-Demand	Anodyne	SCD1	34	47
C[C@@H]1C[C@@H]1c1nnc2ccc(N3CCC(N4CCc5cc(F)ccc54)CC3)nn12	ZINC000450507530	GG	On-Demand	Anodyne	SCD	33	54
C[C@H]1C[C@@H]1c1nnc2ccc(N3CCC(N4CCc5cc(F)ccc54)CC3)nn12	ZINC000450507531	GG	On-Demand	Anodyne	SCD1	34	47
C[C@H]1C[C@@H]1c1nnc2ccc(N3CCC(N4CCc5cc(F)ccc54)CC3)nn12	ZINC000450507531	GG	On-Demand	Anodyne	SCD	33	54
C[C@@H]1C[C@H]1c1nnc2ccc(N3CCC(N4CCc5cc(F)ccc54)CC3)nn12	ZINC000450507532	GG	On-Demand	Anodyne	SCD1	34	47
C[C@@H]1C[C@H]1c1nnc2ccc(N3CCC(N4CCc5cc(F)ccc54)CC3)nn12	ZINC000450507532	GG	On-Demand	Anodyne	SCD	33	54
COC(=O)c1csc(CN[C@@H](CCCc2ccccc2)c2ccccc2)n1	ZINC000450507542	GJ	On-Demand	Anodyne	FAAH	16	43
COC(=O)c1csc(CN[C@H](CCCc2ccccc2)c2ccccc2)n1	ZINC000450507543	GJ	On-Demand	Anodyne	FAAH	16	43
C[C@@H](Nc1ncnc2cc(Br)ccc12)C(=O)NCCF	ZINC000450507556	EE	On-Demand	Anodyne	EGFR	48	36
C[C@H](Nc1ncnc2cc(Br)ccc12)C(=O)NCCF	ZINC000450507557	EE	On-Demand	Anodyne	EGFR	48	36
CC1(C(=O)Nc2ccc(C(=O)NCCC(=O)O)cc2)CC1	ZINC000450507578	CD	On-Demand	Anodyne	GCGR	79	45
CC1(C(=O)Nc2ccc(C(=O)NCCC(=O)O)cc2)CC1	ZINC000450507578	CD	On-Demand	Anodyne	GIPR	74	36
CSCC[C@H](O)C(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450507579	GF	On-Demand	Anodyne	OPRK1	18	40
CSCC[C@H](O)C(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450507579	GF	On-Demand	Anodyne	SIGMAR1	22	54
CSCC[C@H](O)C(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450507579	GF	On-Demand	Anodyne	KCNJ1	57	35
CSCC[C@@H](O)C(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450507580	GF	On-Demand	Anodyne	OPRK1	18	40
CSCC[C@@H](O)C(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450507580	GF	On-Demand	Anodyne	SIGMAR1	22	54
CSCC[C@@H](O)C(=O)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450507580	GF	On-Demand	Anodyne	KCNJ1	57	35
CCSc1cccnc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507610	EH	On-Demand	Anodyne	GRIN2B	34	42
CCSc1cccnc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507611	EH	On-Demand	Anodyne	GRIN2B	34	42
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	HTR1A	65	55
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	ADRA2A	17	42
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	DRD2	65	50
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	DRD1	42	40
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	DRD4	44	50
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	ACHE	24	46
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	HTR2A	35	48
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	HTR2C	21	48
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	HRH1	15	40
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	ADRA1B	26	40
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	DRD3	72	45
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	CHRM5	15	40
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	ADRA2B	15	40
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	ADRA2C	16	42
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	HTR7	58	55
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	SIGMAR1	35	44
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	BCHE	17	41
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	HTR5A	26	48
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	SLC18A3	24	41
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	ABCB1B	63	39
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	MTNR1B	28	41
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	SLC9A1	52	34
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	EBP	27	44
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	ABCB1	36	40
COc1cc2c(c(OC)c1OC)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450507612	GH	On-Demand	Anodyne	CYP2J2	57	41
COc1ccc(-c2noc(N(C)CC(=O)N(C)[C@@H](C)c3ccccc3)n2)cc1	ZINC000450507613	GG	On-Demand	Anodyne	LUCI_PHOPE	35	41
COc1ccc(-c2noc(N(C)CC(=O)N(C)[C@H](C)c3ccccc3)n2)cc1	ZINC000450507614	GG	On-Demand	Anodyne	LUCI_PHOPE	35	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2Cl)c(OC)c1	ZINC000450507621	GH	On-Demand	Anodyne	PTGS2	23	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2Cl)c(OC)c1	ZINC000450507621	GH	On-Demand	Anodyne	P2RX7	39	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2Cl)c(OC)c1	ZINC000450507621	GH	On-Demand	Anodyne	MTNR1A	73	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2Cl)c(OC)c1	ZINC000450507621	GH	On-Demand	Anodyne	MTNR1B	66	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2Cl)c(OC)c1	ZINC000450507622	GH	On-Demand	Anodyne	PTGS2	23	42
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2Cl)c(OC)c1	ZINC000450507622	GH	On-Demand	Anodyne	P2RX7	39	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2Cl)c(OC)c1	ZINC000450507622	GH	On-Demand	Anodyne	MTNR1A	73	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2Cl)c(OC)c1	ZINC000450507622	GH	On-Demand	Anodyne	MTNR1B	66	40
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507623	EH	On-Demand	Anodyne	GRIN2B	23	41
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507624	EH	On-Demand	Anodyne	GRIN2B	23	41
COc1ccc(-c2ccnc(N3CCC[C@H](S(C)(=O)=O)CC3)n2)cc1	ZINC000450507626	FF	On-Demand	Anodyne	DKK1	0	47
COc1ccc(-c2ccnc(N3CCC[C@@H](S(C)(=O)=O)CC3)n2)cc1	ZINC000450507627	FF	On-Demand	Anodyne	DKK1	0	47
COc1ccc(C(=O)N[C@H](C)CC(=O)O)c(OC2CCCC2)c1	ZINC000450507634	DF	On-Demand	Anodyne	ADRB3	22	41
COc1ccc(C(=O)N[C@@H](C)CC(=O)O)c(OC2CCCC2)c1	ZINC000450507635	DF	On-Demand	Anodyne	ADRB3	22	41
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	SIGMAR1	22	43
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	MMP13	22	42
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	CCR3	37	40
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	CCR5	24	45
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	COLA	50	43
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	CPT1A	49	43
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	ITGA4	57	42
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	MMP7	23	42
COC(=O)c1ccc(CC(=O)N2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450507638	FF	On-Demand	Anodyne	GPR183	0	41
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	SIGMAR1	22	43
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	MMP13	22	42
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	CCR3	37	40
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	CCR5	24	45
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	COLA	50	43
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	CPT1A	49	43
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	ITGA4	57	42
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	MMP7	23	42
COC(=O)c1ccc(CC(=O)N2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450507639	FF	On-Demand	Anodyne	GPR183	0	41
COC(=O)C1(NC(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450507652	CD	On-Demand	Anodyne	NCE103	29	46
COC(=O)C1(NC(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450507652	CD	On-Demand	Anodyne	P96878_MYCTU	18	46
COC(=O)C1(NC(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450507652	CD	On-Demand	Anodyne	CAN2	0	46
N#Cc1cnc(NCC2CCC(F)(F)CC2)c([N+](=O)[O-])c1	ZINC000450507672	CG	On-Demand	Mild	PRKCQ	51	39
COC(=O)C1(NC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450507686	CD	On-Demand	Anodyne	TACR3	19	40
COC(=O)C1(NC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450507686	CD	On-Demand	Anodyne	CTSV	42	29
CNC(=O)[C@@H]1CN(CCC2=CCCCC2)c2ccccc2O1	ZINC000450507692	DF	On-Demand	Anodyne	CYSLTR2	44	35
CNC(=O)[C@H]1CN(CCC2=CCCCC2)c2ccccc2O1	ZINC000450507693	DF	On-Demand	Anodyne	CYSLTR2	44	35
COCC[C@H](NC(=O)c1cnn2ccc(C)cc12)c1ccco1	ZINC000450507695	DF	On-Demand	Anodyne	EPHB3	34	47
COCC[C@@H](NC(=O)c1cnn2ccc(C)cc12)c1ccco1	ZINC000450507696	DF	On-Demand	Anodyne	EPHB3	34	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507711	EG	On-Demand	Anodyne	MC4R	45	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507711	EG	On-Demand	Anodyne	FDFT1	40	35
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507711	EG	On-Demand	Anodyne	PRCP	58	44
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507711	EG	On-Demand	Anodyne	MC3R	53	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507711	EG	On-Demand	Anodyne	MC5R	39	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507712	EG	On-Demand	Anodyne	MC4R	45	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507712	EG	On-Demand	Anodyne	FDFT1	40	35
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507712	EG	On-Demand	Anodyne	PRCP	58	44
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507712	EG	On-Demand	Anodyne	MC3R	53	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450507712	EG	On-Demand	Anodyne	MC5R	39	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507713	EG	On-Demand	Anodyne	MC4R	45	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507713	EG	On-Demand	Anodyne	FDFT1	40	35
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507713	EG	On-Demand	Anodyne	PRCP	58	44
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507713	EG	On-Demand	Anodyne	MC3R	53	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507713	EG	On-Demand	Anodyne	MC5R	39	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507714	EG	On-Demand	Anodyne	MC4R	45	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507714	EG	On-Demand	Anodyne	FDFT1	40	35
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507714	EG	On-Demand	Anodyne	PRCP	58	44
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507714	EG	On-Demand	Anodyne	MC3R	53	47
C[C@H](O)[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450507714	EG	On-Demand	Anodyne	MC5R	39	47
CCOC(=O)c1csc(N2CCC(N3CCc4cc(F)ccc43)CC2)n1	ZINC000450507717	GG	On-Demand	Anodyne	SCD1	31	45
CCOC(=O)c1csc(N2CCC(N3CCc4cc(F)ccc43)CC2)n1	ZINC000450507717	GG	On-Demand	Anodyne	SCD	26	44
COc1ccc(-c2noc(=N[C@H](C)C(=O)NCCF)[nH]2)cc1	ZINC000450507744	DD	On-Demand	Anodyne	TBK1	44	36
COc1ccc(-c2noc(=N[C@@H](C)C(=O)NCCF)[nH]2)cc1	ZINC000450507745	DD	On-Demand	Anodyne	TBK1	44	36
COCC[C@@H](NC(=O)[C@]1(C#N)CC12CCCC2)c1ccco1	ZINC000450507746	DF	On-Demand	Mild	NPPA	44	35
COCC[C@@H](NC(=O)[C@@]1(C#N)CC12CCCC2)c1ccco1	ZINC000450507747	DF	On-Demand	Mild	NPPA	44	35
COCC[C@H](NC(=O)[C@@]1(C#N)CC12CCCC2)c1ccco1	ZINC000450507748	DF	On-Demand	Mild	NPPA	44	35
COCC[C@H](NC(=O)[C@]1(C#N)CC12CCCC2)c1ccco1	ZINC000450507749	DF	On-Demand	Mild	NPPA	44	35
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507750	EI	On-Demand	Anodyne	GRIN2B	24	42
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507750	EI	On-Demand	Anodyne	CHEK2	18	40
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507750	EI	On-Demand	Anodyne	CCR5	31	40
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507750	EI	On-Demand	Anodyne	CPT2	41	38
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507750	EI	On-Demand	Anodyne	EPHX2	15	41
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507751	EI	On-Demand	Anodyne	GRIN2B	24	42
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507751	EI	On-Demand	Anodyne	CHEK2	18	40
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507751	EI	On-Demand	Anodyne	CCR5	31	40
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507751	EI	On-Demand	Anodyne	CPT2	41	38
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507751	EI	On-Demand	Anodyne	EPHX2	15	41
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507752	EI	On-Demand	Anodyne	GRIN2B	24	42
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507752	EI	On-Demand	Anodyne	CHEK2	18	40
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507752	EI	On-Demand	Anodyne	CCR5	31	40
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507752	EI	On-Demand	Anodyne	CPT2	41	38
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507752	EI	On-Demand	Anodyne	EPHX2	15	41
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507753	EI	On-Demand	Anodyne	GRIN2B	24	42
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507753	EI	On-Demand	Anodyne	CHEK2	18	40
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507753	EI	On-Demand	Anodyne	CCR5	31	40
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507753	EI	On-Demand	Anodyne	CPT2	41	38
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507753	EI	On-Demand	Anodyne	EPHX2	15	41
CN(CCN1CCC(C(=O)Nc2ccccc2O)CC1)Cc1ccccc1	ZINC000450507754	FG	On-Demand	Anodyne	ACHE	24	45
CN(CCN1CCC(C(=O)Nc2ccccc2O)CC1)Cc1ccccc1	ZINC000450507754	FG	On-Demand	Anodyne	SIGMAR1	47	44
CN(CCN1CCC(C(=O)Nc2ccccc2O)CC1)Cc1ccccc1	ZINC000450507754	FG	On-Demand	Anodyne	CACNA1G	39	41
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450507762	GI	On-Demand	Anodyne	GRIN2B	22	41
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450507762	GI	On-Demand	Anodyne	ITGA4	43	35
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450507762	GI	On-Demand	Anodyne	ACKR3	51	33
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450507763	GI	On-Demand	Anodyne	GRIN2B	22	41
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450507763	GI	On-Demand	Anodyne	ITGA4	43	35
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450507763	GI	On-Demand	Anodyne	ACKR3	51	33
CCOC(=O)c1csc(NCC(=O)N[C@@H]2CCOc3ccccc32)n1	ZINC000450507765	FD	On-Demand	Anodyne	LUXR	43	34
CCOC(=O)c1csc(NCC(=O)N[C@@H]2CCOc3ccccc32)n1	ZINC000450507765	FD	On-Demand	Anodyne	TRAR	55	32
CCOC(=O)c1csc(NCC(=O)N[C@@H]2CCOc3ccccc32)n1	ZINC000450507765	FD	On-Demand	Anodyne	LASR	42	32
CCOC(=O)c1csc(NCC(=O)N[C@H]2CCOc3ccccc32)n1	ZINC000450507766	FD	On-Demand	Anodyne	LUXR	43	34
CCOC(=O)c1csc(NCC(=O)N[C@H]2CCOc3ccccc32)n1	ZINC000450507766	FD	On-Demand	Anodyne	TRAR	55	32
CCOC(=O)c1csc(NCC(=O)N[C@H]2CCOc3ccccc32)n1	ZINC000450507766	FD	On-Demand	Anodyne	LASR	42	32
Fc1ccc2[nH]cc(CCCNc3ncc(C(F)F)cn3)c2c1	ZINC000450507771	DH	On-Demand	Anodyne	HTR1A	39	51
Fc1ccc2[nH]cc(CCCNc3ncc(C(F)F)cn3)c2c1	ZINC000450507771	DH	On-Demand	Anodyne	HTR1D	51	37
Fc1ccc2[nH]cc(CCCNc3ncc(C(F)F)cn3)c2c1	ZINC000450507771	DH	On-Demand	Anodyne	HTR1B	42	38
Fc1ccc2[nH]cc(CCCNc3ncc(C(F)F)cn3)c2c1	ZINC000450507771	DH	On-Demand	Anodyne	SLC6A4	30	65
Fc1ccc2[nH]cc(CCCNc3ncc(C(F)F)cn3)c2c1	ZINC000450507771	DH	On-Demand	Anodyne	MPO	122	65
Cc1ccc(C(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)c(Cl)c1Cl	ZINC000450507789	EG	On-Demand	Anodyne	INHA	24	42
Cc1ccc(C(=O)NC[C@H]2CC(=O)N(C3CC3)C2)c(Cl)c1Cl	ZINC000450507790	EG	On-Demand	Anodyne	INHA	24	42
O=C(Cc1ccccc1O[C@H]1CCOC1)NCCc1cc(F)c(F)c(F)c1	ZINC000450507791	GG	On-Demand	Anodyne	PDEC	0	42
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCCc1cc(F)c(F)c(F)c1	ZINC000450507792	GG	On-Demand	Anodyne	PDEC	0	42
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507796	DF	On-Demand	Mild	CHEK2	22	40
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507797	DF	On-Demand	Mild	CHEK2	22	40
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507800	GH	On-Demand	Anodyne	GRIN2B	42	40
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507800	GH	On-Demand	Anodyne	SIGMAR1	19	41
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507801	GH	On-Demand	Anodyne	GRIN2B	42	40
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507801	GH	On-Demand	Anodyne	SIGMAR1	19	41
COCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccco1	ZINC000450507804	DF	On-Demand	Anodyne	CAN2	0	40
COCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccco1	ZINC000450507805	DF	On-Demand	Anodyne	CAN2	0	40
Cc1ccn2ncc(C(=O)NCCCOCCOCc3ccccc3)c2c1	ZINC000450507809	FF	On-Demand	Anodyne	EPHB3	35	49
Cc1ccn2ncc(C(=O)NCCCOCCOCc3ccccc3)c2c1	ZINC000450507809	FF	On-Demand	Anodyne	ALPHA-1A	0	52
CC(C)c1n[nH]c(=NCCCc2c[nH]c3ccc(F)cc23)o1	ZINC000450507815	DG	On-Demand	Anodyne	HTR1A	15	40
CC(C)c1n[nH]c(=NCCCc2c[nH]c3ccc(F)cc23)o1	ZINC000450507815	DG	On-Demand	Anodyne	SLC6A4	20	48
CC(C)c1n[nH]c(=NCCCc2c[nH]c3ccc(F)cc23)o1	ZINC000450507815	DG	On-Demand	Anodyne	MPO	95	48
O=C(NCCCOCCOCc1ccccc1)c1cc2c([nH]1)CCCC2	ZINC000450507816	FG	On-Demand	Anodyne	ALPHA-1A	0	40
CCc1cccc(C(=O)NCCc2cc(F)c(F)c(F)c2)n1	ZINC000450507823	DG	On-Demand	Anodyne	PDE5A	17	41
CSc1cccc(C(=O)NC[C@H]2CC(=O)N(C3CC3)C2)c1	ZINC000450507824	DE	On-Demand	Anodyne	CACNA1I	42	33
CSc1cccc(C(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)c1	ZINC000450507825	DE	On-Demand	Anodyne	CACNA1I	42	33
Cn1c(C#N)ccc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450507828	DE	On-Demand	Mild	CHRNA10	43	40
Cn1c(C#N)ccc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507829	DE	On-Demand	Mild	CHRNA10	43	40
CC(C)N1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1=O	ZINC000450507836	GD	On-Demand	Mild	HTR1B	17	42
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	DRD2	16	40
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	DRD4	20	43
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	ACHE	21	42
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	DRD3	0	40
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	ABCB1B	53	36
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	SLC9A1	45	31
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	ABCB1	23	46
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	NOD1	29	41
COc1cc2c(c(OC)c1OC)CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450507841	FH	On-Demand	Anodyne	NOD2	44	41
O=C1CC[C@H](CN[C@H](Cc2ccccc2)c2ccccc2)CCN1	ZINC000450507847	DG	On-Demand	Anodyne	SCN9A	0	41
O=C1CC[C@H](CN[C@H](Cc2ccccc2)c2ccccc2)CCN1	ZINC000450507847	DG	On-Demand	Anodyne	MAN1B1	52	36
O=C1CC[C@H](CN[C@@H](Cc2ccccc2)c2ccccc2)CCN1	ZINC000450507848	DG	On-Demand	Anodyne	SCN9A	0	41
O=C1CC[C@H](CN[C@@H](Cc2ccccc2)c2ccccc2)CCN1	ZINC000450507848	DG	On-Demand	Anodyne	MAN1B1	52	36
O=C1CC[C@@H](CN[C@@H](Cc2ccccc2)c2ccccc2)CCN1	ZINC000450507849	DG	On-Demand	Anodyne	SCN9A	0	41
O=C1CC[C@@H](CN[C@@H](Cc2ccccc2)c2ccccc2)CCN1	ZINC000450507849	DG	On-Demand	Anodyne	MAN1B1	52	36
O=C1CC[C@@H](CN[C@H](Cc2ccccc2)c2ccccc2)CCN1	ZINC000450507850	DG	On-Demand	Anodyne	SCN9A	0	41
O=C1CC[C@@H](CN[C@H](Cc2ccccc2)c2ccccc2)CCN1	ZINC000450507850	DG	On-Demand	Anodyne	MAN1B1	52	36
CCCOc1cccc(CC(=O)N(CCC(=O)O)Cc2cccc(F)c2F)c1	ZINC000450507860	GH	On-Demand	Anodyne	LTA4H	17	40
CCCOc1cccc(CC(=O)N(CCC(=O)O)Cc2cccc(F)c2F)c1	ZINC000450507860	GH	On-Demand	Anodyne	PLA2G4B	30	42
CCCOc1cccc(CC(=O)N(CCC(=O)O)Cc2cccc(F)c2F)c1	ZINC000450507860	GH	On-Demand	Anodyne	PDS	70	37
C[C@@H](O)[C@H]1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450507884	FF	On-Demand	Anodyne	HRH4	26	47
C[C@H](O)[C@@H]1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450507885	FF	On-Demand	Anodyne	HRH4	26	47
C[C@H](O)[C@H]1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450507886	FF	On-Demand	Anodyne	HRH4	26	47
C[C@@H](O)[C@@H]1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450507887	FF	On-Demand	Anodyne	HRH4	26	47
COc1cc(CC(=O)N2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450507906	CE	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450507906	CE	On-Demand	Anodyne	OPRK1	45	43
COc1cc(CC(=O)N2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450507906	CE	On-Demand	Anodyne	FDFT1	40	35
COc1cc(CC(=O)N2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450507906	CE	On-Demand	Anodyne	CCR1	30	41
COc1cc(CC(=O)N2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450507907	CE	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450507907	CE	On-Demand	Anodyne	OPRK1	45	43
COc1cc(CC(=O)N2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450507907	CE	On-Demand	Anodyne	FDFT1	40	35
COc1cc(CC(=O)N2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450507907	CE	On-Demand	Anodyne	CCR1	30	41
COc1cc(CC(=O)N2CC[C@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450507908	CE	On-Demand	Anodyne	FDFT1	40	35
COc1cc(CC(=O)N2CC[C@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450507908	CE	On-Demand	Anodyne	CCR1	30	41
COc1cc(CC(=O)N2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450507909	CE	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450507909	CE	On-Demand	Anodyne	OPRK1	45	43
COc1cc(CC(=O)N2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450507909	CE	On-Demand	Anodyne	FDFT1	40	35
COc1cc(CC(=O)N2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450507909	CE	On-Demand	Anodyne	CCR1	30	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507922	EH	On-Demand	Anodyne	GRIN2B	54	53
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450507922	EH	On-Demand	Anodyne	AKR1C3	17	40
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507923	EH	On-Demand	Anodyne	GRIN2B	54	53
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@H](COc2ccccc2)C1	ZINC000450507923	EH	On-Demand	Anodyne	AKR1C3	17	40
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450507930	EF	On-Demand	Anodyne	INHA	40	42
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450507931	EF	On-Demand	Anodyne	INHA	40	42
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450507932	EF	On-Demand	Anodyne	INHA	40	42
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450507933	EF	On-Demand	Anodyne	INHA	40	42
COCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ccco1	ZINC000450507940	EF	On-Demand	Anodyne	P2RY12	44	33
COCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ccco1	ZINC000450507941	EF	On-Demand	Anodyne	P2RY12	44	33
COCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ccco1	ZINC000450507942	EF	On-Demand	Anodyne	P2RY12	44	33
COCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ccco1	ZINC000450507943	EF	On-Demand	Anodyne	P2RY12	44	33
C=CCC1(C(=O)N[C@@H](CCOC)c2ccco2)CCCC1	ZINC000450507944	CH	On-Demand	Mild	NPPA	44	36
C=CCC1(C(=O)N[C@H](CCOC)c2ccco2)CCCC1	ZINC000450507945	CH	On-Demand	Mild	NPPA	44	36
Cc1nc2ccnn2cc1C(=O)NCCCOCCOCc1ccccc1	ZINC000450507946	FE	On-Demand	Anodyne	DDR1	52	39
O=C(NCCCOCCOCc1ccccc1)c1ccc2cnccc2c1	ZINC000450507964	FH	On-Demand	Anodyne	DRD3	19	42
O=C(NCCCOCCOCc1ccccc1)c1ccc2cnccc2c1	ZINC000450507964	FH	On-Demand	Anodyne	TBXAS1	18	40
O=C(NCCCOCCOCc1ccccc1)c1ccc2cnccc2c1	ZINC000450507964	FH	On-Demand	Anodyne	PTAFR	21	44
O=C(NCCCOCCOCc1ccccc1)c1ccc2cnccc2c1	ZINC000450507964	FH	On-Demand	Anodyne	AKT1	0	44
O=C(NCCCOCCOCc1ccccc1)c1ccc2cnccc2c1	ZINC000450507964	FH	On-Demand	Anodyne	NAMPT	27	48
O=C(NCCCOCCOCc1ccccc1)c1ccc2cnccc2c1	ZINC000450507964	FH	On-Demand	Anodyne	ALPHA-1A	0	42
c1ccc2sc(CN3CCN(Cc4nnc(C5CC5)s4)CC3)nc2c1	ZINC000450507965	FG	On-Demand	Anodyne	LTA4H	27	40
COc1cc(Cl)c(C(=O)N[C@@H](C(=O)O)C2CC2)cc1OC	ZINC000450508003	DD	On-Demand	Anodyne	HTR4	50	39
COc1cc(Cl)c(C(=O)N[C@@H](C(=O)O)C2CC2)cc1OC	ZINC000450508003	DD	On-Demand	Anodyne	NTSR2	47	44
COc1cc(Cl)c(C(=O)N[C@@H](C(=O)O)C2CC2)cc1OC	ZINC000450508003	DD	On-Demand	Anodyne	PYGL	0	41
COc1cc(Cl)c(C(=O)N[C@H](C(=O)O)C2CC2)cc1OC	ZINC000450508004	DD	On-Demand	Anodyne	HTR4	50	39
COc1cc(Cl)c(C(=O)N[C@H](C(=O)O)C2CC2)cc1OC	ZINC000450508004	DD	On-Demand	Anodyne	NTSR2	47	44
COc1cc(Cl)c(C(=O)N[C@H](C(=O)O)C2CC2)cc1OC	ZINC000450508004	DD	On-Demand	Anodyne	PYGL	0	41
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508013	DH	On-Demand	Anodyne	GRIN2B	22	40
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2c2cccn2C)cc1	ZINC000450508017	EG	On-Demand	Anodyne	HRH3	0	52
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2c2cccn2C)cc1	ZINC000450508018	EG	On-Demand	Anodyne	HRH3	0	52
C[C@@H](Nc1ncnc2[nH]c3ccccc3c12)C(=O)NCCF	ZINC000450508026	DD	On-Demand	Anodyne	UTS2R	27	40
C[C@H](Nc1ncnc2[nH]c3ccccc3c12)C(=O)NCCF	ZINC000450508027	DD	On-Demand	Anodyne	UTS2R	27	40
O=C(NCCCOCCOCc1ccccc1)c1cc2ccncc2s1	ZINC000450508028	FH	On-Demand	Anodyne	SELE	27	42
O=C(NCCCOCCOCc1ccccc1)c1cc2ccncc2s1	ZINC000450508028	FH	On-Demand	Anodyne	ICAM1	23	42
O=C(NCCCOCCOCc1ccccc1)c1cc2ccncc2s1	ZINC000450508028	FH	On-Demand	Anodyne	VCAM1	25	42
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	ADAM17	15	45
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	MTNR1A	52	44
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	MTNR1B	44	44
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	FAAH	16	40
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	FFAR1	35	45
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	NCE103	20	41
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	CRTM	63	47
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	CAN2	0	41
CNS(=O)(=O)NCC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000450508034	GC	On-Demand	Anodyne	PDS	50	37
COc1ccc(NC(=O)[C@H](O)CCSC)cc1Oc1ccc(C)nn1	ZINC000450508036	FF	On-Demand	Anodyne	ENPP1	58	33
COc1ccc(NC(=O)[C@@H](O)CCSC)cc1Oc1ccc(C)nn1	ZINC000450508037	FF	On-Demand	Anodyne	ENPP1	58	33
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)O)c1	ZINC000450508039	CC	On-Demand	Anodyne	AKR1C3	62	43
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)O)c1	ZINC000450508039	CC	On-Demand	Anodyne	PARP14	0	40
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)O)c1	ZINC000450508039	CC	On-Demand	Anodyne	PARP15	0	44
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)O)c1	ZINC000450508039	CC	On-Demand	Anodyne	KCNK3	80	38
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)O)c1	ZINC000450508039	CC	On-Demand	Anodyne	KCNK9	67	38
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)O)c1	ZINC000450508039	CC	On-Demand	Anodyne	PARP10	0	49
C[C@@H](O)[C@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450508040	DF	On-Demand	Anodyne	L3MBTL3	43	33
C[C@@H](O)[C@@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450508041	DF	On-Demand	Anodyne	L3MBTL3	43	33
C[C@H](O)[C@@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450508042	DF	On-Demand	Anodyne	L3MBTL3	43	33
C[C@H](O)[C@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450508043	DF	On-Demand	Anodyne	L3MBTL3	43	33
C[C@@H](O)CCN1CCN(Cc2nc3ccccc3s2)CC1	ZINC000450508046	DE	On-Demand	Anodyne	ACOX1	51	31
C[C@H](O)CCN1CCN(Cc2nc3ccccc3s2)CC1	ZINC000450508047	DE	On-Demand	Anodyne	ACOX1	51	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	GHRHR	75	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	P2RY12	82	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CTSB	15	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CTSK	32	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CTSL	18	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CACNA1B	53	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CCR1	34	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CCKBR	28	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CTSS	18	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CAPN1	43	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	CAPN2	55	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	FPR1	40	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	AMP1_PLAFQ	23	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	RHODESAIN	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508070	FG	On-Demand	Anodyne	Q9N6S8_PLAFA	23	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	GHRHR	75	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	P2RY12	82	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CTSB	15	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CTSK	32	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CTSL	18	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CACNA1B	53	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CCR1	34	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CCKBR	28	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CTSS	18	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CAPN1	43	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	CAPN2	55	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	FPR1	40	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	AMP1_PLAFQ	23	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	RHODESAIN	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508071	FG	On-Demand	Anodyne	Q9N6S8_PLAFA	23	42
CS(=O)(=O)[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508072	GF	On-Demand	Anodyne	PDE3A	46	36
CS(=O)(=O)[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508072	GF	On-Demand	Anodyne	PDGFRB	31	40
CS(=O)(=O)[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508072	GF	On-Demand	Anodyne	PDE3B	68	36
CS(=O)(=O)[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508072	GF	On-Demand	Anodyne	SIRT3	48	35
CS(=O)(=O)[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508072	GF	On-Demand	Anodyne	SIRT2	42	35
CS(=O)(=O)[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508073	GF	On-Demand	Anodyne	PDE3A	46	36
CS(=O)(=O)[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508073	GF	On-Demand	Anodyne	PDGFRB	31	40
CS(=O)(=O)[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508073	GF	On-Demand	Anodyne	PDE3B	68	36
CS(=O)(=O)[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508073	GF	On-Demand	Anodyne	SIRT3	48	35
CS(=O)(=O)[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450508073	GF	On-Demand	Anodyne	SIRT2	42	35
COCC[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)c1ccco1	ZINC000450508079	EG	On-Demand	Anodyne	P2RY12	40	31
COCC[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)c1ccco1	ZINC000450508079	EG	On-Demand	Anodyne	CTSV	50	36
COCC[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)c1ccco1	ZINC000450508079	EG	On-Demand	Anodyne	NPPA	45	37
COCC[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)c1ccco1	ZINC000450508080	EG	On-Demand	Anodyne	P2RY12	40	31
COCC[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)c1ccco1	ZINC000450508080	EG	On-Demand	Anodyne	CTSV	50	36
COCC[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)c1ccco1	ZINC000450508080	EG	On-Demand	Anodyne	NPPA	45	37
COc1cc2c(c(OC)c1OC)CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450508091	FH	On-Demand	Anodyne	DRD2	16	40
COc1cc2c(c(OC)c1OC)CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450508091	FH	On-Demand	Anodyne	ACHE	21	42
COc1cc2c(c(OC)c1OC)CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450508091	FH	On-Demand	Anodyne	DRD3	0	40
COc1cc2c(c(OC)c1OC)CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450508091	FH	On-Demand	Anodyne	ABCB1B	54	36
COC(=O)C1(NC(=O)[C@@H]2CCCc3sc(Nc4ccccc4)nc32)CC1	ZINC000450508096	FF	On-Demand	Anodyne	CYP2D6	16	43
COC(=O)C1(NC(=O)[C@H]2CCCc3sc(Nc4ccccc4)nc32)CC1	ZINC000450508097	FF	On-Demand	Anodyne	CYP2D6	16	43
Cc1nc(=NCCCc2c[nH]c3ccc(F)cc23)[nH]cc1[N+](=O)[O-]	ZINC000450508100	EF	On-Demand	Bother	SLC6A4	24	47
Cc1nc(=NCCCc2c[nH]c3ccc(F)cc23)[nH]cc1[N+](=O)[O-]	ZINC000450508100	EF	On-Demand	Bother	MPO	68	47
CCc1cccc(C(=O)N[C@H](CCOC)c2ccco2)n1	ZINC000450508101	CF	On-Demand	Anodyne	PDE5A	23	40
CCc1cccc(C(=O)N[C@@H](CCOC)c2ccco2)n1	ZINC000450508102	CF	On-Demand	Anodyne	PDE5A	23	40
COCCO[C@H]1CCCN(c2nccc3c(OC)cccc23)C1	ZINC000450508103	DF	On-Demand	Anodyne	PDE3A	29	43
COCCO[C@H]1CCCN(c2nccc3c(OC)cccc23)C1	ZINC000450508103	DF	On-Demand	Anodyne	PDE3B	73	38
COCCO[C@@H]1CCCN(c2nccc3c(OC)cccc23)C1	ZINC000450508104	DF	On-Demand	Anodyne	PDE3A	29	43
COCCO[C@@H]1CCCN(c2nccc3c(OC)cccc23)C1	ZINC000450508104	DF	On-Demand	Anodyne	PDE3B	73	38
CC(C)(C)n1ncnc1CNc1ncnc2cc(Br)ccc12	ZINC000450508105	FF	On-Demand	Anodyne	EGFR	53	39
CC(C)(C)n1ncnc1CNc1ncnc2cc(Br)ccc12	ZINC000450508105	FF	On-Demand	Anodyne	CLK4	53	34
COC(=O)C1(NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450508116	FD	On-Demand	Mild	AR	22	41
COC(=O)C1(NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450508117	FD	On-Demand	Mild	AR	22	41
Cc1ccc2[nH]c(C(=O)N[C@H](C)CC(=O)O)c(C)c2c1	ZINC000450508120	CE	On-Demand	Anodyne	NCE103	45	37
Cc1ccc2[nH]c(C(=O)N[C@@H](C)CC(=O)O)c(C)c2c1	ZINC000450508121	CE	On-Demand	Anodyne	NCE103	45	37
N#Cc1cc2c([nH]c1=NCCCc1c[nH]c3ccc(F)cc13)CCOC2	ZINC000450508143	FG	On-Demand	Mild	HTR1A	30	42
N#Cc1cc2c([nH]c1=NCCCc1c[nH]c3ccc(F)cc13)CCOC2	ZINC000450508143	FG	On-Demand	Mild	SLC6A4	24	43
N#Cc1cc2c([nH]c1=NCCCc1c[nH]c3ccc(F)cc13)CCOC2	ZINC000450508143	FG	On-Demand	Mild	MPO	85	48
CC(C)N1CCN(C(=O)c2ccsc2Br)CC1=O	ZINC000450508147	EE	On-Demand	Anodyne	P2RX7	17	56
CC[C@@H](O)CC(=O)NCC(C)(C)C1CCCCC1	ZINC000450508150	CF	On-Demand	Anodyne	AMY2	45	32
CC[C@H](O)CC(=O)NCC(C)(C)C1CCCCC1	ZINC000450508151	CF	On-Demand	Anodyne	AMY2	45	32
O=C(CC1(O)CCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450508159	CE	On-Demand	Anodyne	COLA	65	39
O=C(CC1(O)CCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450508159	CE	On-Demand	Anodyne	CPT1A	62	39
O=C(CC1(O)CCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000450508159	CE	On-Demand	Anodyne	CPT2	44	39
O=C(CC1(O)CCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508160	CE	On-Demand	Anodyne	COLA	65	39
O=C(CC1(O)CCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508160	CE	On-Demand	Anodyne	CPT1A	62	39
O=C(CC1(O)CCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508160	CE	On-Demand	Anodyne	CPT2	44	39
C[C@H](O)[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450508161	EF	On-Demand	Anodyne	PDE6D	82	45
C[C@H](O)[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450508161	EF	On-Demand	Anodyne	IMDH_CRYPV	29	45
C[C@@H](O)[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450508162	EF	On-Demand	Anodyne	PDE6D	82	45
C[C@@H](O)[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450508162	EF	On-Demand	Anodyne	IMDH_CRYPV	29	45
C[C@H](O)[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450508163	EF	On-Demand	Anodyne	PDE6D	82	45
C[C@H](O)[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450508163	EF	On-Demand	Anodyne	IMDH_CRYPV	29	45
C[C@@H](O)[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450508164	EF	On-Demand	Anodyne	PDE6D	82	45
C[C@@H](O)[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450508164	EF	On-Demand	Anodyne	IMDH_CRYPV	29	45
COC(=O)C1(NC(=O)c2ccc3cnccc3c2)CC1	ZINC000450508166	CD	On-Demand	Anodyne	AKT1	20	42
C=CCC1(C(=O)N[C@@H](CCOC)c2ccco2)CCCCC1	ZINC000450508179	DI	On-Demand	Mild	NPPA	44	35
C=CCC1(C(=O)N[C@H](CCOC)c2ccco2)CCCCC1	ZINC000450508180	DI	On-Demand	Mild	NPPA	44	35
COc1ccc(C(=O)NCCCCCC(=O)O)c(OC2CCCC2)c1	ZINC000450508199	EG	On-Demand	Anodyne	MTNR1A	50	39
COC(=O)C1(NC(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450508212	DE	On-Demand	Anodyne	SORT1	15	42
COc1cc2c(c(OC)c1OC)CCN(CCN(C)Cc1ccccc1)CC2	ZINC000450508213	GG	On-Demand	Anodyne	HTR1A	28	44
COc1cc2c(c(OC)c1OC)CCN(CCN(C)Cc1ccccc1)CC2	ZINC000450508213	GG	On-Demand	Anodyne	ACHE	29	43
COc1cc2c(c(OC)c1OC)CCN(CCN(C)Cc1ccccc1)CC2	ZINC000450508213	GG	On-Demand	Anodyne	SIGMAR1	37	44
COc1cc2c(c(OC)c1OC)CCN(CCN(C)Cc1ccccc1)CC2	ZINC000450508213	GG	On-Demand	Anodyne	BCHE	16	43
COc1cc2c(c(OC)c1OC)CCN(CCN(C)Cc1ccccc1)CC2	ZINC000450508213	GG	On-Demand	Anodyne	ABCB1B	66	40
COc1cc2c(c(OC)c1OC)CCN(CCN(C)Cc1ccccc1)CC2	ZINC000450508213	GG	On-Demand	Anodyne	ACKR3	41	36
CN1C(=O)CC[C@H]1C(=O)NC1(c2ccc(F)cc2F)CCCCC1	ZINC000450508222	EF	On-Demand	Anodyne	P2RX7	25	49
CN1C(=O)CC[C@@H]1C(=O)NC1(c2ccc(F)cc2F)CCCCC1	ZINC000450508223	EF	On-Demand	Anodyne	P2RX7	25	49
O=C(c1cc2ccncc2s1)N1CC[C@H](COc2ccccc2)C1	ZINC000450508231	EH	On-Demand	Anodyne	GRIN2B	39	43
O=C(c1cc2ccncc2s1)N1CC[C@H](COc2ccccc2)C1	ZINC000450508231	EH	On-Demand	Anodyne	COLA	40	38
O=C(c1cc2ccncc2s1)N1CC[C@H](COc2ccccc2)C1	ZINC000450508231	EH	On-Demand	Anodyne	CPT1A	45	38
O=C(c1cc2ccncc2s1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508232	EH	On-Demand	Anodyne	GRIN2B	39	43
O=C(c1cc2ccncc2s1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508232	EH	On-Demand	Anodyne	COLA	40	38
O=C(c1cc2ccncc2s1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508232	EH	On-Demand	Anodyne	CPT1A	45	38
O=C(c1cc(Br)c(F)cc1O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508240	GH	On-Demand	Anodyne	GRIN2B	35	42
O=C(c1cc(Br)c(F)cc1O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508240	GH	On-Demand	Anodyne	ITGA4	43	34
O=C(c1cc(Br)c(F)cc1O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508241	GH	On-Demand	Anodyne	GRIN2B	35	42
O=C(c1cc(Br)c(F)cc1O)N1CC[C@H](COc2ccccc2)C1	ZINC000450508241	GH	On-Demand	Anodyne	ITGA4	43	34
Cc1cnc(CCCC(=O)N2CC[C@H](COc3ccccc3)C2)o1	ZINC000450508252	EG	On-Demand	Anodyne	COLA	64	38
Cc1cnc(CCCC(=O)N2CC[C@H](COc3ccccc3)C2)o1	ZINC000450508252	EG	On-Demand	Anodyne	CPT2	44	38
Cc1cnc(CCCC(=O)N2CC[C@@H](COc3ccccc3)C2)o1	ZINC000450508253	EG	On-Demand	Anodyne	COLA	64	38
Cc1cnc(CCCC(=O)N2CC[C@@H](COc3ccccc3)C2)o1	ZINC000450508253	EG	On-Demand	Anodyne	CPT2	44	38
CCN(CCOCCO)c1nc(-c2ccc(OC)cc2)no1	ZINC000450508255	DD	On-Demand	Anodyne	LUCI_PHOPE	15	40
Fc1ccc2c(c1)CCN2C1CCN(c2nccc(-c3cnccn3)n2)CC1	ZINC000450508261	GG	On-Demand	Anodyne	SCD1	33	42
Fc1ccc2c(c1)CCN2C1CCN(c2nccc(-c3cnccn3)n2)CC1	ZINC000450508261	GG	On-Demand	Anodyne	SCD	30	47
Cn1c(C(=O)NCCCOCCOCc2ccccc2)c2n(c1=O)CCCC2	ZINC000450508266	GD	On-Demand	Anodyne	ALPHA-1A	0	43
O=C(O)[C@H]1COCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450508268	DD	On-Demand	Anodyne	OPRM1	0	42
O=C(O)[C@H]1COCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450508268	DD	On-Demand	Anodyne	OPRK1	40	42
O=C(O)[C@@H]1COCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450508269	DD	On-Demand	Anodyne	OPRM1	0	42
O=C(O)[C@@H]1COCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450508269	DD	On-Demand	Anodyne	OPRK1	40	42
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	HTR1A	35	44
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	DRD2	27	45
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	DRD4	21	42
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	ACHE	20	41
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	HTR2A	25	44
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	DRD3	19	42
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	HTR7	51	44
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	HNMT	60	36
Nc1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)nc2ccccc12	ZINC000450508280	GF	On-Demand	Anodyne	CYP2J2	55	39
CC(C)c1nnc(N2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)o1	ZINC000450508286	CI	On-Demand	Anodyne	SLC18A3	21	40
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	HTR1A	18	46
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	DRD4	27	43
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	HTR2A	24	45
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	HTR2C	20	53
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	SLC6A1	46	33
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	HRH1	17	40
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	DRD3	28	43
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	CASR	17	44
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	SIGMAR1	22	43
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	MCHR1	24	43
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450508294	FF	On-Demand	Anodyne	CYP2J2	67	50
COc1cc2c(cc1F)CC[C@H]2Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450508309	DF	On-Demand	Bother	PRKCQ	30	43
COc1cc2c(cc1F)CC[C@@H]2Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450508310	DF	On-Demand	Bother	PRKCQ	30	43
COC(=O)c1coc(CNC2(c3ccccc3)CCC2)n1	ZINC000450508315	CF	On-Demand	Anodyne	NPPA	42	36
COC1(C(=O)NCc2cccc(C(=O)O)c2)CCC1	ZINC000450508318	CD	On-Demand	Anodyne	MMP13	17	48
COC1(C(=O)NCc2cccc(C(=O)O)c2)CCC1	ZINC000450508318	CD	On-Demand	Anodyne	SLC12A5	42	33
O=S(=O)(NC1CCN(CC2CC(F)(F)C2)CC1)c1ccccc1	ZINC000450508322	EE	On-Demand	Anodyne	DRD2	17	48
O=S(=O)(NC1CCN(CC2CC(F)(F)C2)CC1)c1ccccc1	ZINC000450508322	EE	On-Demand	Anodyne	ADRA1D	23	42
O=S(=O)(NC1CCN(CC2CC(F)(F)C2)CC1)c1ccccc1	ZINC000450508322	EE	On-Demand	Anodyne	ADRA1A	22	42
O=S(=O)(NC1CCN(CC2CC(F)(F)C2)CC1)c1ccccc1	ZINC000450508322	EE	On-Demand	Anodyne	ADRA1B	34	42
O=S(=O)(NC1CCN(CC2CC(F)(F)C2)CC1)c1ccccc1	ZINC000450508322	EE	On-Demand	Anodyne	HTR6	16	48
O=S(=O)(NC1CCN(CC2CC(F)(F)C2)CC1)c1ccccc1	ZINC000450508322	EE	On-Demand	Anodyne	CCR8	65	34
O=S(=O)(NC1CCN(CC2CC(F)(F)C2)CC1)c1ccccc1	ZINC000450508322	EE	On-Demand	Anodyne	SFRP1	113	44
O=S(=O)(NC1CCN(CC2CC(F)(F)C2)CC1)c1ccccc1	ZINC000450508322	EE	On-Demand	Anodyne	WNT3	86	40
NC(=O)CCN(CC/C=C\c1ccccc1)Cc1ccccc1	ZINC000450508325	DG	On-Demand	Anodyne	NA	0	40
NC(=O)CCN(CC/C=C/c1ccccc1)Cc1ccccc1	ZINC000450508326	DG	On-Demand	Anodyne	NA	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(C(C)C)C(=O)C1	ZINC000450508328	EF	On-Demand	Anodyne	P2RX7	29	46
COc1cc(Cl)c(C(=O)NC2CCC(C(=O)O)CC2)cc1OC	ZINC000450508336	EF	On-Demand	Anodyne	DRD3	0	47
COc1cc(Cl)c(C(=O)NC2CCC(C(=O)O)CC2)cc1OC	ZINC000450508336	EF	On-Demand	Anodyne	HTR3A	26	42
CNS(=O)(=O)NCC(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000450508346	EC	On-Demand	Anodyne	CA1	23	41
CNS(=O)(=O)NCC(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000450508346	EC	On-Demand	Anodyne	CA4	31	41
O=C([C@@H]1CC12CCSCC2)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450508347	EI	On-Demand	Anodyne	PREP	44	42
O=C([C@@H]1CC12CCSCC2)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450508348	EI	On-Demand	Anodyne	PREP	44	42
O=C([C@@H]1CC12CCSCC2)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450508349	EI	On-Demand	Anodyne	PREP	44	42
O=C([C@@H]1CC12CCSCC2)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450508350	EI	On-Demand	Anodyne	PREP	44	42
CC(C)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1=O	ZINC000450508358	DF	On-Demand	Anodyne	HSD17B2	56	33
CC(C)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1=O	ZINC000450508359	DF	On-Demand	Anodyne	HSD17B2	56	33
CC(C)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1=O	ZINC000450508360	DF	On-Demand	Anodyne	HSD17B2	56	33
CC(C)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1=O	ZINC000450508361	DF	On-Demand	Anodyne	HSD17B2	56	33
Cc1nc(C)n(CCCC(=O)N2CCC[C@H]2/C=C\c2ccccc2)n1	ZINC000450508370	EG	On-Demand	Anodyne	COLA	47	34
Cc1nc(C)n(CCCC(=O)N2CCC[C@H]2/C=C\c2ccccc2)n1	ZINC000450508370	EG	On-Demand	Anodyne	CPT1A	45	34
Cc1nc(C)n(CCCC(=O)N2CCC[C@H]2/C=C/c2ccccc2)n1	ZINC000450508371	EG	On-Demand	Anodyne	COLA	47	34
Cc1nc(C)n(CCCC(=O)N2CCC[C@H]2/C=C/c2ccccc2)n1	ZINC000450508371	EG	On-Demand	Anodyne	CPT1A	45	34
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)n1	ZINC000450508372	EG	On-Demand	Anodyne	COLA	47	34
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)n1	ZINC000450508372	EG	On-Demand	Anodyne	CPT1A	45	34
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)n1	ZINC000450508373	EG	On-Demand	Anodyne	COLA	47	34
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)n1	ZINC000450508373	EG	On-Demand	Anodyne	CPT1A	45	34
C[C@@H](O)CCN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450508394	CD	On-Demand	Anodyne	KCNQ2	53	33
C[C@@H](O)CCN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450508394	CD	On-Demand	Anodyne	CCR5	43	40
C[C@H](O)CCN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450508395	CD	On-Demand	Anodyne	KCNQ2	53	33
C[C@H](O)CCN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450508395	CD	On-Demand	Anodyne	CCR5	43	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(Cl)cc2)c(OC)c1	ZINC000450508405	GH	On-Demand	Anodyne	PTGS1	0	44
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(Cl)cc2)c(OC)c1	ZINC000450508405	GH	On-Demand	Anodyne	PTGS2	23	44
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(Cl)cc2)c(OC)c1	ZINC000450508405	GH	On-Demand	Anodyne	MTNR1A	58	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(Cl)cc2)c(OC)c1	ZINC000450508405	GH	On-Demand	Anodyne	MTNR1B	46	39
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(Cl)cc2)c(OC)c1	ZINC000450508406	GH	On-Demand	Anodyne	PTGS1	0	44
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(Cl)cc2)c(OC)c1	ZINC000450508406	GH	On-Demand	Anodyne	PTGS2	23	44
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(Cl)cc2)c(OC)c1	ZINC000450508406	GH	On-Demand	Anodyne	MTNR1A	58	39
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(Cl)cc2)c(OC)c1	ZINC000450508406	GH	On-Demand	Anodyne	MTNR1B	46	39
C[C@@H](Nc1ccnc2cc(F)c(Cl)cc12)C(=O)NCCF	ZINC000450508420	DF	On-Demand	Anodyne	HRP1_PLAFA	66	31
C[C@H](Nc1ccnc2cc(F)c(Cl)cc12)C(=O)NCCF	ZINC000450508421	DF	On-Demand	Anodyne	HRP1_PLAFA	66	31
COc1ccc(-c2ccnc(N3CCC(n4cnc(C(N)=O)c4N)CC3)n2)cc1	ZINC000450508425	GD	On-Demand	Anodyne	DKK1	0	43
CCC(=O)CCCN1CCc2cc(OC)c(OC)c(OC)c2CC1	ZINC000450508431	EF	On-Demand	Anodyne	ABCB1B	45	32
CCC(=O)CCCN1CCc2cc(OC)c(OC)c(OC)c2CC1	ZINC000450508431	EF	On-Demand	Anodyne	SLC29A2	0	46
CCCC[C@@H](C)C(=O)N(CCC(=O)O)Cc1cccc(F)c1F	ZINC000450508440	EH	On-Demand	Anodyne	CCKAR	22	42
CCCC[C@H](C)C(=O)N(CCC(=O)O)Cc1cccc(F)c1F	ZINC000450508441	EH	On-Demand	Anodyne	CCKAR	22	42
Fc1ccc2c(c1)CCN2C1CCN(c2nc(C3CCC3)no2)CC1	ZINC000450508444	EH	On-Demand	Anodyne	SCD1	29	42
Fc1ccc2c(c1)CCN2C1CCN(c2nc(C3CCC3)no2)CC1	ZINC000450508444	EH	On-Demand	Anodyne	SCD	26	45
O=C(Cc1ccc(O)c(F)c1)N1CC[C@H](COc2ccccc2)C1	ZINC000450508446	EG	On-Demand	Anodyne	GRIN2B	41	43
O=C(Cc1ccc(O)c(F)c1)N1CC[C@H](COc2ccccc2)C1	ZINC000450508446	EG	On-Demand	Anodyne	ITGA4	54	39
O=C(Cc1ccc(O)c(F)c1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508447	EG	On-Demand	Anodyne	GRIN2B	41	43
O=C(Cc1ccc(O)c(F)c1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450508447	EG	On-Demand	Anodyne	ITGA4	54	39
Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)Nc1cccc(C(=O)O)c1)CC2	ZINC000450508448	GG	On-Demand	Anodyne	PARP10	0	52
Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)Nc1cccc(C(=O)O)c1)CC2	ZINC000450508449	GG	On-Demand	Anodyne	PARP10	0	52
OCCOC1(CNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450508467	FF	On-Demand	Anodyne	HNMT	40	31
C[C@@H](Oc1ccccn1)C(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000450508480	EH	On-Demand	Anodyne	P2RY1	32	42
C[C@H](Oc1ccccn1)C(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000450508481	EH	On-Demand	Anodyne	P2RY1	32	42
COc1ccc([C@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508487	GI	On-Demand	Anodyne	CTSK	23	44
COc1ccc([C@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508487	GI	On-Demand	Anodyne	CTSL	22	44
COc1ccc([C@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508487	GI	On-Demand	Anodyne	CTSS	20	44
COc1ccc([C@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508487	GI	On-Demand	Anodyne	ACE2	27	40
COc1ccc([C@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508487	GI	On-Demand	Anodyne	FFAR1	18	51
COc1ccc([C@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508488	GI	On-Demand	Anodyne	CTSK	23	44
COc1ccc([C@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508488	GI	On-Demand	Anodyne	CTSL	22	44
COc1ccc([C@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508488	GI	On-Demand	Anodyne	CTSS	20	44
COc1ccc([C@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508488	GI	On-Demand	Anodyne	ACE2	27	40
COc1ccc([C@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508488	GI	On-Demand	Anodyne	FFAR1	18	51
COc1ccc([C@@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508489	GI	On-Demand	Anodyne	CTSK	23	44
COc1ccc([C@@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508489	GI	On-Demand	Anodyne	CTSL	22	44
COc1ccc([C@@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508489	GI	On-Demand	Anodyne	CTSS	20	44
COc1ccc([C@@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508489	GI	On-Demand	Anodyne	ACE2	27	40
COc1ccc([C@@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508489	GI	On-Demand	Anodyne	FFAR1	18	51
COc1ccc([C@@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508490	GI	On-Demand	Anodyne	CTSK	23	44
COc1ccc([C@@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508490	GI	On-Demand	Anodyne	CTSL	22	44
COc1ccc([C@@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508490	GI	On-Demand	Anodyne	CTSS	20	44
COc1ccc([C@@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508490	GI	On-Demand	Anodyne	ACE2	27	40
COc1ccc([C@@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450508490	GI	On-Demand	Anodyne	FFAR1	18	51
CC(C)(C)Oc1cc(F)ccc1NC(=O)c1ccnc(OC(F)F)c1	ZINC000450508493	FI	On-Demand	Anodyne	PYGL	0	40
CCCc1occc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508495	CF	On-Demand	Anodyne	KDM4E	21	41
O=S(=O)(NC1CCN(CCC2=CCCCC2)CC1)c1ccccc1	ZINC000450508503	EG	On-Demand	Anodyne	SFRP1	97	38
O=S(=O)(NC1CCN(CCC2=CCCCC2)CC1)c1ccccc1	ZINC000450508503	EG	On-Demand	Anodyne	WNT3	77	37
Cc1ccc2[nH]c(C(=O)NC[C@@H](C)C(=O)O)c(C)c2c1	ZINC000450508507	CE	On-Demand	Anodyne	NCE103	41	37
Cc1ccc2[nH]c(C(=O)NC[C@H](C)C(=O)O)c(C)c2c1	ZINC000450508508	CE	On-Demand	Anodyne	NCE103	41	37
O=C(CSC1CC1)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000450508509	FI	On-Demand	Anodyne	RBP4	47	35
O=C(CSC1CC1)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000450508510	FI	On-Demand	Anodyne	RBP4	47	35
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	GRIN2B	16	44
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	TACR1	18	45
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	SSTR4	43	38
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	SLC6A11	0	41
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	SLC6A12	0	42
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	CCR2	26	41
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	SLC6A13	0	42
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	PROC	47	34
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	AMP1_PLAFQ	48	38
O=C(O)c1cccc(CNC(=O)[C@@H](c2ccccc2)C2CC2)c1	ZINC000450508511	DG	On-Demand	Anodyne	Q8WSF8_APLCA	40	31
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	GRIN2B	16	44
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	TACR1	18	45
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	SSTR4	43	38
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	SLC6A11	0	41
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	SLC6A12	0	42
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	CCR2	26	41
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	SLC6A13	0	42
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	PROC	47	34
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	AMP1_PLAFQ	48	38
O=C(O)c1cccc(CNC(=O)[C@H](c2ccccc2)C2CC2)c1	ZINC000450508512	DG	On-Demand	Anodyne	Q8WSF8_APLCA	40	31
CC1(C(=O)Nc2cccc(-n3ncc(C(=O)O)c3C(F)(F)F)c2)CC1	ZINC000450508513	FG	On-Demand	Anodyne	MST1R	51	40
O=C(O)COc1cccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450508522	GI	On-Demand	Anodyne	PPARD	65	46
O=C(O)COc1cccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450508522	GI	On-Demand	Anodyne	EPHX2	30	46
O=C(O)COc1cccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450508522	GI	On-Demand	Anodyne	PDS	40	38
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1CCCC(=O)c1ccccc1	ZINC000450508525	FF	On-Demand	Anodyne	CYP2J2	47	33
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1CCCC(=O)c1ccccc1	ZINC000450508526	FF	On-Demand	Anodyne	CYP2J2	47	33
O=C(CC1CC(F)(F)C1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450508529	DI	On-Demand	Anodyne	PREP	81	47
O=C(CC1CC(F)(F)C1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450508529	DI	On-Demand	Anodyne	F1PEP1	0	41
O=C(CC1CC(F)(F)C1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450508530	DI	On-Demand	Anodyne	PREP	81	47
O=C(CC1CC(F)(F)C1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450508530	DI	On-Demand	Anodyne	F1PEP1	0	41
O=C(CC1CC(F)(F)C1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450508531	DI	On-Demand	Anodyne	PREP	68	42
O=C(CC1CC(F)(F)C1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450508531	DI	On-Demand	Anodyne	F1PEP1	0	41
O=C(CC1CC(F)(F)C1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450508532	DI	On-Demand	Anodyne	PREP	68	42
O=C(CC1CC(F)(F)C1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450508532	DI	On-Demand	Anodyne	F1PEP1	0	41
COc1cccc2c(N3CC[C@H]4OCCN(C)[C@H]4C3)nccc12	ZINC000450508537	DE	On-Demand	Anodyne	PDE3A	46	38
COc1cccc2c(N3CC[C@H]4OCCN(C)[C@H]4C3)nccc12	ZINC000450508537	DE	On-Demand	Anodyne	PDE3B	68	38
COc1cccc2c(N3CC[C@H]4OCCN(C)[C@@H]4C3)nccc12	ZINC000450508538	DE	On-Demand	Anodyne	PDE3A	46	38
COc1cccc2c(N3CC[C@H]4OCCN(C)[C@@H]4C3)nccc12	ZINC000450508538	DE	On-Demand	Anodyne	PDE3B	68	38
COc1cccc2c(N3CC[C@@H]4OCCN(C)[C@H]4C3)nccc12	ZINC000450508539	DE	On-Demand	Anodyne	PDE3A	46	38
COc1cccc2c(N3CC[C@@H]4OCCN(C)[C@H]4C3)nccc12	ZINC000450508539	DE	On-Demand	Anodyne	PDE3B	68	38
COc1cccc2c(N3CC[C@@H]4OCCN(C)[C@@H]4C3)nccc12	ZINC000450508540	DE	On-Demand	Anodyne	PDE3A	46	38
COc1cccc2c(N3CC[C@@H]4OCCN(C)[C@@H]4C3)nccc12	ZINC000450508540	DE	On-Demand	Anodyne	PDE3B	68	38
O=C(O)CNC(=O)Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450508541	GE	On-Demand	Anodyne	CXCL8	18	41
Cc1ccn(-c2ccccc2C(=O)N2CCN(C(C)C)C(=O)C2)n1	ZINC000450508568	ED	On-Demand	Anodyne	P2RX7	0	55
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	DRD2	15	47
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	ADRA1D	25	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	ADRA1A	19	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	ADRA1B	32	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	CCR5	38	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	HTR6	15	47
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	CCR8	81	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	SFRP1	129	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508572	GF	On-Demand	Anodyne	WNT3	87	39
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	DRD2	15	47
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	ADRA1D	25	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	ADRA1A	19	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	ADRA1B	32	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	CCR5	38	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	HTR6	15	47
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	CCR8	81	37
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	SFRP1	129	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508573	GF	On-Demand	Anodyne	WNT3	87	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	DRD2	15	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	ADRA1D	25	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	ADRA1A	19	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	ADRA1B	32	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	CCR5	38	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	HTR6	15	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	CCR8	81	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	SFRP1	129	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508574	GF	On-Demand	Anodyne	WNT3	87	39
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	DRD2	15	47
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	ADRA1D	25	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	ADRA1A	19	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	ADRA1B	32	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	CCR5	38	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	HTR6	15	47
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	CCR8	81	37
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	SFRP1	129	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508575	GF	On-Demand	Anodyne	WNT3	87	39
COC(=O)C1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000450508594	FD	On-Demand	Anodyne	DRD2	17	45
COC(=O)C1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000450508594	FD	On-Demand	Anodyne	ADRA1D	27	42
COC(=O)C1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000450508594	FD	On-Demand	Anodyne	ADRA1A	26	42
COC(=O)C1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000450508594	FD	On-Demand	Anodyne	ADRA1B	26	42
COC(=O)C1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000450508594	FD	On-Demand	Anodyne	HTR7	16	45
COC(=O)C1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000450508594	FD	On-Demand	Anodyne	CCR8	99	37
COC(=O)C1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000450508594	FD	On-Demand	Anodyne	SFRP1	140	43
COC(=O)C1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000450508594	FD	On-Demand	Anodyne	WNT3	94	40
CC(=O)c1ccc(CN2c3ccc(S(N)(=O)=O)cc3C[C@H]2C)cc1	ZINC000450508597	EE	On-Demand	Anodyne	CA2	39	46
CC(=O)c1ccc(CN2c3ccc(S(N)(=O)=O)cc3C[C@H]2C)cc1	ZINC000450508597	EE	On-Demand	Anodyne	CA7	50	41
CC(=O)c1ccc(CN2c3ccc(S(N)(=O)=O)cc3C[C@@H]2C)cc1	ZINC000450508598	EE	On-Demand	Anodyne	CA2	39	46
CC(=O)c1ccc(CN2c3ccc(S(N)(=O)=O)cc3C[C@@H]2C)cc1	ZINC000450508598	EE	On-Demand	Anodyne	CA7	50	41
CCc1cc(CCCn2ccnc2)on1	ZINC000450508600	BE	On-Demand	Anodyne	TBXAS1	34	46
CCc1cc(CCCn2ccnc2)on1	ZINC000450508600	BE	On-Demand	Anodyne	HMOX2	49	35
CCOC(=O)c1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)nc1	ZINC000450508646	FD	On-Demand	Anodyne	SRD5A2	0	41
CCOC(=O)c1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)nc1	ZINC000450508646	FD	On-Demand	Anodyne	CA7	31	44
CCCOc1cccc(CC(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450508651	EG	On-Demand	Anodyne	HRH2	30	41
CCCOc1cccc(CC(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450508651	EG	On-Demand	Anodyne	PPARG	28	40
CCCOc1cccc(CC(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450508651	EG	On-Demand	Anodyne	PTGER2	25	45
CCCOc1cccc(CC(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450508651	EG	On-Demand	Anodyne	MTNR1A	41	45
CCCOc1cccc(CC(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450508651	EG	On-Demand	Anodyne	MTNR1B	34	40
CCCOc1cccc(CC(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450508651	EG	On-Demand	Anodyne	PLA2G4B	74	48
CCCOc1cccc(CC(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450508651	EG	On-Demand	Anodyne	TSPAN17	0	46
CCCOc1cccc(CC(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450508651	EG	On-Demand	Anodyne	PDS	85	42
CC[C@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450508664	DF	On-Demand	Anodyne	PDE4B	19	43
CC[C@@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450508665	DF	On-Demand	Anodyne	PDE4B	19	43
CCC(=O)CCCN1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	ZINC000450508667	GH	On-Demand	Anodyne	DRD4	16	45
CCC(=O)CCCN1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	ZINC000450508667	GH	On-Demand	Anodyne	DRD3	17	40
CCC(=O)CCCN1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	ZINC000450508667	GH	On-Demand	Anodyne	AVPR1B	16	40
C[C@H](c1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)cc1)C(F)(F)F	ZINC000450508669	GH	On-Demand	Anodyne	CA7	24	47
C[C@@H](c1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)cc1)C(F)(F)F	ZINC000450508670	GH	On-Demand	Anodyne	CA7	24	47
C[C@H](CN1CC=C(c2c[nH]c3ncccc23)CC1)S(C)(=O)=O	ZINC000450508690	DE	On-Demand	Anodyne	SLC6A4	15	56
C[C@@H](CN1CC=C(c2c[nH]c3ncccc23)CC1)S(C)(=O)=O	ZINC000450508691	DE	On-Demand	Anodyne	SLC6A4	15	56
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	DRD4	43	32
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	PPARA	26	46
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	PTAFR	0	40
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	MMP13	27	40
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	ROCK1	24	41
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	PPARD	30	43
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	MTNR1A	43	36
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	PLA2G4B	66	42
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	AKR1C3	36	41
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	AKR1C2	52	37
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	KCNK3	40	33
CCCOc1cc(OC)ccc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508692	EG	On-Demand	Anodyne	PDS	45	33
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)on1	ZINC000450508699	EG	On-Demand	Anodyne	COLA	79	41
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)on1	ZINC000450508699	EG	On-Demand	Anodyne	CPT1A	63	34
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)on1	ZINC000450508699	EG	On-Demand	Anodyne	PREP	42	38
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)on1	ZINC000450508699	EG	On-Demand	Anodyne	ADORA3	0	40
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)on1	ZINC000450508700	EG	On-Demand	Anodyne	COLA	79	41
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)on1	ZINC000450508700	EG	On-Demand	Anodyne	CPT1A	63	34
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)on1	ZINC000450508700	EG	On-Demand	Anodyne	PREP	42	38
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)on1	ZINC000450508700	EG	On-Demand	Anodyne	ADORA3	0	40
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)on1	ZINC000450508701	EG	On-Demand	Anodyne	COLA	79	41
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)on1	ZINC000450508701	EG	On-Demand	Anodyne	CPT1A	63	34
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)on1	ZINC000450508701	EG	On-Demand	Anodyne	PREP	42	38
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)on1	ZINC000450508701	EG	On-Demand	Anodyne	ADORA3	0	40
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)on1	ZINC000450508702	EG	On-Demand	Anodyne	COLA	79	41
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)on1	ZINC000450508702	EG	On-Demand	Anodyne	CPT1A	63	34
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)on1	ZINC000450508702	EG	On-Demand	Anodyne	PREP	42	38
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)on1	ZINC000450508702	EG	On-Demand	Anodyne	ADORA3	0	40
CCC[C@H](C(=O)NCc1cccc(C(=O)O)c1)C(C)C	ZINC000450508713	CG	On-Demand	Anodyne	PCSK5	54	35
CCC[C@H](C(=O)NCc1cccc(C(=O)O)c1)C(C)C	ZINC000450508713	CG	On-Demand	Anodyne	AMP1_PLAFQ	49	38
CCC[C@H](C(=O)NCc1cccc(C(=O)O)c1)C(C)C	ZINC000450508713	CG	On-Demand	Anodyne	CARM1	42	35
CCC[C@H](C(=O)NCc1cccc(C(=O)O)c1)C(C)C	ZINC000450508713	CG	On-Demand	Anodyne	PDS	42	33
CCC[C@@H](C(=O)NCc1cccc(C(=O)O)c1)C(C)C	ZINC000450508714	CG	On-Demand	Anodyne	PCSK5	54	35
CCC[C@@H](C(=O)NCc1cccc(C(=O)O)c1)C(C)C	ZINC000450508714	CG	On-Demand	Anodyne	AMP1_PLAFQ	49	38
CCC[C@@H](C(=O)NCc1cccc(C(=O)O)c1)C(C)C	ZINC000450508714	CG	On-Demand	Anodyne	CARM1	42	35
CCC[C@@H](C(=O)NCc1cccc(C(=O)O)c1)C(C)C	ZINC000450508714	CG	On-Demand	Anodyne	PDS	42	33
N#Cc1cccc(N[C@H]2CCN(C(=O)COc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508722	FF	On-Demand	Mild	COLA	103	42
N#Cc1cccc(N[C@H]2CCN(C(=O)COc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508722	FF	On-Demand	Mild	CPT1A	60	38
N#Cc1cccc(N[C@H]2CCN(C(=O)COc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508722	FF	On-Demand	Mild	CPT2	40	34
N#Cc1cccc(N[C@@H]2CCN(C(=O)COc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508723	FF	On-Demand	Mild	COLA	103	42
N#Cc1cccc(N[C@@H]2CCN(C(=O)COc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508723	FF	On-Demand	Mild	CPT1A	60	38
N#Cc1cccc(N[C@@H]2CCN(C(=O)COc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508723	FF	On-Demand	Mild	CPT2	40	34
CN(CC(=O)N1CCC(C(=O)O)CC1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450508730	FD	On-Demand	Anodyne	OPRM1	0	44
CN(CC(=O)N1CCC(C(=O)O)CC1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450508730	FD	On-Demand	Anodyne	OPRK1	54	46
CN(CC(=O)N1CCC(C(=O)O)CC1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450508730	FD	On-Demand	Anodyne	FDFT1	31	40
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	HTR1A	18	62
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	DRD2	23	48
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	DRD4	42	41
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	HTR2A	18	48
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	DRD3	21	42
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	SLC6A3	18	40
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	HTR7	21	53
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	SIGMAR1	35	48
Oc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)nc2ccccc12	ZINC000450508731	GG	On-Demand	Anodyne	HNMT	41	34
CNC(=O)NC1CN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450508732	CC	On-Demand	Mild	MTNR1A	27	44
CNC(=O)NC1CN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450508732	CC	On-Demand	Mild	MTNR1B	0	44
CC(C)N(CCN(C)C(=O)c1cccc(C(F)(F)F)n1)C(C)C	ZINC000450508733	EG	On-Demand	Anodyne	TRPV1	47	34
CN(Cc1ccc(C(=O)O)cc1)C(=O)C1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450508735	GI	On-Demand	Anodyne	TACR3	29	44
CN(Cc1ccc(C(=O)O)cc1)C(=O)C1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450508735	GI	On-Demand	Anodyne	TRPM8	39	41
N#Cc1cc(Br)cnc1N1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450508736	GF	On-Demand	Mild	KISS1R	45	34
N#Cc1cc(Br)cnc1N1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450508737	GF	On-Demand	Mild	KISS1R	45	34
O=C(O)[C@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508739	GH	On-Demand	Anodyne	PPARA	17	44
O=C(O)[C@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508739	GH	On-Demand	Anodyne	MME	69	44
O=C(O)[C@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508739	GH	On-Demand	Anodyne	ANPEP	44	32
O=C(O)[C@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508739	GH	On-Demand	Anodyne	CPA1	58	43
O=C(O)[C@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508739	GH	On-Demand	Anodyne	PPARD	20	41
O=C(O)[C@@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508740	GH	On-Demand	Anodyne	PPARA	17	44
O=C(O)[C@@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508740	GH	On-Demand	Anodyne	MME	69	44
O=C(O)[C@@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508740	GH	On-Demand	Anodyne	ANPEP	44	32
O=C(O)[C@@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508740	GH	On-Demand	Anodyne	CPA1	58	43
O=C(O)[C@@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)Cc1ccccc1	ZINC000450508740	GH	On-Demand	Anodyne	PPARD	20	41
CC(C)(C)[C@H](O)C[C@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450508745	FF	On-Demand	Anodyne	EGFR	44	36
CC(C)(C)[C@H](O)C[C@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450508745	FF	On-Demand	Anodyne	HTT	0	42
CC(C)(C)[C@@H](O)C[C@@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450508746	FF	On-Demand	Anodyne	EGFR	44	36
CC(C)(C)[C@@H](O)C[C@@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450508746	FF	On-Demand	Anodyne	HTT	0	42
CC(C)(C)[C@@H](O)C[C@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450508747	FF	On-Demand	Anodyne	EGFR	44	36
CC(C)(C)[C@@H](O)C[C@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450508747	FF	On-Demand	Anodyne	HTT	0	42
CC(C)(C)[C@H](O)C[C@@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450508748	FF	On-Demand	Anodyne	EGFR	44	36
CC(C)(C)[C@H](O)C[C@@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450508748	FF	On-Demand	Anodyne	HTT	0	42
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450508757	DH	On-Demand	Anodyne	PREP	41	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450508757	DH	On-Demand	Anodyne	SFRP1	42	34
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450508757	DH	On-Demand	Anodyne	WNT3	43	33
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450508758	DH	On-Demand	Anodyne	PREP	41	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450508758	DH	On-Demand	Anodyne	SFRP1	42	34
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450508758	DH	On-Demand	Anodyne	WNT3	43	33
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450508759	DH	On-Demand	Anodyne	PREP	67	43
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450508759	DH	On-Demand	Anodyne	SFRP1	64	38
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450508759	DH	On-Demand	Anodyne	WNT3	68	38
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450508760	DH	On-Demand	Anodyne	PREP	67	43
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450508760	DH	On-Demand	Anodyne	SFRP1	64	38
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450508760	DH	On-Demand	Anodyne	WNT3	68	38
CCOc1ccc(C[C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)cc1	ZINC000450508778	GG	On-Demand	Anodyne	PPARG	33	41
CCOc1ccc(C[C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)cc1	ZINC000450508778	GG	On-Demand	Anodyne	PPARA	45	45
CCOc1ccc(C[C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)cc1	ZINC000450508778	GG	On-Demand	Anodyne	MME	29	40
CCOc1ccc(C[C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)cc1	ZINC000450508778	GG	On-Demand	Anodyne	PPARD	33	41
CCOc1ccc(C[C@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)cc1	ZINC000450508779	GG	On-Demand	Anodyne	PPARG	33	41
CCOc1ccc(C[C@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)cc1	ZINC000450508779	GG	On-Demand	Anodyne	PPARA	45	45
CCOc1ccc(C[C@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)cc1	ZINC000450508779	GG	On-Demand	Anodyne	MME	29	40
CCOc1ccc(C[C@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)cc1	ZINC000450508779	GG	On-Demand	Anodyne	PPARD	33	41
COc1ccc([C@H](NC(=O)Cc2ccc(Cl)c(OC)c2)C(F)(F)F)cc1	ZINC000450508780	GI	On-Demand	Anodyne	P2RX7	0	40
COc1ccc([C@@H](NC(=O)Cc2ccc(Cl)c(OC)c2)C(F)(F)F)cc1	ZINC000450508781	GI	On-Demand	Anodyne	P2RX7	0	40
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1CC1CC(F)(F)C1	ZINC000450508783	DE	On-Demand	Anodyne	CA7	29	41
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1CC1CC(F)(F)C1	ZINC000450508784	DE	On-Demand	Anodyne	CA7	29	41
COc1cccc2c(N3CCC[C@@H](CNC(=O)c4ccco4)C3)nccc12	ZINC000450508785	FG	On-Demand	Anodyne	HTR1A	17	47
COc1cccc2c(N3CCC[C@@H](CNC(=O)c4ccco4)C3)nccc12	ZINC000450508785	FG	On-Demand	Anodyne	CCR3	17	41
COc1cccc2c(N3CCC[C@@H](CNC(=O)c4ccco4)C3)nccc12	ZINC000450508785	FG	On-Demand	Anodyne	ALK	17	40
COc1cccc2c(N3CCC[C@H](CNC(=O)c4ccco4)C3)nccc12	ZINC000450508786	FG	On-Demand	Anodyne	HTR1A	17	47
COc1cccc2c(N3CCC[C@H](CNC(=O)c4ccco4)C3)nccc12	ZINC000450508786	FG	On-Demand	Anodyne	CCR3	17	41
COc1cccc2c(N3CCC[C@H](CNC(=O)c4ccco4)C3)nccc12	ZINC000450508786	FG	On-Demand	Anodyne	ALK	17	40
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	HTR1A	20	57
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	DRD2	30	51
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	DRD1	16	49
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	DRD4	24	49
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	HTR1D	16	42
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	HTR2A	21	51
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	SLC6A4	19	57
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	HTR1F	15	45
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	HTR5A	15	49
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450508787	FI	On-Demand	Anodyne	CYP2J2	44	32
COc1ccc([C@@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C(F)(F)F)cc1	ZINC000450508788	GH	On-Demand	Anodyne	P2RY12	71	34
COc1ccc([C@@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C(F)(F)F)cc1	ZINC000450508789	GH	On-Demand	Anodyne	P2RY12	71	34
COc1ccc([C@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C(F)(F)F)cc1	ZINC000450508790	GH	On-Demand	Anodyne	P2RY12	71	34
COc1ccc([C@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C(F)(F)F)cc1	ZINC000450508791	GH	On-Demand	Anodyne	P2RY12	71	34
COc1ccc(-c2ccnc(N3CCC[C@@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450508795	GG	On-Demand	Anodyne	DKK1	0	49
COc1ccc(-c2ccnc(N3CCC[C@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450508796	GG	On-Demand	Anodyne	DKK1	0	49
CCCc1cc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)no1	ZINC000450508809	DH	On-Demand	Anodyne	PREP	42	37
CCCc1cc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)no1	ZINC000450508810	DH	On-Demand	Anodyne	PREP	42	37
CCCc1cc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)no1	ZINC000450508811	DH	On-Demand	Anodyne	PREP	51	40
CCCc1cc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)no1	ZINC000450508812	DH	On-Demand	Anodyne	PREP	42	37
COc1ccc(C(=O)N(C)CCC(=O)O)c(OC2CCCC2)c1	ZINC000450508813	DF	On-Demand	Anodyne	MTNR1A	42	36
CC(C)(C)Oc1cc(F)ccc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450508820	FJ	On-Demand	Anodyne	PYGL	17	44
C[C@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508830	FE	On-Demand	Anodyne	ADRA1D	24	43
C[C@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508830	FE	On-Demand	Anodyne	ADRA1A	17	43
C[C@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508830	FE	On-Demand	Anodyne	ADRA1B	31	43
C[C@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508830	FE	On-Demand	Anodyne	SFRP1	112	34
C[C@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508830	FE	On-Demand	Anodyne	WNT3	72	34
C[C@@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508831	FE	On-Demand	Anodyne	ADRA1D	24	43
C[C@@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508831	FE	On-Demand	Anodyne	ADRA1A	17	43
C[C@@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508831	FE	On-Demand	Anodyne	ADRA1B	31	43
C[C@@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508831	FE	On-Demand	Anodyne	SFRP1	112	34
C[C@@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450508831	FE	On-Demand	Anodyne	WNT3	72	34
CC[C@@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450508832	CD	On-Demand	Bother	ACE2	45	33
CC[C@@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450508832	CD	On-Demand	Bother	KCNK3	43	37
CC[C@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450508833	CD	On-Demand	Bother	ACE2	45	33
CC[C@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450508833	CD	On-Demand	Bother	KCNK3	43	37
N#Cc1cccc(N2CCC[C@H](CNC(=O)c3ccco3)C2)c1[N+](=O)[O-]	ZINC000450508838	FF	On-Demand	Mild	KISS1R	45	34
N#Cc1cccc(N2CCC[C@@H](CNC(=O)c3ccco3)C2)c1[N+](=O)[O-]	ZINC000450508839	FF	On-Demand	Mild	KISS1R	45	34
Cc1cc(NC(=O)c2ccccc2CCC(F)(F)F)cc(C(=O)O)c1C	ZINC000450508846	FJ	On-Demand	Anodyne	KCNK3	57	38
Cc1cc(NC(=O)c2ccccc2CCC(F)(F)F)cc(C(=O)O)c1C	ZINC000450508846	FJ	On-Demand	Anodyne	KCNK9	55	34
CCOc1ccc(C[C@H](CNC(=O)C2(C)CC2)C(=O)O)cc1	ZINC000450508847	DE	On-Demand	Anodyne	PPARG	40	31
CCOc1ccc(C[C@H](CNC(=O)C2(C)CC2)C(=O)O)cc1	ZINC000450508847	DE	On-Demand	Anodyne	CPA1	55	36
CCOc1ccc(C[C@@H](CNC(=O)C2(C)CC2)C(=O)O)cc1	ZINC000450508848	DE	On-Demand	Anodyne	PPARG	40	31
CCOc1ccc(C[C@@H](CNC(=O)C2(C)CC2)C(=O)O)cc1	ZINC000450508848	DE	On-Demand	Anodyne	CPA1	55	36
Cc1cc(=NC(=O)C2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)CC2)[nH]o1	ZINC000450508890	GH	On-Demand	Anodyne	CACNA1G	33	40
Cc1cc(=NC(=O)C2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)CC2)[nH]o1	ZINC000450508891	GH	On-Demand	Anodyne	CACNA1G	33	40
CC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450508894	EG	On-Demand	Anodyne	TIMP3	61	32
CC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450508894	EG	On-Demand	Anodyne	ACE2	44	33
CC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450508895	EG	On-Demand	Anodyne	TIMP3	61	32
CC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450508895	EG	On-Demand	Anodyne	ACE2	44	33
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	NQO2	27	42
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	TRPV1	23	43
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	MTNR1A	93	42
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	MTNR1B	79	41
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	AKR1C3	40	43
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	SUCNR1	23	41
COc1ccc(CCCC(=O)NCc2cccc(C(=O)O)c2)c(OC)c1	ZINC000450508899	FG	On-Demand	Anodyne	CYSK1	42	33
Cc1c(Br)cc(S(C)(=O)=O)cc1C(=O)NC[C@@H](C)C(=O)O	ZINC000450508900	GD	On-Demand	Anodyne	ITGAV	52	36
Cc1c(Br)cc(S(C)(=O)=O)cc1C(=O)NC[C@H](C)C(=O)O	ZINC000450508901	GD	On-Demand	Anodyne	ITGAV	52	36
COc1ccc([C@@H](NC(=O)c2ccsc2C)C(F)(F)F)cc1	ZINC000450508903	EI	On-Demand	Anodyne	CTSK	15	43
COc1ccc([C@H](NC(=O)c2ccsc2C)C(F)(F)F)cc1	ZINC000450508904	EI	On-Demand	Anodyne	CTSK	15	43
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450508910	DH	On-Demand	Anodyne	PREP	40	36
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450508911	DH	On-Demand	Anodyne	PREP	40	36
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450508912	DH	On-Demand	Anodyne	PREP	40	36
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	ACE	39	42
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	FOLH1	19	45
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	MME	100	46
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	ANPEP	103	42
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	RNPEP	40	36
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	PAPA1_CARPA	43	35
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	CPA1	86	44
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	NAALAD2	31	45
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	CAPNS1	63	32
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	CAPN1	46	39
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	CAPN2	55	32
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	ACE2	76	37
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	LAP3	43	35
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	CPA3	0	44
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	FPR1	44	36
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	NPR	48	37
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450508914	EB	On-Demand	Anodyne	SLC15A2	0	40
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	ACE	39	42
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	FOLH1	19	45
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	MME	100	46
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	ANPEP	103	42
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	RNPEP	40	36
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	PAPA1_CARPA	43	35
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	CPA1	86	44
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	NAALAD2	31	45
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	CAPNS1	63	32
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	CAPN1	46	39
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	CAPN2	55	32
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	ACE2	76	37
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	LAP3	43	35
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	CPA3	0	44
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	FPR1	44	36
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	NPR	48	37
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450508915	EB	On-Demand	Anodyne	SLC15A2	0	40
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450508916	GE	On-Demand	Anodyne	SIGMAR1	22	40
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450508916	GE	On-Demand	Anodyne	SSTR5	48	39
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450508916	GE	On-Demand	Anodyne	HSP90AA1	24	42
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450508916	GE	On-Demand	Anodyne	CACNA1G	34	40
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450508916	GE	On-Demand	Anodyne	RORC	46	32
COCCN1CN(c2ncnc3cc(Br)ccc23)CC1=O	ZINC000450508926	FD	On-Demand	Anodyne	PDGFRB	34	40
N#Cc1cccc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508928	FG	On-Demand	Mild	FAP	0	40
N#Cc1cccc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508928	FG	On-Demand	Mild	BIRC2	20	45
N#Cc1cccc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508929	FG	On-Demand	Mild	FAP	0	40
N#Cc1cccc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450508929	FG	On-Demand	Mild	BIRC2	20	45
O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450508944	GJ	On-Demand	Mild	RBP4	60	36
O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450508945	GJ	On-Demand	Mild	RBP4	60	36
O=C(COc1ccccc1)N1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508968	GE	On-Demand	Anodyne	COLA	133	45
O=C(COc1ccccc1)N1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508968	GE	On-Demand	Anodyne	CPT1A	119	45
O=C(COc1ccccc1)N1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508968	GE	On-Demand	Anodyne	CPT2	46	38
O=C(COc1ccccc1)N1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508968	GE	On-Demand	Anodyne	MAPK1	56	36
O=C(COc1ccccc1)N1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508968	GE	On-Demand	Anodyne	MAPK9	47	36
O=C(COc1ccccc1)N1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508968	GE	On-Demand	Anodyne	MAPK10	24	49
O=C(COc1ccccc1)N1CC[C@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508968	GE	On-Demand	Anodyne	MAPK8	44	49
O=C(COc1ccccc1)N1CC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508969	GE	On-Demand	Anodyne	COLA	133	45
O=C(COc1ccccc1)N1CC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508969	GE	On-Demand	Anodyne	CPT1A	119	45
O=C(COc1ccccc1)N1CC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508969	GE	On-Demand	Anodyne	CPT2	46	38
O=C(COc1ccccc1)N1CC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508969	GE	On-Demand	Anodyne	MAPK1	56	36
O=C(COc1ccccc1)N1CC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508969	GE	On-Demand	Anodyne	MAPK9	47	36
O=C(COc1ccccc1)N1CC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508969	GE	On-Demand	Anodyne	MAPK10	24	49
O=C(COc1ccccc1)N1CC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450508969	GE	On-Demand	Anodyne	MAPK8	44	49
CCc1ccc2nccc(N3CCC[C@@H](CNC(=O)c4ccco4)C3)c2c1	ZINC000450508973	FI	On-Demand	Anodyne	CCR3	18	43
CCc1ccc2nccc(N3CCC[C@@H](CNC(=O)c4ccco4)C3)c2c1	ZINC000450508973	FI	On-Demand	Anodyne	ALK	15	41
CCc1ccc2nccc(N3CCC[C@H](CNC(=O)c4ccco4)C3)c2c1	ZINC000450508974	FI	On-Demand	Anodyne	CCR3	18	43
CCc1ccc2nccc(N3CCC[C@H](CNC(=O)c4ccco4)C3)c2c1	ZINC000450508974	FI	On-Demand	Anodyne	ALK	15	41
CC(C)c1occc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450508979	CG	On-Demand	Anodyne	MMP13	16	40
CO[C@@H](Cc1ccccc1)CN1CCc2cc(S(N)(=O)=O)ccc21	ZINC000450508995	ED	On-Demand	Anodyne	CA7	39	42
CO[C@H](Cc1ccccc1)CN1CCc2cc(S(N)(=O)=O)ccc21	ZINC000450508996	ED	On-Demand	Anodyne	CA7	39	42
N#Cc1cc(Br)cnc1N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000450508998	GG	On-Demand	Mild	PREP	43	36
N#Cc1cc(Br)cnc1N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000450508998	GG	On-Demand	Mild	BIRC2	20	45
N#Cc1cc(Br)cnc1N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000450508998	GG	On-Demand	Mild	GPR183	0	42
N#Cc1cc(Br)cnc1N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000450508999	GG	On-Demand	Mild	PREP	43	36
N#Cc1cc(Br)cnc1N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000450508999	GG	On-Demand	Mild	BIRC2	20	45
N#Cc1cc(Br)cnc1N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000450508999	GG	On-Demand	Mild	GPR183	0	42
NS(=O)(=O)c1ccc2c(c1)CCN2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450509000	DD	On-Demand	Anodyne	CA7	18	41
NS(=O)(=O)c1ccc2c(c1)CCN2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450509001	DD	On-Demand	Anodyne	CA7	18	41
C[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509002	CD	On-Demand	Anodyne	SDH1	0	41
C[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509003	CD	On-Demand	Anodyne	SDH1	0	41
CC(C)N1CCN(C(=O)c2cc(Br)c(F)cc2O)CC1=O	ZINC000450509008	FD	On-Demand	Anodyne	P2RX7	15	50
O=S(=O)(NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccccc1	ZINC000450509021	FD	On-Demand	Anodyne	CCR8	49	32
O=S(=O)(NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccccc1	ZINC000450509021	FD	On-Demand	Anodyne	SFRP1	129	40
O=S(=O)(NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccccc1	ZINC000450509021	FD	On-Demand	Anodyne	WNT3	86	37
O=S(=O)(NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccccc1	ZINC000450509022	FD	On-Demand	Anodyne	CCR8	49	32
O=S(=O)(NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccccc1	ZINC000450509022	FD	On-Demand	Anodyne	SFRP1	129	40
O=S(=O)(NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccccc1	ZINC000450509022	FD	On-Demand	Anodyne	WNT3	86	37
Cc1cc(OCC(=O)O)ccc1NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450509057	FG	On-Demand	Anodyne	PPARD	43	39
C[C@@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509067	DH	On-Demand	Anodyne	FOLH1	22	40
C[C@@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509067	DH	On-Demand	Anodyne	TRY2_BOVIN	57	39
C[C@@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509067	DH	On-Demand	Anodyne	FURIN	42	33
C[C@@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509067	DH	On-Demand	Anodyne	AKR1C3	36	42
C[C@@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509067	DH	On-Demand	Anodyne	PDS	55	38
C[C@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509068	DH	On-Demand	Anodyne	FOLH1	22	40
C[C@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509068	DH	On-Demand	Anodyne	TRY2_BOVIN	47	34
C[C@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509068	DH	On-Demand	Anodyne	AKR1C3	36	42
C[C@H](CCC(=O)NCc1cccc(C(=O)O)c1)c1ccccc1	ZINC000450509068	DH	On-Demand	Anodyne	PDS	45	35
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)c1	ZINC000450509073	EE	On-Demand	Anodyne	ACHE	25	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)c1	ZINC000450509073	EE	On-Demand	Anodyne	CHRM3	19	45
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)c1	ZINC000450509073	EE	On-Demand	Anodyne	CCR3	39	41
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)c1	ZINC000450509073	EE	On-Demand	Anodyne	HSP90AA1	20	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)c1	ZINC000450509073	EE	On-Demand	Anodyne	CACNA1G	27	41
CN(CC(=O)N1CCC(C(=O)O)CC1)C(=O)C1(Oc2ccccc2F)CC1	ZINC000450509078	GD	On-Demand	Anodyne	SLC6A1	53	36
CCc1cc(CCCN2CCN(Cc3nc(O)c4ccccc4n3)CC2)on1	ZINC000450509091	GF	On-Demand	Anodyne	HTR7	17	51
CCc1cc(CCCN2CCN(Cc3nc(O)c4ccccc4n3)CC2)on1	ZINC000450509091	GF	On-Demand	Anodyne	HNMT	46	31
CC(=O)c1nc(N[C@H]2CCN(C(=O)COc3ccccc3)C2)sc1C	ZINC000450509099	FE	On-Demand	Anodyne	COLA	133	41
CC(=O)c1nc(N[C@H]2CCN(C(=O)COc3ccccc3)C2)sc1C	ZINC000450509099	FE	On-Demand	Anodyne	CPT1A	119	41
CC(=O)c1nc(N[C@H]2CCN(C(=O)COc3ccccc3)C2)sc1C	ZINC000450509099	FE	On-Demand	Anodyne	CPT2	43	37
CC(=O)c1nc(N[C@@H]2CCN(C(=O)COc3ccccc3)C2)sc1C	ZINC000450509100	FE	On-Demand	Anodyne	COLA	133	41
CC(=O)c1nc(N[C@@H]2CCN(C(=O)COc3ccccc3)C2)sc1C	ZINC000450509100	FE	On-Demand	Anodyne	CPT1A	119	41
CC(=O)c1nc(N[C@@H]2CCN(C(=O)COc3ccccc3)C2)sc1C	ZINC000450509100	FE	On-Demand	Anodyne	CPT2	43	37
CC[C@@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450509114	DF	On-Demand	Anodyne	AVPR1A	33	40
CC[C@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450509115	DF	On-Demand	Anodyne	AVPR1A	33	40
CCOc1ccc(CNc2ncc(C(F)F)cn2)cc1Cl	ZINC000450509119	DH	On-Demand	Anodyne	PDE5A	37	46
CCOc1ccc(CNc2ncc(C(F)F)cn2)cc1Cl	ZINC000450509119	DH	On-Demand	Anodyne	PDE6A	44	34
Cc1cc2c(cc1C)[C@@H](C(=O)NCc1cccc(C(=O)O)c1)CO2	ZINC000450509130	EF	On-Demand	Anodyne	FFAR1	41	35
Cc1cc2c(cc1C)[C@H](C(=O)NCc1cccc(C(=O)O)c1)CO2	ZINC000450509131	EF	On-Demand	Anodyne	FFAR1	41	35
CCC(CC)(C(=O)NCc1cccc(C(=O)O)c1)c1ccc(OC)c(OC)c1	ZINC000450509133	GH	On-Demand	Anodyne	PPARA	22	41
CCC(CC)(C(=O)NCc1cccc(C(=O)O)c1)c1ccc(OC)c(OC)c1	ZINC000450509133	GH	On-Demand	Anodyne	PPARD	23	41
CCC(CC)(C(=O)NCc1cccc(C(=O)O)c1)c1ccc(OC)c(OC)c1	ZINC000450509133	GH	On-Demand	Anodyne	MT-ND1	27	46
CCC(CC)(C(=O)NCc1cccc(C(=O)O)c1)c1ccc(OC)c(OC)c1	ZINC000450509133	GH	On-Demand	Anodyne	DRTS_TRYCR	43	30
CCC(CC)(C(=O)NCc1cccc(C(=O)O)c1)c1ccc(OC)c(OC)c1	ZINC000450509133	GH	On-Demand	Anodyne	PDS	41	33
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccccc1	ZINC000450509142	FH	On-Demand	Anodyne	SIGMAR1	17	40
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccccc1	ZINC000450509142	FH	On-Demand	Anodyne	HTR6	18	46
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccccc1	ZINC000450509142	FH	On-Demand	Anodyne	CCR8	42	33
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccccc1	ZINC000450509142	FH	On-Demand	Anodyne	SFRP1	107	45
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccccc1	ZINC000450509142	FH	On-Demand	Anodyne	WNT3	82	40
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccccc1	ZINC000450509143	FH	On-Demand	Anodyne	SIGMAR1	17	40
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccccc1	ZINC000450509143	FH	On-Demand	Anodyne	HTR6	18	46
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccccc1	ZINC000450509143	FH	On-Demand	Anodyne	CCR8	42	33
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccccc1	ZINC000450509143	FH	On-Demand	Anodyne	SFRP1	107	45
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccccc1	ZINC000450509143	FH	On-Demand	Anodyne	WNT3	82	40
Cc1ccn(CC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)n1	ZINC000450509150	CF	On-Demand	Anodyne	PREP	46	35
Cc1ccn(CC(=O)N2CCC[C@H]2/C=C/c2ccccc2)n1	ZINC000450509151	CF	On-Demand	Anodyne	PREP	46	35
Cc1ccn(CC(=O)N2CCC[C@H]2/C=C\c2ccccc2)n1	ZINC000450509152	CF	On-Demand	Anodyne	PREP	46	35
Cc1ccn(CC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)n1	ZINC000450509153	CF	On-Demand	Anodyne	PREP	46	35
COc1ccc([C@@H](NC(=O)c2cc(C)cs2)C(F)(F)F)cc1	ZINC000450509158	EI	On-Demand	Anodyne	CTSK	17	42
COc1ccc([C@@H](NC(=O)c2cc(C)cs2)C(F)(F)F)cc1	ZINC000450509158	EI	On-Demand	Anodyne	CTSL	22	42
COc1ccc([C@@H](NC(=O)c2cc(C)cs2)C(F)(F)F)cc1	ZINC000450509158	EI	On-Demand	Anodyne	CTSS	16	42
COc1ccc([C@H](NC(=O)c2cc(C)cs2)C(F)(F)F)cc1	ZINC000450509159	EI	On-Demand	Anodyne	CTSK	17	42
COc1ccc([C@H](NC(=O)c2cc(C)cs2)C(F)(F)F)cc1	ZINC000450509159	EI	On-Demand	Anodyne	CTSL	22	42
COc1ccc([C@H](NC(=O)c2cc(C)cs2)C(F)(F)F)cc1	ZINC000450509159	EI	On-Demand	Anodyne	CTSS	16	42
COc1ccc(CNC(=O)CCNC2(c3ccccc3)CCC2)c(OC)c1	ZINC000450509175	FG	On-Demand	Anodyne	TACR3	0	40
COc1ccc(CNC(=O)CCNC2(c3ccccc3)CCC2)c(OC)c1	ZINC000450509175	FG	On-Demand	Anodyne	MTNR1A	65	39
COc1ccc(CNC(=O)CCNC2(c3ccccc3)CCC2)c(OC)c1	ZINC000450509175	FG	On-Demand	Anodyne	MTNR1B	63	39
COc1ccc(CNC(=O)CCNC2(c3ccccc3)CCC2)c(OC)c1	ZINC000450509175	FG	On-Demand	Anodyne	ACAT	0	44
Cc1cnc(CCCC(=O)N2CCC[C@H]2/C=C/c2ccccc2)o1	ZINC000450509176	DI	On-Demand	Anodyne	COLA	48	33
Cc1cnc(CCCC(=O)N2CCC[C@H]2/C=C/c2ccccc2)o1	ZINC000450509176	DI	On-Demand	Anodyne	CPT1A	44	33
Cc1cnc(CCCC(=O)N2CCC[C@H]2/C=C/c2ccccc2)o1	ZINC000450509176	DI	On-Demand	Anodyne	PREP	91	48
Cc1cnc(CCCC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)o1	ZINC000450509177	DI	On-Demand	Anodyne	COLA	48	33
Cc1cnc(CCCC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)o1	ZINC000450509177	DI	On-Demand	Anodyne	CPT1A	44	33
Cc1cnc(CCCC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)o1	ZINC000450509177	DI	On-Demand	Anodyne	PREP	82	48
Cc1cnc(CCCC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)o1	ZINC000450509178	DI	On-Demand	Anodyne	COLA	48	33
Cc1cnc(CCCC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)o1	ZINC000450509178	DI	On-Demand	Anodyne	CPT1A	44	33
Cc1cnc(CCCC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)o1	ZINC000450509178	DI	On-Demand	Anodyne	PREP	82	48
Cc1cnc(CCCC(=O)N2CCC[C@H]2/C=C\c2ccccc2)o1	ZINC000450509179	DI	On-Demand	Anodyne	COLA	48	33
Cc1cnc(CCCC(=O)N2CCC[C@H]2/C=C\c2ccccc2)o1	ZINC000450509179	DI	On-Demand	Anodyne	CPT1A	44	33
Cc1cnc(CCCC(=O)N2CCC[C@H]2/C=C\c2ccccc2)o1	ZINC000450509179	DI	On-Demand	Anodyne	PREP	91	48
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	HTR1A	18	47
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	DRD2	29	47
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	HRH2	22	46
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	ADRA1D	15	40
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	ADRA1A	20	40
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	ADRA1B	25	40
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	HTR7	44	43
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	CCR3	15	47
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	CCR5	44	39
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	HTR6	22	47
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	CCR8	82	39
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	CYP2J2	55	39
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	SFRP1	110	50
CCC(=O)CCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509198	EE	On-Demand	Anodyne	WNT3	84	39
CN1CCC[C@@H](C(=O)N[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)C1=O	ZINC000450509221	GG	On-Demand	Anodyne	RBP4	41	35
CN1CCC[C@@H](C(=O)N[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)C1=O	ZINC000450509222	GG	On-Demand	Anodyne	RBP4	41	35
CN1CCC[C@H](C(=O)N[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)C1=O	ZINC000450509223	GG	On-Demand	Anodyne	RBP4	41	35
CN1CCC[C@H](C(=O)N[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)C1=O	ZINC000450509224	GG	On-Demand	Anodyne	RBP4	41	35
COc1ccc(C(=O)NC2CCC(C(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450509232	FG	On-Demand	Anodyne	PDE4D	17	44
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	DRD2	24	50
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	ADRA1D	19	41
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	ADRA1B	25	41
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	HTR7	33	50
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	SIGMAR1	55	44
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	NPY2R	40	44
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	CCR3	20	54
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	CCR5	53	40
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	HTR6	29	50
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	TGM2	15	40
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	CCR8	84	36
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	SFRP1	126	43
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	LIMK2	42	36
CN(CCN1CCC(NS(=O)(=O)c2ccccc2)CC1)Cc1ccccc1	ZINC000450509234	GF	On-Demand	Anodyne	WNT3	85	40
Cc1nc(N[C@H](C)CCNS(=O)(=O)c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450509235	FD	On-Demand	Bother	COLA	46	33
Cc1nc(N[C@@H](C)CCNS(=O)(=O)c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450509236	FD	On-Demand	Bother	COLA	46	33
CCOCc1nc(C)c(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)s1	ZINC000450509237	FI	On-Demand	Anodyne	PREP	42	36
CCOCc1nc(C)c(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)s1	ZINC000450509238	FI	On-Demand	Anodyne	PREP	42	36
CCOCc1nc(C)c(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)s1	ZINC000450509239	FI	On-Demand	Anodyne	PREP	42	36
CCOCc1nc(C)c(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)s1	ZINC000450509240	FI	On-Demand	Anodyne	PREP	42	36
CC1(O)CC(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)C1	ZINC000450509246	CF	On-Demand	Anodyne	PREP	51	42
CC1(O)CC(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)C1	ZINC000450509246	CF	On-Demand	Anodyne	SFRP1	40	34
CC1(O)CC(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)C1	ZINC000450509246	CF	On-Demand	Anodyne	WNT3	46	34
CC1(O)CC(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)C1	ZINC000450509247	CF	On-Demand	Anodyne	PREP	51	42
CC1(O)CC(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)C1	ZINC000450509247	CF	On-Demand	Anodyne	SFRP1	40	34
CC1(O)CC(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)C1	ZINC000450509247	CF	On-Demand	Anodyne	WNT3	46	34
CC1(O)CC(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)C1	ZINC000450509248	CF	On-Demand	Anodyne	PREP	51	42
CC1(O)CC(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)C1	ZINC000450509248	CF	On-Demand	Anodyne	SFRP1	40	34
CC1(O)CC(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)C1	ZINC000450509248	CF	On-Demand	Anodyne	WNT3	46	34
CC1(O)CC(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)C1	ZINC000450509249	CF	On-Demand	Anodyne	PREP	51	42
CC1(O)CC(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)C1	ZINC000450509249	CF	On-Demand	Anodyne	SFRP1	40	34
CC1(O)CC(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)C1	ZINC000450509249	CF	On-Demand	Anodyne	WNT3	46	34
CN1[C@H]2CC[C@H]1CC([C@@H](Nc1ncc(C(F)F)cn1)c1ccc(Cl)cc1)C2	ZINC000450509260	GK	On-Demand	Anodyne	SLC6A3	32	47
CN1[C@H]2CC[C@H]1CC([C@H](Nc1ncc(C(F)F)cn1)c1ccc(Cl)cc1)C2	ZINC000450509261	GK	On-Demand	Anodyne	SLC6A3	32	47
CC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509265	CD	On-Demand	Anodyne	MME	46	38
CC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509265	CD	On-Demand	Anodyne	CXCL8	17	40
CC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509265	CD	On-Demand	Anodyne	SDH1	0	40
CC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509265	CD	On-Demand	Anodyne	TIMP3	62	35
CC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509265	CD	On-Demand	Anodyne	ECE1	40	38
CC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509265	CD	On-Demand	Anodyne	ACE2	75	36
CC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509265	CD	On-Demand	Anodyne	NPPA	54	34
CC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509266	CD	On-Demand	Anodyne	MME	46	38
CC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509266	CD	On-Demand	Anodyne	CXCL8	17	40
CC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509266	CD	On-Demand	Anodyne	SDH1	0	40
CC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509266	CD	On-Demand	Anodyne	TIMP3	62	35
CC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509266	CD	On-Demand	Anodyne	ECE1	40	38
CC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509266	CD	On-Demand	Anodyne	ACE2	75	36
CC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509266	CD	On-Demand	Anodyne	NPPA	54	34
COc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC(C(=O)O)CC2)cc1OC	ZINC000450509283	GD	On-Demand	Anodyne	HTR4	73	39
COc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC(C(=O)O)CC2)cc1OC	ZINC000450509283	GD	On-Demand	Anodyne	FDFT1	28	40
NC(=O)CCN(Cc1ccccc1)Cc1cn(CC2CC2)nn1	ZINC000450509287	DD	On-Demand	Anodyne	HSP90AB1	18	41
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	DRD2	26	55
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	ADRA1D	25	47
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	ADRA1A	22	47
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	ADRA1B	38	47
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	HTR7	27	45
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	CCR5	70	46
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	HTR6	25	55
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	CCR8	43	35
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	BIRC2	42	38
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	SFRP1	110	44
C[C@@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509292	DD	On-Demand	Anodyne	WNT3	85	41
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	DRD2	26	55
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	ADRA1D	25	47
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	ADRA1A	22	47
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	ADRA1B	38	47
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	HTR7	27	45
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	CCR5	70	46
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	HTR6	25	55
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	CCR8	43	35
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	BIRC2	42	38
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	SFRP1	110	44
C[C@H](O)CCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509293	DD	On-Demand	Anodyne	WNT3	85	41
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450509306	EI	On-Demand	Anodyne	SFRP1	95	35
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450509306	EI	On-Demand	Anodyne	WNT3	66	34
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450509307	EI	On-Demand	Anodyne	SFRP1	95	35
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450509307	EI	On-Demand	Anodyne	WNT3	66	34
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450509308	EI	On-Demand	Anodyne	SFRP1	95	35
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450509308	EI	On-Demand	Anodyne	WNT3	66	34
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450509309	EI	On-Demand	Anodyne	SFRP1	95	35
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450509309	EI	On-Demand	Anodyne	WNT3	66	34
CC(C)(C)Oc1cc(F)ccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450509310	GJ	On-Demand	Anodyne	F10	34	45
CS(=O)(=O)c1cc(CNc2ncc(C(F)F)cn2)cc(C(F)(F)F)c1	ZINC000450509315	GF	On-Demand	Anodyne	PTGS2	15	43
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	DRD2	16	40
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	HTR2A	15	40
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	LTA4H	22	43
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	CASR	50	50
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	SIGMAR1	42	42
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	CCR3	41	34
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	CCR5	41	41
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	TACR3	47	34
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	HSP90AA1	16	41
Cc1cc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)no1	ZINC000450509316	FE	On-Demand	Anodyne	CACNA1G	43	40
COc1cc(CN2CCc3cc(S(N)(=O)=O)ccc32)ccc1Cl	ZINC000450509324	FF	On-Demand	Anodyne	CA7	38	41
O=C(O)c1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450509328	FH	On-Demand	Anodyne	TACR1	19	56
O=C(O)c1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450509328	FH	On-Demand	Anodyne	PTGER4	15	40
O=C(O)c1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450509328	FH	On-Demand	Anodyne	CCR2	55	38
O=C(O)c1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450509328	FH	On-Demand	Anodyne	PTGDR	0	40
O=C(O)c1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450509328	FH	On-Demand	Anodyne	AKR1C3	25	43
O=C(O)c1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450509328	FH	On-Demand	Anodyne	SETD7	0	40
O=C(O)c1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450509328	FH	On-Demand	Anodyne	CCL2	0	41
COc1ccc([C@H](NC(=O)c2cc(C#N)[nH]c2C)C(F)(F)F)cc1	ZINC000450509330	EG	On-Demand	Mild	CTSF	40	30
COc1ccc([C@@H](NC(=O)c2cc(C#N)[nH]c2C)C(F)(F)F)cc1	ZINC000450509331	EG	On-Demand	Mild	CTSF	40	30
CN(C)c1nc(N2CCC[C@@H](CNC(=O)c3ccco3)C2)nc2ccccc12	ZINC000450509332	GF	On-Demand	Anodyne	ADRA2A	0	40
CN(C)c1nc(N2CCC[C@H](CNC(=O)c3ccco3)C2)nc2ccccc12	ZINC000450509333	GF	On-Demand	Anodyne	ADRA2A	0	40
CC(C)(C)Oc1cc(F)ccc1NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450509334	GI	On-Demand	Anodyne	THYX_PBCV1	0	41
Cc1ccn2ncc(C(=O)N(C)CCN(C(C)C)C(C)C)c2c1	ZINC000450509335	DF	On-Demand	Anodyne	EPHB3	20	44
N#Cc1ccnc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509336	DD	On-Demand	Mild	MAPK9	35	40
N#Cc1ccnc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509336	DD	On-Demand	Mild	MAPK10	0	41
N#Cc1ccnc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509336	DD	On-Demand	Mild	MAPK8	33	40
N#Cc1ccnc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509337	DD	On-Demand	Mild	MAPK9	35	40
N#Cc1ccnc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509337	DD	On-Demand	Mild	MAPK10	0	41
N#Cc1ccnc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509337	DD	On-Demand	Mild	MAPK8	33	40
CC[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1CC(F)F	ZINC000450509352	GF	On-Demand	Anodyne	EPHX2	22	50
CC[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1CC(F)F	ZINC000450509353	GF	On-Demand	Anodyne	EPHX2	22	50
CC(C)N1CCN(C(=O)c2ccc(I)cc2F)CC1=O	ZINC000450509354	GE	On-Demand	Anodyne	P2RX7	25	54
COC(=O)c1csc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)n1	ZINC000450509357	GD	On-Demand	Anodyne	SIGMAR1	23	40
COC(=O)c1csc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)n1	ZINC000450509357	GD	On-Demand	Anodyne	SSTR5	38	41
COC(=O)c1csc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)n1	ZINC000450509357	GD	On-Demand	Anodyne	CCR3	15	49
COC(=O)c1csc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)n1	ZINC000450509357	GD	On-Demand	Anodyne	HTR6	15	42
COC(=O)c1csc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)n1	ZINC000450509357	GD	On-Demand	Anodyne	CCR8	74	36
COC(=O)c1csc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)n1	ZINC000450509357	GD	On-Demand	Anodyne	SFRP1	127	41
COC(=O)c1csc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)n1	ZINC000450509357	GD	On-Demand	Anodyne	WNT3	85	36
Oc1n[nH]c([C@@H]2CCCN(c3ncnc4cc(Br)ccc34)C2)n1	ZINC000450509359	GF	On-Demand	Anodyne	PDE3A	45	35
Oc1n[nH]c([C@@H]2CCCN(c3ncnc4cc(Br)ccc34)C2)n1	ZINC000450509359	GF	On-Demand	Anodyne	PDE3B	66	35
Oc1n[nH]c([C@H]2CCCN(c3ncnc4cc(Br)ccc34)C2)n1	ZINC000450509360	GF	On-Demand	Anodyne	PDE3A	45	35
Oc1n[nH]c([C@H]2CCCN(c3ncnc4cc(Br)ccc34)C2)n1	ZINC000450509360	GF	On-Demand	Anodyne	PDE3B	66	35
CN1CCC[C@H](C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)C1=O	ZINC000450509365	DF	On-Demand	Anodyne	PREP	74	42
CN1CCC[C@H](C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)C1=O	ZINC000450509365	DF	On-Demand	Anodyne	F1PEP1	0	40
CN1CCC[C@H](C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)C1=O	ZINC000450509366	DF	On-Demand	Anodyne	PREP	74	42
CN1CCC[C@H](C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)C1=O	ZINC000450509366	DF	On-Demand	Anodyne	F1PEP1	0	40
CN1CCC[C@H](C(=O)N2CCC[C@H]2/C=C/c2ccccc2)C1=O	ZINC000450509367	DF	On-Demand	Anodyne	PREP	74	42
CN1CCC[C@H](C(=O)N2CCC[C@H]2/C=C/c2ccccc2)C1=O	ZINC000450509367	DF	On-Demand	Anodyne	F1PEP1	0	40
CN1CCC[C@H](C(=O)N2CCC[C@H]2/C=C\c2ccccc2)C1=O	ZINC000450509368	DF	On-Demand	Anodyne	PREP	74	42
CN1CCC[C@H](C(=O)N2CCC[C@H]2/C=C\c2ccccc2)C1=O	ZINC000450509368	DF	On-Demand	Anodyne	F1PEP1	0	40
CCC[C@H](OC)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450509400	CH	On-Demand	Anodyne	ACE	33	42
CCC[C@H](OC)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450509401	CH	On-Demand	Anodyne	ACE	44	42
CCC[C@H](OC)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450509401	CH	On-Demand	Anodyne	ACKR3	44	36
CCC[C@H](OC)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450509402	CH	On-Demand	Anodyne	ACE	33	42
CCC[C@H](OC)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450509403	CH	On-Demand	Anodyne	ACE	33	42
Cc1cccc(Cl)c1CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509413	GH	On-Demand	Anodyne	DRD2	20	42
Cc1cccc(Cl)c1CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509413	GH	On-Demand	Anodyne	HTR7	15	42
Cc1cccc(Cl)c1CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509413	GH	On-Demand	Anodyne	SIGMAR1	25	48
Cc1cccc(Cl)c1CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509413	GH	On-Demand	Anodyne	HTR6	21	42
Cc1cccc(Cl)c1CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509413	GH	On-Demand	Anodyne	CCR8	88	37
Cc1cccc(Cl)c1CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509413	GH	On-Demand	Anodyne	SFRP1	134	42
Cc1cccc(Cl)c1CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509413	GH	On-Demand	Anodyne	WNT3	89	37
COc1cccc(-n2cc(C(=O)N(C)CCN(C(C)C)C(C)C)nn2)c1	ZINC000450509414	FE	On-Demand	Anodyne	ESRRA	24	42
CNC(=O)NC1CN(c2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000450509420	ED	On-Demand	Anodyne	PPIA	41	32
Cn1c(C#N)ccc1C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450509423	DG	On-Demand	Mild	PREP	42	36
Cn1c(C#N)ccc1C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450509424	DG	On-Demand	Mild	PREP	42	36
Cn1c(C#N)ccc1C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450509425	DG	On-Demand	Mild	PREP	42	36
Cn1c(C#N)ccc1C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450509426	DG	On-Demand	Mild	PREP	42	36
C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509433	CD	On-Demand	Anodyne	P2RX7	48	37
C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509433	CD	On-Demand	Anodyne	KMO	0	40
C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509433	CD	On-Demand	Anodyne	NCE103	28	42
C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509433	CD	On-Demand	Anodyne	PFK	0	40
C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509433	CD	On-Demand	Anodyne	P96878_MYCTU	19	42
C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509433	CD	On-Demand	Anodyne	CAN2	0	42
C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509434	CD	On-Demand	Anodyne	P2RX7	48	37
C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509434	CD	On-Demand	Anodyne	KMO	0	40
C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509434	CD	On-Demand	Anodyne	NCE103	28	42
C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509434	CD	On-Demand	Anodyne	PFK	0	40
C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509434	CD	On-Demand	Anodyne	P96878_MYCTU	19	42
C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509434	CD	On-Demand	Anodyne	CAN2	0	42
O=C(O)c1cccc(CNC(=O)c2cc(C3CC3)no2)c1	ZINC000450509439	CE	On-Demand	Anodyne	MMP13	18	41
COc1ccc2c(c1)C[C@H](C(=O)Nc1cc(C)c(C)c(C(=O)O)c1)CO2	ZINC000450509441	FG	On-Demand	Anodyne	ROCK2	36	58
COc1ccc2c(c1)C[C@H](C(=O)Nc1cc(C)c(C)c(C(=O)O)c1)CO2	ZINC000450509441	FG	On-Demand	Anodyne	CDC42BPA	0	46
COc1ccc2c(c1)C[C@H](C(=O)Nc1cc(C)c(C)c(C(=O)O)c1)CO2	ZINC000450509441	FG	On-Demand	Anodyne	AKR1C2	53	39
COc1ccc2c(c1)C[C@@H](C(=O)Nc1cc(C)c(C)c(C(=O)O)c1)CO2	ZINC000450509442	FG	On-Demand	Anodyne	ROCK2	36	58
COc1ccc2c(c1)C[C@@H](C(=O)Nc1cc(C)c(C)c(C(=O)O)c1)CO2	ZINC000450509442	FG	On-Demand	Anodyne	CDC42BPA	0	46
COc1ccc2c(c1)C[C@@H](C(=O)Nc1cc(C)c(C)c(C(=O)O)c1)CO2	ZINC000450509442	FG	On-Demand	Anodyne	AKR1C2	53	39
Cc1nn(-c2ccccc2)cc1NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450509476	FH	On-Demand	Anodyne	ANPEP	30	40
Cc1nn(-c2ccccc2)cc1NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450509476	FH	On-Demand	Anodyne	CAPN1	32	41
Cc1nn(-c2ccccc2)cc1NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450509476	FH	On-Demand	Anodyne	FPR1	57	34
CCCc1occc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450509478	DF	On-Demand	Anodyne	U38	0	44
Fc1ccc2c(C3=CCN(Cc4nnc(C5CC5)s4)CC3)c[nH]c2c1	ZINC000450509481	FI	On-Demand	Anodyne	HTR1D	0	48
Fc1ccc2c(C3=CCN(Cc4nnc(C5CC5)s4)CC3)c[nH]c2c1	ZINC000450509481	FI	On-Demand	Anodyne	SLC6A4	24	49
CO[C@H]1C[C@@H](C(N)=O)N(c2ncnc3cc(Br)ccc23)C1	ZINC000450509482	FD	On-Demand	Anodyne	PDE3B	51	32
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C)n(C(C)C)n1	ZINC000450509483	EF	On-Demand	Anodyne	CARM1	50	33
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	CHRM1	17	43
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	DRD4	22	56
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	CHRM3	29	43
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	SIGMAR1	31	51
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	SSTR5	53	39
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	CCR3	92	52
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	MLNR	52	41
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	EPHX2	67	53
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	CXCR3	26	47
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	MCHR1	39	43
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450509498	GI	On-Demand	Anodyne	CACNA1G	34	42
CCc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450509506	FG	On-Demand	Anodyne	PPARA	18	44
CCc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450509507	FG	On-Demand	Anodyne	PPARA	18	44
O=S(=O)(NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccc(F)cc1	ZINC000450509508	FE	On-Demand	Anodyne	SFRP1	73	35
O=S(=O)(NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccc(F)cc1	ZINC000450509508	FE	On-Demand	Anodyne	WNT3	55	32
O=S(=O)(NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccc(F)cc1	ZINC000450509509	FE	On-Demand	Anodyne	SFRP1	73	35
O=S(=O)(NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1)c1ccc(F)cc1	ZINC000450509509	FE	On-Demand	Anodyne	WNT3	55	32
CC[C@@H]1C[C@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509511	CD	On-Demand	Anodyne	OPRM1	33	42
CC[C@@H]1C[C@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509511	CD	On-Demand	Anodyne	GRIA1	40	35
CC[C@@H]1C[C@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509511	CD	On-Demand	Anodyne	YARS	64	37
CC[C@@H]1C[C@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509511	CD	On-Demand	Anodyne	SLC15A2	0	41
CC[C@@H]1C[C@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509511	CD	On-Demand	Anodyne	PCNA	0	40
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cnn2ccc(C)cc12	ZINC000450509512	FF	On-Demand	Anodyne	EPHB3	32	45
COc1cc(Cl)c(C(=O)NC2(C(=O)O)CC2)cc1OC	ZINC000450509515	CD	On-Demand	Anodyne	HTR4	42	35
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccc(Cl)cc1	ZINC000450509517	EC	On-Demand	Anodyne	UTS2	46	36
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccc(Cl)cc1	ZINC000450509518	EC	On-Demand	Anodyne	UTS2	46	36
O=C(Cc1ccccc1O[C@H]1CCOC1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509529	FD	On-Demand	Anodyne	TIMP3	47	31
O=C(Cc1ccccc1O[C@H]1CCOC1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509529	FD	On-Demand	Anodyne	YARS	62	35
O=C(Cc1ccccc1O[C@@H]1CCOC1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509530	FD	On-Demand	Anodyne	TIMP3	47	31
O=C(Cc1ccccc1O[C@@H]1CCOC1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509530	FD	On-Demand	Anodyne	YARS	62	35
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCNC(=O)CC3)CC2)cc1	ZINC000450509531	ED	On-Demand	Anodyne	SLC6A7	0	41
Cc1ccc(C(=O)N2CCN(C[C@H]3CCNC(=O)CC3)CC2)cc1	ZINC000450509532	ED	On-Demand	Anodyne	SLC6A7	0	41
COc1cc(CNC(=O)C[C@@H](C)SC)ccc1C(=O)O	ZINC000450509537	CE	On-Demand	Anodyne	TRPV1	25	46
COc1cc(CNC(=O)C[C@H](C)SC)ccc1C(=O)O	ZINC000450509538	CE	On-Demand	Anodyne	TRPV1	25	46
Cc1ccccc1C(=O)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450509545	EF	On-Demand	Anodyne	DRD4	20	49
Cc1ccccc1C(=O)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450509545	EF	On-Demand	Anodyne	SIGMAR1	17	43
Cc1ccccc1C(=O)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450509545	EF	On-Demand	Anodyne	CCR8	66	36
Cc1ccccc1C(=O)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450509546	EF	On-Demand	Anodyne	DRD4	20	49
Cc1ccccc1C(=O)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450509546	EF	On-Demand	Anodyne	SIGMAR1	17	43
Cc1ccccc1C(=O)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450509546	EF	On-Demand	Anodyne	CCR8	66	36
NC(=O)c1ccc(S(=O)(=O)N2CCN(C[C@H](O)Cc3ccccc3)CC2)o1	ZINC000450509551	GC	On-Demand	Anodyne	VACHT_TETCF	0	46
NC(=O)c1ccc(S(=O)(=O)N2CCN(C[C@H](O)Cc3ccccc3)CC2)o1	ZINC000450509551	GC	On-Demand	Anodyne	ABCB1	40	35
COC(=O)c1coc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450509556	GE	On-Demand	Anodyne	SIGMAR1	19	40
COC(=O)c1coc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450509556	GE	On-Demand	Anodyne	CCR3	91	44
COC(=O)c1coc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450509556	GE	On-Demand	Anodyne	EPHX2	51	42
COC(=O)c1coc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450509556	GE	On-Demand	Anodyne	CXCR3	24	40
COC(=O)c1coc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450509556	GE	On-Demand	Anodyne	MCHR1	30	44
COC(=O)c1coc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450509556	GE	On-Demand	Anodyne	CACNA1G	24	53
CC(C)(C(=O)N[C@H](CO)Cc1ccc(O)cc1)C1CCC1	ZINC000450509557	CE	On-Demand	Anodyne	OPRM1	30	41
CC(C)(C(=O)N[C@H](CO)Cc1ccc(O)cc1)C1CCC1	ZINC000450509557	CE	On-Demand	Anodyne	OPRD1	40	43
CC(C)(C(=O)N[C@H](CO)Cc1ccc(O)cc1)C1CCC1	ZINC000450509557	CE	On-Demand	Anodyne	YARS	67	38
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450509558	GD	On-Demand	Anodyne	CCR3	60	39
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450509559	GD	On-Demand	Anodyne	CCR3	60	39
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509562	FE	On-Demand	Anodyne	ACE	66	38
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509562	FE	On-Demand	Anodyne	NAAA	45	36
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509562	FE	On-Demand	Anodyne	BIRC2	47	35
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509563	FE	On-Demand	Anodyne	ACE	66	38
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509563	FE	On-Demand	Anodyne	NAAA	45	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509563	FE	On-Demand	Anodyne	BIRC2	47	35
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509564	FE	On-Demand	Anodyne	ACE	66	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509564	FE	On-Demand	Anodyne	NAAA	45	36
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509564	FE	On-Demand	Anodyne	BIRC2	47	35
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509565	FE	On-Demand	Anodyne	ACE	66	38
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509565	FE	On-Demand	Anodyne	NAAA	45	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450509565	FE	On-Demand	Anodyne	BIRC2	47	35
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CNS(C)(=O)=O)C1	ZINC000450509566	ED	On-Demand	Anodyne	OPRK1	0	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CNS(C)(=O)=O)C1	ZINC000450509567	ED	On-Demand	Anodyne	OPRK1	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CNS(C)(=O)=O)C1	ZINC000450509568	ED	On-Demand	Anodyne	OPRK1	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CNS(C)(=O)=O)C1	ZINC000450509569	ED	On-Demand	Anodyne	OPRK1	0	40
N#Cc1ccc(N2C[C@@H](C(=O)N3CCCc4cccc(O)c43)CC2=O)cc1Cl	ZINC000450509576	GG	On-Demand	Mild	NR3C2	28	40
N#Cc1ccc(N2C[C@H](C(=O)N3CCCc4cccc(O)c43)CC2=O)cc1Cl	ZINC000450509577	GG	On-Demand	Mild	NR3C2	28	40
CSc1cccc(C(=O)N2CCC(CC(=O)N(C)C)CC2)c1	ZINC000450509589	DF	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CCC(CC(=O)N(C)C)CC2)c1	ZINC000450509589	DF	On-Demand	Anodyne	L3MBTL3	43	42
NC(=O)c1ccc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450509591	EE	On-Demand	Anodyne	DRD4	29	51
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509592	FG	On-Demand	Anodyne	CCR2	28	40
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	DRD3	0	41
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	PPARG	17	42
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	PPARA	30	48
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	HTR4	27	48
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	FOLH1	18	43
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	MME	86	48
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	ANPEP	87	35
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	CPA1	65	40
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	KCNA3	42	45
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	PPARD	24	42
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	CAPN1	21	41
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	LAP3	50	34
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	ITGAV	25	42
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	CPA3	0	40
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509594	GG	On-Demand	Anodyne	HCRTR2	20	40
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	DRD3	0	41
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	PPARG	17	42
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	PPARA	30	48
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	HTR4	27	48
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	FOLH1	18	43
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	MME	86	48
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	ANPEP	87	35
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	CPA1	65	40
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	KCNA3	42	45
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	PPARD	24	42
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	CAPN1	21	41
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	LAP3	50	34
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	ITGAV	25	42
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	CPA3	0	40
COc1cc(Cl)c(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450509595	GG	On-Demand	Anodyne	HCRTR2	20	40
Cc1cc(-c2nc(C(=O)Nc3ccc(F)cc3OC(C)(C)C)co2)ccn1	ZINC000450509596	FJ	On-Demand	Anodyne	IRAK4	23	46
C[C@@H](O)CCN1c2ccc(S(N)(=O)=O)cc2C[C@H]1C	ZINC000450509598	CC	On-Demand	Anodyne	CA7	39	41
C[C@H](O)CCN1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C	ZINC000450509599	CC	On-Demand	Anodyne	CA7	39	41
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1CC[C@@H](C)O	ZINC000450509600	CC	On-Demand	Anodyne	CA7	39	41
C[C@H](O)CCN1c2ccc(S(N)(=O)=O)cc2C[C@H]1C	ZINC000450509601	CC	On-Demand	Anodyne	CA7	39	41
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	HTR1A	24	41
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	DRD2	37	43
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	DRD4	51	49
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	ACHE	37	43
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	HRH2	28	51
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	HRH1	24	48
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	DRD3	31	47
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	HTR4	20	44
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	F10	16	41
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	CHRM3	28	45
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	SIGMAR1	39	40
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	SSTR5	61	41
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	CCR3	62	43
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	MCHR1	43	43
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	CACNA1G	42	43
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450509609	FH	On-Demand	Anodyne	CCR8	36	48
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	ACE	44	42
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	FOLH1	24	44
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	MME	116	48
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	ANPEP	103	39
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	RNPEP	41	38
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	CPA1	96	48
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	TIMP3	60	35
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	NAALAD2	31	44
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	ACE2	74	35
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	LAP3	47	38
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	CPA3	0	48
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	POL	0	40
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	AMP1_PLAFQ	47	37
CC1(C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509619	CD	On-Demand	Anodyne	BLAIMP-1	0	41
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	ACE	44	42
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	FOLH1	24	44
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	MME	116	48
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	ANPEP	103	39
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	RNPEP	41	38
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	CPA1	96	48
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	TIMP3	60	35
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	NAALAD2	31	44
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	ACE2	74	35
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	LAP3	47	38
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	CPA3	0	48
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	POL	0	40
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	AMP1_PLAFQ	47	37
CC1(C(=O)NC[C@H](Cc2ccccc2)C(=O)O)CC1	ZINC000450509620	CD	On-Demand	Anodyne	BLAIMP-1	0	41
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450509621	EI	On-Demand	Anodyne	FKBP1A	38	41
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450509621	EI	On-Demand	Anodyne	PREP	72	46
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450509621	EI	On-Demand	Anodyne	FAP	0	40
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450509622	EI	On-Demand	Anodyne	FKBP1A	38	41
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450509622	EI	On-Demand	Anodyne	PREP	72	46
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450509622	EI	On-Demand	Anodyne	FAP	0	40
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450509623	EI	On-Demand	Anodyne	FKBP1A	38	41
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450509623	EI	On-Demand	Anodyne	PREP	72	46
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450509623	EI	On-Demand	Anodyne	FAP	0	40
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450509624	EI	On-Demand	Anodyne	FKBP1A	38	41
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450509624	EI	On-Demand	Anodyne	PREP	72	46
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450509624	EI	On-Demand	Anodyne	FAP	0	40
COc1cc(CN2CCC[C@H](CNS(C)(=O)=O)C2)ccc1Cl	ZINC000450509649	EE	On-Demand	Anodyne	AVPR1B	43	36
CCOC(=O)c1csc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509651	FE	On-Demand	Anodyne	F2	20	46
CCOC(=O)c1csc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509651	FE	On-Demand	Anodyne	P2RY12	139	37
CCOC(=O)c1csc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509651	FE	On-Demand	Anodyne	TRY1_BOVIN	28	46
CCOC(=O)c1csc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509651	FE	On-Demand	Anodyne	PREP	45	35
CCOC(=O)c1csc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509651	FE	On-Demand	Anodyne	BIRC2	24	45
CCOC(=O)c1csc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509651	FE	On-Demand	Anodyne	TRPC6	62	34
CCOC(=O)c1csc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509651	FE	On-Demand	Anodyne	TRPC3	48	34
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509652	FE	On-Demand	Anodyne	F2	20	46
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509652	FE	On-Demand	Anodyne	P2RY12	139	37
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509652	FE	On-Demand	Anodyne	TRY1_BOVIN	28	46
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509652	FE	On-Demand	Anodyne	PREP	45	35
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509652	FE	On-Demand	Anodyne	BIRC2	24	45
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509652	FE	On-Demand	Anodyne	TRPC6	62	34
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450509652	FE	On-Demand	Anodyne	TRPC3	48	34
COc1cc(CN2CCC[C@@H](CNS(C)(=O)=O)C2)ccc1Cl	ZINC000450509659	EE	On-Demand	Anodyne	AVPR1B	43	36
CCC(=O)CCCN1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1	ZINC000450509660	FC	On-Demand	Anodyne	CYP2J2	45	34
O=C(O)C[C@H](NC(=O)Cc1cccc(OCC(F)(F)F)c1)C1CCCCC1	ZINC000450509662	GH	On-Demand	Anodyne	CETP	0	40
O=C(O)C[C@H](NC(=O)Cc1cccc(OCC(F)(F)F)c1)C1CCCCC1	ZINC000450509662	GH	On-Demand	Anodyne	FAAH	17	41
O=C(O)C[C@H](NC(=O)Cc1cccc(OCC(F)(F)F)c1)C1CCCCC1	ZINC000450509662	GH	On-Demand	Anodyne	PDS	49	35
O=C(O)C[C@@H](NC(=O)Cc1cccc(OCC(F)(F)F)c1)C1CCCCC1	ZINC000450509672	GH	On-Demand	Anodyne	CETP	0	40
O=C(O)C[C@@H](NC(=O)Cc1cccc(OCC(F)(F)F)c1)C1CCCCC1	ZINC000450509672	GH	On-Demand	Anodyne	FAAH	17	41
O=C(O)C[C@@H](NC(=O)Cc1cccc(OCC(F)(F)F)c1)C1CCCCC1	ZINC000450509672	GH	On-Demand	Anodyne	PDS	49	35
COc1cc(C)c(C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450509673	FF	On-Demand	Anodyne	PPARA	22	42
COc1cc(C)c(C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450509673	FF	On-Demand	Anodyne	TRPV1	26	40
COc1cc(C)c(C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450509673	FF	On-Demand	Anodyne	MT-ND1	27	48
COc1cc(C)c(C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450509673	FF	On-Demand	Anodyne	U38	0	47
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	DRD2	19	46
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	DRD4	15	41
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	ADRA1D	30	44
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	ADRA1A	23	44
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	ADRA1B	37	44
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	HTR6	18	46
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	F13A1	15	41
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	CCR8	57	37
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	SFRP1	113	38
CO[C@@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509678	GF	On-Demand	Anodyne	WNT3	75	36
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	DRD2	19	46
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	DRD4	15	41
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	ADRA1D	30	44
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	ADRA1A	23	44
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	ADRA1B	37	44
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	HTR6	18	46
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	F13A1	15	41
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	CCR8	57	37
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	SFRP1	113	38
CO[C@H](Cc1ccccc1)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450509681	GF	On-Demand	Anodyne	WNT3	75	36
CCCC[C@H](C)C(=O)N[C@H](CC(=O)O)C1CCCCC1	ZINC000450509698	CG	On-Demand	Anodyne	HLA-DRB3	53	35
CCCC[C@H](C)C(=O)N[C@H](CC(=O)O)C1CCCCC1	ZINC000450509698	CG	On-Demand	Anodyne	NOD1	42	35
CCCC[C@H](C)C(=O)N[C@@H](CC(=O)O)C1CCCCC1	ZINC000450509699	CG	On-Demand	Anodyne	HLA-DRB3	53	35
CCCC[C@H](C)C(=O)N[C@@H](CC(=O)O)C1CCCCC1	ZINC000450509699	CG	On-Demand	Anodyne	NOD1	42	35
CCCC[C@@H](C)C(=O)N[C@@H](CC(=O)O)C1CCCCC1	ZINC000450509700	CG	On-Demand	Anodyne	HLA-DRB3	53	35
CCCC[C@@H](C)C(=O)N[C@@H](CC(=O)O)C1CCCCC1	ZINC000450509700	CG	On-Demand	Anodyne	NOD1	42	35
CCCC[C@@H](C)C(=O)N[C@H](CC(=O)O)C1CCCCC1	ZINC000450509701	CG	On-Demand	Anodyne	HLA-DRB3	53	35
CCCC[C@@H](C)C(=O)N[C@H](CC(=O)O)C1CCCCC1	ZINC000450509701	CG	On-Demand	Anodyne	NOD1	42	35
COc1cccc(OCCC(=O)N[C@H](C)c2ccon2)c1	ZINC000450509711	CE	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc(OCCC(=O)N[C@H](C)c2ccon2)c1	ZINC000450509711	CE	On-Demand	Anodyne	MTNR1B	33	41
COc1cccc(OCCC(=O)N[C@@H](C)c2ccon2)c1	ZINC000450509716	CE	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc(OCCC(=O)N[C@@H](C)c2ccon2)c1	ZINC000450509716	CE	On-Demand	Anodyne	MTNR1B	33	41
C[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509723	CD	On-Demand	Anodyne	CXCL8	17	40
C[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509723	CD	On-Demand	Anodyne	NPPA	44	32
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	CHRM2	16	42
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	DRD2	30	60
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	DRD4	50	54
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	ACHE	23	48
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	HRH1	22	49
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	DRD3	27	56
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	KCNH2	23	49
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	HTR4	56	48
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	CHRM3	20	42
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	SIGMAR1	39	51
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	SSTR5	92	49
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	NPY2R	15	44
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	CCR1	48	48
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	CCR3	150	55
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	CCR5	16	42
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	UTS2R	31	43
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	MLNR	66	42
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	MET	15	44
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	EPHX2	55	47
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	PDK1	51	39
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	CXCR3	48	44
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	ENV	42	32
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	MCHR1	76	55
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	CACNA1G	46	47
COc1cc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450509725	GI	On-Demand	Anodyne	CCR8	22	46
COc1cc(CNC(=O)[C@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509726	FH	On-Demand	Anodyne	ABCC8	21	46
COc1cc(CNC(=O)[C@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509726	FH	On-Demand	Anodyne	ADRB3	34	45
COc1cc(CNC(=O)[C@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509726	FH	On-Demand	Anodyne	MME	41	38
COc1cc(CNC(=O)[C@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509726	FH	On-Demand	Anodyne	ANPEP	37	40
COc1cc(CNC(=O)[C@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509726	FH	On-Demand	Anodyne	PTPRA	63	37
COc1cc(CNC(=O)[C@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509726	FH	On-Demand	Anodyne	ACE2	55	33
COc1cc(CNC(=O)[C@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509726	FH	On-Demand	Anodyne	AMP1_PLAFQ	48	38
COc1cc(CNC(=O)[C@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509726	FH	On-Demand	Anodyne	ACPS	0	41
C[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509727	CD	On-Demand	Anodyne	CXCL8	17	40
C[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450509727	CD	On-Demand	Anodyne	NPPA	44	32
COc1cc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509728	FH	On-Demand	Anodyne	ABCC8	21	46
COc1cc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509728	FH	On-Demand	Anodyne	ADRB3	34	45
COc1cc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509728	FH	On-Demand	Anodyne	MME	41	38
COc1cc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509728	FH	On-Demand	Anodyne	ANPEP	37	40
COc1cc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509728	FH	On-Demand	Anodyne	PTPRA	63	37
COc1cc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509728	FH	On-Demand	Anodyne	ACE2	55	33
COc1cc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509728	FH	On-Demand	Anodyne	AMP1_PLAFQ	48	38
COc1cc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)ccc1C(=O)O	ZINC000450509728	FH	On-Demand	Anodyne	ACPS	0	41
COc1cc(N2CCN(c3nccc4cc([N+](=O)[O-])ccc34)CC2)ccc1F	ZINC000450509744	GH	On-Demand	Bother	WDR5	25	44
COc1cc(Cl)c(C(=O)N(C)CCC(=O)O)cc1OC	ZINC000450509765	DD	On-Demand	Anodyne	HTR4	46	44
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450509772	FH	On-Demand	Anodyne	HTR4	26	46
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450509772	FH	On-Demand	Anodyne	CCR3	21	40
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450509773	FH	On-Demand	Anodyne	HTR4	26	46
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450509773	FH	On-Demand	Anodyne	CCR3	21	40
COC(=O)c1ccc(CN2CCCc3c(C(N)=O)cccc32)cc1Cl	ZINC000450509774	FG	On-Demand	Anodyne	FABP4	40	36
COC(=O)C1(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)CC1	ZINC000450509775	EG	On-Demand	Anodyne	HTR1A	0	53
COC(=O)C1(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)CC1	ZINC000450509775	EG	On-Demand	Anodyne	HTR1D	0	50
COC(=O)C1(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)CC1	ZINC000450509775	EG	On-Demand	Anodyne	SLC6A4	23	53
CN(C)C(=O)CC1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450509777	GF	On-Demand	Bother	CACNA1B	40	38
CN(C)C(=O)CC1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450509777	GF	On-Demand	Bother	LIPG	47	37
CS(=O)(=O)NC[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450509787	DE	On-Demand	Anodyne	SLC6A1	84	38
CS(=O)(=O)NC[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450509788	DE	On-Demand	Anodyne	SLC6A1	84	38
CS(=O)(=O)NC[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450509789	DE	On-Demand	Anodyne	SLC6A1	84	38
CS(=O)(=O)NC[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450509790	DE	On-Demand	Anodyne	SLC6A1	84	38
O=C(O)COc1ccc(CCNC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450509796	FF	On-Demand	Anodyne	FFAR4	41	36
COc1cc(Cl)c(C(=O)NC2(C(=O)O)CCC(C)CC2)cc1OC	ZINC000450509807	FG	On-Demand	Anodyne	HTR4	47	37
Cc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)c(C(C)C)n1	ZINC000450509808	EF	On-Demand	Anodyne	SLC15A2	0	41
COCCN(C)CCCC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450509810	FH	On-Demand	Anodyne	CCR5	43	39
COc1ccc(C(=O)Nc2cccc(CC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450509817	FH	On-Demand	Anodyne	PDE4A	31	42
COc1ccc(C(=O)Nc2cccc(CC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450509817	FH	On-Demand	Anodyne	CCR3	16	41
COc1ccc(C(=O)Nc2cccc(CC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450509817	FH	On-Demand	Anodyne	PTGDR	23	45
COc1ccc(C(=O)Nc2cccc(CC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450509817	FH	On-Demand	Anodyne	AKR1C2	45	35
COc1ccc(C(=O)Nc2cccc(CC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450509817	FH	On-Demand	Anodyne	KCNK3	54	42
COc1ccc(C(=O)Nc2cccc(CC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450509817	FH	On-Demand	Anodyne	KCNK9	59	42
CN(C)S(=O)(=O)CC(=O)Nc1ccc(OCC(=O)O)c(Cl)c1	ZINC000450509819	FC	On-Demand	Anodyne	MCHR2	27	43
CN(C)S(=O)(=O)CC(=O)Nc1ccc(OCC(=O)O)c(Cl)c1	ZINC000450509819	FC	On-Demand	Anodyne	PTGDR2	34	42
O=C(CC1CC(F)(F)C1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509825	CD	On-Demand	Anodyne	YARS	61	34
O=C(CC1CC(F)(F)C1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450509825	CD	On-Demand	Anodyne	SLC15A2	0	40
COc1cc(CC(=O)N2CCc3ccc(C(C)(C)C)cc3C2)ccc1O	ZINC000450509830	FH	On-Demand	Anodyne	TRPV1	32	51
CCC1(C(=O)NCc2ccc(C(=O)O)c(OC)c2)CCCCC1	ZINC000450509841	DG	On-Demand	Anodyne	ABCC8	25	43
CCC1(C(=O)NCc2ccc(C(=O)O)c(OC)c2)CCCCC1	ZINC000450509841	DG	On-Demand	Anodyne	HCN1	50	34
CCC1(C(=O)NCc2ccc(C(=O)O)c(OC)c2)CCCCC1	ZINC000450509841	DG	On-Demand	Anodyne	HCN4	48	34
COC[C@@]1(C(=O)N2CCc3ccc(C(C)(C)C)cc3C2)CCOC1	ZINC000450509842	EF	On-Demand	Anodyne	CCR2	29	42
COC[C@]1(C(=O)N2CCc3ccc(C(C)(C)C)cc3C2)CCOC1	ZINC000450509843	EF	On-Demand	Anodyne	CCR2	29	42
NC(=O)c1ccc(S(=O)(=O)N2CCN(CCc3ccc(Cl)cc3)CC2)o1	ZINC000450509849	GD	On-Demand	Anodyne	SIGMAR1	15	43
Cc1ccc(C(=O)N2CCN(CCC[C@H](C)O)CC2)cc1	ZINC000450509852	CD	On-Demand	Anodyne	L3MBTL3	47	38
Cc1ccc(C(=O)N2CCN(CCC[C@H](C)O)CC2)cc1	ZINC000450509852	CD	On-Demand	Anodyne	GPR183	0	40
Cc1ccc(C(=O)N2CCN(CCC[C@H](C)O)CC2)cc1	ZINC000450509852	CD	On-Demand	Anodyne	SLC6A7	0	44
Cc1ccc(C(=O)N2CCN(CCC[C@@H](C)O)CC2)cc1	ZINC000450509853	CD	On-Demand	Anodyne	L3MBTL3	47	38
Cc1ccc(C(=O)N2CCN(CCC[C@@H](C)O)CC2)cc1	ZINC000450509853	CD	On-Demand	Anodyne	GPR183	0	40
Cc1ccc(C(=O)N2CCN(CCC[C@@H](C)O)CC2)cc1	ZINC000450509853	CD	On-Demand	Anodyne	SLC6A7	0	44
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H]1CCCCC1(F)F	ZINC000450509854	DE	On-Demand	Anodyne	YARS	59	33
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1CCCCC1(F)F	ZINC000450509855	DE	On-Demand	Anodyne	YARS	59	33
COC1(C)CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450509856	DD	On-Demand	Anodyne	PTGER3	23	40
COC1(C)CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450509856	DD	On-Demand	Anodyne	EPHX2	26	49
COc1cc(CNC(=O)c2cc(C)nc(C(F)(F)F)n2)ccc1C(=O)O	ZINC000450509858	FE	On-Demand	Anodyne	PPARA	30	41
COc1cc(CNC(=O)c2cc(C)nc(C(F)(F)F)n2)ccc1C(=O)O	ZINC000450509858	FE	On-Demand	Anodyne	MMP13	24	42
COc1cc(CNC(=O)c2cc(C)nc(C(F)(F)F)n2)ccc1C(=O)O	ZINC000450509858	FE	On-Demand	Anodyne	PPARD	28	40
COc1cc(CNC(=O)c2cc(C)nc(C(F)(F)F)n2)ccc1C(=O)O	ZINC000450509858	FE	On-Demand	Anodyne	DRTS_TRYCR	43	30
COc1ccccc1NC(=O)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450509859	GG	On-Demand	Anodyne	DRD4	22	41
COc1ccccc1NC(=O)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450509859	GG	On-Demand	Anodyne	DRD3	0	41
COc1ccccc1NC(=O)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450509859	GG	On-Demand	Anodyne	CACNA1G	42	47
C[C@H](c1ccccc1)[C@H](O)CN1CCCc2c(C(N)=O)cccc21	ZINC000450509862	DF	On-Demand	Anodyne	FABP4	43	33
C[C@@H](c1ccccc1)[C@H](O)CN1CCCc2c(C(N)=O)cccc21	ZINC000450509863	DF	On-Demand	Anodyne	FABP4	43	33
C[C@H](c1ccccc1)[C@@H](O)CN1CCCc2c(C(N)=O)cccc21	ZINC000450509864	DF	On-Demand	Anodyne	FABP4	43	33
C[C@@H](c1ccccc1)[C@@H](O)CN1CCCc2c(C(N)=O)cccc21	ZINC000450509865	DF	On-Demand	Anodyne	FABP4	43	33
N#Cc1cnc(NCC2CC(c3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000450509877	DG	On-Demand	Mild	PRKCQ	32	41
CC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509883	CE	On-Demand	Anodyne	ACE	40	40
CC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509883	CE	On-Demand	Anodyne	AVPR1A	0	44
CC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509883	CE	On-Demand	Anodyne	MME	33	42
CC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509883	CE	On-Demand	Anodyne	LTA4H	49	38
CC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509883	CE	On-Demand	Anodyne	CDC25B	23	42
CC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509883	CE	On-Demand	Anodyne	ACE2	71	40
CC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509883	CE	On-Demand	Anodyne	PDS	40	33
CC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509884	CE	On-Demand	Anodyne	ACE	40	40
CC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509884	CE	On-Demand	Anodyne	AVPR1A	0	44
CC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509884	CE	On-Demand	Anodyne	MME	33	42
CC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509884	CE	On-Demand	Anodyne	LTA4H	49	38
CC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509884	CE	On-Demand	Anodyne	CDC25B	23	42
CC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509884	CE	On-Demand	Anodyne	ACE2	71	40
CC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450509884	CE	On-Demand	Anodyne	PDS	40	33
COc1cccc2c(N3C[C@H]4COC[C@@H](C3)O4)nccc12	ZINC000450509889	CD	On-Demand	Anodyne	PDE3B	50	33
CS(=O)(=O)c1ccc2c(c1)CCN(c1cccc(C#N)c1[N+](=O)[O-])CC2	ZINC000450509905	FE	On-Demand	Mild	AKR1C3	31	40
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	CA2	29	46
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	CHRM3	15	40
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	THRB	0	40
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	MMP13	15	47
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	TRY2_BOVIN	53	37
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	PLA2G4B	50	38
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	E1	0	50
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	CYNT	24	44
CCCCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1	ZINC000450509906	GF	On-Demand	Anodyne	NAMPT	57	38
Cc1cc(OCC(=O)O)ccc1NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450509908	GI	On-Demand	Anodyne	PPARA	28	42
Cc1cc(OCC(=O)O)ccc1NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450509908	GI	On-Demand	Anodyne	PPARD	108	52
Cc1cc(C(=O)Nc2ccc(F)cc2OC(C)(C)C)ncc1C(N)=O	ZINC000450509909	EG	On-Demand	Anodyne	PYGL	27	42
Cc1cc(C(=O)Nc2ccc(F)cc2OC(C)(C)C)ncc1C(N)=O	ZINC000450509909	EG	On-Demand	Anodyne	CSF1R	41	42
Cc1c(C#N)c(N2CCC[C@@H](CNC(=O)c3ccco3)C2)nc2ccccc12	ZINC000450509923	FH	On-Demand	Mild	KISS1R	64	37
Cc1c(C#N)c(N2CCC[C@H](CNC(=O)c3ccco3)C2)nc2ccccc12	ZINC000450509924	FH	On-Demand	Mild	KISS1R	64	37
COc1ccc(C(=O)NCCCCC(=O)O)c(OC2CCCC2)c1	ZINC000450509928	EG	On-Demand	Anodyne	MTNR1A	50	39
COc1ccc(-c2ccnc(NCCCOC(F)F)n2)cc1	ZINC000450509939	DF	On-Demand	Anodyne	CLK4	23	54
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	HTR1A	15	43
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	DRD2	27	41
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	DRD4	53	41
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	ACHE	28	43
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	HRH1	19	43
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	DRD3	32	41
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	SIGMAR1	25	48
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	SSTR5	67	43
COc1cc(CN2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccc1Cl	ZINC000450509941	GG	On-Demand	Anodyne	BCHE	23	44
COc1cccc(Oc2ccc(C(=O)N(C)CCN(C(C)C)C(C)C)nc2)c1	ZINC000450509946	GI	On-Demand	Anodyne	MTNR1A	30	40
COc1cccc(Oc2ccc(C(=O)N(C)CCN(C(C)C)C(C)C)nc2)c1	ZINC000450509946	GI	On-Demand	Anodyne	MTNR1B	31	44
Cc1ccccc1C(=O)NC1CCN(CC2CCC(=O)CC2)CC1	ZINC000450509955	EF	On-Demand	Anodyne	DRD4	0	54
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	DRD2	32	44
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	DRD4	17	49
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	HTR2A	34	53
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	HTR2C	25	52
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	SLC6A1	112	36
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	ERG2	20	44
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	HTR7	19	44
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	SIGMAR1	15	51
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	CCR3	98	46
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	CYP2D6	15	45
CS(=O)(=O)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509957	FE	On-Demand	Anodyne	CYP2J2	52	37
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	DRD2	32	44
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	DRD4	17	49
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	HTR2A	34	53
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	HTR2C	25	52
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	SLC6A1	112	36
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	ERG2	20	44
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	HTR7	19	44
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	SIGMAR1	15	51
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	CCR3	98	46
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	CYP2D6	15	45
CS(=O)(=O)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450509958	FE	On-Demand	Anodyne	CYP2J2	52	37
COc1ccc([C@H](NC(=O)[C@@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509965	FG	On-Demand	Anodyne	ACACA	43	36
COc1ccc([C@H](NC(=O)[C@@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509965	FG	On-Demand	Anodyne	CTSL	15	42
COc1ccc([C@H](NC(=O)[C@@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509965	FG	On-Demand	Anodyne	CTSS	17	42
COc1ccc([C@@H](NC(=O)[C@@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509966	FG	On-Demand	Anodyne	ACACA	43	36
COc1ccc([C@@H](NC(=O)[C@@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509966	FG	On-Demand	Anodyne	CTSL	15	42
COc1ccc([C@@H](NC(=O)[C@@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509966	FG	On-Demand	Anodyne	CTSS	17	42
COc1ccc([C@H](NC(=O)[C@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509967	FG	On-Demand	Anodyne	ACACA	43	36
COc1ccc([C@H](NC(=O)[C@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509967	FG	On-Demand	Anodyne	CTSL	15	42
COc1ccc([C@H](NC(=O)[C@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509967	FG	On-Demand	Anodyne	CTSS	17	42
COc1ccc([C@@H](NC(=O)[C@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509969	FG	On-Demand	Anodyne	ACACA	43	36
COc1ccc([C@@H](NC(=O)[C@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509969	FG	On-Demand	Anodyne	CTSL	15	42
COc1ccc([C@@H](NC(=O)[C@H](C)Oc2ccccn2)C(F)(F)F)cc1	ZINC000450509969	FG	On-Demand	Anodyne	CTSS	17	42
CC(C)N1CCN(C(=O)c2ccccc2-n2cc(Br)cn2)CC1=O	ZINC000450509980	GE	On-Demand	Anodyne	P2RX7	24	53
CS(=O)(=O)c1cccc(CN2CCCc3cc(F)ccc32)c1	ZINC000450509986	DG	On-Demand	Anodyne	TYMS	0	41
CCCCCN(CCCOC)C(=O)c1cnn2ccc(C)cc12	ZINC000450509996	DG	On-Demand	Anodyne	EPHB3	20	43
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	HTR1A	24	52
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	DRD2	30	41
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	DRD1	17	42
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	DRD4	25	42
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	HTR2A	27	44
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	HTR2C	21	46
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	DRD3	26	42
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	HTR7	37	42
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	MC4R	61	40
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	CCR3	55	41
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	SLC18A3	0	41
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	EPHX2	20	40
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	MCHR1	30	53
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	CYP2J2	53	39
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510001	GG	On-Demand	Anodyne	KCNK3	41	36
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	HTR1A	24	52
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	DRD2	30	41
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	DRD1	17	42
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	DRD4	25	42
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	HTR2A	27	44
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	HTR2C	21	46
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	DRD3	26	42
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	HTR7	37	42
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	MC4R	61	40
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	CCR3	55	41
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	SLC18A3	0	41
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	EPHX2	20	40
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	MCHR1	30	53
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	CYP2J2	53	39
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450510002	GG	On-Demand	Anodyne	KCNK3	41	36
COc1ccccc1NC(=O)C1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450510015	FH	On-Demand	Anodyne	DRD4	16	40
COc1ccccc1NC(=O)C1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450510015	FH	On-Demand	Anodyne	DRD3	0	40
Cc1ccc(Br)cc1CC(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510017	GF	On-Demand	Anodyne	OPRM1	29	40
Cc1ccc(Br)cc1CC(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510017	GF	On-Demand	Anodyne	OPRD1	33	40
Cc1ccc(Br)cc1CC(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510017	GF	On-Demand	Anodyne	GRIA1	51	38
Cc1ccc(Br)cc1CC(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510017	GF	On-Demand	Anodyne	YARS	50	33
Cc1ccc(Br)cc1CC(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510017	GF	On-Demand	Anodyne	SLC15A2	0	42
Cc1ccc(Br)cc1CC(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510017	GF	On-Demand	Anodyne	PCNA	0	42
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cccc(SC)c1	ZINC000450510023	EH	On-Demand	Anodyne	NPR	45	31
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cccc(SC)c1	ZINC000450510023	EH	On-Demand	Anodyne	PDS	44	33
COc1ccc(CC(=O)N[C@H]2CN(c3ccc(F)cc3)C2=O)c(Cl)c1OC	ZINC000450510024	GF	On-Demand	Anodyne	P2RX7	41	40
COc1ccc(CC(=O)N[C@@H]2CN(c3ccc(F)cc3)C2=O)c(Cl)c1OC	ZINC000450510025	GF	On-Demand	Anodyne	P2RX7	41	40
Cn1nccc1[C@H]1OCC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450510035	FG	On-Demand	Anodyne	EGFR	31	41
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510036	GH	On-Demand	Anodyne	MC4R	52	44
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510036	GH	On-Demand	Anodyne	PRCP	59	41
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510036	GH	On-Demand	Anodyne	MC3R	44	44
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510036	GH	On-Demand	Anodyne	MC5R	35	44
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510037	GH	On-Demand	Anodyne	MC4R	52	44
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510037	GH	On-Demand	Anodyne	PRCP	59	41
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510037	GH	On-Demand	Anodyne	MC3R	44	44
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510037	GH	On-Demand	Anodyne	MC5R	35	44
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510038	GH	On-Demand	Anodyne	MC4R	52	44
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510038	GH	On-Demand	Anodyne	PRCP	59	41
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510038	GH	On-Demand	Anodyne	MC3R	44	44
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510038	GH	On-Demand	Anodyne	MC5R	35	44
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510039	GH	On-Demand	Anodyne	MC4R	52	44
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510039	GH	On-Demand	Anodyne	PRCP	59	41
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510039	GH	On-Demand	Anodyne	MC3R	44	44
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450510039	GH	On-Demand	Anodyne	MC5R	35	44
O=C(O)Cc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450510045	FI	On-Demand	Anodyne	TACR1	18	43
O=C(O)Cc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450510045	FI	On-Demand	Anodyne	PPARD	17	40
O=C(O)Cc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450510045	FI	On-Demand	Anodyne	SLC1A1	19	44
O=C(O)Cc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450510045	FI	On-Demand	Anodyne	EPHX2	18	41
O=C(O)Cc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450510045	FI	On-Demand	Anodyne	SLC1A2	33	44
O=C(O)Cc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450510045	FI	On-Demand	Anodyne	KCNK3	21	40
COC(=O)C1(CN2CCC(C(=O)Nc3ccccc3OC)CC2)CC1	ZINC000450510047	EE	On-Demand	Anodyne	HTR4	16	47
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450510050	DD	On-Demand	Anodyne	OPRD1	0	40
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450510050	DD	On-Demand	Anodyne	YARS	62	34
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)CCCn1nc(C)nc1C	ZINC000450510059	FE	On-Demand	Anodyne	HLA-DRB1	48	32
COc1cc(Cl)c(C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510060	FH	On-Demand	Anodyne	HTR4	56	39
COc1cc(Cl)c(C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510061	FH	On-Demand	Anodyne	HTR4	56	39
O=C(CCCC(=O)C1CC1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510082	DD	On-Demand	Anodyne	GRIA1	41	38
O=C(CCCC(=O)C1CC1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510082	DD	On-Demand	Anodyne	YARS	58	32
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450510092	FG	On-Demand	Anodyne	HDAC1	0	45
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450510092	FG	On-Demand	Anodyne	SGPL1	0	43
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450510092	FG	On-Demand	Anodyne	SMO	33	41
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1Cc1ccccc1	ZINC000450510093	FG	On-Demand	Anodyne	HDAC1	0	45
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1Cc1ccccc1	ZINC000450510093	FG	On-Demand	Anodyne	SGPL1	0	43
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1Cc1ccccc1	ZINC000450510093	FG	On-Demand	Anodyne	SMO	33	41
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@@H](C)CN1Cc1ccccc1	ZINC000450510094	FG	On-Demand	Anodyne	HDAC1	0	45
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@@H](C)CN1Cc1ccccc1	ZINC000450510094	FG	On-Demand	Anodyne	SGPL1	0	43
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@@H](C)CN1Cc1ccccc1	ZINC000450510094	FG	On-Demand	Anodyne	SMO	33	41
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1Cc1ccccc1	ZINC000450510095	FG	On-Demand	Anodyne	HDAC1	0	45
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1Cc1ccccc1	ZINC000450510095	FG	On-Demand	Anodyne	SGPL1	0	43
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1Cc1ccccc1	ZINC000450510095	FG	On-Demand	Anodyne	SMO	33	41
Cc1ccccc1C(=O)NC1CCN(CC2(C#N)CCC2)CC1	ZINC000450510097	DF	On-Demand	Mild	DRD4	21	50
Cc1ccccc1C(=O)NC1CCN(CC2(C#N)CCC2)CC1	ZINC000450510097	DF	On-Demand	Mild	SIGMAR1	20	43
Cc1ccccc1C(=O)NC1CCN(CC2(C#N)CCC2)CC1	ZINC000450510097	DF	On-Demand	Mild	CCR8	67	38
CSc1cccc(C(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)c1	ZINC000450510098	EJ	On-Demand	Anodyne	COLA	40	34
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)c1	ZINC000450510099	EJ	On-Demand	Anodyne	COLA	40	34
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	ACE	27	43
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	OPRM1	39	46
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	OPRD1	33	47
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	MME	78	44
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	ANPEP	60	37
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	KLK3	63	34
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	NTSR1	47	35
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	HLA-A	54	34
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	CAPNS1	50	37
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	PDYN	0	42
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	MMP3	33	41
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	MMP8	29	42
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	GRIA1	43	35
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	YARS	66	38
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	CAPN1	52	42
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	CAPN2	78	38
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	ACE2	53	42
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	FPR1	41	35
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	NPR	42	42
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	SLC15A2	0	49
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510104	DF	On-Demand	Anodyne	PCNA	0	42
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	ACE	27	43
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	OPRM1	39	46
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	OPRD1	33	47
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	MME	78	44
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	ANPEP	60	37
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	KLK3	63	34
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	NTSR1	47	35
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	HLA-A	54	34
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	CAPNS1	50	37
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	PDYN	0	42
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	MMP3	33	41
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	MMP8	29	42
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	GRIA1	43	35
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	YARS	66	38
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	CAPN1	52	42
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	CAPN2	78	38
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	ACE2	53	42
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	FPR1	41	35
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	NPR	42	42
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	SLC15A2	0	49
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510105	DF	On-Demand	Anodyne	PCNA	0	42
CCOC(=O)c1cc(C(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)[nH]c1C	ZINC000450510111	FF	On-Demand	Anodyne	NPR	46	31
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510113	FC	On-Demand	Anodyne	FOLH1	40	32
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510114	FC	On-Demand	Anodyne	FOLH1	40	32
CC(C)c1ncsc1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510119	DE	On-Demand	Anodyne	SLC15A2	0	41
CN(C)C(=O)CC1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450510120	FG	On-Demand	Anodyne	L3MBTL3	42	34
CS[C@H](C)CC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510125	EF	On-Demand	Anodyne	FOLH1	41	33
CS[C@H](C)CC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510126	EF	On-Demand	Anodyne	FOLH1	41	33
CS[C@@H](C)CC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510127	EF	On-Demand	Anodyne	FOLH1	41	33
CS[C@@H](C)CC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510128	EF	On-Demand	Anodyne	FOLH1	41	33
Cc1cc2c(cc1NC(=O)c1cccc3c1O[C@H](C)C3)OCO2	ZINC000450510131	DG	On-Demand	Anodyne	G2YM83_BOTF4	40	36
Cc1cc2c(cc1NC(=O)c1cccc3c1O[C@@H](C)C3)OCO2	ZINC000450510132	DG	On-Demand	Anodyne	G2YM83_BOTF4	40	36
CC1(C(=O)Nc2cc(C(=O)O)cc(S(C)(=O)=O)c2)CC1	ZINC000450510133	CD	On-Demand	Anodyne	RARA	44	37
CCC[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)CCN1CCOC	ZINC000450510134	GG	On-Demand	Anodyne	P2RY12	41	32
CCC[C@H]1CN(C(=O)Cc2scnc2-c2ccccc2)CCN1CCOC	ZINC000450510135	GG	On-Demand	Anodyne	P2RY12	41	32
CC(C)(C)c1ccc2c(c1)CN(C(=O)C1(CF)CCOCC1)CC2	ZINC000450510138	EH	On-Demand	Anodyne	CCR2	25	41
O=C(Cc1ccc(Cl)c(F)c1)NC1(C(=O)O)CCC1	ZINC000450510149	CE	On-Demand	Anodyne	ENV	46	37
COC(=O)c1csc(CN2CC[C@@H](C)c3ccccc32)n1	ZINC000450510150	DG	On-Demand	Anodyne	TRPC6	47	35
COC(=O)c1csc(CN2CC[C@@H](C)c3ccccc32)n1	ZINC000450510150	DG	On-Demand	Anodyne	TRPC3	42	35
COC(=O)c1csc(CN2CC[C@H](C)c3ccccc32)n1	ZINC000450510151	DG	On-Demand	Anodyne	TRPC6	47	35
COC(=O)c1csc(CN2CC[C@H](C)c3ccccc32)n1	ZINC000450510151	DG	On-Demand	Anodyne	TRPC3	42	35
COCCOC[C@@H](O)CN1CCCc2cc(F)ccc21	ZINC000450510152	CD	On-Demand	Anodyne	HSP90AB1	34	40
COCCOC[C@H](O)CN1CCCc2cc(F)ccc21	ZINC000450510153	CD	On-Demand	Anodyne	HSP90AB1	34	40
CC1=C(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CCC(C)(C)C1	ZINC000450510158	DF	On-Demand	Anodyne	YARS	62	36
C[C@@H](O)CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510165	CE	On-Demand	Anodyne	HTR1A	26	46
C[C@@H](O)CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510165	CE	On-Demand	Anodyne	CASR	27	41
C[C@@H](O)CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510165	CE	On-Demand	Anodyne	HTR7	28	45
C[C@@H](O)CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510165	CE	On-Demand	Anodyne	SORD	40	35
C[C@H](O)CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510166	CE	On-Demand	Anodyne	HTR1A	26	46
C[C@H](O)CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510166	CE	On-Demand	Anodyne	CASR	27	41
C[C@H](O)CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510166	CE	On-Demand	Anodyne	HTR7	28	45
C[C@H](O)CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510166	CE	On-Demand	Anodyne	SORD	40	35
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2COCCO2)CC1	ZINC000450510167	ED	On-Demand	Anodyne	EPHX2	58	42
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2COCCO2)CC1	ZINC000450510168	ED	On-Demand	Anodyne	EPHX2	58	42
COc1ccc(-c2noc(N3CCC[C@@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450510174	GF	On-Demand	Anodyne	DRD4	40	30
COc1ccc(-c2noc(N3CCC[C@@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450510174	GF	On-Demand	Anodyne	HRH3	22	40
COc1ccc(-c2noc(N3CCC[C@@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450510174	GF	On-Demand	Anodyne	COLA	0	41
COc1ccc(-c2noc(N3CCC[C@@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450510174	GF	On-Demand	Anodyne	CPT1A	18	41
COc1ccc(-c2noc(N3CCC[C@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450510175	GF	On-Demand	Anodyne	DRD4	40	30
COc1ccc(-c2noc(N3CCC[C@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450510175	GF	On-Demand	Anodyne	HRH3	22	40
COc1ccc(-c2noc(N3CCC[C@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450510175	GF	On-Demand	Anodyne	COLA	0	41
COc1ccc(-c2noc(N3CCC[C@H](CNC(=O)c4ccco4)C3)n2)cc1	ZINC000450510175	GF	On-Demand	Anodyne	CPT1A	18	41
CC(=O)c1cccc(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)c1	ZINC000450510176	GF	On-Demand	Anodyne	HTR1A	20	44
CC(=O)c1cccc(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)c1	ZINC000450510176	GF	On-Demand	Anodyne	DRD2	18	44
CC(=O)c1cccc(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)c1	ZINC000450510176	GF	On-Demand	Anodyne	ACHE	27	40
CC(=O)c1cccc(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)c1	ZINC000450510176	GF	On-Demand	Anodyne	HTR1D	30	42
CC(=O)c1cccc(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)c1	ZINC000450510176	GF	On-Demand	Anodyne	CHRM3	17	42
CC(=O)c1cccc(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)c1	ZINC000450510176	GF	On-Demand	Anodyne	FAAH	19	42
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	FKBP1A	40	45
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	CASP3	24	44
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	MMP13	29	41
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	CCR4	19	47
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	ITGA4	40	41
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	CAPNS1	22	45
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	MMP3	31	41
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	CAPN1	19	48
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	MMP7	40	38
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	MMP1	33	41
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)C	ZINC000450510177	GE	On-Demand	Anodyne	WNT3	46	33
Cc1nc(NCc2cccc(N3C(=O)N[C@@](C)(C4CC4)C3=O)c2)ncc1[N+](=O)[O-]	ZINC000450510183	GD	On-Demand	Bother	PRKCQ	47	45
Cc1nc(NCc2cccc(N3C(=O)N[C@](C)(C4CC4)C3=O)c2)ncc1[N+](=O)[O-]	ZINC000450510184	GD	On-Demand	Bother	PRKCQ	47	45
CC(C)(CC(=O)NCc1cccc(C(=O)O)c1)C(F)(F)F	ZINC000450510203	DF	On-Demand	Anodyne	KCNJ11	44	33
COc1ccc([C@@H](NC(=O)CC2CC(F)(F)C2)C(F)(F)F)cc1	ZINC000450510207	EH	On-Demand	Anodyne	CTSK	23	44
COc1ccc([C@@H](NC(=O)CC2CC(F)(F)C2)C(F)(F)F)cc1	ZINC000450510207	EH	On-Demand	Anodyne	CTSL	15	44
COc1ccc([C@@H](NC(=O)CC2CC(F)(F)C2)C(F)(F)F)cc1	ZINC000450510207	EH	On-Demand	Anodyne	CTSS	15	44
COc1ccc([C@H](NC(=O)CC2CC(F)(F)C2)C(F)(F)F)cc1	ZINC000450510208	EH	On-Demand	Anodyne	CTSK	23	44
COc1ccc([C@H](NC(=O)CC2CC(F)(F)C2)C(F)(F)F)cc1	ZINC000450510208	EH	On-Demand	Anodyne	CTSL	15	44
COc1ccc([C@H](NC(=O)CC2CC(F)(F)C2)C(F)(F)F)cc1	ZINC000450510208	EH	On-Demand	Anodyne	CTSS	15	44
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	ACE	33	40
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	PPARG	18	43
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	PPARA	24	43
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	MME	72	40
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	MMP13	21	44
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	CTSB	35	43
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	PAPA1_CARPA	43	34
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	CYSP_TRYCR	53	41
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	CTSF	67	41
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	CTSL	38	46
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	MMP2	18	40
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	MMP3	26	40
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	ECE1	16	45
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	SOAT1	24	53
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	CTSS	31	46
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	CAPN2	44	31
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	ACE2	76	39
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	MMP1	34	44
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	PSMB8	48	35
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	GPR88	0	43
COc1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510222	FH	On-Demand	Anodyne	PQSD	0	43
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	ACE	33	40
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	PPARG	18	43
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	PPARA	24	43
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	MME	72	40
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	MMP13	21	44
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	CTSB	35	43
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	PAPA1_CARPA	43	34
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	CYSP_TRYCR	53	41
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	CTSF	67	41
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	CTSL	38	46
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	MMP2	18	40
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	MMP3	26	40
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	ECE1	16	45
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	SOAT1	24	53
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	CTSS	31	46
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	CAPN2	44	31
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	ACE2	76	39
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	MMP1	34	44
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	PSMB8	48	35
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	GPR88	0	43
COc1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510223	FH	On-Demand	Anodyne	PQSD	0	43
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	ACE	33	40
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	PPARG	18	43
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	PPARA	24	43
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	MME	72	40
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	MMP13	21	44
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	CTSB	35	43
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	PAPA1_CARPA	43	34
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	CYSP_TRYCR	53	41
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	CTSF	67	41
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	CTSL	38	46
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	MMP2	18	40
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	MMP3	26	40
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	ECE1	16	45
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	SOAT1	24	53
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	CTSS	31	46
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	CAPN2	44	31
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	ACE2	76	39
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	MMP1	34	44
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	PSMB8	48	35
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	GPR88	0	43
COc1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510224	FH	On-Demand	Anodyne	PQSD	0	43
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	ACE	33	40
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	PPARG	18	43
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	PPARA	24	43
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	MME	72	40
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	MMP13	21	44
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	CTSB	35	43
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	PAPA1_CARPA	43	34
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	CYSP_TRYCR	53	41
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	CTSF	67	41
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	CTSL	38	46
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	MMP2	18	40
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	MMP3	26	40
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	ECE1	16	45
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	SOAT1	24	53
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	CTSS	31	46
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	CAPN2	44	31
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	ACE2	76	39
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	MMP1	34	44
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	PSMB8	48	35
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	GPR88	0	43
COc1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450510225	FH	On-Demand	Anodyne	PQSD	0	43
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	DRD2	27	46
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	DRD4	50	46
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	ACHE	37	56
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	ADRA1B	24	40
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	DRD3	26	46
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	LTA4H	28	48
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	KCNA5	22	42
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	SIGMAR1	59	50
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	SSTR5	55	43
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	CCR3	41	61
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	SLC6A5	23	42
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	TGM2	31	42
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	MCHR1	49	46
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	CCR8	82	37
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	CYP2J2	45	33
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	SFRP1	111	43
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	WNT3	85	39
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	NOD2	42	36
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	ADIPOR1	0	44
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000450510230	FF	On-Demand	Anodyne	ADIPOR2	0	44
COc1ccc([C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450510234	GI	On-Demand	Anodyne	GPR88	0	47
COc1ccc2c(c1)OCCN(c1nccc3c(OC)cccc13)C2	ZINC000450510240	EH	On-Demand	Anodyne	PDE3B	59	36
CC(=O)N[C@H](C(=O)N(C)CCN(C(C)C)C(C)C)C(C)(C)C	ZINC000450510246	DE	On-Demand	Anodyne	PDF	50	35
C[C@@H]1CCO[C@@H]1C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450510248	CG	On-Demand	Anodyne	PREP	56	41
C[C@@H]1CCO[C@@H]1C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450510248	CG	On-Demand	Anodyne	F1PEP1	0	40
C[C@@H]1CCO[C@@H]1C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450510249	CG	On-Demand	Anodyne	PREP	56	41
C[C@@H]1CCO[C@@H]1C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450510249	CG	On-Demand	Anodyne	F1PEP1	0	40
CC(C)c1ccoc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450510251	CG	On-Demand	Anodyne	SOAT1	22	41
CC(C)c1ccoc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450510251	CG	On-Demand	Anodyne	ACAT	0	44
CC(C)c1ccoc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450510251	CG	On-Demand	Anodyne	PDS	46	34
CC(F)(F)c1ccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)cn1	ZINC000450510255	EJ	On-Demand	Anodyne	SFRP1	123	43
CC(F)(F)c1ccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)cn1	ZINC000450510255	EJ	On-Demand	Anodyne	WNT3	85	38
CC(F)(F)c1ccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cn1	ZINC000450510256	EJ	On-Demand	Anodyne	SFRP1	123	43
CC(F)(F)c1ccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cn1	ZINC000450510256	EJ	On-Demand	Anodyne	WNT3	85	38
CC(F)(F)c1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)cn1	ZINC000450510257	EJ	On-Demand	Anodyne	SFRP1	123	43
CC(F)(F)c1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)cn1	ZINC000450510257	EJ	On-Demand	Anodyne	WNT3	85	38
CC(F)(F)c1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cn1	ZINC000450510258	EJ	On-Demand	Anodyne	SFRP1	123	43
CC(F)(F)c1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cn1	ZINC000450510258	EJ	On-Demand	Anodyne	WNT3	85	38
CCc1cccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)n1	ZINC000450510259	DH	On-Demand	Anodyne	PREP	54	38
CCc1cccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)n1	ZINC000450510260	DH	On-Demand	Anodyne	PREP	59	38
CCc1cccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)n1	ZINC000450510261	DH	On-Demand	Anodyne	PREP	54	38
CCc1cccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)n1	ZINC000450510262	DH	On-Demand	Anodyne	PREP	54	38
COc1cccc(OCCC(=O)Nc2cnn(CC(C)C)c2C(C)C)c1	ZINC000450510272	FI	On-Demand	Anodyne	MTNR1A	25	41
COc1cccc(OCCC(=O)Nc2cnn(CC(C)C)c2C(C)C)c1	ZINC000450510272	FI	On-Demand	Anodyne	MTNR1B	29	41
COc1cccc(OCCC(=O)Nc2cnn(CC(C)C)c2C(C)C)c1	ZINC000450510272	FI	On-Demand	Anodyne	FAS	19	40
CC[C@@H](C)CC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510274	DF	On-Demand	Anodyne	FOLH1	42	34
CC[C@@H](C)CC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510275	DF	On-Demand	Anodyne	FOLH1	42	34
CC[C@H](C)CC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510276	DF	On-Demand	Anodyne	FOLH1	42	34
CC[C@H](C)CC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510277	DF	On-Demand	Anodyne	FOLH1	42	34
C[C@@H](c1ccc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)cc1)C(F)(F)F	ZINC000450510283	GG	On-Demand	Anodyne	CXCR3	19	40
C[C@@H](c1ccc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)cc1)C(F)(F)F	ZINC000450510283	GG	On-Demand	Anodyne	SMO	0	46
C[C@H](c1ccc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)cc1)C(F)(F)F	ZINC000450510284	GG	On-Demand	Anodyne	CXCR3	19	40
C[C@H](c1ccc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)cc1)C(F)(F)F	ZINC000450510284	GG	On-Demand	Anodyne	SMO	0	46
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	PPARA	21	51
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	ABCC8	19	41
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	ADRB3	34	46
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	MME	27	46
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	TRPV1	22	43
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	PPARD	21	45
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	REN	28	42
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	PTPRA	56	35
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	ACE2	44	33
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	F7	18	42
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	MT-ND1	25	43
COc1ccc(C[C@@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510289	GF	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	PPARA	21	51
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	ABCC8	19	41
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	ADRB3	34	46
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	MME	27	46
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	TRPV1	22	43
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	PPARD	21	45
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	REN	28	42
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	PTPRA	56	35
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	ACE2	44	33
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	F7	18	42
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	MT-ND1	25	43
COc1ccc(C[C@H](C)C(=O)NCc2ccc(C(=O)O)c(OC)c2)cc1OC	ZINC000450510290	GF	On-Demand	Anodyne	DRTS_TRYCR	45	32
CC(F)(F)C(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510291	DE	On-Demand	Anodyne	OPRM1	23	42
CC(F)(F)C(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510291	DE	On-Demand	Anodyne	YARS	64	38
CC(F)(F)C(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510291	DE	On-Demand	Anodyne	SLC15A2	0	44
CC(F)(F)C(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450510291	DE	On-Demand	Anodyne	PCNA	0	42
C[C@H](CCC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510292	GI	On-Demand	Anodyne	FOLH1	40	32
C[C@H](CCC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510292	GI	On-Demand	Anodyne	GSTA1	0	40
C[C@H](CCC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510292	GI	On-Demand	Anodyne	NAALAD2	20	42
C[C@H](CCC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510292	GI	On-Demand	Anodyne	GSTP1	17	41
C[C@H](CCC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510293	GI	On-Demand	Anodyne	FOLH1	40	32
C[C@H](CCC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510293	GI	On-Demand	Anodyne	GSTA1	0	40
C[C@H](CCC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510293	GI	On-Demand	Anodyne	NAALAD2	20	42
C[C@H](CCC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510293	GI	On-Demand	Anodyne	GSTP1	17	41
C[C@@H](CCC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510294	GI	On-Demand	Anodyne	FOLH1	40	32
C[C@@H](CCC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510294	GI	On-Demand	Anodyne	GSTA1	0	40
C[C@@H](CCC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510294	GI	On-Demand	Anodyne	NAALAD2	20	42
C[C@@H](CCC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510294	GI	On-Demand	Anodyne	GSTP1	17	41
C[C@@H](CCC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510295	GI	On-Demand	Anodyne	FOLH1	40	32
C[C@@H](CCC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510295	GI	On-Demand	Anodyne	GSTA1	0	40
C[C@@H](CCC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510295	GI	On-Demand	Anodyne	NAALAD2	20	42
C[C@@H](CCC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)c1ccccc1	ZINC000450510295	GI	On-Demand	Anodyne	GSTP1	17	41
CN(C)C(=O)CC1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450510300	FE	On-Demand	Anodyne	P2RY12	41	34
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450510302	EF	On-Demand	Anodyne	CCR3	71	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450510302	EF	On-Demand	Anodyne	EPHX2	50	41
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450510302	EF	On-Demand	Anodyne	CXCR3	21	42
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450510303	EF	On-Demand	Anodyne	CCR3	71	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450510303	EF	On-Demand	Anodyne	EPHX2	50	41
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450510303	EF	On-Demand	Anodyne	CXCR3	21	42
CC1(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)CC1	ZINC000450510304	CF	On-Demand	Anodyne	PTGDR2	41	47
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CC(=O)N(C)C)CC1	ZINC000450510317	FG	On-Demand	Anodyne	CACNA1B	49	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CC(=O)N(C)C)CC1	ZINC000450510317	FG	On-Demand	Anodyne	CCR2	22	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CC(=O)N(C)C)CC1	ZINC000450510317	FG	On-Demand	Anodyne	LIPG	48	38
COc1ccc2[nH]c(C(=O)N[C@@H](CC(=O)O)C3CCCCC3)cc2c1	ZINC000450510320	EG	On-Demand	Anodyne	CCKAR	29	46
COc1ccc2[nH]c(C(=O)N[C@@H](CC(=O)O)C3CCCCC3)cc2c1	ZINC000450510320	EG	On-Demand	Anodyne	PYGL	91	42
COc1ccc2[nH]c(C(=O)N[C@@H](CC(=O)O)C3CCCCC3)cc2c1	ZINC000450510320	EG	On-Demand	Anodyne	TUBB2B	45	48
COc1ccc2[nH]c(C(=O)N[C@@H](CC(=O)O)C3CCCCC3)cc2c1	ZINC000450510320	EG	On-Demand	Anodyne	FLT3	0	49
COc1ccc2[nH]c(C(=O)N[C@H](CC(=O)O)C3CCCCC3)cc2c1	ZINC000450510321	EG	On-Demand	Anodyne	CCKAR	29	46
COc1ccc2[nH]c(C(=O)N[C@H](CC(=O)O)C3CCCCC3)cc2c1	ZINC000450510321	EG	On-Demand	Anodyne	PYGL	91	42
COc1ccc2[nH]c(C(=O)N[C@H](CC(=O)O)C3CCCCC3)cc2c1	ZINC000450510321	EG	On-Demand	Anodyne	TUBB2B	45	48
COc1ccc2[nH]c(C(=O)N[C@H](CC(=O)O)C3CCCCC3)cc2c1	ZINC000450510321	EG	On-Demand	Anodyne	FLT3	0	49
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1nn2c(c1C)OCCC2	ZINC000450510325	FE	On-Demand	Anodyne	HTR4	49	35
O=S(=O)(c1cccnc1)N1CCN(CC2=CCCCC2)CC1	ZINC000450510327	DD	On-Demand	Anodyne	NAMPT	27	41
O=S(=O)(NC1CCN(C[C@@H]2CCCCC2(F)F)CC1)c1ccc(F)cc1	ZINC000450510328	GG	On-Demand	Anodyne	HTR6	15	52
O=S(=O)(NC1CCN(C[C@@H]2CCCCC2(F)F)CC1)c1ccc(F)cc1	ZINC000450510328	GG	On-Demand	Anodyne	SFRP1	121	38
O=S(=O)(NC1CCN(C[C@@H]2CCCCC2(F)F)CC1)c1ccc(F)cc1	ZINC000450510328	GG	On-Demand	Anodyne	WNT3	83	36
O=S(=O)(NC1CCN(C[C@H]2CCCCC2(F)F)CC1)c1ccc(F)cc1	ZINC000450510329	GG	On-Demand	Anodyne	HTR6	15	52
O=S(=O)(NC1CCN(C[C@H]2CCCCC2(F)F)CC1)c1ccc(F)cc1	ZINC000450510329	GG	On-Demand	Anodyne	SFRP1	121	38
O=S(=O)(NC1CCN(C[C@H]2CCCCC2(F)F)CC1)c1ccc(F)cc1	ZINC000450510329	GG	On-Demand	Anodyne	WNT3	83	36
C=CCC1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CCCCC1	ZINC000450510340	DF	On-Demand	Mild	YARS	48	32
CC(C)CCCC(=O)N1CCC(CC(=O)N(C)C)CC1	ZINC000450510341	CF	On-Demand	Anodyne	GNAI3	0	41
CN1CC[C@@H]2OCCN(c3ncnc4cc(Br)ccc34)[C@@H]2C1	ZINC000450510353	FE	On-Demand	Anodyne	PDE3B	65	33
CN1CC[C@@H]2OCCN(c3ncnc4cc(Br)ccc34)[C@H]2C1	ZINC000450510354	FE	On-Demand	Anodyne	PDE3B	65	33
CN1CC[C@H]2OCCN(c3ncnc4cc(Br)ccc34)[C@@H]2C1	ZINC000450510355	FE	On-Demand	Anodyne	PDE3B	65	33
CN1CC[C@H]2OCCN(c3ncnc4cc(Br)ccc34)[C@H]2C1	ZINC000450510356	FE	On-Demand	Anodyne	PDE3B	65	33
CC[C@@H](O)CC(=O)N1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450510357	EG	On-Demand	Anodyne	CCR1	27	44
CC[C@@H](O)CC(=O)N1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450510357	EG	On-Demand	Anodyne	BCL2A1	43	37
CC[C@H](O)CC(=O)N1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450510358	EG	On-Demand	Anodyne	CCR1	27	44
CC[C@H](O)CC(=O)N1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450510358	EG	On-Demand	Anodyne	BCL2A1	43	37
CCC[C@@H](O)CN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510363	DF	On-Demand	Anodyne	ACOX1	76	36
CCC[C@H](O)CN1CCN(c2nc3ccccc3s2)CC1	ZINC000450510364	DF	On-Demand	Anodyne	ACOX1	76	36
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450510375	GG	On-Demand	Anodyne	MME	19	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450510375	GG	On-Demand	Anodyne	MC4R	40	36
CO[C@@H](Cc1ccccc1)CN1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450510377	GG	On-Demand	Anodyne	MME	19	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450510377	GG	On-Demand	Anodyne	MC4R	40	36
COc1cc(N2CCN(c3cccc(C#N)c3[N+](=O)[O-])CC2)ccc1F	ZINC000450510378	FF	On-Demand	Mild	SSTR1	42	37
COc1cc(N2CCN(c3cccc(C#N)c3[N+](=O)[O-])CC2)ccc1F	ZINC000450510378	FF	On-Demand	Mild	WDR5	25	45
CO[C@H](Cc1ccccc1)CN1CCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450510379	GG	On-Demand	Anodyne	MME	19	40
CO[C@H](Cc1ccccc1)CN1CCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450510379	GG	On-Demand	Anodyne	MC4R	40	36
CO[C@H](Cc1ccccc1)CN1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450510381	GG	On-Demand	Anodyne	MME	19	40
CO[C@H](Cc1ccccc1)CN1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450510381	GG	On-Demand	Anodyne	MC4R	40	36
COc1ccc(F)cc1CC(=O)N[C@@H](CC(=O)O)C1CCCCC1	ZINC000450510396	EF	On-Demand	Anodyne	TSPO	0	41
COc1ccc(F)cc1CC(=O)N[C@H](CC(=O)O)C1CCCCC1	ZINC000450510399	EF	On-Demand	Anodyne	TSPO	0	41
COc1cc(CC(=O)N(C)CCN(C(C)C)C(C)C)ccc1Cl	ZINC000450510400	EG	On-Demand	Anodyne	OPRK1	0	49
COc1ccccc1NC(=O)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450510409	EF	On-Demand	Anodyne	HTR4	19	43
COc1ccccc1NC(=O)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450510410	EF	On-Demand	Anodyne	HTR4	19	43
Cc1cc(NC(=O)C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)no1	ZINC000450510424	GF	On-Demand	Anodyne	ACHE	33	40
Cc1cc(NC(=O)C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)no1	ZINC000450510424	GF	On-Demand	Anodyne	SIGMAR1	32	48
Cc1cc(NC(=O)C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)no1	ZINC000450510424	GF	On-Demand	Anodyne	CACNA1G	40	39
COc1ccccc1NC(=O)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450510430	EG	On-Demand	Anodyne	HTR1A	22	44
COc1ccccc1NC(=O)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450510430	EG	On-Demand	Anodyne	DRD3	0	42
COc1ccccc1NC(=O)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450510430	EG	On-Demand	Anodyne	HTR4	37	47
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450510444	FH	On-Demand	Anodyne	SLC6A1	22	41
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)CCCC(C)C	ZINC000450510446	DI	On-Demand	Anodyne	COLA	52	37
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)CCCC(C)C	ZINC000450510446	DI	On-Demand	Anodyne	CPT1A	54	37
Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)CCCC(C)C	ZINC000450510447	DI	On-Demand	Anodyne	COLA	52	37
Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)CCCC(C)C	ZINC000450510447	DI	On-Demand	Anodyne	CPT1A	54	37
Fc1ccc2c(C3=CCN(Cc4ccn(CC(F)(F)F)n4)CC3)c[nH]c2c1	ZINC000450510457	GI	On-Demand	Anodyne	SLC6A4	17	49
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	HTR1A	56	44
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	DRD2	63	55
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	DRD1	23	44
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	DRD4	75	55
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	ACHE	20	40
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	HTR2A	33	46
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	HTR2C	18	45
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	SLC6A1	31	49
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	SLC6A4	21	44
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	HRH1	31	52
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	ADRA1B	30	44
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	DRD3	56	55
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	SLC6A3	20	43
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	HTR4	69	50
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	CHRM3	19	42
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	LTA4H	19	42
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	TACR1	17	44
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	HTR7	38	44
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	HRH3	20	40
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	SIGMAR1	53	54
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	CCR1	53	41
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	CCR3	51	42
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	CCR5	20	42
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	ABCB1B	30	40
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	ABCB1	27	40
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	DHCR7	0	44
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	RBP4	22	42
COc1ccccc1NC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450510461	FI	On-Demand	Anodyne	CACNA1G	55	46
O=C(N[C@H](CO)Cc1ccc(O)cc1)c1c(F)ccc(SCC2CC2)c1F	ZINC000450510464	GH	On-Demand	Anodyne	YARS	48	33
C/C=C/COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510474	FF	On-Demand	Anodyne	LPAR1	22	41
C/C=C/COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510474	FF	On-Demand	Anodyne	GRIA1	40	34
C/C=C/COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510474	FF	On-Demand	Anodyne	YARS	47	31
C/C=C/COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510474	FF	On-Demand	Anodyne	LPAR3	35	41
C/C=C/COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510474	FF	On-Demand	Anodyne	PCNA	0	41
C/C=C\COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510475	FF	On-Demand	Anodyne	LPAR1	22	41
C/C=C\COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510475	FF	On-Demand	Anodyne	GRIA1	40	34
C/C=C\COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510475	FF	On-Demand	Anodyne	YARS	47	31
C/C=C\COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510475	FF	On-Demand	Anodyne	LPAR3	35	41
C/C=C\COc1cccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450510475	FF	On-Demand	Anodyne	PCNA	0	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cc(C)on2)CC1	ZINC000450510488	FE	On-Demand	Anodyne	SIGMAR1	17	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cc(C)on2)CC1	ZINC000450510488	FE	On-Demand	Anodyne	F11	42	36
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cc(C)on2)CC1	ZINC000450510488	FE	On-Demand	Anodyne	PSMB8	28	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cc(C)on2)CC1	ZINC000450510489	FE	On-Demand	Anodyne	SIGMAR1	17	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cc(C)on2)CC1	ZINC000450510489	FE	On-Demand	Anodyne	F11	42	36
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cc(C)on2)CC1	ZINC000450510489	FE	On-Demand	Anodyne	PSMB8	28	41
N#Cc1c(Cl)cccc1N1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450510495	EG	On-Demand	Mild	KISS1R	41	35
N#Cc1c(Cl)cccc1N1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450510501	EG	On-Demand	Mild	KISS1R	41	35
CCC1(C(=O)NCc2cccc(C(=O)O)c2)CCCCC1	ZINC000450510507	CG	On-Demand	Anodyne	ACAT	0	41
Cc1ccc(C(=O)N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000450510512	FF	On-Demand	Anodyne	ABCB1	24	41
Cc1ccc(C(=O)N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000450510512	FF	On-Demand	Anodyne	GPR183	0	40
Cc1ccc(C(=O)N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000450510512	FF	On-Demand	Anodyne	SLC6A7	0	43
Cc1ccc(C(=O)N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000450510514	FF	On-Demand	Anodyne	ABCB1	24	41
Cc1ccc(C(=O)N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000450510514	FF	On-Demand	Anodyne	GPR183	0	40
Cc1ccc(C(=O)N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000450510514	FF	On-Demand	Anodyne	SLC6A7	0	43
Cc1ccc(C(=O)N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000450510515	FF	On-Demand	Anodyne	ABCB1	24	41
Cc1ccc(C(=O)N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000450510515	FF	On-Demand	Anodyne	GPR183	0	40
Cc1ccc(C(=O)N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000450510515	FF	On-Demand	Anodyne	SLC6A7	0	43
Cc1ccc(C(=O)N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000450510516	FF	On-Demand	Anodyne	ABCB1	24	41
Cc1ccc(C(=O)N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000450510516	FF	On-Demand	Anodyne	GPR183	0	40
Cc1ccc(C(=O)N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000450510516	FF	On-Demand	Anodyne	SLC6A7	0	43
COc1cc(CNC(=O)[C@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510517	EG	On-Demand	Anodyne	ADRB3	47	46
COc1cc(CNC(=O)[C@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510517	EG	On-Demand	Anodyne	SLC6A11	0	42
COc1cc(CNC(=O)[C@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510517	EG	On-Demand	Anodyne	SOAT1	30	44
COc1cc(CNC(=O)[C@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510517	EG	On-Demand	Anodyne	PTPRA	49	33
COc1cc(CNC(=O)[C@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510517	EG	On-Demand	Anodyne	SLC6A12	0	42
COc1cc(CNC(=O)[C@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510517	EG	On-Demand	Anodyne	SLC6A13	0	40
COc1cc(CNC(=O)[C@@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510518	EG	On-Demand	Anodyne	ADRB3	47	46
COc1cc(CNC(=O)[C@@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510518	EG	On-Demand	Anodyne	SLC6A11	0	42
COc1cc(CNC(=O)[C@@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510518	EG	On-Demand	Anodyne	SOAT1	30	44
COc1cc(CNC(=O)[C@@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510518	EG	On-Demand	Anodyne	PTPRA	49	33
COc1cc(CNC(=O)[C@@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510518	EG	On-Demand	Anodyne	SLC6A12	0	42
COc1cc(CNC(=O)[C@@H](c2ccccc2)C2CC2)ccc1C(=O)O	ZINC000450510518	EG	On-Demand	Anodyne	SLC6A13	0	40
COC1(C(=O)NCc2cccc(C(=O)O)c2)CCCCC1	ZINC000450510519	CE	On-Demand	Anodyne	MMP13	17	47
O=C(c1cccc2c1CCCC2)N1CCCc2cccc(O)c21	ZINC000450510520	DH	On-Demand	Anodyne	AVPR2	50	40
CC(=O)c1ccc(CN2CCCc3c(C(N)=O)cccc32)cc1	ZINC000450510524	DF	On-Demand	Anodyne	FABP4	51	38
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1ccsc1C	ZINC000450510525	DG	On-Demand	Anodyne	NPR	52	35
COc1cc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)ccc1C(=O)O	ZINC000450510526	GH	On-Demand	Anodyne	PPARA	25	47
COc1cc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)ccc1C(=O)O	ZINC000450510526	GH	On-Demand	Anodyne	TRPV1	17	52
COc1cc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)ccc1C(=O)O	ZINC000450510526	GH	On-Demand	Anodyne	PPARD	42	45
COc1cc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)ccc1C(=O)O	ZINC000450510526	GH	On-Demand	Anodyne	MTTP	40	35
COc1cc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)ccc1C(=O)O	ZINC000450510526	GH	On-Demand	Anodyne	MT-ND1	23	40
O=C(Cc1ccc(Cl)c(F)c1)NC1(C(=O)O)CCSCC1	ZINC000450510530	EE	On-Demand	Anodyne	ENV	42	32
O=C(O)C[C@H](NC(=O)c1cc(COc2ccccc2F)on1)C1CCCCC1	ZINC000450510531	GH	On-Demand	Anodyne	NTSR2	41	38
O=C(O)CNC(=O)Cc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450510532	GF	On-Demand	Anodyne	HDAC3	16	43
O=C(O)C[C@@H](NC(=O)c1cc(COc2ccccc2F)on1)C1CCCCC1	ZINC000450510540	GH	On-Demand	Anodyne	NTSR2	41	38
O=C1CCC(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)CC1	ZINC000450510544	EI	On-Demand	Anodyne	HTR1D	15	51
O=C1CCC(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)CC1	ZINC000450510544	EI	On-Demand	Anodyne	SLC6A4	26	54
CO[C@H](Cc1ccccc1)C(=O)N(C)CCN(C(C)C)C(C)C	ZINC000450510563	DF	On-Demand	Anodyne	MME	27	45
CO[C@H](Cc1ccccc1)C(=O)N(C)CCN(C(C)C)C(C)C	ZINC000450510563	DF	On-Demand	Anodyne	CAPNS1	54	34
CO[C@@H](Cc1ccccc1)C(=O)N(C)CCN(C(C)C)C(C)C	ZINC000450510564	DF	On-Demand	Anodyne	MME	27	45
CO[C@@H](Cc1ccccc1)C(=O)N(C)CCN(C(C)C)C(C)C	ZINC000450510564	DF	On-Demand	Anodyne	CAPNS1	54	34
C=CCC1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CCCC1	ZINC000450510570	DF	On-Demand	Mild	YARS	49	33
Cc1ccccc1[C@@H](CC(=O)O)NC(=O)CS(=O)(=O)N(C)C	ZINC000450510584	EC	On-Demand	Anodyne	CTSA	79	46
Cc1ccccc1[C@H](CC(=O)O)NC(=O)CS(=O)(=O)N(C)C	ZINC000450510585	EC	On-Demand	Anodyne	CTSA	79	46
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	MME	55	38
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	ANPEP	45	35
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	CTSB	47	36
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	PAPA1_CARPA	49	40
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	SLC15A1	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	CAPNS1	54	35
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	HLA-DRB1	41	34
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	POL	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	NPR	50	37
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450510591	FF	On-Demand	Anodyne	PENP_PENJA	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	MME	55	38
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	ANPEP	45	35
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	CTSB	47	36
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	PAPA1_CARPA	49	40
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	SLC15A1	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	CAPNS1	54	35
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	HLA-DRB1	41	34
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	POL	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	NPR	50	37
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450510592	FF	On-Demand	Anodyne	PENP_PENJA	0	41
COc1ccc([C@H](CC(=O)O)NC(=O)Cc2ccc(Cl)c(F)c2)c(OC)c1	ZINC000450510593	GG	On-Demand	Anodyne	PTGS1	0	42
COc1ccc([C@H](CC(=O)O)NC(=O)Cc2ccc(Cl)c(F)c2)c(OC)c1	ZINC000450510593	GG	On-Demand	Anodyne	PTGS2	29	42
COc1ccc([C@H](CC(=O)O)NC(=O)Cc2ccc(Cl)c(F)c2)c(OC)c1	ZINC000450510593	GG	On-Demand	Anodyne	CTSA	73	36
COc1ccc([C@@H](CC(=O)O)NC(=O)Cc2ccc(Cl)c(F)c2)c(OC)c1	ZINC000450510594	GG	On-Demand	Anodyne	PTGS1	0	42
COc1ccc([C@@H](CC(=O)O)NC(=O)Cc2ccc(Cl)c(F)c2)c(OC)c1	ZINC000450510594	GG	On-Demand	Anodyne	PTGS2	29	42
COc1ccc([C@@H](CC(=O)O)NC(=O)Cc2ccc(Cl)c(F)c2)c(OC)c1	ZINC000450510594	GG	On-Demand	Anodyne	CTSA	73	36
C[C@H](CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510596	FD	On-Demand	Anodyne	NPY2R	27	41
C[C@@H](CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510597	FD	On-Demand	Anodyne	NPY2R	27	41
Cc1ccc(C(=O)N2CCN(Cc3nnc(C4CC4)s3)CC2)cc1	ZINC000450510600	EF	On-Demand	Anodyne	SLC6A7	0	41
CCC[C@H]1CN(C(=O)CCOc2cccc(OC)c2)CCN1CCOC	ZINC000450510602	FE	On-Demand	Anodyne	DRD4	40	30
CCC[C@H]1CN(C(=O)CCOc2cccc(OC)c2)CCN1CCOC	ZINC000450510602	FE	On-Demand	Anodyne	CHRNA10	25	41
CCC[C@@H]1CN(C(=O)CCOc2cccc(OC)c2)CCN1CCOC	ZINC000450510603	FE	On-Demand	Anodyne	DRD4	40	30
CCC[C@@H]1CN(C(=O)CCOc2cccc(OC)c2)CCN1CCOC	ZINC000450510603	FE	On-Demand	Anodyne	CHRNA10	25	41
COc1ccccc1NC(=O)C1CCN(CC2=CCCCC2)CC1	ZINC000450510604	EH	On-Demand	Anodyne	HTR1A	19	42
COc1ccccc1NC(=O)C1CCN(CC2=CCCCC2)CC1	ZINC000450510604	EH	On-Demand	Anodyne	DRD2	20	42
COc1ccccc1NC(=O)C1CCN(CC2=CCCCC2)CC1	ZINC000450510604	EH	On-Demand	Anodyne	DRD4	22	42
COc1ccccc1NC(=O)C1CCN(CC2=CCCCC2)CC1	ZINC000450510604	EH	On-Demand	Anodyne	DRD3	15	42
COc1ccccc1NC(=O)C1CCN(CC2=CCCCC2)CC1	ZINC000450510604	EH	On-Demand	Anodyne	SIGMAR1	17	47
COc1ccccc1NC(=O)C1CCN(CC2=CCCCC2)CC1	ZINC000450510604	EH	On-Demand	Anodyne	CCR3	26	40
COc1ccccc1NC(=O)C1CCN(CC2=CCCCC2)CC1	ZINC000450510604	EH	On-Demand	Anodyne	CACNA1G	37	42
COc1cc(CNC(=O)c2conc2C2CC2)ccc1C(=O)O	ZINC000450510605	DE	On-Demand	Anodyne	U38	0	40
CC(=O)c1cccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510614	GG	On-Demand	Anodyne	HTR1A	15	42
CC(=O)c1cccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510614	GG	On-Demand	Anodyne	CHRM3	17	41
CC(=O)c1cccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510614	GG	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)c1cccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510614	GG	On-Demand	Anodyne	NPY2R	25	46
CC(=O)c1cccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510614	GG	On-Demand	Anodyne	CCR3	65	45
CC(=O)c1cccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510614	GG	On-Demand	Anodyne	MCHR1	33	45
CC(=O)c1cccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510614	GG	On-Demand	Anodyne	CACNA1G	28	40
CC(=O)c1cccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510615	GG	On-Demand	Anodyne	HTR1A	15	42
CC(=O)c1cccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510615	GG	On-Demand	Anodyne	CHRM3	17	41
CC(=O)c1cccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510615	GG	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)c1cccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510615	GG	On-Demand	Anodyne	NPY2R	25	46
CC(=O)c1cccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510615	GG	On-Demand	Anodyne	CCR3	65	45
CC(=O)c1cccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510615	GG	On-Demand	Anodyne	MCHR1	33	45
CC(=O)c1cccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)c1	ZINC000450510615	GG	On-Demand	Anodyne	CACNA1G	28	40
CO[C@@H]1C[C@@H](c2nncn2C)N(c2ncnc3cc(Br)ccc23)C1	ZINC000450510617	GE	On-Demand	Anodyne	PDE3A	41	32
CO[C@@H]1C[C@@H](c2nncn2C)N(c2ncnc3cc(Br)ccc23)C1	ZINC000450510617	GE	On-Demand	Anodyne	PDE3B	61	32
COc1cc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)ccc1Cl	ZINC000450510618	EE	On-Demand	Anodyne	AVPR1A	19	40
COc1cc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)ccc1Cl	ZINC000450510618	EE	On-Demand	Anodyne	TRPV1	40	39
COc1cc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)ccc1Cl	ZINC000450510618	EE	On-Demand	Anodyne	YARS	49	32
COc1cc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)ccc1Cl	ZINC000450510618	EE	On-Demand	Anodyne	NCE103	33	42
COc1cc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)ccc1Cl	ZINC000450510618	EE	On-Demand	Anodyne	P96878_MYCTU	16	42
COc1ccccc1NC(=O)C1CCN(CC2(C#N)CCC2)CC1	ZINC000450510624	EG	On-Demand	Mild	DRD4	15	40
COc1ccccc1NC(=O)C1CCN(CC2(C#N)CCC2)CC1	ZINC000450510624	EG	On-Demand	Mild	HTR4	20	46
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	DRD2	28	47
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	DRD4	44	47
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	ACHE	18	46
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	HRH1	16	45
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	DRD3	26	47
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	HTR4	50	44
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	SIGMAR1	24	47
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	CCR3	29	42
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	ITGA4	16	44
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	EPHX2	26	42
COc1ccccc1NC(=O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450510626	FJ	On-Demand	Anodyne	CACNA1G	37	42
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)[nH]c1C	ZINC000450510627	GG	On-Demand	Anodyne	GABRA1	15	40
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)[nH]c1C	ZINC000450510627	GG	On-Demand	Anodyne	GABRA4	24	40
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)[nH]c1C	ZINC000450510627	GG	On-Demand	Anodyne	GABRA5	36	40
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)[nH]c1C	ZINC000450510627	GG	On-Demand	Anodyne	GABRA3	19	40
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)[nH]c1C	ZINC000450510627	GG	On-Demand	Anodyne	GABRA2	16	40
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450510630	GG	On-Demand	Anodyne	GCK	25	44
CS(=O)(=O)c1cccc(CN2CCCc3c(C(N)=O)cccc32)c1	ZINC000450510633	EE	On-Demand	Anodyne	TRY2_BOVIN	42	34
CCCOc1ccc(C(=O)N2CCCc3cccc(O)c32)c(OC)c1	ZINC000450510635	EH	On-Demand	Anodyne	AVPR2	15	41
CCCOc1ccc(C(=O)N2CCCc3cccc(O)c32)c(OC)c1	ZINC000450510635	EH	On-Demand	Anodyne	OXTR	0	40
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)on1	ZINC000450510636	GE	On-Demand	Anodyne	GABRA1	15	40
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)on1	ZINC000450510636	GE	On-Demand	Anodyne	GABRA4	24	40
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)on1	ZINC000450510636	GE	On-Demand	Anodyne	GABRA5	36	40
CCOC(=O)c1cc(C(=O)N2CCc3c(ncn3-c3ccc(F)cc3)C2)on1	ZINC000450510636	GE	On-Demand	Anodyne	GABRA3	19	40
COC(=O)c1csc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)n1	ZINC000450510641	FE	On-Demand	Anodyne	TRPC6	58	41
COC(=O)c1csc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)n1	ZINC000450510641	FE	On-Demand	Anodyne	TRPC3	35	41
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	HTR1A	55	42
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	DRD2	53	45
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	DRD4	36	41
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	HTR2A	35	41
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	DRD3	49	46
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	HTR4	50	54
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	HTR7	53	40
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	SIGMAR1	23	40
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	CCR3	26	41
CCC(=O)CCCN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450510656	EG	On-Demand	Anodyne	CYP2J2	49	35
Cc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)c2c1CCC2	ZINC000450510657	EF	On-Demand	Anodyne	OPRM1	23	40
Cc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)c2c1CCC2	ZINC000450510657	EF	On-Demand	Anodyne	OPRD1	29	40
Cc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)c2c1CCC2	ZINC000450510657	EF	On-Demand	Anodyne	SLC15A2	0	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	CHRM2	17	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	CHRM1	23	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	DRD2	15	55
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	DRD4	28	55
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	SLC6A3	24	51
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	CHRM3	30	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	TACR2	25	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	SIGMAR1	31	48
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	NPY1R	25	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	NPY2R	26	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	CCR3	101	50
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	CCR5	15	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	TIMP3	49	39
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	EPHX2	60	55
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	CXCR3	22	43
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	MCHR1	32	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510658	GH	On-Demand	Anodyne	CACNA1G	39	43
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	CHRM2	17	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	CHRM1	23	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	DRD2	15	55
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	DRD4	28	55
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	SLC6A3	24	51
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	CHRM3	30	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	TACR2	25	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	SIGMAR1	31	48
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	NPY1R	25	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	NPY2R	26	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	CCR3	101	50
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	CCR5	15	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	TIMP3	49	39
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	EPHX2	60	55
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	CXCR3	22	43
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	MCHR1	32	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450510659	GH	On-Demand	Anodyne	CACNA1G	39	43
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450510671	EE	On-Demand	Anodyne	ACHE	22	44
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450510671	EE	On-Demand	Anodyne	SIGMAR1	26	42
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450510671	EE	On-Demand	Anodyne	MAPK1	18	40
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450510671	EE	On-Demand	Anodyne	HSP90AA1	25	45
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1	ZINC000450510671	EE	On-Demand	Anodyne	MCHR1	41	38
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	DRD2	35	52
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	DRD4	37	45
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	HRH2	19	46
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	HTR2A	24	54
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	DRD3	16	52
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	HTR7	28	48
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	HRH3	20	47
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	SIGMAR1	62	47
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	CCR1	26	44
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	CCR3	15	55
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	HTR6	30	48
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	CCR8	42	36
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	SFRP1	123	43
O=S(=O)(NC1CCN(CCc2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000450510673	GG	On-Demand	Anodyne	WNT3	80	36
CC(C)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1=O	ZINC000450510674	FF	On-Demand	Anodyne	P2RX7	0	54
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	ACACA	49	41
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	CTSF	59	36
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	CTSK	34	46
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	CTSL	33	46
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	MMP2	23	40
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	MMP3	36	40
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	CTSS	26	46
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	MMP9	24	40
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	ACE2	55	34
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	MMP1	31	40
COc1ccc([C@@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510676	GI	On-Demand	Anodyne	GPR88	0	43
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	ACACA	49	41
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	CTSF	59	36
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	CTSK	34	46
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	CTSL	33	46
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	MMP2	23	40
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	MMP3	36	40
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	CTSS	26	46
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	MMP9	24	40
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	ACE2	55	34
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	MMP1	31	40
COc1ccc([C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510677	GI	On-Demand	Anodyne	GPR88	0	43
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	ACACA	49	41
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	CTSF	59	36
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	CTSK	34	46
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	CTSL	33	46
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	MMP2	23	40
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	MMP3	36	40
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	CTSS	26	46
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	MMP9	24	40
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	ACE2	55	34
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	MMP1	31	40
COc1ccc([C@H](NC(=O)[C@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510678	GI	On-Demand	Anodyne	GPR88	0	43
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	ACACA	49	41
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	CTSF	59	36
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	CTSK	34	46
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	CTSL	33	46
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	MMP2	23	40
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	MMP3	36	40
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	CTSS	26	46
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	MMP9	24	40
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	ACE2	55	34
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	MMP1	31	40
COc1ccc([C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C(F)(F)F)cc1	ZINC000450510679	GI	On-Demand	Anodyne	GPR88	0	43
O=C(O)CCCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450510680	CE	On-Demand	Anodyne	NCE103	30	48
CC(C)N(CCN(C)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(C)C	ZINC000450510689	GH	On-Demand	Bother	PPXII	0	40
CC(C)N(CCN(C)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(C)C	ZINC000450510689	GH	On-Demand	Bother	AADAC	0	40
CC(=O)c1nc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)sc1C	ZINC000450510699	FF	On-Demand	Anodyne	TRY1_BOVIN	41	33
CC(=O)c1nc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)sc1C	ZINC000450510699	FF	On-Demand	Anodyne	BIRC2	24	46
CC(=O)c1nc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)sc1C	ZINC000450510700	FF	On-Demand	Anodyne	TRY1_BOVIN	41	33
CC(=O)c1nc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)sc1C	ZINC000450510700	FF	On-Demand	Anodyne	BIRC2	24	46
CSc1cccc(C(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000450510703	FG	On-Demand	Mild	HDAC8	0	46
CSc1cccc(C(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000450510704	FG	On-Demand	Mild	HDAC8	0	46
CN(CCC(=O)O)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450510709	CD	On-Demand	Anodyne	OPRK1	15	49
CC(=O)c1nc(N2CCCN(c3ccc(F)c(F)c3)CC2)sc1C	ZINC000450510727	FH	On-Demand	Anodyne	MLYCD	20	47
C[C@@H](O)CCN1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000450510728	DD	On-Demand	Anodyne	HTR7	18	53
C[C@H](O)CCN1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000450510729	DD	On-Demand	Anodyne	HTR7	18	53
CN(Cc1ccc(C(=O)O)cc1)C(=O)CS(=O)(=O)N(C)C	ZINC000450510742	DC	On-Demand	Anodyne	TRPM8	46	35
CN(Cc1ccc(C(=O)O)cc1)C(=O)CS(=O)(=O)N(C)C	ZINC000450510742	DC	On-Demand	Anodyne	LIMK2	40	40
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	HTR1A	18	60
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	THRA	15	41
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	DRD2	32	42
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	DRD1	22	48
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	DRD4	26	45
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	HTR2A	48	48
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	HTR2C	28	60
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	HRH1	15	47
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	ADRA1B	18	42
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	DRD3	15	48
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	ERG2	20	42
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	CCR3	41	44
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	SLC18A3	18	43
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	MCHR1	20	42
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	CYP2J2	59	44
Cc1cc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450510746	FF	On-Demand	Anodyne	WNT3A	47	33
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510764	GF	On-Demand	Mild	ACE	55	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510764	GF	On-Demand	Mild	MME	30	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510764	GF	On-Demand	Mild	CTRB_BOVIN	46	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510764	GF	On-Demand	Mild	BIRC3	51	39
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510764	GF	On-Demand	Mild	BIRC2	77	39
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510765	GF	On-Demand	Mild	ACE	55	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510765	GF	On-Demand	Mild	MME	30	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510765	GF	On-Demand	Mild	CTRB_BOVIN	46	36
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510765	GF	On-Demand	Mild	BIRC3	51	39
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510765	GF	On-Demand	Mild	BIRC2	77	39
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510766	GF	On-Demand	Mild	ACE	55	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510766	GF	On-Demand	Mild	MME	30	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510766	GF	On-Demand	Mild	CTRB_BOVIN	46	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510766	GF	On-Demand	Mild	BIRC3	51	39
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510766	GF	On-Demand	Mild	BIRC2	77	39
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510767	GF	On-Demand	Mild	ACE	55	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510767	GF	On-Demand	Mild	MME	30	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510767	GF	On-Demand	Mild	CTRB_BOVIN	46	36
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510767	GF	On-Demand	Mild	BIRC3	51	39
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450510767	GF	On-Demand	Mild	BIRC2	77	39
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	CHRM2	22	41
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	DRD2	32	49
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	ACHE	38	48
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	HRH1	23	41
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	DRD3	28	44
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	F10	26	46
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	CHRM3	34	43
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	SIGMAR1	54	49
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	SSTR5	59	45
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	TRY2_BOVIN	92	40
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	NPY2R	38	44
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	CCR3	56	61
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	ST14	105	37
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	CXCR3	28	42
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	MCHR1	44	47
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	CCR8	85	44
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	SFRP1	114	42
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	WNT3	86	39
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	TMPRSS6	62	34
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	ADIPOR1	0	42
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)c1	ZINC000450510768	FF	On-Demand	Anodyne	ADIPOR2	0	42
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450510772	GF	On-Demand	Anodyne	SIGMAR1	19	41
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450510772	GF	On-Demand	Anodyne	SSTR5	40	36
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450510772	GF	On-Demand	Anodyne	CCR3	95	45
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450510772	GF	On-Demand	Anodyne	EPHX2	51	43
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450510772	GF	On-Demand	Anodyne	CXCR3	23	40
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450510772	GF	On-Demand	Anodyne	MCHR1	30	43
CC(=O)N[C@H](C(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1)C(C)(C)C	ZINC000450510773	GI	On-Demand	Anodyne	QDPR	0	41
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	HTR1A	18	42
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	DRD2	15	44
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	DRD4	16	44
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	HTR4	36	47
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	CCR3	24	42
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	STK17B	40	36
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	CACNA1G	39	41
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	HCN1	52	33
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450510780	FI	On-Demand	Anodyne	HCN4	50	33
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	HTR1A	18	42
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	DRD2	15	44
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	DRD4	16	44
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	HTR4	36	47
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	CCR3	24	42
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	STK17B	40	36
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	CACNA1G	39	41
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	HCN1	52	33
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450510781	FI	On-Demand	Anodyne	HCN4	50	33
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450510786	FD	On-Demand	Anodyne	HDAC1	0	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450510786	FD	On-Demand	Anodyne	SMO	0	50
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450510787	FD	On-Demand	Anodyne	HDAC1	0	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450510787	FD	On-Demand	Anodyne	SMO	0	50
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450510788	FD	On-Demand	Anodyne	HDAC1	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450510788	FD	On-Demand	Anodyne	SMO	0	50
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450510789	FD	On-Demand	Anodyne	HDAC1	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450510789	FD	On-Demand	Anodyne	SMO	0	50
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCCN3C(C)C)CC2)cc1	ZINC000450510795	EG	On-Demand	Anodyne	HRH3	25	46
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCCN3C(C)C)CC2)cc1	ZINC000450510795	EG	On-Demand	Anodyne	L3MBTL1	0	42
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCCN3C(C)C)CC2)cc1	ZINC000450510795	EG	On-Demand	Anodyne	L3MBTL3	59	40
Cc1ccc(C(=O)N2CCN(C[C@H]3CCCCN3C(C)C)CC2)cc1	ZINC000450510796	EG	On-Demand	Anodyne	HRH3	25	46
Cc1ccc(C(=O)N2CCN(C[C@H]3CCCCN3C(C)C)CC2)cc1	ZINC000450510796	EG	On-Demand	Anodyne	L3MBTL1	0	42
Cc1ccc(C(=O)N2CCN(C[C@H]3CCCCN3C(C)C)CC2)cc1	ZINC000450510796	EG	On-Demand	Anodyne	L3MBTL3	59	40
Cc1ccc(C(=O)N2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)cc1	ZINC000450510799	FF	On-Demand	Anodyne	SLC6A7	0	40
CCOC(=O)c1ccc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)nc1	ZINC000450510804	FD	On-Demand	Anodyne	P2RY12	27	41
CCC1(C(=O)NCc2ccc(C(=O)O)c(OC)c2)CC1	ZINC000450510805	CE	On-Demand	Anodyne	TRPV1	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H]1CCCCC1(F)F	ZINC000450510810	EG	On-Demand	Anodyne	AMY2	44	31
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H]1CCCCC1(F)F	ZINC000450510811	EG	On-Demand	Anodyne	AMY2	44	31
CCS(=O)(=O)c1ccc(CN2CCCc3c(C(N)=O)cccc32)cc1	ZINC000450510813	FF	On-Demand	Anodyne	FABP4	48	35
COc1ccccc1NC(=O)C1CCN(CCc2cscn2)CC1	ZINC000450510814	EG	On-Demand	Anodyne	HTR1A	34	40
COc1ccccc1NC(=O)C1CCN(CCc2cscn2)CC1	ZINC000450510814	EG	On-Demand	Anodyne	DRD2	31	43
COc1ccccc1NC(=O)C1CCN(CCc2cscn2)CC1	ZINC000450510814	EG	On-Demand	Anodyne	HTR4	25	48
COc1ccccc1NC(=O)C1CCN(CCc2cscn2)CC1	ZINC000450510814	EG	On-Demand	Anodyne	CCR3	26	41
COc1ccccc1NC(=O)C1CCN(CCc2cscn2)CC1	ZINC000450510814	EG	On-Demand	Anodyne	SCN5A	40	33
COc1ccccc1NC(=O)C1CCN(CCc2cscn2)CC1	ZINC000450510814	EG	On-Demand	Anodyne	STK17B	40	37
COc1ccccc1NC(=O)C1CCN(CCc2cscn2)CC1	ZINC000450510814	EG	On-Demand	Anodyne	GPR142	24	41
CCCCCN(CCCOC)C(=O)c1cccc(CC)n1	ZINC000450510815	CG	On-Demand	Anodyne	TSPO	26	47
CCCC[C@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510825	EG	On-Demand	Anodyne	FOLH1	43	34
CCCC[C@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510825	EG	On-Demand	Anodyne	LTA4H	28	43
CCCC[C@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510825	EG	On-Demand	Anodyne	GSTA1	0	40
CCCC[C@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510825	EG	On-Demand	Anodyne	ACE2	50	34
CCCC[C@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510825	EG	On-Demand	Anodyne	NOD1	45	33
CCCC[C@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510826	EG	On-Demand	Anodyne	FOLH1	43	34
CCCC[C@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510826	EG	On-Demand	Anodyne	LTA4H	28	43
CCCC[C@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510826	EG	On-Demand	Anodyne	GSTA1	0	40
CCCC[C@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510826	EG	On-Demand	Anodyne	ACE2	50	34
CCCC[C@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510826	EG	On-Demand	Anodyne	NOD1	45	33
CCCC[C@@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510827	EG	On-Demand	Anodyne	FOLH1	43	34
CCCC[C@@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510827	EG	On-Demand	Anodyne	LTA4H	28	43
CCCC[C@@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510827	EG	On-Demand	Anodyne	GSTA1	0	40
CCCC[C@@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510827	EG	On-Demand	Anodyne	ACE2	50	34
CCCC[C@@H](C)C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510827	EG	On-Demand	Anodyne	NOD1	45	33
CCCC[C@@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510828	EG	On-Demand	Anodyne	FOLH1	43	34
CCCC[C@@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510828	EG	On-Demand	Anodyne	LTA4H	28	43
CCCC[C@@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510828	EG	On-Demand	Anodyne	GSTA1	0	40
CCCC[C@@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510828	EG	On-Demand	Anodyne	ACE2	50	34
CCCC[C@@H](C)C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450510828	EG	On-Demand	Anodyne	NOD1	45	33
COc1ccccc1NC(=O)C1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450510833	ED	On-Demand	Anodyne	HTR4	21	47
COc1ccccc1NC(=O)C1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450510834	ED	On-Demand	Anodyne	HTR4	21	47
COc1cc(CNC(=O)CCc2cccc(OC)c2F)ccc1C(=O)O	ZINC000450510845	FF	On-Demand	Anodyne	TRPV1	0	43
COc1ccc(C[C@@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510846	GG	On-Demand	Anodyne	ACE	23	45
COc1ccc(C[C@@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510846	GG	On-Demand	Anodyne	MME	35	45
COc1ccc(C[C@@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510846	GG	On-Demand	Anodyne	CTSD	22	43
COc1ccc(C[C@@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510846	GG	On-Demand	Anodyne	REN	54	36
COc1ccc(C[C@@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510846	GG	On-Demand	Anodyne	ACE2	49	38
COc1ccc(C[C@@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510846	GG	On-Demand	Anodyne	PROC	40	35
COc1ccc(C[C@@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510847	GG	On-Demand	Anodyne	ACE	23	45
COc1ccc(C[C@@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510847	GG	On-Demand	Anodyne	MME	35	45
COc1ccc(C[C@@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510847	GG	On-Demand	Anodyne	CTSD	22	43
COc1ccc(C[C@@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510847	GG	On-Demand	Anodyne	REN	54	36
COc1ccc(C[C@@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510847	GG	On-Demand	Anodyne	ACE2	49	38
COc1ccc(C[C@@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510847	GG	On-Demand	Anodyne	PROC	40	35
COc1ccc(C[C@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510848	GG	On-Demand	Anodyne	ACE	23	45
COc1ccc(C[C@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510848	GG	On-Demand	Anodyne	MME	35	45
COc1ccc(C[C@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510848	GG	On-Demand	Anodyne	CTSD	22	43
COc1ccc(C[C@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510848	GG	On-Demand	Anodyne	REN	54	36
COc1ccc(C[C@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510848	GG	On-Demand	Anodyne	ACE2	49	38
COc1ccc(C[C@H](C)C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510848	GG	On-Demand	Anodyne	PROC	40	35
COc1ccc(C[C@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510849	GG	On-Demand	Anodyne	ACE	23	45
COc1ccc(C[C@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510849	GG	On-Demand	Anodyne	MME	35	45
COc1ccc(C[C@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510849	GG	On-Demand	Anodyne	CTSD	22	43
COc1ccc(C[C@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510849	GG	On-Demand	Anodyne	REN	54	36
COc1ccc(C[C@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510849	GG	On-Demand	Anodyne	ACE2	49	38
COc1ccc(C[C@H](C)C(=O)N[C@@H](CC(=O)O)C2CCCCC2)cc1OC	ZINC000450510849	GG	On-Demand	Anodyne	PROC	40	35
C=CCOc1ccc(CC(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)cc1	ZINC000450510854	FG	On-Demand	Mild	EPOR	0	42
C=CCOc1ccc(CC(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)cc1	ZINC000450510854	FG	On-Demand	Mild	HRAS	48	34
C[C@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510861	GD	On-Demand	Anodyne	DRD2	17	59
C[C@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510861	GD	On-Demand	Anodyne	ADRA1D	24	48
C[C@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510861	GD	On-Demand	Anodyne	ADRA1A	20	48
C[C@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510861	GD	On-Demand	Anodyne	ADRA1B	34	48
C[C@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510861	GD	On-Demand	Anodyne	HTR7	15	50
C[C@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510861	GD	On-Demand	Anodyne	HTR6	16	59
C[C@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510861	GD	On-Demand	Anodyne	SFRP1	70	36
C[C@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510861	GD	On-Demand	Anodyne	WNT3	45	34
C[C@@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510862	GD	On-Demand	Anodyne	DRD2	17	59
C[C@@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510862	GD	On-Demand	Anodyne	ADRA1D	24	48
C[C@@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510862	GD	On-Demand	Anodyne	ADRA1A	20	48
C[C@@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510862	GD	On-Demand	Anodyne	ADRA1B	34	48
C[C@@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510862	GD	On-Demand	Anodyne	HTR7	15	50
C[C@@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510862	GD	On-Demand	Anodyne	HTR6	16	59
C[C@@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510862	GD	On-Demand	Anodyne	SFRP1	70	36
C[C@@H](CN1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450510862	GD	On-Demand	Anodyne	WNT3	45	34
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450510869	ED	On-Demand	Anodyne	OPRM1	57	41
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450510869	ED	On-Demand	Anodyne	OPRK1	0	40
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450510869	ED	On-Demand	Anodyne	MME	44	37
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450510869	ED	On-Demand	Anodyne	ITGA4	47	38
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450510869	ED	On-Demand	Anodyne	F11	40	33
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450510869	ED	On-Demand	Anodyne	YARS	54	39
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450510870	ED	On-Demand	Anodyne	OPRM1	57	41
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450510870	ED	On-Demand	Anodyne	OPRK1	0	40
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450510870	ED	On-Demand	Anodyne	MME	44	37
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450510870	ED	On-Demand	Anodyne	ITGA4	47	38
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450510870	ED	On-Demand	Anodyne	F11	40	33
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450510870	ED	On-Demand	Anodyne	YARS	54	39
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	CHRM1	17	48
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	DRD2	17	42
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	DRD4	26	57
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	DRD3	0	48
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	CHRM3	18	43
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	SIGMAR1	24	48
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	SSTR5	51	43
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	CCR3	37	49
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	EPHX2	15	42
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	MCHR1	33	43
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	CCR8	64	38
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	TYRO3	16	42
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	HCN1	43	34
Cc1ccccc1C(=O)NC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450510871	FH	On-Demand	Anodyne	HCN4	43	34
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450510872	FD	On-Demand	Anodyne	DRD1	24	45
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450510872	FD	On-Demand	Anodyne	SLC18A3	0	41
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450510872	FD	On-Demand	Anodyne	SMO	0	53
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450510872	FD	On-Demand	Anodyne	CDPK1	0	40
O=S(=O)(c1cccnc1)N1CCN(CCC2=CCCCC2)CC1	ZINC000450510888	EE	On-Demand	Anodyne	NAMPT	23	40
Cc1cc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)nn1C(C)C	ZINC000450510892	DD	On-Demand	Anodyne	YARS	40	31
CC[C@H](C)CC(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450510893	CE	On-Demand	Anodyne	TRPV1	34	47
CC[C@@H](C)CC(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450510894	CE	On-Demand	Anodyne	TRPV1	34	47
CC(=O)[C@@](C)(O)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450510895	DD	On-Demand	Anodyne	L3MBTL3	43	35
CC(=O)[C@](C)(O)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450510896	DD	On-Demand	Anodyne	L3MBTL3	43	35
Cc1cccc(Cl)c1CN1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1	ZINC000450510912	GD	On-Demand	Anodyne	LPL	44	36
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CHRM2	20	42
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	HTR1A	22	41
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CHRM1	17	42
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	DRD2	60	63
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	DRD4	93	63
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	ACHE	46	63
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	HTR2A	20	55
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	HRH1	36	56
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	DRD3	56	63
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	HTR3A	33	54
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	KCNH2	24	45
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	HTR4	96	63
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CHRM3	21	42
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	HTR7	15	52
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	SIGMAR1	46	58
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	SSTR5	100	56
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CCR1	25	43
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CCR3	74	63
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	UTS2R	40	50
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CCR2	20	41
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	SLC6A5	30	42
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	PDK1	55	43
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CXCR3	36	40
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	MCHR1	69	58
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CACNA1I	20	40
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CCR8	75	49
COc1cc(CN2CCC(NC(=O)c3ccccc3C)CC2)ccc1Cl	ZINC000450510913	FI	On-Demand	Anodyne	CYP3A43	0	41
N#CC1(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)CCC1	ZINC000450510914	FE	On-Demand	Mild	SFRP1	80	36
N#CC1(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)CCC1	ZINC000450510914	FE	On-Demand	Mild	WNT3	54	34
Cc1nc(C)n(CCCC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)n1	ZINC000450510915	FG	On-Demand	Anodyne	COLA	76	38
Cc1nc(C)n(CCCC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)n1	ZINC000450510915	FG	On-Demand	Anodyne	CPT1A	66	38
Cc1nc(C)n(CCCC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)n1	ZINC000450510916	FG	On-Demand	Anodyne	COLA	76	38
Cc1nc(C)n(CCCC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)n1	ZINC000450510916	FG	On-Demand	Anodyne	CPT1A	66	38
O=C(Cc1ccc(Cl)c(F)c1)NC1(C(=O)O)CC1	ZINC000450510918	CD	On-Demand	Anodyne	ENV	46	34
C[C@@H]1C[C@]1(C#N)C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450510920	CG	On-Demand	Mild	CCR2	17	43
C[C@H]1C[C@@]1(C#N)C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450510921	CG	On-Demand	Mild	CCR2	17	43
C[C@H]1C[C@]1(C#N)C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450510922	CG	On-Demand	Mild	CCR2	17	43
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450510923	CG	On-Demand	Mild	CCR2	17	43
C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NC(=O)CS(=O)(=O)C1CC1	ZINC000450510924	FF	On-Demand	Anodyne	RBP4	59	35
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000450510925	FF	On-Demand	Anodyne	RBP4	59	35
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@H](C)c1ccccc1C(F)(F)F	ZINC000450510926	FF	On-Demand	Anodyne	RBP4	59	35
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@H](C)c1ccccc1C(F)(F)F	ZINC000450510927	FF	On-Demand	Anodyne	RBP4	59	35
CC[C@H](CC(F)(F)F)C(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450510929	EH	On-Demand	Anodyne	CTSB	46	36
CC[C@@H](CC(F)(F)F)C(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450510930	EH	On-Demand	Anodyne	CTSB	46	36
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	CHRM2	15	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	CHRM1	19	48
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	DRD4	25	50
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	HTR4	31	42
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	P2RY12	41	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	CHRM3	16	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	SIGMAR1	21	44
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	SSTR5	70	54
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	CCR3	21	41
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	UTS2R	15	41
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	MCHR1	39	46
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	CCR8	73	39
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccccc3C)CC2)nc1	ZINC000450510935	GF	On-Demand	Anodyne	HPGDS	37	41
C[C@H](CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1)S(C)(=O)=O	ZINC000450510936	EF	On-Demand	Anodyne	HTR1D	0	49
C[C@H](CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1)S(C)(=O)=O	ZINC000450510936	EF	On-Demand	Anodyne	SLC6A4	24	59
C[C@@H](CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1)S(C)(=O)=O	ZINC000450510937	EF	On-Demand	Anodyne	HTR1D	0	49
C[C@@H](CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1)S(C)(=O)=O	ZINC000450510937	EF	On-Demand	Anodyne	SLC6A4	24	59
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)o1	ZINC000450510938	EH	On-Demand	Anodyne	COLA	97	37
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)o1	ZINC000450510938	EH	On-Demand	Anodyne	CPT1A	94	37
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)o1	ZINC000450510939	EH	On-Demand	Anodyne	COLA	97	37
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)o1	ZINC000450510939	EH	On-Demand	Anodyne	CPT1A	94	37
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	ABCC8	20	42
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	CNR2	31	40
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	CASR	17	43
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	TRPV1	0	44
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	PPARD	33	40
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	MTNR1A	40	41
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	PLA2G4B	32	41
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	PTPRA	44	32
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	HCRTR2	18	44
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	U38	0	40
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	TSPAN17	0	41
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	NCE103	17	40
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	CAN2	0	40
CCCOc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450510942	FG	On-Demand	Anodyne	PDS	71	38
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	CHRM1	16	44
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	DRD2	22	47
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	DRD4	30	51
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	HTR2A	16	49
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	SLC6A1	89	43
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	DRD3	27	41
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	HTR4	44	42
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	SIGMAR1	27	47
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	SLC6A5	57	42
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	MCHR1	21	52
Cc1ccccc1C(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450510943	EI	On-Demand	Anodyne	CCR8	65	38
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	CHRM1	16	44
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	DRD2	22	47
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	DRD4	30	51
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	HTR2A	16	49
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	SLC6A1	89	43
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	DRD3	27	41
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	HTR4	44	42
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	SIGMAR1	27	47
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	SLC6A5	57	42
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	MCHR1	21	52
Cc1ccccc1C(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450510944	EI	On-Demand	Anodyne	CCR8	65	38
COc1ccccc1NC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450510946	EI	On-Demand	Anodyne	HTR1A	40	45
COc1ccccc1NC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450510946	EI	On-Demand	Anodyne	DRD2	36	45
COc1ccccc1NC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450510946	EI	On-Demand	Anodyne	DRD4	24	43
COc1ccccc1NC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450510946	EI	On-Demand	Anodyne	DRD3	32	43
COc1ccccc1NC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450510946	EI	On-Demand	Anodyne	HTR4	26	53
COc1ccccc1NC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450510946	EI	On-Demand	Anodyne	CHRM3	15	40
COc1ccccc1NC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450510946	EI	On-Demand	Anodyne	SIGMAR1	18	41
COc1ccccc1NC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450510946	EI	On-Demand	Anodyne	CACNA1G	35	43
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)C[C@@H]1COc2ccccc2O1	ZINC000450510947	FF	On-Demand	Anodyne	HTR1A	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)C[C@H]1COc2ccccc2O1	ZINC000450510948	FF	On-Demand	Anodyne	HTR1A	0	41
C[C@@H](C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)C1CC1	ZINC000450510952	DF	On-Demand	Anodyne	FOLH1	40	32
C[C@@H](C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)C1CC1	ZINC000450510953	DF	On-Demand	Anodyne	FOLH1	40	32
C[C@H](C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)C1CC1	ZINC000450510954	DF	On-Demand	Anodyne	FOLH1	40	32
C[C@H](C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)C1CC1	ZINC000450510955	DF	On-Demand	Anodyne	FOLH1	40	32
N#CC1(CN2CCN(S(=O)(=O)c3cccnc3)CC2)CCC1	ZINC000450510958	DD	On-Demand	Mild	NAMPT	22	40
COc1ccc([C@@H](CC(=O)O)NC(=O)c2[nH]c3ccc(C)cc3c2C)c(OC)c1	ZINC000450510959	GH	On-Demand	Anodyne	CTSA	53	37
COc1ccc([C@H](CC(=O)O)NC(=O)c2[nH]c3ccc(C)cc3c2C)c(OC)c1	ZINC000450510960	GH	On-Demand	Anodyne	CTSA	53	37
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](CC(=O)O)C2CCCCC2)c1	ZINC000450510961	GG	On-Demand	Anodyne	MTNR1A	28	46
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](CC(=O)O)C2CCCCC2)c1	ZINC000450510961	GG	On-Demand	Anodyne	MTNR1B	33	46
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](CC(=O)O)C2CCCCC2)c1	ZINC000450510962	GG	On-Demand	Anodyne	MTNR1A	28	46
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](CC(=O)O)C2CCCCC2)c1	ZINC000450510962	GG	On-Demand	Anodyne	MTNR1B	33	46
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H](CC(=O)O)C2CCCCC2)c1	ZINC000450510963	GG	On-Demand	Anodyne	MTNR1A	28	46
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H](CC(=O)O)C2CCCCC2)c1	ZINC000450510963	GG	On-Demand	Anodyne	MTNR1B	33	46
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](CC(=O)O)C2CCCCC2)c1	ZINC000450510964	GG	On-Demand	Anodyne	MTNR1A	28	46
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](CC(=O)O)C2CCCCC2)c1	ZINC000450510964	GG	On-Demand	Anodyne	MTNR1B	33	46
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H](O)C1CCC1	ZINC000450510968	DD	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)O1	ZINC000450510978	FE	On-Demand	Anodyne	PDE3A	43	34
COC(=O)[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)O1	ZINC000450510978	FE	On-Demand	Anodyne	PDGFRB	41	42
COC(=O)[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)O1	ZINC000450510978	FE	On-Demand	Anodyne	PDE3B	42	34
CCOc1ccc(C[C@@H](CNC(=O)C2(C3CC3)CCOCC2)C(=O)O)cc1	ZINC000450510990	GF	On-Demand	Anodyne	TIMP3	65	39
CCOc1ccc(C[C@H](CNC(=O)C2(C3CC3)CCOCC2)C(=O)O)cc1	ZINC000450510991	GF	On-Demand	Anodyne	TIMP3	65	39
CC(C)N1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC1=O	ZINC000450510995	GE	On-Demand	Anodyne	TRPC6	83	43
CC(C)N1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC1=O	ZINC000450510995	GE	On-Demand	Anodyne	TRPC3	61	43
CC(C)N1CCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1=O	ZINC000450511000	DD	On-Demand	Anodyne	P2RX7	0	49
NS(=O)(=O)c1ccc2c(c1)CCN2CCc1ccc(Cl)cc1	ZINC000450511001	EF	On-Demand	Anodyne	CA	0	40
NS(=O)(=O)c1ccc2c(c1)CCN2CCc1ccc(Cl)cc1	ZINC000450511001	EF	On-Demand	Anodyne	Q5TU56_ANOGA	0	40
Cc1nn(C)cc1CC(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000450511007	DG	On-Demand	Anodyne	P2RX7	43	40
O=C(O)CCCCNC(=O)CCCc1cc(F)ccc1F	ZINC000450511014	CF	On-Demand	Anodyne	MPO	25	40
CNC(=O)NC1CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450511015	ED	On-Demand	Anodyne	PDGFRB	26	41
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2C)c(OC2CCCC2)c1	ZINC000450511035	GI	On-Demand	Anodyne	PDE4A	31	42
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2C)c(OC2CCCC2)c1	ZINC000450511035	GI	On-Demand	Anodyne	PDE4B	19	42
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2C)c(OC2CCCC2)c1	ZINC000450511035	GI	On-Demand	Anodyne	PDE4D	23	42
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2C)c(OC2CCCC2)c1	ZINC000450511035	GI	On-Demand	Anodyne	PPARD	35	40
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2C)c(OC2CCCC2)c1	ZINC000450511035	GI	On-Demand	Anodyne	PDE4C	15	42
O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1cnc(C2CC2)nc1	ZINC000450511046	GI	On-Demand	Anodyne	RBP4	44	32
O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1cnc(C2CC2)nc1	ZINC000450511047	GI	On-Demand	Anodyne	RBP4	44	32
O=C(CCC(=O)N1CCC[C@H]1/C=C/c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450511048	GI	On-Demand	Bother	CACNA1D	50	37
O=C(CCC(=O)N1CCC[C@H]1/C=C/c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450511048	GI	On-Demand	Bother	PREP	36	47
O=C(CCC(=O)N1CCC[C@H]1/C=C\c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450511049	GI	On-Demand	Bother	CACNA1D	50	37
O=C(CCC(=O)N1CCC[C@H]1/C=C\c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450511049	GI	On-Demand	Bother	PREP	36	47
O=C(CCC(=O)N1CCC[C@@H]1/C=C/c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450511050	GI	On-Demand	Bother	CACNA1D	50	37
O=C(CCC(=O)N1CCC[C@@H]1/C=C/c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450511050	GI	On-Demand	Bother	PREP	36	47
O=C(CCC(=O)N1CCC[C@@H]1/C=C\c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450511051	GI	On-Demand	Bother	CACNA1D	50	37
O=C(CCC(=O)N1CCC[C@@H]1/C=C\c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450511051	GI	On-Demand	Bother	PREP	36	47
CCc1cc(CCCN2CCC(NS(=O)(=O)c3ccccc3)CC2)on1	ZINC000450511056	GF	On-Demand	Anodyne	DRD2	17	42
CCc1cc(CCCN2CCC(NS(=O)(=O)c3ccccc3)CC2)on1	ZINC000450511056	GF	On-Demand	Anodyne	HTR7	36	42
CCc1cc(CCCN2CCC(NS(=O)(=O)c3ccccc3)CC2)on1	ZINC000450511056	GF	On-Demand	Anodyne	HTR6	19	42
CCc1cc(CCCN2CCC(NS(=O)(=O)c3ccccc3)CC2)on1	ZINC000450511056	GF	On-Demand	Anodyne	CCR8	46	34
CCc1cc(CCCN2CCC(NS(=O)(=O)c3ccccc3)CC2)on1	ZINC000450511056	GF	On-Demand	Anodyne	SFRP1	118	43
CCc1cc(CCCN2CCC(NS(=O)(=O)c3ccccc3)CC2)on1	ZINC000450511056	GF	On-Demand	Anodyne	WNT3	75	34
O=C1CC[C@H](CCC(=O)N2CCC[C@H]2/C=C\c2ccccc2)N1	ZINC000450511061	DF	On-Demand	Anodyne	PREP	44	38
O=C1CC[C@H](CCC(=O)N2CCC[C@H]2/C=C/c2ccccc2)N1	ZINC000450511062	DF	On-Demand	Anodyne	PREP	44	38
O=C1CC[C@H](CCC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)N1	ZINC000450511063	DF	On-Demand	Anodyne	PREP	44	38
O=C1CC[C@H](CCC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)N1	ZINC000450511064	DF	On-Demand	Anodyne	PREP	44	38
COc1cc(CC(=O)N2CCC[C@H]2/C=C/c2ccccc2)ccc1O	ZINC000450511067	EH	On-Demand	Anodyne	FKBP1A	48	34
COc1cc(CC(=O)N2CCC[C@H]2/C=C/c2ccccc2)ccc1O	ZINC000450511067	EH	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)N2CCC[C@H]2/C=C/c2ccccc2)ccc1O	ZINC000450511067	EH	On-Demand	Anodyne	ACKR3	46	38
COc1cc(CC(=O)N2CCC[C@H]2/C=C\c2ccccc2)ccc1O	ZINC000450511068	EH	On-Demand	Anodyne	FKBP1A	48	34
COc1cc(CC(=O)N2CCC[C@H]2/C=C\c2ccccc2)ccc1O	ZINC000450511068	EH	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)N2CCC[C@H]2/C=C\c2ccccc2)ccc1O	ZINC000450511068	EH	On-Demand	Anodyne	ACKR3	46	38
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H](O)C1CCC1	ZINC000450511069	DD	On-Demand	Anodyne	AMY2	43	29
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	HTR1A	63	43
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	DRD2	59	46
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	DRD4	49	46
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	ACHE	43	40
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	HTR1D	15	43
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	HTR1B	17	43
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	HTR2A	28	40
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	HRH1	23	57
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	DRD3	53	46
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	HTR4	38	49
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	CHRM3	21	41
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	GRIN2B	23	43
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	LTA4H	24	44
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	TACR1	24	43
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	HTR7	45	38
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	HRH3	15	41
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	SIGMAR1	58	46
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	CCR3	48	44
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	CACNA1G	52	42
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	CCR8	19	40
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	LIMK2	16	40
COc1ccccc1NC(=O)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450511074	GG	On-Demand	Anodyne	ACKR3	46	30
COc1cc(CNC(=O)c2cc(C(C)C)oc2C)ccc1C(=O)O	ZINC000450511081	EG	On-Demand	Anodyne	U38	0	42
CCOC(=O)c1ccc(CN2CCc3cc(F)c(F)cc32)nc1	ZINC000450511084	DG	On-Demand	Anodyne	SRD5A1	20	42
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	HTR1A	42	63
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	DRD2	43	69
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	DRD1	30	57
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	DRD4	49	63
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	HTR2A	38	63
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	HTR2C	16	52
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	DRD3	35	69
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	ERG2	22	49
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	HTR7	38	49
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	SIGMAR1	16	69
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	CYP2J2	50	35
NC(=O)c1ccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450511088	FE	On-Demand	Anodyne	SLC27A1	57	42
COc1cc(CC(=O)N2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450511090	FF	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450511090	FF	On-Demand	Anodyne	OPRK1	50	43
COc1cc(CC(=O)N2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450511090	FF	On-Demand	Anodyne	HTR4	36	40
COc1cc(CC(=O)N2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450511090	FF	On-Demand	Anodyne	CCR1	37	41
COc1cc(CC(=O)N2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450511090	FF	On-Demand	Anodyne	CCR3	28	41
O=C(c1ccc(N2CCC2)nc1)N1CCCN(CC(F)F)CC1	ZINC000450511091	DD	On-Demand	Anodyne	BDKRB1	0	41
Cc1cccc2c1O[C@@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C2	ZINC000450511092	ED	On-Demand	Anodyne	YARS	40	31
Cc1cccc2c1O[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C2	ZINC000450511093	ED	On-Demand	Anodyne	YARS	40	31
COc1ccccc1NC(=O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450511102	GH	On-Demand	Anodyne	HTR1A	20	41
COc1ccccc1NC(=O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450511102	GH	On-Demand	Anodyne	DRD2	20	47
COc1ccccc1NC(=O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450511102	GH	On-Demand	Anodyne	DRD4	28	47
COc1ccccc1NC(=O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450511102	GH	On-Demand	Anodyne	DRD3	25	47
COc1ccccc1NC(=O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450511102	GH	On-Demand	Anodyne	HTR4	19	47
COc1ccccc1NC(=O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450511102	GH	On-Demand	Anodyne	SIGMAR1	23	46
COc1ccccc1NC(=O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450511102	GH	On-Demand	Anodyne	CCR3	28	42
COc1ccccc1NC(=O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450511102	GH	On-Demand	Anodyne	CACNA1G	40	38
COc1ccccc1NC(=O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450511103	GH	On-Demand	Anodyne	HTR1A	20	41
COc1ccccc1NC(=O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450511103	GH	On-Demand	Anodyne	DRD2	20	47
COc1ccccc1NC(=O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450511103	GH	On-Demand	Anodyne	DRD4	28	47
COc1ccccc1NC(=O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450511103	GH	On-Demand	Anodyne	DRD3	25	47
COc1ccccc1NC(=O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450511103	GH	On-Demand	Anodyne	HTR4	19	47
COc1ccccc1NC(=O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450511103	GH	On-Demand	Anodyne	SIGMAR1	23	46
COc1ccccc1NC(=O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450511103	GH	On-Demand	Anodyne	CCR3	28	42
COc1ccccc1NC(=O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450511103	GH	On-Demand	Anodyne	CACNA1G	40	38
Cc1cccc(Cl)c1C(=O)N1CCCN(CC(F)F)CC1	ZINC000450511105	DG	On-Demand	Anodyne	CCR5	22	40
Cc1cc(F)c(CC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)cc1F	ZINC000450511112	FI	On-Demand	Anodyne	COLA	55	38
Cc1cc(F)c(CC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)cc1F	ZINC000450511112	FI	On-Demand	Anodyne	CPT1A	55	38
Cc1cc(F)c(CC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)cc1F	ZINC000450511113	FI	On-Demand	Anodyne	COLA	55	38
Cc1cc(F)c(CC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)cc1F	ZINC000450511113	FI	On-Demand	Anodyne	CPT1A	55	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	OPRM1	70	51
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	OPRD1	88	51
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	NPY4R	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	PDYN	0	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	PAM	0	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	POL	0	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	SLC15A2	0	53
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	CBX7	0	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511114	FD	On-Demand	Anodyne	VM1B1_BOTAS	0	44
C[C@H](O)CCN1CCCc2cc(Cl)ccc21	ZINC000450511117	BF	On-Demand	Anodyne	CNR1	40	31
C[C@H](O)CCN1CCCc2cc(Cl)ccc21	ZINC000450511117	BF	On-Demand	Anodyne	NAMPT	0	40
C[C@@H](O)CCN1CCCc2cc(Cl)ccc21	ZINC000450511118	BF	On-Demand	Anodyne	CNR1	40	31
C[C@@H](O)CCN1CCCc2cc(Cl)ccc21	ZINC000450511118	BF	On-Demand	Anodyne	NAMPT	0	40
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000450511124	FD	On-Demand	Anodyne	RBP4	42	36
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000450511125	FD	On-Demand	Anodyne	RBP4	42	36
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000450511126	FD	On-Demand	Anodyne	RBP4	42	36
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000450511127	FD	On-Demand	Anodyne	RBP4	42	36
CCOC(=O)c1cc(C(=O)N2CCc3ccc(C(C)(C)C)cc3C2)on1	ZINC000450511137	FG	On-Demand	Anodyne	BCL2	0	41
COc1cc(-c2noc(CN3CCN(C(=O)c4ccc(C)cc4)CC3)n2)ncn1	ZINC000450511141	GD	On-Demand	Anodyne	PLA2G2A	22	41
C[C@@H]1Cc2cccc(C(=O)N[C@H](CO)Cc3ccc(O)cc3)c2O1	ZINC000450511144	EE	On-Demand	Anodyne	YARS	40	32
C[C@H]1Cc2cccc(C(=O)N[C@H](CO)Cc3ccc(O)cc3)c2O1	ZINC000450511145	EE	On-Demand	Anodyne	YARS	40	32
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	ACE	32	46
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	OPRM1	39	47
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	OPRD1	33	46
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	MME	84	45
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	ANPEP	61	38
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	KLK3	40	31
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	NTSR1	48	36
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	HLA-A	59	37
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	CAPNS1	49	35
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	MMP3	23	40
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	MMP8	29	43
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	GRIA1	44	36
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	YARS	66	40
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	CAPN1	48	38
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	CAPN2	76	38
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	ACE2	70	46
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	MMP7	27	40
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	MMP1	22	40
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	FPR1	41	36
CC[C@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511146	CE	On-Demand	Anodyne	NPR	42	41
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	ACE	32	46
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	OPRM1	39	47
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	OPRD1	33	46
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	MME	84	45
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	ANPEP	61	38
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	KLK3	40	31
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	NTSR1	48	36
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	HLA-A	59	37
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	CAPNS1	49	35
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	MMP3	23	40
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	MMP8	29	43
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	GRIA1	44	36
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	YARS	66	40
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	CAPN1	48	38
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	CAPN2	76	38
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	ACE2	70	46
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	MMP7	27	40
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	MMP1	22	40
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	FPR1	41	36
CC[C@@H](CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511147	CE	On-Demand	Anodyne	NPR	42	41
O=C(N[C@H](CO)Cc1ccc(O)cc1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450511149	GD	On-Demand	Anodyne	YARS	56	31
NC(=O)c1cccc2c1CCCN2CCCC(=O)c1ccccc1	ZINC000450511150	DG	On-Demand	Anodyne	FABP4	47	34
NC(=O)c1cccc2c1CCCN2CCCC(=O)c1ccccc1	ZINC000450511150	DG	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)c1ccc(CC(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)cc1	ZINC000450511153	FF	On-Demand	Anodyne	POL	0	43
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000450511154	EG	On-Demand	Anodyne	RBP4	66	37
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H](C)c1ccccc1C(F)(F)F	ZINC000450511155	EG	On-Demand	Anodyne	RBP4	66	37
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000450511156	EG	On-Demand	Anodyne	RBP4	66	37
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H](C)c1ccccc1C(F)(F)F	ZINC000450511157	EG	On-Demand	Anodyne	RBP4	66	37
COc1cc(Cl)c(C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450511169	GG	On-Demand	Anodyne	KCNA3	23	45
COc1cc(Cl)c(C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450511169	GG	On-Demand	Anodyne	ITGAV	16	44
COc1cc(Cl)c(C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450511170	GG	On-Demand	Anodyne	KCNA3	23	45
COc1cc(Cl)c(C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450511170	GG	On-Demand	Anodyne	ITGAV	16	44
CC1(C(=O)Nc2ccc(C(=O)N3CCC(C(=O)O)CC3)cc2)CC1	ZINC000450511171	EE	On-Demand	Anodyne	AVPR2	47	36
CC1(C(=O)Nc2ccc(C(=O)N3CCC(C(=O)O)CC3)cc2)CC1	ZINC000450511171	EE	On-Demand	Anodyne	EPHX2	28	40
CC1(C(=O)Nc2ccc(C(=O)N3CCC(C(=O)O)CC3)cc2)CC1	ZINC000450511171	EE	On-Demand	Anodyne	L3MBTL3	85	42
Cc1cccc(C[C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)c1	ZINC000450511174	FG	On-Demand	Anodyne	CTSB	15	44
Cc1cccc(C[C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)c1	ZINC000450511174	FG	On-Demand	Anodyne	P2RX7	41	37
Cc1cccc(C[C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)c1	ZINC000450511174	FG	On-Demand	Anodyne	CPA1	49	50
Cc1cccc(C[C@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)c1	ZINC000450511175	FG	On-Demand	Anodyne	CTSB	15	44
Cc1cccc(C[C@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)c1	ZINC000450511175	FG	On-Demand	Anodyne	P2RX7	41	37
Cc1cccc(C[C@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C(=O)O)c1	ZINC000450511175	FG	On-Demand	Anodyne	CPA1	49	50
CCc1cc(CCCN2CCN(C(=O)c3ccccn3)CC2)on1	ZINC000450511197	EE	On-Demand	Anodyne	DRD3	15	43
CC(=O)c1nc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)sc1C	ZINC000450511198	EE	On-Demand	Anodyne	BIRC2	17	44
CC(=O)c1nc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)sc1C	ZINC000450511199	EE	On-Demand	Anodyne	BIRC2	17	44
O=C(c1ccc(O)cc1)N1CCN(CCC2=CCCCC2)CC1	ZINC000450511205	DG	On-Demand	Anodyne	FABI	51	35
O=C(c1ccc(O)cc1)N1CCN(CCC2=CCCCC2)CC1	ZINC000450511205	DG	On-Demand	Anodyne	L3MBTL3	44	36
COc1cc(CN2CCN(c3oc(-c4ccco4)nc3C#N)CC2)ccc1Cl	ZINC000450511206	GH	On-Demand	Mild	SSTR5	40	36
COc1ccc2c(c1)CCCCN2C(=O)c1cccc(C(F)(F)F)n1	ZINC000450511210	FI	On-Demand	Anodyne	AVPR2	32	46
COc1ccc2c(c1)CCCCN2C(=O)c1cccc(C(F)(F)F)n1	ZINC000450511210	FI	On-Demand	Anodyne	CYP11B2	26	42
COc1ccc2c(c1)CCCCN2C(=O)c1cccc(C(F)(F)F)n1	ZINC000450511210	FI	On-Demand	Anodyne	TAAR1	24	40
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450511229	EI	On-Demand	Anodyne	AVPR2	41	47
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450511229	EI	On-Demand	Anodyne	CYP11B2	21	43
COc1ccc2c(c1)CCCCN2C(=O)c1cc(C)n(C(C)C)n1	ZINC000450511231	EH	On-Demand	Anodyne	SRD5A1	0	40
COc1ccc2c(c1)CCCCN2C(=O)c1cc(C)n(C(C)C)n1	ZINC000450511231	EH	On-Demand	Anodyne	AVPR2	32	41
COc1ccc(C(=O)NCC(C)(C)C(=O)O)c(OC2CCCC2)c1	ZINC000450511232	EF	On-Demand	Anodyne	PDE4B	26	44
CC1(C(=O)NC[C@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511233	DF	On-Demand	Anodyne	MME	47	43
CC1(C(=O)NC[C@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511233	DF	On-Demand	Anodyne	FCER2	30	41
CC1(C(=O)NC[C@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511233	DF	On-Demand	Anodyne	CPA1	60	57
CC1(C(=O)NC[C@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511233	DF	On-Demand	Anodyne	TPH1	47	36
CC1(C(=O)NC[C@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511233	DF	On-Demand	Anodyne	ACE2	34	43
CC1(C(=O)NC[C@@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511234	DF	On-Demand	Anodyne	MME	47	43
CC1(C(=O)NC[C@@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511234	DF	On-Demand	Anodyne	FCER2	30	41
CC1(C(=O)NC[C@@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511234	DF	On-Demand	Anodyne	CPA1	60	57
CC1(C(=O)NC[C@@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511234	DF	On-Demand	Anodyne	TPH1	47	36
CC1(C(=O)NC[C@@H](Cc2ccc3ccccc3c2)C(=O)O)CC1	ZINC000450511234	DF	On-Demand	Anodyne	ACE2	34	43
COC(=O)c1coc(CN[C@@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)n1	ZINC000450511242	GH	On-Demand	Anodyne	SOAT1	0	46
COC(=O)c1coc(CN[C@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)n1	ZINC000450511243	GH	On-Demand	Anodyne	SOAT1	0	46
CC(C)(C)[C@@H](O)C[C@H](CO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450511256	EH	On-Demand	Anodyne	HRP1_PLAFA	50	36
CC(C)(C)[C@H](O)C[C@@H](CO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450511257	EH	On-Demand	Anodyne	HRP1_PLAFA	50	36
CC(C)(C)[C@@H](O)C[C@@H](CO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450511258	EH	On-Demand	Anodyne	HRP1_PLAFA	50	36
CC(C)(C)[C@H](O)C[C@H](CO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450511259	EH	On-Demand	Anodyne	HRP1_PLAFA	50	36
COc1cccc2c(N3CCC([C@H]4OCC[C@@H]4C(N)=O)CC3)nccc12	ZINC000450511263	FE	On-Demand	Anodyne	PDE3A	41	33
COc1cccc2c(N3CCC([C@H]4OCC[C@@H]4C(N)=O)CC3)nccc12	ZINC000450511263	FE	On-Demand	Anodyne	PDE3B	41	36
COc1cc(CC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)ccc1O	ZINC000450511269	EH	On-Demand	Anodyne	FKBP1A	48	34
COc1cc(CC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)ccc1O	ZINC000450511269	EH	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)ccc1O	ZINC000450511269	EH	On-Demand	Anodyne	ACKR3	46	38
COc1cc(CC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)ccc1O	ZINC000450511270	EH	On-Demand	Anodyne	FKBP1A	48	34
COc1cc(CC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)ccc1O	ZINC000450511270	EH	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)ccc1O	ZINC000450511270	EH	On-Demand	Anodyne	ACKR3	46	38
CN1[C@H]2CC[C@H]1CC([C@H](N=c1[nH]ncs1)c1ccc(Cl)cc1)C2	ZINC000450511271	EH	On-Demand	Anodyne	SLC6A1	23	42
CN1[C@H]2CC[C@H]1CC([C@H](N=c1[nH]ncs1)c1ccc(Cl)cc1)C2	ZINC000450511271	EH	On-Demand	Anodyne	SLC6A3	16	42
CN1[C@H]2CC[C@H]1CC([C@@H](N=c1[nH]ncs1)c1ccc(Cl)cc1)C2	ZINC000450511272	EH	On-Demand	Anodyne	SLC6A1	23	42
CN1[C@H]2CC[C@H]1CC([C@@H](N=c1[nH]ncs1)c1ccc(Cl)cc1)C2	ZINC000450511272	EH	On-Demand	Anodyne	SLC6A3	16	42
Nc1ncccc1CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450511283	ED	On-Demand	Anodyne	SFRP1	100	40
O=S(=O)(NC1CCN(CC23CCC(CC2)C3)CC1)c1ccccc1	ZINC000450511284	EG	On-Demand	Anodyne	SFRP1	101	39
O=S(=O)(NC1CCN(CC23CCC(CC2)C3)CC1)c1ccccc1	ZINC000450511284	EG	On-Demand	Anodyne	WNT3	50	31
NS(=O)(=O)c1ccc2c(c1)CCN2CC1=CCCCC1	ZINC000450511295	CE	On-Demand	Anodyne	CA7	24	44
N#Cc1c(Cl)cccc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511306	FG	On-Demand	Mild	COLA	124	44
N#Cc1c(Cl)cccc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511306	FG	On-Demand	Mild	CPT1A	106	44
N#Cc1c(Cl)cccc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511306	FG	On-Demand	Mild	CPT2	48	41
N#Cc1c(Cl)cccc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511306	FG	On-Demand	Mild	SCD	19	40
N#Cc1c(Cl)cccc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511306	FG	On-Demand	Mild	GPR183	0	44
N#Cc1c(Cl)cccc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511307	FG	On-Demand	Mild	COLA	124	44
N#Cc1c(Cl)cccc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511307	FG	On-Demand	Mild	CPT1A	106	44
N#Cc1c(Cl)cccc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511307	FG	On-Demand	Mild	CPT2	48	41
N#Cc1c(Cl)cccc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511307	FG	On-Demand	Mild	SCD	19	40
N#Cc1c(Cl)cccc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000450511307	FG	On-Demand	Mild	GPR183	0	44
CCS(=O)(=O)c1ccc(CN2CCCc3cc(F)ccc32)cc1	ZINC000450511321	EH	On-Demand	Anodyne	TYMS	0	45
CCS(=O)(=O)c1ccc(CN2CCCc3cc(F)ccc32)cc1	ZINC000450511321	EH	On-Demand	Anodyne	CYP11B2	18	41
CCS(=O)(=O)c1ccc(CN2CCCc3cc(F)ccc32)cc1	ZINC000450511321	EH	On-Demand	Anodyne	C3SWJ7_ECOLX	0	44
CC(=O)[C@@](C)(O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450511322	ED	On-Demand	Anodyne	CCR3	79	40
CC(=O)[C@@](C)(O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450511322	ED	On-Demand	Anodyne	EPHX2	64	48
CC(=O)[C@@](C)(O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450511322	ED	On-Demand	Anodyne	CXCR3	25	42
CC(=O)[C@](C)(O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450511323	ED	On-Demand	Anodyne	CCR3	79	40
CC(=O)[C@](C)(O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450511323	ED	On-Demand	Anodyne	EPHX2	64	48
CC(=O)[C@](C)(O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450511323	ED	On-Demand	Anodyne	CXCR3	25	42
COC(=O)c1csc(CN2CCc3cc(S(N)(=O)=O)ccc32)n1	ZINC000450511332	FD	On-Demand	Anodyne	CA7	30	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H]2/C=C/c2ccccc2)c1	ZINC000450511334	EJ	On-Demand	Anodyne	UTS2R	46	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H]2/C=C/c2ccccc2)c1	ZINC000450511334	EJ	On-Demand	Anodyne	PREP	43	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c1	ZINC000450511336	EJ	On-Demand	Anodyne	UTS2R	46	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c1	ZINC000450511336	EJ	On-Demand	Anodyne	PREP	43	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H]2/C=C\c2ccccc2)c1	ZINC000450511338	EJ	On-Demand	Anodyne	UTS2R	46	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H]2/C=C\c2ccccc2)c1	ZINC000450511338	EJ	On-Demand	Anodyne	PREP	43	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)c1	ZINC000450511340	EJ	On-Demand	Anodyne	UTS2R	46	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)c1	ZINC000450511340	EJ	On-Demand	Anodyne	PREP	43	39
Fc1ccc2c(C3=CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)c[nH]c2c1	ZINC000450511343	EH	On-Demand	Anodyne	HTR1D	0	48
Fc1ccc2c(C3=CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)c[nH]c2c1	ZINC000450511343	EH	On-Demand	Anodyne	SLC6A4	23	52
Fc1ccc2c(C3=CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)c[nH]c2c1	ZINC000450511345	EH	On-Demand	Anodyne	HTR1D	0	48
Fc1ccc2c(C3=CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)c[nH]c2c1	ZINC000450511345	EH	On-Demand	Anodyne	SLC6A4	23	52
COC(=O)c1ccc(CC(=O)N[C@@H](c2ccc(OC)cc2)C(F)(F)F)cc1	ZINC000450511346	GG	On-Demand	Anodyne	CTSK	21	43
COC(=O)c1ccc(CC(=O)N[C@@H](c2ccc(OC)cc2)C(F)(F)F)cc1	ZINC000450511346	GG	On-Demand	Anodyne	CTSL	21	43
COC(=O)c1ccc(CC(=O)N[C@@H](c2ccc(OC)cc2)C(F)(F)F)cc1	ZINC000450511346	GG	On-Demand	Anodyne	CTSS	16	43
COC(=O)c1ccc(CC(=O)N[C@@H](c2ccc(OC)cc2)C(F)(F)F)cc1	ZINC000450511346	GG	On-Demand	Anodyne	MMP1	18	40
Cc1cncc(-c2nc(CN3CCC(NC(=O)c4ccccc4C)CC3)no2)c1	ZINC000450511347	GG	On-Demand	Anodyne	DRD4	22	49
Cc1cncc(-c2nc(CN3CCC(NC(=O)c4ccccc4C)CC3)no2)c1	ZINC000450511347	GG	On-Demand	Anodyne	SIGMAR1	19	41
Cc1cncc(-c2nc(CN3CCC(NC(=O)c4ccccc4C)CC3)no2)c1	ZINC000450511347	GG	On-Demand	Anodyne	SSTR5	54	47
Cc1cncc(-c2nc(CN3CCC(NC(=O)c4ccccc4C)CC3)no2)c1	ZINC000450511347	GG	On-Demand	Anodyne	PDE4B	41	35
Cc1cncc(-c2nc(CN3CCC(NC(=O)c4ccccc4C)CC3)no2)c1	ZINC000450511347	GG	On-Demand	Anodyne	PDK1	43	38
Cc1cncc(-c2nc(CN3CCC(NC(=O)c4ccccc4C)CC3)no2)c1	ZINC000450511347	GG	On-Demand	Anodyne	CCR8	56	31
COC(=O)c1ccc(CC(=O)N[C@H](c2ccc(OC)cc2)C(F)(F)F)cc1	ZINC000450511348	GG	On-Demand	Anodyne	CTSK	21	43
COC(=O)c1ccc(CC(=O)N[C@H](c2ccc(OC)cc2)C(F)(F)F)cc1	ZINC000450511348	GG	On-Demand	Anodyne	CTSL	21	43
COC(=O)c1ccc(CC(=O)N[C@H](c2ccc(OC)cc2)C(F)(F)F)cc1	ZINC000450511348	GG	On-Demand	Anodyne	CTSS	16	43
COC(=O)c1ccc(CC(=O)N[C@H](c2ccc(OC)cc2)C(F)(F)F)cc1	ZINC000450511348	GG	On-Demand	Anodyne	MMP1	18	40
O=C(O)CCCCNC(=O)C1(Oc2ccccc2F)CC1	ZINC000450511352	CE	On-Demand	Anodyne	CXCL8	17	43
CCCCCN(CCCOC)C(=O)c1ocnc1-c1ccccc1	ZINC000450511377	EI	On-Demand	Anodyne	TSPO	50	50
CCCCCN(CCCOC)C(=O)c1ocnc1-c1ccccc1	ZINC000450511377	EI	On-Demand	Anodyne	SOAT1	30	41
Cc1nc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450511378	FE	On-Demand	Bother	MAPK9	18	43
Cc1nc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450511378	FE	On-Demand	Bother	MAPK8	18	43
Cc1nc(N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450511378	FE	On-Demand	Bother	PRKCQ	44	38
Cc1nc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450511379	FE	On-Demand	Bother	MAPK9	18	43
Cc1nc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450511379	FE	On-Demand	Bother	MAPK8	18	43
Cc1nc(N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450511379	FE	On-Demand	Bother	PRKCQ	44	38
CS[C@H](C)CC(=O)NCc1cccc(C(=O)O)c1	ZINC000450511382	CE	On-Demand	Anodyne	PDS	50	34
CS[C@@H](C)CC(=O)NCc1cccc(C(=O)O)c1	ZINC000450511386	CE	On-Demand	Anodyne	PDS	50	34
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	DRD4	42	44
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	ACHE	20	42
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	HRH1	23	46
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	DRD3	27	44
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	HTR4	50	38
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	SIGMAR1	26	42
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	SSTR5	72	46
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	CCR3	49	42
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	UTS2R	27	40
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	HSP90AA1	21	41
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	PDK1	52	41
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	MCHR1	39	46
COc1cc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)ccc1Cl	ZINC000450511388	FF	On-Demand	Anodyne	CACNA1G	34	44
O=C(COc1ccccc1)N1CC[C@@H](Nc2ncc(C(F)F)cn2)C1	ZINC000450511392	EF	On-Demand	Anodyne	COLA	131	43
O=C(COc1ccccc1)N1CC[C@H](Nc2ncc(C(F)F)cn2)C1	ZINC000450511393	EF	On-Demand	Anodyne	COLA	131	43
CC[S@](=O)CC(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450511399	CE	On-Demand	Anodyne	PREP	42	39
CC[S@](=O)CC(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450511401	CE	On-Demand	Anodyne	PREP	42	39
CC[S@](=O)CC(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450511402	CE	On-Demand	Anodyne	PREP	42	39
CC[S@](=O)CC(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450511404	CE	On-Demand	Anodyne	PREP	42	39
O=C(O)[C@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccccc1	ZINC000450511409	EE	On-Demand	Anodyne	MME	59	38
O=C(O)[C@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccccc1	ZINC000450511409	EE	On-Demand	Anodyne	ANPEP	64	33
O=C(O)[C@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccccc1	ZINC000450511409	EE	On-Demand	Anodyne	CPA1	60	40
O=C(O)[C@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccccc1	ZINC000450511409	EE	On-Demand	Anodyne	TIMP3	58	33
O=C(O)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccccc1	ZINC000450511410	EE	On-Demand	Anodyne	MME	59	38
O=C(O)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccccc1	ZINC000450511410	EE	On-Demand	Anodyne	ANPEP	64	33
O=C(O)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccccc1	ZINC000450511410	EE	On-Demand	Anodyne	CPA1	60	40
O=C(O)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccccc1	ZINC000450511410	EE	On-Demand	Anodyne	TIMP3	58	33
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)on1	ZINC000450511429	FF	On-Demand	Anodyne	COLA	81	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)on1	ZINC000450511429	FF	On-Demand	Anodyne	CPT1A	61	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)on1	ZINC000450511430	FF	On-Demand	Anodyne	COLA	81	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)on1	ZINC000450511430	FF	On-Demand	Anodyne	CPT1A	61	40
O=C(O)CCCOc1ccc(NC(=O)C2(C3CC3)CCOCC2)cc1	ZINC000450511435	EG	On-Demand	Anodyne	CYSLTR2	43	32
O=C(O)CCCOc1ccc(NC(=O)C2(C3CC3)CCOCC2)cc1	ZINC000450511435	EG	On-Demand	Anodyne	EPHX2	15	42
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	HTR1A	29	42
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	DRD2	55	54
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	DRD4	90	54
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	ACHE	51	46
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	HRH2	24	48
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	HTR2A	15	43
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	HRH1	36	48
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	DRD3	44	54
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	OPRK1	30	42
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	HTR3A	0	54
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	KCNH2	20	46
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	HTR4	75	46
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	CHRM3	25	42
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	TACR1	15	41
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	HRH3	15	40
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	SIGMAR1	56	54
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	SSTR5	84	44
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	CCR1	38	47
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	CCR3	78	47
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	ITGA4	16	41
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	FAAH	16	40
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	EPHX2	20	42
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	CXCR3	30	40
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	MCHR1	54	46
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	CACNA1G	56	48
COc1cc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)ccc1Cl	ZINC000450511440	GI	On-Demand	Anodyne	CCR8	36	45
CCOC1(C(=O)NCc2ccc(C(=O)O)c(OC)c2)CCCC1	ZINC000450511441	DE	On-Demand	Anodyne	TRPV1	16	41
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	OPRM1	38	47
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	OPRD1	35	45
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	PAPA1_CARPA	45	37
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	GRIA1	42	37
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	PAM	0	40
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	YARS	71	42
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	SLC15A2	0	51
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	IL1B	0	40
CC(=O)N[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C(C)(C)C	ZINC000450511442	DC	On-Demand	Anodyne	PCNA	0	48
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511451	CE	On-Demand	Anodyne	OPRM1	30	40
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511451	CE	On-Demand	Anodyne	OPRD1	39	40
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511451	CE	On-Demand	Anodyne	YARS	61	35
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511452	CE	On-Demand	Anodyne	OPRM1	30	40
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511452	CE	On-Demand	Anodyne	OPRD1	39	40
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511452	CE	On-Demand	Anodyne	YARS	61	35
C[C@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511453	CE	On-Demand	Anodyne	OPRM1	30	40
C[C@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511453	CE	On-Demand	Anodyne	OPRD1	39	40
C[C@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511453	CE	On-Demand	Anodyne	YARS	61	35
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511454	CE	On-Demand	Anodyne	OPRM1	30	40
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511454	CE	On-Demand	Anodyne	OPRD1	39	40
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511454	CE	On-Demand	Anodyne	YARS	61	35
NC(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450511458	EG	On-Demand	Anodyne	DRD4	0	45
NC(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450511458	EG	On-Demand	Anodyne	SLC18A3	0	44
NC(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450511458	EG	On-Demand	Anodyne	HTR3B	0	42
NC(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450511458	EG	On-Demand	Anodyne	CYP2J2	46	32
CCC(=O)C1(C(=O)N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450511461	FI	On-Demand	Anodyne	QDPR	0	40
Cc1ccc(F)c(CC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)c1	ZINC000450511463	EI	On-Demand	Anodyne	CPT1A	72	39
Cc1ccc(F)c(CC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)c1	ZINC000450511464	EI	On-Demand	Anodyne	CPT1A	72	39
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450511465	FG	On-Demand	Anodyne	TIMP3	41	33
COc1cc(C)c(C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450511481	FF	On-Demand	Anodyne	PPARD	17	40
COc1cc(C)c(C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450511482	FF	On-Demand	Anodyne	PPARD	17	40
C[C@H]1Cc2cccc(C(=O)Nc3cccnc3OCC(F)F)c2O1	ZINC000450511491	EG	On-Demand	Anodyne	G2YM83_BOTF4	81	45
C[C@@H]1Cc2cccc(C(=O)Nc3cccnc3OCC(F)F)c2O1	ZINC000450511492	EG	On-Demand	Anodyne	G2YM83_BOTF4	81	45
CC(C)(C)[C@H](O)C[C@H](CO)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450511498	EF	On-Demand	Anodyne	CX3CR1	40	33
CC(C)(C)[C@@H](O)C[C@@H](CO)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450511499	EF	On-Demand	Anodyne	CX3CR1	40	33
CC(C)(C)[C@@H](O)C[C@H](CO)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450511500	EF	On-Demand	Anodyne	CX3CR1	40	33
CC(C)(C)[C@H](O)C[C@@H](CO)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450511501	EF	On-Demand	Anodyne	CX3CR1	40	33
COc1cc(Cl)c(C(=O)N2CCO[C@H](CC(=O)O)C2)cc1OC	ZINC000450511505	ED	On-Demand	Anodyne	HTR4	44	35
COc1cc(Cl)c(C(=O)N2CCO[C@@H](CC(=O)O)C2)cc1OC	ZINC000450511506	ED	On-Demand	Anodyne	HTR4	44	35
CS(=O)(=O)c1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511515	GD	On-Demand	Anodyne	MME	84	46
CS(=O)(=O)c1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511515	GD	On-Demand	Anodyne	ANPEP	94	36
CS(=O)(=O)c1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511515	GD	On-Demand	Anodyne	CPA1	63	49
CS(=O)(=O)c1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511515	GD	On-Demand	Anodyne	LAP3	43	36
CS(=O)(=O)c1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511516	GD	On-Demand	Anodyne	MME	84	46
CS(=O)(=O)c1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511516	GD	On-Demand	Anodyne	ANPEP	94	36
CS(=O)(=O)c1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511516	GD	On-Demand	Anodyne	CPA1	63	49
CS(=O)(=O)c1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511516	GD	On-Demand	Anodyne	LAP3	43	36
COc1ccc2c(c1)CCCCN2C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450511526	GH	On-Demand	Anodyne	CPT2	19	40
COc1ccc2c(c1)CCCCN2C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450511527	GH	On-Demand	Anodyne	CPT2	19	40
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511538	EC	On-Demand	Anodyne	CPA1	50	38
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450511539	EC	On-Demand	Anodyne	CPA1	50	38
FC(F)(F)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450511540	FJ	On-Demand	Anodyne	PDE3A	46	37
FC(F)(F)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450511540	FJ	On-Demand	Anodyne	AKT2	20	41
FC(F)(F)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450511540	FJ	On-Demand	Anodyne	PDE3B	67	35
FC(F)(F)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450511540	FJ	On-Demand	Anodyne	SIRT3	61	35
FC(F)(F)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450511540	FJ	On-Demand	Anodyne	SIRT2	55	35
FC(F)(F)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450511540	FJ	On-Demand	Anodyne	SIRT1	54	35
COc1ccc2c(c1)CCCCN2C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450511546	EE	On-Demand	Anodyne	AVPR2	34	41
COc1ccc(F)cc1CC(=O)NC[C@H](C(=O)O)c1ccc(C)cc1	ZINC000450511549	EF	On-Demand	Anodyne	PPARA	15	45
COc1ccc(F)cc1CC(=O)NC[C@H](C(=O)O)c1ccc(C)cc1	ZINC000450511549	EF	On-Demand	Anodyne	PPARD	22	45
COc1ccc(F)cc1CC(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1	ZINC000450511550	EF	On-Demand	Anodyne	PPARA	15	45
COc1ccc(F)cc1CC(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1	ZINC000450511550	EF	On-Demand	Anodyne	PPARD	22	45
COc1ccc2c(c1)CCCCN2C(=O)c1cc2n(n1)CCCC2	ZINC000450511565	EG	On-Demand	Anodyne	AVPR2	27	42
CC(C)O[C@@]1(C(=O)N2CCc3ccc(C(C)(C)C)cc3C2)CCOC1	ZINC000450511570	EG	On-Demand	Anodyne	CCR2	21	44
CC(C)O[C@]1(C(=O)N2CCc3ccc(C(C)(C)C)cc3C2)CCOC1	ZINC000450511571	EG	On-Demand	Anodyne	CCR2	21	44
Fc1ccc2c(C3=CCN(CC4CC(F)(F)C4)CC3)c[nH]c2c1	ZINC000450511572	DI	On-Demand	Anodyne	DRD2	0	62
Fc1ccc2c(C3=CCN(CC4CC(F)(F)C4)CC3)c[nH]c2c1	ZINC000450511572	DI	On-Demand	Anodyne	HTR1D	0	50
Fc1ccc2c(C3=CCN(CC4CC(F)(F)C4)CC3)c[nH]c2c1	ZINC000450511572	DI	On-Demand	Anodyne	SLC6A4	25	55
CCCC[C@@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511573	CF	On-Demand	Anodyne	TRPV1	30	46
CCCC[C@@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511573	CF	On-Demand	Anodyne	REN	23	41
CCCC[C@@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511573	CF	On-Demand	Anodyne	PCSK5	42	34
CCCC[C@@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511573	CF	On-Demand	Anodyne	FURIN	45	34
CCCC[C@@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511573	CF	On-Demand	Anodyne	PTPRA	61	35
CCCC[C@@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511573	CF	On-Demand	Anodyne	ACAT	0	45
CCCC[C@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511574	CF	On-Demand	Anodyne	TRPV1	30	46
CCCC[C@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511574	CF	On-Demand	Anodyne	REN	23	41
CCCC[C@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511574	CF	On-Demand	Anodyne	PCSK5	42	34
CCCC[C@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511574	CF	On-Demand	Anodyne	FURIN	45	34
CCCC[C@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511574	CF	On-Demand	Anodyne	PTPRA	61	35
CCCC[C@H](C)C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511574	CF	On-Demand	Anodyne	ACAT	0	45
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450511575	GI	On-Demand	Anodyne	COLA	57	36
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450511575	GI	On-Demand	Anodyne	CPT1A	55	36
Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450511576	GI	On-Demand	Anodyne	COLA	57	36
Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450511576	GI	On-Demand	Anodyne	CPT1A	55	36
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	CHRM1	19	44
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	DRD4	27	47
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	ACHE	15	48
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	SLC6A1	41	34
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	DRD3	23	47
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	HTR4	42	38
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	CNR2	16	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	SIGMAR1	29	50
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	CCR3	28	44
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	ABCB1	40	35
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	MCHR1	28	47
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	CCR8	63	36
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511584	FG	On-Demand	Anodyne	DERP1	0	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	CHRM1	19	44
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	DRD4	27	47
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	ACHE	15	48
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	SLC6A1	41	34
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	DRD3	23	47
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	HTR4	42	38
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	CNR2	16	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	SIGMAR1	29	50
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	CCR3	28	44
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	ABCB1	40	35
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	MCHR1	28	47
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	CCR8	63	36
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000450511585	FG	On-Demand	Anodyne	DERP1	0	40
CC(C)(C(=O)N[C@H](CO)Cc1ccc(O)cc1)c1cccc2ccccc12	ZINC000450511591	FH	On-Demand	Anodyne	CCR3	0	43
CC(C)(C)c1ccc2c(c1)CN(C(=O)C1(C(=O)C3CC3)CC1)CC2	ZINC000450511594	EH	On-Demand	Anodyne	CCR2	20	44
CCCCCN(CCCOC)C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450511597	EG	On-Demand	Anodyne	TSPO	19	41
CCCCCN(CCCOC)C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450511597	EG	On-Demand	Anodyne	PLM2_PLAFA	48	32
COc1cc(CNC(=O)C(C)(C)c2ccc(Cl)cc2F)ccc1C(=O)O	ZINC000450511608	GH	On-Demand	Anodyne	U38	0	43
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	DRD2	21	57
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	HRH2	15	43
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	ADRA1D	21	43
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	ADRA1A	17	43
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	ADRA1B	27	43
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	HTR7	31	57
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	CCR3	15	53
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	HTR6	24	57
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	PTGDR	21	41
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	SFRP1	133	44
O=S(=O)(NC1CCN(CC/C=C/c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511610	GH	On-Demand	Anodyne	WNT3	88	39
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	DRD2	21	57
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	HRH2	15	43
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	ADRA1D	21	43
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	ADRA1A	17	43
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	ADRA1B	27	43
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	HTR7	31	57
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	CCR3	15	53
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	HTR6	24	57
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	PTGDR	21	41
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	SFRP1	133	44
O=S(=O)(NC1CCN(CC/C=C\c2ccccc2)CC1)c1ccc(F)cc1	ZINC000450511611	GH	On-Demand	Anodyne	WNT3	88	39
CCC(=O)C1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CC1	ZINC000450511618	CD	On-Demand	Anodyne	OPRM1	20	43
CCC(=O)C1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CC1	ZINC000450511618	CD	On-Demand	Anodyne	GRIA1	42	36
CCC(=O)C1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CC1	ZINC000450511618	CD	On-Demand	Anodyne	YARS	62	35
CCC(=O)C1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CC1	ZINC000450511618	CD	On-Demand	Anodyne	SLC15A2	0	42
CCC(=O)C1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CC1	ZINC000450511618	CD	On-Demand	Anodyne	PCNA	0	40
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	ADRB3	28	43
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	PDE4A	45	44
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	KCNA3	42	39
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	PDE4B	28	44
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	PDE4D	31	44
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	PPARD	15	40
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	PDE4C	16	44
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	MT-ND1	24	40
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	U38	0	42
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC2CCCC2)c1	ZINC000450511628	GH	On-Demand	Anodyne	AKR1C2	50	36
Cc1cc(C)c(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1Br	ZINC000450511634	GG	On-Demand	Anodyne	GRIA1	49	34
Cc1cc(C)c(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1Br	ZINC000450511634	GG	On-Demand	Anodyne	YARS	50	33
Cc1cc(C)c(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1Br	ZINC000450511634	GG	On-Demand	Anodyne	SLC15A2	0	40
Cc1cc(C)c(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1Br	ZINC000450511634	GG	On-Demand	Anodyne	PCNA	0	41
COCc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450511635	GF	On-Demand	Anodyne	FOLH1	40	32
COCc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450511636	GF	On-Demand	Anodyne	FOLH1	40	32
CN(C)C(=O)CC1CCN(C(=O)CCCC(=O)C(C)(C)C)CC1	ZINC000450511644	DE	On-Demand	Anodyne	GNAI1	0	41
CN(C)C(=O)CC1CCN(C(=O)CCCC(=O)C(C)(C)C)CC1	ZINC000450511644	DE	On-Demand	Anodyne	GNAI3	0	43
CN(C)C(=O)CC1CCN(C(=O)CCCC(=O)C(C)(C)C)CC1	ZINC000450511644	DE	On-Demand	Anodyne	GNAO1	0	41
COc1ccc(F)c2[nH]c(C(=O)N[C@@H](CC(=O)O)C3CCCCC3)cc12	ZINC000450511645	FG	On-Demand	Anodyne	NTSR2	48	39
COc1ccc(F)c2[nH]c(C(=O)N[C@H](CC(=O)O)C3CCCCC3)cc12	ZINC000450511646	FG	On-Demand	Anodyne	NTSR2	48	39
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511647	DE	On-Demand	Anodyne	ACE	25	42
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511647	DE	On-Demand	Anodyne	OPRM1	33	45
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511647	DE	On-Demand	Anodyne	GRIA1	41	34
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511647	DE	On-Demand	Anodyne	YARS	68	41
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511647	DE	On-Demand	Anodyne	ACE2	52	42
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511647	DE	On-Demand	Anodyne	SLC15A2	0	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511648	DE	On-Demand	Anodyne	ACE	25	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511648	DE	On-Demand	Anodyne	OPRM1	33	45
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511648	DE	On-Demand	Anodyne	GRIA1	41	34
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511648	DE	On-Demand	Anodyne	YARS	68	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511648	DE	On-Demand	Anodyne	ACE2	52	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450511648	DE	On-Demand	Anodyne	SLC15A2	0	49
CC(C)c1nnc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)s1	ZINC000450511649	FJ	On-Demand	Anodyne	SLC6A4	18	51
COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)c(OC2CCCC2)c1	ZINC000450511650	FI	On-Demand	Anodyne	PDE4A	28	42
COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)c(OC2CCCC2)c1	ZINC000450511650	FI	On-Demand	Anodyne	PDE4B	16	42
COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)c(OC2CCCC2)c1	ZINC000450511650	FI	On-Demand	Anodyne	PDE4D	20	49
COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)c(OC2CCCC2)c1	ZINC000450511650	FI	On-Demand	Anodyne	PYGL	22	41
COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)c(OC2CCCC2)c1	ZINC000450511650	FI	On-Demand	Anodyne	PDE4C	15	42
COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)c(OC2CCCC2)c1	ZINC000450511650	FI	On-Demand	Anodyne	AKR1C3	23	40
COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)c(OC2CCCC2)c1	ZINC000450511650	FI	On-Demand	Anodyne	AKR1C2	52	40
COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)c(OC2CCCC2)c1	ZINC000450511650	FI	On-Demand	Anodyne	GPR35	50	40
COc1ccc(-c2noc(N3CCN(C)[C@H](c4nc(C5CC5)no4)C3)n2)cc1	ZINC000450511651	GE	On-Demand	Anodyne	COLA	0	42
COc1ccc(-c2noc(N3CCN(C)[C@H](c4nc(C5CC5)no4)C3)n2)cc1	ZINC000450511651	GE	On-Demand	Anodyne	CPT1A	18	42
COc1ccc(-c2noc(N3CCN(C)[C@@H](c4nc(C5CC5)no4)C3)n2)cc1	ZINC000450511652	GE	On-Demand	Anodyne	COLA	0	42
COc1ccc(-c2noc(N3CCN(C)[C@@H](c4nc(C5CC5)no4)C3)n2)cc1	ZINC000450511652	GE	On-Demand	Anodyne	CPT1A	18	42
CCC(=O)CCCN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450511653	FG	On-Demand	Anodyne	DRD3	15	40
CCC(=O)CCCN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450511653	FG	On-Demand	Anodyne	MC4R	49	36
CCC(=O)CCCN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450511653	FG	On-Demand	Anodyne	PLA2G2A	24	42
CCC(=O)CCCN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450511653	FG	On-Demand	Anodyne	CYP2J2	48	34
CCC(=O)CCCN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450511654	FG	On-Demand	Anodyne	DRD3	15	40
CCC(=O)CCCN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450511654	FG	On-Demand	Anodyne	MC4R	49	36
CCC(=O)CCCN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450511654	FG	On-Demand	Anodyne	PLA2G2A	24	42
CCC(=O)CCCN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450511654	FG	On-Demand	Anodyne	CYP2J2	48	34
O=C(O)COc1ccc(CCNC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450511660	GG	On-Demand	Anodyne	FFAR1	41	44
O=C(O)COc1ccc(CCNC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450511660	GG	On-Demand	Anodyne	FFAR4	59	44
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450511661	FD	On-Demand	Anodyne	STAT6	47	34
COc1cc(CNC(=O)CCc2ccoc2)ccc1C(=O)O	ZINC000450511668	DE	On-Demand	Anodyne	TRPV1	23	47
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	PLG	30	40
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	F10	26	43
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	MME	41	45
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	ANPEP	28	40
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	TRPV1	25	43
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	TRY2_BOVIN	63	35
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	PPARD	25	48
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	REN	28	42
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	PCSK5	40	34
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	FURIN	46	34
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	PTPRA	45	33
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	ACE2	56	36
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	F7	23	43
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	CTSV	43	29
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	ST14	44	33
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	MT-ND1	27	46
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	AMP1_PLAFQ	44	38
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	CARM1	58	36
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	DRTS_TRYCR	47	33
COc1ccc(C[C@@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511672	FF	On-Demand	Anodyne	PDS	40	34
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	PLG	30	40
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	F10	26	43
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	MME	41	45
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	ANPEP	28	40
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	TRPV1	25	43
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	TRY2_BOVIN	63	35
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	PPARD	25	48
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	REN	28	42
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	PCSK5	40	34
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	FURIN	46	34
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	PTPRA	45	33
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	ACE2	56	36
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	F7	23	43
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	CTSV	43	29
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	ST14	44	33
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	MT-ND1	27	46
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	AMP1_PLAFQ	44	38
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	CARM1	58	36
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	DRTS_TRYCR	47	33
COc1ccc(C[C@H](C)C(=O)NCc2cccc(C(=O)O)c2)cc1OC	ZINC000450511673	FF	On-Demand	Anodyne	PDS	40	34
COc1cc(CC(=O)N2CCN(C(C)C)C(=O)C2)ccc1Cl	ZINC000450511680	DD	On-Demand	Anodyne	OPRK1	38	41
COc1cc(CC(=O)N2CCN(C(C)C)C(=O)C2)ccc1Cl	ZINC000450511680	DD	On-Demand	Anodyne	CCR1	35	42
CN(C)S(=O)(=O)CC(=O)Nc1ccc2c(ccn2CC(=O)O)c1	ZINC000450511685	EC	On-Demand	Anodyne	RORC	43	47
O=C(O)COc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450511696	GH	On-Demand	Anodyne	PPARD	56	44
O=C(O)COc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450511696	GH	On-Demand	Anodyne	EPHX2	32	47
O=C(O)COc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450511696	GH	On-Demand	Anodyne	HIF1A	19	40
CCC[C@@H](O)CN1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	ZINC000450511697	GG	On-Demand	Anodyne	ACOX1	83	36
CCC[C@@H](O)CN1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	ZINC000450511697	GG	On-Demand	Anodyne	ABCB1	24	52
CCC[C@H](O)CN1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	ZINC000450511698	GG	On-Demand	Anodyne	ACOX1	83	36
CCC[C@H](O)CN1CCN(Cc2csc(-c3ccc(OC)cc3)n2)CC1	ZINC000450511698	GG	On-Demand	Anodyne	ABCB1	24	52
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)nc1	ZINC000450511726	FD	On-Demand	Anodyne	SSTR5	45	36
N#CC1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CCC1	ZINC000450511732	EE	On-Demand	Mild	CCR8	51	31
N#CC1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CCC1	ZINC000450511732	EE	On-Demand	Mild	SFRP1	105	40
N#CC1(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)CCC1	ZINC000450511732	EE	On-Demand	Mild	WNT3	81	39
O=C(CCCc1cc(F)ccc1F)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450511736	FG	On-Demand	Anodyne	MME	42	46
O=C(CCCc1cc(F)ccc1F)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450511736	FG	On-Demand	Anodyne	ANPEP	45	34
O=C(CCCc1cc(F)ccc1F)NC[C@H](Cc1ccccc1)C(=O)O	ZINC000450511736	FG	On-Demand	Anodyne	CPA1	60	39
O=C(CCCc1cc(F)ccc1F)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450511737	FG	On-Demand	Anodyne	MME	42	46
O=C(CCCc1cc(F)ccc1F)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450511737	FG	On-Demand	Anodyne	ANPEP	45	34
O=C(CCCc1cc(F)ccc1F)NC[C@@H](Cc1ccccc1)C(=O)O	ZINC000450511737	FG	On-Demand	Anodyne	CPA1	60	39
O=C(Cc1ccc(Cl)c(F)c1)NC1CCC(C(=O)O)CC1	ZINC000450511747	DF	On-Demand	Anodyne	ENV	47	36
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	DRD2	47	48
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	DRD4	67	48
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	ACHE	45	48
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	ADRA1D	44	41
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	ADRA1A	32	41
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	HRH1	26	51
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	ADRA1B	52	41
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	DRD3	32	48
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	KCNH2	15	48
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	HTR4	40	41
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	HTR7	21	44
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	APOB	0	40
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	CHAT	24	40
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	SIGMAR1	54	53
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	SSTR5	95	52
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	BCHE	15	42
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	CCR3	40	61
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	HTR6	24	44
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	UTS2R	32	40
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	MCHR1	39	46
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	CCR8	55	45
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	SFRP1	121	38
COc1cc(CN2CCC(NS(=O)(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450511757	GG	On-Demand	Anodyne	WNT3	77	35
Cn1c(=O)c2cc(C(=O)N[C@H](CO)Cc3ccc(O)cc3)sc2n(C)c1=O	ZINC000450511773	GC	On-Demand	Anodyne	GRIA1	53	35
Cn1c(=O)c2cc(C(=O)N[C@H](CO)Cc3ccc(O)cc3)sc2n(C)c1=O	ZINC000450511773	GC	On-Demand	Anodyne	AKT1	41	33
CC1(O)CC(C(=O)N2CCc3ccc(C(C)(C)C)cc3C2)C1	ZINC000450511784	DG	On-Demand	Anodyne	CCR2	17	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](CC(=O)O)c1ccc(Cl)cc1	ZINC000450511785	EC	On-Demand	Anodyne	UTS2	51	41
CC(C)(C)c1ccc2c(c1)CN(C(=O)CCc1ccc(C(N)=O)cc1)CC2	ZINC000450511787	FH	On-Demand	Anodyne	GPBAR1	24	47
Cc1ccc(C(=O)N2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450511792	DG	On-Demand	Anodyne	L3MBTL3	60	36
Cc1ccc(C(=O)N2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450511792	DG	On-Demand	Anodyne	SLC6A7	0	40
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450511793	DG	On-Demand	Anodyne	L3MBTL3	60	36
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450511793	DG	On-Demand	Anodyne	SLC6A7	0	40
COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)CO2	ZINC000450511794	FE	On-Demand	Anodyne	BMP1	41	33
COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)CO2	ZINC000450511794	FE	On-Demand	Anodyne	MTNR1A	23	49
COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)CO2	ZINC000450511794	FE	On-Demand	Anodyne	ROCK2	34	50
COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)CO2	ZINC000450511794	FE	On-Demand	Anodyne	AKR1C2	47	38
COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)CO2	ZINC000450511795	FE	On-Demand	Anodyne	BMP1	41	33
COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)CO2	ZINC000450511795	FE	On-Demand	Anodyne	MTNR1A	23	49
COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)CO2	ZINC000450511795	FE	On-Demand	Anodyne	ROCK2	34	50
COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)CO2	ZINC000450511795	FE	On-Demand	Anodyne	AKR1C2	47	38
CCCCCN(CCCOC)C(=O)Cc1ccc(O)c(F)c1	ZINC000450511796	DG	On-Demand	Anodyne	INHA	57	32
CO[C@@H](Cc1ccccc1)CN1CCCc2c(C(N)=O)cccc21	ZINC000450511799	DF	On-Demand	Anodyne	FABP4	48	36
CO[C@H](Cc1ccccc1)CN1CCCc2c(C(N)=O)cccc21	ZINC000450511800	DF	On-Demand	Anodyne	FABP4	48	36
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511808	GF	On-Demand	Anodyne	MTNR1A	21	50
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511808	GF	On-Demand	Anodyne	MTNR1B	23	50
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511808	GF	On-Demand	Anodyne	AKR1C2	55	39
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511809	GF	On-Demand	Anodyne	MTNR1A	21	50
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511809	GF	On-Demand	Anodyne	MTNR1B	23	50
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511809	GF	On-Demand	Anodyne	AKR1C2	55	39
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511810	GF	On-Demand	Anodyne	MTNR1A	21	50
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511810	GF	On-Demand	Anodyne	MTNR1B	23	50
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511810	GF	On-Demand	Anodyne	AKR1C2	55	39
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511811	GF	On-Demand	Anodyne	MTNR1A	21	50
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511811	GF	On-Demand	Anodyne	MTNR1B	23	50
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511811	GF	On-Demand	Anodyne	AKR1C2	55	39
CCc1occc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450511813	DE	On-Demand	Anodyne	U38	0	43
CCc1cc(CCCN2CCC(NC(=O)c3ccccc3C)CC2)on1	ZINC000450511814	FG	On-Demand	Anodyne	DRD2	19	43
CCc1cc(CCCN2CCC(NC(=O)c3ccccc3C)CC2)on1	ZINC000450511814	FG	On-Demand	Anodyne	DRD4	27	49
CCc1cc(CCCN2CCC(NC(=O)c3ccccc3C)CC2)on1	ZINC000450511814	FG	On-Demand	Anodyne	HTR2A	25	49
CCc1cc(CCCN2CCC(NC(=O)c3ccccc3C)CC2)on1	ZINC000450511814	FG	On-Demand	Anodyne	INHA	55	33
CCc1cc(CCCN2CCC(NC(=O)c3ccccc3C)CC2)on1	ZINC000450511814	FG	On-Demand	Anodyne	HTR4	48	41
CCc1cc(CCCN2CCC(NC(=O)c3ccccc3C)CC2)on1	ZINC000450511814	FG	On-Demand	Anodyne	CCR8	57	36
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	DRD2	15	41
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	DRD4	44	44
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	ACHE	18	40
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	SIGMAR1	21	41
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	SSTR5	64	46
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	CXCR3	33	42
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	MCHR1	50	43
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	CACNA1I	32	40
CC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1	ZINC000450511827	FK	On-Demand	Anodyne	PTGES	15	40
CC(=O)c1ccc(CN2CCN(Cc3ccc(C(C)=O)cc3)[C@@H](C)C2)cc1	ZINC000450511838	FH	On-Demand	Anodyne	MLNR	48	38
CC(=O)c1ccc(CN2CCN(Cc3ccc(C(C)=O)cc3)[C@H](C)C2)cc1	ZINC000450511839	FH	On-Demand	Anodyne	MLNR	48	38
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1)C(F)(F)F	ZINC000450511843	GH	On-Demand	Anodyne	FAAH	24	41
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1)C(F)(F)F	ZINC000450511843	GH	On-Demand	Anodyne	CCR8	23	42
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450511847	GH	On-Demand	Anodyne	MC4R	40	37
C[C@H](c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1)C(F)(F)F	ZINC000450511848	GH	On-Demand	Anodyne	FAAH	24	41
C[C@H](c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1)C(F)(F)F	ZINC000450511848	GH	On-Demand	Anodyne	CCR8	23	42
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1	ZINC000450511849	GE	On-Demand	Anodyne	FABI	66	45
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1	ZINC000450511849	GE	On-Demand	Anodyne	PLA2G2A	38	45
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1	ZINC000450511849	GE	On-Demand	Anodyne	LSS	20	53
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1	ZINC000450511849	GE	On-Demand	Anodyne	L3MBTL3	42	46
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450511850	GH	On-Demand	Anodyne	MC4R	40	37
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450511851	GH	On-Demand	Anodyne	MC4R	40	37
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450511852	GH	On-Demand	Anodyne	MC4R	40	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC[C@H]1CCCCO1	ZINC000450511861	EF	On-Demand	Anodyne	PFDN6	0	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC[C@@H]1CCCCO1	ZINC000450511862	EF	On-Demand	Anodyne	PFDN6	0	41
COc1ccccc1NC(=O)C1CCN(Cc2cccnc2N)CC1	ZINC000450511864	EF	On-Demand	Anodyne	DRD3	0	42
COc1ccccc1NC(=O)C1CCN(Cc2cccnc2N)CC1	ZINC000450511864	EF	On-Demand	Anodyne	SLC9A1	45	31
CC(=O)c1cccc(CN2CCCc3c(C(N)=O)cccc32)c1	ZINC000450511869	DF	On-Demand	Anodyne	FABP4	42	35
CCC[C@H](O)CN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450511872	DF	On-Demand	Anodyne	DRD3	23	44
CCC[C@H](O)CN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450511872	DF	On-Demand	Anodyne	HTR4	30	46
CCC[C@H](O)CN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450511872	DF	On-Demand	Anodyne	CCR3	28	49
CCC[C@H](O)CN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450511872	DF	On-Demand	Anodyne	ABCB1	40	40
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450511874	DF	On-Demand	Anodyne	DRD3	23	44
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450511874	DF	On-Demand	Anodyne	HTR4	30	46
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450511874	DF	On-Demand	Anodyne	CCR3	28	49
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccccc2OC)CC1	ZINC000450511874	DF	On-Demand	Anodyne	ABCB1	40	40
CCC(CC)Oc1ccc(C(=O)N2CCC(CC(=O)N(C)C)CC2)cc1	ZINC000450511880	FH	On-Demand	Anodyne	LSS	19	41
CCC(CC)Oc1ccc(C(=O)N2CCC(CC(=O)N(C)C)CC2)cc1	ZINC000450511880	FH	On-Demand	Anodyne	L3MBTL3	62	39
CCc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511901	EF	On-Demand	Anodyne	TRPV1	33	48
CCc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511901	EF	On-Demand	Anodyne	U38	0	42
CCc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450511901	EF	On-Demand	Anodyne	CAN2	0	42
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450511903	FG	On-Demand	Anodyne	NPR	40	30
CN(C)S(=O)(=O)CC(=O)Nc1ccc(OCCCC(=O)O)cc1	ZINC000450511906	EC	On-Demand	Anodyne	LTA4H	47	46
CN(C)S(=O)(=O)CC(=O)Nc1ccc(OCCCC(=O)O)cc1	ZINC000450511906	EC	On-Demand	Anodyne	CA1	42	37
CN(C)S(=O)(=O)CC(=O)Nc1ccc(OCCCC(=O)O)cc1	ZINC000450511906	EC	On-Demand	Anodyne	PLA2G4B	50	40
CN(C)S(=O)(=O)CC(=O)Nc1ccc(OCCCC(=O)O)cc1	ZINC000450511906	EC	On-Demand	Anodyne	CA12	25	43
CN(C)S(=O)(=O)CC(=O)Nc1ccc(OCCCC(=O)O)cc1	ZINC000450511906	EC	On-Demand	Anodyne	CA9	25	43
NC(=O)c1ccc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)nc1	ZINC000450511908	GD	On-Demand	Anodyne	DRD4	20	40
NC(=O)c1ccc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)nc1	ZINC000450511908	GD	On-Demand	Anodyne	SMO	26	51
CS(=O)(=O)c1cccc(CN2CCCc3cc(F)c(F)cc32)c1	ZINC000450511909	EG	On-Demand	Anodyne	TYMS	0	44
CS(=O)(=O)c1cccc(CN2CCCc3cc(F)c(F)cc32)c1	ZINC000450511909	EG	On-Demand	Anodyne	C3SWJ7_ECOLX	0	43
CCCCCN(CCCOC)C(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450511910	EH	On-Demand	Anodyne	TSPO	23	60
O=C(CCCc1cc(F)ccc1F)NCc1nc(C(=O)O)cs1	ZINC000450511942	EF	On-Demand	Anodyne	SUCNR1	41	38
CC1(O)CC(C(=O)Nc2cccnc2OCC(F)F)C1	ZINC000450511966	CD	On-Demand	Anodyne	P2RY1	50	34
CC1(O)CC(C(=O)Nc2cccnc2OCC(F)F)C1	ZINC000450511966	CD	On-Demand	Anodyne	G2YM83_BOTF4	51	32
Cc1ccc(F)c(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450511975	DE	On-Demand	Anodyne	GRIA1	49	36
Cc1ccc(F)c(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450511975	DE	On-Demand	Anodyne	SLC15A2	0	40
Cc1ccc(F)c(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450511975	DE	On-Demand	Anodyne	PCNA	0	43
CCS(=O)(=O)c1ccc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)cc1	ZINC000450511979	GI	On-Demand	Anodyne	HTR1A	0	51
CCS(=O)(=O)c1ccc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)cc1	ZINC000450511979	GI	On-Demand	Anodyne	SLC6A4	24	51
C=CC(C)(C)C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450511981	CI	On-Demand	Mild	HDAC6	15	48
COc1cc(CNC(=O)C2(OC)CCC2)ccc1C(=O)O	ZINC000450511982	CD	On-Demand	Anodyne	ABCC8	23	40
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	CACNA1H	55	38
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	DRD2	15	44
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	DRD4	25	42
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	HTR1D	23	44
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	HTR1B	21	44
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	SIGMAR1	22	42
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	CCR3	78	40
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	ABCC1	45	33
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	MCHR1	41	44
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511983	GH	On-Demand	Anodyne	BIRC2	64	39
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	CACNA1H	55	38
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	DRD2	15	44
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	DRD4	25	42
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	HTR1D	23	44
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	HTR1B	21	44
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	SIGMAR1	22	42
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	CCR3	78	40
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	ABCC1	45	33
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	MCHR1	41	44
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450511984	GH	On-Demand	Anodyne	BIRC2	64	39
Cc1ccccc1C(=O)NC1CCN(CC2=CCCCC2)CC1	ZINC000450511987	DH	On-Demand	Anodyne	DRD4	24	53
Cc1ccccc1C(=O)NC1CCN(CC2=CCCCC2)CC1	ZINC000450511987	DH	On-Demand	Anodyne	SLC6A1	42	35
Cc1ccccc1C(=O)NC1CCN(CC2=CCCCC2)CC1	ZINC000450511987	DH	On-Demand	Anodyne	SIGMAR1	26	49
Cc1ccccc1C(=O)NC1CCN(CC2=CCCCC2)CC1	ZINC000450511987	DH	On-Demand	Anodyne	CCR3	24	43
Cc1ccccc1C(=O)NC1CCN(CC2=CCCCC2)CC1	ZINC000450511987	DH	On-Demand	Anodyne	MCHR1	37	43
Cc1ccccc1C(=O)NC1CCN(CC2=CCCCC2)CC1	ZINC000450511987	DH	On-Demand	Anodyne	CCR8	45	38
O=C(NC[C@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1)c1ccco1	ZINC000450511988	GI	On-Demand	Anodyne	CCR3	18	44
O=C(NC[C@@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1)c1ccco1	ZINC000450511989	GI	On-Demand	Anodyne	CCR3	18	44
CC(C)O[C@]1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CCOC1	ZINC000450511994	DC	On-Demand	Anodyne	YARS	59	32
CC(C)O[C@@]1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CCOC1	ZINC000450511995	DC	On-Demand	Anodyne	YARS	59	32
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450512000	GD	On-Demand	Anodyne	CXCR3	21	42
O=S(=O)(NC1CCN(C[C@@H]2CCCCC2(F)F)CC1)c1ccccc1	ZINC000450512001	FG	On-Demand	Anodyne	HTR6	15	48
O=S(=O)(NC1CCN(C[C@@H]2CCCCC2(F)F)CC1)c1ccccc1	ZINC000450512001	FG	On-Demand	Anodyne	CCR8	73	36
O=S(=O)(NC1CCN(C[C@@H]2CCCCC2(F)F)CC1)c1ccccc1	ZINC000450512001	FG	On-Demand	Anodyne	SFRP1	116	43
O=S(=O)(NC1CCN(C[C@@H]2CCCCC2(F)F)CC1)c1ccccc1	ZINC000450512001	FG	On-Demand	Anodyne	WNT3	90	42
O=S(=O)(NC1CCN(C[C@H]2CCCCC2(F)F)CC1)c1ccccc1	ZINC000450512002	FG	On-Demand	Anodyne	HTR6	15	48
O=S(=O)(NC1CCN(C[C@H]2CCCCC2(F)F)CC1)c1ccccc1	ZINC000450512002	FG	On-Demand	Anodyne	CCR8	73	36
O=S(=O)(NC1CCN(C[C@H]2CCCCC2(F)F)CC1)c1ccccc1	ZINC000450512002	FG	On-Demand	Anodyne	SFRP1	116	43
O=S(=O)(NC1CCN(C[C@H]2CCCCC2(F)F)CC1)c1ccccc1	ZINC000450512002	FG	On-Demand	Anodyne	WNT3	90	42
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450512017	EG	On-Demand	Anodyne	SLC6A1	0	41
CC(C)N1CCN(C(=O)c2cc(Cl)c(Br)cc2F)CC1=O	ZINC000450512018	GF	On-Demand	Anodyne	P2RX7	32	58
CN(C)C(=O)CC1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450512020	EG	On-Demand	Anodyne	SLC6A1	0	41
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450512022	EG	On-Demand	Anodyne	SLC6A1	0	41
CN(C)C(=O)CC1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450512024	EG	On-Demand	Anodyne	SLC6A1	0	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512025	GH	On-Demand	Anodyne	DRD4	18	52
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512025	GH	On-Demand	Anodyne	SIGMAR1	21	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512025	GH	On-Demand	Anodyne	CCR3	90	49
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512025	GH	On-Demand	Anodyne	CCR5	17	48
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512025	GH	On-Demand	Anodyne	PLD1	40	37
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512025	GH	On-Demand	Anodyne	EPHX2	61	48
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512025	GH	On-Demand	Anodyne	CXCR3	22	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512025	GH	On-Demand	Anodyne	MCHR1	26	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512026	GH	On-Demand	Anodyne	DRD4	18	52
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512026	GH	On-Demand	Anodyne	SIGMAR1	21	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512026	GH	On-Demand	Anodyne	CCR3	90	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512026	GH	On-Demand	Anodyne	CCR5	17	48
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512026	GH	On-Demand	Anodyne	PLD1	40	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512026	GH	On-Demand	Anodyne	EPHX2	61	48
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512026	GH	On-Demand	Anodyne	CXCR3	22	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512026	GH	On-Demand	Anodyne	MCHR1	26	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512027	GH	On-Demand	Anodyne	DRD4	18	52
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512027	GH	On-Demand	Anodyne	SIGMAR1	21	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512027	GH	On-Demand	Anodyne	CCR3	90	49
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512027	GH	On-Demand	Anodyne	CCR5	17	48
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512027	GH	On-Demand	Anodyne	PLD1	40	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512027	GH	On-Demand	Anodyne	EPHX2	61	48
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512027	GH	On-Demand	Anodyne	CXCR3	22	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512027	GH	On-Demand	Anodyne	MCHR1	26	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512028	GH	On-Demand	Anodyne	DRD4	18	52
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512028	GH	On-Demand	Anodyne	SIGMAR1	21	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512028	GH	On-Demand	Anodyne	CCR3	90	49
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512028	GH	On-Demand	Anodyne	CCR5	17	48
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512028	GH	On-Demand	Anodyne	PLD1	40	37
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512028	GH	On-Demand	Anodyne	EPHX2	61	48
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512028	GH	On-Demand	Anodyne	CXCR3	22	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512028	GH	On-Demand	Anodyne	MCHR1	26	40
CCC[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1CCOC	ZINC000450512033	GE	On-Demand	Anodyne	CCR3	20	40
CCC[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1CCOC	ZINC000450512033	GE	On-Demand	Anodyne	EPHX2	17	44
CNc1nc(N2CCC[C@@H](CNC(=O)c3ccco3)C2)nc2ccccc12	ZINC000450512040	FE	On-Demand	Anodyne	HTR3A	17	48
CCC[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1CCOC	ZINC000450512041	GE	On-Demand	Anodyne	CCR3	20	40
CCC[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1CCOC	ZINC000450512041	GE	On-Demand	Anodyne	EPHX2	17	44
CNc1nc(N2CCC[C@H](CNC(=O)c3ccco3)C2)nc2ccccc12	ZINC000450512043	FE	On-Demand	Anodyne	HTR3A	17	48
O=C(O)[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512045	FF	On-Demand	Anodyne	MME	58	40
O=C(O)[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512045	FF	On-Demand	Anodyne	ANPEP	51	33
O=C(O)[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512045	FF	On-Demand	Anodyne	CPA1	66	40
O=C(O)[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512045	FF	On-Demand	Anodyne	NAALAD2	28	40
O=C(O)[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512045	FF	On-Demand	Anodyne	CPA3	0	40
O=C(O)[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512046	FF	On-Demand	Anodyne	MME	58	40
O=C(O)[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512046	FF	On-Demand	Anodyne	ANPEP	51	33
O=C(O)[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512046	FF	On-Demand	Anodyne	CPA1	66	40
O=C(O)[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512046	FF	On-Demand	Anodyne	NAALAD2	28	40
O=C(O)[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1ccccc1	ZINC000450512046	FF	On-Demand	Anodyne	CPA3	0	40
Brc1ccc2c(N3C[C@H]4COC[C@@H](C3)O4)ncnc2c1	ZINC000450512049	ED	On-Demand	Anodyne	PDE3B	51	31
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	HTR1A	48	44
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	DRD4	31	43
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	ADRA1A	30	41
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	DRD3	40	41
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	HTR4	47	54
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	CHRM3	19	41
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	HTR7	45	38
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	SIGMAR1	20	42
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	CCR3	31	43
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	CCR5	42	40
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	MCHR1	15	41
COc1ccccc1NC(=O)C1CCN(CC[C@@H](C)O)CC1	ZINC000450512050	DE	On-Demand	Anodyne	CACNA1G	36	43
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	HTR1A	48	44
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	DRD4	31	43
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	ADRA1A	30	41
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	DRD3	40	41
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	HTR4	47	54
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	CHRM3	19	41
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	HTR7	45	38
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	SIGMAR1	20	42
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	CCR3	31	43
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	CCR5	42	40
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	MCHR1	15	41
COc1ccccc1NC(=O)C1CCN(CC[C@H](C)O)CC1	ZINC000450512051	DE	On-Demand	Anodyne	CACNA1G	36	43
Cc1ccccc1C(=O)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512053	GG	On-Demand	Anodyne	DRD4	26	51
Cc1ccccc1C(=O)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512053	GG	On-Demand	Anodyne	SIGMAR1	21	49
Cc1ccccc1C(=O)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512053	GG	On-Demand	Anodyne	SSTR5	46	37
Cc1ccccc1C(=O)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512053	GG	On-Demand	Anodyne	CCR3	17	42
Cc1ccccc1C(=O)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512053	GG	On-Demand	Anodyne	MCHR1	40	43
Cc1ccccc1C(=O)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512053	GG	On-Demand	Anodyne	CCR8	59	33
Cc1ccccc1C(=O)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512053	GG	On-Demand	Anodyne	HPGDS	39	46
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	HTR1A	15	44
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	CHRM1	25	46
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	DRD2	33	58
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	DRD4	33	58
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	ACHE	22	45
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	HTR1D	25	43
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	HTR1B	24	43
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	HTR2A	27	43
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	HTR2C	17	48
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	GNRHR	43	35
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	DRD3	17	41
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	KCNH2	17	40
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	LTA4H	36	42
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	HTR7	19	41
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	TACR2	28	40
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	SIGMAR1	54	51
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	NPY1R	37	41
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	NPY2R	41	49
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	CCR1	15	42
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	CCR3	153	52
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	CCR5	42	51
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	CHRNA7	23	44
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	NPY5R	19	49
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	CYP2D6	21	41
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	SLC6A5	29	40
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	EPHX2	68	55
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	CXCR3	24	45
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	MCHR1	70	46
CN(CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450512054	GH	On-Demand	Anodyne	CACNA1G	49	43
COc1cc(CNC(=O)Cc2cccc(OCC(F)(F)F)c2)ccc1C(=O)O	ZINC000450512063	GG	On-Demand	Anodyne	PPARG	22	47
COc1cc(CNC(=O)Cc2cccc(OCC(F)(F)F)c2)ccc1C(=O)O	ZINC000450512063	GG	On-Demand	Anodyne	PPARA	30	47
COc1cc(CNC(=O)Cc2cccc(OCC(F)(F)F)c2)ccc1C(=O)O	ZINC000450512063	GG	On-Demand	Anodyne	ABCC8	20	42
COc1cc(CNC(=O)Cc2cccc(OCC(F)(F)F)c2)ccc1C(=O)O	ZINC000450512063	GG	On-Demand	Anodyne	TRPV1	28	44
COc1cc(CNC(=O)Cc2cccc(OCC(F)(F)F)c2)ccc1C(=O)O	ZINC000450512063	GG	On-Demand	Anodyne	PPARD	40	47
COc1cc(CNC(=O)Cc2cccc(OCC(F)(F)F)c2)ccc1C(=O)O	ZINC000450512063	GG	On-Demand	Anodyne	HCRTR2	15	42
COc1cc(CNC(=O)Cc2cccc(OCC(F)(F)F)c2)ccc1C(=O)O	ZINC000450512063	GG	On-Demand	Anodyne	CARM1	40	34
COc1cc(CNC(=O)Cc2cccc(OCC(F)(F)F)c2)ccc1C(=O)O	ZINC000450512063	GG	On-Demand	Anodyne	PDS	68	39
CC(C)N1CCN(C(=O)c2cccc3c2CCCC3)CC1=O	ZINC000450512074	DE	On-Demand	Anodyne	P2RX7	29	62
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C[C@H]1C	ZINC000450512078	GG	On-Demand	Anodyne	SLC6A3	15	42
C[C@H]1CN(C[C@@H](O)[C@H](C)c2ccccc2)CCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450512079	GG	On-Demand	Anodyne	SLC6A3	15	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C[C@@H]1C	ZINC000450512080	GG	On-Demand	Anodyne	SLC6A3	15	42
COc1cc(C)c(C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)cc1OC	ZINC000450512081	EH	On-Demand	Anodyne	CPT2	40	33
COc1cc(C)c(C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)cc1OC	ZINC000450512081	EH	On-Demand	Anodyne	KCNK3	34	40
COc1cc(C)c(C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)cc1OC	ZINC000450512081	EH	On-Demand	Anodyne	KCNK9	30	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)[C@H](C)C1	ZINC000450512082	GG	On-Demand	Anodyne	SLC6A3	15	42
CCCCCN(CCCOC)C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450512085	EH	On-Demand	Anodyne	TSPO	56	47
Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)ncc1C(N)=O	ZINC000450512110	GD	On-Demand	Mild	FASN	41	36
Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)ncc1C(N)=O	ZINC000450512111	GD	On-Demand	Mild	FASN	41	36
CC(C)[C@@H](Nc1ncnc2cc(Br)ccc12)c1ncc[nH]1	ZINC000450512124	EH	On-Demand	Anodyne	EGFR	41	38
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450512126	GH	On-Demand	Anodyne	CCR3	50	39
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450512127	GH	On-Demand	Anodyne	CCR3	50	39
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450512128	GH	On-Demand	Anodyne	CCR3	50	39
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450512129	GH	On-Demand	Anodyne	CCR3	50	39
CC(C)[C@H](Nc1ncnc2cc(Br)ccc12)c1ncc[nH]1	ZINC000450512131	EH	On-Demand	Anodyne	EGFR	41	38
COCCOC[C@H](O)CN1CCCc2c(C(N)=O)cccc21	ZINC000450512141	DC	On-Demand	Anodyne	ABCB1	45	38
COCCOC[C@@H](O)CN1CCCc2c(C(N)=O)cccc21	ZINC000450512142	DC	On-Demand	Anodyne	ABCB1	45	38
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450512144	GG	On-Demand	Anodyne	OPRK1	0	50
COc1cc(CNC(=O)CCCc2cc(F)ccc2F)ccc1C(=O)O	ZINC000450512145	FG	On-Demand	Anodyne	GRIN2B	17	42
COc1cc(CNC(=O)CCCc2cc(F)ccc2F)ccc1C(=O)O	ZINC000450512145	FG	On-Demand	Anodyne	HTR7	19	41
COc1cc(CNC(=O)CCCc2cc(F)ccc2F)ccc1C(=O)O	ZINC000450512145	FG	On-Demand	Anodyne	TRPV1	18	47
COc1cc(CNC(=O)CCCc2cc(F)ccc2F)ccc1C(=O)O	ZINC000450512145	FG	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1cccc(Oc2ccc(C(=O)NCCCOCCO)nc2)c1	ZINC000450512181	EE	On-Demand	Anodyne	DRD4	44	33
COc1cccc(Oc2ccc(C(=O)NCCCOCCO)nc2)c1	ZINC000450512181	EE	On-Demand	Anodyne	MTNR1A	48	37
COc1cccc(Oc2ccc(C(=O)NCCCOCCO)nc2)c1	ZINC000450512181	EE	On-Demand	Anodyne	MTNR1B	46	41
COc1cccc(Oc2ccc(C(=O)NCCCOCCO)nc2)c1	ZINC000450512181	EE	On-Demand	Anodyne	CRTM	41	36
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450512188	FJ	On-Demand	Mild	CTSF	46	33
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450512189	FJ	On-Demand	Mild	CTSF	46	33
CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450512190	FJ	On-Demand	Mild	CTSF	46	33
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450512191	FJ	On-Demand	Mild	CTSF	46	33
CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450512196	GF	On-Demand	Bother	CPA1	18	43
CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450512196	GF	On-Demand	Bother	PDS	45	39
CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450512197	GF	On-Demand	Bother	CPA1	18	43
CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450512197	GF	On-Demand	Bother	PDS	45	39
CC(C)(CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450512200	CD	On-Demand	Anodyne	CXCL8	18	43
O=C(Cc1ccc(OC(F)F)c(F)c1)Nc1cccnc1OCC(F)F	ZINC000450512201	GH	On-Demand	Anodyne	P2RY1	32	40
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(C2CC2)nc1C	ZINC000450512206	EI	On-Demand	Anodyne	AVPR2	41	44
COc1ccc2c(c1)CCCCN2C(=O)c1ccsc1C	ZINC000450512209	DI	On-Demand	Anodyne	SRD5A1	0	40
COc1ccc2c(c1)CCCCN2C(=O)c1ccsc1C	ZINC000450512209	DI	On-Demand	Anodyne	AVPR2	43	45
COCc1cccc(CC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450512218	FF	On-Demand	Anodyne	CPA1	49	38
COCc1cccc(CC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450512219	FF	On-Demand	Anodyne	CPA1	49	38
C[C@H](Oc1ccccn1)C(=O)Nc1cccnc1OCC(F)F	ZINC000450512233	DF	On-Demand	Anodyne	P2RY1	48	39
C[C@@H](Oc1ccccn1)C(=O)Nc1cccnc1OCC(F)F	ZINC000450512234	DF	On-Demand	Anodyne	P2RY1	48	39
CCC1(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)CC1	ZINC000450512263	CE	On-Demand	Anodyne	CPA1	58	42
CCC1(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)CC1	ZINC000450512264	CE	On-Demand	Anodyne	CPA1	58	42
CC1(C(=O)Nc2ccc(OCCCC(=O)O)cc2)CC1	ZINC000450512270	CF	On-Demand	Anodyne	LTA4H	40	42
CC1(C(=O)Nc2ccc(OCCCC(=O)O)cc2)CC1	ZINC000450512270	CF	On-Demand	Anodyne	PLA2G4B	68	42
CCc1cccc(C(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)n1	ZINC000450512271	EH	On-Demand	Anodyne	COLA	80	35
CCc1cccc(C(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)n1	ZINC000450512271	EH	On-Demand	Anodyne	CPT1A	78	35
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)n1	ZINC000450512272	EH	On-Demand	Anodyne	COLA	80	35
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)n1	ZINC000450512272	EH	On-Demand	Anodyne	CPT1A	78	35
COc1cc(Cl)c(C(=O)N2CC[C@](C)(C(=O)O)C2)cc1OC	ZINC000450512275	EE	On-Demand	Anodyne	TACR2	19	40
COc1cc(Cl)c(C(=O)N2CC[C@@](C)(C(=O)O)C2)cc1OC	ZINC000450512276	EE	On-Demand	Anodyne	TACR2	19	40
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	HTR1A	19	46
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	DRD4	21	44
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	HTR2A	22	51
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	DRD3	15	46
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	TBXAS1	55	44
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	HTR7	30	43
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	FAAH	18	44
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	TGM2	30	43
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	F13A1	28	43
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	AKR1C3	51	37
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	CYP2J2	55	39
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1	ZINC000450512281	FE	On-Demand	Anodyne	NAMPT	49	39
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512289	GH	On-Demand	Anodyne	HTR1A	15	42
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512289	GH	On-Demand	Anodyne	DRD4	21	45
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512289	GH	On-Demand	Anodyne	DRD3	15	45
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512289	GH	On-Demand	Anodyne	HTR4	19	44
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512289	GH	On-Demand	Anodyne	CCR3	18	46
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512290	GH	On-Demand	Anodyne	HTR1A	15	42
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512290	GH	On-Demand	Anodyne	DRD4	21	45
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512290	GH	On-Demand	Anodyne	DRD3	15	45
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512290	GH	On-Demand	Anodyne	HTR4	19	44
COc1ccccc1NC(=O)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512290	GH	On-Demand	Anodyne	CCR3	18	46
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512291	GH	On-Demand	Anodyne	HTR1A	15	42
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512291	GH	On-Demand	Anodyne	DRD4	21	45
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512291	GH	On-Demand	Anodyne	DRD3	15	45
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512291	GH	On-Demand	Anodyne	HTR4	19	44
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450512291	GH	On-Demand	Anodyne	CCR3	18	46
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512292	GH	On-Demand	Anodyne	HTR1A	15	42
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512292	GH	On-Demand	Anodyne	DRD4	21	45
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512292	GH	On-Demand	Anodyne	DRD3	15	45
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512292	GH	On-Demand	Anodyne	HTR4	19	44
COc1ccccc1NC(=O)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450512292	GH	On-Demand	Anodyne	CCR3	18	46
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	DRD2	38	43
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	DRD4	56	49
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	ACHE	38	48
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	HRH1	24	48
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	DRD3	29	47
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	HTR4	25	46
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	LTA4H	21	41
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	SIGMAR1	48	44
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	SSTR5	53	39
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	CCR3	48	43
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	SLC18A3	22	40
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	MCHR1	47	45
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	CACNA1G	45	44
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	CCR8	32	41
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	MBTPS1	42	34
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450512295	FH	On-Demand	Anodyne	NOD2	42	39
CCCCCN(CCCOC)C(=O)c1ccc2nccnc2n1	ZINC000450512297	DF	On-Demand	Anodyne	TSPO	19	41
O=C(Cc1ccc(OC(F)F)c(F)c1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512298	FE	On-Demand	Anodyne	YARS	47	31
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512310	GG	On-Demand	Anodyne	SIGMAR1	22	45
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512310	GG	On-Demand	Anodyne	CCR3	53	46
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512310	GG	On-Demand	Anodyne	EPHX2	52	45
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512310	GG	On-Demand	Anodyne	CXCR3	26	42
O=C(Nc1ccc(F)cc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450512310	GG	On-Demand	Anodyne	MCHR1	32	43
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	DRD2	23	43
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	DRD4	29	43
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	HRH1	16	48
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	DRD3	22	43
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	HTR4	22	46
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	SIGMAR1	24	46
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	SSTR5	39	40
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	CCR3	41	43
COc1ccccc1NC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450512311	GI	On-Demand	Anodyne	CACNA1G	38	52
COc1ccc2c(c1)C[C@H](C(=O)N[C@H](CC(=O)O)C1CCCCC1)CO2	ZINC000450512313	FF	On-Demand	Anodyne	ROCK2	33	50
COc1ccc2c(c1)C[C@H](C(=O)N[C@H](CC(=O)O)C1CCCCC1)CO2	ZINC000450512313	FF	On-Demand	Anodyne	CDC42BPA	0	45
COc1ccc2c(c1)C[C@@H](C(=O)N[C@H](CC(=O)O)C1CCCCC1)CO2	ZINC000450512314	FF	On-Demand	Anodyne	ROCK2	33	50
COc1ccc2c(c1)C[C@@H](C(=O)N[C@H](CC(=O)O)C1CCCCC1)CO2	ZINC000450512314	FF	On-Demand	Anodyne	CDC42BPA	0	45
COc1ccc2c(c1)C[C@H](C(=O)N[C@@H](CC(=O)O)C1CCCCC1)CO2	ZINC000450512315	FF	On-Demand	Anodyne	ROCK2	33	50
COc1ccc2c(c1)C[C@H](C(=O)N[C@@H](CC(=O)O)C1CCCCC1)CO2	ZINC000450512315	FF	On-Demand	Anodyne	CDC42BPA	0	45
COc1ccc2c(c1)C[C@@H](C(=O)N[C@@H](CC(=O)O)C1CCCCC1)CO2	ZINC000450512316	FF	On-Demand	Anodyne	ROCK2	33	50
COc1ccc2c(c1)C[C@@H](C(=O)N[C@@H](CC(=O)O)C1CCCCC1)CO2	ZINC000450512316	FF	On-Demand	Anodyne	CDC42BPA	0	45
COc1cccc(OCCC(=O)N(C)CC2CCN(c3ccncc3)CC2)c1	ZINC000450512317	GG	On-Demand	Anodyne	DRD4	43	36
COc1cccc(OCCC(=O)N(C)CC2CCN(c3ccncc3)CC2)c1	ZINC000450512317	GG	On-Demand	Anodyne	F10	18	45
Cc1ccccc1C(=O)NC1CCN([C@H](C)c2csnn2)CC1	ZINC000450512333	EF	On-Demand	Anodyne	CCR8	55	34
Cc1ccccc1C(=O)NC1CCN([C@@H](C)c2csnn2)CC1	ZINC000450512334	EF	On-Demand	Anodyne	CCR8	55	34
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	ACE	35	47
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	OPRM1	47	50
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	OPRD1	42	49
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	MME	102	48
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	ANPEP	83	40
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	FCER2	49	38
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	KLK3	48	32
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	CTSL	18	40
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	CPA1	35	43
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	SLC15A1	0	40
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	HLA-A	57	35
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	CAPNS1	50	35
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	PDYN	0	46
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	MMP2	19	43
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	MMP3	31	42
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	MMP8	35	45
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	GRIA1	44	35
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	YARS	70	42
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	CAPN1	46	37
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	MMP9	20	47
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	CAPN2	63	36
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	ACE2	61	43
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	MMP7	33	43
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	MMP1	29	43
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	FPR1	52	39
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	POL	0	46
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	NPR	52	44
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	SLC15A2	0	55
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CC(C)CC(CC(C)C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512336	DG	On-Demand	Anodyne	PCNA	0	43
CCCCCN(CCCOC)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450512345	EH	On-Demand	Anodyne	P2RY12	163	40
CCCCCN(CCCOC)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450512345	EH	On-Demand	Anodyne	TSPO	44	55
CCCCCN(CCCOC)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450512345	EH	On-Demand	Anodyne	CCKAR	0	45
CCCCCN(CCCOC)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450512345	EH	On-Demand	Anodyne	ACAT	0	40
CCCCCN(CCCOC)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450512345	EH	On-Demand	Anodyne	AGER	0	49
COc1cc(CNC(=O)c2csc(C)c2C)ccc1C(=O)O	ZINC000450512346	DG	On-Demand	Anodyne	U38	0	44
CCC1CCC(NC(=O)c2cc(OC)c(OC)cc2Cl)(C(=O)O)CC1	ZINC000450512351	FH	On-Demand	Anodyne	HTR4	51	37
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000450512360	GJ	On-Demand	Mild	CTSF	67	37
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000450512361	GJ	On-Demand	Mild	CTSF	67	37
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000450512362	GJ	On-Demand	Mild	CTSF	67	37
CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000450512363	GJ	On-Demand	Mild	CTSF	67	37
COCc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450512366	EE	On-Demand	Anodyne	ABCC8	19	43
COCc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450512366	EE	On-Demand	Anodyne	TRPV1	31	47
COCc1cccc(CC(=O)NCc2ccc(C(=O)O)c(OC)c2)c1	ZINC000450512366	EE	On-Demand	Anodyne	NCE103	17	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C(C)C)C(=O)C3)ccc21	ZINC000450512374	GF	On-Demand	Anodyne	PLK1	43	32
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C(C)C)C(=O)C3)ccc21	ZINC000450512374	GF	On-Demand	Anodyne	HPGD	59	69
CN1CCO[C@H]2CCN(c3ncnc4cc(Br)ccc34)C[C@H]21	ZINC000450512377	FE	On-Demand	Anodyne	PDE3A	48	36
CN1CCO[C@H]2CCN(c3ncnc4cc(Br)ccc34)C[C@H]21	ZINC000450512377	FE	On-Demand	Anodyne	PDE3B	47	36
CN1CCO[C@H]2CCN(c3ncnc4cc(Br)ccc34)C[C@@H]21	ZINC000450512378	FE	On-Demand	Anodyne	PDE3A	48	36
CN1CCO[C@H]2CCN(c3ncnc4cc(Br)ccc34)C[C@@H]21	ZINC000450512378	FE	On-Demand	Anodyne	PDE3B	47	36
CN1CCO[C@@H]2CCN(c3ncnc4cc(Br)ccc34)C[C@H]21	ZINC000450512379	FE	On-Demand	Anodyne	PDE3A	48	36
CN1CCO[C@@H]2CCN(c3ncnc4cc(Br)ccc34)C[C@H]21	ZINC000450512379	FE	On-Demand	Anodyne	PDE3B	47	36
CN1CCO[C@@H]2CCN(c3ncnc4cc(Br)ccc34)C[C@@H]21	ZINC000450512380	FE	On-Demand	Anodyne	PDE3A	48	36
CN1CCO[C@@H]2CCN(c3ncnc4cc(Br)ccc34)C[C@@H]21	ZINC000450512380	FE	On-Demand	Anodyne	PDE3B	47	36
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450512388	CI	On-Demand	Anodyne	PREP	44	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450512389	CI	On-Demand	Anodyne	PREP	44	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450512390	CI	On-Demand	Anodyne	PREP	44	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450512391	CI	On-Demand	Anodyne	PREP	44	41
CN(CC(=O)N1CCC(C(=O)O)CC1)C(=O)CCCc1cc(F)ccc1F	ZINC000450512392	GE	On-Demand	Anodyne	DPP4	20	41
COc1ccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)cc1S(C)(=O)=O	ZINC000450512401	GG	On-Demand	Anodyne	MTNR1B	32	40
COc1ccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)cc1S(C)(=O)=O	ZINC000450512401	GG	On-Demand	Anodyne	SFRP1	47	32
COc1ccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)cc1S(C)(=O)=O	ZINC000450512401	GG	On-Demand	Anodyne	WNT3	40	32
COc1ccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)cc1S(C)(=O)=O	ZINC000450512401	GG	On-Demand	Anodyne	ACKR3	51	37
COc1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)cc1S(C)(=O)=O	ZINC000450512402	GG	On-Demand	Anodyne	MTNR1B	32	40
COc1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)cc1S(C)(=O)=O	ZINC000450512402	GG	On-Demand	Anodyne	SFRP1	47	32
COc1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)cc1S(C)(=O)=O	ZINC000450512402	GG	On-Demand	Anodyne	WNT3	40	32
COc1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)cc1S(C)(=O)=O	ZINC000450512402	GG	On-Demand	Anodyne	ACKR3	51	37
COc1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cc1S(C)(=O)=O	ZINC000450512403	GG	On-Demand	Anodyne	MTNR1B	32	40
COc1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cc1S(C)(=O)=O	ZINC000450512403	GG	On-Demand	Anodyne	SFRP1	47	32
COc1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cc1S(C)(=O)=O	ZINC000450512403	GG	On-Demand	Anodyne	WNT3	40	32
COc1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cc1S(C)(=O)=O	ZINC000450512403	GG	On-Demand	Anodyne	ACKR3	51	37
COc1ccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cc1S(C)(=O)=O	ZINC000450512404	GG	On-Demand	Anodyne	MTNR1B	32	40
COc1ccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cc1S(C)(=O)=O	ZINC000450512404	GG	On-Demand	Anodyne	SFRP1	47	32
COc1ccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cc1S(C)(=O)=O	ZINC000450512404	GG	On-Demand	Anodyne	WNT3	40	32
COc1ccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cc1S(C)(=O)=O	ZINC000450512404	GG	On-Demand	Anodyne	ACKR3	51	37
CC(C)N(CCN(C)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(C)C	ZINC000450512409	GF	On-Demand	Anodyne	PIK3CD	24	43
CC(C)N(CCN(C)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(C)C	ZINC000450512409	GF	On-Demand	Anodyne	PIK3CB	39	43
Cc1cc(NC(=O)C2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)no1	ZINC000450512410	FE	On-Demand	Anodyne	CASR	16	46
Cc1cc(NC(=O)C2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)no1	ZINC000450512410	FE	On-Demand	Anodyne	CCR5	26	41
Cc1cc(NC(=O)C2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)no1	ZINC000450512411	FE	On-Demand	Anodyne	CASR	16	46
Cc1cc(NC(=O)C2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)no1	ZINC000450512411	FE	On-Demand	Anodyne	CCR5	26	41
Cc1cc(NC(=O)C2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)no1	ZINC000450512412	FE	On-Demand	Anodyne	CASR	16	46
Cc1cc(NC(=O)C2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)no1	ZINC000450512412	FE	On-Demand	Anodyne	CCR5	26	41
Cc1cc(NC(=O)C2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)no1	ZINC000450512413	FE	On-Demand	Anodyne	CASR	16	46
Cc1cc(NC(=O)C2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)no1	ZINC000450512413	FE	On-Demand	Anodyne	CCR5	26	41
CC(C)N1CCN(C(=O)c2cc(Cl)c(F)cc2Br)CC1=O	ZINC000450512414	GF	On-Demand	Anodyne	P2RX7	32	58
Cc1nc(NCc2cc(C(F)(F)F)cc(S(C)(=O)=O)c2)ncc1[N+](=O)[O-]	ZINC000450512419	GE	On-Demand	Bother	PTGS2	19	43
CS(=O)(=O)c1ccc2c(c1)CCN(c1ncc(C(F)F)cn1)CC2	ZINC000450512426	FE	On-Demand	Anodyne	GPR119	30	44
CC(C)(COCc1ccccc1)C(=O)NCc1cccc(C(=O)O)c1	ZINC000450512444	EG	On-Demand	Anodyne	SRD5A2	0	43
CC(C)(COCc1ccccc1)C(=O)NCc1cccc(C(=O)O)c1	ZINC000450512444	EG	On-Demand	Anodyne	PTGER1	27	41
CC(C)(COCc1ccccc1)C(=O)NCc1cccc(C(=O)O)c1	ZINC000450512444	EG	On-Demand	Anodyne	PLA2G4B	22	43
CC(C)(COCc1ccccc1)C(=O)NCc1cccc(C(=O)O)c1	ZINC000450512444	EG	On-Demand	Anodyne	AKR1C3	32	40
CC(C)(COCc1ccccc1)C(=O)NCc1cccc(C(=O)O)c1	ZINC000450512444	EG	On-Demand	Anodyne	PDS	45	33
CC1(C(=O)Nc2ccc3c(ccn3CC(=O)O)c2)CC1	ZINC000450512466	CE	On-Demand	Anodyne	RORC	39	42
Fc1ccc2c(C3=CCN(Cc4cn(CC5CC5)nn4)CC3)c[nH]c2c1	ZINC000450512488	FH	On-Demand	Anodyne	SLC6A4	23	49
CCc1cc(CCCN2CCC(C(=O)Nc3ccccc3OC)CC2)on1	ZINC000450512492	FH	On-Demand	Anodyne	HTR1A	39	40
CCc1cc(CCCN2CCC(C(=O)Nc3ccccc3OC)CC2)on1	ZINC000450512492	FH	On-Demand	Anodyne	DRD2	41	43
CCc1cc(CCCN2CCC(C(=O)Nc3ccccc3OC)CC2)on1	ZINC000450512492	FH	On-Demand	Anodyne	DRD4	30	44
CCc1cc(CCCN2CCC(C(=O)Nc3ccccc3OC)CC2)on1	ZINC000450512492	FH	On-Demand	Anodyne	DRD3	46	43
CCc1cc(CCCN2CCC(C(=O)Nc3ccccc3OC)CC2)on1	ZINC000450512492	FH	On-Demand	Anodyne	HTR4	49	45
O=C(O)Cc1cccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450512493	GI	On-Demand	Anodyne	PPARD	16	40
O=C(O)Cc1cccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450512493	GI	On-Demand	Anodyne	EPHX2	19	44
O=C(O)Cc1cccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450512493	GI	On-Demand	Anodyne	SLC1A2	31	44
O=C(O)Cc1cccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450512493	GI	On-Demand	Anodyne	KCNK3	21	40
COC(=O)c1coc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)n1	ZINC000450512495	FG	On-Demand	Anodyne	HTR1A	0	57
COC(=O)c1coc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)n1	ZINC000450512495	FG	On-Demand	Anodyne	HTR1D	0	48
COC(=O)c1coc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)n1	ZINC000450512495	FG	On-Demand	Anodyne	SLC6A4	23	57
C[C@@H](O)CCN1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000450512496	CG	On-Demand	Anodyne	HTR1D	22	42
C[C@H](O)CCN1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000450512497	CG	On-Demand	Anodyne	HTR1D	22	42
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450512505	FI	On-Demand	Anodyne	SIGMAR1	15	40
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450512505	FI	On-Demand	Anodyne	CCR3	78	45
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450512505	FI	On-Demand	Anodyne	EPHX2	52	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450512505	FI	On-Demand	Anodyne	CXCR3	23	42
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450512505	FI	On-Demand	Anodyne	CACNA1G	17	42
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450512506	FI	On-Demand	Anodyne	SIGMAR1	15	40
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450512506	FI	On-Demand	Anodyne	CCR3	78	45
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450512506	FI	On-Demand	Anodyne	EPHX2	52	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450512506	FI	On-Demand	Anodyne	CXCR3	23	42
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450512506	FI	On-Demand	Anodyne	CACNA1G	17	42
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	ADRB1	16	45
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	THRA	24	41
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	HTR4	19	44
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	ADRB3	18	45
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	THRB	28	45
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	CASR	16	40
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	CTSL	17	40
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	U38	0	40
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	PTGDR2	32	41
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	NCE103	21	46
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	P96878_MYCTU	15	46
COc1cc(Cl)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450512510	GF	On-Demand	Anodyne	CAN2	0	46
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450512513	GF	On-Demand	Anodyne	CAPN2	61	33
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450512513	GF	On-Demand	Anodyne	NPR	59	34
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450512513	GF	On-Demand	Anodyne	Q6PRC7_IXORI	41	33
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450512513	GF	On-Demand	Anodyne	THYX_PBCV1	0	40
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450512513	GF	On-Demand	Anodyne	FAS	16	40
C[C@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000450512515	FE	On-Demand	Anodyne	ADRA1D	19	44
C[C@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000450512515	FE	On-Demand	Anodyne	ADRA1B	25	44
C[C@@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000450512516	FE	On-Demand	Anodyne	ADRA1D	19	44
C[C@@H](c1csnn1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000450512516	FE	On-Demand	Anodyne	ADRA1B	25	44
COc1cc(CNC(=O)CCCC2CCOCC2)ccc1C(=O)O	ZINC000450512517	EF	On-Demand	Anodyne	TRPV1	0	47
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cccc(C(F)(F)F)n1	ZINC000450512520	FG	On-Demand	Anodyne	TRPV1	75	40
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cccc(C(F)(F)F)n1	ZINC000450512520	FG	On-Demand	Anodyne	NPR	40	30
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cccc(C(F)(F)F)n1	ZINC000450512520	FG	On-Demand	Anodyne	CARM1	78	38
CCc1ccccc1CC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450512524	FG	On-Demand	Anodyne	FOLH1	41	33
CCc1ccccc1CC(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450512524	FG	On-Demand	Anodyne	ACE2	42	33
CCc1ccccc1CC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450512525	FG	On-Demand	Anodyne	FOLH1	41	33
CCc1ccccc1CC(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1	ZINC000450512525	FG	On-Demand	Anodyne	ACE2	42	33
O=C(O)CCCOc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450512535	FH	On-Demand	Anodyne	LTA4H	41	40
O=C(O)CCCOc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450512535	FH	On-Demand	Anodyne	CYSLTR2	49	35
O=C(O)CCCOc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450512535	FH	On-Demand	Anodyne	PLA2G4B	41	34
O=C(O)CCCOc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450512535	FH	On-Demand	Anodyne	FAAH	16	49
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450512536	FE	On-Demand	Anodyne	ACE	19	41
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450512536	FE	On-Demand	Anodyne	OPRM1	49	43
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450512536	FE	On-Demand	Anodyne	OPRD1	40	41
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450512536	FE	On-Demand	Anodyne	MME	52	53
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450512536	FE	On-Demand	Anodyne	TACR2	40	36
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450512536	FE	On-Demand	Anodyne	TIMP3	70	36
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450512536	FE	On-Demand	Anodyne	YARS	64	38
COc1cc(CNC(=O)c2occc2C(C)C)ccc1C(=O)O	ZINC000450512537	DG	On-Demand	Anodyne	PPARA	17	40
COc1cc(CNC(=O)c2occc2C(C)C)ccc1C(=O)O	ZINC000450512537	DG	On-Demand	Anodyne	ABCC8	19	41
COc1cc(CNC(=O)c2occc2C(C)C)ccc1C(=O)O	ZINC000450512537	DG	On-Demand	Anodyne	ADRB3	25	44
COc1cc(CNC(=O)c2occc2C(C)C)ccc1C(=O)O	ZINC000450512537	DG	On-Demand	Anodyne	U38	0	42
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	HTR1A	24	49
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	DRD2	28	40
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	DRD1	18	43
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	DRD4	25	48
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	HTR2A	26	49
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	HTR2C	20	49
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	SLC6A1	105	38
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	DRD3	21	55
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	CHRM4	17	43
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	DRD5	15	48
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	HTR7	31	49
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	HRH3	17	44
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	SIGMAR1	25	52
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	SLC18A3	0	41
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	HTR3B	0	40
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512539	GI	On-Demand	Anodyne	CYP2J2	65	47
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	HTR1A	24	49
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	DRD1	18	43
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	DRD4	25	48
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	HTR2A	26	49
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	HTR2C	20	49
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	SLC6A1	105	38
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	DRD3	21	55
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	CHRM4	17	43
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	DRD5	15	48
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	HTR7	31	49
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	HRH3	17	44
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	SIGMAR1	25	52
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	SLC18A3	0	41
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	HTR3B	0	40
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCCC(=O)c1ccccc1	ZINC000450512540	GI	On-Demand	Anodyne	CYP2J2	65	47
CCOC(=O)c1cc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)on1	ZINC000450512544	EC	On-Demand	Anodyne	GRIA1	44	35
CCOC(=O)c1cc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)on1	ZINC000450512544	EC	On-Demand	Anodyne	YARS	53	37
CCOC(=O)c1cc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)on1	ZINC000450512544	EC	On-Demand	Anodyne	PCNA	0	40
Cc1cccc2c1C[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)O2	ZINC000450512552	ED	On-Demand	Anodyne	YARS	40	31
Cc1cccc2c1C[C@@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)O2	ZINC000450512553	ED	On-Demand	Anodyne	YARS	40	31
CC[C@@H](O)CC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450512559	CD	On-Demand	Anodyne	CAPN2	51	33
CC[C@@H](O)CC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450512559	CD	On-Demand	Anodyne	POL	0	40
CC[C@@H](O)CC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450512559	CD	On-Demand	Anodyne	NPR	52	32
CC[C@@H](O)CC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450512559	CD	On-Demand	Anodyne	PDS	44	33
CC[C@H](O)CC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450512560	CD	On-Demand	Anodyne	CAPN2	51	33
CC[C@H](O)CC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450512560	CD	On-Demand	Anodyne	POL	0	40
CC[C@H](O)CC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450512560	CD	On-Demand	Anodyne	NPR	52	32
CC[C@H](O)CC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)OC	ZINC000450512560	CD	On-Demand	Anodyne	PDS	44	33
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450512566	FH	On-Demand	Anodyne	HTR1A	15	42
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450512566	FH	On-Demand	Anodyne	DRD4	16	40
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450512566	FH	On-Demand	Anodyne	HTR4	29	45
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450512566	FH	On-Demand	Anodyne	CHRM3	25	40
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450512566	FH	On-Demand	Anodyne	CCR3	37	41
COc1ccccc1NC(=O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450512566	FH	On-Demand	Anodyne	CACNA1G	31	40
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450512567	FH	On-Demand	Anodyne	HTR1A	15	42
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450512567	FH	On-Demand	Anodyne	DRD4	16	40
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450512567	FH	On-Demand	Anodyne	HTR4	29	45
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450512567	FH	On-Demand	Anodyne	CHRM3	25	40
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450512567	FH	On-Demand	Anodyne	CCR3	37	41
COc1ccccc1NC(=O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450512567	FH	On-Demand	Anodyne	CACNA1G	31	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450512568	GF	On-Demand	Anodyne	PPARA	16	45
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450512568	GF	On-Demand	Anodyne	PPARD	19	45
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](CO)Cc2ccc(O)cc2)c1	ZINC000450512568	GF	On-Demand	Anodyne	PCNA	0	44
Cc1cccc(Cl)c1C(=O)N(C)CC1CCN(c2ccncc2)CC1	ZINC000450512569	FI	On-Demand	Anodyne	F10	18	42
CC(=O)NC[C@H](CC(=O)N[C@H](CO)Cc1ccc(O)cc1)CC(C)C	ZINC000450512570	FD	On-Demand	Anodyne	OPRM1	49	50
CC(=O)NC[C@H](CC(=O)N[C@H](CO)Cc1ccc(O)cc1)CC(C)C	ZINC000450512570	FD	On-Demand	Anodyne	OPRD1	59	50
CC(=O)NC[C@H](CC(=O)N[C@H](CO)Cc1ccc(O)cc1)CC(C)C	ZINC000450512570	FD	On-Demand	Anodyne	PDYN	0	42
CC(=O)NC[C@H](CC(=O)N[C@H](CO)Cc1ccc(O)cc1)CC(C)C	ZINC000450512570	FD	On-Demand	Anodyne	YARS	57	33
CC(=O)NC[C@H](CC(=O)N[C@H](CO)Cc1ccc(O)cc1)CC(C)C	ZINC000450512570	FD	On-Demand	Anodyne	SLC15A2	0	43
CC(=O)NC[C@H](CC(=O)N[C@H](CO)Cc1ccc(O)cc1)CC(C)C	ZINC000450512570	FD	On-Demand	Anodyne	PCNA	0	41
CC1(C(=O)NCCc2ccc(OCC(=O)O)cc2)CC1	ZINC000450512572	CD	On-Demand	Anodyne	PLA2G4B	53	32
CC1(C(=O)NCCc2ccc(OCC(=O)O)cc2)CC1	ZINC000450512572	CD	On-Demand	Anodyne	FFAR4	43	33
COc1cc(CNC(=O)c2ccoc2C(C)C)ccc1C(=O)O	ZINC000450512582	DG	On-Demand	Anodyne	PPARA	15	40
COc1cc(CNC(=O)c2ccoc2C(C)C)ccc1C(=O)O	ZINC000450512582	DG	On-Demand	Anodyne	PPARD	16	40
COc1cc(CNC(=O)c2ccoc2C(C)C)ccc1C(=O)O	ZINC000450512582	DG	On-Demand	Anodyne	U38	0	42
N#CC1(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)CCC1	ZINC000450512584	EG	On-Demand	Mild	CCR3	53	42
N#CC1(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)CCC1	ZINC000450512584	EG	On-Demand	Mild	EPHX2	49	44
O=C(Nc1ccc(F)cc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450512586	EH	On-Demand	Anodyne	SIGMAR1	26	47
O=C(Nc1ccc(F)cc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450512586	EH	On-Demand	Anodyne	CCR3	98	49
O=C(Nc1ccc(F)cc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450512586	EH	On-Demand	Anodyne	EPHX2	52	43
O=C(Nc1ccc(F)cc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450512586	EH	On-Demand	Anodyne	CXCR3	31	71
O=C(Nc1ccc(F)cc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450512586	EH	On-Demand	Anodyne	MCHR1	28	47
O=C(Nc1ccc(F)cc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450512586	EH	On-Demand	Anodyne	CACNA1G	23	40
Cc1ccc(C(=O)N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450512587	DE	On-Demand	Anodyne	L3MBTL3	50	35
Cc1ccc(C(=O)N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450512587	DE	On-Demand	Anodyne	SLC6A7	0	42
Cc1ccc(C(=O)N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450512588	DE	On-Demand	Anodyne	L3MBTL3	50	35
Cc1ccc(C(=O)N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450512588	DE	On-Demand	Anodyne	SLC6A7	0	42
COc1ccc(CCCC(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC)c1	ZINC000450512594	GG	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CCCC(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC)c1	ZINC000450512594	GG	On-Demand	Anodyne	TRPV1	33	49
COc1ccc(CCCC(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC)c1	ZINC000450512594	GG	On-Demand	Anodyne	MTNR1A	87	42
COc1ccc(CCCC(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC)c1	ZINC000450512594	GG	On-Demand	Anodyne	MTNR1B	77	42
COc1ccc(CCCC(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC)c1	ZINC000450512594	GG	On-Demand	Anodyne	PTPN22	18	40
COc1ccc(CCCC(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC)c1	ZINC000450512594	GG	On-Demand	Anodyne	AKR1C2	52	38
COc1ccc(CCCC(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OC)c1	ZINC000450512594	GG	On-Demand	Anodyne	SUCNR1	18	40
CCC(=O)CCCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512595	EG	On-Demand	Anodyne	CCR3	98	45
CCC(=O)CCCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512595	EG	On-Demand	Anodyne	CHRNA7	27	47
CCC(=O)CCCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512595	EG	On-Demand	Anodyne	EPHX2	69	53
CCC(=O)CCCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450512595	EG	On-Demand	Anodyne	CXCR3	22	40
COC[C@@](C)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450512598	DD	On-Demand	Anodyne	NCE103	27	44
COC[C@](C)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450512599	DD	On-Demand	Anodyne	NCE103	27	44
COc1cc(CNC(=O)c2cc(C(C)C)on2)ccc1C(=O)O	ZINC000450512601	DE	On-Demand	Anodyne	U38	0	40
COc1ccc(-c2noc(N3CCN(C)[C@H](c4nc(C)no4)C3)n2)cc1	ZINC000450512608	FD	On-Demand	Anodyne	COLA	28	44
COc1ccc(-c2noc(N3CCN(C)[C@@H](c4nc(C)no4)C3)n2)cc1	ZINC000450512609	FD	On-Demand	Anodyne	COLA	28	44
CC(=O)c1cccc(CN2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)c1	ZINC000450512610	GD	On-Demand	Anodyne	ADORA2B	44	35
CC(=O)c1cccc(CN2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)c1	ZINC000450512610	GD	On-Demand	Anodyne	SIGMAR1	19	43
CC(=O)c1cccc(CN2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)c1	ZINC000450512610	GD	On-Demand	Anodyne	TRY2_BOVIN	56	33
O=C(CCCC(=O)C1CC1)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450512629	DD	On-Demand	Anodyne	LUXR	62	35
O=C(CCCC(=O)C1CC1)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450512630	DD	On-Demand	Anodyne	LUXR	62	35
Cc1cc(C)c(C(=O)N2CCC(CC(=O)N(C)C)CC2)cc1Br	ZINC000450512640	GG	On-Demand	Anodyne	L3MBTL1	0	44
Cc1cc(C)c(C(=O)N2CCC(CC(=O)N(C)C)CC2)cc1Br	ZINC000450512640	GG	On-Demand	Anodyne	L3MBTL3	25	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCc2cccc(O)c21	ZINC000450512643	EI	On-Demand	Anodyne	AVPR2	46	41
CC[C@@H]1C[C@H]1C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512654	DG	On-Demand	Anodyne	CTSL	15	42
CC[C@@H]1C[C@H]1C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512656	DG	On-Demand	Anodyne	CTSL	15	42
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	OPRM1	55	44
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	OPRD1	48	43
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	OPRK1	0	43
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	MME	73	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	ANPEP	53	35
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	PAPA1_CARPA	47	34
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	TIMP3	40	35
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	CAPNS1	44	30
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	SOAT1	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	YARS	66	43
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	CAPN2	45	32
C[C@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512664	DD	On-Demand	Anodyne	PSMB5	32	40
CC(C)N(CCN(C)C(=O)Cc1ccccc1O[C@H]1CCOC1)C(C)C	ZINC000450512665	FF	On-Demand	Anodyne	PDE4D	15	42
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	OPRM1	55	44
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	OPRD1	48	43
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	OPRK1	0	43
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	MME	73	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	ANPEP	53	35
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	PAPA1_CARPA	47	34
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	TIMP3	40	35
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	CAPNS1	44	30
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	SOAT1	0	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	YARS	66	43
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	CAPN2	45	32
C[C@@H](Oc1ccccn1)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450512666	DD	On-Demand	Anodyne	PSMB5	32	40
Cc1ccc(C(=O)N2CCN(Cc3noc(-c4cncc(C)c4)n3)CC2)cc1	ZINC000450512668	GF	On-Demand	Anodyne	PLA2G2A	31	42
CC(C)N(CCN(C)C(=O)Cc1ccccc1O[C@@H]1CCOC1)C(C)C	ZINC000450512669	FF	On-Demand	Anodyne	PDE4D	15	42
CCOC1(C(=O)NCc2cccc(C(=O)O)c2)CCCC1	ZINC000450512672	CE	On-Demand	Anodyne	PDS	40	34
Cc1ccccc1C(=O)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450512693	EI	On-Demand	Anodyne	CHRM1	15	44
Cc1ccccc1C(=O)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450512693	EI	On-Demand	Anodyne	DRD2	15	43
Cc1ccccc1C(=O)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450512693	EI	On-Demand	Anodyne	DRD4	27	50
Cc1ccccc1C(=O)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450512693	EI	On-Demand	Anodyne	SLC6A1	48	37
Cc1ccccc1C(=O)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450512693	EI	On-Demand	Anodyne	HTR4	40	41
Cc1ccccc1C(=O)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450512693	EI	On-Demand	Anodyne	SIGMAR1	18	43
Cc1ccccc1C(=O)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450512693	EI	On-Demand	Anodyne	CCR3	18	40
Cc1ccccc1C(=O)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450512693	EI	On-Demand	Anodyne	CCR8	67	40
CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512694	FI	On-Demand	Anodyne	CTSF	75	38
CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512694	FI	On-Demand	Anodyne	CTSK	36	48
CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512694	FI	On-Demand	Anodyne	CTSL	25	48
CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512694	FI	On-Demand	Anodyne	CTSS	21	48
Cc1ccn(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)n1	ZINC000450512697	CC	On-Demand	Anodyne	YARS	56	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512698	FI	On-Demand	Anodyne	CTSF	75	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512698	FI	On-Demand	Anodyne	CTSK	36	48
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512698	FI	On-Demand	Anodyne	CTSL	25	48
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512698	FI	On-Demand	Anodyne	CTSS	21	48
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512699	FI	On-Demand	Anodyne	CTSF	75	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512699	FI	On-Demand	Anodyne	CTSK	36	48
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512699	FI	On-Demand	Anodyne	CTSL	25	48
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512699	FI	On-Demand	Anodyne	CTSS	21	48
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512701	FI	On-Demand	Anodyne	CTSF	75	38
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512701	FI	On-Demand	Anodyne	CTSK	36	48
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512701	FI	On-Demand	Anodyne	CTSL	25	48
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450512701	FI	On-Demand	Anodyne	CTSS	21	48
COc1cc(CNC(=O)CC[C@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512722	EH	On-Demand	Anodyne	ADRB1	16	49
COc1cc(CNC(=O)CC[C@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512722	EH	On-Demand	Anodyne	ABCC8	20	44
COc1cc(CNC(=O)CC[C@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512722	EH	On-Demand	Anodyne	ADRB3	47	49
COc1cc(CNC(=O)CC[C@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512722	EH	On-Demand	Anodyne	TRPV1	30	49
COc1cc(CNC(=O)CC[C@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512722	EH	On-Demand	Anodyne	BCHE	20	40
COc1cc(CNC(=O)CC[C@@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512723	EH	On-Demand	Anodyne	ADRB1	16	49
COc1cc(CNC(=O)CC[C@@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512723	EH	On-Demand	Anodyne	ABCC8	20	44
COc1cc(CNC(=O)CC[C@@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512723	EH	On-Demand	Anodyne	ADRB3	47	49
COc1cc(CNC(=O)CC[C@@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512723	EH	On-Demand	Anodyne	TRPV1	30	49
COc1cc(CNC(=O)CC[C@@H](C)c2ccccc2)ccc1C(=O)O	ZINC000450512723	EH	On-Demand	Anodyne	BCHE	20	40
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(N2CCC2)nc1	ZINC000450512724	FE	On-Demand	Anodyne	HDAC1	22	42
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(N2CCC2)nc1	ZINC000450512724	FE	On-Demand	Anodyne	SMO	17	42
O=C(c1cnc(C2CC2)nc1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450512727	DH	On-Demand	Anodyne	PREP	44	36
O=C(c1cnc(C2CC2)nc1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450512728	DH	On-Demand	Anodyne	PREP	68	37
O=C(c1cnc(C2CC2)nc1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450512729	DH	On-Demand	Anodyne	PREP	44	36
O=C(c1cnc(C2CC2)nc1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450512730	DH	On-Demand	Anodyne	PREP	44	36
COc1ccc(C(=O)N[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512741	DE	On-Demand	Anodyne	PDE4A	30	53
COc1ccc(C(=O)N[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512741	DE	On-Demand	Anodyne	PDE4B	18	53
COc1ccc(C(=O)N[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512741	DE	On-Demand	Anodyne	PDE4D	19	53
COc1ccc(C(=O)N[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512741	DE	On-Demand	Anodyne	PDE4C	15	53
COc1ccc(C(=O)N[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512741	DE	On-Demand	Anodyne	LUCI_LUCLA	15	40
COc1ccc(C(=O)N[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512742	DE	On-Demand	Anodyne	PDE4A	30	53
COc1ccc(C(=O)N[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512742	DE	On-Demand	Anodyne	PDE4B	18	53
COc1ccc(C(=O)N[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512742	DE	On-Demand	Anodyne	PDE4D	19	53
COc1ccc(C(=O)N[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512742	DE	On-Demand	Anodyne	PDE4C	15	53
COc1ccc(C(=O)N[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450512742	DE	On-Demand	Anodyne	LUCI_LUCLA	15	40
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	HTR1A	32	41
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	DRD2	41	40
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	DRD1	28	40
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	DRD4	66	49
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	ACHE	22	42
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	HRH1	15	42
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	DRD3	40	39
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	HTR7	16	41
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	SIGMAR1	19	45
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	SSTR5	63	42
COc1cc(CN2CCN(Cc3nc4ccccc4c(=N)[nH]3)CC2)ccc1Cl	ZINC000450512772	GG	On-Demand	Anodyne	BCHE	17	42
CC(=O)N[C@H](C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O)C(C)(C)C	ZINC000450512782	ED	On-Demand	Anodyne	BIRC2	31	42
CC(=O)N[C@H](C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O)C(C)(C)C	ZINC000450512783	ED	On-Demand	Anodyne	BIRC2	31	42
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cn2nccc2nc1C	ZINC000450512784	FE	On-Demand	Anodyne	NPR	41	31
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450512796	FI	On-Demand	Anodyne	COLA	70	37
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450512796	FI	On-Demand	Anodyne	CPT1A	68	37
Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450512797	FI	On-Demand	Anodyne	COLA	70	37
Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450512797	FI	On-Demand	Anodyne	CPT1A	68	37
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OCC(C)C)c1	ZINC000450512798	GG	On-Demand	Anodyne	ADRB1	15	43
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OCC(C)C)c1	ZINC000450512798	GG	On-Demand	Anodyne	PPARA	23	42
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OCC(C)C)c1	ZINC000450512798	GG	On-Demand	Anodyne	ABCC8	20	41
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OCC(C)C)c1	ZINC000450512798	GG	On-Demand	Anodyne	ADRB3	34	45
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OCC(C)C)c1	ZINC000450512798	GG	On-Demand	Anodyne	PPARD	22	42
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OCC(C)C)c1	ZINC000450512798	GG	On-Demand	Anodyne	MT-ND1	24	40
COc1ccc(C(=O)NCc2ccc(C(=O)O)c(OC)c2)c(OCC(C)C)c1	ZINC000450512798	GG	On-Demand	Anodyne	AKR1C2	53	38
COC[C@@H]1C[C@@H](OC)CN1c1ncnc2cc(Br)ccc12	ZINC000450512799	FF	On-Demand	Anodyne	PDE3B	63	34
COC[C@@H]1C[C@H](OC)CN1c1ncnc2cc(Br)ccc12	ZINC000450512800	FF	On-Demand	Anodyne	PDE3B	63	34
CCc1cccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)n1	ZINC000450512805	DD	On-Demand	Anodyne	PDE5A	28	49
CCc1cccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)n1	ZINC000450512805	DD	On-Demand	Anodyne	OPRM1	27	40
CCc1cccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)n1	ZINC000450512805	DD	On-Demand	Anodyne	GRIA1	43	34
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	HTR1A	15	57
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	DRD2	31	45
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	DRD1	22	49
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	DRD4	23	57
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	HTR2A	29	57
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	HTR2C	19	49
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	DRD3	16	57
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	ERG2	21	44
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	HTR7	19	45
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	SIGMAR1	16	52
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	SLC18A3	0	48
O=C(CCCN1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450512808	GE	On-Demand	Anodyne	CYP2J2	50	35
CCCCCN(CCCOC)C(=O)c1cn2nccc2nc1C	ZINC000450512811	DF	On-Demand	Anodyne	TSPO	21	41
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512812	GH	On-Demand	Anodyne	ACACA	42	44
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512812	GH	On-Demand	Anodyne	ACACB	16	44
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512812	GH	On-Demand	Anodyne	UPP1	52	39
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512812	GH	On-Demand	Anodyne	MTNR1A	23	41
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512812	GH	On-Demand	Anodyne	PLA2G4B	31	44
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512812	GH	On-Demand	Anodyne	TSPAN17	0	41
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512812	GH	On-Demand	Anodyne	PDS	65	33
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512813	GH	On-Demand	Anodyne	ACACA	42	44
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512813	GH	On-Demand	Anodyne	ACACB	16	44
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512813	GH	On-Demand	Anodyne	UPP1	52	39
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512813	GH	On-Demand	Anodyne	MTNR1A	23	41
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512813	GH	On-Demand	Anodyne	PLA2G4B	31	44
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512813	GH	On-Demand	Anodyne	TSPAN17	0	41
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)c1	ZINC000450512813	GH	On-Demand	Anodyne	PDS	65	33
COC(=O)c1csc(CN2CCC(NC(=O)c3ccccc3C)CC2)n1	ZINC000450512829	FF	On-Demand	Anodyne	DRD4	24	48
COC(=O)c1csc(CN2CCC(NC(=O)c3ccccc3C)CC2)n1	ZINC000450512829	FF	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1csc(CN2CCC(NC(=O)c3ccccc3C)CC2)n1	ZINC000450512829	FF	On-Demand	Anodyne	SIGMAR1	22	44
COC(=O)c1csc(CN2CCC(NC(=O)c3ccccc3C)CC2)n1	ZINC000450512829	FF	On-Demand	Anodyne	SSTR5	41	36
COC(=O)c1csc(CN2CCC(NC(=O)c3ccccc3C)CC2)n1	ZINC000450512829	FF	On-Demand	Anodyne	MCHR1	28	43
COC(=O)c1csc(CN2CCC(NC(=O)c3ccccc3C)CC2)n1	ZINC000450512829	FF	On-Demand	Anodyne	CCR8	60	35
O=C(O)C[C@H](NC(=O)C[C@@H]1C[C@H]1c1ccccc1)C1CCCCC1	ZINC000450512833	EH	On-Demand	Anodyne	GPR88	0	42
O=C(O)C[C@@H](NC(=O)C[C@@H]1C[C@H]1c1ccccc1)C1CCCCC1	ZINC000450512834	EH	On-Demand	Anodyne	GPR88	0	42
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(C(=O)C2CC2)CC1	ZINC000450512842	DD	On-Demand	Anodyne	OPRD1	0	40
O=C(N[C@H](CO)Cc1ccc(O)cc1)C1(C(=O)C2CC2)CC1	ZINC000450512842	DD	On-Demand	Anodyne	YARS	58	33
Cc1ccc(C(=O)Nc2cc(Cl)c(O)c(Cl)c2)c(C(C)C)n1	ZINC000450512852	EJ	On-Demand	Anodyne	NR2E3	46	35
Cc1ccc(C(=O)Nc2cc(Cl)c(O)c(Cl)c2)c(C(C)C)n1	ZINC000450512852	EJ	On-Demand	Anodyne	SHH	33	42
Cc1ccc(C(=O)Nc2cc(Cl)c(O)c(Cl)c2)c(C(C)C)n1	ZINC000450512852	EJ	On-Demand	Anodyne	Q25615_ONCVO	48	32
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	DRD2	19	46
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	DRD4	51	43
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	ACHE	25	41
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	HRH1	17	42
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	SIGMAR1	28	40
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	SSTR5	58	43
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	CCR3	21	40
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	FAAH	20	43
CC(=O)c1cccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1	ZINC000450512853	FK	On-Demand	Anodyne	MCHR1	56	42
NC(=O)c1cccc2c1CCCN2C[C@H]1CCNC(=O)CC1	ZINC000450512858	DD	On-Demand	Anodyne	PARP1	22	45
NC(=O)c1cccc2c1CCCN2C[C@@H]1CCNC(=O)CC1	ZINC000450512859	DD	On-Demand	Anodyne	PARP1	22	45
Cc1ccc(C(=O)N2CCC(CC(=O)N(C)C)CC2)c2c1CCC2	ZINC000450512870	EF	On-Demand	Anodyne	L3MBTL3	63	36
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C)cs1	ZINC000450512872	DG	On-Demand	Anodyne	CAPN1	47	32
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C)cs1	ZINC000450512872	DG	On-Demand	Anodyne	CAPN2	70	33
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C)cs1	ZINC000450512872	DG	On-Demand	Anodyne	POL	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C)cs1	ZINC000450512872	DG	On-Demand	Anodyne	NPR	57	34
CCOc1ccc(C[C@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)cc1	ZINC000450512877	FC	On-Demand	Anodyne	MME	40	39
CCOc1ccc(C[C@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)cc1	ZINC000450512877	FC	On-Demand	Anodyne	CPA1	43	34
CCOc1ccc(C[C@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)cc1	ZINC000450512877	FC	On-Demand	Anodyne	ACE2	46	37
CCOc1ccc(C[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)cc1	ZINC000450512878	FC	On-Demand	Anodyne	MME	40	39
CCOc1ccc(C[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)cc1	ZINC000450512878	FC	On-Demand	Anodyne	CPA1	43	34
CCOc1ccc(C[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)cc1	ZINC000450512878	FC	On-Demand	Anodyne	ACE2	46	37
CCOc1ccc(CNc2ncc([N+](=O)[O-])c(C)n2)cc1Cl	ZINC000450512898	DF	On-Demand	Bother	S1PR4	23	40
CCOc1ccc(CNc2ncc([N+](=O)[O-])c(C)n2)cc1Cl	ZINC000450512898	DF	On-Demand	Bother	PDE6A	43	34
CCOc1ccc(CNc2ncc([N+](=O)[O-])c(C)n2)cc1Cl	ZINC000450512898	DF	On-Demand	Bother	PRKCQ	46	43
Cc1csc(C(=O)Nc2ccc(F)cc2OC(C)(C)C)c1	ZINC000450512900	DJ	On-Demand	Anodyne	PYGL	24	41
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	CYP19A1	33	46
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	CYP11B1	46	46
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	TBXAS1	53	46
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	CYP11B2	45	46
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	HMOX1	41	42
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	CYP17A1	27	40
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	CYP24A1	48	32
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	CAMC	0	44
C[C@@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512914	BE	On-Demand	Anodyne	CYP27B1	59	32
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	CYP19A1	33	46
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	CYP11B1	46	46
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	TBXAS1	53	46
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	CYP11B2	45	46
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	HMOX1	41	42
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	CYP17A1	27	40
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	CYP24A1	48	32
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	CAMC	0	44
C[C@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512915	BE	On-Demand	Anodyne	CYP27B1	59	32
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	CYP19A1	33	46
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	CYP11B1	46	46
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	TBXAS1	53	46
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	CYP11B2	45	46
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	HMOX1	41	42
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	CYP17A1	27	40
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	CYP24A1	48	32
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	CAMC	0	44
C[C@@H](c1ccccc1)[C@H](O)Cn1ccnc1	ZINC000450512916	BE	On-Demand	Anodyne	CYP27B1	59	32
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	CYP19A1	33	46
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	CYP11B1	46	46
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	TBXAS1	53	46
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	CYP11B2	45	46
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	HMOX1	41	42
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	CYP17A1	27	40
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	CYP24A1	48	32
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	CAMC	0	44
C[C@H](c1ccccc1)[C@@H](O)Cn1ccnc1	ZINC000450512917	BE	On-Demand	Anodyne	CYP27B1	59	32
Cc1nc(NCCCc2nc3cccnc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450512920	DD	On-Demand	Bother	PRKCQ	44	41
O=S(=O)(NC1CCN(C[C@H]2CCC(F)(F)C2)CC1)c1ccccc1	ZINC000450512928	FF	On-Demand	Anodyne	ADRA1B	29	40
O=S(=O)(NC1CCN(C[C@H]2CCC(F)(F)C2)CC1)c1ccccc1	ZINC000450512928	FF	On-Demand	Anodyne	SFRP1	109	42
O=S(=O)(NC1CCN(C[C@H]2CCC(F)(F)C2)CC1)c1ccccc1	ZINC000450512928	FF	On-Demand	Anodyne	WNT3	83	39
O=S(=O)(NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1)c1ccccc1	ZINC000450512929	FF	On-Demand	Anodyne	ADRA1B	29	40
O=S(=O)(NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1)c1ccccc1	ZINC000450512929	FF	On-Demand	Anodyne	SFRP1	109	42
O=S(=O)(NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1)c1ccccc1	ZINC000450512929	FF	On-Demand	Anodyne	WNT3	83	39
COc1ccc([C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512930	GH	On-Demand	Anodyne	CTSK	26	50
COc1ccc([C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512930	GH	On-Demand	Anodyne	CTSL	15	50
COc1ccc([C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512930	GH	On-Demand	Anodyne	MTNR1A	21	40
COc1ccc([C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512930	GH	On-Demand	Anodyne	MTNR1B	21	40
COc1ccc([C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512930	GH	On-Demand	Anodyne	CTSS	21	50
COc1ccc([C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512931	GH	On-Demand	Anodyne	CTSK	26	50
COc1ccc([C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512931	GH	On-Demand	Anodyne	CTSL	15	50
COc1ccc([C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512931	GH	On-Demand	Anodyne	MTNR1A	21	40
COc1ccc([C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512931	GH	On-Demand	Anodyne	MTNR1B	21	40
COc1ccc([C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C(F)(F)F)cc1	ZINC000450512931	GH	On-Demand	Anodyne	CTSS	21	50
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450512932	CH	On-Demand	Anodyne	PREP	81	47
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450512932	CH	On-Demand	Anodyne	F1PEP1	0	40
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450512933	CH	On-Demand	Anodyne	PREP	74	47
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450512933	CH	On-Demand	Anodyne	F1PEP1	0	40
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450512934	CH	On-Demand	Anodyne	PREP	81	47
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450512934	CH	On-Demand	Anodyne	F1PEP1	0	40
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450512935	CH	On-Demand	Anodyne	PREP	81	47
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450512935	CH	On-Demand	Anodyne	F1PEP1	0	40
Cc1nc(N[C@H]2C[C@@H]2c2cccnc2)ncc1[N+](=O)[O-]	ZINC000450512936	CE	On-Demand	Bother	PRKCQ	45	36
Cc1nc(N2CCc3ccc(S(C)(=O)=O)cc3CC2)ncc1[N+](=O)[O-]	ZINC000450512941	FD	On-Demand	Bother	GPR119	15	40
Cc1cccc(Cl)c1CN1CCc2cc(S(N)(=O)=O)ccc21	ZINC000450512952	EF	On-Demand	Anodyne	CA7	33	41
CCOC(=O)c1cc(C(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)on1	ZINC000450512967	FE	On-Demand	Anodyne	CAPN2	52	32
CCOC(=O)c1cc(C(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)on1	ZINC000450512967	FE	On-Demand	Anodyne	NPR	51	33
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2cc(S(N)(=O)=O)ccc21	ZINC000450512969	ED	On-Demand	Anodyne	CA7	35	46
C[C@H](c1ccccc1)[C@H](O)CN1CCc2cc(S(N)(=O)=O)ccc21	ZINC000450512971	ED	On-Demand	Anodyne	CA7	35	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2cc(S(N)(=O)=O)ccc21	ZINC000450512972	ED	On-Demand	Anodyne	CA7	35	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2cc(S(N)(=O)=O)ccc21	ZINC000450512973	ED	On-Demand	Anodyne	CA7	35	46
CN(C)S(=O)(=O)c1cc(C(=O)NCc2cccc(C(=O)O)c2)n(C)c1	ZINC000450512974	FC	On-Demand	Anodyne	UL54	43	32
CN(C)S(=O)(=O)c1cc(C(=O)NCc2cccc(C(=O)O)c2)n(C)c1	ZINC000450512974	FC	On-Demand	Anodyne	AKR1C3	45	34
O=C(CCCC(=O)N1CCC[C@H]1/C=C/c1ccccc1)C1CC1	ZINC000450512978	DH	On-Demand	Anodyne	FKBP1A	25	40
O=C(CCCC(=O)N1CCC[C@H]1/C=C/c1ccccc1)C1CC1	ZINC000450512978	DH	On-Demand	Anodyne	PREP	93	47
O=C(CCCC(=O)N1CCC[C@@H]1/C=C\c1ccccc1)C1CC1	ZINC000450512982	DH	On-Demand	Anodyne	FKBP1A	23	40
O=C(CCCC(=O)N1CCC[C@@H]1/C=C\c1ccccc1)C1CC1	ZINC000450512982	DH	On-Demand	Anodyne	PREP	52	45
O=C(CCCC(=O)N1CCC[C@@H]1/C=C/c1ccccc1)C1CC1	ZINC000450512983	DH	On-Demand	Anodyne	FKBP1A	23	40
O=C(CCCC(=O)N1CCC[C@@H]1/C=C/c1ccccc1)C1CC1	ZINC000450512983	DH	On-Demand	Anodyne	PREP	52	45
O=C(CCCC(=O)N1CCC[C@H]1/C=C\c1ccccc1)C1CC1	ZINC000450512984	DH	On-Demand	Anodyne	FKBP1A	23	40
O=C(CCCC(=O)N1CCC[C@H]1/C=C\c1ccccc1)C1CC1	ZINC000450512984	DH	On-Demand	Anodyne	PREP	52	45
CCOC(=O)c1csc(=NCc2ccc3c(c2)nc(CC)n3C2CC2)[nH]1	ZINC000450512985	FH	On-Demand	Anodyne	FPR2	27	40
COc1cc(Cl)c(C(=O)N[C@@H](CC(=O)O)c2ccccc2C)cc1OC	ZINC000450512987	GH	On-Demand	Anodyne	PTGER3	40	41
COc1cc(Cl)c(C(=O)N[C@@H](CC(=O)O)c2ccccc2C)cc1OC	ZINC000450512987	GH	On-Demand	Anodyne	UTS2	52	33
COc1cc(Cl)c(C(=O)N[C@@H](CC(=O)O)c2ccccc2C)cc1OC	ZINC000450512987	GH	On-Demand	Anodyne	CTSA	117	56
FC(F)OCCCNc1ncnc2[nH]c3ccccc3c12	ZINC000450512988	CG	On-Demand	Anodyne	UTS2R	29	45
COc1cc(Cl)c(C(=O)N[C@H](CC(=O)O)c2ccccc2C)cc1OC	ZINC000450512990	GH	On-Demand	Anodyne	PTGER3	40	41
COc1cc(Cl)c(C(=O)N[C@H](CC(=O)O)c2ccccc2C)cc1OC	ZINC000450512990	GH	On-Demand	Anodyne	UTS2	52	33
COc1cc(Cl)c(C(=O)N[C@H](CC(=O)O)c2ccccc2C)cc1OC	ZINC000450512990	GH	On-Demand	Anodyne	CTSA	117	56
COC(=O)c1cccc(CN2CCC[C@H](CNS(C)(=O)=O)C2)c1Cl	ZINC000450512993	FD	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)c1cccc(CN2CCC[C@@H](CNS(C)(=O)=O)C2)c1Cl	ZINC000450512994	FD	On-Demand	Anodyne	SLC6A1	52	34
CCS(=O)(=O)c1ccc(CN2CCc3cc(F)c(F)cc32)cc1	ZINC000450512997	EG	On-Demand	Anodyne	TYMS	0	40
CC(=O)[C@](C)(O)CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000450513002	DF	On-Demand	Anodyne	HTR1A	0	53
CC(=O)[C@](C)(O)CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000450513002	DF	On-Demand	Anodyne	HTR1D	0	52
CC(=O)[C@](C)(O)CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000450513002	DF	On-Demand	Anodyne	SLC6A4	25	53
CC(=O)[C@@](C)(O)CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000450513003	DF	On-Demand	Anodyne	HTR1A	0	53
CC(=O)[C@@](C)(O)CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000450513003	DF	On-Demand	Anodyne	HTR1D	0	52
CC(=O)[C@@](C)(O)CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000450513003	DF	On-Demand	Anodyne	SLC6A4	25	53
COc1cc(CNC(=O)c2ccccc2CCC(F)(F)F)ccc1C(=O)O	ZINC000450513006	GH	On-Demand	Anodyne	PPARA	25	42
COc1cc(CNC(=O)c2ccccc2CCC(F)(F)F)ccc1C(=O)O	ZINC000450513006	GH	On-Demand	Anodyne	ABCC8	18	40
COc1cc(CNC(=O)c2ccccc2CCC(F)(F)F)ccc1C(=O)O	ZINC000450513006	GH	On-Demand	Anodyne	PPARD	28	41
COc1cc(CNC(=O)c2ccccc2CCC(F)(F)F)ccc1C(=O)O	ZINC000450513006	GH	On-Demand	Anodyne	U38	0	45
COCc1nn(C)cc1C(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450513014	GH	On-Demand	Anodyne	QDPR	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450513015	GG	On-Demand	Bother	CACNA1C	56	39
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450513015	GG	On-Demand	Bother	CACNA1D	85	39
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450513015	GG	On-Demand	Bother	COLA	78	45
CN(CC1CCN(c2ccncc2)CC1)C(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450513021	GI	On-Demand	Anodyne	F10	16	41
CCc1cc(CCCN2CCN(c3ccc(C(N)=O)cn3)CC2)on1	ZINC000450513023	ED	On-Demand	Anodyne	DRD4	21	40
COc1ccc(-c2noc(CN3CCN(C(=O)c4ccc(C)cc4)CC3)n2)nn1	ZINC000450513026	GD	On-Demand	Anodyne	PLA2G2A	26	42
COc1ccc(-c2noc(CN3CCN(C(=O)c4ccc(C)cc4)CC3)n2)nn1	ZINC000450513026	GD	On-Demand	Anodyne	GPR183	0	40
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513035	CE	On-Demand	Anodyne	OPRM1	36	40
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513035	CE	On-Demand	Anodyne	OPRD1	49	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513035	CE	On-Demand	Anodyne	YARS	61	33
CC(C)OC(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513037	CD	On-Demand	Anodyne	OPRM1	21	40
CC(C)OC(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513037	CD	On-Demand	Anodyne	MME	26	40
CC(C)OC(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513037	CD	On-Demand	Anodyne	YARS	59	35
CC(C)OC(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513037	CD	On-Demand	Anodyne	SLC15A2	0	45
CC(C)OC(C)(C)C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513037	CD	On-Demand	Anodyne	PCNA	0	43
COc1ccc(CCCC(=O)N[C@H](CC(=O)O)C2CCCCC2)c(OC)c1	ZINC000450513056	GH	On-Demand	Anodyne	MTNR1A	54	38
COc1ccc(CCCC(=O)N[C@H](CC(=O)O)C2CCCCC2)c(OC)c1	ZINC000450513056	GH	On-Demand	Anodyne	MTNR1B	46	40
COc1ccc(CCCC(=O)N[C@@H](CC(=O)O)C2CCCCC2)c(OC)c1	ZINC000450513057	GH	On-Demand	Anodyne	MTNR1A	54	38
COc1ccc(CCCC(=O)N[C@@H](CC(=O)O)C2CCCCC2)c(OC)c1	ZINC000450513057	GH	On-Demand	Anodyne	MTNR1B	46	40
COc1cc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)ccc1Cl	ZINC000450513062	GE	On-Demand	Anodyne	ADORA2B	46	37
COc1cc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)ccc1Cl	ZINC000450513062	GE	On-Demand	Anodyne	SIGMAR1	15	48
COc1cc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)ccc1Cl	ZINC000450513062	GE	On-Demand	Anodyne	SSTR5	46	36
COc1cc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)ccc1Cl	ZINC000450513062	GE	On-Demand	Anodyne	CYP11B2	30	40
COc1cc(CNC(=O)C[C@@H]2C[C@H]2c2ccccc2)ccc1C(=O)O	ZINC000450513069	EG	On-Demand	Anodyne	ABCC8	18	41
COc1ccccc1NC(=O)C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450513076	FF	On-Demand	Anodyne	DRD3	0	41
COc1cc(CNC(=O)c2ccccc2COC2CCOCC2)ccc1C(=O)O	ZINC000450513077	GG	On-Demand	Anodyne	KCNA3	42	38
COc1cc(CNC(=O)c2ccccc2COC2CCOCC2)ccc1C(=O)O	ZINC000450513077	GG	On-Demand	Anodyne	SLC6A5	52	35
COc1cc(CNC(=O)c2ccccc2COC2CCOCC2)ccc1C(=O)O	ZINC000450513077	GG	On-Demand	Anodyne	U38	0	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450513078	GE	On-Demand	Anodyne	CTSK	21	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450513078	GE	On-Demand	Anodyne	SCN9A	40	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450513078	GE	On-Demand	Anodyne	CAPN1	17	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450513078	GE	On-Demand	Anodyne	CAPN2	41	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450513079	GE	On-Demand	Anodyne	CTSK	21	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450513079	GE	On-Demand	Anodyne	SCN9A	40	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450513079	GE	On-Demand	Anodyne	CAPN1	17	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O	ZINC000450513079	GE	On-Demand	Anodyne	CAPN2	41	34
NC(=O)c1ccc(N2CCN(CC/C=C/c3ccccc3)CC2)nc1	ZINC000450513082	EE	On-Demand	Anodyne	HTR1A	20	43
NC(=O)c1ccc(N2CCN(CC/C=C/c3ccccc3)CC2)nc1	ZINC000450513082	EE	On-Demand	Anodyne	SMO	18	51
NC(=O)c1ccc(N2CCN(CC/C=C\c3ccccc3)CC2)nc1	ZINC000450513083	EE	On-Demand	Anodyne	HTR1A	20	43
NC(=O)c1ccc(N2CCN(CC/C=C\c3ccccc3)CC2)nc1	ZINC000450513083	EE	On-Demand	Anodyne	SMO	18	51
CCOC(=O)c1ccc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)nc1	ZINC000450513105	GI	On-Demand	Anodyne	HTR1A	0	48
CCOC(=O)c1ccc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)nc1	ZINC000450513105	GI	On-Demand	Anodyne	HTR1D	0	51
CCOC(=O)c1ccc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)nc1	ZINC000450513105	GI	On-Demand	Anodyne	SLC6A4	22	51
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450513106	FG	On-Demand	Anodyne	AVPR1A	24	41
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450513106	FG	On-Demand	Anodyne	ABCB1	38	43
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450513106	FG	On-Demand	Anodyne	GPR183	0	41
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450513106	FG	On-Demand	Anodyne	SLC6A7	0	42
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450513107	FG	On-Demand	Anodyne	AVPR1A	24	41
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450513107	FG	On-Demand	Anodyne	ABCB1	38	43
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450513107	FG	On-Demand	Anodyne	GPR183	0	41
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000450513107	FG	On-Demand	Anodyne	SLC6A7	0	42
CC(=O)c1ccc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)cc1	ZINC000450513112	FD	On-Demand	Anodyne	ADORA2B	45	35
Cn1c(C#N)ccc1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000450513119	CC	On-Demand	Mild	YARS	40	33
Cc1ccc(C(=O)N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)cc1	ZINC000450513121	GG	On-Demand	Anodyne	SIGMAR1	24	45
Cc1ccc(C(=O)N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)cc1	ZINC000450513121	GG	On-Demand	Anodyne	FAAH	15	43
Cc1ccc(C(=O)N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)cc1	ZINC000450513121	GG	On-Demand	Anodyne	SLC6A7	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1ccsc1Br	ZINC000450513123	GH	On-Demand	Anodyne	NPR	55	35
CSc1cccc(C(=O)N(CCNC(C)=O)[C@H](C)C(=O)OC(C)(C)C)c1	ZINC000450513125	GF	On-Demand	Anodyne	MTNR1A	19	43
CSc1cccc(C(=O)N(CCNC(C)=O)[C@H](C)C(=O)OC(C)(C)C)c1	ZINC000450513125	GF	On-Demand	Anodyne	MTNR1B	18	43
CSc1cccc(C(=O)N(CCNC(C)=O)[C@@H](C)C(=O)OC(C)(C)C)c1	ZINC000450513126	GF	On-Demand	Anodyne	MTNR1A	19	43
CSc1cccc(C(=O)N(CCNC(C)=O)[C@@H](C)C(=O)OC(C)(C)C)c1	ZINC000450513126	GF	On-Demand	Anodyne	MTNR1B	18	43
C[C@@]1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CC=CCC1	ZINC000450513142	CE	On-Demand	Anodyne	YARS	61	33
C[C@]1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CC=CCC1	ZINC000450513143	CE	On-Demand	Anodyne	YARS	61	33
CCCCCN(CCCOC)C(=O)c1cc2cccnc2s1	ZINC000450513144	DH	On-Demand	Anodyne	TSPO	18	40
Cc1nn(-c2ccccc2)cc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450513154	DH	On-Demand	Anodyne	NPY5R	15	44
Cc1ccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c(Br)c1	ZINC000450513156	GF	On-Demand	Anodyne	GRIA1	44	35
Cc1ccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c(Br)c1	ZINC000450513156	GF	On-Demand	Anodyne	YARS	50	32
Cc1ccc(CC(=O)N[C@H](CO)Cc2ccc(O)cc2)c(Br)c1	ZINC000450513156	GF	On-Demand	Anodyne	PCNA	0	42
CC1(C(=O)N2CCCN(c3ccc(Cl)c(Cl)c3)CC2)CCC(=O)CC1	ZINC000450513157	GI	On-Demand	Anodyne	CCR1	28	41
CC1(C(=O)N2CCCN(c3ccc(Cl)c(Cl)c3)CC2)CCC(=O)CC1	ZINC000450513157	GI	On-Demand	Anodyne	BCL2A1	43	34
CC[C@@H](O)CC(=O)Nc1cc(Cl)c(O)c(Cl)c1	ZINC000450513161	CF	On-Demand	Anodyne	SLC1A1	42	34
CC[C@@H](O)CC(=O)Nc1cc(Cl)c(O)c(Cl)c1	ZINC000450513161	CF	On-Demand	Anodyne	SLC1A3	44	33
CC[C@@H](O)CC(=O)Nc1cc(Cl)c(O)c(Cl)c1	ZINC000450513161	CF	On-Demand	Anodyne	SLC1A2	47	33
CC[C@H](O)CC(=O)Nc1cc(Cl)c(O)c(Cl)c1	ZINC000450513162	CF	On-Demand	Anodyne	SLC1A1	42	34
CC[C@H](O)CC(=O)Nc1cc(Cl)c(O)c(Cl)c1	ZINC000450513162	CF	On-Demand	Anodyne	SLC1A3	44	33
CC[C@H](O)CC(=O)Nc1cc(Cl)c(O)c(Cl)c1	ZINC000450513162	CF	On-Demand	Anodyne	SLC1A2	47	33
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513163	GF	On-Demand	Anodyne	MC4R	55	40
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513163	GF	On-Demand	Anodyne	NPY2R	64	38
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450513164	GF	On-Demand	Anodyne	MC4R	55	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450513164	GF	On-Demand	Anodyne	NPY2R	64	38
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450513165	GF	On-Demand	Anodyne	MC4R	55	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1	ZINC000450513165	GF	On-Demand	Anodyne	NPY2R	64	38
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513166	GF	On-Demand	Anodyne	MC4R	55	40
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513166	GF	On-Demand	Anodyne	NPY2R	64	38
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	HTR1A	43	47
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	DRD2	41	47
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	DRD4	32	44
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	SLC6A1	41	39
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	HRH1	17	52
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	DRD3	47	52
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	HTR4	47	49
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	CHRM3	18	41
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	SIGMAR1	21	48
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	CCR3	21	40
COc1ccccc1NC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450513167	FI	On-Demand	Anodyne	CACNA1G	39	42
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	HTR1A	43	47
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	DRD2	41	47
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	DRD4	32	44
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	SLC6A1	41	39
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	HRH1	17	52
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	DRD3	47	52
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	HTR4	47	49
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	CHRM3	18	41
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	SIGMAR1	21	48
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	CCR3	21	40
COc1ccccc1NC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450513168	FI	On-Demand	Anodyne	CACNA1G	39	42
COC(=O)c1csc(CN2CCCc3cc(Cl)ccc32)n1	ZINC000450513172	DH	On-Demand	Anodyne	CNR1	51	32
CC(C)N(CCN(C)C(=O)c1cc(Cl)c2ccccc2n1)C(C)C	ZINC000450513173	EI	On-Demand	Anodyne	TSPO	44	47
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450513174	FE	On-Demand	Anodyne	CCR5	80	34
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450513176	FE	On-Demand	Anodyne	CCR5	80	34
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450513177	FE	On-Demand	Anodyne	CCR5	80	34
CC(C)(C)Oc1cc(F)ccc1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450513185	GJ	On-Demand	Bother	PYGL	28	42
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(C)C	ZINC000450513189	FF	On-Demand	Anodyne	ACE	41	42
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(C)C	ZINC000450513189	FF	On-Demand	Anodyne	PREP	82	46
CC(C)N(CCN(C)C(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(C)C	ZINC000450513189	FF	On-Demand	Anodyne	TMPRSS11D	51	34
COc1ccc(C(=O)NCc2cc(C(=O)O)c(C)o2)c(OC2CCCC2)c1	ZINC000450513192	FH	On-Demand	Anodyne	PDE4B	16	40
O=C(O)c1cccc(CNC(=O)C2(Cc3ccccc3F)CC2)c1	ZINC000450513194	EG	On-Demand	Anodyne	AKR1C3	27	42
COc1ccc(-c2noc(N3CCc4ccc(S(C)(=O)=O)cc4CC3)n2)cc1	ZINC000450513195	GF	On-Demand	Anodyne	PTGS2	15	42
COc1ccc(C(=O)Nc2ccn(CC(=O)O)n2)c(OC2CCCC2)c1	ZINC000450513197	FD	On-Demand	Anodyne	LUCI_LUCLA	17	44
COC(=O)c1ccc(CNC2(c3ccccc3)CCC2)cc1Cl	ZINC000450513202	EI	On-Demand	Anodyne	ALOX5AP	21	42
COC(=O)c1ccc(CNC2(c3ccccc3)CCC2)cc1Cl	ZINC000450513202	EI	On-Demand	Anodyne	TACR3	65	36
COc1cc(N2CCN(c3nccc(-c4cnccn4)n3)CC2)ccc1F	ZINC000450513210	FE	On-Demand	Anodyne	DYRK1B	26	42
COc1cc(CC(=O)N(C)CCN(C(C)C)C(C)C)ccc1O	ZINC000450513211	DF	On-Demand	Anodyne	TRPV1	27	44
COc1cc(CC(=O)N(C)CCN(C(C)C)C(C)C)ccc1O	ZINC000450513211	DF	On-Demand	Anodyne	ALOX15	0	46
COc1cc(CC(=O)N(C)CCN(C(C)C)C(C)C)ccc1O	ZINC000450513211	DF	On-Demand	Anodyne	NCE103	25	49
COc1cc(CC(=O)N(C)CCN(C(C)C)C(C)C)ccc1O	ZINC000450513211	DF	On-Demand	Anodyne	CAN2	0	49
FC(F)c1cnc(N2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)nc1	ZINC000450513220	DI	On-Demand	Anodyne	SLC18A3	35	46
Cc1oc(C(C)C)cc1C(=O)NCc1cccc(C(=O)O)c1	ZINC000450513236	DG	On-Demand	Anodyne	MMP13	17	44
CC(C)(C)Oc1cc(F)ccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450513248	EH	On-Demand	Anodyne	HDAC1	24	43
CC(C)(C)Oc1cc(F)ccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450513248	EH	On-Demand	Anodyne	HPGDS	15	41
O=C(CC1(O)CCC1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450513252	CF	On-Demand	Anodyne	PREP	50	41
O=C(CC1(O)CCC1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450513253	CF	On-Demand	Anodyne	PREP	50	41
O=C(CC1(O)CCC1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450513254	CF	On-Demand	Anodyne	PREP	50	41
O=C(CC1(O)CCC1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450513255	CF	On-Demand	Anodyne	PREP	50	41
CC(C)(C)Oc1cc(F)ccc1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450513261	EI	On-Demand	Anodyne	NCE103	24	40
CC(C)(C)Oc1cc(F)ccc1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450513261	EI	On-Demand	Anodyne	CAN2	0	40
CCC[C@H](NC(=O)c1cc(OC)c(OC)cc1Cl)C(=O)O	ZINC000450513276	DE	On-Demand	Anodyne	NOD1	41	33
CCC[C@@H](NC(=O)c1cc(OC)c(OC)cc1Cl)C(=O)O	ZINC000450513277	DE	On-Demand	Anodyne	NOD1	41	33
C[C@@H]1CC[C@H](C(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)O1	ZINC000450513293	EI	On-Demand	Anodyne	KCNJ11	71	39
C[C@@H]1CC[C@H](C(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)O1	ZINC000450513294	EI	On-Demand	Anodyne	KCNJ11	71	39
O=C1CN(CCNC(=O)c2ccc(C(F)(F)F)[nH]2)CCN1	ZINC000450513303	DC	On-Demand	Anodyne	PLD2	63	36
COc1ccc(Oc2ccc(C(=O)NCCN3CCNC(=O)C3)nc2)cc1	ZINC000450513307	FD	On-Demand	Anodyne	DRD4	46	35
CC[C@]1(C)C[C@@H]1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513321	EF	On-Demand	Anodyne	EDNRB	35	46
CC[C@]1(C)C[C@@H]1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513321	EF	On-Demand	Anodyne	EDNRA	43	37
CC[C@]1(C)C[C@@H]1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513321	EF	On-Demand	Anodyne	SLC15A2	0	44
CC[C@]1(C)C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513322	EF	On-Demand	Anodyne	EDNRB	35	46
CC[C@]1(C)C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513322	EF	On-Demand	Anodyne	EDNRA	43	37
CC[C@]1(C)C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513322	EF	On-Demand	Anodyne	SLC15A2	0	44
CC[C@]1(C)C[C@H]1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513323	EF	On-Demand	Anodyne	EDNRB	35	46
CC[C@]1(C)C[C@H]1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513323	EF	On-Demand	Anodyne	EDNRA	43	37
CC[C@]1(C)C[C@H]1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513323	EF	On-Demand	Anodyne	SLC15A2	0	44
CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513324	EF	On-Demand	Anodyne	EDNRB	35	46
CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513324	EF	On-Demand	Anodyne	EDNRA	43	37
CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513324	EF	On-Demand	Anodyne	SLC15A2	0	44
CCOc1nc2ccc(C(=O)N3CC[C@H](n4ncc5ccccc54)C3)cc2[nH]1	ZINC000450513330	GG	On-Demand	Anodyne	FPR2	28	40
CCOc1nc2ccc(C(=O)N3CC[C@H](n4ncc5ccccc54)C3)cc2[nH]1	ZINC000450513330	GG	On-Demand	Anodyne	L3MBTL3	42	33
CCOc1nc2ccc(C(=O)N3CC[C@@H](n4ncc5ccccc54)C3)cc2[nH]1	ZINC000450513331	GG	On-Demand	Anodyne	FPR2	28	40
CCOc1nc2ccc(C(=O)N3CC[C@@H](n4ncc5ccccc54)C3)cc2[nH]1	ZINC000450513331	GG	On-Demand	Anodyne	L3MBTL3	42	33
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)cn1	ZINC000450513332	GH	On-Demand	Anodyne	L3MBTL3	50	36
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)cn1	ZINC000450513333	GH	On-Demand	Anodyne	L3MBTL3	50	36
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	DRD4	39	43
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	ACHE	22	43
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	SIGMAR1	26	49
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	CCR1	28	41
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	MAPK1	28	46
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	HSP90AA1	20	41
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	CXCR3	34	41
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	MCHR1	44	47
CC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)cc1	ZINC000450513337	GI	On-Demand	Anodyne	CACNA1I	52	41
Cc1cccc([C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)c1	ZINC000450513349	GI	On-Demand	Bother	PGR	0	46
Cc1cccc([C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)c1	ZINC000450513349	GI	On-Demand	Bother	CACNA1D	47	36
Cc1cccc([C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)c1	ZINC000450513350	GI	On-Demand	Bother	PGR	0	46
Cc1cccc([C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)c1	ZINC000450513350	GI	On-Demand	Bother	CACNA1D	47	36
CC(C)c1ccc(C[C@@H](C)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450513364	CG	On-Demand	Anodyne	YARS	40	31
CC(C)c1ccc(C[C@@H](C)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450513364	CG	On-Demand	Anodyne	ACE2	32	40
CC(C)c1ccc(C[C@@H](C)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450513365	CG	On-Demand	Anodyne	YARS	40	31
CC(C)c1ccc(C[C@@H](C)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450513365	CG	On-Demand	Anodyne	ACE2	32	40
CC(C)c1ccc(C[C@H](C)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450513366	CG	On-Demand	Anodyne	YARS	40	31
CC(C)c1ccc(C[C@H](C)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450513366	CG	On-Demand	Anodyne	ACE2	32	40
CC(C)c1ccc(C[C@H](C)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450513367	CG	On-Demand	Anodyne	YARS	40	31
CC(C)c1ccc(C[C@H](C)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450513367	CG	On-Demand	Anodyne	ACE2	32	40
COC(=O)C1(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)CC1	ZINC000450513370	EE	On-Demand	Anodyne	CCR3	44	35
COC(=O)C1(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)CC1	ZINC000450513370	EE	On-Demand	Anodyne	CACNA1G	44	47
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450513373	FE	On-Demand	Anodyne	CCR5	80	34
Cc1ccccc1C(=O)NC1CCN(CC23CCC(CC2)C3)CC1	ZINC000450513379	EH	On-Demand	Anodyne	DRD4	24	53
Cc1ccccc1C(=O)NC1CCN(CC23CCC(CC2)C3)CC1	ZINC000450513379	EH	On-Demand	Anodyne	SIGMAR1	21	46
Cc1ccccc1C(=O)NC1CCN(CC23CCC(CC2)C3)CC1	ZINC000450513379	EH	On-Demand	Anodyne	CCR8	68	39
COCCN(C)CCCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450513382	FF	On-Demand	Anodyne	ENPP2	19	40
Cc1nc(N[C@H]2CCO[C@@H]2c2cncc(Br)c2)ncc1[N+](=O)[O-]	ZINC000450513383	GF	On-Demand	Bother	PRKCQ	45	36
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@@H]2CCNC(=O)CC2)CC1	ZINC000450513384	GD	On-Demand	Anodyne	CCR3	57	40
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@@H]2CCNC(=O)CC2)CC1	ZINC000450513385	GD	On-Demand	Anodyne	CCR3	57	40
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@H]2CCNC(=O)CC2)CC1	ZINC000450513386	GD	On-Demand	Anodyne	CCR3	57	40
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C[C@H]2CCNC(=O)CC2)CC1	ZINC000450513387	GD	On-Demand	Anodyne	CCR3	57	40
CC(=O)c1ccc(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513391	GH	On-Demand	Anodyne	PLA2G2A	0	44
CC(=O)c1ccc(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513391	GH	On-Demand	Anodyne	S1PR4	23	46
CC(=O)c1ccc(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513391	GH	On-Demand	Anodyne	S1PR1	17	46
CC(=O)c1ccc(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513391	GH	On-Demand	Anodyne	S1PR5	38	43
CC(=O)c1ccc(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513391	GH	On-Demand	Anodyne	DPP7	22	40
CC(=O)c1ccc(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513392	GH	On-Demand	Anodyne	PLA2G2A	0	44
CC(=O)c1ccc(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513392	GH	On-Demand	Anodyne	S1PR4	23	46
CC(=O)c1ccc(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513392	GH	On-Demand	Anodyne	S1PR1	17	46
CC(=O)c1ccc(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513392	GH	On-Demand	Anodyne	S1PR5	38	43
CC(=O)c1ccc(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)cc1	ZINC000450513392	GH	On-Demand	Anodyne	DPP7	22	40
CCc1cc(CCCN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)on1	ZINC000450513393	FH	On-Demand	Anodyne	CCR3	88	44
CCc1cc(CCCN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)on1	ZINC000450513393	FH	On-Demand	Anodyne	CHRNA7	22	40
CCc1cc(CCCN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)on1	ZINC000450513393	FH	On-Demand	Anodyne	EPHX2	51	41
CCOC(=O)c1ccc(CN2CCc3cccc(C)c32)nc1	ZINC000450513394	CG	On-Demand	Anodyne	NOD2	18	40
COc1cc(CNC(=O)CC(C)(C)C(F)(F)F)ccc1C(=O)O	ZINC000450513398	EF	On-Demand	Anodyne	TRPV1	38	45
COc1cc(CNC(=O)CC(C)(C)C(F)(F)F)ccc1C(=O)O	ZINC000450513398	EF	On-Demand	Anodyne	MT-ND1	24	41
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	HTR1A	77	56
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	DRD2	78	51
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	DRD1	31	45
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	DRD4	60	48
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	ACHE	24	44
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	HTR2A	47	48
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	HTR2C	29	56
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	SLC6A1	67	40
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	ADRA1A	43	39
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	HRH1	30	55
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	ADRA1B	36	45
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	DRD3	76	46
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	HTR4	63	53
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	CHRM3	21	45
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	HTR7	59	56
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	SIGMAR1	44	46
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	CHRNA7	15	41
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	EBP	24	42
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	ABCB1	0	45
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	MCHR1	22	51
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	CACNA1G	45	41
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513403	GI	On-Demand	Anodyne	CYP2J2	65	46
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)nc1	ZINC000450513407	GG	On-Demand	Anodyne	HTR4	19	42
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)nc1	ZINC000450513407	GG	On-Demand	Anodyne	CHRM3	21	41
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)nc1	ZINC000450513407	GG	On-Demand	Anodyne	SSTR5	69	41
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccccc3OC)CC2)nc1	ZINC000450513407	GG	On-Demand	Anodyne	CACNA1G	32	40
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	DRD4	29	41
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	HRH3	16	46
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	BDKRB1	21	43
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	LSS	16	53
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	FAAH	19	43
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	MCHR1	30	41
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	CACNA1I	15	44
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	CCR8	23	40
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1Cl	ZINC000450513411	GG	On-Demand	Anodyne	GPR183	0	41
CNc1nc(N2CCN(C)[C@H](c3nc(C)no3)C2)nc2ccccc12	ZINC000450513413	ED	On-Demand	Anodyne	HRH4	20	42
CNc1nc(N2CCN(C)[C@@H](c3nc(C)no3)C2)nc2ccccc12	ZINC000450513414	ED	On-Demand	Anodyne	HRH4	20	42
Cn1nc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)c2c1CCCC2	ZINC000450513416	ED	On-Demand	Anodyne	YARS	40	31
COc1cc(CNC(=O)[C@H](C)C2CC2)ccc1C(=O)O	ZINC000450513417	CE	On-Demand	Anodyne	ABCC8	24	41
COc1cc(CNC(=O)[C@H](C)C2CC2)ccc1C(=O)O	ZINC000450513417	CE	On-Demand	Anodyne	ADRB3	33	44
COc1cc(CNC(=O)[C@H](C)C2CC2)ccc1C(=O)O	ZINC000450513417	CE	On-Demand	Anodyne	TRPV1	33	42
COc1cc(CNC(=O)[C@@H](C)C2CC2)ccc1C(=O)O	ZINC000450513418	CE	On-Demand	Anodyne	ABCC8	24	41
COc1cc(CNC(=O)[C@@H](C)C2CC2)ccc1C(=O)O	ZINC000450513418	CE	On-Demand	Anodyne	ADRB3	33	44
COc1cc(CNC(=O)[C@@H](C)C2CC2)ccc1C(=O)O	ZINC000450513418	CE	On-Demand	Anodyne	TRPV1	33	42
COCCOC[C@@H](O)CN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513420	GD	On-Demand	Anodyne	ACOX1	45	35
COCCOC[C@@H](O)CN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513420	GD	On-Demand	Anodyne	ABCB1	59	36
COCCOC[C@@H](O)CN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513420	GD	On-Demand	Anodyne	HSP90AB1	37	40
COCCOC[C@H](O)CN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513421	GD	On-Demand	Anodyne	ACOX1	45	35
COCCOC[C@H](O)CN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513421	GD	On-Demand	Anodyne	ABCB1	59	36
COCCOC[C@H](O)CN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513421	GD	On-Demand	Anodyne	HSP90AB1	37	40
COCCOC[C@H](O)CN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513422	GD	On-Demand	Anodyne	ACOX1	45	35
COCCOC[C@H](O)CN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513422	GD	On-Demand	Anodyne	ABCB1	59	36
COCCOC[C@H](O)CN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513422	GD	On-Demand	Anodyne	HSP90AB1	37	40
COCCOC[C@@H](O)CN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513423	GD	On-Demand	Anodyne	ACOX1	45	35
COCCOC[C@@H](O)CN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513423	GD	On-Demand	Anodyne	ABCB1	59	36
COCCOC[C@@H](O)CN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1	ZINC000450513423	GD	On-Demand	Anodyne	HSP90AB1	37	40
CCC[C@@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)C(C)C	ZINC000450513425	DG	On-Demand	Anodyne	ADRB3	22	41
CCC[C@@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)C(C)C	ZINC000450513425	DG	On-Demand	Anodyne	TRPV1	17	41
CCC[C@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)C(C)C	ZINC000450513426	DG	On-Demand	Anodyne	ADRB3	22	41
CCC[C@H](C(=O)NCc1ccc(C(=O)O)c(OC)c1)C(C)C	ZINC000450513426	DG	On-Demand	Anodyne	TRPV1	17	41
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450513431	FH	On-Demand	Anodyne	CHRM3	20	46
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450513431	FH	On-Demand	Anodyne	SIGMAR1	19	40
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450513431	FH	On-Demand	Anodyne	CCR3	64	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450513431	FH	On-Demand	Anodyne	EPHX2	53	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450513431	FH	On-Demand	Anodyne	CXCR3	23	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450513432	FH	On-Demand	Anodyne	CHRM3	20	46
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450513432	FH	On-Demand	Anodyne	SIGMAR1	19	40
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450513432	FH	On-Demand	Anodyne	CCR3	64	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450513432	FH	On-Demand	Anodyne	EPHX2	53	43
O=C(Nc1ccc(F)cc1)NC1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450513432	FH	On-Demand	Anodyne	CXCR3	23	43
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	PPARA	21	41
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	ADRB3	18	43
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	TRPV1	0	40
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	PPARD	24	41
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	MTNR1A	30	41
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	MTNR1B	25	43
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	S1PR2	40	30
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	MT-ND1	25	43
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	U38	0	45
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	LUCI_LUCLA	16	43
CCCOc1cc(OC)ccc1C(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513439	FG	On-Demand	Anodyne	AKR1C2	53	38
Cc1ccc(C(=O)N2CCCc3cccc(O)c32)c2c1CCC2	ZINC000450513440	DH	On-Demand	Anodyne	AVPR2	45	40
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	TSHR	53	31
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	PPARG	16	40
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	PDGFRB	27	41
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	COLA	52	38
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	CPT1A	50	38
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	PRNP	19	48
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	FLT1	24	41
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	KDR	50	41
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	GRM4	24	42
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	PLA2G4B	60	37
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	CPT1B	40	34
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	PDGFRA	55	41
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	CSF1R	17	41
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	ENPP1	40	32
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	GLMU	0	41
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	KCNK3	46	40
COc1cc(Cl)c(C(=O)Nc2ccc(OCCCC(=O)O)cc2)cc1OC	ZINC000450513447	GH	On-Demand	Anodyne	KCNK9	35	40
Cc1ccc(C(=O)N2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450513459	DE	On-Demand	Anodyne	SLC6A7	0	43
Cc1ccc(C(=O)N2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450513460	DE	On-Demand	Anodyne	SLC6A7	0	43
O=C(Cc1ccc(Cl)c(F)c1)N[C@]1(C(=O)O)CCSC1	ZINC000450513462	DE	On-Demand	Anodyne	ENV	42	32
O=C(Cc1ccc(Cl)c(F)c1)N[C@@]1(C(=O)O)CCSC1	ZINC000450513463	DE	On-Demand	Anodyne	ENV	42	32
CCCCCN(CCCOC)C(=O)c1ccc2cnccc2c1	ZINC000450513466	DH	On-Demand	Anodyne	THRA	44	33
Cc1cc(OCC(=O)O)ccc1NC(=O)C1(C)CC1	ZINC000450513495	CE	On-Demand	Anodyne	PPARD	42	40
NS(=O)(=O)c1ccc2c(c1)CCN2CCCC(=O)c1ccc(F)cc1	ZINC000450513499	FE	On-Demand	Anodyne	CA2	21	47
NS(=O)(=O)c1ccc2c(c1)CCN2CCCC(=O)c1ccc(F)cc1	ZINC000450513499	FE	On-Demand	Anodyne	HTR2A	18	44
NS(=O)(=O)c1ccc2c(c1)CCN2CCCC(=O)c1ccc(F)cc1	ZINC000450513499	FE	On-Demand	Anodyne	CA1	18	47
NS(=O)(=O)c1ccc2c(c1)CCN2CCCC(=O)c1ccc(F)cc1	ZINC000450513499	FE	On-Demand	Anodyne	CA7	28	47
NS(=O)(=O)c1ccc2c(c1)CCN2CCCC(=O)c1ccc(F)cc1	ZINC000450513499	FE	On-Demand	Anodyne	CA12	15	47
CS(=O)(=O)c1cc(CNc2nncs2)cc(C(F)(F)F)c1	ZINC000450513505	ED	On-Demand	Anodyne	PTGS2	15	42
CC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450513512	CE	On-Demand	Anodyne	CCKAR	0	40
CC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450513512	CE	On-Demand	Anodyne	PIN1	25	41
CC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450513512	CE	On-Demand	Anodyne	NCE103	48	37
CC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450513513	CE	On-Demand	Anodyne	CCKAR	0	40
CC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450513513	CE	On-Demand	Anodyne	PIN1	25	41
CC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450513513	CE	On-Demand	Anodyne	NCE103	48	37
CC(C)c1cc(C(=O)NCc2cccc(C(=O)O)c2)no1	ZINC000450513531	CE	On-Demand	Anodyne	MMP13	24	45
CC(C)c1cc(C(=O)NCc2cccc(C(=O)O)c2)no1	ZINC000450513531	CE	On-Demand	Anodyne	NR1H4	46	36
CC(C)c1cc(C(=O)NCc2cccc(C(=O)O)c2)no1	ZINC000450513531	CE	On-Demand	Anodyne	CARM1	45	36
CC(C)c1cc(C(=O)NCc2cccc(C(=O)O)c2)no1	ZINC000450513531	CE	On-Demand	Anodyne	KDM4E	30	40
CC(C)c1cc(C(=O)NCc2cccc(C(=O)O)c2)no1	ZINC000450513531	CE	On-Demand	Anodyne	PDS	44	34
CC(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513536	FG	On-Demand	Anodyne	MC4R	49	41
CC(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513536	FG	On-Demand	Anodyne	PRCP	50	38
CC(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513536	FG	On-Demand	Anodyne	MC3R	45	41
CC(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513536	FG	On-Demand	Anodyne	MC5R	36	41
CC(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513537	FG	On-Demand	Anodyne	MC4R	49	41
CC(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513537	FG	On-Demand	Anodyne	PRCP	50	38
CC(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513537	FG	On-Demand	Anodyne	MC3R	45	41
CC(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513537	FG	On-Demand	Anodyne	MC5R	36	41
CC(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513538	FG	On-Demand	Anodyne	MC4R	49	41
CC(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513538	FG	On-Demand	Anodyne	PRCP	50	38
CC(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513538	FG	On-Demand	Anodyne	MC3R	45	41
CC(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513538	FG	On-Demand	Anodyne	MC5R	36	41
CC(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513539	FG	On-Demand	Anodyne	MC4R	49	41
CC(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513539	FG	On-Demand	Anodyne	PRCP	50	38
CC(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513539	FG	On-Demand	Anodyne	MC3R	45	41
CC(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450513539	FG	On-Demand	Anodyne	MC5R	36	41
COCc1nn(C)cc1C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450513540	EF	On-Demand	Anodyne	COLA	56	35
COCc1nn(C)cc1C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450513541	EF	On-Demand	Anodyne	COLA	56	35
COCc1nn(C)cc1C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450513542	EF	On-Demand	Anodyne	COLA	56	35
COCc1nn(C)cc1C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450513543	EF	On-Demand	Anodyne	COLA	56	35
Cc1nnnn1-c1ccc(C(=O)N2CCN(C(C)C)C(=O)C2)c(F)c1	ZINC000450513553	EC	On-Demand	Anodyne	P2RX7	17	44
COc1ccc([C@H](NC(=O)CCCC(=O)C(C)(C)C)C(F)(F)F)cc1	ZINC000450513564	FI	On-Demand	Anodyne	CTSK	16	43
COc1ccc([C@H](NC(=O)CCCC(=O)C(C)(C)C)C(F)(F)F)cc1	ZINC000450513564	FI	On-Demand	Anodyne	DXR	19	40
COc1ccc([C@@H](NC(=O)CCCC(=O)C(C)(C)C)C(F)(F)F)cc1	ZINC000450513565	FI	On-Demand	Anodyne	CTSK	16	43
COc1ccc([C@@H](NC(=O)CCCC(=O)C(C)(C)C)C(F)(F)F)cc1	ZINC000450513565	FI	On-Demand	Anodyne	DXR	19	40
CC1(C(=O)Nc2ccc(-n3ncc(C(=O)O)c3C(F)(F)F)cc2)CC1	ZINC000450513576	FG	On-Demand	Anodyne	MST1R	48	38
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H](O)C1CCC1	ZINC000450513580	CC	On-Demand	Anodyne	OPRM1	58	40
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H](O)C1CCC1	ZINC000450513580	CC	On-Demand	Anodyne	SOAT1	0	43
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H](O)C1CCC1	ZINC000450513580	CC	On-Demand	Anodyne	YARS	78	46
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H](O)C1CCC1	ZINC000450513580	CC	On-Demand	Anodyne	ACE2	24	43
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H](O)C1CCC1	ZINC000450513580	CC	On-Demand	Anodyne	SLC15A2	0	46
COc1ccc(-c2noc(N3CCN(c4ccc(F)c(OC)c4)CC3)n2)cc1	ZINC000450513581	GG	On-Demand	Anodyne	LUCI_PHOPE	29	44
COc1ccc(-c2noc(N3CCN(c4ccc(F)c(OC)c4)CC3)n2)cc1	ZINC000450513581	GG	On-Demand	Anodyne	WNT3A	19	40
COc1ccc(-c2noc(N3CCN(c4ccc(F)c(OC)c4)CC3)n2)cc1	ZINC000450513581	GG	On-Demand	Anodyne	AXIN2	0	40
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H](O)C1CCC1	ZINC000450513582	CC	On-Demand	Anodyne	OPRM1	58	40
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H](O)C1CCC1	ZINC000450513582	CC	On-Demand	Anodyne	SOAT1	0	43
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H](O)C1CCC1	ZINC000450513582	CC	On-Demand	Anodyne	YARS	78	46
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H](O)C1CCC1	ZINC000450513582	CC	On-Demand	Anodyne	ACE2	24	43
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H](O)C1CCC1	ZINC000450513582	CC	On-Demand	Anodyne	SLC15A2	0	46
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCCC3(F)F)CC2)cc1	ZINC000450513583	EH	On-Demand	Anodyne	L3MBTL1	0	40
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCCC3(F)F)CC2)cc1	ZINC000450513583	EH	On-Demand	Anodyne	L3MBTL3	74	38
Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCCC3(F)F)CC2)cc1	ZINC000450513583	EH	On-Demand	Anodyne	SLC6A7	0	40
Cc1ccc(C(=O)N2CCN(C[C@H]3CCCCC3(F)F)CC2)cc1	ZINC000450513584	EH	On-Demand	Anodyne	L3MBTL1	0	40
Cc1ccc(C(=O)N2CCN(C[C@H]3CCCCC3(F)F)CC2)cc1	ZINC000450513584	EH	On-Demand	Anodyne	L3MBTL3	74	38
Cc1ccc(C(=O)N2CCN(C[C@H]3CCCCC3(F)F)CC2)cc1	ZINC000450513584	EH	On-Demand	Anodyne	SLC6A7	0	40
COc1ccccc1NC(=O)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450513586	EH	On-Demand	Anodyne	HTR1A	18	40
COc1ccccc1NC(=O)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450513586	EH	On-Demand	Anodyne	DRD4	15	41
COc1ccccc1NC(=O)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450513586	EH	On-Demand	Anodyne	HTR4	15	46
COc1cc(CNC(=O)C2(OC)CCCCC2)ccc1C(=O)O	ZINC000450513590	DE	On-Demand	Anodyne	ABCC8	24	41
COc1cc(CNC(=O)C2(OC)CCCCC2)ccc1C(=O)O	ZINC000450513590	DE	On-Demand	Anodyne	TRPV1	25	40
COc1cc(CNC(=O)c2cc(S(=O)(=O)N(C)C)cn2C)ccc1C(=O)O	ZINC000450513591	GC	On-Demand	Anodyne	UL54	56	32
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	HTR1A	15	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CHRM1	20	44
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	DRD2	45	50
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CNR1	35	47
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	DRD4	71	61
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	ADRA1D	19	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	HTR2A	41	61
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	HTR2C	22	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	SLC6A1	50	37
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	SLC6A4	27	41
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	ADRA1A	23	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	HRH1	21	43
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	ADRA1B	22	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	DRD3	36	46
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	AVPR1A	28	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	SLC6A3	21	43
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	HTR4	61	44
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CHRM3	20	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	LTA4H	15	43
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CNR2	33	47
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	HTR7	15	60
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	SIGMAR1	54	53
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	PRCP	26	40
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	SSTR5	44	38
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CCR1	49	46
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CCR3	50	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CCR5	24	40
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	UTS2R	29	40
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	ABCB1	0	40
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CCR2	20	42
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	SLC6A5	48	38
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	C5AR1	28	43
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CXCR3	29	40
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	MCHR1	60	50
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	CCR8	71	38
Cc1ccccc1C(=O)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450513595	FI	On-Demand	Anodyne	BIRC2	59	41
COC1(C)CN(C(=O)C2=C(c3ccccc3)CCC2)C1	ZINC000450513596	CF	On-Demand	Anodyne	CHRM5	36	40
COC(=O)c1coc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)n1	ZINC000450513601	ED	On-Demand	Anodyne	GPR183	0	41
COC(=O)c1coc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)n1	ZINC000450513601	ED	On-Demand	Anodyne	SLC6A7	0	40
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	HTR1A	25	70
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	CHRM1	20	42
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	DRD2	45	61
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	DRD1	20	48
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	DRD4	39	54
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	ADRA1D	18	42
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	HTR2A	45	60
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	HTR2C	30	63
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	SLC6A1	53	35
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	ADRA1A	17	48
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	HRH1	19	47
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	ADRA1B	23	43
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	DRD3	23	54
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	KCNH2	16	42
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	ERG2	20	43
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	HTR7	41	46
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	TACR2	25	42
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	SIGMAR1	40	52
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	NPY2R	22	42
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	CCR3	120	52
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	CHRNA7	33	45
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	SLC18A3	0	47
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	HTR3B	0	48
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	EPHX2	69	56
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	CXCR3	21	43
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	MCHR1	42	52
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	CACNA1G	33	40
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	CYP2J2	63	44
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	NET	0	43
O=C(Nc1ccc(F)cc1)NC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450513602	GI	On-Demand	Anodyne	AP2S1	0	43
CCc1cc(CCCN2CCN(C(=O)c3ccc(C)cc3)CC2)on1	ZINC000450513603	EF	On-Demand	Anodyne	PLA2G2A	58	53
CCc1cc(CCCN2CCN(C(=O)c3ccc(C)cc3)CC2)on1	ZINC000450513603	EF	On-Demand	Anodyne	SLC6A7	0	40
COC(=O)c1csc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)n1	ZINC000450513609	GI	On-Demand	Anodyne	SSTR5	42	42
Cc1nc2ccnn2cc1C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450513613	EH	On-Demand	Anodyne	BCL2	0	42
CCC[C@@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C(=O)O	ZINC000450513617	FH	On-Demand	Anodyne	MAP	0	60
CCC[C@@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C(=O)O	ZINC000450513617	FH	On-Demand	Anodyne	ACE2	50	35
CCC[C@@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C(=O)O	ZINC000450513617	FH	On-Demand	Anodyne	BLA1_STEMA	23	42
CCC[C@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C(=O)O	ZINC000450513619	FH	On-Demand	Anodyne	MAP	0	60
CCC[C@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C(=O)O	ZINC000450513619	FH	On-Demand	Anodyne	ACE2	50	35
CCC[C@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C(=O)O	ZINC000450513619	FH	On-Demand	Anodyne	BLA1_STEMA	23	42
C[C@H](O)CCN1CCCc2cc(F)ccc21	ZINC000450513635	BE	On-Demand	Anodyne	NAMPT	0	40
C[C@@H](O)CCN1CCCc2cc(F)ccc21	ZINC000450513636	BE	On-Demand	Anodyne	NAMPT	0	40
COc1cc(CNC(=O)C(C)(C)COCc2ccccc2)ccc1C(=O)O	ZINC000450513648	FG	On-Demand	Anodyne	MT-ND1	24	41
COc1cc(CNC(=O)C(C)(C)COCc2ccccc2)ccc1C(=O)O	ZINC000450513648	FG	On-Demand	Anodyne	U38	0	40
COc1cc(CNC(=O)C(C)(C)COCc2ccccc2)ccc1C(=O)O	ZINC000450513648	FG	On-Demand	Anodyne	POBA	0	44
COc1cc(CNC(=O)C2(C)CC2)ccc1C(=O)O	ZINC000450513649	CD	On-Demand	Anodyne	U38	0	43
CCC(CC)Oc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1	ZINC000450513655	FG	On-Demand	Anodyne	GRIA1	43	36
CCC(CC)Oc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1	ZINC000450513655	FG	On-Demand	Anodyne	YARS	52	33
CCC(CC)Oc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1	ZINC000450513655	FG	On-Demand	Anodyne	ACE2	33	40
CCC(CC)Oc1ccc(C(=O)N[C@H](CO)Cc2ccc(O)cc2)cc1	ZINC000450513655	FG	On-Demand	Anodyne	PCNA	0	45
CSCC[C@@H](O)C(=O)N1CC[C@@](O)(Cc2cccc(Cl)c2)C1	ZINC000450513663	ED	On-Demand	Anodyne	CCR1	46	37
CSCC[C@H](O)C(=O)N1CC[C@@](O)(Cc2cccc(Cl)c2)C1	ZINC000450513664	ED	On-Demand	Anodyne	CCR1	46	37
CSCC[C@H](O)C(=O)N1CC[C@](O)(Cc2cccc(Cl)c2)C1	ZINC000450513665	ED	On-Demand	Anodyne	CCR1	46	37
CSCC[C@@H](O)C(=O)N1CC[C@](O)(Cc2cccc(Cl)c2)C1	ZINC000450513666	ED	On-Demand	Anodyne	CCR1	46	37
Cc1ccc(NC(=O)C2CCN(C[C@@H]3CCCCC3(F)F)CC2)nc1	ZINC000450513667	FH	On-Demand	Anodyne	GCK	18	41
Cc1ccc(NC(=O)C2CCN(C[C@H]3CCCCC3(F)F)CC2)nc1	ZINC000450513668	FH	On-Demand	Anodyne	GCK	18	41
COc1cc(CC(=O)NCCN2CCNC(=O)C2)ccc1Cl	ZINC000450513670	EC	On-Demand	Anodyne	DRD4	46	36
COc1cc(CC(=O)NCCN2CCNC(=O)C2)ccc1Cl	ZINC000450513670	EC	On-Demand	Anodyne	HTR4	41	33
COc1cc(CC(=O)NCCN2CCNC(=O)C2)ccc1Cl	ZINC000450513670	EC	On-Demand	Anodyne	NCE103	23	44
COc1cc(CC(=O)NCCN2CCNC(=O)C2)ccc1Cl	ZINC000450513670	EC	On-Demand	Anodyne	CAN2	0	44
O=C(O)[C@H]1CCN(C(=O)C2(Oc3ccccc3F)CC2)C1	ZINC000450513678	CD	On-Demand	Anodyne	SLC6A1	80	38
O=C(O)[C@@H]1CCN(C(=O)C2(Oc3ccccc3F)CC2)C1	ZINC000450513680	CD	On-Demand	Anodyne	SLC6A1	80	38
COC(=O)c1coc(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)n1	ZINC000450513689	GD	On-Demand	Anodyne	HTR7	20	46
COC(=O)c1coc(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)n1	ZINC000450513689	GD	On-Demand	Anodyne	CCR3	15	47
COC(=O)c1coc(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)n1	ZINC000450513689	GD	On-Demand	Anodyne	CACNA1G	19	53
COC(=O)c1coc(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)n1	ZINC000450513689	GD	On-Demand	Anodyne	SFRP1	63	35
COC(=O)c1coc(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)n1	ZINC000450513689	GD	On-Demand	Anodyne	WNT3	40	31
CS[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513694	EF	On-Demand	Anodyne	EDNRB	40	41
CS[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513694	EF	On-Demand	Anodyne	EDNRA	48	43
CS[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513694	EF	On-Demand	Anodyne	MMP14	52	38
CS[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513694	EF	On-Demand	Anodyne	SLC15A2	0	50
CS[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513694	EF	On-Demand	Anodyne	NRDE	0	40
CS[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513696	EF	On-Demand	Anodyne	EDNRB	40	41
CS[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513696	EF	On-Demand	Anodyne	EDNRA	48	43
CS[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513696	EF	On-Demand	Anodyne	MMP14	52	38
CS[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513696	EF	On-Demand	Anodyne	SLC15A2	0	50
CS[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513696	EF	On-Demand	Anodyne	NRDE	0	40
COc1cc(CC(=O)N2CCCc3cccc(O)c32)ccc1Cl	ZINC000450513698	EH	On-Demand	Anodyne	OPRK1	38	41
COC(=O)c1coc(CN2CCCc3cc(Cl)ccc32)n1	ZINC000450513699	DG	On-Demand	Anodyne	CNR1	51	32
CS[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513700	EF	On-Demand	Anodyne	EDNRB	40	41
CS[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513700	EF	On-Demand	Anodyne	EDNRA	48	43
CS[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513700	EF	On-Demand	Anodyne	MMP14	52	38
CS[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513700	EF	On-Demand	Anodyne	SLC15A2	0	50
CS[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513700	EF	On-Demand	Anodyne	NRDE	0	40
CS[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513702	EF	On-Demand	Anodyne	EDNRB	40	41
CS[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513702	EF	On-Demand	Anodyne	EDNRA	48	43
CS[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513702	EF	On-Demand	Anodyne	MMP14	52	38
CS[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513702	EF	On-Demand	Anodyne	SLC15A2	0	50
CS[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450513702	EF	On-Demand	Anodyne	NRDE	0	40
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1C	ZINC000450513707	DF	On-Demand	Anodyne	EPHX2	31	45
O=C1CCC(CN2CCC[C@H]2C(=O)Nc2cc(Cl)cc(Cl)c2)CC1	ZINC000450513712	FI	On-Demand	Anodyne	HSD11B1	38	41
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1C	ZINC000450513713	DF	On-Demand	Anodyne	EPHX2	31	45
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1C	ZINC000450513714	DF	On-Demand	Anodyne	EPHX2	31	45
O=C1CCC(CN2CCC[C@@H]2C(=O)Nc2cc(Cl)cc(Cl)c2)CC1	ZINC000450513715	FI	On-Demand	Anodyne	HSD11B1	38	41
C[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC[C@H]1C	ZINC000450513716	DF	On-Demand	Anodyne	EPHX2	31	45
Cc1noc(C2(C)CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)n1	ZINC000450513723	FF	On-Demand	Anodyne	GHRHR	56	33
Cc1noc(C2(C)CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)n1	ZINC000450513725	FF	On-Demand	Anodyne	GHRHR	56	33
COc1cc(CC(=O)N2CCC(C)(c3nc(C)no3)CC2)ccc1Cl	ZINC000450513740	FG	On-Demand	Anodyne	CCR1	30	41
C[C@H](CCC(=O)O)NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000450513750	EG	On-Demand	Anodyne	SDH1	0	40
C[C@@H](CCC(=O)O)NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000450513751	EG	On-Demand	Anodyne	SDH1	0	40
COc1ccc(CC(=O)NCCN2CCNC(=O)C2)c(Cl)c1OC	ZINC000450513752	FC	On-Demand	Anodyne	DRD4	43	35
C[C@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450513753	GH	On-Demand	Anodyne	XIAP	29	40
C[C@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450513753	GH	On-Demand	Anodyne	BIRC2	70	44
C[C@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@H]1CCCN(C2CCC2)C1	ZINC000450513754	GH	On-Demand	Anodyne	XIAP	29	40
C[C@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@H]1CCCN(C2CCC2)C1	ZINC000450513754	GH	On-Demand	Anodyne	BIRC2	70	44
C[C@@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@H]1CCCN(C2CCC2)C1	ZINC000450513755	GH	On-Demand	Anodyne	XIAP	29	40
C[C@@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@H]1CCCN(C2CCC2)C1	ZINC000450513755	GH	On-Demand	Anodyne	BIRC2	70	44
C[C@@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450513756	GH	On-Demand	Anodyne	XIAP	29	40
C[C@@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450513756	GH	On-Demand	Anodyne	BIRC2	70	44
O=C(N[C@H](c1cccc2ccccc12)C(F)(F)F)[C@H]1CC1(F)F	ZINC000450513759	EI	On-Demand	Anodyne	KCNJ11	95	43
O=C(N[C@@H](c1cccc2ccccc12)C(F)(F)F)[C@H]1CC1(F)F	ZINC000450513760	EI	On-Demand	Anodyne	KCNJ11	95	43
O=C(N[C@H](c1cccc2ccccc12)C(F)(F)F)[C@@H]1CC1(F)F	ZINC000450513761	EI	On-Demand	Anodyne	KCNJ11	95	43
O=C(N[C@@H](c1cccc2ccccc12)C(F)(F)F)[C@@H]1CC1(F)F	ZINC000450513762	EI	On-Demand	Anodyne	KCNJ11	95	43
COC(=O)c1cccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)c1Cl	ZINC000450513777	GG	On-Demand	Anodyne	DRD4	40	33
COC(=O)c1cccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)c1Cl	ZINC000450513777	GG	On-Demand	Anodyne	BDKRB1	17	41
COC(=O)c1cccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)c1Cl	ZINC000450513777	GG	On-Demand	Anodyne	CCR8	33	43
COC(=O)c1cccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)c1Cl	ZINC000450513777	GG	On-Demand	Anodyne	SLC6A7	0	40
O=C(O)c1cccc(CNC(=O)C2(Cc3cccc(F)c3)CCC2)c1	ZINC000450513784	EH	On-Demand	Anodyne	FABP4	26	41
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	DRD2	15	50
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	HTR1D	18	40
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	ADRA1B	16	41
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	KCNH2	15	43
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	SIGMAR1	25	45
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	CCR3	129	45
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	CCR5	31	51
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	CHRNA7	15	44
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	MLNR	34	42
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	CYP2D6	22	40
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	EPHX2	71	51
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	CXCR3	26	42
C[C@@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513786	DE	On-Demand	Anodyne	MCHR1	27	40
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	DRD2	15	50
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	HTR1D	18	40
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	ADRA1B	16	41
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	KCNH2	15	43
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	SIGMAR1	25	45
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	CCR3	129	45
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	CCR5	31	51
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	CHRNA7	15	44
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	MLNR	34	42
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	CYP2D6	22	40
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	EPHX2	71	51
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	CXCR3	26	42
C[C@H](O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450513787	DE	On-Demand	Anodyne	MCHR1	27	40
COC(=O)[C@H](c1cccc(Br)c1)N(C)C(=O)CC1CC(F)(F)C1	ZINC000450513811	GH	On-Demand	Anodyne	KCNA5	0	43
COC(=O)[C@@H](c1cccc(Br)c1)N(C)C(=O)CC1CC(F)(F)C1	ZINC000450513812	GH	On-Demand	Anodyne	KCNA5	0	43
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)CCCc1ncc(C)o1	ZINC000450513821	EF	On-Demand	Anodyne	CES1D	44	33
O=S(=O)(NC1CCN(CC2=CCCCC2)CC1)c1ccccc1	ZINC000450513836	EF	On-Demand	Anodyne	WNT3	51	31
CCc1ccccc1CC(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513844	EF	On-Demand	Anodyne	TRPV1	44	50
CCc1ccccc1CC(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513844	EF	On-Demand	Anodyne	U38	0	46
CCc1ccccc1CC(=O)NCc1ccc(C(=O)O)c(OC)c1	ZINC000450513844	EF	On-Demand	Anodyne	CAN2	0	43
COc1cc(CNC(=O)C2(Cc3cccc(F)c3)CCC2)ccc1C(=O)O	ZINC000450513855	FH	On-Demand	Anodyne	SLC12A5	42	36
CCC[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450513859	ED	On-Demand	Anodyne	ADRA1B	31	43
CCC[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450513859	ED	On-Demand	Anodyne	CCR8	78	38
CCC[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450513859	ED	On-Demand	Anodyne	SFRP1	106	40
CCC[C@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450513859	ED	On-Demand	Anodyne	WNT3	81	39
CCC[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450513860	ED	On-Demand	Anodyne	ADRA1B	31	43
CCC[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450513860	ED	On-Demand	Anodyne	CCR8	78	38
CCC[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450513860	ED	On-Demand	Anodyne	SFRP1	106	40
CCC[C@@H](O)CN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000450513860	ED	On-Demand	Anodyne	WNT3	81	39
Cc1oc(CNC(=O)CCCc2cc(F)ccc2F)cc1C(=O)O	ZINC000450513861	EG	On-Demand	Anodyne	P2RX7	49	42
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	F2	0	43
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	DRD4	50	45
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	ACHE	18	42
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	HRH1	26	51
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	DRD3	28	45
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	HTR4	64	39
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	F10	52	36
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	SIGMAR1	25	43
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	SSTR5	71	49
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	CCR3	41	45
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	EPHX2	23	40
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	CXCR3	31	42
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	MCHR1	43	46
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	STK17B	40	34
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	CACNA1G	34	45
COc1cc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)ccc1Cl	ZINC000450513865	FH	On-Demand	Anodyne	CACNA1I	15	42
CC(C)N1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1=O	ZINC000450513867	GF	On-Demand	Anodyne	HRH4	27	50
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513878	FF	On-Demand	Anodyne	DRD4	41	31
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513878	FF	On-Demand	Anodyne	MTNR1B	36	48
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513878	FF	On-Demand	Anodyne	MT-ND1	24	40
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513878	FF	On-Demand	Anodyne	AKR1C3	31	41
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513878	FF	On-Demand	Anodyne	AKR1C2	44	33
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513879	FG	On-Demand	Anodyne	CHRM1	15	43
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513879	FG	On-Demand	Anodyne	DRD4	19	45
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513879	FG	On-Demand	Anodyne	HTR4	46	35
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513879	FG	On-Demand	Anodyne	SIGMAR1	21	47
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513879	FG	On-Demand	Anodyne	MCHR1	19	44
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513879	FG	On-Demand	Anodyne	CCR8	61	37
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513880	FF	On-Demand	Anodyne	DRD4	41	31
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513880	FF	On-Demand	Anodyne	MTNR1B	36	48
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513880	FF	On-Demand	Anodyne	MT-ND1	24	40
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513880	FF	On-Demand	Anodyne	AKR1C3	31	41
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513880	FF	On-Demand	Anodyne	AKR1C2	44	33
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513881	FF	On-Demand	Anodyne	DRD4	41	31
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513881	FF	On-Demand	Anodyne	MTNR1B	36	48
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513881	FF	On-Demand	Anodyne	MT-ND1	24	40
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513881	FF	On-Demand	Anodyne	AKR1C3	31	41
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513881	FF	On-Demand	Anodyne	AKR1C2	44	33
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513882	FF	On-Demand	Anodyne	DRD4	41	31
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513882	FF	On-Demand	Anodyne	MTNR1B	36	48
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513882	FF	On-Demand	Anodyne	MT-ND1	24	40
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513882	FF	On-Demand	Anodyne	AKR1C3	31	41
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)NCc2cccc(C(=O)O)c2)c1	ZINC000450513882	FF	On-Demand	Anodyne	AKR1C2	44	33
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513885	FG	On-Demand	Anodyne	CHRM1	15	43
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513885	FG	On-Demand	Anodyne	DRD4	19	45
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513885	FG	On-Demand	Anodyne	HTR4	46	35
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513885	FG	On-Demand	Anodyne	SIGMAR1	21	47
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513885	FG	On-Demand	Anodyne	MCHR1	19	44
Cc1ccccc1C(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513885	FG	On-Demand	Anodyne	CCR8	61	37
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513887	FG	On-Demand	Anodyne	CHRM1	15	43
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513887	FG	On-Demand	Anodyne	DRD4	19	45
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513887	FG	On-Demand	Anodyne	HTR4	46	35
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513887	FG	On-Demand	Anodyne	SIGMAR1	21	47
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513887	FG	On-Demand	Anodyne	MCHR1	19	44
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450513887	FG	On-Demand	Anodyne	CCR8	61	37
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513888	FG	On-Demand	Anodyne	CHRM1	15	43
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513888	FG	On-Demand	Anodyne	DRD4	19	45
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513888	FG	On-Demand	Anodyne	HTR4	46	35
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513888	FG	On-Demand	Anodyne	SIGMAR1	21	47
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513888	FG	On-Demand	Anodyne	MCHR1	19	44
Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450513888	FG	On-Demand	Anodyne	CCR8	61	37
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)c1	ZINC000450513892	FH	On-Demand	Anodyne	AKR1C2	52	36
COc1cc(CNC(=O)C2(Cc3ccccc3Cl)CC2)ccc1C(=O)O	ZINC000450513895	FH	On-Demand	Anodyne	ABCC8	19	41
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)c1	ZINC000450513897	FH	On-Demand	Anodyne	AKR1C2	52	36
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)c1	ZINC000450513898	FH	On-Demand	Anodyne	AKR1C2	52	36
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)c1	ZINC000450513899	FH	On-Demand	Anodyne	AKR1C2	52	36
COc1cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)ccc1Cl	ZINC000450513901	FE	On-Demand	Anodyne	HTR1A	25	42
COc1cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)ccc1Cl	ZINC000450513901	FE	On-Demand	Anodyne	DRD2	35	41
COc1cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)ccc1Cl	ZINC000450513901	FE	On-Demand	Anodyne	DRD4	58	42
COc1cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)ccc1Cl	ZINC000450513901	FE	On-Demand	Anodyne	DRD3	34	41
COc1cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)ccc1Cl	ZINC000450513901	FE	On-Demand	Anodyne	HTR4	25	42
COc1cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)ccc1Cl	ZINC000450513901	FE	On-Demand	Anodyne	SSTR5	65	42
COc1cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)ccc1Cl	ZINC000450513901	FE	On-Demand	Anodyne	IKBKB	51	35
COc1cc(CN2CCN(c3ccc(C(N)=O)cn3)CC2)ccc1Cl	ZINC000450513901	FE	On-Demand	Anodyne	CXCR3	28	46
COC(=O)c1csc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)n1	ZINC000450513908	FH	On-Demand	Anodyne	HTR1A	0	51
COC(=O)c1csc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)n1	ZINC000450513908	FH	On-Demand	Anodyne	HTR1D	0	46
COC(=O)c1csc(CN2CC=C(c3c[nH]c4cc(F)ccc34)CC2)n1	ZINC000450513908	FH	On-Demand	Anodyne	SLC6A4	22	51
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450513915	DE	On-Demand	Anodyne	F10	47	31
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450513915	DE	On-Demand	Anodyne	CCR5	33	41
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450513915	DE	On-Demand	Anodyne	NPY5R	15	42
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450513916	DE	On-Demand	Anodyne	F10	47	31
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450513916	DE	On-Demand	Anodyne	CCR5	33	41
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450513916	DE	On-Demand	Anodyne	NPY5R	15	42
O=C([C@H]1CC1(F)F)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450513920	EI	On-Demand	Anodyne	QDPR	0	40
O=C([C@H]1CC1(F)F)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450513920	EI	On-Demand	Anodyne	ADAM10	32	40
O=C([C@@H]1CC1(F)F)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450513927	EI	On-Demand	Anodyne	QDPR	0	40
O=C([C@@H]1CC1(F)F)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450513927	EI	On-Demand	Anodyne	ADAM10	32	40
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HTR1A	71	61
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	DRD2	80	61
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	DRD1	35	47
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	DRD4	57	47
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	ACHE	16	44
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	ADRA1D	41	43
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HTR1D	19	41
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HTR2A	57	53
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HTR2C	38	61
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	ADRA1A	47	47
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HRH1	25	50
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	ADRA1B	41	46
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	DRD3	70	47
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HTR4	51	51
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	ADRA2C	17	42
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	CHRM3	19	41
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HTR2B	15	46
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	ERG2	20	42
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HTR7	59	48
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	SIGMAR1	39	56
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	CCR3	61	41
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	CHRNA7	0	40
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	SLC18A3	26	48
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	EBP	20	42
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	HTR3B	0	47
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	ABCB1	16	42
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	MCHR1	26	45
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	CACNA1G	51	47
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	CYP2J2	62	44
COc1ccccc1NC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450513930	GI	On-Demand	Anodyne	AP2S1	0	42
COc1cccc(C(=O)N(C)CC(=O)N2CCC[C@@H](C(=O)O)C2)c1[N+](=O)[O-]	ZINC000450513933	GC	On-Demand	Bother	SLC6A1	118	42
COc1cccc(C(=O)N(C)CC(=O)N2CCC[C@@H](C(=O)O)C2)c1[N+](=O)[O-]	ZINC000450513933	GC	On-Demand	Bother	FDFT1	30	40
COc1cc(Cl)c(C(=O)NC[C@@H](C)C(=O)O)cc1OC	ZINC000450513936	DD	On-Demand	Anodyne	ITGAV	47	39
COc1cc(Cl)c(C(=O)NC[C@H](C)C(=O)O)cc1OC	ZINC000450513937	DD	On-Demand	Anodyne	ITGAV	47	39
CC1CC(C(=O)N[C@H](CO)Cc2ccc(O)cc2)(c2cccc(Cl)c2)C1	ZINC000450513939	FG	On-Demand	Anodyne	YARS	55	32
COc1cccc(C(=O)N(C)CC(=O)N2CCC[C@H](C(=O)O)C2)c1[N+](=O)[O-]	ZINC000450513941	GC	On-Demand	Bother	SLC6A1	118	42
COc1cccc(C(=O)N(C)CC(=O)N2CCC[C@H](C(=O)O)C2)c1[N+](=O)[O-]	ZINC000450513941	GC	On-Demand	Bother	FDFT1	30	40
COC(=O)c1coc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)n1	ZINC000450513942	GE	On-Demand	Anodyne	SLC6A1	50	32
COC(=O)c1coc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)n1	ZINC000450513949	GE	On-Demand	Anodyne	SLC6A1	50	32
COC[C@@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC	ZINC000450513951	DD	On-Demand	Anodyne	P2RY12	45	33
COC[C@@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC	ZINC000450513951	DD	On-Demand	Anodyne	TACR3	22	42
COC[C@@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC	ZINC000450513951	DD	On-Demand	Anodyne	CTSV	49	35
COC[C@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC	ZINC000450513952	DD	On-Demand	Anodyne	P2RY12	45	33
COC[C@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC	ZINC000450513952	DD	On-Demand	Anodyne	TACR3	22	42
COC[C@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC	ZINC000450513952	DD	On-Demand	Anodyne	CTSV	49	35
COC(=O)c1coc(CN2CC=C(c3c[nH]c4cc(C)ccc34)CC2)n1	ZINC000450513985	FH	On-Demand	Anodyne	SLC6A4	0	46
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	MME	26	43
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	EDNRB	49	38
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	MPO	51	34
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	MMP14	51	34
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	ECE1	58	45
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	PIN1	27	40
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	NPR	29	43
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	SLC15A2	0	45
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	KISS1R	60	35
CC(C)c1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450513999	FF	On-Demand	Anodyne	ERAP2	41	38
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCN(C(C)C)C(=O)C3)cc2)c1	ZINC000450514001	GF	On-Demand	Anodyne	CHRM3	15	45
O=C(O)CCCOc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450514002	GI	On-Demand	Anodyne	LTA4H	35	44
O=C(O)CCCOc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450514002	GI	On-Demand	Anodyne	LTB4R	53	38
O=C(O)CCCOc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450514002	GI	On-Demand	Anodyne	LTB4R2	45	36
O=C(O)CCCOc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450514002	GI	On-Demand	Anodyne	FAAH	20	40
O=C(O)CCCOc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450514002	GI	On-Demand	Anodyne	FFAR1	30	40
O=C(O)CCCOc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450514002	GI	On-Demand	Anodyne	FFAR4	49	40
COC1(C)CN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450514004	DE	On-Demand	Anodyne	SLC12A5	46	34
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	MME	26	43
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	EDNRB	49	38
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	MPO	51	34
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	MMP14	51	34
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	ECE1	58	45
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	PIN1	27	40
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	NPR	29	43
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	SLC15A2	0	45
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	KISS1R	60	35
CC(C)c1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)no1	ZINC000450514007	FF	On-Demand	Anodyne	ERAP2	41	38
O=C(O)c1cccc(CCNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450514015	GH	On-Demand	Anodyne	AKR1C3	23	42
CCc1cccc(C(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)n1	ZINC000450514024	EF	On-Demand	Anodyne	CAPN2	42	32
CCc1cccc(C(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)n1	ZINC000450514024	EF	On-Demand	Anodyne	NPR	52	32
CCc1cccc(C(=O)N(Cc2ccccc2)[C@@H](C)C(=O)OC)n1	ZINC000450514024	EF	On-Demand	Anodyne	PDS	43	32
COC[C@H](CNC(=O)c1ccc2cnccc2c1)OC	ZINC000450514025	CD	On-Demand	Anodyne	AKT1	21	43
COC[C@@H](CNC(=O)c1ccc2cnccc2c1)OC	ZINC000450514027	CD	On-Demand	Anodyne	AKT1	21	43
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)CCCC(=O)C1CC1	ZINC000450514029	EF	On-Demand	Anodyne	AMY2	44	30
CCC[C@@H](NC(=O)C1(OC)CCC1)C(=O)O	ZINC000450514030	BC	On-Demand	Anodyne	NPPA	42	37
CCC[C@@H](NC(=O)C1(OC)CCC1)C(=O)O	ZINC000450514030	BC	On-Demand	Anodyne	NOD1	50	34
CCC[C@H](NC(=O)C1(OC)CCC1)C(=O)O	ZINC000450514032	BC	On-Demand	Anodyne	NPPA	42	37
CCC[C@H](NC(=O)C1(OC)CCC1)C(=O)O	ZINC000450514032	BC	On-Demand	Anodyne	NOD1	50	34
CC(C)Oc1ccc2nccc(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)c2c1	ZINC000450514034	GF	On-Demand	Anodyne	SSTR3	42	33
COc1ccc2[nH]cc(C3=CCN(C[C@](C)(O)C(C)=O)CC3)c2c1	ZINC000450514036	EF	On-Demand	Anodyne	HTR1A	23	53
COc1ccc2[nH]cc(C3=CCN(C[C@](C)(O)C(C)=O)CC3)c2c1	ZINC000450514036	EF	On-Demand	Anodyne	SLC6A4	24	60
COc1ccc2[nH]cc(C3=CCN(C[C@@](C)(O)C(C)=O)CC3)c2c1	ZINC000450514038	EF	On-Demand	Anodyne	HTR1A	23	53
COc1ccc2[nH]cc(C3=CCN(C[C@@](C)(O)C(C)=O)CC3)c2c1	ZINC000450514038	EF	On-Demand	Anodyne	SLC6A4	24	60
COc1cc(Cl)c(C(=O)N[C@@H]2CCCCCC[C@H]2C(=O)O)cc1OC	ZINC000450514058	FH	On-Demand	Anodyne	DRD2	33	40
COc1cc(Cl)c(C(=O)N[C@@H]2CCCCCC[C@H]2C(=O)O)cc1OC	ZINC000450514058	FH	On-Demand	Anodyne	DRD3	0	42
COc1cc(Cl)c(C(=O)N[C@@H]2CCCCCC[C@H]2C(=O)O)cc1OC	ZINC000450514058	FH	On-Demand	Anodyne	HTR3A	31	44
COc1cc(Cl)c(C(=O)N[C@@H]2CCCCCC[C@H]2C(=O)O)cc1OC	ZINC000450514058	FH	On-Demand	Anodyne	HTR4	57	44
COc1cc(Cl)c(C(=O)N[C@H]2CCCCCC[C@@H]2C(=O)O)cc1OC	ZINC000450514059	FH	On-Demand	Anodyne	DRD2	33	40
COc1cc(Cl)c(C(=O)N[C@H]2CCCCCC[C@@H]2C(=O)O)cc1OC	ZINC000450514059	FH	On-Demand	Anodyne	DRD3	0	42
COc1cc(Cl)c(C(=O)N[C@H]2CCCCCC[C@@H]2C(=O)O)cc1OC	ZINC000450514059	FH	On-Demand	Anodyne	HTR3A	31	44
COc1cc(Cl)c(C(=O)N[C@H]2CCCCCC[C@@H]2C(=O)O)cc1OC	ZINC000450514059	FH	On-Demand	Anodyne	HTR4	57	44
COc1cc(Cl)c(C(=O)N[C@H]2CCCCCC[C@H]2C(=O)O)cc1OC	ZINC000450514060	FH	On-Demand	Anodyne	DRD2	33	40
COc1cc(Cl)c(C(=O)N[C@H]2CCCCCC[C@H]2C(=O)O)cc1OC	ZINC000450514060	FH	On-Demand	Anodyne	DRD3	0	42
COc1cc(Cl)c(C(=O)N[C@H]2CCCCCC[C@H]2C(=O)O)cc1OC	ZINC000450514060	FH	On-Demand	Anodyne	HTR3A	31	44
COc1cc(Cl)c(C(=O)N[C@H]2CCCCCC[C@H]2C(=O)O)cc1OC	ZINC000450514060	FH	On-Demand	Anodyne	HTR4	57	44
COc1cc(Cl)c(C(=O)N[C@@H]2CCCCCC[C@@H]2C(=O)O)cc1OC	ZINC000450514061	FH	On-Demand	Anodyne	DRD2	33	40
COc1cc(Cl)c(C(=O)N[C@@H]2CCCCCC[C@@H]2C(=O)O)cc1OC	ZINC000450514061	FH	On-Demand	Anodyne	DRD3	0	42
COc1cc(Cl)c(C(=O)N[C@@H]2CCCCCC[C@@H]2C(=O)O)cc1OC	ZINC000450514061	FH	On-Demand	Anodyne	HTR3A	31	44
COc1cc(Cl)c(C(=O)N[C@@H]2CCCCCC[C@@H]2C(=O)O)cc1OC	ZINC000450514061	FH	On-Demand	Anodyne	HTR4	57	44
CCc1cccc(C(=O)NC[C@H](COC)OC)n1	ZINC000450514063	CD	On-Demand	Anodyne	PDE5A	24	41
CCc1cccc(C(=O)NC[C@@H](COC)OC)n1	ZINC000450514064	CD	On-Demand	Anodyne	PDE5A	24	41
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	DRD2	16	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	DRD4	40	39
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	ACHE	21	46
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	F10	15	42
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	CHRM3	22	45
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	SSTR5	45	38
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	FAAH	20	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	MCHR1	41	42
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	CACNA1G	28	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)c1	ZINC000450514065	FG	On-Demand	Anodyne	MGEA5	32	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(C)(c2nc(C)no2)CC1	ZINC000450514070	EF	On-Demand	Anodyne	GHRHR	55	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC(C)(c2nc(C)no2)CC1	ZINC000450514071	EF	On-Demand	Anodyne	GHRHR	55	31
CC(=O)c1ccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514084	GG	On-Demand	Anodyne	SIGMAR1	21	43
CC(=O)c1ccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514084	GG	On-Demand	Anodyne	NPY2R	27	43
CC(=O)c1ccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514084	GG	On-Demand	Anodyne	CCR3	72	45
CC(=O)c1ccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514084	GG	On-Demand	Anodyne	MLNR	36	41
CC(=O)c1ccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514084	GG	On-Demand	Anodyne	TGFBR1	0	40
CC(=O)c1ccc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514084	GG	On-Demand	Anodyne	MCHR1	38	45
CC(=O)c1ccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514085	GG	On-Demand	Anodyne	SIGMAR1	21	43
CC(=O)c1ccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514085	GG	On-Demand	Anodyne	NPY2R	27	43
CC(=O)c1ccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514085	GG	On-Demand	Anodyne	CCR3	72	45
CC(=O)c1ccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514085	GG	On-Demand	Anodyne	MLNR	36	41
CC(=O)c1ccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514085	GG	On-Demand	Anodyne	TGFBR1	0	40
CC(=O)c1ccc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000450514085	GG	On-Demand	Anodyne	MCHR1	38	45
O=C(O)C[C@H](NC(=O)c1cccc(C(F)F)c1)C1CCCCC1	ZINC000450514091	EH	On-Demand	Anodyne	CCKBR	22	44
O=C(O)C[C@@H](NC(=O)c1cccc(C(F)F)c1)C1CCCCC1	ZINC000450514092	EH	On-Demand	Anodyne	CCKBR	22	44
CC[S@](=O)CC(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450514102	EG	On-Demand	Anodyne	QDPR	0	41
CC[S@@](=O)CC(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450514103	EG	On-Demand	Anodyne	QDPR	0	41
CCCCCN(CCCOC)C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450514107	GH	On-Demand	Anodyne	P2RY12	164	37
CCCCCN(CCCOC)C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450514107	GH	On-Demand	Anodyne	CCKAR	0	41
CCCCCN(CCCOC)C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450514108	GH	On-Demand	Anodyne	P2RY12	164	37
CCCCCN(CCCOC)C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450514108	GH	On-Demand	Anodyne	CCKAR	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(C#N)n1C	ZINC000450514111	EE	On-Demand	Mild	CTSB	40	34
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(C#N)n1C	ZINC000450514111	EE	On-Demand	Mild	NPR	51	33
COc1cc(CNC(=O)CCCc2cccc(C(F)(F)F)c2)ccc1C(=O)O	ZINC000450514116	GI	On-Demand	Anodyne	PPARG	15	44
COc1cc(CNC(=O)CCCc2cccc(C(F)(F)F)c2)ccc1C(=O)O	ZINC000450514116	GI	On-Demand	Anodyne	PPARA	21	44
COc1cc(CNC(=O)CCCc2cccc(C(F)(F)F)c2)ccc1C(=O)O	ZINC000450514116	GI	On-Demand	Anodyne	TRPV1	19	45
COc1cc(CNC(=O)CCCc2cccc(C(F)(F)F)c2)ccc1C(=O)O	ZINC000450514116	GI	On-Demand	Anodyne	PPARD	29	44
COc1cc(CNC(=O)CCCc2cccc(C(F)(F)F)c2)ccc1C(=O)O	ZINC000450514116	GI	On-Demand	Anodyne	MTNR1B	16	40
COc1cc(CNC(=O)CCCc2cccc(C(F)(F)F)c2)ccc1C(=O)O	ZINC000450514116	GI	On-Demand	Anodyne	CCR2	48	38
COc1cc(CNC(=O)CCCc2cccc(C(F)(F)F)c2)ccc1C(=O)O	ZINC000450514116	GI	On-Demand	Anodyne	PDS	47	41
CC1(O)CC(C(=O)N[C@H](CO)Cc2ccc(O)cc2)C1	ZINC000450514117	CC	On-Demand	Anodyne	OPRD1	38	40
CC1(O)CC(C(=O)N[C@H](CO)Cc2ccc(O)cc2)C1	ZINC000450514117	CC	On-Demand	Anodyne	YARS	63	37
CC1(O)CC(C(=O)N[C@H](CO)Cc2ccc(O)cc2)C1	ZINC000450514117	CC	On-Demand	Anodyne	SLC15A2	0	41
CC1(O)CC(C(=O)N[C@H](CO)Cc2ccc(O)cc2)C1	ZINC000450514117	CC	On-Demand	Anodyne	PCNA	0	40
NC(=O)c1ccc(N2CCN(CCc3c(Cl)cccc3Cl)CC2)nc1	ZINC000450514118	GF	On-Demand	Anodyne	HTR1A	36	43
NC(=O)c1ccc(N2CCN(CCc3c(Cl)cccc3Cl)CC2)nc1	ZINC000450514118	GF	On-Demand	Anodyne	DRD2	33	41
NC(=O)c1ccc(N2CCN(CCc3c(Cl)cccc3Cl)CC2)nc1	ZINC000450514118	GF	On-Demand	Anodyne	DRD4	35	45
NC(=O)c1ccc(N2CCN(CCc3c(Cl)cccc3Cl)CC2)nc1	ZINC000450514118	GF	On-Demand	Anodyne	DRD3	41	41
CC(C)(C)c1ccc2c(c1)CN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)CC2	ZINC000450514119	EI	On-Demand	Anodyne	CCR2	17	41
CS(=O)(=O)NC[C@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450514120	FF	On-Demand	Anodyne	SLC6A1	44	33
CS(=O)(=O)NC[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450514121	FF	On-Demand	Anodyne	SLC6A1	44	33
COc1ccc(CC(=O)Nc2cc3c(cc2C)OCO3)c(Cl)c1OC	ZINC000450514127	FH	On-Demand	Anodyne	EDNRA	21	40
COCC1(C(=O)NCc2ccc(C(=O)O)c(OC)c2)CCC1	ZINC000450514132	DD	On-Demand	Anodyne	ABCC8	18	41
CC(=O)c1cccc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)c1	ZINC000450514138	FD	On-Demand	Anodyne	ADORA2B	46	37
CC(=O)c1cccc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)c1	ZINC000450514138	FD	On-Demand	Anodyne	AKR1C3	56	37
CC(=O)c1cccc(CN2CCN(S(=O)(=O)c3cccnc3)CC2)c1	ZINC000450514138	FD	On-Demand	Anodyne	NAMPT	69	42
CCCCCN(CCCOC)C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450514140	EH	On-Demand	Anodyne	PLM2_PLAFA	40	33
CCCCCN(CCCOC)C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450514140	EH	On-Demand	Anodyne	MLYCD	16	45
C[C@H](Oc1ccccn1)C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000450514142	GH	On-Demand	Anodyne	ACACA	41	35
C[C@H](Oc1ccccn1)C(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000450514143	GH	On-Demand	Anodyne	ACACA	41	35
C[C@@H](Oc1ccccn1)C(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000450514144	GH	On-Demand	Anodyne	ACACA	41	35
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000450514145	GH	On-Demand	Anodyne	ACACA	41	35
COc1cc(C)c(C(=O)N[C@H](C(=O)O)c2ccc(OC(F)F)cc2)cc1OC	ZINC000450514151	GG	On-Demand	Anodyne	FOLH1	44	38
COc1cc(C)c(C(=O)N[C@@H](C(=O)O)c2ccc(OC(F)F)cc2)cc1OC	ZINC000450514152	GG	On-Demand	Anodyne	FOLH1	44	38
CCCOc1ccc(C(=O)Nc2cc3c(cc2C)OCO3)c(OC)c1	ZINC000450514153	EH	On-Demand	Anodyne	EDNRB	37	41
CCCOc1ccc(C(=O)Nc2cc3c(cc2C)OCO3)c(OC)c1	ZINC000450514153	EH	On-Demand	Anodyne	EDNRA	42	42
CN(CC1CCN(c2ccncc2)CC1)C(=O)C1=C(c2ccccc2)CCC1	ZINC000450514155	GI	On-Demand	Anodyne	SSTR1	18	41
COC[C@@H](CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)OC	ZINC000450514176	ED	On-Demand	Anodyne	PIK3CB	26	40
COC[C@H](CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)OC	ZINC000450514177	ED	On-Demand	Anodyne	PIK3CB	26	40
COc1cc(CC(=O)N[C@H](C)[C@@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514193	FH	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N[C@H](C)[C@@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514193	FH	On-Demand	Anodyne	OPRK1	33	41
COc1cc(CC(=O)N[C@H](C)[C@@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514193	FH	On-Demand	Anodyne	CCR3	36	43
COc1cc(CC(=O)N[C@@H](C)[C@@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514194	FH	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N[C@@H](C)[C@@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514194	FH	On-Demand	Anodyne	OPRK1	33	41
COc1cc(CC(=O)N[C@@H](C)[C@@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514194	FH	On-Demand	Anodyne	CCR3	36	43
COc1cc(CC(=O)N[C@@H](C)[C@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514195	FH	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N[C@@H](C)[C@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514195	FH	On-Demand	Anodyne	OPRK1	33	41
COc1cc(CC(=O)N[C@@H](C)[C@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514195	FH	On-Demand	Anodyne	CCR3	36	43
COc1cc(CC(=O)N[C@H](C)[C@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514196	FH	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N[C@H](C)[C@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514196	FH	On-Demand	Anodyne	OPRK1	33	41
COc1cc(CC(=O)N[C@H](C)[C@H]2CCCN(C3CCC3)C2)ccc1Cl	ZINC000450514196	FH	On-Demand	Anodyne	CCR3	36	43
COc1cc(Cl)c(C(=O)NCCCCC(=O)O)cc1OC	ZINC000450514214	DE	On-Demand	Anodyne	DRD2	16	45
COc1cc(Cl)c(C(=O)NCCCCC(=O)O)cc1OC	ZINC000450514214	DE	On-Demand	Anodyne	HTR4	48	38
COc1ccccc1C[C@@H](CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450514223	GG	On-Demand	Anodyne	PPARA	18	41
COc1ccccc1C[C@@H](CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450514223	GG	On-Demand	Anodyne	PPARD	20	41
COc1ccccc1C[C@H](CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450514224	GG	On-Demand	Anodyne	PPARA	18	41
COc1ccccc1C[C@H](CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450514224	GG	On-Demand	Anodyne	PPARD	20	41
COC(=O)c1csc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)n1	ZINC000450514227	GF	On-Demand	Anodyne	CCR3	53	38
COC(=O)c1csc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)n1	ZINC000450514227	GF	On-Demand	Anodyne	MCHR1	21	42
COC(=O)c1csc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)n1	ZINC000450514227	GF	On-Demand	Anodyne	CACNA1G	50	48
O=C(O)[C@H]1CCN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450514228	EF	On-Demand	Anodyne	LIPG	52	35
O=C(O)[C@@H]1CCN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450514230	EF	On-Demand	Anodyne	LIPG	52	35
COc1cc(Cl)c(C(=O)N2CCc3ccc(C(=O)O)cc3C2)cc1OC	ZINC000450514231	GG	On-Demand	Anodyne	HTR4	58	37
COc1cc(Cl)c(C(=O)N2CCc3ccc(C(=O)O)cc3C2)cc1OC	ZINC000450514231	GG	On-Demand	Anodyne	HDAC6	38	44
COc1cc(Cl)c(C(=O)N2CCc3ccc(C(=O)O)cc3C2)cc1OC	ZINC000450514231	GG	On-Demand	Anodyne	ABCB1	0	44
COc1cc(Cl)c(C(=O)N2CCc3ccc(C(=O)O)cc3C2)cc1OC	ZINC000450514231	GG	On-Demand	Anodyne	AKR1C3	32	40
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H]1C(N)=O	ZINC000450514236	ED	On-Demand	Anodyne	PDE3B	46	32
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H]1C(N)=O	ZINC000450514236	ED	On-Demand	Anodyne	SIRT2	57	31
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H]1C(N)=O	ZINC000450514236	ED	On-Demand	Anodyne	SIRT1	44	31
Cc1cc(OCC(=O)O)ccc1NC(=O)CCCc1cc(F)ccc1F	ZINC000450514237	FH	On-Demand	Anodyne	THRB	21	41
CC(C)c1nnc(N2CCC[C@H](CNC(=O)c3ccco3)C2)o1	ZINC000450514242	DE	On-Demand	Anodyne	CCR3	41	34
CC(C)c1nnc(N2CCC[C@@H](CNC(=O)c3ccco3)C2)o1	ZINC000450514243	DE	On-Demand	Anodyne	CCR3	41	34
C[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450514248	CD	On-Demand	Anodyne	THRA	15	40
C[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450514248	CD	On-Demand	Anodyne	AVPR1A	17	43
C[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450514248	CD	On-Demand	Anodyne	MME	23	40
C[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450514248	CD	On-Demand	Anodyne	SLC15A2	0	40
C[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450514248	CD	On-Demand	Anodyne	PFK	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H]3CCCCC3(F)F)C2)n1	ZINC000450514256	FH	On-Demand	Anodyne	SLC6A1	62	34
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H]3CCCCC3(F)F)C2)n1	ZINC000450514256	FH	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H]3CCCCC3(F)F)C2)n1	ZINC000450514257	FH	On-Demand	Anodyne	SLC6A1	62	34
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H]3CCCCC3(F)F)C2)n1	ZINC000450514257	FH	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H]3CCCCC3(F)F)C2)n1	ZINC000450514258	FH	On-Demand	Anodyne	SLC6A1	62	34
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H]3CCCCC3(F)F)C2)n1	ZINC000450514258	FH	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H]3CCCCC3(F)F)C2)n1	ZINC000450514259	FH	On-Demand	Anodyne	SLC6A1	62	34
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H]3CCCCC3(F)F)C2)n1	ZINC000450514259	FH	On-Demand	Anodyne	PDE8A	0	41
Cc1ccc2c(C3=CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)c[nH]c2c1	ZINC000450514284	DI	On-Demand	Anodyne	SLC6A4	15	44
Cc1ccc2c(C3=CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)c[nH]c2c1	ZINC000450514288	DI	On-Demand	Anodyne	SLC6A4	15	44
Cc1ccc2[nH]c(C(=O)NCCCCC(=O)O)c(C)c2c1	ZINC000450514302	CF	On-Demand	Anodyne	NCE103	58	41
O=S(=O)(NC1CCN(CCc2cscn2)CC1)c1ccccc1	ZINC000450514306	FE	On-Demand	Anodyne	HTR7	15	47
O=S(=O)(NC1CCN(CCc2cscn2)CC1)c1ccccc1	ZINC000450514306	FE	On-Demand	Anodyne	SFRP1	111	41
O=S(=O)(NC1CCN(CCc2cscn2)CC1)c1ccccc1	ZINC000450514306	FE	On-Demand	Anodyne	WNT3	65	34
O=C(Cc1ccccc1)N1CCC[C@H](Nc2ncc(C(F)F)cn2)C1	ZINC000450514331	EG	On-Demand	Anodyne	PREP	42	35
O=C(Cc1ccccc1)N1CCC[C@H](Nc2ncc(C(F)F)cn2)C1	ZINC000450514331	EG	On-Demand	Anodyne	BIRC2	24	49
O=C(Cc1ccccc1)N1CCC[C@@H](Nc2ncc(C(F)F)cn2)C1	ZINC000450514332	EG	On-Demand	Anodyne	PREP	42	35
O=C(Cc1ccccc1)N1CCC[C@@H](Nc2ncc(C(F)F)cn2)C1	ZINC000450514332	EG	On-Demand	Anodyne	BIRC2	24	49
CN(Cc1ccc(C(=O)O)cc1)C(=O)C1(Oc2ccccc2F)CC1	ZINC000450514333	EG	On-Demand	Anodyne	TACR3	56	39
COC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1Cl	ZINC000450514339	GF	On-Demand	Anodyne	SIGMAR1	20	46
COC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1Cl	ZINC000450514339	GF	On-Demand	Anodyne	SSTR5	53	38
COC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1Cl	ZINC000450514339	GF	On-Demand	Anodyne	HSP90AA1	22	40
COC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1Cl	ZINC000450514339	GF	On-Demand	Anodyne	PDK1	49	39
COC(=O)c1ccc(CN2CCC(C(=O)Nc3cc(C)on3)CC2)cc1Cl	ZINC000450514339	GF	On-Demand	Anodyne	MCHR1	38	43
COc1ccc(-c2noc(N[C@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514347	GE	On-Demand	Anodyne	MMP13	15	48
COc1ccc(-c2noc(N[C@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514347	GE	On-Demand	Anodyne	COLA	158	57
COc1ccc(-c2noc(N[C@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514347	GE	On-Demand	Anodyne	CPT1A	141	57
COc1ccc(-c2noc(N[C@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514347	GE	On-Demand	Anodyne	CPT2	45	35
COc1ccc(-c2noc(N[C@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514347	GE	On-Demand	Anodyne	MLNR	16	40
COc1ccc(-c2noc(N[C@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514347	GE	On-Demand	Anodyne	PDK1	42	36
COc1ccc(-c2noc(N[C@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514347	GE	On-Demand	Anodyne	MMP7	17	48
COc1ccc(-c2noc(N[C@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514347	GE	On-Demand	Anodyne	MCHR1	16	41
COc1ccc(-c2noc(N[C@@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514348	GE	On-Demand	Anodyne	MMP13	15	48
COc1ccc(-c2noc(N[C@@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514348	GE	On-Demand	Anodyne	COLA	158	57
COc1ccc(-c2noc(N[C@@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514348	GE	On-Demand	Anodyne	CPT1A	141	57
COc1ccc(-c2noc(N[C@@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514348	GE	On-Demand	Anodyne	CPT2	45	35
COc1ccc(-c2noc(N[C@@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514348	GE	On-Demand	Anodyne	MLNR	16	40
COc1ccc(-c2noc(N[C@@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514348	GE	On-Demand	Anodyne	PDK1	42	36
COc1ccc(-c2noc(N[C@@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514348	GE	On-Demand	Anodyne	MMP7	17	48
COc1ccc(-c2noc(N[C@@H]3CCN(C(=O)COc4ccccc4)C3)n2)cc1	ZINC000450514348	GE	On-Demand	Anodyne	MCHR1	16	41
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000450514350	EI	On-Demand	Anodyne	ACPS	0	40
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000450514351	EI	On-Demand	Anodyne	ACPS	0	40
CCS(=O)(=O)c1ccc(CN(CCC(N)=O)Cc2ccccc2)cc1	ZINC000450514357	FE	On-Demand	Anodyne	CA2	17	40
CCS(=O)(=O)c1ccc(CN(CCC(N)=O)Cc2ccccc2)cc1	ZINC000450514357	FE	On-Demand	Anodyne	LIMK2	41	37
CCS(=O)(=O)c1ccc(CN(CCC(N)=O)Cc2ccccc2)cc1	ZINC000450514357	FE	On-Demand	Anodyne	RORC	49	60
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	PDE4A	40	42
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	CCR3	17	42
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	KCNA3	40	36
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	PDE4B	22	42
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	PDE4D	23	43
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	PDE4C	15	42
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	TAAR1	38	40
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	AKR1C3	18	41
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	AKR1C2	42	35
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	KCNK3	58	44
COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450514358	GH	On-Demand	Anodyne	KCNK9	58	44
CC(C)N1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)CC1=O	ZINC000450514359	DD	On-Demand	Anodyne	P2RX7	0	55
COc1ccc(C[C@@H](C)C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)cc1OC	ZINC000450514370	FH	On-Demand	Anodyne	MME	15	41
COc1ccc(C[C@H](C)C(=O)Nc2cc(C)c(C)c(C(=O)O)c2)cc1OC	ZINC000450514371	FH	On-Demand	Anodyne	MME	15	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450514382	GF	On-Demand	Anodyne	PDE4D	15	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450514382	GF	On-Demand	Anodyne	TIMP3	71	34
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450514382	GF	On-Demand	Anodyne	PDEC	0	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450514383	GF	On-Demand	Anodyne	PDE4D	15	41
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450514383	GF	On-Demand	Anodyne	TIMP3	71	34
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450514383	GF	On-Demand	Anodyne	PDEC	0	41
CC(=O)c1cccc(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)c1	ZINC000450514384	GH	On-Demand	Anodyne	NPY2R	16	41
CC(=O)c1cccc(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)c1	ZINC000450514384	GH	On-Demand	Anodyne	S1PR4	21	40
CC(=O)c1cccc(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)c1	ZINC000450514384	GH	On-Demand	Anodyne	S1PR1	16	40
CC(=O)c1cccc(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)c1	ZINC000450514385	GH	On-Demand	Anodyne	NPY2R	16	41
CC(=O)c1cccc(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)c1	ZINC000450514385	GH	On-Demand	Anodyne	S1PR4	21	40
CC(=O)c1cccc(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)c1	ZINC000450514385	GH	On-Demand	Anodyne	S1PR1	16	40
CC(C)N1CCCC[C@H]1CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450514393	GH	On-Demand	Anodyne	CCR3	97	43
CC(C)N1CCCC[C@H]1CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450514393	GH	On-Demand	Anodyne	EPHX2	55	46
CC(C)N1CCCC[C@H]1CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450514393	GH	On-Demand	Anodyne	CXCR3	24	40
CC(C)N1CCCC[C@H]1CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450514393	GH	On-Demand	Anodyne	MCHR1	15	41
CC(C)N1CCCC[C@@H]1CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450514394	GH	On-Demand	Anodyne	CCR3	97	43
CC(C)N1CCCC[C@@H]1CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450514394	GH	On-Demand	Anodyne	EPHX2	55	46
CC(C)N1CCCC[C@@H]1CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450514394	GH	On-Demand	Anodyne	CXCR3	24	40
CC(C)N1CCCC[C@@H]1CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000450514394	GH	On-Demand	Anodyne	MCHR1	15	41
COc1cccc(OCCC(=O)N2CC(C)(OC)C2)c1	ZINC000450514399	CD	On-Demand	Anodyne	MTNR1A	33	47
COc1cccc(OCCC(=O)N2CC(C)(OC)C2)c1	ZINC000450514399	CD	On-Demand	Anodyne	MTNR1B	36	40
Fc1ccc2c(C3=CCN(C[C@H]4COCCO4)CC3)c[nH]c2c1	ZINC000450514402	DF	On-Demand	Anodyne	HTR1D	0	53
Fc1ccc2c(C3=CCN(C[C@H]4COCCO4)CC3)c[nH]c2c1	ZINC000450514402	DF	On-Demand	Anodyne	SLC6A4	23	54
Fc1ccc2c(C3=CCN(C[C@@H]4COCCO4)CC3)c[nH]c2c1	ZINC000450514403	DF	On-Demand	Anodyne	HTR1D	0	53
Fc1ccc2c(C3=CCN(C[C@@H]4COCCO4)CC3)c[nH]c2c1	ZINC000450514403	DF	On-Demand	Anodyne	SLC6A4	23	54
COC(=O)c1coc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)n1	ZINC000450514410	GH	On-Demand	Anodyne	SSTR5	42	42
O=S(=O)(NC1CCN(CC2=CCCCC2)CC1)c1ccc(F)cc1	ZINC000450514413	FG	On-Demand	Anodyne	SFRP1	46	35
CO[C@H]1C[C@@H](CO)N(c2ncnc3cc(Br)ccc23)C1	ZINC000450514416	ED	On-Demand	Anodyne	PDE3B	62	34
CO[C@@H]1C[C@@H](CO)N(c2ncnc3cc(Br)ccc23)C1	ZINC000450514417	ED	On-Demand	Anodyne	PDE3B	62	34
O=S(=O)(NC1CCN(CCC2=CCCCC2)CC1)c1ccc(F)cc1	ZINC000450514418	FG	On-Demand	Anodyne	HTR2A	15	42
O=S(=O)(NC1CCN(CCC2=CCCCC2)CC1)c1ccc(F)cc1	ZINC000450514418	FG	On-Demand	Anodyne	HTR7	20	52
O=S(=O)(NC1CCN(CCC2=CCCCC2)CC1)c1ccc(F)cc1	ZINC000450514418	FG	On-Demand	Anodyne	HTR6	20	52
O=S(=O)(NC1CCN(CCC2=CCCCC2)CC1)c1ccc(F)cc1	ZINC000450514418	FG	On-Demand	Anodyne	SFRP1	44	39
O=C(N[C@H](CO)Cc1ccc(O)cc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450514422	GD	On-Demand	Anodyne	CA2	17	49
O=C(N[C@H](CO)Cc1ccc(O)cc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450514422	GD	On-Demand	Anodyne	YARS	59	34
CCC[C@H](C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)C(C)C	ZINC000450514431	EH	On-Demand	Anodyne	FOLH1	40	32
CCC[C@@H](C(=O)N[C@H](C(=O)O)c1ccc(OC(F)F)cc1)C(C)C	ZINC000450514432	EH	On-Demand	Anodyne	FOLH1	40	32
CCC[C@H](C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)C(C)C	ZINC000450514433	EH	On-Demand	Anodyne	FOLH1	40	32
CCC[C@@H](C(=O)N[C@@H](C(=O)O)c1ccc(OC(F)F)cc1)C(C)C	ZINC000450514434	EH	On-Demand	Anodyne	FOLH1	40	32
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	DRD4	15	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	PLA2G2A	37	43
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	ADAM17	16	43
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	LSS	20	53
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	E1	0	46
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	L3MBTL1	0	46
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	L3MBTL3	42	46
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	MBTD1	0	46
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)cc1	ZINC000450514439	GF	On-Demand	Anodyne	SLC6A7	0	42
COC(=O)C1(CN2CC=C(c3c[nH]c4cc(C)ccc34)CC2)CC1	ZINC000450514444	DH	On-Demand	Anodyne	HTR1A	0	42
COC(=O)C1(CN2CC=C(c3c[nH]c4cc(C)ccc34)CC2)CC1	ZINC000450514444	DH	On-Demand	Anodyne	SLC6A4	15	48
CC(C)N(Cc1cnns1)c1ccccc1	ZINC000450514452	BF	On-Demand	Anodyne	TAAR1	25	49
O=C(NCc1ccc(F)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450514453	FH	On-Demand	Anodyne	SIGMAR1	18	41
O=C(NCc1ccc(F)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450514453	FH	On-Demand	Anodyne	CCR3	45	38
O=C(NCc1ccc(F)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450514453	FH	On-Demand	Anodyne	CACNA1G	39	45
O=C(NCc1ccc(F)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450514454	FH	On-Demand	Anodyne	SIGMAR1	18	41
O=C(NCc1ccc(F)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450514454	FH	On-Demand	Anodyne	CCR3	45	38
O=C(NCc1ccc(F)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450514454	FH	On-Demand	Anodyne	CACNA1G	39	45
COc1cc(CN(CCC(N)=O)Cc2ccccc2)ccc1Cl	ZINC000450514463	EG	On-Demand	Anodyne	PLA2G2A	28	42
CCc1ccc2nccc(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)c2c1	ZINC000450514484	FF	On-Demand	Anodyne	SSTR3	66	34
COC(=O)c1csc(CN2CC=C(c3c[nH]c4cc(C)ccc34)CC2)n1	ZINC000450514492	FI	On-Demand	Anodyne	SLC6A4	0	44
CC(C)N1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1=O	ZINC000450514494	GD	On-Demand	Mild	AR	15	41
CC(C)N1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1=O	ZINC000450514495	GD	On-Demand	Mild	AR	15	41
CCS(=O)(=O)c1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)cc1	ZINC000450514516	GD	On-Demand	Anodyne	CA2	25	42
CCS(=O)(=O)c1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)cc1	ZINC000450514516	GD	On-Demand	Anodyne	CA1	23	42
CCS(=O)(=O)c1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)cc1	ZINC000450514516	GD	On-Demand	Anodyne	CA7	47	45
CCS(=O)(=O)c1ccc(CN2CCc3cc(S(N)(=O)=O)ccc32)cc1	ZINC000450514516	GD	On-Demand	Anodyne	CA12	26	42
Cc1cc(NC(=O)CCCC2CCOCC2)cc(C(=O)O)c1C	ZINC000450514517	DH	On-Demand	Anodyne	LDLR	0	41
CC(=O)c1cccc(CN2c3ccc(S(N)(=O)=O)cc3C[C@H]2C)c1	ZINC000450514522	EE	On-Demand	Anodyne	CA7	40	39
CC(=O)c1cccc(CN2c3ccc(S(N)(=O)=O)cc3C[C@@H]2C)c1	ZINC000450514523	EE	On-Demand	Anodyne	CA7	40	39
COC(=O)c1coc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)n1	ZINC000450514526	GE	On-Demand	Anodyne	F10	37	46
COC(=O)c1coc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)n1	ZINC000450514526	GE	On-Demand	Anodyne	CACNA1G	16	44
Cc1ccc(C(=O)N2CCN(C(C)C)C(=O)C2)c2c1CCC2	ZINC000450514531	DE	On-Demand	Anodyne	P2RX7	17	56
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450514549	EF	On-Demand	Anodyne	F10	36	52
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450514549	EF	On-Demand	Anodyne	NPY5R	15	44
N#CC1(CN2CCc3cc(S(N)(=O)=O)ccc32)CCC1	ZINC000450514550	CD	On-Demand	Mild	CA7	19	46
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450514551	EI	On-Demand	Anodyne	HTR1A	22	57
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450514551	EI	On-Demand	Anodyne	DRD4	15	56
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450514551	EI	On-Demand	Anodyne	SLC6A4	16	57
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450514551	EI	On-Demand	Anodyne	HTR5A	16	48
O=C(CCCN1CC=C(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450514551	EI	On-Demand	Anodyne	CYP2J2	48	35
CN(C)S(=O)(=O)CC(=O)NCc1cccc(C(=O)O)c1	ZINC000450514552	DB	On-Demand	Anodyne	F10	18	42
CN(C)S(=O)(=O)CC(=O)NCc1cccc(C(=O)O)c1	ZINC000450514552	DB	On-Demand	Anodyne	TRY2_BOVIN	42	33
CN(C)S(=O)(=O)CC(=O)NCc1cccc(C(=O)O)c1	ZINC000450514552	DB	On-Demand	Anodyne	AKR1C3	43	33
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450514553	EF	On-Demand	Anodyne	F10	36	52
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450514553	EF	On-Demand	Anodyne	NPY5R	15	44
CC(=O)c1nc(N(C)CCc2cccc([N+](=O)[O-])c2)sc1C	ZINC000450514559	DG	On-Demand	Bother	CACNA1D	62	33
O=C(Nc1ccc(Cl)cn1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450514566	FI	On-Demand	Anodyne	SLC6A1	47	35
O=C(Nc1ccc(Cl)cn1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450514566	FI	On-Demand	Anodyne	F10	35	46
O=C(Nc1ccc(Cl)cn1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450514566	FI	On-Demand	Anodyne	SIGMAR1	16	47
O=C(CSC1CC1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514568	CH	On-Demand	Anodyne	SLC6A1	45	33
O=C(CSC1CC1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514568	CH	On-Demand	Anodyne	PREP	72	45
O=C(CSC1CC1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514568	CH	On-Demand	Anodyne	F1PEP1	0	40
O=C(Nc1ccc(Cl)cn1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450514569	FI	On-Demand	Anodyne	SLC6A1	47	35
O=C(Nc1ccc(Cl)cn1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450514569	FI	On-Demand	Anodyne	F10	35	46
O=C(Nc1ccc(Cl)cn1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450514569	FI	On-Demand	Anodyne	SIGMAR1	16	47
O=C(CSC1CC1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514571	CH	On-Demand	Anodyne	SLC6A1	45	33
O=C(CSC1CC1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514571	CH	On-Demand	Anodyne	PREP	72	45
O=C(CSC1CC1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514571	CH	On-Demand	Anodyne	F1PEP1	0	40
O=C(CSC1CC1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514572	CH	On-Demand	Anodyne	SLC6A1	45	33
O=C(CSC1CC1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514572	CH	On-Demand	Anodyne	PREP	72	45
O=C(CSC1CC1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514572	CH	On-Demand	Anodyne	F1PEP1	0	40
O=C(CSC1CC1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514573	CH	On-Demand	Anodyne	PREP	61	45
O=C(CSC1CC1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514573	CH	On-Demand	Anodyne	F1PEP1	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	ACE	63	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	CELA1	26	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	MME	36	44
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	TRY1_BOVIN	53	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	DPP4	18	45
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	PREP	78	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	DPP8	23	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	F1PEP1	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450514574	EH	On-Demand	Anodyne	BRCA1	63	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	ACE	63	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	CELA1	26	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	MME	36	44
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	TRY1_BOVIN	53	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	DPP4	18	45
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	PREP	78	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	DPP8	23	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	F1PEP1	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450514575	EH	On-Demand	Anodyne	BRCA1	63	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	ACE	63	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	CELA1	26	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	MME	36	44
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	TRY1_BOVIN	53	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	DPP4	18	45
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	PREP	78	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	DPP8	23	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	F1PEP1	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450514576	EH	On-Demand	Anodyne	BRCA1	63	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	ACE	63	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	CELA1	26	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	MME	36	44
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	TRY1_BOVIN	53	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	DPP4	18	45
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	PREP	78	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	DPP8	23	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	F1PEP1	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450514578	EH	On-Demand	Anodyne	BRCA1	63	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450514579	FI	On-Demand	Anodyne	CCR2	83	38
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450514579	FI	On-Demand	Anodyne	SLC6A5	31	41
Oc1nc(CN2CCN(CC/C=C\c3ccccc3)CC2)nc2ccccc12	ZINC000450514580	FH	On-Demand	Anodyne	HTR7	15	50
Oc1nc(CN2CCN(CC/C=C\c3ccccc3)CC2)nc2ccccc12	ZINC000450514580	FH	On-Demand	Anodyne	SLC6A5	28	40
Oc1nc(CN2CCN(CC/C=C/c3ccccc3)CC2)nc2ccccc12	ZINC000450514581	FH	On-Demand	Anodyne	HTR7	15	50
Oc1nc(CN2CCN(CC/C=C/c3ccccc3)CC2)nc2ccccc12	ZINC000450514581	FH	On-Demand	Anodyne	SLC6A5	28	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450514585	FI	On-Demand	Anodyne	CCR2	83	38
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450514585	FI	On-Demand	Anodyne	SLC6A5	31	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450514587	FI	On-Demand	Anodyne	CCR2	83	38
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450514587	FI	On-Demand	Anodyne	SLC6A5	31	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450514588	FI	On-Demand	Anodyne	CCR2	83	38
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450514588	FI	On-Demand	Anodyne	SLC6A5	31	41
O=[N+]([O-])c1ccc(-c2csc(NCCC3(O)CCC3)n2)cc1	ZINC000450514599	DF	On-Demand	Bother	MAOB	19	53
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450514601	GG	On-Demand	Anodyne	AVPR2	51	47
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450514601	GG	On-Demand	Anodyne	COLA	41	41
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450514601	GG	On-Demand	Anodyne	CPT2	40	36
CN(Cc1ccccc1)C(=O)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450514605	EE	On-Demand	Anodyne	TACR3	54	34
CN(Cc1ccccc1)C(=O)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450514607	EE	On-Demand	Anodyne	TACR3	54	34
Cc1ccc([C@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514611	GG	On-Demand	Anodyne	PPARG	23	44
Cc1ccc([C@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514611	GG	On-Demand	Anodyne	PPARA	15	44
Cc1ccc([C@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514611	GG	On-Demand	Anodyne	PPARD	19	44
Cc1ccc([C@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514611	GG	On-Demand	Anodyne	CCR2	17	42
Cc1ccc([C@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514611	GG	On-Demand	Anodyne	CRTM	45	36
Cc1ccc([C@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514611	GG	On-Demand	Anodyne	PDS	64	34
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514615	GG	On-Demand	Anodyne	PPARG	23	44
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514615	GG	On-Demand	Anodyne	PPARA	15	44
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514615	GG	On-Demand	Anodyne	PPARD	19	44
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514615	GG	On-Demand	Anodyne	CCR2	17	42
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514615	GG	On-Demand	Anodyne	CRTM	45	36
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)O)cc1	ZINC000450514615	GG	On-Demand	Anodyne	PDS	64	34
Cc1cccc(C[C@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)c1	ZINC000450514618	EC	On-Demand	Anodyne	MME	41	36
Cc1cccc(C[C@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)c1	ZINC000450514618	EC	On-Demand	Anodyne	CTSB	23	40
Cc1cccc(C[C@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)c1	ZINC000450514618	EC	On-Demand	Anodyne	CPA1	54	53
Cc1cccc(C[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)c1	ZINC000450514622	EC	On-Demand	Anodyne	MME	41	36
Cc1cccc(C[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)c1	ZINC000450514622	EC	On-Demand	Anodyne	CTSB	23	40
Cc1cccc(C[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O)c1	ZINC000450514622	EC	On-Demand	Anodyne	CPA1	54	53
CCS(=O)(=O)c1ccc(CN(C)Cc2ccc(C(=O)OC)cc2)cc1	ZINC000450514623	FF	On-Demand	Anodyne	LIMK2	43	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450514631	GH	On-Demand	Anodyne	F10	37	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450514632	GH	On-Demand	Anodyne	F10	37	51
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450514633	GH	On-Demand	Anodyne	F10	37	51
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450514634	GH	On-Demand	Anodyne	F10	37	51
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450514635	GJ	On-Demand	Anodyne	RBP4	93	41
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450514637	GJ	On-Demand	Anodyne	RBP4	93	41
CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc2nncn2n1	ZINC000450514638	GH	On-Demand	Anodyne	TACR1	18	42
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@H](C(=O)O)c1ccc(C)cc1)CO2	ZINC000450514643	FF	On-Demand	Anodyne	ROCK2	37	49
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@H](C(=O)O)c1ccc(C)cc1)CO2	ZINC000450514643	FF	On-Demand	Anodyne	CDC42BPA	0	44
COc1ccc2c(c1)C[C@H](C(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1)CO2	ZINC000450514644	FF	On-Demand	Anodyne	ROCK2	37	49
COc1ccc2c(c1)C[C@H](C(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1)CO2	ZINC000450514644	FF	On-Demand	Anodyne	CDC42BPA	0	44
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1)CO2	ZINC000450514645	FF	On-Demand	Anodyne	ROCK2	37	49
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1)CO2	ZINC000450514645	FF	On-Demand	Anodyne	CDC42BPA	0	44
COc1ccc2c(c1)C[C@H](C(=O)NC[C@H](C(=O)O)c1ccc(C)cc1)CO2	ZINC000450514646	FF	On-Demand	Anodyne	ROCK2	37	49
COc1ccc2c(c1)C[C@H](C(=O)NC[C@H](C(=O)O)c1ccc(C)cc1)CO2	ZINC000450514646	FF	On-Demand	Anodyne	CDC42BPA	0	44
CCOC(=O)c1csc(N2CCN(C)[C@@H](Cc3ccccc3)C2)n1	ZINC000450514650	EF	On-Demand	Anodyne	P2RY12	40	34
CCOC(=O)c1csc(N2CCN(C)[C@H](Cc3ccccc3)C2)n1	ZINC000450514651	EF	On-Demand	Anodyne	P2RY12	40	34
CCCC[C@H](C)C(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1	ZINC000450514657	CG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@@H](C)C(=O)NC[C@H](C(=O)O)c1ccc(C)cc1	ZINC000450514658	CG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@@H](C)C(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1	ZINC000450514659	CG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@H](C)C(=O)NC[C@H](C(=O)O)c1ccc(C)cc1	ZINC000450514660	CG	On-Demand	Anodyne	CTSK	22	40
Cc1cccc(C[C@H](CNC(=O)C2(C)CC2)C(=O)O)c1	ZINC000450514667	CE	On-Demand	Anodyne	CPA1	58	57
Cc1cccc(C[C@@H](CNC(=O)C2(C)CC2)C(=O)O)c1	ZINC000450514668	CE	On-Demand	Anodyne	CPA1	58	57
CCc1cccc(CC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450514670	EF	On-Demand	Anodyne	MME	33	45
CCc1cccc(CC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450514670	EF	On-Demand	Anodyne	CPA1	55	40
CCc1cccc(CC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450514671	EF	On-Demand	Anodyne	MME	33	45
CCc1cccc(CC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450514671	EF	On-Demand	Anodyne	CPA1	55	40
O=C([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514675	GF	On-Demand	Anodyne	PDE3A	48	36
O=C([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514675	GF	On-Demand	Anodyne	PDGFRB	35	40
O=C([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514675	GF	On-Demand	Anodyne	PDE3B	71	36
O=C([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514675	GF	On-Demand	Anodyne	SIRT3	56	36
O=C([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514675	GF	On-Demand	Anodyne	SIRT2	46	35
O=C([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514675	GF	On-Demand	Anodyne	SIRT1	43	30
O=C([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514676	GF	On-Demand	Anodyne	PDE3A	48	36
O=C([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514676	GF	On-Demand	Anodyne	PDGFRB	35	40
O=C([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514676	GF	On-Demand	Anodyne	PDE3B	71	36
O=C([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514676	GF	On-Demand	Anodyne	SIRT3	56	36
O=C([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514676	GF	On-Demand	Anodyne	SIRT2	46	35
O=C([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)N1CCCC1	ZINC000450514676	GF	On-Demand	Anodyne	SIRT1	43	30
CCS(=O)(=O)c1ccc([C@@H](C)N=c2[nH]c(=NC)c3ccccc3[nH]2)cc1	ZINC000450514697	FE	On-Demand	Anodyne	PTGS2	40	31
CCS(=O)(=O)c1ccc([C@H](C)N=c2[nH]c(=NC)c3ccccc3[nH]2)cc1	ZINC000450514698	FE	On-Demand	Anodyne	PTGS2	40	31
O=C(NC1CCCCC1)N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450514699	FF	On-Demand	Anodyne	MCHR1	15	40
O=C(NC1CCCCC1)N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450514699	FF	On-Demand	Anodyne	HPGDS	31	40
COc1ccc2c(c1)CCCCN2C(=O)c1ccnc(OC(F)F)c1	ZINC000450514700	EH	On-Demand	Anodyne	AVPR2	36	43
Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3cnn[nH]3)C2)n1	ZINC000450514718	DD	On-Demand	Anodyne	SLC6A1	81	37
Cc1cccc(NC(=O)[C@H]2CCCN(Cc3cnn[nH]3)C2)n1	ZINC000450514719	DD	On-Demand	Anodyne	SLC6A1	81	37
C[C@H](CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1)S(C)(=O)=O	ZINC000450514724	FD	On-Demand	Anodyne	F10	29	48
C[C@@H](CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1)S(C)(=O)=O	ZINC000450514725	FD	On-Demand	Anodyne	F10	29	48
C[C@@H](CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1)S(C)(=O)=O	ZINC000450514726	FD	On-Demand	Anodyne	F10	29	48
C[C@H](CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1)S(C)(=O)=O	ZINC000450514727	FD	On-Demand	Anodyne	F10	29	48
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1	ZINC000450514728	FG	On-Demand	Anodyne	ACHE	15	44
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1	ZINC000450514728	FG	On-Demand	Anodyne	SIGMAR1	27	45
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1	ZINC000450514728	FG	On-Demand	Anodyne	SSTR5	45	37
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1	ZINC000450514728	FG	On-Demand	Anodyne	MCHR1	35	40
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1	ZINC000450514728	FG	On-Demand	Anodyne	CACNA1I	15	41
CC1(O)CC(C(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)C1	ZINC000450514731	EH	On-Demand	Anodyne	KCNJ11	94	41
CC1(O)CC(C(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)C1	ZINC000450514732	EH	On-Demand	Anodyne	KCNJ11	94	41
O=C1CC[C@@H](CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)CCN1	ZINC000450514733	FE	On-Demand	Anodyne	F10	27	45
O=C1CC[C@@H](CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)CCN1	ZINC000450514733	FE	On-Demand	Anodyne	NPY5R	18	41
O=C1CC[C@H](CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)CCN1	ZINC000450514734	FE	On-Demand	Anodyne	F10	27	45
O=C1CC[C@H](CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)CCN1	ZINC000450514734	FE	On-Demand	Anodyne	NPY5R	18	41
COc1ccc2[nH]cc(C3=CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)c2c1	ZINC000450514735	EH	On-Demand	Anodyne	HTR1A	15	50
COc1ccc2[nH]cc(C3=CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)c2c1	ZINC000450514735	EH	On-Demand	Anodyne	SLC6A4	23	56
COc1ccc2[nH]cc(C3=CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)c2c1	ZINC000450514736	EH	On-Demand	Anodyne	HTR1A	15	50
COc1ccc2[nH]cc(C3=CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)c2c1	ZINC000450514736	EH	On-Demand	Anodyne	SLC6A4	23	56
COC[C@H](CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)OC	ZINC000450514738	CE	On-Demand	Anodyne	SCN9A	23	40
COC[C@H](CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1)OC	ZINC000450514739	CE	On-Demand	Anodyne	SCN9A	23	40
COC[C@H](CNC(=O)[C@H]1CCC[C@H]1c1ccccc1)OC	ZINC000450514740	CE	On-Demand	Anodyne	SCN9A	23	40
COC[C@H](CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1)OC	ZINC000450514741	CE	On-Demand	Anodyne	SCN9A	23	40
CCC[C@H](O)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450514753	DE	On-Demand	Anodyne	SLC6A1	49	34
CCC[C@H](O)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450514753	DE	On-Demand	Anodyne	PDE8A	0	42
CCC[C@H](O)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450514754	DE	On-Demand	Anodyne	SLC6A1	49	34
CCC[C@H](O)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450514754	DE	On-Demand	Anodyne	PDE8A	0	42
CCC[C@@H](O)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450514755	DE	On-Demand	Anodyne	SLC6A1	49	34
CCC[C@@H](O)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450514755	DE	On-Demand	Anodyne	PDE8A	0	42
CCC[C@@H](O)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450514756	DE	On-Demand	Anodyne	SLC6A1	49	34
CCC[C@@H](O)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450514756	DE	On-Demand	Anodyne	PDE8A	0	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450514757	EJ	On-Demand	Anodyne	CTSF	62	36
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450514758	EJ	On-Demand	Anodyne	CTSF	62	36
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450514759	EJ	On-Demand	Anodyne	CTSF	62	36
CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450514760	EJ	On-Demand	Anodyne	CTSF	62	36
COC(=O)c1csc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)n1	ZINC000450514763	GF	On-Demand	Anodyne	F2	0	45
COC(=O)c1csc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)n1	ZINC000450514763	GF	On-Demand	Anodyne	F10	55	37
O=C(NCc1ccc(F)cc1)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450514764	EH	On-Demand	Anodyne	CCR3	29	43
O=C(NCc1ccc(F)cc1)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450514764	EH	On-Demand	Anodyne	CACNA1G	50	46
COC[C@H](CNC(=O)Cc1ccccc1O[C@@H]1CCOC1)OC	ZINC000450514783	DD	On-Demand	Anodyne	PDE4D	15	40
COC[C@H](CNC(=O)Cc1ccccc1O[C@H]1CCOC1)OC	ZINC000450514784	DD	On-Demand	Anodyne	PDE4D	15	40
COC[C@@H](CNC(=O)Cc1ccccc1O[C@@H]1CCOC1)OC	ZINC000450514785	DD	On-Demand	Anodyne	PDE4D	15	40
COC[C@@H](CNC(=O)Cc1ccccc1O[C@H]1CCOC1)OC	ZINC000450514786	DD	On-Demand	Anodyne	PDE4D	15	40
C[C@H](NC(=O)c1cc2ccncc2s1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450514811	EH	On-Demand	Anodyne	TACR2	42	35
C[C@@H](NC(=O)c1cc2ccncc2s1)[C@H]1CCCN(C2CCC2)C1	ZINC000450514812	EH	On-Demand	Anodyne	TACR2	42	35
C[C@@H](NC(=O)c1cc2ccncc2s1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450514813	EH	On-Demand	Anodyne	TACR2	42	35
C[C@H](NC(=O)c1cc2ccncc2s1)[C@H]1CCCN(C2CCC2)C1	ZINC000450514814	EH	On-Demand	Anodyne	TACR2	42	35
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514817	FH	On-Demand	Anodyne	KLKB1	28	40
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514817	FH	On-Demand	Anodyne	SLC6A1	92	35
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514817	FH	On-Demand	Anodyne	F10	40	30
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514817	FH	On-Demand	Anodyne	MAPK1	26	40
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514817	FH	On-Demand	Anodyne	CXCR3	23	41
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514817	FH	On-Demand	Anodyne	MCHR1	15	40
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514817	FH	On-Demand	Anodyne	GPBAR1	0	41
COc1ccc(CCCC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c(OC)c1	ZINC000450514828	GG	On-Demand	Anodyne	MTNR1A	50	39
COc1ccc(CCCC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c(OC)c1	ZINC000450514828	GG	On-Demand	Anodyne	MTNR1B	42	39
COc1ccc(CCCC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c(OC)c1	ZINC000450514829	GG	On-Demand	Anodyne	MTNR1A	50	39
COc1ccc(CCCC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c(OC)c1	ZINC000450514829	GG	On-Demand	Anodyne	MTNR1B	42	39
O=C(O)[C@@H](CNC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)c1ccccc1	ZINC000450514835	GI	On-Demand	Anodyne	TACR1	15	42
O=C(O)[C@H](CNC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)c1ccccc1	ZINC000450514836	GI	On-Demand	Anodyne	TACR1	15	42
C[C@H](CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450514850	CE	On-Demand	Anodyne	MPO	21	42
C[C@@H](CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450514851	CE	On-Demand	Anodyne	MPO	21	42
Cc1ccc(Br)cc1CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450514865	FG	On-Demand	Anodyne	CCR8	26	48
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccnc1OCC(F)F	ZINC000450514870	FG	On-Demand	Anodyne	P2RY1	47	38
C[C@H](OCCc1ccccc1)C(=O)Nc1cccnc1OCC(F)F	ZINC000450514871	FG	On-Demand	Anodyne	P2RY1	47	38
CC1(C(=O)NCc2ccc(OCCCC(=O)O)cc2)CC1	ZINC000450514884	CE	On-Demand	Anodyne	LTA4H	29	43
CC1(C(=O)NCc2ccc(OCCCC(=O)O)cc2)CC1	ZINC000450514884	CE	On-Demand	Anodyne	PLA2G4B	68	42
CC1(C(=O)NCc2ccc(OCCCC(=O)O)cc2)CC1	ZINC000450514884	CE	On-Demand	Anodyne	FFAR1	40	37
CC1(C(=O)NCc2ccc(OCCCC(=O)O)cc2)CC1	ZINC000450514884	CE	On-Demand	Anodyne	FFAR4	42	32
O=C(NCC[C@@H]1CCCCO1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450514891	DH	On-Demand	Anodyne	SCN9A	0	40
O=C(NCC[C@@H]1CCCCO1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450514892	DH	On-Demand	Anodyne	SCN9A	0	40
O=C(NCC[C@@H]1CCCCO1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450514893	DH	On-Demand	Anodyne	SCN9A	0	40
O=C(NCC[C@@H]1CCCCO1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450514894	DH	On-Demand	Anodyne	SCN9A	0	40
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	PPARA	19	46
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	LTA4H	18	41
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	PLA2G2A	23	40
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	PLA2G4B	48	35
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	FFAR1	40	37
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	NCE103	23	45
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	FFAR4	51	37
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	P96878_MYCTU	18	45
O=C(O)CCCOc1ccc(CNC(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000450514900	GH	On-Demand	Anodyne	CAN2	0	45
c1ccc2c(c1)[nH]c1ncnc(N3CC[C@]4(CCCOC4)C3)c12	ZINC000450514901	DG	On-Demand	Anodyne	AKT1	21	40
c1ccc2c(c1)[nH]c1ncnc(N3CC[C@@]4(CCCOC4)C3)c12	ZINC000450514902	DG	On-Demand	Anodyne	AKT1	21	40
COC(=O)c1ccc(CN(C)Cc2ccn(CCc3ccccc3)n2)cc1	ZINC000450514903	FH	On-Demand	Anodyne	FAS	27	43
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450514905	GF	On-Demand	Mild	COLA	34	43
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450514905	GF	On-Demand	Mild	CPT1A	34	43
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450514906	GF	On-Demand	Mild	COLA	34	43
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450514906	GF	On-Demand	Mild	CPT1A	34	43
N#CC1(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)CCC1	ZINC000450514911	EG	On-Demand	Mild	NPFFR2	24	42
N#CC1(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)CCC1	ZINC000450514912	EG	On-Demand	Mild	NPFFR2	24	42
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514918	FH	On-Demand	Anodyne	KLKB1	28	40
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514918	FH	On-Demand	Anodyne	SLC6A1	92	35
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514918	FH	On-Demand	Anodyne	F10	40	30
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514918	FH	On-Demand	Anodyne	MAPK1	26	40
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514918	FH	On-Demand	Anodyne	CXCR3	23	41
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514918	FH	On-Demand	Anodyne	MCHR1	15	40
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000450514918	FH	On-Demand	Anodyne	GPBAR1	0	41
CSc1cccc(C(=O)NCCN2CCNC(=O)C2)c1	ZINC000450514922	CC	On-Demand	Anodyne	DRD4	53	40
CSc1cccc(C(=O)NCCN2CCNC(=O)C2)c1	ZINC000450514922	CC	On-Demand	Anodyne	PLD1	75	42
CSc1cccc(C(=O)NCCN2CCNC(=O)C2)c1	ZINC000450514922	CC	On-Demand	Anodyne	PLD2	95	42
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	ACE	27	47
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	PPARG	21	40
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	MME	41	46
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	EDNRA	28	43
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	TACR1	31	45
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	CCKAR	73	39
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	MPO	43	37
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	BRS3	29	41
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	UPP1	16	44
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	MC3R	49	37
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	MC5R	44	35
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	MMP2	25	41
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	MMP14	73	35
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	GRPR	55	37
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	ECE1	64	44
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	MMP11	67	33
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	CCKBR	54	38
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	ACE2	56	40
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	MC1R	77	37
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	NPR	27	41
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	SLC15A2	0	47
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	KISS1R	65	35
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	ERAP2	42	38
CCCOc1cccc(CC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514930	GG	On-Demand	Anodyne	NRDE	0	42
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	ACE	27	47
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	PPARG	21	40
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	MME	41	46
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	EDNRA	28	43
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	TACR1	31	45
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	CCKAR	73	39
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	MPO	43	37
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	BRS3	29	41
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	UPP1	16	44
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	MC3R	49	37
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	MC5R	44	35
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	MMP2	25	41
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	MMP14	73	35
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	GRPR	55	37
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	ECE1	64	44
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	MMP11	67	33
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	CCKBR	54	38
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	ACE2	56	40
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	MC1R	77	37
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	NPR	27	41
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	SLC15A2	0	47
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	KISS1R	65	35
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	ERAP2	42	38
CCCOc1cccc(CC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)c1	ZINC000450514931	GG	On-Demand	Anodyne	NRDE	0	42
CC(=O)Nc1cccc2c1CCCN2CC[C@@H](C)O	ZINC000450514933	CE	On-Demand	Anodyne	KCNQ2	72	36
CC(=O)Nc1cccc2c1CCCN2CC[C@H](C)O	ZINC000450514934	CE	On-Demand	Anodyne	KCNQ2	72	36
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	HTR1A	26	42
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	DRD2	37	46
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	DRD4	30	40
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	ACHE	27	42
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	HTR1D	17	40
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	HTR2A	36	49
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	HTR2C	20	49
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	HRH1	31	40
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	OPRM1	15	41
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	HTR4	19	42
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	LTA4H	28	45
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	TACR1	25	40
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	HTR7	28	44
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	HRH3	21	48
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	SIGMAR1	65	59
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	CCR3	95	52
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	CCR5	69	56
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	SCN9A	0	42
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	TACR3	42	39
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	CCR2	23	40
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	EPHX2	22	47
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	MCHR1	35	42
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	CACNA1G	84	54
CN(CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450514935	GG	On-Demand	Anodyne	TMPRSS11D	43	35
CC(=O)c1ccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000450514945	FG	On-Demand	Anodyne	DRD2	15	40
CC(=O)c1ccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000450514945	FG	On-Demand	Anodyne	ACHE	26	47
CC(=O)c1ccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000450514945	FG	On-Demand	Anodyne	HRH3	18	41
CC(=O)c1ccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000450514945	FG	On-Demand	Anodyne	SIGMAR1	51	45
CC(=O)c1ccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000450514945	FG	On-Demand	Anodyne	LSS	16	52
CC(=O)c1ccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000450514945	FG	On-Demand	Anodyne	FAAH	19	40
CC(=O)c1ccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1	ZINC000450514945	FG	On-Demand	Anodyne	MGLL	0	44
CCC[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514963	DF	On-Demand	Anodyne	AVPR1A	0	41
CCC[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514963	DF	On-Demand	Anodyne	EDNRB	43	37
CCC[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514963	DF	On-Demand	Anodyne	MPO	55	37
CCC[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514963	DF	On-Demand	Anodyne	BRS3	33	42
CCC[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514963	DF	On-Demand	Anodyne	ECE1	43	37
CCC[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514963	DF	On-Demand	Anodyne	SLC15A2	0	44
CCC[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514963	DF	On-Demand	Anodyne	NOD1	76	35
CCC[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514964	DF	On-Demand	Anodyne	AVPR1A	0	41
CCC[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514964	DF	On-Demand	Anodyne	EDNRB	43	37
CCC[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514964	DF	On-Demand	Anodyne	MPO	55	37
CCC[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514964	DF	On-Demand	Anodyne	BRS3	33	42
CCC[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514964	DF	On-Demand	Anodyne	ECE1	43	37
CCC[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514964	DF	On-Demand	Anodyne	SLC15A2	0	44
CCC[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450514964	DF	On-Demand	Anodyne	NOD1	76	35
Cc1cccc(NC(=O)[C@H]2CCCN(CC3(C#N)CCC3)C2)n1	ZINC000450514965	DF	On-Demand	Mild	SLC6A1	56	34
Cc1cccc(NC(=O)[C@H]2CCCN(CC3(C#N)CCC3)C2)n1	ZINC000450514965	DF	On-Demand	Mild	PDE8A	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(CC3(C#N)CCC3)C2)n1	ZINC000450514966	DF	On-Demand	Mild	SLC6A1	46	34
Cc1cccc(NC(=O)[C@@H]2CCCN(CC3(C#N)CCC3)C2)n1	ZINC000450514966	DF	On-Demand	Mild	PDE8A	0	41
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514969	FH	On-Demand	Anodyne	DRD4	28	40
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514969	FH	On-Demand	Anodyne	SLC6A1	101	36
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514969	FH	On-Demand	Anodyne	CCR2	18	49
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514969	FH	On-Demand	Anodyne	TYK2	40	37
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514969	FH	On-Demand	Anodyne	RHOA	0	40
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514970	FH	On-Demand	Anodyne	DRD4	28	40
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514970	FH	On-Demand	Anodyne	SLC6A1	101	36
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514970	FH	On-Demand	Anodyne	CCR2	18	49
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514970	FH	On-Demand	Anodyne	TYK2	40	37
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c1	ZINC000450514970	FH	On-Demand	Anodyne	RHOA	0	40
COc1cc(Cl)c(C(=O)N2CC[C@@H](C(=O)O)C2)cc1OC	ZINC000450514977	DD	On-Demand	Anodyne	SLC6A1	46	38
COc1cc(Cl)c(C(=O)N2CC[C@@H](C(=O)O)C2)cc1OC	ZINC000450514977	DD	On-Demand	Anodyne	HTR4	65	39
COc1cc(Cl)c(C(=O)N2CC[C@H](C(=O)O)C2)cc1OC	ZINC000450514978	DD	On-Demand	Anodyne	SLC6A1	46	38
COc1cc(Cl)c(C(=O)N2CC[C@H](C(=O)O)C2)cc1OC	ZINC000450514978	DD	On-Demand	Anodyne	HTR4	65	39
Cc1ccc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)nc1	ZINC000450514983	FG	On-Demand	Anodyne	ACHE	16	40
Cc1ccc(NC(=O)C2CCN(CCN(C)Cc3ccccc3)CC2)nc1	ZINC000450514983	FG	On-Demand	Anodyne	SIGMAR1	35	40
COC[C@@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)OC	ZINC000450514994	CD	On-Demand	Anodyne	MTNR1B	28	45
COC[C@@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)OC	ZINC000450514994	CD	On-Demand	Anodyne	GPR88	0	42
O=C(NCc1ccc(F)cc1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450514995	FH	On-Demand	Anodyne	CCR3	42	38
O=C(NCc1ccc(F)cc1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450514995	FH	On-Demand	Anodyne	CACNA1G	43	50
O=C(NCc1ccc(F)cc1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450514996	FH	On-Demand	Anodyne	CCR3	42	38
O=C(NCc1ccc(F)cc1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450514996	FH	On-Demand	Anodyne	CACNA1G	43	50
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	DRD2	19	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	DRD4	19	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	HTR2A	16	42
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	SLC6A1	0	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	SLC6A4	19	52
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	SLC6A3	31	52
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	SIGMAR1	35	56
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	P2RX7	21	40
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	CCR3	63	45
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	CCR5	23	44
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	F11	45	35
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	EPHX2	23	44
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	AMP1_PLAFQ	40	34
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	CACNA1G	65	51
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	SCD	20	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450514999	GG	On-Demand	Anodyne	TMPRSS11D	53	35
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	DRD2	19	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	DRD4	19	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	HTR2A	16	42
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	SLC6A1	0	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	SLC6A4	19	52
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	SLC6A3	31	52
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	SIGMAR1	35	56
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	P2RX7	21	40
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	CCR3	63	45
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	CCR5	23	44
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	F11	45	35
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	EPHX2	23	44
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	AMP1_PLAFQ	40	34
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	CACNA1G	65	51
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	SCD	20	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450515000	GG	On-Demand	Anodyne	TMPRSS11D	53	35
O=C(N[C@H](CO)Cc1ccc(F)cc1)[C@@H](O)C1CCC1	ZINC000450515002	CD	On-Demand	Anodyne	MME	24	42
O=C(N[C@H](CO)Cc1ccc(F)cc1)[C@@H](O)C1CCC1	ZINC000450515002	CD	On-Demand	Anodyne	YARS	52	35
O=C(N[C@@H](CO)Cc1ccc(F)cc1)[C@@H](O)C1CCC1	ZINC000450515003	CD	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H](CO)Cc1ccc(F)cc1)[C@@H](O)C1CCC1	ZINC000450515003	CD	On-Demand	Anodyne	YARS	52	35
O=C(N[C@H](CO)Cc1ccc(F)cc1)[C@H](O)C1CCC1	ZINC000450515004	CD	On-Demand	Anodyne	MME	24	42
O=C(N[C@H](CO)Cc1ccc(F)cc1)[C@H](O)C1CCC1	ZINC000450515004	CD	On-Demand	Anodyne	YARS	52	35
O=C(N[C@@H](CO)Cc1ccc(F)cc1)[C@H](O)C1CCC1	ZINC000450515005	CD	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H](CO)Cc1ccc(F)cc1)[C@H](O)C1CCC1	ZINC000450515005	CD	On-Demand	Anodyne	YARS	52	35
COC(=O)C1(CN[C@@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)CC1	ZINC000450515087	FH	On-Demand	Anodyne	SOAT1	0	49
COC(=O)C1(CN[C@@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)CC1	ZINC000450515087	FH	On-Demand	Anodyne	MMP1	24	41
COC(=O)C1(CN[C@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)CC1	ZINC000450515088	FH	On-Demand	Anodyne	SOAT1	0	49
COC(=O)C1(CN[C@H](Cc2ccc(OC)cc2)c2ccc(OC)cc2)CC1	ZINC000450515088	FH	On-Demand	Anodyne	MMP1	24	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ncnc3sccc23)CC1	ZINC000450515091	FF	On-Demand	Anodyne	ADRB3	0	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ncnc3sccc23)CC1	ZINC000450515092	FF	On-Demand	Anodyne	ADRB3	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncnc3sccc23)CC1	ZINC000450515093	FF	On-Demand	Anodyne	ADRB3	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncnc3sccc23)CC1	ZINC000450515094	FF	On-Demand	Anodyne	ADRB3	0	40
CCCOc1cccc(CC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515100	FG	On-Demand	Anodyne	ACACA	41	44
CCCOc1cccc(CC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515100	FG	On-Demand	Anodyne	ACACB	22	41
CCCOc1cccc(CC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515100	FG	On-Demand	Anodyne	PLA2G4B	27	42
CCCOc1cccc(CC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515100	FG	On-Demand	Anodyne	TSPAN17	0	42
CCCOc1cccc(CC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515100	FG	On-Demand	Anodyne	CRTM	50	36
CCCOc1cccc(CC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515100	FG	On-Demand	Anodyne	PDS	65	34
CCCOc1cccc(CC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515101	FG	On-Demand	Anodyne	ACACA	41	44
CCCOc1cccc(CC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515101	FG	On-Demand	Anodyne	ACACB	22	41
CCCOc1cccc(CC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515101	FG	On-Demand	Anodyne	PLA2G4B	27	42
CCCOc1cccc(CC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515101	FG	On-Demand	Anodyne	TSPAN17	0	42
CCCOc1cccc(CC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515101	FG	On-Demand	Anodyne	CRTM	50	36
CCCOc1cccc(CC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450515101	FG	On-Demand	Anodyne	PDS	65	34
CCOC(=O)c1ccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)nc1	ZINC000450515105	GG	On-Demand	Anodyne	P2RY12	26	43
CCOC(=O)c1ccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)nc1	ZINC000450515106	GG	On-Demand	Anodyne	P2RY12	26	43
O=C(NCC[C@H]1CCCCO1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450515113	EH	On-Demand	Anodyne	OXTR	0	41
O=C(NCC[C@H]1CCCCO1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450515113	EH	On-Demand	Anodyne	RBP4	75	37
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450515116	EI	On-Demand	Anodyne	AVPR2	28	43
Cc1ccc([C@H](CNC(=O)C(C)(C)COCc2ccccc2)C(=O)O)cc1	ZINC000450515123	FH	On-Demand	Anodyne	POL	0	41
Cc1ccc([C@H](CNC(=O)C(C)(C)COCc2ccccc2)C(=O)O)cc1	ZINC000450515123	FH	On-Demand	Anodyne	NPR	45	32
Cc1ccc([C@@H](CNC(=O)C(C)(C)COCc2ccccc2)C(=O)O)cc1	ZINC000450515131	FH	On-Demand	Anodyne	POL	0	41
Cc1ccc([C@@H](CNC(=O)C(C)(C)COCc2ccccc2)C(=O)O)cc1	ZINC000450515131	FH	On-Demand	Anodyne	NPR	45	32
CN(C)S(=O)(=O)CC(=O)N1CCc2ccc(C(=O)O)cc2C1	ZINC000450515135	EC	On-Demand	Anodyne	HDAC6	37	42
CN(C)S(=O)(=O)CC(=O)N1CCc2ccc(C(=O)O)cc2C1	ZINC000450515135	EC	On-Demand	Anodyne	AKR1C3	57	41
C[C@@H](NC(=O)c1ccc2cnccc2c1)[C@H]1CCCN(C2CCC2)C1	ZINC000450515136	EH	On-Demand	Anodyne	HRH3	15	43
C[C@@H](NC(=O)c1ccc2cnccc2c1)[C@H]1CCCN(C2CCC2)C1	ZINC000450515136	EH	On-Demand	Anodyne	AKT1	25	50
C[C@@H](NC(=O)c1ccc2cnccc2c1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450515137	EH	On-Demand	Anodyne	HRH3	15	43
C[C@@H](NC(=O)c1ccc2cnccc2c1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450515137	EH	On-Demand	Anodyne	AKT1	25	50
C[C@H](NC(=O)c1ccc2cnccc2c1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450515138	EH	On-Demand	Anodyne	HRH3	15	43
C[C@H](NC(=O)c1ccc2cnccc2c1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450515138	EH	On-Demand	Anodyne	AKT1	25	50
C[C@H](NC(=O)c1ccc2cnccc2c1)[C@H]1CCCN(C2CCC2)C1	ZINC000450515139	EH	On-Demand	Anodyne	HRH3	15	43
C[C@H](NC(=O)c1ccc2cnccc2c1)[C@H]1CCCN(C2CCC2)C1	ZINC000450515139	EH	On-Demand	Anodyne	AKT1	25	50
CCOC(=O)c1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)nc1	ZINC000450515147	GI	On-Demand	Anodyne	SSTR5	68	44
COC[C@@H](CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1)OC	ZINC000450515149	FE	On-Demand	Anodyne	PYGL	57	38
COC[C@H](CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1)OC	ZINC000450515151	FE	On-Demand	Anodyne	PYGL	57	38
O=C(c1cccc2c1CCCC2)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450515161	EI	On-Demand	Anodyne	L3MBTL3	56	39
O=C(c1cccc2c1CCCC2)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450515162	EI	On-Demand	Anodyne	L3MBTL3	56	39
N#Cc1cccc(C(=O)NCCN2CCNC(=O)C2)c1Br	ZINC000450515171	FC	On-Demand	Mild	DRD4	41	32
N#Cc1cccc(C(=O)NCCN2CCNC(=O)C2)c1Br	ZINC000450515171	FC	On-Demand	Mild	PLD2	68	35
CN(C)c1nc(N[C@@H](CO)C[C@H](O)C(C)(C)C)nc2ccccc12	ZINC000450515174	ED	On-Demand	Anodyne	ADRA2A	15	42
CN(C)c1nc(N[C@@H](CO)C[C@@H](O)C(C)(C)C)nc2ccccc12	ZINC000450515181	ED	On-Demand	Anodyne	ADRA2A	15	42
CN(C)c1nc(N[C@H](CO)C[C@@H](O)C(C)(C)C)nc2ccccc12	ZINC000450515185	ED	On-Demand	Anodyne	ADRA2A	15	42
Cc1cccc(NC(=O)[C@H]2CCCN(CC3CC(F)(F)C3)C2)n1	ZINC000450515189	DG	On-Demand	Anodyne	SLC6A1	92	35
Cc1cccc(NC(=O)[C@H]2CCCN(CC3CC(F)(F)C3)C2)n1	ZINC000450515189	DG	On-Demand	Anodyne	CCR3	50	34
Cc1cccc(NC(=O)[C@H]2CCCN(CC3CC(F)(F)C3)C2)n1	ZINC000450515189	DG	On-Demand	Anodyne	PDE8A	0	42
Cc1cccc(NC(=O)[C@@H]2CCCN(CC3CC(F)(F)C3)C2)n1	ZINC000450515190	DG	On-Demand	Anodyne	SLC6A1	92	35
Cc1cccc(NC(=O)[C@@H]2CCCN(CC3CC(F)(F)C3)C2)n1	ZINC000450515190	DG	On-Demand	Anodyne	CCR3	50	34
Cc1cccc(NC(=O)[C@@H]2CCCN(CC3CC(F)(F)C3)C2)n1	ZINC000450515190	DG	On-Demand	Anodyne	PDE8A	0	42
CN(C)c1nc(N[C@H](CO)C[C@H](O)C(C)(C)C)nc2ccccc12	ZINC000450515192	ED	On-Demand	Anodyne	ADRA2A	15	42
CC[C@H](CC(F)(F)F)C(=O)Nc1cccnc1OCC(F)F	ZINC000450515225	EH	On-Demand	Anodyne	P2RY1	55	38
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450515229	FI	On-Demand	Anodyne	F10	37	47
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450515229	FI	On-Demand	Anodyne	NPY5R	17	41
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccnc1OCC(F)F	ZINC000450515230	EH	On-Demand	Anodyne	P2RY1	55	38
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450515231	FI	On-Demand	Anodyne	F10	37	47
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450515231	FI	On-Demand	Anodyne	NPY5R	17	41
CCC[C@@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515242	EF	On-Demand	Anodyne	SLC6A1	68	34
CCC[C@@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515242	EF	On-Demand	Anodyne	F10	27	47
CCC[C@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515243	EF	On-Demand	Anodyne	SLC6A1	68	34
CCC[C@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515243	EF	On-Demand	Anodyne	F10	27	47
CCC[C@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515245	EF	On-Demand	Anodyne	SLC6A1	68	34
CCC[C@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515245	EF	On-Demand	Anodyne	F10	27	47
CCC[C@@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515246	EF	On-Demand	Anodyne	SLC6A1	68	34
CCC[C@@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515246	EF	On-Demand	Anodyne	F10	27	47
CN(C)CCCC1CCN(C(=O)Cc2cc3ccccc3s2)CC1	ZINC000450515247	EI	On-Demand	Anodyne	NPY2R	15	40
CCN(CCC(=O)NCc1ccc(OC)cc1OC)[C@H]1CCS(=O)(=O)C1	ZINC000450515249	GD	On-Demand	Anodyne	MTNR1A	40	37
CCN(CCC(=O)NCc1ccc(OC)cc1OC)[C@@H]1CCS(=O)(=O)C1	ZINC000450515250	GD	On-Demand	Anodyne	MTNR1A	40	37
O=[N+]([O-])c1ccc2nc(N3CCCCC[C@@H]3CCO)[nH]c2c1	ZINC000450515260	DF	On-Demand	Bother	TXN	21	54
O=[N+]([O-])c1ccc2nc(N3CCCCC[C@H]3CCO)[nH]c2c1	ZINC000450515261	DF	On-Demand	Bother	TXN	21	54
COc1cccc2c(N3CCC[C@@H](c4nc(C(F)(F)F)cn4C)C3)nccc12	ZINC000450515265	GI	On-Demand	Anodyne	PDE3A	31	40
COc1cccc2c(N3CCC[C@@H](c4nc(C(F)(F)F)cn4C)C3)nccc12	ZINC000450515265	GI	On-Demand	Anodyne	PDE3B	42	33
COc1cccc2c(N3CCC[C@H](c4nc(C(F)(F)F)cn4C)C3)nccc12	ZINC000450515266	GI	On-Demand	Anodyne	PDE3A	31	40
COc1cccc2c(N3CCC[C@H](c4nc(C(F)(F)F)cn4C)C3)nccc12	ZINC000450515266	GI	On-Demand	Anodyne	PDE3B	42	33
CNS(=O)(=O)NCC(=O)N1CCCCc2cc(OC)ccc21	ZINC000450515267	EC	On-Demand	Anodyne	DRD4	46	36
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)n1	ZINC000450515269	ED	On-Demand	Anodyne	SLC6A1	60	33
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)n1	ZINC000450515269	ED	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)n1	ZINC000450515270	ED	On-Demand	Anodyne	SLC6A1	60	33
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)n1	ZINC000450515270	ED	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)n1	ZINC000450515271	ED	On-Demand	Anodyne	SLC6A1	60	33
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)n1	ZINC000450515271	ED	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)n1	ZINC000450515272	ED	On-Demand	Anodyne	SLC6A1	60	33
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)n1	ZINC000450515272	ED	On-Demand	Anodyne	PDE8A	0	41
COC[C@H](CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)OC	ZINC000450515273	FE	On-Demand	Anodyne	ROCK2	16	41
COC[C@H](CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)OC	ZINC000450515273	FE	On-Demand	Anodyne	PDS	52	41
COC[C@@H](CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)OC	ZINC000450515274	FE	On-Demand	Anodyne	ROCK2	16	41
COC[C@@H](CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)OC	ZINC000450515274	FE	On-Demand	Anodyne	PDS	52	41
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450515278	FH	On-Demand	Anodyne	SLC6A1	57	34
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450515278	FH	On-Demand	Anodyne	F10	20	45
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450515280	FH	On-Demand	Anodyne	SLC6A1	57	34
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450515280	FH	On-Demand	Anodyne	F10	20	45
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450515282	FH	On-Demand	Anodyne	SLC6A1	57	34
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450515282	FH	On-Demand	Anodyne	F10	20	45
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450515283	FH	On-Demand	Anodyne	SLC6A1	57	34
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450515283	FH	On-Demand	Anodyne	F10	20	45
Cc1csc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450515290	DG	On-Demand	Anodyne	TRPC6	43	33
Cc1csc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450515291	DG	On-Demand	Anodyne	TRPC6	43	33
COC[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)OC	ZINC000450515298	EF	On-Demand	Anodyne	RBP4	65	42
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450515306	EF	On-Demand	Anodyne	F10	26	45
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450515307	EF	On-Demand	Anodyne	F10	26	45
CCOC(=O)c1ccc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)nc1	ZINC000450515314	GI	On-Demand	Anodyne	HTR1A	16	48
CCOC(=O)c1ccc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)nc1	ZINC000450515314	GI	On-Demand	Anodyne	HTR1D	16	53
CCOC(=O)c1ccc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)nc1	ZINC000450515314	GI	On-Demand	Anodyne	SLC6A4	22	54
COc1ccc2[nH]cc(C3=CCN(CC4CCC(=O)CC4)CC3)c2c1	ZINC000450515316	EI	On-Demand	Anodyne	HTR1A	22	51
COc1ccc2[nH]cc(C3=CCN(CC4CCC(=O)CC4)CC3)c2c1	ZINC000450515316	EI	On-Demand	Anodyne	HTR1D	25	53
COc1ccc2[nH]cc(C3=CCN(CC4CCC(=O)CC4)CC3)c2c1	ZINC000450515316	EI	On-Demand	Anodyne	HTR1B	21	53
COc1ccc2[nH]cc(C3=CCN(CC4CCC(=O)CC4)CC3)c2c1	ZINC000450515316	EI	On-Demand	Anodyne	SLC6A4	26	64
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515323	GH	On-Demand	Anodyne	SLC6A1	127	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515323	GH	On-Demand	Anodyne	F10	28	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515325	GH	On-Demand	Anodyne	SLC6A1	127	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515325	GH	On-Demand	Anodyne	F10	28	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515327	GH	On-Demand	Anodyne	SLC6A1	127	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515327	GH	On-Demand	Anodyne	F10	28	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515328	GH	On-Demand	Anodyne	SLC6A1	127	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515328	GH	On-Demand	Anodyne	F10	28	45
COc1ccc(OC(F)(F)F)c(C(=O)NCCN2CCNC(=O)C2)c1	ZINC000450515332	FC	On-Demand	Anodyne	DRD4	48	36
C[C@@H](NC(=O)[C@H](O)C1CCC1)c1cccc(F)c1F	ZINC000450515337	CE	On-Demand	Anodyne	CES2	21	43
C[C@H](NC(=O)[C@H](O)C1CCC1)c1cccc(F)c1F	ZINC000450515338	CE	On-Demand	Anodyne	CES2	21	43
C[C@@H](NC(=O)[C@@H](O)C1CCC1)c1cccc(F)c1F	ZINC000450515340	CE	On-Demand	Anodyne	CES2	21	43
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1cccc(F)c1F	ZINC000450515341	CE	On-Demand	Anodyne	CES2	21	43
CCc1cc(CCCN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)on1	ZINC000450515353	GH	On-Demand	Anodyne	SLC6A1	80	35
CCc1cc(CCCN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)on1	ZINC000450515353	GH	On-Demand	Anodyne	F10	20	41
CCc1cc(CCCN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)on1	ZINC000450515354	GH	On-Demand	Anodyne	SLC6A1	80	35
CCc1cc(CCCN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)on1	ZINC000450515354	GH	On-Demand	Anodyne	F10	20	41
C[C@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450515357	EH	On-Demand	Anodyne	BIRC3	41	39
C[C@@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450515359	EH	On-Demand	Anodyne	BIRC3	41	39
C[C@@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450515360	EH	On-Demand	Anodyne	BIRC3	41	39
C[C@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450515361	EH	On-Demand	Anodyne	BIRC3	41	39
COc1ccccc1Oc1ccc(C(=O)NCCN2CCNC(=O)C2)nc1	ZINC000450515365	FD	On-Demand	Anodyne	DRD1	0	45
COc1ccccc1Oc1ccc(C(=O)NCCN2CCNC(=O)C2)nc1	ZINC000450515365	FD	On-Demand	Anodyne	DRD4	44	35
CC[C@H](O)CC(=O)N1CCC(CCCN(C)C)CC1	ZINC000450515376	CD	On-Demand	Anodyne	GNAI3	0	41
CC[C@@H](O)CC(=O)N1CCC(CCCN(C)C)CC1	ZINC000450515377	CD	On-Demand	Anodyne	GNAI3	0	41
O=C(Nc1cccnc1OCC(F)F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450515386	DF	On-Demand	Anodyne	P2RY1	49	34
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	HTR1A	20	46
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	DRD2	33	49
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	DRD1	16	42
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	DRD4	39	42
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	HTR2A	34	45
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	HTR2C	26	53
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	SLC6A1	64	34
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	HRH1	18	42
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	DRD3	28	42
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	F10	39	46
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	ERG2	18	42
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	HTR7	25	42
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	HRH3	17	40
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	SIGMAR1	28	47
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	MCHR1	22	53
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	LUCI_LUCLA	32	41
O=C(CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)c1ccccc1	ZINC000450515393	GI	On-Demand	Anodyne	CYP2J2	61	43
O=C(O)c1ccc2c(c1)CN(C(=O)CCCc1cc(F)ccc1F)CC2	ZINC000450515395	FH	On-Demand	Anodyne	DPP4	20	41
O=C(O)c1ccc2c(c1)CN(C(=O)CCCc1cc(F)ccc1F)CC2	ZINC000450515395	FH	On-Demand	Anodyne	HDAC6	39	43
O=C(O)c1ccc2c(c1)CN(C(=O)CCCc1cc(F)ccc1F)CC2	ZINC000450515395	FH	On-Demand	Anodyne	AKR1C3	27	42
CSc1cccc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450515398	GH	On-Demand	Anodyne	DRD4	15	43
CSc1cccc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450515398	GH	On-Demand	Anodyne	MAPK14	43	38
CSc1cccc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450515398	GH	On-Demand	Anodyne	MAPK13	89	34
CSc1cccc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450515398	GH	On-Demand	Anodyne	CCR2	22	40
CSc1cccc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450515407	GH	On-Demand	Anodyne	DRD4	15	43
CSc1cccc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450515407	GH	On-Demand	Anodyne	MAPK14	43	38
CSc1cccc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450515407	GH	On-Demand	Anodyne	MAPK13	89	34
CSc1cccc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450515407	GH	On-Demand	Anodyne	CCR2	22	40
O=C(O)CCCOc1ccc(CNC(=O)C2(C3CC3)CCOCC2)cc1	ZINC000450515412	FF	On-Demand	Anodyne	CYSLTR2	42	32
Cn1nc(-c2ccccc2)cc1C(=O)NCCCOCCO	ZINC000450515419	DD	On-Demand	Anodyne	P2RY12	44	35
Cn1nc(-c2ccccc2)cc1C(=O)NCCCOCCO	ZINC000450515419	DD	On-Demand	Anodyne	CTSV	44	30
CC(C)(CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(F)(F)F	ZINC000450515425	EG	On-Demand	Anodyne	CPA1	47	39
CC(C)(CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(F)(F)F	ZINC000450515426	EG	On-Demand	Anodyne	CPA1	47	39
CN(C)c1nc(N2CCC(CC(F)(F)F)CC2)nc2ccccc12	ZINC000450515429	EH	On-Demand	Anodyne	ADRA2A	15	43
CCCc1occc1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515430	EG	On-Demand	Anodyne	ANPEP	49	37
CCCc1occc1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515431	EG	On-Demand	Anodyne	ANPEP	49	37
Cn1cc(-c2ccc(C(=O)NCC[C@H]3CCCCO3)o2)cn1	ZINC000450515441	DE	On-Demand	Anodyne	MMP13	17	44
Cn1cc(-c2ccc(C(=O)NCC[C@@H]3CCCCO3)o2)cn1	ZINC000450515442	DE	On-Demand	Anodyne	MMP13	17	44
O=C(O)CCCOc1ccc(CNC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450515443	GG	On-Demand	Anodyne	LTA4H	37	42
O=C(O)CCCOc1ccc(CNC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450515443	GG	On-Demand	Anodyne	CYSLTR2	60	34
O=C(O)CCCOc1ccc(CNC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450515443	GG	On-Demand	Anodyne	FFAR4	40	35
C[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515467	CE	On-Demand	Anodyne	MME	51	47
C[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515467	CE	On-Demand	Anodyne	ANPEP	40	36
C[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515467	CE	On-Demand	Anodyne	CPA1	60	42
C[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515467	CE	On-Demand	Anodyne	ACE2	44	33
C[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515468	CE	On-Demand	Anodyne	MME	51	47
C[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515468	CE	On-Demand	Anodyne	ANPEP	40	36
C[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515468	CE	On-Demand	Anodyne	CPA1	60	42
C[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515468	CE	On-Demand	Anodyne	ACE2	44	33
C[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515469	CE	On-Demand	Anodyne	MME	51	47
C[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515469	CE	On-Demand	Anodyne	ANPEP	40	36
C[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515469	CE	On-Demand	Anodyne	CPA1	60	42
C[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515469	CE	On-Demand	Anodyne	ACE2	44	33
C[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515470	CE	On-Demand	Anodyne	MME	51	47
C[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515470	CE	On-Demand	Anodyne	ANPEP	40	36
C[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515470	CE	On-Demand	Anodyne	CPA1	60	42
C[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C1CC1	ZINC000450515470	CE	On-Demand	Anodyne	ACE2	44	33
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	PPARA	19	45
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	HTR4	18	42
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	MME	20	45
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	CTSB	21	43
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	CTSL	21	40
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	CPA1	28	49
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	PPARD	21	42
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	CTSV	39	40
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	ITGAV	19	41
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515474	GG	On-Demand	Anodyne	KCNK3	41	36
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	PPARA	19	45
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	HTR4	18	42
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	MME	20	45
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	CTSB	21	43
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	CTSL	21	40
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	CPA1	28	49
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	PPARD	21	42
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	CTSV	39	40
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	ITGAV	19	41
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1OC	ZINC000450515475	GG	On-Demand	Anodyne	KCNK3	41	36
CC1=C(C(=O)Nc2ccc(O)cc2F)CCC(C)(C)C1	ZINC000450515480	CH	On-Demand	Anodyne	DHODH	17	45
CCC(CC)(CNC(=O)c1cc(OC)c(OC)cc1Cl)C(=O)O	ZINC000450515497	EF	On-Demand	Anodyne	HTR4	28	42
Cc1ccc(NC(=O)C2CCN(C[C@@H]3CCCCN3C(C)C)CC2)nc1	ZINC000450515498	FG	On-Demand	Anodyne	GCK	23	40
Cc1ccc(NC(=O)C2CCN(C[C@H]3CCCCN3C(C)C)CC2)nc1	ZINC000450515499	FG	On-Demand	Anodyne	GCK	23	40
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)n1	ZINC000450515501	EG	On-Demand	Anodyne	SLC6A1	52	33
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)n1	ZINC000450515501	EG	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)n1	ZINC000450515502	EG	On-Demand	Anodyne	SLC6A1	52	33
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)n1	ZINC000450515502	EG	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)n1	ZINC000450515503	EG	On-Demand	Anodyne	SLC6A1	52	33
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)n1	ZINC000450515503	EG	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)n1	ZINC000450515504	EG	On-Demand	Anodyne	SLC6A1	52	33
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)n1	ZINC000450515504	EG	On-Demand	Anodyne	PDE8A	0	41
CC(C)N1C(=O)N[C@@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@@H]21	ZINC000450515508	GF	On-Demand	Anodyne	PDE3A	47	37
CC(C)N1C(=O)N[C@@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@@H]21	ZINC000450515508	GF	On-Demand	Anodyne	PDE3B	70	37
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450515513	EG	On-Demand	Anodyne	F10	34	49
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(CCc2cscn2)C1	ZINC000450515520	FG	On-Demand	Anodyne	SLC6A1	94	34
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(CCc2cscn2)C1	ZINC000450515521	FG	On-Demand	Anodyne	SLC6A1	94	34
O=C1CC[C@H](CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)CCN1	ZINC000450515529	FE	On-Demand	Anodyne	F10	20	41
O=C1CC[C@@H](CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)CCN1	ZINC000450515530	FE	On-Demand	Anodyne	F10	20	41
O=C1CC[C@H](CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)CCN1	ZINC000450515531	FE	On-Demand	Anodyne	F10	20	41
O=C1CC[C@@H](CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)CCN1	ZINC000450515532	FE	On-Demand	Anodyne	F10	20	41
O=C(Nc1ccc(Br)cn1)[C@@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450515533	GH	On-Demand	Anodyne	SLC6A1	62	32
O=C(Nc1ccc(Br)cn1)[C@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450515534	GH	On-Demand	Anodyne	SLC6A1	62	32
COC[C@@H](CNC(=O)Cc1ccc(Cl)c(OC)c1)OC	ZINC000450515540	DD	On-Demand	Anodyne	TRPV1	43	44
COC[C@@H](CNC(=O)Cc1ccc(Cl)c(OC)c1)OC	ZINC000450515540	DD	On-Demand	Anodyne	NCE103	30	47
COC[C@H](CNC(=O)Cc1ccc(Cl)c(OC)c1)OC	ZINC000450515541	DD	On-Demand	Anodyne	TRPV1	43	44
COC[C@H](CNC(=O)Cc1ccc(Cl)c(OC)c1)OC	ZINC000450515541	DD	On-Demand	Anodyne	NCE103	30	47
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	ACE	27	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	PPARA	15	46
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	MME	56	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	CMA1	29	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	CTSB	54	44
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	CYSP_TRYCR	48	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	CTSF	54	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	CTSL	40	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	SOAT1	22	43
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	CTRC	57	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515547	FH	On-Demand	Anodyne	ACE2	48	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	ACE	27	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	PPARA	15	46
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	MME	56	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	CMA1	29	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	CTSB	54	44
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	CYSP_TRYCR	48	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	CTSF	54	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	CTSL	40	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	SOAT1	22	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	CTRC	57	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515548	FH	On-Demand	Anodyne	ACE2	48	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	ACE	27	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	PPARA	15	46
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	MME	56	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	CMA1	29	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	CTSB	54	44
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	CYSP_TRYCR	48	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	CTSF	54	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	CTSL	40	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	SOAT1	22	43
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	CTRC	57	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515549	FH	On-Demand	Anodyne	ACE2	48	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	ACE	27	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	PPARA	15	46
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	MME	56	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	CMA1	29	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	CTSB	54	44
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	CYSP_TRYCR	48	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	CTSF	54	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	CTSL	40	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	SOAT1	22	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	CTRC	57	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000450515550	FH	On-Demand	Anodyne	ACE2	48	34
C/C=C\COc1cccc(CC(=O)NCCN2CCNC(=O)C2)c1	ZINC000450515553	EC	On-Demand	Anodyne	DRD4	43	32
C/C=C/COc1cccc(CC(=O)NCCN2CCNC(=O)C2)c1	ZINC000450515554	EC	On-Demand	Anodyne	DRD4	43	32
O=C(CCCN1CCC[C@H]1c1ccc[nH]1)c1ccc(Br)cc1	ZINC000450515568	FJ	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCC[C@@H]1c1ccc[nH]1)c1ccc(Br)cc1	ZINC000450515569	FJ	On-Demand	Anodyne	CYP2J2	49	34
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450515570	GG	On-Demand	Anodyne	SIGMAR1	23	43
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450515570	GG	On-Demand	Anodyne	MCHR1	20	43
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450515570	GG	On-Demand	Anodyne	CACNA1G	52	55
COC(=O)CCN1CC[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1=O	ZINC000450515571	GC	On-Demand	Anodyne	CCKAR	34	40
COC(=O)CCN1CC[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1=O	ZINC000450515571	GC	On-Demand	Anodyne	CCKBR	49	40
COC(=O)CCN1CC[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1=O	ZINC000450515571	GC	On-Demand	Anodyne	EPHX2	21	48
COC(=O)CCN1CC[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1=O	ZINC000450515571	GC	On-Demand	Anodyne	CACNA1I	15	41
COC(=O)CCN1CC[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1=O	ZINC000450515572	GC	On-Demand	Anodyne	CCKAR	34	40
COC(=O)CCN1CC[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1=O	ZINC000450515572	GC	On-Demand	Anodyne	CCKBR	49	40
COC(=O)CCN1CC[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1=O	ZINC000450515572	GC	On-Demand	Anodyne	EPHX2	21	48
COC(=O)CCN1CC[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1=O	ZINC000450515572	GC	On-Demand	Anodyne	CACNA1I	15	41
Cc1ccc2c(C3=CCN(Cc4cnns4)CC3)c[nH]c2c1	ZINC000450515573	DH	On-Demand	Anodyne	SLC6A4	15	46
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	DRD2	29	40
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	DRD1	15	44
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	DRD4	0	44
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	HTR2A	19	45
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	HTR2C	17	45
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	ERG2	19	41
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	SLC18A3	0	46
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	HTR3B	0	41
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450515574	FI	On-Demand	Anodyne	CYP2J2	48	34
COc1ccc2[nH]cc(C3=CCN(Cc4ccn(CC(F)(F)F)n4)CC3)c2c1	ZINC000450515581	GI	On-Demand	Anodyne	HTR1A	0	49
COc1ccc2[nH]cc(C3=CCN(Cc4ccn(CC(F)(F)F)n4)CC3)c2c1	ZINC000450515581	GI	On-Demand	Anodyne	SLC6A4	16	55
COC(=O)C1(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)CC1	ZINC000450515584	FE	On-Demand	Anodyne	SLC6A1	86	35
COC(=O)C1(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)CC1	ZINC000450515584	FE	On-Demand	Anodyne	F10	49	33
COC(=O)C1(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)CC1	ZINC000450515585	FE	On-Demand	Anodyne	SLC6A1	86	35
COC(=O)C1(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)CC1	ZINC000450515585	FE	On-Demand	Anodyne	F10	49	33
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	ACE	31	44
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	GNRHR	0	42
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MME	50	47
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	LTA4H	25	43
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	EDNRB	56	40
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	EDNRA	35	43
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MC4R	41	39
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	CCKAR	67	41
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MPO	64	39
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	BRS3	22	41
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MC3R	56	40
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MC5R	60	38
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MMP2	24	46
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MMP8	32	46
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MMP14	73	38
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	GRPR	63	40
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	ECE1	69	48
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	LNPEP	28	48
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MMP11	61	37
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	CCKBR	45	46
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	GHSR	25	40
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	ACE2	68	40
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MC1R	72	40
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MMP7	0	42
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	MMP1	0	46
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	FPR1	25	42
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	NPR	39	49
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	SLC15A2	0	48
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	KISS1R	68	41
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	ERAP2	48	49
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	ERAP1	0	49
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	LASB	0	40
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	NOD1	78	36
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	NRDE	0	43
CCCC[C@@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515586	EG	On-Demand	Anodyne	IL1RN	0	40
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	ACE	31	44
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	GNRHR	0	42
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MME	50	47
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	LTA4H	25	43
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	EDNRB	56	40
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	EDNRA	35	43
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MC4R	41	39
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	CCKAR	67	41
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MPO	64	39
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	BRS3	22	41
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MC3R	56	40
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MC5R	60	38
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MMP2	24	46
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MMP8	32	46
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MMP14	73	38
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	GRPR	63	40
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	ECE1	69	48
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	LNPEP	28	48
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MMP11	61	37
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	CCKBR	45	46
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	GHSR	25	40
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	ACE2	68	40
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MC1R	72	40
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MMP7	0	42
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	MMP1	0	46
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	FPR1	25	42
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	NPR	39	49
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	SLC15A2	0	48
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	KISS1R	68	41
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	ERAP2	48	49
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	ERAP1	0	49
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	LASB	0	40
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	NOD1	78	36
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	NRDE	0	43
CCCC[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515587	EG	On-Demand	Anodyne	IL1RN	0	40
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	ACE	31	44
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	GNRHR	0	42
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MME	50	47
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	LTA4H	25	43
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	EDNRB	56	40
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	EDNRA	35	43
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MC4R	41	39
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	CCKAR	67	41
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MPO	64	39
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	BRS3	22	41
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MC3R	56	40
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MC5R	60	38
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MMP2	24	46
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MMP8	32	46
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MMP14	73	38
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	GRPR	63	40
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	ECE1	69	48
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	LNPEP	28	48
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MMP11	61	37
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	CCKBR	45	46
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	GHSR	25	40
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	ACE2	68	40
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MC1R	72	40
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MMP7	0	42
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	MMP1	0	46
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	FPR1	25	42
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	NPR	39	49
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	SLC15A2	0	48
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	KISS1R	68	41
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	ERAP2	48	49
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	ERAP1	0	49
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	LASB	0	40
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	NOD1	78	36
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	NRDE	0	43
CCCC[C@H](C)C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515588	EG	On-Demand	Anodyne	IL1RN	0	40
O=C(NCCCOCCO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450515600	FE	On-Demand	Anodyne	PYGL	50	44
O=C(NCCCOCCO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450515600	FE	On-Demand	Anodyne	PLD2	43	33
O=C(O)COc1cccc(CNC(=O)CCCc2cc(F)ccc2F)c1	ZINC000450515604	FG	On-Demand	Anodyne	TSPAN17	0	40
O=C(O)COc1cccc(CNC(=O)CCCc2cc(F)ccc2F)c1	ZINC000450515604	FG	On-Demand	Anodyne	CRTH2	0	42
O=C(O)COc1cccc(CNC(=O)CCCc2cc(F)ccc2F)c1	ZINC000450515604	FG	On-Demand	Anodyne	SUCNR1	54	35
O=C(O)COc1cccc(CNC(=O)CCCc2cc(F)ccc2F)c1	ZINC000450515604	FG	On-Demand	Anodyne	PDS	56	41
O=C(O)CCc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450515609	GI	On-Demand	Anodyne	EPHX2	25	45
O=C(O)CCc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450515609	GI	On-Demand	Anodyne	FFAR1	43	51
CS[C@@H](C)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515618	DE	On-Demand	Anodyne	MME	30	44
CS[C@@H](C)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515618	DE	On-Demand	Anodyne	CPA1	50	39
CS[C@@H](C)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515619	DE	On-Demand	Anodyne	MME	30	44
CS[C@@H](C)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515619	DE	On-Demand	Anodyne	CPA1	50	39
CS[C@H](C)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515620	DE	On-Demand	Anodyne	MME	30	44
CS[C@H](C)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515620	DE	On-Demand	Anodyne	CPA1	50	39
CS[C@H](C)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515621	DE	On-Demand	Anodyne	MME	30	44
CS[C@H](C)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515621	DE	On-Demand	Anodyne	CPA1	50	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450515629	EE	On-Demand	Anodyne	ABCB1	15	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450515629	EE	On-Demand	Anodyne	CCR8	17	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450515630	EE	On-Demand	Anodyne	ABCB1	15	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450515630	EE	On-Demand	Anodyne	CCR8	17	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450515631	EE	On-Demand	Anodyne	ABCB1	15	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450515631	EE	On-Demand	Anodyne	CCR8	17	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450515632	EE	On-Demand	Anodyne	ABCB1	15	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccccn2)CC1	ZINC000450515632	EE	On-Demand	Anodyne	CCR8	17	42
O=C(NCC(=O)N1CCOC2(CCC2)C1)Nc1cccc(Cl)c1	ZINC000450515634	EE	On-Demand	Anodyne	EPHX2	26	45
C[C@@]1(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)CCCOC1	ZINC000450515637	DE	On-Demand	Anodyne	CPA1	23	46
C[C@]1(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)CCCOC1	ZINC000450515638	DE	On-Demand	Anodyne	CPA1	23	46
C[C@]1(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)CCCOC1	ZINC000450515639	DE	On-Demand	Anodyne	CPA1	23	46
C[C@@]1(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)CCCOC1	ZINC000450515640	DE	On-Demand	Anodyne	CPA1	23	46
CC(C)C[C@H](CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450515653	EG	On-Demand	Anodyne	MMP14	46	38
CC(C)C[C@H](CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450515653	EG	On-Demand	Anodyne	KISS1R	49	31
CC(C)C[C@@H](CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450515654	EG	On-Demand	Anodyne	MMP14	46	38
CC(C)C[C@@H](CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450515654	EG	On-Demand	Anodyne	KISS1R	49	31
COc1ccc(F)cc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515658	FF	On-Demand	Anodyne	PPARA	22	50
COc1ccc(F)cc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515658	FF	On-Demand	Anodyne	MME	30	47
COc1ccc(F)cc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515658	FF	On-Demand	Anodyne	CPA1	49	38
COc1ccc(F)cc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515658	FF	On-Demand	Anodyne	PPARD	30	53
COc1ccc(F)cc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515659	FF	On-Demand	Anodyne	PPARA	22	50
COc1ccc(F)cc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515659	FF	On-Demand	Anodyne	MME	30	47
COc1ccc(F)cc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515659	FF	On-Demand	Anodyne	CPA1	49	38
COc1ccc(F)cc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515659	FF	On-Demand	Anodyne	PPARD	30	53
COc1ccc(C(=O)NCc2nc(C(=O)O)cs2)c(OC2CCCC2)c1	ZINC000450515661	GG	On-Demand	Anodyne	SLC5A7	26	40
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450515662	GG	On-Demand	Anodyne	AVPR2	34	43
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	NPY2R	18	42
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	COLA	68	37
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	CPT1A	66	37
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	CPT2	48	36
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	KDR	31	43
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	GRM4	25	41
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	NR1H4	15	48
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	CPT1B	47	36
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	NR2E3	45	34
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	SMO	34	45
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	Q25615_ONCVO	60	37
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	GLMU	0	46
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	KCNK3	55	44
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	KCNK9	49	43
COc1cc(Cl)c(C(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)cc1OC	ZINC000450515673	GH	On-Demand	Anodyne	BRPF1	0	40
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	ACE	31	44
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	GNRHR	0	42
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MME	50	47
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	LTA4H	25	43
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	EDNRB	56	40
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	EDNRA	35	43
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MC4R	41	39
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	CCKAR	67	41
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MPO	64	39
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	BRS3	22	41
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MC3R	56	40
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MC5R	60	38
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MMP2	24	46
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MMP8	32	46
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MMP14	73	38
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	GRPR	63	40
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	ECE1	69	48
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	LNPEP	28	48
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MMP11	61	37
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	CCKBR	45	46
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	GHSR	25	40
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	ACE2	68	40
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MC1R	72	40
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MMP7	0	42
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	MMP1	0	46
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	FPR1	25	42
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	NPR	39	49
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	SLC15A2	0	48
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	KISS1R	68	41
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	ERAP2	48	49
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	ERAP1	0	49
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	LASB	0	40
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	NOD1	78	36
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	NRDE	0	43
CCCC[C@H](C)C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515689	EG	On-Demand	Anodyne	IL1RN	0	40
COC[C@@H](CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1)OC	ZINC000450515690	FD	On-Demand	Anodyne	TRPC6	63	35
COC[C@@H](CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1)OC	ZINC000450515690	FD	On-Demand	Anodyne	TRPC3	43	35
COC[C@H](CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1)OC	ZINC000450515691	FD	On-Demand	Anodyne	TRPC6	63	35
COC[C@H](CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1)OC	ZINC000450515691	FD	On-Demand	Anodyne	TRPC3	43	35
O=C(N[C@@H](c1cccc2ccccc12)C(F)(F)F)c1cnn2c1CCC2	ZINC000450515693	FI	On-Demand	Anodyne	KCNJ11	56	31
O=C(N[C@H](c1cccc2ccccc12)C(F)(F)F)c1cnn2c1CCC2	ZINC000450515694	FI	On-Demand	Anodyne	KCNJ11	56	31
COc1ccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)cc1S(C)(=O)=O	ZINC000450515695	GF	On-Demand	Anodyne	MAPK7	15	40
COc1ccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)cc1S(C)(=O)=O	ZINC000450515695	GF	On-Demand	Anodyne	L3MBTL3	73	38
COc1ccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)cc1S(C)(=O)=O	ZINC000450515696	GF	On-Demand	Anodyne	MAPK7	15	40
COc1ccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)cc1S(C)(=O)=O	ZINC000450515696	GF	On-Demand	Anodyne	L3MBTL3	73	38
CC(C)Cn1cc(C(=O)NCCN2CCNC(=O)C2)c(C(F)F)n1	ZINC000450515706	EC	On-Demand	Anodyne	PLD2	46	32
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)CCCc1cc(F)ccc1F	ZINC000450515707	GE	On-Demand	Anodyne	SLC6A1	102	39
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)CCCc1cc(F)ccc1F	ZINC000450515707	GE	On-Demand	Anodyne	FDFT1	28	41
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)CCCc1cc(F)ccc1F	ZINC000450515708	GE	On-Demand	Anodyne	SLC6A1	102	39
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)CCCc1cc(F)ccc1F	ZINC000450515708	GE	On-Demand	Anodyne	FDFT1	28	41
C[C@H](CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)S(C)(=O)=O	ZINC000450515709	FD	On-Demand	Anodyne	F10	37	54
C[C@H](CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)S(C)(=O)=O	ZINC000450515709	FD	On-Demand	Anodyne	NPY5R	15	41
C[C@H](CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)S(C)(=O)=O	ZINC000450515709	FD	On-Demand	Anodyne	GCK	26	42
C[C@@H](CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)S(C)(=O)=O	ZINC000450515710	FD	On-Demand	Anodyne	F10	37	54
C[C@@H](CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)S(C)(=O)=O	ZINC000450515710	FD	On-Demand	Anodyne	NPY5R	15	41
C[C@@H](CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)S(C)(=O)=O	ZINC000450515710	FD	On-Demand	Anodyne	GCK	26	42
O=C(N[C@H]1CCCc2cc(F)ccc21)C1(Cc2ccccc2)CCOCC1	ZINC000450515711	FI	On-Demand	Anodyne	BDKRB1	63	41
O=C(N[C@@H]1CCCc2cc(F)ccc21)C1(Cc2ccccc2)CCOCC1	ZINC000450515712	FI	On-Demand	Anodyne	BDKRB1	63	41
CCn1nnc(C)c1CN(c1ccccc1)C(C)C	ZINC000450515715	CG	On-Demand	Anodyne	TAAR1	23	43
CCS(=O)(=O)c1ccc(CN2CCCc3c(C(=O)OC)cccc32)cc1	ZINC000450515716	FG	On-Demand	Anodyne	FABP4	44	34
CCS(=O)(=O)c1ccc(CN2CCCc3c(C(=O)OC)cccc32)cc1	ZINC000450515716	FG	On-Demand	Anodyne	RORC	40	32
COC[C@H](CNC(=O)c1cc2ccncc2s1)OC	ZINC000450515717	CD	On-Demand	Anodyne	SELE	62	38
COC[C@H](CNC(=O)c1cc2ccncc2s1)OC	ZINC000450515717	CD	On-Demand	Anodyne	ICAM1	63	38
COC[C@H](CNC(=O)c1cc2ccncc2s1)OC	ZINC000450515717	CD	On-Demand	Anodyne	VCAM1	56	37
COC[C@@H](CNC(=O)c1cc2ccncc2s1)OC	ZINC000450515718	CD	On-Demand	Anodyne	SELE	62	38
COC[C@@H](CNC(=O)c1cc2ccncc2s1)OC	ZINC000450515718	CD	On-Demand	Anodyne	ICAM1	63	38
COC[C@@H](CNC(=O)c1cc2ccncc2s1)OC	ZINC000450515718	CD	On-Demand	Anodyne	VCAM1	56	37
CCc1cc(CCCN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)on1	ZINC000450515730	FI	On-Demand	Anodyne	HTR1A	19	56
CCc1cc(CCCN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)on1	ZINC000450515730	FI	On-Demand	Anodyne	HTR1D	33	50
CCc1cc(CCCN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)on1	ZINC000450515730	FI	On-Demand	Anodyne	HTR1B	27	50
CCc1cc(CCCN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)on1	ZINC000450515730	FI	On-Demand	Anodyne	SLC6A4	25	57
CC(F)(F)c1ccc(C(=O)NCCN2CCNC(=O)C2)cn1	ZINC000450515741	DC	On-Demand	Anodyne	PLD2	66	39
CN1C(=O)N[C@@H]2CN(c3nccc4cc(C(F)(F)F)ccc34)CC[C@@H]21	ZINC000450515747	FF	On-Demand	Anodyne	LIPG	54	36
COc1ccc(C(=O)N[C@H](C)CCC(=O)O)c(OC2CCCC2)c1	ZINC000450515748	EF	On-Demand	Anodyne	ADRB3	22	42
COc1ccc(C(=O)N[C@@H](C)CCC(=O)O)c(OC2CCCC2)c1	ZINC000450515749	EF	On-Demand	Anodyne	ADRB3	22	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCCN1CCNC(=O)C1	ZINC000450515761	ED	On-Demand	Anodyne	PLD1	40	34
Cc1cc(C(F)(F)F)ccc1C(=O)NCCN1CCNC(=O)C1	ZINC000450515761	ED	On-Demand	Anodyne	PLD2	65	36
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	MME	27	45
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	EDNRB	56	40
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	EDNRA	27	40
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	TACR1	29	40
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	CCKAR	26	41
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	MPO	58	38
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	MMP14	53	36
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	ECE1	58	44
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	NPR	30	45
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	SLC15A2	0	49
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515762	FC	On-Demand	Anodyne	KISS1R	49	35
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	MME	27	45
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	EDNRB	56	40
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	EDNRA	27	40
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	TACR1	29	40
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	CCKAR	26	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	MPO	58	38
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	MMP14	53	36
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	ECE1	58	44
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	NPR	30	45
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	SLC15A2	0	49
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450515763	FC	On-Demand	Anodyne	KISS1R	49	35
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	KLKB1	32	42
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	DRD2	15	44
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	DRD4	41	37
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	ACHE	15	44
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	F10	42	32
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	SIGMAR1	28	53
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	SSTR5	45	39
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	MAPK1	29	41
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450515772	FH	On-Demand	Anodyne	CXCR3	36	45
N#Cc1ccc(OCC(=O)NCCN2CCNC(=O)C2)cc1Br	ZINC000450515773	GC	On-Demand	Mild	TRPV4	40	31
COC(=O)c1coc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)n1	ZINC000450515777	FE	On-Demand	Anodyne	SLC6A1	64	33
COC(=O)c1coc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)n1	ZINC000450515777	FE	On-Demand	Anodyne	PDE8B	41	33
COC(=O)c1coc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)n1	ZINC000450515778	FE	On-Demand	Anodyne	SLC6A1	64	33
COC(=O)c1coc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)n1	ZINC000450515778	FE	On-Demand	Anodyne	PDE8B	41	33
COc1ccccc1-n1cnc2cc(C(=O)NCCCOCCO)ccc21	ZINC000450515803	FE	On-Demand	Anodyne	HTR1A	30	46
COc1ccccc1-n1cnc2cc(C(=O)NCCCOCCO)ccc21	ZINC000450515803	FE	On-Demand	Anodyne	DRD2	34	50
COc1ccccc1-n1cnc2cc(C(=O)NCCCOCCO)ccc21	ZINC000450515803	FE	On-Demand	Anodyne	DRD4	24	45
COc1ccccc1-n1cnc2cc(C(=O)NCCCOCCO)ccc21	ZINC000450515803	FE	On-Demand	Anodyne	ADRA1D	17	42
COc1ccccc1-n1cnc2cc(C(=O)NCCCOCCO)ccc21	ZINC000450515803	FE	On-Demand	Anodyne	DRD3	60	50
COc1ccccc1-n1cnc2cc(C(=O)NCCCOCCO)ccc21	ZINC000450515803	FE	On-Demand	Anodyne	CPT1A	46	34
COc1ccccc1-n1cnc2cc(C(=O)NCCCOCCO)ccc21	ZINC000450515803	FE	On-Demand	Anodyne	HPGD	45	55
CCC[C@H](O)CN1CCN(C(=O)NC2CCCCC2)CC1	ZINC000450515807	CD	On-Demand	Anodyne	NMUR2	0	44
CCC[C@H](O)CN1CCN(C(=O)NC2CCCCC2)CC1	ZINC000450515807	CD	On-Demand	Anodyne	NMUR1	0	44
CCC[C@@H](O)CN1CCN(C(=O)NC2CCCCC2)CC1	ZINC000450515808	CD	On-Demand	Anodyne	NMUR2	0	44
CCC[C@@H](O)CN1CCN(C(=O)NC2CCCCC2)CC1	ZINC000450515808	CD	On-Demand	Anodyne	NMUR1	0	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515810	FE	On-Demand	Anodyne	FABI	45	35
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515810	FE	On-Demand	Anodyne	GRIN2B	15	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515810	FE	On-Demand	Anodyne	L3MBTL3	41	35
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515811	FE	On-Demand	Anodyne	FABI	45	35
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515811	FE	On-Demand	Anodyne	GRIN2B	15	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515811	FE	On-Demand	Anodyne	L3MBTL3	41	35
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515812	FE	On-Demand	Anodyne	FABI	45	35
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515812	FE	On-Demand	Anodyne	GRIN2B	15	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515812	FE	On-Demand	Anodyne	L3MBTL3	41	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515813	FE	On-Demand	Anodyne	FABI	45	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515813	FE	On-Demand	Anodyne	GRIN2B	15	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450515813	FE	On-Demand	Anodyne	L3MBTL3	41	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515824	FH	On-Demand	Anodyne	MME	59	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515824	FH	On-Demand	Anodyne	PAPA1_CARPA	47	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515824	FH	On-Demand	Anodyne	CYSP_TRYCR	47	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515824	FH	On-Demand	Anodyne	CTSF	47	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515824	FH	On-Demand	Anodyne	ACE2	55	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515824	FH	On-Demand	Anodyne	FPR1	42	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515825	FH	On-Demand	Anodyne	MME	59	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515825	FH	On-Demand	Anodyne	PAPA1_CARPA	47	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515825	FH	On-Demand	Anodyne	CYSP_TRYCR	47	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515825	FH	On-Demand	Anodyne	CTSF	47	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515825	FH	On-Demand	Anodyne	ACE2	55	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515825	FH	On-Demand	Anodyne	FPR1	42	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515826	FH	On-Demand	Anodyne	MME	59	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515826	FH	On-Demand	Anodyne	PAPA1_CARPA	47	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515826	FH	On-Demand	Anodyne	CYSP_TRYCR	47	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515826	FH	On-Demand	Anodyne	CTSF	47	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515826	FH	On-Demand	Anodyne	ACE2	55	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515826	FH	On-Demand	Anodyne	FPR1	42	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515827	FH	On-Demand	Anodyne	MME	59	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515827	FH	On-Demand	Anodyne	PAPA1_CARPA	47	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515827	FH	On-Demand	Anodyne	CYSP_TRYCR	47	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515827	FH	On-Demand	Anodyne	CTSF	47	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515827	FH	On-Demand	Anodyne	ACE2	55	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000450515827	FH	On-Demand	Anodyne	FPR1	42	32
CC(C)c1ccoc1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515831	EG	On-Demand	Anodyne	ANPEP	54	35
CC(C)c1ccoc1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515831	EG	On-Demand	Anodyne	CPA1	51	38
CC(C)c1ccoc1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515832	EG	On-Demand	Anodyne	ANPEP	54	35
CC(C)c1ccoc1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450515832	EG	On-Demand	Anodyne	CPA1	51	38
O=C(O)CSCCNC(=O)C1(Oc2ccccc2F)CC1	ZINC000450515835	DD	On-Demand	Anodyne	CXCL8	17	41
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)Nc2ccc(O)cc2F)cc1OC	ZINC000450515836	GF	On-Demand	Anodyne	P2RX7	0	40
CCOC(=O)c1ccc(CN2CCN(c3ncnc4sccc34)CC2)nc1	ZINC000450515850	GF	On-Demand	Anodyne	P2RY12	34	41
CCOC(=O)c1ccc(CN2CCN(c3ncnc4sccc34)CC2)nc1	ZINC000450515850	GF	On-Demand	Anodyne	PDGFRB	28	45
O=C(O)CCc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1	ZINC000450515855	EG	On-Demand	Anodyne	FFAR4	50	38
CN(C)S(=O)(=O)CC(=O)Nc1ccc(CCC(=O)O)cc1	ZINC000450515859	DC	On-Demand	Anodyne	CYP2B1	0	42
CN(C)S(=O)(=O)CC(=O)Nc1ccc(CCC(=O)O)cc1	ZINC000450515859	DC	On-Demand	Anodyne	FFAR1	63	44
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450515890	GF	On-Demand	Anodyne	SIGMAR1	15	44
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450515890	GF	On-Demand	Anodyne	CCR3	52	34
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450515891	GF	On-Demand	Anodyne	SIGMAR1	15	44
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450515891	GF	On-Demand	Anodyne	CCR3	52	34
CSc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450515898	GH	On-Demand	Anodyne	COLA	74	44
CSc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450515898	GH	On-Demand	Anodyne	CPT1A	73	44
CSc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450515898	GH	On-Demand	Anodyne	GRM5	15	47
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450515899	GH	On-Demand	Anodyne	COLA	74	44
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450515899	GH	On-Demand	Anodyne	CPT1A	73	44
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450515899	GH	On-Demand	Anodyne	GRM5	15	47
COC[C@H](CNC(=O)c1ccc(C(C)(F)F)nc1)OC	ZINC000450515908	CD	On-Demand	Anodyne	EPHX2	15	40
COC[C@@H](CNC(=O)c1ccc(C(C)(F)F)nc1)OC	ZINC000450515909	CD	On-Demand	Anodyne	EPHX2	15	40
CN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000450515940	EE	On-Demand	Bother	CACNA1D	43	31
CCC(=O)CCCN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450515949	DF	On-Demand	Anodyne	SLC6A1	116	39
CCC(=O)CCCN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450515949	DF	On-Demand	Anodyne	PDE8A	0	42
CCC(=O)CCCN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450515950	DF	On-Demand	Anodyne	SLC6A1	116	39
CCC(=O)CCCN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450515950	DF	On-Demand	Anodyne	PDE8A	0	42
C[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515952	DE	On-Demand	Anodyne	ACE	0	41
C[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515952	DE	On-Demand	Anodyne	GNRHR	0	40
C[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515952	DE	On-Demand	Anodyne	SLC15A2	0	48
C[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515952	DE	On-Demand	Anodyne	LASB	0	40
C[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515952	DE	On-Demand	Anodyne	NRDE	0	41
C[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515953	DE	On-Demand	Anodyne	ACE	0	41
C[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515953	DE	On-Demand	Anodyne	GNRHR	0	40
C[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515953	DE	On-Demand	Anodyne	SLC15A2	0	48
C[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515953	DE	On-Demand	Anodyne	LASB	0	40
C[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515953	DE	On-Demand	Anodyne	NRDE	0	41
C[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515954	DE	On-Demand	Anodyne	ACE	0	41
C[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515954	DE	On-Demand	Anodyne	GNRHR	0	40
C[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515954	DE	On-Demand	Anodyne	SLC15A2	0	48
C[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515954	DE	On-Demand	Anodyne	LASB	0	40
C[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515954	DE	On-Demand	Anodyne	NRDE	0	41
C[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515955	DE	On-Demand	Anodyne	ACE	0	41
C[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515955	DE	On-Demand	Anodyne	GNRHR	0	40
C[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515955	DE	On-Demand	Anodyne	SLC15A2	0	48
C[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515955	DE	On-Demand	Anodyne	LASB	0	40
C[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C1CC1	ZINC000450515955	DE	On-Demand	Anodyne	NRDE	0	41
CCC[C@H](NC(=O)CCc1ccoc1)C(=O)O	ZINC000450515966	BD	On-Demand	Anodyne	GART	45	33
CCC[C@@H](NC(=O)CCc1ccoc1)C(=O)O	ZINC000450515967	BD	On-Demand	Anodyne	GART	45	33
C[C@@H](O)CCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515974	DE	On-Demand	Anodyne	SLC6A1	126	39
C[C@@H](O)CCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515974	DE	On-Demand	Anodyne	F10	33	51
C[C@@H](O)CCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515974	DE	On-Demand	Anodyne	BIRC2	43	38
C[C@H](O)CCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515975	DE	On-Demand	Anodyne	SLC6A1	126	39
C[C@H](O)CCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515975	DE	On-Demand	Anodyne	F10	33	51
C[C@H](O)CCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515975	DE	On-Demand	Anodyne	BIRC2	43	38
C[C@H](O)CCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515976	DE	On-Demand	Anodyne	SLC6A1	126	39
C[C@H](O)CCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515976	DE	On-Demand	Anodyne	F10	33	51
C[C@H](O)CCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515976	DE	On-Demand	Anodyne	BIRC2	43	38
C[C@@H](O)CCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515977	DE	On-Demand	Anodyne	SLC6A1	126	39
C[C@@H](O)CCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515977	DE	On-Demand	Anodyne	F10	33	51
C[C@@H](O)CCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450515977	DE	On-Demand	Anodyne	BIRC2	43	38
CCC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450515980	CE	On-Demand	Anodyne	MME	39	42
CCC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450515980	CE	On-Demand	Anodyne	TIMP3	60	35
CCC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450515980	CE	On-Demand	Anodyne	ECE1	32	40
CCC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450515980	CE	On-Demand	Anodyne	NPPA	57	38
CCC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450515981	CE	On-Demand	Anodyne	MME	39	42
CCC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450515981	CE	On-Demand	Anodyne	TIMP3	60	35
CCC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450515981	CE	On-Demand	Anodyne	ECE1	32	40
CCC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450515981	CE	On-Demand	Anodyne	NPPA	57	38
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	DRD2	17	42
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	CHRM3	15	40
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	SIGMAR1	36	49
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	CCR3	78	45
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	MLNR	43	38
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	EPHX2	27	41
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	MCHR1	23	43
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	CACNA1G	59	55
O=C(NCc1ccc(F)cc1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450515982	GH	On-Demand	Anodyne	SCD	27	42
COC[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)OC	ZINC000450515984	EE	On-Demand	Anodyne	SLC6A1	27	40
COC[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)OC	ZINC000450515984	EE	On-Demand	Anodyne	SLC6A3	18	40
N#CC1(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)CCC1	ZINC000450515990	EG	On-Demand	Mild	F10	24	46
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515995	GG	On-Demand	Anodyne	ACE	19	40
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515995	GG	On-Demand	Anodyne	MME	25	40
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515995	GG	On-Demand	Anodyne	EDNRB	48	38
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515995	GG	On-Demand	Anodyne	ECE1	50	39
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515995	GG	On-Demand	Anodyne	SLC15A2	0	41
Cc1cc2c(cc1C)[C@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515996	GG	On-Demand	Anodyne	ACE	19	40
Cc1cc2c(cc1C)[C@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515996	GG	On-Demand	Anodyne	MME	25	40
Cc1cc2c(cc1C)[C@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515996	GG	On-Demand	Anodyne	EDNRB	48	38
Cc1cc2c(cc1C)[C@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515996	GG	On-Demand	Anodyne	ECE1	50	39
Cc1cc2c(cc1C)[C@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515996	GG	On-Demand	Anodyne	SLC15A2	0	41
Cc1cc2c(cc1C)[C@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515997	GG	On-Demand	Anodyne	ACE	19	40
Cc1cc2c(cc1C)[C@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515997	GG	On-Demand	Anodyne	MME	25	40
Cc1cc2c(cc1C)[C@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515997	GG	On-Demand	Anodyne	EDNRB	48	38
Cc1cc2c(cc1C)[C@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515997	GG	On-Demand	Anodyne	ECE1	50	39
Cc1cc2c(cc1C)[C@H](C(=O)N[C@@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515997	GG	On-Demand	Anodyne	SLC15A2	0	41
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515998	GG	On-Demand	Anodyne	ACE	19	40
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515998	GG	On-Demand	Anodyne	MME	25	40
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515998	GG	On-Demand	Anodyne	EDNRB	48	38
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515998	GG	On-Demand	Anodyne	ECE1	50	39
Cc1cc2c(cc1C)[C@@H](C(=O)N[C@H](Cc1c[nH]c3cc(F)ccc13)C(=O)O)CO2	ZINC000450515998	GG	On-Demand	Anodyne	SLC15A2	0	41
CCC[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516003	DE	On-Demand	Anodyne	EPHX2	24	57
CCC[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516004	DE	On-Demand	Anodyne	EPHX2	24	57
CCOC(=O)[C@@H](CO)NC(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450516006	DC	On-Demand	Anodyne	CA14	0	40
CCOC(=O)[C@@H](CO)NC(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450516006	DC	On-Demand	Anodyne	ACR	45	32
CCOC(=O)[C@H](CO)NC(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450516007	DC	On-Demand	Anodyne	CA14	0	40
CCOC(=O)[C@H](CO)NC(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450516007	DC	On-Demand	Anodyne	ACR	45	32
CCCC[C@@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450516017	EG	On-Demand	Anodyne	NOD1	63	35
CCCC[C@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450516018	EG	On-Demand	Anodyne	NOD1	63	35
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450516022	EE	On-Demand	Anodyne	ACE	71	41
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450516022	EE	On-Demand	Anodyne	BIRC3	44	34
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450516022	EE	On-Demand	Anodyne	BIRC2	54	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450516022	EE	On-Demand	Anodyne	BIRC8	41	34
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450516023	EE	On-Demand	Anodyne	ACE	71	41
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450516023	EE	On-Demand	Anodyne	BIRC3	44	34
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450516023	EE	On-Demand	Anodyne	BIRC2	54	36
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450516023	EE	On-Demand	Anodyne	BIRC8	41	34
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450516024	EE	On-Demand	Anodyne	ACE	71	41
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450516024	EE	On-Demand	Anodyne	BIRC3	44	34
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450516024	EE	On-Demand	Anodyne	BIRC2	54	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450516024	EE	On-Demand	Anodyne	BIRC8	41	34
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450516025	EE	On-Demand	Anodyne	ACE	71	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450516025	EE	On-Demand	Anodyne	BIRC3	44	34
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450516025	EE	On-Demand	Anodyne	BIRC2	54	36
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450516025	EE	On-Demand	Anodyne	BIRC8	41	34
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	HTR1A	36	62
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	DRD2	48	59
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	DRD1	26	56
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	DRD4	32	62
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	HTR2A	50	57
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	HTR2C	34	64
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	DRD3	30	62
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	DRD5	26	62
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	ERG2	21	44
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	HTR7	49	47
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	SIGMAR1	24	58
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	CCR3	21	41
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	SLC18A3	23	55
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	HTR3B	0	56
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	PLD2	41	34
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	CYP2J2	61	43
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	WNT3A	44	31
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccc(F)cc1	ZINC000450516031	GI	On-Demand	Anodyne	AP2S1	0	44
CC(=O)c1cccc(CN2CCN(S(=O)(=O)c3cc(C)sc3C)CC2)c1	ZINC000450516039	GG	On-Demand	Anodyne	ADORA2B	44	35
O=C(O)CC[C@@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450516056	EH	On-Demand	Anodyne	DPP4	17	48
O=C(O)CC[C@H]1CCCCN1C(=O)CCCc1cc(F)ccc1F	ZINC000450516057	EH	On-Demand	Anodyne	DPP4	17	48
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	AVPR1A	0	43
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	MME	27	40
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	LTA4H	44	38
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	C3AR1	34	40
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	PAM	0	45
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	ACE2	62	40
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	NCE103	25	42
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	POLG_WNV	41	31
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	NOD1	89	43
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516065	DF	On-Demand	Anodyne	CAN2	0	42
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	AVPR1A	0	43
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	MME	27	40
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	LTA4H	44	38
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	C3AR1	34	40
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	PAM	0	45
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	ACE2	62	40
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	NCE103	25	42
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	POLG_WNV	41	31
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	NOD1	89	43
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516066	DF	On-Demand	Anodyne	CAN2	0	42
COCC1(C(=O)O)CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000450516072	ED	On-Demand	Bother	CCR5	40	39
O=C(N[C@H](CO)c1ccccc1)[C@H](O)C1CCC1	ZINC000450516075	BC	On-Demand	Anodyne	SOAT1	41	47
O=C(N[C@H](CO)c1ccccc1)[C@H](O)C1CCC1	ZINC000450516075	BC	On-Demand	Anodyne	METAP2	0	68
O=C(N[C@H](CO)c1ccccc1)[C@H](O)C1CCC1	ZINC000450516075	BC	On-Demand	Anodyne	MAST3	0	41
O=C(N[C@H](CO)c1ccccc1)[C@H](O)C1CCC1	ZINC000450516075	BC	On-Demand	Anodyne	GPR88	0	48
O=C(N[C@H](CO)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450516076	BC	On-Demand	Anodyne	SOAT1	41	47
O=C(N[C@H](CO)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450516076	BC	On-Demand	Anodyne	METAP2	0	68
O=C(N[C@H](CO)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450516076	BC	On-Demand	Anodyne	MAST3	0	41
O=C(N[C@H](CO)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450516076	BC	On-Demand	Anodyne	GPR88	0	48
CCOC(=O)[C@@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450516082	DC	On-Demand	Anodyne	MTNR1A	47	46
CCOC(=O)[C@@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450516082	DC	On-Demand	Anodyne	MTNR1B	45	46
CCOC(=O)[C@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450516083	DC	On-Demand	Anodyne	MTNR1A	47	46
CCOC(=O)[C@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450516083	DC	On-Demand	Anodyne	MTNR1B	45	46
CCOC(=O)[C@H](CO)NC(=O)CCCC(C)C	ZINC000450516089	BC	On-Demand	Anodyne	Q6UB75_PIG	0	43
CCOC(=O)[C@H](CO)NC(=O)CCCC(C)C	ZINC000450516089	BC	On-Demand	Anodyne	TLR2	0	42
CCOC(=O)[C@H](CO)NC(=O)CCCC(C)C	ZINC000450516089	BC	On-Demand	Anodyne	NOD1	105	49
CCOC(=O)[C@@H](CO)NC(=O)CCCC(C)C	ZINC000450516090	BC	On-Demand	Anodyne	Q6UB75_PIG	0	43
CCOC(=O)[C@@H](CO)NC(=O)CCCC(C)C	ZINC000450516090	BC	On-Demand	Anodyne	TLR2	0	42
CCOC(=O)[C@@H](CO)NC(=O)CCCC(C)C	ZINC000450516090	BC	On-Demand	Anodyne	NOD1	105	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000450516095	ED	On-Demand	Anodyne	OPRK1	25	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000450516095	ED	On-Demand	Anodyne	CCR5	54	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000450516096	ED	On-Demand	Anodyne	OPRK1	25	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000450516096	ED	On-Demand	Anodyne	CCR5	54	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000450516097	ED	On-Demand	Anodyne	OPRK1	25	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000450516097	ED	On-Demand	Anodyne	CCR5	54	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000450516098	ED	On-Demand	Anodyne	OPRK1	25	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000450516098	ED	On-Demand	Anodyne	CCR5	54	40
Cc1nn(-c2ccccc2)cc1CNC(=O)C(C)(C)C1CCC1	ZINC000450516099	DH	On-Demand	Anodyne	P2RX7	15	48
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	MME	63	48
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	ANPEP	64	33
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	CTSL	17	42
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	CPA1	56	41
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	MMP2	15	44
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	MMP3	24	44
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	CTSS	16	42
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	ACE2	64	38
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	AMP1_PLAFQ	31	42
CCCC[C@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516106	DG	On-Demand	Anodyne	LEF	45	40
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	MME	63	48
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	ANPEP	64	33
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	CTSL	17	42
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	CPA1	56	41
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	MMP2	15	44
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	MMP3	24	44
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	CTSS	16	42
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	ACE2	64	38
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	AMP1_PLAFQ	31	42
CCCC[C@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516107	DG	On-Demand	Anodyne	LEF	45	40
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	MME	63	48
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	ANPEP	64	33
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	CTSL	17	42
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	CPA1	56	41
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	MMP2	15	44
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	MMP3	24	44
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	CTSS	16	42
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	ACE2	64	38
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	AMP1_PLAFQ	31	42
CCCC[C@@H](C)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516108	DG	On-Demand	Anodyne	LEF	45	40
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	MME	63	48
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	ANPEP	64	33
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	CTSL	17	42
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	CPA1	56	41
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	MMP2	15	44
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	MMP3	24	44
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	CTSS	16	42
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	ACE2	64	38
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	AMP1_PLAFQ	31	42
CCCC[C@@H](C)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516109	DG	On-Demand	Anodyne	LEF	45	40
Cc1cc(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)co1	ZINC000450516126	DE	On-Demand	Anodyne	CPA1	50	41
Cc1cc(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)co1	ZINC000450516127	DE	On-Demand	Anodyne	CPA1	50	41
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	DRD2	34	52
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	DRD1	26	58
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	DRD4	26	52
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	HTR2A	36	51
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	HTR2C	28	58
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	FABI	32	40
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	PLA2G2A	0	43
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	SLC18A3	0	51
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	NET	0	54
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	AP2S1	0	52
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccc(F)cc1	ZINC000450516132	FF	On-Demand	Anodyne	SLC6A7	0	42
COc1ccc2c(c1)CCCCN2C(=O)c1cc2ccncc2s1	ZINC000450516137	EI	On-Demand	Anodyne	CYP11B1	16	40
COc1ccc2c(c1)CCCCN2C(=O)c1cc2ccncc2s1	ZINC000450516137	EI	On-Demand	Anodyne	AVPR2	18	41
COc1ccc2c(c1)CCCCN2C(=O)c1cc2ccncc2s1	ZINC000450516137	EI	On-Demand	Anodyne	CYP11B2	34	46
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	HTR1A	37	61
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	DRD2	44	61
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	DRD1	27	53
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	DRD4	31	61
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	HTR2A	35	61
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	HTR2C	18	49
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	HRH1	15	61
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	DRD3	27	61
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	HTR7	34	48
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	HTR3B	0	41
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	CYP2J2	47	34
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccc(F)cc1	ZINC000450516138	GH	On-Demand	Anodyne	AP2S1	0	48
Cc1cc(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)nc(C(F)(F)F)n1	ZINC000450516144	GF	On-Demand	Anodyne	CPA1	28	46
Cc1cc(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)nc(C(F)(F)F)n1	ZINC000450516145	GF	On-Demand	Anodyne	CPA1	28	46
CCc1ccccc1CC(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1	ZINC000450516146	EG	On-Demand	Anodyne	MME	28	46
CCc1ccccc1CC(=O)NC[C@H](C(=O)O)c1ccc(C)cc1	ZINC000450516147	EG	On-Demand	Anodyne	MME	28	46
Cc1ccc(F)c(CC(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450516148	GG	On-Demand	Anodyne	P2RX7	37	41
Cc1ccc(F)c(CC(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000450516149	GG	On-Demand	Anodyne	P2RX7	37	41
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@H]2CCCCO2)c1	ZINC000450516152	EG	On-Demand	Anodyne	DRD4	40	30
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@H]2CCCCO2)c1	ZINC000450516152	EG	On-Demand	Anodyne	GRIN2B	0	42
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@H]2CCCCO2)c1	ZINC000450516152	EG	On-Demand	Anodyne	NQO2	35	44
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450516153	EG	On-Demand	Anodyne	DRD4	40	30
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450516153	EG	On-Demand	Anodyne	GRIN2B	0	42
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450516153	EG	On-Demand	Anodyne	NQO2	35	44
COc1cc(CC(=O)NCC[C@H]2CCCCO2)ccc1Cl	ZINC000450516154	DF	On-Demand	Anodyne	TRPV1	23	42
COc1cc(CC(=O)NCC[C@H]2CCCCO2)ccc1Cl	ZINC000450516154	DF	On-Demand	Anodyne	SSTR3	0	45
COc1cc(CC(=O)NCC[C@H]2CCCCO2)ccc1Cl	ZINC000450516154	DF	On-Demand	Anodyne	NCE103	25	48
COc1cc(CC(=O)NCC[C@H]2CCCCO2)ccc1Cl	ZINC000450516154	DF	On-Demand	Anodyne	CAN2	0	48
COc1cc(CC(=O)NCC[C@@H]2CCCCO2)ccc1Cl	ZINC000450516155	DF	On-Demand	Anodyne	TRPV1	23	42
COc1cc(CC(=O)NCC[C@@H]2CCCCO2)ccc1Cl	ZINC000450516155	DF	On-Demand	Anodyne	SSTR3	0	45
COc1cc(CC(=O)NCC[C@@H]2CCCCO2)ccc1Cl	ZINC000450516155	DF	On-Demand	Anodyne	NCE103	25	48
COc1cc(CC(=O)NCC[C@@H]2CCCCO2)ccc1Cl	ZINC000450516155	DF	On-Demand	Anodyne	CAN2	0	48
N#Cc1cnc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000450516160	FE	On-Demand	Mild	MLNR	21	41
N#Cc1cnc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000450516161	FE	On-Demand	Mild	MLNR	21	41
COC1(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)CCC1	ZINC000450516162	DD	On-Demand	Anodyne	PAPA1_CARPA	15	40
COC1(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)CCC1	ZINC000450516163	DD	On-Demand	Anodyne	PAPA1_CARPA	15	40
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	DRD2	18	44
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	FABI	64	41
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	DRD3	0	40
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	TACR1	0	40
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	SSTR5	52	38
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	CCR1	34	40
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	TACR3	18	40
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	SLC9A1	15	41
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	LSS	16	52
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	MCHR1	20	42
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	MGLL	0	40
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	CCR8	45	48
COc1cc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)ccc1Cl	ZINC000450516170	FG	On-Demand	Anodyne	ABHD6	0	40
COc1ccccc1C[C@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450516182	FB	On-Demand	Anodyne	PPARD	19	40
COc1ccccc1C[C@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450516182	FB	On-Demand	Anodyne	ITGAV	21	40
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450516183	GI	On-Demand	Anodyne	AVPR2	79	49
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450516183	GI	On-Demand	Anodyne	NPY2R	17	42
COc1ccccc1C[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450516185	FB	On-Demand	Anodyne	PPARD	19	40
COc1ccccc1C[C@@H](CNC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450516185	FB	On-Demand	Anodyne	ITGAV	21	40
O=C(O)[C@H](CNC(=O)C1(Cc2ccccc2F)CC1)Cc1cccc(F)c1	ZINC000450516192	FG	On-Demand	Anodyne	MME	25	40
O=C(O)[C@H](CNC(=O)C1(Cc2ccccc2F)CC1)Cc1cccc(F)c1	ZINC000450516192	FG	On-Demand	Anodyne	CPA1	49	36
O=C(O)[C@@H](CNC(=O)C1(Cc2ccccc2F)CC1)Cc1cccc(F)c1	ZINC000450516193	FG	On-Demand	Anodyne	MME	25	40
O=C(O)[C@@H](CNC(=O)C1(Cc2ccccc2F)CC1)Cc1cccc(F)c1	ZINC000450516193	FG	On-Demand	Anodyne	CPA1	49	36
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	DRD1	15	45
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	DRD4	15	46
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	HTR2A	32	47
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	HTR2C	27	48
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	SLC6A1	150	41
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	HTR1F	55	38
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	CCR3	83	40
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	SLC18A3	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	HTR3B	0	42
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	CYP2D6	15	40
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	MCHR1	15	45
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516222	GH	On-Demand	Anodyne	CYP2J2	51	38
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	DRD1	15	45
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	DRD4	15	46
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	HTR2A	32	47
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	HTR2C	27	48
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	SLC6A1	150	41
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	HTR1F	55	38
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	CCR3	83	40
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	SLC18A3	0	41
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	HTR3B	0	42
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	CYP2D6	15	40
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	MCHR1	15	45
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450516225	GH	On-Demand	Anodyne	CYP2J2	51	38
COCCOC[C@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450516227	FD	On-Demand	Anodyne	F10	29	45
COCCOC[C@@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450516228	FD	On-Demand	Anodyne	F10	29	45
COCCOC[C@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450516229	FD	On-Demand	Anodyne	F10	29	45
COCCOC[C@@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450516230	FD	On-Demand	Anodyne	F10	29	45
COc1ccc2[nH]cc(C3=CCN(Cc4cccc(C(C)=O)c4)CC3)c2c1	ZINC000450516245	FJ	On-Demand	Anodyne	HTR1A	24	52
COc1ccc2[nH]cc(C3=CCN(Cc4cccc(C(C)=O)c4)CC3)c2c1	ZINC000450516245	FJ	On-Demand	Anodyne	DRD4	40	32
COc1ccc2[nH]cc(C3=CCN(Cc4cccc(C(C)=O)c4)CC3)c2c1	ZINC000450516245	FJ	On-Demand	Anodyne	HTR1D	26	55
COc1ccc2[nH]cc(C3=CCN(Cc4cccc(C(C)=O)c4)CC3)c2c1	ZINC000450516245	FJ	On-Demand	Anodyne	HTR1B	21	55
COc1ccc2[nH]cc(C3=CCN(Cc4cccc(C(C)=O)c4)CC3)c2c1	ZINC000450516245	FJ	On-Demand	Anodyne	SLC6A4	20	56
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	ACE	22	45
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	MME	30	48
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	EDNRA	26	40
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	CCKAR	51	39
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	BRS3	25	41
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	MMP2	20	43
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	MMP14	47	34
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	ECE1	61	43
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	MMP11	43	29
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	CCKBR	50	41
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	MMP9	19	43
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	PIN1	23	46
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	NPR	28	42
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	SLC15A2	0	53
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516254	GH	On-Demand	Anodyne	KISS1R	41	33
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	ACE	22	45
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	MME	30	48
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	EDNRA	26	40
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	CCKAR	51	39
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	BRS3	25	41
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	MMP2	20	43
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	MMP14	47	34
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	ECE1	61	43
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	MMP11	43	29
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	CCKBR	50	41
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	MMP9	19	43
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	PIN1	23	46
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	NPR	28	42
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	SLC15A2	0	53
O=C(C[C@@H]1C[C@H]1c1ccccc1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450516255	GH	On-Demand	Anodyne	KISS1R	41	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450516258	FI	On-Demand	Anodyne	CACNA1B	40	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450516258	FI	On-Demand	Anodyne	LIPG	44	32
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450516258	FI	On-Demand	Anodyne	MAP3K12	26	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450516259	FI	On-Demand	Anodyne	CACNA1B	40	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450516259	FI	On-Demand	Anodyne	LIPG	44	32
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450516259	FI	On-Demand	Anodyne	MAP3K12	26	41
CN1CCN(C(=O)c2ccc(I)cc2F)C(C)(C)C1	ZINC000450516260	GF	On-Demand	Anodyne	MAP2K1	18	42
C[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)[C@H]1CCCN(C2CCC2)C1	ZINC000450516262	FG	On-Demand	Anodyne	MMP13	0	48
C[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)[C@H]1CCCN(C2CCC2)C1	ZINC000450516263	FG	On-Demand	Anodyne	MMP13	0	48
C[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450516264	FG	On-Demand	Anodyne	MMP13	0	48
C[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450516265	FG	On-Demand	Anodyne	MMP13	0	48
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450516268	FD	On-Demand	Anodyne	CYP2D6	0	41
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450516268	FD	On-Demand	Anodyne	ABCB1	42	36
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450516269	FD	On-Demand	Anodyne	CYP2D6	0	41
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450516269	FD	On-Demand	Anodyne	ABCB1	42	36
C[C@]1(F)CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450516274	DE	On-Demand	Anodyne	EPHX2	29	48
C[C@]1(F)CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450516274	DE	On-Demand	Anodyne	CACNA1I	15	46
C[C@@]1(F)CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450516275	DE	On-Demand	Anodyne	EPHX2	29	48
C[C@@]1(F)CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450516275	DE	On-Demand	Anodyne	CACNA1I	15	46
O=C(NCc1ccc(F)cc1)C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450516276	FE	On-Demand	Anodyne	SIGMAR1	25	43
O=C(NCc1ccc(F)cc1)C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450516276	FE	On-Demand	Anodyne	CCR3	70	39
O=C(NCc1ccc(F)cc1)C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450516276	FE	On-Demand	Anodyne	MCHR1	17	43
O=C(NCc1ccc(F)cc1)C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450516276	FE	On-Demand	Anodyne	CACNA1G	48	48
COC(=O)c1cccc(CN2CCCc3c(NC(C)=O)cccc32)c1Cl	ZINC000450516283	FI	On-Demand	Anodyne	KCNQ2	53	35
O=C(Cc1ccc(Cl)c(F)c1)N[C@H](CC1CC1)C(=O)O	ZINC000450516284	CE	On-Demand	Anodyne	AVPR1A	25	40
O=C(Cc1ccc(Cl)c(F)c1)N[C@H](CC1CC1)C(=O)O	ZINC000450516284	CE	On-Demand	Anodyne	CDC25B	0	40
O=C(Cc1ccc(Cl)c(F)c1)N[C@H](CC1CC1)C(=O)O	ZINC000450516284	CE	On-Demand	Anodyne	ENV	41	32
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H](CC1CC1)C(=O)O	ZINC000450516285	CE	On-Demand	Anodyne	AVPR1A	25	40
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H](CC1CC1)C(=O)O	ZINC000450516285	CE	On-Demand	Anodyne	CDC25B	0	40
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H](CC1CC1)C(=O)O	ZINC000450516285	CE	On-Demand	Anodyne	ENV	41	32
COc1ccccc1C[C@H](CNC(=O)C1(C)CC1)C(=O)O	ZINC000450516286	CD	On-Demand	Anodyne	PPARA	18	42
COc1ccccc1C[C@H](CNC(=O)C1(C)CC1)C(=O)O	ZINC000450516286	CD	On-Demand	Anodyne	MME	25	40
COc1ccccc1C[C@H](CNC(=O)C1(C)CC1)C(=O)O	ZINC000450516286	CD	On-Demand	Anodyne	PPARD	24	43
COc1ccccc1C[C@@H](CNC(=O)C1(C)CC1)C(=O)O	ZINC000450516287	CD	On-Demand	Anodyne	PPARA	18	42
COc1ccccc1C[C@@H](CNC(=O)C1(C)CC1)C(=O)O	ZINC000450516287	CD	On-Demand	Anodyne	MME	25	40
COc1ccccc1C[C@@H](CNC(=O)C1(C)CC1)C(=O)O	ZINC000450516287	CD	On-Demand	Anodyne	PPARD	24	43
Cc1nc(C)n(CCCC(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)n1	ZINC000450516289	GI	On-Demand	Anodyne	PPAF_PHAVU	0	40
Cc1nc(C)n(CCCC(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)n1	ZINC000450516290	GI	On-Demand	Anodyne	PPAF_PHAVU	0	40
O=C1CN(CCNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCN1	ZINC000450516296	GD	On-Demand	Anodyne	PLD1	69	45
O=C1CN(CCNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCN1	ZINC000450516296	GD	On-Demand	Anodyne	PLD2	91	45
CCCOc1ccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)c(OC)c1	ZINC000450516297	GH	On-Demand	Anodyne	OXTR	30	40
CCCOc1ccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)c(OC)c1	ZINC000450516297	GH	On-Demand	Anodyne	FPR2	26	40
CCCOc1ccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)c(OC)c1	ZINC000450516298	GH	On-Demand	Anodyne	OXTR	30	40
CCCOc1ccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)c(OC)c1	ZINC000450516298	GH	On-Demand	Anodyne	FPR2	26	40
Cc1nn(-c2ccccc2)cc1CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450516301	GG	On-Demand	Anodyne	P2RX7	26	50
Cc1nn(-c2ccccc2)cc1CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450516302	GG	On-Demand	Anodyne	P2RX7	26	50
Cc1cnc(CCCC(=O)NCc2cn(-c3ccccc3)nc2C)o1	ZINC000450516327	EG	On-Demand	Anodyne	P2RX7	24	51
COc1cc(CN2CCN(Cc3c(C)noc3C)CC2)ccc1Cl	ZINC000450516328	EG	On-Demand	Anodyne	SSTR5	48	38
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	AVPR1A	17	40
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	MME	42	56
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	CMA1	17	42
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	PTGER3	40	39
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	NAALAD2	31	42
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	PAM	0	40
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	CCKBR	38	44
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	CPA3	0	41
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	Q6UB75_PIG	0	41
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516335	FH	On-Demand	Anodyne	FFAR4	51	39
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	AVPR1A	17	40
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	MME	42	56
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	CMA1	17	42
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	PTGER3	40	39
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	NAALAD2	31	42
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	PAM	0	40
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	CCKBR	38	44
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	CPA3	0	41
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	Q6UB75_PIG	0	41
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516336	FH	On-Demand	Anodyne	FFAR4	51	39
Cc1nn(-c2ccccc2)cc1CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450516338	GH	On-Demand	Anodyne	P2RX7	18	51
Cc1nc(C)n(CCCC(=O)NCc2cn(-c3ccccc3)nc2C)n1	ZINC000450516353	FE	On-Demand	Anodyne	P2RX7	23	50
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450516366	FF	On-Demand	Anodyne	OPRK1	0	41
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450516366	FF	On-Demand	Anodyne	CCR2	22	42
CC[C@H](CC(F)(F)F)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450516367	FF	On-Demand	Anodyne	OPRK1	0	41
CC[C@H](CC(F)(F)F)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450516367	FF	On-Demand	Anodyne	CCR2	22	42
CC[C@H](CC(F)(F)F)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450516368	FF	On-Demand	Anodyne	OPRK1	0	41
CC[C@H](CC(F)(F)F)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450516368	FF	On-Demand	Anodyne	CCR2	22	42
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450516369	FF	On-Demand	Anodyne	OPRK1	0	41
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450516369	FF	On-Demand	Anodyne	CCR2	22	42
COc1cc(Cl)c(C(=O)N(CCc2ccccc2)CC(=O)O)cc1OC	ZINC000450516370	GG	On-Demand	Anodyne	SLC6A9	29	42
COc1cc(Cl)c(C(=O)N(CCc2ccccc2)CC(=O)O)cc1OC	ZINC000450516370	GG	On-Demand	Anodyne	HCRTR2	19	41
CCC[C@H](O)CN(C1CC1)[C@@H]1CCc2ccccc21	ZINC000450516376	CG	On-Demand	Anodyne	HTR1A	15	42
CCC[C@@H](O)CN(C1CC1)[C@@H]1CCc2ccccc21	ZINC000450516377	CG	On-Demand	Anodyne	HTR1A	15	42
CCC[C@H](O)CN(C1CC1)[C@H]1CCc2ccccc21	ZINC000450516378	CG	On-Demand	Anodyne	HTR1A	15	42
CCC[C@@H](O)CN(C1CC1)[C@H]1CCc2ccccc21	ZINC000450516379	CG	On-Demand	Anodyne	HTR1A	15	42
O=C(NC1CCCCC1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450516387	FH	On-Demand	Anodyne	EPHX2	24	44
O=C(NC1CCCCC1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450516388	FH	On-Demand	Anodyne	EPHX2	24	44
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CHRM2	24	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CHRM1	25	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	ACE	52	39
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	DRD2	15	48
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	FKBP1A	40	37
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	DRD4	26	46
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	ACHE	15	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	DRD3	22	48
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	OPRK1	0	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CHRM3	33	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	MME	44	39
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	LTA4H	23	44
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CNR2	17	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	PGC	49	32
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	SIGMAR1	42	46
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CTSB	24	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CYSP_TRYCR	35	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CACNA1B	23	43
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	TIMP3	38	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	C3AR1	41	38
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	SLC6A5	35	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	EPHX2	45	44
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	MCHR1	27	45
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CACNA1G	15	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	CCR8	20	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	BIRC2	47	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	SLC12A5	48	37
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	DERP1	0	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	ADIPOR1	0	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516389	FG	On-Demand	Anodyne	ADIPOR2	0	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CHRM2	24	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CHRM1	25	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	ACE	52	39
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	DRD2	15	48
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	FKBP1A	40	37
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	DRD4	26	46
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	ACHE	15	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	DRD3	22	48
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	OPRK1	0	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CHRM3	33	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	MME	44	39
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	LTA4H	23	44
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CNR2	17	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	PGC	49	32
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	SIGMAR1	42	46
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CTSB	24	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CYSP_TRYCR	35	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CACNA1B	23	43
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	TIMP3	38	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	C3AR1	41	38
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	SLC6A5	35	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	EPHX2	45	44
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	MCHR1	27	45
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CACNA1G	15	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	CCR8	20	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	BIRC2	47	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	SLC12A5	48	37
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	DERP1	0	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	ADIPOR1	0	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450516390	FG	On-Demand	Anodyne	ADIPOR2	0	41
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccccc1	ZINC000450516410	FG	On-Demand	Anodyne	HTR1A	51	46
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccccc1	ZINC000450516410	FG	On-Demand	Anodyne	DRD2	49	49
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccccc1	ZINC000450516410	FG	On-Demand	Anodyne	DRD1	23	41
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccccc1	ZINC000450516410	FG	On-Demand	Anodyne	DRD4	32	42
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccccc1	ZINC000450516410	FG	On-Demand	Anodyne	HTR2A	29	49
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccccc1	ZINC000450516410	FG	On-Demand	Anodyne	DRD3	32	49
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccccc1	ZINC000450516410	FG	On-Demand	Anodyne	HTR7	57	46
O=C(CCCN1CCN(c2ncnc3sccc23)CC1)c1ccccc1	ZINC000450516410	FG	On-Demand	Anodyne	CYP2J2	54	39
CCOc1cc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)on1	ZINC000450516415	FE	On-Demand	Anodyne	SSTR5	49	42
CCOc1cc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)on1	ZINC000450516415	FE	On-Demand	Anodyne	PDK1	40	34
CCOc1cc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)on1	ZINC000450516416	FE	On-Demand	Anodyne	SSTR5	49	42
CCOc1cc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)on1	ZINC000450516416	FE	On-Demand	Anodyne	PDK1	40	34
N#CC1(CN2CCN(C(=O)c3ccccn3)CC2)CCC1	ZINC000450516434	CD	On-Demand	Mild	CCR8	15	42
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450516439	CF	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450516439	CF	On-Demand	Anodyne	MTNR1A	27	44
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450516439	CF	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450516439	CF	On-Demand	Anodyne	CHRNA10	23	43
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450516439	CF	On-Demand	Anodyne	RORC	41	38
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450516440	CF	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450516440	CF	On-Demand	Anodyne	MTNR1A	27	44
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450516440	CF	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450516440	CF	On-Demand	Anodyne	CHRNA10	23	43
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450516440	CF	On-Demand	Anodyne	RORC	41	38
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@H](C)C2)c1	ZINC000450516441	CF	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@H](C)C2)c1	ZINC000450516441	CF	On-Demand	Anodyne	MTNR1A	27	44
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@H](C)C2)c1	ZINC000450516441	CF	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@H](C)C2)c1	ZINC000450516441	CF	On-Demand	Anodyne	CHRNA10	23	43
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@H](C)C2)c1	ZINC000450516441	CF	On-Demand	Anodyne	RORC	41	38
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450516442	CF	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450516442	CF	On-Demand	Anodyne	MTNR1A	27	44
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450516442	CF	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450516442	CF	On-Demand	Anodyne	CHRNA10	23	43
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450516442	CF	On-Demand	Anodyne	RORC	41	38
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	F2	0	51
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	DRD2	26	46
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	DRD4	60	46
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	ACHE	25	45
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	HRH1	27	47
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	DRD3	27	46
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	HTR3A	0	46
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	AVPR1B	43	36
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	KCNH2	21	43
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	HTR4	74	42
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	F10	62	41
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	HRH3	15	42
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	SIGMAR1	31	48
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	SSTR5	89	47
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	CCR3	45	44
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	UTS2R	27	40
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	CXCR3	41	46
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	MCHR1	55	47
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	STK17B	40	35
COc1cc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1Cl	ZINC000450516443	GI	On-Demand	Anodyne	CACNA1G	37	46
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	ACE	34	53
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	GNRHR	0	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MME	55	51
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	EDNRB	43	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	EDNRA	33	43
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	TACR1	37	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MC4R	36	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	CCKAR	65	41
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MPO	63	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	BRS3	27	42
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MC3R	54	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MC5R	56	34
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MMP2	26	44
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MMP8	32	42
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MMP14	72	39
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	GRPR	62	34
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	ECE1	72	51
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	LNPEP	25	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	SSTR3	25	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MMP11	64	34
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	CCKBR	54	43
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MMP9	24	45
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	ACE2	50	34
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MC1R	77	40
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	PIN1	24	41
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	MMP1	20	41
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	FPR1	19	42
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	NPR	32	48
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	HDA106	0	45
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	SLC15A2	0	53
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	KISS1R	75	39
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	ERAP2	44	41
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	ERAP1	0	41
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	LASB	0	41
C[C@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516450	GI	On-Demand	Anodyne	NRDE	0	44
Cc1csc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450516451	FH	On-Demand	Anodyne	COLA	58	44
Cc1csc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450516451	FH	On-Demand	Anodyne	CPT1A	49	44
Cc1csc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450516451	FH	On-Demand	Anodyne	GRM5	0	43
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	ACE	34	53
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	GNRHR	0	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MME	55	51
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	EDNRB	43	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	EDNRA	33	43
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	TACR1	37	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MC4R	36	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	CCKAR	65	41
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MPO	63	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	BRS3	27	42
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MC3R	54	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MC5R	56	34
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MMP2	26	44
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MMP8	32	42
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MMP14	72	39
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	GRPR	62	34
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	ECE1	72	51
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	LNPEP	25	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	SSTR3	25	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MMP11	64	34
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	CCKBR	54	43
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MMP9	24	45
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	ACE2	50	34
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MC1R	77	40
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	PIN1	24	41
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	MMP1	20	41
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	FPR1	19	42
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	NPR	32	48
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	HDA106	0	45
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	SLC15A2	0	53
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	KISS1R	75	39
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	ERAP2	44	41
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	ERAP1	0	41
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	LASB	0	41
C[C@@H](CCC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516452	GI	On-Demand	Anodyne	NRDE	0	44
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	ACE	34	53
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	GNRHR	0	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MME	55	51
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	EDNRB	43	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	EDNRA	33	43
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	TACR1	37	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MC4R	36	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	CCKAR	65	41
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MPO	63	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	BRS3	27	42
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MC3R	54	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MC5R	56	34
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MMP2	26	44
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MMP8	32	42
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MMP14	72	39
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	GRPR	62	34
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	ECE1	72	51
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	LNPEP	25	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	SSTR3	25	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MMP11	64	34
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	CCKBR	54	43
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MMP9	24	45
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	ACE2	50	34
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MC1R	77	40
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	PIN1	24	41
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	MMP1	20	41
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	FPR1	19	42
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	NPR	32	48
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	HDA106	0	45
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	SLC15A2	0	53
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	KISS1R	75	39
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	ERAP2	44	41
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	ERAP1	0	41
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	LASB	0	41
C[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516453	GI	On-Demand	Anodyne	NRDE	0	44
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	ACE	34	53
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	GNRHR	0	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MME	55	51
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	EDNRB	43	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	EDNRA	33	43
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	TACR1	37	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MC4R	36	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	CCKAR	65	41
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MPO	63	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	BRS3	27	42
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MC3R	54	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MC5R	56	34
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MMP2	26	44
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MMP8	32	42
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MMP14	72	39
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	GRPR	62	34
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	ECE1	72	51
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	LNPEP	25	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	SSTR3	25	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MMP11	64	34
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	CCKBR	54	43
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MMP9	24	45
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	ACE2	50	34
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MC1R	77	40
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	PIN1	24	41
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	MMP1	20	41
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	FPR1	19	42
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	NPR	32	48
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	HDA106	0	45
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	SLC15A2	0	53
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	KISS1R	75	39
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	ERAP2	44	41
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	ERAP1	0	41
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	LASB	0	41
C[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1ccccc1	ZINC000450516454	GI	On-Demand	Anodyne	NRDE	0	44
Cc1csc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450516455	FH	On-Demand	Anodyne	COLA	58	44
Cc1csc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450516455	FH	On-Demand	Anodyne	CPT1A	49	44
Cc1csc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450516455	FH	On-Demand	Anodyne	GRM5	0	43
O=C(N[C@@H](c1cccc2ccccc12)C(F)(F)F)c1cc2n(n1)CCC2	ZINC000450516456	FI	On-Demand	Anodyne	KCNJ11	91	35
O=C(N[C@H](c1cccc2ccccc12)C(F)(F)F)c1cc2n(n1)CCC2	ZINC000450516458	FI	On-Demand	Anodyne	KCNJ11	91	35
O=C(c1ccc(O)cc1)N1CCN(CC2=CCCCC2)CC1	ZINC000450516469	DF	On-Demand	Anodyne	FABI	59	39
O=C(c1ccc(O)cc1)N1CCN(CC2=CCCCC2)CC1	ZINC000450516469	DF	On-Demand	Anodyne	L3MBTL1	0	42
O=C(c1ccc(O)cc1)N1CCN(CC2=CCCCC2)CC1	ZINC000450516469	DF	On-Demand	Anodyne	L3MBTL3	48	42
O=C(c1ccc(O)cc1)N1CCN(CC2=CCCCC2)CC1	ZINC000450516469	DF	On-Demand	Anodyne	MBTD1	0	42
O=C(C[C@@H]1C[C@H]1c1ccccc1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516471	FG	On-Demand	Anodyne	MME	20	41
O=C(C[C@@H]1C[C@H]1c1ccccc1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516471	FG	On-Demand	Anodyne	CPA1	41	34
O=C(C[C@@H]1C[C@H]1c1ccccc1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516474	FG	On-Demand	Anodyne	MME	20	41
O=C(C[C@@H]1C[C@H]1c1ccccc1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516474	FG	On-Demand	Anodyne	CPA1	41	34
O=C(N[C@H]1CCCc2cc(F)ccc21)c1ccc(N2CCC2)nc1	ZINC000450516501	EG	On-Demand	Anodyne	BDKRB1	30	53
O=C(N[C@H]1CCCc2cc(F)ccc21)c1ccc(N2CCC2)nc1	ZINC000450516501	EG	On-Demand	Anodyne	HPGDS	30	47
O=C(N[C@@H]1CCCc2cc(F)ccc21)c1ccc(N2CCC2)nc1	ZINC000450516502	EG	On-Demand	Anodyne	BDKRB1	30	53
O=C(N[C@@H]1CCCc2cc(F)ccc21)c1ccc(N2CCC2)nc1	ZINC000450516502	EG	On-Demand	Anodyne	HPGDS	30	47
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1Cl	ZINC000450516516	GF	On-Demand	Anodyne	FABI	63	38
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1Cl	ZINC000450516516	GF	On-Demand	Anodyne	CHRM3	18	40
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1Cl	ZINC000450516516	GF	On-Demand	Anodyne	BDKRB1	17	41
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1Cl	ZINC000450516516	GF	On-Demand	Anodyne	FAAH	19	41
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1Cl	ZINC000450516516	GF	On-Demand	Anodyne	MCHR1	18	41
COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1Cl	ZINC000450516516	GF	On-Demand	Anodyne	CCR8	23	40
Cc1ccc2c(C3=CCN(CC4CCC(=O)CC4)CC3)c[nH]c2c1	ZINC000450516535	DI	On-Demand	Anodyne	HTR1A	0	43
Cc1ccc2c(C3=CCN(CC4CCC(=O)CC4)CC3)c[nH]c2c1	ZINC000450516535	DI	On-Demand	Anodyne	SLC6A4	17	51
CCc1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516549	EF	On-Demand	Anodyne	MME	64	46
CCc1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516549	EF	On-Demand	Anodyne	CPA1	74	42
CCc1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516549	EF	On-Demand	Anodyne	PPARD	23	40
CCc1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516549	EF	On-Demand	Anodyne	ACE2	44	35
CCc1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516549	EF	On-Demand	Anodyne	LAP3	43	34
CCc1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516549	EF	On-Demand	Anodyne	AMP1_PLAFQ	49	34
CCc1ccccc1CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516549	EF	On-Demand	Anodyne	PDS	33	40
CCc1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516550	EF	On-Demand	Anodyne	MME	64	46
CCc1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516550	EF	On-Demand	Anodyne	CPA1	74	42
CCc1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516550	EF	On-Demand	Anodyne	PPARD	23	40
CCc1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516550	EF	On-Demand	Anodyne	ACE2	44	35
CCc1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516550	EF	On-Demand	Anodyne	LAP3	43	34
CCc1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516550	EF	On-Demand	Anodyne	AMP1_PLAFQ	49	34
CCc1ccccc1CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516550	EF	On-Demand	Anodyne	PDS	33	40
Cc1ccc2c(C3=CCN(Cc4nnc(C5CC5)s4)CC3)c[nH]c2c1	ZINC000450516579	FI	On-Demand	Anodyne	SLC6A4	0	43
CN1CCN(C(=O)c2cccc3c2CCCC3)C(C)(C)C1	ZINC000450516599	CF	On-Demand	Anodyne	FABP4	43	36
COCCOC[C@H](O)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450516601	FD	On-Demand	Anodyne	ABCB1	68	37
COCCOC[C@H](O)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450516601	FD	On-Demand	Anodyne	HSP90AB1	42	44
COCCOC[C@@H](O)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450516602	FD	On-Demand	Anodyne	ABCB1	68	37
COCCOC[C@@H](O)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450516602	FD	On-Demand	Anodyne	HSP90AB1	42	44
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	HTR1A	16	51
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	DRD2	32	46
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	DRD1	26	53
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	DRD4	22	46
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	HTR2A	25	54
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	HTR2C	19	51
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	DRD3	16	54
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	ERG2	21	46
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	SIGMAR1	15	51
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	SLC18A3	0	47
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	HTR3B	0	44
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	CYP2J2	54	41
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	NET	0	48
Cc1noc(C)c1CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450516615	FG	On-Demand	Anodyne	AP2S1	0	46
O=C(O)Cc1ccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450516623	GI	On-Demand	Anodyne	EPHX2	26	40
COc1ccc(C(=O)N[C@H]2CC[C@@H](C(=O)O)C2)c(OC2CCCC2)c1	ZINC000450516634	EF	On-Demand	Anodyne	PDE4A	25	42
COc1ccc(C(=O)N[C@@H]2CC[C@H](C(=O)O)C2)c(OC2CCCC2)c1	ZINC000450516635	EF	On-Demand	Anodyne	PDE4A	25	42
COc1cccc(Oc2ccc(C(=O)NC(CO)CO)nc2)c1	ZINC000450516642	DC	On-Demand	Anodyne	ACACA	44	40
COc1cccc(Oc2ccc(C(=O)NC(CO)CO)nc2)c1	ZINC000450516642	DC	On-Demand	Anodyne	ACACB	22	44
COc1cccc(Oc2ccc(C(=O)NC(CO)CO)nc2)c1	ZINC000450516642	DC	On-Demand	Anodyne	RAF1	22	40
COc1cccc(Oc2ccc(C(=O)NC(CO)CO)nc2)c1	ZINC000450516642	DC	On-Demand	Anodyne	MTNR1A	33	41
COc1cccc(Oc2ccc(C(=O)NC(CO)CO)nc2)c1	ZINC000450516642	DC	On-Demand	Anodyne	MTNR1B	39	47
COc1cccc(Oc2ccc(C(=O)NC(CO)CO)nc2)c1	ZINC000450516642	DC	On-Demand	Anodyne	Q8MMZ8_EIMTE	28	40
O=C(O)C1(CNC(=O)C2(Oc3ccccc3F)CC2)CCCCC1	ZINC000450516643	EF	On-Demand	Anodyne	HCN1	54	33
O=C(O)C1(CNC(=O)C2(Oc3ccccc3F)CC2)CCCCC1	ZINC000450516643	EF	On-Demand	Anodyne	HCN4	51	33
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	CHRM2	17	43
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	DRD4	23	45
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	ACHE	15	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	DRD3	0	64
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	CHRM3	32	43
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	SIGMAR1	30	44
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	CCKAR	29	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	CCR3	51	47
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	TIMP3	57	35
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	EPHX2	53	50
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	CXCR3	22	42
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	MCHR1	27	44
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	CCR8	17	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516649	FH	On-Demand	Anodyne	BIRC2	40	35
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	CHRM2	17	43
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	DRD4	23	45
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	ACHE	15	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	DRD3	0	64
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	CHRM3	32	43
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	SIGMAR1	30	44
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	CCKAR	29	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	CCR3	51	47
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	TIMP3	57	35
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	EPHX2	53	50
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	CXCR3	22	42
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	MCHR1	27	44
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	CCR8	17	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450516650	FH	On-Demand	Anodyne	BIRC2	40	35
C[C@H](Cc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1)C(=O)O	ZINC000450516655	FI	On-Demand	Anodyne	MME	18	40
C[C@H](Cc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1)C(=O)O	ZINC000450516655	FI	On-Demand	Anodyne	SLC1A2	40	36
C[C@@H](Cc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1)C(=O)O	ZINC000450516656	FI	On-Demand	Anodyne	MME	18	40
C[C@@H](Cc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1)C(=O)O	ZINC000450516656	FI	On-Demand	Anodyne	SLC1A2	40	36
CCOC(=O)[C@@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450516660	DD	On-Demand	Anodyne	PIN1	23	42
CCOC(=O)[C@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450516661	DD	On-Demand	Anodyne	PIN1	23	42
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450516683	GG	On-Demand	Anodyne	HRAS	49	32
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450516684	GG	On-Demand	Anodyne	HRAS	49	32
Cn1cc(-c2ccc(C(=O)NCc3ccccc3CN3CCC[C@H]3CO)o2)cn1	ZINC000450516691	GF	On-Demand	Anodyne	MMP13	0	43
Cn1cc(-c2ccc(C(=O)NCc3ccccc3CN3CCC[C@@H]3CO)o2)cn1	ZINC000450516692	GF	On-Demand	Anodyne	MMP13	0	43
CC(=O)c1ccc(CN2CCN(S(=O)(=O)c3cc(C)sc3C)CC2)cc1	ZINC000450516698	GG	On-Demand	Anodyne	ADORA2B	43	36
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	ACE	29	43
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	GNRHR	0	42
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	MME	51	56
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	EDNRB	54	40
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	EDNRA	34	42
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	BMP1	26	41
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	CCKAR	44	38
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	BRS3	22	42
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	MC3R	44	36
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	MMP2	22	41
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	MMP8	32	41
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	MMP14	75	37
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	GRPR	69	39
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	ECE1	72	57
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	LNPEP	25	42
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	MMP11	61	35
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	CCKBR	41	38
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	ACE2	64	38
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	MMP1	0	42
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	NPR	33	51
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	MAGI3	0	40
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	SLC15A2	0	48
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	KISS1R	62	37
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	ERAP2	44	42
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	ERAP1	0	42
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	LASB	0	41
CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516704	EG	On-Demand	Anodyne	NRDE	0	42
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	ACE	29	43
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	GNRHR	0	42
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	MME	51	56
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	EDNRB	54	40
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	EDNRA	34	42
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	BMP1	26	41
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	CCKAR	44	38
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	BRS3	22	42
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	MC3R	44	36
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	MMP2	22	41
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	MMP8	32	41
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	MMP14	75	37
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	GRPR	69	39
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	ECE1	72	57
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	LNPEP	25	42
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	MMP11	61	35
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	CCKBR	41	38
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	ACE2	64	38
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	MMP1	0	42
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	NPR	33	51
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	MAGI3	0	40
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	SLC15A2	0	48
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	KISS1R	62	37
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	ERAP2	44	42
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	ERAP1	0	42
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	LASB	0	41
CCC[C@@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516705	EG	On-Demand	Anodyne	NRDE	0	42
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	ACE	29	43
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	GNRHR	0	42
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	MME	51	56
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	EDNRB	54	40
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	EDNRA	34	42
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	BMP1	26	41
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	CCKAR	44	38
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	BRS3	22	42
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	MC3R	44	36
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	MMP2	22	41
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	MMP8	32	41
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	MMP14	75	37
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	GRPR	69	39
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	ECE1	72	57
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	LNPEP	25	42
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	MMP11	61	35
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	CCKBR	41	38
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	ACE2	64	38
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	MMP1	0	42
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	NPR	33	51
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	MAGI3	0	40
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	SLC15A2	0	48
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	KISS1R	62	37
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	ERAP2	44	42
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	ERAP1	0	42
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	LASB	0	41
CCC[C@H](C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516706	EG	On-Demand	Anodyne	NRDE	0	42
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	ACE	29	43
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	MME	51	56
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	EDNRB	54	40
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	EDNRA	34	42
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	BMP1	26	41
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	CCKAR	44	38
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	BRS3	22	42
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	MC3R	44	36
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	MMP2	22	41
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	MMP8	32	41
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	MMP14	75	37
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	GRPR	69	39
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	ECE1	72	57
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	LNPEP	25	42
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	MMP11	61	35
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	CCKBR	41	38
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	ACE2	64	38
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	MMP1	0	42
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	NPR	33	51
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	MAGI3	0	40
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	SLC15A2	0	48
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	KISS1R	62	37
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	ERAP2	44	42
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	ERAP1	0	42
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	LASB	0	41
CCC[C@H](C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(C)C	ZINC000450516707	EG	On-Demand	Anodyne	NRDE	0	42
COc1ccc(-c2ccnc(N3C[C@@H](C)[C@H](C(N)=O)C3)n2)cc1	ZINC000450516709	DD	On-Demand	Anodyne	SORD	40	31
CC(C)(CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516718	CE	On-Demand	Anodyne	P2RX7	42	36
CC(C)(CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516718	CE	On-Demand	Anodyne	PTGES2	55	32
CC(C)(CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450516718	CE	On-Demand	Anodyne	NCE103	28	42
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)CC1	ZINC000450516724	FE	On-Demand	Anodyne	F2	15	40
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)CC1	ZINC000450516724	FE	On-Demand	Anodyne	F10	51	35
Cc1ccc(Br)cc1CC(=O)NCCN1CCNC(=O)C1	ZINC000450516725	FC	On-Demand	Anodyne	PLD2	40	38
COC(=O)c1csc(CN2CCN(c3ncnc4sccc34)CC2)n1	ZINC000450516736	GE	On-Demand	Anodyne	PDGFRB	48	35
Cn1nc(-c2ccccc2)cc1C(=O)NCC[C@@H]1CCCCO1	ZINC000450516738	DF	On-Demand	Anodyne	INHA	49	39
Cn1nc(-c2ccccc2)cc1C(=O)NCC[C@@H]1CCCCO1	ZINC000450516738	DF	On-Demand	Anodyne	COLA	57	37
Cn1nc(-c2ccccc2)cc1C(=O)NCC[C@@H]1CCCCO1	ZINC000450516738	DF	On-Demand	Anodyne	CPT1A	45	36
Cn1nc(-c2ccccc2)cc1C(=O)NCC[C@H]1CCCCO1	ZINC000450516740	DF	On-Demand	Anodyne	INHA	49	39
Cn1nc(-c2ccccc2)cc1C(=O)NCC[C@H]1CCCCO1	ZINC000450516740	DF	On-Demand	Anodyne	COLA	57	37
Cn1nc(-c2ccccc2)cc1C(=O)NCC[C@H]1CCCCO1	ZINC000450516740	DF	On-Demand	Anodyne	CPT1A	45	36
COc1ccc(C(=O)NCCSCC(=O)O)c(OC2CCCC2)c1	ZINC000450516748	FF	On-Demand	Anodyne	MTNR1A	46	34
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCN3CCNC(=O)C3)cc2)c1	ZINC000450516753	GD	On-Demand	Anodyne	DRD4	47	39
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCN3CCNC(=O)C3)cc2)c1	ZINC000450516753	GD	On-Demand	Anodyne	CHRM3	19	54
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCN3CCNC(=O)C3)cc2)c1	ZINC000450516753	GD	On-Demand	Anodyne	MMP13	16	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCN3CCNC(=O)C3)cc2)c1	ZINC000450516753	GD	On-Demand	Anodyne	PLD1	71	40
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCN3CCNC(=O)C3)cc2)c1	ZINC000450516753	GD	On-Demand	Anodyne	PLD2	96	40
CCOC(=O)c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)nc1	ZINC000450516756	FD	On-Demand	Anodyne	P2RY12	45	43
CCOC(=O)c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)nc1	ZINC000450516756	FD	On-Demand	Anodyne	CCR8	29	43
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)nc1	ZINC000450516759	GF	On-Demand	Anodyne	SSTR5	47	41
CCOc1cc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)on1	ZINC000450516760	GF	On-Demand	Anodyne	ALOX5AP	42	33
CCOc1cc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)on1	ZINC000450516760	GF	On-Demand	Anodyne	COLA	85	47
CCOc1cc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)on1	ZINC000450516760	GF	On-Demand	Anodyne	CPT1A	83	47
CCOc1cc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)on1	ZINC000450516762	GF	On-Demand	Anodyne	ALOX5AP	42	33
CCOc1cc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)on1	ZINC000450516762	GF	On-Demand	Anodyne	COLA	85	47
CCOc1cc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)on1	ZINC000450516762	GF	On-Demand	Anodyne	CPT1A	83	47
COC[C@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516776	DE	On-Demand	Anodyne	PFK	0	40
COC[C@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516776	DE	On-Demand	Anodyne	CAN2	0	42
Cc1cc(F)c(CC(=O)Nc2cccnc2OCC(F)F)cc1F	ZINC000450516777	EG	On-Demand	Anodyne	P2RY1	38	42
COC[C@@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516778	DE	On-Demand	Anodyne	PFK	0	40
COC[C@@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516778	DE	On-Demand	Anodyne	CAN2	0	42
CC(C)(COCc1ccccc1)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516782	GG	On-Demand	Anodyne	MME	40	42
CC(C)(COCc1ccccc1)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516782	GG	On-Demand	Anodyne	PAPA1_CARPA	23	42
CC(C)(COCc1ccccc1)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516782	GG	On-Demand	Anodyne	CPA1	51	50
CC(C)(COCc1ccccc1)C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516782	GG	On-Demand	Anodyne	POL	0	41
CC(C)(COCc1ccccc1)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516784	GG	On-Demand	Anodyne	MME	40	42
CC(C)(COCc1ccccc1)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516784	GG	On-Demand	Anodyne	PAPA1_CARPA	23	42
CC(C)(COCc1ccccc1)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516784	GG	On-Demand	Anodyne	CPA1	51	50
CC(C)(COCc1ccccc1)C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450516784	GG	On-Demand	Anodyne	POL	0	41
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1	ZINC000450516790	GC	On-Demand	Anodyne	ACE	43	43
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1	ZINC000450516790	GC	On-Demand	Anodyne	PREP	42	46
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1	ZINC000450516790	GC	On-Demand	Anodyne	WNT3	44	34
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516791	FH	On-Demand	Anodyne	HTR2A	17	44
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516791	FH	On-Demand	Anodyne	HTR2C	19	43
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516791	FH	On-Demand	Anodyne	SLC6A1	138	46
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516791	FH	On-Demand	Anodyne	PDE8A	0	44
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516791	FH	On-Demand	Anodyne	PDE8B	40	32
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516791	FH	On-Demand	Anodyne	CYP2J2	56	41
Cc1cccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516791	FH	On-Demand	Anodyne	GPBAR1	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516792	FH	On-Demand	Anodyne	HTR2A	17	44
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516792	FH	On-Demand	Anodyne	HTR2C	19	43
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516792	FH	On-Demand	Anodyne	SLC6A1	138	46
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516792	FH	On-Demand	Anodyne	PDE8A	0	44
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516792	FH	On-Demand	Anodyne	PDE8B	40	32
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516792	FH	On-Demand	Anodyne	CYP2J2	56	41
Cc1cccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450516792	FH	On-Demand	Anodyne	GPBAR1	0	41
CC[C@H](O)CC(=O)N[C@H](C)c1cccc(F)c1F	ZINC000450516793	CE	On-Demand	Anodyne	CES2	21	45
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1	ZINC000450516794	GC	On-Demand	Anodyne	ACE	43	43
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1	ZINC000450516794	GC	On-Demand	Anodyne	PREP	42	46
CN(C)S(=O)(=O)CC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1	ZINC000450516794	GC	On-Demand	Anodyne	WNT3	44	34
CC[C@@H](O)CC(=O)N[C@@H](C)c1cccc(F)c1F	ZINC000450516795	CE	On-Demand	Anodyne	CES2	21	45
CC[C@H](O)CC(=O)N[C@@H](C)c1cccc(F)c1F	ZINC000450516797	CE	On-Demand	Anodyne	CES2	21	45
CC[C@@H](O)CC(=O)N[C@H](C)c1cccc(F)c1F	ZINC000450516799	CE	On-Demand	Anodyne	CES2	21	45
O=C(Cc1ccccc1O[C@H]1CCOC1)NCCN1CCNC(=O)C1	ZINC000450516801	EB	On-Demand	Anodyne	PLD1	53	32
O=C(Cc1ccccc1O[C@H]1CCOC1)NCCN1CCNC(=O)C1	ZINC000450516801	EB	On-Demand	Anodyne	PLD2	62	32
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCCN1CCNC(=O)C1	ZINC000450516802	EB	On-Demand	Anodyne	PLD1	53	32
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCCN1CCNC(=O)C1	ZINC000450516802	EB	On-Demand	Anodyne	PLD2	62	32
CC(C)(C)OCC[C@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450516803	FG	On-Demand	Anodyne	NOD1	67	36
CC(C)(C)OCC[C@@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450516804	FG	On-Demand	Anodyne	NOD1	67	36
C[C@@H](CCC(=O)O)NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450516805	CE	On-Demand	Anodyne	P2RY12	53	33
C[C@H](CCC(=O)O)NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450516807	CE	On-Demand	Anodyne	P2RY12	53	33
COC(=O)c1csc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)n1	ZINC000450516808	GE	On-Demand	Anodyne	FAAH	18	40
Cc1nc2ccnn2cc1C(=O)NCC[C@H]1CCCCO1	ZINC000450516813	CD	On-Demand	Anodyne	DDR1	57	46
Cc1nc2ccnn2cc1C(=O)NCC[C@@H]1CCCCO1	ZINC000450516814	CD	On-Demand	Anodyne	DDR1	57	46
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	ACE	19	46
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	MME	24	43
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	MPO	57	38
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	MMP14	53	35
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	ECE1	56	42
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	MMP11	44	31
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	GHSR	44	38
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	NPR	29	43
CC(C)(CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516815	FG	On-Demand	Anodyne	SLC15A2	0	50
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	ACE	19	46
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	MME	24	43
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	MPO	57	38
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	MMP14	53	35
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	ECE1	56	42
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	MMP11	44	31
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	GHSR	44	38
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	NPR	29	43
CC(C)(CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)C(F)(F)F	ZINC000450516821	FG	On-Demand	Anodyne	SLC15A2	0	50
C[C@]1(O)CCCN(C(=O)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000450516823	FC	On-Demand	Bother	COLA	65	32
C[C@@]1(O)CCCN(C(=O)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000450516824	FC	On-Demand	Bother	COLA	65	32
O=C(CCCN1CCC[C@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516826	DH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1CCC[C@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516826	DH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516826	DH	On-Demand	Anodyne	HTR2A	21	46
O=C(CCCN1CCC[C@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516826	DH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCC[C@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516826	DH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCC[C@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516826	DH	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCC[C@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516826	DH	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCC[C@@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516828	DH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1CCC[C@@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516828	DH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516828	DH	On-Demand	Anodyne	HTR2A	21	46
O=C(CCCN1CCC[C@@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516828	DH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCC[C@@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516828	DH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCC[C@@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516828	DH	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCC[C@@H]1c1ccc[nH]1)c1ccc(F)cc1	ZINC000450516828	DH	On-Demand	Anodyne	CYP2J2	49	35
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@@H](C)c3ccccc3)C2)n1	ZINC000450516830	FG	On-Demand	Anodyne	SLC6A1	93	42
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@@H](C)c3ccccc3)C2)n1	ZINC000450516830	FG	On-Demand	Anodyne	PDE8A	0	45
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@@H](C)c3ccccc3)C2)n1	ZINC000450516830	FG	On-Demand	Anodyne	BIRC8	40	31
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@H](C)c3ccccc3)C2)n1	ZINC000450516831	FG	On-Demand	Anodyne	SLC6A1	93	42
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@H](C)c3ccccc3)C2)n1	ZINC000450516831	FG	On-Demand	Anodyne	PDE8A	0	45
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@H](C)c3ccccc3)C2)n1	ZINC000450516831	FG	On-Demand	Anodyne	BIRC8	40	31
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@H](C)c3ccccc3)C2)n1	ZINC000450516833	FG	On-Demand	Anodyne	SLC6A1	93	42
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@H](C)c3ccccc3)C2)n1	ZINC000450516833	FG	On-Demand	Anodyne	PDE8A	0	45
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@H](C)c3ccccc3)C2)n1	ZINC000450516833	FG	On-Demand	Anodyne	BIRC8	40	31
O=C(O)[C@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1cccc(F)c1	ZINC000450516834	EE	On-Demand	Anodyne	CPA1	23	47
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@@H](C)c3ccccc3)C2)n1	ZINC000450516835	FG	On-Demand	Anodyne	SLC6A1	93	42
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@@H](C)c3ccccc3)C2)n1	ZINC000450516835	FG	On-Demand	Anodyne	PDE8A	0	45
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@@H](C)c3ccccc3)C2)n1	ZINC000450516835	FG	On-Demand	Anodyne	BIRC8	40	31
O=C(O)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1cccc(F)c1	ZINC000450516836	EE	On-Demand	Anodyne	CPA1	23	47
COC[C@H](CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)OC	ZINC000450516841	ED	On-Demand	Anodyne	PDE8B	53	36
COc1ccc2c(c1)CCCCN2C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450516846	DH	On-Demand	Anodyne	SRD5A1	23	40
COC[C@H](CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)OC	ZINC000450516848	ED	On-Demand	Anodyne	PDE8B	53	36
COC[C@@H](CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)OC	ZINC000450516850	ED	On-Demand	Anodyne	PDE8B	53	36
O=C(Nc1cccnc1OCC(F)F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450516851	GG	On-Demand	Anodyne	P2RY1	26	44
COC[C@@H](CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)OC	ZINC000450516852	ED	On-Demand	Anodyne	PDE8B	53	36
CCOC(=O)c1ccc(CN(CC)c2ccccc2)nc1	ZINC000450516863	CG	On-Demand	Anodyne	P2RY12	20	41
N#CC1(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)CCC1	ZINC000450516873	EG	On-Demand	Mild	SLC6A1	42	33
N#CC1(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)CCC1	ZINC000450516873	EG	On-Demand	Mild	F10	19	43
N#CC1(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)CCC1	ZINC000450516876	EG	On-Demand	Mild	SLC6A1	42	33
N#CC1(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)CCC1	ZINC000450516876	EG	On-Demand	Mild	F10	19	43
O=C(O)CSCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450516884	DD	On-Demand	Anodyne	NCE103	28	45
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516901	FH	On-Demand	Anodyne	C3AR1	43	36
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516901	FH	On-Demand	Anodyne	PREP	62	43
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516901	FH	On-Demand	Anodyne	GPBAR1	0	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516901	FH	On-Demand	Anodyne	BIRC2	43	37
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516901	FH	On-Demand	Anodyne	CES1D	51	29
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516902	FH	On-Demand	Anodyne	C3AR1	43	36
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516902	FH	On-Demand	Anodyne	PREP	62	43
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516902	FH	On-Demand	Anodyne	GPBAR1	0	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516902	FH	On-Demand	Anodyne	BIRC2	43	37
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450516902	FH	On-Demand	Anodyne	CES1D	51	29
O=C(NC1CCCCC1)NC1CCN(CC2CC(F)(F)C2)CC1	ZINC000450516930	EG	On-Demand	Anodyne	EPHX2	28	45
O=C(NC1CCCCC1)NC1CCN(CC2CC(F)(F)C2)CC1	ZINC000450516930	EG	On-Demand	Anodyne	P95276_MYCTO	0	40
O=C(Cc1ccc(O)c(F)c1)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450516934	FD	On-Demand	Anodyne	CAN2	0	40
O=C(Cc1ccc(O)c(F)c1)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450516935	FD	On-Demand	Anodyne	CAN2	0	40
Cc1nc(NC[C@@H]2CCCN(C)[C@H]2c2ccnn2C)ncc1[N+](=O)[O-]	ZINC000450516941	ED	On-Demand	Bother	PRKCQ	47	37
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(CO)CO)cc2)c1	ZINC000450516944	ED	On-Demand	Anodyne	CTSV	33	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(CO)CO)cc2)c1	ZINC000450516944	ED	On-Demand	Anodyne	PIN1	29	48
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(CO)CO)cc2)c1	ZINC000450516944	ED	On-Demand	Anodyne	E1	0	47
O=C(NC(CO)CO)c1cccc2c1CCCC2	ZINC000450516972	BC	On-Demand	Anodyne	FABP4	43	33
COc1cccc(C(=O)NCC2(C(=O)O)CCCCC2)c1[N+](=O)[O-]	ZINC000450516982	EE	On-Demand	Bother	KCNA3	45	44
COc1cccc(C(=O)NCC2(C(=O)O)CCCCC2)c1[N+](=O)[O-]	ZINC000450516982	EE	On-Demand	Bother	HCN1	72	47
COc1cccc(C(=O)NCC2(C(=O)O)CCCCC2)c1[N+](=O)[O-]	ZINC000450516982	EE	On-Demand	Bother	HCN4	61	45
O=C(c1cccc(C(F)(F)F)n1)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450516991	GD	On-Demand	Anodyne	SFRP1	103	41
O=C(c1cccc(C(F)(F)F)n1)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450516991	GD	On-Demand	Anodyne	WNT3	78	34
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2ccc3nncn3n2)C1	ZINC000450516995	FE	On-Demand	Anodyne	PREP	47	39
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2ccc3nncn3n2)C1	ZINC000450516996	FE	On-Demand	Anodyne	PREP	47	39
CCOC(=O)c1cc(C(=O)N[C@@H]2CN(c3ccccc3)C2=O)on1	ZINC000450516997	EC	On-Demand	Anodyne	P2RY12	46	33
CCOC(=O)c1cc(C(=O)N[C@H]2CN(c3ccccc3)C2=O)on1	ZINC000450516998	EC	On-Demand	Anodyne	P2RY12	46	33
CCOC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)nc1	ZINC000450516999	GG	On-Demand	Anodyne	SSTR5	40	38
CCOC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)nc1	ZINC000450516999	GG	On-Demand	Anodyne	NOD1	21	42
CCOC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)nc1	ZINC000450516999	GG	On-Demand	Anodyne	NOD2	41	42
COCC1(C(=O)O)CCN(C(=O)c2ccccc2Oc2cccc(C)c2)CC1	ZINC000450517000	GH	On-Demand	Anodyne	CCR8	46	40
CC(C)(C)[C@@H](NCC1(C#N)CCC1)c1ccc(F)cc1	ZINC000450517009	CI	On-Demand	Mild	CTSS	15	41
CC(C)(C)[C@H](NCC1(C#N)CCC1)c1ccc(F)cc1	ZINC000450517011	CI	On-Demand	Mild	CTSS	15	41
COC[C@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517012	FE	On-Demand	Anodyne	DRD2	17	42
COC[C@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517012	FE	On-Demand	Anodyne	DRD3	29	42
COC[C@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517012	FE	On-Demand	Anodyne	CPT1A	44	31
COC[C@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517012	FE	On-Demand	Anodyne	PLK1	49	34
COC[C@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517012	FE	On-Demand	Anodyne	HPGD	43	55
COC[C@@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517014	FE	On-Demand	Anodyne	DRD2	17	42
COC[C@@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517014	FE	On-Demand	Anodyne	DRD3	29	42
COC[C@@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517014	FE	On-Demand	Anodyne	CPT1A	44	31
COC[C@@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517014	FE	On-Demand	Anodyne	PLK1	49	34
COC[C@@H](CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)OC	ZINC000450517014	FE	On-Demand	Anodyne	HPGD	43	55
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(C#N)n1C	ZINC000450517027	DF	On-Demand	Mild	AVPR2	24	42
COc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)c(OC2CCCC2)c1	ZINC000450517054	EF	On-Demand	Anodyne	PDE4A	24	42
COc1ccc2c(c1)CCCCN2C(=O)c1cc(C)cs1	ZINC000450517059	DI	On-Demand	Anodyne	SRD5A1	15	40
COc1ccc2c(c1)CCCCN2C(=O)c1cc(C)cs1	ZINC000450517059	DI	On-Demand	Anodyne	AVPR2	31	42
COc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)c(OC2CCCC2)c1	ZINC000450517060	EF	On-Demand	Anodyne	PDE4A	24	42
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450517075	CD	On-Demand	Anodyne	RBP4	50	33
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450517076	CD	On-Demand	Anodyne	RBP4	50	33
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)Nc1ccc([N+](=O)[O-])nc1	ZINC000450517079	EF	On-Demand	Bother	NPR	28	41
Cc1cccc(Cl)c1C(=O)N1CCC(CCCN(C)C)CC1	ZINC000450517080	DH	On-Demand	Anodyne	CCR5	37	45
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)Nc1ccc([N+](=O)[O-])nc1	ZINC000450517088	EF	On-Demand	Bother	NPR	28	41
COC(=O)[C@H](Cc1ccccc1)[C@H](C)Nc1ccc([N+](=O)[O-])nc1	ZINC000450517090	EF	On-Demand	Bother	NPR	28	41
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)Nc1ccc([N+](=O)[O-])nc1	ZINC000450517092	EF	On-Demand	Bother	NPR	28	41
Cc1ccc2[nH]c(C(=O)N(C)CC(=O)N3CCC[C@H](C(=O)O)C3)c(C)c2c1	ZINC000450517097	FE	On-Demand	Anodyne	SLC6A1	64	34
Cc1ccc2[nH]c(C(=O)N(C)CC(=O)N3CCC[C@@H](C(=O)O)C3)c(C)c2c1	ZINC000450517098	FE	On-Demand	Anodyne	SLC6A1	64	34
CCC(CC)(CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450517100	DG	On-Demand	Anodyne	NCE103	27	40
CCC(CC)(CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450517100	DG	On-Demand	Anodyne	P96878_MYCTU	18	40
CCC(CC)(CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450517100	DG	On-Demand	Anodyne	CAN2	0	40
C[C@]1(C(=O)Nc2ccc(-c3ncco3)cc2)CC=CCC1	ZINC000450517103	CI	On-Demand	Anodyne	LTA4H	16	40
COc1cc(CC(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1O	ZINC000450517104	GE	On-Demand	Anodyne	SIGMAR1	15	43
COc1cc(CC(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1O	ZINC000450517104	GE	On-Demand	Anodyne	SSTR5	42	38
COc1cc(CC(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1O	ZINC000450517104	GE	On-Demand	Anodyne	CCR3	50	40
COc1cc(CC(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1O	ZINC000450517104	GE	On-Demand	Anodyne	MCHR1	18	40
C[C@@]1(C(=O)Nc2ccc(-c3ncco3)cc2)CC=CCC1	ZINC000450517105	CI	On-Demand	Anodyne	LTA4H	16	40
COc1cc(CC(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1O	ZINC000450517106	GE	On-Demand	Anodyne	SIGMAR1	15	43
COc1cc(CC(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1O	ZINC000450517106	GE	On-Demand	Anodyne	SSTR5	42	38
COc1cc(CC(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1O	ZINC000450517106	GE	On-Demand	Anodyne	CCR3	50	40
COc1cc(CC(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1O	ZINC000450517106	GE	On-Demand	Anodyne	MCHR1	18	40
O=C(Nc1ccc(Cl)cn1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450517107	EG	On-Demand	Anodyne	F10	36	52
O=C(Nc1ccc(Cl)cn1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450517107	EG	On-Demand	Anodyne	NPY5R	18	44
COc1ccc2[nH]cc(C3=CCN([C@H](C)c4csnn4)CC3)c2c1	ZINC000450517109	EH	On-Demand	Anodyne	HTR1A	0	49
COc1ccc2[nH]cc(C3=CCN([C@H](C)c4csnn4)CC3)c2c1	ZINC000450517109	EH	On-Demand	Anodyne	SLC6A4	0	59
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450517111	DG	On-Demand	Anodyne	P2RX7	16	46
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	DRD2	15	40
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	DRD4	37	42
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	ACHE	16	43
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	SIGMAR1	33	50
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	LSS	20	44
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	FAAH	0	48
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	MGLL	0	42
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	KCNJ1	41	33
CC(=O)c1ccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1	ZINC000450517115	FG	On-Demand	Anodyne	GPR183	0	40
COc1ccc2[nH]cc(C3=CCN([C@@H](C)c4csnn4)CC3)c2c1	ZINC000450517117	EH	On-Demand	Anodyne	HTR1A	0	49
COc1ccc2[nH]cc(C3=CCN([C@@H](C)c4csnn4)CC3)c2c1	ZINC000450517117	EH	On-Demand	Anodyne	SLC6A4	0	59
COC[C@H](CNC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1)OC	ZINC000450517118	FF	On-Demand	Anodyne	GCK	15	43
COC[C@@H](CNC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1)OC	ZINC000450517120	FF	On-Demand	Anodyne	GCK	15	43
COc1ccccc1C[C@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450517123	GE	On-Demand	Bother	PPARA	15	41
COc1ccccc1C[C@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450517123	GE	On-Demand	Bother	KCNA3	40	45
COc1ccccc1C[C@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450517123	GE	On-Demand	Bother	PPARD	20	40
COc1ccccc1C[C@@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450517126	GE	On-Demand	Bother	PPARA	15	41
COc1ccccc1C[C@@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450517126	GE	On-Demand	Bother	KCNA3	40	45
COc1ccccc1C[C@@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450517126	GE	On-Demand	Bother	PPARD	20	40
Cc1ccc(NC(=O)C2CCN(CC/C=C\c3ccccc3)CC2)nc1	ZINC000450517128	EI	On-Demand	Anodyne	SLC6A1	49	34
Cc1ccc(NC(=O)C2CCN(CC/C=C/c3ccccc3)CC2)nc1	ZINC000450517134	EI	On-Demand	Anodyne	SLC6A1	49	34
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	CHRM1	15	44
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	DRD4	17	59
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	CHRM3	28	44
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	SIGMAR1	23	40
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	CCR3	47	48
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	EPHX2	59	46
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	CXCR3	24	41
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	MCHR1	19	40
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450517137	FI	On-Demand	Anodyne	ACAT	0	43
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	CHRM1	15	44
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	DRD4	17	59
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	CHRM3	28	44
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	SIGMAR1	23	40
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	CCR3	47	48
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	EPHX2	59	46
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	CXCR3	24	41
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	MCHR1	19	40
O=C(Nc1ccccc1)NC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450517138	FI	On-Demand	Anodyne	ACAT	0	43
CCCOc1cccc(CC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517153	FG	On-Demand	Anodyne	PPARG	19	48
CCCOc1cccc(CC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517153	FG	On-Demand	Anodyne	PLA2G4B	21	41
CCCOc1cccc(CC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517153	FG	On-Demand	Anodyne	TSPAN17	0	40
CCCOc1cccc(CC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517153	FG	On-Demand	Anodyne	PTGES	0	43
CCCOc1cccc(CC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517153	FG	On-Demand	Anodyne	PDS	69	43
CCCOc1cccc(CC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517155	FG	On-Demand	Anodyne	PPARG	19	48
CCCOc1cccc(CC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517155	FG	On-Demand	Anodyne	PLA2G4B	21	41
CCCOc1cccc(CC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517155	FG	On-Demand	Anodyne	TSPAN17	0	40
CCCOc1cccc(CC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517155	FG	On-Demand	Anodyne	PTGES	0	43
CCCOc1cccc(CC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1	ZINC000450517155	FG	On-Demand	Anodyne	PDS	69	43
C[C@@H]1CCO[C@@H]1C(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450517162	EH	On-Demand	Anodyne	KCNJ11	65	39
C[C@@H]1CCO[C@@H]1C(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450517165	EH	On-Demand	Anodyne	KCNJ11	65	39
CCn1nnc(C)c1C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450517170	DE	On-Demand	Anodyne	P2RX7	17	50
C[C@@]1(NC(=O)Cc2ccc(Cl)c(F)c2)CCCC[C@@H]1C(=O)O	ZINC000450517171	EG	On-Demand	Anodyne	ENV	45	34
C[C@]1(NC(=O)Cc2ccc(Cl)c(F)c2)CCCC[C@@H]1C(=O)O	ZINC000450517172	EG	On-Demand	Anodyne	ENV	45	34
C[C@@]1(NC(=O)Cc2ccc(Cl)c(F)c2)CCCC[C@H]1C(=O)O	ZINC000450517173	EG	On-Demand	Anodyne	ENV	45	34
C[C@]1(NC(=O)Cc2ccc(Cl)c(F)c2)CCCC[C@H]1C(=O)O	ZINC000450517175	EG	On-Demand	Anodyne	ENV	45	34
CCC[C@@H](NC(=O)C[C@@H](C)SC)C(=O)O	ZINC000450517188	BD	On-Demand	Anodyne	NOD1	97	46
N#Cc1nc(-c2ccco2)oc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450517194	GH	On-Demand	Mild	HTR1A	18	43
N#Cc1nc(-c2ccco2)oc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450517194	GH	On-Demand	Mild	DRD4	19	40
N#Cc1nc(-c2ccco2)oc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450517194	GH	On-Demand	Mild	DRD3	15	41
N#Cc1nc(-c2ccco2)oc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450517194	GH	On-Demand	Mild	HTR7	24	42
N#Cc1nc(-c2ccco2)oc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450517194	GH	On-Demand	Mild	CYP2J2	55	39
Cc1ccc([C@@H](CNC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)O)cc1	ZINC000450517195	EG	On-Demand	Anodyne	SLC6A11	0	43
Cc1ccc([C@@H](CNC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)O)cc1	ZINC000450517195	EG	On-Demand	Anodyne	SLC6A12	0	43
CCC[C@@H](NC(=O)C[C@H](C)SC)C(=O)O	ZINC000450517197	BD	On-Demand	Anodyne	NOD1	97	46
CCC[C@H](NC(=O)C[C@@H](C)SC)C(=O)O	ZINC000450517198	BD	On-Demand	Anodyne	NOD1	97	46
CCC[C@H](NC(=O)C[C@H](C)SC)C(=O)O	ZINC000450517199	BD	On-Demand	Anodyne	NOD1	97	46
Cc1ccc([C@H](CNC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)O)cc1	ZINC000450517200	EG	On-Demand	Anodyne	SLC6A11	0	43
Cc1ccc([C@H](CNC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)O)cc1	ZINC000450517200	EG	On-Demand	Anodyne	SLC6A12	0	43
Cc1ccc([C@H](CNC(=O)[C@H](c2ccccc2)C2CC2)C(=O)O)cc1	ZINC000450517202	EG	On-Demand	Anodyne	SLC6A11	0	43
Cc1ccc([C@H](CNC(=O)[C@H](c2ccccc2)C2CC2)C(=O)O)cc1	ZINC000450517202	EG	On-Demand	Anodyne	SLC6A12	0	43
Cc1ccc([C@@H](CNC(=O)[C@H](c2ccccc2)C2CC2)C(=O)O)cc1	ZINC000450517205	EG	On-Demand	Anodyne	SLC6A11	0	43
Cc1ccc([C@@H](CNC(=O)[C@H](c2ccccc2)C2CC2)C(=O)O)cc1	ZINC000450517205	EG	On-Demand	Anodyne	SLC6A12	0	43
COc1cccc(C(=O)NCC(C)(C)C(=O)O)c1[N+](=O)[O-]	ZINC000450517209	CD	On-Demand	Bother	ECR	15	40
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	HTR1A	24	40
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	DRD2	31	40
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	DRD4	53	38
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	HRH1	22	41
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	DRD3	28	42
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	OPRK1	0	41
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	TACR1	25	44
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	SSTR5	69	41
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	CCR3	37	40
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	TACR3	24	44
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	GRM4	38	44
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	FAAH	27	42
COc1cc(CN2CCN(C(=O)c3ccccn3)CC2)ccc1Cl	ZINC000450517212	EF	On-Demand	Anodyne	CCR8	58	52
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450517226	DD	On-Demand	Anodyne	SCN9A	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450517226	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	24	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450517227	DD	On-Demand	Anodyne	SCN9A	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450517227	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	24	42
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450517228	DD	On-Demand	Anodyne	SCN9A	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450517228	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	24	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450517229	DD	On-Demand	Anodyne	SCN9A	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450517229	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	24	42
CCOC(=O)c1cc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)on1	ZINC000450517231	FE	On-Demand	Anodyne	P2RY12	41	32
CCOC(=O)c1cc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)on1	ZINC000450517237	FE	On-Demand	Anodyne	P2RY12	41	32
COC[C@@H](CNC(=O)c1ccc(C(F)(F)F)cc1C)OC	ZINC000450517251	DE	On-Demand	Anodyne	MTTP	56	33
CCCc1cc(C(=O)NCc2cn(-c3ccccc3)nc2C)no1	ZINC000450517255	DG	On-Demand	Anodyne	P2RX7	22	50
COC[C@H](CNC(=O)c1ccc(C(F)(F)F)cc1C)OC	ZINC000450517256	DE	On-Demand	Anodyne	MTTP	56	33
Cc1ccc(F)c(CC(=O)NCCN2CCNC(=O)C2)c1	ZINC000450517257	CC	On-Demand	Anodyne	PLD1	49	40
Cc1ccc(F)c(CC(=O)NCCN2CCNC(=O)C2)c1	ZINC000450517257	CC	On-Demand	Anodyne	PLD2	73	36
COc1ccc2[nH]cc(C3=CCN(CC[C@@H](C)O)CC3)c2c1	ZINC000450517261	DG	On-Demand	Anodyne	HTR1A	19	56
COc1ccc2[nH]cc(C3=CCN(CC[C@@H](C)O)CC3)c2c1	ZINC000450517261	DG	On-Demand	Anodyne	HTR1D	23	58
COc1ccc2[nH]cc(C3=CCN(CC[C@@H](C)O)CC3)c2c1	ZINC000450517261	DG	On-Demand	Anodyne	HTR1B	18	45
COc1ccc2[nH]cc(C3=CCN(CC[C@@H](C)O)CC3)c2c1	ZINC000450517261	DG	On-Demand	Anodyne	SLC6A4	17	59
COc1ccc2[nH]cc(C3=CCN(CC[C@H](C)O)CC3)c2c1	ZINC000450517262	DG	On-Demand	Anodyne	HTR1A	19	56
COc1ccc2[nH]cc(C3=CCN(CC[C@H](C)O)CC3)c2c1	ZINC000450517262	DG	On-Demand	Anodyne	HTR1D	23	58
COc1ccc2[nH]cc(C3=CCN(CC[C@H](C)O)CC3)c2c1	ZINC000450517262	DG	On-Demand	Anodyne	HTR1B	18	45
COc1ccc2[nH]cc(C3=CCN(CC[C@H](C)O)CC3)c2c1	ZINC000450517262	DG	On-Demand	Anodyne	SLC6A4	17	59
Cc1ccc(NC(=O)C2CCN(C[C@H]3CCC(F)(F)C3)CC2)nc1	ZINC000450517275	EG	On-Demand	Anodyne	NPY5R	29	42
Cc1ccc(NC(=O)C2CCN(C[C@@H]3CCC(F)(F)C3)CC2)nc1	ZINC000450517276	EG	On-Demand	Anodyne	NPY5R	29	42
CCC(CC)(CNC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450517278	DE	On-Demand	Bother	KCNK3	42	36
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450517285	EC	On-Demand	Anodyne	CTRB_BOVIN	47	35
CCOC(=O)[C@H](CO)NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450517286	EC	On-Demand	Anodyne	CTRB_BOVIN	47	35
O=C(CSC1CC1)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450517299	CD	On-Demand	Anodyne	LUXR	43	35
O=C(CSC1CC1)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450517299	CD	On-Demand	Anodyne	TRAR	45	36
O=C(CSC1CC1)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450517300	CD	On-Demand	Anodyne	LUXR	43	35
O=C(CSC1CC1)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450517300	CD	On-Demand	Anodyne	TRAR	45	36
COCC1(C(=O)O)CCN(C(=O)Cc2ccc(C)c(Br)c2)CC1	ZINC000450517302	GF	On-Demand	Anodyne	GPR183	0	42
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CHRM2	19	47
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	DRD2	44	55
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	FKBP1A	25	42
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CNR1	21	41
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	DRD4	71	55
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	ACHE	44	55
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	HRH2	29	49
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	HRH1	27	55
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	DRD3	27	55
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	HTR3A	0	47
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	AVPR1B	41	33
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	ABCC8	19	42
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	KCNH2	21	55
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	HTR4	83	55
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CHRM3	23	47
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CNR2	20	41
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	HRH3	22	41
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	SIGMAR1	57	61
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	SSTR5	102	55
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CCR1	33	42
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CCR3	67	54
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CCR5	20	48
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	BDKRB1	41	39
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	UTS2R	37	49
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	MLNR	29	40
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CCR2	22	40
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	SLC6A5	37	43
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	EPHX2	52	44
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	PDK1	54	42
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CXCR3	50	43
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	MCHR1	71	58
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CACNA1G	37	45
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	CCR8	31	51
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	ADIPOR1	0	42
COc1cc(CN2CCC(NC(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450517304	GH	On-Demand	Anodyne	ADIPOR2	0	42
O=C(C1CCN(Cc2ccccc2OC2CC2)CC1)N1CCc2ccccc21	ZINC000450517314	GI	On-Demand	Anodyne	DRD4	17	40
CCN(Cc1ccnc(OC)n1)c1cccc(Cl)c1	ZINC000450517319	CG	On-Demand	Anodyne	TAAR1	16	56
COc1cc(Cl)c(C(=O)N(C)Cc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450517320	GG	On-Demand	Anodyne	HSP90AB1	40	42
COc1cc(Cl)c(C(=O)N(C)Cc2ccc(OCC(=O)O)cc2)cc1OC	ZINC000450517320	GG	On-Demand	Anodyne	MT-ND1	25	43
CO[C@@H]1COCC[C@@H]1CC(=O)N1Cc2cc(Br)ccc2C[C@@H]1C	ZINC000450517329	GG	On-Demand	Anodyne	CCR2	24	44
CO[C@@H]1COCC[C@H]1CC(=O)N1Cc2cc(Br)ccc2C[C@H]1C	ZINC000450517330	GG	On-Demand	Anodyne	CCR2	24	44
CO[C@@H]1COCC[C@H]1CC(=O)N1Cc2cc(Br)ccc2C[C@@H]1C	ZINC000450517331	GG	On-Demand	Anodyne	CCR2	24	44
CO[C@@H]1COCC[C@@H]1CC(=O)N1Cc2cc(Br)ccc2C[C@H]1C	ZINC000450517332	GG	On-Demand	Anodyne	CCR2	24	44
C[C@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517336	FH	On-Demand	Anodyne	MME	62	37
C[C@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517336	FH	On-Demand	Anodyne	TIMP3	68	40
C[C@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517336	FH	On-Demand	Anodyne	ECE1	40	36
C[C@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517336	FH	On-Demand	Anodyne	NPY5R	21	42
C[C@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517336	FH	On-Demand	Anodyne	ACE2	58	34
C[C@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517336	FH	On-Demand	Anodyne	FPR1	46	37
C[C@@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517337	FH	On-Demand	Anodyne	MME	62	37
C[C@@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517337	FH	On-Demand	Anodyne	TIMP3	68	40
C[C@@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517337	FH	On-Demand	Anodyne	ECE1	40	36
C[C@@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517337	FH	On-Demand	Anodyne	NPY5R	21	42
C[C@@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517337	FH	On-Demand	Anodyne	ACE2	58	34
C[C@@H](Cc1ccc(NC(=O)C2(Oc3ccccc3F)CC2)cc1)C(=O)O	ZINC000450517337	FH	On-Demand	Anodyne	FPR1	46	37
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HTR1A	21	65
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	DRD2	42	64
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	DRD1	26	51
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	DRD4	36	54
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HRH2	16	43
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HTR2A	47	64
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HTR2C	29	64
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HRH1	18	54
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	ADRA1B	18	45
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	DRD3	21	54
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	KCNH2	17	40
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HTR4	15	40
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	DRD5	15	47
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	ERG2	22	48
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HTR7	26	48
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HRH3	23	41
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	SIGMAR1	42	58
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	CCR3	79	59
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	CHRNA7	18	41
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	SLC18A3	15	47
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	HTR3B	0	51
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	SLC6A5	31	40
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	EPHX2	54	47
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	MCHR1	29	47
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	CACNA1G	35	42
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	CYP2J2	60	43
O=C(NC1CCCCC1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450517349	GH	On-Demand	Anodyne	AP2S1	0	48
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450517356	DC	On-Demand	Anodyne	CTRB_BOVIN	46	34
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450517357	DC	On-Demand	Anodyne	CTRB_BOVIN	46	34
O=C(NC(CO)CO)c1cc2ccc(Br)cc2s1	ZINC000450517360	ED	On-Demand	Anodyne	AKT1	54	33
O=C(NC(CO)CO)c1cc2ccc(Br)cc2s1	ZINC000450517360	ED	On-Demand	Anodyne	PIN1	31	51
O=C(NCc1ccc(F)cc1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450517363	EF	On-Demand	Anodyne	CACNA1G	43	43
O=C(NCc1ccc(F)cc1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450517364	EF	On-Demand	Anodyne	CACNA1G	43	43
O=C(O)c1cccc(CCNC(=O)C2(Oc3ccccc3F)CC2)c1	ZINC000450517369	EF	On-Demand	Anodyne	AKR1C3	23	40
O=C(O)c1cccc(CCNC(=O)C2(Oc3ccccc3F)CC2)c1	ZINC000450517369	EF	On-Demand	Anodyne	KDM4E	23	45
CO[C@@H]1COCC[C@@H]1CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450517379	EE	On-Demand	Anodyne	P2RX7	19	46
CO[C@@H]1COCC[C@H]1CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450517382	EE	On-Demand	Anodyne	P2RX7	19	46
CO[C@H]1COCC[C@@H]1CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450517383	EE	On-Demand	Anodyne	P2RX7	19	46
CO[C@H]1COCC[C@H]1CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450517384	EE	On-Demand	Anodyne	P2RX7	19	46
CCC[C@H](NC(=O)C(CC)(CC)c1ccc(OC)c(OC)c1)C(=O)O	ZINC000450517387	FG	On-Demand	Anodyne	NOD1	62	33
CCC[C@@H](NC(=O)C(CC)(CC)c1ccc(OC)c(OC)c1)C(=O)O	ZINC000450517388	FG	On-Demand	Anodyne	NOD1	62	33
CO[C@H](Cc1ccccc1)CN1CCCc2c(NC(C)=O)cccc21	ZINC000450517395	EH	On-Demand	Anodyne	KCNQ2	69	38
CO[C@@H](Cc1ccccc1)CN1CCCc2c(NC(C)=O)cccc21	ZINC000450517396	EH	On-Demand	Anodyne	KCNQ2	69	38
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450517397	GG	On-Demand	Anodyne	CCR3	51	42
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450517397	GG	On-Demand	Anodyne	CACNA1G	51	45
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450517398	GG	On-Demand	Anodyne	CCR3	51	42
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450517398	GG	On-Demand	Anodyne	CACNA1G	51	45
CCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450517400	CF	On-Demand	Anodyne	TYMS	53	36
CCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450517400	CF	On-Demand	Anodyne	PIN1	28	40
CCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450517400	CF	On-Demand	Anodyne	NOD1	45	33
CCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450517402	CF	On-Demand	Anodyne	TYMS	53	36
CCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450517402	CF	On-Demand	Anodyne	PIN1	28	40
CCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450517402	CF	On-Demand	Anodyne	NOD1	45	33
COc1cc(C)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517421	GF	On-Demand	Anodyne	PPARG	17	43
COc1cc(C)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517421	GF	On-Demand	Anodyne	PPARA	25	46
COc1cc(C)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517421	GF	On-Demand	Anodyne	MME	22	47
COc1cc(C)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517421	GF	On-Demand	Anodyne	CPA1	38	49
COc1cc(C)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517421	GF	On-Demand	Anodyne	PPARD	25	44
COc1cc(C)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517423	GF	On-Demand	Anodyne	PPARG	17	43
COc1cc(C)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517423	GF	On-Demand	Anodyne	PPARA	25	46
COc1cc(C)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517423	GF	On-Demand	Anodyne	MME	22	47
COc1cc(C)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517423	GF	On-Demand	Anodyne	CPA1	38	49
COc1cc(C)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450517423	GF	On-Demand	Anodyne	PPARD	25	44
O=C([C@@H](O)C1CCC1)N1CC[C@@](O)(Cc2cccc(Cl)c2)C1	ZINC000450517424	DE	On-Demand	Anodyne	CCR1	46	36
O=C([C@H](O)C1CCC1)N1CC[C@@](O)(Cc2cccc(Cl)c2)C1	ZINC000450517426	DE	On-Demand	Anodyne	CCR1	46	36
O=C([C@@H](O)C1CCC1)N1CC[C@](O)(Cc2cccc(Cl)c2)C1	ZINC000450517428	DE	On-Demand	Anodyne	CCR1	46	36
O=C([C@H](O)C1CCC1)N1CC[C@](O)(Cc2cccc(Cl)c2)C1	ZINC000450517430	DE	On-Demand	Anodyne	CCR1	46	36
O=C(Cc1ccc(O)c(F)c1)NCCN1CCNC(=O)C1	ZINC000450517435	CB	On-Demand	Anodyne	PLD2	68	33
CCC[C@H](NC(=O)C1(OCC)CCCC1)C(=O)O	ZINC000450517437	CD	On-Demand	Anodyne	MME	17	44
CCC[C@H](NC(=O)C1(OCC)CCCC1)C(=O)O	ZINC000450517437	CD	On-Demand	Anodyne	NPPA	54	41
CCC[C@H](NC(=O)C1(OCC)CCCC1)C(=O)O	ZINC000450517437	CD	On-Demand	Anodyne	NOD1	69	36
CCC[C@@H](NC(=O)C1(OCC)CCCC1)C(=O)O	ZINC000450517448	CD	On-Demand	Anodyne	MME	17	44
CCC[C@@H](NC(=O)C1(OCC)CCCC1)C(=O)O	ZINC000450517448	CD	On-Demand	Anodyne	NPPA	54	41
CCC[C@@H](NC(=O)C1(OCC)CCCC1)C(=O)O	ZINC000450517448	CD	On-Demand	Anodyne	NOD1	69	36
N#CC1(CN(CC(N)=O)Cc2ccc(OCc3ccccc3)cc2)CCC1	ZINC000450517449	FG	On-Demand	Mild	HRAS	51	35
C/C=C\COc1cccc(CC(=O)NC[C@@H](COC)OC)c1	ZINC000450517451	DD	On-Demand	Anodyne	PDS	69	34
C/C=C\COc1cccc(CC(=O)NC[C@H](COC)OC)c1	ZINC000450517452	DD	On-Demand	Anodyne	PDS	69	34
CCC[C@H](NC(=O)c1c(-c2ccccc2)oc(C)c1C)C(=O)O	ZINC000450517458	DH	On-Demand	Anodyne	C3AR1	52	36
CCC[C@H](NC(=O)c1c(-c2ccccc2)oc(C)c1C)C(=O)O	ZINC000450517458	DH	On-Demand	Anodyne	NPPA	41	35
CCC[C@@H](NC(=O)c1c(-c2ccccc2)oc(C)c1C)C(=O)O	ZINC000450517462	DH	On-Demand	Anodyne	MME	37	42
CCC[C@@H](NC(=O)c1c(-c2ccccc2)oc(C)c1C)C(=O)O	ZINC000450517462	DH	On-Demand	Anodyne	C3AR1	59	38
CCC[C@@H](NC(=O)c1c(-c2ccccc2)oc(C)c1C)C(=O)O	ZINC000450517462	DH	On-Demand	Anodyne	NAALAD2	43	36
CCC[C@@H](NC(=O)c1c(-c2ccccc2)oc(C)c1C)C(=O)O	ZINC000450517462	DH	On-Demand	Anodyne	ACE2	44	38
CCC[C@@H](NC(=O)c1c(-c2ccccc2)oc(C)c1C)C(=O)O	ZINC000450517462	DH	On-Demand	Anodyne	NPPA	44	37
CSc1cccc(C(=O)NCCCOCCO)c1	ZINC000450517464	CD	On-Demand	Anodyne	DRD4	42	32
CCS(=O)(=O)c1ccc(CN2CCCc3c(NC(C)=O)cccc32)cc1	ZINC000450517465	FG	On-Demand	Anodyne	KCNQ2	66	34
CCS(=O)(=O)c1ccc(CN2CCCc3c(NC(C)=O)cccc32)cc1	ZINC000450517465	FG	On-Demand	Anodyne	RORC	58	35
NC(=O)[C@]1(O)CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450517469	FD	On-Demand	Anodyne	SIRT3	42	32
O=C(C1CCN(Cc2cnn[nH]2)CC1)N1CCc2ccccc21	ZINC000450517470	DD	On-Demand	Anodyne	DRD4	20	43
NC(=O)[C@@]1(O)CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450517472	FD	On-Demand	Anodyne	SIRT3	42	32
COC(=O)CCN1CC[C@@H](NC(=O)c2c(Cl)cc(Cl)cc2Cl)C1=O	ZINC000450517481	GF	On-Demand	Anodyne	CACNA1I	41	32
COC(=O)CCN1CC[C@H](NC(=O)c2c(Cl)cc(Cl)cc2Cl)C1=O	ZINC000450517485	GF	On-Demand	Anodyne	CACNA1I	41	32
C=CCC1(C(=O)N[C@@H](CCC)C(=O)O)CCC1	ZINC000450517486	BE	On-Demand	Mild	NPPA	40	35
C=CCC1(C(=O)N[C@@H](CCC)C(=O)O)CCC1	ZINC000450517486	BE	On-Demand	Mild	NOD1	42	35
C=CCC1(C(=O)N[C@H](CCC)C(=O)O)CCC1	ZINC000450517487	BE	On-Demand	Mild	NPPA	40	35
C=CCC1(C(=O)N[C@H](CCC)C(=O)O)CCC1	ZINC000450517487	BE	On-Demand	Mild	NOD1	42	35
CCC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450517491	EG	On-Demand	Anodyne	TIMP3	59	33
CCC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450517491	EG	On-Demand	Anodyne	NPPA	40	36
CCC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450517493	EG	On-Demand	Anodyne	TIMP3	59	33
CCC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450517493	EG	On-Demand	Anodyne	NPPA	40	36
C[C@H](O)CCN(Cc1ccccc1)c1c(O)nc(=O)n(Cc2ccccc2)c1N	ZINC000450517496	GE	On-Demand	Anodyne	TLR7	25	44
C[C@@H](O)CCN(Cc1ccccc1)c1c(O)nc(=O)n(Cc2ccccc2)c1N	ZINC000450517497	GE	On-Demand	Anodyne	TLR7	25	44
COCCOC[C@@H](O)CN1CC=C(c2c[nH]c3cc(C)ccc23)CC1	ZINC000450517500	EF	On-Demand	Anodyne	SLC6A4	0	45
COCCOC[C@H](O)CN1CC=C(c2c[nH]c3cc(C)ccc23)CC1	ZINC000450517501	EF	On-Demand	Anodyne	SLC6A4	0	45
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)c1	ZINC000450517504	FG	On-Demand	Anodyne	SLC6A1	83	39
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)c1	ZINC000450517504	FG	On-Demand	Anodyne	PDE8A	0	44
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)c1	ZINC000450517505	FG	On-Demand	Anodyne	SLC6A1	83	39
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)c1	ZINC000450517505	FG	On-Demand	Anodyne	PDE8A	0	44
C[C@H](CCC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450517506	CE	On-Demand	Anodyne	AVPR1A	0	43
C[C@@H](CCC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450517508	CE	On-Demand	Anodyne	AVPR1A	0	43
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	DRD2	31	60
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	DRD1	18	46
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	DRD4	34	46
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	HTR2A	35	59
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	HTR2C	18	59
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	SLC6A1	38	47
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	SLC6A4	19	43
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	HRH1	23	46
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	DRD3	17	46
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	SLC6A3	24	43
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	KCNH2	17	42
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	DRD5	19	46
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	HRH3	23	58
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	SIGMAR1	42	60
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	PRCP	27	47
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	P2RX7	54	44
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	CCR1	41	42
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	CCR3	77	46
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	CCR5	18	54
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	PLD1	46	40
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	EPHX2	29	50
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	PLD2	40	40
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	C5AR1	15	44
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	CXCR3	20	40
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	O19067_PIG	0	43
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	MCHR1	29	44
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	CACNA1G	68	61
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	CACNA1I	42	35
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	GPBAR1	0	45
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	Q76353_9HIV1	0	40
O=C(NCc1ccc(F)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517514	FI	On-Demand	Anodyne	PANK3	0	42
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450517519	GH	On-Demand	Anodyne	SLC6A1	50	34
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450517519	GH	On-Demand	Anodyne	F10	34	51
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450517526	GH	On-Demand	Anodyne	SLC6A1	50	34
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450517526	GH	On-Demand	Anodyne	F10	34	51
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450517527	GH	On-Demand	Anodyne	SLC6A1	50	34
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450517527	GH	On-Demand	Anodyne	F10	34	51
CC(C)N1CCCC[C@H]1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450517528	GH	On-Demand	Anodyne	SLC6A1	50	34
CC(C)N1CCCC[C@H]1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450517528	GH	On-Demand	Anodyne	F10	34	51
O=C(c1ccc(O)cc1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450517538	EG	On-Demand	Anodyne	FABI	52	35
O=C(c1ccc(O)cc1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450517538	EG	On-Demand	Anodyne	F3	23	43
O=C(c1ccc(O)cc1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450517538	EG	On-Demand	Anodyne	SLC6A5	32	42
O=C(c1ccc(O)cc1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450517538	EG	On-Demand	Anodyne	SLC6A7	0	40
O=C(c1ccc(O)cc1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450517539	EG	On-Demand	Anodyne	FABI	52	35
O=C(c1ccc(O)cc1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450517539	EG	On-Demand	Anodyne	F3	23	43
O=C(c1ccc(O)cc1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450517539	EG	On-Demand	Anodyne	SLC6A5	32	42
O=C(c1ccc(O)cc1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450517539	EG	On-Demand	Anodyne	SLC6A7	0	40
O=C(NCCCOCCO)c1ccc(-c2ccncc2)c(F)c1	ZINC000450517552	DE	On-Demand	Anodyne	ALPL	41	37
N#Cc1c(Cl)cccc1N1CCC(CC(F)(F)F)CC1	ZINC000450517560	DI	On-Demand	Mild	GRM2	15	43
O=C(O)CCc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450517564	EH	On-Demand	Anodyne	HDAC3	19	46
O=C(O)CCc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450517564	EH	On-Demand	Anodyne	CYP2B1	0	40
O=C(O)CCc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450517564	EH	On-Demand	Anodyne	FFAR1	71	44
O=C(O)CCc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450517564	EH	On-Demand	Anodyne	FFAR4	61	43
N#Cc1cc(Br)cnc1N[C@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC000450517565	GF	On-Demand	Mild	GPR183	0	43
N#Cc1cc(Br)cnc1N[C@@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC000450517566	GF	On-Demand	Mild	GPR183	0	43
CN1CCC(Oc2ccc(CNc3cccc(C#N)c3[N+](=O)[O-])cc2)CC1	ZINC000450517567	FH	On-Demand	Mild	PRSS2	47	36
CN(C)S(=O)(=O)CC(=O)Nc1cccc(CSCCC(=O)O)c1	ZINC000450517578	FD	On-Demand	Anodyne	PARP10	0	42
COC(=O)c1ccc(CC(=O)N2CCCCc3cc(OC)ccc32)cc1	ZINC000450517587	FG	On-Demand	Anodyne	SRD5A1	33	42
COC(=O)c1ccc(CC(=O)N2CCCCc3cc(OC)ccc32)cc1	ZINC000450517587	FG	On-Demand	Anodyne	DRD4	43	34
COC(=O)c1ccc(CC(=O)N2CCCCc3cc(OC)ccc32)cc1	ZINC000450517587	FG	On-Demand	Anodyne	AVPR2	33	44
COC(=O)c1ccc(CC(=O)N2CCCCc3cc(OC)ccc32)cc1	ZINC000450517587	FG	On-Demand	Anodyne	SRD5A2	29	42
COC(=O)c1ccc(CC(=O)N2CCCCc3cc(OC)ccc32)cc1	ZINC000450517587	FG	On-Demand	Anodyne	EIF2AK3	56	40
COC(=O)c1ccc(CC(=O)N2CCCCc3cc(OC)ccc32)cc1	ZINC000450517587	FG	On-Demand	Anodyne	GPR183	0	40
CN(C)S(=O)(=O)CC(=O)NCc1ccc(OCCCC(=O)O)cc1	ZINC000450517588	FC	On-Demand	Anodyne	LTA4H	22	45
CN(C)S(=O)(=O)CC(=O)NCc1ccc(OCCCC(=O)O)cc1	ZINC000450517588	FC	On-Demand	Anodyne	PLA2G4B	59	39
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	DRD2	21	52
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	DRD4	46	52
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	ACHE	28	47
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	AVPR2	44	40
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	AVPR1A	26	40
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	LTA4H	19	40
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	VACHT_TETCF	0	42
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	SIGMAR1	47	69
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	SLC18A3	21	40
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	NOD1	32	42
CC(=O)c1ccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)cc1	ZINC000450517602	FH	On-Demand	Anodyne	NOD2	50	43
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C[C@@H]1CCNC(=O)CC1	ZINC000450517611	GE	On-Demand	Anodyne	HRAS	51	33
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C[C@H]1CCNC(=O)CC1	ZINC000450517612	GE	On-Demand	Anodyne	HRAS	51	33
COCc1cccc(CC(=O)N(CC(=O)O)Cc2ccc(F)c(F)c2)c1	ZINC000450517616	FF	On-Demand	Anodyne	GYS1	55	52
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CHRM2	22	45
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	HTR1A	15	48
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	DRD2	37	68
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	DRD4	59	68
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	ACHE	17	43
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	HTR1D	22	41
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	HTR1B	22	41
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	HTR2A	32	52
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	SLC6A1	22	48
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	SLC6A4	19	45
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	HRH1	17	40
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	DRD3	25	68
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	SLC6A3	17	45
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	KCNH2	22	42
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	HTR4	23	42
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CHRM3	37	45
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	LTA4H	32	43
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	HTR7	15	41
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	HRH3	22	41
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	SIGMAR1	63	57
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	PRCP	29	41
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	NPY2R	0	42
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CCR1	47	44
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CCR3	96	54
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CCR5	31	41
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CHRNA7	23	43
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	ABCB1	0	41
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CCR2	15	40
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	EPHX2	75	55
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	C5AR1	17	42
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CXCR3	37	49
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	MCHR1	69	47
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	CACNA1G	33	43
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	BIRC2	57	41
O=C(Nc1ccccc1)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450517617	FI	On-Demand	Anodyne	ACHP_LYMST	17	43
O=C(NC(CO)CO)c1ccc2scc(Br)c2c1	ZINC000450517618	ED	On-Demand	Anodyne	AKT1	51	31
Cn1nc(-c2ccccc2)cc1C(=O)NC(CO)CO	ZINC000450517621	CC	On-Demand	Anodyne	TACR3	24	40
Cn1nc(-c2ccccc2)cc1C(=O)NC(CO)CO	ZINC000450517621	CC	On-Demand	Anodyne	CTSV	53	37
Cn1nc(-c2ccccc2)cc1C(=O)NC(CO)CO	ZINC000450517621	CC	On-Demand	Anodyne	AGER	0	42
CC[S@](=O)CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450517622	DD	On-Demand	Anodyne	P2RX7	32	56
CC[S@@](=O)CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450517623	DD	On-Demand	Anodyne	P2RX7	32	56
O=C(O)CCc1cccc(NC(=O)CCCc2cc(F)ccc2F)c1	ZINC000450517630	EH	On-Demand	Anodyne	FFAR1	55	39
O=C(O)CCc1cccc(NC(=O)CCCc2cc(F)ccc2F)c1	ZINC000450517630	EH	On-Demand	Anodyne	FFAR4	42	39
O=C(O)CCc1cccc(NC(=O)CCCc2cc(F)ccc2F)c1	ZINC000450517630	EH	On-Demand	Anodyne	PARP10	0	45
Cc1nn(-c2ccccc2)cc1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450517637	DG	On-Demand	Anodyne	P2RX7	22	53
Cc1nn(-c2ccccc2)cc1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450517637	DG	On-Demand	Anodyne	CARM1	45	31
Cn1cc([C@@H]2CCCCN2c2ncnc3cc(Cl)ccc23)cn1	ZINC000450517648	EH	On-Demand	Anodyne	HRP1_PLAFA	40	33
Cn1cc([C@@H]2CCCCN2c2ncnc3cc(Cl)ccc23)cn1	ZINC000450517648	EH	On-Demand	Anodyne	HNMT	49	34
Cn1cc([C@H]2CCCCN2c2ncnc3cc(Cl)ccc23)cn1	ZINC000450517649	EH	On-Demand	Anodyne	HRP1_PLAFA	40	33
Cn1cc([C@H]2CCCCN2c2ncnc3cc(Cl)ccc23)cn1	ZINC000450517649	EH	On-Demand	Anodyne	HNMT	49	34
CCN(Cc1nc(C(=O)OC)co1)c1cccc(OC)c1	ZINC000450517654	CE	On-Demand	Anodyne	MTNR1B	23	42
O=C(Nc1ccccc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450517661	GG	On-Demand	Anodyne	DRD4	21	62
O=C(Nc1ccccc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450517661	GG	On-Demand	Anodyne	SIGMAR1	24	45
O=C(Nc1ccccc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450517661	GG	On-Demand	Anodyne	CCR3	40	40
O=C(Nc1ccccc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450517661	GG	On-Demand	Anodyne	SLC6A5	23	40
O=C(Nc1ccccc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450517661	GG	On-Demand	Anodyne	EPHX2	46	44
O=C(Nc1ccccc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450517661	GG	On-Demand	Anodyne	CXCR3	25	44
O=C(Nc1ccccc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450517661	GG	On-Demand	Anodyne	MCHR1	34	43
O=C(Nc1ccccc1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450517661	GG	On-Demand	Anodyne	HPGDS	37	45
CN(C)S(=O)(=O)CC(=O)NCc1cccc(-n2ccc(C(=O)O)n2)c1	ZINC000450517684	FC	On-Demand	Anodyne	CARM1	45	36
CCOC(=O)[C@@H](CO)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450517685	EC	On-Demand	Bother	CACNA1C	58	40
CCOC(=O)[C@@H](CO)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450517685	EC	On-Demand	Bother	CCR3	0	49
CCOC(=O)[C@@H](CO)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450517685	EC	On-Demand	Bother	IRAK4	24	42
CCOC(=O)[C@H](CO)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450517686	EC	On-Demand	Bother	CACNA1C	58	40
CCOC(=O)[C@H](CO)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450517686	EC	On-Demand	Bother	CCR3	0	49
CCOC(=O)[C@H](CO)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450517686	EC	On-Demand	Bother	IRAK4	24	42
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@@H]1CCCCC1(F)F	ZINC000450517692	EH	On-Demand	Anodyne	P2RX7	33	48
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H]1CCCCC1(F)F	ZINC000450517693	EH	On-Demand	Anodyne	P2RX7	33	48
O=C(NCc1ccccc1CN1CC[C@H](O)C1)c1ccc2c(c1)OC(F)(F)O2	ZINC000450517698	GF	On-Demand	Anodyne	OPRK1	17	40
O=C(NCc1ccccc1CN1CC[C@H](O)C1)c1ccc2c(c1)OC(F)(F)O2	ZINC000450517698	GF	On-Demand	Anodyne	MCHR1	19	47
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)c1ccc2c(c1)OC(F)(F)O2	ZINC000450517699	GF	On-Demand	Anodyne	OPRK1	17	40
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)c1ccc2c(c1)OC(F)(F)O2	ZINC000450517699	GF	On-Demand	Anodyne	MCHR1	19	47
COc1ccc2[nH]cc(C3=CCN(C[C@H]4COCCO4)CC3)c2c1	ZINC000450517703	EF	On-Demand	Anodyne	HTR1A	0	51
COc1ccc2[nH]cc(C3=CCN(C[C@H]4COCCO4)CC3)c2c1	ZINC000450517703	EF	On-Demand	Anodyne	SLC6A4	24	58
COc1ccc2[nH]cc(C3=CCN(C[C@@H]4COCCO4)CC3)c2c1	ZINC000450517704	EF	On-Demand	Anodyne	HTR1A	0	51
COc1ccc2[nH]cc(C3=CCN(C[C@@H]4COCCO4)CC3)c2c1	ZINC000450517704	EF	On-Demand	Anodyne	SLC6A4	24	58
CCc1cc(CCCN2CCC(C(=O)NCc3ccc(F)cc3)CC2)on1	ZINC000450517708	FG	On-Demand	Anodyne	DRD2	19	41
CCc1cc(CCCN2CCC(C(=O)NCc3ccc(F)cc3)CC2)on1	ZINC000450517708	FG	On-Demand	Anodyne	HTR2A	28	41
CCc1cc(CCCN2CCC(C(=O)NCc3ccc(F)cc3)CC2)on1	ZINC000450517708	FG	On-Demand	Anodyne	CCR3	47	37
CCc1cc(CCCN2CCC(C(=O)NCc3ccc(F)cc3)CC2)on1	ZINC000450517708	FG	On-Demand	Anodyne	CACNA1G	44	51
O=C(Cc1ccc(Cl)c(F)c1)N[C@]1(C(=O)O)CCOC1	ZINC000450517709	DD	On-Demand	Anodyne	ENV	42	33
O=C(Cc1ccc(Cl)c(F)c1)N[C@@]1(C(=O)O)CCOC1	ZINC000450517710	DD	On-Demand	Anodyne	ENV	42	33
CC(=O)Nc1cccc2c1CCCN2C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450517711	EH	On-Demand	Anodyne	KCNQ2	79	42
CC(=O)Nc1cccc2c1CCCN2C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450517711	EH	On-Demand	Anodyne	KCNQ4	0	40
CC(=O)Nc1cccc2c1CCCN2C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450517712	EH	On-Demand	Anodyne	KCNQ2	79	42
CC(=O)Nc1cccc2c1CCCN2C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450517712	EH	On-Demand	Anodyne	KCNQ4	0	40
CC(=O)Nc1cccc2c1CCCN2C[C@H](O)[C@H](C)c1ccccc1	ZINC000450517713	EH	On-Demand	Anodyne	KCNQ2	79	42
CC(=O)Nc1cccc2c1CCCN2C[C@H](O)[C@H](C)c1ccccc1	ZINC000450517713	EH	On-Demand	Anodyne	KCNQ4	0	40
CC(=O)Nc1cccc2c1CCCN2C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450517714	EH	On-Demand	Anodyne	KCNQ2	79	42
CC(=O)Nc1cccc2c1CCCN2C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450517714	EH	On-Demand	Anodyne	KCNQ4	0	40
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1cccc(F)c1F	ZINC000450517717	DG	On-Demand	Anodyne	HDAC1	16	40
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1cccc(F)c1F	ZINC000450517717	DG	On-Demand	Anodyne	HPGDS	30	45
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1cccc(F)c1F	ZINC000450517718	DG	On-Demand	Anodyne	HDAC1	16	40
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1cccc(F)c1F	ZINC000450517718	DG	On-Demand	Anodyne	HPGDS	30	45
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	P2RY12	30	42
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	SSTR5	52	44
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	CCR3	48	39
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	MLNR	48	39
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	EPHX2	16	40
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	CXCR3	18	40
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	MCHR1	29	43
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	CACNA1G	51	47
CCOC(=O)c1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)nc1	ZINC000450517727	GF	On-Demand	Anodyne	WNT3A	46	33
Cc1noc(C2(C)CCN(C(=O)c3ccc4c(c3)OC(F)(F)O4)CC2)n1	ZINC000450517735	FF	On-Demand	Anodyne	ACACA	40	31
COC[C@@H](CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)OC	ZINC000450517736	DD	On-Demand	Anodyne	GCK	31	42
COC[C@H](CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)OC	ZINC000450517737	DD	On-Demand	Anodyne	GCK	31	42
COc1cccc(-n2cc(C(=O)N3CCC(C)(c4nc(C)no4)CC3)nn2)c1	ZINC000450517738	GE	On-Demand	Anodyne	CCKAR	27	41
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	MME	32	48
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	EDNRA	32	44
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	CCKAR	29	42
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	MPO	62	39
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	BRS3	22	40
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	MMP14	60	39
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	GRPR	55	33
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	ECE1	61	45
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	SSTR3	23	40
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	ACE2	53	38
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	NPR	31	46
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	SLC15A2	0	51
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	KISS1R	58	36
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	ERAP2	40	38
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	LASB	0	41
CC[C@@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517745	DF	On-Demand	Anodyne	NRDE	0	40
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	MME	32	48
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	EDNRA	32	44
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	CCKAR	29	42
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	MPO	62	39
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	BRS3	22	40
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	MMP14	60	39
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	GRPR	55	33
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	ECE1	61	45
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	SSTR3	23	40
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	ACE2	53	38
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	NPR	31	46
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	SLC15A2	0	51
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	KISS1R	58	36
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	ERAP2	40	38
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	LASB	0	41
CC[C@H](C)CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517746	DF	On-Demand	Anodyne	NRDE	0	40
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	MME	32	48
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	EDNRA	32	44
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	CCKAR	29	42
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	MPO	62	39
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	BRS3	22	40
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	MMP14	60	39
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	GRPR	55	33
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	ECE1	61	45
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	SSTR3	23	40
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	ACE2	53	38
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	NPR	31	46
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	SLC15A2	0	51
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	KISS1R	58	36
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	ERAP2	40	38
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	LASB	0	41
CC[C@@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517747	DF	On-Demand	Anodyne	NRDE	0	40
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	MME	32	48
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	EDNRA	32	44
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	CCKAR	29	42
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	MPO	62	39
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	BRS3	22	40
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	MMP14	60	39
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	GRPR	55	33
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	ECE1	61	45
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	SSTR3	23	40
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	ACE2	53	38
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	NPR	31	46
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	SLC15A2	0	51
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	KISS1R	58	36
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	ERAP2	40	38
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	LASB	0	41
CC[C@H](C)CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450517748	DF	On-Demand	Anodyne	NRDE	0	40
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	HTR1A	18	60
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	DRD2	33	45
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	DRD1	23	51
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	DRD4	35	46
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	HTR2A	41	49
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	HTR2C	28	60
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	HRH1	15	49
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	ADRA1B	18	42
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	DRD3	15	51
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	ERG2	21	45
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	HTR1F	66	43
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	SIGMAR1	17	56
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	SLC18A3	15	48
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	HTR3B	0	45
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	MCHR1	24	49
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	CYP2J2	57	46
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	WNT3A	40	33
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450517756	GH	On-Demand	Anodyne	AP2S1	0	45
CC1(C(=O)N[C@H]2CCCc3cc(F)ccc32)CCC(=O)CC1	ZINC000450517757	DG	On-Demand	Anodyne	BDKRB1	49	41
CC1(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CCC(=O)CC1	ZINC000450517758	DG	On-Demand	Anodyne	BDKRB1	49	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517764	GH	On-Demand	Anodyne	DRD4	27	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517764	GH	On-Demand	Anodyne	DRD3	0	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517764	GH	On-Demand	Anodyne	OPRL1	23	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517764	GH	On-Demand	Anodyne	F10	47	31
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517764	GH	On-Demand	Anodyne	SIGMAR1	24	47
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517765	GH	On-Demand	Anodyne	DRD4	27	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517765	GH	On-Demand	Anodyne	DRD3	0	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517765	GH	On-Demand	Anodyne	OPRL1	23	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517765	GH	On-Demand	Anodyne	F10	47	31
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450517765	GH	On-Demand	Anodyne	SIGMAR1	24	47
COCc1nn(C)cc1C(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450517776	GH	On-Demand	Anodyne	KCNJ11	52	34
COCc1nn(C)cc1C(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450517777	GH	On-Demand	Anodyne	KCNJ11	52	34
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450517782	EG	On-Demand	Anodyne	SLC6A1	77	35
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450517782	EG	On-Demand	Anodyne	F10	24	46
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450517783	EG	On-Demand	Anodyne	SLC6A1	77	35
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450517783	EG	On-Demand	Anodyne	F10	24	46
CC[C@H](O)CC(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000450517790	CE	On-Demand	Anodyne	NPY2R	40	33
CC[C@H](O)CC(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000450517791	CE	On-Demand	Anodyne	NPY2R	40	33
CC[C@@H](O)CC(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000450517792	CE	On-Demand	Anodyne	NPY2R	40	33
CC[C@@H](O)CC(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000450517793	CE	On-Demand	Anodyne	NPY2R	40	33
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450517798	GJ	On-Demand	Anodyne	MC4R	33	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450517798	GJ	On-Demand	Anodyne	PRCP	55	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450517799	GJ	On-Demand	Anodyne	MC4R	33	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450517799	GJ	On-Demand	Anodyne	PRCP	55	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450517800	GJ	On-Demand	Anodyne	MC4R	33	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450517800	GJ	On-Demand	Anodyne	PRCP	55	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	CNR2	16	41
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	HRH3	20	44
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	SIGMAR1	24	49
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	SSTR5	56	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	CCR3	24	44
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	MLNR	47	37
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	FAAH	24	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	EPHX2	35	43
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	NMUR2	0	42
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450517809	GF	On-Demand	Anodyne	NMUR1	0	42
COc1cc(Cl)c(C(=O)N2CCO[C@@H](C(=O)O)C2)cc1OC	ZINC000450517810	ED	On-Demand	Anodyne	HTR4	40	34
COc1cc(Cl)c(C(=O)N2CCO[C@@H](C(=O)O)C2)cc1OC	ZINC000450517810	ED	On-Demand	Anodyne	LRRK2	18	40
COc1cc(Cl)c(C(=O)N2CCO[C@H](C(=O)O)C2)cc1OC	ZINC000450517811	ED	On-Demand	Anodyne	HTR4	40	34
COc1cc(Cl)c(C(=O)N2CCO[C@H](C(=O)O)C2)cc1OC	ZINC000450517811	ED	On-Demand	Anodyne	LRRK2	18	40
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517822	GD	On-Demand	Anodyne	ACE	22	45
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517822	GD	On-Demand	Anodyne	MME	80	45
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517822	GD	On-Demand	Anodyne	FCER2	30	43
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517822	GD	On-Demand	Anodyne	TRY2_BOVIN	59	35
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517822	GD	On-Demand	Anodyne	CPA1	57	52
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517822	GD	On-Demand	Anodyne	TPH1	47	36
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517822	GD	On-Demand	Anodyne	ACE2	49	45
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517823	GD	On-Demand	Anodyne	ACE	22	45
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517823	GD	On-Demand	Anodyne	MME	80	45
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517823	GD	On-Demand	Anodyne	FCER2	30	43
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517823	GD	On-Demand	Anodyne	TRY2_BOVIN	59	35
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517823	GD	On-Demand	Anodyne	CPA1	57	52
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517823	GD	On-Demand	Anodyne	TPH1	47	36
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000450517823	GD	On-Demand	Anodyne	ACE2	49	45
CC[C@H](CC(C)C)C(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450517836	FH	On-Demand	Anodyne	CCR3	53	32
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450517837	FH	On-Demand	Anodyne	CCR3	53	32
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450517838	FH	On-Demand	Anodyne	CCR3	53	32
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450517839	FH	On-Demand	Anodyne	CCR3	53	32
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	HTR1A	25	55
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	THRA	0	40
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	DRD2	30	43
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	DRD4	26	43
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	HTR2A	27	49
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	HTR2C	23	52
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	FABI	53	38
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	DRD3	23	47
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	HTR7	44	55
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	PLA2G2A	0	44
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	CYP2J2	65	46
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	L3MBTL3	45	37
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	AP2S1	0	40
O=C(CCCN1CCN(C(=O)c2ccc(O)cc2)CC1)c1ccccc1	ZINC000450517847	FF	On-Demand	Anodyne	SLC6A7	0	42
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)Cc3ccc(O)c(F)c3)no2)cn1	ZINC000450517851	GG	On-Demand	Anodyne	COLA	101	47
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)Cc3ccc(O)c(F)c3)no2)cn1	ZINC000450517851	GG	On-Demand	Anodyne	CPT1A	97	47
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)Cc3ccc(O)c(F)c3)no2)cn1	ZINC000450517852	GG	On-Demand	Anodyne	COLA	101	47
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)Cc3ccc(O)c(F)c3)no2)cn1	ZINC000450517852	GG	On-Demand	Anodyne	CPT1A	97	47
N#CC1(CN2CCN(C(=O)c3ccc(O)cc3)CC2)CCC1	ZINC000450517859	CD	On-Demand	Mild	L3MBTL3	49	35
O=C(c1ccc(O)cc1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450517860	DD	On-Demand	Anodyne	L3MBTL3	49	35
O=C(c1ccc(O)cc1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450517861	DD	On-Demand	Anodyne	L3MBTL3	49	35
COc1ccc2c(c1)C[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)CO2	ZINC000450517866	GE	On-Demand	Anodyne	MTNR1A	19	45
COc1ccc2c(c1)C[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)CO2	ZINC000450517866	GE	On-Demand	Anodyne	ROCK2	32	44
COc1ccc2c(c1)C[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)CO2	ZINC000450517867	GE	On-Demand	Anodyne	MTNR1A	19	45
COc1ccc2c(c1)C[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)CO2	ZINC000450517867	GE	On-Demand	Anodyne	ROCK2	32	44
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)CO2	ZINC000450517868	GE	On-Demand	Anodyne	MTNR1A	19	45
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)CO2	ZINC000450517868	GE	On-Demand	Anodyne	ROCK2	32	44
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)CO2	ZINC000450517869	GE	On-Demand	Anodyne	ROCK2	32	44
O=C(CCCC1CCOCC1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450517872	FF	On-Demand	Anodyne	CPA1	22	46
O=C(CCCC1CCOCC1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450517873	FF	On-Demand	Anodyne	CPA1	22	46
COc1ccc2c(c1)CCCCN2C(=O)C1CC(C)(O)C1	ZINC000450517874	CF	On-Demand	Anodyne	AVPR2	26	42
Cc1oc(C(C)C)cc1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450517877	EH	On-Demand	Anodyne	CPA1	52	52
Cc1oc(C(C)C)cc1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450517878	EH	On-Demand	Anodyne	CPA1	52	52
CC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450517900	FH	On-Demand	Anodyne	ALOX5AP	49	37
CC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450517900	FH	On-Demand	Anodyne	COLA	58	45
CC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450517900	FH	On-Demand	Anodyne	CPT1A	48	45
CCOC(=O)[C@@H](CO)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450517912	EB	On-Demand	Anodyne	DRD4	40	33
CCOC(=O)[C@@H](CO)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450517912	EB	On-Demand	Anodyne	P2RY12	49	38
CCOC(=O)[C@@H](CO)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450517912	EB	On-Demand	Anodyne	ESRRA	21	42
CCOC(=O)[C@H](CO)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450517913	EB	On-Demand	Anodyne	DRD4	40	33
CCOC(=O)[C@H](CO)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450517913	EB	On-Demand	Anodyne	P2RY12	49	38
CCOC(=O)[C@H](CO)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450517913	EB	On-Demand	Anodyne	ESRRA	21	42
CSc1cccc(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1	ZINC000450517916	FG	On-Demand	Anodyne	ACKR3	50	31
CSc1cccc(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1	ZINC000450517917	FG	On-Demand	Anodyne	ACKR3	50	31
CN(Cc1ccc(OCC(=O)O)cc1)C(=O)C1(C)CC1	ZINC000450517919	CD	On-Demand	Anodyne	PLA2G4B	51	30
CC(=O)N[C@H](C(=O)N[C@H]1CN(c2ccccc2)C1=O)C(C)(C)C	ZINC000450517927	DD	On-Demand	Anodyne	GAG-PRO	50	32
CC(=O)N[C@H](C(=O)N[C@H]1CN(c2ccccc2)C1=O)C(C)(C)C	ZINC000450517927	DD	On-Demand	Anodyne	BIRC2	34	40
CC(=O)N[C@H](C(=O)N[C@H]1CN(c2ccccc2)C1=O)C(C)(C)C	ZINC000450517927	DD	On-Demand	Anodyne	BIRC8	43	36
CC(=O)N[C@H](C(=O)N[C@@H]1CN(c2ccccc2)C1=O)C(C)(C)C	ZINC000450517928	DD	On-Demand	Anodyne	GAG-PRO	50	32
CC(=O)N[C@H](C(=O)N[C@@H]1CN(c2ccccc2)C1=O)C(C)(C)C	ZINC000450517928	DD	On-Demand	Anodyne	BIRC2	34	40
CC(=O)N[C@H](C(=O)N[C@@H]1CN(c2ccccc2)C1=O)C(C)(C)C	ZINC000450517928	DD	On-Demand	Anodyne	BIRC8	43	36
C[C@H](Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1)C(=O)O	ZINC000450517939	GJ	On-Demand	Anodyne	MME	22	40
C[C@H](Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1)C(=O)O	ZINC000450517939	GJ	On-Demand	Anodyne	TIMP3	43	33
C[C@H](Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1)C(=O)O	ZINC000450517939	GJ	On-Demand	Anodyne	PPARD	15	44
C[C@H](Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1)C(=O)O	ZINC000450517939	GJ	On-Demand	Anodyne	FPR2	17	40
C[C@@H](Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1)C(=O)O	ZINC000450517940	GJ	On-Demand	Anodyne	MME	22	40
C[C@@H](Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1)C(=O)O	ZINC000450517940	GJ	On-Demand	Anodyne	TIMP3	43	33
C[C@@H](Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1)C(=O)O	ZINC000450517940	GJ	On-Demand	Anodyne	PPARD	15	44
C[C@@H](Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1)C(=O)O	ZINC000450517940	GJ	On-Demand	Anodyne	FPR2	17	40
Cc1csc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450517956	EF	On-Demand	Anodyne	DRD4	24	40
Cc1csc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450517957	EF	On-Demand	Anodyne	DRD4	24	40
COC(=O)c1csc(CN2CCC(NC(=O)NC3CCCCC3)CC2)n1	ZINC000450517964	GF	On-Demand	Anodyne	SSTR5	47	33
COC(=O)c1csc(CN2CCC(NC(=O)NC3CCCCC3)CC2)n1	ZINC000450517964	GF	On-Demand	Anodyne	EPHX2	33	43
COC(=O)c1csc(CN2CCC(NC(=O)NC3CCCCC3)CC2)n1	ZINC000450517964	GF	On-Demand	Anodyne	CXCR3	19	42
CCC(=O)CCCN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450517966	EG	On-Demand	Anodyne	HTR7	40	39
CCC(=O)CCCN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450517966	EG	On-Demand	Anodyne	CYP2J2	51	36
CCCC[C@@H](C)C(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1	ZINC000450517968	DG	On-Demand	Anodyne	ACE	30	40
CCCC[C@H](C)C(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1	ZINC000450517969	DG	On-Demand	Anodyne	ACE	30	40
Cc1nn(-c2ccccc2)cc1CNC(=O)CSC1CC1	ZINC000450517971	DF	On-Demand	Anodyne	P2RX7	30	54
CN(Cc1ccc(OCC(=O)O)cc1)C(=O)C1(Oc2ccccc2F)CC1	ZINC000450517972	FF	On-Demand	Anodyne	TACR3	44	39
O=C(Cc1ccc(Cl)c(F)c1)NCC1(C(=O)O)CCCCC1	ZINC000450517983	EG	On-Demand	Anodyne	ENV	43	33
CC1(C(=O)NCc2cccc(-n3ccc(C(=O)O)n3)c2)CC1	ZINC000450517995	CD	On-Demand	Anodyne	CARM1	50	33
CC1(C(=O)NCc2cccc(-n3ccc(C(=O)O)n3)c2)CC1	ZINC000450517995	CD	On-Demand	Anodyne	RPA1	43	32
O=C(Nc1ccccc1)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450517997	EI	On-Demand	Anodyne	DRD4	19	58
O=C(Nc1ccccc1)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450517997	EI	On-Demand	Anodyne	CCR3	59	49
O=C(Nc1ccccc1)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450517997	EI	On-Demand	Anodyne	EPHX2	48	43
O=C(Nc1ccccc1)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450517997	EI	On-Demand	Anodyne	CXCR3	25	59
O=C(Nc1ccccc1)NC1CCN(CCC2=CCCCC2)CC1	ZINC000450517997	EI	On-Demand	Anodyne	MCHR1	21	45
O=C(Cc1ccc(Cl)c(F)c1)NCC1(C(=O)O)CCOCC1	ZINC000450518000	EE	On-Demand	Anodyne	ENV	42	33
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450518001	GJ	On-Demand	Anodyne	MC4R	33	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450518001	GJ	On-Demand	Anodyne	PRCP	55	40
O=C(CCCC(=O)C1CC1)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450518002	FJ	On-Demand	Anodyne	KCNJ11	63	41
O=C(CCCC(=O)C1CC1)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450518002	FJ	On-Demand	Anodyne	PPAF_PHAVU	0	44
O=C(CCCC(=O)C1CC1)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450518003	FJ	On-Demand	Anodyne	KCNJ11	63	41
O=C(CCCC(=O)C1CC1)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450518003	FJ	On-Demand	Anodyne	PPAF_PHAVU	0	44
CN(C)CCCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450518010	EE	On-Demand	Anodyne	FASN	26	41
CN(C)CCCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450518010	EE	On-Demand	Anodyne	ENPP2	21	43
CN(C)CCCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450518010	EE	On-Demand	Anodyne	HPGDS	15	42
CN(C)CCCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450518010	EE	On-Demand	Anodyne	L3MBTL3	58	38
CN1CCN(C(=O)c2ccc(N3CCC3)nc2)C(C)(C)C1	ZINC000450518012	CD	On-Demand	Anodyne	HDAC1	17	40
COc1ccccc1C[C@@H](CNC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450518018	GG	On-Demand	Anodyne	PPARA	16	43
COc1ccccc1C[C@@H](CNC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450518018	GG	On-Demand	Anodyne	MME	16	40
COc1ccccc1C[C@@H](CNC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450518018	GG	On-Demand	Anodyne	PPARD	21	43
COc1ccccc1C[C@H](CNC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450518019	GG	On-Demand	Anodyne	PPARA	16	43
COc1ccccc1C[C@H](CNC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450518019	GG	On-Demand	Anodyne	MME	16	40
COc1ccccc1C[C@H](CNC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450518019	GG	On-Demand	Anodyne	PPARD	21	43
CCC[C@H](NC(=O)C1(OC)CCCCC1)C(=O)O	ZINC000450518021	CD	On-Demand	Anodyne	MME	18	44
CCC[C@H](NC(=O)C1(OC)CCCCC1)C(=O)O	ZINC000450518021	CD	On-Demand	Anodyne	NPPA	56	41
CCC[C@H](NC(=O)C1(OC)CCCCC1)C(=O)O	ZINC000450518021	CD	On-Demand	Anodyne	NOD1	41	33
CCC[C@@H](NC(=O)C1(OC)CCCCC1)C(=O)O	ZINC000450518022	CD	On-Demand	Anodyne	MME	18	44
CCC[C@@H](NC(=O)C1(OC)CCCCC1)C(=O)O	ZINC000450518022	CD	On-Demand	Anodyne	NPPA	56	41
CCC[C@@H](NC(=O)C1(OC)CCCCC1)C(=O)O	ZINC000450518022	CD	On-Demand	Anodyne	NOD1	41	33
COC(=O)CCN1CC[C@H](NC(=O)Cc2cc3ccccc3s2)C1=O	ZINC000450518033	FD	On-Demand	Anodyne	CASP1	22	40
COC(=O)CCN1CC[C@@H](NC(=O)Cc2cc3ccccc3s2)C1=O	ZINC000450518034	FD	On-Demand	Anodyne	CASP1	22	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)[C@@H]2CCCN(C3CCC3)C2)c1	ZINC000450518035	FH	On-Demand	Anodyne	SLC6A1	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)[C@H]2CCCN(C3CCC3)C2)c1	ZINC000450518036	FH	On-Demand	Anodyne	SLC6A1	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](C)[C@@H]2CCCN(C3CCC3)C2)c1	ZINC000450518037	FH	On-Demand	Anodyne	SLC6A1	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](C)[C@H]2CCCN(C3CCC3)C2)c1	ZINC000450518038	FH	On-Demand	Anodyne	SLC6A1	0	40
COC[C@H](CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1)OC	ZINC000450518039	EE	On-Demand	Anodyne	MTNR1A	30	42
COC[C@H](CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1)OC	ZINC000450518039	EE	On-Demand	Anodyne	MTNR1B	30	45
COC[C@@H](CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1)OC	ZINC000450518040	EE	On-Demand	Anodyne	MTNR1A	30	42
COC[C@@H](CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1)OC	ZINC000450518040	EE	On-Demand	Anodyne	MTNR1B	30	45
COC(=O)c1coc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)n1	ZINC000450518046	FD	On-Demand	Anodyne	FAAH	18	41
CN1C(=O)N[C@@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@@H]21	ZINC000450518047	FD	On-Demand	Anodyne	PDE3A	49	38
CN1C(=O)N[C@@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@@H]21	ZINC000450518047	FD	On-Demand	Anodyne	PDE3B	72	38
CSc1cccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450518057	EH	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450518057	EH	On-Demand	Anodyne	L3MBTL1	0	40
CSc1cccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450518057	EH	On-Demand	Anodyne	L3MBTL3	52	40
CSc1cccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450518058	EH	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450518058	EH	On-Demand	Anodyne	L3MBTL1	0	40
CSc1cccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450518058	EH	On-Demand	Anodyne	L3MBTL3	52	40
C[C@H](CN(C(=O)CCCc1cc(F)ccc1F)C1CC1)C(=O)O	ZINC000450518060	EF	On-Demand	Anodyne	DPP4	19	47
C[C@@H](CN(C(=O)CCCc1cc(F)ccc1F)C1CC1)C(=O)O	ZINC000450518061	EF	On-Demand	Anodyne	DPP4	19	47
COC(=O)c1coc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)n1	ZINC000450518068	FG	On-Demand	Anodyne	HTR1A	15	52
COC(=O)c1coc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)n1	ZINC000450518068	FG	On-Demand	Anodyne	SLC6A4	23	54
COc1cccc(OCCC(=O)N2CC[C@](C)(F)C2)c1	ZINC000450518069	CE	On-Demand	Anodyne	MTNR1A	24	43
COc1cccc(OCCC(=O)N2CC[C@@](C)(F)C2)c1	ZINC000450518070	CE	On-Demand	Anodyne	MTNR1A	24	43
CCC(CC)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450518071	DG	On-Demand	Anodyne	NCE103	25	43
CCC(CC)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450518071	DG	On-Demand	Anodyne	PFK	0	43
CCC(CC)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450518071	DG	On-Demand	Anodyne	CAN2	0	43
CCS(=O)(=O)c1ccc(CN[C@@H](c2ccccc2)C(C)(C)C)cc1	ZINC000450518092	EI	On-Demand	Anodyne	RORC	43	39
CCS(=O)(=O)c1ccc(CN[C@H](c2ccccc2)C(C)(C)C)cc1	ZINC000450518093	EI	On-Demand	Anodyne	RORC	43	39
Cc1cccc([C@H](NC(=O)Cn2ccc(C)n2)C(F)(F)F)c1	ZINC000450518098	DF	On-Demand	Anodyne	CTRC	41	38
Cc1cccc([C@@H](NC(=O)Cn2ccc(C)n2)C(F)(F)F)c1	ZINC000450518099	DF	On-Demand	Anodyne	CTRC	41	38
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CHRM2	23	44
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CHRM1	19	44
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	DRD2	52	69
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	TSHR	48	32
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	DRD4	85	69
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	ACHE	55	56
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	HRH2	51	40
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	HTR2A	16	51
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	HRH1	31	50
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	DRD3	46	69
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	HTR3A	0	51
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	KCNH2	24	56
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	HTR4	75	56
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CHRM3	35	41
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	LTA4H	26	44
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	TACR1	16	45
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	TACR2	20	42
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	SIGMAR1	60	63
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	SSTR5	97	51
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	NPY1R	41	41
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	BCHE	16	45
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CCR1	24	40
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CCR3	103	56
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CCR5	24	43
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CPT1A	44	32
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	UTS2R	34	45
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	FAAH	20	48
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CCR2	23	40
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	SLC6A5	31	42
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	EPHX2	56	48
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	PDK1	54	42
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CXCR3	53	49
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	MCHR1	86	55
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CACNA1G	37	41
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	CCR8	31	52
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	NPFFR1	46	37
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	NOD2	40	37
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	ADIPOR1	0	42
COc1cc(CN2CCC(NC(=O)Nc3ccccc3)CC2)ccc1Cl	ZINC000450518113	FI	On-Demand	Anodyne	ADIPOR2	0	42
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518115	FH	On-Demand	Anodyne	ALOX5AP	49	37
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518115	FH	On-Demand	Anodyne	COLA	58	45
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518115	FH	On-Demand	Anodyne	CPT1A	48	45
CC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518116	FH	On-Demand	Anodyne	ALOX5AP	49	37
CC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518116	FH	On-Demand	Anodyne	COLA	58	45
CC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518116	FH	On-Demand	Anodyne	CPT1A	48	45
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518118	FH	On-Demand	Anodyne	ALOX5AP	49	37
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518118	FH	On-Demand	Anodyne	COLA	58	45
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518118	FH	On-Demand	Anodyne	CPT1A	48	45
COCC1(C(=O)O)CCN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)CC1	ZINC000450518121	GG	On-Demand	Anodyne	SLC12A5	18	40
CCc1cccc(C(=O)NC(CO)CO)n1	ZINC000450518125	BB	On-Demand	Anodyne	PDE5A	28	51
CCOC(=O)c1cnn(C2CCN(c3ncc(C#N)cc3[N+](=O)[O-])CC2)c1C	ZINC000450518130	GE	On-Demand	Mild	P2RY12	53	38
COCC1(C#N)CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1	ZINC000450518137	FG	On-Demand	Mild	CTSB	0	44
COCC1(C#N)CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1	ZINC000450518137	FG	On-Demand	Mild	CTSK	15	44
CC[C@@H](O)CC(=O)N1CCCCc2cc(OC)ccc21	ZINC000450518138	CF	On-Demand	Anodyne	SRD5A1	35	40
CC[C@H](O)CC(=O)N1CCCCc2cc(OC)ccc21	ZINC000450518139	CF	On-Demand	Anodyne	SRD5A1	35	40
O=C(NCCCOCCO)c1ccc2cnccc2c1	ZINC000450518146	CD	On-Demand	Anodyne	PTAFR	16	43
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450518147	GG	On-Demand	Anodyne	ANPEP	41	42
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450518147	GG	On-Demand	Anodyne	CAPNS1	42	31
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450518147	GG	On-Demand	Anodyne	CAPN1	46	36
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450518147	GG	On-Demand	Anodyne	CAPN2	65	33
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450518147	GG	On-Demand	Anodyne	FPR1	59	34
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450518147	GG	On-Demand	Anodyne	NPR	59	33
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450518147	GG	On-Demand	Anodyne	PSMB5	43	31
C[C@H](O)CCCNC1(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450518150	CH	On-Demand	Anodyne	SLC6A2	18	43
C[C@H](O)CCCNC1(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450518150	CH	On-Demand	Anodyne	SLC6A3	22	43
C[C@@H](O)CCCNC1(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450518151	CH	On-Demand	Anodyne	SLC6A2	18	43
C[C@@H](O)CCCNC1(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450518151	CH	On-Demand	Anodyne	SLC6A3	22	43
C[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)CC(=O)O	ZINC000450518154	CD	On-Demand	Anodyne	CXCL8	17	41
C[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)CC(=O)O	ZINC000450518154	CD	On-Demand	Anodyne	SDH1	0	40
C[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)CC(=O)O	ZINC000450518155	CD	On-Demand	Anodyne	CXCL8	17	41
C[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)CC(=O)O	ZINC000450518155	CD	On-Demand	Anodyne	SDH1	0	40
O=C(Nc1ccccc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450518156	DH	On-Demand	Anodyne	CHRM1	15	40
O=C(Nc1ccccc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450518156	DH	On-Demand	Anodyne	DRD4	22	67
O=C(Nc1ccccc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450518156	DH	On-Demand	Anodyne	CHRM3	24	40
O=C(Nc1ccccc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450518156	DH	On-Demand	Anodyne	SIGMAR1	26	46
O=C(Nc1ccccc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450518156	DH	On-Demand	Anodyne	CCR3	56	51
O=C(Nc1ccccc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450518156	DH	On-Demand	Anodyne	EPHX2	49	44
O=C(Nc1ccccc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450518156	DH	On-Demand	Anodyne	CXCR3	32	81
O=C(Nc1ccccc1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450518156	DH	On-Demand	Anodyne	MCHR1	29	44
COC(=O)Cc1ccc(NCc2c(F)cccc2N2CCCC2)c([N+](=O)[O-])c1	ZINC000450518162	GH	On-Demand	Bother	KCNQ2	64	39
CC[C@H](O)CC(=O)N[C@H](CO)c1ccccc1	ZINC000450518182	BC	On-Demand	Anodyne	KCNA5	0	42
CC[C@H](O)CC(=O)N[C@H](CO)c1ccccc1	ZINC000450518182	BC	On-Demand	Anodyne	ACER2	0	42
CC[C@H](O)CC(=O)N[C@H](CO)c1ccccc1	ZINC000450518182	BC	On-Demand	Anodyne	GPR88	0	46
CC[C@H](O)CC(=O)N[C@H](CO)c1ccccc1	ZINC000450518182	BC	On-Demand	Anodyne	COL4A3BP	0	41
CC[C@@H](O)CC(=O)N[C@H](CO)c1ccccc1	ZINC000450518184	BC	On-Demand	Anodyne	KCNA5	0	42
CC[C@@H](O)CC(=O)N[C@H](CO)c1ccccc1	ZINC000450518184	BC	On-Demand	Anodyne	ACER2	0	42
CC[C@@H](O)CC(=O)N[C@H](CO)c1ccccc1	ZINC000450518184	BC	On-Demand	Anodyne	GPR88	0	46
CC[C@@H](O)CC(=O)N[C@H](CO)c1ccccc1	ZINC000450518184	BC	On-Demand	Anodyne	COL4A3BP	0	41
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1cc(C2CC2)no1	ZINC000450518229	EE	On-Demand	Anodyne	CPA1	29	47
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1cc(C2CC2)no1	ZINC000450518232	EE	On-Demand	Anodyne	CPA1	29	47
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)c3ccc(C#N)n3C)no2)cn1	ZINC000450518234	GE	On-Demand	Mild	COLA	41	47
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)c3ccc(C#N)n3C)no2)cn1	ZINC000450518234	GE	On-Demand	Mild	CPT1A	40	47
CCCc1cc(C(=O)N[C@@H](CO)C(=O)OCC)no1	ZINC000450518237	CC	On-Demand	Anodyne	P2RY12	40	34
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)c3ccc(C#N)n3C)no2)cn1	ZINC000450518238	GE	On-Demand	Mild	COLA	41	47
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)c3ccc(C#N)n3C)no2)cn1	ZINC000450518238	GE	On-Demand	Mild	CPT1A	40	47
COC(=O)c1csc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)n1	ZINC000450518239	FD	On-Demand	Anodyne	TRPC6	47	36
CCCc1cc(C(=O)N[C@H](CO)C(=O)OCC)no1	ZINC000450518241	CC	On-Demand	Anodyne	P2RY12	40	34
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ncsc1C(F)(F)F	ZINC000450518242	GF	On-Demand	Anodyne	CPA1	28	48
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ncsc1C(F)(F)F	ZINC000450518245	GF	On-Demand	Anodyne	CPA1	28	48
C[C@H](CNC(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)O	ZINC000450518246	DC	On-Demand	Bother	COLA	43	31
C[C@@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518248	CF	On-Demand	Anodyne	MME	66	37
C[C@@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518248	CF	On-Demand	Anodyne	ANPEP	54	33
C[C@@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518248	CF	On-Demand	Anodyne	TIMP3	66	35
C[C@@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518248	CF	On-Demand	Anodyne	ACE2	53	36
C[C@@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518248	CF	On-Demand	Anodyne	FPR1	37	40
C[C@@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518248	CF	On-Demand	Anodyne	SLC22A20	0	40
C[C@@H](CNC(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)O	ZINC000450518249	DC	On-Demand	Bother	COLA	43	31
C[C@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518250	CF	On-Demand	Anodyne	MME	66	37
C[C@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518250	CF	On-Demand	Anodyne	ANPEP	54	33
C[C@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518250	CF	On-Demand	Anodyne	TIMP3	66	35
C[C@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518250	CF	On-Demand	Anodyne	ACE2	53	36
C[C@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518250	CF	On-Demand	Anodyne	FPR1	37	40
C[C@H](Cc1ccc(NC(=O)C2(C)CC2)cc1)C(=O)O	ZINC000450518250	CF	On-Demand	Anodyne	SLC22A20	0	40
CN1CCC(Oc2ccc(CNc3nccc(-c4cnccn4)n3)cc2)CC1	ZINC000450518251	GG	On-Demand	Anodyne	DYRK1B	20	47
COCC1(C(=O)O)CCN(C(=O)Cc2c[nH]c3ccc(Cl)cc23)CC1	ZINC000450518257	FF	On-Demand	Anodyne	HTR1D	32	41
COCC1(C(=O)O)CCN(C(=O)Cc2c[nH]c3ccc(Cl)cc23)CC1	ZINC000450518257	FF	On-Demand	Anodyne	HTR1B	31	41
N#Cc1c(Cl)cccc1N[C@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC000450518264	EG	On-Demand	Mild	MLNR	34	43
N#Cc1c(Cl)cccc1N[C@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC000450518264	EG	On-Demand	Mild	GPR183	0	41
N#Cc1c(Cl)cccc1N[C@@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC000450518265	EG	On-Demand	Mild	MLNR	34	43
N#Cc1c(Cl)cccc1N[C@@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC000450518265	EG	On-Demand	Mild	GPR183	0	41
CC(C)CC(CC(C)C)C(=O)NC(CO)CO	ZINC000450518273	BD	On-Demand	Anodyne	MME	0	49
COC(=O)c1ccc(CN(C)C[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450518281	EG	On-Demand	Anodyne	POL	0	43
COC(=O)c1ccc(CN(C)C[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450518282	EG	On-Demand	Anodyne	POL	0	43
COC(=O)c1ccc(CN(C)C[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450518283	EG	On-Demand	Anodyne	POL	0	43
COC(=O)c1ccc(CN(C)C[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450518284	EG	On-Demand	Anodyne	POL	0	43
O=C(O)COc1cccc(CNC(=O)C2(Oc3ccccc3F)CC2)c1	ZINC000450518286	FF	On-Demand	Anodyne	FABP4	43	32
O=C(O)COc1cccc(CNC(=O)C2(Oc3ccccc3F)CC2)c1	ZINC000450518286	FF	On-Demand	Anodyne	PDS	59	37
O=C(O)[C@H](CNC(=O)[C@@H](c1ccccc1)C1CC1)Cc1cccc(F)c1	ZINC000450518292	FG	On-Demand	Anodyne	MME	42	47
O=C(O)[C@H](CNC(=O)[C@@H](c1ccccc1)C1CC1)Cc1cccc(F)c1	ZINC000450518292	FG	On-Demand	Anodyne	CPA1	51	38
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)[C@H](c1ccccc1)C1CC1	ZINC000450518293	FG	On-Demand	Anodyne	MME	42	47
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)[C@H](c1ccccc1)C1CC1	ZINC000450518293	FG	On-Demand	Anodyne	CPA1	51	38
O=C(O)[C@@H](CNC(=O)[C@@H](c1ccccc1)C1CC1)Cc1cccc(F)c1	ZINC000450518294	FG	On-Demand	Anodyne	MME	42	47
O=C(O)[C@@H](CNC(=O)[C@@H](c1ccccc1)C1CC1)Cc1cccc(F)c1	ZINC000450518294	FG	On-Demand	Anodyne	CPA1	51	38
O=C(O)[C@H](CNC(=O)[C@H](c1ccccc1)C1CC1)Cc1cccc(F)c1	ZINC000450518295	FG	On-Demand	Anodyne	MME	42	47
O=C(O)[C@H](CNC(=O)[C@H](c1ccccc1)C1CC1)Cc1cccc(F)c1	ZINC000450518295	FG	On-Demand	Anodyne	CPA1	51	38
O=C(NCC[C@@H]1CCCCO1)c1ccc(-c2ccncc2)c(F)c1	ZINC000450518299	EH	On-Demand	Anodyne	ROCK2	35	44
O=C(NCC[C@H]1CCCCO1)c1ccc(-c2ccncc2)c(F)c1	ZINC000450518300	EH	On-Demand	Anodyne	ROCK2	35	44
Cc1cnc(CCCC(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)o1	ZINC000450518304	GJ	On-Demand	Anodyne	KCNJ11	51	32
Cc1cnc(CCCC(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)o1	ZINC000450518304	GJ	On-Demand	Anodyne	SUCNR1	40	34
Cc1cnc(CCCC(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)o1	ZINC000450518305	GJ	On-Demand	Anodyne	KCNJ11	51	32
Cc1cnc(CCCC(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)o1	ZINC000450518305	GJ	On-Demand	Anodyne	SUCNR1	40	34
CCc1cc(CCCN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)on1	ZINC000450518328	GH	On-Demand	Anodyne	F10	27	46
Cc1ccc(NC(=O)C2CCN(Cc3c(C)cccc3Cl)CC2)nc1	ZINC000450518334	FI	On-Demand	Anodyne	DRD4	25	45
Cc1ccc(NC(=O)C2CCN(Cc3c(C)cccc3Cl)CC2)nc1	ZINC000450518334	FI	On-Demand	Anodyne	EPHX2	29	40
Cc1ccc(NC(=O)C2CCN(Cc3c(C)cccc3Cl)CC2)nc1	ZINC000450518334	FI	On-Demand	Anodyne	TYK2	46	36
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450518340	GH	On-Demand	Anodyne	F10	42	56
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450518341	GH	On-Demand	Anodyne	F10	42	56
COc1cccc(OCCC(=O)N[C@H](C)c2cccc(F)c2F)c1	ZINC000450518350	EH	On-Demand	Anodyne	MTNR1A	38	52
COc1cccc(OCCC(=O)N[C@H](C)c2cccc(F)c2F)c1	ZINC000450518350	EH	On-Demand	Anodyne	MTNR1B	39	52
COc1cccc(OCCC(=O)N[C@@H](C)c2cccc(F)c2F)c1	ZINC000450518351	EH	On-Demand	Anodyne	MTNR1A	38	52
COc1cccc(OCCC(=O)N[C@@H](C)c2cccc(F)c2F)c1	ZINC000450518351	EH	On-Demand	Anodyne	MTNR1B	39	52
CCS(=O)(=O)c1ccc(CN(c2ccccc2)C(C)C)cc1	ZINC000450518356	DH	On-Demand	Anodyne	TAAR1	18	42
CCS(=O)(=O)c1ccc(CN(c2ccccc2)C(C)C)cc1	ZINC000450518356	DH	On-Demand	Anodyne	RORC	47	47
CCS(=O)(=O)c1ccc(CN(c2ccccc2)C(C)C)cc1	ZINC000450518356	DH	On-Demand	Anodyne	RORB	0	41
Cc1cncc(-c2nc(CN3CCC[C@H](C(=O)Nc4cccc(C)n4)C3)no2)c1	ZINC000450518358	GF	On-Demand	Anodyne	PDE8A	0	44
Cc1cncc(-c2nc(CN3CCC[C@@H](C(=O)Nc4cccc(C)n4)C3)no2)c1	ZINC000450518359	GF	On-Demand	Anodyne	PDE8A	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450518360	GG	On-Demand	Anodyne	CCR1	23	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450518360	GG	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450518361	GG	On-Demand	Anodyne	CCR1	23	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450518361	GG	On-Demand	Anodyne	RHODESAIN	0	42
O=C1CC[C@H](CN[C@H](C(=O)Nc2ccccc2)c2ccccc2)CCN1	ZINC000450518375	FF	On-Demand	Anodyne	HDAC11	48	39
O=C1CC[C@H](CN[C@@H](C(=O)Nc2ccccc2)c2ccccc2)CCN1	ZINC000450518376	FF	On-Demand	Anodyne	HDAC11	48	39
O=C1CC[C@@H](CN[C@@H](C(=O)Nc2ccccc2)c2ccccc2)CCN1	ZINC000450518377	FF	On-Demand	Anodyne	HDAC11	48	39
O=C1CC[C@@H](CN[C@H](C(=O)Nc2ccccc2)c2ccccc2)CCN1	ZINC000450518378	FF	On-Demand	Anodyne	HDAC11	48	39
C[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)[C@H]1CCCN(C2CCC2)C1	ZINC000450518383	FG	On-Demand	Anodyne	BIRC3	40	36
C[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)[C@H]1CCCN(C2CCC2)C1	ZINC000450518383	FG	On-Demand	Anodyne	L3MBTL3	46	32
C[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)[C@H]1CCCN(C2CCC2)C1	ZINC000450518386	FG	On-Demand	Anodyne	BIRC3	40	36
C[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)[C@H]1CCCN(C2CCC2)C1	ZINC000450518386	FG	On-Demand	Anodyne	L3MBTL3	46	32
C[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450518387	FG	On-Demand	Anodyne	BIRC3	40	36
C[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450518387	FG	On-Demand	Anodyne	L3MBTL3	46	32
C[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450518388	FG	On-Demand	Anodyne	BIRC3	40	36
C[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450518388	FG	On-Demand	Anodyne	L3MBTL3	46	32
Cc1nn(C)cc1CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450518394	DE	On-Demand	Anodyne	P2RX7	27	46
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450518401	DD	On-Demand	Anodyne	SLC6A1	71	35
CCc1ccc2nccc(N3CCC[C@@](O)(C(=O)N4CCCC4)C3)c2c1	ZINC000450518404	FF	On-Demand	Anodyne	ECE2	0	40
CCc1ccc2nccc(N3CCC[C@](O)(C(=O)N4CCCC4)C3)c2c1	ZINC000450518405	FF	On-Demand	Anodyne	ECE2	0	40
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450518407	DD	On-Demand	Anodyne	SLC6A1	71	35
COc1cccc(CCC(=O)N(CC(=O)O)Cc2ccc(F)c(F)c2)c1F	ZINC000450518411	GG	On-Demand	Anodyne	GYS1	31	47
CCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518418	CE	On-Demand	Anodyne	AVPR1A	0	45
CCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518418	CE	On-Demand	Anodyne	LTA4H	43	37
CCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518418	CE	On-Demand	Anodyne	CDC25B	22	40
CCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518418	CE	On-Demand	Anodyne	ACE2	66	37
CCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518418	CE	On-Demand	Anodyne	NOD1	72	36
CCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518419	CE	On-Demand	Anodyne	AVPR1A	0	45
CCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518419	CE	On-Demand	Anodyne	LTA4H	43	37
CCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518419	CE	On-Demand	Anodyne	CDC25B	22	40
CCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518419	CE	On-Demand	Anodyne	ACE2	66	37
CCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450518419	CE	On-Demand	Anodyne	NOD1	72	36
COC(=O)c1csc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)n1	ZINC000450518425	GH	On-Demand	Anodyne	HTR1A	16	49
COC(=O)c1csc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)n1	ZINC000450518425	GH	On-Demand	Anodyne	HTR1D	20	49
COC(=O)c1csc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)n1	ZINC000450518425	GH	On-Demand	Anodyne	HTR1B	15	45
COC(=O)c1csc(CN2CC=C(c3c[nH]c4ccc(OC)cc34)CC2)n1	ZINC000450518425	GH	On-Demand	Anodyne	SLC6A4	22	54
CC(=O)NC[C@H](CC(=O)NCc1cn(-c2ccccc2)nc1C)CC(C)C	ZINC000450518427	FF	On-Demand	Anodyne	P2RX7	18	49
COCc1cccc(CC(=O)N2CCC(COC)(C(=O)O)CC2)c1	ZINC000450518436	ED	On-Demand	Anodyne	GPR183	0	41
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CCCCC2)cc1OC	ZINC000450518437	FG	On-Demand	Anodyne	HTR4	30	42
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CCCCC2)cc1OC	ZINC000450518437	FG	On-Demand	Anodyne	P2RX7	20	43
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CCCCC2)cc1OC	ZINC000450518437	FG	On-Demand	Anodyne	KCNA3	41	41
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CCCCC2)cc1OC	ZINC000450518437	FG	On-Demand	Anodyne	HCN1	59	41
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CCCCC2)cc1OC	ZINC000450518437	FG	On-Demand	Anodyne	HCN4	56	41
CC[C@@H]1C[C@H]1C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450518438	CF	On-Demand	Anodyne	P2RX7	23	48
O=C(NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)[C@@H](O)C1CCC1	ZINC000450518447	FC	On-Demand	Anodyne	L3MBTL3	42	33
O=C(NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)[C@@H](O)C1CCC1	ZINC000450518448	FC	On-Demand	Anodyne	L3MBTL3	42	33
O=C(NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)[C@H](O)C1CCC1	ZINC000450518449	FC	On-Demand	Anodyne	L3MBTL3	42	33
O=C(NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)[C@H](O)C1CCC1	ZINC000450518450	FC	On-Demand	Anodyne	L3MBTL3	42	33
N#CC1(CNC2(c3ccc(Cl)c(Cl)c3)CC2)CCC1	ZINC000450518455	CI	On-Demand	Mild	SLC6A3	0	46
Cc1cc(C)c(C(=O)O)cc1NC(=O)C1(Oc2ccccc2F)CC1	ZINC000450518466	EH	On-Demand	Anodyne	FABH	0	41
CCOCc1nc(C)c(C(=O)NCc2cn(-c3ccccc3)nc2C)s1	ZINC000450518467	FG	On-Demand	Anodyne	SCD1	43	41
CCOCc1nc(C)c(C(=O)NCc2cn(-c3ccccc3)nc2C)s1	ZINC000450518467	FG	On-Demand	Anodyne	SCD	37	41
CC(C)(C)C(=O)CCCC(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450518469	DE	On-Demand	Anodyne	LUXR	44	34
CC(C)(C)C(=O)CCCC(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450518470	DE	On-Demand	Anodyne	LUXR	44	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518485	GG	On-Demand	Anodyne	MME	82	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518485	GG	On-Demand	Anodyne	FCER2	40	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518485	GG	On-Demand	Anodyne	PAPA1_CARPA	50	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518485	GG	On-Demand	Anodyne	SOAT1	24	47
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518485	GG	On-Demand	Anodyne	CAPN2	44	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518485	GG	On-Demand	Anodyne	ACE2	44	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518485	GG	On-Demand	Anodyne	AMP1_PLAFQ	48	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518486	GG	On-Demand	Anodyne	MME	82	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518486	GG	On-Demand	Anodyne	FCER2	40	31
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518486	GG	On-Demand	Anodyne	PAPA1_CARPA	50	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518486	GG	On-Demand	Anodyne	SOAT1	24	47
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518486	GG	On-Demand	Anodyne	CAPN2	44	31
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518486	GG	On-Demand	Anodyne	ACE2	44	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1Br	ZINC000450518486	GG	On-Demand	Anodyne	AMP1_PLAFQ	48	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518487	GG	On-Demand	Anodyne	MME	82	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518487	GG	On-Demand	Anodyne	FCER2	40	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518487	GG	On-Demand	Anodyne	PAPA1_CARPA	50	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518487	GG	On-Demand	Anodyne	SOAT1	24	47
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518487	GG	On-Demand	Anodyne	CAPN2	44	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518487	GG	On-Demand	Anodyne	ACE2	44	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518487	GG	On-Demand	Anodyne	AMP1_PLAFQ	48	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518488	GG	On-Demand	Anodyne	MME	82	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518488	GG	On-Demand	Anodyne	FCER2	40	31
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518488	GG	On-Demand	Anodyne	PAPA1_CARPA	50	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518488	GG	On-Demand	Anodyne	SOAT1	24	47
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518488	GG	On-Demand	Anodyne	CAPN2	44	31
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518488	GG	On-Demand	Anodyne	ACE2	44	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1Br	ZINC000450518488	GG	On-Demand	Anodyne	AMP1_PLAFQ	48	34
COc1ccccc1Oc1ccc(C(=O)NC(CO)CO)nc1	ZINC000450518497	DC	On-Demand	Anodyne	PDGFRA	48	34
Cc1ccc([C@H](CNC(=O)Cc2ccccc2S(C)(=O)=O)C(=O)O)cc1	ZINC000450518503	GD	On-Demand	Anodyne	MME	19	43
Cc1ccc([C@H](CNC(=O)Cc2ccccc2S(C)(=O)=O)C(=O)O)cc1	ZINC000450518503	GD	On-Demand	Anodyne	ITGAV	42	37
Cc1ccc([C@@H](CNC(=O)Cc2ccccc2S(C)(=O)=O)C(=O)O)cc1	ZINC000450518504	GD	On-Demand	Anodyne	MME	19	43
Cc1ccc([C@@H](CNC(=O)Cc2ccccc2S(C)(=O)=O)C(=O)O)cc1	ZINC000450518504	GD	On-Demand	Anodyne	ITGAV	42	37
O=C(NCC[C@@H]1CCCCO1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450518506	FH	On-Demand	Anodyne	PYGL	44	45
O=C(NCC[C@@H]1CCCCO1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450518506	FH	On-Demand	Anodyne	PLD2	43	33
O=C(NCC[C@H]1CCCCO1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450518507	FH	On-Demand	Anodyne	PYGL	44	45
O=C(NCC[C@H]1CCCCO1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450518507	FH	On-Demand	Anodyne	PLD2	43	33
COc1ccc(C(=O)NCc2ccc(C(=O)O)o2)c(OC2CCCC2)c1	ZINC000450518508	FG	On-Demand	Anodyne	PDE4B	19	41
COc1cc(CC(=O)NCCCOCCO)ccc1Cl	ZINC000450518520	DD	On-Demand	Anodyne	TRPV1	27	51
COc1cc(CC(=O)NCCCOCCO)ccc1Cl	ZINC000450518520	DD	On-Demand	Anodyne	NCE103	30	51
CC(C)(C(=O)O)c1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450518524	GJ	On-Demand	Anodyne	TRPV1	18	46
CN(C)S(=O)(=O)CC(=O)Nc1ccc(C(C)(C)C(=O)O)cc1	ZINC000450518534	EC	On-Demand	Anodyne	PSBA	0	41
COC(=O)c1ccc(CN(C)Cc2ccc(C(C)=O)cc2)cc1	ZINC000450518535	DG	On-Demand	Anodyne	ACR	41	35
CC(C)c1cc(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)no1	ZINC000450518543	EF	On-Demand	Anodyne	CPA1	36	50
CC(C)c1cc(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)no1	ZINC000450518544	EF	On-Demand	Anodyne	CPA1	36	50
CCc1cccc(C(=O)NCCCOCCO)n1	ZINC000450518561	CC	On-Demand	Anodyne	PDE5A	25	44
CCCOc1ccc(C(=O)Nc2cccnc2OCC(F)F)c(OC)c1	ZINC000450518567	FH	On-Demand	Anodyne	P2RY1	46	38
CC(C)CCN(CC[C@H](C)O)c1c(O)nc(=O)n(Cc2ccccc2)c1N	ZINC000450518568	FE	On-Demand	Anodyne	TLR7	21	41
CC(C)CCN(CC[C@@H](C)O)c1c(O)nc(=O)n(Cc2ccccc2)c1N	ZINC000450518569	FE	On-Demand	Anodyne	TLR7	21	41
COc1ccc(-c2ccnc(N3CCC4(CCOCC4)CC3)n2)cc1	ZINC000450518576	EH	On-Demand	Anodyne	DKK1	0	40
COc1ccc(-c2ccnc(N3CCC4(CCOCC4)CC3)n2)cc1	ZINC000450518576	EH	On-Demand	Anodyne	SMG1	40	32
CCS(=O)(=O)c1ccc(CN2CCCc3cccc(OC)c32)cc1	ZINC000450518580	EG	On-Demand	Anodyne	TYMS	0	40
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cccnc1OCC(F)F	ZINC000450518582	FG	On-Demand	Anodyne	P2RY1	52	42
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cccnc1OCC(F)F	ZINC000450518583	FG	On-Demand	Anodyne	P2RY1	52	42
COc1cccc(C(=O)NC[C@H](CC(C)C)C(=O)O)c1[N+](=O)[O-]	ZINC000450518584	DE	On-Demand	Bother	KCNA3	30	46
COc1cccc(C(=O)NC[C@@H](CC(C)C)C(=O)O)c1[N+](=O)[O-]	ZINC000450518585	DE	On-Demand	Bother	KCNA3	30	46
COc1cccc(C(=O)NC[C@H](Cc2cccc(C)c2)C(=O)O)c1[N+](=O)[O-]	ZINC000450518592	FF	On-Demand	Bother	CPA1	29	47
COc1cccc(C(=O)NC[C@@H](Cc2cccc(C)c2)C(=O)O)c1[N+](=O)[O-]	ZINC000450518593	FF	On-Demand	Bother	CPA1	29	47
COC(=O)C1(CNC2(c3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450518603	DH	On-Demand	Anodyne	SLC6A2	21	41
COC(=O)C1(CNC2(c3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450518603	DH	On-Demand	Anodyne	SLC6A4	0	43
COC(=O)C1(CNC2(c3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450518603	DH	On-Demand	Anodyne	SLC6A3	24	43
COC(=O)C1(CNC2(c3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450518603	DH	On-Demand	Anodyne	NET	0	43
COc1cccc(Oc2ccc(C(=O)NCCN3CCNC(=O)C3)nc2)c1	ZINC000450518616	FD	On-Demand	Anodyne	DRD4	55	42
COC(=O)CCN1CC[C@H](NC(=O)[C@H](O)C2CCC2)C1=O	ZINC000450518619	CB	On-Demand	Anodyne	BIRC2	55	32
COC(=O)CCN1CC[C@H](NC(=O)[C@@H](O)C2CCC2)C1=O	ZINC000450518620	CB	On-Demand	Anodyne	BIRC2	55	32
COC(=O)CCN1CC[C@@H](NC(=O)[C@@H](O)C2CCC2)C1=O	ZINC000450518621	CB	On-Demand	Anodyne	BIRC2	55	32
COC(=O)CCN1CC[C@@H](NC(=O)[C@H](O)C2CCC2)C1=O	ZINC000450518622	CB	On-Demand	Anodyne	BIRC2	55	32
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	DRD2	22	43
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	HTR2A	22	46
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	SLC6A1	60	37
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	HTR7	18	43
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	SIGMAR1	38	55
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	CCR3	60	49
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	CCR5	20	49
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450518623	FI	On-Demand	Anodyne	CACNA1G	65	51
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	DRD2	22	43
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	HTR2A	22	46
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	SLC6A1	60	37
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	HTR7	18	43
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	SIGMAR1	38	55
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	CCR3	60	49
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	CCR5	20	49
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1ccc(F)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450518624	FI	On-Demand	Anodyne	CACNA1G	65	51
COc1ccc(-c2ccnc(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)n2)cc1	ZINC000450518628	GE	On-Demand	Anodyne	PIK3CA	15	47
COc1ccc(-c2ccnc(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)n2)cc1	ZINC000450518628	GE	On-Demand	Anodyne	MTOR	17	45
COc1ccc(-c2ccnc(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)n2)cc1	ZINC000450518628	GE	On-Demand	Anodyne	NPBWR1	40	32
O=C(CCCc1cc(F)ccc1F)NC[C@H](Oc1ccc(F)cc1)C(=O)O	ZINC000450518637	GG	On-Demand	Anodyne	MPO	32	40
O=C(CCCc1cc(F)ccc1F)NC[C@@H](Oc1ccc(F)cc1)C(=O)O	ZINC000450518639	GG	On-Demand	Anodyne	MPO	32	40
CCSc1cccnc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450518647	FF	On-Demand	Anodyne	MCHR1	15	42
CCSc1cccnc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450518649	FF	On-Demand	Anodyne	MCHR1	15	42
COC(=O)c1ccc(CN2CCC(N(C)S(C)(=O)=O)CC2)cc1Cl	ZINC000450518664	FD	On-Demand	Anodyne	AVPR1B	40	32
COC(=O)c1ccc(CN2CCC(N(C)S(C)(=O)=O)CC2)cc1Cl	ZINC000450518664	FD	On-Demand	Anodyne	SIGMAR1	31	43
COC(=O)c1ccc(CN2CCC(N(C)S(C)(=O)=O)CC2)cc1Cl	ZINC000450518664	FD	On-Demand	Anodyne	SSTR5	46	35
COC(=O)c1ccc(CN2CCC(N(C)S(C)(=O)=O)CC2)cc1Cl	ZINC000450518664	FD	On-Demand	Anodyne	CCR3	34	44
COC(=O)c1ccc(CN2CCC(N(C)S(C)(=O)=O)CC2)cc1Cl	ZINC000450518664	FD	On-Demand	Anodyne	MCHR1	47	45
COc1cc(CC(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518669	FH	On-Demand	Anodyne	TRPV1	39	47
COc1cc(CC(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518669	FH	On-Demand	Anodyne	P2RX7	0	45
COc1cc(CC(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518669	FH	On-Demand	Anodyne	NCE103	27	40
COc1cc(CC(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518669	FH	On-Demand	Anodyne	MTCA1	15	40
COc1cc(CC(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518669	FH	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518670	FH	On-Demand	Anodyne	TRPV1	39	47
COc1cc(CC(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518670	FH	On-Demand	Anodyne	P2RX7	0	45
COc1cc(CC(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518670	FH	On-Demand	Anodyne	NCE103	27	40
COc1cc(CC(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518670	FH	On-Demand	Anodyne	MTCA1	15	40
COc1cc(CC(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)ccc1O	ZINC000450518670	FH	On-Demand	Anodyne	CAN2	0	40
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccccc1	ZINC000450518673	EI	On-Demand	Anodyne	KCNQ2	69	35
CC(=O)Nc1cccc2c1CCCN2CCCC(=O)c1ccccc1	ZINC000450518673	EI	On-Demand	Anodyne	CYP2J2	53	38
Cc1ccc(C(=O)N2CC[C@@](C)(F)C2)cc1C(=O)N1CC[C@](C)(F)C1	ZINC000450518681	FG	On-Demand	Anodyne	RXRG	50	38
Cc1ccc(C(=O)N2CC[C@@](C)(F)C2)cc1C(=O)N1CC[C@](C)(F)C1	ZINC000450518681	FG	On-Demand	Anodyne	RXRB	43	38
Cc1ccc(C(=O)N2CC[C@](C)(F)C2)cc1C(=O)N1CC[C@](C)(F)C1	ZINC000450518682	FG	On-Demand	Anodyne	RXRG	50	38
Cc1ccc(C(=O)N2CC[C@](C)(F)C2)cc1C(=O)N1CC[C@](C)(F)C1	ZINC000450518682	FG	On-Demand	Anodyne	RXRB	43	38
Cc1ccc(C(=O)N2CC[C@](C)(F)C2)cc1C(=O)N1CC[C@@](C)(F)C1	ZINC000450518683	FG	On-Demand	Anodyne	RXRG	50	38
Cc1ccc(C(=O)N2CC[C@](C)(F)C2)cc1C(=O)N1CC[C@@](C)(F)C1	ZINC000450518683	FG	On-Demand	Anodyne	RXRB	43	38
COCC1(C(=O)O)CCN(C(=O)CCCc2cccc(C(F)(F)F)c2)CC1	ZINC000450518684	GG	On-Demand	Anodyne	TACR1	19	47
COCC1(C(=O)O)CCN(C(=O)CCCc2cccc(C(F)(F)F)c2)CC1	ZINC000450518684	GG	On-Demand	Anodyne	SCD1	25	40
Cc1ccc(C(=O)N2CC[C@@](C)(F)C2)cc1C(=O)N1CC[C@@](C)(F)C1	ZINC000450518685	FG	On-Demand	Anodyne	RXRG	50	38
Cc1ccc(C(=O)N2CC[C@@](C)(F)C2)cc1C(=O)N1CC[C@@](C)(F)C1	ZINC000450518685	FG	On-Demand	Anodyne	RXRB	43	38
COC[C@H](CNC(=O)c1ccc(-c2ccncc2)c(F)c1)OC	ZINC000450518690	DE	On-Demand	Anodyne	F3	65	32
COC[C@@H](CNC(=O)c1ccc(-c2ccncc2)c(F)c1)OC	ZINC000450518691	DE	On-Demand	Anodyne	F3	65	32
Cc1ccc2c(C3=CCN(CCc4cscn4)CC3)c[nH]c2c1	ZINC000450518697	DI	On-Demand	Anodyne	SLC6A4	16	48
COc1ccc2[nH]cc(C3=CCN(Cc4ccc(C(C)=O)cc4)CC3)c2c1	ZINC000450518698	FJ	On-Demand	Anodyne	HTR1A	20	52
COc1ccc2[nH]cc(C3=CCN(Cc4ccc(C(C)=O)cc4)CC3)c2c1	ZINC000450518698	FJ	On-Demand	Anodyne	HTR1D	31	57
COc1ccc2[nH]cc(C3=CCN(Cc4ccc(C(C)=O)cc4)CC3)c2c1	ZINC000450518698	FJ	On-Demand	Anodyne	HTR1B	24	57
COc1ccc2[nH]cc(C3=CCN(Cc4ccc(C(C)=O)cc4)CC3)c2c1	ZINC000450518698	FJ	On-Demand	Anodyne	SLC6A4	20	59
COc1ccc2[nH]cc(C3=CCN(Cc4ccc(C(C)=O)cc4)CC3)c2c1	ZINC000450518698	FJ	On-Demand	Anodyne	MTNR1A	17	40
COc1ccc2[nH]cc(C3=CCN(Cc4ccc(C(C)=O)cc4)CC3)c2c1	ZINC000450518698	FJ	On-Demand	Anodyne	MTNR1B	15	40
CC(C)N1C(=O)N[C@@H]2CN(c3nccc4cc(C(F)(F)F)ccc34)CC[C@@H]21	ZINC000450518703	GH	On-Demand	Anodyne	LIPG	49	33
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450518706	FH	On-Demand	Anodyne	F10	27	50
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450518706	FH	On-Demand	Anodyne	NPY5R	30	44
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450518707	FH	On-Demand	Anodyne	F10	27	50
O=C(Nc1ccc(Cl)cn1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450518707	FH	On-Demand	Anodyne	NPY5R	30	44
COc1cc(Cl)c(C(=O)N(C[C@@H](C)C(=O)O)C2CC2)cc1OC	ZINC000450518713	EF	On-Demand	Anodyne	HTR4	45	35
COc1cc(Cl)c(C(=O)N(C[C@H](C)C(=O)O)C2CC2)cc1OC	ZINC000450518714	EF	On-Demand	Anodyne	HTR4	45	35
COc1cccc(C(=O)NC[C@H](C)CC(=O)O)c1[N+](=O)[O-]	ZINC000450518724	CD	On-Demand	Bother	KCNA3	32	48
COc1cccc(C(=O)NC[C@@H](C)CC(=O)O)c1[N+](=O)[O-]	ZINC000450518726	CD	On-Demand	Bother	KCNA3	32	48
CC(=O)c1cccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1	ZINC000450518728	FH	On-Demand	Anodyne	DRD2	20	44
CC(=O)c1cccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1	ZINC000450518728	FH	On-Demand	Anodyne	DRD4	46	44
CC(=O)c1cccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1	ZINC000450518728	FH	On-Demand	Anodyne	ACHE	26	42
CC(=O)c1cccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1	ZINC000450518728	FH	On-Demand	Anodyne	CHRM3	21	42
CC(=O)c1cccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1	ZINC000450518728	FH	On-Demand	Anodyne	VACHT_TETCF	0	40
CC(=O)c1cccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1	ZINC000450518728	FH	On-Demand	Anodyne	SIGMAR1	40	65
CC(=O)c1cccc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1	ZINC000450518728	FH	On-Demand	Anodyne	NOD2	40	35
COc1cc(Cl)c(C(=O)N[C@@H](C(=O)O)[C@H]2CCCOC2)cc1OC	ZINC000450518729	FD	On-Demand	Anodyne	NTSR2	38	41
COc1cc(Cl)c(C(=O)N[C@H](C(=O)O)[C@@H]2CCCOC2)cc1OC	ZINC000450518730	FD	On-Demand	Anodyne	NTSR2	38	41
COc1cc(Cl)c(C(=O)N[C@H](C(=O)O)[C@H]2CCCOC2)cc1OC	ZINC000450518731	FD	On-Demand	Anodyne	NTSR2	38	41
COc1cc(Cl)c(C(=O)N[C@@H](C(=O)O)[C@@H]2CCCOC2)cc1OC	ZINC000450518733	FD	On-Demand	Anodyne	NTSR2	38	41
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	PPARA	17	45
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	COLA	59	36
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	CPT1A	56	36
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	CPT2	42	32
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	PPARD	17	42
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	GRM4	21	41
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	PLAU	41	33
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	CPT1B	47	36
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	ENPP1	56	33
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	SMO	30	52
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	Q25615_ONCVO	43	35
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	GLMU	0	41
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	KCNK3	52	41
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@@H](C)C(=O)O)cc2)cc1OC	ZINC000450518735	GH	On-Demand	Anodyne	KCNK9	44	41
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	PPARA	17	45
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	COLA	59	36
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	CPT1A	56	36
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	CPT2	42	32
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	PPARD	17	42
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	GRM4	21	41
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	PLAU	41	33
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	CPT1B	47	36
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	ENPP1	56	33
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	SMO	30	52
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	Q25615_ONCVO	43	35
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	GLMU	0	41
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	KCNK3	52	41
COc1cc(Cl)c(C(=O)Nc2ccc(C[C@H](C)C(=O)O)cc2)cc1OC	ZINC000450518736	GH	On-Demand	Anodyne	KCNK9	44	41
CCCC[C@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450518751	DD	On-Demand	Bother	CCR3	25	41
CCCC[C@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450518751	DD	On-Demand	Bother	NOD1	58	34
CCCC[C@@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450518752	DD	On-Demand	Bother	CCR3	25	41
CCCC[C@@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450518752	DD	On-Demand	Bother	NOD1	58	34
COc1cc(Cl)c(C(=O)N(CCCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450518753	GH	On-Demand	Anodyne	FFAR2	55	38
C[C@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518754	EE	On-Demand	Anodyne	ALOX5	22	54
C[C@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518754	EE	On-Demand	Anodyne	LTA4H	35	45
C[C@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518754	EE	On-Demand	Anodyne	HRAS	56	39
C[C@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518754	EE	On-Demand	Anodyne	CACNA1B	23	41
C[C@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518754	EE	On-Demand	Anodyne	ACE2	30	43
C[C@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518754	EE	On-Demand	Anodyne	ADAMTS4	48	42
C[C@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518754	EE	On-Demand	Anodyne	FFAR1	44	44
C[C@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518754	EE	On-Demand	Anodyne	Q6PRC7_IXORI	47	35
C[C@@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518755	EE	On-Demand	Anodyne	ALOX5	22	54
C[C@@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518755	EE	On-Demand	Anodyne	LTA4H	35	45
C[C@@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518755	EE	On-Demand	Anodyne	HRAS	56	39
C[C@@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518755	EE	On-Demand	Anodyne	CACNA1B	23	41
C[C@@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518755	EE	On-Demand	Anodyne	ACE2	30	43
C[C@@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518755	EE	On-Demand	Anodyne	ADAMTS4	48	42
C[C@@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518755	EE	On-Demand	Anodyne	FFAR1	44	44
C[C@@H](O)CCN(CC(N)=O)Cc1ccc(OCc2ccccc2)cc1	ZINC000450518755	EE	On-Demand	Anodyne	Q6PRC7_IXORI	47	35
CCN(CC[C@@H](C)O)c1cccc(OC)c1	ZINC000450518756	BE	On-Demand	Anodyne	CETP	0	40
CCN(CC[C@@H](C)O)c1cccc(OC)c1	ZINC000450518756	BE	On-Demand	Anodyne	MTNR1B	27	45
CCN(CC[C@H](C)O)c1cccc(OC)c1	ZINC000450518757	BE	On-Demand	Anodyne	CETP	0	40
CCN(CC[C@H](C)O)c1cccc(OC)c1	ZINC000450518757	BE	On-Demand	Anodyne	MTNR1B	27	45
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	CCKAR	44	46
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	PYGL	82	49
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	TUBB2B	51	52
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	NS3	0	57
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	FLT3	0	50
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	PIN1	35	42
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	PYK	22	42
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	NOD1	45	32
CCC[C@@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518760	CE	On-Demand	Anodyne	SLC46A1	40	31
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	CCKAR	44	46
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	PYGL	82	49
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	TUBB2B	51	52
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	NS3	0	57
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	FLT3	0	50
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	PIN1	35	42
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	PYK	22	42
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	NOD1	45	32
CCC[C@H](NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450518761	CE	On-Demand	Anodyne	SLC46A1	40	31
C[C@@H](NC(=O)[C@]1(C)CC=CCC1)c1cccc(F)c1F	ZINC000450518762	CH	On-Demand	Anodyne	SDH1	0	45
C[C@@H](NC(=O)[C@@]1(C)CC=CCC1)c1cccc(F)c1F	ZINC000450518763	CH	On-Demand	Anodyne	SDH1	0	45
C[C@H](NC(=O)[C@]1(C)CC=CCC1)c1cccc(F)c1F	ZINC000450518764	CH	On-Demand	Anodyne	SDH1	0	45
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)c1cccc(F)c1F	ZINC000450518766	CH	On-Demand	Anodyne	SDH1	0	45
O=C(CC[C@@H]1CCOC1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450518769	EE	On-Demand	Anodyne	ECE1	50	39
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	DRD2	19	47
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	DRD4	42	39
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	DRD3	0	42
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	OPRK1	0	40
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	SIGMAR1	33	49
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	TRY2_BOVIN	41	34
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	NPY2R	15	40
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	FAAH	26	42
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	MGLL	0	43
CC(=O)c1cccc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)c1	ZINC000450518772	FG	On-Demand	Anodyne	GPR183	0	42
O=C(CC[C@@H]1CCOC1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450518774	EE	On-Demand	Anodyne	ECE1	50	39
O=C(CC[C@H]1CCOC1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450518776	EE	On-Demand	Anodyne	ECE1	50	39
O=C(CC[C@H]1CCOC1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450518778	EE	On-Demand	Anodyne	ECE1	50	39
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450518789	DF	On-Demand	Anodyne	P2RX7	50	36
COc1ccc(C(=O)N2C[C@@H](C(=O)O)O[C@H](C)C2)c(OC2CCCC2)c1	ZINC000450518790	FE	On-Demand	Anodyne	PDE4B	15	41
COc1ccc(C(=O)N2C[C@@H](C)O[C@@H](C(=O)O)C2)c(OC2CCCC2)c1	ZINC000450518791	FE	On-Demand	Anodyne	PDE4B	15	41
CN(CCN1CCC(C(=O)N2CCc3ccccc32)CC1)Cc1ccccc1	ZINC000450518798	GG	On-Demand	Anodyne	CHRM1	15	42
CN(CCN1CCC(C(=O)N2CCc3ccccc32)CC1)Cc1ccccc1	ZINC000450518798	GG	On-Demand	Anodyne	DRD4	19	42
CN(CCN1CCC(C(=O)N2CCc3ccccc32)CC1)Cc1ccccc1	ZINC000450518798	GG	On-Demand	Anodyne	ACHE	19	42
CN(CCN1CCC(C(=O)N2CCc3ccccc32)CC1)Cc1ccccc1	ZINC000450518798	GG	On-Demand	Anodyne	HTR2A	18	41
CN(CCN1CCC(C(=O)N2CCc3ccccc32)CC1)Cc1ccccc1	ZINC000450518798	GG	On-Demand	Anodyne	SIGMAR1	50	61
CN(CCN1CCC(C(=O)N2CCc3ccccc32)CC1)Cc1ccccc1	ZINC000450518798	GG	On-Demand	Anodyne	CCR5	31	41
CN(CCN1CCC(C(=O)N2CCc3ccccc32)CC1)Cc1ccccc1	ZINC000450518798	GG	On-Demand	Anodyne	CYP2J2	42	30
Cc1nn(-c2ccccc2)cc1CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450518799	GG	On-Demand	Anodyne	DGAT1	0	46
O=C(NCC[C@@H]1CCCCO1)c1cccc2c1CCCC2	ZINC000450518810	CG	On-Demand	Anodyne	FABP4	44	35
O=C(NCC[C@H]1CCCCO1)c1cccc2c1CCCC2	ZINC000450518811	CG	On-Demand	Anodyne	FABP4	44	35
CC(C)CCCC(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518828	FH	On-Demand	Anodyne	COLA	103	49
CC(C)CCCC(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518828	FH	On-Demand	Anodyne	CPT1A	85	49
CC(C)CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518829	FH	On-Demand	Anodyne	COLA	103	49
CC(C)CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518829	FH	On-Demand	Anodyne	CPT1A	85	49
COc1ccc(C(=O)N2CCO[C@@H](CC(=O)O)C2)c(OC2CCCC2)c1	ZINC000450518839	FE	On-Demand	Anodyne	RORC	43	36
COc1ccc(C(=O)N2CCO[C@H](CC(=O)O)C2)c(OC2CCCC2)c1	ZINC000450518840	FE	On-Demand	Anodyne	RORC	43	36
C[C@H](CN1CCN(C(=O)NC2CCCCC2)CC1)S(C)(=O)=O	ZINC000450518850	ED	On-Demand	Anodyne	EPHX2	28	42
C[C@@H](CN1CCN(C(=O)NC2CCCCC2)CC1)S(C)(=O)=O	ZINC000450518851	ED	On-Demand	Anodyne	EPHX2	28	42
CC(C)C[C@@H](CNC(=O)c1ccc2c(c1)CCC=C2)C(=O)O	ZINC000450518852	DG	On-Demand	Anodyne	F3	60	32
CC(C)C[C@H](CNC(=O)c1ccc2c(c1)CCC=C2)C(=O)O	ZINC000450518853	DG	On-Demand	Anodyne	F3	60	32
CC[C@@H]1C[C@H]1C(=O)Nc1cccnc1OCC(F)F	ZINC000450518863	CF	On-Demand	Anodyne	P2RY1	43	36
CC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518865	FI	On-Demand	Anodyne	DRD2	35	44
CC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518865	FI	On-Demand	Anodyne	HRH2	51	46
CC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518865	FI	On-Demand	Anodyne	OPRM1	15	55
CC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518865	FI	On-Demand	Anodyne	NPY1R	37	42
CC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518865	FI	On-Demand	Anodyne	CCKAR	24	40
CC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518865	FI	On-Demand	Anodyne	CCR3	78	53
CC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518865	FI	On-Demand	Anodyne	EPHX2	29	42
CC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518865	FI	On-Demand	Anodyne	MCHR1	21	46
CC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518866	FI	On-Demand	Anodyne	DRD2	35	44
CC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518866	FI	On-Demand	Anodyne	HRH2	51	46
CC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518866	FI	On-Demand	Anodyne	OPRM1	15	55
CC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518866	FI	On-Demand	Anodyne	NPY1R	37	42
CC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518866	FI	On-Demand	Anodyne	CCKAR	24	40
CC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518866	FI	On-Demand	Anodyne	CCR3	78	53
CC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518866	FI	On-Demand	Anodyne	EPHX2	29	42
CC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1	ZINC000450518866	FI	On-Demand	Anodyne	MCHR1	21	46
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518867	GI	On-Demand	Anodyne	ALOX5AP	44	36
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518867	GI	On-Demand	Anodyne	COLA	53	44
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518867	GI	On-Demand	Anodyne	CPT1A	52	44
CCC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518868	GI	On-Demand	Anodyne	ALOX5AP	44	36
CCC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518868	GI	On-Demand	Anodyne	COLA	53	44
CCC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518868	GI	On-Demand	Anodyne	CPT1A	52	44
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518869	GI	On-Demand	Anodyne	ALOX5AP	44	36
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518869	GI	On-Demand	Anodyne	COLA	53	44
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518869	GI	On-Demand	Anodyne	CPT1A	52	44
CCC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518870	GI	On-Demand	Anodyne	ALOX5AP	44	36
CCC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518870	GI	On-Demand	Anodyne	COLA	53	44
CCC[C@@H]1CCC[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450518870	GI	On-Demand	Anodyne	CPT1A	52	44
COc1ccc2c(c1)CCCCN2C(=O)c1nn(C)c2c1CCCC2	ZINC000450518874	EG	On-Demand	Anodyne	CNR1	51	31
COc1ccc2c(c1)CCCCN2C(=O)c1nn(C)c2c1CCCC2	ZINC000450518874	EG	On-Demand	Anodyne	AVPR2	30	43
O=C(NCC[C@H]1CCCCO1)[C@H]1CCN(c2ccccc2)C1	ZINC000450518875	DF	On-Demand	Anodyne	PDE8B	22	41
O=C(NCC[C@H]1CCCCO1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450518876	DF	On-Demand	Anodyne	PDE8B	22	41
O=C(NCC[C@@H]1CCCCO1)[C@H]1CCN(c2ccccc2)C1	ZINC000450518877	DF	On-Demand	Anodyne	PDE8B	22	41
O=C(NCC[C@@H]1CCCCO1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450518878	DF	On-Demand	Anodyne	PDE8B	22	41
O=C(O)[C@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccc2ccccc2c1	ZINC000450518881	GG	On-Demand	Anodyne	CPA1	27	48
O=C(O)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1ccc2ccccc2c1	ZINC000450518882	GG	On-Demand	Anodyne	CPA1	27	48
CCOC(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)nc1	ZINC000450518883	FE	On-Demand	Anodyne	P2RY12	54	41
CCOC(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)nc1	ZINC000450518883	FE	On-Demand	Anodyne	SSTR5	59	46
CCOC(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)nc1	ZINC000450518883	FE	On-Demand	Anodyne	FAAH	17	40
CCOC(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)nc1	ZINC000450518883	FE	On-Demand	Anodyne	EPHX2	19	40
CCOC(=O)c1ccc(CN2CCN(C(=O)NC3CCCCC3)CC2)nc1	ZINC000450518883	FE	On-Demand	Anodyne	SCARB1	52	37
COc1ccc2c(c1)CCCCN2C(=O)Cc1cn(C)nc1C	ZINC000450518890	DF	On-Demand	Anodyne	EIF2AK3	74	40
COc1ccc2c(c1)CCCCN2C(=O)CCCC(=O)C1CC1	ZINC000450518891	DH	On-Demand	Anodyne	DRD4	41	32
COc1ccc2c(c1)CCCCN2C(=O)CCCC(=O)C1CC1	ZINC000450518891	DH	On-Demand	Anodyne	AVPR2	20	40
COc1ccc2c(c1)CCCCN2C(=O)CCCC(=O)C1CC1	ZINC000450518891	DH	On-Demand	Anodyne	MTNR1B	26	41
COc1ccc2c(c1)CCCCN2C(=O)CCCC(=O)C1CC1	ZINC000450518891	DH	On-Demand	Anodyne	EBP	27	41
O=C(NC[C@@H]1CCCCN1CC1CC(F)(F)C1)Nc1ccccc1	ZINC000450518892	EH	On-Demand	Anodyne	CCR3	45	40
O=C(NC[C@@H]1CCCCN1CC1CC(F)(F)C1)Nc1ccccc1	ZINC000450518892	EH	On-Demand	Anodyne	EPHX2	20	41
O=C(NC[C@H]1CCCCN1CC1CC(F)(F)C1)Nc1ccccc1	ZINC000450518893	EH	On-Demand	Anodyne	CCR3	45	40
O=C(NC[C@H]1CCCCN1CC1CC(F)(F)C1)Nc1ccccc1	ZINC000450518893	EH	On-Demand	Anodyne	EPHX2	20	41
COc1cccc2c(NCc3ccc(OC4CCN(C)CC4)cc3)nccc12	ZINC000450518900	GI	On-Demand	Anodyne	PDE3A	46	37
COc1cccc2c(NCc3ccc(OC4CCN(C)CC4)cc3)nccc12	ZINC000450518900	GI	On-Demand	Anodyne	HRH3	15	50
COc1cccc2c(NCc3ccc(OC4CCN(C)CC4)cc3)nccc12	ZINC000450518900	GI	On-Demand	Anodyne	UTS2R	18	40
COc1cccc2c(NCc3ccc(OC4CCN(C)CC4)cc3)nccc12	ZINC000450518900	GI	On-Demand	Anodyne	PDE3B	67	37
CN(C1CCN(CCc2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450518903	EE	On-Demand	Anodyne	DRD4	22	41
CN(C1CCN(CCc2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450518903	EE	On-Demand	Anodyne	SIGMAR1	25	40
CN(C1CCN(CCc2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450518903	EE	On-Demand	Anodyne	CCR5	39	44
CCC(CC)Oc1ccc(C(=O)NC(CO)CO)cc1	ZINC000450518904	CD	On-Demand	Anodyne	UTS2	41	34
CCCOc1cccc(CC(=O)N2CCC(COC)(C(=O)O)CC2)c1	ZINC000450518910	EE	On-Demand	Anodyne	PLA2G4B	22	41
Cn1nccc1[C@H]1[C@H](Nc2ccnc3cc(F)c(Cl)cc23)CC(=O)N1C1CC1	ZINC000450518917	GH	On-Demand	Anodyne	HRP1_PLAFA	60	31
COc1ccc(C(=O)NCC2(C(=O)O)CCOCC2)c(OC2CCCC2)c1	ZINC000450518925	GF	On-Demand	Anodyne	PDE4A	33	41
COc1ccc(C(=O)NCC2(C(=O)O)CCOCC2)c(OC2CCCC2)c1	ZINC000450518925	GF	On-Demand	Anodyne	KCNA3	50	42
COc1ccc(C(=O)NCC2(C(=O)O)CCOCC2)c(OC2CCCC2)c1	ZINC000450518925	GF	On-Demand	Anodyne	PDE4B	16	41
COc1ccc(C(=O)NCC2(C(=O)O)CCOCC2)c(OC2CCCC2)c1	ZINC000450518925	GF	On-Demand	Anodyne	PDE4D	17	41
COc1ccc(C(=O)NCC2(C(=O)O)CCOCC2)c(OC2CCCC2)c1	ZINC000450518925	GF	On-Demand	Anodyne	PDE4C	17	41
COc1ccc(C(=O)NCC2(C(=O)O)CCOCC2)c(OC2CCCC2)c1	ZINC000450518925	GF	On-Demand	Anodyne	HCN1	53	34
COc1ccc(C(=O)NCC2(C(=O)O)CCOCC2)c(OC2CCCC2)c1	ZINC000450518925	GF	On-Demand	Anodyne	HCN4	42	32
COC(=O)c1csc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)n1	ZINC000450518928	GE	On-Demand	Anodyne	TRPC6	52	34
C=CC(C)(C)C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450518937	CG	On-Demand	Mild	P2RX7	16	50
O=C(O)CC[C@H]1CCCN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450518938	FH	On-Demand	Anodyne	LIPG	46	37
O=C(O)CC[C@@H]1CCCN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450518939	FH	On-Demand	Anodyne	LIPG	46	37
CC(=O)Nc1cccc2c1CCCN2Cc1cccc(C(C)=O)c1	ZINC000450518950	DH	On-Demand	Anodyne	KCNQ2	64	37
CC(C)CCCC(=O)NC(CO)CO	ZINC000450518952	BC	On-Demand	Anodyne	PLA2G2C	0	41
CC(C)CCCC(=O)NC(CO)CO	ZINC000450518952	BC	On-Demand	Anodyne	Q6UB75_PIG	0	48
CC(C)CCCC(=O)NC(CO)CO	ZINC000450518952	BC	On-Demand	Anodyne	NOD1	48	38
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518956	GH	On-Demand	Anodyne	MME	41	54
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518956	GH	On-Demand	Anodyne	CMA1	15	46
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518956	GH	On-Demand	Anodyne	PTGER3	44	35
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518956	GH	On-Demand	Anodyne	NAALAD2	29	40
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518956	GH	On-Demand	Anodyne	Q6UB75_PIG	0	44
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518956	GH	On-Demand	Anodyne	HDA106	0	44
O=C(O)CC[C@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518956	GH	On-Demand	Anodyne	FFAR4	42	38
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518957	GH	On-Demand	Anodyne	MME	41	54
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518957	GH	On-Demand	Anodyne	CMA1	15	46
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518957	GH	On-Demand	Anodyne	PTGER3	44	35
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518957	GH	On-Demand	Anodyne	NAALAD2	29	40
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518957	GH	On-Demand	Anodyne	Q6UB75_PIG	0	44
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518957	GH	On-Demand	Anodyne	HDA106	0	44
O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)CCCc1cc(F)ccc1F	ZINC000450518957	GH	On-Demand	Anodyne	FFAR4	42	38
Cc1nn(-c2ccccc2)cc1CNC(=O)CC1(O)CCC1	ZINC000450518959	CE	On-Demand	Anodyne	P2RX7	23	53
CN(C)S(=O)(=O)CC(=O)Nc1cccc(CCC(=O)O)c1	ZINC000450518961	DC	On-Demand	Anodyne	E1	0	40
CN(C)S(=O)(=O)CC(=O)Nc1cccc(CCC(=O)O)c1	ZINC000450518961	DC	On-Demand	Anodyne	FFAR1	41	40
CN(C)S(=O)(=O)CC(=O)Nc1cccc(CCC(=O)O)c1	ZINC000450518961	DC	On-Demand	Anodyne	PARP10	0	45
CCCOc1cc(OC)ccc1C(=O)N1CCC(COC)(C(=O)O)CC1	ZINC000450518975	FE	On-Demand	Anodyne	SCN5A	31	40
N#Cc1cnc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000450518976	GF	On-Demand	Mild	PREP	59	39
N#Cc1cnc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000450518977	GF	On-Demand	Mild	PREP	59	39
COc1cccc(OCCC(=O)Nc2cnn(CC(C)C)c2C)c1	ZINC000450518982	EG	On-Demand	Anodyne	FAS	19	40
CCC[C@H](NC(=O)c1occc1C(C)C)C(=O)O	ZINC000450518985	CE	On-Demand	Anodyne	MME	31	44
CCC[C@H](NC(=O)c1occc1C(C)C)C(=O)O	ZINC000450518985	CE	On-Demand	Anodyne	ANPEP	43	32
CCC[C@H](NC(=O)c1occc1C(C)C)C(=O)O	ZINC000450518985	CE	On-Demand	Anodyne	ACE2	51	35
CCC[C@@H](NC(=O)c1occc1C(C)C)C(=O)O	ZINC000450518992	CE	On-Demand	Anodyne	MME	31	44
CCC[C@@H](NC(=O)c1occc1C(C)C)C(=O)O	ZINC000450518992	CE	On-Demand	Anodyne	ANPEP	43	32
CCC[C@@H](NC(=O)c1occc1C(C)C)C(=O)O	ZINC000450518992	CE	On-Demand	Anodyne	ACE2	51	35
CC(=O)N[C@H](C(=O)NCc1ccccc1CN1CC[C@@H](O)C1)C(C)(C)C	ZINC000450519000	FD	On-Demand	Anodyne	OPRK1	0	40
CC(=O)N[C@H](C(=O)NCc1ccccc1CN1CC[C@H](O)C1)C(C)(C)C	ZINC000450519001	FD	On-Demand	Anodyne	OPRK1	0	40
Cc1ccc2c(C3=CCN(C[C@H]4COCCO4)CC3)c[nH]c2c1	ZINC000450519033	DF	On-Demand	Anodyne	SLC6A4	0	48
Cc1cccc2c1O[C@H](C(=O)NCc1ccccc1CN1CC[C@H](O)C1)C2	ZINC000450519035	FE	On-Demand	Anodyne	OPRK1	17	43
Cc1ccc2c(C3=CCN(C[C@@H]4COCCO4)CC3)c[nH]c2c1	ZINC000450519036	DF	On-Demand	Anodyne	SLC6A4	0	48
Cc1cccc2c1O[C@H](C(=O)NCc1ccccc1CN1CC[C@@H](O)C1)C2	ZINC000450519040	FE	On-Demand	Anodyne	OPRK1	17	43
Cc1cccc2c1O[C@@H](C(=O)NCc1ccccc1CN1CC[C@H](O)C1)C2	ZINC000450519042	FE	On-Demand	Anodyne	OPRK1	17	43
CCC[C@@H](NC(=O)c1cc(C(C)C)oc1C)C(=O)O	ZINC000450519043	CF	On-Demand	Anodyne	NOD1	71	37
CCC[C@H](NC(=O)c1cc(C(C)C)oc1C)C(=O)O	ZINC000450519044	CF	On-Demand	Anodyne	NOD1	71	37
CCN(Cc1ccc(S(=O)(=O)CC)cc1)c1ccccc1C	ZINC000450519045	DH	On-Demand	Anodyne	RORC	18	40
C[C@@H](O)CCCN[C@@H](C(=O)Nc1ccccc1)c1ccccc1	ZINC000450519061	DG	On-Demand	Anodyne	HDAC2	21	41
C[C@H](O)CCCN[C@@H](C(=O)Nc1ccccc1)c1ccccc1	ZINC000450519062	DG	On-Demand	Anodyne	HDAC2	21	41
C[C@@H](O)CCCN[C@H](C(=O)Nc1ccccc1)c1ccccc1	ZINC000450519063	DG	On-Demand	Anodyne	HDAC2	21	41
C[C@H](O)CCCN[C@H](C(=O)Nc1ccccc1)c1ccccc1	ZINC000450519064	DG	On-Demand	Anodyne	HDAC2	21	41
CN1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C(C)(C)C1	ZINC000450519066	EG	On-Demand	Anodyne	CHRM5	27	42
CN1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C(C)(C)C1	ZINC000450519066	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
C[C@@H]1CN(c2ccnc3cc(F)c(Cl)cc23)C[C@H]1C(=O)N1CCOCC1	ZINC000450519070	GF	On-Demand	Anodyne	PRCP	45	32
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519071	FG	On-Demand	Anodyne	ACE	54	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519071	FG	On-Demand	Anodyne	XPNPEP1	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519071	FG	On-Demand	Anodyne	XPNPEP2	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519071	FG	On-Demand	Anodyne	XIAP	50	38
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519071	FG	On-Demand	Anodyne	BIRC2	81	43
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519072	FG	On-Demand	Anodyne	ACE	54	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519072	FG	On-Demand	Anodyne	XPNPEP1	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519072	FG	On-Demand	Anodyne	XPNPEP2	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519072	FG	On-Demand	Anodyne	XIAP	50	38
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519072	FG	On-Demand	Anodyne	BIRC2	81	43
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519073	FG	On-Demand	Anodyne	ACE	54	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519073	FG	On-Demand	Anodyne	XPNPEP1	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519073	FG	On-Demand	Anodyne	XPNPEP2	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519073	FG	On-Demand	Anodyne	XIAP	50	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450519073	FG	On-Demand	Anodyne	BIRC2	81	43
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519074	FG	On-Demand	Anodyne	ACE	54	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519074	FG	On-Demand	Anodyne	XPNPEP1	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519074	FG	On-Demand	Anodyne	XPNPEP2	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519074	FG	On-Demand	Anodyne	XIAP	50	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519074	FG	On-Demand	Anodyne	BIRC2	81	43
COC[C@@H](CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)OC	ZINC000450519084	DD	On-Demand	Anodyne	CAPN1	34	40
COC[C@@H](CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)OC	ZINC000450519084	DD	On-Demand	Anodyne	CAPN2	45	33
COC[C@H](CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)OC	ZINC000450519085	DD	On-Demand	Anodyne	CAPN1	34	40
COC[C@H](CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)OC	ZINC000450519085	DD	On-Demand	Anodyne	CAPN2	45	33
CCOC(=O)c1ccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)nc1	ZINC000450519087	GF	On-Demand	Anodyne	P2RY12	36	42
Cc1cc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)nn1C(C)C	ZINC000450519105	GG	On-Demand	Anodyne	COLA	47	43
Cc1cc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)nn1C(C)C	ZINC000450519105	GG	On-Demand	Anodyne	CPT1A	46	43
Cc1cc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)nn1C(C)C	ZINC000450519106	GG	On-Demand	Anodyne	COLA	47	43
Cc1cc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)nn1C(C)C	ZINC000450519106	GG	On-Demand	Anodyne	CPT1A	46	43
CC[C@H](C)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519114	CF	On-Demand	Anodyne	MME	33	44
CC[C@H](C)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519114	CF	On-Demand	Anodyne	CPA1	52	40
CC[C@@H](C)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519115	CF	On-Demand	Anodyne	MME	33	44
CC[C@@H](C)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519115	CF	On-Demand	Anodyne	CPA1	52	40
CC[C@H](C)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519116	CF	On-Demand	Anodyne	MME	33	44
CC[C@H](C)CC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519116	CF	On-Demand	Anodyne	CPA1	52	40
CC[C@@H](C)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519117	CF	On-Demand	Anodyne	MME	33	44
CC[C@@H](C)CC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519117	CF	On-Demand	Anodyne	CPA1	52	40
COc1cccc2c(N3CCC(CC(F)(F)F)CC3)nccc12	ZINC000450519122	DI	On-Demand	Anodyne	PDE3A	47	40
COc1cccc2c(N3CCC(CC(F)(F)F)CC3)nccc12	ZINC000450519122	DI	On-Demand	Anodyne	PDE3B	69	38
Cc1cc(-c2nc(C(=O)NCCCOCCO)co2)ccn1	ZINC000450519127	DD	On-Demand	Anodyne	TBXA2R	0	45
COc1cc(Cl)c(C(=O)NCCSCC(=O)O)cc1OC	ZINC000450519132	ED	On-Demand	Anodyne	HTR4	48	35
Cc1cccc2c1O[C@@H](C(=O)NCc1ccccc1CN1CC[C@@H](O)C1)C2	ZINC000450519145	FE	On-Demand	Anodyne	OPRK1	17	43
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450519147	EE	On-Demand	Anodyne	P2RX7	40	34
O=C(NCc1ccccc1CN1CC[C@H](O)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450519148	EE	On-Demand	Anodyne	P2RX7	40	34
CCCC[C@@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450519150	CB	On-Demand	Anodyne	PAM	0	40
CCCC[C@@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450519150	CB	On-Demand	Anodyne	NOD1	112	54
CCCC[C@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450519151	CB	On-Demand	Anodyne	PAM	0	40
CCCC[C@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O	ZINC000450519151	CB	On-Demand	Anodyne	NOD1	112	54
CCCC[C@@H](NC(=O)c1cc(OC)c(OC)cc1Cl)C(=O)O	ZINC000450519153	EF	On-Demand	Anodyne	NOD1	85	40
CCCC[C@H](NC(=O)c1cc(OC)c(OC)cc1Cl)C(=O)O	ZINC000450519155	EF	On-Demand	Anodyne	NOD1	85	40
COc1cc(Cl)c(C(=O)N2CCCC[C@@H]2CCC(=O)O)cc1OC	ZINC000450519156	FG	On-Demand	Anodyne	HTR4	59	40
COc1cc(Cl)c(C(=O)N2CCCC[C@H]2CCC(=O)O)cc1OC	ZINC000450519157	FG	On-Demand	Anodyne	HTR4	59	40
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H]1CC[C@H](C(=O)O)C1	ZINC000450519179	CE	On-Demand	Anodyne	AVPR1A	0	41
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H]1CC[C@H](C(=O)O)C1	ZINC000450519179	CE	On-Demand	Anodyne	ENV	46	35
O=C(Cc1ccc(Cl)c(F)c1)N[C@H]1CC[C@@H](C(=O)O)C1	ZINC000450519181	CE	On-Demand	Anodyne	AVPR1A	0	41
O=C(Cc1ccc(Cl)c(F)c1)N[C@H]1CC[C@@H](C(=O)O)C1	ZINC000450519181	CE	On-Demand	Anodyne	ENV	46	35
COc1cccc(OCCC(=O)N2CCOC3(CCC3)C2)c1	ZINC000450519183	DE	On-Demand	Anodyne	MTNR1A	19	43
CC(=O)c1ccc(CN(Cc2nc(O)c3ccccc3n2)C(C)C)cc1	ZINC000450519192	EH	On-Demand	Anodyne	TSPO	25	40
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccccc3)CC2)n1	ZINC000450519197	FF	On-Demand	Anodyne	DRD4	22	42
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccccc3)CC2)n1	ZINC000450519197	FF	On-Demand	Anodyne	SIGMAR1	27	41
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccccc3)CC2)n1	ZINC000450519197	FF	On-Demand	Anodyne	NPY1R	40	35
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccccc3)CC2)n1	ZINC000450519197	FF	On-Demand	Anodyne	CCR3	38	41
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccccc3)CC2)n1	ZINC000450519197	FF	On-Demand	Anodyne	EPHX2	44	45
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccccc3)CC2)n1	ZINC000450519197	FF	On-Demand	Anodyne	CXCR3	23	41
COC(=O)c1csc(CN2CCC(NC(=O)Nc3ccccc3)CC2)n1	ZINC000450519197	FF	On-Demand	Anodyne	MCHR1	32	45
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1conc1C1CC1	ZINC000450519208	EE	On-Demand	Anodyne	CPA1	22	46
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1conc1C1CC1	ZINC000450519209	EE	On-Demand	Anodyne	CPA1	22	46
Cc1nc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450519212	GF	On-Demand	Bother	PREP	56	41
Cc1nc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450519212	GF	On-Demand	Bother	GPBAR1	0	43
Cc1nc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450519213	GF	On-Demand	Bother	PREP	56	41
Cc1nc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450519213	GF	On-Demand	Bother	GPBAR1	0	43
COCC1(C(=O)O)CCN(C(=O)c2ccc(-c3ccc(C(C)(C)C)cc3)o2)CC1	ZINC000450519220	GI	On-Demand	Anodyne	SCN10A	19	43
COc1cccc(CCC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1F	ZINC000450519221	GF	On-Demand	Anodyne	PPARA	17	41
COc1cccc(CCC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1F	ZINC000450519221	GF	On-Demand	Anodyne	MME	28	41
COc1cccc(CCC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1F	ZINC000450519221	GF	On-Demand	Anodyne	CPA1	39	46
COc1cccc(CCC(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1F	ZINC000450519221	GF	On-Demand	Anodyne	PPARD	20	41
Cc1ccc(NC(=O)c2ccc(N3CCOCCN3)c([N+](=O)[O-])c2)cc1	ZINC000450519222	FE	On-Demand	Bother	PRNP	43	32
Cc1ccc(NC(=O)c2ccc(N3CCOCCN3)c([N+](=O)[O-])c2)cc1	ZINC000450519222	FE	On-Demand	Bother	F3	41	31
Cc1ccc(NC(=O)c2ccc(N3CCOCCN3)c([N+](=O)[O-])c2)cc1	ZINC000450519222	FE	On-Demand	Bother	TAAR1	28	53
COc1cccc(CCC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1F	ZINC000450519223	GF	On-Demand	Anodyne	PPARA	17	41
COc1cccc(CCC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1F	ZINC000450519223	GF	On-Demand	Anodyne	MME	28	41
COc1cccc(CCC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1F	ZINC000450519223	GF	On-Demand	Anodyne	CPA1	39	46
COc1cccc(CCC(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1F	ZINC000450519223	GF	On-Demand	Anodyne	PPARD	20	41
O=C(CCCc1cc(F)ccc1F)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519225	GG	On-Demand	Anodyne	MME	17	40
O=C(CCCc1cc(F)ccc1F)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519225	GG	On-Demand	Anodyne	CPA1	44	50
Cc1cncc(-c2nc(CN3CCC(NC(=O)Nc4ccccc4)CC3)no2)c1	ZINC000450519227	GG	On-Demand	Anodyne	DRD4	21	52
Cc1cncc(-c2nc(CN3CCC(NC(=O)Nc4ccccc4)CC3)no2)c1	ZINC000450519227	GG	On-Demand	Anodyne	SSTR5	51	46
Cc1cncc(-c2nc(CN3CCC(NC(=O)Nc4ccccc4)CC3)no2)c1	ZINC000450519227	GG	On-Demand	Anodyne	CCR3	28	43
Cc1cncc(-c2nc(CN3CCC(NC(=O)Nc4ccccc4)CC3)no2)c1	ZINC000450519227	GG	On-Demand	Anodyne	EPHX2	32	41
Cc1cncc(-c2nc(CN3CCC(NC(=O)Nc4ccccc4)CC3)no2)c1	ZINC000450519227	GG	On-Demand	Anodyne	PDK1	47	37
Cc1cncc(-c2nc(CN3CCC(NC(=O)Nc4ccccc4)CC3)no2)c1	ZINC000450519227	GG	On-Demand	Anodyne	CXCR3	23	42
Cc1cncc(-c2nc(CN3CCC(NC(=O)Nc4ccccc4)CC3)no2)c1	ZINC000450519227	GG	On-Demand	Anodyne	MCHR1	27	42
O=C(CCCc1cc(F)ccc1F)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519228	GG	On-Demand	Anodyne	MME	17	40
O=C(CCCc1cc(F)ccc1F)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450519228	GG	On-Demand	Anodyne	CPA1	44	50
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450519247	EF	On-Demand	Bother	COLA	44	33
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450519247	EF	On-Demand	Bother	PRKCQ	40	41
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450519248	EF	On-Demand	Bother	COLA	44	33
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450519248	EF	On-Demand	Bother	PRKCQ	40	41
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450519249	EF	On-Demand	Bother	COLA	44	33
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450519249	EF	On-Demand	Bother	PRKCQ	40	41
COC(=O)[C@H](Cc1ccccc1)[C@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450519251	EF	On-Demand	Bother	COLA	44	33
COC(=O)[C@H](Cc1ccccc1)[C@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450519251	EF	On-Demand	Bother	PRKCQ	40	41
Cc1ccc(F)c(CC(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450519253	GH	On-Demand	Anodyne	COLA	100	51
Cc1ccc(F)c(CC(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450519253	GH	On-Demand	Anodyne	CPT1A	97	51
Cc1ccc(F)c(CC(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450519257	GH	On-Demand	Anodyne	COLA	100	51
Cc1ccc(F)c(CC(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)c1	ZINC000450519257	GH	On-Demand	Anodyne	CPT1A	97	51
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450519258	GG	On-Demand	Anodyne	MTNR1A	17	47
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450519258	GG	On-Demand	Anodyne	MTNR1B	21	47
COc1cc(CC(=O)NC(CO)CO)ccc1Cl	ZINC000450519261	CC	On-Demand	Anodyne	AVPR1A	0	40
COc1cc(CC(=O)NC(CO)CO)ccc1Cl	ZINC000450519261	CC	On-Demand	Anodyne	TRPV1	36	42
COc1cc(CC(=O)NC(CO)CO)ccc1Cl	ZINC000450519261	CC	On-Demand	Anodyne	P2RX7	0	40
COc1cc(CC(=O)NC(CO)CO)ccc1Cl	ZINC000450519261	CC	On-Demand	Anodyne	NCE103	32	45
COc1cc(CC(=O)NC(CO)CO)ccc1Cl	ZINC000450519261	CC	On-Demand	Anodyne	CAN2	0	45
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450519262	GG	On-Demand	Anodyne	MTNR1A	17	47
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450519262	GG	On-Demand	Anodyne	MTNR1B	21	47
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450519263	GG	On-Demand	Anodyne	MTNR1A	17	47
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450519263	GG	On-Demand	Anodyne	MTNR1B	21	47
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450519264	GG	On-Demand	Anodyne	MTNR1A	17	47
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450519264	GG	On-Demand	Anodyne	MTNR1B	21	47
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450519265	FE	On-Demand	Anodyne	FABI	50	38
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450519265	FE	On-Demand	Anodyne	ABCB1	34	43
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450519265	FE	On-Demand	Anodyne	PARP1	20	40
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450519266	FE	On-Demand	Anodyne	FABI	50	38
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450519266	FE	On-Demand	Anodyne	ABCB1	34	43
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000450519266	FE	On-Demand	Anodyne	PARP1	20	40
CC(C)Cn1cc(C(=O)Nc2ccc(O)cc2F)c(C(F)F)n1	ZINC000450519267	EH	On-Demand	Anodyne	MAP2K1	46	32
O=C(NC1CCCCC1)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450519276	EF	On-Demand	Anodyne	EPHX2	17	44
O=C(NC1CCCCC1)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450519277	EF	On-Demand	Anodyne	EPHX2	17	44
CCC[C@@H](OC)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450519278	CD	On-Demand	Anodyne	ACE	42	39
CCC[C@H](OC)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450519279	CD	On-Demand	Anodyne	ACE	42	39
CCC[C@@H](OC)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450519280	CD	On-Demand	Anodyne	ACE	42	39
CCC[C@H](OC)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450519281	CD	On-Demand	Anodyne	ACE	42	39
Cc1cc(C(F)(F)F)ccc1C(=O)NC(CO)CO	ZINC000450519282	CD	On-Demand	Anodyne	SORT1	17	45
Cc1cc(C(F)(F)F)ccc1C(=O)NC(CO)CO	ZINC000450519282	CD	On-Demand	Anodyne	MTTP	63	36
Cc1cc(C(F)(F)F)ccc1C(=O)NC(CO)CO	ZINC000450519282	CD	On-Demand	Anodyne	CCR2	33	44
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450519283	FF	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450519283	FF	On-Demand	Anodyne	P2RX7	50	40
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450519283	FF	On-Demand	Anodyne	CCR2	23	40
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450519283	FF	On-Demand	Anodyne	MCHR1	26	44
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450519284	FF	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450519284	FF	On-Demand	Anodyne	P2RX7	50	40
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450519284	FF	On-Demand	Anodyne	CCR2	23	40
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450519284	FF	On-Demand	Anodyne	MCHR1	26	44
O=C(Cc1ccc(Cl)c(F)c1)N[C@H](C(=O)O)[C@H]1CCCOC1	ZINC000450519297	EE	On-Demand	Anodyne	ENV	40	30
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H](C(=O)O)[C@H]1CCCOC1	ZINC000450519298	EE	On-Demand	Anodyne	ENV	40	30
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H](C(=O)O)[C@@H]1CCCOC1	ZINC000450519299	EE	On-Demand	Anodyne	ENV	40	30
O=C(Cc1ccc(Cl)c(F)c1)N[C@H](C(=O)O)[C@@H]1CCCOC1	ZINC000450519300	EE	On-Demand	Anodyne	ENV	40	30
COc1ccc2[nH]cc(C3=CCN(C[C@@H](C)S(C)(=O)=O)CC3)c2c1	ZINC000450519303	EF	On-Demand	Anodyne	HTR1A	22	52
COc1ccc2[nH]cc(C3=CCN(C[C@@H](C)S(C)(=O)=O)CC3)c2c1	ZINC000450519303	EF	On-Demand	Anodyne	SLC6A4	24	63
COc1ccc2[nH]cc(C3=CCN(C[C@H](C)S(C)(=O)=O)CC3)c2c1	ZINC000450519304	EF	On-Demand	Anodyne	HTR1A	22	52
COc1ccc2[nH]cc(C3=CCN(C[C@H](C)S(C)(=O)=O)CC3)c2c1	ZINC000450519304	EF	On-Demand	Anodyne	SLC6A4	24	63
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccc(Cl)c(F)c1	ZINC000450519307	FC	On-Demand	Anodyne	FOLH1	38	40
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccc(Cl)c(F)c1	ZINC000450519308	FC	On-Demand	Anodyne	FOLH1	38	40
C[C@@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519327	DD	On-Demand	Anodyne	HMGCR	28	40
C[C@@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519327	DD	On-Demand	Anodyne	HTR2A	22	48
C[C@@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519327	DD	On-Demand	Anodyne	SLC6A1	0	41
C[C@@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519327	DD	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519327	DD	On-Demand	Anodyne	CCR3	95	40
C[C@@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519327	DD	On-Demand	Anodyne	CCR5	43	47
C[C@@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519327	DD	On-Demand	Anodyne	CACNA1G	53	53
C[C@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519328	DD	On-Demand	Anodyne	HMGCR	28	40
C[C@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519328	DD	On-Demand	Anodyne	HTR2A	22	48
C[C@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519328	DD	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519328	DD	On-Demand	Anodyne	SIGMAR1	22	44
C[C@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519328	DD	On-Demand	Anodyne	CCR3	95	40
C[C@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519328	DD	On-Demand	Anodyne	CCR5	43	47
C[C@H](O)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450519328	DD	On-Demand	Anodyne	CACNA1G	53	53
C[C@@H](c1ccc(Cl)cc1)N(CC[C@@H](C)O)C1CC1	ZINC000450519338	CH	On-Demand	Anodyne	UTS2	42	34
C[C@H](O)CCN(C1CC1)[C@H](C)c1ccc(Cl)cc1	ZINC000450519339	CH	On-Demand	Anodyne	UTS2	42	34
C[C@H](O)CCN(C1CC1)[C@@H](C)c1ccc(Cl)cc1	ZINC000450519340	CH	On-Demand	Anodyne	UTS2	42	34
C[C@@H](O)CCN(C1CC1)[C@H](C)c1ccc(Cl)cc1	ZINC000450519341	CH	On-Demand	Anodyne	UTS2	42	34
Cc1cccc(NC(=O)[C@H]2CCCN(CC[C@H](C)O)C2)n1	ZINC000450519344	CD	On-Demand	Anodyne	SLC6A1	128	40
Cc1cccc(NC(=O)[C@H]2CCCN(CC[C@H](C)O)C2)n1	ZINC000450519344	CD	On-Demand	Anodyne	PDE8A	0	43
Cc1cccc(NC(=O)[C@H]2CCCN(CC[C@H](C)O)C2)n1	ZINC000450519344	CD	On-Demand	Anodyne	BIRC2	40	32
Cc1cccc(NC(=O)[C@H]2CCCN(CC[C@@H](C)O)C2)n1	ZINC000450519345	CD	On-Demand	Anodyne	SLC6A1	128	40
Cc1cccc(NC(=O)[C@H]2CCCN(CC[C@@H](C)O)C2)n1	ZINC000450519345	CD	On-Demand	Anodyne	PDE8A	0	43
Cc1cccc(NC(=O)[C@H]2CCCN(CC[C@@H](C)O)C2)n1	ZINC000450519345	CD	On-Demand	Anodyne	BIRC2	40	32
Cc1cccc(NC(=O)[C@@H]2CCCN(CC[C@H](C)O)C2)n1	ZINC000450519346	CD	On-Demand	Anodyne	SLC6A1	128	40
Cc1cccc(NC(=O)[C@@H]2CCCN(CC[C@H](C)O)C2)n1	ZINC000450519346	CD	On-Demand	Anodyne	PDE8A	0	43
Cc1cccc(NC(=O)[C@@H]2CCCN(CC[C@H](C)O)C2)n1	ZINC000450519346	CD	On-Demand	Anodyne	BIRC2	40	32
Cc1cccc(NC(=O)[C@@H]2CCCN(CC[C@@H](C)O)C2)n1	ZINC000450519347	CD	On-Demand	Anodyne	SLC6A1	128	40
Cc1cccc(NC(=O)[C@@H]2CCCN(CC[C@@H](C)O)C2)n1	ZINC000450519347	CD	On-Demand	Anodyne	PDE8A	0	43
Cc1cccc(NC(=O)[C@@H]2CCCN(CC[C@@H](C)O)C2)n1	ZINC000450519347	CD	On-Demand	Anodyne	BIRC2	40	32
C[C@@]1(O)CCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450519348	DE	On-Demand	Anodyne	SLC12A5	58	37
C[C@]1(O)CCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450519349	DE	On-Demand	Anodyne	SLC12A5	58	37
Cc1ccc2c(C3=CCN(Cc4nnc(C(C)C)s4)CC3)c[nH]c2c1	ZINC000450519357	FJ	On-Demand	Anodyne	SLC6A4	18	44
COC(=O)c1csc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)n1	ZINC000450519358	GF	On-Demand	Anodyne	SLC6A1	64	34
COC(=O)c1csc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)n1	ZINC000450519358	GF	On-Demand	Anodyne	F10	52	35
COC(=O)c1csc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)n1	ZINC000450519359	GF	On-Demand	Anodyne	SLC6A1	64	34
COC(=O)c1csc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)n1	ZINC000450519359	GF	On-Demand	Anodyne	F10	52	35
O=C(CCCc1cc(F)ccc1F)NCCc1cccc(C(=O)O)c1	ZINC000450519363	EG	On-Demand	Anodyne	KDM4E	20	40
COc1ccccc1C[C@@H](CNC(=O)C1(C2CC2)CCOCC1)C(=O)O	ZINC000450519368	FE	On-Demand	Anodyne	KCNA3	41	34
COc1ccccc1C[C@@H](CNC(=O)C1(C2CC2)CCOCC1)C(=O)O	ZINC000450519368	FE	On-Demand	Anodyne	TIMP3	40	30
COc1ccccc1C[C@H](CNC(=O)C1(C2CC2)CCOCC1)C(=O)O	ZINC000450519369	FE	On-Demand	Anodyne	KCNA3	41	34
COc1ccccc1C[C@H](CNC(=O)C1(C2CC2)CCOCC1)C(=O)O	ZINC000450519369	FE	On-Demand	Anodyne	TIMP3	40	30
COc1cccc2c(N3C[C@@H](C)[C@H](C(N)=O)C3)nccc12	ZINC000450519371	CD	On-Demand	Anodyne	PDE3B	40	32
COCCOC[C@@H](O)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450519372	FD	On-Demand	Anodyne	SLC6A1	67	39
COCCOC[C@@H](O)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450519373	FD	On-Demand	Anodyne	SLC6A1	67	39
COCCOC[C@H](O)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450519374	FD	On-Demand	Anodyne	SLC6A1	67	39
COCCOC[C@H](O)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450519375	FD	On-Demand	Anodyne	SLC6A1	67	39
Cc1ccc2c(C3=CCN(CC4CC(F)(F)C4)CC3)c[nH]c2c1	ZINC000450519383	DJ	On-Demand	Anodyne	SLC6A4	16	46
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519384	FD	On-Demand	Anodyne	SLC6A1	92	38
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519384	FD	On-Demand	Anodyne	OPRM1	0	43
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519384	FD	On-Demand	Anodyne	OPRK1	57	45
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519384	FD	On-Demand	Anodyne	FDFT1	35	43
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519385	FD	On-Demand	Anodyne	SLC6A1	92	38
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519385	FD	On-Demand	Anodyne	OPRM1	0	43
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519385	FD	On-Demand	Anodyne	OPRK1	57	45
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519385	FD	On-Demand	Anodyne	FDFT1	35	43
CCc1cccc(C(=O)NCCN2CCNC(=O)C2)n1	ZINC000450519387	CB	On-Demand	Anodyne	DRD4	43	32
CCc1cccc(C(=O)NCCN2CCNC(=O)C2)n1	ZINC000450519387	CB	On-Demand	Anodyne	PLD2	76	36
CCC[C@H](NC(=O)c1ccc2c(c1)CCC=C2)C(=O)O	ZINC000450519388	CF	On-Demand	Anodyne	GART	48	31
CCC[C@@H](NC(=O)c1ccc2c(c1)CCC=C2)C(=O)O	ZINC000450519389	CF	On-Demand	Anodyne	GART	48	31
Cc1ccc2[nH]c(C(=O)N[C@@H](CC3CC3)C(=O)O)c(C)c2c1	ZINC000450519391	DF	On-Demand	Anodyne	PIN1	26	42
Cc1ccc2[nH]c(C(=O)N[C@H](CC3CC3)C(=O)O)c(C)c2c1	ZINC000450519392	DF	On-Demand	Anodyne	PIN1	26	42
O=C(CCCC1CCOCC1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519395	GG	On-Demand	Anodyne	ACE	19	40
O=C(CCCC1CCOCC1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519395	GG	On-Demand	Anodyne	MME	25	40
O=C(CCCC1CCOCC1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519395	GG	On-Demand	Anodyne	EDNRB	27	40
O=C(CCCC1CCOCC1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519395	GG	On-Demand	Anodyne	MPO	42	38
O=C(CCCC1CCOCC1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519395	GG	On-Demand	Anodyne	ECE1	54	40
O=C(CCCC1CCOCC1)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519395	GG	On-Demand	Anodyne	SLC15A2	0	45
O=C(CCCC1CCOCC1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519396	GG	On-Demand	Anodyne	ACE	19	40
O=C(CCCC1CCOCC1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519396	GG	On-Demand	Anodyne	MME	25	40
O=C(CCCC1CCOCC1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519396	GG	On-Demand	Anodyne	EDNRB	27	40
O=C(CCCC1CCOCC1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519396	GG	On-Demand	Anodyne	MPO	42	38
O=C(CCCC1CCOCC1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519396	GG	On-Demand	Anodyne	ECE1	54	40
O=C(CCCC1CCOCC1)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519396	GG	On-Demand	Anodyne	SLC15A2	0	45
COC(=O)CCN1CC[C@@H](NC(=O)c2ccc(N3CCC3)nc2)C1=O	ZINC000450519398	EC	On-Demand	Anodyne	HPGDS	29	46
COC(=O)CCN1CC[C@H](NC(=O)c2ccc(N3CCC3)nc2)C1=O	ZINC000450519399	EC	On-Demand	Anodyne	HPGDS	29	46
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519400	GG	On-Demand	Anodyne	PPARG	15	46
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519400	GG	On-Demand	Anodyne	PPARA	26	46
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519400	GG	On-Demand	Anodyne	MME	36	44
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519400	GG	On-Demand	Anodyne	TRPV1	26	41
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519400	GG	On-Demand	Anodyne	PPARD	27	46
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519400	GG	On-Demand	Anodyne	NCE103	23	41
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519400	GG	On-Demand	Anodyne	P96878_MYCTU	18	41
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519400	GG	On-Demand	Anodyne	CAN2	0	41
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)cn1	ZINC000450519403	GF	On-Demand	Anodyne	CCR2	28	42
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)cn1	ZINC000450519403	GF	On-Demand	Anodyne	MCHR1	16	51
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)cn1	ZINC000450519403	GF	On-Demand	Anodyne	CACNA1I	45	33
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cn1	ZINC000450519404	GF	On-Demand	Anodyne	CCR2	28	42
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cn1	ZINC000450519404	GF	On-Demand	Anodyne	MCHR1	16	51
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cn1	ZINC000450519404	GF	On-Demand	Anodyne	CACNA1I	45	33
CCC[C@@H](CC(C)C)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450519418	EG	On-Demand	Anodyne	OPRK1	0	42
CCC[C@@H](CC(C)C)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450519419	EG	On-Demand	Anodyne	OPRK1	0	42
CCC[C@H](CC(C)C)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450519420	EG	On-Demand	Anodyne	OPRK1	0	42
CCC[C@H](CC(C)C)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450519421	EG	On-Demand	Anodyne	OPRK1	0	42
Cc1cc(OCc2ccccc2)nc(N2CCC[C@](O)(C(N)=O)C2)n1	ZINC000450519423	ED	On-Demand	Anodyne	SLC12A5	68	37
Cc1cc(OCc2ccccc2)nc(N2CCC[C@@](O)(C(N)=O)C2)n1	ZINC000450519424	ED	On-Demand	Anodyne	SLC12A5	68	37
CCOC(=O)[C@@H](CO)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450519425	DC	On-Demand	Anodyne	P2RY12	57	38
CCOC(=O)[C@H](CO)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450519426	DC	On-Demand	Anodyne	P2RY12	57	38
COCC1(C(=O)O)CCN(C(=O)c2cc(OC)c(OC)cc2Cl)CC1	ZINC000450519446	FE	On-Demand	Anodyne	HTR4	50	35
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccnc1OCC(F)F	ZINC000450519469	FI	On-Demand	Anodyne	TRPV1	25	45
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccnc1OCC(F)F	ZINC000450519469	FI	On-Demand	Anodyne	P2RY1	49	45
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccnc1OCC(F)F	ZINC000450519469	FI	On-Demand	Anodyne	PPARD	53	37
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccnc1OCC(F)F	ZINC000450519469	FI	On-Demand	Anodyne	KDR	17	43
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccnc1OCC(F)F	ZINC000450519469	FI	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccnc1OCC(F)F	ZINC000450519469	FI	On-Demand	Anodyne	MTTP	68	37
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccnc1OCC(F)F	ZINC000450519469	FI	On-Demand	Anodyne	TEK	48	40
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccnc1OCC(F)F	ZINC000450519469	FI	On-Demand	Anodyne	G2YM83_BOTF4	56	31
C/C=C\COc1cccc(CC(=O)NC(CO)CO)c1	ZINC000450519476	CC	On-Demand	Anodyne	PDS	75	34
COc1cc(CN2CCN(c3ncnc4sccc34)CC2)ccc1Cl	ZINC000450519478	FH	On-Demand	Anodyne	PDGFRB	55	38
COc1cc(CN2CCN(c3ncnc4sccc34)CC2)ccc1Cl	ZINC000450519478	FH	On-Demand	Anodyne	SSTR5	41	36
COc1cc(CN2CCN(c3ncnc4sccc34)CC2)ccc1Cl	ZINC000450519478	FH	On-Demand	Anodyne	PDE3B	45	33
COc1cc(CN2CCN(c3ncnc4sccc34)CC2)ccc1Cl	ZINC000450519478	FH	On-Demand	Anodyne	HTT	0	42
CC(C)c1nnc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519491	FG	On-Demand	Anodyne	PREP	51	45
CC(C)c1nnc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519491	FG	On-Demand	Anodyne	MTNR1A	17	42
CC(C)c1nnc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519491	FG	On-Demand	Anodyne	MTNR1B	21	40
CC(C)c1nnc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519491	FG	On-Demand	Anodyne	BIRC2	52	39
CC(C)c1nnc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519491	FG	On-Demand	Anodyne	CES1D	43	31
CC(C)c1nnc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519492	FG	On-Demand	Anodyne	PREP	51	45
CC(C)c1nnc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519492	FG	On-Demand	Anodyne	MTNR1A	17	42
CC(C)c1nnc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519492	FG	On-Demand	Anodyne	MTNR1B	21	40
CC(C)c1nnc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519492	FG	On-Demand	Anodyne	BIRC2	52	39
CC(C)c1nnc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)o1	ZINC000450519492	FG	On-Demand	Anodyne	CES1D	43	31
COCC1(C#N)CCN(c2nccc(-c3ccc(OC)cc3)n2)CC1	ZINC000450519513	EF	On-Demand	Mild	SLC6A7	0	42
Cc1cncc(-c2nc(CN3CCN(C(=O)c4ccc(O)cc4)CC3)no2)c1	ZINC000450519519	GE	On-Demand	Anodyne	PLA2G2A	30	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCCOCCO	ZINC000450519525	FE	On-Demand	Anodyne	AVPR1B	54	43
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCCOCCO	ZINC000450519525	FE	On-Demand	Anodyne	PDE6D	94	43
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCCOCCO	ZINC000450519525	FE	On-Demand	Anodyne	IMDH_CRYPV	37	55
COc1cc(-c2noc(CN3CCN(C(=O)c4ccc(O)cc4)CC3)n2)ncn1	ZINC000450519540	GD	On-Demand	Anodyne	PLA2G2A	22	40
CCOC(=O)[C@H](CO)NC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450519550	EE	On-Demand	Anodyne	CTRB_BOVIN	41	38
CCOC(=O)[C@@H](CO)NC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450519551	EE	On-Demand	Anodyne	CTRB_BOVIN	41	38
CCc1cccc(C(=O)Nc2cccnc2OCC(F)F)n1	ZINC000450519568	DF	On-Demand	Anodyne	PDE5A	25	41
CCc1cccc(C(=O)Nc2cccnc2OCC(F)F)n1	ZINC000450519568	DF	On-Demand	Anodyne	G2YM83_BOTF4	66	36
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)c3cncc(Cl)c3)no2)cn1	ZINC000450519571	GG	On-Demand	Anodyne	COLA	60	46
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)c3cncc(Cl)c3)no2)cn1	ZINC000450519571	GG	On-Demand	Anodyne	CPT1A	59	46
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)c3cncc(Cl)c3)no2)cn1	ZINC000450519571	GG	On-Demand	Anodyne	GRM5	15	41
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)c3cncc(Cl)c3)no2)cn1	ZINC000450519573	GG	On-Demand	Anodyne	COLA	60	46
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)c3cncc(Cl)c3)no2)cn1	ZINC000450519573	GG	On-Demand	Anodyne	CPT1A	59	46
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)c3cncc(Cl)c3)no2)cn1	ZINC000450519573	GG	On-Demand	Anodyne	GRM5	15	41
COc1ccc2c(c1)CCCCN2C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450519574	GH	On-Demand	Bother	DRD4	45	36
COc1ccc2c(c1)CCCCN2C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450519574	GH	On-Demand	Bother	AVPR2	17	44
COc1ccc2c(c1)CCCCN2C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450519574	GH	On-Demand	Bother	TAAR1	20	41
COc1ccc2c(c1)CCCCN2C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450519574	GH	On-Demand	Bother	AKR1C3	17	41
COc1ccc2c(c1)CCCCN2C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450519574	GH	On-Demand	Bother	AKR1C2	15	41
O=C(O)COc1cccc(CNC(=O)C2(C3CC3)CCOCC2)c1	ZINC000450519586	ED	On-Demand	Anodyne	PDS	41	32
CCOC(=O)c1cc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)on1	ZINC000450519587	GD	On-Demand	Anodyne	SSTR5	40	40
CCOC(=O)c1cc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)on1	ZINC000450519587	GD	On-Demand	Anodyne	CCR3	42	33
CCOC(=O)c1cc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)on1	ZINC000450519589	GD	On-Demand	Anodyne	SSTR5	40	40
CCOC(=O)c1cc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)on1	ZINC000450519589	GD	On-Demand	Anodyne	CCR3	42	33
COc1ccc(C(=O)NC[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450519590	DE	On-Demand	Anodyne	ADRB3	24	40
COc1ccc(C(=O)NC[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450519591	DE	On-Demand	Anodyne	ADRB3	24	40
COc1ccc(C(=O)N2CCC(O)(C(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450519593	FE	On-Demand	Anodyne	OXTR	25	41
C[C@H](CN1CCN(C(=O)c2ccc(O)cc2)CC1)S(C)(=O)=O	ZINC000450519594	EC	On-Demand	Anodyne	L3MBTL3	43	34
O=C(O)CCCN(Cc1ccccc1)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450519595	FH	On-Demand	Anodyne	FFAR2	66	39
C[C@@H](CN1CCN(C(=O)c2ccc(O)cc2)CC1)S(C)(=O)=O	ZINC000450519596	EC	On-Demand	Anodyne	L3MBTL3	43	34
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519601	GG	On-Demand	Anodyne	PPARG	15	46
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519601	GG	On-Demand	Anodyne	PPARA	26	46
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519601	GG	On-Demand	Anodyne	MME	36	44
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519601	GG	On-Demand	Anodyne	TRPV1	26	41
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519601	GG	On-Demand	Anodyne	PPARD	27	46
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519601	GG	On-Demand	Anodyne	NCE103	23	41
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519601	GG	On-Demand	Anodyne	P96878_MYCTU	18	41
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450519601	GG	On-Demand	Anodyne	CAN2	0	41
COc1ccc(-c2noc(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)n2)cc1	ZINC000450519603	FD	On-Demand	Anodyne	MTOR	59	36
COc1ccc(-c2noc(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)n2)cc1	ZINC000450519603	FD	On-Demand	Anodyne	S1PR1	16	40
COc1ccc(-c2noc(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)n2)cc1	ZINC000450519603	FD	On-Demand	Anodyne	NPBWR1	49	31
C=CCOc1ccc(CC(=O)N[C@@H](C)[C@H]2CCCN(C3CCC3)C2)cc1	ZINC000450519616	FH	On-Demand	Mild	BIRC2	40	34
C=CCOc1ccc(CC(=O)N[C@H](C)[C@@H]2CCCN(C3CCC3)C2)cc1	ZINC000450519617	FH	On-Demand	Mild	BIRC2	40	34
C=CCOc1ccc(CC(=O)N[C@H](C)[C@H]2CCCN(C3CCC3)C2)cc1	ZINC000450519618	FH	On-Demand	Mild	BIRC2	40	34
C=CCOc1ccc(CC(=O)N[C@@H](C)[C@@H]2CCCN(C3CCC3)C2)cc1	ZINC000450519619	FH	On-Demand	Mild	BIRC2	40	34
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)C1(C)CC1	ZINC000450519620	CC	On-Demand	Anodyne	SLC6A1	65	32
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)C1(C)CC1	ZINC000450519621	CC	On-Demand	Anodyne	SLC6A1	65	32
CCOc1nc2ccc(C(=O)N3CCC(C)(c4nc(C)no4)CC3)cc2[nH]1	ZINC000450519622	FF	On-Demand	Anodyne	ACACA	57	40
CCOc1nc2ccc(C(=O)N3CCC(C)(c4nc(C)no4)CC3)cc2[nH]1	ZINC000450519622	FF	On-Demand	Anodyne	ACACB	48	40
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	ACE	20	46
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	MME	27	42
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	EDNRB	51	38
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	CCKAR	22	43
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	MPO	41	33
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	MMP14	46	33
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	ECE1	58	43
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	NPR	28	42
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	SLC15A2	0	44
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	KISS1R	53	34
Cc1oc(C(C)C)cc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519623	FH	On-Demand	Anodyne	ERAP2	40	37
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	ACE	20	46
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	MME	27	42
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	EDNRB	51	38
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	CCKAR	22	43
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	MPO	41	33
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	MMP14	46	33
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	ECE1	58	43
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	NPR	28	42
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	SLC15A2	0	44
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	KISS1R	53	34
Cc1oc(C(C)C)cc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450519624	FH	On-Demand	Anodyne	ERAP2	40	37
O=C(O)c1ccc2c(c1)CN(C(=O)C1(c3ccc(C(F)(F)F)cc3)CC1)CC2	ZINC000450519631	GI	On-Demand	Anodyne	CCR2	20	46
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H]3CCCCN3C(C)C)C2)n1	ZINC000450519642	FG	On-Demand	Anodyne	SLC6A1	44	33
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H]3CCCCN3C(C)C)C2)n1	ZINC000450519642	FG	On-Demand	Anodyne	PDE8A	0	40
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H]3CCCCN3C(C)C)C2)n1	ZINC000450519643	FG	On-Demand	Anodyne	SLC6A1	44	33
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H]3CCCCN3C(C)C)C2)n1	ZINC000450519643	FG	On-Demand	Anodyne	PDE8A	0	40
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H]3CCCCN3C(C)C)C2)n1	ZINC000450519644	FG	On-Demand	Anodyne	SLC6A1	44	33
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H]3CCCCN3C(C)C)C2)n1	ZINC000450519644	FG	On-Demand	Anodyne	PDE8A	0	40
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H]3CCCCN3C(C)C)C2)n1	ZINC000450519645	FG	On-Demand	Anodyne	SLC6A1	44	33
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H]3CCCCN3C(C)C)C2)n1	ZINC000450519645	FG	On-Demand	Anodyne	PDE8A	0	40
CC(=O)[C@@](C)(O)CN1CC=C(c2c[nH]c3cc(C)ccc23)CC1	ZINC000450519646	DF	On-Demand	Anodyne	HTR1A	0	42
CC(=O)[C@@](C)(O)CN1CC=C(c2c[nH]c3cc(C)ccc23)CC1	ZINC000450519646	DF	On-Demand	Anodyne	SLC6A4	0	50
CC(=O)[C@](C)(O)CN1CC=C(c2c[nH]c3cc(C)ccc23)CC1	ZINC000450519647	DF	On-Demand	Anodyne	HTR1A	0	42
CC(=O)[C@](C)(O)CN1CC=C(c2c[nH]c3cc(C)ccc23)CC1	ZINC000450519647	DF	On-Demand	Anodyne	SLC6A4	0	50
C[C@@H](O)CCN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1	ZINC000450519661	EE	On-Demand	Anodyne	MAPK1	28	41
C[C@@H](O)CCN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1	ZINC000450519661	EE	On-Demand	Anodyne	KCNMA1	24	40
C[C@H](O)CCN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1	ZINC000450519662	EE	On-Demand	Anodyne	MAPK1	28	41
C[C@H](O)CCN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1	ZINC000450519662	EE	On-Demand	Anodyne	KCNMA1	24	40
O=C(Nc1ccc(Cl)cn1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450519677	DD	On-Demand	Anodyne	F10	30	47
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1cc(Cl)cc(Cl)c1)C(=O)O	ZINC000450519681	GC	On-Demand	Anodyne	ACE2	61	36
CN(C)S(=O)(=O)CC(=O)N[C@H](Cc1cc(Cl)cc(Cl)c1)C(=O)O	ZINC000450519681	GC	On-Demand	Anodyne	SLC15A2	0	40
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1cc(Cl)cc(Cl)c1)C(=O)O	ZINC000450519682	GC	On-Demand	Anodyne	ACE2	61	36
CN(C)S(=O)(=O)CC(=O)N[C@@H](Cc1cc(Cl)cc(Cl)c1)C(=O)O	ZINC000450519682	GC	On-Demand	Anodyne	SLC15A2	0	40
COc1cc(CC(=O)N2CC[C@H](n3ncc4ccccc43)C2)ccc1Cl	ZINC000450519683	FH	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2CC[C@H](n3ncc4ccccc43)C2)ccc1Cl	ZINC000450519683	FH	On-Demand	Anodyne	CCR3	31	40
COc1cc(CC(=O)N2CC[C@@H](n3ncc4ccccc43)C2)ccc1Cl	ZINC000450519684	FH	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2CC[C@@H](n3ncc4ccccc43)C2)ccc1Cl	ZINC000450519684	FH	On-Demand	Anodyne	CCR3	31	40
CCc1cc(CCCN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)on1	ZINC000450519688	FG	On-Demand	Anodyne	SLC6A1	76	34
CCc1cc(CCCN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)on1	ZINC000450519688	FG	On-Demand	Anodyne	PDE8A	0	40
CCc1cc(CCCN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)on1	ZINC000450519689	FG	On-Demand	Anodyne	SLC6A1	76	34
CCc1cc(CCCN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)on1	ZINC000450519689	FG	On-Demand	Anodyne	PDE8A	0	40
CCOC(=O)c1ccc(CN(CC)c2cccc(OC)c2)nc1	ZINC000450519717	DG	On-Demand	Anodyne	P2RY12	19	43
CCOC(=O)c1ccc(CN(CC)c2cccc(OC)c2)nc1	ZINC000450519717	DG	On-Demand	Anodyne	MTNR1A	18	46
COCCCOc1ccc(CNc2nccc(-c3cnccn3)n2)cc1	ZINC000450519734	FF	On-Demand	Anodyne	CLK4	23	44
CC[C@@H]1CCC[C@H]1C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450519735	CE	On-Demand	Anodyne	XIAP	50	37
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450519736	CE	On-Demand	Anodyne	XIAP	50	37
CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450519737	CE	On-Demand	Anodyne	XIAP	50	37
CC[C@@H]1CCC[C@H]1C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450519738	CE	On-Demand	Anodyne	XIAP	50	37
COc1ccc(OC(F)(F)F)c(C(=O)NC(CO)CO)c1	ZINC000450519739	DC	On-Demand	Anodyne	AKR1C2	44	35
COc1ccc(OC(F)(F)F)c(C(=O)NC(CO)CO)c1	ZINC000450519739	DC	On-Demand	Anodyne	KCNK9	26	42
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	HTR1A	30	49
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	DRD2	33	49
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	DRD1	17	45
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	DRD4	25	50
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	HTR2A	31	48
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	HTR2C	25	56
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	SLC6A1	65	36
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	DRD3	24	56
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	DRD5	21	50
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	HTR7	45	46
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	SIGMAR1	27	56
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCC(C(=O)N2CCc3ccccc32)CC1)c1ccccc1	ZINC000450519756	GH	On-Demand	Anodyne	CYP2J2	65	46
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450519757	GF	On-Demand	Anodyne	CACNA1B	52	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450519757	GF	On-Demand	Anodyne	LIPG	42	32
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450519757	GF	On-Demand	Anodyne	SFRP1	88	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450519757	GF	On-Demand	Anodyne	WNT3	67	32
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450519759	GD	On-Demand	Anodyne	E1	0	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450519759	GD	On-Demand	Anodyne	LUXR	54	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450519759	GD	On-Demand	Anodyne	PHZR	0	42
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450519760	GD	On-Demand	Anodyne	E1	0	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450519760	GD	On-Demand	Anodyne	LUXR	54	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450519760	GD	On-Demand	Anodyne	PHZR	0	42
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450519767	EG	On-Demand	Anodyne	P2RX7	24	48
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H]1CC12CCSCC2	ZINC000450519768	EG	On-Demand	Anodyne	P2RX7	24	48
CCc1cc(CCCN2CCC(C(=O)N3CCc4ccccc43)CC2)on1	ZINC000450519799	FG	On-Demand	Anodyne	CYP2J2	44	32
O=C(NCc1ccccc1CN1CCC[C@H]1CO)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450519802	FE	On-Demand	Anodyne	P2RX7	35	40
O=C(NCc1ccccc1CN1CCC[C@@H]1CO)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450519804	FE	On-Demand	Anodyne	P2RX7	35	40
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	F10	20	41
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	ANPEP	19	46
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	CTSB	29	43
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	CTSL	33	41
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	CCR3	0	53
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	CTSS	25	41
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	CTSV	30	41
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	CTRB_BOVIN	59	38
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519810	GD	On-Demand	Anodyne	E1	0	44
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	F10	20	41
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	ANPEP	19	46
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	CTSB	29	43
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	CTSL	33	41
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	CCR3	0	53
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	CTSS	25	41
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	CTSV	30	41
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	CTRB_BOVIN	59	38
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450519812	GD	On-Demand	Anodyne	E1	0	44
CN1CCC(Oc2ccc(CNc3cccc(Cl)c3C#N)cc2)CC1	ZINC000450519835	FI	On-Demand	Mild	UTS2R	24	40
CC1(O)CC(C(=O)Nc2ccc3cccc(Cl)c3n2)C1	ZINC000450519840	CF	On-Demand	Anodyne	TYK2	53	39
O=C(O)CSCc1cccc(NC(=O)CCCc2cc(F)ccc2F)c1	ZINC000450519853	GI	On-Demand	Anodyne	PARP10	0	41
O=C(c1ccc(O)cc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450519868	EG	On-Demand	Anodyne	FABI	65	47
O=C(c1ccc(O)cc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450519868	EG	On-Demand	Anodyne	HRH3	0	41
O=C(c1ccc(O)cc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450519868	EG	On-Demand	Anodyne	PLA2G2A	31	47
O=C(c1ccc(O)cc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450519868	EG	On-Demand	Anodyne	LSS	24	56
O=C(c1ccc(O)cc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450519868	EG	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc(O)cc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450519868	EG	On-Demand	Anodyne	MBTD1	0	40
O=C(c1ccc(O)cc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450519868	EG	On-Demand	Anodyne	KCNJ1	55	38
O=C(c1ccc(O)cc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450519868	EG	On-Demand	Anodyne	SLC6A7	0	43
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCOCCO	ZINC000450519877	DE	On-Demand	Anodyne	PPARA	17	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCOCCO	ZINC000450519877	DE	On-Demand	Anodyne	PPARD	25	42
CC(=O)N[C@H](C(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)C(C)(C)C	ZINC000450519878	GE	On-Demand	Anodyne	BIRC2	35	46
CC(=O)N[C@H](C(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)C(C)(C)C	ZINC000450519879	GE	On-Demand	Anodyne	BIRC2	35	46
CC1(C(=O)NCc2cccc(OCC(=O)O)c2)CC1	ZINC000450519895	CD	On-Demand	Anodyne	HRH2	22	40
CC1(C(=O)NCc2cccc(OCC(=O)O)c2)CC1	ZINC000450519895	CD	On-Demand	Anodyne	FABP4	46	35
CC1(C(=O)NCc2cccc(OCC(=O)O)c2)CC1	ZINC000450519895	CD	On-Demand	Anodyne	PLA2G4B	27	40
CC1(C(=O)NCc2cccc(OCC(=O)O)c2)CC1	ZINC000450519895	CD	On-Demand	Anodyne	FFAR1	34	41
CC1(C(=O)NCc2cccc(OCC(=O)O)c2)CC1	ZINC000450519895	CD	On-Demand	Anodyne	CRTH2	0	40
CC1(C(=O)NCc2cccc(OCC(=O)O)c2)CC1	ZINC000450519895	CD	On-Demand	Anodyne	PDS	70	38
Cc1ccc(F)c(CC(=O)Nc2cccnc2OCC(F)F)c1	ZINC000450519909	DG	On-Demand	Anodyne	P2RY1	38	42
O=C(Cc1ccc(OC(F)F)c(F)c1)NCC[C@H]1CCCCO1	ZINC000450519911	EG	On-Demand	Anodyne	PDEC	0	40
O=C(Cc1ccc(OC(F)F)c(F)c1)NCC[C@@H]1CCCCO1	ZINC000450519912	EG	On-Demand	Anodyne	PDEC	0	40
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1)C(F)(F)F	ZINC000450519916	GI	On-Demand	Anodyne	FABI	59	38
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1)C(F)(F)F	ZINC000450519916	GI	On-Demand	Anodyne	L3MBTL1	0	44
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1)C(F)(F)F	ZINC000450519916	GI	On-Demand	Anodyne	L3MBTL3	23	44
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1)C(F)(F)F	ZINC000450519916	GI	On-Demand	Anodyne	MBTD1	0	44
C[C@H](c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1)C(F)(F)F	ZINC000450519917	GI	On-Demand	Anodyne	FABI	59	38
C[C@H](c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1)C(F)(F)F	ZINC000450519917	GI	On-Demand	Anodyne	L3MBTL1	0	44
C[C@H](c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1)C(F)(F)F	ZINC000450519917	GI	On-Demand	Anodyne	L3MBTL3	23	44
C[C@H](c1ccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)cc1)C(F)(F)F	ZINC000450519917	GI	On-Demand	Anodyne	MBTD1	0	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	DRD2	19	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	DRD4	43	43
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	ACHE	29	41
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	DRD3	0	43
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	CHRM3	22	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	SIGMAR1	30	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	CCR3	42	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	MAPK1	28	42
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	FAAH	20	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	MCHR1	47	43
CC(=O)c1cccc(CN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)c1	ZINC000450519927	GI	On-Demand	Anodyne	CACNA1G	38	40
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450519936	FH	On-Demand	Anodyne	SFRP1	59	32
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450519936	FH	On-Demand	Anodyne	WNT3	41	30
O=C(Nc1cccnc1OCC(F)F)[C@H](O)C1CCC1	ZINC000450519937	CD	On-Demand	Anodyne	P2RY1	46	35
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450519938	FH	On-Demand	Anodyne	SFRP1	59	32
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450519938	FH	On-Demand	Anodyne	WNT3	41	30
O=C(Nc1cccnc1OCC(F)F)[C@@H](O)C1CCC1	ZINC000450519940	CD	On-Demand	Anodyne	P2RY1	46	35
C[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450519953	FI	On-Demand	Anodyne	BIRC3	41	37
C[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450519953	FI	On-Demand	Anodyne	BIRC2	41	34
C[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519954	FI	On-Demand	Anodyne	BIRC3	41	37
C[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519954	FI	On-Demand	Anodyne	BIRC2	41	34
C[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519955	FI	On-Demand	Anodyne	BIRC3	41	37
C[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450519955	FI	On-Demand	Anodyne	BIRC2	41	34
C[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450519957	FI	On-Demand	Anodyne	BIRC3	41	37
C[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450519957	FI	On-Demand	Anodyne	BIRC2	41	34
COc1ccc(-c2ccnc(N3CCC(CC(F)(F)F)CC3)n2)cc1	ZINC000450519962	FI	On-Demand	Anodyne	DKK1	0	51
Cc1ccc(C(=O)N2CCC[C@](C)(O)C2)cc1C(=O)N1CCC[C@@](C)(O)C1	ZINC000450519967	FD	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCC[C@](C)(O)C2)cc1C(=O)N1CCC[C@@](C)(O)C1	ZINC000450519967	FD	On-Demand	Anodyne	TP53BP1	0	41
Cc1ccc(C(=O)N2CCC[C@@](C)(O)C2)cc1C(=O)N1CCC[C@@](C)(O)C1	ZINC000450519970	FD	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCC[C@@](C)(O)C2)cc1C(=O)N1CCC[C@@](C)(O)C1	ZINC000450519970	FD	On-Demand	Anodyne	TP53BP1	0	41
Cc1ccc(C(=O)N2CCC[C@@](C)(O)C2)cc1C(=O)N1CCC[C@](C)(O)C1	ZINC000450519971	FD	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCC[C@@](C)(O)C2)cc1C(=O)N1CCC[C@](C)(O)C1	ZINC000450519971	FD	On-Demand	Anodyne	TP53BP1	0	41
Cc1ccc(C(=O)N2CCC[C@](C)(O)C2)cc1C(=O)N1CCC[C@](C)(O)C1	ZINC000450519973	FD	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCC[C@](C)(O)C2)cc1C(=O)N1CCC[C@](C)(O)C1	ZINC000450519973	FD	On-Demand	Anodyne	TP53BP1	0	41
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1cccc(F)c1F	ZINC000450519974	FI	On-Demand	Anodyne	TIMP3	48	31
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1cccc(F)c1F	ZINC000450519974	FI	On-Demand	Anodyne	ACAT	0	40
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1cccc(F)c1F	ZINC000450519976	FI	On-Demand	Anodyne	TIMP3	48	31
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1cccc(F)c1F	ZINC000450519976	FI	On-Demand	Anodyne	ACAT	0	40
O=C(Nc1ccc(Br)cn1)C1CCN(CC2=CCCCC2)CC1	ZINC000450519979	GH	On-Demand	Anodyne	CXCR3	20	43
CC(C)N(Cc1ccn(CC(F)(F)F)n1)c1ccccc1	ZINC000450519980	CH	On-Demand	Anodyne	TAAR1	17	40
CC(F)(F)c1ccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)cn1	ZINC000450519988	FH	On-Demand	Anodyne	SFRP1	41	38
CC(F)(F)c1ccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)cn1	ZINC000450519988	FH	On-Demand	Anodyne	L3MBTL3	44	38
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)cn1	ZINC000450519990	FH	On-Demand	Anodyne	SFRP1	41	38
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)cn1	ZINC000450519990	FH	On-Demand	Anodyne	L3MBTL3	44	38
COCCN1C(=O)N[C@@H]2CN(c3nc(C(C)=O)c(C)s3)CC[C@@H]21	ZINC000450519991	ED	On-Demand	Anodyne	PARE	50	36
CCC[C@@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1	ZINC000450520003	FF	On-Demand	Anodyne	SLC6A1	41	34
CCC[C@H](O)CN1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1	ZINC000450520004	FF	On-Demand	Anodyne	SLC6A1	41	34
CCC[C@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1	ZINC000450520005	FF	On-Demand	Anodyne	SLC6A1	41	34
CCC[C@@H](O)CN1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1	ZINC000450520006	FF	On-Demand	Anodyne	SLC6A1	41	34
CCC(CC)Oc1ccc(C(=O)NCCN2CCNC(=O)C2)cc1	ZINC000450520007	ED	On-Demand	Anodyne	DRD4	44	34
CCC(CC)Oc1ccc(C(=O)NCCN2CCNC(=O)C2)cc1	ZINC000450520007	ED	On-Demand	Anodyne	PLD1	48	40
CCC(CC)Oc1ccc(C(=O)NCCN2CCNC(=O)C2)cc1	ZINC000450520007	ED	On-Demand	Anodyne	PLD2	68	42
CCS(=O)(=O)c1ccc(CN2CC=C(c3c[nH]c4cc(C)ccc34)CC2)cc1	ZINC000450520008	GJ	On-Demand	Anodyne	HTR1A	15	42
CCS(=O)(=O)c1ccc(CN2CC=C(c3c[nH]c4cc(C)ccc34)CC2)cc1	ZINC000450520008	GJ	On-Demand	Anodyne	SLC6A4	19	47
CCc1cc(CCCN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)on1	ZINC000450520010	GH	On-Demand	Anodyne	HRP1_PLAFA	41	38
CCc1cc(CCCN2CCC(C(=O)Nc3cc(Cl)ccc3O)CC2)on1	ZINC000450520010	GH	On-Demand	Anodyne	HNMT	42	32
O=C(O)[C@@H]1CCN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450520011	EF	On-Demand	Anodyne	LIPG	50	36
O=C(O)[C@H]1CCN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450520012	EF	On-Demand	Anodyne	LIPG	50	36
Cc1ccc2[nH]c(C(=O)N[C@@H](C)CCC(=O)O)c(C)c2c1	ZINC000450520017	CF	On-Demand	Anodyne	NCE103	44	38
Cc1ccc2[nH]c(C(=O)N[C@H](C)CCC(=O)O)c(C)c2c1	ZINC000450520018	CF	On-Demand	Anodyne	NCE103	44	38
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)cc1	ZINC000450520019	FG	On-Demand	Anodyne	SLC6A1	89	38
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)cc1	ZINC000450520019	FG	On-Demand	Anodyne	CCR3	42	35
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)cc1	ZINC000450520019	FG	On-Demand	Anodyne	PDE8A	0	45
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)cc1	ZINC000450520019	FG	On-Demand	Anodyne	GPBAR1	0	45
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)cc1	ZINC000450520020	FG	On-Demand	Anodyne	SLC6A1	89	38
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)cc1	ZINC000450520020	FG	On-Demand	Anodyne	CCR3	42	35
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)cc1	ZINC000450520020	FG	On-Demand	Anodyne	PDE8A	0	45
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)cc1	ZINC000450520020	FG	On-Demand	Anodyne	GPBAR1	0	45
Cc1cc(OCc2ccccc2)nc(N2C[C@@H](C)[C@H](C(=O)N3CCOCC3)C2)n1	ZINC000450520023	GE	On-Demand	Anodyne	SSTR3	80	32
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)C1(Oc2ccccc2F)CC1	ZINC000450520024	GD	On-Demand	Anodyne	SLC6A1	155	42
CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)C1(Oc2ccccc2F)CC1	ZINC000450520024	GD	On-Demand	Anodyne	FDFT1	24	40
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)C1(Oc2ccccc2F)CC1	ZINC000450520025	GD	On-Demand	Anodyne	SLC6A1	155	42
CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)C1(Oc2ccccc2F)CC1	ZINC000450520025	GD	On-Demand	Anodyne	FDFT1	24	40
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450520027	GH	On-Demand	Anodyne	ACE	23	40
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450520027	GH	On-Demand	Anodyne	SIGMAR1	19	61
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450520028	GH	On-Demand	Anodyne	ACE	23	40
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000450520028	GH	On-Demand	Anodyne	SIGMAR1	19	61
COc1cc(CN2CCC(N(C)S(C)(=O)=O)CC2)ccc1Cl	ZINC000450520035	EE	On-Demand	Anodyne	AVPR1B	44	36
COc1cc(CN2CCC(N(C)S(C)(=O)=O)CC2)ccc1Cl	ZINC000450520035	EE	On-Demand	Anodyne	UTS2R	30	41
COc1cc(CN2CCC(N(C)S(C)(=O)=O)CC2)ccc1Cl	ZINC000450520035	EE	On-Demand	Anodyne	MCHR1	28	44
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)CC1CCC(=O)CC1	ZINC000450520040	GG	On-Demand	Anodyne	MAOB	19	40
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)CC1CCC(=O)CC1	ZINC000450520040	GG	On-Demand	Anodyne	LTA4H	30	41
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)CC1CCC(=O)CC1	ZINC000450520040	GG	On-Demand	Anodyne	HRAS	49	32
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)CC1CCC(=O)CC1	ZINC000450520040	GG	On-Demand	Anodyne	FFAR1	31	41
COCc1nn(C)cc1C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450520048	ED	On-Demand	Anodyne	P2RX7	16	49
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1	ZINC000450520051	FC	On-Demand	Anodyne	FOLH1	42	33
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1	ZINC000450520051	FC	On-Demand	Anodyne	TPH1	50	37
CN(C)S(=O)(=O)CC(=O)N[C@H](C(=O)O)c1ccc2ccccc2c1	ZINC000450520051	FC	On-Demand	Anodyne	UTS2	43	42
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccc2ccccc2c1	ZINC000450520052	FC	On-Demand	Anodyne	FOLH1	42	33
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccc2ccccc2c1	ZINC000450520052	FC	On-Demand	Anodyne	TPH1	50	37
CN(C)S(=O)(=O)CC(=O)N[C@@H](C(=O)O)c1ccc2ccccc2c1	ZINC000450520052	FC	On-Demand	Anodyne	UTS2	43	42
COc1cc(CC(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)ccc1Cl	ZINC000450520083	GD	On-Demand	Anodyne	OPRK1	34	41
COc1ccc(Oc2ccc(C(=O)NC(CO)CO)nc2)cc1	ZINC000450520084	DC	On-Demand	Anodyne	ACACB	40	39
COc1ccc(Oc2ccc(C(=O)NC(CO)CO)nc2)cc1	ZINC000450520084	DC	On-Demand	Anodyne	NPBWR1	44	33
CCS(=O)(=O)c1ccc(CN(CC(=O)OC)C(C)C)cc1	ZINC000450520092	DD	On-Demand	Anodyne	RORC	40	38
CC(C)N(Cc1nc(O)c2ccccc2n1)Cc1ccccc1OC1CC1	ZINC000450520095	FI	On-Demand	Anodyne	TNKS	50	36
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)CC1CC(F)(F)C1	ZINC000450520110	FH	On-Demand	Anodyne	EPOR	0	40
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)CC1CC(F)(F)C1	ZINC000450520110	FH	On-Demand	Anodyne	HRAS	51	35
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)CC1CC(F)(F)C1	ZINC000450520110	FH	On-Demand	Anodyne	FFAR1	28	42
N#CC1(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)CCC1	ZINC000450520126	EF	On-Demand	Mild	CACNA1G	42	48
CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C(C)(C)C1	ZINC000450520137	FE	On-Demand	Mild	TRPV4	40	31
COC(=O)CCN1CC[C@H](NC(=O)CCOc2cccc(OC)c2)C1=O	ZINC000450520140	FC	On-Demand	Anodyne	DRD4	40	31
COC(=O)CCN1CC[C@H](NC(=O)CCOc2cccc(OC)c2)C1=O	ZINC000450520140	FC	On-Demand	Anodyne	AVPR1B	27	40
COC(=O)CCN1CC[C@H](NC(=O)CCOc2cccc(OC)c2)C1=O	ZINC000450520140	FC	On-Demand	Anodyne	MTNR1A	22	41
COC(=O)CCN1CC[C@@H](NC(=O)CCOc2cccc(OC)c2)C1=O	ZINC000450520141	FC	On-Demand	Anodyne	DRD4	40	31
COC(=O)CCN1CC[C@@H](NC(=O)CCOc2cccc(OC)c2)C1=O	ZINC000450520141	FC	On-Demand	Anodyne	AVPR1B	27	40
COC(=O)CCN1CC[C@@H](NC(=O)CCOc2cccc(OC)c2)C1=O	ZINC000450520141	FC	On-Demand	Anodyne	MTNR1A	22	41
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	DRD2	37	52
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	DRD4	50	43
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	ACHE	27	44
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	HTR2A	15	44
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	HRH1	31	42
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	DRD3	31	49
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	KCNH2	21	42
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	HTR4	67	48
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	CHRM3	19	45
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	GRIN2B	16	47
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	SIGMAR1	39	45
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	SSTR5	79	42
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	P2RX7	45	39
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	CCR1	45	45
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	CCR3	88	47
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	CCR5	15	47
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	SLC18A3	18	42
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	MLNR	53	40
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	EPHX2	25	45
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	CXCR3	27	45
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	MCHR1	53	48
COc1cc(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450520142	GI	On-Demand	Anodyne	CACNA1G	65	60
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(C)cn2)CC1	ZINC000450520143	FG	On-Demand	Anodyne	F11	41	34
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520147	FF	On-Demand	Anodyne	COLA	65	45
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520147	FF	On-Demand	Anodyne	CPT1A	47	44
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(C)cn2)CC1	ZINC000450520148	FG	On-Demand	Anodyne	F11	41	34
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520157	FF	On-Demand	Anodyne	COLA	65	45
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520157	FF	On-Demand	Anodyne	CPT1A	47	44
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520158	FF	On-Demand	Anodyne	COLA	65	45
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520158	FF	On-Demand	Anodyne	CPT1A	47	44
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520159	FF	On-Demand	Anodyne	COLA	65	45
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520159	FF	On-Demand	Anodyne	CPT1A	47	44
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520173	CE	On-Demand	Anodyne	XIAP	54	37
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520173	CE	On-Demand	Anodyne	BIRC3	44	37
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520173	CE	On-Demand	Anodyne	BIRC8	55	36
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520174	CE	On-Demand	Anodyne	XIAP	54	37
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520174	CE	On-Demand	Anodyne	BIRC3	44	37
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520174	CE	On-Demand	Anodyne	BIRC8	55	36
Cc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(Cl)c1Cl	ZINC000450520176	GH	On-Demand	Anodyne	DRD4	27	42
Cc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(Cl)c1Cl	ZINC000450520176	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(Cl)c1Cl	ZINC000450520176	GH	On-Demand	Anodyne	MCHR1	19	40
Cc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(Cl)c1Cl	ZINC000450520177	GH	On-Demand	Anodyne	DRD4	27	42
Cc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(Cl)c1Cl	ZINC000450520177	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(Cl)c1Cl	ZINC000450520177	GH	On-Demand	Anodyne	MCHR1	19	40
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1CCC(F)(F)F	ZINC000450520179	GH	On-Demand	Anodyne	MME	38	42
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1CCC(F)(F)F	ZINC000450520179	GH	On-Demand	Anodyne	ANPEP	56	35
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1CCC(F)(F)F	ZINC000450520179	GH	On-Demand	Anodyne	CPA1	50	48
O=C1CN(CCNC(=O)c2c(F)ccc(SCC3CC3)c2F)CCN1	ZINC000450520184	FD	On-Demand	Anodyne	PLD1	46	35
O=C1CN(CCNC(=O)c2c(F)ccc(SCC3CC3)c2F)CCN1	ZINC000450520184	FD	On-Demand	Anodyne	PLD2	55	37
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1CCC(F)(F)F	ZINC000450520185	GH	On-Demand	Anodyne	MME	38	42
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1CCC(F)(F)F	ZINC000450520185	GH	On-Demand	Anodyne	ANPEP	56	35
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1CCC(F)(F)F	ZINC000450520185	GH	On-Demand	Anodyne	CPA1	50	48
Cc1cc(C(=O)N2Cc3cc(Br)ccc3C[C@H]2C)nn1C(C)C	ZINC000450520188	GI	On-Demand	Anodyne	BCL2	0	44
Cc1ccc([C@H](CNC(=O)c2coc(C)c2)C(=O)O)cc1	ZINC000450520190	CE	On-Demand	Anodyne	ITGAV	43	38
Cc1cc(C(=O)N2Cc3cc(Br)ccc3C[C@@H]2C)nn1C(C)C	ZINC000450520191	GI	On-Demand	Anodyne	BCL2	0	44
CCN(Cc1ccc(S(=O)(=O)CC)cc1)c1cccc(OC)c1	ZINC000450520192	EH	On-Demand	Anodyne	CETP	0	40
CCN(Cc1ccc(S(=O)(=O)CC)cc1)c1cccc(OC)c1	ZINC000450520192	EH	On-Demand	Anodyne	MTNR1A	16	42
CCN(Cc1ccc(S(=O)(=O)CC)cc1)c1cccc(OC)c1	ZINC000450520192	EH	On-Demand	Anodyne	MTNR1B	18	42
Cc1ccc([C@@H](CNC(=O)c2coc(C)c2)C(=O)O)cc1	ZINC000450520201	CE	On-Demand	Anodyne	ITGAV	43	38
CC[C@@H]1C[C@H]1C(=O)N1Cc2cc(Br)ccc2C[C@H]1C	ZINC000450520205	DH	On-Demand	Anodyne	PNMT	16	40
CCN(CC)C(=O)[C@@H](NCCC(C)(F)F)c1ccccc1	ZINC000450520219	CG	On-Demand	Anodyne	NPY2R	42	38
FC(F)(F)CC1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450520226	EI	On-Demand	Anodyne	AKT2	29	44
FC(F)(F)CC1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450520226	EI	On-Demand	Anodyne	UTS2R	15	40
FC(F)(F)CC1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450520226	EI	On-Demand	Anodyne	SIRT3	52	32
FC(F)(F)CC1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450520226	EI	On-Demand	Anodyne	SIRT2	45	32
FC(F)(F)CC1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450520226	EI	On-Demand	Anodyne	SIRT1	41	32
CCN(CC)C(=O)[C@H](NCCC(C)(F)F)c1ccccc1	ZINC000450520234	CG	On-Demand	Anodyne	NPY2R	42	38
Cc1scc(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1C	ZINC000450520242	EG	On-Demand	Anodyne	CPA1	40	39
Cc1scc(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1C	ZINC000450520243	EG	On-Demand	Anodyne	CPA1	40	39
O=C(NC1CCCCC1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450520247	GG	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NC1CCCCC1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450520247	GG	On-Demand	Anodyne	SSTR5	44	34
O=C(NC1CCCCC1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450520247	GG	On-Demand	Anodyne	SLC6A5	29	41
O=C(NC1CCCCC1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450520247	GG	On-Demand	Anodyne	EPHX2	33	40
O=C(NC1CCCCC1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450520247	GG	On-Demand	Anodyne	MCHR1	33	42
O=C(NC1CCCCC1)NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450520247	GG	On-Demand	Anodyne	HPGDS	39	45
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	DRD2	28	47
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	DRD4	45	39
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	DRD3	22	43
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	SIGMAR1	27	47
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	ABCC1	78	34
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	TACR3	0	46
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	FAAH	23	42
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	KCNJ1	57	35
O=C(c1ccccn1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450520255	EF	On-Demand	Anodyne	SLC6A7	0	43
COc1ccc2c(c1)C[C@H](C(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1)CO2	ZINC000450520264	GF	On-Demand	Anodyne	BMP1	40	40
COc1ccc2c(c1)C[C@H](C(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1)CO2	ZINC000450520264	GF	On-Demand	Anodyne	ROCK2	25	41
COc1ccc2c(c1)C[C@H](C(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1)CO2	ZINC000450520264	GF	On-Demand	Anodyne	GYS1	25	44
COc1ccc2c(c1)C[C@@H](C(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1)CO2	ZINC000450520267	GF	On-Demand	Anodyne	BMP1	40	40
COc1ccc2c(c1)C[C@@H](C(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1)CO2	ZINC000450520267	GF	On-Demand	Anodyne	ROCK2	25	41
COc1ccc2c(c1)C[C@@H](C(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1)CO2	ZINC000450520267	GF	On-Demand	Anodyne	GYS1	25	44
C[C@H](CN(C(=O)Cc1ccc(Cl)c(F)c1)C1CC1)C(=O)O	ZINC000450520271	DF	On-Demand	Anodyne	OPRK1	0	40
C[C@@H](CN(C(=O)Cc1ccc(Cl)c(F)c1)C1CC1)C(=O)O	ZINC000450520272	DF	On-Demand	Anodyne	OPRK1	0	40
O=C(C1CCN(Cc2cnns2)CC1)N1CCc2ccccc21	ZINC000450520280	EE	On-Demand	Anodyne	DRD4	15	42
O=C(O)[C@@H]1CCN(C(=O)CCCc2cc(F)ccc2F)C1	ZINC000450520283	CE	On-Demand	Anodyne	SLC6A1	62	42
O=C(O)[C@@H]1CCN(C(=O)CCCc2cc(F)ccc2F)C1	ZINC000450520283	CE	On-Demand	Anodyne	DPP4	26	43
O=C(O)[C@H]1CCN(C(=O)CCCc2cc(F)ccc2F)C1	ZINC000450520284	CE	On-Demand	Anodyne	SLC6A1	62	42
O=C(O)[C@H]1CCN(C(=O)CCCc2cc(F)ccc2F)C1	ZINC000450520284	CE	On-Demand	Anodyne	DPP4	26	43
O=C(Cc1ccc(OC(F)F)c(F)c1)NCCN1CCNC(=O)C1	ZINC000450520286	EC	On-Demand	Anodyne	PLD2	55	31
COc1ccc(CN(CC[C@H](C)O)Cc2ccccc2)cc1	ZINC000450520287	CG	On-Demand	Anodyne	G6PC	26	43
COc1ccc(CN(CC[C@@H](C)O)Cc2ccccc2)cc1	ZINC000450520288	CG	On-Demand	Anodyne	G6PC	26	43
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450520289	EH	On-Demand	Anodyne	P2RX7	20	47
COC[C@H](CNC(=O)C[C@@H]1COc2ccccc2O1)OC	ZINC000450520291	CC	On-Demand	Anodyne	ADRA2B	19	42
Cc1nn(-c2ccccc2)cc1CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450520292	EH	On-Demand	Anodyne	P2RX7	24	53
COC[C@@H](CNC(=O)C[C@H]1COc2ccccc2O1)OC	ZINC000450520293	CC	On-Demand	Anodyne	ADRA2B	19	42
COC[C@H](CNC(=O)C[C@H]1COc2ccccc2O1)OC	ZINC000450520294	CC	On-Demand	Anodyne	ADRA2B	19	42
COC[C@@H](CNC(=O)C[C@@H]1COc2ccccc2O1)OC	ZINC000450520295	CC	On-Demand	Anodyne	ADRA2B	19	42
O=C(NC(CO)CO)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450520310	CD	On-Demand	Anodyne	GPR88	0	45
O=C(NC(CO)CO)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450520313	CD	On-Demand	Anodyne	GPR88	0	45
O=C(NC(CO)CO)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450520315	CD	On-Demand	Anodyne	GPR88	0	45
O=C(NC(CO)CO)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450520318	CD	On-Demand	Anodyne	GPR88	0	45
OC1(CCNc2ccnc3cc(F)c(Cl)cc23)CCC1	ZINC000450520340	CH	On-Demand	Anodyne	HRP1_PLAFA	104	39
COc1cccc(C(=O)NCc2ccc(OCCCC(=O)O)cc2)c1[N+](=O)[O-]	ZINC000450520351	GF	On-Demand	Bother	CYSLTR2	42	31
COc1cccc(C(=O)NCc2ccc(OCCCC(=O)O)cc2)c1[N+](=O)[O-]	ZINC000450520351	GF	On-Demand	Bother	PLA2G4B	51	34
COc1cccc(C(=O)NCc2ccc(OCCCC(=O)O)cc2)c1[N+](=O)[O-]	ZINC000450520351	GF	On-Demand	Bother	U38	0	43
CC(C)CC(CC(C)C)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450520352	FH	On-Demand	Anodyne	OPRK1	22	42
CC(C)CC(CC(C)C)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450520352	FH	On-Demand	Anodyne	MCHR1	16	41
CC(C)CC(CC(C)C)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450520354	FH	On-Demand	Anodyne	OPRK1	22	42
CC(C)CC(CC(C)C)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450520354	FH	On-Demand	Anodyne	MCHR1	16	41
COc1ccc(CN(Cc2ccccc2)Cc2cn(CC3CC3)nn2)cc1	ZINC000450520355	FH	On-Demand	Anodyne	HSP90AB1	0	48
COc1ccccc1Oc1ccc(C(=O)NCCCOCCO)nc1	ZINC000450520359	EE	On-Demand	Anodyne	DRD3	28	41
O=C(C1CCN(CC2=CCCCC2)CC1)N1CCc2ccccc21	ZINC000450520370	DH	On-Demand	Anodyne	DRD4	20	44
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520372	GG	On-Demand	Anodyne	PPARA	21	43
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520372	GG	On-Demand	Anodyne	MME	21	41
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520372	GG	On-Demand	Anodyne	CPA1	40	50
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520372	GG	On-Demand	Anodyne	PPARD	18	43
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520372	GG	On-Demand	Anodyne	PDS	41	38
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520373	GG	On-Demand	Anodyne	PPARA	21	43
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520373	GG	On-Demand	Anodyne	MME	21	41
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520373	GG	On-Demand	Anodyne	CPA1	40	50
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520373	GG	On-Demand	Anodyne	PPARD	18	43
O=C(Cc1cccc(OC(F)(F)F)c1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520373	GG	On-Demand	Anodyne	PDS	41	38
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	DRD4	29	42
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	CHRM3	25	44
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	SIGMAR1	31	45
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	SSTR5	48	40
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	CCR3	60	45
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	FAAH	44	55
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	EPHX2	34	43
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	CXCR3	23	47
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	MCHR1	42	43
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	MGLL	0	55
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	CCR8	23	40
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	NMUR2	0	47
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	NMUR1	0	47
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1cccc(CN2CCN(C(=O)NC3CCCCC3)CC2)c1	ZINC000450520374	EG	On-Demand	Anodyne	ADIPOR2	0	41
Cc1ccc2[nH]c(C(=O)NCc3ccc(OCCCC(=O)O)cc3)c(C)c2c1	ZINC000450520378	GH	On-Demand	Anodyne	PPARA	16	50
Cc1ccc2[nH]c(C(=O)NCc3ccc(OCCCC(=O)O)cc3)c(C)c2c1	ZINC000450520378	GH	On-Demand	Anodyne	PLA2G4B	76	36
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450520382	GF	On-Demand	Anodyne	SFRP1	94	34
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450520382	GF	On-Demand	Anodyne	WNT3	63	31
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450520385	GF	On-Demand	Anodyne	SFRP1	94	34
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450520385	GF	On-Demand	Anodyne	WNT3	63	31
COC(=O)c1cccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)c1Cl	ZINC000450520390	GF	On-Demand	Anodyne	FABI	55	36
COC(=O)c1cccc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)c1Cl	ZINC000450520390	GF	On-Demand	Anodyne	CCR8	33	43
N#Cc1ccnc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450520391	EE	On-Demand	Mild	PREP	53	39
COc1cc(CC(=O)Nc2cccnc2OCC(F)F)ccc1Cl	ZINC000450520392	FH	On-Demand	Anodyne	P2RX7	23	48
N#Cc1ccnc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450520393	EE	On-Demand	Mild	PREP	53	39
N#Cc1cccc(N2CC[C@@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000450520401	DD	On-Demand	Mild	SSTR2	29	41
N#Cc1cccc(N2CC[C@@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000450520401	DD	On-Demand	Mild	SSTR1	47	40
N#Cc1cccc(N2CC[C@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000450520403	DD	On-Demand	Mild	SSTR2	29	41
N#Cc1cccc(N2CC[C@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000450520403	DD	On-Demand	Mild	SSTR1	47	40
CC1(C(=O)Nc2cccc(C(=O)N3CCCC[C@H]3C(=O)O)c2)CC1	ZINC000450520405	EF	On-Demand	Anodyne	PREP	32	50
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC(CO)CO	ZINC000450520409	CC	On-Demand	Anodyne	KLK3	52	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC(CO)CO	ZINC000450520409	CC	On-Demand	Anodyne	HLA-A	41	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC(CO)CO	ZINC000450520409	CC	On-Demand	Anodyne	CAPNS1	45	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC(CO)CO	ZINC000450520409	CC	On-Demand	Anodyne	CAPN1	52	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC(CO)CO	ZINC000450520409	CC	On-Demand	Anodyne	CAPN2	56	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC(CO)CO	ZINC000450520409	CC	On-Demand	Anodyne	FPR1	56	37
NC(=O)c1ccc(CCC(=O)NCc2ccccc2CN2CCC[C@H]2CO)cc1	ZINC000450520410	GD	On-Demand	Anodyne	TMPRSS11D	46	35
NC(=O)c1ccc(CCC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)cc1	ZINC000450520411	GD	On-Demand	Anodyne	TMPRSS11D	46	35
CCc1nc(CN2CCN(C[C@H](O)COCCOC)CC2)cs1	ZINC000450520412	EC	On-Demand	Anodyne	ACOX1	55	30
CCc1nc(CN2CCN(C[C@H](O)COCCOC)CC2)cs1	ZINC000450520412	EC	On-Demand	Anodyne	HSP90AB1	37	40
CCc1nc(CN2CCN(C[C@@H](O)COCCOC)CC2)cs1	ZINC000450520413	EC	On-Demand	Anodyne	ACOX1	55	30
CCc1nc(CN2CCN(C[C@@H](O)COCCOC)CC2)cs1	ZINC000450520413	EC	On-Demand	Anodyne	HSP90AB1	37	40
O=C(O)COc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520420	GH	On-Demand	Anodyne	TRPV1	15	42
O=C(O)COc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520420	GH	On-Demand	Anodyne	PPARD	55	50
O=C(O)COc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520420	GH	On-Demand	Anodyne	EPHX2	31	44
O=C(O)COc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520420	GH	On-Demand	Anodyne	ACR	19	40
O=C(O)COc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520420	GH	On-Demand	Anodyne	MCHR1	18	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450520422	DC	On-Demand	Anodyne	ACE	32	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450520422	DC	On-Demand	Anodyne	SLC6A1	43	32
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450520422	DC	On-Demand	Anodyne	P2RY12	107	38
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450520423	DC	On-Demand	Anodyne	ACE	32	42
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450520423	DC	On-Demand	Anodyne	SLC6A1	43	32
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450520423	DC	On-Demand	Anodyne	P2RY12	107	38
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450520424	DC	On-Demand	Anodyne	ACE	32	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450520424	DC	On-Demand	Anodyne	SLC6A1	43	32
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450520424	DC	On-Demand	Anodyne	P2RY12	107	38
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450520425	DC	On-Demand	Anodyne	ACE	32	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450520425	DC	On-Demand	Anodyne	SLC6A1	43	32
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450520425	DC	On-Demand	Anodyne	P2RY12	107	38
CC(C)c1ncsc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450520428	FF	On-Demand	Anodyne	VHL	54	30
CC(C)c1ncsc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450520429	FF	On-Demand	Anodyne	VHL	54	30
N#CC1(CN2CCC(NC(=O)Nc3ccccc3)CC2)CCC1	ZINC000450520430	DF	On-Demand	Mild	SIGMAR1	19	40
N#CC1(CN2CCC(NC(=O)Nc3ccccc3)CC2)CCC1	ZINC000450520430	DF	On-Demand	Mild	EPHX2	46	44
N#CC1(CN2CCC(NC(=O)Nc3ccccc3)CC2)CCC1	ZINC000450520430	DF	On-Demand	Mild	MCHR1	15	40
N#CC1(CN2CCC(NC(=O)Nc3ccccc3)CC2)CCC1	ZINC000450520430	DF	On-Demand	Mild	ACAT	0	40
O=C(O)COc1ccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520431	GI	On-Demand	Anodyne	PPARA	16	41
O=C(O)COc1ccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520431	GI	On-Demand	Anodyne	PPARD	61	52
O=C(O)COc1ccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520431	GI	On-Demand	Anodyne	EPHX2	40	41
O=C(O)COc1ccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450520431	GI	On-Demand	Anodyne	ACR	18	40
CC(C)CCCC(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520432	CE	On-Demand	Anodyne	BIRC3	40	33
CC(C)CCCC(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520432	CE	On-Demand	Anodyne	LUXR	63	35
CC(C)CCCC(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520432	CE	On-Demand	Anodyne	BIRC8	40	32
CC(C)CCCC(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520433	CE	On-Demand	Anodyne	BIRC3	40	33
CC(C)CCCC(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520433	CE	On-Demand	Anodyne	LUXR	63	35
CC(C)CCCC(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520433	CE	On-Demand	Anodyne	BIRC8	40	32
COCC1(C(=O)O)CCN(C(=O)c2cc3cc(OC)ccc3[nH]2)CC1	ZINC000450520434	EE	On-Demand	Anodyne	GRIN2B	23	45
COCC1(C(=O)O)CCN(C(=O)c2cc3cc(OC)ccc3[nH]2)CC1	ZINC000450520434	EE	On-Demand	Anodyne	HRH4	28	45
COCC1(C(=O)O)CCN(C(=O)c2cc3cc(OC)ccc3[nH]2)CC1	ZINC000450520434	EE	On-Demand	Anodyne	TUBB2B	45	51
COCC1(C(=O)O)CCN(C(=O)c2cc3cc(OC)ccc3[nH]2)CC1	ZINC000450520434	EE	On-Demand	Anodyne	FPR2	31	49
COCC1(C(=O)O)CCN(C(=O)C(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000450520435	GG	On-Demand	Anodyne	GHRHR	57	33
COCC1(C(=O)O)CCN(C(=O)C(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000450520435	GG	On-Demand	Anodyne	MME	71	39
COCC1(C(=O)O)CCN(C(=O)C(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000450520435	GG	On-Demand	Anodyne	CPA1	40	36
COCC1(C(=O)O)CCN(C(=O)C(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000450520435	GG	On-Demand	Anodyne	TIMP3	62	36
CCC(=O)CCCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450520470	EG	On-Demand	Anodyne	SLC6A1	118	36
CCC(=O)CCCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450520470	EG	On-Demand	Anodyne	F10	26	44
CCC(=O)CCCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450520471	EG	On-Demand	Anodyne	SLC6A1	118	36
CCC(=O)CCCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450520471	EG	On-Demand	Anodyne	F10	26	44
O=C(O)c1ccc2c(c1)CN(C(=O)C1(Oc3ccccc3F)CC1)CC2	ZINC000450520472	FG	On-Demand	Anodyne	HDAC6	39	41
O=C(O)c1ccc2c(c1)CN(C(=O)C1(Oc3ccccc3F)CC1)CC2	ZINC000450520472	FG	On-Demand	Anodyne	AKR1C3	32	40
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450520474	EF	On-Demand	Anodyne	SLC6A1	53	33
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450520474	EF	On-Demand	Anodyne	F10	18	41
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450520475	EF	On-Demand	Anodyne	SLC6A1	53	33
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450520475	EF	On-Demand	Anodyne	F10	18	41
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450520476	EF	On-Demand	Anodyne	SLC6A1	53	33
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450520476	EF	On-Demand	Anodyne	F10	18	41
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450520477	EF	On-Demand	Anodyne	SLC6A1	53	33
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450520477	EF	On-Demand	Anodyne	F10	18	41
C[C@@H](CCC(=O)O)NC(=O)CCCc1cc(F)ccc1F	ZINC000450520484	CF	On-Demand	Anodyne	MPO	15	41
C[C@H](CCC(=O)O)NC(=O)CCCc1cc(F)ccc1F	ZINC000450520486	CF	On-Demand	Anodyne	MPO	15	41
OC[C@@H](CN1CCCCC1)Nc1ncnc2cc(Br)ccc12	ZINC000450520488	FF	On-Demand	Anodyne	EGFR	37	41
OC[C@@H](CN1CCCCC1)Nc1ncnc2cc(Br)ccc12	ZINC000450520488	FF	On-Demand	Anodyne	HNMT	42	32
OC[C@H](CN1CCCCC1)Nc1ncnc2cc(Br)ccc12	ZINC000450520490	FF	On-Demand	Anodyne	EGFR	37	41
OC[C@H](CN1CCCCC1)Nc1ncnc2cc(Br)ccc12	ZINC000450520490	FF	On-Demand	Anodyne	HNMT	42	32
COCC1(C(=O)O)CCN(C(=O)[C@@H]2COc3ccc(OC)cc3C2)CC1	ZINC000450520508	FD	On-Demand	Anodyne	ROCK2	25	44
COCC1(C(=O)O)CCN(C(=O)[C@@H]2COc3ccc(OC)cc3C2)CC1	ZINC000450520508	FD	On-Demand	Anodyne	CDC42BPA	0	42
COCC1(C(=O)O)CCN(C(=O)[C@H]2COc3ccc(OC)cc3C2)CC1	ZINC000450520510	FD	On-Demand	Anodyne	ROCK2	25	44
COCC1(C(=O)O)CCN(C(=O)[C@H]2COc3ccc(OC)cc3C2)CC1	ZINC000450520510	FD	On-Demand	Anodyne	CDC42BPA	0	42
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	ACE	19	43
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	MME	24	41
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	CCKAR	23	44
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	MPO	52	34
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	MMP14	60	35
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	ECE1	55	41
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	LNPEP	25	41
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	MMP11	57	32
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	MMP9	16	41
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	NPR	27	41
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	SLC15A2	0	45
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	KISS1R	49	34
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	ERAP2	43	41
CCCc1occc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520516	FG	On-Demand	Anodyne	ERAP1	0	41
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	ACE	19	43
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	MME	24	41
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	CCKAR	23	44
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	MPO	52	34
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	MMP14	60	35
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	ECE1	55	41
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	LNPEP	25	41
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	MMP11	57	32
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	MMP9	16	41
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	NPR	27	41
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	SLC15A2	0	45
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	KISS1R	49	34
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	ERAP2	43	41
CCCc1occc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O	ZINC000450520517	FG	On-Demand	Anodyne	ERAP1	0	41
CN1CCC[C@@H](CNc2ccnc3cc(F)c(Cl)cc23)[C@@H]1c1ccnn1C	ZINC000450520538	GI	On-Demand	Anodyne	HRP1_PLAFA	96	36
CN1CCC[C@@H](CNc2ccnc3cc(F)c(Cl)cc23)[C@@H]1c1ccnn1C	ZINC000450520538	GI	On-Demand	Anodyne	HNMT	55	36
CCCc1ccc([C@H](C)N(CCc2cscn2)CC(N)=O)cc1	ZINC000450520544	EG	On-Demand	Anodyne	BMP1	41	32
CCCc1ccc([C@@H](C)N(CCc2cscn2)CC(N)=O)cc1	ZINC000450520546	EG	On-Demand	Anodyne	BMP1	41	32
O=C(NC(CO)CO)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450520552	CD	On-Demand	Anodyne	GPR88	0	45
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450520559	FG	On-Demand	Anodyne	CARM1	55	36
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450520560	FG	On-Demand	Anodyne	CARM1	55	36
O=C(O)CC[C@H]1CCCN(C(=O)CCCc2cc(F)ccc2F)C1	ZINC000450520570	EG	On-Demand	Anodyne	DPP4	20	40
O=C(O)CC[C@@H]1CCCN(C(=O)CCCc2cc(F)ccc2F)C1	ZINC000450520572	EG	On-Demand	Anodyne	DPP4	20	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	CHRM1	20	42
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	DRD4	15	43
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	HRH2	18	41
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	CHRM3	24	42
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	SIGMAR1	18	42
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	SSTR5	75	52
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	FAAH	18	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	EPHX2	41	46
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	MCHR1	37	41
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	HPGDS	34	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)nc1	ZINC000450520582	GF	On-Demand	Anodyne	SCARB1	53	38
Cc1cccc(Cl)c1C(=O)N1CC[C@@](C)(F)C1	ZINC000450520589	CG	On-Demand	Anodyne	CCR5	24	43
Cc1cccc(Cl)c1C(=O)N1CC[C@](C)(F)C1	ZINC000450520592	CG	On-Demand	Anodyne	CCR5	24	43
O=C(CC1(O)CCC1)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450520599	EH	On-Demand	Anodyne	KCNJ11	76	37
COCc1nn(C)cc1C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000450520601	FD	On-Demand	Anodyne	DRD2	33	40
O=C(CC1(O)CCC1)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450520602	EH	On-Demand	Anodyne	KCNJ11	76	37
O=C(O)[C@H]1CN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)Cc2ccccc21	ZINC000450520603	GH	On-Demand	Anodyne	RBP4	54	35
COCc1nn(C)cc1C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000450520604	FD	On-Demand	Anodyne	DRD2	33	40
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450520605	EF	On-Demand	Anodyne	CCR3	30	45
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450520605	EF	On-Demand	Anodyne	EPHX2	52	45
O=C(Nc1ccccc1)NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450520605	EF	On-Demand	Anodyne	CXCR3	21	44
O=C(Nc1ccccc1)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450520606	EF	On-Demand	Anodyne	CCR3	30	45
O=C(Nc1ccccc1)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450520606	EF	On-Demand	Anodyne	EPHX2	52	45
O=C(Nc1ccccc1)NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450520606	EF	On-Demand	Anodyne	CXCR3	21	44
COCC1(C(=O)O)CCN(C(=O)c2ccc(OC)cc2OCC(C)C)CC1	ZINC000450520607	GF	On-Demand	Anodyne	SCN5A	31	40
O=C(O)[C@@H]1CN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)Cc2ccccc21	ZINC000450520609	GH	On-Demand	Anodyne	RBP4	54	35
Cc1ccc2c(C3=CCN(C[C@H](C)S(C)(=O)=O)CC3)c[nH]c2c1	ZINC000450520610	EF	On-Demand	Anodyne	SLC6A4	0	49
Cc1ccc2c(C3=CCN(C[C@@H](C)S(C)(=O)=O)CC3)c[nH]c2c1	ZINC000450520611	EF	On-Demand	Anodyne	SLC6A4	0	49
COc1ccc2[nH]cc(C3=CCN(Cc4nnc(C(C)C)s4)CC3)c2c1	ZINC000450520612	FI	On-Demand	Anodyne	HTR1A	15	49
COc1ccc2[nH]cc(C3=CCN(Cc4nnc(C(C)C)s4)CC3)c2c1	ZINC000450520612	FI	On-Demand	Anodyne	HTR1D	17	48
COc1ccc2[nH]cc(C3=CCN(Cc4nnc(C(C)C)s4)CC3)c2c1	ZINC000450520612	FI	On-Demand	Anodyne	SLC6A4	22	57
CC(C)c1nnc(CN(c2ccccc2)C(C)C)s1	ZINC000450520615	CI	On-Demand	Anodyne	TAAR1	23	45
C[C@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C[C@H]1C	ZINC000450520616	DH	On-Demand	Anodyne	SLC12A5	53	34
C[C@@H]1CN(C(=O)C2(Cc3ccccc3)CCOCC2)CC[C@H]1C	ZINC000450520617	DH	On-Demand	Anodyne	SLC12A5	53	34
C[C@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C[C@@H]1C	ZINC000450520618	DH	On-Demand	Anodyne	SLC12A5	53	34
C[C@@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C[C@@H]1C	ZINC000450520619	DH	On-Demand	Anodyne	SLC12A5	53	34
CSCC[C@H](O)C(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000450520620	CE	On-Demand	Anodyne	BDKRB1	52	43
CSCC[C@H](O)C(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000450520621	CE	On-Demand	Anodyne	BDKRB1	52	43
CSCC[C@@H](O)C(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000450520622	CE	On-Demand	Anodyne	BDKRB1	52	43
CSCC[C@@H](O)C(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000450520623	CE	On-Demand	Anodyne	BDKRB1	52	43
Cc1ccccc1[C@@H](CC(=O)O)NC(=O)CCCc1cc(F)ccc1F	ZINC000450520624	FH	On-Demand	Anodyne	CTSA	100	48
Cc1ccccc1[C@H](CC(=O)O)NC(=O)CCCc1cc(F)ccc1F	ZINC000450520625	FH	On-Demand	Anodyne	CTSA	100	48
CC1(C(=O)Nc2cccc(C(=O)N3CCCC[C@@H]3C(=O)O)c2)CC1	ZINC000450520626	EF	On-Demand	Anodyne	PREP	32	50
COC(=O)c1cn(CCNc2nc(N(C)C)c3ccccc3n2)nn1	ZINC000450520635	EC	On-Demand	Anodyne	ADRA2A	16	45
COc1ccc2c(c1)CCCCN2C(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450520649	FH	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc2c(c1)CCCCN2C(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450520649	FH	On-Demand	Anodyne	MTNR1B	36	41
CCc1cccc(C(=O)N2CCCCc3cc(OC)ccc32)n1	ZINC000450520650	DH	On-Demand	Anodyne	DRD4	44	35
CCc1cccc(C(=O)N2CCCCc3cc(OC)ccc32)n1	ZINC000450520650	DH	On-Demand	Anodyne	AVPR2	41	46
COc1ccc2c(c1)CCCCN2C(=O)Cc1ccc(O)c(F)c1	ZINC000450520661	EG	On-Demand	Anodyne	EIF2AK3	65	41
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC[C@@H]3CCCCO3)cc2)c1	ZINC000450520666	GH	On-Demand	Anodyne	LDLR	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC[C@@H]3CCCCO3)cc2)c1	ZINC000450520666	GH	On-Demand	Anodyne	SSTR3	27	40
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC[C@@H]3CCCCO3)cc2)c1	ZINC000450520666	GH	On-Demand	Anodyne	E1	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC[C@H]3CCCCO3)cc2)c1	ZINC000450520667	GH	On-Demand	Anodyne	LDLR	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC[C@H]3CCCCO3)cc2)c1	ZINC000450520667	GH	On-Demand	Anodyne	SSTR3	27	40
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC[C@H]3CCCCO3)cc2)c1	ZINC000450520667	GH	On-Demand	Anodyne	E1	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCOCCO)cc2)c1	ZINC000450520675	FE	On-Demand	Anodyne	MMP13	18	51
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@H]1CCCCO1	ZINC000450520676	DH	On-Demand	Anodyne	LDLR	0	44
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@H]1CCCCO1	ZINC000450520676	DH	On-Demand	Anodyne	CCR2	62	46
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@@H]1CCCCO1	ZINC000450520677	DH	On-Demand	Anodyne	LDLR	0	44
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@@H]1CCCCO1	ZINC000450520677	DH	On-Demand	Anodyne	CCR2	82	46
CC1(C(=O)NC[C@H](Cc2cccc3ccccc23)C(=O)O)CC1	ZINC000450520684	DF	On-Demand	Anodyne	CPA1	35	54
CC1(C(=O)NC[C@H](Cc2cccc3ccccc23)C(=O)O)CC1	ZINC000450520684	DF	On-Demand	Anodyne	ECE1	37	45
CC1(C(=O)NC[C@H](Cc2cccc3ccccc23)C(=O)O)CC1	ZINC000450520684	DF	On-Demand	Anodyne	ACE2	44	42
CC1(C(=O)NC[C@@H](Cc2cccc3ccccc23)C(=O)O)CC1	ZINC000450520685	DF	On-Demand	Anodyne	CPA1	35	54
CC1(C(=O)NC[C@@H](Cc2cccc3ccccc23)C(=O)O)CC1	ZINC000450520685	DF	On-Demand	Anodyne	ECE1	37	45
CC1(C(=O)NC[C@@H](Cc2cccc3ccccc23)C(=O)O)CC1	ZINC000450520685	DF	On-Demand	Anodyne	ACE2	44	42
COCc1cccc(CC(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450520686	EF	On-Demand	Anodyne	PTGER3	42	36
COCc1cccc(CC(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)c1	ZINC000450520687	EF	On-Demand	Anodyne	PTGER3	42	36
NC(=O)N1CCC[C@@H](C(=O)Nc2cc(Cl)c(O)c(Cl)c2)C1	ZINC000450520692	EE	On-Demand	Anodyne	INHA	24	43
NC(=O)N1CCC[C@H](C(=O)Nc2cc(Cl)c(O)c(Cl)c2)C1	ZINC000450520693	EE	On-Demand	Anodyne	INHA	24	43
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520698	GH	On-Demand	Anodyne	COLA	44	44
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520698	GH	On-Demand	Anodyne	CPT1A	43	44
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520699	GH	On-Demand	Anodyne	COLA	44	44
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520699	GH	On-Demand	Anodyne	CPT1A	43	44
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520700	GH	On-Demand	Anodyne	COLA	44	44
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520700	GH	On-Demand	Anodyne	CPT1A	43	44
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520701	GH	On-Demand	Anodyne	COLA	44	44
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1	ZINC000450520701	GH	On-Demand	Anodyne	CPT1A	43	44
COC[C@H]1CN(c2ncnc3cc(Br)ccc23)CC(C)(C)O1	ZINC000450520722	FG	On-Demand	Anodyne	PDE3A	43	32
COC[C@H]1CN(c2ncnc3cc(Br)ccc23)CC(C)(C)O1	ZINC000450520722	FG	On-Demand	Anodyne	PDE3B	63	32
COC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC(C)(C)O1	ZINC000450520723	FG	On-Demand	Anodyne	PDE3A	43	32
COC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC(C)(C)O1	ZINC000450520723	FG	On-Demand	Anodyne	PDE3B	63	32
Cc1nc(NC[C@H](OCC2CC2)c2ccc(Cl)cc2)ncc1[N+](=O)[O-]	ZINC000450520730	FH	On-Demand	Bother	PRKCQ	34	46
Cc1nc(NC[C@@H](OCC2CC2)c2ccc(Cl)cc2)ncc1[N+](=O)[O-]	ZINC000450520731	FH	On-Demand	Bother	PRKCQ	34	46
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)cn1	ZINC000450520734	GG	On-Demand	Anodyne	SFRP1	63	35
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)cn1	ZINC000450520734	GG	On-Demand	Anodyne	WNT3	45	32
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)cn1	ZINC000450520735	GG	On-Demand	Anodyne	SFRP1	63	35
CC(F)(F)c1ccc(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)cn1	ZINC000450520735	GG	On-Demand	Anodyne	WNT3	45	32
O=C(C1CCN(CC/C=C\c2ccccc2)CC1)N1CCc2ccccc21	ZINC000450520736	FI	On-Demand	Anodyne	SLC6A1	43	35
O=C(C1CCN(CC/C=C\c2ccccc2)CC1)N1CCc2ccccc21	ZINC000450520736	FI	On-Demand	Anodyne	SIGMAR1	15	56
O=C(C1CCN(CC/C=C/c2ccccc2)CC1)N1CCc2ccccc21	ZINC000450520737	FI	On-Demand	Anodyne	SLC6A1	43	35
O=C(C1CCN(CC/C=C/c2ccccc2)CC1)N1CCc2ccccc21	ZINC000450520737	FI	On-Demand	Anodyne	SIGMAR1	15	56
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450520741	FG	On-Demand	Anodyne	EPHX2	19	41
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450520742	FG	On-Demand	Anodyne	EPHX2	19	41
CN1C(=O)C[C@@H](Nc2ccnc3cc(F)c(Cl)cc23)[C@@H]1c1ccnn1C	ZINC000450520755	FG	On-Demand	Anodyne	HRP1_PLAFA	69	33
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(OC)c1	ZINC000450520757	GF	On-Demand	Anodyne	DRD2	26	43
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(OC)c1	ZINC000450520757	GF	On-Demand	Anodyne	DRD4	26	42
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(OC)c1	ZINC000450520757	GF	On-Demand	Anodyne	DRD3	29	43
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(OC)c1	ZINC000450520757	GF	On-Demand	Anodyne	OPRK1	16	44
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(OC)c1	ZINC000450520757	GF	On-Demand	Anodyne	HCN1	60	32
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(OC)c1	ZINC000450520757	GF	On-Demand	Anodyne	HCN4	49	32
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(OC)c1	ZINC000450520758	GF	On-Demand	Anodyne	DRD2	26	43
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(OC)c1	ZINC000450520758	GF	On-Demand	Anodyne	DRD4	26	42
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(OC)c1	ZINC000450520758	GF	On-Demand	Anodyne	DRD3	29	43
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(OC)c1	ZINC000450520758	GF	On-Demand	Anodyne	OPRK1	16	44
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(OC)c1	ZINC000450520758	GF	On-Demand	Anodyne	HCN1	60	32
CCCOc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(OC)c1	ZINC000450520758	GF	On-Demand	Anodyne	HCN4	49	32
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	HTR1A	25	76
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	CHRM1	20	44
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	DRD2	48	64
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	DRD1	24	50
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	DRD4	45	57
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	ADRA1D	18	44
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	HTR2A	47	60
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	HTR2C	31	63
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	ADRA1A	17	50
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	HRH1	19	50
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	ADRA1B	23	45
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	DRD3	26	57
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	KCNH2	17	44
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	HTR4	15	42
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	ERG2	21	45
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	HTR1F	29	40
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	HTR7	40	48
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	TACR2	21	44
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	SIGMAR1	41	54
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	NPY2R	0	44
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	CCR3	124	55
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	CHRNA7	28	43
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	SLC18A3	17	48
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	HTR3B	0	50
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	EPHX2	68	54
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	CXCR3	21	41
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	MCHR1	46	52
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	CACNA1G	33	40
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	CYP2J2	66	47
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	NET	0	45
O=C(Nc1ccccc1)NC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450520761	GI	On-Demand	Anodyne	AP2S1	0	45
CCCC[C@@H](NC(=O)C1(C2CC2)CCOCC1)C(=O)O	ZINC000450520762	CD	On-Demand	Anodyne	NOD1	79	38
CCCC[C@H](NC(=O)C1(C2CC2)CCOCC1)C(=O)O	ZINC000450520763	CD	On-Demand	Anodyne	NOD1	79	38
CC(F)(F)C(C)(C)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450520773	EF	On-Demand	Anodyne	MCHR1	15	41
CC(F)(F)C(C)(C)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450520774	EF	On-Demand	Anodyne	MCHR1	15	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	ACE	42	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	MME	33	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	ANPEP	41	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	CTSB	19	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	CTSK	47	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	CTSL	39	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	CAPNS1	46	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	CTSS	22	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	CAPN1	58	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	CAPN2	66	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	FPR1	70	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	NPR	42	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	XIAP	44	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	BIRC2	47	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450520781	FE	On-Demand	Anodyne	BIRC8	47	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	ACE	42	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	MME	33	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	ANPEP	41	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	CTSB	19	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	CTSK	47	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	CTSL	39	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	CAPNS1	46	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	CTSS	22	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	CAPN1	58	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	CAPN2	66	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	FPR1	70	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	NPR	42	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	XIAP	44	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	BIRC2	47	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450520782	FE	On-Demand	Anodyne	BIRC8	47	33
Cn1cc(-c2ccc(C(=O)NCc3ccccc3CN3CC[C@@H](O)C3)o2)cn1	ZINC000450520790	GE	On-Demand	Anodyne	MMP13	0	42
Cn1cc(-c2ccc(C(=O)NCc3ccccc3CN3CC[C@@H](O)C3)o2)cn1	ZINC000450520790	GE	On-Demand	Anodyne	MCHR1	21	44
Cn1cc(-c2ccc(C(=O)NCc3ccccc3CN3CC[C@H](O)C3)o2)cn1	ZINC000450520791	GE	On-Demand	Anodyne	MMP13	0	42
Cn1cc(-c2ccc(C(=O)NCc3ccccc3CN3CC[C@H](O)C3)o2)cn1	ZINC000450520791	GE	On-Demand	Anodyne	MCHR1	21	44
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2ccc3c(n2)CCCC3=O)C1	ZINC000450520796	GH	On-Demand	Anodyne	PREP	48	39
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2ccc3c(n2)CCCC3=O)C1	ZINC000450520797	GH	On-Demand	Anodyne	PREP	48	39
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520818	GG	On-Demand	Anodyne	DRD4	22	40
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520818	GG	On-Demand	Anodyne	HRH2	43	37
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520818	GG	On-Demand	Anodyne	SIGMAR1	21	43
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520818	GG	On-Demand	Anodyne	MCHR1	26	41
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520818	GG	On-Demand	Anodyne	CCR8	16	40
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520819	GG	On-Demand	Anodyne	DRD4	22	40
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520819	GG	On-Demand	Anodyne	HRH2	43	37
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520819	GG	On-Demand	Anodyne	SIGMAR1	21	43
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520819	GG	On-Demand	Anodyne	MCHR1	26	41
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450520819	GG	On-Demand	Anodyne	CCR8	16	40
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520820	GG	On-Demand	Anodyne	DRD4	22	40
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520820	GG	On-Demand	Anodyne	HRH2	43	37
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520820	GG	On-Demand	Anodyne	SIGMAR1	21	43
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520820	GG	On-Demand	Anodyne	MCHR1	26	41
C/C=C\COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520820	GG	On-Demand	Anodyne	CCR8	16	40
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520821	GG	On-Demand	Anodyne	DRD4	22	40
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520821	GG	On-Demand	Anodyne	HRH2	43	37
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520821	GG	On-Demand	Anodyne	SIGMAR1	21	43
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520821	GG	On-Demand	Anodyne	MCHR1	26	41
C/C=C/COc1cccc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450520821	GG	On-Demand	Anodyne	CCR8	16	40
COC(=O)c1csc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)n1	ZINC000450520831	FE	On-Demand	Anodyne	SLC6A1	70	36
COC(=O)c1csc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)n1	ZINC000450520832	FE	On-Demand	Anodyne	SLC6A1	70	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	SLC6A1	0	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	SLC6A4	18	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	OPRK1	21	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	SLC6A3	32	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	SIGMAR1	25	54
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	CCR3	61	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	CCR5	44	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	PLD1	52	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	SLC6A11	0	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	SLC6A12	0	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	EPHX2	18	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520833	GG	On-Demand	Anodyne	CACNA1G	64	49
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	SLC6A1	0	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	SLC6A4	18	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	OPRK1	21	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	SLC6A3	32	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	SIGMAR1	25	54
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	CCR3	61	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	CCR5	44	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	PLD1	52	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	SLC6A11	0	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	SLC6A12	0	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	EPHX2	18	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520834	GG	On-Demand	Anodyne	CACNA1G	64	49
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	SLC6A4	18	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	OPRK1	21	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	SLC6A3	32	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	SIGMAR1	25	54
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	CCR3	61	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	CCR5	44	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	PLD1	52	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	SLC6A11	0	46
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	SLC6A12	0	46
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	EPHX2	18	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520835	GG	On-Demand	Anodyne	CACNA1G	64	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	SLC6A4	18	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	OPRK1	21	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	SLC6A3	32	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	SIGMAR1	25	54
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	CCR3	61	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	CCR5	44	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	PLD1	52	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	SLC6A11	0	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	SLC6A12	0	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	EPHX2	18	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450520836	GG	On-Demand	Anodyne	CACNA1G	64	49
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCN1CCNC(=O)C1	ZINC000450520856	FC	On-Demand	Anodyne	PLD2	56	36
CCC[C@@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450520865	CD	On-Demand	Bother	CCR3	26	42
CCC[C@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(=O)O	ZINC000450520866	CD	On-Demand	Bother	CCR3	26	42
O=C(Nc1ccc(Cl)cn1)C1CCN(CC2=CCCCC2)CC1	ZINC000450520869	EH	On-Demand	Anodyne	F10	31	46
O=C(Nc1ccc(Cl)cn1)C1CCN(CC2=CCCCC2)CC1	ZINC000450520869	EH	On-Demand	Anodyne	CXCR3	29	51
Cc1ccc2c(C3=CCN(CC[C@H](C)O)CC3)c[nH]c2c1	ZINC000450520876	CG	On-Demand	Anodyne	HTR1A	19	48
Cc1ccc2c(C3=CCN(CC[C@H](C)O)CC3)c[nH]c2c1	ZINC000450520876	CG	On-Demand	Anodyne	SLC6A4	23	54
Cc1ccc2c(C3=CCN(CC[C@@H](C)O)CC3)c[nH]c2c1	ZINC000450520877	CG	On-Demand	Anodyne	HTR1A	19	48
Cc1ccc2c(C3=CCN(CC[C@@H](C)O)CC3)c[nH]c2c1	ZINC000450520877	CG	On-Demand	Anodyne	SLC6A4	23	54
O=C1CN(CCNC(=O)c2ccsc2Br)CCN1	ZINC000450520878	EC	On-Demand	Anodyne	PLD2	51	34
Cc1cccc(NC(=O)[C@H]2CCCN(CCc3cscn3)C2)n1	ZINC000450520879	EF	On-Demand	Anodyne	SLC6A1	99	36
Cc1cccc(NC(=O)[C@H]2CCCN(CCc3cscn3)C2)n1	ZINC000450520879	EF	On-Demand	Anodyne	PDE8A	0	43
Cc1cccc(NC(=O)[C@@H]2CCCN(CCc3cscn3)C2)n1	ZINC000450520880	EF	On-Demand	Anodyne	SLC6A1	99	36
Cc1cccc(NC(=O)[C@@H]2CCCN(CCc3cscn3)C2)n1	ZINC000450520880	EF	On-Demand	Anodyne	PDE8A	0	43
Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccn(CC(F)(F)F)n3)C2)n1	ZINC000450520889	GF	On-Demand	Anodyne	SLC6A1	61	33
Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccn(CC(F)(F)F)n3)C2)n1	ZINC000450520889	GF	On-Demand	Anodyne	PDE8A	0	43
Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccn(CC(F)(F)F)n3)C2)n1	ZINC000450520890	GF	On-Demand	Anodyne	SLC6A1	61	33
Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccn(CC(F)(F)F)n3)C2)n1	ZINC000450520890	GF	On-Demand	Anodyne	PDE8A	0	43
CO[C@@H]1C[C@H](C(=O)O)N(C(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000450520903	DD	On-Demand	Anodyne	OPRK1	35	41
CO[C@H]1C[C@@H](C(=O)O)N(C(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000450520904	DD	On-Demand	Anodyne	OPRK1	35	41
CO[C@H]1C[C@H](C(=O)O)N(C(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000450520905	DD	On-Demand	Anodyne	OPRK1	35	41
CO[C@@H]1C[C@@H](C(=O)O)N(C(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000450520906	DD	On-Demand	Anodyne	OPRK1	35	41
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)n1	ZINC000450520939	GG	On-Demand	Anodyne	ALOX5AP	46	33
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)n1	ZINC000450520939	GG	On-Demand	Anodyne	COLA	86	47
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)n1	ZINC000450520939	GG	On-Demand	Anodyne	CPT1A	84	47
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)n1	ZINC000450520940	GG	On-Demand	Anodyne	ALOX5AP	46	33
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)n1	ZINC000450520940	GG	On-Demand	Anodyne	COLA	86	47
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)n1	ZINC000450520940	GG	On-Demand	Anodyne	CPT1A	84	47
COc1cccc(Oc2ccc(C(=O)NCC[C@@H]3CCCCO3)nc2)c1	ZINC000450520942	FH	On-Demand	Anodyne	DRD4	47	36
COc1cccc(Oc2ccc(C(=O)NCC[C@@H]3CCCCO3)nc2)c1	ZINC000450520942	FH	On-Demand	Anodyne	NQO2	33	40
COc1cccc(Oc2ccc(C(=O)NCC[C@H]3CCCCO3)nc2)c1	ZINC000450520943	FH	On-Demand	Anodyne	DRD4	47	36
COc1cccc(Oc2ccc(C(=O)NCC[C@H]3CCCCO3)nc2)c1	ZINC000450520943	FH	On-Demand	Anodyne	NQO2	33	40
COc1ccc2c(c1)CCCCN2C(=O)c1cc2cccnc2s1	ZINC000450520946	EI	On-Demand	Anodyne	AVPR2	28	41
COc1ccc2c(c1)CCCCN2C(=O)c1cc2cccnc2s1	ZINC000450520946	EI	On-Demand	Anodyne	CYP11B2	30	46
CC(F)(F)c1ccc(C(=O)Nc2cccnc2OCC(F)F)cn1	ZINC000450520947	EG	On-Demand	Anodyne	P2RY1	48	36
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520953	GD	On-Demand	Anodyne	ACE	24	44
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520953	GD	On-Demand	Anodyne	MME	69	50
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520953	GD	On-Demand	Anodyne	CPA1	32	51
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520953	GD	On-Demand	Anodyne	MMP8	21	41
CN(C)S(=O)(=O)CC(=O)NC[C@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520953	GD	On-Demand	Anodyne	ACE2	49	45
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520954	GD	On-Demand	Anodyne	ACE	24	44
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520954	GD	On-Demand	Anodyne	MME	69	50
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520954	GD	On-Demand	Anodyne	CPA1	32	51
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520954	GD	On-Demand	Anodyne	MMP8	21	41
CN(C)S(=O)(=O)CC(=O)NC[C@@H](Cc1cccc2ccccc12)C(=O)O	ZINC000450520954	GD	On-Demand	Anodyne	ACE2	49	45
CCC[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520955	DG	On-Demand	Anodyne	MME	46	39
CCC[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520955	DG	On-Demand	Anodyne	ANPEP	72	35
CCC[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520955	DG	On-Demand	Anodyne	CPA1	56	41
CCC[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520955	DG	On-Demand	Anodyne	LAP3	42	33
CCC[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520956	DG	On-Demand	Anodyne	MME	46	39
CCC[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520956	DG	On-Demand	Anodyne	ANPEP	72	35
CCC[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520956	DG	On-Demand	Anodyne	CPA1	56	41
CCC[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520956	DG	On-Demand	Anodyne	LAP3	42	33
CCC[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520957	DG	On-Demand	Anodyne	MME	46	39
CCC[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520957	DG	On-Demand	Anodyne	ANPEP	72	35
CCC[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520957	DG	On-Demand	Anodyne	CPA1	56	41
CCC[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520957	DG	On-Demand	Anodyne	LAP3	42	33
CCC[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520958	DG	On-Demand	Anodyne	MME	46	39
CCC[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520958	DG	On-Demand	Anodyne	ANPEP	72	35
CCC[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520958	DG	On-Demand	Anodyne	CPA1	56	41
CCC[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)C(C)C	ZINC000450520958	DG	On-Demand	Anodyne	LAP3	42	33
COc1cccc(OCCC(=O)Nc2cccnc2OCC(F)F)c1	ZINC000450520967	FG	On-Demand	Anodyne	P2RY1	38	41
COc1cccc(OCCC(=O)Nc2cccnc2OCC(F)F)c1	ZINC000450520967	FG	On-Demand	Anodyne	MTNR1A	23	42
COc1cccc(OCCC(=O)Nc2cccnc2OCC(F)F)c1	ZINC000450520967	FG	On-Demand	Anodyne	MTNR1B	26	44
COc1ccc(C(=O)NC[C@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520973	GH	On-Demand	Anodyne	ADRB3	41	47
COc1ccc(C(=O)NC[C@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520973	GH	On-Demand	Anodyne	PDE4A	37	44
COc1ccc(C(=O)NC[C@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520973	GH	On-Demand	Anodyne	KCNA3	45	43
COc1ccc(C(=O)NC[C@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520973	GH	On-Demand	Anodyne	PDE4B	16	42
COc1ccc(C(=O)NC[C@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520973	GH	On-Demand	Anodyne	PDE4D	15	42
COc1ccc(C(=O)NC[C@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520973	GH	On-Demand	Anodyne	PDE4C	15	42
COc1ccc(C(=O)NC[C@@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520974	GH	On-Demand	Anodyne	ADRB3	41	47
COc1ccc(C(=O)NC[C@@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520974	GH	On-Demand	Anodyne	PDE4A	37	44
COc1ccc(C(=O)NC[C@@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520974	GH	On-Demand	Anodyne	KCNA3	45	43
COc1ccc(C(=O)NC[C@@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520974	GH	On-Demand	Anodyne	PDE4B	16	42
COc1ccc(C(=O)NC[C@@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520974	GH	On-Demand	Anodyne	PDE4D	15	42
COc1ccc(C(=O)NC[C@@H](C(=O)O)c2ccccc2)c(OC2CCCC2)c1	ZINC000450520974	GH	On-Demand	Anodyne	PDE4C	15	42
CCCOc1cc(OC)ccc1C(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1	ZINC000450520979	FG	On-Demand	Anodyne	MTNR1B	20	44
CCCOc1cc(OC)ccc1C(=O)NC[C@@H](C(=O)O)c1ccc(C)cc1	ZINC000450520979	FG	On-Demand	Anodyne	LUCI_LUCLA	17	46
CCCOc1cc(OC)ccc1C(=O)NC[C@H](C(=O)O)c1ccc(C)cc1	ZINC000450520980	FG	On-Demand	Anodyne	MTNR1B	20	44
CCCOc1cc(OC)ccc1C(=O)NC[C@H](C(=O)O)c1ccc(C)cc1	ZINC000450520980	FG	On-Demand	Anodyne	LUCI_LUCLA	17	46
CCCOc1cc(OC)ccc1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520981	GG	On-Demand	Anodyne	PPARG	20	50
CCCOc1cc(OC)ccc1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520981	GG	On-Demand	Anodyne	PPARA	29	46
CCCOc1cc(OC)ccc1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520981	GG	On-Demand	Anodyne	CPA1	17	44
CCCOc1cc(OC)ccc1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520981	GG	On-Demand	Anodyne	PPARD	29	45
CCCOc1cc(OC)ccc1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520982	GG	On-Demand	Anodyne	PPARG	20	50
CCCOc1cc(OC)ccc1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520982	GG	On-Demand	Anodyne	PPARA	29	46
CCCOc1cc(OC)ccc1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520982	GG	On-Demand	Anodyne	CPA1	17	44
CCCOc1cc(OC)ccc1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450520982	GG	On-Demand	Anodyne	PPARD	29	45
COc1ccc2c(c1)CCCCN2C(=O)c1cc(C#N)[nH]c1C	ZINC000450520983	DG	On-Demand	Mild	AVPR2	27	40
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(N2CCC2)nc1	ZINC000450520995	EG	On-Demand	Anodyne	AVPR2	35	48
COc1ccc2c(c1)CCCCN2C(=O)c1ccc(N2CCC2)nc1	ZINC000450520995	EG	On-Demand	Anodyne	GALR2	41	33
C[C@H](CCC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521001	FH	On-Demand	Anodyne	MME	46	42
C[C@H](CCC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521001	FH	On-Demand	Anodyne	ANPEP	52	35
C[C@H](CCC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521001	FH	On-Demand	Anodyne	CPA1	54	38
C[C@@H](CCC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521002	FH	On-Demand	Anodyne	MME	46	42
C[C@@H](CCC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521002	FH	On-Demand	Anodyne	ANPEP	52	35
C[C@@H](CCC(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521002	FH	On-Demand	Anodyne	CPA1	54	38
C[C@H](CCC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521003	FH	On-Demand	Anodyne	MME	46	42
C[C@H](CCC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521003	FH	On-Demand	Anodyne	ANPEP	52	35
C[C@H](CCC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521003	FH	On-Demand	Anodyne	CPA1	54	38
C[C@@H](CCC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521004	FH	On-Demand	Anodyne	MME	46	42
C[C@@H](CCC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521004	FH	On-Demand	Anodyne	ANPEP	52	35
C[C@@H](CCC(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1ccccc1	ZINC000450521004	FH	On-Demand	Anodyne	CPA1	54	38
O=C(NCCCOCCO)c1cc2ccncc2s1	ZINC000450521005	CD	On-Demand	Anodyne	SELE	50	36
O=C(NCCCOCCO)c1cc2ccncc2s1	ZINC000450521005	CD	On-Demand	Anodyne	ICAM1	45	36
O=C(NCCCOCCO)c1cc2ccncc2s1	ZINC000450521005	CD	On-Demand	Anodyne	VCAM1	48	36
O=C(Cc1ccc(Cl)c(F)c1)N1CCC(O)(C(=O)O)CC1	ZINC000450521020	DD	On-Demand	Anodyne	ENV	41	32
CSc1cccc(C(=O)NCC[C@H]2CCCCO2)c1	ZINC000450521021	CG	On-Demand	Anodyne	DRD4	40	30
CSc1cccc(C(=O)NCC[C@H]2CCCCO2)c1	ZINC000450521021	CG	On-Demand	Anodyne	LDLR	0	40
CSc1cccc(C(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450521022	CG	On-Demand	Anodyne	DRD4	40	30
CSc1cccc(C(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450521022	CG	On-Demand	Anodyne	LDLR	0	40
Cc1ccc([C@H](CNC(=O)c2cc(C)c(F)c(C)c2)C(=O)O)cc1	ZINC000450521024	EG	On-Demand	Anodyne	ITGAV	50	38
Cc1ccc([C@@H](CNC(=O)c2cc(C)c(F)c(C)c2)C(=O)O)cc1	ZINC000450521025	EG	On-Demand	Anodyne	ITGAV	50	38
C[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)CC(=O)O	ZINC000450521027	CE	On-Demand	Anodyne	NCE103	27	40
C[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)CC(=O)O	ZINC000450521028	CE	On-Demand	Anodyne	NCE103	27	40
COCC1(C(=O)O)CCN(C(=O)Cc2cccc(OCC(F)(F)F)c2)CC1	ZINC000450521029	GF	On-Demand	Anodyne	BRS3	31	45
COCC1(C(=O)O)CCN(C(=O)Cc2cccc(OCC(F)(F)F)c2)CC1	ZINC000450521029	GF	On-Demand	Anodyne	GPR183	0	42
COc1ccc(CN(Cc2ccccc2)CC2CCC(=O)CC2)cc1	ZINC000450521038	EI	On-Demand	Anodyne	ACHE	15	40
COc1ccc(CN(Cc2ccccc2)CC2CCC(=O)CC2)cc1	ZINC000450521038	EI	On-Demand	Anodyne	SIGMAR1	18	44
COc1ccc(CN(Cc2ccccc2)CC2CCC(=O)CC2)cc1	ZINC000450521038	EI	On-Demand	Anodyne	G6PC	24	40
COCC1(C(=O)O)CCN(C(=O)c2ccc(Br)c(C)c2)CC1	ZINC000450521050	FF	On-Demand	Anodyne	CCR5	42	37
CCOC(=O)c1cnn(C2CCN(c3nccc(C#N)n3)CC2)c1C	ZINC000450521053	ED	On-Demand	Mild	P2RY12	36	41
COCC1(C(=O)O)CCN(C(=O)C(C)(C)COCc2ccccc2)CC1	ZINC000450521073	FF	On-Demand	Anodyne	GHRHR	57	35
COCC1(C(=O)O)CCN(C(=O)C(C)(C)COCc2ccccc2)CC1	ZINC000450521073	FF	On-Demand	Anodyne	SLC12A5	61	37
O=C(O)CC[C@H]1CCCN(C(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000450521081	EG	On-Demand	Anodyne	OPRK1	33	42
O=C(O)CC[C@@H]1CCCN(C(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000450521082	EG	On-Demand	Anodyne	OPRK1	33	42
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	CHRM2	18	50
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	CHRM1	22	47
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	DRD4	22	56
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	P2RY12	37	46
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	PPIA	23	44
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	CHRM3	32	50
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	SIGMAR1	21	49
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	SSTR5	67	48
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	CCR3	37	44
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	CCKBR	43	35
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	EPHX2	52	45
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	CXCR3	27	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	MCHR1	44	42
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	NOD2	25	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	ADIPOR1	0	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)nc1	ZINC000450521083	GG	On-Demand	Anodyne	ADIPOR2	0	40
O=C(NC(CO)CO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450521091	ED	On-Demand	Anodyne	PYGL	54	39
O=C(NC(CO)CO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450521091	ED	On-Demand	Anodyne	PYK	31	40
CN(Cc1ccc(OCC(=O)O)cc1)C(=O)CCCc1cc(F)ccc1F	ZINC000450521099	GG	On-Demand	Anodyne	FFAR1	38	41
CN(Cc1ccc(OCC(=O)O)cc1)C(=O)CCCc1cc(F)ccc1F	ZINC000450521099	GG	On-Demand	Anodyne	FFAR4	57	42
C[C@H](CN1CCC(NC(=O)NC2CCCCC2)CC1)S(C)(=O)=O	ZINC000450521100	ED	On-Demand	Anodyne	EPHX2	26	53
C[C@@H](CN1CCC(NC(=O)NC2CCCCC2)CC1)S(C)(=O)=O	ZINC000450521101	ED	On-Demand	Anodyne	EPHX2	26	53
O=C(O)CCc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450521115	GI	On-Demand	Anodyne	SLC1A2	32	42
O=C(O)CCc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450521115	GI	On-Demand	Anodyne	FFAR1	44	52
O=C(O)CCc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450521115	GI	On-Demand	Anodyne	RHOA	0	40
CCCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450521117	DG	On-Demand	Anodyne	TYMS	53	33
CCCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450521117	DG	On-Demand	Anodyne	C3AR1	44	33
CCCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450521117	DG	On-Demand	Anodyne	GART	47	31
CCCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450521117	DG	On-Demand	Anodyne	NOD1	85	40
CCCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450521118	DG	On-Demand	Anodyne	TYMS	53	33
CCCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450521118	DG	On-Demand	Anodyne	C3AR1	44	33
CCCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450521118	DG	On-Demand	Anodyne	GART	47	31
CCCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450521118	DG	On-Demand	Anodyne	NOD1	85	40
CC[S@](=O)CC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450521128	EG	On-Demand	Anodyne	KCNJ11	60	37
CC[S@@](=O)CC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450521129	EG	On-Demand	Anodyne	KCNJ11	60	37
CC[S@@](=O)CC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450521130	EG	On-Demand	Anodyne	KCNJ11	60	37
CC[S@](=O)CC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450521131	EG	On-Demand	Anodyne	KCNJ11	60	37
CN(Cc1ccccc1)C(=O)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450521132	EF	On-Demand	Mild	TACR3	45	37
COc1cccc2c(N3C[C@@H](C)[C@H](C(=O)N4CCOCC4)C3)nccc12	ZINC000450521154	FE	On-Demand	Anodyne	PDE3B	43	32
CCOC(=O)c1cc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)[nH]c1C	ZINC000450521155	FF	On-Demand	Anodyne	FPR2	30	44
CCOC(=O)c1cc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)[nH]c1C	ZINC000450521155	FF	On-Demand	Anodyne	AKR1C3	0	41
CCOC(=O)c1cc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)[nH]c1C	ZINC000450521156	FF	On-Demand	Anodyne	FPR2	30	44
CCOC(=O)c1cc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)[nH]c1C	ZINC000450521156	FF	On-Demand	Anodyne	AKR1C3	0	41
O=C(Nc1cc(Cl)ccc1O)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450521167	FI	On-Demand	Anodyne	TACR3	54	33
O=C(Nc1cc(Cl)ccc1O)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450521168	FI	On-Demand	Anodyne	TACR3	54	33
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	HTR1A	19	46
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	DRD1	15	43
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	DRD4	26	43
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	ADRA1D	15	43
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	HTR2A	30	43
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	HTR2C	35	53
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	SLC6A1	59	33
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	ADRA1A	15	40
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	HRH1	22	42
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	DRD3	20	43
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	HTR7	23	40
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	SLC18A3	0	40
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	MCHR1	21	43
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	CYP2J2	65	52
Cc1ccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450521170	FH	On-Demand	Anodyne	MAP3K12	15	40
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)n1	ZINC000450521172	EF	On-Demand	Anodyne	SLC6A1	71	34
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)n1	ZINC000450521172	EF	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)n1	ZINC000450521173	EF	On-Demand	Anodyne	SLC6A1	71	34
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)n1	ZINC000450521173	EF	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)n1	ZINC000450521174	EF	On-Demand	Anodyne	SLC6A1	71	34
Cc1cccc(NC(=O)[C@H]2CCCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)n1	ZINC000450521174	EF	On-Demand	Anodyne	PDE8A	0	41
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)n1	ZINC000450521175	EF	On-Demand	Anodyne	SLC6A1	71	34
Cc1cccc(NC(=O)[C@@H]2CCCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)n1	ZINC000450521175	EF	On-Demand	Anodyne	PDE8A	0	41
O=C1CN(CCNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)CCN1	ZINC000450521176	FB	On-Demand	Bother	PLD2	58	36
Cc1ccc(NC(=O)C2CCN(CC[C@@H](C)O)CC2)nc1	ZINC000450521179	CD	On-Demand	Anodyne	CCR5	29	41
Cc1ccc(NC(=O)C2CCN(CC[C@H](C)O)CC2)nc1	ZINC000450521180	CD	On-Demand	Anodyne	CCR5	29	41
CCC[C@H](NC(=O)c1ccoc1C(C)C)C(=O)O	ZINC000450521181	CE	On-Demand	Anodyne	ACE2	40	33
CCC[C@@H](NC(=O)c1ccoc1C(C)C)C(=O)O	ZINC000450521182	CE	On-Demand	Anodyne	ACE2	40	33
O=C(CC1CC(F)(F)C1)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450521183	FJ	On-Demand	Anodyne	KCNJ11	70	39
O=C(CC1CC(F)(F)C1)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450521184	FJ	On-Demand	Anodyne	KCNJ11	70	39
O=C(Nc1ccc(Cl)cn1)C1CCN(CCc2cscn2)CC1	ZINC000450521189	FG	On-Demand	Anodyne	F10	32	48
CN1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C(C)(C)C1	ZINC000450521191	FE	On-Demand	Mild	AR	34	40
CN1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C(C)(C)C1	ZINC000450521192	FE	On-Demand	Mild	AR	34	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	DRD2	20	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	DRD4	50	38
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	ACHE	28	47
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	DRD3	22	43
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	F10	41	32
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	CHRM3	25	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	SIGMAR1	33	46
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	SSTR5	45	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	FAAH	29	41
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	NPY5R	16	42
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	TYK2	54	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	CXCR3	39	42
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	MCHR1	54	41
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1	ZINC000450521201	FH	On-Demand	Anodyne	CACNA1G	32	40
Cn1cc(-c2ccc(C(=O)N3CC[C@H](n4ncc5ccccc54)C3)o2)cn1	ZINC000450521206	FG	On-Demand	Anodyne	MAP3K7	46	33
Cn1cc(-c2ccc(C(=O)N3CC[C@@H](n4ncc5ccccc54)C3)o2)cn1	ZINC000450521207	FG	On-Demand	Anodyne	MAP3K7	46	33
Nc1ncccc1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450521209	EF	On-Demand	Anodyne	SLC6A1	72	35
Nc1ncccc1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000450521210	EF	On-Demand	Anodyne	SLC6A1	72	35
CN1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C(C)(C)C1	ZINC000450521211	FG	On-Demand	Anodyne	HRH4	27	53
CN(C)S(=O)(=O)CC(=O)N[C@@H]1CCCCCC[C@H]1C(=O)O	ZINC000450521212	DC	On-Demand	Anodyne	ACE	0	41
CN(C)S(=O)(=O)CC(=O)N[C@H]1CCCCCC[C@H]1C(=O)O	ZINC000450521213	DC	On-Demand	Anodyne	ACE	0	41
CN(C)S(=O)(=O)CC(=O)N[C@H]1CCCCCC[C@@H]1C(=O)O	ZINC000450521214	DC	On-Demand	Anodyne	ACE	0	41
CN(C)S(=O)(=O)CC(=O)N[C@@H]1CCCCCC[C@@H]1C(=O)O	ZINC000450521215	DC	On-Demand	Anodyne	ACE	0	41
O=C(NCc1ccc(F)cc1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450521218	EI	On-Demand	Anodyne	HTR2A	17	49
O=C(NCc1ccc(F)cc1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450521218	EI	On-Demand	Anodyne	SIGMAR1	15	47
O=C(NCc1ccc(F)cc1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450521218	EI	On-Demand	Anodyne	CCR3	54	43
O=C(NCc1ccc(F)cc1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450521218	EI	On-Demand	Anodyne	CACNA1G	49	52
COc1ccc2c(c1)CCCCN2C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450521260	FH	On-Demand	Anodyne	EIF2AK3	55	38
CC(F)(F)c1ccc(C(=O)NCCCOCCO)cn1	ZINC000450521263	CD	On-Demand	Anodyne	EPHX2	18	40
COCC1(C(=O)O)CCN(C(=O)C2(Cc3cccc(F)c3)CCC2)CC1	ZINC000450521269	FF	On-Demand	Anodyne	SLC12A5	55	35
COc1cc(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc([N+](=O)[O-])c1C	ZINC000450521273	GF	On-Demand	Bother	PPARA	18	40
COc1cc(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc([N+](=O)[O-])c1C	ZINC000450521273	GF	On-Demand	Bother	CPA1	21	43
COc1cc(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc([N+](=O)[O-])c1C	ZINC000450521273	GF	On-Demand	Bother	PPARD	23	40
COc1cc(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc([N+](=O)[O-])c1C	ZINC000450521274	GF	On-Demand	Bother	PPARA	18	40
COc1cc(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc([N+](=O)[O-])c1C	ZINC000450521274	GF	On-Demand	Bother	CPA1	21	43
COc1cc(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc([N+](=O)[O-])c1C	ZINC000450521274	GF	On-Demand	Bother	PPARD	23	40
C[C@H](OCCc1ccccc1)C(=O)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450521279	GD	On-Demand	Anodyne	ACE	55	38
C[C@@H](OCCc1ccccc1)C(=O)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450521280	GD	On-Demand	Anodyne	ACE	55	38
COc1cccc(-n2cc(C(=O)NCC[C@@H]3CCCCO3)nn2)c1	ZINC000450521282	ED	On-Demand	Anodyne	DRD4	50	39
COc1cccc(-n2cc(C(=O)NCC[C@H]3CCCCO3)nn2)c1	ZINC000450521289	ED	On-Demand	Anodyne	DRD4	50	39
CC(C)(C(=O)O)c1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1	ZINC000450521293	FI	On-Demand	Anodyne	HDAC3	15	43
CC[C@H](CC(F)(F)F)C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450521302	EH	On-Demand	Anodyne	P2RX7	24	52
CC[C@H](CC(F)(F)F)C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450521302	EH	On-Demand	Anodyne	CARM1	58	36
CC[C@@H](CC(F)(F)F)C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450521303	EH	On-Demand	Anodyne	P2RX7	24	52
CC[C@@H](CC(F)(F)F)C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450521303	EH	On-Demand	Anodyne	CARM1	58	36
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521304	GH	On-Demand	Anodyne	HTR4	23	42
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521304	GH	On-Demand	Anodyne	MME	57	45
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521304	GH	On-Demand	Anodyne	PTGER3	58	39
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521304	GH	On-Demand	Anodyne	CCKAR	43	34
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521304	GH	On-Demand	Anodyne	NAALAD2	28	40
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521304	GH	On-Demand	Anodyne	CCKBR	32	41
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521304	GH	On-Demand	Anodyne	CAPN1	26	44
COc1cc(Cl)c(C(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521304	GH	On-Demand	Anodyne	NS5B	0	42
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521305	GH	On-Demand	Anodyne	HTR4	23	42
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521305	GH	On-Demand	Anodyne	MME	57	45
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521305	GH	On-Demand	Anodyne	PTGER3	58	39
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521305	GH	On-Demand	Anodyne	CCKAR	43	34
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521305	GH	On-Demand	Anodyne	NAALAD2	28	40
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521305	GH	On-Demand	Anodyne	CCKBR	32	41
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521305	GH	On-Demand	Anodyne	CAPN1	26	44
COc1cc(Cl)c(C(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1OC	ZINC000450521305	GH	On-Demand	Anodyne	NS5B	0	42
COc1cccc(-n2cc(C(=O)N3CCCCc4cc(OC)ccc43)nn2)c1	ZINC000450521319	GG	On-Demand	Anodyne	DRD4	44	34
COc1cccc(-n2cc(C(=O)N3CCCCc4cc(OC)ccc43)nn2)c1	ZINC000450521319	GG	On-Demand	Anodyne	AVPR2	29	45
Cc1nn(-c2ccccc2)cc1CNC(=O)CCCC(=O)C1CC1	ZINC000450521323	EF	On-Demand	Anodyne	P2RX7	27	52
COc1ccc(C[C@@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521325	GG	On-Demand	Anodyne	ACE	23	46
COc1ccc(C[C@@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521325	GG	On-Demand	Anodyne	PPARA	18	46
COc1ccc(C[C@@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521325	GG	On-Demand	Anodyne	MME	49	52
COc1ccc(C[C@@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521325	GG	On-Demand	Anodyne	PPARD	19	44
COc1ccc(C[C@@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521325	GG	On-Demand	Anodyne	ACE2	59	34
COc1ccc(C[C@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521327	GG	On-Demand	Anodyne	ACE	23	46
COc1ccc(C[C@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521327	GG	On-Demand	Anodyne	PPARA	18	46
COc1ccc(C[C@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521327	GG	On-Demand	Anodyne	MME	49	52
COc1ccc(C[C@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521327	GG	On-Demand	Anodyne	PPARD	19	44
COc1ccc(C[C@H](C)C(=O)NC[C@@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521327	GG	On-Demand	Anodyne	ACE2	59	34
COc1ccc(C[C@@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521328	GG	On-Demand	Anodyne	ACE	23	46
COc1ccc(C[C@@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521328	GG	On-Demand	Anodyne	PPARA	18	46
COc1ccc(C[C@@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521328	GG	On-Demand	Anodyne	MME	49	52
COc1ccc(C[C@@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521328	GG	On-Demand	Anodyne	PPARD	19	44
COc1ccc(C[C@@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521328	GG	On-Demand	Anodyne	ACE2	59	34
COc1ccc(C[C@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521329	GG	On-Demand	Anodyne	ACE	23	46
COc1ccc(C[C@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521329	GG	On-Demand	Anodyne	PPARA	18	46
COc1ccc(C[C@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521329	GG	On-Demand	Anodyne	MME	49	52
COc1ccc(C[C@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521329	GG	On-Demand	Anodyne	PPARD	19	44
COc1ccc(C[C@H](C)C(=O)NC[C@H](C(=O)O)c2ccc(C)cc2)cc1OC	ZINC000450521329	GG	On-Demand	Anodyne	ACE2	59	34
CCOC(=O)[C@@H](CO)NC(=O)c1oc2ccccc2c1CC	ZINC000450521337	DD	On-Demand	Anodyne	CCR3	0	43
CCOC(=O)[C@H](CO)NC(=O)c1oc2ccccc2c1CC	ZINC000450521338	DD	On-Demand	Anodyne	CCR3	0	43
CNc1nc(N2CCc3c(cccc3S(=O)(=O)NC)C2)nc2ccccc12	ZINC000450521353	GD	On-Demand	Anodyne	HRH4	18	40
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1csc(C(F)(F)F)n1	ZINC000450521356	GF	On-Demand	Anodyne	CPA1	28	48
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1csc(C(F)(F)F)n1	ZINC000450521357	GF	On-Demand	Anodyne	CPA1	28	48
CN1C(=O)CC[C@@H]1C(=O)Nc1cccnc1OCC(F)F	ZINC000450521370	CD	On-Demand	Anodyne	P2RX7	28	42
CN1C(=O)CC[C@H]1C(=O)Nc1cccnc1OCC(F)F	ZINC000450521372	CD	On-Demand	Anodyne	P2RX7	28	42
CCCC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450521373	DE	On-Demand	Anodyne	PAM	0	40
Cc1ccc([C@H](CNC(=O)CC[C@@H](C)c2ccccc2)C(=O)O)cc1	ZINC000450521374	EH	On-Demand	Anodyne	MME	19	43
CCCC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450521375	DE	On-Demand	Anodyne	PAM	0	40
Cc1ccc([C@H](CNC(=O)CC[C@H](C)c2ccccc2)C(=O)O)cc1	ZINC000450521376	EH	On-Demand	Anodyne	MME	19	43
Cc1ccc([C@@H](CNC(=O)CC[C@H](C)c2ccccc2)C(=O)O)cc1	ZINC000450521378	EH	On-Demand	Anodyne	MME	19	43
Cc1ccc([C@@H](CNC(=O)CC[C@@H](C)c2ccccc2)C(=O)O)cc1	ZINC000450521379	EH	On-Demand	Anodyne	MME	19	43
COc1cc(CC(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)ccc1O	ZINC000450521385	FD	On-Demand	Anodyne	TRPV1	0	40
COc1ccccc1Oc1ccc(C(=O)NCC[C@@H]2CCCCO2)nc1	ZINC000450521400	FH	On-Demand	Anodyne	TYRO3	18	40
COc1ccccc1Oc1ccc(C(=O)NCC[C@H]2CCCCO2)nc1	ZINC000450521401	FH	On-Demand	Anodyne	TYRO3	18	40
Cc1cccc(Cl)c1C(=O)NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2	ZINC000450521405	GF	On-Demand	Anodyne	CCR5	19	40
Cc1cccc(Cl)c1C(=O)NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2	ZINC000450521405	GF	On-Demand	Anodyne	L3MBTL3	51	33
Cc1cccc(Cl)c1C(=O)NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2	ZINC000450521406	GF	On-Demand	Anodyne	CCR5	19	40
Cc1cccc(Cl)c1C(=O)NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2	ZINC000450521406	GF	On-Demand	Anodyne	L3MBTL3	51	33
COc1ccc2c(c1)CCCCN2C(=O)[C@@H]1CCC(=O)N1C	ZINC000450521415	DD	On-Demand	Anodyne	SRD5A1	0	44
COc1ccc2c(c1)CCCCN2C(=O)[C@H]1CCC(=O)N1C	ZINC000450521417	DD	On-Demand	Anodyne	SRD5A1	0	44
CCCCS(=O)(=O)c1ccc(C(=O)N2CCC(COC)(C(=O)O)CC2)cc1	ZINC000450521423	GE	On-Demand	Anodyne	ADAM17	21	41
CCC[C@H](OC)C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450521424	DF	On-Demand	Anodyne	P2RX7	15	48
CCC[C@@H](OC)C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450521425	DF	On-Demand	Anodyne	P2RX7	15	48
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450521436	EF	On-Demand	Anodyne	F10	29	46
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450521436	EF	On-Demand	Anodyne	SIGMAR1	15	43
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000450521436	EF	On-Demand	Anodyne	NPY5R	20	40
COc1ccc(-c2noc(N3C[C@@H](C)[C@H](C(N)=O)C3)n2)cc1	ZINC000450521455	DD	On-Demand	Anodyne	COLA	0	41
Cc1ccc(C(=O)NCCN2CCNC(=O)C2)c(Cl)c1Cl	ZINC000450521470	ED	On-Demand	Anodyne	DRD4	42	32
Cc1ccc(C(=O)NCCN2CCNC(=O)C2)c(Cl)c1Cl	ZINC000450521470	ED	On-Demand	Anodyne	THRB	0	48
Cc1ccc(C(=O)NCCN2CCNC(=O)C2)c(Cl)c1Cl	ZINC000450521470	ED	On-Demand	Anodyne	PLD2	50	36
C[C@H](CN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1)S(C)(=O)=O	ZINC000450521481	FE	On-Demand	Anodyne	EPHX2	23	40
C[C@@H](CN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1)S(C)(=O)=O	ZINC000450521482	FE	On-Demand	Anodyne	EPHX2	23	40
CCOC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)nc1	ZINC000450521498	GF	On-Demand	Anodyne	SLC6A1	73	34
CCOC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)nc1	ZINC000450521498	GF	On-Demand	Anodyne	PDE8A	0	42
CCOC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)nc1	ZINC000450521499	GF	On-Demand	Anodyne	SLC6A1	73	34
CCOC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)nc1	ZINC000450521499	GF	On-Demand	Anodyne	PDE8A	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	ACE	58	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	MME	55	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	CAPNS1	57	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	REN	48	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	CAPN1	42	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	ACE2	52	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	POL	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	XIAP	61	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	BIRC3	51	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	BIRC2	64	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521500	EG	On-Demand	Anodyne	BRCA1	60	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	ACE	58	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	MME	55	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	CAPNS1	57	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	REN	48	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	CAPN1	42	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	ACE2	52	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	POL	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	XIAP	61	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	BIRC3	51	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	BIRC2	64	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521501	EG	On-Demand	Anodyne	BRCA1	60	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	ACE	58	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	MME	55	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	CAPNS1	57	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	REN	48	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	CAPN1	42	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	ACE2	52	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	POL	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	XIAP	61	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	BIRC3	51	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	BIRC2	64	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450521502	EG	On-Demand	Anodyne	BRCA1	60	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	ACE	58	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	MME	55	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	CAPNS1	57	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	REN	48	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	CAPN1	42	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	ACE2	52	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	POL	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	XIAP	61	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	BIRC3	51	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	BIRC2	64	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521503	EG	On-Demand	Anodyne	BRCA1	60	33
O=C(N[C@@H]1CCCc2cc(F)ccc21)[C@@H](O)C1CCC1	ZINC000450521519	CE	On-Demand	Anodyne	BDKRB1	51	40
O=C(N[C@H]1CCCc2cc(F)ccc21)[C@@H](O)C1CCC1	ZINC000450521520	CE	On-Demand	Anodyne	BDKRB1	51	40
O=C(N[C@@H]1CCCc2cc(F)ccc21)[C@H](O)C1CCC1	ZINC000450521521	CE	On-Demand	Anodyne	BDKRB1	51	40
O=C(N[C@H]1CCCc2cc(F)ccc21)[C@H](O)C1CCC1	ZINC000450521522	CE	On-Demand	Anodyne	BDKRB1	51	40
Cc1cccc(NC(=O)[C@H]2CCCN(Cc3cccnc3N)C2)n1	ZINC000450521523	EE	On-Demand	Anodyne	SLC6A1	57	35
Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3cccnc3N)C2)n1	ZINC000450521524	EE	On-Demand	Anodyne	SLC6A1	57	35
CN(C)S(=O)(=O)CC(=O)N(CCCC(=O)O)Cc1ccccc1	ZINC000450521526	EC	On-Demand	Anodyne	FFAR2	49	34
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521535	FG	On-Demand	Anodyne	DRD4	16	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521535	FG	On-Demand	Anodyne	OPRK1	18	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521535	FG	On-Demand	Anodyne	SIGMAR1	19	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521535	FG	On-Demand	Anodyne	CCR3	39	46
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521535	FG	On-Demand	Anodyne	CCR5	23	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521535	FG	On-Demand	Anodyne	EPHX2	55	49
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521535	FG	On-Demand	Anodyne	CXCR3	22	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521535	FG	On-Demand	Anodyne	MCHR1	19	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521536	FG	On-Demand	Anodyne	DRD4	16	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521536	FG	On-Demand	Anodyne	OPRK1	18	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521536	FG	On-Demand	Anodyne	SIGMAR1	19	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521536	FG	On-Demand	Anodyne	CCR3	39	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521536	FG	On-Demand	Anodyne	CCR5	23	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521536	FG	On-Demand	Anodyne	EPHX2	55	49
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521536	FG	On-Demand	Anodyne	CXCR3	22	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521536	FG	On-Demand	Anodyne	MCHR1	19	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521537	FG	On-Demand	Anodyne	DRD4	16	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521537	FG	On-Demand	Anodyne	OPRK1	18	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521537	FG	On-Demand	Anodyne	SIGMAR1	19	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521537	FG	On-Demand	Anodyne	CCR3	39	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521537	FG	On-Demand	Anodyne	CCR5	23	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521537	FG	On-Demand	Anodyne	EPHX2	55	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521537	FG	On-Demand	Anodyne	CXCR3	22	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521537	FG	On-Demand	Anodyne	MCHR1	19	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521538	FG	On-Demand	Anodyne	DRD4	16	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521538	FG	On-Demand	Anodyne	OPRK1	18	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521538	FG	On-Demand	Anodyne	SIGMAR1	19	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521538	FG	On-Demand	Anodyne	CCR3	39	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521538	FG	On-Demand	Anodyne	CCR5	23	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521538	FG	On-Demand	Anodyne	EPHX2	55	49
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521538	FG	On-Demand	Anodyne	CXCR3	22	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)Nc2ccccc2)CC1	ZINC000450521538	FG	On-Demand	Anodyne	MCHR1	19	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450521541	DC	On-Demand	Anodyne	KLK3	67	37
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450521541	DC	On-Demand	Anodyne	CAPNS1	46	33
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450521541	DC	On-Demand	Anodyne	CAPN2	76	35
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450521541	DC	On-Demand	Anodyne	ACE2	53	43
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450521542	DC	On-Demand	Anodyne	KLK3	67	37
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450521542	DC	On-Demand	Anodyne	CAPNS1	46	33
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450521542	DC	On-Demand	Anodyne	CAPN2	76	35
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450521542	DC	On-Demand	Anodyne	ACE2	53	43
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450521543	DC	On-Demand	Anodyne	KLK3	67	37
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450521543	DC	On-Demand	Anodyne	CAPNS1	46	33
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450521543	DC	On-Demand	Anodyne	CAPN2	76	35
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450521543	DC	On-Demand	Anodyne	ACE2	53	43
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450521544	DC	On-Demand	Anodyne	KLK3	67	37
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450521544	DC	On-Demand	Anodyne	CAPNS1	46	33
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450521544	DC	On-Demand	Anodyne	CAPN2	76	35
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450521544	DC	On-Demand	Anodyne	ACE2	53	43
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000450521556	GF	On-Demand	Anodyne	ACE	44	38
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000450521556	GF	On-Demand	Anodyne	SLC18A2	46	39
C[C@H](OCCc1ccccc1)C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000450521557	GF	On-Demand	Anodyne	ACE	44	38
C[C@H](OCCc1ccccc1)C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000450521557	GF	On-Demand	Anodyne	SLC18A2	46	39
C[C@H](OCCc1ccccc1)C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000450521558	GF	On-Demand	Anodyne	ACE	44	38
C[C@H](OCCc1ccccc1)C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000450521558	GF	On-Demand	Anodyne	SLC18A2	46	39
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000450521559	GF	On-Demand	Anodyne	ACE	44	38
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000450521559	GF	On-Demand	Anodyne	SLC18A2	46	39
COCC1(C(=O)O)CCN(C(=O)Cc2cccc(OC(F)(F)F)c2)CC1	ZINC000450521569	GE	On-Demand	Anodyne	PPARG	19	41
O=C(CCCC(=O)C1CC1)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450521576	DD	On-Demand	Anodyne	LUXR	75	36
O=C(CCCC(=O)C1CC1)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450521577	DD	On-Demand	Anodyne	LUXR	75	36
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450521586	CD	On-Demand	Anodyne	XIAP	47	35
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450521587	CD	On-Demand	Anodyne	XIAP	47	35
C[C@@H](Cc1ccc(NC(=O)CS(=O)(=O)N(C)C)cc1)C(=O)O	ZINC000450521594	EC	On-Demand	Anodyne	MME	48	36
C[C@@H](Cc1ccc(NC(=O)CS(=O)(=O)N(C)C)cc1)C(=O)O	ZINC000450521594	EC	On-Demand	Anodyne	ANPEP	41	31
C[C@@H](Cc1ccc(NC(=O)CS(=O)(=O)N(C)C)cc1)C(=O)O	ZINC000450521594	EC	On-Demand	Anodyne	NPY5R	33	41
C[C@H](Cc1ccc(NC(=O)CS(=O)(=O)N(C)C)cc1)C(=O)O	ZINC000450521595	EC	On-Demand	Anodyne	MME	48	36
C[C@H](Cc1ccc(NC(=O)CS(=O)(=O)N(C)C)cc1)C(=O)O	ZINC000450521595	EC	On-Demand	Anodyne	ANPEP	41	31
C[C@H](Cc1ccc(NC(=O)CS(=O)(=O)N(C)C)cc1)C(=O)O	ZINC000450521595	EC	On-Demand	Anodyne	NPY5R	33	41
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450521602	GD	On-Demand	Anodyne	DHODH	25	45
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450521602	GD	On-Demand	Anodyne	CYP2D6	15	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450521603	GD	On-Demand	Anodyne	DHODH	25	45
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450521603	GD	On-Demand	Anodyne	CYP2D6	15	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450521604	GD	On-Demand	Anodyne	DHODH	25	45
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450521604	GD	On-Demand	Anodyne	CYP2D6	15	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450521605	GD	On-Demand	Anodyne	DHODH	25	45
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450521605	GD	On-Demand	Anodyne	CYP2D6	15	41
N#Cc1cccc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450521612	GH	On-Demand	Mild	CYSLTR2	51	32
N#Cc1cccc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450521612	GH	On-Demand	Mild	PREP	45	38
N#Cc1cccc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450521613	GH	On-Demand	Mild	CYSLTR2	51	32
N#Cc1cccc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450521613	GH	On-Demand	Mild	PREP	45	38
CCOC(=O)[C@@H](CO)NC(=O)c1ocnc1-c1ccccc1	ZINC000450521614	DC	On-Demand	Anodyne	P2RY12	70	35
CCOC(=O)[C@@H](CO)NC(=O)c1ocnc1-c1ccccc1	ZINC000450521614	DC	On-Demand	Anodyne	TACR3	40	40
CCOC(=O)[C@H](CO)NC(=O)c1ocnc1-c1ccccc1	ZINC000450521615	DC	On-Demand	Anodyne	P2RY12	70	35
CCOC(=O)[C@H](CO)NC(=O)c1ocnc1-c1ccccc1	ZINC000450521615	DC	On-Demand	Anodyne	TACR3	40	40
COc1ccc2[nH]c(C(=O)NC[C@@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521724	DF	On-Demand	Anodyne	CCKAR	28	42
COc1ccc2[nH]c(C(=O)NC[C@@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521724	DF	On-Demand	Anodyne	PYGL	75	42
COc1ccc2[nH]c(C(=O)NC[C@@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521724	DF	On-Demand	Anodyne	MTNR1A	41	40
COc1ccc2[nH]c(C(=O)NC[C@@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521724	DF	On-Demand	Anodyne	MTNR1B	33	40
COc1ccc2[nH]c(C(=O)NC[C@@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521724	DF	On-Demand	Anodyne	TUBB2B	49	50
COc1ccc2[nH]c(C(=O)NC[C@@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521724	DF	On-Demand	Anodyne	FLT3	0	51
COc1ccc2[nH]c(C(=O)NC[C@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521725	DF	On-Demand	Anodyne	CCKAR	28	42
COc1ccc2[nH]c(C(=O)NC[C@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521725	DF	On-Demand	Anodyne	PYGL	75	42
COc1ccc2[nH]c(C(=O)NC[C@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521725	DF	On-Demand	Anodyne	MTNR1A	41	40
COc1ccc2[nH]c(C(=O)NC[C@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521725	DF	On-Demand	Anodyne	MTNR1B	33	40
COc1ccc2[nH]c(C(=O)NC[C@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521725	DF	On-Demand	Anodyne	TUBB2B	49	50
COc1ccc2[nH]c(C(=O)NC[C@H](CC(C)C)C(=O)O)cc2c1	ZINC000450521725	DF	On-Demand	Anodyne	FLT3	0	51
COC(=O)c1ccc(CN(C)Cc2cn(CC3CC3)nn2)cc1	ZINC000450521731	DE	On-Demand	Anodyne	SCARB1	41	34
O=C(O)[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1cccc(F)c1	ZINC000450521739	GF	On-Demand	Anodyne	CPA1	49	48
O=C(O)[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)Cc1cccc(F)c1	ZINC000450521740	GF	On-Demand	Anodyne	CPA1	49	48
Cc1cccc(C[C@@H](CNC(=O)C2(Oc3ccccc3F)CC2)C(=O)O)c1	ZINC000450521741	FG	On-Demand	Anodyne	CPA1	47	46
Cc1cccc(C[C@H](CNC(=O)C2(Oc3ccccc3F)CC2)C(=O)O)c1	ZINC000450521742	FG	On-Demand	Anodyne	CPA1	47	46
O=C(c1ccccn1)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450521746	FG	On-Demand	Anodyne	HTR1A	19	43
O=C(c1ccccn1)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450521746	FG	On-Demand	Anodyne	DRD2	19	42
O=C(c1ccccn1)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450521746	FG	On-Demand	Anodyne	HTR2A	26	43
O=C(c1ccccn1)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450521746	FG	On-Demand	Anodyne	HTR2C	20	40
O=C(c1ccccn1)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450521746	FG	On-Demand	Anodyne	DRD3	20	42
O=C(O)COc1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450521750	GH	On-Demand	Anodyne	PPARD	73	43
O=C(O)COc1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450521750	GH	On-Demand	Anodyne	FFAR1	18	42
O=C(O)COc1cccc(CNC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000450521750	GH	On-Demand	Anodyne	PDS	69	44
Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450521757	GE	On-Demand	Anodyne	EPHX2	17	40
Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450521758	GE	On-Demand	Anodyne	EPHX2	17	40
CC(=O)c1ccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521759	FI	On-Demand	Anodyne	DRD2	35	44
CC(=O)c1ccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521759	FI	On-Demand	Anodyne	AVPR2	22	41
CC(=O)c1ccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521759	FI	On-Demand	Anodyne	OPRM1	15	58
CC(=O)c1ccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521759	FI	On-Demand	Anodyne	LTA4H	27	49
CC(=O)c1ccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521759	FI	On-Demand	Anodyne	SIGMAR1	19	48
CC(=O)c1ccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521759	FI	On-Demand	Anodyne	CCR3	70	46
CC(=O)c1ccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521760	FI	On-Demand	Anodyne	DRD2	35	44
CC(=O)c1ccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521760	FI	On-Demand	Anodyne	AVPR2	22	41
CC(=O)c1ccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521760	FI	On-Demand	Anodyne	OPRM1	15	58
CC(=O)c1ccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521760	FI	On-Demand	Anodyne	LTA4H	27	49
CC(=O)c1ccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521760	FI	On-Demand	Anodyne	SIGMAR1	19	48
CC(=O)c1ccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)cc1	ZINC000450521760	FI	On-Demand	Anodyne	CCR3	70	46
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	KLKB1	27	42
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	DRD2	22	41
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	DRD4	40	41
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	DRD3	19	41
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	F10	47	46
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	LTA4H	17	42
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	HRH3	17	41
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	SIGMAR1	45	42
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	CCR5	43	46
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	NPY5R	23	40
CN(CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450521778	GH	On-Demand	Anodyne	CACNA1G	44	39
O=C(Nc1ccc(Cl)cn1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450521797	EI	On-Demand	Anodyne	F10	27	45
CCC[C@@H](NC(=O)c1cc(S(C)(=O)=O)cc(Br)c1C)C(=O)O	ZINC000450521802	GE	On-Demand	Anodyne	CA2	20	40
CCC[C@H](NC(=O)c1cc(S(C)(=O)=O)cc(Br)c1C)C(=O)O	ZINC000450521803	GE	On-Demand	Anodyne	CA2	20	40
O=C1CN(CCNC(=O)c2cc3ccc(Br)cc3s2)CCN1	ZINC000450521807	GD	On-Demand	Anodyne	PLD1	35	49
O=C1CN(CCNC(=O)c2cc3ccc(Br)cc3s2)CCN1	ZINC000450521807	GD	On-Demand	Anodyne	PLD2	54	44
COCC1(C#N)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450521808	FG	On-Demand	Mild	PDE3A	42	35
COCC1(C#N)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450521808	FG	On-Demand	Mild	PDGFRB	63	42
COCC1(C#N)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450521808	FG	On-Demand	Mild	PDE3B	63	35
CCSc1cccnc1C(=O)NCCN1CCNC(=O)C1	ZINC000450521809	DC	On-Demand	Anodyne	PLD2	48	33
CC(=O)c1cccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)c1	ZINC000450521835	FG	On-Demand	Anodyne	DRD2	15	48
CC(=O)c1cccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)c1	ZINC000450521835	FG	On-Demand	Anodyne	DRD4	20	40
CC(=O)c1cccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)c1	ZINC000450521835	FG	On-Demand	Anodyne	ACHE	19	45
CC(=O)c1cccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)c1	ZINC000450521835	FG	On-Demand	Anodyne	CHRM3	16	43
CC(=O)c1cccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)c1	ZINC000450521835	FG	On-Demand	Anodyne	FAAH	25	42
CC(=O)c1cccc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)c1	ZINC000450521835	FG	On-Demand	Anodyne	MGLL	0	47
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC(C)(c3nc(C)no3)CC2)c1	ZINC000450521836	GG	On-Demand	Anodyne	EPHX2	20	40
CC1(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)CC1	ZINC000450521854	CD	On-Demand	Anodyne	MME	29	40
CC1(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)CC1	ZINC000450521854	CD	On-Demand	Anodyne	CPA1	58	40
Cc1ccc(F)c(CC(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)c1	ZINC000450521859	GF	On-Demand	Anodyne	SFRP1	50	32
Cc1ccc(F)c(CC(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)c1	ZINC000450521859	GF	On-Demand	Anodyne	WNT3	43	32
CC1(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)CC1	ZINC000450521861	CD	On-Demand	Anodyne	MME	29	40
CC1(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)CC1	ZINC000450521861	CD	On-Demand	Anodyne	CPA1	58	40
Cc1ccc(F)c(CC(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)c1	ZINC000450521865	GF	On-Demand	Anodyne	SFRP1	50	32
Cc1ccc(F)c(CC(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)c1	ZINC000450521865	GF	On-Demand	Anodyne	WNT3	43	32
Cc1nn(C)cc1CN(c1ccccc1)C(C)C	ZINC000450521867	BG	On-Demand	Anodyne	TAAR1	27	43
COC[C@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)OC	ZINC000450521873	FE	On-Demand	Anodyne	AVPR1B	51	42
COC[C@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)OC	ZINC000450521873	FE	On-Demand	Anodyne	PDE6D	94	41
COC[C@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)OC	ZINC000450521873	FE	On-Demand	Anodyne	IMDH_CRYPV	37	53
COC[C@@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)OC	ZINC000450521874	FE	On-Demand	Anodyne	AVPR1B	51	42
COC[C@@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)OC	ZINC000450521874	FE	On-Demand	Anodyne	PDE6D	94	41
COC[C@@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)OC	ZINC000450521874	FE	On-Demand	Anodyne	IMDH_CRYPV	37	53
CSc1cccc(C(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)c1	ZINC000450521884	GF	On-Demand	Anodyne	RHOA	0	46
CSc1cccc(C(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)c1	ZINC000450521886	GF	On-Demand	Anodyne	RHOA	0	46
CC(C)(C)OCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450521896	EF	On-Demand	Anodyne	CDC25B	23	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	ACE	59	47
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	OPRM1	24	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	OPRD1	0	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	MME	110	44
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	ANPEP	89	39
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	TACR1	25	45
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	FCER2	73	37
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	BMP1	64	34
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	RNPEP	24	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	PFDN6	0	44
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	KLK3	89	39
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CTSB	62	43
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	PAPA1_CARPA	69	45
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CYSP_TRYCR	58	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CTSK	26	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CTSL	43	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CPA1	43	44
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CCR3	0	55
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	SLC15A1	0	43
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	TIMP3	69	36
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CAPNS1	57	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	MMP3	42	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	HLA-DRB1	75	43
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	SOAT1	22	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	PAM	0	44
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CTSS	31	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CAPN1	95	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CAPN2	103	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	ACE2	83	44
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	PLAU	42	34
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	FPR1	57	38
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	CTRB_BOVIN	54	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	POL	0	43
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	NPR	65	36
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	AMP1_PLAFQ	38	44
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	HDA106	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	RHODESAIN	0	45
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	SLC15A2	0	44
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	BLA1_STEMA	59	35
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	QRFPR	51	36
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	PSMB8	51	37
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	NPFFR1	49	34
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	METAP2	0	45
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521900	CC	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	ACE	59	47
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	OPRM1	24	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	OPRD1	0	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	MME	110	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	ANPEP	89	39
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	TACR1	25	45
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	FCER2	73	37
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	BMP1	64	34
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	RNPEP	24	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	PFDN6	0	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	KLK3	89	39
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CTSB	62	43
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	PAPA1_CARPA	69	45
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CYSP_TRYCR	58	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CTSK	26	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CTSL	43	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CPA1	43	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CCR3	0	55
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	SLC15A1	0	43
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	TIMP3	69	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CAPNS1	57	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	MMP3	42	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	HLA-DRB1	75	43
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	SOAT1	22	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	PAM	0	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CTSS	31	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CAPN1	95	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CAPN2	103	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	ACE2	83	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	PLAU	42	34
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	FPR1	57	38
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	CTRB_BOVIN	54	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	POL	0	43
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	NPR	65	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	AMP1_PLAFQ	38	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	HDA106	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	RHODESAIN	0	45
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	SLC15A2	0	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	BLA1_STEMA	59	35
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	QRFPR	51	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	PSMB8	51	37
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	NPFFR1	49	34
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	METAP2	0	45
CCOC(=O)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521901	CC	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	ACE	59	47
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	OPRM1	24	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	OPRD1	0	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	MME	110	44
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	ANPEP	89	39
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	TACR1	25	45
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	FCER2	73	37
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	BMP1	64	34
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	RNPEP	24	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	PFDN6	0	44
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	KLK3	89	39
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CTSB	62	43
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	PAPA1_CARPA	69	45
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CYSP_TRYCR	58	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CTSK	26	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CTSL	43	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CPA1	43	44
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CCR3	0	55
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	SLC15A1	0	43
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	TIMP3	69	36
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CAPNS1	57	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	MMP3	42	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	HLA-DRB1	75	43
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	SOAT1	22	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	PAM	0	44
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CTSS	31	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CAPN1	95	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CAPN2	103	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	ACE2	83	44
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	PLAU	42	34
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	FPR1	57	38
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	CTRB_BOVIN	54	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	POL	0	43
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	NPR	65	36
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	AMP1_PLAFQ	38	44
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	HDA106	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	RHODESAIN	0	45
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	SLC15A2	0	44
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	BLA1_STEMA	59	35
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	QRFPR	51	36
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	PSMB8	51	37
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	NPFFR1	49	34
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	METAP2	0	45
CCOC(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450521902	CC	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CC(C)(C)OCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450521903	EF	On-Demand	Anodyne	CDC25B	23	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	ACE	59	47
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	OPRM1	24	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	OPRD1	0	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	MME	110	44
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	ANPEP	89	39
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	TACR1	25	45
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	FCER2	73	37
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	BMP1	64	34
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	RNPEP	24	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	PFDN6	0	44
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	KLK3	89	39
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CTSB	62	43
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	PAPA1_CARPA	69	45
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CYSP_TRYCR	58	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CTSK	26	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CTSL	43	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CPA1	43	44
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CCR3	0	55
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	SLC15A1	0	43
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	TIMP3	69	36
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CAPNS1	57	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	MMP3	42	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	HLA-DRB1	75	43
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	SOAT1	22	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	PAM	0	44
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CTSS	31	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CAPN1	95	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CAPN2	103	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	ACE2	83	44
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	PLAU	42	34
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	FPR1	57	38
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	CTRB_BOVIN	54	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	POL	0	43
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	NPR	65	36
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	AMP1_PLAFQ	38	44
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	HDA106	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	RHODESAIN	0	45
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	SLC15A2	0	44
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	BLA1_STEMA	59	35
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	QRFPR	51	36
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	PSMB8	51	37
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	NPFFR1	49	34
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	METAP2	0	45
CCOC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450521905	CC	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521906	FG	On-Demand	Anodyne	SLC6A1	97	39
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521906	FG	On-Demand	Anodyne	F11	40	34
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521906	FG	On-Demand	Anodyne	PDE8A	0	42
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521906	FG	On-Demand	Anodyne	PDE8B	44	32
CCc1cccc(CC(=O)N2CCC(COC)(C(=O)O)CC2)c1	ZINC000450521907	DE	On-Demand	Anodyne	GPR183	0	41
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521908	FG	On-Demand	Anodyne	SLC6A1	97	39
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521908	FG	On-Demand	Anodyne	F11	40	34
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521908	FG	On-Demand	Anodyne	PDE8A	0	42
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521908	FG	On-Demand	Anodyne	PDE8B	44	32
CO[C@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521910	FG	On-Demand	Anodyne	SLC6A1	97	39
CO[C@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521910	FG	On-Demand	Anodyne	F11	40	34
CO[C@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521910	FG	On-Demand	Anodyne	PDE8A	0	42
CO[C@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521910	FG	On-Demand	Anodyne	PDE8B	44	32
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521911	FG	On-Demand	Anodyne	SLC6A1	97	39
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521911	FG	On-Demand	Anodyne	F11	40	34
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521911	FG	On-Demand	Anodyne	PDE8A	0	42
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000450521911	FG	On-Demand	Anodyne	PDE8B	44	32
CCOC(=O)c1csc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521914	FD	On-Demand	Anodyne	P2RY12	102	37
CCOC(=O)c1csc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521914	FD	On-Demand	Anodyne	CCR8	42	38
CCOC(=O)c1csc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521914	FD	On-Demand	Anodyne	BIRC2	20	43
CCOC(=O)c1csc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521914	FD	On-Demand	Anodyne	TRPC6	65	37
CCOC(=O)c1csc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521914	FD	On-Demand	Anodyne	TRPC3	49	37
CCOC(=O)c1csc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521919	FD	On-Demand	Anodyne	P2RY12	102	37
CCOC(=O)c1csc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521919	FD	On-Demand	Anodyne	CCR8	42	38
CCOC(=O)c1csc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521919	FD	On-Demand	Anodyne	BIRC2	20	43
CCOC(=O)c1csc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521919	FD	On-Demand	Anodyne	TRPC6	65	37
CCOC(=O)c1csc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)n1	ZINC000450521919	FD	On-Demand	Anodyne	TRPC3	49	37
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@H]1CCCN(C2CCC2)C1	ZINC000450521921	GJ	On-Demand	Anodyne	RBP4	82	41
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@@H]1CCCN(C2CCC2)C1	ZINC000450521923	GJ	On-Demand	Anodyne	RBP4	82	41
O=C(NCc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450521926	EH	On-Demand	Anodyne	SIGMAR1	23	44
O=C(NCc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450521926	EH	On-Demand	Anodyne	CCR3	47	40
O=C(NCc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450521926	EH	On-Demand	Anodyne	MCHR1	15	45
O=C(NCc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450521926	EH	On-Demand	Anodyne	CACNA1G	50	50
COCCOC[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450521928	FD	On-Demand	Anodyne	EPHX2	17	47
COc1cc(Cl)c(C(=O)N[C@H](CC2CC2)C(=O)O)cc1OC	ZINC000450521929	EE	On-Demand	Anodyne	HTR4	59	37
COc1cc(Cl)c(C(=O)N[C@@H](CC2CC2)C(=O)O)cc1OC	ZINC000450521931	EE	On-Demand	Anodyne	HTR4	59	37
COc1ccccc1C[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450521932	GF	On-Demand	Anodyne	PPARA	18	40
COc1ccccc1C[C@@H](CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450521932	GF	On-Demand	Anodyne	PPARD	22	40
COCCOC[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450521933	FD	On-Demand	Anodyne	EPHX2	17	47
COc1ccccc1C[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450521934	GF	On-Demand	Anodyne	PPARA	18	40
COc1ccccc1C[C@H](CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450521934	GF	On-Demand	Anodyne	PPARD	22	40
COCC1(C(=O)O)CCN(C(=O)Cc2ccc(F)cc2Cl)CC1	ZINC000450521942	EE	On-Demand	Anodyne	P2RX7	43	39
O=C(NCc1ccccc1CN1CCC[C@H]1CO)c1cccc(C(F)(F)F)n1	ZINC000450521948	GF	On-Demand	Anodyne	TRPV1	59	36
O=C(NCc1ccccc1CN1CCC[C@@H]1CO)c1cccc(C(F)(F)F)n1	ZINC000450521949	GF	On-Demand	Anodyne	TRPV1	59	36
COc1cc(Cl)c(C(=O)N[C@H]2CC[C@@H](C(=O)O)C2)cc1OC	ZINC000450521955	EE	On-Demand	Anodyne	DRD2	36	43
COc1cc(Cl)c(C(=O)N[C@H]2CC[C@@H](C(=O)O)C2)cc1OC	ZINC000450521955	EE	On-Demand	Anodyne	HTR4	39	48
COc1cc(Cl)c(C(=O)N[C@@H]2CC[C@H](C(=O)O)C2)cc1OC	ZINC000450521956	EE	On-Demand	Anodyne	DRD2	36	43
COc1cc(Cl)c(C(=O)N[C@@H]2CC[C@H](C(=O)O)C2)cc1OC	ZINC000450521956	EE	On-Demand	Anodyne	HTR4	39	48
Cc1nc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450521981	ED	On-Demand	Bother	C3AR1	41	35
Cc1nc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450521981	ED	On-Demand	Bother	MAPK10	0	42
Cc1nc(N[C@H]2CCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450521981	ED	On-Demand	Bother	MAPK8	0	42
COC(=O)c1coc(CNC2(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000450522010	EH	On-Demand	Anodyne	TACR3	56	33
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	CHRM1	15	42
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	DRD2	16	61
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	DRD4	21	61
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	CHRM3	25	40
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	SIGMAR1	27	42
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	CCR3	47	47
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	SLC6A5	47	36
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	EPHX2	50	47
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	CXCR3	21	44
O=C(Nc1ccccc1)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450522011	EI	On-Demand	Anodyne	MCHR1	23	50
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	CHRM1	15	42
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	DRD2	16	61
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	DRD4	21	61
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	CHRM3	25	40
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	SIGMAR1	27	42
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	CCR3	47	47
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	SLC6A5	47	36
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	EPHX2	50	47
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	CXCR3	21	44
O=C(Nc1ccccc1)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450522012	EI	On-Demand	Anodyne	MCHR1	23	50
CSc1cccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450522021	FF	On-Demand	Anodyne	DRD4	41	32
CSc1cccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450522021	FF	On-Demand	Anodyne	CCR2	26	43
CSc1cccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000450522021	FF	On-Demand	Anodyne	MCHR1	24	49
CSc1cccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450522024	FF	On-Demand	Anodyne	DRD4	41	32
CSc1cccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450522024	FF	On-Demand	Anodyne	CCR2	26	43
CSc1cccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000450522024	FF	On-Demand	Anodyne	MCHR1	24	49
C[C@@H]1CN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C(=O)N1CCOCC1	ZINC000450522030	GG	On-Demand	Anodyne	MAP3K12	17	40
CC(C)N(Cc1nnc(C2CC2)s1)c1ccccc1	ZINC000450522033	CH	On-Demand	Anodyne	TAAR1	17	41
Cc1ccc2c(C3=CCN(Cc4cn(CC5CC5)nn4)CC3)c[nH]c2c1	ZINC000450522039	EH	On-Demand	Anodyne	SLC6A4	0	44
Cc1ccc(NC(=O)C2CCN(CC3CC(F)(F)C3)CC2)nc1	ZINC000450522054	DG	On-Demand	Anodyne	GCK	20	41
CO[C@H]1C[C@@H](CN2CCCC2)N(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450522056	FH	On-Demand	Anodyne	HNMT	48	33
Cc1ccc(C(=O)N2CC[C@H](n3ncc4ccccc43)C2)c2c1CCC2	ZINC000450522088	EH	On-Demand	Anodyne	L3MBTL3	66	37
Cc1ccc(C(=O)N2CC[C@@H](n3ncc4ccccc43)C2)c2c1CCC2	ZINC000450522092	EH	On-Demand	Anodyne	L3MBTL3	66	37
Cc1nn(-c2ccccc2)cc1CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450522095	EG	On-Demand	Anodyne	CARM1	43	34
C[C@@H](CN1CCN(C(=O)N(C)Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522112	FD	On-Demand	Anodyne	RORC	18	40
CC(=O)c1nc(N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)sc1C	ZINC000450522113	GH	On-Demand	Anodyne	PREP	53	41
CC(=O)c1nc(N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)sc1C	ZINC000450522114	GH	On-Demand	Anodyne	PREP	53	41
C[C@H](CN1CCN(C(=O)N(C)Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522116	FD	On-Demand	Anodyne	RORC	18	40
COc1cc(Cl)c(C(=O)N2CCC[C@H](CCC(=O)O)C2)cc1OC	ZINC000450522117	FG	On-Demand	Anodyne	DRD2	22	41
COc1cc(Cl)c(C(=O)N2CCC[C@H](CCC(=O)O)C2)cc1OC	ZINC000450522117	FG	On-Demand	Anodyne	HTR4	63	44
CC(=O)[C@](C)(O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450522118	ED	On-Demand	Anodyne	CCR3	43	34
CC(=O)[C@](C)(O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450522118	ED	On-Demand	Anodyne	CACNA1G	44	51
CC(=O)[C@@](C)(O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450522119	ED	On-Demand	Anodyne	CCR3	43	34
CC(=O)[C@@](C)(O)CN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000450522119	ED	On-Demand	Anodyne	CACNA1G	44	51
COc1cc(Cl)c(C(=O)N2CCC[C@@H](CCC(=O)O)C2)cc1OC	ZINC000450522120	FG	On-Demand	Anodyne	DRD2	22	41
COc1cc(Cl)c(C(=O)N2CCC[C@@H](CCC(=O)O)C2)cc1OC	ZINC000450522120	FG	On-Demand	Anodyne	HTR4	63	44
Cc1noc(C2(C)CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC2)n1	ZINC000450522129	GF	On-Demand	Anodyne	GHRHR	75	33
Cc1nn(-c2ccccc2)cc1CNC(=O)CCCC(C)C	ZINC000450522131	CH	On-Demand	Anodyne	P2RX7	25	54
CCOC(=O)c1cnn(C2CCN(c3cccc(C#N)c3[N+](=O)[O-])CC2)c1C	ZINC000450522134	GF	On-Demand	Mild	P2RY12	51	40
CN(C1CCN(CC/C=C\c2ccccc2)CC1)S(C)(=O)=O	ZINC000450522135	DE	On-Demand	Anodyne	CCR5	44	36
CN(C1CCN(CC/C=C/c2ccccc2)CC1)S(C)(=O)=O	ZINC000450522136	DE	On-Demand	Anodyne	CCR5	44	36
CCN(Cc1ccc(S(=O)(=O)CC)cc1)c1ccccc1	ZINC000450522143	DH	On-Demand	Anodyne	CNR2	0	57
CCN(Cc1ccc(S(=O)(=O)CC)cc1)c1ccccc1	ZINC000450522143	DH	On-Demand	Anodyne	RORC	31	48
CCOC(=O)[C@H](CO)NC(=O)c1cccc2c1CCCC2	ZINC000450522152	CD	On-Demand	Anodyne	CCR3	22	47
CCOC(=O)[C@@H](CO)NC(=O)c1cccc2c1CCCC2	ZINC000450522156	CD	On-Demand	Anodyne	CCR3	22	47
O=C(O)[C@H]1CCCCN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450522160	FD	On-Demand	Bother	ACE	21	42
Cc1cc(C)c(C(=O)NCCN2CCNC(=O)C2)cc1Br	ZINC000450522162	FD	On-Demand	Anodyne	PLD1	42	36
Cc1cc(C)c(C(=O)NCCN2CCNC(=O)C2)cc1Br	ZINC000450522162	FD	On-Demand	Anodyne	PLD2	73	36
CCS(=O)(=O)c1ccc(CNC2(c3ccc(Cl)c(Cl)c3)CC2)cc1	ZINC000450522166	GJ	On-Demand	Anodyne	TACR3	52	33
N#Cc1cccc(NCc2c(F)cccc2N2CCCC2)c1[N+](=O)[O-]	ZINC000450522179	EH	On-Demand	Mild	KCNQ2	54	36
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	HTR1A	31	43
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	DRD2	51	48
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	DRD4	80	48
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	ACHE	39	42
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	HTR2A	19	41
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	AVPR2	42	40
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	HRH1	28	41
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	DRD3	38	43
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	HTR4	40	41
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	SIGMAR1	48	63
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	SSTR5	73	41
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	CCR3	38	41
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	UTS2R	25	40
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	MTNR1B	26	40
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	MCHR1	31	42
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	NOD1	28	40
COc1cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)ccc1Cl	ZINC000450522194	GI	On-Demand	Anodyne	NOD2	43	40
CCOC(=O)[C@@H](CO)NC(=O)c1cc2c(Br)cccc2cn1	ZINC000450522196	FD	On-Demand	Anodyne	CCR3	0	41
CCOC(=O)[C@H](CO)NC(=O)c1cc2c(Br)cccc2cn1	ZINC000450522197	FD	On-Demand	Anodyne	CCR3	0	41
Cc1nc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450522207	ED	On-Demand	Bother	C3AR1	41	35
Cc1nc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450522207	ED	On-Demand	Bother	MAPK10	0	42
Cc1nc(N[C@@H]2CCN(C(=O)Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000450522207	ED	On-Demand	Bother	MAPK8	0	42
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	PDE4A	37	43
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	MMP13	27	42
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	KCNA3	41	38
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	PDE4B	18	43
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	PDE4D	22	43
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	ROCK1	37	43
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	PPARD	28	47
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	ROCK2	38	43
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	PDE4C	15	43
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	CRTH2	0	41
COc1ccc(C(=O)NCc2cccc(OCC(=O)O)c2)c(OC2CCCC2)c1	ZINC000450522208	GG	On-Demand	Anodyne	PDS	42	39
COCC1(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)CCC1	ZINC000450522209	DE	On-Demand	Anodyne	MME	24	43
COCC1(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)CCC1	ZINC000450522210	DE	On-Demand	Anodyne	MME	24	43
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccnc1OCC(F)F	ZINC000450522218	CG	On-Demand	Anodyne	P2RY1	45	37
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccnc1OCC(F)F	ZINC000450522219	CG	On-Demand	Anodyne	P2RY1	45	37
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccnc1OCC(F)F	ZINC000450522220	CG	On-Demand	Anodyne	P2RY1	45	37
CC[C@H]1CCC[C@H]1C(=O)Nc1cccnc1OCC(F)F	ZINC000450522221	CG	On-Demand	Anodyne	P2RY1	45	37
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1	ZINC000450522224	FD	On-Demand	Anodyne	ADAM17	17	41
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1	ZINC000450522224	FD	On-Demand	Anodyne	GRM4	22	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1	ZINC000450522224	FD	On-Demand	Anodyne	LSS	17	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1	ZINC000450522224	FD	On-Demand	Anodyne	FAAH	20	41
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1	ZINC000450522224	FD	On-Demand	Anodyne	CCR8	29	45
COc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC[C@@H](C(=O)O)C2)cc1OC	ZINC000450522239	GD	On-Demand	Anodyne	SLC6A1	132	42
COc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC[C@@H](C(=O)O)C2)cc1OC	ZINC000450522239	GD	On-Demand	Anodyne	HTR4	61	38
COc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC[C@@H](C(=O)O)C2)cc1OC	ZINC000450522239	GD	On-Demand	Anodyne	FDFT1	32	44
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1cnc(C(F)(F)F)nc1	ZINC000450522242	FE	On-Demand	Anodyne	FOLH1	16	40
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1cnc(C(F)(F)F)nc1	ZINC000450522242	FE	On-Demand	Anodyne	MME	16	41
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1cnc(C(F)(F)F)nc1	ZINC000450522242	FE	On-Demand	Anodyne	CPA1	36	50
O=C(NC[C@H](Cc1cccc(F)c1)C(=O)O)c1cnc(C(F)(F)F)nc1	ZINC000450522242	FE	On-Demand	Anodyne	PPARD	18	40
COc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC[C@H](C(=O)O)C2)cc1OC	ZINC000450522243	GD	On-Demand	Anodyne	SLC6A1	132	42
COc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC[C@H](C(=O)O)C2)cc1OC	ZINC000450522243	GD	On-Demand	Anodyne	HTR4	61	38
COc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC[C@H](C(=O)O)C2)cc1OC	ZINC000450522243	GD	On-Demand	Anodyne	FDFT1	32	44
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1cnc(C(F)(F)F)nc1	ZINC000450522245	FE	On-Demand	Anodyne	FOLH1	16	40
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1cnc(C(F)(F)F)nc1	ZINC000450522245	FE	On-Demand	Anodyne	MME	16	41
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1cnc(C(F)(F)F)nc1	ZINC000450522245	FE	On-Demand	Anodyne	CPA1	36	50
O=C(NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1cnc(C(F)(F)F)nc1	ZINC000450522245	FE	On-Demand	Anodyne	PPARD	18	40
O=C(O)[C@@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)c1ccccc1	ZINC000450522249	GH	On-Demand	Anodyne	TACR1	15	47
O=C(O)[C@H](CNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)c1ccccc1	ZINC000450522250	GH	On-Demand	Anodyne	TACR1	15	47
Clc1ccc(CCN2CCC[C@H]2c2ccc[nH]2)cc1	ZINC000450522252	CI	On-Demand	Anodyne	HRH3	36	41
Clc1ccc(CCN2CCC[C@@H]2c2ccc[nH]2)cc1	ZINC000450522253	CI	On-Demand	Anodyne	HRH3	36	41
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450522259	FH	On-Demand	Anodyne	CCR3	53	32
CN(C)S(=O)(=O)CC(=O)NCCc1cccc(C(=O)O)c1	ZINC000450522265	DB	On-Demand	Anodyne	CA5B	16	40
CN(C)S(=O)(=O)CC(=O)NCCc1cccc(C(=O)O)c1	ZINC000450522265	DB	On-Demand	Anodyne	AKR1C3	42	33
CN(C)S(=O)(=O)CC(=O)NCCc1cccc(C(=O)O)c1	ZINC000450522265	DB	On-Demand	Anodyne	CRTM	39	42
CN(C)S(=O)(=O)CC(=O)NCCc1cccc(C(=O)O)c1	ZINC000450522265	DB	On-Demand	Anodyne	KDM4E	22	43
CCC[C@@H](CC(C)C)C(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450522269	FH	On-Demand	Anodyne	CCR3	53	32
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450522270	FH	On-Demand	Anodyne	CCR3	53	32
CCC[C@@H](CC(C)C)C(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450522271	FH	On-Demand	Anodyne	CCR3	53	32
O=C(O)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1cccc2ccccc12	ZINC000450522282	GG	On-Demand	Anodyne	CPA1	15	46
O=C(O)[C@H](CNC(=O)C1(C2CC2)CCOCC1)Cc1cccc2ccccc12	ZINC000450522283	GG	On-Demand	Anodyne	CPA1	15	46
Cc1cccc(C[C@@H](CNC(=O)C2(C3CC3)CCOCC2)C(=O)O)c1	ZINC000450522284	EF	On-Demand	Anodyne	CPA1	24	47
Cc1cccc(C[C@H](CNC(=O)C2(C3CC3)CCOCC2)C(=O)O)c1	ZINC000450522285	EF	On-Demand	Anodyne	CPA1	24	47
O=C(N1CCOC2(CCC2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450522294	EF	On-Demand	Anodyne	SLC12A5	44	34
COc1ccc(F)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1OC	ZINC000450522295	GF	On-Demand	Anodyne	PPARA	22	44
COc1ccc(F)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1OC	ZINC000450522295	GF	On-Demand	Anodyne	MME	16	43
COc1ccc(F)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1OC	ZINC000450522295	GF	On-Demand	Anodyne	CPA1	28	47
COc1ccc(F)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)c1OC	ZINC000450522295	GF	On-Demand	Anodyne	PPARD	25	43
COc1ccc(F)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1OC	ZINC000450522296	GF	On-Demand	Anodyne	PPARA	22	44
COc1ccc(F)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1OC	ZINC000450522296	GF	On-Demand	Anodyne	MME	16	43
COc1ccc(F)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1OC	ZINC000450522296	GF	On-Demand	Anodyne	CPA1	28	47
COc1ccc(F)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)c1OC	ZINC000450522296	GF	On-Demand	Anodyne	PPARD	25	43
CC(C)CN(CC[C@H](C)O)c1c(O)nc(=O)n(Cc2ccccc2)c1N	ZINC000450522299	FD	On-Demand	Anodyne	TLR7	17	41
CC(C)CN(CC[C@@H](C)O)c1c(O)nc(=O)n(Cc2ccccc2)c1N	ZINC000450522300	FD	On-Demand	Anodyne	TLR7	17	41
Cc1ccc([C@H](CNC(=O)Cc2cccc(OCC(F)(F)F)c2)C(=O)O)cc1	ZINC000450522332	GG	On-Demand	Anodyne	NR1H3	18	40
Cc1ccc([C@H](CNC(=O)Cc2cccc(OCC(F)(F)F)c2)C(=O)O)cc1	ZINC000450522332	GG	On-Demand	Anodyne	CRTM	43	35
Cc1ccc([C@H](CNC(=O)Cc2cccc(OCC(F)(F)F)c2)C(=O)O)cc1	ZINC000450522332	GG	On-Demand	Anodyne	PDS	68	38
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OCC(F)(F)F)c2)C(=O)O)cc1	ZINC000450522333	GG	On-Demand	Anodyne	NR1H3	18	40
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OCC(F)(F)F)c2)C(=O)O)cc1	ZINC000450522333	GG	On-Demand	Anodyne	CRTM	43	35
Cc1ccc([C@@H](CNC(=O)Cc2cccc(OCC(F)(F)F)c2)C(=O)O)cc1	ZINC000450522333	GG	On-Demand	Anodyne	PDS	68	38
O=C(c1cnc(C2CC2)nc1)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1	ZINC000450522335	GH	On-Demand	Anodyne	HDAC1	16	41
CCOC(=O)c1cnn(C2CCN(c3cccc(Cl)c3C#N)CC2)c1C	ZINC000450522341	FH	On-Demand	Mild	P2RY12	54	39
C[C@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522345	ED	On-Demand	Anodyne	LPL	44	34
C[C@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522345	ED	On-Demand	Anodyne	CA1	28	40
C[C@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522345	ED	On-Demand	Anodyne	CCR3	46	47
C[C@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522345	ED	On-Demand	Anodyne	EPHX2	57	50
C[C@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522345	ED	On-Demand	Anodyne	CXCR3	23	41
C[C@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522345	ED	On-Demand	Anodyne	P96878_MYCTU	23	43
C[C@@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522346	ED	On-Demand	Anodyne	LPL	44	34
C[C@@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522346	ED	On-Demand	Anodyne	CA1	28	40
C[C@@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522346	ED	On-Demand	Anodyne	CCR3	46	47
C[C@@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522346	ED	On-Demand	Anodyne	EPHX2	57	50
C[C@@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522346	ED	On-Demand	Anodyne	CXCR3	23	41
C[C@@H](CN1CCC(NC(=O)Nc2ccccc2)CC1)S(C)(=O)=O	ZINC000450522346	ED	On-Demand	Anodyne	P96878_MYCTU	23	43
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	ACE	51	46
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	MME	65	46
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	ANPEP	75	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CASP3	24	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	BMP1	45	33
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	PFDN6	0	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	KLK3	86	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CTSB	49	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	PAPA1_CARPA	51	32
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CYSP_TRYCR	55	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CTSK	29	47
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CTSL	30	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	TIMP3	55	34
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CAPNS1	58	37
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	MMP2	23	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	MMP3	54	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	HLA-DRB1	64	39
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	PAM	0	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CAPN1	82	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CAPN2	107	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	ACE2	68	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	LAP3	44	38
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	MMP1	25	41
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	FPR1	49	38
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	CTRB_BOVIN	59	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	NPR	69	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	RHODESAIN	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	PSMB5	43	37
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	SLC15A2	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522348	DC	On-Demand	Anodyne	METAP2	25	53
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	ACE	51	46
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	MME	65	46
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	ANPEP	75	36
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CASP3	24	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	BMP1	45	33
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	PFDN6	0	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	KLK3	86	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CTSB	49	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	PAPA1_CARPA	51	32
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CYSP_TRYCR	55	36
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CTSK	29	47
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CTSL	30	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	TIMP3	55	34
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CAPNS1	58	37
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	MMP2	23	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	MMP3	54	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	HLA-DRB1	64	39
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	REN	0	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	PAM	0	42
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CTSS	0	47
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CAPN1	82	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CAPN2	107	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	ACE2	68	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	LAP3	44	38
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	MMP1	25	41
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	FPR1	49	38
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	CTRB_BOVIN	59	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	NPR	69	36
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	RHODESAIN	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	PSMB5	43	37
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	SLC15A2	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450522349	DC	On-Demand	Anodyne	METAP2	0	53
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	ACE	51	46
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	MME	65	46
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	ANPEP	75	36
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CASP3	24	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	BMP1	45	33
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	PFDN6	0	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	KLK3	86	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CTSB	49	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	PAPA1_CARPA	51	32
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CYSP_TRYCR	55	36
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CTSK	29	47
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CTSL	30	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	TIMP3	55	34
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CAPNS1	58	37
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	MMP2	23	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	MMP3	54	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	HLA-DRB1	64	39
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	PAM	0	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CAPN1	82	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CAPN2	107	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	ACE2	68	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	LAP3	44	38
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	MMP1	25	41
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	FPR1	49	38
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	CTRB_BOVIN	59	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	NPR	69	36
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	RHODESAIN	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	PSMB5	43	37
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	SLC15A2	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522350	DC	On-Demand	Anodyne	METAP2	25	53
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	ACE	51	46
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	MME	65	46
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	ANPEP	75	36
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CASP3	24	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	BMP1	45	33
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	PFDN6	0	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	KLK3	86	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CTSB	49	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	PAPA1_CARPA	51	32
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CYSP_TRYCR	55	36
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CTSK	29	47
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CTSL	30	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	TIMP3	55	34
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CAPNS1	58	37
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	MMP2	23	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	MMP3	54	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	HLA-DRB1	64	39
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	PAM	0	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CAPN1	82	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CAPN2	107	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	ACE2	68	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	LAP3	44	38
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	MMP1	25	41
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	FPR1	49	38
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	CTRB_BOVIN	59	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	NPR	69	36
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	RHODESAIN	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	PSMB5	43	37
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	SLC15A2	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450522351	DC	On-Demand	Anodyne	METAP2	25	53
CCOCc1nc(C)c(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)s1	ZINC000450522353	GE	On-Demand	Anodyne	SCD1	38	40
CCOCc1nc(C)c(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)s1	ZINC000450522353	GE	On-Demand	Anodyne	SCD	29	40
CCOCc1nc(C)c(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)s1	ZINC000450522354	GE	On-Demand	Anodyne	SCD1	38	40
CCOCc1nc(C)c(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)s1	ZINC000450522354	GE	On-Demand	Anodyne	SCD	29	40
CC[C@H](CC(C)C)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522357	EF	On-Demand	Anodyne	OPRK1	0	42
CC[C@@H](CC(C)C)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522358	EF	On-Demand	Anodyne	OPRK1	0	42
CC[C@@H](CC(C)C)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522359	EF	On-Demand	Anodyne	OPRK1	0	42
CC[C@H](CC(C)C)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522360	EF	On-Demand	Anodyne	OPRK1	0	42
Cc1nn(-c2ccccc2)cc1CNC(=O)CC1CC(F)(F)C1	ZINC000450522363	DG	On-Demand	Anodyne	P2RX7	39	54
Cc1cc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@H]2CO)cc1F	ZINC000450522370	GG	On-Demand	Anodyne	DRD2	31	41
Cc1cc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@H]2CO)cc1F	ZINC000450522370	GG	On-Demand	Anodyne	P2RX7	49	36
Cc1cc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@H]2CO)cc1F	ZINC000450522370	GG	On-Demand	Anodyne	ACKR3	56	33
Cc1cc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)cc1F	ZINC000450522371	GG	On-Demand	Anodyne	DRD2	31	41
Cc1cc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)cc1F	ZINC000450522371	GG	On-Demand	Anodyne	P2RX7	49	36
Cc1cc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)cc1F	ZINC000450522371	GG	On-Demand	Anodyne	ACKR3	56	33
CC(F)(F)c1ccc(C(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)cn1	ZINC000450522378	FD	On-Demand	Anodyne	WNT3	52	32
O=C(O)Cc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000450522384	FI	On-Demand	Anodyne	EPHX2	25	42
Fc1cccc(N2CCCC2)c1CNc1ncc(C(F)F)cn1	ZINC000450522395	DH	On-Demand	Anodyne	KCNQ2	55	38
CC[C@H](C)CC(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1	ZINC000450522401	CF	On-Demand	Anodyne	GYS1	18	41
CC[C@@H](C)CC(=O)N(CC(=O)O)Cc1ccc(F)c(F)c1	ZINC000450522402	CF	On-Demand	Anodyne	GYS1	18	41
COc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522419	FH	On-Demand	Anodyne	TSHR	42	33
COc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522419	FH	On-Demand	Anodyne	PDE4A	32	42
COc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522419	FH	On-Demand	Anodyne	PDE4B	26	41
COc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522419	FH	On-Demand	Anodyne	PDE4C	15	41
COc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522419	FH	On-Demand	Anodyne	CPT1B	41	39
COc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522419	FH	On-Demand	Anodyne	YOPH	0	40
COc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522419	FH	On-Demand	Anodyne	AKR1C2	47	36
O=C(O)CC[C@H]1CCCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450522429	EG	On-Demand	Anodyne	OPRM1	0	58
O=C(O)CC[C@H]1CCCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450522429	EG	On-Demand	Anodyne	OPRK1	27	57
O=C(O)CC[C@@H]1CCCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450522430	EG	On-Demand	Anodyne	OPRM1	0	58
O=C(O)CC[C@@H]1CCCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450522430	EG	On-Demand	Anodyne	OPRK1	27	57
CCN(Cc1nc(C(=O)OC)cs1)c1cccc(OC)c1	ZINC000450522433	DF	On-Demand	Anodyne	MTNR1B	23	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(O)cc1F	ZINC000450522442	DG	On-Demand	Anodyne	ANPEP	33	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(O)cc1F	ZINC000450522442	DG	On-Demand	Anodyne	CAPN1	32	45
COc1ccc(-c2noc(CN3CCN(C(=O)c4ccc(O)cc4)CC3)n2)nn1	ZINC000450522476	GD	On-Demand	Anodyne	PLA2G2A	26	42
Cc1oc(-c2ccccc2)c(C(=O)NC[C@H](CC(C)C)C(=O)O)c1C	ZINC000450522479	EI	On-Demand	Anodyne	ITGAV	41	37
Cc1oc(-c2ccccc2)c(C(=O)NC[C@H](CC(C)C)C(=O)O)c1C	ZINC000450522479	EI	On-Demand	Anodyne	NPR	55	36
Cc1oc(-c2ccccc2)c(C(=O)NC[C@@H](CC(C)C)C(=O)O)c1C	ZINC000450522480	EI	On-Demand	Anodyne	ITGAV	41	37
Cc1oc(-c2ccccc2)c(C(=O)NC[C@@H](CC(C)C)C(=O)O)c1C	ZINC000450522480	EI	On-Demand	Anodyne	NPR	55	36
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522491	GG	On-Demand	Anodyne	PPARA	21	45
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522491	GG	On-Demand	Anodyne	HTR4	24	45
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522491	GG	On-Demand	Anodyne	MME	18	44
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522491	GG	On-Demand	Anodyne	CPA1	32	48
COc1cc(Cl)c(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522491	GG	On-Demand	Anodyne	PPARD	21	42
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522492	GG	On-Demand	Anodyne	PPARA	21	45
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522492	GG	On-Demand	Anodyne	HTR4	24	45
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522492	GG	On-Demand	Anodyne	MME	18	44
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522492	GG	On-Demand	Anodyne	CPA1	32	48
COc1cc(Cl)c(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)O)cc1OC	ZINC000450522492	GG	On-Demand	Anodyne	PPARD	21	42
C[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1c(F)cccc1F	ZINC000450522495	FG	On-Demand	Anodyne	MME	43	41
C[C@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1c(F)cccc1F	ZINC000450522495	FG	On-Demand	Anodyne	CPA1	60	42
C[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1c(F)cccc1F	ZINC000450522496	FG	On-Demand	Anodyne	MME	43	41
C[C@@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1c(F)cccc1F	ZINC000450522496	FG	On-Demand	Anodyne	CPA1	60	42
C[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1c(F)cccc1F	ZINC000450522497	FG	On-Demand	Anodyne	MME	43	41
C[C@H](C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)O)c1c(F)cccc1F	ZINC000450522497	FG	On-Demand	Anodyne	CPA1	60	42
C[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1c(F)cccc1F	ZINC000450522498	FG	On-Demand	Anodyne	MME	43	41
C[C@@H](C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)O)c1c(F)cccc1F	ZINC000450522498	FG	On-Demand	Anodyne	CPA1	60	42
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)CCCC(=O)C3CC3)no2)cn1	ZINC000450522504	GG	On-Demand	Anodyne	ALOX5AP	44	34
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)CCCC(=O)C3CC3)no2)cn1	ZINC000450522504	GG	On-Demand	Anodyne	COLA	108	49
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)CCCC(=O)C3CC3)no2)cn1	ZINC000450522504	GG	On-Demand	Anodyne	CPT1A	104	49
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)CCCC(=O)C3CC3)no2)cn1	ZINC000450522505	GG	On-Demand	Anodyne	ALOX5AP	44	34
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)CCCC(=O)C3CC3)no2)cn1	ZINC000450522505	GG	On-Demand	Anodyne	COLA	108	49
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)CCCC(=O)C3CC3)no2)cn1	ZINC000450522505	GG	On-Demand	Anodyne	CPT1A	104	49
Cc1cc(OCc2ccccc2)nc(N2CCC[C@@](O)(Cn3ccnn3)C2)n1	ZINC000450522510	GD	On-Demand	Anodyne	SLC12A5	55	33
Cc1cc(OCc2ccccc2)nc(N2CCC[C@](O)(Cn3ccnn3)C2)n1	ZINC000450522511	GD	On-Demand	Anodyne	SLC12A5	55	33
COCCCN(CC[C@H](C)O)c1c(O)nc(=O)n(Cc2ccccc2)c1N	ZINC000450522520	GD	On-Demand	Anodyne	TLR7	37	40
COCCCN(CC[C@@H](C)O)c1c(O)nc(=O)n(Cc2ccccc2)c1N	ZINC000450522521	GD	On-Demand	Anodyne	TLR7	37	40
O=C(Cc1ccc(Cl)s1)NC[C@@H](Cc1cccc(F)c1)C(=O)O	ZINC000450522526	FG	On-Demand	Anodyne	CPA1	40	35
O=C(Cc1ccc(Cl)s1)NC[C@H](Cc1cccc(F)c1)C(=O)O	ZINC000450522527	FG	On-Demand	Anodyne	CPA1	40	35
CCc1cccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)n1	ZINC000450522531	EE	On-Demand	Anodyne	MCHR1	17	47
CCc1cccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)n1	ZINC000450522532	EE	On-Demand	Anodyne	MCHR1	17	47
CCOC(=O)c1cnn(C2CCN(c3nc4c(cc3C#N)COCC4)CC2)c1C	ZINC000450522536	GF	On-Demand	Mild	P2RY12	53	46
Cc1nn(-c2ccccc2)cc1CNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450522539	DG	On-Demand	Anodyne	P2RX7	19	50
Cc1nn(-c2ccccc2)cc1CNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450522540	DG	On-Demand	Anodyne	P2RX7	19	50
Cc1nn(-c2ccccc2)cc1CNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450522541	DG	On-Demand	Anodyne	P2RX7	19	50
Cc1nn(-c2ccccc2)cc1CNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450522542	DG	On-Demand	Anodyne	P2RX7	19	50
COC(=O)CN(C[C@@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450522544	CE	On-Demand	Anodyne	KCNA5	41	44
COC(=O)CN(C[C@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450522545	CE	On-Demand	Anodyne	KCNA5	41	44
COC(=O)CN(C[C@@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450522546	CE	On-Demand	Anodyne	KCNA5	41	44
COC(=O)CN(C[C@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450522547	CE	On-Demand	Anodyne	KCNA5	41	44
COCC1(C(=O)O)CCN(C(=O)c2cc(Cl)c(Cl)cc2OC)CC1	ZINC000450522549	GF	On-Demand	Anodyne	HTR4	67	37
CC(C)OC(C)(C)C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522557	EE	On-Demand	Anodyne	BIRC2	46	35
CC(C)OC(C)(C)C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522558	EE	On-Demand	Anodyne	BIRC2	46	35
COCC1(C(=O)O)CCN(C(=O)[C@H](C)Cc2ccccc2Cl)CC1	ZINC000450522581	FF	On-Demand	Anodyne	MC4R	42	39
COCC1(C(=O)O)CCN(C(=O)[C@H](C)Cc2ccccc2Cl)CC1	ZINC000450522581	FF	On-Demand	Anodyne	CCKBR	58	35
COCC1(C(=O)O)CCN(C(=O)[C@@H](C)Cc2ccccc2Cl)CC1	ZINC000450522582	FF	On-Demand	Anodyne	MC4R	42	39
COCC1(C(=O)O)CCN(C(=O)[C@@H](C)Cc2ccccc2Cl)CC1	ZINC000450522582	FF	On-Demand	Anodyne	CCKBR	58	35
COc1cc(C)c(C(=O)N(CC(=O)O)Cc2ccc(F)c(F)c2)cc1OC	ZINC000450522583	GG	On-Demand	Anodyne	GYS1	24	43
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2nc(C3CCC3)no2)C1	ZINC000450522592	FG	On-Demand	Anodyne	PREP	49	39
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2nc(C3CCC3)no2)C1	ZINC000450522593	FG	On-Demand	Anodyne	PREP	49	39
Cc1cccc2c1C[C@H](C(=O)NCc1ccccc1CN1CC[C@H](O)C1)O2	ZINC000450522594	FE	On-Demand	Anodyne	OPRK1	19	42
Cc1cccc2c1C[C@@H](C(=O)NCc1ccccc1CN1CC[C@@H](O)C1)O2	ZINC000450522595	FE	On-Demand	Anodyne	OPRK1	19	42
Cc1cccc2c1C[C@@H](C(=O)NCc1ccccc1CN1CC[C@H](O)C1)O2	ZINC000450522596	FE	On-Demand	Anodyne	OPRK1	19	42
Cc1cccc2c1C[C@H](C(=O)NCc1ccccc1CN1CC[C@@H](O)C1)O2	ZINC000450522597	FE	On-Demand	Anodyne	OPRK1	19	42
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CHRM2	26	47
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CHRM1	18	45
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	DRD2	24	57
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	DRD4	53	53
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	ACHE	38	54
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	DRD3	27	80
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	KCNH2	15	49
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CHRM3	38	47
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	LTA4H	34	40
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	SIGMAR1	59	56
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	SSTR5	53	40
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CCR3	83	57
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CCR5	22	40
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	MTOR	19	41
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	SLC6A5	31	49
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	EPHX2	54	47
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CXCR3	51	58
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	TGFBR1	0	40
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	MCHR1	70	49
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CACNA1G	26	42
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CCR8	24	42
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	CYP2J2	45	33
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	NPFFR1	52	40
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	NOD2	47	40
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	ADIPOR1	0	49
CC(=O)c1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000450522609	FH	On-Demand	Anodyne	ADIPOR2	0	49
COc1cc(Cl)c(C(=O)NC2(C(=O)O)CCCCCC2)cc1OC	ZINC000450522623	FG	On-Demand	Anodyne	NTSR2	26	43
COc1cc(Cl)c(C(=O)NC2(C(=O)O)CCCCCC2)cc1OC	ZINC000450522623	FG	On-Demand	Anodyne	PYGL	25	41
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2nncs2)C1	ZINC000450522626	EF	On-Demand	Anodyne	PREP	53	41
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2nncs2)C1	ZINC000450522627	EF	On-Demand	Anodyne	PREP	53	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	CHRM1	20	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	DRD4	18	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	OPRK1	24	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	CHRM3	20	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	SIGMAR1	29	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	CCR3	22	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	CCR5	35	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	C3AR1	42	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	EPHX2	42	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	MCHR1	17	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	BIRC2	50	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	BIRC8	40	31
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	NMUR2	0	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522633	FG	On-Demand	Anodyne	NMUR1	0	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	CHRM1	20	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	DRD4	18	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	OPRK1	24	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	CHRM3	20	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	SIGMAR1	29	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	CCR3	22	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	CCR5	35	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	C3AR1	42	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	EPHX2	42	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	MCHR1	17	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	BIRC2	50	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	BIRC8	40	31
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	NMUR2	0	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522634	FG	On-Demand	Anodyne	NMUR1	0	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	CHRM1	20	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	DRD4	18	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	OPRK1	24	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	CHRM3	20	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	SIGMAR1	29	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	CCR3	22	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	CCR5	35	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	C3AR1	42	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	EPHX2	42	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	MCHR1	17	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	BIRC2	50	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	BIRC8	40	31
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	NMUR2	0	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522635	FG	On-Demand	Anodyne	NMUR1	0	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	CHRM1	20	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	DRD4	18	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	OPRK1	24	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	CHRM3	20	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	SIGMAR1	29	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	CCR3	22	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	CCR5	35	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	C3AR1	42	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	EPHX2	42	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	MCHR1	17	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	BIRC2	50	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	BIRC8	40	31
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	NMUR2	0	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000450522636	FG	On-Demand	Anodyne	NMUR1	0	43
CN(C)S(=O)(=O)CC(=O)N[C@H](CCC(=O)O)Cc1ccccc1	ZINC000450522637	EC	On-Demand	Anodyne	MME	67	47
CN(C)S(=O)(=O)CC(=O)N[C@H](CCC(=O)O)Cc1ccccc1	ZINC000450522637	EC	On-Demand	Anodyne	NAALAD2	39	44
CN(C)S(=O)(=O)CC(=O)N[C@H](CCC(=O)O)Cc1ccccc1	ZINC000450522637	EC	On-Demand	Anodyne	CCKBR	22	41
CN(C)S(=O)(=O)CC(=O)N[C@H](CCC(=O)O)Cc1ccccc1	ZINC000450522637	EC	On-Demand	Anodyne	CAPN1	47	35
CN(C)S(=O)(=O)CC(=O)N[C@H](CCC(=O)O)Cc1ccccc1	ZINC000450522637	EC	On-Demand	Anodyne	CAPN2	46	33
CN(C)S(=O)(=O)CC(=O)N[C@H](CCC(=O)O)Cc1ccccc1	ZINC000450522637	EC	On-Demand	Anodyne	ACE2	41	33
CN(C)S(=O)(=O)CC(=O)N[C@H](CCC(=O)O)Cc1ccccc1	ZINC000450522637	EC	On-Demand	Anodyne	CPA3	0	43
CN(C)S(=O)(=O)CC(=O)N[C@@H](CCC(=O)O)Cc1ccccc1	ZINC000450522638	EC	On-Demand	Anodyne	MME	67	47
CN(C)S(=O)(=O)CC(=O)N[C@@H](CCC(=O)O)Cc1ccccc1	ZINC000450522638	EC	On-Demand	Anodyne	NAALAD2	39	44
CN(C)S(=O)(=O)CC(=O)N[C@@H](CCC(=O)O)Cc1ccccc1	ZINC000450522638	EC	On-Demand	Anodyne	CCKBR	22	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](CCC(=O)O)Cc1ccccc1	ZINC000450522638	EC	On-Demand	Anodyne	CAPN1	47	35
CN(C)S(=O)(=O)CC(=O)N[C@@H](CCC(=O)O)Cc1ccccc1	ZINC000450522638	EC	On-Demand	Anodyne	CAPN2	46	33
CN(C)S(=O)(=O)CC(=O)N[C@@H](CCC(=O)O)Cc1ccccc1	ZINC000450522638	EC	On-Demand	Anodyne	ACE2	41	33
CN(C)S(=O)(=O)CC(=O)N[C@@H](CCC(=O)O)Cc1ccccc1	ZINC000450522638	EC	On-Demand	Anodyne	CPA3	0	43
CC[C@@H]1CCC[C@H]1C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450522645	DH	On-Demand	Anodyne	P2RX7	21	46
CC[C@H]1CCC[C@H]1C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450522646	DH	On-Demand	Anodyne	P2RX7	21	46
CC[C@@H]1CCC[C@@H]1C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450522647	DH	On-Demand	Anodyne	P2RX7	25	46
CC[C@H]1CCC[C@@H]1C(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450522648	DH	On-Demand	Anodyne	P2RX7	21	46
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	DRD4	22	43
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	OPRK1	20	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	PPARD	24	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	CCR2	105	52
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	SLC6A5	41	36
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	EPHX2	18	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	MCHR1	35	46
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	CACNA1G	33	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450522655	GH	On-Demand	Anodyne	LIPG	46	34
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	DRD4	22	43
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	OPRK1	20	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	PPARD	24	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	CCR2	105	52
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	SLC6A5	41	36
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	EPHX2	18	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	MCHR1	35	46
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	CACNA1G	33	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450522656	GH	On-Demand	Anodyne	LIPG	46	34
CCOC(=O)c1cnn(C2CCN(c3nccc4c(OC)cccc34)CC2)c1C	ZINC000450522673	GH	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)c1cc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)on1	ZINC000450522674	FD	On-Demand	Anodyne	MCHR1	18	42
CCOC(=O)c1cc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)on1	ZINC000450522675	FD	On-Demand	Anodyne	MCHR1	18	42
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(Br)cc1C#N	ZINC000450522678	EC	On-Demand	Mild	CTRB_BOVIN	58	38
CCOC(=O)[C@H](CO)NC(=O)c1ccc(Br)cc1C#N	ZINC000450522679	EC	On-Demand	Mild	CTRB_BOVIN	58	38
COc1cc(CC(=O)N[C@@H](CCO)c2ccccc2Br)ccc1O	ZINC000450522690	GF	On-Demand	Anodyne	ABCC8	20	42
COc1cc(CC(=O)N[C@@H](CCO)c2ccccc2Br)ccc1O	ZINC000450522690	GF	On-Demand	Anodyne	TRPV1	35	44
COc1cc(CC(=O)N[C@@H](CCO)c2ccccc2Br)ccc1O	ZINC000450522690	GF	On-Demand	Anodyne	NCE103	29	40
COc1cc(CC(=O)N[C@@H](CCO)c2ccccc2Br)ccc1O	ZINC000450522690	GF	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@H](CCO)c2ccccc2Br)ccc1O	ZINC000450522691	GF	On-Demand	Anodyne	ABCC8	20	42
COc1cc(CC(=O)N[C@H](CCO)c2ccccc2Br)ccc1O	ZINC000450522691	GF	On-Demand	Anodyne	TRPV1	35	44
COc1cc(CC(=O)N[C@H](CCO)c2ccccc2Br)ccc1O	ZINC000450522691	GF	On-Demand	Anodyne	NCE103	29	40
COc1cc(CC(=O)N[C@H](CCO)c2ccccc2Br)ccc1O	ZINC000450522691	GF	On-Demand	Anodyne	CAN2	0	40
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1	ZINC000450522695	FF	On-Demand	Anodyne	P2RX7	40	39
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1	ZINC000450522695	FF	On-Demand	Anodyne	ACKR3	50	32
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1	ZINC000450522696	FF	On-Demand	Anodyne	P2RX7	40	39
Cc1ccc(F)c(CC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1	ZINC000450522696	FF	On-Demand	Anodyne	ACKR3	50	32
CC(C)OC(C)(C)C(=O)N[C@@H]1CN(c2ccccc2)C1=O	ZINC000450522712	CD	On-Demand	Anodyne	BIRC2	41	30
CC(C)OC(C)(C)C(=O)N[C@H]1CN(c2ccccc2)C1=O	ZINC000450522713	CD	On-Demand	Anodyne	BIRC2	41	30
O=C(NC1CCCCC1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450522715	DH	On-Demand	Anodyne	SIGMAR1	18	47
O=C(NC1CCCCC1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450522715	DH	On-Demand	Anodyne	EPHX2	38	42
O=C(NC1CCCCC1)NC1CCN(CC2=CCCCC2)CC1	ZINC000450522715	DH	On-Demand	Anodyne	CXCR3	25	70
CO[C@H]1C[C@@H](CN2CCCC2)N(c2ncnc3cc(Br)ccc23)C1	ZINC000450522731	GG	On-Demand	Anodyne	PDE3A	43	34
CO[C@H]1C[C@@H](CN2CCCC2)N(c2ncnc3cc(Br)ccc23)C1	ZINC000450522731	GG	On-Demand	Anodyne	PDE3B	63	34
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	DRD2	42	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	DRD4	64	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	ACHE	25	42
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	OPRM1	27	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	DRD3	41	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	OPRK1	37	47
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	HTR3A	0	43
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	KCNH2	15	42
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	HTR4	69	42
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	TACR1	26	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	HCRTR1	21	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	SIGMAR1	37	50
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	SSTR5	59	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	P2RX7	55	39
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	CCR3	58	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	CCR5	20	42
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	CCR2	20	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	HCRTR2	18	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	MCHR1	42	46
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	CACNA1I	49	36
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	CCR8	26	40
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)ccc1Cl	ZINC000450522734	GF	On-Demand	Anodyne	MBTPS1	56	37
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	DRD2	42	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	DRD4	64	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	ACHE	25	42
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	OPRM1	27	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	DRD3	41	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	OPRK1	37	47
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	HTR3A	0	43
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	KCNH2	15	42
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	HTR4	69	42
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	TACR1	26	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	HCRTR1	21	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	SIGMAR1	37	50
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	SSTR5	59	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	P2RX7	55	39
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	CCR3	58	45
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	CCR5	20	42
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	CCR2	20	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	HCRTR2	18	41
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	MCHR1	42	46
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	CACNA1I	49	36
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	CCR8	26	40
COc1cc(CC(=O)NCc2ccccc2CN2CC[C@H](O)C2)ccc1Cl	ZINC000450522735	GF	On-Demand	Anodyne	MBTPS1	56	37
OC[C@@H](CN1CCCCC1)Nc1ncnc2cc(Cl)ccc12	ZINC000450522738	DF	On-Demand	Anodyne	HRP1_PLAFA	62	35
OC[C@@H](CN1CCCCC1)Nc1ncnc2cc(Cl)ccc12	ZINC000450522738	DF	On-Demand	Anodyne	HNMT	61	43
OC[C@H](CN1CCCCC1)Nc1ncnc2cc(Cl)ccc12	ZINC000450522739	DF	On-Demand	Anodyne	HRP1_PLAFA	62	35
OC[C@H](CN1CCCCC1)Nc1ncnc2cc(Cl)ccc12	ZINC000450522739	DF	On-Demand	Anodyne	HNMT	61	43
COCC1(C(=O)O)CCN(C(=O)c2cc3c(OC)ccc(F)c3[nH]2)CC1	ZINC000450522751	FE	On-Demand	Anodyne	HRH4	24	53
COCC1(C(=O)O)CCN(C(=O)c2cc3c(OC)ccc(F)c3[nH]2)CC1	ZINC000450522751	FE	On-Demand	Anodyne	ENPP1	58	30
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522756	GH	On-Demand	Anodyne	TSHR	42	32
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522756	GH	On-Demand	Anodyne	PDE4A	38	45
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522756	GH	On-Demand	Anodyne	PDE4B	20	45
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522756	GH	On-Demand	Anodyne	PDE4D	25	45
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522756	GH	On-Demand	Anodyne	PDE4C	15	45
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522756	GH	On-Demand	Anodyne	LUCI_LUCLA	15	41
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522756	GH	On-Demand	Anodyne	AKR1C2	47	36
COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)c(OC2CCCC2)c1	ZINC000450522756	GH	On-Demand	Anodyne	KCNK3	41	35
COC(=O)c1ccc(CC(=O)N[C@@H](CN2CCCC2)c2ccc(OC)cc2)cc1	ZINC000450522773	GF	On-Demand	Anodyne	OPRK1	24	52
COC(=O)c1ccc(CC(=O)N[C@H](CN2CCCC2)c2ccc(OC)cc2)cc1	ZINC000450522774	GF	On-Demand	Anodyne	OPRK1	24	52
COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450522779	FG	On-Demand	Anodyne	OPRK1	25	48
COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450522780	FG	On-Demand	Anodyne	OPRK1	25	48
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)c1	ZINC000450522787	GG	On-Demand	Anodyne	HDAC1	0	40
CC(C)(C#N)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450522788	EG	On-Demand	Mild	AVPR1B	40	41
CC(C)(C#N)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450522788	EG	On-Demand	Mild	PDE6D	65	41
CC(C)(C#N)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450522788	EG	On-Demand	Mild	HDAC8	29	42
CC(C)(C#N)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450522788	EG	On-Demand	Mild	HDAC6	21	42
CC(C)(C#N)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450522788	EG	On-Demand	Mild	IMDH_CRYPV	36	55
CN(C)S(=O)(=O)NCCNc1ncnc2cc(Br)ccc12	ZINC000450522789	FC	On-Demand	Anodyne	EGFR	71	37
C=CCOc1ccc(CC(=O)N[C@@H]2COc3cc(OC)ccc3C2)cc1	ZINC000450522792	FF	On-Demand	Mild	MTNR1A	21	40
C=CCOc1ccc(CC(=O)N[C@H]2COc3cc(OC)ccc3C2)cc1	ZINC000450522793	FF	On-Demand	Mild	MTNR1A	21	40
O=C(Cc1ccc(Cl)c(F)c1)N[C@H]1CCCCC[C@H]1C(=O)O	ZINC000450522802	EG	On-Demand	Anodyne	SSTR3	22	44
O=C(Cc1ccc(Cl)c(F)c1)N[C@H]1CCCCC[C@H]1C(=O)O	ZINC000450522802	EG	On-Demand	Anodyne	ENV	44	34
C[C@@H]1CN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)CC[C@H]1C(=O)O	ZINC000450522813	FG	On-Demand	Anodyne	LIPG	51	34
C[C@H]1CN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)CC[C@@H]1C(=O)O	ZINC000450522814	FG	On-Demand	Anodyne	LIPG	51	34
C[C@@H]1CN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)CC[C@@H]1C(=O)O	ZINC000450522815	FG	On-Demand	Anodyne	LIPG	51	34
C[C@H]1CN(C(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)CC[C@H]1C(=O)O	ZINC000450522816	FG	On-Demand	Anodyne	LIPG	51	34
CC(C)(CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C(F)(F)F	ZINC000450522817	FI	On-Demand	Anodyne	TPH1	46	34
CC(C)(CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C(F)(F)F	ZINC000450522817	FI	On-Demand	Anodyne	UTS2	34	41
CC(C)(CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C(F)(F)F	ZINC000450522817	FI	On-Demand	Anodyne	CTSA	41	35
Cc1cc2c(Br)ccnc2cc1N1CC[C@@H](COC(F)F)C1	ZINC000450522822	FI	On-Demand	Anodyne	PDE3B	46	32
Cc1cc2c(Br)ccnc2cc1N1CC[C@H](COC(F)F)C1	ZINC000450522823	FI	On-Demand	Anodyne	PDE3B	46	32
CCc1ccccc1CC(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450522825	DF	On-Demand	Anodyne	ACE2	54	33
CCc1ccccc1CC(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450522826	DF	On-Demand	Anodyne	ACE2	54	33
CC(C)c1nnc(N2CCC(Oc3ccc(C#N)cc3F)CC2)o1	ZINC000450522833	EG	On-Demand	Mild	DCK	29	44
CC(C)c1nnc(N2CCC(Oc3ccc(C#N)cc3F)CC2)o1	ZINC000450522833	EG	On-Demand	Mild	SCD1	30	43
C[C@@](CNC(=O)C1(Cc2ccccc2F)CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450522835	FG	On-Demand	Anodyne	CACNA1G	28	41
C[C@](CNC(=O)C1(Cc2ccccc2F)CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450522836	FG	On-Demand	Anodyne	CACNA1G	28	41
CC(C)(C#N)CNC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450522837	EE	On-Demand	Mild	TRPV4	41	31
CC(=O)c1nc(N2CC[C@@H](COC(F)F)C2)sc1C	ZINC000450522852	CF	On-Demand	Anodyne	GYRB	0	41
CC(=O)c1nc(N2CC[C@@H](COC(F)F)C2)sc1C	ZINC000450522852	CF	On-Demand	Anodyne	PARE	44	34
CC(=O)c1nc(N2CC[C@H](COC(F)F)C2)sc1C	ZINC000450522853	CF	On-Demand	Anodyne	GYRB	0	41
CC(=O)c1nc(N2CC[C@H](COC(F)F)C2)sc1C	ZINC000450522853	CF	On-Demand	Anodyne	PARE	44	34
COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2cn(C)nc2C)cc1	ZINC000450522880	FE	On-Demand	Anodyne	OPRK1	18	44
COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2cn(C)nc2C)cc1	ZINC000450522881	FE	On-Demand	Anodyne	OPRK1	18	44
CCOC(=O)c1csc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450522884	FG	On-Demand	Anodyne	SIGMAR1	17	41
CCOC(=O)c1csc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450522884	FG	On-Demand	Anodyne	NPFFR1	41	33
CCOC(=O)c1csc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450522885	FG	On-Demand	Anodyne	SIGMAR1	17	41
CCOC(=O)c1csc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450522885	FG	On-Demand	Anodyne	NPFFR1	41	33
CCc1cc(N2CCC(Oc3ccc(C#N)cc3F)CC2)ccn1	ZINC000450522886	EH	On-Demand	Mild	DCK	47	44
COc1ccc2c(c1)OC[C@H](NC(=O)c1c(C)cccc1Cl)C2	ZINC000450522892	EG	On-Demand	Anodyne	DRD4	44	36
COc1ccc2c(c1)OC[C@@H](NC(=O)c1c(C)cccc1Cl)C2	ZINC000450522893	EG	On-Demand	Anodyne	DRD4	44	36
C[C@H](OCCc1ccccc1)C(=O)Nc1cc(C2CCCC2)nn1C	ZINC000450522895	EH	On-Demand	Anodyne	ACE	49	39
C[C@H](OCCc1ccccc1)C(=O)Nc1cc(C2CCCC2)nn1C	ZINC000450522895	EH	On-Demand	Anodyne	AMY2	43	30
C[C@@H](OCCc1ccccc1)C(=O)Nc1cc(C2CCCC2)nn1C	ZINC000450522896	EH	On-Demand	Anodyne	ACE	49	39
C[C@@H](OCCc1ccccc1)C(=O)Nc1cc(C2CCCC2)nn1C	ZINC000450522896	EH	On-Demand	Anodyne	AMY2	43	30
COc1ccc(-c2ccnc(N[C@H](C)C3(S(C)(=O)=O)CC3)n2)cc1	ZINC000450522907	EF	On-Demand	Anodyne	IKBKB	28	52
COc1ccc(-c2ccnc(N[C@H](C)C3(S(C)(=O)=O)CC3)n2)cc1	ZINC000450522907	EF	On-Demand	Anodyne	SMG1	56	31
COc1ccc(-c2ccnc(N[C@@H](C)C3(S(C)(=O)=O)CC3)n2)cc1	ZINC000450522908	EF	On-Demand	Anodyne	IKBKB	28	52
COc1ccc(-c2ccnc(N[C@@H](C)C3(S(C)(=O)=O)CC3)n2)cc1	ZINC000450522908	EF	On-Demand	Anodyne	SMG1	56	31
CSc1ccc2ncnc(NCCOCCS(N)(=O)=O)c2c1	ZINC000450522909	EC	On-Demand	Anodyne	CLK4	43	32
CSc1ccc2ncnc(NCCOCCS(N)(=O)=O)c2c1	ZINC000450522909	EC	On-Demand	Anodyne	CD38	27	41
CCCOc1ccc(C(=O)Nc2cc(C(=O)OCC)cnc2C)c(OC)c1	ZINC000450522923	FH	On-Demand	Anodyne	LUCI_LUCLA	17	46
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(S(=O)(=O)CCCOC)cc1	ZINC000450522943	GG	On-Demand	Anodyne	CA7	15	45
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(S(=O)(=O)CCCOC)cc1	ZINC000450522944	GG	On-Demand	Anodyne	CA7	15	45
CC(C)CN(Cc1cccc(S(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000450522954	EH	On-Demand	Mild	RORC	18	41
CC(C)CN(Cc1cccc(S(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000450522954	EH	On-Demand	Mild	RORB	0	41
CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1COc2cc(OC)ccc2C1	ZINC000450522958	DF	On-Demand	Anodyne	MTNR1A	25	40
CC[C@@H]1CCC[C@H]1C(=O)N[C@@H]1COc2cc(OC)ccc2C1	ZINC000450522959	DF	On-Demand	Anodyne	MTNR1A	25	40
CC[C@@H]1CCC[C@H]1C(=O)N[C@H]1COc2cc(OC)ccc2C1	ZINC000450522960	DF	On-Demand	Anodyne	MTNR1A	25	40
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H]1COc2cc(OC)ccc2C1	ZINC000450522961	DF	On-Demand	Anodyne	MTNR1A	25	40
CC(C)(C)NC(=O)N1CCC(NC(=O)[C@H](O)C2CCC2)CC1	ZINC000450522969	DD	On-Demand	Anodyne	EPHX2	19	42
CC(C)(C)NC(=O)N1CCC(NC(=O)[C@@H](O)C2CCC2)CC1	ZINC000450522970	DD	On-Demand	Anodyne	EPHX2	19	42
CC[C@@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCCOC)cc1	ZINC000450522972	FH	On-Demand	Anodyne	MME	0	51
CC[C@@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCCOC)cc1	ZINC000450522972	FH	On-Demand	Anodyne	CA7	17	63
CC[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCCOC)cc1	ZINC000450522973	FH	On-Demand	Anodyne	MME	0	51
CC[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCCOC)cc1	ZINC000450522973	FH	On-Demand	Anodyne	CA7	17	63
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(C(F)(F)F)[nH]2)CC1	ZINC000450522981	FF	On-Demand	Anodyne	SFRP1	59	33
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(C(F)(F)F)[nH]2)CC1	ZINC000450522981	FF	On-Demand	Anodyne	WNT3	59	33
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522983	GH	On-Demand	Anodyne	CTSL	18	44
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522983	GH	On-Demand	Anodyne	MMP2	50	31
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522983	GH	On-Demand	Anodyne	REN	74	38
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522983	GH	On-Demand	Anodyne	CTSS	48	44
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522983	GH	On-Demand	Anodyne	PGA5	48	34
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522984	GH	On-Demand	Anodyne	CTSL	18	44
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522984	GH	On-Demand	Anodyne	MMP2	50	31
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522984	GH	On-Demand	Anodyne	REN	74	38
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522984	GH	On-Demand	Anodyne	CTSS	48	44
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1ccccc1COC1CCOCC1	ZINC000450522984	GH	On-Demand	Anodyne	PGA5	48	34
COc1cccc(C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1[N+](=O)[O-]	ZINC000450522998	FF	On-Demand	Bother	F2RL1	27	41
COc1cccc(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1[N+](=O)[O-]	ZINC000450522999	FF	On-Demand	Bother	F2RL1	27	41
C/C=C\COc1cccc(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450523000	GG	On-Demand	Anodyne	CCR8	20	42
C[C@@H](Nc1ccnc2cc(F)c(Cl)cc12)C1(S(C)(=O)=O)CC1	ZINC000450523001	EG	On-Demand	Anodyne	HRP1_PLAFA	41	31
C[C@H](Nc1ccnc2cc(F)c(Cl)cc12)C1(S(C)(=O)=O)CC1	ZINC000450523002	EG	On-Demand	Anodyne	HRP1_PLAFA	41	31
COCCCS(=O)(=O)c1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450523023	GG	On-Demand	Anodyne	CPT1A	49	35
COCCCS(=O)(=O)c1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450523023	GG	On-Demand	Anodyne	E1	0	43
COCCCS(=O)(=O)c1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450523023	GG	On-Demand	Anodyne	KCNK3	79	36
COCCCS(=O)(=O)c1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450523023	GG	On-Demand	Anodyne	KCNK9	45	35
CCc1c(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)oc2ccccc12	ZINC000450523024	FH	On-Demand	Anodyne	CCR8	66	37
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cn(CC3CC3)nn2)cc1	ZINC000450523033	FE	On-Demand	Anodyne	OPRK1	17	42
COc1ccc([C@H](CN2CCCC2)NC(=O)c2cn(CC3CC3)nn2)cc1	ZINC000450523034	FE	On-Demand	Anodyne	OPRK1	17	42
CC(C)N1CCN(c2cccc(NC(=O)[C@H](O)C3CCC3)c2)CC1	ZINC000450523045	EE	On-Demand	Anodyne	PRNP	45	43
CC(C)N1CCN(c2cccc(NC(=O)[C@@H](O)C3CCC3)c2)CC1	ZINC000450523046	EE	On-Demand	Anodyne	PRNP	45	43
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)c1	ZINC000450523049	GF	On-Demand	Anodyne	P2RY12	30	41
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)c1	ZINC000450523049	GF	On-Demand	Anodyne	GCK	25	42
COc1ccc2c(c1)OC[C@H](NC(=O)Cc1sccc1Br)C2	ZINC000450523058	GG	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc2c(c1)OC[C@@H](NC(=O)Cc1sccc1Br)C2	ZINC000450523059	GG	On-Demand	Anodyne	MTNR1A	15	45
Cn1nc(-c2ccccc2)cc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523065	GF	On-Demand	Anodyne	INHA	55	33
Cn1nc(-c2ccccc2)cc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523065	GF	On-Demand	Anodyne	SFRP1	89	38
Cn1nc(-c2ccccc2)cc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523065	GF	On-Demand	Anodyne	WNT3	72	38
Cn1nc(-c2ccccc2)cc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523065	GF	On-Demand	Anodyne	HPGDS	31	40
CCOC(=O)c1cnc(C)c(NC(=O)c2cccc(C(F)(F)F)n2)c1	ZINC000450523096	FG	On-Demand	Anodyne	P2RY12	43	39
CCOC(=O)c1cnc(C)c(NC(=O)c2cccc(C(F)(F)F)n2)c1	ZINC000450523096	FG	On-Demand	Anodyne	ATF1	34	43
CCOC(=O)c1cnc(C)c(NC(=O)c2cccc(C(F)(F)F)n2)c1	ZINC000450523096	FG	On-Demand	Anodyne	NFKB1	32	43
CCOC(=O)c1cnc(C)c(NC(=O)c2cccc(C(F)(F)F)n2)c1	ZINC000450523096	FG	On-Demand	Anodyne	SCN10A	22	40
COc1ccc2c(c1)OC[C@@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)C2	ZINC000450523101	GG	On-Demand	Anodyne	MTNR1A	41	48
COc1ccc2c(c1)OC[C@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)C2	ZINC000450523102	GG	On-Demand	Anodyne	MTNR1A	41	48
O=C(O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450523112	EF	On-Demand	Anodyne	OPRM1	0	44
O=C(O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450523112	EF	On-Demand	Anodyne	OPRK1	38	43
O=C(O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450523113	EF	On-Demand	Anodyne	OPRM1	0	44
O=C(O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450523113	EF	On-Demand	Anodyne	OPRK1	38	43
O=C(O)[C@@H]1[C@@H]2CCC[C@H]2CN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450523114	EF	On-Demand	Anodyne	OPRM1	0	44
O=C(O)[C@@H]1[C@@H]2CCC[C@H]2CN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450523114	EF	On-Demand	Anodyne	OPRK1	38	43
O=C(O)[C@@H]1[C@H]2CCC[C@@H]2CN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450523115	EF	On-Demand	Anodyne	OPRM1	0	44
O=C(O)[C@@H]1[C@H]2CCC[C@@H]2CN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450523115	EF	On-Demand	Anodyne	OPRK1	38	43
COCCCS(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450523117	GG	On-Demand	Anodyne	TRPV1	18	40
COCCCS(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450523117	GG	On-Demand	Anodyne	CXCR2	0	42
COCCCS(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450523117	GG	On-Demand	Anodyne	P4HTM	0	44
COCCCS(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450523117	GG	On-Demand	Anodyne	CYNT	23	42
COc1ccc(C(=O)NCCOCC(=O)O)c(OC2CCCC2)c1	ZINC000450523124	ED	On-Demand	Anodyne	PDE4B	15	43
COc1ccc(C(=O)NCCOCC(=O)O)c(OC2CCCC2)c1	ZINC000450523124	ED	On-Demand	Anodyne	PDE4D	18	43
O=C(CCCc1cc(F)ccc1F)N[C@H](CC(F)(F)F)C(=O)O	ZINC000450523129	EF	On-Demand	Anodyne	NOD1	45	31
O=C(CCCc1cc(F)ccc1F)N[C@@H](CC(F)(F)F)C(=O)O	ZINC000450523130	EF	On-Demand	Anodyne	NOD1	45	31
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450523131	EE	On-Demand	Anodyne	TRPV1	26	46
COc1ccc2c(c1)OC[C@@H](NC(=O)C1CC(C)(O)C1)C2	ZINC000450523134	CD	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc2c(c1)OC[C@@H](NC(=O)C1CC(C)(O)C1)C2	ZINC000450523134	CD	On-Demand	Anodyne	MT-ND4	51	31
COc1ccc2c(c1)OC[C@H](NC(=O)C1CC(C)(O)C1)C2	ZINC000450523135	CD	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc2c(c1)OC[C@H](NC(=O)C1CC(C)(O)C1)C2	ZINC000450523135	CD	On-Demand	Anodyne	MT-ND4	51	31
CCOC(CNC(=O)c1cncc(Cl)c1)CNC(=O)c1cncc(Cl)c1	ZINC000450523138	GE	On-Demand	Anodyne	SCN2A	15	40
CCOC(CNC(=O)c1cncc(Cl)c1)CNC(=O)c1cncc(Cl)c1	ZINC000450523138	GE	On-Demand	Anodyne	SCN10A	42	40
Cc1ccc(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)c(Cl)c1Cl	ZINC000450523139	GI	On-Demand	Anodyne	CCR8	49	37
COc1cccc(CCC(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)c1F	ZINC000450523143	GG	On-Demand	Anodyne	CACNA1G	27	40
COc1cccc(CCC(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)c1F	ZINC000450523144	GG	On-Demand	Anodyne	CACNA1G	27	40
C[C@@H](C(=O)N[C@@H](C(=O)O)c1ccc(Cl)cc1Cl)C1CC1	ZINC000450523145	DG	On-Demand	Anodyne	SDH1	0	43
C[C@H](C(=O)N[C@@H](C(=O)O)c1ccc(Cl)cc1Cl)C1CC1	ZINC000450523146	DG	On-Demand	Anodyne	SDH1	0	43
C[C@@H](C(=O)N[C@H](C(=O)O)c1ccc(Cl)cc1Cl)C1CC1	ZINC000450523147	DG	On-Demand	Anodyne	SDH1	0	43
C[C@H](C(=O)N[C@H](C(=O)O)c1ccc(Cl)cc1Cl)C1CC1	ZINC000450523148	DG	On-Demand	Anodyne	SDH1	0	43
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(Nc1nccc(-c3cnccn3)n1)C2	ZINC000450523159	FD	On-Demand	Anodyne	MAPK1	53	33
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	DRD4	43	33
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	HRH2	29	44
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	OPRK1	28	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	AVPR1B	46	44
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	LTA4H	16	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	HRH3	31	48
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	ACOX1	45	35
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	MTNR1A	64	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	MTNR1B	60	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	ABCB1	26	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523168	GG	On-Demand	Anodyne	GPR88	0	46
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	DRD4	43	33
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	HRH2	29	44
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	OPRK1	28	42
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	AVPR1B	46	44
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	LTA4H	16	42
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	HRH3	31	48
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	ACOX1	45	35
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	MTNR1A	64	42
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	MTNR1B	60	42
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	ABCB1	26	41
COc1ccc([C@H](CN2CCCC2)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450523169	GG	On-Demand	Anodyne	GPR88	0	46
CCc1ccccc1CC(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450523180	EG	On-Demand	Anodyne	ECR	24	40
CCc1ccccc1CC(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450523181	EG	On-Demand	Anodyne	ECR	24	40
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC(C)(C)C#N)cc2)c1	ZINC000450523184	EG	On-Demand	Mild	CTSB	20	41
COc1ccc(CN(CC[C@H](C)O)C2CCCCC2)cc1OC	ZINC000450523189	DH	On-Demand	Anodyne	CACNA1C	0	40
COc1ccc(CN(CC[C@@H](C)O)C2CCCCC2)cc1OC	ZINC000450523190	DH	On-Demand	Anodyne	CACNA1C	0	40
CS[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450523202	EH	On-Demand	Anodyne	UTS2	35	42
CS[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450523202	EH	On-Demand	Anodyne	GPR88	0	41
CS[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450523203	EH	On-Demand	Anodyne	UTS2	35	42
CS[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450523203	EH	On-Demand	Anodyne	GPR88	0	41
Cn1cc(-c2ccc(C(=O)Nc3cc(C4CCCC4)nn3C)o2)cn1	ZINC000450523213	EG	On-Demand	Anodyne	MMP13	0	45
CCOC1CC2(CCN(c3ncnc4cc(Br)ccc34)C2)C1	ZINC000450523214	FH	On-Demand	Anodyne	PDE3A	43	36
CCOC1CC2(CCN(c3ncnc4cc(Br)ccc34)C2)C1	ZINC000450523214	FH	On-Demand	Anodyne	PDE3B	64	36
CCOC(=O)c1cnc(C)c(NC(=O)[C@H](O)C2CCC2)c1	ZINC000450523217	CD	On-Demand	Anodyne	SCARB1	46	33
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H](O)C2CCC2)c1	ZINC000450523218	CD	On-Demand	Anodyne	SCARB1	46	33
C[C@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523224	GG	On-Demand	Anodyne	PPARG	25	49
C[C@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523224	GG	On-Demand	Anodyne	PPARA	22	49
C[C@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523224	GG	On-Demand	Anodyne	PPARD	22	49
C[C@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523224	GG	On-Demand	Anodyne	CACNA1G	31	41
C[C@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523224	GG	On-Demand	Anodyne	HAO2	29	44
C[C@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523224	GG	On-Demand	Anodyne	PDS	53	34
C[C@@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523225	GG	On-Demand	Anodyne	PPARG	25	49
C[C@@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523225	GG	On-Demand	Anodyne	PPARA	22	49
C[C@@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523225	GG	On-Demand	Anodyne	PPARD	22	49
C[C@@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523225	GG	On-Demand	Anodyne	CACNA1G	31	41
C[C@@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523225	GG	On-Demand	Anodyne	HAO2	29	44
C[C@@](CNC(=O)Cc1cccc(OC(F)(F)F)c1)(C(=O)O)c1ccc(F)cc1	ZINC000450523225	GG	On-Demand	Anodyne	PDS	53	34
COc1ccc2c(c1)OC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C2	ZINC000450523229	ED	On-Demand	Anodyne	MTNR1A	16	42
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C2	ZINC000450523230	ED	On-Demand	Anodyne	MTNR1A	16	42
COc1ccc(F)cc1CC(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450523232	FF	On-Demand	Anodyne	TRPV1	29	44
COc1ccc(F)cc1CC(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450523232	FF	On-Demand	Anodyne	PPARD	24	42
COc1ccc(F)cc1CC(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450523232	FF	On-Demand	Anodyne	MT-ND1	25	44
COc1ccc(F)cc1CC(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450523233	FF	On-Demand	Anodyne	TRPV1	29	44
COc1ccc(F)cc1CC(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450523233	FF	On-Demand	Anodyne	PPARD	24	42
COc1ccc(F)cc1CC(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450523233	FF	On-Demand	Anodyne	MT-ND1	25	44
CNc1nc(N2CCC(N(CCOC)CCOC)CC2)nc2ccccc12	ZINC000450523236	FD	On-Demand	Anodyne	HRH4	15	43
CNc1nc(N2CCC(N(CCOC)CCOC)CC2)nc2ccccc12	ZINC000450523236	FD	On-Demand	Anodyne	CCR4	17	43
COc1ccc(-c2ccnc(NCC3(C(F)(F)F)CC3)n2)cc1	ZINC000450523237	DH	On-Demand	Anodyne	CLK1	20	53
COc1ccc(-c2ccnc(NCC3(C(F)(F)F)CC3)n2)cc1	ZINC000450523237	DH	On-Demand	Anodyne	CLK4	32	53
COc1ccc(-c2ccnc(NCC3(C(F)(F)F)CC3)n2)cc1	ZINC000450523237	DH	On-Demand	Anodyne	DYRK1B	18	55
COc1ccc(CCCC(=O)N[C@H](C(=O)O)c2cccs2)c(OC)c1	ZINC000450523238	FG	On-Demand	Anodyne	MTNR1A	40	38
COc1ccc(CCCC(=O)N[C@H](C(=O)O)c2cccs2)c(OC)c1	ZINC000450523238	FG	On-Demand	Anodyne	HDA106	0	50
COc1ccc(CCCC(=O)N[C@@H](C(=O)O)c2cccs2)c(OC)c1	ZINC000450523239	FG	On-Demand	Anodyne	MTNR1A	40	38
COc1ccc(CCCC(=O)N[C@@H](C(=O)O)c2cccs2)c(OC)c1	ZINC000450523239	FG	On-Demand	Anodyne	HDA106	0	50
FC(F)OC[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450523241	FG	On-Demand	Anodyne	PDE3A	53	41
FC(F)OC[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450523241	FG	On-Demand	Anodyne	PDE3B	78	41
FC(F)OC[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450523242	FG	On-Demand	Anodyne	PDE3A	53	41
FC(F)OC[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450523242	FG	On-Demand	Anodyne	PDE3B	78	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450523245	FF	On-Demand	Anodyne	OPRK1	0	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450523245	FF	On-Demand	Anodyne	GPR88	0	51
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450523246	FF	On-Demand	Anodyne	OPRK1	0	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450523246	FF	On-Demand	Anodyne	GPR88	0	51
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450523247	FF	On-Demand	Anodyne	OPRK1	0	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450523247	FF	On-Demand	Anodyne	GPR88	0	51
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450523248	FF	On-Demand	Anodyne	OPRK1	0	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450523248	FF	On-Demand	Anodyne	GPR88	0	51
C[C@@H]1CN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)CC[C@@H]1C(=O)O	ZINC000450523249	FH	On-Demand	Anodyne	LIPG	48	34
C[C@@H]1CN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)CC[C@H]1C(=O)O	ZINC000450523250	FH	On-Demand	Anodyne	LIPG	48	34
C[C@H]1CN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)CC[C@H]1C(=O)O	ZINC000450523251	FH	On-Demand	Anodyne	LIPG	48	34
C[C@H]1CN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)CC[C@@H]1C(=O)O	ZINC000450523252	FH	On-Demand	Anodyne	LIPG	48	34
C[C@@H](OCc1ccc(F)cc1)C(=O)NCC(C)(C)C#N	ZINC000450523253	CE	On-Demand	Mild	PAPA1_CARPA	33	42
C[C@H](OCc1ccc(F)cc1)C(=O)NCC(C)(C)C#N	ZINC000450523254	CE	On-Demand	Mild	PAPA1_CARPA	33	42
C[C@](CC(=O)O)(NC(=O)Cc1cccc(OC(F)(F)F)c1)c1cccc(F)c1	ZINC000450523258	GH	On-Demand	Anodyne	PPARG	21	40
C[C@](CC(=O)O)(NC(=O)Cc1cccc(OC(F)(F)F)c1)c1cccc(F)c1	ZINC000450523258	GH	On-Demand	Anodyne	HAO2	21	44
C[C@](CC(=O)O)(NC(=O)Cc1cccc(OC(F)(F)F)c1)c1cccc(F)c1	ZINC000450523258	GH	On-Demand	Anodyne	PDS	43	36
C[C@@](CC(=O)O)(NC(=O)Cc1cccc(OC(F)(F)F)c1)c1cccc(F)c1	ZINC000450523259	GH	On-Demand	Anodyne	PPARG	21	40
C[C@@](CC(=O)O)(NC(=O)Cc1cccc(OC(F)(F)F)c1)c1cccc(F)c1	ZINC000450523259	GH	On-Demand	Anodyne	HAO2	21	44
C[C@@](CC(=O)O)(NC(=O)Cc1cccc(OC(F)(F)F)c1)c1cccc(F)c1	ZINC000450523259	GH	On-Demand	Anodyne	PDS	43	36
COc1ccc2c(c1)OC[C@H](NC(=O)c1ccc(C(C)(F)F)nc1)C2	ZINC000450523261	EF	On-Demand	Anodyne	HPGDS	31	43
COc1ccc2c(c1)OC[C@@H](NC(=O)c1ccc(C(C)(F)F)nc1)C2	ZINC000450523262	EF	On-Demand	Anodyne	HPGDS	31	43
O=C(O)C1(CNC(=O)C2(Oc3ccccc3F)CC2)CC1	ZINC000450523271	CD	On-Demand	Anodyne	CXCL8	17	41
N#Cc1ccc(OC2CCN(c3cccc(Cl)c3C#N)CC2)c(F)c1	ZINC000450523284	FI	On-Demand	Mild	DCK	38	40
O=C(O)COCCNC(=O)C1(Oc2ccccc2F)CC1	ZINC000450523287	CC	On-Demand	Anodyne	CXCL8	17	42
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccnc(OC(F)F)c2)CC1	ZINC000450523294	FE	On-Demand	Anodyne	SSTR5	42	35
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccnc(OC(F)F)c2)CC1	ZINC000450523294	FE	On-Demand	Anodyne	MAPK13	60	35
COC[C@@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450523311	DD	On-Demand	Anodyne	NOD1	47	33
COC[C@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450523312	DD	On-Demand	Anodyne	NOD1	47	33
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450523314	EE	On-Demand	Anodyne	P2RY12	34	41
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450523314	EE	On-Demand	Anodyne	HDAC1	28	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523330	GH	On-Demand	Anodyne	MAPK14	24	43
Cc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523330	GH	On-Demand	Anodyne	CACNA1B	42	37
Cc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523330	GH	On-Demand	Anodyne	CCR2	62	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523330	GH	On-Demand	Anodyne	SLC6A5	32	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523330	GH	On-Demand	Anodyne	EPHX2	37	46
Cc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523330	GH	On-Demand	Anodyne	CCR8	59	36
Cc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523330	GH	On-Demand	Anodyne	SFRP1	104	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523330	GH	On-Demand	Anodyne	WNT3	79	38
COCCCS(=O)(=O)c1ccc(NC(=O)c2cn3nccc3nc2C)cc1	ZINC000450523355	GE	On-Demand	Anodyne	DDR1	49	39
CC(C)c1cc(C(=O)N[C@H](CC(=O)O)c2ccc3ccccc3c2)no1	ZINC000450523377	FH	On-Demand	Anodyne	TPH1	40	37
CC(C)c1cc(C(=O)N[C@H](CC(=O)O)c2ccc3ccccc3c2)no1	ZINC000450523377	FH	On-Demand	Anodyne	UTS2	45	45
CC(C)c1cc(C(=O)N[C@H](CC(=O)O)c2ccc3ccccc3c2)no1	ZINC000450523377	FH	On-Demand	Anodyne	CTSA	83	37
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450523393	GF	On-Demand	Anodyne	CA2	19	40
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450523393	GF	On-Demand	Anodyne	MME	40	45
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450523393	GF	On-Demand	Anodyne	CA1	18	40
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450523393	GF	On-Demand	Anodyne	TIMP3	59	34
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450523393	GF	On-Demand	Anodyne	MMP2	36	43
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450523393	GF	On-Demand	Anodyne	PTPRB	29	42
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450523393	GF	On-Demand	Anodyne	MMP9	27	43
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450523393	GF	On-Demand	Anodyne	PLAU	44	38
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450523394	GF	On-Demand	Anodyne	CA2	19	40
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450523394	GF	On-Demand	Anodyne	MME	40	45
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450523394	GF	On-Demand	Anodyne	CA1	18	40
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450523394	GF	On-Demand	Anodyne	TIMP3	59	34
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450523394	GF	On-Demand	Anodyne	MMP2	36	43
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450523394	GF	On-Demand	Anodyne	PTPRB	29	42
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450523394	GF	On-Demand	Anodyne	MMP9	27	43
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450523394	GF	On-Demand	Anodyne	PLAU	44	38
COc1cc(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450523396	GF	On-Demand	Anodyne	DRD4	16	40
COc1cc(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450523396	GF	On-Demand	Anodyne	HTR4	54	42
COc1cc(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450523396	GF	On-Demand	Anodyne	SIGMAR1	17	47
COc1cc(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450523396	GF	On-Demand	Anodyne	EPHX2	28	40
COc1cc(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450523396	GF	On-Demand	Anodyne	MCHR1	23	42
COc1cc(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450523396	GF	On-Demand	Anodyne	CCR8	15	41
COc1cc(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450523396	GF	On-Demand	Anodyne	CAN2	0	41
COCCCS(=O)(=O)c1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450523401	EG	On-Demand	Anodyne	CA2	15	45
COCCCS(=O)(=O)c1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450523401	EG	On-Demand	Anodyne	CA7	15	41
COCCCS(=O)(=O)c1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450523401	EG	On-Demand	Anodyne	CA4	17	44
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450523403	GH	On-Demand	Anodyne	MAPK11	38	43
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450523403	GH	On-Demand	Anodyne	MAPK14	54	41
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450523403	GH	On-Demand	Anodyne	SSTR5	40	37
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450523403	GH	On-Demand	Anodyne	MAPK13	103	41
CCOC(=O)c1cnc(C)c(NC(=O)c2cc(OC)ccc2OC(F)(F)F)c1	ZINC000450523414	GH	On-Demand	Anodyne	SHH	45	33
COc1ccc(F)cc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523420	EF	On-Demand	Anodyne	CTSD	23	51
COc1ccc(F)cc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523420	EF	On-Demand	Anodyne	NTSR2	40	40
COc1ccc(F)cc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523420	EF	On-Demand	Anodyne	CTSS	40	41
COc1ccc(F)cc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523420	EF	On-Demand	Anodyne	F2RL1	30	48
COc1ccc(F)cc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523420	EF	On-Demand	Anodyne	METAP2	25	41
COc1ccc(F)cc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523421	EF	On-Demand	Anodyne	CTSD	23	51
COc1ccc(F)cc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523421	EF	On-Demand	Anodyne	NTSR2	40	40
COc1ccc(F)cc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523421	EF	On-Demand	Anodyne	CTSS	40	41
COc1ccc(F)cc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523421	EF	On-Demand	Anodyne	F2RL1	30	48
COc1ccc(F)cc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523421	EF	On-Demand	Anodyne	METAP2	25	41
CCC[C@H](C(=O)N[C@@H](C(=O)O)c1cccs1)C(C)C	ZINC000450523423	CG	On-Demand	Anodyne	MME	22	41
CCC[C@H](C(=O)N[C@H](C(=O)O)c1cccs1)C(C)C	ZINC000450523424	CG	On-Demand	Anodyne	MME	22	41
CCC[C@@H](C(=O)N[C@H](C(=O)O)c1cccs1)C(C)C	ZINC000450523425	CG	On-Demand	Anodyne	MME	22	41
CCC[C@@H](C(=O)N[C@@H](C(=O)O)c1cccs1)C(C)C	ZINC000450523426	CG	On-Demand	Anodyne	MME	22	41
N#Cc1ccc(N2C[C@H](C(=O)N3CCCO3)CC2=O)cc1Cl	ZINC000450523428	DD	On-Demand	Mild	NR3C2	15	40
N#Cc1ccc(N2C[C@@H](C(=O)N3CCCO3)CC2=O)cc1Cl	ZINC000450523429	DD	On-Demand	Mild	NR3C2	15	40
CCN(Cc1cn(C)nn1)C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450523430	GF	On-Demand	Anodyne	NAMPT	44	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCO1	ZINC000450523432	CF	On-Demand	Anodyne	CACNA1B	40	34
C[C@@H]1COCC[C@@H]1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450523434	DE	On-Demand	Anodyne	ADRA2A	18	55
C[C@@H]1COCC[C@H]1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450523435	DE	On-Demand	Anodyne	ADRA2A	18	55
C[C@H]1COCC[C@@H]1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450523436	DE	On-Demand	Anodyne	ADRA2A	18	55
C[C@H]1COCC[C@H]1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450523437	DE	On-Demand	Anodyne	ADRA2A	18	55
CCC(CC)Oc1ccc(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)cc1	ZINC000450523443	GH	On-Demand	Anodyne	SLC6A5	38	44
CCC(CC)Oc1ccc(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)cc1	ZINC000450523443	GH	On-Demand	Anodyne	EPHX2	39	43
CCC(CC)Oc1ccc(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)cc1	ZINC000450523443	GH	On-Demand	Anodyne	PLAU	21	44
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(C)nc2C)cc1	ZINC000450523449	FG	On-Demand	Anodyne	UTS2	30	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(C)nc2C)cc1	ZINC000450523450	FG	On-Demand	Anodyne	UTS2	30	41
COc1cc(Cl)c(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)cc1OC	ZINC000450523451	FH	On-Demand	Anodyne	HTR4	54	37
COc1cc(Cl)c(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)cc1OC	ZINC000450523451	FH	On-Demand	Anodyne	CTSS	32	43
COc1cc(Cl)c(C(=O)N[C@H](CC2CCCCC2)C(=O)O)cc1OC	ZINC000450523452	FH	On-Demand	Anodyne	HTR4	54	37
COc1cc(Cl)c(C(=O)N[C@H](CC2CCCCC2)C(=O)O)cc1OC	ZINC000450523452	FH	On-Demand	Anodyne	CTSS	32	43
COc1ccc2c(c1)OC[C@H](NC(=O)CC1(O)CCC1)C2	ZINC000450523456	CD	On-Demand	Anodyne	MTNR1A	27	40
COc1ccc2c(c1)OC[C@@H](NC(=O)CC1(O)CCC1)C2	ZINC000450523457	CD	On-Demand	Anodyne	MTNR1A	27	40
COc1ccc2c(c1)C[C@@H](C(=O)N[C@H](C(=O)O)c1cccs1)CO2	ZINC000450523472	EE	On-Demand	Anodyne	ROCK2	32	48
COc1ccc2c(c1)C[C@@H](C(=O)N[C@@H](C(=O)O)c1cccs1)CO2	ZINC000450523473	EE	On-Demand	Anodyne	ROCK2	32	48
COc1ccc2c(c1)C[C@H](C(=O)N[C@H](C(=O)O)c1cccs1)CO2	ZINC000450523474	EE	On-Demand	Anodyne	ROCK2	32	48
COc1ccc2c(c1)C[C@H](C(=O)N[C@@H](C(=O)O)c1cccs1)CO2	ZINC000450523475	EE	On-Demand	Anodyne	ROCK2	32	48
CCCCS(=O)(=O)c1ccc(C(=O)N[C@H](C(=O)O)c2cccs2)cc1	ZINC000450523490	GF	On-Demand	Anodyne	CA2	23	40
CCCCS(=O)(=O)c1ccc(C(=O)N[C@@H](C(=O)O)c2cccs2)cc1	ZINC000450523491	GF	On-Demand	Anodyne	CA2	23	40
CC(C)(C#N)CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450523500	CE	On-Demand	Mild	CACNA1G	34	40
CC(C)(C#N)CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450523501	CE	On-Demand	Mild	CACNA1G	34	40
COc1cc(C(=O)O)ccc1CCNC(=O)CS(=O)(=O)N(C)C	ZINC000450523504	EB	On-Demand	Anodyne	CYSLTR1	69	36
COc1cc(C(=O)O)ccc1CCNC(=O)CS(=O)(=O)N(C)C	ZINC000450523504	EB	On-Demand	Anodyne	MTNR1A	54	38
COc1cc(C(=O)O)ccc1CCNC(=O)CS(=O)(=O)N(C)C	ZINC000450523504	EB	On-Demand	Anodyne	MTNR1B	41	36
COc1ccc2c(c1)OC[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)C2	ZINC000450523516	FF	On-Demand	Anodyne	MTNR1A	42	40
COc1ccc2c(c1)OC[C@H](NC(=O)[C@H](C)OCCc1ccccc1)C2	ZINC000450523517	FF	On-Demand	Anodyne	MTNR1A	42	40
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)C2	ZINC000450523518	FF	On-Demand	Anodyne	MTNR1A	42	40
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)C2	ZINC000450523519	FF	On-Demand	Anodyne	MTNR1A	42	40
Cc1cc(C(=O)N[C@H](CC2CCCCC2)C(=O)O)nc(C(F)(F)F)n1	ZINC000450523520	FF	On-Demand	Anodyne	CTSS	27	41
Cc1cc(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)nc(C(F)(F)F)n1	ZINC000450523521	FF	On-Demand	Anodyne	CTSS	27	41
CC(C)(C#N)CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450523524	DF	On-Demand	Mild	PPXII	0	40
CCC1(C(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)CC1	ZINC000450523533	CE	On-Demand	Anodyne	CACNA1G	33	40
CCC1(C(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)CC1	ZINC000450523534	CE	On-Demand	Anodyne	CACNA1G	33	40
CCOC(=O)c1cnc(C)c(NC(=O)c2ccsc2C)c1	ZINC000450523542	DG	On-Demand	Anodyne	ATF1	25	40
CCOC(=O)c1cnc(C)c(NC(=O)c2ccsc2C)c1	ZINC000450523542	DG	On-Demand	Anodyne	NFKB1	23	40
COc1ccc(-c2noc(N3CCC(Oc4ccc(C#N)cc4F)CC3)n2)cc1	ZINC000450523543	GH	On-Demand	Mild	DCK	54	44
COc1cc(Cl)c(C(=O)N2CCC[C@H]2C(=O)O)cc1OC	ZINC000450523550	DE	On-Demand	Anodyne	ACE	42	40
COc1cc(Cl)c(C(=O)N2CCC[C@H]2C(=O)O)cc1OC	ZINC000450523550	DE	On-Demand	Anodyne	HTR4	63	38
COc1cc(Cl)c(C(=O)N2CCC[C@@H]2C(=O)O)cc1OC	ZINC000450523551	DE	On-Demand	Anodyne	ACE	42	40
COc1cc(Cl)c(C(=O)N2CCC[C@@H]2C(=O)O)cc1OC	ZINC000450523551	DE	On-Demand	Anodyne	HTR4	63	38
COCc1cc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)cc(C(=O)O)c1	ZINC000450523562	GI	On-Demand	Anodyne	TACR1	23	41
CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(F)c(Cl)cc13)C2	ZINC000450523573	GH	On-Demand	Anodyne	HRP1_PLAFA	98	36
CN(C)S(=O)(=O)NCCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450523583	GB	On-Demand	Bother	BDKRB1	0	46
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	ACE	47	47
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	MME	58	47
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	LTA4H	15	53
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	CTSD	42	37
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	PGC	60	34
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	CTSB	17	46
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	CTSL	24	46
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	CACNA1B	40	37
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	MMP2	77	38
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	MMP3	33	45
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	ECE1	41	36
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	REN	120	41
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	CTSS	47	46
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	CAPN1	25	41
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	CTSE	53	34
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	ACE2	68	47
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	PGA5	48	34
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	PROC	43	40
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	MMP1	21	45
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	FPR1	35	49
CS(=O)(=O)c1ccccc1CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450523595	FE	On-Demand	Anodyne	BLA1_STEMA	25	44
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	ACE	47	47
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	MME	58	47
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	LTA4H	15	53
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	CTSD	42	37
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	PGC	60	34
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	CTSB	17	46
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	CTSL	24	46
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	CACNA1B	40	37
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	MMP2	77	38
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	MMP3	33	45
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	ECE1	41	36
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	REN	120	41
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	CTSS	47	46
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	CAPN1	25	41
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	CTSE	53	34
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	ACE2	68	47
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	PGA5	48	34
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	PROC	43	40
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	MMP1	21	45
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	FPR1	35	49
CS(=O)(=O)c1ccccc1CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450523596	FE	On-Demand	Anodyne	BLA1_STEMA	25	44
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523602	GH	On-Demand	Anodyne	TACR2	25	43
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523602	GH	On-Demand	Anodyne	TACR3	60	45
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523602	GH	On-Demand	Anodyne	CYP2D6	0	40
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523602	GH	On-Demand	Anodyne	UTS2	50	41
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523602	GH	On-Demand	Anodyne	PSMB8	40	33
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523602	GH	On-Demand	Anodyne	GPR88	0	45
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523603	GH	On-Demand	Anodyne	TACR2	25	43
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523603	GH	On-Demand	Anodyne	TACR3	60	45
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523603	GH	On-Demand	Anodyne	CYP2D6	0	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523603	GH	On-Demand	Anodyne	UTS2	50	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523603	GH	On-Demand	Anodyne	PSMB8	40	33
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ocnc2-c2ccccc2)cc1	ZINC000450523603	GH	On-Demand	Anodyne	GPR88	0	45
COc1ccc2c(c1)OC[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450523615	GG	On-Demand	Bother	APOB	0	40
COc1ccc2c(c1)OC[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450523615	GG	On-Demand	Bother	MTTP	21	40
COc1ccc2c(c1)OC[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450523616	GG	On-Demand	Bother	APOB	0	40
COc1ccc2c(c1)OC[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450523616	GG	On-Demand	Bother	MTTP	21	40
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2cccs2)c1	ZINC000450523620	EG	On-Demand	Anodyne	UPP1	51	39
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2cccs2)c1	ZINC000450523620	EG	On-Demand	Anodyne	PLA2G4B	27	43
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2cccs2)c1	ZINC000450523620	EG	On-Demand	Anodyne	TSPAN17	0	43
CCCOc1cccc(CC(=O)N[C@H](C(=O)O)c2cccs2)c1	ZINC000450523620	EG	On-Demand	Anodyne	PDS	64	33
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2cccs2)c1	ZINC000450523621	EG	On-Demand	Anodyne	UPP1	51	39
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2cccs2)c1	ZINC000450523621	EG	On-Demand	Anodyne	PLA2G4B	27	43
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2cccs2)c1	ZINC000450523621	EG	On-Demand	Anodyne	TSPAN17	0	43
CCCOc1cccc(CC(=O)N[C@@H](C(=O)O)c2cccs2)c1	ZINC000450523621	EG	On-Demand	Anodyne	PDS	64	33
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@]2(CC[C@H](C)C2)C1	ZINC000450523625	DG	On-Demand	Anodyne	GHRHR	43	30
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@]2(CC[C@H](C)C2)C1	ZINC000450523625	DG	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@]2(CC[C@@H](C)C2)C1	ZINC000450523626	DG	On-Demand	Anodyne	GHRHR	43	30
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@]2(CC[C@@H](C)C2)C1	ZINC000450523626	DG	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@]2(CC[C@@H](C)C2)C1	ZINC000450523627	DG	On-Demand	Anodyne	GHRHR	43	30
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@]2(CC[C@@H](C)C2)C1	ZINC000450523627	DG	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@]2(CC[C@H](C)C2)C1	ZINC000450523628	DG	On-Demand	Anodyne	GHRHR	43	30
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@]2(CC[C@H](C)C2)C1	ZINC000450523628	DG	On-Demand	Anodyne	TIMP3	41	34
COc1ccc2c(c1)OC[C@H](NC(=O)[C@@H](O)C1CCC1)C2	ZINC000450523629	CD	On-Demand	Anodyne	MTNR1A	27	41
COc1ccc2c(c1)OC[C@H](NC(=O)[C@H](O)C1CCC1)C2	ZINC000450523630	CD	On-Demand	Anodyne	MTNR1A	27	41
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@H](O)C1CCC1)C2	ZINC000450523631	CD	On-Demand	Anodyne	MTNR1A	27	41
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@@H](O)C1CCC1)C2	ZINC000450523632	CD	On-Demand	Anodyne	MTNR1A	27	41
COc1cc(Cl)c(C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450523645	GG	On-Demand	Anodyne	HTR4	20	47
COc1cc(Cl)c(C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450523645	GG	On-Demand	Anodyne	MME	34	44
COc1cc(Cl)c(C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450523645	GG	On-Demand	Anodyne	CPA1	50	35
COc1cc(Cl)c(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450523646	GG	On-Demand	Anodyne	HTR4	20	47
COc1cc(Cl)c(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450523646	GG	On-Demand	Anodyne	MME	34	44
COc1cc(Cl)c(C(=O)N(C)[C@H](Cc2ccccc2)C(=O)O)cc1OC	ZINC000450523646	GG	On-Demand	Anodyne	CPA1	50	35
CCc1cccc(C(=O)N[C@@H]2COc3cc(OC)ccc3C2)n1	ZINC000450523659	DE	On-Demand	Anodyne	PDE5A	19	48
CCc1cccc(C(=O)N[C@H]2COc3cc(OC)ccc3C2)n1	ZINC000450523660	DE	On-Demand	Anodyne	PDE5A	19	48
COCCCS(=O)(=O)c1ccc(NC(=O)c2c(C)cccc2Cl)cc1	ZINC000450523666	GH	On-Demand	Anodyne	GRM4	29	41
COC[C@@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450523674	ED	On-Demand	Anodyne	AVPR1A	33	40
COC[C@@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450523674	ED	On-Demand	Anodyne	NPPA	43	33
COC[C@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450523675	ED	On-Demand	Anodyne	AVPR1A	33	40
COC[C@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450523675	ED	On-Demand	Anodyne	NPPA	43	33
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CC2)cc1OC	ZINC000450523683	DD	On-Demand	Anodyne	HTR4	47	36
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CC2)cc1OC	ZINC000450523683	DD	On-Demand	Anodyne	P2RX7	22	44
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CC2)cc1OC	ZINC000450523683	DD	On-Demand	Anodyne	KCNA3	43	43
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CC2)cc1OC	ZINC000450523683	DD	On-Demand	Anodyne	HCN1	56	38
COc1cc(Cl)c(C(=O)NCC2(C(=O)O)CC2)cc1OC	ZINC000450523683	DD	On-Demand	Anodyne	HCN4	49	37
C[C@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@H]1C(=O)O	ZINC000450523701	DF	On-Demand	Anodyne	OPRK1	37	40
C[C@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@H]1C(=O)O	ZINC000450523701	DF	On-Demand	Anodyne	PRCP	40	31
C[C@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@H]1C(=O)O	ZINC000450523701	DF	On-Demand	Anodyne	MLNR	36	40
C[C@@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@@H]1C(=O)O	ZINC000450523702	DF	On-Demand	Anodyne	OPRK1	37	40
C[C@@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@@H]1C(=O)O	ZINC000450523702	DF	On-Demand	Anodyne	PRCP	40	31
C[C@@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@@H]1C(=O)O	ZINC000450523702	DF	On-Demand	Anodyne	MLNR	36	40
C[C@@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@H]1C(=O)O	ZINC000450523703	DF	On-Demand	Anodyne	OPRK1	37	40
C[C@@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@H]1C(=O)O	ZINC000450523703	DF	On-Demand	Anodyne	PRCP	40	31
C[C@@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@H]1C(=O)O	ZINC000450523703	DF	On-Demand	Anodyne	MLNR	36	40
C[C@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@@H]1C(=O)O	ZINC000450523704	DF	On-Demand	Anodyne	OPRK1	37	40
C[C@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@@H]1C(=O)O	ZINC000450523704	DF	On-Demand	Anodyne	PRCP	40	31
C[C@H]1CN(C(=O)Cc2ccc(Cl)c(F)c2)CC[C@@H]1C(=O)O	ZINC000450523704	DF	On-Demand	Anodyne	MLNR	36	40
CN(C)c1nc(NCC2(C(F)(F)F)CC2)nc2ccccc12	ZINC000450523705	DF	On-Demand	Anodyne	ADRA2A	18	49
CN(C)S(=O)(=O)CC(=O)N[C@H]1CCCCC[C@H]1C(=O)O	ZINC000450523706	DC	On-Demand	Anodyne	ACE	0	41
O=C(CCCc1cc(F)ccc1F)NC[C@H](C(=O)O)c1ccc(F)cc1	ZINC000450523743	FG	On-Demand	Anodyne	MPO	29	40
O=C(CCCc1cc(F)ccc1F)NC[C@@H](C(=O)O)c1ccc(F)cc1	ZINC000450523744	FG	On-Demand	Anodyne	MPO	29	40
FC(F)OC[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450523745	EI	On-Demand	Anodyne	LIPG	52	35
FC(F)OC[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450523746	EI	On-Demand	Anodyne	LIPG	52	35
COc1ccc2c(c1)OC[C@H](NC(=O)[C@H]1Cc3c(C)cccc3O1)C2	ZINC000450523763	EE	On-Demand	Anodyne	MT-ND4	56	36
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@H]1Cc3c(C)cccc3O1)C2	ZINC000450523764	EE	On-Demand	Anodyne	MT-ND4	56	36
COc1ccc2c(c1)OC[C@H](NC(=O)[C@@H]1Cc3c(C)cccc3O1)C2	ZINC000450523765	EE	On-Demand	Anodyne	MT-ND4	56	36
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@@H]1Cc3c(C)cccc3O1)C2	ZINC000450523766	EE	On-Demand	Anodyne	MT-ND4	56	36
COC(=O)c1coc(CN(Cc2ccc(OC)c(OC)c2)C2CCCCC2)n1	ZINC000450523767	GH	On-Demand	Anodyne	SCARB1	21	42
COCCCS(=O)(=O)c1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450523770	GG	On-Demand	Anodyne	PFK	0	44
COCCCS(=O)(=O)c1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450523770	GG	On-Demand	Anodyne	RORC	44	37
COc1cc(Cl)c(C(=O)N2CC[C@@H](C(=O)O)[C@H](C)C2)cc1OC	ZINC000450523771	EF	On-Demand	Anodyne	HTR4	61	39
COc1cc(Cl)c(C(=O)N2CC[C@H](C(=O)O)[C@@H](C)C2)cc1OC	ZINC000450523772	EF	On-Demand	Anodyne	HTR4	61	39
COc1cc(Cl)c(C(=O)N2CC[C@@H](C(=O)O)[C@@H](C)C2)cc1OC	ZINC000450523773	EF	On-Demand	Anodyne	HTR4	61	39
COc1cc(Cl)c(C(=O)N2CC[C@H](C(=O)O)[C@H](C)C2)cc1OC	ZINC000450523774	EF	On-Demand	Anodyne	HTR4	61	39
Cc1cccc(Cl)c1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523781	FG	On-Demand	Anodyne	CACNA1H	16	40
Cc1cccc(Cl)c1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523781	FG	On-Demand	Anodyne	CCR8	59	35
Cc1cccc(Cl)c1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450523781	FG	On-Demand	Anodyne	WNT3	41	35
COC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450523785	CD	On-Demand	Anodyne	AVPR1A	20	40
COC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450523785	CD	On-Demand	Anodyne	ACE2	68	38
COC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450523785	CD	On-Demand	Anodyne	NCE103	26	43
COC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450523785	CD	On-Demand	Anodyne	CAN2	0	43
COC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450523786	CD	On-Demand	Anodyne	AVPR1A	20	40
COC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450523786	CD	On-Demand	Anodyne	ACE2	68	38
COC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450523786	CD	On-Demand	Anodyne	NCE103	26	43
COC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450523786	CD	On-Demand	Anodyne	CAN2	0	43
CCc1cccc(C(=O)Nc2ccc(S(=O)(=O)CCCOC)cc2)n1	ZINC000450523787	FF	On-Demand	Anodyne	PDE5A	27	41
CCc1cccc(C(=O)Nc2ccc(S(=O)(=O)CCCOC)cc2)n1	ZINC000450523787	FF	On-Demand	Anodyne	GRM4	31	40
CC(C)Oc1ccc2nccc(N3CC[C@@H](COC(F)F)C3)c2c1	ZINC000450523788	EI	On-Demand	Anodyne	PDE3B	49	32
CC(C)Oc1ccc2nccc(N3CC[C@H](COC(F)F)C3)c2c1	ZINC000450523789	EI	On-Demand	Anodyne	PDE3B	49	32
COc1ccc2c(c1)C[C@H](C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523790	GF	On-Demand	Anodyne	MTNR1A	17	49
COc1ccc2c(c1)C[C@H](C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523790	GF	On-Demand	Anodyne	ROCK2	36	49
COc1ccc2c(c1)C[C@H](C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523790	GF	On-Demand	Anodyne	CACNA1G	35	45
COc1ccc2c(c1)C[C@H](C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523790	GF	On-Demand	Anodyne	CDC42BPA	0	44
COc1ccc2c(c1)C[C@H](C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523791	GF	On-Demand	Anodyne	MTNR1A	17	49
COc1ccc2c(c1)C[C@H](C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523791	GF	On-Demand	Anodyne	ROCK2	36	49
COc1ccc2c(c1)C[C@H](C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523791	GF	On-Demand	Anodyne	CACNA1G	35	45
COc1ccc2c(c1)C[C@H](C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523791	GF	On-Demand	Anodyne	CDC42BPA	0	44
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523792	GF	On-Demand	Anodyne	MTNR1A	17	49
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523792	GF	On-Demand	Anodyne	ROCK2	36	49
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523792	GF	On-Demand	Anodyne	CACNA1G	35	45
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523792	GF	On-Demand	Anodyne	CDC42BPA	0	44
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523793	GF	On-Demand	Anodyne	MTNR1A	17	49
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523793	GF	On-Demand	Anodyne	ROCK2	36	49
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523793	GF	On-Demand	Anodyne	CACNA1G	35	45
COc1ccc2c(c1)C[C@@H](C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1)CO2	ZINC000450523793	GF	On-Demand	Anodyne	CDC42BPA	0	44
COCCN(CCOC)C1CCN(c2nccc3c(OC)cccc23)CC1	ZINC000450523806	FF	On-Demand	Anodyne	PDE3A	27	40
COCCN(CCOC)C1CCN(c2nccc3c(OC)cccc23)CC1	ZINC000450523806	FF	On-Demand	Anodyne	PDE3B	68	37
COc1ccc(-c2noc(NCC3(C(F)(F)F)CC3)n2)cc1	ZINC000450523815	DF	On-Demand	Anodyne	LUCI_PHOPE	21	41
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)c1	ZINC000450523820	FH	On-Demand	Anodyne	P2RY12	31	43
COc1ccc2c(c1)OC[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)C2	ZINC000450523823	FG	On-Demand	Anodyne	MTNR1A	18	40
COc1ccc2c(c1)OC[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)C2	ZINC000450523824	FG	On-Demand	Anodyne	MTNR1A	18	40
CC(C)(C)NC(=O)N1CCC(NC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450523840	FE	On-Demand	Anodyne	SIGMAR1	16	48
CC(C)(C)NC(=O)N1CCC(NC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450523840	FE	On-Demand	Anodyne	CCR3	20	40
CC(C)(C)NC(=O)N1CCC(NC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450523840	FE	On-Demand	Anodyne	EPHX2	25	42
CC(C)(C)NC(=O)N1CCC(NC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450523840	FE	On-Demand	Anodyne	SFRP1	47	35
CC(C)(C)NC(=O)N1CCC(NC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450523840	FE	On-Demand	Anodyne	WNT3	51	35
Cc1ccc([C@@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O)cc1C	ZINC000450523841	EC	On-Demand	Anodyne	FOLH1	44	37
Cc1ccc([C@H](NC(=O)CS(=O)(=O)N(C)C)C(=O)O)cc1C	ZINC000450523842	EC	On-Demand	Anodyne	FOLH1	44	37
COc1cc(C(=O)O)ccc1CCNC(=O)C1(Oc2ccccc2F)CC1	ZINC000450523845	FF	On-Demand	Anodyne	ACKR3	50	33
CCOC(CNC(=O)c1cccc(CC)n1)CNC(=O)c1cccc(CC)n1	ZINC000450523853	GE	On-Demand	Anodyne	PDE5A	27	42
CCOC(CNC(=O)c1cccc(CC)n1)CNC(=O)c1cccc(CC)n1	ZINC000450523853	GE	On-Demand	Anodyne	ITGAV	44	33
COc1ccc2c(c1)OC[C@@H](NC(=O)Cc1cc3ccccc3s1)C2	ZINC000450523858	FH	On-Demand	Anodyne	MTNR1A	31	47
COc1ccc2c(c1)OC[C@H](NC(=O)Cc1cc3ccccc3s1)C2	ZINC000450523859	FH	On-Demand	Anodyne	MTNR1A	31	47
COc1cc(CC(=O)N2CC[C@]3(CC[C@@H](C)C3)C2)ccc1O	ZINC000450523862	DF	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)N2CC[C@]3(CC[C@@H](C)C3)C2)ccc1O	ZINC000450523862	DF	On-Demand	Anodyne	RORC	45	35
COc1cc(CC(=O)N2CC[C@@]3(CC[C@@H](C)C3)C2)ccc1O	ZINC000450523863	DF	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)N2CC[C@@]3(CC[C@@H](C)C3)C2)ccc1O	ZINC000450523863	DF	On-Demand	Anodyne	RORC	45	35
COc1cc(CC(=O)N2CC[C@@]3(CC[C@H](C)C3)C2)ccc1O	ZINC000450523864	DF	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)N2CC[C@@]3(CC[C@H](C)C3)C2)ccc1O	ZINC000450523864	DF	On-Demand	Anodyne	RORC	45	35
CNC(=O)[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCO1	ZINC000450523866	GD	On-Demand	Anodyne	PDE6D	85	40
CNC(=O)[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCO1	ZINC000450523866	GD	On-Demand	Anodyne	IMDH_CRYPV	30	45
CNC(=O)[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCO1	ZINC000450523867	GD	On-Demand	Anodyne	PDE6D	85	40
CNC(=O)[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCO1	ZINC000450523867	GD	On-Demand	Anodyne	IMDH_CRYPV	30	45
CN(C)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)n1	ZINC000450523868	FF	On-Demand	Anodyne	CASR	50	35
CCOC(=O)[C@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450523869	GD	On-Demand	Anodyne	PDGFRB	0	44
CCOC(=O)[C@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450523869	GD	On-Demand	Anodyne	CPT1A	44	30
CCOC(=O)[C@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450523869	GD	On-Demand	Anodyne	PLK1	51	36
CCOC(=O)[C@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450523869	GD	On-Demand	Anodyne	HPGD	46	55
CCOC(=O)[C@@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450523870	GD	On-Demand	Anodyne	PDGFRB	0	44
CCOC(=O)[C@@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450523870	GD	On-Demand	Anodyne	CPT1A	44	30
CCOC(=O)[C@@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450523870	GD	On-Demand	Anodyne	PLK1	51	36
CCOC(=O)[C@@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450523870	GD	On-Demand	Anodyne	HPGD	46	55
COc1ccc(C(=O)Nc2cnn(C(C)(C)C(=O)O)c2)c(OC2CCCC2)c1	ZINC000450523882	GG	On-Demand	Anodyne	PDE4A	33	41
COc1ccc(C(=O)Nc2cnn(C(C)(C)C(=O)O)c2)c(OC2CCCC2)c1	ZINC000450523882	GG	On-Demand	Anodyne	PDE4B	24	41
COc1ccc(C(=O)Nc2cnn(C(C)(C)C(=O)O)c2)c(OC2CCCC2)c1	ZINC000450523882	GG	On-Demand	Anodyne	PDE4D	19	41
COc1ccc(C(=O)Nc2cnn(C(C)(C)C(=O)O)c2)c(OC2CCCC2)c1	ZINC000450523882	GG	On-Demand	Anodyne	PANC	41	32
CCC(CC)(NC(=O)Cc1ccc(F)cc1Cl)C(=O)O	ZINC000450523896	DF	On-Demand	Anodyne	P2RX7	23	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450523909	GI	On-Demand	Anodyne	RBP4	87	42
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450523910	GI	On-Demand	Anodyne	RBP4	87	42
CCC(CC)(NC(=O)c1cc(Br)c(OC)c(OC)c1)C(=O)O	ZINC000450523918	FF	On-Demand	Anodyne	TPMT	0	43
COc1ccc(NC(=O)CS(=O)(=O)N(C)C)c(C(=O)O)c1	ZINC000450523923	DC	On-Demand	Anodyne	AKR1C3	33	42
COc1ccc(NC(=O)CS(=O)(=O)N(C)C)c(C(=O)O)c1	ZINC000450523923	DC	On-Demand	Anodyne	AKR1C2	61	42
COC(=O)C1(CNC(=O)c2cc(Cl)c3ccccc3n2)CCOCC1	ZINC000450523925	FF	On-Demand	Anodyne	ADAMTS1	0	41
COc1cccc2c(N3CC[C@@H](C(F)(F)F)[C@@H](CO)C3)nccc12	ZINC000450523927	EG	On-Demand	Anodyne	PDE3A	27	40
COc1cccc2c(N3CC[C@@H](C(F)(F)F)[C@@H](CO)C3)nccc12	ZINC000450523927	EG	On-Demand	Anodyne	PDE3B	68	36
COc1cccc2c(N3CC[C@H](C(F)(F)F)[C@H](CO)C3)nccc12	ZINC000450523928	EG	On-Demand	Anodyne	PDE3A	27	40
COc1cccc2c(N3CC[C@H](C(F)(F)F)[C@H](CO)C3)nccc12	ZINC000450523928	EG	On-Demand	Anodyne	PDE3B	68	36
COc1cccc2c(N3CC[C@H](C(F)(F)F)[C@@H](CO)C3)nccc12	ZINC000450523929	EG	On-Demand	Anodyne	PDE3A	27	40
COc1cccc2c(N3CC[C@H](C(F)(F)F)[C@@H](CO)C3)nccc12	ZINC000450523929	EG	On-Demand	Anodyne	PDE3B	68	36
COc1cccc2c(N3CC[C@@H](C(F)(F)F)[C@H](CO)C3)nccc12	ZINC000450523930	EG	On-Demand	Anodyne	PDE3A	27	40
COc1cccc2c(N3CC[C@@H](C(F)(F)F)[C@H](CO)C3)nccc12	ZINC000450523930	EG	On-Demand	Anodyne	PDE3B	68	36
COc1ccc(-c2noc(N(C)[C@H]3C[C@@H](OC)C3)n2)cc1	ZINC000450523942	CE	On-Demand	Anodyne	LUCI_PHOPE	29	43
Cc1cc(Cl)ccc1CN1CCN(c2ncc(C(F)F)cn2)CC1	ZINC000450523943	FH	On-Demand	Anodyne	DRD1	0	42
Cc1cc(Cl)ccc1CN1CCN(c2ncc(C(F)F)cn2)CC1	ZINC000450523943	FH	On-Demand	Anodyne	DRD4	20	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450523950	GG	On-Demand	Anodyne	ADAM17	28	49
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450523951	GG	On-Demand	Anodyne	ADAM17	28	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450523952	GG	On-Demand	Anodyne	ADAM17	28	49
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450523953	GG	On-Demand	Anodyne	ADAM17	28	49
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450523957	DC	On-Demand	Anodyne	GPR88	0	47
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	FKBP1A	16	41
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	MMP13	40	38
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	ITGA4	37	41
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	CAPNS1	23	43
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	MMP2	20	40
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	MMP3	44	38
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	EPHX2	29	40
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	MMP7	53	37
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	MMP1	41	38
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	AKR1C3	38	48
CCC(CC)(NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523958	GE	On-Demand	Anodyne	AKR1C1	15	50
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	FKBP1A	16	41
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	MMP13	40	38
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	ITGA4	37	41
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	CAPNS1	23	43
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	MMP2	20	40
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	MMP3	44	38
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	EPHX2	29	40
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	MMP7	53	37
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	MMP1	41	38
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	AKR1C3	38	48
CCC(CC)(NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1)C(=O)O	ZINC000450523959	GE	On-Demand	Anodyne	AKR1C1	15	50
Cc1cnc(CCCC(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)o1	ZINC000450523962	GH	On-Demand	Anodyne	RBP4	81	38
Cc1cnc(CCCC(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)o1	ZINC000450523963	GH	On-Demand	Anodyne	RBP4	81	38
COc1cc(CC(=O)N2CC[C@]3(CC[C@H](C)C3)C2)ccc1O	ZINC000450523965	DF	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)N2CC[C@]3(CC[C@H](C)C3)C2)ccc1O	ZINC000450523965	DF	On-Demand	Anodyne	RORC	45	35
CC[C@H](O)CC(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450523975	DE	On-Demand	Anodyne	OPRK1	16	42
CC[C@H](O)CC(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450523975	DE	On-Demand	Anodyne	CYP2D6	22	40
CC[C@@H](O)CC(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450523976	DE	On-Demand	Anodyne	OPRK1	16	42
CC[C@@H](O)CC(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450523976	DE	On-Demand	Anodyne	CYP2D6	22	40
CC[C@H](O)CC(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450523977	DE	On-Demand	Anodyne	OPRK1	16	42
CC[C@H](O)CC(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450523977	DE	On-Demand	Anodyne	CYP2D6	22	40
CC[C@@H](O)CC(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450523978	DE	On-Demand	Anodyne	OPRK1	16	42
CC[C@@H](O)CC(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450523978	DE	On-Demand	Anodyne	CYP2D6	22	40
COCCCS(=O)(=O)c1ccc(NC(=O)c2cccc3c2CCCC3)cc1	ZINC000450523979	GH	On-Demand	Anodyne	AVPR2	42	42
COCCCS(=O)(=O)c1ccc(NC(=O)c2cccc3c2CCCC3)cc1	ZINC000450523979	GH	On-Demand	Anodyne	AVPR1A	20	41
COc1ccc2c(c1)OC[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C2	ZINC000450523996	FF	On-Demand	Anodyne	MTNR1A	16	45
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C2	ZINC000450523997	FF	On-Demand	Anodyne	MTNR1A	16	45
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C2	ZINC000450523998	FF	On-Demand	Anodyne	MTNR1A	16	45
COc1ccc2c(c1)OC[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C2	ZINC000450523999	FF	On-Demand	Anodyne	MTNR1A	16	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC(C)(C)C#N	ZINC000450524020	CE	On-Demand	Mild	PAPA1_CARPA	45	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC(C)(C)C#N	ZINC000450524020	CE	On-Demand	Mild	CTSS	36	49
Cc1nc(NCC2(C(F)(F)F)CC2)ncc1[N+](=O)[O-]	ZINC000450524031	CE	On-Demand	Bother	PRKCQ	42	37
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450524043	EG	On-Demand	Anodyne	EPHX2	17	40
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450524044	EG	On-Demand	Anodyne	EPHX2	17	40
COc1ccc2c(c1)OC[C@@H](NC(=O)c1cccc(SC)c1)C2	ZINC000450524045	EG	On-Demand	Anodyne	DRD4	42	32
COc1ccc2c(c1)OC[C@@H](NC(=O)c1cccc(SC)c1)C2	ZINC000450524045	EG	On-Demand	Anodyne	LGALS1	0	41
COc1ccc2c(c1)OC[C@@H](NC(=O)c1cccc(SC)c1)C2	ZINC000450524045	EG	On-Demand	Anodyne	LGALS9	0	41
COc1ccc2c(c1)OC[C@@H](NC(=O)c1cccc(SC)c1)C2	ZINC000450524045	EG	On-Demand	Anodyne	LGALS7B	0	41
COc1ccc2c(c1)OC[C@H](NC(=O)c1cccc(SC)c1)C2	ZINC000450524046	EG	On-Demand	Anodyne	DRD4	42	32
COc1ccc2c(c1)OC[C@H](NC(=O)c1cccc(SC)c1)C2	ZINC000450524046	EG	On-Demand	Anodyne	LGALS1	0	41
COc1ccc2c(c1)OC[C@H](NC(=O)c1cccc(SC)c1)C2	ZINC000450524046	EG	On-Demand	Anodyne	LGALS9	0	41
COc1ccc2c(c1)OC[C@H](NC(=O)c1cccc(SC)c1)C2	ZINC000450524046	EG	On-Demand	Anodyne	LGALS7B	0	41
N#Cc1ccc(OC2CCN(c3nccc(-c4cnccn4)n3)CC2)c(F)c1	ZINC000450524062	GF	On-Demand	Mild	DCK	48	41
C[C@@]1(C(=O)O)CCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450524068	CE	On-Demand	Anodyne	ENV	44	34
C[C@@]1(C(=O)O)CCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450524068	CE	On-Demand	Anodyne	SLC12A5	44	37
C[C@]1(C(=O)O)CCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450524069	CE	On-Demand	Anodyne	ENV	44	34
C[C@]1(C(=O)O)CCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450524069	CE	On-Demand	Anodyne	SLC12A5	44	37
N#Cc1ccnc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)n1	ZINC000450524097	EE	On-Demand	Mild	MAPK1	59	35
O=C(CCCc1cccc(C(F)(F)F)c1)N[C@H](C(=O)O)c1cccs1	ZINC000450524099	FI	On-Demand	Anodyne	PTGFR	32	40
O=C(CCCc1cccc(C(F)(F)F)c1)N[C@H](C(=O)O)c1cccs1	ZINC000450524099	FI	On-Demand	Anodyne	HDA106	0	43
O=C(CCCc1cccc(C(F)(F)F)c1)N[C@@H](C(=O)O)c1cccs1	ZINC000450524100	FI	On-Demand	Anodyne	PTGFR	32	40
O=C(CCCc1cccc(C(F)(F)F)c1)N[C@@H](C(=O)O)c1cccs1	ZINC000450524100	FI	On-Demand	Anodyne	HDA106	0	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)C#N)cc1	ZINC000450524129	FE	On-Demand	Mild	MMP13	18	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)C#N)cc1	ZINC000450524129	FE	On-Demand	Mild	CTSK	35	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)C#N)cc1	ZINC000450524129	FE	On-Demand	Mild	CTSL	24	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)C#N)cc1	ZINC000450524129	FE	On-Demand	Mild	MMP2	22	49
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)C#N)cc1	ZINC000450524129	FE	On-Demand	Mild	CTSS	31	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)C#N)cc1	ZINC000450524129	FE	On-Demand	Mild	CAPN1	16	56
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)C#N)cc1	ZINC000450524129	FE	On-Demand	Mild	PSMB5	33	44
CC(C)(C#N)CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450524143	EE	On-Demand	Mild	AR	23	42
CC(C)(C#N)CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450524144	EE	On-Demand	Mild	AR	23	42
N#Cc1ccc(OC2CCN(c3ncc(C(F)F)cn3)CC2)c(F)c1	ZINC000450524148	EG	On-Demand	Mild	DCK	32	41
COc1ccccc1-n1cnc2cc(C(=O)NCC(C)(C)C#N)ccc21	ZINC000450524154	EG	On-Demand	Mild	DRD2	17	40
COc1ccccc1-n1cnc2cc(C(=O)NCC(C)(C)C#N)ccc21	ZINC000450524154	EG	On-Demand	Mild	DRD3	22	40
COc1ccccc1-n1cnc2cc(C(=O)NCC(C)(C)C#N)ccc21	ZINC000450524154	EG	On-Demand	Mild	PDGFRB	15	44
COc1ccccc1-n1cnc2cc(C(=O)NCC(C)(C)C#N)ccc21	ZINC000450524154	EG	On-Demand	Mild	CPT1A	46	32
COc1ccccc1-n1cnc2cc(C(=O)NCC(C)(C)C#N)ccc21	ZINC000450524154	EG	On-Demand	Mild	HPGD	43	55
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524155	EH	On-Demand	Anodyne	DPEP1	40	33
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524155	EH	On-Demand	Anodyne	CTSK	17	48
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524155	EH	On-Demand	Anodyne	CTSL	32	52
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524155	EH	On-Demand	Anodyne	F2R	25	43
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524155	EH	On-Demand	Anodyne	CCKBR	37	45
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524155	EH	On-Demand	Anodyne	CTSS	54	52
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524155	EH	On-Demand	Anodyne	NS3	0	41
O=C(N[C@@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524155	EH	On-Demand	Anodyne	METAP2	0	41
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524156	EH	On-Demand	Anodyne	DPEP1	40	33
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524156	EH	On-Demand	Anodyne	CTSK	17	48
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524156	EH	On-Demand	Anodyne	CTSL	32	52
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524156	EH	On-Demand	Anodyne	CTSS	54	52
O=C(N[C@H](CC1CCCCC1)C(=O)O)c1cccc(C(F)F)c1	ZINC000450524156	EH	On-Demand	Anodyne	NS3	0	41
CN(C)S(=O)(=O)CC(=O)N[C@@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524159	FD	On-Demand	Anodyne	UTS2	52	46
CN(C)S(=O)(=O)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524160	FD	On-Demand	Anodyne	UTS2	52	46
O=C(NCCc1cccs1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450524173	GH	On-Demand	Anodyne	ADAM17	22	44
O=C(NCCc1cccs1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450524173	GH	On-Demand	Anodyne	MTNR1A	15	40
O=C(NCCc1cccs1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450524173	GH	On-Demand	Anodyne	CACNA1G	35	44
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	ACE	17	44
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	MME	22	41
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	TACR1	48	42
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	CCKAR	40	42
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	BRS3	22	40
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	NMBR	46	34
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	MC3R	40	35
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	MC5R	49	32
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	MMP14	86	38
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	GRPR	60	33
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	ECE1	53	43
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	SSTR3	26	40
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	MMP11	65	34
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	CCKBR	29	40
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	GHSR	73	39
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	MMP9	21	40
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	MC1R	51	36
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	MMP1	20	40
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	NPR	30	41
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	SLC15A2	0	48
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524175	FG	On-Demand	Anodyne	KISS1R	56	34
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	ACE	17	44
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	MME	22	41
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	TACR1	48	42
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	CCKAR	40	42
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	BRS3	22	40
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	NMBR	46	34
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	MC3R	40	35
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	MC5R	49	32
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	MMP14	86	38
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	GRPR	60	33
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	ECE1	53	43
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	SSTR3	26	40
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	MMP11	65	34
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	CCKBR	29	40
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	GHSR	73	39
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	MMP9	21	40
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	MC1R	51	36
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	MMP1	20	40
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	NPR	30	41
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	SLC15A2	0	48
Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C(C)C)n1	ZINC000450524176	FG	On-Demand	Anodyne	KISS1R	56	34
CCN(Cc1cn(C)nn1)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450524182	GE	On-Demand	Anodyne	TRPC6	60	35
CCN(Cc1cn(C)nn1)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450524182	GE	On-Demand	Anodyne	TRPC3	47	35
CCC(=O)CCCN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450524185	DF	On-Demand	Anodyne	EPHX2	37	50
CCC(=O)C1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CC1	ZINC000450524193	FG	On-Demand	Anodyne	RBP4	74	43
CCC(=O)C1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CC1	ZINC000450524194	FG	On-Demand	Anodyne	RBP4	74	43
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450524195	FD	On-Demand	Anodyne	KLK3	40	31
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450524196	FD	On-Demand	Anodyne	KLK3	40	31
O=C(NC1CCCCC1)C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450524209	EE	On-Demand	Anodyne	EPHX2	30	52
CCc1cc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)ccn1	ZINC000450524211	FG	On-Demand	Anodyne	DRD2	16	42
CCc1cc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)ccn1	ZINC000450524211	FG	On-Demand	Anodyne	DRD3	24	42
CCc1cc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)ccn1	ZINC000450524211	FG	On-Demand	Anodyne	SLC18A3	23	47
CCc1cc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)ccn1	ZINC000450524211	FG	On-Demand	Anodyne	KHK	0	40
CCc1cc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)ccn1	ZINC000450524212	FG	On-Demand	Anodyne	DRD2	16	42
CCc1cc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)ccn1	ZINC000450524212	FG	On-Demand	Anodyne	DRD3	24	42
CCc1cc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)ccn1	ZINC000450524212	FG	On-Demand	Anodyne	SLC18A3	23	47
CCc1cc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)ccn1	ZINC000450524212	FG	On-Demand	Anodyne	KHK	0	40
O=C1CCC(CN2CCC(C(=O)NC3CCCCC3)CC2)CC1	ZINC000450524213	DF	On-Demand	Anodyne	EPHX2	36	51
C[C@@H](C(=O)N1C[C@@H](C(=O)O)[C@H](c2ccccc2)C1)C1CC1	ZINC000450524214	CE	On-Demand	Anodyne	SLC6A1	0	42
C[C@@H](C(=O)N1C[C@@H](C(=O)O)[C@H](c2ccccc2)C1)C1CC1	ZINC000450524214	CE	On-Demand	Anodyne	HSD17B2	79	36
Cc1ccn2ncc(C(=O)N3CCO[C@@H](c4ccccc4C(F)(F)F)C3)c2c1	ZINC000450524220	GH	On-Demand	Anodyne	RBP4	79	41
Cc1ccn2ncc(C(=O)N3CCO[C@@H](c4ccccc4C(F)(F)F)C3)c2c1	ZINC000450524220	GH	On-Demand	Anodyne	EPHB3	27	40
Cc1ccn2ncc(C(=O)N3CCO[C@H](c4ccccc4C(F)(F)F)C3)c2c1	ZINC000450524221	GH	On-Demand	Anodyne	RBP4	79	41
Cc1ccn2ncc(C(=O)N3CCO[C@H](c4ccccc4C(F)(F)F)C3)c2c1	ZINC000450524221	GH	On-Demand	Anodyne	EPHB3	27	40
Cc1cc(Cl)ccc1CN1CCN(c2nccc(C#N)n2)CC1	ZINC000450524247	EF	On-Demand	Mild	DRD1	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450524249	ED	On-Demand	Anodyne	GPR88	0	42
CN(C)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)n1	ZINC000450524257	DF	On-Demand	Anodyne	MAP3K5	46	34
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450524260	ED	On-Demand	Anodyne	CACNA1C	15	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450524260	ED	On-Demand	Anodyne	RBP4	60	44
CC[C@@H](Nc1ncc(C(F)F)cn1)c1ccc(OC)c(OC)c1	ZINC000450524262	DH	On-Demand	Anodyne	ENPP1	40	31
CC[C@H](Nc1ncc(C(F)F)cn1)c1ccc(OC)c(OC)c1	ZINC000450524263	DH	On-Demand	Anodyne	ENPP1	40	31
O=C(Cc1ccc(O)c(F)c1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450524264	GH	On-Demand	Anodyne	RBP4	83	39
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450524281	GG	On-Demand	Anodyne	OPRK1	0	45
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450524281	GG	On-Demand	Anodyne	MMP13	0	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450524282	GG	On-Demand	Anodyne	OPRK1	0	45
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450524282	GG	On-Demand	Anodyne	MMP13	0	40
COCCCS(=O)(=O)c1ccc(NC(=O)c2cnn3ccc(C)cc23)cc1	ZINC000450524283	GF	On-Demand	Anodyne	EPHB3	37	49
CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524286	FG	On-Demand	Bother	CTSS	31	54
CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524287	FG	On-Demand	Bother	CTSS	31	54
O=C(c1cc(Cl)c[nH]1)N1CCC(Nc2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450524290	GH	On-Demand	Anodyne	JUN	15	41
O=C(c1cc(Cl)c[nH]1)N1CCC(Nc2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450524290	GH	On-Demand	Anodyne	MAPK9	18	41
CCOC(=O)c1cnc(C)c(NC(=O)c2cc3n(n2)CCC3)c1	ZINC000450524314	DD	On-Demand	Anodyne	P2RY12	44	40
N#Cc1ccc(OC2CCN(c3cccc(C#N)c3[N+](=O)[O-])CC2)c(F)c1	ZINC000450524340	FH	On-Demand	Mild	AR	25	44
Cc1cc(NC2(CCO)CCCC2)nc(-c2cccnc2)n1	ZINC000450524343	CF	On-Demand	Anodyne	ROS1	43	37
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450524345	FH	On-Demand	Anodyne	KCNQ2	18	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450524345	FH	On-Demand	Anodyne	GPR88	0	47
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450524346	FH	On-Demand	Anodyne	KCNQ2	18	41
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450524346	FH	On-Demand	Anodyne	GPR88	0	47
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450524347	FH	On-Demand	Anodyne	KCNQ2	18	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450524347	FH	On-Demand	Anodyne	GPR88	0	47
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450524348	FH	On-Demand	Anodyne	KCNQ2	18	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450524348	FH	On-Demand	Anodyne	GPR88	0	47
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccc(C(=O)OC)cc2)c1	ZINC000450524356	FF	On-Demand	Anodyne	MAPK10	0	42
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccc(C(=O)OC)cc2)c1	ZINC000450524356	FF	On-Demand	Anodyne	MAPK8	22	42
COc1cc(Cl)c(C(=O)N[C@H]2CCCCC[C@H]2C(=O)O)cc1OC	ZINC000450524357	FG	On-Demand	Anodyne	DRD2	33	40
COc1cc(Cl)c(C(=O)N[C@H]2CCCCC[C@H]2C(=O)O)cc1OC	ZINC000450524357	FG	On-Demand	Anodyne	DRD3	0	42
COc1cc(Cl)c(C(=O)N[C@H]2CCCCC[C@H]2C(=O)O)cc1OC	ZINC000450524357	FG	On-Demand	Anodyne	HTR3A	31	44
COc1cc(Cl)c(C(=O)N[C@H]2CCCCC[C@H]2C(=O)O)cc1OC	ZINC000450524357	FG	On-Demand	Anodyne	HTR4	57	44
CCOC(=O)c1cnc(C)c(NC(=O)c2cccc(CC)n2)c1	ZINC000450524360	DF	On-Demand	Anodyne	PDE5A	27	42
CCOC(=O)c1cnc(C)c(NC(=O)c2cccc(CC)n2)c1	ZINC000450524360	DF	On-Demand	Anodyne	P2RY12	24	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	ACE	26	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	OPRK1	30	43
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	MME	52	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	LTA4H	23	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	KCNQ2	37	43
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	MMP13	20	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	CTSB	18	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	CYSP_TRYCR	21	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	SOAT1	29	56
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	F11	44	36
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	CYP2D6	0	42
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	ABCB1	28	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	CAPN1	37	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	MMP9	25	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	CAPN2	31	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	ACE2	40	33
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	MMP1	37	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	PSMB8	60	39
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	GPR88	0	52
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524369	GG	On-Demand	Anodyne	PQSD	0	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	ACE	26	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	OPRK1	30	43
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	MME	52	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	LTA4H	23	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	KCNQ2	37	43
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	MMP13	20	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	CTSB	18	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	CYSP_TRYCR	21	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	SOAT1	29	56
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	F11	44	36
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	CYP2D6	0	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	ABCB1	28	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	CAPN1	37	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	MMP9	25	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	CAPN2	31	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	ACE2	40	33
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	MMP1	37	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	PSMB8	60	39
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	GPR88	0	52
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450524370	GG	On-Demand	Anodyne	PQSD	0	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	ACE	26	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	OPRK1	30	43
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	MME	52	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	LTA4H	23	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	KCNQ2	37	43
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	MMP13	20	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	CTSB	18	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	CYSP_TRYCR	21	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	SOAT1	29	56
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	F11	44	36
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	CYP2D6	0	42
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	ABCB1	28	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	CAPN1	37	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	MMP9	25	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	CAPN2	31	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	ACE2	40	33
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	MMP1	37	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	PSMB8	60	39
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	GPR88	0	52
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524371	GG	On-Demand	Anodyne	PQSD	0	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	ACE	26	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	OPRK1	30	43
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	MME	52	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	LTA4H	23	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	KCNQ2	37	43
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	MMP13	20	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	CTSB	18	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	CYSP_TRYCR	21	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	SOAT1	29	56
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	F11	44	36
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	CYP2D6	0	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	ABCB1	28	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	CAPN1	37	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	MMP9	25	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	CAPN2	31	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	ACE2	40	33
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	MMP1	37	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	PSMB8	60	39
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	GPR88	0	52
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450524372	GG	On-Demand	Anodyne	PQSD	0	40
COc1ccc2c(c1)OC[C@@H](NC(=O)CCCC(=O)C(C)(C)C)C2	ZINC000450524386	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc2c(c1)OC[C@@H](NC(=O)CCCC(=O)C(C)(C)C)C2	ZINC000450524386	EF	On-Demand	Anodyne	MTNR1A	22	41
O=C(Cc1ccc(O)c(F)c1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450524387	GH	On-Demand	Anodyne	RBP4	83	39
COc1ccc2c(c1)OC[C@H](NC(=O)CCCC(=O)C(C)(C)C)C2	ZINC000450524388	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc2c(c1)OC[C@H](NC(=O)CCCC(=O)C(C)(C)C)C2	ZINC000450524388	EF	On-Demand	Anodyne	MTNR1A	22	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	CHRM2	18	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	FKBP1A	44	39
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	DRD4	21	43
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	DRD3	0	45
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	MME	33	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	SIGMAR1	32	47
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	CCR5	33	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	F11	40	36
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	EPHX2	44	46
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	MCHR1	18	43
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	CACNA1G	30	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524389	FG	On-Demand	Anodyne	BIRC2	44	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	CHRM2	18	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	FKBP1A	44	39
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	DRD4	21	43
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	DRD3	0	45
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	MME	33	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	SIGMAR1	32	47
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	CCR5	33	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	F11	40	36
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	EPHX2	44	46
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	MCHR1	18	43
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	CACNA1G	30	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450524392	FG	On-Demand	Anodyne	BIRC2	44	40
O=C(NC1CCCCC1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450524396	DG	On-Demand	Anodyne	EPHX2	35	49
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)[C@H](C)O)cc2)c1	ZINC000450524404	FF	On-Demand	Anodyne	ANPEP	16	45
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)[C@@H](C)O)cc2)c1	ZINC000450524405	FF	On-Demand	Anodyne	ANPEP	16	45
COc1ccc(C[C@@H](C)C(=O)N[C@@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524422	FF	On-Demand	Anodyne	FOLH1	44	39
COc1ccc(C[C@@H](C)C(=O)N[C@@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524422	FF	On-Demand	Anodyne	MME	62	45
COc1ccc(C[C@@H](C)C(=O)N[C@@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524422	FF	On-Demand	Anodyne	ACE2	76	38
COc1ccc(C[C@@H](C)C(=O)N[C@@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524422	FF	On-Demand	Anodyne	FPR1	47	36
COc1ccc(C[C@@H](C)C(=O)N[C@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524424	FF	On-Demand	Anodyne	FOLH1	44	39
COc1ccc(C[C@@H](C)C(=O)N[C@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524424	FF	On-Demand	Anodyne	MME	62	45
COc1ccc(C[C@@H](C)C(=O)N[C@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524424	FF	On-Demand	Anodyne	ACE2	76	38
COc1ccc(C[C@@H](C)C(=O)N[C@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524424	FF	On-Demand	Anodyne	FPR1	47	36
COc1ccc(C[C@H](C)C(=O)N[C@@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524425	FF	On-Demand	Anodyne	FOLH1	44	39
COc1ccc(C[C@H](C)C(=O)N[C@@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524425	FF	On-Demand	Anodyne	MME	62	45
COc1ccc(C[C@H](C)C(=O)N[C@@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524425	FF	On-Demand	Anodyne	ACE2	76	38
COc1ccc(C[C@H](C)C(=O)N[C@@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524425	FF	On-Demand	Anodyne	FPR1	47	36
COc1ccc(C[C@H](C)C(=O)N[C@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524427	FF	On-Demand	Anodyne	FOLH1	44	39
COc1ccc(C[C@H](C)C(=O)N[C@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524427	FF	On-Demand	Anodyne	MME	62	45
COc1ccc(C[C@H](C)C(=O)N[C@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524427	FF	On-Demand	Anodyne	ACE2	76	38
COc1ccc(C[C@H](C)C(=O)N[C@H](C(=O)O)c2cccs2)cc1OC	ZINC000450524427	FF	On-Demand	Anodyne	FPR1	47	36
COC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450524450	EE	On-Demand	Anodyne	TIMP3	63	32
COC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450524450	EE	On-Demand	Anodyne	NPPA	42	32
COC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450524451	EE	On-Demand	Anodyne	TIMP3	63	32
COC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450524451	EE	On-Demand	Anodyne	NPPA	42	32
Cc1cc(C(=O)NC2CCC(c3ccc(F)cc3)CC2)ncc1C(N)=O	ZINC000450524478	FG	On-Demand	Anodyne	MAPK14	51	46
Cc1cc(C(=O)NC2CCC(c3ccc(F)cc3)CC2)ncc1C(N)=O	ZINC000450524478	FG	On-Demand	Anodyne	PDE4B	40	32
Cc1cc(C(=O)NC2CCC(c3ccc(F)cc3)CC2)ncc1C(N)=O	ZINC000450524478	FG	On-Demand	Anodyne	MAPK13	73	34
CCc1cccc(C(=O)NC(C)(C)[C@@H](C)O)n1	ZINC000450524481	BD	On-Demand	Anodyne	PDE5A	24	40
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524482	GG	On-Demand	Anodyne	CTSL	16	43
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524482	GG	On-Demand	Anodyne	CACNA1B	22	43
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524482	GG	On-Demand	Anodyne	MTNR1A	18	45
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524482	GG	On-Demand	Anodyne	MTNR1B	21	45
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524482	GG	On-Demand	Anodyne	CTSS	31	43
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524483	GG	On-Demand	Anodyne	CTSL	16	43
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524483	GG	On-Demand	Anodyne	CACNA1B	22	43
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524483	GG	On-Demand	Anodyne	MTNR1A	18	45
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524483	GG	On-Demand	Anodyne	MTNR1B	21	45
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524483	GG	On-Demand	Anodyne	CTSS	31	43
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524484	GG	On-Demand	Anodyne	CTSL	16	43
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524484	GG	On-Demand	Anodyne	CACNA1B	22	43
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524484	GG	On-Demand	Anodyne	MTNR1A	18	45
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524484	GG	On-Demand	Anodyne	MTNR1B	21	45
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524484	GG	On-Demand	Anodyne	CTSS	31	43
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524485	GG	On-Demand	Anodyne	CTSL	16	43
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524485	GG	On-Demand	Anodyne	CACNA1B	22	43
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524485	GG	On-Demand	Anodyne	MTNR1A	18	45
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524485	GG	On-Demand	Anodyne	MTNR1B	21	45
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450524485	GG	On-Demand	Anodyne	CTSS	31	43
CCc1cccc(C(=O)NC(C)(C)[C@H](C)O)n1	ZINC000450524488	BD	On-Demand	Anodyne	PDE5A	24	40
CCO[C@H]1C[C@@](NC(=O)c2cc(OC)c(OC)cc2Cl)(C(=O)O)C1(C)C	ZINC000450524496	GF	On-Demand	Anodyne	HTR4	45	36
CCO[C@@H]1C[C@](NC(=O)c2cc(OC)c(OC)cc2Cl)(C(=O)O)C1(C)C	ZINC000450524497	GF	On-Demand	Anodyne	HTR4	45	36
CCO[C@H]1C[C@](NC(=O)c2cc(OC)c(OC)cc2Cl)(C(=O)O)C1(C)C	ZINC000450524498	GF	On-Demand	Anodyne	HTR4	45	36
CCO[C@@H]1C[C@@](NC(=O)c2cc(OC)c(OC)cc2Cl)(C(=O)O)C1(C)C	ZINC000450524499	GF	On-Demand	Anodyne	HTR4	45	36
COc1ccc2c(c1)OC[C@H](NC(=O)c1ccsc1C)C2	ZINC000450524514	DF	On-Demand	Anodyne	MTNR1A	15	41
COc1ccc2c(c1)OC[C@@H](NC(=O)c1ccsc1C)C2	ZINC000450524515	DF	On-Demand	Anodyne	MTNR1A	15	41
O=C(c1cc2c([nH]1)CCCC2)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450524539	GI	On-Demand	Anodyne	RBP4	80	45
O=C(c1cc2c([nH]1)CCCC2)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450524540	GI	On-Demand	Anodyne	RBP4	80	45
CC(=O)N[C@H](C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450524557	GG	On-Demand	Anodyne	RBP4	90	42
CC(=O)N[C@H](C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450524558	GG	On-Demand	Anodyne	RBP4	90	42
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C2	ZINC000450524578	EG	On-Demand	Anodyne	MT-ND4	55	34
COc1ccc2c(c1)OC[C@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C2	ZINC000450524579	EG	On-Demand	Anodyne	MT-ND4	55	34
COCCCS(=O)(=O)c1ccc(NC(=O)c2cc(C)cs2)cc1	ZINC000450524580	FG	On-Demand	Anodyne	USP7	42	33
COCCCS(=O)(=O)c1ccc(NC(=O)c2cc(C)cs2)cc1	ZINC000450524580	FG	On-Demand	Anodyne	USP47	53	33
COc1cc(C)c(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)cc1OC	ZINC000450524581	EG	On-Demand	Anodyne	CTSS	31	44
COc1cc(C)c(C(=O)N[C@H](CC2CCCCC2)C(=O)O)cc1OC	ZINC000450524582	EG	On-Demand	Anodyne	CTSS	31	44
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccc(Cl)c(OC)c2)c1	ZINC000450524594	FG	On-Demand	Anodyne	P2RY12	23	42
CCOC(=O)c1cnc(C)c(NC(=O)c2cccc3c2O[C@H](C)C3)c1	ZINC000450524611	EG	On-Demand	Anodyne	G2YM83_BOTF4	62	40
CCOC(=O)c1cnc(C)c(NC(=O)c2cccc3c2O[C@@H](C)C3)c1	ZINC000450524612	EG	On-Demand	Anodyne	G2YM83_BOTF4	62	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@]3(CC[C@H](C)C3)C2)c1	ZINC000450524642	DH	On-Demand	Anodyne	NPBWR1	56	31
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@]3(CC[C@H](C)C3)C2)c1	ZINC000450524643	DH	On-Demand	Anodyne	NPBWR1	56	31
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@]3(CC[C@@H](C)C3)C2)c1	ZINC000450524644	DH	On-Demand	Anodyne	NPBWR1	56	31
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@]3(CC[C@@H](C)C3)C2)c1	ZINC000450524645	DH	On-Demand	Anodyne	NPBWR1	56	31
Cc1ccn(-c2ccccc2C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)n1	ZINC000450524654	GF	On-Demand	Anodyne	CCR8	51	35
CCOC(=O)c1cnc(C)c(NC(=O)[C@@]2(C#N)C[C@@H]2C)c1	ZINC000450524655	CE	On-Demand	Mild	P2RY12	36	41
CCOC(=O)c1cnc(C)c(NC(=O)[C@]2(C#N)C[C@H]2C)c1	ZINC000450524656	CE	On-Demand	Mild	P2RY12	36	41
CCOC(=O)c1cnc(C)c(NC(=O)[C@@]2(C#N)C[C@H]2C)c1	ZINC000450524657	CE	On-Demand	Mild	P2RY12	36	41
CCOC(=O)c1cnc(C)c(NC(=O)[C@]2(C#N)C[C@@H]2C)c1	ZINC000450524658	CE	On-Demand	Mild	P2RY12	36	41
Cc1nc(NC[C@H]2CCN(S(=O)(=O)c3cccs3)C2)ncc1[N+](=O)[O-]	ZINC000450524672	GD	On-Demand	Bother	FAAH	15	44
Cc1nc(NC[C@H]2CCN(S(=O)(=O)c3cccs3)C2)ncc1[N+](=O)[O-]	ZINC000450524672	GD	On-Demand	Bother	PRKCQ	50	40
Cc1nc(NC[C@@H]2CCN(S(=O)(=O)c3cccs3)C2)ncc1[N+](=O)[O-]	ZINC000450524673	GD	On-Demand	Bother	FAAH	15	44
Cc1nc(NC[C@@H]2CCN(S(=O)(=O)c3cccs3)C2)ncc1[N+](=O)[O-]	ZINC000450524673	GD	On-Demand	Bother	PRKCQ	50	40
CCC(CC)(NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450524674	DF	On-Demand	Anodyne	PYGL	76	39
CCC(CC)(NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450524674	DF	On-Demand	Anodyne	TUBB2B	53	54
CCC(CC)(NC(=O)c1cc2cc(OC)ccc2[nH]1)C(=O)O	ZINC000450524674	DF	On-Demand	Anodyne	FLT3	0	52
CCOC(=O)[C@@H](CO)NC(=O)COc1cccc(Br)c1C#N	ZINC000450524675	FC	On-Demand	Mild	RPS27	41	32
CCOC(=O)[C@H](CO)NC(=O)COc1cccc(Br)c1C#N	ZINC000450524676	FC	On-Demand	Mild	RPS27	41	32
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	ACE	18	42
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	MME	23	43
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	EDNRB	21	45
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	EDNRA	40	41
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	TACR1	25	40
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	CCKAR	61	44
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	NMBR	69	33
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	MMP2	20	40
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	MMP8	32	40
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	GRPR	61	33
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	ECE1	56	42
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	SSTR3	40	38
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	MMP11	64	32
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	CCKBR	57	44
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	GHSR	66	41
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	MC1R	51	37
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	NPR	29	41
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524683	DG	On-Demand	Anodyne	SLC15A2	0	46
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	ACE	18	42
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	MME	23	43
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	EDNRB	21	45
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	EDNRA	40	41
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	TACR1	25	40
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	CCKAR	61	44
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	NMBR	69	33
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	MMP2	20	40
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	MMP8	32	40
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	GRPR	61	33
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	ECE1	56	42
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	SSTR3	40	38
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	MMP11	64	32
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	CCKBR	57	44
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	GHSR	66	41
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	MC1R	51	37
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	NPR	29	41
C[C@@H]1CCC[C@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524684	DG	On-Demand	Anodyne	SLC15A2	0	46
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	ACE	18	42
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	MME	23	43
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	EDNRB	21	45
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	EDNRA	40	41
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	TACR1	25	40
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	CCKAR	61	44
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	NMBR	69	33
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	MMP2	20	40
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	MMP8	32	40
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	GRPR	61	33
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	ECE1	56	42
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	SSTR3	40	38
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	MMP11	64	32
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	CCKBR	57	44
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	GHSR	66	41
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	MC1R	51	37
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	NPR	29	41
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524685	DG	On-Demand	Anodyne	SLC15A2	0	46
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	ACE	18	42
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	MME	23	43
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	EDNRB	21	45
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	EDNRA	40	41
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	TACR1	25	40
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	CCKAR	61	44
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	NMBR	69	33
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	MMP2	20	40
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	MMP8	32	40
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	GRPR	61	33
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	ECE1	56	42
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	SSTR3	40	38
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	MMP11	64	32
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	CCKBR	57	44
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	GHSR	66	41
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	MC1R	51	37
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	NPR	29	41
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450524686	DG	On-Demand	Anodyne	SLC15A2	0	46
Cc1nc(C)n(CCCC(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450524689	GG	On-Demand	Anodyne	RBP4	73	40
Cc1nc(C)n(CCCC(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450524690	GG	On-Demand	Anodyne	RBP4	73	40
CNC(=O)[C@@H]1CN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CCO1	ZINC000450524691	GD	On-Demand	Anodyne	HPGD	57	65
CNC(=O)[C@H]1CN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CCO1	ZINC000450524692	GD	On-Demand	Anodyne	HPGD	57	65
O=C(N[C@@H](CCO)c1ccccc1Br)c1cc2c([nH]1)CCCC2	ZINC000450524703	GH	On-Demand	Anodyne	CTSA	55	36
O=C(N[C@H](CCO)c1ccccc1Br)c1cc2c([nH]1)CCCC2	ZINC000450524704	GH	On-Demand	Anodyne	CTSA	55	36
CO[C@H](Cc1ccccc1)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450524710	GH	On-Demand	Anodyne	RBP4	84	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450524711	GH	On-Demand	Anodyne	RBP4	84	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450524712	GH	On-Demand	Anodyne	RBP4	84	41
CO[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450524713	GH	On-Demand	Anodyne	RBP4	84	41
COC(=O)C1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCOCC1	ZINC000450524714	ED	On-Demand	Anodyne	HCN1	62	38
COC(=O)C1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCOCC1	ZINC000450524714	ED	On-Demand	Anodyne	HCN4	49	33
COC(=O)C1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCOCC1	ZINC000450524715	ED	On-Demand	Anodyne	HCN1	62	38
COC(=O)C1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCOCC1	ZINC000450524715	ED	On-Demand	Anodyne	HCN4	49	33
CC(C)c1nnc(N(C)CCN2CCN(Cc3ccccc3)CC2)o1	ZINC000450524720	EE	On-Demand	Anodyne	SIGMAR1	43	42
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	HTR1A	19	67
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	DRD2	36	47
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	DRD1	24	49
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	DRD4	29	49
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	HRH2	17	40
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	HTR2A	34	62
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	HTR2C	29	67
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	HRH1	16	52
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	ADRA1B	16	44
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	DRD3	17	52
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	DRD5	15	45
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	HTR7	17	47
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	HRH3	21	40
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	SIGMAR1	23	51
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	CCR3	34	52
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	SLC18A3	17	45
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	EPHX2	42	48
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	MCHR1	15	45
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	WNT3A	47	33
O=C(CCCN1CCC(C(=O)NC2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450524724	FH	On-Demand	Anodyne	AP2S1	0	47
CC(C)C[C@H](NC(=O)CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450524729	FD	On-Demand	Anodyne	OPRM1	0	45
CC(C)C[C@H](NC(=O)CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450524729	FD	On-Demand	Anodyne	OPRD1	0	45
CC(C)C[C@H](NC(=O)CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450524729	FD	On-Demand	Anodyne	FOLH1	52	36
CC(C)C[C@H](NC(=O)CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450524729	FD	On-Demand	Anodyne	PDYN	0	45
CC(C)C[C@H](NC(=O)CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450524729	FD	On-Demand	Anodyne	SLC15A2	0	43
CN(CCN1CCN(Cc2ccccc2)CC1)c1ncc(C(F)F)cn1	ZINC000450524741	FF	On-Demand	Anodyne	SIGMAR1	37	43
CCOC(=O)[C@@H](CO)NC(=O)c1cnn2ccc(C)cc12	ZINC000450524742	CC	On-Demand	Anodyne	EPHB3	35	50
CCOC(=O)[C@H](CO)NC(=O)c1cnn2ccc(C)cc12	ZINC000450524743	CC	On-Demand	Anodyne	EPHB3	35	50
CS(=O)(=O)NCC1CCN(c2nccc3c([N+](=O)[O-])cccc23)CC1	ZINC000450524748	FD	On-Demand	Bother	NPY2R	0	45
O=C(Cc1ccc(Cl)c(F)c1)NCC1(C(=O)O)CC1	ZINC000450524763	CE	On-Demand	Anodyne	ENV	44	33
O=C(Cc1ccc(Cl)c(F)c1)NCC1(C(=O)O)CC1	ZINC000450524763	CE	On-Demand	Anodyne	NCE103	26	40
CCOC(=O)[C@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450524764	FD	On-Demand	Anodyne	ACACA	34	40
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450524765	FD	On-Demand	Anodyne	ACACA	34	40
CC(C)c1ccoc1C(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450524767	DH	On-Demand	Anodyne	DPEP1	41	32
CC(C)c1ccoc1C(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450524767	DH	On-Demand	Anodyne	MMP2	51	32
CC(C)c1ccoc1C(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450524767	DH	On-Demand	Anodyne	REN	51	36
CC(C)c1ccoc1C(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450524768	DH	On-Demand	Anodyne	DPEP1	41	32
CC(C)c1ccoc1C(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450524768	DH	On-Demand	Anodyne	MMP2	51	32
CC(C)c1ccoc1C(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450524768	DH	On-Demand	Anodyne	REN	51	36
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccc(OC)c(OC)c2Cl)c1	ZINC000450524778	GG	On-Demand	Anodyne	SLC9A1	50	32
C[C@@H](NC(=O)CCCc1cc(F)ccc1F)[C@@H](C)C(=O)O	ZINC000450524781	CF	On-Demand	Anodyne	MPO	18	41
C[C@H](NC(=O)CCCc1cc(F)ccc1F)[C@H](C)C(=O)O	ZINC000450524782	CF	On-Demand	Anodyne	MPO	18	41
C[C@H](C(=O)O)[C@@H](C)NC(=O)CCCc1cc(F)ccc1F	ZINC000450524783	CF	On-Demand	Anodyne	MPO	18	41
C[C@H](NC(=O)CCCc1cc(F)ccc1F)[C@@H](C)C(=O)O	ZINC000450524784	CF	On-Demand	Anodyne	MPO	18	41
COc1ccc2c(c1)OC[C@@H](NC(=O)C(C)(C)C1CCC1)C2	ZINC000450524798	DF	On-Demand	Anodyne	MTNR1A	22	41
COc1ccc2c(c1)OC[C@H](NC(=O)C(C)(C)C1CCC1)C2	ZINC000450524799	DF	On-Demand	Anodyne	MTNR1A	22	41
NS(=O)(=O)CCOCCNc1ncnc2cc(Br)ccc12	ZINC000450524816	GC	On-Demand	Anodyne	EGFR	52	37
COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450524819	GF	On-Demand	Anodyne	OPRK1	27	49
COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450524819	GF	On-Demand	Anodyne	ABCC8	21	44
COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450524819	GF	On-Demand	Anodyne	TRPV1	27	43
COc1ccc([C@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450524819	GF	On-Demand	Anodyne	RORC	46	39
COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450524820	GF	On-Demand	Anodyne	OPRK1	27	49
COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450524820	GF	On-Demand	Anodyne	ABCC8	21	44
COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450524820	GF	On-Demand	Anodyne	TRPV1	27	43
COc1ccc([C@@H](CN2CCCC2)NC(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450524820	GF	On-Demand	Anodyne	RORC	46	39
O=C(O)COCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450524837	CD	On-Demand	Anodyne	NCE103	29	49
O=C(O)COCCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450524837	CD	On-Demand	Anodyne	P96878_MYCTU	20	45
CC(C)CN(Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450524839	DH	On-Demand	Anodyne	CETP	0	42
CC(C)CN(Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450524839	DH	On-Demand	Anodyne	NR1H3	0	45
CC(C)CN(Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450524839	DH	On-Demand	Anodyne	RORC	40	50
CC(C)CN(Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450524839	DH	On-Demand	Anodyne	RORB	0	50
COC[C@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450524845	ED	On-Demand	Anodyne	PDE4B	19	44
COC[C@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450524845	ED	On-Demand	Anodyne	PDE4D	17	44
COC[C@@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450524846	ED	On-Demand	Anodyne	PDE4B	19	44
COC[C@@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450524846	ED	On-Demand	Anodyne	PDE4D	17	44
CC(C)(C)NC(=O)N1CCC(NC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450524854	FF	On-Demand	Anodyne	EPHX2	37	45
CC(C)(C)NC(=O)N1CCC(NC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450524854	FF	On-Demand	Anodyne	SFRP1	88	38
CC(C)(C)NC(=O)N1CCC(NC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450524854	FF	On-Demand	Anodyne	WNT3	69	34
CC(C)(C)NC(=O)N1CCC(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450524855	FF	On-Demand	Anodyne	EPHX2	37	45
CC(C)(C)NC(=O)N1CCC(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450524855	FF	On-Demand	Anodyne	SFRP1	88	38
CC(C)(C)NC(=O)N1CCC(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450524855	FF	On-Demand	Anodyne	WNT3	69	34
COc1cccc(OCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1	ZINC000450524858	GH	On-Demand	Anodyne	HTR1A	16	52
COc1cccc(OCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1	ZINC000450524858	GH	On-Demand	Anodyne	DRD4	45	36
COc1cccc(OCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1	ZINC000450524858	GH	On-Demand	Anodyne	HRH2	19	41
COc1cccc(OCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1	ZINC000450524858	GH	On-Demand	Anodyne	NPY2R	17	40
COc1cccc(OCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1	ZINC000450524858	GH	On-Demand	Anodyne	MTNR1A	26	42
COc1cccc(OCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1	ZINC000450524858	GH	On-Demand	Anodyne	MTNR1B	31	47
COc1cccc(OCCC(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1	ZINC000450524858	GH	On-Demand	Anodyne	ABCB1	15	41
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	DRD3	25	40
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	HTR4	40	43
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	CYSLTR1	55	36
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	LTB4R	18	40
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	PDE4D	18	41
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	PYGL	15	47
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	PTGDR	19	40
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	NCE103	16	42
COc1cc(C(=O)O)ccc1CCNC(=O)c1cc(OC)c(OC)cc1Cl	ZINC000450524859	GG	On-Demand	Anodyne	CAN2	0	42
CCC[C@@H](OC)C(=O)NCC(C)(C)C#N	ZINC000450524863	BD	On-Demand	Mild	PAPA1_CARPA	16	43
CCC[C@H](OC)C(=O)NCC(C)(C)C#N	ZINC000450524864	BD	On-Demand	Mild	PAPA1_CARPA	16	43
CC[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524867	DH	On-Demand	Anodyne	NPR1	43	36
CC[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524867	DH	On-Demand	Anodyne	TPH1	40	39
CC[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524867	DH	On-Demand	Anodyne	CASP1	42	34
CC[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524867	DH	On-Demand	Anodyne	CAPN2	68	40
CC[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524867	DH	On-Demand	Anodyne	ACE2	30	40
CC[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524867	DH	On-Demand	Anodyne	UTS2	35	43
CC[C@@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524867	DH	On-Demand	Anodyne	GPR88	0	42
CC[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524868	DH	On-Demand	Anodyne	MME	18	40
CC[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524868	DH	On-Demand	Anodyne	NPR1	52	36
CC[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524868	DH	On-Demand	Anodyne	TPH1	40	39
CC[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524868	DH	On-Demand	Anodyne	CASP1	47	40
CC[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524868	DH	On-Demand	Anodyne	CAPN2	68	40
CC[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524868	DH	On-Demand	Anodyne	ACE2	30	40
CC[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524868	DH	On-Demand	Anodyne	UTS2	36	43
CC[C@H](C)CC(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1	ZINC000450524868	DH	On-Demand	Anodyne	GPR88	0	42
CC(C)(C#N)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450524882	DE	On-Demand	Mild	PDE8B	46	31
CC(C)(C#N)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450524883	DE	On-Demand	Mild	PDE8B	46	31
COc1ccc(C(=O)N2CC[C@H](C(=O)O)[C@@H](C)C2)c(OC2CCCC2)c1	ZINC000450524887	FG	On-Demand	Anodyne	PDE4B	16	46
COc1ccc(C(=O)N2CC[C@H](C(=O)O)[C@@H](C)C2)c(OC2CCCC2)c1	ZINC000450524887	FG	On-Demand	Anodyne	RORC	41	37
COc1ccc(C(=O)N2CC[C@H](C(=O)O)[C@H](C)C2)c(OC2CCCC2)c1	ZINC000450524888	FG	On-Demand	Anodyne	PDE4B	16	46
COc1ccc(C(=O)N2CC[C@H](C(=O)O)[C@H](C)C2)c(OC2CCCC2)c1	ZINC000450524888	FG	On-Demand	Anodyne	RORC	41	37
COc1ccc(C(=O)N2CC[C@@H](C(=O)O)[C@H](C)C2)c(OC2CCCC2)c1	ZINC000450524889	FG	On-Demand	Anodyne	PDE4B	16	46
COc1ccc(C(=O)N2CC[C@@H](C(=O)O)[C@H](C)C2)c(OC2CCCC2)c1	ZINC000450524889	FG	On-Demand	Anodyne	RORC	41	37
COc1ccc(C(=O)N2CC[C@@H](C(=O)O)[C@@H](C)C2)c(OC2CCCC2)c1	ZINC000450524890	FG	On-Demand	Anodyne	PDE4B	16	46
COc1ccc(C(=O)N2CC[C@@H](C(=O)O)[C@@H](C)C2)c(OC2CCCC2)c1	ZINC000450524890	FG	On-Demand	Anodyne	RORC	41	37
CN(CC1CCOCC1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450524902	EE	On-Demand	Anodyne	PYGL	28	46
COCCCS(=O)(=O)c1ccc(NC(=O)[C@]2(COC)CCOC2)cc1	ZINC000450524909	FD	On-Demand	Anodyne	MMP13	26	45
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@]2(COC)CCOC2)cc1	ZINC000450524910	FD	On-Demand	Anodyne	MMP13	26	45
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)c1	ZINC000450524916	EG	On-Demand	Anodyne	P2RY12	26	40
CCOC(=O)c1cnc(C)c(NC(=O)[C@]2(C#N)CC23CCCC3)c1	ZINC000450524923	EF	On-Demand	Mild	P2RY12	24	40
CCOC(=O)c1cnc(C)c(NC(=O)[C@@]2(C#N)CC23CCCC3)c1	ZINC000450524926	EF	On-Demand	Mild	P2RY12	24	40
C[C@@H](O)C(C)(C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450524931	CD	On-Demand	Anodyne	NCE103	28	49
C[C@@H](O)C(C)(C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450524931	CD	On-Demand	Anodyne	CAN2	0	49
C[C@H](O)C(C)(C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450524935	CD	On-Demand	Anodyne	NCE103	28	49
C[C@H](O)C(C)(C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450524935	CD	On-Demand	Anodyne	CAN2	0	49
O=C(NCCc1cccs1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450524943	EF	On-Demand	Anodyne	ADAM17	0	42
O=C(NCCc1cccs1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450524947	EF	On-Demand	Anodyne	ADAM17	0	42
CCOC(=O)[C@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524949	EC	On-Demand	Anodyne	P2RY12	65	35
CCOC(=O)[C@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524949	EC	On-Demand	Anodyne	KLK3	57	34
CCOC(=O)[C@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524949	EC	On-Demand	Anodyne	CYSP_TRYCR	41	33
CCOC(=O)[C@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524949	EC	On-Demand	Anodyne	CAPN2	55	34
CCOC(=O)[C@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524949	EC	On-Demand	Anodyne	THYX_PBCV1	0	44
CN(C)S(=O)(=O)CC(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450524952	DC	On-Demand	Anodyne	CTSH	37	40
CCOC(=O)[C@@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524953	EC	On-Demand	Anodyne	P2RY12	65	35
CCOC(=O)[C@@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524953	EC	On-Demand	Anodyne	KLK3	57	34
CCOC(=O)[C@@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524953	EC	On-Demand	Anodyne	CYSP_TRYCR	41	33
CCOC(=O)[C@@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524953	EC	On-Demand	Anodyne	CAPN2	55	34
CCOC(=O)[C@@H](CO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450524953	EC	On-Demand	Anodyne	THYX_PBCV1	0	44
CN(C)S(=O)(=O)CC(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450524954	DC	On-Demand	Anodyne	CTSH	37	40
CCOC(=O)[C@@H](CO)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450524966	FD	On-Demand	Bother	CCR3	0	42
CCOC(=O)[C@@H](CO)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450524966	FD	On-Demand	Bother	PPXII	0	40
CCOC(=O)[C@H](CO)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450524968	FD	On-Demand	Bother	CCR3	0	42
CCOC(=O)[C@H](CO)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450524968	FD	On-Demand	Bother	PPXII	0	40
CCOC(=O)C(C)(C)C1CCN(c2ncc(Br)cc2C#N)CC1	ZINC000450524972	GH	On-Demand	Mild	P2RY12	52	43
COc1ccc([C@H](CN2CCCC2)NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450524986	FG	On-Demand	Anodyne	METAP1	23	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450524987	FG	On-Demand	Anodyne	METAP1	23	41
Cc1nc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)ncc1[N+](=O)[O-]	ZINC000450525007	FE	On-Demand	Bother	MAPK9	19	41
Cc1nc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)ncc1[N+](=O)[O-]	ZINC000450525007	FE	On-Demand	Bother	CDK2	15	41
Cc1nc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)ncc1[N+](=O)[O-]	ZINC000450525007	FE	On-Demand	Bother	MAPK8	16	41
CC(C)c1cc(C(=O)N[C@H](CC2CCCCC2)C(=O)O)no1	ZINC000450525008	DF	On-Demand	Anodyne	DPEP1	41	35
CC(C)c1cc(C(=O)N[C@H](CC2CCCCC2)C(=O)O)no1	ZINC000450525008	DF	On-Demand	Anodyne	CTSS	28	43
CC(C)c1cc(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)no1	ZINC000450525009	DF	On-Demand	Anodyne	DPEP1	41	35
CC(C)c1cc(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)no1	ZINC000450525009	DF	On-Demand	Anodyne	CTSS	28	43
c1ccc(CN2CC[C@H](N3CCN(c4nc(C5CCC5)no4)CC3)C2)cc1	ZINC000450525020	FF	On-Demand	Anodyne	SLC18A3	16	42
c1ccc(CN2CC[C@@H](N3CCN(c4nc(C5CCC5)no4)CC3)C2)cc1	ZINC000450525021	FF	On-Demand	Anodyne	SLC18A3	16	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450525033	CB	On-Demand	Anodyne	KLK3	54	32
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450525033	CB	On-Demand	Anodyne	CAPN2	42	35
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450525033	CB	On-Demand	Anodyne	ACE2	40	32
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450525033	CB	On-Demand	Anodyne	METAP2	22	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450525034	CB	On-Demand	Anodyne	KLK3	54	32
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450525034	CB	On-Demand	Anodyne	CAPN2	42	35
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450525034	CB	On-Demand	Anodyne	ACE2	40	32
CCOC(=O)[C@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450525034	CB	On-Demand	Anodyne	METAP2	22	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450525035	CB	On-Demand	Anodyne	KLK3	54	32
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450525035	CB	On-Demand	Anodyne	CAPN2	42	35
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450525035	CB	On-Demand	Anodyne	ACE2	40	32
CCOC(=O)[C@@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450525035	CB	On-Demand	Anodyne	METAP2	22	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450525036	CB	On-Demand	Anodyne	KLK3	54	32
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450525036	CB	On-Demand	Anodyne	CAPN2	42	35
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450525036	CB	On-Demand	Anodyne	ACE2	40	32
CCOC(=O)[C@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450525036	CB	On-Demand	Anodyne	METAP2	22	40
C[C@H](O)C(C)(C)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450525038	ED	On-Demand	Mild	AR	15	44
C[C@H](O)C(C)(C)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450525039	ED	On-Demand	Mild	AR	15	44
C[C@@H](O)C(C)(C)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450525040	ED	On-Demand	Mild	AR	15	44
C[C@@H](O)C(C)(C)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450525041	ED	On-Demand	Mild	AR	15	44
COc1cccc2c1CCN(C(=O)CSC1CC1)C2	ZINC000450525043	CE	On-Demand	Anodyne	SSTR2	42	38
COc1cccc2c1CCN(C(=O)CSC1CC1)C2	ZINC000450525043	CE	On-Demand	Anodyne	SSTR1	46	34
COc1ccc(C2CCN(C(=O)c3cc(C(=O)O)cc([N+](=O)[O-])c3)CC2)cc1	ZINC000450525046	GG	On-Demand	Bother	SLC18A3	23	42
COc1ccc(C2CCN(C(=O)c3cc(C(=O)O)cc([N+](=O)[O-])c3)CC2)cc1	ZINC000450525046	GG	On-Demand	Bother	MGLL	0	46
COc1ccc(C2CCN(C(=O)c3cc(C(=O)O)cc([N+](=O)[O-])c3)CC2)cc1	ZINC000450525046	GG	On-Demand	Bother	ABHD6	0	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	ACE	17	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	OPRM1	0	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	OPRD1	0	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	MME	23	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	EDNRB	40	35
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	TACR1	30	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	MC4R	50	43
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	TACR2	0	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	CCKAR	91	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	BRS3	29	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	TIMP3	50	38
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	NMBR	58	33
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	MC3R	64	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	MC5R	65	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	MMP14	81	38
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	GRPR	74	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	ECE1	54	43
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	MMP11	78	38
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	CCKBR	70	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	GHSR	70	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	MC1R	93	43
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	SLC15A2	0	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	KISS1R	62	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525049	GH	On-Demand	Anodyne	LASB	0	41
Cc1ccc(F)c(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450525051	FE	On-Demand	Anodyne	FBP1	19	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	ACE	17	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	OPRM1	0	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	OPRD1	0	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	MME	23	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	EDNRB	40	35
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	TACR1	30	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	MC4R	50	43
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	TACR2	0	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	CCKAR	91	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	BRS3	29	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	TIMP3	50	38
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	NMBR	58	33
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	MC3R	64	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	MC5R	65	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	MMP14	81	38
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	GRPR	74	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	ECE1	54	43
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	MMP11	78	38
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	CCKBR	70	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	GHSR	70	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	MC1R	93	43
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	SLC15A2	0	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	KISS1R	62	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450525054	GH	On-Demand	Anodyne	LASB	0	41
Cn1c(C#N)ccc1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450525057	FG	On-Demand	Mild	RBP4	69	39
Cn1c(C#N)ccc1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450525064	FG	On-Demand	Mild	RBP4	69	39
O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450525072	FH	On-Demand	Anodyne	CHRM3	20	42
O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450525072	FH	On-Demand	Anodyne	SIGMAR1	26	57
O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450525072	FH	On-Demand	Anodyne	SSTR5	44	37
O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450525072	FH	On-Demand	Anodyne	EPHX2	44	52
O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450525072	FH	On-Demand	Anodyne	CACNA1G	31	40
O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450525072	FH	On-Demand	Anodyne	HCN1	41	33
O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450525072	FH	On-Demand	Anodyne	HCN4	42	33
O=C(NC1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450525072	FH	On-Demand	Anodyne	SCARB1	41	35
O=C(O)Cn1cc(CNC(=O)CCCc2cc(F)ccc2F)nn1	ZINC000450525073	ED	On-Demand	Anodyne	SUCNR1	45	35
O=C(N[C@H](CO)C1CCOCC1)c1cc2cccnc2s1	ZINC000450525087	DD	On-Demand	Anodyne	MAPK1	40	33
O=C(N[C@@H](CO)C1CCOCC1)c1cc2cccnc2s1	ZINC000450525088	DD	On-Demand	Anodyne	MAPK1	40	33
CCN(CC)CCCC1CCN(C(=O)[C@H](C)Oc2ccccn2)CC1	ZINC000450525089	EG	On-Demand	Anodyne	AMY2	40	36
CCN(CC)CCCC1CCN(C(=O)[C@@H](C)Oc2ccccn2)CC1	ZINC000450525090	EG	On-Demand	Anodyne	AMY2	40	36
NC(=O)c1cnc(N[C@@H]2CCCN(CC(F)(F)F)C2)c(Cl)c1	ZINC000450525091	EE	On-Demand	Anodyne	HPGDS	33	40
NC(=O)c1cnc(N[C@H]2CCCN(CC(F)(F)F)C2)c(Cl)c1	ZINC000450525092	EE	On-Demand	Anodyne	HPGDS	33	40
CCOc1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)ccc1OCC(=O)O	ZINC000450525095	GF	On-Demand	Anodyne	AVPR1A	17	43
CCOc1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)ccc1OCC(=O)O	ZINC000450525096	GF	On-Demand	Anodyne	AVPR1A	17	43
COc1cccc2c1CCN(C(=O)[C@@H]1CC13CCSCC3)C2	ZINC000450525101	DG	On-Demand	Anodyne	SSTR1	46	34
COc1cccc2c1CCN(C(=O)[C@H]1CC13CCSCC3)C2	ZINC000450525102	DG	On-Demand	Anodyne	SSTR1	46	34
CCN(CC)CCCC1CCN(C(=O)CCCn2nc(C)nc2C)CC1	ZINC000450525105	FG	On-Demand	Anodyne	GNAI1	0	40
CCN(CC)CCCC1CCN(C(=O)CCCn2nc(C)nc2C)CC1	ZINC000450525105	FG	On-Demand	Anodyne	GNAI3	0	44
CCN(CC)CCCC1CCN(C(=O)CCCn2nc(C)nc2C)CC1	ZINC000450525105	FG	On-Demand	Anodyne	GNAO1	0	40
CC(C)(CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)OCCO	ZINC000450525115	EE	On-Demand	Bother	MAOB	21	49
O[C@@H]1CCCCC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450525116	EG	On-Demand	Anodyne	EGFR	32	41
COc1ccc(-c2ccnc(NC[C@H]3CCC[C@@H](CO)C3)n2)cc1	ZINC000450525125	EG	On-Demand	Anodyne	CLK4	22	49
COc1ccc(-c2ccnc(NC[C@H]3CCC[C@@H](CO)C3)n2)cc1	ZINC000450525125	EG	On-Demand	Anodyne	VCP	59	49
Cc1ccc(C(=O)NC2CCN(CC/C=C\c3ccccc3)CC2)s1	ZINC000450525130	FI	On-Demand	Anodyne	DRD2	19	51
Cc1ccc(C(=O)NC2CCN(CC/C=C\c3ccccc3)CC2)s1	ZINC000450525130	FI	On-Demand	Anodyne	DRD4	23	40
Cc1ccc(C(=O)NC2CCN(CC/C=C\c3ccccc3)CC2)s1	ZINC000450525130	FI	On-Demand	Anodyne	DRD3	26	51
Cc1ccc(C(=O)NC2CCN(CC/C=C\c3ccccc3)CC2)s1	ZINC000450525130	FI	On-Demand	Anodyne	SIGMAR1	18	48
Cc1ccc(C(=O)NC2CCN(CC/C=C\c3ccccc3)CC2)s1	ZINC000450525130	FI	On-Demand	Anodyne	SLC6A5	48	36
Cc1ccc(C(=O)NC2CCN(CC/C=C\c3ccccc3)CC2)s1	ZINC000450525130	FI	On-Demand	Anodyne	MCHR1	21	50
Cc1ccc(C(=O)NC2CCN(CC/C=C/c3ccccc3)CC2)s1	ZINC000450525131	FI	On-Demand	Anodyne	DRD2	19	51
Cc1ccc(C(=O)NC2CCN(CC/C=C/c3ccccc3)CC2)s1	ZINC000450525131	FI	On-Demand	Anodyne	DRD4	23	40
Cc1ccc(C(=O)NC2CCN(CC/C=C/c3ccccc3)CC2)s1	ZINC000450525131	FI	On-Demand	Anodyne	DRD3	26	51
Cc1ccc(C(=O)NC2CCN(CC/C=C/c3ccccc3)CC2)s1	ZINC000450525131	FI	On-Demand	Anodyne	SIGMAR1	18	48
Cc1ccc(C(=O)NC2CCN(CC/C=C/c3ccccc3)CC2)s1	ZINC000450525131	FI	On-Demand	Anodyne	SLC6A5	48	36
Cc1ccc(C(=O)NC2CCN(CC/C=C/c3ccccc3)CC2)s1	ZINC000450525131	FI	On-Demand	Anodyne	MCHR1	21	50
N#CC1(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)CCC1	ZINC000450525164	EH	On-Demand	Mild	CACNA1H	39	40
N#CC1(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)CCC1	ZINC000450525164	EH	On-Demand	Mild	PYGL	0	49
N#CC1(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)CCC1	ZINC000450525164	EH	On-Demand	Mild	FAAH	18	50
COc1ccc2c(N3CC[C@H](COC(F)F)C3)c([N+](=O)[O-])cnc2c1	ZINC000450525175	FG	On-Demand	Bother	PDE3A	40	33
COc1ccc2c(N3CC[C@H](COC(F)F)C3)c([N+](=O)[O-])cnc2c1	ZINC000450525175	FG	On-Demand	Bother	PDE3B	55	33
COc1ccc2c(N3CC[C@@H](COC(F)F)C3)c([N+](=O)[O-])cnc2c1	ZINC000450525176	FG	On-Demand	Bother	PDE3A	40	33
COc1ccc2c(N3CC[C@@H](COC(F)F)C3)c([N+](=O)[O-])cnc2c1	ZINC000450525176	FG	On-Demand	Bother	PDE3B	55	33
O=C(CCc1ccoc1)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450525193	CF	On-Demand	Anodyne	DPEP1	41	32
O=C(CCc1ccoc1)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450525193	CF	On-Demand	Anodyne	PGC	44	31
O=C(CCc1ccoc1)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450525193	CF	On-Demand	Anodyne	MMP2	74	36
O=C(CCc1ccoc1)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450525193	CF	On-Demand	Anodyne	PAM	0	41
O=C(CCc1ccoc1)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450525194	CF	On-Demand	Anodyne	DPEP1	41	32
O=C(CCc1ccoc1)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450525194	CF	On-Demand	Anodyne	PGC	44	31
O=C(CCc1ccoc1)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450525194	CF	On-Demand	Anodyne	MMP2	74	36
O=C(CCc1ccoc1)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450525194	CF	On-Demand	Anodyne	PAM	0	41
COc1cccc(OCCC(=O)NCc2cccc(OC(C)(C)C)n2)c1	ZINC000450525197	FG	On-Demand	Anodyne	MTNR1A	52	42
COc1cccc(OCCC(=O)NCc2cccc(OC(C)(C)C)n2)c1	ZINC000450525197	FG	On-Demand	Anodyne	MTNR1B	44	42
CN(C)S(=O)(=O)c1cc(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)n(C)c1	ZINC000450525204	GD	On-Demand	Anodyne	CTSS	22	40
CN(C)S(=O)(=O)c1cc(C(=O)N[C@H](CC2CCCCC2)C(=O)O)n(C)c1	ZINC000450525205	GD	On-Demand	Anodyne	CTSS	22	40
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1	ZINC000450525206	GD	On-Demand	Anodyne	MMP2	15	42
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1	ZINC000450525206	GD	On-Demand	Anodyne	MMP3	17	42
C[C@@H]1CC[C@@]2(CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525222	DH	On-Demand	Anodyne	ERBB2	0	41
C[C@@H]1CC[C@@]2(CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525222	DH	On-Demand	Anodyne	MMP2	0	41
C[C@@H]1CC[C@@]2(CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525222	DH	On-Demand	Anodyne	ADAM10	39	40
C[C@@H]1CC[C@]2(CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525223	DH	On-Demand	Anodyne	ERBB2	0	41
C[C@@H]1CC[C@]2(CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525223	DH	On-Demand	Anodyne	MMP2	0	41
C[C@@H]1CC[C@]2(CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525223	DH	On-Demand	Anodyne	ADAM10	39	40
C[C@@H]1CC[C@@]2(CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525224	DH	On-Demand	Anodyne	ERBB2	0	41
C[C@@H]1CC[C@@]2(CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525224	DH	On-Demand	Anodyne	MMP2	0	41
C[C@@H]1CC[C@@]2(CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525224	DH	On-Demand	Anodyne	ADAM10	39	40
C[C@@H]1CC[C@]2(CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525225	DH	On-Demand	Anodyne	ERBB2	0	41
C[C@@H]1CC[C@]2(CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525225	DH	On-Demand	Anodyne	MMP2	0	41
C[C@@H]1CC[C@]2(CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)C1	ZINC000450525225	DH	On-Demand	Anodyne	ADAM10	39	40
COc1ccc(-c2ccnc(NC[C@H]3CCOC[C@@H]3C)n2)cc1	ZINC000450525239	DG	On-Demand	Anodyne	MAPK1	49	38
COc1ccc(-c2ccnc(NC[C@H]3CCOC[C@@H]3C)n2)cc1	ZINC000450525239	DG	On-Demand	Anodyne	CLK4	25	52
COc1ccc(-c2ccnc(NC[C@H]3CCOC[C@@H]3C)n2)cc1	ZINC000450525239	DG	On-Demand	Anodyne	VCP	20	42
COc1ccc(-c2ccnc(NC[C@@H]3CCOC[C@H]3C)n2)cc1	ZINC000450525240	DG	On-Demand	Anodyne	MAPK1	49	38
COc1ccc(-c2ccnc(NC[C@@H]3CCOC[C@H]3C)n2)cc1	ZINC000450525240	DG	On-Demand	Anodyne	CLK4	25	52
COc1ccc(-c2ccnc(NC[C@@H]3CCOC[C@H]3C)n2)cc1	ZINC000450525240	DG	On-Demand	Anodyne	VCP	20	42
COc1ccc(-c2ccnc(NC[C@H]3CCOC[C@H]3C)n2)cc1	ZINC000450525241	DG	On-Demand	Anodyne	MAPK1	49	38
COc1ccc(-c2ccnc(NC[C@H]3CCOC[C@H]3C)n2)cc1	ZINC000450525241	DG	On-Demand	Anodyne	CLK4	25	52
COc1ccc(-c2ccnc(NC[C@H]3CCOC[C@H]3C)n2)cc1	ZINC000450525241	DG	On-Demand	Anodyne	VCP	20	42
COc1ccc(-c2ccnc(NC[C@@H]3CCOC[C@@H]3C)n2)cc1	ZINC000450525242	DG	On-Demand	Anodyne	MAPK1	49	38
COc1ccc(-c2ccnc(NC[C@@H]3CCOC[C@@H]3C)n2)cc1	ZINC000450525242	DG	On-Demand	Anodyne	CLK4	25	52
COc1ccc(-c2ccnc(NC[C@@H]3CCOC[C@@H]3C)n2)cc1	ZINC000450525242	DG	On-Demand	Anodyne	VCP	20	42
CCOc1cc(C(=O)N[C@@H](CN2CCCC2)c2ccc(OC)cc2)on1	ZINC000450525243	FF	On-Demand	Anodyne	OPRK1	0	44
CCOc1cc(C(=O)N[C@H](CN2CCCC2)c2ccc(OC)cc2)on1	ZINC000450525244	FF	On-Demand	Anodyne	OPRK1	0	44
CC(=O)c1nc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)sc1C	ZINC000450525258	FH	On-Demand	Anodyne	NPFFR1	40	33
CC(=O)c1nc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)sc1C	ZINC000450525259	FH	On-Demand	Anodyne	NPFFR1	40	33
COc1cccc2c(N3CC[C@@H](COC(F)F)C3)nccc12	ZINC000450525260	DG	On-Demand	Anodyne	PDE3A	48	41
COc1cccc2c(N3CC[C@@H](COC(F)F)C3)nccc12	ZINC000450525260	DG	On-Demand	Anodyne	PDE3B	72	41
COc1cccc2c(N3CC[C@H](COC(F)F)C3)nccc12	ZINC000450525261	DG	On-Demand	Anodyne	PDE3A	48	41
COc1cccc2c(N3CC[C@H](COC(F)F)C3)nccc12	ZINC000450525261	DG	On-Demand	Anodyne	PDE3B	72	41
CCSc1cccnc1C(=O)N[C@H]1COc2cc(OC)ccc2C1	ZINC000450525262	EF	On-Demand	Anodyne	MTNR1A	19	42
CCSc1cccnc1C(=O)N[C@@H]1COc2cc(OC)ccc2C1	ZINC000450525263	EF	On-Demand	Anodyne	MTNR1A	19	42
COc1nccc(CN2c3ccccc3C[C@H]2C(N)=O)n1	ZINC000450525269	CC	On-Demand	Anodyne	TPP2	53	32
Cc1ccc(C(=O)NC2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450525271	FH	On-Demand	Anodyne	DRD4	25	47
Cc1ccc(C(=O)NC2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450525271	FH	On-Demand	Anodyne	SIGMAR1	21	41
Cc1ccc(C(=O)NC2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450525271	FH	On-Demand	Anodyne	SSTR5	49	42
Cc1ccc(C(=O)NC2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450525271	FH	On-Demand	Anodyne	CCR3	20	41
Cc1ccc(C(=O)NC2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450525271	FH	On-Demand	Anodyne	MCHR1	31	44
C[C@H](Sc1ccccc1C(=O)N1CC[C@]2(C1)OCc1ccccc12)C(=O)O	ZINC000450525276	GH	On-Demand	Anodyne	AVPR1A	21	49
C[C@H](Sc1ccccc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12)C(=O)O	ZINC000450525277	GH	On-Demand	Anodyne	AVPR1A	21	49
C[C@@H](Sc1ccccc1C(=O)N1CC[C@]2(C1)OCc1ccccc12)C(=O)O	ZINC000450525278	GH	On-Demand	Anodyne	AVPR1A	21	49
C[C@@H](Sc1ccccc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12)C(=O)O	ZINC000450525279	GH	On-Demand	Anodyne	AVPR1A	21	49
Cc1nc(NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)ncc1[N+](=O)[O-]	ZINC000450525285	FG	On-Demand	Bother	PRKCQ	42	38
Cc1nc(NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)ncc1[N+](=O)[O-]	ZINC000450525286	FG	On-Demand	Bother	PRKCQ	42	38
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@@H]2CCCCN2C2CCCC2)c1	ZINC000450525289	GE	On-Demand	Anodyne	F2	28	40
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@@H]2CCCCN2C2CCCC2)c1	ZINC000450525289	GE	On-Demand	Anodyne	FKBP1A	39	42
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@@H]2CCCCN2C2CCCC2)c1	ZINC000450525289	GE	On-Demand	Anodyne	PREP	15	42
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@@H]2CCCCN2C2CCCC2)c1	ZINC000450525289	GE	On-Demand	Anodyne	TMPRSS11D	65	36
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@H]2CCCCN2C2CCCC2)c1	ZINC000450525290	GE	On-Demand	Anodyne	F2	28	40
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@H]2CCCCN2C2CCCC2)c1	ZINC000450525290	GE	On-Demand	Anodyne	FKBP1A	39	42
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@H]2CCCCN2C2CCCC2)c1	ZINC000450525290	GE	On-Demand	Anodyne	PREP	15	42
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@H]2CCCCN2C2CCCC2)c1	ZINC000450525290	GE	On-Demand	Anodyne	TMPRSS11D	65	36
Cc1cc(F)c(CC(=O)N[C@@H](CO)C2CCOCC2)cc1F	ZINC000450525292	DD	On-Demand	Anodyne	LEF	20	43
Cc1cc(F)c(CC(=O)N[C@H](CO)C2CCOCC2)cc1F	ZINC000450525293	DD	On-Demand	Anodyne	LEF	20	43
CCOC(=O)c1csc(N[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)n1	ZINC000450525317	GD	On-Demand	Anodyne	P2RY12	71	36
CCOC(=O)c1csc(N[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)n1	ZINC000450525317	GD	On-Demand	Anodyne	TGM2	46	40
CCOC(=O)c1csc(N[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)n1	ZINC000450525317	GD	On-Demand	Anodyne	F13A1	38	40
CCOC(=O)c1csc(N[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)n1	ZINC000450525317	GD	On-Demand	Anodyne	TRPC6	53	33
COc1ccc(C2CCN(C(=O)Cc3ccccc3C(=O)O)CC2)cc1	ZINC000450525318	FG	On-Demand	Anodyne	OXTR	0	41
COc1ccc(C2CCN(C(=O)Cc3ccccc3C(=O)O)CC2)cc1	ZINC000450525318	FG	On-Demand	Anodyne	SIGMAR1	17	45
COc1ccc(C2CCN(C(=O)Cc3ccccc3C(=O)O)CC2)cc1	ZINC000450525318	FG	On-Demand	Anodyne	CCR1	41	42
COc1ccc(C2CCN(C(=O)Cc3ccccc3C(=O)O)CC2)cc1	ZINC000450525318	FG	On-Demand	Anodyne	CCR3	19	50
COc1ccc(C2CCN(C(=O)Cc3ccccc3C(=O)O)CC2)cc1	ZINC000450525318	FG	On-Demand	Anodyne	AKR1C2	31	40
COc1ccc(C2CCN(C(=O)Cc3ccccc3C(=O)O)CC2)cc1	ZINC000450525318	FG	On-Demand	Anodyne	GPR183	0	46
COc1ccc(C2CCN(C(=O)CCCCC(=O)O)CC2)cc1	ZINC000450525332	DG	On-Demand	Anodyne	CHRM2	15	40
COc1ccc(C2CCN(C(=O)CCCCC(=O)O)CC2)cc1	ZINC000450525332	DG	On-Demand	Anodyne	MMP13	18	41
COc1ccc(C2CCN(C(=O)CCCCC(=O)O)CC2)cc1	ZINC000450525332	DG	On-Demand	Anodyne	MMP3	16	41
COc1ccc(C2CCN(C(=O)CCCCC(=O)O)CC2)cc1	ZINC000450525332	DG	On-Demand	Anodyne	MMP7	23	41
COc1ccc(C2CCN(C(=O)CCCCC(=O)O)CC2)cc1	ZINC000450525332	DG	On-Demand	Anodyne	ETHR	64	39
O=C(N[C@@H](CO)C1CCOCC1)c1cc(Cl)c2ccccc2n1	ZINC000450525336	EE	On-Demand	Anodyne	MAPK1	43	34
O=C(N[C@H](CO)C1CCOCC1)c1cc(Cl)c2ccccc2n1	ZINC000450525337	EE	On-Demand	Anodyne	MAPK1	43	34
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000450525345	CE	On-Demand	Anodyne	RARG	44	34
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000450525345	CE	On-Demand	Anodyne	RXRG	55	40
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000450525345	CE	On-Demand	Anodyne	RARB	45	37
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000450525345	CE	On-Demand	Anodyne	RXRA	40	40
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000450525345	CE	On-Demand	Anodyne	RXRB	53	35
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000450525346	CE	On-Demand	Anodyne	RARG	44	34
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000450525346	CE	On-Demand	Anodyne	RXRG	55	40
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000450525346	CE	On-Demand	Anodyne	RARB	45	37
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000450525346	CE	On-Demand	Anodyne	RXRA	40	40
CN(C(=O)Cc1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000450525346	CE	On-Demand	Anodyne	RXRB	53	35
CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C(=O)O)o1)[C@@H]1CC1(C)C	ZINC000450525351	FD	On-Demand	Anodyne	CCR4	0	43
CN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C(=O)O)o1)[C@H]1CC1(C)C	ZINC000450525352	FD	On-Demand	Anodyne	CCR4	0	43
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C(=O)O)o1)[C@H]1CC1(C)C	ZINC000450525353	FD	On-Demand	Anodyne	CCR4	0	43
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C(=O)O)o1)[C@@H]1CC1(C)C	ZINC000450525354	FD	On-Demand	Anodyne	CCR4	0	43
CC(C)C[C@H](NC(=O)CNC(=O)C1(C)CC1)C(=O)O	ZINC000450525367	CC	On-Demand	Anodyne	OPRD1	0	42
CC(C)C[C@H](NC(=O)CNC(=O)C1(C)CC1)C(=O)O	ZINC000450525367	CC	On-Demand	Anodyne	FOLH1	54	38
CC(C)C[C@H](NC(=O)CNC(=O)C1(C)CC1)C(=O)O	ZINC000450525367	CC	On-Demand	Anodyne	RIR1_HHV11	51	31
CC(C)C[C@H](NC(=O)CNC(=O)C1(C)CC1)C(=O)O	ZINC000450525367	CC	On-Demand	Anodyne	PDYN	0	42
CC(C)C[C@H](NC(=O)CNC(=O)C1(C)CC1)C(=O)O	ZINC000450525367	CC	On-Demand	Anodyne	GSP	0	41
CC(C)C[C@H](NC(=O)CNC(=O)C1(C)CC1)C(=O)O	ZINC000450525367	CC	On-Demand	Anodyne	SLC15A2	0	51
CC(C)C[C@H](NC(=O)CNC(=O)C1(C)CC1)C(=O)O	ZINC000450525367	CC	On-Demand	Anodyne	CFB	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)[C@@H](C)O	ZINC000450525368	CF	On-Demand	Anodyne	CCR2	32	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)[C@H](C)O	ZINC000450525369	CF	On-Demand	Anodyne	CCR2	32	41
O=C(NC1CCCCC1)C1CCN(CC2=CCCCC2)CC1	ZINC000450525375	DH	On-Demand	Anodyne	EPHX2	38	57
O=C(NC1CCCCC1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450525380	EH	On-Demand	Anodyne	EPHX2	29	46
O=C(NC1CCCCC1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450525381	EH	On-Demand	Anodyne	EPHX2	29	46
COCC[C@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525393	FE	On-Demand	Anodyne	PDE4A	34	42
COCC[C@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525393	FE	On-Demand	Anodyne	PDE4B	17	42
COCC[C@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525393	FE	On-Demand	Anodyne	PDE4D	18	42
COCC[C@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525393	FE	On-Demand	Anodyne	PDE4C	15	42
COCC[C@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525393	FE	On-Demand	Anodyne	NPPA	42	32
COCC[C@@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525394	FE	On-Demand	Anodyne	PDE4A	34	42
COCC[C@@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525394	FE	On-Demand	Anodyne	PDE4B	17	42
COCC[C@@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525394	FE	On-Demand	Anodyne	PDE4D	18	42
COCC[C@@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525394	FE	On-Demand	Anodyne	PDE4C	15	42
COCC[C@@H](NC(=O)c1ccc(OC)cc1OC1CCCC1)C(=O)O	ZINC000450525394	FE	On-Demand	Anodyne	NPPA	42	32
CC[C@H](C(=O)OC)N1CCN(c2cccc(C#N)c2[N+](=O)[O-])CC1	ZINC000450525395	ED	On-Demand	Mild	NPY2R	45	41
CC[C@@H](C(=O)OC)N1CCN(c2cccc(C#N)c2[N+](=O)[O-])CC1	ZINC000450525396	ED	On-Demand	Mild	NPY2R	45	41
OC[C@H]1CN(c2nccc3cc(C(F)(F)F)ccc23)CC[C@H]1C(F)(F)F	ZINC000450525407	GI	On-Demand	Anodyne	LIPG	49	33
OC[C@@H]1CN(c2nccc3cc(C(F)(F)F)ccc23)CC[C@@H]1C(F)(F)F	ZINC000450525408	GI	On-Demand	Anodyne	LIPG	49	33
OC[C@H]1CN(c2nccc3cc(C(F)(F)F)ccc23)CC[C@@H]1C(F)(F)F	ZINC000450525409	GI	On-Demand	Anodyne	LIPG	49	33
OC[C@@H]1CN(c2nccc3cc(C(F)(F)F)ccc23)CC[C@H]1C(F)(F)F	ZINC000450525410	GI	On-Demand	Anodyne	LIPG	49	33
C[C@H](O)C(C)(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450525411	CD	On-Demand	Anodyne	HPGDS	18	45
C[C@@H](O)C(C)(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450525412	CD	On-Demand	Anodyne	HPGDS	18	45
CCOC(=O)c1ccc(CN(C2CC2)[C@@H](C)c2ccccc2)nc1	ZINC000450525413	DH	On-Demand	Anodyne	P2RY12	29	45
CCOC(=O)c1ccc(CN(C2CC2)[C@H](C)c2ccccc2)nc1	ZINC000450525414	DH	On-Demand	Anodyne	P2RY12	29	45
Cc1cccc(Cl)c1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450525415	EI	On-Demand	Anodyne	CNR1	28	41
Cc1cccc(Cl)c1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450525415	EI	On-Demand	Anodyne	DRD4	26	43
Cc1cccc(Cl)c1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450525415	EI	On-Demand	Anodyne	DRD3	15	49
Cc1cccc(Cl)c1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450525415	EI	On-Demand	Anodyne	CNR2	24	40
Cc1cccc(Cl)c1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450525415	EI	On-Demand	Anodyne	SIGMAR1	24	65
Cc1cccc(Cl)c1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450525415	EI	On-Demand	Anodyne	P2RX7	15	42
Cc1cccc(Cl)c1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450525415	EI	On-Demand	Anodyne	EPHX2	52	68
Cc1cccc(Cl)c1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450525415	EI	On-Demand	Anodyne	PTGES	36	43
CC[C@@H](C)CC(=O)N1C[C@@H](C(=O)O)[C@H](c2ccccc2)C1	ZINC000450525426	CF	On-Demand	Anodyne	SLC6A1	25	40
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	DRD4	22	41
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	HRH3	25	49
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	SIGMAR1	31	71
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	SSTR5	61	42
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	CCR3	22	41
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	BDKRB1	46	41
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	EPHX2	48	56
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	MCHR1	42	39
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000450525428	GG	On-Demand	Anodyne	CACNA1G	38	44
COc1cccc(Oc2ccc(C(=O)NC(C)(C)[C@@H](C)O)nc2)c1	ZINC000450525431	EF	On-Demand	Anodyne	MTNR1B	24	43
COc1cccc(Oc2ccc(C(=O)NC(C)(C)[C@@H](C)O)nc2)c1	ZINC000450525431	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	29	40
COc1cccc(Oc2ccc(C(=O)NC(C)(C)[C@H](C)O)nc2)c1	ZINC000450525432	EF	On-Demand	Anodyne	MTNR1B	24	43
COc1cccc(Oc2ccc(C(=O)NC(C)(C)[C@H](C)O)nc2)c1	ZINC000450525432	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	29	40
C[C@H]1CSC[C@@H]1Nc1nc(N(C)C)c2ccccc2n1	ZINC000450525450	CF	On-Demand	Anodyne	ADRA2A	0	50
C[C@H]1CSC[C@H]1Nc1nc(N(C)C)c2ccccc2n1	ZINC000450525451	CF	On-Demand	Anodyne	ADRA2A	0	50
C[C@@H]1CSC[C@@H]1Nc1nc(N(C)C)c2ccccc2n1	ZINC000450525452	CF	On-Demand	Anodyne	ADRA2A	0	50
C[C@@H]1CSC[C@H]1Nc1nc(N(C)C)c2ccccc2n1	ZINC000450525453	CF	On-Demand	Anodyne	ADRA2A	0	50
CNC(=O)[C@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCO1	ZINC000450525470	GD	On-Demand	Anodyne	HRH4	23	44
CNC(=O)[C@@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCO1	ZINC000450525471	GD	On-Demand	Anodyne	HRH4	23	44
COc1cc(Cl)c(C(=O)N[C@@](C)(CC(=O)O)c2cccc(F)c2)cc1OC	ZINC000450525485	GH	On-Demand	Anodyne	HTR4	29	40
COc1cc(Cl)c(C(=O)N[C@](C)(CC(=O)O)c2cccc(F)c2)cc1OC	ZINC000450525486	GH	On-Demand	Anodyne	HTR4	29	40
COc1ccc2c(c1)OC[C@@H](NC(=O)CCCC(=O)C1CC1)C2	ZINC000450525489	DE	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc2c(c1)OC[C@H](NC(=O)CCCC(=O)C1CC1)C2	ZINC000450525490	DE	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1cc(Cl)c(C(=O)NCCOCC(=O)O)cc1OC	ZINC000450525503	DD	On-Demand	Anodyne	HTR4	43	42
CN(C)c1nc(NCCn2cnc(C#N)n2)nc2ccccc12	ZINC000450525508	DC	On-Demand	Mild	ADRA2A	15	43
COc1ccc(C(=O)N[C@@H](C)[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525515	EF	On-Demand	Anodyne	PDE4A	29	46
COc1ccc(C(=O)N[C@@H](C)[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525515	EF	On-Demand	Anodyne	PDE4D	17	46
COc1ccc(C(=O)N[C@@H](C)[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525515	EF	On-Demand	Anodyne	LUCI_LUCLA	15	41
COc1ccc(C(=O)N[C@H](C)[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525516	EF	On-Demand	Anodyne	PDE4A	29	46
COc1ccc(C(=O)N[C@H](C)[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525516	EF	On-Demand	Anodyne	PDE4D	17	46
COc1ccc(C(=O)N[C@H](C)[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525516	EF	On-Demand	Anodyne	LUCI_LUCLA	15	41
COc1ccc(C(=O)N[C@@H](C)[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525517	EF	On-Demand	Anodyne	PDE4A	29	46
COc1ccc(C(=O)N[C@@H](C)[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525517	EF	On-Demand	Anodyne	PDE4D	17	46
COc1ccc(C(=O)N[C@@H](C)[C@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525517	EF	On-Demand	Anodyne	LUCI_LUCLA	15	41
COc1ccc(C(=O)N[C@H](C)[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525518	EF	On-Demand	Anodyne	PDE4A	29	46
COc1ccc(C(=O)N[C@H](C)[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525518	EF	On-Demand	Anodyne	PDE4D	17	46
COc1ccc(C(=O)N[C@H](C)[C@@H](C)C(=O)O)c(OC2CCCC2)c1	ZINC000450525518	EF	On-Demand	Anodyne	LUCI_LUCLA	15	41
CC(C)(C)NC(=O)N1CCC(NC(=O)C(C)(C)c2cccc3ccccc23)CC1	ZINC000450525519	GI	On-Demand	Anodyne	CCR8	78	36
CC(C)(C)NC(=O)N1CCC(NC(=O)C(C)(C)c2cccc3ccccc23)CC1	ZINC000450525519	GI	On-Demand	Anodyne	SFRP1	47	35
CC(C)(C)NC(=O)N1CCC(NC(=O)C(C)(C)c2cccc3ccccc23)CC1	ZINC000450525519	GI	On-Demand	Anodyne	WNT3	45	35
COc1ccc(C(=O)NC[C@H](OC)C(=O)O)c(OC2CCCC2)c1	ZINC000450525520	ED	On-Demand	Anodyne	PDE4B	18	44
COc1ccc(C(=O)NC[C@H](OC)C(=O)O)c(OC2CCCC2)c1	ZINC000450525520	ED	On-Demand	Anodyne	PDE4D	15	44
COc1ccc(C(=O)NC[C@@H](OC)C(=O)O)c(OC2CCCC2)c1	ZINC000450525521	ED	On-Demand	Anodyne	PDE4B	18	44
COc1ccc(C(=O)NC[C@@H](OC)C(=O)O)c(OC2CCCC2)c1	ZINC000450525521	ED	On-Demand	Anodyne	PDE4D	15	44
COC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525529	CC	On-Demand	Anodyne	MME	55	39
COC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525529	CC	On-Demand	Anodyne	SDH1	0	40
COC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525529	CC	On-Demand	Anodyne	TIMP3	61	35
COC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525529	CC	On-Demand	Anodyne	ECE1	44	38
COC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525529	CC	On-Demand	Anodyne	ACE2	68	33
COC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525529	CC	On-Demand	Anodyne	NPPA	59	39
COC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525530	CC	On-Demand	Anodyne	MME	55	39
COC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525530	CC	On-Demand	Anodyne	SDH1	0	40
COC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525530	CC	On-Demand	Anodyne	TIMP3	61	35
COC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525530	CC	On-Demand	Anodyne	ECE1	44	38
COC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525530	CC	On-Demand	Anodyne	ACE2	68	33
COC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525530	CC	On-Demand	Anodyne	NPPA	59	39
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCCO1	ZINC000450525531	DF	On-Demand	Anodyne	HRH4	18	45
COc1ccc(F)c(C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1OC	ZINC000450525536	FF	On-Demand	Anodyne	NTSR2	42	39
COc1ccc(F)c(C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1OC	ZINC000450525536	FF	On-Demand	Anodyne	CTSS	31	42
COc1ccc(F)c(C(=O)N[C@H](CC2CCCCC2)C(=O)O)c1OC	ZINC000450525536	FF	On-Demand	Anodyne	F2RL1	29	42
COc1ccc(F)c(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1OC	ZINC000450525537	FF	On-Demand	Anodyne	NTSR2	42	39
COc1ccc(F)c(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1OC	ZINC000450525537	FF	On-Demand	Anodyne	CTSS	31	42
COc1ccc(F)c(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1OC	ZINC000450525537	FF	On-Demand	Anodyne	F2RL1	29	42
O=C(O)[C@@H]1CN(C(=O)C2(C3CC3)CCOCC2)C[C@H]1c1ccc(Cl)cc1	ZINC000450525539	GG	On-Demand	Anodyne	SLC6A1	48	41
O=C(O)[C@@H]1CN(C(=O)C2(C3CC3)CCOCC2)C[C@H]1c1ccc(Cl)cc1	ZINC000450525539	GG	On-Demand	Anodyne	SLC6A3	15	41
COc1ccc([C@H](CN2CCCC2)NC(=O)C[C@H]2COc3ccccc3O2)cc1	ZINC000450525550	GG	On-Demand	Anodyne	ADRA2B	20	41
COc1ccc([C@H](CN2CCCC2)NC(=O)C[C@H]2COc3ccccc3O2)cc1	ZINC000450525550	GG	On-Demand	Anodyne	ADRA2C	15	41
COc1ccc([C@H](CN2CCCC2)NC(=O)C[C@@H]2COc3ccccc3O2)cc1	ZINC000450525551	GG	On-Demand	Anodyne	ADRA2B	20	41
COc1ccc([C@H](CN2CCCC2)NC(=O)C[C@@H]2COc3ccccc3O2)cc1	ZINC000450525551	GG	On-Demand	Anodyne	ADRA2C	15	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)C[C@H]2COc3ccccc3O2)cc1	ZINC000450525552	GG	On-Demand	Anodyne	ADRA2B	20	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)C[C@H]2COc3ccccc3O2)cc1	ZINC000450525552	GG	On-Demand	Anodyne	ADRA2C	15	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)C[C@@H]2COc3ccccc3O2)cc1	ZINC000450525553	GG	On-Demand	Anodyne	ADRA2B	20	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)C[C@@H]2COc3ccccc3O2)cc1	ZINC000450525553	GG	On-Demand	Anodyne	ADRA2C	15	41
CC(C)(CNc1ccnc2cc(F)c(Cl)cc12)OCCO	ZINC000450525569	DG	On-Demand	Anodyne	HRP1_PLAFA	91	32
CC(C)(CNc1ccnc2cc(F)c(Cl)cc12)OCCO	ZINC000450525569	DG	On-Demand	Anodyne	HNMT	49	34
CC(C)(C)Oc1c(F)cc(NC(=O)c2ccnn2CC(F)(F)F)cc1F	ZINC000450525570	GI	On-Demand	Anodyne	FLT1	22	43
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450525571	FF	On-Demand	Anodyne	SFRP1	95	41
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450525571	FF	On-Demand	Anodyne	WNT3	74	36
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450525571	FF	On-Demand	Anodyne	HPGDS	38	45
CN(C)CCN(C)CCCNc1ncnc2cc(Br)ccc12	ZINC000450525577	FE	On-Demand	Anodyne	EGFR	78	51
COc1cc(CC(=O)N2Cc3ccccc3OC[C@H]2C)ccc1Cl	ZINC000450525591	EH	On-Demand	Anodyne	OPRK1	23	43
COc1cc(CC(=O)N2Cc3ccccc3OC[C@@H]2C)ccc1Cl	ZINC000450525592	EH	On-Demand	Anodyne	OPRK1	23	43
CC(=O)NCC[C@@H]1CCCN(c2ccnc3ccc(OC(C)C)cc23)C1	ZINC000450525596	FH	On-Demand	Anodyne	MTNR1A	17	43
CC(=O)NCC[C@@H]1CCCN(c2ccnc3ccc(OC(C)C)cc23)C1	ZINC000450525596	FH	On-Demand	Anodyne	SIRT2	44	31
CC(=O)NCC[C@H]1CCCN(c2ccnc3ccc(OC(C)C)cc23)C1	ZINC000450525597	FH	On-Demand	Anodyne	MTNR1A	17	43
CC(=O)NCC[C@H]1CCCN(c2ccnc3ccc(OC(C)C)cc23)C1	ZINC000450525597	FH	On-Demand	Anodyne	SIRT2	44	31
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	ZINC000450525600	GE	On-Demand	Anodyne	TRPV1	18	46
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	ZINC000450525600	GE	On-Demand	Anodyne	ROCK2	17	43
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	ZINC000450525600	GE	On-Demand	Anodyne	PDE6A	42	33
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	ZINC000450525600	GE	On-Demand	Anodyne	CA9	21	41
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	ZINC000450525600	GE	On-Demand	Anodyne	HCRTR2	21	40
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	ZINC000450525600	GE	On-Demand	Anodyne	NCE103	29	45
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1Cl	ZINC000450525600	GE	On-Demand	Anodyne	P96878_MYCTU	20	45
Cc1nc2ccnn2cc1C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1	ZINC000450525619	FH	On-Demand	Anodyne	DDR1	54	38
CN(C(=O)Cc1cccc(C(=O)O)c1)[C@@H]1CC1(C)C	ZINC000450525624	CE	On-Demand	Anodyne	RARA	40	33
CN(C(=O)Cc1cccc(C(=O)O)c1)[C@H]1CC1(C)C	ZINC000450525625	CE	On-Demand	Anodyne	RARA	40	33
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2ccc(C(F)(F)F)[nH]2)c1	ZINC000450525629	GE	On-Demand	Anodyne	NAMPT	24	41
COc1ccc(-c2ccnc(NCc3ccncc3OC[C@H]3CCOC3)n2)cc1	ZINC000450525633	GH	On-Demand	Anodyne	CLK1	20	47
COc1ccc(-c2ccnc(NCc3ccncc3OC[C@H]3CCOC3)n2)cc1	ZINC000450525633	GH	On-Demand	Anodyne	CLK4	30	47
COc1ccc(-c2ccnc(NCc3ccncc3OC[C@H]3CCOC3)n2)cc1	ZINC000450525633	GH	On-Demand	Anodyne	DYRK1B	18	47
COc1ccc(-c2ccnc(NCc3ccncc3OC[C@@H]3CCOC3)n2)cc1	ZINC000450525634	GH	On-Demand	Anodyne	CLK1	20	47
COc1ccc(-c2ccnc(NCc3ccncc3OC[C@@H]3CCOC3)n2)cc1	ZINC000450525634	GH	On-Demand	Anodyne	CLK4	30	47
COc1ccc(-c2ccnc(NCc3ccncc3OC[C@@H]3CCOC3)n2)cc1	ZINC000450525634	GH	On-Demand	Anodyne	DYRK1B	18	47
CCc1cccc(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)n1	ZINC000450525636	FG	On-Demand	Anodyne	RHOA	0	41
CCc1cccc(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)n1	ZINC000450525637	FG	On-Demand	Anodyne	RHOA	0	41
CCS(=O)(=O)c1ccc(CN2c3ccccc3C[C@H]2C(N)=O)cc1	ZINC000450525640	ED	On-Demand	Anodyne	TPP2	54	38
CCOC(=O)c1csc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)n1	ZINC000450525645	FI	On-Demand	Anodyne	HTR1A	22	44
CCOC(=O)c1csc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)n1	ZINC000450525645	FI	On-Demand	Anodyne	HTR1D	47	44
CCOC(=O)c1csc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)n1	ZINC000450525645	FI	On-Demand	Anodyne	HTR1B	26	43
CCOC(=O)c1csc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)n1	ZINC000450525645	FI	On-Demand	Anodyne	SLC6A4	27	43
CCOC(=O)c1csc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)n1	ZINC000450525645	FI	On-Demand	Anodyne	HTR1F	95	44
CCOC(=O)c1csc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)n1	ZINC000450525645	FI	On-Demand	Anodyne	MPO	64	34
CCOC(=O)c1csc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)n1	ZINC000450525645	FI	On-Demand	Anodyne	CCR2	88	41
O=C(c1cnn2c1CCC2)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450525650	EG	On-Demand	Anodyne	PARP1	45	38
CCc1oc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1C(=O)O	ZINC000450525651	EF	On-Demand	Anodyne	AVPR1A	21	45
CCc1oc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1C(=O)O	ZINC000450525652	EF	On-Demand	Anodyne	AVPR1A	21	45
COc1cccc2c1CCN(C(=O)c1cc3n(n1)CCCC3)C2	ZINC000450525654	DE	On-Demand	Anodyne	SSTR2	43	37
COc1cccc2c1CCN(C(=O)c1cc3n(n1)CCCC3)C2	ZINC000450525654	DE	On-Demand	Anodyne	SSTR1	46	34
O=C(O)c1cccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450525657	DF	On-Demand	Anodyne	AKR1C3	46	38
O=C(O)c1cccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450525658	DF	On-Demand	Anodyne	AKR1C3	46	38
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCO1	ZINC000450525666	CG	On-Demand	Anodyne	PRCP	46	35
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCO1	ZINC000450525667	CG	On-Demand	Anodyne	PRCP	46	35
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCO1	ZINC000450525668	CG	On-Demand	Anodyne	PRCP	46	35
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCO1	ZINC000450525669	CG	On-Demand	Anodyne	PRCP	46	35
CN(C(=O)CS(=O)(=O)N(C)C)[C@H](Cc1ccccc1)C(=O)O	ZINC000450525672	EC	On-Demand	Anodyne	MME	43	38
CN(C(=O)CS(=O)(=O)N(C)C)[C@H](Cc1ccccc1)C(=O)O	ZINC000450525672	EC	On-Demand	Anodyne	CPA1	53	39
CN(C(=O)CS(=O)(=O)N(C)C)[C@H](Cc1ccccc1)C(=O)O	ZINC000450525672	EC	On-Demand	Anodyne	CHIA	25	40
CN(C(=O)CS(=O)(=O)N(C)C)[C@H](Cc1ccccc1)C(=O)O	ZINC000450525672	EC	On-Demand	Anodyne	BLAIMP-1	0	43
CN(C(=O)CS(=O)(=O)N(C)C)[C@@H](Cc1ccccc1)C(=O)O	ZINC000450525673	EC	On-Demand	Anodyne	MME	43	38
CN(C(=O)CS(=O)(=O)N(C)C)[C@@H](Cc1ccccc1)C(=O)O	ZINC000450525673	EC	On-Demand	Anodyne	CPA1	53	39
CN(C(=O)CS(=O)(=O)N(C)C)[C@@H](Cc1ccccc1)C(=O)O	ZINC000450525673	EC	On-Demand	Anodyne	CHIA	25	40
CN(C(=O)CS(=O)(=O)N(C)C)[C@@H](Cc1ccccc1)C(=O)O	ZINC000450525673	EC	On-Demand	Anodyne	BLAIMP-1	0	43
CC(C)c1occc1C(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450525686	DH	On-Demand	Anodyne	DPEP1	44	35
CC(C)c1occc1C(=O)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450525686	DH	On-Demand	Anodyne	CTSS	33	44
CC(C)c1occc1C(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450525687	DH	On-Demand	Anodyne	DPEP1	44	35
CC(C)c1occc1C(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450525687	DH	On-Demand	Anodyne	CTSL	20	44
CC(C)c1occc1C(=O)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450525687	DH	On-Demand	Anodyne	CTSS	41	44
CN(c1ncnc2[nH]c3ccccc3c12)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450525688	DG	On-Demand	Anodyne	TUBB3	31	41
COCCCS(=O)(=O)c1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450525720	GE	On-Demand	Anodyne	PRNP	41	38
COCCCS(=O)(=O)c1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450525720	GE	On-Demand	Anodyne	DGAT1	42	39
COCCCS(=O)(=O)c1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450525720	GE	On-Demand	Anodyne	HPGDS	19	41
COCC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525724	DD	On-Demand	Anodyne	MME	28	46
COCC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525724	DD	On-Demand	Anodyne	NPPA	69	46
COCC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525728	DD	On-Demand	Anodyne	MME	28	46
COCC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450525728	DD	On-Demand	Anodyne	NPPA	69	46
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525732	EH	On-Demand	Anodyne	MME	78	40
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525732	EH	On-Demand	Anodyne	ANPEP	43	33
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525732	EH	On-Demand	Anodyne	CXCL8	56	37
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525732	EH	On-Demand	Anodyne	FCER2	58	38
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525732	EH	On-Demand	Anodyne	CAPN1	15	40
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525732	EH	On-Demand	Anodyne	ACE2	69	36
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525732	EH	On-Demand	Anodyne	FPR1	63	37
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525733	EH	On-Demand	Anodyne	MME	78	40
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525733	EH	On-Demand	Anodyne	ANPEP	43	33
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525733	EH	On-Demand	Anodyne	CXCL8	56	37
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525733	EH	On-Demand	Anodyne	FCER2	58	38
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525733	EH	On-Demand	Anodyne	CAPN1	15	40
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525733	EH	On-Demand	Anodyne	ACE2	69	36
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525733	EH	On-Demand	Anodyne	FPR1	63	37
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525734	EH	On-Demand	Anodyne	MME	78	40
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525734	EH	On-Demand	Anodyne	ANPEP	43	33
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525734	EH	On-Demand	Anodyne	CXCL8	56	37
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525734	EH	On-Demand	Anodyne	FCER2	58	38
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525734	EH	On-Demand	Anodyne	CAPN1	15	40
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525734	EH	On-Demand	Anodyne	ACE2	69	36
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H](C(=O)O)c1cccs1	ZINC000450525734	EH	On-Demand	Anodyne	FPR1	63	37
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525735	EH	On-Demand	Anodyne	MME	78	40
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525735	EH	On-Demand	Anodyne	ANPEP	43	33
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525735	EH	On-Demand	Anodyne	CXCL8	56	37
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525735	EH	On-Demand	Anodyne	FCER2	58	38
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525735	EH	On-Demand	Anodyne	CAPN1	15	40
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525735	EH	On-Demand	Anodyne	ACE2	69	36
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H](C(=O)O)c1cccs1	ZINC000450525735	EH	On-Demand	Anodyne	FPR1	63	37
CCc1ccccc1CC(=O)N[C@](C)(CC(=O)O)c1cccc(F)c1	ZINC000450525751	EG	On-Demand	Anodyne	KCNN4	0	40
Cc1ccc2[nH]c(C(=O)N3C[C@@H](C(=O)O)[C@H](c4ccccc4)C3)c(C)c2c1	ZINC000450525764	FH	On-Demand	Anodyne	KIF11	0	41
COCCCS(=O)(=O)c1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1	ZINC000450525766	GG	On-Demand	Anodyne	MTTP	53	33
Cc1cc(OCc2ccccc2)nc(N[C@@H](CO)C(N)=O)n1	ZINC000450525775	DC	On-Demand	Anodyne	KLK3	54	32
COCCCS(=O)(=O)c1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1	ZINC000450525776	GG	On-Demand	Anodyne	MTTP	53	33
COC(=O)c1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450525810	GD	On-Demand	Anodyne	CA2	17	43
COC(=O)c1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450525810	GD	On-Demand	Anodyne	NQO2	22	47
COC(=O)c1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450525810	GD	On-Demand	Anodyne	CA7	15	43
COC(=O)c1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450525810	GD	On-Demand	Anodyne	MMP13	19	40
COC(=O)c1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450525810	GD	On-Demand	Anodyne	CA5B	32	43
COC(=O)c1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450525810	GD	On-Demand	Anodyne	CA5A	37	43
COC(=O)c1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450525810	GD	On-Demand	Anodyne	CA9	22	43
COC(=O)c1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450525810	GD	On-Demand	Anodyne	E1	0	40
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C2	ZINC000450525811	GF	On-Demand	Anodyne	CAPN1	15	40
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C2	ZINC000450525811	GF	On-Demand	Anodyne	CAPN2	43	38
COc1ccc2c(c1)OC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C2	ZINC000450525814	GF	On-Demand	Anodyne	CAPN1	15	40
COc1ccc2c(c1)OC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C2	ZINC000450525814	GF	On-Demand	Anodyne	CAPN2	43	38
CC(=O)NCC[C@H]1CCCN(c2ccc(I)cn2)C1	ZINC000450525836	FE	On-Demand	Anodyne	SIRT3	43	39
CC(=O)NCC[C@H]1CCCN(c2ccc(I)cn2)C1	ZINC000450525836	FE	On-Demand	Anodyne	SIRT2	44	31
CC(=O)NCC[C@H]1CCCN(c2ccc(I)cn2)C1	ZINC000450525836	FE	On-Demand	Anodyne	SIRT1	40	32
CCOC(=O)[C@H](CO)NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450525837	FD	On-Demand	Anodyne	ACACA	54	35
CC(=O)NCC[C@@H]1CCCN(c2ccc(I)cn2)C1	ZINC000450525839	FE	On-Demand	Anodyne	SIRT3	43	39
CC(=O)NCC[C@@H]1CCCN(c2ccc(I)cn2)C1	ZINC000450525839	FE	On-Demand	Anodyne	SIRT2	44	31
CC(=O)NCC[C@@H]1CCCN(c2ccc(I)cn2)C1	ZINC000450525839	FE	On-Demand	Anodyne	SIRT1	40	32
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450525840	FD	On-Demand	Anodyne	ACACA	54	35
COc1cccc2c1CCN(C(=O)Cc1ccccc1O[C@@H]1CCOC1)C2	ZINC000450525842	FF	On-Demand	Anodyne	CPT2	27	47
COc1cccc2c1CCN(C(=O)Cc1ccccc1O[C@@H]1CCOC1)C2	ZINC000450525842	FF	On-Demand	Anodyne	PDEC	0	43
CN1CCC[C@H](C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525843	FE	On-Demand	Anodyne	RBP4	84	44
CN1CCC[C@H](C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525843	FE	On-Demand	Anodyne	SFRP1	50	33
CN1CCC[C@H](C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525843	FE	On-Demand	Anodyne	WNT3	55	33
COc1cccc2c1CCN(C(=O)Cc1ccccc1O[C@H]1CCOC1)C2	ZINC000450525844	FF	On-Demand	Anodyne	CPT2	27	47
COc1cccc2c1CCN(C(=O)Cc1ccccc1O[C@H]1CCOC1)C2	ZINC000450525844	FF	On-Demand	Anodyne	PDEC	0	43
CN1CCC[C@@H](C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525845	FE	On-Demand	Anodyne	RBP4	84	44
CN1CCC[C@@H](C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525845	FE	On-Demand	Anodyne	SFRP1	50	33
CN1CCC[C@@H](C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525845	FE	On-Demand	Anodyne	WNT3	55	33
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](CO)C3CCOCC3)cc2)c1	ZINC000450525846	GE	On-Demand	Anodyne	MMP13	0	44
CN1CCC[C@@H](C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525847	FE	On-Demand	Anodyne	RBP4	84	44
CN1CCC[C@@H](C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525847	FE	On-Demand	Anodyne	SFRP1	50	33
CN1CCC[C@@H](C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525847	FE	On-Demand	Anodyne	WNT3	55	33
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](CO)C3CCOCC3)cc2)c1	ZINC000450525848	GE	On-Demand	Anodyne	MMP13	0	44
CN1CCC[C@H](C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525849	FE	On-Demand	Anodyne	RBP4	84	44
CN1CCC[C@H](C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525849	FE	On-Demand	Anodyne	SFRP1	50	33
CN1CCC[C@H](C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000450525849	FE	On-Demand	Anodyne	WNT3	55	33
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)[C@@H](C)O)ccc21	ZINC000450525851	FF	On-Demand	Anodyne	PDGFRB	0	47
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)[C@@H](C)O)ccc21	ZINC000450525851	FF	On-Demand	Anodyne	CPT1A	46	32
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)[C@@H](C)O)ccc21	ZINC000450525851	FF	On-Demand	Anodyne	PLK1	51	34
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)[C@@H](C)O)ccc21	ZINC000450525851	FF	On-Demand	Anodyne	HPGD	51	62
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)[C@H](C)O)ccc21	ZINC000450525852	FF	On-Demand	Anodyne	PDGFRB	0	47
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)[C@H](C)O)ccc21	ZINC000450525852	FF	On-Demand	Anodyne	CPT1A	46	32
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)[C@H](C)O)ccc21	ZINC000450525852	FF	On-Demand	Anodyne	PLK1	51	34
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)[C@H](C)O)ccc21	ZINC000450525852	FF	On-Demand	Anodyne	HPGD	51	62
C[C@@H](O)C(C)(C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450525861	DF	On-Demand	Anodyne	ROCK2	23	42
C[C@H](O)C(C)(C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450525862	DF	On-Demand	Anodyne	ROCK2	23	42
COc1ccc(C(=O)NCC2(C(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450525867	EF	On-Demand	Anodyne	KCNA3	45	45
COc1ccc(C(=O)NCC2(C(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450525867	EF	On-Demand	Anodyne	MTNR1A	33	41
COc1ccc(C(=O)NCC2(C(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450525867	EF	On-Demand	Anodyne	MTNR1B	23	41
COc1ccc(C(=O)NCC2(C(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450525867	EF	On-Demand	Anodyne	HCN1	53	34
COc1ccc(C(=O)NCC2(C(=O)O)CC2)c(OC2CCCC2)c1	ZINC000450525867	EF	On-Demand	Anodyne	HCN4	52	34
COc1ccc(C(=O)N[C@H](CC(F)(F)F)C(=O)O)c(OC2CCCC2)c1	ZINC000450525874	GG	On-Demand	Anodyne	PDE4A	37	40
COc1ccc(C(=O)N[C@H](CC(F)(F)F)C(=O)O)c(OC2CCCC2)c1	ZINC000450525874	GG	On-Demand	Anodyne	PDE4B	20	40
COc1ccc(C(=O)N[C@H](CC(F)(F)F)C(=O)O)c(OC2CCCC2)c1	ZINC000450525874	GG	On-Demand	Anodyne	PDE4D	19	40
COc1ccc(C(=O)N[C@H](CC(F)(F)F)C(=O)O)c(OC2CCCC2)c1	ZINC000450525874	GG	On-Demand	Anodyne	PDE4C	15	40
COc1ccc(C(=O)N[C@@H](CC(F)(F)F)C(=O)O)c(OC2CCCC2)c1	ZINC000450525877	GG	On-Demand	Anodyne	PDE4A	37	40
COc1ccc(C(=O)N[C@@H](CC(F)(F)F)C(=O)O)c(OC2CCCC2)c1	ZINC000450525877	GG	On-Demand	Anodyne	PDE4B	20	40
COc1ccc(C(=O)N[C@@H](CC(F)(F)F)C(=O)O)c(OC2CCCC2)c1	ZINC000450525877	GG	On-Demand	Anodyne	PDE4D	19	40
COc1ccc(C(=O)N[C@@H](CC(F)(F)F)C(=O)O)c(OC2CCCC2)c1	ZINC000450525877	GG	On-Demand	Anodyne	PDE4C	15	40
CCN(CC)CCCC1CCN(C(=O)c2ccn(CCc3ccccc3)n2)CC1	ZINC000450525878	GI	On-Demand	Anodyne	ACHE	23	41
COc1ccc2c(c1)OC[C@@H](NC(=O)CCCc1ncc(C)o1)C2	ZINC000450525880	EE	On-Demand	Anodyne	MTNR1A	21	40
COc1ccc2c(c1)OC[C@H](NC(=O)CCCc1ncc(C)o1)C2	ZINC000450525881	EE	On-Demand	Anodyne	MTNR1A	21	40
CSc1cccc(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450525884	EG	On-Demand	Anodyne	DRD4	17	42
CC(C)c1nnc(CN2CCC(C(=O)NCCc3cccs3)CC2)s1	ZINC000450525885	GG	On-Demand	Anodyne	ADAM17	22	43
Cc1c(C(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)nnn1-c1cnn(C)c1	ZINC000450525898	GG	On-Demand	Anodyne	MET	19	40
Cc1cncc(-c2nc(CN3CCC(NC(=O)C4CCCCC4)CC3)no2)c1	ZINC000450525902	GG	On-Demand	Anodyne	SSTR5	42	43
Cc1cncc(-c2nc(CN3CCC(NC(=O)C4CCCCC4)CC3)no2)c1	ZINC000450525902	GG	On-Demand	Anodyne	EPHX2	23	48
CCc1cccc(C(=O)NCC2(C(=O)OC)CCOCC2)n1	ZINC000450525904	DD	On-Demand	Anodyne	PDE5A	0	41
O=C(N[C@H](CO)CC1CCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450525905	EG	On-Demand	Anodyne	TIMP3	53	31
O=C(N[C@H](CO)CC1CCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450525905	EG	On-Demand	Anodyne	PGA5	47	34
O=C(N[C@H](CO)CC1CCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450525905	EG	On-Demand	Anodyne	SLC12A5	42	33
O=C(N[C@@H](CO)CC1CCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450525906	EG	On-Demand	Anodyne	TIMP3	53	31
O=C(N[C@@H](CO)CC1CCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450525906	EG	On-Demand	Anodyne	PGA5	47	34
O=C(N[C@@H](CO)CC1CCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450525906	EG	On-Demand	Anodyne	SLC12A5	42	33
Cc1ccc(C(=O)NC2CCN(CC3=CCCCC3)CC2)s1	ZINC000450525909	DH	On-Demand	Anodyne	CXCR3	15	53
Cc1ccc(C(=O)NC2CCN(CC3=CCCCC3)CC2)s1	ZINC000450525909	DH	On-Demand	Anodyne	MCHR1	25	40
COC(=O)C1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CCOCC1	ZINC000450525910	GD	On-Demand	Anodyne	PDE8B	55	40
Cc1sccc1C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450525911	EE	On-Demand	Anodyne	FBP1	18	40
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450525917	FG	On-Demand	Anodyne	PYGL	0	46
COC(=O)C1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CCOCC1	ZINC000450525918	GD	On-Demand	Anodyne	PDE8B	55	40
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450525919	FG	On-Demand	Anodyne	PYGL	0	46
C[C@H](CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450525920	FE	On-Demand	Anodyne	CACNA1H	42	37
C[C@H](CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450525920	FE	On-Demand	Anodyne	PYGL	16	49
C[C@H](CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450525920	FE	On-Demand	Anodyne	FAAH	16	51
C[C@H](CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450525920	FE	On-Demand	Anodyne	EPHX2	17	42
C[C@@H](CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450525928	FE	On-Demand	Anodyne	CACNA1H	42	37
C[C@@H](CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450525928	FE	On-Demand	Anodyne	PYGL	16	49
C[C@@H](CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450525928	FE	On-Demand	Anodyne	FAAH	16	51
C[C@@H](CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450525928	FE	On-Demand	Anodyne	EPHX2	17	42
COc1cccc2c1CCN(C(=O)[C@H](C)OCCc1ccccc1)C2	ZINC000450525943	EG	On-Demand	Anodyne	AGTR2	81	41
COc1cccc2c1CCN(C(=O)[C@@H](C)OCCc1ccccc1)C2	ZINC000450525944	EG	On-Demand	Anodyne	AGTR2	81	41
CC(=O)[C@](C)(O)CN[C@@H](c1ccccc1)c1nccs1	ZINC000450525960	CE	On-Demand	Anodyne	MAP1	41	35
CC(=O)[C@@](C)(O)CN[C@H](c1ccccc1)c1nccs1	ZINC000450525961	CE	On-Demand	Anodyne	MAP1	41	35
CC(=O)[C@](C)(O)CN[C@H](c1ccccc1)c1nccs1	ZINC000450525962	CE	On-Demand	Anodyne	MAP1	41	35
CC(=O)[C@@](C)(O)CN[C@@H](c1ccccc1)c1nccs1	ZINC000450525963	CE	On-Demand	Anodyne	MAP1	41	35
COc1cccc(OCCC(=O)N(C)CC2CCOCC2)c1	ZINC000450525969	DE	On-Demand	Anodyne	MTNR1A	27	43
O=C(C[C@H]1COc2ccccc2O1)N1CCCO1	ZINC000450525972	BD	On-Demand	Anodyne	ADRA2B	22	40
O=C(C[C@@H]1COc2ccccc2O1)N1CCCO1	ZINC000450525973	BD	On-Demand	Anodyne	ADRA2B	22	40
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)c1	ZINC000450525975	FI	On-Demand	Anodyne	ATF1	53	47
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)c1	ZINC000450525975	FI	On-Demand	Anodyne	KDR	15	42
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)c1	ZINC000450525975	FI	On-Demand	Anodyne	SORT1	16	43
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)c1	ZINC000450525975	FI	On-Demand	Anodyne	MTTP	45	36
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)c1	ZINC000450525975	FI	On-Demand	Anodyne	NFKB1	49	47
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)c1	ZINC000450525975	FI	On-Demand	Anodyne	TEK	41	37
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)c1	ZINC000450525975	FI	On-Demand	Anodyne	BTK	25	41
CC(C)(C)NC(=O)N1CCC(NC(=O)c2cc3cccnc3s2)CC1	ZINC000450525980	FF	On-Demand	Anodyne	SIRT2	43	31
CC(C)(C)NC(=O)N1CCC(NC(=O)c2cc3cccnc3s2)CC1	ZINC000450525980	FF	On-Demand	Anodyne	SIRT1	40	31
CCCc1cc(C(=O)N[C@H]2COc3cc(OC)ccc3C2)no1	ZINC000450525981	DE	On-Demand	Anodyne	MTNR1A	29	44
CCCc1cc(C(=O)N[C@@H]2COc3cc(OC)ccc3C2)no1	ZINC000450525982	DE	On-Demand	Anodyne	MTNR1A	29	44
CCOC(=O)c1cnc(C)c(NC(=O)c2cc3n(n2)CCCC3)c1	ZINC000450525990	EE	On-Demand	Anodyne	P2RY12	41	40
CO[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450525991	CD	On-Demand	Anodyne	NCE103	28	45
CO[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450525991	CD	On-Demand	Anodyne	P96878_MYCTU	18	40
CO[C@@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450525991	CD	On-Demand	Anodyne	CAN2	0	45
CO[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450525992	CD	On-Demand	Anodyne	NCE103	28	45
CO[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450525992	CD	On-Demand	Anodyne	P96878_MYCTU	18	40
CO[C@H](CNC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450525992	CD	On-Demand	Anodyne	CAN2	0	45
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1	ZINC000450525995	FG	On-Demand	Anodyne	GPR88	0	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1	ZINC000450525996	FG	On-Demand	Anodyne	GPR88	0	41
COCc1cc(NC(=O)C2(C)CC2)cc(C(=O)O)c1	ZINC000450525999	CE	On-Demand	Anodyne	RARA	41	36
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)cc1OC	ZINC000450526015	GG	On-Demand	Anodyne	HTR4	19	40
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)cc1OC	ZINC000450526015	GG	On-Demand	Anodyne	TRPV1	0	44
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)cc1OC	ZINC000450526015	GG	On-Demand	Anodyne	ECR	37	40
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)cc1OC	ZINC000450526015	GG	On-Demand	Anodyne	PYGL	22	41
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)cc1OC	ZINC000450526016	GG	On-Demand	Anodyne	HTR4	19	40
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)cc1OC	ZINC000450526016	GG	On-Demand	Anodyne	TRPV1	0	44
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)cc1OC	ZINC000450526016	GG	On-Demand	Anodyne	ECR	37	40
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)cc1OC	ZINC000450526016	GG	On-Demand	Anodyne	PYGL	22	41
CC(C)[C@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450526021	DG	On-Demand	Anodyne	NCE103	25	45
CC(C)[C@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450526021	DG	On-Demand	Anodyne	PFK	0	40
CC(C)[C@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450526021	DG	On-Demand	Anodyne	CAN2	0	45
CC(C)[C@@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450526022	DG	On-Demand	Anodyne	NCE103	25	45
CC(C)[C@@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450526022	DG	On-Demand	Anodyne	PFK	0	40
CC(C)[C@@](C)(CC(=O)O)NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000450526022	DG	On-Demand	Anodyne	CAN2	0	45
COCCCS(=O)(=O)c1ccc(NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526030	FF	On-Demand	Anodyne	COLA	52	35
COCCCS(=O)(=O)c1ccc(NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526030	FF	On-Demand	Anodyne	CPT1A	55	34
COCCCS(=O)(=O)c1ccc(NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526030	FF	On-Demand	Anodyne	CPT1B	44	35
COCCCS(=O)(=O)c1ccc(NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526030	FF	On-Demand	Anodyne	SCN10A	39	40
COCCCS(=O)(=O)c1ccc(NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526030	FF	On-Demand	Anodyne	USP7	47	38
COCCCS(=O)(=O)c1ccc(NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526030	FF	On-Demand	Anodyne	USP47	59	38
C[C@@H](Nc1nc(N(C)C)c2ccccc2n1)C1(S(C)(=O)=O)CC1	ZINC000450526039	ED	On-Demand	Anodyne	ADRA2A	16	51
C[C@H](Nc1nc(N(C)C)c2ccccc2n1)C1(S(C)(=O)=O)CC1	ZINC000450526040	ED	On-Demand	Anodyne	ADRA2A	16	51
CC(C)(C#N)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450526054	CD	On-Demand	Mild	NCE103	27	41
CC(C)(C#N)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450526054	CD	On-Demand	Mild	CAN2	0	41
COc1cccc2c1CCN(C(=O)c1cc(C)n(C(C)C)n1)C2	ZINC000450526060	DF	On-Demand	Anodyne	SSTR2	41	37
COc1cccc2c1CCN(C(=O)c1cc(C)n(C(C)C)n1)C2	ZINC000450526060	DF	On-Demand	Anodyne	SSTR1	45	33
COc1cccc2c1CCN(C(=O)c1cc(C)n(C(C)C)n1)C2	ZINC000450526060	DF	On-Demand	Anodyne	BCL2	0	48
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cccc(C(F)(F)F)n2)c1	ZINC000450526066	GE	On-Demand	Anodyne	TRPV1	76	34
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cccc(C(F)(F)F)n2)c1	ZINC000450526066	GE	On-Demand	Anodyne	MMP13	23	49
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cccc(C(F)(F)F)n2)c1	ZINC000450526066	GE	On-Demand	Anodyne	CARM1	70	38
CC(=O)NCC[C@@H]1CCCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450526070	EE	On-Demand	Anodyne	ADRA2A	17	41
CC(=O)NCC[C@H]1CCCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450526071	EE	On-Demand	Anodyne	ADRA2A	17	41
CCOC(=O)c1ccc(N2CCCN(C[C@H](Cc3ccccc3)OC)CC2)nc1	ZINC000450526083	GG	On-Demand	Anodyne	SMO	0	42
CCOC(=O)c1ccc(N2CCCN(C[C@@H](Cc3ccccc3)OC)CC2)nc1	ZINC000450526084	GG	On-Demand	Anodyne	SMO	0	42
O=C(O)[C@H]1CCC[C@H](C(=O)NCCOCc2ccc(Cl)cc2)C1	ZINC000450526093	EF	On-Demand	Anodyne	GPBAR1	0	43
O=C(O)[C@H]1CCC[C@@H](C(=O)NCCOCc2ccc(Cl)cc2)C1	ZINC000450526094	EF	On-Demand	Anodyne	GPBAR1	0	43
O=C(NCCOCc1ccc(Cl)cc1)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450526095	EF	On-Demand	Anodyne	GPBAR1	0	43
O=C(O)[C@@H]1CCC[C@@H](C(=O)NCCOCc2ccc(Cl)cc2)C1	ZINC000450526096	EF	On-Demand	Anodyne	GPBAR1	0	43
COc1cccc2c1CCN(C(=O)c1cc(F)c(N3CCOCC3)c(F)c1)C2	ZINC000450526143	GG	On-Demand	Anodyne	SSTR1	44	36
Fc1cc2nccc(NCC3=CCCOC3)c2cc1Br	ZINC000450526146	EH	On-Demand	Anodyne	HRP1_PLAFA	80	34
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)nc1	ZINC000450526147	GG	On-Demand	Anodyne	KCNH2	17	43
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)nc1	ZINC000450526147	GG	On-Demand	Anodyne	SSTR5	65	51
CCOC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)nc1	ZINC000450526147	GG	On-Demand	Anodyne	MCHR1	37	43
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	DRD2	18	52
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	DRD4	38	46
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	ACHE	21	48
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	DRD3	0	42
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	KCNH2	17	42
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	CHRM3	25	43
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	SIGMAR1	28	52
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	SSTR5	49	39
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	TRY2_BOVIN	42	32
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	CCR3	41	49
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	ST14	46	35
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	CXCR3	23	44
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	MCHR1	51	48
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	CCR8	16	42
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1cccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)c1	ZINC000450526152	FH	On-Demand	Anodyne	ADIPOR2	0	40
COc1cccc2c1CCN(C(=O)[C@@H]1Cc3c(C)cccc3O1)C2	ZINC000450526160	DF	On-Demand	Anodyne	SSTR2	43	40
COc1cccc2c1CCN(C(=O)[C@@H]1Cc3c(C)cccc3O1)C2	ZINC000450526160	DF	On-Demand	Anodyne	SSTR1	31	40
COc1cccc2c1CCN(C(=O)[C@H]1Cc3c(C)cccc3O1)C2	ZINC000450526161	DF	On-Demand	Anodyne	SSTR2	43	40
COc1cccc2c1CCN(C(=O)[C@H]1Cc3c(C)cccc3O1)C2	ZINC000450526161	DF	On-Demand	Anodyne	SSTR1	31	40
COc1ccc(CNc2nc(C(C)=O)c(C)s2)cc1S(N)(=O)=O	ZINC000450526165	FD	On-Demand	Anodyne	CA14	15	40
COc1ccc(CNc2nc(C(C)=O)c(C)s2)cc1S(N)(=O)=O	ZINC000450526165	FD	On-Demand	Anodyne	CA9	24	40
COc1ccc(CNc2nc(C(C)=O)c(C)s2)cc1S(N)(=O)=O	ZINC000450526165	FD	On-Demand	Anodyne	DRTS_TRYCR	49	34
CCOC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)nc1	ZINC000450526192	FF	On-Demand	Anodyne	SSTR5	54	49
CCOC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)nc1	ZINC000450526192	FF	On-Demand	Anodyne	EPHX2	32	49
CCOC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)nc1	ZINC000450526192	FF	On-Demand	Anodyne	HPGDS	31	40
CCOC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)nc1	ZINC000450526192	FF	On-Demand	Anodyne	SCARB1	45	36
C[C@H](O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450526200	EF	On-Demand	Anodyne	AVPR1B	30	44
C[C@H](O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450526200	EF	On-Demand	Anodyne	HDAC8	25	41
C[C@H](O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450526200	EF	On-Demand	Anodyne	IMDH_CRYPV	36	56
C[C@@H](O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450526201	EF	On-Demand	Anodyne	AVPR1B	30	44
C[C@@H](O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450526201	EF	On-Demand	Anodyne	HDAC8	25	41
C[C@@H](O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450526201	EF	On-Demand	Anodyne	IMDH_CRYPV	36	56
Cc1cc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450526207	GF	On-Demand	Anodyne	SLC9A1	40	38
Cc1cc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450526207	GF	On-Demand	Anodyne	RBP4	82	44
Cc1cc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450526208	GF	On-Demand	Anodyne	SLC9A1	40	38
Cc1cc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450526208	GF	On-Demand	Anodyne	RBP4	82	44
COc1cc(CC(=O)NC(C)(C)[C@@H](C)O)ccc1Cl	ZINC000450526209	CE	On-Demand	Anodyne	TRPV1	0	45
COc1cc(CC(=O)NC(C)(C)[C@@H](C)O)ccc1Cl	ZINC000450526209	CE	On-Demand	Anodyne	NCE103	27	46
COc1cc(CC(=O)NC(C)(C)[C@H](C)O)ccc1Cl	ZINC000450526210	CE	On-Demand	Anodyne	TRPV1	0	45
COc1cc(CC(=O)NC(C)(C)[C@H](C)O)ccc1Cl	ZINC000450526210	CE	On-Demand	Anodyne	NCE103	27	46
COc1ccc(-c2ccnc(N3CC[C@@H](C(F)(F)F)[C@H](CO)C3)n2)cc1	ZINC000450526211	FG	On-Demand	Anodyne	DKK1	0	41
COc1ccc(-c2ccnc(N3CC[C@H](C(F)(F)F)[C@@H](CO)C3)n2)cc1	ZINC000450526212	FG	On-Demand	Anodyne	DKK1	0	41
COc1ccc(-c2ccnc(N3CC[C@@H](C(F)(F)F)[C@@H](CO)C3)n2)cc1	ZINC000450526213	FG	On-Demand	Anodyne	DKK1	0	41
COc1ccc(-c2ccnc(N3CC[C@H](C(F)(F)F)[C@H](CO)C3)n2)cc1	ZINC000450526214	FG	On-Demand	Anodyne	DKK1	0	41
CCOC(=O)c1cnc(C)c(NC(=O)CCOc2cccc(OC)c2)c1	ZINC000450526215	FF	On-Demand	Anodyne	MTNR1A	27	42
CCOC(=O)c1cnc(C)c(NC(=O)CCOc2cccc(OC)c2)c1	ZINC000450526215	FF	On-Demand	Anodyne	MTNR1B	26	44
CCOC(=O)c1csc(=N[C@H](CC)c2ccc(OC)c(OC)c2)[nH]1	ZINC000450526217	FG	On-Demand	Anodyne	PRKCZ	44	35
CCOC(=O)c1csc(=N[C@@H](CC)c2ccc(OC)c(OC)c2)[nH]1	ZINC000450526218	FG	On-Demand	Anodyne	PRKCZ	44	35
C[C@@H](O)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450526219	DG	On-Demand	Anodyne	GPR88	0	42
CCC(=O)CCCN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450526225	DF	On-Demand	Anodyne	EPHX2	34	44
O=C(N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)C1(C(F)(F)F)CCC1	ZINC000450526226	GI	On-Demand	Anodyne	RBP4	93	45
O=C(N1CCO[C@H](c2ccccc2C(F)(F)F)C1)C1(C(F)(F)F)CCC1	ZINC000450526227	GI	On-Demand	Anodyne	RBP4	93	45
O=C(NC1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450526233	EI	On-Demand	Anodyne	SLC6A1	76	37
O=C(NC1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450526233	EI	On-Demand	Anodyne	CHRM3	18	43
O=C(NC1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450526233	EI	On-Demand	Anodyne	SIGMAR1	29	62
O=C(NC1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450526233	EI	On-Demand	Anodyne	SLC6A5	42	35
O=C(NC1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450526233	EI	On-Demand	Anodyne	EPHX2	42	54
O=C(NC1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450526234	EI	On-Demand	Anodyne	SLC6A1	76	37
O=C(NC1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450526234	EI	On-Demand	Anodyne	CHRM3	18	43
O=C(NC1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450526234	EI	On-Demand	Anodyne	SIGMAR1	29	62
O=C(NC1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450526234	EI	On-Demand	Anodyne	SLC6A5	42	35
O=C(NC1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450526234	EI	On-Demand	Anodyne	EPHX2	42	54
CC(=O)c1nc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)sc1C	ZINC000450526238	GG	On-Demand	Anodyne	ACHE	22	41
CC(=O)c1nc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)sc1C	ZINC000450526238	GG	On-Demand	Anodyne	SLC18A3	24	42
CC(=O)c1nc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)sc1C	ZINC000450526239	GG	On-Demand	Anodyne	ACHE	22	41
CC(=O)c1nc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)sc1C	ZINC000450526239	GG	On-Demand	Anodyne	SLC18A3	24	42
Cc1cc(Cl)ccc1CN1CCN(c2ncc(C#N)cc2[N+](=O)[O-])CC1	ZINC000450526240	FG	On-Demand	Mild	CXCR3	22	45
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	DRD2	20	57
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	CNR1	30	45
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	DRD4	33	43
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	HTR2A	19	46
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	DRD3	16	57
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	LTA4H	24	40
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	CNR2	22	45
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	HRH3	41	47
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	SIGMAR1	44	80
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	CCR1	29	40
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	CCR3	17	43
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	HNMT	41	32
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	EPHX2	52	52
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	MCHR1	36	41
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	CACNA1G	45	44
O=C(NC1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450526255	EI	On-Demand	Anodyne	BIRC2	68	46
CC(C)(C)C(=O)CCCC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450526256	GI	On-Demand	Anodyne	RBP4	84	41
CC(C)(C)C(=O)CCCC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450526257	GI	On-Demand	Anodyne	RBP4	84	41
CCOC(=O)[C@@H](CO)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450526258	ED	On-Demand	Anodyne	TIMP3	70	40
CCOC(=O)[C@H](CO)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450526259	ED	On-Demand	Anodyne	TIMP3	70	40
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)O)[C@H](c2ccccc2)C1	ZINC000450526264	DG	On-Demand	Anodyne	ACE	45	38
CCCOc1cccc(CC(=O)N[C@@](C)(CC(=O)O)c2cccc(F)c2)c1	ZINC000450526274	FH	On-Demand	Anodyne	UPP1	50	38
CCCOc1cccc(CC(=O)N[C@@](C)(CC(=O)O)c2cccc(F)c2)c1	ZINC000450526274	FH	On-Demand	Anodyne	PLA2G4B	27	43
CCCOc1cccc(CC(=O)N[C@@](C)(CC(=O)O)c2cccc(F)c2)c1	ZINC000450526274	FH	On-Demand	Anodyne	TSPAN17	0	43
CCCOc1cccc(CC(=O)N[C@@](C)(CC(=O)O)c2cccc(F)c2)c1	ZINC000450526274	FH	On-Demand	Anodyne	PDS	59	39
CCCOc1cccc(CC(=O)N[C@](C)(CC(=O)O)c2cccc(F)c2)c1	ZINC000450526275	FH	On-Demand	Anodyne	UPP1	50	38
CCCOc1cccc(CC(=O)N[C@](C)(CC(=O)O)c2cccc(F)c2)c1	ZINC000450526275	FH	On-Demand	Anodyne	PLA2G4B	27	43
CCCOc1cccc(CC(=O)N[C@](C)(CC(=O)O)c2cccc(F)c2)c1	ZINC000450526275	FH	On-Demand	Anodyne	TSPAN17	0	43
CCCOc1cccc(CC(=O)N[C@](C)(CC(=O)O)c2cccc(F)c2)c1	ZINC000450526275	FH	On-Demand	Anodyne	PDS	59	39
CC[C@@H]1C[C@H]1C(=O)N[C@H]1COc2cc(OC)ccc2C1	ZINC000450526305	CE	On-Demand	Anodyne	MTNR1A	27	41
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1COc2cc(OC)ccc2C1	ZINC000450526306	CE	On-Demand	Anodyne	MTNR1A	27	41
CCOC(=O)c1csc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)n1	ZINC000450526308	GE	On-Demand	Anodyne	MAPK9	15	40
CCOC(=O)c1csc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)n1	ZINC000450526308	GE	On-Demand	Anodyne	TRPC6	62	41
CCOC(=O)c1csc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)n1	ZINC000450526308	GE	On-Demand	Anodyne	TRPC3	41	41
O=C(c1cc(Cl)c[nH]1)N1CCC(Nc2ncc(C(F)F)cn2)CC1	ZINC000450526310	FG	On-Demand	Anodyne	MAPK1	47	35
COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(C)cs2)cc1	ZINC000450526311	EH	On-Demand	Anodyne	OPRK1	0	43
COc1ccc([C@H](CN2CCCC2)NC(=O)c2cc(C)cs2)cc1	ZINC000450526311	EH	On-Demand	Anodyne	UTS2	20	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(C)cs2)cc1	ZINC000450526312	EH	On-Demand	Anodyne	OPRK1	0	43
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cc(C)cs2)cc1	ZINC000450526312	EH	On-Demand	Anodyne	UTS2	20	40
O=C(Cc1ccc(Cl)c(F)c1)N[C@H](CC(F)(F)F)C(=O)O	ZINC000450526315	EF	On-Demand	Anodyne	CDC25B	22	40
O=C(Cc1ccc(Cl)c(F)c1)N[C@@H](CC(F)(F)F)C(=O)O	ZINC000450526316	EF	On-Demand	Anodyne	CDC25B	22	40
COc1ccc2c(c1)OC[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C2	ZINC000450526330	FE	On-Demand	Anodyne	MTNR1A	41	46
COc1ccc2c(c1)OC[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C2	ZINC000450526330	FE	On-Demand	Anodyne	MTNR1B	35	40
COc1ccc2c(c1)OC[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C2	ZINC000450526331	FE	On-Demand	Anodyne	MTNR1A	41	46
COc1ccc2c(c1)OC[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)C2	ZINC000450526331	FE	On-Demand	Anodyne	MTNR1B	35	40
COc1cccc(Oc2ccc(C(=O)NCC(C)(C)C#N)nc2)c1	ZINC000450526346	EG	On-Demand	Mild	DRD4	41	32
COc1cccc(Oc2ccc(C(=O)NCC(C)(C)C#N)nc2)c1	ZINC000450526346	EG	On-Demand	Mild	MTNR1B	36	41
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450526347	GF	On-Demand	Anodyne	UTS2	33	40
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450526347	GF	On-Demand	Anodyne	HPGDS	16	43
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450526348	GF	On-Demand	Anodyne	UTS2	33	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450526348	GF	On-Demand	Anodyne	HPGDS	16	43
CCc1ccc2nccc(N3CCC[C@@H](CCNC(C)=O)C3)c2c1	ZINC000450526367	EH	On-Demand	Anodyne	SIRT3	44	41
CCc1ccc2nccc(N3CCC[C@@H](CCNC(C)=O)C3)c2c1	ZINC000450526367	EH	On-Demand	Anodyne	SIRT2	45	33
CCc1ccc2nccc(N3CCC[C@@H](CCNC(C)=O)C3)c2c1	ZINC000450526367	EH	On-Demand	Anodyne	SIRT1	43	41
CCc1ccc2nccc(N3CCC[C@H](CCNC(C)=O)C3)c2c1	ZINC000450526368	EH	On-Demand	Anodyne	SIRT3	44	41
CCc1ccc2nccc(N3CCC[C@H](CCNC(C)=O)C3)c2c1	ZINC000450526368	EH	On-Demand	Anodyne	SIRT2	45	33
CCc1ccc2nccc(N3CCC[C@H](CCNC(C)=O)C3)c2c1	ZINC000450526368	EH	On-Demand	Anodyne	SIRT1	43	41
O=[N+]([O-])c1cccc2c(N3CCC(Cc4ccccc4CO)CC3)nccc12	ZINC000450526369	GI	On-Demand	Bother	PQSD	0	44
CCSc1cccnc1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450526376	EG	On-Demand	Anodyne	SSTR2	0	41
CCN(CC)CCCC1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450526424	GI	On-Demand	Anodyne	P2RY12	107	37
CCN(CC)CCCC1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450526424	GI	On-Demand	Anodyne	AGER	0	45
CC(C)(CNc1ncnc2cc(Br)ccc12)OCCO	ZINC000450526425	EE	On-Demand	Anodyne	EGFR	68	41
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](CO)C3CCOCC3)ccc21	ZINC000450526437	GF	On-Demand	Anodyne	HPGD	44	54
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](CO)C3CCOCC3)ccc21	ZINC000450526438	GF	On-Demand	Anodyne	HPGD	44	54
COc1ccc(C2CCN(C(=O)[C@H]3CCC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000450526445	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
COc1ccc(C2CCN(C(=O)[C@H]3CCC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000450526445	EG	On-Demand	Anodyne	SLC6A11	0	42
COc1ccc(C2CCN(C(=O)[C@H]3CCC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000450526445	EG	On-Demand	Anodyne	NPBWR1	56	33
COc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000450526446	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
COc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000450526446	EG	On-Demand	Anodyne	SLC6A11	0	42
COc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000450526446	EG	On-Demand	Anodyne	NPBWR1	56	33
COc1ccc(C2CCN(C(=O)[C@H]3CCC[C@H](C(=O)O)C3)CC2)cc1	ZINC000450526447	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
COc1ccc(C2CCN(C(=O)[C@H]3CCC[C@H](C(=O)O)C3)CC2)cc1	ZINC000450526447	EG	On-Demand	Anodyne	SLC6A11	0	42
COc1ccc(C2CCN(C(=O)[C@H]3CCC[C@H](C(=O)O)C3)CC2)cc1	ZINC000450526447	EG	On-Demand	Anodyne	NPBWR1	56	33
COc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@H](C(=O)O)C3)CC2)cc1	ZINC000450526448	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
COc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@H](C(=O)O)C3)CC2)cc1	ZINC000450526448	EG	On-Demand	Anodyne	SLC6A11	0	42
COc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@H](C(=O)O)C3)CC2)cc1	ZINC000450526448	EG	On-Demand	Anodyne	NPBWR1	56	33
COc1cccc2c1CCN(C(=O)CCCc1ncc(C)o1)C2	ZINC000450526459	DF	On-Demand	Anodyne	SSTR1	43	36
COc1ccc2c(c1)OC[C@H](NC(=O)[C@H]1Cc3cccc(C)c3O1)C2	ZINC000450526466	EE	On-Demand	Anodyne	MT-ND4	50	31
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@H]1Cc3cccc(C)c3O1)C2	ZINC000450526467	EE	On-Demand	Anodyne	MT-ND4	50	31
COc1ccc2c(c1)OC[C@H](NC(=O)[C@@H]1Cc3cccc(C)c3O1)C2	ZINC000450526468	EE	On-Demand	Anodyne	MT-ND4	50	31
COc1ccc2c(c1)OC[C@@H](NC(=O)[C@@H]1Cc3cccc(C)c3O1)C2	ZINC000450526469	EE	On-Demand	Anodyne	MT-ND4	50	31
CCOC(=O)c1cnc(C)c(NC(=O)c2cn(CCc3ccccc3)nn2)c1	ZINC000450526470	GF	On-Demand	Anodyne	CACNA1C	42	37
CCOC(=O)c1cnc(C)c(NC(=O)c2cn(CCc3ccccc3)nn2)c1	ZINC000450526470	GF	On-Demand	Anodyne	P2RY12	29	42
CCOC(=O)c1cnc(C)c(NC(=O)c2cn(CCc3ccccc3)nn2)c1	ZINC000450526470	GF	On-Demand	Anodyne	ADORA3	0	44
CCOC(=O)c1cnc(C)c(NC(=O)c2cn(CCc3ccccc3)nn2)c1	ZINC000450526470	GF	On-Demand	Anodyne	THYX_PBCV1	0	42
CCN(Cc1cn(C)nn1)C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450526485	EF	On-Demand	Anodyne	TSPO	32	46
CC(C)(C)Oc1cccc(CNC(=O)c2ccc(N3CCC3)nc2)n1	ZINC000450526486	EF	On-Demand	Anodyne	HPGDS	27	40
O=C(c1cc(Cl)c[nH]1)N1CCC(Nc2nccc(-c3cnccn3)n2)CC1	ZINC000450526496	GF	On-Demand	Anodyne	PRKD1	49	33
O=C(c1cc(Cl)c[nH]1)N1CCC(Nc2nccc(-c3cnccn3)n2)CC1	ZINC000450526496	GF	On-Demand	Anodyne	MAPK1	72	39
O=C(c1cc(Cl)c[nH]1)N1CCC(Nc2nccc(-c3cnccn3)n2)CC1	ZINC000450526496	GF	On-Demand	Anodyne	MAPK9	26	44
O=C(c1cc(Cl)c[nH]1)N1CCC(Nc2nccc(-c3cnccn3)n2)CC1	ZINC000450526496	GF	On-Demand	Anodyne	MAPK10	0	41
O=C(c1cc(Cl)c[nH]1)N1CCC(Nc2nccc(-c3cnccn3)n2)CC1	ZINC000450526496	GF	On-Demand	Anodyne	MAPK8	29	44
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	CTSD	29	41
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	PGC	44	31
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	CTSK	24	41
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	CACNA1B	42	42
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	F2R	27	40
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	ITGA4	41	35
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	MMP2	53	35
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	REN	87	38
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	CTSS	42	44
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	CAPN1	25	45
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	BLA1_STEMA	24	42
COCc1cccc(CC(=O)N[C@@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526513	EF	On-Demand	Anodyne	METAP2	25	41
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	CTSD	29	41
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	PGC	44	31
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	CTSK	24	41
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	CACNA1B	42	42
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	F2R	27	40
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	ITGA4	41	35
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	MMP2	53	35
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	REN	87	38
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	CTSS	42	44
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	CAPN1	25	45
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	BLA1_STEMA	24	42
COCc1cccc(CC(=O)N[C@H](CC2CCCCC2)C(=O)O)c1	ZINC000450526514	EF	On-Demand	Anodyne	METAP2	25	41
Cc1ccc(NC(=O)c2ccc(N3CCCCN3)c([N+](=O)[O-])c2)cc1	ZINC000450526516	EG	On-Demand	Bother	TAAR1	39	51
COCCN(CCOC)C1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450526534	GF	On-Demand	Anodyne	UTS2R	0	42
COCCN(CCOC)C1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450526534	GF	On-Demand	Anodyne	PDE3B	42	33
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(C#N)n2C)c1	ZINC000450526537	DE	On-Demand	Mild	P2RY12	37	42
C[C@@H](OCCc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526539	CE	On-Demand	Mild	SDH1	0	45
C[C@H](OCCc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526549	CE	On-Demand	Mild	SDH1	0	45
COCCCS(=O)(=O)c1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450526558	GE	On-Demand	Anodyne	GRM4	32	43
COCCCS(=O)(=O)c1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450526559	GE	On-Demand	Anodyne	GRM4	32	43
CC[C@@H]1C[C@H]1C(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450526562	DF	On-Demand	Anodyne	MMP13	28	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450526562	DF	On-Demand	Anodyne	MMP1	31	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450526562	DF	On-Demand	Anodyne	GPR88	0	45
CC[C@@H]1C[C@H]1C(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450526563	DF	On-Demand	Anodyne	MMP13	28	40
CC[C@@H]1C[C@H]1C(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450526563	DF	On-Demand	Anodyne	MMP1	31	40
CC[C@@H]1C[C@H]1C(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000450526563	DF	On-Demand	Anodyne	GPR88	0	45
COc1ccc2c(c1)OC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C2	ZINC000450526570	GF	On-Demand	Anodyne	MTNR1A	30	41
COc1ccc2c(c1)OC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C2	ZINC000450526571	GF	On-Demand	Anodyne	MTNR1A	30	41
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	MME	76	40
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	SDH1	0	42
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CTSB	44	37
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	PAPA1_CARPA	68	50
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CYSP_TRYCR	51	34
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CTSK	24	45
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CTSL	43	50
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CTSS	39	50
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CAPN2	44	31
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	ACE2	45	35
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CTSC	34	40
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CTSV	44	30
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	FPR1	44	34
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	CTRB_BOVIN	58	35
CO[C@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526577	CD	On-Demand	Mild	AMP1_PLAFQ	53	37
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	MME	76	40
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	SDH1	0	42
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CTSB	44	37
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	PAPA1_CARPA	68	50
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CYSP_TRYCR	51	34
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CTSK	24	45
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CTSL	43	50
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CTSS	39	50
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CAPN2	44	31
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	ACE2	45	35
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CTSC	34	40
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CTSV	44	30
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	FPR1	44	34
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	CTRB_BOVIN	58	35
CO[C@@H](Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000450526578	CD	On-Demand	Mild	AMP1_PLAFQ	53	37
CCOC(=O)c1cc(C(=O)N[C@@H](CN2CCCC2)c2ccc(OC)cc2)on1	ZINC000450526581	GE	On-Demand	Anodyne	OPRK1	0	43
CCOC(=O)c1cc(C(=O)N[C@H](CN2CCCC2)c2ccc(OC)cc2)on1	ZINC000450526582	GE	On-Demand	Anodyne	OPRK1	0	43
COc1ccc([C@H](CN2CCCC2)NC(=O)CCCn2nc(C)nc2C)cc1	ZINC000450526585	GF	On-Demand	Anodyne	METAP1	21	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCCn2nc(C)nc2C)cc1	ZINC000450526586	GF	On-Demand	Anodyne	METAP1	21	41
COc1cc(C(=O)O)ccc1CCNC(=O)C1(C)CC1	ZINC000450526595	CD	On-Demand	Anodyne	RARA	41	32
COc1cc(C(=O)O)ccc1CCNC(=O)C1(C)CC1	ZINC000450526595	CD	On-Demand	Anodyne	RXRG	50	39
COc1cc(C(=O)O)ccc1CCNC(=O)C1(C)CC1	ZINC000450526595	CD	On-Demand	Anodyne	RARB	39	40
COc1cc(C(=O)O)ccc1CCNC(=O)C1(C)CC1	ZINC000450526595	CD	On-Demand	Anodyne	RXRB	49	39
COc1cccc2c(NC3CCN(C(=O)c4cc(Cl)c[nH]4)CC3)nccc12	ZINC000450526596	GH	On-Demand	Anodyne	NTSR2	46	38
COc1cccc2c(NC3CCN(C(=O)c4cc(Cl)c[nH]4)CC3)nccc12	ZINC000450526596	GH	On-Demand	Anodyne	TACR3	24	40
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)n3)CC2)cc1	ZINC000450526607	EF	On-Demand	Anodyne	HSD11B1	0	60
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)n3)CC2)cc1	ZINC000450526607	EF	On-Demand	Anodyne	TRPC6	49	44
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)n3)CC2)cc1	ZINC000450526607	EF	On-Demand	Anodyne	TRPC3	23	44
O=C(Nc1cccc(Cl)c1)N1CCCN(Cc2cnns2)CC1	ZINC000450526613	FF	On-Demand	Anodyne	PYGL	0	50
O=C(Nc1cccc(Cl)c1)N1CCCN(Cc2cnns2)CC1	ZINC000450526613	FF	On-Demand	Anodyne	FAAH	24	44
Cc1cc(C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)nn1C(C)C	ZINC000450526627	FD	On-Demand	Anodyne	MMP13	15	41
Cc1cc(C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)nn1C(C)C	ZINC000450526627	FD	On-Demand	Anodyne	CARM1	46	33
CCc1cc(N2CCC[C@@H](CCNC(C)=O)C2)ccn1	ZINC000450526628	CE	On-Demand	Anodyne	SIRT2	43	31
CCc1cc(N2CCC[C@H](CCNC(C)=O)C2)ccn1	ZINC000450526629	CE	On-Demand	Anodyne	SIRT2	43	31
C[C@H]1COc2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450526635	EI	On-Demand	Anodyne	HCRTR2	25	41
C[C@@H]1COc2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450526636	EI	On-Demand	Anodyne	HCRTR2	25	41
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	HTR1A	66	50
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	THRA	0	43
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	DRD2	49	52
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	DRD1	24	45
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	DRD4	52	45
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	HTR2A	32	45
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	HTR2C	20	42
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	HRH1	19	45
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	DRD3	48	52
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	HTR7	57	47
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	SIGMAR1	18	52
CCOC(=O)c1ccc(N2CCCN(CCCC(=O)c3ccccc3)CC2)nc1	ZINC000450526637	GG	On-Demand	Anodyne	CYP2J2	57	41
C[C@H](c1ccccc1)[C@@H](O)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450526638	DE	On-Demand	Anodyne	TPP2	40	40
C[C@@H](c1ccccc1)[C@H](O)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450526639	DE	On-Demand	Anodyne	TPP2	40	40
C[C@H](c1ccccc1)[C@H](O)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450526640	DE	On-Demand	Anodyne	TPP2	40	40
C[C@@H](c1ccccc1)[C@@H](O)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450526641	DE	On-Demand	Anodyne	TPP2	40	40
COc1ccc(-c2noc(N[C@@H]3CCCCC[C@H]3O)n2)cc1	ZINC000450526646	DE	On-Demand	Anodyne	LUCI_PHOPE	15	40
Cc1cc(C(=O)N2Cc3ccccc3OC[C@@H]2C)nn1C(C)C	ZINC000450526653	DG	On-Demand	Anodyne	BCL2	22	47
Cc1cc(C(=O)N2Cc3ccccc3OC[C@H]2C)nn1C(C)C	ZINC000450526654	DG	On-Demand	Anodyne	BCL2	22	47
COc1cccc2c1CCN(C(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C2	ZINC000450526665	DH	On-Demand	Anodyne	SSTR2	44	42
COc1cccc2c1CCN(C(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C2	ZINC000450526665	DH	On-Demand	Anodyne	AGTR2	46	33
CCN(CC)CCCC1CCN(C(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450526669	GG	On-Demand	Anodyne	ACHE	23	40
CCN(CC)CCCC1CCN(C(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450526669	GG	On-Demand	Anodyne	THYX_PBCV1	0	41
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	HRH2	21	45
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	SIGMAR1	18	40
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	CCR3	35	41
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	PYGL	0	52
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	LSS	15	41
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	FAAH	33	63
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	CCR2	20	51
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	EPHX2	19	40
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	CXCR3	30	42
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	MCHR1	40	41
CC(=O)c1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000450526670	GI	On-Demand	Anodyne	P2RY14	43	34
COc1cccc2c1CCN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)C2	ZINC000450526677	FJ	On-Demand	Anodyne	PRCP	53	38
COc1cccc2c1CCN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)C2	ZINC000450526677	FJ	On-Demand	Anodyne	CPT1A	18	47
COc1cccc2c1CCN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)C2	ZINC000450526677	FJ	On-Demand	Anodyne	CPT2	39	47
COc1cccc2c1CCN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)C2	ZINC000450526677	FJ	On-Demand	Anodyne	SSTR1	50	40
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)C2	ZINC000450526678	FJ	On-Demand	Anodyne	PRCP	53	38
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)C2	ZINC000450526678	FJ	On-Demand	Anodyne	CPT1A	18	47
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)C2	ZINC000450526678	FJ	On-Demand	Anodyne	CPT2	39	47
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)C2	ZINC000450526678	FJ	On-Demand	Anodyne	SSTR1	50	40
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)C2	ZINC000450526679	FJ	On-Demand	Anodyne	PRCP	53	38
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)C2	ZINC000450526679	FJ	On-Demand	Anodyne	CPT1A	18	47
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)C2	ZINC000450526679	FJ	On-Demand	Anodyne	CPT2	39	47
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)C2	ZINC000450526679	FJ	On-Demand	Anodyne	SSTR1	50	40
COc1cccc2c1CCN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)C2	ZINC000450526680	FJ	On-Demand	Anodyne	PRCP	53	38
COc1cccc2c1CCN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)C2	ZINC000450526680	FJ	On-Demand	Anodyne	CPT1A	18	47
COc1cccc2c1CCN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)C2	ZINC000450526680	FJ	On-Demand	Anodyne	CPT2	39	47
COc1cccc2c1CCN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)C2	ZINC000450526680	FJ	On-Demand	Anodyne	SSTR1	50	40
Cc1nc(N[C@H]2CCCN(CC(F)(F)F)C2)c2cc[nH]c2n1	ZINC000450526684	DF	On-Demand	Anodyne	JAK3	22	51
Cc1nc(N[C@@H]2CCCN(CC(F)(F)F)C2)c2cc[nH]c2n1	ZINC000450526685	DF	On-Demand	Anodyne	JAK3	22	51
C[C@@H](c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)cc1)C(F)(F)F	ZINC000450526692	GG	On-Demand	Anodyne	TRPV1	16	40
C[C@@H](c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)cc1)C(F)(F)F	ZINC000450526692	GG	On-Demand	Anodyne	PARP1	15	43
C[C@H](c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)cc1)C(F)(F)F	ZINC000450526693	GG	On-Demand	Anodyne	TRPV1	16	40
C[C@H](c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)cc1)C(F)(F)F	ZINC000450526693	GG	On-Demand	Anodyne	PARP1	15	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450526702	EF	On-Demand	Anodyne	MTTP	46	35
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](CO)C1CCOCC1	ZINC000450526703	EF	On-Demand	Anodyne	MTTP	46	35
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526707	FG	On-Demand	Anodyne	OPRK1	0	46
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526707	FG	On-Demand	Anodyne	UTS2	52	42
COc1ccc([C@H](CN2CCCC2)NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526708	FG	On-Demand	Anodyne	OPRK1	0	46
COc1ccc([C@H](CN2CCCC2)NC(=O)c2cncc(Cl)c2)cc1	ZINC000450526708	FG	On-Demand	Anodyne	UTS2	52	42
O=C(O)[C@@H]1[C@@H]2CCC[C@H]2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450526719	GD	On-Demand	Bother	SSTR3	51	35
O=C(O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450526720	GD	On-Demand	Bother	SSTR3	51	35
O=C(O)[C@@H]1[C@H]2CCC[C@@H]2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450526721	GD	On-Demand	Bother	SSTR3	51	35
O=C(O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000450526722	GD	On-Demand	Bother	SSTR3	51	35
Cc1ccc(F)c(CC(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450526728	EF	On-Demand	Anodyne	WNT3	42	35
C[C@](CNC(=O)[C@@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526754	FG	On-Demand	Anodyne	SLC6A11	0	40
C[C@](CNC(=O)[C@@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526754	FG	On-Demand	Anodyne	SLC6A12	0	40
C[C@](CNC(=O)[C@@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526754	FG	On-Demand	Anodyne	CACNA1G	41	44
C[C@@](CNC(=O)[C@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526755	FG	On-Demand	Anodyne	SLC6A11	0	40
C[C@@](CNC(=O)[C@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526755	FG	On-Demand	Anodyne	SLC6A12	0	40
C[C@@](CNC(=O)[C@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526755	FG	On-Demand	Anodyne	CACNA1G	41	44
C[C@@](CNC(=O)[C@@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526756	FG	On-Demand	Anodyne	SLC6A11	0	40
C[C@@](CNC(=O)[C@@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526756	FG	On-Demand	Anodyne	SLC6A12	0	40
C[C@@](CNC(=O)[C@@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526756	FG	On-Demand	Anodyne	CACNA1G	41	44
C[C@](CNC(=O)[C@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526757	FG	On-Demand	Anodyne	SLC6A11	0	40
C[C@](CNC(=O)[C@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526757	FG	On-Demand	Anodyne	SLC6A12	0	40
C[C@](CNC(=O)[C@H](c1ccccc1)C1CC1)(C(=O)O)c1ccc(F)cc1	ZINC000450526757	FG	On-Demand	Anodyne	CACNA1G	41	44
CN(C)c1nc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)nc2ccccc12	ZINC000450526763	GF	On-Demand	Anodyne	ADRA2A	21	57
CN(C)c1nc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)nc2ccccc12	ZINC000450526763	GF	On-Demand	Anodyne	GRIN2B	29	41
CN(C)c1nc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)nc2ccccc12	ZINC000450526763	GF	On-Demand	Anodyne	JUN	15	45
CN(C)c1nc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)nc2ccccc12	ZINC000450526763	GF	On-Demand	Anodyne	MAPK9	20	45
CN(C)c1nc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)nc2ccccc12	ZINC000450526763	GF	On-Demand	Anodyne	MAPK8	20	45
CCSc1cccnc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450526784	FF	On-Demand	Anodyne	C3AR1	41	34
C[C@@H](C(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C1CC1	ZINC000450526786	DH	On-Demand	Anodyne	SDH1	0	40
C[C@@H](C(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C1CC1	ZINC000450526786	DH	On-Demand	Anodyne	CASP1	45	41
C[C@@H](C(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C1CC1	ZINC000450526786	DH	On-Demand	Anodyne	CAPN2	79	41
C[C@@H](C(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C1CC1	ZINC000450526786	DH	On-Demand	Anodyne	UTS2	38	48
C[C@@H](C(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C1CC1	ZINC000450526786	DH	On-Demand	Anodyne	GPR88	0	46
C[C@H](C(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C1CC1	ZINC000450526787	DH	On-Demand	Anodyne	SDH1	0	40
C[C@H](C(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C1CC1	ZINC000450526787	DH	On-Demand	Anodyne	CAPN2	79	41
C[C@H](C(=O)N[C@H](CC(=O)O)c1ccc2ccccc2c1)C1CC1	ZINC000450526787	DH	On-Demand	Anodyne	GPR88	0	46
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	DRD4	35	44
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	ACHE	18	49
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	KCNH2	16	42
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	CHRM3	15	42
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	LTA4H	19	43
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	MAPK11	30	40
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	SIGMAR1	30	50
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	SSTR5	50	41
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	CCR3	25	47
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	SLC6A5	31	43
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	MCHR1	52	48
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000450526806	FH	On-Demand	Anodyne	ADIPOR2	0	41
CCc1cc(CCCN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)on1	ZINC000450526812	GI	On-Demand	Anodyne	PLA2G2A	24	40
CCc1cc(CCCN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)on1	ZINC000450526812	GI	On-Demand	Anodyne	PYGL	0	54
CCc1cc(CCCN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)on1	ZINC000450526812	GI	On-Demand	Anodyne	FAAH	15	45
CCc1cc(CCCN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)on1	ZINC000450526812	GI	On-Demand	Anodyne	P2RY14	44	34
CCN(CC)CCCC1CCN(C(=O)CCc2ccc3ccccc3c2O)CC1	ZINC000450526813	GJ	On-Demand	Anodyne	CCR8	44	41
COc1cccc2c1CCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)C2	ZINC000450526827	DE	On-Demand	Anodyne	HCRTR2	15	48
CCC(=O)CCCN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450526828	DG	On-Demand	Anodyne	CYP2J2	46	33
COC(=O)c1csc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)n1	ZINC000450526831	GF	On-Demand	Anodyne	SSTR5	44	35
COC(=O)c1coc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)n1	ZINC000450526832	GF	On-Demand	Anodyne	P2RY12	15	45
COC(=O)c1coc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)n1	ZINC000450526832	GF	On-Demand	Anodyne	PYGL	0	47
COC(=O)c1coc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)n1	ZINC000450526832	GF	On-Demand	Anodyne	FAAH	24	50
COC(=O)c1coc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)n1	ZINC000450526832	GF	On-Demand	Anodyne	P2RY14	42	32
COCCOCCN(C)c1nc(-c2ccc(OC)cc2)no1	ZINC000450526844	DD	On-Demand	Anodyne	LUCI_PHOPE	16	42
CC1(C(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)CCC(=O)CC1	ZINC000450526852	FG	On-Demand	Anodyne	FFAR2	51	33
CN(C)c1nc(NC[C@H]2CCC[C@@H](CO)C2)nc2ccccc12	ZINC000450526854	DE	On-Demand	Anodyne	ADRA2A	20	63
CN(C)c1nc(NC[C@H]2CCC[C@@H](CO)C2)nc2ccccc12	ZINC000450526854	DE	On-Demand	Anodyne	NPY2R	19	63
COc1cccc2c1CCN(C(=O)c1cccc(SC)c1)C2	ZINC000450526859	DH	On-Demand	Anodyne	DRD4	40	30
COc1cccc2c1CCN(C(=O)c1cccc(SC)c1)C2	ZINC000450526859	DH	On-Demand	Anodyne	SSTR1	48	36
COc1cccc2c1CCN(C(=O)c1cccc(SC)c1)C2	ZINC000450526859	DH	On-Demand	Anodyne	AKR1C3	22	50
COc1cccc2c1CCN(C(=O)CCCC(=O)C1CC1)C2	ZINC000450526869	DF	On-Demand	Anodyne	HTR1A	23	50
COc1cccc2c1CCN(C(=O)CCCC(=O)C1CC1)C2	ZINC000450526869	DF	On-Demand	Anodyne	SSTR2	45	38
COc1cccc2c1CCN(C(=O)CCCC(=O)C1CC1)C2	ZINC000450526869	DF	On-Demand	Anodyne	SSTR1	47	35
CCOC(=O)c1ccc(N2CCCN(Cc3ccc(C(C)=O)cc3)CC2)nc1	ZINC000450526878	GG	On-Demand	Anodyne	P2RY12	25	40
CCOC(=O)c1ccc(N2CCCN(Cc3ccc(C(C)=O)cc3)CC2)nc1	ZINC000450526878	GG	On-Demand	Anodyne	SSTR5	41	33
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	HTR1A	18	58
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	DRD2	40	53
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	DRD1	26	49
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	DRD4	37	45
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	ADRA1D	25	40
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	HTR2A	39	49
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	HTR2C	26	55
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	ADRA1B	18	45
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	DRD3	30	49
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	KCNH2	19	43
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	ERG2	20	43
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	HTR7	18	43
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	MAPK11	29	42
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	MAPK14	21	42
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	SIGMAR1	17	43
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	SSTR5	40	38
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	CCR3	38	44
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	PLD1	48	37
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	SLC18A3	0	46
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	HTR3B	0	43
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	PLD2	45	37
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	MCHR1	31	44
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	CYP2J2	58	42
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450526884	GI	On-Demand	Anodyne	AP2S1	0	43
Cc1ccc(C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c2c1CCC2	ZINC000450526899	FF	On-Demand	Anodyne	E1	0	40
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	CHRM1	19	43
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	DRD2	20	42
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	DRD4	25	45
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	ACHE	18	43
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	HTR2A	18	47
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	DRD3	18	40
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	HTR7	16	41
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	SIGMAR1	39	42
Cc1ccc(C(=O)NC2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450526901	FG	On-Demand	Anodyne	SLC6A5	28	40
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cc3c([nH]2)CCCC3)c1	ZINC000450526902	FE	On-Demand	Anodyne	NAMPT	43	41
CC1(C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000450526905	DF	On-Demand	Anodyne	SLC6A1	65	44
CC1(C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000450526905	DF	On-Demand	Anodyne	MC4R	32	41
Cc1cc(-c2nc(C(=O)NCC(C)(C)C#N)co2)ccn1	ZINC000450526907	CE	On-Demand	Mild	IRAK4	21	43
COC1(C(=O)N[C@H](CC2CCCCC2)C(=O)O)CCC1	ZINC000450526917	CE	On-Demand	Anodyne	METAP2	0	40
COC1(C(=O)N[C@@H](CC2CCCCC2)C(=O)O)CCC1	ZINC000450526918	CE	On-Demand	Anodyne	METAP2	0	40
COc1cccc(OCCC(=O)N[C@@H]2COc3cc(OC)ccc3C2)c1	ZINC000450526932	FF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1cccc(OCCC(=O)N[C@@H]2COc3cc(OC)ccc3C2)c1	ZINC000450526932	FF	On-Demand	Anodyne	MTNR1A	51	43
COc1cccc(OCCC(=O)N[C@H]2COc3cc(OC)ccc3C2)c1	ZINC000450526933	FF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1cccc(OCCC(=O)N[C@H]2COc3cc(OC)ccc3C2)c1	ZINC000450526933	FF	On-Demand	Anodyne	MTNR1A	51	43
Cn1nc(-c2ccccc2)cc1C(=O)NCC(C)(C)C#N	ZINC000450526947	CE	On-Demand	Mild	CTSL	18	41
Cn1nc(-c2ccccc2)cc1C(=O)NCC(C)(C)C#N	ZINC000450526947	CE	On-Demand	Mild	CTSS	18	41
Cn1nc(-c2ccccc2)cc1C(=O)NCC(C)(C)C#N	ZINC000450526947	CE	On-Demand	Mild	CTSV	57	39
Cc1c(C(=O)O)cnn1-c1cccc(NC(=O)C2(C)CC2)c1	ZINC000450526966	CF	On-Demand	Anodyne	SLC9A2	0	40
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450526967	GF	On-Demand	Anodyne	PDE4D	16	40
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450526967	GF	On-Demand	Anodyne	PDEC	0	40
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450526968	GF	On-Demand	Anodyne	PDE4D	16	40
CCOC(=O)c1cnc(C)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450526968	GF	On-Demand	Anodyne	PDEC	0	40
O=C(CCCC1CCOCC1)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450526975	EG	On-Demand	Anodyne	NMT1	23	40
O=C(CCCC1CCOCC1)N[C@@H](CC1CCCCC1)C(=O)O	ZINC000450526975	EG	On-Demand	Anodyne	MMP2	51	32
O=C(CCCC1CCOCC1)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450526976	EG	On-Demand	Anodyne	NMT1	23	40
O=C(CCCC1CCOCC1)N[C@H](CC1CCCCC1)C(=O)O	ZINC000450526976	EG	On-Demand	Anodyne	MMP2	51	32
COCCCS(=O)(=O)c1ccc(NC(=O)C2(CF)CCOCC2)cc1	ZINC000450526982	FE	On-Demand	Anodyne	MMP13	30	44
COCCCS(=O)(=O)c1ccc(NC(=O)C2(CF)CCOCC2)cc1	ZINC000450526982	FE	On-Demand	Anodyne	MMP2	25	40
COCCCS(=O)(=O)c1ccc(NC(=O)C2(CF)CCOCC2)cc1	ZINC000450526982	FE	On-Demand	Anodyne	MMP8	15	44
COCCCS(=O)(=O)c1ccc(NC(=O)C2(CF)CCOCC2)cc1	ZINC000450526982	FE	On-Demand	Anodyne	MMP14	18	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450526992	EE	On-Demand	Anodyne	OPRK1	17	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450526992	EE	On-Demand	Anodyne	MMP13	21	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450526992	EE	On-Demand	Anodyne	MMP3	16	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450526992	EE	On-Demand	Anodyne	MMP1	19	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450526993	EE	On-Demand	Anodyne	OPRK1	17	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450526993	EE	On-Demand	Anodyne	MMP13	21	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450526993	EE	On-Demand	Anodyne	MMP3	16	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450526993	EE	On-Demand	Anodyne	MMP1	19	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450526994	EE	On-Demand	Anodyne	OPRK1	17	42
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450526994	EE	On-Demand	Anodyne	MMP13	21	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450526994	EE	On-Demand	Anodyne	MMP3	16	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450526994	EE	On-Demand	Anodyne	MMP1	19	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450526995	EE	On-Demand	Anodyne	OPRK1	17	42
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450526995	EE	On-Demand	Anodyne	MMP13	21	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450526995	EE	On-Demand	Anodyne	MMP3	16	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450526995	EE	On-Demand	Anodyne	MMP1	19	40
COc1cc(C(=O)O)ccc1CCNC(=O)CCCc1cc(F)ccc1F	ZINC000450527001	GG	On-Demand	Anodyne	CYSLTR1	23	40
COc1cc(C(=O)O)ccc1CCNC(=O)CCCc1cc(F)ccc1F	ZINC000450527001	GG	On-Demand	Anodyne	LTB4R	15	40
COc1cc(C(=O)O)ccc1CCNC(=O)CCCc1cc(F)ccc1F	ZINC000450527001	GG	On-Demand	Anodyne	MTNR1A	43	39
COc1cc(C(=O)O)ccc1CCNC(=O)CCCc1cc(F)ccc1F	ZINC000450527001	GG	On-Demand	Anodyne	ACKR3	51	33
O=C(O)c1coc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450527010	DE	On-Demand	Anodyne	AVPR1A	0	47
O=C(O)c1coc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450527011	DE	On-Demand	Anodyne	AVPR1A	0	47
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	HTR1A	36	48
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	DRD2	34	50
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	DRD1	21	45
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	HTR2A	36	45
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	HTR2C	18	40
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	DRD3	43	45
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	HTR7	39	40
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	FAAH	21	55
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	MCHR1	35	52
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	P2RY14	42	33
O=C(CCCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1)c1ccccc1	ZINC000450527017	GJ	On-Demand	Anodyne	KCNK3	33	40
Cc1ccc2c(c1)[C@@H](Nc1ncc(C#N)cc1[N+](=O)[O-])CCC2	ZINC000450527018	DH	On-Demand	Mild	KCNN3	19	43
C=CCOc1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450527021	GE	On-Demand	Mild	CA5A	15	40
C=CCOc1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450527021	GE	On-Demand	Mild	MTNR1A	19	44
C=CCOc1ccc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000450527021	GE	On-Demand	Mild	CA9	21	42
Cc1nc(NCc2ccncc2OCCN(C)C)ncc1[N+](=O)[O-]	ZINC000450527036	ED	On-Demand	Bother	PRKCQ	41	39
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cc3n(n2)CCCC3)c1	ZINC000450527070	FD	On-Demand	Anodyne	NAMPT	44	36
Cc1cc(C)c([N+](=O)[O-])c(NCC(=O)Nc2ccn(C)n2)n1	ZINC000450527081	DC	On-Demand	Bother	GCK	17	40
FC(F)(F)C1CC(Nc2ncnc3cc(Br)ccc23)C1	ZINC000450527091	EI	On-Demand	Anodyne	EGFR	59	40
FC(F)(F)C1CC(Nc2ncnc3cc(Br)ccc23)C1	ZINC000450527091	EI	On-Demand	Anodyne	CD38	55	39
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	VACHT_TETCF	0	40
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	HSD11B1	0	61
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	FASN	42	37
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	KDM4C	0	45
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	L3MBTL1	0	40
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	L3MBTL3	43	40
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	MAP3K12	38	43
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	FTO	0	45
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	TRPC6	49	43
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	TRPC3	22	43
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	GPR183	0	42
COc1ccc(C2CCN(C(=O)c3ccnc(C(=O)O)c3)CC2)cc1	ZINC000450527094	EF	On-Demand	Anodyne	SLC6A7	0	45
Fc1ccc2[nH]cc(C3CCN(c4ncc(C(F)F)cn4)CC3)c2c1	ZINC000450527095	EI	On-Demand	Anodyne	HTR1D	25	42
COc1ccc(-c2ccnc(N3CC[C@@H](COC(F)F)C3)n2)cc1	ZINC000450527114	EG	On-Demand	Anodyne	PDE4D	41	39
COc1ccc(-c2ccnc(N3CC[C@@H](COC(F)F)C3)n2)cc1	ZINC000450527114	EG	On-Demand	Anodyne	DKK1	0	46
COc1ccc(-c2ccnc(N3CC[C@H](COC(F)F)C3)n2)cc1	ZINC000450527115	EG	On-Demand	Anodyne	PDE4D	41	39
COc1ccc(-c2ccnc(N3CC[C@H](COC(F)F)C3)n2)cc1	ZINC000450527115	EG	On-Demand	Anodyne	DKK1	0	46
COc1ccc2c(c1)OC[C@@H](NC(=O)CCCC(C)C)C2	ZINC000450527117	CF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc2c(c1)OC[C@@H](NC(=O)CCCC(C)C)C2	ZINC000450527117	CF	On-Demand	Anodyne	MTNR1A	30	48
COc1ccc2c(c1)OC[C@H](NC(=O)CCCC(C)C)C2	ZINC000450527118	CF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc2c(c1)OC[C@H](NC(=O)CCCC(C)C)C2	ZINC000450527118	CF	On-Demand	Anodyne	MTNR1A	30	48
C[C@@H]1CSC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450527148	DG	On-Demand	Bother	MAOA	15	53
C[C@@H]1CSC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450527148	DG	On-Demand	Bother	MAOB	31	56
C[C@H]1CSC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450527149	DG	On-Demand	Bother	MAOA	15	53
C[C@H]1CSC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450527149	DG	On-Demand	Bother	MAOB	31	56
C[C@H]1CSC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450527150	DG	On-Demand	Bother	MAOA	15	53
C[C@H]1CSC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450527150	DG	On-Demand	Bother	MAOB	31	56
C[C@@H]1CSC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450527151	DG	On-Demand	Bother	MAOA	15	53
C[C@@H]1CSC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450527151	DG	On-Demand	Bother	MAOB	31	56
COc1ccc2c(c1)OC[C@H](NC(=O)CC1CC(F)(F)C1)C2	ZINC000450527169	DF	On-Demand	Anodyne	MTNR1A	21	42
COc1ccc2c(c1)OC[C@@H](NC(=O)CC1CC(F)(F)C1)C2	ZINC000450527170	DF	On-Demand	Anodyne	MTNR1A	21	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450527172	GH	On-Demand	Anodyne	DRD4	41	32
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450527172	GH	On-Demand	Anodyne	MTNR1A	37	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450527172	GH	On-Demand	Anodyne	MTNR1B	36	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450527172	GH	On-Demand	Anodyne	GPR88	0	49
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450527173	GH	On-Demand	Anodyne	DRD4	41	32
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450527173	GH	On-Demand	Anodyne	MTNR1A	37	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450527173	GH	On-Demand	Anodyne	MTNR1B	36	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450527173	GH	On-Demand	Anodyne	GPR88	0	49
C[C@@H]1CN(C(=O)CCCc2cc(F)ccc2F)CC[C@H]1C(=O)O	ZINC000450527179	EF	On-Demand	Anodyne	DPP4	25	43
C[C@H]1CN(C(=O)CCCc2cc(F)ccc2F)CC[C@@H]1C(=O)O	ZINC000450527180	EF	On-Demand	Anodyne	DPP4	25	43
C[C@@H]1CN(C(=O)CCCc2cc(F)ccc2F)CC[C@@H]1C(=O)O	ZINC000450527181	EF	On-Demand	Anodyne	DPP4	25	43
C[C@H]1CN(C(=O)CCCc2cc(F)ccc2F)CC[C@H]1C(=O)O	ZINC000450527182	EF	On-Demand	Anodyne	DPP4	25	43
CC(C)(COCc1ccccc1)C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450527186	GH	On-Demand	Anodyne	CACNA1G	33	40
CC(C)(COCc1ccccc1)C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450527187	GH	On-Demand	Anodyne	CACNA1G	33	40
C[C@H]1CC[C@]2(CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)C1	ZINC000450527203	EG	On-Demand	Anodyne	PREP	58	43
C[C@H]1CC[C@]2(CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)C1	ZINC000450527203	EG	On-Demand	Anodyne	SFRP1	39	40
C[C@H]1CC[C@]2(CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)C1	ZINC000450527203	EG	On-Demand	Anodyne	WNT3	42	32
C[C@H]1CC[C@@]2(CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)C1	ZINC000450527204	EG	On-Demand	Anodyne	PREP	58	43
C[C@H]1CC[C@@]2(CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)C1	ZINC000450527204	EG	On-Demand	Anodyne	SFRP1	39	40
C[C@H]1CC[C@@]2(CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)C1	ZINC000450527204	EG	On-Demand	Anodyne	WNT3	42	32
COc1cc([C@@H](C)Nc2nc(N(C)C)c3ccccc3n2)ccn1	ZINC000450527208	DF	On-Demand	Anodyne	ADRA2A	15	40
COc1cc([C@H](C)Nc2nc(N(C)C)c3ccccc3n2)ccn1	ZINC000450527209	DF	On-Demand	Anodyne	ADRA2A	15	40
COC(=O)c1csc(CN2c3ccccc3C[C@H]2C(N)=O)n1	ZINC000450527220	DD	On-Demand	Anodyne	TPP2	56	35
COC(=O)c1csc(CN2c3ccccc3C[C@H]2C(N)=O)n1	ZINC000450527220	DD	On-Demand	Anodyne	TRPC6	53	36
COc1cccc2c1CCN(C(=O)C(C)(C)OC(C)C)C2	ZINC000450527232	CF	On-Demand	Anodyne	SSTR1	41	33
COc1ccc(-c2ccnc(NC[C@H]3CCCSC3)n2)cc1	ZINC000450527234	DH	On-Demand	Anodyne	VCP	43	45
COc1ccc(-c2ccnc(NC[C@@H]3CCCSC3)n2)cc1	ZINC000450527235	DH	On-Demand	Anodyne	CLK4	27	50
COc1ccc(-c2ccnc(NC[C@@H]3CCCSC3)n2)cc1	ZINC000450527235	DH	On-Demand	Anodyne	VCP	43	45
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	HTR1A	26	45
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	DRD2	46	47
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	DRD1	23	45
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	DRD4	37	46
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	HTR2A	35	46
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	HTR2C	37	48
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	ADRA1A	15	42
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	DRD3	44	39
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	HTR7	30	42
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	SIGMAR1	23	45
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	CCR3	19	43
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	MCHR1	27	48
Cc1ccc(C(=O)NC2CCN(CCCC(=O)c3ccccc3)CC2)s1	ZINC000450527236	FH	On-Demand	Anodyne	CYP2J2	66	48
O=C(Cc1ccc(OC(F)F)c(F)c1)N[C@H](CO)C1CCOCC1	ZINC000450527239	ED	On-Demand	Anodyne	PDEC	0	40
O=C(Cc1ccc(OC(F)F)c(F)c1)N[C@@H](CO)C1CCOCC1	ZINC000450527240	ED	On-Demand	Anodyne	PDEC	0	40
O=C(N[C@@H](CO)C1CCOCC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450527241	FF	On-Demand	Anodyne	RBP4	69	39
O=C(N[C@H](CO)C1CCOCC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450527242	FF	On-Demand	Anodyne	RBP4	69	39
COC(=O)C[C@H]1COCCN1c1nc(C)cc(OCc2ccccc2)n1	ZINC000450527245	FE	On-Demand	Anodyne	ADAM17	41	35
COC(=O)C[C@@H]1COCCN1c1nc(C)cc(OCc2ccccc2)n1	ZINC000450527246	FE	On-Demand	Anodyne	ADAM17	41	35
O=C(N[C@@H](CO)C1CCOCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450527248	GE	On-Demand	Anodyne	TRPC6	57	36
O=C(N[C@@H](CO)C1CCOCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450527248	GE	On-Demand	Anodyne	TRPC3	50	36
O=C(N[C@H](CO)C1CCOCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450527249	GE	On-Demand	Anodyne	TRPC6	57	36
O=C(N[C@H](CO)C1CCOCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450527249	GE	On-Demand	Anodyne	TRPC3	50	36
COc1cccc2c1CCN(C(=O)c1ccc(-c3cnn(C)c3)o1)C2	ZINC000450527252	EF	On-Demand	Anodyne	SSTR2	45	41
COc1cccc2c1CCN(C(=O)c1ccc(-c3cnn(C)c3)o1)C2	ZINC000450527252	EF	On-Demand	Anodyne	SSTR1	41	39
COc1cccc2c(N3CCC[C@@H](CCNC(C)=O)C3)nccc12	ZINC000450527278	EF	On-Demand	Anodyne	PDE3B	52	32
COc1cccc2c(N3CCC[C@@H](CCNC(C)=O)C3)nccc12	ZINC000450527278	EF	On-Demand	Anodyne	ACKR3	62	32
COc1cccc2c(N3CCC[C@H](CCNC(C)=O)C3)nccc12	ZINC000450527279	EF	On-Demand	Anodyne	PDE3B	52	32
COc1cccc2c(N3CCC[C@H](CCNC(C)=O)C3)nccc12	ZINC000450527279	EF	On-Demand	Anodyne	ACKR3	62	32
Cc1nc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)ncc1[N+](=O)[O-]	ZINC000450527289	FH	On-Demand	Bother	HTR1D	34	41
Cc1nc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)ncc1[N+](=O)[O-]	ZINC000450527289	FH	On-Demand	Bother	HTR1B	19	41
Cc1nc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)ncc1[N+](=O)[O-]	ZINC000450527289	FH	On-Demand	Bother	HTR1F	67	38
CC(C)N1CCCC[C@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527290	GI	On-Demand	Anodyne	CACNA1H	35	40
CC(C)N1CCCC[C@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527290	GI	On-Demand	Anodyne	OPRK1	0	42
CC(C)N1CCCC[C@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527290	GI	On-Demand	Anodyne	PYGL	0	48
CC(C)N1CCCC[C@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527290	GI	On-Demand	Anodyne	FAAH	15	47
CC(C)N1CCCC[C@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527290	GI	On-Demand	Anodyne	EPHX2	26	41
CC(C)N1CCCC[C@@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527291	GI	On-Demand	Anodyne	CACNA1H	35	40
CC(C)N1CCCC[C@@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527291	GI	On-Demand	Anodyne	OPRK1	0	42
CC(C)N1CCCC[C@@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527291	GI	On-Demand	Anodyne	PYGL	0	48
CC(C)N1CCCC[C@@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527291	GI	On-Demand	Anodyne	FAAH	15	47
CC(C)N1CCCC[C@@H]1CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450527291	GI	On-Demand	Anodyne	EPHX2	26	41
COc1cccc2c1CCN(C(=O)[C@H]1CCN(c3ccccc3)C1)C2	ZINC000450527303	EG	On-Demand	Anodyne	SSTR2	73	46
COc1cccc2c1CCN(C(=O)[C@H]1CCN(c3ccccc3)C1)C2	ZINC000450527303	EG	On-Demand	Anodyne	AGTR2	71	35
COc1cccc2c1CCN(C(=O)[C@H]1CCN(c3ccccc3)C1)C2	ZINC000450527303	EG	On-Demand	Anodyne	CPT2	22	56
COc1cccc2c1CCN(C(=O)[C@H]1CCN(c3ccccc3)C1)C2	ZINC000450527303	EG	On-Demand	Anodyne	SSTR1	78	44
COc1cccc2c1CCN(C(=O)[C@@H]1CCN(c3ccccc3)C1)C2	ZINC000450527304	EG	On-Demand	Anodyne	SSTR2	73	46
COc1cccc2c1CCN(C(=O)[C@@H]1CCN(c3ccccc3)C1)C2	ZINC000450527304	EG	On-Demand	Anodyne	AGTR2	71	35
COc1cccc2c1CCN(C(=O)[C@@H]1CCN(c3ccccc3)C1)C2	ZINC000450527304	EG	On-Demand	Anodyne	CPT2	22	56
COc1cccc2c1CCN(C(=O)[C@@H]1CCN(c3ccccc3)C1)C2	ZINC000450527304	EG	On-Demand	Anodyne	SSTR1	78	44
O=C(Cc1cccc(OCC(F)(F)F)c1)N[C@H](C(=O)O)c1cccs1	ZINC000450527342	FG	On-Demand	Anodyne	PDS	51	36
O=C(Cc1cccc(OCC(F)(F)F)c1)N[C@@H](C(=O)O)c1cccs1	ZINC000450527343	FG	On-Demand	Anodyne	PDS	51	36
C[C@@H]1CC[C@@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000450527344	EH	On-Demand	Bother	CACNA1C	42	33
C[C@@H]1CC[C@@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000450527344	EH	On-Demand	Bother	CACNA1D	67	33
C[C@H]1CC[C@@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000450527345	EH	On-Demand	Bother	CACNA1C	42	33
C[C@H]1CC[C@@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000450527345	EH	On-Demand	Bother	CACNA1D	67	33
C[C@@H]1CC[C@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000450527346	EH	On-Demand	Bother	CACNA1C	42	33
C[C@@H]1CC[C@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000450527346	EH	On-Demand	Bother	CACNA1D	67	33
C[C@H]1CC[C@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000450527347	EH	On-Demand	Bother	CACNA1C	42	33
C[C@H]1CC[C@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000450527347	EH	On-Demand	Bother	CACNA1D	67	33
CN(C)S(=O)(=O)CC(=O)N1C[C@@H](C(=O)O)[C@H](c2ccc(Cl)cc2)C1	ZINC000450527356	FC	On-Demand	Anodyne	SLC6A1	59	40
FC(F)c1cnc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450527362	EH	On-Demand	Anodyne	SIGMAR1	22	40
FC(F)c1cnc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450527363	EH	On-Demand	Anodyne	SIGMAR1	22	40
CC(C)c1nnc(N2CCOc3cc(O)ccc3C2)o1	ZINC000450527370	CE	On-Demand	Anodyne	DRD5	15	41
COCCCS(=O)(=O)c1ccc(NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450527371	GG	On-Demand	Anodyne	RORC	42	37
CCN(Cc1cn(C)nn1)C(=O)c1cnn2ccc(C)cc12	ZINC000450527373	CD	On-Demand	Anodyne	EPHB3	19	42
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527383	GG	On-Demand	Anodyne	SLC6A1	72	35
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527383	GG	On-Demand	Anodyne	OPRK1	28	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527383	GG	On-Demand	Anodyne	MMP13	29	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527383	GG	On-Demand	Anodyne	CCR5	28	51
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527383	GG	On-Demand	Anodyne	MMP1	34	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527383	GG	On-Demand	Anodyne	GPR88	0	49
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527384	GG	On-Demand	Anodyne	SLC6A1	72	35
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527384	GG	On-Demand	Anodyne	OPRK1	28	41
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527384	GG	On-Demand	Anodyne	MMP13	29	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527384	GG	On-Demand	Anodyne	CCR5	28	51
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527384	GG	On-Demand	Anodyne	MMP1	34	40
COc1ccc([C@@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527384	GG	On-Demand	Anodyne	GPR88	0	49
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527385	GG	On-Demand	Anodyne	SLC6A1	72	35
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527385	GG	On-Demand	Anodyne	OPRK1	28	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527385	GG	On-Demand	Anodyne	MMP13	29	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527385	GG	On-Demand	Anodyne	CCR5	28	51
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527385	GG	On-Demand	Anodyne	MMP1	34	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527385	GG	On-Demand	Anodyne	GPR88	0	49
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527386	GG	On-Demand	Anodyne	SLC6A1	72	35
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527386	GG	On-Demand	Anodyne	OPRK1	28	41
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527386	GG	On-Demand	Anodyne	MMP13	29	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527386	GG	On-Demand	Anodyne	CCR5	28	51
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527386	GG	On-Demand	Anodyne	MMP1	34	40
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450527386	GG	On-Demand	Anodyne	GPR88	0	49
CC(C)(CNc1ncnc2[nH]c3ccccc3c12)OCCO	ZINC000450527407	DE	On-Demand	Anodyne	UTS2R	30	43
CCN(CC)CCCC1CCN(C(=O)c2cncc(Cl)c2)CC1	ZINC000450527415	EH	On-Demand	Anodyne	CACNA1I	45	33
CCN(CC)CCCC1CCN(C(=O)c2cncc(Cl)c2)CC1	ZINC000450527415	EH	On-Demand	Anodyne	L3MBTL1	0	41
CCC(=O)C1(C(=O)N2CCc3c(cccc3OC)C2)CC1	ZINC000450527417	CE	On-Demand	Anodyne	SSTR1	41	32
COc1cccc2c1CCN(C(=O)Cc1ccc(O)c(F)c1)C2	ZINC000450527442	DF	On-Demand	Anodyne	AKR1C3	15	45
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450527444	FH	On-Demand	Anodyne	DRD4	26	40
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450527444	FH	On-Demand	Anodyne	DRD3	0	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450527444	FH	On-Demand	Anodyne	SIGMAR1	22	41
CO[C@@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450527444	FH	On-Demand	Anodyne	MCHR1	27	45
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450527445	FH	On-Demand	Anodyne	DRD4	26	40
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450527445	FH	On-Demand	Anodyne	DRD3	0	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450527445	FH	On-Demand	Anodyne	SIGMAR1	22	41
CO[C@H](Cc1ccccc1)CN1CCC(NC(=O)c2ccc(C)s2)CC1	ZINC000450527445	FH	On-Demand	Anodyne	MCHR1	27	45
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527453	ED	On-Demand	Anodyne	MAPK1	48	34
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527453	ED	On-Demand	Anodyne	CTSV	46	33
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527454	ED	On-Demand	Anodyne	MAPK1	48	34
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527454	ED	On-Demand	Anodyne	CTSV	46	33
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	DRD2	34	53
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	DRD4	58	52
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	ACHE	23	52
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	HRH1	18	55
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	DRD3	31	52
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	HTR3A	0	45
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	KCNH2	19	47
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	HTR4	64	52
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	SIGMAR1	27	48
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	SSTR5	94	55
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	CCR1	27	42
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	CCR3	38	50
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	UTS2R	33	47
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	PDK1	54	43
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	MCHR1	60	57
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	CACNA1I	15	40
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	CCR8	21	44
COc1cc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)ccc1Cl	ZINC000450527468	GI	On-Demand	Anodyne	CYP3A43	0	40
CCc1cc(N2CCC[C@@H](C3CC3)C2)ccn1	ZINC000450527477	BG	On-Demand	Anodyne	HRH4	16	40
CCc1cc(N2CCC[C@H](C3CC3)C2)ccn1	ZINC000450527478	BG	On-Demand	Anodyne	HRH4	16	40
CC(=O)NCC[C@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1	ZINC000450527483	GH	On-Demand	Anodyne	SIRT3	52	42
CC(=O)NCC[C@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1	ZINC000450527483	GH	On-Demand	Anodyne	SIRT2	52	34
CC(=O)NCC[C@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1	ZINC000450527483	GH	On-Demand	Anodyne	SIRT1	51	31
CC(=O)NCC[C@@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1	ZINC000450527484	GH	On-Demand	Anodyne	SIRT3	52	42
CC(=O)NCC[C@@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1	ZINC000450527484	GH	On-Demand	Anodyne	SIRT2	52	34
CC(=O)NCC[C@@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1	ZINC000450527484	GH	On-Demand	Anodyne	SIRT1	51	31
COc1ccc2c(c1)C[C@H](C(=O)N[C@](C)(CC(=O)O)c1cccc(F)c1)CO2	ZINC000450527505	GF	On-Demand	Anodyne	ROCK2	30	44
COc1ccc2c(c1)C[C@H](C(=O)N[C@](C)(CC(=O)O)c1cccc(F)c1)CO2	ZINC000450527505	GF	On-Demand	Anodyne	CDC42BPA	0	42
COc1ccc2c(c1)C[C@H](C(=O)N[C@@](C)(CC(=O)O)c1cccc(F)c1)CO2	ZINC000450527506	GF	On-Demand	Anodyne	ROCK2	30	44
COc1ccc2c(c1)C[C@H](C(=O)N[C@@](C)(CC(=O)O)c1cccc(F)c1)CO2	ZINC000450527506	GF	On-Demand	Anodyne	CDC42BPA	0	42
COc1ccc2c(c1)C[C@@H](C(=O)N[C@](C)(CC(=O)O)c1cccc(F)c1)CO2	ZINC000450527507	GF	On-Demand	Anodyne	ROCK2	30	44
COc1ccc2c(c1)C[C@@H](C(=O)N[C@](C)(CC(=O)O)c1cccc(F)c1)CO2	ZINC000450527507	GF	On-Demand	Anodyne	CDC42BPA	0	42
COc1ccc2c(c1)C[C@@H](C(=O)N[C@@](C)(CC(=O)O)c1cccc(F)c1)CO2	ZINC000450527508	GF	On-Demand	Anodyne	ROCK2	30	44
COc1ccc2c(c1)C[C@@H](C(=O)N[C@@](C)(CC(=O)O)c1cccc(F)c1)CO2	ZINC000450527508	GF	On-Demand	Anodyne	CDC42BPA	0	42
CSc1ccc2ncnc(NCCNS(=O)(=O)N(C)C)c2c1	ZINC000450527509	EC	On-Demand	Anodyne	CLK4	61	33
COc1cc(Cl)c(C(=O)N[C@H](C(=O)O)c2ccc(C)c(C)c2)cc1OC	ZINC000450527521	GH	On-Demand	Anodyne	FOLH1	40	40
COc1cc(Cl)c(C(=O)N[C@@H](C(=O)O)c2ccc(C)c(C)c2)cc1OC	ZINC000450527522	GH	On-Demand	Anodyne	FOLH1	40	40
CO[C@H](CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450527523	DD	On-Demand	Anodyne	MPO	21	41
CO[C@@H](CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450527524	DD	On-Demand	Anodyne	MPO	21	41
CC(C)(CC(=O)N[C@H](CC1CCCCC1)C(=O)O)C(F)(F)F	ZINC000450527530	DH	On-Demand	Anodyne	CTSS	20	42
CC(C)(CC(=O)N[C@@H](CC1CCCCC1)C(=O)O)C(F)(F)F	ZINC000450527531	DH	On-Demand	Anodyne	CTSS	20	42
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)c1	ZINC000450527532	FG	On-Demand	Anodyne	P2RY12	21	44
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)c1	ZINC000450527532	FG	On-Demand	Anodyne	GPR88	0	41
CC(C)(C#N)CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450527540	CD	On-Demand	Mild	CTSV	44	30
CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450527543	GF	On-Demand	Anodyne	MAPK13	45	33
C[C@@H](Nc1ncnc2cc(Br)ccc12)C1(S(C)(=O)=O)CC1	ZINC000450527550	FF	On-Demand	Anodyne	EGFR	50	36
C[C@H](Nc1ncnc2cc(Br)ccc12)C1(S(C)(=O)=O)CC1	ZINC000450527551	FF	On-Demand	Anodyne	EGFR	50	36
COc1ccc2c(c1)OC[C@H](NC(=O)CC[C@H]1CCC(=O)N1)C2	ZINC000450527554	DD	On-Demand	Anodyne	NQO2	36	40
COc1ccc2c(c1)OC[C@@H](NC(=O)CC[C@H]1CCC(=O)N1)C2	ZINC000450527555	DD	On-Demand	Anodyne	NQO2	36	40
COc1ccc2c(c1)OC[C@H](NC(=O)CC[C@@H]1CCC(=O)N1)C2	ZINC000450527556	DD	On-Demand	Anodyne	NQO2	36	40
COc1ccc2c(c1)OC[C@@H](NC(=O)CC[C@@H]1CCC(=O)N1)C2	ZINC000450527557	DD	On-Demand	Anodyne	NQO2	36	40
COc1cccc(-n2cc(C(=O)NCC(C)(C)C#N)nn2)c1	ZINC000450527567	CD	On-Demand	Mild	DRD4	45	35
CC(C)(C#N)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450527584	CH	On-Demand	Mild	CTSK	17	47
CC(C)(C#N)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450527584	CH	On-Demand	Mild	SCN9A	0	40
CN(CC1CCOCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450527594	EE	On-Demand	Bother	SLC27A4	49	32
O=C(NCCc1cccs1)C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450527601	GG	On-Demand	Anodyne	ADAM17	0	41
CN(CCc1ccccc1[N+](=O)[O-])c1nc2c(cc1C#N)COCC2	ZINC000450527607	EF	On-Demand	Mild	COLA	45	31
CNC(=O)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)CCO1	ZINC000450527624	ED	On-Demand	Anodyne	CACNA1B	41	35
CNC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)CCO1	ZINC000450527625	ED	On-Demand	Anodyne	CACNA1B	41	35
Cc1cc(C(=O)N[C@@H](CCO)c2ccccc2Br)nn1C(C)C	ZINC000450527632	GG	On-Demand	Anodyne	CTSA	73	37
Cc1cc(C(=O)N[C@H](CCO)c2ccccc2Br)nn1C(C)C	ZINC000450527633	GG	On-Demand	Anodyne	CTSA	73	37
O=C(c1cc2n(n1)CCCC2)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450527634	GG	On-Demand	Anodyne	RBP4	80	44
O=C(c1cc2n(n1)CCCC2)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450527634	GG	On-Demand	Anodyne	SFRP1	48	34
O=C(c1cc2n(n1)CCCC2)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450527635	GG	On-Demand	Anodyne	RBP4	80	44
O=C(c1cc2n(n1)CCCC2)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450527635	GG	On-Demand	Anodyne	SFRP1	48	34
CC(C)[C@H](NC(=O)CC[C@H]1CCC(=O)N1)c1ccc(Cl)cc1F	ZINC000450527638	EG	On-Demand	Anodyne	MC4R	26	41
CC(C)[C@H](NC(=O)CC[C@@H]1CCC(=O)N1)c1ccc(Cl)cc1F	ZINC000450527639	EG	On-Demand	Anodyne	MC4R	26	41
CC(C)[C@@H](NC(=O)CC[C@H]1CCC(=O)N1)c1ccc(Cl)cc1F	ZINC000450527640	EG	On-Demand	Anodyne	MC4R	26	41
CC(C)[C@@H](NC(=O)CC[C@@H]1CCC(=O)N1)c1ccc(Cl)cc1F	ZINC000450527641	EG	On-Demand	Anodyne	MC4R	26	41
CSc1cccc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c1	ZINC000450527649	GJ	On-Demand	Anodyne	RBP4	86	40
CSc1cccc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c1	ZINC000450527650	GJ	On-Demand	Anodyne	RBP4	86	40
Cc1ccn(CC(=O)NC2CCC(c3ccc(F)cc3)CC2)n1	ZINC000450527653	DG	On-Demand	Anodyne	MAPK13	43	33
CN(CCN1CCN(Cc2ccccc2)CC1)c1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450527654	GE	On-Demand	Mild	SIGMAR1	19	43
COc1ccc(C2CCN(C(=O)c3cnc(C(=O)O)cn3)CC2)cc1	ZINC000450527670	EE	On-Demand	Anodyne	FASN	41	33
COc1ccc(C2CCN(C(=O)c3cnc(C(=O)O)cn3)CC2)cc1	ZINC000450527670	EE	On-Demand	Anodyne	TRPC6	49	44
COc1ccc(C2CCN(C(=O)c3cnc(C(=O)O)cn3)CC2)cc1	ZINC000450527670	EE	On-Demand	Anodyne	TRPC3	23	44
C[C@H](O)C(C)(C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450527671	DD	On-Demand	Anodyne	PDE4D	15	42
C[C@H](O)C(C)(C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450527674	DD	On-Demand	Anodyne	PDE4D	15	42
C[C@@H](O)C(C)(C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450527675	DD	On-Demand	Anodyne	PDE4D	15	42
C[C@@H](O)C(C)(C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450527677	DD	On-Demand	Anodyne	PDE4D	15	42
C[C@H]1CSC[C@H]1Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450527681	DE	On-Demand	Bother	TBXA2R	20	40
C[C@@H]1CSC[C@@H]1Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450527684	DE	On-Demand	Bother	TBXA2R	20	40
C[C@H]1CSC[C@@H]1Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450527685	DE	On-Demand	Bother	TBXA2R	20	40
C[C@@H]1CSC[C@H]1Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450527686	DE	On-Demand	Bother	TBXA2R	20	40
COc1cccc2c1CCN(C(=O)Cc1cc(F)c(C)cc1F)C2	ZINC000450527699	EG	On-Demand	Anodyne	SSTR2	41	37
COc1cccc2c1CCN(C(=O)Cc1cc(F)c(C)cc1F)C2	ZINC000450527699	EG	On-Demand	Anodyne	AKR1C3	25	49
Cc1nc(C)n(CCCC(=O)NC2CCC(c3ccc(F)cc3)CC2)n1	ZINC000450527704	FH	On-Demand	Anodyne	TNKS	42	37
COc1ccc(-c2ccnc(NCC(C)(C)OCCO)n2)cc1	ZINC000450527730	DE	On-Demand	Anodyne	CLK4	25	55
COc1ccc(-c2ccnc(NCC(C)(C)OCCO)n2)cc1	ZINC000450527730	DE	On-Demand	Anodyne	SMG1	56	31
CC1=C(C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)CCC(C)(C)C1	ZINC000450527731	FG	On-Demand	Anodyne	E1	0	40
Cc1ccc2c(c1)[C@@H](Nc1ncc(C(F)F)cn1)CCC2	ZINC000450527732	CI	On-Demand	Anodyne	KCNN3	21	48
CCOC(=O)[C@H](CO)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450527744	CC	On-Demand	Anodyne	TLR2	0	40
CCOC(=O)[C@H](CO)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450527744	CC	On-Demand	Anodyne	NOD1	89	42
CN1CCC[C@@H](C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)C1=O	ZINC000450527745	FC	On-Demand	Anodyne	TMPRSS11D	47	32
CN1CCC[C@H](C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)C1=O	ZINC000450527746	FC	On-Demand	Anodyne	TMPRSS11D	47	32
CCOC(=O)[C@@H](CO)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450527749	CC	On-Demand	Anodyne	TLR2	0	40
CCOC(=O)[C@@H](CO)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450527749	CC	On-Demand	Anodyne	NOD1	89	42
C[C@H]1COc2ccccc2CN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450527760	EG	On-Demand	Anodyne	AGTR2	50	36
C[C@@H](OCCc1ccccc1)C(=O)N1Cc2ccccc2OC[C@H]1C	ZINC000450527761	EG	On-Demand	Anodyne	AGTR2	50	36
C[C@H](OCCc1ccccc1)C(=O)N1Cc2ccccc2OC[C@@H]1C	ZINC000450527762	EG	On-Demand	Anodyne	AGTR2	50	36
C[C@H](OCCc1ccccc1)C(=O)N1Cc2ccccc2OC[C@H]1C	ZINC000450527764	EG	On-Demand	Anodyne	AGTR2	50	36
CO[C@H](Cc1ccccc1)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450527772	DE	On-Demand	Anodyne	ACE	55	39
CO[C@H](Cc1ccccc1)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450527772	DE	On-Demand	Anodyne	MME	25	42
CO[C@H](Cc1ccccc1)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450527772	DE	On-Demand	Anodyne	TPP2	52	35
CO[C@@H](Cc1ccccc1)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450527773	DE	On-Demand	Anodyne	ACE	55	39
CO[C@@H](Cc1ccccc1)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450527773	DE	On-Demand	Anodyne	MME	25	42
CO[C@@H](Cc1ccccc1)CN1c2ccccc2C[C@H]1C(N)=O	ZINC000450527773	DE	On-Demand	Anodyne	TPP2	52	35
O=C(CCCC(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)C1CC1	ZINC000450527774	FG	On-Demand	Anodyne	PREP	41	35
O=C(CCCC(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)C1CC1	ZINC000450527775	FG	On-Demand	Anodyne	PREP	41	35
COc1ccc(CC(=O)N2Cc3ccccc3OC[C@H]2C)c(Cl)c1OC	ZINC000450527786	GH	On-Demand	Anodyne	AGTR2	46	40
COc1ccc(CC(=O)N2Cc3ccccc3OC[C@@H]2C)c(Cl)c1OC	ZINC000450527787	GH	On-Demand	Anodyne	AGTR2	46	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527792	DD	On-Demand	Anodyne	MME	76	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527792	DD	On-Demand	Anodyne	TIMP3	65	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527792	DD	On-Demand	Anodyne	SOAT1	23	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527792	DD	On-Demand	Anodyne	F11	44	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527792	DD	On-Demand	Anodyne	CAPN1	41	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527792	DD	On-Demand	Anodyne	ACE2	47	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527792	DD	On-Demand	Anodyne	PGA5	46	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527792	DD	On-Demand	Anodyne	PSMB8	50	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527793	DD	On-Demand	Anodyne	MME	76	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527793	DD	On-Demand	Anodyne	TIMP3	65	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527793	DD	On-Demand	Anodyne	SOAT1	23	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527793	DD	On-Demand	Anodyne	F11	44	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527793	DD	On-Demand	Anodyne	CAPN1	41	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527793	DD	On-Demand	Anodyne	ACE2	47	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527793	DD	On-Demand	Anodyne	PGA5	46	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527793	DD	On-Demand	Anodyne	PSMB8	50	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527794	DD	On-Demand	Anodyne	MME	76	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527794	DD	On-Demand	Anodyne	TIMP3	65	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527794	DD	On-Demand	Anodyne	SOAT1	23	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527794	DD	On-Demand	Anodyne	F11	44	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527794	DD	On-Demand	Anodyne	CAPN1	41	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527794	DD	On-Demand	Anodyne	ACE2	47	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527794	DD	On-Demand	Anodyne	PGA5	46	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)C1CCOCC1	ZINC000450527794	DD	On-Demand	Anodyne	PSMB8	50	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527795	DD	On-Demand	Anodyne	MME	76	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527795	DD	On-Demand	Anodyne	TIMP3	65	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527795	DD	On-Demand	Anodyne	SOAT1	23	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527795	DD	On-Demand	Anodyne	F11	44	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527795	DD	On-Demand	Anodyne	CAPN1	41	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527795	DD	On-Demand	Anodyne	ACE2	47	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527795	DD	On-Demand	Anodyne	PGA5	46	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)C1CCOCC1	ZINC000450527795	DD	On-Demand	Anodyne	PSMB8	50	35
O=C(N[C@H](CO)C1CCOCC1)c1cc2ccncc2s1	ZINC000450527801	DD	On-Demand	Anodyne	NAMPT	19	49
O=C(N[C@@H](CO)C1CCOCC1)c1cc2ccncc2s1	ZINC000450527802	DD	On-Demand	Anodyne	NAMPT	19	49
O=C(O)c1ccccc1CCC(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450527803	FF	On-Demand	Anodyne	AVPR1A	17	46
O=C(O)c1ccccc1CCC(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450527804	FF	On-Demand	Anodyne	AVPR1A	17	46
O=C(O)c1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)s1	ZINC000450527812	EF	On-Demand	Anodyne	AVPR1A	22	52
O=C(O)c1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)s1	ZINC000450527813	EF	On-Demand	Anodyne	AVPR1A	22	52
CCN(CC)CCCC1CCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450527830	FI	On-Demand	Anodyne	SFRP1	23	40
CCC[C@@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527833	FG	On-Demand	Anodyne	CAPN2	41	34
CCC[C@@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527833	FG	On-Demand	Anodyne	NPR	46	35
CCC[C@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527834	FG	On-Demand	Anodyne	CAPN2	41	34
CCC[C@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527834	FG	On-Demand	Anodyne	NPR	46	35
CN(C)c1nc(NC[C@@H]2CCCCN2S(=O)(=O)N(C)C)nc2ccccc12	ZINC000450527836	GD	On-Demand	Anodyne	ADRA2A	19	58
CN(C)c1nc(NC[C@@H]2CCCCN2S(=O)(=O)N(C)C)nc2ccccc12	ZINC000450527836	GD	On-Demand	Anodyne	NPY2R	15	58
CN(C)c1nc(NC[C@H]2CCCCN2S(=O)(=O)N(C)C)nc2ccccc12	ZINC000450527837	GD	On-Demand	Anodyne	ADRA2A	19	58
CN(C)c1nc(NC[C@H]2CCCCN2S(=O)(=O)N(C)C)nc2ccccc12	ZINC000450527837	GD	On-Demand	Anodyne	NPY2R	15	58
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	HTR1A	38	42
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	DRD2	48	42
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	DRD4	69	42
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	ADRA1D	26	46
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	DRD3	45	42
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	HTR4	40	43
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	SSTR5	58	38
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	CCR3	15	42
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	UTS2R	22	41
COc1cc(CN2CCN(c3ncccc3C(N)=O)CC2)ccc1Cl	ZINC000450527862	FE	On-Demand	Anodyne	ABCB1	21	41
Cc1cc(N[C@H]2CCCN(CC(F)(F)F)C2)nc(-c2cccnc2)n1	ZINC000450527865	FF	On-Demand	Anodyne	PRKD1	55	36
Cc1cc(N[C@H]2CCCN(CC(F)(F)F)C2)nc(-c2cccnc2)n1	ZINC000450527865	FF	On-Demand	Anodyne	ROS1	56	33
Cc1cc(N[C@@H]2CCCN(CC(F)(F)F)C2)nc(-c2cccnc2)n1	ZINC000450527866	FF	On-Demand	Anodyne	PRKD1	55	36
Cc1cc(N[C@@H]2CCCN(CC(F)(F)F)C2)nc(-c2cccnc2)n1	ZINC000450527866	FF	On-Demand	Anodyne	ROS1	56	33
C[C@H]1COc2ccccc2CN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450527869	FF	On-Demand	Anodyne	THYX_PBCV1	0	40
C[C@@H]1COc2ccccc2CN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450527870	FF	On-Demand	Anodyne	THYX_PBCV1	0	40
CC(=O)c1nc(N(C)CCc2ccccc2[N+](=O)[O-])sc1C	ZINC000450527883	DG	On-Demand	Bother	COLA	96	39
O=C1CCCc2nc(N3CCN([C@H]4CCN(Cc5ccccc5)C4)CC3)ccc21	ZINC000450527885	GF	On-Demand	Anodyne	SLC18A3	15	40
Cc1ccc(C(=O)NC2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)s1	ZINC000450527887	GG	On-Demand	Anodyne	SSTR5	43	36
Cc1ccc(C(=O)NC2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)s1	ZINC000450527887	GG	On-Demand	Anodyne	HPGDS	37	41
N#Cc1cnc(N2CCC(c3c[nH]c4ccc(F)cc34)CC2)c([N+](=O)[O-])c1	ZINC000450527892	FH	On-Demand	Mild	SLC6A4	23	43
O=C1CCCc2nc(N3CCN([C@@H]4CCN(Cc5ccccc5)C4)CC3)ccc21	ZINC000450527893	GF	On-Demand	Anodyne	SLC18A3	15	40
CCOC(=O)[C@@H](CO)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450527901	EC	On-Demand	Anodyne	F7	30	44
CCOC(=O)[C@@H](CO)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450527901	EC	On-Demand	Anodyne	PSBA	0	43
CCOC(=O)[C@H](CO)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450527907	EC	On-Demand	Anodyne	F7	30	44
CCOC(=O)[C@H](CO)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450527907	EC	On-Demand	Anodyne	PSBA	0	43
CC(C)CC(CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527911	FG	On-Demand	Anodyne	MME	15	42
CC(C)CC(CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527911	FG	On-Demand	Anodyne	ANPEP	42	43
CC(C)CC(CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527911	FG	On-Demand	Anodyne	NPR	57	33
CC(C)CC(CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527911	FG	On-Demand	Anodyne	AMP1_PLAFQ	33	42
CC(C)CC(CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450527911	FG	On-Demand	Anodyne	CARM1	46	32
COc1cccc2c1CCN(C(=O)c1ccc(C(C)(F)F)nc1)C2	ZINC000450527912	EG	On-Demand	Anodyne	SSTR2	40	36
COc1cccc2c1CCN(C(=O)c1ccc(C(C)(F)F)nc1)C2	ZINC000450527912	EG	On-Demand	Anodyne	SSTR1	45	33
CC(=O)NCC[C@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450527913	EH	On-Demand	Anodyne	HRP1_PLAFA	49	33
CC(=O)NCC[C@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450527913	EH	On-Demand	Anodyne	SIRT3	39	40
CC(=O)NCC[C@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450527913	EH	On-Demand	Anodyne	SIRT2	43	30
CC(=O)NCC[C@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450527913	EH	On-Demand	Anodyne	SIRT1	41	40
O=C(NC1CCN(CC/C=C\c2ccccc2)CC1)C1CCCCC1	ZINC000450527920	EI	On-Demand	Anodyne	CHRM1	18	48
O=C(NC1CCN(CC/C=C\c2ccccc2)CC1)C1CCCCC1	ZINC000450527920	EI	On-Demand	Anodyne	SLC6A1	109	39
O=C(NC1CCN(CC/C=C\c2ccccc2)CC1)C1CCCCC1	ZINC000450527920	EI	On-Demand	Anodyne	DRD3	16	53
O=C(NC1CCN(CC/C=C\c2ccccc2)CC1)C1CCCCC1	ZINC000450527920	EI	On-Demand	Anodyne	CHRM3	24	40
O=C(NC1CCN(CC/C=C\c2ccccc2)CC1)C1CCCCC1	ZINC000450527920	EI	On-Demand	Anodyne	SIGMAR1	31	56
O=C(NC1CCN(CC/C=C\c2ccccc2)CC1)C1CCCCC1	ZINC000450527920	EI	On-Demand	Anodyne	CCR5	15	43
O=C(NC1CCN(CC/C=C\c2ccccc2)CC1)C1CCCCC1	ZINC000450527920	EI	On-Demand	Anodyne	SLC6A5	42	35
O=C(NC1CCN(CC/C=C\c2ccccc2)CC1)C1CCCCC1	ZINC000450527920	EI	On-Demand	Anodyne	EPHX2	38	48
O=C(NC1CCN(CC/C=C/c2ccccc2)CC1)C1CCCCC1	ZINC000450527921	EI	On-Demand	Anodyne	CHRM1	18	48
O=C(NC1CCN(CC/C=C/c2ccccc2)CC1)C1CCCCC1	ZINC000450527921	EI	On-Demand	Anodyne	SLC6A1	109	39
O=C(NC1CCN(CC/C=C/c2ccccc2)CC1)C1CCCCC1	ZINC000450527921	EI	On-Demand	Anodyne	DRD3	16	53
O=C(NC1CCN(CC/C=C/c2ccccc2)CC1)C1CCCCC1	ZINC000450527921	EI	On-Demand	Anodyne	CHRM3	24	40
O=C(NC1CCN(CC/C=C/c2ccccc2)CC1)C1CCCCC1	ZINC000450527921	EI	On-Demand	Anodyne	SIGMAR1	31	56
O=C(NC1CCN(CC/C=C/c2ccccc2)CC1)C1CCCCC1	ZINC000450527921	EI	On-Demand	Anodyne	CCR5	15	43
O=C(NC1CCN(CC/C=C/c2ccccc2)CC1)C1CCCCC1	ZINC000450527921	EI	On-Demand	Anodyne	SLC6A5	42	35
O=C(NC1CCN(CC/C=C/c2ccccc2)CC1)C1CCCCC1	ZINC000450527921	EI	On-Demand	Anodyne	EPHX2	38	48
CCC(CC)(NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450527926	DG	On-Demand	Anodyne	MPO	18	41
CC(=O)c1nc(NC[C@H]2CCN(S(=O)(=O)c3cccs3)C2)sc1C	ZINC000450527927	GE	On-Demand	Anodyne	FAAH	17	47
CC(=O)c1nc(NC[C@@H]2CCN(S(=O)(=O)c3cccs3)C2)sc1C	ZINC000450527928	GE	On-Demand	Anodyne	FAAH	17	47
O=C(NCCc1cccs1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450527933	FH	On-Demand	Anodyne	ADAM17	0	41
O=C(NCCc1cccs1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450527934	FH	On-Demand	Anodyne	ADAM17	0	41
CCOC(=O)[C@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450527941	FD	On-Demand	Anodyne	PLM2_PLAFA	0	41
CCOC(=O)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450527942	FD	On-Demand	Anodyne	PLM2_PLAFA	0	41
COCC[C@@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450527948	EE	On-Demand	Anodyne	NPPA	51	39
COCC[C@H](NC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450527949	EE	On-Demand	Anodyne	NPPA	51	39
CN(C)c1nc(N2CCC[C@H](CNC(=O)CC(F)(F)F)C2)nc2ccccc12	ZINC000450527977	GF	On-Demand	Anodyne	ADRA2A	16	41
CN(C)c1nc(N2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)nc2ccccc12	ZINC000450527978	GF	On-Demand	Anodyne	ADRA2A	16	41
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	DRD2	22	41
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	DRD4	36	45
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	ACHE	16	43
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	HRH2	25	43
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	HRH1	15	42
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	DRD3	0	45
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	OPRK1	32	42
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	HTR4	59	41
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	HRH3	22	45
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	SIGMAR1	35	67
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	SSTR5	76	43
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	CCR3	50	42
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	UTS2R	20	41
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	EPHX2	45	53
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	PDK1	47	37
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	CXCR3	31	41
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	MCHR1	56	50
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	CACNA1G	40	43
COC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1Cl	ZINC000450527985	GH	On-Demand	Anodyne	CCR8	16	40
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cccc(N(C)C)n2)c1	ZINC000450527986	FG	On-Demand	Anodyne	KCNK3	39	46
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cccc(N(C)C)n2)c1	ZINC000450527986	FG	On-Demand	Anodyne	KCNK9	41	46
COc1ccc(-c2noc(N(C)[C@@H]3CCCOC3)n2)cc1	ZINC000450527987	CE	On-Demand	Anodyne	LUCI_PHOPE	22	40
COc1ccc(-c2noc(N(C)[C@H]3CCCOC3)n2)cc1	ZINC000450527988	CE	On-Demand	Anodyne	LUCI_PHOPE	22	40
CCOC(=O)[C@@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450527989	DC	On-Demand	Anodyne	AVPR1A	0	40
CCOC(=O)[C@@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450527989	DC	On-Demand	Anodyne	TRPV1	41	41
CCOC(=O)[C@@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450527989	DC	On-Demand	Anodyne	NCE103	28	41
CCOC(=O)[C@@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450527989	DC	On-Demand	Anodyne	CAN2	0	41
CCOC(=O)[C@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450527990	DC	On-Demand	Anodyne	AVPR1A	0	40
CCOC(=O)[C@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450527990	DC	On-Demand	Anodyne	TRPV1	41	41
CCOC(=O)[C@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450527990	DC	On-Demand	Anodyne	NCE103	28	41
CCOC(=O)[C@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450527990	DC	On-Demand	Anodyne	CAN2	0	41
O=C(c1ccsn1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450527995	EG	On-Demand	Anodyne	RBP4	26	45
CC(=O)NCC[C@@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450527996	EH	On-Demand	Anodyne	HRP1_PLAFA	49	33
CC(=O)NCC[C@@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450527996	EH	On-Demand	Anodyne	SIRT3	39	40
CC(=O)NCC[C@@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450527996	EH	On-Demand	Anodyne	SIRT2	43	30
CC(=O)NCC[C@@H]1CCCN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450527996	EH	On-Demand	Anodyne	SIRT1	41	40
NC(=O)[C@@H]1Cc2ccccc2N1CCCC(=O)c1ccc(F)cc1	ZINC000450527999	EF	On-Demand	Anodyne	DRD4	0	46
NC(=O)[C@@H]1Cc2ccccc2N1CCCC(=O)c1ccc(F)cc1	ZINC000450527999	EF	On-Demand	Anodyne	SLC18A3	0	47
NC(=O)[C@@H]1Cc2ccccc2N1CCCC(=O)c1ccc(F)cc1	ZINC000450527999	EF	On-Demand	Anodyne	HTR3B	0	48
NC(=O)[C@@H]1Cc2ccccc2N1CCCC(=O)c1ccc(F)cc1	ZINC000450527999	EF	On-Demand	Anodyne	CYP2J2	49	35
CC(=O)NCC[C@@H]1CCCN(c2nc3ccccc3c(C)c2C#N)C1	ZINC000450528006	EG	On-Demand	Mild	FAP	0	40
CC(=O)NCC[C@H]1CCCN(c2nc3ccccc3c(C)c2C#N)C1	ZINC000450528007	EG	On-Demand	Mild	FAP	0	40
Fc1cc2nccc(NCC3=CCCOC3)c2cc1Cl	ZINC000450528023	CH	On-Demand	Anodyne	HRP1_PLAFA	78	33
Fc1cc2nccc(NCC3=CCCOC3)c2cc1Cl	ZINC000450528023	CH	On-Demand	Anodyne	HNMT	50	36
COc1cccc2c1CCN(C(=O)Cc1cc(C)ccc1F)C2	ZINC000450528024	DG	On-Demand	Anodyne	HDAC6	30	40
COc1cccc2c1CCN(C(=O)Cc1cc(C)ccc1F)C2	ZINC000450528024	DG	On-Demand	Anodyne	AKR1C3	19	46
Cc1ccn2ncc(C(=O)N[C@@H](CO)C3CCOCC3)c2c1	ZINC000450528027	DD	On-Demand	Anodyne	EPHB3	34	47
Cc1ccn2ncc(C(=O)N[C@H](CO)C3CCOCC3)c2c1	ZINC000450528028	DD	On-Demand	Anodyne	EPHB3	34	47
COc1cc(CC(=O)N2CCc3c(cccc3OC)C2)ccc1Cl	ZINC000450528036	EG	On-Demand	Anodyne	OPRK1	37	44
COc1cc(CC(=O)N2CCc3c(cccc3OC)C2)ccc1Cl	ZINC000450528036	EG	On-Demand	Anodyne	ABCB1	0	50
COc1cc(CC(=O)N2CCc3c(cccc3OC)C2)ccc1Cl	ZINC000450528036	EG	On-Demand	Anodyne	HCRTR2	24	41
COc1ccc(-c2noc(NC[C@@H]3CCCCN3S(=O)(=O)N(C)C)n2)cc1	ZINC000450528043	GD	On-Demand	Anodyne	COLA	15	40
COc1ccc(-c2noc(NC[C@H]3CCCCN3S(=O)(=O)N(C)C)n2)cc1	ZINC000450528044	GD	On-Demand	Anodyne	COLA	15	40
COc1ccc(C2CCN(C(=O)Cc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528046	FG	On-Demand	Anodyne	CHRM2	25	41
COc1ccc(C2CCN(C(=O)Cc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528046	FG	On-Demand	Anodyne	EDNRA	17	42
COc1ccc(C2CCN(C(=O)Cc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528046	FG	On-Demand	Anodyne	KCNA5	15	45
COc1ccc(C2CCN(C(=O)Cc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528046	FG	On-Demand	Anodyne	CCR1	40	42
COc1ccc(C2CCN(C(=O)Cc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528046	FG	On-Demand	Anodyne	CCR3	15	46
COc1ccc(C2CCN(C(=O)Cc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528046	FG	On-Demand	Anodyne	ETHR	64	40
COc1ccc(C2CCN(C(=O)Cc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528046	FG	On-Demand	Anodyne	GPR183	0	50
CN(C(=O)c1cccc(OCC(=O)O)c1)[C@@H]1CC1(C)C	ZINC000450528049	CE	On-Demand	Anodyne	FABP4	45	34
CN(C(=O)c1cccc(OCC(=O)O)c1)[C@H]1CC1(C)C	ZINC000450528050	CE	On-Demand	Anodyne	FABP4	45	34
O=C(N[C@@H](CO)C1CCOCC1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450528051	GF	On-Demand	Anodyne	PYGL	54	41
O=C(N[C@H](CO)C1CCOCC1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450528052	GF	On-Demand	Anodyne	PYGL	54	41
COc1ccc(C2CCN(C(=O)c3ccccc3S[C@@H](C)C(=O)O)CC2)cc1	ZINC000450528073	GI	On-Demand	Anodyne	CHRM2	34	40
COc1ccc(C2CCN(C(=O)c3ccccc3S[C@@H](C)C(=O)O)CC2)cc1	ZINC000450528073	GI	On-Demand	Anodyne	CCR1	43	41
COc1ccc(C2CCN(C(=O)c3ccccc3S[C@H](C)C(=O)O)CC2)cc1	ZINC000450528074	GI	On-Demand	Anodyne	CHRM2	34	40
COc1ccc(C2CCN(C(=O)c3ccccc3S[C@H](C)C(=O)O)CC2)cc1	ZINC000450528074	GI	On-Demand	Anodyne	CCR1	43	41
O=C(c1ccsn1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450528112	EG	On-Demand	Anodyne	RBP4	26	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	ACE	19	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	OPRM1	15	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	OPRD1	0	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	MME	26	43
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	EDNRB	51	35
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	TACR1	33	43
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	MC4R	39	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	BMP1	27	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	TACR2	30	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	CCKAR	101	47
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	BRS3	27	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	TIMP3	41	35
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	NMBR	42	38
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	MC3R	56	35
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	MC5R	58	33
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	MMP14	89	37
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	GRPR	47	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	ECE1	59	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	MMP11	93	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	CCKBR	80	47
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	GHSR	73	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	MC1R	81	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	SLC15A2	0	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	KISS1R	61	32
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	PSMB8	24	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528113	GG	On-Demand	Anodyne	LASB	0	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	ACE	19	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	OPRM1	15	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	OPRD1	0	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	MME	26	43
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	EDNRB	51	35
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	TACR1	33	43
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	MC4R	39	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	BMP1	27	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	TACR2	30	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	CCKAR	101	47
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	BRS3	27	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	TIMP3	41	35
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	NMBR	42	38
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	MC3R	56	35
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	MC5R	58	33
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	MMP14	89	37
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	GRPR	47	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	ECE1	59	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	MMP11	93	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	CCKBR	80	47
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	GHSR	73	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	MC1R	81	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	SLC15A2	0	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	KISS1R	61	32
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	PSMB8	24	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450528114	GG	On-Demand	Anodyne	LASB	0	40
CCN(Cc1cn(C)nn1)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450528119	ED	On-Demand	Anodyne	DRD4	41	31
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	DRD4	26	43
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	HRH3	21	44
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	SIGMAR1	30	64
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	SSTR5	62	42
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	CCR3	23	41
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	BDKRB1	40	41
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	EPHX2	45	50
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	MCHR1	44	41
CCS(=O)(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450528120	GG	On-Demand	Anodyne	CACNA1G	31	41
CCOC(=O)[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528121	DC	On-Demand	Anodyne	P2RY12	183	37
CCOC(=O)[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528121	DC	On-Demand	Anodyne	KLK3	51	33
CCOC(=O)[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528121	DC	On-Demand	Anodyne	ADORA3	0	40
CCOC(=O)[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528121	DC	On-Demand	Anodyne	CTSV	51	35
CCOC(=O)[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528121	DC	On-Demand	Anodyne	AGER	0	42
CCOC(=O)[C@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528122	DC	On-Demand	Anodyne	P2RY12	183	37
CCOC(=O)[C@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528122	DC	On-Demand	Anodyne	KLK3	51	33
CCOC(=O)[C@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528122	DC	On-Demand	Anodyne	ADORA3	0	40
CCOC(=O)[C@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528122	DC	On-Demand	Anodyne	CTSV	51	35
CCOC(=O)[C@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450528122	DC	On-Demand	Anodyne	AGER	0	42
CCN(C[C@H](C)O)c1nc(C)cc(OCc2ccccc2)n1	ZINC000450528123	DF	On-Demand	Anodyne	CRHR1	0	41
COC(=O)c1csc(CN2CCC(C(=O)NCCc3cccs3)CC2)n1	ZINC000450528130	GF	On-Demand	Anodyne	ADAM17	0	40
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	NR3C1	0	46
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	ACE	16	45
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MME	22	42
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	EDNRB	46	35
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	EDNRA	42	40
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	TACR1	23	44
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	TACR2	0	43
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	CCKAR	74	45
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	CTSL	30	42
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	BRS3	24	45
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	NMBR	30	43
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MC3R	47	34
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MC5R	52	31
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MMP2	24	43
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MMP8	35	43
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MMP14	21	42
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	GRPR	63	35
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	ECE1	54	42
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MMP11	64	33
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	CCKBR	63	45
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	GHSR	67	43
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MMP9	22	47
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MC1R	57	36
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	ADAM9	42	43
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MMP7	0	40
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	MMP1	20	43
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	NPR	31	42
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	SLC15A2	0	50
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	KISS1R	57	34
CNS(=O)(=O)NCC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528131	EB	On-Demand	Anodyne	LASB	0	44
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	NR3C1	0	46
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	ACE	16	45
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MME	22	42
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	EDNRB	46	35
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	EDNRA	42	40
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	TACR1	23	44
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	TACR2	0	43
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	CCKAR	74	45
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	CTSL	30	42
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	BRS3	24	45
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	NMBR	30	43
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MC3R	47	34
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MC5R	52	31
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MMP2	24	43
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MMP8	35	43
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MMP14	21	42
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	GRPR	63	35
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	ECE1	54	42
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MMP11	64	33
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	CCKBR	63	45
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	GHSR	67	43
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MMP9	22	47
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MC1R	57	36
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	ADAM9	42	43
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MMP7	0	40
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	MMP1	20	43
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	NPR	31	42
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	SLC15A2	0	50
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	KISS1R	57	34
CNS(=O)(=O)NCC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450528132	EB	On-Demand	Anodyne	LASB	0	44
C[C@@H]1CSC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450528136	DH	On-Demand	Anodyne	EGFR	45	38
C[C@@H]1CSC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450528136	DH	On-Demand	Anodyne	CD38	48	41
C[C@@H]1CSC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450528137	DH	On-Demand	Anodyne	EGFR	45	38
C[C@@H]1CSC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450528137	DH	On-Demand	Anodyne	CD38	48	41
C[C@H]1CSC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450528138	DH	On-Demand	Anodyne	EGFR	45	38
C[C@H]1CSC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450528138	DH	On-Demand	Anodyne	CD38	48	41
C[C@H]1CSC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450528139	DH	On-Demand	Anodyne	EGFR	45	38
C[C@H]1CSC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450528139	DH	On-Demand	Anodyne	CD38	48	41
CCC(=O)CCCN(C1CC1)[C@@H](C)c1ccccc1	ZINC000450528144	CH	On-Demand	Anodyne	AMY2	47	35
CCC(=O)CCCN(C1CC1)[C@H](C)c1ccccc1	ZINC000450528145	CH	On-Demand	Anodyne	AMY2	47	35
CCOC(=O)[C@@H](CO)NC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450528146	ED	On-Demand	Anodyne	P2RY12	58	31
CCOC(=O)[C@H](CO)NC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450528147	ED	On-Demand	Anodyne	P2RY12	58	31
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	DRD2	23	43
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	DRD4	46	43
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	ACHE	29	42
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	HRH1	21	46
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	DRD3	24	43
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	HTR4	47	45
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	SIGMAR1	26	45
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	SSTR5	72	41
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	CCR3	25	41
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	ADAM17	22	46
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	MCHR1	36	43
COc1cc(CN2CCC(C(=O)NCCc3cccs3)CC2)ccc1Cl	ZINC000450528150	GH	On-Demand	Anodyne	CACNA1G	40	47
Cc1cc(-c2nc(C(=O)NC(C)(C)[C@H](C)O)co2)ccn1	ZINC000450528170	CD	On-Demand	Anodyne	IRAK4	22	44
Cc1cc(-c2nc(C(=O)NC(C)(C)[C@@H](C)O)co2)ccn1	ZINC000450528171	CD	On-Demand	Anodyne	IRAK4	22	44
COc1ccc(-c2noc(N3CCC[C@H](CNC(=O)CC(F)(F)F)C3)n2)cc1	ZINC000450528181	GG	On-Demand	Anodyne	COLA	0	40
COc1ccc(-c2noc(N3CCC[C@@H](CNC(=O)CC(F)(F)F)C3)n2)cc1	ZINC000450528190	GG	On-Demand	Anodyne	COLA	0	40
O=C(NC1CCCCC1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450528207	EH	On-Demand	Anodyne	EPHX2	32	48
O=C(NC1CCCCC1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450528213	EH	On-Demand	Anodyne	EPHX2	32	48
COc1cc(Cl)c(C(=O)Nc2cnn(C(C)(C)C(=O)O)c2)cc1OC	ZINC000450528223	FF	On-Demand	Anodyne	CPT1A	45	32
COc1cc(Cl)c(C(=O)Nc2cnn(C(C)(C)C(=O)O)c2)cc1OC	ZINC000450528223	FF	On-Demand	Anodyne	CPT2	40	34
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450528228	GE	On-Demand	Anodyne	EPHX2	0	47
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450528228	GE	On-Demand	Anodyne	NAMPT	69	43
NC(=O)[C@@H]1Cc2ccccc2N1CCCC(=O)c1ccccc1	ZINC000450528235	DF	On-Demand	Anodyne	ACE	22	42
NC(=O)[C@@H]1Cc2ccccc2N1CCCC(=O)c1ccccc1	ZINC000450528235	DF	On-Demand	Anodyne	TPP2	45	37
NC(=O)[C@@H]1Cc2ccccc2N1CCCC(=O)c1ccccc1	ZINC000450528235	DF	On-Demand	Anodyne	CYP2J2	53	37
Cc1cc(OCc2ccccc2)nc(N(C)[C@@H]2CCC[C@H]2O)n1	ZINC000450528240	DF	On-Demand	Anodyne	TRPM8	0	43
CC(C)C[C@H](NC(=O)CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450528248	FE	On-Demand	Anodyne	FOLH1	46	35
CC(C)C[C@H](NC(=O)CNC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450528248	FE	On-Demand	Anodyne	MMP3	15	40
CCN(CC)CCCC1CCN(C(=O)c2cc3cccnc3s2)CC1	ZINC000450528249	FI	On-Demand	Anodyne	SIRT3	41	31
CC(=O)N[C@H](C(=O)NC1CCC(c2ccc(F)cc2)CC1)C(C)(C)C	ZINC000450528252	EH	On-Demand	Anodyne	BIRC2	29	42
COc1ccc(C2CCN(C(=O)[C@@H]3C[C@@H]3C(=O)O)CC2)cc1	ZINC000450528254	DE	On-Demand	Anodyne	NPBWR1	59	34
COc1ccc(C2CCN(C(=O)[C@H]3C[C@@H]3C(=O)O)CC2)cc1	ZINC000450528257	DE	On-Demand	Anodyne	NPBWR1	59	34
COc1ccc(C2CCN(C(=O)[C@@H]3C[C@H]3C(=O)O)CC2)cc1	ZINC000450528258	DE	On-Demand	Anodyne	NPBWR1	59	34
COc1ccc(C2CCN(C(=O)[C@H]3C[C@H]3C(=O)O)CC2)cc1	ZINC000450528259	DE	On-Demand	Anodyne	NPBWR1	59	34
CCN1CC[C@@H](NC(=O)c2ccc3cnccc3c2)[C@@H]1c1cc(F)c(F)c(F)c1	ZINC000450528271	GI	On-Demand	Anodyne	AKT1	0	41
COc1cccc(OCCC(=O)N[C@H](CO)CC2CCCC2)c1	ZINC000450528272	DF	On-Demand	Anodyne	MTNR1A	34	44
CCN1CC[C@H](NC(=O)c2ccc3cnccc3c2)[C@@H]1c1cc(F)c(F)c(F)c1	ZINC000450528273	GI	On-Demand	Anodyne	AKT1	0	41
COc1cccc(OCCC(=O)N[C@@H](CO)CC2CCCC2)c1	ZINC000450528274	DF	On-Demand	Anodyne	MTNR1A	34	44
CCN1CC[C@H](NC(=O)c2ccc3cnccc3c2)[C@H]1c1cc(F)c(F)c(F)c1	ZINC000450528275	GI	On-Demand	Anodyne	AKT1	0	41
CCN1CC[C@@H](NC(=O)c2ccc3cnccc3c2)[C@H]1c1cc(F)c(F)c(F)c1	ZINC000450528276	GI	On-Demand	Anodyne	AKT1	0	41
Cc1sccc1C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1	ZINC000450528305	EJ	On-Demand	Anodyne	KCNK3	48	37
Cc1sccc1C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1	ZINC000450528305	EJ	On-Demand	Anodyne	KCNK9	49	37
CCOC(=O)c1ccc(N2CCCN(CCN(C)Cc3ccccc3)CC2)nc1	ZINC000450528306	GF	On-Demand	Anodyne	SIGMAR1	18	40
CCOC(=O)c1ccc(N2CCCN(CCN(C)Cc3ccccc3)CC2)nc1	ZINC000450528306	GF	On-Demand	Anodyne	SMO	0	43
CN(C)c1nc(NCc2ccncc2OC[C@H]2CCOC2)nc2ccccc12	ZINC000450528308	GF	On-Demand	Anodyne	ADRA2A	15	46
CN(C)c1nc(NCc2ccncc2OC[C@@H]2CCOC2)nc2ccccc12	ZINC000450528309	GF	On-Demand	Anodyne	ADRA2A	15	46
O=C(O)c1ccc(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450528310	EF	On-Demand	Anodyne	SLC18A3	26	41
O=C(O)c1ccc(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450528311	EF	On-Demand	Anodyne	SLC18A3	26	41
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	HTR1A	42	40
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	DRD2	41	46
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	DRD4	33	42
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	ADRA1D	16	42
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	ADRA1A	18	45
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	DRD3	40	37
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	HTR7	23	40
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	ABCC1	41	41
NC(=O)c1cccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450528313	GF	On-Demand	Anodyne	ABCB1A	17	41
CCN(CC)CCCC1CCN(C(=O)c2cc3n(n2)CCC3)CC1	ZINC000450528332	EF	On-Demand	Anodyne	L3MBTL3	41	32
CCN(CC)CCCC1CCN(C(=O)CSC2CC2)CC1	ZINC000450528333	DG	On-Demand	Anodyne	GNAI3	0	40
C[C@@H]1COc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450528336	DF	On-Demand	Anodyne	PREP	21	42
C[C@H]1COc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450528337	DF	On-Demand	Anodyne	PREP	21	42
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@H](C(=O)O)O3)CC2)cc1	ZINC000450528340	EE	On-Demand	Anodyne	NPBWR1	43	30
O=C(O)c1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c(F)c1	ZINC000450528351	EF	On-Demand	Anodyne	AVPR1A	24	50
O=C(O)c1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c(F)c1	ZINC000450528352	EF	On-Demand	Anodyne	AVPR1A	24	50
COc1cccc2c1CCN(C(=O)[C@@]1(OC(C)C)CCOC1)C2	ZINC000450528381	DE	On-Demand	Anodyne	AKR1C3	15	45
COc1cccc2c1CCN(C(=O)[C@]1(OC(C)C)CCOC1)C2	ZINC000450528382	DE	On-Demand	Anodyne	AKR1C3	15	45
CC(C)(CCC#N)CNc1ncnc2[nH]c3ccccc3c12	ZINC000450528389	CH	On-Demand	Mild	UTS2R	0	41
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450528392	DH	On-Demand	Anodyne	SSTR2	41	40
CCC[C@@H]1CCC[C@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450528393	DH	On-Demand	Anodyne	HTR1A	24	44
CCC[C@@H]1CCC[C@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450528393	DH	On-Demand	Anodyne	SSTR2	41	40
CCC[C@@H]1CCC[C@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450528393	DH	On-Demand	Anodyne	SSTR1	50	40
CCC[C@H]1CCC[C@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450528394	DH	On-Demand	Anodyne	HTR1A	24	44
CCC[C@H]1CCC[C@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450528394	DH	On-Demand	Anodyne	SSTR2	41	40
CCC[C@H]1CCC[C@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450528394	DH	On-Demand	Anodyne	SSTR1	50	40
CCC[C@H]1CCC[C@@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000450528395	DH	On-Demand	Anodyne	SSTR2	41	40
COc1ccc(C2CCN(C(=O)CCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528396	FH	On-Demand	Anodyne	CHRM2	17	42
COc1ccc(C2CCN(C(=O)CCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528396	FH	On-Demand	Anodyne	KCNA5	17	48
COc1ccc(C2CCN(C(=O)CCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528396	FH	On-Demand	Anodyne	CCR1	36	41
COc1ccc(C2CCN(C(=O)CCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528396	FH	On-Demand	Anodyne	C3AR1	35	43
COc1ccc(C2CCN(C(=O)CCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528396	FH	On-Demand	Anodyne	MCHR1	15	42
COc1ccc(C2CCN(C(=O)CCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528396	FH	On-Demand	Anodyne	GPBAR1	19	40
COc1ccc(C2CCN(C(=O)CCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528396	FH	On-Demand	Anodyne	ETHR	66	41
CSc1cccc(C(=O)N2Cc3ccccc3OC[C@H]2C)c1	ZINC000450528400	DH	On-Demand	Anodyne	HCRTR2	0	42
CSc1cccc(C(=O)N2Cc3ccccc3OC[C@@H]2C)c1	ZINC000450528401	DH	On-Demand	Anodyne	HCRTR2	0	42
COc1cccc2c1CCN(C(=O)[C@H]1Cc3cccc(C)c3O1)C2	ZINC000450528410	DF	On-Demand	Anodyne	SSTR2	46	42
COc1cccc2c1CCN(C(=O)[C@H]1Cc3cccc(C)c3O1)C2	ZINC000450528410	DF	On-Demand	Anodyne	SSTR1	50	37
O=C(c1cc2cccnc2s1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450528423	GJ	On-Demand	Anodyne	RBP4	84	44
O=C(c1cc2cccnc2s1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450528424	GJ	On-Demand	Anodyne	RBP4	84	44
CO[C@@H]1COCC[C@H]1CC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450528425	GG	On-Demand	Anodyne	RBP4	80	39
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450528426	GG	On-Demand	Anodyne	RBP4	80	39
CO[C@@H]1COCC[C@H]1CC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450528427	GG	On-Demand	Anodyne	RBP4	80	39
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450528428	GG	On-Demand	Anodyne	RBP4	80	39
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	HTR1A	17	64
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	DRD2	36	47
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	DRD1	22	49
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	DRD4	22	49
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	HRH2	15	42
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	HTR2A	32	59
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	HTR2C	27	64
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	SLC6A1	47	35
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	ADRA1B	16	44
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	DRD3	0	49
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	HTR7	15	47
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	SIGMAR1	26	49
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	CCR3	36	49
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	SLC18A3	15	45
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	EPHX2	37	43
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	MCHR1	18	45
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCCN1CCC(NC(=O)C2CCCCC2)CC1)c1ccc(F)cc1	ZINC000450528429	FH	On-Demand	Anodyne	WNT3A	44	31
O=C(N[C@@H](CO)CC1CCCC1)[C@H](O)C1CCC1	ZINC000450528430	CD	On-Demand	Anodyne	METAP2	19	42
O=C(N[C@@H](CO)CC1CCCC1)[C@@H](O)C1CCC1	ZINC000450528431	CD	On-Demand	Anodyne	METAP2	19	42
O=C(N[C@H](CO)CC1CCCC1)[C@H](O)C1CCC1	ZINC000450528432	CD	On-Demand	Anodyne	METAP2	19	42
O=C(N[C@H](CO)CC1CCCC1)[C@@H](O)C1CCC1	ZINC000450528433	CD	On-Demand	Anodyne	METAP2	19	42
OC1(CCNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450528436	DG	On-Demand	Anodyne	HRP1_PLAFA	100	37
OC1(CCNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450528436	DG	On-Demand	Anodyne	HNMT	52	37
CCC(CC)(NC(=O)Cc1cccc(OCC(F)(F)F)c1)C(=O)O	ZINC000450528448	EF	On-Demand	Anodyne	TSPAN17	0	40
CCC(CC)(NC(=O)Cc1cccc(OCC(F)(F)F)c1)C(=O)O	ZINC000450528448	EF	On-Demand	Anodyne	PDS	82	39
COC(=O)C1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCOCC1	ZINC000450528454	FD	On-Demand	Anodyne	HCN1	50	32
CCS(=O)(=O)c1ccc(CN(C2CC2)[C@@H](C)c2ccccc2)cc1	ZINC000450528461	EI	On-Demand	Anodyne	CCR5	35	40
CCS(=O)(=O)c1ccc(CN(C2CC2)[C@@H](C)c2ccccc2)cc1	ZINC000450528461	EI	On-Demand	Anodyne	RORC	35	40
CCS(=O)(=O)c1ccc(CN(C2CC2)[C@H](C)c2ccccc2)cc1	ZINC000450528462	EI	On-Demand	Anodyne	CCR5	35	40
CCS(=O)(=O)c1ccc(CN(C2CC2)[C@H](C)c2ccccc2)cc1	ZINC000450528462	EI	On-Demand	Anodyne	RORC	35	40
CCC(CC)(NC(=O)[C@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528464	DG	On-Demand	Anodyne	MME	58	40
CCC(CC)(NC(=O)[C@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528464	DG	On-Demand	Anodyne	ANPEP	28	43
CCC(CC)(NC(=O)[C@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528464	DG	On-Demand	Anodyne	CXCL8	56	37
CCC(CC)(NC(=O)[C@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528464	DG	On-Demand	Anodyne	COLA	61	33
CCC(CC)(NC(=O)[C@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528464	DG	On-Demand	Anodyne	ACE2	61	36
CCC(CC)(NC(=O)[C@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528464	DG	On-Demand	Anodyne	DXS	0	41
CCC(CC)(NC(=O)[C@@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528465	DG	On-Demand	Anodyne	MME	58	40
CCC(CC)(NC(=O)[C@@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528465	DG	On-Demand	Anodyne	ANPEP	28	43
CCC(CC)(NC(=O)[C@@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528465	DG	On-Demand	Anodyne	CXCL8	56	37
CCC(CC)(NC(=O)[C@@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528465	DG	On-Demand	Anodyne	COLA	61	33
CCC(CC)(NC(=O)[C@@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528465	DG	On-Demand	Anodyne	ACE2	61	36
CCC(CC)(NC(=O)[C@@H](C)Cc1ccccc1Cl)C(=O)O	ZINC000450528465	DG	On-Demand	Anodyne	DXS	0	41
O=C(NCCc1cccs1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450528468	FH	On-Demand	Anodyne	ADAM17	0	44
O=C(NCCc1cccs1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450528469	FH	On-Demand	Anodyne	ADAM17	0	44
CCOC(=O)[C@@H](CO)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450528478	DC	On-Demand	Anodyne	P2RY12	42	33
CCOC(=O)[C@H](CO)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450528479	DC	On-Demand	Anodyne	P2RY12	42	33
CCOC(=O)C(C)(C)C1CCN(c2nccc(-c3cnccn3)n2)CC1	ZINC000450528488	FF	On-Demand	Anodyne	DKK1	0	42
CC(C)C[C@H](NC(=O)CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450528493	FD	On-Demand	Anodyne	OPRD1	0	42
CC(C)C[C@H](NC(=O)CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450528493	FD	On-Demand	Anodyne	FOLH1	53	39
CC(C)C[C@H](NC(=O)CNC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450528493	FD	On-Demand	Anodyne	PDYN	0	42
CC(C)[C@H](NC(=O)C1CC(C)(O)C1)c1ccc(Cl)cc1F	ZINC000450528496	DG	On-Demand	Anodyne	SDH1	0	42
CC(C)[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc(Cl)cc1F	ZINC000450528497	DG	On-Demand	Anodyne	SDH1	0	42
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	CHRM2	15	43
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	DRD4	31	45
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	DRD3	0	45
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	CHRM3	18	42
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	SIGMAR1	39	69
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	EPHX2	35	47
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	MCHR1	29	43
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	CACNA1G	40	43
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450528510	GH	On-Demand	Anodyne	BIRC2	37	42
COc1cccc2c1CCN(C(=O)[C@@H]1Cc3cccc(C)c3O1)C2	ZINC000450528539	DF	On-Demand	Anodyne	SSTR2	46	42
COc1cccc2c1CCN(C(=O)[C@@H]1Cc3cccc(C)c3O1)C2	ZINC000450528539	DF	On-Demand	Anodyne	SSTR1	50	37
CCN(CC)CCCC1CCN(C(=O)c2cc3n(n2)CCCC3)CC1	ZINC000450528545	EG	On-Demand	Anodyne	L3MBTL3	51	34
COc1cc(CC(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)ccc1O	ZINC000450528546	FI	On-Demand	Anodyne	TRPV1	47	56
COc1cc(CC(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)ccc1O	ZINC000450528546	FI	On-Demand	Anodyne	NCE103	28	40
COc1cc(CC(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)ccc1O	ZINC000450528546	FI	On-Demand	Anodyne	P96878_MYCTU	15	40
COc1cc(CC(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)ccc1O	ZINC000450528546	FI	On-Demand	Anodyne	CAN2	0	40
O=C(O)c1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450528547	DF	On-Demand	Anodyne	AVPR1A	22	52
O=C(O)c1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450528547	DF	On-Demand	Anodyne	SIGMAR1	19	43
O=C(O)c1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450528548	DF	On-Demand	Anodyne	AVPR1A	22	52
O=C(O)c1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450528548	DF	On-Demand	Anodyne	SIGMAR1	19	43
O=C(N[C@H](CO)C1CCOCC1)c1ccc(I)cc1F	ZINC000450528549	GD	On-Demand	Anodyne	MAP2K1	57	38
O=C(N[C@@H](CO)C1CCOCC1)c1ccc(I)cc1F	ZINC000450528550	GD	On-Demand	Anodyne	MAP2K1	57	38
C[C@@H]1C[C@]1(C#N)C(=O)N[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450528552	GI	On-Demand	Mild	ENV	44	34
C[C@@H]1C[C@]1(C#N)C(=O)N[C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450528553	GI	On-Demand	Mild	ENV	44	34
C[C@@H]1C[C@]1(C#N)C(=O)N[C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450528554	GI	On-Demand	Mild	ENV	44	34
C[C@@H]1C[C@]1(C#N)C(=O)N[C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450528555	GI	On-Demand	Mild	ENV	44	34
COc1cccc2c1CCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450528570	GH	On-Demand	Bother	SSTR2	0	49
COc1cccc2c1CCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450528570	GH	On-Demand	Bother	CACNA1B	42	34
COc1cccc2c1CCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450528570	GH	On-Demand	Bother	SLC6A9	23	45
COc1cccc2c1CCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450528570	GH	On-Demand	Bother	SSTR1	24	49
COc1cccc2c1CCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C2	ZINC000450528570	GH	On-Demand	Bother	PPXII	0	40
CC[C@@H]1CCC[C@H]1C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528571	EE	On-Demand	Anodyne	SCN9A	17	40
CC[C@H]1CCC[C@H]1C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528572	EE	On-Demand	Anodyne	SCN9A	17	40
CC[C@H]1CCC[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528573	EE	On-Demand	Anodyne	SCN9A	17	40
CC[C@@H]1CCC[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528574	EE	On-Demand	Anodyne	SCN9A	17	40
CCOC(=O)c1ccc(N2CCCN(C[C@@](C)(O)C(C)=O)CC2)nc1	ZINC000450528575	ED	On-Demand	Anodyne	HPGDS	15	41
CCOC(=O)c1ccc(N2CCCN(C[C@](C)(O)C(C)=O)CC2)nc1	ZINC000450528576	ED	On-Demand	Anodyne	HPGDS	15	41
CCOC1CC(N(C)c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450528586	DF	On-Demand	Anodyne	LUCI_PHOPE	22	40
CCOC(=O)c1csc(N2CCC(Cc3ccccc3CO)CC2)n1	ZINC000450528599	FG	On-Demand	Anodyne	PTGER1	29	41
CN(C(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC1)[C@H]1CC1(C)C	ZINC000450528600	GE	On-Demand	Anodyne	CHRM5	19	42
CN(C(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC1)[C@H]1CC1(C)C	ZINC000450528600	GE	On-Demand	Anodyne	EPHX2	24	51
CN(C(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC1)[C@H]1CC1(C)C	ZINC000450528600	GE	On-Demand	Anodyne	TGM2	43	41
CN(C(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC1)[C@@H]1CC1(C)C	ZINC000450528601	GE	On-Demand	Anodyne	CHRM5	19	42
CN(C(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC1)[C@@H]1CC1(C)C	ZINC000450528601	GE	On-Demand	Anodyne	EPHX2	24	51
CN(C(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)CC1)[C@@H]1CC1(C)C	ZINC000450528601	GE	On-Demand	Anodyne	TGM2	43	41
Cc1nc(NC[C@@H](CO)c2ccccc2Cl)ncc1[N+](=O)[O-]	ZINC000450528614	DD	On-Demand	Bother	PRKCQ	45	39
Cc1nc(NC[C@H](CO)c2ccccc2Cl)ncc1[N+](=O)[O-]	ZINC000450528615	DD	On-Demand	Bother	PRKCQ	45	39
CN(C(=O)C1CCN(S(=O)(=O)c2ccccc2C(=O)O)CC1)[C@H]1CC1(C)C	ZINC000450528616	GE	On-Demand	Anodyne	EPHX2	26	40
CN(C(=O)C1CCN(S(=O)(=O)c2ccccc2C(=O)O)CC1)[C@@H]1CC1(C)C	ZINC000450528617	GE	On-Demand	Anodyne	EPHX2	26	40
COc1cccc2c1CCN(C(=O)c1nn(C)c3c1CCCC3)C2	ZINC000450528618	EF	On-Demand	Anodyne	SSTR1	40	34
NC(=O)c1cccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450528622	EE	On-Demand	Anodyne	HTR1A	32	41
NC(=O)c1cccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450528622	EE	On-Demand	Anodyne	DRD2	35	43
NC(=O)c1cccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450528622	EE	On-Demand	Anodyne	DRD4	47	43
NC(=O)c1cccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450528622	EE	On-Demand	Anodyne	HTR7	25	40
NC(=O)c1cccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450528622	EE	On-Demand	Anodyne	ABCC1	112	49
NC(=O)c1cccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450528622	EE	On-Demand	Anodyne	ABCB1A	59	49
NC(=O)c1cccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450528622	EE	On-Demand	Anodyne	MRGPRX1	40	36
O=C(O)c1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)o1	ZINC000450528626	DE	On-Demand	Anodyne	AVPR1A	0	50
O=C(O)c1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)o1	ZINC000450528627	DE	On-Demand	Anodyne	AVPR1A	0	50
CC[C@@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528628	EF	On-Demand	Anodyne	ANPEP	38	41
CC[C@@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528628	EF	On-Demand	Anodyne	CAPN2	40	34
CC[C@@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528628	EF	On-Demand	Anodyne	AMP1_PLAFQ	28	40
CC[C@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528629	EF	On-Demand	Anodyne	ANPEP	38	41
CC[C@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528629	EF	On-Demand	Anodyne	CAPN2	40	34
CC[C@H](CC(C)C)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528629	EF	On-Demand	Anodyne	AMP1_PLAFQ	28	40
CCOC(=O)c1ccc(N2CCCN(Cc3cccc(C(C)=O)c3)CC2)nc1	ZINC000450528630	GG	On-Demand	Anodyne	HTR1A	16	45
CCOC(=O)c1ccc(N2CCCN(Cc3cccc(C(C)=O)c3)CC2)nc1	ZINC000450528630	GG	On-Demand	Anodyne	DRD2	15	45
CCOC(=O)c1ccc(N2CCCN(Cc3cccc(C(C)=O)c3)CC2)nc1	ZINC000450528630	GG	On-Demand	Anodyne	SSTR5	41	33
COC(=O)c1csc(CN2CCc3ccc(F)cc32)n1	ZINC000450528634	CF	On-Demand	Anodyne	SCD1	0	41
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2ccnn2CC(F)(F)F)c1	ZINC000450528638	GD	On-Demand	Anodyne	CARM1	67	35
CCOC(=O)c1cc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)on1	ZINC000450528643	GG	On-Demand	Anodyne	CACNA1C	16	40
CCOC(=O)c1cc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)on1	ZINC000450528643	GG	On-Demand	Anodyne	RBP4	76	40
CCOC(=O)c1cc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)on1	ZINC000450528644	GG	On-Demand	Anodyne	CACNA1C	16	40
CCOC(=O)c1cc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)on1	ZINC000450528644	GG	On-Demand	Anodyne	RBP4	76	40
COc1ccc(-c2ccnc(NC[C@H]3CCCC[C@H]3NS(C)(=O)=O)n2)cc1	ZINC000450528650	GF	On-Demand	Anodyne	IKBKB	0	45
COc1ccc(-c2ccnc(NC[C@H]3CCCC[C@H]3NS(C)(=O)=O)n2)cc1	ZINC000450528650	GF	On-Demand	Anodyne	VCP	33	42
COc1ccc(-c2ccnc(NC[C@@H]3CCCC[C@H]3NS(C)(=O)=O)n2)cc1	ZINC000450528651	GF	On-Demand	Anodyne	IKBKB	0	45
COc1ccc(-c2ccnc(NC[C@@H]3CCCC[C@H]3NS(C)(=O)=O)n2)cc1	ZINC000450528651	GF	On-Demand	Anodyne	VCP	33	42
COc1ccc(-c2ccnc(NC[C@H]3CCCC[C@@H]3NS(C)(=O)=O)n2)cc1	ZINC000450528652	GF	On-Demand	Anodyne	IKBKB	0	45
COc1ccc(-c2ccnc(NC[C@H]3CCCC[C@@H]3NS(C)(=O)=O)n2)cc1	ZINC000450528652	GF	On-Demand	Anodyne	VCP	33	42
COc1ccc(-c2ccnc(NC[C@@H]3CCCC[C@@H]3NS(C)(=O)=O)n2)cc1	ZINC000450528653	GF	On-Demand	Anodyne	IKBKB	0	45
COc1ccc(-c2ccnc(NC[C@@H]3CCCC[C@@H]3NS(C)(=O)=O)n2)cc1	ZINC000450528653	GF	On-Demand	Anodyne	VCP	33	42
OC1(CCNc2ncnc3cc(Br)ccc23)CCOCC1	ZINC000450528659	FE	On-Demand	Anodyne	EGFR	63	40
O=C(NC1CCCCC1)C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450528663	EG	On-Demand	Anodyne	EPHX2	26	54
O=C(N[C@@H](CCO)c1ccccc1Br)c1cc2n(n1)CCCC2	ZINC000450528664	GF	On-Demand	Anodyne	CTSA	48	33
O=C(N[C@H](CCO)c1ccccc1Br)c1cc2n(n1)CCCC2	ZINC000450528665	GF	On-Demand	Anodyne	CTSA	48	33
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450528666	FC	On-Demand	Anodyne	P2RY12	48	31
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450528667	FC	On-Demand	Anodyne	P2RY12	48	31
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450528668	FC	On-Demand	Anodyne	P2RY12	48	31
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450528669	FC	On-Demand	Anodyne	P2RY12	48	31
COC[C@]1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450528670	FF	On-Demand	Anodyne	RBP4	24	40
COC[C@]1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450528671	FF	On-Demand	Anodyne	RBP4	24	40
COC[C@@]1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450528672	FF	On-Demand	Anodyne	RBP4	24	40
COC[C@@]1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450528673	FF	On-Demand	Anodyne	RBP4	24	40
c1ccc(CN2CC[C@H](N3CCN(c4nncs4)CC3)C2)cc1	ZINC000450528682	ED	On-Demand	Anodyne	DRD3	0	42
c1ccc(CN2CC[C@H](N3CCN(c4nncs4)CC3)C2)cc1	ZINC000450528682	ED	On-Demand	Anodyne	VACHT_TETCF	0	40
c1ccc(CN2CC[C@@H](N3CCN(c4nncs4)CC3)C2)cc1	ZINC000450528683	ED	On-Demand	Anodyne	DRD3	0	42
c1ccc(CN2CC[C@@H](N3CCN(c4nncs4)CC3)C2)cc1	ZINC000450528683	ED	On-Demand	Anodyne	VACHT_TETCF	0	40
CCSc1cccnc1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450528685	GI	On-Demand	Anodyne	RBP4	80	40
CCSc1cccnc1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450528686	GI	On-Demand	Anodyne	RBP4	80	40
COc1cc(CC(=O)Nc2cccc(N(C)C)n2)ccc1Cl	ZINC000450528689	DF	On-Demand	Anodyne	TRPV1	0	41
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528695	GG	On-Demand	Anodyne	HTR4	27	44
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528695	GG	On-Demand	Anodyne	TRPV1	0	43
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528695	GG	On-Demand	Anodyne	ECR	72	41
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528695	GG	On-Demand	Anodyne	KCNA3	45	39
COc1cc(Cl)c(C(=O)NC[C@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528695	GG	On-Demand	Anodyne	E3UJZ5_SPOLI	47	38
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528696	GG	On-Demand	Anodyne	HTR4	27	44
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528696	GG	On-Demand	Anodyne	TRPV1	0	43
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528696	GG	On-Demand	Anodyne	ECR	72	41
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528696	GG	On-Demand	Anodyne	KCNA3	45	39
COc1cc(Cl)c(C(=O)NC[C@@](C)(C(=O)O)c2ccccc2)cc1OC	ZINC000450528696	GG	On-Demand	Anodyne	E3UJZ5_SPOLI	47	38
O=C([C@H]1CCCCC1(F)F)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450528709	GI	On-Demand	Anodyne	RBP4	84	42
O=C([C@@H]1CCCCC1(F)F)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450528710	GI	On-Demand	Anodyne	RBP4	84	42
O=C([C@H]1CCCCC1(F)F)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450528711	GI	On-Demand	Anodyne	RBP4	84	42
O=C([C@@H]1CCCCC1(F)F)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450528712	GI	On-Demand	Anodyne	RBP4	84	42
CCOc1cc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)on1	ZINC000450528734	FG	On-Demand	Anodyne	RBP4	65	37
CCOc1cc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)on1	ZINC000450528735	FG	On-Demand	Anodyne	RBP4	65	37
O=C(NC1CCN(Cc2ccccc2OC2CC2)CC1)C1CCCCC1	ZINC000450528736	FH	On-Demand	Anodyne	DRD4	19	41
O=C(NC1CCN(Cc2ccccc2OC2CC2)CC1)C1CCCCC1	ZINC000450528736	FH	On-Demand	Anodyne	CHRM3	23	42
O=C(NC1CCN(Cc2ccccc2OC2CC2)CC1)C1CCCCC1	ZINC000450528736	FH	On-Demand	Anodyne	SIGMAR1	28	51
O=C(NC1CCN(Cc2ccccc2OC2CC2)CC1)C1CCCCC1	ZINC000450528736	FH	On-Demand	Anodyne	SSTR5	45	39
O=C(NC1CCN(Cc2ccccc2OC2CC2)CC1)C1CCCCC1	ZINC000450528736	FH	On-Demand	Anodyne	CCR3	26	40
O=C(NC1CCN(Cc2ccccc2OC2CC2)CC1)C1CCCCC1	ZINC000450528736	FH	On-Demand	Anodyne	EPHX2	37	47
O=C(NC1CCN(Cc2ccccc2OC2CC2)CC1)C1CCCCC1	ZINC000450528736	FH	On-Demand	Anodyne	MCHR1	25	41
O=C(NC1CCN(Cc2ccccc2OC2CC2)CC1)C1CCCCC1	ZINC000450528736	FH	On-Demand	Anodyne	CCR8	29	40
COC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1Cl	ZINC000450528737	GH	On-Demand	Anodyne	DRD2	15	46
COC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1Cl	ZINC000450528737	GH	On-Demand	Anodyne	DRD4	26	50
COC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1Cl	ZINC000450528737	GH	On-Demand	Anodyne	DRD3	15	46
COC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1Cl	ZINC000450528737	GH	On-Demand	Anodyne	SIGMAR1	25	53
COC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1Cl	ZINC000450528737	GH	On-Demand	Anodyne	EPHX2	34	48
CCOC(=O)[C@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450528738	ED	On-Demand	Anodyne	KLK3	56	34
CCOC(=O)[C@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450528738	ED	On-Demand	Anodyne	TIMP3	74	39
CCOC(=O)[C@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450528738	ED	On-Demand	Anodyne	CAPNS1	44	31
CCOC(=O)[C@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450528738	ED	On-Demand	Anodyne	CAPN2	58	34
COc1cc(C(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)c([N+](=O)[O-])cc1F	ZINC000450528743	GI	On-Demand	Bother	TAAR1	21	40
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)o3)CC2)cc1	ZINC000450528745	EG	On-Demand	Anodyne	L3MBTL1	0	47
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)o3)CC2)cc1	ZINC000450528745	EG	On-Demand	Anodyne	L3MBTL3	24	47
CC(=O)NCC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528746	GG	On-Demand	Anodyne	PDE3A	43	33
CC(=O)NCC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528746	GG	On-Demand	Anodyne	PDGFRB	45	40
CC(=O)NCC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528746	GG	On-Demand	Anodyne	PDE3B	64	33
CC(=O)NCC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528746	GG	On-Demand	Anodyne	SIRT3	96	48
CC(=O)NCC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528746	GG	On-Demand	Anodyne	SIRT2	82	48
CC(=O)NCC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528746	GG	On-Demand	Anodyne	SIRT1	73	41
CC(=O)NCC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528747	GG	On-Demand	Anodyne	PDE3A	43	33
CC(=O)NCC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528747	GG	On-Demand	Anodyne	PDGFRB	45	40
CC(=O)NCC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528747	GG	On-Demand	Anodyne	PDE3B	64	33
CC(=O)NCC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528747	GG	On-Demand	Anodyne	SIRT3	96	48
CC(=O)NCC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528747	GG	On-Demand	Anodyne	SIRT2	82	48
CC(=O)NCC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450528747	GG	On-Demand	Anodyne	SIRT1	73	41
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1O	ZINC000450528750	GD	On-Demand	Anodyne	ADRB2	41	39
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1O	ZINC000450528750	GD	On-Demand	Anodyne	TRPV1	39	57
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1O	ZINC000450528750	GD	On-Demand	Anodyne	CA5A	15	41
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1O	ZINC000450528750	GD	On-Demand	Anodyne	CA9	22	43
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1O	ZINC000450528750	GD	On-Demand	Anodyne	E1	0	40
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1O	ZINC000450528750	GD	On-Demand	Anodyne	NCE103	37	45
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1O	ZINC000450528750	GD	On-Demand	Anodyne	P96878_MYCTU	26	45
COc1cc(CC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)ccc1O	ZINC000450528750	GD	On-Demand	Anodyne	CAN2	0	45
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3F)CC2)cc1	ZINC000450528757	FH	On-Demand	Anodyne	GRM3	22	48
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3F)CC2)cc1	ZINC000450528757	FH	On-Demand	Anodyne	CCR1	38	42
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3F)CC2)cc1	ZINC000450528757	FH	On-Demand	Anodyne	FASN	40	34
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3F)CC2)cc1	ZINC000450528757	FH	On-Demand	Anodyne	L3MBTL3	44	38
O=C(O)COc1cccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450528763	FE	On-Demand	Anodyne	FABP4	42	32
O=C(O)COc1cccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450528764	FE	On-Demand	Anodyne	FABP4	42	32
CN(C(=O)CCc1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000450528773	CF	On-Demand	Anodyne	RXRG	45	36
CN(C(=O)CCc1ccc(C(=O)O)cc1)[C@@H]1CC1(C)C	ZINC000450528773	CF	On-Demand	Anodyne	RXRB	46	33
CN(C(=O)CCc1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000450528774	CF	On-Demand	Anodyne	RXRG	45	36
CN(C(=O)CCc1ccc(C(=O)O)cc1)[C@H]1CC1(C)C	ZINC000450528774	CF	On-Demand	Anodyne	RXRB	46	33
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)c(C)n3)CC2)cc1	ZINC000450528781	FG	On-Demand	Anodyne	TRPC6	33	42
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)c(C)n3)CC2)cc1	ZINC000450528781	FG	On-Demand	Anodyne	TRPC3	17	42
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1)C2	ZINC000450528786	DH	On-Demand	Anodyne	SSTR2	57	45
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1)C2	ZINC000450528787	DH	On-Demand	Anodyne	SSTR2	57	45
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@H](C)[C@H](C)C1)C2	ZINC000450528788	DH	On-Demand	Anodyne	SSTR2	57	45
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1)C2	ZINC000450528789	DH	On-Demand	Anodyne	SSTR2	57	45
COc1cccc2c1CCN(C(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1)C2	ZINC000450528789	DH	On-Demand	Anodyne	SSTR1	68	45
NC(=O)[C@@H]1Cc2ccccc2N1Cc1ccn(CC(F)(F)F)n1	ZINC000450528790	DD	On-Demand	Anodyne	TPP2	43	30
CC(=O)NCC[C@H]1CCCN(c2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000450528795	FG	On-Demand	Anodyne	GPBAR1	23	46
CC(=O)NCC[C@@H]1CCCN(c2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000450528796	FG	On-Demand	Anodyne	GPBAR1	23	46
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2nn(C)c3c2CCCC3)c1	ZINC000450528820	GD	On-Demand	Anodyne	NAMPT	40	33
Cc1cc(-c2nc(C(=O)Nc3cc(F)c(OC(C)(C)C)c(F)c3)co2)ccn1	ZINC000450528821	GJ	On-Demand	Anodyne	IRAK4	21	43
CCOCc1nc(C)c(C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)s1	ZINC000450528832	GE	On-Demand	Anodyne	SCD1	44	43
CCOCc1nc(C)c(C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)s1	ZINC000450528832	GE	On-Demand	Anodyne	SCD	38	43
Cn1cc(-c2ccc(C(=O)Nc3cc(F)c(OC(C)(C)C)c(F)c3)o2)cn1	ZINC000450528846	GI	On-Demand	Anodyne	SCN10A	32	46
O=C(O)c1ccc(CCC(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450528847	FF	On-Demand	Anodyne	SLC18A3	0	42
O=C(O)c1ccc(CCC(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450528848	FF	On-Demand	Anodyne	SLC18A3	0	42
Cc1cncc(-c2nc(CN3CCC(NC(=O)c4ccc(C)s4)CC3)no2)c1	ZINC000450528852	GG	On-Demand	Anodyne	SSTR5	49	44
Cc1cncc(-c2nc(CN3CCC(NC(=O)c4ccc(C)s4)CC3)no2)c1	ZINC000450528852	GG	On-Demand	Anodyne	PDK1	42	36
COc1ccc(C2CCN(C(=O)c3cc(C)c(OCC(=O)O)c(C)c3)CC2)cc1	ZINC000450528866	GH	On-Demand	Anodyne	FASN	41	35
COc1ccc(C2CCN(C(=O)c3cc(C)c(OCC(=O)O)c(C)c3)CC2)cc1	ZINC000450528866	GH	On-Demand	Anodyne	GPR183	0	41
CN(C)S(=O)(=O)c1cccc(CNC(=O)c2cnc(C3CC3)nc2)c1	ZINC000450528867	FD	On-Demand	Anodyne	NAMPT	46	38
COc1ccc(C2CCN(C(=O)CCc3ccccc3C(=O)O)CC2)cc1	ZINC000450528870	FH	On-Demand	Anodyne	SIGMAR1	17	43
COc1ccc(C2CCN(C(=O)CCc3ccccc3C(=O)O)CC2)cc1	ZINC000450528870	FH	On-Demand	Anodyne	CCR1	38	42
COc1ccc(C2CCN(C(=O)CCc3ccccc3C(=O)O)CC2)cc1	ZINC000450528870	FH	On-Demand	Anodyne	CCR3	15	43
COc1ccc(C2CCN(C(=O)CCc3ccccc3C(=O)O)CC2)cc1	ZINC000450528870	FH	On-Demand	Anodyne	C3AR1	31	42
COc1ccc(C2CCN(C(=O)CCc3ccccc3C(=O)O)CC2)cc1	ZINC000450528870	FH	On-Demand	Anodyne	ETHR	43	36
COc1ccc(C2CCN(C(=O)CCc3ccccc3C(=O)O)CC2)cc1	ZINC000450528870	FH	On-Demand	Anodyne	GPR183	0	42
NC(=O)c1cccnc1N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450528879	EE	On-Demand	Anodyne	HTR1A	30	40
NC(=O)c1cccnc1N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450528880	EE	On-Demand	Anodyne	HTR1A	30	40
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	CHRM2	41	38
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	SRD5A2	33	42
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	AVPR1A	24	49
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	HRH3	0	43
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	HSD11B1	0	77
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	SLC18A3	41	48
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	FASN	40	35
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	MMP7	25	40
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	L3MBTL1	0	43
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	L3MBTL3	78	43
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	MBTD1	0	42
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	GPR183	0	50
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)cc3)CC2)cc1	ZINC000450528881	EG	On-Demand	Anodyne	SLC6A7	0	47
CCN(CC)CCCC1CCN(C(=O)c2ocnc2-c2ccccc2)CC1	ZINC000450528893	FI	On-Demand	Anodyne	AMY2	40	36
C[C@H](OCCc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528896	GE	On-Demand	Anodyne	AMP1_PLAFQ	46	36
C[C@H](OCCc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528896	GE	On-Demand	Anodyne	PDS	44	32
C[C@@H](OCCc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528897	GE	On-Demand	Anodyne	AMP1_PLAFQ	46	36
C[C@@H](OCCc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528897	GE	On-Demand	Anodyne	PDS	44	32
CCN(CC)CCCC1CCN(C(=O)CC2CC(F)(F)C2)CC1	ZINC000450528898	EH	On-Demand	Anodyne	GNAI3	0	40
CCOC(=O)[C@@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450528899	ED	On-Demand	Anodyne	KLK3	56	34
CCOC(=O)[C@@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450528899	ED	On-Demand	Anodyne	TIMP3	74	39
CCOC(=O)[C@@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450528899	ED	On-Demand	Anodyne	CAPNS1	44	31
CCOC(=O)[C@@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450528899	ED	On-Demand	Anodyne	CAPN2	58	34
C[C@@H](Oc1ccccn1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528903	FD	On-Demand	Anodyne	CARM1	45	36
C[C@H](Oc1ccccn1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450528904	FD	On-Demand	Anodyne	CARM1	45	36
FC(F)(F)CN1CCC[C@H](Nc2ncncc2-c2ccccc2)C1	ZINC000450528905	EH	On-Demand	Anodyne	HPGDS	32	40
FC(F)(F)CN1CCC[C@@H](Nc2ncncc2-c2ccccc2)C1	ZINC000450528906	EH	On-Demand	Anodyne	HPGDS	32	40
Cc1ccc(C(=O)NC2CCN(Cc3cnn[nH]3)CC2)s1	ZINC000450528907	DD	On-Demand	Anodyne	SSTR5	40	36
CC(C)(CNc1ccnc2cc(F)c(Br)cc12)OCCO	ZINC000450528908	FG	On-Demand	Anodyne	HRP1_PLAFA	41	33
CC(C)(CNc1ccnc2cc(F)c(Br)cc12)OCCO	ZINC000450528908	FG	On-Demand	Anodyne	HNMT	42	32
CCC(CC)(NC(=O)[C@H](C)Cc1ccc(OC)c(OC)c1)C(=O)O	ZINC000450528936	EF	On-Demand	Anodyne	ACE2	66	36
CCC(CC)(NC(=O)[C@@H](C)Cc1ccc(OC)c(OC)c1)C(=O)O	ZINC000450528937	EF	On-Demand	Anodyne	ACE2	66	36
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528938	FG	On-Demand	Anodyne	OPRK1	24	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528938	FG	On-Demand	Anodyne	SIGMAR1	22	46
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528938	FG	On-Demand	Anodyne	CCR5	30	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528938	FG	On-Demand	Anodyne	EPHX2	40	47
C[C@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528938	FG	On-Demand	Anodyne	BIRC8	40	32
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528939	FG	On-Demand	Anodyne	OPRK1	24	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528939	FG	On-Demand	Anodyne	SIGMAR1	22	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528939	FG	On-Demand	Anodyne	CCR5	30	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528939	FG	On-Demand	Anodyne	EPHX2	40	47
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528939	FG	On-Demand	Anodyne	BIRC8	40	32
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528940	FG	On-Demand	Anodyne	OPRK1	24	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528940	FG	On-Demand	Anodyne	SIGMAR1	22	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528940	FG	On-Demand	Anodyne	CCR5	30	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528940	FG	On-Demand	Anodyne	EPHX2	40	47
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528942	FG	On-Demand	Anodyne	OPRK1	24	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528942	FG	On-Demand	Anodyne	SIGMAR1	22	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528942	FG	On-Demand	Anodyne	CCR5	30	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528942	FG	On-Demand	Anodyne	EPHX2	40	47
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450528942	FG	On-Demand	Anodyne	BIRC8	40	32
COc1cccc2c1CCN(C(=O)[C@@H]1C[C@H]1CC(C)C)C2	ZINC000450528946	CG	On-Demand	Anodyne	SLC18A2	43	39
COc1cccc2c1CCN(C(=O)[C@@H]1C[C@H]1CC(C)C)C2	ZINC000450528946	CG	On-Demand	Anodyne	SSTR1	47	35
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	DRD4	43	32
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	AVPR1A	20	41
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	VACHT_TETCF	0	41
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	FABP4	40	36
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	HSD11B1	0	58
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	CCR3	19	55
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	COLA	62	38
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	CPT1A	59	38
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	SLC18A3	32	42
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	SCN5A	33	41
COc1ccc(C2CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)cc1	ZINC000450528948	FG	On-Demand	Anodyne	GPR183	0	43
COc1cccc2c1CCN(C(=O)c1cc(C)c(C(N)=O)cn1)C2	ZINC000450528957	ED	On-Demand	Anodyne	SSTR1	41	33
CCC(CC)(NC(=O)CCCc1ccc(OC)cc1OC)C(=O)O	ZINC000450528958	EF	On-Demand	Anodyne	MTNR1A	69	42
CCC(CC)(NC(=O)CCCc1ccc(OC)cc1OC)C(=O)O	ZINC000450528958	EF	On-Demand	Anodyne	MTNR1B	52	40
CCC(CC)(NC(=O)CCCc1ccc(OC)cc1OC)C(=O)O	ZINC000450528958	EF	On-Demand	Anodyne	ACAT	0	42
CCC(CC)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450528960	DF	On-Demand	Anodyne	NCE103	26	45
CCC(CC)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450528960	DF	On-Demand	Anodyne	PFK	0	42
CCC(CC)(NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450528960	DF	On-Demand	Anodyne	CAN2	0	45
N#Cc1cccc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1[N+](=O)[O-]	ZINC000450528963	GF	On-Demand	Mild	DRD2	17	43
N#Cc1cccc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1[N+](=O)[O-]	ZINC000450528963	GF	On-Demand	Mild	ACHE	18	43
N#Cc1cccc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1[N+](=O)[O-]	ZINC000450528963	GF	On-Demand	Mild	SIGMAR1	28	42
N#Cc1cccc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1[N+](=O)[O-]	ZINC000450528963	GF	On-Demand	Mild	SLC18A3	21	42
N#Cc1cccc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1[N+](=O)[O-]	ZINC000450528965	GF	On-Demand	Mild	DRD2	17	43
N#Cc1cccc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1[N+](=O)[O-]	ZINC000450528965	GF	On-Demand	Mild	ACHE	18	43
N#Cc1cccc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1[N+](=O)[O-]	ZINC000450528965	GF	On-Demand	Mild	SIGMAR1	28	42
N#Cc1cccc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1[N+](=O)[O-]	ZINC000450528965	GF	On-Demand	Mild	SLC18A3	21	42
CCOC(=O)[C@@H](CO)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450528989	CC	On-Demand	Anodyne	CCR3	0	44
CCOC(=O)[C@H](CO)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450528990	CC	On-Demand	Anodyne	CCR3	0	44
CCOC(=O)[C@@H](CO)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450528991	CC	On-Demand	Anodyne	CCR3	0	44
CCOC(=O)[C@H](CO)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450528992	CC	On-Demand	Anodyne	CCR3	0	44
O=C(NC1CCN(CCC2=CCCCC2)CC1)C1CCCCC1	ZINC000450529020	DI	On-Demand	Anodyne	EPHX2	32	44
CC[C@H](C(=O)OC)N1CCN(c2ncc(Br)cc2C#N)CC1	ZINC000450529022	FD	On-Demand	Mild	P2RY12	43	44
CC[C@@H](C(=O)OC)N1CCN(c2ncc(Br)cc2C#N)CC1	ZINC000450529023	FD	On-Demand	Mild	P2RY12	43	44
O=C(Cc1ccc(O)c(F)c1)NC1CCC(c2ccc(F)cc2)CC1	ZINC000450529025	EI	On-Demand	Anodyne	GRIN2B	17	62
O=C(Cc1ccc(O)c(F)c1)NC1CCC(c2ccc(F)cc2)CC1	ZINC000450529025	EI	On-Demand	Anodyne	SIGMAR1	17	47
CC1(O)CC(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1	ZINC000450529030	EF	On-Demand	Anodyne	RBP4	59	37
CC1(O)CC(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1	ZINC000450529030	EF	On-Demand	Anodyne	SFRP1	76	33
CC1(O)CC(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1	ZINC000450529030	EF	On-Demand	Anodyne	WNT3	49	31
CC1(O)CC(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1	ZINC000450529031	EF	On-Demand	Anodyne	RBP4	59	37
CC1(O)CC(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1	ZINC000450529031	EF	On-Demand	Anodyne	SFRP1	76	33
CC1(O)CC(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1	ZINC000450529031	EF	On-Demand	Anodyne	WNT3	49	31
O=C(CCCC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000450529033	FH	On-Demand	Anodyne	RBP4	72	44
O=C(CCCC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000450529034	FH	On-Demand	Anodyne	RBP4	72	44
CC(C)(C)Oc1c(F)cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1F	ZINC000450529042	FJ	On-Demand	Anodyne	ATF1	43	31
CC(C)(C)Oc1c(F)cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1F	ZINC000450529042	FJ	On-Demand	Anodyne	TAAR1	27	40
CC(=O)[C@@](C)(O)CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450529046	FE	On-Demand	Anodyne	PYGL	17	52
CC(=O)[C@@](C)(O)CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450529046	FE	On-Demand	Anodyne	FAAH	18	52
CC(=O)[C@@](C)(O)CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450529046	FE	On-Demand	Anodyne	EPHX2	20	40
CC(=O)[C@](C)(O)CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450529047	FE	On-Demand	Anodyne	PYGL	17	52
CC(=O)[C@](C)(O)CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450529047	FE	On-Demand	Anodyne	FAAH	18	52
CC(=O)[C@](C)(O)CN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450529047	FE	On-Demand	Anodyne	EPHX2	20	40
COC[C@@]1(C(=O)N2CCc3c(cccc3OC)C2)CCOC1	ZINC000450529056	DD	On-Demand	Anodyne	CPT2	15	46
COC[C@]1(C(=O)N2CCc3c(cccc3OC)C2)CCOC1	ZINC000450529057	DD	On-Demand	Anodyne	CPT2	15	46
O=[N+]([O-])c1cccc2c(NC[C@H]3CCCSC3)nccc12	ZINC000450529058	DH	On-Demand	Bother	PRKCQ	47	37
O=[N+]([O-])c1cccc2c(NC[C@@H]3CCCSC3)nccc12	ZINC000450529059	DH	On-Demand	Bother	PRKCQ	47	37
O=[N+]([O-])c1cccc2c(NC[C@H]3CCC[C@@H](CO)C3)nccc12	ZINC000450529061	DG	On-Demand	Bother	PRKCQ	48	43
CCOC(=O)c1ccc(N2CCCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)nc1	ZINC000450529062	GF	On-Demand	Anodyne	P2RY12	27	43
CCOC(=O)c1ccc(N2CCCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)nc1	ZINC000450529063	GF	On-Demand	Anodyne	P2RY12	27	43
CCOC(=O)c1ccc(N2CCCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)nc1	ZINC000450529064	GF	On-Demand	Anodyne	P2RY12	27	43
CCOC(=O)c1ccc(N2CCCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)nc1	ZINC000450529065	GF	On-Demand	Anodyne	P2RY12	27	43
CSc1cccc(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1	ZINC000450529071	FI	On-Demand	Anodyne	RHOA	0	44
CSc1cccc(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1	ZINC000450529072	FI	On-Demand	Anodyne	RHOA	0	44
CCOC(=O)c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)nc1	ZINC000450529076	FD	On-Demand	Anodyne	P2RY12	50	43
CC(=O)N[C@H](C(=O)N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1)C(C)(C)C	ZINC000450529077	GG	On-Demand	Anodyne	CCR1	21	43
CC(=O)N[C@H](C(=O)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1)C(C)(C)C	ZINC000450529078	GG	On-Demand	Anodyne	CCR1	21	43
CCCOc1cccc(CN2c3ccccc3C[C@H]2C(N)=O)c1	ZINC000450529081	DF	On-Demand	Anodyne	ADAM9	43	32
CCCOc1cccc(CN2c3ccccc3C[C@H]2C(N)=O)c1	ZINC000450529081	DF	On-Demand	Anodyne	TPP2	54	37
O=C(O)c1ccccc1CC(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450529083	EF	On-Demand	Anodyne	AVPR1A	21	48
O=C(O)c1ccccc1CC(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450529083	EF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(O)c1ccccc1CC(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450529084	EF	On-Demand	Anodyne	AVPR1A	21	48
O=C(O)c1ccccc1CC(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450529084	EF	On-Demand	Anodyne	SIGMAR1	19	40
COc1ccc(-c2ccnc(N[C@@H]3CCCCC[C@H]3O)n2)cc1	ZINC000450529087	DG	On-Demand	Anodyne	IKBKB	16	45
COc1ccc(-c2ccnc(N[C@@H]3CCCCC[C@H]3O)n2)cc1	ZINC000450529087	DG	On-Demand	Anodyne	MAPK8	20	42
CCOC(=O)c1cc(C(=O)N2CCC(CCCN(CC)CC)CC2)[nH]c1C	ZINC000450529103	GG	On-Demand	Anodyne	AKR1C3	18	41
CCCc1ccc2nccc(N3CCC[C@H](CCNC(C)=O)C3)c2c1	ZINC000450529117	EH	On-Demand	Anodyne	SIRT3	41	33
CCCc1ccc2nccc(N3CCC[C@H](CCNC(C)=O)C3)c2c1	ZINC000450529117	EH	On-Demand	Anodyne	SIRT2	45	33
CCCc1ccc2nccc(N3CCC[C@H](CCNC(C)=O)C3)c2c1	ZINC000450529117	EH	On-Demand	Anodyne	SIRT1	42	40
CCCc1ccc2nccc(N3CCC[C@@H](CCNC(C)=O)C3)c2c1	ZINC000450529118	EH	On-Demand	Anodyne	SIRT3	41	33
CCCc1ccc2nccc(N3CCC[C@@H](CCNC(C)=O)C3)c2c1	ZINC000450529118	EH	On-Demand	Anodyne	SIRT2	45	33
CCCc1ccc2nccc(N3CCC[C@@H](CCNC(C)=O)C3)c2c1	ZINC000450529118	EH	On-Demand	Anodyne	SIRT1	42	40
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529125	GD	On-Demand	Anodyne	MME	44	41
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529125	GD	On-Demand	Anodyne	AMP1_PLAFQ	45	39
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529125	GD	On-Demand	Anodyne	CARM1	40	33
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529125	GD	On-Demand	Anodyne	PDS	45	33
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529126	GD	On-Demand	Anodyne	MME	44	41
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529126	GD	On-Demand	Anodyne	AMP1_PLAFQ	45	39
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529126	GD	On-Demand	Anodyne	CARM1	40	33
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529126	GD	On-Demand	Anodyne	PDS	45	33
COc1cccc2c1CCN(C(=O)[C@@H](C)Oc1ccccn1)C2	ZINC000450529129	DE	On-Demand	Anodyne	SSTR2	31	40
COc1cccc2c1CCN(C(=O)[C@H](C)Oc1ccccn1)C2	ZINC000450529134	DE	On-Demand	Anodyne	SSTR2	31	40
Cc1nc(C2CC2)ccc1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529139	GI	On-Demand	Anodyne	RBP4	88	45
Cc1nc(C2CC2)ccc1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529143	GI	On-Demand	Anodyne	RBP4	88	45
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)c1	ZINC000450529151	GG	On-Demand	Anodyne	MTNR1B	20	45
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)c1	ZINC000450529151	GG	On-Demand	Anodyne	NPBWR1	44	30
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)c1	ZINC000450529152	GG	On-Demand	Anodyne	MTNR1B	20	45
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)c1	ZINC000450529152	GG	On-Demand	Anodyne	NPBWR1	44	30
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)c1	ZINC000450529153	GG	On-Demand	Anodyne	MTNR1B	20	45
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)c1	ZINC000450529153	GG	On-Demand	Anodyne	NPBWR1	44	30
NC(=O)c1ccc(CCC(=O)NC2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000450529156	FH	On-Demand	Anodyne	GRIN2B	16	59
O=C(NC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1)C1CCCCC1	ZINC000450529158	DF	On-Demand	Anodyne	EPHX2	24	40
O=C(NC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1)C1CCCCC1	ZINC000450529159	DF	On-Demand	Anodyne	EPHX2	24	40
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)c1	ZINC000450529172	GE	On-Demand	Anodyne	COLA	60	36
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)c1	ZINC000450529172	GE	On-Demand	Anodyne	CPT1A	58	36
CCOC(=O)c1cnc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)c1	ZINC000450529172	GE	On-Demand	Anodyne	CPT1B	52	34
CC(F)(F)C(C)(C)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529189	FI	On-Demand	Anodyne	RBP4	96	45
CC(F)(F)C(C)(C)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529190	FI	On-Demand	Anodyne	RBP4	96	45
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C)nc1C(C)C	ZINC000450529191	CD	On-Demand	Anodyne	CCR3	15	41
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C)nc1C(C)C	ZINC000450529192	CD	On-Demand	Anodyne	CCR3	15	41
CCC(CC)(NC(=O)Cc1cccc(OC(F)(F)F)c1)C(=O)O	ZINC000450529197	EF	On-Demand	Anodyne	PPARG	22	45
CCC(CC)(NC(=O)Cc1cccc(OC(F)(F)F)c1)C(=O)O	ZINC000450529197	EF	On-Demand	Anodyne	CETP	0	40
CCC(CC)(NC(=O)Cc1cccc(OC(F)(F)F)c1)C(=O)O	ZINC000450529197	EF	On-Demand	Anodyne	CRTM	42	33
CCC(CC)(NC(=O)Cc1cccc(OC(F)(F)F)c1)C(=O)O	ZINC000450529197	EF	On-Demand	Anodyne	PDS	77	36
CN(C)c1nc(N[C@H](CS(=O)(=O)N(C)C)C(F)(F)F)nc2ccccc12	ZINC000450529200	GD	On-Demand	Anodyne	ADRA2A	16	46
CN(C)c1nc(N[C@@H](CS(=O)(=O)N(C)C)C(F)(F)F)nc2ccccc12	ZINC000450529201	GD	On-Demand	Anodyne	ADRA2A	16	46
N#CC1(CN2CCC(C(=O)NCCc3cccs3)CC2)CCC1	ZINC000450529206	EF	On-Demand	Mild	ADAM17	0	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529208	FG	On-Demand	Anodyne	OPRK1	24	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529208	FG	On-Demand	Anodyne	SIGMAR1	17	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529208	FG	On-Demand	Anodyne	CCR5	30	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529208	FG	On-Demand	Anodyne	EPHX2	43	53
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529208	FG	On-Demand	Anodyne	BIRC2	40	39
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529208	FG	On-Demand	Anodyne	BIRC8	40	32
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529208	FG	On-Demand	Anodyne	NMUR2	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529208	FG	On-Demand	Anodyne	NMUR1	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529209	FG	On-Demand	Anodyne	OPRK1	24	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529209	FG	On-Demand	Anodyne	SIGMAR1	17	51
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529209	FG	On-Demand	Anodyne	CCR5	30	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529209	FG	On-Demand	Anodyne	EPHX2	43	53
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529209	FG	On-Demand	Anodyne	BIRC2	40	39
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529209	FG	On-Demand	Anodyne	BIRC8	40	32
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529209	FG	On-Demand	Anodyne	NMUR2	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529209	FG	On-Demand	Anodyne	NMUR1	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529210	FG	On-Demand	Anodyne	OPRK1	24	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529210	FG	On-Demand	Anodyne	SIGMAR1	17	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529210	FG	On-Demand	Anodyne	CCR5	30	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529210	FG	On-Demand	Anodyne	EPHX2	43	53
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529210	FG	On-Demand	Anodyne	BIRC2	40	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529210	FG	On-Demand	Anodyne	BIRC8	40	32
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529210	FG	On-Demand	Anodyne	NMUR2	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529210	FG	On-Demand	Anodyne	NMUR1	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529211	FG	On-Demand	Anodyne	OPRK1	24	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529211	FG	On-Demand	Anodyne	SIGMAR1	17	51
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529211	FG	On-Demand	Anodyne	CCR5	30	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529211	FG	On-Demand	Anodyne	EPHX2	43	53
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529211	FG	On-Demand	Anodyne	BIRC2	40	39
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529211	FG	On-Demand	Anodyne	BIRC8	40	32
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529211	FG	On-Demand	Anodyne	NMUR2	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450529211	FG	On-Demand	Anodyne	NMUR1	0	42
O=C(NC1CCN(CCc2cscn2)CC1)C1CCCCC1	ZINC000450529212	DF	On-Demand	Anodyne	EPHX2	32	45
CCc1cc(CCCN2CCC(NC(=O)C3CCCCC3)CC2)on1	ZINC000450529213	EG	On-Demand	Anodyne	EPHX2	27	44
O=C([C@H]1CC12CCSCC2)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529224	GI	On-Demand	Anodyne	RBP4	84	40
O=C([C@@H]1CC12CCSCC2)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529225	GI	On-Demand	Anodyne	RBP4	84	40
O=C([C@H]1CC12CCSCC2)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529226	GI	On-Demand	Anodyne	RBP4	84	40
O=C([C@@H]1CC12CCSCC2)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529227	GI	On-Demand	Anodyne	RBP4	84	40
COc1cccc2c(N3CCC[C@@H](CN(C)S(C)(=O)=O)C3)nccc12	ZINC000450529228	FE	On-Demand	Anodyne	PDE3B	53	32
COc1cccc2c(N3CCC[C@H](CN(C)S(C)(=O)=O)C3)nccc12	ZINC000450529229	FE	On-Demand	Anodyne	PDE3B	53	32
COC(=O)C1(CNC(=O)c2cc3ccncc3s2)CCOCC1	ZINC000450529238	ED	On-Demand	Anodyne	SELE	53	38
COC(=O)C1(CNC(=O)c2cc3ccncc3s2)CCOCC1	ZINC000450529238	ED	On-Demand	Anodyne	ICAM1	48	32
O=C(N[C@H](CO)C1CCOCC1)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450529282	FE	On-Demand	Anodyne	PRCP	22	48
O=C(N[C@@H](CO)C1CCOCC1)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450529283	FE	On-Demand	Anodyne	PRCP	22	48
COc1cccc2c1CCN(C(=O)Cc1ccc(OC)c(OC)c1Cl)C2	ZINC000450529300	GG	On-Demand	Anodyne	AKR1C3	16	47
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	CHRM2	37	41
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	VACHT_TETCF	0	46
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	HSD11B1	23	67
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	CCR1	39	40
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	SLC18A3	44	45
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	SLC9A1	42	40
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	AKR1C3	38	47
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	L3MBTL1	0	48
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	L3MBTL3	55	38
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	HPGD	37	42
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	GPR183	0	48
COc1ccc(C2CCN(C(=O)c3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529305	EG	On-Demand	Anodyne	SLC6A7	0	41
O=C(N[C@H](CO)C1CCOCC1)c1ccnc(OC(F)F)c1	ZINC000450529315	DD	On-Demand	Anodyne	MAPK1	45	35
O=C(N[C@@H](CO)C1CCOCC1)c1ccnc(OC(F)F)c1	ZINC000450529316	DD	On-Demand	Anodyne	MAPK1	45	35
CC[S@](=O)CC(=O)N[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450529332	GG	On-Demand	Anodyne	ENV	40	32
CC[S@](=O)CC(=O)N[C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450529333	GG	On-Demand	Anodyne	ENV	40	32
CC[S@](=O)CC(=O)N[C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450529334	GG	On-Demand	Anodyne	ENV	40	32
CC[S@](=O)CC(=O)N[C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450529335	GG	On-Demand	Anodyne	ENV	40	32
O=C(NC1CCCCC1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450529339	DF	On-Demand	Anodyne	EPHX2	28	45
O=C(NC1CCCCC1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450529340	DF	On-Demand	Anodyne	EPHX2	28	45
C[C@H](O)C(C)(C)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450529345	DG	On-Demand	Anodyne	MC3R	32	40
C[C@H](O)C(C)(C)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450529345	DG	On-Demand	Anodyne	MC5R	26	40
C[C@H](O)C(C)(C)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450529346	DG	On-Demand	Anodyne	MC3R	32	40
C[C@H](O)C(C)(C)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450529346	DG	On-Demand	Anodyne	MC5R	26	40
C[C@H](O)C(C)(C)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450529347	DG	On-Demand	Anodyne	MC3R	32	40
C[C@H](O)C(C)(C)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450529347	DG	On-Demand	Anodyne	MC5R	26	40
C[C@H](O)C(C)(C)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450529348	DG	On-Demand	Anodyne	MC3R	32	40
C[C@H](O)C(C)(C)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450529348	DG	On-Demand	Anodyne	MC5R	26	40
CN(C)S(=O)(=O)[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450529350	GE	On-Demand	Anodyne	PDE3A	46	35
CN(C)S(=O)(=O)[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450529350	GE	On-Demand	Anodyne	PDE3B	68	35
CN(C)S(=O)(=O)[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450529351	GE	On-Demand	Anodyne	PDE3A	46	35
CN(C)S(=O)(=O)[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450529351	GE	On-Demand	Anodyne	PDE3B	68	35
CC(=O)N[C@H](C(=O)N[C@H](CO)CC1CCCC1)C(C)(C)C	ZINC000450529362	CD	On-Demand	Anodyne	PDF	22	42
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529364	EI	On-Demand	Anodyne	HTR1A	17	42
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529364	EI	On-Demand	Anodyne	PTGIR	44	35
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529364	EI	On-Demand	Anodyne	CPT2	19	56
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529364	EI	On-Demand	Anodyne	PREP	19	41
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529364	EI	On-Demand	Anodyne	SSTR1	52	42
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529365	EI	On-Demand	Anodyne	HTR1A	17	42
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529365	EI	On-Demand	Anodyne	PTGIR	44	35
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529365	EI	On-Demand	Anodyne	CPT2	19	56
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529365	EI	On-Demand	Anodyne	PREP	19	41
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@H]1c1ccccc1)C2	ZINC000450529365	EI	On-Demand	Anodyne	SSTR1	52	42
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529366	EI	On-Demand	Anodyne	HTR1A	17	42
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529366	EI	On-Demand	Anodyne	PTGIR	44	35
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529366	EI	On-Demand	Anodyne	CPT2	19	56
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529366	EI	On-Demand	Anodyne	PREP	19	41
COc1cccc2c1CCN(C(=O)[C@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529366	EI	On-Demand	Anodyne	SSTR1	52	42
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529367	EI	On-Demand	Anodyne	HTR1A	17	42
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529367	EI	On-Demand	Anodyne	PTGIR	44	35
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529367	EI	On-Demand	Anodyne	CPT2	19	56
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529367	EI	On-Demand	Anodyne	PREP	19	41
COc1cccc2c1CCN(C(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C2	ZINC000450529367	EI	On-Demand	Anodyne	SSTR1	52	42
Cc1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc(C)c1OCC(=O)O	ZINC000450529368	GG	On-Demand	Anodyne	AVPR1A	21	45
CC(=O)N[C@H](C(=O)N[C@@H](CO)CC1CCCC1)C(C)(C)C	ZINC000450529369	CD	On-Demand	Anodyne	PDF	22	42
CCC[C@@H](OC)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529378	EG	On-Demand	Anodyne	RBP4	25	41
CCC[C@H](OC)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529379	EG	On-Demand	Anodyne	RBP4	25	41
CCC[C@@H](OC)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529380	EG	On-Demand	Anodyne	RBP4	25	41
CCC[C@H](OC)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529381	EG	On-Demand	Anodyne	RBP4	25	41
Cc1[nH]c(C#N)cc1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529387	FG	On-Demand	Mild	RBP4	69	38
Cc1[nH]c(C#N)cc1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529388	FG	On-Demand	Mild	RBP4	69	38
CNC(=O)[C@H]1CN(C(=O)Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450529394	EC	On-Demand	Anodyne	OPRK1	38	42
CNC(=O)[C@@H]1CN(C(=O)Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450529395	EC	On-Demand	Anodyne	OPRK1	38	42
Cc1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc(C)c1OCC(=O)O	ZINC000450529399	GG	On-Demand	Anodyne	AVPR1A	21	45
CCO[C@@H]1C[C@@](NC(=O)Cc2ccc(Cl)c(F)c2)(C(=O)O)C1(C)C	ZINC000450529412	FF	On-Demand	Anodyne	ENV	46	36
CCO[C@@H]1C[C@](NC(=O)Cc2ccc(Cl)c(F)c2)(C(=O)O)C1(C)C	ZINC000450529420	FF	On-Demand	Anodyne	ENV	46	36
CCO[C@H]1C[C@](NC(=O)Cc2ccc(Cl)c(F)c2)(C(=O)O)C1(C)C	ZINC000450529421	FF	On-Demand	Anodyne	ENV	46	36
CCO[C@H]1C[C@@](NC(=O)Cc2ccc(Cl)c(F)c2)(C(=O)O)C1(C)C	ZINC000450529422	FF	On-Demand	Anodyne	ENV	46	36
CCN(CC)CCCC1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC000450529428	EH	On-Demand	Anodyne	HRH4	15	56
CCN(CC)CCCC1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC000450529428	EH	On-Demand	Anodyne	AKR1C3	17	40
CC[C@@H](C(=O)OC)N1CCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450529431	ED	On-Demand	Bother	CACNA1C	45	32
CC[C@@H](C(=O)OC)N1CCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450529431	ED	On-Demand	Bother	CACNA1D	74	32
CC[C@H](C(=O)OC)N1CCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450529433	ED	On-Demand	Bother	CACNA1C	45	32
CC[C@H](C(=O)OC)N1CCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450529433	ED	On-Demand	Bother	CACNA1D	74	32
CCC[C@H](O)CN(C1CC1)[C@@H](C)c1ccccc1	ZINC000450529441	BG	On-Demand	Anodyne	AOC3	16	41
CCC[C@H](O)CN(C1CC1)[C@H](C)c1ccccc1	ZINC000450529443	BG	On-Demand	Anodyne	AOC3	16	41
CCC[C@@H](O)CN(C1CC1)[C@H](C)c1ccccc1	ZINC000450529444	BG	On-Demand	Anodyne	AOC3	16	41
CCC[C@@H](O)CN(C1CC1)[C@@H](C)c1ccccc1	ZINC000450529445	BG	On-Demand	Anodyne	AOC3	16	41
COCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450529458	DE	On-Demand	Anodyne	TYMS	40	33
COCC[C@@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450529458	DE	On-Demand	Anodyne	NPPA	40	31
COCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450529460	DE	On-Demand	Anodyne	TYMS	40	33
COCC[C@H](NC(=O)c1[nH]c2ccc(C)cc2c1C)C(=O)O	ZINC000450529460	DE	On-Demand	Anodyne	NPPA	40	31
CC[C@H](CC(F)(F)F)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529465	GJ	On-Demand	Anodyne	RBP4	83	41
CC[C@@H](CC(F)(F)F)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529467	GJ	On-Demand	Anodyne	RBP4	83	41
CC[C@H](CC(F)(F)F)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529469	GJ	On-Demand	Anodyne	RBP4	83	41
CC[C@@H](CC(F)(F)F)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529472	GJ	On-Demand	Anodyne	RBP4	83	41
COc1cc(CC(=O)N2Cc3ccccc3OC[C@H]2C)ccc1O	ZINC000450529489	EF	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N2Cc3ccccc3OC[C@@H]2C)ccc1O	ZINC000450529490	EF	On-Demand	Anodyne	TRPV1	0	40
Cc1ccc(C(=O)NC2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)s1	ZINC000450529491	FG	On-Demand	Anodyne	DRD4	16	41
Cc1ccc(C(=O)NC2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)s1	ZINC000450529492	FG	On-Demand	Anodyne	DRD4	16	41
Cc1ccc(C(=O)NC2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)s1	ZINC000450529493	FG	On-Demand	Anodyne	DRD4	16	41
Cc1ccc(C(=O)NC2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)s1	ZINC000450529494	FG	On-Demand	Anodyne	DRD4	16	41
Cc1nc(NC[C@H]2CCCCN2S(=O)(=O)N(C)C)ncc1[N+](=O)[O-]	ZINC000450529495	FC	On-Demand	Bother	PRKCQ	45	36
Cc1nc(NC[C@@H]2CCCCN2S(=O)(=O)N(C)C)ncc1[N+](=O)[O-]	ZINC000450529496	FC	On-Demand	Bother	PRKCQ	45	36
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529497	FF	On-Demand	Anodyne	CARM1	44	33
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529497	FF	On-Demand	Anodyne	PDS	40	33
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529498	FF	On-Demand	Anodyne	CARM1	44	33
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450529498	FF	On-Demand	Anodyne	PDS	40	33
COc1cccc2c1CCN(C(=O)c1cc3c([nH]1)CCCC3)C2	ZINC000450529508	DG	On-Demand	Anodyne	HRH4	22	54
COc1cccc2c1CCN(C(=O)c1cc3c([nH]1)CCCC3)C2	ZINC000450529508	DG	On-Demand	Anodyne	AKR1C3	16	47
CC(=O)NCC[C@H]1CCCN(c2nc3cccc(F)c3s2)C1	ZINC000450529533	DG	On-Demand	Anodyne	SIRT3	54	35
CC(=O)NCC[C@H]1CCCN(c2nc3cccc(F)c3s2)C1	ZINC000450529533	DG	On-Demand	Anodyne	SIRT2	54	35
CC(=O)NCC[C@H]1CCCN(c2nc3cccc(F)c3s2)C1	ZINC000450529533	DG	On-Demand	Anodyne	SIRT1	54	35
CC(=O)NCC[C@@H]1CCCN(c2nc3cccc(F)c3s2)C1	ZINC000450529534	DG	On-Demand	Anodyne	SIRT3	54	35
CC(=O)NCC[C@@H]1CCCN(c2nc3cccc(F)c3s2)C1	ZINC000450529534	DG	On-Demand	Anodyne	SIRT2	54	35
CC(=O)NCC[C@@H]1CCCN(c2nc3cccc(F)c3s2)C1	ZINC000450529534	DG	On-Demand	Anodyne	SIRT1	54	35
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	F2	15	41
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	PLG	18	40
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	F10	26	41
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	PRSS2	46	33
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	SIGMAR1	20	41
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	TRY2_BOVIN	51	39
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	CCR1	42	44
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	CCR3	24	43
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	GHSR	0	41
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	CCR2	18	45
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	NS5B	0	42
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	ST14	42	36
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	MCHR1	22	43
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	AKR1C3	28	43
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	ETHR	51	42
COc1ccc(C2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)cc1	ZINC000450529539	FG	On-Demand	Anodyne	GPR183	0	49
CC(C)(C)Oc1c(F)cc(NC(=O)CCc2nc3cnccc3[nH]2)cc1F	ZINC000450529543	FH	On-Demand	Anodyne	ENPP1	40	32
COc1ccc(-c2ccnc(NCC(C)(C)CCC#N)n2)cc1	ZINC000450529545	DH	On-Demand	Mild	CLK4	22	52
COc1cccc2c1CCN(C(=O)C1(C(=O)C3CC3)CC1)C2	ZINC000450529547	CE	On-Demand	Anodyne	SSTR2	43	38
CCN(CC)CCCC1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450529548	FH	On-Demand	Anodyne	P2RY12	51	34
CCN(CC)CCCC1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450529548	FH	On-Demand	Anodyne	AMY2	40	36
CCN(CC)CCCC1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450529549	FH	On-Demand	Anodyne	P2RY12	51	34
CCN(CC)CCCC1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450529549	FH	On-Demand	Anodyne	AMY2	40	36
CCc1cccc(C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)n1	ZINC000450529559	ED	On-Demand	Anodyne	MMP13	20	41
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	HTR1A	66	71
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	DRD2	66	71
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	DRD1	33	55
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	DRD4	55	71
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	ADRA1D	26	50
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	HTR2A	52	71
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	HTR2C	27	50
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	ADRA1A	24	50
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	DRD3	43	71
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	ERG2	23	50
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	HTR7	59	50
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	SIGMAR1	18	71
NC(=O)c1cccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450529560	FE	On-Demand	Anodyne	CYP2J2	51	36
CCOC(=O)c1ccc(N2CCCN(CCCc3cc(CC)no3)CC2)nc1	ZINC000450529598	GF	On-Demand	Anodyne	DRD4	20	40
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)s3)CC2)cc1	ZINC000450529599	EG	On-Demand	Anodyne	SLC18A3	22	44
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)s3)CC2)cc1	ZINC000450529599	EG	On-Demand	Anodyne	L3MBTL1	0	47
COc1ccc(C2CCN(C(=O)c3ccc(C(=O)O)s3)CC2)cc1	ZINC000450529599	EG	On-Demand	Anodyne	TRPC6	24	40
O=[N+]([O-])c1ccc2c(NC[C@H]3CCC[C@@H](CO)C3)nccc2c1	ZINC000450529609	DF	On-Demand	Bother	PRKCQ	41	39
O=C(O)c1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc([N+](=O)[O-])c1	ZINC000450529627	FF	On-Demand	Bother	AVPR1A	17	44
O=C(O)c1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc([N+](=O)[O-])c1	ZINC000450529628	FF	On-Demand	Bother	AVPR1A	17	44
CNC(=O)[C@@H]1CN(C(=O)c2cc(-c3ccccc3)nn2C)CCO1	ZINC000450529639	EC	On-Demand	Anodyne	INHA	42	31
CNC(=O)[C@H]1CN(C(=O)c2cc(-c3ccccc3)nn2C)CCO1	ZINC000450529640	EC	On-Demand	Anodyne	INHA	42	31
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450529671	FG	On-Demand	Anodyne	SIGMAR1	17	56
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450529671	FG	On-Demand	Anodyne	EPHX2	32	49
O=C(NC1CCCCC1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450529671	FG	On-Demand	Anodyne	HPGDS	33	44
Cc1nc(N[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)ncc1[N+](=O)[O-]	ZINC000450529672	FI	On-Demand	Bother	PRKCQ	44	39
Cc1nc(N[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)ncc1[N+](=O)[O-]	ZINC000450529673	FI	On-Demand	Bother	PRKCQ	44	39
CCn1nnc(C)c1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529682	FF	On-Demand	Anodyne	RBP4	67	38
CCn1nnc(C)c1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529683	FF	On-Demand	Anodyne	RBP4	67	38
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	DRD2	22	43
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	DRD4	36	49
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	ACHE	16	46
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	HRH2	20	41
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	DRD3	0	49
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	OPRK1	32	42
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	HTR4	59	43
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	CHRM3	15	41
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	HRH3	16	41
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	SIGMAR1	35	61
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	SSTR5	77	43
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	CCR3	48	42
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	UTS2R	22	41
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	EPHX2	36	48
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	PDK1	49	39
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	CXCR3	34	42
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	MCHR1	59	52
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	CACNA1G	35	41
COC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1Cl	ZINC000450529685	GH	On-Demand	Anodyne	CCR8	16	42
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	MME	23	42
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	TACR2	0	41
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	CCKAR	59	43
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	NMBR	67	33
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	MMP14	73	38
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	GRPR	61	33
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	ECE1	51	42
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	MMP11	62	31
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	CCKBR	53	43
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	GHSR	65	44
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	MC1R	54	38
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	NPR	30	40
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	SSSIM	26	40
C[C@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529692	DF	On-Demand	Anodyne	SLC15A2	0	48
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	MME	23	42
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	TACR2	0	41
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	CCKAR	59	43
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	NMBR	67	33
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	MMP14	73	38
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	GRPR	61	33
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	ECE1	51	42
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	MMP11	62	31
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	CCKBR	53	43
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	GHSR	65	44
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	MC1R	54	38
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	NPR	30	40
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	SSSIM	26	40
C[C@@]1(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529693	DF	On-Demand	Anodyne	SLC15A2	0	48
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	MME	23	42
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	TACR2	0	41
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	CCKAR	59	43
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	NMBR	67	33
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	MMP14	73	38
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	GRPR	61	33
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	ECE1	51	42
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	MMP11	62	31
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	CCKBR	53	43
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	GHSR	65	44
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	MC1R	54	38
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	NPR	30	40
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	SSSIM	26	40
C[C@@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529694	DF	On-Demand	Anodyne	SLC15A2	0	48
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	MME	23	42
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	TACR2	0	41
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	CCKAR	59	43
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	NMBR	67	33
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	MMP14	73	38
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	GRPR	61	33
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	ECE1	51	42
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	MMP11	62	31
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	CCKBR	53	43
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	GHSR	65	44
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	MC1R	54	38
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	NPR	30	40
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	SSSIM	26	40
C[C@]1(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CC=CCC1	ZINC000450529695	DF	On-Demand	Anodyne	SLC15A2	0	48
Cn1nc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c2c1CCCC2	ZINC000450529705	GH	On-Demand	Anodyne	RBP4	84	45
Cn1nc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c2c1CCCC2	ZINC000450529706	GH	On-Demand	Anodyne	RBP4	84	45
CCOC(=O)[C@@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529707	CD	On-Demand	Anodyne	KLK3	53	36
CCOC(=O)[C@@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529707	CD	On-Demand	Anodyne	MMP8	23	41
CCOC(=O)[C@@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529707	CD	On-Demand	Anodyne	CAPN2	53	35
CCOC(=O)[C@@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529707	CD	On-Demand	Anodyne	NPR	29	50
CCOC(=O)[C@@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529707	CD	On-Demand	Anodyne	SLC15A2	0	42
CCOC(=O)[C@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529708	CD	On-Demand	Anodyne	KLK3	53	36
CCOC(=O)[C@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529708	CD	On-Demand	Anodyne	MMP8	23	41
CCOC(=O)[C@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529708	CD	On-Demand	Anodyne	CAPN2	53	35
CCOC(=O)[C@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529708	CD	On-Demand	Anodyne	NPR	29	50
CCOC(=O)[C@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450529708	CD	On-Demand	Anodyne	SLC15A2	0	42
C[C@@H](O)C(C)(C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450529709	EF	On-Demand	Anodyne	PYK	28	40
C[C@H](O)C(C)(C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450529710	EF	On-Demand	Anodyne	PYK	28	40
Cc1cccc(Cl)c1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450529717	EI	On-Demand	Anodyne	CNR1	22	41
Cc1cccc(Cl)c1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450529717	EI	On-Demand	Anodyne	DRD4	29	45
Cc1cccc(Cl)c1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450529717	EI	On-Demand	Anodyne	DRD3	15	52
Cc1cccc(Cl)c1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450529717	EI	On-Demand	Anodyne	CNR2	18	41
Cc1cccc(Cl)c1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450529717	EI	On-Demand	Anodyne	SIGMAR1	24	58
Cc1cccc(Cl)c1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450529717	EI	On-Demand	Anodyne	EPHX2	45	62
Cc1cccc(Cl)c1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450529717	EI	On-Demand	Anodyne	PTGES	33	41
CC(C)OC(C)(C)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529723	FH	On-Demand	Anodyne	RBP4	75	41
CC(C)OC(C)(C)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529724	FH	On-Demand	Anodyne	RBP4	75	41
CCC[C@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)OCC	ZINC000450529725	CD	On-Demand	Anodyne	KLK3	65	36
CCC[C@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)OCC	ZINC000450529725	CD	On-Demand	Anodyne	CAPN2	61	38
CCC[C@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)OCC	ZINC000450529725	CD	On-Demand	Anodyne	NPR	27	47
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)C(=O)OCC	ZINC000450529726	CD	On-Demand	Anodyne	KLK3	65	36
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)C(=O)OCC	ZINC000450529726	CD	On-Demand	Anodyne	CAPN2	61	38
CCC[C@@H](CC(C)C)C(=O)N[C@H](CO)C(=O)OCC	ZINC000450529726	CD	On-Demand	Anodyne	NPR	27	47
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)OCC	ZINC000450529727	CD	On-Demand	Anodyne	KLK3	65	36
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)OCC	ZINC000450529727	CD	On-Demand	Anodyne	CAPN2	61	38
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)OCC	ZINC000450529727	CD	On-Demand	Anodyne	NPR	27	47
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)C(=O)OCC	ZINC000450529728	CD	On-Demand	Anodyne	KLK3	65	36
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)C(=O)OCC	ZINC000450529728	CD	On-Demand	Anodyne	CAPN2	61	38
CCC[C@H](CC(C)C)C(=O)N[C@H](CO)C(=O)OCC	ZINC000450529728	CD	On-Demand	Anodyne	NPR	27	47
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450529729	DE	On-Demand	Anodyne	Q9NBD4_PLAFA	0	44
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450529729	DE	On-Demand	Anodyne	GPR88	0	42
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450529730	DE	On-Demand	Anodyne	Q9NBD4_PLAFA	0	44
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450529730	DE	On-Demand	Anodyne	GPR88	0	42
CCc1cccc(C(=O)Nc2cccc(N(C)C)n2)n1	ZINC000450529736	CE	On-Demand	Anodyne	PDE5A	23	47
COc1ccc(C[C@@](C)(O)CNc2nccc3c(OC)cccc23)cc1OC	ZINC000450529739	GH	On-Demand	Anodyne	Q9XSW7_PIG	0	40
COc1ccc(C[C@](C)(O)CNc2nccc3c(OC)cccc23)cc1OC	ZINC000450529740	GH	On-Demand	Anodyne	Q9XSW7_PIG	0	40
C[C@H]1Cc2ccccc2CN1C(=O)CCc1ccccc1C(=O)O	ZINC000450529743	DG	On-Demand	Anodyne	PREP	33	44
C[C@@H]1Cc2ccccc2CN1C(=O)CCc1ccccc1C(=O)O	ZINC000450529744	DG	On-Demand	Anodyne	PREP	33	44
C[C@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529752	EC	On-Demand	Anodyne	CA2	26	40
C[C@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529752	EC	On-Demand	Anodyne	CA1	25	47
C[C@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529752	EC	On-Demand	Anodyne	CA4	23	40
C[C@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529752	EC	On-Demand	Anodyne	F7	29	42
C[C@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529752	EC	On-Demand	Anodyne	NCE103	30	47
C[C@@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529753	EC	On-Demand	Anodyne	CA2	26	40
C[C@@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529753	EC	On-Demand	Anodyne	CA1	25	47
C[C@@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529753	EC	On-Demand	Anodyne	CA4	23	40
C[C@@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529753	EC	On-Demand	Anodyne	F7	29	42
C[C@@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)S(N)(=O)=O	ZINC000450529753	EC	On-Demand	Anodyne	NCE103	30	47
Cc1cc2c(Br)ccnc2cc1NCCCn1cc(CO)nn1	ZINC000450529754	GF	On-Demand	Anodyne	HRP1_PLAFA	67	34
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	ACHE	22	40
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	LTA4H	18	42
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	CASR	35	47
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	SIGMAR1	35	41
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	CCKAR	0	40
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	CCR3	65	57
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	CCR5	30	43
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	TACR3	23	43
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	MCHR1	85	46
CN(CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450529755	GG	On-Demand	Mild	CACNA1G	39	40
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccccc1C(=O)O	ZINC000450529761	EH	On-Demand	Anodyne	FABP4	40	34
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccccc1C(=O)O	ZINC000450529761	EH	On-Demand	Anodyne	SLC18A3	51	38
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccccc1C(=O)O	ZINC000450529762	EH	On-Demand	Anodyne	FABP4	40	34
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccccc1C(=O)O	ZINC000450529762	EH	On-Demand	Anodyne	SLC18A3	51	38
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccccc1C(=O)O	ZINC000450529763	EH	On-Demand	Anodyne	FABP4	40	34
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccccc1C(=O)O	ZINC000450529763	EH	On-Demand	Anodyne	SLC18A3	51	38
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccccc1C(=O)O	ZINC000450529764	EH	On-Demand	Anodyne	FABP4	40	34
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccccc1C(=O)O	ZINC000450529764	EH	On-Demand	Anodyne	SLC18A3	51	38
CCOC(=O)c1cc(C(=O)Nc2ccc(OCCO)c(C)c2)[nH]c1C	ZINC000450529768	EE	On-Demand	Anodyne	ENPP1	41	32
CCOC(=O)c1csc(N2C[C@@H](CO)[C@H](c3ccc(Cl)cc3)C2)n1	ZINC000450529771	FG	On-Demand	Anodyne	SLC6A1	44	43
COC(=O)c1ccc(CC(=O)Nc2ccc(OCCO)c(C)c2)cc1	ZINC000450529786	EE	On-Demand	Anodyne	ENPP1	41	31
Cc1nc(C(=O)N2Cc3ccccc3C[C@H]2C)ccc1C(=O)O	ZINC000450529787	DF	On-Demand	Anodyne	BCL2	27	49
Cc1nc(C(=O)N2Cc3ccccc3C[C@@H]2C)ccc1C(=O)O	ZINC000450529788	DF	On-Demand	Anodyne	BCL2	27	49
COc1ccc(-c2noc(N(C)CCn3cc(Br)cn3)n2)cc1	ZINC000450529792	GF	On-Demand	Anodyne	LUCI_PHOPE	15	40
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	CYSLTR1	42	34
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	COLA	88	41
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	CPT1A	85	41
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	CPT2	52	40
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	CPT1B	72	40
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	SCD1	40	41
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	SCD	31	41
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	ENPP1	61	35
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	KCNK3	56	37
COc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)cc1S(C)(=O)=O	ZINC000450529796	GE	On-Demand	Anodyne	KCNK9	53	37
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(OCC(=O)O)c2)C1	ZINC000450529797	EF	On-Demand	Anodyne	TACR1	26	44
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(OCC(=O)O)c2)C1	ZINC000450529797	EF	On-Demand	Anodyne	FABP4	47	38
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(OCC(=O)O)c2)C1	ZINC000450529797	EF	On-Demand	Anodyne	SCN5A	35	41
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(OCC(=O)O)c2)C1	ZINC000450529798	EF	On-Demand	Anodyne	TACR1	26	44
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(OCC(=O)O)c2)C1	ZINC000450529798	EF	On-Demand	Anodyne	FABP4	47	38
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(OCC(=O)O)c2)C1	ZINC000450529798	EF	On-Demand	Anodyne	SCN5A	35	41
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529799	DF	On-Demand	Anodyne	OPRM1	27	42
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529799	DF	On-Demand	Anodyne	AGTR2	74	38
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529799	DF	On-Demand	Anodyne	PREP	29	51
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529799	DF	On-Demand	Anodyne	ADAM9	43	34
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529799	DF	On-Demand	Anodyne	NOD2	42	37
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529800	DF	On-Demand	Anodyne	OPRM1	27	42
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529800	DF	On-Demand	Anodyne	AGTR2	74	38
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529800	DF	On-Demand	Anodyne	PREP	29	51
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529800	DF	On-Demand	Anodyne	ADAM9	43	34
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450529800	DF	On-Demand	Anodyne	NOD2	42	37
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529804	DG	On-Demand	Anodyne	RARA	44	37
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529804	DG	On-Demand	Anodyne	RARG	41	33
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529804	DG	On-Demand	Anodyne	RXRG	58	36
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529804	DG	On-Demand	Anodyne	RXRA	41	36
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529804	DG	On-Demand	Anodyne	RXRB	63	38
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529804	DG	On-Demand	Anodyne	EPHX2	16	46
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529804	DG	On-Demand	Anodyne	AKR1C3	49	35
C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529804	DG	On-Demand	Anodyne	L3MBTL1	0	40
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529805	DG	On-Demand	Anodyne	RARA	44	37
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529805	DG	On-Demand	Anodyne	RARG	41	33
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529805	DG	On-Demand	Anodyne	RXRG	58	36
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529805	DG	On-Demand	Anodyne	RXRA	41	36
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529805	DG	On-Demand	Anodyne	RXRB	63	38
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529805	DG	On-Demand	Anodyne	EPHX2	16	46
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529805	DG	On-Demand	Anodyne	AKR1C3	49	35
C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(C(=O)O)c2)C1	ZINC000450529805	DG	On-Demand	Anodyne	L3MBTL1	0	40
COc1cccc2c(N3CCC(F)(F)[C@H](C)C3)nccc12	ZINC000450529807	CH	On-Demand	Anodyne	PDE3B	62	34
COc1cccc2c(N3CCC(F)(F)[C@@H](C)C3)nccc12	ZINC000450529808	CH	On-Demand	Anodyne	PDE3B	62	34
OC[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccc(Cl)cc1	ZINC000450529827	EG	On-Demand	Anodyne	SLC6A1	49	44
CCCOc1ccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)c(OC)c1	ZINC000450529832	EF	On-Demand	Anodyne	COLA	88	38
CCCOc1ccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)c(OC)c1	ZINC000450529832	EF	On-Demand	Anodyne	CPT1A	82	38
CCCOc1ccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)c(OC)c1	ZINC000450529833	EF	On-Demand	Anodyne	COLA	88	38
CCCOc1ccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)c(OC)c1	ZINC000450529833	EF	On-Demand	Anodyne	CPT1A	82	38
O=C(Nc1ccc(O)cc1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450529834	EH	On-Demand	Anodyne	MAPK1	32	42
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	HTR1A	16	52
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	DRD4	24	40
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	ACHE	15	41
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	HRH2	29	49
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	P2RY12	15	47
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	CHRM3	16	44
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	SIGMAR1	19	44
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	CCR3	31	43
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	PYGL	0	51
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	FAAH	35	68
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	CXCR3	29	42
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	MCHR1	32	41
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	MGLL	0	42
CC(=O)c1cccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)c1	ZINC000450529836	GI	On-Demand	Anodyne	P2RY14	45	35
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H](C(=O)O)CC3)CC2)cc1	ZINC000450529856	EG	On-Demand	Anodyne	CHRM2	28	47
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H](C(=O)O)CC3)CC2)cc1	ZINC000450529856	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H](C(=O)O)CC3)CC2)cc1	ZINC000450529856	EG	On-Demand	Anodyne	SLC6A11	0	41
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H](C(=O)O)CC3)CC2)cc1	ZINC000450529856	EG	On-Demand	Anodyne	NPBWR1	57	31
COc1ccc(C2CCN(C(=O)C3CCC(C(=O)O)CC3)CC2)cc1	ZINC000450529857	EG	On-Demand	Anodyne	CHRM2	28	47
COc1ccc(C2CCN(C(=O)C3CCC(C(=O)O)CC3)CC2)cc1	ZINC000450529857	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
COc1ccc(C2CCN(C(=O)C3CCC(C(=O)O)CC3)CC2)cc1	ZINC000450529857	EG	On-Demand	Anodyne	SLC6A11	0	41
COc1ccc(C2CCN(C(=O)C3CCC(C(=O)O)CC3)CC2)cc1	ZINC000450529857	EG	On-Demand	Anodyne	NPBWR1	57	31
COc1ccc(C2CCN(C(=O)c3cc(C(=O)O)co3)CC2)cc1	ZINC000450529858	EG	On-Demand	Anodyne	SLC9A1	42	34
COc1ccc(-c2ccnc(N3CCC[C@@H](CCNC(C)=O)C3)n2)cc1	ZINC000450529870	FF	On-Demand	Anodyne	GPBAR1	0	40
COc1ccc(-c2ccnc(N3CCC[C@@H](CCNC(C)=O)C3)n2)cc1	ZINC000450529870	FF	On-Demand	Anodyne	DKK1	0	53
COc1ccc(-c2ccnc(N3CCC[C@H](CCNC(C)=O)C3)n2)cc1	ZINC000450529871	FF	On-Demand	Anodyne	GPBAR1	0	40
COc1ccc(-c2ccnc(N3CCC[C@H](CCNC(C)=O)C3)n2)cc1	ZINC000450529871	FF	On-Demand	Anodyne	DKK1	0	53
O=C(O)c1cccc(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450529887	EF	On-Demand	Anodyne	AKR1C3	45	37
O=C(O)c1cccc(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450529888	EF	On-Demand	Anodyne	AKR1C3	45	37
CCN(CC)CCCC1CCN(C(=O)CCCC(C)C)CC1	ZINC000450529895	DI	On-Demand	Anodyne	GNAI1	0	45
CCN(CC)CCCC1CCN(C(=O)CCCC(C)C)CC1	ZINC000450529895	DI	On-Demand	Anodyne	GNAI3	0	47
CCN(CC)CCCC1CCN(C(=O)CCCC(C)C)CC1	ZINC000450529895	DI	On-Demand	Anodyne	GNAO1	0	45
CCN(CC)CCCC1CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450529906	FI	On-Demand	Anodyne	L3MBTL1	0	40
CCN(CC)CCCC1CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450529906	FI	On-Demand	Anodyne	L3MBTL3	53	40
COC[C@]1(C(=O)N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)CCOC1	ZINC000450529910	FF	On-Demand	Anodyne	CCR2	33	40
COC[C@]1(C(=O)N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)CCOC1	ZINC000450529911	FF	On-Demand	Anodyne	CCR2	33	40
COC[C@@]1(C(=O)N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)CCOC1	ZINC000450529912	FF	On-Demand	Anodyne	CCR2	33	40
COC[C@@]1(C(=O)N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)CCOC1	ZINC000450529913	FF	On-Demand	Anodyne	CCR2	33	40
Brc1ccc2c(NCC3=CCCOC3)ncnc2c1	ZINC000450529914	DF	On-Demand	Anodyne	EGFR	41	36
Brc1ccc2c(NCC3=CCCOC3)ncnc2c1	ZINC000450529914	DF	On-Demand	Anodyne	CLK4	58	35
COc1cccc2c1CCN(C(=O)c1cccc3c1O[C@H](C)C3)C2	ZINC000450529915	DG	On-Demand	Anodyne	SSTR1	46	34
COc1cccc2c1CCN(C(=O)c1cccc3c1O[C@@H](C)C3)C2	ZINC000450529916	DG	On-Demand	Anodyne	SSTR1	46	34
O=C(Nc1cccc(Cl)c1)N1CCCN(CC2CC(F)(F)C2)CC1	ZINC000450529918	FH	On-Demand	Anodyne	CACNA1H	47	38
O=C(Nc1cccc(Cl)c1)N1CCCN(CC2CC(F)(F)C2)CC1	ZINC000450529918	FH	On-Demand	Anodyne	CCR3	16	42
O=C(Nc1cccc(Cl)c1)N1CCCN(CC2CC(F)(F)C2)CC1	ZINC000450529918	FH	On-Demand	Anodyne	PYGL	0	49
O=C(Nc1cccc(Cl)c1)N1CCCN(CC2CC(F)(F)C2)CC1	ZINC000450529918	FH	On-Demand	Anodyne	FAAH	17	41
O=C(Nc1cccc(Cl)c1)N1CCCN(CC2CC(F)(F)C2)CC1	ZINC000450529918	FH	On-Demand	Anodyne	EPHX2	25	41
CCC[C@@H](CC(C)C)C(=O)N1CCc2c(cccc2OC)C1	ZINC000450529927	DI	On-Demand	Anodyne	AGTR2	58	32
CCC[C@@H](CC(C)C)C(=O)N1CCc2c(cccc2OC)C1	ZINC000450529927	DI	On-Demand	Anodyne	SSTR1	41	32
CCC[C@H](CC(C)C)C(=O)N1CCc2c(cccc2OC)C1	ZINC000450529928	DI	On-Demand	Anodyne	AGTR2	58	32
CCC[C@H](CC(C)C)C(=O)N1CCc2c(cccc2OC)C1	ZINC000450529928	DI	On-Demand	Anodyne	SSTR1	47	39
COc1cc(CC(=O)N[C@@H](CO)C2CCOCC2)ccc1Cl	ZINC000450529935	ED	On-Demand	Anodyne	NCE103	24	40
COc1cc(CC(=O)N[C@@H](CO)C2CCOCC2)ccc1Cl	ZINC000450529935	ED	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@H](CO)C2CCOCC2)ccc1Cl	ZINC000450529936	ED	On-Demand	Anodyne	NCE103	24	40
COc1cc(CC(=O)N[C@H](CO)C2CCOCC2)ccc1Cl	ZINC000450529936	ED	On-Demand	Anodyne	CAN2	0	40
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529941	FH	On-Demand	Anodyne	PTGIR	41	36
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529941	FH	On-Demand	Anodyne	FABP4	45	36
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529941	FH	On-Demand	Anodyne	CCR5	41	33
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529941	FH	On-Demand	Anodyne	COLA	98	39
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529941	FH	On-Demand	Anodyne	CPT1A	87	39
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529941	FH	On-Demand	Anodyne	CFTR	40	37
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529942	FH	On-Demand	Anodyne	PTGIR	41	36
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529942	FH	On-Demand	Anodyne	FABP4	45	36
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529942	FH	On-Demand	Anodyne	CCR5	41	33
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529942	FH	On-Demand	Anodyne	COLA	98	39
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529942	FH	On-Demand	Anodyne	CPT1A	87	39
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529942	FH	On-Demand	Anodyne	CFTR	40	37
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529943	FH	On-Demand	Anodyne	PTGIR	41	36
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529943	FH	On-Demand	Anodyne	FABP4	45	36
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529943	FH	On-Demand	Anodyne	CCR5	41	33
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529943	FH	On-Demand	Anodyne	COLA	98	39
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529943	FH	On-Demand	Anodyne	CPT1A	87	39
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529943	FH	On-Demand	Anodyne	CFTR	40	37
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529944	FH	On-Demand	Anodyne	PTGIR	41	36
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529944	FH	On-Demand	Anodyne	FABP4	45	36
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529944	FH	On-Demand	Anodyne	CCR5	41	33
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529944	FH	On-Demand	Anodyne	COLA	98	39
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529944	FH	On-Demand	Anodyne	CPT1A	87	39
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450529944	FH	On-Demand	Anodyne	CFTR	40	37
CCOC(=O)C(C)(C)C1CCN(c2nc3c(cc2C#N)COCC3)CC1	ZINC000450529949	FF	On-Demand	Mild	P2RY12	40	41
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529957	GG	On-Demand	Anodyne	RBP4	81	39
C[C@@H](Oc1ccccn1)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529959	GG	On-Demand	Anodyne	RBP4	81	39
C[C@@H](Oc1ccccn1)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529961	GG	On-Demand	Anodyne	RBP4	81	39
C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450529963	GG	On-Demand	Anodyne	RBP4	81	39
CCOc1cc(C(=O)N[C@@H]2CCOC2)ccc1OCC(=O)O	ZINC000450529964	DD	On-Demand	Anodyne	SSTR5	51	41
CCOc1cc(C(=O)N[C@H]2CCOC2)ccc1OCC(=O)O	ZINC000450529966	DD	On-Demand	Anodyne	SSTR5	51	41
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)s1	ZINC000450529968	EH	On-Demand	Anodyne	SLC18A3	44	39
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)s1	ZINC000450529969	EH	On-Demand	Anodyne	SLC18A3	44	39
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)s1	ZINC000450529970	EH	On-Demand	Anodyne	SLC18A3	44	39
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)s1	ZINC000450529971	EH	On-Demand	Anodyne	SLC18A3	44	39
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529983	EH	On-Demand	Anodyne	GRM3	15	43
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529983	EH	On-Demand	Anodyne	SIGMAR1	21	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529983	EH	On-Demand	Anodyne	CCR5	15	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529983	EH	On-Demand	Anodyne	ITGA4	41	34
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529983	EH	On-Demand	Anodyne	SLC18A3	53	36
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529985	EH	On-Demand	Anodyne	GRM3	15	43
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529985	EH	On-Demand	Anodyne	SIGMAR1	21	40
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529985	EH	On-Demand	Anodyne	CCR5	15	40
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529985	EH	On-Demand	Anodyne	ITGA4	41	34
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529985	EH	On-Demand	Anodyne	SLC18A3	53	36
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529986	EH	On-Demand	Anodyne	GRM3	15	43
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529986	EH	On-Demand	Anodyne	SIGMAR1	21	40
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529986	EH	On-Demand	Anodyne	CCR5	15	40
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529986	EH	On-Demand	Anodyne	ITGA4	41	34
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529986	EH	On-Demand	Anodyne	SLC18A3	53	36
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529987	EH	On-Demand	Anodyne	GRM3	15	43
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529987	EH	On-Demand	Anodyne	SIGMAR1	21	40
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529987	EH	On-Demand	Anodyne	CCR5	15	40
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529987	EH	On-Demand	Anodyne	ITGA4	41	34
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450529987	EH	On-Demand	Anodyne	SLC18A3	53	36
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	DRD2	33	51
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	FKBP1A	39	41
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	CNR1	21	40
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	DRD4	55	52
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	ACHE	31	49
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	HRH2	25	43
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	HRH1	22	51
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	DRD3	29	52
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	HTR3A	0	48
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	KCNH2	18	41
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	HTR4	76	48
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	CHRM3	17	42
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	LTA4H	18	41
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	CNR2	19	40
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	HRH3	24	46
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	SIGMAR1	44	69
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	SSTR5	93	51
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	CCR1	30	42
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	CCR3	54	43
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	BDKRB1	44	40
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	UTS2R	33	46
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	EPHX2	48	54
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	PDK1	50	39
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	MCHR1	62	53
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	STK17B	43	36
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	CACNA1G	43	52
COc1cc(CN2CCC(C(=O)NC3CCCCC3)CC2)ccc1Cl	ZINC000450529989	FI	On-Demand	Anodyne	CCR8	24	45
Cc1ccc(C(=O)N2CCC(CCCO)CC2)c2c1CCC2	ZINC000450529997	DG	On-Demand	Anodyne	AKR1C3	0	48
Cc1ccc(C(=O)N2CCC(CCCO)CC2)c2c1CCC2	ZINC000450529997	DG	On-Demand	Anodyne	L3MBTL3	69	39
Cc1sccc1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450529999	FI	On-Demand	Anodyne	RBP4	92	48
Cc1sccc1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450530000	FI	On-Demand	Anodyne	RBP4	92	48
CC(C)(C)CCC1(O)CC(C(=O)N2CCCC[C@H]2c2nc[nH]n2)C1	ZINC000450530012	EF	On-Demand	Anodyne	COLA	64	33
CC(C)(C)CCC1(O)CC(C(=O)N2CCCC[C@H]2c2nc[nH]n2)C1	ZINC000450530012	EF	On-Demand	Anodyne	CPT1A	56	33
CC(C)(C)CCC1(O)CC(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)C1	ZINC000450530014	EF	On-Demand	Anodyne	COLA	64	33
CC(C)(C)CCC1(O)CC(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)C1	ZINC000450530014	EF	On-Demand	Anodyne	CPT1A	56	33
CCCN(Cc1cn(CC2CC2)nn1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450530018	EF	On-Demand	Anodyne	TIMP3	40	30
CCCN(Cc1cn(CC2CC2)nn1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450530019	EF	On-Demand	Anodyne	TIMP3	40	30
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530020	GH	On-Demand	Anodyne	HRH3	28	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530020	GH	On-Demand	Anodyne	SFRP1	63	33
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530020	GH	On-Demand	Anodyne	WNT3	57	31
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530021	GH	On-Demand	Anodyne	HRH3	28	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530021	GH	On-Demand	Anodyne	SFRP1	63	33
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530021	GH	On-Demand	Anodyne	WNT3	57	31
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530022	GH	On-Demand	Anodyne	HRH3	28	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530022	GH	On-Demand	Anodyne	SFRP1	63	33
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530022	GH	On-Demand	Anodyne	WNT3	57	31
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530023	GH	On-Demand	Anodyne	HRH3	28	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530023	GH	On-Demand	Anodyne	SFRP1	63	33
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450530023	GH	On-Demand	Anodyne	WNT3	57	31
C[C@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530025	DG	On-Demand	Anodyne	RARA	46	34
C[C@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530025	DG	On-Demand	Anodyne	SRD5A2	24	41
C[C@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530025	DG	On-Demand	Anodyne	RARG	51	39
C[C@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530025	DG	On-Demand	Anodyne	RXRG	66	42
C[C@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530025	DG	On-Demand	Anodyne	RARB	49	39
C[C@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530025	DG	On-Demand	Anodyne	RXRA	53	42
C[C@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530025	DG	On-Demand	Anodyne	RXRB	67	40
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530026	DG	On-Demand	Anodyne	RARA	46	34
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530026	DG	On-Demand	Anodyne	SRD5A2	24	41
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530026	DG	On-Demand	Anodyne	RARG	51	39
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530026	DG	On-Demand	Anodyne	RXRG	66	42
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530026	DG	On-Demand	Anodyne	RARB	49	39
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530026	DG	On-Demand	Anodyne	RXRA	53	42
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2ccc(C(=O)O)cc2)C1	ZINC000450530026	DG	On-Demand	Anodyne	RXRB	67	40
O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N1CCOCC2(CC2)C1	ZINC000450530029	FG	On-Demand	Anodyne	PRCP	19	52
Cc1ccc(F)c(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000450530030	DF	On-Demand	Anodyne	COLA	120	43
Cc1ccc(F)c(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000450530030	DF	On-Demand	Anodyne	CPT1A	105	43
O=C(NCCc1cccs1)C1CCN(CC2=CCCCC2)CC1	ZINC000450530034	EH	On-Demand	Anodyne	ADAM17	0	42
COCCCOc1ccc(Nc2ncc([N+](=O)[O-])c(C)n2)cc1OC	ZINC000450530035	EF	On-Demand	Bother	S1PR4	0	43
COCCCOc1ccc(Nc2ncc([N+](=O)[O-])c(C)n2)cc1OC	ZINC000450530035	EF	On-Demand	Bother	PLK1	0	44
COCCCOc1ccc(Nc2ncc([N+](=O)[O-])c(C)n2)cc1OC	ZINC000450530035	EF	On-Demand	Bother	PTK2	40	34
COCCCOc1ccc(Nc2ncc([N+](=O)[O-])c(C)n2)cc1OC	ZINC000450530035	EF	On-Demand	Bother	ENPP1	40	30
Cc1ccc(F)c(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000450530036	DF	On-Demand	Anodyne	COLA	120	43
Cc1ccc(F)c(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000450530036	DF	On-Demand	Anodyne	CPT1A	105	43
COc1cc(C(=O)NC2CCC(c3ccc(F)cc3)CC2)c([N+](=O)[O-])cc1F	ZINC000450530048	GI	On-Demand	Bother	DRD2	16	40
CCCOc1ccc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(OC)c1	ZINC000450530049	FH	On-Demand	Anodyne	MET	18	54
CCCOc1ccc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(OC)c1	ZINC000450530049	FH	On-Demand	Anodyne	LUCI_LUCLA	15	40
CCCOc1ccc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(OC)c1	ZINC000450530049	FH	On-Demand	Anodyne	ENPP1	46	30
CCCOc1ccc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(OC)c1	ZINC000450530049	FH	On-Demand	Anodyne	KCNK3	58	45
CCCOc1ccc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(OC)c1	ZINC000450530049	FH	On-Demand	Anodyne	KCNK9	66	45
COCC[C@@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450530054	DD	On-Demand	Anodyne	NPPA	41	32
COCC[C@@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450530054	DD	On-Demand	Anodyne	NOD1	82	38
COCC[C@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450530055	DD	On-Demand	Anodyne	NPPA	41	32
COCC[C@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450530055	DD	On-Demand	Anodyne	NOD1	82	38
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	VDR	49	35
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	PPARG	0	42
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	PPARA	26	42
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	APOB	0	41
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	TRPV1	20	42
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	ATF1	56	37
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	PPARD	62	42
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	SORT1	15	40
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	MTTP	60	41
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	NFKB1	52	37
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	BTK	23	40
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	SCD1	35	41
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	SCD	26	42
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	KCNK3	56	39
Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2C)ccc1OCCO	ZINC000450530065	FH	On-Demand	Anodyne	KCNK9	52	39
Cc1cncc(-c2nc(CN3CCC(C(=O)NC4CCCCC4)CC3)no2)c1	ZINC000450530068	GG	On-Demand	Anodyne	SSTR5	41	43
Cc1cncc(-c2nc(CN3CCC(C(=O)NC4CCCCC4)CC3)no2)c1	ZINC000450530068	GG	On-Demand	Anodyne	EPHX2	27	53
Cc1cncc(-c2nc(CN3CCC(C(=O)NC4CCCCC4)CC3)no2)c1	ZINC000450530068	GG	On-Demand	Anodyne	PTGES	34	40
O=C(N1CCO[C@H](c2ccccc2C(F)(F)F)C1)C1(CF)CCOCC1	ZINC000450530102	GG	On-Demand	Anodyne	RBP4	89	43
O=C(N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)C1(CF)CCOCC1	ZINC000450530103	GG	On-Demand	Anodyne	RBP4	89	43
C[C@@H](C(=O)N1C[C@@H](C(=O)O)[C@H](c2ccccc2)C1)c1c(F)cccc1F	ZINC000450530115	FG	On-Demand	Anodyne	MC4R	28	44
C[C@@H](C(=O)N1C[C@@H](C(=O)O)[C@H](c2ccccc2)C1)c1c(F)cccc1F	ZINC000450530115	FG	On-Demand	Anodyne	HSD17B2	46	33
CCC(CC)(NC(=O)[C@H]1COc2ccc(OC)cc2C1)C(=O)O	ZINC000450530133	DE	On-Demand	Anodyne	CDC42BPA	0	46
CCC(CC)(NC(=O)[C@@H]1COc2ccc(OC)cc2C1)C(=O)O	ZINC000450530135	DE	On-Demand	Anodyne	CDC42BPA	0	46
COC(=O)c1csc(CN2CCC(NC(=O)C3CCCCC3)CC2)n1	ZINC000450530136	FF	On-Demand	Anodyne	EPHX2	26	47
CCc1cc(CCCN2CCC(C(=O)NC3CCCCC3)CC2)on1	ZINC000450530137	EG	On-Demand	Anodyne	EPHX2	30	48
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H]3C(=O)O)CC2)cc1	ZINC000450530165	DF	On-Demand	Anodyne	MMP2	0	41
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H]3C(=O)O)CC2)cc1	ZINC000450530165	DF	On-Demand	Anodyne	ADAM10	36	41
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H]3C(=O)O)CC2)cc1	ZINC000450530165	DF	On-Demand	Anodyne	NPBWR1	76	37
COc1ccc(C2CCN(C(=O)[C@H]3CC[C@@H]3C(=O)O)CC2)cc1	ZINC000450530166	DF	On-Demand	Anodyne	MMP2	0	41
COc1ccc(C2CCN(C(=O)[C@H]3CC[C@@H]3C(=O)O)CC2)cc1	ZINC000450530166	DF	On-Demand	Anodyne	ADAM10	36	41
COc1ccc(C2CCN(C(=O)[C@H]3CC[C@@H]3C(=O)O)CC2)cc1	ZINC000450530166	DF	On-Demand	Anodyne	NPBWR1	76	37
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@H]3C(=O)O)CC2)cc1	ZINC000450530167	DF	On-Demand	Anodyne	MMP2	0	41
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@H]3C(=O)O)CC2)cc1	ZINC000450530167	DF	On-Demand	Anodyne	ADAM10	36	41
COc1ccc(C2CCN(C(=O)[C@@H]3CC[C@H]3C(=O)O)CC2)cc1	ZINC000450530167	DF	On-Demand	Anodyne	NPBWR1	76	37
COc1ccc(C2CCN(C(=O)[C@H]3CC[C@H]3C(=O)O)CC2)cc1	ZINC000450530168	DF	On-Demand	Anodyne	MMP2	0	41
COc1ccc(C2CCN(C(=O)[C@H]3CC[C@H]3C(=O)O)CC2)cc1	ZINC000450530168	DF	On-Demand	Anodyne	ADAM10	36	41
COc1ccc(C2CCN(C(=O)[C@H]3CC[C@H]3C(=O)O)CC2)cc1	ZINC000450530168	DF	On-Demand	Anodyne	NPBWR1	76	37
CCOC(=O)c1ccc(CN2c3ccccc3C[C@H]2C(N)=O)nc1	ZINC000450530173	ED	On-Demand	Anodyne	TPP2	53	33
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450530174	FI	On-Demand	Anodyne	CACNA1H	56	39
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450530174	FI	On-Demand	Anodyne	CCR3	26	42
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450530174	FI	On-Demand	Anodyne	PYGL	0	51
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450530174	FI	On-Demand	Anodyne	FAAH	18	48
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450530174	FI	On-Demand	Anodyne	EPHX2	28	42
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450530175	FI	On-Demand	Anodyne	CACNA1H	56	39
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450530175	FI	On-Demand	Anodyne	CCR3	26	42
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450530175	FI	On-Demand	Anodyne	PYGL	0	51
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450530175	FI	On-Demand	Anodyne	FAAH	18	48
O=C(Nc1cccc(Cl)c1)N1CCCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450530175	FI	On-Demand	Anodyne	EPHX2	28	42
CCN(CC)CCCC1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)CC1	ZINC000450530198	FI	On-Demand	Anodyne	AKR1C3	18	41
COCCOCCN(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450530204	DE	On-Demand	Anodyne	TUBB3	34	44
CC[C@@H](CC(C)C)C(=O)N1CCc2c(cccc2OC)C1	ZINC000450530205	CH	On-Demand	Anodyne	AGTR2	64	32
CC[C@@H](CC(C)C)C(=O)N1CCc2c(cccc2OC)C1	ZINC000450530205	CH	On-Demand	Anodyne	SSTR1	40	38
CC[C@H](CC(C)C)C(=O)N1CCc2c(cccc2OC)C1	ZINC000450530206	CH	On-Demand	Anodyne	AGTR2	64	32
CC(=O)NCC[C@@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450530217	FH	On-Demand	Anodyne	SIRT2	44	31
CC(=O)NCC[C@@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450530217	FH	On-Demand	Anodyne	LIPG	40	34
CC(=O)NCC[C@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450530218	FH	On-Demand	Anodyne	SIRT2	44	31
CC(=O)NCC[C@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450530218	FH	On-Demand	Anodyne	LIPG	40	34
Cc1cc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)ccc1OCCO	ZINC000450530249	GI	On-Demand	Anodyne	RBP4	71	37
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	HTR1A	19	49
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	DRD2	26	49
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	DRD4	25	41
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	HTR2A	24	56
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	HTR2C	18	53
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	CASR	18	44
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	HTR7	15	40
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	CCR3	51	56
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	EPHX2	25	43
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	MCHR1	72	58
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	CYP2J2	59	42
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	MEN1	41	36
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450530250	GH	On-Demand	Mild	KCNK3	20	43
C[C@@H](Oc1ccccn1)C(=O)N1CCC(CCCO)CC1	ZINC000450530260	CD	On-Demand	Anodyne	GRIN2B	18	40
C[C@H](Oc1ccccn1)C(=O)N1CCC(CCCO)CC1	ZINC000450530261	CD	On-Demand	Anodyne	GRIN2B	18	40
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCC(CCCO)CC1	ZINC000450530264	EH	On-Demand	Anodyne	CCR5	21	41
CC(F)(F)c1ccc(C(=O)N2CCC(CCCO)CC2)cn1	ZINC000450530269	DF	On-Demand	Anodyne	L3MBTL1	0	40
CC(F)(F)c1ccc(C(=O)N2CCC(CCCO)CC2)cn1	ZINC000450530269	DF	On-Demand	Anodyne	L3MBTL3	48	34
OCc1cn(CCCNc2ncnc3cc(Br)ccc23)nn1	ZINC000450530277	FD	On-Demand	Anodyne	EGFR	46	37
O=C1CC[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@H]([C@@H]2CCCO2)N1	ZINC000450530290	GE	On-Demand	Bother	MAOB	25	50
O=C1CC[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@@H]([C@H]2CCCO2)N1	ZINC000450530291	GE	On-Demand	Bother	MAOB	25	50
O=C1CC[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@@H]([C@@H]2CCCO2)N1	ZINC000450530292	GE	On-Demand	Bother	MAOB	25	50
O=C1CC[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@H]([C@H]2CCCO2)N1	ZINC000450530293	GE	On-Demand	Bother	MAOB	25	50
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000450530296	EG	On-Demand	Anodyne	COLA	137	43
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000450530296	EG	On-Demand	Anodyne	CPT1A	119	43
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000450530296	EG	On-Demand	Anodyne	CPT2	40	35
C/C=C\COc1cccc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000450530297	EG	On-Demand	Anodyne	COLA	137	43
C/C=C\COc1cccc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000450530297	EG	On-Demand	Anodyne	CPT1A	119	43
C/C=C\COc1cccc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000450530297	EG	On-Demand	Anodyne	CPT2	40	35
COc1ccc(-c2noc(N3C[C@@H](CO)[C@H](c4ccc(Cl)cc4)C3)n2)cc1	ZINC000450530299	GH	On-Demand	Anodyne	SLC6A1	41	49
COc1ccc(-c2noc(N3C[C@@H](CO)[C@H](c4ccc(Cl)cc4)C3)n2)cc1	ZINC000450530299	GH	On-Demand	Anodyne	SLC6A3	15	49
COc1ccc(-c2noc(N3C[C@@H](CO)[C@H](c4ccc(Cl)cc4)C3)n2)cc1	ZINC000450530299	GH	On-Demand	Anodyne	S1PR4	20	41
COc1ccc(-c2noc(N3C[C@@H](CO)[C@H](c4ccc(Cl)cc4)C3)n2)cc1	ZINC000450530299	GH	On-Demand	Anodyne	S1PR1	16	41
Cc1cc(NC(=O)c2c(Br)cnn2C)ccc1OCCO	ZINC000450530305	FE	On-Demand	Anodyne	HTR2A	48	43
Cc1cc(NC(=O)c2c(Br)cnn2C)ccc1OCCO	ZINC000450530305	FE	On-Demand	Anodyne	HTR2C	16	44
Cc1cc(NC(=O)c2c(Br)cnn2C)ccc1OCCO	ZINC000450530305	FE	On-Demand	Anodyne	FLT1	16	44
Cc1cc(NC(=O)c2c(Br)cnn2C)ccc1OCCO	ZINC000450530305	FE	On-Demand	Anodyne	ENPP1	45	33
CCOc1cc(C(=O)N2CC[C@@](C)(c3ccccc3)C2)ccc1OCC(=O)O	ZINC000450530318	GG	On-Demand	Anodyne	PTGDR2	21	41
CCOc1cc(C(=O)N2CC[C@@](C)(c3ccccc3)C2)ccc1OCC(=O)O	ZINC000450530318	GG	On-Demand	Anodyne	HCN1	46	31
CCOc1cc(C(=O)N2CC[C@](C)(c3ccccc3)C2)ccc1OCC(=O)O	ZINC000450530319	GG	On-Demand	Anodyne	PTGDR2	21	41
CCOc1cc(C(=O)N2CC[C@](C)(c3ccccc3)C2)ccc1OCC(=O)O	ZINC000450530319	GG	On-Demand	Anodyne	HCN1	46	31
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCOCC2(CC2)C1	ZINC000450530336	DG	On-Demand	Anodyne	CACNA1B	38	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCOCC2(CC2)C1	ZINC000450530336	DG	On-Demand	Anodyne	EPHX2	18	41
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCOCC2(CC2)C1	ZINC000450530337	FG	On-Demand	Anodyne	HRH4	19	46
O=C(NC1CCCCC1)C1CCN(CCc2cscn2)CC1	ZINC000450530342	DF	On-Demand	Anodyne	EPHX2	34	48
Cc1nc(N(C)CCN2CCN(Cc3ccccc3)CC2)ncc1[N+](=O)[O-]	ZINC000450530348	FD	On-Demand	Bother	MGLL	0	41
O=C(NC1CCC(c2ccc(F)cc2)CC1)c1cc2n(n1)CCCC2	ZINC000450530357	EH	On-Demand	Anodyne	MAPK13	55	34
C=CC(C)(C)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450530358	EH	On-Demand	Mild	RBP4	96	44
C=CC(C)(C)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450530360	EH	On-Demand	Mild	RBP4	96	44
O=C1CCC(CN2CCC(NC(=O)C3CCCCC3)CC2)CC1	ZINC000450530364	DF	On-Demand	Anodyne	EPHX2	28	45
C/C=C\COc1cccc(CC(=O)N[C@@H](CO)C(=O)OCC)c1	ZINC000450530371	DD	On-Demand	Anodyne	PDS	50	31
C/C=C/COc1cccc(CC(=O)N[C@H](CO)C(=O)OCC)c1	ZINC000450530372	DD	On-Demand	Anodyne	PDS	50	31
C/C=C/COc1cccc(CC(=O)N[C@@H](CO)C(=O)OCC)c1	ZINC000450530373	DD	On-Demand	Anodyne	PDS	50	31
C/C=C\COc1cccc(CC(=O)N[C@H](CO)C(=O)OCC)c1	ZINC000450530374	DD	On-Demand	Anodyne	PDS	50	31
Cc1cc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450530377	GI	On-Demand	Anodyne	RBP4	84	46
Cc1cc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450530379	GI	On-Demand	Anodyne	RBP4	84	46
COc1ccc2c(N3CCC[C@@H](CCNC(C)=O)C3)c([N+](=O)[O-])cnc2c1	ZINC000450530383	FF	On-Demand	Bother	MTNR1A	41	38
COc1ccc2c(N3CCC[C@H](CCNC(C)=O)C3)c([N+](=O)[O-])cnc2c1	ZINC000450530384	FF	On-Demand	Bother	MTNR1A	41	38
COc1ccc(-c2noc(N3CCC[C@@H](CCNC(C)=O)C3)n2)cc1	ZINC000450530393	EE	On-Demand	Anodyne	DRD4	41	32
COc1ccc(-c2noc(N3CCC[C@@H](CCNC(C)=O)C3)n2)cc1	ZINC000450530393	EE	On-Demand	Anodyne	MTNR1A	35	41
COc1ccc(-c2noc(N3CCC[C@@H](CCNC(C)=O)C3)n2)cc1	ZINC000450530393	EE	On-Demand	Anodyne	PDK1	40	34
COc1ccc(-c2noc(N3CCC[C@H](CCNC(C)=O)C3)n2)cc1	ZINC000450530396	EE	On-Demand	Anodyne	DRD4	41	32
COc1ccc(-c2noc(N3CCC[C@H](CCNC(C)=O)C3)n2)cc1	ZINC000450530396	EE	On-Demand	Anodyne	MTNR1A	35	41
COc1ccc(-c2noc(N3CCC[C@H](CCNC(C)=O)C3)n2)cc1	ZINC000450530396	EE	On-Demand	Anodyne	PDK1	40	34
CCN(CC)CCCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450530398	FH	On-Demand	Anodyne	ACHE	17	41
CCN(CC)CCCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450530398	FH	On-Demand	Anodyne	P2RY12	53	34
CCN(CC)CCCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450530398	FH	On-Demand	Anodyne	AMY2	62	39
CCN(CC)CCCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450530398	FH	On-Demand	Anodyne	REN	28	40
CCN(CC)CCCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450530398	FH	On-Demand	Anodyne	ST14	52	33
CCN(CC)CCCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450530398	FH	On-Demand	Anodyne	AMP1_PLAFQ	16	43
CCN(CC)CCCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450530398	FH	On-Demand	Anodyne	TMPRSS6	45	32
CCN(CC)CCCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450530404	FH	On-Demand	Anodyne	ACHE	17	41
CCN(CC)CCCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450530404	FH	On-Demand	Anodyne	P2RY12	53	34
CCN(CC)CCCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450530404	FH	On-Demand	Anodyne	AMY2	62	39
CCN(CC)CCCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450530404	FH	On-Demand	Anodyne	REN	28	40
CCN(CC)CCCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450530404	FH	On-Demand	Anodyne	ST14	52	33
CCN(CC)CCCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450530404	FH	On-Demand	Anodyne	AMP1_PLAFQ	16	43
CCN(CC)CCCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450530404	FH	On-Demand	Anodyne	TMPRSS6	45	32
COCC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450530407	FF	On-Demand	Anodyne	TIMP3	45	33
COCC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450530407	FF	On-Demand	Anodyne	NPPA	51	39
COCC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450530408	FF	On-Demand	Anodyne	TIMP3	45	33
COCC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)C(=O)O	ZINC000450530408	FF	On-Demand	Anodyne	NPPA	51	39
Cc1ccc2c(c1)[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)CCC2	ZINC000450530432	CG	On-Demand	Bother	KCNN3	20	46
Cc1ccc2c(c1)[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)CCC2	ZINC000450530432	CG	On-Demand	Bother	PRKCQ	34	43
COC(=O)C1(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CCOCC1	ZINC000450530433	EF	On-Demand	Anodyne	SCN9A	0	41
COC(=O)C1(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CCOCC1	ZINC000450530434	EF	On-Demand	Anodyne	SCN9A	0	41
COC(=O)C1(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)CCOCC1	ZINC000450530435	EF	On-Demand	Anodyne	SCN9A	0	41
COC(=O)C1(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CCOCC1	ZINC000450530436	EF	On-Demand	Anodyne	SCN9A	0	41
C/C=C\COc1cccc(CC(=O)NC(C)(C)[C@@H](C)O)c1	ZINC000450530437	CE	On-Demand	Anodyne	PDS	58	34
C/C=C\COc1cccc(CC(=O)NC(C)(C)[C@H](C)O)c1	ZINC000450530438	CE	On-Demand	Anodyne	PDS	58	34
CCOC(=O)[C@@H](CO)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450530445	EC	On-Demand	Bother	CCR3	0	48
CCOC(=O)[C@H](CO)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450530450	EC	On-Demand	Bother	CCR3	0	48
C[C@H](O)CCN1c2ccccc2C[C@H]1C(N)=O	ZINC000450530454	BC	On-Demand	Anodyne	TPP2	44	44
C[C@@H](O)CCN1c2ccccc2C[C@H]1C(N)=O	ZINC000450530455	BC	On-Demand	Anodyne	TPP2	44	44
C[C@@H](O)CCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450530456	EF	On-Demand	Anodyne	CACNA1H	52	35
C[C@@H](O)CCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450530456	EF	On-Demand	Anodyne	PYGL	0	56
C[C@H](O)CCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450530457	EF	On-Demand	Anodyne	CACNA1H	52	35
C[C@H](O)CCN1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000450530457	EF	On-Demand	Anodyne	PYGL	0	56
CC(=O)NCC[C@H]1CCCN(c2ccnc3cc(F)c(Br)cc23)C1	ZINC000450530463	GH	On-Demand	Anodyne	SIRT3	39	40
CC(=O)NCC[C@H]1CCCN(c2ccnc3cc(F)c(Br)cc23)C1	ZINC000450530463	GH	On-Demand	Anodyne	SIRT2	43	30
CC(=O)NCC[C@H]1CCCN(c2ccnc3cc(F)c(Br)cc23)C1	ZINC000450530463	GH	On-Demand	Anodyne	SIRT1	41	40
CC(=O)NCC[C@@H]1CCCN(c2ccnc3cc(F)c(Br)cc23)C1	ZINC000450530464	GH	On-Demand	Anodyne	SIRT3	39	40
CC(=O)NCC[C@@H]1CCCN(c2ccnc3cc(F)c(Br)cc23)C1	ZINC000450530464	GH	On-Demand	Anodyne	SIRT2	43	30
CC(=O)NCC[C@@H]1CCCN(c2ccnc3cc(F)c(Br)cc23)C1	ZINC000450530464	GH	On-Demand	Anodyne	SIRT1	41	40
OC1(CCNc2ccnc3cc(F)c(Br)cc23)CCOCC1	ZINC000450530470	FG	On-Demand	Anodyne	HRP1_PLAFA	76	32
OC1(CCNc2ccnc3cc(F)c(Br)cc23)CCOCC1	ZINC000450530470	FG	On-Demand	Anodyne	HNMT	49	35
COc1cccc(Oc2ccc(C(=O)N[C@@H](CO)C3CCOCC3)nc2)c1	ZINC000450530489	FE	On-Demand	Anodyne	MTNR1B	18	40
COc1cccc(Oc2ccc(C(=O)N[C@H](CO)C3CCOCC3)nc2)c1	ZINC000450530490	FE	On-Demand	Anodyne	MTNR1B	18	40
Cc1csc(C(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450530502	EE	On-Demand	Anodyne	FBP1	19	40
CCC(CC)(NC(=O)[C@H]1C[C@@]1(C)CC)C(=O)O	ZINC000450530506	BE	On-Demand	Anodyne	DPEP1	59	55
CCC(CC)(NC(=O)[C@@H]1C[C@]1(C)CC)C(=O)O	ZINC000450530508	BE	On-Demand	Anodyne	DPEP1	59	55
CCC(CC)(NC(=O)[C@@H]1C[C@@]1(C)CC)C(=O)O	ZINC000450530509	BE	On-Demand	Anodyne	DPEP1	59	55
CCC(CC)(NC(=O)[C@H]1C[C@]1(C)CC)C(=O)O	ZINC000450530511	BE	On-Demand	Anodyne	DPEP1	59	55
Cc1cc(C(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)ncc1C(N)=O	ZINC000450530513	FG	On-Demand	Anodyne	ATF1	46	33
Cc1cc(C(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)ncc1C(N)=O	ZINC000450530513	FG	On-Demand	Anodyne	NFKB1	43	33
Cc1cc(C(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)ncc1C(N)=O	ZINC000450530513	FG	On-Demand	Anodyne	CSF1R	49	40
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	DRD2	22	53
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	DRD4	39	47
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	HTR2A	20	47
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	SLC6A1	24	42
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	DRD3	20	53
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	KCNH2	20	42
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	MAPK11	28	40
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	SIGMAR1	30	46
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	SSTR5	40	36
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	CCR1	23	40
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	CCR3	15	40
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	UTS2R	24	40
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	MCHR1	49	44
Cc1ccc(C(=O)NC2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450530514	FI	On-Demand	Anodyne	BIRC2	53	41
COc1cccc(-n2cc(C(=O)N3CCc4c(cccc4OC)C3)nn2)c1	ZINC000450530517	FE	On-Demand	Anodyne	DRD4	46	36
COc1cccc(-n2cc(C(=O)N3CCc4c(cccc4OC)C3)nn2)c1	ZINC000450530517	FE	On-Demand	Anodyne	SSTR1	44	35
O=[N+]([O-])c1ccc2c(NC[C@H]3CCCSC3)nccc2c1	ZINC000450530521	DG	On-Demand	Bother	PRKCQ	40	32
O=[N+]([O-])c1ccc2c(NC[C@@H]3CCCSC3)nccc2c1	ZINC000450530522	DG	On-Demand	Bother	PRKCQ	40	32
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450530528	GE	On-Demand	Anodyne	EPHX2	28	48
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450530528	GE	On-Demand	Anodyne	ALK	17	40
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450530529	GE	On-Demand	Anodyne	EPHX2	28	48
CN(C)S(=O)(=O)c1cccc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450530529	GE	On-Demand	Anodyne	ALK	17	40
C[C@@]1(CCCO)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450530544	FH	On-Demand	Anodyne	RBP4	69	38
C[C@]1(CCCO)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450530545	FH	On-Demand	Anodyne	RBP4	69	38
C[C@]1(CCCO)CCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450530548	FI	On-Demand	Anodyne	PRCP	50	35
C[C@]1(CCCO)CCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450530549	FI	On-Demand	Anodyne	PRCP	50	35
C[C@]1(CCCO)CCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450530550	FI	On-Demand	Anodyne	PRCP	50	35
C[C@]1(CCCO)CCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450530551	FI	On-Demand	Anodyne	PRCP	50	35
O=C(O)COc1cccc(C(=O)NCCCCc2ccc(F)c(F)c2)c1	ZINC000450530552	FG	On-Demand	Anodyne	DRD4	44	36
O=C(O)COc1cccc(C(=O)NCCCCc2ccc(F)c(F)c2)c1	ZINC000450530552	FG	On-Demand	Anodyne	FABP4	41	30
O=C(O)COc1cccc(C(=O)NCCCCc2ccc(F)c(F)c2)c1	ZINC000450530552	FG	On-Demand	Anodyne	CRTM	60	38
O=C(O)COc1cccc(C(=O)NCCCCc2ccc(F)c(F)c2)c1	ZINC000450530552	FG	On-Demand	Anodyne	CRTH2	0	45
O=C(O)COc1cccc(C(=O)NCCCCc2ccc(F)c(F)c2)c1	ZINC000450530552	FG	On-Demand	Anodyne	PDS	40	36
COc1ccc(-c2noc(NC[C@@](C)(O)Cc3ccc(OC)c(OC)c3)n2)cc1	ZINC000450530576	GF	On-Demand	Anodyne	WNT3A	18	41
COc1ccc(-c2noc(NC[C@](C)(O)Cc3ccc(OC)c(OC)c3)n2)cc1	ZINC000450530577	GF	On-Demand	Anodyne	WNT3A	18	41
Cc1cc(NC(=O)[C@H](C)OCCc2ccccc2)ccc1OCCO	ZINC000450530584	EF	On-Demand	Anodyne	C5AR1	0	45
Cc1cc(NC(=O)[C@@H](C)OCCc2ccccc2)ccc1OCCO	ZINC000450530585	EF	On-Demand	Anodyne	C5AR1	0	45
Cc1cc(NC(=O)c2cc(C#N)[nH]c2C)ccc1OCCO	ZINC000450530587	CE	On-Demand	Mild	KCNK3	41	33
Cc1cc(NC(=O)c2cc(C#N)[nH]c2C)ccc1OCCO	ZINC000450530587	CE	On-Demand	Mild	KCNK9	43	33
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccnc(C(=O)O)c1	ZINC000450530593	DG	On-Demand	Anodyne	FTO	0	43
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccnc(C(=O)O)c1	ZINC000450530594	DG	On-Demand	Anodyne	FTO	0	43
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccnc(C(=O)O)c1	ZINC000450530595	DG	On-Demand	Anodyne	FTO	0	43
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccnc(C(=O)O)c1	ZINC000450530596	DG	On-Demand	Anodyne	FTO	0	43
C[C@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530609	DG	On-Demand	Anodyne	PREP	53	50
C[C@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530609	DG	On-Demand	Anodyne	CFTR	58	38
C[C@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530609	DG	On-Demand	Anodyne	ADAM9	60	37
C[C@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530609	DG	On-Demand	Anodyne	CYP2J2	46	35
C[C@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530609	DG	On-Demand	Anodyne	NOD2	43	36
C[C@@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530610	DG	On-Demand	Anodyne	PREP	53	50
C[C@@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530610	DG	On-Demand	Anodyne	CFTR	58	38
C[C@@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530610	DG	On-Demand	Anodyne	ADAM9	60	37
C[C@@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530610	DG	On-Demand	Anodyne	CYP2J2	46	35
C[C@@H]1Cc2ccccc2CN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450530610	DG	On-Demand	Anodyne	NOD2	43	36
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450530615	DD	On-Demand	Anodyne	MAPK1	34	48
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450530615	DD	On-Demand	Anodyne	EPHX2	17	41
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450530616	DD	On-Demand	Anodyne	MAPK1	34	48
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450530616	DD	On-Demand	Anodyne	EPHX2	17	41
CCc1oc(C(=O)N2Cc3ccccc3C[C@H]2C)cc1C(=O)O	ZINC000450530617	DG	On-Demand	Anodyne	CFTR	53	35
CCc1oc(C(=O)N2Cc3ccccc3C[C@H]2C)cc1C(=O)O	ZINC000450530617	DG	On-Demand	Anodyne	BCL2	19	45
CCc1oc(C(=O)N2Cc3ccccc3C[C@@H]2C)cc1C(=O)O	ZINC000450530618	DG	On-Demand	Anodyne	CFTR	53	35
CCc1oc(C(=O)N2Cc3ccccc3C[C@@H]2C)cc1C(=O)O	ZINC000450530618	DG	On-Demand	Anodyne	BCL2	19	45
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530619	EH	On-Demand	Anodyne	SIGMAR1	20	40
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530619	EH	On-Demand	Anodyne	CCR5	15	42
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530619	EH	On-Demand	Anodyne	ITGA4	52	37
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530619	EH	On-Demand	Anodyne	SLC18A3	55	38
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530619	EH	On-Demand	Anodyne	CYP2J2	44	32
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530620	EH	On-Demand	Anodyne	SIGMAR1	20	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530620	EH	On-Demand	Anodyne	CCR5	15	42
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530620	EH	On-Demand	Anodyne	ITGA4	52	37
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530620	EH	On-Demand	Anodyne	SLC18A3	55	38
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530620	EH	On-Demand	Anodyne	CYP2J2	44	32
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530621	EH	On-Demand	Anodyne	SIGMAR1	20	40
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530621	EH	On-Demand	Anodyne	CCR5	15	42
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530621	EH	On-Demand	Anodyne	ITGA4	52	37
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530621	EH	On-Demand	Anodyne	SLC18A3	55	38
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530621	EH	On-Demand	Anodyne	CYP2J2	44	32
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530622	EH	On-Demand	Anodyne	SIGMAR1	20	40
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530622	EH	On-Demand	Anodyne	CCR5	15	42
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530622	EH	On-Demand	Anodyne	ITGA4	52	37
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530622	EH	On-Demand	Anodyne	SLC18A3	55	38
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450530622	EH	On-Demand	Anodyne	CYP2J2	44	32
CN(C)S(=O)(=O)c1ccc(NCC(=O)Nc2ccn(C)n2)c([N+](=O)[O-])c1	ZINC000450530636	GC	On-Demand	Bother	BDKRB1	23	43
O=C(CCc1ccc(C(=O)O)cc1)NCCOCc1ccc(Cl)cc1	ZINC000450530645	FG	On-Demand	Anodyne	SRD5A2	0	40
COc1cccc2c1CCN(C(=O)C[C@@H]1CC[C@@H]3C[C@@H]13)C2	ZINC000450530670	CG	On-Demand	Anodyne	HTR1A	23	45
COc1cccc2c1CCN(C(=O)C[C@@H]1CC[C@@H]3C[C@@H]13)C2	ZINC000450530670	CG	On-Demand	Anodyne	SSTR1	54	40
COc1cccc2c1CCN(C(=O)C[C@@H]1CC[C@H]3C[C@@H]13)C2	ZINC000450530671	CG	On-Demand	Anodyne	SSTR1	49	36
COc1cccc2c1CCN(C(=O)C[C@@H]1CC[C@@H]3C[C@H]13)C2	ZINC000450530672	CG	On-Demand	Anodyne	SSTR1	49	36
COc1cccc2c1CCN(C(=O)C[C@@H]1CC[C@H]3C[C@H]13)C2	ZINC000450530673	CG	On-Demand	Anodyne	HTR1A	23	45
COc1cccc2c1CCN(C(=O)C[C@@H]1CC[C@H]3C[C@H]13)C2	ZINC000450530673	CG	On-Demand	Anodyne	SSTR1	54	40
C[C@@H]1C[C@@H]1c1nnc2ccc(N(C)CCOCc3ccc(C#N)cc3)nn12	ZINC000450530683	FF	On-Demand	Mild	PK7	0	40
C[C@@H]1C[C@H]1c1nnc2ccc(N(C)CCOCc3ccc(C#N)cc3)nn12	ZINC000450530684	FF	On-Demand	Mild	PK7	0	40
C[C@H]1C[C@H]1c1nnc2ccc(N(C)CCOCc3ccc(C#N)cc3)nn12	ZINC000450530685	FF	On-Demand	Mild	PK7	0	40
C[C@H]1C[C@@H]1c1nnc2ccc(N(C)CCOCc3ccc(C#N)cc3)nn12	ZINC000450530686	FF	On-Demand	Mild	PK7	0	40
CC(C)(C)Oc1c(F)cc(NC(=O)c2cncc(Cl)c2)cc1F	ZINC000450530689	EI	On-Demand	Anodyne	SCN10A	50	46
COc1ccccc1Oc1ccc(C(=O)N[C@@H](CO)C2CCOCC2)nc1	ZINC000450530690	FE	On-Demand	Anodyne	GHSR	17	40
COc1ccccc1Oc1ccc(C(=O)N[C@H](CO)C2CCOCC2)nc1	ZINC000450530691	FE	On-Demand	Anodyne	GHSR	17	40
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C)c(Cl)c1Cl	ZINC000450530692	DD	On-Demand	Anodyne	CCR3	0	43
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C)c(Cl)c1Cl	ZINC000450530693	DD	On-Demand	Anodyne	CCR3	0	43
Cc1nc(NCCc2cn[nH]c2)ncc1[N+](=O)[O-]	ZINC000450530708	BC	On-Demand	Bother	PRKCQ	40	44
O=C(CSC1CC1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450530713	EH	On-Demand	Anodyne	RBP4	87	45
O=C(CSC1CC1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450530714	EH	On-Demand	Anodyne	RBP4	87	45
N#CC1(CN2CCC(NC(=O)C3CCCCC3)CC2)CCC1	ZINC000450530718	DF	On-Demand	Mild	EPHX2	26	41
OC[C@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@H]1C(F)(F)F	ZINC000450530734	GG	On-Demand	Anodyne	PDE3A	47	38
OC[C@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@H]1C(F)(F)F	ZINC000450530734	GG	On-Demand	Anodyne	PDE3B	68	35
OC[C@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@H]1C(F)(F)F	ZINC000450530734	GG	On-Demand	Anodyne	SIRT3	41	30
OC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@@H]1C(F)(F)F	ZINC000450530736	GG	On-Demand	Anodyne	PDE3A	47	38
OC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@@H]1C(F)(F)F	ZINC000450530736	GG	On-Demand	Anodyne	PDE3B	68	35
OC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@@H]1C(F)(F)F	ZINC000450530736	GG	On-Demand	Anodyne	SIRT3	41	30
OC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@H]1C(F)(F)F	ZINC000450530737	GG	On-Demand	Anodyne	PDE3A	47	38
OC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@H]1C(F)(F)F	ZINC000450530737	GG	On-Demand	Anodyne	PDE3B	68	35
OC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@H]1C(F)(F)F	ZINC000450530737	GG	On-Demand	Anodyne	SIRT3	41	30
OC[C@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@@H]1C(F)(F)F	ZINC000450530738	GG	On-Demand	Anodyne	PDE3A	47	38
OC[C@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@@H]1C(F)(F)F	ZINC000450530738	GG	On-Demand	Anodyne	PDE3B	68	35
OC[C@H]1CN(c2ncnc3cc(Br)ccc23)CC[C@@H]1C(F)(F)F	ZINC000450530738	GG	On-Demand	Anodyne	SIRT3	41	30
CN(C)c1cccc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)n1	ZINC000450530749	FF	On-Demand	Anodyne	CA5B	41	33
CN(C)c1cccc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)n1	ZINC000450530749	FF	On-Demand	Anodyne	CA5A	47	33
CC(C)OC(C)(C)C(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450530760	DF	On-Demand	Anodyne	KCNK3	55	37
CC(C)OC(C)(C)C(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450530760	DF	On-Demand	Anodyne	KCNK9	56	38
CN(CCc1ccccc1[N+](=O)[O-])c1ncc(C(F)F)cn1	ZINC000450530762	DG	On-Demand	Bother	COLA	90	35
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530768	EG	On-Demand	Anodyne	RARA	42	33
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530768	EG	On-Demand	Anodyne	RARG	40	35
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530768	EG	On-Demand	Anodyne	RXRG	68	46
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530768	EG	On-Demand	Anodyne	RARB	42	38
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530768	EG	On-Demand	Anodyne	RXRA	51	46
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530770	EG	On-Demand	Anodyne	RARA	42	33
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530770	EG	On-Demand	Anodyne	RARG	40	35
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530770	EG	On-Demand	Anodyne	RXRG	68	46
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530770	EG	On-Demand	Anodyne	RARB	42	38
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2F)C1	ZINC000450530770	EG	On-Demand	Anodyne	RXRA	51	46
CCCN(CC1(C#N)CCC1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450530772	CG	On-Demand	Mild	TIMP3	40	31
CCCN(CC1(C#N)CCC1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450530774	CG	On-Demand	Mild	TIMP3	40	31
FC(F)c1cnc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)nc1	ZINC000450530782	FF	On-Demand	Anodyne	DRD2	0	41
FC(F)c1cnc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)nc1	ZINC000450530782	FF	On-Demand	Anodyne	DRD3	0	41
FC(F)c1cnc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)nc1	ZINC000450530782	FF	On-Demand	Anodyne	SLC18A3	23	46
FC(F)c1cnc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)nc1	ZINC000450530788	FF	On-Demand	Anodyne	DRD2	0	41
FC(F)c1cnc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)nc1	ZINC000450530788	FF	On-Demand	Anodyne	DRD3	0	41
FC(F)c1cnc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)nc1	ZINC000450530788	FF	On-Demand	Anodyne	SLC18A3	23	46
COc1cc(CC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530794	FI	On-Demand	Anodyne	TRPV1	34	47
COc1cc(CC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530794	FI	On-Demand	Anodyne	MC3R	15	42
COc1cc(CC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530794	FI	On-Demand	Anodyne	MC5R	0	42
COc1cc(CC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530794	FI	On-Demand	Anodyne	TTR	0	45
COc1cc(CC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530794	FI	On-Demand	Anodyne	NCE103	34	45
COc1cc(CC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530794	FI	On-Demand	Anodyne	MTCA1	19	45
COc1cc(CC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530794	FI	On-Demand	Anodyne	P96878_MYCTU	19	42
COc1cc(CC(=O)N[C@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530794	FI	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530796	FI	On-Demand	Anodyne	TRPV1	34	47
COc1cc(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530796	FI	On-Demand	Anodyne	MC3R	15	42
COc1cc(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530796	FI	On-Demand	Anodyne	MC5R	0	42
COc1cc(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530796	FI	On-Demand	Anodyne	TTR	0	45
COc1cc(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530796	FI	On-Demand	Anodyne	NCE103	34	45
COc1cc(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530796	FI	On-Demand	Anodyne	MTCA1	19	45
COc1cc(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530796	FI	On-Demand	Anodyne	P96878_MYCTU	19	42
COc1cc(CC(=O)N[C@@H](c2ccc(Cl)cc2F)C(C)C)ccc1O	ZINC000450530796	FI	On-Demand	Anodyne	CAN2	0	45
C[C@H](CNC(=O)C1=C(c2ccccc2)CCC1)S(N)(=O)=O	ZINC000450530798	DD	On-Demand	Anodyne	ITGAV	40	34
CC(C)c1nnc(N(C)CCc2ccccc2[N+](=O)[O-])o1	ZINC000450530799	CF	On-Demand	Bother	COLA	84	34
C[C@@H](CNC(=O)C1=C(c2ccccc2)CCC1)S(N)(=O)=O	ZINC000450530800	DD	On-Demand	Anodyne	ITGAV	40	34
C[C@H]1Cc2ccccc2CN1C(=O)c1cnc(C(=O)O)cn1	ZINC000450530805	CD	On-Demand	Anodyne	PREP	20	41
C[C@H]1Cc2ccccc2CN1C(=O)c1cnc(C(=O)O)cn1	ZINC000450530805	CD	On-Demand	Anodyne	CFTR	42	36
C[C@H]1Cc2ccccc2CN1C(=O)c1cnc(C(=O)O)cn1	ZINC000450530805	CD	On-Demand	Anodyne	BCL2	19	48
CCC(CC)(NC(=O)Cc1ccccc1S(C)(=O)=O)C(=O)O	ZINC000450530809	ED	On-Demand	Anodyne	MMP16	0	40
C[C@@H]1Cc2ccccc2CN1C(=O)c1cnc(C(=O)O)cn1	ZINC000450530810	CD	On-Demand	Anodyne	PREP	20	41
C[C@@H]1Cc2ccccc2CN1C(=O)c1cnc(C(=O)O)cn1	ZINC000450530810	CD	On-Demand	Anodyne	CFTR	42	36
C[C@@H]1Cc2ccccc2CN1C(=O)c1cnc(C(=O)O)cn1	ZINC000450530810	CD	On-Demand	Anodyne	BCL2	19	48
COc1ccc(-c2noc(=NCc3cc(C)nc(N4CCCC4)c3)[nH]2)cc1	ZINC000450530811	FG	On-Demand	Anodyne	GALR2	41	34
O=C(Nc1ccc(O)cc1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450530812	EF	On-Demand	Anodyne	MAPK1	31	41
O=C(Nc1ccc(O)cc1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450530813	EF	On-Demand	Anodyne	MAPK1	31	41
CC(C)c1nnc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)o1	ZINC000450530821	FF	On-Demand	Anodyne	DRD3	0	41
CC(C)c1nnc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)o1	ZINC000450530821	FF	On-Demand	Anodyne	SLC18A3	22	42
CC(C)c1nnc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)o1	ZINC000450530823	FF	On-Demand	Anodyne	DRD3	0	41
CC(C)c1nnc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)o1	ZINC000450530823	FF	On-Demand	Anodyne	SLC18A3	22	42
O=C(NC1CCN(C[C@H]2CCC(F)(F)C2)CC1)C1CCCCC1	ZINC000450530825	EH	On-Demand	Anodyne	EPHX2	27	41
O=C(NC1CCN(C[C@@H]2CCC(F)(F)C2)CC1)C1CCCCC1	ZINC000450530826	EH	On-Demand	Anodyne	EPHX2	27	41
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCC1(F)F	ZINC000450530837	EH	On-Demand	Anodyne	PDE3A	46	35
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCC1(F)F	ZINC000450530837	EH	On-Demand	Anodyne	PDE3B	45	35
COC(=O)c1cccc(CN2CCC(C(=O)NC3CCCCC3)CC2)c1Cl	ZINC000450530838	GH	On-Demand	Anodyne	DRD4	22	48
COC(=O)c1cccc(CN2CCC(C(=O)NC3CCCCC3)CC2)c1Cl	ZINC000450530838	GH	On-Demand	Anodyne	SIGMAR1	25	58
COC(=O)c1cccc(CN2CCC(C(=O)NC3CCCCC3)CC2)c1Cl	ZINC000450530838	GH	On-Demand	Anodyne	EPHX2	39	53
C[C@H]1CN(c2ncnc3cc(Br)ccc23)CCC1(F)F	ZINC000450530839	EH	On-Demand	Anodyne	PDE3A	46	35
C[C@H]1CN(c2ncnc3cc(Br)ccc23)CCC1(F)F	ZINC000450530839	EH	On-Demand	Anodyne	PDE3B	45	35
N#Cc1cccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1Br	ZINC000450530841	FF	On-Demand	Mild	COLA	85	41
N#Cc1cccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1Br	ZINC000450530841	FF	On-Demand	Mild	CPT1A	76	39
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	CHRM2	15	43
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	CHRM1	15	45
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	DRD4	33	45
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	ACHE	29	40
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	DRD3	0	45
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	CHRM3	19	45
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	SIGMAR1	39	63
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	CCR3	23	40
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	C3AR1	41	36
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	EPHX2	31	43
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	MCHR1	35	42
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	CACNA1G	37	41
O=C(NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1)C1CCCCC1	ZINC000450530846	GH	On-Demand	Anodyne	BIRC2	36	44
N#Cc1cccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)c1Br	ZINC000450530847	FF	On-Demand	Mild	COLA	85	41
N#Cc1cccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)c1Br	ZINC000450530847	FF	On-Demand	Mild	CPT1A	76	39
CCCOc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)c(OC)c1	ZINC000450530853	FG	On-Demand	Anodyne	ENPP1	48	34
CCCOc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)c(OC)c1	ZINC000450530853	FG	On-Demand	Anodyne	KCNK3	47	42
CCCOc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)c(OC)c1	ZINC000450530853	FG	On-Demand	Anodyne	KCNK9	40	42
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OCCO	ZINC000450530858	EG	On-Demand	Anodyne	P4HTM	0	41
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OCCO	ZINC000450530858	EG	On-Demand	Anodyne	SHH	44	34
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OCCO	ZINC000450530858	EG	On-Demand	Anodyne	SCD1	38	41
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OCCO	ZINC000450530858	EG	On-Demand	Anodyne	SCD	26	41
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	ATF1	52	32
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	PPARD	42	35
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	GRM4	40	42
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	NFKB1	48	32
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	43	36
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	SHH	53	36
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	ENPP1	40	31
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	KCNK3	48	36
Cc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OCCO	ZINC000450530866	EG	On-Demand	Anodyne	KCNK9	49	36
O=C(Cc1cccc(C(=O)O)c1)NCCCCc1ccc(F)c(F)c1	ZINC000450530871	EG	On-Demand	Anodyne	LIPC	0	45
O=C(Cc1cccc(C(=O)O)c1)NCCCCc1ccc(F)c(F)c1	ZINC000450530871	EG	On-Demand	Anodyne	AKR1C3	25	41
O=C(Cc1cccc(C(=O)O)c1)NCCCCc1ccc(F)c(F)c1	ZINC000450530871	EG	On-Demand	Anodyne	CRTM	52	41
O=C(Cc1cccc(C(=O)O)c1)NCCCCc1ccc(F)c(F)c1	ZINC000450530871	EG	On-Demand	Anodyne	CAN2	0	40
Cc1nc(C)n(CCCC(=O)Nc2cccc(-c3ncn(C)n3)c2)n1	ZINC000450530872	EE	On-Demand	Anodyne	HDAC3	42	39
Cc1nc(C)n(CCCC(=O)Nc2cccc(-c3ncn(C)n3)c2)n1	ZINC000450530872	EE	On-Demand	Anodyne	HDAC6	32	40
O=[N+]([O-])c1cccc2c(N3C[C@@H](CO)[C@H](c4ccc(Cl)cc4)C3)nccc12	ZINC000450530888	GI	On-Demand	Bother	SLC6A1	0	42
O=C(c1ccsc1Br)N1CCC(CCCO)CC1	ZINC000450530896	EG	On-Demand	Anodyne	AKR1C3	0	45
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)cn1	ZINC000450530898	DF	On-Demand	Anodyne	COLA	69	39
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)cn1	ZINC000450530898	DF	On-Demand	Anodyne	CPT1A	65	39
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)cn1	ZINC000450530899	DF	On-Demand	Anodyne	COLA	69	39
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)cn1	ZINC000450530899	DF	On-Demand	Anodyne	CPT1A	65	39
Cc1ccc(F)c(CC(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450530941	DF	On-Demand	Anodyne	CETP	0	40
Cc1cc(NC(=O)CCc2nc3cnccc3[nH]2)ccc1OCCO	ZINC000450530957	EE	On-Demand	Anodyne	ENPP1	58	47
O=C(Nc1ccc(Br)cc1)C1CCN(Cc2cnns2)CC1	ZINC000450530963	GG	On-Demand	Anodyne	MAPK1	31	41
O=C(Cc1cc2ccccc2c(O)n1)N1CCC(CCCO)CC1	ZINC000450530974	EE	On-Demand	Anodyne	AKR1C3	19	41
O=C(Nc1ccc(O)cc1)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450530975	GJ	On-Demand	Anodyne	MAPK1	30	45
O=C(Nc1ccc(O)cc1)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450530975	GJ	On-Demand	Anodyne	EPHX2	27	46
O=C(Nc1ccc(O)cc1)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450530975	GJ	On-Demand	Anodyne	MCHR1	17	41
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450530979	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450530979	FG	On-Demand	Anodyne	MAPK1	22	44
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450530979	FG	On-Demand	Anodyne	EPHX2	15	49
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450530979	FG	On-Demand	Anodyne	ELOVL6	0	40
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450530980	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450530980	FG	On-Demand	Anodyne	MAPK1	22	44
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450530980	FG	On-Demand	Anodyne	EPHX2	15	49
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450530980	FG	On-Demand	Anodyne	ELOVL6	0	40
CCOc1nc2ccc(C(=O)N3CCC(CCCO)CC3)cc2[nH]1	ZINC000450530988	EF	On-Demand	Anodyne	GRIN2B	42	42
CCOc1nc2ccc(C(=O)N3CCC(CCCO)CC3)cc2[nH]1	ZINC000450530988	EF	On-Demand	Anodyne	CHEK2	34	44
CCOc1nc2ccc(C(=O)N3CCC(CCCO)CC3)cc2[nH]1	ZINC000450530988	EF	On-Demand	Anodyne	AKR1C3	0	44
CCOc1nc2ccc(C(=O)N3CCC(CCCO)CC3)cc2[nH]1	ZINC000450530988	EF	On-Demand	Anodyne	L3MBTL3	41	34
CCc1cccc(C(=O)Nc2ccc(OCCO)c(C)c2)n1	ZINC000450530991	DF	On-Demand	Anodyne	PDE5A	29	49
CCc1cccc(C(=O)Nc2ccc(OCCO)c(C)c2)n1	ZINC000450530991	DF	On-Demand	Anodyne	GRM4	36	43
CCc1cccc(C(=O)Nc2ccc(OCCO)c(C)c2)n1	ZINC000450530991	DF	On-Demand	Anodyne	SHH	42	35
CCc1cccc(C(=O)Nc2ccc(OCCO)c(C)c2)n1	ZINC000450530991	DF	On-Demand	Anodyne	KCNK3	54	37
CCc1cccc(C(=O)Nc2ccc(OCCO)c(C)c2)n1	ZINC000450530991	DF	On-Demand	Anodyne	KCNK9	54	35
Cc1csc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c1	ZINC000450531002	FI	On-Demand	Anodyne	RBP4	88	43
Cc1csc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c1	ZINC000450531003	FI	On-Demand	Anodyne	RBP4	88	43
CCOC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)nc1	ZINC000450531006	FF	On-Demand	Anodyne	SSTR5	51	42
CCOC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)nc1	ZINC000450531006	FF	On-Demand	Anodyne	EPHX2	34	53
CCOC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)nc1	ZINC000450531006	FF	On-Demand	Anodyne	SCARB1	51	36
CC(C)(C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1)C1CCC1	ZINC000450531008	FI	On-Demand	Anodyne	RBP4	87	45
CC(C)(C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1)C1CCC1	ZINC000450531008	FI	On-Demand	Anodyne	SFRP1	60	31
CC(C)(C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1)C1CCC1	ZINC000450531008	FI	On-Demand	Anodyne	WNT3	52	31
CC(C)(C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)C1CCC1	ZINC000450531009	FI	On-Demand	Anodyne	RBP4	87	45
CC(C)(C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)C1CCC1	ZINC000450531009	FI	On-Demand	Anodyne	SFRP1	60	31
CC(C)(C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1)C1CCC1	ZINC000450531009	FI	On-Demand	Anodyne	WNT3	52	31
CCOC(=O)[C@@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450531022	CC	On-Demand	Anodyne	PDE5A	29	52
CCOC(=O)[C@@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450531022	CC	On-Demand	Anodyne	CCR3	0	46
CCOC(=O)[C@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450531023	CC	On-Demand	Anodyne	PDE5A	29	52
CCOC(=O)[C@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450531023	CC	On-Demand	Anodyne	CCR3	0	46
CC(=O)[C@@](C)(O)CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450531039	ED	On-Demand	Anodyne	ADAM17	22	43
CC(=O)[C@](C)(O)CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450531040	ED	On-Demand	Anodyne	ADAM17	22	43
O=C(CC1(O)CCC1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531044	EF	On-Demand	Anodyne	RBP4	70	41
O=C(CC1(O)CCC1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531045	EF	On-Demand	Anodyne	RBP4	70	41
CN(CCN1CCC(C(=O)NCCc2cccs2)CC1)Cc1ccccc1	ZINC000450531047	GG	On-Demand	Anodyne	SIGMAR1	38	44
CN(CCN1CCC(C(=O)NCCc2cccs2)CC1)Cc1ccccc1	ZINC000450531047	GG	On-Demand	Anodyne	CCR5	28	47
CN(CCN1CCC(C(=O)NCCc2cccs2)CC1)Cc1ccccc1	ZINC000450531047	GG	On-Demand	Anodyne	ADAM17	26	51
CN(CCN1CCC(C(=O)NCCc2cccs2)CC1)Cc1ccccc1	ZINC000450531047	GG	On-Demand	Anodyne	CACNA1G	46	44
COCc1nn(C)cc1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531052	GF	On-Demand	Anodyne	RBP4	89	45
COCc1nn(C)cc1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531053	GF	On-Demand	Anodyne	RBP4	89	45
CC[C@@H]1C[C@H]1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531066	EH	On-Demand	Anodyne	RBP4	87	41
CC[C@@H]1C[C@H]1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531067	EH	On-Demand	Anodyne	RBP4	87	41
C[C@@H](O)CCN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450531079	CD	On-Demand	Anodyne	EPHX2	33	50
C[C@H](O)CCN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450531080	CD	On-Demand	Anodyne	EPHX2	33	50
CCC(CC)(NC(=O)c1cccc(S(=O)(=O)N(C)C(C)C)c1)C(=O)O	ZINC000450531081	FE	On-Demand	Anodyne	COLA	29	42
O=C(NC1CCN(CC2=CCCCC2)CC1)C1CCCCC1	ZINC000450531091	DH	On-Demand	Anodyne	SIGMAR1	18	56
O=C(NC1CCN(CC2=CCCCC2)CC1)C1CCCCC1	ZINC000450531091	DH	On-Demand	Anodyne	EPHX2	33	51
CCc1cc(CCCN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)on1	ZINC000450531092	FG	On-Demand	Mild	CCR3	30	45
CCc1cc(CCCN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)on1	ZINC000450531092	FG	On-Demand	Mild	MCHR1	48	39
Cc1[nH]c(C#N)cc1C(=O)N1CCC(CCCO)CC1	ZINC000450531103	CD	On-Demand	Mild	AKR1C3	17	40
OCc1cn(CCCNc2ncnc3[nH]c4ccccc4c23)nn1	ZINC000450531104	DD	On-Demand	Anodyne	UTS2R	0	42
O=C(c1cc2ccncc2s1)N1CCC(CCCO)CC1	ZINC000450531115	DF	On-Demand	Anodyne	AKR1C3	15	44
Cn1cnc(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450531122	DF	On-Demand	Anodyne	HDAC10	50	39
Cn1cnc(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450531122	DF	On-Demand	Anodyne	HDAC2	25	43
Cn1cnc(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450531122	DF	On-Demand	Anodyne	HDAC3	52	43
Cn1cnc(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450531122	DF	On-Demand	Anodyne	HDAC6	44	44
Cn1cnc(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450531122	DF	On-Demand	Anodyne	PARP10	0	40
O=C(O)[C@@H]1CC[C@@H](C(=O)NCCCCc2ccc(F)c(F)c2)CC1	ZINC000450531128	EG	On-Demand	Anodyne	MTNR1A	19	41
O=C(O)[C@@H]1CC[C@@H](C(=O)NCCCCc2ccc(F)c(F)c2)CC1	ZINC000450531128	EG	On-Demand	Anodyne	MTNR1B	18	46
O=C(O)C1CCC(C(=O)NCCCCc2ccc(F)c(F)c2)CC1	ZINC000450531129	EG	On-Demand	Anodyne	MTNR1A	19	41
O=C(O)C1CCC(C(=O)NCCCCc2ccc(F)c(F)c2)CC1	ZINC000450531129	EG	On-Demand	Anodyne	MTNR1B	18	46
COCc1nc(CNc2nc(N(C)C)c3ccccc3n2)cs1	ZINC000450531131	EE	On-Demand	Anodyne	ADRA2A	15	46
N#Cc1cccc(NC(=O)C2CCN(C[C@H]3CCC(F)(F)C3)CC2)c1	ZINC000450531133	EH	On-Demand	Mild	CCR3	42	48
N#Cc1cccc(NC(=O)C2CCN(C[C@H]3CCC(F)(F)C3)CC2)c1	ZINC000450531133	EH	On-Demand	Mild	MCHR1	63	45
N#Cc1cccc(NC(=O)C2CCN(C[C@@H]3CCC(F)(F)C3)CC2)c1	ZINC000450531134	EH	On-Demand	Mild	CCR3	42	48
N#Cc1cccc(NC(=O)C2CCN(C[C@@H]3CCC(F)(F)C3)CC2)c1	ZINC000450531134	EH	On-Demand	Mild	MCHR1	63	45
Cc1nc2ccnn2cc1C(=O)N1CCC(CCCO)CC1	ZINC000450531141	DD	On-Demand	Anodyne	AKR1C3	15	46
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CC2)C1	ZINC000450531158	EH	On-Demand	Anodyne	MC4R	45	37
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CC2)C1	ZINC000450531158	EH	On-Demand	Anodyne	PRCP	57	36
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CC2)C1	ZINC000450531159	EH	On-Demand	Anodyne	MC4R	45	37
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CC2)C1	ZINC000450531159	EH	On-Demand	Anodyne	PRCP	57	36
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CC2)C1	ZINC000450531160	EH	On-Demand	Anodyne	MC4R	45	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CC2)C1	ZINC000450531160	EH	On-Demand	Anodyne	PRCP	57	36
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CC2)C1	ZINC000450531161	EH	On-Demand	Anodyne	MC4R	45	37
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CC2)C1	ZINC000450531161	EH	On-Demand	Anodyne	PRCP	57	36
N#Cc1c(Cl)cccc1N1C[C@@H](CO)[C@H](c2ccc(Cl)cc2)C1	ZINC000450531162	EI	On-Demand	Mild	SLC6A1	21	44
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCOC1	ZINC000450531164	CD	On-Demand	Anodyne	CYP2J2	46	37
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCOC1	ZINC000450531164	CD	On-Demand	Anodyne	LUXR	57	43
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCOC1	ZINC000450531164	CD	On-Demand	Anodyne	TRAR	30	44
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCOC1	ZINC000450531164	CD	On-Demand	Anodyne	LASR	21	43
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCOC1	ZINC000450531165	CD	On-Demand	Anodyne	CYP2J2	46	37
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCOC1	ZINC000450531165	CD	On-Demand	Anodyne	LUXR	57	43
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCOC1	ZINC000450531165	CD	On-Demand	Anodyne	TRAR	30	44
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCOC1	ZINC000450531165	CD	On-Demand	Anodyne	LASR	21	43
O=C(Cc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450531167	EG	On-Demand	Anodyne	LIPC	0	47
O=C(Cc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450531167	EG	On-Demand	Anodyne	PTPRA	54	34
O=C(Cc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450531167	EG	On-Demand	Anodyne	SLC6A5	30	47
O=C(Cc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450531167	EG	On-Demand	Anodyne	POLG_WNV	43	32
O=C(Cc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450531167	EG	On-Demand	Anodyne	CRTM	44	41
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450531170	EF	On-Demand	Anodyne	TIMP3	47	32
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450531170	EF	On-Demand	Anodyne	GPR142	54	42
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450531171	EF	On-Demand	Anodyne	TIMP3	47	32
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450531171	EF	On-Demand	Anodyne	GPR142	54	42
N#Cc1c(Br)cccc1OCC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450531181	GF	On-Demand	Mild	COLA	144	51
N#Cc1c(Br)cccc1OCC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450531181	GF	On-Demand	Mild	CPT1A	136	51
N#Cc1c(Br)cccc1OCC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450531181	GF	On-Demand	Mild	CPT2	43	36
N#Cc1c(Br)cccc1OCC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450531182	GF	On-Demand	Mild	COLA	144	51
N#Cc1c(Br)cccc1OCC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450531182	GF	On-Demand	Mild	CPT1A	136	51
N#Cc1c(Br)cccc1OCC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450531182	GF	On-Demand	Mild	CPT2	43	36
CCOc1nc2ccc(C(=O)Nc3ccc(OCCO)c(C)c3)cc2[nH]1	ZINC000450531187	FF	On-Demand	Anodyne	ENPP1	57	34
CCOc1nc2ccc(C(=O)Nc3ccc(OCCO)c(C)c3)cc2[nH]1	ZINC000450531187	FF	On-Demand	Anodyne	KCNK3	56	34
CCOc1nc2ccc(C(=O)Nc3ccc(OCCO)c(C)c3)cc2[nH]1	ZINC000450531187	FF	On-Demand	Anodyne	KCNK9	51	40
CCN1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@H](C)C1	ZINC000450531193	EG	On-Demand	Bother	EGFR	0	46
CCN1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@@H](C)C1	ZINC000450531194	EG	On-Demand	Bother	EGFR	0	46
Cc1ccc2[nH]c(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)c(C)c2c1	ZINC000450531195	FE	On-Demand	Anodyne	NPR	46	34
Cc1ccc2[nH]c(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)c(C)c2c1	ZINC000450531195	FE	On-Demand	Anodyne	KISS1R	41	30
O=C(NCCc1cccs1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450531231	EI	On-Demand	Anodyne	ADAM17	19	41
Brc1ccc2c(N3CC(C4CCC4)C3)ncnc2c1	ZINC000450531232	DH	On-Demand	Anodyne	PDE3A	45	34
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	CHRM1	15	47
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	DRD2	15	48
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	DRD4	36	49
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	ACHE	25	47
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	CHRM3	20	47
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	LTA4H	25	42
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	HRH3	30	53
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	SIGMAR1	38	68
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	SSTR5	55	41
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	CCR1	15	43
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	CCR3	42	46
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	UTS2R	18	42
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	SLC6A5	33	42
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	EPHX2	40	57
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	CXCR3	31	45
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	MCHR1	64	51
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	CACNA1G	34	41
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	MBTD1	0	45
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	ADIPOR1	0	43
CC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000450531252	EH	On-Demand	Anodyne	ADIPOR2	0	43
COc1ccc(-c2noc(N(C)[C@@H]3CCC[C@H]3O)n2)cc1	ZINC000450531257	CE	On-Demand	Anodyne	LUCI_PHOPE	23	42
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	CHRM1	25	41
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	DRD2	20	41
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	DRD4	22	41
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	ACHE	24	46
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	HTR2A	17	43
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	DRD3	17	50
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	LTA4H	27	47
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	HTR7	22	41
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	HRH3	21	48
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	SIGMAR1	59	54
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	CCR5	50	38
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	AMY2	44	30
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	SLC6A5	20	40
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	EPHX2	49	53
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	CACNA1G	46	42
CN(CCN1CCC(C(=O)NC2CCCCC2)CC1)Cc1ccccc1	ZINC000450531260	FG	On-Demand	Anodyne	PTGES	28	40
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450531264	GI	On-Demand	Anodyne	ADAM17	0	45
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450531264	GI	On-Demand	Anodyne	EPHX2	19	43
CCOC(=O)[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450531269	CC	On-Demand	Anodyne	SELE	72	38
CCOC(=O)[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450531269	CC	On-Demand	Anodyne	ICAM1	70	38
CCOC(=O)[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450531269	CC	On-Demand	Anodyne	VCAM1	52	36
CCOC(=O)[C@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450531270	CC	On-Demand	Anodyne	SELE	72	38
CCOC(=O)[C@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450531270	CC	On-Demand	Anodyne	ICAM1	70	38
CCOC(=O)[C@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450531270	CC	On-Demand	Anodyne	VCAM1	52	36
COc1cccc2c(N3CCC[C@@H](S(=O)(=O)N(C)C)C3)nccc12	ZINC000450531273	EE	On-Demand	Anodyne	PDE3B	61	34
COc1cccc2c(N3CCC[C@H](S(=O)(=O)N(C)C)C3)nccc12	ZINC000450531274	EE	On-Demand	Anodyne	PDE3B	61	34
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531279	CD	On-Demand	Anodyne	SDH1	0	40
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531279	CD	On-Demand	Anodyne	CTSG	25	40
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531279	CD	On-Demand	Anodyne	CTRB1	33	40
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531279	CD	On-Demand	Anodyne	AMY2	52	30
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531279	CD	On-Demand	Anodyne	CELA2A	26	40
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531279	CD	On-Demand	Anodyne	POL	0	42
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531279	CD	On-Demand	Anodyne	AMP1_PLAFQ	40	37
C[C@H](O)C(C)(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450531280	CD	On-Demand	Anodyne	SDH1	0	40
C[C@H](O)C(C)(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450531280	CD	On-Demand	Anodyne	CTSG	25	40
C[C@H](O)C(C)(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450531280	CD	On-Demand	Anodyne	CTRB1	33	40
C[C@H](O)C(C)(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450531280	CD	On-Demand	Anodyne	AMY2	52	30
C[C@H](O)C(C)(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450531280	CD	On-Demand	Anodyne	CELA2A	26	40
C[C@H](O)C(C)(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450531280	CD	On-Demand	Anodyne	POL	0	42
C[C@H](O)C(C)(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450531280	CD	On-Demand	Anodyne	AMP1_PLAFQ	40	37
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531281	CD	On-Demand	Anodyne	SDH1	0	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531281	CD	On-Demand	Anodyne	CTSG	25	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531281	CD	On-Demand	Anodyne	CTRB1	33	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531281	CD	On-Demand	Anodyne	AMY2	52	30
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531281	CD	On-Demand	Anodyne	CELA2A	26	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531281	CD	On-Demand	Anodyne	POL	0	42
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@@H](C)O	ZINC000450531281	CD	On-Demand	Anodyne	AMP1_PLAFQ	40	37
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@H](C)O	ZINC000450531282	CD	On-Demand	Anodyne	SDH1	0	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@H](C)O	ZINC000450531282	CD	On-Demand	Anodyne	CTSG	25	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@H](C)O	ZINC000450531282	CD	On-Demand	Anodyne	CTRB1	33	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@H](C)O	ZINC000450531282	CD	On-Demand	Anodyne	AMY2	52	30
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@H](C)O	ZINC000450531282	CD	On-Demand	Anodyne	CELA2A	26	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@H](C)O	ZINC000450531282	CD	On-Demand	Anodyne	POL	0	42
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)[C@H](C)O	ZINC000450531282	CD	On-Demand	Anodyne	AMP1_PLAFQ	40	37
CC(C)c1ncsc1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531283	GI	On-Demand	Anodyne	RBP4	81	42
CC(C)c1ncsc1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531284	GI	On-Demand	Anodyne	RBP4	81	42
COc1ccccc1-n1cnc2cc(C(=O)N3CCC[C@]3(C)CCCO)ccc21	ZINC000450531292	GH	On-Demand	Anodyne	HPGD	55	63
COc1ccccc1-n1cnc2cc(C(=O)N3CCC[C@@]3(C)CCCO)ccc21	ZINC000450531293	GH	On-Demand	Anodyne	HPGD	55	63
COc1ccccc1Oc1ccc(C(=O)N2CCC[C@@]2(C)CCCO)nc1	ZINC000450531298	FH	On-Demand	Anodyne	CCR8	28	40
COc1ccccc1Oc1ccc(C(=O)N2CCC[C@]2(C)CCCO)nc1	ZINC000450531299	FH	On-Demand	Anodyne	CCR8	28	40
COCC[C@@H](COC)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450531301	DG	On-Demand	Anodyne	HNMT	44	31
COCC[C@H](COC)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450531302	DG	On-Demand	Anodyne	HNMT	44	31
COCC[C@H](COC)Nc1ncnc2cc(Br)ccc12	ZINC000450531310	EF	On-Demand	Anodyne	EGFR	48	41
COCC[C@H](COC)Nc1ncnc2cc(Br)ccc12	ZINC000450531310	EF	On-Demand	Anodyne	FBP1	0	44
COCC[C@H](COC)Nc1ncnc2cc(Br)ccc12	ZINC000450531310	EF	On-Demand	Anodyne	HTT	0	40
COCC[C@@H](COC)Nc1ncnc2cc(Br)ccc12	ZINC000450531311	EF	On-Demand	Anodyne	EGFR	48	41
COCC[C@@H](COC)Nc1ncnc2cc(Br)ccc12	ZINC000450531311	EF	On-Demand	Anodyne	FBP1	0	44
COCC[C@@H](COC)Nc1ncnc2cc(Br)ccc12	ZINC000450531311	EF	On-Demand	Anodyne	HTT	0	40
C[C@@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531314	CF	On-Demand	Anodyne	OPRD1	49	38
C[C@@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531314	CF	On-Demand	Anodyne	AGTR2	69	40
C[C@@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531314	CF	On-Demand	Anodyne	CFTR	55	35
C[C@@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531314	CF	On-Demand	Anodyne	ADAM9	59	38
C[C@@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531314	CF	On-Demand	Anodyne	BCL2	0	40
C[C@@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531314	CF	On-Demand	Anodyne	NR1D1	36	40
C[C@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531315	CF	On-Demand	Anodyne	OPRD1	49	38
C[C@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531315	CF	On-Demand	Anodyne	AGTR2	69	40
C[C@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531315	CF	On-Demand	Anodyne	CFTR	55	35
C[C@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531315	CF	On-Demand	Anodyne	ADAM9	59	38
C[C@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531315	CF	On-Demand	Anodyne	BCL2	0	40
C[C@H]1Cc2ccccc2CN1C(=O)CCCCC(=O)O	ZINC000450531315	CF	On-Demand	Anodyne	NR1D1	36	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC(CCCO)CC1	ZINC000450531324	CG	On-Demand	Anodyne	GNAI3	0	41
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC(CCCO)CC1	ZINC000450531325	CG	On-Demand	Anodyne	GNAI3	0	41
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC(CCCO)CC1	ZINC000450531326	CG	On-Demand	Anodyne	GNAI3	0	41
CCC[C@H]1CCC[C@H]1C(=O)N1CCC(CCCO)CC1	ZINC000450531327	CG	On-Demand	Anodyne	GNAI3	0	41
C[C@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531333	EH	On-Demand	Anodyne	RARA	49	38
C[C@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531333	EH	On-Demand	Anodyne	GHRHR	40	32
C[C@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531333	EH	On-Demand	Anodyne	RARG	60	38
C[C@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531333	EH	On-Demand	Anodyne	PTGER4	42	35
C[C@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531333	EH	On-Demand	Anodyne	RXRG	64	38
C[C@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531333	EH	On-Demand	Anodyne	RARB	63	38
C[C@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531333	EH	On-Demand	Anodyne	RXRA	46	38
C[C@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531333	EH	On-Demand	Anodyne	RXRB	65	37
C[C@@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531334	EH	On-Demand	Anodyne	RARA	49	38
C[C@@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531334	EH	On-Demand	Anodyne	GHRHR	40	32
C[C@@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531334	EH	On-Demand	Anodyne	RARG	60	38
C[C@@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531334	EH	On-Demand	Anodyne	PTGER4	42	35
C[C@@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531334	EH	On-Demand	Anodyne	RXRG	64	38
C[C@@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531334	EH	On-Demand	Anodyne	RARB	63	38
C[C@@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531334	EH	On-Demand	Anodyne	RXRA	46	38
C[C@@]1(c2ccccc2)CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1	ZINC000450531334	EH	On-Demand	Anodyne	RXRB	65	37
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531349	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531350	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531351	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531351	DH	On-Demand	Anodyne	SLC18A3	57	44
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531351	DH	On-Demand	Anodyne	PREP	33	41
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531351	DH	On-Demand	Anodyne	RBP4	20	42
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531352	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531352	DH	On-Demand	Anodyne	SLC18A3	57	44
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531352	DH	On-Demand	Anodyne	PREP	33	41
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cccc(C(=O)O)c1	ZINC000450531352	DH	On-Demand	Anodyne	RBP4	20	42
O=C([C@H]1CCCCN1C1CCCC1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531353	GH	On-Demand	Anodyne	PREP	43	38
O=C([C@H]1CCCCN1C1CCCC1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531353	GH	On-Demand	Anodyne	SFRP1	43	33
O=C([C@H]1CCCCN1C1CCCC1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531353	GH	On-Demand	Anodyne	WNT3	52	33
O=C([C@H]1CCCCN1C1CCCC1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531354	GH	On-Demand	Anodyne	PREP	43	38
O=C([C@H]1CCCCN1C1CCCC1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531354	GH	On-Demand	Anodyne	SFRP1	43	33
O=C([C@H]1CCCCN1C1CCCC1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531354	GH	On-Demand	Anodyne	WNT3	52	33
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531355	GH	On-Demand	Anodyne	PREP	43	38
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531355	GH	On-Demand	Anodyne	SFRP1	43	33
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531355	GH	On-Demand	Anodyne	WNT3	52	33
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531356	GH	On-Demand	Anodyne	PREP	43	38
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531356	GH	On-Demand	Anodyne	SFRP1	43	33
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450531356	GH	On-Demand	Anodyne	WNT3	52	33
CC(C)(C(=O)N1CCC(CCCO)CC1)c1cccc2ccccc12	ZINC000450531362	EI	On-Demand	Anodyne	AKR1C3	20	45
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)CSCC(=O)O	ZINC000450531367	DF	On-Demand	Anodyne	SLC18A3	42	34
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)CSCC(=O)O	ZINC000450531368	DF	On-Demand	Anodyne	SLC18A3	42	34
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)CSCC(=O)O	ZINC000450531369	DF	On-Demand	Anodyne	SLC18A3	42	34
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)CSCC(=O)O	ZINC000450531370	DF	On-Demand	Anodyne	SLC18A3	42	34
O=C(c1cc2n(n1)CCCC2)N1CCC(CCCO)CC1	ZINC000450531371	CD	On-Demand	Anodyne	L3MBTL3	63	37
O=C(O)c1cnc(C(=O)NCCCCc2ccc(F)c(F)c2)cn1	ZINC000450531372	EE	On-Demand	Anodyne	SCNN1A	43	32
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(CCCO)CC3)ccc21	ZINC000450531382	GH	On-Demand	Anodyne	PDGFRB	15	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(CCCO)CC3)ccc21	ZINC000450531382	GH	On-Demand	Anodyne	HPGD	63	70
COC(=O)c1csc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)n1	ZINC000450531383	GF	On-Demand	Mild	CCR3	32	45
COC(=O)c1csc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)n1	ZINC000450531383	GF	On-Demand	Mild	MCHR1	56	38
O=C(C1CC1)C1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CC1	ZINC000450531400	FG	On-Demand	Anodyne	RBP4	76	46
O=C(C1CC1)C1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CC1	ZINC000450531401	FG	On-Demand	Anodyne	RBP4	76	46
CCOC(=O)[C@H](CO)NC(=O)c1ccc(Oc2ccccc2OC)cn1	ZINC000450531412	FD	On-Demand	Anodyne	P2RY12	49	36
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(Oc2ccccc2OC)cn1	ZINC000450531413	FD	On-Demand	Anodyne	P2RY12	49	36
COCCCOc1ccc(Nc2ccc([N+](=O)[O-])nc2)cc1OC	ZINC000450531432	EG	On-Demand	Bother	S1PR4	0	42
O=C(NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1)C1CCCCC1	ZINC000450531457	FG	On-Demand	Anodyne	SIGMAR1	18	51
O=C(NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1)C1CCCCC1	ZINC000450531457	FG	On-Demand	Anodyne	EPHX2	27	44
O=C(NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1)C1CCCCC1	ZINC000450531457	FG	On-Demand	Anodyne	MCHR1	27	42
O=C(NC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1)C1CCCCC1	ZINC000450531457	FG	On-Demand	Anodyne	HPGDS	33	44
CC(C)[C@@H](Nc1ncnc2cc(Br)ccc12)c1nncn1C	ZINC000450531458	FG	On-Demand	Anodyne	EGFR	44	40
CC(C)[C@H](Nc1ncnc2cc(Br)ccc12)c1nncn1C	ZINC000450531459	FG	On-Demand	Anodyne	EGFR	44	40
CCCc1cc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)no1	ZINC000450531467	FH	On-Demand	Anodyne	RBP4	68	38
CCCc1cc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)no1	ZINC000450531468	FH	On-Demand	Anodyne	RBP4	68	38
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450531472	DD	On-Demand	Anodyne	CCR3	22	42
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450531472	DD	On-Demand	Anodyne	MTTP	53	37
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450531473	DD	On-Demand	Anodyne	CCR3	22	42
CCOC(=O)[C@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450531473	DD	On-Demand	Anodyne	MTTP	53	37
CCC(CC)(NC(=O)Cc1cc(F)ccc1OC)C(=O)O	ZINC000450531474	CE	On-Demand	Anodyne	PPARA	15	40
N#Cc1cnc(NC[C@H]2CCN(S(=O)(=O)c3cccs3)C2)c([N+](=O)[O-])c1	ZINC000450531475	GE	On-Demand	Mild	PRKCQ	45	35
N#Cc1cnc(NC[C@@H]2CCN(S(=O)(=O)c3cccs3)C2)c([N+](=O)[O-])c1	ZINC000450531476	GE	On-Demand	Mild	PRKCQ	45	35
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CCO[C@@H](c3ccccc3C(F)(F)F)C1)C(=O)C2	ZINC000450531479	GI	On-Demand	Anodyne	RBP4	86	41
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CCO[C@H](c3ccccc3C(F)(F)F)C1)C(=O)C2	ZINC000450531480	GI	On-Demand	Anodyne	RBP4	86	41
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	PTGIR	54	36
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	AGTR2	96	35
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	FABP4	47	37
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	COLA	95	39
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	CPT1A	84	39
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	CPT2	42	38
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	CFTR	69	49
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	BCL2	0	41
C[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531492	EF	On-Demand	Anodyne	NR1D1	39	45
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	PTGIR	54	36
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	AGTR2	96	35
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	FABP4	47	37
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	COLA	95	39
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	CPT1A	84	39
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	CPT2	42	38
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	CFTR	69	49
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	BCL2	0	41
C[C@H]1Cc2ccccc2CN1C(=O)c1cccc(OCC(=O)O)c1	ZINC000450531493	EF	On-Demand	Anodyne	NR1D1	39	45
C=CCC1(C(=O)Nc2cccc(-c3ncn(C)n3)c2)CCCC1	ZINC000450531494	DH	On-Demand	Mild	LIMK2	16	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531500	GG	On-Demand	Mild	OPRK1	15	48
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531500	GG	On-Demand	Mild	CASR	28	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531500	GG	On-Demand	Mild	CCR3	35	51
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531500	GG	On-Demand	Mild	MCHR1	57	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531501	GG	On-Demand	Mild	OPRK1	15	48
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531501	GG	On-Demand	Mild	CASR	28	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531501	GG	On-Demand	Mild	CCR3	35	51
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531501	GG	On-Demand	Mild	MCHR1	57	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531502	GG	On-Demand	Mild	OPRK1	15	48
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531502	GG	On-Demand	Mild	CASR	28	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531502	GG	On-Demand	Mild	CCR3	35	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531502	GG	On-Demand	Mild	MCHR1	57	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531503	GG	On-Demand	Mild	OPRK1	15	48
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531503	GG	On-Demand	Mild	CASR	28	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531503	GG	On-Demand	Mild	CCR3	35	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450531503	GG	On-Demand	Mild	MCHR1	57	41
Cc1cc(NC(=O)c2cccc3c2CCCC3)ccc1OCCO	ZINC000450531515	EG	On-Demand	Anodyne	AVPR2	54	41
Cc1cc(NC(=O)c2cccc3c2CCCC3)ccc1OCCO	ZINC000450531515	EG	On-Demand	Anodyne	AVPR1A	25	41
Cc1cc(NC(=O)c2cccc3c2CCCC3)ccc1OCCO	ZINC000450531515	EG	On-Demand	Anodyne	MTTP	60	34
Cc1cc(NC(=O)c2cccc3c2CCCC3)ccc1OCCO	ZINC000450531515	EG	On-Demand	Anodyne	KCNK3	61	39
Cc1cc(NC(=O)c2cccc3c2CCCC3)ccc1OCCO	ZINC000450531515	EG	On-Demand	Anodyne	KCNK9	73	39
Cc1nc(N[C@@H]2CCc3sc(Cl)cc32)ncc1[N+](=O)[O-]	ZINC000450531516	DH	On-Demand	Bother	PRKCQ	28	40
Cc1nc(N[C@H]2CCc3sc(Cl)cc32)ncc1[N+](=O)[O-]	ZINC000450531517	DH	On-Demand	Bother	PRKCQ	28	40
CC(=O)c1nc(N2C[C@@H](CO)[C@H](c3ccc(Cl)cc3)C2)sc1C	ZINC000450531518	FH	On-Demand	Anodyne	SLC6A1	41	45
CCOCc1nc(C)c(C(=O)Nc2cccc(-c3ncn(C)n3)c2)s1	ZINC000450531520	FG	On-Demand	Anodyne	KCNK3	40	35
CCOCc1nc(C)c(C(=O)Nc2ccc(OCCO)c(C)c2)s1	ZINC000450531526	FF	On-Demand	Anodyne	PPARD	24	40
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450531534	FF	On-Demand	Anodyne	OPRK1	24	41
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450531534	FF	On-Demand	Anodyne	COLA	102	39
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450531534	FF	On-Demand	Anodyne	CPT1A	87	39
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450531535	FF	On-Demand	Anodyne	OPRK1	24	41
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450531535	FF	On-Demand	Anodyne	COLA	102	39
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450531535	FF	On-Demand	Anodyne	CPT1A	87	39
Cc1csc(C(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531537	CF	On-Demand	Anodyne	KCNK9	42	34
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CCC(CCCO)CC1	ZINC000450531545	DH	On-Demand	Anodyne	CCR5	19	41
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CCC(CCCO)CC1	ZINC000450531546	DH	On-Demand	Anodyne	CCR5	19	41
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCC(CCCO)CC1	ZINC000450531547	DH	On-Demand	Anodyne	CCR5	19	41
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCC(CCCO)CC1	ZINC000450531548	DH	On-Demand	Anodyne	CCR5	19	41
COC(=O)Cc1ccc(NC[C@]2(CO)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1	ZINC000450531552	FF	On-Demand	Bother	CACNA1D	49	33
COC(=O)Cc1ccc(NC[C@@]2(CO)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1	ZINC000450531553	FF	On-Demand	Bother	CACNA1D	49	33
COC(=O)Cc1ccc(NC[C@@]2(CO)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1	ZINC000450531554	FF	On-Demand	Bother	CACNA1D	49	33
COC(=O)Cc1ccc(NC[C@]2(CO)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1	ZINC000450531555	FF	On-Demand	Bother	CACNA1D	49	33
CNc1nc(N2CCN(c3snc(C)c3C#N)CC2)nc2ccccc12	ZINC000450531562	FE	On-Demand	Mild	HRH4	16	43
C/C=C\COc1cccc(CC(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531585	FH	On-Demand	Anodyne	UPP1	40	31
C/C=C/COc1cccc(CC(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531586	FH	On-Demand	Anodyne	UPP1	40	31
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	HTR1B	15	43
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	HTR2A	23	43
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	MAPK14	34	44
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	PIK3CA	31	41
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	PIK3CD	18	41
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	EPHX2	22	43
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	PIK3CB	26	41
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	DGAT1	34	43
Cc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCO	ZINC000450531588	GF	On-Demand	Anodyne	HSPB1	0	44
C[C@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531589	DG	On-Demand	Anodyne	RARA	43	36
C[C@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531589	DG	On-Demand	Anodyne	OPRM1	17	42
C[C@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531589	DG	On-Demand	Anodyne	OPRD1	18	42
C[C@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531589	DG	On-Demand	Anodyne	OPRK1	25	42
C[C@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531589	DG	On-Demand	Anodyne	RXRG	62	38
C[C@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531589	DG	On-Demand	Anodyne	RXRA	49	38
C[C@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531589	DG	On-Demand	Anodyne	RXRB	63	38
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531590	DG	On-Demand	Anodyne	RARA	43	36
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531590	DG	On-Demand	Anodyne	OPRM1	17	42
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531590	DG	On-Demand	Anodyne	OPRD1	18	42
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531590	DG	On-Demand	Anodyne	OPRK1	25	42
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531590	DG	On-Demand	Anodyne	RXRG	62	38
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531590	DG	On-Demand	Anodyne	RXRA	49	38
C[C@@]1(c2ccccc2)CCN(C(=O)Cc2cccc(C(=O)O)c2)C1	ZINC000450531590	DG	On-Demand	Anodyne	RXRB	63	38
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC[C@H]1C(=O)O	ZINC000450531592	CE	On-Demand	Anodyne	AGTR2	90	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC[C@H]1C(=O)O	ZINC000450531592	CE	On-Demand	Anodyne	PREP	28	49
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC[C@H]1C(=O)O	ZINC000450531592	CE	On-Demand	Anodyne	CFTR	42	36
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC[C@H]1C(=O)O	ZINC000450531592	CE	On-Demand	Anodyne	ADAM9	43	34
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H]1C(=O)O	ZINC000450531593	CE	On-Demand	Anodyne	AGTR2	90	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H]1C(=O)O	ZINC000450531593	CE	On-Demand	Anodyne	PREP	28	49
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H]1C(=O)O	ZINC000450531593	CE	On-Demand	Anodyne	CFTR	42	36
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H]1C(=O)O	ZINC000450531593	CE	On-Demand	Anodyne	ADAM9	43	34
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H]1C(=O)O	ZINC000450531594	CE	On-Demand	Anodyne	AGTR2	90	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H]1C(=O)O	ZINC000450531594	CE	On-Demand	Anodyne	PREP	28	49
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H]1C(=O)O	ZINC000450531594	CE	On-Demand	Anodyne	CFTR	42	36
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H]1C(=O)O	ZINC000450531594	CE	On-Demand	Anodyne	ADAM9	43	34
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC[C@@H]1C(=O)O	ZINC000450531595	CE	On-Demand	Anodyne	AGTR2	90	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC[C@@H]1C(=O)O	ZINC000450531595	CE	On-Demand	Anodyne	PREP	28	49
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC[C@@H]1C(=O)O	ZINC000450531595	CE	On-Demand	Anodyne	CFTR	42	36
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC[C@@H]1C(=O)O	ZINC000450531595	CE	On-Demand	Anodyne	ADAM9	43	34
Cc1cc(NC(=O)c2cn(CC3CC3)nn2)ccc1OCCO	ZINC000450531600	DD	On-Demand	Anodyne	ENPP1	41	32
Cc1cc(C(=O)N2CC[C@@](C)(c3ccccc3)C2)cc(C)c1OCC(=O)O	ZINC000450531601	FH	On-Demand	Anodyne	TACR1	34	46
Cc1cc(C(=O)N2CC[C@](C)(c3ccccc3)C2)cc(C)c1OCC(=O)O	ZINC000450531602	FH	On-Demand	Anodyne	TACR1	34	46
O=C(O)CSCC(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450531608	DE	On-Demand	Anodyne	LIPC	0	44
Cc1ccc(CC(=O)Nc2ccc(OCCO)c(C)c2)c(Br)c1	ZINC000450531613	GH	On-Demand	Anodyne	CETP	0	40
C[C@H]1Cc2ccccc2CN1C(=O)c1ccc(C(=O)O)s1	ZINC000450531624	DG	On-Demand	Anodyne	BCL2	16	46
C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(C(=O)O)s1	ZINC000450531625	DG	On-Demand	Anodyne	BCL2	16	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(CCCO)CC1	ZINC000450531627	EF	On-Demand	Anodyne	PFDN6	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(CCCO)CC1	ZINC000450531627	EF	On-Demand	Anodyne	RHODESAIN	0	42
OC[C@@H]1CN(c2nncs2)C[C@H]1c1ccc(Cl)cc1	ZINC000450531632	CE	On-Demand	Anodyne	SLC6A1	23	46
CO[C@@H](C)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450531650	DG	On-Demand	Anodyne	EGFR	62	39
CO[C@@H](C)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450531650	DG	On-Demand	Anodyne	ERBB4	24	43
CO[C@@H](C)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450531650	DG	On-Demand	Anodyne	MKNK1	21	43
CO[C@@H](C)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450531650	DG	On-Demand	Anodyne	HTT	0	41
CO[C@H](C)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450531651	DG	On-Demand	Anodyne	EGFR	62	39
CO[C@H](C)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450531651	DG	On-Demand	Anodyne	ERBB4	24	43
CO[C@H](C)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450531651	DG	On-Demand	Anodyne	MKNK1	21	43
CO[C@H](C)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450531651	DG	On-Demand	Anodyne	HTT	0	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	ACE	22	48
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	SSTR2	54	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	OPRM1	0	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	OPRD1	0	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MME	27	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	EDNRB	55	39
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	EDNRA	49	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	TACR1	32	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	BMP1	28	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	TACR2	59	48
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	CCKAR	92	52
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	CTSL	30	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	BRS3	25	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	NMBR	53	31
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MC3R	63	35
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MC5R	62	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MMP2	23	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MMP8	35	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MMP14	0	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	GRPR	65	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	ECE1	61	47
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	SSTR3	61	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MMP11	69	35
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	CCKBR	76	52
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	GHSR	73	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MMP9	23	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MC1R	71	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	ADAM9	39	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	MMP1	0	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	NPR	32	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	SSSIM	28	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	KISS1R	56	32
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531663	DD	On-Demand	Anodyne	ERAP2	42	38
C/C=C\COc1cccc(CC(=O)N2CCC(CCCO)CC2)c1	ZINC000450531664	EG	On-Demand	Anodyne	GPR183	0	40
CCc1cccc(C(=O)N2CCC(CCCO)CC2)n1	ZINC000450531665	CE	On-Demand	Anodyne	AKR1C3	20	47
C[C@@H]1Cc2cccc(C(=O)N3CCC(CCCO)CC3)c2O1	ZINC000450531670	DF	On-Demand	Anodyne	AKR1C3	15	42
C[C@H]1Cc2cccc(C(=O)N3CCC(CCCO)CC3)c2O1	ZINC000450531671	DF	On-Demand	Anodyne	AKR1C3	15	42
O=C(c1cc2cccnc2s1)N1CCC(CCCO)CC1	ZINC000450531672	DF	On-Demand	Anodyne	SIRT2	43	32
O=C(c1cc2cccnc2s1)N1CCC(CCCO)CC1	ZINC000450531672	DF	On-Demand	Anodyne	SIRT1	40	32
O=C(c1cc2cccnc2s1)N1CCC(CCCO)CC1	ZINC000450531672	DF	On-Demand	Anodyne	AKR1C3	0	43
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	ACE	22	48
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	SSTR2	54	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	OPRM1	0	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	OPRD1	0	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MME	27	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	EDNRB	55	39
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	EDNRA	49	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	TACR1	32	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	BMP1	28	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	TACR2	59	48
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	CCKAR	92	52
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	CTSL	30	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	BRS3	25	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	NMBR	53	31
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MC3R	63	35
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MC5R	62	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MMP2	23	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MMP8	35	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MMP14	0	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	GRPR	65	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	ECE1	61	47
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	SSTR3	61	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MMP11	69	35
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	CCKBR	76	52
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	GHSR	73	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MMP9	23	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MC1R	71	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	ADAM9	39	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	MMP1	0	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	NPR	32	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	SSSIM	28	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	KISS1R	56	32
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@@H](O)C1CCC1	ZINC000450531674	DD	On-Demand	Anodyne	ERAP2	42	38
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	ACE	22	48
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	SSTR2	54	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	OPRM1	0	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	OPRD1	0	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MME	27	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	EDNRB	55	39
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	EDNRA	49	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	TACR1	32	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	BMP1	28	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	TACR2	59	48
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	CCKAR	92	52
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	CTSL	30	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	BRS3	25	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	NMBR	53	31
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MC3R	63	35
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MC5R	62	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MMP2	23	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MMP8	35	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MMP14	0	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	GRPR	65	34
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	ECE1	61	47
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	SSTR3	61	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MMP11	69	35
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	CCKBR	76	52
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	GHSR	73	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MMP9	23	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MC1R	71	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	ADAM9	39	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	MMP1	0	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	NPR	32	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	SSSIM	28	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	KISS1R	56	32
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531675	DD	On-Demand	Anodyne	ERAP2	42	38
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	ACE	22	48
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	SSTR2	54	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	OPRM1	0	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	OPRD1	0	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MME	27	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	EDNRB	55	39
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	EDNRA	49	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	TACR1	32	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	BMP1	28	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	TACR2	59	48
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	CCKAR	92	52
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	CTSL	30	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	BRS3	25	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	NMBR	53	31
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MC3R	63	35
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MC5R	62	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MMP2	23	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MMP8	35	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MMP14	0	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	GRPR	65	34
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	ECE1	61	47
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	SSTR3	61	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MMP11	69	35
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	CCKBR	76	52
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	GHSR	73	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MMP9	23	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MC1R	71	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	ADAM9	39	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	MMP1	0	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	NPR	32	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	SSSIM	28	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	KISS1R	56	32
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)[C@H](O)C1CCC1	ZINC000450531677	DD	On-Demand	Anodyne	ERAP2	42	38
CCC[C@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450531680	CE	On-Demand	Anodyne	EPHX2	33	50
CCC[C@@H](O)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450531682	CE	On-Demand	Anodyne	EPHX2	33	50
COc1cc(CC(=O)NC2CCC(c3ccc(F)cc3)CC2)ccc1O	ZINC000450531684	FH	On-Demand	Anodyne	TRPV1	28	48
COc1cc(CC(=O)NC2CCC(c3ccc(F)cc3)CC2)ccc1O	ZINC000450531684	FH	On-Demand	Anodyne	SIGMAR1	16	46
COc1cc(CC(=O)NC2CCC(c3ccc(F)cc3)CC2)ccc1O	ZINC000450531684	FH	On-Demand	Anodyne	SHBG	18	40
COc1ccc(CNC(=O)CCN[C@](C)(C(N)=O)c2ccccc2)c(OC)c1	ZINC000450531685	GD	On-Demand	Anodyne	MTNR1A	68	40
COc1ccc(CNC(=O)CCN[C@](C)(C(N)=O)c2ccccc2)c(OC)c1	ZINC000450531685	GD	On-Demand	Anodyne	MTNR1B	66	38
COc1ccc(CNC(=O)CCN[C@](C)(C(N)=O)c2ccccc2)c(OC)c1	ZINC000450531685	GD	On-Demand	Anodyne	MT-ND1	23	40
COc1ccc(CNC(=O)CCN[C@@](C)(C(N)=O)c2ccccc2)c(OC)c1	ZINC000450531686	GD	On-Demand	Anodyne	MTNR1A	68	40
COc1ccc(CNC(=O)CCN[C@@](C)(C(N)=O)c2ccccc2)c(OC)c1	ZINC000450531686	GD	On-Demand	Anodyne	MTNR1B	66	38
COc1ccc(CNC(=O)CCN[C@@](C)(C(N)=O)c2ccccc2)c(OC)c1	ZINC000450531686	GD	On-Demand	Anodyne	MT-ND1	23	40
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)nc1	ZINC000450531688	GF	On-Demand	Anodyne	CHRM2	0	45
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)nc1	ZINC000450531688	GF	On-Demand	Anodyne	P2RY12	25	41
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)nc1	ZINC000450531688	GF	On-Demand	Anodyne	CHRM3	19	47
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)nc1	ZINC000450531688	GF	On-Demand	Anodyne	SSTR5	47	41
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	ACE	18	47
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MME	23	46
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	EDNRB	47	36
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	EDNRA	44	42
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	TACR1	27	45
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	CCKAR	77	44
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	CTSL	32	43
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	BRS3	24	44
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MC3R	47	37
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MC5R	54	32
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MMP2	25	45
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MMP8	39	45
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MMP14	21	40
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	GRPR	67	35
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	ECE1	54	44
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	SSTR3	28	42
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MMP11	66	33
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	CCKBR	66	44
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	GHSR	73	45
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MMP9	22	51
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MC1R	60	37
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	ADAM9	43	45
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	MMP1	22	44
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	NPR	32	44
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	ADAM12	15	45
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	SSSIM	27	41
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	SLC15A2	0	52
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	KISS1R	58	32
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	ERAP2	41	37
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	LASB	0	45
CC[C@@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531691	CD	On-Demand	Anodyne	NRDE	0	40
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	ACE	18	47
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MME	23	46
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	EDNRB	47	36
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	EDNRA	44	42
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	TACR1	27	45
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	CCKAR	77	44
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	CTSL	32	43
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	BRS3	24	44
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MC3R	47	37
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MC5R	54	32
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MMP2	25	45
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MMP8	39	45
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MMP14	21	40
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	GRPR	67	35
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	ECE1	54	44
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	SSTR3	28	42
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MMP11	66	33
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	CCKBR	66	44
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	GHSR	73	45
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MMP9	22	51
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MC1R	60	37
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	ADAM9	43	45
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	MMP1	22	44
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	NPR	32	44
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	ADAM12	15	45
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	SSSIM	27	41
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	SLC15A2	0	52
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	KISS1R	58	32
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	ERAP2	41	37
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	LASB	0	45
CC[C@H](O)CC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531693	CD	On-Demand	Anodyne	NRDE	0	40
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	ACE	18	47
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MME	23	46
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	EDNRB	47	36
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	EDNRA	44	42
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	TACR1	27	45
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	CCKAR	77	44
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	CTSL	32	43
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	BRS3	24	44
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MC3R	47	37
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MC5R	54	32
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MMP2	25	45
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MMP8	39	45
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MMP14	21	40
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	GRPR	67	35
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	ECE1	54	44
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	SSTR3	28	42
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MMP11	66	33
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	CCKBR	66	44
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	GHSR	73	45
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MMP9	22	51
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MC1R	60	37
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	ADAM9	43	45
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	MMP1	22	44
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	NPR	32	44
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	ADAM12	15	45
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	SSSIM	27	41
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	SLC15A2	0	52
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	KISS1R	58	32
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	ERAP2	41	37
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	LASB	0	45
CC[C@@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531694	CD	On-Demand	Anodyne	NRDE	0	40
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	ACE	18	47
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MME	23	46
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	EDNRB	47	36
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	EDNRA	44	42
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	TACR1	27	45
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	CCKAR	77	44
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	CTSL	32	43
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	BRS3	24	44
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MC3R	47	37
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MC5R	54	32
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MMP2	25	45
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MMP8	39	45
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MMP14	21	40
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	GRPR	67	35
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	ECE1	54	44
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	SSTR3	28	42
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MMP11	66	33
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	CCKBR	66	44
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	GHSR	73	45
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MMP9	22	51
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MC1R	60	37
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	ADAM9	43	45
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	MMP1	22	44
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	NPR	32	44
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	ADAM12	15	45
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	SSSIM	27	41
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	SLC15A2	0	52
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	KISS1R	58	32
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	ERAP2	41	37
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	LASB	0	45
CC[C@H](O)CC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000450531696	CD	On-Demand	Anodyne	NRDE	0	40
COC(=O)C1(CNC(=O)c2ccc(C(F)(F)F)cc2C)CCOCC1	ZINC000450531697	FF	On-Demand	Anodyne	PPARA	17	40
O=C(c1ccc2cnccc2c1)N1CCC(CCCO)CC1	ZINC000450531700	CF	On-Demand	Anodyne	AKR1C3	0	41
O=C(c1ccc2cnccc2c1)N1CCC(CCCO)CC1	ZINC000450531700	CF	On-Demand	Anodyne	L3MBTL1	0	45
O=C(c1ccc2cnccc2c1)N1CCC(CCCO)CC1	ZINC000450531700	CF	On-Demand	Anodyne	L3MBTL3	53	45
C=C[C@@H]1OCC[C@H]1C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531704	FG	On-Demand	Mild	RBP4	71	43
C=C[C@@H]1OCC[C@H]1C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531705	FG	On-Demand	Mild	RBP4	71	43
COCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450531706	DD	On-Demand	Anodyne	CDC25B	24	41
COCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450531706	DD	On-Demand	Anodyne	NPPA	45	36
COCC[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450531706	DD	On-Demand	Anodyne	NCE103	26	44
COCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450531707	DD	On-Demand	Anodyne	CDC25B	24	41
COCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450531707	DD	On-Demand	Anodyne	NPPA	45	36
COCC[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C(=O)O	ZINC000450531707	DD	On-Demand	Anodyne	NCE103	26	44
O=C(c1cc2c(Br)cccc2cn1)N1CCC(CCCO)CC1	ZINC000450531716	GH	On-Demand	Anodyne	AKR1C3	18	44
N#Cc1ccc(N2C[C@@H](C(=O)N3CCC(CCCO)CC3)CC2=O)cc1Cl	ZINC000450531717	GF	On-Demand	Mild	NR3C2	24	40
N#Cc1ccc(N2C[C@H](C(=O)N3CCC(CCCO)CC3)CC2=O)cc1Cl	ZINC000450531718	GF	On-Demand	Mild	NR3C2	24	40
CO[C@@H]1COC[C@H]1n1cc(CNc2nc(N(C)C)c3ccccc3n2)nn1	ZINC000450531719	FC	On-Demand	Anodyne	ADRA2A	15	43
CCOC(=O)[C@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450531723	DE	On-Demand	Anodyne	P2RY12	52	35
CCOC(=O)[C@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450531723	DE	On-Demand	Anodyne	CHRM4	15	41
CCOC(=O)[C@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450531723	DE	On-Demand	Anodyne	CHRM5	39	42
CCOC(=O)[C@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450531723	DE	On-Demand	Anodyne	CCR3	15	47
CCOC(=O)[C@@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450531724	DE	On-Demand	Anodyne	P2RY12	52	35
CCOC(=O)[C@@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450531724	DE	On-Demand	Anodyne	CHRM4	15	41
CCOC(=O)[C@@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450531724	DE	On-Demand	Anodyne	CHRM5	39	42
CCOC(=O)[C@@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450531724	DE	On-Demand	Anodyne	CCR3	15	47
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	KLK3	69	39
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	CTSB	29	48
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	HLA-A	46	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	CAPNS1	49	35
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	HLA-DRB1	56	35
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	CAPN1	65	38
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	CAPN2	90	38
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	FPR1	45	37
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	NPR	49	38
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531727	EC	On-Demand	Anodyne	FPR-S1	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	KLK3	69	39
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	CTSB	29	48
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	HLA-A	46	36
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	CAPNS1	49	35
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	HLA-DRB1	56	35
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	CAPN1	65	38
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	CAPN2	90	38
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	FPR1	45	37
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	NPR	49	38
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450531728	EC	On-Demand	Anodyne	FPR-S1	0	40
C[C@@H](O)C(C)(C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450531742	CD	On-Demand	Anodyne	CTSV	48	33
C[C@H](O)C(C)(C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450531743	CD	On-Demand	Anodyne	CTSV	48	33
CCOC(=O)[C@H](CO)NC(=O)CCc1ccc2ccccc2c1O	ZINC000450531746	ED	On-Demand	Anodyne	HDA106	0	40
CCOC(=O)[C@@H](CO)NC(=O)CCc1ccc2ccccc2c1O	ZINC000450531747	ED	On-Demand	Anodyne	HDA106	0	40
CN(C)c1cccc(NC(=O)C(C)(C)C2CCC2)n1	ZINC000450531751	CF	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)[C@H](CO)NC(=O)c1ccn(CCc2ccccc2)n1	ZINC000450531774	EC	On-Demand	Anodyne	P2RY12	77	36
CCOC(=O)[C@@H](CO)NC(=O)c1ccn(CCc2ccccc2)n1	ZINC000450531775	EC	On-Demand	Anodyne	P2RY12	77	36
C[C@@H](Cc1ccccc1Cl)C(=O)N1C[C@@H](C(=O)O)[C@H](c2ccccc2)C1	ZINC000450531780	FH	On-Demand	Anodyne	MC4R	50	39
CCN(Cc1cn(C)nn1)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450531783	DE	On-Demand	Anodyne	OPRK1	15	43
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531788	FI	On-Demand	Anodyne	RBP4	85	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531789	FI	On-Demand	Anodyne	RBP4	85	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531790	FI	On-Demand	Anodyne	RBP4	85	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531791	FI	On-Demand	Anodyne	RBP4	85	42
N#Cc1cccc(NC(=O)C2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)c1	ZINC000450531800	GG	On-Demand	Mild	CCR3	24	48
N#Cc1cccc(NC(=O)C2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)c1	ZINC000450531800	GG	On-Demand	Mild	MCHR1	49	40
OCc1cn(CCCNc2ccnc3cc(F)c(Cl)cc23)nn1	ZINC000450531816	EF	On-Demand	Anodyne	HRP1_PLAFA	108	41
OCc1cn(CCCNc2ccnc3cc(F)c(Cl)cc23)nn1	ZINC000450531816	EF	On-Demand	Anodyne	HNMT	63	44
CCc1cc(N2CCC(c3noc4cc(F)ccc34)CC2)ccn1	ZINC000450531817	EI	On-Demand	Anodyne	DRD2	16	61
CCc1cc(N2CCC(c3noc4cc(F)ccc34)CC2)ccn1	ZINC000450531817	EI	On-Demand	Anodyne	HTR2A	28	47
CCc1cc(N2CCC(c3noc4cc(F)ccc34)CC2)ccn1	ZINC000450531817	EI	On-Demand	Anodyne	HTR7	26	44
CCOc1cc(C(=O)N2CC[C@H](c3ccccc3)C[C@H]2C)ccc1OCC(=O)O	ZINC000450531819	GH	On-Demand	Anodyne	PTGDR2	24	45
CCOc1cc(C(=O)N2CC[C@@H](c3ccccc3)C[C@@H]2C)ccc1OCC(=O)O	ZINC000450531820	GH	On-Demand	Anodyne	PTGDR2	24	45
CCOc1cc(C(=O)N2CC[C@@H](c3ccccc3)C[C@H]2C)ccc1OCC(=O)O	ZINC000450531821	GH	On-Demand	Anodyne	PTGDR2	24	45
CCOc1cc(C(=O)N2CC[C@H](c3ccccc3)C[C@@H]2C)ccc1OCC(=O)O	ZINC000450531822	GH	On-Demand	Anodyne	PTGDR2	24	45
COc1cc(Br)c(C(=O)N2CCOCC3(CC3)C2)cc1OC	ZINC000450531830	FF	On-Demand	Anodyne	LRRK2	27	41
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531831	GH	On-Demand	Anodyne	PPARD	66	40
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531831	GH	On-Demand	Anodyne	BTK	15	40
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531831	GH	On-Demand	Anodyne	SHH	46	34
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531831	GH	On-Demand	Anodyne	SCD	30	40
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531831	GH	On-Demand	Anodyne	KCNK3	53	47
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450531831	GH	On-Demand	Anodyne	KCNK9	53	47
C[C@H](c1ccc(CN[C@](C)(C(N)=O)c2ccccc2)cc1)C(F)(F)F	ZINC000450531845	FH	On-Demand	Anodyne	PDS	42	38
C[C@H](c1ccc(CN[C@@](C)(C(N)=O)c2ccccc2)cc1)C(F)(F)F	ZINC000450531846	FH	On-Demand	Anodyne	PDS	42	38
C[C@@H](c1ccc(CN[C@@](C)(C(N)=O)c2ccccc2)cc1)C(F)(F)F	ZINC000450531847	FH	On-Demand	Anodyne	PDS	42	38
C[C@@H](c1ccc(CN[C@](C)(C(N)=O)c2ccccc2)cc1)C(F)(F)F	ZINC000450531848	FH	On-Demand	Anodyne	PDS	42	38
O=C(c1ccc(S(=O)(=O)C2CC2)cc1)N1CCC(CCCO)CC1	ZINC000450531850	FE	On-Demand	Anodyne	L3MBTL3	73	45
COC[C@]1(CNc2ncc([N+](=O)[O-])c(C)n2)OCCc2ccccc21	ZINC000450531863	EE	On-Demand	Bother	PRKCQ	41	35
COC[C@@]1(CNc2ncc([N+](=O)[O-])c(C)n2)OCCc2ccccc21	ZINC000450531864	EE	On-Demand	Bother	PRKCQ	41	35
Cc1cc(NC(=O)c2ccsc2C)ccc1OCCO	ZINC000450531876	CF	On-Demand	Anodyne	KCNK3	54	36
Cc1cc(NC(=O)c2ccsc2C)ccc1OCCO	ZINC000450531876	CF	On-Demand	Anodyne	KCNK9	54	36
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450531886	GE	On-Demand	Anodyne	MAPK1	30	41
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450531886	GE	On-Demand	Anodyne	EPHX2	21	50
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450531887	GE	On-Demand	Anodyne	MAPK1	30	41
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450531887	GE	On-Demand	Anodyne	EPHX2	21	50
Cc1nn(C)cc1CC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531912	FF	On-Demand	Anodyne	RBP4	24	40
Cc1nn(C)cc1CC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531913	FF	On-Demand	Anodyne	RBP4	24	40
CCN1CCN(c2ncnc3cc(Br)ccc23)[C@H](C)C1	ZINC000450531916	EF	On-Demand	Anodyne	HTT	0	43
CCN1CCN(c2ncnc3cc(Br)ccc23)[C@@H](C)C1	ZINC000450531917	EF	On-Demand	Anodyne	HTT	0	43
CCOC(=O)[C@H](CO)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450531918	DD	On-Demand	Anodyne	P2RY12	52	35
CCOC(=O)[C@H](CO)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450531918	DD	On-Demand	Anodyne	CHRM5	38	42
CCOC(=O)[C@@H](CO)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450531919	DD	On-Demand	Anodyne	P2RY12	52	35
CCOC(=O)[C@@H](CO)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450531919	DD	On-Demand	Anodyne	CHRM5	38	42
CN(C)c1nc(NC[C@@H]2CCCC[C@H]2NS(C)(=O)=O)nc2ccccc12	ZINC000450531924	GD	On-Demand	Anodyne	ADRA2A	20	66
CN(C)c1nc(NC[C@@H]2CCCC[C@H]2NS(C)(=O)=O)nc2ccccc12	ZINC000450531924	GD	On-Demand	Anodyne	NPY2R	16	66
CN(C)c1nc(NC[C@H]2CCCC[C@@H]2NS(C)(=O)=O)nc2ccccc12	ZINC000450531925	GD	On-Demand	Anodyne	ADRA2A	20	66
CN(C)c1nc(NC[C@H]2CCCC[C@@H]2NS(C)(=O)=O)nc2ccccc12	ZINC000450531925	GD	On-Demand	Anodyne	NPY2R	16	66
CN(C)c1nc(NC[C@H]2CCCC[C@H]2NS(C)(=O)=O)nc2ccccc12	ZINC000450531926	GD	On-Demand	Anodyne	ADRA2A	20	66
CN(C)c1nc(NC[C@H]2CCCC[C@H]2NS(C)(=O)=O)nc2ccccc12	ZINC000450531926	GD	On-Demand	Anodyne	NPY2R	16	66
CN(C)c1nc(NC[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)nc2ccccc12	ZINC000450531927	GD	On-Demand	Anodyne	ADRA2A	20	66
CN(C)c1nc(NC[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)nc2ccccc12	ZINC000450531927	GD	On-Demand	Anodyne	NPY2R	16	66
C[C@@H](O)C(C)(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450531928	DD	On-Demand	Anodyne	F7	28	41
C[C@H](O)C(C)(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450531929	DD	On-Demand	Anodyne	F7	28	41
CC(C)[C@@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450531937	CD	On-Demand	Anodyne	ENPP2	16	40
CC(C)[C@@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450531937	CD	On-Demand	Anodyne	HPGDS	16	45
O=C(NC1CCCCC1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450531941	DI	On-Demand	Anodyne	EPHX2	37	49
C[C@@H](O)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450531946	DG	On-Demand	Anodyne	RBP4	74	44
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	DRD4	30	42
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	CHRM3	17	45
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	HRH3	19	41
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	SIGMAR1	32	60
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	SSTR5	46	37
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	CCR3	27	44
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	CCR5	16	41
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	SLC6A5	29	42
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	EPHX2	37	47
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	MCHR1	56	44
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	CACNA1G	44	46
C[C@@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531951	GK	On-Demand	Anodyne	BIRC2	40	34
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	DRD4	30	42
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	CHRM3	17	45
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	HRH3	19	41
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	SIGMAR1	32	60
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	SSTR5	46	37
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	CCR3	27	44
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	CCR5	16	41
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	SLC6A5	29	42
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	EPHX2	37	47
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	MCHR1	56	44
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	CACNA1G	44	46
C[C@H](c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450531952	GK	On-Demand	Anodyne	BIRC2	40	34
O=C(CC1CC(F)(F)C1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450531960	FI	On-Demand	Anodyne	RBP4	84	42
O=C(CC1CC(F)(F)C1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450531961	FI	On-Demand	Anodyne	RBP4	84	42
COC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCOCC1	ZINC000450531964	FD	On-Demand	Anodyne	CTSV	44	31
COc1cccc(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)c1[N+](=O)[O-]	ZINC000450531966	FC	On-Demand	Bother	FOLH1	51	44
COc1cccc(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)c1[N+](=O)[O-]	ZINC000450531966	FC	On-Demand	Bother	ANPEP	31	40
COc1cccc(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)c1[N+](=O)[O-]	ZINC000450531966	FC	On-Demand	Bother	FPR1	42	32
COc1cccc(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)c1[N+](=O)[O-]	ZINC000450531966	FC	On-Demand	Bother	NPR	54	35
CCOC(=O)[C@@H](CO)NC(=O)c1ccccc1-n1ccc(C)n1	ZINC000450531967	DC	On-Demand	Anodyne	CCR3	0	42
CCOC(=O)[C@H](CO)NC(=O)c1ccccc1-n1ccc(C)n1	ZINC000450531968	DC	On-Demand	Anodyne	CCR3	0	42
O=C(NC1CCCCC1)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450531971	DH	On-Demand	Anodyne	EPHX2	35	50
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	F2	58	35
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	ACE	34	44
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	FKBP1A	48	48
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	OPRM1	20	47
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	ELANE	44	37
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	CTRA_BOVIN	51	32
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	PRSS3	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	MMP13	54	44
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	TRY1_BOVIN	85	35
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	CTSG	40	32
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	CCR4	0	42
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	ADAM17	53	42
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	ITGA4	68	50
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	CAPNS1	22	55
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	MMP3	57	44
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	MMP8	32	42
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	CELA2A	48	32
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	LGMN	48	36
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	CAPN1	30	57
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	MMP9	31	42
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	MMP7	74	44
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	MMP1	62	47
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	XIAP	57	39
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	SFRP1	43	33
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	WNT3	48	33
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	BRCA1	58	32
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531972	FB	On-Demand	Anodyne	TMPRSS11D	54	35
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	F2	58	35
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	ACE	34	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	FKBP1A	48	48
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	OPRM1	20	47
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	ELANE	44	37
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	CTRA_BOVIN	51	32
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	PRSS3	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	MMP13	54	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	TRY1_BOVIN	85	35
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	CTSG	40	32
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	CCR4	0	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	ADAM17	53	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	ITGA4	68	50
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	CAPNS1	22	55
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	MMP3	57	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	MMP8	32	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	CELA2A	48	32
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	LGMN	48	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	CAPN1	30	57
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	MMP9	31	42
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	MMP7	74	44
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	MMP1	62	47
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	XIAP	57	39
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	SFRP1	43	33
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	WNT3	48	33
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	BRCA1	58	32
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450531973	FB	On-Demand	Anodyne	TMPRSS11D	54	35
Cc1nn(C)cc1CC(=O)N[C@H](c1ccc(Cl)cc1F)C(C)C	ZINC000450531980	EH	On-Demand	Anodyne	MC4R	17	40
Cc1nn(C)cc1CC(=O)N[C@H](c1ccc(Cl)cc1F)C(C)C	ZINC000450531980	EH	On-Demand	Anodyne	MC5R	0	40
Cc1nn(C)cc1CC(=O)N[C@@H](c1ccc(Cl)cc1F)C(C)C	ZINC000450531981	EH	On-Demand	Anodyne	MC4R	17	40
Cc1nn(C)cc1CC(=O)N[C@@H](c1ccc(Cl)cc1F)C(C)C	ZINC000450531981	EH	On-Demand	Anodyne	MC5R	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC)CC(C)C	ZINC000450531982	CD	On-Demand	Anodyne	KLK3	45	34
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC)CC(C)C	ZINC000450531982	CD	On-Demand	Anodyne	CAPN2	51	36
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC)CC(C)C	ZINC000450531982	CD	On-Demand	Anodyne	NPR	28	48
CCOC(=O)[C@@H](CO)NC(=O)[C@H](CC)CC(C)C	ZINC000450531982	CD	On-Demand	Anodyne	SLC15A2	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC)CC(C)C	ZINC000450531983	CD	On-Demand	Anodyne	KLK3	45	34
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC)CC(C)C	ZINC000450531983	CD	On-Demand	Anodyne	CAPN2	51	36
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC)CC(C)C	ZINC000450531983	CD	On-Demand	Anodyne	NPR	28	48
CCOC(=O)[C@H](CO)NC(=O)[C@H](CC)CC(C)C	ZINC000450531983	CD	On-Demand	Anodyne	SLC15A2	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H](CC)CC(C)C	ZINC000450531984	CD	On-Demand	Anodyne	KLK3	45	34
CCOC(=O)[C@H](CO)NC(=O)[C@@H](CC)CC(C)C	ZINC000450531984	CD	On-Demand	Anodyne	CAPN2	51	36
CCOC(=O)[C@H](CO)NC(=O)[C@@H](CC)CC(C)C	ZINC000450531984	CD	On-Demand	Anodyne	NPR	28	48
CCOC(=O)[C@H](CO)NC(=O)[C@@H](CC)CC(C)C	ZINC000450531984	CD	On-Demand	Anodyne	SLC15A2	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](CC)CC(C)C	ZINC000450531985	CD	On-Demand	Anodyne	KLK3	45	34
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](CC)CC(C)C	ZINC000450531985	CD	On-Demand	Anodyne	CAPN2	51	36
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](CC)CC(C)C	ZINC000450531985	CD	On-Demand	Anodyne	NPR	28	48
CCOC(=O)[C@@H](CO)NC(=O)[C@@H](CC)CC(C)C	ZINC000450531985	CD	On-Demand	Anodyne	SLC15A2	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(N(C)C)n1	ZINC000450531988	DH	On-Demand	Anodyne	GRM5	16	43
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(N(C)C)n1	ZINC000450531988	DH	On-Demand	Anodyne	SORT1	39	60
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(N(C)C)n1	ZINC000450531988	DH	On-Demand	Anodyne	MTTP	58	35
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	CHRM2	20	40
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	CHRM1	25	43
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	DRD2	21	53
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	DRD4	21	44
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	ACHE	23	44
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	HTR2A	17	45
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	SLC6A1	66	33
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	DRD3	17	53
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	LTA4H	21	44
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	HTR7	19	41
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	HRH3	18	48
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	SIGMAR1	60	48
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	NPY2R	41	35
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	CCR3	42	40
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	CCR5	54	40
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	C3AR1	40	35
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	AMY2	44	30
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	SLC6A5	20	40
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	EPHX2	41	47
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	MCHR1	30	40
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	CACNA1G	42	41
CN(CCN1CCC(NC(=O)C2CCCCC2)CC1)Cc1ccccc1	ZINC000450531989	FG	On-Demand	Anodyne	BIRC2	34	41
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@H](CO)CC1CCCC1	ZINC000450531991	FF	On-Demand	Anodyne	PRMT3	40	36
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	CHRM2	15	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	ACHE	18	48
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	CHRM3	20	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	GRIN2B	31	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	MMP13	16	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	ST14	63	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	CACNA1I	53	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	L3MBTL3	59	39
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(CCCO)CC3)cc2)c1	ZINC000450532001	GH	On-Demand	Anodyne	TMPRSS6	44	31
CC(C)c1ncsc1C(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450532004	EG	On-Demand	Anodyne	KCNK3	58	38
CC(C)c1ncsc1C(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450532004	EG	On-Demand	Anodyne	KCNK9	75	38
CC(C)CCCC(=O)N1CCC(CCCO)CC1	ZINC000450532005	CF	On-Demand	Anodyne	GNAI1	0	47
CC(C)CCCC(=O)N1CCC(CCCO)CC1	ZINC000450532005	CF	On-Demand	Anodyne	GNAI3	0	49
CC(C)CCCC(=O)N1CCC(CCCO)CC1	ZINC000450532005	CF	On-Demand	Anodyne	GNAO1	0	47
COc1cc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532006	EF	On-Demand	Anodyne	FKBP1A	41	35
COc1cc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532006	EF	On-Demand	Anodyne	OPRM1	0	48
COc1cc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532006	EF	On-Demand	Anodyne	OPRK1	25	48
COc1cc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532006	EF	On-Demand	Anodyne	COLA	118	41
COc1cc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532006	EF	On-Demand	Anodyne	CPT1A	103	41
COc1cc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532007	EF	On-Demand	Anodyne	FKBP1A	41	35
COc1cc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532007	EF	On-Demand	Anodyne	OPRM1	0	48
COc1cc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532007	EF	On-Demand	Anodyne	OPRK1	25	48
COc1cc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532007	EF	On-Demand	Anodyne	COLA	118	41
COc1cc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)ccc1Cl	ZINC000450532007	EF	On-Demand	Anodyne	CPT1A	103	41
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCOC1	ZINC000450532016	BC	On-Demand	Anodyne	PHZR	0	40
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCOC1	ZINC000450532017	BC	On-Demand	Anodyne	PHZR	0	40
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)CC1	ZINC000450532018	GG	On-Demand	Anodyne	EPHX2	15	46
O=C(Nc1ccc(Br)cc1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450532021	GI	On-Demand	Anodyne	MAPK1	20	42
O=C(Nc1ccc(Br)cc1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450532021	GI	On-Demand	Anodyne	EPHX2	20	47
Cc1nc(N2C[C@@H](CO)[C@H](c3ccc(Cl)cc3)C2)ncc1[N+](=O)[O-]	ZINC000450532022	EF	On-Demand	Bother	SLC6A1	0	43
CC(C)CCCC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532023	CF	On-Demand	Anodyne	COLA	117	39
CC(C)CCCC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532023	CF	On-Demand	Anodyne	CPT1A	103	39
CC(C)CCCC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532024	CF	On-Demand	Anodyne	COLA	117	39
CC(C)CCCC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532024	CF	On-Demand	Anodyne	CPT1A	103	39
CCc1oc(C(=O)N2CC[C@@H](c3ccccc3)C[C@@H]2C)cc1C(=O)O	ZINC000450532026	EH	On-Demand	Anodyne	SLC18A3	41	36
CCc1oc(C(=O)N2CC[C@H](c3ccccc3)C[C@H]2C)cc1C(=O)O	ZINC000450532027	EH	On-Demand	Anodyne	SLC18A3	41	36
CCc1oc(C(=O)N2CC[C@@H](c3ccccc3)C[C@H]2C)cc1C(=O)O	ZINC000450532028	EH	On-Demand	Anodyne	SLC18A3	41	36
CCc1oc(C(=O)N2CC[C@H](c3ccccc3)C[C@@H]2C)cc1C(=O)O	ZINC000450532029	EH	On-Demand	Anodyne	SLC18A3	41	36
Cc1ccc(C(=O)N2CCC(CCCO)CC2)c(Cl)c1Cl	ZINC000450532043	EH	On-Demand	Anodyne	P2RX7	28	40
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC(CCCO)CC1	ZINC000450532044	EF	On-Demand	Anodyne	P2RY12	53	33
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC(CCCO)CC1	ZINC000450532044	EF	On-Demand	Anodyne	AKR1C3	0	41
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)N2CCC(CCCO)CC2)CC3)c1	ZINC000450532047	GF	On-Demand	Anodyne	ST14	41	33
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)N2CCC(CCCO)CC2)CC3)c1	ZINC000450532047	GF	On-Demand	Anodyne	TMPRSS6	41	33
Cc1cccc(-c2nnc3n2C[C@H](C(=O)N2CCC(CCCO)CC2)CC3)c1	ZINC000450532048	GF	On-Demand	Anodyne	ST14	41	33
Cc1cccc(-c2nnc3n2C[C@H](C(=O)N2CCC(CCCO)CC2)CC3)c1	ZINC000450532048	GF	On-Demand	Anodyne	TMPRSS6	41	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCO)CC1	ZINC000450532049	EH	On-Demand	Anodyne	CHRM2	16	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCO)CC1	ZINC000450532049	EH	On-Demand	Anodyne	CACNA1B	43	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCO)CC1	ZINC000450532049	EH	On-Demand	Anodyne	LIPC	0	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCO)CC1	ZINC000450532049	EH	On-Demand	Anodyne	CCR2	26	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCO)CC1	ZINC000450532049	EH	On-Demand	Anodyne	AKR1C3	0	50
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCO)CC1	ZINC000450532049	EH	On-Demand	Anodyne	LIPG	53	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCO)CC1	ZINC000450532049	EH	On-Demand	Anodyne	L3MBTL1	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCO)CC1	ZINC000450532049	EH	On-Demand	Anodyne	L3MBTL3	49	40
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)CCC(=O)O	ZINC000450532050	CF	On-Demand	Anodyne	SLC18A3	51	36
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCC(=O)O	ZINC000450532051	CF	On-Demand	Anodyne	SLC18A3	51	36
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCC(=O)O	ZINC000450532052	CF	On-Demand	Anodyne	SLC18A3	51	36
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)CCC(=O)O	ZINC000450532053	CF	On-Demand	Anodyne	SLC18A3	51	36
COc1ccc(CC(=O)Nc2ccc(OCCO)c(C)c2)c(Cl)c1OC	ZINC000450532054	GG	On-Demand	Anodyne	PDE6A	43	34
COc1ccc(CC(=O)Nc2ccc(OCCO)c(C)c2)c(Cl)c1OC	ZINC000450532054	GG	On-Demand	Anodyne	ENPP1	71	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450532055	FF	On-Demand	Anodyne	ANPEP	25	41
O=C(CCc1ccc(C(=O)O)cc1)NCCCCc1ccc(F)c(F)c1	ZINC000450532074	FH	On-Demand	Anodyne	CRTM	40	36
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1(CCOCc2ccccc2)CC1	ZINC000450532076	GH	On-Demand	Bother	CACNA1D	21	40
CSC1(CNc2ccnc3cc(F)c(Cl)cc23)CCN(C)CC1	ZINC000450532080	FI	On-Demand	Anodyne	HRP1_PLAFA	117	38
CSC1(CNc2ccnc3cc(F)c(Cl)cc23)CCN(C)CC1	ZINC000450532080	FI	On-Demand	Anodyne	HNMT	58	38
O=C(CCc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450532104	FH	On-Demand	Anodyne	LIPC	0	46
O=C(CCc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450532104	FH	On-Demand	Anodyne	MTNR1B	22	42
O=C(CCc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450532104	FH	On-Demand	Anodyne	PTPRA	48	33
O=C(CCc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450532104	FH	On-Demand	Anodyne	SLC6A5	26	41
O=C(CCc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450532104	FH	On-Demand	Anodyne	POLG_WNV	43	32
O=C(CCc1ccccc1C(=O)O)NCCCCc1ccc(F)c(F)c1	ZINC000450532104	FH	On-Demand	Anodyne	CRTM	41	37
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)nc1	ZINC000450532122	GF	On-Demand	Mild	P2RY12	56	45
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)nc1	ZINC000450532122	GF	On-Demand	Mild	SSTR5	46	40
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)nc1	ZINC000450532122	GF	On-Demand	Mild	CCR3	30	45
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)nc1	ZINC000450532122	GF	On-Demand	Mild	MCHR1	54	39
O=C(c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)N1CCC(CCCO)CC1	ZINC000450532136	FE	On-Demand	Bother	L3MBTL3	29	40
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@@H](CO)CC1CCCC1	ZINC000450532143	FF	On-Demand	Anodyne	PRMT3	40	36
COc1ccc2c(c1)C[C@@H](C(=O)N1C[C@@H](C(=O)O)[C@H](c3ccccc3)C1)CO2	ZINC000450532145	GF	On-Demand	Anodyne	EDNRB	43	38
COc1ccc2c(c1)C[C@@H](C(=O)N1C[C@@H](C(=O)O)[C@H](c3ccccc3)C1)CO2	ZINC000450532145	GF	On-Demand	Anodyne	ROCK2	27	44
COc1ccc2c(c1)C[C@@H](C(=O)N1C[C@@H](C(=O)O)[C@H](c3ccccc3)C1)CO2	ZINC000450532145	GF	On-Demand	Anodyne	CDC42BPA	0	40
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1Cl	ZINC000450532149	EG	On-Demand	Anodyne	S1PR4	22	42
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1Cl	ZINC000450532149	EG	On-Demand	Anodyne	PDE6A	44	35
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1Cl	ZINC000450532149	EG	On-Demand	Anodyne	SCD1	33	43
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1Cl	ZINC000450532149	EG	On-Demand	Anodyne	SCD	24	43
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1Cl	ZINC000450532149	EG	On-Demand	Anodyne	PFK	0	42
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1Cl	ZINC000450532149	EG	On-Demand	Anodyne	ENPP1	59	37
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1Cl	ZINC000450532149	EG	On-Demand	Anodyne	IMDH_CRYPV	23	44
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1Cl	ZINC000450532149	EG	On-Demand	Anodyne	CAN2	0	40
COc1ccc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c(Cl)c1OC	ZINC000450532155	FF	On-Demand	Anodyne	COLA	112	41
COc1ccc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c(Cl)c1OC	ZINC000450532155	FF	On-Demand	Anodyne	CPT1A	97	41
COc1ccc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c(Cl)c1OC	ZINC000450532157	FF	On-Demand	Anodyne	COLA	112	41
COc1ccc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c(Cl)c1OC	ZINC000450532157	FF	On-Demand	Anodyne	CPT1A	97	41
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	RARA	58	38
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	SRD5A2	29	42
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	RARG	67	40
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	RXRG	75	41
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	RARB	58	40
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	RXRA	60	41
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	RXRB	77	43
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	EPHX2	19	48
C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532158	DG	On-Demand	Anodyne	SLC6A7	0	40
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	RARA	58	38
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	SRD5A2	29	42
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	RARG	67	40
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	RXRG	75	41
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	RARB	58	40
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	RXRA	60	41
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	RXRB	77	43
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	EPHX2	19	48
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(=O)O)cc2)C1	ZINC000450532160	DG	On-Demand	Anodyne	SLC6A7	0	40
CCCc1cc(C(=O)Nc2ccc(OCCO)c(C)c2)no1	ZINC000450532162	DF	On-Demand	Anodyne	ENR	0	42
CC(C)N1CCCC[C@H]1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450532173	EG	On-Demand	Anodyne	EPHX2	26	46
CC(C)N1CCCC[C@@H]1CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450532176	EG	On-Demand	Anodyne	EPHX2	26	46
CCCOc1cccc(CC(=O)NC(CC)(CC)C(=O)O)c1	ZINC000450532177	DF	On-Demand	Anodyne	ACACA	30	40
CCCOc1cccc(CC(=O)NC(CC)(CC)C(=O)O)c1	ZINC000450532177	DF	On-Demand	Anodyne	UPP1	50	39
CCCOc1cccc(CC(=O)NC(CC)(CC)C(=O)O)c1	ZINC000450532177	DF	On-Demand	Anodyne	MTNR1A	28	44
CCCOc1cccc(CC(=O)NC(CC)(CC)C(=O)O)c1	ZINC000450532177	DF	On-Demand	Anodyne	PLA2G4B	64	47
CCCOc1cccc(CC(=O)NC(CC)(CC)C(=O)O)c1	ZINC000450532177	DF	On-Demand	Anodyne	TSPAN17	0	48
CCCOc1cccc(CC(=O)NC(CC)(CC)C(=O)O)c1	ZINC000450532177	DF	On-Demand	Anodyne	PDS	77	37
O=C(c1cc2n(n1)CCC2)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450532178	FG	On-Demand	Anodyne	RBP4	68	39
O=C(c1cc2n(n1)CCC2)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450532181	FG	On-Demand	Anodyne	RBP4	68	39
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450532182	GH	On-Demand	Anodyne	ACE	35	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450532182	GH	On-Demand	Anodyne	PREP	43	35
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450532183	FG	On-Demand	Anodyne	P2RY12	80	44
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450532184	FG	On-Demand	Anodyne	P2RY12	80	44
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450532185	GH	On-Demand	Anodyne	ACE	35	40
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450532185	GH	On-Demand	Anodyne	PREP	43	35
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450532187	GH	On-Demand	Anodyne	ACE	35	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450532187	GH	On-Demand	Anodyne	PREP	43	35
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450532190	GH	On-Demand	Anodyne	ACE	35	40
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450532190	GH	On-Demand	Anodyne	PREP	43	35
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	DRD2	33	55
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	FKBP1A	28	41
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	DRD4	55	57
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	ACHE	32	51
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	HRH2	22	41
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	HRH1	21	51
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	DRD3	30	57
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	HTR3A	0	50
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	KCNH2	18	43
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	HTR4	75	51
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	CHRM3	17	44
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	HRH3	18	42
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	SIGMAR1	43	62
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	SSTR5	95	51
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	CCR1	32	40
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	CCR3	53	43
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	BDKRB1	42	40
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	UTS2R	33	46
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	EPHX2	40	49
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	PDK1	52	41
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	MCHR1	64	56
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	STK17B	43	38
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	CACNA1G	40	50
COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)ccc1Cl	ZINC000450532195	FI	On-Demand	Anodyne	CCR8	24	47
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450532206	FF	On-Demand	Anodyne	CCR5	30	43
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450532208	FF	On-Demand	Anodyne	CCR5	30	43
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	CHRM2	17	48
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	CHRM1	19	48
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	DRD2	23	51
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	DRD4	42	49
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	ACHE	31	44
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	HRH2	33	48
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	DRD3	0	45
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	KCNH2	15	41
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	CHRM3	34	48
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	HRH3	15	41
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	SIGMAR1	37	57
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	SSTR5	65	42
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	CCR3	62	48
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	BDKRB1	39	43
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	FAAH	25	46
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	EPHX2	41	52
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	CXCR3	29	52
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	MCHR1	63	48
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	CACNA1G	35	41
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	CCR8	22	45
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	ADIPOR1	0	43
CC(=O)c1cccc(CN2CCC(NC(=O)C3CCCCC3)CC2)c1	ZINC000450532213	EH	On-Demand	Anodyne	ADIPOR2	0	43
COc1cc(CC(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450532214	GH	On-Demand	Anodyne	RBP4	82	41
COc1cc(CC(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450532214	GH	On-Demand	Anodyne	RORC	44	35
COc1cc(CC(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450532215	GH	On-Demand	Anodyne	RBP4	82	41
COc1cc(CC(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450532215	GH	On-Demand	Anodyne	RORC	44	35
CS(=O)(=O)NCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532216	GE	On-Demand	Anodyne	PDE3A	48	36
CS(=O)(=O)NCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532216	GE	On-Demand	Anodyne	PDGFRB	53	42
CS(=O)(=O)NCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532216	GE	On-Demand	Anodyne	AKT2	19	40
CS(=O)(=O)NCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532216	GE	On-Demand	Anodyne	PDE3B	71	37
CS(=O)(=O)NCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532216	GE	On-Demand	Anodyne	SIRT3	69	47
CS(=O)(=O)NCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532216	GE	On-Demand	Anodyne	SIRT2	60	47
CS(=O)(=O)NCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532216	GE	On-Demand	Anodyne	SIRT1	60	47
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532221	FH	On-Demand	Anodyne	MC4R	35	45
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532221	FH	On-Demand	Anodyne	PRCP	55	42
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532221	FH	On-Demand	Anodyne	MC3R	42	45
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532221	FH	On-Demand	Anodyne	MC5R	35	45
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532223	FH	On-Demand	Anodyne	MC4R	35	45
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532223	FH	On-Demand	Anodyne	PRCP	55	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532223	FH	On-Demand	Anodyne	MC3R	42	45
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532223	FH	On-Demand	Anodyne	MC5R	35	45
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532224	FH	On-Demand	Anodyne	MC4R	35	45
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532224	FH	On-Demand	Anodyne	PRCP	55	42
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532224	FH	On-Demand	Anodyne	MC3R	42	45
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532224	FH	On-Demand	Anodyne	MC5R	35	45
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532225	FH	On-Demand	Anodyne	MC4R	35	45
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532225	FH	On-Demand	Anodyne	PRCP	55	42
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532225	FH	On-Demand	Anodyne	MC3R	42	45
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(CCCO)CC1	ZINC000450532225	FH	On-Demand	Anodyne	MC5R	35	45
Cc1ccn(-c2ccccc2C(=O)N2CCC(CCCO)CC2)n1	ZINC000450532229	EF	On-Demand	Anodyne	AKR1C3	15	44
C[C@]1(CCCO)CCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450532236	DH	On-Demand	Anodyne	FFAR2	47	30
C[C@@]1(CCCO)CCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450532237	DH	On-Demand	Anodyne	FFAR2	47	30
N#Cc1cccc(NC(=O)C2CCN(CC3=CCCCC3)CC2)c1	ZINC000450532240	DH	On-Demand	Mild	MCHR1	40	39
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532256	EG	On-Demand	Anodyne	EPHX2	33	52
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532257	EG	On-Demand	Anodyne	EPHX2	33	52
O=C(O)C[C@H]1COCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450532264	DD	On-Demand	Anodyne	OPRK1	39	45
O=C(O)C[C@@H]1COCCN1C(=O)Cc1ccc(Cl)c(F)c1	ZINC000450532265	DD	On-Demand	Anodyne	OPRK1	39	45
COC(=O)C1(CNC(=O)c2c(F)ccc(SCC3CC3)c2F)CCOCC1	ZINC000450532267	GG	On-Demand	Anodyne	SLC6A9	22	41
COC(=O)c1csc(CN2CCC(C(=O)NC3CCCCC3)CC2)n1	ZINC000450532268	FF	On-Demand	Anodyne	EPHX2	33	52
O=C([C@H]1CC1(F)F)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450532272	EG	On-Demand	Anodyne	RBP4	25	41
O=C([C@@H]1CC1(F)F)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450532273	EG	On-Demand	Anodyne	RBP4	25	41
O=C([C@@H]1CC1(F)F)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450532274	EG	On-Demand	Anodyne	RBP4	25	41
O=C([C@H]1CC1(F)F)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450532275	EG	On-Demand	Anodyne	RBP4	25	41
O=C(NCCc1cccs1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450532280	GI	On-Demand	Anodyne	DRD4	22	42
O=C(NCCc1cccs1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450532280	GI	On-Demand	Anodyne	MC4R	15	45
O=C(NCCc1cccs1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450532280	GI	On-Demand	Anodyne	SIGMAR1	22	43
O=C(NCCc1cccs1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450532280	GI	On-Demand	Anodyne	ADAM17	0	48
O=C(NCCc1cccs1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450532280	GI	On-Demand	Anodyne	EPHX2	17	43
O=C(NCCc1cccs1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450532280	GI	On-Demand	Anodyne	CACNA1G	42	44
O=C(NCCc1cccs1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450532280	GI	On-Demand	Anodyne	GPBAR1	27	48
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532300	EG	On-Demand	Anodyne	COLA	73	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532300	EG	On-Demand	Anodyne	CPT1A	69	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532300	EG	On-Demand	Anodyne	LIPG	47	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532301	EG	On-Demand	Anodyne	COLA	73	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532301	EG	On-Demand	Anodyne	CPT1A	69	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532301	EG	On-Demand	Anodyne	LIPG	47	33
O=C(c1ccnc(OC(F)F)c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532303	DE	On-Demand	Anodyne	CPT1A	61	34
O=C(c1ccnc(OC(F)F)c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532304	DE	On-Demand	Anodyne	CPT1A	61	34
Cc1nc(NC[C@H]2CC[C@@H](c3ccccc3)O2)ncc1[N+](=O)[O-]	ZINC000450532309	DE	On-Demand	Bother	PRKCQ	55	46
Cc1nc(NC[C@H]2CC[C@H](c3ccccc3)O2)ncc1[N+](=O)[O-]	ZINC000450532310	DE	On-Demand	Bother	PRKCQ	55	46
N#CC1(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)CCC1	ZINC000450532322	GH	On-Demand	Mild	DHODH	28	41
COc1cc(CC(=O)N2CCC(CCCO)CC2)ccc1Cl	ZINC000450532323	EF	On-Demand	Anodyne	OPRK1	41	41
COc1cc(CC(=O)N2CCC(CCCO)CC2)ccc1Cl	ZINC000450532323	EF	On-Demand	Anodyne	HTR4	42	38
COc1cc(CC(=O)N2CCC(CCCO)CC2)ccc1Cl	ZINC000450532323	EF	On-Demand	Anodyne	CCR1	22	43
COc1cc(CC(=O)N2CCC(CCCO)CC2)ccc1Cl	ZINC000450532323	EF	On-Demand	Anodyne	CCR3	24	42
C[C@]1(CCCO)CCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450532331	GH	On-Demand	Anodyne	PDE6D	80	39
C[C@]1(CCCO)CCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450532331	GH	On-Demand	Anodyne	IMDH_CRYPV	28	44
C[C@@]1(CCCO)CCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450532332	GH	On-Demand	Anodyne	PDE6D	80	39
C[C@@]1(CCCO)CCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450532332	GH	On-Demand	Anodyne	IMDH_CRYPV	28	44
N#Cc1cccc(NC(=O)C2CCN(C[C@H]3COCCO3)CC2)c1	ZINC000450532333	ED	On-Demand	Mild	CCR3	26	44
N#Cc1cccc(NC(=O)C2CCN(C[C@@H]3COCCO3)CC2)c1	ZINC000450532334	ED	On-Demand	Mild	CCR3	26	44
CCc1cc(CCCN2CCC(C(=O)Nc3ccc(O)cc3)CC2)on1	ZINC000450532341	FG	On-Demand	Anodyne	CHRNA7	18	40
Cc1cccc(Cl)c1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450532345	FI	On-Demand	Anodyne	SIGMAR1	15	42
Cc1cccc(Cl)c1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450532345	FI	On-Demand	Anodyne	MAPK1	36	49
Cc1cccc(Cl)c1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450532345	FI	On-Demand	Anodyne	EPHX2	31	42
O=C(O)[C@H]1CCC[C@H](C(=O)NCCCCc2ccc(F)c(F)c2)C1	ZINC000450532350	EG	On-Demand	Anodyne	GPBAR1	28	40
O=C(O)[C@H]1CCC[C@@H](C(=O)NCCCCc2ccc(F)c(F)c2)C1	ZINC000450532351	EG	On-Demand	Anodyne	GPBAR1	28	40
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450532352	EG	On-Demand	Anodyne	GPBAR1	28	40
O=C(O)[C@@H]1CCC[C@@H](C(=O)NCCCCc2ccc(F)c(F)c2)C1	ZINC000450532353	EG	On-Demand	Anodyne	GPBAR1	28	40
CCOC(=O)c1csc(NCc2ccc(C#N)c(OC)c2)n1	ZINC000450532374	DE	On-Demand	Mild	MAPK9	31	44
CCOC(=O)c1csc(NCc2ccc(C#N)c(OC)c2)n1	ZINC000450532374	DE	On-Demand	Mild	MAPK8	19	44
CCOC(=O)c1csc(NCc2ccc(C#N)c(OC)c2)n1	ZINC000450532374	DE	On-Demand	Mild	DRTS_TRYCR	47	35
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450532381	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450532381	EH	On-Demand	Anodyne	SLC18A3	53	41
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450532382	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450532382	EH	On-Demand	Anodyne	SLC18A3	53	41
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450532383	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450532383	EH	On-Demand	Anodyne	SLC18A3	53	41
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450532384	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450532384	EH	On-Demand	Anodyne	SLC18A3	53	41
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450532385	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450532385	EH	On-Demand	Anodyne	SLC18A3	53	41
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450532386	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450532386	EH	On-Demand	Anodyne	SLC18A3	53	41
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450532387	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450532387	EH	On-Demand	Anodyne	SLC18A3	53	41
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450532388	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450532388	EH	On-Demand	Anodyne	SLC18A3	53	41
Cc1cc(NC(=O)CSC2CC2)ccc1OCCO	ZINC000450532389	CE	On-Demand	Anodyne	QRFPR	44	36
Cc1cc(NC(=O)CSC2CC2)ccc1OCCO	ZINC000450532389	CE	On-Demand	Anodyne	ENPP1	62	39
CO[C@H](C)[C@@H](C)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450532390	DF	On-Demand	Bother	MAOB	31	52
CO[C@@H](C)[C@@H](C)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450532391	DF	On-Demand	Bother	MAOB	31	52
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	F2	63	38
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	P2RY12	48	42
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	ELANE	51	37
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	HCRTR1	17	40
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	TRY1_BOVIN	64	36
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	PREP	92	44
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	LGMN	77	38
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	CFTR	62	39
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	HCRTR2	0	40
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	XIAP	43	37
CCOC(=O)c1cnc(C)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450532392	GF	On-Demand	Anodyne	TMPRSS11D	55	33
CCOC(=O)[C@@H](CO)NC(=O)c1ccc2cnccc2c1	ZINC000450532407	CC	On-Demand	Anodyne	AKT1	24	45
CCOC(=O)[C@H](CO)NC(=O)c1ccc2cnccc2c1	ZINC000450532408	CC	On-Demand	Anodyne	AKT1	24	45
C[C@@H]1C[C@]1(C#N)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450532411	EG	On-Demand	Mild	RBP4	76	43
C[C@@H]1C[C@]1(C#N)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450532412	EG	On-Demand	Mild	RBP4	76	43
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450532413	EG	On-Demand	Mild	RBP4	76	43
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450532414	EG	On-Demand	Mild	RBP4	76	43
CC(C)O[C@@]1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450532426	GG	On-Demand	Anodyne	RBP4	92	40
CC(C)O[C@]1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450532427	GG	On-Demand	Anodyne	RBP4	92	40
CC(C)O[C@]1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450532428	GG	On-Demand	Anodyne	RBP4	92	40
CC(C)O[C@@]1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450532429	GG	On-Demand	Anodyne	RBP4	92	40
CCOC(=O)[C@H](CO)NC(=O)C1(c2ccccc2Br)CCCCC1	ZINC000450532443	GF	On-Demand	Anodyne	TIMP3	50	33
CCOC(=O)[C@@H](CO)NC(=O)C1(c2ccccc2Br)CCCCC1	ZINC000450532444	GF	On-Demand	Anodyne	TIMP3	50	33
CCOC(=O)c1cnc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)c1	ZINC000450532447	EF	On-Demand	Anodyne	CACNA1C	45	36
CCOC(=O)c1cnc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)c1	ZINC000450532447	EF	On-Demand	Anodyne	P2RY12	24	40
CCOC(=O)c1cnc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)c1	ZINC000450532447	EF	On-Demand	Anodyne	CCR1	0	40
CCOC(=O)c1cnc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)c1	ZINC000450532447	EF	On-Demand	Anodyne	GPR142	51	34
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)c1	ZINC000450532448	EF	On-Demand	Anodyne	CACNA1C	45	36
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)c1	ZINC000450532448	EF	On-Demand	Anodyne	P2RY12	24	40
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)c1	ZINC000450532448	EF	On-Demand	Anodyne	CCR1	0	40
CCOC(=O)c1cnc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)c1	ZINC000450532448	EF	On-Demand	Anodyne	GPR142	51	34
CC[C@@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532457	GE	On-Demand	Anodyne	PDGFRB	79	48
CC[C@@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532457	GE	On-Demand	Anodyne	AKT2	24	45
CC[C@@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532457	GE	On-Demand	Anodyne	AKT3	30	45
CC[C@@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532457	GE	On-Demand	Anodyne	PDE3B	45	32
CC[C@@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532457	GE	On-Demand	Anodyne	AKT1	32	45
CC[C@@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532457	GE	On-Demand	Anodyne	SIRT3	84	34
CC[C@@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532457	GE	On-Demand	Anodyne	SIRT2	69	33
CC[C@@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532457	GE	On-Demand	Anodyne	SIRT1	61	33
CC[C@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532458	GE	On-Demand	Anodyne	PDGFRB	79	48
CC[C@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532458	GE	On-Demand	Anodyne	AKT2	24	45
CC[C@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532458	GE	On-Demand	Anodyne	AKT3	30	45
CC[C@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532458	GE	On-Demand	Anodyne	PDE3B	45	32
CC[C@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532458	GE	On-Demand	Anodyne	AKT1	32	45
CC[C@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532458	GE	On-Demand	Anodyne	SIRT3	84	34
CC[C@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532458	GE	On-Demand	Anodyne	SIRT2	69	33
CC[C@H](C(=O)OC)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450532458	GE	On-Demand	Anodyne	SIRT1	61	33
O=C(NC1CCN(CC23CCC(CC2)C3)CC1)C1CCCCC1	ZINC000450532461	DH	On-Demand	Anodyne	EPHX2	30	44
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	DRD4	28	40
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	HRH2	20	40
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	CHRM3	16	43
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	HRH3	24	45
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	SIGMAR1	33	67
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	SSTR5	46	37
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	CCR3	21	44
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	HSP90AA1	16	40
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	SLC6A5	29	42
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	EPHX2	42	53
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	MCHR1	58	42
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	CACNA1G	47	48
C[C@@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532473	GK	On-Demand	Anodyne	BIRC2	44	36
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	DRD4	28	40
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	HRH2	20	40
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	CHRM3	16	43
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	HRH3	24	45
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	SIGMAR1	33	67
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	SSTR5	46	37
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	CCR3	21	44
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	HSP90AA1	16	40
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	SLC6A5	29	42
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	EPHX2	42	53
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	MCHR1	58	42
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	CACNA1G	47	48
C[C@H](c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1)C(F)(F)F	ZINC000450532474	GK	On-Demand	Anodyne	BIRC2	44	36
CCOC(=O)c1cnc(C)c(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450532487	GG	On-Demand	Bother	CACNA1C	62	41
CCOC(=O)c1cnc(C)c(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450532487	GG	On-Demand	Bother	CACNA1D	93	40
CCOC(=O)c1cnc(C)c(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450532487	GG	On-Demand	Bother	IRAK4	22	40
O=C(NC1CCN(C[C@@H]2CCCCC2(F)F)CC1)C1CCCCC1	ZINC000450532488	EH	On-Demand	Anodyne	EPHX2	27	43
O=C(NC1CCN(C[C@H]2CCCCC2(F)F)CC1)C1CCCCC1	ZINC000450532489	EH	On-Demand	Anodyne	EPHX2	27	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	ACE	40	37
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	FKBP1A	48	39
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	DRD4	23	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	DRD3	0	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	MME	33	40
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	LTA4H	17	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	SIGMAR1	31	52
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	F11	41	36
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	EPHX2	49	51
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	MCHR1	17	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	CACNA1G	35	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532490	FG	On-Demand	Anodyne	BIRC2	47	40
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	ACE	40	37
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	FKBP1A	48	39
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	DRD4	23	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	DRD3	0	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	MME	33	40
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	LTA4H	17	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	SIGMAR1	31	52
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	F11	41	36
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	EPHX2	49	51
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	MCHR1	17	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	CACNA1G	35	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532491	FG	On-Demand	Anodyne	BIRC2	47	40
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCOCC2(CC2)C1	ZINC000450532492	EF	On-Demand	Bother	SLC6A9	0	44
Cc1cc(C)c(C(=O)N2CCC(CCCO)CC2)cc1Br	ZINC000450532496	FH	On-Demand	Anodyne	L3MBTL1	0	45
Cc1cc(C)c(C(=O)N2CCC(CCCO)CC2)cc1Br	ZINC000450532496	FH	On-Demand	Anodyne	L3MBTL3	24	45
COc1ccccc1Oc1ccc(C(=O)N2CCC(CCCO)CC2)nc1	ZINC000450532498	FH	On-Demand	Anodyne	CCR8	29	42
C[C@]1(c2ccccc2)CCN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)C1	ZINC000450532530	FG	On-Demand	Bother	RARA	40	33
C[C@]1(c2ccccc2)CCN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)C1	ZINC000450532530	FG	On-Demand	Bother	MGLL	0	40
C[C@]1(c2ccccc2)CCN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)C1	ZINC000450532530	FG	On-Demand	Bother	ABHD6	0	40
C[C@@]1(c2ccccc2)CCN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)C1	ZINC000450532531	FG	On-Demand	Bother	RARA	40	33
C[C@@]1(c2ccccc2)CCN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)C1	ZINC000450532531	FG	On-Demand	Bother	MGLL	0	40
C[C@@]1(c2ccccc2)CCN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)C1	ZINC000450532531	FG	On-Demand	Bother	ABHD6	0	40
CSc1cccc(C(=O)N2CCC(CCCO)CC2)c1	ZINC000450532563	CG	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CCC(CCCO)CC2)c1	ZINC000450532563	CG	On-Demand	Anodyne	L3MBTL1	0	43
CSc1cccc(C(=O)N2CCC(CCCO)CC2)c1	ZINC000450532563	CG	On-Demand	Anodyne	L3MBTL3	51	43
Cc1cc(NC(=O)CC2(O)CCC2)ccc1OCCO	ZINC000450532566	CD	On-Demand	Anodyne	ENPP1	56	35
N#Cc1cccc(NC(=O)C2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450532571	EF	On-Demand	Mild	CCR3	25	44
N#Cc1cccc(NC(=O)C2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450532571	EF	On-Demand	Mild	MCHR1	42	40
N#Cc1cccc(NC(=O)C2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450532572	EF	On-Demand	Mild	CCR3	25	44
N#Cc1cccc(NC(=O)C2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450532572	EF	On-Demand	Mild	MCHR1	42	40
CCSc1cccnc1C(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450532573	EG	On-Demand	Anodyne	ENPP1	50	31
COc1cc(CNc2nc(C(C)=O)c(C)s2)ccc1C#N	ZINC000450532574	DF	On-Demand	Mild	DRTS_TRYCR	43	30
N#Cc1cnc(NC[C@H]2CC[C@H](c3ccccc3)O2)c([N+](=O)[O-])c1	ZINC000450532581	DG	On-Demand	Mild	PRKCQ	48	39
N#Cc1cnc(NC[C@H]2CC[C@@H](c3ccccc3)O2)c([N+](=O)[O-])c1	ZINC000450532582	DG	On-Demand	Mild	PRKCQ	48	39
N#Cc1ccc(OCC(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1Br	ZINC000450532585	GF	On-Demand	Mild	COLA	154	49
N#Cc1ccc(OCC(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1Br	ZINC000450532585	GF	On-Demand	Mild	CPT1A	143	49
N#Cc1ccc(OCC(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1Br	ZINC000450532585	GF	On-Demand	Mild	CPT2	47	38
N#Cc1ccc(OCC(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1Br	ZINC000450532586	GF	On-Demand	Mild	COLA	154	49
N#Cc1ccc(OCC(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1Br	ZINC000450532586	GF	On-Demand	Mild	CPT1A	143	49
N#Cc1ccc(OCC(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1Br	ZINC000450532586	GF	On-Demand	Mild	CPT2	47	38
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H](C(=O)O)O1	ZINC000450532592	CD	On-Demand	Anodyne	AGTR2	56	44
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H](C(=O)O)O1	ZINC000450532592	CD	On-Demand	Anodyne	BCL2	15	43
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H](C(=O)O)O1	ZINC000450532593	CD	On-Demand	Anodyne	AGTR2	56	44
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@H](C(=O)O)O1	ZINC000450532593	CD	On-Demand	Anodyne	BCL2	15	43
Cn1cnc(-c2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)n1	ZINC000450532598	DG	On-Demand	Anodyne	BRAF	44	39
Cn1cnc(-c2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)n1	ZINC000450532598	DG	On-Demand	Anodyne	KCNK9	40	35
CSc1cccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000450532600	DF	On-Demand	Anodyne	COLA	109	38
CSc1cccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000450532600	DF	On-Demand	Anodyne	CPT1A	75	37
CSc1cccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000450532601	DF	On-Demand	Anodyne	COLA	109	38
CSc1cccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000450532601	DF	On-Demand	Anodyne	CPT1A	75	37
O=C(c1cc2ccc(Br)cc2s1)N1CCC(CCCO)CC1	ZINC000450532602	GI	On-Demand	Anodyne	AKR1C3	0	45
Cc1cc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1OCCO	ZINC000450532605	GF	On-Demand	Anodyne	MAPK1	20	40
Cc1cc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1OCCO	ZINC000450532606	GF	On-Demand	Anodyne	MAPK1	20	40
CCCN(Cc1ccc(C(=O)OCC)cn1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450532607	FG	On-Demand	Anodyne	P2RY12	18	42
CCCN(Cc1ccc(C(=O)OCC)cn1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450532608	FG	On-Demand	Anodyne	P2RY12	18	42
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCO)CC1	ZINC000450532616	CF	On-Demand	Anodyne	GNAI1	0	47
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCO)CC1	ZINC000450532616	CF	On-Demand	Anodyne	GNAI3	0	49
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCO)CC1	ZINC000450532616	CF	On-Demand	Anodyne	GNAO1	0	47
Cc1cc(NC(=O)C(C)(C)OC(C)C)ccc1OCCO	ZINC000450532623	CF	On-Demand	Anodyne	VDR	52	35
Cc1cc(NC(=O)C(C)(C)OC(C)C)ccc1OCCO	ZINC000450532623	CF	On-Demand	Anodyne	ENPP1	55	35
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CCOCC2(CC2)C1	ZINC000450532631	FG	On-Demand	Anodyne	PDE6D	61	37
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CCOCC2(CC2)C1	ZINC000450532631	FG	On-Demand	Anodyne	IMDH_CRYPV	28	44
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(CCCO)CC1	ZINC000450532645	DF	On-Demand	Anodyne	AKR1C3	0	51
Cc1cc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCCO	ZINC000450532664	FF	On-Demand	Bother	CACNA1D	66	33
O=C(N[C@H]1CCOC1)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1	ZINC000450532666	FE	On-Demand	Anodyne	HPGDS	36	41
O=C(N[C@@H]1CCOC1)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1	ZINC000450532673	FE	On-Demand	Anodyne	HPGDS	36	41
Cc1cc(NC(=O)c2ccc(C(F)(F)F)[nH]2)ccc1OCCO	ZINC000450532691	EF	On-Demand	Anodyne	SCD1	21	40
CC(C)Cn1cc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(C(F)F)n1	ZINC000450532696	FH	On-Demand	Anodyne	KCNK3	49	36
CC(C)Cn1cc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(C(F)F)n1	ZINC000450532696	FH	On-Demand	Anodyne	KCNK9	59	36
Cc1nc(C)n(CCCC(=O)Nc2ccc(OCCO)c(C)c2)n1	ZINC000450532698	ED	On-Demand	Anodyne	ENPP1	51	32
COc1ccc(C[C@@H](C)C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)cc1OC	ZINC000450532717	GG	On-Demand	Anodyne	AGTR2	42	35
COc1ccc(C[C@@H](C)C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)cc1OC	ZINC000450532717	GG	On-Demand	Anodyne	MTNR1B	22	40
O=C(NCCc1cccs1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450532718	FI	On-Demand	Anodyne	ADAM17	0	45
O=C(NCCc1cccs1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450532720	FI	On-Demand	Anodyne	ADAM17	0	45
COC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCOCC1	ZINC000450532727	FD	On-Demand	Anodyne	TRPV1	0	42
COC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCOCC1	ZINC000450532727	FD	On-Demand	Anodyne	CAN2	0	45
CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CCO1	ZINC000450532731	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
CNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CCO1	ZINC000450532732	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
CC(C)(C(=O)O)n1cc(NC(=O)C2(Oc3ccccc3F)CC2)cn1	ZINC000450532735	EE	On-Demand	Anodyne	PANC	52	34
CCC(CC)(NC(=O)Cc1c[nH]c2ccc(Cl)cc12)C(=O)O	ZINC000450532736	DG	On-Demand	Anodyne	MPO	53	37
CCOC(=O)c1cnc(C)c(NC(=O)Cc2sccc2Br)c1	ZINC000450532743	GH	On-Demand	Anodyne	MAPK10	0	44
CCOC(=O)c1cnc(C)c(NC(=O)Cc2sccc2Br)c1	ZINC000450532743	GH	On-Demand	Anodyne	MAPK8	18	44
CC(C)[C@H](NC(=O)CC1(O)CCC1)c1ccc(Cl)cc1F	ZINC000450532750	DH	On-Demand	Anodyne	MC4R	19	41
CC(C)[C@H](NC(=O)CC1(O)CCC1)c1ccc(Cl)cc1F	ZINC000450532750	DH	On-Demand	Anodyne	MC5R	0	41
CC(C)[C@@H](NC(=O)CC1(O)CCC1)c1ccc(Cl)cc1F	ZINC000450532751	DH	On-Demand	Anodyne	MC5R	0	41
CCSc1cccnc1C(=O)Nc1cccc(N(C)C)n1	ZINC000450532753	DF	On-Demand	Anodyne	MAP1	40	37
CO[C@@H]1C[C@H](N(C)c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450532763	CE	On-Demand	Anodyne	ADRA2A	15	41
C[C@@H](O)CCN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450532764	DD	On-Demand	Anodyne	ADAM17	28	50
C[C@H](O)CCN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450532765	DD	On-Demand	Anodyne	ADAM17	28	50
C[C@@H](O)CCN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532766	CD	On-Demand	Anodyne	EPHX2	40	57
C[C@H](O)CCN1CCC(C(=O)NC2CCCCC2)CC1	ZINC000450532767	CD	On-Demand	Anodyne	EPHX2	40	57
Cc1[nH]c(C#N)cc1C(=O)NC1CCC(c2ccc(F)cc2)CC1	ZINC000450532775	EH	On-Demand	Mild	EZH2	43	34
CCOC(=O)[C@@H](CO)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450532779	ED	On-Demand	Anodyne	P2RY12	56	36
CCOC(=O)[C@H](CO)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450532780	ED	On-Demand	Anodyne	P2RY12	56	36
CC(C)[C@@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450532781	DE	On-Demand	Anodyne	TIMP3	53	31
CCC[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450532786	CE	On-Demand	Anodyne	EPHX2	30	44
CCC[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000450532787	CE	On-Demand	Anodyne	EPHX2	30	44
C[C@@H](CNC(=O)Cc1sccc1Br)S(N)(=O)=O	ZINC000450532794	EC	On-Demand	Anodyne	CA5B	43	35
C[C@@H](CNC(=O)Cc1sccc1Br)S(N)(=O)=O	ZINC000450532794	EC	On-Demand	Anodyne	CA5A	44	35
C[C@H](CNC(=O)Cc1sccc1Br)S(N)(=O)=O	ZINC000450532795	EC	On-Demand	Anodyne	CA5B	43	35
C[C@H](CNC(=O)Cc1sccc1Br)S(N)(=O)=O	ZINC000450532795	EC	On-Demand	Anodyne	CA5A	44	35
Cc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)ccc1OCCO	ZINC000450532805	GI	On-Demand	Anodyne	PPARD	57	39
Cc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)ccc1OCCO	ZINC000450532805	GI	On-Demand	Anodyne	MTTP	49	36
Cn1cnc(-c2cccc(NC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2)n1	ZINC000450532806	GF	On-Demand	Anodyne	CASR	29	41
Cn1cnc(-c2cccc(NC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2)n1	ZINC000450532806	GF	On-Demand	Anodyne	PRKDC	25	42
Cn1cnc(-c2cccc(NC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2)n1	ZINC000450532806	GF	On-Demand	Anodyne	MAPK14	23	40
Cn1cnc(-c2cccc(NC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2)n1	ZINC000450532806	GF	On-Demand	Anodyne	PRNP	45	35
Cn1cnc(-c2cccc(NC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2)n1	ZINC000450532806	GF	On-Demand	Anodyne	EPHX2	19	41
Cn1cnc(-c2cccc(NC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2)n1	ZINC000450532806	GF	On-Demand	Anodyne	BRAF	28	42
Cn1cnc(-c2cccc(NC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2)n1	ZINC000450532806	GF	On-Demand	Anodyne	DGAT1	35	41
Cn1cnc(-c2cccc(NC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2)n1	ZINC000450532806	GF	On-Demand	Anodyne	KCNK3	64	33
Cc1cc(NC(=O)CCc2ccc(C(N)=O)cc2)ccc1OCCO	ZINC000450532807	EE	On-Demand	Anodyne	ENPP1	40	32
Cc1cc(NC(=O)[C@@H](C)Oc2ccccn2)ccc1OCCO	ZINC000450532809	DE	On-Demand	Anodyne	GUAB	0	44
Cc1cc(NC(=O)[C@H](C)Oc2ccccn2)ccc1OCCO	ZINC000450532810	DE	On-Demand	Anodyne	GUAB	0	44
CO[C@H](C)[C@@H](C)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450532820	CF	On-Demand	Anodyne	UTS2R	28	43
CO[C@@H](C)[C@@H](C)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450532821	CF	On-Demand	Anodyne	UTS2R	28	43
Cc1ccc(Br)cc1CC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532826	FG	On-Demand	Anodyne	COLA	119	41
Cc1ccc(Br)cc1CC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532826	FG	On-Demand	Anodyne	CPT1A	103	41
Cc1ccc(Br)cc1CC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532827	FG	On-Demand	Anodyne	COLA	119	41
Cc1ccc(Br)cc1CC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532827	FG	On-Demand	Anodyne	CPT1A	103	41
Cn1cnc(-c2cccc(NC(=O)CC3(O)CCC3)c2)n1	ZINC000450532829	CD	On-Demand	Anodyne	ENPP1	40	30
CC(C)CC(CC(C)C)C(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532841	DH	On-Demand	Anodyne	COLA	84	38
CC(C)CC(CC(C)C)C(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450532841	DH	On-Demand	Anodyne	CPT1A	80	38
CC(C)CC(CC(C)C)C(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532842	DH	On-Demand	Anodyne	COLA	84	38
CC(C)CC(CC(C)C)C(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450532842	DH	On-Demand	Anodyne	CPT1A	80	38
O=C(O)COc1cccc(C(=O)N2CC3(CCOCC3)c3ccccc32)c1	ZINC000450532843	FF	On-Demand	Anodyne	FABP4	43	34
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCOC1	ZINC000450532863	BC	On-Demand	Anodyne	SIGMAR1	22	50
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCOC1	ZINC000450532863	BC	On-Demand	Anodyne	CCR3	23	45
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCOC1	ZINC000450532863	BC	On-Demand	Anodyne	CCR2	24	40
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCOC1	ZINC000450532863	BC	On-Demand	Anodyne	MCHR1	18	45
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCOC1	ZINC000450532863	BC	On-Demand	Anodyne	LUXR	53	38
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCOC1	ZINC000450532864	BC	On-Demand	Anodyne	SIGMAR1	22	50
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCOC1	ZINC000450532864	BC	On-Demand	Anodyne	CCR3	23	45
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCOC1	ZINC000450532864	BC	On-Demand	Anodyne	CCR2	24	40
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCOC1	ZINC000450532864	BC	On-Demand	Anodyne	MCHR1	18	45
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCOC1	ZINC000450532864	BC	On-Demand	Anodyne	LUXR	53	38
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)cc1	ZINC000450532865	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)cc1	ZINC000450532866	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)cc1	ZINC000450532867	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)cc1	ZINC000450532867	DH	On-Demand	Anodyne	SLC18A3	61	46
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccc(C(=O)O)cc1	ZINC000450532868	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
N#Cc1cccc(NC(=O)C2CCN(CCC3=CCCCC3)CC2)c1	ZINC000450532872	EI	On-Demand	Mild	CCR3	34	50
N#Cc1cccc(NC(=O)C2CCN(CCC3=CCCCC3)CC2)c1	ZINC000450532872	EI	On-Demand	Mild	MCHR1	38	41
CCCOc1ccc(C(=O)Nc2cccc(N(C)C)n2)c(OC)c1	ZINC000450532873	EG	On-Demand	Anodyne	KCNK3	44	39
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450532877	ED	On-Demand	Mild	CCR3	28	42
CCOC(=O)[C@H](CO)NC(=O)c1ccc(I)cc1F	ZINC000450532878	GD	On-Demand	Anodyne	MAP2K1	54	41
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450532879	ED	On-Demand	Mild	CCR3	28	42
CCOC(=O)[C@@H](CO)NC(=O)c1ccc(I)cc1F	ZINC000450532884	GD	On-Demand	Anodyne	MAP2K1	54	41
CC(=O)c1cn(CC(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)nn1	ZINC000450532889	GE	On-Demand	Anodyne	RBP4	78	41
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532890	FI	On-Demand	Anodyne	SIGMAR1	15	41
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532890	FI	On-Demand	Anodyne	SLC18A3	50	37
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532890	FI	On-Demand	Anodyne	CYP2J2	47	36
CC(=O)c1cn(CC(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)nn1	ZINC000450532891	GE	On-Demand	Anodyne	RBP4	78	41
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532903	FI	On-Demand	Anodyne	SIGMAR1	15	41
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532903	FI	On-Demand	Anodyne	SLC18A3	50	37
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532903	FI	On-Demand	Anodyne	CYP2J2	47	36
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532905	FI	On-Demand	Anodyne	SIGMAR1	15	41
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532905	FI	On-Demand	Anodyne	SLC18A3	50	37
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532905	FI	On-Demand	Anodyne	CYP2J2	47	36
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532907	FI	On-Demand	Anodyne	SIGMAR1	15	41
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532907	FI	On-Demand	Anodyne	SLC18A3	50	37
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450532907	FI	On-Demand	Anodyne	CYP2J2	47	36
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450532914	GH	On-Demand	Anodyne	CHRNA7	28	40
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450532914	GH	On-Demand	Anodyne	MAPK1	20	42
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000450532914	GH	On-Demand	Anodyne	EPHX2	26	47
O=C(c1cncc(Cl)c1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450532918	FH	On-Demand	Anodyne	SLC9A1	27	40
O=C(c1cncc(Cl)c1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450532918	FH	On-Demand	Anodyne	RBP4	68	39
O=C(c1cncc(Cl)c1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450532919	FH	On-Demand	Anodyne	SLC9A1	27	40
O=C(c1cncc(Cl)c1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450532919	FH	On-Demand	Anodyne	RBP4	68	39
CCOC(=O)C(C)(C)C1CCN(c2nc(-c3ccc(OC)cc3)no2)CC1	ZINC000450532922	FH	On-Demand	Anodyne	COLA	22	42
CCOC(=O)C(C)(C)C1CCN(c2nc(-c3ccc(OC)cc3)no2)CC1	ZINC000450532922	FH	On-Demand	Anodyne	CPT1A	15	42
CCOC(=O)C(C)(C)C1CCN(c2nc(-c3ccc(OC)cc3)no2)CC1	ZINC000450532922	FH	On-Demand	Anodyne	S1PR1	18	41
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450532931	GG	On-Demand	Anodyne	ADAM17	25	46
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000450532932	GG	On-Demand	Anodyne	ADAM17	25	46
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450532955	FD	On-Demand	Anodyne	SLC6A1	0	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450532955	FD	On-Demand	Anodyne	SLC6A3	15	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450532955	FD	On-Demand	Anodyne	PRCP	16	40
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450532955	FD	On-Demand	Anodyne	GPR88	0	42
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450532956	FD	On-Demand	Anodyne	SLC6A1	0	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450532956	FD	On-Demand	Anodyne	SLC6A3	15	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450532956	FD	On-Demand	Anodyne	PRCP	16	40
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450532956	FD	On-Demand	Anodyne	GPR88	0	42
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450532971	FH	On-Demand	Anodyne	RBP4	77	44
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450532972	FH	On-Demand	Anodyne	RBP4	77	44
Cc1ccn(CC(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450532980	FF	On-Demand	Anodyne	RBP4	68	39
Cc1ccn(CC(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450532981	FF	On-Demand	Anodyne	RBP4	68	39
COC(=O)C1(CNC(=O)c2cccc(SC)c2)CCOCC1	ZINC000450532988	DE	On-Demand	Anodyne	DRD4	40	31
O=C(c1ccc(I)cc1F)N1CCOCC2(CC2)C1	ZINC000450533004	GF	On-Demand	Anodyne	MAP2K1	17	40
CN1C(=O)N[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533013	ED	On-Demand	Anodyne	DRD2	39	55
CN1C(=O)N[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533013	ED	On-Demand	Anodyne	DRD1	0	54
CN1C(=O)N[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533013	ED	On-Demand	Anodyne	DRD4	23	56
CN1C(=O)N[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533013	ED	On-Demand	Anodyne	ERG2	24	53
CN1C(=O)N[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533013	ED	On-Demand	Anodyne	SLC18A3	23	56
CN1C(=O)N[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533013	ED	On-Demand	Anodyne	CYP2J2	53	40
CN1C(=O)N[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533013	ED	On-Demand	Anodyne	AP2S1	0	53
CN1C(=O)N[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533014	ED	On-Demand	Anodyne	DRD2	39	55
CN1C(=O)N[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533014	ED	On-Demand	Anodyne	DRD1	0	54
CN1C(=O)N[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533014	ED	On-Demand	Anodyne	DRD4	23	56
CN1C(=O)N[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533014	ED	On-Demand	Anodyne	ERG2	24	53
CN1C(=O)N[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533014	ED	On-Demand	Anodyne	SLC18A3	23	56
CN1C(=O)N[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533014	ED	On-Demand	Anodyne	CYP2J2	53	40
CN1C(=O)N[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1=O	ZINC000450533014	ED	On-Demand	Anodyne	AP2S1	0	53
COc1ccc(C[C@@](C)(O)CNc2nc(N(C)C)c3ccccc3n2)cc1OC	ZINC000450533038	GF	On-Demand	Anodyne	ADRA2A	16	42
COc1ccc(C[C@](C)(O)CNc2nc(N(C)C)c3ccccc3n2)cc1OC	ZINC000450533039	GF	On-Demand	Anodyne	ADRA2A	16	42
C[C@H]1Cc2ccccc2CN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450533052	DF	On-Demand	Anodyne	AGTR2	54	44
C[C@H]1Cc2ccccc2CN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450533052	DF	On-Demand	Anodyne	PREP	27	43
C[C@H]1Cc2ccccc2CN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450533052	DF	On-Demand	Anodyne	CFTR	44	31
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450533053	DF	On-Demand	Anodyne	AGTR2	54	44
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450533053	DF	On-Demand	Anodyne	PREP	27	43
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450533053	DF	On-Demand	Anodyne	CFTR	44	31
C[C@@H]1Cc2ccccc2CN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450533054	DF	On-Demand	Anodyne	AGTR2	54	44
C[C@@H]1Cc2ccccc2CN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450533054	DF	On-Demand	Anodyne	PREP	27	43
C[C@@H]1Cc2ccccc2CN1C(=O)C1CCC(C(=O)O)CC1	ZINC000450533054	DF	On-Demand	Anodyne	CFTR	44	31
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450533055	DF	On-Demand	Anodyne	AGTR2	54	44
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450533055	DF	On-Demand	Anodyne	PREP	27	43
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450533055	DF	On-Demand	Anodyne	CFTR	44	31
COC(=O)Cc1ccc(N[C@@H](C)CN(C)C(C)C)c([N+](=O)[O-])c1	ZINC000450533077	DE	On-Demand	Bother	COLA	89	35
Cc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OCCO	ZINC000450533078	GF	On-Demand	Anodyne	MAPK14	25	45
Cc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OCCO	ZINC000450533078	GF	On-Demand	Anodyne	PRNP	44	32
Cc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OCCO	ZINC000450533078	GF	On-Demand	Anodyne	GCK	17	41
Cc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OCCO	ZINC000450533078	GF	On-Demand	Anodyne	SHH	44	35
Cc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OCCO	ZINC000450533078	GF	On-Demand	Anodyne	HSPB1	0	40
Cc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OCCO	ZINC000450533078	GF	On-Demand	Anodyne	KCNK3	58	33
O=C(CCC(=O)N1CCOCC2(CC2)C1)c1cccc([N+](=O)[O-])c1	ZINC000450533079	EE	On-Demand	Bother	IRAK4	23	40
O=C(c1cnn2c1CCC2)N1CCCC[C@H]1c1cccc(Cl)c1	ZINC000450533082	EH	On-Demand	Anodyne	ADAM17	26	42
O=C(c1cnn2c1CCC2)N1CCCC[C@H]1c1cccc(Cl)c1	ZINC000450533082	EH	On-Demand	Anodyne	GRM5	20	46
O=C(c1cnn2c1CCC2)N1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000450533083	EH	On-Demand	Anodyne	ADAM17	26	42
O=C(c1cnn2c1CCC2)N1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000450533083	EH	On-Demand	Anodyne	GRM5	20	46
Cc1ccc(Br)cc1CC(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450533087	GH	On-Demand	Anodyne	CETP	0	43
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	F2	62	42
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	OPRM1	24	41
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	ELANE	66	42
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	HLA-DRB3	46	36
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	TRY1_BOVIN	85	38
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	PREP	75	46
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	CELA2A	47	31
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	LGMN	66	39
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	XIAP	55	41
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	BRCA1	63	33
O=C(N[C@@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533099	EE	On-Demand	Anodyne	TMPRSS11D	56	42
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	F2	62	42
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	OPRM1	24	41
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	ELANE	66	42
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	HLA-DRB3	46	36
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	TRY1_BOVIN	85	38
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	PREP	75	46
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	CELA2A	47	31
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	LGMN	66	39
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	XIAP	55	41
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	BRCA1	63	33
O=C(N[C@H](CO)CC1CCCC1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450533100	EE	On-Demand	Anodyne	TMPRSS11D	56	42
CNC(=O)[C@@H]1CN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CCO1	ZINC000450533101	GD	On-Demand	Anodyne	CHRM3	15	41
CNC(=O)[C@H]1CN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CCO1	ZINC000450533102	GD	On-Demand	Anodyne	CHRM3	15	41
CCOC(=O)[C@@H](CO)NC(=O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450533105	GD	On-Demand	Anodyne	TIMP3	49	32
CCOC(=O)[C@@H](CO)NC(=O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450533106	GD	On-Demand	Anodyne	TIMP3	49	32
CCOC(=O)[C@H](CO)NC(=O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450533107	GD	On-Demand	Anodyne	TIMP3	49	32
CCOC(=O)[C@H](CO)NC(=O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450533108	GD	On-Demand	Anodyne	TIMP3	49	32
CC(C)[C@@H](CO)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450533123	CF	On-Demand	Anodyne	TIMP3	41	32
O=C(c1cc2ccncc2s1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450533124	GJ	On-Demand	Anodyne	RBP4	80	46
O=C(c1cc2ccncc2s1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450533125	GJ	On-Demand	Anodyne	RBP4	80	46
CCc1cccc(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450533128	FH	On-Demand	Anodyne	RBP4	69	39
CCc1cccc(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450533129	FH	On-Demand	Anodyne	RBP4	69	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CO)CC1CCCC1	ZINC000450533135	EF	On-Demand	Anodyne	PFDN6	0	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CO)CC1CCCC1	ZINC000450533135	EF	On-Demand	Anodyne	REN	51	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CO)CC1CCCC1	ZINC000450533135	EF	On-Demand	Anodyne	CAPN1	43	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CO)CC1CCCC1	ZINC000450533135	EF	On-Demand	Anodyne	NS3	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CO)CC1CCCC1	ZINC000450533135	EF	On-Demand	Anodyne	POLG_HCV1	30	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CO)CC1CCCC1	ZINC000450533135	EF	On-Demand	Anodyne	FPR1	40	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)CC1CCCC1	ZINC000450533136	EF	On-Demand	Anodyne	PFDN6	0	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)CC1CCCC1	ZINC000450533136	EF	On-Demand	Anodyne	REN	51	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)CC1CCCC1	ZINC000450533136	EF	On-Demand	Anodyne	CAPN1	43	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)CC1CCCC1	ZINC000450533136	EF	On-Demand	Anodyne	NS3	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)CC1CCCC1	ZINC000450533136	EF	On-Demand	Anodyne	POLG_HCV1	30	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)CC1CCCC1	ZINC000450533136	EF	On-Demand	Anodyne	FPR1	40	45
CC(C)(C(=O)O)n1cc(NC(=O)Cc2ccc(Cl)c(F)c2)cn1	ZINC000450533146	EF	On-Demand	Anodyne	PFK	0	48
CCOC(=O)c1csc(N(C)CCN2CCN(Cc3ccccc3)CC2)n1	ZINC000450533147	GF	On-Demand	Anodyne	ACHE	16	40
CCOC(=O)c1csc(N(C)CCN2CCN(Cc3ccccc3)CC2)n1	ZINC000450533147	GF	On-Demand	Anodyne	CACNA1G	21	41
COc1cc(Cl)c(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)cc1OC	ZINC000450533149	GD	On-Demand	Anodyne	CA2	21	48
COc1cc(Cl)c(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)cc1OC	ZINC000450533149	GD	On-Demand	Anodyne	FOLH1	56	44
COc1cc(Cl)c(C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)cc1OC	ZINC000450533149	GD	On-Demand	Anodyne	NPR	40	38
O=C(c1cnc(C2CC2)nc1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450533157	GH	On-Demand	Anodyne	RBP4	93	46
O=C(c1cnc(C2CC2)nc1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450533158	GH	On-Demand	Anodyne	RBP4	93	46
O=C(NC1CCN(CC2CC(F)(F)C2)CC1)C1CCCCC1	ZINC000450533167	DG	On-Demand	Anodyne	EPHX2	28	43
COc1cc(CNC(=O)C2CCC(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533174	GH	On-Demand	Anodyne	PDE4A	49	47
COc1cc(CNC(=O)C2CCC(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533174	GH	On-Demand	Anodyne	PDE4B	29	47
COc1cc(CNC(=O)C2CCC(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533174	GH	On-Demand	Anodyne	PDE4D	32	47
COc1cc(CNC(=O)C2CCC(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533174	GH	On-Demand	Anodyne	MTNR1A	33	41
COc1cc(CNC(=O)C2CCC(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533174	GH	On-Demand	Anodyne	MTNR1B	35	41
COc1cc(CNC(=O)C2CCC(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533174	GH	On-Demand	Anodyne	PDE4C	17	47
COc1cc(CNC(=O)C2CCC(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533174	GH	On-Demand	Anodyne	STK17B	42	37
COc1cc(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533175	GH	On-Demand	Anodyne	PDE4A	49	47
COc1cc(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533175	GH	On-Demand	Anodyne	PDE4B	29	47
COc1cc(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533175	GH	On-Demand	Anodyne	PDE4D	32	47
COc1cc(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533175	GH	On-Demand	Anodyne	MTNR1A	33	41
COc1cc(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533175	GH	On-Demand	Anodyne	MTNR1B	35	41
COc1cc(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533175	GH	On-Demand	Anodyne	PDE4C	17	47
COc1cc(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450533175	GH	On-Demand	Anodyne	STK17B	42	37
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	PPARG	17	42
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	PPARA	28	44
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	PDE4A	44	47
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	PDE4B	28	47
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	PDE4D	30	48
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	UTS2R	20	41
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	PPARD	33	44
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	PDE4C	16	47
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	MT-ND1	26	45
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	U38	0	40
COc1cc(CNC(=O)c2ccc(C(=O)O)cc2F)ccc1OC1CCCC1	ZINC000450533187	GH	On-Demand	Anodyne	ACKR3	40	33
COc1cccc(OCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1	ZINC000450533190	FH	On-Demand	Mild	DRD4	41	34
COc1cccc(OCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1	ZINC000450533190	FH	On-Demand	Mild	QDPR	0	40
COc1cccc(OCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1	ZINC000450533190	FH	On-Demand	Mild	ADAM10	15	40
CCc1oc(C(=O)NCc2ccc(OC3CCCC3)c(OC)c2)cc1C(=O)O	ZINC000450533191	GH	On-Demand	Anodyne	PDE4A	39	42
CCc1oc(C(=O)NCc2ccc(OC3CCCC3)c(OC)c2)cc1C(=O)O	ZINC000450533191	GH	On-Demand	Anodyne	PDE4B	22	42
CCc1oc(C(=O)NCc2ccc(OC3CCCC3)c(OC)c2)cc1C(=O)O	ZINC000450533191	GH	On-Demand	Anodyne	PDE4D	20	42
CCc1oc(C(=O)NCc2ccc(OC3CCCC3)c(OC)c2)cc1C(=O)O	ZINC000450533191	GH	On-Demand	Anodyne	PDE4C	15	42
Cc1ccnc(OC2CCN(C(=O)c3ccsc3Br)CC2)c1	ZINC000450533199	GH	On-Demand	Anodyne	HCRTR1	27	42
CCN(CC)C(=O)CCC1CCN(C(=O)c2cncc(Cl)c2)CC1	ZINC000450533212	FG	On-Demand	Anodyne	CACNA1I	50	35
CC(C)Oc1ccc2nccc(N3CC[C@H](C(=O)N4CCCC4)C3)c2c1	ZINC000450533229	FG	On-Demand	Anodyne	FAP	0	40
CC(C)Oc1ccc2nccc(N3CC[C@H](C(=O)N4CCCC4)C3)c2c1	ZINC000450533229	FG	On-Demand	Anodyne	LUCI_LUCLA	17	43
CC(C)Oc1ccc2nccc(N3CC[C@@H](C(=O)N4CCCC4)C3)c2c1	ZINC000450533230	FG	On-Demand	Anodyne	FAP	0	40
CC(C)Oc1ccc2nccc(N3CC[C@@H](C(=O)N4CCCC4)C3)c2c1	ZINC000450533230	FG	On-Demand	Anodyne	LUCI_LUCLA	17	43
CCOC(=O)c1csc(NC[C@@H]2CCCCN2S(C)(=O)=O)n1	ZINC000450533252	EC	On-Demand	Anodyne	TRPC6	47	39
CCOC(=O)c1csc(NC[C@H]2CCCCN2S(C)(=O)=O)n1	ZINC000450533253	EC	On-Demand	Anodyne	TRPC6	47	39
CCN(CC)C(=O)CCC1CCN(C(=O)CC2(O)CCC2)CC1	ZINC000450533255	DE	On-Demand	Anodyne	GNAI1	0	40
CCN(CC)C(=O)CCC1CCN(C(=O)CC2(O)CCC2)CC1	ZINC000450533255	DE	On-Demand	Anodyne	GNAI3	0	41
CCN(CC)C(=O)CCC1CCN(C(=O)CC2(O)CCC2)CC1	ZINC000450533255	DE	On-Demand	Anodyne	GNAO1	0	40
CC(C)N(C)C[C@@H](C)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450533258	CG	On-Demand	Anodyne	UTS2R	29	48
Cc1[nH]c(C#N)cc1C(=O)Nc1ncc(C2CCCCC2)s1	ZINC000450533259	DH	On-Demand	Mild	CDK5	48	43
CC(C)N(C)C[C@H](C)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450533260	CG	On-Demand	Anodyne	UTS2R	29	48
COC(=O)c1csc(CN(CC(C)C)c2cccc(OC)c2)n1	ZINC000450533262	EH	On-Demand	Anodyne	MTNR1A	23	40
COC(=O)c1csc(CN(CC(C)C)c2cccc(OC)c2)n1	ZINC000450533262	EH	On-Demand	Anodyne	MTNR1B	25	40
Cc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1OCCO	ZINC000450533265	EF	On-Demand	Anodyne	HRH3	36	41
Cc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1OCCO	ZINC000450533265	EF	On-Demand	Anodyne	MAPK1	31	41
Cc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1OCCO	ZINC000450533265	EF	On-Demand	Anodyne	EPHX2	22	40
Cc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1OCCO	ZINC000450533269	EF	On-Demand	Anodyne	HRH3	36	41
Cc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1OCCO	ZINC000450533269	EF	On-Demand	Anodyne	MAPK1	31	41
Cc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1OCCO	ZINC000450533269	EF	On-Demand	Anodyne	EPHX2	22	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@H]1CCC[C@H](C(=O)O)C1	ZINC000450533270	EH	On-Demand	Anodyne	SLC6A1	79	34
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@H]1CCC[C@H](C(=O)O)C1	ZINC000450533270	EH	On-Demand	Anodyne	SLC18A3	45	39
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CCC[C@H](C(=O)O)C1	ZINC000450533271	EH	On-Demand	Anodyne	SLC6A1	79	34
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CCC[C@H](C(=O)O)C1	ZINC000450533271	EH	On-Demand	Anodyne	SLC18A3	45	39
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450533272	EH	On-Demand	Anodyne	SLC6A1	79	34
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450533272	EH	On-Demand	Anodyne	SLC18A3	45	39
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CCC[C@@H](C(=O)O)C1	ZINC000450533273	EH	On-Demand	Anodyne	SLC6A1	79	34
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CCC[C@@H](C(=O)O)C1	ZINC000450533273	EH	On-Demand	Anodyne	SLC18A3	45	39
O=[N+]([O-])c1ccc2c(N3C[C@@H](CO)[C@H](c4ccc(Cl)cc4)C3)nccc2c1	ZINC000450533274	GI	On-Demand	Bother	SLC6A1	0	41
C[C@@H](O)CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450533281	DD	On-Demand	Mild	CASR	29	46
C[C@@H](O)CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450533281	DD	On-Demand	Mild	CCR3	51	49
C[C@@H](O)CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450533281	DD	On-Demand	Mild	MCHR1	60	43
C[C@H](O)CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450533283	DD	On-Demand	Mild	CASR	29	46
C[C@H](O)CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450533283	DD	On-Demand	Mild	CCR3	51	49
C[C@H](O)CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450533283	DD	On-Demand	Mild	MCHR1	60	43
O=C(c1ccc2scc(Br)c2c1)N1CCC(CCCO)CC1	ZINC000450533285	GI	On-Demand	Anodyne	AKR1C3	0	43
O=C(c1ccc2scc(Br)c2c1)N1CCC(CCCO)CC1	ZINC000450533285	GI	On-Demand	Anodyne	L3MBTL3	59	39
COc1ccc(-c2noc(NC[C@@]3(CO)C[C@H]3c3ccccc3)n2)cc1	ZINC000450533294	FF	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc(-c2noc(NC[C@]3(CO)C[C@H]3c3ccccc3)n2)cc1	ZINC000450533295	FF	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc(-c2noc(NC[C@]3(CO)C[C@@H]3c3ccccc3)n2)cc1	ZINC000450533296	FF	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc(-c2noc(NC[C@@]3(CO)C[C@@H]3c3ccccc3)n2)cc1	ZINC000450533297	FF	On-Demand	Anodyne	LUCI_PHOPE	21	41
C[C@@](NCC[C@@H]1CCOC1)(C(N)=O)c1ccccc1	ZINC000450533321	CD	On-Demand	Anodyne	AMY2	53	30
C[C@](NCC[C@@H]1CCOC1)(C(N)=O)c1ccccc1	ZINC000450533322	CD	On-Demand	Anodyne	AMY2	53	30
C[C@](NCC[C@H]1CCOC1)(C(N)=O)c1ccccc1	ZINC000450533323	CD	On-Demand	Anodyne	AMY2	53	30
C[C@@](NCC[C@H]1CCOC1)(C(N)=O)c1ccccc1	ZINC000450533324	CD	On-Demand	Anodyne	AMY2	53	30
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)ccc1OCCO	ZINC000450533338	FF	On-Demand	Anodyne	ELANE	40	36
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)ccc1OCCO	ZINC000450533338	FF	On-Demand	Anodyne	PREP	61	41
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)ccc1OCCO	ZINC000450533338	FF	On-Demand	Anodyne	LGMN	56	34
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)ccc1OCCO	ZINC000450533338	FF	On-Demand	Anodyne	CFTR	57	37
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)ccc1OCCO	ZINC000450533338	FF	On-Demand	Anodyne	BRCA1	51	33
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1C[C@@H]1C(=O)O	ZINC000450533351	CD	On-Demand	Anodyne	PREP	22	49
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1C[C@H]1C(=O)O	ZINC000450533352	CD	On-Demand	Anodyne	PREP	22	49
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1C(=O)O	ZINC000450533353	CD	On-Demand	Anodyne	PREP	22	49
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@@H]1C(=O)O	ZINC000450533354	CD	On-Demand	Anodyne	PREP	22	49
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccccc1C(=O)O	ZINC000450533355	DF	On-Demand	Anodyne	OPRD1	42	35
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccccc1C(=O)O	ZINC000450533355	DF	On-Demand	Anodyne	AGTR2	47	38
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccccc1C(=O)O	ZINC000450533355	DF	On-Demand	Anodyne	PREP	30	41
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccccc1C(=O)O	ZINC000450533355	DF	On-Demand	Anodyne	BCL2	0	43
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccccc1C(=O)O	ZINC000450533356	DF	On-Demand	Anodyne	OPRD1	42	35
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccccc1C(=O)O	ZINC000450533356	DF	On-Demand	Anodyne	AGTR2	47	38
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccccc1C(=O)O	ZINC000450533356	DF	On-Demand	Anodyne	PREP	30	41
C[C@H]1Cc2ccccc2CN1C(=O)Cc1ccccc1C(=O)O	ZINC000450533356	DF	On-Demand	Anodyne	BCL2	0	43
COc1ccc(Oc2ccc(C(=O)N3CCC(CCCO)CC3)nc2)cc1	ZINC000450533376	FH	On-Demand	Anodyne	TRPC6	39	42
COc1ccc(Oc2ccc(C(=O)N3CCC(CCCO)CC3)nc2)cc1	ZINC000450533376	FH	On-Demand	Anodyne	TRPC3	17	42
Cc1cc(C)c(C(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1Br	ZINC000450533384	FH	On-Demand	Anodyne	COLA	55	36
Cc1cc(C)c(C(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1Br	ZINC000450533384	FH	On-Demand	Anodyne	CPT1A	55	36
Cc1cc(C)c(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1Br	ZINC000450533385	FH	On-Demand	Anodyne	COLA	55	36
Cc1cc(C)c(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1Br	ZINC000450533385	FH	On-Demand	Anodyne	CPT1A	55	36
O=C(Nc1ccc(O)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450533389	EG	On-Demand	Anodyne	CHRM3	21	40
O=C(Nc1ccc(O)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450533389	EG	On-Demand	Anodyne	MAPK1	33	43
O=C(Nc1ccc(O)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450533390	EG	On-Demand	Anodyne	CHRM3	21	40
O=C(Nc1ccc(O)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450533390	EG	On-Demand	Anodyne	MAPK1	33	43
Cc1cc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)nn1C(C)C	ZINC000450533391	DF	On-Demand	Anodyne	KCNK3	64	35
Cc1cc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)nn1C(C)C	ZINC000450533391	DF	On-Demand	Anodyne	KCNK9	63	35
CCOc1cc(C(=O)N2Cc3ccccc3C[C@@H]2C)ccc1OCC(=O)O	ZINC000450533408	FG	On-Demand	Anodyne	PTGIR	50	33
CCOc1cc(C(=O)N2Cc3ccccc3C[C@@H]2C)ccc1OCC(=O)O	ZINC000450533408	FG	On-Demand	Anodyne	AGTR2	71	33
CCOc1cc(C(=O)N2Cc3ccccc3C[C@@H]2C)ccc1OCC(=O)O	ZINC000450533408	FG	On-Demand	Anodyne	CFTR	60	42
CCOc1cc(C(=O)N2Cc3ccccc3C[C@@H]2C)ccc1OCC(=O)O	ZINC000450533408	FG	On-Demand	Anodyne	ADAM9	47	34
CCOc1cc(C(=O)N2Cc3ccccc3C[C@@H]2C)ccc1OCC(=O)O	ZINC000450533408	FG	On-Demand	Anodyne	PTGDR2	19	43
CCOc1cc(C(=O)N2Cc3ccccc3C[C@H]2C)ccc1OCC(=O)O	ZINC000450533409	FG	On-Demand	Anodyne	PTGIR	50	33
CCOc1cc(C(=O)N2Cc3ccccc3C[C@H]2C)ccc1OCC(=O)O	ZINC000450533409	FG	On-Demand	Anodyne	AGTR2	71	33
CCOc1cc(C(=O)N2Cc3ccccc3C[C@H]2C)ccc1OCC(=O)O	ZINC000450533409	FG	On-Demand	Anodyne	CFTR	60	42
CCOc1cc(C(=O)N2Cc3ccccc3C[C@H]2C)ccc1OCC(=O)O	ZINC000450533409	FG	On-Demand	Anodyne	ADAM9	47	34
CCOc1cc(C(=O)N2Cc3ccccc3C[C@H]2C)ccc1OCC(=O)O	ZINC000450533409	FG	On-Demand	Anodyne	PTGDR2	19	43
C[C@H](CNC(=O)Cc1cc2ccccc2s1)S(N)(=O)=O	ZINC000450533414	DD	On-Demand	Anodyne	CA5B	53	33
C[C@H](CNC(=O)Cc1cc2ccccc2s1)S(N)(=O)=O	ZINC000450533414	DD	On-Demand	Anodyne	CA5A	56	33
C[C@@H](CNC(=O)Cc1cc2ccccc2s1)S(N)(=O)=O	ZINC000450533423	DD	On-Demand	Anodyne	CA5B	53	33
C[C@@H](CNC(=O)Cc1cc2ccccc2s1)S(N)(=O)=O	ZINC000450533423	DD	On-Demand	Anodyne	CA5A	56	33
Cc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)ccc1OCCO	ZINC000450533442	FF	On-Demand	Anodyne	VDR	48	34
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450533458	DF	On-Demand	Anodyne	AGTR2	91	38
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450533458	DF	On-Demand	Anodyne	PREP	28	44
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450533458	DF	On-Demand	Anodyne	CFTR	55	37
C[C@@H]1Cc2ccccc2CN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450533458	DF	On-Demand	Anodyne	AKR1C3	57	42
C[C@H]1Cc2ccccc2CN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450533460	DF	On-Demand	Anodyne	AGTR2	91	38
C[C@H]1Cc2ccccc2CN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450533460	DF	On-Demand	Anodyne	PREP	28	44
C[C@H]1Cc2ccccc2CN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450533460	DF	On-Demand	Anodyne	CFTR	55	37
C[C@H]1Cc2ccccc2CN1C(=O)Cc1cccc(C(=O)O)c1	ZINC000450533460	DF	On-Demand	Anodyne	AKR1C3	57	42
C[C@H]1Cc2ccccc2CN1C(=O)Cn1cc(C(=O)O)nn1	ZINC000450533462	DC	On-Demand	Anodyne	BCL2	0	43
C[C@@H]1Cc2ccccc2CN1C(=O)Cn1cc(C(=O)O)nn1	ZINC000450533464	DC	On-Demand	Anodyne	BCL2	0	43
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	HTR1A	18	60
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	DRD2	35	53
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	DRD1	20	45
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	DRD4	30	43
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	HTR2A	36	48
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	HTR2C	25	60
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	ADRA1B	18	43
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	DRD3	19	45
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	F10	0	41
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	ERG2	20	43
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	HTR7	15	42
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	SIGMAR1	15	53
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	CCR3	79	58
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	SLC18A3	16	41
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	HTR3B	0	45
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	EPHX2	23	43
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	MCHR1	79	56
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	CYP2J2	54	38
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	MEN1	40	37
N#Cc1cccc(NC(=O)C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450533481	GI	On-Demand	Mild	AP2S1	0	41
Cc1ccn(CC(=O)Nc2ccc(OCCO)c(C)c2)n1	ZINC000450533496	CD	On-Demand	Anodyne	ENPP1	56	36
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000450533499	DF	On-Demand	Anodyne	COLA	55	36
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000450533500	DF	On-Demand	Anodyne	COLA	55	36
Cc1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1OCCO	ZINC000450533510	FF	On-Demand	Anodyne	PDEC	0	42
Cc1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1OCCO	ZINC000450533511	FF	On-Demand	Anodyne	PDEC	0	42
CCCOc1ccc(C(=O)N2CCOCC3(CC3)C2)c(OC)c1	ZINC000450533556	DF	On-Demand	Anodyne	OXTR	0	40
N#Cc1cccc(N2CCC(c3noc4cc(F)ccc34)CC2)c1[N+](=O)[O-]	ZINC000450533560	FI	On-Demand	Mild	DRD2	15	51
N#Cc1cccc(N2CCC(c3noc4cc(F)ccc34)CC2)c1[N+](=O)[O-]	ZINC000450533560	FI	On-Demand	Mild	HTR2A	27	47
N#Cc1cccc(N2CCC(c3noc4cc(F)ccc34)CC2)c1[N+](=O)[O-]	ZINC000450533560	FI	On-Demand	Mild	HTR7	26	45
CN(C)c1cccnc1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450533571	DE	On-Demand	Anodyne	ADRA2A	16	47
CN(C)c1cccnc1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450533571	DE	On-Demand	Anodyne	SYK	17	42
Cc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OCCO	ZINC000450533591	FE	On-Demand	Anodyne	C5AR1	16	41
Cc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OCCO	ZINC000450533591	FE	On-Demand	Anodyne	SCD1	22	40
Cc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OCCO	ZINC000450533591	FE	On-Demand	Anodyne	ENPP1	40	33
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccnc(C(=O)O)c2)C1	ZINC000450533603	DF	On-Demand	Anodyne	SCN5A	26	40
C[C@@]1(c2ccccc2)CCN(C(=O)c2ccnc(C(=O)O)c2)C1	ZINC000450533603	DF	On-Demand	Anodyne	FTO	0	48
C[C@]1(c2ccccc2)CCN(C(=O)c2ccnc(C(=O)O)c2)C1	ZINC000450533604	DF	On-Demand	Anodyne	SCN5A	26	40
C[C@]1(c2ccccc2)CCN(C(=O)c2ccnc(C(=O)O)c2)C1	ZINC000450533604	DF	On-Demand	Anodyne	FTO	0	48
N#Cc1cccc(NC(=O)C2CCN(CC3(C#N)CCC3)CC2)c1	ZINC000450533609	DF	On-Demand	Mild	CCR3	24	46
N#Cc1cccc(NC(=O)C2CCN(CC3(C#N)CCC3)CC2)c1	ZINC000450533609	DF	On-Demand	Mild	MCHR1	40	42
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)CC1	ZINC000450533616	GH	On-Demand	Anodyne	MAPK1	31	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450533617	FG	On-Demand	Anodyne	MAPK1	33	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450533618	FG	On-Demand	Anodyne	MAPK1	33	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450533619	FG	On-Demand	Anodyne	MAPK1	33	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450533620	FG	On-Demand	Anodyne	MAPK1	33	43
CCc1cc(N2C[C@@H](CO)[C@H](c3ccc(Cl)cc3)C2)ccn1	ZINC000450533625	DH	On-Demand	Anodyne	SLC6A1	23	45
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)CCCCC(=O)O	ZINC000450533638	DG	On-Demand	Anodyne	SLC18A3	42	34
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)CCCCC(=O)O	ZINC000450533639	DG	On-Demand	Anodyne	SLC18A3	42	34
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCCCC(=O)O	ZINC000450533640	DG	On-Demand	Anodyne	SLC18A3	42	34
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCCCC(=O)O	ZINC000450533641	DG	On-Demand	Anodyne	SLC18A3	42	34
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@H]1CC[C@H]1C(=O)O	ZINC000450533644	DF	On-Demand	Anodyne	SLC18A3	41	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@H]1C(=O)O	ZINC000450533645	DF	On-Demand	Anodyne	SLC18A3	41	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H]1C(=O)O	ZINC000450533646	DF	On-Demand	Anodyne	SLC18A3	41	40
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)[C@H]1CC[C@@H]1C(=O)O	ZINC000450533647	DF	On-Demand	Anodyne	SLC18A3	41	40
COCCC1(C)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450533653	EG	On-Demand	Anodyne	PDE3B	52	31
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCc1ccccc1C(=O)O	ZINC000450533658	FI	On-Demand	Anodyne	SLC18A3	43	37
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)CCc1ccccc1C(=O)O	ZINC000450533659	FI	On-Demand	Anodyne	SLC18A3	43	37
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)CCc1ccccc1C(=O)O	ZINC000450533660	FI	On-Demand	Anodyne	SLC18A3	43	37
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)CCc1ccccc1C(=O)O	ZINC000450533661	FI	On-Demand	Anodyne	SLC18A3	43	37
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	TSHR	49	33
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	DRD4	38	46
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	ACHE	23	48
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	HRH1	20	49
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	DRD3	25	46
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	HTR3A	0	46
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	HTR4	56	39
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	CHRM3	18	42
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	SIGMAR1	30	43
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	SSTR5	71	49
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	CCR1	35	41
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	CCR3	50	42
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	MAPK1	29	41
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	EPHX2	19	42
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	MCHR1	42	46
COc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1Cl	ZINC000450533662	FH	On-Demand	Anodyne	CACNA1G	35	46
CCC(CC)Oc1ccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1	ZINC000450533663	EH	On-Demand	Anodyne	COLA	111	38
CCC(CC)Oc1ccc(C(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1	ZINC000450533663	EH	On-Demand	Anodyne	CPT1A	106	38
CCC(CC)Oc1ccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1	ZINC000450533664	EH	On-Demand	Anodyne	COLA	111	38
CCC(CC)Oc1ccc(C(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1	ZINC000450533664	EH	On-Demand	Anodyne	CPT1A	106	38
COCc1nc([C@@H]2CCCCN2c2nc(C)cc(OCc3ccccc3)n2)n[nH]1	ZINC000450533669	GG	On-Demand	Anodyne	COLA	63	37
COCc1nc([C@@H]2CCCCN2c2nc(C)cc(OCc3ccccc3)n2)n[nH]1	ZINC000450533669	GG	On-Demand	Anodyne	CPT1A	62	37
COCc1nc([C@H]2CCCCN2c2nc(C)cc(OCc3ccccc3)n2)n[nH]1	ZINC000450533670	GG	On-Demand	Anodyne	COLA	63	37
COCc1nc([C@H]2CCCCN2c2nc(C)cc(OCc3ccccc3)n2)n[nH]1	ZINC000450533670	GG	On-Demand	Anodyne	CPT1A	62	37
Cc1cc(NC(=O)CCCC(=O)C(C)(C)C)ccc1OCCO	ZINC000450533674	DG	On-Demand	Anodyne	VDR	43	41
CCOC(=O)c1csc(NC[C@](C)(O)Cc2ccc(OC)c(OC)c2)n1	ZINC000450533681	GE	On-Demand	Anodyne	DRTS_TRYCR	45	35
CCOC(=O)c1csc(NC[C@@](C)(O)Cc2ccc(OC)c(OC)c2)n1	ZINC000450533682	GE	On-Demand	Anodyne	DRTS_TRYCR	45	35
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450533684	GH	On-Demand	Anodyne	CA2	15	40
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450533684	GH	On-Demand	Anodyne	COLA	69	37
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450533684	GH	On-Demand	Anodyne	TIMP3	48	32
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450533684	GH	On-Demand	Anodyne	E1	0	40
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450533684	GH	On-Demand	Anodyne	LIMK2	41	41
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450533684	GH	On-Demand	Anodyne	RORC	61	58
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450533685	GH	On-Demand	Anodyne	CA2	15	40
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450533685	GH	On-Demand	Anodyne	COLA	69	37
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450533685	GH	On-Demand	Anodyne	TIMP3	48	32
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450533685	GH	On-Demand	Anodyne	E1	0	40
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450533685	GH	On-Demand	Anodyne	LIMK2	41	41
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450533685	GH	On-Demand	Anodyne	RORC	61	58
Cc1cc(NC(=O)c2ccnn2CC(F)(F)F)ccc1OCCO	ZINC000450533687	EE	On-Demand	Anodyne	FLT1	27	43
C[C@H]1C[C@@H](C(=O)Nc2cccc(-c3ncn(C)n3)c2)CC[C@H]1C	ZINC000450533688	DG	On-Demand	Anodyne	TYK2	52	37
C[C@@H]1CC[C@H](C(=O)Nc2cccc(-c3ncn(C)n3)c2)C[C@H]1C	ZINC000450533689	DG	On-Demand	Anodyne	TYK2	52	37
C[C@@H]1CC[C@@H](C(=O)Nc2cccc(-c3ncn(C)n3)c2)C[C@H]1C	ZINC000450533690	DG	On-Demand	Anodyne	TYK2	52	37
C[C@H]1C[C@H](C(=O)Nc2cccc(-c3ncn(C)n3)c2)CC[C@H]1C	ZINC000450533691	DG	On-Demand	Anodyne	TYK2	52	37
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450533692	CD	On-Demand	Anodyne	CCR5	32	42
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450533692	CD	On-Demand	Anodyne	MAPK1	30	42
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450533693	CD	On-Demand	Anodyne	CCR5	32	42
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000450533693	CD	On-Demand	Anodyne	MAPK1	30	42
COc1ccc(C[C@@](C)(O)CNc2ncnc3[nH]c4ccccc4c23)cc1OC	ZINC000450533711	GH	On-Demand	Anodyne	EGFR	26	44
COc1ccc(C[C@](C)(O)CNc2ncnc3[nH]c4ccccc4c23)cc1OC	ZINC000450533712	GH	On-Demand	Anodyne	EGFR	26	44
CN(C)c1nc(NCCCn2cc(CO)nn2)nc2ccccc12	ZINC000450533714	EC	On-Demand	Anodyne	ADRA2A	15	43
C[C@@]1(CCCO)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450533722	DF	On-Demand	Anodyne	SLC12A5	64	39
C[C@@]1(CCCO)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450533723	DF	On-Demand	Anodyne	SLC12A5	64	39
C[C@]1(CCCO)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450533724	DF	On-Demand	Anodyne	SLC12A5	64	39
C[C@]1(CCCO)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450533725	DF	On-Demand	Anodyne	SLC12A5	64	39
N#Cc1ccc(OCC(=O)N2CCC(CCCO)CC2)cc1Br	ZINC000450533729	GF	On-Demand	Mild	HTR1B	17	41
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCC(CCCO)CC1	ZINC000450533739	FH	On-Demand	Anodyne	RBP4	77	46
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCC(CCCO)CC1	ZINC000450533739	FH	On-Demand	Anodyne	SFRP1	44	31
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCC(CCCO)CC1	ZINC000450533739	FH	On-Demand	Anodyne	WNT3	44	31
O=C(Nc1ccc(O)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450533740	DH	On-Demand	Anodyne	MAPK1	33	43
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450533741	DG	On-Demand	Anodyne	HCRTR1	52	37
C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450533741	DG	On-Demand	Anodyne	HCRTR2	54	37
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450533742	DG	On-Demand	Anodyne	HCRTR1	52	37
C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450533742	DG	On-Demand	Anodyne	HCRTR2	54	37
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450533743	DG	On-Demand	Anodyne	HCRTR1	52	37
C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450533743	DG	On-Demand	Anodyne	HCRTR2	54	37
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450533744	DG	On-Demand	Anodyne	HCRTR1	52	37
C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450533744	DG	On-Demand	Anodyne	HCRTR2	54	37
CCn1nnc(C)c1C(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450533745	DD	On-Demand	Anodyne	ENPP1	41	32
Cc1ccc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c(Br)c1	ZINC000450533756	FG	On-Demand	Anodyne	COLA	118	41
Cc1ccc(CC(=O)N2CCCC[C@H]2c2nc[nH]n2)c(Br)c1	ZINC000450533756	FG	On-Demand	Anodyne	CPT1A	103	41
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c(Br)c1	ZINC000450533757	FG	On-Demand	Anodyne	COLA	118	41
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c(Br)c1	ZINC000450533757	FG	On-Demand	Anodyne	CPT1A	103	41
OCc1cn(CCCNc2ccnc3cc(F)c(Br)cc23)nn1	ZINC000450533760	GF	On-Demand	Anodyne	HRP1_PLAFA	113	38
OCc1cn(CCCNc2ccnc3cc(F)c(Br)cc23)nn1	ZINC000450533760	GF	On-Demand	Anodyne	HNMT	54	40
O=[N+]([O-])c1ccc2c(=NC[C@@]3(CO)C[C@H]3c3ccccc3)[nH]ccc2c1	ZINC000450533761	EG	On-Demand	Bother	CACNA1D	43	32
O=[N+]([O-])c1ccc2c(=NC[C@]3(CO)C[C@H]3c3ccccc3)[nH]ccc2c1	ZINC000450533762	EG	On-Demand	Bother	CACNA1D	43	32
O=[N+]([O-])c1ccc2c(=NC[C@]3(CO)C[C@@H]3c3ccccc3)[nH]ccc2c1	ZINC000450533763	EG	On-Demand	Bother	CACNA1D	43	32
O=[N+]([O-])c1ccc2c(=NC[C@@]3(CO)C[C@@H]3c3ccccc3)[nH]ccc2c1	ZINC000450533764	EG	On-Demand	Bother	CACNA1D	43	32
Cc1cc(C)c(C(=O)Nc2ccc(OCCO)c(C)c2)cc1Br	ZINC000450533767	GH	On-Demand	Anodyne	KCNK3	47	34
Cc1cc(C)c(C(=O)Nc2ccc(OCCO)c(C)c2)cc1Br	ZINC000450533767	GH	On-Demand	Anodyne	KCNK9	49	34
COc1cccc(OCCC(=O)N2CCC[C@]2(C)CCCO)c1	ZINC000450533779	DF	On-Demand	Anodyne	MTNR1A	15	40
COc1cccc(OCCC(=O)N2CCC[C@@]2(C)CCCO)c1	ZINC000450533780	DF	On-Demand	Anodyne	MTNR1A	15	40
CCS(=O)(=O)c1ccc(CN[C@@](C)(C(N)=O)c2ccccc2)cc1	ZINC000450533785	ED	On-Demand	Anodyne	CA2	25	40
CCS(=O)(=O)c1ccc(CN[C@@](C)(C(N)=O)c2ccccc2)cc1	ZINC000450533785	ED	On-Demand	Anodyne	CYNT	29	40
CCS(=O)(=O)c1ccc(CN[C@@](C)(C(N)=O)c2ccccc2)cc1	ZINC000450533785	ED	On-Demand	Anodyne	RORC	48	37
CCS(=O)(=O)c1ccc(CN[C@](C)(C(N)=O)c2ccccc2)cc1	ZINC000450533786	ED	On-Demand	Anodyne	CA2	25	40
CCS(=O)(=O)c1ccc(CN[C@](C)(C(N)=O)c2ccccc2)cc1	ZINC000450533786	ED	On-Demand	Anodyne	CYNT	29	40
CCS(=O)(=O)c1ccc(CN[C@](C)(C(N)=O)c2ccccc2)cc1	ZINC000450533786	ED	On-Demand	Anodyne	RORC	48	37
O=C(O)c1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)o1	ZINC000450533811	DG	On-Demand	Anodyne	CRTM	42	36
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	PDE5A	20	40
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	DRD2	26	44
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	DRD4	53	44
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	ACHE	29	40
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	HRH1	20	45
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	DRD3	26	44
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	OPRK1	0	40
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	HTR4	46	41
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	SIGMAR1	28	40
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	SSTR5	68	45
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	CCR3	69	53
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	ITGA4	64	33
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	MLNR	28	45
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	CXCR3	31	40
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	MCHR1	91	45
COc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccc1Cl	ZINC000450533819	GI	On-Demand	Mild	CACNA1G	41	44
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCC(CCCO)CC1	ZINC000450533820	GH	On-Demand	Anodyne	GRIN2B	42	46
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCC(CCCO)CC1	ZINC000450533820	GH	On-Demand	Anodyne	HRH4	22	47
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCC(CCCO)CC1	ZINC000450533820	GH	On-Demand	Anodyne	AKR1C3	21	52
C[C@H](CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)S(C)(=O)=O	ZINC000450533834	ED	On-Demand	Mild	CCR3	35	47
C[C@H](CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)S(C)(=O)=O	ZINC000450533834	ED	On-Demand	Mild	ITGA4	49	32
C[C@H](CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)S(C)(=O)=O	ZINC000450533834	ED	On-Demand	Mild	MCHR1	43	41
C[C@@H](CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)S(C)(=O)=O	ZINC000450533835	ED	On-Demand	Mild	CCR3	35	47
C[C@@H](CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)S(C)(=O)=O	ZINC000450533835	ED	On-Demand	Mild	ITGA4	49	32
C[C@@H](CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1)S(C)(=O)=O	ZINC000450533835	ED	On-Demand	Mild	MCHR1	43	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCOCC2(CC2)C1	ZINC000450533838	CD	On-Demand	Anodyne	PSMB8	41	35
CO[C@H](Cc1ccccc1)C(=O)N1CCOCC2(CC2)C1	ZINC000450533839	CD	On-Demand	Anodyne	PSMB8	41	35
O=C(O)CCCCC(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450533842	DG	On-Demand	Anodyne	CRTM	41	37
CN(C)c1cccnc1CNc1ncc(Br)cc1C(F)(F)F	ZINC000450533849	GH	On-Demand	Anodyne	PTK2	53	32
O=C(Cc1ccc(C(=O)O)cc1)NCCCCc1ccc(F)c(F)c1	ZINC000450533852	EG	On-Demand	Anodyne	CRTM	42	38
Cc1cc(NC(=O)C(C)(C)C(C)(F)F)ccc1OCCO	ZINC000450533853	DF	On-Demand	Anodyne	VDR	42	35
Cc1cc(NC(=O)C(C)(C)C(C)(F)F)ccc1OCCO	ZINC000450533853	DF	On-Demand	Anodyne	PPARD	42	37
C[C@H](c1ccccc1)[C@H](O)CN[C@](C)(C(N)=O)c1ccccc1	ZINC000450533863	DE	On-Demand	Anodyne	KIF11	27	43
C[C@H](c1ccccc1)[C@@H](O)CN[C@@](C)(C(N)=O)c1ccccc1	ZINC000450533864	DE	On-Demand	Anodyne	KIF11	27	43
C[C@H](c1ccccc1)[C@@H](O)CN[C@](C)(C(N)=O)c1ccccc1	ZINC000450533865	DE	On-Demand	Anodyne	KIF11	27	43
C[C@H](c1ccccc1)[C@H](O)CN[C@@](C)(C(N)=O)c1ccccc1	ZINC000450533866	DE	On-Demand	Anodyne	KIF11	27	43
COc1cccc(OCCC(=O)NC[C@H](C)S(N)(=O)=O)c1	ZINC000450533867	DC	On-Demand	Anodyne	MTNR1A	60	54
COc1cccc(OCCC(=O)NC[C@H](C)S(N)(=O)=O)c1	ZINC000450533867	DC	On-Demand	Anodyne	MTNR1B	51	54
COc1cccc(OCCC(=O)NC[C@@H](C)S(N)(=O)=O)c1	ZINC000450533868	DC	On-Demand	Anodyne	MTNR1A	60	54
COc1cccc(OCCC(=O)NC[C@@H](C)S(N)(=O)=O)c1	ZINC000450533868	DC	On-Demand	Anodyne	MTNR1B	51	54
C[C@H](CNC(=O)C1=C(c2ccccc2)CCCC1)S(N)(=O)=O	ZINC000450533875	DD	On-Demand	Anodyne	ITGAV	40	34
C[C@@H](CNC(=O)C1=C(c2ccccc2)CCCC1)S(N)(=O)=O	ZINC000450533876	DD	On-Demand	Anodyne	ITGAV	40	34
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCC[C@@H](C(=O)O)C1	ZINC000450533877	DF	On-Demand	Anodyne	AGTR2	68	41
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCC[C@@H](C(=O)O)C1	ZINC000450533877	DF	On-Demand	Anodyne	PREP	34	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CCC[C@H](C(=O)O)C1	ZINC000450533878	DF	On-Demand	Anodyne	AGTR2	68	41
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CCC[C@H](C(=O)O)C1	ZINC000450533878	DF	On-Demand	Anodyne	PREP	34	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450533879	DF	On-Demand	Anodyne	AGTR2	68	41
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450533879	DF	On-Demand	Anodyne	PREP	34	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCC[C@H](C(=O)O)C1	ZINC000450533880	DF	On-Demand	Anodyne	AGTR2	68	41
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCC[C@H](C(=O)O)C1	ZINC000450533880	DF	On-Demand	Anodyne	PREP	34	45
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CCC(CCCO)CC1	ZINC000450533881	GH	On-Demand	Anodyne	PDE6D	94	42
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CCC(CCCO)CC1	ZINC000450533881	GH	On-Demand	Anodyne	NS5B	0	40
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CCC(CCCO)CC1	ZINC000450533881	GH	On-Demand	Anodyne	IMDH_CRYPV	30	46
CC(F)(F)c1ccc(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)cn1	ZINC000450533907	GH	On-Demand	Anodyne	SFRP1	30	40
CC(F)(F)c1ccc(C(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)cn1	ZINC000450533908	GH	On-Demand	Anodyne	SFRP1	30	40
O=C(c1ccc(-c2ccncc2)c(F)c1)N1CCC(CCCO)CC1	ZINC000450533913	EH	On-Demand	Anodyne	L3MBTL3	58	36
O=C(O)c1ccc(C(=O)N[C@@H]2CCOC2)c(F)c1	ZINC000450533934	CD	On-Demand	Anodyne	CCR3	15	42
O=C(O)c1ccc(C(=O)N[C@@H]2CCOC2)c(F)c1	ZINC000450533934	CD	On-Demand	Anodyne	MAPK13	53	33
O=C(O)c1ccc(C(=O)N[C@@H]2CCOC2)c(F)c1	ZINC000450533934	CD	On-Demand	Anodyne	MCHR1	16	41
O=C(O)c1ccc(C(=O)N[C@H]2CCOC2)c(F)c1	ZINC000450533935	CD	On-Demand	Anodyne	CCR3	15	42
O=C(O)c1ccc(C(=O)N[C@H]2CCOC2)c(F)c1	ZINC000450533935	CD	On-Demand	Anodyne	MAPK13	53	33
O=C(O)c1ccc(C(=O)N[C@H]2CCOC2)c(F)c1	ZINC000450533935	CD	On-Demand	Anodyne	MCHR1	16	41
CC(=O)c1nc(N2CCC(c3noc4cc(F)ccc34)CC2)sc1C	ZINC000450533940	FI	On-Demand	Anodyne	DRD2	16	53
CC(=O)c1nc(N2CCC(c3noc4cc(F)ccc34)CC2)sc1C	ZINC000450533940	FI	On-Demand	Anodyne	HTR2A	28	49
CC(=O)c1nc(N2CCC(c3noc4cc(F)ccc34)CC2)sc1C	ZINC000450533940	FI	On-Demand	Anodyne	HTR7	27	47
Cc1cc(NC(=O)C[C@H]2COc3ccccc3O2)ccc1OCCO	ZINC000450533943	EF	On-Demand	Anodyne	ADRA2B	16	41
Cc1cc(NC(=O)C[C@@H]2COc3ccccc3O2)ccc1OCCO	ZINC000450533944	EF	On-Demand	Anodyne	ADRA2B	16	41
CC(C)N(C)C[C@@H](C)Nc1nccc2c([N+](=O)[O-])cccc12	ZINC000450533950	DG	On-Demand	Bother	COLA	57	34
CC(C)N(C)C[C@H](C)Nc1nccc2c([N+](=O)[O-])cccc12	ZINC000450533951	DG	On-Demand	Bother	COLA	57	34
Cc1cc(NC(=O)c2ccc(C)c3c2CCC3)ccc1OCCO	ZINC000450533960	EG	On-Demand	Anodyne	KCNK3	41	34
Cc1cc(NC(=O)c2ccc(C)c3c2CCC3)ccc1OCCO	ZINC000450533960	EG	On-Demand	Anodyne	KCNK9	44	34
O=C(Nc1ccc(O)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450533963	FH	On-Demand	Anodyne	SLC6A1	0	44
O=C(Nc1ccc(O)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450533963	FH	On-Demand	Anodyne	SIGMAR1	28	48
O=C(Nc1ccc(O)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450533963	FH	On-Demand	Anodyne	CCR1	19	40
O=C(Nc1ccc(O)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450533963	FH	On-Demand	Anodyne	MAPK1	29	41
O=C(Nc1ccc(O)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450533963	FH	On-Demand	Anodyne	MCHR1	20	41
O=C(Nc1ccc(O)cc1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450533963	FH	On-Demand	Anodyne	CACNA1G	34	46
COCC[C@H](COC)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450533972	DF	On-Demand	Anodyne	UTS2R	29	46
COCC[C@@H](COC)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450533973	DF	On-Demand	Anodyne	UTS2R	29	46
Cc1cc(NC(=O)Cc2cn(C)nc2C)ccc1OCCO	ZINC000450533978	DD	On-Demand	Anodyne	ENPP1	55	35
O=C(c1ccc(Oc2ccc(Cl)cc2)cn1)N1CCC(CCCO)CC1	ZINC000450533986	FI	On-Demand	Anodyne	FAAH	21	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450533989	GH	On-Demand	Anodyne	CCR3	61	33
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450533990	GH	On-Demand	Anodyne	CCR3	61	33
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450533991	GH	On-Demand	Anodyne	CCR3	61	33
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000450533992	GH	On-Demand	Anodyne	CCR3	61	33
Cc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)ccc1OCCO	ZINC000450533999	FF	On-Demand	Anodyne	DGAT1	16	40
CC(=O)N[C@H](C(=O)Nc1ccc(OCCO)c(C)c1)C(C)(C)C	ZINC000450534004	DD	On-Demand	Anodyne	VDR	46	34
Cc1cc(NC(=O)c2cc(C)n(C(C)C)n2)ccc1OCCO	ZINC000450534005	DF	On-Demand	Anodyne	PTGER1	24	40
CCC(CC)Oc1ccc(C(=O)N2CCC(CCCO)CC2)cc1	ZINC000450534011	EH	On-Demand	Anodyne	LSS	15	40
CCC(CC)Oc1ccc(C(=O)N2CCC(CCCO)CC2)cc1	ZINC000450534011	EH	On-Demand	Anodyne	L3MBTL3	68	38
Cc1cc(CNc2nccc(-c3cnccn3)n2)cc(N2CCCC2)n1	ZINC000450534012	EF	On-Demand	Anodyne	SMG1	51	34
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450534017	GG	On-Demand	Mild	CCKAR	0	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450534017	GG	On-Demand	Mild	CCR3	45	52
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450534017	GG	On-Demand	Mild	ITGA4	60	32
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450534017	GG	On-Demand	Mild	MCHR1	60	40
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450534018	GG	On-Demand	Mild	CCKAR	0	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450534018	GG	On-Demand	Mild	CCR3	45	52
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450534018	GG	On-Demand	Mild	ITGA4	60	32
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000450534018	GG	On-Demand	Mild	MCHR1	60	40
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1O	ZINC000450534020	EE	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)Nc2ccc(OCCO)c(C)c2)ccc1O	ZINC000450534020	EE	On-Demand	Anodyne	ENPP1	56	36
O=C(Nc1ccc(O)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450534021	FI	On-Demand	Anodyne	SLC6A1	44	35
O=C(Nc1ccc(O)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450534021	FI	On-Demand	Anodyne	MAPK1	35	47
O=C(Nc1ccc(O)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450534021	FI	On-Demand	Anodyne	SLC6A5	32	41
O=C(Nc1ccc(O)cc1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450534021	FI	On-Demand	Anodyne	EPHX2	15	41
O=C(Nc1ccc(O)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450534022	FI	On-Demand	Anodyne	SLC6A1	44	35
O=C(Nc1ccc(O)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450534022	FI	On-Demand	Anodyne	MAPK1	35	47
O=C(Nc1ccc(O)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450534022	FI	On-Demand	Anodyne	SLC6A5	32	41
O=C(Nc1ccc(O)cc1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450534022	FI	On-Demand	Anodyne	EPHX2	15	41
N#Cc1cccc(NC(=O)C2CCN(CC/C=C/c3ccccc3)CC2)c1	ZINC000450534024	FI	On-Demand	Mild	CCR3	37	52
N#Cc1cccc(NC(=O)C2CCN(CC/C=C/c3ccccc3)CC2)c1	ZINC000450534024	FI	On-Demand	Mild	MCHR1	60	41
N#Cc1cccc(NC(=O)C2CCN(CC/C=C\c3ccccc3)CC2)c1	ZINC000450534025	FI	On-Demand	Mild	CCR3	37	52
N#Cc1cccc(NC(=O)C2CCN(CC/C=C\c3ccccc3)CC2)c1	ZINC000450534025	FI	On-Demand	Mild	MCHR1	60	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCOCC2(CC2)C1	ZINC000450534027	DE	On-Demand	Anodyne	AKR1C3	25	44
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCOCC2(CC2)C1	ZINC000450534028	DE	On-Demand	Anodyne	AKR1C3	25	44
C[C@@H](Sc1ccccc1C(=O)NCCCCc1ccc(F)c(F)c1)C(=O)O	ZINC000450534029	GI	On-Demand	Anodyne	SLC6A5	32	44
C[C@H](Sc1ccccc1C(=O)NCCCCc1ccc(F)c(F)c1)C(=O)O	ZINC000450534030	GI	On-Demand	Anodyne	SLC6A5	32	44
CCCN(Cc1cccc(C(C)=O)c1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450534032	EI	On-Demand	Anodyne	GUAB	0	41
CCCN(Cc1cccc(C(C)=O)c1)[C@@H](C)C(=O)Nc1ccccc1	ZINC000450534032	EI	On-Demand	Anodyne	KCNK3	67	38
CCCN(Cc1cccc(C(C)=O)c1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450534033	EI	On-Demand	Anodyne	GUAB	0	41
CCCN(Cc1cccc(C(C)=O)c1)[C@H](C)C(=O)Nc1ccccc1	ZINC000450534033	EI	On-Demand	Anodyne	KCNK3	67	38
CCOC(=O)c1csc(N2CCC(c3noc4cc(F)ccc34)CC2)n1	ZINC000450534040	GH	On-Demand	Anodyne	DRD2	16	53
CCOC(=O)c1csc(N2CCC(c3noc4cc(F)ccc34)CC2)n1	ZINC000450534040	GH	On-Demand	Anodyne	HTR2A	28	53
CCOC(=O)c1csc(N2CCC(c3noc4cc(F)ccc34)CC2)n1	ZINC000450534040	GH	On-Demand	Anodyne	HTR7	26	44
COc1ccc(-c2ccnc(NCC3(SC)CCN(C)CC3)n2)cc1	ZINC000450534047	FG	On-Demand	Anodyne	ZAP70	20	40
COc1ccc(-c2ccnc(NCC3(SC)CCN(C)CC3)n2)cc1	ZINC000450534047	FG	On-Demand	Anodyne	CLK4	21	48
Cc1cc(NC(=O)c2cccc3c2O[C@H](C)C3)ccc1OCCO	ZINC000450534054	EF	On-Demand	Anodyne	MTTP	71	37
Cc1cc(NC(=O)c2cccc3c2O[C@H](C)C3)ccc1OCCO	ZINC000450534054	EF	On-Demand	Anodyne	KCNK3	49	35
Cc1cc(NC(=O)c2cccc3c2O[C@H](C)C3)ccc1OCCO	ZINC000450534054	EF	On-Demand	Anodyne	KCNK9	50	35
Cc1cc(NC(=O)c2cccc3c2O[C@@H](C)C3)ccc1OCCO	ZINC000450534055	EF	On-Demand	Anodyne	MTTP	71	37
Cc1cc(NC(=O)c2cccc3c2O[C@@H](C)C3)ccc1OCCO	ZINC000450534055	EF	On-Demand	Anodyne	KCNK3	49	35
Cc1cc(NC(=O)c2cccc3c2O[C@@H](C)C3)ccc1OCCO	ZINC000450534055	EF	On-Demand	Anodyne	KCNK9	50	35
CSC1(CNc2nc(N(C)C)c3ccccc3n2)CCN(C)CC1	ZINC000450534057	EE	On-Demand	Anodyne	ADRA2A	15	45
CC1=C(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)CCC(C)(C)C1	ZINC000450534065	FH	On-Demand	Anodyne	LRRK2	15	44
CN(C)c1nc(N[C@H]2C[C@@H]2C(F)F)nc2ccccc12	ZINC000450534072	CF	On-Demand	Anodyne	ADRA2A	0	48
C[C@H](NC(=O)C1(CF)CCOCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534075	FI	On-Demand	Mild	ACACA	51	37
C[C@H](NC(=O)C1(CF)CCOCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534075	FI	On-Demand	Mild	CTSC	22	41
C[C@@H](NC(=O)C1(CF)CCOCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534076	FI	On-Demand	Mild	ACACA	51	37
C[C@@H](NC(=O)C1(CF)CCOCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534076	FI	On-Demand	Mild	CTSC	22	41
CCCc1ccc2nccc(N3CC[C@H](C(=O)N4CCCC4)C3)c2c1	ZINC000450534081	EH	On-Demand	Anodyne	PREP	41	32
CCCc1ccc2nccc(N3CC[C@H](C(=O)N4CCCC4)C3)c2c1	ZINC000450534081	EH	On-Demand	Anodyne	ECE2	0	40
CCCc1ccc2nccc(N3CC[C@@H](C(=O)N4CCCC4)C3)c2c1	ZINC000450534082	EH	On-Demand	Anodyne	PREP	41	32
CCCc1ccc2nccc(N3CC[C@@H](C(=O)N4CCCC4)C3)c2c1	ZINC000450534082	EH	On-Demand	Anodyne	ECE2	0	40
O=[N+]([O-])c1ccc(-c2csc(N[C@@H]3CC[C@@H](F)C3)n2)cc1	ZINC000450534097	DG	On-Demand	Bother	MAOB	29	55
O=[N+]([O-])c1ccc(-c2csc(N[C@H]3CC[C@@H](F)C3)n2)cc1	ZINC000450534098	DG	On-Demand	Bother	MAOB	29	55
O=[N+]([O-])c1ccc(-c2csc(N[C@H]3CC[C@H](F)C3)n2)cc1	ZINC000450534099	DG	On-Demand	Bother	MAOB	29	55
O=[N+]([O-])c1ccc(-c2csc(N[C@@H]3CC[C@H](F)C3)n2)cc1	ZINC000450534100	DG	On-Demand	Bother	MAOB	29	55
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1c[nH]c2nccc-2c1	ZINC000450534102	FF	On-Demand	Anodyne	BTK	33	44
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450534103	GH	On-Demand	Anodyne	ACHE	15	46
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450534103	GH	On-Demand	Anodyne	OPRM1	0	44
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450534103	GH	On-Demand	Anodyne	OPRK1	41	40
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450534103	GH	On-Demand	Anodyne	HTR4	37	44
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450534103	GH	On-Demand	Anodyne	CCR1	25	44
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)c1	ZINC000450534108	EH	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)c1	ZINC000450534108	EH	On-Demand	Anodyne	HCRTR2	17	43
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)CC2)c1	ZINC000450534109	EH	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)CC2)c1	ZINC000450534109	EH	On-Demand	Anodyne	HCRTR2	17	43
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)c1	ZINC000450534110	EH	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)c1	ZINC000450534110	EH	On-Demand	Anodyne	HCRTR2	17	43
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)c1	ZINC000450534111	EH	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)c1	ZINC000450534111	EH	On-Demand	Anodyne	HCRTR2	17	43
COc1ccccc1O[C@@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450534113	EG	On-Demand	Anodyne	PDE3A	47	41
COc1ccccc1O[C@@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450534113	EG	On-Demand	Anodyne	PDE3B	69	40
COc1ccccc1O[C@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450534114	EG	On-Demand	Anodyne	PDE3A	47	41
COc1ccccc1O[C@H]1CCCN(c2ncc(C(F)F)cn2)C1	ZINC000450534114	EG	On-Demand	Anodyne	PDE3B	69	40
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450534127	FG	On-Demand	Anodyne	GNAI1	0	49
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450534127	FG	On-Demand	Anodyne	GNAI3	0	51
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450534127	FG	On-Demand	Anodyne	GNAO1	0	49
N#Cc1cnc(N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450534137	FF	On-Demand	Mild	ETHR	41	33
O=C(C1CC1)C1(C(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000450534146	FG	On-Demand	Anodyne	TACR3	40	34
FC(F)[C@H]1C[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450534151	DG	On-Demand	Anodyne	EGFR	43	39
CCC(CC)Oc1ccc(C(=O)N2CCOC[C@H]2c2nc(C)no2)cc1	ZINC000450534163	FG	On-Demand	Anodyne	COLA	29	41
CCC(CC)Oc1ccc(C(=O)N2CCOC[C@H]2c2nc(C)no2)cc1	ZINC000450534163	FG	On-Demand	Anodyne	CPT1A	21	41
CCC(CC)Oc1ccc(C(=O)N2CCOC[C@@H]2c2nc(C)no2)cc1	ZINC000450534164	FG	On-Demand	Anodyne	COLA	29	41
CCC(CC)Oc1ccc(C(=O)N2CCOC[C@@H]2c2nc(C)no2)cc1	ZINC000450534164	FG	On-Demand	Anodyne	CPT1A	21	41
O=C(Nc1cccc2c1OCO2)c1cnc(C2CC2)nc1	ZINC000450534170	CE	On-Demand	Anodyne	G2YM83_BOTF4	52	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534171	GG	On-Demand	Anodyne	ANPEP	42	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534171	GG	On-Demand	Anodyne	CTSK	41	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534171	GG	On-Demand	Anodyne	CAPNS1	43	30
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534171	GG	On-Demand	Anodyne	CAPN1	53	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534171	GG	On-Demand	Anodyne	CAPN2	79	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534171	GG	On-Demand	Anodyne	FPR1	55	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534171	GG	On-Demand	Anodyne	NPR	59	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534171	GG	On-Demand	Anodyne	PSMB5	42	32
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	FKBP1A	46	36
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	ACHE	23	42
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	PPARA	22	40
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	PDE4A	49	48
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	HCRTR1	25	44
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	TRPV1	28	45
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	SIGMAR1	17	47
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	SSTR5	15	40
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	PDE4B	31	48
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	PDE4D	38	48
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	UTS2R	20	40
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	PPARD	21	40
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	ROCK2	18	49
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	PDE4C	16	48
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	MT-ND1	24	42
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	HCRTR2	26	41
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	MBTPS1	43	32
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	PDEC	0	41
COc1cc(CNC(=O)Cc2cccc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450534172	GH	On-Demand	Anodyne	ACKR3	48	33
Cc1ccc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)c(Br)c1	ZINC000450534177	GF	On-Demand	Anodyne	COLA	30	43
Cc1ccc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)c(Br)c1	ZINC000450534177	GF	On-Demand	Anodyne	CPT1A	27	43
Cc1ccc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)c(Br)c1	ZINC000450534178	GF	On-Demand	Anodyne	COLA	30	43
Cc1ccc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)c(Br)c1	ZINC000450534178	GF	On-Demand	Anodyne	CPT1A	27	43
CCN(CC)C(=O)CCC1CCN(C(=O)C[C@@H]2COc3ccccc3O2)CC1	ZINC000450534179	GG	On-Demand	Anodyne	CCR8	44	33
CCN(CC)C(=O)CCC1CCN(C(=O)C[C@H]2COc3ccccc3O2)CC1	ZINC000450534180	GG	On-Demand	Anodyne	CCR8	44	33
Cc1ccnc(OC2CCN(C(=O)c3ccnc(OC(F)F)c3)CC2)c1	ZINC000450534185	FG	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)c3ccnc(OC(F)F)c3)CC2)c1	ZINC000450534185	FG	On-Demand	Anodyne	HCRTR2	22	43
Cc1nc(N[C@@H]2CC[C@@H](Nc3ccccn3)CC2)c2cc[nH]c2n1	ZINC000450534190	DG	On-Demand	Anodyne	PRKD1	50	38
Cc1nc(N[C@@H]2CC[C@@H](Nc3ccccn3)CC2)c2cc[nH]c2n1	ZINC000450534190	DG	On-Demand	Anodyne	JAK1	41	34
Cc1nc(N[C@@H]2CC[C@@H](Nc3ccccn3)CC2)c2cc[nH]c2n1	ZINC000450534190	DG	On-Demand	Anodyne	IRAK4	15	47
Cc1ccnc(OC2CCN(C(=O)c3ccc(C#N)n3C)CC2)c1	ZINC000450534191	DE	On-Demand	Mild	HCRTR1	21	42
Cc1ccnc(OC2CCN(C(=O)c3ccc(C#N)n3C)CC2)c1	ZINC000450534191	DE	On-Demand	Mild	HCRTR2	22	42
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450534194	GH	On-Demand	Anodyne	SFRP1	35	43
O=C(CCCC(=O)C1CC1)Nc1ncc(C2CCCCC2)s1	ZINC000450534207	DI	On-Demand	Anodyne	CDK5	64	58
O=[N+]([O-])c1ccc2nc(N3CC[C@H](Oc4cccnc4N4CCCC4)C3)[nH]c2c1	ZINC000450534223	GG	On-Demand	Bother	PDE3B	58	36
O=[N+]([O-])c1ccc2nc(N3CC[C@@H](Oc4cccnc4N4CCCC4)C3)[nH]c2c1	ZINC000450534224	GG	On-Demand	Bother	PDE3B	58	36
CC[C@H](CC(F)(F)F)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534240	EH	On-Demand	Anodyne	CARM1	43	38
CC[C@@H](CC(F)(F)F)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534241	EH	On-Demand	Anodyne	CARM1	43	38
O=C(Nc1cccc(CN2CCOCC2)n1)c1c[nH]c2nccc-2c1	ZINC000450534250	ED	On-Demand	Anodyne	PIK3CA	26	40
O=C(Nc1cccc(CN2CCOCC2)n1)c1c[nH]c2nccc-2c1	ZINC000450534250	ED	On-Demand	Anodyne	SMG1	40	31
Cc1ccnc(OC2CCN(C(=O)Cc3ccc(O)c(F)c3)CC2)c1	ZINC000450534258	EF	On-Demand	Anodyne	MLNR	24	40
CCOC(=O)c1cc(C(=O)Nc2ncc(C3CCCCC3)s2)on1	ZINC000450534259	EH	On-Demand	Anodyne	CDK5	57	47
N#Cc1cccc(N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c1[N+](=O)[O-]	ZINC000450534264	FG	On-Demand	Mild	ETHR	45	37
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534270	FH	On-Demand	Anodyne	CNR1	0	40
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534270	FH	On-Demand	Anodyne	CNR2	22	45
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534270	FH	On-Demand	Anodyne	HRH3	22	40
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534270	FH	On-Demand	Anodyne	LRRK2	17	44
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534270	FH	On-Demand	Anodyne	L3MBTL3	51	33
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534271	FH	On-Demand	Anodyne	CNR1	0	40
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534271	FH	On-Demand	Anodyne	CNR2	22	45
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534271	FH	On-Demand	Anodyne	HRH3	22	40
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534271	FH	On-Demand	Anodyne	LRRK2	17	44
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534271	FH	On-Demand	Anodyne	L3MBTL3	51	33
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534272	FH	On-Demand	Anodyne	CNR1	0	40
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534272	FH	On-Demand	Anodyne	CNR2	22	45
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534272	FH	On-Demand	Anodyne	HRH3	22	40
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534272	FH	On-Demand	Anodyne	LRRK2	17	44
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534272	FH	On-Demand	Anodyne	L3MBTL3	51	33
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534273	FH	On-Demand	Anodyne	CNR1	0	40
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534273	FH	On-Demand	Anodyne	CNR2	22	45
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534273	FH	On-Demand	Anodyne	HRH3	22	40
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534273	FH	On-Demand	Anodyne	LRRK2	17	44
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534273	FH	On-Demand	Anodyne	L3MBTL3	51	33
CCS(=O)(=O)N1CCN(c2ccc(I)cn2)[C@H](C)C1	ZINC000450534282	GD	On-Demand	Anodyne	CXCR3	0	46
O=C([C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1)N1CCCC1	ZINC000450534285	FH	On-Demand	Anodyne	TRPV1	15	41
O=C([C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1)N1CCCC1	ZINC000450534285	FH	On-Demand	Anodyne	LIPG	58	39
O=C([C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1)N1CCCC1	ZINC000450534286	FH	On-Demand	Anodyne	TRPV1	15	41
O=C([C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1)N1CCCC1	ZINC000450534286	FH	On-Demand	Anodyne	LIPG	58	39
Cc1ccnc(OC2CCN(C(=O)CC3CC(F)(F)C3)CC2)c1	ZINC000450534289	DG	On-Demand	Anodyne	HCRTR1	19	41
Cc1ccnc(OC2CCN(C(=O)CC3CC(F)(F)C3)CC2)c1	ZINC000450534289	DG	On-Demand	Anodyne	HCRTR2	20	41
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1	ZINC000450534290	FG	On-Demand	Anodyne	BTK	46	41
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1	ZINC000450534290	FG	On-Demand	Anodyne	LRRK2	15	45
CCN(CCN1CCCCCC1)c1nccc(C#N)n1	ZINC000450534292	CE	On-Demand	Mild	HNMT	36	45
COc1ccc2c(N3C[C@@H](CO)[C@H](c4ccsc4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450534306	GG	On-Demand	Bother	NPBWR1	72	31
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)c1	ZINC000450534312	FG	On-Demand	Anodyne	HCRTR1	24	45
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)c1	ZINC000450534312	FG	On-Demand	Anodyne	HCRTR2	25	45
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)c1	ZINC000450534313	FG	On-Demand	Anodyne	HCRTR1	24	45
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)c1	ZINC000450534313	FG	On-Demand	Anodyne	HCRTR2	25	45
Cc1nc(NC[C@@](C)(CO)c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450534316	DE	On-Demand	Bother	PRKCQ	49	43
Cc1nc(NC[C@](C)(CO)c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450534317	DE	On-Demand	Bother	PRKCQ	49	43
C=CCC[C@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450534324	DF	On-Demand	Mild	NOD1	74	35
C=CCC[C@@H](NC(=O)CCCc1cc(F)ccc1F)C(=O)O	ZINC000450534325	DF	On-Demand	Mild	NOD1	74	35
C[C@@H](O)CCN(Cc1ccc(F)cc1F)C1CCCC1	ZINC000450534327	CG	On-Demand	Anodyne	SLC6A2	16	43
C[C@H](O)CCN(Cc1ccc(F)cc1F)C1CCCC1	ZINC000450534328	CG	On-Demand	Anodyne	SLC6A2	16	43
CN(C)c1nc(NCC2(S(C)(=O)=O)CCCC2)nc2ccccc12	ZINC000450534344	ED	On-Demand	Anodyne	ADRA2A	17	57
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)CCCC(=O)C1CC1	ZINC000450534354	FF	On-Demand	Anodyne	LRRK2	15	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)CCCC(=O)C1CC1	ZINC000450534354	FF	On-Demand	Anodyne	L3MBTL3	46	33
COc1ccc(-c2ccnc(N[C@@H]3CC[C@@H](F)C3)n2)cc1	ZINC000450534356	CG	On-Demand	Anodyne	MAPK1	56	40
COc1ccc(-c2ccnc(N[C@H]3CC[C@@H](F)C3)n2)cc1	ZINC000450534357	CG	On-Demand	Anodyne	MAPK1	56	40
COc1ccc(-c2ccnc(N[C@@H]3CC[C@H](F)C3)n2)cc1	ZINC000450534358	CG	On-Demand	Anodyne	MAPK1	56	40
COc1ccc(-c2ccnc(N[C@H]3CC[C@H](F)C3)n2)cc1	ZINC000450534359	CG	On-Demand	Anodyne	MAPK1	56	40
CCc1cc(=N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)cc[nH]1	ZINC000450534451	EF	On-Demand	Anodyne	ETHR	56	39
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	DRD2	46	38
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	ACHE	33	40
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	ADRB3	21	41
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	PDE4A	47	47
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	HCRTR1	28	44
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	FABP4	45	42
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	SIGMAR1	16	45
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	SSTR5	21	41
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	BCHE	41	41
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	KCNA3	43	39
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	PDE4B	28	47
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	PDE4D	33	47
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	PDE4C	17	47
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	HCRTR2	32	41
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	FAP	0	40
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	ABCG2	19	41
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	MBTPS1	45	34
COc1cc(CNC(=O)Cc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450534452	GH	On-Demand	Anodyne	ACKR3	43	33
O=C(CCC(F)(F)F)N1CCC[C@@H](N=c2[nH]c3cccc(F)c3s2)C1	ZINC000450534470	GH	On-Demand	Anodyne	ETHR	51	38
CO[C@@H](C)CN(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450534471	CF	On-Demand	Anodyne	TUBB3	35	45
CO[C@H](C)CN(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450534472	CF	On-Demand	Anodyne	TUBB3	35	45
Cc1nc(N[C@H]2C[C@@H]2C(F)F)ncc1[N+](=O)[O-]	ZINC000450534473	BD	On-Demand	Bother	PRKCQ	43	34
Cc1[nH]c(C#N)cc1C(=O)N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000450534476	GI	On-Demand	Mild	CTSF	41	30
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000450534477	GI	On-Demand	Mild	CTSF	41	30
CCCOc1cc(OC)ccc1C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450534505	GG	On-Demand	Anodyne	MTNR1B	15	41
CCCOc1cc(OC)ccc1C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450534506	GG	On-Demand	Anodyne	MTNR1B	15	41
CNC(=O)Cn1nc(NC(=O)CCOc2cccc(OC)c2)cc1C	ZINC000450534518	EC	On-Demand	Anodyne	MTNR1A	30	44
CNC(=O)Cn1nc(NC(=O)CCOc2cccc(OC)c2)cc1C	ZINC000450534518	EC	On-Demand	Anodyne	FPR2	24	44
CCCc1csc(NC(=O)c2c(C)cccc2Cl)n1	ZINC000450534524	CI	On-Demand	Anodyne	PDE5A	0	47
CCOCc1nc(C)c(C(=O)NCc2cn(C)nc2-c2ccccc2)s1	ZINC000450534534	FG	On-Demand	Anodyne	SCD1	42	40
CCOCc1nc(C)c(C(=O)NCc2cn(C)nc2-c2ccccc2)s1	ZINC000450534534	FG	On-Demand	Anodyne	SCD	36	40
Cc1ccc2[nH]c(C(=O)N3C[C@H](c4ccccc4)[C@@H](C(=O)O)C3)c(C)c2c1	ZINC000450534538	FH	On-Demand	Anodyne	KIF11	0	41
Cc1ccc2[nH]c(C(=O)N3C[C@@H](C(=O)O)[C@@H](c4ccccc4)C3)c(C)c2c1	ZINC000450534539	FH	On-Demand	Anodyne	KIF11	0	41
Cc1ccc2[nH]c(C(=O)N3C[C@H](C(=O)O)[C@H](c4ccccc4)C3)c(C)c2c1	ZINC000450534540	FH	On-Demand	Anodyne	KIF11	0	41
C[C@@H]1C[C@@]1(C#N)C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450534554	EF	On-Demand	Mild	TACR3	46	35
C[C@@H]1C[C@@]1(C#N)C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450534554	EF	On-Demand	Mild	FFAR2	40	32
C[C@H]1C[C@@]1(C#N)C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450534555	EF	On-Demand	Mild	TACR3	46	35
C[C@H]1C[C@@]1(C#N)C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450534555	EF	On-Demand	Mild	FFAR2	40	32
C[C@@H]1C[C@]1(C#N)C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450534556	EF	On-Demand	Mild	TACR3	46	35
C[C@@H]1C[C@]1(C#N)C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450534556	EF	On-Demand	Mild	FFAR2	40	32
C[C@H]1C[C@]1(C#N)C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450534557	EF	On-Demand	Mild	TACR3	46	35
C[C@H]1C[C@]1(C#N)C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450534557	EF	On-Demand	Mild	FFAR2	40	32
CC(C)[C@@H](CO)CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450534589	DF	On-Demand	Bother	MAOB	23	52
CC(C)[C@H](CO)CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450534590	DF	On-Demand	Bother	MAOB	23	52
COc1cc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)ccc1Cl	ZINC000450534592	FE	On-Demand	Anodyne	OPRK1	22	42
COc1cc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)ccc1Cl	ZINC000450534592	FE	On-Demand	Anodyne	CPT1A	32	42
COc1cc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)ccc1Cl	ZINC000450534593	FE	On-Demand	Anodyne	OPRK1	22	42
COc1cc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)ccc1Cl	ZINC000450534593	FE	On-Demand	Anodyne	CPT1A	32	42
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C#N)C[C@H]3C)CC2)c1	ZINC000450534608	CE	On-Demand	Mild	HCRTR1	22	44
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C#N)C[C@H]3C)CC2)c1	ZINC000450534608	CE	On-Demand	Mild	HCRTR2	23	44
Cc1ccnc(OC2CCN(C(=O)[C@]3(C#N)C[C@H]3C)CC2)c1	ZINC000450534609	CE	On-Demand	Mild	HCRTR1	22	44
Cc1ccnc(OC2CCN(C(=O)[C@]3(C#N)C[C@H]3C)CC2)c1	ZINC000450534609	CE	On-Demand	Mild	HCRTR2	23	44
Cc1ccnc(OC2CCN(C(=O)[C@]3(C#N)C[C@@H]3C)CC2)c1	ZINC000450534610	CE	On-Demand	Mild	HCRTR1	22	44
Cc1ccnc(OC2CCN(C(=O)[C@]3(C#N)C[C@@H]3C)CC2)c1	ZINC000450534610	CE	On-Demand	Mild	HCRTR2	23	44
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C#N)C[C@@H]3C)CC2)c1	ZINC000450534611	CE	On-Demand	Mild	HCRTR1	22	44
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C#N)C[C@@H]3C)CC2)c1	ZINC000450534611	CE	On-Demand	Mild	HCRTR2	23	44
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450534621	GJ	On-Demand	Anodyne	CACNA1B	42	42
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450534621	GJ	On-Demand	Anodyne	CCR2	29	43
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450534621	GJ	On-Demand	Anodyne	LIPG	41	38
Cc1nc(NCC2(c3ccccn3)CCC2)ncc1[N+](=O)[O-]	ZINC000450534623	CF	On-Demand	Bother	PRKCQ	45	38
CCC(=O)C1(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CC1	ZINC000450534634	EI	On-Demand	Mild	MCHR1	26	41
CCC(=O)C1(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CC1	ZINC000450534635	EI	On-Demand	Mild	MCHR1	26	41
O=[N+]([O-])c1ccc(-c2csc(N[C@H]3C[C@@H]3C(F)F)n2)cc1	ZINC000450534650	DG	On-Demand	Bother	MAOB	23	52
CCN(CC)C(=O)CCC1CCN(C(=O)c2cccc(C(F)(F)F)n2)CC1	ZINC000450534655	GH	On-Demand	Anodyne	SFRP1	60	36
CCCc1csc(NC(=O)c2ccc(C)nc2C(C)C)n1	ZINC000450534671	DI	On-Demand	Anodyne	GCK	17	40
COc1cc(CNC(=O)[C@@H]2CC[C@H](C(=O)O)O2)ccc1OC1CCCC1	ZINC000450534676	FE	On-Demand	Anodyne	PDE4A	46	43
COc1cc(CNC(=O)[C@@H]2CC[C@H](C(=O)O)O2)ccc1OC1CCCC1	ZINC000450534676	FE	On-Demand	Anodyne	PDE4B	24	43
COc1cc(CNC(=O)[C@@H]2CC[C@H](C(=O)O)O2)ccc1OC1CCCC1	ZINC000450534676	FE	On-Demand	Anodyne	PDE4D	26	43
COc1cc(CNC(=O)[C@@H]2CC[C@H](C(=O)O)O2)ccc1OC1CCCC1	ZINC000450534676	FE	On-Demand	Anodyne	PDE4C	17	43
Cc1ccnc(OC2CCN(C(=O)c3cn(CC(C)C)nc3C(F)F)CC2)c1	ZINC000450534677	GH	On-Demand	Anodyne	HCRTR1	0	40
Cc1ccnc(OC2CCN(C(=O)c3cn(CC(C)C)nc3C(F)F)CC2)c1	ZINC000450534677	GH	On-Demand	Anodyne	HCRTR2	17	40
Cc1ccnc(OC2CCN(C(=O)c3cc(-c4ccccc4)nn3C)CC2)c1	ZINC000450534679	GG	On-Demand	Anodyne	HCRTR1	25	44
Cc1ccnc(OC2CCN(C(=O)c3cc(-c4ccccc4)nn3C)CC2)c1	ZINC000450534679	GG	On-Demand	Anodyne	HCRTR2	25	44
COC(=O)Cc1ccc(Nc2ccc(OCCCO)cc2)c([N+](=O)[O-])c1	ZINC000450534681	FF	On-Demand	Bother	AKR1C2	43	42
Cn1cc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)c(-c2ccccc2)n1	ZINC000450534686	FG	On-Demand	Anodyne	EPHX2	17	40
Cn1cc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)c(-c2ccccc2)n1	ZINC000450534686	FG	On-Demand	Anodyne	PDE8B	43	32
Cn1cc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)c(-c2ccccc2)n1	ZINC000450534687	FG	On-Demand	Anodyne	EPHX2	17	40
Cn1cc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)c(-c2ccccc2)n1	ZINC000450534687	FG	On-Demand	Anodyne	PDE8B	43	32
CS(=O)(=O)N1CCCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450534688	GE	On-Demand	Anodyne	EGFR	51	37
CS(=O)(=O)N1CCCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450534689	GE	On-Demand	Anodyne	EGFR	51	37
CC(C)OC(C)(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534690	FJ	On-Demand	Mild	CTSF	53	32
CC(C)OC(C)(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534690	FJ	On-Demand	Mild	GRIA2	15	41
CC(C)OC(C)(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534690	FJ	On-Demand	Mild	CTRB_BOVIN	43	31
CC(C)OC(C)(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534690	FJ	On-Demand	Mild	MCHR1	22	41
CC(C)OC(C)(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534691	FJ	On-Demand	Mild	CTSF	53	32
CC(C)OC(C)(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534691	FJ	On-Demand	Mild	GRIA2	15	41
CC(C)OC(C)(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534691	FJ	On-Demand	Mild	CTRB_BOVIN	43	31
CC(C)OC(C)(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534691	FJ	On-Demand	Mild	MCHR1	22	41
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)n1	ZINC000450534696	GE	On-Demand	Anodyne	ETHR	58	41
CCOC(=O)c1csc(N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)n1	ZINC000450534696	GE	On-Demand	Anodyne	TRPC6	45	32
CS(=O)(=O)N1CCCC[C@@H]1CNc1nccc2c([N+](=O)[O-])cccc12	ZINC000450534697	FE	On-Demand	Bother	PRKCQ	40	34
CS(=O)(=O)N1CCCC[C@H]1CNc1nccc2c([N+](=O)[O-])cccc12	ZINC000450534698	FE	On-Demand	Bother	PRKCQ	40	34
COC(=O)Cc1ccc(NCC2(c3ccccn3)CCC2)c([N+](=O)[O-])c1	ZINC000450534708	FG	On-Demand	Bother	NMBR	65	42
COC(=O)Cc1ccc(NCC2(c3ccccn3)CCC2)c([N+](=O)[O-])c1	ZINC000450534708	FG	On-Demand	Bother	GRPR	41	42
CC(C)[C@H](CO)CNc1ncnc2cc(Br)ccc12	ZINC000450534728	DE	On-Demand	Anodyne	EGFR	64	41
CC(C)[C@@H](CO)CNc1ncnc2cc(Br)ccc12	ZINC000450534729	DE	On-Demand	Anodyne	EGFR	64	41
CCSc1cccnc1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450534730	FH	On-Demand	Anodyne	HCRTR1	0	40
CCSc1cccnc1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450534730	FH	On-Demand	Anodyne	HCRTR2	0	40
COc1cc(CNC(=O)c2cccc(C(=O)O)n2)ccc1OC1CCCC1	ZINC000450534734	FG	On-Demand	Anodyne	PDE4A	48	44
COc1cc(CNC(=O)c2cccc(C(=O)O)n2)ccc1OC1CCCC1	ZINC000450534734	FG	On-Demand	Anodyne	PDE4B	29	44
COc1cc(CNC(=O)c2cccc(C(=O)O)n2)ccc1OC1CCCC1	ZINC000450534734	FG	On-Demand	Anodyne	ROCK2	17	40
Cc1nc(NC[C@@H]2CCCCN2S(C)(=O)=O)ncc1[N+](=O)[O-]	ZINC000450534750	EC	On-Demand	Bother	PRKCQ	50	39
Cc1nc(NC[C@H]2CCCCN2S(C)(=O)=O)ncc1[N+](=O)[O-]	ZINC000450534751	EC	On-Demand	Bother	PRKCQ	50	39
CC[C@@H]1C[C@H]1C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534761	CF	On-Demand	Anodyne	P2RX7	43	33
Cc1ccc(NC(=O)c2ccc(N3CC(N4CCNC4=O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450534800	GE	On-Demand	Bother	TAAR1	34	46
CCN(Cc1cccc(S(C)(=O)=O)c1)c1ccccc1OC	ZINC000450534819	DG	On-Demand	Anodyne	NR3C1	15	46
Nc1nc(N[C@@H]2CC[C@@H](Nc3ccccn3)CC2)ncc1[N+](=O)[O-]	ZINC000450534831	EE	On-Demand	Bother	PRKCQ	48	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450534837	GG	On-Demand	Anodyne	BTK	48	47
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450534837	GG	On-Demand	Anodyne	LRRK2	35	49
CC[C@@H](CC(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534847	DH	On-Demand	Anodyne	CAPN2	72	34
CC[C@@H](CC(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534847	DH	On-Demand	Anodyne	NPR	52	33
CC[C@@H](CC(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534847	DH	On-Demand	Anodyne	CARM1	18	41
CC[C@H](CC(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534848	DH	On-Demand	Anodyne	CAPN2	72	34
CC[C@H](CC(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534848	DH	On-Demand	Anodyne	NPR	52	33
CC[C@H](CC(C)C)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450534848	DH	On-Demand	Anodyne	CARM1	18	41
COc1cccc(N(Cc2ccn(CC(F)(F)F)n2)CC(C)C)c1	ZINC000450534852	EI	On-Demand	Anodyne	CETP	0	41
C[C@@H]1CN(C(=O)c2ccc3cnccc3c2)[C@H]2CCCC[C@@H]12	ZINC000450534853	CH	On-Demand	Anodyne	AKT1	16	40
C[C@@H]1CN(C(=O)c2ccc3cnccc3c2)[C@@H]2CCCC[C@H]12	ZINC000450534854	CH	On-Demand	Anodyne	AKT1	16	40
C[C@@H]1CN(C(=O)c2ccc3cnccc3c2)[C@@H]2CCCC[C@@H]12	ZINC000450534855	CH	On-Demand	Anodyne	AKT1	16	40
C[C@@H]1CN(C(=O)c2ccc3cnccc3c2)[C@H]2CCCC[C@H]12	ZINC000450534856	CH	On-Demand	Anodyne	AKT1	16	40
Cn1cc(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)c(-c2ccccc2)n1	ZINC000450534857	DF	On-Demand	Anodyne	P2RX7	61	38
C[C@@H](NC(=O)[C@@H]1CC1(F)F)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534858	EI	On-Demand	Mild	MCHR1	29	40
C[C@H](NC(=O)[C@@H]1CC1(F)F)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534859	EI	On-Demand	Mild	MCHR1	29	40
C[C@@H](NC(=O)[C@H]1CC1(F)F)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534860	EI	On-Demand	Mild	MCHR1	29	40
C[C@H](NC(=O)[C@H]1CC1(F)F)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534861	EI	On-Demand	Mild	MCHR1	29	40
CCOC(=O)c1csc(NC[C@@](C)(CO)c2ccccc2)n1	ZINC000450534870	DE	On-Demand	Anodyne	DHODH	20	40
CCOC(=O)c1csc(NC[C@](C)(CO)c2ccccc2)n1	ZINC000450534871	DE	On-Demand	Anodyne	DHODH	20	40
COc1cc(CNC(=O)[C@@H]2CC[C@@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534878	EF	On-Demand	Anodyne	PDE4A	44	43
COc1cc(CNC(=O)[C@@H]2CC[C@@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534878	EF	On-Demand	Anodyne	PDE4B	28	45
COc1cc(CNC(=O)[C@@H]2CC[C@@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534878	EF	On-Demand	Anodyne	SCN9A	0	44
COc1cc(CNC(=O)[C@H]2CC[C@@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534879	EF	On-Demand	Anodyne	PDE4A	44	43
COc1cc(CNC(=O)[C@H]2CC[C@@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534879	EF	On-Demand	Anodyne	PDE4B	28	45
COc1cc(CNC(=O)[C@H]2CC[C@@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534879	EF	On-Demand	Anodyne	SCN9A	0	44
COc1cc(CNC(=O)[C@@H]2CC[C@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534880	EF	On-Demand	Anodyne	PDE4A	44	43
COc1cc(CNC(=O)[C@@H]2CC[C@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534880	EF	On-Demand	Anodyne	PDE4B	28	45
COc1cc(CNC(=O)[C@@H]2CC[C@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534880	EF	On-Demand	Anodyne	SCN9A	0	44
COc1cc(CNC(=O)[C@H]2CC[C@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534881	EF	On-Demand	Anodyne	PDE4A	44	43
COc1cc(CNC(=O)[C@H]2CC[C@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534881	EF	On-Demand	Anodyne	PDE4B	28	45
COc1cc(CNC(=O)[C@H]2CC[C@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450534881	EF	On-Demand	Anodyne	SCN9A	0	44
CSc1cccc(C(=O)N2CCC(Oc3cc(C)ccn3)CC2)c1	ZINC000450534886	EH	On-Demand	Anodyne	HCRTR1	0	42
CSc1cccc(C(=O)N2CCC(Oc3cc(C)ccn3)CC2)c1	ZINC000450534886	EH	On-Demand	Anodyne	CCR3	0	41
CSc1cccc(C(=O)N2CCC(Oc3cc(C)ccn3)CC2)c1	ZINC000450534886	EH	On-Demand	Anodyne	HCRTR2	22	42
COc1cccc(N(Cc2cccc(S(C)(=O)=O)c2)CC(C)C)c1	ZINC000450534887	EH	On-Demand	Anodyne	CETP	0	48
COc1cccc(N(Cc2cccc(S(C)(=O)=O)c2)CC(C)C)c1	ZINC000450534887	EH	On-Demand	Anodyne	RORC	18	41
COc1cccc(N(Cc2cccc(S(C)(=O)=O)c2)CC(C)C)c1	ZINC000450534887	EH	On-Demand	Anodyne	RORB	0	41
COc1cccc(C(F)(F)CNc2ncc([N+](=O)[O-])c(C)n2)n1	ZINC000450534896	EE	On-Demand	Bother	PRKCQ	45	36
FC(F)(F)[C@@H](CNc1nccc(-c2cnccn2)n1)N1CCOCC1	ZINC000450534897	FD	On-Demand	Anodyne	MAPK1	51	35
FC(F)(F)[C@@H](CNc1nccc(-c2cnccn2)n1)N1CCOCC1	ZINC000450534897	FD	On-Demand	Anodyne	SMG1	44	38
FC(F)(F)[C@H](CNc1nccc(-c2cnccn2)n1)N1CCOCC1	ZINC000450534898	FD	On-Demand	Anodyne	MAPK1	51	35
FC(F)(F)[C@H](CNc1nccc(-c2cnccn2)n1)N1CCOCC1	ZINC000450534898	FD	On-Demand	Anodyne	SMG1	44	38
C[C@@H](CN(C)C)Nc1ncnc2cc(Br)ccc12	ZINC000450534906	DF	On-Demand	Anodyne	EGFR	47	40
C[C@@H](CN(C)C)Nc1ncnc2cc(Br)ccc12	ZINC000450534906	DF	On-Demand	Anodyne	HTT	0	46
O=[N+]([O-])c1cccc2c(NC[C@H]3CCCS(=O)(=O)C3)nccc12	ZINC000450534918	EE	On-Demand	Bother	PRKCQ	46	37
O=[N+]([O-])c1cccc2c(NC[C@@H]3CCCS(=O)(=O)C3)nccc12	ZINC000450534919	EE	On-Demand	Bother	PRKCQ	46	37
O=C(CSC1CC1)Nc1ncc(C2CCCCC2)s1	ZINC000450534920	CI	On-Demand	Anodyne	CDK5	73	62
CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450534924	EG	On-Demand	Bother	PRKCQ	48	39
CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450534925	EG	On-Demand	Bother	PRKCQ	48	39
CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450534926	EG	On-Demand	Bother	PRKCQ	48	39
CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450534927	EG	On-Demand	Bother	PRKCQ	48	39
Cc1ccc(F)c(CC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1	ZINC000450534929	FG	On-Demand	Anodyne	LRRK2	18	44
COc1ccc(-c2ccnc(NC[C@@H](CO)C(C)C)n2)cc1	ZINC000450534939	DF	On-Demand	Anodyne	CLK4	25	55
COc1ccc(-c2ccnc(NC[C@H](CO)C(C)C)n2)cc1	ZINC000450534940	DF	On-Demand	Anodyne	CLK4	25	55
CO[C@@H]1COCC[C@@H]1CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534945	GH	On-Demand	Mild	ACACA	40	36
CO[C@@H]1COCC[C@@H]1CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534945	GH	On-Demand	Mild	MCHR1	28	41
CO[C@@H]1COCC[C@@H]1CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534946	GH	On-Demand	Mild	ACACA	40	36
CO[C@@H]1COCC[C@@H]1CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534946	GH	On-Demand	Mild	MCHR1	28	41
CO[C@@H]1COCC[C@H]1CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534947	GH	On-Demand	Mild	ACACA	40	36
CO[C@@H]1COCC[C@H]1CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534947	GH	On-Demand	Mild	MCHR1	28	41
CO[C@@H]1COCC[C@H]1CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534948	GH	On-Demand	Mild	ACACA	40	36
CO[C@@H]1COCC[C@H]1CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450534948	GH	On-Demand	Mild	MCHR1	28	41
CCN(CC)C(=O)CCC1CCN(C(=O)CCc2ccc(C(N)=O)cc2)CC1	ZINC000450534950	GF	On-Demand	Anodyne	CCR8	34	40
COc1cc(CNC(=O)c2ccc(C(=O)O)o2)ccc1OC1CCCC1	ZINC000450534954	FG	On-Demand	Anodyne	PDE4A	45	47
COc1cc(CNC(=O)c2ccc(C(=O)O)o2)ccc1OC1CCCC1	ZINC000450534954	FG	On-Demand	Anodyne	MMP13	0	40
COc1cc(CNC(=O)c2ccc(C(=O)O)o2)ccc1OC1CCCC1	ZINC000450534954	FG	On-Demand	Anodyne	PDE4B	29	47
COc1cc(CNC(=O)c2ccc(C(=O)O)o2)ccc1OC1CCCC1	ZINC000450534954	FG	On-Demand	Anodyne	PDE4D	32	40
COc1cc(CNC(=O)c2ccc(C(=O)O)o2)ccc1OC1CCCC1	ZINC000450534954	FG	On-Demand	Anodyne	MT-ND1	24	43
COc1cc(CNC(=O)c2ccc(C(=O)O)o2)ccc1OC1CCCC1	ZINC000450534954	FG	On-Demand	Anodyne	PDEC	0	40
F[C@@H]1CC[C@@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450534963	DH	On-Demand	Anodyne	EGFR	50	39
F[C@@H]1CC[C@@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450534963	DH	On-Demand	Anodyne	CD38	43	42
F[C@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450534964	DH	On-Demand	Anodyne	EGFR	50	39
F[C@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450534964	DH	On-Demand	Anodyne	CD38	43	42
F[C@H]1CC[C@@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450534965	DH	On-Demand	Anodyne	EGFR	50	39
F[C@H]1CC[C@@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450534965	DH	On-Demand	Anodyne	CD38	43	42
F[C@@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450534966	DH	On-Demand	Anodyne	CD38	36	42
Cc1ccnc(OC2CCN(C(=O)c3cc(C#N)[nH]c3C)CC2)c1	ZINC000450534978	DF	On-Demand	Mild	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)c3cc(C#N)[nH]c3C)CC2)c1	ZINC000450534978	DF	On-Demand	Mild	FASN	40	35
Cc1ccnc(OC2CCN(C(=O)c3cc(C#N)[nH]c3C)CC2)c1	ZINC000450534978	DF	On-Demand	Mild	HCRTR2	0	41
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534979	DE	On-Demand	Anodyne	CNR1	21	41
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534979	DE	On-Demand	Anodyne	CNR2	25	45
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534979	DE	On-Demand	Anodyne	LRRK2	19	46
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450534979	DE	On-Demand	Anodyne	L3MBTL3	48	33
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450534988	EG	On-Demand	Anodyne	CNR2	0	43
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450534988	EG	On-Demand	Anodyne	HRH3	22	40
COc1ccccc1O[C@H]1CCCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450534990	EH	On-Demand	Anodyne	PDE3A	27	40
COc1ccccc1O[C@H]1CCCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450534990	EH	On-Demand	Anodyne	PDE3B	43	33
COc1ccccc1O[C@H]1CCCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450534990	EH	On-Demand	Anodyne	SCD1	22	41
COc1ccccc1O[C@@H]1CCCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450534991	EH	On-Demand	Anodyne	PDE3A	27	40
COc1ccccc1O[C@@H]1CCCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450534991	EH	On-Demand	Anodyne	PDE3B	43	33
COc1ccccc1O[C@@H]1CCCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450534991	EH	On-Demand	Anodyne	SCD1	22	41
C=CCOc1ccc(CC(=O)N2CCC(Oc3cc(C)ccn3)CC2)cc1	ZINC000450535009	FH	On-Demand	Mild	MLNR	23	41
Cc1noc([C@H]2COCCN2C(=O)CCCC(=O)C(C)(C)C)n1	ZINC000450535010	DE	On-Demand	Anodyne	COLA	22	41
Cc1noc([C@H]2COCCN2C(=O)CCCC(=O)C(C)(C)C)n1	ZINC000450535010	DE	On-Demand	Anodyne	CPT1A	15	41
Cc1noc([C@@H]2COCCN2C(=O)CCCC(=O)C(C)(C)C)n1	ZINC000450535011	DE	On-Demand	Anodyne	COLA	22	41
Cc1noc([C@@H]2COCCN2C(=O)CCCC(=O)C(C)(C)C)n1	ZINC000450535011	DE	On-Demand	Anodyne	CPT1A	15	41
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450535014	GF	On-Demand	Anodyne	LRRK2	16	43
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450535015	GF	On-Demand	Anodyne	LRRK2	16	43
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc3c2OCO3)cn1	ZINC000450535043	EG	On-Demand	Anodyne	G2YM83_BOTF4	62	36
CCOC(=O)c1cc(C(=O)N2CCC(Oc3cc(C)ccn3)CC2)on1	ZINC000450535049	FE	On-Demand	Anodyne	HCRTR1	19	42
CCOC(=O)c1cc(C(=O)N2CCC(Oc3cc(C)ccn3)CC2)on1	ZINC000450535049	FE	On-Demand	Anodyne	HCRTR2	20	42
O=[N+]([O-])c1cccc2c(NCC3(c4ccccn4)CCC3)nccc12	ZINC000450535055	EI	On-Demand	Bother	NMBR	28	40
O=[N+]([O-])c1cccc2c(NCC3(c4ccccn4)CCC3)nccc12	ZINC000450535055	EI	On-Demand	Bother	GRPR	24	40
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[C@@H](Nc2ccccn2)CC1	ZINC000450535063	GG	On-Demand	Bother	TBXA2R	21	46
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450535075	FH	On-Demand	Anodyne	L3MBTL3	59	36
COc1cccc2c(N3CC[C@H](C(=O)N4CCCC4)C3)nccc12	ZINC000450535078	EF	On-Demand	Anodyne	SSTR2	47	38
COc1cccc2c(N3CC[C@H](C(=O)N4CCCC4)C3)nccc12	ZINC000450535078	EF	On-Demand	Anodyne	PDE3A	47	37
COc1cccc2c(N3CC[C@H](C(=O)N4CCCC4)C3)nccc12	ZINC000450535078	EF	On-Demand	Anodyne	SSTR1	52	37
COc1cccc2c(N3CC[C@H](C(=O)N4CCCC4)C3)nccc12	ZINC000450535078	EF	On-Demand	Anodyne	PDE3B	71	37
COc1cccc2c(N3CC[C@@H](C(=O)N4CCCC4)C3)nccc12	ZINC000450535079	EF	On-Demand	Anodyne	SSTR2	47	38
COc1cccc2c(N3CC[C@@H](C(=O)N4CCCC4)C3)nccc12	ZINC000450535079	EF	On-Demand	Anodyne	PDE3A	47	37
COc1cccc2c(N3CC[C@@H](C(=O)N4CCCC4)C3)nccc12	ZINC000450535079	EF	On-Demand	Anodyne	SSTR1	52	37
COc1cccc2c(N3CC[C@@H](C(=O)N4CCCC4)C3)nccc12	ZINC000450535079	EF	On-Demand	Anodyne	PDE3B	71	37
Cc1ccnc(OC2CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC2)c1	ZINC000450535080	GG	On-Demand	Anodyne	GHRHR	56	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@@H]1c1nc(C)no1	ZINC000450535093	ED	On-Demand	Anodyne	COLA	42	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@@H]1c1nc(C)no1	ZINC000450535093	ED	On-Demand	Anodyne	CPT1A	31	43
CO[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@H]1c1nc(C)no1	ZINC000450535094	ED	On-Demand	Anodyne	COLA	42	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@H]1c1nc(C)no1	ZINC000450535094	ED	On-Demand	Anodyne	CPT1A	31	43
CO[C@H](Cc1ccccc1)C(=O)N1CCOC[C@@H]1c1nc(C)no1	ZINC000450535095	ED	On-Demand	Anodyne	COLA	42	46
CO[C@H](Cc1ccccc1)C(=O)N1CCOC[C@@H]1c1nc(C)no1	ZINC000450535095	ED	On-Demand	Anodyne	CPT1A	31	43
CO[C@H](Cc1ccccc1)C(=O)N1CCOC[C@H]1c1nc(C)no1	ZINC000450535096	ED	On-Demand	Anodyne	COLA	42	46
CO[C@H](Cc1ccccc1)C(=O)N1CCOC[C@H]1c1nc(C)no1	ZINC000450535096	ED	On-Demand	Anodyne	CPT1A	31	43
CC[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H](C)S1(=O)=O	ZINC000450535100	GF	On-Demand	Anodyne	PDE3B	53	34
CC[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H](C)S1(=O)=O	ZINC000450535101	GF	On-Demand	Anodyne	PDE3B	53	34
CC[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)S1(=O)=O	ZINC000450535102	GF	On-Demand	Anodyne	PDE3B	53	34
CC[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)S1(=O)=O	ZINC000450535103	GF	On-Demand	Anodyne	PDE3B	53	34
Cc1ccnc(OC2CCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2)c1	ZINC000450535120	FH	On-Demand	Anodyne	HCRTR1	24	45
Cc1ccnc(OC2CCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2)c1	ZINC000450535120	FH	On-Demand	Anodyne	HCRTR2	25	45
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450535126	GF	On-Demand	Anodyne	TRPV1	0	42
Cc1noc([C@H]2COCCN2C(=O)CCCC(C)C)n1	ZINC000450535147	CE	On-Demand	Anodyne	COLA	27	41
Cc1noc([C@@H]2COCCN2C(=O)CCCC(C)C)n1	ZINC000450535148	CE	On-Demand	Anodyne	COLA	27	41
Cc1ccnc(OC2CCN(C(=O)C(C)(C)C(C)(F)F)CC2)c1	ZINC000450535215	EG	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)C(C)(C)C(C)(F)F)CC2)c1	ZINC000450535215	EG	On-Demand	Anodyne	HCRTR2	0	43
C[C@@H]1CN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)[C@@H]2CCCC[C@H]12	ZINC000450535223	EG	On-Demand	Anodyne	PDEC	0	40
C[C@@H]1CN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)[C@@H]2CCCC[C@@H]12	ZINC000450535224	EG	On-Demand	Anodyne	PDEC	0	40
C[C@@H]1CN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)[C@H]2CCCC[C@H]12	ZINC000450535225	EG	On-Demand	Anodyne	PDEC	0	40
C[C@@H]1CN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)[C@H]2CCCC[C@@H]12	ZINC000450535226	EG	On-Demand	Anodyne	PDEC	0	40
Cc1cc(N2CC(N3CCNC3=O)C2)nc(C(C)C)n1	ZINC000450535227	CD	On-Demand	Anodyne	SORD	48	33
COc1cc(CNC(=O)[C@@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535233	GH	On-Demand	Anodyne	PDE4A	47	44
COc1cc(CNC(=O)[C@@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535233	GH	On-Demand	Anodyne	PDE4B	27	44
COc1cc(CNC(=O)[C@@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535233	GH	On-Demand	Anodyne	PDE4D	29	44
COc1cc(CNC(=O)[C@@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535233	GH	On-Demand	Anodyne	PDE4C	17	44
COc1cc(CNC(=O)[C@@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535233	GH	On-Demand	Anodyne	STK17B	40	36
COc1cc(CNC(=O)[C@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535234	GH	On-Demand	Anodyne	PDE4A	47	44
COc1cc(CNC(=O)[C@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535234	GH	On-Demand	Anodyne	PDE4B	27	44
COc1cc(CNC(=O)[C@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535234	GH	On-Demand	Anodyne	PDE4D	29	44
COc1cc(CNC(=O)[C@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535234	GH	On-Demand	Anodyne	PDE4C	17	44
COc1cc(CNC(=O)[C@H]2CCC[C@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535234	GH	On-Demand	Anodyne	STK17B	40	36
COc1cc(CNC(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535235	GH	On-Demand	Anodyne	PDE4A	47	44
COc1cc(CNC(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535235	GH	On-Demand	Anodyne	PDE4B	27	44
COc1cc(CNC(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535235	GH	On-Demand	Anodyne	PDE4D	29	44
COc1cc(CNC(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535235	GH	On-Demand	Anodyne	PDE4C	17	44
COc1cc(CNC(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535235	GH	On-Demand	Anodyne	STK17B	40	36
COc1cc(CNC(=O)[C@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535236	GH	On-Demand	Anodyne	PDE4A	47	44
COc1cc(CNC(=O)[C@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535236	GH	On-Demand	Anodyne	PDE4B	27	44
COc1cc(CNC(=O)[C@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535236	GH	On-Demand	Anodyne	PDE4D	29	44
COc1cc(CNC(=O)[C@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535236	GH	On-Demand	Anodyne	PDE4C	17	44
COc1cc(CNC(=O)[C@H]2CCC[C@@H](C(=O)O)C2)ccc1OC1CCCC1	ZINC000450535236	GH	On-Demand	Anodyne	STK17B	40	36
Cc1ccnc(OC2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CC2)c1	ZINC000450535245	FI	On-Demand	Anodyne	HCRTR1	0	40
Cc1ccnc(OC2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CC2)c1	ZINC000450535245	FI	On-Demand	Anodyne	HCRTR2	15	40
CSc1cccc(C(=O)N2CCOC[C@@H]2c2nc(C)no2)c1	ZINC000450535254	DE	On-Demand	Anodyne	COLA	18	40
CSc1cccc(C(=O)N2CCOC[C@@H]2c2nc(C)no2)c1	ZINC000450535254	DE	On-Demand	Anodyne	GRM5	18	43
CSc1cccc(C(=O)N2CCOC[C@H]2c2nc(C)no2)c1	ZINC000450535255	DE	On-Demand	Anodyne	COLA	18	40
CSc1cccc(C(=O)N2CCOC[C@H]2c2nc(C)no2)c1	ZINC000450535255	DE	On-Demand	Anodyne	GRM5	18	43
CCOC(=O)c1cc(C(=O)N2CCC(CCC(=O)N(CC)CC)CC2)[nH]c1C	ZINC000450535270	GG	On-Demand	Anodyne	AKR1C3	18	42
NC(=O)CCC1CCN(C(=O)Cc2scnc2-c2ccccc2)CC1	ZINC000450535276	FF	On-Demand	Anodyne	ETHR	42	36
C[C@H]1CC[C@@H](C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)O1	ZINC000450535290	EH	On-Demand	Mild	MCHR1	31	44
C[C@H]1CC[C@@H](C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)O1	ZINC000450535291	EH	On-Demand	Mild	MCHR1	31	44
COc1ccc(-c2ccnc(N[C@@H]3CCCN(S(=O)(=O)N(C)C)C3)n2)cc1	ZINC000450535294	GD	On-Demand	Anodyne	IKBKB	25	51
COc1ccc(-c2ccnc(N[C@@H]3CCCN(S(=O)(=O)N(C)C)C3)n2)cc1	ZINC000450535294	GD	On-Demand	Anodyne	MAPK1	44	37
COc1ccc(-c2ccnc(N[C@@H]3CCCN(S(=O)(=O)N(C)C)C3)n2)cc1	ZINC000450535294	GD	On-Demand	Anodyne	MAPK10	0	40
COc1ccc(-c2ccnc(N[C@@H]3CCCN(S(=O)(=O)N(C)C)C3)n2)cc1	ZINC000450535294	GD	On-Demand	Anodyne	MAPK8	0	44
CS(=O)(=O)N1CCCC[C@H]1CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450535301	GE	On-Demand	Bother	MAOB	21	51
CS(=O)(=O)N1CCCC[C@@H]1CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450535302	GE	On-Demand	Bother	MAOB	21	51
COC[C@@]1(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCOC1	ZINC000450535312	FG	On-Demand	Mild	ACACB	27	40
COC[C@@]1(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCOC1	ZINC000450535312	FG	On-Demand	Mild	LGMN	40	35
COC[C@]1(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCOC1	ZINC000450535313	FG	On-Demand	Mild	ACACB	27	40
COC[C@]1(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCOC1	ZINC000450535313	FG	On-Demand	Mild	LGMN	40	35
COC[C@]1(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCOC1	ZINC000450535314	FG	On-Demand	Mild	ACACB	27	40
COC[C@]1(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCOC1	ZINC000450535314	FG	On-Demand	Mild	LGMN	40	35
COC[C@@]1(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCOC1	ZINC000450535315	FG	On-Demand	Mild	ACACB	27	40
COC[C@@]1(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCOC1	ZINC000450535315	FG	On-Demand	Mild	LGMN	40	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(-c2ncn(C)n2)cc1	ZINC000450535320	FF	On-Demand	Anodyne	ANPEP	21	41
COc1cc(CNC(=O)c2cc(C(=O)O)co2)ccc1OC1CCCC1	ZINC000450535331	FG	On-Demand	Anodyne	PDE4A	46	47
COc1cc(CNC(=O)c2cc(C(=O)O)co2)ccc1OC1CCCC1	ZINC000450535331	FG	On-Demand	Anodyne	PDE4B	28	47
COc1cc(CNC(=O)c2cc(C(=O)O)co2)ccc1OC1CCCC1	ZINC000450535331	FG	On-Demand	Anodyne	MT-ND1	25	45
COc1cc(CNC(=O)c2cc(C(=O)O)co2)ccc1OC1CCCC1	ZINC000450535331	FG	On-Demand	Anodyne	PDEC	0	41
CCN(CC)C(=O)CCC1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450535332	GH	On-Demand	Anodyne	P2RY12	130	36
CC(C)c1ncsc1C(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450535333	FI	On-Demand	Anodyne	CENPE	0	40
CC(=O)N[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(C)(C)C	ZINC000450535349	GH	On-Demand	Mild	ACACA	24	43
CC(=O)N[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(C)(C)C	ZINC000450535349	GH	On-Demand	Mild	CTSF	76	36
CC(=O)N[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(C)(C)C	ZINC000450535349	GH	On-Demand	Mild	ACACB	24	42
CC(=O)N[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(C)(C)C	ZINC000450535349	GH	On-Demand	Mild	MCHR1	19	40
CC(=O)N[C@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(C)(C)C	ZINC000450535350	GH	On-Demand	Mild	ACACA	24	43
CC(=O)N[C@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(C)(C)C	ZINC000450535350	GH	On-Demand	Mild	CTSF	76	36
CC(=O)N[C@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(C)(C)C	ZINC000450535350	GH	On-Demand	Mild	ACACB	24	42
CC(=O)N[C@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(C)(C)C	ZINC000450535350	GH	On-Demand	Mild	MCHR1	19	40
O=C(CCCC(=O)C1CC1)Nc1cccc2c1OCO2	ZINC000450535353	CF	On-Demand	Anodyne	HDAC3	17	42
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450535354	FI	On-Demand	Anodyne	GNAI3	0	40
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450535355	FI	On-Demand	Anodyne	GNAI3	0	40
CCC[C@H]1CCC[C@H]1C(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450535356	FI	On-Demand	Anodyne	GNAI3	0	40
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450535357	FI	On-Demand	Anodyne	GNAI3	0	40
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(CC(C)C)CC(C)C	ZINC000450535373	FI	On-Demand	Anodyne	HRH3	0	41
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C(CC(C)C)CC(C)C	ZINC000450535373	FI	On-Demand	Anodyne	LRRK2	18	48
Cc1cnc(CCCC(=O)Nc2ncc(C3CCCCC3)s2)o1	ZINC000450535386	EI	On-Demand	Anodyne	CDK5	62	51
c1ccc(N[C@@H]2CC[C@@H](Nc3ncnc4sccc34)CC2)nc1	ZINC000450535393	EH	On-Demand	Anodyne	CD38	45	41
Cc1ccnc(OC2CCN(C(=O)C(C)(C)C3CCC3)CC2)c1	ZINC000450535408	DH	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)C(C)(C)C3CCC3)CC2)c1	ZINC000450535408	DH	On-Demand	Anodyne	HCRTR2	15	41
NC(=O)N1CCC[C@H](CNc2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450535414	EE	On-Demand	Bother	PRKCQ	48	36
NC(=O)N1CCC[C@@H](CNc2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450535415	EE	On-Demand	Bother	PRKCQ	48	36
CNS(=O)(=O)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450535429	GC	On-Demand	Anodyne	PDGFRB	65	47
CNS(=O)(=O)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450535429	GC	On-Demand	Anodyne	AKT2	15	41
CNS(=O)(=O)N1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450535429	GC	On-Demand	Anodyne	AKT3	17	41
Cc1ccnc(OC2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)c1	ZINC000450535430	GI	On-Demand	Anodyne	HCRTR1	35	41
Cc1ccnc(OC2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)c1	ZINC000450535430	GI	On-Demand	Anodyne	HCRTR2	24	41
Cc1nc(C)c(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])o1	ZINC000450535433	FE	On-Demand	Bother	BDKRB1	22	42
CN(C)S(=O)(=O)N1CCC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450535435	FC	On-Demand	Anodyne	IKBKB	0	45
CN(C)S(=O)(=O)N1CCC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450535435	FC	On-Demand	Anodyne	MAPK9	23	40
CN(C)S(=O)(=O)N1CCC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450535435	FC	On-Demand	Anodyne	MAPK8	26	40
CC(=O)N[C@H](C(=O)Nc1ccc(-c2ncn(C)n2)cc1)C(C)(C)C	ZINC000450535436	ED	On-Demand	Anodyne	AT1	0	41
COc1ccc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)c(Cl)c1OC	ZINC000450535437	GE	On-Demand	Anodyne	COLA	26	40
COc1ccc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)c(Cl)c1OC	ZINC000450535437	GE	On-Demand	Anodyne	CPT1A	23	40
COc1ccc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)c(Cl)c1OC	ZINC000450535438	GE	On-Demand	Anodyne	COLA	26	40
COc1ccc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)c(Cl)c1OC	ZINC000450535438	GE	On-Demand	Anodyne	CPT1A	23	40
CC(=O)c1nc(N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)sc1C	ZINC000450535439	FF	On-Demand	Anodyne	ETHR	56	37
Cc1nc(N[C@H]2CCC[C@H]2Oc2cc(F)cc(F)c2)ncc1[N+](=O)[O-]	ZINC000450535444	FG	On-Demand	Bother	PRKCQ	43	36
CS(=O)(=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CCCC1	ZINC000450535447	FH	On-Demand	Anodyne	HRP1_PLAFA	91	34
CS(=O)(=O)C1(CNc2ccnc3cc(F)c(Cl)cc23)CCCC1	ZINC000450535447	FH	On-Demand	Anodyne	HNMT	45	37
CN(C)c1nc(NCc2ccc(C[S@@](C)=O)cc2)nc2ccccc12	ZINC000450535457	FF	On-Demand	Anodyne	ADRA2A	16	49
CN(C)c1nc(NCc2ccc(C[S@](C)=O)cc2)nc2ccccc12	ZINC000450535458	FF	On-Demand	Anodyne	ADRA2A	16	49
COc1cccc(N(CC[C@@H](C)O)CC(C)C)c1	ZINC000450535462	CF	On-Demand	Anodyne	CETP	0	42
COc1cccc(N(CC[C@H](C)O)CC(C)C)c1	ZINC000450535463	CF	On-Demand	Anodyne	CETP	0	42
Cc1nn(C)cc1CC(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450535464	DD	On-Demand	Anodyne	P2RX7	63	51
C[C@@H](CN(C)C)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450535465	CE	On-Demand	Anodyne	UTS2R	30	50
CCC[C@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450535477	DE	On-Demand	Anodyne	CAPN1	42	34
CCC[C@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450535477	DE	On-Demand	Anodyne	CAPN2	71	40
C=CCC[C@@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450535480	DE	On-Demand	Mild	NPPA	41	32
C=CCC[C@H](NC(=O)C1(Oc2ccccc2F)CC1)C(=O)O	ZINC000450535481	DE	On-Demand	Mild	NPPA	41	32
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450535488	GH	On-Demand	Anodyne	L3MBTL3	49	33
C[C@@H](CN(C)C)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450535493	DF	On-Demand	Bother	MAOB	26	51
Cn1cc(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)c(-c2ccccc2)n1	ZINC000450535494	FI	On-Demand	Anodyne	SCN9A	0	40
Cn1cc(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)c(-c2ccccc2)n1	ZINC000450535495	FI	On-Demand	Anodyne	SCN9A	0	40
Cn1cc(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)c(-c2ccccc2)n1	ZINC000450535496	FI	On-Demand	Anodyne	SCN9A	0	40
Cn1cc(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)c(-c2ccccc2)n1	ZINC000450535497	FI	On-Demand	Anodyne	SCN9A	0	40
CCCOc1ccc(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)c(OC)c1	ZINC000450535509	FH	On-Demand	Anodyne	PRNP	27	48
CCCOc1ccc(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)c(OC)c1	ZINC000450535509	FH	On-Demand	Anodyne	LUCI_LUCLA	16	42
CCCOc1ccc(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)c(OC)c1	ZINC000450535509	FH	On-Demand	Anodyne	AGER	0	40
CCCOc1ccc(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)c(OC)c1	ZINC000450535509	FH	On-Demand	Anodyne	KCNK3	44	38
CCC(CC)(NC(=O)C1CN(c2nc(-c3ccc(OC)cc3)no2)C1)C(N)=O	ZINC000450535519	GD	On-Demand	Anodyne	S1PR4	19	42
CCC(CC)(NC(=O)C1CN(c2nc(-c3ccc(OC)cc3)no2)C1)C(N)=O	ZINC000450535519	GD	On-Demand	Anodyne	S1PR1	19	42
CCN(CC)C(=O)CCC1CCN(C(=O)c2cc3cccnc3s2)CC1	ZINC000450535521	FH	On-Demand	Anodyne	SIRT3	51	32
CCN(CC)C(=O)CCC1CCN(C(=O)c2cc3cccnc3s2)CC1	ZINC000450535521	FH	On-Demand	Anodyne	SIRT2	44	32
CCN(CC)C(=O)CCC1CCN(C(=O)c2cc3cccnc3s2)CC1	ZINC000450535521	FH	On-Demand	Anodyne	SIRT1	51	32
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC(C1CCC1)C1CCC1	ZINC000450535528	EG	On-Demand	Bother	TBXA2R	21	40
C[C@H](NC(=O)CC1(O)CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535534	EH	On-Demand	Mild	CTSF	72	35
C[C@H](NC(=O)CC1(O)CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535534	EH	On-Demand	Mild	CTSK	42	37
C[C@H](NC(=O)CC1(O)CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535534	EH	On-Demand	Mild	MCHR1	37	43
C[C@@H](NC(=O)CC1(O)CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535535	EH	On-Demand	Mild	CTSF	72	35
C[C@@H](NC(=O)CC1(O)CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535535	EH	On-Demand	Mild	CTSK	42	37
C[C@@H](NC(=O)CC1(O)CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535535	EH	On-Demand	Mild	MCHR1	37	43
NC(=O)N1CCC[C@@H](CNc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450535541	EG	On-Demand	Anodyne	HRP1_PLAFA	88	34
NC(=O)N1CCC[C@@H](CNc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450535541	EG	On-Demand	Anodyne	HNMT	57	37
NC(=O)N1CCC[C@H](CNc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450535542	EG	On-Demand	Anodyne	HRP1_PLAFA	88	34
NC(=O)N1CCC[C@H](CNc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450535542	EG	On-Demand	Anodyne	HNMT	57	37
O=C(Nc1cccc(CN2CCOCC2)n1)[C@@H](O)C1CCC1	ZINC000450535559	DD	On-Demand	Anodyne	CASR	49	38
O=C(Nc1cccc(CN2CCOCC2)n1)[C@H](O)C1CCC1	ZINC000450535560	DD	On-Demand	Anodyne	CASR	49	38
CCN(CC)C(=O)CCC1CCN(C(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450535562	FG	On-Demand	Anodyne	EPHB3	24	40
O=[N+]([O-])c1ccc(-c2csc(NC[C@H]3CCCS(=O)(=O)C3)n2)cc1	ZINC000450535567	FE	On-Demand	Bother	MAOB	21	50
O=[N+]([O-])c1ccc(-c2csc(NC[C@@H]3CCCS(=O)(=O)C3)n2)cc1	ZINC000450535568	FE	On-Demand	Bother	MAOB	21	50
Cc1cccc(Cl)c1C(=O)N(C)CCNC(=O)C(C)C	ZINC000450535587	CE	On-Demand	Anodyne	CXCL8	42	35
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(=O)C(C)(C)C)CC1	ZINC000450535592	FH	On-Demand	Anodyne	GNAI1	0	48
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(=O)C(C)(C)C)CC1	ZINC000450535592	FH	On-Demand	Anodyne	GNAI3	0	50
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(=O)C(C)(C)C)CC1	ZINC000450535592	FH	On-Demand	Anodyne	GNAO1	0	48
CCc1c(C(=O)N2CCC(CCC(=O)N(CC)CC)CC2)oc2ccccc12	ZINC000450535595	GI	On-Demand	Anodyne	CCR8	41	32
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450535622	FE	On-Demand	Anodyne	LRRK2	21	44
C[C@H](OCCc1ccccc1)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450535623	FG	On-Demand	Anodyne	AMP1_PLAFQ	42	35
C[C@H](OCCc1ccccc1)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450535623	FG	On-Demand	Anodyne	CARM1	26	43
C[C@@H](OCCc1ccccc1)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450535624	FG	On-Demand	Anodyne	AMP1_PLAFQ	42	35
C[C@@H](OCCc1ccccc1)C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450535624	FG	On-Demand	Anodyne	CARM1	26	43
Cc1noc([C@@H]2COCCN2C(=O)Cc2cc(Br)ccc2C)n1	ZINC000450535630	GF	On-Demand	Anodyne	COLA	29	43
Cc1noc([C@@H]2COCCN2C(=O)Cc2cc(Br)ccc2C)n1	ZINC000450535630	GF	On-Demand	Anodyne	CPT1A	27	43
Cc1noc([C@H]2COCCN2C(=O)Cc2cc(Br)ccc2C)n1	ZINC000450535631	GF	On-Demand	Anodyne	COLA	29	43
Cc1noc([C@H]2COCCN2C(=O)Cc2cc(Br)ccc2C)n1	ZINC000450535631	GF	On-Demand	Anodyne	CPT1A	27	43
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccnc(OC(F)F)c1	ZINC000450535669	GF	On-Demand	Anodyne	MAPK14	17	40
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccnc(OC(F)F)c1	ZINC000450535669	GF	On-Demand	Anodyne	BTK	42	38
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccnc(OC(F)F)c1	ZINC000450535669	GF	On-Demand	Anodyne	LRRK2	29	46
O=C(Cc1ccc(Cl)c(F)c1)N[C@H]1CCC[C@H]1C(=O)O	ZINC000450535670	CE	On-Demand	Anodyne	SSTR3	0	42
O=C(Cc1ccc(Cl)c(F)c1)N[C@H]1CCC[C@H]1C(=O)O	ZINC000450535670	CE	On-Demand	Anodyne	ENV	44	34
CCOc1nc2ccc(C(=O)N3CCC(Oc4cc(C)ccn4)CC3)cc2[nH]1	ZINC000450535675	GG	On-Demand	Anodyne	GRIN2B	29	41
CCOc1nc2ccc(C(=O)N3CCC(Oc4cc(C)ccn4)CC3)cc2[nH]1	ZINC000450535675	GG	On-Demand	Anodyne	HCRTR1	0	40
CCOc1nc2ccc(C(=O)N3CCC(Oc4cc(C)ccn4)CC3)cc2[nH]1	ZINC000450535675	GG	On-Demand	Anodyne	HCRTR2	16	40
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450535676	FF	On-Demand	Anodyne	LRRK2	16	48
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450535691	GF	On-Demand	Anodyne	BTK	43	40
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450535691	GF	On-Demand	Anodyne	LRRK2	19	45
NC(=O)CCC1CCN(C(=O)Cc2sccc2Br)CC1	ZINC000450535704	FF	On-Demand	Anodyne	ETHR	43	36
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450535749	FF	On-Demand	Anodyne	CNR2	0	40
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450535749	FF	On-Demand	Anodyne	LRRK2	27	42
CC(=O)N[C@H](C(=O)N1CCC(Oc2cc(C)ccn2)CC1)C(C)(C)C	ZINC000450535754	EE	On-Demand	Anodyne	HCRTR1	18	42
CC(=O)N[C@H](C(=O)N1CCC(Oc2cc(C)ccn2)CC1)C(C)(C)C	ZINC000450535754	EE	On-Demand	Anodyne	HCRTR2	18	42
CN(C)c1nc(NCCn2cc(Br)cn2)nc2ccccc12	ZINC000450535762	FE	On-Demand	Anodyne	ADRA2A	16	44
Cc1nc(N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)ncc1[N+](=O)[O-]	ZINC000450535773	FE	On-Demand	Bother	ETHR	54	35
C[C@H](NC(=O)CC1CC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535776	FJ	On-Demand	Mild	CTSF	60	33
C[C@H](NC(=O)CC1CC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535776	FJ	On-Demand	Mild	MCHR1	40	44
C[C@@H](NC(=O)CC1CC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535777	FJ	On-Demand	Mild	CTSF	60	33
C[C@@H](NC(=O)CC1CC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450535777	FJ	On-Demand	Mild	MCHR1	40	44
CN(C)c1nc(N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)nc2ccccc12	ZINC000450535778	GC	On-Demand	Anodyne	ADRA2A	20	49
CN(C)c1nc(N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)nc2ccccc12	ZINC000450535778	GC	On-Demand	Anodyne	NPY2R	15	48
CN(C)c1nc(N[C@@H]2CCCN(S(=O)(=O)N(C)C)C2)nc2ccccc12	ZINC000450535778	GC	On-Demand	Anodyne	MAPK8	16	40
CCc1cccc(C(=O)N2CCC(Oc3cc(C)ccn3)CC2)n1	ZINC000450535781	EG	On-Demand	Anodyne	HCRTR1	22	41
CCc1cccc(C(=O)N2CCC(Oc3cc(C)ccn3)CC2)n1	ZINC000450535781	EG	On-Demand	Anodyne	HCRTR2	22	41
COc1cc(CNC(=O)CC2(C(=O)O)CCC2)ccc1OC1CCCC1	ZINC000450535786	FG	On-Demand	Anodyne	PDE4A	44	41
COc1cc(CNC(=O)CC2(C(=O)O)CCC2)ccc1OC1CCCC1	ZINC000450535786	FG	On-Demand	Anodyne	PDE4B	28	44
COc1cccc(OCCC(=O)Nc2cccc(CN3CCOCC3)n2)c1	ZINC000450535787	FE	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)Nc2cccc(CN3CCOCC3)n2)c1	ZINC000450535787	FE	On-Demand	Anodyne	HRH2	29	41
COc1cccc(OCCC(=O)Nc2cccc(CN3CCOCC3)n2)c1	ZINC000450535787	FE	On-Demand	Anodyne	AVPR1B	32	44
COc1cccc(OCCC(=O)Nc2cccc(CN3CCOCC3)n2)c1	ZINC000450535787	FE	On-Demand	Anodyne	CASR	34	41
COc1cccc(OCCC(=O)Nc2cccc(CN3CCOCC3)n2)c1	ZINC000450535787	FE	On-Demand	Anodyne	MTNR1A	24	40
COc1cccc(OCCC(=O)Nc2cccc(CN3CCOCC3)n2)c1	ZINC000450535787	FE	On-Demand	Anodyne	MTNR1B	27	40
COc1cccc(OCCC(=O)Nc2cccc(CN3CCOCC3)n2)c1	ZINC000450535787	FE	On-Demand	Anodyne	EPHX2	23	44
CCS(=O)(=O)N1CCN(c2nccc3cc(C(F)(F)F)ccc23)[C@H](C)C1	ZINC000450535788	GG	On-Demand	Anodyne	CXCR3	17	45
COc1cc(CC(=O)N2CCC(Oc3cc(C)ccn3)CC2)ccc1Cl	ZINC000450535802	FH	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CCC(Oc3cc(C)ccn3)CC2)ccc1Cl	ZINC000450535802	FH	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2CCC(Oc3cc(C)ccn3)CC2)ccc1Cl	ZINC000450535802	FH	On-Demand	Anodyne	CCR1	22	41
COc1cc(CC(=O)N2CCC(Oc3cc(C)ccn3)CC2)ccc1Cl	ZINC000450535802	FH	On-Demand	Anodyne	SCD	21	41
O=C(Nc1ncc(C2CCCCC2)s1)[C@H]1CC1(F)F	ZINC000450535803	CH	On-Demand	Anodyne	CDK5	63	53
O=C(Nc1ncc(C2CCCCC2)s1)[C@@H]1CC1(F)F	ZINC000450535804	CH	On-Demand	Anodyne	CDK5	63	53
COc1ccccc1O[C@H]1CCCN(c2nccc(-c3cnccn3)n2)C1	ZINC000450535806	FF	On-Demand	Anodyne	PDE3A	41	39
COc1ccccc1O[C@@H]1CCCN(c2nccc(-c3cnccn3)n2)C1	ZINC000450535807	FF	On-Demand	Anodyne	PDE3A	41	39
CCCc1csc(NC(=O)CCOc2cccc(OC)c2)n1	ZINC000450535825	DH	On-Demand	Anodyne	PDE5A	0	44
CCCc1csc(NC(=O)CCOc2cccc(OC)c2)n1	ZINC000450535825	DH	On-Demand	Anodyne	CSNK1D	23	45
CCCc1csc(NC(=O)CCOc2cccc(OC)c2)n1	ZINC000450535825	DH	On-Demand	Anodyne	ROCK1	19	43
CCCc1csc(NC(=O)CCOc2cccc(OC)c2)n1	ZINC000450535825	DH	On-Demand	Anodyne	MTNR1A	54	44
CCCc1csc(NC(=O)CCOc2cccc(OC)c2)n1	ZINC000450535825	DH	On-Demand	Anodyne	MTNR1B	48	45
CCCc1csc(NC(=O)CCOc2cccc(OC)c2)n1	ZINC000450535825	DH	On-Demand	Anodyne	ROCK2	20	44
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(C)C)CC1	ZINC000450535842	DH	On-Demand	Anodyne	GNAI1	0	48
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(C)C)CC1	ZINC000450535842	DH	On-Demand	Anodyne	GNAI3	0	50
CCN(CC)C(=O)CCC1CCN(C(=O)CCCC(C)C)CC1	ZINC000450535842	DH	On-Demand	Anodyne	GNAO1	0	48
COc1ccc(-c2ccnc(NC[C@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535861	GF	On-Demand	Anodyne	JAK3	0	41
COc1ccc(-c2ccnc(NC[C@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535861	GF	On-Demand	Anodyne	JAK2	18	41
COc1ccc(-c2ccnc(NC[C@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535861	GF	On-Demand	Anodyne	MAPK1	50	38
COc1ccc(-c2ccnc(NC[C@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535861	GF	On-Demand	Anodyne	CLK1	19	49
COc1ccc(-c2ccnc(NC[C@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535861	GF	On-Demand	Anodyne	CLK4	29	49
COc1ccc(-c2ccnc(NC[C@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535861	GF	On-Demand	Anodyne	DYRK1B	17	49
COc1ccc(-c2ccnc(NC[C@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535861	GF	On-Demand	Anodyne	SMG1	46	39
COc1ccc(-c2ccnc(NC[C@@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535862	GF	On-Demand	Anodyne	JAK3	0	41
COc1ccc(-c2ccnc(NC[C@@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535862	GF	On-Demand	Anodyne	JAK2	18	41
COc1ccc(-c2ccnc(NC[C@@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535862	GF	On-Demand	Anodyne	MAPK1	50	38
COc1ccc(-c2ccnc(NC[C@@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535862	GF	On-Demand	Anodyne	CLK1	19	49
COc1ccc(-c2ccnc(NC[C@@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535862	GF	On-Demand	Anodyne	CLK4	29	49
COc1ccc(-c2ccnc(NC[C@@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535862	GF	On-Demand	Anodyne	DYRK1B	17	49
COc1ccc(-c2ccnc(NC[C@@H](N3CCOCC3)C(F)(F)F)n2)cc1	ZINC000450535862	GF	On-Demand	Anodyne	SMG1	46	39
CCCCCn1cc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)c(C)n1	ZINC000450535863	GG	On-Demand	Anodyne	P2RX7	54	40
CCCCCn1cc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)c(C)n1	ZINC000450535863	GG	On-Demand	Anodyne	PSBA	0	41
COc1ccc(CN2CC[C@H](Nc3nnc(C(C)C)o3)C2=O)c(OC)c1	ZINC000450535868	FD	On-Demand	Anodyne	TRY2_BOVIN	18	40
COc1ccc(CN2CC[C@@H](Nc3nnc(C(C)C)o3)C2=O)c(OC)c1	ZINC000450535869	FD	On-Demand	Anodyne	TRY2_BOVIN	18	40
N#Cc1cccc(N2CC[C@H](Oc3cccnc3N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000450535875	GG	On-Demand	Mild	PDE3A	24	43
N#Cc1cccc(N2CC[C@H](Oc3cccnc3N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000450535875	GG	On-Demand	Mild	PDE3B	29	43
N#Cc1cccc(N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000450535876	GG	On-Demand	Mild	PDE3A	24	43
N#Cc1cccc(N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000450535876	GG	On-Demand	Mild	PDE3B	29	43
Cc1ccnc(OC2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)c1	ZINC000450535881	FG	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)c1	ZINC000450535881	FG	On-Demand	Anodyne	HCRTR2	0	41
Cc1ccnc(OC2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)c1	ZINC000450535882	FG	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)c1	ZINC000450535882	FG	On-Demand	Anodyne	HCRTR2	0	41
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)CC2)c1	ZINC000450535883	FG	On-Demand	Anodyne	GRIN2B	20	40
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)CC2)c1	ZINC000450535883	FG	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)CC2)c1	ZINC000450535883	FG	On-Demand	Anodyne	HCRTR2	0	41
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)CC2)c1	ZINC000450535883	FG	On-Demand	Anodyne	AKR1C3	17	40
O=C(CCC(F)(F)F)N1CCC[C@@H](Nc2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450535900	GH	On-Demand	Bother	ETHR	44	36
CCS(=O)(=O)N1CCN(c2ncc(C(F)F)cn2)[C@H](C)C1	ZINC000450535902	DD	On-Demand	Anodyne	CXCR3	24	46
Cc1noc([C@H]2COCCN2C(=O)CCc2cccc(F)c2Br)n1	ZINC000450535903	GF	On-Demand	Anodyne	COLA	45	41
Cc1noc([C@H]2COCCN2C(=O)CCc2cccc(F)c2Br)n1	ZINC000450535903	GF	On-Demand	Anodyne	CPT1A	42	41
Cc1noc([C@@H]2COCCN2C(=O)CCc2cccc(F)c2Br)n1	ZINC000450535904	GF	On-Demand	Anodyne	COLA	45	41
Cc1noc([C@@H]2COCCN2C(=O)CCc2cccc(F)c2Br)n1	ZINC000450535904	GF	On-Demand	Anodyne	CPT1A	42	41
COc1cc(CNC(=O)c2cnc(C(=O)O)cn2)ccc1OC1CCCC1	ZINC000450535905	FE	On-Demand	Anodyne	PDE4A	53	47
COc1cc(CNC(=O)c2cnc(C(=O)O)cn2)ccc1OC1CCCC1	ZINC000450535905	FE	On-Demand	Anodyne	SSTR5	41	39
COc1cc(CNC(=O)c2cnc(C(=O)O)cn2)ccc1OC1CCCC1	ZINC000450535905	FE	On-Demand	Anodyne	PDE4B	29	47
COc1cc(CNC(=O)c2cnc(C(=O)O)cn2)ccc1OC1CCCC1	ZINC000450535905	FE	On-Demand	Anodyne	PDE4D	37	47
COc1cc(CNC(=O)c2cnc(C(=O)O)cn2)ccc1OC1CCCC1	ZINC000450535905	FE	On-Demand	Anodyne	ROCK2	16	40
COc1cc(CNC(=O)c2cnc(C(=O)O)cn2)ccc1OC1CCCC1	ZINC000450535905	FE	On-Demand	Anodyne	PDE4C	17	47
COc1cc(CNC(=O)c2cnc(C(=O)O)cn2)ccc1OC1CCCC1	ZINC000450535905	FE	On-Demand	Anodyne	SLC5A7	34	41
COc1cc(CNC(=O)c2cnc(C(=O)O)cn2)ccc1OC1CCCC1	ZINC000450535905	FE	On-Demand	Anodyne	MT-ND1	18	41
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	FKBP1A	41	36
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	ACHE	16	40
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	PDE4A	45	52
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	TRPV1	20	44
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	BCHE	19	40
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	PDE4B	28	49
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	PDE4D	34	49
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	UTS2R	15	41
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	NOS2	16	43
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	PDE4C	17	49
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	MT-ND1	26	43
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	MBTPS1	43	33
COc1cc(CNC(=O)CCc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450535918	GH	On-Demand	Anodyne	PDEC	0	46
Cc1ccnc(OC2CCN(C(=O)Cc3cc(C)ccc3F)CC2)c1	ZINC000450535923	EG	On-Demand	Anodyne	HCRTR1	23	41
Cc1ccnc(OC2CCN(C(=O)Cc3cc(C)ccc3F)CC2)c1	ZINC000450535923	EG	On-Demand	Anodyne	HCRTR2	24	41
COc1ccc(-c2noc(N(C)CCC(N)=O)n2)cc1	ZINC000450535924	CD	On-Demand	Anodyne	LUCI_PHOPE	15	42
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450535931	GF	On-Demand	Anodyne	BTK	40	36
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450535931	GF	On-Demand	Anodyne	LRRK2	16	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450535932	GF	On-Demand	Anodyne	BTK	40	36
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450535932	GF	On-Demand	Anodyne	LRRK2	16	44
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450535941	FG	On-Demand	Anodyne	LRRK2	26	44
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1C	ZINC000450535942	FG	On-Demand	Anodyne	LRRK2	26	44
COc1cc(Cl)c(C(=O)N[C@@H]2CCC[C@@H]2C(=O)O)cc1OC	ZINC000450535958	EE	On-Demand	Anodyne	DRD2	35	41
COc1cc(Cl)c(C(=O)N[C@@H]2CCC[C@@H]2C(=O)O)cc1OC	ZINC000450535958	EE	On-Demand	Anodyne	HTR4	37	45
CCCCCn1cc(CNC(=O)c2c(C)cccc2Cl)c(C)n1	ZINC000450535959	EI	On-Demand	Anodyne	P2RX7	50	43
CCCCCn1cc(CNC(=O)c2c(C)cccc2Cl)c(C)n1	ZINC000450535959	EI	On-Demand	Anodyne	ACAT	0	41
O=C1NCCN1C1CN(c2ncnc3ccc(I)cc23)C1	ZINC000450535973	GD	On-Demand	Anodyne	PDE3B	46	32
Cc1cc(F)c(CC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)cc1F	ZINC000450535974	GG	On-Demand	Anodyne	LRRK2	21	45
N#Cc1cnc(N[C@@H]2CC[C@@H](Nc3ccccn3)CC2)c(Cl)c1	ZINC000450536007	EH	On-Demand	Mild	IRAK4	15	42
COc1cc(CC(=O)Nc2ncc(C3CCCCC3)s2)ccc1O	ZINC000450536008	EI	On-Demand	Anodyne	CDK5	72	61
COc1cc(CC(=O)Nc2ncc(C3CCCCC3)s2)ccc1O	ZINC000450536008	EI	On-Demand	Anodyne	STK17B	41	36
CC1(C(=O)NCC2(c3ccccc3Cl)CCCCC2)CCC(=O)CC1	ZINC000450536012	FJ	On-Demand	Anodyne	ACAT	0	43
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450536019	FG	On-Demand	Anodyne	CNR1	0	42
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450536019	FG	On-Demand	Anodyne	CNR2	22	42
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450536019	FG	On-Demand	Anodyne	LRRK2	17	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450536019	FG	On-Demand	Anodyne	L3MBTL3	43	33
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H]1CCCCC1(F)F	ZINC000450536020	FG	On-Demand	Anodyne	CNR1	0	42
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H]1CCCCC1(F)F	ZINC000450536020	FG	On-Demand	Anodyne	CNR2	22	42
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H]1CCCCC1(F)F	ZINC000450536020	FG	On-Demand	Anodyne	LRRK2	17	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H]1CCCCC1(F)F	ZINC000450536020	FG	On-Demand	Anodyne	L3MBTL3	43	33
CC(C)[C@@H](CO)CNc1ncnc2[nH]c3ccccc3c12	ZINC000450536027	CF	On-Demand	Anodyne	UTS2R	22	46
CC(C)[C@H](CO)CNc1ncnc2[nH]c3ccccc3c12	ZINC000450536028	CF	On-Demand	Anodyne	UTS2R	22	46
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)c1	ZINC000450536029	GI	On-Demand	Anodyne	HCRTR1	26	44
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)c1	ZINC000450536029	GI	On-Demand	Anodyne	CACNA1B	40	39
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)c1	ZINC000450536029	GI	On-Demand	Anodyne	HCRTR2	27	44
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)c1	ZINC000450536029	GI	On-Demand	Anodyne	LIPG	58	43
Cc1nc(NC(C2CCC2)C2CCC2)ncc1[N+](=O)[O-]	ZINC000450536031	CG	On-Demand	Bother	PRKCQ	44	38
Cc1nc(N[C@@H]2CC[C@H]2C)ncc1[N+](=O)[O-]	ZINC000450536034	BD	On-Demand	Bother	PRKCQ	46	38
Cc1nc(N[C@@H]2CC[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000450536035	BD	On-Demand	Bother	PRKCQ	46	38
Cc1nc(N[C@H]2CC[C@H]2C)ncc1[N+](=O)[O-]	ZINC000450536036	BD	On-Demand	Bother	PRKCQ	46	38
Cc1nc(N[C@H]2CC[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000450536037	BD	On-Demand	Bother	PRKCQ	46	38
CC(=O)c1cn(CC(=O)Nc2ncc(C3CCCCC3)s2)nn1	ZINC000450536105	EF	On-Demand	Anodyne	CDK5	35	41
Cc1nc(N[C@@H]2CC[C@@H](Nc3ccccn3)CC2)ncc1[N+](=O)[O-]	ZINC000450536113	EF	On-Demand	Bother	PRKCQ	28	42
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	HDAC8	26	43
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	HDAC10	39	43
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	HDAC1	26	45
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	HDAC2	28	45
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	HDAC3	47	43
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	HDAC6	43	43
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	PTPRF	44	34
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	HDAC9	34	45
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	MSR1	0	40
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	CYP2B1	0	42
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	PFHDAC1	0	43
O=C(O)CCCCC(=O)Nc1ccc2cc[nH]c2c1	ZINC000450536116	CF	On-Demand	Anodyne	PARP10	0	47
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450536123	EH	On-Demand	Anodyne	HCRTR1	0	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450536123	EH	On-Demand	Anodyne	HCRTR2	15	40
CCC[C@H]1CCC[C@H]1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450536124	EH	On-Demand	Anodyne	HCRTR1	0	40
CCC[C@H]1CCC[C@H]1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450536124	EH	On-Demand	Anodyne	HCRTR2	15	40
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450536125	EH	On-Demand	Anodyne	HCRTR1	0	40
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450536125	EH	On-Demand	Anodyne	HCRTR2	15	40
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450536126	EH	On-Demand	Anodyne	HCRTR1	0	40
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC(Oc2cc(C)ccn2)CC1	ZINC000450536126	EH	On-Demand	Anodyne	HCRTR2	15	40
Cn1cc(-c2ccc(C(=O)Nc3ncc(C4CCCCC4)s3)o2)cn1	ZINC000450536135	FI	On-Demand	Anodyne	MMP13	0	46
Cn1cc(-c2ccc(C(=O)Nc3ncc(C4CCCCC4)s3)o2)cn1	ZINC000450536135	FI	On-Demand	Anodyne	CDK5	60	49
CCCOc1ccc(C(=O)Nc2cccc3c2OCO3)c(OC)c1	ZINC000450536136	EG	On-Demand	Anodyne	EDNRB	22	40
CCCOc1ccc(C(=O)Nc2cccc3c2OCO3)c(OC)c1	ZINC000450536136	EG	On-Demand	Anodyne	EDNRA	24	40
CCCOc1ccc(C(=O)Nc2cccc3c2OCO3)c(OC)c1	ZINC000450536136	EG	On-Demand	Anodyne	KCNK3	42	38
CCCOc1ccc(C(=O)Nc2cccc3c2OCO3)c(OC)c1	ZINC000450536136	EG	On-Demand	Anodyne	G2YM83_BOTF4	40	33
Cc1cc(OCc2ccccc2)nc(N2CCC[C@](F)(CO)C2)n1	ZINC000450536139	EF	On-Demand	Anodyne	SLC12A5	56	33
Cc1cc(OCc2ccccc2)nc(N2CCC[C@@](F)(CO)C2)n1	ZINC000450536140	EF	On-Demand	Anodyne	SLC12A5	56	33
CSc1ccc2ncnc(NCc3oc(C)nc3C)c2c1	ZINC000450536141	DF	On-Demand	Anodyne	DYRK1A	24	41
CSc1ccc2ncnc(NCc3oc(C)nc3C)c2c1	ZINC000450536141	DF	On-Demand	Anodyne	CLK2	28	41
CSc1ccc2ncnc(NCc3oc(C)nc3C)c2c1	ZINC000450536141	DF	On-Demand	Anodyne	CLK4	74	42
CSc1ccc2ncnc(NCc3oc(C)nc3C)c2c1	ZINC000450536141	DF	On-Demand	Anodyne	DYRK1B	30	41
CCN(Cc1nc(-c2cc(C)ccn2)no1)c1ccccc1OC	ZINC000450536149	DG	On-Demand	Anodyne	LUCI_PHOPE	29	42
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)c1	ZINC000450536154	FI	On-Demand	Anodyne	HCRTR1	0	44
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)c1	ZINC000450536154	FI	On-Demand	Anodyne	SCN5A	18	40
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)c1	ZINC000450536154	FI	On-Demand	Anodyne	EPHX2	16	45
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)c1	ZINC000450536154	FI	On-Demand	Anodyne	HCRTR2	22	44
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)c1	ZINC000450536155	FI	On-Demand	Anodyne	HCRTR1	0	44
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)c1	ZINC000450536155	FI	On-Demand	Anodyne	SCN5A	18	40
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)c1	ZINC000450536155	FI	On-Demand	Anodyne	EPHX2	16	45
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)c1	ZINC000450536155	FI	On-Demand	Anodyne	HCRTR2	22	44
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)c1	ZINC000450536156	FI	On-Demand	Anodyne	HCRTR1	0	44
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)c1	ZINC000450536156	FI	On-Demand	Anodyne	SCN5A	18	40
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)c1	ZINC000450536156	FI	On-Demand	Anodyne	EPHX2	16	45
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)c1	ZINC000450536156	FI	On-Demand	Anodyne	HCRTR2	22	44
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)c1	ZINC000450536157	FI	On-Demand	Anodyne	HCRTR1	0	44
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)c1	ZINC000450536157	FI	On-Demand	Anodyne	SCN5A	18	40
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)c1	ZINC000450536157	FI	On-Demand	Anodyne	EPHX2	16	45
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)c1	ZINC000450536157	FI	On-Demand	Anodyne	HCRTR2	22	44
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450536171	GJ	On-Demand	Anodyne	UTS2R	44	31
COC(=O)c1coc(CN(CC(C)C)c2cccc(OC)c2)n1	ZINC000450536202	DG	On-Demand	Anodyne	CETP	0	40
COc1cc(CNC(=O)CCCCC(=O)O)ccc1OC1CCCC1	ZINC000450536206	EG	On-Demand	Anodyne	PDE4A	45	42
COc1cc(CNC(=O)CCCCC(=O)O)ccc1OC1CCCC1	ZINC000450536206	EG	On-Demand	Anodyne	TRPV1	22	55
COc1cc(CNC(=O)CCCCC(=O)O)ccc1OC1CCCC1	ZINC000450536206	EG	On-Demand	Anodyne	PDE4B	32	47
COc1cc(CNC(=O)CCCCC(=O)O)ccc1OC1CCCC1	ZINC000450536206	EG	On-Demand	Anodyne	PDEC	0	43
CC(=O)N[C@H](C(=O)Nc1ncc(C2CCCCC2)s1)C(C)(C)C	ZINC000450536207	EH	On-Demand	Anodyne	CDK5	56	47
CCN(CC)C(=O)CCC1CCN(C(=O)CSC2CC2)CC1	ZINC000450536209	EF	On-Demand	Anodyne	GNAI1	0	42
CCN(CC)C(=O)CCC1CCN(C(=O)CSC2CC2)CC1	ZINC000450536209	EF	On-Demand	Anodyne	GNAI3	0	44
CCN(CC)C(=O)CCC1CCN(C(=O)CSC2CC2)CC1	ZINC000450536209	EF	On-Demand	Anodyne	GNAO1	0	42
O=[N+]([O-])c1ccc(N2CC[C@H](Oc3cccnc3N3CCCC3)C2)cn1	ZINC000450536236	FF	On-Demand	Bother	PDE3B	40	34
O=[N+]([O-])c1ccc(N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)cn1	ZINC000450536237	FF	On-Demand	Bother	PDE3B	40	34
CC[C@@H](CNc1ncnc2[nH]c3ccccc3c12)OC	ZINC000450536258	CF	On-Demand	Anodyne	TUBB3	31	40
CC[C@@H](CNc1ncnc2[nH]c3ccccc3c12)OC	ZINC000450536258	CF	On-Demand	Anodyne	UTS2R	23	44
CC[C@H](CNc1ncnc2[nH]c3ccccc3c12)OC	ZINC000450536259	CF	On-Demand	Anodyne	TUBB3	31	40
CC[C@H](CNc1ncnc2[nH]c3ccccc3c12)OC	ZINC000450536259	CF	On-Demand	Anodyne	UTS2R	23	44
OC[C@H]1CN(c2ncnc3cc(Br)ccc23)CCC1(F)F	ZINC000450536282	FF	On-Demand	Anodyne	PDE3A	43	32
Cc1nc(C)n(CCCC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1	ZINC000450536284	GI	On-Demand	Mild	MCHR1	26	40
Cc1nc(C)n(CCCC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1	ZINC000450536284	GI	On-Demand	Mild	SUCNR1	17	42
Cc1nc(C)n(CCCC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1	ZINC000450536285	GI	On-Demand	Mild	MCHR1	26	40
Cc1nc(C)n(CCCC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1	ZINC000450536285	GI	On-Demand	Mild	SUCNR1	17	42
COc1cc(C(=O)Nc2ncc(C3CCCCC3)s2)c([N+](=O)[O-])cc1F	ZINC000450536288	GI	On-Demand	Bother	CDK5	49	40
OC[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCC1(F)F	ZINC000450536289	FF	On-Demand	Anodyne	PDE3A	43	32
COC(=O)CN1CCC[C@H](CNc2nc(C)nc3[nH]ccc23)C1	ZINC000450536297	DC	On-Demand	Anodyne	IGF1R	49	37
Cc1noc([C@@H]2COCCN2C(=O)Cc2cc(F)c(C)cc2F)n1	ZINC000450536300	EE	On-Demand	Anodyne	COLA	24	41
Cc1noc([C@@H]2COCCN2C(=O)Cc2cc(F)c(C)cc2F)n1	ZINC000450536300	EE	On-Demand	Anodyne	CPT1A	18	41
Cc1noc([C@H]2COCCN2C(=O)Cc2cc(F)c(C)cc2F)n1	ZINC000450536301	EE	On-Demand	Anodyne	COLA	24	41
Cc1noc([C@H]2COCCN2C(=O)Cc2cc(F)c(C)cc2F)n1	ZINC000450536301	EE	On-Demand	Anodyne	CPT1A	18	41
COC(=O)CN1CCC[C@@H](CNc2nc(C)nc3[nH]ccc23)C1	ZINC000450536303	DC	On-Demand	Anodyne	IGF1R	49	37
O=S(=O)(C1CC1)N1CCC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450536309	FD	On-Demand	Anodyne	IKBKB	0	45
O=S(=O)(C1CC1)N1CCC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450536309	FD	On-Demand	Anodyne	MAPK1	51	36
O=S(=O)(C1CC1)N1CCC[C@@H](Nc2nccc(-c3cnccn3)n2)C1	ZINC000450536309	FD	On-Demand	Anodyne	MAPK8	29	43
CN(C)c1nc(NC[C@H]2CCCN(C(N)=O)C2)nc2ccccc12	ZINC000450536310	ED	On-Demand	Anodyne	ADRA2A	21	58
CN(C)c1nc(NC[C@H]2CCCN(C(N)=O)C2)nc2ccccc12	ZINC000450536310	ED	On-Demand	Anodyne	NPY2R	20	58
CN(C)c1nc(NC[C@H]2CCCN(C(N)=O)C2)nc2ccccc12	ZINC000450536310	ED	On-Demand	Anodyne	VCP	56	35
CN(C)c1nc(NC[C@@H]2CCCN(C(N)=O)C2)nc2ccccc12	ZINC000450536311	ED	On-Demand	Anodyne	ADRA2A	21	58
CN(C)c1nc(NC[C@@H]2CCCN(C(N)=O)C2)nc2ccccc12	ZINC000450536311	ED	On-Demand	Anodyne	NPY2R	20	58
CN(C)c1nc(NC[C@@H]2CCCN(C(N)=O)C2)nc2ccccc12	ZINC000450536311	ED	On-Demand	Anodyne	VCP	56	35
CCOC1(C)CCN(c2nccc3c(OC)cccc23)CC1	ZINC000450536320	DH	On-Demand	Anodyne	PDE3B	44	32
C[C@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450536329	FJ	On-Demand	Mild	CTSF	70	34
C[C@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450536329	FJ	On-Demand	Mild	MCHR1	33	41
C[C@@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450536331	FJ	On-Demand	Mild	CTSF	70	34
C[C@@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450536331	FJ	On-Demand	Mild	MCHR1	33	41
CCCOc1ccc(C(=O)N2CCOC[C@H]2c2nc(C)no2)c(OC)c1	ZINC000450536340	FE	On-Demand	Anodyne	COLA	27	41
CCCOc1ccc(C(=O)N2CCOC[C@H]2c2nc(C)no2)c(OC)c1	ZINC000450536340	FE	On-Demand	Anodyne	CPT1A	24	41
CCCOc1ccc(C(=O)N2CCOC[C@@H]2c2nc(C)no2)c(OC)c1	ZINC000450536341	FE	On-Demand	Anodyne	COLA	27	41
CCCOc1ccc(C(=O)N2CCOC[C@@H]2c2nc(C)no2)c(OC)c1	ZINC000450536341	FE	On-Demand	Anodyne	CPT1A	24	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450536348	DD	On-Demand	Anodyne	CAPNS1	44	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450536348	DD	On-Demand	Anodyne	CAPN1	43	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450536348	DD	On-Demand	Anodyne	CAPN2	47	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450536349	DD	On-Demand	Anodyne	CAPNS1	44	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450536349	DD	On-Demand	Anodyne	CAPN1	43	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450536349	DD	On-Demand	Anodyne	CAPN2	47	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450536350	DD	On-Demand	Anodyne	CAPNS1	44	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450536350	DD	On-Demand	Anodyne	CAPN1	43	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450536350	DD	On-Demand	Anodyne	CAPN2	47	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450536351	DD	On-Demand	Anodyne	CAPNS1	44	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450536351	DD	On-Demand	Anodyne	CAPN1	43	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450536351	DD	On-Demand	Anodyne	CAPN2	47	33
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450536359	ED	On-Demand	Anodyne	CNR1	0	40
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450536359	ED	On-Demand	Anodyne	CNR2	0	41
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450536359	ED	On-Demand	Anodyne	LRRK2	27	43
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450536359	ED	On-Demand	Anodyne	L3MBTL1	0	41
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450536359	ED	On-Demand	Anodyne	L3MBTL3	44	33
CN(C)c1nc(N2CCCN(S(=O)(=O)N(C)C)CC2)nc2ccccc12	ZINC000450536370	GD	On-Demand	Anodyne	SORD	16	46
C[C@@H](O)C[C@@H](C)NC(=O)c1cc(O)ccc1F	ZINC000450536375	BD	For-Sale	Anodyne	HSD17B1	24	40
C[C@@H](C[C@@H](C)O)NC(=O)c1cc(O)ccc1F	ZINC000450536376	BD	For-Sale	Anodyne	HSD17B1	24	40
C[C@H](O)C[C@@H](C)NC(=O)c1cc(O)ccc1F	ZINC000450536377	BD	For-Sale	Anodyne	HSD17B1	24	40
C[C@H](O)C[C@H](C)NC(=O)c1cc(O)ccc1F	ZINC000450536378	BD	For-Sale	Anodyne	HSD17B1	24	40
Cc1ccc(C2CCN(C(=O)c3ccc(-c4ccncc4)c(F)c3)CC2)cn1	ZINC000450536379	GJ	On-Demand	Anodyne	FASN	42	38
Cc1ccc(C2CCN(C(=O)c3ccc(-c4ccncc4)c(F)c3)CC2)cn1	ZINC000450536379	GJ	On-Demand	Anodyne	L3MBTL3	41	33
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	PDE4A	41	44
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	HCRTR1	19	44
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	FABP4	40	39
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	PDE4B	20	42
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	PDE4D	23	42
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	NOS2	17	41
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	PDE4C	15	42
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	HCRTR2	19	41
COc1cc(CNC(=O)CCc2ccccc2C(=O)O)ccc1OC1CCCC1	ZINC000450536382	GH	On-Demand	Anodyne	MBTPS1	45	34
C[C@@H](O)C[C@@H](C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450536397	EF	On-Demand	Anodyne	PYGL	43	36
C[C@@H](C[C@@H](C)O)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450536398	EF	On-Demand	Anodyne	PYGL	43	36
C[C@H](O)C[C@@H](C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450536399	EF	On-Demand	Anodyne	PYGL	43	36
C[C@H](O)C[C@H](C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450536400	EF	On-Demand	Anodyne	PYGL	43	36
Cc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)CC2)cn1	ZINC000450536434	EH	On-Demand	Anodyne	FASN	40	34
CCCOc1cc(C)ccc1CNC(=O)Cc1ccccc1C(=O)O	ZINC000450536439	EG	On-Demand	Anodyne	PPARD	17	41
O=[N+]([O-])c1ccc(-c2csc(NC[C@H](CO)C3CC3)n2)cc1	ZINC000450536440	DF	On-Demand	Bother	MAOB	23	52
O=[N+]([O-])c1ccc(-c2csc(NC[C@@H](CO)C3CC3)n2)cc1	ZINC000450536441	DF	On-Demand	Bother	MAOB	23	52
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536442	FD	On-Demand	Anodyne	ACE	52	48
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536442	FD	On-Demand	Anodyne	MME	38	48
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536442	FD	On-Demand	Anodyne	PGC	41	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536442	FD	On-Demand	Anodyne	APP	15	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536442	FD	On-Demand	Anodyne	BIRC2	50	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536443	FD	On-Demand	Anodyne	ACE	52	48
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536443	FD	On-Demand	Anodyne	MME	38	48
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536443	FD	On-Demand	Anodyne	PGC	41	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536443	FD	On-Demand	Anodyne	APP	15	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536443	FD	On-Demand	Anodyne	BIRC2	50	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536444	FD	On-Demand	Anodyne	ACE	52	48
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536444	FD	On-Demand	Anodyne	MME	38	48
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536444	FD	On-Demand	Anodyne	PGC	41	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536444	FD	On-Demand	Anodyne	APP	15	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536444	FD	On-Demand	Anodyne	BIRC2	50	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536445	FD	On-Demand	Anodyne	ACE	52	48
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536445	FD	On-Demand	Anodyne	MME	38	48
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536445	FD	On-Demand	Anodyne	PGC	41	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536445	FD	On-Demand	Anodyne	APP	15	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450536445	FD	On-Demand	Anodyne	BIRC2	50	39
CCCOc1cc(C)ccc1CNC(=O)c1ccc(C(=O)O)o1	ZINC000450536487	DG	On-Demand	Anodyne	PPARA	15	41
O=C(O)c1cccc(CC(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450536488	GH	On-Demand	Anodyne	CCR2	66	43
O=C(O)c1cccc(CC(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450536488	GH	On-Demand	Anodyne	LIPG	41	31
O=C(O)c1cccc(CC(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450536489	GH	On-Demand	Anodyne	CCR2	66	43
O=C(O)c1cccc(CC(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450536489	GH	On-Demand	Anodyne	LIPG	41	31
CNc1nc(N2CC[C@](CO)(c3ccccc3)C2)nc2ccccc12	ZINC000450536493	EE	On-Demand	Anodyne	HRH4	15	44
CNc1nc(N2CC[C@@](CO)(c3ccccc3)C2)nc2ccccc12	ZINC000450536495	EE	On-Demand	Anodyne	HRH4	15	44
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)CC1	ZINC000450536576	FH	On-Demand	Anodyne	AKR1C3	18	41
COc1cc(CNC(=O)c2ccc(C(=O)O)c(C)n2)ccc1OC1CCCC1	ZINC000450536604	GG	On-Demand	Anodyne	PDE4A	48	42
COc1cc(CNC(=O)c2ccc(C(=O)O)c(C)n2)ccc1OC1CCCC1	ZINC000450536604	GG	On-Demand	Anodyne	PDE4B	29	42
COc1cc(CNC(=O)c2ccc(C(=O)O)c(C)n2)ccc1OC1CCCC1	ZINC000450536604	GG	On-Demand	Anodyne	PDE4D	29	42
COc1cc(CNC(=O)c2ccc(C(=O)O)c(C)n2)ccc1OC1CCCC1	ZINC000450536604	GG	On-Demand	Anodyne	PDE4C	15	42
COc1cc(CNC(=O)c2ccc(C(=O)O)c(C)n2)ccc1OC1CCCC1	ZINC000450536604	GG	On-Demand	Anodyne	SLC5A7	27	41
Cc1nc(NCC2(C(F)(F)F)CCC2)ncc1[N+](=O)[O-]	ZINC000450536605	CF	On-Demand	Bother	PRKCQ	41	36
COc1cc(CNC(=O)C2(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450536613	EE	On-Demand	Anodyne	PDE4A	34	41
COc1cc(CNC(=O)C2(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450536613	EE	On-Demand	Anodyne	PDE4B	30	46
COc1cc(CNC(=O)C2(C(=O)O)CC2)ccc1OC1CCCC1	ZINC000450536613	EE	On-Demand	Anodyne	PDE4D	31	41
CCN(CC)C(=O)CCC1CCN(C(=O)CC2CC(F)(F)C2)CC1	ZINC000450536614	EG	On-Demand	Anodyne	GNAI1	0	40
CCN(CC)C(=O)CCC1CCN(C(=O)CC2CC(F)(F)C2)CC1	ZINC000450536614	EG	On-Demand	Anodyne	GNAI3	0	41
CCN(CC)C(=O)CCC1CCN(C(=O)CC2CC(F)(F)C2)CC1	ZINC000450536614	EG	On-Demand	Anodyne	GNAO1	0	40
CCCOc1cccc(CC(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536626	FG	On-Demand	Anodyne	PPARG	26	40
CCCOc1cccc(CC(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536626	FG	On-Demand	Anodyne	PPARD	26	40
CCCOc1cccc(CC(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536626	FG	On-Demand	Anodyne	PLA2G4B	22	41
CCCOc1cccc(CC(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536626	FG	On-Demand	Anodyne	TSPAN17	0	43
CCCOc1cccc(CC(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536626	FG	On-Demand	Anodyne	CACNA1G	31	40
CCCOc1cccc(CC(=O)NC[C@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536626	FG	On-Demand	Anodyne	PDS	67	38
CCCOc1cccc(CC(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536627	FG	On-Demand	Anodyne	PPARG	26	40
CCCOc1cccc(CC(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536627	FG	On-Demand	Anodyne	PPARD	26	40
CCCOc1cccc(CC(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536627	FG	On-Demand	Anodyne	PLA2G4B	22	41
CCCOc1cccc(CC(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536627	FG	On-Demand	Anodyne	TSPAN17	0	43
CCCOc1cccc(CC(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536627	FG	On-Demand	Anodyne	CACNA1G	31	40
CCCOc1cccc(CC(=O)NC[C@@](C)(C(=O)O)c2ccc(F)cc2)c1	ZINC000450536627	FG	On-Demand	Anodyne	PDS	67	38
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450536628	GH	On-Demand	Anodyne	ACHE	22	42
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450536628	GH	On-Demand	Anodyne	SLC6A3	22	41
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450536628	GH	On-Demand	Anodyne	GHRHR	41	34
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450536628	GH	On-Demand	Anodyne	P2RY12	55	37
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450536628	GH	On-Demand	Anodyne	CCR5	25	40
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450536628	GH	On-Demand	Anodyne	AMY2	45	31
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450536629	GH	On-Demand	Anodyne	ACHE	22	42
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450536629	GH	On-Demand	Anodyne	SLC6A3	22	41
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450536629	GH	On-Demand	Anodyne	GHRHR	41	34
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450536629	GH	On-Demand	Anodyne	P2RY12	55	37
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450536629	GH	On-Demand	Anodyne	CCR5	25	40
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450536629	GH	On-Demand	Anodyne	AMY2	45	31
COc1cc(CNC(=O)Cn2cc(C(=O)O)nn2)ccc1OC1CCCC1	ZINC000450536633	FD	On-Demand	Anodyne	PDE4A	51	43
COc1cc(CNC(=O)Cn2cc(C(=O)O)nn2)ccc1OC1CCCC1	ZINC000450536633	FD	On-Demand	Anodyne	HCRTR1	19	45
COc1cc(CNC(=O)Cn2cc(C(=O)O)nn2)ccc1OC1CCCC1	ZINC000450536633	FD	On-Demand	Anodyne	SSTR5	25	40
COc1cc(CNC(=O)Cn2cc(C(=O)O)nn2)ccc1OC1CCCC1	ZINC000450536633	FD	On-Demand	Anodyne	PDE4B	30	43
COc1cc(CNC(=O)Cn2cc(C(=O)O)nn2)ccc1OC1CCCC1	ZINC000450536633	FD	On-Demand	Anodyne	PDE4D	35	43
COc1cc(CNC(=O)Cn2cc(C(=O)O)nn2)ccc1OC1CCCC1	ZINC000450536633	FD	On-Demand	Anodyne	PDE4C	16	43
COc1cc(CNC(=O)Cn2cc(C(=O)O)nn2)ccc1OC1CCCC1	ZINC000450536633	FD	On-Demand	Anodyne	HCRTR2	16	41
COc1cc(CNC(=O)Cn2cc(C(=O)O)nn2)ccc1OC1CCCC1	ZINC000450536633	FD	On-Demand	Anodyne	DRTS_TRYCR	43	30
Cc1noc([C@H]2COCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)n1	ZINC000450536644	FE	On-Demand	Anodyne	COLA	26	40
Cc1noc([C@H]2COCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)n1	ZINC000450536644	FE	On-Demand	Anodyne	CPT1A	23	40
Cc1noc([C@@H]2COCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)n1	ZINC000450536645	FE	On-Demand	Anodyne	COLA	26	40
Cc1noc([C@@H]2COCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)n1	ZINC000450536645	FE	On-Demand	Anodyne	CPT1A	23	40
NC(=O)CCC1CCN(C(=O)Cc2cc3ccccc3s2)CC1	ZINC000450536651	EF	On-Demand	Anodyne	ETHR	53	34
C/C=C\COc1cccc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)c1	ZINC000450536657	FE	On-Demand	Anodyne	CPT1A	74	46
C/C=C/COc1cccc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)c1	ZINC000450536658	FE	On-Demand	Anodyne	CPT1A	74	46
C/C=C\COc1cccc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)c1	ZINC000450536659	FE	On-Demand	Anodyne	CPT1A	74	46
C/C=C/COc1cccc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)c1	ZINC000450536661	FE	On-Demand	Anodyne	CPT1A	74	46
O=C(O)c1cccc(CC(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536668	FC	On-Demand	Anodyne	TRY2_BOVIN	55	33
O=C(O)c1cccc(CC(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536668	FC	On-Demand	Anodyne	ST14	83	35
O=C(O)c1cccc(CC(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536668	FC	On-Demand	Anodyne	AKR1C3	48	38
O=C(O)c1cccc(CC(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536668	FC	On-Demand	Anodyne	SFRP1	50	33
O=C(O)c1cccc(CC(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536668	FC	On-Demand	Anodyne	TMPRSS6	50	32
O=C(O)c1cccc(CC(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536669	FC	On-Demand	Anodyne	TRY2_BOVIN	55	33
O=C(O)c1cccc(CC(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536669	FC	On-Demand	Anodyne	ST14	83	35
O=C(O)c1cccc(CC(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536669	FC	On-Demand	Anodyne	AKR1C3	48	38
O=C(O)c1cccc(CC(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536669	FC	On-Demand	Anodyne	SFRP1	50	33
O=C(O)c1cccc(CC(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450536669	FC	On-Demand	Anodyne	TMPRSS6	50	32
O=C(O)c1ccccc1CC(=O)N1CC[C@H](S(=O)(=O)N2CCCC2)C1	ZINC000450536684	FC	On-Demand	Anodyne	SLC6A1	54	33
O=C(O)c1ccccc1CC(=O)N1CC[C@@H](S(=O)(=O)N2CCCC2)C1	ZINC000450536685	FC	On-Demand	Anodyne	SLC6A1	54	33
Cc1cccc(C)c1[C@@H](C)NC(=O)c1ccc(C(=O)O)o1	ZINC000450536709	CG	On-Demand	Anodyne	S1PR4	23	43
Cc1cccc(C)c1[C@H](C)NC(=O)c1ccc(C(=O)O)o1	ZINC000450536710	CG	On-Demand	Anodyne	S1PR4	23	43
COCC(C)(C)CNc1ncnc2[nH]c3ccccc3c12	ZINC000450536720	CG	On-Demand	Anodyne	UTS2R	31	47
O=C(c1cnn(-c2ccncc2)c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450536722	FF	On-Demand	Anodyne	TBXAS1	25	40
Cc1ccc(CN(CCO)C(=O)CCc2ccc(C(N)=O)cc2)cc1	ZINC000450536724	EE	On-Demand	Anodyne	PLM2_PLAFA	51	36
CNc1nc(N2CCC[C@@H](CSC)C2)nc2ccccc12	ZINC000450536727	DF	On-Demand	Anodyne	HRH4	21	50
CNc1nc(N2CCC[C@H](CSC)C2)nc2ccccc12	ZINC000450536728	DF	On-Demand	Anodyne	HRH4	21	50
CCCN(CC(N)=O)c1ncnc2cc(Br)ccc12	ZINC000450536729	DE	On-Demand	Anodyne	EGFR	42	35
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450536737	FI	On-Demand	Anodyne	LUXR	46	37
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450536738	FI	On-Demand	Anodyne	LUXR	46	37
Brc1ccc2c(N3CCOC[C@H](C4CCC4)C3)ncnc2c1	ZINC000450536752	FH	On-Demand	Anodyne	PDE3A	44	33
Brc1ccc2c(N3CCOC[C@H](C4CCC4)C3)ncnc2c1	ZINC000450536752	FH	On-Demand	Anodyne	PDE3B	66	33
Brc1ccc2c(N3CCOC[C@@H](C4CCC4)C3)ncnc2c1	ZINC000450536753	FH	On-Demand	Anodyne	PDE3A	44	33
Brc1ccc2c(N3CCOC[C@@H](C4CCC4)C3)ncnc2c1	ZINC000450536753	FH	On-Demand	Anodyne	PDE3B	66	33
CCCN(CC(N)=O)c1nc2cc(C)cc(C)c2o1	ZINC000450536760	CE	On-Demand	Anodyne	CETP	0	40
FC(F)c1cnc(N2CCC3(CCN(Cc4ccccc4)CC3)C2)nc1	ZINC000450536762	FH	On-Demand	Anodyne	SIGMAR1	38	40
Cc1ccc(C2CCN(C(=O)c3cccc(C(F)(F)F)n3)CC2)cn1	ZINC000450536787	EH	On-Demand	Anodyne	RBP4	37	42
Cc1ccc(C2CCN(C(=O)c3cccc(C(F)(F)F)n3)CC2)cn1	ZINC000450536787	EH	On-Demand	Anodyne	SFRP1	46	36
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450536807	CF	On-Demand	Anodyne	SORT1	16	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450536808	CF	On-Demand	Anodyne	SORT1	16	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450536809	CF	On-Demand	Anodyne	SORT1	16	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)C[C@H](C)O	ZINC000450536810	CF	On-Demand	Anodyne	SORT1	16	43
CC(=O)c1ccc(NC(=O)C(C)(C)C2CCC2)cc1Cl	ZINC000450536811	CI	On-Demand	Anodyne	NPY2R	43	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2nnc(C(C)C)o2)C1	ZINC000450536812	DF	On-Demand	Anodyne	ADRA1D	19	43
COC(=O)[C@@]1(c2ccccc2)CCN(c2nnc(C(C)C)o2)C1	ZINC000450536812	DF	On-Demand	Anodyne	ADRA1A	20	43
COC(=O)[C@@]1(c2ccccc2)CCN(c2nnc(C(C)C)o2)C1	ZINC000450536812	DF	On-Demand	Anodyne	ADRA1B	15	43
COC(=O)[C@@]1(c2ccccc2)CCN(c2nnc(C(C)C)o2)C1	ZINC000450536812	DF	On-Demand	Anodyne	KCNA3	17	43
COC(=O)[C@]1(c2ccccc2)CCN(c2nnc(C(C)C)o2)C1	ZINC000450536813	DF	On-Demand	Anodyne	ADRA1D	19	43
COC(=O)[C@]1(c2ccccc2)CCN(c2nnc(C(C)C)o2)C1	ZINC000450536813	DF	On-Demand	Anodyne	ADRA1A	20	43
COC(=O)[C@]1(c2ccccc2)CCN(c2nnc(C(C)C)o2)C1	ZINC000450536813	DF	On-Demand	Anodyne	ADRA1B	15	43
COC(=O)[C@]1(c2ccccc2)CCN(c2nnc(C(C)C)o2)C1	ZINC000450536813	DF	On-Demand	Anodyne	KCNA3	17	43
CC(=O)c1ccc(NC(=O)CC2CC(F)(F)C2)cc1Cl	ZINC000450536814	DH	On-Demand	Anodyne	ENV	45	36
COC(=O)CN1CCC[C@@H](CN=c2cc(C)[nH]c(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000450536815	GE	On-Demand	Bother	CHEK2	21	40
COC(=O)CN1CCC[C@H](CN=c2cc(C)[nH]c(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000450536816	GE	On-Demand	Bother	CHEK2	21	40
O=C(O)[C@@H]1CC[C@@H]1C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450536824	DE	On-Demand	Anodyne	PRCP	45	33
O=C(O)[C@@H]1CC[C@H]1C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450536825	DE	On-Demand	Anodyne	PRCP	45	33
O=C(O)[C@@H]1CC[C@H]1C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450536826	DE	On-Demand	Anodyne	PRCP	45	33
O=C(O)[C@@H]1CC[C@@H]1C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450536827	DE	On-Demand	Anodyne	PRCP	45	33
C[C@H](O)C[C@@H](C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450536831	DF	On-Demand	Anodyne	ROCK2	29	42
C[C@@H](C[C@@H](C)O)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450536832	DF	On-Demand	Anodyne	ROCK2	29	42
C[C@H](O)C[C@H](C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450536833	DF	On-Demand	Anodyne	ROCK2	29	42
C[C@@H](O)C[C@@H](C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450536834	DF	On-Demand	Anodyne	ROCK2	29	42
CC(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1Cl	ZINC000450536835	DH	On-Demand	Anodyne	TYK2	49	36
CC(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1Cl	ZINC000450536835	DH	On-Demand	Anodyne	NR2E3	56	41
COC(=O)CN1CCC[C@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536850	EE	On-Demand	Anodyne	EGFR	25	40
COC(=O)CN1CCC[C@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536850	EE	On-Demand	Anodyne	HRP1_PLAFA	56	39
COC(=O)CN1CCC[C@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536850	EE	On-Demand	Anodyne	FLT1	21	43
COC(=O)CN1CCC[C@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536850	EE	On-Demand	Anodyne	HNMT	52	36
COC(=O)CN1CCC[C@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536850	EE	On-Demand	Anodyne	ERBB4	42	33
COC(=O)CN1CCC[C@@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536851	EE	On-Demand	Anodyne	EGFR	25	40
COC(=O)CN1CCC[C@@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536851	EE	On-Demand	Anodyne	HRP1_PLAFA	56	39
COC(=O)CN1CCC[C@@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536851	EE	On-Demand	Anodyne	FLT1	21	43
COC(=O)CN1CCC[C@@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536851	EE	On-Demand	Anodyne	HNMT	52	36
COC(=O)CN1CCC[C@@H](CNc2ncnc3cc(Cl)ccc23)C1	ZINC000450536851	EE	On-Demand	Anodyne	ERBB4	42	33
Cc1ccc(F)c(CC(=O)NCc2cn(C)nc2C)c1	ZINC000450536853	CE	On-Demand	Anodyne	P2RX7	73	47
COC(=O)[C@@]1(c2ccccc2)CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450536858	FF	On-Demand	Mild	ADRA1A	27	40
COC(=O)[C@]1(c2ccccc2)CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450536859	FF	On-Demand	Mild	ADRA1A	27	40
Cc1nn(C)cc1CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450536864	CD	On-Demand	Anodyne	MMP13	15	40
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450536874	GG	On-Demand	Anodyne	ACHE	18	42
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450536874	GG	On-Demand	Anodyne	P2RY12	53	37
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450536874	GG	On-Demand	Anodyne	CCR8	42	32
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450536875	GG	On-Demand	Anodyne	ACHE	18	42
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450536875	GG	On-Demand	Anodyne	P2RY12	53	37
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450536875	GG	On-Demand	Anodyne	CCR8	42	32
Cc1ccc(CN(CCO)C(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450536898	EG	On-Demand	Anodyne	LIMK2	23	42
O=C(c1ccc2c(c1)OC(F)(F)O2)N1CCC(CCCn2ccnc2)CC1	ZINC000450536904	GH	On-Demand	Anodyne	TBXAS1	42	42
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536917	FH	On-Demand	Anodyne	GRIN2B	21	43
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536917	FH	On-Demand	Anodyne	PTGER4	42	36
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536917	FH	On-Demand	Anodyne	PRKCD	0	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536917	FH	On-Demand	Anodyne	PRKCE	15	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536917	FH	On-Demand	Anodyne	PRKCA	32	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536917	FH	On-Demand	Anodyne	PRKACA	24	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536917	FH	On-Demand	Anodyne	KLK5	40	38
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536918	FH	On-Demand	Anodyne	GRIN2B	21	43
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536918	FH	On-Demand	Anodyne	PTGER4	42	36
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536918	FH	On-Demand	Anodyne	PRKCD	0	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536918	FH	On-Demand	Anodyne	PRKCE	15	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536918	FH	On-Demand	Anodyne	PRKCA	32	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536918	FH	On-Demand	Anodyne	PRKACA	24	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450536918	FH	On-Demand	Anodyne	KLK5	40	38
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536919	FH	On-Demand	Anodyne	GRIN2B	21	43
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536919	FH	On-Demand	Anodyne	PTGER4	42	36
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536919	FH	On-Demand	Anodyne	PRKCD	0	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536919	FH	On-Demand	Anodyne	PRKCE	15	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536919	FH	On-Demand	Anodyne	PRKCA	32	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536919	FH	On-Demand	Anodyne	PRKACA	24	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536919	FH	On-Demand	Anodyne	KLK5	40	38
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536920	FH	On-Demand	Anodyne	GRIN2B	21	43
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536920	FH	On-Demand	Anodyne	PTGER4	42	36
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536920	FH	On-Demand	Anodyne	PRKCD	0	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536920	FH	On-Demand	Anodyne	PRKCE	15	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536920	FH	On-Demand	Anodyne	PRKCA	32	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536920	FH	On-Demand	Anodyne	PRKACA	24	46
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450536920	FH	On-Demand	Anodyne	KLK5	40	38
CN(C)c1nc(NC[C@H](N2CCOCC2)C(F)(F)F)nc2ccccc12	ZINC000450536931	FD	On-Demand	Anodyne	ADRA2A	16	43
CN(C)c1nc(NC[C@@H](N2CCOCC2)C(F)(F)F)nc2ccccc12	ZINC000450536936	FD	On-Demand	Anodyne	ADRA2A	16	43
CC(C)c1nnc(CCNc2ncnc3[nH]c4ccccc4c23)s1	ZINC000450536940	EH	On-Demand	Anodyne	UTS2R	31	45
CC[C@]1(C)C[C@H]1C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450536942	DF	On-Demand	Anodyne	CACNA1G	24	40
CC[C@]1(C)C[C@@H]1C(=O)NC[C@@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450536943	DF	On-Demand	Anodyne	CACNA1G	24	40
CC[C@]1(C)C[C@H]1C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450536944	DF	On-Demand	Anodyne	CACNA1G	24	40
CC[C@]1(C)C[C@@H]1C(=O)NC[C@](C)(C(=O)O)c1ccc(F)cc1	ZINC000450536945	DF	On-Demand	Anodyne	CACNA1G	24	40
C[C@H]1CN(C)[C@H](C)CN1C(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450536952	DG	On-Demand	Anodyne	SLC6A1	24	40
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)[C@H](C)CN1C	ZINC000450536955	DG	On-Demand	Anodyne	SLC6A1	24	40
C[C@H]1CN(C)[C@H](C)CN1C(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450536956	DG	On-Demand	Anodyne	SLC6A1	24	40
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)[C@H](C)CN1C	ZINC000450536957	DG	On-Demand	Anodyne	SLC6A1	24	40
O=C(O)CC1(NC(=O)Cc2ccc(Cl)c(F)c2)CCCC1	ZINC000450536960	DF	On-Demand	Anodyne	ENV	41	32
O=C(O)CC1(NC(=O)Cc2ccc(Cl)c(F)c2)CCCC1	ZINC000450536960	DF	On-Demand	Anodyne	PFK	0	40
Cc1ccnc(OC2CCN(C(=O)Cc3ccc(OC(F)F)c(F)c3)CC2)c1	ZINC000450536968	GH	On-Demand	Anodyne	GPR119	27	43
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2cc3ccccc3c(O)n2)CC1	ZINC000450536974	GG	On-Demand	Anodyne	ACACB	15	40
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2cc3ccccc3c(O)n2)CC1	ZINC000450536974	GG	On-Demand	Anodyne	CCR8	51	37
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc(C#N)n1C	ZINC000450536979	FD	On-Demand	Mild	LRRK2	17	46
CCC[C@@H](C)C(=O)NCCNc1ncnc2cc(Br)ccc12	ZINC000450536983	FF	On-Demand	Anodyne	EGFR	89	39
CCC[C@H](C)C(=O)NCCNc1ncnc2cc(Br)ccc12	ZINC000450536984	FF	On-Demand	Anodyne	EGFR	89	39
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450536994	ED	On-Demand	Anodyne	CNR2	23	42
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450536994	ED	On-Demand	Anodyne	HRH3	23	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450536994	ED	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450536994	ED	On-Demand	Anodyne	L3MBTL3	75	37
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450536996	ED	On-Demand	Anodyne	CNR2	23	42
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450536996	ED	On-Demand	Anodyne	HRH3	23	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450536996	ED	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450536996	ED	On-Demand	Anodyne	L3MBTL3	75	37
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)c1	ZINC000450536999	FH	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)c1	ZINC000450536999	FH	On-Demand	Anodyne	HCRTR2	0	41
CC(C)OCCCCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450537001	FI	On-Demand	Anodyne	AVPR1B	55	40
CC(C)OCCCCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450537001	FI	On-Demand	Anodyne	PDE6D	99	39
CC(C)OCCCCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450537001	FI	On-Demand	Anodyne	IMDH_CRYPV	38	52
CCN1C(=O)C[C@H](C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)[C@H]1c1cccnc1	ZINC000450537007	FE	On-Demand	Bother	NAMPT	28	41
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	PPARG	15	43
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	PPARA	25	43
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	PDE4A	51	54
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	HCRTR1	16	42
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	TRPV1	35	45
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	MMP13	0	42
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	PDE4B	34	54
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	PDE4D	42	54
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	UTS2R	21	42
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	PPARD	24	43
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	PDE4C	22	45
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	MT-ND1	27	47
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	MBTPS1	44	34
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	PDEC	0	46
COc1cc(CNC(=O)Cc2ccc(C(=O)O)cc2)ccc1OC1CCCC1	ZINC000450537010	GH	On-Demand	Anodyne	ACKR3	44	34
O=C(c1cc2cccnc2s1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537011	FH	On-Demand	Anodyne	TBXAS1	41	41
O=C(c1cc2cccnc2s1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537011	FH	On-Demand	Anodyne	HMOX2	47	34
CNC(=O)[C@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450537023	DD	On-Demand	Anodyne	EGFR	59	42
CC(C)(C)C(C)(C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450537030	DG	On-Demand	Bother	TBXA2R	28	42
CSc1cccc(C(=O)NCCCCOC(C)C)c1	ZINC000450537031	CG	On-Demand	Anodyne	DRD4	41	31
O=C(c1ocnc1-c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537050	FH	On-Demand	Anodyne	TBXAS1	38	40
COc1ccc(CC(=O)N(CCO)Cc2ccc(C)cc2)c(Cl)c1OC	ZINC000450537051	GG	On-Demand	Anodyne	PDE6A	40	30
Cc1ccc(C(=O)NCc2cn(C)nc2C)c(Cl)c1Cl	ZINC000450537087	DG	On-Demand	Anodyne	P2RX7	43	36
CC(=O)c1ccc(NC(=O)[C@H]2CC23CCSCC3)cc1Cl	ZINC000450537088	DI	On-Demand	Anodyne	ENV	41	33
CC(=O)c1ccc(NC(=O)[C@@H]2CC23CCSCC3)cc1Cl	ZINC000450537089	DI	On-Demand	Anodyne	ENV	41	33
COC(=O)CN1CCC[C@@H](CNc2ccnc(-c3ccccc3)n2)C1	ZINC000450537091	ED	On-Demand	Anodyne	VCP	47	34
COC(=O)CN1CCC[C@H](CNc2ccnc(-c3ccccc3)n2)C1	ZINC000450537092	ED	On-Demand	Anodyne	VCP	47	34
COC(=O)[C@@H]1CCO[C@H]1C1CCN(c2nccc3c(OC)cccc23)CC1	ZINC000450537094	FG	On-Demand	Anodyne	PDE3A	41	33
COC(=O)[C@@H]1CCO[C@H]1C1CCN(c2nccc3c(OC)cccc23)CC1	ZINC000450537094	FG	On-Demand	Anodyne	PDE3B	61	35
COC(=O)CN1CCC[C@@H](CNc2ncc([N+](=O)[O-])cn2)C1	ZINC000450537095	DC	On-Demand	Bother	PRKCQ	40	32
COC(=O)CN1CCC[C@H](CNc2ncc([N+](=O)[O-])cn2)C1	ZINC000450537096	DC	On-Demand	Bother	PRKCQ	40	32
CCC[C@H](CC(C)C)C(=O)N1CCC(c2ccc(C)nc2)CC1	ZINC000450537100	DJ	On-Demand	Anodyne	CCR1	41	41
CCC[C@@H](CC(C)C)C(=O)N1CCC(c2ccc(C)nc2)CC1	ZINC000450537101	DJ	On-Demand	Anodyne	CCR1	41	41
Cc1nn(C)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450537133	CD	On-Demand	Anodyne	P2RX7	42	37
Cc1nn(C)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450537133	CD	On-Demand	Anodyne	EPHX2	20	41
Cc1nn(C)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450537134	CD	On-Demand	Anodyne	P2RX7	42	37
Cc1nn(C)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450537134	CD	On-Demand	Anodyne	EPHX2	20	41
CCc1oc(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)cc1C(=O)O	ZINC000450537136	GI	On-Demand	Anodyne	GRM4	23	40
C[C@H](O)C[C@H](C)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450537150	CF	On-Demand	Anodyne	SCN9A	0	43
C[C@H](O)C[C@H](C)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450537151	CF	On-Demand	Anodyne	SCN9A	0	43
C[C@H](O)C[C@H](C)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450537152	CF	On-Demand	Anodyne	SCN9A	0	43
C[C@H](O)C[C@H](C)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450537153	CF	On-Demand	Anodyne	SCN9A	0	43
COC(=O)CN1CCC[C@H](CNc2ncnc3c2ncn3C2CC2)C1	ZINC000450537154	ED	On-Demand	Anodyne	ADORA1	43	37
COC(=O)CN1CCC[C@H](CNc2ncnc3c2ncn3C2CC2)C1	ZINC000450537154	ED	On-Demand	Anodyne	ADORA3	54	35
COC(=O)CN1CCC[C@@H](CNc2ncnc3c2ncn3C2CC2)C1	ZINC000450537155	ED	On-Demand	Anodyne	ADORA1	43	37
COC(=O)CN1CCC[C@@H](CNc2ncnc3c2ncn3C2CC2)C1	ZINC000450537155	ED	On-Demand	Anodyne	ADORA3	54	35
C[C@@H](O)C[C@@H](C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450537158	DD	On-Demand	Anodyne	CA2	22	41
C[C@H](O)C[C@@H](C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450537159	DD	On-Demand	Anodyne	CA2	22	41
C[C@H](O)C[C@H](C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450537160	DD	On-Demand	Anodyne	CA2	22	41
C[C@@H](C[C@@H](C)O)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450537161	DD	On-Demand	Anodyne	CA2	22	41
Brc1ccc2c(N3CC[C@@H](n4cccn4)C3)ncnc2c1	ZINC000450537162	EG	On-Demand	Anodyne	PDE3A	52	40
Brc1ccc2c(N3CC[C@H](n4cccn4)C3)ncnc2c1	ZINC000450537163	EG	On-Demand	Anodyne	PDE3A	52	40
C[C@@H](O)C[C@@H](C)NC(=O)c1ccc2cnccc2c1	ZINC000450537165	CE	On-Demand	Anodyne	AKT1	26	48
C[C@H](O)C[C@@H](C)NC(=O)c1ccc2cnccc2c1	ZINC000450537166	CE	On-Demand	Anodyne	AKT1	26	48
Cc1nc(Oc2ccc(OCC3CC3)c(Cl)c2)ncc1[N+](=O)[O-]	ZINC000450537176	EH	On-Demand	Bother	S1PR4	23	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450537179	GG	On-Demand	Anodyne	BTK	40	36
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450537179	GG	On-Demand	Anodyne	LRRK2	16	43
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450537182	GG	On-Demand	Anodyne	BTK	40	36
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450537182	GG	On-Demand	Anodyne	LRRK2	16	43
COc1ccc(-c2noc(NCc3cc(C)nc(N4CCCC4)n3)n2)cc1	ZINC000450537188	FE	On-Demand	Anodyne	GALR2	41	37
CC[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@@H](C)S1(=O)=O	ZINC000450537207	FE	On-Demand	Anodyne	S1PR4	21	42
CC[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@@H](C)S1(=O)=O	ZINC000450537207	FE	On-Demand	Anodyne	S1PR1	19	45
CC[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@@H](C)S1(=O)=O	ZINC000450537207	FE	On-Demand	Anodyne	S1PR5	35	41
CC[C@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H](C)S1(=O)=O	ZINC000450537208	FE	On-Demand	Anodyne	S1PR4	21	42
CC[C@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H](C)S1(=O)=O	ZINC000450537208	FE	On-Demand	Anodyne	S1PR1	19	45
CC[C@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H](C)S1(=O)=O	ZINC000450537208	FE	On-Demand	Anodyne	S1PR5	35	41
CC[C@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@@H](C)S1(=O)=O	ZINC000450537209	FE	On-Demand	Anodyne	S1PR4	21	42
CC[C@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@@H](C)S1(=O)=O	ZINC000450537209	FE	On-Demand	Anodyne	S1PR1	19	45
CC[C@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@@H](C)S1(=O)=O	ZINC000450537209	FE	On-Demand	Anodyne	S1PR5	35	41
CC[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H](C)S1(=O)=O	ZINC000450537211	FE	On-Demand	Anodyne	S1PR4	21	42
CC[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H](C)S1(=O)=O	ZINC000450537211	FE	On-Demand	Anodyne	S1PR1	19	45
CC[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H](C)S1(=O)=O	ZINC000450537211	FE	On-Demand	Anodyne	S1PR5	35	41
Cc1ccnc(OC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)c1	ZINC000450537214	FE	On-Demand	Anodyne	PRSS2	63	36
O=C(c1cc2ccncc2s1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537215	FH	On-Demand	Anodyne	TBXAS1	36	42
O=C(c1cc2ccncc2s1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537215	FH	On-Demand	Anodyne	HMOX2	48	34
CCOc1cc(C(=O)N[C@@H](C)c2c(C)cccc2C)ccc1OCC(=O)O	ZINC000450537232	FH	On-Demand	Anodyne	PPARD	43	38
CCOc1cc(C(=O)N[C@H](C)c2c(C)cccc2C)ccc1OCC(=O)O	ZINC000450537233	FH	On-Demand	Anodyne	PPARD	43	38
Cc1c(C(=O)Nc2cccc(-c3cnn[nH]3)c2)nnn1C(C)C	ZINC000450537239	DE	On-Demand	Anodyne	KCNK3	53	32
CS(=O)(=O)C[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450537267	FG	On-Demand	Anodyne	LIPG	49	35
CS(=O)(=O)C[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450537268	FG	On-Demand	Anodyne	LIPG	49	35
CC(C)OCCCCNC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450537271	DG	On-Demand	Anodyne	TPP2	36	41
CC(C)OCCCCNC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450537272	DG	On-Demand	Anodyne	TPP2	36	41
CC(F)(F)C(C)(C)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450537280	EH	On-Demand	Anodyne	TBXAS1	34	44
Cn1cc(CNC(=O)c2nn(C)c3c2CCCC3)c(-c2ccccc2)n1	ZINC000450537285	EF	On-Demand	Anodyne	FABP4	43	34
COC[C@]1(C(=O)O)CCCN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450537287	GG	On-Demand	Anodyne	SLC12A5	40	42
COC[C@@]1(C(=O)O)CCCN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450537289	GG	On-Demand	Anodyne	SLC12A5	40	42
Cc1ccc(CN(CCO)C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1	ZINC000450537294	GF	On-Demand	Anodyne	PLM2_PLAFA	42	43
COc1ccc(-c2ccnc(NCc3cc(C)nc(N4CCCC4)n3)n2)cc1	ZINC000450537295	GG	On-Demand	Anodyne	GALR2	41	37
COc1ccc(-c2ccnc(NCc3cc(C)nc(N4CCCC4)n3)n2)cc1	ZINC000450537295	GG	On-Demand	Anodyne	CLK4	28	52
COc1ccc(-c2ccnc(NCc3cc(C)nc(N4CCCC4)n3)n2)cc1	ZINC000450537295	GG	On-Demand	Anodyne	DYRK1B	21	52
CCCN(CC(N)=O)c1ncnc2[nH]c3ccccc3c12	ZINC000450537296	CD	On-Demand	Anodyne	TSPO	30	40
CCCN(CC(N)=O)c1ncnc2[nH]c3ccccc3c12	ZINC000450537296	CD	On-Demand	Anodyne	TUBB3	31	41
CCCN(CC(N)=O)c1ncnc2[nH]c3ccccc3c12	ZINC000450537296	CD	On-Demand	Anodyne	UTS2R	21	44
Cc1ccnc(OC2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)CC2)c1	ZINC000450537299	EF	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)CC2)c1	ZINC000450537299	EF	On-Demand	Anodyne	HCRTR2	0	43
CCOC(=O)c1csc(N2CCCN(c3ccccc3F)CC2)n1	ZINC000450537302	EG	On-Demand	Anodyne	KCNQ2	41	36
CS(=O)(=O)CC1CCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450537304	FH	On-Demand	Anodyne	LIPG	40	34
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2ccc(C(=O)OC)cc2)CC1	ZINC000450537325	GF	On-Demand	Anodyne	CCR8	51	39
Cc1ccc(CN(CCO)C(=O)Cc2cn(C)nc2C)cc1	ZINC000450537329	DD	On-Demand	Anodyne	PLA2G7	54	38
Cc1cc(Cl)ccc1S(=O)(=O)NCCNc1ncc([N+](=O)[O-])c(C)n1	ZINC000450537331	GD	On-Demand	Bother	PRKCQ	41	38
COc1cccc2c(N3CCC[C@@H](CS(C)(=O)=O)C3)nccc12	ZINC000450537332	EF	On-Demand	Anodyne	PDE3A	44	34
COc1cccc2c(N3CCC[C@@H](CS(C)(=O)=O)C3)nccc12	ZINC000450537332	EF	On-Demand	Anodyne	PDE3B	65	34
COc1cccc2c(N3CCC[C@H](CS(C)(=O)=O)C3)nccc12	ZINC000450537333	EF	On-Demand	Anodyne	PDE3A	44	34
COc1cccc2c(N3CCC[C@H](CS(C)(=O)=O)C3)nccc12	ZINC000450537333	EF	On-Demand	Anodyne	PDE3B	65	34
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537345	FG	On-Demand	Anodyne	TBXAS1	45	42
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537349	FG	On-Demand	Anodyne	TBXAS1	45	42
CC(C)OCCCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450537362	DG	On-Demand	Anodyne	P2RY12	104	36
CC(C)OCCCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450537362	DG	On-Demand	Anodyne	FOLH1	40	34
CC(C)OCCCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450537362	DG	On-Demand	Anodyne	CTSV	47	33
CC(C)OCCCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450537362	DG	On-Demand	Anodyne	AGER	0	41
C[C@H](O)C[C@H](C)NC(=O)c1ccc2cnccc2c1	ZINC000450537366	CE	On-Demand	Anodyne	AKT1	26	48
C[C@@H](C[C@@H](C)O)NC(=O)c1ccc2cnccc2c1	ZINC000450537367	CE	On-Demand	Anodyne	AKT1	26	48
CCOCc1nc(C)c(C(=O)Nc2ccc(C(C)=O)c(Cl)c2)s1	ZINC000450537368	FI	On-Demand	Anodyne	DHODH	19	43
COC(=O)c1ccc(CC(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537383	CD	On-Demand	Anodyne	MMP7	21	40
COC(=O)c1ccc(CC(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537384	CD	On-Demand	Anodyne	MMP7	21	40
COC(=O)c1ccc(CC(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537385	CD	On-Demand	Anodyne	MMP7	21	40
COC(=O)c1ccc(CC(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537386	CD	On-Demand	Anodyne	MMP7	21	40
O=C(O)c1ccc(CC(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450537395	EG	On-Demand	Anodyne	ETHR	49	37
O=C(O)c1ccc(CC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450537396	EG	On-Demand	Anodyne	ETHR	49	37
CCCOc1cc(C)ccc1CNC(=O)c1ccccc1S[C@@H](C)C(=O)O	ZINC000450537397	GI	On-Demand	Anodyne	PPARA	22	42
CCCOc1cc(C)ccc1CNC(=O)c1ccccc1S[C@@H](C)C(=O)O	ZINC000450537397	GI	On-Demand	Anodyne	PPARD	27	42
CCCOc1cc(C)ccc1CNC(=O)c1ccccc1S[C@H](C)C(=O)O	ZINC000450537398	GI	On-Demand	Anodyne	PPARA	22	42
CCCOc1cc(C)ccc1CNC(=O)c1ccccc1S[C@H](C)C(=O)O	ZINC000450537398	GI	On-Demand	Anodyne	PPARD	27	42
N#Cc1cnc(NC[C@H]2CCN(c3ccccc3F)C2)c([N+](=O)[O-])c1	ZINC000450537399	EF	On-Demand	Mild	PRKCQ	52	44
N#Cc1cnc(NC[C@@H]2CCN(c3ccccc3F)C2)c([N+](=O)[O-])c1	ZINC000450537400	EF	On-Demand	Mild	PRKCQ	52	44
COC(=O)CN1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1	ZINC000450537402	GD	On-Demand	Bother	TBXA2R	25	40
COC(=O)CN1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1	ZINC000450537403	GD	On-Demand	Bother	TBXA2R	25	40
Cc1ccc(C2CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC2)cn1	ZINC000450537404	FH	On-Demand	Anodyne	CCR1	45	52
Cc1ccc(C2CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC2)cn1	ZINC000450537404	FH	On-Demand	Anodyne	RHODESAIN	0	43
COc1ccc(-c2noc(N3CC[C@H](Oc4ccc(C#N)cn4)C3)n2)cc1	ZINC000450537420	FF	On-Demand	Mild	PDE3A	42	43
COc1ccc(-c2noc(N3CC[C@H](Oc4ccc(C#N)cn4)C3)n2)cc1	ZINC000450537420	FF	On-Demand	Mild	PDE3B	65	43
COc1ccc(-c2noc(N3CC[C@@H](Oc4ccc(C#N)cn4)C3)n2)cc1	ZINC000450537421	FF	On-Demand	Mild	PDE3A	42	43
COc1ccc(-c2noc(N3CC[C@@H](Oc4ccc(C#N)cn4)C3)n2)cc1	ZINC000450537421	FF	On-Demand	Mild	PDE3B	65	43
Cc1ccc(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CC2)cn1	ZINC000450537436	FJ	On-Demand	Anodyne	PRCP	52	37
COc1cccc2c(N3CC[C@@H](n4cccn4)C3)nccc12	ZINC000450537452	CF	On-Demand	Anodyne	PDE3A	30	43
COc1cccc2c(N3CC[C@@H](n4cccn4)C3)nccc12	ZINC000450537452	CF	On-Demand	Anodyne	PDE3B	77	40
COc1cccc2c(N3CC[C@H](n4cccn4)C3)nccc12	ZINC000450537453	CF	On-Demand	Anodyne	PDE3A	30	43
COc1cccc2c(N3CC[C@H](n4cccn4)C3)nccc12	ZINC000450537453	CF	On-Demand	Anodyne	PDE3B	77	40
CCOC(=O)c1cc(C(=O)N2CCC(c3ccc(C)nc3)CC2)on1	ZINC000450537461	EF	On-Demand	Anodyne	GYRB	0	41
Cc1cc(C)c2oc(N(C)CCOc3ccc(S(N)(=O)=O)cc3)nc2c1	ZINC000450537469	GF	On-Demand	Anodyne	CA2	15	42
Cc1cc(C)c2oc(N(C)CCOc3ccc(S(N)(=O)=O)cc3)nc2c1	ZINC000450537469	GF	On-Demand	Anodyne	CA1	15	42
Cc1cc(C)c2oc(N(C)CCOc3ccc(S(N)(=O)=O)cc3)nc2c1	ZINC000450537469	GF	On-Demand	Anodyne	CA7	23	42
COc1cccc2c(N3CCC(CO)(c4ccccc4)CC3)nccc12	ZINC000450537476	EH	On-Demand	Anodyne	HTR1A	23	40
COc1cccc2c(N3CCC(CO)(c4ccccc4)CC3)nccc12	ZINC000450537476	EH	On-Demand	Anodyne	ADRA1D	20	40
COc1cccc2c(N3CCC(CO)(c4ccccc4)CC3)nccc12	ZINC000450537476	EH	On-Demand	Anodyne	ADRA1A	18	40
COc1cccc2c(N3CCC(CO)(c4ccccc4)CC3)nccc12	ZINC000450537476	EH	On-Demand	Anodyne	ADRA1B	19	40
COc1cccc2c(N3CCC(CO)(c4ccccc4)CC3)nccc12	ZINC000450537476	EH	On-Demand	Anodyne	SOAT1	15	40
COc1cccc2c(N3CCC(CO)(c4ccccc4)CC3)nccc12	ZINC000450537476	EH	On-Demand	Anodyne	SORD	21	42
CCOC(=O)c1cc(C(=O)N(CCO)Cc2ccc(C)cc2)on1	ZINC000450537485	ED	On-Demand	Anodyne	TSPO	15	40
CCOC(=O)c1cc(C(=O)N(CCO)Cc2ccc(C)cc2)on1	ZINC000450537485	ED	On-Demand	Anodyne	PLM2_PLAFA	43	33
C[C@H]1CN(C)[C@H](C)CN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450537486	EE	On-Demand	Anodyne	PTGER3	18	41
C[C@H]1CN(C)[C@H](C)CN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450537486	EE	On-Demand	Anodyne	CACNA1I	15	43
C[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H](C)CN1C	ZINC000450537491	EE	On-Demand	Anodyne	PTGER3	18	41
C[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H](C)CN1C	ZINC000450537491	EE	On-Demand	Anodyne	CACNA1I	15	43
C[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H](C)CN1C	ZINC000450537493	EE	On-Demand	Anodyne	PTGER3	18	41
C[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H](C)CN1C	ZINC000450537493	EE	On-Demand	Anodyne	CACNA1I	15	43
C[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H](C)CN1C	ZINC000450537495	EE	On-Demand	Anodyne	PTGER3	18	41
C[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H](C)CN1C	ZINC000450537495	EE	On-Demand	Anodyne	CACNA1I	15	43
CC(C)CCCC(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450537497	CG	On-Demand	Anodyne	HDAC10	45	42
CC(C)CCCC(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450537497	CG	On-Demand	Anodyne	HDAC3	46	46
CC(C)CCCC(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450537497	CG	On-Demand	Anodyne	HDAC6	42	44
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCCOC(C)C)cc2)c1	ZINC000450537504	GH	On-Demand	Anodyne	ANPEP	18	44
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCCOC(C)C)cc2)c1	ZINC000450537504	GH	On-Demand	Anodyne	PTAFR	16	48
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCCOC(C)C)cc2)c1	ZINC000450537504	GH	On-Demand	Anodyne	KCNK3	49	35
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCCOC(C)C)cc2)c1	ZINC000450537504	GH	On-Demand	Anodyne	KCNK9	40	35
CCC(=O)C1(C(=O)N2CCC(CCCn3ccnc3)CC2)CC1	ZINC000450537515	DF	On-Demand	Anodyne	TBXAS1	27	40
CC(C)N1C(=O)C[C@H](NC(=O)[C@H]2CC2(F)F)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450537517	FG	On-Demand	Anodyne	ENV	43	34
CC(C)N1C(=O)C[C@H](NC(=O)[C@H]2CC2(F)F)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450537521	FG	On-Demand	Anodyne	ENV	43	34
CC(C)N1C(=O)C[C@H](NC(=O)[C@@H]2CC2(F)F)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450537524	FG	On-Demand	Anodyne	ENV	43	34
CC(C)N1C(=O)C[C@H](NC(=O)[C@@H]2CC2(F)F)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450537526	FG	On-Demand	Anodyne	ENV	43	34
CCc1cc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)ccn1	ZINC000450537528	ED	On-Demand	Anodyne	CA7	31	50
CC1(C)CN(C(=O)c2cccc(OCC(=O)O)c2)C[C@@H]1c1ccccc1	ZINC000450537539	FG	On-Demand	Anodyne	FABP4	46	36
CC1(C)CN(C(=O)c2cccc(OCC(=O)O)c2)C[C@H]1c1ccccc1	ZINC000450537540	FG	On-Demand	Anodyne	FABP4	46	36
COc1cccc(OCCC(=O)NCCC2CCS(=O)(=O)CC2)c1	ZINC000450537567	FD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)NCCC2CCS(=O)(=O)CC2)c1	ZINC000450537567	FD	On-Demand	Anodyne	NQO2	29	42
COc1cccc(OCCC(=O)NCCC2CCS(=O)(=O)CC2)c1	ZINC000450537567	FD	On-Demand	Anodyne	MTNR1A	77	49
COc1cccc(OCCC(=O)NCCC2CCS(=O)(=O)CC2)c1	ZINC000450537567	FD	On-Demand	Anodyne	MTNR1B	68	49
CSc1cccc(C(=O)N(CCO)Cc2ccc(C)cc2)c1	ZINC000450537572	DG	On-Demand	Anodyne	PLM2_PLAFA	59	37
Cc1c(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)cccc1[N+](=O)[O-]	ZINC000450537589	DE	On-Demand	Bother	P2RX7	24	40
Cc1c(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)cccc1[N+](=O)[O-]	ZINC000450537589	DE	On-Demand	Bother	COLA	81	32
Cc1ccc(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C(F)(F)F)CC2)cn1	ZINC000450537610	GJ	On-Demand	Anodyne	RBP4	96	47
Cc1ccc(C2CCN(C(=O)c3ccc(C4CC4)nc3C)CC2)cn1	ZINC000450537615	EH	On-Demand	Anodyne	FASN	42	35
COc1cccc2c(N3C[C@H](C)S(=O)(=O)[C@@H](C)C3)nccc12	ZINC000450537631	DE	On-Demand	Anodyne	PDE3A	43	35
COc1cccc2c(N3C[C@H](C)S(=O)(=O)[C@@H](C)C3)nccc12	ZINC000450537631	DE	On-Demand	Anodyne	PDE3B	64	35
COc1cccc2c(N3C[C@H](C)S(=O)(=O)[C@H](C)C3)nccc12	ZINC000450537634	DE	On-Demand	Anodyne	PDE3A	43	35
COc1cccc2c(N3C[C@H](C)S(=O)(=O)[C@H](C)C3)nccc12	ZINC000450537634	DE	On-Demand	Anodyne	PDE3B	64	35
COc1cccc2c(N3C[C@@H](C)S(=O)(=O)[C@H](C)C3)nccc12	ZINC000450537636	DE	On-Demand	Anodyne	PDE3A	43	35
COc1cccc2c(N3C[C@@H](C)S(=O)(=O)[C@H](C)C3)nccc12	ZINC000450537636	DE	On-Demand	Anodyne	PDE3B	64	35
CC[C@@H]1C[C@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450537640	CF	On-Demand	Anodyne	TBXAS1	23	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	ANPEP	23	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	MMP13	24	51
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	CTSB	22	60
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	CTSK	24	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	CAPNS1	63	60
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	MMP2	38	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	MMP3	27	51
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	MMP8	18	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	MMP14	17	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	CAPN1	72	69
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	MMP9	26	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	CAPN2	68	62
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	MMP7	16	41
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450537666	FD	On-Demand	Anodyne	PSMB5	31	42
CC(C)OCCCCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450537667	EF	On-Demand	Bother	PTAFR	17	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	ANPEP	23	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	MMP13	24	51
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	CTSB	22	60
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	CTSK	24	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	CAPNS1	63	60
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	MMP2	38	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	MMP3	27	51
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	MMP8	18	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	MMP14	17	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	CAPN1	72	69
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	MMP9	26	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	CAPN2	68	62
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	MMP7	16	41
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450537668	FD	On-Demand	Anodyne	PSMB5	31	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	ANPEP	23	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	MMP13	24	51
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	CTSB	22	60
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	CTSK	24	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	CAPNS1	63	60
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	MMP2	38	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	MMP3	27	51
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	MMP8	18	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	MMP14	17	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	CAPN1	72	69
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	MMP9	26	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	CAPN2	68	62
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	MMP7	16	41
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450537669	FD	On-Demand	Anodyne	PSMB5	31	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	ANPEP	23	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	MMP13	24	51
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	CTSB	22	60
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	CTSK	24	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	CAPNS1	63	60
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	MMP2	38	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	MMP3	27	51
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	MMP8	18	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	MMP14	17	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	CAPN1	72	69
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	MMP9	26	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	CAPN2	68	62
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	MMP7	16	41
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450537670	FD	On-Demand	Anodyne	PSMB5	31	42
Cc1cccc(C)c1[C@@H](C)NC(=O)c1ccccc1S[C@@H](C)C(=O)O	ZINC000450537681	FI	On-Demand	Anodyne	DAC	45	34
Cc1cccc(C)c1[C@H](C)NC(=O)c1ccccc1S[C@@H](C)C(=O)O	ZINC000450537693	FI	On-Demand	Anodyne	DAC	45	34
Cc1cccc(C)c1[C@@H](C)NC(=O)c1ccccc1S[C@H](C)C(=O)O	ZINC000450537694	FI	On-Demand	Anodyne	DAC	45	34
Cc1cccc(C)c1[C@H](C)NC(=O)c1ccccc1S[C@H](C)C(=O)O	ZINC000450537695	FI	On-Demand	Anodyne	DAC	45	34
CCN(CC)C(=O)CCC1CCN(C(=O)C(C)(C)C2CCC2)CC1	ZINC000450537703	EH	On-Demand	Anodyne	GNAI3	0	40
CCc1cc(N2CCCN(S(=O)(=O)N(C)C)CC2)ccn1	ZINC000450537705	DC	On-Demand	Anodyne	SORD	16	47
CCCOc1ccc(C(=O)N2CCC(Oc3cc(C)ccn3)CC2)c(OC)c1	ZINC000450537709	GH	On-Demand	Anodyne	OXTR	39	44
CN(C)S(=O)(=O)N1CCCN(c2nccc3c([N+](=O)[O-])cccc23)CC1	ZINC000450537715	GD	On-Demand	Bother	SORD	18	40
C[C@H](CNc1ncnc2[nH]c3ccccc3c12)CN(C)C	ZINC000450537719	CF	On-Demand	Anodyne	UTS2R	23	46
C[C@@H](CNc1ncnc2[nH]c3ccccc3c12)CN(C)C	ZINC000450537720	CF	On-Demand	Anodyne	UTS2R	23	46
C[C@@H]1CC[C@@H](C(=O)NCc2cn(C)nc2-c2ccccc2)C[C@H]1C	ZINC000450537740	EH	On-Demand	Anodyne	P2RX7	44	40
C[C@@H]1CC[C@@H](C(=O)NCc2cn(C)nc2-c2ccccc2)C[C@H]1C	ZINC000450537740	EH	On-Demand	Anodyne	PDE8B	56	33
C[C@H]1C[C@H](C(=O)NCc2cn(C)nc2-c2ccccc2)CC[C@H]1C	ZINC000450537742	EH	On-Demand	Anodyne	P2RX7	44	40
C[C@H]1C[C@H](C(=O)NCc2cn(C)nc2-c2ccccc2)CC[C@H]1C	ZINC000450537742	EH	On-Demand	Anodyne	PDE8B	56	33
N#Cc1cccc(N2CCC[C@](CO)(Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450537743	FG	On-Demand	Mild	SLC12A5	50	37
N#Cc1cccc(N2CCC[C@@](CO)(Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450537744	FG	On-Demand	Mild	SLC12A5	50	37
C[C@@H]1CC[C@H](C(=O)NCc2cn(C)nc2-c2ccccc2)C[C@H]1C	ZINC000450537746	EH	On-Demand	Anodyne	P2RX7	44	40
C[C@@H]1CC[C@H](C(=O)NCc2cn(C)nc2-c2ccccc2)C[C@H]1C	ZINC000450537746	EH	On-Demand	Anodyne	PDE8B	56	33
C[C@H]1C[C@@H](C(=O)NCc2cn(C)nc2-c2ccccc2)CC[C@H]1C	ZINC000450537747	EH	On-Demand	Anodyne	P2RX7	44	40
C[C@H]1C[C@@H](C(=O)NCc2cn(C)nc2-c2ccccc2)CC[C@H]1C	ZINC000450537747	EH	On-Demand	Anodyne	PDE8B	56	33
CCC[C@H](Nc1ncnc2cc(Br)ccc12)C(N)=O	ZINC000450537748	DE	On-Demand	Anodyne	EGFR	57	41
CCC[C@H](Nc1ncnc2cc(Br)ccc12)C(N)=O	ZINC000450537748	DE	On-Demand	Anodyne	HTT	0	44
CC(=O)c1ccc(NC(=O)c2c(C3CC3)noc2C)cc1Cl	ZINC000450537753	DH	On-Demand	Anodyne	GHSR	0	41
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](C)C[C@H](C)O)c1	ZINC000450537764	DE	On-Demand	Anodyne	KCNK3	20	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](C)C[C@H](C)O)c1	ZINC000450537764	DE	On-Demand	Anodyne	KCNK9	25	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H](C)C[C@@H](C)O)c1	ZINC000450537765	DE	On-Demand	Anodyne	KCNK3	20	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H](C)C[C@@H](C)O)c1	ZINC000450537765	DE	On-Demand	Anodyne	KCNK9	25	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H](C)C[C@H](C)O)c1	ZINC000450537766	DE	On-Demand	Anodyne	KCNK3	20	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H](C)C[C@H](C)O)c1	ZINC000450537766	DE	On-Demand	Anodyne	KCNK9	25	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](C)C[C@@H](C)O)c1	ZINC000450537768	DE	On-Demand	Anodyne	KCNK3	20	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](C)C[C@@H](C)O)c1	ZINC000450537768	DE	On-Demand	Anodyne	KCNK9	25	40
COc1ccc(Oc2ccc(C(=O)N[C@H](C)C[C@@H](C)O)nc2)cc1	ZINC000450537774	EF	On-Demand	Anodyne	ACACA	32	40
COc1ccc(Oc2ccc(C(=O)N[C@H](C)C[C@@H](C)O)nc2)cc1	ZINC000450537774	EF	On-Demand	Anodyne	ACACB	42	42
COc1ccc(Oc2ccc(C(=O)N[C@H](C)C[C@H](C)O)nc2)cc1	ZINC000450537775	EF	On-Demand	Anodyne	ACACA	32	40
COc1ccc(Oc2ccc(C(=O)N[C@H](C)C[C@H](C)O)nc2)cc1	ZINC000450537775	EF	On-Demand	Anodyne	ACACB	42	42
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)C[C@@H](C)O)nc2)cc1	ZINC000450537777	EF	On-Demand	Anodyne	ACACA	32	40
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)C[C@@H](C)O)nc2)cc1	ZINC000450537777	EF	On-Demand	Anodyne	ACACB	42	42
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450537796	FG	On-Demand	Anodyne	ACHE	21	44
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450537796	FG	On-Demand	Anodyne	P2RY12	61	34
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450537796	FG	On-Demand	Anodyne	REN	29	40
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450537796	FG	On-Demand	Anodyne	ST14	54	33
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450537796	FG	On-Demand	Anodyne	AMP1_PLAFQ	16	43
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450537796	FG	On-Demand	Anodyne	TMPRSS6	45	31
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450537797	FG	On-Demand	Anodyne	ACHE	21	44
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450537797	FG	On-Demand	Anodyne	P2RY12	61	34
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450537797	FG	On-Demand	Anodyne	REN	29	40
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450537797	FG	On-Demand	Anodyne	ST14	54	33
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450537797	FG	On-Demand	Anodyne	AMP1_PLAFQ	16	43
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450537797	FG	On-Demand	Anodyne	TMPRSS6	45	31
Cc1ccnc(OC2CCN(C(=O)Cc3cc(F)c(C)cc3F)CC2)c1	ZINC000450537820	FH	On-Demand	Anodyne	HCRTR1	0	40
Cc1ccnc(OC2CCN(C(=O)Cc3cc(F)c(C)cc3F)CC2)c1	ZINC000450537820	FH	On-Demand	Anodyne	HCRTR2	0	40
Cc1ccnc(OC2CCN(C(=O)Cc3cc(F)c(C)cc3F)CC2)c1	ZINC000450537820	FH	On-Demand	Anodyne	GPR119	32	41
CC[C@@H]1CCC[C@@H]1C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450537821	DH	On-Demand	Anodyne	P2RX7	40	33
CC[C@@H]1CCC[C@H]1C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450537822	DH	On-Demand	Anodyne	P2RX7	40	33
CC[C@H]1CCC[C@H]1C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450537823	DH	On-Demand	Anodyne	P2RX7	40	33
CC[C@H]1CCC[C@@H]1C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000450537824	DH	On-Demand	Anodyne	P2RX7	41	37
Cc1nc(C)n(CCCC(=O)Nc2ncc(C3CCCCC3)s2)n1	ZINC000450537825	EH	On-Demand	Anodyne	CDK5	63	49
NC(=O)CCC1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450537826	EG	On-Demand	Anodyne	ST14	47	38
O=C(CCC(F)(F)F)N1CCC[C@@H](N=c2[nH]ccc3cc([N+](=O)[O-])ccc23)C1	ZINC000450537827	GG	On-Demand	Bother	ETHR	47	34
COc1cc(CNC(=O)[C@H]2C[C@@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450537838	EE	On-Demand	Anodyne	PDE4B	28	44
COc1cc(CNC(=O)[C@@H]2C[C@@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450537839	EE	On-Demand	Anodyne	PDE4B	28	44
COc1cc(CNC(=O)[C@H]2C[C@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450537840	EE	On-Demand	Anodyne	PDE4B	28	44
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)C[C@H](C)O)nc2)cc1	ZINC000450537841	EF	On-Demand	Anodyne	ACACA	32	40
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)C[C@H](C)O)nc2)cc1	ZINC000450537841	EF	On-Demand	Anodyne	ACACB	42	42
COc1cccc2c(N3CCC[C@@](CO)(Cc4ccccc4)C3)nccc12	ZINC000450537842	FI	On-Demand	Anodyne	SLC12A5	42	32
COc1cccc2c(N3CCC[C@](CO)(Cc4ccccc4)C3)nccc12	ZINC000450537843	FI	On-Demand	Anodyne	SLC12A5	42	32
O=C(O)[C@@H]1CC[C@@H]1C(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450537844	FF	On-Demand	Anodyne	LIPG	50	36
O=C(O)[C@@H]1CC[C@H]1C(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450537845	FF	On-Demand	Anodyne	LIPG	50	36
O=C(O)[C@@H]1CC[C@H]1C(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450537846	FF	On-Demand	Anodyne	LIPG	50	36
O=C(O)[C@@H]1CC[C@@H]1C(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450537847	FF	On-Demand	Anodyne	LIPG	50	36
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537862	FG	On-Demand	Anodyne	SRD5A2	20	40
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537862	FG	On-Demand	Anodyne	SIGMAR1	23	44
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537862	FG	On-Demand	Anodyne	PRKCD	28	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537862	FG	On-Demand	Anodyne	PRKCE	21	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537862	FG	On-Demand	Anodyne	PRKCH	15	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537862	FG	On-Demand	Anodyne	PRKCA	44	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537862	FG	On-Demand	Anodyne	PRKACA	34	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537862	FG	On-Demand	Anodyne	KLK5	42	41
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537863	FG	On-Demand	Anodyne	SRD5A2	20	40
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537863	FG	On-Demand	Anodyne	SIGMAR1	23	44
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537863	FG	On-Demand	Anodyne	PRKCD	28	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537863	FG	On-Demand	Anodyne	PRKCE	21	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537863	FG	On-Demand	Anodyne	PRKCH	15	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537863	FG	On-Demand	Anodyne	PRKCA	44	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537863	FG	On-Demand	Anodyne	PRKACA	34	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450537863	FG	On-Demand	Anodyne	KLK5	42	41
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537864	FG	On-Demand	Anodyne	SRD5A2	20	40
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537864	FG	On-Demand	Anodyne	SIGMAR1	23	44
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537864	FG	On-Demand	Anodyne	PRKCD	28	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537864	FG	On-Demand	Anodyne	PRKCE	21	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537864	FG	On-Demand	Anodyne	PRKCH	15	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537864	FG	On-Demand	Anodyne	PRKCA	44	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537864	FG	On-Demand	Anodyne	PRKACA	34	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537864	FG	On-Demand	Anodyne	KLK5	42	41
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537865	FG	On-Demand	Anodyne	SRD5A2	20	40
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537865	FG	On-Demand	Anodyne	SIGMAR1	23	44
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537865	FG	On-Demand	Anodyne	PRKCD	28	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537865	FG	On-Demand	Anodyne	PRKCE	21	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537865	FG	On-Demand	Anodyne	PRKCH	15	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537865	FG	On-Demand	Anodyne	PRKCA	44	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537865	FG	On-Demand	Anodyne	PRKACA	34	49
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450537865	FG	On-Demand	Anodyne	KLK5	42	41
O=C(O)c1ccc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450537867	GH	On-Demand	Anodyne	SLC6A7	0	42
CCC[C@@H](C)C(=O)NCCNc1nccc2c([N+](=O)[O-])cccc12	ZINC000450537868	EG	On-Demand	Bother	COLA	52	31
CCC[C@H](C)C(=O)NCCNc1nccc2c([N+](=O)[O-])cccc12	ZINC000450537869	EG	On-Demand	Bother	COLA	52	31
O=C(O)c1ccc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450537870	GH	On-Demand	Anodyne	SLC6A7	0	42
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537878	GG	On-Demand	Anodyne	TBXAS1	43	45
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537878	GG	On-Demand	Anodyne	PREP	112	56
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537878	GG	On-Demand	Anodyne	SFRP1	57	43
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537878	GG	On-Demand	Anodyne	WNT3	61	43
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450537878	GG	On-Demand	Anodyne	NAMPT	15	41
CC(C)N(CCN1CCCCCC1)c1ncc([N+](=O)[O-])s1	ZINC000450537880	DG	On-Demand	Bother	MAPK9	0	42
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	HTR1A	30	48
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	DRD2	36	52
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	DRD1	17	47
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	DRD4	26	47
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	ADRA1D	25	42
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	ADRA1A	18	41
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	DRD3	65	52
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	PDGFRB	17	44
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	CPT1A	45	31
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	PLK1	49	34
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	HPGD	46	55
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	AP2S1	0	44
COc1ccccc1-n1cnc2cc(C(=O)NCCCCOC(C)C)ccc21	ZINC000450537885	GH	On-Demand	Anodyne	ALPHA-1A	0	45
CC(=O)c1ccc(NC(=O)c2cnc(C3CC3)nc2)cc1Cl	ZINC000450537886	DG	On-Demand	Anodyne	MAOB	19	42
CC(=O)c1ccc(NC(=O)c2cnc(C3CC3)nc2)cc1Cl	ZINC000450537886	DG	On-Demand	Anodyne	GRM4	45	39
CC(=O)c1ccc(NC(=O)c2cnc(C3CC3)nc2)cc1Cl	ZINC000450537886	DG	On-Demand	Anodyne	TYK2	61	42
CC(=O)c1ccc(NC(=O)c2cnc(C3CC3)nc2)cc1Cl	ZINC000450537886	DG	On-Demand	Anodyne	NR2E3	44	32
CC(=O)c1ccc(NC(=O)c2cnc(C3CC3)nc2)cc1Cl	ZINC000450537886	DG	On-Demand	Anodyne	SHH	50	37
CC(=O)c1ccc(NC(=O)c2cnc(C3CC3)nc2)cc1Cl	ZINC000450537886	DG	On-Demand	Anodyne	KCNK3	40	35
O=C(O)[C@@H]1CCC[C@@H](C(=O)N[C@H]2CCCOc3c(Cl)cccc32)C1	ZINC000450537911	FH	On-Demand	Anodyne	CNR1	29	42
Cc1nn(C)cc1CNC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450537913	DD	On-Demand	Anodyne	NOS2	65	32
O=C(O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)C1	ZINC000450537914	FH	On-Demand	Anodyne	CNR1	29	42
O=C(N[C@@H]1CCCOc2c(Cl)cccc21)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450537915	FH	On-Demand	Anodyne	CNR1	29	42
O=C(N[C@H]1CCCOc2c(Cl)cccc21)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450537916	FH	On-Demand	Anodyne	CNR1	29	42
Cc1nn(C)cc1CNC(=O)C[C@H]1COc2ccccc2O1	ZINC000450537920	DD	On-Demand	Anodyne	NOS2	65	32
CC1(C)CN(C(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)C[C@@H]1c1ccccc1	ZINC000450537933	EH	On-Demand	Anodyne	SLC6A1	46	32
CC1(C)CN(C(=O)[C@@H]2CCC[C@H](C(=O)O)C2)C[C@H]1c1ccccc1	ZINC000450537934	EH	On-Demand	Anodyne	SLC6A1	46	32
CC1(C)CN(C(=O)[C@@H]2CCC[C@H](C(=O)O)C2)C[C@@H]1c1ccccc1	ZINC000450537936	EH	On-Demand	Anodyne	SLC6A1	46	32
CC1(C)CN(C(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)C[C@H]1c1ccccc1	ZINC000450537937	EH	On-Demand	Anodyne	SLC6A1	46	32
Cc1nc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1C(=O)O	ZINC000450537940	GG	On-Demand	Anodyne	CACNA1B	41	34
Cc1nc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)ccc1C(=O)O	ZINC000450537941	GG	On-Demand	Anodyne	CACNA1B	41	34
CN(C)c1nc(N2CC[C@H](Oc3ccc(C#N)cn3)C2)nc2ccccc12	ZINC000450537951	FF	On-Demand	Mild	PDE3A	43	41
CN(C)c1nc(N2CC[C@@H](Oc3ccc(C#N)cn3)C2)nc2ccccc12	ZINC000450537953	FF	On-Demand	Mild	PDE3A	43	41
Cc1nn(C)cc1CNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450537964	EE	On-Demand	Anodyne	P2RX7	59	40
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	FKBP1A	36	52
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	ELANE	59	37
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	MMP13	44	45
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	TRY1_BOVIN	54	33
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	ADAM17	45	41
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	ITGA4	50	52
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	CAPNS1	22	56
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	MMP3	51	44
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	MMP8	27	41
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	CAPN1	24	61
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	MMP9	30	43
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	MMP7	64	45
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	MMP1	53	48
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	XIAP	58	39
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	SFRP1	56	35
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	WNT3	56	34
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537972	ED	On-Demand	Anodyne	BRCA1	45	33
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	FKBP1A	36	52
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	ELANE	59	37
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	MMP13	44	45
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	TRY1_BOVIN	54	33
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	ADAM17	45	41
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	ITGA4	50	52
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	CAPNS1	22	56
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	MMP3	51	44
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	MMP8	27	41
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	CAPN1	24	61
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	MMP9	30	43
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	MMP7	64	45
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	MMP1	53	48
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	XIAP	58	39
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	SFRP1	56	35
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	WNT3	56	34
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450537975	ED	On-Demand	Anodyne	BRCA1	45	33
CC[C@@H](O)CC(=O)Nc1cc(F)ccc1OC	ZINC000450538012	BD	On-Demand	Anodyne	PYGL	0	42
CC[C@H](O)CC(=O)Nc1cc(F)ccc1OC	ZINC000450538013	BD	On-Demand	Anodyne	PYGL	0	42
CCc1oc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000450538026	GH	On-Demand	Anodyne	LIPG	42	32
CCc1oc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1C(=O)O	ZINC000450538027	GH	On-Demand	Anodyne	LIPG	42	32
CC(=O)c1ccc(NC(=O)c2ccc(C3CC3)nc2C)cc1Cl	ZINC000450538032	EI	On-Demand	Anodyne	TYK2	43	37
CC(=O)c1ccc(NC(=O)c2ccc(C3CC3)nc2C)cc1Cl	ZINC000450538032	EI	On-Demand	Anodyne	NR2E3	63	35
CC(=O)c1ccc(NC(=O)c2ccc(C3CC3)nc2C)cc1Cl	ZINC000450538032	EI	On-Demand	Anodyne	SHH	52	47
Cc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450538034	EJ	On-Demand	Anodyne	ERBB2	0	43
Cc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450538034	EJ	On-Demand	Anodyne	CCR5	20	40
Cc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450538034	EJ	On-Demand	Anodyne	SLC18A3	24	42
Cc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450538034	EJ	On-Demand	Anodyne	ADAM10	30	43
Cc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450538035	EJ	On-Demand	Anodyne	ERBB2	0	43
Cc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450538035	EJ	On-Demand	Anodyne	CCR5	20	40
Cc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450538035	EJ	On-Demand	Anodyne	SLC18A3	24	42
Cc1ccc(C2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450538035	EJ	On-Demand	Anodyne	ADAM10	30	43
Cc1ccc(C2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450538036	EJ	On-Demand	Anodyne	ERBB2	0	43
Cc1ccc(C2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450538036	EJ	On-Demand	Anodyne	CCR5	20	40
Cc1ccc(C2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450538036	EJ	On-Demand	Anodyne	SLC18A3	24	42
Cc1ccc(C2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450538036	EJ	On-Demand	Anodyne	ADAM10	30	43
Cc1ccc(C2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450538037	EJ	On-Demand	Anodyne	ERBB2	0	43
Cc1ccc(C2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450538037	EJ	On-Demand	Anodyne	CCR5	20	40
Cc1ccc(C2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450538037	EJ	On-Demand	Anodyne	SLC18A3	24	42
Cc1ccc(C2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450538037	EJ	On-Demand	Anodyne	ADAM10	30	43
COc1ccc(-c2ccnc(N3CCC(F)(F)[C@@H](CO)C3)n2)cc1	ZINC000450538039	EF	On-Demand	Anodyne	DKK1	0	41
COc1ccc(-c2ccnc(N3CCC(F)(F)[C@H](CO)C3)n2)cc1	ZINC000450538040	EF	On-Demand	Anodyne	DKK1	0	41
COc1cc(CNC(=O)[C@@H]2C[C@H]2C(=O)O)ccc1OC1CCCC1	ZINC000450538041	EE	On-Demand	Anodyne	PDE4B	28	44
NC(=O)N1CCC[C@@H](CNc2ncnc3cc(Br)ccc23)C1	ZINC000450538047	FE	On-Demand	Anodyne	EGFR	48	35
NC(=O)N1CCC[C@H](CNc2ncnc3cc(Br)ccc23)C1	ZINC000450538048	FE	On-Demand	Anodyne	EGFR	48	35
CSCc1ccc(CNc2ncc([N+](=O)[O-])c(C)n2)cc1	ZINC000450538052	DF	On-Demand	Bother	PRKCQ	47	43
Cn1c(C#N)ccc1C(=O)Nc1ncc(C2CCCCC2)s1	ZINC000450538053	DH	On-Demand	Mild	CDK5	54	47
COc1cc(CNC(=O)CCC(=O)O)ccc1OC1CCCC1	ZINC000450538055	DE	On-Demand	Anodyne	PDEC	0	44
COc1ccc(-c2noc(N(C)C[C@H](C)OC)n2)cc1	ZINC000450538078	CE	On-Demand	Anodyne	LUCI_PHOPE	29	44
COc1ccc(-c2noc(N(C)C[C@@H](C)OC)n2)cc1	ZINC000450538079	CE	On-Demand	Anodyne	LUCI_PHOPE	29	44
CCc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)n1	ZINC000450538082	FF	On-Demand	Anodyne	CNR1	0	40
CCc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)n1	ZINC000450538082	FF	On-Demand	Anodyne	BTK	37	40
CCc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)n1	ZINC000450538082	FF	On-Demand	Anodyne	LRRK2	30	52
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ncc(C3CCCCC3)s2)cn1	ZINC000450538087	GJ	On-Demand	Anodyne	CDK5	54	47
C[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538101	EH	On-Demand	Mild	SDH1	0	46
C[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538101	EH	On-Demand	Mild	ACACA	35	41
C[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538101	EH	On-Demand	Mild	CTSF	41	32
C[C@H](NC(=O)C1CC(C)(O)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538102	EH	On-Demand	Mild	SDH1	0	46
C[C@H](NC(=O)C1CC(C)(O)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538102	EH	On-Demand	Mild	ACACA	35	41
C[C@H](NC(=O)C1CC(C)(O)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538102	EH	On-Demand	Mild	CTSF	41	32
CCN(CC)C(=O)CCC1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450538105	FI	On-Demand	Anodyne	L3MBTL3	41	35
C[C@H](NC(=O)[C@]1(C#N)C[C@@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538106	EH	On-Demand	Mild	ACACA	40	38
C[C@H](NC(=O)[C@]1(C#N)C[C@@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538106	EH	On-Demand	Mild	CTSF	45	32
C[C@H](NC(=O)[C@]1(C#N)C[C@@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538106	EH	On-Demand	Mild	MCHR1	33	41
C[C@H](NC(=O)[C@@]1(C#N)C[C@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538107	EH	On-Demand	Mild	ACACA	40	38
C[C@H](NC(=O)[C@@]1(C#N)C[C@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538107	EH	On-Demand	Mild	CTSF	45	32
C[C@H](NC(=O)[C@@]1(C#N)C[C@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538107	EH	On-Demand	Mild	MCHR1	33	41
C[C@H](NC(=O)[C@@]1(C#N)C[C@@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538108	EH	On-Demand	Mild	ACACA	40	38
C[C@H](NC(=O)[C@@]1(C#N)C[C@@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538108	EH	On-Demand	Mild	CTSF	45	32
C[C@H](NC(=O)[C@@]1(C#N)C[C@@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538108	EH	On-Demand	Mild	MCHR1	33	41
C[C@H](NC(=O)[C@]1(C#N)C[C@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538109	EH	On-Demand	Mild	ACACA	40	38
C[C@H](NC(=O)[C@]1(C#N)C[C@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538109	EH	On-Demand	Mild	CTSF	45	32
C[C@H](NC(=O)[C@]1(C#N)C[C@H]1C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538109	EH	On-Demand	Mild	MCHR1	33	41
CS(=O)(=O)C1(CNc2ncnc3cc(Br)ccc23)CCCC1	ZINC000450538114	GF	On-Demand	Anodyne	EGFR	86	40
Cc1ccnc(OC2CCN(C(=O)[C@@H]3CCCCN3C3CCCC3)CC2)c1	ZINC000450538115	FH	On-Demand	Anodyne	CPT2	26	43
Cc1ccnc(OC2CCN(C(=O)[C@H]3CCCCN3C3CCCC3)CC2)c1	ZINC000450538116	FH	On-Demand	Anodyne	CPT2	26	43
COc1ccc(-c2noc(N[C@@H]3CCCN(C(=O)CCC(F)(F)F)C3)n2)cc1	ZINC000450538121	GF	On-Demand	Anodyne	COLA	38	42
COc1ccc(-c2noc(N[C@@H]3CCCN(C(=O)CCC(F)(F)F)C3)n2)cc1	ZINC000450538121	GF	On-Demand	Anodyne	CPT1A	32	42
COc1ccc(-c2noc(N[C@@H]3CCCN(C(=O)CCC(F)(F)F)C3)n2)cc1	ZINC000450538121	GF	On-Demand	Anodyne	ETHR	74	48
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450538123	GG	On-Demand	Anodyne	BTK	42	37
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450538123	GG	On-Demand	Anodyne	MLYCD	17	44
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450538123	GG	On-Demand	Anodyne	LRRK2	35	49
CCC[C@@H](OC)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538131	EI	On-Demand	Mild	CTSK	44	36
CCC[C@@H](OC)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538131	EI	On-Demand	Mild	ACACB	28	43
CCC[C@@H](OC)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538131	EI	On-Demand	Mild	CTRB_BOVIN	44	30
CCC[C@@H](OC)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538132	EI	On-Demand	Mild	CTSK	44	36
CCC[C@@H](OC)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538132	EI	On-Demand	Mild	ACACB	28	43
CCC[C@@H](OC)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538132	EI	On-Demand	Mild	CTRB_BOVIN	44	30
CCC[C@H](OC)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538133	EI	On-Demand	Mild	CTSK	44	36
CCC[C@H](OC)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538133	EI	On-Demand	Mild	ACACB	28	43
CCC[C@H](OC)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538133	EI	On-Demand	Mild	CTRB_BOVIN	44	30
CCC[C@H](OC)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538134	EI	On-Demand	Mild	CTSK	44	36
CCC[C@H](OC)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538134	EI	On-Demand	Mild	ACACB	28	43
CCC[C@H](OC)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538134	EI	On-Demand	Mild	CTRB_BOVIN	44	30
O=C(N(CCO)Cc1ccc(Cl)c(Cl)c1)C1(C(F)(F)F)CCC1	ZINC000450538135	FI	On-Demand	Anodyne	FFAR2	65	36
CCOc1cc(C(=O)N(C)Cc2ccc(F)cc2C)ccc1OCC(=O)O	ZINC000450538145	GG	On-Demand	Anodyne	PTGDR2	25	40
O=C(O)c1ccc(CC(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450538153	FC	On-Demand	Anodyne	L3MBTL3	57	36
COC(=O)CN1CCC[C@H](CN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)C1	ZINC000450538154	ED	On-Demand	Bother	CACNA1D	47	35
O=C(O)c1ccc(CC(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450538155	FC	On-Demand	Anodyne	L3MBTL3	57	36
Cc1ccn(-c2ccccc2C(=O)N2C[C@@H](C)N(C)C[C@@H]2C)n1	ZINC000450538156	DE	On-Demand	Anodyne	HCRTR2	31	40
Cc1ccn(-c2ccccc2C(=O)N2C[C@H](C)N(C)C[C@@H]2C)n1	ZINC000450538157	DE	On-Demand	Anodyne	HCRTR2	31	40
Cc1ccn(-c2ccccc2C(=O)N2C[C@@H](C)N(C)C[C@H]2C)n1	ZINC000450538158	DE	On-Demand	Anodyne	HCRTR2	31	40
Cc1ccn(-c2ccccc2C(=O)N2C[C@H](C)N(C)C[C@H]2C)n1	ZINC000450538159	DE	On-Demand	Anodyne	HCRTR2	31	40
CC(C)OCCCCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450538160	EH	On-Demand	Anodyne	MAPK14	17	41
CC(C)OCCCCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450538160	EH	On-Demand	Anodyne	F3	62	38
CC(C)OCCCCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450538160	EH	On-Demand	Anodyne	ROCK2	38	41
COC(=O)CN1CCC[C@@H](CN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)C1	ZINC000450538163	ED	On-Demand	Bother	CACNA1D	47	35
COc1cccc2c(NCc3cccc(N4CCOCC4)c3)nccc12	ZINC000450538191	EH	On-Demand	Anodyne	PDE5A	28	41
COc1cccc2c(NCc3cccc(N4CCOCC4)c3)nccc12	ZINC000450538191	EH	On-Demand	Anodyne	EPHB4	84	40
COc1cccc2c(NCc3cccc(N4CCOCC4)c3)nccc12	ZINC000450538191	EH	On-Demand	Anodyne	STAT6	55	39
Cc1nc(NCC(C)(C)C(C)(C)C)ncc1[N+](=O)[O-]	ZINC000450538194	CG	On-Demand	Bother	PRKCQ	47	38
O=C(O)CCC(=O)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450538195	CF	On-Demand	Anodyne	LUXR	57	37
O=C(O)CCC(=O)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450538195	CF	On-Demand	Anodyne	TRAR	57	33
O=C(O)CCC(=O)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450538196	CF	On-Demand	Anodyne	LUXR	57	37
O=C(O)CCC(=O)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450538196	CF	On-Demand	Anodyne	TRAR	57	33
Cc1ccc(CN(CCO)C(=O)c2ccnc(OC(F)F)c2)cc1	ZINC000450538216	EF	On-Demand	Anodyne	PLM2_PLAFA	28	42
CC(C)OCCCCNC(=O)C(C)(C)C1CCC1	ZINC000450538217	CG	On-Demand	Anodyne	AMY2	46	32
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccccc1C(=O)O	ZINC000450538218	DG	On-Demand	Anodyne	ANPEP	16	41
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccccc1C(=O)O	ZINC000450538218	DG	On-Demand	Anodyne	PTGER4	0	47
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccccc1C(=O)O	ZINC000450538218	DG	On-Demand	Anodyne	ACE2	42	36
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccccc1C(=O)O	ZINC000450538218	DG	On-Demand	Anodyne	AKR1C2	28	41
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccccc1C(=O)O	ZINC000450538222	DG	On-Demand	Anodyne	ANPEP	16	41
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccccc1C(=O)O	ZINC000450538222	DG	On-Demand	Anodyne	PTGER4	0	47
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccccc1C(=O)O	ZINC000450538222	DG	On-Demand	Anodyne	ACE2	42	36
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccccc1C(=O)O	ZINC000450538222	DG	On-Demand	Anodyne	AKR1C2	28	41
CCCOc1cc(C)ccc1CNC(=O)CCCCC(=O)O	ZINC000450538231	DG	On-Demand	Anodyne	PLA2G4B	41	32
CCCc1c(NC(=O)c2sc(COCC)nc2C)cnn1-c1ccccc1	ZINC000450538234	GI	On-Demand	Anodyne	GPR142	52	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538239	GD	On-Demand	Anodyne	ACE	50	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538239	GD	On-Demand	Anodyne	MME	26	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538239	GD	On-Demand	Anodyne	APP	16	43
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538239	GD	On-Demand	Anodyne	BIRC2	89	38
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538241	GD	On-Demand	Anodyne	ACE	50	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538241	GD	On-Demand	Anodyne	MME	26	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538241	GD	On-Demand	Anodyne	APP	16	43
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538241	GD	On-Demand	Anodyne	BIRC2	89	38
CC(=O)c1cn(CC(=O)N(CCO)Cc2ccc(C)cc2)nn1	ZINC000450538242	DC	On-Demand	Anodyne	PLA2G7	44	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538243	GD	On-Demand	Anodyne	ACE	50	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538243	GD	On-Demand	Anodyne	MME	26	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538243	GD	On-Demand	Anodyne	APP	16	43
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538243	GD	On-Demand	Anodyne	BIRC2	89	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538244	GD	On-Demand	Anodyne	ACE	50	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538244	GD	On-Demand	Anodyne	MME	26	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538244	GD	On-Demand	Anodyne	APP	16	43
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450538244	GD	On-Demand	Anodyne	BIRC2	89	38
CC(=O)c1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1Cl	ZINC000450538245	DH	On-Demand	Anodyne	GRM4	54	39
CC(=O)c1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1Cl	ZINC000450538245	DH	On-Demand	Anodyne	NPY5R	15	44
CC(C)OCCCCNC(=O)c1cc2ccncc2s1	ZINC000450538248	CG	On-Demand	Anodyne	VCAM1	40	33
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	MME	47	37
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	ANPEP	46	39
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	SDH1	0	43
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	KLK3	47	31
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	CTSB	41	33
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	PAPA1_CARPA	51	35
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	CYSP_TRYCR	43	33
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	CTSK	26	40
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	CAPNS1	56	34
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	MMP2	21	41
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	MMP3	42	36
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	CAPN1	71	38
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	CAPN2	91	37
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	ACE2	51	35
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	FPR1	45	34
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	POL	0	40
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	NPR	69	34
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538257	CD	On-Demand	Anodyne	AMP1_PLAFQ	48	39
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	MME	47	37
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	ANPEP	46	39
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	SDH1	0	43
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	KLK3	47	31
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	CTSB	41	33
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	PAPA1_CARPA	51	35
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	CYSP_TRYCR	43	33
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	CTSK	26	40
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	CAPNS1	56	34
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	MMP2	21	41
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	MMP3	42	36
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	CAPN1	71	38
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	CAPN2	91	37
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	ACE2	51	35
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	FPR1	45	34
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	POL	0	40
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	NPR	69	34
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538258	CD	On-Demand	Anodyne	AMP1_PLAFQ	48	39
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	MME	47	37
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	ANPEP	46	39
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	SDH1	0	43
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	KLK3	47	31
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	CTSB	41	33
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	PAPA1_CARPA	51	35
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	CYSP_TRYCR	43	33
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	CTSK	26	40
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	CAPNS1	56	34
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	MMP2	21	41
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	MMP3	42	36
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	CAPN1	71	38
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	CAPN2	91	37
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	ACE2	51	35
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	FPR1	45	34
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	POL	0	40
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	NPR	69	34
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450538260	CD	On-Demand	Anodyne	AMP1_PLAFQ	48	39
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	MME	47	37
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	ANPEP	46	39
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	SDH1	0	43
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	KLK3	47	31
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	CTSB	41	33
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	PAPA1_CARPA	51	35
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	CYSP_TRYCR	43	33
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	CTSK	26	40
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	CAPNS1	56	34
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	MMP2	21	41
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	MMP3	42	36
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	CAPN1	71	38
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	CAPN2	91	37
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	ACE2	51	35
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	FPR1	45	34
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	POL	0	40
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	NPR	69	34
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450538261	CD	On-Demand	Anodyne	AMP1_PLAFQ	48	39
C[C@@H](O)CN(C)c1ncnc2cc(Br)ccc12	ZINC000450538262	CE	On-Demand	Anodyne	EGFR	25	40
C[C@H](O)CN(C)c1ncnc2cc(Br)ccc12	ZINC000450538263	CE	On-Demand	Anodyne	EGFR	25	40
COc1ccc(-c2noc(N[C@@H](CO)C3CCCC3)n2)cc1	ZINC000450538264	DE	On-Demand	Anodyne	COLA	15	42
COc1ccc(-c2noc(N[C@H](CO)C3CCCC3)n2)cc1	ZINC000450538265	DE	On-Demand	Anodyne	COLA	15	42
CNc1nc(N2CC[C@@H](n3cc(Cl)cn3)C2)nc2ccccc12	ZINC000450538273	EE	On-Demand	Anodyne	HRH4	20	51
CNc1nc(N2CC[C@H](n3cc(Cl)cn3)C2)nc2ccccc12	ZINC000450538274	EE	On-Demand	Anodyne	HRH4	20	51
CC(C)Oc1ccc2nccc(N3CC[C@H](n4cccn4)C3)c2c1	ZINC000450538277	DH	On-Demand	Anodyne	PDE3B	46	32
CC(C)Oc1ccc2nccc(N3CC[C@@H](n4cccn4)C3)c2c1	ZINC000450538278	DH	On-Demand	Anodyne	PDE3B	46	32
C[C@@H](O)C[C@@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450538281	DD	On-Demand	Bother	CACNA1D	42	33
C[C@H](O)C[C@@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450538283	DD	On-Demand	Bother	CACNA1D	42	33
C[C@H](O)C[C@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450538284	DD	On-Demand	Bother	CACNA1D	42	33
C[C@@H](C[C@@H](C)O)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450538285	DD	On-Demand	Bother	CACNA1D	42	33
O=C(O)COc1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538300	GC	On-Demand	Anodyne	COLA	87	39
O=C(O)COc1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538300	GC	On-Demand	Anodyne	CPT1A	81	39
O=C(O)COc1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538300	GC	On-Demand	Anodyne	CPT2	42	36
O=C(O)COc1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538300	GC	On-Demand	Anodyne	L3MBTL1	0	41
O=C(O)COc1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538300	GC	On-Demand	Anodyne	L3MBTL3	61	41
O=C(O)COc1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538305	GC	On-Demand	Anodyne	COLA	87	39
O=C(O)COc1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538305	GC	On-Demand	Anodyne	CPT1A	81	39
O=C(O)COc1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538305	GC	On-Demand	Anodyne	CPT2	42	36
O=C(O)COc1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538305	GC	On-Demand	Anodyne	L3MBTL1	0	41
O=C(O)COc1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450538305	GC	On-Demand	Anodyne	L3MBTL3	61	41
Cc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)cn1	ZINC000450538308	FJ	On-Demand	Anodyne	CACNA1B	41	41
Cc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)cn1	ZINC000450538308	FJ	On-Demand	Anodyne	SLC9A1	42	35
Cc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)cn1	ZINC000450538308	FJ	On-Demand	Anodyne	LIPE	19	40
Cc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)cn1	ZINC000450538308	FJ	On-Demand	Anodyne	FASN	45	37
Cc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)cn1	ZINC000450538308	FJ	On-Demand	Anodyne	CCR2	30	44
Cc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)cn1	ZINC000450538308	FJ	On-Demand	Anodyne	RBP4	31	40
Cc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)cn1	ZINC000450538308	FJ	On-Demand	Anodyne	LIPG	52	36
Cc1nc2ccnn2cc1C(=O)NCCCCOC(C)C	ZINC000450538321	CD	On-Demand	Anodyne	DDR1	57	41
CCNC(=O)[C@@H](N=c1[nH]c(-c2ccc(OC)cc2)no1)C(C)C	ZINC000450538339	DD	On-Demand	Anodyne	TBK1	40	34
NC(=O)N1CCC[C@@H](CNc2ccnc3cc(F)c(Br)cc23)C1	ZINC000450538343	GG	On-Demand	Anodyne	HRP1_PLAFA	73	37
NC(=O)N1CCC[C@@H](CNc2ccnc3cc(F)c(Br)cc23)C1	ZINC000450538343	GG	On-Demand	Anodyne	HNMT	54	35
NC(=O)N1CCC[C@H](CNc2ccnc3cc(F)c(Br)cc23)C1	ZINC000450538344	GG	On-Demand	Anodyne	HRP1_PLAFA	73	37
NC(=O)N1CCC[C@H](CNc2ccnc3cc(F)c(Br)cc23)C1	ZINC000450538344	GG	On-Demand	Anodyne	HNMT	54	35
COC[C@]1(C(=O)O)CCCN(C(=O)c2cc(OC)c(OC)cc2Cl)C1	ZINC000450538353	FE	On-Demand	Anodyne	HTR4	41	39
COC[C@@]1(C(=O)O)CCCN(C(=O)c2cc(OC)c(OC)cc2Cl)C1	ZINC000450538354	FE	On-Demand	Anodyne	HTR4	41	39
CC[S@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538360	EG	On-Demand	Mild	ACACA	23	41
CC[S@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538360	EG	On-Demand	Mild	CTSF	42	32
CC[S@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538360	EG	On-Demand	Mild	ACACB	27	41
CC[S@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538360	EG	On-Demand	Mild	MCHR1	22	41
CC[S@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538360	EG	On-Demand	Mild	E1	0	40
CC[S@@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538361	EG	On-Demand	Mild	ACACA	23	41
CC[S@@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538361	EG	On-Demand	Mild	CTSF	42	32
CC[S@@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538361	EG	On-Demand	Mild	ACACB	27	41
CC[S@@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538361	EG	On-Demand	Mild	MCHR1	22	41
CC[S@@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538361	EG	On-Demand	Mild	E1	0	40
CC[S@@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538362	EG	On-Demand	Mild	ACACA	23	41
CC[S@@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538362	EG	On-Demand	Mild	CTSF	42	32
CC[S@@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538362	EG	On-Demand	Mild	ACACB	27	41
CC[S@@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538362	EG	On-Demand	Mild	MCHR1	22	41
CC[S@@](=O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538362	EG	On-Demand	Mild	E1	0	40
CC[S@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538363	EG	On-Demand	Mild	ACACA	23	41
CC[S@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538363	EG	On-Demand	Mild	CTSF	42	32
CC[S@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538363	EG	On-Demand	Mild	ACACB	27	41
CC[S@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538363	EG	On-Demand	Mild	MCHR1	22	41
CC[S@](=O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538363	EG	On-Demand	Mild	E1	0	40
NC(=O)N1CCC[C@H](CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1	ZINC000450538370	FE	On-Demand	Bother	MAOB	23	49
NC(=O)N1CCC[C@@H](CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1	ZINC000450538371	FE	On-Demand	Bother	MAOB	23	49
CCCc1csc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450538372	FH	On-Demand	Anodyne	ROCK1	20	46
CCCc1csc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450538372	FH	On-Demand	Anodyne	ROCK2	15	46
CCCc1csc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450538372	FH	On-Demand	Anodyne	TRPA1	22	43
C=CCOc1ccc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)cc1	ZINC000450538390	EE	On-Demand	Mild	COLA	54	44
C=CCOc1ccc(CC(=O)N2CCOC[C@H]2c2nc(C)no2)cc1	ZINC000450538390	EE	On-Demand	Mild	CPT1A	42	44
C=CCOc1ccc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)cc1	ZINC000450538391	EE	On-Demand	Mild	COLA	54	44
C=CCOc1ccc(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)cc1	ZINC000450538391	EE	On-Demand	Mild	CPT1A	42	44
Cn1cnc(-c2ccc(NC(=O)CCCC(=O)C3CC3)cc2)n1	ZINC000450538399	DF	On-Demand	Anodyne	CHRNA7	24	45
Cn1cnc(-c2ccc(NC(=O)CCCC(=O)C3CC3)cc2)n1	ZINC000450538399	DF	On-Demand	Anodyne	HDAC10	25	40
CO[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)[C@@H]2CCCC[C@H]21	ZINC000450538411	DG	On-Demand	Anodyne	ACE	53	37
CO[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)[C@H]2CCCC[C@H]21	ZINC000450538412	DG	On-Demand	Anodyne	ACE	53	37
CO[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)[C@@H]2CCCC[C@@H]21	ZINC000450538413	DG	On-Demand	Anodyne	ACE	53	37
CO[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)[C@H]2CCCC[C@@H]21	ZINC000450538414	DG	On-Demand	Anodyne	ACE	53	37
Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)CC1CC(F)(F)C1	ZINC000450538427	FF	On-Demand	Anodyne	LRRK2	17	44
Cc1cccc(Cl)c1C(=O)N1CCC(CCC(N)=O)CC1	ZINC000450538428	DF	On-Demand	Anodyne	CCR5	29	45
CC[C@@H]1CN(c2nccc3c(OC)cccc23)C[C@@H](C)S1(=O)=O	ZINC000450538430	EF	On-Demand	Anodyne	PDE3B	47	32
CC[C@H]1CN(c2nccc3c(OC)cccc23)C[C@@H](C)S1(=O)=O	ZINC000450538431	EF	On-Demand	Anodyne	PDE3B	47	32
CC[C@@H]1CN(c2nccc3c(OC)cccc23)C[C@H](C)S1(=O)=O	ZINC000450538432	EF	On-Demand	Anodyne	PDE3B	47	32
CC[C@H]1CN(c2nccc3c(OC)cccc23)C[C@H](C)S1(=O)=O	ZINC000450538433	EF	On-Demand	Anodyne	PDE3B	47	32
COc1ccc(-c2ccnc(N[C@@H](C)CN(C)C)n2)cc1	ZINC000450538435	CF	On-Demand	Anodyne	CLK4	23	50
Cc1ccc(CC(=O)NCc2cn(C)nc2C)c(Br)c1	ZINC000450538442	EF	On-Demand	Anodyne	P2RX7	31	43
CC(=O)c1nc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450538445	FD	On-Demand	Anodyne	CA2	39	44
CC(=O)c1nc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450538445	FD	On-Demand	Anodyne	CA1	37	44
CC(=O)c1nc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450538445	FD	On-Demand	Anodyne	CA7	31	44
CC(=O)c1nc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450538445	FD	On-Demand	Anodyne	CA4	28	40
CC(=O)c1nc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450538445	FD	On-Demand	Anodyne	CA12	29	44
CC(=O)c1nc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450538445	FD	On-Demand	Anodyne	CA9	33	44
CC(C)CCCC(=O)N[C@H](C)C[C@@H](C)O	ZINC000450538448	BE	On-Demand	Anodyne	Q6UB75_PIG	0	42
CC(C)CCCC(=O)N[C@H](C)C[C@@H](C)O	ZINC000450538448	BE	On-Demand	Anodyne	NOD1	43	36
CC(C)CCCC(=O)N[C@H](C)C[C@H](C)O	ZINC000450538449	BE	On-Demand	Anodyne	Q6UB75_PIG	0	42
CC(C)CCCC(=O)N[C@H](C)C[C@H](C)O	ZINC000450538449	BE	On-Demand	Anodyne	NOD1	43	36
CC(C)CCCC(=O)N[C@@H](C)C[C@H](C)O	ZINC000450538450	BE	On-Demand	Anodyne	Q6UB75_PIG	0	42
CC(C)CCCC(=O)N[C@@H](C)C[C@H](C)O	ZINC000450538450	BE	On-Demand	Anodyne	NOD1	43	36
CC(C)CCCC(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450538451	BE	On-Demand	Anodyne	Q6UB75_PIG	0	42
CC(C)CCCC(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450538451	BE	On-Demand	Anodyne	NOD1	43	36
COc1cc(CC(=O)N2CCC(CCCn3ccnc3)CC2)ccc1Cl	ZINC000450538460	GH	On-Demand	Anodyne	TBXAS1	49	41
COc1cc(CC(=O)N2CCC(CCCn3ccnc3)CC2)ccc1Cl	ZINC000450538460	GH	On-Demand	Anodyne	CCR1	22	42
COc1cc(CC(=O)N2CCC(CCCn3ccnc3)CC2)ccc1Cl	ZINC000450538460	GH	On-Demand	Anodyne	QPCT	31	46
O=C(O)CCCCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450538467	DF	On-Demand	Anodyne	ETHR	49	36
O=C(O)CCCCC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450538468	DF	On-Demand	Anodyne	ETHR	49	36
O=C(O)c1ccc(CC(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450538477	GH	On-Demand	Anodyne	CCR2	52	42
O=C(O)c1ccc(CC(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450538477	GH	On-Demand	Anodyne	LIPG	42	33
O=C(O)c1ccc(CC(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450538478	GH	On-Demand	Anodyne	CCR2	52	42
O=C(O)c1ccc(CC(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450538478	GH	On-Demand	Anodyne	LIPG	42	33
CCCN(CC(N)=O)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450538486	DE	On-Demand	Bother	SLC27A4	44	33
CNc1nc(N2CCC(CS(C)(=O)=O)CC2)nc2ccccc12	ZINC000450538488	ED	On-Demand	Anodyne	HRH4	21	44
CCc1cccc(C(=O)N(CCO)Cc2ccc(C)cc2)n1	ZINC000450538491	CF	On-Demand	Anodyne	PLM2_PLAFA	66	35
N#Cc1cccc(N2CCC3(CCN(Cc4ccccc4)CC3)C2)c1[N+](=O)[O-]	ZINC000450538494	GH	On-Demand	Mild	SIGMAR1	37	41
N#Cc1cccc(N2CCC3(CCN(Cc4ccccc4)CC3)C2)c1[N+](=O)[O-]	ZINC000450538494	GH	On-Demand	Mild	NPFFR1	49	33
COc1ccc(-c2noc(N3CC[C@@H](N(C)CCO)[C@H]3C)n2)cc1	ZINC000450538496	ED	On-Demand	Anodyne	COLA	0	42
Cc1ccc(Br)cc1CC(=O)NCc1cn(C)nc1C	ZINC000450538503	EF	On-Demand	Anodyne	P2RX7	58	42
COc1ccc2c(N3CC[C@@H](CS(C)(=O)=O)C3)c([N+](=O)[O-])cnc2c1	ZINC000450538508	FE	On-Demand	Bother	PDE3B	49	34
COc1ccc2c(N3CC[C@H](CS(C)(=O)=O)C3)c([N+](=O)[O-])cnc2c1	ZINC000450538509	FE	On-Demand	Bother	PDE3B	49	34
COc1ccc(-c2ccnc(NCC3CC(F)(F)C3)n2)cc1	ZINC000450538515	DH	On-Demand	Anodyne	CLK4	28	53
COc1ccc(-c2ccnc(NCC3CC(F)(F)C3)n2)cc1	ZINC000450538515	DH	On-Demand	Anodyne	DYRK1B	15	55
COc1ccc(-c2ccnc(NCC3CC(F)(F)C3)n2)cc1	ZINC000450538515	DH	On-Demand	Anodyne	VCP	44	45
Cc1nc(C)n(CCCC(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)n1	ZINC000450538518	GF	On-Demand	Anodyne	NPY5R	15	42
Cc1nc(C)n(CCCC(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)n1	ZINC000450538518	GF	On-Demand	Anodyne	SCD1	15	42
COC(=O)[C@@]1(c2ccccc2)CCN(c2nncs2)C1	ZINC000450538519	CD	On-Demand	Anodyne	ADRA1D	19	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2nncs2)C1	ZINC000450538519	CD	On-Demand	Anodyne	ADRA1A	19	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2nncs2)C1	ZINC000450538519	CD	On-Demand	Anodyne	ADRA1B	15	41
COC(=O)[C@]1(c2ccccc2)CCN(c2nncs2)C1	ZINC000450538520	CD	On-Demand	Anodyne	ADRA1D	19	41
COC(=O)[C@]1(c2ccccc2)CCN(c2nncs2)C1	ZINC000450538520	CD	On-Demand	Anodyne	ADRA1A	19	41
COC(=O)[C@]1(c2ccccc2)CCN(c2nncs2)C1	ZINC000450538520	CD	On-Demand	Anodyne	ADRA1B	15	41
O=C(O)C1CCC(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450538528	GG	On-Demand	Anodyne	LIPG	49	34
O=C(O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450538529	GG	On-Demand	Anodyne	LIPG	49	34
O=C(O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450538531	GG	On-Demand	Anodyne	LIPG	49	34
O=C(O)C1CCC(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450538532	GG	On-Demand	Anodyne	LIPG	49	34
COCCOCc1ccc(CNc2nccc(-c3ccc(OC)cc3)n2)cc1	ZINC000450538533	GH	On-Demand	Anodyne	CLK4	29	62
COCCOCc1ccc(CNc2nccc(-c3ccc(OC)cc3)n2)cc1	ZINC000450538533	GH	On-Demand	Anodyne	DYRK1B	16	68
CSC[C@@H]1CCCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450538560	DG	On-Demand	Anodyne	ADRA2A	16	41
CSC[C@H]1CCCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450538562	DG	On-Demand	Anodyne	ADRA2A	16	41
COC(=O)CN1CCC[C@@H](CNc2cc(C)nc(-c3cccnc3)n2)C1	ZINC000450538574	FD	On-Demand	Anodyne	ROS1	58	35
COC(=O)CN1CCC[C@H](CNc2cc(C)nc(-c3cccnc3)n2)C1	ZINC000450538577	FD	On-Demand	Anodyne	ROS1	58	35
O=C(O)c1ccc(CCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450538579	FH	On-Demand	Anodyne	PTGER4	50	33
O=C(O)c1ccc(CCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450538579	FH	On-Demand	Anodyne	ETHR	55	38
O=C(O)c1ccc(CCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450538581	FH	On-Demand	Anodyne	PTGER4	50	33
O=C(O)c1ccc(CCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450538581	FH	On-Demand	Anodyne	ETHR	55	38
O=C(c1cncc(Cl)c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450538588	EG	On-Demand	Anodyne	TBXAS1	37	43
O=C(c1cncc(Cl)c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450538588	EG	On-Demand	Anodyne	HMOX2	40	34
Cc1ccc(C2CCN(C(=O)c3cc(Br)c(F)cc3O)CC2)cn1	ZINC000450538598	GI	On-Demand	Anodyne	FASN	40	33
CCc1oc(C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)cc1C(=O)O	ZINC000450538616	FH	On-Demand	Anodyne	PTGER4	19	42
CCc1oc(C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)cc1C(=O)O	ZINC000450538616	FH	On-Demand	Anodyne	PTGDR	0	41
CCc1oc(C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)cc1C(=O)O	ZINC000450538620	FH	On-Demand	Anodyne	PTGER4	19	42
CCc1oc(C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)cc1C(=O)O	ZINC000450538620	FH	On-Demand	Anodyne	PTGDR	0	41
CC(C)OCCCCNC(=O)[C@H]1CC12CCSCC2	ZINC000450538628	CF	On-Demand	Anodyne	EPHX2	50	46
CC(C)OCCCCNC(=O)[C@@H]1CC12CCSCC2	ZINC000450538630	CF	On-Demand	Anodyne	EPHX2	50	46
CCCc1cc(C(=O)Nc2ccc(C(C)=O)c(Cl)c2)no1	ZINC000450538633	DH	On-Demand	Anodyne	FLT1	16	40
CCCc1cc(C(=O)Nc2ccc(C(C)=O)c(Cl)c2)no1	ZINC000450538633	DH	On-Demand	Anodyne	GRM4	45	37
CC(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538634	EI	On-Demand	Anodyne	AVPR2	55	37
CC(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538634	EI	On-Demand	Anodyne	NPY2R	73	45
CC(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538634	EI	On-Demand	Anodyne	MAPK1	33	49
CC(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538634	EI	On-Demand	Anodyne	EPHX2	25	44
CC(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538634	EI	On-Demand	Anodyne	TYK2	45	37
CC(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538634	EI	On-Demand	Anodyne	NR2E3	40	37
CC(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538634	EI	On-Demand	Anodyne	RHOA	0	40
CC(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538635	EI	On-Demand	Anodyne	AVPR2	55	37
CC(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538635	EI	On-Demand	Anodyne	NPY2R	73	45
CC(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538635	EI	On-Demand	Anodyne	MAPK1	33	49
CC(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538635	EI	On-Demand	Anodyne	EPHX2	25	44
CC(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538635	EI	On-Demand	Anodyne	TYK2	45	37
CC(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538635	EI	On-Demand	Anodyne	NR2E3	40	37
CC(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1Cl	ZINC000450538635	EI	On-Demand	Anodyne	RHOA	0	40
Cc1ccnc(OC2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)c1	ZINC000450538645	FH	On-Demand	Anodyne	HCRTR1	27	44
Cc1ccnc(OC2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)c1	ZINC000450538645	FH	On-Demand	Anodyne	HCRTR2	28	44
Cc1ccnc(OC2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)c1	ZINC000450538645	FH	On-Demand	Anodyne	L3MBTL3	47	35
COc1ccccc1O[C@H]1CCCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450538650	FH	On-Demand	Mild	PDE3A	23	45
COc1ccccc1O[C@H]1CCCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450538650	FH	On-Demand	Mild	PDE3B	35	45
COc1ccccc1O[C@@H]1CCCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450538651	FH	On-Demand	Mild	PDE3A	23	45
COc1ccccc1O[C@@H]1CCCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450538651	FH	On-Demand	Mild	PDE3B	35	45
O=C(N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F)[C@H]1CC1(F)F	ZINC000450538658	FH	On-Demand	Mild	EPHX2	32	43
O=C(N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F)[C@@H]1CC1(F)F	ZINC000450538659	FH	On-Demand	Mild	EPHX2	32	43
O=C(N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F)[C@@H]1CC1(F)F	ZINC000450538660	FH	On-Demand	Mild	EPHX2	32	43
O=C(N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F)[C@H]1CC1(F)F	ZINC000450538661	FH	On-Demand	Mild	EPHX2	32	43
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450538666	GI	On-Demand	Anodyne	UTS2R	44	31
CCN(CC)C(=O)CCC1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450538667	GI	On-Demand	Anodyne	UTS2R	44	31
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450538668	GI	On-Demand	Anodyne	UTS2R	44	31
CCN(CC)C(=O)CCC1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450538669	GI	On-Demand	Anodyne	UTS2R	44	31
COc1cc(CNC(=O)c2ccnc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450538670	FG	On-Demand	Anodyne	PDE4A	50	43
COc1cc(CNC(=O)c2ccnc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450538670	FG	On-Demand	Anodyne	PDE4B	29	52
COc1cc(CNC(=O)c2ccnc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450538670	FG	On-Demand	Anodyne	ROCK2	15	43
COc1cc(CNC(=O)c2ccnc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450538670	FG	On-Demand	Anodyne	SLC5A7	32	43
COc1cc(CNC(=O)c2ccnc(C(=O)O)c2)ccc1OC1CCCC1	ZINC000450538670	FG	On-Demand	Anodyne	MT-ND1	24	43
Cc1ccnc(OC2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)CC2)c1	ZINC000450538676	FD	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)CC2)c1	ZINC000450538676	FD	On-Demand	Anodyne	HCRTR2	16	41
Cc1ccc(F)c(CC(=O)N2CCOC[C@H]2c2nc(C)no2)c1	ZINC000450538687	DD	On-Demand	Anodyne	COLA	32	43
Cc1ccc(F)c(CC(=O)N2CCOC[C@H]2c2nc(C)no2)c1	ZINC000450538687	DD	On-Demand	Anodyne	CPT1A	23	43
Cc1ccc(F)c(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)c1	ZINC000450538688	DD	On-Demand	Anodyne	COLA	32	43
Cc1ccc(F)c(CC(=O)N2CCOC[C@@H]2c2nc(C)no2)c1	ZINC000450538688	DD	On-Demand	Anodyne	CPT1A	23	43
O=C(CC1CC(F)(F)C1)Nc1ncc(C2CCCCC2)s1	ZINC000450538701	DJ	On-Demand	Anodyne	CDK5	64	58
Cc1cccc(Cl)c1C(=O)Nc1cccc(CN2CCOCC2)n1	ZINC000450538713	EG	On-Demand	Anodyne	CNR1	0	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(CN2CCOCC2)n1	ZINC000450538713	EG	On-Demand	Anodyne	CNR2	0	46
Cc1cccc(Cl)c1C(=O)Nc1cccc(CN2CCOCC2)n1	ZINC000450538713	EG	On-Demand	Anodyne	LCK	37	49
Cc1cnc(CCCC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1	ZINC000450538727	FJ	On-Demand	Mild	SUCNR1	25	45
Cc1cnc(CCCC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1	ZINC000450538728	FJ	On-Demand	Mild	SUCNR1	25	45
C[C@H](NC(=O)CCCC(=O)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538731	FJ	On-Demand	Mild	MCHR1	33	45
C[C@@H](NC(=O)CCCC(=O)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450538732	FJ	On-Demand	Mild	MCHR1	33	45
C[C@@H](C[C@@H](C)O)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450538734	DG	On-Demand	Anodyne	GPR88	0	40
C[C@H](O)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450538735	DG	On-Demand	Anodyne	GPR88	0	40
C[C@@H](O)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450538736	DG	On-Demand	Anodyne	GPR88	0	40
Cc1ccc(C2CCN(C(=O)c3cc4ccncc4s3)CC2)cn1	ZINC000450538737	EI	On-Demand	Anodyne	FASN	40	34
C[C@@H](O)C[C@@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450538738	DF	On-Demand	Bother	PPXII	0	40
C[C@@H](O)C[C@@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450538738	DF	On-Demand	Bother	AADAC	0	40
C[C@@H](C[C@@H](C)O)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450538739	DF	On-Demand	Bother	PPXII	0	40
C[C@@H](C[C@@H](C)O)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450538739	DF	On-Demand	Bother	AADAC	0	40
C[C@H](O)C[C@@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450538740	DF	On-Demand	Bother	PPXII	0	40
C[C@H](O)C[C@@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450538740	DF	On-Demand	Bother	AADAC	0	40
C[C@H](O)C[C@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450538741	DF	On-Demand	Bother	PPXII	0	40
C[C@H](O)C[C@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450538741	DF	On-Demand	Bother	AADAC	0	40
COc1cccc2c(N3CC[C@H](n4cc(C)cn4)C3)nccc12	ZINC000450538756	DG	On-Demand	Anodyne	PDE3A	50	39
COc1cccc2c(N3CC[C@H](n4cc(C)cn4)C3)nccc12	ZINC000450538756	DG	On-Demand	Anodyne	PDE3B	75	39
COc1cccc2c(N3CC[C@@H](n4cc(C)cn4)C3)nccc12	ZINC000450538757	DG	On-Demand	Anodyne	PDE3A	50	39
COc1cccc2c(N3CC[C@@H](n4cc(C)cn4)C3)nccc12	ZINC000450538757	DG	On-Demand	Anodyne	PDE3B	75	39
C[C@H](CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)CN(C)C	ZINC000450538766	DF	On-Demand	Bother	MAOB	17	51
C[C@@H](CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)CN(C)C	ZINC000450538767	DF	On-Demand	Bother	MAOB	17	51
CC(=O)c1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1Cl	ZINC000450538770	DG	On-Demand	Anodyne	CNR1	40	30
CC(=O)c1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1Cl	ZINC000450538770	DG	On-Demand	Anodyne	AVPR2	47	42
CC(=O)c1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1Cl	ZINC000450538770	DG	On-Demand	Anodyne	GRM4	47	39
CC(=O)c1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1Cl	ZINC000450538770	DG	On-Demand	Anodyne	TYK2	53	37
CC(=O)c1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1Cl	ZINC000450538770	DG	On-Demand	Anodyne	NR2E3	59	32
CC1(O)CC(C(=O)NCc2ccnc(NC(=O)C3CC(C)(O)C3)c2)C1	ZINC000450538776	EC	On-Demand	Anodyne	TYK2	66	42
CN1C(=O)C[C@H](NC(=O)[C@@H](O)C2CCC2)[C@@H]1c1ccc(Cl)cc1	ZINC000450538778	ED	On-Demand	Anodyne	SLC6A1	50	37
CN1C(=O)C[C@H](NC(=O)[C@H](O)C2CCC2)[C@@H]1c1ccc(Cl)cc1	ZINC000450538781	ED	On-Demand	Anodyne	SLC6A1	50	37
CN1C(=O)C[C@H](NC(=O)[C@@H](O)C2CCC2)[C@H]1c1ccc(Cl)cc1	ZINC000450538782	ED	On-Demand	Anodyne	SLC6A1	50	37
CN1C(=O)C[C@H](NC(=O)[C@H](O)C2CCC2)[C@H]1c1ccc(Cl)cc1	ZINC000450538784	ED	On-Demand	Anodyne	SLC6A1	50	37
CN(CCOc1ccc(S(N)(=O)=O)cc1)c1nc(C2CCC2)no1	ZINC000450538785	FD	On-Demand	Anodyne	CA7	22	42
COCC(C)(C)CNc1ncnc2cc(Br)ccc12	ZINC000450538787	DF	On-Demand	Anodyne	EGFR	70	41
COCC(C)(C)CNc1ncnc2cc(Br)ccc12	ZINC000450538787	DF	On-Demand	Anodyne	FBP1	18	43
COCC(C)(C)CNc1ncnc2cc(Br)ccc12	ZINC000450538787	DF	On-Demand	Anodyne	ERBB4	24	43
COCC(C)(C)CNc1ncnc2cc(Br)ccc12	ZINC000450538787	DF	On-Demand	Anodyne	MKNK1	21	43
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450538789	EF	On-Demand	Anodyne	ADRA1D	18	41
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450538789	EF	On-Demand	Anodyne	ADRA1A	19	41
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450538789	EF	On-Demand	Anodyne	KCNA3	17	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450538792	EF	On-Demand	Anodyne	ADRA1D	18	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450538792	EF	On-Demand	Anodyne	ADRA1A	19	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(C(C)=O)c(C)s2)C1	ZINC000450538792	EF	On-Demand	Anodyne	KCNA3	17	41
CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)CCC(=O)O	ZINC000450538801	DG	On-Demand	Anodyne	PLA2G10	17	43
CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)CCC(=O)O	ZINC000450538801	DG	On-Demand	Anodyne	Q6UB75_PIG	0	43
CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)CCC(=O)O	ZINC000450538803	DG	On-Demand	Anodyne	PLA2G10	17	43
CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)CCC(=O)O	ZINC000450538803	DG	On-Demand	Anodyne	Q6UB75_PIG	0	43
CC(F)(F)c1ccc(C(=O)N2CCC(CCCn3ccnc3)CC2)cn1	ZINC000450538804	FH	On-Demand	Anodyne	TBXAS1	33	40
CCc1oc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000450538811	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
CCc1oc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1C(=O)O	ZINC000450538813	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
CC(C)OCCCCNC(=O)C1CC(O)(CCC(C)(C)C)C1	ZINC000450538814	DG	On-Demand	Anodyne	EPHX2	17	40
CSc1cccc(C(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450538831	EH	On-Demand	Anodyne	TBXAS1	47	45
CC(C)OCCCCNC(=O)c1ccc(I)cc1F	ZINC000450538835	GG	On-Demand	Anodyne	FOLH1	32	40
CC(C)OCCCCNC(=O)c1ccc(I)cc1F	ZINC000450538835	GG	On-Demand	Anodyne	MAP2K1	42	42
CCOC(=O)c1csc(N2CCC[C@H](c3ccccc3)C2)n1	ZINC000450538838	DH	On-Demand	Anodyne	SLC6A1	61	33
C[C@@H](CNc1ncnc2cc(Br)ccc12)CN(C)C	ZINC000450538839	DE	On-Demand	Anodyne	EGFR	83	42
C[C@@H](CNc1ncnc2cc(Br)ccc12)CN(C)C	ZINC000450538839	DE	On-Demand	Anodyne	FBP1	15	40
C[C@@H](CNc1ncnc2cc(Br)ccc12)CN(C)C	ZINC000450538839	DE	On-Demand	Anodyne	ERBB4	23	40
CCOC(=O)c1csc(N2CCC[C@@H](c3ccccc3)C2)n1	ZINC000450538840	DH	On-Demand	Anodyne	SLC6A1	61	33
C[C@H](CNc1ncnc2cc(Br)ccc12)CN(C)C	ZINC000450538842	DE	On-Demand	Anodyne	EGFR	83	42
C[C@H](CNc1ncnc2cc(Br)ccc12)CN(C)C	ZINC000450538842	DE	On-Demand	Anodyne	FBP1	15	40
C[C@H](CNc1ncnc2cc(Br)ccc12)CN(C)C	ZINC000450538842	DE	On-Demand	Anodyne	ERBB4	23	40
COC(=O)[C@@H]1CCO[C@H]1C1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450538843	GF	On-Demand	Anodyne	LIMK2	42	40
CC(C)OCCCCNC(=O)C1(C(=O)C2CC2)CC1	ZINC000450538850	CE	On-Demand	Anodyne	EPHX2	0	44
O=C(O)c1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)o1	ZINC000450538886	DF	On-Demand	Anodyne	L3MBTL1	0	47
O=C(O)c1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)o1	ZINC000450538890	DF	On-Demand	Anodyne	L3MBTL1	0	47
Cc1cccc(C)c1[C@H](C)NC(=O)CCc1ccc(C(=O)O)cc1	ZINC000450538898	EH	On-Demand	Anodyne	CMA1	16	42
Cc1cccc(C)c1[C@@H](C)NC(=O)CCc1ccc(C(=O)O)cc1	ZINC000450538899	EH	On-Demand	Anodyne	CMA1	16	42
CN(CCOc1ccc(S(N)(=O)=O)cc1)c1ncc(C(F)F)cn1	ZINC000450538900	FD	On-Demand	Anodyne	CA2	22	48
CN(CCOc1ccc(S(N)(=O)=O)cc1)c1ncc(C(F)F)cn1	ZINC000450538900	FD	On-Demand	Anodyne	CA1	21	48
CN(CCOc1ccc(S(N)(=O)=O)cc1)c1ncc(C(F)F)cn1	ZINC000450538900	FD	On-Demand	Anodyne	CA7	31	48
CN(CCOc1ccc(S(N)(=O)=O)cc1)c1ncc(C(F)F)cn1	ZINC000450538900	FD	On-Demand	Anodyne	CA12	16	48
CN(CCOc1ccc(S(N)(=O)=O)cc1)c1ncc(C(F)F)cn1	ZINC000450538900	FD	On-Demand	Anodyne	CA9	20	48
O=C([C@H]1CC1(F)F)N1CCC(CCCn2ccnc2)CC1	ZINC000450538904	CF	On-Demand	Anodyne	TBXAS1	22	41
O=C([C@@H]1CC1(F)F)N1CCC(CCCn2ccnc2)CC1	ZINC000450538905	CF	On-Demand	Anodyne	TBXAS1	22	41
O=C(c1cccc2c1CCCC2)N1CCC(CCCn2ccnc2)CC1	ZINC000450538918	FI	On-Demand	Anodyne	TBXAS1	43	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450538927	FG	On-Demand	Anodyne	TBXAS1	66	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450538927	FG	On-Demand	Anodyne	REN	26	45
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450538927	FG	On-Demand	Anodyne	AMP1_PLAFQ	16	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450538928	FG	On-Demand	Anodyne	TBXAS1	66	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450538928	FG	On-Demand	Anodyne	REN	26	45
CO[C@H](Cc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450538928	FG	On-Demand	Anodyne	AMP1_PLAFQ	16	42
COc1cccc(OCCC(=O)N2C[C@H](C)N(C)C[C@@H]2C)c1	ZINC000450538929	DE	On-Demand	Anodyne	DRD4	43	33
COc1cccc(OCCC(=O)N2C[C@@H](C)N(C)C[C@@H]2C)c1	ZINC000450538930	DE	On-Demand	Anodyne	DRD4	43	33
COc1cccc(OCCC(=O)N2C[C@H](C)N(C)C[C@H]2C)c1	ZINC000450538931	DE	On-Demand	Anodyne	DRD4	43	33
COc1cccc(OCCC(=O)N2C[C@@H](C)N(C)C[C@H]2C)c1	ZINC000450538932	DE	On-Demand	Anodyne	DRD4	43	33
COc1ccc(-c2ccnc(NCCS(=O)(=O)N(C)C)n2)cc1	ZINC000450538942	ED	On-Demand	Anodyne	IKBKB	25	52
COc1ccc(-c2ccnc(NCCS(=O)(=O)N(C)C)n2)cc1	ZINC000450538942	ED	On-Demand	Anodyne	CLK4	26	54
COc1ccc(-c2ccnc(NCCS(=O)(=O)N(C)C)n2)cc1	ZINC000450538942	ED	On-Demand	Anodyne	SMG1	62	38
COC(=O)CN1CCC[C@H](CNc2nc3cccc(C)c3s2)C1	ZINC000450538952	EE	On-Demand	Anodyne	CCR3	47	34
COC(=O)CN1CCC[C@@H](CNc2nc3cccc(C)c3s2)C1	ZINC000450538953	EE	On-Demand	Anodyne	CCR3	47	34
OC[C@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450538958	DE	On-Demand	Anodyne	EGFR	54	40
OC[C@@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450538959	DE	On-Demand	Anodyne	EGFR	54	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cn(C)nc1C	ZINC000450538962	DF	On-Demand	Anodyne	PPARA	0	45
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cn(C)nc1C	ZINC000450538962	DF	On-Demand	Anodyne	P2RX7	36	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cn(C)nc1C	ZINC000450538962	DF	On-Demand	Anodyne	PPARD	22	45
Cc1ccc(C2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)cn1	ZINC000450538975	EI	On-Demand	Anodyne	FASN	45	41
Cc1ccc(C2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)cn1	ZINC000450538975	EI	On-Demand	Anodyne	L3MBTL3	69	37
CC(=O)c1nc(N2CCC[C@](CO)(Cc3ccccc3)C2)sc1C	ZINC000450538995	EG	On-Demand	Anodyne	SLC12A5	75	39
CC(=O)c1nc(N2CCC[C@@](CO)(Cc3ccccc3)C2)sc1C	ZINC000450538996	EG	On-Demand	Anodyne	SLC12A5	75	39
CC[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450538998	DE	On-Demand	Anodyne	BMP1	44	33
CC[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450538998	DE	On-Demand	Anodyne	CAPN1	46	35
CC[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450538998	DE	On-Demand	Anodyne	CAPN2	82	38
CC[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450538998	DE	On-Demand	Anodyne	ACE2	40	38
CC[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450538998	DE	On-Demand	Anodyne	NPR	43	33
CNc1nc(N2CCN(C3CCC3)C[C@H](C)C2)nc2ccccc12	ZINC000450539000	EE	On-Demand	Anodyne	CCR4	15	49
CNc1nc(N2CCN(C3CCC3)C[C@@H](C)C2)nc2ccccc12	ZINC000450539001	EE	On-Demand	Anodyne	CCR4	15	49
CC1(C)CN(C(=O)c2cccc(C(=O)O)c2)C[C@H]1c1ccccc1	ZINC000450539008	DH	On-Demand	Anodyne	L3MBTL1	0	41
CC[C@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450539009	DE	On-Demand	Anodyne	BMP1	44	33
CC[C@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450539009	DE	On-Demand	Anodyne	CAPN1	46	35
CC[C@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450539009	DE	On-Demand	Anodyne	CAPN2	82	38
CC[C@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450539009	DE	On-Demand	Anodyne	ACE2	40	38
CC[C@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(N)=O	ZINC000450539009	DE	On-Demand	Anodyne	NPR	43	33
COC(=O)[C@]1(c2ccccc2)CCN(c2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450539010	FE	On-Demand	Mild	ADRA1B	15	42
COC(=O)[C@]1(c2ccccc2)CCN(c2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450539010	FE	On-Demand	Mild	KCNA3	16	43
CC1(C)CN(C(=O)c2cccc(C(=O)O)c2)C[C@@H]1c1ccccc1	ZINC000450539011	DH	On-Demand	Anodyne	L3MBTL1	0	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450539015	FE	On-Demand	Mild	ADRA1B	15	42
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450539015	FE	On-Demand	Mild	KCNA3	16	43
O=C(NCC1(c2ccc(F)cc2F)CCCC1)c1cnn2c1CCC2	ZINC000450539026	EG	On-Demand	Anodyne	HCN1	50	30
O=C(NCC1(c2ccc(F)cc2F)CCCC1)c1cnn2c1CCC2	ZINC000450539026	EG	On-Demand	Anodyne	HCN4	47	30
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450539030	GG	On-Demand	Anodyne	TBXAS1	15	42
CCCOc1cc(C)ccc1CNC(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450539038	EG	On-Demand	Anodyne	EPHX2	22	42
Cc1ccoc1CNc1ncc([N+](=O)[O-])c(C)n1	ZINC000450539044	BE	On-Demand	Bother	PRKCQ	32	44
CCCOc1cc(C)ccc1CNC(=O)C1CCC(C(=O)O)CC1	ZINC000450539045	EG	On-Demand	Anodyne	EPHX2	22	42
COc1ccc(-c2noc(N(C)C[C@@H](C)O)n2)cc1	ZINC000450539046	CD	On-Demand	Anodyne	LUCI_PHOPE	36	45
COc1ccc(-c2noc(N(C)C[C@H](C)O)n2)cc1	ZINC000450539047	CD	On-Demand	Anodyne	LUCI_PHOPE	36	45
Cc1ccc(C2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)CC2)cn1	ZINC000450539049	GH	On-Demand	Anodyne	FASN	40	39
Cc1ccc2c(c1)[C@H](Nc1ncc(C#N)cc1[N+](=O)[O-])CCC2	ZINC000450539057	DH	On-Demand	Mild	KCNN3	19	43
O=C(O)[C@@H]1CCC[C@@H](C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450539061	GG	On-Demand	Anodyne	LIPG	44	34
O=C(O)[C@@H]1CCC[C@@H](C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450539063	GG	On-Demand	Anodyne	LIPG	44	34
C[C@H]1CN(C(=O)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000450539064	EB	On-Demand	Bother	COLA	73	34
O=C(O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450539065	GG	On-Demand	Anodyne	LIPG	44	34
O=C(O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450539066	GG	On-Demand	Anodyne	LIPG	44	34
Cc1ccc(C2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)cn1	ZINC000450539072	EH	On-Demand	Anodyne	VACHT_TETCF	0	42
Cc1ccc(C2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)cn1	ZINC000450539072	EH	On-Demand	Anodyne	ADAM10	48	36
Cc1ccc(C2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)cn1	ZINC000450539073	EH	On-Demand	Anodyne	VACHT_TETCF	0	42
Cc1ccc(C2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)cn1	ZINC000450539073	EH	On-Demand	Anodyne	ADAM10	48	36
C[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000450539074	EB	On-Demand	Bother	COLA	73	34
C[C@@H]1CN(C(=O)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000450539075	EB	On-Demand	Bother	COLA	73	34
C[C@H]1CN(C(=O)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000450539076	EB	On-Demand	Bother	COLA	73	34
Cc1c(CNC(=O)[C@@H]2CC[C@@H](C(=O)O)CC2)sc2ccc(Cl)cc12	ZINC000450539078	FI	On-Demand	Anodyne	EPHX2	15	40
Cc1c(CNC(=O)C2CCC(C(=O)O)CC2)sc2ccc(Cl)cc12	ZINC000450539079	FI	On-Demand	Anodyne	EPHX2	15	40
O=C(N1CCC(CCCn2ccnc2)CC1)C1(C(F)(F)F)CCC1	ZINC000450539083	EH	On-Demand	Anodyne	TBXAS1	24	41
COc1cccc2c(N3CC[C@@H](CS(C)(=O)=O)C3)nccc12	ZINC000450539091	DE	On-Demand	Anodyne	PDE3A	28	42
COc1cccc2c(N3CC[C@H](CS(C)(=O)=O)C3)nccc12	ZINC000450539092	DE	On-Demand	Anodyne	PDE3A	28	42
Cc1nc(C)n(CCCC(=O)Nc2cccc(-c3cnn[nH]3)c2)n1	ZINC000450539093	EE	On-Demand	Anodyne	HDAC10	40	42
Cc1nc(C)n(CCCC(=O)Nc2cccc(-c3cnn[nH]3)c2)n1	ZINC000450539093	EE	On-Demand	Anodyne	HDAC3	42	42
Cc1nc(C)n(CCCC(=O)Nc2cccc(-c3cnn[nH]3)c2)n1	ZINC000450539093	EE	On-Demand	Anodyne	HDAC6	36	42
O=C(c1cc2n(n1)CCC2)N1CCC(CCCn2ccnc2)CC1	ZINC000450539095	EE	On-Demand	Anodyne	TBXAS1	43	38
C=C[C@@H]1OCC[C@H]1C(=O)NCc1ccnc(NC(=O)[C@@H]2CCO[C@H]2C=C)c1	ZINC000450539098	FD	On-Demand	Mild	TYK2	58	36
COc1cc(CC(=O)NCCCCOC(C)C)ccc1Cl	ZINC000450539102	DG	On-Demand	Anodyne	TRPV1	17	53
COc1cc(CC(=O)NCCCCOC(C)C)ccc1Cl	ZINC000450539102	DG	On-Demand	Anodyne	PTGDR	23	40
COc1cc(CC(=O)NCCCCOC(C)C)ccc1Cl	ZINC000450539102	DG	On-Demand	Anodyne	NCE103	29	50
COc1cc(CC(=O)NCCCCOC(C)C)ccc1Cl	ZINC000450539102	DG	On-Demand	Anodyne	P96878_MYCTU	19	50
COc1cc(CC(=O)NCCCCOC(C)C)ccc1Cl	ZINC000450539102	DG	On-Demand	Anodyne	CAN2	0	50
O=C(CSC1CC1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539113	DF	On-Demand	Anodyne	TBXAS1	24	42
COc1ccc(CNC(=O)CCN(C)CCc2noc(C)n2)c(OC)c1	ZINC000450539116	FD	On-Demand	Anodyne	PDGFRB	27	40
COc1ccc(CNC(=O)CCN(C)CCc2noc(C)n2)c(OC)c1	ZINC000450539116	FD	On-Demand	Anodyne	MTNR1A	50	38
O=C(O)c1ccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)s1	ZINC000450539120	FD	On-Demand	Anodyne	L3MBTL1	0	51
O=C(O)c1ccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)s1	ZINC000450539120	FD	On-Demand	Anodyne	L3MBTL3	49	51
O=C(O)c1ccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)s1	ZINC000450539121	FD	On-Demand	Anodyne	L3MBTL1	0	51
O=C(O)c1ccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)s1	ZINC000450539121	FD	On-Demand	Anodyne	L3MBTL3	49	51
CCCN(CC(N)=O)c1nc(-c2ccc(OC)cc2)no1	ZINC000450539122	CD	On-Demand	Anodyne	TSPO	17	40
CCCN(CC(N)=O)c1nc(-c2ccc(OC)cc2)no1	ZINC000450539122	CD	On-Demand	Anodyne	LUCI_PHOPE	16	43
O=C(c1ccnc(OC(F)F)c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539129	FG	On-Demand	Anodyne	TBXAS1	41	39
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450539134	GD	On-Demand	Anodyne	CCR3	60	33
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450539134	GD	On-Demand	Anodyne	BIRC2	45	38
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450539135	GD	On-Demand	Anodyne	CCR3	60	33
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450539135	GD	On-Demand	Anodyne	BIRC2	45	38
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450539136	GD	On-Demand	Anodyne	CCR3	60	33
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450539136	GD	On-Demand	Anodyne	BIRC2	45	38
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450539137	GD	On-Demand	Anodyne	CCR3	60	33
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450539137	GD	On-Demand	Anodyne	BIRC2	45	38
O=C(O)CCCCC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450539139	FH	On-Demand	Anodyne	HDAC6	26	43
O=C(O)CCCCC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450539139	FH	On-Demand	Anodyne	SLC1A2	40	33
O=C(O)CCCCC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450539139	FH	On-Demand	Anodyne	PARP10	0	42
Cc1ccc(C2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CC2)cn1	ZINC000450539142	GH	On-Demand	Bother	CACNA1C	54	34
Cc1ccc(C2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CC2)cn1	ZINC000450539142	GH	On-Demand	Bother	CACNA1D	80	34
CC(=O)c1ccc(NC(=O)Cc2cn(C)nc2C)cc1Cl	ZINC000450539143	DF	On-Demand	Anodyne	IMDH_CRYPV	37	43
OC[C@H](CNc1ccnc2cc(F)c(Cl)cc12)C1CC1	ZINC000450539152	CG	On-Demand	Anodyne	HRP1_PLAFA	84	38
OC[C@H](CNc1ccnc2cc(F)c(Cl)cc12)C1CC1	ZINC000450539152	CG	On-Demand	Anodyne	HNMT	50	36
OC[C@@H](CNc1ccnc2cc(F)c(Cl)cc12)C1CC1	ZINC000450539153	CG	On-Demand	Anodyne	HRP1_PLAFA	84	38
OC[C@@H](CNc1ccnc2cc(F)c(Cl)cc12)C1CC1	ZINC000450539153	CG	On-Demand	Anodyne	HNMT	50	36
CC(=O)c1ccc(NC(=O)c2cn(CC(C)C)nc2C(F)F)cc1Cl	ZINC000450539157	FJ	On-Demand	Anodyne	IKBKB	43	32
COC(=O)CN1CCC[C@H](CNc2nccc(C)c2C#N)C1	ZINC000450539164	DD	On-Demand	Mild	BDKRB1	26	41
COC(=O)CN1CCC[C@@H](CNc2nccc(C)c2C#N)C1	ZINC000450539165	DD	On-Demand	Mild	BDKRB1	26	41
COc1ccc(-c2noc(N3C[C@@H](C)S(=O)(=O)[C@H](C)C3)n2)cc1	ZINC000450539169	ED	On-Demand	Anodyne	S1PR1	15	42
COc1ccc(-c2noc(N3C[C@@H](C)S(=O)(=O)[C@H](C)C3)n2)cc1	ZINC000450539169	ED	On-Demand	Anodyne	LUCI_PHOPE	15	43
COc1ccc(-c2noc(N3C[C@H](C)S(=O)(=O)[C@H](C)C3)n2)cc1	ZINC000450539170	ED	On-Demand	Anodyne	S1PR1	15	42
COc1ccc(-c2noc(N3C[C@H](C)S(=O)(=O)[C@H](C)C3)n2)cc1	ZINC000450539170	ED	On-Demand	Anodyne	LUCI_PHOPE	15	43
COc1ccc(-c2noc(N3C[C@H](C)S(=O)(=O)[C@@H](C)C3)n2)cc1	ZINC000450539171	ED	On-Demand	Anodyne	S1PR1	15	42
COc1ccc(-c2noc(N3C[C@H](C)S(=O)(=O)[C@@H](C)C3)n2)cc1	ZINC000450539171	ED	On-Demand	Anodyne	LUCI_PHOPE	15	43
Cc1ccc(C2CCN(C(=O)[C@@H]3CCCCN3C3CCCC3)CC2)cn1	ZINC000450539172	FH	On-Demand	Anodyne	PREP	40	35
Cc1ccc(C2CCN(C(=O)[C@H]3CCCCN3C3CCCC3)CC2)cn1	ZINC000450539173	FH	On-Demand	Anodyne	PREP	40	35
COCC1(CNc2ncc([N+](=O)[O-])c(C)n2)CCCCC1	ZINC000450539180	CF	On-Demand	Bother	PRKCQ	44	35
Cc1ccc(C2CCN(C(=O)c3ccsc3C)CC2)cn1	ZINC000450539186	DH	On-Demand	Anodyne	FASN	42	35
COc1cc(CC(=O)N[C@H](C)C[C@@H](C)O)ccc1Cl	ZINC000450539195	CE	On-Demand	Anodyne	AVPR1A	0	40
COc1cc(CC(=O)N[C@H](C)C[C@@H](C)O)ccc1Cl	ZINC000450539195	CE	On-Demand	Anodyne	TRPV1	32	40
COc1cc(CC(=O)N[C@H](C)C[C@@H](C)O)ccc1Cl	ZINC000450539195	CE	On-Demand	Anodyne	NCE103	26	43
COc1cc(CC(=O)N[C@@H](C)C[C@H](C)O)ccc1Cl	ZINC000450539196	CE	On-Demand	Anodyne	AVPR1A	0	40
COc1cc(CC(=O)N[C@@H](C)C[C@H](C)O)ccc1Cl	ZINC000450539196	CE	On-Demand	Anodyne	TRPV1	32	40
COc1cc(CC(=O)N[C@@H](C)C[C@H](C)O)ccc1Cl	ZINC000450539196	CE	On-Demand	Anodyne	NCE103	26	43
COc1cc(CC(=O)N[C@@H](C)C[C@@H](C)O)ccc1Cl	ZINC000450539197	CE	On-Demand	Anodyne	AVPR1A	0	40
COc1cc(CC(=O)N[C@@H](C)C[C@@H](C)O)ccc1Cl	ZINC000450539197	CE	On-Demand	Anodyne	TRPV1	32	40
COc1cc(CC(=O)N[C@@H](C)C[C@@H](C)O)ccc1Cl	ZINC000450539197	CE	On-Demand	Anodyne	NCE103	26	43
COc1cc(CC(=O)N[C@H](C)C[C@H](C)O)ccc1Cl	ZINC000450539198	CE	On-Demand	Anodyne	AVPR1A	0	40
COc1cc(CC(=O)N[C@H](C)C[C@H](C)O)ccc1Cl	ZINC000450539198	CE	On-Demand	Anodyne	TRPV1	32	40
COc1cc(CC(=O)N[C@H](C)C[C@H](C)O)ccc1Cl	ZINC000450539198	CE	On-Demand	Anodyne	NCE103	26	43
CC(=O)c1ccc(NC(=O)CC[C@@H]2CCC(=O)N2)cc1Cl	ZINC000450539205	DF	On-Demand	Anodyne	PTPRF	41	31
CC(=O)c1ccc(NC(=O)CC[C@H]2CCC(=O)N2)cc1Cl	ZINC000450539206	DF	On-Demand	Anodyne	PTPRF	41	31
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539225	FH	On-Demand	Anodyne	TBXAS1	37	40
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539225	FH	On-Demand	Anodyne	AKR1C3	0	40
Cc1cccc(C)c1[C@H](C)NC(=O)CCc1ccccc1C(=O)O	ZINC000450539234	EH	On-Demand	Anodyne	PTGER4	0	45
Cc1cccc(C)c1[C@H](C)NC(=O)CCc1ccccc1C(=O)O	ZINC000450539234	EH	On-Demand	Anodyne	PTGER3	40	34
Cc1cccc(C)c1[C@@H](C)NC(=O)CCc1ccccc1C(=O)O	ZINC000450539236	EH	On-Demand	Anodyne	PTGER4	0	45
Cc1cccc(C)c1[C@@H](C)NC(=O)CCc1ccccc1C(=O)O	ZINC000450539236	EH	On-Demand	Anodyne	PTGER3	40	34
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCCOC(C)C	ZINC000450539247	DH	On-Demand	Anodyne	PPARA	18	44
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCCOC(C)C	ZINC000450539247	DH	On-Demand	Anodyne	PPARD	31	44
Cc1ccc(C(=O)N2CCC(CCCn3ccnc3)CC2)c2c1CCC2	ZINC000450539255	FI	On-Demand	Anodyne	TBXAS1	47	44
Cc1ccc(C(=O)N2CCC(CCCn3ccnc3)CC2)c2c1CCC2	ZINC000450539255	FI	On-Demand	Anodyne	L3MBTL3	49	33
O=C(c1ccsc1Br)N1CCC(CCCn2ccnc2)CC1	ZINC000450539258	GI	On-Demand	Anodyne	TBXAS1	45	41
CC(C)CCCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450539280	CG	On-Demand	Bother	AADAC	0	40
CN1CCC2(CCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450539295	FF	On-Demand	Anodyne	EPHX2	15	41
CN1CCC2(CCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450539295	FF	On-Demand	Anodyne	MCHR1	17	52
CN1CCC2(CCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450539295	FF	On-Demand	Anodyne	CACNA1I	15	47
COC(=O)[C@H]1CCN(c2nccc(-c3ccc(OC)cc3)n2)[C@H]1C(C)C	ZINC000450539305	FG	On-Demand	Anodyne	DKK1	0	40
CCc1cccc(C(=O)NCC(CNC(=O)c2cccc(CC)n2)OC)n1	ZINC000450539306	FD	On-Demand	Anodyne	PDE5A	27	43
CCN1C(=O)C[C@H](C(=O)NCCCCOC(C)C)[C@H]1c1cccnc1	ZINC000450539315	EE	On-Demand	Anodyne	NAMPT	17	45
N#Cc1c(Cl)cccc1NCC(=O)NCCN1CCCCCC1	ZINC000450539316	EF	On-Demand	Mild	DRD4	46	37
N#Cc1c(Cl)cccc1NCC(=O)NCCN1CCCCCC1	ZINC000450539316	EF	On-Demand	Mild	HNMT	44	34
O=C(CCC(=O)N1CCC(CCCn2ccnc2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000450539322	GG	On-Demand	Bother	TBXAS1	28	44
CN1CC[C@@]2(CCN(c3ncnc4[nH]c5ccccc5c34)C2)C1	ZINC000450539323	DF	On-Demand	Anodyne	AKT1	33	42
CN1CC[C@]2(CCN(c3ncnc4[nH]c5ccccc5c34)C2)C1	ZINC000450539324	DF	On-Demand	Anodyne	AKT1	33	42
CSC[C@@H]1CCCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450539325	DH	On-Demand	Anodyne	UTS2R	0	40
CSC[C@H]1CCCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450539326	DH	On-Demand	Anodyne	UTS2R	0	40
Cc1ccc(C2CCN(C(=O)c3cncc(Cl)c3)CC2)cn1	ZINC000450539334	DG	On-Demand	Anodyne	FASN	42	36
Cc1ccc(C2CCN(C(=O)c3cncc(Cl)c3)CC2)cn1	ZINC000450539334	DG	On-Demand	Anodyne	L3MBTL1	0	40
Cc1ccc(C2CCN(C(=O)c3cncc(Cl)c3)CC2)cn1	ZINC000450539334	DG	On-Demand	Anodyne	L3MBTL3	41	32
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](C)C[C@H](C)O)cc2)c1	ZINC000450539352	FF	On-Demand	Anodyne	E1	0	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](C)C[C@H](C)O)cc2)c1	ZINC000450539353	FF	On-Demand	Anodyne	E1	0	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](C)C[C@@H](C)O)cc2)c1	ZINC000450539354	FF	On-Demand	Anodyne	E1	0	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](C)C[C@@H](C)O)cc2)c1	ZINC000450539355	FF	On-Demand	Anodyne	E1	0	44
C[C@H](O)C[C@@H](C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450539357	CD	On-Demand	Anodyne	AVPR1A	15	40
C[C@@H](C[C@@H](C)O)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450539358	CD	On-Demand	Anodyne	AVPR1A	15	40
C[C@H](O)C[C@H](C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450539359	CD	On-Demand	Anodyne	AVPR1A	15	40
C[C@@H](O)C[C@@H](C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450539360	CD	On-Demand	Anodyne	AVPR1A	15	40
COc1ccc(-c2ccnc(NC[C@@H](CO)C3CC3)n2)cc1	ZINC000450539361	CF	On-Demand	Anodyne	MAPK1	42	39
COc1ccc(-c2ccnc(NC[C@@H](CO)C3CC3)n2)cc1	ZINC000450539361	CF	On-Demand	Anodyne	CLK4	26	52
COc1ccc(-c2ccnc(NC[C@H](CO)C3CC3)n2)cc1	ZINC000450539362	CF	On-Demand	Anodyne	MAPK1	42	39
COc1ccc(-c2ccnc(NC[C@H](CO)C3CC3)n2)cc1	ZINC000450539362	CF	On-Demand	Anodyne	CLK4	26	52
COC(=O)CN1CCC[C@H](CNc2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450539370	FD	On-Demand	Bother	PRKCQ	44	34
COC(=O)CN1CCC[C@@H](CNc2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450539371	FD	On-Demand	Bother	PRKCQ	44	34
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	F2	58	41
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	ACE	46	41
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	OPRM1	25	42
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	OPRD1	0	40
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	CELA1	53	39
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	ELANE	83	48
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	HLA-DRB3	46	37
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	CMA1	41	39
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	TRY1_BOVIN	88	38
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	NTSR1	60	33
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	CTSG	41	32
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	HLA-A	49	34
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	PREP	83	47
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	CELA2A	41	32
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	LGMN	66	39
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	TPP2	44	39
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	XIAP	81	46
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	BRCA1	69	38
C[C@@H](C[C@@H](C)O)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539387	DD	On-Demand	Anodyne	TMPRSS11D	57	40
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	F2	58	41
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	ACE	46	41
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	OPRM1	25	42
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	OPRD1	0	40
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	CELA1	53	39
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	ELANE	83	48
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	HLA-DRB3	46	37
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	CMA1	41	39
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	TRY1_BOVIN	88	38
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	NTSR1	60	33
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	CTSG	41	32
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	HLA-A	49	34
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	PREP	83	47
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	CELA2A	41	32
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	LGMN	66	39
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	TPP2	44	39
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	XIAP	81	46
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	BRCA1	69	38
C[C@@H](O)C[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450539388	DD	On-Demand	Anodyne	TMPRSS11D	57	40
Cc1cc(NC(=O)CS(=O)(=O)C2CC2)c2ncccc2c1	ZINC000450539406	DE	On-Demand	Anodyne	C0L093_TOBAC	49	32
CC[C@@H](CC(C)C)C(=O)N1CCC(c2ccc(C)nc2)CC1	ZINC000450539411	DI	On-Demand	Anodyne	CCR1	42	42
CC[C@H](CC(C)C)C(=O)N1CCC(c2ccc(C)nc2)CC1	ZINC000450539412	DI	On-Demand	Anodyne	CCR1	42	42
O=[N+]([O-])c1cccc2c(NCC3CC(F)(F)C3)nccc12	ZINC000450539417	CH	On-Demand	Bother	PRKCQ	47	38
CN(C)S(=O)(=O)CCNc1ccnc2cc(F)c(Br)cc12	ZINC000450539418	GE	On-Demand	Anodyne	HRP1_PLAFA	118	39
CN(C)S(=O)(=O)CCNc1ccnc2cc(F)c(Br)cc12	ZINC000450539418	GE	On-Demand	Anodyne	HNMT	44	37
CN(C)S(=O)(=O)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450539421	EE	On-Demand	Anodyne	HRP1_PLAFA	91	38
CN(C)S(=O)(=O)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450539421	EE	On-Demand	Anodyne	HNMT	52	39
C=CC(C)(C)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450539434	CG	On-Demand	Mild	TBXAS1	33	40
CC(C)OCCCCNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450539435	DI	On-Demand	Anodyne	SLC6A1	0	42
CC(C)OCCCCNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450539435	DI	On-Demand	Anodyne	AMY2	50	34
CC(C)CCCC(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450539440	DH	On-Demand	Anodyne	TBXAS1	23	45
CC(C)CCCC(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450539440	DH	On-Demand	Anodyne	GNAI3	0	42
C[C@@H](NC(=O)CCc1ccccc1C(=O)O)c1cccc(OC(F)(F)F)c1	ZINC000450539445	GI	On-Demand	Anodyne	PTGER3	64	40
C[C@H](NC(=O)CCc1ccccc1C(=O)O)c1cccc(OC(F)(F)F)c1	ZINC000450539446	GI	On-Demand	Anodyne	PTGER3	64	40
COc1cc(CC(=O)N(CCO)Cc2ccc(C)cc2)ccc1Cl	ZINC000450539451	EG	On-Demand	Anodyne	PDE6A	41	31
CC(C)OCCCCNC(=O)c1cc2cccnc2s1	ZINC000450539454	CG	On-Demand	Anodyne	TBXAS1	15	40
COc1ccc(-c2ccnc(N3CCC[C@H](CSC)C3)n2)cc1	ZINC000450539461	EH	On-Demand	Anodyne	DKK1	0	41
COc1ccc(-c2ccnc(N3CCC[C@@H](CSC)C3)n2)cc1	ZINC000450539462	EH	On-Demand	Anodyne	DKK1	0	41
COC(=O)[C@H]1CCN(c2ccc(I)cn2)[C@H]1C(C)C	ZINC000450539477	FF	On-Demand	Anodyne	SLC6A1	0	40
N#Cc1cnc(NC[C@@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1	ZINC000450539478	DG	On-Demand	Mild	PRKCQ	42	38
N#Cc1cnc(NC[C@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1	ZINC000450539479	DG	On-Demand	Mild	PRKCQ	42	38
COc1cccc2c(N3CCC[C@@H](CSC)C3)nccc12	ZINC000450539498	DH	On-Demand	Anodyne	PDE3A	27	40
COc1cccc2c(N3CCC[C@H](CSC)C3)nccc12	ZINC000450539499	DH	On-Demand	Anodyne	PDE3A	42	40
COc1cccc2c(N3CCC[C@H](CSC)C3)nccc12	ZINC000450539499	DH	On-Demand	Anodyne	PDE3B	45	40
CC[C@@H]1C[C@H]1C(=O)NCc1ccnc(NC(=O)[C@@H]2C[C@H]2CC)c1	ZINC000450539500	DF	On-Demand	Anodyne	TYK2	67	39
CCOc1nc2ccc(C(=O)N3CCC(CCCn4ccnc4)CC3)cc2[nH]1	ZINC000450539503	GG	On-Demand	Anodyne	TBXAS1	44	41
CCOc1nc2ccc(C(=O)N3CCC(CCCn4ccnc4)CC3)cc2[nH]1	ZINC000450539503	GG	On-Demand	Anodyne	CHEK2	20	40
O=C(O)c1ccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539506	FD	On-Demand	Anodyne	L3MBTL1	0	50
O=C(O)c1ccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539506	FD	On-Demand	Anodyne	L3MBTL3	105	50
O=C(O)c1ccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539506	FD	On-Demand	Anodyne	L3MBTL4	0	42
O=C(O)c1ccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539506	FD	On-Demand	Anodyne	MBTD1	0	47
O=C(O)c1ccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539506	FD	On-Demand	Anodyne	TP53BP1	0	42
O=C(O)c1ccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539507	FD	On-Demand	Anodyne	L3MBTL1	0	50
O=C(O)c1ccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539507	FD	On-Demand	Anodyne	L3MBTL3	105	50
O=C(O)c1ccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539507	FD	On-Demand	Anodyne	L3MBTL4	0	42
O=C(O)c1ccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539507	FD	On-Demand	Anodyne	MBTD1	0	47
O=C(O)c1ccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450539507	FD	On-Demand	Anodyne	TP53BP1	0	42
Cc1cccc(C)c1[C@@H](C)NC(=O)CCCCC(=O)O	ZINC000450539517	CG	On-Demand	Anodyne	Q6UB75_PIG	0	40
Cc1cccc(C)c1[C@@H](C)NC(=O)CCCCC(=O)O	ZINC000450539517	CG	On-Demand	Anodyne	ACER2	0	42
Cc1cccc(C)c1[C@@H](C)NC(=O)CCCCC(=O)O	ZINC000450539517	CG	On-Demand	Anodyne	COL4A3BP	0	41
Cc1cccc(C)c1[C@H](C)NC(=O)CCCCC(=O)O	ZINC000450539518	CG	On-Demand	Anodyne	Q6UB75_PIG	0	40
Cc1cccc(C)c1[C@H](C)NC(=O)CCCCC(=O)O	ZINC000450539518	CG	On-Demand	Anodyne	ACER2	0	42
Cc1cccc(C)c1[C@H](C)NC(=O)CCCCC(=O)O	ZINC000450539518	CG	On-Demand	Anodyne	COL4A3BP	0	41
O=C(O)[C@@H]1CC[C@@H](C(=O)N[C@H]2CCCOc3c(Cl)cccc32)CC1	ZINC000450539519	FH	On-Demand	Anodyne	CNR1	31	44
O=C(O)C1CCC(C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)CC1	ZINC000450539520	FH	On-Demand	Anodyne	CNR1	31	44
O=C(O)[C@@H]1CC[C@@H](C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)CC1	ZINC000450539521	FH	On-Demand	Anodyne	CNR1	31	44
O=C(O)C1CCC(C(=O)N[C@H]2CCCOc3c(Cl)cccc32)CC1	ZINC000450539522	FH	On-Demand	Anodyne	CNR1	31	44
CCOC(=O)c1csc(N2CCN(c3cccc(F)c3)C[C@H]2C)n1	ZINC000450539524	EG	On-Demand	Anodyne	CCKAR	41	33
CCOC(=O)c1csc(N2CCN(c3cccc(F)c3)C[C@@H]2C)n1	ZINC000450539525	EG	On-Demand	Anodyne	CCKAR	41	33
O=C(O)CSCC(=O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450539526	DE	On-Demand	Anodyne	KLK5	41	38
O=C(O)CSCC(=O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450539527	DE	On-Demand	Anodyne	KLK5	41	38
O=C(O)CSCC(=O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450539528	DE	On-Demand	Anodyne	KLK5	41	38
O=C(O)CSCC(=O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450539529	DE	On-Demand	Anodyne	KLK5	41	38
C[C@@H](NC(=O)[C@@H]1CC[C@@H](C(=O)O)CC1)c1cccc(OC(F)(F)F)c1	ZINC000450539532	FH	On-Demand	Anodyne	ACACA	0	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncc(C(F)F)cn2)C1	ZINC000450539537	EF	On-Demand	Anodyne	ADRA1D	20	44
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncc(C(F)F)cn2)C1	ZINC000450539537	EF	On-Demand	Anodyne	ADRA1A	17	44
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncc(C(F)F)cn2)C1	ZINC000450539537	EF	On-Demand	Anodyne	ADRA1B	15	44
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncc(C(F)F)cn2)C1	ZINC000450539537	EF	On-Demand	Anodyne	KCNA3	17	42
COC(=O)[C@]1(c2ccccc2)CCN(c2ncc(C(F)F)cn2)C1	ZINC000450539538	EF	On-Demand	Anodyne	ADRA1D	20	44
COC(=O)[C@]1(c2ccccc2)CCN(c2ncc(C(F)F)cn2)C1	ZINC000450539538	EF	On-Demand	Anodyne	ADRA1A	17	44
COC(=O)[C@]1(c2ccccc2)CCN(c2ncc(C(F)F)cn2)C1	ZINC000450539538	EF	On-Demand	Anodyne	ADRA1B	15	44
COC(=O)[C@]1(c2ccccc2)CCN(c2ncc(C(F)F)cn2)C1	ZINC000450539538	EF	On-Demand	Anodyne	KCNA3	17	42
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	AVPR2	42	38
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	MAPK14	17	42
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	NPY2R	47	36
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	COLA	29	44
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	PRNP	40	34
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	PIK3CD	16	43
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	NR1H4	0	40
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	EPHX2	22	45
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	PIK3CB	30	45
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	STAT6	41	30
CC(=O)c1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1Cl	ZINC000450539539	GH	On-Demand	Anodyne	DGAT1	25	43
C[C@H](O)C[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450539551	CE	On-Demand	Anodyne	SELE	62	38
C[C@H](O)C[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450539551	CE	On-Demand	Anodyne	ICAM1	50	31
C[C@@H](C[C@@H](C)O)NC(=O)c1cc2ccncc2s1	ZINC000450539552	CE	On-Demand	Anodyne	SELE	62	38
C[C@@H](C[C@@H](C)O)NC(=O)c1cc2ccncc2s1	ZINC000450539552	CE	On-Demand	Anodyne	ICAM1	50	31
C[C@H](O)C[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450539553	CE	On-Demand	Anodyne	SELE	62	38
C[C@H](O)C[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450539553	CE	On-Demand	Anodyne	ICAM1	50	31
C[C@@H](O)C[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450539554	CE	On-Demand	Anodyne	SELE	62	38
C[C@@H](O)C[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450539554	CE	On-Demand	Anodyne	ICAM1	50	31
C[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)S1(=O)=O	ZINC000450539556	FE	On-Demand	Anodyne	PDE3A	45	35
C[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)S1(=O)=O	ZINC000450539556	FE	On-Demand	Anodyne	PDE3B	44	35
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)S1(=O)=O	ZINC000450539557	FE	On-Demand	Anodyne	PDE3A	45	35
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)S1(=O)=O	ZINC000450539557	FE	On-Demand	Anodyne	PDE3B	44	35
C[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H](C)S1(=O)=O	ZINC000450539558	FE	On-Demand	Anodyne	PDE3A	45	35
C[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H](C)S1(=O)=O	ZINC000450539558	FE	On-Demand	Anodyne	PDE3B	44	35
OC[C@H](Nc1ncnc2cc(Br)ccc12)C1CCCC1	ZINC000450539559	EG	On-Demand	Anodyne	EGFR	42	37
OC[C@@H](Nc1ncnc2cc(Br)ccc12)C1CCCC1	ZINC000450539560	EG	On-Demand	Anodyne	EGFR	42	37
COC(=O)c1ccccc1CC1CCN(c2nccc(C#N)n2)CC1	ZINC000450539561	EF	On-Demand	Mild	DKK1	0	42
O=C(O)c1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)s1	ZINC000450539571	EG	On-Demand	Anodyne	L3MBTL1	0	47
O=C(O)c1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)s1	ZINC000450539572	EG	On-Demand	Anodyne	L3MBTL1	0	47
COC(=O)c1ccccc1CC1CCN(c2nccc(-c3cnccn3)n2)CC1	ZINC000450539580	GG	On-Demand	Anodyne	DKK1	0	49
N#Cc1ccc(O[C@H]2CCN(c3nc4c(cc3C#N)COCC4)C2)nc1	ZINC000450539585	ED	On-Demand	Mild	PDE3B	44	38
N#Cc1ccc(O[C@@H]2CCN(c3nc4c(cc3C#N)COCC4)C2)nc1	ZINC000450539586	ED	On-Demand	Mild	PDE3B	44	38
COCC1(CNc2nccc(-c3ccc(OC)cc3)n2)CCOCC1	ZINC000450539594	EG	On-Demand	Anodyne	CLK4	25	52
COCC1(CNc2nccc(-c3ccc(OC)cc3)n2)CCOCC1	ZINC000450539594	EG	On-Demand	Anodyne	SMG1	42	34
CC(=O)c1ccc(NC(=O)[C@H]2CCCCC2(F)F)cc1Cl	ZINC000450539609	DI	On-Demand	Anodyne	TYK2	46	37
CC(=O)c1ccc(NC(=O)[C@H]2CCCCC2(F)F)cc1Cl	ZINC000450539609	DI	On-Demand	Anodyne	ENV	42	32
CC(=O)c1ccc(NC(=O)[C@@H]2CCCCC2(F)F)cc1Cl	ZINC000450539610	DI	On-Demand	Anodyne	TYK2	46	37
CC(=O)c1ccc(NC(=O)[C@@H]2CCCCC2(F)F)cc1Cl	ZINC000450539610	DI	On-Demand	Anodyne	ENV	42	32
CN(C)S(=O)(=O)N1CCCN(c2nccc3cc([N+](=O)[O-])ccc23)CC1	ZINC000450539612	GD	On-Demand	Bother	SORD	19	41
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[C@H](C)O)ccc21	ZINC000450539613	FF	On-Demand	Anodyne	PDGFRB	0	46
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[C@H](C)O)ccc21	ZINC000450539613	FF	On-Demand	Anodyne	CPT1A	46	34
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[C@H](C)O)ccc21	ZINC000450539613	FF	On-Demand	Anodyne	PLK1	48	33
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[C@H](C)O)ccc21	ZINC000450539613	FF	On-Demand	Anodyne	HPGD	47	57
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[C@H](C)O)ccc21	ZINC000450539614	FF	On-Demand	Anodyne	PDGFRB	0	46
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[C@H](C)O)ccc21	ZINC000450539614	FF	On-Demand	Anodyne	CPT1A	46	34
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[C@H](C)O)ccc21	ZINC000450539614	FF	On-Demand	Anodyne	PLK1	48	33
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[C@H](C)O)ccc21	ZINC000450539614	FF	On-Demand	Anodyne	HPGD	47	57
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[C@@H](C)O)ccc21	ZINC000450539615	FF	On-Demand	Anodyne	PDGFRB	0	46
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[C@@H](C)O)ccc21	ZINC000450539615	FF	On-Demand	Anodyne	CPT1A	46	34
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[C@@H](C)O)ccc21	ZINC000450539615	FF	On-Demand	Anodyne	PLK1	48	33
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[C@@H](C)O)ccc21	ZINC000450539615	FF	On-Demand	Anodyne	HPGD	47	57
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[C@@H](C)O)ccc21	ZINC000450539616	FF	On-Demand	Anodyne	PDGFRB	0	46
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[C@@H](C)O)ccc21	ZINC000450539616	FF	On-Demand	Anodyne	CPT1A	46	34
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[C@@H](C)O)ccc21	ZINC000450539616	FF	On-Demand	Anodyne	PLK1	48	33
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[C@@H](C)O)ccc21	ZINC000450539616	FF	On-Demand	Anodyne	HPGD	47	57
CCc1cc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)ccn1	ZINC000450539620	DF	On-Demand	Anodyne	ADRA1D	19	40
CCc1cc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)ccn1	ZINC000450539620	DF	On-Demand	Anodyne	ADRA1A	19	40
CCc1cc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)ccn1	ZINC000450539620	DF	On-Demand	Anodyne	ADRA1B	15	40
CCc1cc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)ccn1	ZINC000450539620	DF	On-Demand	Anodyne	KCNA3	17	42
CCc1cc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)ccn1	ZINC000450539621	DF	On-Demand	Anodyne	ADRA1D	19	40
CCc1cc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)ccn1	ZINC000450539621	DF	On-Demand	Anodyne	ADRA1A	19	40
CCc1cc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)ccn1	ZINC000450539621	DF	On-Demand	Anodyne	ADRA1B	15	40
CCc1cc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)ccn1	ZINC000450539621	DF	On-Demand	Anodyne	KCNA3	17	42
O=C(O)c1ccccc1CC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450539622	EG	On-Demand	Anodyne	FABP4	50	45
O=C(O)c1ccccc1CC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450539623	EG	On-Demand	Anodyne	FABP4	50	45
C[C@H](NC(=O)[C@@H]1CC[C@@H](C(=O)O)CC1)c1cccc(OC(F)(F)F)c1	ZINC000450539633	FH	On-Demand	Anodyne	ACACA	0	40
C[C@H](NC(=O)C1CCC(C(=O)O)CC1)c1cccc(OC(F)(F)F)c1	ZINC000450539634	FH	On-Demand	Anodyne	ACACA	0	40
C[C@@H](NC(=O)C1CCC(C(=O)O)CC1)c1cccc(OC(F)(F)F)c1	ZINC000450539635	FH	On-Demand	Anodyne	ACACA	0	40
N#Cc1ccnc(NCC[C@H](c2ccccc2)C(F)(F)F)n1	ZINC000450539661	DG	On-Demand	Mild	HTR7	18	43
N#Cc1ccnc(NCC[C@@H](c2ccccc2)C(F)(F)F)n1	ZINC000450539662	DG	On-Demand	Mild	HTR7	18	43
COc1cc(CC(=O)N2CCC(CCCn3ccnc3)CC2)ccc1O	ZINC000450539664	FF	On-Demand	Anodyne	TBXAS1	42	34
COc1cc(CC(=O)N2CCC(CCCn3ccnc3)CC2)ccc1O	ZINC000450539664	FF	On-Demand	Anodyne	QPCT	28	49
O=C(c1cccc(C(F)(F)F)n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539666	FH	On-Demand	Anodyne	HMOX2	45	33
O=C(c1cccc(C(F)(F)F)n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539666	FH	On-Demand	Anodyne	SFRP1	20	40
O=C(O)C1(C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)CC1	ZINC000450539670	DF	On-Demand	Anodyne	CNR1	31	42
O=C(O)C1(C(=O)N[C@H]2CCCOc3c(Cl)cccc32)CC1	ZINC000450539671	DF	On-Demand	Anodyne	CNR1	31	42
C[C@H]1CN(C(=O)Cc2cc3ccccc3s2)C[C@@H]1O	ZINC000450539682	CE	On-Demand	Anodyne	AROQ	22	40
C[C@H]1CN(C(=O)Cc2cc3ccccc3s2)C[C@H]1O	ZINC000450539683	CE	On-Demand	Anodyne	AROQ	22	40
C[C@@H]1CN(C(=O)Cc2cc3ccccc3s2)C[C@@H]1O	ZINC000450539684	CE	On-Demand	Anodyne	AROQ	22	40
C[C@@H]1CN(C(=O)Cc2cc3ccccc3s2)C[C@H]1O	ZINC000450539685	CE	On-Demand	Anodyne	AROQ	22	40
O=[N+]([O-])c1cccc2c(NC[C@H]3CC[C@@H](CO)O3)nccc12	ZINC000450539696	DE	On-Demand	Bother	PRKCQ	45	35
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450539697	CF	On-Demand	Bother	AADAC	0	40
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539702	GG	On-Demand	Bother	PRKCD	40	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539702	GG	On-Demand	Bother	PRKCE	30	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539702	GG	On-Demand	Bother	PRKCH	37	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539702	GG	On-Demand	Bother	PRKCA	57	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539702	GG	On-Demand	Bother	PRKCB	22	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539702	GG	On-Demand	Bother	PRKACA	48	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539703	GG	On-Demand	Bother	PRKCD	40	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539703	GG	On-Demand	Bother	PRKCE	30	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539703	GG	On-Demand	Bother	PRKCH	37	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539703	GG	On-Demand	Bother	PRKCA	57	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539703	GG	On-Demand	Bother	PRKCB	22	49
O=C(O)c1cc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539703	GG	On-Demand	Bother	PRKACA	48	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539704	GG	On-Demand	Bother	PRKCD	40	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539704	GG	On-Demand	Bother	PRKCE	30	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539704	GG	On-Demand	Bother	PRKCH	37	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539704	GG	On-Demand	Bother	PRKCA	57	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539704	GG	On-Demand	Bother	PRKCB	22	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539704	GG	On-Demand	Bother	PRKACA	48	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539705	GG	On-Demand	Bother	PRKCD	40	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539705	GG	On-Demand	Bother	PRKCE	30	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539705	GG	On-Demand	Bother	PRKCH	37	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539705	GG	On-Demand	Bother	PRKCA	57	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539705	GG	On-Demand	Bother	PRKCB	22	49
O=C(O)c1cc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000450539705	GG	On-Demand	Bother	PRKACA	48	49
COc1cccc2c(N3CCC(CS(C)(=O)=O)CC3)nccc12	ZINC000450539706	EF	On-Demand	Anodyne	PDE3A	46	36
COc1cccc2c(N3CCC(CS(C)(=O)=O)CC3)nccc12	ZINC000450539706	EF	On-Demand	Anodyne	PDE3B	69	37
COc1cccc(OCCC(=O)N2CCCC23CCN(C)CC3)c1	ZINC000450539717	EF	On-Demand	Anodyne	DRD4	41	31
O=C(O)c1coc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450539724	EF	On-Demand	Anodyne	PRKCD	41	51
O=C(O)c1coc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450539724	EF	On-Demand	Anodyne	PRKCE	30	51
O=C(O)c1coc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450539724	EF	On-Demand	Anodyne	PRKCA	58	51
O=C(O)c1coc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450539724	EF	On-Demand	Anodyne	PRKACA	53	51
O=C(O)c1coc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450539725	EF	On-Demand	Anodyne	PRKCD	41	51
O=C(O)c1coc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450539725	EF	On-Demand	Anodyne	PRKCE	30	51
O=C(O)c1coc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450539725	EF	On-Demand	Anodyne	PRKCA	58	51
O=C(O)c1coc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450539725	EF	On-Demand	Anodyne	PRKACA	53	51
O=C(O)c1coc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450539726	EF	On-Demand	Anodyne	PRKCD	41	51
O=C(O)c1coc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450539726	EF	On-Demand	Anodyne	PRKCE	30	51
O=C(O)c1coc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450539726	EF	On-Demand	Anodyne	PRKCA	58	51
O=C(O)c1coc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450539726	EF	On-Demand	Anodyne	PRKACA	53	51
O=C(O)c1coc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450539727	EF	On-Demand	Anodyne	PRKCD	41	51
O=C(O)c1coc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450539727	EF	On-Demand	Anodyne	PRKCE	30	51
O=C(O)c1coc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450539727	EF	On-Demand	Anodyne	PRKCA	58	51
O=C(O)c1coc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450539727	EF	On-Demand	Anodyne	PRKACA	53	51
C/C=C\COc1cccc(CC(=O)N2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450539746	FI	On-Demand	Anodyne	BRS3	22	40
C/C=C/COc1cccc(CC(=O)N2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450539747	FI	On-Demand	Anodyne	BRS3	22	40
CNc1nc(N2CC[C@H](Oc3ccc(C#N)cn3)C2)nc2ccccc12	ZINC000450539761	EE	On-Demand	Mild	PDE3A	43	40
CNc1nc(N2CC[C@H](Oc3ccc(C#N)cn3)C2)nc2ccccc12	ZINC000450539761	EE	On-Demand	Mild	PDE3B	64	40
CNc1nc(N2CC[C@@H](Oc3ccc(C#N)cn3)C2)nc2ccccc12	ZINC000450539762	EE	On-Demand	Mild	PDE3A	43	40
CNc1nc(N2CC[C@@H](Oc3ccc(C#N)cn3)C2)nc2ccccc12	ZINC000450539762	EE	On-Demand	Mild	PDE3B	64	40
CC[C@@H](CNc1ncnc2cc(Br)ccc12)OC	ZINC000450539776	DF	On-Demand	Anodyne	EGFR	63	42
CC[C@@H](CNc1ncnc2cc(Br)ccc12)OC	ZINC000450539776	DF	On-Demand	Anodyne	FBP1	18	42
CC[C@@H](CNc1ncnc2cc(Br)ccc12)OC	ZINC000450539776	DF	On-Demand	Anodyne	ERBB4	20	42
CC[C@@H](CNc1ncnc2cc(Br)ccc12)OC	ZINC000450539776	DF	On-Demand	Anodyne	MKNK1	20	41
CC[C@H](CNc1ncnc2cc(Br)ccc12)OC	ZINC000450539777	DF	On-Demand	Anodyne	EGFR	63	42
CC[C@H](CNc1ncnc2cc(Br)ccc12)OC	ZINC000450539777	DF	On-Demand	Anodyne	FBP1	18	42
CC[C@H](CNc1ncnc2cc(Br)ccc12)OC	ZINC000450539777	DF	On-Demand	Anodyne	ERBB4	20	42
CC[C@H](CNc1ncnc2cc(Br)ccc12)OC	ZINC000450539777	DF	On-Demand	Anodyne	MKNK1	20	41
COc1ccc(-c2noc(N3CC[C@](CO)(c4ccccc4)C3)n2)cc1	ZINC000450539778	FF	On-Demand	Anodyne	COLA	0	42
COc1ccc(-c2noc(N3CC[C@@](CO)(c4ccccc4)C3)n2)cc1	ZINC000450539779	FF	On-Demand	Anodyne	COLA	0	42
CC(=O)c1ccc(NC(=O)c2ccn(C)c2C2CCC2)cc1Cl	ZINC000450539780	EI	On-Demand	Anodyne	AVPR2	41	36
Cc1cccnc1C(C)(C)CNc1ncc([N+](=O)[O-])c(C)n1	ZINC000450539783	DF	On-Demand	Bother	PRKCQ	43	39
O=C(O)CCCCC(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450539784	FG	On-Demand	Anodyne	CCR2	33	41
O=C(O)CCCCC(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450539784	FG	On-Demand	Anodyne	LIPG	42	32
O=C(O)CCCCC(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450539785	FG	On-Demand	Anodyne	CCR2	33	41
O=C(O)CCCCC(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450539785	FG	On-Demand	Anodyne	LIPG	42	32
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539788	GG	On-Demand	Anodyne	ADRA1D	18	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539788	GG	On-Demand	Anodyne	ADRA1A	19	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539788	GG	On-Demand	Anodyne	COLA	48	44
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539788	GG	On-Demand	Anodyne	CPT1A	41	44
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539788	GG	On-Demand	Anodyne	LUCI_PHOPE	21	40
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539789	GG	On-Demand	Anodyne	ADRA1D	18	41
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539789	GG	On-Demand	Anodyne	ADRA1A	19	41
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539789	GG	On-Demand	Anodyne	COLA	48	44
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539789	GG	On-Demand	Anodyne	CPT1A	41	44
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450539789	GG	On-Demand	Anodyne	LUCI_PHOPE	21	40
Cc1nn(C)cc1CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450539798	DG	In-Stock	Anodyne	P2RX7	40	34
O=C(CCc1ccc(C(=O)O)cc1)NCc1cc2c(cc1OC(F)F)OCO2	ZINC000450539800	GF	On-Demand	Anodyne	NOS2	68	31
O=C(CCc1ccc(C(=O)O)cc1)NCc1cc2c(cc1OC(F)F)OCO2	ZINC000450539800	GF	On-Demand	Anodyne	PDEC	0	44
CCc1cc(N2CC[C@@](CO)(c3ccccc3)C2)ccn1	ZINC000450539802	CF	On-Demand	Anodyne	SORD	40	37
CCc1cc(N2CC[C@](CO)(c3ccccc3)C2)ccn1	ZINC000450539803	CF	On-Demand	Anodyne	SORD	40	37
COc1ccc(OC(F)(F)F)c(C(=O)NCc2cn(C)nc2C)c1	ZINC000450539816	EF	On-Demand	Anodyne	MT-ND1	16	41
COC(=O)CN1CCC[C@H](CNc2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450539817	ED	On-Demand	Mild	PRKCQ	45	35
COC(=O)CN1CCC[C@@H](CNc2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450539818	ED	On-Demand	Mild	PRKCQ	45	35
CC(C)OCCCCNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450539837	CG	On-Demand	Anodyne	EPHX2	16	44
CC(C)OCCCCNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450539838	CG	On-Demand	Anodyne	EPHX2	16	44
CC(C)OCCCCNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450539839	CG	On-Demand	Anodyne	EPHX2	16	44
CC(C)OCCCCNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450539840	CG	On-Demand	Anodyne	EPHX2	16	44
CN(C)c1nc(N2CC[C@@H](CS(C)(=O)=O)C2)nc2ccccc12	ZINC000450539841	ED	On-Demand	Anodyne	ADRA2A	16	51
CN(C)c1nc(N2CC[C@H](CS(C)(=O)=O)C2)nc2ccccc12	ZINC000450539842	ED	On-Demand	Anodyne	ADRA2A	16	51
O=C(Cc1ccc(O)c(F)c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539847	EF	On-Demand	Anodyne	TBXAS1	24	43
CC(C)OCCCCNC(=O)CC1CC(F)(F)C1	ZINC000450539849	CF	On-Demand	Anodyne	EPHX2	33	44
Cc1ccc2c(c1)[C@H](Nc1ncc(C(F)F)cn1)CCC2	ZINC000450539852	CI	On-Demand	Anodyne	KCNN3	21	48
Cc1cc(CNc2nc(N(C)C)c3ccccc3n2)nc(N2CCCC2)n1	ZINC000450539860	FE	On-Demand	Anodyne	ADRA2A	16	46
CCCN(CC(N)=O)c1nc(N(C)C)c2ccccc2n1	ZINC000450539868	CD	On-Demand	Anodyne	TSPO	28	40
Cc1ccc(CN(CCO)C(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450539869	EG	On-Demand	Anodyne	ACAT	43	35
Cc1ccc(CN(CCO)C(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450539870	EG	On-Demand	Anodyne	ACAT	43	35
O=C(c1cc(Cl)c2ccccc2n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539874	GI	On-Demand	Anodyne	TBXAS1	54	40
O=C(c1cc(Cl)c2ccccc2n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539874	GI	On-Demand	Anodyne	HMOX2	47	35
O=C(O)c1cnc(C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)cn1	ZINC000450539888	EE	On-Demand	Anodyne	CNR1	31	44
O=C(O)c1cnc(C(=O)N[C@H]2CCCOc3c(Cl)cccc32)cn1	ZINC000450539889	EE	On-Demand	Anodyne	CNR1	31	44
C[C@H](Oc1ccccn1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450539891	EF	On-Demand	Anodyne	TBXAS1	41	38
C[C@@H](Oc1ccccn1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450539892	EF	On-Demand	Anodyne	TBXAS1	41	38
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450539893	DG	On-Demand	Anodyne	RIPK1	46	33
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450539894	DG	On-Demand	Anodyne	RIPK1	46	33
C[C@H](Nc1ncc(C(F)F)cn1)c1ncc(Br)cn1	ZINC000450539895	EG	On-Demand	Anodyne	JAK2	19	40
C[C@@H](Nc1ncc(C(F)F)cn1)c1ncc(Br)cn1	ZINC000450539896	EG	On-Demand	Anodyne	JAK2	19	40
CCC[C@H](OC)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450539898	DF	On-Demand	Anodyne	TBXAS1	26	42
CCC[C@@H](OC)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450539899	DF	On-Demand	Anodyne	TBXAS1	26	42
O=C(c1ccc2nccnc2n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539906	FF	On-Demand	Anodyne	TBXAS1	25	40
O=C(c1ccc2nccnc2n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450539906	FF	On-Demand	Anodyne	HMOX2	45	33
O=C(O)c1ccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)o1	ZINC000450539932	EF	On-Demand	Anodyne	PRKCD	25	48
O=C(O)c1ccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)o1	ZINC000450539932	EF	On-Demand	Anodyne	PRKCA	41	48
O=C(O)c1ccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)o1	ZINC000450539932	EF	On-Demand	Anodyne	PRKACA	32	48
O=C(O)c1ccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)o1	ZINC000450539932	EF	On-Demand	Anodyne	KLK5	40	38
COC(=O)CN1CCC[C@@H](CNc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450539941	GE	On-Demand	Anodyne	P2RY12	78	34
COC(=O)CN1CCC[C@@H](CNc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450539941	GE	On-Demand	Anodyne	VCP	60	39
COC(=O)CN1CCC[C@H](CNc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450539942	GE	On-Demand	Anodyne	P2RY12	78	34
COC(=O)CN1CCC[C@H](CNc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450539942	GE	On-Demand	Anodyne	VCP	60	39
C[C@@H](C[C@@H](C)O)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450539947	DG	On-Demand	Anodyne	RBP4	73	45
C[C@H](O)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450539948	DG	On-Demand	Anodyne	RBP4	73	45
C[C@@H](O)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450539949	DG	On-Demand	Anodyne	RBP4	73	45
O=C(O)[C@@H]1C[C@H]1C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450539953	EF	On-Demand	Anodyne	TYK2	26	44
O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)[C@H]1C[C@H]1C(=O)O	ZINC000450539954	EF	On-Demand	Anodyne	TYK2	26	44
O=C(O)[C@H]1C[C@H]1C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450539955	EF	On-Demand	Anodyne	TYK2	26	44
O=C(O)[C@H]1C[C@@H]1C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450539956	EF	On-Demand	Anodyne	TYK2	26	44
COC(=O)CN1CCC[C@H](CN=c2c([N+](=O)[O-])c[nH]c3ccccc23)C1	ZINC000450539957	FD	On-Demand	Bother	NMBR	59	32
COC(=O)CN1CCC[C@@H](CN=c2c([N+](=O)[O-])c[nH]c3ccccc23)C1	ZINC000450539958	FD	On-Demand	Bother	NMBR	59	32
CC(=O)c1ccc(NC(=O)c2ccc(C(C)C)nc2C)cc1Cl	ZINC000450539962	EJ	On-Demand	Anodyne	NR2E3	62	36
CC(=O)c1ccc(NC(=O)c2ccc(C(C)C)nc2C)cc1Cl	ZINC000450539962	EJ	On-Demand	Anodyne	SHH	55	47
Cc1nc(C2CC2)ccc1C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450539967	CE	On-Demand	Anodyne	JAK3	15	43
Cc1nc(C2CC2)ccc1C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450539968	CE	On-Demand	Anodyne	JAK3	15	43
Cc1nc(C2CC2)ccc1C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450539969	CE	On-Demand	Anodyne	JAK3	15	43
Cc1nc(C2CC2)ccc1C(=O)N[C@H](C)C[C@H](C)O	ZINC000450539970	CE	On-Demand	Anodyne	JAK3	15	43
Cc1ccc(C2CCN(C(=O)Cc3cc(F)c(C)cc3F)CC2)cn1	ZINC000450539986	EH	On-Demand	Anodyne	PRCP	40	33
COC(=O)CN1CCC[C@@H](CNc2nccc(OCc3ccccc3)n2)C1	ZINC000450539996	FE	On-Demand	Anodyne	GRIN2B	26	43
COC(=O)CN1CCC[C@@H](CNc2nccc(OCc3ccccc3)n2)C1	ZINC000450539996	FE	On-Demand	Anodyne	VCP	54	34
COC(=O)CN1CCC[C@H](CNc2nccc(OCc3ccccc3)n2)C1	ZINC000450539997	FE	On-Demand	Anodyne	GRIN2B	26	43
COC(=O)CN1CCC[C@H](CNc2nccc(OCc3ccccc3)n2)C1	ZINC000450539997	FE	On-Demand	Anodyne	VCP	54	34
COCC1(CNc2ncnc3cc(Br)ccc23)CCOCC1	ZINC000450540006	FF	On-Demand	Anodyne	EGFR	70	38
CCc1nc(C(C)C)ccc1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450540007	EJ	On-Demand	Anodyne	NR2E3	45	35
O=C(O)c1coc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450540016	DF	On-Demand	Anodyne	SLC9A1	43	38
O=C(O)c1coc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450540017	DF	On-Demand	Anodyne	SLC9A1	43	38
Cc1ccc(C2CCN(C(=O)c3cc(C#N)[nH]c3C)CC2)cn1	ZINC000450540018	DF	On-Demand	Mild	FASN	52	45
O=C(O)c1ccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)o1	ZINC000450540033	EF	On-Demand	Anodyne	PRKCD	25	48
O=C(O)c1ccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)o1	ZINC000450540033	EF	On-Demand	Anodyne	PRKCA	41	48
O=C(O)c1ccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)o1	ZINC000450540033	EF	On-Demand	Anodyne	PRKACA	32	48
O=C(O)c1ccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)o1	ZINC000450540033	EF	On-Demand	Anodyne	KLK5	40	38
O=C(O)c1ccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)o1	ZINC000450540034	EF	On-Demand	Anodyne	PRKCD	25	48
O=C(O)c1ccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)o1	ZINC000450540034	EF	On-Demand	Anodyne	PRKCA	41	48
O=C(O)c1ccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)o1	ZINC000450540034	EF	On-Demand	Anodyne	PRKACA	32	48
O=C(O)c1ccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)o1	ZINC000450540034	EF	On-Demand	Anodyne	KLK5	40	38
O=C(O)c1ccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)o1	ZINC000450540035	EF	On-Demand	Anodyne	PRKCD	25	48
O=C(O)c1ccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)o1	ZINC000450540035	EF	On-Demand	Anodyne	PRKCA	41	48
O=C(O)c1ccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)o1	ZINC000450540035	EF	On-Demand	Anodyne	PRKACA	32	48
O=C(O)c1ccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)o1	ZINC000450540035	EF	On-Demand	Anodyne	KLK5	40	38
C/C=C\COc1cccc(CC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450540041	GI	On-Demand	Anodyne	TBXAS1	35	43
C/C=C/COc1cccc(CC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450540042	GI	On-Demand	Anodyne	TBXAS1	35	43
CC(C)OCCCCNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450540056	EF	On-Demand	Anodyne	PDE4D	15	42
CC(C)OCCCCNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450540057	EF	On-Demand	Anodyne	PDE4D	15	42
O=C(Cc1cc2ccccc2c(O)n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450540071	GG	On-Demand	Anodyne	TBXAS1	46	39
O=C(Cc1cc2ccccc2c(O)n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450540071	GG	On-Demand	Anodyne	HMOX2	44	33
CCc1oc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540091	FG	On-Demand	Anodyne	PRKCD	47	50
CCc1oc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540091	FG	On-Demand	Anodyne	PRKCE	30	50
CCc1oc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540091	FG	On-Demand	Anodyne	PRKCA	62	50
CCc1oc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540091	FG	On-Demand	Anodyne	PRKCB	21	50
CCc1oc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540091	FG	On-Demand	Anodyne	PRKACA	50	50
CCc1oc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540092	FG	On-Demand	Anodyne	PRKCD	47	50
CCc1oc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540092	FG	On-Demand	Anodyne	PRKCE	30	50
CCc1oc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540092	FG	On-Demand	Anodyne	PRKCA	62	50
CCc1oc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540092	FG	On-Demand	Anodyne	PRKCB	21	50
CCc1oc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540092	FG	On-Demand	Anodyne	PRKACA	50	50
CCc1oc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540093	FG	On-Demand	Anodyne	PRKCD	47	50
CCc1oc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540093	FG	On-Demand	Anodyne	PRKCE	30	50
CCc1oc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540093	FG	On-Demand	Anodyne	PRKCA	62	50
CCc1oc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540093	FG	On-Demand	Anodyne	PRKCB	21	50
CCc1oc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540093	FG	On-Demand	Anodyne	PRKACA	50	50
CCc1oc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540094	FG	On-Demand	Anodyne	PRKCD	47	50
CCc1oc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540094	FG	On-Demand	Anodyne	PRKCE	30	50
CCc1oc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540094	FG	On-Demand	Anodyne	PRKCA	62	50
CCc1oc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540094	FG	On-Demand	Anodyne	PRKCB	21	50
CCc1oc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1C(=O)O	ZINC000450540094	FG	On-Demand	Anodyne	PRKACA	50	50
Cc1ccc(CN(CCO)C(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450540097	EF	On-Demand	Anodyne	PLA2G7	46	37
O=C(CNc1nccc(-c2cnccn2)n1)NCCN1CCCCCC1	ZINC000450540106	FD	On-Demand	Anodyne	IKBKB	15	44
O=C(CNc1nccc(-c2cnccn2)n1)NCCN1CCCCCC1	ZINC000450540106	FD	On-Demand	Anodyne	HNMT	59	35
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540110	GF	On-Demand	Anodyne	E1	0	44
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540110	GF	On-Demand	Anodyne	RORC	66	36
O=C1CCCc2nc(N3CCC4(CCN(Cc5ccccc5)CC4)C3)ccc21	ZINC000450540118	GI	On-Demand	Anodyne	SIGMAR1	30	41
CCC[C@@H](C)C(=O)NCCNc1ncnc2[nH]c3ccccc3c12	ZINC000450540125	EG	On-Demand	Anodyne	UTS2R	28	47
CCC[C@H](C)C(=O)NCCNc1ncnc2[nH]c3ccccc3c12	ZINC000450540126	EG	On-Demand	Anodyne	UTS2R	28	47
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCC(CCCn3ccnc3)CC2)cn1	ZINC000450540129	GH	On-Demand	Anodyne	TBXAS1	31	42
O=C([C@@H]1CCCCC1(F)F)N1CCC(CCCn2ccnc2)CC1	ZINC000450540130	EH	On-Demand	Anodyne	TBXAS1	17	45
O=C([C@H]1CCCCC1(F)F)N1CCC(CCCn2ccnc2)CC1	ZINC000450540131	EH	On-Demand	Anodyne	TBXAS1	17	45
CC(C)OCCCCNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450540132	CF	On-Demand	Anodyne	EPHX2	0	41
COCC1(CNc2ccnc3cc(F)c(Br)cc23)CCOCC1	ZINC000450540140	GH	On-Demand	Anodyne	HNMT	41	31
COC(=O)c1ccccc1CC1CCN(c2nc3c(cc2C#N)COCC3)CC1	ZINC000450540146	GG	On-Demand	Mild	P2RY12	37	42
Cc1cc(F)ccc1CN(C)C(=O)[C@@H]1CC[C@H]1C(=O)O	ZINC000450540147	CE	On-Demand	Anodyne	TACR1	24	41
Cc1cc(F)ccc1CN(C)C(=O)[C@@H]1CC[C@@H]1C(=O)O	ZINC000450540148	CE	On-Demand	Anodyne	TACR1	24	41
Cc1cc(F)ccc1CN(C)C(=O)[C@H]1CC[C@H]1C(=O)O	ZINC000450540149	CE	On-Demand	Anodyne	TACR1	24	41
Cc1cc(F)ccc1CN(C)C(=O)[C@H]1CC[C@@H]1C(=O)O	ZINC000450540150	CE	On-Demand	Anodyne	TACR1	24	41
COc1cccc2c(N3CC[C@]4(C)[C@@H](C3)C4(F)F)nccc12	ZINC000450540155	DH	On-Demand	Anodyne	PDE3B	58	34
COc1cccc2c(N3CC[C@]4(C)[C@H](C3)C4(F)F)nccc12	ZINC000450540156	DH	On-Demand	Anodyne	PDE3B	58	34
COc1cccc2c(N3CC[C@@]4(C)[C@H](C3)C4(F)F)nccc12	ZINC000450540157	DH	On-Demand	Anodyne	PDE3B	58	34
COc1cccc2c(N3CC[C@@]4(C)[C@@H](C3)C4(F)F)nccc12	ZINC000450540158	DH	On-Demand	Anodyne	PDE3B	58	34
CC(=O)c1ccc(NC(=O)c2c(C)nsc2NC2CC2)cc1Cl	ZINC000450540165	EI	On-Demand	Anodyne	TYK2	71	41
C[C@@]12CCN(c3ncnc4cc(Br)ccc34)C[C@@H]1C2(F)F	ZINC000450540192	FH	On-Demand	Anodyne	PDE3A	48	36
C[C@@]12CCN(c3ncnc4cc(Br)ccc34)C[C@@H]1C2(F)F	ZINC000450540192	FH	On-Demand	Anodyne	PDE3B	70	36
C[C@]12CCN(c3ncnc4cc(Br)ccc34)C[C@@H]1C2(F)F	ZINC000450540193	FH	On-Demand	Anodyne	PDE3A	48	36
C[C@]12CCN(c3ncnc4cc(Br)ccc34)C[C@@H]1C2(F)F	ZINC000450540193	FH	On-Demand	Anodyne	PDE3B	70	36
C[C@]12CCN(c3ncnc4cc(Br)ccc34)C[C@H]1C2(F)F	ZINC000450540194	FH	On-Demand	Anodyne	PDE3A	48	36
C[C@]12CCN(c3ncnc4cc(Br)ccc34)C[C@H]1C2(F)F	ZINC000450540194	FH	On-Demand	Anodyne	PDE3B	70	36
C[C@@]12CCN(c3ncnc4cc(Br)ccc34)C[C@H]1C2(F)F	ZINC000450540195	FH	On-Demand	Anodyne	PDE3A	48	36
C[C@@]12CCN(c3ncnc4cc(Br)ccc34)C[C@H]1C2(F)F	ZINC000450540195	FH	On-Demand	Anodyne	PDE3B	70	36
CC(=O)c1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1Cl	ZINC000450540205	FI	On-Demand	Anodyne	MAOB	19	41
CC(=O)c1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1Cl	ZINC000450540205	FI	On-Demand	Anodyne	KIT	0	41
CC(=O)c1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1Cl	ZINC000450540205	FI	On-Demand	Anodyne	GRM4	40	37
CC(=O)c1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1Cl	ZINC000450540205	FI	On-Demand	Anodyne	SHH	53	39
CO[C@@](C)(CNc1nc(N(C)C)c2ccccc2n1)C1CC1	ZINC000450540206	DE	On-Demand	Anodyne	ADRA2A	20	55
CO[C@@](C)(CNc1nc(N(C)C)c2ccccc2n1)C1CC1	ZINC000450540206	DE	On-Demand	Anodyne	NPY2R	16	55
CO[C@](C)(CNc1nc(N(C)C)c2ccccc2n1)C1CC1	ZINC000450540207	DE	On-Demand	Anodyne	ADRA2A	20	55
CO[C@](C)(CNc1nc(N(C)C)c2ccccc2n1)C1CC1	ZINC000450540207	DE	On-Demand	Anodyne	NPY2R	16	55
O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(N2CCC2)nc1	ZINC000450540211	FH	On-Demand	Anodyne	HPGDS	33	52
O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(N2CCC2)nc1	ZINC000450540212	FH	On-Demand	Anodyne	HPGDS	33	52
O=C(O)[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450540215	CE	On-Demand	Anodyne	PRCP	44	33
O=C(O)[C@@H]1C[C@@H]1C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450540216	CE	On-Demand	Anodyne	PRCP	44	33
O=C(O)[C@@H]1C[C@@H]1C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450540217	CE	On-Demand	Anodyne	PRCP	44	33
O=C(O)[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450540218	CE	On-Demand	Anodyne	PRCP	44	33
COc1cc(CC(=O)N2CCC(c3ccc(C)nc3)CC2)ccc1Cl	ZINC000450540226	FI	On-Demand	Anodyne	CCR1	54	42
COc1cc(CC(=O)N2CCC(c3ccc(C)nc3)CC2)ccc1Cl	ZINC000450540226	FI	On-Demand	Anodyne	CCR2	0	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540233	FF	On-Demand	Anodyne	ANPEP	25	41
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450540234	GJ	On-Demand	Anodyne	TBXAS1	53	42
COC[C@@H]1CCN1c1ncnc2cc(Br)ccc12	ZINC000450540238	DF	On-Demand	Anodyne	PDE3A	44	34
COC[C@H]1CCN1c1ncnc2cc(Br)ccc12	ZINC000450540239	DF	On-Demand	Anodyne	PDE3A	44	34
C=CCOc1ccc(CC(=O)N2CCC(CCCn3ccnc3)CC2)cc1	ZINC000450540244	FH	On-Demand	Mild	TBXAS1	41	42
C=CCOc1ccc(CC(=O)N2CCC(CCCn3ccnc3)CC2)cc1	ZINC000450540244	FH	On-Demand	Mild	HMOX2	18	40
CC[C@@H](CC(C)C)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450540251	CG	On-Demand	Bother	AADAC	0	44
CC[C@H](CC(C)C)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450540252	CG	On-Demand	Bother	AADAC	0	44
CC(C)OCCCCNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450540257	FF	On-Demand	Anodyne	PIK3CD	21	43
CC(C)OCCCCNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450540257	FF	On-Demand	Anodyne	PIK3CB	36	43
C[C@H](C(=O)Nc1cccc(-c2cnn[nH]2)c1)C(C)(F)F	ZINC000450540260	CF	On-Demand	Anodyne	MTNN	45	32
C[C@H](C(=O)Nc1cccc(-c2cnn[nH]2)c1)C(C)(F)F	ZINC000450540260	CF	On-Demand	Anodyne	RIPK1	47	32
C[C@@H](C(=O)Nc1cccc(-c2cnn[nH]2)c1)C(C)(F)F	ZINC000450540261	CF	On-Demand	Anodyne	MTNN	45	32
C[C@@H](C(=O)Nc1cccc(-c2cnn[nH]2)c1)C(C)(F)F	ZINC000450540261	CF	On-Demand	Anodyne	RIPK1	47	32
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)C[C@H]1c1ccccc1	ZINC000450540267	DH	On-Demand	Anodyne	RARA	41	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)C[C@H]1c1ccccc1	ZINC000450540267	DH	On-Demand	Anodyne	RXRG	48	31
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)C[C@H]1c1ccccc1	ZINC000450540267	DH	On-Demand	Anodyne	RXRB	52	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)C[C@H]1c1ccccc1	ZINC000450540267	DH	On-Demand	Anodyne	L3MBTL3	54	35
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)C[C@@H]1c1ccccc1	ZINC000450540268	DH	On-Demand	Anodyne	RARA	41	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)C[C@@H]1c1ccccc1	ZINC000450540268	DH	On-Demand	Anodyne	RXRG	48	31
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)C[C@@H]1c1ccccc1	ZINC000450540268	DH	On-Demand	Anodyne	RXRB	52	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)C[C@@H]1c1ccccc1	ZINC000450540268	DH	On-Demand	Anodyne	L3MBTL3	54	35
Cc1sccc1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450540270	DH	On-Demand	Anodyne	TBXAS1	48	41
COC(=O)CN1CCC[C@H](CNc2ncc([N+](=O)[O-])c(C)n2)C1	ZINC000450540280	DC	On-Demand	Bother	PRKCQ	51	39
COC(=O)CN1CCC[C@@H](CNc2ncc([N+](=O)[O-])c(C)n2)C1	ZINC000450540281	DC	On-Demand	Bother	PRKCQ	51	39
CC[C@@H](Nc1ncnc2cc(Br)ccc12)C(N)=O	ZINC000450540294	DE	On-Demand	Anodyne	EGFR	59	43
CC[C@@H](Nc1ncnc2cc(Br)ccc12)C(N)=O	ZINC000450540294	DE	On-Demand	Anodyne	HTT	0	46
CC[C@H](Nc1ncnc2cc(Br)ccc12)C(N)=O	ZINC000450540295	DE	On-Demand	Anodyne	EGFR	59	43
CC[C@H](Nc1ncnc2cc(Br)ccc12)C(N)=O	ZINC000450540295	DE	On-Demand	Anodyne	HTT	0	46
CC(=O)c1ccc(NC(=O)c2c3n(c(=O)n2C)CCCC3)cc1Cl	ZINC000450540296	EF	On-Demand	Anodyne	AVPR2	31	41
COc1cccc2c(N3CCCN(S(=O)(=O)N(C)C)CC3)nccc12	ZINC000450540297	FD	On-Demand	Anodyne	SORD	19	44
O=C(CNc1nccc2c([N+](=O)[O-])cccc12)NCCN1CCCCCC1	ZINC000450540305	FF	On-Demand	Bother	HNMT	70	40
Cc1cnn([C@@H]2CCN(c3ncnc4cc(Br)ccc34)C2)c1	ZINC000450540306	FG	On-Demand	Anodyne	PDE3A	52	39
Cc1cnn([C@@H]2CCN(c3ncnc4cc(Br)ccc34)C2)c1	ZINC000450540306	FG	On-Demand	Anodyne	PDE3B	77	39
Cc1cnn([C@H]2CCN(c3ncnc4cc(Br)ccc34)C2)c1	ZINC000450540309	FG	On-Demand	Anodyne	PDE3A	52	39
Cc1cnn([C@H]2CCN(c3ncnc4cc(Br)ccc34)C2)c1	ZINC000450540309	FG	On-Demand	Anodyne	PDE3B	77	39
OC[C@@H]1C[C@H]2CC[C@H]1N2c1nc(-c2ccccc2C(F)(F)F)nc2ccccc12	ZINC000450540322	GJ	On-Demand	Anodyne	CHEK2	18	40
OC[C@H]1C[C@H]2CC[C@H]1N2c1nc(-c2ccccc2C(F)(F)F)nc2ccccc12	ZINC000450540323	GJ	On-Demand	Anodyne	CHEK2	18	40
CC1(C)CN(C(=O)c2ccnc(C(=O)O)c2)C[C@H]1c1ccccc1	ZINC000450540327	DG	On-Demand	Anodyne	FTO	0	45
CC1(C)CN(C(=O)c2ccnc(C(=O)O)c2)C[C@@H]1c1ccccc1	ZINC000450540328	DG	On-Demand	Anodyne	FTO	0	45
CN(CC(C)(C)C#N)c1ncnc2[nH]c3ccccc3c12	ZINC000450540329	CG	On-Demand	Mild	TUBB3	32	42
CC(F)(F)C(C)(C)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450540336	CF	On-Demand	Bother	AADAC	0	45
Cc1nn(C)cc1CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450540341	CD	On-Demand	Anodyne	P2RX7	67	44
CCCc1ccc2nccc(N3CCCN(S(=O)(=O)N(C)C)CC3)c2c1	ZINC000450540344	GF	On-Demand	Anodyne	SORD	15	44
CC[C@H](CNc1nccc(-c2ccc(OC)cc2)n1)OC	ZINC000450540345	CF	On-Demand	Anodyne	CLK4	25	56
CC[C@@H](CNc1nccc(-c2ccc(OC)cc2)n1)OC	ZINC000450540346	CF	On-Demand	Anodyne	CLK4	25	56
COc1ccc(-c2ccnc(NCCc3nnc(C(C)C)s3)n2)cc1	ZINC000450540357	FH	On-Demand	Anodyne	CLK4	21	50
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccc(C(=O)O)cc1	ZINC000450540366	DG	On-Demand	Anodyne	PTGER4	27	42
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccc(C(=O)O)cc1	ZINC000450540366	DG	On-Demand	Anodyne	ACE2	47	32
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccc(C(=O)O)cc1	ZINC000450540369	DG	On-Demand	Anodyne	PTGER4	27	42
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccc(C(=O)O)cc1	ZINC000450540369	DG	On-Demand	Anodyne	ACE2	47	32
Cc1ccn(CC(=O)N2CCC(CCCn3ccnc3)CC2)n1	ZINC000450540378	DE	On-Demand	Anodyne	TBXAS1	41	37
C[C@@H](NC(=O)C1(C(=O)O)CC1)c1cccc(OC(F)(F)F)c1	ZINC000450540380	DF	On-Demand	Anodyne	SDH1	0	43
C[C@H](NC(=O)C1(C(=O)O)CC1)c1cccc(OC(F)(F)F)c1	ZINC000450540382	DF	On-Demand	Anodyne	SDH1	0	43
CSc1cccc(C(=O)N2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450540399	EI	On-Demand	Anodyne	FASN	40	37
CSc1cccc(C(=O)N2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450540399	EI	On-Demand	Anodyne	L3MBTL1	0	40
CSc1cccc(C(=O)N2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450540399	EI	On-Demand	Anodyne	L3MBTL3	45	40
CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)CCCCC(=O)O	ZINC000450540405	EH	On-Demand	Anodyne	Q6UB75_PIG	0	47
CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)CCCCC(=O)O	ZINC000450540405	EH	On-Demand	Anodyne	COL4A3BP	0	42
CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)CCCCC(=O)O	ZINC000450540410	EH	On-Demand	Anodyne	Q6UB75_PIG	0	47
CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)CCCCC(=O)O	ZINC000450540410	EH	On-Demand	Anodyne	COL4A3BP	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	ACE	45	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	MME	105	44
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	ANPEP	74	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	TACR1	15	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	FCER2	69	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	RNPEP	26	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	KLK3	49	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CTSB	53	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	PAPA1_CARPA	69	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CYSP_TRYCR	60	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CTSK	30	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CTSL	39	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CPA1	50	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	SLC15A1	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CTRB1	33	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CAPNS1	64	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	HLA-DRB1	47	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	REN	44	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	LNPEP	18	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	PAM	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CTSS	27	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CAPN1	96	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	CAPN2	104	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	ACE2	74	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	PROTEASE	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	MMP1	31	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	FPR1	59	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	POL	0	45
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	NPR	70	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	AMP1_PLAFQ	63	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	HDA106	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	PENP_PENJA	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	SLC15A2	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	PSMB8	40	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)O	ZINC000450540411	CD	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	ACE	45	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	MME	105	44
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	ANPEP	74	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	TACR1	15	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	FCER2	69	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	RNPEP	26	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	KLK3	49	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CTSB	53	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	PAPA1_CARPA	69	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CYSP_TRYCR	60	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CTSK	30	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CTSL	39	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CPA1	50	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	SLC15A1	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CTRB1	33	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CAPNS1	64	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	HLA-DRB1	47	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	REN	44	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	LNPEP	18	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	PAM	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CTSS	27	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CAPN1	96	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	CAPN2	104	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	ACE2	74	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	PROTEASE	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	MMP1	31	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	FPR1	59	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	POL	0	45
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	NPR	70	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	AMP1_PLAFQ	63	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	HDA106	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	PENP_PENJA	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	SLC15A2	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	PSMB8	40	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)O	ZINC000450540413	CD	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	ACE	45	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	MME	105	44
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	ANPEP	74	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	TACR1	15	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	FCER2	69	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	RNPEP	26	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	KLK3	49	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CTSB	53	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	PAPA1_CARPA	69	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CYSP_TRYCR	60	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CTSK	30	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CTSL	39	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CPA1	50	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	SLC15A1	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CTRB1	33	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CAPNS1	64	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	HLA-DRB1	47	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	REN	44	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	LNPEP	18	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	PAM	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CTSS	27	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CAPN1	96	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	CAPN2	104	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	ACE2	74	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	PROTEASE	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	MMP1	31	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	FPR1	59	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	POL	0	45
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	NPR	70	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	AMP1_PLAFQ	63	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	HDA106	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	PENP_PENJA	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	SLC15A2	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	PSMB8	40	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)O	ZINC000450540414	CD	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	ACE	45	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	MME	105	44
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	ANPEP	74	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	TACR1	15	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	FCER2	69	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	RNPEP	26	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	KLK3	49	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CTSB	53	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	PAPA1_CARPA	69	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CYSP_TRYCR	60	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CTSK	30	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CTSL	39	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CPA1	50	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	SLC15A1	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CTRB1	33	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CAPNS1	64	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	HLA-DRB1	47	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	REN	44	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	LNPEP	18	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	PAM	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CTSS	27	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CAPN1	96	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	CAPN2	104	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	ACE2	74	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	PROTEASE	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	MMP1	31	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	FPR1	59	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	POL	0	45
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	NPR	70	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	AMP1_PLAFQ	63	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	HDA106	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	PENP_PENJA	0	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	SLC15A2	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	PSMB8	40	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)O	ZINC000450540415	CD	On-Demand	Anodyne	VM1B1_BOTAS	0	40
COC(=O)CN1CCC[C@H](CNc2ncnc3cc(Br)ccc23)C1	ZINC000450540416	GE	On-Demand	Anodyne	EGFR	57	38
COC(=O)CN1CCC[C@H](CNc2ncnc3cc(Br)ccc23)C1	ZINC000450540416	GE	On-Demand	Anodyne	ERBB2	21	40
COC(=O)CN1CCC[C@@H](CNc2ncnc3cc(Br)ccc23)C1	ZINC000450540418	GE	On-Demand	Anodyne	EGFR	57	38
COC(=O)CN1CCC[C@@H](CNc2ncnc3cc(Br)ccc23)C1	ZINC000450540418	GE	On-Demand	Anodyne	ERBB2	21	40
COc1ccc(OC(F)(F)F)c(C(=O)NCCCCOC(C)C)c1	ZINC000450540420	EH	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(OC(F)(F)F)c(C(=O)NCCCCOC(C)C)c1	ZINC000450540420	EH	On-Demand	Anodyne	TRPV1	0	42
COc1ccc(OC(F)(F)F)c(C(=O)NCCCCOC(C)C)c1	ZINC000450540420	EH	On-Demand	Anodyne	PPARD	22	42
COC(=O)[C@H]1CCN(c2nc(-c3ccc(OC)cc3)no2)[C@H]1C(C)C	ZINC000450540422	EF	On-Demand	Anodyne	COLA	0	42
COC(=O)[C@H]1CCN(c2nc(-c3ccc(OC)cc3)no2)[C@H]1C(C)C	ZINC000450540422	EF	On-Demand	Anodyne	HSP90AA1	22	42
CN(C)c1nc(N2CCC(CO)(c3ccccc3)CC2)nc2ccccc12	ZINC000450540426	FG	On-Demand	Anodyne	SORD	49	33
COc1cc2c(cc1Cl)CN(c1nc(C(C)=O)c(C)s1)CC2	ZINC000450540435	EH	On-Demand	Anodyne	ABCB1B	49	33
COCc1nn(C)cc1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450540456	DF	On-Demand	Anodyne	FLT1	31	42
COCc1nn(C)cc1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450540456	DF	On-Demand	Anodyne	SHH	38	40
C=CCOc1ccc(CC(=O)N[C@H](C)C[C@@H](C)O)cc1	ZINC000450540464	CE	On-Demand	Mild	ACACA	46	35
C=CCOc1ccc(CC(=O)N[C@H](C)C[C@H](C)O)cc1	ZINC000450540465	CE	On-Demand	Mild	ACACA	46	35
C=CCOc1ccc(CC(=O)N[C@@H](C)C[C@@H](C)O)cc1	ZINC000450540466	CE	On-Demand	Mild	ACACA	46	35
C=CCOc1ccc(CC(=O)N[C@@H](C)C[C@H](C)O)cc1	ZINC000450540467	CE	On-Demand	Mild	ACACA	46	35
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H]1CCCCS1	ZINC000450540472	CF	On-Demand	Anodyne	MME	55	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1CCCCS1	ZINC000450540474	CF	On-Demand	Anodyne	MME	55	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@H]1CCCCS1	ZINC000450540476	CF	On-Demand	Anodyne	MME	55	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H]1CCCCS1	ZINC000450540478	CF	On-Demand	Anodyne	MME	55	36
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nnc(C2CCC2)n1C	ZINC000450540480	FG	On-Demand	Anodyne	CCR2	52	36
Cc1ccc(C2CCN(C(=O)CCCC(=O)C3CC3)CC2)cn1	ZINC000450540483	DG	On-Demand	Anodyne	ETHR	45	32
CO[C@H]1COCC[C@@H]1CC(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	ZINC000450540508	GF	On-Demand	Anodyne	CCR2	46	45
CO[C@@H]1COCC[C@@H]1CC(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	ZINC000450540510	GF	On-Demand	Anodyne	CCR2	46	45
CO[C@@H]1COCC[C@H]1CC(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	ZINC000450540511	GF	On-Demand	Anodyne	CCR2	46	45
CO[C@H]1COCC[C@H]1CC(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1	ZINC000450540512	GF	On-Demand	Anodyne	CCR2	46	45
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(c2ccc(C)nc2)CC1	ZINC000450540524	EG	On-Demand	Anodyne	CCR1	45	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC(c2ccc(C)nc2)CC1	ZINC000450540531	EG	On-Demand	Anodyne	CCR1	45	42
O=C(O)c1ccccc1CC(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450540533	GH	On-Demand	Anodyne	TACR1	20	40
O=C(O)c1ccccc1CC(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450540533	GH	On-Demand	Anodyne	CACNA1B	45	31
O=C(O)c1ccccc1CC(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450540533	GH	On-Demand	Anodyne	CCR2	43	41
O=C(O)c1ccccc1CC(=O)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450540533	GH	On-Demand	Anodyne	LIPG	52	34
O=C(O)c1ccccc1CC(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450540534	GH	On-Demand	Anodyne	TACR1	20	40
O=C(O)c1ccccc1CC(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450540534	GH	On-Demand	Anodyne	CACNA1B	45	31
O=C(O)c1ccccc1CC(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450540534	GH	On-Demand	Anodyne	CCR2	43	41
O=C(O)c1ccccc1CC(=O)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450540534	GH	On-Demand	Anodyne	LIPG	52	34
O=C(O)CCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450540553	CE	On-Demand	Anodyne	GRIN2D	56	33
O=C(O)CCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450540553	CE	On-Demand	Anodyne	ETHR	50	37
CCc1cc(N2CCC(CO)(c3ccccc3)CC2)ccn1	ZINC000450540555	CG	On-Demand	Anodyne	SORD	41	39
CCNC(=O)[C@@H](Nc1nc(N(C)C)c2ccccc2n1)C(C)C	ZINC000450540556	DE	On-Demand	Anodyne	ADRA2A	16	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450540558	GJ	On-Demand	Anodyne	TBXAS1	45	48
O=C(O)CCC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450540562	CE	On-Demand	Anodyne	GRIN2D	56	33
O=C(O)CCC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450540562	CE	On-Demand	Anodyne	ETHR	50	37
CCOC(=O)c1cc(C(=O)N2CCC(c3ccc(C)nc3)CC2)[nH]c1C	ZINC000450540564	FG	On-Demand	Anodyne	FASN	41	35
COC(=O)[C@@H]1CCO[C@H]1C1CCN(c2nccc(-c3ccc(OC)cc3)n2)CC1	ZINC000450540574	GF	On-Demand	Anodyne	DKK1	0	45
CC(C)Oc1ccc2nccc(N3CCCN(S(=O)(=O)N(C)C)CC3)c2c1	ZINC000450540576	GE	On-Demand	Anodyne	SORD	15	43
Cc1ncc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c(O)n1	ZINC000450540590	GD	On-Demand	Anodyne	PRSS1	0	42
COc1ccc(-c2noc(N(C)CC(C)(C)C#N)n2)cc1	ZINC000450540593	CF	On-Demand	Mild	LUCI_PHOPE	28	42
CC[C@@H]1CCC[C@@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450540630	DH	On-Demand	Anodyne	TBXAS1	26	40
CC[C@@H]1CCC[C@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450540631	DH	On-Demand	Anodyne	TBXAS1	26	40
CC[C@H]1CCC[C@@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450540632	DH	On-Demand	Anodyne	TBXAS1	26	40
CC[C@H]1CCC[C@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450540633	DH	On-Demand	Anodyne	TBXAS1	26	40
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540634	DG	On-Demand	Anodyne	HDAC10	39	41
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540634	DG	On-Demand	Anodyne	HDAC3	44	42
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540634	DG	On-Demand	Anodyne	HDAC6	37	44
COC(=O)[C@@H]1CN(c2nc(C(C)=O)c(C)s2)C[C@H]1c1ccc(Cl)cc1	ZINC000450540638	GH	On-Demand	Anodyne	SLC6A1	81	48
COC(=O)[C@@H]1CN(c2nc(C(C)=O)c(C)s2)C[C@H]1c1ccc(Cl)cc1	ZINC000450540638	GH	On-Demand	Anodyne	SLC6A4	20	48
COC(=O)[C@@H]1CN(c2nc(C(C)=O)c(C)s2)C[C@H]1c1ccc(Cl)cc1	ZINC000450540638	GH	On-Demand	Anodyne	SLC6A3	35	48
C[C@@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CCN(C2CC2)C1	ZINC000450540646	FG	On-Demand	Anodyne	ACACB	25	43
C[C@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CCN(C2CC2)C1	ZINC000450540647	FG	On-Demand	Anodyne	ACACB	25	43
C[C@@H]1CC[C@]2(CCN(C(=O)c3ccc(C(=O)O)cc3)C2)C1	ZINC000450540663	CG	On-Demand	Anodyne	L3MBTL1	0	45
C[C@@H]1CC[C@]2(CCN(C(=O)c3ccc(C(=O)O)cc3)C2)C1	ZINC000450540663	CG	On-Demand	Anodyne	L3MBTL3	51	39
C[C@H]1CC[C@]2(CCN(C(=O)c3ccc(C(=O)O)cc3)C2)C1	ZINC000450540664	CG	On-Demand	Anodyne	L3MBTL1	0	45
C[C@H]1CC[C@]2(CCN(C(=O)c3ccc(C(=O)O)cc3)C2)C1	ZINC000450540664	CG	On-Demand	Anodyne	L3MBTL3	51	39
C[C@@H]1CC[C@@]2(CCN(C(=O)c3ccc(C(=O)O)cc3)C2)C1	ZINC000450540666	CG	On-Demand	Anodyne	L3MBTL1	0	45
C[C@@H]1CC[C@@]2(CCN(C(=O)c3ccc(C(=O)O)cc3)C2)C1	ZINC000450540666	CG	On-Demand	Anodyne	L3MBTL3	51	39
C[C@H]1CC[C@@]2(CCN(C(=O)c3ccc(C(=O)O)cc3)C2)C1	ZINC000450540668	CG	On-Demand	Anodyne	L3MBTL1	0	45
C[C@H]1CC[C@@]2(CCN(C(=O)c3ccc(C(=O)O)cc3)C2)C1	ZINC000450540668	CG	On-Demand	Anodyne	L3MBTL3	51	39
O=C(CCCC(=O)C1CC1)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540672	CF	On-Demand	Anodyne	HDAC10	56	42
O=C(CCCC(=O)C1CC1)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540672	CF	On-Demand	Anodyne	HDAC2	29	42
O=C(CCCC(=O)C1CC1)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540672	CF	On-Demand	Anodyne	HDAC3	53	42
O=C(CCCC(=O)C1CC1)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450540672	CF	On-Demand	Anodyne	HDAC6	55	45
CC1(C)CN(C(=O)CCc2ccc(C(=O)O)cc2)C[C@H]1c1ccccc1	ZINC000450540678	FH	On-Demand	Anodyne	PTGER4	42	34
CC1(C)CN(C(=O)CCc2ccc(C(=O)O)cc2)C[C@H]1c1ccccc1	ZINC000450540678	FH	On-Demand	Anodyne	CYP2J2	45	34
CC1(C)CN(C(=O)CCc2ccc(C(=O)O)cc2)C[C@@H]1c1ccccc1	ZINC000450540679	FH	On-Demand	Anodyne	PTGER4	42	34
CC1(C)CN(C(=O)CCc2ccc(C(=O)O)cc2)C[C@@H]1c1ccccc1	ZINC000450540679	FH	On-Demand	Anodyne	CYP2J2	45	34
CCCN(CC(N)=O)c1nc2ccccc2c(=NC)[nH]1	ZINC000450540681	CC	On-Demand	Anodyne	TSPO	25	40
CCCOc1ccc(C(=O)N2CCC(CCCn3ccnc3)CC2)c(OC)c1	ZINC000450540682	GI	On-Demand	Anodyne	OXTR	20	41
CCCOc1ccc(C(=O)N2CCC(CCCn3ccnc3)CC2)c(OC)c1	ZINC000450540682	GI	On-Demand	Anodyne	TBXAS1	38	43
CCCOc1ccc(C(=O)N2CCC(CCCn3ccnc3)CC2)c(OC)c1	ZINC000450540682	GI	On-Demand	Anodyne	QPCT	25	43
CC(C)OCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450540686	CE	On-Demand	Anodyne	TRPV1	0	51
CC(C)OCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450540686	CE	On-Demand	Anodyne	GRIA1	49	34
CC(C)OCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450540686	CE	On-Demand	Anodyne	NCE103	31	47
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450540688	GF	On-Demand	Bother	CA7	15	41
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450540688	GF	On-Demand	Bother	CA5B	45	41
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450540688	GF	On-Demand	Bother	CA5A	52	41
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450540688	GF	On-Demand	Bother	RORC	52	39
COc1ccc(-c2ccnc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450540690	GF	On-Demand	Anodyne	DRD4	45	35
COc1ccc(-c2ccnc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450540690	GF	On-Demand	Anodyne	CHRNA7	27	48
COc1ccc(-c2ccnc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450540690	GF	On-Demand	Anodyne	IKBKB	27	43
COc1ccc(-c2ccnc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450540690	GF	On-Demand	Anodyne	JAK3	25	43
COc1ccc(-c2ccnc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450540690	GF	On-Demand	Anodyne	JAK2	22	43
COc1ccc(-c2ccnc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450540690	GF	On-Demand	Anodyne	HNMT	80	34
COc1ccc(-c2ccnc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450540690	GF	On-Demand	Anodyne	ZAP70	25	43
COc1ccc(-c2ccnc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450540690	GF	On-Demand	Anodyne	SMG1	62	34
CC(C)OCCCCNC(=O)[C@H]1CC1(F)F	ZINC000450540709	BD	On-Demand	Anodyne	EPHX2	39	46
CC(C)OCCCCNC(=O)[C@@H]1CC1(F)F	ZINC000450540710	BD	On-Demand	Anodyne	EPHX2	39	46
CS(=O)(=O)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450540716	GF	On-Demand	Anodyne	PDE3A	47	35
CS(=O)(=O)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450540716	GF	On-Demand	Anodyne	PDE3B	69	36
CS(=O)(=O)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450540716	GF	On-Demand	Anodyne	SIRT3	66	40
CS(=O)(=O)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450540716	GF	On-Demand	Anodyne	SIRT2	57	40
CS(=O)(=O)CC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450540716	GF	On-Demand	Anodyne	SIRT1	56	40
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	PTGER1	28	41
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	SIGMAR1	22	42
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	PRKCD	26	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	PRKCE	40	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	PRKCH	42	38
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	PRKCA	71	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	PRKCB	28	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	PRKACA	57	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540718	FG	On-Demand	Anodyne	KLK5	41	38
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	PTGER1	28	41
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	SIGMAR1	22	42
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	PRKCD	26	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	PRKCE	40	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	PRKCH	42	38
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	PRKCA	71	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	PRKCB	28	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	PRKACA	57	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540719	FG	On-Demand	Anodyne	KLK5	41	38
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	PTGER1	28	41
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	SIGMAR1	22	42
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	PRKCD	26	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	PRKCE	40	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	PRKCH	42	38
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	PRKCA	71	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	PRKCB	28	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	PRKACA	57	53
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540720	FG	On-Demand	Anodyne	KLK5	41	38
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	PTGER1	28	41
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	SIGMAR1	22	42
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	PRKCD	26	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	PRKCE	40	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	PRKCH	42	38
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	PRKCA	71	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	PRKCB	28	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	PRKACA	57	53
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540721	FG	On-Demand	Anodyne	KLK5	41	38
COc1ccc(-c2noc(N3CCC[C@@H](CS(C)(=O)=O)C3)n2)cc1	ZINC000450540722	FE	On-Demand	Anodyne	COLA	15	41
COc1ccc(-c2noc(N3CCC[C@H](CS(C)(=O)=O)C3)n2)cc1	ZINC000450540723	FE	On-Demand	Anodyne	COLA	15	41
COC(=O)c1cccc(CCNC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450540733	EE	On-Demand	Anodyne	DRD4	46	35
COC(=O)c1cccc(CCNC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450540733	EE	On-Demand	Anodyne	CXCR3	23	42
COC(=O)c1cccc(CCNC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450540733	EE	On-Demand	Anodyne	HPGDS	23	41
FC(F)c1cnc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)nc1	ZINC000450540735	EH	On-Demand	Anodyne	PDE3A	43	35
FC(F)c1cnc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)nc1	ZINC000450540735	EH	On-Demand	Anodyne	PDE3B	59	34
FC(F)c1cnc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)nc1	ZINC000450540736	EH	On-Demand	Anodyne	PDE3A	43	35
FC(F)c1cnc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)nc1	ZINC000450540736	EH	On-Demand	Anodyne	PDE3B	59	34
C[C@@H](OCCc1ccccc1)C(=O)NC[C@H]1CCCCS1	ZINC000450540769	DG	On-Demand	Anodyne	AMY2	44	30
C[C@@H](O)C[C@@H](C)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450540772	DD	On-Demand	Anodyne	CCR1	41	36
C[C@H](O)C[C@@H](C)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450540773	DD	On-Demand	Anodyne	CCR1	41	36
C[C@@H](C[C@@H](C)O)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450540774	DD	On-Demand	Anodyne	CCR1	41	36
C[C@H](O)C[C@H](C)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450540775	DD	On-Demand	Anodyne	CCR1	41	36
CN(C)c1nc(N[C@@H](CO)C2CCCC2)nc2ccccc12	ZINC000450540776	DF	On-Demand	Anodyne	ADRA2A	0	47
C[C@H](OCCc1ccccc1)C(=O)NC[C@H]1CCCCS1	ZINC000450540777	DG	On-Demand	Anodyne	AMY2	44	30
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H]1CCCCS1	ZINC000450540778	DG	On-Demand	Anodyne	AMY2	44	30
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H]1CCCCS1	ZINC000450540779	DG	On-Demand	Anodyne	AMY2	44	30
CN(C)c1nc(N[C@H](CO)C2CCCC2)nc2ccccc12	ZINC000450540781	DF	On-Demand	Anodyne	ADRA2A	0	47
Cc1ccc(C2CCN(C(=O)CCCC(C)C)CC2)cn1	ZINC000450540789	CH	On-Demand	Anodyne	CCR1	37	42
Cc1ccc(C2CCN(C(=O)CCCC(C)C)CC2)cn1	ZINC000450540789	CH	On-Demand	Anodyne	ETHR	51	41
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	DRD4	31	44
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	KCNH2	16	41
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	HTR4	27	41
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	SIGMAR1	21	44
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	SSTR5	93	51
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	CCR3	17	41
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	UTS2R	19	43
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	PDK1	57	44
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	MCHR1	47	45
CCOc1cc(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)on1	ZINC000450540791	GH	On-Demand	Anodyne	CACNA1I	61	44
CCOc1cc(C(=O)N(C)Cc2ccc(F)c(C)c2)ccc1OCC(=O)O	ZINC000450540808	GG	On-Demand	Anodyne	PPARD	47	37
CCOc1cc(C(=O)N(C)Cc2ccc(F)c(C)c2)ccc1OCC(=O)O	ZINC000450540808	GG	On-Demand	Anodyne	PTGDR2	38	40
CC1(C)CN(C(=O)c2ccc(C(=O)O)nc2)CC[C@H]1C(F)(F)F	ZINC000450540810	EF	On-Demand	Anodyne	P4HTM	0	47
CC1(C)CN(C(=O)c2ccc(C(=O)O)nc2)CC[C@H]1C(F)(F)F	ZINC000450540810	EF	On-Demand	Anodyne	P4HA1	0	47
CC1(C)CN(C(=O)c2ccc(C(=O)O)nc2)CC[C@H]1C(F)(F)F	ZINC000450540810	EF	On-Demand	Anodyne	L3MBTL1	0	47
CC1(C)CN(C(=O)c2ccc(C(=O)O)nc2)CC[C@H]1C(F)(F)F	ZINC000450540810	EF	On-Demand	Anodyne	L3MBTL3	41	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)nc2)CC[C@@H]1C(F)(F)F	ZINC000450540811	EF	On-Demand	Anodyne	P4HTM	0	47
CC1(C)CN(C(=O)c2ccc(C(=O)O)nc2)CC[C@@H]1C(F)(F)F	ZINC000450540811	EF	On-Demand	Anodyne	P4HA1	0	47
CC1(C)CN(C(=O)c2ccc(C(=O)O)nc2)CC[C@@H]1C(F)(F)F	ZINC000450540811	EF	On-Demand	Anodyne	L3MBTL1	0	47
CC1(C)CN(C(=O)c2ccc(C(=O)O)nc2)CC[C@@H]1C(F)(F)F	ZINC000450540811	EF	On-Demand	Anodyne	L3MBTL3	41	33
CO[C@@H](Cc1ccccc1)C(=O)NCc1cnc(C)nc1O	ZINC000450540812	DD	On-Demand	Anodyne	AMP1_PLAFQ	54	40
CC(=O)c1ccc(NC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1Cl	ZINC000450540814	FE	On-Demand	Anodyne	CYSP_TRYCR	18	45
CO[C@H](Cc1ccccc1)C(=O)NCc1cnc(C)nc1O	ZINC000450540815	DD	On-Demand	Anodyne	AMP1_PLAFQ	54	40
O=C(O)C1(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450540817	EG	On-Demand	Anodyne	PPARA	22	42
CCn1c(NC(=O)[C@H]2CC2(F)F)nc2cc(F)ccc21	ZINC000450540826	CF	On-Demand	Anodyne	ITK	23	42
Cc1cc2c(Br)ccnc2cc1NCCS(=O)(=O)N(C)C	ZINC000450540830	FF	On-Demand	Anodyne	HRP1_PLAFA	44	32
CCn1c(NC(=O)[C@@H]2CC2(F)F)nc2cc(F)ccc21	ZINC000450540831	CF	On-Demand	Anodyne	ITK	23	42
CC[C@@H]1C[C@H]1C(=O)Nc1nc2cc(F)ccc2n1CC	ZINC000450540835	CG	On-Demand	Anodyne	ITK	25	43
C[C@H]1CN(c2ncnc3sc4c(c23)CCC4)CCN(C2CC2)C1	ZINC000450540847	EG	On-Demand	Anodyne	RBP4	18	45
C[C@@H]1CN(c2ncnc3sc4c(c23)CCC4)CCN(C2CC2)C1	ZINC000450540850	EG	On-Demand	Anodyne	RBP4	18	45
COc1ccc2c(c1)OCCN(C(=O)c1cc(C(=O)O)co1)C2	ZINC000450540852	DE	On-Demand	Anodyne	DRD4	40	31
CN(C)S(=O)(=O)N1CCCN(c2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450540853	GE	On-Demand	Anodyne	SORD	15	42
Cc1csc(C(=O)N2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450540861	DH	On-Demand	Anodyne	FASN	41	35
C=C[C@@H]1OCC[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450540862	GH	On-Demand	Mild	DRD4	22	45
C=C[C@@H]1OCC[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450540862	GH	On-Demand	Mild	SIGMAR1	20	45
C=C[C@@H]1OCC[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450540862	GH	On-Demand	Mild	SSTR5	47	39
C=C[C@@H]1OCC[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450540862	GH	On-Demand	Mild	MCHR1	38	43
CO[C@@H](Cc1ccccc1)C(=O)Nc1c(C)noc1C1CC1	ZINC000450540866	DG	On-Demand	Anodyne	TIMP3	59	34
CO[C@H](Cc1ccccc1)C(=O)Nc1c(C)noc1C1CC1	ZINC000450540868	DG	On-Demand	Anodyne	TIMP3	59	34
CCC1(CC)CCC(NC(=O)CCc2ccccc2C(=O)O)CC1	ZINC000450540878	EI	On-Demand	Anodyne	SIGMAR1	16	42
CCC1(CC)CCC(NC(=O)CCc2ccccc2C(=O)O)CC1	ZINC000450540878	EI	On-Demand	Anodyne	KCNA3	18	45
CCc1ccc2nccc(N3CCCN(S(=O)(=O)N(C)C)CC3)c2c1	ZINC000450540886	FE	On-Demand	Anodyne	SORD	15	45
CCCOc1cc(C)ccc1CNC(=O)c1ccnc(C(=O)O)c1	ZINC000450540896	EF	On-Demand	Anodyne	FTO	0	41
COc1ccc(CC(=O)NCc2cn(C)nc2C)c(Cl)c1OC	ZINC000450540902	EE	On-Demand	Anodyne	P2RX7	62	42
CCOC1(C)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450540908	FH	On-Demand	Anodyne	PDE3A	43	35
CCOC1(C)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450540908	FH	On-Demand	Anodyne	PDE3B	64	35
COC(=O)[C@@]1(c2ccccc2)CCN(c2nccc(C#N)n2)C1	ZINC000450540918	DD	On-Demand	Mild	KCNA3	20	46
COC(=O)[C@]1(c2ccccc2)CCN(c2nccc(C#N)n2)C1	ZINC000450540919	DD	On-Demand	Mild	KCNA3	20	46
CCOC1(C)CCN(c2nc(NC)c3ccccc3n2)CC1	ZINC000450540929	DE	On-Demand	Anodyne	HRH4	18	44
C[C@@H](O)CN(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450540930	CD	On-Demand	Anodyne	TUBB3	34	45
C[C@@H](O)CN(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450540930	CD	On-Demand	Anodyne	UTS2R	17	41
C[C@H](O)CN(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450540931	CD	On-Demand	Anodyne	TUBB3	34	45
C[C@H](O)CN(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450540931	CD	On-Demand	Anodyne	UTS2R	17	41
COc1ccc(-c2noc(N3CCC(CO)(c4ccccc4)CC3)n2)cc1	ZINC000450540933	FG	On-Demand	Anodyne	COLA	25	43
COc1ccc(-c2noc(N3CCC(CO)(c4ccccc4)CC3)n2)cc1	ZINC000450540933	FG	On-Demand	Anodyne	CPT1A	18	43
COc1ccc(-c2noc(N3CCC(CO)(c4ccccc4)CC3)n2)cc1	ZINC000450540933	FG	On-Demand	Anodyne	LUCI_PHOPE	21	40
CC1(C)CN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)C[C@H]1c1ccccc1	ZINC000450540936	FH	On-Demand	Bother	CACNA1D	53	33
CC1(C)CN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1	ZINC000450540937	FH	On-Demand	Bother	CACNA1D	53	33
CCC(=O)C1(C(=O)NCCCCOC(C)C)CC1	ZINC000450540941	CE	On-Demand	Anodyne	EPHX2	0	40
Cc1cc(OCc2ccccc2)nc(NC[C@H]2CC[C@@H](CO)O2)n1	ZINC000450540956	ED	On-Demand	Anodyne	VCP	53	34
COC(=O)[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccc(Cl)cc1	ZINC000450540961	FG	On-Demand	Anodyne	SLC6A2	18	48
COC(=O)[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccc(Cl)cc1	ZINC000450540961	FG	On-Demand	Anodyne	SLC6A1	177	51
COC(=O)[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccc(Cl)cc1	ZINC000450540961	FG	On-Demand	Anodyne	SLC6A4	33	51
COC(=O)[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccc(Cl)cc1	ZINC000450540961	FG	On-Demand	Anodyne	SLC6A3	72	48
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540975	FH	On-Demand	Anodyne	PRKCD	0	48
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540975	FH	On-Demand	Anodyne	PRKCE	18	48
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540975	FH	On-Demand	Anodyne	PRKCA	31	48
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540975	FH	On-Demand	Anodyne	PRKACA	26	48
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540976	FH	On-Demand	Anodyne	PRKCD	0	48
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540976	FH	On-Demand	Anodyne	PRKCE	18	48
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540976	FH	On-Demand	Anodyne	PRKCA	31	48
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450540976	FH	On-Demand	Anodyne	PRKACA	26	48
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540977	FH	On-Demand	Anodyne	PRKCD	0	48
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540977	FH	On-Demand	Anodyne	PRKCE	18	48
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540977	FH	On-Demand	Anodyne	PRKCA	31	48
O=C(CCc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540977	FH	On-Demand	Anodyne	PRKACA	26	48
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540978	FH	On-Demand	Anodyne	PRKCD	0	48
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540978	FH	On-Demand	Anodyne	PRKCE	18	48
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540978	FH	On-Demand	Anodyne	PRKCA	31	48
O=C(CCc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450540978	FH	On-Demand	Anodyne	PRKACA	26	48
CCC[C@H](C)C(=O)NCCNc1nccc(-c2ccc(OC)cc2)n1	ZINC000450540988	EG	On-Demand	Anodyne	SMG1	40	32
CCC[C@@H](C)C(=O)NCCNc1nccc(-c2ccc(OC)cc2)n1	ZINC000450540989	EG	On-Demand	Anodyne	SMG1	40	32
c1cc(CNc2nccc(-c3cnccn3)n2)cc(N2CCOCC2)c1	ZINC000450541000	EE	On-Demand	Anodyne	MAPK1	42	35
c1cc(CNc2nccc(-c3cnccn3)n2)cc(N2CCOCC2)c1	ZINC000450541000	EE	On-Demand	Anodyne	CLK2	28	42
c1cc(CNc2nccc(-c3cnccn3)n2)cc(N2CCOCC2)c1	ZINC000450541000	EE	On-Demand	Anodyne	CLK4	27	42
c1cc(CNc2nccc(-c3cnccn3)n2)cc(N2CCOCC2)c1	ZINC000450541000	EE	On-Demand	Anodyne	EPHB4	26	40
c1cc(CNc2nccc(-c3cnccn3)n2)cc(N2CCOCC2)c1	ZINC000450541000	EE	On-Demand	Anodyne	STAT6	68	43
c1cc(CNc2nccc(-c3cnccn3)n2)cc(N2CCOCC2)c1	ZINC000450541000	EE	On-Demand	Anodyne	SMG1	51	41
O=[N+]([O-])c1ccc(-c2csc(NC[C@H]3CC[C@@H](CO)O3)n2)cc1	ZINC000450541005	EE	On-Demand	Bother	MAOB	21	50
O=[N+]([O-])c1ccc2c(N3CCC(CO)(c4ccccc4)CC3)nccc2c1	ZINC000450541006	FH	On-Demand	Bother	SORD	15	41
C[C@H]1CN(c2ncnc3cc(Br)ccc23)CCN(C2CCC2)C1	ZINC000450541011	GH	On-Demand	Anodyne	PDE3A	47	35
C[C@H]1CN(c2ncnc3cc(Br)ccc23)CCN(C2CCC2)C1	ZINC000450541011	GH	On-Demand	Anodyne	PDE3B	69	35
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCN(C2CCC2)C1	ZINC000450541012	GH	On-Demand	Anodyne	PDE3A	47	35
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCN(C2CCC2)C1	ZINC000450541012	GH	On-Demand	Anodyne	PDE3B	69	35
C[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450541013	DD	On-Demand	Anodyne	CCKBR	42	37
C[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450541013	DD	On-Demand	Anodyne	EPHX2	23	53
C[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450541014	DD	On-Demand	Anodyne	CCKBR	42	37
C[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450541014	DD	On-Demand	Anodyne	EPHX2	23	53
C[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450541015	DD	On-Demand	Anodyne	CCKBR	42	37
C[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450541015	DD	On-Demand	Anodyne	EPHX2	23	53
C[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450541016	DD	On-Demand	Anodyne	CCKBR	42	37
C[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450541016	DD	On-Demand	Anodyne	EPHX2	23	53
CCOc1cc(C(=O)NC2CCC3(CCOCC3)CC2)ccc1OCC(=O)O	ZINC000450541017	GG	On-Demand	Anodyne	MAPK14	20	40
CCOc1cc(C(=O)NC2CCC3(CCOCC3)CC2)ccc1OCC(=O)O	ZINC000450541017	GG	On-Demand	Anodyne	SSTR5	53	41
Cc1nc(N[C@@H](CCCC#N)c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450541021	DH	On-Demand	Mild	PRKCQ	29	43
Cc1nc(N[C@H](CCCC#N)c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450541022	DH	On-Demand	Mild	PRKCQ	29	43
COc1ccc2c(c1)OCCN(C(=O)c1cccc(OCC(=O)O)c1)C2	ZINC000450541035	FE	On-Demand	Anodyne	DRD4	47	36
COc1ccc2c(c1)OCCN(C(=O)c1ccc(C(=O)O)c(C)n1)C2	ZINC000450541043	EE	On-Demand	Anodyne	AKR1C2	46	37
Cc1ccccc1C[C@@H](C)N(C)C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450541044	DG	On-Demand	Anodyne	SLC6A1	54	34
Cc1ccccc1C[C@H](C)N(C)C(=O)C1CCC(C(=O)O)CC1	ZINC000450541045	DG	On-Demand	Anodyne	SLC6A1	54	34
Cc1ccccc1C[C@H](C)N(C)C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1	ZINC000450541046	DG	On-Demand	Anodyne	SLC6A1	54	34
Cc1ccccc1C[C@@H](C)N(C)C(=O)C1CCC(C(=O)O)CC1	ZINC000450541047	DG	On-Demand	Anodyne	SLC6A1	54	34
CNS(=O)(=O)NCC(=O)N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450541069	GD	On-Demand	Anodyne	RBP4	72	38
CNS(=O)(=O)NCC(=O)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450541070	GD	On-Demand	Anodyne	RBP4	72	38
CNS(=O)(=O)NCC(=O)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450541071	GD	On-Demand	Anodyne	RBP4	72	38
CNS(=O)(=O)NCC(=O)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450541072	GD	On-Demand	Anodyne	RBP4	72	38
Cc1nc(N[C@@H]2CCC[C@@H]2F)ncc1[N+](=O)[O-]	ZINC000450541094	BD	On-Demand	Bother	PRKCQ	45	36
Cc1nc(N[C@H]2CCC[C@H]2F)ncc1[N+](=O)[O-]	ZINC000450541095	BD	On-Demand	Bother	PRKCQ	45	36
Cc1ccc(C(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)c(C(C)C)n1	ZINC000450541101	GH	On-Demand	Mild	DGAT1	20	40
Cc1ccc(C(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)c(C(C)C)n1	ZINC000450541101	GH	On-Demand	Mild	HIVRT	0	42
Cc1ccccc1C[C@@H](C)N(C)C(=O)CCC(=O)O	ZINC000450541130	CE	On-Demand	Anodyne	CPA1	15	45
Cc1ccccc1C[C@H](C)N(C)C(=O)CCC(=O)O	ZINC000450541132	CE	On-Demand	Anodyne	CPA1	15	45
O=C(O)c1ccc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c(F)c1	ZINC000450541138	GH	On-Demand	Anodyne	CACNA1B	47	35
COc1ccc(C(=O)NC[C@H]2CCCCS2)cc1S(C)(=O)=O	ZINC000450541139	EE	On-Demand	Anodyne	CPT1B	44	32
COc1ccc(C(=O)NC[C@@H]2CCCCS2)cc1S(C)(=O)=O	ZINC000450541140	EE	On-Demand	Anodyne	CPT1B	44	32
O=C(O)c1ccc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c(F)c1	ZINC000450541142	GH	On-Demand	Anodyne	CACNA1B	47	35
CC(=O)N[C@H](C(=O)N[C@@H](C)C[C@H](C)O)C(C)(C)C	ZINC000450541164	CC	On-Demand	Anodyne	MMP3	0	41
CC(=O)N[C@H](C(=O)N[C@@H](C)C[C@H](C)O)C(C)(C)C	ZINC000450541164	CC	On-Demand	Anodyne	MMP1	0	41
CC(=O)N[C@H](C(=O)N[C@H](C)C[C@@H](C)O)C(C)(C)C	ZINC000450541165	CC	On-Demand	Anodyne	MMP3	0	41
CC(=O)N[C@H](C(=O)N[C@H](C)C[C@@H](C)O)C(C)(C)C	ZINC000450541165	CC	On-Demand	Anodyne	MMP1	0	41
CC(=O)N[C@H](C(=O)N[C@@H](C)C[C@@H](C)O)C(C)(C)C	ZINC000450541166	CC	On-Demand	Anodyne	MMP3	0	41
CC(=O)N[C@H](C(=O)N[C@@H](C)C[C@@H](C)O)C(C)(C)C	ZINC000450541166	CC	On-Demand	Anodyne	MMP1	0	41
CC(=O)N[C@H](C(=O)N[C@H](C)C[C@H](C)O)C(C)(C)C	ZINC000450541167	CC	On-Demand	Anodyne	MMP3	0	41
CC(=O)N[C@H](C(=O)N[C@H](C)C[C@H](C)O)C(C)(C)C	ZINC000450541167	CC	On-Demand	Anodyne	MMP1	0	41
COc1cccc(OCCC(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)c1	ZINC000450541174	GI	On-Demand	Anodyne	MTNR1A	37	45
COc1cccc(OCCC(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)c1	ZINC000450541174	GI	On-Demand	Anodyne	MTNR1B	38	45
COc1cccc(OCCC(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)c1	ZINC000450541175	GI	On-Demand	Anodyne	MTNR1A	37	45
COc1cccc(OCCC(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)c1	ZINC000450541175	GI	On-Demand	Anodyne	MTNR1B	38	45
O=C(O)COc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450541178	FG	On-Demand	Anodyne	PTGIR	47	37
O=C(O)COc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450541178	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
O=C(O)COc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450541178	FG	On-Demand	Anodyne	FABP4	44	34
O=C(O)COc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450541178	FG	On-Demand	Anodyne	HSD11B1	0	44
O=C(O)COc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450541178	FG	On-Demand	Anodyne	COLA	67	39
O=C(O)COc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450541178	FG	On-Demand	Anodyne	CPT1A	61	39
O=C(O)COc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450541178	FG	On-Demand	Anodyne	CHRNA10	40	33
O=C(O)COc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450541178	FG	On-Demand	Anodyne	L3MBTL1	0	40
O=C(O)COc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450541179	FG	On-Demand	Anodyne	PTGIR	47	37
O=C(O)COc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450541179	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
O=C(O)COc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450541179	FG	On-Demand	Anodyne	FABP4	44	34
O=C(O)COc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450541179	FG	On-Demand	Anodyne	HSD11B1	0	44
O=C(O)COc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450541179	FG	On-Demand	Anodyne	COLA	67	39
O=C(O)COc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450541179	FG	On-Demand	Anodyne	CPT1A	61	39
O=C(O)COc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450541179	FG	On-Demand	Anodyne	CHRNA10	40	33
O=C(O)COc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450541179	FG	On-Demand	Anodyne	L3MBTL1	0	40
C[C@H](O)C[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541180	CD	On-Demand	Anodyne	P2RX3	18	46
C[C@H](O)C[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541180	CD	On-Demand	Anodyne	CTSV	48	33
C[C@H](O)C[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541180	CD	On-Demand	Anodyne	GPR142	17	40
C[C@@H](C[C@@H](C)O)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541181	CD	On-Demand	Anodyne	P2RX3	18	46
C[C@@H](C[C@@H](C)O)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541181	CD	On-Demand	Anodyne	CTSV	48	33
C[C@@H](C[C@@H](C)O)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541181	CD	On-Demand	Anodyne	GPR142	17	40
C[C@H](O)C[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541182	CD	On-Demand	Anodyne	P2RX3	18	46
C[C@H](O)C[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541182	CD	On-Demand	Anodyne	CTSV	48	33
C[C@H](O)C[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541182	CD	On-Demand	Anodyne	GPR142	17	40
C[C@@H](O)C[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541183	CD	On-Demand	Anodyne	P2RX3	18	46
C[C@@H](O)C[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541183	CD	On-Demand	Anodyne	CTSV	48	33
C[C@@H](O)C[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450541183	CD	On-Demand	Anodyne	GPR142	17	40
COCCOCc1ccc(CNc2nc(N(C)C)c3ccccc3n2)cc1	ZINC000450541184	FF	On-Demand	Anodyne	ADRA2A	16	47
Cc1nn(C)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450541189	DD	On-Demand	Anodyne	ANPEP	34	40
COc1ccc(-c2ccnc(NC[C@@H](C)CN(C)C)n2)cc1	ZINC000450541190	DF	On-Demand	Anodyne	CLK4	27	54
COc1ccc(-c2ccnc(NC[C@H](C)CN(C)C)n2)cc1	ZINC000450541191	DF	On-Demand	Anodyne	CLK4	27	54
COCC1(CNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450541200	EH	On-Demand	Anodyne	HRP1_PLAFA	84	35
COCC1(CNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450541200	EH	On-Demand	Anodyne	HNMT	48	33
Cc1ccc(C2CCN(C(=O)Cc3ccc(OC(F)F)c(F)c3)CC2)cn1	ZINC000450541223	GI	On-Demand	Anodyne	CCR1	40	37
CCNC(=O)[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(C)C	ZINC000450541245	EF	On-Demand	Anodyne	CAPN2	58	37
CCNC(=O)[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(C)C	ZINC000450541245	EF	On-Demand	Anodyne	ACE2	47	38
CCNC(=O)[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(C)C	ZINC000450541245	EF	On-Demand	Anodyne	ADAMTS4	44	38
CN(C(=O)CC1(O)CCC1)[C@@H](CNC(=O)CC1(O)CCC1)Cc1ccccc1	ZINC000450541251	GD	On-Demand	Anodyne	MME	40	37
CN(C(=O)CC1(O)CCC1)[C@@H](CNC(=O)CC1(O)CCC1)Cc1ccccc1	ZINC000450541251	GD	On-Demand	Anodyne	TIMP3	47	32
CN(C(=O)CC1(O)CCC1)[C@H](CNC(=O)CC1(O)CCC1)Cc1ccccc1	ZINC000450541252	GD	On-Demand	Anodyne	MME	40	37
CN(C(=O)CC1(O)CCC1)[C@H](CNC(=O)CC1(O)CCC1)Cc1ccccc1	ZINC000450541252	GD	On-Demand	Anodyne	TIMP3	47	32
CCNC(=O)[C@@H](Nc1ncnc2[nH]c3ccccc3c12)C(C)C	ZINC000450541269	DF	On-Demand	Anodyne	UTS2R	27	42
CCNC(=O)[C@@H](Nc1ncnc2[nH]c3ccccc3c12)C(C)C	ZINC000450541269	DF	On-Demand	Anodyne	GRPR	42	30
O=C(c1ccc(-c2ccncc2)c(F)c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450541277	GI	On-Demand	Anodyne	TBXAS1	38	42
Cc1nc(C2CC2)ccc1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541297	FH	On-Demand	Anodyne	HMOX2	45	33
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541298	DH	On-Demand	Anodyne	TBXAS1	20	43
CCCc1nc(C)c(CNc2nccc(-c3ccc(OC)cc3)n2)o1	ZINC000450541300	EI	On-Demand	Anodyne	CLK4	26	52
CCC[C@@H](CC(C)C)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541301	EI	On-Demand	Anodyne	TBXAS1	21	41
CCC[C@H](CC(C)C)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541302	EI	On-Demand	Anodyne	TBXAS1	21	41
COC(=O)c1ccc(CC(=O)N2CCC(CCCn3ccnc3)CC2)cc1	ZINC000450541303	FF	On-Demand	Anodyne	CYP19A1	0	41
COC(=O)c1ccc(CC(=O)N2CCC(CCCn3ccnc3)CC2)cc1	ZINC000450541303	FF	On-Demand	Anodyne	TBXAS1	50	39
OCC1(c2ccccc2)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450541304	GH	On-Demand	Anodyne	AKT2	28	42
OCC1(c2ccccc2)CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450541304	GH	On-Demand	Anodyne	AKT3	26	42
COCC(C)(C)CNc1nccc(-c2ccc(OC)cc2)n1	ZINC000450541305	DG	On-Demand	Anodyne	CLK4	26	57
CC[C@H](CC(C)C)C(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450541315	CG	On-Demand	Anodyne	MTNN	45	31
CC[C@@H](CC(C)C)C(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450541316	CG	On-Demand	Anodyne	MTNN	45	31
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1ccnc(NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)c1	ZINC000450541325	FH	On-Demand	Anodyne	NOS2	57	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1ccnc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)c1	ZINC000450541326	FH	On-Demand	Anodyne	NOS2	57	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1ccnc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)c1	ZINC000450541327	FH	On-Demand	Anodyne	NOS2	57	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1ccnc(NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)c1	ZINC000450541328	FH	On-Demand	Anodyne	NOS2	57	34
C[C@@]1(Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C[C@H]1c1ccccc1	ZINC000450541344	EG	On-Demand	Bother	TBXA2R	0	40
C[C@H]1CN(c2ccccc2S(C)(=O)=O)CCN(C2CC2)C1	ZINC000450541346	DE	On-Demand	Anodyne	ADRA1B	30	40
C[C@@H]1CN(c2ccccc2S(C)(=O)=O)CCN(C2CC2)C1	ZINC000450541347	DE	On-Demand	Anodyne	ADRA1B	30	40
CC1(C)CN(C(=O)c2cccc(C(=O)O)c2)CC[C@H]1C(F)(F)F	ZINC000450541363	EG	On-Demand	Anodyne	L3MBTL1	0	46
CC1(C)CN(C(=O)c2cccc(C(=O)O)c2)CC[C@H]1C(F)(F)F	ZINC000450541363	EG	On-Demand	Anodyne	L3MBTL3	41	33
CC1(C)CN(C(=O)c2cccc(C(=O)O)c2)CC[C@@H]1C(F)(F)F	ZINC000450541364	EG	On-Demand	Anodyne	L3MBTL1	0	46
CC1(C)CN(C(=O)c2cccc(C(=O)O)c2)CC[C@@H]1C(F)(F)F	ZINC000450541364	EG	On-Demand	Anodyne	L3MBTL3	41	33
Cc1ccccc1C[C@@H](C)N(C)C(=O)c1ccnc(C(=O)O)c1	ZINC000450541373	DF	On-Demand	Anodyne	FTO	0	43
Cc1ccccc1C[C@H](C)N(C)C(=O)c1ccnc(C(=O)O)c1	ZINC000450541374	DF	On-Demand	Anodyne	FTO	0	43
Cc1ccccc1C[C@@H](C)N(C)C(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1	ZINC000450541385	FG	On-Demand	Bother	COLA	57	32
Cc1ccccc1C[C@H](C)N(C)C(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1	ZINC000450541386	FG	On-Demand	Bother	COLA	57	32
COc1ccc(-c2ccnc(N3CCC[C@H](O)CC3)n2)cc1	ZINC000450541407	CF	On-Demand	Anodyne	DKK1	0	50
COc1ccc(-c2ccnc(N3CCC[C@@H](O)CC3)n2)cc1	ZINC000450541408	CF	On-Demand	Anodyne	DKK1	0	50
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450541441	DI	On-Demand	Anodyne	NPY2R	49	35
COC(=O)CN1CCC[C@H](CNc2nc3ccccc3cc2[N+](=O)[O-])C1	ZINC000450541444	FD	On-Demand	Bother	PRKCQ	48	37
COC(=O)CN1CCC[C@@H](CNc2nc3ccccc3cc2[N+](=O)[O-])C1	ZINC000450541445	FD	On-Demand	Bother	PRKCQ	48	37
CC(=O)N[C@H](C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1)C(C)(C)C	ZINC000450541465	GF	On-Demand	Anodyne	NPY5R	16	43
O=C(O)c1cccc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450541466	GH	On-Demand	Anodyne	CCR2	40	38
O=C(O)c1cccc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450541466	GH	On-Demand	Anodyne	RBP4	15	47
O=C(O)c1cccc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450541466	GH	On-Demand	Anodyne	HPGD	16	41
O=C(O)c1cccc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450541467	GH	On-Demand	Anodyne	CCR2	40	38
O=C(O)c1cccc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450541467	GH	On-Demand	Anodyne	RBP4	15	47
O=C(O)c1cccc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450541467	GH	On-Demand	Anodyne	HPGD	16	41
Cc1ccc(C2CCN(C(=O)c3ccc4cnccc4c3)CC2)cn1	ZINC000450541489	EH	On-Demand	Anodyne	FASN	47	39
Cc1ccc(C2CCN(C(=O)c3ccc4cnccc4c3)CC2)cn1	ZINC000450541489	EH	On-Demand	Anodyne	L3MBTL1	0	43
Cc1ccc(C2CCN(C(=O)c3ccc4cnccc4c3)CC2)cn1	ZINC000450541489	EH	On-Demand	Anodyne	L3MBTL3	61	43
COC(=O)Cc1ccc(NCc2ccc(OC)nc2OC)c([N+](=O)[O-])c1	ZINC000450541492	FE	On-Demand	Bother	DRTS_TOXGO	17	40
COc1ccc(CC(=O)N2CCC(c3ccc(C)nc3)CC2)c(Cl)c1OC	ZINC000450541500	GI	On-Demand	Anodyne	CCR1	51	34
CCCOc1cc(C)ccc1CNC(=O)Cc1cccc(C(=O)O)c1	ZINC000450541502	EG	On-Demand	Anodyne	PPARD	26	43
CCCOc1cc(C)ccc1CNC(=O)Cc1cccc(C(=O)O)c1	ZINC000450541502	EG	On-Demand	Anodyne	PLA2G4B	46	38
Cc1ccc(C2CCN(C(=O)CCCC(=O)C(C)(C)C)CC2)cn1	ZINC000450541505	EH	On-Demand	Anodyne	ETHR	52	33
COc1ccc(CNc2nc(N(C)C)c3ccccc3n2)c(OC)n1	ZINC000450541510	EE	On-Demand	Anodyne	ADRA2A	16	48
O=C(O)CSCC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450541516	FG	On-Demand	Anodyne	ENPP1	58	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450541539	FF	On-Demand	Bother	AADAC	0	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450541560	FH	On-Demand	Anodyne	TBXAS1	41	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450541560	FH	On-Demand	Anodyne	NAMPT	15	41
CC[C@@H]1C[C@H]1C(=O)NCCCCOC(C)C	ZINC000450541563	BE	On-Demand	Anodyne	EPHX2	33	43
CC(C)c1nnc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000450541564	ED	On-Demand	Anodyne	CA7	22	46
CC(C)C[C@@H]1C[C@H]1C(=O)NCCCCOC(C)C	ZINC000450541571	CF	On-Demand	Anodyne	EPHX2	0	42
COc1cccc(Oc2ccc(C(=O)NCCCCOC(C)C)nc2)c1	ZINC000450541577	FH	On-Demand	Anodyne	DRD4	43	32
COc1cccc(Oc2ccc(C(=O)NCCCCOC(C)C)nc2)c1	ZINC000450541577	FH	On-Demand	Anodyne	DRD3	15	42
COc1cccc(Oc2ccc(C(=O)NCCCCOC(C)C)nc2)c1	ZINC000450541577	FH	On-Demand	Anodyne	MTNR1A	44	41
COc1cccc(Oc2ccc(C(=O)NCCCCOC(C)C)nc2)c1	ZINC000450541577	FH	On-Demand	Anodyne	MTNR1B	42	41
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541578	EI	On-Demand	Anodyne	TBXAS1	23	42
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541579	EI	On-Demand	Anodyne	TBXAS1	23	42
CCC[C@H]1CCC[C@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541580	EI	On-Demand	Anodyne	TBXAS1	23	42
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541581	EI	On-Demand	Anodyne	TBXAS1	23	42
CCC[C@@H](C)C(=O)NCCNc1nc(N(C)C)c2ccccc2n1	ZINC000450541582	EE	On-Demand	Anodyne	ADRA2A	17	48
CCC[C@H](C)C(=O)NCCNc1nc(N(C)C)c2ccccc2n1	ZINC000450541583	EE	On-Demand	Anodyne	ADRA2A	17	48
COC(=O)[C@@H]1CN(c2nc(C3CCC3)no2)C[C@H]1c1ccc(Cl)cc1	ZINC000450541587	FG	On-Demand	Anodyne	SLC6A1	125	50
COC(=O)[C@@H]1CN(c2nc(C3CCC3)no2)C[C@H]1c1ccc(Cl)cc1	ZINC000450541587	FG	On-Demand	Anodyne	SLC6A4	24	50
COC(=O)[C@@H]1CN(c2nc(C3CCC3)no2)C[C@H]1c1ccc(Cl)cc1	ZINC000450541587	FG	On-Demand	Anodyne	SLC6A3	42	41
Cc1ccc(CN(CCO)C(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450541588	FG	On-Demand	Anodyne	PLM2_PLAFA	44	37
O=C(O)CCCCC(=O)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450541601	EG	On-Demand	Anodyne	LUXR	64	36
O=C(O)CCCCC(=O)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450541601	EG	On-Demand	Anodyne	TRAR	48	36
O=C(O)CCCCC(=O)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450541601	EG	On-Demand	Anodyne	LASR	48	36
O=C(O)CCCCC(=O)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450541602	EG	On-Demand	Anodyne	LUXR	64	36
O=C(O)CCCCC(=O)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450541602	EG	On-Demand	Anodyne	TRAR	48	36
O=C(O)CCCCC(=O)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450541602	EG	On-Demand	Anodyne	LASR	48	36
O=C(CCCC(=O)N1CCC(CCCn2ccnc2)CC1)C1CC1	ZINC000450541615	EG	On-Demand	Anodyne	TBXAS1	26	46
O=C(CCCC(=O)N1CCC(CCCn2ccnc2)CC1)C1CC1	ZINC000450541615	EG	On-Demand	Anodyne	GNAI3	0	43
C[C@@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)[C@H](C)CN1C	ZINC000450541621	GF	On-Demand	Anodyne	HCRTR1	27	41
C[C@@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)[C@H](C)CN1C	ZINC000450541621	GF	On-Demand	Anodyne	HCRTR2	41	41
C[C@H]1CN(C)[C@H](C)CN1C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450541622	GF	On-Demand	Anodyne	HCRTR1	27	41
C[C@H]1CN(C)[C@H](C)CN1C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450541622	GF	On-Demand	Anodyne	HCRTR2	41	41
C[C@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)[C@H](C)CN1C	ZINC000450541623	GF	On-Demand	Anodyne	HCRTR1	27	41
C[C@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)[C@H](C)CN1C	ZINC000450541623	GF	On-Demand	Anodyne	HCRTR2	41	41
C[C@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)[C@@H](C)CN1C	ZINC000450541624	GF	On-Demand	Anodyne	HCRTR1	27	41
C[C@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)[C@@H](C)CN1C	ZINC000450541624	GF	On-Demand	Anodyne	HCRTR2	41	41
COC(CNC(=O)c1cncc(Cl)c1)CNC(=O)c1cncc(Cl)c1	ZINC000450541630	GD	On-Demand	Anodyne	SCN10A	43	39
COC(CNC(=O)c1cncc(Cl)c1)CNC(=O)c1cncc(Cl)c1	ZINC000450541630	GD	On-Demand	Anodyne	CACNA1I	42	34
CCc1noc(C)c1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450541637	DI	On-Demand	Anodyne	HRP1_PLAFA	46	30
Cn1cc(-c2ccc(C(=O)NC[C@H]3CCCCS3)o2)cn1	ZINC000450541642	DF	On-Demand	Anodyne	MMP13	0	44
Cn1cc(-c2ccc(C(=O)NC[C@@H]3CCCCS3)o2)cn1	ZINC000450541643	DF	On-Demand	Anodyne	MMP13	0	44
Cc1ccccc1C[C@H](C)N(C)C(=O)c1cccc(OCC(=O)O)c1	ZINC000450541650	EG	On-Demand	Anodyne	FABP4	46	37
Cc1ccccc1C[C@H](C)N(C)C(=O)c1cccc(OCC(=O)O)c1	ZINC000450541650	EG	On-Demand	Anodyne	CRTH2	0	41
Cc1ccccc1C[C@H](C)N(C)C(=O)c1cccc(OCC(=O)O)c1	ZINC000450541650	EG	On-Demand	Anodyne	PDS	47	32
Cc1ccccc1C[C@@H](C)N(C)C(=O)c1cccc(OCC(=O)O)c1	ZINC000450541651	EG	On-Demand	Anodyne	FABP4	46	37
Cc1ccccc1C[C@@H](C)N(C)C(=O)c1cccc(OCC(=O)O)c1	ZINC000450541651	EG	On-Demand	Anodyne	CRTH2	0	41
Cc1ccccc1C[C@@H](C)N(C)C(=O)c1cccc(OCC(=O)O)c1	ZINC000450541651	EG	On-Demand	Anodyne	PDS	47	32
COc1ccc(-c2ccnc(N3C[C@H](C)N(C)[C@H](C)C3)n2)cc1	ZINC000450541664	DF	On-Demand	Anodyne	SORD	61	38
COc1ccc(-c2ccnc(N3C[C@H](C)N(C)[C@H](C)C3)n2)cc1	ZINC000450541664	DF	On-Demand	Anodyne	DKK1	0	40
CN(C)c1nc(NCCCCS(N)(=O)=O)nc2ccccc12	ZINC000450541665	DC	On-Demand	Anodyne	ADRA2A	19	54
CN(C)c1nc(NCCCCS(N)(=O)=O)nc2ccccc12	ZINC000450541665	DC	On-Demand	Anodyne	SLC2A1	17	40
CN(C)c1nc(NCCCCS(N)(=O)=O)nc2ccccc12	ZINC000450541665	DC	On-Demand	Anodyne	HT1	16	40
CCOC1CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450541672	DF	On-Demand	Anodyne	PDE3A	51	44
CCOC1CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450541672	DF	On-Demand	Anodyne	PDE3B	76	44
Cc1ncc(CNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c(O)n1	ZINC000450541689	FD	On-Demand	Anodyne	SCN10A	21	42
Cc1ncc(CNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c(O)n1	ZINC000450541689	FD	On-Demand	Anodyne	STAT6	40	33
COCCN1CCN(C(=O)c2c(C)cccc2Cl)CC1=O	ZINC000450541699	DD	On-Demand	Anodyne	P2RX7	29	47
COc1ccccc1Oc1ccc(C(=O)NCc2nnc(C3CCC3)n2C)nc1	ZINC000450541708	GG	On-Demand	Anodyne	ACKR3	41	30
COc1ccc2c(c1)OCCN(C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1)C2	ZINC000450541715	EE	On-Demand	Anodyne	MTNR1A	21	47
COc1ccc2c(c1)OCCN(C(=O)[C@@H]1CC[C@@H](C(=O)O)CC1)C2	ZINC000450541715	EE	On-Demand	Anodyne	MTNR1B	18	43
COc1ccc2c(c1)OCCN(C(=O)C1CCC(C(=O)O)CC1)C2	ZINC000450541716	EE	On-Demand	Anodyne	MTNR1A	21	47
COc1ccc2c(c1)OCCN(C(=O)C1CCC(C(=O)O)CC1)C2	ZINC000450541716	EE	On-Demand	Anodyne	MTNR1B	18	43
CCc1cccc(C(=O)NCc2cnc(C)nc2O)n1	ZINC000450541722	CD	On-Demand	Anodyne	PDE5A	26	41
Cc1ccc(C2CCN(C(=O)c3cccc(C#N)c3Br)CC2)cn1	ZINC000450541733	GI	On-Demand	Mild	FASN	46	38
Cc1ccc(C2CCN(C(=O)c3cccc4c3CCCC4)CC2)cn1	ZINC000450541734	EI	On-Demand	Anodyne	FABP4	40	33
Cc1ccc(C2CCN(C(=O)c3cccc4c3CCCC4)CC2)cn1	ZINC000450541734	EI	On-Demand	Anodyne	FASN	42	36
Cc1ccc(C2CCN(C(=O)c3cccc4c3CCCC4)CC2)cn1	ZINC000450541734	EI	On-Demand	Anodyne	L3MBTL3	47	36
O=C(O)[C@@H]1CC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541735	GI	On-Demand	Anodyne	DHODH	43	38
O=C(O)[C@@H]1CC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541735	GI	On-Demand	Anodyne	MPL	15	40
O=C(O)[C@@H]1CC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541735	GI	On-Demand	Anodyne	NPY2R	40	44
O=C(O)[C@@H]1CC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541735	GI	On-Demand	Anodyne	GRM4	15	40
O=C(O)[C@@H]1CC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541735	GI	On-Demand	Anodyne	EPHX2	15	42
O=C(O)[C@@H]1CC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541735	GI	On-Demand	Anodyne	TYK2	55	38
O=C(O)C1CCC(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541736	GI	On-Demand	Anodyne	DHODH	43	38
O=C(O)C1CCC(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541736	GI	On-Demand	Anodyne	MPL	15	40
O=C(O)C1CCC(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541736	GI	On-Demand	Anodyne	NPY2R	40	44
O=C(O)C1CCC(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541736	GI	On-Demand	Anodyne	GRM4	15	40
O=C(O)C1CCC(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541736	GI	On-Demand	Anodyne	EPHX2	15	42
O=C(O)C1CCC(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)CC1	ZINC000450541736	GI	On-Demand	Anodyne	TYK2	55	38
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(C3CCC3)no2)C1	ZINC000450541752	EF	On-Demand	Anodyne	COLA	55	37
COC(=O)[C@]1(c2ccccc2)CCN(c2nc(C3CCC3)no2)C1	ZINC000450541752	EF	On-Demand	Anodyne	CPT1A	40	37
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(C3CCC3)no2)C1	ZINC000450541753	EF	On-Demand	Anodyne	COLA	55	37
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(C3CCC3)no2)C1	ZINC000450541753	EF	On-Demand	Anodyne	CPT1A	40	37
COc1ccc2c(N3CC[C@@H](n4cc(Cl)cn4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450541770	FG	On-Demand	Bother	PDE3B	54	34
COc1ccc2c(N3CC[C@H](n4cc(Cl)cn4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450541771	FG	On-Demand	Bother	PDE3B	54	34
C[C@@H](O)C[C@@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450541776	CD	On-Demand	Anodyne	MMP13	19	45
C[C@H](O)C[C@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450541777	CD	On-Demand	Anodyne	MMP13	19	45
C[C@@H](C[C@@H](C)O)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450541778	CD	On-Demand	Anodyne	MMP13	19	45
C[C@H](O)C[C@@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450541779	CD	On-Demand	Anodyne	MMP13	19	45
COc1ccc(-c2ccnc(NC[C@@](C)(OC)C3CC3)n2)cc1	ZINC000450541782	DG	On-Demand	Anodyne	CLK4	25	53
COc1ccc(-c2ccnc(NC[C@@](C)(OC)C3CC3)n2)cc1	ZINC000450541782	DG	On-Demand	Anodyne	DYRK1B	15	55
COc1ccc(-c2ccnc(NC[C@](C)(OC)C3CC3)n2)cc1	ZINC000450541783	DG	On-Demand	Anodyne	CLK4	25	53
COc1ccc(-c2ccnc(NC[C@](C)(OC)C3CC3)n2)cc1	ZINC000450541783	DG	On-Demand	Anodyne	DYRK1B	15	55
CCCc1c(NC(=O)[C@H](Cc2ccccc2)OC)cnn1-c1ccccc1	ZINC000450541784	FI	On-Demand	Anodyne	GPR142	41	34
CCCc1c(NC(=O)[C@@H](Cc2ccccc2)OC)cnn1-c1ccccc1	ZINC000450541785	FI	On-Demand	Anodyne	GPR142	41	34
COCC1(CNc2nc(N(C)C)c3ccccc3n2)CCOCC1	ZINC000450541791	ED	On-Demand	Anodyne	ADRA2A	15	47
O=C(O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)C1	ZINC000450541800	EG	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@H](c3c(F)cccc3F)C2)C1	ZINC000450541801	EG	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H](c3c(F)cccc3F)C2)C1	ZINC000450541802	EG	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)C1	ZINC000450541803	EG	On-Demand	Anodyne	SLC6A1	68	38
C[C@H](O)C[C@@H](C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450541806	DD	On-Demand	Anodyne	PDE4D	15	42
C[C@H](O)C[C@H](C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450541807	DD	On-Demand	Anodyne	PDE4D	15	42
C[C@H](O)C[C@@H](C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450541808	DD	On-Demand	Anodyne	PDE4D	15	42
C[C@H](O)C[C@H](C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450541809	DD	On-Demand	Anodyne	PDE4D	15	42
O=C(O)[C@H]1CC[C@@H](C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)O1	ZINC000450541825	FE	On-Demand	Anodyne	LIPG	48	33
O=C(O)[C@H]1CC[C@@H](C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)O1	ZINC000450541826	FE	On-Demand	Anodyne	LIPG	48	33
CC(=O)c1ccc(NC(=O)c2ncoc2C2CC2)cc1Cl	ZINC000450541827	DH	On-Demand	Anodyne	GRM4	45	36
CC(=O)c1ccc(NC(=O)c2ncoc2C2CC2)cc1Cl	ZINC000450541827	DH	On-Demand	Anodyne	TYK2	59	38
COc1ccc(C(=O)N2CCC(c3ccc(C)nc3)CC2)cc1S(C)(=O)=O	ZINC000450541828	GF	On-Demand	Anodyne	FASN	41	37
COc1ccc(C(=O)N2CCC(c3ccc(C)nc3)CC2)cc1S(C)(=O)=O	ZINC000450541828	GF	On-Demand	Anodyne	L3MBTL3	68	37
CC(F)(F)C(C)(C)C(=O)Nc1cccc(-c2cnn[nH]2)c1	ZINC000450541835	CG	On-Demand	Anodyne	RIPK1	46	33
COc1ccc(-c2noc(N(C)C[C@@H](O)Cc3ccccc3)n2)cc1	ZINC000450541836	EF	On-Demand	Anodyne	LUCI_PHOPE	30	44
COc1ccc(-c2noc(N(C)C[C@H](O)Cc3ccccc3)n2)cc1	ZINC000450541837	EF	On-Demand	Anodyne	LUCI_PHOPE	30	44
CC(C)c1nnc(N2CCC3(CCN(Cc4ccccc4)CC3)C2)o1	ZINC000450541856	EH	On-Demand	Anodyne	SIGMAR1	51	42
CC(C)OCCCCNC(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450541868	DF	On-Demand	Anodyne	KIT	19	40
C[C@@H]1CC[C@]2(CCN(C(=O)c3cccc(C(=O)O)c3)C2)C1	ZINC000450541869	CG	On-Demand	Anodyne	L3MBTL1	0	41
C[C@H]1CC[C@]2(CCN(C(=O)c3cccc(C(=O)O)c3)C2)C1	ZINC000450541870	CG	On-Demand	Anodyne	L3MBTL1	0	41
C[C@@H]1CC[C@@]2(CCN(C(=O)c3cccc(C(=O)O)c3)C2)C1	ZINC000450541871	CG	On-Demand	Anodyne	L3MBTL1	0	41
C[C@H]1CC[C@@]2(CCN(C(=O)c3cccc(C(=O)O)c3)C2)C1	ZINC000450541872	CG	On-Demand	Anodyne	L3MBTL1	0	41
CCSc1cccnc1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541873	FH	On-Demand	Anodyne	HMOX2	46	33
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450541874	FH	On-Demand	Anodyne	TBXAS1	43	41
CCc1cccc(C(=O)NCCCCOC(C)C)n1	ZINC000450541875	CF	On-Demand	Anodyne	PDE5A	31	49
O=C(c1cn(CCc2ccccc2)nn1)N1CCC(CCCn2ccnc2)CC1	ZINC000450541884	GG	On-Demand	Anodyne	TBXAS1	39	45
COc1cccc2c(N3CCN(C4CCC4)C[C@H](C)C3)nccc12	ZINC000450541892	EH	On-Demand	Anodyne	PDE3A	44	35
COc1cccc2c(N3CCN(C4CCC4)C[C@H](C)C3)nccc12	ZINC000450541892	EH	On-Demand	Anodyne	EBP	32	43
COc1cccc2c(N3CCN(C4CCC4)C[C@H](C)C3)nccc12	ZINC000450541892	EH	On-Demand	Anodyne	PDE3B	66	35
COc1cccc2c(N3CCN(C4CCC4)C[C@@H](C)C3)nccc12	ZINC000450541893	EH	On-Demand	Anodyne	PDE3A	44	35
COc1cccc2c(N3CCN(C4CCC4)C[C@@H](C)C3)nccc12	ZINC000450541893	EH	On-Demand	Anodyne	EBP	32	43
COc1cccc2c(N3CCN(C4CCC4)C[C@@H](C)C3)nccc12	ZINC000450541893	EH	On-Demand	Anodyne	PDE3B	66	35
Cc1cc(-c2nc(C(=O)NCCCCOC(C)C)co2)ccn1	ZINC000450541898	DF	On-Demand	Anodyne	TBXA2R	0	43
O=[N+]([O-])c1cccc2c(NCc3cccc(N4CCOCC4)c3)nccc12	ZINC000450541901	FH	On-Demand	Bother	MET	15	45
O=[N+]([O-])c1cccc2c(NCc3cccc(N4CCOCC4)c3)nccc12	ZINC000450541901	FH	On-Demand	Bother	EPHB4	58	35
O=[N+]([O-])c1cccc2c(NCc3cccc(N4CCOCC4)c3)nccc12	ZINC000450541901	FH	On-Demand	Bother	STAT6	54	39
O=C(CNc1ncc(C(F)F)cn1)NCCN1CCCCCC1	ZINC000450541906	ED	On-Demand	Anodyne	HNMT	51	33
CC(C)OCCCCNC(=O)c1cn(-c2cccnc2)nn1	ZINC000450541910	DD	On-Demand	Anodyne	TBXAS1	0	44
COc1ccc2c(c1)OCCN(C(=O)C1(C(=O)O)CC1)C2	ZINC000450541913	CD	On-Demand	Anodyne	AKR1C2	41	34
Cc1cccc(-c2noc(SCC(=O)N3C[C@H](C)[C@@H](O)C3)n2)c1	ZINC000450541924	ED	On-Demand	Anodyne	GRM5	25	48
Cc1cccc(-c2noc(SCC(=O)N3C[C@@H](O)[C@H](C)C3)n2)c1	ZINC000450541925	ED	On-Demand	Anodyne	GRM5	25	48
Cc1cccc(-c2noc(SCC(=O)N3C[C@H](C)[C@H](O)C3)n2)c1	ZINC000450541926	ED	On-Demand	Anodyne	GRM5	25	48
Cc1cccc(-c2noc(SCC(=O)N3C[C@@H](C)[C@@H](O)C3)n2)c1	ZINC000450541927	ED	On-Demand	Anodyne	GRM5	25	48
COc1ccc(-c2noc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450541935	FD	On-Demand	Anodyne	DRD4	48	37
COc1ccc(-c2noc(NCC(=O)NCCN3CCCCCC3)n2)cc1	ZINC000450541935	FD	On-Demand	Anodyne	CHRNA7	27	44
CCn1c(NC(=O)c2cnc(C3CC3)nc2)nc2cc(F)ccc21	ZINC000450541946	EG	On-Demand	Anodyne	ITK	27	47
COc1cc(CC(=O)NC2(C)Cc3ccccc3C2)ccc1Cl	ZINC000450541952	EH	On-Demand	Anodyne	TRPV1	22	41
COc1cc(CC(=O)NC2(C)Cc3ccccc3C2)ccc1Cl	ZINC000450541952	EH	On-Demand	Anodyne	NCE103	26	42
COc1cc(CC(=O)NC2(C)Cc3ccccc3C2)ccc1Cl	ZINC000450541952	EH	On-Demand	Anodyne	CAN2	0	42
CC1(NC(=O)[C@@H]2CCN(c3ccccc3)C2)Cc2ccccc2C1	ZINC000450541972	DG	On-Demand	Anodyne	HTR2A	15	40
CC1(NC(=O)[C@@H]2CCN(c3ccccc3)C2)Cc2ccccc2C1	ZINC000450541972	DG	On-Demand	Anodyne	HTR2B	16	40
COC(=O)CN1CCC[C@H](CNc2nc3cccc(F)c3s2)C1	ZINC000450541973	EE	On-Demand	Anodyne	CCR3	64	35
COC(=O)CN1CCC[C@@H](CNc2nc3cccc(F)c3s2)C1	ZINC000450541974	EE	On-Demand	Anodyne	CCR3	64	35
CC1(NC(=O)[C@H]2CCN(c3ccccc3)C2)Cc2ccccc2C1	ZINC000450541976	DG	On-Demand	Anodyne	HTR2A	15	40
CC1(NC(=O)[C@H]2CCN(c3ccccc3)C2)Cc2ccccc2C1	ZINC000450541976	DG	On-Demand	Anodyne	HTR2B	16	40
CC1(NC(=O)CNC(=O)Nc2cccc(Cl)c2)Cc2ccccc2C1	ZINC000450541984	FG	On-Demand	Anodyne	PPIA	20	40
CC1(NC(=O)CNC(=O)Nc2cccc(Cl)c2)Cc2ccccc2C1	ZINC000450541984	FG	On-Demand	Anodyne	PTGER3	17	40
CC1(NC(=O)CNC(=O)Nc2cccc(Cl)c2)Cc2ccccc2C1	ZINC000450541984	FG	On-Demand	Anodyne	CCKBR	17	42
CC1(NC(=O)CNC(=O)Nc2cccc(Cl)c2)Cc2ccccc2C1	ZINC000450541984	FG	On-Demand	Anodyne	EPHX2	15	43
CC1(NC(=O)CNC(=O)Nc2cccc(Cl)c2)Cc2ccccc2C1	ZINC000450541984	FG	On-Demand	Anodyne	CACNA1I	15	47
CN(C)S(=O)(=O)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450541997	DD	On-Demand	Anodyne	UTS2R	26	45
COC(=O)CN1CCC[C@H](CNc2ncnc3ccc(SC)cc23)C1	ZINC000450542000	FE	On-Demand	Anodyne	CLK4	22	42
COC(=O)CN1CCC[C@H](CNc2ncnc3ccc(SC)cc23)C1	ZINC000450542000	FE	On-Demand	Anodyne	DYRK1B	15	42
COC(=O)CN1CCC[C@@H](CNc2ncnc3ccc(SC)cc23)C1	ZINC000450542005	FE	On-Demand	Anodyne	CLK4	22	42
COC(=O)CN1CCC[C@@H](CNc2ncnc3ccc(SC)cc23)C1	ZINC000450542005	FE	On-Demand	Anodyne	DYRK1B	15	42
O=C(O)c1ccc(CCC(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)cc1	ZINC000450542029	GI	On-Demand	Anodyne	PTGER4	30	40
C[C@@H](O)CN(C)c1nccc2c([N+](=O)[O-])cccc12	ZINC000450542036	CD	On-Demand	Bother	COLA	53	34
C[C@H](O)CN(C)c1nccc2c([N+](=O)[O-])cccc12	ZINC000450542037	CD	On-Demand	Bother	COLA	53	34
CN(C)[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H]1O	ZINC000450542039	ED	On-Demand	Anodyne	PDE3A	43	34
Cc1nc(N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ncc1[N+](=O)[O-]	ZINC000450542050	DH	On-Demand	Bother	PRKCQ	41	39
COc1cc(Br)c(C(=O)NC[C@@H]2CCCCS2)cc1OC	ZINC000450542058	FG	On-Demand	Anodyne	DRD2	33	43
COc1cc(Br)c(C(=O)NC[C@@H]2CCCCS2)cc1OC	ZINC000450542058	FG	On-Demand	Anodyne	DRD3	0	43
COc1cc(Br)c(C(=O)NC[C@H]2CCCCS2)cc1OC	ZINC000450542060	FG	On-Demand	Anodyne	DRD2	33	43
COc1cc(Br)c(C(=O)NC[C@H]2CCCCS2)cc1OC	ZINC000450542060	FG	On-Demand	Anodyne	DRD3	0	43
FCCCCNc1ncnc2[nH]c3ccccc3c12	ZINC000450542076	CG	On-Demand	Anodyne	UTS2R	30	47
COC(=O)c1ccccc1CC1CCN(c2ncc([N+](=O)[O-])c(C)n2)CC1	ZINC000450542086	FF	On-Demand	Bother	PRKCQ	46	39
CCn1c(NC(=O)CC2CC(F)(F)C2)nc2cc(F)ccc21	ZINC000450542106	DH	On-Demand	Anodyne	ITK	38	40
CC(=O)c1ccc(NC(=O)[C@@H](C)C(C)(F)F)cc1Cl	ZINC000450542108	CH	On-Demand	Anodyne	IMDH_CRYPV	41	37
CC[C@@H]1C[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542109	FI	On-Demand	Anodyne	DRD4	28	44
CC[C@@H]1C[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542109	FI	On-Demand	Anodyne	SIGMAR1	25	50
CC[C@@H]1C[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542109	FI	On-Demand	Anodyne	SSTR5	58	42
CC[C@@H]1C[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542109	FI	On-Demand	Anodyne	CXCR3	36	43
CC[C@@H]1C[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542109	FI	On-Demand	Anodyne	MCHR1	44	42
CC[C@@H]1C[C@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542109	FI	On-Demand	Anodyne	CACNA1I	50	41
CC(=O)c1ccc(NC(=O)[C@H](C)C(C)(F)F)cc1Cl	ZINC000450542111	CH	On-Demand	Anodyne	IMDH_CRYPV	41	37
CC(=O)c1ccc(NC(=O)c2c[nH]nc2C(C)(C)C)cc1Cl	ZINC000450542114	DH	On-Demand	Anodyne	GRM4	49	42
CC(=O)c1ccc(NC(=O)c2c[nH]nc2C(C)(C)C)cc1Cl	ZINC000450542114	DH	On-Demand	Anodyne	TYK2	15	40
CC(=O)c1ccc(NC(=O)c2c[nH]nc2C(C)(C)C)cc1Cl	ZINC000450542114	DH	On-Demand	Anodyne	NR2E3	53	35
CC(=O)c1ccc(NC(=O)c2c[nH]nc2C(C)(C)C)cc1Cl	ZINC000450542114	DH	On-Demand	Anodyne	SHH	58	37
COC(=O)CN1CCC[C@@H](CNc2nccc(Oc3ccccc3)n2)C1	ZINC000450542121	FF	On-Demand	Anodyne	COLA	48	33
COC(=O)CN1CCC[C@@H](CNc2nccc(Oc3ccccc3)n2)C1	ZINC000450542121	FF	On-Demand	Anodyne	CPT1A	47	33
COC(=O)CN1CCC[C@H](CNc2nccc(Oc3ccccc3)n2)C1	ZINC000450542122	FF	On-Demand	Anodyne	COLA	48	33
COC(=O)CN1CCC[C@H](CNc2nccc(Oc3ccccc3)n2)C1	ZINC000450542122	FF	On-Demand	Anodyne	CPT1A	47	33
CC[C@H](O)CC(=O)N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000450542132	DD	On-Demand	Anodyne	HSD17B2	43	38
Ic1ccc(NCc2cccc(N3CCOCC3)c2)nc1	ZINC000450542135	GF	On-Demand	Anodyne	STAT6	69	43
NC(=O)c1ccc(CCC(=O)N2CCC(CCCn3ccnc3)CC2)cc1	ZINC000450542173	FF	On-Demand	Anodyne	TBXAS1	45	39
CCn1nnc(C)c1C(=O)Nc1nc2cc(F)ccc2n1CC	ZINC000450542176	DE	On-Demand	Anodyne	ITK	29	40
COc1cccc(Oc2ccc(C(=O)NCc3nnc(C4CCC4)n3C)nc2)c1	ZINC000450542178	GG	On-Demand	Anodyne	DRD4	41	31
CC[C@H](O)CC(=O)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450542180	EH	On-Demand	Anodyne	RBP4	68	36
CC[C@H](O)CC(=O)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450542182	EH	On-Demand	Anodyne	RBP4	68	36
CC[C@H](O)CC(=O)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450542185	EH	On-Demand	Anodyne	RBP4	68	36
CC[C@H](O)CC(=O)N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450542187	EH	On-Demand	Anodyne	RBP4	68	36
COc1ccc(-c2ccnc(NCCCCS(N)(=O)=O)n2)cc1	ZINC000450542189	ED	On-Demand	Anodyne	IKBKB	25	57
COc1ccc(-c2ccnc(NCCCCS(N)(=O)=O)n2)cc1	ZINC000450542189	ED	On-Demand	Anodyne	CLK4	22	53
COc1ccc(-c2ccnc(NCCCCS(N)(=O)=O)n2)cc1	ZINC000450542189	ED	On-Demand	Anodyne	SMG1	60	37
CS(=O)(=O)C[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450542197	GF	On-Demand	Anodyne	PDE3A	46	36
CS(=O)(=O)C[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450542197	GF	On-Demand	Anodyne	PDE3B	69	36
CS(=O)(=O)C[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450542198	GF	On-Demand	Anodyne	PDE3A	46	36
CS(=O)(=O)C[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450542198	GF	On-Demand	Anodyne	PDE3B	69	36
CC[C@@H](O)CC(=O)NCCc1cccc(C(=O)OC)c1	ZINC000450542207	CD	On-Demand	Anodyne	MTNR1A	43	36
CC[C@@H](O)CC(=O)NCCc1cccc(C(=O)OC)c1	ZINC000450542207	CD	On-Demand	Anodyne	CAN2	0	41
CC[C@@H](O)CC(=O)NCCc1cccc(C(=O)OC)c1	ZINC000450542207	CD	On-Demand	Anodyne	PDS	41	38
CC[C@H](O)CC(=O)NCCc1cccc(C(=O)OC)c1	ZINC000450542208	CD	On-Demand	Anodyne	MTNR1A	43	36
CC[C@H](O)CC(=O)NCCc1cccc(C(=O)OC)c1	ZINC000450542208	CD	On-Demand	Anodyne	PDS	41	38
COc1cccc(OCCC(=O)N2C[C@@H](O)[C@H](C)C2)c1	ZINC000450542212	CD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N2C[C@@H](O)[C@H](C)C2)c1	ZINC000450542212	CD	On-Demand	Anodyne	MTNR1A	27	46
Cc1nn(C)cc1CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542213	GG	On-Demand	Anodyne	DRD4	28	41
Cc1nn(C)cc1CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542213	GG	On-Demand	Anodyne	SIGMAR1	25	54
Cc1nn(C)cc1CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542213	GG	On-Demand	Anodyne	SSTR5	51	41
Cc1nn(C)cc1CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542213	GG	On-Demand	Anodyne	MCHR1	53	43
Cc1nn(C)cc1CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542213	GG	On-Demand	Anodyne	CACNA1I	59	41
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H](O)C2)c1	ZINC000450542214	CD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H](O)C2)c1	ZINC000450542214	CD	On-Demand	Anodyne	MTNR1A	27	46
COc1cccc(OCCC(=O)N2C[C@@H](C)[C@@H](O)C2)c1	ZINC000450542215	CD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N2C[C@@H](C)[C@@H](O)C2)c1	ZINC000450542215	CD	On-Demand	Anodyne	MTNR1A	27	46
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H](O)C2)c1	ZINC000450542216	CD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H](O)C2)c1	ZINC000450542216	CD	On-Demand	Anodyne	MTNR1A	27	46
CC(C)OCCCCNC(=O)[C@H]1CCCCC1(F)F	ZINC000450542217	CG	On-Demand	Anodyne	EPHX2	15	41
CC(C)OCCCCNC(=O)[C@@H]1CCCCC1(F)F	ZINC000450542218	CG	On-Demand	Anodyne	EPHX2	15	41
N#Cc1ccc(OC2CCC(NC(=O)c3c[nH]c4nccc-4c3)CC2)nc1	ZINC000450542227	FF	On-Demand	Mild	DGAT1	26	44
COc1cccc2c(N3CCOC[C@@H](C4CCC4)C3)nccc12	ZINC000450542231	DG	On-Demand	Anodyne	PDE3A	44	34
COc1cccc2c(N3CCOC[C@@H](C4CCC4)C3)nccc12	ZINC000450542231	DG	On-Demand	Anodyne	PDE3B	65	34
COc1cccc2c(N3CCOC[C@H](C4CCC4)C3)nccc12	ZINC000450542233	DG	On-Demand	Anodyne	PDE3A	44	34
COc1cccc2c(N3CCOC[C@H](C4CCC4)C3)nccc12	ZINC000450542233	DG	On-Demand	Anodyne	PDE3B	65	34
CC[C@H]1CCN1c1ncnc2cc(Br)ccc12	ZINC000450542235	CG	On-Demand	Anodyne	PDE3B	51	33
CC[C@@H]1CCN1c1ncnc2cc(Br)ccc12	ZINC000450542236	CG	On-Demand	Anodyne	PDE3B	51	33
CC[C@H](O)CC(=O)N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000450542244	DD	On-Demand	Anodyne	HSD17B2	43	38
COc1ccccc1Oc1ccc(C(=O)NCCCCOC(C)C)nc1	ZINC000450542246	FH	On-Demand	Anodyne	DRD2	20	42
COc1ccccc1Oc1ccc(C(=O)NCCCCOC(C)C)nc1	ZINC000450542246	FH	On-Demand	Anodyne	DRD1	0	44
COc1ccccc1Oc1ccc(C(=O)NCCCCOC(C)C)nc1	ZINC000450542246	FH	On-Demand	Anodyne	DRD3	34	44
COc1ccccc1Oc1ccc(C(=O)NCCCCOC(C)C)nc1	ZINC000450542246	FH	On-Demand	Anodyne	AP2S1	0	42
CC[C@H](O)CC(=O)N[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000450542247	DD	On-Demand	Anodyne	HSD17B2	43	38
CC[C@H](O)CC(=O)N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000450542250	DD	On-Demand	Anodyne	HSD17B2	43	38
N#Cc1ccc(OC2CCC(NC(=O)[C@@H](O)C3CCC3)CC2)nc1	ZINC000450542261	ED	On-Demand	Mild	DGAT1	26	42
N#Cc1ccc(OC2CCC(NC(=O)[C@H](O)C3CCC3)CC2)nc1	ZINC000450542264	ED	On-Demand	Mild	DGAT1	26	42
OC[C@@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450542274	DH	On-Demand	Anodyne	LIPG	46	34
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542278	EH	On-Demand	Anodyne	TBXAS1	30	44
CC(C)(C)C(=O)CCCC(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542278	EH	On-Demand	Anodyne	GNAI3	0	42
CN(C)S(=O)(=O)CCNc1ncnc2cc(Br)ccc12	ZINC000450542279	FD	On-Demand	Anodyne	EGFR	87	43
OC[C@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450542282	DH	On-Demand	Anodyne	LIPG	46	34
CC(C)OCCCCNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450542285	CF	On-Demand	Anodyne	EPHX2	0	42
CC(C)OCCCCNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450542287	CF	On-Demand	Anodyne	EPHX2	0	42
CC(C)OCCCCNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450542290	CF	On-Demand	Anodyne	EPHX2	0	42
CC(C)OCCCCNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450542292	CF	On-Demand	Anodyne	EPHX2	0	42
C[C@@H]1CN(c2ncc(C(F)(F)F)cc2Cl)CCN(C2CC2)C1	ZINC000450542298	EH	On-Demand	Anodyne	CXCR3	35	43
C[C@H]1CN(c2ncc(C(F)(F)F)cc2Cl)CCN(C2CC2)C1	ZINC000450542300	EH	On-Demand	Anodyne	CXCR3	35	43
Cc1ccc(C2CCN(C(=O)c3ccsc3Br)CC2)cn1	ZINC000450542305	FI	On-Demand	Anodyne	FASN	40	33
CCOc1cc(C(=O)N(C)[C@@H](C)Cc2ccccc2C)ccc1OCC(=O)O	ZINC000450542320	GH	On-Demand	Anodyne	PLA2G2A	52	34
CCOc1cc(C(=O)N(C)[C@@H](C)Cc2ccccc2C)ccc1OCC(=O)O	ZINC000450542320	GH	On-Demand	Anodyne	PPARD	41	35
C[C@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542321	EF	On-Demand	Anodyne	AVPR1B	40	39
C[C@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542321	EF	On-Demand	Anodyne	CTRA_BOVIN	45	32
C[C@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542321	EF	On-Demand	Anodyne	HDAC8	29	42
C[C@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542321	EF	On-Demand	Anodyne	TACR3	41	34
C[C@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542321	EF	On-Demand	Anodyne	HDAC6	22	42
C[C@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542321	EF	On-Demand	Anodyne	IMDH_CRYPV	38	56
C[C@H](O)C[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542322	EF	On-Demand	Anodyne	AVPR1B	40	39
C[C@H](O)C[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542322	EF	On-Demand	Anodyne	CTRA_BOVIN	45	32
C[C@H](O)C[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542322	EF	On-Demand	Anodyne	HDAC8	29	42
C[C@H](O)C[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542322	EF	On-Demand	Anodyne	TACR3	41	34
C[C@H](O)C[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542322	EF	On-Demand	Anodyne	HDAC6	22	42
C[C@H](O)C[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542322	EF	On-Demand	Anodyne	IMDH_CRYPV	38	56
CCOc1cc(C(=O)N(C)[C@H](C)Cc2ccccc2C)ccc1OCC(=O)O	ZINC000450542323	GH	On-Demand	Anodyne	PLA2G2A	52	34
CCOc1cc(C(=O)N(C)[C@H](C)Cc2ccccc2C)ccc1OCC(=O)O	ZINC000450542323	GH	On-Demand	Anodyne	PPARD	41	35
C[C@@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542325	EF	On-Demand	Anodyne	AVPR1B	40	39
C[C@@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542325	EF	On-Demand	Anodyne	CTRA_BOVIN	45	32
C[C@@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542325	EF	On-Demand	Anodyne	HDAC8	29	42
C[C@@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542325	EF	On-Demand	Anodyne	TACR3	41	34
C[C@@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542325	EF	On-Demand	Anodyne	HDAC6	22	42
C[C@@H](O)C[C@@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542325	EF	On-Demand	Anodyne	IMDH_CRYPV	38	56
COc1ccc(-c2noc(N3CCC[C@@H](O)CC3)n2)cc1	ZINC000450542327	CE	On-Demand	Anodyne	COLA	0	43
C[C@@H](C[C@@H](C)O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542328	EF	On-Demand	Anodyne	AVPR1B	40	39
C[C@@H](C[C@@H](C)O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542328	EF	On-Demand	Anodyne	CTRA_BOVIN	45	32
C[C@@H](C[C@@H](C)O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542328	EF	On-Demand	Anodyne	HDAC8	29	42
C[C@@H](C[C@@H](C)O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542328	EF	On-Demand	Anodyne	TACR3	41	34
C[C@@H](C[C@@H](C)O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542328	EF	On-Demand	Anodyne	HDAC6	22	42
C[C@@H](C[C@@H](C)O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450542328	EF	On-Demand	Anodyne	IMDH_CRYPV	38	56
COc1ccc(-c2noc(N3CCC[C@H](O)CC3)n2)cc1	ZINC000450542329	CE	On-Demand	Anodyne	COLA	0	43
CN1CCC(C(=O)Nc2cccc(-c3cnn[nH]3)c2)CC1	ZINC000450542331	CD	On-Demand	Anodyne	HTR1F	64	38
CN1CCC(C(=O)Nc2cccc(-c3cnn[nH]3)c2)CC1	ZINC000450542331	CD	On-Demand	Anodyne	GSK3B	17	48
CN1CCC(C(=O)Nc2cccc(-c3cnn[nH]3)c2)CC1	ZINC000450542331	CD	On-Demand	Anodyne	GSK3A	25	45
CN1CCC(C(=O)Nc2cccc(-c3cnn[nH]3)c2)CC1	ZINC000450542331	CD	On-Demand	Anodyne	TYK2	56	37
CN1CCC(C(=O)Nc2cccc(-c3cnn[nH]3)c2)CC1	ZINC000450542331	CD	On-Demand	Anodyne	LIMK2	30	42
COc1ccc2c(N3CC[C@H](Oc4ccc(C#N)cn4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450542350	GG	On-Demand	Mild	PDE3A	50	47
COc1ccc2c(N3CC[C@H](Oc4ccc(C#N)cn4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450542350	GG	On-Demand	Mild	PDE3B	75	47
COc1ccc2c(N3CC[C@@H](Oc4ccc(C#N)cn4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450542352	GG	On-Demand	Mild	PDE3A	50	47
COc1ccc2c(N3CC[C@@H](Oc4ccc(C#N)cn4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450542352	GG	On-Demand	Mild	PDE3B	75	47
NS(=O)(=O)CCCCNc1ncnc2[nH]c3ccccc3c12	ZINC000450542373	DD	On-Demand	Anodyne	UTS2R	28	45
Cc1cnn([C@H]2CCN(c3ccnc4ccc(OC(C)C)cc34)C2)c1	ZINC000450542392	EH	On-Demand	Anodyne	PDE3B	52	31
Cc1cnn([C@@H]2CCN(c3ccnc4ccc(OC(C)C)cc34)C2)c1	ZINC000450542393	EH	On-Demand	Anodyne	PDE3B	52	31
O=C(O)c1cccc(CC(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450542394	EG	On-Demand	Anodyne	FABP4	41	34
O=C(O)c1cccc(CC(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450542394	EG	On-Demand	Anodyne	ETHR	48	36
O=C(O)c1cccc(CC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450542395	EG	On-Demand	Anodyne	FABP4	41	34
O=C(O)c1cccc(CC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450542395	EG	On-Demand	Anodyne	ETHR	48	36
C[C@H](O)C[C@@H](C)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450542403	EG	On-Demand	Anodyne	ACACA	31	40
C[C@@H](C[C@@H](C)O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450542404	EG	On-Demand	Anodyne	ACACA	31	40
C[C@H](O)C[C@H](C)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450542405	EG	On-Demand	Anodyne	ACACA	31	40
C[C@@H](O)C[C@@H](C)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450542406	EG	On-Demand	Anodyne	ACACA	31	40
COC(=O)[C@@H]1CN(c2nccc(-c3cnccn3)n2)C[C@H]1c1ccc(Cl)cc1	ZINC000450542433	GF	On-Demand	Anodyne	SLC6A1	63	45
COC(=O)[C@@H]1CN(c2nccc(-c3cnccn3)n2)C[C@H]1c1ccc(Cl)cc1	ZINC000450542433	GF	On-Demand	Anodyne	SLC6A4	17	45
COC(=O)[C@@H]1CN(c2nccc(-c3cnccn3)n2)C[C@H]1c1ccc(Cl)cc1	ZINC000450542433	GF	On-Demand	Anodyne	SLC6A3	30	45
COc1cccc(-n2cc(C(=O)NCCCCOC(C)C)nn2)c1	ZINC000450542444	EE	On-Demand	Anodyne	DRD4	46	36
COC(=O)[C@@H]1CN(c2cccc(C#N)c2[N+](=O)[O-])C[C@H]1c1ccc(Cl)cc1	ZINC000450542445	GH	On-Demand	Mild	SLC6A1	58	45
COC(=O)[C@@H]1CN(c2cccc(C#N)c2[N+](=O)[O-])C[C@H]1c1ccc(Cl)cc1	ZINC000450542445	GH	On-Demand	Mild	SLC6A4	16	45
COC(=O)[C@@H]1CN(c2cccc(C#N)c2[N+](=O)[O-])C[C@H]1c1ccc(Cl)cc1	ZINC000450542445	GH	On-Demand	Mild	SLC6A3	27	45
O=C(O)c1cc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc([N+](=O)[O-])c1	ZINC000450542446	GC	On-Demand	Bother	L3MBTL3	43	37
O=C(O)c1cc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc([N+](=O)[O-])c1	ZINC000450542447	GC	On-Demand	Bother	L3MBTL3	43	37
CC[C@@H]1CC[C@@H](Nc2ncc([N+](=O)[O-])c(C)n2)CC1	ZINC000450542452	CG	On-Demand	Bother	PRKCQ	31	44
C[C@H](OCCc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542478	FH	On-Demand	Anodyne	GRIN2B	30	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542478	FH	On-Demand	Anodyne	TBXAS1	65	39
C[C@H](OCCc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542478	FH	On-Demand	Anodyne	HMOX1	40	35
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542480	FH	On-Demand	Anodyne	GRIN2B	30	41
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542480	FH	On-Demand	Anodyne	TBXAS1	65	39
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542480	FH	On-Demand	Anodyne	HMOX1	40	35
COC(=O)[C@@H]1CN(c2nnc(C(C)C)o2)C[C@H]1c1ccc(Cl)cc1	ZINC000450542485	EG	On-Demand	Anodyne	SLC6A1	121	52
COC(=O)[C@@H]1CN(c2nnc(C(C)C)o2)C[C@H]1c1ccc(Cl)cc1	ZINC000450542485	EG	On-Demand	Anodyne	SLC6A3	41	42
CC[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1cn(C)nc1C	ZINC000450542487	GI	On-Demand	Anodyne	EIF2AK3	52	32
CC[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1cn(C)nc1C	ZINC000450542491	GI	On-Demand	Anodyne	EIF2AK3	52	32
C/C=C\COc1cccc(CC(=O)NCCCC#N)c1	ZINC000450542497	CF	On-Demand	Mild	MTNR1A	26	41
C/C=C\COc1cccc(CC(=O)NCCCC#N)c1	ZINC000450542497	CF	On-Demand	Mild	CRTM	46	40
Cc1ccc(CN(CCO)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450542503	FF	On-Demand	Bother	CACNA1D	41	33
O=C(C[C@@H]1CSc2ccccc2O1)N1CCC(CCCn2ccnc2)CC1	ZINC000450542505	GH	On-Demand	Anodyne	HMOX2	43	31
O=C(C[C@H]1CSc2ccccc2O1)N1CCC(CCCn2ccnc2)CC1	ZINC000450542509	GH	On-Demand	Anodyne	HMOX2	43	31
O=C(CNc1nccc2cc([N+](=O)[O-])ccc12)NCCN1CCCCCC1	ZINC000450542516	FD	On-Demand	Bother	HRP1_PLAFA	38	45
O=C(CNc1nccc2cc([N+](=O)[O-])ccc12)NCCN1CCCCCC1	ZINC000450542516	FD	On-Demand	Bother	HNMT	63	38
C[C@@H](OCCc1ccccc1)C(=O)NC[C@H]1CCCCS1(=O)=O	ZINC000450542522	ED	On-Demand	Anodyne	AMY2	43	29
C[C@H](OCCc1ccccc1)C(=O)NC[C@H]1CCCCS1(=O)=O	ZINC000450542523	ED	On-Demand	Anodyne	AMY2	43	29
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H]1CCCCS1(=O)=O	ZINC000450542524	ED	On-Demand	Anodyne	AMY2	43	29
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H]1CCCCS1(=O)=O	ZINC000450542525	ED	On-Demand	Anodyne	AMY2	43	29
C[C@@H](F)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450542531	CG	On-Demand	Anodyne	UTS2R	25	57
C[C@H](F)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450542533	CG	On-Demand	Anodyne	UTS2R	25	57
C[C@@H]1CC[C@@]2(CCN(C(=O)CCc3ccc(C(=O)O)cc3)C2)C1	ZINC000450542543	DG	On-Demand	Anodyne	PTGER4	45	36
C[C@H]1CC[C@@]2(CCN(C(=O)CCc3ccc(C(=O)O)cc3)C2)C1	ZINC000450542544	DG	On-Demand	Anodyne	PTGER4	45	36
C[C@@H]1CC[C@]2(CCN(C(=O)CCc3ccc(C(=O)O)cc3)C2)C1	ZINC000450542545	DG	On-Demand	Anodyne	PTGER4	45	36
C[C@H]1CC[C@]2(CCN(C(=O)CCc3ccc(C(=O)O)cc3)C2)C1	ZINC000450542548	DG	On-Demand	Anodyne	PTGER4	45	36
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCC#N	ZINC000450542553	CG	On-Demand	Mild	PPARA	16	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCC#N	ZINC000450542553	CG	On-Demand	Mild	PPARD	22	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCC#N	ZINC000450542553	CG	On-Demand	Mild	SORT1	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCC#N	ZINC000450542553	CG	On-Demand	Mild	MLYCD	15	41
O=C(N[C@@H]1C[C@H]2OCCC[C@H]12)c1ccnc(C(=O)O)c1	ZINC000450542558	CD	On-Demand	Anodyne	KDM4C	0	47
O=C(N[C@@H]1C[C@H]2OCCC[C@H]12)c1ccnc(C(=O)O)c1	ZINC000450542558	CD	On-Demand	Anodyne	FTO	0	47
O=C(N[C@@H]1C[C@@H]2OCCC[C@@H]21)c1ccnc(C(=O)O)c1	ZINC000450542560	CD	On-Demand	Anodyne	KDM4C	0	47
O=C(N[C@@H]1C[C@@H]2OCCC[C@@H]21)c1ccnc(C(=O)O)c1	ZINC000450542560	CD	On-Demand	Anodyne	FTO	0	47
O=C(N[C@@H]1C[C@H]2OCCC[C@@H]12)c1ccnc(C(=O)O)c1	ZINC000450542562	CD	On-Demand	Anodyne	KDM4C	0	47
O=C(N[C@@H]1C[C@H]2OCCC[C@@H]12)c1ccnc(C(=O)O)c1	ZINC000450542562	CD	On-Demand	Anodyne	FTO	0	47
O=C(N[C@@H]1C[C@@H]2OCCC[C@H]21)c1ccnc(C(=O)O)c1	ZINC000450542563	CD	On-Demand	Anodyne	KDM4C	0	47
O=C(N[C@@H]1C[C@@H]2OCCC[C@H]21)c1ccnc(C(=O)O)c1	ZINC000450542563	CD	On-Demand	Anodyne	FTO	0	47
COCCN1CCN(C(=O)c2c(Cl)cc(Cl)cc2Cl)CC1=O	ZINC000450542566	FF	On-Demand	Anodyne	P2RX7	0	55
CC(C)OC(C)(C)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542571	DG	On-Demand	Anodyne	TBXAS1	23	42
Cc1ccc(C2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)cn1	ZINC000450542573	FH	On-Demand	Anodyne	CCR1	44	45
Cc1ccc(C2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)cn1	ZINC000450542574	FH	On-Demand	Anodyne	CCR1	44	45
Cc1ccc(C2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542578	GK	On-Demand	Anodyne	MC4R	56	45
Cc1ccc(C2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542578	GK	On-Demand	Anodyne	PRCP	73	49
Cc1ccc(C2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542578	GK	On-Demand	Anodyne	NPBWR1	44	34
O=C(CCc1ccc2ccccc2c1O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542580	GI	On-Demand	Anodyne	TBXAS1	41	39
Cc1ccc(C2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542583	GK	On-Demand	Anodyne	MC4R	56	45
Cc1ccc(C2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542583	GK	On-Demand	Anodyne	PRCP	73	49
Cc1ccc(C2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542583	GK	On-Demand	Anodyne	NPBWR1	44	34
Cc1ccc(C2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542584	GK	On-Demand	Anodyne	MC4R	56	45
Cc1ccc(C2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542584	GK	On-Demand	Anodyne	PRCP	73	49
Cc1ccc(C2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542584	GK	On-Demand	Anodyne	NPBWR1	44	34
Cc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542585	GK	On-Demand	Anodyne	MC4R	56	45
Cc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542585	GK	On-Demand	Anodyne	PRCP	73	49
Cc1ccc(C2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450542585	GK	On-Demand	Anodyne	NPBWR1	44	34
CCCOc1cc(C)ccc1CNC(=O)[C@H]1CC[C@@H]1C(=O)O	ZINC000450542593	DF	On-Demand	Anodyne	P2RX7	16	40
CCCOc1cc(C)ccc1CNC(=O)[C@@H]1CC[C@@H]1C(=O)O	ZINC000450542596	DF	On-Demand	Anodyne	P2RX7	16	40
CCCOc1cc(C)ccc1CNC(=O)[C@H]1CC[C@H]1C(=O)O	ZINC000450542597	DF	On-Demand	Anodyne	P2RX7	16	40
CCCOc1cc(C)ccc1CNC(=O)[C@@H]1CC[C@H]1C(=O)O	ZINC000450542598	DF	On-Demand	Anodyne	P2RX7	16	40
CC(=O)c1ccc(NC(=O)c2scnc2C(C)C)cc1Cl	ZINC000450542630	DI	On-Demand	Anodyne	FLT1	20	47
CC(=O)c1ccc(NC(=O)c2scnc2C(C)C)cc1Cl	ZINC000450542630	DI	On-Demand	Anodyne	GRM4	44	39
CC(=O)c1ccc(NC(=O)c2scnc2C(C)C)cc1Cl	ZINC000450542630	DI	On-Demand	Anodyne	SHH	42	36
CN(C)c1nc(NCCS(=O)(=O)N(C)C)nc2ccccc12	ZINC000450542641	DC	On-Demand	Anodyne	ADRA2A	19	57
Cc1ccc(C(=O)N2CCc3c(O)ncnc3C2)c(Cl)c1Cl	ZINC000450542656	EF	On-Demand	Anodyne	P2RX7	33	40
Cc1nn(C)cc1CNC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450542658	EG	On-Demand	Anodyne	PRCP	46	35
Cc1nn(C)cc1CNC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450542658	EG	On-Demand	Anodyne	P2RX7	69	38
Cc1nn(C)cc1CNC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450542669	EG	On-Demand	Anodyne	PRCP	46	35
Cc1nn(C)cc1CNC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450542669	EG	On-Demand	Anodyne	P2RX7	69	38
Cc1nn(C)cc1CNC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450542671	EG	On-Demand	Anodyne	PRCP	46	35
Cc1nn(C)cc1CNC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450542671	EG	On-Demand	Anodyne	P2RX7	69	38
Cc1nn(C)cc1CNC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450542673	EG	On-Demand	Anodyne	PRCP	46	35
Cc1nn(C)cc1CNC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450542673	EG	On-Demand	Anodyne	P2RX7	69	38
COc1ccc(-c2ccnc(N3CCCN(S(=O)(=O)N(C)C)CC3)n2)cc1	ZINC000450542676	GD	On-Demand	Anodyne	SORD	24	48
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450542678	FF	On-Demand	Anodyne	MMP1	23	48
COCC1(CCNc2nccc(-c3ccc(OC)cc3)n2)CCC1	ZINC000450542679	EH	On-Demand	Anodyne	CLK4	28	52
COCC1(CCNc2nccc(-c3ccc(OC)cc3)n2)CCC1	ZINC000450542679	EH	On-Demand	Anodyne	DYRK1B	16	57
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450542680	FF	On-Demand	Anodyne	MMP1	23	48
COC(=O)CN1CCC[C@H](CNc2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450542681	FE	On-Demand	Bother	PRKCQ	44	35
COC(=O)CN1CCC[C@@H](CNc2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450542682	FE	On-Demand	Bother	PRKCQ	44	35
CC(=O)c1ccc(NC(=O)C2(C(F)(F)F)CCC2)cc1Cl	ZINC000450542683	DI	On-Demand	Anodyne	ENV	43	32
COc1cccc(-n2cc(C(=O)N[C@H](C)C[C@@H](C)O)nn2)c1	ZINC000450542684	DD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(-n2cc(C(=O)N[C@H](C)C[C@@H](C)O)nn2)c1	ZINC000450542684	DD	On-Demand	Anodyne	ESRRA	22	40
COc1cccc(-n2cc(C(=O)N[C@H](C)C[C@H](C)O)nn2)c1	ZINC000450542685	DD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(-n2cc(C(=O)N[C@H](C)C[C@H](C)O)nn2)c1	ZINC000450542685	DD	On-Demand	Anodyne	ESRRA	22	40
COc1cccc(-n2cc(C(=O)N[C@@H](C)C[C@H](C)O)nn2)c1	ZINC000450542686	DD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(-n2cc(C(=O)N[C@@H](C)C[C@H](C)O)nn2)c1	ZINC000450542686	DD	On-Demand	Anodyne	ESRRA	22	40
COc1cccc(-n2cc(C(=O)N[C@@H](C)C[C@@H](C)O)nn2)c1	ZINC000450542687	DD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(-n2cc(C(=O)N[C@@H](C)C[C@@H](C)O)nn2)c1	ZINC000450542687	DD	On-Demand	Anodyne	ESRRA	22	40
CC(=O)c1ccc(NC(=O)[C@@H]2CCCN(c3ccccc3)C2=O)cc1Cl	ZINC000450542698	FH	On-Demand	Anodyne	AVPR2	44	36
CC(=O)c1ccc(NC(=O)[C@@H]2CCCN(c3ccccc3)C2=O)cc1Cl	ZINC000450542698	FH	On-Demand	Anodyne	NPY2R	39	40
CC(=O)c1ccc(NC(=O)[C@H]2CCCN(c3ccccc3)C2=O)cc1Cl	ZINC000450542699	FH	On-Demand	Anodyne	AVPR2	44	36
CC(=O)c1ccc(NC(=O)[C@H]2CCCN(c3ccccc3)C2=O)cc1Cl	ZINC000450542699	FH	On-Demand	Anodyne	NPY2R	39	40
C[C@@H](O)C[C@@H](C)NC(=O)c1ccc(I)cc1F	ZINC000450542710	FE	On-Demand	Anodyne	MAP2K1	48	37
C[C@@H](C[C@@H](C)O)NC(=O)c1ccc(I)cc1F	ZINC000450542711	FE	On-Demand	Anodyne	MAP2K1	48	37
C[C@H](O)C[C@@H](C)NC(=O)c1ccc(I)cc1F	ZINC000450542712	FE	On-Demand	Anodyne	MAP2K1	48	37
C[C@H](O)C[C@H](C)NC(=O)c1ccc(I)cc1F	ZINC000450542713	FE	On-Demand	Anodyne	MAP2K1	48	37
CC[C@H](CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)OC	ZINC000450542720	DF	On-Demand	Bother	MAOB	21	51
CC[C@@H](CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)OC	ZINC000450542721	DF	On-Demand	Bother	MAOB	21	51
OCC1(c2ccccc2)CCN(c2ccc(I)cn2)CC1	ZINC000450542735	GG	On-Demand	Anodyne	SMO	0	40
CCNC(=O)[C@@H](Nc1nc2ccccc2c(=NC)[nH]1)C(C)C	ZINC000450542742	DD	On-Demand	Anodyne	TACR3	47	35
CCc1nc(C)c(CNc2ncc([N+](=O)[O-])c(C)n2)o1	ZINC000450542772	CE	On-Demand	Bother	PRKCQ	43	37
COC(=O)CN1CCC[C@H](CNc2nc(C)ccc2[N+](=O)[O-])C1	ZINC000450542779	DD	On-Demand	Bother	PRKCQ	47	36
COC(=O)CN1CCC[C@@H](CNc2nc(C)ccc2[N+](=O)[O-])C1	ZINC000450542782	DD	On-Demand	Bother	PRKCQ	47	36
CC(=O)c1ccc(NC(=O)C2(Cc3ccc(F)cc3)CCOCC2)cc1Cl	ZINC000450542809	GJ	On-Demand	Anodyne	ENV	41	32
CCC[C@@H](C)C(=O)NCCNc1nc(-c2ccc(OC)cc2)no1	ZINC000450542817	EE	On-Demand	Anodyne	CTSS	15	42
CCC[C@H](C)C(=O)NCCNc1nc(-c2ccc(OC)cc2)no1	ZINC000450542819	EE	On-Demand	Anodyne	CTSS	15	42
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450542822	CH	On-Demand	Anodyne	TYK2	54	36
Cc1ncc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)c(O)n1	ZINC000450542823	DD	On-Demand	Anodyne	PDE8B	46	30
Cc1ncc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)c(O)n1	ZINC000450542823	DD	On-Demand	Anodyne	GPBAR1	28	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc3nncn3n2)C1	ZINC000450542825	DD	On-Demand	Anodyne	KCNA3	16	40
COC(=O)[C@]1(c2ccccc2)CCN(c2ccc3nncn3n2)C1	ZINC000450542827	DD	On-Demand	Anodyne	KCNA3	16	40
CCN1C(=O)C[C@H](C(=O)Nc2ccc(C(C)=O)c(Cl)c2)[C@H]1c1cccnc1	ZINC000450542832	GG	On-Demand	Anodyne	NAMPT	31	40
Cc1ncc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)c(O)n1	ZINC000450542834	DD	On-Demand	Anodyne	PDE8B	46	30
Cc1ncc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)c(O)n1	ZINC000450542834	DD	On-Demand	Anodyne	GPBAR1	28	41
CC(C)OCCCCNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450542839	DG	On-Demand	Anodyne	EPHX2	23	40
O=C(O)[C@@H]1CCC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)C1	ZINC000450542843	GI	On-Demand	Anodyne	NPY2R	34	42
O=C(O)[C@@H]1CCC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)C1	ZINC000450542843	GI	On-Demand	Anodyne	TYK2	49	33
O=C(O)[C@H]1CCC[C@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)C1	ZINC000450542844	GI	On-Demand	Anodyne	NPY2R	34	42
O=C(O)[C@H]1CCC[C@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)C1	ZINC000450542844	GI	On-Demand	Anodyne	TYK2	49	33
O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450542845	GI	On-Demand	Anodyne	NPY2R	34	42
O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450542845	GI	On-Demand	Anodyne	TYK2	49	33
O=C(O)[C@H]1CCC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)C1	ZINC000450542846	GI	On-Demand	Anodyne	NPY2R	34	42
O=C(O)[C@H]1CCC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)C1	ZINC000450542846	GI	On-Demand	Anodyne	TYK2	49	33
COc1cccc2c1[C@@H](C(=O)Nc1ccc(C(C)=O)c(Cl)c1)CC2	ZINC000450542861	EI	On-Demand	Anodyne	AVPR2	50	37
COc1cccc2c1[C@@H](C(=O)Nc1ccc(C(C)=O)c(Cl)c1)CC2	ZINC000450542861	EI	On-Demand	Anodyne	GRM4	23	41
COc1cccc2c1[C@H](C(=O)Nc1ccc(C(C)=O)c(Cl)c1)CC2	ZINC000450542872	EI	On-Demand	Anodyne	AVPR2	50	37
COc1cccc2c1[C@H](C(=O)Nc1ccc(C(C)=O)c(Cl)c1)CC2	ZINC000450542872	EI	On-Demand	Anodyne	GRM4	23	41
COc1ccc(F)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450542873	DF	On-Demand	Anodyne	GRIN2B	28	41
COc1ccc(F)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450542873	DF	On-Demand	Anodyne	SLC9A1	46	33
COc1ccc(F)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450542873	DF	On-Demand	Anodyne	HDAC1	27	44
COc1ccc(F)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450542873	DF	On-Demand	Anodyne	ABCB1	0	40
COc1ccc(F)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450542873	DF	On-Demand	Anodyne	RBP4	24	41
COc1ccc(F)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450542873	DF	On-Demand	Anodyne	ACKR3	46	34
COc1ccc(F)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450542873	DF	On-Demand	Anodyne	BRPF1	0	40
C[C@@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C[C@@H](C)S1(=O)=O	ZINC000450542880	FF	On-Demand	Bother	EGFR	0	49
C[C@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C[C@@H](C)S1(=O)=O	ZINC000450542882	FF	On-Demand	Bother	EGFR	0	49
C[C@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C[C@H](C)S1(=O)=O	ZINC000450542883	FF	On-Demand	Bother	EGFR	0	49
CN(C)S(=O)(=O)CCNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450542884	FD	On-Demand	Bother	MAOB	15	48
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542887	FH	On-Demand	Anodyne	TBXAS1	48	37
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450542888	FH	On-Demand	Anodyne	TBXAS1	48	37
Cc1ccccc1C[C@H](C)N(C)C(=O)Cc1cccc(C(=O)O)c1	ZINC000450542890	EG	On-Demand	Anodyne	OPRK1	0	42
Cc1ccccc1C[C@@H](C)N(C)C(=O)Cc1cccc(C(=O)O)c1	ZINC000450542892	EG	On-Demand	Anodyne	OPRK1	0	42
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1C	ZINC000450542896	CD	On-Demand	Anodyne	HPGDS	15	40
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1C	ZINC000450542896	CD	On-Demand	Anodyne	SLC6A7	0	40
C[C@H]1CN(C)[C@H](C)CN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450542899	CD	On-Demand	Anodyne	HPGDS	15	40
C[C@H]1CN(C)[C@H](C)CN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450542899	CD	On-Demand	Anodyne	SLC6A7	0	40
Cc1cc(OCc2ccccc2)nc(N2CC[C@H](Oc3ccc(C#N)cn3)C2)n1	ZINC000450542900	GG	On-Demand	Mild	PDE3B	62	38
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1C	ZINC000450542901	CD	On-Demand	Anodyne	HPGDS	15	40
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H](C)CN1C	ZINC000450542901	CD	On-Demand	Anodyne	SLC6A7	0	40
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@@H](C)CN1C	ZINC000450542902	CD	On-Demand	Anodyne	HPGDS	15	40
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@@H](C)CN1C	ZINC000450542902	CD	On-Demand	Anodyne	SLC6A7	0	40
CNC(=O)[C@H](C)Nc1nccc(-c2ccc(OC)cc2)n1	ZINC000450542905	CD	On-Demand	Anodyne	JAK3	18	42
CNC(=O)[C@H](C)Nc1nccc(-c2ccc(OC)cc2)n1	ZINC000450542905	CD	On-Demand	Anodyne	JAK2	18	42
CNC(=O)[C@H](C)Nc1nccc(-c2ccc(OC)cc2)n1	ZINC000450542905	CD	On-Demand	Anodyne	CAMK2D	23	44
CNC(=O)[C@H](C)Nc1nccc(-c2ccc(OC)cc2)n1	ZINC000450542905	CD	On-Demand	Anodyne	CDK2	15	41
CNC(=O)[C@H](C)Nc1nccc(-c2ccc(OC)cc2)n1	ZINC000450542905	CD	On-Demand	Anodyne	SMG1	66	36
Cc1cc(OCc2ccccc2)nc(N2CC[C@@H](Oc3ccc(C#N)cn3)C2)n1	ZINC000450542906	GG	On-Demand	Mild	PDE3B	62	38
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450542907	DG	On-Demand	Bother	AADAC	0	48
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000450542909	DG	On-Demand	Bother	AADAC	0	48
CC(=O)c1ccc(NC(=O)[C@H]2CCc3nncn3C2)cc1Cl	ZINC000450542914	DE	On-Demand	Anodyne	MAPK1	30	40
CC(=O)c1ccc(NC(=O)[C@H]2CCc3nncn3C2)cc1Cl	ZINC000450542914	DE	On-Demand	Anodyne	TYK2	40	38
CC(=O)c1ccc(NC(=O)[C@@H]2CCc3nncn3C2)cc1Cl	ZINC000450542916	DE	On-Demand	Anodyne	MAPK1	30	40
CC(=O)c1ccc(NC(=O)[C@@H]2CCc3nncn3C2)cc1Cl	ZINC000450542916	DE	On-Demand	Anodyne	TYK2	40	38
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	DRD4	23	46
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	SIGMAR1	30	58
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	SSTR5	47	39
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	CCR3	16	48
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	PDK1	40	36
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	MCHR1	38	45
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	CACNA1I	52	41
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	ADIPOR1	0	42
O=C(CSC1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450542918	FH	On-Demand	Anodyne	ADIPOR2	0	42
Cc1noc(C2CC2)c1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450542922	EG	On-Demand	Bother	CACNA1D	45	32
O=C(c1ccc2cnccc2c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450542946	EH	On-Demand	Anodyne	TBXAS1	52	46
O=C(c1ccc2cnccc2c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450542946	EH	On-Demand	Anodyne	HMOX2	46	35
O=C(c1ccc2cnccc2c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450542946	EH	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc2cnccc2c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450542946	EH	On-Demand	Anodyne	L3MBTL3	43	40
CN(C)c1nc(N2CCC[C@@H](CO)CC2)nc2ccccc12	ZINC000450542948	DE	On-Demand	Anodyne	ADRA2A	19	45
CC(=O)c1nc(N2CC[C@@H](n3cc(Cl)cn3)C2)sc1C	ZINC000450542949	DF	On-Demand	Anodyne	PARE	43	31
CC(=O)c1nc(N2CC[C@H](n3cc(Cl)cn3)C2)sc1C	ZINC000450542950	DF	On-Demand	Anodyne	PARE	43	31
CN(C)c1nc(N2CCC[C@H](CO)CC2)nc2ccccc12	ZINC000450542960	DE	On-Demand	Anodyne	ADRA2A	19	45
c1ccc(CN2CCC3(CC2)CCN(c2nc(C4CCC4)no2)C3)cc1	ZINC000450542970	FH	On-Demand	Anodyne	SIGMAR1	51	36
CCCOc1cc(C)ccc1CNC(=O)c1cccc(OCC(=O)O)c1	ZINC000450542972	FG	On-Demand	Anodyne	DRD4	41	35
CCCOc1cc(C)ccc1CNC(=O)c1cccc(OCC(=O)O)c1	ZINC000450542972	FG	On-Demand	Anodyne	PPARA	15	40
CCCOc1cc(C)ccc1CNC(=O)c1cccc(OCC(=O)O)c1	ZINC000450542972	FG	On-Demand	Anodyne	PPARD	25	40
CCCOc1cc(C)ccc1CNC(=O)c1cccc(OCC(=O)O)c1	ZINC000450542972	FG	On-Demand	Anodyne	PLA2G4B	52	41
COc1ccc2c(c1)OCCN(C(=O)Cc1cccc(C(=O)O)c1)C2	ZINC000450542982	EE	On-Demand	Anodyne	DRD4	41	31
COc1ccc2c(c1)OCCN(C(=O)Cc1cccc(C(=O)O)c1)C2	ZINC000450542982	EE	On-Demand	Anodyne	EDNRA	32	43
COc1ccc2c(c1)OCCN(C(=O)Cc1cccc(C(=O)O)c1)C2	ZINC000450542982	EE	On-Demand	Anodyne	AKR1C3	47	45
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[C@@H](C)O)nc2)c1	ZINC000450542983	EF	On-Demand	Anodyne	ACACA	56	40
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[C@@H](C)O)nc2)c1	ZINC000450542983	EF	On-Demand	Anodyne	MTNR1A	31	41
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[C@@H](C)O)nc2)c1	ZINC000450542983	EF	On-Demand	Anodyne	MTNR1B	31	45
CCOC1CN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450542984	BD	On-Demand	Bother	CHRNA3	15	51
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[C@H](C)O)nc2)c1	ZINC000450542985	EF	On-Demand	Anodyne	ACACA	56	40
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[C@H](C)O)nc2)c1	ZINC000450542985	EF	On-Demand	Anodyne	MTNR1A	31	41
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[C@H](C)O)nc2)c1	ZINC000450542985	EF	On-Demand	Anodyne	MTNR1B	31	45
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[C@@H](C)O)nc2)c1	ZINC000450542986	EF	On-Demand	Anodyne	ACACA	56	40
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[C@@H](C)O)nc2)c1	ZINC000450542986	EF	On-Demand	Anodyne	MTNR1A	31	41
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[C@@H](C)O)nc2)c1	ZINC000450542986	EF	On-Demand	Anodyne	MTNR1B	31	45
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[C@H](C)O)nc2)c1	ZINC000450542987	EF	On-Demand	Anodyne	ACACA	56	40
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[C@H](C)O)nc2)c1	ZINC000450542987	EF	On-Demand	Anodyne	MTNR1A	31	41
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[C@H](C)O)nc2)c1	ZINC000450542987	EF	On-Demand	Anodyne	MTNR1B	31	45
CCn1c(NC(=O)[C@H](O)C2CCC2)nc2cc(Br)ccc21	ZINC000450542991	FF	On-Demand	Anodyne	ITK	25	42
CCn1c(NC(=O)[C@@H](O)C2CCC2)nc2cc(Br)ccc21	ZINC000450542992	FF	On-Demand	Anodyne	ITK	25	42
Cc1ccc(C2CCN(C(=O)c3ccc(C#N)n3C)CC2)cn1	ZINC000450543000	DF	On-Demand	Mild	FASN	45	38
O=C(N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450543006	EH	On-Demand	Anodyne	RBP4	84	41
O=C(N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)[C@H](O)C1CCC1	ZINC000450543007	EH	On-Demand	Anodyne	RBP4	84	41
O=C(N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450543008	EH	On-Demand	Anodyne	RBP4	84	41
O=C(N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F)[C@H](O)C1CCC1	ZINC000450543009	EH	On-Demand	Anodyne	RBP4	84	41
Cc1ccc(C2CCN(C(=O)[C@H](C)OCc3ccc(F)cc3)CC2)cn1	ZINC000450543012	FH	On-Demand	Anodyne	CCR1	40	44
CCc1cc(N2C[C@H](C)N(C)[C@H](C)C2)ccn1	ZINC000450543014	BE	On-Demand	Anodyne	SORD	47	33
Cc1ccc(C2CCN(C(=O)[C@@H](C)OCc3ccc(F)cc3)CC2)cn1	ZINC000450543017	FH	On-Demand	Anodyne	CCR1	40	44
Cc1ccc(C2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)cn1	ZINC000450543024	EH	On-Demand	Anodyne	SLC9A1	43	39
Cc1ccc(C2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)cn1	ZINC000450543024	EH	On-Demand	Anodyne	FASN	40	37
Cc1ccc(C2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)cn1	ZINC000450543024	EH	On-Demand	Anodyne	SFRP1	27	41
Cc1ccc(C2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)cn1	ZINC000450543024	EH	On-Demand	Anodyne	L3MBTL3	45	39
CC(=O)N[C@H](C(=O)N1CCC(c2ccc(C)nc2)CC1)C(C)(C)C	ZINC000450543025	EF	On-Demand	Anodyne	CCR1	44	41
C[C@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C[C@@H](C)N1C	ZINC000450543027	EG	On-Demand	Bother	EGFR	0	46
Cc1nnnn1-c1ccc(C(=O)NC2(C)Cc3ccccc3C2)c(F)c1	ZINC000450543030	FE	On-Demand	Anodyne	F9	47	35
CC(C)OCCCCNC(=O)CSC1CC1	ZINC000450543035	BE	On-Demand	Anodyne	EPHX2	0	43
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543039	FG	On-Demand	Anodyne	PRKCD	47	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543039	FG	On-Demand	Anodyne	PRKCE	36	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543039	FG	On-Demand	Anodyne	PRKCA	65	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543039	FG	On-Demand	Anodyne	PRKCB	22	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543039	FG	On-Demand	Anodyne	PRKACA	57	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543040	FG	On-Demand	Anodyne	PRKCD	47	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543040	FG	On-Demand	Anodyne	PRKCE	36	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543040	FG	On-Demand	Anodyne	PRKCA	65	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543040	FG	On-Demand	Anodyne	PRKCB	22	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000450543040	FG	On-Demand	Anodyne	PRKACA	57	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543041	FG	On-Demand	Anodyne	PRKCD	47	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543041	FG	On-Demand	Anodyne	PRKCE	36	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543041	FG	On-Demand	Anodyne	PRKCA	65	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543041	FG	On-Demand	Anodyne	PRKCB	22	50
O=C(O)COc1cccc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543041	FG	On-Demand	Anodyne	PRKACA	57	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543042	FG	On-Demand	Anodyne	PRKCD	47	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543042	FG	On-Demand	Anodyne	PRKCE	36	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543042	FG	On-Demand	Anodyne	PRKCA	65	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543042	FG	On-Demand	Anodyne	PRKCB	22	50
O=C(O)COc1cccc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000450543042	FG	On-Demand	Anodyne	PRKACA	57	50
Cc1ccn(-c2ccccc2C(=O)NCCCCOC(C)C)n1	ZINC000450543045	DG	On-Demand	Anodyne	POLR1A	40	32
CC(C)OCCCCNC(=O)c1ccc2cnccc2c1	ZINC000450543062	CG	On-Demand	Anodyne	DRD4	40	30
CC(C)OCCCCNC(=O)c1ccc2cnccc2c1	ZINC000450543062	CG	On-Demand	Anodyne	PTAFR	22	45
O=C(CC1CC(F)(F)C1)NCc1ccnc(NC(=O)CC2CC(F)(F)C2)c1	ZINC000450543071	GH	On-Demand	Anodyne	TYK2	48	33
CSC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450543072	FH	On-Demand	Anodyne	PDE3A	48	36
CSC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450543072	FH	On-Demand	Anodyne	PDE3B	71	36
CSC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450543073	FH	On-Demand	Anodyne	PDE3A	48	36
CSC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450543073	FH	On-Demand	Anodyne	PDE3B	71	36
O=C(O)c1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543094	FD	On-Demand	Anodyne	CACNA1B	18	41
O=C(O)c1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543094	FD	On-Demand	Anodyne	PREP	29	43
O=C(O)c1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543094	FD	On-Demand	Anodyne	AKR1C3	52	38
O=C(O)c1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543094	FD	On-Demand	Anodyne	SFRP1	42	37
O=C(O)c1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543094	FD	On-Demand	Anodyne	RHOA	0	42
O=C(O)c1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543094	FD	On-Demand	Anodyne	L3MBTL1	0	52
O=C(O)c1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543094	FD	On-Demand	Anodyne	L3MBTL3	86	52
O=C(O)c1cccc(C(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543094	FD	On-Demand	Anodyne	MBTD1	0	40
O=C(O)c1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543095	FD	On-Demand	Anodyne	CACNA1B	18	41
O=C(O)c1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543095	FD	On-Demand	Anodyne	PREP	29	43
O=C(O)c1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543095	FD	On-Demand	Anodyne	AKR1C3	52	38
O=C(O)c1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543095	FD	On-Demand	Anodyne	SFRP1	42	37
O=C(O)c1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543095	FD	On-Demand	Anodyne	RHOA	0	42
O=C(O)c1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543095	FD	On-Demand	Anodyne	L3MBTL1	0	52
O=C(O)c1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543095	FD	On-Demand	Anodyne	L3MBTL3	86	52
O=C(O)c1cccc(C(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)c1	ZINC000450543095	FD	On-Demand	Anodyne	MBTD1	0	40
O=C(c1ccn(CCc2ccccc2)n1)N1CCC(CCCn2ccnc2)CC1	ZINC000450543106	GH	On-Demand	Anodyne	TBXAS1	48	47
OC[C@@H]1CC[C@H](CNc2ncnc3cc(Br)ccc23)O1	ZINC000450543112	ED	On-Demand	Anodyne	EGFR	59	40
OC[C@@H]1CC[C@H](CNc2ncnc3cc(Br)ccc23)O1	ZINC000450543112	ED	On-Demand	Anodyne	DYRK1A	21	40
OC[C@@H]1CC[C@H](CNc2ncnc3cc(Br)ccc23)O1	ZINC000450543112	ED	On-Demand	Anodyne	CLK2	25	40
OC[C@@H]1CC[C@H](CNc2ncnc3cc(Br)ccc23)O1	ZINC000450543112	ED	On-Demand	Anodyne	CLK4	35	40
OC[C@@H]1CC[C@H](CNc2ncnc3cc(Br)ccc23)O1	ZINC000450543112	ED	On-Demand	Anodyne	DYRK1B	27	40
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543115	FG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543115	FG	On-Demand	Anodyne	PRKCD	39	52
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543115	FG	On-Demand	Anodyne	PRKCE	28	52
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543115	FG	On-Demand	Anodyne	PRKCA	52	52
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543115	FG	On-Demand	Anodyne	PRKCB	15	40
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543115	FG	On-Demand	Anodyne	PRKACA	40	52
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543115	FG	On-Demand	Anodyne	KLK5	40	38
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543116	FG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543116	FG	On-Demand	Anodyne	PRKCD	39	52
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543116	FG	On-Demand	Anodyne	PRKCE	28	52
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543116	FG	On-Demand	Anodyne	PRKCA	52	52
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543116	FG	On-Demand	Anodyne	PRKCB	15	40
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543116	FG	On-Demand	Anodyne	PRKACA	40	52
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543116	FG	On-Demand	Anodyne	KLK5	40	38
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543117	FG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543117	FG	On-Demand	Anodyne	PRKCD	39	52
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543117	FG	On-Demand	Anodyne	PRKCE	28	52
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543117	FG	On-Demand	Anodyne	PRKCA	52	52
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543117	FG	On-Demand	Anodyne	PRKCB	15	40
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543117	FG	On-Demand	Anodyne	PRKACA	40	52
O=C(Cc1ccccc1C(=O)O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543117	FG	On-Demand	Anodyne	KLK5	40	38
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543118	FG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543118	FG	On-Demand	Anodyne	PRKCD	39	52
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543118	FG	On-Demand	Anodyne	PRKCE	28	52
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543118	FG	On-Demand	Anodyne	PRKCA	52	52
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543118	FG	On-Demand	Anodyne	PRKCB	15	40
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543118	FG	On-Demand	Anodyne	PRKACA	40	52
O=C(Cc1ccccc1C(=O)O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543118	FG	On-Demand	Anodyne	KLK5	40	38
Cc1nn(C)cc1CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450543133	FD	On-Demand	Mild	P2RX7	62	41
Cc1nn(C)cc1CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450543134	FD	On-Demand	Mild	P2RX7	62	41
O=C(O)[C@H]1CC[C@H]1C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450543152	FG	On-Demand	Anodyne	TYK2	49	37
O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)[C@H]1CC[C@H]1C(=O)O	ZINC000450543153	FG	On-Demand	Anodyne	TYK2	49	37
O=C(O)[C@H]1CC[C@@H]1C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450543154	FG	On-Demand	Anodyne	TYK2	49	37
O=C(O)[C@@H]1CC[C@H]1C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000450543155	FG	On-Demand	Anodyne	TYK2	49	37
CNc1nc(N2CCCN(S(=O)(=O)N(C)C)CC2)nc2ccccc12	ZINC000450543183	FC	On-Demand	Anodyne	HRH4	17	42
Cc1ccc(C2CCN(C(=O)c3cc4cccnc4s3)CC2)cn1	ZINC000450543193	EI	On-Demand	Anodyne	FASN	40	33
C[C@@H]1CCC[C@]1(C)C(=O)N1CCc2cc(F)ccc2C1	ZINC000450543198	CH	On-Demand	Anodyne	CCR2	16	43
C[C@H]1CCC[C@]1(C)C(=O)N1CCc2cc(F)ccc2C1	ZINC000450543200	CH	On-Demand	Anodyne	CCR2	16	43
C[C@@H]1CCC[C@@]1(C)C(=O)N1CCc2cc(F)ccc2C1	ZINC000450543202	CH	On-Demand	Anodyne	CCR2	16	43
C[C@H]1CCC[C@@]1(C)C(=O)N1CCc2cc(F)ccc2C1	ZINC000450543204	CH	On-Demand	Anodyne	CCR2	16	43
COC(=O)c1cccc(CCNC(=O)CCOc2cccc(OC)c2)c1	ZINC000450543217	FF	On-Demand	Anodyne	DRD4	44	33
COC(=O)c1cccc(CCNC(=O)CCOc2cccc(OC)c2)c1	ZINC000450543217	FF	On-Demand	Anodyne	MTNR1A	89	42
COC(=O)c1cccc(CCNC(=O)CCOc2cccc(OC)c2)c1	ZINC000450543217	FF	On-Demand	Anodyne	MTNR1B	73	50
COC(=O)c1cccc(CCNC(=O)CCOc2cccc(OC)c2)c1	ZINC000450543217	FF	On-Demand	Anodyne	CRTM	41	37
COC(=O)c1cccc(CCNC(=O)CCOc2cccc(OC)c2)c1	ZINC000450543217	FF	On-Demand	Anodyne	CAN2	0	49
COC(=O)c1cccc(CCNC(=O)CCOc2cccc(OC)c2)c1	ZINC000450543217	FF	On-Demand	Anodyne	PDS	30	40
CC(=O)c1ccc(NC(=O)CSC2CC2)cc1Cl	ZINC000450543220	CG	On-Demand	Anodyne	QRFPR	40	35
CC(=O)c1ccc(NC(=O)CSC2CC2)cc1Cl	ZINC000450543220	CG	On-Demand	Anodyne	ENPP1	49	30
O=C(CCCC(=O)C1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543237	GI	On-Demand	Anodyne	DRD4	23	44
O=C(CCCC(=O)C1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543237	GI	On-Demand	Anodyne	HTR4	27	43
O=C(CCCC(=O)C1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543237	GI	On-Demand	Anodyne	SIGMAR1	26	55
O=C(CCCC(=O)C1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543237	GI	On-Demand	Anodyne	SSTR5	43	38
O=C(CCCC(=O)C1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543237	GI	On-Demand	Anodyne	MCHR1	40	43
O=C(CCCC(=O)C1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543237	GI	On-Demand	Anodyne	CACNA1I	49	39
O=C(CCCC(=O)C1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543237	GI	On-Demand	Anodyne	ADIPOR1	0	40
O=C(CCCC(=O)C1CC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543237	GI	On-Demand	Anodyne	ADIPOR2	0	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc3c(cc2C#N)COCC3)C1	ZINC000450543240	FE	On-Demand	Mild	KCNA3	15	41
COC(=O)[C@]1(c2ccccc2)CCN(c2nc3c(cc2C#N)COCC3)C1	ZINC000450543242	FE	On-Demand	Mild	KCNA3	15	41
COC(=O)CN1CCC[C@H](CNc2ncc(C)cc2[N+](=O)[O-])C1	ZINC000450543260	DD	On-Demand	Bother	PRKCQ	47	38
COC(=O)CN1CCC[C@@H](CNc2ncc(C)cc2[N+](=O)[O-])C1	ZINC000450543261	DD	On-Demand	Bother	PRKCQ	47	38
Cc1ccc(C2CCN(C(=O)CCCc3ncc(C)o3)CC2)cn1	ZINC000450543264	EG	On-Demand	Anodyne	ETHR	45	32
COc1ccc2c(c1)OCCN(C(=O)[C@@H]1CCC[C@@H](C(=O)O)C1)C2	ZINC000450543265	EE	On-Demand	Anodyne	MTNR1A	22	40
COc1ccc2c(c1)OCCN(C(=O)[C@@H]1CCC[C@H](C(=O)O)C1)C2	ZINC000450543266	EE	On-Demand	Anodyne	MTNR1A	22	40
COc1ccc2c(c1)OCCN(C(=O)[C@H]1CCC[C@@H](C(=O)O)C1)C2	ZINC000450543267	EE	On-Demand	Anodyne	MTNR1A	22	40
COc1ccc2c(c1)OCCN(C(=O)[C@H]1CCC[C@H](C(=O)O)C1)C2	ZINC000450543268	EE	On-Demand	Anodyne	MTNR1A	22	40
C[C@@H](O)C[C@@H](C)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450543269	CD	On-Demand	Anodyne	SDH1	0	43
C[C@@H](C[C@@H](C)O)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450543271	CD	On-Demand	Anodyne	SDH1	0	43
C[C@H](O)C[C@@H](C)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450543272	CD	On-Demand	Anodyne	SDH1	0	43
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@@H]1CCCCS1	ZINC000450543273	DG	On-Demand	Anodyne	CTSV	43	30
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@H]1CCCCS1	ZINC000450543274	DG	On-Demand	Anodyne	CTSV	43	30
C[C@H](O)C[C@H](C)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450543279	CD	On-Demand	Anodyne	SDH1	0	43
CO[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450543299	DH	On-Demand	Anodyne	GRM4	26	41
CO[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450543299	DH	On-Demand	Anodyne	TYK2	48	35
CO[C@H]1CCCC[C@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450543300	DH	On-Demand	Anodyne	GRM4	26	41
CO[C@H]1CCCC[C@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450543300	DH	On-Demand	Anodyne	TYK2	48	35
CO[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450543301	DH	On-Demand	Anodyne	GRM4	26	41
CO[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450543301	DH	On-Demand	Anodyne	TYK2	48	35
CO[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450543302	DH	On-Demand	Anodyne	GRM4	26	41
CO[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000450543302	DH	On-Demand	Anodyne	TYK2	48	35
CCn1c(NC(=O)CCCC(=O)C2CC2)nc2cc(F)ccc21	ZINC000450543330	DG	On-Demand	Anodyne	ITK	42	40
CC1(C)CN(C(=O)c2ccnc(C(=O)O)c2)CC[C@H]1C(F)(F)F	ZINC000450543331	EF	On-Demand	Anodyne	MAP3K12	40	36
CC1(C)CN(C(=O)c2ccnc(C(=O)O)c2)CC[C@H]1C(F)(F)F	ZINC000450543331	EF	On-Demand	Anodyne	FTO	0	48
CC1(C)CN(C(=O)c2ccnc(C(=O)O)c2)CC[C@@H]1C(F)(F)F	ZINC000450543332	EF	On-Demand	Anodyne	MAP3K12	40	36
CC1(C)CN(C(=O)c2ccnc(C(=O)O)c2)CC[C@@H]1C(F)(F)F	ZINC000450543332	EF	On-Demand	Anodyne	FTO	0	48
CC(C)OCCCCNC(=O)C1CC(C)(O)C1	ZINC000450543335	BD	On-Demand	Anodyne	EPHX2	38	45
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1cccc(C(=O)O)c1	ZINC000450543341	DG	On-Demand	Anodyne	PTGER4	21	40
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1cccc(C(=O)O)c1	ZINC000450543341	DG	On-Demand	Anodyne	E1	0	41
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1cccc(C(=O)O)c1	ZINC000450543341	DG	On-Demand	Anodyne	AKR1C3	35	40
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1cccc(C(=O)O)c1	ZINC000450543342	DG	On-Demand	Anodyne	PTGER4	21	40
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1cccc(C(=O)O)c1	ZINC000450543342	DG	On-Demand	Anodyne	E1	0	41
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1cccc(C(=O)O)c1	ZINC000450543342	DG	On-Demand	Anodyne	AKR1C3	35	40
CCNC(=O)[C@@H](Nc1ncnc2cc(Br)ccc12)C(C)C	ZINC000450543343	FF	On-Demand	Anodyne	EGFR	44	38
CCNC(=O)[C@@H](Nc1ncnc2cc(Br)ccc12)C(C)C	ZINC000450543343	FF	On-Demand	Anodyne	HTT	0	41
O=C(Nc1ccc(O)c([N+](=O)[O-])c1)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450543351	GG	On-Demand	Bother	TAAR1	24	40
O=C(Nc1ccc(O)c([N+](=O)[O-])c1)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450543351	GG	On-Demand	Bother	USP47	43	34
O=C(O)CCCCC(=O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543352	DF	On-Demand	Anodyne	KLK5	40	36
O=C(O)CCCCC(=O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450543353	DF	On-Demand	Anodyne	KLK5	40	36
O=C(O)CCCCC(=O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543354	DF	On-Demand	Anodyne	KLK5	40	36
O=C(O)CCCCC(=O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450543355	DF	On-Demand	Anodyne	KLK5	40	36
CCc1cccc(C(=O)N[C@H](C)C[C@@H](C)O)n1	ZINC000450543368	BD	On-Demand	Anodyne	PDE5A	26	41
CCc1cccc(C(=O)N[C@@H](C)C[C@H](C)O)n1	ZINC000450543369	BD	On-Demand	Anodyne	PDE5A	26	41
CCc1cccc(C(=O)N[C@@H](C)C[C@@H](C)O)n1	ZINC000450543370	BD	On-Demand	Anodyne	PDE5A	26	41
CCc1cccc(C(=O)N[C@H](C)C[C@H](C)O)n1	ZINC000450543372	BD	On-Demand	Anodyne	PDE5A	26	41
COC(=O)CN1CCC[C@H](CNc2ncnc3[nH]ccc23)C1	ZINC000450543374	DC	On-Demand	Anodyne	IGF1R	54	35
COC(=O)CN1CCC[C@H](CNc2ncnc3[nH]ccc23)C1	ZINC000450543374	DC	On-Demand	Anodyne	JAK2	24	49
COC(=O)CN1CCC[C@@H](CNc2ncnc3[nH]ccc23)C1	ZINC000450543376	DC	On-Demand	Anodyne	IGF1R	54	35
COC(=O)CN1CCC[C@@H](CNc2ncnc3[nH]ccc23)C1	ZINC000450543376	DC	On-Demand	Anodyne	JAK2	24	49
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450543379	GH	On-Demand	Anodyne	TBXAS1	57	40
CC(C)OCCCCNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450543380	FI	On-Demand	Anodyne	PYGL	47	45
C[C@@H](C[C@@H](C)O)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450543388	EF	On-Demand	Anodyne	PRCP	16	42
C[C@H](O)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450543390	EF	On-Demand	Anodyne	PRCP	16	42
C[C@@H](O)C[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450543391	EF	On-Demand	Anodyne	PRCP	16	42
CCCc1c(NC(=O)c2cnc(C3CC3)nc2)cnn1-c1ccccc1	ZINC000450543408	EH	On-Demand	Anodyne	MAPK14	15	41
CCCc1c(NC(=O)c2ccc(C(C)(F)F)nc2)cnn1-c1ccccc1	ZINC000450543416	FJ	On-Demand	Anodyne	MAPK14	15	43
CN=c1[nH]c(=NCC(=O)NCCN2CCCCCC2)[nH]c2ccccc12	ZINC000450543426	FC	On-Demand	Anodyne	PLD1	41	33
CN=c1[nH]c(=NCC(=O)NCCN2CCCCCC2)[nH]c2ccccc12	ZINC000450543426	FC	On-Demand	Anodyne	HNMT	47	35
Cc1nn(C)cc1CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450543430	CF	On-Demand	Anodyne	SCN9A	0	40
Cc1nn(C)cc1CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450543431	CF	On-Demand	Anodyne	SCN9A	0	40
C[C@@H]1CN(c2ncnc3[nH]c4ccccc4c23)CCN([C@@H]2C[C@@H]2C)C1	ZINC000450543432	EG	On-Demand	Anodyne	LIMK2	70	36
Cc1nn(C)cc1CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450543433	CF	On-Demand	Anodyne	SCN9A	0	40
Cc1nn(C)cc1CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450543434	CF	On-Demand	Anodyne	SCN9A	0	40
C[C@@H]1CN(c2ncnc3[nH]c4ccccc4c23)CCN([C@@H]2C[C@H]2C)C1	ZINC000450543435	EG	On-Demand	Anodyne	LIMK2	70	36
C[C@@H]1CN(c2ncnc3[nH]c4ccccc4c23)CCN([C@H]2C[C@H]2C)C1	ZINC000450543437	EG	On-Demand	Anodyne	LIMK2	70	36
O=C(O)c1cc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)ccn1	ZINC000450543438	GG	On-Demand	Anodyne	MAP3K12	35	42
O=C(O)c1cc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)ccn1	ZINC000450543438	GG	On-Demand	Anodyne	FTO	0	40
O=C(O)c1cc(C(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)ccn1	ZINC000450543438	GG	On-Demand	Anodyne	SLC6A7	0	40
C[C@@H]1CN(c2ncnc3[nH]c4ccccc4c23)CCN([C@H]2C[C@@H]2C)C1	ZINC000450543439	EG	On-Demand	Anodyne	LIMK2	70	36
O=C(O)c1cc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)ccn1	ZINC000450543440	GG	On-Demand	Anodyne	MAP3K12	35	42
O=C(O)c1cc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)ccn1	ZINC000450543440	GG	On-Demand	Anodyne	FTO	0	40
O=C(O)c1cc(C(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)ccn1	ZINC000450543440	GG	On-Demand	Anodyne	SLC6A7	0	40
COc1cc(CC(=O)NCc2cn(C)nc2C)ccc1Cl	ZINC000450543452	DE	On-Demand	Anodyne	CAN2	0	43
CCOC(=O)c1cc(C(=O)N2CCC(CCCn3ccnc3)CC2)[nH]c1C	ZINC000450543459	FG	On-Demand	Anodyne	AKR1C3	15	40
CCCOc1cc(C)ccc1CNC(=O)Cc1ccc(C(=O)O)cc1	ZINC000450543467	EG	On-Demand	Anodyne	PPARD	26	41
CCCOc1cc(C)ccc1CNC(=O)Cc1ccc(C(=O)O)cc1	ZINC000450543467	EG	On-Demand	Anodyne	PLA2G4B	41	33
CCc1nc(C)c(CNc2ccnc3cc(F)c(Cl)cc23)o1	ZINC000450543479	DI	On-Demand	Anodyne	HRP1_PLAFA	63	34
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@@H](C)CN1C	ZINC000450543480	ED	On-Demand	Anodyne	HRH3	0	40
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@@H](C)CN1C	ZINC000450543480	ED	On-Demand	Anodyne	UL80	23	47
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@@H](C)CN1C	ZINC000450543480	ED	On-Demand	Anodyne	PREP	107	58
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@@H](C)CN1C	ZINC000450543480	ED	On-Demand	Anodyne	SFRP1	41	39
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@@H](C)CN1C	ZINC000450543480	ED	On-Demand	Anodyne	WNT3	41	31
CCCOc1ccc(C(=O)N2CCC(c3ccc(C)nc3)CC2)c(OC)c1	ZINC000450543481	FI	On-Demand	Anodyne	OXTR	27	44
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@H](C)CN1C	ZINC000450543482	ED	On-Demand	Anodyne	UL80	23	47
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@H](C)CN1C	ZINC000450543482	ED	On-Demand	Anodyne	PREP	107	58
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@H](C)CN1C	ZINC000450543482	ED	On-Demand	Anodyne	SFRP1	41	39
C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@H](C)CN1C	ZINC000450543482	ED	On-Demand	Anodyne	WNT3	41	31
Cc1nc(NC[C@]2(C)C[C@H]2c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450543492	CG	On-Demand	Bother	PRKCQ	25	42
CO[C@@H](CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)C1CC1	ZINC000450543515	DF	On-Demand	Bother	MAOB	28	54
CO[C@H](CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)C1CC1	ZINC000450543517	DF	On-Demand	Bother	MAOB	28	54
C[C@@H]1CN(c2ncnc3[nH]c4ccccc4c23)CCN(C2CCC2)C1	ZINC000450543518	EG	On-Demand	Anodyne	LIMK2	61	35
O=C(O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H](c3c(F)cccc3F)C2)CC1	ZINC000450543532	EG	On-Demand	Anodyne	SLC6A1	59	38
O=C(O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H](c3c(F)cccc3F)C2)CC1	ZINC000450543532	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
O=C(O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H](c3c(F)cccc3F)C2)CC1	ZINC000450543532	EG	On-Demand	Anodyne	HSD11B1	0	41
O=C(O)C1CCC(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)CC1	ZINC000450543533	EG	On-Demand	Anodyne	SLC6A1	59	38
O=C(O)C1CCC(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)CC1	ZINC000450543533	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
O=C(O)C1CCC(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)CC1	ZINC000450543533	EG	On-Demand	Anodyne	HSD11B1	0	41
O=C(O)[C@@H]1CC[C@@H](C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)CC1	ZINC000450543535	EG	On-Demand	Anodyne	SLC6A1	59	38
O=C(O)[C@@H]1CC[C@@H](C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)CC1	ZINC000450543535	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
O=C(O)[C@@H]1CC[C@@H](C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)CC1	ZINC000450543535	EG	On-Demand	Anodyne	HSD11B1	0	41
O=C(O)C1CCC(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)CC1	ZINC000450543537	EG	On-Demand	Anodyne	SLC6A1	59	38
O=C(O)C1CCC(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)CC1	ZINC000450543537	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
O=C(O)C1CCC(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)CC1	ZINC000450543537	EG	On-Demand	Anodyne	HSD11B1	0	41
Cc1ccc(C2CCN(C(=O)c3cc4c([nH]3)CCCC4)CC2)cn1	ZINC000450543539	DH	On-Demand	Anodyne	HRH4	24	56
Cc1ccc(C2CCN(C(=O)c3cc4c([nH]3)CCCC4)CC2)cn1	ZINC000450543539	DH	On-Demand	Anodyne	FASN	41	35
COC(=O)[C@]1(c2ccccc2)CCN(c2ncc(Br)cc2C#N)C1	ZINC000450543544	GG	On-Demand	Mild	P2RY12	23	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncc(Br)cc2C#N)C1	ZINC000450543545	GG	On-Demand	Mild	P2RY12	23	41
O=C(O)c1ccccc1CCC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450543547	FH	On-Demand	Anodyne	FABP4	45	43
O=C(O)c1ccccc1CCC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450543547	FH	On-Demand	Anodyne	CCR1	25	41
O=C(O)c1ccccc1CCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450543550	FH	On-Demand	Anodyne	FABP4	45	43
O=C(O)c1ccccc1CCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450543550	FH	On-Demand	Anodyne	CCR1	25	41
CCn1c(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)nc2cc(F)ccc21	ZINC000450543557	DG	On-Demand	Anodyne	ITK	23	41
Cc1ccc(CC(=O)NCc2cnc(C)nc2O)c(Br)c1	ZINC000450543562	FE	On-Demand	Anodyne	P2RX7	30	40
Cc1ncc(CNC(=O)c2ccc(C(F)(F)F)cc2C)c(O)n1	ZINC000450543577	EF	On-Demand	Anodyne	PPARA	0	44
Cc1ncc(CNC(=O)c2ccc(C(F)(F)F)cc2C)c(O)n1	ZINC000450543577	EF	On-Demand	Anodyne	PPARD	31	44
C[C@H]1CN(c2nc(N(C)C)c3ccccc3n2)C[C@@H](C)N1C	ZINC000450543578	CE	On-Demand	Anodyne	ADRA2A	0	40
Cc1cc(=NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[nH]n1[C@H](C)C1CC1	ZINC000450543585	FG	On-Demand	Bother	CACNA1D	68	33
Cc1cc(=NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[nH]n1[C@H](C)C1CC1	ZINC000450543585	FG	On-Demand	Bother	IRAK4	24	41
Cc1cc(=NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[nH]n1[C@@H](C)C1CC1	ZINC000450543586	FG	On-Demand	Bother	CACNA1D	68	33
Cc1cc(=NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[nH]n1[C@@H](C)C1CC1	ZINC000450543586	FG	On-Demand	Bother	IRAK4	24	41
CCn1c(NC(=O)Cc2ccc(OC)c(OC)c2Cl)nc2cc(F)ccc21	ZINC000450543587	GI	On-Demand	Anodyne	PDGFRB	31	42
CCn1c(NC(=O)Cc2ccc(OC)c(OC)c2Cl)nc2cc(F)ccc21	ZINC000450543587	GI	On-Demand	Anodyne	P2RX7	46	38
Cc1nc(NC[C@@H](NCc2ccccc2)C(F)(F)F)ncc1[N+](=O)[O-]	ZINC000450543588	FF	On-Demand	Bother	PRKCQ	22	43
Cc1nc(NC[C@H](NCc2ccccc2)C(F)(F)F)ncc1[N+](=O)[O-]	ZINC000450543589	FF	On-Demand	Bother	PRKCQ	22	43
O=C(O)c1cccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)c1	ZINC000450543618	FI	On-Demand	Anodyne	AKR1C3	23	42
O=C(O)c1cccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)c1	ZINC000450543618	FI	On-Demand	Anodyne	HPGD	16	40
COc1ccc(-c2ccnc(N3CC[C@@](CO)(c4ccccc4)C3)n2)cc1	ZINC000450543634	FG	On-Demand	Anodyne	SORD	53	47
COc1ccc(-c2ccnc(N3CC[C@@](CO)(c4ccccc4)C3)n2)cc1	ZINC000450543634	FG	On-Demand	Anodyne	DKK1	0	40
COc1ccc(-c2ccnc(N3CC[C@](CO)(c4ccccc4)C3)n2)cc1	ZINC000450543635	FG	On-Demand	Anodyne	SORD	53	47
COc1ccc(-c2ccnc(N3CC[C@](CO)(c4ccccc4)C3)n2)cc1	ZINC000450543635	FG	On-Demand	Anodyne	DKK1	0	40
C[C@H]1CN(c2ncnc3[nH]c4ccccc4c23)CCN(C2CCC2)C1	ZINC000450543639	EG	On-Demand	Anodyne	LIMK2	61	35
CCCc1c(NC(=O)c2cc(C)n(C(C)C)n2)cnn1-c1ccccc1	ZINC000450543641	FI	On-Demand	Anodyne	NPY5R	15	44
Clc1cnn([C@@H]2CCN(c3ncnc4cc(Br)ccc34)C2)c1	ZINC000450543643	GH	On-Demand	Anodyne	PDE3A	50	42
Clc1cnn([C@@H]2CCN(c3ncnc4cc(Br)ccc34)C2)c1	ZINC000450543643	GH	On-Demand	Anodyne	PDE3B	74	42
Clc1cnn([C@H]2CCN(c3ncnc4cc(Br)ccc34)C2)c1	ZINC000450543644	GH	On-Demand	Anodyne	PDE3A	50	42
Clc1cnn([C@H]2CCN(c3ncnc4cc(Br)ccc34)C2)c1	ZINC000450543644	GH	On-Demand	Anodyne	PDE3B	74	42
Cc1ccn2ncc(C(=O)N[C@H](C)C[C@@H](C)O)c2c1	ZINC000450543648	CD	On-Demand	Anodyne	EPHB3	36	53
Cc1ccn2ncc(C(=O)N[C@H](C)C[C@H](C)O)c2c1	ZINC000450543651	CD	On-Demand	Anodyne	EPHB3	36	53
Cc1ccn2ncc(C(=O)N[C@@H](C)C[C@H](C)O)c2c1	ZINC000450543652	CD	On-Demand	Anodyne	EPHB3	36	53
Cc1ccn2ncc(C(=O)N[C@@H](C)C[C@@H](C)O)c2c1	ZINC000450543654	CD	On-Demand	Anodyne	EPHB3	36	53
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncc([N+](=O)[O-])c(C)n2)C1	ZINC000450543655	EE	On-Demand	Bother	ADRA1A	24	41
CCn1c(NC(=O)C(C)(C)C(C)(F)F)nc2cc(F)ccc21	ZINC000450543657	DH	On-Demand	Anodyne	ITK	41	41
COC(=O)[C@]1(c2ccccc2)CCN(c2ncc([N+](=O)[O-])c(C)n2)C1	ZINC000450543658	EE	On-Demand	Bother	ADRA1A	24	41
CCn1c(NC(=O)CC2(O)CCC2)nc2cc(F)ccc21	ZINC000450543661	CE	On-Demand	Anodyne	ITK	23	41
Cc1ccc(F)c(CC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450543671	EH	On-Demand	Anodyne	TBXAS1	49	41
O=C(O)COc1cccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)c1	ZINC000450543676	GH	On-Demand	Anodyne	FABP4	44	34
O=C(O)COc1cccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)c1	ZINC000450543676	GH	On-Demand	Anodyne	SCN5A	23	40
O=C(O)COc1cccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)c1	ZINC000450543676	GH	On-Demand	Anodyne	CCR8	19	40
COc1cccc2c(NCC(=O)NCCN3CCCCCC3)nccc12	ZINC000450543678	FF	On-Demand	Anodyne	HTR1A	37	41
COc1cccc2c(NCC(=O)NCCN3CCCCCC3)nccc12	ZINC000450543678	FF	On-Demand	Anodyne	DRD2	31	44
COc1cccc2c(NCC(=O)NCCN3CCCCCC3)nccc12	ZINC000450543678	FF	On-Demand	Anodyne	DRD4	44	34
COc1cccc2c(NCC(=O)NCCN3CCCCCC3)nccc12	ZINC000450543678	FF	On-Demand	Anodyne	ADRA1D	33	41
COc1cccc2c(NCC(=O)NCCN3CCCCCC3)nccc12	ZINC000450543678	FF	On-Demand	Anodyne	ADRA1A	31	41
COc1cccc2c(NCC(=O)NCCN3CCCCCC3)nccc12	ZINC000450543678	FF	On-Demand	Anodyne	DRD3	41	35
COc1cccc2c(NCC(=O)NCCN3CCCCCC3)nccc12	ZINC000450543678	FF	On-Demand	Anodyne	HNMT	85	41
CC(=O)c1ccc(NC(=O)c2cc3n(n2)CCC3)cc1Cl	ZINC000450543679	DF	On-Demand	Anodyne	AVPR2	45	39
CC(=O)c1ccc(NC(=O)c2cc3n(n2)CCC3)cc1Cl	ZINC000450543679	DF	On-Demand	Anodyne	GRM4	43	37
CC(=O)c1ccc(NC(=O)c2cc3n(n2)CCC3)cc1Cl	ZINC000450543679	DF	On-Demand	Anodyne	TYK2	45	35
CC(=O)c1[nH]c(=NCc2cccc(N3CCOCC3)c2)sc1C	ZINC000450543680	EF	On-Demand	Anodyne	PRKDC	20	41
COc1cccc2c(N3C[C@H](C)N(C)[C@H](C)C3)nccc12	ZINC000450543683	CF	On-Demand	Anodyne	PDE3B	67	39
Cc1ccc(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Br)cc3)CC2)cn1	ZINC000450543689	GJ	On-Demand	Anodyne	PRCP	47	38
COC(=O)[C@@H]1CN(c2nc3c(cc2C#N)COCC3)C[C@H]1c1ccc(Cl)cc1	ZINC000450543726	GG	On-Demand	Mild	SLC6A1	0	41
CCOC(=O)c1csc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)n1	ZINC000450543753	FF	On-Demand	Anodyne	ADRA1A	24	40
CCOC(=O)c1csc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)n1	ZINC000450543756	FF	On-Demand	Anodyne	ADRA1A	24	40
CC(=O)c1ccc(NC(=O)c2nn(C)c3c2CCCC3)cc1Cl	ZINC000450543759	EG	On-Demand	Anodyne	CNR1	53	32
CC(=O)c1ccc(NC(=O)c2nn(C)c3c2CCCC3)cc1Cl	ZINC000450543759	EG	On-Demand	Anodyne	SHH	25	40
C[C@H](O)C[C@@H](C)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450543770	CE	On-Demand	Anodyne	CAPN2	49	33
C[C@H](O)C[C@H](C)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450543772	CE	On-Demand	Anodyne	CAPN2	49	33
C[C@H](O)C[C@H](C)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450543773	CE	On-Demand	Anodyne	CAPN2	49	33
C[C@H](O)C[C@@H](C)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450543774	CE	On-Demand	Anodyne	CAPN2	49	33
COc1ccc(-c2ccnc(NC[C@H](OC)C3CC3)n2)cc1	ZINC000450543777	CF	On-Demand	Anodyne	CLK4	26	54
COc1ccc(-c2ccnc(NC[C@@H](OC)C3CC3)n2)cc1	ZINC000450543779	CF	On-Demand	Anodyne	CLK4	26	54
Cc1cc(-c2nc(C(=O)N[C@H](C)C[C@@H](C)O)co2)ccn1	ZINC000450543780	CD	On-Demand	Anodyne	IRAK4	20	41
Cc1cc(-c2nc(C(=O)N[C@H](C)C[C@H](C)O)co2)ccn1	ZINC000450543783	CD	On-Demand	Anodyne	IRAK4	20	41
Cc1cc(-c2nc(C(=O)N[C@@H](C)C[C@H](C)O)co2)ccn1	ZINC000450543786	CD	On-Demand	Anodyne	IRAK4	20	41
Cc1cc(-c2nc(C(=O)N[C@@H](C)C[C@@H](C)O)co2)ccn1	ZINC000450543789	CD	On-Demand	Anodyne	IRAK4	20	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](C)C[C@H](C)O)c1	ZINC000450543802	CE	On-Demand	Anodyne	MTNR1B	29	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](C)C[C@@H](C)O)c1	ZINC000450543803	CE	On-Demand	Anodyne	MTNR1B	29	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)C[C@@H](C)O)c1	ZINC000450543804	CE	On-Demand	Anodyne	MTNR1B	29	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)C[C@H](C)O)c1	ZINC000450543805	CE	On-Demand	Anodyne	MTNR1B	29	41
Cc1ccc(C2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450543806	FK	On-Demand	Anodyne	CCR5	24	40
Cc1ccc(C2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450543806	FK	On-Demand	Anodyne	ADAM10	31	43
Cc1ccc(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C(F)(F)F)cc3)CC2)cn1	ZINC000450543807	GJ	On-Demand	Anodyne	LIPE	19	45
CN(C)S(=O)(=O)CCNc1nccc2c([N+](=O)[O-])cccc12	ZINC000450543808	DD	On-Demand	Bother	COLA	50	36
Cc1ccc(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])CC2)cn1	ZINC000450543810	GI	On-Demand	Bother	CCR2	15	40
Cc1ccc(C2CCN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])CC2)cn1	ZINC000450543810	GI	On-Demand	Bother	LIPG	50	35
Cc1ccc(CN(CCO)C(=O)c2cc(C)c(C(N)=O)cn2)cc1	ZINC000450543824	ED	On-Demand	Anodyne	PLM2_PLAFA	41	32
N#Cc1cc(Br)cnc1NCC(=O)NCCN1CCCCCC1	ZINC000450543836	GE	On-Demand	Mild	HNMT	44	30
Cc1c(C)c(C)c(CNC(=O)CCCCC(=O)O)c(C)c1C	ZINC000450543856	DG	On-Demand	Anodyne	KDM2A	40	31
COc1ccc(-c2noc(N(C)Cc3occc3C)n2)cc1	ZINC000450543858	CG	On-Demand	Anodyne	LUCI_PHOPE	15	41
COc1cccc2c(N3CC[C@@H](n4cc(Cl)cn4)C3)nccc12	ZINC000450543859	EH	On-Demand	Anodyne	PDE3A	52	40
COc1cccc2c(N3CC[C@@H](n4cc(Cl)cn4)C3)nccc12	ZINC000450543859	EH	On-Demand	Anodyne	PDE3B	74	40
COc1cccc2c(N3CC[C@H](n4cc(Cl)cn4)C3)nccc12	ZINC000450543863	EH	On-Demand	Anodyne	PDE3A	52	40
COc1cccc2c(N3CC[C@H](n4cc(Cl)cn4)C3)nccc12	ZINC000450543863	EH	On-Demand	Anodyne	PDE3B	74	40
N#Cc1cccc(NCCCCCN2CCCC2)c1[N+](=O)[O-]	ZINC000450543877	DG	On-Demand	Mild	HNMT	63	38
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450543891	GI	On-Demand	Anodyne	DRD4	26	44
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450543891	GI	On-Demand	Anodyne	SIGMAR1	26	49
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450543891	GI	On-Demand	Anodyne	SSTR5	51	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450543891	GI	On-Demand	Anodyne	CXCR3	25	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450543891	GI	On-Demand	Anodyne	MCHR1	45	42
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450543891	GI	On-Demand	Anodyne	CACNA1I	50	41
C[C@@H]1CN(C(=O)[C@@H](C#N)CCc2ccccc2)C[C@H]1O	ZINC000450543903	CD	On-Demand	Mild	ACE	47	38
C[C@@H]1CN(C(=O)[C@@H](C#N)CCc2ccccc2)C[C@H]1O	ZINC000450543903	CD	On-Demand	Mild	SDH1	0	42
C[C@@H]1CN(C(=O)[C@@H](C#N)CCc2ccccc2)C[C@H]1O	ZINC000450543903	CD	On-Demand	Mild	CTSC	26	41
C[C@@H]1CN(C(=O)[C@H](C#N)CCc2ccccc2)C[C@@H]1O	ZINC000450543904	CD	On-Demand	Mild	ACE	47	38
C[C@@H]1CN(C(=O)[C@H](C#N)CCc2ccccc2)C[C@@H]1O	ZINC000450543904	CD	On-Demand	Mild	SDH1	0	42
C[C@@H]1CN(C(=O)[C@H](C#N)CCc2ccccc2)C[C@@H]1O	ZINC000450543904	CD	On-Demand	Mild	CTSC	26	41
C[C@@H]1CN(C(=O)[C@H](C#N)CCc2ccccc2)C[C@H]1O	ZINC000450543905	CD	On-Demand	Mild	ACE	47	38
C[C@@H]1CN(C(=O)[C@H](C#N)CCc2ccccc2)C[C@H]1O	ZINC000450543905	CD	On-Demand	Mild	SDH1	0	42
C[C@@H]1CN(C(=O)[C@H](C#N)CCc2ccccc2)C[C@H]1O	ZINC000450543905	CD	On-Demand	Mild	CTSC	26	41
C[C@@H]1CN(C(=O)[C@@H](C#N)CCc2ccccc2)C[C@@H]1O	ZINC000450543906	CD	On-Demand	Mild	ACE	47	38
C[C@@H]1CN(C(=O)[C@@H](C#N)CCc2ccccc2)C[C@@H]1O	ZINC000450543906	CD	On-Demand	Mild	SDH1	0	42
C[C@@H]1CN(C(=O)[C@@H](C#N)CCc2ccccc2)C[C@@H]1O	ZINC000450543906	CD	On-Demand	Mild	CTSC	26	41
COc1cc(Nc2ncc([N+](=O)[O-])c(C)n2)cc(OC)c1C	ZINC000450543908	DF	On-Demand	Bother	PLK1	0	50
COc1cc(Nc2ncc([N+](=O)[O-])c(C)n2)cc(OC)c1C	ZINC000450543908	DF	On-Demand	Bother	PTK2	54	38
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450543914	FI	On-Demand	Anodyne	TBXAS1	52	42
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450543917	FI	On-Demand	Anodyne	TBXAS1	52	42
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450543918	FI	On-Demand	Anodyne	TBXAS1	52	42
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450543919	FI	On-Demand	Anodyne	TBXAS1	52	42
CCn1c(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)nc2cc(F)ccc21	ZINC000450543924	GH	On-Demand	Anodyne	ITK	43	41
CCC(=O)C1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1	ZINC000450543928	GH	On-Demand	Anodyne	DRD4	33	45
CCC(=O)C1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1	ZINC000450543928	GH	On-Demand	Anodyne	SIGMAR1	26	48
CCC(=O)C1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1	ZINC000450543928	GH	On-Demand	Anodyne	SSTR5	61	41
CCC(=O)C1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1	ZINC000450543928	GH	On-Demand	Anodyne	CCR3	24	41
CCC(=O)C1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1	ZINC000450543928	GH	On-Demand	Anodyne	CXCR3	44	42
CCC(=O)C1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1	ZINC000450543928	GH	On-Demand	Anodyne	MCHR1	44	46
CCC(=O)C1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1	ZINC000450543928	GH	On-Demand	Anodyne	CACNA1I	54	43
COc1ccc(OC(F)(F)F)c(C(=O)NCc2cnc(C)nc2O)c1	ZINC000450543946	FE	On-Demand	Anodyne	PPARA	22	42
COc1ccc(OC(F)(F)F)c(C(=O)NCc2cnc(C)nc2O)c1	ZINC000450543946	FE	On-Demand	Anodyne	PPARD	48	42
COc1ccc(OC(F)(F)F)c(C(=O)NCc2cnc(C)nc2O)c1	ZINC000450543946	FE	On-Demand	Anodyne	SCN10A	31	40
C[C@@]1(CNc2ncc(C#N)cc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450543951	DG	On-Demand	Mild	PRKCQ	40	34
O=C(O)CCCCC(=O)N1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000450543959	EH	On-Demand	Anodyne	CCKBR	42	39
OC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543968	EF	On-Demand	Anodyne	PDE3A	45	34
OC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543968	EF	On-Demand	Anodyne	PDGFRB	45	40
OC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543968	EF	On-Demand	Anodyne	PDE3B	66	34
OC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543968	EF	On-Demand	Anodyne	SIRT3	53	38
OC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543968	EF	On-Demand	Anodyne	SIRT2	54	33
OC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543969	EF	On-Demand	Anodyne	PDE3A	45	34
OC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543969	EF	On-Demand	Anodyne	PDGFRB	45	40
OC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543969	EF	On-Demand	Anodyne	PDE3B	66	34
OC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543969	EF	On-Demand	Anodyne	SIRT3	53	38
OC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450543969	EF	On-Demand	Anodyne	SIRT2	54	33
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	DRD4	23	44
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	SIGMAR1	27	55
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	SSTR5	43	38
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	CCR3	20	40
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	CCKBR	53	36
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	PDK1	41	36
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	MCHR1	37	43
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	CACNA1G	15	49
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	ADIPOR1	0	40
O=C(CC1(O)CCC1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450543985	FG	On-Demand	Anodyne	ADIPOR2	0	40
O=C(Nc1ccc2c(c1)COC2)C1(Cc2ccccc2)CCOCC1	ZINC000450543989	EH	On-Demand	Anodyne	PTPRF	45	35
O=c1c(NC[C@@H](NCc2ccccc2)C(F)(F)F)nccn1C(F)F	ZINC000450543990	FE	On-Demand	Anodyne	CASP3	55	35
O=c1c(NC[C@@H](NCc2ccccc2)C(F)(F)F)nccn1C(F)F	ZINC000450543990	FE	On-Demand	Anodyne	CASP8	51	35
O=c1c(NC[C@H](NCc2ccccc2)C(F)(F)F)nccn1C(F)F	ZINC000450543991	FE	On-Demand	Anodyne	CASP3	55	35
O=c1c(NC[C@H](NCc2ccccc2)C(F)(F)F)nccn1C(F)F	ZINC000450543991	FE	On-Demand	Anodyne	CASP8	51	35
COc1ccc(-c2ccnc(NCCC3(OC)CCC3)n2)cc1	ZINC000450543996	DH	On-Demand	Anodyne	CLK4	26	54
COc1ccc(-c2ccnc(NCCC3(OC)CCC3)n2)cc1	ZINC000450543996	DH	On-Demand	Anodyne	DYRK1B	15	56
Cn1c(CNC(=O)c2cncc(Cl)c2)nnc1C1CCC1	ZINC000450543999	DE	On-Demand	Anodyne	CACNA1I	49	32
CNc1nc(N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)nc2ccccc12	ZINC000450544005	GD	On-Demand	Bother	HTR3A	15	56
N#Cc1cccc(NCc2cccc(N3CCOCC3)c2)c1[N+](=O)[O-]	ZINC000450544009	EF	On-Demand	Mild	MET	17	45
O=C(O)CCC(=O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450544015	CE	On-Demand	Anodyne	PRKCA	0	44
O=C(O)CCC(=O)N[C@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450544015	CE	On-Demand	Anodyne	KLK5	40	38
O=C(O)CCC(=O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450544020	CE	On-Demand	Anodyne	PRKCA	0	44
O=C(O)CCC(=O)N[C@@H]1CCC[C@@H]1OCc1ccccc1	ZINC000450544020	CE	On-Demand	Anodyne	KLK5	40	38
O=C(O)CCC(=O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450544022	CE	On-Demand	Anodyne	PRKCA	0	44
O=C(O)CCC(=O)N[C@H]1CCC[C@H]1OCc1ccccc1	ZINC000450544022	CE	On-Demand	Anodyne	KLK5	40	38
O=C(O)CCC(=O)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000450544023	CE	On-Demand	Anodyne	PRKCA	0	44
Cc1ccc(CN(CCO)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450544029	FF	On-Demand	Anodyne	LIMK2	41	49
N#Cc1cccc(NCC(=O)NCCN2CCCCCC2)c1[N+](=O)[O-]	ZINC000450544035	ED	On-Demand	Mild	DRD4	41	32
CS(=O)(=O)C[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544040	FE	On-Demand	Anodyne	PDE3A	50	38
CS(=O)(=O)C[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544040	FE	On-Demand	Anodyne	PDE3B	75	38
CS(=O)(=O)C[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544040	FE	On-Demand	Anodyne	SIRT3	58	37
CS(=O)(=O)C[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544040	FE	On-Demand	Anodyne	SIRT2	52	37
CS(=O)(=O)C[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544040	FE	On-Demand	Anodyne	SIRT1	52	37
CS(=O)(=O)C[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544041	FE	On-Demand	Anodyne	PDE3A	50	38
CS(=O)(=O)C[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544041	FE	On-Demand	Anodyne	PDE3B	75	38
CS(=O)(=O)C[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544041	FE	On-Demand	Anodyne	SIRT3	58	37
CS(=O)(=O)C[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544041	FE	On-Demand	Anodyne	SIRT2	52	37
CS(=O)(=O)C[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450544041	FE	On-Demand	Anodyne	SIRT1	52	37
Cc1ccc2c(c1)[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)CCC2	ZINC000450544051	CG	On-Demand	Bother	KCNN3	20	46
Cc1ccc2c(c1)[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)CCC2	ZINC000450544051	CG	On-Demand	Bother	PRKCQ	34	43
O=C(NCc1ccnc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450544061	GG	On-Demand	Anodyne	TYK2	66	39
CC(C)(C(=O)N1CCC(CCCn2ccnc2)CC1)C1CCC1	ZINC000450544073	DH	On-Demand	Anodyne	TBXAS1	36	44
CC(C)OCCCCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450544081	DF	On-Demand	Anodyne	DRD3	23	43
CC(C)OCCCCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450544081	DF	On-Demand	Anodyne	P2RY12	48	34
CC(C)OCCCCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450544082	DF	On-Demand	Anodyne	DRD3	23	43
CC(C)OCCCCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450544082	DF	On-Demand	Anodyne	P2RY12	48	34
Cc1c(CNC(=O)CCCCC(=O)O)sc2ccc(Cl)cc12	ZINC000450544085	EI	On-Demand	Anodyne	CMA1	16	40
CCc1cccc(C(=O)N2CCC(CCCn3ccnc3)CC2)n1	ZINC000450544096	EG	On-Demand	Anodyne	TBXAS1	46	39
CC1(O)CC(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)C1	ZINC000450544100	CD	On-Demand	Bother	AADAC	0	40
CN(C)c1nc(N2CCC(CS(C)(=O)=O)CC2)nc2ccccc12	ZINC000450544116	ED	On-Demand	Anodyne	NPY2R	0	53
OCCC1(Nc2ncnc3cc(Br)ccc23)CC1	ZINC000450544120	DF	On-Demand	Anodyne	EGFR	45	42
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450544121	FH	On-Demand	Anodyne	BDKRB1	54	38
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450544121	FH	On-Demand	Anodyne	LUXR	67	38
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450544121	FH	On-Demand	Anodyne	TRAR	41	38
O=C(Cc1ccc(C(=O)O)cc1)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450544121	FH	On-Demand	Anodyne	PHZR	0	41
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450544122	FH	On-Demand	Anodyne	BDKRB1	54	38
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450544122	FH	On-Demand	Anodyne	LUXR	67	38
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450544122	FH	On-Demand	Anodyne	TRAR	41	38
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450544122	FH	On-Demand	Anodyne	PHZR	0	41
O=C(c1ccnn1CC(F)(F)F)N1CCC(CCCn2ccnc2)CC1	ZINC000450544128	FF	On-Demand	Anodyne	HMOX2	44	31
O=C(NCc1ccc2nc(O)[nH]c2c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450544150	EE	On-Demand	Anodyne	GRIN2B	32	41
O=C(NCc1ccc2nc(O)[nH]c2c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450544151	EE	On-Demand	Anodyne	GRIN2B	32	41
COc1cc(CC(=O)Nc2c(C)noc2C2CC2)ccc1Cl	ZINC000450544156	DH	On-Demand	Anodyne	PFK	0	40
COc1ccc2c(c1)OCCN(C(=O)Cc1ccccc1C(=O)O)C2	ZINC000450544158	EE	On-Demand	Anodyne	AKR1C2	47	34
COCCN1CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1=O	ZINC000450544159	ED	On-Demand	Anodyne	CHRM5	37	40
C[C@@H]1CN(c2ncc(Cl)cc2Cl)CCN(C2CC2)C1	ZINC000450544160	DG	On-Demand	Anodyne	CXCR3	34	44
C[C@H]1CN(c2ncc(Cl)cc2Cl)CCN(C2CC2)C1	ZINC000450544161	DG	On-Demand	Anodyne	CXCR3	34	44
CN(C)c1nc(N2CCC[C@@H](O)CC2)nc2ccccc12	ZINC000450544167	CE	On-Demand	Anodyne	ADRA2A	0	40
CN(C)c1nc(N2CCC[C@H](O)CC2)nc2ccccc12	ZINC000450544168	CE	On-Demand	Anodyne	ADRA2A	0	40
Cc1ccn(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)n1	ZINC000450544169	GG	On-Demand	Anodyne	DRD4	38	44
Cc1ccn(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)n1	ZINC000450544169	GG	On-Demand	Anodyne	SIGMAR1	26	54
Cc1ccn(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)n1	ZINC000450544169	GG	On-Demand	Anodyne	SSTR5	62	41
Cc1ccn(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)n1	ZINC000450544169	GG	On-Demand	Anodyne	CCR3	21	43
Cc1ccn(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)n1	ZINC000450544169	GG	On-Demand	Anodyne	PDK1	43	38
Cc1ccn(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)n1	ZINC000450544169	GG	On-Demand	Anodyne	MCHR1	53	44
Cc1ccn(CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)n1	ZINC000450544169	GG	On-Demand	Anodyne	CACNA1I	56	43
Cc1[nH]c(C#N)cc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544172	GH	On-Demand	Mild	DRD4	30	45
Cc1[nH]c(C#N)cc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544172	GH	On-Demand	Mild	HTR4	27	43
Cc1[nH]c(C#N)cc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544172	GH	On-Demand	Mild	SIGMAR1	20	44
Cc1[nH]c(C#N)cc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544172	GH	On-Demand	Mild	SSTR5	50	42
Cc1[nH]c(C#N)cc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544172	GH	On-Demand	Mild	MCHR1	37	45
Cc1[nH]c(C#N)cc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544172	GH	On-Demand	Mild	CACNA1I	48	41
O=C(O)c1cccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1	ZINC000450544176	DG	On-Demand	Anodyne	PREP	30	43
O=C(O)c1cccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1	ZINC000450544176	DG	On-Demand	Anodyne	RBP4	24	41
O=C(O)c1cccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1	ZINC000450544176	DG	On-Demand	Anodyne	L3MBTL1	0	42
COc1ccc(-c2ccnc(N3CCC[C@H](CO)CC3)n2)cc1	ZINC000450544187	DF	On-Demand	Anodyne	SORD	25	42
COc1ccc(-c2ccnc(N3CCC[C@H](CO)CC3)n2)cc1	ZINC000450544187	DF	On-Demand	Anodyne	DKK1	0	51
COc1ccc(-c2ccnc(N3CCC[C@H](CO)CC3)n2)cc1	ZINC000450544187	DF	On-Demand	Anodyne	SLC6A7	0	42
COc1ccc(-c2ccnc(N3CCC[C@@H](CO)CC3)n2)cc1	ZINC000450544188	DF	On-Demand	Anodyne	SORD	25	42
COc1ccc(-c2ccnc(N3CCC[C@@H](CO)CC3)n2)cc1	ZINC000450544188	DF	On-Demand	Anodyne	DKK1	0	51
COc1ccc(-c2ccnc(N3CCC[C@@H](CO)CC3)n2)cc1	ZINC000450544188	DF	On-Demand	Anodyne	SLC6A7	0	42
CC1(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1	ZINC000450544190	FG	On-Demand	Bother	CACNA1C	47	36
CC1(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1	ZINC000450544190	FG	On-Demand	Bother	CACNA1D	80	36
Cc1ncc(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c(O)n1	ZINC000450544213	ED	On-Demand	Anodyne	ANPEP	34	40
Cc1ccc(CN(CCO)C(=O)CCc2ccc3ccccc3c2O)cc1	ZINC000450544219	FH	On-Demand	Anodyne	ALOX5	15	52
CC[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cnn2c1CCC2	ZINC000450544226	GI	On-Demand	Anodyne	AVPR2	32	40
CC[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cnn2c1CCC2	ZINC000450544227	GI	On-Demand	Anodyne	AVPR2	32	40
CNc1nc(N2CC[C@@]3(CCCN(C)C3)C2)nc2ccccc12	ZINC000450544229	DE	On-Demand	Anodyne	HRH4	20	46
CNc1nc(N2CC[C@]3(CCCN(C)C3)C2)nc2ccccc12	ZINC000450544230	DE	On-Demand	Anodyne	HRH4	20	46
CN(C)c1nc(N2CCC[C@@H](CS(C)(=O)=O)C2)nc2ccccc12	ZINC000450544236	ED	On-Demand	Anodyne	ADRA2A	0	48
CN(C)c1nc(N2CCC[C@H](CS(C)(=O)=O)C2)nc2ccccc12	ZINC000450544237	ED	On-Demand	Anodyne	ADRA2A	0	48
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450544240	FH	On-Demand	Anodyne	BDKRB1	47	37
O=C(Cc1cccc(C(=O)O)c1)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000450544240	FH	On-Demand	Anodyne	LUXR	62	38
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450544242	FH	On-Demand	Anodyne	BDKRB1	47	37
O=C(Cc1cccc(C(=O)O)c1)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000450544242	FH	On-Demand	Anodyne	LUXR	62	38
Cc1cccc(C)c1[C@H](C)NC(=O)c1cccc(OCC(=O)O)c1	ZINC000450544258	EG	On-Demand	Anodyne	FABP4	46	37
Cc1cccc(C)c1[C@@H](C)NC(=O)c1cccc(OCC(=O)O)c1	ZINC000450544264	EG	On-Demand	Anodyne	FABP4	46	37
C[C@@H]1CCO[C@@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544275	FG	On-Demand	Anodyne	DRD4	22	42
C[C@@H]1CCO[C@@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544275	FG	On-Demand	Anodyne	SIGMAR1	23	47
C[C@@H]1CCO[C@@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544275	FG	On-Demand	Anodyne	SSTR5	46	39
C[C@@H]1CCO[C@@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544275	FG	On-Demand	Anodyne	PDK1	47	35
C[C@@H]1CCO[C@@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544275	FG	On-Demand	Anodyne	MCHR1	41	39
C[C@@H]1CCO[C@@H]1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544275	FG	On-Demand	Anodyne	CACNA1I	42	34
CC(C)OCCCCNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450544276	DH	On-Demand	Anodyne	SCN9A	0	43
CC(C)OCCCCNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450544276	DH	On-Demand	Anodyne	AMY2	47	32
CC(C)OCCCCNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450544277	DH	On-Demand	Anodyne	SCN9A	0	43
CC(C)OCCCCNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450544277	DH	On-Demand	Anodyne	AMY2	47	32
CC(C)OCCCCNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450544279	DH	On-Demand	Anodyne	SCN9A	0	43
CC(C)OCCCCNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450544279	DH	On-Demand	Anodyne	AMY2	47	32
CC(C)OCCCCNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450544281	DH	On-Demand	Anodyne	SCN9A	0	43
CC(C)OCCCCNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450544281	DH	On-Demand	Anodyne	AMY2	47	32
O=C(O)c1ccc(CCC(=O)N2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450544283	GD	On-Demand	Anodyne	L3MBTL3	48	34
O=C(O)c1ccc(CCC(=O)N2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000450544284	GD	On-Demand	Anodyne	L3MBTL3	48	34
O=C(O)c1ccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)cc1	ZINC000450544339	FI	On-Demand	Anodyne	INHA	19	43
O=C(O)c1ccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)cc1	ZINC000450544339	FI	On-Demand	Anodyne	SCN5A	0	42
O=C(O)c1ccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)cc1	ZINC000450544339	FI	On-Demand	Anodyne	EPHX2	15	40
O=C(O)c1ccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)cc1	ZINC000450544339	FI	On-Demand	Anodyne	CCR8	16	42
O=C(O)c1ccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)cc1	ZINC000450544339	FI	On-Demand	Anodyne	SLC6A7	0	43
O=C(c1ccccc1[N+](=O)[O-])N1CCN(c2nc(C3CCC3)no2)CC1	ZINC000450544340	FE	On-Demand	Bother	L3MBTL3	15	40
FC(F)(F)[C@H](CNc1ncnc2c1ncn2C1CC1)NCc1ccccc1	ZINC000450544365	GG	On-Demand	Anodyne	ADORA1	46	43
FC(F)(F)[C@H](CNc1ncnc2c1ncn2C1CC1)NCc1ccccc1	ZINC000450544365	GG	On-Demand	Anodyne	CDK1	27	43
FC(F)(F)[C@H](CNc1ncnc2c1ncn2C1CC1)NCc1ccccc1	ZINC000450544365	GG	On-Demand	Anodyne	ADORA3	62	46
FC(F)(F)[C@H](CNc1ncnc2c1ncn2C1CC1)NCc1ccccc1	ZINC000450544365	GG	On-Demand	Anodyne	DNMT3B	37	40
FC(F)(F)[C@@H](CNc1ncnc2c1ncn2C1CC1)NCc1ccccc1	ZINC000450544366	GG	On-Demand	Anodyne	ADORA1	46	43
FC(F)(F)[C@@H](CNc1ncnc2c1ncn2C1CC1)NCc1ccccc1	ZINC000450544366	GG	On-Demand	Anodyne	CDK1	27	43
FC(F)(F)[C@@H](CNc1ncnc2c1ncn2C1CC1)NCc1ccccc1	ZINC000450544366	GG	On-Demand	Anodyne	ADORA3	62	46
FC(F)(F)[C@@H](CNc1ncnc2c1ncn2C1CC1)NCc1ccccc1	ZINC000450544366	GG	On-Demand	Anodyne	DNMT3B	37	40
CC[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cnc(C2CC2)nc1	ZINC000450544381	GJ	On-Demand	Anodyne	AVPR2	36	40
CC[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cnc(C2CC2)nc1	ZINC000450544382	GJ	On-Demand	Anodyne	AVPR2	36	40
COc1cc(CC(=O)NC[C@H]2CCCCS2)ccc1Cl	ZINC000450544383	DG	On-Demand	Anodyne	DRD2	42	35
COc1cc(CC(=O)NC[C@H]2CCCCS2)ccc1Cl	ZINC000450544383	DG	On-Demand	Anodyne	NCE103	22	43
COc1cc(CC(=O)NC[C@H]2CCCCS2)ccc1Cl	ZINC000450544383	DG	On-Demand	Anodyne	P96878_MYCTU	16	43
COc1cc(CC(=O)NC[C@H]2CCCCS2)ccc1Cl	ZINC000450544383	DG	On-Demand	Anodyne	CAN2	0	43
COc1cc(CC(=O)NC[C@@H]2CCCCS2)ccc1Cl	ZINC000450544384	DG	On-Demand	Anodyne	DRD2	42	35
COc1cc(CC(=O)NC[C@@H]2CCCCS2)ccc1Cl	ZINC000450544384	DG	On-Demand	Anodyne	NCE103	22	43
COc1cc(CC(=O)NC[C@@H]2CCCCS2)ccc1Cl	ZINC000450544384	DG	On-Demand	Anodyne	P96878_MYCTU	16	43
COc1cc(CC(=O)NC[C@@H]2CCCCS2)ccc1Cl	ZINC000450544384	DG	On-Demand	Anodyne	CAN2	0	43
COc1cccc(OCCC(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)c1	ZINC000450544392	GG	On-Demand	Mild	TNKS	55	44
COc1ccc(-c2noc(N3C[C@H](C)N(C)[C@H](C)C3)n2)cc1	ZINC000450544422	DE	On-Demand	Anodyne	LUCI_PHOPE	15	41
O[C@@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450544439	DH	On-Demand	Anodyne	PRKD1	39	42
O[C@@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450544439	DH	On-Demand	Anodyne	LIPG	45	34
O[C@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450544440	DH	On-Demand	Anodyne	PRKD1	39	42
O[C@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450544440	DH	On-Demand	Anodyne	LIPG	45	34
Cc1ccccc1C[C@H](C)N(C)C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450544457	EG	On-Demand	Anodyne	OPRK1	0	42
Cc1ccccc1C[C@@H](C)N(C)C(=O)Cc1ccc(C(=O)O)cc1	ZINC000450544458	EG	On-Demand	Anodyne	OPRK1	0	42
COc1cc(CC(=O)NCc2nnc(C3CCC3)n2C)ccc1Cl	ZINC000450544475	EF	On-Demand	Anodyne	DRD2	46	36
COc1cc(CC(=O)NCc2nnc(C3CCC3)n2C)ccc1Cl	ZINC000450544475	EF	On-Demand	Anodyne	TRPV1	26	42
COc1cc(CC(=O)NCc2nnc(C3CCC3)n2C)ccc1Cl	ZINC000450544475	EF	On-Demand	Anodyne	NCE103	22	43
COc1cc(CC(=O)NCc2nnc(C3CCC3)n2C)ccc1Cl	ZINC000450544475	EF	On-Demand	Anodyne	CAN2	0	43
CC[C@H](CC(C)C)C(=O)NCc1ccc2nc(O)[nH]c2c1	ZINC000450544480	CF	On-Demand	Anodyne	MMP7	17	40
CC[C@@H](CC(C)C)C(=O)NCc1ccc2nc(O)[nH]c2c1	ZINC000450544481	CF	On-Demand	Anodyne	MMP7	17	40
Cc1cc(CN(C)C(=O)CCc2ccc(C(=O)O)cc2)ccc1F	ZINC000450544483	EG	On-Demand	Anodyne	TRPM8	45	37
CSc1cccc(C(=O)Nc2c(C)noc2C2CC2)c1	ZINC000450544490	CH	On-Demand	Anodyne	KCNK3	43	33
CCC[C@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544497	FH	On-Demand	Anodyne	DRD4	27	43
CCC[C@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544497	FH	On-Demand	Anodyne	ACHE	16	42
CCC[C@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544497	FH	On-Demand	Anodyne	SIGMAR1	27	47
CCC[C@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544497	FH	On-Demand	Anodyne	SSTR5	52	39
CCC[C@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544497	FH	On-Demand	Anodyne	PDK1	49	37
CCC[C@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544497	FH	On-Demand	Anodyne	MCHR1	44	44
CCC[C@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544497	FH	On-Demand	Anodyne	CACNA1I	57	44
CCC[C@@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544498	FH	On-Demand	Anodyne	DRD4	27	43
CCC[C@@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544498	FH	On-Demand	Anodyne	ACHE	16	42
CCC[C@@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544498	FH	On-Demand	Anodyne	SIGMAR1	27	47
CCC[C@@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544498	FH	On-Demand	Anodyne	SSTR5	52	39
CCC[C@@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544498	FH	On-Demand	Anodyne	PDK1	49	37
CCC[C@@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544498	FH	On-Demand	Anodyne	MCHR1	44	44
CCC[C@@H](OC)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544498	FH	On-Demand	Anodyne	CACNA1I	57	44
CCc1noc(C)c1CNc1ccc(CC(=O)OC)cc1[N+](=O)[O-]	ZINC000450544514	EF	On-Demand	Bother	DRTS_TOXGO	16	42
Cc1ccccc1C[C@H](C)N(C)C(=O)[C@H]1CCC[C@@H](C(=O)O)C1	ZINC000450544544	DG	On-Demand	Anodyne	SLC6A1	78	36
Cc1ccccc1C[C@H](C)N(C)C(=O)[C@@H]1CCC[C@H](C(=O)O)C1	ZINC000450544545	DG	On-Demand	Anodyne	SLC6A1	78	36
Cc1ccccc1C[C@H](C)N(C)C(=O)[C@@H]1CCC[C@@H](C(=O)O)C1	ZINC000450544546	DG	On-Demand	Anodyne	SLC6A1	78	36
Cc1ccccc1C[C@H](C)N(C)C(=O)[C@H]1CCC[C@H](C(=O)O)C1	ZINC000450544547	DG	On-Demand	Anodyne	SLC6A1	78	36
NS(=O)(=O)CCCCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450544563	EF	On-Demand	Anodyne	HRP1_PLAFA	115	43
C[C@H](OCCc1ccccc1)C(=O)NCc1nnc(C2CCC2)n1C	ZINC000450544590	EE	On-Demand	Anodyne	ACE	45	38
C[C@@H](OCCc1ccccc1)C(=O)NCc1nnc(C2CCC2)n1C	ZINC000450544591	EE	On-Demand	Anodyne	ACE	45	38
CCn1c(NC(=O)c2cc(C)n(C(C)C)n2)nc2cc(F)ccc21	ZINC000450544593	EH	On-Demand	Anodyne	P2RX7	19	40
CCn1c(NC(=O)c2cc(C)n(C(C)C)n2)nc2cc(F)ccc21	ZINC000450544593	EH	On-Demand	Anodyne	ITK	41	38
COc1cc(CC(=O)NCc2cnc(C)nc2O)ccc1O	ZINC000450544594	DD	On-Demand	Anodyne	FOLA	22	46
COc1cc(CC(=O)NCc2cnc(C)nc2O)ccc1O	ZINC000450544594	DD	On-Demand	Anodyne	TRPV1	47	58
COc1cc(CC(=O)NCc2cnc(C)nc2O)ccc1O	ZINC000450544594	DD	On-Demand	Anodyne	NCE103	32	44
COc1cc(CC(=O)NCc2cnc(C)nc2O)ccc1O	ZINC000450544594	DD	On-Demand	Anodyne	P96878_MYCTU	24	44
COc1ccc2c(c1)OCCN(C(=O)CCc1ccccc1C(=O)O)C2	ZINC000450544604	FF	On-Demand	Anodyne	AKR1C2	45	34
COc1ccc2c(c1)OCCN(C(=O)Cc1ccc(C(=O)O)cc1)C2	ZINC000450544620	EE	On-Demand	Anodyne	BMP1	47	37
CO[C@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544621	DF	On-Demand	Anodyne	EGFR	61	38
CO[C@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544621	DF	On-Demand	Anodyne	ERBB2	16	42
CO[C@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544621	DF	On-Demand	Anodyne	FBP1	18	42
CO[C@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544621	DF	On-Demand	Anodyne	ERBB4	16	42
CO[C@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544621	DF	On-Demand	Anodyne	EPHA2	43	36
CO[C@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544621	DF	On-Demand	Anodyne	MKNK1	21	42
CO[C@@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544622	DF	On-Demand	Anodyne	EGFR	61	38
CO[C@@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544622	DF	On-Demand	Anodyne	ERBB2	16	42
CO[C@@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544622	DF	On-Demand	Anodyne	FBP1	18	42
CO[C@@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544622	DF	On-Demand	Anodyne	ERBB4	16	42
CO[C@@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544622	DF	On-Demand	Anodyne	EPHA2	43	36
CO[C@@H](CNc1ncnc2cc(Br)ccc12)C1CC1	ZINC000450544622	DF	On-Demand	Anodyne	MKNK1	21	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1c(C)noc1C1CC1	ZINC000450544637	DI	On-Demand	Anodyne	SORT1	16	44
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1c(C)noc1C1CC1	ZINC000450544637	DI	On-Demand	Anodyne	MTTP	41	33
Cc1nc(NC2CC(C(C)(C)C)C2)ncc1[N+](=O)[O-]	ZINC000450544638	CF	On-Demand	Bother	PRKCQ	44	38
CC1(NC(=O)COc2ccc(C#N)c(Br)c2)Cc2ccccc2C1	ZINC000450544640	GG	On-Demand	Mild	TRPV4	43	33
NS(=O)(=O)CCCCNc1ncnc2cc(Br)ccc12	ZINC000450544645	FD	On-Demand	Anodyne	EGFR	83	44
CC(C)OC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544647	GI	On-Demand	Anodyne	DRD4	28	42
CC(C)OC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544647	GI	On-Demand	Anodyne	ACHE	18	42
CC(C)OC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544647	GI	On-Demand	Anodyne	CHRM3	15	42
CC(C)OC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544647	GI	On-Demand	Anodyne	SIGMAR1	26	47
CC(C)OC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544647	GI	On-Demand	Anodyne	SSTR5	58	41
CC(C)OC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544647	GI	On-Demand	Anodyne	PDK1	42	37
CC(C)OC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544647	GI	On-Demand	Anodyne	MCHR1	50	42
CC(C)OC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450544647	GI	On-Demand	Anodyne	CACNA1I	70	42
C[C@H]1CN(c2ncnc3[nH]c4ccccc4c23)C[C@@H](C)N1C	ZINC000450544654	CF	On-Demand	Anodyne	LIMK2	60	38
COc1ccc2c(c1)OCCN(C(=O)[C@@H]1CC[C@H]1C(=O)O)C2	ZINC000450544665	DD	On-Demand	Anodyne	RORC	40	34
COc1ccc2c(c1)OCCN(C(=O)[C@@H]1CC[C@@H]1C(=O)O)C2	ZINC000450544666	DD	On-Demand	Anodyne	RORC	40	34
COc1ccc2c(c1)OCCN(C(=O)[C@H]1CC[C@H]1C(=O)O)C2	ZINC000450544667	DD	On-Demand	Anodyne	RORC	40	34
COc1ccc2c(c1)OCCN(C(=O)[C@H]1CC[C@@H]1C(=O)O)C2	ZINC000450544668	DD	On-Demand	Anodyne	RORC	40	34
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccnc(C(=O)O)c3)C2)c1	ZINC000450544685	EF	On-Demand	Anodyne	FTO	0	42
Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccnc(C(=O)O)c3)C2)c1	ZINC000450544686	EF	On-Demand	Anodyne	FTO	0	42
COc1cc(CC(=O)NC2(C)Cc3ccccc3C2)ccc1O	ZINC000450544700	DF	On-Demand	Anodyne	TRPV1	44	50
COc1cc(CC(=O)NC2(C)Cc3ccccc3C2)ccc1O	ZINC000450544700	DF	On-Demand	Anodyne	TTR	0	43
COc1cc(CC(=O)NC2(C)Cc3ccccc3C2)ccc1O	ZINC000450544700	DF	On-Demand	Anodyne	NCE103	39	45
COc1cc(CC(=O)NC2(C)Cc3ccccc3C2)ccc1O	ZINC000450544700	DF	On-Demand	Anodyne	P96878_MYCTU	25	45
COc1cc(CC(=O)NC2(C)Cc3ccccc3C2)ccc1O	ZINC000450544700	DF	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)NCCCC#N)ccc1Cl	ZINC000450544709	CE	On-Demand	Mild	CAN2	0	52
O[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450544711	DF	On-Demand	Anodyne	PDE3A	46	35
O[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450544711	DF	On-Demand	Anodyne	PDE3B	68	35
O[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450544711	DF	On-Demand	Anodyne	SIRT3	49	34
O[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450544711	DF	On-Demand	Anodyne	SIRT2	43	30
O[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450544712	DF	On-Demand	Anodyne	PDE3A	46	35
O[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450544712	DF	On-Demand	Anodyne	PDE3B	68	35
O[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450544712	DF	On-Demand	Anodyne	SIRT3	49	34
O[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450544712	DF	On-Demand	Anodyne	SIRT2	43	30
N#CCCCNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450544730	ED	On-Demand	Mild	AR	15	42
N#CCCCNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450544731	ED	On-Demand	Mild	AR	15	42
Cc1ncc(CNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)c(O)n1	ZINC000450544732	GD	On-Demand	Mild	P2RX7	42	39
Cc1ncc(CNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)c(O)n1	ZINC000450544733	GD	On-Demand	Mild	P2RX7	42	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc2nc(O)[nH]c2c1	ZINC000450544734	FE	On-Demand	Anodyne	ANPEP	33	40
CCn1c(NC(=O)c2cn(C)nc2COC)nc2cc(F)ccc21	ZINC000450544748	EE	On-Demand	Anodyne	ITK	40	38
Cc1cc(NC[C@@H](NCc2ccccc2)C(F)(F)F)ncn1	ZINC000450544749	DE	On-Demand	Anodyne	FAAH	19	40
Cc1cc(NC[C@H](NCc2ccccc2)C(F)(F)F)ncn1	ZINC000450544750	DE	On-Demand	Anodyne	FAAH	19	40
COc1ccc(-c2noc(N3CCC[C@@H](CO)CC3)n2)cc1	ZINC000450544753	DE	On-Demand	Anodyne	COLA	19	43
COc1ccc(-c2noc(N3CCC[C@@H](CO)CC3)n2)cc1	ZINC000450544753	DE	On-Demand	Anodyne	CPT1A	15	43
COc1ccc(-c2noc(N3CCC[C@H](CO)CC3)n2)cc1	ZINC000450544754	DE	On-Demand	Anodyne	COLA	19	43
COc1ccc(-c2noc(N3CCC[C@H](CO)CC3)n2)cc1	ZINC000450544754	DE	On-Demand	Anodyne	CPT1A	15	43
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCC#N)cc2)c1	ZINC000450544760	EF	On-Demand	Mild	CTSB	24	45
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCC#N)cc2)c1	ZINC000450544760	EF	On-Demand	Mild	CTSS	23	43
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCC#N)cc2)c1	ZINC000450544760	EF	On-Demand	Mild	CTSV	42	43
O=C(O)COc1cccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1	ZINC000450544779	EG	On-Demand	Anodyne	PTGIR	45	38
O=C(O)COc1cccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1	ZINC000450544779	EG	On-Demand	Anodyne	FABP4	45	34
O=C(O)COc1cccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1	ZINC000450544779	EG	On-Demand	Anodyne	COLA	103	40
O=C(O)COc1cccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1	ZINC000450544779	EG	On-Demand	Anodyne	CPT1A	94	40
O=C(O)COc1cccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1	ZINC000450544779	EG	On-Demand	Anodyne	CFTR	45	36
CCOC1(CNc2ncc([N+](=O)[O-])c(C)n2)CCCC1	ZINC000450544780	CE	On-Demand	Bother	PRKCQ	44	35
Cc1nc(N[C@]2(C)C[C@H]2c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450544788	CG	On-Demand	Bother	PRKCQ	44	38
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]2OCCC[C@@H]21	ZINC000450544799	DE	On-Demand	Anodyne	LUXR	40	40
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]2OCCC[C@@H]21	ZINC000450544799	DE	On-Demand	Anodyne	TRAR	23	40
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]2OCCC[C@H]12	ZINC000450544800	DE	On-Demand	Anodyne	LUXR	40	40
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]2OCCC[C@H]12	ZINC000450544800	DE	On-Demand	Anodyne	TRAR	23	40
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]2OCCC[C@@H]12	ZINC000450544801	DE	On-Demand	Anodyne	LUXR	40	40
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]2OCCC[C@@H]12	ZINC000450544801	DE	On-Demand	Anodyne	TRAR	23	40
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]2OCCC[C@H]21	ZINC000450544802	DE	On-Demand	Anodyne	LUXR	40	40
O=C(CCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]2OCCC[C@H]21	ZINC000450544802	DE	On-Demand	Anodyne	TRAR	23	40
COc1cc(CC(=O)NCc2cnc(C)nc2O)ccc1Cl	ZINC000450544809	DE	On-Demand	Anodyne	CAN2	0	45
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H]1CCCCS1(=O)=O	ZINC000450544824	EF	On-Demand	Anodyne	CCR2	31	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCCCS1(=O)=O	ZINC000450544825	EF	On-Demand	Anodyne	CCR2	31	40
Cc1ccn2ncc(C(=O)NC3(C)Cc4ccccc4C3)c2c1	ZINC000450544827	DF	On-Demand	Anodyne	EPHB3	41	57
CC1(O)CC(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1	ZINC000450544834	FG	On-Demand	Anodyne	DRD4	28	40
CC1(O)CC(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1	ZINC000450544834	FG	On-Demand	Anodyne	SIGMAR1	26	53
CC1(O)CC(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1	ZINC000450544834	FG	On-Demand	Anodyne	SSTR5	48	40
CC1(O)CC(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1	ZINC000450544834	FG	On-Demand	Anodyne	EPHX2	18	43
CC1(O)CC(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1	ZINC000450544834	FG	On-Demand	Anodyne	PDK1	41	36
CC1(O)CC(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1	ZINC000450544834	FG	On-Demand	Anodyne	CXCR3	35	41
CC1(O)CC(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1	ZINC000450544834	FG	On-Demand	Anodyne	MCHR1	46	40
CC1(O)CC(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1	ZINC000450544834	FG	On-Demand	Anodyne	CACNA1I	46	41
CN1CCC[C@]2(CCN(c3ncnc4[nH]c5ccccc5c34)C2)C1	ZINC000450544888	DG	On-Demand	Anodyne	AKT1	15	40
CN1CCC[C@@]2(CCN(c3ncnc4[nH]c5ccccc5c34)C2)C1	ZINC000450544889	DG	On-Demand	Anodyne	AKT1	15	40
COc1cccc2c(N3CCC[C@H](n4cc(CO)nn4)C3)nccc12	ZINC000450544896	EE	On-Demand	Anodyne	PDE3B	61	33
COc1cccc2c(N3CCC[C@@H](n4cc(CO)nn4)C3)nccc12	ZINC000450544897	EE	On-Demand	Anodyne	PDE3B	61	33
CCn1ccnc(NC[C@@H](NCc2ccccc2)C(F)(F)F)c1=O	ZINC000450544902	ED	On-Demand	Anodyne	CASP3	42	33
CCn1ccnc(NC[C@@H](NCc2ccccc2)C(F)(F)F)c1=O	ZINC000450544902	ED	On-Demand	Anodyne	CASP8	42	34
CCn1ccnc(NC[C@H](NCc2ccccc2)C(F)(F)F)c1=O	ZINC000450544903	ED	On-Demand	Anodyne	CASP3	42	33
CCn1ccnc(NC[C@H](NCc2ccccc2)C(F)(F)F)c1=O	ZINC000450544903	ED	On-Demand	Anodyne	CASP8	42	34
Cc1ccccc1C[C@H](C)N(C)C(=O)CCCCC(=O)O	ZINC000450544904	CG	On-Demand	Anodyne	KDM4A	0	41
Cc1ccccc1C[C@H](C)N(C)C(=O)CCCCC(=O)O	ZINC000450544904	CG	On-Demand	Anodyne	KDM4C	0	41
Cc1ccccc1C[C@@H](C)N(C)C(=O)CCCCC(=O)O	ZINC000450544905	CG	On-Demand	Anodyne	KDM4A	0	41
Cc1ccccc1C[C@@H](C)N(C)C(=O)CCCCC(=O)O	ZINC000450544905	CG	On-Demand	Anodyne	KDM4C	0	41
COCCN1CCN(C(=O)c2c(Cl)cc(F)cc2Br)CC1=O	ZINC000450544915	GE	On-Demand	Anodyne	P2RX7	25	52
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CC1(F)F	ZINC000450544927	FH	On-Demand	Anodyne	DRD4	23	45
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CC1(F)F	ZINC000450544927	FH	On-Demand	Anodyne	CHRM3	15	42
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CC1(F)F	ZINC000450544927	FH	On-Demand	Anodyne	SIGMAR1	27	52
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CC1(F)F	ZINC000450544927	FH	On-Demand	Anodyne	SSTR5	48	39
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CC1(F)F	ZINC000450544927	FH	On-Demand	Anodyne	CCR3	20	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CC1(F)F	ZINC000450544927	FH	On-Demand	Anodyne	CXCR3	22	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CC1(F)F	ZINC000450544927	FH	On-Demand	Anodyne	MCHR1	43	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H]1CC1(F)F	ZINC000450544927	FH	On-Demand	Anodyne	CACNA1I	44	38
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CC1(F)F	ZINC000450544928	FH	On-Demand	Anodyne	DRD4	23	45
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CC1(F)F	ZINC000450544928	FH	On-Demand	Anodyne	CHRM3	15	42
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CC1(F)F	ZINC000450544928	FH	On-Demand	Anodyne	SIGMAR1	27	52
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CC1(F)F	ZINC000450544928	FH	On-Demand	Anodyne	SSTR5	48	39
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CC1(F)F	ZINC000450544928	FH	On-Demand	Anodyne	CCR3	20	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CC1(F)F	ZINC000450544928	FH	On-Demand	Anodyne	CXCR3	22	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CC1(F)F	ZINC000450544928	FH	On-Demand	Anodyne	MCHR1	43	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H]1CC1(F)F	ZINC000450544928	FH	On-Demand	Anodyne	CACNA1I	44	38
C[C@@H]1CN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CCN(C2CC2)C1	ZINC000450544932	GD	On-Demand	Bother	L3MBTL1	0	47
C[C@@H]1CN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CCN(C2CC2)C1	ZINC000450544932	GD	On-Demand	Bother	L3MBTL3	61	47
C[C@H]1CN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CCN(C2CC2)C1	ZINC000450544933	GD	On-Demand	Bother	L3MBTL1	0	47
C[C@H]1CN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CCN(C2CC2)C1	ZINC000450544933	GD	On-Demand	Bother	L3MBTL3	61	47
N#Cc1cc2c(nc1N1CCN(C(=O)c3ccccc3[N+](=O)[O-])CC1)CCOC2	ZINC000450544950	GD	On-Demand	Mild	SLC6A9	15	40
Cc1ncc(CNC(=O)CCc2cccc(F)c2Br)c(O)n1	ZINC000450544958	FF	On-Demand	Anodyne	P2RX7	26	40
COc1ccc(-c2ccnc(N[C@@H]3CCC[C@@H]3F)n2)cc1	ZINC000450544959	CG	On-Demand	Anodyne	IKBKB	15	45
COc1ccc(-c2ccnc(N[C@H]3CCC[C@H]3F)n2)cc1	ZINC000450544960	CG	On-Demand	Anodyne	IKBKB	15	45
COc1cccc2c(N3CCCO[C@H](C(C)C)C3)nccc12	ZINC000450544968	DG	On-Demand	Anodyne	PDE3B	55	37
COc1cccc2c(N3CCCO[C@@H](C(C)C)C3)nccc12	ZINC000450544969	DG	On-Demand	Anodyne	PDE3B	55	37
CC1(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CCC(=O)CC1	ZINC000450544976	FJ	On-Demand	Anodyne	RBP4	62	36
CC1(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CCC(=O)CC1	ZINC000450544977	FJ	On-Demand	Anodyne	RBP4	62	36
CC1(C(=O)N[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CCC(=O)CC1	ZINC000450544978	FJ	On-Demand	Anodyne	RBP4	62	36
CC1(C(=O)N[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CCC(=O)CC1	ZINC000450544979	FJ	On-Demand	Anodyne	RBP4	62	36
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	DRD4	31	49
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	ACHE	17	42
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	KCNH2	15	42
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	SIGMAR1	28	50
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	SSTR5	52	43
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	CCR3	23	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	MAPKAPK2	18	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	PDK1	51	39
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	MCHR1	47	47
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccsn1	ZINC000450544982	FH	On-Demand	Anodyne	CACNA1I	47	42
CCc1cccc(C(=O)NC2(C)Cc3ccccc3C2)n1	ZINC000450544985	CF	On-Demand	Anodyne	G2YM83_BOTF4	45	32
COc1ccc(-c2noc(N3CCC[C@@H]3CF)n2)cc1	ZINC000450544988	CF	On-Demand	Anodyne	COLA	0	43
COc1ccc(-c2noc(N3CCC[C@H]3CF)n2)cc1	ZINC000450544989	CF	On-Demand	Anodyne	COLA	0	43
Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3F)C2)c1	ZINC000450544990	FH	On-Demand	Anodyne	RXRG	39	40
Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3F)C2)c1	ZINC000450544990	FH	On-Demand	Anodyne	RXRA	17	40
Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3F)C2)c1	ZINC000450544990	FH	On-Demand	Anodyne	RXRB	38	40
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3F)C2)c1	ZINC000450544991	FH	On-Demand	Anodyne	RXRG	39	40
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3F)C2)c1	ZINC000450544991	FH	On-Demand	Anodyne	RXRA	17	40
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3F)C2)c1	ZINC000450544991	FH	On-Demand	Anodyne	RXRB	38	40
CC[C@@H](O)CC(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000450545004	DD	On-Demand	Mild	DGAT1	26	41
CC[C@@H](O)CC(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000450545004	DD	On-Demand	Mild	TNKS	43	38
CC[C@H](O)CC(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000450545005	DD	On-Demand	Mild	DGAT1	26	41
CC[C@H](O)CC(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000450545005	DD	On-Demand	Mild	TNKS	43	38
CCOC(=O)c1csc(N2CCc3cc(OC)c(Cl)cc3C2)n1	ZINC000450545025	FH	On-Demand	Anodyne	ABCB1B	55	33
C[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)N1C	ZINC000450545030	EF	On-Demand	Anodyne	PDE3A	45	36
O=C(Nc1ccc2c(c1)COC2)C1(Cc2cccc(Cl)c2)CC1	ZINC000450545057	EI	On-Demand	Anodyne	PTPRF	41	31
CC(C)[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCCO1	ZINC000450545068	FH	On-Demand	Anodyne	PDE3A	45	35
CC(C)[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCCO1	ZINC000450545068	FH	On-Demand	Anodyne	PDE3B	66	35
CC(C)[C@H]1CN(c2ncnc3cc(Br)ccc23)CCCO1	ZINC000450545069	FH	On-Demand	Anodyne	PDE3A	45	35
CC(C)[C@H]1CN(c2ncnc3cc(Br)ccc23)CCCO1	ZINC000450545069	FH	On-Demand	Anodyne	PDE3B	66	35
O=C(O)c1ccc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)cc1	ZINC000450545070	DG	On-Demand	Anodyne	L3MBTL3	60	36
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1(C(=O)C2CC2)CC1	ZINC000450545071	GH	On-Demand	Anodyne	DRD4	29	46
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1(C(=O)C2CC2)CC1	ZINC000450545071	GH	On-Demand	Anodyne	SIGMAR1	25	49
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1(C(=O)C2CC2)CC1	ZINC000450545071	GH	On-Demand	Anodyne	SSTR5	53	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1(C(=O)C2CC2)CC1	ZINC000450545071	GH	On-Demand	Anodyne	CCR3	22	42
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1(C(=O)C2CC2)CC1	ZINC000450545071	GH	On-Demand	Anodyne	CXCR3	31	43
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1(C(=O)C2CC2)CC1	ZINC000450545071	GH	On-Demand	Anodyne	MCHR1	44	47
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1(C(=O)C2CC2)CC1	ZINC000450545071	GH	On-Demand	Anodyne	CACNA1I	49	41
CC1(C)CC[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450545075	DG	On-Demand	Anodyne	EPHX2	24	51
CC1(C)CC[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450545075	DG	On-Demand	Anodyne	ENV	42	31
CC1(C)CC[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450545075	DG	On-Demand	Anodyne	CACNA1I	15	45
CC1(C)CC[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450545076	DG	On-Demand	Anodyne	EPHX2	24	51
CC1(C)CC[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450545076	DG	On-Demand	Anodyne	ENV	42	31
CC1(C)CC[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450545076	DG	On-Demand	Anodyne	CACNA1I	15	45
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	DRD4	36	46
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	ACHE	17	41
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	HTR4	22	41
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	SIGMAR1	25	47
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	SSTR5	54	42
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	CCR3	17	40
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	PDK1	42	37
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	MCHR1	53	46
Cn1c(C#N)ccc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545089	GH	On-Demand	Mild	CACNA1I	57	42
O=C(O)c1cc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)ccn1	ZINC000450545112	FH	On-Demand	Anodyne	FTO	0	43
O=C(O)c1cc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)ccn1	ZINC000450545112	FH	On-Demand	Anodyne	SLC6A7	0	41
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)CCN(C2CC2)C1	ZINC000450545113	DG	On-Demand	Anodyne	PDE3A	48	40
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)CCN(C2CC2)C1	ZINC000450545113	DG	On-Demand	Anodyne	PDE3B	72	40
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)CCN(C2CC2)C1	ZINC000450545113	DG	On-Demand	Anodyne	HTT	0	45
C[C@@H]1CN(c2ncnc3cc(Cl)ccc23)CCN(C2CC2)C1	ZINC000450545114	DG	On-Demand	Anodyne	PDE3A	48	40
C[C@@H]1CN(c2ncnc3cc(Cl)ccc23)CCN(C2CC2)C1	ZINC000450545114	DG	On-Demand	Anodyne	PDE3B	72	40
C[C@@H]1CN(c2ncnc3cc(Cl)ccc23)CCN(C2CC2)C1	ZINC000450545114	DG	On-Demand	Anodyne	HTT	0	45
O=C(O)CCC(=O)N1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000450545116	DF	On-Demand	Anodyne	CCKBR	46	38
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1ccc2c(c1)COC2	ZINC000450545119	CG	On-Demand	Anodyne	PTPRF	41	32
C[C@@H]1CCC[C@]1(C)C(=O)Nc1ccc2c(c1)COC2	ZINC000450545120	CG	On-Demand	Anodyne	PTPRF	41	32
C[C@H]1CCC[C@@]1(C)C(=O)Nc1ccc2c(c1)COC2	ZINC000450545121	CG	On-Demand	Anodyne	PTPRF	41	32
C[C@H]1CCC[C@]1(C)C(=O)Nc1ccc2c(c1)COC2	ZINC000450545122	CG	On-Demand	Anodyne	PTPRF	41	32
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	CACNA1H	21	41
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	DRD4	28	44
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	CHRM3	15	43
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	SIGMAR1	25	49
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	SSTR5	51	40
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	PDK1	41	36
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	CXCR3	25	41
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	MCHR1	46	42
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545126	FI	On-Demand	Mild	CACNA1I	64	41
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@H]1C(F)(F)F	ZINC000450545129	EG	On-Demand	Anodyne	RARA	41	32
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@H]1C(F)(F)F	ZINC000450545129	EG	On-Demand	Anodyne	RXRG	42	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@H]1C(F)(F)F	ZINC000450545129	EG	On-Demand	Anodyne	RXRB	45	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@H]1C(F)(F)F	ZINC000450545129	EG	On-Demand	Anodyne	L3MBTL1	0	41
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@H]1C(F)(F)F	ZINC000450545129	EG	On-Demand	Anodyne	L3MBTL3	69	41
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@H]1C(F)(F)F	ZINC000450545129	EG	On-Demand	Anodyne	MBTD1	0	40
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@@H]1C(F)(F)F	ZINC000450545130	EG	On-Demand	Anodyne	RARA	41	32
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@@H]1C(F)(F)F	ZINC000450545130	EG	On-Demand	Anodyne	RXRG	42	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@@H]1C(F)(F)F	ZINC000450545130	EG	On-Demand	Anodyne	RXRB	45	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@@H]1C(F)(F)F	ZINC000450545130	EG	On-Demand	Anodyne	L3MBTL1	0	41
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@@H]1C(F)(F)F	ZINC000450545130	EG	On-Demand	Anodyne	L3MBTL3	69	41
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2)CC[C@@H]1C(F)(F)F	ZINC000450545130	EG	On-Demand	Anodyne	MBTD1	0	40
C[C@H]1CN(c2nc3ccccc3s2)CCN(C2CC2)C1	ZINC000450545137	CG	On-Demand	Anodyne	HRH3	15	52
C[C@@H]1CN(c2nc3ccccc3s2)CCN(C2CC2)C1	ZINC000450545138	CG	On-Demand	Anodyne	HRH3	15	52
CS(=O)(=O)c1ccc(NC[C@H](NCc2ccccc2)C(F)(F)F)nc1	ZINC000450545147	FF	On-Demand	Anodyne	PTGS2	23	47
CS(=O)(=O)c1ccc(NC[C@@H](NCc2ccccc2)C(F)(F)F)nc1	ZINC000450545148	FF	On-Demand	Anodyne	PTGS2	23	47
CCn1c(NC(=O)CSC2CC2)nc2cc(F)ccc21	ZINC000450545165	CG	On-Demand	Anodyne	ITK	25	43
CO[C@@H](Cc1ccccc1)C(=O)NCc1nnc(C2CCC2)n1C	ZINC000450545181	ED	On-Demand	Anodyne	ACE	48	35
CO[C@@H](Cc1ccccc1)C(=O)NCc1nnc(C2CCC2)n1C	ZINC000450545181	ED	On-Demand	Anodyne	MME	40	36
CO[C@H](Cc1ccccc1)C(=O)NCc1nnc(C2CCC2)n1C	ZINC000450545182	ED	On-Demand	Anodyne	ACE	48	35
CO[C@H](Cc1ccccc1)C(=O)NCc1nnc(C2CCC2)n1C	ZINC000450545182	ED	On-Demand	Anodyne	MME	40	36
CSc1cccc(C(=O)Nc2cc(C)n([C@H](C)C3CC3)n2)c1	ZINC000450545210	DH	On-Demand	Anodyne	KCNK3	51	35
CSc1cccc(C(=O)Nc2cc(C)n([C@@H](C)C3CC3)n2)c1	ZINC000450545211	DH	On-Demand	Anodyne	KCNK3	51	35
CC1(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)Cc2ccccc2C1	ZINC000450545229	FG	On-Demand	Anodyne	G2YM83_BOTF4	60	37
COc1cccc(OCCC(=O)NC2(C)Cc3ccccc3C2)c1	ZINC000450545230	EG	On-Demand	Anodyne	DRD4	43	34
COc1cccc(OCCC(=O)NC2(C)Cc3ccccc3C2)c1	ZINC000450545230	EG	On-Demand	Anodyne	MTNR1A	40	39
COc1cccc(OCCC(=O)NC2(C)Cc3ccccc3C2)c1	ZINC000450545230	EG	On-Demand	Anodyne	MTNR1B	42	39
COc1cc2c(cc1Cl)CN(c1ncc(Br)cc1C#N)CC2	ZINC000450545234	GH	On-Demand	Mild	SRC	61	36
CCn1c(NC(=O)[C@H](Cc2ccccc2)OC)nc2cc(F)ccc21	ZINC000450545243	EG	On-Demand	Anodyne	CTRA_BOVIN	42	33
CCn1c(NC(=O)[C@@H](Cc2ccccc2)OC)nc2cc(F)ccc21	ZINC000450545244	EG	On-Demand	Anodyne	CTRA_BOVIN	42	33
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2F)CC[C@H]1C(F)(F)F	ZINC000450545263	EH	On-Demand	Anodyne	L3MBTL3	46	36
CC1(C)CN(C(=O)c2ccc(C(=O)O)cc2F)CC[C@@H]1C(F)(F)F	ZINC000450545264	EH	On-Demand	Anodyne	L3MBTL3	46	36
CCc1cc(N2CC[C@H](CC3CC3)C2)ccn1	ZINC000450545268	BG	On-Demand	Anodyne	HRH4	15	40
CCc1cc(N2CC[C@@H](CC3CC3)C2)ccn1	ZINC000450545269	BG	On-Demand	Anodyne	HRH4	15	40
O=C(O)CCCCC(=O)N1C[C@H]2CC[C@H]1c1ccccc12	ZINC000450545270	CG	On-Demand	Anodyne	PTGFR	46	39
Cc1ccn2ncc(C(=O)NC[C@H]3CCCCS3)c2c1	ZINC000450545283	CF	On-Demand	Anodyne	EPHB3	33	47
Cc1ccn2ncc(C(=O)NC[C@@H]3CCCCS3)c2c1	ZINC000450545284	CF	On-Demand	Anodyne	EPHB3	33	47
CCCOc1ccc(C(=O)NCc2ccc3nc(O)[nH]c3c2)c(OC)c1	ZINC000450545286	FF	On-Demand	Anodyne	U38	0	41
O=C(c1ccccc1[N+](=O)[O-])N1CCN(c2ncc(C(F)F)cn2)CC1	ZINC000450545294	FE	On-Demand	Bother	SLC6A7	0	45
Cc1ccc(F)c(CC(=O)NCc2cnc(C)nc2O)c1	ZINC000450545323	CD	On-Demand	Anodyne	P2RX7	52	44
CCc1noc(C)c1CNc1nc(N(C)C)c2ccccc2n1	ZINC000450545324	DF	On-Demand	Anodyne	ADRA2A	15	44
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]2OCCC[C@@H]12	ZINC000450545333	CD	On-Demand	Anodyne	LUXR	41	36
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]2OCCC[C@@H]21	ZINC000450545334	CD	On-Demand	Anodyne	LUXR	41	36
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]2OCCC[C@H]12	ZINC000450545335	CD	On-Demand	Anodyne	LUXR	41	36
O=C(Cc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]2OCCC[C@H]21	ZINC000450545336	CD	On-Demand	Anodyne	LUXR	41	36
COc1cccc(OCCC(=O)N[C@@H]2CCC(C)(C)C2)c1	ZINC000450545355	CG	On-Demand	Anodyne	KCNQ1	0	49
COc1cccc(OCCC(=O)N[C@@H]2CCC(C)(C)C2)c1	ZINC000450545355	CG	On-Demand	Anodyne	MTNR1A	43	45
COc1cccc(OCCC(=O)N[C@@H]2CCC(C)(C)C2)c1	ZINC000450545355	CG	On-Demand	Anodyne	MTNR1B	38	46
COc1cccc(OCCC(=O)N[C@H]2CCC(C)(C)C2)c1	ZINC000450545356	CG	On-Demand	Anodyne	KCNQ1	0	49
COc1cccc(OCCC(=O)N[C@H]2CCC(C)(C)C2)c1	ZINC000450545356	CG	On-Demand	Anodyne	MTNR1A	43	45
COc1cccc(OCCC(=O)N[C@H]2CCC(C)(C)C2)c1	ZINC000450545356	CG	On-Demand	Anodyne	MTNR1B	38	46
Cc1ncc(CNC(=O)[C@@H](C)OCCc2ccccc2)c(O)n1	ZINC000450545374	DD	On-Demand	Anodyne	AMP1_PLAFQ	40	36
Cc1ncc(CNC(=O)[C@H](C)OCCc2ccccc2)c(O)n1	ZINC000450545375	DD	On-Demand	Anodyne	AMP1_PLAFQ	40	36
CCC(CC)Oc1ccc(C(=O)NC[C@@H]2CCCCS2(=O)=O)cc1	ZINC000450545408	FF	On-Demand	Anodyne	KCNQ1	0	42
CCC(CC)Oc1ccc(C(=O)NC[C@H]2CCCCS2(=O)=O)cc1	ZINC000450545409	FF	On-Demand	Anodyne	KCNQ1	0	42
Cc1nc(NC[C@@H]2CN(Cc3ccccc3)CC23CCOCC3)ncc1[N+](=O)[O-]	ZINC000450545416	GE	On-Demand	Bother	PRKCQ	44	38
Cc1nc(NC[C@H]2CN(Cc3ccccc3)CC23CCOCC3)ncc1[N+](=O)[O-]	ZINC000450545417	GE	On-Demand	Bother	PRKCQ	44	38
CCn1c(NC(=O)C[S@@](=O)CC)nc2cc(F)ccc21	ZINC000450545430	CD	On-Demand	Anodyne	ITK	23	41
CCn1c(NC(=O)C[S@](=O)CC)nc2cc(F)ccc21	ZINC000450545431	CD	On-Demand	Anodyne	ITK	23	41
COc1ccc(-c2ccnc(N3CCC[C@](CO)(C(C)C)C3)n2)cc1	ZINC000450545432	EG	On-Demand	Anodyne	SORD	33	42
COc1ccc(-c2ccnc(N3CCC[C@@](CO)(C(C)C)C3)n2)cc1	ZINC000450545433	EG	On-Demand	Anodyne	SORD	33	42
Cc1cc(F)cc([C@]2(F)CCN(C(=O)Cc3ccc(C(=O)O)cc3)C2)c1	ZINC000450545443	FG	On-Demand	Anodyne	RXRG	48	37
Cc1cc(F)cc([C@]2(F)CCN(C(=O)Cc3ccc(C(=O)O)cc3)C2)c1	ZINC000450545443	FG	On-Demand	Anodyne	RXRB	41	37
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)Cc3ccc(C(=O)O)cc3)C2)c1	ZINC000450545444	FG	On-Demand	Anodyne	RXRG	48	37
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)Cc3ccc(C(=O)O)cc3)C2)c1	ZINC000450545444	FG	On-Demand	Anodyne	RXRB	41	37
Cn1nc(-c2ccccc2)cc1C(=O)NCc1nnc(C2CCC2)n1C	ZINC000450545447	FE	On-Demand	Anodyne	CTSV	46	32
CCOc1cc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)ccc1OCC(=O)O	ZINC000450545473	GH	On-Demand	Anodyne	PTGIR	45	35
CCOc1cc(C(=O)N2C[C@H]3CC[C@H]2c2ccccc23)ccc1OCC(=O)O	ZINC000450545473	GH	On-Demand	Anodyne	PTGDR2	23	42
Cc1ncc(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c(O)n1	ZINC000450545478	ED	On-Demand	Bother	CACNA1D	49	32
Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3)C2)c1	ZINC000450545522	EH	On-Demand	Anodyne	RARA	40	31
Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3)C2)c1	ZINC000450545522	EH	On-Demand	Anodyne	RXRG	61	40
Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3)C2)c1	ZINC000450545522	EH	On-Demand	Anodyne	RXRA	41	40
Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3)C2)c1	ZINC000450545522	EH	On-Demand	Anodyne	RXRB	59	40
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3)C2)c1	ZINC000450545523	EH	On-Demand	Anodyne	RARA	40	31
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3)C2)c1	ZINC000450545523	EH	On-Demand	Anodyne	RXRG	61	40
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3)C2)c1	ZINC000450545523	EH	On-Demand	Anodyne	RXRA	41	40
Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc(C(=O)O)cc3)C2)c1	ZINC000450545523	EH	On-Demand	Anodyne	RXRB	59	40
O=C(CC1CC(F)(F)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545551	GJ	On-Demand	Anodyne	DRD4	25	43
O=C(CC1CC(F)(F)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545551	GJ	On-Demand	Anodyne	SIGMAR1	29	54
O=C(CC1CC(F)(F)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545551	GJ	On-Demand	Anodyne	SSTR5	46	38
O=C(CC1CC(F)(F)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545551	GJ	On-Demand	Anodyne	CCR3	17	43
O=C(CC1CC(F)(F)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545551	GJ	On-Demand	Anodyne	CXCR3	27	42
O=C(CC1CC(F)(F)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545551	GJ	On-Demand	Anodyne	MCHR1	47	42
O=C(CC1CC(F)(F)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545551	GJ	On-Demand	Anodyne	CACNA1G	21	42
O=C(CC1CC(F)(F)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545551	GJ	On-Demand	Anodyne	CACNA1I	65	40
CC1(NC(=O)c2ccc(N3CCC3)nc2)Cc2ccccc2C1	ZINC000450545567	DF	On-Demand	Anodyne	HDAC1	31	44
COc1ccc(CCNc2ncc([N+](=O)[O-])c(C)n2)c(Cl)c1OC	ZINC000450545570	FE	On-Demand	Bother	PRKCQ	42	42
NS(=O)(=O)CCCCNc1ccnc2cc(F)c(Br)cc12	ZINC000450545588	GF	On-Demand	Anodyne	HRP1_PLAFA	120	38
NS(=O)(=O)CCCCNc1ccnc2cc(F)c(Br)cc12	ZINC000450545588	GF	On-Demand	Anodyne	HNMT	55	40
NS(=O)(=O)CCCCNc1ccnc2cc(F)c(Br)cc12	ZINC000450545588	GF	On-Demand	Anodyne	BOTA	15	43
Cc1cc2c(Br)ccnc2cc1NCCCCS(N)(=O)=O	ZINC000450545603	FF	On-Demand	Anodyne	HRP1_PLAFA	58	32
O=[N+]([O-])c1ccc(NCCCCCN2CCCC2)cn1	ZINC000450545604	CF	On-Demand	Bother	CHRNA7	36	45
O=[N+]([O-])c1ccc(NCCCCCN2CCCC2)cn1	ZINC000450545604	CF	On-Demand	Bother	HNMT	72	43
CC1(C)CC[C@@H](NC(=O)c2c(Cl)cc(F)cc2Br)C1	ZINC000450545606	EJ	On-Demand	Anodyne	ENV	42	33
CC1(C)CC[C@H](NC(=O)c2c(Cl)cc(F)cc2Br)C1	ZINC000450545607	EJ	On-Demand	Anodyne	ENV	42	33
Cc1cc(OCc2ccccc2)nc(N2CCC[C@H]2CF)n1	ZINC000450545608	DG	On-Demand	Anodyne	CHRNA10	40	35
Cc1cc(OCc2ccccc2)nc(N2CCC[C@@H]2CF)n1	ZINC000450545609	DG	On-Demand	Anodyne	CHRNA10	40	35
CCOc1cc(C(=O)Nc2nc3cc(F)ccc3n2CC)on1	ZINC000450545620	DF	On-Demand	Anodyne	ITK	39	40
CCOCc1nc(C)c(C(=O)NCc2ccc3nc(O)[nH]c3c2)s1	ZINC000450545656	EE	On-Demand	Anodyne	SCD1	39	42
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545657	FH	On-Demand	Mild	DRD4	36	41
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545657	FH	On-Demand	Mild	SIGMAR1	26	49
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545657	FH	On-Demand	Mild	SSTR5	47	41
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545657	FH	On-Demand	Mild	CCR3	27	41
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545657	FH	On-Demand	Mild	CXCR3	33	40
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545657	FH	On-Demand	Mild	MCHR1	42	43
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545657	FH	On-Demand	Mild	CACNA1I	42	33
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545658	FH	On-Demand	Mild	DRD4	36	41
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545658	FH	On-Demand	Mild	SIGMAR1	26	49
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545658	FH	On-Demand	Mild	SSTR5	47	41
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545658	FH	On-Demand	Mild	CCR3	27	41
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545658	FH	On-Demand	Mild	CXCR3	33	40
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545658	FH	On-Demand	Mild	MCHR1	42	43
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545658	FH	On-Demand	Mild	CACNA1I	42	33
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545659	FH	On-Demand	Mild	DRD4	36	41
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545659	FH	On-Demand	Mild	SIGMAR1	26	49
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545659	FH	On-Demand	Mild	SSTR5	47	41
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545659	FH	On-Demand	Mild	CCR3	27	41
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545659	FH	On-Demand	Mild	CXCR3	33	40
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545659	FH	On-Demand	Mild	MCHR1	42	43
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545659	FH	On-Demand	Mild	CACNA1I	42	33
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545660	FH	On-Demand	Mild	DRD4	36	41
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545660	FH	On-Demand	Mild	SIGMAR1	26	49
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545660	FH	On-Demand	Mild	SSTR5	47	41
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545660	FH	On-Demand	Mild	CCR3	27	41
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545660	FH	On-Demand	Mild	CXCR3	33	40
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545660	FH	On-Demand	Mild	MCHR1	42	43
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450545660	FH	On-Demand	Mild	CACNA1I	42	33
Cc1ccccc1C[C@H](C)N(C)C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450545679	EH	On-Demand	Anodyne	FFAR1	25	40
Cc1ccccc1C[C@@H](C)N(C)C(=O)CCc1ccc(C(=O)O)cc1	ZINC000450545680	EH	On-Demand	Anodyne	FFAR1	25	40
COC(=O)c1cccc(CCNC(=O)Cc2sccc2Br)c1	ZINC000450545684	GG	On-Demand	Anodyne	CAN2	0	41
Cc1ncc(CNC(=O)Cc2cc(Br)ccc2C)c(O)n1	ZINC000450545689	FE	On-Demand	Anodyne	P2RX7	21	41
CCOC(=O)c1ccc(N2CC(NC(=O)CC3CC(F)(F)C3)C2)nc1	ZINC000450545699	FD	On-Demand	Anodyne	P2RY12	21	42
CC(C)Oc1c(F)cc(NC(=O)CCc2nc3cnccc3[nH]2)cc1F	ZINC000450545701	FH	On-Demand	Anodyne	ENPP1	40	32
CC(=O)N[C@H](C(=O)Nc1nc2c(s1)CN(C(C)C)CC2)C(C)(C)C	ZINC000450545704	FE	On-Demand	Anodyne	APEX1	0	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc4n(n3)CCC4)C2)nc1	ZINC000450545705	FD	On-Demand	Anodyne	P2RY12	37	40
CCc1cc(CCCN2CCC(C(=O)NCCN(C)C)CC2)on1	ZINC000450545706	ED	On-Demand	Anodyne	GNAI1	0	41
CCc1cc(CCCN2CCC(C(=O)NCCN(C)C)CC2)on1	ZINC000450545706	ED	On-Demand	Anodyne	GNAI3	0	41
CCc1cc(CCCN2CCC(C(=O)NCCN(C)C)CC2)on1	ZINC000450545706	ED	On-Demand	Anodyne	GNAO1	0	41
COC1(CNc2cc(-c3ccccc3)nc3ncnn23)CCCC1	ZINC000450545710	DG	On-Demand	Anodyne	DHOD	0	42
O=C(Nc1cccc(F)c1)C1CCN(CC2=CCCCC2)CC1	ZINC000450545711	DH	On-Demand	Anodyne	F10	0	43
O=C(Nc1cccc(F)c1)C1CCN(CC2=CCCCC2)CC1	ZINC000450545711	DH	On-Demand	Anodyne	SIGMAR1	16	50
O=C(Nc1cccc(F)c1)C1CCN(CC2=CCCCC2)CC1	ZINC000450545711	DH	On-Demand	Anodyne	CCR3	72	39
O=C(Nc1cccc(F)c1)C1CCN(CC2=CCCCC2)CC1	ZINC000450545711	DH	On-Demand	Anodyne	EPHX2	21	41
O=C(Nc1cccc(F)c1)C1CCN(CC2=CCCCC2)CC1	ZINC000450545711	DH	On-Demand	Anodyne	CXCR3	18	58
O=C(Nc1cccc(F)c1)C1CCN(CC2=CCCCC2)CC1	ZINC000450545711	DH	On-Demand	Anodyne	MCHR1	37	40
O=C(Nc1cccc(F)c1)C1CCN(CC2=CCCCC2)CC1	ZINC000450545711	DH	On-Demand	Anodyne	CACNA1G	39	42
CC(C)N1CCc2nc(NC(=O)[C@@H]3C[C@@]3(C)c3ccccc3)sc2C1	ZINC000450545713	FH	On-Demand	Anodyne	APEX1	0	41
CCOC(=O)C[C@H](C)N(C)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450545714	DE	On-Demand	Anodyne	CAPNS1	45	35
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450545715	DE	On-Demand	Anodyne	CAPNS1	45	35
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450545716	DE	On-Demand	Anodyne	CAPNS1	45	35
CCOC(=O)C[C@H](C)N(C)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450545717	DE	On-Demand	Anodyne	CAPNS1	45	35
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@@H]4COCCO4)C3)n2)c1	ZINC000450545722	EE	On-Demand	Anodyne	GRM5	29	51
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@@H]4COCCO4)C3)n2)c1	ZINC000450545722	EE	On-Demand	Anodyne	ETHR	37	49
Fc1cccc(-c2noc([C@H]3CCCN(C[C@@H]4COCCO4)C3)n2)c1	ZINC000450545723	EE	On-Demand	Anodyne	GRM5	29	51
Fc1cccc(-c2noc([C@H]3CCCN(C[C@@H]4COCCO4)C3)n2)c1	ZINC000450545723	EE	On-Demand	Anodyne	ETHR	37	49
Fc1cccc(-c2noc([C@H]3CCCN(C[C@H]4COCCO4)C3)n2)c1	ZINC000450545724	EE	On-Demand	Anodyne	GRM5	29	51
Fc1cccc(-c2noc([C@H]3CCCN(C[C@H]4COCCO4)C3)n2)c1	ZINC000450545724	EE	On-Demand	Anodyne	ETHR	37	49
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@H]4COCCO4)C3)n2)c1	ZINC000450545725	EE	On-Demand	Anodyne	GRM5	29	51
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@H]4COCCO4)C3)n2)c1	ZINC000450545725	EE	On-Demand	Anodyne	ETHR	37	49
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc(C#N)[nH]c3C)C2)nc1	ZINC000450545726	FD	On-Demand	Mild	P2RY12	47	39
CCOC(=O)C[C@@H](C)N(C)C(=O)CCc1nc2cnccc2[nH]1	ZINC000450545750	DD	On-Demand	Anodyne	CACNA1G	27	40
CCOC(=O)C[C@H](C)N(C)C(=O)CCc1nc2cnccc2[nH]1	ZINC000450545751	DD	On-Demand	Anodyne	CACNA1G	27	40
COC1(CNc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CCCC1	ZINC000450545757	FE	On-Demand	Bother	BCL2L1	47	38
COC1(CNc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CCCC1	ZINC000450545757	FE	On-Demand	Bother	TAAR1	19	40
C[C@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)CCN(C2CC2)C1	ZINC000450545758	DG	On-Demand	Mild	AR	56	53
C[C@@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)CCN(C2CC2)C1	ZINC000450545759	DG	On-Demand	Mild	AR	56	53
C[C@@H]1CN(c2ccnc(N3CCCCC3)n2)CCN(C2CC2)C1	ZINC000450545762	DE	On-Demand	Anodyne	SORD	53	40
C[C@H]1CN(c2ccnc(N3CCCCC3)n2)CCN(C2CC2)C1	ZINC000450545763	DE	On-Demand	Anodyne	SORD	53	40
CCN(CC(=O)N(C)C[C@H](O)CO)Cc1ccccc1Cl	ZINC000450545768	DC	On-Demand	Anodyne	DXS	0	40
Cc1ccc(F)c(CC(=O)Nc2nc3c(s2)CN(C(C)C)CC3)c1	ZINC000450545773	EH	On-Demand	Anodyne	SLC27A1	37	43
O=C1CC[C@@H](CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CCN1	ZINC000450545776	FF	On-Demand	Anodyne	GRM5	30	49
O=C1CC[C@@H](CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CCN1	ZINC000450545776	FF	On-Demand	Anodyne	ETHR	33	46
O=C1CC[C@H](CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CCN1	ZINC000450545777	FF	On-Demand	Anodyne	GRM5	30	49
O=C1CC[C@H](CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CCN1	ZINC000450545777	FF	On-Demand	Anodyne	ETHR	33	46
O=C1CC[C@H](CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CCN1	ZINC000450545778	FF	On-Demand	Anodyne	GRM5	30	49
O=C1CC[C@H](CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CCN1	ZINC000450545778	FF	On-Demand	Anodyne	ETHR	33	46
O=C1CC[C@@H](CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CCN1	ZINC000450545779	FF	On-Demand	Anodyne	GRM5	30	49
O=C1CC[C@@H](CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CCN1	ZINC000450545779	FF	On-Demand	Anodyne	ETHR	33	46
O=C(Nc1cccc(F)c1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450545780	FI	On-Demand	Anodyne	CCR3	53	41
O=C(Nc1cccc(F)c1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450545780	FI	On-Demand	Anodyne	EPHX2	25	43
O=C(Nc1cccc(F)c1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450545780	FI	On-Demand	Anodyne	CACNA1G	37	42
O=C(Nc1cccc(F)c1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450545780	FI	On-Demand	Anodyne	KCNK3	15	41
O=C(Nc1cccc(F)c1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450545781	FI	On-Demand	Anodyne	CCR3	53	41
O=C(Nc1cccc(F)c1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450545781	FI	On-Demand	Anodyne	EPHX2	25	43
O=C(Nc1cccc(F)c1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450545781	FI	On-Demand	Anodyne	CACNA1G	37	42
O=C(Nc1cccc(F)c1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450545781	FI	On-Demand	Anodyne	KCNK3	15	41
CC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	ZINC000450545782	FI	On-Demand	Anodyne	DRD2	23	47
CC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	ZINC000450545782	FI	On-Demand	Anodyne	DRD4	65	47
CC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	ZINC000450545782	FI	On-Demand	Anodyne	ACHE	37	47
CC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	ZINC000450545782	FI	On-Demand	Anodyne	DRD3	23	47
CC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	ZINC000450545782	FI	On-Demand	Anodyne	LTA4H	23	40
CC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	ZINC000450545782	FI	On-Demand	Anodyne	SIGMAR1	47	44
CC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	ZINC000450545782	FI	On-Demand	Anodyne	AKT2	117	51
CC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1	ZINC000450545782	FI	On-Demand	Anodyne	AKT1	49	51
CCc1cccc(C(=O)N[C@@H](CCOC)Cc2ccco2)n1	ZINC000450545784	DF	On-Demand	Anodyne	PDE5A	22	42
CCc1cccc(C(=O)N[C@H](CCOC)Cc2ccco2)n1	ZINC000450545785	DF	On-Demand	Anodyne	PDE5A	22	42
Cc1nnc2c3ccccc3c(N3CCN(C4CC4)C[C@@H](C)C3)nn12	ZINC000450545791	EF	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3CCN(C4CC4)C[C@@H](C)C3)nn12	ZINC000450545791	EF	On-Demand	Anodyne	BRD9	54	34
Cc1nnc2c3ccccc3c(N3CCN(C4CC4)C[C@H](C)C3)nn12	ZINC000450545792	EF	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3CCN(C4CC4)C[C@H](C)C3)nn12	ZINC000450545792	EF	On-Demand	Anodyne	BRD9	54	34
COc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)nccc12	ZINC000450545794	DG	On-Demand	Anodyne	PDE3A	45	36
COc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)nccc12	ZINC000450545794	DG	On-Demand	Anodyne	EBP	30	43
COc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)nccc12	ZINC000450545794	DG	On-Demand	Anodyne	PDE3B	68	36
COc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)nccc12	ZINC000450545795	DG	On-Demand	Anodyne	PDE3A	45	36
COc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)nccc12	ZINC000450545795	DG	On-Demand	Anodyne	EBP	30	43
COc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)nccc12	ZINC000450545795	DG	On-Demand	Anodyne	PDE3B	68	36
COc1ccc2nc(N3CCN(C4CC4)C[C@@H](C)C3)c(C)nc2c1	ZINC000450545818	EF	On-Demand	Anodyne	EBP	27	40
COc1ccc2nc(N3CCN(C4CC4)C[C@H](C)C3)c(C)nc2c1	ZINC000450545819	EF	On-Demand	Anodyne	EBP	27	40
COc1n[nH]c(NC(=O)[C@@](C)(Cc2ccc(OC)c(OC)c2)NC(C)=O)n1	ZINC000450545820	GC	On-Demand	Anodyne	ENPP1	54	30
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccnc(OC(F)F)c3)C2)nc1	ZINC000450545821	GD	On-Demand	Anodyne	P2RY12	20	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccnc(OC(F)F)c3)C2)nc1	ZINC000450545821	GD	On-Demand	Anodyne	SSTR5	40	37
CNC(=O)c1cc([N+](=O)[O-])ccc1NCC1(OC)CCCC1	ZINC000450545829	DE	On-Demand	Bother	NMBR	40	30
C[C@@H]1Cc2cccc(C(=O)NCCCc3nc(-c4ccc(F)cc4)no3)c2O1	ZINC000450545830	GH	On-Demand	Anodyne	SPHK1	39	41
C[C@H]1Cc2cccc(C(=O)NCCCc3nc(-c4ccc(F)cc4)no3)c2O1	ZINC000450545831	GH	On-Demand	Anodyne	SPHK1	39	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3C[C@H]3CC)C2)nc1	ZINC000450545832	DD	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc(C)cs3)C2)nc1	ZINC000450545842	EE	On-Demand	Anodyne	P2RY12	24	44
CC(C)c1ncsc1C(=O)Nc1nc2c(s1)CN(C(C)C)CC2	ZINC000450545844	FH	On-Demand	Anodyne	APEX1	0	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccsn3)C2)nc1	ZINC000450545849	ED	On-Demand	Anodyne	P2RY12	20	40
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3ccc(O)c(OC)c3)C2)nc1	ZINC000450545850	GD	On-Demand	Anodyne	P2RY12	22	40
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3ccc(O)c(OC)c3)C2)nc1	ZINC000450545850	GD	On-Demand	Anodyne	TRPV1	0	43
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3ccc(O)c(OC)c3)C2)nc1	ZINC000450545850	GD	On-Demand	Anodyne	SSTR5	55	41
CC(=O)[C@](C)(O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450545854	EE	On-Demand	Anodyne	GRM5	32	56
CC(=O)[C@](C)(O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450545854	EE	On-Demand	Anodyne	ETHR	61	54
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450545855	EE	On-Demand	Anodyne	GRM5	32	56
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450545855	EE	On-Demand	Anodyne	ETHR	61	54
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450545856	EE	On-Demand	Anodyne	GRM5	32	56
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450545856	EE	On-Demand	Anodyne	ETHR	61	54
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450545857	EE	On-Demand	Anodyne	GRM5	32	56
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450545857	EE	On-Demand	Anodyne	ETHR	61	54
COc1ccc(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)cc1S(C)(=O)=O	ZINC000450545858	GG	On-Demand	Anodyne	COLA	96	42
COc1ccc(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)cc1S(C)(=O)=O	ZINC000450545858	GG	On-Demand	Anodyne	CPT1A	91	42
COc1ccc(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)cc1S(C)(=O)=O	ZINC000450545858	GG	On-Demand	Anodyne	CPT2	52	41
COc1ccc(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)cc1S(C)(=O)=O	ZINC000450545858	GG	On-Demand	Anodyne	CPT1B	78	41
COc1ccc(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)cc1S(C)(=O)=O	ZINC000450545858	GG	On-Demand	Anodyne	TAAR1	23	40
COc1ccc(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)cc1S(C)(=O)=O	ZINC000450545858	GG	On-Demand	Anodyne	KCNK3	45	34
COc1ccc(OC(F)(F)F)c(C(=O)NCCCC#N)c1	ZINC000450545867	DF	On-Demand	Mild	TRPV1	0	43
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1cn(CC2CC2)nn1	ZINC000450545868	FE	On-Demand	Anodyne	SPHK1	40	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3cccc(SC)c3)C2)nc1	ZINC000450545869	FF	On-Demand	Anodyne	P2RY12	23	42
COC1(CNc2ncccc2C(=O)N2CCc3ccccc32)CCCC1	ZINC000450545882	FH	On-Demand	Anodyne	AVPR2	51	39
COC1(CNc2ncccc2C(=O)N2CCc3ccccc32)CCCC1	ZINC000450545882	FH	On-Demand	Anodyne	HCN1	49	31
COC1(CNc2ncccc2C(=O)N2CCc3ccccc32)CCCC1	ZINC000450545882	FH	On-Demand	Anodyne	HCN4	47	31
COC(=O)c1csc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)n1	ZINC000450545894	GG	On-Demand	Anodyne	AKT2	54	43
COC(=O)c1csc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)n1	ZINC000450545894	GG	On-Demand	Anodyne	AKT1	32	43
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450545895	EG	On-Demand	Anodyne	TSPO	35	47
CCOC(=O)C[C@H](C)N(C)C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450545896	EG	On-Demand	Anodyne	TSPO	35	47
CN(C)CCNC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450545909	EE	On-Demand	Anodyne	SLC6A1	41	34
CN(C)CCNC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450545909	EE	On-Demand	Anodyne	CACNA1G	41	39
CN(C)CCNC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450545910	EE	On-Demand	Anodyne	SLC6A1	41	34
CN(C)CCNC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450545910	EE	On-Demand	Anodyne	CACNA1G	41	39
C[C@H]1CN(c2cc(Cl)ccc2C#N)CCN(C2CC2)C1	ZINC000450545915	CG	On-Demand	Mild	NOS2	18	40
C[C@H]1CN(c2cc(Cl)ccc2C#N)CCN(C2CC2)C1	ZINC000450545915	CG	On-Demand	Mild	NOS3	17	40
C[C@@H]1CN(c2cc(Cl)ccc2C#N)CCN(C2CC2)C1	ZINC000450545916	CG	On-Demand	Mild	NOS2	18	40
C[C@@H]1CN(c2cc(Cl)ccc2C#N)CCN(C2CC2)C1	ZINC000450545916	CG	On-Demand	Mild	NOS3	17	40
Cc1ccc(C(=O)Nc2nc3c(s2)CN(C(C)C)CC3)c(Cl)c1Cl	ZINC000450545923	GJ	On-Demand	Anodyne	F10	17	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCCC#N	ZINC000450545930	CD	On-Demand	Mild	PAPA1_CARPA	52	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCCC#N	ZINC000450545930	CD	On-Demand	Mild	CTSL	30	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCCC#N	ZINC000450545930	CD	On-Demand	Mild	CTSS	44	52
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCCC#N	ZINC000450545930	CD	On-Demand	Mild	CAPN1	23	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCCC#N	ZINC000450545930	CD	On-Demand	Mild	Q9NAW4_PLAFA	24	41
CC(C)C[C@@H]1C[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450545931	EH	On-Demand	Anodyne	SPHK1	44	45
CCOC(=O)c1ccc(N2CC(NC(=O)c3cnn4c3CCC4)C2)nc1	ZINC000450545932	FD	On-Demand	Anodyne	HPGDS	30	41
CC[C@@H]1C[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450545940	DF	On-Demand	Anodyne	KCNQ1	0	40
CC[C@@H]1C[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450545940	DF	On-Demand	Anodyne	SPHK1	48	46
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	HTR1A	23	63
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	DRD2	42	59
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	DRD1	20	47
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	DRD4	32	49
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	HTR1D	18	44
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	HTR1B	16	44
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	HTR2A	55	53
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	HTR2C	35	63
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	ADRA1A	20	41
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	HRH1	15	49
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	ADRA1B	19	46
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	DRD3	20	49
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	F10	0	44
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	HTR7	33	44
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	SIGMAR1	23	59
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	CCR3	95	46
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	CHRNA7	24	43
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	SLC18A3	17	45
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	HTR3B	0	47
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	EPHX2	34	47
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	PLD2	49	37
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	MCHR1	50	61
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	CACNA1G	48	44
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450545941	GI	On-Demand	Anodyne	AP2S1	0	44
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(C)[C@@H]1C	ZINC000450545952	DG	On-Demand	Anodyne	CACNA1B	44	32
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(C)[C@@H]1C	ZINC000450545952	DG	On-Demand	Anodyne	CCR2	35	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(C)[C@H]1C	ZINC000450545953	DG	On-Demand	Anodyne	CACNA1B	44	32
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(C)[C@H]1C	ZINC000450545953	DG	On-Demand	Anodyne	CCR2	35	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(C)[C@@H]1C	ZINC000450545954	DG	On-Demand	Anodyne	CACNA1B	44	32
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(C)[C@@H]1C	ZINC000450545954	DG	On-Demand	Anodyne	CCR2	35	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(C)[C@H]1C	ZINC000450545955	DG	On-Demand	Anodyne	CACNA1B	44	32
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(C)[C@H]1C	ZINC000450545955	DG	On-Demand	Anodyne	CCR2	35	43
CCOC(=O)C[C@@H](C)N(C)C(=O)C[C@@H]1COc2ccccc2O1	ZINC000450545958	DE	On-Demand	Anodyne	ADRA1B	15	42
CCOC(=O)C[C@@H](C)N(C)C(=O)C[C@@H]1COc2ccccc2O1	ZINC000450545958	DE	On-Demand	Anodyne	ADRA2B	17	42
CCOC(=O)C[C@@H](C)N(C)C(=O)C[C@H]1COc2ccccc2O1	ZINC000450545959	DE	On-Demand	Anodyne	ADRA1B	15	42
CCOC(=O)C[C@@H](C)N(C)C(=O)C[C@H]1COc2ccccc2O1	ZINC000450545959	DE	On-Demand	Anodyne	ADRA2B	17	42
CCOC(=O)C[C@H](C)N(C)C(=O)C[C@@H]1COc2ccccc2O1	ZINC000450545960	DE	On-Demand	Anodyne	ADRA1B	15	42
CCOC(=O)C[C@H](C)N(C)C(=O)C[C@@H]1COc2ccccc2O1	ZINC000450545960	DE	On-Demand	Anodyne	ADRA2B	17	42
CCOC(=O)C[C@H](C)N(C)C(=O)C[C@H]1COc2ccccc2O1	ZINC000450545961	DE	On-Demand	Anodyne	ADRA1B	15	42
CCOC(=O)C[C@H](C)N(C)C(=O)C[C@H]1COc2ccccc2O1	ZINC000450545961	DE	On-Demand	Anodyne	ADRA2B	17	42
CC(C)Oc1c(F)cc(NC(=O)[C@@H](C)Oc2ccccn2)cc1F	ZINC000450545962	EH	On-Demand	Anodyne	GRM4	31	40
CC(C)Oc1c(F)cc(NC(=O)[C@@H](C)Oc2ccccn2)cc1F	ZINC000450545962	EH	On-Demand	Anodyne	IMDH_CRYPV	35	43
CC(C)Oc1c(F)cc(NC(=O)[C@H](C)Oc2ccccn2)cc1F	ZINC000450545963	EH	On-Demand	Anodyne	GRM4	31	40
CC(C)Oc1c(F)cc(NC(=O)[C@H](C)Oc2ccccn2)cc1F	ZINC000450545963	EH	On-Demand	Anodyne	IMDH_CRYPV	35	43
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cccc(CC)n1	ZINC000450545979	CE	On-Demand	Anodyne	PDE5A	0	42
CCOC(=O)C[C@H](C)N(C)C(=O)c1cccc(CC)n1	ZINC000450545980	CE	On-Demand	Anodyne	PDE5A	0	42
CCc1cccc(C(=O)Nc2nc(OC)n[nH]2)n1	ZINC000450545981	BD	On-Demand	Anodyne	PDE5A	24	42
N#CC1(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)CCC1	ZINC000450545984	EH	On-Demand	Mild	GRM5	24	56
N#CC1(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)CCC1	ZINC000450545985	EH	On-Demand	Mild	GRM5	24	56
C[C@@H]1[C@@H](NC(=O)COc2ccc(C#N)c(Br)c2)CCCN1C	ZINC000450545993	FE	On-Demand	Mild	CHRNA10	51	37
C[C@@H]1[C@H](NC(=O)COc2ccc(C#N)c(Br)c2)CCCN1C	ZINC000450545994	FE	On-Demand	Mild	CHRNA10	51	37
C[C@H]1[C@@H](NC(=O)COc2ccc(C#N)c(Br)c2)CCCN1C	ZINC000450545995	FE	On-Demand	Mild	CHRNA10	51	37
C[C@H]1[C@H](NC(=O)COc2ccc(C#N)c(Br)c2)CCCN1C	ZINC000450545996	FE	On-Demand	Mild	CHRNA10	51	37
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc(C)c(C(N)=O)cn3)C2)nc1	ZINC000450546000	GC	On-Demand	Anodyne	P2RY12	24	41
CCOC(=O)c1ccc(N2CC(NC(=O)c3cccc(C(F)(F)F)n3)C2)nc1	ZINC000450546002	GE	On-Demand	Anodyne	P2RY12	43	43
COCC[C@H](Cc1ccco1)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450546009	EE	On-Demand	Anodyne	NPPA	40	32
COCC[C@@H](Cc1ccco1)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450546010	EE	On-Demand	Anodyne	NPPA	40	32
C[C@H]1CN(c2ccc(C(F)(F)F)cc2C#N)CCN(C2CC2)C1	ZINC000450546011	DG	On-Demand	Mild	LIPG	51	35
C[C@@H]1CN(c2ccc(C(F)(F)F)cc2C#N)CCN(C2CC2)C1	ZINC000450546012	DG	On-Demand	Mild	LIPG	51	35
COC1(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CCCC1	ZINC000450546013	FE	On-Demand	Bother	BCL2L1	54	39
COC1(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CCCC1	ZINC000450546013	FE	On-Demand	Bother	BCL2	43	39
COC(=O)c1coc(CN(c2ccc(Cl)cc2)C(C)C)n1	ZINC000450546015	DH	On-Demand	Anodyne	TAAR1	17	40
Fc1ccc(-c2noc([C@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n2)cc1	ZINC000450546019	FH	On-Demand	Anodyne	GRM5	23	55
Fc1ccc(-c2noc([C@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n2)cc1	ZINC000450546020	FH	On-Demand	Anodyne	GRM5	23	55
Fc1ccc(-c2noc([C@@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n2)cc1	ZINC000450546021	FH	On-Demand	Anodyne	GRM5	23	55
Fc1ccc(-c2noc([C@@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n2)cc1	ZINC000450546022	FH	On-Demand	Anodyne	GRM5	23	55
CCOC(=O)C[C@@H](C)N(C)C(=O)CCCC(C)C	ZINC000450546023	CF	On-Demand	Anodyne	CHRNA4	0	43
CCOC(=O)C[C@H](C)N(C)C(=O)CCCC(C)C	ZINC000450546024	CF	On-Demand	Anodyne	CHRNA4	0	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546027	GH	On-Demand	Anodyne	AKT2	48	39
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546028	GH	On-Demand	Anodyne	AKT2	48	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546029	GH	On-Demand	Anodyne	AKT2	48	39
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546030	GH	On-Demand	Anodyne	AKT2	48	39
COC(=O)c1csc(CN(c2ccc(Cl)cc2)C(C)C)n1	ZINC000450546034	DH	On-Demand	Anodyne	TAAR1	17	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3CC34CCSCC4)C2)nc1	ZINC000450546037	GE	On-Demand	Anodyne	P2RY12	16	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H]3CC34CCSCC4)C2)nc1	ZINC000450546038	GE	On-Demand	Anodyne	P2RY12	16	40
COCC[C@H](Cc1ccco1)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450546040	DE	On-Demand	Anodyne	NPPA	40	31
COCC[C@@H](Cc1ccco1)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450546041	DE	On-Demand	Anodyne	NPPA	40	31
CCOC(=O)C[C@@H](C)N(C)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450546042	EE	On-Demand	Anodyne	PDE4D	16	46
CCOC(=O)C[C@H](C)N(C)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450546043	EE	On-Demand	Anodyne	PDE4D	16	46
CCOC(=O)C[C@H](C)N(C)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450546044	EE	On-Demand	Anodyne	PDE4D	16	46
CCOC(=O)C[C@@H](C)N(C)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450546045	EE	On-Demand	Anodyne	PDE4D	16	46
COCC[C@@H](Cc1ccco1)NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450546047	EF	On-Demand	Anodyne	NPPA	41	33
COCC[C@H](Cc1ccco1)NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450546048	EF	On-Demand	Anodyne	NPPA	41	33
CCOC(=O)c1ccc(N2CC(NC(=O)c3cncc(Cl)c3)C2)nc1	ZINC000450546053	FD	On-Demand	Anodyne	P2RY12	31	45
CCOC(=O)c1ccc(N2CC(NC(=O)c3cncc(Cl)c3)C2)nc1	ZINC000450546053	FD	On-Demand	Anodyne	SSTR5	49	45
COCC[C@H](Cc1ccco1)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450546055	DG	On-Demand	Anodyne	NPPA	46	36
COCC[C@@H](Cc1ccco1)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450546056	DG	On-Demand	Anodyne	NPPA	46	36
C[C@H]1CN(c2ncc(C#N)cc2Cl)CCN(C2CC2)C1	ZINC000450546057	CF	On-Demand	Mild	CXCR3	31	47
C[C@@H]1CN(c2ncc(C#N)cc2Cl)CCN(C2CC2)C1	ZINC000450546058	CF	On-Demand	Mild	CXCR3	31	47
Fc1ccc(-c2noc([C@@H]3CCCN(C[C@@H]4COCCO4)C3)n2)cc1	ZINC000450546066	EE	On-Demand	Anodyne	GRM5	24	57
Fc1ccc(-c2noc([C@H]3CCCN(C[C@@H]4COCCO4)C3)n2)cc1	ZINC000450546067	EE	On-Demand	Anodyne	GRM5	24	57
Fc1ccc(-c2noc([C@H]3CCCN(C[C@H]4COCCO4)C3)n2)cc1	ZINC000450546068	EE	On-Demand	Anodyne	GRM5	24	57
Fc1ccc(-c2noc([C@@H]3CCCN(C[C@H]4COCCO4)C3)n2)cc1	ZINC000450546069	EE	On-Demand	Anodyne	GRM5	24	57
COC(=O)C1(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)CC1	ZINC000450546070	GG	On-Demand	Anodyne	EGFR	15	40
COC(=O)C1(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)CC1	ZINC000450546070	GG	On-Demand	Anodyne	INHA	16	44
COC(=O)C1(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)CC1	ZINC000450546070	GG	On-Demand	Anodyne	CCKAR	0	40
COC(=O)C1(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)CC1	ZINC000450546070	GG	On-Demand	Anodyne	LIMK2	18	46
COc1ccc(OC(F)(F)F)c(C(=O)Nc2nc(OC)n[nH]2)c1	ZINC000450546078	ED	On-Demand	Anodyne	KCNK3	25	42
COc1ccc(OC(F)(F)F)c(C(=O)Nc2nc(OC)n[nH]2)c1	ZINC000450546078	ED	On-Demand	Anodyne	KCNK9	29	42
C[C@@H]1CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CCN(C2CC2)C1	ZINC000450546081	GE	On-Demand	Anodyne	CXCR3	50	44
C[C@H]1CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CCN(C2CC2)C1	ZINC000450546082	GE	On-Demand	Anodyne	CXCR3	50	44
O[C@H](Cc1ccccc1)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546083	FG	On-Demand	Anodyne	VACHT_TETCF	0	52
O[C@H](Cc1ccccc1)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546083	FG	On-Demand	Anodyne	AKT2	49	42
O[C@H](Cc1ccccc1)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546083	FG	On-Demand	Anodyne	AKT1	26	42
O[C@H](Cc1ccccc1)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546083	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
FC1(F)CC[C@H](CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)C1	ZINC000450546084	EI	On-Demand	Anodyne	AKT2	47	40
FC1(F)CC[C@H](CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)C1	ZINC000450546084	EI	On-Demand	Anodyne	AKT1	27	40
FC1(F)CC[C@@H](CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)C1	ZINC000450546085	EI	On-Demand	Anodyne	AKT2	47	40
FC1(F)CC[C@@H](CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)C1	ZINC000450546085	EI	On-Demand	Anodyne	AKT1	27	40
Cc1nc(C2CC2)ccc1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546093	GH	On-Demand	Anodyne	SPHK1	39	41
C[C@@H](O)CCN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546096	DE	On-Demand	Anodyne	AKT2	69	43
C[C@@H](O)CCN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546096	DE	On-Demand	Anodyne	AKT1	26	43
C[C@H](O)CCN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546097	DE	On-Demand	Anodyne	AKT2	69	43
C[C@H](O)CCN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450546097	DE	On-Demand	Anodyne	AKT1	26	43
CC[C@H](CC(F)(F)F)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546117	FH	On-Demand	Anodyne	SPHK1	40	40
CC[C@@H](CC(F)(F)F)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546118	FH	On-Demand	Anodyne	SPHK1	40	40
O=C(CC1CC(F)(F)C1)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546125	FG	On-Demand	Anodyne	SPHK1	40	40
Fc1cccc(-c2noc([C@H]3CCCN(CCc4cscn4)C3)n2)c1	ZINC000450546130	FH	On-Demand	Anodyne	GRM5	28	49
Fc1cccc(-c2noc([C@H]3CCCN(CCc4cscn4)C3)n2)c1	ZINC000450546130	FH	On-Demand	Anodyne	ETHR	33	45
Fc1cccc(-c2noc([C@@H]3CCCN(CCc4cscn4)C3)n2)c1	ZINC000450546131	FH	On-Demand	Anodyne	GRM5	28	49
Fc1cccc(-c2noc([C@@H]3CCCN(CCc4cscn4)C3)n2)c1	ZINC000450546131	FH	On-Demand	Anodyne	ETHR	33	45
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@H](C)OCCc1ccccc1	ZINC000450546136	DE	On-Demand	Anodyne	ALOX5	15	43
CCOC(=O)C[C@H](C)N(C)C(=O)[C@H](C)OCCc1ccccc1	ZINC000450546137	DE	On-Demand	Anodyne	ALOX5	15	43
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450546138	DE	On-Demand	Anodyne	ALOX5	15	43
CCOC(=O)C[C@H](C)N(C)C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450546139	DE	On-Demand	Anodyne	ALOX5	15	43
CCOC(=O)c1ccc(N2CC(NC(=O)CCCn3nc(C)nc3C)C2)nc1	ZINC000450546140	GD	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)C[C@H](C)N(C)C(=O)CCc1ccc2ccccc2c1O	ZINC000450546141	EG	On-Demand	Anodyne	ALOX5	16	71
CCOC(=O)C[C@@H](C)N(C)C(=O)CCc1ccc2ccccc2c1O	ZINC000450546142	EG	On-Demand	Anodyne	ALOX5	16	71
Nc1ncccc1CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546160	FG	On-Demand	Anodyne	GRM5	28	49
Nc1ncccc1CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546160	FG	On-Demand	Anodyne	ETHR	23	46
Nc1ncccc1CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546161	FG	On-Demand	Anodyne	GRM5	28	49
Nc1ncccc1CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546161	FG	On-Demand	Anodyne	ETHR	23	46
CCOC(=O)c1ccc(N2CC(NC(=O)Cn3ccc(C)n3)C2)nc1	ZINC000450546162	EC	On-Demand	Anodyne	P2RY12	19	40
CC(F)(F)C(C)(C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546168	FH	On-Demand	Anodyne	SPHK1	39	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccc(C(C)(F)F)nc3)C2)nc1	ZINC000450546169	GE	On-Demand	Anodyne	P2RY12	24	43
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccc(C(C)(F)F)nc3)C2)nc1	ZINC000450546169	GE	On-Demand	Anodyne	HDAC1	0	41
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccc(C(C)(F)F)nc3)C2)nc1	ZINC000450546169	GE	On-Demand	Anodyne	HPGDS	35	46
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450546170	GH	On-Demand	Anodyne	LTA4H	32	40
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450546170	GH	On-Demand	Anodyne	CCR5	21	41
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450546170	GH	On-Demand	Anodyne	GHSR	18	44
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450546171	GH	On-Demand	Anodyne	LTA4H	32	40
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450546171	GH	On-Demand	Anodyne	CCR5	21	41
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450546171	GH	On-Demand	Anodyne	GHSR	18	44
CCOC(=O)c1ccc(N2CC(NC(=O)CC3(O)CCC3)C2)nc1	ZINC000450546172	EC	On-Demand	Anodyne	P2RY12	23	43
N#CCCCNC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450546178	DE	On-Demand	Mild	TRPV4	41	31
COCC[C@H](Cc1ccco1)NC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450546184	ED	On-Demand	Anodyne	NPPA	40	31
COCC[C@@H](Cc1ccco1)NC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450546185	ED	On-Demand	Anodyne	NPPA	40	31
COC1(CNc2cc(N3CCCCC3)ncn2)CCCC1	ZINC000450546186	CF	On-Demand	Anodyne	GALR2	42	33
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546190	FH	On-Demand	Anodyne	F10	0	42
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546190	FH	On-Demand	Anodyne	SIGMAR1	24	42
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546190	FH	On-Demand	Anodyne	CCKAR	22	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546190	FH	On-Demand	Anodyne	CCR3	64	42
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546190	FH	On-Demand	Anodyne	F11	41	36
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546190	FH	On-Demand	Anodyne	EPHX2	23	42
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546190	FH	On-Demand	Anodyne	CACNA1G	37	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546191	FH	On-Demand	Anodyne	F10	0	42
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546191	FH	On-Demand	Anodyne	SIGMAR1	24	42
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546191	FH	On-Demand	Anodyne	CCKAR	22	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546191	FH	On-Demand	Anodyne	CCR3	64	42
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546191	FH	On-Demand	Anodyne	F11	41	36
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546191	FH	On-Demand	Anodyne	EPHX2	23	42
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546191	FH	On-Demand	Anodyne	CACNA1G	37	41
CCC[C@H](O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546201	FG	On-Demand	Anodyne	EGFR	24	40
CCC[C@H](O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546201	FG	On-Demand	Anodyne	INHA	17	47
CCC[C@H](O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546201	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
CCC[C@H](O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546201	FG	On-Demand	Anodyne	LIMK2	18	46
CCC[C@@H](O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546202	FG	On-Demand	Anodyne	EGFR	24	40
CCC[C@@H](O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546202	FG	On-Demand	Anodyne	INHA	17	47
CCC[C@@H](O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546202	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
CCC[C@@H](O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546202	FG	On-Demand	Anodyne	LIMK2	18	46
COCC[C@@H](Cc1ccco1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450546214	FG	On-Demand	Anodyne	INHA	45	34
COCC[C@@H](Cc1ccco1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450546214	FG	On-Demand	Anodyne	P2RY12	65	33
COCC[C@@H](Cc1ccco1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450546214	FG	On-Demand	Anodyne	CTSV	50	35
COCC[C@@H](Cc1ccco1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450546214	FG	On-Demand	Anodyne	NPPA	48	39
COCC[C@H](Cc1ccco1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450546215	FG	On-Demand	Anodyne	INHA	45	34
COCC[C@H](Cc1ccco1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450546215	FG	On-Demand	Anodyne	P2RY12	65	33
COCC[C@H](Cc1ccco1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450546215	FG	On-Demand	Anodyne	CTSV	50	35
COCC[C@H](Cc1ccco1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450546215	FG	On-Demand	Anodyne	NPPA	48	39
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc4c([nH]3)CCCC4)C2)nc1	ZINC000450546219	FE	On-Demand	Anodyne	P2RY12	19	41
CSc1cccc(C(=O)NCCCC#N)c1	ZINC000450546230	BE	On-Demand	Mild	DRD4	43	33
COCC[C@H](Cc1ccco1)NC(=O)C1(CF)CCOCC1	ZINC000450546231	DE	On-Demand	Anodyne	NPPA	41	33
COCC[C@@H](Cc1ccco1)NC(=O)C1(CF)CCOCC1	ZINC000450546232	DE	On-Demand	Anodyne	NPPA	41	33
Cc1cccc(CNC(=O)c2ccc(C(=O)N(C)C[C@H](O)CO)cc2)c1	ZINC000450546233	FD	On-Demand	Anodyne	LIMK2	27	41
Cc1cc(C(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)nn1C(C)C	ZINC000450546236	FI	On-Demand	Anodyne	CTSA	47	37
Cc1cc(C(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)nn1C(C)C	ZINC000450546237	FI	On-Demand	Anodyne	CTSA	47	37
C[C@H](c1csnn1)N1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546244	GH	On-Demand	Anodyne	LIMK2	18	46
C[C@@H](c1csnn1)N1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546245	GH	On-Demand	Anodyne	LIMK2	18	46
CCS(=O)(=O)c1ccc(CNC(C)(C)c2ccc(Cl)c(Cl)c2)cc1	ZINC000450546246	GJ	On-Demand	Anodyne	RORC	44	38
CC(C)N1CCc2nc(NC(=O)[C@@H]3C[C@H]3c3ccccc3Cl)sc2C1	ZINC000450546247	GI	On-Demand	Anodyne	APEX1	0	41
COCC[C@@H](Cc1ccco1)NC(=O)C1CC(C)(O)C1	ZINC000450546250	CD	On-Demand	Anodyne	NPPA	40	32
COCC[C@H](Cc1ccco1)NC(=O)C1CC(C)(O)C1	ZINC000450546251	CD	On-Demand	Anodyne	NPPA	40	32
CCOC(=O)c1ccc(N2CC(NC(=O)CCCC(=O)C(C)(C)C)C2)nc1	ZINC000450546260	GE	On-Demand	Anodyne	P2RY12	22	40
CC(C)CCCC(=O)Nc1nc2c(s1)CN(C(C)C)CC2	ZINC000450546262	DH	On-Demand	Anodyne	APEX1	0	42
C[C@H]1CN(c2nnc(-c3ccccc3Cl)s2)CCN(C2CC2)C1	ZINC000450546269	EH	On-Demand	Anodyne	HRH3	16	63
C[C@@H]1CN(c2nnc(-c3ccccc3Cl)s2)CCN(C2CC2)C1	ZINC000450546270	EH	On-Demand	Anodyne	HRH3	16	63
CCOC(=O)c1ccc(N2CC(NC(=O)c3oc4ccccc4c3CC)C2)nc1	ZINC000450546278	GG	On-Demand	Anodyne	P2RY12	17	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3oc4ccccc4c3CC)C2)nc1	ZINC000450546278	GG	On-Demand	Anodyne	DGAT1	17	40
CN(C)CCNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450546282	EE	On-Demand	Anodyne	SIGMAR1	32	46
CN(C)CCNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450546282	EE	On-Demand	Anodyne	CCR1	40	40
CN(C)CCNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450546282	EE	On-Demand	Anodyne	CCR5	24	50
CN(C)CCNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450546282	EE	On-Demand	Anodyne	C5AR1	23	43
CN(C)CCNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450546282	EE	On-Demand	Anodyne	CACNA1G	45	49
O=C(Nc1cccc(Br)c1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450546285	GH	On-Demand	Anodyne	INHA	16	45
O=C(Nc1cccc(Br)c1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450546285	GH	On-Demand	Anodyne	LIMK2	17	44
O=C(Nc1cccc(Br)c1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450546286	GH	On-Demand	Anodyne	INHA	16	45
O=C(Nc1cccc(Br)c1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450546286	GH	On-Demand	Anodyne	LIMK2	17	44
CCOC(=O)c1ccc(N2CC(NC(=O)C3(C(=O)CC)CC3)C2)nc1	ZINC000450546300	ED	On-Demand	Anodyne	P2RY12	21	41
CC(C)(C(=O)NCCCc1nc(-c2ccc(F)cc2)no1)C1CCC1	ZINC000450546301	EH	On-Demand	Anodyne	KCNQ1	0	47
CC(C)(C(=O)NCCCc1nc(-c2ccc(F)cc2)no1)C1CCC1	ZINC000450546301	EH	On-Demand	Anodyne	SPHK1	49	45
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H]3CCN(c4ccccc4)C3)C2)nc1	ZINC000450546302	GE	On-Demand	Anodyne	P2RY12	63	44
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3CCN(c4ccccc4)C3)C2)nc1	ZINC000450546303	GE	On-Demand	Anodyne	P2RY12	63	44
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	HTR1A	24	60
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	DRD2	39	54
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	DRD1	18	43
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	DRD4	38	45
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	ADRA1D	17	41
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	HTR2A	45	53
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	HTR2C	31	62
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	SLC6A1	78	39
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	HRH1	19	42
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	ADRA1B	17	41
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	DRD3	24	45
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	HTR7	35	41
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	SIGMAR1	30	51
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	CCR3	79	44
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	CHRNA7	28	41
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	SLC18A3	0	42
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	EPHX2	36	45
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	MCHR1	50	61
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	CACNA1G	47	41
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	CYP2J2	62	45
O=C(CCCN1CCC(C(=O)Nc2cccc(F)c2)CC1)c1ccccc1	ZINC000450546314	FI	On-Demand	Anodyne	KCNK3	44	46
CCc1cc(CCCN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)on1	ZINC000450546322	FH	On-Demand	Anodyne	AKT2	46	40
CCc1cc(CCCN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)on1	ZINC000450546322	FH	On-Demand	Anodyne	AKT1	24	40
O=C(Nc1cccc(F)c1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450546327	EG	On-Demand	Anodyne	F10	0	41
O=C(Nc1cccc(F)c1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450546328	EG	On-Demand	Anodyne	F10	0	41
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546337	FD	On-Demand	Anodyne	ACOX1	41	35
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546337	FD	On-Demand	Anodyne	CCR3	46	41
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546337	FD	On-Demand	Anodyne	ABCB1	46	39
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546337	FD	On-Demand	Anodyne	EPHX2	17	42
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546337	FD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546337	FD	On-Demand	Anodyne	CACNA1G	41	37
COCCOC[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546338	FD	On-Demand	Anodyne	ACOX1	41	35
COCCOC[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546338	FD	On-Demand	Anodyne	CCR3	46	41
COCCOC[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546338	FD	On-Demand	Anodyne	ABCB1	46	39
COCCOC[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546338	FD	On-Demand	Anodyne	EPHX2	17	42
COCCOC[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546338	FD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
COCCOC[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450546338	FD	On-Demand	Anodyne	CACNA1G	41	37
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546342	GI	On-Demand	Anodyne	GRM5	29	53
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546342	GI	On-Demand	Anodyne	ETHR	24	45
CC(C)N1CCCC[C@H]1CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546343	GI	On-Demand	Anodyne	GRM5	29	53
CC(C)N1CCCC[C@H]1CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546343	GI	On-Demand	Anodyne	ETHR	24	45
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546344	GI	On-Demand	Anodyne	GRM5	29	53
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546344	GI	On-Demand	Anodyne	ETHR	24	45
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546345	GI	On-Demand	Anodyne	GRM5	29	53
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546345	GI	On-Demand	Anodyne	ETHR	24	45
COc1cc2c(NCC3(OC)CCCC3)ncnc2cc1F	ZINC000450546360	DF	On-Demand	Anodyne	EGFR	42	45
COc1cc2c(NCC3(OC)CCCC3)ncnc2cc1F	ZINC000450546360	DF	On-Demand	Anodyne	ERBB2	16	42
COc1cc2c(NCC3(OC)CCCC3)ncnc2cc1F	ZINC000450546360	DF	On-Demand	Anodyne	FGFR1	21	42
COc1cc2c(NCC3(OC)CCCC3)ncnc2cc1F	ZINC000450546360	DF	On-Demand	Anodyne	FLT1	32	42
COc1cc2c(NCC3(OC)CCCC3)ncnc2cc1F	ZINC000450546360	DF	On-Demand	Anodyne	FBP1	15	42
COc1cc2c(NCC3(OC)CCCC3)ncnc2cc1F	ZINC000450546360	DF	On-Demand	Anodyne	EPHA2	45	35
CCn1nnc(C)c1CN(c1ccc(Cl)cc1)C(C)C	ZINC000450546364	CH	On-Demand	Anodyne	TAAR1	24	45
COc1cccc(Oc2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)nc2)c1	ZINC000450546365	FG	On-Demand	Anodyne	DRD4	43	32
COc1cccc(Oc2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)nc2)c1	ZINC000450546365	FG	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc(Oc2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)nc2)c1	ZINC000450546365	FG	On-Demand	Anodyne	CHRNA10	38	42
COc1cccc(Oc2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)nc2)c1	ZINC000450546366	FG	On-Demand	Anodyne	DRD4	43	32
COc1cccc(Oc2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)nc2)c1	ZINC000450546366	FG	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc(Oc2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)nc2)c1	ZINC000450546366	FG	On-Demand	Anodyne	CHRNA10	38	42
COc1cccc(Oc2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)nc2)c1	ZINC000450546367	FG	On-Demand	Anodyne	DRD4	43	32
COc1cccc(Oc2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)nc2)c1	ZINC000450546367	FG	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc(Oc2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)nc2)c1	ZINC000450546367	FG	On-Demand	Anodyne	CHRNA10	38	42
COc1cccc(Oc2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)nc2)c1	ZINC000450546368	FG	On-Demand	Anodyne	DRD4	43	32
COc1cccc(Oc2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)nc2)c1	ZINC000450546368	FG	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc(Oc2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)nc2)c1	ZINC000450546368	FG	On-Demand	Anodyne	CHRNA10	38	42
C[C@H]1CN(c2ncnc3cc(Br)ccc23)CCN(C2CC2)C1	ZINC000450546369	FG	On-Demand	Anodyne	PDE3A	48	36
C[C@H]1CN(c2ncnc3cc(Br)ccc23)CCN(C2CC2)C1	ZINC000450546369	FG	On-Demand	Anodyne	PDE3B	71	36
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCN(C2CC2)C1	ZINC000450546370	FG	On-Demand	Anodyne	PDE3A	48	36
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)CCN(C2CC2)C1	ZINC000450546370	FG	On-Demand	Anodyne	PDE3B	71	36
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cccc(C(F)(F)F)n1	ZINC000450546390	DF	On-Demand	Anodyne	CARM1	42	31
CCOC(=O)C[C@H](C)N(C)C(=O)c1cccc(C(F)(F)F)n1	ZINC000450546391	DF	On-Demand	Anodyne	CARM1	42	31
CC(=O)[C@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546392	EE	On-Demand	Anodyne	GRM5	25	48
CC(=O)[C@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546392	EE	On-Demand	Anodyne	ETHR	59	41
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546393	EE	On-Demand	Anodyne	GRM5	25	48
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546393	EE	On-Demand	Anodyne	ETHR	59	41
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546394	EE	On-Demand	Anodyne	GRM5	25	48
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546394	EE	On-Demand	Anodyne	ETHR	59	41
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546395	EE	On-Demand	Anodyne	GRM5	25	48
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546395	EE	On-Demand	Anodyne	ETHR	59	41
CCC(=O)c1ccc(NCC2(OC)CCCC2)c([N+](=O)[O-])c1	ZINC000450546403	DH	On-Demand	Bother	TAAR1	17	45
CCOC(=O)c1ccc(CN2CCC(C(=O)NCCN(C)C)CC2)nc1	ZINC000450546408	FD	On-Demand	Anodyne	SSTR5	48	42
O=C(Nc1cccc(Br)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450546409	GI	On-Demand	Anodyne	INHA	17	47
O=C(Nc1cccc(Br)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450546409	GI	On-Demand	Anodyne	CCR3	42	39
O=C(Nc1cccc(Br)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450546409	GI	On-Demand	Anodyne	EPHX2	34	41
O=C(Nc1cccc(Br)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450546409	GI	On-Demand	Anodyne	LIMK2	18	46
CC1(O)CC(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546410	EE	On-Demand	Anodyne	SPHK1	45	44
C=C[C@@H]1OCC[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546411	EF	On-Demand	Mild	SPHK1	46	43
CCC(=O)C1(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CC1	ZINC000450546433	EF	On-Demand	Anodyne	KCNQ1	0	40
CCC(=O)C1(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CC1	ZINC000450546433	EF	On-Demand	Anodyne	SPHK1	43	44
C[C@@H]1[C@H](NC(=O)C[C@H]2COc3ccccc3O2)CCCN1C	ZINC000450546439	DD	On-Demand	Anodyne	ADRA2B	22	42
C[C@@H]1[C@@H](NC(=O)C[C@@H]2COc3ccccc3O2)CCCN1C	ZINC000450546440	DD	On-Demand	Anodyne	ADRA2B	22	42
C[C@@H]1[C@H](NC(=O)C[C@@H]2COc3ccccc3O2)CCCN1C	ZINC000450546441	DD	On-Demand	Anodyne	ADRA2B	22	42
C[C@@H]1[C@@H](NC(=O)C[C@H]2COc3ccccc3O2)CCCN1C	ZINC000450546442	DD	On-Demand	Anodyne	ADRA2B	22	42
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546445	GI	On-Demand	Anodyne	GRM5	25	54
CC(C)N1CCCC[C@H]1CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546446	GI	On-Demand	Anodyne	GRM5	25	54
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546447	GI	On-Demand	Anodyne	GRM5	25	54
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450546448	GI	On-Demand	Anodyne	GRM5	25	54
C=CC(C)(C)C(=O)NC1CN(c2ccc(C(=O)OCC)cn2)C1	ZINC000450546449	DD	On-Demand	Mild	P2RY12	21	41
COC(=O)c1coc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)n1	ZINC000450546461	FE	On-Demand	Anodyne	CCR3	48	39
COC(=O)c1coc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)n1	ZINC000450546461	FE	On-Demand	Anodyne	CACNA1G	38	47
COC(=O)c1coc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)n1	ZINC000450546461	FE	On-Demand	Anodyne	LIMK2	24	41
CCOC(=O)c1ccc(N2CC(NC(=O)C3(C(=O)C4CC4)CC3)C2)nc1	ZINC000450546463	FD	On-Demand	Anodyne	P2RY12	20	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C2)nc1	ZINC000450546469	GD	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C2)nc1	ZINC000450546469	GD	On-Demand	Anodyne	GAG-PRO	44	32
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450546470	GJ	On-Demand	Anodyne	SPHK1	45	43
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450546471	GJ	On-Demand	Anodyne	SPHK1	45	43
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450546472	GJ	On-Demand	Anodyne	SPHK1	45	43
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450546473	GJ	On-Demand	Anodyne	SPHK1	45	43
CCOC(=O)c1ccc(N2CC(NC(=O)c3cnc(C4CC4)nc3)C2)nc1	ZINC000450546476	FD	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)c1ccc(N2CC(NC(=O)c3cnc(C4CC4)nc3)C2)nc1	ZINC000450546476	FD	On-Demand	Anodyne	SSTR5	40	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3cnc(C4CC4)nc3)C2)nc1	ZINC000450546476	FD	On-Demand	Anodyne	HPGDS	31	41
COC(=O)C1(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CC1	ZINC000450546478	FG	On-Demand	Anodyne	COLA	50	41
COC(=O)C1(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CC1	ZINC000450546478	FG	On-Demand	Anodyne	GRM5	32	56
COC(=O)C1(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CC1	ZINC000450546478	FG	On-Demand	Anodyne	SMO	47	35
COC(=O)C1(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CC1	ZINC000450546478	FG	On-Demand	Anodyne	ETHR	42	50
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CC1	ZINC000450546479	FG	On-Demand	Anodyne	COLA	50	41
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CC1	ZINC000450546479	FG	On-Demand	Anodyne	GRM5	32	56
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CC1	ZINC000450546479	FG	On-Demand	Anodyne	SMO	47	35
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CC1	ZINC000450546479	FG	On-Demand	Anodyne	ETHR	42	50
Cc1sccc1C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450546488	DI	On-Demand	Anodyne	KCNK3	41	36
Cc1sccc1C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450546488	DI	On-Demand	Anodyne	KCNK9	44	36
CCc1cccc(C(=O)Nc2nc3c(s2)CN(C(C)C)CC3)n1	ZINC000450546489	EG	On-Demand	Anodyne	PDE5A	0	40
CCc1cccc(C(=O)Nc2nc3c(s2)CN(C(C)C)CC3)n1	ZINC000450546489	EG	On-Demand	Anodyne	F10	0	47
CCc1cccc(C(=O)Nc2nc3c(s2)CN(C(C)C)CC3)n1	ZINC000450546489	EG	On-Demand	Anodyne	APEX1	0	40
CN(C[C@H](O)CO)C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450546495	ED	On-Demand	Anodyne	IMDH_CRYPV	30	47
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	HTR1A	17	63
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	DRD2	35	47
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	DRD1	22	49
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	DRD4	22	49
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	ADRA1D	16	47
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	HTR2A	41	51
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	HTR2C	28	63
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	ADRA1B	18	47
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	DRD3	24	49
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	ERG2	21	47
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	SIGMAR1	20	59
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	CCR3	37	44
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	SLC18A3	15	45
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	HTR3B	0	45
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	PLD2	45	36
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	MCHR1	21	46
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	CACNA1G	46	45
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	CYP2J2	58	42
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	NET	0	47
CN(C)CCNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450546497	FE	On-Demand	Anodyne	AP2S1	0	47
CCOC(=O)c1ccc(N2CC(NC(=O)c3cccc4c3O[C@H](C)C4)C2)nc1	ZINC000450546499	GE	On-Demand	Anodyne	P2RY12	19	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3cccc4c3O[C@@H](C)C4)C2)nc1	ZINC000450546500	GE	On-Demand	Anodyne	P2RY12	19	40
COC1(CNc2nc(-c3ccccn3)nc(C)c2C)CCCC1	ZINC000450546501	DF	On-Demand	Anodyne	METAP1	35	43
CCOC(=O)c1cc(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)on1	ZINC000450546503	GE	On-Demand	Anodyne	SPHK1	38	40
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546505	EG	On-Demand	Anodyne	SPHK1	40	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546506	EG	On-Demand	Anodyne	SPHK1	40	42
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546507	EG	On-Demand	Anodyne	SPHK1	40	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546508	EG	On-Demand	Anodyne	SPHK1	40	42
C[C@H]1CN(c2ncnc3[nH]c4ccccc4c23)CCN(C2CC2)C1	ZINC000450546509	DG	On-Demand	Anodyne	LIMK2	59	36
C[C@@H]1CN(c2ncnc3[nH]c4ccccc4c23)CCN(C2CC2)C1	ZINC000450546510	DG	On-Demand	Anodyne	LIMK2	59	36
CCOC(=O)c1ccc(N2CC(NC(=O)C(C)(C)OC(C)C)C2)nc1	ZINC000450546514	ED	On-Demand	Anodyne	P2RY12	22	40
CCc1cc(CCCN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)on1	ZINC000450546522	GI	On-Demand	Anodyne	GRM5	25	53
CCc1cc(CCCN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)on1	ZINC000450546523	GI	On-Demand	Anodyne	GRM5	25	53
Fc1ccc(-c2noc([C@@H]3CCCN(C[C@H]4CCC(F)(F)C4)C3)n2)cc1	ZINC000450546524	FI	On-Demand	Anodyne	GRM5	23	56
Fc1ccc(-c2noc([C@H]3CCCN(C[C@@H]4CCC(F)(F)C4)C3)n2)cc1	ZINC000450546525	FI	On-Demand	Anodyne	GRM5	23	56
Fc1ccc(-c2noc([C@@H]3CCCN(C[C@@H]4CCC(F)(F)C4)C3)n2)cc1	ZINC000450546526	FI	On-Demand	Anodyne	GRM5	23	56
Fc1ccc(-c2noc([C@H]3CCCN(C[C@H]4CCC(F)(F)C4)C3)n2)cc1	ZINC000450546527	FI	On-Demand	Anodyne	GRM5	23	56
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3cc(C)ccc3F)C2)nc1	ZINC000450546532	FE	On-Demand	Anodyne	P2RY12	28	42
N#CC1(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)CCC1	ZINC000450546537	DG	On-Demand	Mild	CACNA1G	32	41
CCCCNc1cc(N2CCN(C3CC3)C[C@@H](C)C2)nc(N)n1	ZINC000450546539	DE	On-Demand	Anodyne	HRH4	47	46
CCCCNc1cc(N2CCN(C3CC3)C[C@H](C)C2)nc(N)n1	ZINC000450546540	DE	On-Demand	Anodyne	HRH4	47	46
COCC[C@H](Cc1ccco1)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450546541	ED	On-Demand	Anodyne	NPPA	40	32
COCC[C@@H](Cc1ccco1)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450546542	ED	On-Demand	Anodyne	NPPA	40	32
CCOC(=O)c1cc(C(=O)Nc2nc3c(s2)CN(C(C)C)CC3)[nH]c1C	ZINC000450546567	GF	On-Demand	Anodyne	F10	0	41
CCOC(=O)c1ccc(N2CC(NC(=O)c3ncccc3SCC)C2)nc1	ZINC000450546571	GE	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1ccc(N2CC(NC(=O)CCc3ccc(C(N)=O)cc3)C2)nc1	ZINC000450546572	GD	On-Demand	Anodyne	P2RY12	21	40
CCC[C@H](OC)C(=O)NC1CN(c2ccc(C(=O)OCC)cn2)C1	ZINC000450546575	ED	On-Demand	Anodyne	P2RY12	20	41
CCC[C@@H](OC)C(=O)NC1CN(c2ccc(C(=O)OCC)cn2)C1	ZINC000450546576	ED	On-Demand	Anodyne	P2RY12	20	41
Cc1cccc2c1C[C@H](C(=O)NCCCc1nc(-c3ccc(F)cc3)no1)O2	ZINC000450546577	GG	On-Demand	Anodyne	SPHK1	38	40
Cc1cccc2c1C[C@@H](C(=O)NCCCc1nc(-c3ccc(F)cc3)no1)O2	ZINC000450546578	GG	On-Demand	Anodyne	SPHK1	38	40
CCOC(=O)C[C@H](C)N(C)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450546588	ED	On-Demand	Anodyne	THYX_PBCV1	0	43
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450546589	ED	On-Demand	Anodyne	THYX_PBCV1	0	43
CC(C)Oc1c(F)cc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1F	ZINC000450546595	GI	On-Demand	Bother	CACNA1D	41	32
CC(C)Oc1c(F)cc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1F	ZINC000450546595	GI	On-Demand	Bother	SENP1	0	42
COc1cc(CC(=O)N(C)C[C@H](O)CO)ccc1Cl	ZINC000450546598	CC	On-Demand	Anodyne	OPRK1	0	52
CC(C)N1CCc2nc(NC(=O)c3cc(Cl)c4ccccc4n3)sc2C1	ZINC000450546599	GI	On-Demand	Anodyne	F10	17	44
CC(C)N1CCc2nc(NC(=O)c3cc(Cl)c4ccccc4n3)sc2C1	ZINC000450546599	GI	On-Demand	Anodyne	APEX1	0	42
CCOC(=O)c1ccc(N2CC(NC(=O)CCCC(=O)C3CC3)C2)nc1	ZINC000450546600	FD	On-Demand	Anodyne	P2RY12	24	40
Fc1cccc(-c2noc([C@@H]3CCCN(Cc4cnn[nH]4)C3)n2)c1	ZINC000450546601	EE	On-Demand	Anodyne	GRM5	28	52
Fc1cccc(-c2noc([C@@H]3CCCN(Cc4cnn[nH]4)C3)n2)c1	ZINC000450546601	EE	On-Demand	Anodyne	ETHR	28	47
Fc1cccc(-c2noc([C@H]3CCCN(Cc4cnn[nH]4)C3)n2)c1	ZINC000450546602	EE	On-Demand	Anodyne	GRM5	28	52
Fc1cccc(-c2noc([C@H]3CCCN(Cc4cnn[nH]4)C3)n2)c1	ZINC000450546602	EE	On-Demand	Anodyne	ETHR	28	47
COC(=O)[C@@H](C)NC(=O)c1ccc(NCC2(OC)CCCC2)c([N+](=O)[O-])c1	ZINC000450546611	GE	On-Demand	Bother	TAAR1	21	44
COC(=O)[C@H](C)NC(=O)c1ccc(NCC2(OC)CCCC2)c([N+](=O)[O-])c1	ZINC000450546612	GE	On-Demand	Bother	TAAR1	21	44
COCC[C@@H](Cc1ccco1)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450546613	EE	On-Demand	Anodyne	NCE103	22	40
COCC[C@H](Cc1ccco1)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450546614	EE	On-Demand	Anodyne	NCE103	22	40
COCC[C@H](Cc1ccco1)NC(=O)c1cc2cccnc2s1	ZINC000450546624	EG	On-Demand	Anodyne	AKT1	50	32
COCC[C@@H](Cc1ccco1)NC(=O)c1cc2cccnc2s1	ZINC000450546625	EG	On-Demand	Anodyne	AKT1	50	32
COCC[C@@H](Cc1ccco1)NC(=O)CCCc1ncc(C)o1	ZINC000450546626	DF	On-Demand	Anodyne	NPPA	45	36
COCC[C@H](Cc1ccco1)NC(=O)CCCc1ncc(C)o1	ZINC000450546627	DF	On-Demand	Anodyne	NPPA	45	36
CC(C)N1CCc2nc(NC(=O)[C@H]3CCN(c4ccccc4)C3)sc2C1	ZINC000450546634	FG	On-Demand	Anodyne	APEX1	0	44
CC(C)N1CCc2nc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)sc2C1	ZINC000450546635	FG	On-Demand	Anodyne	APEX1	0	44
O[C@H](Cc1ccccc1)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546636	GH	On-Demand	Anodyne	GRM5	30	54
O[C@H](Cc1ccccc1)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546636	GH	On-Demand	Anodyne	ETHR	35	48
O[C@H](Cc1ccccc1)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546637	GH	On-Demand	Anodyne	GRM5	30	54
O[C@H](Cc1ccccc1)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546637	GH	On-Demand	Anodyne	ETHR	35	48
C[C@@H](O)CCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546643	FF	On-Demand	Anodyne	CCKAR	0	40
C[C@H](O)CCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450546644	FF	On-Demand	Anodyne	CCKAR	0	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CC12CCSCC2	ZINC000450546645	GG	On-Demand	Anodyne	KCNQ1	0	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CC12CCSCC2	ZINC000450546645	GG	On-Demand	Anodyne	SPHK1	36	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CC12CCSCC2	ZINC000450546646	GG	On-Demand	Anodyne	KCNQ1	0	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CC12CCSCC2	ZINC000450546646	GG	On-Demand	Anodyne	SPHK1	36	40
COCC[C@@H](Cc1ccco1)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450546649	GE	On-Demand	Anodyne	CPT1A	43	30
COCC[C@H](Cc1ccco1)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450546650	GE	On-Demand	Anodyne	CPT1A	43	30
C[C@@H](c1csnn1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546661	FH	On-Demand	Anodyne	GRM5	27	48
C[C@@H](c1csnn1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546661	FH	On-Demand	Anodyne	ETHR	33	43
C[C@H](c1csnn1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546662	FH	On-Demand	Anodyne	GRM5	27	48
C[C@H](c1csnn1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546662	FH	On-Demand	Anodyne	ETHR	33	43
C[C@@H](c1csnn1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546663	FH	On-Demand	Anodyne	GRM5	27	48
C[C@@H](c1csnn1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546663	FH	On-Demand	Anodyne	ETHR	33	43
C[C@H](c1csnn1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546664	FH	On-Demand	Anodyne	GRM5	27	48
C[C@H](c1csnn1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546664	FH	On-Demand	Anodyne	ETHR	33	43
CC[C@H](CC(C)C)C(=O)N[C@@H](CCOC)Cc1ccco1	ZINC000450546666	CG	On-Demand	Anodyne	CAPN1	31	40
CC[C@H](CC(C)C)C(=O)N[C@@H](CCOC)Cc1ccco1	ZINC000450546666	CG	On-Demand	Anodyne	CAPN2	40	40
CC[C@@H](CC(C)C)C(=O)N[C@@H](CCOC)Cc1ccco1	ZINC000450546667	CG	On-Demand	Anodyne	CAPN1	31	40
CC[C@@H](CC(C)C)C(=O)N[C@@H](CCOC)Cc1ccco1	ZINC000450546667	CG	On-Demand	Anodyne	CAPN2	40	40
CC[C@H](CC(C)C)C(=O)N[C@H](CCOC)Cc1ccco1	ZINC000450546668	CG	On-Demand	Anodyne	CAPN1	31	40
CC[C@H](CC(C)C)C(=O)N[C@H](CCOC)Cc1ccco1	ZINC000450546668	CG	On-Demand	Anodyne	CAPN2	40	40
CC[C@@H](CC(C)C)C(=O)N[C@H](CCOC)Cc1ccco1	ZINC000450546669	CG	On-Demand	Anodyne	CAPN1	31	40
CC[C@@H](CC(C)C)C(=O)N[C@H](CCOC)Cc1ccco1	ZINC000450546669	CG	On-Demand	Anodyne	CAPN2	40	40
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cnn2ccc(C)cc12	ZINC000450546681	DE	On-Demand	Anodyne	EPHB3	20	43
CCOC(=O)C[C@H](C)N(C)C(=O)c1cnn2ccc(C)cc12	ZINC000450546682	DE	On-Demand	Anodyne	EPHB3	20	43
COc1n[nH]c(NC(=O)[C@H]2Cc3cccc(C)c3O2)n1	ZINC000450546685	CD	On-Demand	Anodyne	ROCK2	28	40
COc1n[nH]c(NC(=O)[C@@H]2Cc3cccc(C)c3O2)n1	ZINC000450546686	CD	On-Demand	Anodyne	ROCK2	28	40
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)nc1	ZINC000450546691	GG	On-Demand	Anodyne	P2RY12	33	42
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)nc1	ZINC000450546691	GG	On-Demand	Anodyne	SSTR5	50	40
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)nc1	ZINC000450546691	GG	On-Demand	Anodyne	CCR3	48	38
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)nc1	ZINC000450546691	GG	On-Demand	Anodyne	MCHR1	41	45
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)nc1	ZINC000450546691	GG	On-Demand	Anodyne	CACNA1G	37	42
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)nc1	ZINC000450546691	GG	On-Demand	Anodyne	LIMK2	30	42
COCC[C@H](Cc1ccco1)NC(=O)CC1(O)CCC1	ZINC000450546701	CD	On-Demand	Anodyne	NPPA	44	35
COCC[C@@H](Cc1ccco1)NC(=O)CC1(O)CCC1	ZINC000450546702	CD	On-Demand	Anodyne	NPPA	44	35
C[C@H]1[C@H](NC(=O)c2ccc3cnccc3c2)CCCN1C	ZINC000450546703	CE	On-Demand	Anodyne	AKT1	23	45
C[C@H]1[C@H](NC(=O)c2ccc3cnccc3c2)CCCN1C	ZINC000450546703	CE	On-Demand	Anodyne	RPS6KA3	41	37
C[C@H]1[C@@H](NC(=O)c2ccc3cnccc3c2)CCCN1C	ZINC000450546704	CE	On-Demand	Anodyne	AKT1	23	45
C[C@H]1[C@@H](NC(=O)c2ccc3cnccc3c2)CCCN1C	ZINC000450546704	CE	On-Demand	Anodyne	RPS6KA3	41	37
C[C@@H]1[C@H](NC(=O)c2ccc3cnccc3c2)CCCN1C	ZINC000450546705	CE	On-Demand	Anodyne	AKT1	23	45
C[C@@H]1[C@H](NC(=O)c2ccc3cnccc3c2)CCCN1C	ZINC000450546705	CE	On-Demand	Anodyne	RPS6KA3	41	37
C[C@@H]1[C@@H](NC(=O)c2ccc3cnccc3c2)CCCN1C	ZINC000450546706	CE	On-Demand	Anodyne	AKT1	23	45
C[C@@H]1[C@@H](NC(=O)c2ccc3cnccc3c2)CCCN1C	ZINC000450546706	CE	On-Demand	Anodyne	RPS6KA3	41	37
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	DRD2	24	40
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	DRD4	41	45
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	ACHE	31	51
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	HRH1	15	44
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	DRD3	22	45
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	AVPR1B	42	35
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	HTR4	66	46
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	SIGMAR1	33	47
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	SSTR5	78	44
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	CCR3	30	42
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	CCR5	16	41
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	UTS2R	34	49
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	MCHR1	45	47
COc1cc(CN2CCC(C(=O)NCCN(C)C)CC2)ccc1Cl	ZINC000450546713	FE	On-Demand	Anodyne	CACNA1G	49	51
CCC[C@@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546716	EG	On-Demand	Anodyne	GRM5	31	56
CCC[C@@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546716	EG	On-Demand	Anodyne	ETHR	41	50
CCC[C@@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546717	EG	On-Demand	Anodyne	GRM5	31	56
CCC[C@@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546717	EG	On-Demand	Anodyne	ETHR	41	50
CCC[C@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546718	EG	On-Demand	Anodyne	GRM5	31	56
CCC[C@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546718	EG	On-Demand	Anodyne	ETHR	41	50
CCC[C@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546719	EG	On-Demand	Anodyne	GRM5	31	56
CCC[C@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546719	EG	On-Demand	Anodyne	ETHR	41	50
C[C@@H]1CN(c2ncc(Br)cc2Cl)CCN(C2CC2)C1	ZINC000450546723	EG	On-Demand	Anodyne	CXCR3	31	40
C[C@H]1CN(c2ncc(Br)cc2Cl)CCN(C2CC2)C1	ZINC000450546724	EG	On-Demand	Anodyne	CXCR3	31	40
CC(C)Oc1c(F)cc(NC(=O)c2c(Br)cnn2C)cc1F	ZINC000450546727	FH	On-Demand	Anodyne	HTR2A	21	44
COc1cc2c(N3CCN(C4CC4)C[C@@H](C)C3)ccnc2cc1F	ZINC000450546741	EG	On-Demand	Anodyne	PDE3A	45	35
COc1cc2c(N3CCN(C4CC4)C[C@H](C)C3)ccnc2cc1F	ZINC000450546742	EG	On-Demand	Anodyne	PDE3A	45	35
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450546744	ED	On-Demand	Anodyne	ESRRA	22	43
CCOC(=O)C[C@H](C)N(C)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450546745	ED	On-Demand	Anodyne	ESRRA	22	43
COCCOC[C@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546759	GE	On-Demand	Anodyne	GRM5	29	52
COCCOC[C@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546759	GE	On-Demand	Anodyne	SMO	40	34
COCCOC[C@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546759	GE	On-Demand	Anodyne	ETHR	40	47
COCCOC[C@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546760	GE	On-Demand	Anodyne	GRM5	29	52
COCCOC[C@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546760	GE	On-Demand	Anodyne	SMO	40	34
COCCOC[C@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546760	GE	On-Demand	Anodyne	ETHR	40	47
COCCOC[C@@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546761	GE	On-Demand	Anodyne	GRM5	29	52
COCCOC[C@@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546761	GE	On-Demand	Anodyne	SMO	40	34
COCCOC[C@@H](O)CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546761	GE	On-Demand	Anodyne	ETHR	40	47
COCCOC[C@@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546762	GE	On-Demand	Anodyne	GRM5	29	52
COCCOC[C@@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546762	GE	On-Demand	Anodyne	SMO	40	34
COCCOC[C@@H](O)CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450546762	GE	On-Demand	Anodyne	ETHR	40	47
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450546770	DG	On-Demand	Anodyne	GPR88	0	41
CC(C)N1CCc2nc(NC(=O)Cc3ccc(O)c(F)c3)sc2C1	ZINC000450546786	EF	On-Demand	Anodyne	SLC27A1	31	40
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	DRD4	15	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	PRCP	22	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	CCR3	99	38
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	PLA2G2A	0	42
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	COLA	40	38
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	S1PR4	34	47
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	SLC18A3	17	40
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	S1PR3	0	42
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	MLNR	57	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	GRM5	27	50
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	S1PR1	22	47
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	SPHK1	26	43
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	S1PR5	48	47
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546787	GI	On-Demand	Anodyne	ETHR	57	39
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	DRD4	15	41
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	PRCP	22	41
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	CCR3	99	38
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	PLA2G2A	0	42
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	COLA	40	38
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	S1PR4	34	47
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	SLC18A3	17	40
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	S1PR3	0	42
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	MLNR	57	41
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	GRM5	27	50
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	S1PR1	22	47
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	SPHK1	26	43
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	S1PR5	48	47
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1	ZINC000450546788	GI	On-Demand	Anodyne	ETHR	57	39
O=C(CCCC(=O)C1CC1)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546789	FG	On-Demand	Anodyne	KCNQ1	0	40
O=C(CCCC(=O)C1CC1)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546789	FG	On-Demand	Anodyne	SPHK1	41	42
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](CC)CC(F)(F)F)C2)nc1	ZINC000450546791	FF	On-Demand	Anodyne	P2RY12	24	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](CC)CC(F)(F)F)C2)nc1	ZINC000450546791	FF	On-Demand	Anodyne	HPGDS	30	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](CC)CC(F)(F)F)C2)nc1	ZINC000450546792	FF	On-Demand	Anodyne	P2RY12	24	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](CC)CC(F)(F)F)C2)nc1	ZINC000450546792	FF	On-Demand	Anodyne	HPGDS	30	41
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3ccc(C(=O)OC)cc3)C2)nc1	ZINC000450546793	GD	On-Demand	Anodyne	P2RY12	22	42
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc4cccnc4s3)C2)nc1	ZINC000450546797	GE	On-Demand	Anodyne	P2RY12	27	41
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)C1(C(=O)C2CC2)CC1	ZINC000450546798	FF	On-Demand	Anodyne	KCNQ1	0	41
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)C1(C(=O)C2CC2)CC1	ZINC000450546798	FF	On-Demand	Anodyne	SPHK1	44	43
CC(C)Oc1c(F)cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1F	ZINC000450546810	GI	On-Demand	Anodyne	RARA	28	48
CC(C)Oc1c(F)cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1F	ZINC000450546810	GI	On-Demand	Anodyne	GCK	30	49
N#CC1(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)CCC1	ZINC000450546816	DG	On-Demand	Mild	AKT2	46	41
N#CC1(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)CCC1	ZINC000450546816	DG	On-Demand	Mild	AKT1	23	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1nc2c(s1)CN(C(C)C)CC2	ZINC000450546817	GI	On-Demand	Anodyne	SORT1	16	41
Cc1cc(-c2nc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)co2)ccn1	ZINC000450546818	DE	On-Demand	Anodyne	IRAK4	20	40
Cc1cc(-c2nc(C(=O)N[C@H]3CCCN(C)[C@H]3C)co2)ccn1	ZINC000450546819	DE	On-Demand	Anodyne	IRAK4	20	40
Cc1cc(-c2nc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)co2)ccn1	ZINC000450546820	DE	On-Demand	Anodyne	IRAK4	20	40
Cc1cc(-c2nc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)co2)ccn1	ZINC000450546821	DE	On-Demand	Anodyne	IRAK4	20	40
C[C@@H]1CN(c2ccnc(N3CCOCC3)n2)CCN(C2CC2)C1	ZINC000450546852	DD	On-Demand	Anodyne	SORD	43	39
C[C@H]1CN(c2ccnc(N3CCOCC3)n2)CCN(C2CC2)C1	ZINC000450546853	DD	On-Demand	Anodyne	SORD	43	39
CCCOc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450546883	DG	On-Demand	Anodyne	TRPV1	19	50
CCCOc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450546883	DG	On-Demand	Anodyne	PRNP	67	42
CCCOc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450546883	DG	On-Demand	Anodyne	P4HTM	0	54
CCCOc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450546883	DG	On-Demand	Anodyne	ACR	18	41
CCCOc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450546883	DG	On-Demand	Anodyne	DGAT1	51	43
CCCOc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450546883	DG	On-Demand	Anodyne	HPGDS	21	42
CCCOc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450546883	DG	On-Demand	Anodyne	NOD2	42	41
COC(=O)[C@@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@H]1c1ccc(O)cc1	ZINC000450546890	GH	On-Demand	Mild	AR	63	45
COc1cc(CC(=O)NC[C@H](SC)C(C)(C)C)ccc1O	ZINC000450546898	DF	On-Demand	Anodyne	TRPV1	32	60
COc1cc(CC(=O)NC[C@H](SC)C(C)(C)C)ccc1O	ZINC000450546898	DF	On-Demand	Anodyne	NCE103	39	48
COc1cc(CC(=O)NC[C@H](SC)C(C)(C)C)ccc1O	ZINC000450546898	DF	On-Demand	Anodyne	P96878_MYCTU	24	48
COc1cc(CC(=O)NC[C@H](SC)C(C)(C)C)ccc1O	ZINC000450546898	DF	On-Demand	Anodyne	CAN2	0	48
COc1cc(CC(=O)NC[C@@H](SC)C(C)(C)C)ccc1O	ZINC000450546899	DF	On-Demand	Anodyne	TRPV1	32	60
COc1cc(CC(=O)NC[C@@H](SC)C(C)(C)C)ccc1O	ZINC000450546899	DF	On-Demand	Anodyne	NCE103	39	48
COc1cc(CC(=O)NC[C@@H](SC)C(C)(C)C)ccc1O	ZINC000450546899	DF	On-Demand	Anodyne	P96878_MYCTU	24	48
COc1cc(CC(=O)NC[C@@H](SC)C(C)(C)C)ccc1O	ZINC000450546899	DF	On-Demand	Anodyne	CAN2	0	48
COC(=O)c1csc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)n1	ZINC000450546903	FF	On-Demand	Anodyne	FAAH	0	47
COC(=O)c1csc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)n1	ZINC000450546903	FF	On-Demand	Anodyne	LIMK2	22	40
COC(=O)[C@@H]1CN(c2nc(N(C)C)c3ccccc3n2)C[C@H]1c1ccc(O)cc1	ZINC000450546909	GF	On-Demand	Anodyne	SLC6A1	66	43
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	P2RY12	28	41
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	CHRM3	15	40
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	SSTR5	48	44
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	MLNR	42	36
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	EPHX2	16	42
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	MCHR1	26	42
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	CACNA1G	40	40
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	LIMK2	23	40
CCOC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc1	ZINC000450546922	GG	On-Demand	Anodyne	WNT3A	46	34
COC(=O)[C@@H]1CN(c2ncncc2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450546923	EE	On-Demand	Anodyne	SLC6A1	62	46
CCn1nnc(C)c1C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450546924	DD	On-Demand	Anodyne	P2RX7	18	44
CCOC(=O)c1cnc2c(OC)cccc2c1NCc1n[nH]c(CC)n1	ZINC000450546927	FF	On-Demand	Anodyne	ATP4A	15	58
COC(=O)[C@@H]1CN(c2ncc(Br)cc2C)C[C@H]1c1ccc(O)cc1	ZINC000450546929	GG	On-Demand	Anodyne	SLC6A1	55	41
C[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)c1ccc([N+](=O)[O-])cc1	ZINC000450546930	GG	On-Demand	Bother	LRRK2	20	40
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	F2	63	45
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	FKBP1A	24	40
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	ELANE	40	37
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	P2RX7	25	45
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	TRY1_BOVIN	47	38
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	DPP4	17	44
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	PREP	80	44
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	XIAP	34	43
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450546935	GG	On-Demand	Anodyne	TMPRSS11D	66	37
COC(=O)[C@@H]1CN(c2ncc(Cl)cn2)C[C@H]1c1ccc(O)cc1	ZINC000450546936	EE	On-Demand	Anodyne	SLC6A3	24	48
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(C)[C@@H]1C	ZINC000450546941	DE	On-Demand	Anodyne	XPNPEP1	0	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(C)[C@@H]1C	ZINC000450546941	DE	On-Demand	Anodyne	XPNPEP2	0	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(C)[C@@H]1C	ZINC000450546942	DE	On-Demand	Anodyne	XPNPEP1	0	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(C)[C@@H]1C	ZINC000450546942	DE	On-Demand	Anodyne	XPNPEP2	0	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(C)[C@H]1C	ZINC000450546943	DE	On-Demand	Anodyne	XPNPEP1	0	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(C)[C@H]1C	ZINC000450546943	DE	On-Demand	Anodyne	XPNPEP2	0	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(C)[C@H]1C	ZINC000450546944	DE	On-Demand	Anodyne	XPNPEP1	0	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(C)[C@H]1C	ZINC000450546944	DE	On-Demand	Anodyne	XPNPEP2	0	40
COC(=O)[C@@H]1CN(c2nnc(C(C)C)o2)C[C@H]1c1ccc(O)cc1	ZINC000450546951	EE	On-Demand	Anodyne	SLC6A1	75	44
Cc1cc(C(=O)Nc2nc(Cc3ccccc3)cs2)nn1C(C)C	ZINC000450546954	EI	On-Demand	Anodyne	GMPS	0	40
CCCN(Cc1cn(CC2CC2)nn1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450546965	GG	On-Demand	Anodyne	L3MBTL3	45	34
COC(=O)c1csc(CN2C[C@H](C(N)=O)Cc3ccccc32)n1	ZINC000450546983	ED	On-Demand	Anodyne	TPP2	40	33
COC(=O)c1csc(CN2C[C@@H](C(N)=O)Cc3ccccc32)n1	ZINC000450546984	ED	On-Demand	Anodyne	TPP2	40	33
COC(=O)[C@@H]1CN(c2ccc(C#N)c(Cl)c2)C[C@H]1c1ccc(O)cc1	ZINC000450546985	FG	On-Demand	Mild	AR	18	45
COC(=O)[C@@H]1CN(c2ccc(C#N)c(Cl)c2)C[C@H]1c1ccc(O)cc1	ZINC000450546985	FG	On-Demand	Mild	SLC6A1	53	45
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450546988	DG	On-Demand	Anodyne	OPRK1	19	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450546989	DG	On-Demand	Anodyne	OPRK1	19	40
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546992	GH	On-Demand	Anodyne	KCNQ1	0	41
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450546992	GH	On-Demand	Anodyne	SPHK1	39	41
C=CCOc1ccc(CC(=O)NC2CN(c3ccc(C(=O)OCC)cn3)C2)cc1	ZINC000450547000	GE	On-Demand	Mild	P2RY12	20	41
CC(C)N1CCc2nc(NC(=O)CCCC(=O)C3CC3)sc2C1	ZINC000450547010	EF	On-Demand	Anodyne	APEX1	0	40
CCCOc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450547011	CF	On-Demand	Anodyne	ADRB1	28	41
CCCOc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450547011	CF	On-Demand	Anodyne	ACACA	37	41
CCCOc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450547011	CF	On-Demand	Anodyne	METAP2	0	45
CCCOc1ccc(NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450547012	CF	On-Demand	Anodyne	ADRB1	28	41
CCCOc1ccc(NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450547012	CF	On-Demand	Anodyne	ACACA	37	41
CCCOc1ccc(NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450547012	CF	On-Demand	Anodyne	METAP2	0	45
C[C@@H]1[C@H](NC(=O)COc2cccc(Br)c2C#N)CCCN1C	ZINC000450547013	FE	On-Demand	Mild	CHRNA10	41	37
C[C@H]1[C@@H](NC(=O)COc2cccc(Br)c2C#N)CCCN1C	ZINC000450547014	FE	On-Demand	Mild	CHRNA10	41	37
C[C@@H]1[C@@H](NC(=O)COc2cccc(Br)c2C#N)CCCN1C	ZINC000450547015	FE	On-Demand	Mild	CHRNA10	41	37
C[C@H]1[C@H](NC(=O)COc2cccc(Br)c2C#N)CCCN1C	ZINC000450547016	FE	On-Demand	Mild	CHRNA10	41	37
C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCN(C2CC2)C1	ZINC000450547019	FF	On-Demand	Bother	L3MBTL1	0	47
C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCN(C2CC2)C1	ZINC000450547019	FF	On-Demand	Bother	L3MBTL3	56	37
C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCN(C2CC2)C1	ZINC000450547020	FF	On-Demand	Bother	L3MBTL1	0	47
C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCN(C2CC2)C1	ZINC000450547020	FF	On-Demand	Bother	L3MBTL3	56	37
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccsc3C)C2)nc1	ZINC000450547023	EE	On-Demand	Anodyne	P2RY12	23	40
C[C@H]1CN(c2ncnc3cc(F)c(F)cc23)CCN(C2CC2)C1	ZINC000450547040	DF	On-Demand	Anodyne	PDE3A	50	38
C[C@@H]1CN(c2ncnc3cc(F)c(F)cc23)CCN(C2CC2)C1	ZINC000450547041	DF	On-Demand	Anodyne	PDE3A	50	38
CC(C)Oc1c(F)cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1F	ZINC000450547046	FJ	On-Demand	Anodyne	RARA	23	41
CC(C)Oc1c(F)cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1F	ZINC000450547046	FJ	On-Demand	Anodyne	P4HTM	0	41
CC(C)Oc1c(F)cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1F	ZINC000450547046	FJ	On-Demand	Anodyne	GCK	24	42
CCOC(=O)c1ccc(N2CC(NC(=O)C3CC(C)(O)C3)C2)nc1	ZINC000450547075	EC	On-Demand	Anodyne	P2RY12	25	43
COCC[C@@H](Cc1ccco1)NC(=O)c1cccc2c1CCCC2	ZINC000450547076	EH	On-Demand	Anodyne	NPPA	40	32
COCC[C@H](Cc1ccco1)NC(=O)c1cccc2c1CCCC2	ZINC000450547077	EH	On-Demand	Anodyne	NPPA	40	32
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547090	DG	On-Demand	Anodyne	OPRK1	19	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547091	DG	On-Demand	Anodyne	OPRK1	19	40
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])nc2)C[C@H]1c1ccc(O)cc1	ZINC000450547092	EE	On-Demand	Bother	SLC6A1	38	40
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	SLC6A4	15	52
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	SLC6A3	25	52
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	DHODH	48	38
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	SIGMAR1	32	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	CCR3	55	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	CCR5	17	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	TIMP3	44	40
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	F11	44	35
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547093	FH	On-Demand	Anodyne	CACNA1G	43	47
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	SLC6A4	15	52
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	SLC6A3	25	52
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	DHODH	48	38
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	SIGMAR1	32	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	CCR3	55	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	CCR5	17	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	TIMP3	44	40
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	F11	44	35
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547094	FH	On-Demand	Anodyne	CACNA1G	43	47
COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)CCCC(=O)C2CC2)c1	ZINC000450547096	GJ	On-Demand	Anodyne	DRD4	43	35
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)CCCC(=O)C2CC2)c1	ZINC000450547097	GJ	On-Demand	Anodyne	DRD4	43	35
COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)CCCC(=O)C2CC2)c1	ZINC000450547098	GJ	On-Demand	Anodyne	DRD4	43	35
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)CCCC(=O)C2CC2)c1	ZINC000450547099	GJ	On-Demand	Anodyne	DRD4	43	35
CC[S@](=O)CC(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450547100	FH	On-Demand	Anodyne	DRD4	40	31
CC[S@](=O)CC(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450547101	FH	On-Demand	Anodyne	DRD4	40	31
CC[S@](=O)CC(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450547102	FH	On-Demand	Anodyne	DRD4	40	31
CC[S@](=O)CC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450547103	FH	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450547107	FF	On-Demand	Bother	SLC6A1	31	42
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450547108	GF	On-Demand	Anodyne	CCR3	63	53
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450547108	GF	On-Demand	Anodyne	CCR2	15	40
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450547108	GF	On-Demand	Anodyne	EPHX2	42	42
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450547109	GF	On-Demand	Anodyne	CCR3	63	53
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450547109	GF	On-Demand	Anodyne	CCR2	15	40
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450547109	GF	On-Demand	Anodyne	EPHX2	42	42
COC(=O)[C@@H]1CN(c2nc(C3CCC3)no2)C[C@H]1c1ccc(O)cc1	ZINC000450547110	EE	On-Demand	Anodyne	SLC6A1	65	45
COC(=O)[C@@H]1CN(c2ccnc(N3CCCCC3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450547123	GF	On-Demand	Anodyne	SLC6A1	35	42
CCc1nc(CNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)n[nH]1	ZINC000450547129	EE	On-Demand	Anodyne	ROS1	50	35
O=C(Nc1ccccc1Br)C1CCN(CC2=CCCCC2)CC1	ZINC000450547131	GJ	On-Demand	Anodyne	EPHX2	15	50
COC[C@@]1(C(=O)Nc2sc(-c3ccccc3)nc2C)CCOC1	ZINC000450547140	EG	On-Demand	Anodyne	PSMB8	40	33
COC[C@]1(C(=O)Nc2sc(-c3ccccc3)nc2C)CCOC1	ZINC000450547141	EG	On-Demand	Anodyne	PSMB8	40	33
COC(=O)[C@@H]1CN(c2nc([C@@H](C)OC)ns2)C[C@H]1c1ccc(O)cc1	ZINC000450547146	FE	On-Demand	Anodyne	SLC6A1	47	40
COC(=O)[C@@H]1CN(c2nc([C@H](C)OC)ns2)C[C@H]1c1ccc(O)cc1	ZINC000450547147	FE	On-Demand	Anodyne	SLC6A1	47	40
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(N)=O)Cc3ccccc32)cc1	ZINC000450547159	FE	On-Demand	Anodyne	TPP2	58	36
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(N)=O)Cc3ccccc32)cc1	ZINC000450547159	FE	On-Demand	Anodyne	RORC	41	34
CCS(=O)(=O)c1ccc(CN2C[C@H](C(N)=O)Cc3ccccc32)cc1	ZINC000450547160	FE	On-Demand	Anodyne	TPP2	58	36
CCS(=O)(=O)c1ccc(CN2C[C@H](C(N)=O)Cc3ccccc32)cc1	ZINC000450547160	FE	On-Demand	Anodyne	RORC	41	34
O=C(NCCc1ccc(F)c(F)c1F)[C@H]1CCN(c2ccccc2)C1	ZINC000450547163	EG	On-Demand	Anodyne	GPBAR1	30	43
O=C(NCCc1ccc(F)c(F)c1F)[C@@H]1CCN(c2ccccc2)C1	ZINC000450547164	EG	On-Demand	Anodyne	GPBAR1	30	43
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	DRD2	34	53
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	DRD4	51	45
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	ACHE	29	47
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	HTR1D	22	41
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	HTR2C	16	42
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	HRH1	28	49
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	DRD3	30	49
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	KCNH2	19	43
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	HTR4	64	41
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	F10	0	40
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	LTA4H	16	52
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	SIGMAR1	41	46
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	SSTR5	81	49
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	CCR1	49	50
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	CCR3	106	48
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	SLC18A3	18	43
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	MLNR	65	41
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	EPHX2	29	47
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	CXCR3	35	43
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	MCHR1	66	45
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	CACNA1G	62	56
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	CCR8	26	40
COc1cc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450547170	GI	On-Demand	Anodyne	NOD2	40	36
C[C@@H](OCCc1ccccc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450547171	FG	On-Demand	Anodyne	ANPEP	20	40
C[C@@H](OCCc1ccccc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450547171	FG	On-Demand	Anodyne	AMP1_PLAFQ	34	40
C[C@H](OCCc1ccccc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450547172	FG	On-Demand	Anodyne	ANPEP	20	40
C[C@H](OCCc1ccccc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450547172	FG	On-Demand	Anodyne	AMP1_PLAFQ	34	40
C[C@@H](O)CCN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	ZINC000450547177	EE	On-Demand	Anodyne	WNT3A	54	37
C[C@@H]1Oc2ccc(C(=O)C3CCN(CC[C@@H](C)O)CC3)cc2NC1=O	ZINC000450547178	EE	On-Demand	Anodyne	WNT3A	54	37
C[C@H](O)CCN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	ZINC000450547179	EE	On-Demand	Anodyne	WNT3A	54	37
C[C@H](O)CCN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	ZINC000450547180	EE	On-Demand	Anodyne	WNT3A	54	37
COCC[C@@H](Cc1ccco1)NC(=O)c1ocnc1-c1ccccc1	ZINC000450547190	EG	On-Demand	Anodyne	NPPA	46	36
COCC[C@H](Cc1ccco1)NC(=O)c1ocnc1-c1ccccc1	ZINC000450547191	EG	On-Demand	Anodyne	NPPA	46	36
CC(C)Oc1c(F)cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1F	ZINC000450547194	GI	On-Demand	Anodyne	PDE4D	17	42
CC(C)Oc1c(F)cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1F	ZINC000450547194	GI	On-Demand	Anodyne	PDEC	0	41
CC(C)Oc1c(F)cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1F	ZINC000450547195	GI	On-Demand	Anodyne	PDE4D	17	42
CC(C)Oc1c(F)cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1F	ZINC000450547195	GI	On-Demand	Anodyne	PDEC	0	41
COCC[C@@H](Cc1ccco1)NC(=O)C(C)(C)C1CCC1	ZINC000450547196	CG	On-Demand	Anodyne	AMY2	45	31
COCC[C@H](Cc1ccco1)NC(=O)C(C)(C)C1CCC1	ZINC000450547197	CG	On-Demand	Anodyne	AMY2	45	31
CCc1cccc(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)n1	ZINC000450547198	FG	On-Demand	Anodyne	SPHK1	38	41
C[C@H](c1csnn1)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450547199	EG	On-Demand	Anodyne	AKT2	50	35
C[C@@H](c1csnn1)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450547200	EG	On-Demand	Anodyne	AKT2	50	35
COc1cc(CC(=O)N[C@@H]2CCCN(C)[C@@H]2C)ccc1Cl	ZINC000450547207	DE	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@H]2CCCN(C)[C@H]2C)ccc1Cl	ZINC000450547208	DE	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@H]2CCCN(C)[C@@H]2C)ccc1Cl	ZINC000450547209	DE	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@@H]2CCCN(C)[C@H]2C)ccc1Cl	ZINC000450547210	DE	On-Demand	Anodyne	CAN2	0	40
Cn1nc(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)c2c1CCCC2	ZINC000450547223	GF	On-Demand	Anodyne	SCARB1	54	34
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	EGFR	20	41
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	DRD2	32	49
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	DRD4	61	47
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	ACHE	34	44
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	HRH1	28	47
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	DRD3	28	47
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	HTR3A	0	47
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	KCNH2	19	44
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	HTR4	73	44
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	F10	0	44
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	SIGMAR1	39	55
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	SSTR5	78	47
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	NPY2R	17	46
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	CCR1	32	42
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	CCR3	108	48
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	MLNR	49	43
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	MET	21	40
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	EPHX2	25	40
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	CXCR3	30	40
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	MCHR1	80	45
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	CACNA1G	57	51
COc1cc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)ccc1Cl	ZINC000450547226	GI	On-Demand	Anodyne	CCR8	23	40
COCC[C@@H](Cc1ccco1)NC(=O)c1cnn2ccc(C)cc12	ZINC000450547238	EF	On-Demand	Anodyne	EPHB3	33	45
COCC[C@H](Cc1ccco1)NC(=O)c1cnn2ccc(C)cc12	ZINC000450547239	EF	On-Demand	Anodyne	EPHB3	33	45
COc1cc2nc(N3CCN(C4CC4)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450547240	FD	On-Demand	Anodyne	ADRA1D	21	52
COc1cc2nc(N3CCN(C4CC4)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450547240	FD	On-Demand	Anodyne	ADRA1A	17	53
COc1cc2nc(N3CCN(C4CC4)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450547240	FD	On-Demand	Anodyne	ADRA1B	43	53
COc1cc2nc(N3CCN(C4CC4)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450547240	FD	On-Demand	Anodyne	PDE3A	45	34
COc1cc2nc(N3CCN(C4CC4)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450547240	FD	On-Demand	Anodyne	CCR4	55	45
COc1cc2nc(N3CCN(C4CC4)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450547240	FD	On-Demand	Anodyne	PDE3B	67	34
COc1cc2nc(N3CCN(C4CC4)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450547240	FD	On-Demand	Anodyne	EHMT2	79	46
COc1cc2nc(N3CCN(C4CC4)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450547241	FD	On-Demand	Anodyne	ADRA1D	21	52
COc1cc2nc(N3CCN(C4CC4)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450547241	FD	On-Demand	Anodyne	ADRA1A	17	53
COc1cc2nc(N3CCN(C4CC4)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450547241	FD	On-Demand	Anodyne	ADRA1B	43	53
COc1cc2nc(N3CCN(C4CC4)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450547241	FD	On-Demand	Anodyne	PDE3A	45	34
COc1cc2nc(N3CCN(C4CC4)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450547241	FD	On-Demand	Anodyne	CCR4	55	45
COc1cc2nc(N3CCN(C4CC4)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450547241	FD	On-Demand	Anodyne	PDE3B	67	34
COc1cc2nc(N3CCN(C4CC4)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450547241	FD	On-Demand	Anodyne	EHMT2	79	46
CCC[C@@H]1CCC[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547249	FI	On-Demand	Anodyne	KCNQ1	0	41
CCC[C@@H]1CCC[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547249	FI	On-Demand	Anodyne	SPHK1	49	47
CCC[C@@H]1CCC[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547250	FI	On-Demand	Anodyne	KCNQ1	0	41
CCC[C@@H]1CCC[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547250	FI	On-Demand	Anodyne	SPHK1	49	47
CCC[C@H]1CCC[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547251	FI	On-Demand	Anodyne	KCNQ1	0	41
CCC[C@H]1CCC[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547251	FI	On-Demand	Anodyne	SPHK1	49	47
CCC[C@H]1CCC[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547252	FI	On-Demand	Anodyne	KCNQ1	0	41
CCC[C@H]1CCC[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547252	FI	On-Demand	Anodyne	SPHK1	49	47
COC(=O)c1csc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)n1	ZINC000450547265	GF	On-Demand	Anodyne	CCR3	51	39
COC(=O)c1csc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)n1	ZINC000450547265	GF	On-Demand	Anodyne	CACNA1G	39	40
COC(=O)c1csc(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)n1	ZINC000450547265	GF	On-Demand	Anodyne	LIMK2	24	41
CN(C)CCNC(=O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450547275	FF	On-Demand	Anodyne	HTR4	24	42
CN(C)CCNC(=O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450547275	FF	On-Demand	Anodyne	CACNA1G	34	41
CN(C)CCNC(=O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450547275	FF	On-Demand	Anodyne	MTNR1C	0	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3c(C)nnn3CC)C2)nc1	ZINC000450547276	FC	On-Demand	Anodyne	P2RY12	22	40
C[C@H](CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1)S(C)(=O)=O	ZINC000450547287	EE	On-Demand	Anodyne	AKT2	39	41
C[C@H](CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1)S(C)(=O)=O	ZINC000450547287	EE	On-Demand	Anodyne	AKT1	25	41
C[C@@H](CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1)S(C)(=O)=O	ZINC000450547288	EE	On-Demand	Anodyne	AKT2	39	41
C[C@@H](CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1)S(C)(=O)=O	ZINC000450547288	EE	On-Demand	Anodyne	AKT1	25	41
C[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCCN1C	ZINC000450547301	FG	On-Demand	Anodyne	SLC6A1	43	40
C[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCCN1C	ZINC000450547301	FG	On-Demand	Anodyne	SLC6A3	18	40
C[C@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCCN1C	ZINC000450547302	FG	On-Demand	Anodyne	SLC6A1	43	40
C[C@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCCN1C	ZINC000450547302	FG	On-Demand	Anodyne	SLC6A3	18	40
C[C@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCCN1C	ZINC000450547303	FG	On-Demand	Anodyne	SLC6A1	43	40
C[C@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCCN1C	ZINC000450547303	FG	On-Demand	Anodyne	SLC6A3	18	40
C[C@@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCCN1C	ZINC000450547304	FG	On-Demand	Anodyne	SLC6A1	43	40
C[C@@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCCN1C	ZINC000450547304	FG	On-Demand	Anodyne	SLC6A3	18	40
COC(=O)[C@@H]1CN(c2cccc(C)c2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450547314	FG	On-Demand	Bother	SLC6A1	54	42
COC(=O)[C@@H]1CN(c2ccnc3cccnc23)C[C@H]1c1ccc(O)cc1	ZINC000450547315	EF	On-Demand	Anodyne	SLC6A1	63	44
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@H]4CCC(F)(F)C4)C3)n2)c1	ZINC000450547316	FI	On-Demand	Anodyne	GRM5	31	59
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@H]4CCC(F)(F)C4)C3)n2)c1	ZINC000450547316	FI	On-Demand	Anodyne	ETHR	29	47
Fc1cccc(-c2noc([C@H]3CCCN(C[C@@H]4CCC(F)(F)C4)C3)n2)c1	ZINC000450547319	FI	On-Demand	Anodyne	GRM5	31	59
Fc1cccc(-c2noc([C@H]3CCCN(C[C@@H]4CCC(F)(F)C4)C3)n2)c1	ZINC000450547319	FI	On-Demand	Anodyne	ETHR	29	47
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@@H]4CCC(F)(F)C4)C3)n2)c1	ZINC000450547320	FI	On-Demand	Anodyne	GRM5	31	59
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@@H]4CCC(F)(F)C4)C3)n2)c1	ZINC000450547320	FI	On-Demand	Anodyne	ETHR	29	47
Fc1cccc(-c2noc([C@H]3CCCN(C[C@H]4CCC(F)(F)C4)C3)n2)c1	ZINC000450547321	FI	On-Demand	Anodyne	GRM5	31	59
Fc1cccc(-c2noc([C@H]3CCCN(C[C@H]4CCC(F)(F)C4)C3)n2)c1	ZINC000450547321	FI	On-Demand	Anodyne	ETHR	29	47
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H]3CC3(F)F)C2)nc1	ZINC000450547335	ED	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3CC3(F)F)C2)nc1	ZINC000450547346	ED	On-Demand	Anodyne	P2RY12	21	41
COC(=O)[C@@H]1CN(c2ccnc3ccsc23)C[C@H]1c1ccc(O)cc1	ZINC000450547353	FG	On-Demand	Anodyne	SLC6A1	38	42
COc1ccc(CC(=O)N[C@H]2CCCN(C)[C@H]2C)c(Cl)c1OC	ZINC000450547357	EE	On-Demand	Anodyne	ACKR3	62	32
COc1ccc(CC(=O)N[C@@H]2CCCN(C)[C@@H]2C)c(Cl)c1OC	ZINC000450547358	EE	On-Demand	Anodyne	ACKR3	62	32
COc1ccc(CC(=O)N[C@@H]2CCCN(C)[C@H]2C)c(Cl)c1OC	ZINC000450547359	EE	On-Demand	Anodyne	ACKR3	62	32
COc1ccc(CC(=O)N[C@H]2CCCN(C)[C@@H]2C)c(Cl)c1OC	ZINC000450547360	EE	On-Demand	Anodyne	ACKR3	62	32
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccc(O)cc1	ZINC000450547361	GG	On-Demand	Anodyne	SLC6A1	68	49
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccc(O)cc1	ZINC000450547361	GG	On-Demand	Anodyne	SLC6A4	19	48
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccc(O)cc1	ZINC000450547361	GG	On-Demand	Anodyne	SLC6A3	31	48
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccc(O)cc1	ZINC000450547361	GG	On-Demand	Anodyne	PDE3A	41	34
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccc(O)cc1	ZINC000450547361	GG	On-Demand	Anodyne	PDE3B	61	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	MME	66	38
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	FCER2	46	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	PAPA1_CARPA	62	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	CYSP_TRYCR	41	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	CTSS	22	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	CAPN2	44	31
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	ACE2	45	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	FPR1	53	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547363	DG	On-Demand	Anodyne	AMP1_PLAFQ	45	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	MME	66	38
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	FCER2	46	34
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	PAPA1_CARPA	62	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	CYSP_TRYCR	41	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	CTSS	22	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	CAPN2	44	31
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	ACE2	45	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	FPR1	53	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	POL	0	41
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](SC)C(C)(C)C	ZINC000450547365	DG	On-Demand	Anodyne	AMP1_PLAFQ	45	36
CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450547366	GG	On-Demand	Anodyne	PDGFRB	0	44
CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450547366	GG	On-Demand	Anodyne	PLK1	65	37
CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450547366	GG	On-Demand	Anodyne	HPGD	47	57
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	MME	66	38
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	FCER2	46	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	PAPA1_CARPA	62	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	CYSP_TRYCR	41	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	CTSS	22	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	CAPN2	44	31
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	ACE2	45	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	FPR1	53	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547367	DG	On-Demand	Anodyne	AMP1_PLAFQ	45	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	MME	66	38
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	FCER2	46	34
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	PAPA1_CARPA	62	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	CYSP_TRYCR	41	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	CTSS	22	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	CAPN2	44	31
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	ACE2	45	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	FPR1	53	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	POL	0	41
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](SC)C(C)(C)C	ZINC000450547368	DG	On-Demand	Anodyne	AMP1_PLAFQ	45	36
CCOC(=O)C[C@@H](C)N(C)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450547369	GG	On-Demand	Anodyne	PDGFRB	0	44
CCOC(=O)C[C@@H](C)N(C)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450547369	GG	On-Demand	Anodyne	PLK1	65	37
CCOC(=O)C[C@@H](C)N(C)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450547369	GG	On-Demand	Anodyne	HPGD	47	57
COc1cc(CC(=O)N[C@H]2CCCN(C)[C@H]2C)ccc1O	ZINC000450547370	CD	On-Demand	Anodyne	CAN2	0	41
C[C@@H]1CN(c2ncncc2-c2ccccc2)CCN(C2CC2)C1	ZINC000450547371	DG	On-Demand	Anodyne	SLC9A1	18	49
COc1cc(CC(=O)N[C@@H]2CCCN(C)[C@@H]2C)ccc1O	ZINC000450547372	CD	On-Demand	Anodyne	CAN2	0	41
C[C@H]1CN(c2ncncc2-c2ccccc2)CCN(C2CC2)C1	ZINC000450547373	DG	On-Demand	Anodyne	SLC9A1	18	49
COc1cc(CC(=O)N[C@@H]2CCCN(C)[C@H]2C)ccc1O	ZINC000450547374	CD	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@H]2CCCN(C)[C@@H]2C)ccc1O	ZINC000450547375	CD	On-Demand	Anodyne	CAN2	0	41
COC(=O)[C@@H]1CN(c2c(F)cccc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450547376	FF	On-Demand	Bother	SLC6A1	38	42
CCCN(CC1=CCCCC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547377	EJ	On-Demand	Anodyne	L3MBTL3	71	37
C=CCC1(C(=O)N[C@@H](CCOC)Cc2ccco2)CCCCC1	ZINC000450547394	DH	On-Demand	Mild	NPPA	45	36
C=CCC1(C(=O)N[C@H](CCOC)Cc2ccco2)CCCCC1	ZINC000450547395	DH	On-Demand	Mild	NPPA	45	36
CC(C)N1CCCC[C@H]1CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547399	FG	On-Demand	Anodyne	CCR3	106	46
CC(C)N1CCCC[C@H]1CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547399	FG	On-Demand	Anodyne	EPHX2	46	42
CC(C)N1CCCC[C@H]1CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547399	FG	On-Demand	Anodyne	BIRC2	47	41
CC(C)N1CCCC[C@H]1CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547401	FG	On-Demand	Anodyne	CCR3	106	46
CC(C)N1CCCC[C@H]1CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547401	FG	On-Demand	Anodyne	EPHX2	46	42
CC(C)N1CCCC[C@H]1CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547401	FG	On-Demand	Anodyne	BIRC2	47	41
CC(C)N1CCCC[C@@H]1CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547402	FG	On-Demand	Anodyne	CCR3	106	46
CC(C)N1CCCC[C@@H]1CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547402	FG	On-Demand	Anodyne	EPHX2	46	42
CC(C)N1CCCC[C@@H]1CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547402	FG	On-Demand	Anodyne	BIRC2	47	41
CC(C)N1CCCC[C@@H]1CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547403	FG	On-Demand	Anodyne	CCR3	106	46
CC(C)N1CCCC[C@@H]1CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547403	FG	On-Demand	Anodyne	EPHX2	46	42
CC(C)N1CCCC[C@@H]1CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547403	FG	On-Demand	Anodyne	BIRC2	47	41
COCC[C@H](Cc1ccco1)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450547421	EF	On-Demand	Anodyne	MME	59	35
COCC[C@H](Cc1ccco1)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450547421	EF	On-Demand	Anodyne	ANPEP	45	31
FC1(F)CC(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)C1	ZINC000450547422	FJ	On-Demand	Anodyne	GRM5	24	46
FC1(F)CC(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)C1	ZINC000450547422	FJ	On-Demand	Anodyne	Q8MHZ5_SHEEP	44	36
COCC[C@@H](Cc1ccco1)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450547423	EF	On-Demand	Anodyne	MME	59	35
COCC[C@@H](Cc1ccco1)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450547423	EF	On-Demand	Anodyne	ANPEP	45	31
COCC[C@H](Cc1ccco1)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450547424	EF	On-Demand	Anodyne	MME	59	35
COCC[C@H](Cc1ccco1)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450547424	EF	On-Demand	Anodyne	ANPEP	45	31
COCC[C@@H](Cc1ccco1)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450547425	EF	On-Demand	Anodyne	MME	59	35
COCC[C@@H](Cc1ccco1)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450547425	EF	On-Demand	Anodyne	ANPEP	45	31
FC1(F)CC(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)C1	ZINC000450547429	FJ	On-Demand	Anodyne	GRM5	24	46
FC1(F)CC(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)C1	ZINC000450547429	FJ	On-Demand	Anodyne	Q8MHZ5_SHEEP	44	36
Cc1ccc(F)c(CC(=O)NCCCc2nc(-c3ccc(F)cc3)no2)c1	ZINC000450547435	FH	On-Demand	Anodyne	P2RX7	20	40
Cc1ccc(F)c(CC(=O)NCCCc2nc(-c3ccc(F)cc3)no2)c1	ZINC000450547435	FH	On-Demand	Anodyne	SPHK1	36	42
Fc1ccc(NC2CCN(CCc3cscn3)CC2)cc1	ZINC000450547438	DG	On-Demand	Anodyne	SCN5A	42	34
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	DRD2	34	55
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	DRD4	55	49
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	ACHE	28	48
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	HTR2A	28	52
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	DRD3	16	48
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	SLC6A3	17	42
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	KCNH2	25	56
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	LTA4H	35	58
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	HRH3	19	45
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	SIGMAR1	52	55
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	SSTR5	79	43
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	CCR1	27	42
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	CCR3	118	54
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	PLD1	40	35
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	SLC18A3	15	45
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	MLNR	95	58
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	CCR2	19	42
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	CXCR3	42	39
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	MCHR1	74	56
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	CACNA1G	50	46
CC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450547445	EI	On-Demand	Anodyne	NOD2	42	36
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000450547453	GI	On-Demand	Anodyne	CCR3	53	39
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000450547453	GI	On-Demand	Anodyne	GRM5	33	55
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000450547453	GI	On-Demand	Anodyne	ETHR	58	51
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000450547455	GI	On-Demand	Anodyne	CCR3	53	39
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000450547455	GI	On-Demand	Anodyne	GRM5	33	55
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)c1	ZINC000450547455	GI	On-Demand	Anodyne	ETHR	58	51
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H]3CCC[C@@H]3CC)C2)nc1	ZINC000450547462	EE	On-Demand	Anodyne	SCARB1	40	34
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H]3CCC[C@H]3CC)C2)nc1	ZINC000450547464	EE	On-Demand	Anodyne	SCARB1	40	34
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3CCC[C@H]3CC)C2)nc1	ZINC000450547465	EE	On-Demand	Anodyne	SCARB1	40	34
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3CCC[C@@H]3CC)C2)nc1	ZINC000450547466	EE	On-Demand	Anodyne	SCARB1	40	34
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3cc(F)c(C)cc3F)C2)nc1	ZINC000450547469	GE	On-Demand	Anodyne	P2RY12	27	43
c1ccc(-c2nc(C3CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)n[nH]2)cc1	ZINC000450547476	EG	On-Demand	Anodyne	AKT2	61	39
c1ccc(-c2nc(C3CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)n[nH]2)cc1	ZINC000450547477	EG	On-Demand	Anodyne	AKT2	61	39
C[C@H]1CN(c2ncc(C(F)(F)F)s2)CCN(C2CC2)C1	ZINC000450547486	DG	On-Demand	Anodyne	MLYCD	62	38
C[C@@H]1CN(c2ncc(C(F)(F)F)s2)CCN(C2CC2)C1	ZINC000450547487	DG	On-Demand	Anodyne	MLYCD	62	38
COC(=O)C1(CN2CCC(Nc3ccc(F)cc3)CC2)CC1	ZINC000450547500	DF	On-Demand	Anodyne	CCR3	43	36
COC(=O)C1(CN2CCC(Nc3ccc(F)cc3)CC2)CC1	ZINC000450547500	DF	On-Demand	Anodyne	MLNR	36	44
CC(C)N1CCc2nc(NC(=O)c3cc(-c4ccccc4)nn3C)sc2C1	ZINC000450547502	GH	On-Demand	Anodyne	F10	26	45
CC(C)N1CCc2nc(NC(=O)c3cc(-c4ccccc4)nn3C)sc2C1	ZINC000450547502	GH	On-Demand	Anodyne	APEX1	0	49
Cc1cncc(-c2nc(CN3CCC(Nc4ccc(F)cc4)CC3)no2)c1	ZINC000450547516	FH	On-Demand	Anodyne	SSTR5	39	42
CNc1nc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc2ccccc12	ZINC000450547532	GE	On-Demand	Anodyne	SLC6A1	75	44
CNc1nc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc2ccccc12	ZINC000450547532	GE	On-Demand	Anodyne	SLC6A4	22	44
CNc1nc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc2ccccc12	ZINC000450547532	GE	On-Demand	Anodyne	SLC6A3	34	40
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	CHRM2	15	53
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	DRD4	25	57
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	HTR2A	17	42
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	CHRM3	17	53
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	LTA4H	24	41
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	SIGMAR1	37	49
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	SSTR5	43	40
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	CCR3	140	47
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	UTS2R	20	42
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	MLNR	70	48
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	CYP2D6	19	42
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	CCR2	22	49
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	EPHX2	51	42
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	MCHR1	41	51
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	CACNA1G	32	42
CC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547554	FG	On-Demand	Anodyne	NOD2	43	37
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	CHRM2	15	53
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	DRD4	25	57
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	HTR2A	17	42
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	CHRM3	17	53
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	LTA4H	24	41
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	SIGMAR1	37	49
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	SSTR5	43	40
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	CCR3	140	47
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	UTS2R	20	42
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	MLNR	70	48
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	CYP2D6	19	42
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	CCR2	22	49
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	EPHX2	51	42
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	MCHR1	41	51
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	CACNA1G	32	42
CC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000450547555	FG	On-Demand	Anodyne	NOD2	43	37
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccc(O)cc1	ZINC000450547556	GF	On-Demand	Anodyne	SLC6A1	66	43
COC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)C[C@H]1c1ccc(O)cc1	ZINC000450547556	GF	On-Demand	Anodyne	SLC6A3	30	42
C[C@@H](O)CCN(Cc1ccsc1)c1ccccc1	ZINC000450547582	CH	On-Demand	Anodyne	HCAR3	23	40
COC1(CNc2ccc(C(=O)N3CCc4ccccc43)cn2)CCCC1	ZINC000450547585	FH	On-Demand	Anodyne	AVPR2	87	43
COC1(CNc2ccc(C(=O)N3CCc4ccccc43)cn2)CCCC1	ZINC000450547585	FH	On-Demand	Anodyne	AVPR1A	47	41
CO[C@@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450547586	EH	On-Demand	Anodyne	MME	61	37
CO[C@@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450547586	EH	On-Demand	Anodyne	ANPEP	41	34
CO[C@@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450547586	EH	On-Demand	Anodyne	ACE2	44	34
CO[C@@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450547586	EH	On-Demand	Anodyne	ACPS	0	41
C[C@H](O)CCN(Cc1ccsc1)c1ccccc1	ZINC000450547587	CH	On-Demand	Anodyne	HCAR3	23	40
COC(=O)[C@@H]1CN(c2nc(-c3ccc(C)cc3)no2)C[C@H]1c1ccc(O)cc1	ZINC000450547588	GG	On-Demand	Anodyne	SLC6A1	80	42
COC(=O)[C@@H]1CN(c2nc(-c3ccc(C)cc3)no2)C[C@H]1c1ccc(O)cc1	ZINC000450547588	GG	On-Demand	Anodyne	SLC6A3	38	40
CC(=O)[C@](C)(O)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	ZINC000450547589	FD	On-Demand	Anodyne	WNT3A	40	33
CO[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450547590	EH	On-Demand	Anodyne	MME	61	37
CO[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450547590	EH	On-Demand	Anodyne	ANPEP	41	34
CO[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450547590	EH	On-Demand	Anodyne	ACE2	44	34
CO[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000450547590	EH	On-Demand	Anodyne	ACPS	0	41
CCOC(=O)c1ccc(N2CC(NC(=O)c3cccc(CC)n3)C2)nc1	ZINC000450547591	FD	On-Demand	Anodyne	P2RY12	24	42
CC(=O)[C@](C)(O)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	ZINC000450547592	FD	On-Demand	Anodyne	WNT3A	40	33
COc1n[nH]c(NC(=O)Cc2cc(C)ccc2F)n1	ZINC000450547594	CD	On-Demand	Anodyne	CSNK1D	17	40
CC(=O)[C@@](C)(O)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	ZINC000450547595	FD	On-Demand	Anodyne	WNT3A	40	33
CC(=O)[C@@](C)(O)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	ZINC000450547596	FD	On-Demand	Anodyne	WNT3A	40	33
C[C@H](c1ccccc1)[C@@H](O)CN1C[C@H](C(N)=O)Cc2ccccc21	ZINC000450547597	DE	On-Demand	Anodyne	TPP2	41	34
C[C@H](c1ccccc1)[C@H](O)CN1C[C@@H](C(N)=O)Cc2ccccc21	ZINC000450547598	DE	On-Demand	Anodyne	TPP2	41	34
C[C@H](c1ccccc1)[C@@H](O)CN1C[C@@H](C(N)=O)Cc2ccccc21	ZINC000450547599	DE	On-Demand	Anodyne	TPP2	41	34
C[C@H](c1ccccc1)[C@H](O)CN1C[C@H](C(N)=O)Cc2ccccc21	ZINC000450547600	DE	On-Demand	Anodyne	TPP2	41	34
CCS(=O)(=O)c1ccc(CN(CC(=O)OC)CC(=O)OC)cc1	ZINC000450547607	EC	On-Demand	Anodyne	CA4	24	41
CCS(=O)(=O)c1ccc(CN(CC(=O)OC)CC(=O)OC)cc1	ZINC000450547607	EC	On-Demand	Anodyne	RORC	61	46
CCOC(=O)c1ccnc(N2CCN(C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450547609	EE	On-Demand	Bother	SLC27A4	42	30
CCOC(=O)c1ccnc(N2CCN(C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000450547610	EE	On-Demand	Bother	SLC27A4	42	30
Cn1nc(-c2ccccc2)cc1C(=O)NCCCC#N	ZINC000450547623	CE	On-Demand	Mild	POLG_WNV	45	30
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	CHRM2	19	42
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	HTR1A	21	52
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	CHRM1	15	42
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	DRD2	38	52
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	DRD4	58	46
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	ACHE	33	46
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	HTR1D	18	52
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	HTR1B	15	52
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	HTR2A	26	50
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	HRH1	19	43
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	DRD3	18	45
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	SLC6A3	17	41
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	KCNH2	26	46
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	CHRM3	34	46
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	LTA4H	24	49
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	FGFR1	23	41
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	SIGMAR1	50	54
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	SSTR5	83	41
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	CCR3	131	53
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	PLD1	42	33
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	FLT1	17	41
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	MLNR	80	49
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	FAAH	21	40
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	CCR2	28	43
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	PDGFRA	24	41
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	CXCR3	35	45
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	MCHR1	85	51
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	CACNA1G	53	45
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	MGLL	0	40
CC(=O)c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1	ZINC000450547631	EI	On-Demand	Anodyne	CCR8	26	42
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	CHRM2	19	46
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	CHRM1	15	45
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	DRD4	21	40
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	DRD3	0	51
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	SLC6A3	17	47
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	CHRM3	26	46
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	TACR2	26	40
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	SIGMAR1	29	44
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	CCR3	88	43
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	CCR5	24	45
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	EPHX2	52	45
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	TGM2	15	40
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	CACNA1G	34	42
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	F13A1	26	40
CO[C@@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547634	FG	On-Demand	Anodyne	BIRC2	42	35
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	CHRM2	19	46
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	CHRM1	15	45
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	DRD4	21	40
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	DRD3	0	51
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	SLC6A3	17	47
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	CHRM3	26	46
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	TACR2	26	40
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	SIGMAR1	29	44
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	CCR3	88	43
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	CCR5	24	45
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	EPHX2	52	45
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	TGM2	15	40
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	CACNA1G	34	42
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	F13A1	26	40
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547636	FG	On-Demand	Anodyne	BIRC2	42	35
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	CHRM2	19	46
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	CHRM1	15	45
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	DRD4	21	40
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	DRD3	0	51
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	SLC6A3	17	47
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	CHRM3	26	46
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	TACR2	26	40
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	SIGMAR1	29	44
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	CCR3	88	43
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	CCR5	24	45
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	EPHX2	52	45
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	TGM2	15	40
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	CACNA1G	34	42
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	F13A1	26	40
CO[C@H](Cc1ccccc1)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547637	FG	On-Demand	Anodyne	BIRC2	42	35
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	CHRM2	19	46
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	CHRM1	15	45
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	DRD4	21	40
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	DRD3	0	51
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	SLC6A3	17	47
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	CHRM3	26	46
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	TACR2	26	40
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	SIGMAR1	29	44
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	CCR3	88	43
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	CCR5	24	45
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	EPHX2	52	45
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	TGM2	15	40
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	CACNA1G	34	42
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	F13A1	26	40
CO[C@H](Cc1ccccc1)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450547639	FG	On-Demand	Anodyne	BIRC2	42	35
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	FKBP1A	39	53
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	ELANE	45	34
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	MMP13	41	42
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	ITGA4	43	46
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	CAPNS1	24	48
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	MMP3	45	42
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	MMP8	27	41
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	CAPN1	20	52
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	MMP7	54	42
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	MMP1	47	45
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	XIAP	40	41
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	SFRP1	126	38
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	WNT3	90	38
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	TMPRSS11D	50	37
CS[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547642	GF	On-Demand	Anodyne	MLX	0	41
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	FKBP1A	39	53
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	ELANE	45	34
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	MMP13	41	42
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	ITGA4	43	46
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	CAPNS1	24	48
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	MMP3	45	42
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	MMP8	27	41
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	CAPN1	20	52
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	MMP7	54	42
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	MMP1	47	45
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	XIAP	40	41
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	SFRP1	126	38
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	WNT3	90	38
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	TMPRSS11D	50	37
CS[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(C)(C)C	ZINC000450547646	GF	On-Demand	Anodyne	MLX	0	41
COc1cccc(OCCC(=O)N2C[C@H](O)C[C@H]2c2ccc(F)cc2)c1	ZINC000450547647	FF	On-Demand	Anodyne	MTNR1A	15	40
COc1cccc(OCCC(=O)N2C[C@@H](O)C[C@H]2c2ccc(F)cc2)c1	ZINC000450547648	FF	On-Demand	Anodyne	MTNR1A	15	40
COc1cccc(OCCC(=O)N2C[C@@H](O)C[C@@H]2c2ccc(F)cc2)c1	ZINC000450547649	FF	On-Demand	Anodyne	MTNR1A	15	40
COc1cccc(OCCC(=O)N2C[C@H](O)C[C@@H]2c2ccc(F)cc2)c1	ZINC000450547651	FF	On-Demand	Anodyne	MTNR1A	15	40
COC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@H]1c1ccc(O)cc1	ZINC000450547653	FG	On-Demand	Anodyne	SLC6A1	50	41
COC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@H]1c1ccc(O)cc1	ZINC000450547653	FG	On-Demand	Anodyne	ADAM33	0	41
N#CC1(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)CCC1	ZINC000450547655	DG	On-Demand	Mild	CACNA1G	35	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547659	FH	On-Demand	Anodyne	MME	47	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547659	FH	On-Demand	Anodyne	CYSP_TRYCR	41	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547659	FH	On-Demand	Anodyne	CTSF	51	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547659	FH	On-Demand	Anodyne	ACE2	44	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547660	FH	On-Demand	Anodyne	MME	47	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547660	FH	On-Demand	Anodyne	CYSP_TRYCR	41	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547660	FH	On-Demand	Anodyne	CTSF	51	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547660	FH	On-Demand	Anodyne	ACE2	44	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547661	FH	On-Demand	Anodyne	MME	47	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547661	FH	On-Demand	Anodyne	CYSP_TRYCR	41	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547661	FH	On-Demand	Anodyne	CTSF	51	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547661	FH	On-Demand	Anodyne	ACE2	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547662	FH	On-Demand	Anodyne	MME	47	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547662	FH	On-Demand	Anodyne	CYSP_TRYCR	41	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547662	FH	On-Demand	Anodyne	CTSF	51	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450547662	FH	On-Demand	Anodyne	ACE2	44	33
COC(=O)[C@@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450547667	FG	On-Demand	Anodyne	SLC6A1	64	41
COC(=O)[C@@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450547667	FG	On-Demand	Anodyne	PDE3A	42	32
COC(=O)[C@@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450547667	FG	On-Demand	Anodyne	PDGFRB	29	43
COC(=O)[C@@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450547667	FG	On-Demand	Anodyne	PDE3B	62	32
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547668	EG	On-Demand	Anodyne	SLC6A1	0	51
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547668	EG	On-Demand	Anodyne	PRCP	27	41
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547668	EG	On-Demand	Anodyne	COLA	30	43
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547668	EG	On-Demand	Anodyne	GRM5	26	49
COc1ccc2nc(C(F)(F)F)nc(N3CCN(C4CC4)C[C@@H](C)C3)c2c1	ZINC000450547675	GH	On-Demand	Anodyne	PDE3B	47	36
COc1ccc2nc(C(F)(F)F)nc(N3CCN(C4CC4)C[C@H](C)C3)c2c1	ZINC000450547676	GH	On-Demand	Anodyne	PDE3B	47	36
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@H]3COc4ccccc4O3)C2)nc1	ZINC000450547677	GD	On-Demand	Anodyne	P2RY12	19	44
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@@H]3COc4ccccc4O3)C2)nc1	ZINC000450547678	GD	On-Demand	Anodyne	P2RY12	19	44
Fc1cccc(-c2noc([C@H]3CCCN(CC4CC(F)(F)C4)C3)n2)c1	ZINC000450547680	FI	On-Demand	Anodyne	GRM5	33	59
Fc1cccc(-c2noc([C@H]3CCCN(CC4CC(F)(F)C4)C3)n2)c1	ZINC000450547680	FI	On-Demand	Anodyne	ETHR	35	49
Fc1cccc(-c2noc([C@@H]3CCCN(CC4CC(F)(F)C4)C3)n2)c1	ZINC000450547681	FI	On-Demand	Anodyne	GRM5	33	59
Fc1cccc(-c2noc([C@@H]3CCCN(CC4CC(F)(F)C4)C3)n2)c1	ZINC000450547681	FI	On-Demand	Anodyne	ETHR	35	49
CC(=O)N[C@H](C(=O)NCCCc1nc(-c2ccc(F)cc2)no1)C(C)(C)C	ZINC000450547682	GE	On-Demand	Anodyne	SPHK1	38	41
FC(F)(F)Cn1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)n1	ZINC000450547684	GH	On-Demand	Anodyne	AKT2	57	42
FC(F)(F)Cn1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)n1	ZINC000450547684	GH	On-Demand	Anodyne	AKT1	33	42
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CCN(c2ccccc2)C1	ZINC000450547694	GG	On-Demand	Anodyne	SPHK1	39	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450547695	GG	On-Demand	Anodyne	SPHK1	39	40
CCCOc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450547699	CF	On-Demand	Anodyne	PNLIP	0	40
CCCOc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450547699	CF	On-Demand	Anodyne	LTA4H	31	40
CCCOc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450547699	CF	On-Demand	Anodyne	ACACA	39	43
CCCOc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450547699	CF	On-Demand	Anodyne	PLA2G4B	59	33
CCCOc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450547699	CF	On-Demand	Anodyne	FAAH	22	44
CCCOc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450547699	CF	On-Demand	Anodyne	ACR	25	43
CCCOc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450547699	CF	On-Demand	Anodyne	SLC1A2	44	39
CCCOc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450547699	CF	On-Demand	Anodyne	O69638_MYCTO	0	41
CCCOc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450547700	CF	On-Demand	Anodyne	PNLIP	0	40
CCCOc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450547700	CF	On-Demand	Anodyne	LTA4H	31	40
CCCOc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450547700	CF	On-Demand	Anodyne	ACACA	39	43
CCCOc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450547700	CF	On-Demand	Anodyne	PLA2G4B	59	33
CCCOc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450547700	CF	On-Demand	Anodyne	FAAH	22	44
CCCOc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450547700	CF	On-Demand	Anodyne	ACR	25	43
CCCOc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450547700	CF	On-Demand	Anodyne	SLC1A2	44	39
CCCOc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450547700	CF	On-Demand	Anodyne	O69638_MYCTO	0	41
CC(C)N1CCc2nc(NC(=O)[C@H](C)OCCc3ccccc3)sc2C1	ZINC000450547701	FG	On-Demand	Anodyne	APEX1	0	42
CC(C)N1CCc2nc(NC(=O)[C@@H](C)OCCc3ccccc3)sc2C1	ZINC000450547702	FG	On-Demand	Anodyne	APEX1	0	42
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@H]1CCCN(C)[C@@H]1C	ZINC000450547705	FF	On-Demand	Anodyne	BIRC2	41	36
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H]1CCCN(C)[C@@H]1C	ZINC000450547706	FF	On-Demand	Anodyne	BIRC2	41	36
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@H]1CCCN(C)[C@H]1C	ZINC000450547707	FF	On-Demand	Anodyne	BIRC2	41	36
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H]1CCCN(C)[C@H]1C	ZINC000450547708	FF	On-Demand	Anodyne	BIRC2	41	36
C[C@H]1C[C@]1(C#N)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547709	EE	On-Demand	Mild	SPHK1	40	43
C[C@@H]1C[C@@]1(C#N)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547710	EE	On-Demand	Mild	SPHK1	40	43
C[C@H]1C[C@@]1(C#N)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547711	EE	On-Demand	Mild	SPHK1	40	43
C[C@@H]1C[C@]1(C#N)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450547712	EE	On-Demand	Mild	SPHK1	40	43
c1ccc(-c2nc(C3CCN(Cc4cnn[nH]4)CC3)n[nH]2)cc1	ZINC000450547713	DD	On-Demand	Anodyne	AKT2	51	45
c1ccc(-c2nc(C3CCN(Cc4cnn[nH]4)CC3)n[nH]2)cc1	ZINC000450547713	DD	On-Demand	Anodyne	AKT1	29	45
N#CCCCNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450547714	CG	On-Demand	Mild	CTSK	16	45
O=C(Nc1cccc(F)c1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450547715	GG	On-Demand	Anodyne	CACNA1G	41	46
O=C(Nc1cccc(F)c1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450547715	GG	On-Demand	Anodyne	HPGDS	30	40
C[C@H](O)CCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547717	EG	On-Demand	Anodyne	SLC6A1	0	51
C[C@H](O)CCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547717	EG	On-Demand	Anodyne	PRCP	27	41
C[C@H](O)CCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547717	EG	On-Demand	Anodyne	COLA	30	43
C[C@H](O)CCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547717	EG	On-Demand	Anodyne	GRM5	26	49
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547718	EG	On-Demand	Anodyne	SLC6A1	0	51
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547718	EG	On-Demand	Anodyne	PRCP	27	41
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547718	EG	On-Demand	Anodyne	COLA	30	43
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547718	EG	On-Demand	Anodyne	GRM5	26	49
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547719	EG	On-Demand	Anodyne	SLC6A1	0	51
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547719	EG	On-Demand	Anodyne	PRCP	27	41
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547719	EG	On-Demand	Anodyne	COLA	30	43
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450547719	EG	On-Demand	Anodyne	GRM5	26	49
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	PRCP	21	40
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	CCR3	91	42
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	COLA	41	38
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	S1PR4	24	41
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	MLNR	46	36
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	GRM5	28	49
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	S1PR1	21	41
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	S1PR5	37	41
CC(=O)c1cccc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547722	GI	On-Demand	Anodyne	ETHR	57	42
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	PRCP	21	40
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	CCR3	91	42
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	COLA	41	38
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	S1PR4	24	41
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	MLNR	46	36
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	GRM5	28	49
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	S1PR1	21	41
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	S1PR5	37	41
CC(=O)c1cccc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)c1	ZINC000450547723	GI	On-Demand	Anodyne	ETHR	57	42
CCc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)ccn1	ZINC000450547730	EF	On-Demand	Anodyne	SLC6A1	55	43
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	HTR1A	31	66
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	DRD2	46	63
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	DRD1	24	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	DRD4	33	53
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	ADRA1D	22	43
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	HTR2A	52	62
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	HTR2C	33	72
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	SLC6A1	102	38
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	SLC6A4	15	47
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	ADRA1A	20	41
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	HRH1	25	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	ADRA1B	21	44
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	DRD3	27	53
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	SLC6A3	16	47
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	DRD5	15	48
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	ERG2	21	44
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	HTR7	42	48
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	SIGMAR1	39	59
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	PRCP	16	40
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	CCR3	78	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	CCR5	16	46
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	CHRNA7	39	44
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	SLC18A3	23	48
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	ABCB1	15	44
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	EPHX2	33	43
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	MCHR1	33	53
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	CACNA1G	52	47
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	CYP2J2	65	46
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	NET	0	44
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450547734	FI	On-Demand	Anodyne	AP2S1	0	44
CCOC(=O)c1ccc(CN2C[C@@H](C(N)=O)Cc3ccccc32)nc1	ZINC000450547737	ED	On-Demand	Anodyne	TPP2	46	33
CCOC(=O)c1ccc(CN2C[C@H](C(N)=O)Cc3ccccc32)nc1	ZINC000450547738	ED	On-Demand	Anodyne	TPP2	46	33
COC(=O)[C@@H]1CN(c2cncc(OCCO)n2)C[C@H]1c1ccc(O)cc1	ZINC000450547743	FC	On-Demand	Anodyne	SLC6A1	36	41
CCc1nc(CNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)n[nH]1	ZINC000450547748	FC	On-Demand	Anodyne	ADORA2B	40	31
CC[C@@H](C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450547749	DE	On-Demand	Anodyne	MTNR1A	61	45
CC[C@@H](C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450547749	DE	On-Demand	Anodyne	MTNR1B	47	45
CC[C@H](C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450547751	DE	On-Demand	Anodyne	MTNR1A	61	45
CC[C@H](C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450547751	DE	On-Demand	Anodyne	MTNR1B	47	45
CC(=O)[C@](C)(O)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450547757	ED	On-Demand	Anodyne	AKT2	46	40
CC(=O)[C@@](C)(O)CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450547758	ED	On-Demand	Anodyne	AKT2	46	40
CCc1cccc(C(=O)NCCCC#N)n1	ZINC000450547759	BD	On-Demand	Mild	PDE5A	24	42
NC(=O)[C@H]1Cc2ccccc2N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450547765	EF	On-Demand	Anodyne	DRD4	0	47
NC(=O)[C@H]1Cc2ccccc2N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450547765	EF	On-Demand	Anodyne	SLC18A3	0	45
NC(=O)[C@H]1Cc2ccccc2N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450547765	EF	On-Demand	Anodyne	HTR3B	0	46
NC(=O)[C@H]1Cc2ccccc2N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450547765	EF	On-Demand	Anodyne	CYP2J2	46	32
NC(=O)[C@@H]1Cc2ccccc2N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450547767	EF	On-Demand	Anodyne	DRD4	0	47
NC(=O)[C@@H]1Cc2ccccc2N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450547767	EF	On-Demand	Anodyne	SLC18A3	0	45
NC(=O)[C@@H]1Cc2ccccc2N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450547767	EF	On-Demand	Anodyne	HTR3B	0	46
NC(=O)[C@@H]1Cc2ccccc2N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450547767	EF	On-Demand	Anodyne	CYP2J2	46	32
CCCOc1ccc(NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450547777	CH	On-Demand	Anodyne	KCNQ1	0	41
CCCOc1ccc(NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450547777	CH	On-Demand	Anodyne	PLA2G4B	66	35
CCCOc1ccc(NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450547777	CH	On-Demand	Anodyne	FAAH	24	43
CCOC(=O)C[C@H](C)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450547781	GE	On-Demand	Mild	PGR	16	41
CCOC(=O)C[C@H](C)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450547781	GE	On-Demand	Mild	NR3C2	33	40
CCOC(=O)C[C@H](C)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450547782	GE	On-Demand	Mild	PGR	16	41
CCOC(=O)C[C@H](C)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450547782	GE	On-Demand	Mild	NR3C2	33	40
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450547783	GE	On-Demand	Mild	PGR	16	41
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450547783	GE	On-Demand	Mild	NR3C2	33	40
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450547784	GE	On-Demand	Mild	PGR	16	41
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450547784	GE	On-Demand	Mild	NR3C2	33	40
COC(=O)[C@@H]1CN(c2cncc(-c3cccs3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450547802	GG	On-Demand	Anodyne	SLC6A1	0	40
CCOC(=O)C[C@H](C)N(C)C(=O)c1cc2ccncc2s1	ZINC000450547804	DF	On-Demand	Anodyne	SELE	63	36
CCOC(=O)C[C@H](C)N(C)C(=O)c1cc2ccncc2s1	ZINC000450547804	DF	On-Demand	Anodyne	VCAM1	40	36
COC(=O)[C@@H]1CN(c2cc(C(C)C)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450547805	EF	On-Demand	Anodyne	SLC6A1	74	41
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cc2ccncc2s1	ZINC000450547806	DF	On-Demand	Anodyne	SELE	63	36
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cc2ccncc2s1	ZINC000450547806	DF	On-Demand	Anodyne	VCAM1	40	36
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	DRD2	28	47
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	DRD4	61	47
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	ACHE	37	49
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	HRH1	17	44
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	DRD3	24	47
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	CHRM3	29	44
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	SIGMAR1	40	40
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	CCR3	40	40
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	AKT2	107	50
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	AKT1	44	50
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	MCHR1	43	39
CC(=O)c1cccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)c1	ZINC000450547837	FI	On-Demand	Anodyne	MGLL	0	41
C[C@@H](O)CCN1CCCC[C@H]1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450547855	EH	On-Demand	Anodyne	CCR1	40	36
C[C@@H](O)CCN1CCCC[C@H]1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450547855	EH	On-Demand	Anodyne	PANK3	0	46
C[C@@H](O)CCN1CCCC[C@@H]1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450547856	EH	On-Demand	Anodyne	CCR1	40	36
C[C@@H](O)CCN1CCCC[C@@H]1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450547856	EH	On-Demand	Anodyne	PANK3	0	46
C[C@H](O)CCN1CCCC[C@H]1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450547857	EH	On-Demand	Anodyne	CCR1	40	36
C[C@H](O)CCN1CCCC[C@H]1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450547857	EH	On-Demand	Anodyne	PANK3	0	46
C[C@H](O)CCN1CCCC[C@@H]1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450547858	EH	On-Demand	Anodyne	CCR1	40	36
C[C@H](O)CCN1CCCC[C@@H]1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450547858	EH	On-Demand	Anodyne	PANK3	0	46
CNC(=O)c1cccnc1N1C[C@@H](C(=O)OC)[C@H](c2ccc(O)cc2)C1	ZINC000450547859	FD	On-Demand	Anodyne	SLC6A1	44	40
CCOc1cncc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)n1	ZINC000450547864	ED	On-Demand	Anodyne	SLC6A1	48	45
O=C1CCC(CN2CCC(Nc3ccc(F)cc3)CC2)CC1	ZINC000450547867	DG	On-Demand	Anodyne	SIGMAR1	22	45
O=C1CCC(CN2CCC(Nc3ccc(F)cc3)CC2)CC1	ZINC000450547867	DG	On-Demand	Anodyne	MLNR	27	41
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	P2RY12	39	40
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	CHRM3	15	41
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	FGFR1	23	41
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	SSTR5	67	43
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	CCR3	34	40
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	FLT1	0	41
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	MLNR	63	42
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	PDGFRA	25	41
CCOC(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)nc1	ZINC000450547868	FG	On-Demand	Anodyne	MCHR1	29	41
COC(=O)[C@@H]1CN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1c1ccc(O)cc1	ZINC000450547869	GG	On-Demand	Anodyne	SLC6A1	47	44
COC(=O)[C@@H]1CN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1c1ccc(O)cc1	ZINC000450547869	GG	On-Demand	Anodyne	GRM5	26	44
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547874	FG	On-Demand	Anodyne	P2RY12	16	43
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547874	FG	On-Demand	Anodyne	CCKAR	26	41
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547874	FG	On-Demand	Anodyne	CCR3	22	41
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547874	FG	On-Demand	Anodyne	FAAH	19	48
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547874	FG	On-Demand	Anodyne	ABCB1	22	43
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547874	FG	On-Demand	Anodyne	KCNK3	53	36
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547874	FG	On-Demand	Anodyne	KCNK9	54	36
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547875	FG	On-Demand	Anodyne	P2RY12	16	43
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547875	FG	On-Demand	Anodyne	CCKAR	26	41
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547875	FG	On-Demand	Anodyne	CCR3	22	41
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547875	FG	On-Demand	Anodyne	FAAH	19	48
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547875	FG	On-Demand	Anodyne	ABCB1	22	43
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547875	FG	On-Demand	Anodyne	KCNK3	53	36
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2cccc(C)c2)CC1	ZINC000450547875	FG	On-Demand	Anodyne	KCNK9	54	36
COc1cccc(-n2cc(C(=O)NC[C@H](SC)C(C)(C)C)nn2)c1	ZINC000450547877	EF	On-Demand	Anodyne	DRD4	44	34
COc1cccc(-n2cc(C(=O)NC[C@@H](SC)C(C)(C)C)nn2)c1	ZINC000450547878	EF	On-Demand	Anodyne	DRD4	44	34
O=C1CC[C@@H](CN2CCCC[C@H]2c2ccccc2C(F)(F)F)CCN1	ZINC000450547879	FI	On-Demand	Anodyne	RBP4	40	36
O=C1CC[C@@H](CN2CCCC[C@@H]2c2ccccc2C(F)(F)F)CCN1	ZINC000450547880	FI	On-Demand	Anodyne	RBP4	40	36
O=C1CC[C@H](CN2CCCC[C@@H]2c2ccccc2C(F)(F)F)CCN1	ZINC000450547881	FI	On-Demand	Anodyne	RBP4	40	36
O=C1CC[C@H](CN2CCCC[C@H]2c2ccccc2C(F)(F)F)CCN1	ZINC000450547882	FI	On-Demand	Anodyne	RBP4	40	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547885	FH	On-Demand	Anodyne	OPRK1	18	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547885	FH	On-Demand	Anodyne	SIGMAR1	15	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547885	FH	On-Demand	Anodyne	CCR3	39	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547885	FH	On-Demand	Anodyne	CCR5	24	49
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547885	FH	On-Demand	Anodyne	PLD1	49	37
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547885	FH	On-Demand	Anodyne	CACNA1G	40	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547886	FH	On-Demand	Anodyne	OPRK1	18	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547886	FH	On-Demand	Anodyne	SIGMAR1	15	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547886	FH	On-Demand	Anodyne	CCR3	39	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547886	FH	On-Demand	Anodyne	CCR5	24	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547886	FH	On-Demand	Anodyne	PLD1	49	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547886	FH	On-Demand	Anodyne	CACNA1G	40	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547887	FH	On-Demand	Anodyne	OPRK1	18	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547887	FH	On-Demand	Anodyne	SIGMAR1	15	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547887	FH	On-Demand	Anodyne	CCR3	39	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547887	FH	On-Demand	Anodyne	CCR5	24	49
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547887	FH	On-Demand	Anodyne	PLD1	49	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547887	FH	On-Demand	Anodyne	CACNA1G	40	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547888	FH	On-Demand	Anodyne	OPRK1	18	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547888	FH	On-Demand	Anodyne	SIGMAR1	15	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547888	FH	On-Demand	Anodyne	CCR3	39	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547888	FH	On-Demand	Anodyne	CCR5	24	49
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547888	FH	On-Demand	Anodyne	PLD1	49	37
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450547888	FH	On-Demand	Anodyne	CACNA1G	40	42
CCC[C@H](O)CN(CCc1ccccn1)Cc1ccc(F)cc1	ZINC000450547897	DG	On-Demand	Anodyne	GRIN1	19	44
CCC[C@@H](O)CN(CCc1ccccn1)Cc1ccc(F)cc1	ZINC000450547898	DG	On-Demand	Anodyne	GRIN1	19	44
CCc1nc(CNc2c(C#N)cnc3c(Br)c(C)ccc23)n[nH]1	ZINC000450547903	FG	On-Demand	Mild	MAP3K8	42	35
O=C(NCCSCC(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450547904	DE	On-Demand	Anodyne	SCD	15	47
O=C(NCCSCC(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450547904	DE	On-Demand	Anodyne	HPGDS	33	53
CCCN(C[C@@H](O)[C@@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547905	GI	On-Demand	Anodyne	HTR1A	24	40
CCCN(C[C@@H](O)[C@@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547905	GI	On-Demand	Anodyne	CCR5	34	43
CCCN(C[C@@H](O)[C@@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547905	GI	On-Demand	Anodyne	L3MBTL3	58	36
CCCN(C[C@@H](O)[C@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547906	GI	On-Demand	Anodyne	HTR1A	24	40
CCCN(C[C@@H](O)[C@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547906	GI	On-Demand	Anodyne	CCR5	34	43
CCCN(C[C@@H](O)[C@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547906	GI	On-Demand	Anodyne	L3MBTL3	58	36
CCCN(C[C@H](O)[C@@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547907	GI	On-Demand	Anodyne	HTR1A	24	40
CCCN(C[C@H](O)[C@@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547907	GI	On-Demand	Anodyne	CCR5	34	43
CCCN(C[C@H](O)[C@@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547907	GI	On-Demand	Anodyne	L3MBTL3	58	36
CCCN(C[C@H](O)[C@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547908	GI	On-Demand	Anodyne	HTR1A	24	40
CCCN(C[C@H](O)[C@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547908	GI	On-Demand	Anodyne	CCR5	34	43
CCCN(C[C@H](O)[C@H](C)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450547908	GI	On-Demand	Anodyne	L3MBTL3	58	36
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450547913	GI	On-Demand	Mild	UTS2R	44	30
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450547914	GI	On-Demand	Mild	UTS2R	44	30
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450547915	GI	On-Demand	Mild	UTS2R	44	30
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450547916	GI	On-Demand	Mild	UTS2R	44	30
COC(=O)c1csc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450547917	GF	On-Demand	Anodyne	CACNA1G	42	42
COC(=O)c1csc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450547917	GF	On-Demand	Anodyne	TRPC6	52	34
COC(=O)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450547919	GG	On-Demand	Anodyne	SLC6A1	48	45
COC(=O)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450547919	GG	On-Demand	Anodyne	SLC6A3	25	43
COC(=O)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450547919	GG	On-Demand	Anodyne	SORD	44	37
CCc1cc(CCCN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)on1	ZINC000450547929	GI	On-Demand	Anodyne	CCR3	62	53
CCc1cc(CCCN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)on1	ZINC000450547930	GI	On-Demand	Anodyne	CCR3	62	53
CCOC(=O)c1ccc(CN(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)nc1	ZINC000450547934	GE	On-Demand	Anodyne	CA2	19	44
CCOC(=O)c1ccc(CN(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)nc1	ZINC000450547934	GE	On-Demand	Anodyne	CA7	22	44
CCOC(=O)c1ccc(CN(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)nc1	ZINC000450547934	GE	On-Demand	Anodyne	CA13	25	41
CCOC(=O)c1ccc(CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)nc1	ZINC000450547935	GE	On-Demand	Anodyne	CA2	19	44
CCOC(=O)c1ccc(CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)nc1	ZINC000450547935	GE	On-Demand	Anodyne	CA7	22	44
CCOC(=O)c1ccc(CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)nc1	ZINC000450547935	GE	On-Demand	Anodyne	CA13	25	41
COCCOC[C@@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547939	CD	On-Demand	Anodyne	DRD3	15	40
COCCOC[C@@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547939	CD	On-Demand	Anodyne	CYP2D6	25	40
COCCOC[C@@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547939	CD	On-Demand	Anodyne	ABCB1	58	38
COCCOC[C@@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547939	CD	On-Demand	Anodyne	HSP90AB1	39	40
COCCOC[C@@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547940	CD	On-Demand	Anodyne	DRD3	15	40
COCCOC[C@@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547940	CD	On-Demand	Anodyne	CYP2D6	25	40
COCCOC[C@@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547940	CD	On-Demand	Anodyne	ABCB1	58	38
COCCOC[C@@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547940	CD	On-Demand	Anodyne	HSP90AB1	39	40
COCCOC[C@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547941	CD	On-Demand	Anodyne	DRD3	15	40
COCCOC[C@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547941	CD	On-Demand	Anodyne	CYP2D6	25	40
COCCOC[C@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547941	CD	On-Demand	Anodyne	ABCB1	58	38
COCCOC[C@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450547941	CD	On-Demand	Anodyne	HSP90AB1	39	40
COCCOC[C@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547942	CD	On-Demand	Anodyne	DRD3	15	40
COCCOC[C@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547942	CD	On-Demand	Anodyne	CYP2D6	25	40
COCCOC[C@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547942	CD	On-Demand	Anodyne	ABCB1	58	38
COCCOC[C@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450547942	CD	On-Demand	Anodyne	HSP90AB1	39	40
COC(=O)[C@@H]1CN(c2nc(C)nc(OC)c2C)C[C@H]1c1ccc(O)cc1	ZINC000450547943	FE	On-Demand	Anodyne	SLC6A1	64	42
Cc1cccc(NC(=O)N2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450547975	FH	On-Demand	Anodyne	CCR3	24	41
Cc1cccc(NC(=O)N2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450547975	FH	On-Demand	Anodyne	EPHX2	22	43
Cc1cccc(NC(=O)N2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450547975	FH	On-Demand	Anodyne	KCNK3	44	34
Cc1cccc(NC(=O)N2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450547976	FH	On-Demand	Anodyne	CCR3	24	41
Cc1cccc(NC(=O)N2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450547976	FH	On-Demand	Anodyne	EPHX2	22	43
Cc1cccc(NC(=O)N2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450547976	FH	On-Demand	Anodyne	KCNK3	44	34
COC(=O)[C@@H](NCc1nccc(OC)n1)c1ccccc1	ZINC000450547977	CD	On-Demand	Anodyne	TACR3	15	45
COC(=O)[C@H](NCc1nccc(OC)n1)c1ccccc1	ZINC000450547978	CD	On-Demand	Anodyne	TACR3	15	45
COC(=O)c1coc(CN2CCCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450547981	FI	On-Demand	Anodyne	RBP4	77	40
COC(=O)c1coc(CN2CCCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450547982	FI	On-Demand	Anodyne	RBP4	77	40
C[C@@H](O)CCN1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547983	EH	On-Demand	Anodyne	CNR1	17	46
C[C@@H](O)CCN1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547983	EH	On-Demand	Anodyne	CNR2	15	46
C[C@@H](O)CCN1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547983	EH	On-Demand	Anodyne	P2RX7	34	40
C[C@@H](O)CCN1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547984	EH	On-Demand	Anodyne	CNR1	17	46
C[C@@H](O)CCN1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547984	EH	On-Demand	Anodyne	CNR2	15	46
C[C@@H](O)CCN1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547984	EH	On-Demand	Anodyne	P2RX7	34	40
C[C@H](O)CCN1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547985	EH	On-Demand	Anodyne	CNR1	17	46
C[C@H](O)CCN1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547985	EH	On-Demand	Anodyne	CNR2	15	46
C[C@H](O)CCN1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547985	EH	On-Demand	Anodyne	P2RX7	34	40
C[C@H](O)CCN1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547986	EH	On-Demand	Anodyne	CNR1	17	46
C[C@H](O)CCN1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547986	EH	On-Demand	Anodyne	CNR2	15	46
C[C@H](O)CCN1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450547986	EH	On-Demand	Anodyne	P2RX7	34	40
c1ccc(CCn2ccc(CN3CC[C@H](Nc4ccccc4)C3)n2)cc1	ZINC000450547988	EH	On-Demand	Anodyne	DRD4	32	40
c1ccc(CCn2ccc(CN3CC[C@H](Nc4ccccc4)C3)n2)cc1	ZINC000450547988	EH	On-Demand	Anodyne	ACHE	15	41
c1ccc(CCn2ccc(CN3CC[C@H](Nc4ccccc4)C3)n2)cc1	ZINC000450547988	EH	On-Demand	Anodyne	DRD3	0	40
c1ccc(CCn2ccc(CN3CC[C@H](Nc4ccccc4)C3)n2)cc1	ZINC000450547988	EH	On-Demand	Anodyne	SIGMAR1	44	38
c1ccc(CCn2ccc(CN3CC[C@@H](Nc4ccccc4)C3)n2)cc1	ZINC000450547990	EH	On-Demand	Anodyne	DRD4	32	40
c1ccc(CCn2ccc(CN3CC[C@@H](Nc4ccccc4)C3)n2)cc1	ZINC000450547990	EH	On-Demand	Anodyne	ACHE	15	41
c1ccc(CCn2ccc(CN3CC[C@@H](Nc4ccccc4)C3)n2)cc1	ZINC000450547990	EH	On-Demand	Anodyne	DRD3	0	40
c1ccc(CCn2ccc(CN3CC[C@@H](Nc4ccccc4)C3)n2)cc1	ZINC000450547990	EH	On-Demand	Anodyne	SIGMAR1	44	38
CCOC(=O)c1ccc(N2CC(NC(=O)c3cnn4ccc(C)cc34)C2)nc1	ZINC000450547993	GD	On-Demand	Anodyne	P2RY12	26	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3cnn4ccc(C)cc34)C2)nc1	ZINC000450547993	GD	On-Demand	Anodyne	EPHB3	34	44
C/C=C\COc1cccc(CC(=O)Nc2nc(OC)n[nH]2)c1	ZINC000450548020	DD	On-Demand	Anodyne	CSNK1D	17	41
COc1n[nH]c(NC(=O)Cc2ccc(Cl)c(OC)c2)n1	ZINC000450548021	CD	On-Demand	Anodyne	CAN2	0	40
COc1ccc(-c2ccnc(N3CCN(C4CC4)C[C@H](C)C3)n2)cc1	ZINC000450548028	EG	On-Demand	Anodyne	EBP	23	43
COc1ccc(-c2ccnc(N3CCN(C4CC4)C[C@H](C)C3)n2)cc1	ZINC000450548028	EG	On-Demand	Anodyne	DKK1	0	40
COc1ccc(-c2ccnc(N3CCN(C4CC4)C[C@@H](C)C3)n2)cc1	ZINC000450548029	EG	On-Demand	Anodyne	EBP	23	43
COc1ccc(-c2ccnc(N3CCN(C4CC4)C[C@@H](C)C3)n2)cc1	ZINC000450548029	EG	On-Demand	Anodyne	DKK1	0	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](Cc3ccccc3)OC)C2)nc1	ZINC000450548030	GD	On-Demand	Anodyne	CACNA1C	40	34
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](Cc3ccccc3)OC)C2)nc1	ZINC000450548030	GD	On-Demand	Anodyne	P2RY12	29	44
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](Cc3ccccc3)OC)C2)nc1	ZINC000450548030	GD	On-Demand	Anodyne	HDAC1	0	43
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](Cc3ccccc3)OC)C2)nc1	ZINC000450548031	GD	On-Demand	Anodyne	CACNA1C	40	34
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](Cc3ccccc3)OC)C2)nc1	ZINC000450548031	GD	On-Demand	Anodyne	P2RY12	29	44
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](Cc3ccccc3)OC)C2)nc1	ZINC000450548031	GD	On-Demand	Anodyne	HDAC1	0	43
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CCCCC1(F)F	ZINC000450548044	FH	On-Demand	Anodyne	KCNQ1	0	44
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CCCCC1(F)F	ZINC000450548044	FH	On-Demand	Anodyne	SPHK1	43	43
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CCCCC1(F)F	ZINC000450548045	FH	On-Demand	Anodyne	KCNQ1	0	44
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@H]1CCCCC1(F)F	ZINC000450548045	FH	On-Demand	Anodyne	SPHK1	43	43
CC(F)(F)c1ccc(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)cn1	ZINC000450548071	GH	On-Demand	Anodyne	KCNQ1	0	42
Cc1cccc2c1O[C@H](C(=O)NCCCc1nc(-c3ccc(F)cc3)no1)C2	ZINC000450548074	GG	On-Demand	Anodyne	SPHK1	40	42
Cc1cccc2c1O[C@@H](C(=O)NCCCc1nc(-c3ccc(F)cc3)no1)C2	ZINC000450548075	GG	On-Demand	Anodyne	SPHK1	40	42
CCc1cc(CCCN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)on1	ZINC000450548076	GI	On-Demand	Anodyne	GRM5	28	49
CCc1cc(CCCN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)on1	ZINC000450548076	GI	On-Demand	Anodyne	ETHR	23	45
CCc1cc(CCCN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)on1	ZINC000450548077	GI	On-Demand	Anodyne	GRM5	28	49
CCc1cc(CCCN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)on1	ZINC000450548077	GI	On-Demand	Anodyne	ETHR	23	45
COc1ccc2nc(C)nc(N3CCN(C4CC4)C[C@@H](C)C3)c2c1	ZINC000450548078	EF	On-Demand	Anodyne	PDE3A	41	38
COc1ccc2nc(C)nc(N3CCN(C4CC4)C[C@@H](C)C3)c2c1	ZINC000450548078	EF	On-Demand	Anodyne	PDE3B	59	38
COc1ccc2nc(C)nc(N3CCN(C4CC4)C[C@H](C)C3)c2c1	ZINC000450548079	EF	On-Demand	Anodyne	PDE3A	41	38
COc1ccc2nc(C)nc(N3CCN(C4CC4)C[C@H](C)C3)c2c1	ZINC000450548079	EF	On-Demand	Anodyne	PDE3B	59	38
COCC[C@H](Cc1ccco1)NC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450548080	CD	On-Demand	Mild	NPPA	42	33
COCC[C@H](Cc1ccco1)NC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450548081	CD	On-Demand	Mild	NPPA	42	33
COCC[C@H](Cc1ccco1)NC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450548082	CD	On-Demand	Mild	NPPA	42	33
COCC[C@H](Cc1ccco1)NC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450548083	CD	On-Demand	Mild	NPPA	42	33
CC[C@H](c1ccc(Cl)cc1Cl)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450548088	GH	On-Demand	Anodyne	FDFT1	24	42
CC[C@H](c1ccc(Cl)cc1Cl)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450548088	GH	On-Demand	Anodyne	EPHX2	21	40
CC[C@@H](c1ccc(Cl)cc1Cl)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450548089	GH	On-Demand	Anodyne	FDFT1	24	42
CC[C@@H](c1ccc(Cl)cc1Cl)N1CCC(C(=O)NCCN(C)C)CC1	ZINC000450548089	GH	On-Demand	Anodyne	EPHX2	21	40
COC(=O)[C@@H]1CN(c2ccnc(C)c2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450548097	EG	On-Demand	Anodyne	SLC6A1	72	47
CC(=O)N[C@H](C(=O)Nc1sc(-c2ccccc2)nc1C)C(C)(C)C	ZINC000450548098	EH	On-Demand	Anodyne	VHL	45	36
COC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450548111	GF	On-Demand	Bother	SLC6A1	22	42
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	HTR1A	25	51
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	DRD2	28	45
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	DRD1	20	45
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	HTR1D	26	40
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	HTR1B	30	40
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	HTR2A	31	41
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	HTR2C	32	43
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	DRD3	31	45
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	P2RY12	19	45
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	CASR	28	42
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	HTR7	41	43
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	CCKAR	27	43
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	PYGL	0	43
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	FAAH	18	47
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	ABCB1	15	41
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	CCKBR	28	41
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	MCHR1	24	48
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	CYP2J2	58	45
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	P2RY14	41	37
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	KCNK3	81	38
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450548114	FH	On-Demand	Anodyne	KCNK9	51	43
COC(=O)[C@@H]1CN(c2ccnc3cc(F)c(OC)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450548119	GG	On-Demand	Anodyne	SLC6A1	23	41
COC(=O)[C@@H]1CN(c2ccnc3cc(F)c(OC)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450548119	GG	On-Demand	Anodyne	PDGFRA	46	36
CCc1nc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)c2ccsc2n1	ZINC000450548120	GG	On-Demand	Anodyne	SLC6A1	23	42
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	CHRM2	0	51
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	CHRM1	15	54
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	P2RY12	24	40
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	CHRM3	22	54
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	SSTR5	51	47
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	CCR3	96	51
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	MLNR	61	39
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	EPHX2	50	41
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548125	GF	On-Demand	Anodyne	CXCR3	20	40
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	CHRM2	0	51
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	CHRM1	15	54
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	P2RY12	24	40
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	CHRM3	22	54
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	SSTR5	51	47
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	CCR3	96	51
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	MLNR	61	39
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	EPHX2	50	41
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)nc1	ZINC000450548126	GF	On-Demand	Anodyne	CXCR3	20	40
O=C(Nc1cccc(Br)c1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450548127	GF	On-Demand	Anodyne	INHA	15	43
O=C(Nc1cccc(Br)c1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450548127	GF	On-Demand	Anodyne	EPHX2	21	44
O=C(Nc1cccc(Br)c1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450548127	GF	On-Demand	Anodyne	LIMK2	19	47
O=C(Nc1cccc(Br)c1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450548129	GF	On-Demand	Anodyne	INHA	15	43
O=C(Nc1cccc(Br)c1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450548129	GF	On-Demand	Anodyne	EPHX2	21	44
O=C(Nc1cccc(Br)c1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450548129	GF	On-Demand	Anodyne	LIMK2	19	47
COCC[C@H](Cc1ccco1)NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450548132	DE	On-Demand	Anodyne	NPPA	45	36
COCC[C@@H](Cc1ccco1)NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450548133	DE	On-Demand	Anodyne	NPPA	45	36
COC(=O)[C@@H]1CN(c2cc(C)nc3ccccc23)C[C@H]1c1ccc(O)cc1	ZINC000450548135	FH	On-Demand	Anodyne	SLC6A1	57	44
COC(=O)[C@@H]1CN(c2cc(C)nc3ccccc23)C[C@H]1c1ccc(O)cc1	ZINC000450548135	FH	On-Demand	Anodyne	ADAM17	62	37
COC(=O)[C@@H]1CN(c2nc(CC(C)C)ns2)C[C@H]1c1ccc(O)cc1	ZINC000450548142	FF	On-Demand	Anodyne	SLC6A1	53	41
COC(=O)[C@@H]1CN(c2nc(C)nc(N(C)C)n2)C[C@H]1c1ccc(O)cc1	ZINC000450548143	FD	On-Demand	Anodyne	SLC6A1	42	41
CC(=O)[C@@](C)(O)CN1CCC[C@H](CNC(=O)Nc2ccc(C)cc2)C1	ZINC000450548144	EE	On-Demand	Anodyne	CCR3	65	34
CC(=O)[C@@](C)(O)CN1CCC[C@@H](CNC(=O)Nc2ccc(C)cc2)C1	ZINC000450548148	EE	On-Demand	Anodyne	CCR3	65	34
CC(=O)[C@](C)(O)CN1CCC[C@@H](CNC(=O)Nc2ccc(C)cc2)C1	ZINC000450548150	EE	On-Demand	Anodyne	CCR3	65	34
CC(=O)[C@](C)(O)CN1CCC[C@H](CNC(=O)Nc2ccc(C)cc2)C1	ZINC000450548151	EE	On-Demand	Anodyne	CCR3	65	34
Clc1ccc(-c2noc([C@@H]3CCCN(Cc4cnn[nH]4)C3)n2)cc1	ZINC000450548153	EF	On-Demand	Anodyne	GRM5	22	46
Clc1ccc(-c2noc([C@H]3CCCN(Cc4cnn[nH]4)C3)n2)cc1	ZINC000450548154	EF	On-Demand	Anodyne	GRM5	22	46
C[C@H](CN1CCC(C(=O)Nc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450548161	ED	On-Demand	Anodyne	CCR3	51	40
C[C@H](CN1CCC(C(=O)Nc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450548161	ED	On-Demand	Anodyne	EPHX2	33	45
C[C@@H](CN1CCC(C(=O)Nc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450548162	ED	On-Demand	Anodyne	CCR3	51	40
C[C@@H](CN1CCC(C(=O)Nc2cccc(F)c2)CC1)S(C)(=O)=O	ZINC000450548162	ED	On-Demand	Anodyne	EPHX2	33	45
COC(=O)[C@@H]1CN(c2nc(C(C)=O)c(C)s2)C[C@H]1c1ccc(O)cc1	ZINC000450548168	FF	On-Demand	Anodyne	SLC6A1	44	41
COC(=O)[C@@H]1CN(c2c(C)cccc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450548173	FG	On-Demand	Bother	SLC6A1	41	40
N#CC1(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)CCC1	ZINC000450548177	GH	On-Demand	Mild	INHA	16	45
N#CC1(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)CCC1	ZINC000450548177	GH	On-Demand	Mild	LIMK2	16	43
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc(OCC)no3)C2)nc1	ZINC000450548184	FD	On-Demand	Anodyne	SSTR5	41	35
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)C2)nc1	ZINC000450548187	GE	On-Demand	Anodyne	P2RY12	21	41
COC(=O)[C@@H]1CN(c2nc3ccc(F)cc3n2C)C[C@H]1c1ccc(O)cc1	ZINC000450548190	FF	On-Demand	Anodyne	SLC6A1	63	43
COC(=O)[C@@H]1CN(c2nc3ccc(F)cc3n2C)C[C@H]1c1ccc(O)cc1	ZINC000450548190	FF	On-Demand	Anodyne	SLC6A3	24	43
COCC[C@@H](Cc1ccco1)NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450548201	GF	On-Demand	Anodyne	NPPA	42	33
COCC[C@H](Cc1ccco1)NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450548202	GF	On-Demand	Anodyne	NPPA	42	33
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450548203	GF	On-Demand	Anodyne	NPPA	42	33
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450548204	GF	On-Demand	Anodyne	NPPA	42	33
CCS(=O)(=O)c1ccc(CN(C(C)C)C2CCCCC2)cc1	ZINC000450548205	DI	On-Demand	Anodyne	RORC	30	43
COc1ccc(C(=O)NC[C@H](SC)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450548206	FF	On-Demand	Anodyne	COLA	45	35
COc1ccc(C(=O)NC[C@H](SC)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450548206	FF	On-Demand	Anodyne	CPT1A	45	31
COc1ccc(C(=O)NC[C@H](SC)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450548206	FF	On-Demand	Anodyne	ITGAV	32	42
CC(C)Oc1c(F)cc(NC(=O)c2ccnc(OC(F)F)c2)cc1F	ZINC000450548207	FI	On-Demand	Anodyne	KCNK3	32	44
COc1ccc(C(=O)NC[C@@H](SC)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450548209	FF	On-Demand	Anodyne	COLA	45	35
COc1ccc(C(=O)NC[C@@H](SC)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450548209	FF	On-Demand	Anodyne	CPT1A	45	31
COc1ccc(C(=O)NC[C@@H](SC)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450548209	FF	On-Demand	Anodyne	ITGAV	32	42
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)[C@@H]2CCCN(C)C2=O)c1	ZINC000450548227	GH	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)[C@@H]2CCCN(C)C2=O)c1	ZINC000450548227	GH	On-Demand	Anodyne	HSD17B2	0	40
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)[C@H]2CCCN(C)C2=O)c1	ZINC000450548228	GH	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)[C@H]2CCCN(C)C2=O)c1	ZINC000450548228	GH	On-Demand	Anodyne	HSD17B2	0	40
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)[C@H]2CCCN(C)C2=O)c1	ZINC000450548229	GH	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)[C@H]2CCCN(C)C2=O)c1	ZINC000450548229	GH	On-Demand	Anodyne	HSD17B2	0	40
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)[C@@H]2CCCN(C)C2=O)c1	ZINC000450548230	GH	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)[C@@H]2CCCN(C)C2=O)c1	ZINC000450548230	GH	On-Demand	Anodyne	HSD17B2	0	40
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	HTR1A	19	72
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	THRA	0	42
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	DRD2	35	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	DRD1	23	52
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	DRD4	30	52
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	HRH2	0	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	ADRA1D	15	41
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	HTR1D	15	46
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	HTR2A	44	56
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	HTR2C	28	72
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	HRH1	15	52
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	ADRA1B	16	46
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	DRD3	18	52
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	ERG2	23	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	HTR7	16	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	SIGMAR1	25	66
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	CCR3	64	48
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	CHRNA7	32	46
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	SLC18A3	21	47
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	EPHX2	33	45
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	MCHR1	25	54
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	CACNA1G	46	42
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	CYP2J2	61	43
O=C(CCCN1CCC(C(=O)Nc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450548243	GI	On-Demand	Anodyne	AP2S1	0	49
COCC[C@H](Cc1ccco1)NC(=O)c1cc2ccncc2s1	ZINC000450548273	EG	On-Demand	Anodyne	AKT1	52	33
COCC[C@H](Cc1ccco1)NC(=O)c1cc2ccncc2s1	ZINC000450548273	EG	On-Demand	Anodyne	NPPA	40	31
COCC[C@@H](Cc1ccco1)NC(=O)c1cc2ccncc2s1	ZINC000450548274	EG	On-Demand	Anodyne	AKT1	52	33
COCC[C@@H](Cc1ccco1)NC(=O)c1cc2ccncc2s1	ZINC000450548274	EG	On-Demand	Anodyne	NPPA	40	31
N#CC1(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CCC1	ZINC000450548277	EH	On-Demand	Mild	GRM5	32	59
N#CC1(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CCC1	ZINC000450548277	EH	On-Demand	Mild	ETHR	30	49
N#CC1(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CCC1	ZINC000450548278	EH	On-Demand	Mild	GRM5	32	59
N#CC1(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CCC1	ZINC000450548278	EH	On-Demand	Mild	ETHR	30	49
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](C)OCCc3ccccc3)C2)nc1	ZINC000450548279	GE	On-Demand	Anodyne	ACE	30	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](C)OCCc3ccccc3)C2)nc1	ZINC000450548279	GE	On-Demand	Anodyne	P2RY12	25	43
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](C)OCCc3ccccc3)C2)nc1	ZINC000450548279	GE	On-Demand	Anodyne	HDAC1	0	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](C)OCCc3ccccc3)C2)nc1	ZINC000450548280	GE	On-Demand	Anodyne	ACE	30	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](C)OCCc3ccccc3)C2)nc1	ZINC000450548280	GE	On-Demand	Anodyne	P2RY12	25	43
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](C)OCCc3ccccc3)C2)nc1	ZINC000450548280	GE	On-Demand	Anodyne	HDAC1	0	41
CC(C)N(Cc1nnc(C2CC2)s1)c1ccc(Cl)cc1	ZINC000450548283	DI	On-Demand	Anodyne	TAAR1	23	43
CCOc1cc(C(=O)N[C@H](CCOC)Cc2ccco2)on1	ZINC000450548292	DE	On-Demand	Anodyne	PSMB8	32	41
CCOc1cc(C(=O)N[C@@H](CCOC)Cc2ccco2)on1	ZINC000450548293	DE	On-Demand	Anodyne	PSMB8	32	41
C[C@@H](CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1)S(C)(=O)=O	ZINC000450548299	FE	On-Demand	Anodyne	GRM5	31	55
C[C@@H](CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1)S(C)(=O)=O	ZINC000450548299	FE	On-Demand	Anodyne	ETHR	36	49
C[C@@H](CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1)S(C)(=O)=O	ZINC000450548300	FE	On-Demand	Anodyne	GRM5	31	55
C[C@@H](CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1)S(C)(=O)=O	ZINC000450548300	FE	On-Demand	Anodyne	ETHR	36	49
C[C@H](CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1)S(C)(=O)=O	ZINC000450548301	FE	On-Demand	Anodyne	GRM5	31	55
C[C@H](CN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1)S(C)(=O)=O	ZINC000450548301	FE	On-Demand	Anodyne	ETHR	36	49
C[C@H](CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1)S(C)(=O)=O	ZINC000450548302	FE	On-Demand	Anodyne	GRM5	31	55
C[C@H](CN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1)S(C)(=O)=O	ZINC000450548302	FE	On-Demand	Anodyne	ETHR	36	49
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	F2	51	37
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	ACE	29	41
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	CELA1	40	38
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	ELANE	65	40
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	CTRA_BOVIN	54	33
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	TRY1_BOVIN	84	35
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	CTSG	43	33
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	PREP	59	41
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	CELA2A	52	37
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	PEPD	0	40
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	XPNPEP2	0	40
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	XIAP	49	45
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	BRCA1	66	35
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548317	FF	On-Demand	Anodyne	TMPRSS11D	41	33
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	F2	51	37
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	ACE	29	41
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	CELA1	40	38
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	ELANE	65	40
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	CTRA_BOVIN	54	33
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	TRY1_BOVIN	84	35
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	CTSG	43	33
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	PREP	59	41
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	CELA2A	52	37
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	PEPD	0	40
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	XPNPEP2	0	40
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	XIAP	49	45
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	BRCA1	66	35
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450548318	FF	On-Demand	Anodyne	TMPRSS11D	41	33
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450548319	FG	On-Demand	Anodyne	SPHK1	43	42
CCC(=O)CCCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450548324	GH	On-Demand	Anodyne	EGFR	19	44
CCC(=O)CCCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450548324	GH	On-Demand	Anodyne	INHA	16	44
CCC(=O)CCCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450548324	GH	On-Demand	Anodyne	CCR3	45	39
CCC(=O)CCCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450548324	GH	On-Demand	Anodyne	EPHX2	36	45
CCC(=O)CCCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450548324	GH	On-Demand	Anodyne	MCHR1	30	48
CCC(=O)CCCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000450548324	GH	On-Demand	Anodyne	LIMK2	18	46
Cc1onc(C2CC2)c1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450548325	FG	On-Demand	Anodyne	KCNQ1	0	40
Cc1onc(C2CC2)c1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450548325	FG	On-Demand	Anodyne	SPHK1	45	43
Cc1ccc(NC(=O)c2ccc(N3CCN(C4CC4)C[C@H](C)C3)nc2)cc1	ZINC000450548335	FH	On-Demand	Anodyne	PRNP	60	41
Cc1ccc(NC(=O)c2ccc(N3CCN(C4CC4)C[C@H](C)C3)nc2)cc1	ZINC000450548335	FH	On-Demand	Anodyne	HDAC1	30	48
Cc1ccc(NC(=O)c2ccc(N3CCN(C4CC4)C[C@H](C)C3)nc2)cc1	ZINC000450548335	FH	On-Demand	Anodyne	P4HTM	0	48
Cc1ccc(NC(=O)c2ccc(N3CCN(C4CC4)C[C@H](C)C3)nc2)cc1	ZINC000450548335	FH	On-Demand	Anodyne	DGAT1	42	36
Cc1ccc(NC(=O)c2ccc(N3CCN(C4CC4)C[C@@H](C)C3)nc2)cc1	ZINC000450548336	FH	On-Demand	Anodyne	PRNP	60	41
Cc1ccc(NC(=O)c2ccc(N3CCN(C4CC4)C[C@@H](C)C3)nc2)cc1	ZINC000450548336	FH	On-Demand	Anodyne	HDAC1	30	48
Cc1ccc(NC(=O)c2ccc(N3CCN(C4CC4)C[C@@H](C)C3)nc2)cc1	ZINC000450548336	FH	On-Demand	Anodyne	P4HTM	0	48
Cc1ccc(NC(=O)c2ccc(N3CCN(C4CC4)C[C@@H](C)C3)nc2)cc1	ZINC000450548336	FH	On-Demand	Anodyne	DGAT1	42	36
C[C@@H](CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1)S(C)(=O)=O	ZINC000450548337	FE	On-Demand	Anodyne	GRM5	24	46
C[C@@H](CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1)S(C)(=O)=O	ZINC000450548338	FE	On-Demand	Anodyne	GRM5	24	46
C[C@H](CN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1)S(C)(=O)=O	ZINC000450548339	FE	On-Demand	Anodyne	GRM5	24	46
C[C@H](CN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1)S(C)(=O)=O	ZINC000450548340	FE	On-Demand	Anodyne	GRM5	24	46
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	F2	57	37
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	ACE	39	43
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	ELANE	80	41
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	PREP	54	46
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	LGMN	51	32
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	CFTR	64	40
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	XIAP	51	37
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	WNT3	40	32
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	BRCA1	60	33
CC(C)Oc1c(F)cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC000450548347	GH	On-Demand	Anodyne	TMPRSS11D	60	35
COc1n[nH]c(NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450548353	GD	On-Demand	Anodyne	MMP13	27	43
COc1n[nH]c(NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450548353	GD	On-Demand	Anodyne	MMP2	30	55
COc1n[nH]c(NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450548353	GD	On-Demand	Anodyne	MMP3	18	43
COc1n[nH]c(NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450548353	GD	On-Demand	Anodyne	MMP8	15	55
COc1n[nH]c(NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450548353	GD	On-Demand	Anodyne	MMP9	18	55
COc1n[nH]c(NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450548353	GD	On-Demand	Anodyne	MMP12	19	43
COc1n[nH]c(NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450548353	GD	On-Demand	Anodyne	MMP7	23	43
CN(C)CCNC(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450548354	GE	On-Demand	Anodyne	ACHE	32	42
CN(C)CCNC(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450548354	GE	On-Demand	Anodyne	SIGMAR1	32	49
CN(C)CCNC(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450548354	GE	On-Demand	Anodyne	MCHR1	18	43
CN(C)CCNC(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450548354	GE	On-Demand	Anodyne	CACNA1G	51	44
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450548355	DE	On-Demand	Anodyne	SLC6A1	57	33
COC(=O)[C@@H]1CN(c2ncnc3c2CCCCC3)C[C@H]1c1ccc(O)cc1	ZINC000450548360	FF	On-Demand	Anodyne	SLC6A1	50	42
COC(=O)[C@@H]1CN(c2nccc(C)c2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450548361	EG	On-Demand	Anodyne	SLC6A1	63	46
CCOC(=O)C[C@H](C)N(C)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450548364	DE	On-Demand	Anodyne	SLC6A1	57	33
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450548365	DE	On-Demand	Anodyne	SLC6A1	57	33
CCOC(=O)C[C@H](C)N(C)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450548366	DE	On-Demand	Anodyne	SLC6A1	57	33
COCC[C@@H](Cc1ccco1)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450548374	DG	On-Demand	Anodyne	NPPA	44	35
COCC[C@@H](Cc1ccco1)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450548376	DG	On-Demand	Anodyne	NPPA	44	35
COCC[C@H](Cc1ccco1)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450548377	DG	On-Demand	Anodyne	NPPA	44	35
COCC[C@H](Cc1ccco1)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450548379	DG	On-Demand	Anodyne	NPPA	44	35
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)Cn2ccc(C)n2)c1	ZINC000450548387	GH	On-Demand	Anodyne	UTS2R	49	35
COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)Cn2ccc(C)n2)c1	ZINC000450548389	GH	On-Demand	Anodyne	UTS2R	49	35
COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)Cn2ccc(C)n2)c1	ZINC000450548390	GH	On-Demand	Anodyne	UTS2R	49	35
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)Cn2ccc(C)n2)c1	ZINC000450548392	GH	On-Demand	Anodyne	UTS2R	49	35
COCC[C@@H](Cc1ccco1)NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000450548398	DF	On-Demand	Mild	NPPA	45	35
COCC[C@H](Cc1ccco1)NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000450548400	DF	On-Demand	Mild	NPPA	45	35
COCC[C@@H](Cc1ccco1)NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000450548401	DF	On-Demand	Mild	NPPA	45	35
COCC[C@H](Cc1ccco1)NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000450548402	DF	On-Demand	Mild	NPPA	45	35
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccnn3CC(F)(F)F)C2)nc1	ZINC000450548403	GD	On-Demand	Anodyne	HPGDS	35	44
C=CCC1(C(=O)N[C@@H](CCOC)Cc2ccco2)CCCC1	ZINC000450548405	DG	On-Demand	Mild	NPPA	45	36
C=CCC1(C(=O)N[C@H](CCOC)Cc2ccco2)CCCC1	ZINC000450548406	DG	On-Demand	Mild	NPPA	45	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548407	FH	On-Demand	Anodyne	NPY2R	34	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548407	FH	On-Demand	Anodyne	CCR3	50	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548407	FH	On-Demand	Anodyne	EPHX2	21	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548407	FH	On-Demand	Anodyne	MCHR1	23	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548408	FH	On-Demand	Anodyne	NPY2R	34	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548408	FH	On-Demand	Anodyne	CCR3	50	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548408	FH	On-Demand	Anodyne	EPHX2	21	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548408	FH	On-Demand	Anodyne	MCHR1	23	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548409	FH	On-Demand	Anodyne	NPY2R	34	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548409	FH	On-Demand	Anodyne	CCR3	50	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548409	FH	On-Demand	Anodyne	EPHX2	21	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548409	FH	On-Demand	Anodyne	MCHR1	23	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548410	FH	On-Demand	Anodyne	NPY2R	34	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548410	FH	On-Demand	Anodyne	CCR3	50	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548410	FH	On-Demand	Anodyne	EPHX2	21	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)Nc2cccc(F)c2)CC1	ZINC000450548410	FH	On-Demand	Anodyne	MCHR1	23	40
CN(C[C@H](O)CO)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450548414	CC	On-Demand	Mild	CTSB	40	34
CN(C[C@H](O)CO)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450548415	CC	On-Demand	Mild	CTSB	40	34
CCc1cc(NCc2n[nH]c(CC)n2)n2ncnc2n1	ZINC000450548417	CC	On-Demand	Anodyne	DHOD	0	51
CC(=O)c1ccc(CN(C(C)C)C2CCCC2)cc1	ZINC000450548424	CI	On-Demand	Anodyne	ACE	43	38
CCOC(=O)c1cc(C(=O)NCCc2ccc(F)c(F)c2F)on1	ZINC000450548426	EE	On-Demand	Anodyne	P2RX7	15	46
Cc1ccc(NC(=O)NC[C@@H]2CCCN([C@H](C)c3csnn3)C2)cc1	ZINC000450548431	FG	On-Demand	Anodyne	CCR3	49	34
Cc1ccc(NC(=O)NC[C@@H]2CCCN([C@H](C)c3csnn3)C2)cc1	ZINC000450548431	FG	On-Demand	Anodyne	PRMT3	41	37
Cc1ccc(NC(=O)NC[C@@H]2CCCN([C@@H](C)c3csnn3)C2)cc1	ZINC000450548432	FG	On-Demand	Anodyne	CCR3	49	34
Cc1ccc(NC(=O)NC[C@@H]2CCCN([C@@H](C)c3csnn3)C2)cc1	ZINC000450548432	FG	On-Demand	Anodyne	PRMT3	41	37
Cc1ccc(NC(=O)NC[C@H]2CCCN([C@H](C)c3csnn3)C2)cc1	ZINC000450548433	FG	On-Demand	Anodyne	CCR3	49	34
Cc1ccc(NC(=O)NC[C@H]2CCCN([C@H](C)c3csnn3)C2)cc1	ZINC000450548433	FG	On-Demand	Anodyne	PRMT3	41	37
Cc1ccc(NC(=O)NC[C@H]2CCCN([C@@H](C)c3csnn3)C2)cc1	ZINC000450548434	FG	On-Demand	Anodyne	CCR3	49	34
Cc1ccc(NC(=O)NC[C@H]2CCCN([C@@H](C)c3csnn3)C2)cc1	ZINC000450548434	FG	On-Demand	Anodyne	PRMT3	41	37
COC(=O)[C@@H]1CN(c2ncc(C(C)C)s2)C[C@H]1c1ccc(O)cc1	ZINC000450548447	EG	On-Demand	Anodyne	SLC6A1	64	41
O=C1CC[C@@H](CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548449	GG	On-Demand	Anodyne	COLA	0	40
O=C1CC[C@@H](CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548449	GG	On-Demand	Anodyne	GRM5	24	44
O=C1CC[C@@H](CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548449	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	35
O=C1CC[C@H](CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548450	GG	On-Demand	Anodyne	COLA	0	40
O=C1CC[C@H](CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548450	GG	On-Demand	Anodyne	GRM5	24	44
O=C1CC[C@H](CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548450	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	35
O=C1CC[C@H](CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548451	GG	On-Demand	Anodyne	COLA	0	40
O=C1CC[C@H](CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548451	GG	On-Demand	Anodyne	GRM5	24	44
O=C1CC[C@H](CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548451	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	35
O=C1CC[C@@H](CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548452	GG	On-Demand	Anodyne	COLA	0	40
O=C1CC[C@@H](CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548452	GG	On-Demand	Anodyne	GRM5	24	44
O=C1CC[C@@H](CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCN1	ZINC000450548452	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	35
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@@H](SC)C(C)(C)C)c1	ZINC000450548454	DH	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@@H](SC)C(C)(C)C)c1	ZINC000450548454	DH	On-Demand	Anodyne	MTNR1A	27	43
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@@H](SC)C(C)(C)C)c1	ZINC000450548454	DH	On-Demand	Anodyne	MTNR1B	27	43
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@@H](SC)C(C)(C)C)c1	ZINC000450548454	DH	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@H](SC)C(C)(C)C)c1	ZINC000450548455	DH	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@H](SC)C(C)(C)C)c1	ZINC000450548455	DH	On-Demand	Anodyne	MTNR1A	27	43
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@H](SC)C(C)(C)C)c1	ZINC000450548455	DH	On-Demand	Anodyne	MTNR1B	27	43
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@H](SC)C(C)(C)C)c1	ZINC000450548455	DH	On-Demand	Anodyne	GPR88	0	42
CCC[C@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450548456	BE	On-Demand	Anodyne	OPRK1	15	40
CCC[C@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450548457	BE	On-Demand	Anodyne	OPRK1	15	40
CCC[C@@H](O)CN1CC[C@@H](Nc2ccccc2)C1	ZINC000450548458	BE	On-Demand	Anodyne	OPRK1	15	40
CCC[C@@H](O)CN1CC[C@H](Nc2ccccc2)C1	ZINC000450548459	BE	On-Demand	Anodyne	OPRK1	15	40
CS[C@@H](CNC(=O)c1coc(-c2ccnc(C)c2)n1)C(C)(C)C	ZINC000450548460	EH	On-Demand	Anodyne	IRAK4	20	41
CS[C@H](CNC(=O)c1coc(-c2ccnc(C)c2)n1)C(C)(C)C	ZINC000450548461	EH	On-Demand	Anodyne	IRAK4	20	41
CS[C@H](CNC(=O)c1cc2ccncc2s1)C(C)(C)C	ZINC000450548476	DH	On-Demand	Anodyne	SELE	61	40
CS[C@H](CNC(=O)c1cc2ccncc2s1)C(C)(C)C	ZINC000450548476	DH	On-Demand	Anodyne	ICAM1	57	40
CS[C@H](CNC(=O)c1cc2ccncc2s1)C(C)(C)C	ZINC000450548476	DH	On-Demand	Anodyne	VCAM1	47	34
CS[C@@H](CNC(=O)c1cc2ccncc2s1)C(C)(C)C	ZINC000450548477	DH	On-Demand	Anodyne	VCAM1	46	33
COC(=O)[C@@H]1CN(c2ccnc(N(C)C)n2)C[C@H]1c1ccc(O)cc1	ZINC000450548478	ED	On-Demand	Anodyne	SLC6A1	57	42
CC(=O)[C@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548479	FF	On-Demand	Anodyne	PRCP	27	40
CC(=O)[C@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548479	FF	On-Demand	Anodyne	COLA	37	44
CC(=O)[C@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548479	FF	On-Demand	Anodyne	GRM5	27	50
CC(=O)[C@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548479	FF	On-Demand	Anodyne	ETHR	56	39
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548480	FF	On-Demand	Anodyne	PRCP	27	40
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548480	FF	On-Demand	Anodyne	COLA	37	44
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548480	FF	On-Demand	Anodyne	GRM5	27	50
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548480	FF	On-Demand	Anodyne	ETHR	56	39
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548481	FF	On-Demand	Anodyne	PRCP	27	40
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548481	FF	On-Demand	Anodyne	COLA	37	44
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548481	FF	On-Demand	Anodyne	GRM5	27	50
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548481	FF	On-Demand	Anodyne	ETHR	56	39
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548482	FF	On-Demand	Anodyne	PRCP	27	40
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548482	FF	On-Demand	Anodyne	COLA	37	44
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548482	FF	On-Demand	Anodyne	GRM5	27	50
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548482	FF	On-Demand	Anodyne	ETHR	56	39
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	CHRM2	27	40
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	HTR1A	24	43
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	CHRM1	23	42
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	DRD2	38	55
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	DRD4	73	55
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	ACHE	45	47
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	HTR2A	17	49
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	OPRM1	21	42
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	DRD3	28	48
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	OPRD1	19	48
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	OPRK1	19	43
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	CHRM3	44	44
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	LTA4H	29	47
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	TACR2	17	40
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	SIGMAR1	57	48
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	SSTR5	61	37
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	CCR3	97	48
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	UTS2R	18	41
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	MLNR	53	42
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	FAAH	26	47
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	CCR2	35	49
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	CXCR3	32	46
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	MCHR1	66	50
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	MGLL	0	43
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	CCR8	22	43
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	AKR1C3	22	42
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	NPFFR1	53	34
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	BRD4	15	42
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	BRD3	25	42
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	KCNK3	46	34
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000450548488	CH	On-Demand	Anodyne	ADIPOR2	0	41
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	CHRM2	27	40
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	HTR1A	24	43
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	CHRM1	23	42
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	DRD2	38	55
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	DRD4	73	55
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	ACHE	45	47
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	HTR2A	17	49
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	OPRM1	21	42
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	DRD3	28	48
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	OPRD1	19	48
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	OPRK1	19	43
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	CHRM3	44	44
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	LTA4H	29	47
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	TACR2	17	40
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	SIGMAR1	57	48
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	SSTR5	61	37
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	CCR3	97	48
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	UTS2R	18	41
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	MLNR	53	42
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	FAAH	26	47
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	CCR2	35	49
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	CXCR3	32	46
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	MCHR1	66	50
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	MGLL	0	43
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	CCR8	22	43
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	AKR1C3	22	42
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	NPFFR1	53	34
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	BRD4	15	42
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	BRD3	25	42
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	KCNK3	46	34
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000450548489	CH	On-Demand	Anodyne	ADIPOR2	0	41
CNC(=O)c1cccnc1NCC1(OC)CCCC1	ZINC000450548491	CD	On-Demand	Anodyne	HCN1	51	32
CCCOc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450548513	CD	On-Demand	Anodyne	NQO2	15	40
CCCOc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450548513	CD	On-Demand	Anodyne	CA7	17	41
CCCOc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450548513	CD	On-Demand	Anodyne	PLA2G4B	55	33
CCCOc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450548513	CD	On-Demand	Anodyne	FAAH	21	43
CCCOc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450548513	CD	On-Demand	Anodyne	EPHX2	17	41
CCCOc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450548513	CD	On-Demand	Anodyne	CA12	20	47
CCCOc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450548513	CD	On-Demand	Anodyne	CA9	20	47
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450548520	FH	On-Demand	Anodyne	RBP4	60	37
CSc1ccc2ncnc(N3CCN(C4CC4)C[C@@H](C)C3)c2c1	ZINC000450548534	EG	On-Demand	Anodyne	PDE3A	48	36
CSc1ccc2ncnc(N3CCN(C4CC4)C[C@@H](C)C3)c2c1	ZINC000450548534	EG	On-Demand	Anodyne	HTT	0	41
CSc1ccc2ncnc(N3CCN(C4CC4)C[C@H](C)C3)c2c1	ZINC000450548535	EG	On-Demand	Anodyne	PDE3A	48	36
CSc1ccc2ncnc(N3CCN(C4CC4)C[C@H](C)C3)c2c1	ZINC000450548535	EG	On-Demand	Anodyne	HTT	0	41
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@@H]3CCOC[C@@H]3OC)C2)nc1	ZINC000450548538	GD	On-Demand	Anodyne	P2RY12	18	40
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@H]3CCOC[C@@H]3OC)C2)nc1	ZINC000450548539	GD	On-Demand	Anodyne	P2RY12	18	40
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@H]3CCOC[C@H]3OC)C2)nc1	ZINC000450548540	GD	On-Demand	Anodyne	P2RY12	18	40
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@@H]3CCOC[C@H]3OC)C2)nc1	ZINC000450548541	GD	On-Demand	Anodyne	P2RY12	18	40
CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450548551	GG	On-Demand	Anodyne	F10	15	40
CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450548551	GG	On-Demand	Anodyne	ROCK2	17	43
CCOC(=O)C[C@@H](C)N(C)C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450548552	GG	On-Demand	Anodyne	F10	15	40
CCOC(=O)C[C@@H](C)N(C)C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450548552	GG	On-Demand	Anodyne	ROCK2	17	43
CCOC(=O)C[C@@H](C)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450548559	FE	On-Demand	Bother	CACNA1C	60	40
CCOC(=O)C[C@@H](C)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450548559	FE	On-Demand	Bother	CACNA1D	92	40
CCOC(=O)C[C@@H](C)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450548559	FE	On-Demand	Bother	IRAK4	24	46
CCOC(=O)C[C@H](C)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450548560	FE	On-Demand	Bother	CACNA1C	60	40
CCOC(=O)C[C@H](C)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450548560	FE	On-Demand	Bother	CACNA1D	92	40
CCOC(=O)C[C@H](C)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450548560	FE	On-Demand	Bother	IRAK4	24	46
CCOC(=O)C[C@@H](C)N(C)C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450548562	EG	On-Demand	Anodyne	PTGDR2	0	40
CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450548563	EG	On-Demand	Anodyne	PTGDR2	0	40
COCC[C@@H](Cc1ccco1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450548565	EF	On-Demand	Anodyne	MMP13	0	43
COCC[C@@H](Cc1ccco1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450548565	EF	On-Demand	Anodyne	NPPA	43	35
COCC[C@H](Cc1ccco1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450548566	EF	On-Demand	Anodyne	MMP13	0	43
COCC[C@H](Cc1ccco1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450548566	EF	On-Demand	Anodyne	NPPA	43	35
C[C@H]1CN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CCN(C2CC2)C1	ZINC000450548567	FD	On-Demand	Bother	ADRA1D	21	40
C[C@H]1CN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CCN(C2CC2)C1	ZINC000450548567	FD	On-Demand	Bother	ADRA1B	25	40
C[C@@H]1CN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CCN(C2CC2)C1	ZINC000450548568	FD	On-Demand	Bother	ADRA1D	21	40
C[C@@H]1CN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CCN(C2CC2)C1	ZINC000450548568	FD	On-Demand	Bother	ADRA1B	25	40
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548595	DF	On-Demand	Anodyne	DRD2	44	41
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548595	DF	On-Demand	Anodyne	DRD3	25	41
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548595	DF	On-Demand	Anodyne	HTR3A	29	41
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548595	DF	On-Demand	Anodyne	HTR4	43	35
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548595	DF	On-Demand	Anodyne	ACKR3	63	32
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548596	DF	On-Demand	Anodyne	DRD2	44	41
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548596	DF	On-Demand	Anodyne	DRD3	25	41
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548596	DF	On-Demand	Anodyne	HTR3A	29	41
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548596	DF	On-Demand	Anodyne	HTR4	43	35
CCCOc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548596	DF	On-Demand	Anodyne	ACKR3	63	32
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548597	DF	On-Demand	Anodyne	DRD2	44	41
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548597	DF	On-Demand	Anodyne	DRD3	25	41
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548597	DF	On-Demand	Anodyne	HTR3A	29	41
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548597	DF	On-Demand	Anodyne	HTR4	43	35
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c(OC)c1	ZINC000450548597	DF	On-Demand	Anodyne	ACKR3	63	32
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548598	DF	On-Demand	Anodyne	DRD2	44	41
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548598	DF	On-Demand	Anodyne	DRD3	25	41
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548598	DF	On-Demand	Anodyne	HTR3A	29	41
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548598	DF	On-Demand	Anodyne	HTR4	43	35
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)c(OC)c1	ZINC000450548598	DF	On-Demand	Anodyne	ACKR3	63	32
CNS(=O)(=O)c1ccc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc1	ZINC000450548603	GD	On-Demand	Anodyne	SLC6A1	26	40
COC(=O)[C@@H]1CN(c2nc3ccccc3c(C)c2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450548605	GH	On-Demand	Mild	SLC6A1	22	42
COC(=O)[C@@H]1CN(c2cccc(Cl)c2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450548627	FG	On-Demand	Mild	SLC6A1	47	45
COC(=O)[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450548633	GD	On-Demand	Anodyne	SLC6A1	46	43
COC(=O)[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450548633	GD	On-Demand	Anodyne	P2RY12	27	40
COC(=O)[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450548633	GD	On-Demand	Anodyne	CXCR3	29	43
COC(=O)[C@@H]1CN(c2c(F)cc(C#N)cc2F)C[C@H]1c1ccc(O)cc1	ZINC000450548636	FF	On-Demand	Mild	SLC6A1	74	44
COC(=O)[C@@H]1CN(c2c(F)cc(C#N)cc2F)C[C@H]1c1ccc(O)cc1	ZINC000450548636	FF	On-Demand	Mild	SLC6A3	24	41
COc1cc(-c2noc(CN3CC[C@H](Nc4ccccc4)C3)n2)ncn1	ZINC000450548637	FE	On-Demand	Anodyne	SSTR5	52	34
COc1cc(-c2noc(CN3CC[C@@H](Nc4ccccc4)C3)n2)ncn1	ZINC000450548638	FE	On-Demand	Anodyne	SSTR5	52	34
COC(=O)[C@@H]1CN(c2ncc(S(N)(=O)=O)s2)C[C@H]1c1ccc(O)cc1	ZINC000450548648	GC	On-Demand	Anodyne	SLC6A1	31	40
COC(=O)[C@@H]1CN(c2ncnc3c(C)cccc23)C[C@H]1c1ccc(O)cc1	ZINC000450548649	FG	On-Demand	Anodyne	SLC6A1	40	40
COC(=O)[C@@H]1CN(c2ncnc3cccc(C)c23)C[C@H]1c1ccc(O)cc1	ZINC000450548671	FG	On-Demand	Anodyne	SLC6A1	38	42
CCOC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)nc1	ZINC000450548682	EF	On-Demand	Anodyne	P2RY12	74	48
CCOC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)nc1	ZINC000450548682	EF	On-Demand	Anodyne	CHRM3	23	47
CCOC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)nc1	ZINC000450548682	EF	On-Demand	Anodyne	LTA4H	24	45
CCOC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)nc1	ZINC000450548682	EF	On-Demand	Anodyne	SSTR5	53	43
CCOC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)nc1	ZINC000450548683	EF	On-Demand	Anodyne	P2RY12	74	48
CCOC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)nc1	ZINC000450548683	EF	On-Demand	Anodyne	CHRM3	23	47
CCOC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)nc1	ZINC000450548683	EF	On-Demand	Anodyne	LTA4H	24	45
CCOC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)nc1	ZINC000450548683	EF	On-Demand	Anodyne	SSTR5	53	43
COC(=O)[C@@H]1CN(c2nnc(Cc3ccccc3)s2)C[C@H]1c1ccc(O)cc1	ZINC000450548685	GG	On-Demand	Anodyne	SLC6A1	49	43
COC(=O)[C@@H]1CN(c2nnc(Cc3ccccc3)s2)C[C@H]1c1ccc(O)cc1	ZINC000450548685	GG	On-Demand	Anodyne	SLC6A3	23	42
c1ccc(-c2nc(C3CCN(C[C@H]4COCCO4)CC3)n[nH]2)cc1	ZINC000450548698	EE	On-Demand	Anodyne	AKT2	38	40
c1ccc(-c2nc(C3CCN(C[C@H]4COCCO4)CC3)n[nH]2)cc1	ZINC000450548698	EE	On-Demand	Anodyne	AKT1	23	40
c1ccc(-c2nc(C3CCN(C[C@@H]4COCCO4)CC3)n[nH]2)cc1	ZINC000450548699	EE	On-Demand	Anodyne	AKT2	38	40
c1ccc(-c2nc(C3CCN(C[C@@H]4COCCO4)CC3)n[nH]2)cc1	ZINC000450548699	EE	On-Demand	Anodyne	AKT1	23	40
COc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)ccnc12	ZINC000450548715	DG	On-Demand	Anodyne	HTR1A	17	42
COc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)ccnc12	ZINC000450548715	DG	On-Demand	Anodyne	ADRA1D	19	42
COc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)ccnc12	ZINC000450548715	DG	On-Demand	Anodyne	ADRA1B	19	40
COc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)ccnc12	ZINC000450548715	DG	On-Demand	Anodyne	EBP	24	42
COc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)ccnc12	ZINC000450548716	DG	On-Demand	Anodyne	HTR1A	17	42
COc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)ccnc12	ZINC000450548716	DG	On-Demand	Anodyne	ADRA1D	19	42
COc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)ccnc12	ZINC000450548716	DG	On-Demand	Anodyne	ADRA1B	19	40
COc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)ccnc12	ZINC000450548716	DG	On-Demand	Anodyne	EBP	24	42
CC(C)N1CCc2nc(NC(=O)[C@@H]3CCCCN3C3CCCC3)sc2C1	ZINC000450548719	GH	On-Demand	Anodyne	APEX1	0	41
CC(C)N1CCc2nc(NC(=O)[C@H]3CCCCN3C3CCCC3)sc2C1	ZINC000450548720	GH	On-Demand	Anodyne	APEX1	0	41
C[C@@H](c1csnn1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450548726	FH	On-Demand	Anodyne	GRM5	23	56
C[C@H](c1csnn1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450548727	FH	On-Demand	Anodyne	GRM5	23	56
C[C@@H](c1csnn1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450548728	FH	On-Demand	Anodyne	GRM5	23	56
C[C@H](c1csnn1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450548729	FH	On-Demand	Anodyne	GRM5	23	56
CCOC(=O)c1ccc(N2CC(NC(=O)C(C)(C)C3CCC3)C2)nc1	ZINC000450548745	EE	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)C[C@@H](C)N(C)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450548754	EF	On-Demand	Anodyne	OPRK1	25	51
CCOC(=O)C[C@H](C)N(C)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450548755	EF	On-Demand	Anodyne	OPRK1	25	51
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccc(C(F)(F)F)[nH]3)C2)nc1	ZINC000450548762	GE	On-Demand	Anodyne	HPGDS	30	40
CCCOc1ccc(C(=O)N2CC(F)C2)c(OC)c1	ZINC000450548803	CE	On-Demand	Anodyne	OXTR	0	43
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)CC1CC(F)(F)C1	ZINC000450548898	FI	On-Demand	Anodyne	RBP4	52	32
CCC(=O)CCCN1CC[C@H](Nc2ccccc2)C1	ZINC000450548899	CF	On-Demand	Anodyne	DRD2	31	40
CCC(=O)CCCN1CC[C@H](Nc2ccccc2)C1	ZINC000450548899	CF	On-Demand	Anodyne	DRD4	26	40
CCC(=O)CCCN1CC[C@H](Nc2ccccc2)C1	ZINC000450548899	CF	On-Demand	Anodyne	SLC6A1	77	34
CCC(=O)CCCN1CC[C@H](Nc2ccccc2)C1	ZINC000450548899	CF	On-Demand	Anodyne	HTR7	50	39
CCC(=O)CCCN1CC[C@H](Nc2ccccc2)C1	ZINC000450548899	CF	On-Demand	Anodyne	CCR3	35	41
CCC(=O)CCCN1CC[C@H](Nc2ccccc2)C1	ZINC000450548899	CF	On-Demand	Anodyne	CYP2J2	53	38
CCC(=O)CCCN1CC[C@@H](Nc2ccccc2)C1	ZINC000450548900	CF	On-Demand	Anodyne	DRD2	31	40
CCC(=O)CCCN1CC[C@@H](Nc2ccccc2)C1	ZINC000450548900	CF	On-Demand	Anodyne	DRD4	26	40
CCC(=O)CCCN1CC[C@@H](Nc2ccccc2)C1	ZINC000450548900	CF	On-Demand	Anodyne	SLC6A1	77	34
CCC(=O)CCCN1CC[C@@H](Nc2ccccc2)C1	ZINC000450548900	CF	On-Demand	Anodyne	HTR7	50	39
CCC(=O)CCCN1CC[C@@H](Nc2ccccc2)C1	ZINC000450548900	CF	On-Demand	Anodyne	CCR3	35	41
CCC(=O)CCCN1CC[C@@H](Nc2ccccc2)C1	ZINC000450548900	CF	On-Demand	Anodyne	CYP2J2	53	38
COC(=O)c1csc(CN2CCC(Nc3ccc(F)cc3)CC2)n1	ZINC000450548903	EG	On-Demand	Anodyne	SSTR5	60	37
COC(=O)c1csc(CN2CCC(Nc3ccc(F)cc3)CC2)n1	ZINC000450548903	EG	On-Demand	Anodyne	MLNR	35	43
COC(=O)c1csc(CN2CCC(Nc3ccc(F)cc3)CC2)n1	ZINC000450548903	EG	On-Demand	Anodyne	CACNA1G	24	42
COC(=O)c1csc(CN2CCC(Nc3ccc(F)cc3)CC2)n1	ZINC000450548903	EG	On-Demand	Anodyne	TRPC6	53	35
COC(=O)[C@@H]1CN(c2nccn3c(C(C)C)nnc23)C[C@H]1c1ccc(O)cc1	ZINC000450548904	GE	On-Demand	Anodyne	SLC6A1	46	38
C[C@H]1c2ccc(F)cc2C[C@@H](C)N1C(=O)c1c[nH]c2nccc-2c1	ZINC000450548906	DH	On-Demand	Anodyne	HCRTR2	0	41
C[C@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1c[nH]c2nccc-2c1	ZINC000450548909	DH	On-Demand	Anodyne	HCRTR2	0	41
C[C@H]1Cc2cc(F)ccc2[C@H](C)N1C(=O)c1c[nH]c2nccc-2c1	ZINC000450548910	DH	On-Demand	Anodyne	HCRTR2	0	41
C[C@@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1c[nH]c2nccc-2c1	ZINC000450548911	DH	On-Demand	Anodyne	HCRTR2	0	41
C[C@@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548914	CD	On-Demand	Anodyne	DRD4	15	43
C[C@@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548914	CD	On-Demand	Anodyne	SIGMAR1	19	42
C[C@@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548914	CD	On-Demand	Anodyne	CCR3	115	43
C[C@@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548914	CD	On-Demand	Anodyne	CCR5	20	48
C[C@@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548914	CD	On-Demand	Anodyne	MLNR	33	42
C[C@@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548914	CD	On-Demand	Anodyne	CCR2	18	41
C[C@@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548914	CD	On-Demand	Anodyne	EPHX2	59	47
C[C@@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548914	CD	On-Demand	Anodyne	BIRC2	79	43
C[C@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548915	CD	On-Demand	Anodyne	DRD4	15	43
C[C@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548915	CD	On-Demand	Anodyne	SIGMAR1	19	42
C[C@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548915	CD	On-Demand	Anodyne	CCR3	115	43
C[C@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548915	CD	On-Demand	Anodyne	CCR5	20	48
C[C@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548915	CD	On-Demand	Anodyne	MLNR	33	42
C[C@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548915	CD	On-Demand	Anodyne	CCR2	18	41
C[C@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548915	CD	On-Demand	Anodyne	EPHX2	59	47
C[C@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548915	CD	On-Demand	Anodyne	BIRC2	79	43
C[C@@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548916	CD	On-Demand	Anodyne	DRD4	15	43
C[C@@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548916	CD	On-Demand	Anodyne	SIGMAR1	19	42
C[C@@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548916	CD	On-Demand	Anodyne	CCR3	115	43
C[C@@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548916	CD	On-Demand	Anodyne	CCR5	20	48
C[C@@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548916	CD	On-Demand	Anodyne	MLNR	33	42
C[C@@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548916	CD	On-Demand	Anodyne	CCR2	18	41
C[C@@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548916	CD	On-Demand	Anodyne	EPHX2	59	47
C[C@@H](O)CCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548916	CD	On-Demand	Anodyne	BIRC2	79	43
C[C@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548917	CD	On-Demand	Anodyne	DRD4	15	43
C[C@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548917	CD	On-Demand	Anodyne	SIGMAR1	19	42
C[C@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548917	CD	On-Demand	Anodyne	CCR3	115	43
C[C@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548917	CD	On-Demand	Anodyne	CCR5	20	48
C[C@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548917	CD	On-Demand	Anodyne	MLNR	33	42
C[C@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548917	CD	On-Demand	Anodyne	CCR2	18	41
C[C@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548917	CD	On-Demand	Anodyne	EPHX2	59	47
C[C@H](O)CCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450548917	CD	On-Demand	Anodyne	BIRC2	79	43
Clc1ccc(-c2noc([C@@H]3CCCN(C[C@@H]4COCCO4)C3)n2)cc1	ZINC000450548925	FF	On-Demand	Anodyne	GRM5	23	45
Clc1ccc(-c2noc([C@H]3CCCN(C[C@@H]4COCCO4)C3)n2)cc1	ZINC000450548927	FF	On-Demand	Anodyne	GRM5	23	45
Clc1ccc(-c2noc([C@H]3CCCN(C[C@H]4COCCO4)C3)n2)cc1	ZINC000450548929	FF	On-Demand	Anodyne	GRM5	23	45
Clc1ccc(-c2noc([C@@H]3CCCN(C[C@H]4COCCO4)C3)n2)cc1	ZINC000450548931	FF	On-Demand	Anodyne	GRM5	23	45
Cc1nc(-c2ccccc2)sc1NC(=O)C1(C(F)(F)F)CCC1	ZINC000450548937	EJ	On-Demand	Anodyne	PPARA	0	40
CCC(=O)CCCN(C)CC(=O)Nc1cc(F)cc(F)c1	ZINC000450548938	CF	On-Demand	Anodyne	LTA4H	19	45
CC1(CNC(=O)c2ccc(N3CCC3)nc2)Cc2ccccc2C1	ZINC000450548944	DF	On-Demand	Anodyne	HDAC1	31	42
CC1(CNC(=O)c2ccc(N3CCC3)nc2)Cc2ccccc2C1	ZINC000450548944	DF	On-Demand	Anodyne	HCN1	40	36
COc1ccc(CC(=O)NCCc2ccc(F)c(F)c2F)c(Cl)c1OC	ZINC000450548947	GH	On-Demand	Anodyne	P2RX7	35	43
COc1ccc(CC(=O)NCCc2ccc(F)c(F)c2F)c(Cl)c1OC	ZINC000450548947	GH	On-Demand	Anodyne	MTNR1A	40	39
COc1ccc(CC(=O)NCCc2ccc(F)c(F)c2F)c(Cl)c1OC	ZINC000450548947	GH	On-Demand	Anodyne	CAN2	0	42
C/C=C/COc1cccc(CC(=O)N[C@@H]2CCCN(C)[C@@H]2C)c1	ZINC000450548955	DF	On-Demand	Anodyne	CHRNA10	43	35
C/C=C\COc1cccc(CC(=O)N[C@@H]2CCCN(C)[C@@H]2C)c1	ZINC000450548956	DF	On-Demand	Anodyne	CHRNA10	43	35
C/C=C/COc1cccc(CC(=O)N[C@@H]2CCCN(C)[C@H]2C)c1	ZINC000450548957	DF	On-Demand	Anodyne	CHRNA10	43	35
C/C=C\COc1cccc(CC(=O)N[C@@H]2CCCN(C)[C@H]2C)c1	ZINC000450548958	DF	On-Demand	Anodyne	CHRNA10	43	35
C[C@@H](c1csnn1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548959	GI	On-Demand	Anodyne	GRM5	21	42
CC(=O)c1cccc(CN2CCc3[nH]c4ccccc4c3C2)c1	ZINC000450548961	DH	On-Demand	Anodyne	DRD5	19	40
CC(=O)c1cccc(CN2CCc3[nH]c4ccccc4c3C2)c1	ZINC000450548961	DH	On-Demand	Anodyne	SSTR4	54	38
CC(=O)c1cccc(CN2CCc3[nH]c4ccccc4c3C2)c1	ZINC000450548961	DH	On-Demand	Anodyne	SSTR5	44	38
CC(=O)c1cccc(CN2CCc3[nH]c4ccccc4c3C2)c1	ZINC000450548961	DH	On-Demand	Anodyne	HTR5A	27	51
CC(=O)c1cccc(CN2CCc3[nH]c4ccccc4c3C2)c1	ZINC000450548961	DH	On-Demand	Anodyne	MCHR2	51	36
C[C@H](c1csnn1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548969	GI	On-Demand	Anodyne	GRM5	21	42
C[C@@H](c1csnn1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548970	GI	On-Demand	Anodyne	GRM5	21	42
C[C@H](c1csnn1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450548971	GI	On-Demand	Anodyne	GRM5	21	42
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	CHRM2	28	44
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	CHRM1	23	42
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	DRD2	36	56
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	DRD4	79	56
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	ACHE	44	56
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	HTR2A	15	48
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	OPRM1	17	42
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	DRD3	27	51
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	OPRD1	20	43
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	KCNH2	16	44
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	CHRM3	36	44
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	LTA4H	43	58
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	HRH3	23	43
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	SIGMAR1	62	49
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	SSTR5	56	38
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	CCR3	82	48
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	UTS2R	24	42
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	SLC18A3	25	41
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	MLNR	80	48
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	CCR2	31	45
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	SLC6A5	30	42
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	CXCR3	43	41
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	MCHR1	58	50
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	NPFFR1	55	39
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	BRD4	18	41
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	NOD2	43	37
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	BRD2	36	41
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	BRD3	29	41
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	ADIPOR1	0	43
CC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450548974	CH	On-Demand	Anodyne	ADIPOR2	0	43
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	CHRM2	28	44
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	CHRM1	23	42
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	DRD2	36	56
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	DRD4	79	56
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	ACHE	44	56
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	HTR2A	15	48
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	OPRM1	17	42
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	DRD3	27	51
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	OPRD1	20	43
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	KCNH2	16	44
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	CHRM3	36	44
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	LTA4H	43	58
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	HRH3	23	43
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	SIGMAR1	62	49
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	SSTR5	56	38
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	CCR3	82	48
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	UTS2R	24	42
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	SLC18A3	25	41
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	MLNR	80	48
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	CCR2	31	45
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	SLC6A5	30	42
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	CXCR3	43	41
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	MCHR1	58	50
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	NPFFR1	55	39
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	BRD4	18	41
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	NOD2	43	37
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	BRD2	36	41
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	BRD3	29	41
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	ADIPOR1	0	43
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450548975	CH	On-Demand	Anodyne	ADIPOR2	0	43
COC(=O)[C@@H]1CN(c2cc(C#N)cc(C)n2)C[C@H]1c1ccc(O)cc1	ZINC000450548978	EE	On-Demand	Mild	SLC6A1	53	40
N#CC1(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)CCC1	ZINC000450548985	DF	On-Demand	Mild	CCR3	73	43
N#CC1(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)CCC1	ZINC000450548985	DF	On-Demand	Mild	EPHX2	43	40
N#CC1(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)CCC1	ZINC000450548986	DF	On-Demand	Mild	CCR3	73	43
N#CC1(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)CCC1	ZINC000450548986	DF	On-Demand	Mild	EPHX2	43	40
COc1n[nH]c(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)n1	ZINC000450548993	FD	On-Demand	Anodyne	CA9	17	41
COc1n[nH]c(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)n1	ZINC000450548993	FD	On-Demand	Anodyne	RORC	52	32
Cc1ccn(CC(=O)Nc2nc3c(s2)CN(C(C)C)CC3)n1	ZINC000450548995	DE	On-Demand	Anodyne	SLC27A1	33	44
Cc1cc(F)c(CC(=O)NCCCc2nc(-c3ccc(F)cc3)no2)cc1F	ZINC000450549004	GH	On-Demand	Anodyne	P2RX7	18	40
Cc1cc(F)c(CC(=O)NCCCc2nc(-c3ccc(F)cc3)no2)cc1F	ZINC000450549004	GH	On-Demand	Anodyne	SPHK1	35	40
CCOC(=O)c1ccc(N2CC(NC(=O)CCCC(C)C)C2)nc1	ZINC000450549009	EE	On-Demand	Anodyne	P2RY12	24	41
COc1ccccc1-n1cnc2cc(C(=O)N(C)C[C@H](O)CO)ccc21	ZINC000450549014	FD	On-Demand	Anodyne	PDGFRB	0	43
COc1ccccc1-n1cnc2cc(C(=O)N(C)C[C@H](O)CO)ccc21	ZINC000450549014	FD	On-Demand	Anodyne	PLK1	52	35
COc1ccccc1-n1cnc2cc(C(=O)N(C)C[C@H](O)CO)ccc21	ZINC000450549014	FD	On-Demand	Anodyne	HPGD	44	56
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549038	FG	On-Demand	Anodyne	PRCP	18	40
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549038	FG	On-Demand	Anodyne	COLA	44	40
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549038	FG	On-Demand	Anodyne	CPT1A	32	40
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549038	FG	On-Demand	Anodyne	GRM5	24	46
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549038	FG	On-Demand	Anodyne	SMO	44	35
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549038	FG	On-Demand	Anodyne	ETHR	55	38
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549039	FG	On-Demand	Anodyne	PRCP	18	40
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549039	FG	On-Demand	Anodyne	COLA	44	40
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549039	FG	On-Demand	Anodyne	CPT1A	32	40
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549039	FG	On-Demand	Anodyne	GRM5	24	46
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549039	FG	On-Demand	Anodyne	SMO	44	35
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1	ZINC000450549039	FG	On-Demand	Anodyne	ETHR	55	38
CCOC(=O)C[C@@H](C)N(C)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450549042	DD	On-Demand	Anodyne	TRPV1	40	48
CCOC(=O)C[C@@H](C)N(C)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450549042	DD	On-Demand	Anodyne	ALOX15	0	47
CCOC(=O)C[C@@H](C)N(C)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450549042	DD	On-Demand	Anodyne	NCE103	28	50
CCOC(=O)C[C@H](C)N(C)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450549043	DD	On-Demand	Anodyne	TRPV1	40	48
CCOC(=O)C[C@H](C)N(C)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450549043	DD	On-Demand	Anodyne	ALOX15	0	47
CCOC(=O)C[C@H](C)N(C)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450549043	DD	On-Demand	Anodyne	NCE103	28	50
COC1(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)CCCC1	ZINC000450549045	EE	On-Demand	Anodyne	NPY1R	40	33
COC1(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)CCCC1	ZINC000450549045	EE	On-Demand	Anodyne	NPY2R	51	35
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)nn1C(C)C	ZINC000450549056	GH	On-Demand	Anodyne	PTGER1	30	51
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)nn1C(C)C	ZINC000450549056	GH	On-Demand	Anodyne	NPY2R	46	38
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H]3Cc4c(C)cccc4O3)C2)nc1	ZINC000450549057	GD	On-Demand	Anodyne	P2RY12	19	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3Cc4c(C)cccc4O3)C2)nc1	ZINC000450549058	GD	On-Demand	Anodyne	P2RY12	19	40
COc1ccc2c(NCC3(OC)CCCC3)ncnc2c1F	ZINC000450549063	DF	On-Demand	Anodyne	PDE6A	40	30
CCc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C	ZINC000450549087	CG	On-Demand	Anodyne	ABL1	41	36
CCc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C	ZINC000450549087	CG	On-Demand	Anodyne	MAPK14	23	44
CCc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C	ZINC000450549087	CG	On-Demand	Anodyne	PRNP	59	42
CCc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C	ZINC000450549087	CG	On-Demand	Anodyne	P4HTM	0	44
CCc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C	ZINC000450549087	CG	On-Demand	Anodyne	DGAT1	51	40
CCc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C	ZINC000450549087	CG	On-Demand	Anodyne	HSPB1	0	43
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc(C)n(C(C)C)n3)C2)nc1	ZINC000450549103	FD	On-Demand	Anodyne	P2RY12	29	42
Fc1cccc(-c2noc([C@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n2)c1	ZINC000450549116	FH	On-Demand	Anodyne	GRM5	28	49
Fc1cccc(-c2noc([C@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n2)c1	ZINC000450549116	FH	On-Demand	Anodyne	ETHR	23	46
Fc1cccc(-c2noc([C@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n2)c1	ZINC000450549118	FH	On-Demand	Anodyne	GRM5	28	49
Fc1cccc(-c2noc([C@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n2)c1	ZINC000450549118	FH	On-Demand	Anodyne	ETHR	23	46
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n2)c1	ZINC000450549120	FH	On-Demand	Anodyne	GRM5	28	49
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n2)c1	ZINC000450549120	FH	On-Demand	Anodyne	ETHR	23	46
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n2)c1	ZINC000450549121	FH	On-Demand	Anodyne	GRM5	28	49
Fc1cccc(-c2noc([C@@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n2)c1	ZINC000450549121	FH	On-Demand	Anodyne	ETHR	23	46
CC(F)(F)CCCNc1nc2ccccc2nc1N1CCOCC1	ZINC000450549131	EG	On-Demand	Anodyne	PIK3CA	18	43
COC(=O)c1coc(CN2CCC(c3nc4ccccc4[nH]3)CC2)n1	ZINC000450549133	EF	On-Demand	Anodyne	SSTR5	40	38
CC1CCN(CCc2cccc(NC(=O)[C@@H](O)C3CCC3)c2)CC1	ZINC000450549138	EG	On-Demand	Anodyne	HTR1D	33	44
CC1CCN(CCc2cccc(NC(=O)[C@@H](O)C3CCC3)c2)CC1	ZINC000450549138	EG	On-Demand	Anodyne	HTR1B	26	44
CC1CCN(CCc2cccc(NC(=O)[C@@H](O)C3CCC3)c2)CC1	ZINC000450549138	EG	On-Demand	Anodyne	SIGMAR1	26	40
CC1CCN(CCc2cccc(NC(=O)[C@@H](O)C3CCC3)c2)CC1	ZINC000450549138	EG	On-Demand	Anodyne	MCHR1	24	43
CC1CCN(CCc2cccc(NC(=O)[C@@H](O)C3CCC3)c2)CC1	ZINC000450549138	EG	On-Demand	Anodyne	BIRC2	80	41
CC1CCN(CCc2cccc(NC(=O)[C@H](O)C3CCC3)c2)CC1	ZINC000450549139	EG	On-Demand	Anodyne	HTR1D	33	44
CC1CCN(CCc2cccc(NC(=O)[C@H](O)C3CCC3)c2)CC1	ZINC000450549139	EG	On-Demand	Anodyne	HTR1B	26	44
CC1CCN(CCc2cccc(NC(=O)[C@H](O)C3CCC3)c2)CC1	ZINC000450549139	EG	On-Demand	Anodyne	SIGMAR1	26	40
CC1CCN(CCc2cccc(NC(=O)[C@H](O)C3CCC3)c2)CC1	ZINC000450549139	EG	On-Demand	Anodyne	MCHR1	24	43
CC1CCN(CCc2cccc(NC(=O)[C@H](O)C3CCC3)c2)CC1	ZINC000450549139	EG	On-Demand	Anodyne	BIRC2	80	41
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	HTR1A	15	53
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	HTR1D	30	41
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	HTR1B	24	41
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	CASR	44	42
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	TACR2	49	34
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	HRH3	16	40
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	SIGMAR1	33	41
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	CCR3	41	40
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	NPFFR2	32	40
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	EPHX2	26	41
O=C(Nc1cccc(CCN2CCCC2)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450549148	GI	On-Demand	Anodyne	NPFFR1	40	33
CNS(=O)(=O)NCC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450549159	FC	On-Demand	Anodyne	DRD4	0	43
CNS(=O)(=O)NCC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450549159	FC	On-Demand	Anodyne	HTR1D	34	45
CNS(=O)(=O)NCC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450549159	FC	On-Demand	Anodyne	HTR1B	30	45
CNS(=O)(=O)NCC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450549159	FC	On-Demand	Anodyne	CCR3	46	37
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	HTR1A	15	48
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	DRD2	17	46
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	DRD4	43	35
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	HTR1D	36	46
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	HTR1B	30	46
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	HTR2A	28	46
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	HTR2C	28	46
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	DRD3	22	46
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	HRH3	18	49
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	SIGMAR1	29	44
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	SRC	22	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	CCR3	40	37
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	JAK1	0	42
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	MET	15	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	TYK2	61	38
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	P2RY14	45	37
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450549170	EJ	On-Demand	Anodyne	KCNK3	64	37
O=C(Nc1cccc(CCN2CCCC2)c1)[C@@H](O)C1CCC1	ZINC000450549176	DE	On-Demand	Anodyne	HTR1D	32	45
O=C(Nc1cccc(CCN2CCCC2)c1)[C@@H](O)C1CCC1	ZINC000450549176	DE	On-Demand	Anodyne	HTR1B	26	45
O=C(Nc1cccc(CCN2CCCC2)c1)[C@@H](O)C1CCC1	ZINC000450549176	DE	On-Demand	Anodyne	HRH3	17	44
O=C(Nc1cccc(CCN2CCCC2)c1)[C@@H](O)C1CCC1	ZINC000450549176	DE	On-Demand	Anodyne	CCR3	53	39
O=C(Nc1cccc(CCN2CCCC2)c1)[C@@H](O)C1CCC1	ZINC000450549176	DE	On-Demand	Anodyne	MCHR1	28	42
O=C(Nc1cccc(CCN2CCCC2)c1)[C@@H](O)C1CCC1	ZINC000450549176	DE	On-Demand	Anodyne	BIRC2	72	44
O=C(Nc1cccc(CCN2CCCC2)c1)[C@H](O)C1CCC1	ZINC000450549177	DE	On-Demand	Anodyne	HTR1D	32	45
O=C(Nc1cccc(CCN2CCCC2)c1)[C@H](O)C1CCC1	ZINC000450549177	DE	On-Demand	Anodyne	HTR1B	26	45
O=C(Nc1cccc(CCN2CCCC2)c1)[C@H](O)C1CCC1	ZINC000450549177	DE	On-Demand	Anodyne	HRH3	17	44
O=C(Nc1cccc(CCN2CCCC2)c1)[C@H](O)C1CCC1	ZINC000450549177	DE	On-Demand	Anodyne	CCR3	53	39
O=C(Nc1cccc(CCN2CCCC2)c1)[C@H](O)C1CCC1	ZINC000450549177	DE	On-Demand	Anodyne	MCHR1	28	42
O=C(Nc1cccc(CCN2CCCC2)c1)[C@H](O)C1CCC1	ZINC000450549177	DE	On-Demand	Anodyne	BIRC2	72	44
COc1ccc(CNC(=O)CCNC2(c3ccc(F)cc3)CC2)c(OC)c1	ZINC000450549180	FG	On-Demand	Anodyne	HTR7	24	40
COc1ccc(CNC(=O)CCNC2(c3ccc(F)cc3)CC2)c(OC)c1	ZINC000450549180	FG	On-Demand	Anodyne	MTNR1A	50	38
COC(=O)c1csc(CN(Cc2ccc3c(c2)OCO3)C2(C)CCCC2)n1	ZINC000450549190	GH	On-Demand	Anodyne	BMP1	64	37
C[C@@H](Nc1cc(C#N)ccn1)c1cccc(C2CC2)c1	ZINC000450549255	CI	On-Demand	Mild	PLK1	27	43
C[C@@H](Nc1cc(C#N)ccn1)c1cccc(C2CC2)c1	ZINC000450549255	CI	On-Demand	Mild	MAP3K12	52	41
C[C@H](Nc1cc(C#N)ccn1)c1cccc(C2CC2)c1	ZINC000450549256	CI	On-Demand	Mild	PLK1	27	43
C[C@H](Nc1cc(C#N)ccn1)c1cccc(C2CC2)c1	ZINC000450549256	CI	On-Demand	Mild	MAP3K12	52	41
c1ccc2c3c([nH]c2c1)CCN(C[C@H]1C[C@H]2CC[C@H]1O2)C3	ZINC000450549269	CG	On-Demand	Anodyne	DRD5	17	43
c1ccc2c3c([nH]c2c1)CCN(C[C@@H]1C[C@H]2CC[C@H]1O2)C3	ZINC000450549270	CG	On-Demand	Anodyne	DRD5	17	43
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3C[C@@]3(C)c3ccccc3)C2)nc1	ZINC000450549296	GF	On-Demand	Anodyne	P2RY12	24	44
Cc1ccc(NC(=O)NC[C@H]2CCCN(Cc3cn(CC4CC4)nn3)C2)cc1	ZINC000450549312	GG	On-Demand	Anodyne	CCR3	92	49
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](CC)CC(C)C)C2)nc1	ZINC000450549318	EF	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](CC)CC(C)C)C2)nc1	ZINC000450549319	EF	On-Demand	Anodyne	P2RY12	21	41
C[C@@H]1[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)CCCN1C	ZINC000450549322	EG	On-Demand	Anodyne	MAPK13	68	33
C[C@@H]1[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)CCCN1C	ZINC000450549322	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
C[C@@H]1[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)CCCN1C	ZINC000450549323	EG	On-Demand	Anodyne	MAPK13	68	33
C[C@@H]1[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)CCCN1C	ZINC000450549323	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
C[C@H]1[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)CCCN1C	ZINC000450549324	EG	On-Demand	Anodyne	MAPK13	68	33
C[C@H]1[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)CCCN1C	ZINC000450549324	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
C[C@H]1[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)CCCN1C	ZINC000450549325	EG	On-Demand	Anodyne	MAPK13	68	33
C[C@H]1[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)CCCN1C	ZINC000450549325	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Cc1nnc2c3ccccc3c(NCCCC(C)(F)F)nn12	ZINC000450549341	DF	On-Demand	Anodyne	CREBBP	43	36
Cc1nnc2c3ccccc3c(NCCCC(C)(F)F)nn12	ZINC000450549341	DF	On-Demand	Anodyne	BRD9	56	40
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450549343	EF	On-Demand	Anodyne	P2RY12	65	37
CCOC(=O)C[C@@H](C)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450549343	EF	On-Demand	Anodyne	AGER	0	41
CCOC(=O)C[C@H](C)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450549344	EF	On-Demand	Anodyne	P2RY12	65	37
CCOC(=O)C[C@H](C)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450549344	EF	On-Demand	Anodyne	AGER	0	41
CCOC(=O)c1ccc(N2CC(NC(=O)CSC3CC3)C2)nc1	ZINC000450549345	ED	On-Demand	Anodyne	P2RY12	21	43
Cc1ccc(NC(=O)NC[C@@H]2CCCN(Cc3cn(CC4CC4)nn3)C2)cc1	ZINC000450549349	GG	On-Demand	Anodyne	CCR3	92	49
COC(=O)c1coc(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)n1	ZINC000450549350	FE	On-Demand	Anodyne	CACNA1G	43	54
COc1ccccc1COC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450549376	FI	On-Demand	Anodyne	CHRM2	16	46
COc1ccccc1COC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450549376	FI	On-Demand	Anodyne	CCR3	20	42
COc1ccccc1COC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450549376	FI	On-Demand	Anodyne	CCR5	37	40
COc1ccccc1COC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450549376	FI	On-Demand	Anodyne	REN	47	37
COc1ccccc1COC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450549376	FI	On-Demand	Anodyne	MBTPS1	48	34
C[C@@H](Nc1ncc([N+](=O)[O-])c(=N)[nH]1)c1cccc(C2CC2)c1	ZINC000450549377	CF	On-Demand	Bother	PRKCQ	24	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(C)[C@H]1C	ZINC000450549379	CD	On-Demand	Anodyne	POL	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(C)[C@@H]1C	ZINC000450549380	CD	On-Demand	Anodyne	POL	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(C)[C@H]1C	ZINC000450549381	CD	On-Demand	Anodyne	POL	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(C)[C@@H]1C	ZINC000450549382	CD	On-Demand	Anodyne	POL	0	43
CNC(=O)c1ccc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)c([N+](=O)[O-])c1	ZINC000450549386	GE	On-Demand	Bother	TAAR1	19	42
C[C@H](Nc1ncc([N+](=O)[O-])c(=N)[nH]1)c1cccc(C2CC2)c1	ZINC000450549387	CF	On-Demand	Bother	PRKCQ	24	40
CC(F)(F)C(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549397	FH	On-Demand	Anodyne	HTR2A	20	41
CC(F)(F)C(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549397	FH	On-Demand	Anodyne	CNR2	0	60
CC(F)(F)C(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549397	FH	On-Demand	Anodyne	NPY2R	36	48
CC(F)(F)C(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549397	FH	On-Demand	Anodyne	EPHX2	34	43
CC(F)(F)C(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549397	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
COc1cc(CN2CCC(NC(C)C)CC2)ccc1Cl	ZINC000450549417	CG	On-Demand	Anodyne	DRD2	24	42
COc1cc(CN2CCC(NC(C)C)CC2)ccc1Cl	ZINC000450549417	CG	On-Demand	Anodyne	DRD4	36	44
COc1cc(CN2CCC(NC(C)C)CC2)ccc1Cl	ZINC000450549417	CG	On-Demand	Anodyne	HTR4	43	39
COc1cc(CN2CCC(NC(C)C)CC2)ccc1Cl	ZINC000450549417	CG	On-Demand	Anodyne	SIGMAR1	44	44
COc1cc(CN2CCC(NC(C)C)CC2)ccc1Cl	ZINC000450549417	CG	On-Demand	Anodyne	SSTR5	88	50
COc1cc(CN2CCC(NC(C)C)CC2)ccc1Cl	ZINC000450549417	CG	On-Demand	Anodyne	CCR3	31	42
COc1cc(CN2CCC(NC(C)C)CC2)ccc1Cl	ZINC000450549417	CG	On-Demand	Anodyne	UTS2R	33	40
COc1cc(CN2CCC(NC(C)C)CC2)ccc1Cl	ZINC000450549417	CG	On-Demand	Anodyne	MCHR1	37	49
O=C1CCC(CN2CCCC[C@@H]2C(=O)Nc2ccc(Cl)cc2Cl)CC1	ZINC000450549420	GJ	On-Demand	Anodyne	CNR2	15	45
O=C1CCC(CN2CCCC[C@@H]2C(=O)Nc2ccc(Cl)cc2Cl)CC1	ZINC000450549420	GJ	On-Demand	Anodyne	P2RX7	29	41
O=C1CCC(CN2CCCC[C@H]2C(=O)Nc2ccc(Cl)cc2Cl)CC1	ZINC000450549421	GJ	On-Demand	Anodyne	CNR2	15	45
O=C1CCC(CN2CCCC[C@H]2C(=O)Nc2ccc(Cl)cc2Cl)CC1	ZINC000450549421	GJ	On-Demand	Anodyne	P2RX7	29	41
Cn1c(C#N)ccc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549424	FF	On-Demand	Mild	EPHX2	21	41
N#CC1(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCC1	ZINC000450549440	FI	On-Demand	Mild	GRM5	22	46
Cc1cccc(Cl)c1C(=O)N1CCN(C2CCN(C)CC2)[C@@H](C)C1	ZINC000450549452	EF	On-Demand	Anodyne	CCR5	25	43
Cc1cccc(Cl)c1C(=O)N1CCN(C2CCN(C)CC2)[C@@H](C)C1	ZINC000450549452	EF	On-Demand	Anodyne	L3MBTL1	0	41
C[C@H]1c2ccc(F)cc2C[C@@H](C)N1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450549454	EI	On-Demand	Anodyne	HCRTR2	31	43
Cc1cccc(Cl)c1C(=O)N1CCN(C2CCN(C)CC2)[C@H](C)C1	ZINC000450549455	EF	On-Demand	Anodyne	CCR5	25	43
Cc1cccc(Cl)c1C(=O)N1CCN(C2CCN(C)CC2)[C@H](C)C1	ZINC000450549455	EF	On-Demand	Anodyne	L3MBTL1	0	41
C[C@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450549459	EI	On-Demand	Anodyne	HCRTR2	31	43
C[C@H]1Cc2cc(F)ccc2[C@H](C)N1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450549460	EI	On-Demand	Anodyne	HCRTR2	31	43
C[C@@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450549461	EI	On-Demand	Anodyne	HCRTR2	31	43
CCCc1cc(C(=O)NC2CN(c3ccc(C(=O)OCC)cn3)C2)no1	ZINC000450549482	FD	On-Demand	Anodyne	P2RY12	20	40
CN(C)CCNS(=O)(=O)c1ccc(N2CCC[C@](C)(F)C2)c([N+](=O)[O-])c1	ZINC000450549497	GD	On-Demand	Bother	BCL2L1	70	34
CN(C)CCNS(=O)(=O)c1ccc(N2CCC[C@](C)(F)C2)c([N+](=O)[O-])c1	ZINC000450549497	GD	On-Demand	Bother	BCL2	63	31
CCCOc1ccc(NC(=O)CNS(=O)(=O)NC)cc1	ZINC000450549499	DC	On-Demand	Anodyne	PLA2G4B	42	32
CCCOc1ccc(NC(=O)CNS(=O)(=O)NC)cc1	ZINC000450549499	DC	On-Demand	Anodyne	CA12	22	51
CCCOc1ccc(NC(=O)CNS(=O)(=O)NC)cc1	ZINC000450549499	DC	On-Demand	Anodyne	CA9	23	51
N#CC1(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CCC1	ZINC000450549501	FI	On-Demand	Mild	GRM5	22	46
CN(C)CCNS(=O)(=O)c1ccc(N2CCC[C@@](C)(F)C2)c([N+](=O)[O-])c1	ZINC000450549506	GD	On-Demand	Bother	BCL2L1	70	34
CN(C)CCNS(=O)(=O)c1ccc(N2CCC[C@@](C)(F)C2)c([N+](=O)[O-])c1	ZINC000450549506	GD	On-Demand	Bother	BCL2	63	31
COC(=O)c1coc(CN2CCC(Nc3ccc(F)cc3)CC2)n1	ZINC000450549509	EF	On-Demand	Anodyne	SSTR5	64	37
COC(=O)c1coc(CN2CCC(Nc3ccc(F)cc3)CC2)n1	ZINC000450549509	EF	On-Demand	Anodyne	MLNR	35	42
COC(=O)c1coc(CN2CCC(Nc3ccc(F)cc3)CC2)n1	ZINC000450549509	EF	On-Demand	Anodyne	CACNA1G	23	61
C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450549514	EG	On-Demand	Anodyne	SLC6A1	99	35
C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450549514	EG	On-Demand	Anodyne	SIGMAR1	37	47
CC[C@@H](O)CC(=O)Nc1ccc2nc(C(F)(F)C(F)(F)F)[nH]c2c1	ZINC000450549515	FG	On-Demand	Anodyne	MCHR1	15	45
C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450549516	EG	On-Demand	Anodyne	SLC6A1	99	35
C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450549516	EG	On-Demand	Anodyne	SIGMAR1	37	47
Clc1ccc(-c2noc([C@H]3CCCN(CCc4cscn4)C3)n2)cc1	ZINC000450549518	FI	On-Demand	Anodyne	GRM5	19	43
C[C@H]1CC[C@@H](C)N1[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450549519	EG	On-Demand	Anodyne	SLC6A1	99	35
C[C@H]1CC[C@@H](C)N1[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450549519	EG	On-Demand	Anodyne	SIGMAR1	37	47
Clc1ccc(-c2noc([C@@H]3CCCN(CCc4cscn4)C3)n2)cc1	ZINC000450549520	FI	On-Demand	Anodyne	GRM5	19	43
C[C@H]1CC[C@@H](C)N1[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450549522	EG	On-Demand	Anodyne	SLC6A1	99	35
C[C@H]1CC[C@@H](C)N1[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450549522	EG	On-Demand	Anodyne	SIGMAR1	37	47
C[C@@H]1[C@H](NC(=O)c2cccc(C(F)(F)F)n2)CCCN1C	ZINC000450549523	DE	On-Demand	Anodyne	SFRP1	46	32
C[C@H]1[C@@H](NC(=O)c2cccc(C(F)(F)F)n2)CCCN1C	ZINC000450549525	DE	On-Demand	Anodyne	SFRP1	46	32
C[C@H]1[C@H](NC(=O)c2cccc(C(F)(F)F)n2)CCCN1C	ZINC000450549526	DE	On-Demand	Anodyne	SFRP1	46	32
C[C@@H]1[C@@H](NC(=O)c2cccc(C(F)(F)F)n2)CCCN1C	ZINC000450549527	DE	On-Demand	Anodyne	SFRP1	46	32
CC[C@H](O)CC(=O)Nc1ccc2nc(C(F)(F)C(F)(F)F)[nH]c2c1	ZINC000450549529	FG	On-Demand	Anodyne	MCHR1	15	45
COc1nc(NC(=O)c2ccc(C(F)(F)F)cc2C)n[nH]1	ZINC000450549548	DE	On-Demand	Anodyne	SORT1	17	46
COc1nc(NC(=O)c2ccc(C(F)(F)F)cc2C)n[nH]1	ZINC000450549548	DE	On-Demand	Anodyne	MTTP	44	34
CC(=O)[C@](C)(O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450549562	DD	On-Demand	Anodyne	CCR3	99	41
CC(=O)[C@](C)(O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450549562	DD	On-Demand	Anodyne	EPHX2	54	44
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	HTR1A	25	60
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	DRD2	37	62
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	DRD1	27	54
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	DRD4	32	55
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	HTR2A	38	62
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	HTR2C	26	62
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	HRH1	15	55
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	DRD3	22	55
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	DRD5	15	48
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	ERG2	22	47
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	HTR7	35	47
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	HRH3	21	42
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	SIGMAR1	31	55
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	CCR3	31	49
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	CHRNA7	24	41
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	SLC18A3	0	46
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	HTR3B	0	54
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	MCHR1	15	43
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	CYP2J2	56	41
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	AP2S1	0	47
O=C(CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1)NC1CCCCC1	ZINC000450549563	GF	On-Demand	Anodyne	SLC27A1	43	34
CC(=O)[C@](C)(O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450549566	DD	On-Demand	Anodyne	CCR3	99	41
CC(=O)[C@](C)(O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450549566	DD	On-Demand	Anodyne	EPHX2	54	44
CC(=O)[C@@](C)(O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450549567	DD	On-Demand	Anodyne	CCR3	99	41
CC(=O)[C@@](C)(O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450549567	DD	On-Demand	Anodyne	EPHX2	54	44
CC(=O)[C@@](C)(O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450549568	DD	On-Demand	Anodyne	CCR3	99	41
CC(=O)[C@@](C)(O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450549568	DD	On-Demand	Anodyne	EPHX2	54	44
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	DRD4	16	44
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	CCR3	61	39
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	COLA	40	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	CPT1A	37	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	S1PR4	20	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	MLNR	55	43
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	GRM5	34	56
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	S1PR1	18	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	S1PR5	41	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	SMO	41	34
CC(=O)c1ccc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549570	GI	On-Demand	Anodyne	ETHR	58	52
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	DRD4	16	44
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	CCR3	61	39
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	COLA	40	41
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	CPT1A	37	41
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	S1PR4	20	41
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	MLNR	55	43
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	GRM5	34	56
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	S1PR1	18	41
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	S1PR5	41	41
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	SMO	41	34
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1	ZINC000450549571	GI	On-Demand	Anodyne	ETHR	58	52
COCC[C@@H](Cc1ccco1)NC(=O)c1ccc2cnccc2c1	ZINC000450549572	DG	On-Demand	Anodyne	AKT1	20	42
COCC[C@H](Cc1ccco1)NC(=O)c1ccc2cnccc2c1	ZINC000450549575	DG	On-Demand	Anodyne	AKT1	20	42
COC1(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)CCCC1	ZINC000450549580	FF	On-Demand	Anodyne	LRRK2	29	42
COC(=O)[C@@H]1CN(c2ccnc(N3CCOCC3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450549583	GD	On-Demand	Anodyne	SLC6A1	23	41
COC(=O)[C@@H]1CN(c2nc(C)c(C#N)cc2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450549601	FG	On-Demand	Mild	SLC6A1	0	42
COC(=O)[C@@H]1CN(c2cnc3cc(F)c(F)cc3n2)C[C@H]1c1ccc(O)cc1	ZINC000450549602	GG	On-Demand	Anodyne	SLC6A1	50	44
COC(=O)[C@@H]1CN(c2cnc3cc(F)c(F)cc3n2)C[C@H]1c1ccc(O)cc1	ZINC000450549602	GG	On-Demand	Anodyne	SLC6A3	24	40
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	DRD2	21	43
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	DRD4	40	44
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	SLC6A1	44	33
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	DRD3	21	43
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	LTA4H	22	42
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	SIGMAR1	26	43
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	CCR3	46	44
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	MLNR	36	42
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	CCR2	22	42
COC(=O)c1cccc(CN2CC[C@H](Nc3ccccc3)C2)c1Cl	ZINC000450549605	EH	On-Demand	Anodyne	MCHR1	26	42
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	DRD2	21	43
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	DRD4	40	44
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	SLC6A1	44	33
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	DRD3	21	43
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	LTA4H	22	42
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	SIGMAR1	26	43
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	CCR3	46	44
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	MLNR	36	42
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	CCR2	22	42
COC(=O)c1cccc(CN2CC[C@@H](Nc3ccccc3)C2)c1Cl	ZINC000450549610	EH	On-Demand	Anodyne	MCHR1	26	42
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	HTR1A	42	41
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	DRD2	44	45
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	DRD4	49	45
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	HTR2A	17	41
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	HRH1	17	42
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	OPRM1	0	40
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	DRD3	49	39
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	TACR1	16	41
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	HTR7	54	47
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	SIGMAR1	32	52
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	SSTR5	22	40
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	BCHE	17	40
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	CCR3	29	41
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	MTNR1A	72	41
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	MTNR1B	67	41
COc1ccc(CNC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549614	GF	On-Demand	Anodyne	MCHR1	36	41
C[C@@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)CCN(C2CC2)C1	ZINC000450549618	GE	On-Demand	Anodyne	HTR3A	28	51
C[C@@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)CCN(C2CC2)C1	ZINC000450549618	GE	On-Demand	Anodyne	HRH4	28	51
C[C@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)CCN(C2CC2)C1	ZINC000450549620	GE	On-Demand	Anodyne	HTR3A	28	51
C[C@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)CCN(C2CC2)C1	ZINC000450549620	GE	On-Demand	Anodyne	HRH4	28	51
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549621	DF	On-Demand	Anodyne	CCR3	42	34
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549621	DF	On-Demand	Anodyne	GRM5	24	47
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549621	DF	On-Demand	Anodyne	SMO	40	35
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549621	DF	On-Demand	Anodyne	ETHR	55	38
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	HTR1A	42	41
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	DRD2	44	45
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	DRD4	49	45
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	HTR2A	17	41
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	HRH1	17	42
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	OPRM1	0	40
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	DRD3	49	39
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	TACR1	16	41
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	HTR7	54	47
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	SIGMAR1	32	52
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	SSTR5	22	40
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	BCHE	17	40
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	CCR3	29	41
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	MTNR1A	72	41
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	MTNR1B	67	41
COc1ccc(CNC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450549622	GF	On-Demand	Anodyne	MCHR1	36	41
C[C@H](O)CCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549624	DF	On-Demand	Anodyne	CCR3	42	34
C[C@H](O)CCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549624	DF	On-Demand	Anodyne	GRM5	24	47
C[C@H](O)CCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549624	DF	On-Demand	Anodyne	SMO	40	35
C[C@H](O)CCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549624	DF	On-Demand	Anodyne	ETHR	55	38
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549625	DF	On-Demand	Anodyne	CCR3	42	34
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549625	DF	On-Demand	Anodyne	GRM5	24	47
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549625	DF	On-Demand	Anodyne	SMO	40	35
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549625	DF	On-Demand	Anodyne	ETHR	55	38
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549627	DF	On-Demand	Anodyne	CCR3	42	34
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549627	DF	On-Demand	Anodyne	GRM5	24	47
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549627	DF	On-Demand	Anodyne	SMO	40	35
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000450549627	DF	On-Demand	Anodyne	ETHR	55	38
COc1n[nH]c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)n1	ZINC000450549639	FD	On-Demand	Mild	NR3C2	48	40
CCCN(Cc1ccc(C(C)=O)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549643	GI	On-Demand	Anodyne	HTR1A	25	41
CCCN(Cc1ccc(C(C)=O)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549643	GI	On-Demand	Anodyne	DRD3	18	41
CCCN(Cc1ccc(C(C)=O)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549643	GI	On-Demand	Anodyne	AVPR1A	25	42
CCCN(Cc1ccc(C(C)=O)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549643	GI	On-Demand	Anodyne	CCR5	23	40
CCCN(Cc1ccc(C(C)=O)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549643	GI	On-Demand	Anodyne	L3MBTL3	80	39
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	ANPEP	26	42
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	MAP	0	46
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	CASP3	17	42
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	ADAM17	0	50
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	MAP1	110	42
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	MTNR1B	26	41
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	MMP3	20	43
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	MMP9	0	50
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	MMP1	22	50
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	GCK	24	43
COc1cccc(OCCC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549646	GG	On-Demand	Anodyne	HPN	49	33
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	ANPEP	26	42
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	MAP	0	46
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	CASP3	17	42
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	ADAM17	0	50
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	MAP1	110	42
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	MTNR1B	26	41
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	MMP3	20	43
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	MMP9	0	50
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	MMP1	22	50
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	GCK	24	43
COc1cccc(OCCC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1	ZINC000450549647	GG	On-Demand	Anodyne	HPN	49	33
COc1n[nH]c(NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)n1	ZINC000450549648	FD	On-Demand	Mild	NR3C2	48	40
CCOC(=O)c1ccc(CN(C(C)C)C2CCCCC2)nc1	ZINC000450549654	DH	On-Demand	Anodyne	SCARB1	55	38
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3ccc(O)c(F)c3)C2)nc1	ZINC000450549656	FD	On-Demand	Anodyne	P2RY12	24	41
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CC3(C#N)CCC3)C2)cc1	ZINC000450549662	EH	On-Demand	Mild	CCR3	55	44
Cc1ccc(NC(=O)NC[C@H]2CCCN(CC3(C#N)CCC3)C2)cc1	ZINC000450549667	EH	On-Demand	Mild	CCR3	55	44
COC(=O)[C@@H]1CN(c2nccnc2OC(C)C)C[C@H]1c1ccc(O)cc1	ZINC000450549668	FE	On-Demand	Anodyne	SLC6A1	58	41
COC(=O)[C@@H]1CN(c2nccnc2OC(C)C)C[C@H]1c1ccc(O)cc1	ZINC000450549668	FE	On-Demand	Anodyne	SLC6A3	26	40
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549675	EH	On-Demand	Anodyne	EPHX2	34	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549676	EH	On-Demand	Anodyne	EPHX2	34	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549677	EH	On-Demand	Anodyne	EPHX2	34	42
O=C(C[C@@H]1CC[C@H]2C[C@H]12)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450549678	EH	On-Demand	Anodyne	EPHX2	34	42
C[C@H]1CCCN(c2cc(NCCCC3CCOCC3)ncn2)C1	ZINC000450549693	DG	On-Demand	Anodyne	PRCP	15	41
C[C@@H]1CCCN(c2cc(NCCCC3CCOCC3)ncn2)C1	ZINC000450549694	DG	On-Demand	Anodyne	PRCP	15	41
Cc1cc(NCCC(C)(F)F)c2cccc([N+](=O)[O-])c2n1	ZINC000450549701	CH	On-Demand	Bother	NFKBIA	0	41
C[C@@H](CN1CCN(CC(=O)N2CCCc3ccccc32)CC1)S(C)(=O)=O	ZINC000450549703	GD	On-Demand	Anodyne	DRD4	20	49
C[C@H](CN1CCN(CC(=O)N2CCCc3ccccc32)CC1)S(C)(=O)=O	ZINC000450549704	GD	On-Demand	Anodyne	DRD4	20	49
O=C(CN1CCN(CCC2=CCCCC2)CC1)N1CCCc2ccccc21	ZINC000450549717	FG	On-Demand	Anodyne	DRD4	20	51
O=C(CN1CCN(CCC2=CCCCC2)CC1)N1CCCc2ccccc21	ZINC000450549717	FG	On-Demand	Anodyne	AVPR2	33	40
C[C@@H](C[S@@](C)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450549719	CD	On-Demand	Anodyne	AKT1	25	49
C[C@@H](C[S@@](C)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450549719	CD	On-Demand	Anodyne	CYP17A1	16	40
C[C@H](C[S@](C)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450549720	CD	On-Demand	Anodyne	AKT1	25	49
C[C@H](C[S@](C)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450549720	CD	On-Demand	Anodyne	CYP17A1	16	40
C[C@H](C[S@@](C)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450549721	CD	On-Demand	Anodyne	AKT1	25	49
C[C@H](C[S@@](C)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450549721	CD	On-Demand	Anodyne	CYP17A1	16	40
C[C@@H](C[S@](C)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450549722	CD	On-Demand	Anodyne	AKT1	25	49
C[C@@H](C[S@](C)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450549722	CD	On-Demand	Anodyne	CYP17A1	16	40
Cc1cc(C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)nn1C(C)C	ZINC000450549727	ED	On-Demand	Anodyne	GALR1	47	34
Cc1cc(C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)nn1C(C)C	ZINC000450549728	ED	On-Demand	Anodyne	GALR1	47	34
C[C@@H](Oc1ccccn1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450549732	ED	On-Demand	Anodyne	GALR1	45	32
C[C@H](Oc1ccccn1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450549733	ED	On-Demand	Anodyne	GALR1	45	32
C[C@H](Oc1ccccn1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450549734	ED	On-Demand	Anodyne	GALR1	45	32
C[C@@H](Oc1ccccn1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450549735	ED	On-Demand	Anodyne	GALR1	45	32
C[C@@H](c1csnn1)N1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450549746	FF	On-Demand	Anodyne	SORD	72	39
C[C@H](c1csnn1)N1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450549747	FF	On-Demand	Anodyne	SORD	72	39
C[C@@H](CN1CCN(c2ccnc(-c3ccccc3)n2)CC1)S(C)(=O)=O	ZINC000450549764	FD	On-Demand	Anodyne	SORD	87	41
C[C@H](CN1CCN(c2ccnc(-c3ccccc3)n2)CC1)S(C)(=O)=O	ZINC000450549765	FD	On-Demand	Anodyne	SORD	87	41
C[C@@H](c1cccc(O)c1)N(C)CCCC(=O)c1ccccc1	ZINC000450549766	CI	On-Demand	Anodyne	GLI1	0	41
C[C@H](c1cccc(O)c1)N(C)CCCC(=O)c1ccccc1	ZINC000450549767	CI	On-Demand	Anodyne	GLI1	0	41
Cc1ccn2ncc(C(=O)NCCCn3ccnn3)c2c1	ZINC000450549772	CD	On-Demand	Anodyne	ALPHA-1A	0	41
CC[C@@H](CC(F)(F)F)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450549779	EF	On-Demand	Anodyne	GALR1	49	36
CC[C@H](CC(F)(F)F)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450549780	EF	On-Demand	Anodyne	GALR1	49	36
CC[C@@H](CC(F)(F)F)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450549781	EF	On-Demand	Anodyne	GALR1	49	36
CC[C@H](CC(F)(F)F)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450549782	EF	On-Demand	Anodyne	GALR1	49	36
CC(F)(F)CCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450549788	CH	On-Demand	Mild	MAP3K8	111	38
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	HTR1A	15	53
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	DRD2	24	53
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	DRD4	54	46
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	ACHE	25	41
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	HRH2	39	48
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	AVPR1B	17	51
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	CHRM3	26	44
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	CNR2	19	42
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	SIGMAR1	34	49
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	SSTR5	52	40
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	CCR3	48	44
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	BDKRB1	41	41
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	FAAH	40	51
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	EPHX2	31	47
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	CXCR3	17	47
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	MCHR1	48	44
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	CACNA1G	24	41
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	MGLL	0	51
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	CCR8	21	45
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	ADIPOR1	0	45
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)c1	ZINC000450549800	FE	On-Demand	Anodyne	ADIPOR2	0	45
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450549805	FH	On-Demand	Anodyne	RBP4	43	30
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450549806	FH	On-Demand	Anodyne	RBP4	43	30
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@@H]1COCCO1	ZINC000450549831	FF	On-Demand	Anodyne	RBP4	44	31
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@H]1COCCO1	ZINC000450549832	FF	On-Demand	Anodyne	RBP4	44	31
CC[C@@H](C(=O)N1CCOC[C@H]1C(N)=O)N1CCO[C@H](CC)C1	ZINC000450549833	DB	On-Demand	Anodyne	TPP2	24	42
CC[C@@H](C(=O)N1CCOC[C@@H]1C(N)=O)N1CCO[C@H](CC)C1	ZINC000450549834	DB	On-Demand	Anodyne	TPP2	24	42
CC[C@@H]1CN([C@H](CC)C(=O)N2CCOC[C@@H]2C(N)=O)CCO1	ZINC000450549835	DB	On-Demand	Anodyne	TPP2	24	42
CC[C@@H]1CN([C@H](CC)C(=O)N2CCOC[C@H]2C(N)=O)CCO1	ZINC000450549836	DB	On-Demand	Anodyne	TPP2	24	42
Fc1ccc(-c2noc([C@H]3CCCN(CC4CC(F)(F)C4)C3)n2)cc1	ZINC000450549839	FI	On-Demand	Anodyne	GRM5	24	59
Fc1ccc(-c2noc([C@@H]3CCCN(CC4CC(F)(F)C4)C3)n2)cc1	ZINC000450549840	FI	On-Demand	Anodyne	GRM5	24	59
COc1ccc(C(=O)N2[C@H](C)Cc3cc(F)ccc3[C@H]2C)cc1S(C)(=O)=O	ZINC000450549843	GG	On-Demand	Anodyne	HCRTR2	30	42
COc1ccc(C(=O)N2[C@@H](C)c3ccc(F)cc3C[C@H]2C)cc1S(C)(=O)=O	ZINC000450549844	GG	On-Demand	Anodyne	HCRTR2	30	42
COc1ccc(C(=O)N2[C@@H](C)Cc3cc(F)ccc3[C@H]2C)cc1S(C)(=O)=O	ZINC000450549845	GG	On-Demand	Anodyne	HCRTR2	30	42
COc1ccc(C(=O)N2[C@@H](C)Cc3cc(F)ccc3[C@@H]2C)cc1S(C)(=O)=O	ZINC000450549846	GG	On-Demand	Anodyne	HCRTR2	30	42
COc1ccc(CCNC(=O)[C@@]2(C)CCC[C@H]2C)cc1S(N)(=O)=O	ZINC000450549850	FD	On-Demand	Anodyne	CA2	15	45
COc1ccc(CCNC(=O)[C@@]2(C)CCC[C@H]2C)cc1S(N)(=O)=O	ZINC000450549850	FD	On-Demand	Anodyne	CA1	15	45
COc1ccc(CCNC(=O)[C@@]2(C)CCC[C@H]2C)cc1S(N)(=O)=O	ZINC000450549850	FD	On-Demand	Anodyne	CA14	16	45
COc1ccc(CCNC(=O)[C@@]2(C)CCC[C@@H]2C)cc1S(N)(=O)=O	ZINC000450549851	FD	On-Demand	Anodyne	CA2	15	45
COc1ccc(CCNC(=O)[C@@]2(C)CCC[C@@H]2C)cc1S(N)(=O)=O	ZINC000450549851	FD	On-Demand	Anodyne	CA1	15	45
COc1ccc(CCNC(=O)[C@@]2(C)CCC[C@@H]2C)cc1S(N)(=O)=O	ZINC000450549851	FD	On-Demand	Anodyne	CA14	16	45
COc1ccc(CCNC(=O)[C@]2(C)CCC[C@H]2C)cc1S(N)(=O)=O	ZINC000450549853	FD	On-Demand	Anodyne	CA2	15	45
COc1ccc(CCNC(=O)[C@]2(C)CCC[C@H]2C)cc1S(N)(=O)=O	ZINC000450549853	FD	On-Demand	Anodyne	CA1	15	45
COc1ccc(CCNC(=O)[C@]2(C)CCC[C@H]2C)cc1S(N)(=O)=O	ZINC000450549853	FD	On-Demand	Anodyne	CA14	16	45
COc1ccc(CCNC(=O)[C@]2(C)CCC[C@@H]2C)cc1S(N)(=O)=O	ZINC000450549856	FD	On-Demand	Anodyne	CA2	15	45
COc1ccc(CCNC(=O)[C@]2(C)CCC[C@@H]2C)cc1S(N)(=O)=O	ZINC000450549856	FD	On-Demand	Anodyne	CA1	15	45
COc1ccc(CCNC(=O)[C@]2(C)CCC[C@@H]2C)cc1S(N)(=O)=O	ZINC000450549856	FD	On-Demand	Anodyne	CA14	16	45
CCC(=O)C1(C(=O)N[C@H](CCOC)Cc2ccco2)CC1	ZINC000450549864	CE	On-Demand	Anodyne	NPPA	45	36
CCC(=O)C1(C(=O)N[C@@H](CCOC)Cc2ccco2)CC1	ZINC000450549865	CE	On-Demand	Anodyne	NPPA	45	36
O=C(CCC(=O)N1CC(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000450549874	CD	On-Demand	Bother	CACNA1D	42	31
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	DRD1	17	47
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	HTR2A	21	83
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	HTR2C	20	83
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	ADRA2B	0	47
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	ADRA2C	0	47
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	DRD5	26	45
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	HTR7	21	42
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	SSTR4	51	37
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	SIGMAR1	15	67
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	SSTR5	40	36
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	HTR5A	50	85
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	CHRNA6	0	40
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCc2[nH]c3ccccc3c2C1)c1ccccc1	ZINC000450549875	DI	On-Demand	Anodyne	CYP2J2	54	38
COc1ccc(CCNC(=O)c2ccc(C)nc2C(C)C)cc1S(N)(=O)=O	ZINC000450549894	GE	On-Demand	Anodyne	CA2	22	48
COc1ccc(CCNC(=O)c2ccc(C)nc2C(C)C)cc1S(N)(=O)=O	ZINC000450549894	GE	On-Demand	Anodyne	CA1	21	48
COc1ccc(CCNC(=O)c2ccc(C)nc2C(C)C)cc1S(N)(=O)=O	ZINC000450549894	GE	On-Demand	Anodyne	CA7	16	48
COc1ccc(CCNC(=O)c2ccc(C)nc2C(C)C)cc1S(N)(=O)=O	ZINC000450549894	GE	On-Demand	Anodyne	CA14	19	48
COc1ccc(CCNC(=O)c2ccc(C)nc2C(C)C)cc1S(N)(=O)=O	ZINC000450549894	GE	On-Demand	Anodyne	CA12	15	40
COc1ccc(CCNC(=O)c2ccc(C)nc2C(C)C)cc1S(N)(=O)=O	ZINC000450549894	GE	On-Demand	Anodyne	CA9	30	40
CCOc1nc2ccc(C(=O)Nc3nc4c(s3)CN(C(C)C)CC4)cc2[nH]1	ZINC000450549904	GG	On-Demand	Anodyne	F10	0	43
Cc1nnnn1-c1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)c(F)c1	ZINC000450549916	ED	On-Demand	Anodyne	CCR3	15	42
Cc1nnnn1-c1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)c(F)c1	ZINC000450549918	ED	On-Demand	Anodyne	CCR3	15	42
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c(F)c1	ZINC000450549919	ED	On-Demand	Anodyne	CCR3	15	42
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)c(F)c1	ZINC000450549920	ED	On-Demand	Anodyne	CCR3	15	42
COc1ccccc1COC1CCN(C(=O)[C@H](O)C2CCC2)CC1	ZINC000450549922	EE	On-Demand	Anodyne	MBTPS1	40	31
COc1ccccc1COC1CCN(C(=O)[C@@H](O)C2CCC2)CC1	ZINC000450549925	EE	On-Demand	Anodyne	MBTPS1	40	31
C[C@H](NC(=O)C1CC(C)(O)C1)c1ccc(CNC(=O)C2CC(C)(O)C2)cc1	ZINC000450549928	FD	On-Demand	Anodyne	SDH1	0	53
C[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc(CNC(=O)C2CC(C)(O)C2)cc1	ZINC000450549929	FD	On-Demand	Anodyne	SDH1	0	53
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1cc2n(n1)CCC2	ZINC000450549944	FE	On-Demand	Anodyne	SPHK1	39	40
CCOC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)nc1	ZINC000450549947	GG	On-Demand	Anodyne	SSTR5	43	37
CCOC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)nc1	ZINC000450549947	GG	On-Demand	Anodyne	AKT2	59	43
CCOC(=O)c1ccc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)nc1	ZINC000450549947	GG	On-Demand	Anodyne	AKT1	34	43
CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450549959	FG	On-Demand	Anodyne	MTNR1A	30	40
CCOC(=O)C[C@H](C)N(C)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450549959	FG	On-Demand	Anodyne	MTNR1B	36	41
CCOC(=O)C[C@@H](C)N(C)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450549960	FG	On-Demand	Anodyne	MTNR1A	30	40
CCOC(=O)C[C@@H](C)N(C)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450549960	FG	On-Demand	Anodyne	MTNR1B	36	41
CCOC(=O)c1ccc(N2CC(NC(=O)c3cc(C(=O)OCC)no3)C2)nc1	ZINC000450549965	GD	On-Demand	Anodyne	P2RY12	25	42
CCOC(=O)c1ccc(N2CC(NC(=O)C(C)(C)C(C)(F)F)C2)nc1	ZINC000450549979	FE	On-Demand	Anodyne	P2RY12	41	41
CCOC(=O)c1ccc(N2CC(NC(=O)C(C)(C)C(C)(F)F)C2)nc1	ZINC000450549979	FE	On-Demand	Anodyne	HPGDS	26	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](C)Oc3ccccn3)C2)nc1	ZINC000450549980	FD	On-Demand	Anodyne	P2RY12	24	42
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](C)Oc3ccccn3)C2)nc1	ZINC000450549981	FD	On-Demand	Anodyne	P2RY12	24	42
C[C@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)CCN(C2CC2)C1	ZINC000450549988	DG	On-Demand	Mild	AR	22	42
C[C@@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)CCN(C2CC2)C1	ZINC000450549989	DG	On-Demand	Mild	AR	22	42
CCCN(CCCC(=O)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549996	GJ	On-Demand	Anodyne	HTR1A	25	44
CCCN(CCCC(=O)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549996	GJ	On-Demand	Anodyne	DRD2	31	42
CCCN(CCCC(=O)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549996	GJ	On-Demand	Anodyne	DRD3	35	44
CCCN(CCCC(=O)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549996	GJ	On-Demand	Anodyne	CYP2J2	54	38
CCCN(CCCC(=O)c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450549996	GJ	On-Demand	Anodyne	L3MBTL3	75	38
CCNC(=O)c1ccc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc1	ZINC000450549997	FD	On-Demand	Anodyne	SLC6A1	46	41
CS[C@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(C)(C)C	ZINC000450550010	FI	On-Demand	Bother	PPXII	0	41
CS[C@@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(C)(C)C	ZINC000450550011	FI	On-Demand	Bother	PPXII	0	41
Cc1cncc(-c2nc(CN3CCC(C(=O)Nc4ccc(F)cc4)CC3)no2)c1	ZINC000450550012	GG	On-Demand	Anodyne	SSTR5	34	41
CCc1cc(CCCN2CCC(Nc3ccc(F)cc3)CC2)on1	ZINC000450550028	EH	On-Demand	Anodyne	DRD2	17	41
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	HTR1A	16	42
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	DRD4	21	43
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	HTR1D	24	41
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	P2RY12	17	48
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	CHRM3	15	44
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	CCKAR	17	40
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	CCR3	33	40
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	FAAH	34	59
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	CCKBR	27	41
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	MGLL	0	45
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	KCNK3	59	40
CC(=O)c1cccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)c1	ZINC000450550040	FH	On-Demand	Anodyne	KCNK9	47	42
COC(=O)c1ccc(CN(CCC(N)=O)c2cccc(C)c2)cc1Cl	ZINC000450550054	FG	On-Demand	Anodyne	NR1H4	42	36
CCC[C@H](O)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	ZINC000450550072	FE	On-Demand	Anodyne	WNT3A	52	34
CCC[C@H](O)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	ZINC000450550076	FE	On-Demand	Anodyne	WNT3A	52	34
CCC[C@@H](O)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	ZINC000450550078	FE	On-Demand	Anodyne	WNT3A	52	34
C[C@]1(F)CCCN(c2ncncc2-c2ccccc2)C1	ZINC000450550079	CG	On-Demand	Anodyne	SLC9A1	15	48
C[C@@]1(F)CCCN(c2ncncc2-c2ccccc2)C1	ZINC000450550080	CG	On-Demand	Anodyne	SLC9A1	15	48
CCC[C@@H](O)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	ZINC000450550081	FE	On-Demand	Anodyne	WNT3A	52	34
C[C@]1(F)CCCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450550103	CH	On-Demand	Anodyne	FAAH	16	45
O=C1NCCN(C(=O)CC2CC(F)(F)C2)[C@H]1Cc1ccccc1	ZINC000450550106	DD	On-Demand	Anodyne	GALR1	43	31
O=C1NCCN(C(=O)CC2CC(F)(F)C2)[C@@H]1Cc1ccccc1	ZINC000450550107	DD	On-Demand	Anodyne	GALR1	43	31
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450550108	GF	On-Demand	Bother	TAAR1	20	45
C[C@@]1(F)CCCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450550109	CH	On-Demand	Anodyne	FAAH	16	45
CCNC(=O)c1ccc(N2CCc3c(F)ccc(Br)c3C2)nn1	ZINC000450550111	GF	On-Demand	Anodyne	SCD1	55	41
CCNC(=O)c1ccc(N2CCc3c(F)ccc(Br)c3C2)nn1	ZINC000450550111	GF	On-Demand	Anodyne	SCD	46	40
CNS(=O)(=O)NCC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450550113	EC	On-Demand	Anodyne	HTR1D	35	48
CNS(=O)(=O)NCC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450550113	EC	On-Demand	Anodyne	HTR1B	30	48
COC(=O)[C@@H]1CN(c2cc(C)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450550114	DD	On-Demand	Anodyne	SLC6A1	82	43
COC(=O)[C@@H]1CN(c2cc(C)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450550114	DD	On-Demand	Anodyne	SLC6A3	25	40
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CC12CCSCC2	ZINC000450550126	GH	On-Demand	Anodyne	EPHX2	34	46
O=C(Nc1ccc(F)cc1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450550128	FI	On-Demand	Anodyne	EPHX2	19	44
O=C(Nc1ccc(F)cc1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450550128	FI	On-Demand	Anodyne	CACNA1G	41	44
O=C(Nc1ccc(F)cc1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450550129	FI	On-Demand	Anodyne	EPHX2	19	44
O=C(Nc1ccc(F)cc1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450550129	FI	On-Demand	Anodyne	CACNA1G	41	44
COC(=O)[C@H](C)NC(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450550130	GF	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@@H]1CN(c2ncnc3c(F)cccc23)C[C@H]1c1ccc(O)cc1	ZINC000450550131	FF	On-Demand	Anodyne	SLC6A1	33	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CC12CCSCC2	ZINC000450550134	GH	On-Demand	Anodyne	EPHX2	34	46
c1ccc(N[C@H]2CCN(CCc3cscn3)C2)cc1	ZINC000450550138	CF	On-Demand	Anodyne	SCN5A	41	35
c1ccc(N[C@@H]2CCN(CCc3cscn3)C2)cc1	ZINC000450550139	CF	On-Demand	Anodyne	SCN5A	41	35
C[C@H](O)CCN1C[C@H](C(N)=O)Cc2ccccc21	ZINC000450550140	BC	On-Demand	Anodyne	ACE	22	40
C[C@H](O)CCN1C[C@H](C(N)=O)Cc2ccccc21	ZINC000450550140	BC	On-Demand	Anodyne	TPP2	59	36
C[C@H](O)CCN1C[C@@H](C(N)=O)Cc2ccccc21	ZINC000450550141	BC	On-Demand	Anodyne	ACE	22	40
C[C@H](O)CCN1C[C@@H](C(N)=O)Cc2ccccc21	ZINC000450550141	BC	On-Demand	Anodyne	TPP2	59	36
C[C@@H](O)CCN1C[C@@H](C(N)=O)Cc2ccccc21	ZINC000450550142	BC	On-Demand	Anodyne	ACE	22	40
C[C@@H](O)CCN1C[C@@H](C(N)=O)Cc2ccccc21	ZINC000450550142	BC	On-Demand	Anodyne	TPP2	59	36
C[C@@H](O)CCN1C[C@H](C(N)=O)Cc2ccccc21	ZINC000450550143	BC	On-Demand	Anodyne	ACE	22	40
C[C@@H](O)CCN1C[C@H](C(N)=O)Cc2ccccc21	ZINC000450550143	BC	On-Demand	Anodyne	TPP2	59	36
CC[S@@](=O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550147	ED	On-Demand	Anodyne	EPHX2	24	40
CC[S@](=O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550148	ED	On-Demand	Anodyne	EPHX2	24	40
c1ccc(CCn2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)n2)cc1	ZINC000450550152	GI	On-Demand	Anodyne	DRD2	0	41
c1ccc(CCn2ccc(CN3CCC(c4nc5ccccc5[nH]4)CC3)n2)cc1	ZINC000450550152	GI	On-Demand	Anodyne	DRD4	31	44
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	HTR1A	17	48
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	HTR1D	33	48
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	HTR1B	28	48
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	KIT	16	40
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	PRNP	41	38
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	HDAC1	24	41
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	ABCB1	18	41
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	MCHR1	16	40
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	TAAR1	31	45
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	HT1	0	42
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	DDR1	42	32
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	DGAT1	40	41
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	HPGDS	25	44
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	KCNK3	58	33
O=C(Nc1cccc(CCN2CCCC2)c1)c1ccc(N2CCC2)nc1	ZINC000450550159	FG	On-Demand	Anodyne	LMGT2	0	42
CCc1nc(CNc2ncnc3ccc(SC)cc23)n[nH]1	ZINC000450550165	DE	On-Demand	Anodyne	CLK4	65	37
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450550167	GF	On-Demand	Anodyne	SLC6A1	22	41
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450550167	GF	On-Demand	Anodyne	PDE3A	51	38
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450550167	GF	On-Demand	Anodyne	PDGFRB	79	42
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450550167	GF	On-Demand	Anodyne	PDE3B	75	38
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450550167	GF	On-Demand	Anodyne	PDGFRA	25	41
O=C(CC1CC(F)(F)C1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550175	FI	On-Demand	Anodyne	HTR1A	26	43
O=C(CC1CC(F)(F)C1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550175	FI	On-Demand	Anodyne	HTR1D	41	43
O=C(CC1CC(F)(F)C1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550175	FI	On-Demand	Anodyne	HTR1B	36	43
O=C(CC1CC(F)(F)C1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550175	FI	On-Demand	Anodyne	SLC6A4	0	45
O=C(CC1CC(F)(F)C1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550175	FI	On-Demand	Anodyne	TPR	16	55
O=C(CC1CC(F)(F)C1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550175	FI	On-Demand	Anodyne	MPO	84	43
C[C@H](O)CCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450550187	ED	On-Demand	Anodyne	DRD4	23	52
C[C@H](O)CCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450550187	ED	On-Demand	Anodyne	AVPR2	36	42
C[C@@H](O)CCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450550188	ED	On-Demand	Anodyne	DRD4	23	52
C[C@@H](O)CCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450550188	ED	On-Demand	Anodyne	AVPR2	36	42
COCCOC[C@H](O)CN1CCc2[nH]c3ccc(F)cc3c2C1	ZINC000450550194	DD	On-Demand	Anodyne	HSP90AB1	34	42
COCCOC[C@@H](O)CN1CCc2[nH]c3ccc(F)cc3c2C1	ZINC000450550196	DD	On-Demand	Anodyne	HSP90AB1	34	42
O=C(Cc1ccc(O)c(F)c1)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550198	GG	On-Demand	Anodyne	F2R	51	32
O=C(Cc1ccc(O)c(F)c1)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550198	GG	On-Demand	Anodyne	EPHX2	32	49
O=C(Cc1ccc(O)c(F)c1)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550198	GG	On-Demand	Anodyne	PFK	0	40
CC(C)CCCC(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550204	DF	On-Demand	Anodyne	BIRC2	43	35
CC(C)CCCC(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550205	DF	On-Demand	Anodyne	BIRC2	43	35
COC(=O)C(C)(C)N(C)Cc1ccn(CCc2ccccc2)n1	ZINC000450550207	DF	On-Demand	Anodyne	FAS	16	40
CC[C@@](NCc1ccc(S(=O)(=O)CC)cc1)(C(=O)OC)c1ccccc1	ZINC000450550208	GG	On-Demand	Anodyne	PTPRB	55	38
CC[C@@](NCc1ccc(S(=O)(=O)CC)cc1)(C(=O)OC)c1ccccc1	ZINC000450550208	GG	On-Demand	Anodyne	RORC	41	36
CC[C@](NCc1ccc(S(=O)(=O)CC)cc1)(C(=O)OC)c1ccccc1	ZINC000450550209	GG	On-Demand	Anodyne	PTPRB	55	38
CC[C@](NCc1ccc(S(=O)(=O)CC)cc1)(C(=O)OC)c1ccccc1	ZINC000450550209	GG	On-Demand	Anodyne	RORC	41	36
CCN(C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1)S(C)(=O)=O	ZINC000450550214	FD	On-Demand	Anodyne	CCR5	48	41
CCN(C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1)S(C)(=O)=O	ZINC000450550217	FD	On-Demand	Anodyne	CCR5	48	41
CCN(C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1)S(C)(=O)=O	ZINC000450550218	FD	On-Demand	Anodyne	CCR5	48	41
CCN(C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1)S(C)(=O)=O	ZINC000450550219	FD	On-Demand	Anodyne	CCR5	48	41
COCc1nn(C)cc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550238	GE	On-Demand	Anodyne	HTR2A	22	40
COCc1nn(C)cc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550238	GE	On-Demand	Anodyne	KDR	16	44
COCc1nn(C)cc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550238	GE	On-Demand	Anodyne	NR1H4	0	44
COCc1nn(C)cc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450550238	GE	On-Demand	Anodyne	EPHX2	28	42
COc1cccc(OCCC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)c1	ZINC000450550242	GG	On-Demand	Anodyne	AVPR1B	19	41
COc1cccc(OCCC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)c1	ZINC000450550242	GG	On-Demand	Anodyne	MTNR1A	37	44
COc1cccc(OCCC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)c1	ZINC000450550242	GG	On-Demand	Anodyne	MTNR1B	36	44
Cn1cc(-c2ccc(C(=O)N[C@H]3CCCN(c4cccnc4)C3=O)o2)cn1	ZINC000450550248	FE	On-Demand	Anodyne	CHRNA7	18	42
Cn1cc(-c2ccc(C(=O)N[C@@H]3CCCN(c4cccnc4)C3=O)o2)cn1	ZINC000450550249	FE	On-Demand	Anodyne	CHRNA7	18	42
C[C@@H]1C[C@@H](CCNC(=O)Cc2ccc(O)c(F)c2)CCO1	ZINC000450550261	CE	On-Demand	Anodyne	NCE103	26	40
C[C@H]1C[C@H](CCNC(=O)Cc2ccc(O)c(F)c2)CCO1	ZINC000450550262	CE	On-Demand	Anodyne	NCE103	26	40
C[C@H]1C[C@@H](CCNC(=O)Cc2ccc(O)c(F)c2)CCO1	ZINC000450550263	CE	On-Demand	Anodyne	NCE103	26	40
C[C@@H]1C[C@H](CCNC(=O)Cc2ccc(O)c(F)c2)CCO1	ZINC000450550264	CE	On-Demand	Anodyne	NCE103	26	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)c1	ZINC000450550274	FE	On-Demand	Anodyne	GPR88	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)c1	ZINC000450550275	FE	On-Demand	Anodyne	GPR88	0	40
Cc1cccc(Cl)c1CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450550287	FG	On-Demand	Anodyne	DRD4	15	42
Cc1cccc(Cl)c1CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450550287	FG	On-Demand	Anodyne	SIGMAR1	16	40
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550288	EG	On-Demand	Anodyne	C3AR1	40	36
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550288	EG	On-Demand	Anodyne	MMP1	23	42
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550288	EG	On-Demand	Anodyne	BIRC2	47	37
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550289	EG	On-Demand	Anodyne	C3AR1	40	36
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550289	EG	On-Demand	Anodyne	MMP1	23	42
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550289	EG	On-Demand	Anodyne	BIRC2	47	37
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450550296	FE	On-Demand	Anodyne	CALCRL	15	41
O=C(N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450550297	FE	On-Demand	Anodyne	CALCRL	15	41
CCC[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000450550298	CG	On-Demand	Anodyne	CTSD	20	45
CCC[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000450550298	CG	On-Demand	Anodyne	BACE1	21	45
CCC[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000450550299	CG	On-Demand	Anodyne	CTSD	20	45
CCC[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000450550299	CG	On-Demand	Anodyne	BACE1	21	45
COc1cccc([C@@H]2C[C@H]2C(=O)N2C[C@@H](C)CC(C)(C)C2)c1	ZINC000450550315	DH	On-Demand	Anodyne	NPBWR1	42	29
COc1cccc([C@@H]2C[C@H]2C(=O)N2C[C@H](C)CC(C)(C)C2)c1	ZINC000450550316	DH	On-Demand	Anodyne	NPBWR1	42	29
CC[C@H](O)CC(=O)N1CCC(OCc2ccccc2OC)CC1	ZINC000450550322	DE	On-Demand	Anodyne	RORC	44	37
CC[C@@H](O)CC(=O)N1CCC(OCc2ccccc2OC)CC1	ZINC000450550323	DE	On-Demand	Anodyne	RORC	44	37
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450550344	DF	On-Demand	Anodyne	GPR88	0	55
COC(=O)c1coc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)n1	ZINC000450550351	GG	On-Demand	Anodyne	GRM5	22	45
COC(=O)c1coc(CN2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)n1	ZINC000450550351	GG	On-Demand	Anodyne	ETHR	49	36
COC(=O)c1coc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)n1	ZINC000450550353	GG	On-Demand	Anodyne	GRM5	22	45
COC(=O)c1coc(CN2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)n1	ZINC000450550353	GG	On-Demand	Anodyne	ETHR	49	36
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)[C@H]2CCCN(C)C2=O)c1	ZINC000450550358	EE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)[C@H]2CCCN(C)C2=O)c1	ZINC000450550359	EE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)[C@@H]2CCCN(C)C2=O)c1	ZINC000450550360	EE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)[C@@H]2CCCN(C)C2=O)c1	ZINC000450550361	EE	On-Demand	Anodyne	DRD4	41	32
C[C@H]1CN(c2ccnc(N(C)C)n2)CCN(C2CC2)C1	ZINC000450550372	CD	On-Demand	Anodyne	SORD	60	33
C[C@@H]1CN(c2ccnc(N(C)C)n2)CCN(C2CC2)C1	ZINC000450550373	CD	On-Demand	Anodyne	SORD	60	33
COC[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450550397	CE	On-Demand	Anodyne	TIMP3	64	34
C[C@@H]1[C@H](NC(=O)c2cncc(Cl)c2)CCCN1C	ZINC000450550425	CD	On-Demand	Anodyne	CACNA1I	46	31
CNS(=O)(=O)NCC(=O)NCC1(c2ccc(Cl)cc2Cl)CCC1	ZINC000450550430	GD	On-Demand	Anodyne	SLC6A9	43	35
CC[C@@H](O)CC(=O)NCC1(c2ccc(Cl)cc2Cl)CCC1	ZINC000450550431	EH	On-Demand	Anodyne	MTNR1A	0	42
CC[C@@H](O)CC(=O)NCC1(c2ccc(Cl)cc2Cl)CCC1	ZINC000450550431	EH	On-Demand	Anodyne	ACAT	0	42
CC[C@H](O)CC(=O)NCC1(c2ccc(Cl)cc2Cl)CCC1	ZINC000450550432	EH	On-Demand	Anodyne	MTNR1A	0	42
CC[C@H](O)CC(=O)NCC1(c2ccc(Cl)cc2Cl)CCC1	ZINC000450550432	EH	On-Demand	Anodyne	ACAT	0	42
C[C@H]1[C@@H](NC(=O)c2cncc(Cl)c2)CCCN1C	ZINC000450550434	CD	On-Demand	Anodyne	CACNA1I	46	31
C[C@H]1[C@H](NC(=O)c2cncc(Cl)c2)CCCN1C	ZINC000450550435	CD	On-Demand	Anodyne	CACNA1I	46	31
C[C@@H]1[C@@H](NC(=O)c2cncc(Cl)c2)CCCN1C	ZINC000450550436	CD	On-Demand	Anodyne	CACNA1I	46	31
COC(=O)c1coc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)n1	ZINC000450550440	FF	On-Demand	Anodyne	AKT2	47	41
COC(=O)c1coc(CN2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)n1	ZINC000450550440	FF	On-Demand	Anodyne	AKT1	24	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)C2)nc1	ZINC000450550441	FD	On-Demand	Anodyne	P2RY12	28	40
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCCC#N	ZINC000450550442	DF	On-Demand	Mild	PAPA1_CARPA	49	32
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCCC#N	ZINC000450550442	DF	On-Demand	Mild	CTSL	22	40
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCCC#N	ZINC000450550442	DF	On-Demand	Mild	CTSS	28	40
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCCC#N	ZINC000450550442	DF	On-Demand	Mild	CTRB_BOVIN	46	35
CCOC(=O)c1ccc(N2CC(NC(=O)C[S@](=O)CC)C2)nc1	ZINC000450550446	EC	On-Demand	Anodyne	P2RY12	24	43
CCOC(=O)c1ccc(N2CC(NC(=O)C[S@@](=O)CC)C2)nc1	ZINC000450550447	EC	On-Demand	Anodyne	P2RY12	24	43
COC1(CNc2cnn(Cc3ccccc3)c(=O)c2Cl)CCCC1	ZINC000450550456	EG	On-Demand	Anodyne	NPBWR1	51	44
C[C@H]1CN(c2nc(-c3cccc(Cl)c3)no2)CCN(C2CC2)C1	ZINC000450550460	EG	On-Demand	Anodyne	GRM5	28	49
C[C@@H]1CN(c2nc(-c3cccc(Cl)c3)no2)CCN(C2CC2)C1	ZINC000450550461	EG	On-Demand	Anodyne	GRM5	28	49
Cc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)ncnc12	ZINC000450550465	CF	On-Demand	Anodyne	EBP	23	40
Cc1cccc2c(N3CCN(C4CC4)C[C@@H](C)C3)ncnc12	ZINC000450550465	CF	On-Demand	Anodyne	PDE3B	48	31
Cc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)ncnc12	ZINC000450550466	CF	On-Demand	Anodyne	EBP	23	40
Cc1cccc2c(N3CCN(C4CC4)C[C@H](C)C3)ncnc12	ZINC000450550466	CF	On-Demand	Anodyne	PDE3B	48	31
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCn1ccnn1	ZINC000450550501	DE	On-Demand	Anodyne	SORT1	15	41
Nc1ncccc1CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450550522	EE	On-Demand	Anodyne	DRD4	30	43
Nc1ncccc1CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450550522	EE	On-Demand	Anodyne	SORD	64	37
CCOC(=O)[C@@H](C)N(C)CCc1cscn1	ZINC000450550530	BD	On-Demand	Anodyne	BMP1	46	35
CCOC(=O)[C@H](C)N(C)CCc1cscn1	ZINC000450550531	BD	On-Demand	Anodyne	BMP1	46	35
CC1(O)CC(C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)C1	ZINC000450550544	DC	On-Demand	Anodyne	GALR1	46	33
CC1(O)CC(C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)C1	ZINC000450550545	DC	On-Demand	Anodyne	GALR1	46	33
COC(=O)C1(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)CC1	ZINC000450550546	FE	On-Demand	Anodyne	HTR1A	21	40
COC(=O)C1(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)CC1	ZINC000450550546	FE	On-Demand	Anodyne	DRD3	18	40
COC(=O)C1(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)CC1	ZINC000450550546	FE	On-Demand	Anodyne	SORD	75	38
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550565	FE	On-Demand	Anodyne	ACE	54	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550565	FE	On-Demand	Anodyne	FKBP1A	36	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550565	FE	On-Demand	Anodyne	MME	27	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550565	FE	On-Demand	Anodyne	CHRNA7	41	37
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550565	FE	On-Demand	Anodyne	C3AR1	44	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550565	FE	On-Demand	Anodyne	XIAP	37	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550565	FE	On-Demand	Anodyne	BIRC3	50	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550565	FE	On-Demand	Anodyne	BIRC2	78	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550566	FE	On-Demand	Anodyne	ACE	54	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550566	FE	On-Demand	Anodyne	FKBP1A	36	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550566	FE	On-Demand	Anodyne	MME	27	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550566	FE	On-Demand	Anodyne	CHRNA7	41	37
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550566	FE	On-Demand	Anodyne	C3AR1	44	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550566	FE	On-Demand	Anodyne	XIAP	37	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550566	FE	On-Demand	Anodyne	BIRC3	50	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450550566	FE	On-Demand	Anodyne	BIRC2	78	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550567	FE	On-Demand	Anodyne	ACE	54	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550567	FE	On-Demand	Anodyne	FKBP1A	36	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550567	FE	On-Demand	Anodyne	MME	27	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550567	FE	On-Demand	Anodyne	CHRNA7	41	37
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550567	FE	On-Demand	Anodyne	C3AR1	44	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550567	FE	On-Demand	Anodyne	XIAP	37	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550567	FE	On-Demand	Anodyne	BIRC3	50	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550567	FE	On-Demand	Anodyne	BIRC2	78	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550568	FE	On-Demand	Anodyne	ACE	54	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550568	FE	On-Demand	Anodyne	FKBP1A	36	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550568	FE	On-Demand	Anodyne	MME	27	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550568	FE	On-Demand	Anodyne	CHRNA7	41	37
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550568	FE	On-Demand	Anodyne	C3AR1	44	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550568	FE	On-Demand	Anodyne	XIAP	37	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550568	FE	On-Demand	Anodyne	BIRC3	50	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450550568	FE	On-Demand	Anodyne	BIRC2	78	40
CC(F)(F)CCNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000450550577	DD	On-Demand	Bother	CYNT	37	42
COC(=O)[C@H](NCCN(C)Cc1ccccc1)c1ccccc1	ZINC000450550603	DF	On-Demand	Anodyne	ACHE	0	43
COC(=O)[C@@H](NCCN(C)Cc1ccccc1)c1ccccc1	ZINC000450550604	DF	On-Demand	Anodyne	ACHE	0	43
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	KCNH2	15	43
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	LTA4H	17	47
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	ADORA2B	40	39
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	SIGMAR1	39	48
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	SSTR5	75	45
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	CCR3	50	46
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	MLNR	74	54
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	MCHR1	35	45
CCS(=O)(=O)c1ccc(CN2CCC(Nc3ccc(F)cc3)CC2)cc1	ZINC000450550617	GH	On-Demand	Anodyne	CACNA1G	39	43
COC(=O)[C@@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@H]1c1ccc(O)cc1	ZINC000450550628	GH	On-Demand	Anodyne	SLC6A1	60	42
COC(=O)[C@@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@H]1c1ccc(O)cc1	ZINC000450550628	GH	On-Demand	Anodyne	SLC6A4	16	42
COC(=O)[C@@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@H]1c1ccc(O)cc1	ZINC000450550628	GH	On-Demand	Anodyne	SLC6A3	30	43
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	SLC6A1	59	38
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	PRCP	31	44
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	PLA2G2A	0	40
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	COLA	44	46
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	CPT1A	37	46
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	S1PR4	20	41
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	GRM5	27	50
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	S1PR1	15	41
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	SPHK1	23	41
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	S1PR5	36	41
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550629	FI	On-Demand	Anodyne	ETHR	57	39
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	SLC6A1	59	38
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	PRCP	31	44
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	PLA2G2A	0	40
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	COLA	44	46
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	CPT1A	37	46
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	S1PR4	20	41
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	GRM5	27	50
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	S1PR1	15	41
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	SPHK1	23	41
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	S1PR5	36	41
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450550630	FI	On-Demand	Anodyne	ETHR	57	39
CCc1cccc(C(=O)NCCc2ccc(F)c(F)c2F)n1	ZINC000450550647	DG	On-Demand	Anodyne	PDE5A	18	40
COc1cccc(-n2cc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)nn2)c1	ZINC000450550654	ED	On-Demand	Anodyne	DRD4	44	34
COc1cccc(-n2cc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)nn2)c1	ZINC000450550655	ED	On-Demand	Anodyne	DRD4	44	34
COc1cccc(-n2cc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)nn2)c1	ZINC000450550656	ED	On-Demand	Anodyne	DRD4	44	34
COc1cccc(-n2cc(C(=O)N[C@H]3CCCN(C)[C@H]3C)nn2)c1	ZINC000450550657	ED	On-Demand	Anodyne	DRD4	44	34
COC(=O)[C@@H]1CN(c2ncccc2S(C)(=O)=O)C[C@H]1c1ccc(O)cc1	ZINC000450550669	GD	On-Demand	Anodyne	SLC6A1	46	41
Cc1cnc(CCCC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)o1	ZINC000450550691	GG	On-Demand	Anodyne	HTR2A	15	40
Cc1cnc(CCCC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)o1	ZINC000450550691	GG	On-Demand	Anodyne	EPHX2	26	41
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	ABL1	44	41
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	CASR	35	46
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	LCK	20	42
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	RAF1	16	43
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	EPHX2	33	50
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	NOD1	26	41
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	NOD2	39	41
CSc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450550723	GI	On-Demand	Anodyne	KCNK3	76	36
COc1ccc(C(=O)N[C@@]2(C)CCO[C@@H]2C)cc1S(C)(=O)=O	ZINC000450550750	ED	On-Demand	Anodyne	COLA	51	34
COc1ccc(C(=O)N[C@@]2(C)CCO[C@@H]2C)cc1S(C)(=O)=O	ZINC000450550750	ED	On-Demand	Anodyne	CPT1A	49	34
COc1ccc(C(=O)N[C@@]2(C)CCO[C@H]2C)cc1S(C)(=O)=O	ZINC000450550752	ED	On-Demand	Anodyne	COLA	51	34
COc1ccc(C(=O)N[C@@]2(C)CCO[C@H]2C)cc1S(C)(=O)=O	ZINC000450550752	ED	On-Demand	Anodyne	CPT1A	49	34
COc1ccc(C(=O)N[C@]2(C)CCO[C@@H]2C)cc1S(C)(=O)=O	ZINC000450550753	ED	On-Demand	Anodyne	COLA	51	34
COc1ccc(C(=O)N[C@]2(C)CCO[C@@H]2C)cc1S(C)(=O)=O	ZINC000450550753	ED	On-Demand	Anodyne	CPT1A	49	34
COc1ccc(C(=O)N[C@]2(C)CCO[C@H]2C)cc1S(C)(=O)=O	ZINC000450550754	ED	On-Demand	Anodyne	COLA	51	34
COc1ccc(C(=O)N[C@]2(C)CCO[C@H]2C)cc1S(C)(=O)=O	ZINC000450550754	ED	On-Demand	Anodyne	CPT1A	49	34
CC(F)(F)C(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550799	FI	On-Demand	Anodyne	HTR1A	24	46
CC(F)(F)C(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550799	FI	On-Demand	Anodyne	HTR1D	45	46
CC(F)(F)C(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550799	FI	On-Demand	Anodyne	HTR1B	33	46
CC(F)(F)C(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550799	FI	On-Demand	Anodyne	NQO2	18	47
CC(F)(F)C(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550799	FI	On-Demand	Anodyne	MPO	88	44
CC(F)(F)C(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450550799	FI	On-Demand	Anodyne	ABCG2	24	40
Cc1nc(C2CC2)ccc1C(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550817	FH	On-Demand	Anodyne	ADAM17	0	52
Cc1nc(C2CC2)ccc1C(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550817	FH	On-Demand	Anodyne	MAP1	116	38
Cc1nc(C2CC2)ccc1C(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550817	FH	On-Demand	Anodyne	HPN	41	31
Cc1nc(C2CC2)ccc1C(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550818	FH	On-Demand	Anodyne	ADAM17	0	52
Cc1nc(C2CC2)ccc1C(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550818	FH	On-Demand	Anodyne	MAP1	116	38
Cc1nc(C2CC2)ccc1C(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550818	FH	On-Demand	Anodyne	HPN	41	31
Cc1nc(S(=O)(=O)N2CCN(CCN(C)Cc3ccccc3)CC2)cs1	ZINC000450550838	GD	On-Demand	Anodyne	SIGMAR1	18	41
COc1cc(CC(=O)Nc2cc(F)c(OC(C)C)c(F)c2)ccc1O	ZINC000450550841	FH	On-Demand	Anodyne	TRPV1	32	49
COc1cc(CC(=O)Nc2cc(F)c(OC(C)C)c(F)c2)ccc1O	ZINC000450550841	FH	On-Demand	Anodyne	NCE103	23	45
COc1cc(CC(=O)Nc2cc(F)c(OC(C)C)c(F)c2)ccc1O	ZINC000450550841	FH	On-Demand	Anodyne	CAN2	0	45
CCN(c1ccccc1)S(=O)(=O)c1ccc(=NCCCC(C)(F)F)[nH]c1	ZINC000450550851	GH	On-Demand	Anodyne	NR1I2	15	42
C[C@@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1ccsn1	ZINC000450550855	CG	On-Demand	Anodyne	HCRTR2	27	40
COCC[C@H](Cc1ccco1)NC(=O)c1coc2c1C(=O)CCC2	ZINC000450550856	EF	On-Demand	Anodyne	NPPA	41	34
COCC[C@@H](Cc1ccco1)NC(=O)c1coc2c1C(=O)CCC2	ZINC000450550857	EF	On-Demand	Anodyne	NPPA	41	34
COC(=O)C(C)(C)N(C)Cc1ccc(Cl)c(OC)c1	ZINC000450550874	CF	On-Demand	Anodyne	TRPV1	36	44
COC(=O)C(C)(C)N(C)Cc1ccc(Cl)c(OC)c1	ZINC000450550874	CF	On-Demand	Anodyne	MT-ND1	25	40
COc1cc2c(N3CCN(C4CC4)C[C@@H](C)C3)ncnc2cc1F	ZINC000450550876	EF	On-Demand	Anodyne	PDE3A	62	47
COc1cc2c(N3CCN(C4CC4)C[C@@H](C)C3)ncnc2cc1F	ZINC000450550876	EF	On-Demand	Anodyne	PDGFRB	65	41
COc1cc2c(N3CCN(C4CC4)C[C@@H](C)C3)ncnc2cc1F	ZINC000450550876	EF	On-Demand	Anodyne	PDE3B	92	47
COc1cc2c(N3CCN(C4CC4)C[C@H](C)C3)ncnc2cc1F	ZINC000450550879	EF	On-Demand	Anodyne	PDE3A	62	47
COc1cc2c(N3CCN(C4CC4)C[C@H](C)C3)ncnc2cc1F	ZINC000450550879	EF	On-Demand	Anodyne	PDGFRB	65	41
COc1cc2c(N3CCN(C4CC4)C[C@H](C)C3)ncnc2cc1F	ZINC000450550879	EF	On-Demand	Anodyne	PDE3B	92	47
CC(F)(F)CCCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450550880	DH	On-Demand	Anodyne	DHOD	0	46
Fc1cccc(-c2noc([C@@H]3CCCN(Cc4cnns4)C3)n2)c1	ZINC000450550881	EG	On-Demand	Anodyne	GRM5	29	53
Fc1cccc(-c2noc([C@@H]3CCCN(Cc4cnns4)C3)n2)c1	ZINC000450550881	EG	On-Demand	Anodyne	ETHR	35	47
Fc1cccc(-c2noc([C@H]3CCCN(Cc4cnns4)C3)n2)c1	ZINC000450550883	EG	On-Demand	Anodyne	GRM5	29	53
Fc1cccc(-c2noc([C@H]3CCCN(Cc4cnns4)C3)n2)c1	ZINC000450550883	EG	On-Demand	Anodyne	ETHR	35	47
C[C@H]1Cc2cc(F)ccc2[C@H](C)N1C(=O)c1ccsn1	ZINC000450550885	CG	On-Demand	Anodyne	HCRTR2	27	40
C[C@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1ccsn1	ZINC000450550886	CG	On-Demand	Anodyne	HCRTR2	27	40
C[C@H]1c2ccc(F)cc2C[C@@H](C)N1C(=O)c1ccsn1	ZINC000450550887	CG	On-Demand	Anodyne	HCRTR2	27	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@]3(C#N)C[C@@H]3C)C2)nc1	ZINC000450550888	ED	On-Demand	Mild	P2RY12	40	42
CC(F)(F)CCCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450550890	DI	On-Demand	Mild	MAP3K8	80	37
CCOC(=O)c1ccc(N2CC(NC(=O)[C@]3(C#N)C[C@H]3C)C2)nc1	ZINC000450550897	ED	On-Demand	Mild	P2RY12	40	42
CCOC(=O)c1ccc(N2CC(NC(=O)[C@]3(C#N)C[C@@H]3C)C2)nc1	ZINC000450550900	ED	On-Demand	Mild	P2RY12	40	42
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@]3(C#N)C[C@H]3C)C2)nc1	ZINC000450550903	ED	On-Demand	Mild	P2RY12	40	42
CC[C@@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550909	DD	On-Demand	Anodyne	ADAM17	0	57
CC[C@@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550909	DD	On-Demand	Anodyne	MAP1	122	43
CC[C@@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550909	DD	On-Demand	Anodyne	MMP3	28	48
CC[C@@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550909	DD	On-Demand	Anodyne	MMP9	0	57
CC[C@@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550909	DD	On-Demand	Anodyne	CAPN2	52	34
CC[C@@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550909	DD	On-Demand	Anodyne	MMP1	0	57
CC[C@@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550912	DD	On-Demand	Anodyne	ADAM17	0	57
CC[C@@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550912	DD	On-Demand	Anodyne	MAP1	122	43
CC[C@@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550912	DD	On-Demand	Anodyne	MMP3	28	48
CC[C@@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550912	DD	On-Demand	Anodyne	MMP9	0	57
CC[C@@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550912	DD	On-Demand	Anodyne	CAPN2	52	34
CC[C@@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550912	DD	On-Demand	Anodyne	MMP1	0	57
CC[C@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550914	DD	On-Demand	Anodyne	ADAM17	0	57
CC[C@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550914	DD	On-Demand	Anodyne	MAP1	122	43
CC[C@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550914	DD	On-Demand	Anodyne	MMP3	28	48
CC[C@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550914	DD	On-Demand	Anodyne	MMP9	0	57
CC[C@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550914	DD	On-Demand	Anodyne	CAPN2	52	34
CC[C@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550914	DD	On-Demand	Anodyne	MMP1	0	57
CC[C@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550915	DD	On-Demand	Anodyne	ADAM17	0	57
CC[C@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550915	DD	On-Demand	Anodyne	MAP1	122	43
CC[C@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550915	DD	On-Demand	Anodyne	MMP3	28	48
CC[C@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550915	DD	On-Demand	Anodyne	MMP9	0	57
CC[C@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550915	DD	On-Demand	Anodyne	CAPN2	52	34
CC[C@H](O)CC(=O)N[C@H](CC(C)C)C(=O)Nc1nccs1	ZINC000450550915	DD	On-Demand	Anodyne	MMP1	0	57
CCC(=O)CCCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550931	EH	On-Demand	Anodyne	SLC6A1	84	37
CCC(=O)CCCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550931	EH	On-Demand	Anodyne	HRH3	23	40
CCC(=O)CCCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550931	EH	On-Demand	Anodyne	COLA	41	40
CCC(=O)CCCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550931	EH	On-Demand	Anodyne	CPT1A	38	40
CCC(=O)CCCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550931	EH	On-Demand	Anodyne	GRM5	32	56
CCC(=O)CCCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550931	EH	On-Demand	Anodyne	SMO	40	34
CCC(=O)CCCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550931	EH	On-Demand	Anodyne	ETHR	61	54
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550932	EH	On-Demand	Anodyne	SLC6A1	84	37
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550932	EH	On-Demand	Anodyne	HRH3	23	40
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550932	EH	On-Demand	Anodyne	COLA	41	40
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550932	EH	On-Demand	Anodyne	CPT1A	38	40
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550932	EH	On-Demand	Anodyne	GRM5	32	56
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550932	EH	On-Demand	Anodyne	SMO	40	34
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550932	EH	On-Demand	Anodyne	ETHR	61	54
O=C(NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550939	GI	On-Demand	Anodyne	DRD4	25	42
O=C(NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550939	GI	On-Demand	Anodyne	HTR2A	24	45
O=C(NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550939	GI	On-Demand	Anodyne	HTR2C	23	45
O=C(NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550939	GI	On-Demand	Anodyne	SLC6A1	138	42
O=C(NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550939	GI	On-Demand	Anodyne	CCR3	125	56
O=C(NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550939	GI	On-Demand	Anodyne	EPHX2	21	43
O=C(NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550939	GI	On-Demand	Anodyne	MCHR1	28	49
O=C(NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550939	GI	On-Demand	Anodyne	CYP2J2	50	36
O=C(NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550940	GI	On-Demand	Anodyne	DRD4	25	42
O=C(NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550940	GI	On-Demand	Anodyne	HTR2A	24	45
O=C(NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550940	GI	On-Demand	Anodyne	HTR2C	23	45
O=C(NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550940	GI	On-Demand	Anodyne	SLC6A1	138	42
O=C(NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550940	GI	On-Demand	Anodyne	CCR3	125	56
O=C(NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550940	GI	On-Demand	Anodyne	EPHX2	21	43
O=C(NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550940	GI	On-Demand	Anodyne	MCHR1	28	49
O=C(NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000450550940	GI	On-Demand	Anodyne	CYP2J2	50	36
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550944	DF	On-Demand	Anodyne	GRM5	32	56
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550944	DF	On-Demand	Anodyne	SMO	43	35
C[C@H](O)CCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550944	DF	On-Demand	Anodyne	ETHR	43	51
C[C@H](O)CCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550945	DF	On-Demand	Anodyne	GRM5	32	56
C[C@H](O)CCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550945	DF	On-Demand	Anodyne	SMO	43	35
C[C@H](O)CCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550945	DF	On-Demand	Anodyne	ETHR	43	51
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550946	DF	On-Demand	Anodyne	GRM5	32	56
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550946	DF	On-Demand	Anodyne	SMO	43	35
C[C@@H](O)CCN1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550946	DF	On-Demand	Anodyne	ETHR	43	51
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550947	DF	On-Demand	Anodyne	GRM5	32	56
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550947	DF	On-Demand	Anodyne	SMO	43	35
C[C@@H](O)CCN1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000450550947	DF	On-Demand	Anodyne	ETHR	43	51
COc1cc(CC(=O)Nc2nc3c(s2)CN(C(C)C)CC3)ccc1Cl	ZINC000450550955	GH	On-Demand	Anodyne	CSNK1D	40	39
CC(C)c1nccc(N2CCN(C3CC3)C[C@@H](C)C2)n1	ZINC000450550962	CF	On-Demand	Anodyne	SORD	71	40
CC(C)c1nccc(N2CCN(C3CC3)C[C@H](C)C2)n1	ZINC000450550963	CF	On-Demand	Anodyne	SORD	71	40
CC[C@@H](CC(C)C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450550964	EH	On-Demand	Anodyne	SPHK1	40	42
CC[C@H](CC(C)C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450550965	EH	On-Demand	Anodyne	SPHK1	40	42
COc1ccccc1Oc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)nc1	ZINC000450550976	FG	On-Demand	Anodyne	ACKR3	62	32
COc1ccccc1Oc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)nc1	ZINC000450550977	FG	On-Demand	Anodyne	ACKR3	62	32
COc1ccccc1Oc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)nc1	ZINC000450550978	FG	On-Demand	Anodyne	ACKR3	62	32
COc1ccccc1Oc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)nc1	ZINC000450550979	FG	On-Demand	Anodyne	ACKR3	62	32
CC(C)N1CCc2nc(NC(=O)[C@H]3CCCCC3(F)F)sc2C1	ZINC000450550988	EH	On-Demand	Anodyne	APEX1	0	42
CC(C)N1CCc2nc(NC(=O)[C@@H]3CCCCC3(F)F)sc2C1	ZINC000450550989	EH	On-Demand	Anodyne	APEX1	0	42
CN(C)S(=O)(=O)c1ccc(NCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450550999	EE	On-Demand	Bother	COLA	41	34
COc1cccc(-n2cc(C(=O)NCCCn3ccnn3)nn2)c1	ZINC000450551003	EC	On-Demand	Anodyne	DRD4	47	37
C[C@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551004	DE	On-Demand	Anodyne	HTR1A	26	43
C[C@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551004	DE	On-Demand	Anodyne	DRD2	21	41
C[C@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551004	DE	On-Demand	Anodyne	DRD4	37	41
C[C@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551004	DE	On-Demand	Anodyne	HTR2A	19	42
C[C@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551004	DE	On-Demand	Anodyne	DRD3	17	41
C[C@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551004	DE	On-Demand	Anodyne	SORD	117	48
C[C@@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551005	DE	On-Demand	Anodyne	HTR1A	26	43
C[C@@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551005	DE	On-Demand	Anodyne	DRD2	21	41
C[C@@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551005	DE	On-Demand	Anodyne	DRD4	37	41
C[C@@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551005	DE	On-Demand	Anodyne	HTR2A	19	42
C[C@@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551005	DE	On-Demand	Anodyne	DRD3	17	41
C[C@@H](O)CCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450551005	DE	On-Demand	Anodyne	SORD	117	48
Cc1cc(C(=O)NCC[C@H]2CCO[C@H](C)C2)ncc1C(N)=O	ZINC000450551013	DD	On-Demand	Anodyne	SIRT2	44	31
Cc1cc(C(=O)NCC[C@@H]2CCO[C@@H](C)C2)ncc1C(N)=O	ZINC000450551014	DD	On-Demand	Anodyne	SIRT2	44	31
Cc1cc(C(=O)NCC[C@H]2CCO[C@@H](C)C2)ncc1C(N)=O	ZINC000450551015	DD	On-Demand	Anodyne	SIRT2	44	31
Cc1cc(C(=O)NCC[C@@H]2CCO[C@H](C)C2)ncc1C(N)=O	ZINC000450551016	DD	On-Demand	Anodyne	SIRT2	44	31
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1O	ZINC000450551017	FD	On-Demand	Anodyne	TSHR	41	31
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1O	ZINC000450551017	FD	On-Demand	Anodyne	BRS3	26	43
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1O	ZINC000450551017	FD	On-Demand	Anodyne	MBTPS1	43	31
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1O	ZINC000450551018	FD	On-Demand	Anodyne	TSHR	41	31
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1O	ZINC000450551018	FD	On-Demand	Anodyne	BRS3	26	43
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1O	ZINC000450551018	FD	On-Demand	Anodyne	MBTPS1	43	31
CC(F)(F)CCNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450551031	GJ	On-Demand	Anodyne	NPBWR1	45	38
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	HTR1A	26	48
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	DRD2	30	46
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	DRD1	0	41
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	DRD4	61	46
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	ADRA1A	18	41
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	DRD3	54	47
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	HRP1_PLAFA	17	42
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	CTSK	27	40
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	PLD1	43	46
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	PLD2	76	38
COc1ccc(C(=O)NCCN2CCN(CC3(C#N)CCC3)CC2)cc1	ZINC000450551046	FD	On-Demand	Mild	AP2S1	0	40
CCn1nc(C)c(CC(=O)Nc2cc(CCc3ccccc3C)[nH]n2)c1C	ZINC000450551048	FF	On-Demand	Anodyne	P2RX7	40	45
CC(F)(F)CCNc1ccnc(C(=O)NCc2ccccc2)c1	ZINC000450551060	DG	On-Demand	Anodyne	TACR1	15	41
CC(F)(F)CCNc1ccnc(C(=O)NCc2ccccc2)c1	ZINC000450551060	DG	On-Demand	Anodyne	PDS	49	35
COC(=O)[C@@H]1CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccc(O)cc1	ZINC000450551119	GG	On-Demand	Anodyne	SLC6A1	55	46
COC(=O)[C@@H]1CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccc(O)cc1	ZINC000450551119	GG	On-Demand	Anodyne	SLC6A3	25	46
COC(=O)[C@@H]1CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccc(O)cc1	ZINC000450551119	GG	On-Demand	Anodyne	FAAH	0	46
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CCCN(C)[C@H]2C)c1	ZINC000450551124	DE	On-Demand	Anodyne	DRD4	43	33
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551127	DH	On-Demand	Anodyne	DRD5	20	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551127	DH	On-Demand	Anodyne	SSTR4	45	35
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551127	DH	On-Demand	Anodyne	HTR5A	31	54
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CCCN(C)[C@H]2C)c1	ZINC000450551128	DE	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c1	ZINC000450551129	DE	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CCCN(C)[C@@H]2C)c1	ZINC000450551130	DE	On-Demand	Anodyne	DRD4	43	33
C[C@H](c1ccccc1)[C@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551135	DH	On-Demand	Anodyne	DRD5	20	43
C[C@H](c1ccccc1)[C@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551135	DH	On-Demand	Anodyne	SSTR4	45	35
C[C@H](c1ccccc1)[C@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551135	DH	On-Demand	Anodyne	HTR5A	31	54
COC(=O)[C@@H]1CN(c2nc3cccc(F)c3s2)C[C@H]1c1ccc(O)cc1	ZINC000450551138	FH	On-Demand	Anodyne	SLC6A1	45	44
COC(=O)[C@@H]1CN(c2nc3cccc(F)c3s2)C[C@H]1c1ccc(O)cc1	ZINC000450551138	FH	On-Demand	Anodyne	SLC6A3	18	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551139	DH	On-Demand	Anodyne	DRD5	20	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551139	DH	On-Demand	Anodyne	SSTR4	45	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551139	DH	On-Demand	Anodyne	HTR5A	31	54
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551141	DH	On-Demand	Anodyne	DRD5	20	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551141	DH	On-Demand	Anodyne	SSTR4	45	35
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2[nH]c3ccccc3c2C1	ZINC000450551141	DH	On-Demand	Anodyne	HTR5A	31	54
COC(=O)CNC(=O)c1ccc(N[C@H](C)c2cccc(C3CC3)c2)c([N+](=O)[O-])c1	ZINC000450551142	GH	On-Demand	Bother	TAAR1	20	46
COC(=O)CNC(=O)c1ccc(N[C@@H](C)c2cccc(C3CC3)c2)c([N+](=O)[O-])c1	ZINC000450551143	GH	On-Demand	Bother	TAAR1	20	46
COC(=O)c1nc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)sc1C	ZINC000450551152	GE	On-Demand	Anodyne	SLC6A1	43	41
O=C(CN1CCN(CC2=CCCCC2)CC1)NC1CCCCC1	ZINC000450551173	DF	On-Demand	Anodyne	SIGMAR1	15	42
COC(=O)[C@@H]1CN(c2nc3c(F)cccc3n2C)C[C@H]1c1ccc(O)cc1	ZINC000450551175	FF	On-Demand	Anodyne	SLC6A1	84	42
COC(=O)c1coc(CN2CC[C@@H](Nc3ccccc3)C2)n1	ZINC000450551192	DE	On-Demand	Anodyne	LTA4H	20	42
COC(=O)c1coc(CN2CC[C@H](Nc3ccccc3)C2)n1	ZINC000450551193	DE	On-Demand	Anodyne	LTA4H	20	42
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	CNR1	17	40
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	DRD4	43	47
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	ACHE	20	45
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	LTA4H	33	43
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	HRH3	28	53
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	SIGMAR1	34	52
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	SSTR5	48	39
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	CCR3	26	41
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	EPHX2	33	46
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	CXCR3	21	41
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	MCHR1	47	46
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	CACNA1G	24	41
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	ADIPOR1	0	46
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1	ZINC000450551204	FE	On-Demand	Anodyne	ADIPOR2	0	46
COC(=O)c1cnc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc1	ZINC000450551208	FD	On-Demand	Anodyne	SLC6A1	76	44
COC(=O)c1cnc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc1	ZINC000450551208	FD	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)c1cnc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc1	ZINC000450551208	FD	On-Demand	Anodyne	SLC6A3	37	41
COc1cc(CN2C[C@@H](C(N)=O)Cc3ccccc32)ccc1Cl	ZINC000450551211	EG	On-Demand	Anodyne	DRD4	39	41
COc1cc(CN2C[C@@H](C(N)=O)Cc3ccccc32)ccc1Cl	ZINC000450551211	EG	On-Demand	Anodyne	PYGM	31	40
COc1cc(CN2C[C@@H](C(N)=O)Cc3ccccc32)ccc1Cl	ZINC000450551211	EG	On-Demand	Anodyne	TPP2	50	30
COc1cc(CN2C[C@H](C(N)=O)Cc3ccccc32)ccc1Cl	ZINC000450551212	EG	On-Demand	Anodyne	DRD4	39	41
COc1cc(CN2C[C@H](C(N)=O)Cc3ccccc32)ccc1Cl	ZINC000450551212	EG	On-Demand	Anodyne	PYGM	31	40
COc1cc(CN2C[C@H](C(N)=O)Cc3ccccc32)ccc1Cl	ZINC000450551212	EG	On-Demand	Anodyne	TPP2	50	30
CCCOc1ccc(C(=O)N2C[C@H]3[C@H](O)CC[C@H]3C2)c(OC)c1	ZINC000450551213	DE	On-Demand	Anodyne	OXTR	21	41
CCCOc1ccc(C(=O)N2C[C@H]3[C@@H](O)CC[C@H]3C2)c(OC)c1	ZINC000450551214	DE	On-Demand	Anodyne	OXTR	21	41
CCCN(CC1(C#N)CCC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450551215	EH	On-Demand	Mild	L3MBTL3	65	37
CCCOc1ccc(C(=O)N2C[C@@H]3CC[C@H](O)[C@H]3C2)c(OC)c1	ZINC000450551216	DE	On-Demand	Anodyne	OXTR	21	41
CCCOc1ccc(C(=O)N2C[C@@H]3CC[C@@H](O)[C@H]3C2)c(OC)c1	ZINC000450551217	DE	On-Demand	Anodyne	OXTR	21	41
COC(=O)[C@@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450551220	GG	On-Demand	Bother	SLC6A1	38	44
CN1C(=O)C[C@@H](C(=O)NCCc2ccc(F)c(F)c2F)[C@@H]1c1cccnc1	ZINC000450551222	GE	On-Demand	Anodyne	P2RX7	41	44
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	GYRB	0	41
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	P2RY12	55	66
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	PDGFRB	37	45
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	KIT	31	40
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	SSTR5	40	32
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	ROCK1	40	34
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	KDR	23	42
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	ROCK2	22	40
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	FAAH	28	47
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	TEK	19	40
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	P2RY14	50	36
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	LIMK2	35	48
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	KCNK3	55	36
CCOC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)nc1	ZINC000450551233	GF	On-Demand	Anodyne	KCNK9	48	36
COC(=O)[C@@H]1CN(c2ncnc3sc4c(c23)CCC4)C[C@H]1c1ccc(O)cc1	ZINC000450551243	GG	On-Demand	Anodyne	RBP4	17	42
C[C@@H]1CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CCN(C2CC2)C1	ZINC000450551250	GG	On-Demand	Anodyne	AVPR2	43	39
C[C@H]1CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CCN(C2CC2)C1	ZINC000450551252	GG	On-Demand	Anodyne	AVPR2	43	39
COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)CC1CCC(=O)CC1	ZINC000450551266	FH	On-Demand	Anodyne	TACR2	56	36
COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)CC1CCC(=O)CC1	ZINC000450551266	FH	On-Demand	Anodyne	TACR3	45	34
COCC[C@@H](Cc1ccco1)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450551268	FE	On-Demand	Anodyne	ESRRA	19	40
COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)CC1CCC(=O)CC1	ZINC000450551270	FH	On-Demand	Anodyne	TACR2	56	36
COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)CC1CCC(=O)CC1	ZINC000450551270	FH	On-Demand	Anodyne	TACR3	45	34
COCC[C@H](Cc1ccco1)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450551271	FE	On-Demand	Anodyne	ESRRA	19	40
COC(=O)c1coc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)n1	ZINC000450551272	FE	On-Demand	Anodyne	P2RY12	16	45
COC(=O)c1coc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)n1	ZINC000450551272	FE	On-Demand	Anodyne	FAAH	22	46
COC(=O)c1coc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)n1	ZINC000450551272	FE	On-Demand	Anodyne	P2RY14	43	34
COC(=O)c1coc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)n1	ZINC000450551272	FE	On-Demand	Anodyne	LIMK2	19	46
CCc1nc(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])n[nH]1	ZINC000450551278	FD	On-Demand	Bother	BDKRB1	0	41
CO[C@H](Cc1ccccc1)C(=O)N1CC(F)C1	ZINC000450551290	BD	On-Demand	Anodyne	ACE	57	34
CO[C@H](Cc1ccccc1)C(=O)N1CC(F)C1	ZINC000450551290	BD	On-Demand	Anodyne	PPARA	15	40
CO[C@H](Cc1ccccc1)C(=O)N1CC(F)C1	ZINC000450551290	BD	On-Demand	Anodyne	MME	58	34
CO[C@H](Cc1ccccc1)C(=O)N1CC(F)C1	ZINC000450551290	BD	On-Demand	Anodyne	ACE2	46	33
CO[C@@H](Cc1ccccc1)C(=O)N1CC(F)C1	ZINC000450551291	BD	On-Demand	Anodyne	ACE	57	34
CO[C@@H](Cc1ccccc1)C(=O)N1CC(F)C1	ZINC000450551291	BD	On-Demand	Anodyne	PPARA	15	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC(F)C1	ZINC000450551291	BD	On-Demand	Anodyne	MME	58	34
CO[C@@H](Cc1ccccc1)C(=O)N1CC(F)C1	ZINC000450551291	BD	On-Demand	Anodyne	ACE2	46	33
CCc1cc(N[C@H]2CCCc3c(F)cc(F)cc32)n2ncnc2n1	ZINC000450551302	EG	On-Demand	Anodyne	DHOD	0	43
CC(C)Oc1c(F)cc(NC(=O)c2cccc(C(F)(F)F)n2)cc1F	ZINC000450551303	FI	On-Demand	Anodyne	TRPV1	52	32
CC(C)Oc1c(F)cc(NC(=O)c2cccc(C(F)(F)F)n2)cc1F	ZINC000450551303	FI	On-Demand	Anodyne	ATF1	52	34
CC(C)Oc1c(F)cc(NC(=O)c2cccc(C(F)(F)F)n2)cc1F	ZINC000450551303	FI	On-Demand	Anodyne	NFKB1	48	34
CC(C)Oc1c(F)cc(NC(=O)c2cccc(C(F)(F)F)n2)cc1F	ZINC000450551303	FI	On-Demand	Anodyne	SCN10A	28	42
CC(C)Oc1c(F)cc(NC(=O)c2cccc(C(F)(F)F)n2)cc1F	ZINC000450551303	FI	On-Demand	Anodyne	SHH	30	40
CCc1cc(N[C@@H]2CCCc3c(F)cc(F)cc32)n2ncnc2n1	ZINC000450551304	EG	On-Demand	Anodyne	DHOD	0	43
C[C@H](OCCc1ccccc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450551317	GH	On-Demand	Anodyne	MTNR1A	29	43
C[C@H](OCCc1ccccc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450551317	GH	On-Demand	Anodyne	MTNR1B	45	43
C[C@H](OCCc1ccccc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450551317	GH	On-Demand	Anodyne	SPHK1	38	40
C[C@H](OCCc1ccccc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450551317	GH	On-Demand	Anodyne	TPSAB1	48	37
C[C@@H](OCCc1ccccc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450551318	GH	On-Demand	Anodyne	MTNR1A	29	43
C[C@@H](OCCc1ccccc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450551318	GH	On-Demand	Anodyne	MTNR1B	45	43
C[C@@H](OCCc1ccccc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450551318	GH	On-Demand	Anodyne	SPHK1	38	40
C[C@@H](OCCc1ccccc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450551318	GH	On-Demand	Anodyne	TPSAB1	48	37
CCOC(=O)C[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450551321	FH	On-Demand	Anodyne	GPR88	0	51
CC(C)N1CCCC[C@H]1CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450551330	FH	On-Demand	Anodyne	AKT2	47	39
CC(C)N1CCCC[C@@H]1CN1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450551331	FH	On-Demand	Anodyne	AKT2	47	39
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@@H]3CC[C@@H]4C[C@@H]34)C2)nc1	ZINC000450551332	ED	On-Demand	Anodyne	P2RY12	20	41
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@@H]3CC[C@H]4C[C@@H]34)C2)nc1	ZINC000450551333	ED	On-Demand	Anodyne	P2RY12	20	41
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@@H]3CC[C@@H]4C[C@H]34)C2)nc1	ZINC000450551334	ED	On-Demand	Anodyne	P2RY12	20	41
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@@H]3CC[C@H]4C[C@H]34)C2)nc1	ZINC000450551335	ED	On-Demand	Anodyne	P2RY12	20	41
CC(C)N1CCc2nc(NC(=O)c3ccc(C(F)(F)F)[nH]3)sc2C1	ZINC000450551336	FH	On-Demand	Anodyne	F10	0	43
COCC[C@@H](Cc1ccco1)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450551349	GI	On-Demand	Anodyne	RBP4	64	38
COCC[C@H](Cc1ccco1)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450551350	GI	On-Demand	Anodyne	RBP4	64	38
C[C@@H]1CC[C@H](C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)C[C@H]1C	ZINC000450551359	FH	On-Demand	Anodyne	SPHK1	48	47
C[C@@H]1CC[C@@H](C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)C[C@H]1C	ZINC000450551360	FH	On-Demand	Anodyne	SPHK1	48	47
C[C@H]1C[C@H](C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CC[C@H]1C	ZINC000450551361	FH	On-Demand	Anodyne	SPHK1	48	47
C[C@H]1C[C@@H](C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CC[C@H]1C	ZINC000450551362	FH	On-Demand	Anodyne	SPHK1	48	47
COC(=O)c1coc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)n1	ZINC000450551367	GG	On-Demand	Anodyne	COLA	32	40
COC(=O)c1coc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)n1	ZINC000450551367	GG	On-Demand	Anodyne	CPT1A	31	40
COC(=O)c1coc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)n1	ZINC000450551367	GG	On-Demand	Anodyne	GRM5	30	52
COC(=O)c1coc(CN2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)n1	ZINC000450551367	GG	On-Demand	Anodyne	ETHR	46	47
COC(=O)c1coc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)n1	ZINC000450551369	GG	On-Demand	Anodyne	COLA	32	40
COC(=O)c1coc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)n1	ZINC000450551369	GG	On-Demand	Anodyne	CPT1A	31	40
COC(=O)c1coc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)n1	ZINC000450551369	GG	On-Demand	Anodyne	GRM5	30	52
COC(=O)c1coc(CN2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)n1	ZINC000450551369	GG	On-Demand	Anodyne	ETHR	46	47
CCOC(=O)c1ccc(N2CC(NC(=O)c3cn4nccc4nc3C)C2)nc1	ZINC000450551376	GD	On-Demand	Anodyne	DDR1	54	39
CCOC(=O)[C@H](C)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450551378	CE	On-Demand	Anodyne	AOC3	23	41
CCOC(=O)[C@H](C)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450551379	CE	On-Demand	Anodyne	AOC3	23	41
CCOC(=O)[C@H](C)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450551380	CE	On-Demand	Anodyne	AOC3	23	41
CCOC(=O)[C@H](C)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450551381	CE	On-Demand	Anodyne	AOC3	23	41
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3cn(C)nc3C)C2)nc1	ZINC000450551383	FC	On-Demand	Anodyne	P2RY12	19	40
O=C(CN1CCN(C[C@H]2CCC(F)(F)C2)CC1)N1CCCc2ccccc21	ZINC000450551464	GG	On-Demand	Anodyne	DRD4	25	46
O=C(CN1CCN(C[C@H]2CCC(F)(F)C2)CC1)N1CCCc2ccccc21	ZINC000450551464	GG	On-Demand	Anodyne	CHRM3	16	42
O=C(CN1CCN(C[C@@H]2CCC(F)(F)C2)CC1)N1CCCc2ccccc21	ZINC000450551471	GG	On-Demand	Anodyne	DRD4	25	46
O=C(CN1CCN(C[C@@H]2CCC(F)(F)C2)CC1)N1CCCc2ccccc21	ZINC000450551471	GG	On-Demand	Anodyne	CHRM3	16	42
CCN(C1CCN(CCc2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450551472	EF	On-Demand	Anodyne	SIGMAR1	26	46
CCN(C1CCN(CCc2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450551472	EF	On-Demand	Anodyne	CCR5	30	46
Cc1cc(C(=O)N[C@H]2CCCN(c3cccnc3)C2=O)ncc1C(N)=O	ZINC000450551474	FC	On-Demand	Anodyne	VCP	51	38
Cc1cc(C(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)ncc1C(N)=O	ZINC000450551475	FC	On-Demand	Anodyne	VCP	51	38
COC(=O)[C@H](C)NC(=O)c1ccc(N2CCC[C@@](C)(F)C2)c([N+](=O)[O-])c1	ZINC000450551478	FE	On-Demand	Bother	TAAR1	31	47
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCC[C@](C)(F)C2)c([N+](=O)[O-])c1	ZINC000450551481	FE	On-Demand	Bother	TAAR1	31	47
COC(=O)[C@H](C)NC(=O)c1ccc(N2CCC[C@](C)(F)C2)c([N+](=O)[O-])c1	ZINC000450551482	FE	On-Demand	Bother	TAAR1	31	47
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCC[C@@](C)(F)C2)c([N+](=O)[O-])c1	ZINC000450551483	FE	On-Demand	Bother	TAAR1	31	47
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	ABL1	49	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	CASR	51	42
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	RAF1	37	42
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	KDR	16	44
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	GRM4	43	35
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	ABL2	44	35
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	EPHX2	42	46
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	PIK3CB	40	32
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	TYK2	15	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	43	44
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cccc(C(F)(F)F)n1	ZINC000450551484	GH	On-Demand	Anodyne	BRAF	19	45
COc1cc2c(NCCCC3CCOCC3)ncnc2cc1F	ZINC000450551492	DF	On-Demand	Anodyne	EGFR	37	43
COc1cc2c(NCCCC3CCOCC3)ncnc2cc1F	ZINC000450551492	DF	On-Demand	Anodyne	FGFR1	23	44
COc1cc2c(NCCCC3CCOCC3)ncnc2cc1F	ZINC000450551492	DF	On-Demand	Anodyne	FLT1	33	44
COc1cc2c(NCCCC3CCOCC3)ncnc2cc1F	ZINC000450551492	DF	On-Demand	Anodyne	EPHA2	50	39
CC(F)(F)CCCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450551502	EG	On-Demand	Anodyne	LRRK2	30	42
CCNC(=O)c1ccc(N2CCC[C@@](C)(F)C2)nn1	ZINC000450551520	CD	On-Demand	Anodyne	SCD1	45	39
CCNC(=O)c1ccc(N2CCC[C@@](C)(F)C2)nn1	ZINC000450551520	CD	On-Demand	Anodyne	SCD	24	40
CCNC(=O)c1ccc(N2CCC[C@](C)(F)C2)nn1	ZINC000450551522	CD	On-Demand	Anodyne	SCD1	45	39
CCNC(=O)c1ccc(N2CCC[C@](C)(F)C2)nn1	ZINC000450551522	CD	On-Demand	Anodyne	SCD	24	40
C[C@]1(F)CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450551546	FE	On-Demand	Bother	SLC6A9	15	43
C[C@@]1(F)CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450551547	FE	On-Demand	Bother	SLC6A9	15	43
CCOC(=O)[C@H](Cc1ccccc1)N(CC[C@@H](C)O)C1CC1	ZINC000450551548	DE	On-Demand	Anodyne	TIMP3	40	33
CCOC(=O)[C@H](Cc1ccccc1)N(CC[C@@H](C)O)C1CC1	ZINC000450551548	DE	On-Demand	Anodyne	AMY2	46	32
CCOC(=O)[C@H](Cc1ccccc1)N(CC[C@@H](C)O)C1CC1	ZINC000450551548	DE	On-Demand	Anodyne	CTRB_BOVIN	50	36
CCOC(=O)[C@@H](Cc1ccccc1)N(CC[C@@H](C)O)C1CC1	ZINC000450551549	DE	On-Demand	Anodyne	TIMP3	40	33
CCOC(=O)[C@@H](Cc1ccccc1)N(CC[C@@H](C)O)C1CC1	ZINC000450551549	DE	On-Demand	Anodyne	AMY2	46	32
CCOC(=O)[C@@H](Cc1ccccc1)N(CC[C@@H](C)O)C1CC1	ZINC000450551549	DE	On-Demand	Anodyne	CTRB_BOVIN	50	36
CCOC(=O)[C@@H](Cc1ccccc1)N(CC[C@H](C)O)C1CC1	ZINC000450551550	DE	On-Demand	Anodyne	TIMP3	40	33
CCOC(=O)[C@@H](Cc1ccccc1)N(CC[C@H](C)O)C1CC1	ZINC000450551550	DE	On-Demand	Anodyne	AMY2	46	32
CCOC(=O)[C@@H](Cc1ccccc1)N(CC[C@H](C)O)C1CC1	ZINC000450551550	DE	On-Demand	Anodyne	CTRB_BOVIN	50	36
CCOC(=O)[C@H](Cc1ccccc1)N(CC[C@H](C)O)C1CC1	ZINC000450551551	DE	On-Demand	Anodyne	TIMP3	40	33
CCOC(=O)[C@H](Cc1ccccc1)N(CC[C@H](C)O)C1CC1	ZINC000450551551	DE	On-Demand	Anodyne	AMY2	46	32
CCOC(=O)[C@H](Cc1ccccc1)N(CC[C@H](C)O)C1CC1	ZINC000450551551	DE	On-Demand	Anodyne	CTRB_BOVIN	50	36
COc1cc(CC(=O)N(C)C[C@@H]2CC=CCC2)ccc1Cl	ZINC000450551552	DH	On-Demand	Anodyne	OPRK1	22	43
COc1cc(CC(=O)N(C)C[C@H]2CC=CCC2)ccc1Cl	ZINC000450551553	DH	On-Demand	Anodyne	OPRK1	22	43
Cc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)ccc1-n1nnnc1C(C)C	ZINC000450551554	GG	On-Demand	Anodyne	SCN10A	17	41
COC[C@]1(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)CCOC1	ZINC000450551566	FE	On-Demand	Anodyne	EPHX2	29	42
COC[C@@]1(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)CCOC1	ZINC000450551567	FE	On-Demand	Anodyne	EPHX2	29	42
Cc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)nn1C(C)C	ZINC000450551574	GH	On-Demand	Anodyne	HTR1D	54	37
Cc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)nn1C(C)C	ZINC000450551574	GH	On-Demand	Anodyne	MPO	64	37
Cc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)nn1C(C)C	ZINC000450551574	GH	On-Demand	Anodyne	ABCG2	25	42
COc1cccc(Oc2ccc(C(=O)NCCc3nnc4n3CCCC4)nc2)c1	ZINC000450551575	GF	On-Demand	Anodyne	DRD4	48	37
COc1cccc(Oc2ccc(C(=O)NCCc3nnc4n3CCCC4)nc2)c1	ZINC000450551575	GF	On-Demand	Anodyne	MTNR1A	55	39
COc1cccc(Oc2ccc(C(=O)NCCc3nnc4n3CCCC4)nc2)c1	ZINC000450551575	GF	On-Demand	Anodyne	MTNR1B	53	39
COC(=O)c1coc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)n1	ZINC000450551577	GD	On-Demand	Anodyne	SFRP1	52	32
COC(=O)c1coc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)n1	ZINC000450551578	GD	On-Demand	Anodyne	SFRP1	52	32
COC(=O)C(C)(C)N(C)CC/C=C\c1ccccc1	ZINC000450551581	CF	On-Demand	Anodyne	AMY2	54	32
O=C(CN1CCN(Cc2ccn(CC(F)(F)F)n2)CC1)NC1CCCCC1	ZINC000450551582	GE	On-Demand	Anodyne	SIGMAR1	16	40
O=C(CN1CCN(Cc2ccn(CC(F)(F)F)n2)CC1)NC1CCCCC1	ZINC000450551582	GE	On-Demand	Anodyne	HPGDS	34	40
N#Cc1ccc(N2C[C@@H](C(=O)N3CC(F)C3)CC2=O)cc1Cl	ZINC000450551596	DD	On-Demand	Mild	AR	17	46
N#Cc1ccc(N2C[C@H](C(=O)N3CC(F)C3)CC2=O)cc1Cl	ZINC000450551597	DD	On-Demand	Mild	AR	17	46
CCOCc1nc(C)c(C(=O)Nc2nc(Cc3ccccc3)cs2)s1	ZINC000450551617	FI	On-Demand	Anodyne	PDE5A	0	42
CCOCc1nc(C)c(C(=O)Nc2nc(Cc3ccccc3)cs2)s1	ZINC000450551617	FI	On-Demand	Anodyne	SCD1	19	41
CCOCc1nc(C)c(C(=O)Nc2nc(Cc3ccccc3)cs2)s1	ZINC000450551617	FI	On-Demand	Anodyne	SCD	18	41
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	DRD2	23	48
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	DRD4	48	48
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	ACHE	46	46
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	HRH1	29	42
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	DRD3	22	42
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	OPRK1	29	40
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	AVPR1B	46	40
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	HTR4	87	46
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	CHAT	24	40
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	SIGMAR1	43	44
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	SSTR5	74	43
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	CCR1	35	41
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	CCR3	46	45
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	UTS2R	25	40
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	MCHR1	40	44
COc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)ccc1Cl	ZINC000450551618	GF	On-Demand	Anodyne	CACNA1I	41	40
COc1cc(Br)c(C(=O)NCCCn2ccnn2)cc1OC	ZINC000450551619	FD	On-Demand	Anodyne	DRD3	25	41
Cc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)n1C	ZINC000450551621	FD	On-Demand	Mild	AR	18	40
Cc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)n1C	ZINC000450551622	FD	On-Demand	Mild	AR	18	40
CC(C)NC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450551632	EG	On-Demand	Anodyne	BIRC2	32	41
Fc1ccc(NC2CCN(Cc3cnns3)CC2)cc1	ZINC000450551637	CF	On-Demand	Anodyne	MLNR	27	43
COc1ccc(CCNC(=O)[C@@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551649	FD	On-Demand	Anodyne	CA2	18	47
COc1ccc(CCNC(=O)[C@@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551649	FD	On-Demand	Anodyne	CA1	20	47
COc1ccc(CCNC(=O)[C@@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551649	FD	On-Demand	Anodyne	CA7	15	47
COc1ccc(CCNC(=O)[C@@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551649	FD	On-Demand	Anodyne	CA14	18	47
COc1ccc(CCNC(=O)[C@@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551649	FD	On-Demand	Anodyne	SCMU_MYCTU	0	40
COc1ccc(CCNC(=O)[C@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551650	FD	On-Demand	Anodyne	CA2	18	47
COc1ccc(CCNC(=O)[C@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551650	FD	On-Demand	Anodyne	CA1	20	47
COc1ccc(CCNC(=O)[C@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551650	FD	On-Demand	Anodyne	CA7	15	47
COc1ccc(CCNC(=O)[C@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551650	FD	On-Demand	Anodyne	CA14	18	47
COc1ccc(CCNC(=O)[C@]2(C)CC=CCC2)cc1S(N)(=O)=O	ZINC000450551650	FD	On-Demand	Anodyne	SCMU_MYCTU	0	40
NC(=O)c1ccc(CCC(=O)N[C@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000450551654	FD	On-Demand	Anodyne	C3AR1	43	36
NC(=O)c1ccc(CCC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000450551656	FD	On-Demand	Anodyne	C3AR1	43	36
COC(=O)[C@@H]1CN(c2nc(C)nc3[nH]ccc23)C[C@H]1c1ccc(O)cc1	ZINC000450551662	FE	On-Demand	Anodyne	SLC6A1	37	40
CCC[C@@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551675	EH	On-Demand	Anodyne	COLA	33	44
CCC[C@@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551675	EH	On-Demand	Anodyne	CPT1A	30	44
CCC[C@@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551675	EH	On-Demand	Anodyne	GRM5	26	48
CCC[C@@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551675	EH	On-Demand	Anodyne	SPHK1	23	43
CCC[C@@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551679	EH	On-Demand	Anodyne	COLA	33	44
CCC[C@@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551679	EH	On-Demand	Anodyne	CPT1A	30	44
CCC[C@@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551679	EH	On-Demand	Anodyne	GRM5	26	48
CCC[C@@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551679	EH	On-Demand	Anodyne	SPHK1	23	43
N#CC1(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)CCC1	ZINC000450551680	FE	On-Demand	Mild	DRD4	20	48
CCC[C@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551682	EH	On-Demand	Anodyne	COLA	33	44
CCC[C@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551682	EH	On-Demand	Anodyne	CPT1A	30	44
CCC[C@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551682	EH	On-Demand	Anodyne	GRM5	26	48
CCC[C@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551682	EH	On-Demand	Anodyne	SPHK1	23	43
CCC[C@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551685	EH	On-Demand	Anodyne	COLA	33	44
CCC[C@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551685	EH	On-Demand	Anodyne	CPT1A	30	44
CCC[C@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551685	EH	On-Demand	Anodyne	GRM5	26	48
CCC[C@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450551685	EH	On-Demand	Anodyne	SPHK1	23	43
CC(C)c1nnc(CN2CCC(Nc3ccc(F)cc3)CC2)s1	ZINC000450551687	EH	On-Demand	Anodyne	MLNR	31	41
C[C@@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551701	GG	On-Demand	Anodyne	COLA	27	42
C[C@@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551701	GG	On-Demand	Anodyne	CPT1A	23	42
C[C@@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551701	GG	On-Demand	Anodyne	GRM5	26	46
C[C@@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551701	GG	On-Demand	Anodyne	DPP7	0	41
C[C@@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551703	GG	On-Demand	Anodyne	COLA	27	42
C[C@@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551703	GG	On-Demand	Anodyne	CPT1A	23	42
C[C@@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551703	GG	On-Demand	Anodyne	GRM5	26	46
C[C@@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551703	GG	On-Demand	Anodyne	DPP7	0	41
C[C@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551705	GG	On-Demand	Anodyne	COLA	27	42
C[C@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551705	GG	On-Demand	Anodyne	CPT1A	23	42
C[C@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551705	GG	On-Demand	Anodyne	GRM5	26	46
C[C@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551705	GG	On-Demand	Anodyne	DPP7	0	41
C[C@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551707	GG	On-Demand	Anodyne	COLA	27	42
C[C@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551707	GG	On-Demand	Anodyne	CPT1A	23	42
C[C@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551707	GG	On-Demand	Anodyne	GRM5	26	46
C[C@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)S(C)(=O)=O	ZINC000450551707	GG	On-Demand	Anodyne	DPP7	0	41
COC(=O)c1csc(CN(c2ccccc2)C2CCCC2)n1	ZINC000450551715	DH	On-Demand	Anodyne	COLA	0	40
COC(=O)c1csc(CN(c2ccccc2)C2CCCC2)n1	ZINC000450551715	DH	On-Demand	Anodyne	CPT1A	17	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC(F)C1	ZINC000450551733	CD	On-Demand	Anodyne	DPP4	18	45
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)C[S@@](C)=O)nc2)cc1	ZINC000450551743	EE	On-Demand	Anodyne	ACACA	29	41
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)C[S@@](C)=O)nc2)cc1	ZINC000450551743	EE	On-Demand	Anodyne	ACACB	24	41
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC(F)C1	ZINC000450551744	CD	On-Demand	Anodyne	DPP4	18	45
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)C[S@](C)=O)nc2)cc1	ZINC000450551745	EE	On-Demand	Anodyne	ACACA	29	41
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)C[S@](C)=O)nc2)cc1	ZINC000450551745	EE	On-Demand	Anodyne	ACACB	24	41
COc1ccc(Oc2ccc(C(=O)N[C@H](C)C[S@@](C)=O)nc2)cc1	ZINC000450551747	EE	On-Demand	Anodyne	ACACA	29	41
COc1ccc(Oc2ccc(C(=O)N[C@H](C)C[S@@](C)=O)nc2)cc1	ZINC000450551747	EE	On-Demand	Anodyne	ACACB	24	41
COc1ccc(Oc2ccc(C(=O)N[C@H](C)C[S@](C)=O)nc2)cc1	ZINC000450551748	EE	On-Demand	Anodyne	ACACA	29	41
COc1ccc(Oc2ccc(C(=O)N[C@H](C)C[S@](C)=O)nc2)cc1	ZINC000450551748	EE	On-Demand	Anodyne	ACACB	24	41
Clc1ccc(-c2noc([C@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n2)cc1	ZINC000450551763	FI	On-Demand	Anodyne	GRM5	20	44
Clc1ccc(-c2noc([C@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n2)cc1	ZINC000450551766	FI	On-Demand	Anodyne	GRM5	20	44
Clc1ccc(-c2noc([C@@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n2)cc1	ZINC000450551768	FI	On-Demand	Anodyne	GRM5	20	44
Clc1ccc(-c2noc([C@@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n2)cc1	ZINC000450551770	FI	On-Demand	Anodyne	GRM5	20	44
COC(=O)[C@@H]1CN(c2nc(C3CC3)ns2)C[C@H]1c1ccc(O)cc1	ZINC000450551772	EF	On-Demand	Anodyne	SLC6A1	72	43
CCc1cc(CCCN2CCc3[nH]c4ccccc4c3C2)on1	ZINC000450551775	DH	On-Demand	Anodyne	DRD5	20	41
CCc1cc(CCCN2CCc3[nH]c4ccccc4c3C2)on1	ZINC000450551775	DH	On-Demand	Anodyne	HTR5A	41	55
CC[C@H](C)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450551777	BF	On-Demand	Anodyne	AOC3	24	44
CC[C@H](C)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450551778	BF	On-Demand	Anodyne	AOC3	24	44
CC[C@H](C)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450551779	BF	On-Demand	Anodyne	AOC3	24	44
CC[C@H](C)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450551780	BF	On-Demand	Anodyne	AOC3	24	44
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])c(C)c2)C[C@H]1c1ccc(O)cc1	ZINC000450551781	FG	On-Demand	Bother	SLC6A1	39	40
COC(=O)[C@@H]1CN(c2nc(C)nc(C)c2F)C[C@H]1c1ccc(O)cc1	ZINC000450551783	EE	On-Demand	Anodyne	SLC6A1	69	44
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)CC2CC(F)(F)C2)c1	ZINC000450551800	GK	On-Demand	Anodyne	UTS2R	44	30
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450551802	FI	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450551804	FI	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450551805	FI	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450551806	FI	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)CC2CC(F)(F)C2)c1	ZINC000450551811	GK	On-Demand	Anodyne	UTS2R	44	30
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)CC2CC(F)(F)C2)c1	ZINC000450551812	GK	On-Demand	Anodyne	UTS2R	44	30
COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)CC2CC(F)(F)C2)c1	ZINC000450551814	GK	On-Demand	Anodyne	UTS2R	44	30
COC(=O)[C@@H]1CN(c2cc(C)nc(OC)n2)C[C@H]1c1ccc(O)cc1	ZINC000450551821	ED	On-Demand	Anodyne	SLC6A1	62	42
Cc1ccc(-n2ncc(NCCC(C)(F)F)c(Cl)c2=O)cc1Cl	ZINC000450551823	FI	On-Demand	Anodyne	NPBWR1	42	39
COC(=O)[C@@H]1CN(c2cncc(C)n2)C[C@H]1c1ccc(O)cc1	ZINC000450551839	DD	On-Demand	Anodyne	SLC6A1	76	45
COC(=O)c1ccccc1C(=O)c1ccc(NCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450551846	GI	On-Demand	Bother	TAAR1	16	44
CC(F)(F)CCN=c1ccc(C(=O)N2CCc3ccccc32)c[nH]1	ZINC000450551851	EG	On-Demand	Anodyne	AVPR2	41	42
Cc1cnc(CCCC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)o1	ZINC000450551855	ED	On-Demand	Anodyne	PREP	44	41
Cc1cnc(CCCC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)o1	ZINC000450551859	ED	On-Demand	Anodyne	PREP	44	41
CCOC(=O)[C@@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450551860	CF	On-Demand	Anodyne	THRA	69	42
CCOC(=O)[C@@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450551860	CF	On-Demand	Anodyne	THRB	35	42
CCOC(=O)[C@@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450551860	CF	On-Demand	Anodyne	AMY2	44	30
CCOC(=O)[C@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450551861	CF	On-Demand	Anodyne	THRA	69	42
CCOC(=O)[C@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450551861	CF	On-Demand	Anodyne	THRB	35	42
CCOC(=O)[C@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450551861	CF	On-Demand	Anodyne	AMY2	44	30
COC(=O)[C@@H]1CN(c2noc(-c3ccccc3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450551867	FF	On-Demand	Anodyne	SLC6A1	46	46
CN1CCN(C(=O)CC2CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450551875	GG	On-Demand	Anodyne	SIGMAR1	20	40
CN1CCN(C(=O)CC2CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450551875	GG	On-Demand	Anodyne	CCR3	21	40
COC(=O)C(C)(C)N(C)CC/C=C/c1ccccc1	ZINC000450551882	CF	On-Demand	Anodyne	AMY2	54	32
CNS(=O)(=O)NCC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450551893	FD	On-Demand	Anodyne	CACNA1B	40	34
CNS(=O)(=O)NCC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450551893	FD	On-Demand	Anodyne	CCR2	65	39
CNS(=O)(=O)NCC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450551894	FD	On-Demand	Anodyne	CACNA1B	40	34
CNS(=O)(=O)NCC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450551894	FD	On-Demand	Anodyne	CCR2	65	39
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551897	FI	On-Demand	Anodyne	HTR1D	37	41
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551897	FI	On-Demand	Anodyne	HTR1B	30	41
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551897	FI	On-Demand	Anodyne	MPO	55	38
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551898	FI	On-Demand	Anodyne	HTR1D	37	41
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551898	FI	On-Demand	Anodyne	HTR1B	30	41
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551898	FI	On-Demand	Anodyne	MPO	55	38
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551899	FI	On-Demand	Anodyne	HTR1D	37	41
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551899	FI	On-Demand	Anodyne	HTR1B	30	41
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551899	FI	On-Demand	Anodyne	MPO	55	38
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551900	FI	On-Demand	Anodyne	HTR1D	37	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551900	FI	On-Demand	Anodyne	HTR1B	30	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551900	FI	On-Demand	Anodyne	MPO	55	38
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCC3=CCCCC3)CC2)C1	ZINC000450551908	EG	On-Demand	Anodyne	BIRC2	42	32
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCC3=CCCCC3)CC2)C1	ZINC000450551909	EG	On-Demand	Anodyne	BIRC2	42	32
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCC3=CCCCC3)CC2)C1	ZINC000450551910	EG	On-Demand	Anodyne	BIRC2	42	32
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCC3=CCCCC3)CC2)C1	ZINC000450551911	EG	On-Demand	Anodyne	BIRC2	42	32
CC(F)(F)CCCN=c1ccc(C(=O)N2CCc3ccccc32)c[nH]1	ZINC000450551917	EH	On-Demand	Anodyne	AVPR2	40	40
C[C@@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551922	EG	On-Demand	Mild	HTR1A	27	40
C[C@@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551922	EG	On-Demand	Mild	HTR1B	25	40
C[C@@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551922	EG	On-Demand	Mild	SLC6A4	0	43
C[C@@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551922	EG	On-Demand	Mild	MPO	60	35
C[C@@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551922	EG	On-Demand	Mild	MAPT	20	44
C[C@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551923	EG	On-Demand	Mild	HTR1A	27	40
C[C@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551923	EG	On-Demand	Mild	HTR1B	25	40
C[C@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551923	EG	On-Demand	Mild	SLC6A4	0	43
C[C@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551923	EG	On-Demand	Mild	MPO	60	35
C[C@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551923	EG	On-Demand	Mild	MAPT	20	44
C[C@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551924	EG	On-Demand	Mild	HTR1A	27	40
C[C@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551924	EG	On-Demand	Mild	HTR1B	25	40
C[C@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551924	EG	On-Demand	Mild	SLC6A4	0	43
C[C@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551924	EG	On-Demand	Mild	MPO	60	35
C[C@H]1C[C@@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551924	EG	On-Demand	Mild	MAPT	20	44
C[C@@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551925	EG	On-Demand	Mild	HTR1A	27	40
C[C@@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551925	EG	On-Demand	Mild	HTR1B	25	40
C[C@@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551925	EG	On-Demand	Mild	SLC6A4	0	43
C[C@@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551925	EG	On-Demand	Mild	MPO	60	35
C[C@@H]1C[C@]1(C#N)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551925	EG	On-Demand	Mild	MAPT	20	44
COc1cc(OC)c2ncnc(N3CCC[C@](C)(F)C3)c2c1	ZINC000450551927	DF	On-Demand	Anodyne	PDE3A	42	34
COc1cc(OC)c2ncnc(N3CCC[C@@](C)(F)C3)c2c1	ZINC000450551928	DF	On-Demand	Anodyne	PDE3A	42	34
CC(C)C[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)Nc1nccs1	ZINC000450551934	FF	On-Demand	Anodyne	ADAM17	0	50
CC(C)C[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)Nc1nccs1	ZINC000450551934	FF	On-Demand	Anodyne	MAP1	113	39
CC(C)C[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)Nc1nccs1	ZINC000450551934	FF	On-Demand	Anodyne	GCK	22	41
CC(C)C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)Nc1nccs1	ZINC000450551935	FF	On-Demand	Anodyne	ADAM17	0	50
CC(C)C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)Nc1nccs1	ZINC000450551935	FF	On-Demand	Anodyne	MAP1	113	39
CC(C)C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)Nc1nccs1	ZINC000450551935	FF	On-Demand	Anodyne	GCK	22	41
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551944	DG	On-Demand	Anodyne	P2RX7	18	41
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551944	DG	On-Demand	Anodyne	EPHX2	32	40
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	HTR1A	30	43
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	ACHE	32	40
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	HTR1D	60	43
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	HTR1B	46	43
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	SLC6A4	0	45
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	NQO2	17	41
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	MPO	74	47
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	MC5R	33	42
O=C(CCCC(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450551945	GH	On-Demand	Anodyne	MTNR1A	20	59
CC(F)(F)CCCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450551948	GG	On-Demand	Anodyne	CA4	15	45
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccnc(OC(F)F)c1	ZINC000450551957	GG	On-Demand	Anodyne	ABL1	48	42
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccnc(OC(F)F)c1	ZINC000450551957	GG	On-Demand	Anodyne	HTR2A	17	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccnc(OC(F)F)c1	ZINC000450551957	GG	On-Demand	Anodyne	MAPK14	18	44
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccnc(OC(F)F)c1	ZINC000450551957	GG	On-Demand	Anodyne	RAF1	15	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccnc(OC(F)F)c1	ZINC000450551957	GG	On-Demand	Anodyne	ABL2	47	33
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccnc(OC(F)F)c1	ZINC000450551957	GG	On-Demand	Anodyne	EPHX2	28	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccnc(OC(F)F)c1	ZINC000450551957	GG	On-Demand	Anodyne	TYK2	19	45
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccnc(OC(F)F)c1	ZINC000450551957	GG	On-Demand	Anodyne	Q8MMZ8_EIMTE	22	41
COc1ccc(OC(F)(F)F)c(C(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450551962	GE	On-Demand	Anodyne	DRD4	41	32
COc1ccc(OC(F)(F)F)c(C(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450551962	GE	On-Demand	Anodyne	MTNR1A	42	40
COc1ccc(OC(F)(F)F)c(C(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450551962	GE	On-Demand	Anodyne	MTNR1B	37	40
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	LPL	49	39
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	CASR	46	42
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	TACR2	33	46
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	SIGMAR1	21	41
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	NPY2R	47	43
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	CCR3	27	44
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	F2R	54	34
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	EPHX2	30	42
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551965	GG	On-Demand	Anodyne	PSMB8	43	37
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	LPL	49	39
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	CASR	46	42
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	TACR2	33	46
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	SIGMAR1	21	41
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	NPY2R	47	43
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	CCR3	27	44
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	F2R	54	34
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	EPHX2	30	42
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450551966	GG	On-Demand	Anodyne	PSMB8	43	37
CC[C@@](NCCC[C@H](C)O)(C(=O)OC)c1ccccc1	ZINC000450551967	CE	On-Demand	Anodyne	AMY2	55	32
CC[C@@](NCCC[C@@H](C)O)(C(=O)OC)c1ccccc1	ZINC000450551968	CE	On-Demand	Anodyne	AMY2	55	32
CC[C@](NCCC[C@@H](C)O)(C(=O)OC)c1ccccc1	ZINC000450551969	CE	On-Demand	Anodyne	AMY2	55	32
CC[C@](NCCC[C@H](C)O)(C(=O)OC)c1ccccc1	ZINC000450551970	CE	On-Demand	Anodyne	AMY2	55	32
Cc1nc(-c2ccccn2)nc(N2CCC[C@](C)(F)C2)c1C	ZINC000450551974	DG	On-Demand	Anodyne	METAP1	30	45
Cc1nc(-c2ccccn2)nc(N2CCC[C@@](C)(F)C2)c1C	ZINC000450551975	DG	On-Demand	Anodyne	METAP1	30	45
CS(=O)(=O)c1ccc(N2CCc3c(F)ccc(Br)c3C2)nc1	ZINC000450551977	GF	On-Demand	Anodyne	GPR119	15	42
Cc1ccccc1CCc1cc(NC(=O)CSC2CC2)n[nH]1	ZINC000450551982	DF	On-Demand	Anodyne	CDK2	17	41
CC(=O)NC[C@H](CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1)CC(C)C	ZINC000450551995	FD	On-Demand	Anodyne	GALR1	44	31
CC(=O)NC[C@H](CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1)CC(C)C	ZINC000450551996	FD	On-Demand	Anodyne	GALR1	44	31
CC(=O)c1ccc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)cc1	ZINC000450551997	GE	On-Demand	Anodyne	ACHE	16	43
CC(=O)c1ccc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)cc1	ZINC000450551997	GE	On-Demand	Anodyne	NPFFR1	43	36
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	HTR1A	36	52
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	DRD2	42	52
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	DRD1	22	46
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	DRD4	66	50
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	HTR2A	26	44
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	HTR2C	22	40
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	DRD3	58	45
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	HRP1_PLAFA	22	47
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	PLD1	47	52
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	CYP2D6	0	47
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	PLD2	71	39
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	HPGDS	23	40
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	NOD2	25	41
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	AP2S1	0	45
COc1ccc(C(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450551999	EC	On-Demand	Anodyne	ALPHA-1A	0	41
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	HTR1A	36	52
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	DRD2	42	52
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	DRD1	22	46
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	DRD4	66	50
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	HTR2A	26	44
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	HTR2C	22	40
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	DRD3	58	45
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	HRP1_PLAFA	22	47
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	PLD1	47	52
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	CYP2D6	0	47
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	PLD2	71	39
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	HPGDS	23	40
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	NOD2	25	41
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	AP2S1	0	45
COc1ccc(C(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450552000	EC	On-Demand	Anodyne	ALPHA-1A	0	41
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HTR1A	58	55
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	ADRA2A	16	51
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	DRD2	70	52
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	DRD1	24	45
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	DRD4	77	64
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	ACHE	36	57
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HRH2	35	45
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HTR1D	18	43
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HTR1B	15	43
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HTR2A	39	50
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HTR2C	35	44
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	ADRA1A	15	45
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	DRD3	96	55
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	OPRD1	16	43
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HTR4	19	41
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	CHRM3	19	56
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HRP1_PLAFA	22	44
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	NQO2	20	44
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	TRPV1	0	43
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	SIGMAR1	41	44
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	MMP13	26	42
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	CCR3	43	49
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	ADAM17	18	42
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	PLD1	58	48
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	MTNR1A	61	37
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	MTNR1B	56	37
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	ROCK2	19	41
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	HDAC6	19	43
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	FAAH	23	45
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	MMP9	18	42
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	PLD2	87	38
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	CXCR3	15	41
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	MMP1	17	42
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	MCHR1	53	55
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	CACNA1G	35	40
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	SHH	15	40
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	NOD1	32	45
COc1ccc(C(=O)NCCN2CCN(Cc3cccc(C(C)=O)c3)CC2)cc1	ZINC000450552007	GE	On-Demand	Anodyne	NOD2	43	45
CCC[C@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450552014	EE	On-Demand	Anodyne	ABCB1	45	36
CCC[C@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450552014	EE	On-Demand	Anodyne	SORD	93	44
CCC[C@@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450552015	EE	On-Demand	Anodyne	ABCB1	45	36
CCC[C@@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450552015	EE	On-Demand	Anodyne	SORD	93	44
NS(=O)(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450552017	ED	On-Demand	Bother	CA2	18	40
O=C(CN1CCN(C[C@@H]2CCCCC2(F)F)CC1)N1CCCc2ccccc21	ZINC000450552031	GG	On-Demand	Anodyne	DRD4	21	47
O=C(CN1CCN(C[C@H]2CCCCC2(F)F)CC1)N1CCCc2ccccc21	ZINC000450552035	GG	On-Demand	Anodyne	DRD4	21	47
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC(F)C1	ZINC000450552059	CD	On-Demand	Anodyne	PDEC	0	41
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CC(F)C1	ZINC000450552060	CD	On-Demand	Anodyne	PDEC	0	41
COCCOC[C@@H](O)CN(Cc1ccc2c(c1)OCO2)C1(C)CCCC1	ZINC000450552069	FF	On-Demand	Anodyne	BMP1	44	36
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	DRD2	29	42
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	DRD4	22	47
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	HTR4	43	32
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	GRIN2B	33	40
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	HTR7	29	45
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	SIGMAR1	29	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	CCR3	30	44
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	SLC18A3	0	43
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	PREP	26	40
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	HTR3B	0	42
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450552070	FF	On-Demand	Anodyne	CYP2J2	70	50
CCN(CC)S(=O)(=O)c1ccc(NCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450552072	FG	On-Demand	Bother	BDKRB1	24	47
COCCOC[C@H](O)CN(Cc1ccc2c(c1)OCO2)C1(C)CCCC1	ZINC000450552073	FF	On-Demand	Anodyne	BMP1	44	36
O=C1NCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)[C@H]1Cc1ccccc1	ZINC000450552083	GF	On-Demand	Anodyne	BRS3	28	42
O=C1NCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)[C@@H]1Cc1ccccc1	ZINC000450552084	GF	On-Demand	Anodyne	BRS3	28	42
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	HTR1A	19	41
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	DRD2	20	44
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	DRD4	42	33
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	DRD3	0	44
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	DRD5	25	44
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	HTR7	37	40
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	SSTR4	49	36
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	HTR5A	29	49
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	ABCB1B	41	34
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	MTNR1A	44	39
COc1ccc(CNC(=O)CCN2CCc3[nH]c4ccccc4c3C2)c(OC)c1	ZINC000450552092	GG	On-Demand	Anodyne	MTNR1B	42	39
CC(F)(F)CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450552113	EF	On-Demand	Anodyne	LRRK2	30	42
CCS(=O)(=O)c1ccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1	ZINC000450552116	GG	On-Demand	Anodyne	CA2	22	49
CCS(=O)(=O)c1ccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1	ZINC000450552116	GG	On-Demand	Anodyne	LTA4H	18	44
CCS(=O)(=O)c1ccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1	ZINC000450552116	GG	On-Demand	Anodyne	CA1	20	49
CCS(=O)(=O)c1ccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1	ZINC000450552116	GG	On-Demand	Anodyne	MMP8	22	40
CCS(=O)(=O)c1ccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1	ZINC000450552116	GG	On-Demand	Anodyne	IDO1	23	42
CCS(=O)(=O)c1ccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1	ZINC000450552116	GG	On-Demand	Anodyne	RORC	67	55
CCOC(=O)c1cc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)ncc1Cl	ZINC000450552122	EH	On-Demand	Bother	CACNA1C	45	37
CCOC(=O)c1cc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)ncc1Cl	ZINC000450552122	EH	On-Demand	Bother	CACNA1D	57	37
CC(F)(F)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450552158	EH	On-Demand	Anodyne	TAAR1	36	45
CC(F)(F)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450552158	EH	On-Demand	Anodyne	KCNK3	89	41
CC(F)(F)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450552158	EH	On-Demand	Anodyne	KCNK9	58	41
CC1CCC(NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450552162	GG	On-Demand	Anodyne	DRD2	20	44
CC1CCC(NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450552162	GG	On-Demand	Anodyne	DRD4	43	50
CC1CCC(NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450552162	GG	On-Demand	Anodyne	SLC6A1	25	41
CC1CCC(NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450552162	GG	On-Demand	Anodyne	HRH3	18	49
CC1CCC(NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450552162	GG	On-Demand	Anodyne	SIGMAR1	36	48
CC1CCC(NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450552162	GG	On-Demand	Anodyne	CACNA1G	17	40
CC1CCC(NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450552162	GG	On-Demand	Anodyne	BIRC2	62	45
CCS(=O)(=O)c1ccc(CN2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)cc1	ZINC000450552171	FG	On-Demand	Anodyne	HRH3	16	48
CCS(=O)(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)cc1	ZINC000450552172	FG	On-Demand	Anodyne	HRH3	16	48
CCS(=O)(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450552173	FG	On-Demand	Anodyne	HRH3	16	48
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450552174	FG	On-Demand	Anodyne	HRH3	16	48
CCS(=O)(=O)c1ccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)cc1	ZINC000450552179	GI	On-Demand	Anodyne	RORC	28	40
N#Cc1ccc(OCC(=O)N2CC(F)C2)cc1Br	ZINC000450552180	DD	On-Demand	Mild	TRPV4	42	32
CN(C)C(=O)NCCN(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450552188	FD	On-Demand	Anodyne	PSBA	0	58
COC(=O)c1csc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)n1	ZINC000450552206	GE	On-Demand	Anodyne	CCR3	106	52
COC(=O)c1csc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)n1	ZINC000450552206	GE	On-Demand	Anodyne	EPHX2	43	39
COC(=O)c1csc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)n1	ZINC000450552207	GE	On-Demand	Anodyne	CCR3	106	52
COC(=O)c1csc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)n1	ZINC000450552207	GE	On-Demand	Anodyne	EPHX2	43	39
CN1CCC[C@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552212	GE	On-Demand	Anodyne	HTR1A	21	44
CN1CCC[C@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552212	GE	On-Demand	Anodyne	HTR1D	109	39
CN1CCC[C@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552212	GE	On-Demand	Anodyne	HTR1B	89	39
CN1CCC[C@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552212	GE	On-Demand	Anodyne	SLC6A4	15	48
CN1CCC[C@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552212	GE	On-Demand	Anodyne	MPO	52	37
CN1CCC[C@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552212	GE	On-Demand	Anodyne	MTNR1A	19	45
CN1CCC[C@@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552213	GE	On-Demand	Anodyne	HTR1A	21	44
CN1CCC[C@@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552213	GE	On-Demand	Anodyne	HTR1D	109	39
CN1CCC[C@@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552213	GE	On-Demand	Anodyne	HTR1B	89	39
CN1CCC[C@@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552213	GE	On-Demand	Anodyne	SLC6A4	15	48
CN1CCC[C@@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552213	GE	On-Demand	Anodyne	MPO	52	37
CN1CCC[C@@H](C(=O)NCCc2c[nH]c3ccc(Br)cc23)C1=O	ZINC000450552213	GE	On-Demand	Anodyne	MTNR1A	19	45
C[C@]1(F)CCCN(c2nccc(OCc3ccccc3)n2)C1	ZINC000450552245	DG	On-Demand	Anodyne	SLC12A5	55	33
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552246	GG	On-Demand	Anodyne	CHRM3	17	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552246	GG	On-Demand	Anodyne	MMP13	22	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552246	GG	On-Demand	Anodyne	SSTR3	31	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552246	GG	On-Demand	Anodyne	CCR2	19	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552246	GG	On-Demand	Anodyne	PRKCA	47	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552246	GG	On-Demand	Anodyne	PRKACA	49	35
C[C@@]1(F)CCCN(c2nccc(OCc3ccccc3)n2)C1	ZINC000450552247	DG	On-Demand	Anodyne	SLC12A5	55	33
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552248	GG	On-Demand	Anodyne	CHRM3	17	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552248	GG	On-Demand	Anodyne	MMP13	22	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552248	GG	On-Demand	Anodyne	SSTR3	31	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552248	GG	On-Demand	Anodyne	CCR2	19	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552248	GG	On-Demand	Anodyne	PRKCA	47	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552248	GG	On-Demand	Anodyne	PRKACA	49	35
C[C@@H](CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552249	GD	On-Demand	Anodyne	ADRA1B	18	44
C[C@@H](CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552249	GD	On-Demand	Anodyne	BIRC2	25	41
C[C@@H](CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552249	GD	On-Demand	Anodyne	SFRP1	56	33
C[C@@H](CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552249	GD	On-Demand	Anodyne	WNT3	42	34
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552250	GG	On-Demand	Anodyne	CHRM3	17	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552250	GG	On-Demand	Anodyne	MMP13	22	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552250	GG	On-Demand	Anodyne	SSTR3	31	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552250	GG	On-Demand	Anodyne	CCR2	19	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552250	GG	On-Demand	Anodyne	PRKCA	47	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)cc2)c1	ZINC000450552250	GG	On-Demand	Anodyne	PRKACA	49	35
C[C@@H](CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552251	GD	On-Demand	Anodyne	ADRA1B	18	44
C[C@@H](CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552251	GD	On-Demand	Anodyne	BIRC2	25	41
C[C@@H](CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552251	GD	On-Demand	Anodyne	SFRP1	56	33
C[C@@H](CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552251	GD	On-Demand	Anodyne	WNT3	42	34
C[C@H](CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552252	GD	On-Demand	Anodyne	ADRA1B	18	44
C[C@H](CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552252	GD	On-Demand	Anodyne	BIRC2	25	41
C[C@H](CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552252	GD	On-Demand	Anodyne	SFRP1	56	33
C[C@H](CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552252	GD	On-Demand	Anodyne	WNT3	42	34
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552253	GG	On-Demand	Anodyne	CHRM3	17	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552253	GG	On-Demand	Anodyne	MMP13	22	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552253	GG	On-Demand	Anodyne	SSTR3	31	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552253	GG	On-Demand	Anodyne	CCR2	19	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552253	GG	On-Demand	Anodyne	PRKCA	47	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)cc2)c1	ZINC000450552253	GG	On-Demand	Anodyne	PRKACA	49	35
C[C@H](CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552254	GD	On-Demand	Anodyne	ADRA1B	18	44
C[C@H](CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552254	GD	On-Demand	Anodyne	BIRC2	25	41
C[C@H](CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552254	GD	On-Demand	Anodyne	SFRP1	56	33
C[C@H](CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450552254	GD	On-Demand	Anodyne	WNT3	42	34
COC(=O)[C@@H]1CN(c2noc(C(C)(C)C)n2)C[C@H]1c1ccc(O)cc1	ZINC000450552257	EE	On-Demand	Anodyne	SLC6A1	40	41
CC(=O)[C@@](C)(O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450552260	CE	On-Demand	Anodyne	MLNR	37	48
CC(=O)[C@](C)(O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450552261	CE	On-Demand	Anodyne	MLNR	37	48
CC(F)(F)CCCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450552263	EE	On-Demand	Anodyne	NPY1R	40	33
CC(F)(F)CCCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450552263	EE	On-Demand	Anodyne	NPY2R	60	38
CO[C@@H]1COCC[C@H]1CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552270	GF	On-Demand	Anodyne	EPHX2	31	42
CO[C@H]1COCC[C@@H]1CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552271	GF	On-Demand	Anodyne	EPHX2	31	42
CO[C@H]1COCC[C@H]1CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552272	GF	On-Demand	Anodyne	EPHX2	31	42
CO[C@@H]1COCC[C@@H]1CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552274	GF	On-Demand	Anodyne	EPHX2	31	42
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)cc1	ZINC000450552279	FI	On-Demand	Anodyne	CCR3	95	44
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)cc1	ZINC000450552279	FI	On-Demand	Anodyne	EPHX2	15	44
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)cc1	ZINC000450552284	FI	On-Demand	Anodyne	CCR3	95	44
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)cc1	ZINC000450552284	FI	On-Demand	Anodyne	EPHX2	15	44
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)cc1	ZINC000450552285	FI	On-Demand	Anodyne	CCR3	95	44
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)cc1	ZINC000450552285	FI	On-Demand	Anodyne	EPHX2	15	44
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)cc1	ZINC000450552286	FI	On-Demand	Anodyne	CCR3	95	44
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)cc1	ZINC000450552286	FI	On-Demand	Anodyne	EPHX2	15	44
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	ABL1	60	46
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	HTR2A	21	43
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	LCK	24	40
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	MAPK14	21	44
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	SRC	15	40
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	RAF1	22	41
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	KDR	21	44
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	ABL2	56	37
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	MTOR	40	36
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	EPHX2	33	41
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	MCHR1	15	43
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	32	41
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	BTK	24	40
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	DDR1	43	37
CC(F)(F)c1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1	ZINC000450552304	GH	On-Demand	Anodyne	SHH	40	33
CC[C@](NC[C@@H]1CCC(F)(F)C1)(C(=O)OC)c1ccccc1	ZINC000450552306	DG	On-Demand	Anodyne	AMY2	56	34
CC[C@@](NC[C@@H]1CCC(F)(F)C1)(C(=O)OC)c1ccccc1	ZINC000450552307	DG	On-Demand	Anodyne	AMY2	56	34
CC[C@@](NC[C@H]1CCC(F)(F)C1)(C(=O)OC)c1ccccc1	ZINC000450552309	DG	On-Demand	Anodyne	AMY2	56	34
CC[C@](NC[C@H]1CCC(F)(F)C1)(C(=O)OC)c1ccccc1	ZINC000450552311	DG	On-Demand	Anodyne	AMY2	56	34
C[C@]1(F)CCCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450552313	CH	On-Demand	Anodyne	RBP4	20	47
C[C@@]1(F)CCCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450552316	CH	On-Demand	Anodyne	RBP4	20	47
COc1cc(CC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ccc1O	ZINC000450552318	GG	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ccc1O	ZINC000450552318	GG	On-Demand	Anodyne	EPHX2	29	44
COc1cc(CC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ccc1O	ZINC000450552318	GG	On-Demand	Anodyne	NCE103	32	43
COc1cc(CC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ccc1O	ZINC000450552318	GG	On-Demand	Anodyne	P96878_MYCTU	17	43
COc1cc(CC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ccc1O	ZINC000450552318	GG	On-Demand	Anodyne	CAN2	0	43
COC(=O)[C@@H]1CN(c2cc(N3CCC[C@@H](C)C3)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450552324	GF	On-Demand	Anodyne	SLC6A1	63	43
COC(=O)[C@@H]1CN(c2cc(N3CCC[C@@H](C)C3)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450552324	GF	On-Demand	Anodyne	SLC6A3	29	40
COC(=O)[C@@H]1CN(c2cc(N3CCC[C@H](C)C3)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450552327	GF	On-Demand	Anodyne	SLC6A1	63	43
COC(=O)[C@@H]1CN(c2cc(N3CCC[C@H](C)C3)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450552327	GF	On-Demand	Anodyne	SLC6A3	29	40
COC(=O)[C@@H]1CN(c2cc(C#N)ccc2C(C)=O)C[C@H]1c1ccc(O)cc1	ZINC000450552328	FF	On-Demand	Mild	SLC6A1	35	41
CC(F)(F)CCNc1ccnc2cc(F)ccc12	ZINC000450552358	CH	On-Demand	Anodyne	HRP1_PLAFA	118	38
CC(F)(F)CCNc1ccnc2cc(F)ccc12	ZINC000450552358	CH	On-Demand	Anodyne	HNMT	55	39
CC(F)(F)CCNc1ccnc2cc(F)ccc12	ZINC000450552358	CH	On-Demand	Anodyne	BOTA	15	46
Cc1nn(C)cc1CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552361	FE	On-Demand	Anodyne	HTR2A	18	40
Cc1nn(C)cc1CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552361	FE	On-Demand	Anodyne	P2RX7	41	47
Cc1nn(C)cc1CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552361	FE	On-Demand	Anodyne	EPHX2	30	41
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552366	DG	On-Demand	Anodyne	HTR1D	35	46
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552366	DG	On-Demand	Anodyne	HTR1B	28	46
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552366	DG	On-Demand	Anodyne	SIGMAR1	26	40
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552366	DG	On-Demand	Anodyne	CCR3	50	39
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552366	DG	On-Demand	Anodyne	MCHR1	29	40
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552366	DG	On-Demand	Anodyne	CACNA1G	21	42
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	HTR1A	25	45
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	DRD2	33	45
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	DRD1	17	40
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	DRD4	57	44
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	DRD3	56	45
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	HRP1_PLAFA	30	45
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	PLD1	55	49
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	PLD2	72	38
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	MCHR1	31	44
COc1ccc(C(=O)NCCN2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450552367	GD	On-Demand	Anodyne	CACNA1I	40	36
C[C@H](CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450552371	ED	On-Demand	Anodyne	CCR3	99	44
C[C@H](CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450552371	ED	On-Demand	Anodyne	EPHX2	55	44
C[C@@H](CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450552377	ED	On-Demand	Anodyne	CCR3	99	44
C[C@@H](CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450552377	ED	On-Demand	Anodyne	EPHX2	55	44
C[C@H](CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450552379	ED	On-Demand	Anodyne	CCR3	99	44
C[C@H](CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450552379	ED	On-Demand	Anodyne	EPHX2	55	44
C[C@@H](CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450552381	ED	On-Demand	Anodyne	CCR3	99	44
C[C@@H](CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450552381	ED	On-Demand	Anodyne	EPHX2	55	44
Cc1ccc(F)c(CN2C[C@@H](C(N)=O)Cc3ccccc32)c1	ZINC000450552388	CF	On-Demand	Anodyne	DRD4	22	40
Cc1ccc(F)c(CN2C[C@H](C(N)=O)Cc3ccccc32)c1	ZINC000450552389	CF	On-Demand	Anodyne	DRD4	22	40
C[C@@H]1C[C@@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552404	DG	On-Demand	Anodyne	SIRT3	46	36
C[C@@H]1C[C@@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552404	DG	On-Demand	Anodyne	SIRT2	49	36
C[C@@H]1C[C@@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552404	DG	On-Demand	Anodyne	SIRT1	46	36
C[C@H]1C[C@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552405	DG	On-Demand	Anodyne	SIRT3	46	36
C[C@H]1C[C@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552405	DG	On-Demand	Anodyne	SIRT2	49	36
C[C@H]1C[C@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552405	DG	On-Demand	Anodyne	SIRT1	46	36
C[C@H]1C[C@@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552406	DG	On-Demand	Anodyne	SIRT3	46	36
C[C@H]1C[C@@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552406	DG	On-Demand	Anodyne	SIRT2	49	36
C[C@H]1C[C@@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552406	DG	On-Demand	Anodyne	SIRT1	46	36
C[C@@H]1C[C@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552407	DG	On-Demand	Anodyne	SIRT3	46	36
C[C@@H]1C[C@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552407	DG	On-Demand	Anodyne	SIRT2	49	36
C[C@@H]1C[C@H](CCNC(=O)c2cc3cccnc3s2)CCO1	ZINC000450552407	DG	On-Demand	Anodyne	SIRT1	46	36
CCOC(=O)c1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)nc1	ZINC000450552410	GD	On-Demand	Anodyne	SSTR5	44	39
C[C@@H]1C[C@@H](CCNC(=O)c2cc(-c3ccccc3)nn2C)CCO1	ZINC000450552414	EG	On-Demand	Anodyne	INHA	76	34
C[C@H]1C[C@@H](CCNC(=O)c2cc(-c3ccccc3)nn2C)CCO1	ZINC000450552415	EG	On-Demand	Anodyne	INHA	76	34
C[C@@H]1C[C@H](CCNC(=O)c2cc(-c3ccccc3)nn2C)CCO1	ZINC000450552416	EG	On-Demand	Anodyne	INHA	76	34
C[C@H]1C[C@H](CCNC(=O)c2cc(-c3ccccc3)nn2C)CCO1	ZINC000450552417	EG	On-Demand	Anodyne	INHA	76	34
O=C(CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1)c1ccccc1	ZINC000450552418	GE	On-Demand	Anodyne	HTR1A	28	50
O=C(CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1)c1ccccc1	ZINC000450552418	GE	On-Demand	Anodyne	DRD2	29	42
O=C(CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1)c1ccccc1	ZINC000450552418	GE	On-Demand	Anodyne	DRD4	21	42
O=C(CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1)c1ccccc1	ZINC000450552418	GE	On-Demand	Anodyne	HTR2A	23	45
O=C(CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1)c1ccccc1	ZINC000450552418	GE	On-Demand	Anodyne	DRD3	16	43
O=C(CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1)c1ccccc1	ZINC000450552418	GE	On-Demand	Anodyne	HTR7	46	45
O=C(CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1)c1ccccc1	ZINC000450552418	GE	On-Demand	Anodyne	HSD11B1	15	46
O=C(CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1)c1ccccc1	ZINC000450552418	GE	On-Demand	Anodyne	CYP2J2	57	40
Cc1ccc(NC(=O)c2ccc(NCCC(C)(F)F)nc2)cc1	ZINC000450552420	DH	On-Demand	Anodyne	KIT	16	44
Cc1ccc(NC(=O)c2ccc(NCCC(C)(F)F)nc2)cc1	ZINC000450552420	DH	On-Demand	Anodyne	TRPV1	21	46
Cc1ccc(NC(=O)c2ccc(NCCC(C)(F)F)nc2)cc1	ZINC000450552420	DH	On-Demand	Anodyne	CXCR2	15	40
Cc1ccc(NC(=O)c2ccc(NCCC(C)(F)F)nc2)cc1	ZINC000450552420	DH	On-Demand	Anodyne	MAP3K5	44	36
COc1ccc(OC(F)(F)F)c(C(=O)Nc2nnc(C)n2C)c1	ZINC000450552432	EE	On-Demand	Anodyne	KCNK3	26	42
COc1ccc(OC(F)(F)F)c(C(=O)Nc2nnc(C)n2C)c1	ZINC000450552432	EE	On-Demand	Anodyne	KCNK9	30	42
COc1cccc2c(NCCC(C)(F)F)ccnc12	ZINC000450552444	CH	On-Demand	Anodyne	KCNN3	18	42
NC(=O)c1cc(NCCCC2CCOCC2)ccn1	ZINC000450552449	CD	On-Demand	Anodyne	SIRT2	43	31
C[C@@H]1OCC[C@@]1(C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450552480	EG	On-Demand	Anodyne	RBP4	67	37
C[C@H]1OCC[C@]1(C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450552481	EG	On-Demand	Anodyne	RBP4	67	37
C[C@H]1OCC[C@@]1(C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450552482	EG	On-Demand	Anodyne	RBP4	67	37
COC[C@@H](C)NC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450552486	CG	On-Demand	Anodyne	ALPL	18	41
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552582	DG	On-Demand	Anodyne	HTR1D	35	46
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552582	DG	On-Demand	Anodyne	HTR1B	28	46
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552582	DG	On-Demand	Anodyne	SIGMAR1	26	40
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552582	DG	On-Demand	Anodyne	CCR3	50	39
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552582	DG	On-Demand	Anodyne	MCHR1	29	40
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450552582	DG	On-Demand	Anodyne	CACNA1G	21	42
CCOC(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)nc1	ZINC000450552589	FH	On-Demand	Anodyne	DRD4	16	43
CCOC(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)nc1	ZINC000450552589	FH	On-Demand	Anodyne	HTR2B	15	54
CCOC(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)nc1	ZINC000450552589	FH	On-Demand	Anodyne	SSTR5	46	43
CCc1cc(CCCN2CCc3[nH]c4ccc(Cl)cc4c3C2)on1	ZINC000450552594	EI	On-Demand	Anodyne	HTR5A	15	41
C[C@]1(F)CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450552599	DF	On-Demand	Anodyne	HDAC1	26	43
C[C@@]1(F)CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450552600	DF	On-Demand	Anodyne	HDAC1	26	43
C[C@@H](c1ccccc1)[C@@H](O)CNC1(c2ccc(F)cc2)CCOCC1	ZINC000450552624	EH	On-Demand	Anodyne	CTSD	15	42
C[C@@H](c1ccccc1)[C@@H](O)CNC1(c2ccc(F)cc2)CCOCC1	ZINC000450552624	EH	On-Demand	Anodyne	BACE1	17	40
C[C@@H](c1ccccc1)[C@H](O)CNC1(c2ccc(F)cc2)CCOCC1	ZINC000450552625	EH	On-Demand	Anodyne	CTSD	15	42
C[C@@H](c1ccccc1)[C@H](O)CNC1(c2ccc(F)cc2)CCOCC1	ZINC000450552625	EH	On-Demand	Anodyne	BACE1	17	40
C[C@H](c1ccccc1)[C@H](O)CNC1(c2ccc(F)cc2)CCOCC1	ZINC000450552626	EH	On-Demand	Anodyne	CTSD	15	42
C[C@H](c1ccccc1)[C@H](O)CNC1(c2ccc(F)cc2)CCOCC1	ZINC000450552626	EH	On-Demand	Anodyne	BACE1	17	40
C[C@H](c1ccccc1)[C@@H](O)CNC1(c2ccc(F)cc2)CCOCC1	ZINC000450552627	EH	On-Demand	Anodyne	CTSD	15	42
C[C@H](c1ccccc1)[C@@H](O)CNC1(c2ccc(F)cc2)CCOCC1	ZINC000450552627	EH	On-Demand	Anodyne	BACE1	17	40
O=C(Nc1ccc(F)cc1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450552635	GG	On-Demand	Anodyne	SIGMAR1	16	40
O=C(Nc1ccc(F)cc1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450552635	GG	On-Demand	Anodyne	CACNA1G	45	47
COC(=O)[C@H](NCCC[C@@H](C)O)c1ccc(OC)cc1	ZINC000450552641	CD	On-Demand	Anodyne	DXR	19	40
COC(=O)[C@@H](NCCC[C@H](C)O)c1ccc(OC)cc1	ZINC000450552642	CD	On-Demand	Anodyne	DXR	19	40
COC(=O)[C@@H](NCCC[C@@H](C)O)c1ccc(OC)cc1	ZINC000450552643	CD	On-Demand	Anodyne	DXR	19	40
COC(=O)[C@H](NCCC[C@H](C)O)c1ccc(OC)cc1	ZINC000450552644	CD	On-Demand	Anodyne	DXR	19	40
CC[C@@H]1C[C@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450552656	EH	On-Demand	Anodyne	HTR1A	26	43
CC[C@@H]1C[C@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450552656	EH	On-Demand	Anodyne	HTR1D	74	40
CC[C@@H]1C[C@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450552656	EH	On-Demand	Anodyne	HTR1B	58	43
CC[C@@H]1C[C@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450552656	EH	On-Demand	Anodyne	SLC6A4	0	46
CC[C@@H]1C[C@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450552656	EH	On-Demand	Anodyne	MPO	83	41
CC[C@@H]1C[C@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450552656	EH	On-Demand	Anodyne	MTNR1A	21	48
CC[C@@H]1C[C@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450552656	EH	On-Demand	Anodyne	ABCG2	25	41
COC(=O)CNC(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450552660	GE	On-Demand	Bother	TAAR1	21	46
O=[N+]([O-])c1cc(Cl)cnc1NCCCC1CCOCC1	ZINC000450552667	CG	On-Demand	Bother	PRKCQ	45	38
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552670	GI	On-Demand	Anodyne	NPY2R	61	41
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552670	GI	On-Demand	Anodyne	EPHX2	39	41
COc1cc(-c2noc(CN3CCC(Nc4ccc(F)cc4)CC3)n2)ncn1	ZINC000450552673	GF	On-Demand	Anodyne	SSTR5	65	35
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552677	GI	On-Demand	Anodyne	NPY2R	61	41
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552677	GI	On-Demand	Anodyne	EPHX2	39	41
CN1CCN(S(=O)(=O)c2ccc(N3CCC[C@](C)(F)C3)nc2)CC1	ZINC000450552678	FD	On-Demand	Anodyne	GCK	23	42
COC(=O)[C@@H]1CN(c2cncc(OCC(C)C)n2)C[C@H]1c1ccc(O)cc1	ZINC000450552686	FF	On-Demand	Anodyne	SLC6A1	37	40
CN1CCN(S(=O)(=O)c2ccc(N3CCC[C@@](C)(F)C3)nc2)CC1	ZINC000450552688	FD	On-Demand	Anodyne	GCK	23	42
COC(=O)[C@@H]1CN(c2cc(C)ccc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450552696	FG	On-Demand	Bother	SLC6A1	44	40
CCS(=O)(=O)c1ccc(CNC(C)(C)c2ccc(Cl)cc2)cc1	ZINC000450552697	FI	On-Demand	Anodyne	RORC	40	37
O=C(Nc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450552698	DH	On-Demand	Anodyne	SIGMAR1	21	43
O=C(Nc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450552698	DH	On-Demand	Anodyne	CCR3	54	41
O=C(Nc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450552698	DH	On-Demand	Anodyne	EPHX2	19	47
O=C(Nc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450552698	DH	On-Demand	Anodyne	CXCR3	16	52
O=C(Nc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450552698	DH	On-Demand	Anodyne	MCHR1	18	44
O=C(Nc1ccc(F)cc1)C1CCN(CC2=CCCCC2)CC1	ZINC000450552698	DH	On-Demand	Anodyne	CACNA1G	44	44
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	MAP	0	42
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	ADAM17	23	59
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	MAP1	124	42
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	MMP3	30	49
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	F11	28	40
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	MMP9	0	59
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	CAPN2	47	33
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	MMP1	22	59
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	GCK	26	47
CC(C)C[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552702	ED	On-Demand	Anodyne	HPN	68	36
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	MAP	0	42
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	ADAM17	23	59
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	MAP1	124	42
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	MMP3	30	49
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	F11	28	40
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	MMP9	0	59
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	CAPN2	47	33
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	MMP1	22	59
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	GCK	26	47
CC(C)C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552703	ED	On-Demand	Anodyne	HPN	68	36
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	MAP	0	42
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	ADAM17	23	59
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	MAP1	124	42
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	MMP3	30	49
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	F11	28	40
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	MMP9	0	59
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	CAPN2	47	33
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	MMP1	22	59
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	GCK	26	47
CC(C)C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552704	ED	On-Demand	Anodyne	HPN	68	36
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	MAP	0	42
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	ADAM17	23	59
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	MAP1	124	42
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	MMP3	30	49
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	F11	28	40
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	MMP9	0	59
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	CAPN2	47	33
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	MMP1	22	59
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	GCK	26	47
CC(C)C[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)Nc1nccs1	ZINC000450552706	ED	On-Demand	Anodyne	HPN	68	36
COC(=O)[C@@H]1CN(c2cc(C)c(Br)cn2)C[C@H]1c1ccc(O)cc1	ZINC000450552715	GG	On-Demand	Anodyne	SLC6A1	69	43
C[C@H]1Cc2cccc(C(=O)N3CCNC(=O)[C@H]3Cc3ccccc3)c2O1	ZINC000450552716	FE	On-Demand	Anodyne	GHRL	64	34
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000450552717	FE	On-Demand	Anodyne	CCR3	73	46
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000450552717	FE	On-Demand	Anodyne	EPHX2	22	51
C=CC(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552720	DG	On-Demand	Mild	HTR2A	17	42
C=CC(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552720	DG	On-Demand	Mild	CNR2	0	57
C=CC(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552720	DG	On-Demand	Mild	NPY2R	33	45
C=CC(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450552720	DG	On-Demand	Mild	EPHX2	24	40
C[C@@H]1Cc2cccc(C(=O)N3CCNC(=O)[C@@H]3Cc3ccccc3)c2O1	ZINC000450552722	FE	On-Demand	Anodyne	GHRL	64	34
C[C@H]1Cc2cccc(C(=O)N3CCNC(=O)[C@@H]3Cc3ccccc3)c2O1	ZINC000450552723	FE	On-Demand	Anodyne	GHRL	64	34
C[C@@H]1Cc2cccc(C(=O)N3CCNC(=O)[C@H]3Cc3ccccc3)c2O1	ZINC000450552724	FE	On-Demand	Anodyne	GHRL	64	34
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450552730	DE	On-Demand	Anodyne	GALR1	47	34
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450552731	DE	On-Demand	Anodyne	GALR1	47	34
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000450552734	FE	On-Demand	Anodyne	CCR3	73	46
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000450552734	FE	On-Demand	Anodyne	EPHX2	22	51
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000450552738	FE	On-Demand	Anodyne	CCR3	73	46
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000450552738	FE	On-Demand	Anodyne	EPHX2	22	51
O=C(NCCc1c[nH]c2ccc(Br)cc12)C1(C(F)(F)F)CCC1	ZINC000450552740	GI	On-Demand	Anodyne	HTR1D	48	39
O=C(NCCc1c[nH]c2ccc(Br)cc12)C1(C(F)(F)F)CCC1	ZINC000450552740	GI	On-Demand	Anodyne	MPO	79	41
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000450552742	FE	On-Demand	Anodyne	CCR3	73	46
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000450552742	FE	On-Demand	Anodyne	EPHX2	22	51
COC(=O)[C@@H]1CN(c2ncc(C)s2)C[C@H]1c1ccc(O)cc1	ZINC000450552749	DF	On-Demand	Anodyne	SLC6A1	69	43
CCc1cc(CCCN2CCN(CC(=O)N3CCCc4ccccc43)CC2)on1	ZINC000450552752	GF	On-Demand	Anodyne	DRD4	24	50
COC(=O)c1csc(CN2CCCC[C@H]2c2cc3ccccc3[nH]2)n1	ZINC000450552762	FI	On-Demand	Anodyne	COLA	39	40
COC(=O)c1csc(CN2CCCC[C@H]2c2cc3ccccc3[nH]2)n1	ZINC000450552762	FI	On-Demand	Anodyne	CPT1A	37	40
Cc1nnc(NC(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)n1C	ZINC000450552767	EE	On-Demand	Anodyne	MAP3K5	46	37
COC(=O)c1csc(CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)n1	ZINC000450552768	FI	On-Demand	Anodyne	COLA	39	40
COC(=O)c1csc(CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)n1	ZINC000450552768	FI	On-Demand	Anodyne	CPT1A	37	40
CCC(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450552771	DH	On-Demand	Bother	TAAR1	15	43
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1	ZINC000450552773	GE	On-Demand	Anodyne	CA2	41	40
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1	ZINC000450552773	GE	On-Demand	Anodyne	CA1	31	40
CC1CCN(CCc2cccc(NC(=O)C3(C)CCC(=O)CC3)c2)CC1	ZINC000450552779	FI	On-Demand	Anodyne	HTR1A	15	44
CC1CCN(CCc2cccc(NC(=O)C3(C)CCC(=O)CC3)c2)CC1	ZINC000450552779	FI	On-Demand	Anodyne	HTR1D	29	40
CC1CCN(CCc2cccc(NC(=O)C3(C)CCC(=O)CC3)c2)CC1	ZINC000450552779	FI	On-Demand	Anodyne	HTR1B	23	40
CC1CCN(CCc2cccc(NC(=O)C3(C)CCC(=O)CC3)c2)CC1	ZINC000450552779	FI	On-Demand	Anodyne	SIGMAR1	21	40
CC1CCN(CCc2cccc(NC(=O)C3(C)CCC(=O)CC3)c2)CC1	ZINC000450552779	FI	On-Demand	Anodyne	CCR3	52	39
CC1CCN(CCc2cccc(NC(=O)C3(C)CCC(=O)CC3)c2)CC1	ZINC000450552779	FI	On-Demand	Anodyne	BIRC2	41	35
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1	ZINC000450552780	GE	On-Demand	Anodyne	CA2	41	40
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1	ZINC000450552780	GE	On-Demand	Anodyne	CA1	31	40
CC(=O)N[C@H](C(=O)Nc1nc(Cc2ccccc2)cs1)C(C)(C)C	ZINC000450552783	EG	On-Demand	Anodyne	MMP2	22	45
CC(=O)N[C@H](C(=O)Nc1nc(Cc2ccccc2)cs1)C(C)(C)C	ZINC000450552783	EG	On-Demand	Anodyne	MMP3	31	41
CC(=O)N[C@H](C(=O)Nc1nc(Cc2ccccc2)cs1)C(C)(C)C	ZINC000450552783	EG	On-Demand	Anodyne	POL	0	44
CC(=O)N[C@H](C(=O)Nc1nc(Cc2ccccc2)cs1)C(C)(C)C	ZINC000450552783	EG	On-Demand	Anodyne	GAG-PRO	50	35
CC(=O)N[C@H](C(=O)Nc1nc(Cc2ccccc2)cs1)C(C)(C)C	ZINC000450552783	EG	On-Demand	Anodyne	Q82323_9DELA	65	31
O=C(NCCc1c[nH]c2ccc(Br)cc12)c1cnc(C2CC2)nc1	ZINC000450552787	GH	On-Demand	Anodyne	HTR1A	29	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)c1cnc(C2CC2)nc1	ZINC000450552787	GH	On-Demand	Anodyne	HTR1D	61	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)c1cnc(C2CC2)nc1	ZINC000450552787	GH	On-Demand	Anodyne	HTR1B	45	40
O=C(NCCc1c[nH]c2ccc(Br)cc12)c1cnc(C2CC2)nc1	ZINC000450552787	GH	On-Demand	Anodyne	SLC6A4	0	43
O=C(NCCc1c[nH]c2ccc(Br)cc12)c1cnc(C2CC2)nc1	ZINC000450552787	GH	On-Demand	Anodyne	MPO	52	35
O=C(NCCc1c[nH]c2ccc(Br)cc12)c1cnc(C2CC2)nc1	ZINC000450552787	GH	On-Demand	Anodyne	ABCG2	25	41
O=C(NCCc1c[nH]c2ccc(Br)cc12)c1cnc(C2CC2)nc1	ZINC000450552787	GH	On-Demand	Anodyne	MAPT	18	42
COC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552793	EF	On-Demand	Anodyne	ADRB3	25	42
COC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552793	EF	On-Demand	Anodyne	ANPEP	43	34
COC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552793	EF	On-Demand	Anodyne	SOAT1	0	49
COC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552793	EF	On-Demand	Anodyne	CAPN2	45	32
COC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552793	EF	On-Demand	Anodyne	MMP1	24	43
COC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552793	EF	On-Demand	Anodyne	GPR88	0	42
COC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552794	EF	On-Demand	Anodyne	ADRB3	25	42
COC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552794	EF	On-Demand	Anodyne	ANPEP	43	34
COC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552794	EF	On-Demand	Anodyne	SOAT1	0	49
COC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552794	EF	On-Demand	Anodyne	CAPN2	45	32
COC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552794	EF	On-Demand	Anodyne	MMP1	24	43
COC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552794	EF	On-Demand	Anodyne	GPR88	0	42
COC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552797	EF	On-Demand	Anodyne	ADRB3	25	42
COC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552797	EF	On-Demand	Anodyne	ANPEP	43	34
COC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552797	EF	On-Demand	Anodyne	SOAT1	0	49
COC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552797	EF	On-Demand	Anodyne	CAPN2	45	32
COC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552797	EF	On-Demand	Anodyne	MMP1	24	43
COC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450552797	EF	On-Demand	Anodyne	GPR88	0	42
CCC(=O)CCCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450552816	DF	On-Demand	Anodyne	CCR3	98	46
CCC(=O)CCCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450552816	DF	On-Demand	Anodyne	EPHX2	54	48
CCC(=O)CCCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450552817	DF	On-Demand	Anodyne	CCR3	98	46
CCC(=O)CCCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450552817	DF	On-Demand	Anodyne	EPHX2	54	48
CO[C@H](Cc1ccccc1)C(=O)Nc1ncn(C(C)(C)C)n1	ZINC000450552825	DE	On-Demand	Anodyne	MME	41	32
CO[C@H](Cc1ccccc1)C(=O)Nc1ncn(C(C)(C)C)n1	ZINC000450552825	DE	On-Demand	Anodyne	AMP1_PLAFQ	40	34
CO[C@H](Cc1ccccc1)C(=O)Nc1ncn(C(C)(C)C)n1	ZINC000450552825	DE	On-Demand	Anodyne	GPR142	57	32
CO[C@@H](Cc1ccccc1)C(=O)Nc1ncn(C(C)(C)C)n1	ZINC000450552827	DE	On-Demand	Anodyne	MME	41	32
CO[C@@H](Cc1ccccc1)C(=O)Nc1ncn(C(C)(C)C)n1	ZINC000450552827	DE	On-Demand	Anodyne	AMP1_PLAFQ	40	34
CO[C@@H](Cc1ccccc1)C(=O)Nc1ncn(C(C)(C)C)n1	ZINC000450552827	DE	On-Demand	Anodyne	GPR142	57	32
COC(=O)c1coc(CN2C[C@H](C(N)=O)Cc3ccccc32)n1	ZINC000450552845	DD	On-Demand	Anodyne	TPP2	40	33
CC(F)(F)CCNc1ncnc2c1ncn2C1CC1	ZINC000450552849	CF	On-Demand	Anodyne	ADORA1	46	42
CC(F)(F)CCNc1ncnc2c1ncn2C1CC1	ZINC000450552849	CF	On-Demand	Anodyne	ADORA2A	0	48
CC(F)(F)CCNc1ncnc2c1ncn2C1CC1	ZINC000450552849	CF	On-Demand	Anodyne	ADORA3	57	38
COC(=O)c1coc(CN2C[C@@H](C(N)=O)Cc3ccccc32)n1	ZINC000450552852	DD	On-Demand	Anodyne	TPP2	40	33
CSc1cccc(C(=O)NCCCn2ccnn2)c1	ZINC000450552860	CD	On-Demand	Anodyne	DRD4	41	31
CCC(=O)CCCN1CCN(Cc2nnnn2-c2ccccc2)CC1	ZINC000450552864	ED	On-Demand	Anodyne	HTR7	50	36
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552865	GI	On-Demand	Anodyne	HRH2	44	50
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552865	GI	On-Demand	Anodyne	CHRM3	24	40
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552865	GI	On-Demand	Anodyne	CCR3	130	51
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552865	GI	On-Demand	Anodyne	CYP2D6	18	51
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552865	GI	On-Demand	Anodyne	CCR2	15	43
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552865	GI	On-Demand	Anodyne	EPHX2	16	42
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552865	GI	On-Demand	Anodyne	CACNA1I	26	41
COc1cc(CC(=O)N(C)CCc2ccccc2O)ccc1O	ZINC000450552867	DE	On-Demand	Anodyne	TTR	0	43
COc1cc(CC(=O)N(C)CCc2ccccc2O)ccc1O	ZINC000450552867	DE	On-Demand	Anodyne	MBTPS1	41	31
COc1cc(CC(=O)N(C)CCc2ccccc2O)ccc1O	ZINC000450552867	DE	On-Demand	Anodyne	CAN2	0	43
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552868	GI	On-Demand	Anodyne	HRH2	44	50
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552868	GI	On-Demand	Anodyne	CHRM3	24	40
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552868	GI	On-Demand	Anodyne	CCR3	130	51
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552868	GI	On-Demand	Anodyne	CYP2D6	18	51
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552868	GI	On-Demand	Anodyne	CCR2	15	43
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552868	GI	On-Demand	Anodyne	EPHX2	16	42
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)c1	ZINC000450552868	GI	On-Demand	Anodyne	CACNA1I	26	41
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552869	GI	On-Demand	Anodyne	EGFR	28	40
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552869	GI	On-Demand	Anodyne	NPY2R	34	40
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552869	GI	On-Demand	Anodyne	EPHX2	34	41
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552869	GI	On-Demand	Anodyne	ERBB4	52	35
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552869	GI	On-Demand	Anodyne	MCHR1	41	42
Nc1ncccc1CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450552870	FH	On-Demand	Anodyne	COLA	26	41
Nc1ncccc1CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450552870	FH	On-Demand	Anodyne	GRM5	23	45
Nc1ncccc1CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450552871	FH	On-Demand	Anodyne	COLA	26	41
Nc1ncccc1CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450552871	FH	On-Demand	Anodyne	GRM5	23	45
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552873	GI	On-Demand	Anodyne	EGFR	28	40
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552873	GI	On-Demand	Anodyne	NPY2R	34	40
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552873	GI	On-Demand	Anodyne	EPHX2	34	41
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552873	GI	On-Demand	Anodyne	ERBB4	52	35
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450552873	GI	On-Demand	Anodyne	MCHR1	41	42
CCS(=O)(=O)c1ccc(CN(C)CC(=O)Nc2cc(F)cc(F)c2)cc1	ZINC000450552888	GF	On-Demand	Anodyne	LTA4H	21	43
CCS(=O)(=O)c1ccc(CN(C)CC(=O)Nc2cc(F)cc(F)c2)cc1	ZINC000450552888	GF	On-Demand	Anodyne	CA1	15	40
CCS(=O)(=O)c1ccc(CN(C)CC(=O)Nc2cc(F)cc(F)c2)cc1	ZINC000450552888	GF	On-Demand	Anodyne	RORC	70	47
C[C@@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450552896	CE	On-Demand	Anodyne	SLC6A4	22	44
C[C@@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450552896	CE	On-Demand	Anodyne	SLC6A3	31	41
C[C@@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450552896	CE	On-Demand	Anodyne	CCR3	60	34
C[C@@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450552896	CE	On-Demand	Anodyne	CCR5	22	46
C[C@@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450552896	CE	On-Demand	Anodyne	MLNR	38	49
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552902	FD	On-Demand	Anodyne	HTR1A	25	45
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552902	FD	On-Demand	Anodyne	DRD2	28	44
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552902	FD	On-Demand	Anodyne	DRD4	58	44
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552902	FD	On-Demand	Anodyne	DRD3	47	45
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552902	FD	On-Demand	Anodyne	PLD1	50	48
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552902	FD	On-Demand	Anodyne	PLD2	65	36
COc1ccc(C(=O)NCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552905	FD	On-Demand	Anodyne	HTR1A	25	45
COc1ccc(C(=O)NCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552905	FD	On-Demand	Anodyne	DRD2	28	44
COc1ccc(C(=O)NCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552905	FD	On-Demand	Anodyne	DRD4	58	44
COc1ccc(C(=O)NCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552905	FD	On-Demand	Anodyne	DRD3	47	45
COc1ccc(C(=O)NCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552905	FD	On-Demand	Anodyne	PLD1	50	48
COc1ccc(C(=O)NCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450552905	FD	On-Demand	Anodyne	PLD2	65	36
C[C@@H](O)CCCn1cnc2scc(-c3ccc(F)cc3)c2c1=O	ZINC000450552906	EG	On-Demand	Anodyne	TGM2	17	40
C[C@H](O)CCCn1cnc2scc(-c3ccc(F)cc3)c2c1=O	ZINC000450552909	EG	On-Demand	Anodyne	TGM2	17	40
CCOC(=O)[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)CC12COC2	ZINC000450552910	EC	On-Demand	Anodyne	P2RY12	30	43
CCOC(=O)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)CC12COC2	ZINC000450552911	EC	On-Demand	Anodyne	P2RY12	30	43
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CSc3ccccc32)n1	ZINC000450552912	DH	On-Demand	Bother	PRKCQ	43	36
Cc1ccc([N+](=O)[O-])c(NC[C@H]2CSc3ccccc32)n1	ZINC000450552913	DH	On-Demand	Bother	PRKCQ	43	36
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	HTR1A	25	47
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	DRD2	31	47
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	DRD1	0	42
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	DRD4	60	45
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	DRD3	40	42
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	PLD2	57	35
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	MCHR1	24	47
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	NOD2	32	42
COc1ccc(C(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450552928	FF	On-Demand	Anodyne	AP2S1	0	41
COc1cc(CC(=O)Nc2nnc(C)n2C)ccc1Cl	ZINC000450552929	CD	On-Demand	Anodyne	CAN2	0	42
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCC(=O)C1CC1	ZINC000450552939	ED	On-Demand	Anodyne	E1	0	40
COc1cc(Br)ccc1CCCNC(=O)C1CC(C)(O)C1	ZINC000450552941	FF	On-Demand	Anodyne	MTNR1B	23	40
Cc1cc(N[C@H]2CCCc3c(F)cccc32)n2ncnc2n1	ZINC000450552949	CG	On-Demand	Anodyne	DHOD	0	52
Cc1cc(N[C@@H]2CCCc3c(F)cccc32)n2ncnc2n1	ZINC000450552950	CG	On-Demand	Anodyne	DHOD	0	52
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	DRD2	21	43
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	HTR4	55	37
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	HTR7	34	42
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	SIGMAR1	16	48
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	MTNR1A	65	40
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	MTNR1B	57	40
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	MCHR1	27	40
COc1ccc(CNC(=O)CCN2CCC(NC(C)C)CC2)c(OC)c1	ZINC000450552953	FE	On-Demand	Anodyne	EHMT2	47	31
COC(=O)c1ccc(CNC(C)(C)c2ccccc2OC)cc1Cl	ZINC000450552960	EI	On-Demand	Anodyne	PDE6A	41	31
CC(=O)c1ccc(CN2CCC[C@H]2C(=O)Nc2nccs2)cc1	ZINC000450552969	EF	On-Demand	Anodyne	MAP1	114	39
CC(=O)c1ccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)cc1	ZINC000450552971	EF	On-Demand	Anodyne	MAP1	114	39
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450552975	FF	On-Demand	Anodyne	BIRC2	28	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450552976	FF	On-Demand	Anodyne	BIRC2	28	40
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450552977	FF	On-Demand	Anodyne	BIRC2	28	40
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450552978	FF	On-Demand	Anodyne	BIRC2	28	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H]1CCCc2c(F)cccc21	ZINC000450552980	GF	On-Demand	Anodyne	CA2	22	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H]1CCCc2c(F)cccc21	ZINC000450552980	GF	On-Demand	Anodyne	CA1	21	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H]1CCCc2c(F)cccc21	ZINC000450552980	GF	On-Demand	Anodyne	CA7	30	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1CCCc2c(F)cccc21	ZINC000450552982	GF	On-Demand	Anodyne	CA2	22	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1CCCc2c(F)cccc21	ZINC000450552982	GF	On-Demand	Anodyne	CA1	21	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1CCCc2c(F)cccc21	ZINC000450552982	GF	On-Demand	Anodyne	CA7	30	40
C[C@H](Nc1cccc(C(=O)OC(C)(C)C)n1)c1ccc([N+](=O)[O-])cc1	ZINC000450552984	EI	On-Demand	Bother	CCR3	17	41
CC[C@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552986	ED	On-Demand	Anodyne	CA2	62	53
CC[C@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552986	ED	On-Demand	Anodyne	CA1	54	53
CC[C@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552986	ED	On-Demand	Anodyne	CA7	38	46
CC[C@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552986	ED	On-Demand	Anodyne	CA4	65	51
CC[C@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552986	ED	On-Demand	Anodyne	CA5A	42	36
CC[C@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552986	ED	On-Demand	Anodyne	P96878_MYCTU	40	33
CCc1cc(N[C@H]2CCCc3c(F)cccc32)n2ncnc2n1	ZINC000450552987	DG	On-Demand	Anodyne	DHOD	0	45
CCc1cc(N[C@@H]2CCCc3c(F)cccc32)n2ncnc2n1	ZINC000450552988	DG	On-Demand	Anodyne	DHOD	0	45
CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552990	ED	On-Demand	Anodyne	CA2	62	53
CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552990	ED	On-Demand	Anodyne	CA1	54	53
CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552990	ED	On-Demand	Anodyne	CA7	38	46
CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552990	ED	On-Demand	Anodyne	CA4	65	51
CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552990	ED	On-Demand	Anodyne	CA5A	42	36
CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450552990	ED	On-Demand	Anodyne	P96878_MYCTU	40	33
CC(C)(O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450552993	FG	On-Demand	Anodyne	AVPR1B	31	45
CC(C)(O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450552993	FG	On-Demand	Anodyne	PDE6D	65	38
CC(C)(O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450552993	FG	On-Demand	Anodyne	HDAC8	26	42
CC(C)(O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450552993	FG	On-Demand	Anodyne	HDAC6	20	42
CC(C)(O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450552993	FG	On-Demand	Anodyne	IMDH_CRYPV	37	58
CC(F)(F)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450553022	CH	On-Demand	Anodyne	UTS2R	26	49
CC(=O)c1cccc(CN2CCC[C@H]2C(=O)Nc2nccs2)c1	ZINC000450553027	EF	On-Demand	Anodyne	MAP1	97	37
CC(=O)c1cccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)c1	ZINC000450553028	EF	On-Demand	Anodyne	MAP1	97	37
CCc1cc(CCCN2CCC[C@H]2C(=O)Nc2nccs2)on1	ZINC000450553034	EF	On-Demand	Anodyne	MAP1	62	36
CCc1cc(CCCN2CCC[C@@H]2C(=O)Nc2nccs2)on1	ZINC000450553035	EF	On-Demand	Anodyne	MAP1	62	36
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CO)C1	ZINC000450553047	DE	On-Demand	Anodyne	PDE6D	73	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CO)C1	ZINC000450553047	DE	On-Demand	Anodyne	HDAC8	27	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CO)C1	ZINC000450553047	DE	On-Demand	Anodyne	HDAC6	20	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CO)C1	ZINC000450553047	DE	On-Demand	Anodyne	PTGDR2	18	40
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CO)C1	ZINC000450553047	DE	On-Demand	Anodyne	IMDH_CRYPV	32	51
O=C(NC[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1)Nc1cccc(F)c1	ZINC000450553053	GF	On-Demand	Anodyne	CCR3	132	52
O=C(NC[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1)Nc1cccc(F)c1	ZINC000450553053	GF	On-Demand	Anodyne	CYP2D6	17	43
O=C(NC[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1)Nc1cccc(F)c1	ZINC000450553054	GF	On-Demand	Anodyne	CCR3	132	52
O=C(NC[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1)Nc1cccc(F)c1	ZINC000450553054	GF	On-Demand	Anodyne	CYP2D6	17	43
C=CCOc1ccc(CC(=O)N2CC(F)C2)cc1	ZINC000450553058	BD	On-Demand	Mild	GPR183	0	40
COc1cccc([C@H]2C[C@H](C)CN2C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450553070	FH	On-Demand	Anodyne	MTNR1A	25	41
COc1cccc([C@H]2C[C@H](C)CN2C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450553070	FH	On-Demand	Anodyne	MTNR1B	25	44
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450553071	FH	On-Demand	Anodyne	MTNR1A	25	41
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450553071	FH	On-Demand	Anodyne	MTNR1B	25	44
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450553072	FH	On-Demand	Anodyne	MTNR1A	25	41
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450553072	FH	On-Demand	Anodyne	MTNR1B	25	44
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450553073	FH	On-Demand	Anodyne	MTNR1A	25	41
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450553073	FH	On-Demand	Anodyne	MTNR1B	25	44
COC(=O)C1CCC(NC(=O)c2ccc(N3CCC3)nc2)(C(=O)OC)CC1	ZINC000450553080	GD	On-Demand	Anodyne	FASN	20	40
COC(=O)C1CCC(NC(=O)c2ccc(N3CCC3)nc2)(C(=O)OC)CC1	ZINC000450553080	GD	On-Demand	Anodyne	HPGDS	22	47
COC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450553082	EF	On-Demand	Anodyne	ADRB3	25	42
COC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450553082	EF	On-Demand	Anodyne	ANPEP	43	34
COC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450553082	EF	On-Demand	Anodyne	SOAT1	0	49
COC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450553082	EF	On-Demand	Anodyne	CAPN2	45	32
COC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450553082	EF	On-Demand	Anodyne	MMP1	24	43
COC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1	ZINC000450553082	EF	On-Demand	Anodyne	GPR88	0	42
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000450553097	GH	On-Demand	Anodyne	DRD4	35	45
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000450553097	GH	On-Demand	Anodyne	ADORA1	16	41
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000450553097	GH	On-Demand	Anodyne	HTR2B	15	55
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000450553097	GH	On-Demand	Anodyne	ADORA2B	43	34
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000450553097	GH	On-Demand	Anodyne	SSTR5	62	42
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000450553097	GH	On-Demand	Anodyne	AKT2	44	41
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000450553097	GH	On-Demand	Anodyne	NPY5R	24	42
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000450553097	GH	On-Demand	Anodyne	AKT1	20	43
C[C@@]1(F)CCCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000450553101	CH	On-Demand	Mild	AR	19	55
C[C@]1(F)CCCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000450553102	CH	On-Demand	Mild	AR	19	55
N#CC1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CCC1	ZINC000450553113	EH	On-Demand	Mild	ERBB4	41	36
N#CC1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CCC1	ZINC000450553113	EH	On-Demand	Mild	ENV	41	34
N#CC1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CCC1	ZINC000450553113	EH	On-Demand	Mild	MCHR1	46	45
Cc1cccc2c1O[C@H](C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1)C2	ZINC000450553117	FD	On-Demand	Anodyne	GHRL	52	33
Cc1cccc2c1O[C@@H](C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1)C2	ZINC000450553120	FD	On-Demand	Anodyne	GHRL	52	33
Cc1cccc2c1O[C@H](C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1)C2	ZINC000450553123	FD	On-Demand	Anodyne	GHRL	52	33
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cncc(Cl)c1	ZINC000450553124	FG	On-Demand	Anodyne	ABL1	37	40
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cncc(Cl)c1	ZINC000450553124	FG	On-Demand	Anodyne	HTR2A	17	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cncc(Cl)c1	ZINC000450553124	FG	On-Demand	Anodyne	PIK3CA	23	40
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cncc(Cl)c1	ZINC000450553124	FG	On-Demand	Anodyne	EPHX2	25	45
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cncc(Cl)c1	ZINC000450553124	FG	On-Demand	Anodyne	SCN10A	41	41
Cc1cccc2c1O[C@@H](C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1)C2	ZINC000450553125	FD	On-Demand	Anodyne	GHRL	52	33
CC[C@H](O)CC(=O)Nc1ccc2c(C)[nH]nc2c1	ZINC000450553142	BD	On-Demand	Anodyne	SLC1A2	55	33
CC[C@@H](O)CC(=O)Nc1ccc2c(C)[nH]nc2c1	ZINC000450553144	BD	On-Demand	Anodyne	SLC1A2	55	33
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450553146	FF	On-Demand	Anodyne	EPHX2	29	41
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450553148	FF	On-Demand	Anodyne	EPHX2	29	41
COC(=O)c1csc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)n1	ZINC000450553163	GF	On-Demand	Anodyne	DRD4	24	40
COC(=O)c1csc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)n1	ZINC000450553163	GF	On-Demand	Anodyne	SORD	44	33
O=S(=O)(c1ccc(NCCCC2CCOCC2)nc1)N1CCCC1	ZINC000450553173	FD	On-Demand	Anodyne	MERTK	32	41
CCCN(Cc1ccc(C(C)=O)cc1)C[C@H]1CCCCO1	ZINC000450553178	CH	On-Demand	Anodyne	OXTR	26	41
CCCN(Cc1ccc(C(C)=O)cc1)C[C@H]1CCCCO1	ZINC000450553178	CH	On-Demand	Anodyne	AVPR1A	17	41
CCCN(Cc1ccc(C(C)=O)cc1)C[C@@H]1CCCCO1	ZINC000450553179	CH	On-Demand	Anodyne	OXTR	26	41
CCCN(Cc1ccc(C(C)=O)cc1)C[C@@H]1CCCCO1	ZINC000450553179	CH	On-Demand	Anodyne	AVPR1A	17	41
Cc1cc(C)cc(C2=CCN(C(=O)[C@H](O)C3CCC3)CC2)c1	ZINC000450553181	CG	On-Demand	Anodyne	ADAM10	27	42
Cc1cc(C)cc(C2=CCN(C(=O)[C@@H](O)C3CCC3)CC2)c1	ZINC000450553182	CG	On-Demand	Anodyne	ADAM10	27	42
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)[C@@H](O)C1CCC1	ZINC000450553186	EG	On-Demand	Anodyne	PHES	0	40
COc1ccc(C(=O)NCCN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450553188	FF	On-Demand	Anodyne	HTR1A	24	47
COc1ccc(C(=O)NCCN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450553188	FF	On-Demand	Anodyne	DRD2	30	47
COc1ccc(C(=O)NCCN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450553188	FF	On-Demand	Anodyne	DRD1	0	42
COc1ccc(C(=O)NCCN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450553188	FF	On-Demand	Anodyne	DRD4	60	45
COc1ccc(C(=O)NCCN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450553188	FF	On-Demand	Anodyne	DRD3	38	42
COc1ccc(C(=O)NCCN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450553188	FF	On-Demand	Anodyne	PLD2	58	35
COc1ccc(C(=O)NCCN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450553188	FF	On-Demand	Anodyne	AP2S1	0	42
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C1CC1)[C@@H](O)C1CCC1	ZINC000450553191	EG	On-Demand	Anodyne	PHES	0	40
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)[C@H](O)C1CCC1	ZINC000450553192	EG	On-Demand	Anodyne	PHES	0	40
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C1CC1)[C@H](O)C1CCC1	ZINC000450553193	EG	On-Demand	Anodyne	PHES	0	40
COc1cc(Br)ccc1CCCNC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450553206	GG	On-Demand	Anodyne	MTNR1A	34	40
COc1cc(Br)ccc1CCCNC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450553206	GG	On-Demand	Anodyne	MTNR1B	37	45
c1ccc2nc(NCCCC3CCOCC3)cnc2c1	ZINC000450553220	CG	On-Demand	Anodyne	METG	41	32
O=C1NCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)[C@H]1Cc1ccccc1	ZINC000450553237	GD	On-Demand	Anodyne	PDEC	0	42
O=C1NCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)[C@H]1Cc1ccccc1	ZINC000450553239	GD	On-Demand	Anodyne	PDEC	0	42
O=C1NCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)[C@@H]1Cc1ccccc1	ZINC000450553241	GD	On-Demand	Anodyne	PDEC	0	42
O=C1NCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)[C@@H]1Cc1ccccc1	ZINC000450553244	GD	On-Demand	Anodyne	PDEC	0	42
CC(C)N1CCCC[C@@H]1CN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450553250	GF	On-Demand	Anodyne	DRD4	22	45
C[C@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450553252	CE	On-Demand	Anodyne	SLC6A4	22	44
C[C@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450553252	CE	On-Demand	Anodyne	SLC6A3	31	41
C[C@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450553252	CE	On-Demand	Anodyne	CCR3	60	34
C[C@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450553252	CE	On-Demand	Anodyne	CCR5	22	46
C[C@H](O)CCN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450553252	CE	On-Demand	Anodyne	MLNR	38	49
COC(=O)[C@@H]1CN(c2nc3ccccc3o2)C[C@H]1c1ccc(O)cc1	ZINC000450553254	EF	On-Demand	Anodyne	SLC6A1	65	46
COC(=O)[C@@H]1CN(c2nc3ccccc3o2)C[C@H]1c1ccc(O)cc1	ZINC000450553254	EF	On-Demand	Anodyne	NPBWR1	39	40
CO[C@@H](Cc1ccccc1)Cn1cnc2sc3c(c2c1=O)CCC3	ZINC000450553255	EG	On-Demand	Anodyne	HTR1B	18	43
CO[C@H](Cc1ccccc1)Cn1cnc2sc3c(c2c1=O)CCC3	ZINC000450553257	EG	On-Demand	Anodyne	HTR1B	18	43
COc1cc2c(N3CCC[C@](C)(F)C3)ncnc2cc1F	ZINC000450553261	CG	On-Demand	Anodyne	PDE3A	53	40
COc1cc2c(N3CCC[C@](C)(F)C3)ncnc2cc1F	ZINC000450553261	CG	On-Demand	Anodyne	PDGFRB	65	40
COc1cc2c(N3CCC[C@](C)(F)C3)ncnc2cc1F	ZINC000450553261	CG	On-Demand	Anodyne	PDE3B	78	40
COc1cc2c(N3CCC[C@@](C)(F)C3)ncnc2cc1F	ZINC000450553263	CG	On-Demand	Anodyne	PDE3A	53	40
COc1cc2c(N3CCC[C@@](C)(F)C3)ncnc2cc1F	ZINC000450553263	CG	On-Demand	Anodyne	PDGFRB	65	40
COc1cc2c(N3CCC[C@@](C)(F)C3)ncnc2cc1F	ZINC000450553263	CG	On-Demand	Anodyne	PDE3B	78	40
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	HTR1A	26	48
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	DRD4	25	41
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	HTR2A	21	43
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	HTR2C	16	45
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	DRD3	20	43
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	HTR7	39	43
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	SIGMAR1	23	43
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	HTR3B	0	42
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553264	GF	On-Demand	Anodyne	CYP2J2	61	45
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	HTR1A	26	48
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	DRD4	25	41
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	HTR2A	21	43
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	HTR2C	16	45
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	DRD3	20	43
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	HTR7	39	43
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	SIGMAR1	23	43
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	HTR3B	0	42
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553265	GF	On-Demand	Anodyne	CYP2J2	61	45
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	HTR1A	26	48
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	DRD4	25	41
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	HTR2A	21	43
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	HTR2C	16	45
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	DRD3	20	43
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	HTR7	39	43
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	SIGMAR1	23	43
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	HTR3B	0	42
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553267	GF	On-Demand	Anodyne	CYP2J2	61	45
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	HTR1A	26	48
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	DRD4	25	41
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	HTR2A	21	43
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	HTR2C	16	45
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	DRD3	20	43
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	HTR7	39	43
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	SIGMAR1	23	43
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	HTR3B	0	42
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)C1	ZINC000450553271	GF	On-Demand	Anodyne	CYP2J2	61	45
CCCN(C[C@@H]1CCCCC1(F)F)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450553274	GJ	On-Demand	Anodyne	CCR5	20	42
CCCN(C[C@@H]1CCCCC1(F)F)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450553274	GJ	On-Demand	Anodyne	L3MBTL3	68	39
CC(C)N1CCCC[C@H]1CN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450553278	GF	On-Demand	Anodyne	DRD4	22	45
CC[C@@](NCc1nnc(C2CC2)s1)(C(=O)OC)c1ccccc1	ZINC000450553283	EF	On-Demand	Anodyne	AMY2	53	31
CCCN(C[C@H]1CCCCC1(F)F)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450553286	GJ	On-Demand	Anodyne	CCR5	20	42
CCCN(C[C@H]1CCCCC1(F)F)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450553286	GJ	On-Demand	Anodyne	L3MBTL3	68	39
COC(=O)[C@@H]1CN(c2nnc(C3CC3)s2)C[C@H]1c1ccc(O)cc1	ZINC000450553291	EF	On-Demand	Anodyne	SLC6A1	79	44
COc1ccc(CNC(=O)CCN(C(C)C)C2CCCC2)c(OC)c1	ZINC000450553293	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN(C(C)C)C2CCCC2)c(OC)c1	ZINC000450553293	EG	On-Demand	Anodyne	MTNR1A	55	39
CCCN(C[C@@H](O)[C@H](C)c1ccccc1)C1CCN(c2cc(C)nc(C)n2)CC1	ZINC000450553294	GH	On-Demand	Anodyne	SORD	18	43
CCCN(C[C@H](O)[C@@H](C)c1ccccc1)C1CCN(c2cc(C)nc(C)n2)CC1	ZINC000450553298	GH	On-Demand	Anodyne	SORD	18	43
CCCN(C[C@@H](O)[C@@H](C)c1ccccc1)C1CCN(c2cc(C)nc(C)n2)CC1	ZINC000450553299	GH	On-Demand	Anodyne	SORD	18	43
CCCN(C[C@H](O)[C@H](C)c1ccccc1)C1CCN(c2cc(C)nc(C)n2)CC1	ZINC000450553300	GH	On-Demand	Anodyne	SORD	18	43
CCCCNc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc(N)n1	ZINC000450553311	GE	On-Demand	Anodyne	SLC6A1	21	41
CCCCNc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nc(N)n1	ZINC000450553311	GE	On-Demand	Anodyne	HRH4	19	42
CC[C@](NCc1nnc(C2CC2)s1)(C(=O)OC)c1ccccc1	ZINC000450553314	EF	On-Demand	Anodyne	AMY2	53	31
CS[C@H](CNC(=O)Cc1ccccc1O[C@H]1CCOC1)C(C)(C)C	ZINC000450553319	FG	On-Demand	Anodyne	PDE4D	15	42
CS[C@H](CNC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(C)(C)C	ZINC000450553327	FG	On-Demand	Anodyne	PDE4D	15	42
CS[C@@H](CNC(=O)Cc1ccccc1O[C@H]1CCOC1)C(C)(C)C	ZINC000450553329	FG	On-Demand	Anodyne	PDE4D	15	42
CS[C@@H](CNC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(C)(C)C	ZINC000450553333	FG	On-Demand	Anodyne	PDE4D	15	42
CCOC(=O)c1ccc(CN2CCN(C)c3ccccc32)nc1	ZINC000450553344	DF	On-Demand	Anodyne	P2RY12	32	41
CCNC(=O)c1ccc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nn1	ZINC000450553349	FD	On-Demand	Anodyne	SLC6A1	38	42
CCNC(=O)c1ccc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)nn1	ZINC000450553349	FD	On-Demand	Anodyne	SCD1	46	38
Cn1nc(-c2ccccc2)cc1C(=O)NC(C)(C)C(C)(C)O	ZINC000450553354	DE	On-Demand	Anodyne	CTSV	47	32
C[C@]1(F)CCCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450553360	EH	On-Demand	Anodyne	AVPR2	67	45
C[C@@]1(F)CCCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450553362	EH	On-Demand	Anodyne	AVPR2	67	45
Cc1nc(C)n(CCCC(=O)Nc2nc(Cc3ccccc3)cs2)n1	ZINC000450553364	FG	On-Demand	Anodyne	HDAC9	17	41
FC(F)c1nc(NCCCC2CCOCC2)c2ccccc2n1	ZINC000450553386	DH	On-Demand	Anodyne	BCHE	43	36
CCC[C@H](OC)C(=O)Nc1nc(Cc2ccccc2)cs1	ZINC000450553399	DG	On-Demand	Anodyne	MME	26	44
CCC[C@H](OC)C(=O)Nc1nc(Cc2ccccc2)cs1	ZINC000450553399	DG	On-Demand	Anodyne	CAPN2	48	35
CCC[C@@H](OC)C(=O)Nc1nc(Cc2ccccc2)cs1	ZINC000450553403	DG	On-Demand	Anodyne	MME	26	44
CCC[C@@H](OC)C(=O)Nc1nc(Cc2ccccc2)cs1	ZINC000450553403	DG	On-Demand	Anodyne	CAPN2	48	35
COC(=O)c1csc(CN2CCCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450553405	GJ	On-Demand	Anodyne	CPT1A	27	40
COC(=O)c1csc(CN2CCCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450553405	GJ	On-Demand	Anodyne	RBP4	77	40
COC(=O)c1csc(CN2CCCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450553406	GJ	On-Demand	Anodyne	CPT1A	27	40
COC(=O)c1csc(CN2CCCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450553406	GJ	On-Demand	Anodyne	RBP4	77	40
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553407	ED	On-Demand	Anodyne	COLA	64	37
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553407	ED	On-Demand	Anodyne	CPT1A	44	30
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553407	ED	On-Demand	Anodyne	CPT2	46	37
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553407	ED	On-Demand	Anodyne	CPT1B	44	34
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553407	ED	On-Demand	Anodyne	ACKR3	63	33
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553408	ED	On-Demand	Anodyne	COLA	64	37
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553408	ED	On-Demand	Anodyne	CPT1A	44	30
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553408	ED	On-Demand	Anodyne	CPT2	46	37
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553408	ED	On-Demand	Anodyne	CPT1B	44	34
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553408	ED	On-Demand	Anodyne	ACKR3	63	33
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553409	ED	On-Demand	Anodyne	COLA	64	37
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553409	ED	On-Demand	Anodyne	CPT1A	44	30
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553409	ED	On-Demand	Anodyne	CPT2	46	37
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553409	ED	On-Demand	Anodyne	CPT1B	44	34
COc1ccc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1S(C)(=O)=O	ZINC000450553409	ED	On-Demand	Anodyne	ACKR3	63	33
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553410	ED	On-Demand	Anodyne	COLA	64	37
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553410	ED	On-Demand	Anodyne	CPT1A	44	30
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553410	ED	On-Demand	Anodyne	CPT2	46	37
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553410	ED	On-Demand	Anodyne	CPT1B	44	34
COc1ccc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1S(C)(=O)=O	ZINC000450553410	ED	On-Demand	Anodyne	ACKR3	63	33
COC(=O)CN(CC(=O)OC)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450553411	DC	On-Demand	Anodyne	KCNA5	28	43
CCC(C)(C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450553413	DF	On-Demand	Anodyne	MTNR1A	57	40
CCC(C)(C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450553413	DF	On-Demand	Anodyne	MTNR1B	48	40
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3C)n2)c(OC)c1	ZINC000450553415	GE	On-Demand	Anodyne	PDGFRB	32	41
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3C)n2)c(OC)c1	ZINC000450553415	GE	On-Demand	Anodyne	HTR7	21	43
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3C)n2)c(OC)c1	ZINC000450553415	GE	On-Demand	Anodyne	MTNR1A	49	35
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3C)n2)c(OC)c1	ZINC000450553415	GE	On-Demand	Anodyne	MTNR1B	45	35
COC(=O)CN(CC(=O)OC)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450553417	DC	On-Demand	Anodyne	KCNA5	28	43
COC(=O)CN(CC(=O)OC)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450553418	DC	On-Demand	Anodyne	KCNA5	28	43
COC(=O)CN(CC(=O)OC)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450553419	DC	On-Demand	Anodyne	KCNA5	28	43
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553420	GH	On-Demand	Anodyne	PRCP	22	40
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553420	GH	On-Demand	Anodyne	COLA	46	46
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553420	GH	On-Demand	Anodyne	CPT1A	38	46
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553420	GH	On-Demand	Anodyne	GRM5	27	50
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553420	GH	On-Demand	Anodyne	SPHK1	30	41
COC(=O)C1(CN2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553420	GH	On-Demand	Anodyne	SMO	45	36
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553422	GH	On-Demand	Anodyne	PRCP	22	40
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553422	GH	On-Demand	Anodyne	COLA	46	46
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553422	GH	On-Demand	Anodyne	CPT1A	38	46
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553422	GH	On-Demand	Anodyne	GRM5	27	50
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553422	GH	On-Demand	Anodyne	SPHK1	30	41
COC(=O)C1(CN2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1	ZINC000450553422	GH	On-Demand	Anodyne	SMO	45	36
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)cc1	ZINC000450553424	FG	On-Demand	Anodyne	CCR3	89	43
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)cc1	ZINC000450553425	FG	On-Demand	Anodyne	CCR3	89	43
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)cc1	ZINC000450553426	FG	On-Demand	Anodyne	CCR3	89	43
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)cc1	ZINC000450553427	FG	On-Demand	Anodyne	CCR3	89	43
COC(=O)[C@@H]1CN(c2ccnc3ccc(C)cc23)C[C@H]1c1ccc(O)cc1	ZINC000450553433	FH	On-Demand	Anodyne	SLC6A1	70	42
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553451	FG	On-Demand	Anodyne	DRD4	17	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553451	FG	On-Demand	Anodyne	OPRK1	17	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553451	FG	On-Demand	Anodyne	SIGMAR1	19	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553451	FG	On-Demand	Anodyne	CCR3	80	37
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553451	FG	On-Demand	Anodyne	CCR5	29	51
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553451	FG	On-Demand	Anodyne	EPHX2	52	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553451	FG	On-Demand	Anodyne	BIRC2	41	38
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553452	FG	On-Demand	Anodyne	DRD4	17	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553452	FG	On-Demand	Anodyne	OPRK1	17	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553452	FG	On-Demand	Anodyne	SIGMAR1	19	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553452	FG	On-Demand	Anodyne	CCR3	80	37
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553452	FG	On-Demand	Anodyne	CCR5	29	51
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553452	FG	On-Demand	Anodyne	EPHX2	52	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553452	FG	On-Demand	Anodyne	BIRC2	41	38
CCC[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450553457	DD	On-Demand	Anodyne	ACOX1	48	35
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553458	FG	On-Demand	Anodyne	DRD4	17	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553458	FG	On-Demand	Anodyne	OPRK1	17	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553458	FG	On-Demand	Anodyne	SIGMAR1	19	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553458	FG	On-Demand	Anodyne	CCR3	80	37
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553458	FG	On-Demand	Anodyne	CCR5	29	51
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553458	FG	On-Demand	Anodyne	EPHX2	52	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553458	FG	On-Demand	Anodyne	BIRC2	41	38
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553459	FG	On-Demand	Anodyne	DRD4	17	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553459	FG	On-Demand	Anodyne	OPRK1	17	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553459	FG	On-Demand	Anodyne	SIGMAR1	19	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553459	FG	On-Demand	Anodyne	CCR3	80	37
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553459	FG	On-Demand	Anodyne	CCR5	29	51
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553459	FG	On-Demand	Anodyne	EPHX2	52	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000450553459	FG	On-Demand	Anodyne	BIRC2	41	38
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450553461	EF	On-Demand	Anodyne	CCR3	85	48
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450553461	EF	On-Demand	Anodyne	EPHX2	41	38
CCC[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450553463	DD	On-Demand	Anodyne	ACOX1	48	35
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450553465	EF	On-Demand	Anodyne	CCR3	85	48
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450553465	EF	On-Demand	Anodyne	EPHX2	41	38
CC[C@@H]1C[C@H]1C(=O)NCCCc1ccc(Br)cc1OC	ZINC000450553466	EH	On-Demand	Anodyne	MTNR1A	31	40
CC[C@@H]1C[C@H]1C(=O)NCCCc1ccc(Br)cc1OC	ZINC000450553466	EH	On-Demand	Anodyne	MTNR1B	28	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450553467	EF	On-Demand	Anodyne	CCR3	85	48
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450553467	EF	On-Demand	Anodyne	EPHX2	41	38
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450553469	EF	On-Demand	Anodyne	CCR3	85	48
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450553469	EF	On-Demand	Anodyne	EPHX2	41	38
CN(Cc1nnc(C2CC2)s1)C1CCN(Cc2ccccc2)CC1	ZINC000450553470	EH	On-Demand	Anodyne	DRD2	0	47
CN(Cc1nnc(C2CC2)s1)C1CCN(Cc2ccccc2)CC1	ZINC000450553470	EH	On-Demand	Anodyne	DRD4	32	42
CN(Cc1nnc(C2CC2)s1)C1CCN(Cc2ccccc2)CC1	ZINC000450553470	EH	On-Demand	Anodyne	ACHE	35	46
CN(Cc1nnc(C2CC2)s1)C1CCN(Cc2ccccc2)CC1	ZINC000450553470	EH	On-Demand	Anodyne	DRD3	0	42
CN(Cc1nnc(C2CC2)s1)C1CCN(Cc2ccccc2)CC1	ZINC000450553470	EH	On-Demand	Anodyne	SIGMAR1	58	47
Cc1nc(S(=O)(=O)N2CCN(C[C@H](O)Cc3ccccc3)CC2)cs1	ZINC000450553476	GD	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1nc(S(=O)(=O)N2CCN(C[C@H](O)Cc3ccccc3)CC2)cs1	ZINC000450553476	GD	On-Demand	Anodyne	ABCB1	43	35
C[C@H]1Oc2ccc(C(=O)C3CCN(C[C@@H](C)S(C)(=O)=O)CC3)cc2NC1=O	ZINC000450553483	GD	On-Demand	Anodyne	WNT3A	52	36
C[C@@H]1Oc2ccc(C(=O)C3CCN(C[C@@H](C)S(C)(=O)=O)CC3)cc2NC1=O	ZINC000450553486	GD	On-Demand	Anodyne	WNT3A	52	36
CCC[C@H](OC)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450553487	DD	On-Demand	Anodyne	BIRC2	44	42
C[C@@H](CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1)S(C)(=O)=O	ZINC000450553488	GD	On-Demand	Anodyne	WNT3A	52	36
CCC[C@H](OC)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450553490	DD	On-Demand	Anodyne	BIRC2	44	42
C[C@@H]1Oc2ccc(C(=O)C3CCN(C[C@H](C)S(C)(=O)=O)CC3)cc2NC1=O	ZINC000450553491	GD	On-Demand	Anodyne	WNT3A	52	36
CCC[C@@H](OC)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450553492	DD	On-Demand	Anodyne	BIRC2	44	42
COC(=O)[C@@H]1CN(c2nc(C(F)(F)F)ns2)C[C@H]1c1ccc(O)cc1	ZINC000450553494	FF	On-Demand	Anodyne	SLC6A1	41	40
CCC[C@@H](OC)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450553496	DD	On-Demand	Anodyne	BIRC2	44	42
N#Cc1ccc(OCC(=O)N2CCOC[C@@H]2C(N)=O)cc1Br	ZINC000450553504	FC	On-Demand	Mild	CPT2	41	39
COC(=O)c1cncc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)n1	ZINC000450553505	FD	On-Demand	Anodyne	SLC6A1	57	42
N#Cc1ccc(OCC(=O)N2CCOC[C@H]2C(N)=O)cc1Br	ZINC000450553507	FC	On-Demand	Mild	CPT2	41	39
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	HTR1A	31	52
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	DRD2	37	47
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	DRD1	15	43
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	DRD4	41	43
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	HTR2A	28	46
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	HTR2C	21	48
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	HRH1	16	40
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	DRD3	35	44
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	HTR7	47	46
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	SIGMAR1	31	44
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	HTR3B	0	42
CC1CCC(NC(=O)CN2CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450553508	GF	On-Demand	Anodyne	CYP2J2	66	48
C[C@H](Nc1nccc(C(F)F)n1)c1cccc(C2CC2)c1	ZINC000450553509	CI	On-Demand	Anodyne	PAK3	16	42
C[C@H](Nc1nccc(C(F)F)n1)c1cccc(C2CC2)c1	ZINC000450553509	CI	On-Demand	Anodyne	PAK1	26	42
C[C@H](Nc1nccc(C(F)F)n1)c1cccc(C2CC2)c1	ZINC000450553509	CI	On-Demand	Anodyne	PAK2	18	42
C[C@@H](Nc1nccc(C(F)F)n1)c1cccc(C2CC2)c1	ZINC000450553510	CI	On-Demand	Anodyne	PAK3	16	42
C[C@@H](Nc1nccc(C(F)F)n1)c1cccc(C2CC2)c1	ZINC000450553510	CI	On-Demand	Anodyne	PAK1	26	42
C[C@@H](Nc1nccc(C(F)F)n1)c1cccc(C2CC2)c1	ZINC000450553510	CI	On-Demand	Anodyne	PAK2	18	42
FC1(F)CC[C@@H](CN2CCc3[nH]c4ccccc4c3C2)C1	ZINC000450553535	CH	On-Demand	Anodyne	DRD5	18	48
FC1(F)CC[C@H](CN2CCc3[nH]c4ccccc4c3C2)C1	ZINC000450553536	CH	On-Demand	Anodyne	DRD5	18	48
Cc1nc(N[C@@H]2CCCc3c(F)cccc32)ncc1[N+](=O)[O-]	ZINC000450553553	DG	On-Demand	Bother	PRKCQ	42	42
Cc1nc(N[C@H]2CCCc3c(F)cccc32)ncc1[N+](=O)[O-]	ZINC000450553554	DG	On-Demand	Bother	PRKCQ	42	42
CC(=O)c1ccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1	ZINC000450553572	EH	On-Demand	Anodyne	LTA4H	22	50
COC(=O)C1(CN2CCc3[nH]c4ccccc4c3C2)CC1	ZINC000450553580	CE	On-Demand	Anodyne	SSTR4	46	36
COC(=O)C1(CN2CCc3[nH]c4ccccc4c3C2)CC1	ZINC000450553580	CE	On-Demand	Anodyne	HTR5A	27	53
C[C@H](O)CCN1CCN(CC(=O)N[C@@H]2CCC[C@H](C)C2)CC1	ZINC000450553584	DD	On-Demand	Anodyne	BIRC2	41	33
C[C@H](O)CCN1CCN(CC(=O)N[C@H]2CCC[C@H](C)C2)CC1	ZINC000450553585	DD	On-Demand	Anodyne	BIRC2	41	33
C[C@H](O)CCN1CCN(CC(=O)N[C@@H]2CCC[C@@H](C)C2)CC1	ZINC000450553586	DD	On-Demand	Anodyne	BIRC2	41	33
C[C@H](O)CCN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450553587	DD	On-Demand	Anodyne	BIRC2	41	33
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	CHRM1	22	41
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	DRD2	17	46
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	DRD4	22	42
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	ACHE	41	45
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	OPRM1	15	42
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	GRIN2B	62	38
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	SIGMAR1	71	46
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	CCR5	49	43
CN1CCN(C(=O)CC2CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450553602	FD	On-Demand	Anodyne	TACR3	23	41
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@H]2CCO[C@H](C)C2)c1	ZINC000450553630	FH	On-Demand	Anodyne	NQO2	28	40
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@@H]2CCO[C@@H](C)C2)c1	ZINC000450553633	FH	On-Demand	Anodyne	NQO2	28	40
CCc1cc(CCCN(C)C2CCN(C(=O)c3ccccc3)CC2)on1	ZINC000450553634	FG	On-Demand	Anodyne	L3MBTL3	59	38
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@H]2CCO[C@@H](C)C2)c1	ZINC000450553635	FH	On-Demand	Anodyne	NQO2	28	40
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@@H]2CCO[C@H](C)C2)c1	ZINC000450553637	FH	On-Demand	Anodyne	NQO2	28	40
CCC[C@@H](O)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450553642	CD	On-Demand	Anodyne	MAP	0	40
CCC[C@@H](O)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450553643	CD	On-Demand	Anodyne	MAP	0	40
CCC[C@H](O)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450553644	CD	On-Demand	Anodyne	MAP	0	40
CCC[C@H](O)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450553645	CD	On-Demand	Anodyne	MAP	0	40
CCOC(=O)[C@@H]1CN(c2ncnc3ccsc23)CC12COC2	ZINC000450553646	DD	On-Demand	Anodyne	SIRT3	51	31
CCOC(=O)[C@@H]1CN(c2ncnc3ccsc23)CC12COC2	ZINC000450553646	DD	On-Demand	Anodyne	SIRT2	64	31
CCOC(=O)[C@@H]1CN(c2ncnc3ccsc23)CC12COC2	ZINC000450553646	DD	On-Demand	Anodyne	SIRT1	51	31
CCOC(=O)[C@H]1CN(c2ncnc3ccsc23)CC12COC2	ZINC000450553647	DD	On-Demand	Anodyne	SIRT3	51	31
CCOC(=O)[C@H]1CN(c2ncnc3ccsc23)CC12COC2	ZINC000450553647	DD	On-Demand	Anodyne	SIRT2	64	31
CCOC(=O)[C@H]1CN(c2ncnc3ccsc23)CC12COC2	ZINC000450553647	DD	On-Demand	Anodyne	SIRT1	51	31
CC(C)(C)n1cnc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)n1	ZINC000450553649	GF	On-Demand	Mild	AR	18	42
CCOCc1nc(C)c(C(=O)N[C@H]2CCCN(c3cccnc3)C2=O)s1	ZINC000450553650	FE	On-Demand	Anodyne	SCD1	18	44
CCOCc1nc(C)c(C(=O)N[C@H]2CCCN(c3cccnc3)C2=O)s1	ZINC000450553650	FE	On-Demand	Anodyne	SCD	18	44
CC(C)(C)n1cnc(NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)n1	ZINC000450553651	GF	On-Demand	Mild	AR	18	42
CCOCc1nc(C)c(C(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)s1	ZINC000450553653	FE	On-Demand	Anodyne	SCD1	18	44
CCOCc1nc(C)c(C(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)s1	ZINC000450553653	FE	On-Demand	Anodyne	SCD	18	44
O=C(CN(Cc1cccnc1)C[C@H]1CCC(F)(F)C1)Nc1ccc(Cl)cc1	ZINC000450553689	GJ	On-Demand	Anodyne	NAMPT	44	43
O=C(CN(Cc1cccnc1)C[C@@H]1CCC(F)(F)C1)Nc1ccc(Cl)cc1	ZINC000450553690	GJ	On-Demand	Anodyne	NAMPT	44	43
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450553725	CE	On-Demand	Anodyne	HTR1D	30	48
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450553725	CE	On-Demand	Anodyne	HTR1B	26	48
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450553725	CE	On-Demand	Anodyne	KCNQ2	48	34
CC[C@H](O)CC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450553725	CE	On-Demand	Anodyne	CHRNA7	22	44
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450553726	CE	On-Demand	Anodyne	HTR1D	30	48
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450553726	CE	On-Demand	Anodyne	HTR1B	26	48
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450553726	CE	On-Demand	Anodyne	KCNQ2	48	34
CC[C@@H](O)CC(=O)Nc1cccc(CCN2CCCC2)c1	ZINC000450553726	CE	On-Demand	Anodyne	CHRNA7	22	44
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)C1(C(F)(F)F)CCC1	ZINC000450553741	GH	On-Demand	Anodyne	EPHX2	35	41
CN(C)S(=O)(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450553743	FE	On-Demand	Bother	BDKRB1	23	43
c1cc(NCCCC2CCOCC2)c2sccc2n1	ZINC000450553749	CH	On-Demand	Anodyne	HRP1_PLAFA	41	30
C[C@H]1CCC[C@@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553757	DD	On-Demand	Anodyne	CA2	41	38
C[C@H]1CCC[C@@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553757	DD	On-Demand	Anodyne	CA1	40	36
C[C@H]1CCC[C@@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553757	DD	On-Demand	Anodyne	CA4	46	38
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553759	DD	On-Demand	Anodyne	CA2	41	38
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553759	DD	On-Demand	Anodyne	CA1	40	36
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553759	DD	On-Demand	Anodyne	CA4	46	38
C[C@H]1CCC[C@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553761	DD	On-Demand	Anodyne	CA2	41	38
C[C@H]1CCC[C@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553761	DD	On-Demand	Anodyne	CA1	40	36
C[C@H]1CCC[C@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553761	DD	On-Demand	Anodyne	CA4	46	38
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553762	DD	On-Demand	Anodyne	CA2	41	38
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553762	DD	On-Demand	Anodyne	CA1	40	36
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450553762	DD	On-Demand	Anodyne	CA4	46	38
COc1ccccc1-n1cnc2cc(C(=O)N3CC(CO)C3)ccc21	ZINC000450553763	EE	On-Demand	Anodyne	HPGD	61	72
O=C(Nc1nccs1)[C@H]1CCCN1CCc1cscn1	ZINC000450553788	DE	On-Demand	Anodyne	MAP	0	44
O=C(Nc1nccs1)[C@@H]1CCCN1CCc1cscn1	ZINC000450553790	DE	On-Demand	Anodyne	MAP	0	44
COc1cc(CC(=O)N[C@H](C)C[S@@](C)=O)ccc1Cl	ZINC000450553791	DD	On-Demand	Anodyne	NCE103	25	41
COc1cc(CC(=O)N[C@H](C)C[S@](C)=O)ccc1Cl	ZINC000450553792	DD	On-Demand	Anodyne	NCE103	25	41
COc1cc(CC(=O)N[C@@H](C)C[S@](C)=O)ccc1Cl	ZINC000450553793	DD	On-Demand	Anodyne	NCE103	25	41
COc1cc(CC(=O)N[C@@H](C)C[S@@](C)=O)ccc1Cl	ZINC000450553794	DD	On-Demand	Anodyne	NCE103	25	41
CCOC(=O)[C@H]1CN(c2ccc(C(F)(F)F)cc2C#N)CC12COC2	ZINC000450553804	FF	On-Demand	Mild	LIPG	49	37
CCOC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)cc2C#N)CC12COC2	ZINC000450553808	FF	On-Demand	Mild	LIPG	49	37
COc1ccc(CNC(=O)CCN[C@@H](C(N)=O)C(C)(C)C)c(OC)c1	ZINC000450553842	FD	On-Demand	Anodyne	MTNR1A	62	39
COc1ccc(CNC(=O)CCN[C@@H](C(N)=O)C(C)(C)C)c(OC)c1	ZINC000450553842	FD	On-Demand	Anodyne	MTNR1B	50	38
COc1ccc(CNC(=O)CCN[C@@H](C(N)=O)C(C)(C)C)c(OC)c1	ZINC000450553842	FD	On-Demand	Anodyne	MT-ND1	22	40
COc1ccc(CNC(=O)CCN[C@H](C(N)=O)C(C)(C)C)c(OC)c1	ZINC000450553845	FD	On-Demand	Anodyne	MTNR1A	62	39
COc1ccc(CNC(=O)CCN[C@H](C(N)=O)C(C)(C)C)c(OC)c1	ZINC000450553845	FD	On-Demand	Anodyne	MTNR1B	50	38
COc1ccc(CNC(=O)CCN[C@H](C(N)=O)C(C)(C)C)c(OC)c1	ZINC000450553845	FD	On-Demand	Anodyne	MT-ND1	22	40
COC(=O)[C@@H]1CN(c2cncc(C(N)=O)n2)C[C@H]1c1ccc(O)cc1	ZINC000450553848	EC	On-Demand	Anodyne	SLC6A1	50	41
CN1CCN(c2nc3ccccc3nc2N2CCC[C@](C)(F)C2)CC1	ZINC000450553851	EF	On-Demand	Anodyne	HRH4	24	42
CN1CCN(c2nc3ccccc3nc2N2CCC[C@@](C)(F)C2)CC1	ZINC000450553853	EF	On-Demand	Anodyne	HRH4	24	42
O=C(NCCn1c2ccccc2c2ccccc21)C1(CF)CCOCC1	ZINC000450553854	FH	On-Demand	Anodyne	PTGDS	44	37
Cc1cccc2c1C[C@@H](C(=O)Nc1ccc(CN3CCOCC3)c(Cl)c1)O2	ZINC000450553864	GG	On-Demand	Anodyne	EPHX2	32	41
COC(=O)[C@@H]1CN(c2nccnc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450553866	DD	On-Demand	Mild	SLC6A1	52	42
Cc1cccc2c1C[C@H](C(=O)Nc1ccc(CN3CCOCC3)c(Cl)c1)O2	ZINC000450553867	GG	On-Demand	Anodyne	EPHX2	32	41
C[C@@]1(F)CCCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450553870	CC	On-Demand	Anodyne	SCD	24	44
C[C@]1(F)CCCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450553871	CC	On-Demand	Anodyne	SCD	24	44
O=S(=O)(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1cccc(F)c1	ZINC000450553872	FF	On-Demand	Anodyne	SFRP1	80	36
O=S(=O)(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1cccc(F)c1	ZINC000450553872	FF	On-Demand	Anodyne	WNT3	40	30
O=S(=O)(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1cccc(F)c1	ZINC000450553873	FF	On-Demand	Anodyne	SFRP1	80	36
O=S(=O)(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1cccc(F)c1	ZINC000450553873	FF	On-Demand	Anodyne	WNT3	40	30
O=C(Cc1scnc1-c1ccccc1)Nc1cccc(CCN2CCCC2)c1	ZINC000450553876	GJ	On-Demand	Anodyne	HRH2	40	35
O=C(Cc1scnc1-c1ccccc1)Nc1cccc(CCN2CCCC2)c1	ZINC000450553876	GJ	On-Demand	Anodyne	HTR1D	28	44
O=C(Cc1scnc1-c1ccccc1)Nc1cccc(CCN2CCCC2)c1	ZINC000450553876	GJ	On-Demand	Anodyne	HTR1B	24	44
O=C(Cc1scnc1-c1ccccc1)Nc1cccc(CCN2CCCC2)c1	ZINC000450553876	GJ	On-Demand	Anodyne	CHRNA7	20	41
O=C(Cc1scnc1-c1ccccc1)Nc1cccc(CCN2CCCC2)c1	ZINC000450553876	GJ	On-Demand	Anodyne	MCHR1	19	45
COC(=O)[C@@H]1CN(c2nc(C)c(C)s2)C[C@H]1c1ccc(O)cc1	ZINC000450553878	EF	On-Demand	Anodyne	SLC6A1	67	43
CCc1cc(CCCN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)on1	ZINC000450553883	FG	On-Demand	Anodyne	CCR3	87	50
CCc1cc(CCCN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)on1	ZINC000450553883	FG	On-Demand	Anodyne	EPHX2	41	38
CCc1cc(CCCN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)on1	ZINC000450553884	FG	On-Demand	Anodyne	CCR3	87	50
CCc1cc(CCCN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)on1	ZINC000450553884	FG	On-Demand	Anodyne	EPHX2	41	38
CS[C@H](CNC(=O)Cc1ccc(O)c(F)c1)C(C)(C)C	ZINC000450553908	CF	On-Demand	Anodyne	TRPV1	25	58
CS[C@@H](CNC(=O)Cc1ccc(O)c(F)c1)C(C)(C)C	ZINC000450553909	CF	On-Demand	Anodyne	TRPV1	25	58
COC(=O)[C@@H]1CN(c2nc(C)cc(C(F)(F)F)n2)C[C@H]1c1ccc(O)cc1	ZINC000450553910	GF	On-Demand	Anodyne	SLC6A1	59	40
Cc1cc(C(F)(F)F)ccc1C(=O)N=c1ncn(C2CCCCC2)[nH]1	ZINC000450553958	FH	On-Demand	Anodyne	LIPG	42	31
Clc1ccc(-c2noc([C@@H]3CCCN(Cc4cnns4)C3)n2)cc1	ZINC000450553960	FH	On-Demand	Anodyne	GRM5	23	47
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553965	GI	On-Demand	Anodyne	HRH2	32	41
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553965	GI	On-Demand	Anodyne	CHRM3	20	42
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553965	GI	On-Demand	Anodyne	CCR3	178	59
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553965	GI	On-Demand	Anodyne	CYP2D6	23	59
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553965	GI	On-Demand	Anodyne	MCHR1	31	41
C[C@]1(F)CCCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450553967	EG	On-Demand	Anodyne	ACACA	0	40
C[C@]1(F)CCCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450553967	EG	On-Demand	Anodyne	ACACB	25	43
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553968	GI	On-Demand	Anodyne	HRH2	32	41
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553968	GI	On-Demand	Anodyne	CHRM3	20	42
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553968	GI	On-Demand	Anodyne	CCR3	178	59
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553968	GI	On-Demand	Anodyne	CYP2D6	23	59
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)c1	ZINC000450553968	GI	On-Demand	Anodyne	MCHR1	31	41
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)C[C@@H]2COc3ccccc3O2)c1	ZINC000450553969	FH	On-Demand	Anodyne	ADRA2B	16	40
C[C@@]1(F)CCCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450553970	EG	On-Demand	Anodyne	ACACA	0	40
C[C@@]1(F)CCCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450553970	EG	On-Demand	Anodyne	ACACB	25	43
Clc1ccc(-c2noc([C@H]3CCCN(Cc4cnns4)C3)n2)cc1	ZINC000450553972	FH	On-Demand	Anodyne	GRM5	23	47
COc1cccc(OCCC(=O)NCCSCC(F)(F)F)c1	ZINC000450553973	EF	On-Demand	Anodyne	MTNR1B	47	41
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)C[C@@H]2COc3ccccc3O2)c1	ZINC000450553975	FH	On-Demand	Anodyne	ADRA2B	16	40
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)C[C@H]2COc3ccccc3O2)c1	ZINC000450553976	FH	On-Demand	Anodyne	ADRA2B	16	40
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)C[C@H]2COc3ccccc3O2)c1	ZINC000450553977	FH	On-Demand	Anodyne	ADRA2B	16	40
CC[C@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450553994	BF	On-Demand	Anodyne	CTSB	18	44
CC[C@@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450553995	BF	On-Demand	Anodyne	CTSB	18	44
CC[C@@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450553996	BF	On-Demand	Anodyne	CTSB	18	44
CC[C@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450554002	BF	On-Demand	Anodyne	CTSB	18	44
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554004	FD	On-Demand	Anodyne	ADRB2	22	41
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554004	FD	On-Demand	Anodyne	ADRB3	31	41
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554004	FD	On-Demand	Anodyne	ABCB1	40	38
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554004	FD	On-Demand	Anodyne	EPHX2	15	43
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554004	FD	On-Demand	Anodyne	HSP90AB1	35	41
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554004	FD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554004	FD	On-Demand	Anodyne	CACNA1G	41	37
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554005	FD	On-Demand	Anodyne	ADRB2	22	41
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554005	FD	On-Demand	Anodyne	ADRB3	31	41
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554005	FD	On-Demand	Anodyne	ABCB1	40	38
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554005	FD	On-Demand	Anodyne	EPHX2	15	43
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554005	FD	On-Demand	Anodyne	HSP90AB1	35	41
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554005	FD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)cc2)CC1	ZINC000450554005	FD	On-Demand	Anodyne	CACNA1G	41	37
COC(=O)[C@@H]1CN(c2cc(C(C)=O)ccc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450554016	FF	On-Demand	Mild	SLC6A1	44	41
CCc1csc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)n1	ZINC000450554018	EF	On-Demand	Anodyne	SLC6A1	61	44
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000450554024	EG	On-Demand	Anodyne	RBP4	25	40
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000450554025	EG	On-Demand	Anodyne	RBP4	25	40
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1C[C@H]2[C@H](O)CC[C@H]2C1	ZINC000450554027	EG	On-Demand	Anodyne	RBP4	25	40
C[C@H]1[C@H](NC(=O)c2cc(-c3ccccc3)nn2C)CCCN1C	ZINC000450554028	DE	On-Demand	Anodyne	FAAH	17	44
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1C[C@H]2[C@@H](O)CC[C@H]2C1	ZINC000450554029	EG	On-Demand	Anodyne	RBP4	25	40
C[C@@H]1[C@@H](NC(=O)c2cc(-c3ccccc3)nn2C)CCCN1C	ZINC000450554030	DE	On-Demand	Anodyne	FAAH	17	44
C[C@@H]1[C@H](NC(=O)c2cc(-c3ccccc3)nn2C)CCCN1C	ZINC000450554031	DE	On-Demand	Anodyne	FAAH	17	44
C[C@H]1[C@@H](NC(=O)c2cc(-c3ccccc3)nn2C)CCCN1C	ZINC000450554033	DE	On-Demand	Anodyne	FAAH	17	44
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	CHRM2	19	48
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	DRD2	19	53
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	DRD4	29	53
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	CHRM3	26	46
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	SIGMAR1	35	48
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	SSTR5	40	40
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	NPY1R	29	43
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	NPY2R	23	42
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	CCR3	141	51
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	MLNR	63	40
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	CYP2D6	23	49
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	CCR2	28	51
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	EPHX2	49	40
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	CXCR3	28	41
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	MCHR1	51	46
CC(=O)c1cccc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554044	FG	On-Demand	Anodyne	CACNA1G	31	41
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	CHRM2	19	48
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	DRD2	19	53
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	DRD4	29	53
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	CHRM3	26	46
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	SIGMAR1	35	48
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	SSTR5	40	40
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	NPY1R	29	43
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	NPY2R	23	42
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	CCR3	141	51
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	MLNR	63	40
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	CYP2D6	23	49
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	CCR2	28	51
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	EPHX2	49	40
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	CXCR3	28	41
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	MCHR1	51	46
CC(=O)c1cccc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1	ZINC000450554046	FG	On-Demand	Anodyne	CACNA1G	31	41
CCc1nc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)n[nH]1	ZINC000450554047	ED	On-Demand	Anodyne	NPY2R	46	37
Fc1cccc2c1CCC[C@H]2Nc1ncncc1Cl	ZINC000450554056	CH	On-Demand	Anodyne	KCNN3	16	45
CCCN(C[C@H]1COCCO1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554057	EE	On-Demand	Anodyne	L3MBTL3	41	34
Fc1cccc2c1CCC[C@@H]2Nc1ncncc1Cl	ZINC000450554058	CH	On-Demand	Anodyne	KCNN3	16	45
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CC(F)C1	ZINC000450554076	DF	On-Demand	Anodyne	HRH4	30	50
c1ccc2c(c1)[nH]c1ncnc(NCCCC3CCOCC3)c12	ZINC000450554090	DH	On-Demand	Anodyne	UTS2R	23	45
CC(C)NC(=O)c1ccc(NCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450554092	DG	On-Demand	Bother	TAAR1	18	44
CC(C)CCCC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450554104	DE	On-Demand	Anodyne	GALR1	56	35
COc1cc(Br)ccc1CCCNC(=O)C1(C(=O)C2CC2)CC1	ZINC000450554105	GG	On-Demand	Anodyne	MTNR1B	25	40
CC(C)CCCC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450554106	DE	On-Demand	Anodyne	GALR1	56	35
N#Cc1ccc(OCC(=O)NCC(=O)C2CC2)cc1Br	ZINC000450554112	ED	On-Demand	Mild	TRPV4	40	31
CC(=O)c1cccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)c1	ZINC000450554116	FH	On-Demand	Anodyne	HTR1A	30	47
CC(=O)c1cccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)c1	ZINC000450554116	FH	On-Demand	Anodyne	DRD2	28	44
CC(=O)c1cccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)c1	ZINC000450554116	FH	On-Demand	Anodyne	DRD4	54	44
CC(=O)c1cccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)c1	ZINC000450554116	FH	On-Demand	Anodyne	ACHE	15	46
CC(=O)c1cccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)c1	ZINC000450554116	FH	On-Demand	Anodyne	DRD3	28	42
CC(=O)c1cccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)c1	ZINC000450554116	FH	On-Demand	Anodyne	SORD	72	36
CC(=O)c1cccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)c1	ZINC000450554116	FH	On-Demand	Anodyne	MGLL	0	43
NC(=O)c1cc([N+](=O)[O-])cnc1NCCCC1CCOCC1	ZINC000450554138	DD	On-Demand	Bother	PRKCQ	42	34
COCc1nn(C)cc1C(=O)Nc1cc(CCc2ccccc2C)[nH]n1	ZINC000450554148	FE	On-Demand	Anodyne	MT-CYB	53	31
O=C(CCCN1CCCC[C@H]1c1cn[nH]c1)c1ccc(F)cc1	ZINC000450554153	DH	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCCC[C@H]1c1cn[nH]c1)c1ccc(F)cc1	ZINC000450554153	DH	On-Demand	Anodyne	HTR2A	20	43
O=C(CCCN1CCCC[C@H]1c1cn[nH]c1)c1ccc(F)cc1	ZINC000450554153	DH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCCC[C@H]1c1cn[nH]c1)c1ccc(F)cc1	ZINC000450554153	DH	On-Demand	Anodyne	CYP2J2	45	31
O=C(CCCN1CCCC[C@@H]1c1cn[nH]c1)c1ccc(F)cc1	ZINC000450554155	DH	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCCC[C@@H]1c1cn[nH]c1)c1ccc(F)cc1	ZINC000450554155	DH	On-Demand	Anodyne	HTR2A	20	43
O=C(CCCN1CCCC[C@@H]1c1cn[nH]c1)c1ccc(F)cc1	ZINC000450554155	DH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCCC[C@@H]1c1cn[nH]c1)c1ccc(F)cc1	ZINC000450554155	DH	On-Demand	Anodyne	CYP2J2	45	31
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	F2	32	40
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	MAP	0	44
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	CTRA_BOVIN	40	31
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	TRY1_BOVIN	48	40
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	MAP1	129	44
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	PREP	48	45
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	CELA2A	48	31
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554167	EF	On-Demand	Anodyne	BRCA1	44	31
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	F2	32	40
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	MAP	0	44
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	CTRA_BOVIN	40	31
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	TRY1_BOVIN	48	40
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	MAP1	129	44
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	PREP	48	45
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	CELA2A	48	31
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	POL	0	41
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450554169	EF	On-Demand	Anodyne	BRCA1	44	31
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	F2	32	40
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	MAP	0	44
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	CTRA_BOVIN	40	31
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	TRY1_BOVIN	48	40
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	MAP1	129	44
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	PREP	48	45
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	CELA2A	48	31
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554171	EF	On-Demand	Anodyne	BRCA1	44	31
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	F2	32	40
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	MAP	0	44
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	CTRA_BOVIN	40	31
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	TRY1_BOVIN	48	40
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	MAP1	129	44
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	PREP	48	45
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	CELA2A	48	31
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	POL	0	41
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450554173	EF	On-Demand	Anodyne	BRCA1	44	31
C[C@@H](C[S@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554176	CD	On-Demand	Anodyne	SELE	56	37
C[C@@H](C[S@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554176	CD	On-Demand	Anodyne	ICAM1	50	37
C[C@@H](C[S@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554176	CD	On-Demand	Anodyne	VCAM1	44	32
C[C@H](O)CCN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554185	CD	On-Demand	Anodyne	L3MBTL1	0	44
C[C@H](C[S@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554186	CD	On-Demand	Anodyne	SELE	56	37
C[C@H](C[S@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554186	CD	On-Demand	Anodyne	ICAM1	50	37
C[C@H](C[S@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554186	CD	On-Demand	Anodyne	VCAM1	44	32
C[C@@H](C[S@@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554187	CD	On-Demand	Anodyne	SELE	56	37
C[C@@H](C[S@@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554187	CD	On-Demand	Anodyne	ICAM1	50	37
C[C@@H](C[S@@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554187	CD	On-Demand	Anodyne	VCAM1	44	32
C[C@H](C[S@@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554188	CD	On-Demand	Anodyne	SELE	56	37
C[C@H](C[S@@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554188	CD	On-Demand	Anodyne	ICAM1	50	37
C[C@H](C[S@@](C)=O)NC(=O)c1cc2ccncc2s1	ZINC000450554188	CD	On-Demand	Anodyne	VCAM1	44	32
C[C@@H](O)CCN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554189	CD	On-Demand	Anodyne	L3MBTL1	0	44
CCS(=O)(=O)N(C)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450554190	FF	On-Demand	Anodyne	AVPR1B	44	36
CCS(=O)(=O)N(C)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450554190	FF	On-Demand	Anodyne	SSTR5	72	44
CCS(=O)(=O)N(C)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450554190	FF	On-Demand	Anodyne	UTS2R	30	40
CCS(=O)(=O)N(C)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450554190	FF	On-Demand	Anodyne	MCHR1	27	43
C[C@@H]1CCc2c(sc3ncn(CC4(C#N)CCC4)c(=O)c23)C1	ZINC000450554207	DG	On-Demand	Mild	HTR1B	16	43
C[C@H]1CCc2c(sc3ncn(CC4(C#N)CCC4)c(=O)c23)C1	ZINC000450554208	DG	On-Demand	Mild	HTR1B	16	43
O=C(CCC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450554213	GE	On-Demand	Bother	CACNA1D	40	34
O=C(CCC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450554216	GE	On-Demand	Bother	CACNA1D	40	34
CN(CCc1ccccc1O)C(=O)[C@H]1CCCCC1(F)F	ZINC000450554221	CG	On-Demand	Anodyne	AMY2	43	29
CN(CCc1ccccc1O)C(=O)[C@@H]1CCCCC1(F)F	ZINC000450554222	CG	On-Demand	Anodyne	AMY2	43	29
COC(=O)c1coc(CN(CCO)[C@H]2CCCc3ccccc32)n1	ZINC000450554231	EE	On-Demand	Anodyne	CXCR4	41	38
COC(=O)c1coc(CN(CCO)[C@@H]2CCCc3ccccc32)n1	ZINC000450554232	EE	On-Demand	Anodyne	CXCR4	41	38
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450554249	EE	On-Demand	Anodyne	MAPK1	42	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450554249	EE	On-Demand	Anodyne	TYK2	56	34
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450554249	EE	On-Demand	Anodyne	ERBB4	46	35
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450554249	EE	On-Demand	Anodyne	CXCR3	23	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450554249	EE	On-Demand	Anodyne	ENV	41	31
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450554249	EE	On-Demand	Anodyne	MCHR1	35	41
O=C(Nc1nccs1)[C@H]1CCCN1CC1=CCCCC1	ZINC000450554260	CG	On-Demand	Anodyne	MAP	0	40
O=C(Nc1nccs1)[C@H]1CCCN1CC1=CCCCC1	ZINC000450554260	CG	On-Demand	Anodyne	MAP1	62	40
C[C@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554262	FF	On-Demand	Anodyne	AVPR1B	34	40
C[C@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554262	FF	On-Demand	Anodyne	CTRA_BOVIN	41	31
C[C@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554262	FF	On-Demand	Anodyne	HDAC8	30	40
C[C@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554262	FF	On-Demand	Anodyne	TACR3	56	38
C[C@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554262	FF	On-Demand	Anodyne	HDAC6	22	41
C[C@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554262	FF	On-Demand	Anodyne	IMDH_CRYPV	35	54
C[C@@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554263	FF	On-Demand	Anodyne	AVPR1B	34	40
C[C@@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554263	FF	On-Demand	Anodyne	CTRA_BOVIN	41	31
C[C@@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554263	FF	On-Demand	Anodyne	HDAC8	30	40
C[C@@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554263	FF	On-Demand	Anodyne	TACR3	56	38
C[C@@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554263	FF	On-Demand	Anodyne	HDAC6	22	41
C[C@@H](C[S@@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554263	FF	On-Demand	Anodyne	IMDH_CRYPV	35	54
O=C(Nc1nccs1)[C@@H]1CCCN1CC1=CCCCC1	ZINC000450554264	CG	On-Demand	Anodyne	MAP	0	40
O=C(Nc1nccs1)[C@@H]1CCCN1CC1=CCCCC1	ZINC000450554264	CG	On-Demand	Anodyne	MAP1	62	40
C[C@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554266	FF	On-Demand	Anodyne	AVPR1B	34	40
C[C@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554266	FF	On-Demand	Anodyne	CTRA_BOVIN	41	31
C[C@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554266	FF	On-Demand	Anodyne	HDAC8	30	40
C[C@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554266	FF	On-Demand	Anodyne	TACR3	56	38
C[C@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554266	FF	On-Demand	Anodyne	HDAC6	22	41
C[C@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554266	FF	On-Demand	Anodyne	IMDH_CRYPV	35	54
C[C@@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554267	FF	On-Demand	Anodyne	AVPR1B	34	40
C[C@@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554267	FF	On-Demand	Anodyne	CTRA_BOVIN	41	31
C[C@@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554267	FF	On-Demand	Anodyne	HDAC8	30	40
C[C@@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554267	FF	On-Demand	Anodyne	TACR3	56	38
C[C@@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554267	FF	On-Demand	Anodyne	HDAC6	22	41
C[C@@H](C[S@](C)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450554267	FF	On-Demand	Anodyne	IMDH_CRYPV	35	54
COc1cc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)ccc1Cl	ZINC000450554268	GF	On-Demand	Anodyne	DRD2	19	40
COc1cc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)ccc1Cl	ZINC000450554268	GF	On-Demand	Anodyne	DRD4	37	42
COc1cc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)ccc1Cl	ZINC000450554268	GF	On-Demand	Anodyne	SIGMAR1	22	48
COc1cc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)ccc1Cl	ZINC000450554268	GF	On-Demand	Anodyne	SSTR5	47	38
COc1cc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)ccc1Cl	ZINC000450554268	GF	On-Demand	Anodyne	UTS2R	15	41
COc1cc(CC(=O)NCCc2nnc3n2CCCC3)ccc1Cl	ZINC000450554309	EE	On-Demand	Anodyne	DRD2	45	34
COc1cc(CC(=O)NCCc2nnc3n2CCCC3)ccc1Cl	ZINC000450554309	EE	On-Demand	Anodyne	HTR4	42	35
COc1cc(CC(=O)NCCc2nnc3n2CCCC3)ccc1Cl	ZINC000450554309	EE	On-Demand	Anodyne	NCE103	22	50
CC(F)(F)CCCNc1cnc(-c2ccccc2)cn1	ZINC000450554317	CH	On-Demand	Anodyne	TPH1	28	41
Cc1nn(C)cc1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554323	GF	On-Demand	Anodyne	ACHE	28	40
Cc1nn(C)cc1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554323	GF	On-Demand	Anodyne	HTR1D	82	41
Cc1nn(C)cc1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554323	GF	On-Demand	Anodyne	HTR1B	64	40
Cc1nn(C)cc1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554323	GF	On-Demand	Anodyne	NQO2	17	42
Cc1nn(C)cc1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554323	GF	On-Demand	Anodyne	MPO	67	38
COC(=O)C(C)(C)N(C)Cc1c(C)cccc1Cl	ZINC000450554329	CG	On-Demand	Anodyne	ECR	41	37
CC[S@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554330	FE	On-Demand	Anodyne	HTR1D	43	44
CC[S@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554330	FE	On-Demand	Anodyne	HTR1B	32	44
CC[S@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554330	FE	On-Demand	Anodyne	MPO	80	44
CC[S@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554330	FE	On-Demand	Anodyne	MTNR1A	19	52
CC[S@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554330	FE	On-Demand	Anodyne	ABCG2	25	41
CC[S@@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554331	FE	On-Demand	Anodyne	HTR1D	43	44
CC[S@@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554331	FE	On-Demand	Anodyne	HTR1B	32	44
CC[S@@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554331	FE	On-Demand	Anodyne	MPO	80	44
CC[S@@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554331	FE	On-Demand	Anodyne	MTNR1A	19	52
CC[S@@](=O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554331	FE	On-Demand	Anodyne	ABCG2	25	41
O=C(CSC1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554338	FG	On-Demand	Anodyne	HTR1A	28	44
O=C(CSC1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554338	FG	On-Demand	Anodyne	HTR1D	69	37
O=C(CSC1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554338	FG	On-Demand	Anodyne	HTR1B	52	40
O=C(CSC1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554338	FG	On-Demand	Anodyne	SLC6A4	0	46
O=C(CSC1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450554338	FG	On-Demand	Anodyne	MPO	69	38
CCCN(C[C@@H]1COCCO1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554360	EE	On-Demand	Anodyne	L3MBTL3	41	34
CS[C@@H](CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(C)(C)C	ZINC000450554380	FG	On-Demand	Anodyne	PDE8B	56	32
CS[C@@H](CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(C)(C)C	ZINC000450554381	FG	On-Demand	Anodyne	PDE8B	56	32
CS[C@H](CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(C)(C)C	ZINC000450554382	FG	On-Demand	Anodyne	PDE8B	56	32
CS[C@H](CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(C)(C)C	ZINC000450554383	FG	On-Demand	Anodyne	PDE8B	56	32
C[C@@H](OCc1ccc(F)cc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450554384	FH	On-Demand	Anodyne	LEF	54	34
C[C@H](OCc1ccc(F)cc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450554385	FH	On-Demand	Anodyne	LEF	54	34
C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450554429	DF	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450554429	DF	On-Demand	Anodyne	SLC18A3	22	44
C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450554430	DF	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@@H]1CC[C@@H](C)N1[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450554430	DF	On-Demand	Anodyne	SLC18A3	22	44
C[C@H](Nc1cc(NCC2CC2)ncn1)c1ccc([N+](=O)[O-])cc1	ZINC000450554442	DG	On-Demand	Bother	GPR39	0	40
Cc1nc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450554443	EI	On-Demand	Anodyne	PPARA	21	42
Cc1ccc(C(=O)N2C[C@@H]3CC[C@@H](O)[C@H]3C2)c2c1CCC2	ZINC000450554447	CE	On-Demand	Anodyne	L3MBTL3	39	41
CCc1nc(CNc2nc3ccccc3nc2N2CCN(C)CC2)n[nH]1	ZINC000450554450	FD	On-Demand	Anodyne	HTR3A	29	46
CCc1nc(CNc2nc3ccccc3nc2N2CCN(C)CC2)n[nH]1	ZINC000450554450	FD	On-Demand	Anodyne	HRH4	32	46
COC(=O)[C@@H]1CN(c2nccc(C)c2Br)C[C@H]1c1ccc(O)cc1	ZINC000450554453	GG	On-Demand	Anodyne	SLC6A1	58	42
Cc1ccc(C(=O)N2C[C@H]3[C@H](O)CC[C@H]3C2)c2c1CCC2	ZINC000450554454	CE	On-Demand	Anodyne	L3MBTL3	39	41
Cc1ccc(C(=O)N2C[C@H]3[C@@H](O)CC[C@H]3C2)c2c1CCC2	ZINC000450554455	CE	On-Demand	Anodyne	L3MBTL3	39	41
Cc1ccc(C(=O)N2C[C@@H]3CC[C@H](O)[C@H]3C2)c2c1CCC2	ZINC000450554456	CE	On-Demand	Anodyne	L3MBTL3	39	41
O=C(NCC(=O)N1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)Nc1cccc(Cl)c1	ZINC000450554464	GF	On-Demand	Anodyne	CCR3	40	40
O=C(NCC(=O)N1C[C@H](O)C[C@@H]1c1ccc(F)cc1)Nc1cccc(Cl)c1	ZINC000450554465	GF	On-Demand	Anodyne	CCR3	40	40
O=C(NCC(=O)N1C[C@@H](O)C[C@H]1c1ccc(F)cc1)Nc1cccc(Cl)c1	ZINC000450554466	GF	On-Demand	Anodyne	CCR3	40	40
O=C(NCC(=O)N1C[C@H](O)C[C@H]1c1ccc(F)cc1)Nc1cccc(Cl)c1	ZINC000450554467	GF	On-Demand	Anodyne	CCR3	40	40
COC(=O)[C@@H]1CN(c2nc(C)cc(OC)n2)C[C@H]1c1ccc(O)cc1	ZINC000450554471	ED	On-Demand	Anodyne	SLC6A1	59	42
COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cn(CC2CC2)nn1	ZINC000450554477	GG	On-Demand	Anodyne	TACR2	40	33
COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cn(CC2CC2)nn1	ZINC000450554477	GG	On-Demand	Anodyne	TACR3	40	32
COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cn(CC2CC2)nn1	ZINC000450554483	GG	On-Demand	Anodyne	TACR2	40	33
COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cn(CC2CC2)nn1	ZINC000450554483	GG	On-Demand	Anodyne	TACR3	40	32
CCS(=O)(=O)c1ccc(CN(C(C)C)C2CCCC2)cc1	ZINC000450554485	DH	On-Demand	Anodyne	RORC	31	43
CS[C@@H](CNC(=O)c1cc(-c2ccccc2)nn1C)C(C)(C)C	ZINC000450554493	EH	On-Demand	Anodyne	CTSV	52	36
CS[C@H](CNC(=O)c1cc(-c2ccccc2)nn1C)C(C)(C)C	ZINC000450554495	EH	On-Demand	Anodyne	CTSV	52	36
C[C@@H]1Oc2ccc(C(=O)C3CCN(C[C@H]4CCC(F)(F)C4)CC3)cc2NC1=O	ZINC000450554507	GH	On-Demand	Anodyne	WNT3A	46	33
C[C@H]1Oc2ccc(C(=O)C3CCN(C[C@H]4CCC(F)(F)C4)CC3)cc2NC1=O	ZINC000450554509	GH	On-Demand	Anodyne	WNT3A	46	33
C[C@@H]1Oc2ccc(C(=O)C3CCN(C[C@@H]4CCC(F)(F)C4)CC3)cc2NC1=O	ZINC000450554511	GH	On-Demand	Anodyne	WNT3A	46	33
C[C@H]1Oc2ccc(C(=O)C3CCN(C[C@@H]4CCC(F)(F)C4)CC3)cc2NC1=O	ZINC000450554513	GH	On-Demand	Anodyne	WNT3A	46	33
C[C@@H](O)CCN1CCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450554519	DI	On-Demand	Anodyne	RBP4	81	40
C[C@@H](O)CCN1CCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450554524	DI	On-Demand	Anodyne	RBP4	81	40
C[C@H](O)CCN1CCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450554525	DI	On-Demand	Anodyne	RBP4	81	40
C[C@H](O)CCN1CCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450554526	DI	On-Demand	Anodyne	RBP4	81	40
COC(=O)[C@@H]1CN(c2ccc(-n3ccc(C)n3)nn2)C[C@H]1c1ccc(O)cc1	ZINC000450554532	GE	On-Demand	Anodyne	SLC6A1	42	40
COC(=O)c1coc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)n1	ZINC000450554545	GF	On-Demand	Anodyne	CCR3	118	49
COC(=O)c1coc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)n1	ZINC000450554546	GF	On-Demand	Anodyne	CCR3	118	49
COC(=O)[C@@H]1CN(c2nc3ccc(OC)cc3nc2C)C[C@H]1c1ccc(O)cc1	ZINC000450554558	GG	On-Demand	Anodyne	SLC6A1	28	43
Cc1ccc([N+](=O)[O-])c(NCCCC2CCOCC2)n1	ZINC000450554577	CF	On-Demand	Bother	PRKCQ	43	35
CC[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450554579	CD	On-Demand	Anodyne	GALR1	46	33
CC[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450554579	CD	On-Demand	Anodyne	GHRL	49	32
CC[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450554580	CD	On-Demand	Anodyne	GALR1	46	33
CC[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450554580	CD	On-Demand	Anodyne	GHRL	49	32
CCCOc1ccc(C(=O)NCCCn2ccnn2)c(OC)c1	ZINC000450554583	DD	On-Demand	Anodyne	DRD3	17	40
O=C(CN1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1)N1CCCc2ccccc21	ZINC000450554584	FE	On-Demand	Anodyne	DRD4	18	45
O=C(CN1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1)N1CCCc2ccccc21	ZINC000450554585	FE	On-Demand	Anodyne	DRD4	18	45
CCOC(=O)c1ccc(CN2CCC(N(CC)S(C)(=O)=O)CC2)nc1	ZINC000450554607	FD	On-Demand	Anodyne	SSTR5	52	43
CCc1cccc(C(=O)N[C@@H](C)C[S@@](C)=O)n1	ZINC000450554617	CD	On-Demand	Anodyne	PDE5A	25	41
CCc1cccc(C(=O)N[C@H](C)C[S@@](C)=O)n1	ZINC000450554619	CD	On-Demand	Anodyne	PDE5A	25	41
COc1cccc([C@@H]2C[C@H]2C(=O)N(C)CCc2ccccc2O)c1	ZINC000450554620	EG	On-Demand	Anodyne	GPR88	0	47
CCc1cccc(C(=O)N[C@H](C)C[S@](C)=O)n1	ZINC000450554621	CD	On-Demand	Anodyne	PDE5A	25	41
CCc1cccc(C(=O)N[C@@H](C)C[S@](C)=O)n1	ZINC000450554622	CD	On-Demand	Anodyne	PDE5A	25	41
C=CCOc1ccc(CC(=O)NCC[C@@H]2CCO[C@@H](C)C2)cc1	ZINC000450554624	DG	On-Demand	Mild	PHZR	0	40
C=CCOc1ccc(CC(=O)NCC[C@@H]2CCO[C@H](C)C2)cc1	ZINC000450554625	DG	On-Demand	Mild	PHZR	0	40
C=CCOc1ccc(CC(=O)NCC[C@H]2CCO[C@@H](C)C2)cc1	ZINC000450554626	DG	On-Demand	Mild	PHZR	0	40
C=CCOc1ccc(CC(=O)NCC[C@H]2CCO[C@H](C)C2)cc1	ZINC000450554627	DG	On-Demand	Mild	PHZR	0	40
CC(C)(O)C(C)(C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450554631	FG	On-Demand	Anodyne	PYK	33	41
C[C@@H](O)CCCn1cnc2sc3c(c2c1=O)CC[C@@H](C)C3	ZINC000450554633	DF	On-Demand	Anodyne	HTR1B	18	43
C[C@H](O)CCCn1cnc2sc3c(c2c1=O)CC[C@@H](C)C3	ZINC000450554634	DF	On-Demand	Anodyne	HTR1B	18	43
C[C@H](O)CCCn1cnc2sc3c(c2c1=O)CC[C@H](C)C3	ZINC000450554635	DF	On-Demand	Anodyne	HTR1B	18	43
C[C@H]1CCc2c(sc3ncn(CCC[C@@H](C)O)c(=O)c23)C1	ZINC000450554636	DF	On-Demand	Anodyne	HTR1B	18	43
CC(C)(O)C(C)(C)NC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450554650	FE	On-Demand	Mild	TRPV4	40	30
C[C@H](c1ccc(CN2CCC[C@H]2C(=O)Nc2nccs2)cc1)C(F)(F)F	ZINC000450554655	GI	On-Demand	Anodyne	MAP1	102	36
C[C@H](c1ccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)cc1)C(F)(F)F	ZINC000450554660	GI	On-Demand	Anodyne	MAP1	102	36
C[C@@H](c1ccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)cc1)C(F)(F)F	ZINC000450554661	GI	On-Demand	Anodyne	MAP1	102	36
C[C@@H](c1ccc(CN2CCC[C@H]2C(=O)Nc2nccs2)cc1)C(F)(F)F	ZINC000450554662	GI	On-Demand	Anodyne	MAP1	102	36
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450554689	FE	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@H](C)NC(=O)c1ccc(NCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450554690	FE	On-Demand	Bother	TAAR1	20	47
CCCc1cc(C(=O)N(C)CCc2ccccc2O)no1	ZINC000450554695	CF	On-Demand	Anodyne	TSPO	15	40
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554700	FG	On-Demand	Anodyne	CCR5	44	42
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554700	FG	On-Demand	Anodyne	L3MBTL1	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554700	FG	On-Demand	Anodyne	L3MBTL3	65	42
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554702	FG	On-Demand	Anodyne	CCR5	44	42
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554702	FG	On-Demand	Anodyne	L3MBTL1	0	42
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554702	FG	On-Demand	Anodyne	L3MBTL3	65	42
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554704	FG	On-Demand	Anodyne	CCR5	44	42
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554704	FG	On-Demand	Anodyne	L3MBTL1	0	42
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554704	FG	On-Demand	Anodyne	L3MBTL3	65	42
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554706	FG	On-Demand	Anodyne	CCR5	44	42
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554706	FG	On-Demand	Anodyne	L3MBTL1	0	42
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450554706	FG	On-Demand	Anodyne	L3MBTL3	65	42
CCOc1cc(C(=O)NCCCc2ccc(Br)cc2OC)on1	ZINC000450554735	GG	On-Demand	Anodyne	MTNR1A	28	41
CCOc1cc(C(=O)NCCCc2ccc(Br)cc2OC)on1	ZINC000450554735	GG	On-Demand	Anodyne	MTNR1B	31	41
CCOC(=O)[C@@H]1CN(c2ncnc3ccc(C)cc23)CC12COC2	ZINC000450554746	ED	On-Demand	Anodyne	PDGFRB	20	41
CCOC(=O)[C@H]1CN(c2ncnc3ccc(C)cc23)CC12COC2	ZINC000450554748	ED	On-Demand	Anodyne	PDGFRB	20	41
CCn1nnc(C)c1CSc1ncc(C(F)(F)F)cc1Cl	ZINC000450554760	EH	On-Demand	Anodyne	GABRB3	0	46
CC(=O)c1cccc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)c1	ZINC000450554764	GE	On-Demand	Anodyne	HTR1A	15	47
CC(=O)c1cccc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)c1	ZINC000450554764	GE	On-Demand	Anodyne	DRD2	16	41
CC(=O)c1cccc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)c1	ZINC000450554764	GE	On-Demand	Anodyne	ACHE	15	42
CC(=O)c1cccc(CN2CCN(Cc3nnnn3-c3ccccc3)CC2)c1	ZINC000450554764	GE	On-Demand	Anodyne	FAAH	23	42
CCS(=O)(=O)N(C)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450554768	GE	On-Demand	Anodyne	ACHE	23	40
CCS(=O)(=O)N(C)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450554768	GE	On-Demand	Anodyne	SIGMAR1	42	39
C[C@@H]1C[C@]1(C#N)C(=O)NCCn1c2ccccc2c2ccccc21	ZINC000450554790	DG	On-Demand	Mild	FABI	45	33
CC(=O)c1cc(F)ccc1OCc1cn(C)nc1C	ZINC000450554791	CF	On-Demand	Anodyne	MT-CYB	43	30
C[C@@H](CCO)CCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450554792	DF	On-Demand	Anodyne	DHOD	0	43
C[C@H](CCO)CCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450554793	DF	On-Demand	Anodyne	DHOD	0	43
C[C@H]1C[C@]1(C#N)C(=O)NCCn1c2ccccc2c2ccccc21	ZINC000450554795	DG	On-Demand	Mild	FABI	45	33
C[C@@H]1C[C@@]1(C#N)C(=O)NCCn1c2ccccc2c2ccccc21	ZINC000450554800	DG	On-Demand	Mild	FABI	45	33
C[C@H]1C[C@@]1(C#N)C(=O)NCCn1c2ccccc2c2ccccc21	ZINC000450554801	DG	On-Demand	Mild	FABI	45	33
CC(C)(C)OC(=O)C1CCC(NC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450554803	FF	On-Demand	Anodyne	HDAC1	22	43
CC(C)(C)OC(=O)C1CCC(NC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450554803	FF	On-Demand	Anodyne	HPGDS	36	58
C[C@H]1CN(CCCC(=O)c2ccccc2)c2ccccc2NC1=O	ZINC000450554805	DH	On-Demand	Anodyne	CYSLTR2	49	33
C[C@H]1CN(CCCC(=O)c2ccccc2)c2ccccc2NC1=O	ZINC000450554805	DH	On-Demand	Anodyne	CYP2J2	50	35
C[C@@H]1CN(CCCC(=O)c2ccccc2)c2ccccc2NC1=O	ZINC000450554808	DH	On-Demand	Anodyne	CYSLTR2	49	33
C[C@@H]1CN(CCCC(=O)c2ccccc2)c2ccccc2NC1=O	ZINC000450554808	DH	On-Demand	Anodyne	CYP2J2	50	35
CCSc1cccnc1C(=O)NCC[C@H](C)N1CCCCC1	ZINC000450554815	DG	On-Demand	Anodyne	CCR5	21	40
CCSc1cccnc1C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450554816	DG	On-Demand	Anodyne	CCR5	21	40
CCn1c(SCc2nc(C(=O)OC)cs2)nc2ccccc21	ZINC000450554859	EH	On-Demand	Anodyne	PTGDR2	20	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554876	EH	On-Demand	Anodyne	DRD2	36	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554876	EH	On-Demand	Anodyne	DRD4	0	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554876	EH	On-Demand	Anodyne	HTR2A	17	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554876	EH	On-Demand	Anodyne	ERG2	19	41
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554876	EH	On-Demand	Anodyne	CYSLTR2	42	31
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554876	EH	On-Demand	Anodyne	SLC18A3	0	48
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554876	EH	On-Demand	Anodyne	CYP2J2	48	34
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554876	EH	On-Demand	Anodyne	AP2S1	0	41
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554878	EH	On-Demand	Anodyne	DRD2	36	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554878	EH	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554878	EH	On-Demand	Anodyne	HTR2A	17	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554878	EH	On-Demand	Anodyne	ERG2	19	41
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554878	EH	On-Demand	Anodyne	CYSLTR2	42	31
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554878	EH	On-Demand	Anodyne	SLC18A3	0	48
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554878	EH	On-Demand	Anodyne	CYP2J2	48	34
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)c2ccccc2NC1=O	ZINC000450554878	EH	On-Demand	Anodyne	AP2S1	0	41
CCn1c(SCCC(C)(F)F)nc2ccccc21	ZINC000450554891	CI	On-Demand	Anodyne	PTGDR2	17	45
CC[C@H](O)CC(=O)N1CC=C(c2cc(C)cc(C)c2)CC1	ZINC000450554902	CG	On-Demand	Anodyne	ADAM10	20	40
CC[C@@H](O)CC(=O)N1CC=C(c2cc(C)cc(C)c2)CC1	ZINC000450554903	CG	On-Demand	Anodyne	ADAM10	20	40
O=C(CCCN1CCNC(=O)[C@@H]1c1cccs1)c1ccccc1	ZINC000450554905	EF	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCNC(=O)[C@H]1c1cccs1)c1ccccc1	ZINC000450554906	EF	On-Demand	Anodyne	CYP2J2	49	34
COc1cc(CN[C@H](C(N)=O)C(C)(C)C)ccc1Cl	ZINC000450554919	CE	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CN[C@H](C(N)=O)C(C)(C)C)ccc1Cl	ZINC000450554919	CE	On-Demand	Anodyne	PDE6A	41	32
COc1cc(CN[C@H](C(N)=O)C(C)(C)C)ccc1Cl	ZINC000450554919	CE	On-Demand	Anodyne	MT-ND1	24	40
COc1cc(CN[C@H](C(N)=O)C(C)(C)C)ccc1Cl	ZINC000450554919	CE	On-Demand	Anodyne	DRTS_TRYCR	47	32
COc1cc(CN[C@@H](C(N)=O)C(C)(C)C)ccc1Cl	ZINC000450554920	CE	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CN[C@@H](C(N)=O)C(C)(C)C)ccc1Cl	ZINC000450554920	CE	On-Demand	Anodyne	PDE6A	41	32
COc1cc(CN[C@@H](C(N)=O)C(C)(C)C)ccc1Cl	ZINC000450554920	CE	On-Demand	Anodyne	MT-ND1	24	40
COc1cc(CN[C@@H](C(N)=O)C(C)(C)C)ccc1Cl	ZINC000450554920	CE	On-Demand	Anodyne	DRTS_TRYCR	47	32
CC(F)(F)CCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450554921	EG	On-Demand	Bother	MAPK13	44	33
CC(=O)NC1CCC(N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450554928	GE	On-Demand	Bother	CACNA1D	43	33
COC(=O)C1(CNC(=O)c2ccsc2Br)CCCCC1	ZINC000450554931	FG	On-Demand	Anodyne	HCN1	54	35
COC(=O)C1(CNC(=O)c2ccsc2Br)CCCCC1	ZINC000450554931	FG	On-Demand	Anodyne	HCN4	52	35
COC(=O)C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCCC1	ZINC000450554943	FE	On-Demand	Anodyne	HCN1	63	39
COC(=O)C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCCC1	ZINC000450554943	FE	On-Demand	Anodyne	HCN4	53	36
COCCOC[C@@H](O)CN1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000450554946	ED	On-Demand	Anodyne	ADRB2	27	40
COCCOC[C@@H](O)CN1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000450554946	ED	On-Demand	Anodyne	ADRB3	40	40
COCCOC[C@@H](O)CN1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000450554946	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COCCOC[C@H](O)CN1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000450554948	ED	On-Demand	Anodyne	ADRB2	27	40
COCCOC[C@H](O)CN1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000450554948	ED	On-Demand	Anodyne	ADRB3	40	40
COCCOC[C@H](O)CN1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000450554948	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
C[C@H](CCNC(=O)c1cc2ccncc2s1)N1CCCCC1	ZINC000450554954	DG	On-Demand	Anodyne	TACR2	42	37
C[C@H](CCNC(=O)c1cc2ccncc2s1)N1CCCCC1	ZINC000450554954	DG	On-Demand	Anodyne	NAMPT	21	50
C[C@@H](CCNC(=O)c1cc2ccncc2s1)N1CCCCC1	ZINC000450554956	DG	On-Demand	Anodyne	TACR2	42	37
C[C@@H](CCNC(=O)c1cc2ccncc2s1)N1CCCCC1	ZINC000450554956	DG	On-Demand	Anodyne	CCR5	37	41
C[C@@H](CCNC(=O)c1cc2ccncc2s1)N1CCCCC1	ZINC000450554956	DG	On-Demand	Anodyne	NAMPT	21	50
COCCOC[C@H](O)CN1CCc2[nH]c3ccc(Cl)cc3c2C1	ZINC000450554964	EE	On-Demand	Anodyne	HSP90AB1	34	40
COCCOC[C@@H](O)CN1CCc2[nH]c3ccc(Cl)cc3c2C1	ZINC000450554968	EE	On-Demand	Anodyne	HSP90AB1	34	40
O=C(NCC1(CO)CCC1)c1cc2ccncc2s1	ZINC000450554977	CE	On-Demand	Anodyne	NAMPT	18	42
COC(=O)c1cnc(NC[C@@H]2CS(=O)(=O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000450554983	GD	On-Demand	Bother	PRKCQ	44	35
COC(=O)c1cnc(NC[C@H]2CS(=O)(=O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000450554992	GD	On-Demand	Bother	PRKCQ	44	35
COc1ccc(CNC(=O)CCN(C(C)C)C2CCC2)c(OC)c1	ZINC000450555000	EF	On-Demand	Anodyne	MTNR1A	56	39
COc1ccc(C(=O)NCCCNc2ccccc2F)cc1S(C)(=O)=O	ZINC000450555002	GE	On-Demand	Anodyne	DRD2	21	42
COc1ccc(C(=O)NCCCNc2ccccc2F)cc1S(C)(=O)=O	ZINC000450555002	GE	On-Demand	Anodyne	DRD1	0	42
COc1ccc(C(=O)NCCCNc2ccccc2F)cc1S(C)(=O)=O	ZINC000450555002	GE	On-Demand	Anodyne	DRD4	43	34
COc1ccc(C(=O)NCCCNc2ccccc2F)cc1S(C)(=O)=O	ZINC000450555002	GE	On-Demand	Anodyne	DRD3	38	43
COc1ccc(C(=O)NCCCNc2ccccc2F)cc1S(C)(=O)=O	ZINC000450555002	GE	On-Demand	Anodyne	COLA	53	41
COc1ccc(C(=O)NCCCNc2ccccc2F)cc1S(C)(=O)=O	ZINC000450555002	GE	On-Demand	Anodyne	CPT1A	52	37
COc1ccc(C(=O)NCCCNc2ccccc2F)cc1S(C)(=O)=O	ZINC000450555002	GE	On-Demand	Anodyne	PTGDR	22	40
CC(C)(C)OC(=O)c1cnc(NC[C@@H](O)Cc2cccc(F)c2)cn1	ZINC000450555008	EF	On-Demand	Anodyne	PAPA1_CARPA	20	43
CC(C)(C)OC(=O)c1cnc(NC[C@H](O)Cc2cccc(F)c2)cn1	ZINC000450555009	EF	On-Demand	Anodyne	PAPA1_CARPA	20	43
CCn1c(SCc2nc(C(=O)OC)co2)nnc1-c1ccco1	ZINC000450555013	EF	On-Demand	Anodyne	SLC27A1	42	37
CN(CC(=O)NCc1ccccc1)Cc1cnns1	ZINC000450555014	CD	On-Demand	Anodyne	UL54	52	32
NC(=O)[C@@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450555015	FD	On-Demand	Anodyne	PDE6D	90	41
NC(=O)[C@@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450555015	FD	On-Demand	Anodyne	IMDH_CRYPV	28	44
NC(=O)[C@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450555020	FD	On-Demand	Anodyne	PDE6D	90	41
NC(=O)[C@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450555020	FD	On-Demand	Anodyne	IMDH_CRYPV	28	44
COC[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450555032	CD	On-Demand	Anodyne	PSBA	0	43
CCOC(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)nc1	ZINC000450555034	EE	On-Demand	Anodyne	PDS	42	42
COC(=O)[C@@H]1CN(c2nnc(C3CCOCC3)s2)C[C@H]1c1ccc(O)cc1	ZINC000450555038	GF	On-Demand	Anodyne	SLC6A1	49	41
O=C(c1cccnc1N[C@H]1CCCc2c(F)cc(F)cc21)N1CCCCC1	ZINC000450555039	FI	On-Demand	Anodyne	PARP1	35	40
C[C@H](CN1CCC(Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450555040	DE	On-Demand	Anodyne	MLNR	31	44
C[C@@H](CN1CCC(Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450555041	DE	On-Demand	Anodyne	MLNR	31	44
CCOC(=O)COc1ccc(NC(=O)Cn2cc(C(C)=O)nn2)cc1	ZINC000450555042	ED	On-Demand	Anodyne	PPO2	15	44
COC(=O)[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccc(O)cc1	ZINC000450555050	EF	On-Demand	Anodyne	SLC6A1	122	43
COC(=O)[C@@H]1CN(c2ncc(C(F)F)cn2)C[C@H]1c1ccc(O)cc1	ZINC000450555050	EF	On-Demand	Anodyne	SLC6A3	44	37
O=C(c1cccnc1N[C@@H]1CCCc2c(F)cc(F)cc21)N1CCCCC1	ZINC000450555055	FI	On-Demand	Anodyne	PARP1	35	40
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)c2ccc(C#N)n2C)c1	ZINC000450555061	DG	On-Demand	Mild	DRD4	40	31
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	DRD2	31	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	DRD1	18	46
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	DRD4	28	49
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	HRH2	17	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	HTR2A	36	51
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	HTR2C	28	57
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	DRD3	0	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	ERG2	20	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	SIGMAR1	16	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	CCR3	105	52
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	CHRNA7	21	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	SLC18A3	0	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	HTR3B	0	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	EPHX2	53	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	MCHR1	23	45
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555062	GH	On-Demand	Anodyne	CYP2J2	54	38
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)c2ccc(C#N)n2C)c1	ZINC000450555063	DG	On-Demand	Mild	DRD4	40	31
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	DRD2	31	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	DRD1	18	46
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	DRD4	28	49
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	HRH2	17	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	HTR2A	36	51
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	HTR2C	28	57
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	DRD3	0	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	ERG2	20	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	SIGMAR1	16	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	CCR3	105	52
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	CHRNA7	21	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	SLC18A3	0	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	HTR3B	0	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	EPHX2	53	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	MCHR1	23	45
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450555064	GH	On-Demand	Anodyne	CYP2J2	54	38
COc1cccc([C@H]2C[C@H](C)CN2C(=O)c2ccc(C#N)n2C)c1	ZINC000450555065	DG	On-Demand	Mild	DRD4	40	31
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)c2ccc(C#N)n2C)c1	ZINC000450555067	DG	On-Demand	Mild	DRD4	40	31
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)CC2(O)CCC2)c1	ZINC000450555069	FI	On-Demand	Anodyne	UTS2R	46	31
COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)CC2(O)CCC2)c1	ZINC000450555078	FI	On-Demand	Anodyne	UTS2R	46	31
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)CC2(O)CCC2)c1	ZINC000450555080	FI	On-Demand	Anodyne	UTS2R	46	31
COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)CC2(O)CCC2)c1	ZINC000450555082	FI	On-Demand	Anodyne	UTS2R	46	31
COC(=O)[C@@H]1CN(c2ncc(Cl)cc2Cl)C[C@H]1c1ccc(O)cc1	ZINC000450555100	FG	On-Demand	Anodyne	SLC6A1	83	48
C[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1cccc(C2CC2)c1	ZINC000450555105	GI	On-Demand	Bother	BCL2L1	59	36
C[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1cccc(C2CC2)c1	ZINC000450555106	GI	On-Demand	Bother	BCL2L1	59	36
COCc1nc(OC)cc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)n1	ZINC000450555111	FD	On-Demand	Anodyne	SLC6A1	47	42
CCc1c(C(=O)N[C@H]2CCCN(C)[C@@H]2C)oc2ccccc12	ZINC000450555112	DG	On-Demand	Anodyne	HTR4	40	36
CCc1c(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)oc2ccccc12	ZINC000450555114	DG	On-Demand	Anodyne	HTR4	40	36
CCc1c(C(=O)N[C@@H]2CCCN(C)[C@H]2C)oc2ccccc12	ZINC000450555116	DG	On-Demand	Anodyne	HTR4	40	36
CCc1c(C(=O)N[C@H]2CCCN(C)[C@H]2C)oc2ccccc12	ZINC000450555118	DG	On-Demand	Anodyne	HTR4	40	36
Fc1cccc2c1CCC[C@@H]2Nc1ccccn1	ZINC000450555125	BH	On-Demand	Anodyne	KCNN3	22	42
Fc1cccc2c1CCC[C@H]2Nc1ccccn1	ZINC000450555126	BH	On-Demand	Anodyne	KCNN3	22	42
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CCCN(C)[C@@H]1C	ZINC000450555131	DE	On-Demand	Anodyne	CCR3	78	32
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CCCN(C)[C@H]1C	ZINC000450555133	DE	On-Demand	Anodyne	CCR3	78	32
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CCCN(C)[C@@H]1C	ZINC000450555135	DE	On-Demand	Anodyne	CCR3	78	32
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CCCN(C)[C@H]1C	ZINC000450555136	DE	On-Demand	Anodyne	CCR3	78	32
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@H]3CCCCN3C(C)C)C2)cc1	ZINC000450555139	GI	On-Demand	Anodyne	HRH3	0	40
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@H]3CCCCN3C(C)C)C2)cc1	ZINC000450555139	GI	On-Demand	Anodyne	CCR3	81	44
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@@H]3CCCCN3C(C)C)C2)cc1	ZINC000450555147	GI	On-Demand	Anodyne	HRH3	0	40
Cc1ccc(NC(=O)NC[C@H]2CCCN(C[C@@H]3CCCCN3C(C)C)C2)cc1	ZINC000450555147	GI	On-Demand	Anodyne	CCR3	76	36
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H]3CCCCN3C(C)C)C2)cc1	ZINC000450555148	GI	On-Demand	Anodyne	HRH3	0	40
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H]3CCCCN3C(C)C)C2)cc1	ZINC000450555148	GI	On-Demand	Anodyne	CCR3	81	44
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H]3CCCCN3C(C)C)C2)cc1	ZINC000450555149	GI	On-Demand	Anodyne	HRH3	0	40
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H]3CCCCN3C(C)C)C2)cc1	ZINC000450555149	GI	On-Demand	Anodyne	CCR3	81	44
COc1cccc(-n2cc(C(=O)N3CC(F)C3)nn2)c1	ZINC000450555150	CD	On-Demand	Anodyne	ESRRA	21	40
COc1cccc(-n2cc(C(=O)N3CC(F)C3)nn2)c1	ZINC000450555150	CD	On-Demand	Anodyne	CCKAR	21	41
CCOC(=O)COc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1	ZINC000450555157	FG	On-Demand	Anodyne	MTTP	41	33
O=S(=O)(NCC1CC1)c1ccc(NCCCC2CCOCC2)nc1	ZINC000450555158	FD	On-Demand	Anodyne	NPY1R	40	32
O=S(=O)(NCC1CC1)c1ccc(NCCCC2CCOCC2)nc1	ZINC000450555158	FD	On-Demand	Anodyne	NPY2R	45	36
COC(=O)[C@@H]1CN(c2ccc(Cl)cc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450555162	FG	On-Demand	Mild	SLC6A1	81	50
COC(=O)[C@@H]1CN(c2ccc(Cl)cc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450555162	FG	On-Demand	Mild	SLC6A4	15	47
CS[C@@H](CNC(=O)c1cnn2ccc(C)cc12)C(C)(C)C	ZINC000450555167	DG	On-Demand	Anodyne	EPHB3	35	50
CCc1cccc(C(=O)NCCCn2ccnn2)n1	ZINC000450555174	CD	On-Demand	Anodyne	PDE5A	21	41
CS[C@H](CNC(=O)c1cnn2ccc(C)cc12)C(C)(C)C	ZINC000450555176	DG	On-Demand	Anodyne	EPHB3	35	50
CCOC(=O)COc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1	ZINC000450555178	FG	On-Demand	Anodyne	MTTP	41	33
CC[C@H](C)N(C)Cc1ccc(Cl)c(OC)c1	ZINC000450555227	BH	On-Demand	Anodyne	TTR	0	40
CC[C@@H](C)N(C)Cc1ccc(Cl)c(OC)c1	ZINC000450555231	BH	On-Demand	Anodyne	TTR	0	40
O=C(Nc1nccs1)[C@@H]1CCCN1CC1CC(F)(F)C1	ZINC000450555232	DF	On-Demand	Anodyne	MAP	0	42
O=C(Nc1nccs1)[C@@H]1CCCN1CC1CC(F)(F)C1	ZINC000450555232	DF	On-Demand	Anodyne	MAP1	85	42
O=C(Nc1nccs1)[C@H]1CCCN1CC1CC(F)(F)C1	ZINC000450555234	DF	On-Demand	Anodyne	MAP	0	42
O=C(Nc1nccs1)[C@H]1CCCN1CC1CC(F)(F)C1	ZINC000450555234	DF	On-Demand	Anodyne	MAP1	85	42
NC(=O)[C@H]1Cc2ccccc2N(CCCC(=O)c2ccccc2)C1	ZINC000450555237	DF	On-Demand	Anodyne	CYSLTR2	48	32
NC(=O)[C@H]1Cc2ccccc2N(CCCC(=O)c2ccccc2)C1	ZINC000450555237	DF	On-Demand	Anodyne	TPP2	52	31
NC(=O)[C@H]1Cc2ccccc2N(CCCC(=O)c2ccccc2)C1	ZINC000450555237	DF	On-Demand	Anodyne	CYP2J2	49	34
COC(=O)C1(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)CC1	ZINC000450555238	FF	On-Demand	Anodyne	SIGMAR1	28	44
COC(=O)C1(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)CC1	ZINC000450555238	FF	On-Demand	Anodyne	CCR5	37	45
NC(=O)[C@@H]1Cc2ccccc2N(CCCC(=O)c2ccccc2)C1	ZINC000450555241	DF	On-Demand	Anodyne	CYSLTR2	48	32
NC(=O)[C@@H]1Cc2ccccc2N(CCCC(=O)c2ccccc2)C1	ZINC000450555241	DF	On-Demand	Anodyne	TPP2	52	31
NC(=O)[C@@H]1Cc2ccccc2N(CCCC(=O)c2ccccc2)C1	ZINC000450555241	DF	On-Demand	Anodyne	CYP2J2	49	34
COc1cc(CC(=O)N(C)CCc2ccccc2O)ccc1Cl	ZINC000450555243	EG	On-Demand	Anodyne	OPRK1	0	45
COc1cc(CC(=O)N(C)CCc2ccccc2O)ccc1Cl	ZINC000450555243	EG	On-Demand	Anodyne	NCE103	31	45
COc1cc(CC(=O)N(C)CCc2ccccc2O)ccc1Cl	ZINC000450555243	EG	On-Demand	Anodyne	MBTPS1	41	31
COc1cc(CC(=O)N(C)CCc2ccccc2O)ccc1Cl	ZINC000450555243	EG	On-Demand	Anodyne	CAN2	0	45
COC(=O)c1coc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)n1	ZINC000450555244	GE	On-Demand	Anodyne	SORD	48	33
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CCc3cscn3)C2)cc1	ZINC000450555245	FH	On-Demand	Anodyne	CCR3	88	54
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CCc3cscn3)C2)cc1	ZINC000450555245	FH	On-Demand	Anodyne	BIRC2	41	37
CO[C@@H](Cc1ccccc1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450555247	FD	On-Demand	Anodyne	AGTR2	44	32
CO[C@@H](Cc1ccccc1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450555247	FD	On-Demand	Anodyne	GALR1	47	33
CO[C@@H](Cc1ccccc1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450555249	FD	On-Demand	Anodyne	AGTR2	44	32
CO[C@@H](Cc1ccccc1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450555249	FD	On-Demand	Anodyne	GALR1	47	33
CC(C)(C)n1cnc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)n1	ZINC000450555250	GE	On-Demand	Anodyne	RORC	55	33
CO[C@H](Cc1ccccc1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450555251	FD	On-Demand	Anodyne	AGTR2	44	32
CO[C@H](Cc1ccccc1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450555251	FD	On-Demand	Anodyne	GALR1	47	33
Cc1ccc(NC(=O)NC[C@H]2CCCN(CCc3cscn3)C2)cc1	ZINC000450555252	FH	On-Demand	Anodyne	CCR3	88	54
Cc1ccc(NC(=O)NC[C@H]2CCCN(CCc3cscn3)C2)cc1	ZINC000450555252	FH	On-Demand	Anodyne	BIRC2	41	37
CO[C@H](Cc1ccccc1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450555253	FD	On-Demand	Anodyne	AGTR2	44	32
CO[C@H](Cc1ccccc1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450555253	FD	On-Demand	Anodyne	GALR1	47	33
Cc1ccn2ncc(C(=O)N3CCNC(=O)[C@H]3Cc3ccccc3)c2c1	ZINC000450555255	ED	On-Demand	Anodyne	EPHB3	33	45
Cc1ccn2ncc(C(=O)N3CCNC(=O)[C@@H]3Cc3ccccc3)c2c1	ZINC000450555256	ED	On-Demand	Anodyne	EPHB3	33	45
C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)CCc1c(Cl)cccc1Cl	ZINC000450555257	GH	On-Demand	Anodyne	CA2	17	42
CC(F)(F)CCNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450555261	DH	On-Demand	Bother	MAOB	27	51
C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)CCc1c(Cl)cccc1Cl	ZINC000450555262	GH	On-Demand	Anodyne	CA2	17	42
O=C(Nc1nccs1)[C@@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450555263	EH	On-Demand	Anodyne	SLC6A1	25	42
O=C(Nc1nccs1)[C@@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450555263	EH	On-Demand	Anodyne	MAP1	95	37
O=C(Nc1nccs1)[C@@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450555263	EH	On-Demand	Anodyne	PREP	33	43
O=C(Nc1nccs1)[C@@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450555266	EH	On-Demand	Anodyne	SLC6A1	25	42
O=C(Nc1nccs1)[C@@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450555266	EH	On-Demand	Anodyne	MAP1	95	37
O=C(Nc1nccs1)[C@@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450555266	EH	On-Demand	Anodyne	PREP	33	43
O=C(Nc1nccs1)[C@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450555268	EH	On-Demand	Anodyne	SLC6A1	25	42
O=C(Nc1nccs1)[C@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450555268	EH	On-Demand	Anodyne	MAP1	95	37
O=C(Nc1nccs1)[C@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450555268	EH	On-Demand	Anodyne	PREP	33	43
O=C(Nc1nccs1)[C@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450555270	EH	On-Demand	Anodyne	SLC6A1	25	42
O=C(Nc1nccs1)[C@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450555270	EH	On-Demand	Anodyne	MAP1	95	37
O=C(Nc1nccs1)[C@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450555270	EH	On-Demand	Anodyne	PREP	33	43
C[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCCN1C	ZINC000450555271	EG	On-Demand	Anodyne	RBP4	60	37
C[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCCN1C	ZINC000450555271	EG	On-Demand	Anodyne	SFRP1	52	36
C[C@H](O)CCN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450555272	EF	On-Demand	Anodyne	NAMPT	36	44
C[C@H](O)CCN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450555272	EF	On-Demand	Anodyne	NR1D1	50	40
C[C@@H](O)CCN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450555273	EF	On-Demand	Anodyne	NAMPT	36	44
C[C@@H](O)CCN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450555273	EF	On-Demand	Anodyne	NR1D1	50	40
C[C@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCCN1C	ZINC000450555274	EG	On-Demand	Anodyne	RBP4	60	37
C[C@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCCN1C	ZINC000450555274	EG	On-Demand	Anodyne	SFRP1	52	36
C[C@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCCN1C	ZINC000450555276	EG	On-Demand	Anodyne	RBP4	60	37
C[C@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCCN1C	ZINC000450555276	EG	On-Demand	Anodyne	SFRP1	52	36
CC(C)N1CCCC[C@@H]1CN1C[C@@H](C(N)=O)Cc2ccccc21	ZINC000450555277	DE	On-Demand	Anodyne	TPP2	52	32
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555278	DD	On-Demand	Anodyne	CA2	58	40
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555278	DD	On-Demand	Anodyne	CA1	57	39
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555278	DD	On-Demand	Anodyne	CA7	42	36
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555278	DD	On-Demand	Anodyne	CA4	68	39
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555278	DD	On-Demand	Anodyne	CA5A	41	36
CC(C)N1CCCC[C@@H]1CN1C[C@H](C(N)=O)Cc2ccccc21	ZINC000450555279	DE	On-Demand	Anodyne	TPP2	52	32
CC(C)N1CCCC[C@H]1CN1C[C@@H](C(N)=O)Cc2ccccc21	ZINC000450555281	DE	On-Demand	Anodyne	TPP2	52	32
CC(C)N1CCCC[C@H]1CN1C[C@H](C(N)=O)Cc2ccccc21	ZINC000450555283	DE	On-Demand	Anodyne	TPP2	52	32
COC(=O)[C@@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccc(O)cc1	ZINC000450555286	FG	On-Demand	Anodyne	SLC6A1	40	44
COC(=O)[C@@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccc(O)cc1	ZINC000450555286	FG	On-Demand	Anodyne	NPBWR1	41	41
C[C@H](OCc1ccc(F)cc1)C(=O)NCCCNc1ccccc1F	ZINC000450555290	EG	On-Demand	Anodyne	LEF	40	32
C[C@@H](OCc1ccc(F)cc1)C(=O)NCCCNc1ccccc1F	ZINC000450555293	EG	On-Demand	Anodyne	LEF	40	32
CCCN(CCc1cscn1)CC(=O)Nc1ccc(Cl)cc1	ZINC000450555297	EH	On-Demand	Anodyne	IMDH_CRYPV	26	40
CCC(=O)CCCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450555302	EG	On-Demand	Anodyne	HTR1A	76	46
CCC(=O)CCCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450555302	EG	On-Demand	Anodyne	DRD4	55	41
CCC(=O)CCCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450555302	EG	On-Demand	Anodyne	HTR2A	50	45
CCC(=O)CCCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450555302	EG	On-Demand	Anodyne	DRD3	56	47
CCC(=O)CCCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450555302	EG	On-Demand	Anodyne	P2RY12	40	31
CCC(=O)CCCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450555302	EG	On-Demand	Anodyne	HTR7	87	39
CCC(=O)CCCN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450555302	EG	On-Demand	Anodyne	CYP2J2	48	34
O=C(NCCCNc1cccc(F)c1)[C@@H]1CC12CCSCC2	ZINC000450555313	DG	On-Demand	Anodyne	TBK1	18	41
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC(F)(F)C3)C2)cc1	ZINC000450555318	FH	On-Demand	Anodyne	CCR3	88	46
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC(F)(F)C3)C2)cc1	ZINC000450555318	FH	On-Demand	Anodyne	EPHX2	19	47
O=C(NCCCNc1cccc(F)c1)[C@H]1CC12CCSCC2	ZINC000450555319	DG	On-Demand	Anodyne	TBK1	18	41
Cc1ccc(NC(=O)NC[C@H]2CCCN(CC3CC(F)(F)C3)C2)cc1	ZINC000450555323	FH	On-Demand	Anodyne	CCR3	88	46
Cc1ccc(NC(=O)NC[C@H]2CCCN(CC3CC(F)(F)C3)C2)cc1	ZINC000450555323	FH	On-Demand	Anodyne	EPHX2	19	47
Cc1nc(NC[C@H]2CSc3ccccc32)ncc1[N+](=O)[O-]	ZINC000450555326	DE	On-Demand	Bother	PRKCQ	51	41
Cc1nc(NC[C@@H]2CSc3ccccc32)ncc1[N+](=O)[O-]	ZINC000450555337	DE	On-Demand	Bother	PRKCQ	51	41
CCc1cc(CCCN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)on1	ZINC000450555341	FF	On-Demand	Bother	PLA2G2A	45	46
CCc1cc(CCCN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)on1	ZINC000450555341	FF	On-Demand	Bother	KCNJ1	26	40
COc1ccc(OC(F)(F)F)c(C(=O)NCC(=O)C2CC2)c1	ZINC000450555348	DE	On-Demand	Anodyne	GRIN2B	19	41
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC(=O)C3CC3)cc2)c1	ZINC000450555366	FF	On-Demand	Anodyne	MMP13	0	51
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC(=O)C3CC3)cc2)c1	ZINC000450555366	FF	On-Demand	Anodyne	CCR2	38	41
CC[C@@H](Nc1ccc2nnc(-c3ccccc3)n2n1)C(F)F	ZINC000450555375	DF	On-Demand	Anodyne	LRRK2	25	42
CC[C@H](Nc1ccc2nnc(-c3ccccc3)n2n1)C(F)F	ZINC000450555379	DF	On-Demand	Anodyne	LRRK2	25	42
CCOC(=O)c1ccc(CN(CCO)[C@H]2CCCc3ccccc32)nc1	ZINC000450555388	FG	On-Demand	Anodyne	CXCR4	64	46
c1ccc(-c2nccc(N3CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)n2)cc1	ZINC000450555389	FF	On-Demand	Anodyne	SORD	40	34
CCOC(=O)c1ccc(CN(CCO)[C@@H]2CCCc3ccccc32)nc1	ZINC000450555390	FG	On-Demand	Anodyne	CXCR4	64	46
c1ccc(-c2nccc(N3CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)n2)cc1	ZINC000450555394	FF	On-Demand	Anodyne	SORD	40	34
O=C1NCCN(C(=O)CC2(O)CCC2)[C@H]1Cc1ccccc1	ZINC000450555407	DC	On-Demand	Anodyne	GALR1	43	31
Cc1cnc(CCCC(=O)NCCCNc2cccc(F)c2)o1	ZINC000450555408	DG	On-Demand	Anodyne	TBK1	16	47
C[C@H](O)CCCn1cnc2sc3c(c2c1=O)CCCC3	ZINC000450555412	CE	On-Demand	Anodyne	HTR1B	17	43
CNS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450555413	GF	On-Demand	Anodyne	SLC18A3	0	42
C[C@@H](O)CCCn1cnc2sc3c(c2c1=O)CCCC3	ZINC000450555414	CE	On-Demand	Anodyne	HTR1B	17	43
C=C[C@@H]1OCC[C@H]1C(=O)NCCCNc1cccc(F)c1	ZINC000450555415	CE	On-Demand	Mild	TBK1	27	44
CCN(CC(=O)Nc1c(C)cccc1C)Cc1ccc(Cl)c(OC)c1	ZINC000450555421	FI	On-Demand	Anodyne	S1PR4	48	43
O=C1NCCN(C(=O)CC2(O)CCC2)[C@@H]1Cc1ccccc1	ZINC000450555422	DC	On-Demand	Anodyne	GALR1	43	31
O=C(C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1)N(Cc1ccccc1)C1CC1	ZINC000450555427	FG	On-Demand	Anodyne	CCR5	34	41
COC(=O)c1csc(CN2CCC[C@H]2C(=O)Nc2nccs2)n1	ZINC000450555428	FD	On-Demand	Anodyne	MAP1	97	37
COC(=O)c1csc(CN2CCC[C@@H]2C(=O)Nc2nccs2)n1	ZINC000450555430	FD	On-Demand	Anodyne	MAP1	97	37
O=C(C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1)N(Cc1ccccc1)C1CC1	ZINC000450555437	FG	On-Demand	Anodyne	CCR5	34	41
CCOC(=O)COc1ccc(NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450555438	EF	On-Demand	Anodyne	LTA4H	26	41
CC(F)(F)CCn1cnc2scc(-c3ccc(F)cc3)c2c1=O	ZINC000450555441	EI	On-Demand	Anodyne	TGM2	15	40
Clc1ccc(CCN2CCN(Cc3nnnn3-c3ccccc3)CC2)cc1	ZINC000450555458	GF	On-Demand	Anodyne	DRD2	20	52
Clc1ccc(CCN2CCN(Cc3nnnn3-c3ccccc3)CC2)cc1	ZINC000450555458	GF	On-Demand	Anodyne	DRD4	43	42
Clc1ccc(CCN2CCN(Cc3nnnn3-c3ccccc3)CC2)cc1	ZINC000450555458	GF	On-Demand	Anodyne	SLC6A3	20	46
Clc1ccc(CCN2CCN(Cc3nnnn3-c3ccccc3)CC2)cc1	ZINC000450555458	GF	On-Demand	Anodyne	SIGMAR1	39	52
COC(=O)c1ccc(C(=O)Cn2cnc3sc4c(c3c2=O)CC[C@H](C)C4)o1	ZINC000450555479	GF	On-Demand	Anodyne	HTR1B	19	40
COC(=O)c1ccc(C(=O)Cn2cnc3sc4c(c3c2=O)CC[C@@H](C)C4)o1	ZINC000450555480	GF	On-Demand	Anodyne	HTR1B	19	40
COC(=O)c1cnc(NC[C@@H]2CSc3ccccc32)c([N+](=O)[O-])c1	ZINC000450555481	EG	On-Demand	Bother	PRKCQ	45	35
CC(=O)NC1CCC(N(C)C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450555488	EE	On-Demand	Anodyne	NPY2R	17	50
CC(=O)NC1CCC(N(C)C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450555488	EE	On-Demand	Anodyne	MTNR1A	26	40
CC(=O)NC1CCC(N(C)C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450555488	EE	On-Demand	Anodyne	MTNR1B	17	40
CC(=O)NC1CCC(N(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450555489	EE	On-Demand	Anodyne	NPY2R	17	50
CC(=O)NC1CCC(N(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450555489	EE	On-Demand	Anodyne	MTNR1A	26	40
CC(=O)NC1CCC(N(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450555489	EE	On-Demand	Anodyne	MTNR1B	17	40
C[C@@H](CCNC(=O)c1cc(-c2ccccc2)nn1C)N1CCCCC1	ZINC000450555514	EG	On-Demand	Anodyne	INHA	48	32
C[C@@H](CCNC(=O)c1cc(-c2ccccc2)nn1C)N1CCCCC1	ZINC000450555514	EG	On-Demand	Anodyne	P2RY12	69	33
C[C@@H](CCNC(=O)c1cc(-c2ccccc2)nn1C)N1CCCCC1	ZINC000450555514	EG	On-Demand	Anodyne	CCR5	27	41
C[C@@H](CCNC(=O)c1cc(-c2ccccc2)nn1C)N1CCCCC1	ZINC000450555514	EG	On-Demand	Anodyne	CTSV	43	30
C[C@H](CCNC(=O)c1cc(-c2ccccc2)nn1C)N1CCCCC1	ZINC000450555515	EG	On-Demand	Anodyne	INHA	48	32
C[C@H](CCNC(=O)c1cc(-c2ccccc2)nn1C)N1CCCCC1	ZINC000450555515	EG	On-Demand	Anodyne	P2RY12	69	33
C[C@H](CCNC(=O)c1cc(-c2ccccc2)nn1C)N1CCCCC1	ZINC000450555515	EG	On-Demand	Anodyne	CCR5	27	41
C[C@H](CCNC(=O)c1cc(-c2ccccc2)nn1C)N1CCCCC1	ZINC000450555515	EG	On-Demand	Anodyne	CTSV	43	30
C[C@@H](CCNC(=O)c1ccc2cnccc2c1)N1CCCCC1	ZINC000450555534	DG	On-Demand	Anodyne	DRD4	42	32
C[C@@H](CCNC(=O)c1ccc2cnccc2c1)N1CCCCC1	ZINC000450555534	DG	On-Demand	Anodyne	CCR5	19	41
C[C@@H](CCNC(=O)c1ccc2cnccc2c1)N1CCCCC1	ZINC000450555534	DG	On-Demand	Anodyne	RPS6KA3	44	37
C[C@H](CCNC(=O)c1ccc2cnccc2c1)N1CCCCC1	ZINC000450555535	DG	On-Demand	Anodyne	DRD4	42	32
C[C@H](CCNC(=O)c1ccc2cnccc2c1)N1CCCCC1	ZINC000450555535	DG	On-Demand	Anodyne	CCR5	19	41
C[C@H](CCNC(=O)c1ccc2cnccc2c1)N1CCCCC1	ZINC000450555535	DG	On-Demand	Anodyne	RPS6KA3	44	37
COCCOC[C@H](O)CN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450555545	FE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COCCOC[C@@H](O)CN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450555546	FE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COCCOC[C@H](O)CN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450555547	FE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COCCOC[C@@H](O)CN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450555548	FE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
C[C@@H](CCNC(=O)Cc1ccccc1O[C@H]1CCOC1)N1CCCCC1	ZINC000450555555	FF	On-Demand	Anodyne	HCN1	42	34
C[C@@H](CCNC(=O)Cc1ccccc1O[C@H]1CCOC1)N1CCCCC1	ZINC000450555555	FF	On-Demand	Anodyne	HCN4	41	34
C[C@H](CCNC(=O)Cc1ccccc1O[C@@H]1CCOC1)N1CCCCC1	ZINC000450555556	FF	On-Demand	Anodyne	HCN1	42	34
C[C@H](CCNC(=O)Cc1ccccc1O[C@@H]1CCOC1)N1CCCCC1	ZINC000450555556	FF	On-Demand	Anodyne	HCN4	41	34
C[C@H](CCNC(=O)Cc1ccccc1O[C@H]1CCOC1)N1CCCCC1	ZINC000450555557	FF	On-Demand	Anodyne	HCN1	42	34
C[C@H](CCNC(=O)Cc1ccccc1O[C@H]1CCOC1)N1CCCCC1	ZINC000450555557	FF	On-Demand	Anodyne	HCN4	41	34
C[C@@H](CCNC(=O)Cc1ccccc1O[C@@H]1CCOC1)N1CCCCC1	ZINC000450555558	FF	On-Demand	Anodyne	HCN1	42	34
C[C@@H](CCNC(=O)Cc1ccccc1O[C@@H]1CCOC1)N1CCCCC1	ZINC000450555558	FF	On-Demand	Anodyne	HCN4	41	34
Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1-c1nnnn1C1CC1	ZINC000450555572	GH	On-Demand	Anodyne	ABL1	40	34
NS(=O)(=O)CCN1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450555574	GC	On-Demand	Anodyne	SIGMAR1	35	46
COC(=O)C(C)(C)N(C)CCN(C)Cc1ccccc1	ZINC000450555584	CE	On-Demand	Anodyne	ACHE	25	46
COC(=O)C(C)(C)N(C)CCN(C)Cc1ccccc1	ZINC000450555584	CE	On-Demand	Anodyne	LTA4H	30	41
COC(=O)C(C)(C)N(C)CCN(C)Cc1ccccc1	ZINC000450555584	CE	On-Demand	Anodyne	AMY2	57	34
COC(=O)C(C)(C)N(C)CCN(C)Cc1ccccc1	ZINC000450555584	CE	On-Demand	Anodyne	PTPRB	44	40
CN(CCNC1(c2ccc(F)cc2)CCOCC1)Cc1ccccc1	ZINC000450555594	EH	On-Demand	Anodyne	TACR3	32	40
Cc1cnc(CCCC(=O)NCCn2c3ccccc3c3ccccc32)o1	ZINC000450555595	FI	On-Demand	Anodyne	CNR1	0	40
Cc1cnc(CCCC(=O)NCCn2c3ccccc3c3ccccc32)o1	ZINC000450555595	FI	On-Demand	Anodyne	CNR2	15	40
CCN(CC)S(=O)(=O)c1ccc(NCCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450555596	GG	On-Demand	Bother	COLA	51	34
CC(F)(F)CCCNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450555603	GK	On-Demand	Anodyne	NPBWR1	42	37
C[C@@H]1CCCN(c2cc(NCCCC(C)(F)F)ncn2)C1	ZINC000450555617	CH	On-Demand	Anodyne	PRCP	20	43
C[C@H]1CCCN(c2cc(NCCCC(C)(F)F)ncn2)C1	ZINC000450555619	CH	On-Demand	Anodyne	PRCP	20	43
CCC(=O)CCCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450555633	FE	On-Demand	Anodyne	HTR1A	37	40
CCC(=O)CCCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450555633	FE	On-Demand	Anodyne	DRD2	33	49
CCC(=O)CCCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450555633	FE	On-Demand	Anodyne	DRD4	29	58
CCC(=O)CCCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450555633	FE	On-Demand	Anodyne	HTR7	51	40
CCC(=O)CCCN1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450555633	FE	On-Demand	Anodyne	CYP2J2	45	32
CC(=O)[C@@](C)(O)CN[C@H](c1ccccc1)C1CCC1	ZINC000450555641	CE	On-Demand	Anodyne	AMY2	44	30
CC(=O)[C@@](C)(O)CN[C@@H](c1ccccc1)C1CCC1	ZINC000450555642	CE	On-Demand	Anodyne	AMY2	44	30
CC(=O)[C@](C)(O)CN[C@H](c1ccccc1)C1CCC1	ZINC000450555643	CE	On-Demand	Anodyne	AMY2	44	30
CC(=O)[C@](C)(O)CN[C@@H](c1ccccc1)C1CCC1	ZINC000450555648	CE	On-Demand	Anodyne	AMY2	44	30
CC(=O)[C@@](C)(O)CN1CCc2[nH]c3ccc(Cl)cc3c2C1	ZINC000450555649	DF	On-Demand	Anodyne	SIRT1	15	42
CC(=O)[C@](C)(O)CN1CCc2[nH]c3ccc(Cl)cc3c2C1	ZINC000450555650	DF	On-Demand	Anodyne	SIRT1	15	42
CCC(=O)CCCN1CCc2[nH]c3ccc(Cl)cc3c2C1	ZINC000450555653	DH	On-Demand	Anodyne	HTR5A	25	52
CCS(=O)(=O)c1ccc(CN2CCC(NC(C)C)CC2)cc1	ZINC000450555662	DE	On-Demand	Anodyne	HRH3	23	43
CCS(=O)(=O)c1ccc(CN2CCC(NC(C)C)CC2)cc1	ZINC000450555662	DE	On-Demand	Anodyne	SIGMAR1	35	40
CCS(=O)(=O)c1ccc(CN2CCC(NC(C)C)CC2)cc1	ZINC000450555662	DE	On-Demand	Anodyne	SSTR5	66	45
C[C@H](C[S@](C)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450555687	FG	On-Demand	Anodyne	ACACA	28	41
C[C@H](C[S@](C)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450555687	FG	On-Demand	Anodyne	ACACB	35	40
C[C@@H](C[S@@](C)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450555688	FG	On-Demand	Anodyne	ACACA	28	41
C[C@@H](C[S@@](C)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450555688	FG	On-Demand	Anodyne	ACACB	35	40
C[C@H](C[S@@](C)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450555689	FG	On-Demand	Anodyne	ACACA	28	41
C[C@H](C[S@@](C)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450555689	FG	On-Demand	Anodyne	ACACB	35	40
C[C@@H](C[S@](C)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450555690	FG	On-Demand	Anodyne	ACACA	28	41
C[C@@H](C[S@](C)=O)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450555690	FG	On-Demand	Anodyne	ACACB	35	40
CCn1nnc(C)c1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450555693	GF	On-Demand	Anodyne	MPO	56	37
CCn1nnc(C)c1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450555693	GF	On-Demand	Anodyne	ABCG2	25	40
CC(F)(F)CCNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000450555714	EF	On-Demand	Anodyne	CYNT	24	43
CC(C)(C)[C@H](NCCc1ccc(Cl)cc1)C(N)=O	ZINC000450555716	CE	On-Demand	Anodyne	PDF	20	40
CC(C)(C)[C@H](NCCc1ccc(Cl)cc1)C(N)=O	ZINC000450555716	CE	On-Demand	Anodyne	MMP3	16	41
CC(C)(C)[C@@H](NCCc1ccc(Cl)cc1)C(N)=O	ZINC000450555717	CE	On-Demand	Anodyne	PDF	20	40
CC(C)(C)[C@@H](NCCc1ccc(Cl)cc1)C(N)=O	ZINC000450555717	CE	On-Demand	Anodyne	MMP3	16	41
CCc1cc(N[C@H](C)c2cccc(C3CC3)c2)n2ncnc2n1	ZINC000450555747	DH	On-Demand	Anodyne	DHOD	0	48
CCc1cc(N[C@@H](C)c2cccc(C3CC3)c2)n2ncnc2n1	ZINC000450555749	DH	On-Demand	Anodyne	DHOD	0	48
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)cc1	ZINC000450555768	DH	On-Demand	Anodyne	HRH3	25	40
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)cc1	ZINC000450555768	DH	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)cc1	ZINC000450555768	DH	On-Demand	Anodyne	MLNR	47	35
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)cc1	ZINC000450555768	DH	On-Demand	Anodyne	L3MBTL1	0	41
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)cc1	ZINC000450555768	DH	On-Demand	Anodyne	L3MBTL3	17	41
CC(=O)c1ccc(CN2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555777	DH	On-Demand	Anodyne	HRH3	25	40
CC(=O)c1ccc(CN2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555777	DH	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)c1ccc(CN2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555777	DH	On-Demand	Anodyne	MLNR	47	35
CC(=O)c1ccc(CN2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555777	DH	On-Demand	Anodyne	L3MBTL1	0	41
CC(=O)c1ccc(CN2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555777	DH	On-Demand	Anodyne	L3MBTL3	17	41
CC(=O)c1ccc(CN2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)cc1	ZINC000450555779	DH	On-Demand	Anodyne	HRH3	25	40
CC(=O)c1ccc(CN2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)cc1	ZINC000450555779	DH	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)c1ccc(CN2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)cc1	ZINC000450555779	DH	On-Demand	Anodyne	MLNR	47	35
CC(=O)c1ccc(CN2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)cc1	ZINC000450555779	DH	On-Demand	Anodyne	L3MBTL1	0	41
CC(=O)c1ccc(CN2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)cc1	ZINC000450555779	DH	On-Demand	Anodyne	L3MBTL3	17	41
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555781	DH	On-Demand	Anodyne	HRH3	25	40
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555781	DH	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555781	DH	On-Demand	Anodyne	MLNR	47	35
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555781	DH	On-Demand	Anodyne	L3MBTL1	0	41
CC(=O)c1ccc(CN2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)cc1	ZINC000450555781	DH	On-Demand	Anodyne	L3MBTL3	17	41
CN(C)CCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450555799	FF	On-Demand	Anodyne	DRD2	49	40
CN(C)CCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450555799	FF	On-Demand	Anodyne	DRD1	23	40
CN(C)CCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450555799	FF	On-Demand	Anodyne	ADRA1D	51	40
CN(C)CCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450555799	FF	On-Demand	Anodyne	ADRA1A	40	38
c1ccc(-c2cc(NCCCC3CCOCC3)n3ncnc3n2)cc1	ZINC000450555808	EG	On-Demand	Anodyne	DHOD	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555833	GH	On-Demand	Anodyne	NPY2R	41	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555833	GH	On-Demand	Anodyne	CCR3	120	48
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555833	GH	On-Demand	Anodyne	CYP2D6	16	45
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	HTR1A	25	51
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	DRD2	29	56
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	DRD4	30	51
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	HTR2A	28	51
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	HRH1	19	48
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	DRD3	16	45
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	GRIN2B	28	44
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	HTR7	35	51
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	SIGMAR1	21	52
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	PRCP	57	43
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	PLD1	40	35
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	PARP2	18	46
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	HTR3B	0	40
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	PARP1	17	46
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	GRIN3A	0	40
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	MCHR1	22	50
O=C(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1	ZINC000450555836	EI	On-Demand	Anodyne	CYP2J2	64	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555837	GH	On-Demand	Anodyne	NPY2R	41	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555837	GH	On-Demand	Anodyne	CCR3	120	48
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555837	GH	On-Demand	Anodyne	CYP2D6	16	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555838	GH	On-Demand	Anodyne	NPY2R	41	35
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555838	GH	On-Demand	Anodyne	CCR3	120	48
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555838	GH	On-Demand	Anodyne	CYP2D6	16	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555839	GH	On-Demand	Anodyne	NPY2R	41	35
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555839	GH	On-Demand	Anodyne	CCR3	120	48
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450555839	GH	On-Demand	Anodyne	CYP2D6	16	45
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	DRD2	18	46
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	DRD4	25	46
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	HRH2	19	44
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	SIGMAR1	24	42
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	CCR3	79	47
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	MLNR	76	42
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	CCR2	15	43
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	MCHR1	25	41
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	SFRP1	111	35
CC(=O)c1ccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555861	GF	On-Demand	Anodyne	WNT3	71	35
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	DRD2	18	46
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	DRD4	25	46
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	HRH2	19	44
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	SIGMAR1	24	42
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	CCR3	79	47
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	MLNR	76	42
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	CCR2	15	43
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	MCHR1	25	41
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	SFRP1	111	35
CC(=O)c1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)cc1	ZINC000450555863	GF	On-Demand	Anodyne	WNT3	71	35
COc1cc(F)cc(CNC(=O)C2(Cc3ccccc3)CCOCC2)c1	ZINC000450555871	FG	On-Demand	Anodyne	NR3C2	23	51
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555872	DH	On-Demand	Anodyne	HMGCR	99	37
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555872	DH	On-Demand	Anodyne	ACACA	64	46
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555872	DH	On-Demand	Anodyne	ACACB	25	46
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555873	DH	On-Demand	Anodyne	HMGCR	54	33
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555873	DH	On-Demand	Anodyne	ACACA	64	46
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555874	DH	On-Demand	Anodyne	HMGCR	54	33
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555874	DH	On-Demand	Anodyne	ACACA	64	46
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555875	DH	On-Demand	Anodyne	HMGCR	54	33
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450555875	DH	On-Demand	Anodyne	ACACA	64	46
CCC[C@H](O)CN(CCCO)C(c1ccccc1)c1ccccc1	ZINC000450555877	EH	On-Demand	Anodyne	AOC3	15	40
CCC[C@@H](O)CN(CCCO)C(c1ccccc1)c1ccccc1	ZINC000450555878	EH	On-Demand	Anodyne	AOC3	15	40
O=C(CN1CCN(CC/C=C\c2ccccc2)CC1)NC1CCCCC1	ZINC000450555879	FG	On-Demand	Anodyne	DRD4	19	52
O=C(CN1CCN(CC/C=C\c2ccccc2)CC1)NC1CCCCC1	ZINC000450555879	FG	On-Demand	Anodyne	SIGMAR1	25	41
O=C(CN1CCN(CC/C=C\c2ccccc2)CC1)NC1CCCCC1	ZINC000450555879	FG	On-Demand	Anodyne	EPHX2	24	45
O=C(CN1CCN(CC/C=C/c2ccccc2)CC1)NC1CCCCC1	ZINC000450555880	FG	On-Demand	Anodyne	DRD4	19	52
O=C(CN1CCN(CC/C=C/c2ccccc2)CC1)NC1CCCCC1	ZINC000450555880	FG	On-Demand	Anodyne	SIGMAR1	25	41
O=C(CN1CCN(CC/C=C/c2ccccc2)CC1)NC1CCCCC1	ZINC000450555880	FG	On-Demand	Anodyne	EPHX2	24	45
COC(=O)c1cnc(NC[C@H]2CSc3ccccc32)c([N+](=O)[O-])c1	ZINC000450555890	EG	On-Demand	Bother	PRKCQ	45	35
CCS(=O)(=O)c1ccc(Cn2cc(C(F)(F)F)ccc2=O)cc1	ZINC000450555901	EF	On-Demand	Anodyne	RORC	37	42
CCCN(Cc1nnc(C2CC2)s1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450555902	GH	On-Demand	Anodyne	DRD3	17	41
CCOc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)ccc1[N+](=O)[O-]	ZINC000450555903	GG	On-Demand	Bother	SLC6A1	54	41
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA2	107	54
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	MME	0	47
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA1	84	60
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA7	64	43
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA5B	62	38
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA4	102	54
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA5A	67	38
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA14	44	45
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA12	45	40
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	CA9	55	43
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	NCE103	41	36
CC(C)CC(CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450555907	EF	On-Demand	Anodyne	P96878_MYCTU	50	40
Cc1cccc(NC(=O)N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450555913	EF	On-Demand	Anodyne	EPHX2	19	42
Cc1cccc(NC(=O)N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450555913	EF	On-Demand	Anodyne	P2RY14	42	33
Cc1cccc(NC(=O)N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450555929	EF	On-Demand	Anodyne	EPHX2	19	42
Cc1cccc(NC(=O)N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450555929	EF	On-Demand	Anodyne	P2RY14	42	33
COC(=O)[C@@H]1CN(c2nc(C)nc3c2CCCC3)C[C@H]1c1ccc(O)cc1	ZINC000450555930	FF	On-Demand	Anodyne	SLC6A1	33	42
Cc1cccc(O)c1NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450555943	CH	On-Demand	Anodyne	ACAT	0	42
CCOC(=O)[C@H]1CN(c2nc3ccccc3[nH]2)CC12COC2	ZINC000450555945	DD	On-Demand	Anodyne	NPY5R	0	42
CCOC(=O)[C@H]1CN(c2nc3ccccc3[nH]2)CC12COC2	ZINC000450555945	DD	On-Demand	Anodyne	ALKBH3	42	36
CCOC(=O)[C@@H]1CN(c2nc3ccccc3[nH]2)CC12COC2	ZINC000450555954	DD	On-Demand	Anodyne	NPY5R	0	42
CCOC(=O)[C@@H]1CN(c2nc3ccccc3[nH]2)CC12COC2	ZINC000450555954	DD	On-Demand	Anodyne	ALKBH3	42	36
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1c1ccc(O)cc1	ZINC000450555956	FF	On-Demand	Bother	SLC6A1	54	40
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CC[C@@H](C)O)C2)cc1	ZINC000450555963	DF	On-Demand	Anodyne	CCR3	92	41
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CC[C@@H](C)O)C2)cc1	ZINC000450555963	DF	On-Demand	Anodyne	BIRC2	52	40
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CC[C@H](C)O)C2)cc1	ZINC000450555969	DF	On-Demand	Anodyne	CCR3	92	41
Cc1ccc(NC(=O)NC[C@@H]2CCCN(CC[C@H](C)O)C2)cc1	ZINC000450555969	DF	On-Demand	Anodyne	BIRC2	52	40
Cc1ccc(NC(=O)NC[C@H]2CCCN(CC[C@@H](C)O)C2)cc1	ZINC000450555971	DF	On-Demand	Anodyne	CCR3	92	41
Cc1ccc(NC(=O)NC[C@H]2CCCN(CC[C@@H](C)O)C2)cc1	ZINC000450555971	DF	On-Demand	Anodyne	BIRC2	52	40
Cc1ccc(NC(=O)NC[C@H]2CCCN(CC[C@H](C)O)C2)cc1	ZINC000450555974	DF	On-Demand	Anodyne	CCR3	92	41
Cc1ccc(NC(=O)NC[C@H]2CCCN(CC[C@H](C)O)C2)cc1	ZINC000450555974	DF	On-Demand	Anodyne	BIRC2	52	40
CC[C@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450555977	BF	On-Demand	Anodyne	ACHE	0	42
CC[C@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450555977	BF	On-Demand	Anodyne	AOC3	15	42
CC[C@@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450555978	BF	On-Demand	Anodyne	ACHE	0	42
CC[C@@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450555978	BF	On-Demand	Anodyne	AOC3	15	42
CCc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)n2ncnc2n1	ZINC000450555980	FD	On-Demand	Anodyne	SLC6A1	30	41
COc1cccc(OCCC(=O)N(C)CCNC(=O)N(C)C)c1	ZINC000450555986	DD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)N(C)CCNC(=O)N(C)C)c1	ZINC000450555986	DD	On-Demand	Anodyne	MTNR1A	61	45
COc1cccc(OCCC(=O)N(C)CCNC(=O)N(C)C)c1	ZINC000450555986	DD	On-Demand	Anodyne	MTNR1B	52	40
O=C(NCc1cc(Cl)sc1Cl)c1ccc(N2CCC2)nc1	ZINC000450555989	EH	On-Demand	Anodyne	SCN2A	20	43
O=C(NCc1cc(Cl)sc1Cl)c1ccc(N2CCC2)nc1	ZINC000450555989	EH	On-Demand	Anodyne	SCN10A	33	43
COC(=O)[C@@H]1CN(c2ccc(C)c(C#N)n2)C[C@H]1c1ccc(O)cc1	ZINC000450555992	EE	On-Demand	Mild	SLC6A1	46	42
Cc1c(C(=O)N2CCCCc3cc(Br)ccc32)nn2c1OCCC2	ZINC000450555993	GH	On-Demand	Anodyne	AVPR2	24	40
COc1cc(CC(=O)NC[C@H](SC)C(C)(C)C)ccc1Cl	ZINC000450555994	EH	On-Demand	Anodyne	TRPV1	26	45
COc1cc(CC(=O)NC[C@H](SC)C(C)(C)C)ccc1Cl	ZINC000450555994	EH	On-Demand	Anodyne	NCE103	27	47
COc1cc(CC(=O)NC[C@H](SC)C(C)(C)C)ccc1Cl	ZINC000450555994	EH	On-Demand	Anodyne	CAN2	0	47
COc1cc(CC(=O)NC[C@@H](SC)C(C)(C)C)ccc1Cl	ZINC000450555995	EH	On-Demand	Anodyne	TRPV1	26	45
COc1cc(CC(=O)NC[C@@H](SC)C(C)(C)C)ccc1Cl	ZINC000450555995	EH	On-Demand	Anodyne	NCE103	27	47
COc1cc(CC(=O)NC[C@@H](SC)C(C)(C)C)ccc1Cl	ZINC000450555995	EH	On-Demand	Anodyne	CAN2	0	47
COc1cccc(Oc2ccc(C(=O)NCC[C@H]3CCO[C@H](C)C3)nc2)c1	ZINC000450555999	FH	On-Demand	Anodyne	DRD4	42	32
COc1cccc(Oc2ccc(C(=O)NCC[C@H]3CCO[C@@H](C)C3)nc2)c1	ZINC000450556001	FH	On-Demand	Anodyne	DRD4	42	32
COc1cccc(Oc2ccc(C(=O)NCC[C@@H]3CCO[C@H](C)C3)nc2)c1	ZINC000450556003	FH	On-Demand	Anodyne	DRD4	42	32
COc1cccc(Oc2ccc(C(=O)NCC[C@@H]3CCO[C@@H](C)C3)nc2)c1	ZINC000450556005	FH	On-Demand	Anodyne	DRD4	42	32
CC(=O)c1cccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	ZINC000450556009	GF	On-Demand	Anodyne	HTR1A	15	50
CC(=O)c1cccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	ZINC000450556009	GF	On-Demand	Anodyne	DRD2	21	57
CC(=O)c1cccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	ZINC000450556009	GF	On-Demand	Anodyne	DRD4	40	67
CC(=O)c1cccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	ZINC000450556009	GF	On-Demand	Anodyne	ACHE	19	41
CC(=O)c1cccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	ZINC000450556009	GF	On-Demand	Anodyne	AVPR2	41	43
CC(=O)c1cccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	ZINC000450556009	GF	On-Demand	Anodyne	SIGMAR1	17	51
CC(=O)c1cccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)c1	ZINC000450556009	GF	On-Demand	Anodyne	BDKRB1	21	40
COC(=O)[C@@H]1CN(c2cncc(SC)n2)C[C@H]1c1ccc(O)cc1	ZINC000450556012	EE	On-Demand	Anodyne	SLC6A1	52	41
COCCOC[C@H](O)CN1CCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450556014	FG	On-Demand	Anodyne	HSP90AB1	38	42
COCCOC[C@H](O)CN1CCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450556014	FG	On-Demand	Anodyne	RBP4	65	36
COCCOC[C@H](O)CN1CCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450556016	FG	On-Demand	Anodyne	HSP90AB1	38	42
COCCOC[C@H](O)CN1CCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450556016	FG	On-Demand	Anodyne	RBP4	65	36
COCCOC[C@@H](O)CN1CCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450556017	FG	On-Demand	Anodyne	HSP90AB1	38	42
COCCOC[C@@H](O)CN1CCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450556017	FG	On-Demand	Anodyne	RBP4	65	36
COCCOC[C@@H](O)CN1CCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450556018	FG	On-Demand	Anodyne	HSP90AB1	38	42
COCCOC[C@@H](O)CN1CCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450556018	FG	On-Demand	Anodyne	RBP4	65	36
CC(C)(O)C(C)(C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450556023	DE	On-Demand	Anodyne	PDEC	0	40
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	DRD2	35	47
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	DRD1	23	49
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	DRD4	25	51
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	HTR2A	36	59
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	HTR2C	26	61
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	ERG2	22	47
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	CCR3	31	41
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	CCR5	27	42
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	SLC18A3	0	48
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	HTR3B	0	47
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	CYP2J2	63	44
CCN(C1CCN(CCCC(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450556032	FF	On-Demand	Anodyne	AP2S1	0	47
CC(C)(O)C(C)(C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450556040	DE	On-Demand	Anodyne	PDEC	0	40
CC[C@@H](Nc1cc(-c2ccccc2)nc2ncnn12)C(F)F	ZINC000450556043	DG	On-Demand	Anodyne	DHOD	0	42
C[C@H](C[S@@](C)=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450556044	EF	On-Demand	Anodyne	RBP4	61	44
CC[C@H](Nc1cc(-c2ccccc2)nc2ncnn12)C(F)F	ZINC000450556045	DG	On-Demand	Anodyne	DHOD	0	42
C[C@@H](C[S@](C)=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450556046	EF	On-Demand	Anodyne	RBP4	61	44
C[C@@H](C[S@@](C)=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450556047	EF	On-Demand	Anodyne	RBP4	61	44
COc1cccc(OCCC(=O)N[C@@H](CO)c2cccc(F)c2)c1	ZINC000450556049	EE	On-Demand	Anodyne	MTNR1A	32	45
COc1cccc(OCCC(=O)N[C@@H](CO)c2cccc(F)c2)c1	ZINC000450556049	EE	On-Demand	Anodyne	MTNR1B	32	44
COc1cccc(OCCC(=O)N[C@H](CO)c2cccc(F)c2)c1	ZINC000450556051	EE	On-Demand	Anodyne	MTNR1A	32	45
COc1cccc(OCCC(=O)N[C@H](CO)c2cccc(F)c2)c1	ZINC000450556051	EE	On-Demand	Anodyne	MTNR1B	32	44
CNS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccccc1)CC2	ZINC000450556056	FF	On-Demand	Anodyne	TRY2_BOVIN	44	31
CNS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccccc1)CC2	ZINC000450556056	FF	On-Demand	Anodyne	CYP2J2	47	33
CC(C)N1CCCC[C@@H]1CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450556057	EF	On-Demand	Anodyne	MAP	0	41
CC(C)N1CCCC[C@@H]1CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450556057	EF	On-Demand	Anodyne	MAP1	99	41
O=C(C1CCN(C[C@H]2COCCO2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450556058	FE	On-Demand	Anodyne	CCR5	30	44
O=C(C1CCN(C[C@@H]2COCCO2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450556059	FE	On-Demand	Anodyne	CCR5	30	44
N#C[C@@H](c1ccccc1)N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450556065	GH	On-Demand	Mild	PTAFR	35	47
CC(C)N1CCCC[C@H]1CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450556066	EF	On-Demand	Anodyne	MAP	0	41
CC(C)N1CCCC[C@H]1CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450556066	EF	On-Demand	Anodyne	MAP1	99	41
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450556067	EF	On-Demand	Anodyne	MAP	0	41
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450556067	EF	On-Demand	Anodyne	MAP1	99	41
CC(C)N1CCCC[C@H]1CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450556069	EF	On-Demand	Anodyne	MAP	0	41
CC(C)N1CCCC[C@H]1CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450556069	EF	On-Demand	Anodyne	MAP1	99	41
N#C[C@H](c1ccccc1)N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450556080	GH	On-Demand	Mild	PTAFR	35	47
N#Cc1cccc(C(=O)NCC(=O)C2CC2)c1Br	ZINC000450556096	DE	On-Demand	Mild	FAP	0	40
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	HTR1A	30	73
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	CHRM1	15	44
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	DRD2	47	51
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	DRD4	47	47
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	ACHE	16	48
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	HTR2A	36	50
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	HTR2C	20	53
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	SLC6A1	111	39
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	DRD3	39	53
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	CHRM3	15	44
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	LTA4H	23	43
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	HTR7	55	45
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	SIGMAR1	40	53
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	CCR3	35	44
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	HTR3B	0	41
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	CCR2	20	42
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	MCHR1	25	55
O=C(CCCN1CC[C@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556101	DH	On-Demand	Anodyne	CYP2J2	67	47
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	HTR1A	30	73
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	CHRM1	15	44
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	DRD2	47	51
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	DRD4	47	47
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	ACHE	16	48
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	HTR2A	36	50
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	HTR2C	20	53
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	SLC6A1	111	39
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	DRD3	39	53
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	CHRM3	15	44
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	LTA4H	23	43
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	HTR7	55	45
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	SIGMAR1	40	53
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	CCR3	35	44
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	HTR3B	0	41
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	CCR2	20	42
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	MCHR1	25	55
O=C(CCCN1CC[C@@H](Nc2ccccc2)C1)c1ccccc1	ZINC000450556105	DH	On-Demand	Anodyne	CYP2J2	67	47
COc1ccc(C2(CNC(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CCC2)cc1	ZINC000450556111	GH	On-Demand	Bother	CACNA1C	47	39
COc1ccc(C2(CNC(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CCC2)cc1	ZINC000450556111	GH	On-Demand	Bother	CACNA1D	75	39
COc1ccc(C2(CNC(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CCC2)cc1	ZINC000450556111	GH	On-Demand	Bother	NMBR	60	42
COc1ccc(C2(CNC(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CCC2)cc1	ZINC000450556111	GH	On-Demand	Bother	MTNR1A	20	42
COc1ccc(C2(CNC(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CCC2)cc1	ZINC000450556111	GH	On-Demand	Bother	MTNR1B	17	42
COc1ccc(C2(CNC(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CCC2)cc1	ZINC000450556111	GH	On-Demand	Bother	GRPR	29	42
COc1ccc(C2(CNC(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CCC2)cc1	ZINC000450556111	GH	On-Demand	Bother	ACAT	0	46
O[C@@H](CNc1ncnc2sc3c(c12)CCC3)Cc1cccc(F)c1	ZINC000450556136	EG	On-Demand	Anodyne	RBP4	15	40
O[C@H](CNc1ncnc2sc3c(c12)CCC3)Cc1cccc(F)c1	ZINC000450556140	EG	On-Demand	Anodyne	RBP4	15	40
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	EGFR	32	41
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	DRD2	15	43
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	DRD4	39	43
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	ACHE	20	45
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	KCNH2	15	44
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	LTA4H	19	52
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	SIGMAR1	32	48
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	NPY2R	40	45
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	CCR3	70	42
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	MAPK1	36	52
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	CCR2	20	42
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	EPHX2	31	42
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	ERBB4	48	33
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	CXCR3	45	48
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	ENV	40	32
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	MCHR1	94	44
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	CACNA1G	50	43
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	CACNA1I	53	40
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	ALK	22	41
CC(=O)c1ccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1	ZINC000450556147	GJ	On-Demand	Anodyne	NOD2	40	34
CCOC(=O)c1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)nc1	ZINC000450556149	DG	On-Demand	Bother	CACNA1D	41	36
CCOC(=O)c1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)nc1	ZINC000450556149	DG	On-Demand	Bother	SLC27A4	46	34
CC(C)OC(C)(C)C(=O)Nc1nc(Cc2ccccc2)cs1	ZINC000450556158	DH	On-Demand	Anodyne	PDE5A	0	44
Cc1cc(C)cc([C@@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000450556166	GI	On-Demand	Bother	CACNA1C	59	37
Cc1cc(C)cc([C@@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000450556166	GI	On-Demand	Bother	CACNA1D	88	37
Cc1cc(C)cc([C@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000450556178	GI	On-Demand	Bother	CACNA1C	59	37
Cc1cc(C)cc([C@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000450556178	GI	On-Demand	Bother	CACNA1D	88	37
CC(C)(O)C(C)(C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450556184	CD	On-Demand	Anodyne	CAN2	0	51
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	DRD4	31	43
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	ACHE	15	42
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	P2RY12	17	48
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	CCR3	32	40
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	FAAH	32	53
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	MCHR1	26	42
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	NOD2	41	35
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	KCNK3	49	39
CC(=O)c1ccc(CN2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1	ZINC000450556194	FH	On-Demand	Anodyne	KCNK9	44	39
Cc1ccn2ncc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)c2c1	ZINC000450556202	CD	On-Demand	Anodyne	EPHB3	36	51
Cc1ccn2ncc(C(=O)N[C@H]3CCCN(C)[C@H]3C)c2c1	ZINC000450556204	CD	On-Demand	Anodyne	EPHB3	36	51
Cc1ccn2ncc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)c2c1	ZINC000450556205	CD	On-Demand	Anodyne	EPHB3	36	51
Cc1ccn2ncc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)c2c1	ZINC000450556206	CD	On-Demand	Anodyne	EPHB3	36	51
COc1ccc(C2(CNC(=O)c3ccnn3CC(F)(F)F)CCC2)cc1	ZINC000450556212	FG	On-Demand	Anodyne	ACAT	0	44
CCOc1cccc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)c1[N+](=O)[O-]	ZINC000450556214	GG	On-Demand	Bother	SLC6A1	39	41
COC[C@@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450556230	FG	On-Demand	Anodyne	CACNA1B	46	33
COC[C@@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450556230	FG	On-Demand	Anodyne	CCR2	87	44
COC[C@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450556232	FG	On-Demand	Anodyne	CACNA1B	46	33
COC[C@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450556232	FG	On-Demand	Anodyne	CCR2	87	44
COC[C@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450556233	FG	On-Demand	Anodyne	CACNA1B	46	33
COC[C@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450556233	FG	On-Demand	Anodyne	CCR2	87	44
COC[C@@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450556236	FG	On-Demand	Anodyne	CACNA1B	46	33
COC[C@@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450556236	FG	On-Demand	Anodyne	CCR2	87	44
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556239	DH	On-Demand	Anodyne	ACE	54	44
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556239	DH	On-Demand	Anodyne	MME	34	44
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556239	DH	On-Demand	Anodyne	VACHT_TETCF	0	43
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556239	DH	On-Demand	Anodyne	CCR1	28	41
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556239	DH	On-Demand	Anodyne	CCR5	39	43
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556239	DH	On-Demand	Anodyne	LIPE	15	46
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556239	DH	On-Demand	Anodyne	TPSAB1	29	43
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556241	DH	On-Demand	Anodyne	ACE	54	44
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556241	DH	On-Demand	Anodyne	MME	34	44
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556241	DH	On-Demand	Anodyne	VACHT_TETCF	0	43
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556241	DH	On-Demand	Anodyne	CCR1	28	41
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556241	DH	On-Demand	Anodyne	CCR5	39	43
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556241	DH	On-Demand	Anodyne	LIPE	15	46
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556241	DH	On-Demand	Anodyne	TPSAB1	29	43
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556243	DH	On-Demand	Anodyne	VACHT_TETCF	0	43
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556244	DH	On-Demand	Anodyne	ACE	54	44
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556244	DH	On-Demand	Anodyne	MME	34	44
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556244	DH	On-Demand	Anodyne	VACHT_TETCF	0	43
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556244	DH	On-Demand	Anodyne	CCR1	28	41
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556244	DH	On-Demand	Anodyne	CCR5	39	43
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556244	DH	On-Demand	Anodyne	LIPE	15	46
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556244	DH	On-Demand	Anodyne	TPSAB1	29	43
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1	ZINC000450556257	GE	On-Demand	Anodyne	FABI	32	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1	ZINC000450556257	GE	On-Demand	Anodyne	SIGMAR1	27	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1	ZINC000450556257	GE	On-Demand	Anodyne	PLA2G2A	25	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1	ZINC000450556257	GE	On-Demand	Anodyne	MLNR	17	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1	ZINC000450556257	GE	On-Demand	Anodyne	LSS	17	41
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1	ZINC000450556257	GE	On-Demand	Anodyne	RORC	48	36
Cc1cccc(Cl)c1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450556259	EI	On-Demand	Anodyne	CHRM2	18	45
Cc1cccc(Cl)c1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450556259	EI	On-Demand	Anodyne	GRIN2B	61	39
Cc1cccc(Cl)c1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450556259	EI	On-Demand	Anodyne	CCR3	44	45
Cc1cccc(Cl)c1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450556259	EI	On-Demand	Anodyne	CCR5	40	51
Cc1cccc(Cl)c1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450556259	EI	On-Demand	Anodyne	CHRNA7	53	42
Cc1cccc(Cl)c1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450556259	EI	On-Demand	Anodyne	C3AR1	47	40
NS(=O)(=O)C[C@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450556267	CD	On-Demand	Anodyne	SLC6A1	17	43
COc1ccc(C2(CNC(=O)c3ccsc3C)CCC2)cc1	ZINC000450556268	DH	On-Demand	Anodyne	KCNA3	58	47
COc1ccc(C2(CNC(=O)c3ccsc3C)CCC2)cc1	ZINC000450556268	DH	On-Demand	Anodyne	ACAT	0	49
NS(=O)(=O)C[C@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450556269	CD	On-Demand	Anodyne	SLC6A1	17	43
NS(=O)(=O)C[C@@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450556271	CD	On-Demand	Anodyne	SLC6A1	17	43
NS(=O)(=O)C[C@@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450556272	CD	On-Demand	Anodyne	SLC6A1	17	43
CCOC(=O)[C@@H]1CN(c2ccnc3cc(Cl)ccc23)CC12COC2	ZINC000450556286	EF	On-Demand	Anodyne	HRP1_PLAFA	92	34
CCOC(=O)[C@@H]1CN(c2ccnc3cc(Cl)ccc23)CC12COC2	ZINC000450556286	EF	On-Demand	Anodyne	HNMT	47	33
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450556288	CG	On-Demand	Anodyne	ADAM10	32	45
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450556289	CG	On-Demand	Anodyne	ADAM10	32	45
CC(C)(C)[C@H]1CCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450556294	CH	On-Demand	Anodyne	ABHD11	0	41
CC(C)(C)[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450556295	CH	On-Demand	Anodyne	ABHD11	0	41
CCOC(=O)[C@H]1CN(c2ccnc3cc(Cl)ccc23)CC12COC2	ZINC000450556297	EF	On-Demand	Anodyne	HRP1_PLAFA	92	34
CCOC(=O)[C@H]1CN(c2ccnc3cc(Cl)ccc23)CC12COC2	ZINC000450556297	EF	On-Demand	Anodyne	HNMT	47	33
Cc1ccn2ncc(C(=O)N[C@@H](C)C[S@@](C)=O)c2c1	ZINC000450556309	CD	On-Demand	Anodyne	EPHB3	35	51
Cc1ccn2ncc(C(=O)N[C@H](C)C[S@](C)=O)c2c1	ZINC000450556310	CD	On-Demand	Anodyne	EPHB3	35	51
COc1ccc(-c2nnc(SC[C@H]3CCCCC3(F)F)o2)cc1	ZINC000450556318	EJ	On-Demand	Anodyne	GSK3B	15	47
COc1ccc(-c2nnc(SC[C@H]3CCCCC3(F)F)o2)cc1	ZINC000450556318	EJ	On-Demand	Anodyne	GSK3A	27	44
Cc1ccn2ncc(C(=O)N[C@H](C)C[S@@](C)=O)c2c1	ZINC000450556320	CD	On-Demand	Anodyne	EPHB3	35	51
COc1ccc(-c2nnc(SC[C@@H]3CCCCC3(F)F)o2)cc1	ZINC000450556321	EJ	On-Demand	Anodyne	GSK3B	15	47
COc1ccc(-c2nnc(SC[C@@H]3CCCCC3(F)F)o2)cc1	ZINC000450556321	EJ	On-Demand	Anodyne	GSK3A	27	44
CCC(=O)C1(C(=O)N2CC[C@H](c3cccc(C)c3)C2)CC1	ZINC000450556322	CG	On-Demand	Anodyne	ADAM10	20	43
CCC(=O)C1(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)CC1	ZINC000450556324	CG	On-Demand	Anodyne	ADAM10	20	43
Cc1ccn2ncc(C(=O)N[C@@H](C)C[S@](C)=O)c2c1	ZINC000450556327	CD	On-Demand	Anodyne	EPHB3	35	51
Cc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ncc1C(N)=O	ZINC000450556331	GG	On-Demand	Anodyne	CACNA1B	48	36
Cc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ncc1C(N)=O	ZINC000450556331	GG	On-Demand	Anodyne	SLC9A1	48	40
Cc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ncc1C(N)=O	ZINC000450556331	GG	On-Demand	Anodyne	CCR2	44	41
Cc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ncc1C(N)=O	ZINC000450556333	GG	On-Demand	Anodyne	CACNA1B	48	36
Cc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ncc1C(N)=O	ZINC000450556333	GG	On-Demand	Anodyne	SLC9A1	48	40
Cc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ncc1C(N)=O	ZINC000450556333	GG	On-Demand	Anodyne	CCR2	44	41
C[C@@H](c1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1)C(F)(F)F	ZINC000450556345	GJ	On-Demand	Anodyne	ACHE	36	58
C[C@@H](c1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1)C(F)(F)F	ZINC000450556345	GJ	On-Demand	Anodyne	SLC6A3	16	42
C[C@@H](c1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1)C(F)(F)F	ZINC000450556345	GJ	On-Demand	Anodyne	SIGMAR1	29	40
C[C@H](c1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1)C(F)(F)F	ZINC000450556346	GJ	On-Demand	Anodyne	ACHE	36	58
C[C@H](c1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1)C(F)(F)F	ZINC000450556346	GJ	On-Demand	Anodyne	SLC6A3	16	42
C[C@H](c1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1)C(F)(F)F	ZINC000450556346	GJ	On-Demand	Anodyne	SIGMAR1	29	40
C1=C[C@H]2C[C@H]1[C@@H]1CN(c3nc(-c4ccccc4)ns3)C[C@@H]12	ZINC000450556347	CG	On-Demand	Anodyne	FAAH	15	45
CCOc1ccc(OCc2cccc(C)n2)cc1	ZINC000450556354	BG	On-Demand	Anodyne	CACNA2D1	41	37
CCOc1ccc(OCc2cccc(C)n2)cc1	ZINC000450556354	BG	On-Demand	Anodyne	CYSLTR1	23	41
COC(=O)C1(CN2CCC[C@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)CC1	ZINC000450556357	FH	On-Demand	Anodyne	PRCP	18	52
COC(=O)C1(CN2CCC[C@@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)CC1	ZINC000450556358	FH	On-Demand	Anodyne	PRCP	18	52
CN(C)S(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccccc1)CC2	ZINC000450556371	FF	On-Demand	Anodyne	CYP2J2	47	33
CCC[C@@H](O)CN1CCN(Cc2noc(C(C)(C)C)n2)CC1	ZINC000450556375	DD	On-Demand	Anodyne	ACOX1	32	40
CCC[C@H](O)CN1CCN(Cc2noc(C(C)(C)C)n2)CC1	ZINC000450556376	DD	On-Demand	Anodyne	ACOX1	32	40
C[C@H](CCNC(=O)c1ccnc(OC(F)F)c1)N1CCCCC1	ZINC000450556388	EF	On-Demand	Anodyne	CCR5	17	46
C[C@@H](CCNC(=O)c1ccnc(OC(F)F)c1)N1CCCCC1	ZINC000450556389	EF	On-Demand	Anodyne	CCR5	17	46
COC(=O)C1(CNC(=O)c2cn3nccc3nc2C)CCCCC1	ZINC000450556399	ED	On-Demand	Anodyne	DDR1	43	35
COC(=O)C1(CNC(=O)c2cn3nccc3nc2C)CCCCC1	ZINC000450556399	ED	On-Demand	Anodyne	HCN1	58	37
COC(=O)C1(CNC(=O)c2cn3nccc3nc2C)CCCCC1	ZINC000450556399	ED	On-Demand	Anodyne	HCN4	55	37
C[C@@H](CCO)CCNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450556408	DF	On-Demand	Bother	MAOB	30	51
C[C@H](CCO)CCNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450556409	DF	On-Demand	Bother	MAOB	30	51
COC(=O)C1(CNC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CCCCC1	ZINC000450556416	GF	On-Demand	Anodyne	HCN1	49	30
COC(=O)C1(CNC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CCCCC1	ZINC000450556416	GF	On-Demand	Anodyne	HCN4	47	30
CC(=O)NC1CCC(N(C)C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450556444	EF	On-Demand	Anodyne	NA	21	40
CC(=O)NC1CCC(N(C)C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450556445	EF	On-Demand	Anodyne	NA	21	40
COC(=O)c1cnc(Nc2cnn(C3CCOCC3)c2C)nc1	ZINC000450556446	DD	On-Demand	Anodyne	LRRK2	34	53
Cc1cccc(-c2cnc([C@@H]3CCCN3CC[C@@H](C)O)[nH]2)c1	ZINC000450556447	CG	On-Demand	Anodyne	PRCP	20	45
Cc1cccc(-c2cnc([C@H]3CCCN3CC[C@@H](C)O)[nH]2)c1	ZINC000450556448	CG	On-Demand	Anodyne	PRCP	20	45
Cc1cccc(-c2cnc([C@H]3CCCN3CC[C@H](C)O)[nH]2)c1	ZINC000450556449	CG	On-Demand	Anodyne	PRCP	20	45
Cc1cccc(-c2cnc([C@@H]3CCCN3CC[C@H](C)O)[nH]2)c1	ZINC000450556450	CG	On-Demand	Anodyne	PRCP	20	45
CC(=O)NC1CCC(N(C)C(=O)c2cccc3c2CCCC3)CC1	ZINC000450556459	EG	On-Demand	Anodyne	MTR1B_CHICK	0	44
CC(C)(C(=O)NCC1(CO)CCC1)c1cccc2ccccc12	ZINC000450556462	DG	On-Demand	Anodyne	KCNJ11	42	32
CC(C)(C(=O)NCC1(CO)CCC1)c1cccc2ccccc12	ZINC000450556462	DG	On-Demand	Anodyne	NMBR	54	33
CCc1cccc(C(=O)NCC[C@H](C)N2CCCCC2)n1	ZINC000450556463	CF	On-Demand	Anodyne	CCR5	0	40
CCc1cccc(C(=O)NCC[C@@H](C)N2CCCCC2)n1	ZINC000450556464	CF	On-Demand	Anodyne	CCR5	0	40
CO[C@@H](Cc1ccccc1)C(=O)N(C)C1CCC(NC(C)=O)CC1	ZINC000450556469	EE	On-Demand	Anodyne	TIMP3	42	35
CO[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(NC(C)=O)CC1	ZINC000450556470	EE	On-Demand	Anodyne	TIMP3	42	35
COc1ccc(CNC(=O)CCSc2nc3ccccc3n2C)c(OC)c1	ZINC000450556475	GG	On-Demand	Anodyne	PDGFRB	44	40
COc1ccc(CNC(=O)CCSc2nc3ccccc3n2C)c(OC)c1	ZINC000450556475	GG	On-Demand	Anodyne	MTNR1A	50	35
COc1ccc(CNC(=O)CCSc2nc3ccccc3n2C)c(OC)c1	ZINC000450556475	GG	On-Demand	Anodyne	MTNR1B	41	35
COc1ccc(CNC(=O)CCSc2nc3ccccc3n2C)c(OC)c1	ZINC000450556475	GG	On-Demand	Anodyne	CSF1R	16	40
COc1ccc(CNC(=O)CCSc2nc3ccccc3n2C)c(OC)c1	ZINC000450556475	GG	On-Demand	Anodyne	PTGDR2	15	41
Cc1ccc2ncnc(N3CCC[C@](C)(F)C3)c2c1	ZINC000450556496	CG	On-Demand	Anodyne	HTT	0	42
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	HTR1A	26	51
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	DRD2	29	42
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	DRD4	23	46
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	HTR2A	28	47
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	HTR2C	25	50
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	SLC6A1	41	33
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	DRD3	23	45
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	HTR7	52	57
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	SLC18A3	0	42
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	HTR3B	0	41
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1	ZINC000450556497	FF	On-Demand	Anodyne	CYP2J2	63	45
Cc1ccc2ncnc(N3CCC[C@@](C)(F)C3)c2c1	ZINC000450556498	CG	On-Demand	Anodyne	HTT	0	42
CC(C)(C)S(=O)(=O)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)cn1	ZINC000450556503	FF	On-Demand	Anodyne	GRIN1	0	43
CC(C)(C)S(=O)(=O)c1ccc(NC[C@H](O)Cc2cccc(F)c2)cn1	ZINC000450556505	FF	On-Demand	Anodyne	GRIN1	0	43
Cc1cc(NCCCC2CCOCC2)nc(-c2ccccn2)n1	ZINC000450556511	DF	On-Demand	Anodyne	METAP1	22	40
O=C(CN1CCN(CC/C=C/c2ccccc2)CC1)N1CCCc2ccccc21	ZINC000450556513	GH	On-Demand	Anodyne	DRD2	16	53
O=C(CN1CCN(CC/C=C/c2ccccc2)CC1)N1CCCc2ccccc21	ZINC000450556513	GH	On-Demand	Anodyne	DRD4	22	62
O=C(CN1CCN(CC/C=C/c2ccccc2)CC1)N1CCCc2ccccc21	ZINC000450556513	GH	On-Demand	Anodyne	AVPR2	34	41
O=C(CN1CCN(CC/C=C\c2ccccc2)CC1)N1CCCc2ccccc21	ZINC000450556515	GH	On-Demand	Anodyne	DRD2	16	53
O=C(CN1CCN(CC/C=C\c2ccccc2)CC1)N1CCCc2ccccc21	ZINC000450556515	GH	On-Demand	Anodyne	DRD4	22	62
O=C(CN1CCN(CC/C=C\c2ccccc2)CC1)N1CCCc2ccccc21	ZINC000450556515	GH	On-Demand	Anodyne	AVPR2	34	41
COc1ccc(-c2nnc(SCC3(C)CCC3)o2)cc1	ZINC000450556516	CI	On-Demand	Anodyne	GSK3B	18	54
COc1ccc(-c2nnc(SCC3(C)CCC3)o2)cc1	ZINC000450556516	CI	On-Demand	Anodyne	GSK3A	42	49
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(Br)cc1	ZINC000450556518	GI	On-Demand	Anodyne	SLC6A1	40	35
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(Br)cc1	ZINC000450556518	GI	On-Demand	Anodyne	CYP2J2	49	35
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2cccc(O)c2)c(OC)c1	ZINC000450556532	FG	On-Demand	Anodyne	MTNR1A	43	41
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2cccc(O)c2)c(OC)c1	ZINC000450556533	FG	On-Demand	Anodyne	MTNR1A	43	41
COC(=O)c1coc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)n1	ZINC000450556535	GG	On-Demand	Anodyne	EGFR	25	40
COC(=O)c1coc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)n1	ZINC000450556535	GG	On-Demand	Anodyne	ERBB4	46	32
COC(=O)c1coc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)n1	ZINC000450556535	GG	On-Demand	Anodyne	MCHR1	45	38
COC(=O)c1coc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)n1	ZINC000450556535	GG	On-Demand	Anodyne	CACNA1G	23	44
C=CC(C)(C)C(=O)NCCCc1ccc(Br)cc1OC	ZINC000450556540	EH	On-Demand	Mild	MTNR1B	19	42
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	CHRM2	15	43
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	DRD2	18	46
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	DRD4	45	40
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	ACHE	47	50
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	DRD3	0	42
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	HRH3	17	51
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	SIGMAR1	73	49
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	CCR5	54	44
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	LSS	16	44
CCS(=O)(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000450556544	GH	On-Demand	Anodyne	RORC	29	41
COc1ccc(-c2ccnc(NCCC(C)(F)F)n2)cc1	ZINC000450556545	CH	On-Demand	Anodyne	DYRK1A	15	61
COc1ccc(-c2ccnc(NCCC(C)(F)F)n2)cc1	ZINC000450556545	CH	On-Demand	Anodyne	ZAP70	21	40
COc1ccc(-c2ccnc(NCCC(C)(F)F)n2)cc1	ZINC000450556545	CH	On-Demand	Anodyne	CLK1	21	58
COc1ccc(-c2ccnc(NCCC(C)(F)F)n2)cc1	ZINC000450556545	CH	On-Demand	Anodyne	CLK4	33	58
COc1ccc(-c2ccnc(NCCC(C)(F)F)n2)cc1	ZINC000450556545	CH	On-Demand	Anodyne	DYRK1B	18	61
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(Br)cc1	ZINC000450556551	GI	On-Demand	Anodyne	SLC6A1	40	35
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(Br)cc1	ZINC000450556551	GI	On-Demand	Anodyne	CYP2J2	49	35
O=C(Nc1nccs1)[C@H]1CCCN1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450556554	DE	On-Demand	Anodyne	MAP1	58	38
N#C[C@@H](c1ccccc1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450556555	DE	On-Demand	Mild	PTAFR	30	43
C[C@@H](Nc1ccc(S(C)(=O)=O)cc1F)c1cccc(C2CC2)c1	ZINC000450556558	EI	On-Demand	Anodyne	TRPV1	43	35
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450556560	DE	On-Demand	Anodyne	MAP1	58	38
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)c1cccc(C2CC2)c1	ZINC000450556562	EI	On-Demand	Anodyne	TRPV1	43	35
N#Cc1ccnc(N[C@H]2CCCc3c(F)cc(F)cc32)c1	ZINC000450556563	CH	On-Demand	Mild	MAP3K12	45	32
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450556564	DE	On-Demand	Anodyne	MAP1	58	38
Cn1c(=O)c2cc(C(=O)NCCCNc3cccc(F)c3)sc2n(C)c1=O	ZINC000450556565	GD	On-Demand	Anodyne	TBK1	16	40
N#Cc1ccnc(N[C@@H]2CCCc3c(F)cc(F)cc32)c1	ZINC000450556566	CH	On-Demand	Mild	MAP3K12	45	32
O=C(Nc1nccs1)[C@H]1CCCN1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450556568	DE	On-Demand	Anodyne	MAP1	58	38
N#C[C@H](c1ccccc1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450556570	DE	On-Demand	Mild	PTAFR	30	43
N#C[C@H](c1ccccc1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450556575	DE	On-Demand	Mild	PTAFR	30	43
CCC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556577	EE	On-Demand	Anodyne	CA2	60	63
CCC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556577	EE	On-Demand	Anodyne	CA1	54	63
CCC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556577	EE	On-Demand	Anodyne	CA7	39	48
CCC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556577	EE	On-Demand	Anodyne	CA4	68	63
CCC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556577	EE	On-Demand	Anodyne	CA5A	41	34
CCC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556577	EE	On-Demand	Anodyne	CA12	22	47
CCC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556577	EE	On-Demand	Anodyne	P96878_MYCTU	40	35
N#C[C@@H](c1ccccc1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450556578	DE	On-Demand	Mild	PTAFR	30	43
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc4cnccc4c3)C2)c1	ZINC000450556582	EI	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc4cnccc4c3)C2)c1	ZINC000450556582	EI	On-Demand	Anodyne	L3MBTL3	68	43
CCC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556584	EE	On-Demand	Anodyne	CA2	60	63
CCC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556584	EE	On-Demand	Anodyne	CA1	54	63
CCC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556584	EE	On-Demand	Anodyne	CA7	39	48
CCC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556584	EE	On-Demand	Anodyne	CA4	68	63
CCC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556584	EE	On-Demand	Anodyne	CA5A	41	34
CCC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556584	EE	On-Demand	Anodyne	CA12	22	47
CCC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450556584	EE	On-Demand	Anodyne	P96878_MYCTU	40	35
CC[C@@H](Nc1cc(COC)nc2ncnn12)C(F)F	ZINC000450556585	CD	On-Demand	Anodyne	DHOD	0	44
CC[C@H](Nc1cc(COC)nc2ncnn12)C(F)F	ZINC000450556593	CD	On-Demand	Anodyne	DHOD	0	44
C[C@H](O)CCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450556596	EF	On-Demand	Anodyne	SLC6A1	49	32
C[C@H](O)CCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450556596	EF	On-Demand	Anodyne	SIGMAR1	45	39
C[C@H](O)CCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450556596	EF	On-Demand	Anodyne	CCR5	91	48
C[C@H](O)CCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450556596	EF	On-Demand	Anodyne	CYP2J2	45	32
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc4cnccc4c3)C2)c1	ZINC000450556599	EI	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc4cnccc4c3)C2)c1	ZINC000450556599	EI	On-Demand	Anodyne	L3MBTL3	68	43
C[C@@H](O)CCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450556607	EF	On-Demand	Anodyne	SLC6A1	49	32
C[C@@H](O)CCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450556607	EF	On-Demand	Anodyne	SIGMAR1	45	39
C[C@@H](O)CCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450556607	EF	On-Demand	Anodyne	CCR5	91	48
C[C@@H](O)CCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450556607	EF	On-Demand	Anodyne	CYP2J2	45	32
Cc1ccc(F)c(CC(=O)NCCC(=O)NCc2ccccn2)c1	ZINC000450556608	ED	On-Demand	Anodyne	P2RX7	34	41
Cc1ccc(F)c(CC(=O)NCCC(=O)NCc2ccccn2)c1	ZINC000450556608	ED	On-Demand	Anodyne	SUCNR1	44	33
O=C(NCCCNc1ccccc1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450556611	FG	On-Demand	Anodyne	F2	53	38
O=C(NCCCNc1ccccc1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450556611	FG	On-Demand	Anodyne	FKBP1A	28	41
O=C(NCCCNc1ccccc1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450556611	FG	On-Demand	Anodyne	TRY1_BOVIN	66	37
O=C(NCCCNc1ccccc1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450556611	FG	On-Demand	Anodyne	DPP4	15	47
O=C(NCCCNc1ccccc1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450556611	FG	On-Demand	Anodyne	PREP	72	43
O=C(NCCCNc1ccccc1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450556611	FG	On-Demand	Anodyne	XIAP	30	40
O=C(NCCCNc1ccccc1F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450556611	FG	On-Demand	Anodyne	TMPRSS11D	55	35
COc1cc(Br)ccc1CCCNC(=O)CC1CC(F)(F)C1	ZINC000450556615	GH	On-Demand	Anodyne	MTNR1B	24	42
CCc1cc(NCCCC(C)(F)F)n2ncnc2n1	ZINC000450556627	CF	On-Demand	Anodyne	DHOD	0	60
CC(F)(F)CCCNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450556636	DF	On-Demand	Anodyne	PRCP	0	43
COc1ccc(C2(CNC(=O)c3cn(CC4CC4)nn3)CCC2)cc1	ZINC000450556640	EF	On-Demand	Anodyne	ACAT	0	44
COc1ccc(C2(CNC(=O)c3cn(CC4CC4)nn3)CCC2)cc1	ZINC000450556640	EF	On-Demand	Anodyne	HCN4	40	31
CC(F)(F)CCCNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450556641	DF	On-Demand	Anodyne	PRCP	0	43
c1ccc(-c2nccc(N3CCN(CCc4cscn4)CC3)n2)cc1	ZINC000450556685	FF	On-Demand	Anodyne	DRD4	24	40
C/C=C\COc1cccc(CC(=O)NCCCn2ccnn2)c1	ZINC000450556703	DD	On-Demand	Anodyne	HRH2	47	36
O=C(CCc1nc2cnccc2[nH]1)NCCCNc1ccccc1F	ZINC000450556707	EF	On-Demand	Anodyne	CYSP_TRYCR	0	45
C/C=C/COc1cccc(CC(=O)NCCCn2ccnn2)c1	ZINC000450556708	DD	On-Demand	Anodyne	HRH2	47	36
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450556714	EF	On-Demand	Anodyne	MAP1	118	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450556714	EF	On-Demand	Anodyne	POL	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450556723	EF	On-Demand	Anodyne	MAP1	118	39
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450556723	EF	On-Demand	Anodyne	POL	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450556726	EF	On-Demand	Anodyne	MAP1	118	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450556726	EF	On-Demand	Anodyne	POL	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450556733	EF	On-Demand	Anodyne	MAP1	118	39
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450556733	EF	On-Demand	Anodyne	POL	0	42
N#C[C@@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556747	EH	On-Demand	Mild	HTR1A	19	47
N#C[C@@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556747	EH	On-Demand	Mild	DRD4	21	46
N#C[C@@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556747	EH	On-Demand	Mild	HTR2A	21	46
N#C[C@@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556747	EH	On-Demand	Mild	DRD3	22	46
N#C[C@@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556747	EH	On-Demand	Mild	PTAFR	51	50
N#C[C@@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556747	EH	On-Demand	Mild	HTR7	25	46
N#C[C@@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556747	EH	On-Demand	Mild	ABCB1	0	46
N#C[C@@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556747	EH	On-Demand	Mild	CYP2J2	59	42
N#C[C@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556754	EH	On-Demand	Mild	HTR1A	19	47
N#C[C@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556754	EH	On-Demand	Mild	DRD4	21	46
N#C[C@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556754	EH	On-Demand	Mild	HTR2A	21	46
N#C[C@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556754	EH	On-Demand	Mild	DRD3	22	46
N#C[C@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556754	EH	On-Demand	Mild	PTAFR	51	50
N#C[C@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556754	EH	On-Demand	Mild	HTR7	25	46
N#C[C@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556754	EH	On-Demand	Mild	ABCB1	0	46
N#C[C@H](c1ccccc1)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450556754	EH	On-Demand	Mild	CYP2J2	59	42
CC(C)c1nnc(Cn2cnc3sc4c(c3c2=O)CC[C@H](C)C4)s1	ZINC000450556755	FH	On-Demand	Anodyne	HTR1B	16	40
CC(C)c1nnc(Cn2cnc3sc4c(c3c2=O)CC[C@@H](C)C4)s1	ZINC000450556766	FH	On-Demand	Anodyne	HTR1B	16	40
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	HTR1A	15	62
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	DRD2	36	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	DRD1	23	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	DRD4	27	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	ADRA1D	15	41
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	HTR2A	38	53
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	HTR2C	23	61
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	HRH1	16	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	ADRA1B	15	46
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	DRD5	15	48
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	ERG2	23	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	HTR7	17	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	SIGMAR1	25	56
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	CCR3	42	44
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	SLC18A3	0	51
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	EBP	15	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	HTR3B	0	49
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	MCHR1	15	52
CN1CCN(C(=O)CC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450556774	GF	On-Demand	Anodyne	CYP2J2	61	44
CCCOc1ccc(C(=O)Nc2c(C)cccc2O)c(OC)c1	ZINC000450556783	DH	On-Demand	Anodyne	LUCI_LUCLA	16	46
CCCOc1ccc(C(=O)Nc2c(C)cccc2O)c(OC)c1	ZINC000450556783	DH	On-Demand	Anodyne	KCNK3	47	41
CCCOc1ccc(C(=O)Nc2c(C)cccc2O)c(OC)c1	ZINC000450556783	DH	On-Demand	Anodyne	KCNK9	40	41
COC[C@@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450556796	CD	On-Demand	Anodyne	CPG2	0	40
CCOC(=O)[C@@H](C)N(C)CCCC(=O)c1ccc(F)cc1	ZINC000450556807	CF	On-Demand	Anodyne	THRA	68	39
CCCc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)no1	ZINC000450556809	FG	On-Demand	Anodyne	EPHX2	20	40
CCOC(=O)[C@H](C)N(C)CCCC(=O)c1ccc(F)cc1	ZINC000450556813	CF	On-Demand	Anodyne	THRA	68	39
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	MME	46	38
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	FCER2	45	33
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	CYSP_TRYCR	41	31
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	CAPNS1	45	32
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	CAPN1	44	38
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	CAPN2	64	37
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	FPR1	40	37
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	AMP1_PLAFQ	47	39
CO[C@@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556817	CD	On-Demand	Anodyne	NPFFR1	50	34
Cc1ccc(C(=O)N[C@@H](CO)c2c(F)cccc2F)c(C)n1	ZINC000450556821	DE	On-Demand	Anodyne	UTS2	40	30
COC(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1Cl	ZINC000450556822	EG	On-Demand	Anodyne	ABCB1	23	52
COC(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1Cl	ZINC000450556822	EG	On-Demand	Anodyne	SLC6A5	27	46
COC(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1Cl	ZINC000450556822	EG	On-Demand	Anodyne	ABCG2	39	47
COC(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1Cl	ZINC000450556822	EG	On-Demand	Anodyne	NOD1	33	44
COC(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1Cl	ZINC000450556822	EG	On-Demand	Anodyne	NOD2	50	44
C[C@H](C1CCC1)N(C)C(=O)c1ccc(N2CCC2)nc1	ZINC000450556824	CF	On-Demand	Anodyne	HPGDS	15	42
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	MME	46	38
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	FCER2	45	33
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	CYSP_TRYCR	41	31
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	CAPNS1	45	32
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	CAPN1	44	38
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	CAPN2	64	37
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	FPR1	40	37
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	AMP1_PLAFQ	47	39
CO[C@H](Cc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450556827	CD	On-Demand	Anodyne	NPFFR1	50	34
C[C@@H](C1CCC1)N(C)C(=O)c1ccc(N2CCC2)nc1	ZINC000450556829	CF	On-Demand	Anodyne	HPGDS	15	42
Cc1ccc(C(=O)N[C@H](CO)c2c(F)cccc2F)c(C)n1	ZINC000450556830	DE	On-Demand	Anodyne	UTS2	40	30
CC(C)c1ncsc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450556833	GI	On-Demand	Anodyne	FLT1	19	41
CC(C)c1ncsc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450556833	GI	On-Demand	Anodyne	EPHX2	27	40
c1ccc(-c2nccc(N3CCN(Cc4cnns4)CC3)n2)cc1	ZINC000450556836	EE	On-Demand	Anodyne	SORD	44	36
O=C(Cc1cc2ccccc2s1)N1CCC[C@H]1c1ncc[nH]1	ZINC000450556848	DH	On-Demand	Anodyne	COLA	110	39
O=C(Cc1cc2ccccc2s1)N1CCC[C@H]1c1ncc[nH]1	ZINC000450556848	DH	On-Demand	Anodyne	CPT1A	94	37
CCOC(=O)COc1ccc(NC(=O)CCCn2nc(C)nc2C)cc1	ZINC000450556853	FE	On-Demand	Anodyne	ADORA1	16	40
CCOC(=O)COc1ccc(NC(=O)CCCn2nc(C)nc2C)cc1	ZINC000450556853	FE	On-Demand	Anodyne	ADORA2B	50	39
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	HTR1A	26	48
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	DRD2	33	47
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	DRD1	0	42
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	DRD4	61	46
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	HTR2A	22	46
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	HTR2C	24	40
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	DRD3	52	46
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	ACOX1	48	32
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	CYP2D6	25	52
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	PLD2	62	36
CCC[C@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556854	ED	On-Demand	Anodyne	AP2S1	0	41
O=C(Cc1cc2ccccc2s1)N1CCC[C@@H]1c1ncc[nH]1	ZINC000450556856	DH	On-Demand	Anodyne	COLA	110	39
O=C(Cc1cc2ccccc2s1)N1CCC[C@@H]1c1ncc[nH]1	ZINC000450556856	DH	On-Demand	Anodyne	CPT1A	94	37
O=C(CCCN1CCNC(=O)[C@@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556857	EF	On-Demand	Anodyne	DRD2	34	48
O=C(CCCN1CCNC(=O)[C@@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556857	EF	On-Demand	Anodyne	DRD4	0	54
O=C(CCCN1CCNC(=O)[C@@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556857	EF	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCNC(=O)[C@@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556857	EF	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCNC(=O)[C@@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556857	EF	On-Demand	Anodyne	CYP2J2	53	38
COc1cc(CC(=O)NC(C)(C)C(C)(C)O)ccc1Cl	ZINC000450556860	CF	On-Demand	Anodyne	TRPV1	35	46
COc1cc(CC(=O)NC(C)(C)C(C)(C)O)ccc1Cl	ZINC000450556860	CF	On-Demand	Anodyne	NCE103	30	48
COc1cc(CC(=O)NC(C)(C)C(C)(C)O)ccc1Cl	ZINC000450556860	CF	On-Demand	Anodyne	CAN2	0	48
O=C(CCCN1CCNC(=O)[C@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556861	EF	On-Demand	Anodyne	DRD2	34	48
O=C(CCCN1CCNC(=O)[C@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556861	EF	On-Demand	Anodyne	DRD4	0	54
O=C(CCCN1CCNC(=O)[C@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556861	EF	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCNC(=O)[C@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556861	EF	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCNC(=O)[C@H]1c1ccccc1)c1ccc(F)cc1	ZINC000450556861	EF	On-Demand	Anodyne	CYP2J2	53	38
CC(C)(C(=O)Nc1cc(S(N)(=O)=O)ccc1O)C1CCC1	ZINC000450556865	DD	On-Demand	Anodyne	CA2	62	42
CC(C)(C(=O)Nc1cc(S(N)(=O)=O)ccc1O)C1CCC1	ZINC000450556865	DD	On-Demand	Anodyne	CA1	54	40
CC(C)(C(=O)Nc1cc(S(N)(=O)=O)ccc1O)C1CCC1	ZINC000450556865	DD	On-Demand	Anodyne	CA7	47	41
CC(C)(C(=O)Nc1cc(S(N)(=O)=O)ccc1O)C1CCC1	ZINC000450556865	DD	On-Demand	Anodyne	CA4	64	42
CC(C)(C(=O)Nc1cc(S(N)(=O)=O)ccc1O)C1CCC1	ZINC000450556865	DD	On-Demand	Anodyne	CA5A	40	34
CC(C)(C(=O)Nc1cc(S(N)(=O)=O)ccc1O)C1CCC1	ZINC000450556865	DD	On-Demand	Anodyne	CA12	34	41
CC(C)(C(=O)Nc1cc(S(N)(=O)=O)ccc1O)C1CCC1	ZINC000450556865	DD	On-Demand	Anodyne	P96878_MYCTU	46	33
COC(=O)c1cccc(CN2CCN(Cc3cccc(O)c3)CC2)c1Cl	ZINC000450556866	FG	On-Demand	Anodyne	DRD4	40	31
COC(=O)c1cccc(CN2CCN(Cc3cccc(O)c3)CC2)c1Cl	ZINC000450556866	FG	On-Demand	Anodyne	SIGMAR1	29	40
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	HTR1A	26	48
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	DRD2	33	47
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	DRD1	0	42
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	DRD4	61	46
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	HTR2A	22	46
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	HTR2C	24	40
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	DRD3	52	46
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	ACOX1	48	32
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	CYP2D6	25	52
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	PLD2	62	36
CCC[C@@H](O)CN1CCN(CCNC(=O)c2ccc(OC)cc2)CC1	ZINC000450556870	ED	On-Demand	Anodyne	AP2S1	0	41
COC(=O)c1coc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450556873	EF	On-Demand	Anodyne	DRD2	0	44
COC(=O)c1coc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450556873	EF	On-Demand	Anodyne	DRD4	37	40
COC(=O)c1coc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450556873	EF	On-Demand	Anodyne	ACHE	39	42
COC(=O)c1coc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450556873	EF	On-Demand	Anodyne	DRD3	32	40
COC(=O)c1coc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450556873	EF	On-Demand	Anodyne	SIGMAR1	63	44
COC(=O)c1coc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450556873	EF	On-Demand	Anodyne	SSTR5	42	35
COC(=O)c1coc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450556873	EF	On-Demand	Anodyne	MCHR1	39	42
COC(=O)c1coc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450556873	EF	On-Demand	Anodyne	CACNA1G	24	43
CCCN(CC(=O)Nc1ccc(Cl)cc1)Cc1nc(-c2cc(C)ccn2)no1	ZINC000450556878	GH	On-Demand	Anodyne	TSPO	15	41
COc1ccc(CNC(=O)CCN[C@@]2(CO)C[C@@H](C)CC(C)(C)C2)c(OC)c1	ZINC000450556890	GF	On-Demand	Anodyne	MTNR1A	41	34
CSc1ccc2ncnc(N3CCC[C@](C)(F)C3)c2c1	ZINC000450556893	CH	On-Demand	Anodyne	HTT	0	43
CS[C@@H](CNC(=O)c1ccc2cnccc2c1)C(C)(C)C	ZINC000450556894	DH	On-Demand	Anodyne	AKT1	0	43
CSc1ccc2ncnc(N3CCC[C@@](C)(F)C3)c2c1	ZINC000450556902	CH	On-Demand	Anodyne	HTT	0	43
CS[C@H](CNC(=O)c1ccc2cnccc2c1)C(C)(C)C	ZINC000450556903	DH	On-Demand	Anodyne	AKT1	0	43
COc1ccc(CNC(=O)CCN[C@]2(CO)C[C@@H](C)CC(C)(C)C2)c(OC)c1	ZINC000450556906	GF	On-Demand	Anodyne	MTNR1A	41	34
CCC(=O)CCCN1CCN(CCNS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450556909	GD	On-Demand	Anodyne	HTR2A	24	53
CCC(=O)CCCN1CCN(CCNS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450556909	GD	On-Demand	Anodyne	HTR7	41	53
CCC(=O)CCCN1CCN(CCNS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450556909	GD	On-Demand	Anodyne	CCR1	17	54
COCCOC[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450556910	ED	On-Demand	Anodyne	ADRB3	34	41
COCCOC[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450556910	ED	On-Demand	Anodyne	MLNR	29	40
COCCOC[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450556910	ED	On-Demand	Anodyne	HSP90AB1	38	45
COCCOC[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450556910	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	46
COc1ccc(CNC(=O)CCN[C@]2(CO)C[C@H](C)CC(C)(C)C2)c(OC)c1	ZINC000450556914	GF	On-Demand	Anodyne	MTNR1A	41	34
COc1ccc(CNC(=O)CCN[C@@]2(CO)C[C@H](C)CC(C)(C)C2)c(OC)c1	ZINC000450556920	GF	On-Demand	Anodyne	MTNR1A	41	34
CCCN(CC[C@H](C)O)C1CCN(c2cc(C)nc(C)n2)CC1	ZINC000450556923	DF	On-Demand	Anodyne	SORD	15	40
COCCOC[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450556924	ED	On-Demand	Anodyne	ADRB3	34	41
COCCOC[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450556924	ED	On-Demand	Anodyne	MLNR	29	40
COCCOC[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450556924	ED	On-Demand	Anodyne	HSP90AB1	38	45
COCCOC[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450556924	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	46
CC(C)(C)C(=O)Nc1ccc(C(=O)NCCCNc2cccc(F)c2)cn1	ZINC000450556927	FG	On-Demand	Anodyne	TBK1	18	41
CCCN(CC[C@@H](C)O)C1CCN(c2cc(C)nc(C)n2)CC1	ZINC000450556928	DF	On-Demand	Anodyne	SORD	15	40
COC(=O)c1coc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)n1	ZINC000450556929	GF	On-Demand	Anodyne	CCR3	59	47
c1ccc2nc(N3CCN(Cc4nnc(C5CC5)s4)CC3)ccc2c1	ZINC000450556933	FG	On-Demand	Anodyne	HTR3A	34	49
c1ccc2nc(N3CCN(Cc4nnc(C5CC5)s4)CC3)ccc2c1	ZINC000450556933	FG	On-Demand	Anodyne	SORD	20	44
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450556934	GH	On-Demand	Anodyne	HTR1A	0	40
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450556934	GH	On-Demand	Anodyne	HTR1D	36	40
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450556934	GH	On-Demand	Anodyne	HTR1B	27	40
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450556934	GH	On-Demand	Anodyne	MPO	81	40
CC1(O)CC(C(=O)NCCCNc2cccc(F)c2)C1	ZINC000450556937	CD	On-Demand	Anodyne	TBK1	68	51
COC(=O)c1coc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)n1	ZINC000450556938	GF	On-Demand	Anodyne	CCR3	59	47
O[C@H](Cc1ccccc1)CN1CCN(Cc2nnnn2-c2ccccc2)CC1	ZINC000450556949	GD	On-Demand	Anodyne	VACHT_TETCF	0	50
COC(=O)[C@@H]1CN(c2c(Cl)cccc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450556950	FG	On-Demand	Mild	SLC6A1	79	47
COC(=O)[C@@H]1CN(c2cc(C)ccn2)C[C@H]1c1ccc(O)cc1	ZINC000450556957	DE	On-Demand	Anodyne	SLC6A3	28	40
COCCOC[C@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556963	GF	On-Demand	Anodyne	COLA	39	45
COCCOC[C@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556963	GF	On-Demand	Anodyne	CPT1A	34	45
COCCOC[C@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556963	GF	On-Demand	Anodyne	GRM5	23	45
COCCOC[C@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556985	GF	On-Demand	Anodyne	COLA	39	45
COCCOC[C@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556985	GF	On-Demand	Anodyne	CPT1A	34	45
COCCOC[C@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556985	GF	On-Demand	Anodyne	GRM5	23	45
COCCOC[C@@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556990	GF	On-Demand	Anodyne	COLA	39	45
COCCOC[C@@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556990	GF	On-Demand	Anodyne	CPT1A	34	45
COCCOC[C@@H](O)CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450556990	GF	On-Demand	Anodyne	GRM5	23	45
O=C(CN1CCN(CC2=CCCCC2)CC1)N1CCCc2ccccc21	ZINC000450556996	FG	On-Demand	Anodyne	DRD4	28	58
O=C(CN1CCN(CC2=CCCCC2)CC1)N1CCCc2ccccc21	ZINC000450556996	FG	On-Demand	Anodyne	AVPR2	34	41
COCCOC[C@@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450557000	GF	On-Demand	Anodyne	COLA	39	45
COCCOC[C@@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450557000	GF	On-Demand	Anodyne	CPT1A	34	45
COCCOC[C@@H](O)CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000450557000	GF	On-Demand	Anodyne	GRM5	23	45
COc1cc2c(NCCC(C)(F)F)ccnc2cc1F	ZINC000450557003	CH	On-Demand	Anodyne	HRP1_PLAFA	82	35
COc1cc2c(NCCC(C)(F)F)ccnc2cc1F	ZINC000450557003	CH	On-Demand	Anodyne	FGFR2	49	43
COc1cc2c(NCCC(C)(F)F)ccnc2cc1F	ZINC000450557003	CH	On-Demand	Anodyne	FLT1	17	44
COc1cc2c(NCCC(C)(F)F)ccnc2cc1F	ZINC000450557003	CH	On-Demand	Anodyne	HNMT	48	34
COc1cc2c(NCCC(C)(F)F)ccnc2cc1F	ZINC000450557003	CH	On-Demand	Anodyne	PDGFRA	46	38
CC1(C(=O)NCC2(c3ccc(Cl)cc3Cl)CCC2)CCC(=O)CC1	ZINC000450557017	FJ	On-Demand	Anodyne	SLC6A9	40	34
CCOC(=O)COc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1	ZINC000450557023	EE	On-Demand	Anodyne	NOD2	34	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450557028	EG	On-Demand	Anodyne	DRD2	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450557028	EG	On-Demand	Anodyne	DRD4	38	44
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450557028	EG	On-Demand	Anodyne	DRD3	22	44
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450557028	EG	On-Demand	Anodyne	SSTR5	57	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450557028	EG	On-Demand	Anodyne	CCR3	30	42
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450557028	EG	On-Demand	Anodyne	MLNR	40	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450557028	EG	On-Demand	Anodyne	MCHR1	26	44
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCCC1	ZINC000450557031	EF	On-Demand	Mild	CA2	48	36
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCCC1	ZINC000450557031	EF	On-Demand	Mild	CA1	45	36
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCCC1	ZINC000450557031	EF	On-Demand	Mild	CA7	41	34
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCCC1	ZINC000450557031	EF	On-Demand	Mild	CA5B	51	34
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCCC1	ZINC000450557031	EF	On-Demand	Mild	CA4	55	36
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCCC1	ZINC000450557031	EF	On-Demand	Mild	CA5A	54	34
O=C([C@H]1CC12CCSCC2)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557034	FJ	On-Demand	Anodyne	CCR2	47	47
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450557035	EG	On-Demand	Anodyne	DRD2	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450557035	EG	On-Demand	Anodyne	DRD4	38	44
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450557035	EG	On-Demand	Anodyne	DRD3	22	44
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450557035	EG	On-Demand	Anodyne	SSTR5	57	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450557035	EG	On-Demand	Anodyne	CCR3	30	42
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450557035	EG	On-Demand	Anodyne	MLNR	40	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000450557035	EG	On-Demand	Anodyne	MCHR1	26	44
COC(=O)[C@@H]1CN(c2nc(C)nc(C)c2C)C[C@H]1c1ccc(O)cc1	ZINC000450557039	EF	On-Demand	Anodyne	SLC6A1	77	46
COC(=O)c1csc(CN2CCc3[nH]c4ccccc4c3C2)n1	ZINC000450557049	EF	On-Demand	Anodyne	HTR5A	19	48
O=C([C@H]1CC12CCSCC2)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557058	FJ	On-Demand	Anodyne	CCR2	47	47
Cc1nnc2c3ccccc3c(N3CCC[C@](C)(F)C3)nn12	ZINC000450557061	CF	On-Demand	Anodyne	CREBBP	44	35
Cc1nnc2c3ccccc3c(N3CCC[C@](C)(F)C3)nn12	ZINC000450557061	CF	On-Demand	Anodyne	BRD9	56	35
O=C([C@@H]1CC12CCSCC2)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557062	FJ	On-Demand	Anodyne	CCR2	47	47
O=C([C@@H]1CC12CCSCC2)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557063	FJ	On-Demand	Anodyne	CCR2	47	47
Cc1nnc2c3ccccc3c(N3CCC[C@@](C)(F)C3)nn12	ZINC000450557066	CF	On-Demand	Anodyne	CREBBP	44	35
Cc1nnc2c3ccccc3c(N3CCC[C@@](C)(F)C3)nn12	ZINC000450557066	CF	On-Demand	Anodyne	BRD9	56	35
COc1nccc(CN(c2cccc(C)c2)C(C)C)n1	ZINC000450557071	CG	On-Demand	Anodyne	TAAR1	23	43
CC(=O)c1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)cc1	ZINC000450557072	FE	On-Demand	Anodyne	DRD4	34	47
CC(=O)c1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)cc1	ZINC000450557072	FE	On-Demand	Anodyne	ACHE	38	50
CC(=O)c1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)cc1	ZINC000450557072	FE	On-Demand	Anodyne	HRH3	19	49
CC(=O)c1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)cc1	ZINC000450557072	FE	On-Demand	Anodyne	SIGMAR1	45	52
CC(=O)c1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)cc1	ZINC000450557072	FE	On-Demand	Anodyne	CCR3	28	40
CC(=O)c1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)cc1	ZINC000450557072	FE	On-Demand	Anodyne	MCHR1	30	42
CC(=O)c1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)cc1	ZINC000450557072	FE	On-Demand	Anodyne	CACNA1I	40	40
COc1cc(CN(C)CC(=O)NCc2ccccc2)ccc1Cl	ZINC000450557073	EG	On-Demand	Anodyne	ACHE	0	42
COc1cc(CN(C)CC(=O)NCc2ccccc2)ccc1Cl	ZINC000450557073	EG	On-Demand	Anodyne	TRPV1	24	46
COc1cc(CN(C)CC(=O)NCc2ccccc2)ccc1Cl	ZINC000450557073	EG	On-Demand	Anodyne	HCRTR2	30	48
COc1cc(CN(C)CC(=O)NCc2ccccc2)ccc1Cl	ZINC000450557073	EG	On-Demand	Anodyne	U38	0	43
COc1cc(CN(C)CC(=O)NCc2ccccc2)ccc1Cl	ZINC000450557073	EG	On-Demand	Anodyne	CAN2	0	45
COc1cc(CN(C)CC(=O)NCc2ccccc2)ccc1Cl	ZINC000450557073	EG	On-Demand	Anodyne	PDS	41	39
C[C@H](c1ccccc1)[C@@H](O)CN(C)CC(=O)Nc1cc(F)cc(F)c1	ZINC000450557077	EF	On-Demand	Anodyne	SLC6A9	23	46
C[C@H](c1ccccc1)[C@H](O)CN(C)CC(=O)Nc1cc(F)cc(F)c1	ZINC000450557083	EF	On-Demand	Anodyne	SLC6A9	23	46
C[C@@H](c1ccccc1)[C@H](O)CN(C)CC(=O)Nc1cc(F)cc(F)c1	ZINC000450557088	EF	On-Demand	Anodyne	SLC6A9	23	46
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CC(=O)Nc1cc(F)cc(F)c1	ZINC000450557092	EF	On-Demand	Anodyne	SLC6A9	23	46
O=C(C1CC1)C1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450557098	FH	On-Demand	Anodyne	CACNA1B	41	35
O=C(C1CC1)C1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450557098	FH	On-Demand	Anodyne	CCR2	56	38
O=C(C1CC1)C1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450557105	FH	On-Demand	Anodyne	CACNA1B	41	35
O=C(C1CC1)C1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450557105	FH	On-Demand	Anodyne	CCR2	56	38
Cc1cccc([C@H]2CCN(C(=O)c3cn(CC(C)C)nc3C(F)F)C2)c1	ZINC000450557115	FI	On-Demand	Anodyne	TPSAB1	36	42
Cc1cccc([C@@H]2CCN(C(=O)c3cn(CC(C)C)nc3C(F)F)C2)c1	ZINC000450557120	FI	On-Demand	Anodyne	TPSAB1	36	42
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)Cc1cn(CC2CC2)nn1	ZINC000450557122	GH	On-Demand	Anodyne	RBP4	51	31
CO[C@@H](Cc1ccccc1)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450557130	EI	On-Demand	Anodyne	CDC7	40	35
CO[C@H](Cc1ccccc1)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450557133	EI	On-Demand	Anodyne	CDC7	40	35
CCc1cc(CCCSc2nnc(-c3ccc(OC)cc3)o2)on1	ZINC000450557134	EI	On-Demand	Anodyne	GSK3A	28	46
O=C(NCCc1c[nH]c2ccc(Br)cc12)C1(CF)CCOCC1	ZINC000450557149	GG	On-Demand	Anodyne	HTR1A	0	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)C1(CF)CCOCC1	ZINC000450557149	GG	On-Demand	Anodyne	HTR1D	28	40
O=C(NCCc1c[nH]c2ccc(Br)cc12)C1(CF)CCOCC1	ZINC000450557149	GG	On-Demand	Anodyne	MPO	75	40
O=C(NCCc1c[nH]c2ccc(Br)cc12)C1(CF)CCOCC1	ZINC000450557149	GG	On-Demand	Anodyne	ABCG2	25	41
C[C@H](CN1CCC(C(=O)Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450557156	ED	On-Demand	Anodyne	CCR3	37	42
C[C@H](CN1CCC(C(=O)Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450557156	ED	On-Demand	Anodyne	EPHX2	30	41
C[C@H](CN1CCC(C(=O)Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450557156	ED	On-Demand	Anodyne	CACNA1G	34	40
CC[C@]1(C)COCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450557160	CE	On-Demand	Anodyne	TIMP3	40	32
CC[C@]1(C)COCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450557160	CE	On-Demand	Anodyne	PSMB8	52	36
COc1cc(Br)ccc1CCCNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450557161	GH	On-Demand	Anodyne	MTNR1B	16	45
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450557162	ED	On-Demand	Anodyne	CCR3	37	42
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450557162	ED	On-Demand	Anodyne	EPHX2	30	41
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450557162	ED	On-Demand	Anodyne	CACNA1G	34	40
CC[C@]1(C)COCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450557165	CE	On-Demand	Anodyne	TIMP3	40	32
CC[C@]1(C)COCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450557165	CE	On-Demand	Anodyne	PSMB8	52	36
CC[C@@]1(C)COCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450557170	CE	On-Demand	Anodyne	TIMP3	40	32
CC[C@@]1(C)COCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450557170	CE	On-Demand	Anodyne	PSMB8	52	36
C[C@H](C[S@@](C)=O)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450557171	EE	On-Demand	Anodyne	PRCP	16	41
C[C@@H](C[S@@](C)=O)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450557175	EE	On-Demand	Anodyne	PRCP	16	41
CC[C@@]1(C)COCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450557176	CE	On-Demand	Anodyne	TIMP3	40	32
CC[C@@]1(C)COCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450557176	CE	On-Demand	Anodyne	PSMB8	52	36
C[C@@H](C[S@](C)=O)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450557177	EE	On-Demand	Anodyne	PRCP	16	41
COc1cc(CC(=O)N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)ccc1Cl	ZINC000450557215	GH	On-Demand	Anodyne	CCR1	34	41
COc1cc(CC(=O)N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)ccc1Cl	ZINC000450557217	GH	On-Demand	Anodyne	CCR1	34	41
COc1cc(CC(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)ccc1Cl	ZINC000450557219	GH	On-Demand	Anodyne	CCR1	34	41
COc1cc(CC(=O)N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)ccc1Cl	ZINC000450557221	GH	On-Demand	Anodyne	CCR1	34	41
COC(=O)[C@@H]1CN(c2nc3ccccc3s2)C[C@H]1c1ccc(O)cc1	ZINC000450557233	FG	On-Demand	Anodyne	SLC6A1	66	44
COC(=O)[C@@H]1CN(c2ccc(F)cc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450557234	FF	On-Demand	Bother	SLC6A1	42	40
COC(=O)[C@@H]1CN(c2cc(OC)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450557243	ED	On-Demand	Anodyne	SLC6A1	89	44
COC(=O)[C@@H]1CN(c2cc(OC)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450557243	ED	On-Demand	Anodyne	SLC6A3	28	41
CCOCc1nc(C)c(C(=O)Nc2sc(-c3ccccc3)nc2C)s1	ZINC000450557250	FJ	On-Demand	Anodyne	SCD1	17	40
COC(=O)[C@@H]1CN(c2ccc(F)cn2)C[C@H]1c1ccc(O)cc1	ZINC000450557253	DE	On-Demand	Anodyne	SLC6A1	73	43
COC(=O)[C@@H]1CN(c2ccc(F)cn2)C[C@H]1c1ccc(O)cc1	ZINC000450557253	DE	On-Demand	Anodyne	SLC6A3	27	41
CCc1cc(CC)nc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)n1	ZINC000450557254	FF	On-Demand	Anodyne	SLC6A1	94	45
COC(=O)[C@@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450557259	GD	On-Demand	Bother	TAAR1	17	40
COc1cccc([C@@H]2C[C@H]2C(=O)NCCc2ccc(F)c(F)c2F)c1	ZINC000450557268	EH	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@@H]2C[C@H]2C(=O)NCCc2ccc(F)c(F)c2F)c1	ZINC000450557268	EH	On-Demand	Anodyne	NQO2	33	42
COc1cccc([C@@H]2C[C@H]2C(=O)NCCc2ccc(F)c(F)c2F)c1	ZINC000450557268	EH	On-Demand	Anodyne	MTNR1A	83	44
COc1cccc([C@@H]2C[C@H]2C(=O)NCCc2ccc(F)c(F)c2F)c1	ZINC000450557268	EH	On-Demand	Anodyne	MTNR1B	67	38
Cc1cc(Nc2cnn(C3CCOCC3)c2C)c([N+](=O)[O-])cc1C(F)(F)F	ZINC000450557283	GJ	On-Demand	Bother	LRRK2	16	53
Cc1cc(C(F)(F)F)nc(Nc2cnn(C3CCOCC3)c2C)n1	ZINC000450557288	EG	On-Demand	Anodyne	LRRK2	38	61
CCOC(=O)c1cc(C(=O)NCC2(CO)CCC2)on1	ZINC000450557297	CC	On-Demand	Anodyne	HCN1	41	31
CCOC(=O)c1cc(C(=O)NCC2(CO)CCC2)on1	ZINC000450557297	CC	On-Demand	Anodyne	HCN4	41	31
CCCn1c(SCC2(C#N)CCC2)nnc1-c1ccc(Cl)cc1	ZINC000450557303	EJ	On-Demand	Mild	HSD11B1	17	40
Cc1nn(C)cc1CC(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450557304	CD	On-Demand	Anodyne	CCR5	39	40
Cc1nn(C)cc1CC(=O)NCC[C@H](C)N1CCCCC1	ZINC000450557305	CD	On-Demand	Anodyne	CCR5	39	40
C=CCOc1ccc(CC(=O)N(C)C2CCC(NC(C)=O)CC2)cc1	ZINC000450557313	EF	On-Demand	Mild	CCR5	15	40
CCc1cc(NCC[C@H](C)CCO)n2ncnc2n1	ZINC000450557324	CD	On-Demand	Anodyne	DHOD	0	52
CCc1cc(NCC[C@@H](C)CCO)n2ncnc2n1	ZINC000450557325	CD	On-Demand	Anodyne	DHOD	0	52
Cc1nn(C)cc1CSc1nc2ccccc2n1C	ZINC000450557326	CF	On-Demand	Anodyne	PTGDR2	16	44
COc1cccc2c(NCC[C@@H](C)CCO)c(C)cnc12	ZINC000450557379	CG	On-Demand	Anodyne	ATP4A	23	43
COc1cccc2c(NCC[C@H](C)CCO)c(C)cnc12	ZINC000450557380	CG	On-Demand	Anodyne	ATP4A	23	43
COc1cc(CC(=O)N[C@H]2CCCN(c3cccnc3)C2=O)ccc1Cl	ZINC000450557383	FF	On-Demand	Anodyne	HTR4	45	36
COc1cc(CC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)ccc1Cl	ZINC000450557384	FF	On-Demand	Anodyne	HTR4	45	36
O=C(c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450557385	GF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450557385	GF	On-Demand	Bother	L3MBTL3	26	43
COc1cc(CC(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)ccc1O	ZINC000450557388	GF	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)ccc1O	ZINC000450557388	GF	On-Demand	Anodyne	ENPP1	55	33
CCS(=O)(=O)N(C)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450557398	FD	On-Demand	Anodyne	CCR5	52	40
CCS(=O)(=O)N(C)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450557399	FD	On-Demand	Anodyne	CCR5	52	40
CCS(=O)(=O)N(C)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450557400	FD	On-Demand	Anodyne	CCR5	52	40
CCS(=O)(=O)N(C)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450557401	FD	On-Demand	Anodyne	CCR5	52	40
CC(=O)c1cccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c1	ZINC000450557405	FE	On-Demand	Anodyne	DRD2	18	48
CC(=O)c1cccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c1	ZINC000450557405	FE	On-Demand	Anodyne	DRD4	37	48
CC(=O)c1cccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c1	ZINC000450557405	FE	On-Demand	Anodyne	ACHE	46	45
CC(=O)c1cccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c1	ZINC000450557405	FE	On-Demand	Anodyne	CHRM3	22	43
CC(=O)c1cccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c1	ZINC000450557405	FE	On-Demand	Anodyne	SIGMAR1	46	43
CC(=O)c1cccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c1	ZINC000450557405	FE	On-Demand	Anodyne	CCR3	49	42
CC(=O)c1cccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c1	ZINC000450557405	FE	On-Demand	Anodyne	MCHR1	28	40
CC(=O)c1cccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c1	ZINC000450557405	FE	On-Demand	Anodyne	MGLL	0	45
CCOC(=O)[C@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450557410	CE	On-Demand	Anodyne	ALOX5	23	40
CCOC(=O)[C@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450557410	CE	On-Demand	Anodyne	ACHE	26	46
CCOC(=O)[C@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450557410	CE	On-Demand	Anodyne	CTSB	43	34
CCOC(=O)[C@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450557410	CE	On-Demand	Anodyne	PAPA1_CARPA	42	33
CCOC(=O)[C@@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450557411	CE	On-Demand	Anodyne	ALOX5	23	40
CCOC(=O)[C@@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450557411	CE	On-Demand	Anodyne	ACHE	26	46
CCOC(=O)[C@@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450557411	CE	On-Demand	Anodyne	CTSB	43	34
CCOC(=O)[C@@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450557411	CE	On-Demand	Anodyne	PAPA1_CARPA	42	33
CC(C)NC(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450557425	EG	On-Demand	Bother	TAAR1	18	43
COC(=O)c1coc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)n1	ZINC000450557430	GD	On-Demand	Anodyne	DRD4	21	47
Cc1cnc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450557431	CF	On-Demand	Bother	PRKCQ	44	38
O=S(=O)(c1ccc(NCCCC2CCOCC2)nc1)N1CCCCC1	ZINC000450557436	FE	On-Demand	Anodyne	MERTK	32	42
CCOC(=O)COc1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1	ZINC000450557452	EF	On-Demand	Anodyne	EPHX2	28	55
O=C1NCCN(C(=O)Cc2ccc(O)c(F)c2)[C@H]1Cc1ccccc1	ZINC000450557461	ED	On-Demand	Anodyne	BRS3	24	40
O=C1NCCN(C(=O)Cc2ccc(O)c(F)c2)[C@@H]1Cc1ccccc1	ZINC000450557463	ED	On-Demand	Anodyne	BRS3	24	40
COc1cc(CC(=O)NCCCNc2cccc(F)c2)ccc1Cl	ZINC000450557464	FH	On-Demand	Anodyne	TRPV1	25	47
COc1cc(CC(=O)NCCCNc2cccc(F)c2)ccc1Cl	ZINC000450557464	FH	On-Demand	Anodyne	TBK1	16	44
COc1cc(CC(=O)NCCCNc2cccc(F)c2)ccc1Cl	ZINC000450557464	FH	On-Demand	Anodyne	NCE103	26	47
COc1cc(CC(=O)NCCCNc2cccc(F)c2)ccc1Cl	ZINC000450557464	FH	On-Demand	Anodyne	P96878_MYCTU	19	47
COc1cc(CC(=O)NCCCNc2cccc(F)c2)ccc1Cl	ZINC000450557464	FH	On-Demand	Anodyne	CAN2	0	47
Cc1cc(C(F)(F)F)ccc1C(=O)NCC(=O)C1CC1	ZINC000450557473	CF	On-Demand	Anodyne	LIPC	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCC(=O)C1CC1	ZINC000450557473	CF	On-Demand	Anodyne	PPARD	25	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCC(=O)C1CC1	ZINC000450557473	CF	On-Demand	Anodyne	CCR2	87	47
Cc1cc(C(F)(F)F)ccc1C(=O)NCC(=O)C1CC1	ZINC000450557473	CF	On-Demand	Anodyne	LIPG	44	40
COC(=O)C1(CN(C)C2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000450557478	EE	On-Demand	Anodyne	CCR5	26	40
COC(=O)C1(CN(C)C2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000450557478	EE	On-Demand	Anodyne	L3MBTL3	61	41
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cn(CCc4ccccc4)nn3)C2)c1	ZINC000450557500	FH	On-Demand	Anodyne	THYX_PBCV1	0	43
COc1ccccc1-n1cnc2cc(C(=O)N[C@]3(C)CCO[C@H]3C)ccc21	ZINC000450557508	FG	On-Demand	Anodyne	PLK1	42	35
COc1ccccc1-n1cnc2cc(C(=O)N[C@]3(C)CCO[C@H]3C)ccc21	ZINC000450557508	FG	On-Demand	Anodyne	HPGD	44	55
COc1ccccc1-n1cnc2cc(C(=O)N[C@@]3(C)CCO[C@H]3C)ccc21	ZINC000450557509	FG	On-Demand	Anodyne	PLK1	42	35
COc1ccccc1-n1cnc2cc(C(=O)N[C@@]3(C)CCO[C@H]3C)ccc21	ZINC000450557509	FG	On-Demand	Anodyne	HPGD	44	55
COc1ccccc1-n1cnc2cc(C(=O)N[C@]3(C)CCO[C@@H]3C)ccc21	ZINC000450557510	FG	On-Demand	Anodyne	PLK1	42	35
COc1ccccc1-n1cnc2cc(C(=O)N[C@]3(C)CCO[C@@H]3C)ccc21	ZINC000450557510	FG	On-Demand	Anodyne	HPGD	44	55
COc1ccccc1-n1cnc2cc(C(=O)N[C@@]3(C)CCO[C@@H]3C)ccc21	ZINC000450557511	FG	On-Demand	Anodyne	PLK1	42	35
COc1ccccc1-n1cnc2cc(C(=O)N[C@@]3(C)CCO[C@@H]3C)ccc21	ZINC000450557511	FG	On-Demand	Anodyne	HPGD	44	55
O=C(c1ccc(Oc2ccc(C(=O)N3CC(F)C3)cc2)cc1)N1CC(F)C1	ZINC000450557512	FG	On-Demand	Anodyne	PLAU	18	43
O=C(c1ccc(Oc2ccc(C(=O)N3CC(F)C3)cc2)cc1)N1CC(F)C1	ZINC000450557512	FG	On-Demand	Anodyne	ST14	24	43
O=C(c1ccc(Oc2ccc(C(=O)N3CC(F)C3)cc2)cc1)N1CC(F)C1	ZINC000450557512	FG	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc(Oc2ccc(C(=O)N3CC(F)C3)cc2)cc1)N1CC(F)C1	ZINC000450557512	FG	On-Demand	Anodyne	L3MBTL3	47	41
O=C(c1ccc(Oc2ccc(C(=O)N3CC(F)C3)cc2)cc1)N1CC(F)C1	ZINC000450557512	FG	On-Demand	Anodyne	SLC6A7	0	44
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cn(CCc4ccccc4)nn3)C2)c1	ZINC000450557517	FH	On-Demand	Anodyne	THYX_PBCV1	0	43
CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450557520	GG	On-Demand	Anodyne	CACNA1B	41	34
CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450557520	GG	On-Demand	Anodyne	CCR2	51	40
CCOC(=O)c1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450557523	GG	On-Demand	Anodyne	CACNA1B	41	34
CCOC(=O)c1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450557523	GG	On-Demand	Anodyne	CCR2	51	40
O=C(NCC[C@H]1CCOC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450557526	EG	On-Demand	Anodyne	RBP4	59	38
C[C@@H](C[S@@](C)=O)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450557533	DE	On-Demand	Anodyne	ROCK2	27	40
CCn1c(SCC(=O)c2ccc(C(=O)OC)o2)nnc1-c1cccs1	ZINC000450557545	GG	On-Demand	Anodyne	SLC27A1	38	40
O=C(c1cccc(O)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450557548	EG	On-Demand	Anodyne	DRD2	25	47
O=C(c1cccc(O)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450557548	EG	On-Demand	Anodyne	DRD4	43	39
O=C(c1cccc(O)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450557548	EG	On-Demand	Anodyne	FABI	46	37
O=C(c1cccc(O)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450557548	EG	On-Demand	Anodyne	HRH3	0	41
O=C(c1cccc(O)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450557548	EG	On-Demand	Anodyne	SIGMAR1	22	40
O=C(c1cccc(O)c1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450557548	EG	On-Demand	Anodyne	KCNJ1	81	35
C[C@H](C[S@@](C)=O)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450557550	DE	On-Demand	Anodyne	ROCK2	27	40
C[C@@H](C[S@](C)=O)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450557552	DE	On-Demand	Anodyne	ROCK2	27	40
C[C@H](C[S@](C)=O)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450557554	DE	On-Demand	Anodyne	ROCK2	27	40
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCC2CCOCC2)C1=O	ZINC000450557555	EE	On-Demand	Bother	SLC27A4	54	36
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCC2CCOCC2)C1=O	ZINC000450557557	EE	On-Demand	Bother	SLC27A4	54	36
Cn1nc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c2c1CCCC2	ZINC000450557580	GH	On-Demand	Anodyne	CACNA1B	42	36
Cn1nc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c2c1CCCC2	ZINC000450557580	GH	On-Demand	Anodyne	SLC9A1	41	37
Cn1nc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c2c1CCCC2	ZINC000450557580	GH	On-Demand	Anodyne	CCR2	47	40
Cn1nc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c2c1CCCC2	ZINC000450557580	GH	On-Demand	Anodyne	RBP4	21	42
Cn1nc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c2c1CCCC2	ZINC000450557582	GH	On-Demand	Anodyne	CACNA1B	42	36
Cn1nc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c2c1CCCC2	ZINC000450557582	GH	On-Demand	Anodyne	SLC9A1	41	37
Cn1nc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c2c1CCCC2	ZINC000450557582	GH	On-Demand	Anodyne	CCR2	47	40
Cn1nc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c2c1CCCC2	ZINC000450557582	GH	On-Demand	Anodyne	RBP4	21	42
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	HTR1A	16	46
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	HTR1D	34	46
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	HTR1B	28	46
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	CCR3	44	37
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	PRNP	40	36
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	HDAC1	22	42
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	TAAR1	34	43
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	HT1	0	41
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	DDR1	41	32
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	DGAT1	40	41
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	HPGDS	36	44
CC1CCN(CCc2cccc(NC(=O)c3ccc(N4CCC4)nc3)c2)CC1	ZINC000450557593	GH	On-Demand	Anodyne	LMGT2	0	41
CC(C)O[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450557594	GG	On-Demand	Anodyne	HTR1D	22	40
CC(C)O[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450557594	GG	On-Demand	Anodyne	HTR1B	19	40
CC(C)O[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450557594	GG	On-Demand	Anodyne	ABCG2	25	41
CC(C)O[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450557595	GG	On-Demand	Anodyne	HTR1D	22	40
CC(C)O[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450557595	GG	On-Demand	Anodyne	HTR1B	19	40
CC(C)O[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450557595	GG	On-Demand	Anodyne	ABCG2	25	41
Cc1ccc(C(=O)Nc2ccc3c(C)[nH]nc3c2)c(C(C)C)n1	ZINC000450557598	DH	On-Demand	Anodyne	NR2E3	61	36
CC(C)OC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557599	FH	On-Demand	Anodyne	HTR1A	0	46
CC(C)OC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557599	FH	On-Demand	Anodyne	HTR1D	39	40
CC(C)OC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557599	FH	On-Demand	Anodyne	HTR1B	33	44
CC(C)OC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557599	FH	On-Demand	Anodyne	MPO	63	39
CC(C)OC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557599	FH	On-Demand	Anodyne	CCKBR	16	40
CC(C)OC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557599	FH	On-Demand	Anodyne	ABCG2	26	43
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1CC12CCSCC2	ZINC000450557602	GI	On-Demand	Anodyne	MPO	53	35
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	DRD4	24	41
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	ACHE	15	43
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	SIGMAR1	15	47
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	CCR1	0	40
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	CCR3	186	59
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	MLNR	64	42
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	CYP2D6	24	59
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	CCR2	15	41
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	CXCR3	18	41
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	MCHR1	39	42
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557608	GI	On-Demand	Anodyne	CACNA1I	50	36
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	DRD4	24	41
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	ACHE	15	43
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	SIGMAR1	15	47
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	CCR1	0	40
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	CCR3	186	59
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	MLNR	64	42
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	CYP2D6	24	59
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	CCR2	15	41
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	CXCR3	18	41
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	MCHR1	39	42
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000450557610	GI	On-Demand	Anodyne	CACNA1I	50	36
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H]1CC12CCSCC2	ZINC000450557619	GI	On-Demand	Anodyne	MPO	53	35
CC(C)(C)[C@@H]1CCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450557621	FG	On-Demand	Anodyne	ABHD11	0	40
CC(C)(C)[C@@H]1CCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450557644	FG	On-Demand	Anodyne	ABHD11	0	40
Clc1ccc(CCN2CCCC[C@H]2c2cn[nH]c2)cc1	ZINC000450557646	CH	On-Demand	Anodyne	HRH3	19	40
Clc1ccc(CCN2CCCC[C@H]2c2cn[nH]c2)cc1	ZINC000450557646	CH	On-Demand	Anodyne	SPHK2	15	41
Clc1ccc(CCN2CCCC[C@H]2c2cn[nH]c2)cc1	ZINC000450557646	CH	On-Demand	Anodyne	SPHK1	18	41
Clc1ccc(CCN2CCCC[C@@H]2c2cn[nH]c2)cc1	ZINC000450557647	CH	On-Demand	Anodyne	HRH3	19	40
Clc1ccc(CCN2CCCC[C@@H]2c2cn[nH]c2)cc1	ZINC000450557647	CH	On-Demand	Anodyne	SPHK2	15	41
Clc1ccc(CCN2CCCC[C@@H]2c2cn[nH]c2)cc1	ZINC000450557647	CH	On-Demand	Anodyne	SPHK1	18	41
CC(C)(C)[C@H]1CCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450557648	FG	On-Demand	Anodyne	ABHD11	0	40
CC(C)(C)[C@H]1CCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450557651	FG	On-Demand	Anodyne	ABHD11	0	40
c1ccc(CCn2ccc(CN3CCN4CCCC[C@H]4C3)n2)cc1	ZINC000450557653	DF	On-Demand	Anodyne	SIGMAR1	22	49
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450557654	GF	On-Demand	Anodyne	ACE	49	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450557654	GF	On-Demand	Anodyne	MME	39	42
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450557654	GF	On-Demand	Anodyne	BIRC2	51	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450557654	GF	On-Demand	Anodyne	PSMB8	40	36
c1ccc(CCn2ccc(CN3CCN4CCCC[C@@H]4C3)n2)cc1	ZINC000450557655	DF	On-Demand	Anodyne	SIGMAR1	22	49
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@@H]2CCC[C@@H](C)C2)CC1	ZINC000450557656	GF	On-Demand	Anodyne	ACE	49	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@@H]2CCC[C@@H](C)C2)CC1	ZINC000450557656	GF	On-Demand	Anodyne	MME	39	42
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@@H]2CCC[C@@H](C)C2)CC1	ZINC000450557656	GF	On-Demand	Anodyne	BIRC2	51	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@@H]2CCC[C@@H](C)C2)CC1	ZINC000450557656	GF	On-Demand	Anodyne	PSMB8	40	36
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@H]2CCC[C@H](C)C2)CC1	ZINC000450557659	GF	On-Demand	Anodyne	ACE	49	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@H]2CCC[C@H](C)C2)CC1	ZINC000450557659	GF	On-Demand	Anodyne	MME	39	42
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@H]2CCC[C@H](C)C2)CC1	ZINC000450557659	GF	On-Demand	Anodyne	BIRC2	51	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@H]2CCC[C@H](C)C2)CC1	ZINC000450557659	GF	On-Demand	Anodyne	PSMB8	40	36
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@@H]2CCC[C@H](C)C2)CC1	ZINC000450557660	GF	On-Demand	Anodyne	ACE	49	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@@H]2CCC[C@H](C)C2)CC1	ZINC000450557660	GF	On-Demand	Anodyne	MME	39	42
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@@H]2CCC[C@H](C)C2)CC1	ZINC000450557660	GF	On-Demand	Anodyne	BIRC2	51	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)N[C@@H]2CCC[C@H](C)C2)CC1	ZINC000450557660	GF	On-Demand	Anodyne	PSMB8	40	36
CS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c(C(F)(F)F)c1	ZINC000450557662	FG	On-Demand	Anodyne	HSD11B1	21	40
c1cnc2[nH]cc(C3CCN(CCc4cscn4)CC3)c2c1	ZINC000450557664	DG	On-Demand	Anodyne	CCR2	21	43
Cc1nc(C2CC2)ccc1C(=O)NCCCNc1cccc(F)c1	ZINC000450557671	EH	On-Demand	Anodyne	TBK1	36	45
O=C(c1cncc(Cl)c1)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450557675	FJ	On-Demand	Anodyne	GRM5	17	42
COc1cccc([C@H]2C[C@H](C)CN2C(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450557692	FH	On-Demand	Anodyne	TRPV1	0	40
COc1cccc([C@H]2C[C@H](C)CN2C(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450557692	FH	On-Demand	Anodyne	RORC	44	43
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450557693	FH	On-Demand	Anodyne	TRPV1	0	40
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450557693	FH	On-Demand	Anodyne	RORC	44	43
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450557694	FH	On-Demand	Anodyne	TRPV1	0	40
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450557694	FH	On-Demand	Anodyne	RORC	44	43
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450557696	FH	On-Demand	Anodyne	TRPV1	0	40
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)Cc2ccc(O)c(OC)c2)c1	ZINC000450557696	FH	On-Demand	Anodyne	RORC	44	43
C[C@H](Nc1ncc(C(F)F)cn1)c1cccc(C2CC2)c1	ZINC000450557698	CI	On-Demand	Anodyne	NTRK1	15	41
C[C@@H](Nc1ncc(C(F)F)cn1)c1cccc(C2CC2)c1	ZINC000450557699	CI	On-Demand	Anodyne	NTRK1	15	41
O=C(c1cncc(Cl)c1)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450557702	FJ	On-Demand	Anodyne	GRM5	17	42
COC(=O)c1coc(CN2CCC(Nc3cccc(C)c3)CC2)n1	ZINC000450557704	EF	On-Demand	Anodyne	PTPN2	42	33
COC(=O)c1coc(CN2CCC(Nc3cccc(C)c3)CC2)n1	ZINC000450557704	EF	On-Demand	Anodyne	SSTR5	64	38
COc1ccc(C2(CNC(=O)c3c(Br)cnn3C)CCC2)cc1	ZINC000450557711	GG	On-Demand	Anodyne	KCNA3	43	36
COc1ccc(C2(CNC(=O)c3c(Br)cnn3C)CCC2)cc1	ZINC000450557711	GG	On-Demand	Anodyne	MTNR1A	19	42
COc1ccc(C2(CNC(=O)c3c(Br)cnn3C)CCC2)cc1	ZINC000450557711	GG	On-Demand	Anodyne	ACAT	0	48
C[C@@H](c1csnn1)N1CCc2[nH]c3ccccc3c2C1	ZINC000450557715	CG	On-Demand	Anodyne	DRD5	18	43
C[C@H](c1csnn1)N1CCc2[nH]c3ccccc3c2C1	ZINC000450557716	CG	On-Demand	Anodyne	DRD5	18	43
COC(=O)C1CCC(NC(=O)c2ccc3cnccc3c2)(C(=O)OC)CC1	ZINC000450557718	FE	On-Demand	Anodyne	AKT1	20	41
CCOc1ccc(OCc2nnc(C(C)C)s2)cc1	ZINC000450557719	CH	On-Demand	Anodyne	CACNA2D1	49	39
c1cnc2[nH]cc(C3CCN(Cc4nnc(C5CC5)s4)CC3)c2c1	ZINC000450557720	EH	On-Demand	Anodyne	CCR2	0	43
O=C(CC1CC(F)(F)C1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557737	EI	On-Demand	Anodyne	CACNA1B	47	35
O=C(CC1CC(F)(F)C1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557737	EI	On-Demand	Anodyne	CCR2	75	47
O=C(CC1CC(F)(F)C1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557737	EI	On-Demand	Anodyne	RBP4	22	42
O=C(CC1CC(F)(F)C1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557737	EI	On-Demand	Anodyne	LIPG	49	34
O=C(CC1CC(F)(F)C1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557741	EI	On-Demand	Anodyne	CACNA1B	47	35
O=C(CC1CC(F)(F)C1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557741	EI	On-Demand	Anodyne	CCR2	75	47
O=C(CC1CC(F)(F)C1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557741	EI	On-Demand	Anodyne	RBP4	22	42
O=C(CC1CC(F)(F)C1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557741	EI	On-Demand	Anodyne	LIPG	49	34
COC(=O)c1coc(CN2CCCC[C@H]2c2cc3ccccc3[nH]2)n1	ZINC000450557752	EH	On-Demand	Anodyne	COLA	45	36
COC(=O)c1coc(CN2CCCC[C@H]2c2cc3ccccc3[nH]2)n1	ZINC000450557752	EH	On-Demand	Anodyne	CPT1A	44	36
COC(=O)c1coc(CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)n1	ZINC000450557756	EH	On-Demand	Anodyne	COLA	45	36
COC(=O)c1coc(CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)n1	ZINC000450557756	EH	On-Demand	Anodyne	CPT1A	44	36
Cc1nc(-c2c(C)noc2C)sc1C(=O)NCCCNc1cccc(F)c1	ZINC000450557758	GI	On-Demand	Anodyne	TBK1	18	41
COCCOC[C@H](O)CN(Cc1ccc2c(c1)OCO2)c1ccc(F)cc1	ZINC000450557765	GF	On-Demand	Anodyne	BMP1	58	37
COc1ccc(Oc2ccc(C(=O)N(C)[C@@H](C)C[S@](C)=O)nc2)cc1	ZINC000450557771	FF	On-Demand	Anodyne	NPY5R	19	40
COc1ccc(Oc2ccc(C(=O)N(C)[C@H](C)C[S@](C)=O)nc2)cc1	ZINC000450557776	FF	On-Demand	Anodyne	NPY5R	19	40
COc1ccc(Oc2ccc(C(=O)N(C)[C@H](C)C[S@@](C)=O)nc2)cc1	ZINC000450557781	FF	On-Demand	Anodyne	NPY5R	19	40
COCCOC[C@@H](O)CN(Cc1ccc2c(c1)OCO2)c1ccc(F)cc1	ZINC000450557784	GF	On-Demand	Anodyne	BMP1	58	37
COc1ccc(Oc2ccc(C(=O)N(C)[C@@H](C)C[S@@](C)=O)nc2)cc1	ZINC000450557786	FF	On-Demand	Anodyne	NPY5R	19	40
CC[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(F)F	ZINC000450557828	DE	On-Demand	Bother	BDKRB1	0	40
CC[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(F)F	ZINC000450557831	DE	On-Demand	Bother	BDKRB1	0	40
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA2	92	45
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA1	75	45
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA7	51	39
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA5B	42	33
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA4	82	45
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA5A	48	33
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA14	34	40
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA12	38	40
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CA9	43	39
CCC(CC)Oc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)cc1	ZINC000450557840	GF	On-Demand	Anodyne	CYNT	25	41
CCOC(=O)COc1ccc(NC(=O)C(C)(C)C(C)(F)F)cc1	ZINC000450557855	EG	On-Demand	Anodyne	S1PR4	30	40
CCOC(=O)COc1ccc(NC(=O)C(C)(C)C(C)(F)F)cc1	ZINC000450557855	EG	On-Demand	Anodyne	EPHX2	29	54
CCOC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)nc1	ZINC000450557872	FD	On-Demand	Anodyne	P2RY12	45	41
CC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450557913	EF	On-Demand	Bother	SIGMAR1	22	42
CC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450557913	EF	On-Demand	Bother	SSTR5	40	37
CC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450557913	EF	On-Demand	Bother	MLNR	46	32
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450557914	EF	On-Demand	Bother	SIGMAR1	22	42
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450557914	EF	On-Demand	Bother	SSTR5	40	37
CC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450557914	EF	On-Demand	Bother	MLNR	46	32
COc1ccc(C2(CNC(=O)C[C@H]3CCOC[C@H]3OC)CCC2)cc1	ZINC000450557931	EF	On-Demand	Anodyne	MTNR1A	24	43
COc1ccc(C2(CNC(=O)C[C@H]3CCOC[C@H]3OC)CCC2)cc1	ZINC000450557931	EF	On-Demand	Anodyne	ACAT	0	45
COc1ccc(C2(CNC(=O)C[C@@H]3CCOC[C@H]3OC)CCC2)cc1	ZINC000450557934	EF	On-Demand	Anodyne	MTNR1A	24	43
COc1ccc(C2(CNC(=O)C[C@@H]3CCOC[C@H]3OC)CCC2)cc1	ZINC000450557934	EF	On-Demand	Anodyne	ACAT	0	45
COc1ccc(C2(CNC(=O)C[C@H]3CCOC[C@@H]3OC)CCC2)cc1	ZINC000450557937	EF	On-Demand	Anodyne	MTNR1A	24	43
COc1ccc(C2(CNC(=O)C[C@H]3CCOC[C@@H]3OC)CCC2)cc1	ZINC000450557937	EF	On-Demand	Anodyne	ACAT	0	45
COc1ccc(C2(CNC(=O)C[C@@H]3CCOC[C@@H]3OC)CCC2)cc1	ZINC000450557940	EF	On-Demand	Anodyne	MTNR1A	24	43
COc1ccc(C2(CNC(=O)C[C@@H]3CCOC[C@@H]3OC)CCC2)cc1	ZINC000450557940	EF	On-Demand	Anodyne	ACAT	0	45
CC[S@@](=O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557942	EF	On-Demand	Anodyne	CACNA1B	48	36
CC[S@@](=O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557942	EF	On-Demand	Anodyne	CCR2	46	44
CC[S@@](=O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557942	EF	On-Demand	Anodyne	LIPG	46	34
CC[S@](=O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557944	EF	On-Demand	Anodyne	CACNA1B	48	36
CC[S@](=O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557944	EF	On-Demand	Anodyne	CCR2	46	44
CC[S@](=O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557944	EF	On-Demand	Anodyne	LIPG	46	34
CC[S@@](=O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557946	EF	On-Demand	Anodyne	CACNA1B	48	36
CC[S@@](=O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557946	EF	On-Demand	Anodyne	CCR2	46	44
CC[S@@](=O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557946	EF	On-Demand	Anodyne	LIPG	46	34
CC[S@](=O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557949	EF	On-Demand	Anodyne	CACNA1B	48	36
CC[S@](=O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557949	EF	On-Demand	Anodyne	CCR2	46	44
CC[S@](=O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450557949	EF	On-Demand	Anodyne	LIPG	46	34
CN(CCN1CCc2ccc(O)cc2C1)Cc1ccccc1	ZINC000450557952	CF	On-Demand	Anodyne	DRD2	0	50
CN(CCN1CCc2ccc(O)cc2C1)Cc1ccccc1	ZINC000450557952	CF	On-Demand	Anodyne	DRD1	30	47
CN(CCN1CCc2ccc(O)cc2C1)Cc1ccccc1	ZINC000450557952	CF	On-Demand	Anodyne	DRD4	0	47
CN(CCN1CCc2ccc(O)cc2C1)Cc1ccccc1	ZINC000450557952	CF	On-Demand	Anodyne	DRD5	47	41
CN(CCN1CCc2ccc(O)cc2C1)Cc1ccccc1	ZINC000450557952	CF	On-Demand	Anodyne	SIGMAR1	31	47
CN(CCN1CCc2ccc(O)cc2C1)Cc1ccccc1	ZINC000450557952	CF	On-Demand	Anodyne	ABCB1B	65	35
CN(CCN1CCc2ccc(O)cc2C1)Cc1ccccc1	ZINC000450557952	CF	On-Demand	Anodyne	ABCB1	23	40
CN(CCN1CCc2ccc(O)cc2C1)Cc1ccccc1	ZINC000450557952	CF	On-Demand	Anodyne	SLC6A5	29	46
CCS(=O)(=O)c1ccc(CN2CCN(Cc3noc(C)n3)CC2)cc1	ZINC000450557953	FD	On-Demand	Anodyne	PLA2G2A	24	46
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	OPRK1	26	40
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	TACR1	32	40
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	TACR2	47	35
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	SIGMAR1	16	53
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	HSD11B1	0	40
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	CCR3	42	41
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	CCR5	27	41
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	TACR3	66	39
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	MBTPS1	49	33
COc1cc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)ccc1Cl	ZINC000450557966	FI	On-Demand	Anodyne	L3MBTL3	55	37
COc1cc(CC(=O)NCCC(=O)NCc2ccccn2)ccc1Cl	ZINC000450557975	FE	On-Demand	Anodyne	PDE5A	30	49
COc1cc(CC(=O)NCCC(=O)NCc2ccccn2)ccc1Cl	ZINC000450557975	FE	On-Demand	Anodyne	GRM4	21	48
COc1cc(CC(=O)NCCC(=O)NCc2ccccn2)ccc1Cl	ZINC000450557975	FE	On-Demand	Anodyne	NCE103	25	45
COc1cc(CC(=O)NCCC(=O)NCc2ccccn2)ccc1Cl	ZINC000450557975	FE	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)NCCC(=O)NCc2ccccn2)ccc1Cl	ZINC000450557975	FE	On-Demand	Anodyne	SUCNR1	40	39
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	DRD2	35	45
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	DRD1	21	50
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	DRD4	25	49
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	HTR2A	32	52
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	HTR2C	26	62
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	HRH1	17	47
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	ERG2	21	45
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	SIGMAR1	21	50
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	CCR3	49	39
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	SLC18A3	0	47
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	HTR3B	0	50
O=C(CCCN1CCC(CN2CCCCC2=O)CC1)c1ccc(F)cc1	ZINC000450557976	FH	On-Demand	Anodyne	CYP2J2	59	41
CCC[C@H](O)CN1CCN(CCNS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450557981	FD	On-Demand	Anodyne	HTR7	21	44
CCOc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)on1	ZINC000450557982	FF	On-Demand	Anodyne	HTR2A	21	40
CCC[C@@H](O)CN1CCN(CCNS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450557987	FD	On-Demand	Anodyne	HTR7	21	44
COCc1nn(C)cc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557995	GF	On-Demand	Anodyne	HTR1A	0	40
COCc1nn(C)cc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557995	GF	On-Demand	Anodyne	HTR1D	81	38
COCc1nn(C)cc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557995	GF	On-Demand	Anodyne	HTR1B	60	41
COCc1nn(C)cc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557995	GF	On-Demand	Anodyne	NQO2	18	45
COCc1nn(C)cc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557995	GF	On-Demand	Anodyne	MPO	53	36
COCc1nn(C)cc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557995	GF	On-Demand	Anodyne	ABCG2	28	46
COCc1nn(C)cc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450557995	GF	On-Demand	Anodyne	MAPT	17	40
CCOc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)on1	ZINC000450558013	GG	On-Demand	Anodyne	HTR1A	0	40
CCOc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)on1	ZINC000450558013	GG	On-Demand	Anodyne	HTR1D	48	40
CCOc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)on1	ZINC000450558013	GG	On-Demand	Anodyne	HTR1B	30	40
CCOc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)on1	ZINC000450558013	GG	On-Demand	Anodyne	NQO2	20	44
CCOc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)on1	ZINC000450558013	GG	On-Demand	Anodyne	MPO	46	37
CCOc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)on1	ZINC000450558013	GG	On-Demand	Anodyne	MTNR1A	16	45
CCOc1cc(C(=O)NCCc2c[nH]c3ccc(Br)cc23)on1	ZINC000450558013	GG	On-Demand	Anodyne	ABCG2	30	48
Cc1cccc(Cl)c1CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450558015	EH	On-Demand	Anodyne	MAP	0	41
Cc1cccc(Cl)c1CN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450558015	EH	On-Demand	Anodyne	MAP1	96	39
O=C(Cc1ccc(OC(F)F)c(F)c1)Nc1ncn(C2CCCCC2)n1	ZINC000450558019	FH	On-Demand	Anodyne	PDEC	0	40
Cc1cccc(Cl)c1CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450558021	EH	On-Demand	Anodyne	MAP	0	41
Cc1cccc(Cl)c1CN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450558021	EH	On-Demand	Anodyne	MAP1	96	39
Cn1nc(-c2ccccc2)cc1C(=O)NCC(=O)C1CC1	ZINC000450558023	CD	On-Demand	Anodyne	CTSV	44	30
Cn1nc(-c2ccccc2)cc1C(=O)NCC(=O)C1CC1	ZINC000450558023	CD	On-Demand	Anodyne	VCP	58	39
FC1(F)CCCC[C@H]1CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558034	EJ	On-Demand	Anodyne	CCR2	30	51
Cc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)c(C(C)C)n1	ZINC000450558038	EE	On-Demand	Anodyne	CA2	44	40
Cc1ccc(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)c(C(C)C)n1	ZINC000450558038	EE	On-Demand	Anodyne	CA4	50	38
FC1(F)CCCC[C@@H]1CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558039	EJ	On-Demand	Anodyne	CCR2	30	51
COC(=O)C(C)(C)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450558043	CE	On-Demand	Anodyne	AMY2	56	32
COC(=O)C(C)(C)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450558046	CE	On-Demand	Anodyne	AMY2	56	32
CCOC(=O)c1ccc(Cn2cc(C(F)(F)F)ccc2=O)nc1	ZINC000450558051	EE	On-Demand	Anodyne	GPR119	15	41
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR1A	35	56
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	DRD2	53	59
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	DRD1	23	46
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	DRD4	34	56
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HRH2	0	42
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	ADRA1D	18	45
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR1D	36	49
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR1B	31	52
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR2A	53	56
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR2C	32	53
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HRH1	31	56
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	ADRA1B	25	46
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	DRD3	20	56
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR1F	91	47
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR7	33	43
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	SIGMAR1	17	56
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	PRCP	19	40
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR1E	15	40
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	CCR2	21	42
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	MCHR1	16	45
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	CYP2J2	55	39
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccc(F)cc1	ZINC000450558059	FJ	On-Demand	Anodyne	AP2S1	0	42
O=C(Nc1ccccc1Br)C1CCN(CCc2cscn2)CC1	ZINC000450558088	GH	On-Demand	Anodyne	SCN5A	40	32
Cc1cccc(NC(=O)N2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)c1	ZINC000450558093	GG	On-Demand	Anodyne	P2RY12	15	44
Cc1cccc(NC(=O)N2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)c1	ZINC000450558093	GG	On-Demand	Anodyne	FAAH	21	48
CCc1cccc(C(=O)NCC2(CO)CCC2)n1	ZINC000450558094	BD	On-Demand	Anodyne	HCN1	50	31
CCc1cccc(C(=O)NCC2(CO)CCC2)n1	ZINC000450558094	BD	On-Demand	Anodyne	HCN4	48	31
COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CCC[C@H](C)O)C2=O)cc1	ZINC000450558101	GF	On-Demand	Anodyne	BACE1	0	45
COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CCC[C@@H](C)O)C2=O)cc1	ZINC000450558102	GF	On-Demand	Anodyne	BACE1	0	45
COC(=O)C1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450558103	EF	On-Demand	Anodyne	CACNA1G	25	41
COC(=O)C1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450558103	EF	On-Demand	Anodyne	HCN1	52	32
COC(=O)C1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450558103	EF	On-Demand	Anodyne	HCN4	50	32
COC(=O)C1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450558104	EF	On-Demand	Anodyne	CACNA1G	25	41
COC(=O)C1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450558104	EF	On-Demand	Anodyne	HCN1	52	32
COC(=O)C1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450558104	EF	On-Demand	Anodyne	HCN4	50	32
C[C@H](OCCc1ccccc1)C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450558110	EG	On-Demand	Anodyne	ACE	40	38
C[C@@H](OCCc1ccccc1)C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450558112	EG	On-Demand	Anodyne	ACE	40	38
C[C@H](OCCc1ccccc1)C(=O)NCC[C@H](C)N1CCCCC1	ZINC000450558113	EG	On-Demand	Anodyne	ACE	40	38
C[C@@H](CCNC(=O)[C@@H](C)OCCc1ccccc1)N1CCCCC1	ZINC000450558115	EG	On-Demand	Anodyne	ACE	40	38
C[C@@H](CCO)CCNc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450558117	GH	On-Demand	Anodyne	PDS	15	64
COCc1nnc(N2C[C@@H](C(=O)OC)[C@H](c3ccc(O)cc3)C2)s1	ZINC000450558122	ED	On-Demand	Anodyne	SLC6A1	60	44
C[C@H](CCO)CCNc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450558123	GH	On-Demand	Anodyne	PDS	15	64
C[C@@H](CCO)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450558124	CF	On-Demand	Anodyne	UTS2R	27	54
C[C@H](CCO)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450558125	CF	On-Demand	Anodyne	UTS2R	27	54
COC(=O)[C@@H]1CN(c2cc(OC)c(F)cc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450558127	GF	On-Demand	Bother	SLC6A1	29	40
Fc1ccc(NC2CCN(CC3CC(F)(F)C3)CC2)cc1	ZINC000450558135	CH	On-Demand	Anodyne	SIGMAR1	15	42
COC(=O)[C@@H]1CN(c2ccncc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450558144	EE	On-Demand	Bother	SLC6A1	55	40
COC(=O)[C@@H]1CN(c2ccncc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450558144	EE	On-Demand	Bother	SLC6A3	19	40
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H](C)c1cccc(S(N)(=O)=O)c1	ZINC000450558153	FE	On-Demand	Anodyne	TTK	24	40
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H](C)c1cccc(S(N)(=O)=O)c1	ZINC000450558155	FE	On-Demand	Anodyne	TTK	24	40
C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450558156	FE	On-Demand	Anodyne	TTK	24	40
C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450558158	FE	On-Demand	Anodyne	TTK	24	40
COC(=O)c1ccc(CC(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450558161	DD	On-Demand	Anodyne	MBTPS1	40	32
COC(=O)c1ccc(CC(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450558163	DD	On-Demand	Anodyne	MBTPS1	40	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC[C@H](C)N1CCCCC1	ZINC000450558164	FF	On-Demand	Anodyne	RIR1_HHV11	42	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC[C@H](C)N1CCCCC1	ZINC000450558164	FF	On-Demand	Anodyne	CAPN1	15	41
COC(=O)c1ccc(CC(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1	ZINC000450558165	DD	On-Demand	Anodyne	MBTPS1	40	32
COC(=O)c1ccc(CC(=O)N[C@H]2CCCN(C)[C@H]2C)cc1	ZINC000450558166	DD	On-Demand	Anodyne	MBTPS1	40	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450558167	FF	On-Demand	Anodyne	RIR1_HHV11	42	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450558167	FF	On-Demand	Anodyne	CAPN1	15	41
Cc1nc2ccnn2cc1C(=O)NCC1(CO)CCC1	ZINC000450558207	CC	On-Demand	Anodyne	DDR1	46	35
Cc1nc2ccnn2cc1C(=O)NCC1(CO)CCC1	ZINC000450558207	CC	On-Demand	Anodyne	HCN1	53	32
Cc1nc2ccnn2cc1C(=O)NCC1(CO)CCC1	ZINC000450558207	CC	On-Demand	Anodyne	HCN4	51	32
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	HTR1A	15	64
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	DRD2	33	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	DRD1	16	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	DRD4	25	47
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	HTR2A	30	55
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	HTR2C	30	58
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	SLC6A1	88	38
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	ADRA1B	15	46
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	DRD3	0	49
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	HTR7	22	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	SIGMAR1	27	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	CCR3	86	42
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	CHRNA7	25	41
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	SLC18A3	16	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	HTR3B	0	44
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	EPHX2	52	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	CXCR3	17	40
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	MCHR1	23	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558228	FH	On-Demand	Anodyne	CYP2J2	58	41
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	HTR1A	15	64
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	DRD2	33	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	DRD1	16	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	DRD4	25	47
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	HTR2A	30	55
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	HTR2C	30	58
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	SLC6A1	88	38
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	ADRA1B	15	46
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	DRD3	0	49
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	HTR7	22	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	SIGMAR1	27	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	CCR3	86	42
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	CHRNA7	25	41
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	SLC18A3	16	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	HTR3B	0	44
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	EPHX2	52	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	CXCR3	17	40
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	MCHR1	23	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450558229	FH	On-Demand	Anodyne	CYP2J2	58	41
COC(=O)[C@@H]1CN(c2nc3ccccc3nc2C)C[C@H]1c1ccc(O)cc1	ZINC000450558230	FG	On-Demand	Anodyne	SLC6A1	77	45
COC(=O)[C@@H]1CN(c2nc3ccccc3nc2C)C[C@H]1c1ccc(O)cc1	ZINC000450558230	FG	On-Demand	Anodyne	SLC6A3	25	43
COC(=O)C1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450558233	GF	On-Demand	Anodyne	PDE8B	52	34
COC(=O)C1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450558233	GF	On-Demand	Anodyne	HCN1	50	31
COC(=O)C1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450558233	GF	On-Demand	Anodyne	HCN4	49	31
COC(=O)C1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450558234	GF	On-Demand	Anodyne	PDE8B	52	34
COC(=O)C1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450558234	GF	On-Demand	Anodyne	HCN1	50	31
COC(=O)C1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450558234	GF	On-Demand	Anodyne	HCN4	49	31
COCCOC[C@@H](O)CN1CCCCCc2ccccc21	ZINC000450558254	CE	On-Demand	Anodyne	HSP90AB1	39	44
COCCOC[C@H](O)CN1CCCCCc2ccccc21	ZINC000450558255	CE	On-Demand	Anodyne	HSP90AB1	39	44
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	CHRM2	23	41
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	CHRM1	15	41
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	DRD2	37	52
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	DRD4	75	52
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	ACHE	37	46
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	DRD3	30	52
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	KCNH2	20	46
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	HTR4	62	40
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	CHRM3	28	41
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	LTA4H	35	48
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	TACR2	20	40
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	SIGMAR1	51	50
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	SSTR5	75	39
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	CCR3	85	47
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	UTS2R	25	43
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	MLNR	64	45
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	FAAH	20	46
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	CCR2	38	43
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	MCHR1	58	56
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	CACNA1I	40	37
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	CCR8	16	40
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	CYP3A43	0	40
COC(=O)c1ccc(CN2CC[C@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558263	EH	On-Demand	Anodyne	NPFFR1	47	38
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	CHRM2	23	41
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	CHRM1	15	41
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	DRD2	37	52
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	DRD4	75	52
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	ACHE	37	46
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	DRD3	30	52
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	KCNH2	20	46
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	HTR4	62	40
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	CHRM3	28	41
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	LTA4H	35	48
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	TACR2	20	40
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	SIGMAR1	51	50
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	SSTR5	75	39
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	CCR3	85	47
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	UTS2R	25	43
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	MLNR	64	45
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	FAAH	20	46
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	CCR2	38	43
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	MCHR1	58	56
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	CACNA1I	40	37
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	CCR8	16	40
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	CYP3A43	0	40
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl	ZINC000450558264	EH	On-Demand	Anodyne	NPFFR1	47	38
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558265	EH	On-Demand	Anodyne	SLC6A1	0	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558265	EH	On-Demand	Anodyne	SLC6A4	24	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558265	EH	On-Demand	Anodyne	SLC6A3	42	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558265	EH	On-Demand	Anodyne	MC4R	47	38
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558265	EH	On-Demand	Anodyne	SIGMAR1	16	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558265	EH	On-Demand	Anodyne	PLD1	47	38
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558265	EH	On-Demand	Anodyne	MLNR	33	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558266	EH	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558266	EH	On-Demand	Anodyne	SLC6A4	24	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558266	EH	On-Demand	Anodyne	SLC6A3	42	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558266	EH	On-Demand	Anodyne	MC4R	47	38
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558266	EH	On-Demand	Anodyne	SIGMAR1	16	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558266	EH	On-Demand	Anodyne	PLD1	47	38
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558266	EH	On-Demand	Anodyne	MLNR	33	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558267	EH	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558267	EH	On-Demand	Anodyne	SLC6A4	24	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558267	EH	On-Demand	Anodyne	SLC6A3	42	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558267	EH	On-Demand	Anodyne	MC4R	47	38
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558267	EH	On-Demand	Anodyne	SIGMAR1	16	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558267	EH	On-Demand	Anodyne	PLD1	47	38
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558267	EH	On-Demand	Anodyne	MLNR	33	43
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)C(F)F	ZINC000450558268	CF	On-Demand	Anodyne	ADORA1	38	45
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)C(F)F	ZINC000450558268	CF	On-Demand	Anodyne	ADORA2A	0	47
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558269	EH	On-Demand	Anodyne	SLC6A1	0	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558269	EH	On-Demand	Anodyne	SLC6A4	24	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558269	EH	On-Demand	Anodyne	SLC6A3	42	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558269	EH	On-Demand	Anodyne	MC4R	47	38
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558269	EH	On-Demand	Anodyne	SIGMAR1	16	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558269	EH	On-Demand	Anodyne	PLD1	47	38
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Nc2ccc(F)cc2)CC1	ZINC000450558269	EH	On-Demand	Anodyne	MLNR	33	43
CC[C@@H]1C[C@H]1C(=O)Nc1sc(-c2ccccc2)nc1C	ZINC000450558271	CI	On-Demand	Anodyne	PPARA	0	42
CCOc1nc2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)cc2[nH]1	ZINC000450558272	DE	On-Demand	Anodyne	SSTR5	40	33
CCOc1nc2ccc(C(=O)N[C@H]3CCCN(C)[C@H]3C)cc2[nH]1	ZINC000450558272	DE	On-Demand	Anodyne	ACKR3	49	30
CCOc1nc2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)cc2[nH]1	ZINC000450558273	DE	On-Demand	Anodyne	SSTR5	40	33
CCOc1nc2ccc(C(=O)N[C@@H]3CCCN(C)[C@@H]3C)cc2[nH]1	ZINC000450558273	DE	On-Demand	Anodyne	ACKR3	49	30
CC[C@H](Nc1ncnc2c1ncn2C1CC1)C(F)F	ZINC000450558274	CF	On-Demand	Anodyne	ADORA1	38	45
CC[C@H](Nc1ncnc2c1ncn2C1CC1)C(F)F	ZINC000450558274	CF	On-Demand	Anodyne	ADORA2A	0	47
CCOc1nc2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)cc2[nH]1	ZINC000450558275	DE	On-Demand	Anodyne	SSTR5	40	33
CCOc1nc2ccc(C(=O)N[C@@H]3CCCN(C)[C@H]3C)cc2[nH]1	ZINC000450558275	DE	On-Demand	Anodyne	ACKR3	49	30
CCOc1nc2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)cc2[nH]1	ZINC000450558277	DE	On-Demand	Anodyne	SSTR5	40	33
CCOc1nc2ccc(C(=O)N[C@H]3CCCN(C)[C@@H]3C)cc2[nH]1	ZINC000450558277	DE	On-Demand	Anodyne	ACKR3	49	30
CC(F)(F)CCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450558283	FF	On-Demand	Anodyne	CA2	15	46
CC(F)(F)CCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450558283	FF	On-Demand	Anodyne	CA4	15	46
CC[S@](=O)CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450558288	DC	On-Demand	Anodyne	GALR1	46	33
CC[S@](=O)CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450558288	DC	On-Demand	Anodyne	GHRL	46	33
CC[S@@](=O)CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450558289	DC	On-Demand	Anodyne	GALR1	46	33
CC[S@@](=O)CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450558289	DC	On-Demand	Anodyne	GHRL	46	33
CC[S@@](=O)CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450558290	DC	On-Demand	Anodyne	GALR1	46	33
CC[S@@](=O)CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450558290	DC	On-Demand	Anodyne	GHRL	46	33
CC[S@](=O)CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450558291	DC	On-Demand	Anodyne	GALR1	46	33
CC[S@](=O)CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450558291	DC	On-Demand	Anodyne	GHRL	46	33
CC(F)(F)CCN=c1ccc(S(=O)(=O)NCC2CC2)c[nH]1	ZINC000450558292	DD	On-Demand	Anodyne	NPY1R	42	34
c1ccc(-n2ncc3c(NCCCC4CCOCC4)ncnc32)cc1	ZINC000450558307	EG	On-Demand	Anodyne	ABL1	24	41
CCS(=O)(=O)N(C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450558337	GG	On-Demand	Anodyne	NPY1R	29	42
CCCc1cc(NCCCC2CCOCC2)n2ncnc2n1	ZINC000450558359	DF	On-Demand	Anodyne	DHOD	0	48
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1	ZINC000450558371	FG	On-Demand	Anodyne	COLA	68	39
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1	ZINC000450558371	FG	On-Demand	Anodyne	CPT1A	62	38
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1	ZINC000450558371	FG	On-Demand	Anodyne	CPT2	42	38
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1	ZINC000450558372	FG	On-Demand	Anodyne	COLA	68	39
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1	ZINC000450558372	FG	On-Demand	Anodyne	CPT1A	62	38
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1	ZINC000450558372	FG	On-Demand	Anodyne	CPT2	42	38
COc1ccc(C2(CNC(=O)[C@@H]3OCC[C@@H]3C)CCC2)cc1	ZINC000450558379	DF	On-Demand	Anodyne	MTNR1A	27	47
COc1ccc(C2(CNC(=O)[C@@H]3OCC[C@@H]3C)CCC2)cc1	ZINC000450558379	DF	On-Demand	Anodyne	ACAT	0	48
CCCOc1ccc(C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)c(OC)c1	ZINC000450558382	GF	On-Demand	Anodyne	OXTR	16	41
CCCOc1ccc(C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)c(OC)c1	ZINC000450558384	GF	On-Demand	Anodyne	OXTR	16	41
O=C(NCCCNc1ccccc1F)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450558395	GF	On-Demand	Anodyne	BCHE	20	41
COc1cc(CN2CCC[C@@H](c3ncc[nH]3)C2)ccc1Cl	ZINC000450558396	DG	On-Demand	Anodyne	SSTR5	48	41
COc1cc(CN2CCC[C@H](c3ncc[nH]3)C2)ccc1Cl	ZINC000450558398	DG	On-Demand	Anodyne	SSTR5	48	41
Clc1cccnc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450558400	GG	On-Demand	Anodyne	DRD2	21	47
Clc1cccnc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450558400	GG	On-Demand	Anodyne	DRD4	46	43
Clc1cccnc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450558400	GG	On-Demand	Anodyne	DRD3	21	42
Clc1cccnc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450558400	GG	On-Demand	Anodyne	SIGMAR1	27	47
CCOc1nc2ccc(C(=O)N3CCNC(=O)[C@H]3Cc3ccccc3)cc2[nH]1	ZINC000450558411	GE	On-Demand	Anodyne	GRIN2B	32	41
C[C@@H](O)CCCN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450558412	DD	On-Demand	Bother	SLC27A4	42	30
C[C@H](O)CCCN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450558413	DD	On-Demand	Bother	SLC27A4	42	30
C[C@@H](O)CCCN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450558415	DD	On-Demand	Bother	SLC27A4	42	30
C[C@H](O)CCCN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450558417	DD	On-Demand	Bother	SLC27A4	42	30
COc1ccc(C2(CNC(=O)[C@@H]3CCCN(C)C3=O)CCC2)cc1	ZINC000450558418	EE	On-Demand	Anodyne	DRD4	40	30
COc1ccc(C2(CNC(=O)[C@@H]3CCCN(C)C3=O)CCC2)cc1	ZINC000450558418	EE	On-Demand	Anodyne	MTNR1A	35	48
COc1ccc(C2(CNC(=O)[C@@H]3CCCN(C)C3=O)CCC2)cc1	ZINC000450558418	EE	On-Demand	Anodyne	MTNR1B	25	45
CCOc1nc2ccc(C(=O)N3CCNC(=O)[C@@H]3Cc3ccccc3)cc2[nH]1	ZINC000450558419	GE	On-Demand	Anodyne	GRIN2B	32	41
COc1ccc(C2(CNC(=O)[C@H]3CCCN(C)C3=O)CCC2)cc1	ZINC000450558421	EE	On-Demand	Anodyne	DRD4	40	30
COc1ccc(C2(CNC(=O)[C@H]3CCCN(C)C3=O)CCC2)cc1	ZINC000450558421	EE	On-Demand	Anodyne	MTNR1A	35	48
COc1ccc(C2(CNC(=O)[C@H]3CCCN(C)C3=O)CCC2)cc1	ZINC000450558421	EE	On-Demand	Anodyne	MTNR1B	25	45
O=C(N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1(C(F)(F)F)CCC1	ZINC000450558432	FJ	On-Demand	Anodyne	CACNA1B	43	36
O=C(N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1(C(F)(F)F)CCC1	ZINC000450558432	FJ	On-Demand	Anodyne	CCR2	75	47
O=C(N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1(C(F)(F)F)CCC1	ZINC000450558432	FJ	On-Demand	Anodyne	RBP4	29	44
O=C(N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1(C(F)(F)F)CCC1	ZINC000450558435	FJ	On-Demand	Anodyne	CACNA1B	43	36
O=C(N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1(C(F)(F)F)CCC1	ZINC000450558435	FJ	On-Demand	Anodyne	CCR2	75	47
O=C(N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1(C(F)(F)F)CCC1	ZINC000450558435	FJ	On-Demand	Anodyne	RBP4	29	44
CC[C@H](O)CC(=O)Nc1nc2ccccc2n1Cc1ccccc1C	ZINC000450558444	EG	On-Demand	Anodyne	ALOX5AP	24	42
CC[C@@H](O)CC(=O)Nc1nc2ccccc2n1Cc1ccccc1C	ZINC000450558445	EG	On-Demand	Anodyne	ALOX5AP	24	42
CCOC(=O)c1ccc(CN(Cc2cccc(C)c2)Cc2ccccn2)nc1	ZINC000450558462	GI	On-Demand	Anodyne	P2RY12	21	40
O=S(=O)(c1cccnc1NC[C@@H](O)Cc1cccc(F)c1)N1CCCCC1	ZINC000450558466	GE	On-Demand	Anodyne	NAMPT	17	46
O=S(=O)(c1cccnc1NC[C@H](O)Cc1cccc(F)c1)N1CCCCC1	ZINC000450558467	GE	On-Demand	Anodyne	NAMPT	17	46
CCS(=O)(=O)c1ccc(CN2CCN3CCCC[C@H]3C2)cc1	ZINC000450558469	DE	On-Demand	Anodyne	L3MBTL1	0	41
CCS(=O)(=O)c1ccc(CN2CCN3CCCC[C@H]3C2)cc1	ZINC000450558469	DE	On-Demand	Anodyne	MBTD1	0	41
CCS(=O)(=O)c1ccc(CN2CCN3CCCC[C@@H]3C2)cc1	ZINC000450558471	DE	On-Demand	Anodyne	L3MBTL1	0	41
CCS(=O)(=O)c1ccc(CN2CCN3CCCC[C@@H]3C2)cc1	ZINC000450558471	DE	On-Demand	Anodyne	MBTD1	0	41
CCCc1c(NC(=O)c2cnc(C3CC3)nc2)cnn1-c1cccc(F)c1	ZINC000450558484	FH	On-Demand	Anodyne	MAPK14	23	41
CCN(CC(=O)Nc1c(C)cccc1C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450558502	GH	On-Demand	Anodyne	RORC	64	49
CC(C)(O)C(C)(C)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450558518	FE	On-Demand	Mild	AR	21	46
CC[S@](=O)CC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450558519	DE	On-Demand	Anodyne	ACAT	0	51
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H]2c2ccc(Br)s2)n1	ZINC000450558521	GH	On-Demand	Anodyne	COLA	62	42
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H]2c2ccc(Br)s2)n1	ZINC000450558521	GH	On-Demand	Anodyne	CPT1A	59	42
CC[S@@](=O)CC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450558522	DE	On-Demand	Anodyne	ACAT	0	51
CC(C)(O)C(C)(C)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450558524	FE	On-Demand	Mild	AR	21	46
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)C[S@@](C)=O	ZINC000450558526	DF	On-Demand	Anodyne	MTTP	45	36
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)C[S@@](C)=O	ZINC000450558528	DF	On-Demand	Anodyne	MTTP	45	36
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)C[S@](C)=O	ZINC000450558529	DF	On-Demand	Anodyne	MTTP	45	36
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)C[S@](C)=O	ZINC000450558531	DF	On-Demand	Anodyne	MTTP	45	36
Cc1cccc(C2=CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)c1	ZINC000450558532	EH	On-Demand	Anodyne	ADAM10	21	42
Cc1nc(C)n(CCCC(=O)N2CCC[C@H]2c2ccc(Br)s2)n1	ZINC000450558543	GH	On-Demand	Anodyne	COLA	62	42
Cc1nc(C)n(CCCC(=O)N2CCC[C@H]2c2ccc(Br)s2)n1	ZINC000450558543	GH	On-Demand	Anodyne	CPT1A	59	42
CCOC(=O)COc1ccc(NC(=O)Cn2ccc(C)n2)cc1	ZINC000450558549	DD	On-Demand	Anodyne	ADORA2B	42	36
CC(C)(C)[C@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450558550	EG	On-Demand	Bother	CACNA1C	42	33
CC(C)(C)[C@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450558550	EG	On-Demand	Bother	CACNA1D	64	33
CCC[C@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558552	CF	On-Demand	Anodyne	CTSS	0	52
CCC[C@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558552	CF	On-Demand	Anodyne	CCR2	44	48
CCC[C@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558552	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
CC(C)(C)[C@@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450558553	EG	On-Demand	Bother	CACNA1C	42	33
CC(C)(C)[C@@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450558553	EG	On-Demand	Bother	CACNA1D	64	33
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@@H]1CCCCC1(F)F	ZINC000450558554	GK	On-Demand	Anodyne	RBP4	46	32
Cc1cccc([C@H]2CCN(C(=O)CCCc3ncc(C)o3)C2)c1	ZINC000450558555	DH	On-Demand	Anodyne	MGEA5	23	43
Cc1cccc([C@@H]2CCN(C(=O)CCCc3ncc(C)o3)C2)c1	ZINC000450558556	DH	On-Demand	Anodyne	MGEA5	23	43
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@H]1CCCCC1(F)F	ZINC000450558561	GK	On-Demand	Anodyne	RBP4	46	32
COC[C@@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450558562	CF	On-Demand	Anodyne	LMGT2	0	42
Fc1cccc2c1CCC[C@H]2Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450558566	FH	On-Demand	Anodyne	DHOD	0	47
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)C2)c1	ZINC000450558567	CH	On-Demand	Anodyne	ADAM10	27	43
Fc1cccc2c1CCC[C@@H]2Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450558569	FH	On-Demand	Anodyne	DHOD	0	47
Cc1cccc([C@@H]2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)C2)c1	ZINC000450558570	CH	On-Demand	Anodyne	ADAM10	27	43
COc1cc(CC(=O)N[C@@]2(C)CCO[C@@H]2C)ccc1Cl	ZINC000450558574	CF	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@@]2(C)CCO[C@@H]2C)ccc1Cl	ZINC000450558574	CF	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@@]2(C)CCO[C@H]2C)ccc1Cl	ZINC000450558578	CF	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@@]2(C)CCO[C@H]2C)ccc1Cl	ZINC000450558578	CF	On-Demand	Anodyne	CAN2	0	41
Cc1cccc([C@H]2CCN(C(=O)c3cc(C)cs3)C2)c1	ZINC000450558579	CH	On-Demand	Anodyne	HPGD	17	41
COc1cc(CC(=O)N[C@]2(C)CCO[C@@H]2C)ccc1Cl	ZINC000450558580	CF	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@]2(C)CCO[C@@H]2C)ccc1Cl	ZINC000450558580	CF	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@]2(C)CCO[C@H]2C)ccc1Cl	ZINC000450558583	CF	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@]2(C)CCO[C@H]2C)ccc1Cl	ZINC000450558583	CF	On-Demand	Anodyne	CAN2	0	41
COC(=O)c1coc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)n1	ZINC000450558586	GF	On-Demand	Anodyne	CCR5	15	41
COC(=O)c1coc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)n1	ZINC000450558586	GF	On-Demand	Anodyne	CACNA1G	19	44
Cc1cccc([C@@H]2CCN(C(=O)c3cc(C)cs3)C2)c1	ZINC000450558594	CH	On-Demand	Anodyne	HPGD	17	41
CCC[C@@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558599	CF	On-Demand	Anodyne	CTSS	0	52
CCC[C@@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558599	CF	On-Demand	Anodyne	CCR2	44	48
CCC[C@@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558599	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
C[C@@H](C[S@](C)=O)N(C)C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450558600	FF	On-Demand	Anodyne	IMDH_CRYPV	29	46
Cc1ccc(F)c(CN2CCCc3ccc(S(N)(=O)=O)cc32)c1	ZINC000450558602	EF	On-Demand	Anodyne	CA7	16	40
C[C@H](C[S@@](C)=O)N(C)C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450558603	FF	On-Demand	Anodyne	IMDH_CRYPV	29	46
C[C@@H](C[S@@](C)=O)N(C)C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450558604	FF	On-Demand	Anodyne	IMDH_CRYPV	29	46
C[C@H](C[S@](C)=O)N(C)C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450558606	FF	On-Demand	Anodyne	IMDH_CRYPV	29	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@@H]2CCOC2)cc1	ZINC000450558614	GE	On-Demand	Anodyne	MMP13	16	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@@H]2CCOC2)cc1	ZINC000450558614	GE	On-Demand	Anodyne	MMP3	15	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@@H]2CCOC2)cc1	ZINC000450558614	GE	On-Demand	Anodyne	CAPN1	21	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@@H]2CCOC2)cc1	ZINC000450558614	GE	On-Demand	Anodyne	CAPN2	15	48
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@@H]2CCOC2)cc1	ZINC000450558614	GE	On-Demand	Anodyne	PSMB5	30	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@@H]2CCOC2)cc1	ZINC000450558614	GE	On-Demand	Anodyne	LEF	49	38
O=C(Nc1nccs1)[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450558617	GG	On-Demand	Anodyne	MAP	0	40
O=C(Nc1nccs1)[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450558617	GG	On-Demand	Anodyne	MAP1	70	40
O=C(Nc1nccs1)[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450558617	GG	On-Demand	Anodyne	PREP	43	45
O=C(Nc1nccs1)[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450558619	GG	On-Demand	Anodyne	MAP	0	40
O=C(Nc1nccs1)[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450558619	GG	On-Demand	Anodyne	MAP1	70	40
O=C(Nc1nccs1)[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450558619	GG	On-Demand	Anodyne	PREP	43	45
CC(C)N(CCCC(=O)c1ccc(Br)cc1)C1CCOCC1	ZINC000450558620	FI	On-Demand	Anodyne	CYP2J2	43	30
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@H]2CCOC2)cc1	ZINC000450558622	GE	On-Demand	Anodyne	MMP13	16	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@H]2CCOC2)cc1	ZINC000450558622	GE	On-Demand	Anodyne	MMP3	15	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@H]2CCOC2)cc1	ZINC000450558622	GE	On-Demand	Anodyne	CAPN1	21	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@H]2CCOC2)cc1	ZINC000450558622	GE	On-Demand	Anodyne	CAPN2	15	48
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@H]2CCOC2)cc1	ZINC000450558622	GE	On-Demand	Anodyne	PSMB5	30	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC[C@H]2CCOC2)cc1	ZINC000450558622	GE	On-Demand	Anodyne	LEF	49	38
COC(=O)C(C)(C)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450558624	CE	On-Demand	Anodyne	AMY2	56	32
O=C(CCCC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	ZINC000450558627	FI	On-Demand	Anodyne	CCR2	76	45
O=C(CCCC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	ZINC000450558627	FI	On-Demand	Anodyne	RBP4	29	44
O=C(CCCC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	ZINC000450558627	FI	On-Demand	Anodyne	LIPG	45	32
O=C(CCCC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	ZINC000450558627	FI	On-Demand	Anodyne	ETHR	44	36
CC(F)(F)CCn1cnc2c(cnn2-c2ccccc2)c1=O	ZINC000450558631	DF	On-Demand	Anodyne	Q9M629_MAIZE	42	30
O=C(CCCC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	ZINC000450558632	FI	On-Demand	Anodyne	CCR2	76	45
O=C(CCCC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	ZINC000450558632	FI	On-Demand	Anodyne	RBP4	29	44
O=C(CCCC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	ZINC000450558632	FI	On-Demand	Anodyne	LIPG	45	32
O=C(CCCC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1CC1	ZINC000450558632	FI	On-Demand	Anodyne	ETHR	44	36
COC(=O)C(C)(C)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450558635	CE	On-Demand	Anodyne	AMY2	56	32
CN(CC1CC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450558652	DG	On-Demand	Anodyne	CCR5	17	45
CN(CC1CC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450558652	DG	On-Demand	Anodyne	L3MBTL1	0	42
CN(CC1CC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450558652	DG	On-Demand	Anodyne	L3MBTL3	66	42
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA2	69	53
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA1	59	69
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA7	47	48
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA5B	44	36
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA4	73	53
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA5A	51	36
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA14	30	50
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA12	29	40
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	CA9	41	40
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	NCE103	48	33
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	MTCA1	53	31
CC[C@@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558656	DE	On-Demand	Anodyne	P96878_MYCTU	62	37
C[C@]1(F)CCCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450558662	CG	On-Demand	Anodyne	SORD	41	40
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA2	69	53
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA1	59	69
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA7	47	48
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA5B	44	36
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA4	73	53
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA5A	51	36
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA14	30	50
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA12	29	40
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	CA9	41	40
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	NCE103	48	33
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	MTCA1	53	31
CC[C@H](CC(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450558664	DE	On-Demand	Anodyne	P96878_MYCTU	62	37
C[C@@]1(F)CCCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450558668	CG	On-Demand	Anodyne	SORD	41	40
NS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450558680	DD	On-Demand	Anodyne	SLC6A1	45	45
NS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450558680	DD	On-Demand	Anodyne	PREP	23	41
NS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450558680	DD	On-Demand	Anodyne	CYP2J2	55	39
CC(C)OC(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450558683	FG	On-Demand	Anodyne	HTR2A	19	41
CC(C)OC(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450558683	FG	On-Demand	Anodyne	CNR2	0	55
CC(C)OC(C)(C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450558683	FG	On-Demand	Anodyne	NPY2R	34	44
NS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450558691	DD	On-Demand	Anodyne	SLC6A1	45	45
NS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450558691	DD	On-Demand	Anodyne	PREP	23	41
NS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450558691	DD	On-Demand	Anodyne	CYP2J2	55	39
COc1cccc([C@@H]2C[C@H]2C(=O)N(C)[C@@H](C)C[S@](C)=O)c1	ZINC000450558692	DE	On-Demand	Anodyne	GPR88	0	52
COc1cccc([C@@H]2C[C@H]2C(=O)N(C)[C@@H](C)C[S@@](C)=O)c1	ZINC000450558694	DE	On-Demand	Anodyne	GPR88	0	52
COc1cccc([C@@H]2C[C@H]2C(=O)N(C)[C@H](C)C[S@@](C)=O)c1	ZINC000450558697	DE	On-Demand	Anodyne	GPR88	0	52
COc1cccc([C@@H]2C[C@H]2C(=O)N(C)[C@H](C)C[S@](C)=O)c1	ZINC000450558702	DE	On-Demand	Anodyne	GPR88	0	52
CO[C@@H]1COCC[C@@H]1CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450558703	FG	On-Demand	Anodyne	CCR2	66	47
CC(C)(C)OC(=O)CN(Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450558705	GG	On-Demand	Anodyne	STAT5B	0	40
CO[C@@H]1COCC[C@@H]1CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450558706	FG	On-Demand	Anodyne	CCR2	66	47
CO[C@@H]1COCC[C@H]1CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450558708	FG	On-Demand	Anodyne	CCR2	66	47
CO[C@@H]1COCC[C@H]1CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450558709	FG	On-Demand	Anodyne	CCR2	66	47
O=C(NCCn1c2ccccc2c2ccccc21)[C@@H]1CC1(F)F	ZINC000450558730	DH	On-Demand	Anodyne	CNR1	0	40
COc1cc(Br)ccc1CCCNC(=O)CCCC(=O)C1CC1	ZINC000450558733	GH	On-Demand	Anodyne	MTNR1A	43	40
COc1cc(Br)ccc1CCCNC(=O)CCCC(=O)C1CC1	ZINC000450558733	GH	On-Demand	Anodyne	MTNR1B	41	40
O=C(NCCn1c2ccccc2c2ccccc21)[C@H]1CC1(F)F	ZINC000450558737	DH	On-Demand	Anodyne	CNR1	0	40
Cc1nc(S(=O)(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)cs1	ZINC000450558757	GE	On-Demand	Anodyne	HTR1A	21	44
Cc1nc(S(=O)(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)cs1	ZINC000450558757	GE	On-Demand	Anodyne	DRD4	16	40
Cc1nc(S(=O)(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)cs1	ZINC000450558757	GE	On-Demand	Anodyne	HTR2A	27	41
Cc1nc(S(=O)(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)cs1	ZINC000450558757	GE	On-Demand	Anodyne	HTR2C	24	42
Cc1nc(S(=O)(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)cs1	ZINC000450558757	GE	On-Demand	Anodyne	DRD3	17	42
Cc1nc(S(=O)(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)cs1	ZINC000450558757	GE	On-Demand	Anodyne	HTR7	33	44
Cc1nc(S(=O)(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)cs1	ZINC000450558757	GE	On-Demand	Anodyne	SLC18A3	0	40
Cc1nc(S(=O)(=O)N2CCN(CCCC(=O)c3ccccc3)CC2)cs1	ZINC000450558757	GE	On-Demand	Anodyne	CYP2J2	57	42
CCCc1cc(N[C@H](CC)C(F)F)n2ncnc2n1	ZINC000450558761	CF	On-Demand	Anodyne	DHOD	0	46
CCS(=O)(=O)c1ccc(CN2CCC(CN3CCCCC3=O)CC2)cc1	ZINC000450558762	GF	On-Demand	Anodyne	ACHE	23	56
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450558766	GI	On-Demand	Bother	CACNA1C	57	36
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450558766	GI	On-Demand	Bother	CACNA1D	87	35
CCCc1cc(N[C@@H](CC)C(F)F)n2ncnc2n1	ZINC000450558767	CF	On-Demand	Anodyne	DHOD	0	46
COc1cccc([C@H]2C[C@H](C)CN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450558771	GI	On-Demand	Bother	CACNA1C	57	36
COc1cccc([C@H]2C[C@H](C)CN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450558771	GI	On-Demand	Bother	CACNA1D	87	35
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450558773	GI	On-Demand	Bother	CACNA1C	57	36
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450558773	GI	On-Demand	Bother	CACNA1D	87	35
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450558775	GI	On-Demand	Bother	CACNA1C	57	36
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000450558775	GI	On-Demand	Bother	CACNA1D	87	35
C[C@H](CN1CCC(c2nc3ccccc3[nH]2)CC1)S(C)(=O)=O	ZINC000450558778	DE	On-Demand	Anodyne	HTR4	15	43
C[C@H](CN1CCC(c2nc3ccccc3[nH]2)CC1)S(C)(=O)=O	ZINC000450558778	DE	On-Demand	Anodyne	PARP2	18	42
C[C@H](CN1CCC(c2nc3ccccc3[nH]2)CC1)S(C)(=O)=O	ZINC000450558778	DE	On-Demand	Anodyne	PARP1	15	42
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1nccc(C#N)n1	ZINC000450558779	FG	On-Demand	Mild	PAPA1_CARPA	44	39
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1nccc(C#N)n1	ZINC000450558779	FG	On-Demand	Mild	CTRB_BOVIN	53	31
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1nccc(C#N)n1	ZINC000450558782	FG	On-Demand	Mild	PAPA1_CARPA	44	39
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1nccc(C#N)n1	ZINC000450558782	FG	On-Demand	Mild	CTRB_BOVIN	53	31
CCOC(=O)[C@@H]1CN(c2ncnc3c2cnn3-c2ccccc2)CC12COC2	ZINC000450558783	GD	On-Demand	Anodyne	GPR119	16	42
CCOC(=O)[C@H]1CN(c2ncnc3c2cnn3-c2ccccc2)CC12COC2	ZINC000450558785	GD	On-Demand	Anodyne	GPR119	16	42
C[C@@H](CN1CCC(c2nc3ccccc3[nH]2)CC1)S(C)(=O)=O	ZINC000450558786	DE	On-Demand	Anodyne	HTR4	15	43
C[C@@H](CN1CCC(c2nc3ccccc3[nH]2)CC1)S(C)(=O)=O	ZINC000450558786	DE	On-Demand	Anodyne	PARP2	18	42
C[C@@H](CN1CCC(c2nc3ccccc3[nH]2)CC1)S(C)(=O)=O	ZINC000450558786	DE	On-Demand	Anodyne	PARP1	15	42
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@H](CO)CC(F)(F)F	ZINC000450558795	FD	On-Demand	Anodyne	PSBA	0	43
CO[C@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558807	EG	On-Demand	Anodyne	MME	55	43
CO[C@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558807	EG	On-Demand	Anodyne	PAPA1_CARPA	55	37
CO[C@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558807	EG	On-Demand	Anodyne	CTSL	22	40
CO[C@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558807	EG	On-Demand	Anodyne	AMP1_PLAFQ	48	42
CO[C@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558807	EG	On-Demand	Anodyne	NPFFR1	49	32
CO[C@@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558810	EG	On-Demand	Anodyne	MME	55	43
CO[C@@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558810	EG	On-Demand	Anodyne	PAPA1_CARPA	55	37
CO[C@@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558810	EG	On-Demand	Anodyne	CTSL	22	40
CO[C@@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558810	EG	On-Demand	Anodyne	AMP1_PLAFQ	48	42
CO[C@@H](Cc1ccccc1)C(=O)NCCCNc1ccccc1F	ZINC000450558810	EG	On-Demand	Anodyne	NPFFR1	49	32
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@@H](CO)CC(F)(F)F	ZINC000450558811	FD	On-Demand	Anodyne	PSBA	0	43
COc1cccc(Oc2ccc(C(=O)NCC(=O)C3CC3)nc2)c1	ZINC000450558812	EF	On-Demand	Anodyne	DRD4	43	34
COc1cccc(Oc2ccc(C(=O)NCC(=O)C3CC3)nc2)c1	ZINC000450558812	EF	On-Demand	Anodyne	MTNR1A	50	44
COc1cccc(Oc2ccc(C(=O)NCC(=O)C3CC3)nc2)c1	ZINC000450558812	EF	On-Demand	Anodyne	MTNR1B	52	47
COc1cccc(Oc2ccc(C(=O)NCC(=O)C3CC3)nc2)c1	ZINC000450558812	EF	On-Demand	Anodyne	ROCK2	42	35
CCN1C(=O)C[C@H](C(=O)NCCCNc2cccc(F)c2)[C@H]1c1cccnc1	ZINC000450558814	GF	On-Demand	Anodyne	TBK1	25	43
CCS(=O)(=O)c1ccc(CN2CCc3ccc(S(=O)(=O)NC)cc32)cc1	ZINC000450558816	GD	On-Demand	Anodyne	TYMS	0	40
CC(C)O[C@@]1(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)CCOC1	ZINC000450558834	GF	On-Demand	Anodyne	EPHX2	28	43
CC(C)O[C@]1(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)CCOC1	ZINC000450558837	GF	On-Demand	Anodyne	EPHX2	28	43
CCc1cc(CCCN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)on1	ZINC000450558856	GI	On-Demand	Anodyne	ERBB4	45	35
CCc1cc(CCCN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)on1	ZINC000450558856	GI	On-Demand	Anodyne	MCHR1	46	43
O=C(N[C@H](CO)c1cccc(Br)c1)[C@H](O)C1CCC1	ZINC000450558857	ED	On-Demand	Anodyne	METAP2	0	51
O=C(N[C@H](CO)c1cccc(Br)c1)[C@@H](O)C1CCC1	ZINC000450558859	ED	On-Demand	Anodyne	METAP2	0	51
O=C(N[C@@H](CO)c1cccc(Br)c1)[C@H](O)C1CCC1	ZINC000450558861	ED	On-Demand	Anodyne	METAP2	0	51
O=C(N[C@@H](CO)c1cccc(Br)c1)[C@@H](O)C1CCC1	ZINC000450558862	ED	On-Demand	Anodyne	METAP2	0	51
C[C@H](c1csnn1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558864	DG	On-Demand	Anodyne	CCR2	24	43
C[C@@H](c1csnn1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450558865	DG	On-Demand	Anodyne	CCR2	24	43
Cc1nc(C)n(CCCC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450558866	GF	On-Demand	Anodyne	EPHX2	25	40
Cc1ccn2ncc(C(=O)N3C[C@H](C)CC(C)(C)C3)c2c1	ZINC000450558871	CG	On-Demand	Anodyne	EPHB3	24	42
Cc1ccn2ncc(C(=O)N3C[C@@H](C)CC(C)(C)C3)c2c1	ZINC000450558876	CG	On-Demand	Anodyne	EPHB3	24	42
COc1cc(CC(=O)Nc2ncn(C(C)(C)C)n2)ccc1Cl	ZINC000450558881	DF	On-Demand	Anodyne	TRPV1	0	40
O=C1CC[C@@H](CN2CCC[C@H]2C(=O)Nc2nccs2)CCN1	ZINC000450558883	DD	On-Demand	Anodyne	MAP1	49	37
CC(=O)c1cccc(CN2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)c1	ZINC000450558884	DH	On-Demand	Anodyne	SLC6A1	49	34
CC(=O)c1cccc(CN2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)c1	ZINC000450558884	DH	On-Demand	Anodyne	CHRM3	16	41
CC(=O)c1cccc(CN2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)c1	ZINC000450558885	DH	On-Demand	Anodyne	SLC6A1	49	34
CC(=O)c1cccc(CN2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)c1	ZINC000450558885	DH	On-Demand	Anodyne	CHRM3	16	41
O=C1CC[C@H](CN2CCC[C@@H]2C(=O)Nc2nccs2)CCN1	ZINC000450558886	DD	On-Demand	Anodyne	MAP1	49	37
O=C1CC[C@H](CN2CCC[C@H]2C(=O)Nc2nccs2)CCN1	ZINC000450558887	DD	On-Demand	Anodyne	MAP1	49	37
CC(=O)c1cccc(CN2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)c1	ZINC000450558889	DH	On-Demand	Anodyne	SLC6A1	43	34
CC(=O)c1cccc(CN2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)c1	ZINC000450558891	DH	On-Demand	Anodyne	SLC6A1	49	34
CC(=O)c1cccc(CN2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)c1	ZINC000450558891	DH	On-Demand	Anodyne	CHRM3	16	41
CC(C)c1nccc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)n1	ZINC000450558893	CF	On-Demand	Anodyne	SORD	121	49
CC[C@@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450558902	GJ	On-Demand	Anodyne	HTR1D	29	41
CC[C@@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450558902	GJ	On-Demand	Anodyne	HTR1B	25	41
CC[C@@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450558902	GJ	On-Demand	Anodyne	MPO	81	42
CC[C@@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450558902	GJ	On-Demand	Anodyne	ABCG2	24	40
CC[C@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450558905	GJ	On-Demand	Anodyne	HTR1D	29	41
CC[C@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450558905	GJ	On-Demand	Anodyne	HTR1B	25	41
CC[C@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450558905	GJ	On-Demand	Anodyne	MPO	81	42
CC[C@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450558905	GJ	On-Demand	Anodyne	ABCG2	24	40
COC(=O)C(C)(C)N(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450558906	FG	On-Demand	Anodyne	HDAC8	18	44
COC(=O)C(C)(C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450558922	FD	On-Demand	Anodyne	MTNR1A	55	39
CCOc1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450558923	CF	On-Demand	Anodyne	CACNA2D2	50	32
CCOc1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450558923	CF	On-Demand	Anodyne	MAL12	0	43
COCCOC[C@H](O)CN(Cc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450558928	FE	On-Demand	Anodyne	BMP1	66	44
COCCOC[C@@H](O)CN(Cc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450558929	FE	On-Demand	Anodyne	BMP1	66	44
COC(=O)C1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCCCC1	ZINC000450558940	FF	On-Demand	Anodyne	HCN1	62	42
COC(=O)C1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCCCC1	ZINC000450558940	FF	On-Demand	Anodyne	HCN4	57	38
C[C@H](CCNC(=O)c1ccn(CCc2ccccc2)n1)N1CCCCC1	ZINC000450559001	FG	On-Demand	Anodyne	CCR5	21	42
C[C@@H](CCNC(=O)c1ccn(CCc2ccccc2)n1)N1CCCCC1	ZINC000450559002	FG	On-Demand	Anodyne	CCR5	21	42
Cc1ccc(C(=O)NCC2(CO)CCC2)c(Cl)c1Cl	ZINC000450559007	DG	On-Demand	Anodyne	HCN1	49	30
Cc1ccc(C(=O)NCC2(CO)CCC2)c(Cl)c1Cl	ZINC000450559007	DG	On-Demand	Anodyne	HCN4	47	30
COC(=O)[C@@H]1CN(c2cc([N+](=O)[O-])ccc2C(C)=O)C[C@H]1c1ccc(O)cc1	ZINC000450559029	GF	On-Demand	Bother	SLC6A1	29	41
COC(=O)[C@@H]1CN(c2cc([N+](=O)[O-])ccc2C(C)=O)C[C@H]1c1ccc(O)cc1	ZINC000450559029	GF	On-Demand	Bother	SLC6A3	15	42
CS[C@H](CNC(=O)Cc1ccc(OC(F)F)c(F)c1)C(C)(C)C	ZINC000450559030	EH	On-Demand	Anodyne	TRPV1	24	40
CS[C@@H](CNC(=O)Cc1ccc(OC(F)F)c(F)c1)C(C)(C)C	ZINC000450559031	EH	On-Demand	Anodyne	TRPV1	24	40
CCc1cc(CCCN[C@H](C(=O)OC)c2ccccc2)on1	ZINC000450559034	DF	On-Demand	Anodyne	SOAT1	16	41
CCc1cc(CCCN[C@@H](C(=O)OC)c2ccccc2)on1	ZINC000450559035	DF	On-Demand	Anodyne	SOAT1	16	41
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	HTR1A	32	59
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	DRD2	39	58
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	DRD1	27	58
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	DRD4	34	51
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	HTR1D	24	42
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	HTR1B	27	42
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	HTR2A	46	51
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	HTR2C	36	48
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	ADRA1B	17	42
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	DRD3	29	58
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	P2RY12	15	43
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	ERG2	22	46
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	HTR7	39	44
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	SIGMAR1	15	51
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	CCKAR	0	40
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	CCR3	67	42
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	PYGL	0	40
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	SLC18A3	0	47
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	HTR3B	0	46
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	CCKBR	0	40
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	EPHX2	26	41
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	MCHR1	34	53
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	CYP2J2	53	41
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	P2RY14	46	39
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	LIMK2	16	46
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	AP2S1	0	44
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	KCNK3	57	39
Cc1cccc(NC(=O)N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450559038	GH	On-Demand	Anodyne	KCNK9	42	39
COC(=O)[C@@H]1CN(c2ccc3nnc([C@H]4C[C@H]4C)n3n2)C[C@H]1c1ccc(O)cc1	ZINC000450559050	GE	On-Demand	Anodyne	SLC6A1	72	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@@H]4C[C@@H]4C)n3n2)C[C@H]1c1ccc(O)cc1	ZINC000450559051	GE	On-Demand	Anodyne	SLC6A1	72	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@H]4C[C@@H]4C)n3n2)C[C@H]1c1ccc(O)cc1	ZINC000450559052	GE	On-Demand	Anodyne	SLC6A1	72	40
COC(=O)[C@@H]1CN(c2ccc3nnc([C@@H]4C[C@H]4C)n3n2)C[C@H]1c1ccc(O)cc1	ZINC000450559053	GE	On-Demand	Anodyne	SLC6A1	72	40
CCN(CCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1)CC1CC1	ZINC000450559055	FG	On-Demand	Anodyne	L3MBTL1	0	40
CCN(CCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1)CC1CC1	ZINC000450559055	FG	On-Demand	Anodyne	L3MBTL3	60	37
Cc1cccc(NC(=O)N2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450559059	ED	On-Demand	Anodyne	KCNK3	46	37
Cc1cccc(NC(=O)N2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450559059	ED	On-Demand	Anodyne	KCNK9	46	37
Cc1cccc(NC(=O)N2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450559060	ED	On-Demand	Anodyne	KCNK3	46	37
Cc1cccc(NC(=O)N2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450559060	ED	On-Demand	Anodyne	KCNK9	46	37
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H](O)[C@@H](C)c3ccccc3)C2)cc1	ZINC000450559072	GH	On-Demand	Anodyne	CCR3	67	39
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@H](O)[C@H](C)c3ccccc3)C2)cc1	ZINC000450559074	GH	On-Demand	Anodyne	CCR3	67	39
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H](O)[C@@H](C)c3ccccc3)C2)cc1	ZINC000450559076	GH	On-Demand	Anodyne	CCR3	67	39
Cc1ccc(NC(=O)NC[C@@H]2CCCN(C[C@@H](O)[C@H](C)c3ccccc3)C2)cc1	ZINC000450559078	GH	On-Demand	Anodyne	CCR3	67	39
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450559098	FH	On-Demand	Anodyne	CCR3	96	48
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450559098	FH	On-Demand	Anodyne	EPHX2	45	39
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450559099	FH	On-Demand	Anodyne	CCR3	96	48
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450559099	FH	On-Demand	Anodyne	EPHX2	45	39
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450559100	FH	On-Demand	Anodyne	CCR3	96	48
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450559100	FH	On-Demand	Anodyne	EPHX2	45	39
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450559101	FH	On-Demand	Anodyne	CCR3	96	48
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450559101	FH	On-Demand	Anodyne	EPHX2	45	39
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450559109	ED	On-Demand	Anodyne	NPY1R	41	34
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450559109	ED	On-Demand	Anodyne	NPY2R	58	38
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450559112	EG	On-Demand	Anodyne	CCR3	99	46
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450559112	EG	On-Demand	Anodyne	EPHX2	44	39
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450559113	EG	On-Demand	Anodyne	CCR3	99	46
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450559113	EG	On-Demand	Anodyne	EPHX2	44	39
C[C@H](CCO)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450559114	ED	On-Demand	Anodyne	NPY1R	41	34
C[C@H](CCO)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450559114	ED	On-Demand	Anodyne	NPY2R	58	38
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450559115	EG	On-Demand	Anodyne	CCR3	99	46
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450559115	EG	On-Demand	Anodyne	EPHX2	44	39
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450559117	EG	On-Demand	Anodyne	CCR3	99	46
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450559117	EG	On-Demand	Anodyne	EPHX2	44	39
CCOC(=O)c1cc(NCc2n[nH]c(CC)n2)ncc1Cl	ZINC000450559118	DE	On-Demand	Anodyne	CACNA1C	75	41
Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1-c1nnnn1C1CC1	ZINC000450559130	GG	On-Demand	Anodyne	MAPK14	18	42
Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1-c1nnnn1C1CC1	ZINC000450559130	GG	On-Demand	Anodyne	HSPB1	0	41
COC(=O)[C@@H]1CN(c2nc3cccc(C)c3s2)C[C@H]1c1ccc(O)cc1	ZINC000450559140	FH	On-Demand	Anodyne	SLC6A1	47	42
COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C[C@H]1CCNC(=O)CC1	ZINC000450559148	FG	On-Demand	Anodyne	TACR2	41	33
COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)C[C@H]1CCNC(=O)CC1	ZINC000450559150	FG	On-Demand	Anodyne	TACR2	41	33
C[C@H](CCNC(=O)c1ccc(C(C)(F)F)nc1)N1CCCCC1	ZINC000450559151	EG	On-Demand	Anodyne	EPHX2	0	40
COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C[C@@H]1CCNC(=O)CC1	ZINC000450559152	FG	On-Demand	Anodyne	TACR2	41	33
C[C@@H](CCNC(=O)c1ccc(C(C)(F)F)nc1)N1CCCCC1	ZINC000450559153	EG	On-Demand	Anodyne	EPHX2	0	40
COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)C[C@@H]1CCNC(=O)CC1	ZINC000450559154	FG	On-Demand	Anodyne	TACR2	41	33
C[C@@H]1[C@H](NC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCCN1C	ZINC000450559156	EH	On-Demand	Anodyne	PRCP	45	35
C[C@@H]1[C@H](NC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCCN1C	ZINC000450559159	EH	On-Demand	Anodyne	PRCP	45	35
C[C@@H]1[C@H](NC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCCN1C	ZINC000450559160	EH	On-Demand	Anodyne	PRCP	45	35
C[C@@H]1[C@H](NC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCCN1C	ZINC000450559161	EH	On-Demand	Anodyne	PRCP	45	35
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450559169	FE	On-Demand	Anodyne	GALR1	45	32
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450559170	FE	On-Demand	Anodyne	GALR1	45	32
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450559171	FE	On-Demand	Anodyne	GALR1	45	32
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450559172	FE	On-Demand	Anodyne	GALR1	45	32
C[C@H](OCCc1ccccc1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450559190	FE	On-Demand	Anodyne	GALR1	47	34
COC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)cc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450559192	GH	On-Demand	Mild	LIPG	46	33
C[C@H](OCCc1ccccc1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450559196	FE	On-Demand	Anodyne	GALR1	47	34
C[C@@H](OCCc1ccccc1)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450559197	FE	On-Demand	Anodyne	GALR1	47	34
C[C@@H](OCCc1ccccc1)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450559198	FE	On-Demand	Anodyne	GALR1	47	34
CC(=O)[C@@](C)(O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450559201	ED	On-Demand	Anodyne	SORD	66	38
CC(=O)[C@](C)(O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450559202	ED	On-Demand	Anodyne	SORD	66	38
CCOC(=O)[C@@H](C)N(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450559205	DD	On-Demand	Anodyne	CA4	28	41
CCOC(=O)[C@@H](C)N(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450559205	DD	On-Demand	Anodyne	RORC	22	44
CCOC(=O)[C@H](C)N(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450559206	DD	On-Demand	Anodyne	CA4	28	41
CCOC(=O)[C@H](C)N(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450559206	DD	On-Demand	Anodyne	RORC	22	44
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)c2cccc(O)c2)cc1	ZINC000450559215	EG	On-Demand	Anodyne	HSD17B2	15	41
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)c2cccc(O)c2)cc1	ZINC000450559216	EG	On-Demand	Anodyne	HSD17B2	15	41
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	HTR1A	41	50
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	DRD2	53	53
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	DRD1	22	44
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	DRD4	65	49
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	ACHE	29	59
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	HTR2A	25	52
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	HTR2C	23	41
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	DRD3	80	53
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	GCGR	25	40
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	HTR4	21	42
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	LTA4H	24	40
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	HRP1_PLAFA	23	47
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	HRH3	24	42
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	SIGMAR1	36	49
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	MMP13	27	43
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	CCR3	20	45
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	ADAM17	21	43
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	PLD1	49	49
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	HDAC6	22	45
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	CYP2D6	0	40
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	MMP9	21	41
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	PLD2	76	37
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	MMP1	23	43
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	MCHR1	45	57
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	CACNA1G	35	47
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	PROKR1	61	33
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	NOD1	31	51
COc1ccc(C(=O)NCCN2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000450559225	GE	On-Demand	Anodyne	NOD2	49	51
Cc1cc(NCCCC2CCOCC2)nc(-c2cccnc2)n1	ZINC000450559234	DF	On-Demand	Anodyne	ROS1	66	42
CC(C)OC(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559270	EI	On-Demand	Anodyne	CACNA1B	58	40
CC(C)OC(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559270	EI	On-Demand	Anodyne	CCR2	63	46
CC(C)OC(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559270	EI	On-Demand	Anodyne	RBP4	33	41
CC(C)OC(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559271	EI	On-Demand	Anodyne	CACNA1B	58	40
CC(C)OC(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559271	EI	On-Demand	Anodyne	CCR2	63	46
CC(C)OC(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559271	EI	On-Demand	Anodyne	RBP4	33	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450559272	GJ	On-Demand	Anodyne	CACNA1B	41	34
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450559272	GJ	On-Demand	Anodyne	CCR2	38	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450559272	GJ	On-Demand	Anodyne	RBP4	32	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450559273	GJ	On-Demand	Anodyne	CACNA1B	41	34
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450559273	GJ	On-Demand	Anodyne	CCR2	38	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450559273	GJ	On-Demand	Anodyne	RBP4	32	40
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559274	FJ	On-Demand	Anodyne	CACNA1B	48	36
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559274	FJ	On-Demand	Anodyne	CCR2	72	46
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559274	FJ	On-Demand	Anodyne	RBP4	23	41
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559279	FJ	On-Demand	Anodyne	CACNA1B	48	36
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559279	FJ	On-Demand	Anodyne	CCR2	72	46
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559279	FJ	On-Demand	Anodyne	RBP4	23	41
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559281	FJ	On-Demand	Anodyne	CACNA1B	48	36
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559281	FJ	On-Demand	Anodyne	CCR2	72	46
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559281	FJ	On-Demand	Anodyne	RBP4	23	41
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559282	FJ	On-Demand	Anodyne	CACNA1B	48	36
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559282	FJ	On-Demand	Anodyne	CCR2	72	46
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450559282	FJ	On-Demand	Anodyne	RBP4	23	41
COC(=O)c1ccc(CC(=O)NCC2(c3ccc(OC)cc3)CCC2)cc1	ZINC000450559283	FG	On-Demand	Anodyne	KCNA3	38	44
COC(=O)c1ccc(CC(=O)NCC2(c3ccc(OC)cc3)CCC2)cc1	ZINC000450559283	FG	On-Demand	Anodyne	MTNR1A	26	45
COC(=O)c1ccc(CC(=O)NCC2(c3ccc(OC)cc3)CCC2)cc1	ZINC000450559283	FG	On-Demand	Anodyne	MTNR1B	17	46
COC(=O)c1ccc(CC(=O)NCC2(c3ccc(OC)cc3)CCC2)cc1	ZINC000450559283	FG	On-Demand	Anodyne	CA9	17	41
COC(=O)c1ccc(CC(=O)NCC2(c3ccc(OC)cc3)CCC2)cc1	ZINC000450559283	FG	On-Demand	Anodyne	ACAT	0	51
NS(=O)(=O)c1ccc(NC[C@H](O)Cc2cccc(F)c2)c(C(F)(F)F)c1	ZINC000450559300	GF	On-Demand	Anodyne	CA5A	42	39
NS(=O)(=O)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)c(C(F)(F)F)c1	ZINC000450559301	GF	On-Demand	Anodyne	CA5A	42	39
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	CHRM2	20	47
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	DRD2	23	48
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	DRD4	54	48
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	ACHE	49	53
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	OPRM1	15	44
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	DRD3	23	48
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	LTA4H	26	44
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	HRH3	23	45
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	SIGMAR1	68	50
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	CCR3	27	42
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	CCR5	59	45
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	SLC18A3	20	41
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	MCHR1	34	40
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	CACNA1G	27	44
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	CYP2J2	45	32
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	MBTPS1	56	38
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1ccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)cc1	ZINC000450559312	GI	On-Demand	Anodyne	ADIPOR2	0	41
CCOC(=O)c1cccnc1NC[C@@H](O)Cc1cccc(F)c1	ZINC000450559317	DE	On-Demand	Anodyne	PPIA	22	40
CC[C@H](O)CC(=O)N[C@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000450559318	CE	On-Demand	Anodyne	HMGCR	51	33
CCOC(=O)c1cccnc1NC[C@H](O)Cc1cccc(F)c1	ZINC000450559319	DE	On-Demand	Anodyne	PPIA	22	40
CC[C@H](O)CC(=O)N[C@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000450559324	CE	On-Demand	Anodyne	HMGCR	51	33
CC[C@H](O)CC(=O)N[C@@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000450559325	CE	On-Demand	Anodyne	HMGCR	51	33
CC[C@H](O)CC(=O)N[C@@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000450559327	CE	On-Demand	Anodyne	HMGCR	51	33
CO[C@@H](Cc1ccccc1)CN1CCc2ccc(O)cc2C1	ZINC000450559336	CG	On-Demand	Anodyne	ABCB1	23	42
CO[C@@H](Cc1ccccc1)CN1CCc2ccc(O)cc2C1	ZINC000450559336	CG	On-Demand	Anodyne	SLC6A5	17	42
CO[C@H](Cc1ccccc1)CN1CCc2ccc(O)cc2C1	ZINC000450559337	CG	On-Demand	Anodyne	ABCB1	23	42
CO[C@H](Cc1ccccc1)CN1CCc2ccc(O)cc2C1	ZINC000450559337	CG	On-Demand	Anodyne	SLC6A5	17	42
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559338	FE	On-Demand	Anodyne	OPRM1	23	43
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559338	FE	On-Demand	Anodyne	OPRD1	21	40
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559338	FE	On-Demand	Anodyne	OPRK1	25	40
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559338	FE	On-Demand	Anodyne	TRY2_BOVIN	56	36
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559338	FE	On-Demand	Anodyne	ABCB1	39	41
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559338	FE	On-Demand	Anodyne	PARP1	20	42
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559339	FE	On-Demand	Anodyne	OPRM1	23	43
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559339	FE	On-Demand	Anodyne	OPRD1	21	40
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559339	FE	On-Demand	Anodyne	OPRK1	25	40
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559339	FE	On-Demand	Anodyne	TRY2_BOVIN	56	36
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559339	FE	On-Demand	Anodyne	ABCB1	39	41
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000450559339	FE	On-Demand	Anodyne	PARP1	20	42
Cc1cccc(Cl)c1C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000450559340	FI	On-Demand	Anodyne	F10	16	41
Cc1cccc(Cl)c1C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000450559340	FI	On-Demand	Anodyne	SSTR1	18	41
COc1ccc(C2(CNC(=O)CCCC(=O)C3CC3)CCC2)cc1	ZINC000450559351	EG	On-Demand	Anodyne	MTNR1A	32	46
COc1ccc(C2(CNC(=O)CCCC(=O)C3CC3)CCC2)cc1	ZINC000450559351	EG	On-Demand	Anodyne	MTNR1B	24	46
COc1ccc(C2(CNC(=O)CCCC(=O)C3CC3)CCC2)cc1	ZINC000450559351	EG	On-Demand	Anodyne	ACAT	0	48
COc1ccc(C2(CNC(=O)CCCC(=O)C3CC3)CCC2)cc1	ZINC000450559351	EG	On-Demand	Anodyne	NPBWR1	43	30
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCCCC2(F)F)cc1	ZINC000450559352	EG	On-Demand	Anodyne	EPHX2	18	53
COc1ccc(C2(CNC(=O)[C@H](C)Oc3ccccn3)CCC2)cc1	ZINC000450559353	EG	On-Demand	Anodyne	ACAT	0	51
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCCCC2(F)F)cc1	ZINC000450559354	EG	On-Demand	Anodyne	EPHX2	18	53
COc1ccc(C2(CNC(=O)[C@@H](C)Oc3ccccn3)CCC2)cc1	ZINC000450559355	EG	On-Demand	Anodyne	ACAT	0	51
COc1ccc(-c2nnc(SCC3CC(F)(F)C3)o2)cc1	ZINC000450559360	DH	On-Demand	Anodyne	GSK3B	0	52
Cc1nn(C)cc1CC(=O)N1CCCCc2cc(Br)ccc21	ZINC000450559362	FG	On-Demand	Anodyne	EIF2AK3	65	36
COc1ccc(CNC(=O)CCN2CCNC(=O)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450559364	GD	On-Demand	Anodyne	MTNR1A	46	34
COc1ccc(CNC(=O)CCN2CCNC(=O)[C@H]2c2ccccc2)c(OC)c1	ZINC000450559365	GD	On-Demand	Anodyne	MTNR1A	46	34
COc1ccc(C2(CNC(=O)CCc3nc4cnccc4[nH]3)CCC2)cc1	ZINC000450559366	FG	On-Demand	Anodyne	MTNR1A	18	44
O=C1CC[C@@H](CN2CCC[C@@H]2C(=O)Nc2nccs2)CCN1	ZINC000450559382	DD	On-Demand	Anodyne	MAP1	49	37
COc1ccc(C2(CNC(=O)c3cn(CC(C)C)nc3C(F)F)CCC2)cc1	ZINC000450559384	GI	On-Demand	Anodyne	KCNA3	46	38
COc1ccc(C2(CNC(=O)c3cn(CC(C)C)nc3C(F)F)CCC2)cc1	ZINC000450559384	GI	On-Demand	Anodyne	ACAT	0	48
CCC(=O)CCCN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450559385	CE	On-Demand	Anodyne	MAP1	96	39
CCC(=O)CCCN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450559387	CE	On-Demand	Anodyne	MAP1	96	39
CCc1cc(CCCN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)on1	ZINC000450559391	GI	On-Demand	Anodyne	CCR5	42	41
CCc1cc(CCCN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)on1	ZINC000450559391	GI	On-Demand	Anodyne	CYP2J2	48	35
FC1(F)CCCC[C@@H]1Cn1nnc(-c2ccccc2)n1	ZINC000450559393	CG	On-Demand	Anodyne	SCARB1	41	41
CCc1cc(CCCN2CCN(c3ncccc3Cl)CC2)on1	ZINC000450559399	EG	On-Demand	Anodyne	DRD2	27	49
CCc1cc(CCCN2CCN(c3ncccc3Cl)CC2)on1	ZINC000450559399	EG	On-Demand	Anodyne	DRD4	25	43
CCc1cc(CCCN2CCN(c3ncccc3Cl)CC2)on1	ZINC000450559399	EG	On-Demand	Anodyne	DRD3	24	43
FC1(F)CCCC[C@H]1Cn1nnc(-c2ccccc2)n1	ZINC000450559403	CG	On-Demand	Anodyne	SCARB1	41	41
CCOC(=O)c1ccc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)nc1	ZINC000450559404	GF	On-Demand	Anodyne	P2RY12	40	41
CCOC(=O)c1ccc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)nc1	ZINC000450559404	GF	On-Demand	Anodyne	PTR1	44	39
CCOC(=O)c1ccc(CN(C)C2CCN(C(=O)c3ccccc3)CC2)nc1	ZINC000450559404	GF	On-Demand	Anodyne	L3MBTL3	65	39
CC(C)(O)C(C)(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450559406	CD	On-Demand	Anodyne	HPGDS	18	47
COC(=O)c1ccc(CN2CCC[C@H]2C(=O)Nc2nccs2)cc1Cl	ZINC000450559412	GG	On-Demand	Anodyne	MAP1	102	35
COC(=O)c1ccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)cc1Cl	ZINC000450559413	GG	On-Demand	Anodyne	MAP1	102	35
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC(C)(C)C(C)(C)O	ZINC000450559418	EF	On-Demand	Anodyne	MAP3K5	43	32
C[C@H]1[C@@H](C)N(C)CCN1C(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450559426	DG	On-Demand	Anodyne	PREP	30	43
C[C@H]1[C@@H](C)N(C)CCN1C(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450559427	DG	On-Demand	Anodyne	PREP	30	43
C[C@H]1[C@@H](C)N(C)CCN1C(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450559428	DG	On-Demand	Anodyne	PREP	30	43
C[C@H]1[C@@H](C)N(C)CCN1C(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450559429	DG	On-Demand	Anodyne	PREP	30	43
Cc1nn(C)cc1CC(=O)NCCCNc1ccccc1F	ZINC000450559439	DE	On-Demand	Anodyne	P2RX7	42	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCCCNc1cccc(F)c1	ZINC000450559440	CG	On-Demand	Anodyne	TBK1	20	40
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCCCNc1cccc(F)c1	ZINC000450559441	CG	On-Demand	Anodyne	TBK1	15	40
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCCCNc1cccc(F)c1	ZINC000450559442	CG	On-Demand	Anodyne	TBK1	15	40
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCCCNc1cccc(F)c1	ZINC000450559443	CG	On-Demand	Anodyne	TBK1	20	40
CN(CCc1ccccc1O)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450559464	FI	On-Demand	Anodyne	RBP4	67	35
COC(=O)c1coc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)n1	ZINC000450559483	ED	On-Demand	Mild	PTAFR	49	45
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	CA2	80	47
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	CA1	66	41
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	CA7	51	40
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	CA5B	45	38
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	CA4	84	47
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	CA5A	51	38
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	CYNT	43	38
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	MTCA1	40	36
CC(F)(F)C(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450559489	DD	On-Demand	Anodyne	P96878_MYCTU	55	36
COC(=O)c1coc(CN2CCN([C@H](C#N)c3ccccc3)CC2)n1	ZINC000450559491	ED	On-Demand	Mild	PTAFR	49	45
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CCc2cscn2)CC1	ZINC000450559502	EE	On-Demand	Bother	KCNJ1	28	43
C[C@@H]1[C@@H](C)N(C(=O)c2ccccc2-n2cc(Br)cn2)CCN1C	ZINC000450559510	GF	On-Demand	Anodyne	HCRTR1	52	39
C[C@@H]1[C@@H](C)N(C(=O)c2ccccc2-n2cc(Br)cn2)CCN1C	ZINC000450559510	GF	On-Demand	Anodyne	HCRTR2	55	39
C[C@H]1[C@@H](C)N(C)CCN1C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450559511	GF	On-Demand	Anodyne	HCRTR1	52	39
C[C@H]1[C@@H](C)N(C)CCN1C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450559511	GF	On-Demand	Anodyne	HCRTR2	55	39
C[C@H]1[C@@H](C)N(C(=O)c2ccccc2-n2cc(Br)cn2)CCN1C	ZINC000450559512	GF	On-Demand	Anodyne	HCRTR1	52	39
C[C@H]1[C@@H](C)N(C(=O)c2ccccc2-n2cc(Br)cn2)CCN1C	ZINC000450559512	GF	On-Demand	Anodyne	HCRTR2	55	39
C[C@H]1[C@H](C)N(C(=O)c2ccccc2-n2cc(Br)cn2)CCN1C	ZINC000450559513	GF	On-Demand	Anodyne	HCRTR1	52	39
C[C@H]1[C@H](C)N(C(=O)c2ccccc2-n2cc(Br)cn2)CCN1C	ZINC000450559513	GF	On-Demand	Anodyne	HCRTR2	55	39
CCn1c(SCc2nc(C(=O)OC)cs2)nnc1-c1cccs1	ZINC000450559514	FH	On-Demand	Anodyne	LRRK2	0	43
CCn1c(SCc2nc(C(=O)OC)cs2)nnc1-c1cccs1	ZINC000450559514	FH	On-Demand	Anodyne	SLC27A1	47	42
CCOCc1nc(C)c(C(=O)NCCCNc2cccc(F)c2)s1	ZINC000450559534	FG	On-Demand	Anodyne	SCD1	27	40
CCOCc1nc(C)c(C(=O)NCCCNc2cccc(F)c2)s1	ZINC000450559534	FG	On-Demand	Anodyne	SCD	20	40
NS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450559548	GE	On-Demand	Anodyne	CYP2J2	48	34
NS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450559549	GE	On-Demand	Anodyne	CYP2J2	48	34
CN(C[C@@H]1C[C@H]2CC[C@H]1O2)C1CCN(Cc2ccccc2)CC1	ZINC000450559552	DG	On-Demand	Anodyne	ACHE	35	47
CN(C[C@@H]1C[C@H]2CC[C@H]1O2)C1CCN(Cc2ccccc2)CC1	ZINC000450559552	DG	On-Demand	Anodyne	SIGMAR1	60	48
CN(C[C@H]1C[C@H]2CC[C@H]1O2)C1CCN(Cc2ccccc2)CC1	ZINC000450559553	DG	On-Demand	Anodyne	ACHE	35	47
CN(C[C@H]1C[C@H]2CC[C@H]1O2)C1CCN(Cc2ccccc2)CC1	ZINC000450559553	DG	On-Demand	Anodyne	SIGMAR1	60	48
C[C@@H](c1ccc(Cn2cc(C(F)(F)F)ccc2=O)cc1)C(F)(F)F	ZINC000450559565	EJ	On-Demand	Anodyne	PTGDR	0	40
C[C@H](c1ccc(Cn2cc(C(F)(F)F)ccc2=O)cc1)C(F)(F)F	ZINC000450559567	EJ	On-Demand	Anodyne	PTGDR	0	40
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559568	FE	On-Demand	Anodyne	NPY2R	48	39
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559568	FE	On-Demand	Anodyne	MAPK1	34	42
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559568	FE	On-Demand	Anodyne	EPHX2	31	45
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559568	FE	On-Demand	Anodyne	TYK2	48	38
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559568	FE	On-Demand	Anodyne	ERBB4	40	33
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559568	FE	On-Demand	Anodyne	ENV	40	32
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559568	FE	On-Demand	Anodyne	MCHR1	40	41
CC(=O)[C@@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559568	FE	On-Demand	Anodyne	CACNA1I	52	35
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559569	FE	On-Demand	Anodyne	NPY2R	48	39
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559569	FE	On-Demand	Anodyne	MAPK1	34	42
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559569	FE	On-Demand	Anodyne	EPHX2	31	45
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559569	FE	On-Demand	Anodyne	TYK2	48	38
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559569	FE	On-Demand	Anodyne	ERBB4	40	33
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559569	FE	On-Demand	Anodyne	ENV	40	32
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559569	FE	On-Demand	Anodyne	MCHR1	40	41
CC(=O)[C@](C)(O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450559569	FE	On-Demand	Anodyne	CACNA1I	52	35
COC(=O)C1CCC(NC(=O)c2cn3nccc3nc2C)(C(=O)OC)CC1	ZINC000450559572	FD	On-Demand	Anodyne	DDR1	42	36
CCOC(=O)C(C)(C)N(C)CC1CCC(=O)CC1	ZINC000450559579	CE	On-Demand	Anodyne	AMY2	44	31
Cc1ccc(C(=O)N[C@@H](CO)c2ccc(Br)cc2)c(C)n1	ZINC000450559605	EF	On-Demand	Anodyne	UTS2	40	33
Cc1ccc(C(=O)N[C@H](CO)c2ccc(Br)cc2)c(C)n1	ZINC000450559611	EF	On-Demand	Anodyne	UTS2	40	33
COc1cccc(OCCC(=O)N2CCC(O)(CN3CCOCC3)CC2)c1	ZINC000450559612	GD	On-Demand	Anodyne	DRD4	40	32
COc1cccc(OCCC(=O)N2CCC(O)(CN3CCOCC3)CC2)c1	ZINC000450559612	GD	On-Demand	Anodyne	EPHX2	19	41
CCOC(=O)[C@H]1CN(c2cc(C(F)(F)F)ccn2)CC12COC2	ZINC000450559617	EE	On-Demand	Anodyne	CCR2	16	43
CCOC(=O)[C@@H]1CN(c2cc(C(F)(F)F)ccn2)CC12COC2	ZINC000450559620	EE	On-Demand	Anodyne	CCR2	16	43
Cc1cccc(Cl)c1C(=O)N1CCC(O)(CN2CCOCC2)CC1	ZINC000450559660	FD	On-Demand	Anodyne	CCR5	59	42
CC(C)N(CC[C@@H](C)O)CC(=O)Nc1ccc(F)cc1	ZINC000450559665	CE	On-Demand	Anodyne	LTA4H	0	41
CC(C)N(CC[C@H](C)O)CC(=O)Nc1ccc(F)cc1	ZINC000450559667	CE	On-Demand	Anodyne	LTA4H	0	41
CC[C@@H]1C[C@H]1C(=O)NCc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2CC)cc1	ZINC000450559679	EH	On-Demand	Anodyne	SDH1	0	45
CC[C@@H]1C[C@H]1C(=O)NCc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]2CC)cc1	ZINC000450559680	EH	On-Demand	Anodyne	SDH1	0	45
CNC(=O)CN(Cc1cccc(C(C)=O)c1)Cc1cccc(C(F)(F)F)c1	ZINC000450559706	GH	On-Demand	Anodyne	CCR2	41	36
CNC(=O)CN(Cc1cccc(C(C)=O)c1)Cc1cccc(C(F)(F)F)c1	ZINC000450559706	GH	On-Demand	Anodyne	IMDH_CRYPV	20	40
CNC(=O)CN(Cc1cccc(C(C)=O)c1)Cc1cccc(C(F)(F)F)c1	ZINC000450559706	GH	On-Demand	Anodyne	KCNK3	19	41
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc1	ZINC000450559721	FF	On-Demand	Anodyne	SIGMAR1	25	42
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc1	ZINC000450559721	FF	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)cc1	ZINC000450559721	FF	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc1	ZINC000450559723	FF	On-Demand	Anodyne	SIGMAR1	25	42
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc1	ZINC000450559723	FF	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)cc1	ZINC000450559723	FF	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)cc1	ZINC000450559725	FF	On-Demand	Anodyne	SIGMAR1	25	42
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)cc1	ZINC000450559725	FF	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)cc1	ZINC000450559725	FF	On-Demand	Anodyne	ADIPOR2	0	40
COC(=O)C1CCC(NC(=O)c2cc3ccncc3s2)(C(=O)OC)CC1	ZINC000450559726	GE	On-Demand	Anodyne	TACR2	43	36
COC(=O)C1CCC(NC(=O)c2cc3ccncc3s2)(C(=O)OC)CC1	ZINC000450559726	GE	On-Demand	Anodyne	SELE	41	35
COC(=O)C1CCC(NC(=O)c2cc3ccncc3s2)(C(=O)OC)CC1	ZINC000450559726	GE	On-Demand	Anodyne	VCAM1	46	35
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)cc1	ZINC000450559727	FF	On-Demand	Anodyne	SIGMAR1	25	42
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)cc1	ZINC000450559727	FF	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1ccc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)cc1	ZINC000450559727	FF	On-Demand	Anodyne	ADIPOR2	0	40
CC(C)N(CC[C@@H](C)O)CC(=O)Nc1ccccc1C(F)(F)F	ZINC000450559728	EG	On-Demand	Anodyne	RBP4	41	36
CC(C)N(CC[C@H](C)O)CC(=O)Nc1ccccc1C(F)(F)F	ZINC000450559730	EG	On-Demand	Anodyne	RBP4	41	36
CCOC(=O)[C@H]1CN(c2ccnc(C(C)C)n2)CC12COC2	ZINC000450559732	DD	On-Demand	Anodyne	SORD	55	33
C[C@H]1Cc2cc(F)ccc2[C@H](C)N1C(=O)c1ccc(N2CCC2)nc1	ZINC000450559734	EH	On-Demand	Anodyne	HCRTR2	0	42
C[C@H]1c2ccc(F)cc2C[C@@H](C)N1C(=O)c1ccc(N2CCC2)nc1	ZINC000450559735	EH	On-Demand	Anodyne	HCRTR2	0	42
C[C@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1ccc(N2CCC2)nc1	ZINC000450559736	EH	On-Demand	Anodyne	HCRTR2	0	42
C[C@@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1ccc(N2CCC2)nc1	ZINC000450559737	EH	On-Demand	Anodyne	HCRTR2	0	42
CCOC(=O)[C@@H]1CN(c2ccnc(C(C)C)n2)CC12COC2	ZINC000450559740	DD	On-Demand	Anodyne	SORD	55	33
COc1cc(CC(=O)Nc2ncn(C3CCCCC3)n2)ccc1O	ZINC000450559767	EF	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)Nc2ncn(C3CCCCC3)n2)ccc1O	ZINC000450559767	EF	On-Demand	Anodyne	CRK3	0	46
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)C1	ZINC000450559776	GE	On-Demand	Anodyne	ACOX1	41	36
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)C1	ZINC000450559776	GE	On-Demand	Anodyne	BIRC2	54	36
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450559777	GE	On-Demand	Anodyne	ACOX1	41	36
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450559777	GE	On-Demand	Anodyne	BIRC2	54	36
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)C1	ZINC000450559778	GE	On-Demand	Anodyne	ACOX1	41	36
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)C1	ZINC000450559778	GE	On-Demand	Anodyne	BIRC2	54	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450559780	GE	On-Demand	Anodyne	ACOX1	41	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1	ZINC000450559780	GE	On-Demand	Anodyne	BIRC2	54	36
C[C@H](O)CCN1CCc2[nH]c3ccc(Cl)cc3c2C1	ZINC000450559786	CF	On-Demand	Anodyne	HTR5A	15	43
C[C@@H](O)CCN1CCc2[nH]c3ccc(Cl)cc3c2C1	ZINC000450559788	CF	On-Demand	Anodyne	HTR5A	15	43
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)C[C@@H]1CCCCO1	ZINC000450559801	EG	On-Demand	Anodyne	RORC	15	48
CCCN(Cc1ccc(S(=O)(=O)CC)cc1)C[C@H]1CCCCO1	ZINC000450559802	EG	On-Demand	Anodyne	RORC	15	48
CNS(=O)(=O)c1ccc(N2CCC[C@@](C)(F)C2)c(F)c1	ZINC000450559804	DE	On-Demand	Anodyne	SLC6A9	16	42
CNS(=O)(=O)c1ccc(N2CCC[C@](C)(F)C2)c(F)c1	ZINC000450559805	DE	On-Demand	Anodyne	SLC6A9	16	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H]1CC1(F)F	ZINC000450559806	EG	On-Demand	Anodyne	HTR1A	28	43
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H]1CC1(F)F	ZINC000450559806	EG	On-Demand	Anodyne	HTR1B	24	41
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H]1CC1(F)F	ZINC000450559806	EG	On-Demand	Anodyne	SLC6A4	0	47
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H]1CC1(F)F	ZINC000450559806	EG	On-Demand	Anodyne	MPO	74	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1CC1(F)F	ZINC000450559807	EG	On-Demand	Anodyne	HTR1A	28	43
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1CC1(F)F	ZINC000450559807	EG	On-Demand	Anodyne	HTR1B	24	41
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1CC1(F)F	ZINC000450559807	EG	On-Demand	Anodyne	SLC6A4	0	47
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H]1CC1(F)F	ZINC000450559807	EG	On-Demand	Anodyne	MPO	74	42
CCC[C@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559816	FG	On-Demand	Anodyne	HTR1A	22	43
CCC[C@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559816	FG	On-Demand	Anodyne	HTR1D	48	43
CCC[C@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559816	FG	On-Demand	Anodyne	HTR1B	35	43
CCC[C@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559816	FG	On-Demand	Anodyne	NQO2	37	53
CCC[C@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559816	FG	On-Demand	Anodyne	MPO	79	43
CCC[C@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559816	FG	On-Demand	Anodyne	MTNR1A	44	55
CCC[C@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559816	FG	On-Demand	Anodyne	MTNR1B	22	53
CCC[C@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559816	FG	On-Demand	Anodyne	ABCG2	26	43
CCC[C@@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559817	FG	On-Demand	Anodyne	HTR1A	22	43
CCC[C@@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559817	FG	On-Demand	Anodyne	HTR1D	48	43
CCC[C@@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559817	FG	On-Demand	Anodyne	HTR1B	35	43
CCC[C@@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559817	FG	On-Demand	Anodyne	NQO2	37	53
CCC[C@@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559817	FG	On-Demand	Anodyne	MPO	79	43
CCC[C@@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559817	FG	On-Demand	Anodyne	MTNR1A	44	55
CCC[C@@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559817	FG	On-Demand	Anodyne	MTNR1B	22	53
CCC[C@@H](OC)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450559817	FG	On-Demand	Anodyne	ABCG2	26	43
O=C(CC1(O)CCC1)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450559818	EE	On-Demand	Anodyne	EPHX2	27	41
O=S(=O)(N[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)c1cccc(F)c1	ZINC000450559819	FE	On-Demand	Anodyne	SFRP1	57	33
O=S(=O)(N[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)c1cccc(F)c1	ZINC000450559819	FE	On-Demand	Anodyne	WNT3	48	33
O=S(=O)(N[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)c1cccc(F)c1	ZINC000450559820	FE	On-Demand	Anodyne	SFRP1	57	33
O=S(=O)(N[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)c1cccc(F)c1	ZINC000450559820	FE	On-Demand	Anodyne	WNT3	48	33
O=S(=O)(N[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)c1cccc(F)c1	ZINC000450559821	FE	On-Demand	Anodyne	SFRP1	57	33
O=S(=O)(N[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)c1cccc(F)c1	ZINC000450559821	FE	On-Demand	Anodyne	WNT3	48	33
O=S(=O)(N[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)c1cccc(F)c1	ZINC000450559822	FE	On-Demand	Anodyne	SFRP1	57	33
O=S(=O)(N[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)c1cccc(F)c1	ZINC000450559822	FE	On-Demand	Anodyne	WNT3	48	33
CCc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450559834	FG	On-Demand	Anodyne	HTR2A	15	40
CCc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450559834	FG	On-Demand	Anodyne	CNR2	0	46
CCc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450559834	FG	On-Demand	Anodyne	CASR	46	38
CCc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450559834	FG	On-Demand	Anodyne	GRM4	40	35
CCc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450559834	FG	On-Demand	Anodyne	PIK3CD	19	40
CCc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450559834	FG	On-Demand	Anodyne	MTOR	65	38
CCc1cccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450559834	FG	On-Demand	Anodyne	EPHX2	28	42
CCOC(=O)[C@H](Cc1ccccc1)N(CC1CC(F)(F)C1)C1CC1	ZINC000450559838	EH	On-Demand	Anodyne	TIMP3	57	33
CCOC(=O)[C@@H](Cc1ccccc1)N(CC1CC(F)(F)C1)C1CC1	ZINC000450559839	EH	On-Demand	Anodyne	TIMP3	57	33
N#CC1(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)CCC1	ZINC000450559842	FE	On-Demand	Mild	SFRP1	67	34
N#CC1(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)CCC1	ZINC000450559842	FE	On-Demand	Mild	WNT3	42	34
N#CC1(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)CCC1	ZINC000450559843	FE	On-Demand	Mild	SFRP1	67	34
N#CC1(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)CCC1	ZINC000450559843	FE	On-Demand	Mild	WNT3	42	34
CC(C)c1nccc(N2CCC[C@@](C)(F)C2)n1	ZINC000450559851	BF	On-Demand	Anodyne	SORD	105	42
CC(C)c1nccc(N2CCC[C@](C)(F)C2)n1	ZINC000450559852	BF	On-Demand	Anodyne	SORD	105	42
Cc1ccn(CC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n1	ZINC000450559866	EE	On-Demand	Anodyne	P2RX7	15	41
CCN(CCC1CCN(C(=O)c2c[nH]c3nccc-3c2)CC1)CC1CC1	ZINC000450559898	FG	On-Demand	Anodyne	L3MBTL3	49	33
COC(=O)C1(CNC(=O)c2cn(-c3cccnc3)nn2)CCCCC1	ZINC000450559909	ED	On-Demand	Anodyne	HCN1	51	33
COC(=O)C1(CNC(=O)c2cn(-c3cccnc3)nn2)CCCCC1	ZINC000450559909	ED	On-Demand	Anodyne	HCN4	48	33
Cc1nnnn1-c1ccc(C(=O)NCC[C@@H](C)N2CCCCC2)c(F)c1	ZINC000450559915	FE	On-Demand	Anodyne	CCR5	38	40
Cc1nnnn1-c1ccc(C(=O)NCC[C@H](C)N2CCCCC2)c(F)c1	ZINC000450559916	FE	On-Demand	Anodyne	CCR5	38	40
C[C@@H](CCNC(=O)COc1ccc(C#N)c(Br)c1)N1CCCCC1	ZINC000450559923	GG	On-Demand	Mild	TRPV4	40	31
C[C@H](CCNC(=O)COc1ccc(C#N)c(Br)c1)N1CCCCC1	ZINC000450559924	GG	On-Demand	Mild	TRPV4	40	31
C[C@@H](O)CCN1CCC(C(=O)Nc2ccccc2Br)CC1	ZINC000450559949	FF	On-Demand	Anodyne	CCR5	39	40
C[C@H](O)CCN1CCC(C(=O)Nc2ccccc2Br)CC1	ZINC000450559950	FF	On-Demand	Anodyne	CCR5	39	40
Cc1nc(NC[C@H]2CS(=O)(=O)c3ccccc32)ncc1[N+](=O)[O-]	ZINC000450559952	ED	On-Demand	Bother	PRKCQ	50	40
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559956	FG	On-Demand	Anodyne	P2RY12	17	42
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559956	FG	On-Demand	Anodyne	CCKAR	27	40
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559956	FG	On-Demand	Anodyne	ABCB1	0	44
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559956	FG	On-Demand	Anodyne	KCNK3	45	38
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559956	FG	On-Demand	Anodyne	KCNK9	41	38
Cc1nc(NC[C@@H]2CS(=O)(=O)c3ccccc32)ncc1[N+](=O)[O-]	ZINC000450559958	ED	On-Demand	Bother	PRKCQ	50	40
O=C(CCCC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1)C1CC1	ZINC000450559963	ED	On-Demand	Anodyne	GALR1	43	31
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559970	FG	On-Demand	Anodyne	P2RY12	17	42
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559970	FG	On-Demand	Anodyne	CCKAR	27	40
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559970	FG	On-Demand	Anodyne	ABCB1	0	44
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559970	FG	On-Demand	Anodyne	KCNK3	45	38
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559970	FG	On-Demand	Anodyne	KCNK9	41	38
O=C(CCCC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1)C1CC1	ZINC000450559972	ED	On-Demand	Anodyne	GALR1	43	31
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559973	FG	On-Demand	Anodyne	P2RY12	17	42
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559973	FG	On-Demand	Anodyne	CCKAR	27	40
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559973	FG	On-Demand	Anodyne	ABCB1	0	44
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559973	FG	On-Demand	Anodyne	KCNK3	45	38
Cc1cccc(NC(=O)N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450559973	FG	On-Demand	Anodyne	KCNK9	41	38
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559975	FG	On-Demand	Anodyne	P2RY12	17	42
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559975	FG	On-Demand	Anodyne	CCKAR	27	40
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559975	FG	On-Demand	Anodyne	ABCB1	0	44
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559975	FG	On-Demand	Anodyne	KCNK3	45	38
Cc1cccc(NC(=O)N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450559975	FG	On-Demand	Anodyne	KCNK9	41	38
Cc1cc(NC(=O)c2ccnn2CC(F)(F)F)ccc1-n1nnnc1C(C)C	ZINC000450560000	GG	On-Demand	Anodyne	FLT1	15	41
Cc1nn(C)cc1CC(=O)NCCc1ccc(F)c(F)c1F	ZINC000450560009	DE	On-Demand	Anodyne	P2RX7	35	52
Cn1c(SCC2CC(F)(F)C2)nc2ccccc21	ZINC000450560014	CH	On-Demand	Anodyne	HRH1	15	43
COC(=O)C1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450560015	ED	On-Demand	Anodyne	HCN1	51	31
COC(=O)C1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450560015	ED	On-Demand	Anodyne	HCN4	48	31
C[C@@H]1CCO[C@@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450560025	DC	On-Demand	Anodyne	GALR1	44	32
C[C@@H]1CCO[C@@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450560025	DC	On-Demand	Anodyne	GHRL	53	33
C[C@@H]1CCO[C@@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450560028	DC	On-Demand	Anodyne	GALR1	44	32
C[C@@H]1CCO[C@@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450560028	DC	On-Demand	Anodyne	GHRL	53	33
Cc1cnc(CCCC(=O)Nc2sc(-c3ccccc3)nc2C)o1	ZINC000450560049	EI	On-Demand	Anodyne	FAAH	42	35
CO[C@H](COc1ccc(F)cc1C(C)=O)Cc1ccccc1	ZINC000450560055	DH	On-Demand	Anodyne	SDH1	0	41
CO[C@H](COc1ccc(F)cc1C(C)=O)Cc1ccccc1	ZINC000450560055	DH	On-Demand	Anodyne	ABCB1	57	40
CO[C@H](COc1ccc(F)cc1C(C)=O)Cc1ccccc1	ZINC000450560055	DH	On-Demand	Anodyne	PDS	63	39
COC(=O)c1coc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)n1	ZINC000450560067	FD	On-Demand	Anodyne	CCR3	65	33
CO[C@@H](COc1ccc(F)cc1C(C)=O)Cc1ccccc1	ZINC000450560070	DH	On-Demand	Anodyne	SDH1	0	41
CO[C@@H](COc1ccc(F)cc1C(C)=O)Cc1ccccc1	ZINC000450560070	DH	On-Demand	Anodyne	ABCB1	57	40
CO[C@@H](COc1ccc(F)cc1C(C)=O)Cc1ccccc1	ZINC000450560070	DH	On-Demand	Anodyne	PDS	63	39
COC(=O)c1coc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)n1	ZINC000450560071	FD	On-Demand	Anodyne	CCR3	65	33
FC1(F)CC(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)C1	ZINC000450560075	EG	On-Demand	Anodyne	SORD	55	36
COC(=O)c1cc(NCC[C@@H](C)CCO)c2cc(Br)ccc2n1	ZINC000450560082	GH	On-Demand	Anodyne	NQO1	19	41
CCc1nc(CNc2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])n[nH]1	ZINC000450560084	GD	On-Demand	Bother	DRTS_TOXGO	17	43
CCc1nc(CNc2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])n[nH]1	ZINC000450560084	GD	On-Demand	Bother	TAAR1	16	43
COC(=O)c1cc(NCC[C@H](C)CCO)c2cc(Br)ccc2n1	ZINC000450560085	GH	On-Demand	Anodyne	NQO1	19	41
CCc1nc(CNc2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])n[nH]1	ZINC000450560091	GD	On-Demand	Bother	DRTS_TOXGO	17	43
CCc1nc(CNc2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])n[nH]1	ZINC000450560091	GD	On-Demand	Bother	TAAR1	16	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450560099	FE	On-Demand	Anodyne	ADAM10	15	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450560100	FE	On-Demand	Anodyne	ADAM10	15	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450560102	FE	On-Demand	Anodyne	ADAM10	15	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450560103	FE	On-Demand	Anodyne	ADAM10	15	42
COC(=O)[C@@H]1CN(c2nnc(-c3ccccc3)s2)C[C@H]1c1ccc(O)cc1	ZINC000450560124	GG	On-Demand	Anodyne	SLC6A1	63	47
COC(=O)[C@@H]1CN(c2nnc(-c3ccccc3)s2)C[C@H]1c1ccc(O)cc1	ZINC000450560124	GG	On-Demand	Anodyne	SLC6A3	29	47
CCS(=O)(=O)c1ccc(CN2CCC(N(C)S(=O)(=O)CC)CC2)cc1	ZINC000450560128	GD	On-Demand	Anodyne	LSS	16	42
CN1CCN(c2nc3ccccc3nc2NCCC(C)(F)F)CC1	ZINC000450560130	EF	On-Demand	Anodyne	HTR3A	24	51
CN1CCN(c2nc3ccccc3nc2NCCC(C)(F)F)CC1	ZINC000450560130	EF	On-Demand	Anodyne	HRH4	41	51
CN1CCN(c2nc3ccccc3nc2NCCC(C)(F)F)CC1	ZINC000450560130	EF	On-Demand	Anodyne	TLR9	0	40
CN1CCC[C@@H](C(=O)NCCc2ccc(F)c(F)c2F)C1=O	ZINC000450560133	DD	On-Demand	Anodyne	P2RX7	38	42
CN1CCC[C@H](C(=O)NCCc2ccc(F)c(F)c2F)C1=O	ZINC000450560134	DD	On-Demand	Anodyne	P2RX7	38	42
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560135	GI	On-Demand	Anodyne	CCR3	131	49
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560135	GI	On-Demand	Anodyne	CYP2D6	18	46
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560135	GI	On-Demand	Anodyne	EPHX2	15	43
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560135	GI	On-Demand	Anodyne	MCHR1	23	40
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560135	GI	On-Demand	Anodyne	CACNA1I	40	45
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560135	GI	On-Demand	Anodyne	NOD2	40	34
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560136	GI	On-Demand	Anodyne	CCR3	131	49
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560136	GI	On-Demand	Anodyne	CYP2D6	18	46
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560136	GI	On-Demand	Anodyne	EPHX2	15	43
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560136	GI	On-Demand	Anodyne	MCHR1	23	40
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560136	GI	On-Demand	Anodyne	CACNA1I	40	45
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000450560136	GI	On-Demand	Anodyne	NOD2	40	34
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HTR1A	54	53
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	ADRA2A	20	52
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	DRD2	64	53
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	DRD1	26	46
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	DRD4	65	51
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	ACHE	19	50
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	ADRA1D	17	41
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HTR1D	0	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HTR2A	37	46
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HTR2C	33	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	SLC6A4	16	45
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	ADRA1A	30	42
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	DRD3	105	50
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HTR4	23	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HRP1_PLAFA	26	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HTR7	41	38
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	NQO2	20	42
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	SIGMAR1	23	53
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	MMP13	23	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	PLD1	65	51
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HDAC6	22	41
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HTR3B	0	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	CYP2D6	0	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	SLC6A5	58	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	MMP9	29	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	PLD2	90	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	MMP1	29	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	MCHR1	25	48
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HDA106	0	46
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	CYP27B1	28	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	HPGDS	23	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	NOD1	26	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	NOD2	41	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	AP2S1	0	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	ALPHA-1A	0	41
COc1ccc(C(=O)NCCN2CCN(CC/C=C\c3ccccc3)CC2)cc1	ZINC000450560172	GG	On-Demand	Anodyne	GPR183	0	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HTR1A	54	53
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	ADRA2A	20	52
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	DRD2	64	53
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	DRD1	26	46
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	DRD4	65	51
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	ACHE	19	50
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	ADRA1D	17	41
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HTR1D	0	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HTR2A	37	46
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HTR2C	33	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	SLC6A4	16	45
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	ADRA1A	30	42
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	DRD3	105	50
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HTR4	23	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HRP1_PLAFA	26	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HTR7	41	38
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	NQO2	20	42
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	SIGMAR1	23	53
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	MMP13	23	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	PLD1	65	51
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HDAC6	22	41
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HTR3B	0	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	CYP2D6	0	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	SLC6A5	58	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	MMP9	29	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	PLD2	90	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	MMP1	29	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	MCHR1	25	48
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HDA106	0	46
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	CYP27B1	28	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	HPGDS	23	40
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	NOD1	26	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	NOD2	41	43
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	AP2S1	0	44
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	ALPHA-1A	0	41
COc1ccc(C(=O)NCCN2CCN(CC/C=C/c3ccccc3)CC2)cc1	ZINC000450560175	GG	On-Demand	Anodyne	GPR183	0	40
CCc1cc(CCCN2CCN(c3ccnc(-c4ccccc4)n3)CC2)on1	ZINC000450560180	GG	On-Demand	Anodyne	DRD2	20	49
CCc1cc(CCCN2CCN(c3ccnc(-c4ccccc4)n3)CC2)on1	ZINC000450560180	GG	On-Demand	Anodyne	DRD4	33	49
CCc1cc(CCCN2CCN(c3ccnc(-c4ccccc4)n3)CC2)on1	ZINC000450560180	GG	On-Demand	Anodyne	DRD3	24	49
CCc1cc(CCCN2CCN(c3ccnc(-c4ccccc4)n3)CC2)on1	ZINC000450560180	GG	On-Demand	Anodyne	SIGMAR1	15	44
CCc1cc(CCCN2CCN(c3ccnc(-c4ccccc4)n3)CC2)on1	ZINC000450560180	GG	On-Demand	Anodyne	SORD	40	37
O=C(N[C@H]1CCCN(c2cccnc2)C1=O)c1cncc(Cl)c1	ZINC000450560194	EE	On-Demand	Anodyne	CHRNA7	17	40
O=C(N[C@H]1CCCN(c2cccnc2)C1=O)c1cncc(Cl)c1	ZINC000450560194	EE	On-Demand	Anodyne	HDAC8	16	40
CCOC(=O)c1ccc(CSc2nnc(-c3cccs3)n2CC)nc1	ZINC000450560200	FH	On-Demand	Anodyne	SLC27A1	41	44
COc1cccc(OCCC(=O)N(C)CCC2CCN(c3ccncc3)CC2)c1	ZINC000450560226	GH	On-Demand	Anodyne	F10	17	43
COc1cccc(OCCC(=O)N(C)CCC2CCN(c3ccncc3)CC2)c1	ZINC000450560226	GH	On-Demand	Anodyne	SSTR1	16	40
CCOC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)nc1	ZINC000450560233	FF	On-Demand	Anodyne	P2RY12	61	52
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	HTR1A	42	50
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	DRD2	28	57
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	DRD4	49	40
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	DRD3	24	44
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	HTR3A	46	57
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	CYSLTR1	33	40
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	FAAH	20	43
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	SORD	24	45
CC(=O)c1cccc(CN2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450560235	EH	On-Demand	Anodyne	MGLL	0	44
Nc1ncccc1CN1CCC(Oc2ccccn2)CC1	ZINC000450560243	CE	On-Demand	Anodyne	SCN9A	0	42
Nc1ncccc1CN1CCC(Oc2ccccn2)CC1	ZINC000450560243	CE	On-Demand	Anodyne	SCN5A	81	42
Cc1cccc([C@H]2CCN(C(=O)c3cc4c([nH]3)CCCC4)C2)c1	ZINC000450560260	DH	On-Demand	Anodyne	HRH4	22	54
Cc1onc(C2CC2)c1C(=O)NCCCNc1cccc(F)c1	ZINC000450560262	DG	On-Demand	Anodyne	TBK1	27	41
Cc1cccc([C@@H]2CCN(C(=O)c3cc4c([nH]3)CCCC4)C2)c1	ZINC000450560263	DH	On-Demand	Anodyne	HRH4	23	54
Cc1cccc([C@@H]2CCN(C(=O)c3cc4c([nH]3)CCCC4)C2)c1	ZINC000450560263	DH	On-Demand	Anodyne	ADAM10	17	41
O=C(C1CCN(C[C@@H]2CCC(F)(F)C2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450560268	GI	On-Demand	Anodyne	CHRM3	16	41
O=C(C1CCN(C[C@@H]2CCC(F)(F)C2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450560268	GI	On-Demand	Anodyne	CCR5	39	46
O=C(C1CCN(C[C@H]2CCC(F)(F)C2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450560271	GI	On-Demand	Anodyne	CHRM3	16	41
O=C(C1CCN(C[C@H]2CCC(F)(F)C2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450560271	GI	On-Demand	Anodyne	CCR5	39	46
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC2=CCCCC2)CC1	ZINC000450560274	EF	On-Demand	Bother	MGLL	0	43
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC2=CCCCC2)CC1	ZINC000450560274	EF	On-Demand	Bother	ABHD6	0	43
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC2=CCCCC2)CC1	ZINC000450560274	EF	On-Demand	Bother	KCNJ1	25	40
CCOC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)nc1	ZINC000450560284	FD	On-Demand	Anodyne	P2RY12	52	41
CCCc1cc(C(=O)NCC2(c3ccc(OC)cc3)CCC2)no1	ZINC000450560285	EG	On-Demand	Anodyne	MTNR1A	23	41
CCCc1cc(C(=O)NCC2(c3ccc(OC)cc3)CCC2)no1	ZINC000450560285	EG	On-Demand	Anodyne	ACAT	0	45
COc1ccc(C2(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)CCC2)cc1	ZINC000450560286	GG	On-Demand	Anodyne	MMP13	51	42
COc1ccc(C2(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)CCC2)cc1	ZINC000450560286	GG	On-Demand	Anodyne	KCNA3	50	45
COc1ccc(C2(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)CCC2)cc1	ZINC000450560286	GG	On-Demand	Anodyne	MMP3	46	42
COc1ccc(C2(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)CCC2)cc1	ZINC000450560286	GG	On-Demand	Anodyne	MMP8	29	42
COc1ccc(C2(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)CCC2)cc1	ZINC000450560286	GG	On-Demand	Anodyne	MMP7	40	35
COc1ccc(C2(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)CCC2)cc1	ZINC000450560286	GG	On-Demand	Anodyne	MMP1	45	41
COc1ccc(C2(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)CCC2)cc1	ZINC000450560286	GG	On-Demand	Anodyne	ACAT	0	48
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(C4CC4)nc3C)C2)c1	ZINC000450560287	DI	On-Demand	Anodyne	HPGD	18	41
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C4CC4)nc3C)C2)c1	ZINC000450560289	DI	On-Demand	Anodyne	TPSAB1	27	40
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C4CC4)nc3C)C2)c1	ZINC000450560289	DI	On-Demand	Anodyne	HPGD	20	45
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450560298	GI	On-Demand	Anodyne	NR3C2	17	41
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450560298	GI	On-Demand	Anodyne	TIMP3	45	36
Clc1ccc(CCN2CCC[C@H](c3ncc[nH]3)C2)cc1	ZINC000450560301	CG	On-Demand	Anodyne	BIRC2	46	41
Clc1ccc(CCN2CCC[C@@H](c3ncc[nH]3)C2)cc1	ZINC000450560302	CG	On-Demand	Anodyne	BIRC2	46	41
O[C@H](CNc1nccc(N[C@@H]2CCCOC2)n1)Cc1cccc(F)c1	ZINC000450560307	ED	On-Demand	Anodyne	MAPK1	51	38
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450560308	GI	On-Demand	Anodyne	NR3C2	17	41
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450560308	GI	On-Demand	Anodyne	TIMP3	45	36
O[C@H](CNc1nccc(N[C@H]2CCCOC2)n1)Cc1cccc(F)c1	ZINC000450560309	ED	On-Demand	Anodyne	MAPK1	51	38
O[C@@H](CNc1nccc(N[C@@H]2CCCOC2)n1)Cc1cccc(F)c1	ZINC000450560310	ED	On-Demand	Anodyne	MAPK1	51	38
CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450560311	GI	On-Demand	Anodyne	NR3C2	17	41
CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450560311	GI	On-Demand	Anodyne	TIMP3	45	36
O[C@@H](CNc1nccc(N[C@H]2CCCOC2)n1)Cc1cccc(F)c1	ZINC000450560312	ED	On-Demand	Anodyne	MAPK1	51	38
CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450560314	GI	On-Demand	Anodyne	NR3C2	17	41
CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450560314	GI	On-Demand	Anodyne	TIMP3	45	36
CN(CCN1CCC[C@H]1C(=O)Nc1nccs1)Cc1ccccc1	ZINC000450560318	EF	On-Demand	Anodyne	MAP	0	40
CN(CCN1CCC[C@H]1C(=O)Nc1nccs1)Cc1ccccc1	ZINC000450560318	EF	On-Demand	Anodyne	MAP1	105	40
CN(CCN1CCC[C@H]1C(=O)Nc1nccs1)Cc1ccccc1	ZINC000450560318	EF	On-Demand	Anodyne	PREP	43	46
Cc1cnc(CCCC(=O)N2CCC[C@@H]2c2ccc(Br)s2)o1	ZINC000450560320	GI	On-Demand	Anodyne	COLA	48	41
Cc1cnc(CCCC(=O)N2CCC[C@@H]2c2ccc(Br)s2)o1	ZINC000450560320	GI	On-Demand	Anodyne	CPT1A	46	33
Cc1cnc(CCCC(=O)N2CCC[C@@H]2c2ccc(Br)s2)o1	ZINC000450560320	GI	On-Demand	Anodyne	PREP	40	36
CN(CCN1CCC[C@@H]1C(=O)Nc1nccs1)Cc1ccccc1	ZINC000450560322	EF	On-Demand	Anodyne	MAP	0	40
CN(CCN1CCC[C@@H]1C(=O)Nc1nccs1)Cc1ccccc1	ZINC000450560322	EF	On-Demand	Anodyne	MAP1	105	40
CN(CCN1CCC[C@@H]1C(=O)Nc1nccs1)Cc1ccccc1	ZINC000450560322	EF	On-Demand	Anodyne	PREP	43	46
Cc1cnc(CCCC(=O)N2CCC[C@H]2c2ccc(Br)s2)o1	ZINC000450560325	GI	On-Demand	Anodyne	COLA	48	41
Cc1cnc(CCCC(=O)N2CCC[C@H]2c2ccc(Br)s2)o1	ZINC000450560325	GI	On-Demand	Anodyne	CPT1A	46	33
Cc1cnc(CCCC(=O)N2CCC[C@H]2c2ccc(Br)s2)o1	ZINC000450560325	GI	On-Demand	Anodyne	PREP	40	36
Cc1ccc(C(=O)N[C@@H](CO)c2cccc(F)c2)c(C)n1	ZINC000450560329	CE	On-Demand	Anodyne	MAPK1	55	46
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CC[C@H](c3cccc(C(F)(F)F)c3)C1)C(=O)C2	ZINC000450560332	GI	On-Demand	Anodyne	CACNA1B	41	34
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CC[C@H](c3cccc(C(F)(F)F)c3)C1)C(=O)C2	ZINC000450560332	GI	On-Demand	Anodyne	CCR2	43	43
Cc1ccc(C(=O)N[C@H](CO)c2cccc(F)c2)c(C)n1	ZINC000450560336	CE	On-Demand	Anodyne	MAPK1	55	46
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CC[C@@H](c3cccc(C(F)(F)F)c3)C1)C(=O)C2	ZINC000450560343	GI	On-Demand	Anodyne	CACNA1B	41	34
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CC[C@@H](c3cccc(C(F)(F)F)c3)C1)C(=O)C2	ZINC000450560343	GI	On-Demand	Anodyne	CCR2	43	43
COc1ccc(C2(CNC(=O)c3ccsc3Br)CCC2)cc1	ZINC000450560345	GI	On-Demand	Anodyne	KCNA3	51	43
COc1ccc(C2(CNC(=O)c3ccsc3Br)CCC2)cc1	ZINC000450560345	GI	On-Demand	Anodyne	ACAT	0	48
CO[C@@H](Cc1ccccc1)CN1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000450560348	EG	On-Demand	Mild	PTAFR	41	45
CO[C@H](Cc1ccccc1)CN1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000450560349	EG	On-Demand	Mild	PTAFR	41	45
CC[C@@H](O)CC(=O)N[C@@H](CO)c1cccc(F)c1	ZINC000450560352	CD	On-Demand	Anodyne	KCNQ2	15	40
CC[C@H](O)CC(=O)N[C@H](CO)c1cccc(F)c1	ZINC000450560354	CD	On-Demand	Anodyne	KCNQ2	15	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000450560355	EG	On-Demand	Mild	PTAFR	41	45
CO[C@H](Cc1ccccc1)CN1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000450560356	EG	On-Demand	Mild	PTAFR	41	45
CC[C@H](O)CC(=O)N[C@@H](CO)c1cccc(F)c1	ZINC000450560358	CD	On-Demand	Anodyne	KCNQ2	15	40
CC[C@@H](O)CC(=O)N[C@H](CO)c1cccc(F)c1	ZINC000450560360	CD	On-Demand	Anodyne	KCNQ2	15	40
CN(C)CCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450560367	FG	On-Demand	Anodyne	HTR1A	47	41
CN(C)CCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450560367	FG	On-Demand	Anodyne	ADRA1D	45	40
CN(C)CCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450560367	FG	On-Demand	Anodyne	HTR2A	16	40
CN(C)CCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450560367	FG	On-Demand	Anodyne	ADRA1A	35	40
CN(C)CCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450560367	FG	On-Demand	Anodyne	ADRA1B	32	40
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450560368	FG	On-Demand	Anodyne	HTR1A	47	41
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450560368	FG	On-Demand	Anodyne	ADRA1D	45	40
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450560368	FG	On-Demand	Anodyne	HTR2A	16	40
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450560368	FG	On-Demand	Anodyne	ADRA1A	35	40
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450560368	FG	On-Demand	Anodyne	ADRA1B	32	40
C[C@H](C[S@](C)=O)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450560371	CD	On-Demand	Anodyne	KCNQ2	43	38
C[C@H](C[S@@](C)=O)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450560372	CD	On-Demand	Anodyne	KCNQ2	43	38
C[C@H](C[S@](C)=O)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450560373	CD	On-Demand	Anodyne	KCNQ2	43	38
C[C@H](C[S@@](C)=O)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450560375	CD	On-Demand	Anodyne	KCNQ2	43	38
COC(=O)c1csc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)n1	ZINC000450560386	GD	On-Demand	Bother	MGLL	0	45
COC(=O)c1csc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)n1	ZINC000450560386	GD	On-Demand	Bother	ABHD6	0	45
COc1ccc(CNC(=O)CCN(C)Cc2cccc(C)n2)c(OC)c1	ZINC000450560400	FF	On-Demand	Anodyne	MTNR1B	46	35
COc1cc(CC(=O)N2CCC[C@@H]2c2ccc(Br)s2)ccc1O	ZINC000450560417	GI	On-Demand	Anodyne	RORC	40	33
COc1cccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)O)nc2)c1	ZINC000450560418	EG	On-Demand	Anodyne	RAF1	28	42
COc1cccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)O)nc2)c1	ZINC000450560418	EG	On-Demand	Anodyne	MTNR1A	29	46
COc1cccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)O)nc2)c1	ZINC000450560418	EG	On-Demand	Anodyne	MTNR1B	27	46
COc1cccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)O)nc2)c1	ZINC000450560418	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	40	42
COc1cc(CC(=O)N2CCC[C@H]2c2ccc(Br)s2)ccc1O	ZINC000450560421	GI	On-Demand	Anodyne	RORC	40	33
CCOC(=O)COc1ccc(NC(=O)c2cc(C(=O)OCC)c(C)[nH]2)cc1	ZINC000450560426	FF	On-Demand	Anodyne	ACR	53	34
CC(C)(C)C(=O)CCCC(=O)NCCCNc1cccc(F)c1	ZINC000450560429	DH	On-Demand	Anodyne	TBK1	17	47
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	CHRM2	19	45
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	DRD4	21	43
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	AVPR1A	27	41
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	MC4R	22	40
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	HRH3	25	44
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	SIGMAR1	28	65
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	HSD11B1	0	49
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	SHC	20	43
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	CCR1	45	41
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	CCR3	30	46
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	CCR5	35	43
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	LSS	30	52
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	EPHX2	16	41
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	C5AR1	34	50
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	MCHR1	17	46
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	SMO	35	41
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	L3MBTL1	0	42
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	L3MBTL3	74	42
CN(CCc1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560446	FI	On-Demand	Anodyne	MBTD1	0	40
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	DRD2	17	46
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	DRD4	36	46
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	ACHE	35	42
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	SLC6A1	0	44
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	SLC6A4	19	46
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	DRD3	24	46
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	SLC6A3	28	50
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	SIGMAR1	77	50
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	CCR3	15	41
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	CCR5	55	43
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560464	FH	On-Demand	Anodyne	CACNA1G	20	41
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	DRD2	17	46
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	DRD4	36	46
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	ACHE	35	42
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	SLC6A1	0	44
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	SLC6A4	19	46
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	DRD3	24	46
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	SLC6A3	28	50
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	SIGMAR1	77	50
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	CCR3	15	41
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	CCR5	55	43
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560466	FH	On-Demand	Anodyne	CACNA1G	20	41
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	DRD2	17	46
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	DRD4	36	46
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	ACHE	35	42
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	SLC6A1	0	44
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	SLC6A4	19	46
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	DRD3	24	46
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	SLC6A3	28	50
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	SIGMAR1	77	50
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	CCR3	15	41
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	CCR5	55	43
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560469	FH	On-Demand	Anodyne	CACNA1G	20	41
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	DRD2	17	46
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	DRD4	36	46
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	ACHE	35	42
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	SLC6A1	0	44
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	SLC6A4	19	46
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	DRD3	24	46
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	SLC6A3	28	50
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	SIGMAR1	77	50
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	CCR3	15	41
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	CCR5	55	43
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000450560471	FH	On-Demand	Anodyne	CACNA1G	20	41
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@H]1CCCCC1(F)F	ZINC000450560473	EG	On-Demand	Anodyne	MAP	0	45
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@H]1CCCCC1(F)F	ZINC000450560473	EG	On-Demand	Anodyne	MAP1	88	45
O=C(Nc1nccs1)[C@H]1CCCN1C[C@@H]1CCCCC1(F)F	ZINC000450560476	EG	On-Demand	Anodyne	MAP	0	45
O=C(Nc1nccs1)[C@H]1CCCN1C[C@@H]1CCCCC1(F)F	ZINC000450560476	EG	On-Demand	Anodyne	MAP1	88	45
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@@H]1CCCCC1(F)F	ZINC000450560477	EG	On-Demand	Anodyne	MAP	0	45
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@@H]1CCCCC1(F)F	ZINC000450560477	EG	On-Demand	Anodyne	MAP1	88	45
O=C(Nc1nccs1)[C@H]1CCCN1C[C@H]1CCCCC1(F)F	ZINC000450560478	EG	On-Demand	Anodyne	MAP	0	45
O=C(Nc1nccs1)[C@H]1CCCN1C[C@H]1CCCCC1(F)F	ZINC000450560478	EG	On-Demand	Anodyne	MAP1	88	45
O=C(Nc1nccs1)[C@H]1CCCN1C[C@@H]1CCC(F)(F)C1	ZINC000450560480	DF	On-Demand	Anodyne	MAP	0	40
O=C(Nc1nccs1)[C@H]1CCCN1C[C@@H]1CCC(F)(F)C1	ZINC000450560480	DF	On-Demand	Anodyne	MAP1	69	40
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@@H]1CCC(F)(F)C1	ZINC000450560482	DF	On-Demand	Anodyne	MAP	0	40
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@@H]1CCC(F)(F)C1	ZINC000450560482	DF	On-Demand	Anodyne	MAP1	69	40
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@H]1CCC(F)(F)C1	ZINC000450560484	DF	On-Demand	Anodyne	MAP	0	40
O=C(Nc1nccs1)[C@@H]1CCCN1C[C@H]1CCC(F)(F)C1	ZINC000450560484	DF	On-Demand	Anodyne	MAP1	69	40
O=C(Nc1nccs1)[C@H]1CCCN1C[C@H]1CCC(F)(F)C1	ZINC000450560485	DF	On-Demand	Anodyne	MAP	0	40
O=C(Nc1nccs1)[C@H]1CCCN1C[C@H]1CCC(F)(F)C1	ZINC000450560485	DF	On-Demand	Anodyne	MAP1	69	40
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1C[C@H]2[C@@H](O)CC[C@H]2C1	ZINC000450560496	EE	On-Demand	Bother	LIPG	49	34
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000450560498	EE	On-Demand	Bother	LIPG	49	34
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000450560500	EE	On-Demand	Bother	LIPG	49	34
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1C[C@H]2[C@H](O)CC[C@H]2C1	ZINC000450560502	EE	On-Demand	Bother	LIPG	49	34
CCOc1ccc(OCc2c(C)nnn2CC)cc1	ZINC000450560530	CF	On-Demand	Anodyne	CACNA2D2	43	36
O=C1CC[C@H](CN2CCC(c3c[nH]c4ncccc34)CC2)CCN1	ZINC000450560541	EF	On-Demand	Anodyne	CCR2	0	54
O=C1CC[C@H](CN2CCC(c3c[nH]c4ncccc34)CC2)CCN1	ZINC000450560541	EF	On-Demand	Anodyne	CDC7	41	36
O=C1CC[C@@H](CN2CCC(c3c[nH]c4ncccc34)CC2)CCN1	ZINC000450560542	EF	On-Demand	Anodyne	CCR2	0	54
O=C1CC[C@@H](CN2CCC(c3c[nH]c4ncccc34)CC2)CCN1	ZINC000450560542	EF	On-Demand	Anodyne	CDC7	41	36
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@@H]1CCC(F)(F)C1	ZINC000450560593	FH	On-Demand	Anodyne	CCR2	41	37
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H]1CCC(F)(F)C1	ZINC000450560598	FH	On-Demand	Anodyne	CCR2	41	37
FC1(F)CC(CN2CCC(c3c[nH]c4ncccc34)CC2)C1	ZINC000450560605	DH	On-Demand	Anodyne	CCR2	0	54
O=C(CCNC(=O)Cc1ccc(OC(F)F)c(F)c1)NCc1ccccn1	ZINC000450560613	GE	On-Demand	Anodyne	SUCNR1	43	36
Cc1ccnc(N[C@H](C)c2cccc(C3CC3)c2)n1	ZINC000450560618	CH	On-Demand	Anodyne	PAK1	25	40
Cc1ccnc(N[C@@H](C)c2cccc(C3CC3)c2)n1	ZINC000450560619	CH	On-Demand	Anodyne	PAK1	25	40
C[C@H]1CN(C(=O)c2cc3c([nH]2)CCCC3)CC(C)(C)C1	ZINC000450560620	CG	On-Demand	Anodyne	HRH4	23	60
C[C@@H]1CN(C(=O)c2cc3c([nH]2)CCCC3)CC(C)(C)C1	ZINC000450560622	CG	On-Demand	Anodyne	HRH4	23	60
O=C(CS(=O)(=O)C1CC1)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450560623	FF	On-Demand	Anodyne	PHES	0	40
O=C(CS(=O)(=O)C1CC1)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450560625	FF	On-Demand	Anodyne	PHES	0	40
COC(=O)[C@H](c1ccccc1)N(C)Cc1ccn(CCc2ccccc2)n1	ZINC000450560636	FG	On-Demand	Anodyne	FAS	20	41
COC(=O)[C@@H](c1ccccc1)N(C)Cc1ccn(CCc2ccccc2)n1	ZINC000450560638	FG	On-Demand	Anodyne	FAS	20	41
CN(C[C@@H]1CC=CCC1)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450560641	EI	On-Demand	Bother	LIPG	47	34
CN(C[C@H]1CC=CCC1)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450560642	EI	On-Demand	Bother	LIPG	47	34
CC1CCC(NC(=O)CN2CCN(Cc3cccnc3N)CC2)CC1	ZINC000450560665	ED	On-Demand	Anodyne	SIGMAR1	17	41
CC[C@H](C)N(Cc1ccc(C(C)=O)cc1)Cc1nc(O)c2ccccc2n1	ZINC000450560669	FI	On-Demand	Anodyne	TSPO	29	41
CC[C@@H](C)N(Cc1ccc(C(C)=O)cc1)Cc1nc(O)c2ccccc2n1	ZINC000450560673	FI	On-Demand	Anodyne	TSPO	29	41
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560680	EG	On-Demand	Anodyne	MME	44	35
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560680	EG	On-Demand	Anodyne	ANPEP	53	33
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560680	EG	On-Demand	Anodyne	CTSB	27	41
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560680	EG	On-Demand	Anodyne	CAPNS1	46	33
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560680	EG	On-Demand	Anodyne	PAM	0	40
COC(=O)[C@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560681	EG	On-Demand	Anodyne	MME	44	35
COC(=O)[C@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560681	EG	On-Demand	Anodyne	ANPEP	53	33
COC(=O)[C@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560681	EG	On-Demand	Anodyne	CTSB	27	41
COC(=O)[C@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560681	EG	On-Demand	Anodyne	CAPNS1	46	33
COC(=O)[C@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560681	EG	On-Demand	Anodyne	PAM	0	40
COC(=O)[C@@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560682	EG	On-Demand	Anodyne	MME	44	35
COC(=O)[C@@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560682	EG	On-Demand	Anodyne	ANPEP	53	33
COC(=O)[C@@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560682	EG	On-Demand	Anodyne	CTSB	27	41
COC(=O)[C@@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560682	EG	On-Demand	Anodyne	CAPNS1	46	33
COC(=O)[C@@H](c1ccccc1)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450560682	EG	On-Demand	Anodyne	PAM	0	40
CN(C)S(=O)(=O)c1ccc(NCCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450560685	FF	On-Demand	Bother	COLA	52	35
COC(=O)[C@@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560687	EG	On-Demand	Anodyne	MME	44	35
COC(=O)[C@@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560687	EG	On-Demand	Anodyne	ANPEP	53	33
COC(=O)[C@@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560687	EG	On-Demand	Anodyne	CTSB	27	41
COC(=O)[C@@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560687	EG	On-Demand	Anodyne	CAPNS1	46	33
COC(=O)[C@@H](c1ccccc1)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450560687	EG	On-Demand	Anodyne	PAM	0	40
CCc1cccc(C(=O)NCCC(=O)NCc2ccccn2)n1	ZINC000450560694	DD	On-Demand	Anodyne	PDE5A	27	44
CC(F)(F)CCCNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000450560695	EG	On-Demand	Anodyne	CYNT	23	41
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	HTR1A	15	44
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	DRD2	20	42
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	DRD4	38	45
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	ACHE	21	43
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	HRH2	26	43
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	HTR1D	30	51
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	HTR1B	21	51
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	CHRM3	18	43
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	HTR1F	66	39
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	SSTR5	53	36
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	CCR2	20	46
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	MCHR1	35	40
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	MCHR2	51	36
CC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1	ZINC000450560700	EI	On-Demand	Anodyne	CDC7	44	37
CC(C)(C)C(=O)CCCC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450560718	GH	On-Demand	Anodyne	CNR2	0	51
CC(C)(C)C(=O)CCCC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450560718	GH	On-Demand	Anodyne	NPY2R	27	43
CC(C)(C)C(=O)CCCC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450560718	GH	On-Demand	Anodyne	EPHX2	31	42
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](C)C[S@](C)=O)nc2)c1	ZINC000450560720	FF	On-Demand	Anodyne	MTNR1A	24	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](C)C[S@](C)=O)nc2)c1	ZINC000450560720	FF	On-Demand	Anodyne	MTNR1B	26	41
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](C)C[S@](C)=O)nc2)c1	ZINC000450560722	FF	On-Demand	Anodyne	MTNR1A	24	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](C)C[S@](C)=O)nc2)c1	ZINC000450560722	FF	On-Demand	Anodyne	MTNR1B	26	41
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](C)C[S@@](C)=O)nc2)c1	ZINC000450560723	FF	On-Demand	Anodyne	MTNR1A	24	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](C)C[S@@](C)=O)nc2)c1	ZINC000450560723	FF	On-Demand	Anodyne	MTNR1B	26	41
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](C)C[S@@](C)=O)nc2)c1	ZINC000450560724	FF	On-Demand	Anodyne	MTNR1A	24	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](C)C[S@@](C)=O)nc2)c1	ZINC000450560724	FF	On-Demand	Anodyne	MTNR1B	26	41
CC1CCN(CCc2cccc(NC(=O)CS(=O)(=O)C3CC3)c2)CC1	ZINC000450560758	FE	On-Demand	Anodyne	DRD4	17	43
CC1CCN(CCc2cccc(NC(=O)CS(=O)(=O)C3CC3)c2)CC1	ZINC000450560758	FE	On-Demand	Anodyne	HTR1D	33	44
CC1CCN(CCc2cccc(NC(=O)CS(=O)(=O)C3CC3)c2)CC1	ZINC000450560758	FE	On-Demand	Anodyne	HTR1B	28	44
CC1CCN(CCc2cccc(NC(=O)CS(=O)(=O)C3CC3)c2)CC1	ZINC000450560758	FE	On-Demand	Anodyne	SIGMAR1	23	41
CC1CCN(CCc2cccc(NC(=O)CS(=O)(=O)C3CC3)c2)CC1	ZINC000450560758	FE	On-Demand	Anodyne	CCR3	53	40
CC(C)c1ncsc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450560764	GI	On-Demand	Anodyne	HTR1B	22	41
CC(C)c1ncsc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450560764	GI	On-Demand	Anodyne	MPO	52	34
CC(C)c1ncsc1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450560764	GI	On-Demand	Anodyne	ABCG2	27	45
Cc1cnc(CCCC(=O)NCCc2c[nH]c3ccc(Br)cc23)o1	ZINC000450560777	GH	On-Demand	Anodyne	HTR1A	0	43
Cc1cnc(CCCC(=O)NCCc2c[nH]c3ccc(Br)cc23)o1	ZINC000450560777	GH	On-Demand	Anodyne	HTR1D	38	43
Cc1cnc(CCCC(=O)NCCc2c[nH]c3ccc(Br)cc23)o1	ZINC000450560777	GH	On-Demand	Anodyne	HTR1B	39	43
Cc1cnc(CCCC(=O)NCCc2c[nH]c3ccc(Br)cc23)o1	ZINC000450560777	GH	On-Demand	Anodyne	MPO	51	47
Cc1cnc(CCCC(=O)NCCc2c[nH]c3ccc(Br)cc23)o1	ZINC000450560777	GH	On-Demand	Anodyne	MTNR1A	24	56
Cc1cnc(CCCC(=O)NCCc2c[nH]c3ccc(Br)cc23)o1	ZINC000450560777	GH	On-Demand	Anodyne	MTNR1B	15	56
Cc1cnc(CCCC(=O)NCCc2c[nH]c3ccc(Br)cc23)o1	ZINC000450560777	GH	On-Demand	Anodyne	ABCG2	26	42
O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)c1cncc(Cl)c1	ZINC000450560779	EE	On-Demand	Anodyne	CHRNA7	17	40
O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)c1cncc(Cl)c1	ZINC000450560779	EE	On-Demand	Anodyne	HDAC8	16	40
Cc1ccc(NC(=O)c2ccc(NCC[C@H](C)CCO)c([N+](=O)[O-])c2)cc1	ZINC000450560806	FH	On-Demand	Bother	TAAR1	19	49
Cc1ccc(NC(=O)c2ccc(NCC[C@H](C)CCO)c([N+](=O)[O-])c2)cc1	ZINC000450560806	FH	On-Demand	Bother	MCL1	0	43
CCOC(=O)[C@@H](Cc1ccccc1)N(CCc1cscn1)C1CC1	ZINC000450560807	EG	On-Demand	Anodyne	BMP1	63	41
CCOC(=O)[C@H](Cc1ccccc1)N(CCc1cscn1)C1CC1	ZINC000450560810	EG	On-Demand	Anodyne	BMP1	63	41
Cc1ccc(NC(=O)c2ccc(NCC[C@@H](C)CCO)c([N+](=O)[O-])c2)cc1	ZINC000450560811	FH	On-Demand	Bother	TAAR1	19	49
Cc1ccc(NC(=O)c2ccc(NCC[C@@H](C)CCO)c([N+](=O)[O-])c2)cc1	ZINC000450560811	FH	On-Demand	Bother	MCL1	0	43
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	HTR1A	26	48
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	DRD2	32	48
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	DRD1	0	43
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	DRD4	62	47
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	DRD3	46	48
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	HRP1_PLAFA	31	49
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	PLD1	46	38
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	CYP2D6	0	40
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	PLD2	74	38
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	HPGDS	23	40
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	AP2S1	0	42
COc1ccc(C(=O)NCCN2CCN(C[C@](C)(O)C(C)=O)CC2)cc1	ZINC000450560814	FC	On-Demand	Anodyne	ALPHA-1A	0	41
CCc1cc(CCCN2CCc3[nH]c4ccc(F)cc4c3C2)on1	ZINC000450560817	EH	On-Demand	Anodyne	HTR5A	23	46
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	HTR1A	26	48
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	DRD2	32	48
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	DRD1	0	43
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	DRD4	62	47
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	DRD3	46	48
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	HRP1_PLAFA	31	49
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	PLD1	46	38
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	CYP2D6	0	40
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	PLD2	74	38
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	HPGDS	23	40
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	AP2S1	0	42
COc1ccc(C(=O)NCCN2CCN(C[C@@](C)(O)C(C)=O)CC2)cc1	ZINC000450560818	FC	On-Demand	Anodyne	ALPHA-1A	0	41
CCc1ccc(NC(=O)CNS(=O)(=O)NC)cc1C	ZINC000450560823	CC	On-Demand	Anodyne	CA4	15	40
C[C@@H](c1csnn1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450560831	FE	On-Demand	Anodyne	DRD4	18	44
C[C@H](c1csnn1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000450560835	FE	On-Demand	Anodyne	DRD4	18	44
CC(F)(F)CCCNc1ncnc2[nH]c3ccccc3c12	ZINC000450560836	CH	On-Demand	Anodyne	UTS2R	29	47
Cc1sccc1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450560853	DE	On-Demand	Anodyne	GALR1	45	32
Cc1sccc1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450560854	DE	On-Demand	Anodyne	GALR1	45	32
CC(F)(F)CCNc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450560865	GI	On-Demand	Anodyne	PDS	15	73
COC(=O)c1ccc(CC(=O)NCC2(CO)CCC2)cc1	ZINC000450560868	CD	On-Demand	Anodyne	NPFFR1	32	43
CCn1c(SCC(=O)CC[C@@H]2CCCCO2)nc2ccccc21	ZINC000450560873	EI	On-Demand	Anodyne	PTGDR2	17	40
CCn1c(SCC(=O)CC[C@H]2CCCCO2)nc2ccccc21	ZINC000450560874	EI	On-Demand	Anodyne	PTGDR2	17	40
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560890	GG	On-Demand	Anodyne	DRD4	28	47
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560890	GG	On-Demand	Anodyne	HRH3	24	42
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560890	GG	On-Demand	Anodyne	SIGMAR1	27	42
C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560890	GG	On-Demand	Anodyne	BIRC2	76	49
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560891	GG	On-Demand	Anodyne	DRD4	28	47
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560891	GG	On-Demand	Anodyne	HRH3	24	42
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560891	GG	On-Demand	Anodyne	SIGMAR1	27	42
C[C@H]1CCC[C@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560891	GG	On-Demand	Anodyne	BIRC2	76	49
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560892	GG	On-Demand	Anodyne	DRD4	28	47
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560892	GG	On-Demand	Anodyne	HRH3	24	42
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560892	GG	On-Demand	Anodyne	SIGMAR1	27	42
C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560892	GG	On-Demand	Anodyne	BIRC2	76	49
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560893	GG	On-Demand	Anodyne	DRD4	28	47
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560893	GG	On-Demand	Anodyne	HRH3	24	42
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560893	GG	On-Demand	Anodyne	SIGMAR1	27	42
C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CCc3ccc(Cl)cc3)CC2)C1	ZINC000450560893	GG	On-Demand	Anodyne	BIRC2	76	49
CCC[C@H](OC)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450560905	DD	On-Demand	Anodyne	GALR1	48	34
CCC[C@H](OC)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450560905	DD	On-Demand	Anodyne	GHRL	44	32
CCC[C@H](OC)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450560907	DD	On-Demand	Anodyne	GALR1	48	34
CCC[C@H](OC)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450560907	DD	On-Demand	Anodyne	GHRL	44	32
CCC[C@@H](OC)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450560908	DD	On-Demand	Anodyne	GALR1	48	34
CCC[C@@H](OC)C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450560908	DD	On-Demand	Anodyne	GHRL	44	32
CCC[C@@H](OC)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450560909	DD	On-Demand	Anodyne	GALR1	48	34
CCC[C@@H](OC)C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450560909	DD	On-Demand	Anodyne	GHRL	44	32
CCc1cccc(C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)n1	ZINC000450560911	DD	On-Demand	Anodyne	GALR1	43	31
CCc1cccc(C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)n1	ZINC000450560912	DD	On-Demand	Anodyne	GALR1	43	31
CC(=O)c1ccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)cc1	ZINC000450560931	GF	On-Demand	Anodyne	DRD2	21	67
CC(=O)c1ccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)cc1	ZINC000450560931	GF	On-Demand	Anodyne	DRD4	44	78
CC(=O)c1ccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)cc1	ZINC000450560931	GF	On-Demand	Anodyne	ACHE	20	44
CC(=O)c1ccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)cc1	ZINC000450560931	GF	On-Demand	Anodyne	AVPR2	53	45
CC(=O)c1ccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)cc1	ZINC000450560931	GF	On-Demand	Anodyne	SIGMAR1	25	54
CC(=O)c1ccc(CN2CCN(CC(=O)N3CCCc4ccccc43)CC2)cc1	ZINC000450560931	GF	On-Demand	Anodyne	NOD2	45	38
COC(=O)[C@@H]1CN(c2ncnc3n[nH]cc23)C[C@H]1c1ccc(O)cc1	ZINC000450560941	ED	On-Demand	Anodyne	SLC6A1	35	40
CCS(=O)(=O)N(C)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450560949	EF	On-Demand	Anodyne	CCR5	43	36
COC(=O)[C@@H]1CN(c2cc(Cl)ccc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450560953	FG	On-Demand	Mild	SLC6A1	80	50
COC(=O)[C@@H]1CN(c2cc(Cl)ccc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450560953	FG	On-Demand	Mild	SLC6A4	15	47
COC(=O)[C@@H]1CN(c2cc(Cl)ccc2C#N)C[C@H]1c1ccc(O)cc1	ZINC000450560953	FG	On-Demand	Mild	SLC6A3	25	47
CCS(=O)(=O)N(C)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450560954	EF	On-Demand	Anodyne	CCR5	43	36
N#Cc1cnc2c(F)cc(F)cc2c1NCCCC1CCOCC1	ZINC000450560955	EI	On-Demand	Mild	MAP3K8	52	37
CCCN(C[C@H](Cc1ccccc1)OC)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560956	GI	On-Demand	Anodyne	DRD3	21	41
CCCN(C[C@H](Cc1ccccc1)OC)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560956	GI	On-Demand	Anodyne	L3MBTL3	44	34
CCCN(C[C@@H](Cc1ccccc1)OC)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560957	GI	On-Demand	Anodyne	DRD3	21	41
CCCN(C[C@@H](Cc1ccccc1)OC)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450560957	GI	On-Demand	Anodyne	L3MBTL3	44	34
COC(=O)[C@@H]1CN(c2nccc(-c3cnccn3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450560993	GE	On-Demand	Anodyne	SLC6A1	37	44
COC(=O)[C@@H]1CN(c2nccc(-c3cnccn3)n2)C[C@H]1c1ccc(O)cc1	ZINC000450560993	GE	On-Demand	Anodyne	SLC6A3	18	44
COC(=O)[C@@H]1CN(c2ccc(Br)c(C)n2)C[C@H]1c1ccc(O)cc1	ZINC000450561012	GG	On-Demand	Anodyne	SLC6A1	66	42
COC(=O)[C@@H]1CN(c2nnc(C)c(C)n2)C[C@H]1c1ccc(O)cc1	ZINC000450561020	ED	On-Demand	Anodyne	SLC6A1	71	44
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C)c3)C2)n1	ZINC000450561021	CH	On-Demand	Anodyne	HSD11B1	16	44
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C)c3)C2)n1	ZINC000450561021	CH	On-Demand	Anodyne	TPSAB1	29	42
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C)c3)C2)n1	ZINC000450561021	CH	On-Demand	Anodyne	HPGD	20	43
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)n1	ZINC000450561024	CH	On-Demand	Anodyne	HSD11B1	16	44
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)n1	ZINC000450561024	CH	On-Demand	Anodyne	TPSAB1	29	42
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)n1	ZINC000450561024	CH	On-Demand	Anodyne	HPGD	20	43
C[C@H]1[C@H](NC(=O)c2ccc(C(C)(F)F)nc2)CCCN1C	ZINC000450561038	CE	On-Demand	Anodyne	SFRP1	44	36
C[C@H]1[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)CCCN1C	ZINC000450561039	CE	On-Demand	Anodyne	SFRP1	44	36
C[C@@H]1[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)CCCN1C	ZINC000450561040	CE	On-Demand	Anodyne	SFRP1	44	36
C[C@@H]1[C@H](NC(=O)c2ccc(C(C)(F)F)nc2)CCCN1C	ZINC000450561041	CE	On-Demand	Anodyne	SFRP1	44	36
CCc1nc(C)c(CSc2nnc(-c3ccc(OC)cc3)o2)o1	ZINC000450561043	EH	On-Demand	Anodyne	TYMS	0	40
CCc1nc(C)c(CSc2nnc(-c3ccc(OC)cc3)o2)o1	ZINC000450561043	EH	On-Demand	Anodyne	GSK3B	22	57
CCc1nc(C)c(CSc2nnc(-c3ccc(OC)cc3)o2)o1	ZINC000450561043	EH	On-Demand	Anodyne	GSK3A	47	49
COC(=O)[C@@H]1CN(c2cc(C)nc(C#N)c2)C[C@H]1c1ccc(O)cc1	ZINC000450561048	EE	On-Demand	Mild	SLC6A1	49	42
CCC(=O)CCCN1CCc2ccc(O)cc2C1	ZINC000450561050	BF	On-Demand	Anodyne	DRD1	17	53
CCC(=O)CCCN1CCc2ccc(O)cc2C1	ZINC000450561050	BF	On-Demand	Anodyne	DRD4	0	48
CCC(=O)CCCN1CCc2ccc(O)cc2C1	ZINC000450561050	BF	On-Demand	Anodyne	DRD5	42	45
CCC(=O)CCCN1CCc2ccc(O)cc2C1	ZINC000450561050	BF	On-Demand	Anodyne	ABCB1B	45	32
CCC(=O)CCCN1CCc2ccc(O)cc2C1	ZINC000450561050	BF	On-Demand	Anodyne	SLC6A5	26	44
COC(=O)[C@@H]1CN(c2cc(N3CCCCC3)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450561057	GF	On-Demand	Anodyne	SLC6A1	77	44
COC(=O)[C@@H]1CN(c2cc(N3CCCCC3)ncn2)C[C@H]1c1ccc(O)cc1	ZINC000450561057	GF	On-Demand	Anodyne	SLC6A3	34	40
CN(CCCC(=O)c1ccccc1)CC(=O)Nc1cc(F)cc(F)c1	ZINC000450561059	EG	On-Demand	Anodyne	LTA4H	28	50
CN(CCCC(=O)c1ccccc1)CC(=O)Nc1cc(F)cc(F)c1	ZINC000450561059	EG	On-Demand	Anodyne	SLC6A9	30	44
CCOc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561062	FH	On-Demand	Anodyne	CACNA1B	47	34
CCOc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561062	FH	On-Demand	Anodyne	CCR5	49	34
CCOc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561062	FH	On-Demand	Anodyne	CCR2	52	37
CCOc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561062	FH	On-Demand	Anodyne	MCHR1	15	40
CCOc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561062	FH	On-Demand	Anodyne	ETHR	42	34
CCOc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561066	FH	On-Demand	Anodyne	CACNA1B	47	34
CCOc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561066	FH	On-Demand	Anodyne	CCR5	49	34
CCOc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561066	FH	On-Demand	Anodyne	CCR2	52	37
CCOc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561066	FH	On-Demand	Anodyne	MCHR1	15	40
CCOc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)on1	ZINC000450561066	FH	On-Demand	Anodyne	ETHR	42	34
COCCOC[C@@H](O)CN(C)c1ccccc1Oc1ccccc1	ZINC000450561067	EF	On-Demand	Anodyne	TSPO	51	34
COCCOC[C@H](O)CN(C)c1ccccc1Oc1ccccc1	ZINC000450561069	EF	On-Demand	Anodyne	TSPO	51	34
O=C(Cc1cc2ccccc2s1)N1CCC(Cc2cccnc2)CC1	ZINC000450561070	FI	On-Demand	Anodyne	GRIN2B	60	40
O=C(Cc1cc2ccccc2s1)N1CCC(Cc2cccnc2)CC1	ZINC000450561070	FI	On-Demand	Anodyne	NPY2R	44	33
O=C(Cc1cc2ccccc2s1)N1CCC(Cc2cccnc2)CC1	ZINC000450561070	FI	On-Demand	Anodyne	CHRNA7	51	41
O=C(Cc1cc2ccccc2s1)N1CCC(Cc2cccnc2)CC1	ZINC000450561070	FI	On-Demand	Anodyne	C3AR1	51	45
O=C(Cc1cc2ccccc2s1)N1CCC(Cc2cccnc2)CC1	ZINC000450561070	FI	On-Demand	Anodyne	ACHP_LYMST	24	41
O=C(Cc1cc2ccccc2s1)N1CCC(Cc2cccnc2)CC1	ZINC000450561070	FI	On-Demand	Anodyne	NR1D1	18	45
CCOC(=O)c1ccc(CN2CCc3ccc(O)cc3C2)nc1	ZINC000450561080	DF	On-Demand	Anodyne	NOD1	29	47
CCOC(=O)c1ccc(CN2CCc3ccc(O)cc3C2)nc1	ZINC000450561080	DF	On-Demand	Anodyne	NOD2	45	47
CCOCc1nc(C)c(C(=O)NCCc2ccc(F)c(F)c2F)s1	ZINC000450561081	FG	On-Demand	Anodyne	SCD1	29	41
CCOCc1nc(C)c(C(=O)NCCc2ccc(F)c(F)c2F)s1	ZINC000450561081	FG	On-Demand	Anodyne	SCD	23	41
COc1cccc([C@@H]2C[C@H]2C(=O)NCCCNc2ccccc2F)c1	ZINC000450561091	EH	On-Demand	Anodyne	DRD4	43	34
COc1cccc([C@@H]2C[C@H]2C(=O)NCCCNc2ccccc2F)c1	ZINC000450561091	EH	On-Demand	Anodyne	DRD3	20	49
Cc1ccc(NC(=O)[C@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)nc1	ZINC000450561096	ED	On-Demand	Anodyne	SLC6A1	74	34
Cc1ccc(NC(=O)[C@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)nc1	ZINC000450561096	ED	On-Demand	Anodyne	GCK	27	43
Cc1ccc(NC(=O)[C@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)nc1	ZINC000450561097	ED	On-Demand	Anodyne	SLC6A1	74	34
Cc1ccc(NC(=O)[C@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)nc1	ZINC000450561097	ED	On-Demand	Anodyne	GCK	27	43
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)nc1	ZINC000450561099	ED	On-Demand	Anodyne	SLC6A1	74	34
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)nc1	ZINC000450561099	ED	On-Demand	Anodyne	GCK	27	43
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)nc1	ZINC000450561101	ED	On-Demand	Anodyne	SLC6A1	74	34
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)nc1	ZINC000450561101	ED	On-Demand	Anodyne	GCK	27	43
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccc(C(=O)NCCO)nn1	ZINC000450561103	ED	On-Demand	Anodyne	SCD1	23	43
COC(=O)[C@@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000450561104	GG	On-Demand	Bother	SLC6A1	52	48
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2c2ccc(Br)s2)on1	ZINC000450561106	GH	On-Demand	Anodyne	COLA	44	38
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2c2ccc(Br)s2)on1	ZINC000450561106	GH	On-Demand	Anodyne	CPT1A	43	38
O=C(CCCC(=O)C1CC1)Nc1nc(Cc2ccccc2)cs1	ZINC000450561107	EH	On-Demand	Anodyne	HDAC10	22	41
O=C(CCCC(=O)C1CC1)Nc1nc(Cc2ccccc2)cs1	ZINC000450561107	EH	On-Demand	Anodyne	HDAC3	15	41
O=C(CCCC(=O)C1CC1)Nc1nc(Cc2ccccc2)cs1	ZINC000450561107	EH	On-Demand	Anodyne	HDAC6	17	47
O=C(CCCC(=O)C1CC1)Nc1nc(Cc2ccccc2)cs1	ZINC000450561107	EH	On-Demand	Anodyne	HDAC9	16	47
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccc(C(=O)NCCO)nn1	ZINC000450561112	ED	On-Demand	Anodyne	SCD1	23	43
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccc(Br)s2)on1	ZINC000450561114	GH	On-Demand	Anodyne	COLA	44	38
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccc(Br)s2)on1	ZINC000450561114	GH	On-Demand	Anodyne	CPT1A	43	38
O=C(c1cncc(Cl)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561116	FI	On-Demand	Anodyne	CACNA1B	46	35
O=C(c1cncc(Cl)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561116	FI	On-Demand	Anodyne	SLC9A1	42	43
O=C(c1cncc(Cl)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561116	FI	On-Demand	Anodyne	CCR2	50	39
O=C(c1cncc(Cl)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561116	FI	On-Demand	Anodyne	RBP4	24	47
O=C(c1cncc(Cl)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561116	FI	On-Demand	Anodyne	RHOA	0	41
CN(C)CCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450561117	ED	On-Demand	Anodyne	HTR1A	44	45
CN(C)CCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450561117	ED	On-Demand	Anodyne	ADRA1D	40	46
CN(C)CCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450561117	ED	On-Demand	Anodyne	ADRA1A	33	46
CN(C)CCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450561117	ED	On-Demand	Anodyne	ADRA1B	23	46
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450561119	ED	On-Demand	Anodyne	HTR1A	44	45
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450561119	ED	On-Demand	Anodyne	ADRA1D	40	46
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450561119	ED	On-Demand	Anodyne	ADRA1A	33	46
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450561119	ED	On-Demand	Anodyne	ADRA1B	23	46
O=C(c1cncc(Cl)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561123	FI	On-Demand	Anodyne	CACNA1B	46	35
O=C(c1cncc(Cl)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561123	FI	On-Demand	Anodyne	SLC9A1	42	43
O=C(c1cncc(Cl)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561123	FI	On-Demand	Anodyne	CCR2	50	39
O=C(c1cncc(Cl)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561123	FI	On-Demand	Anodyne	RBP4	24	47
O=C(c1cncc(Cl)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450561123	FI	On-Demand	Anodyne	RHOA	0	41
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561126	FH	On-Demand	Anodyne	VACHT_TETCF	0	42
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561126	FH	On-Demand	Anodyne	HSD11B1	0	43
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561126	FH	On-Demand	Anodyne	CPT2	43	38
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561126	FH	On-Demand	Anodyne	PREP	76	51
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561126	FH	On-Demand	Anodyne	SFRP1	55	44
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561126	FH	On-Demand	Anodyne	WNT3	52	44
CC1(O)CC(C(=O)NCCCNc2ccccc2F)C1	ZINC000450561128	CD	On-Demand	Anodyne	TBK1	45	35
COC(=O)[C@@H]1CN(c2cc(C)c([N+](=O)[O-])cc2F)C[C@H]1c1ccc(O)cc1	ZINC000450561129	FG	On-Demand	Bother	SLC6A1	32	41
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561132	FH	On-Demand	Anodyne	VACHT_TETCF	0	42
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561132	FH	On-Demand	Anodyne	HSD11B1	0	43
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561132	FH	On-Demand	Anodyne	CPT2	43	38
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561132	FH	On-Demand	Anodyne	PREP	76	51
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561132	FH	On-Demand	Anodyne	SFRP1	55	44
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)C2)c1	ZINC000450561132	FH	On-Demand	Anodyne	WNT3	52	44
CC(C)(C)[C@H]1CCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450561133	DH	On-Demand	Anodyne	CACNA1B	37	40
CC(C)(C)[C@H]1CCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450561133	DH	On-Demand	Anodyne	SFRP1	100	37
CC(C)(C)[C@H]1CCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450561133	DH	On-Demand	Anodyne	WNT3	66	34
CC(C)(C)[C@H]1CCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450561133	DH	On-Demand	Anodyne	ABHD11	0	40
CC(C)(C)[C@@H]1CCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450561134	DH	On-Demand	Anodyne	WNT3	48	29
CC(C)(C)[C@@H]1CCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450561134	DH	On-Demand	Anodyne	ABHD11	0	40
CCCN(CC[C@@H](C)O)CC(=O)Nc1ccc(Cl)cc1	ZINC000450561136	CF	On-Demand	Anodyne	PSBA	0	40
CCCN(CC[C@H](C)O)CC(=O)Nc1ccc(Cl)cc1	ZINC000450561139	CF	On-Demand	Anodyne	PSBA	0	40
O=c1c2c3c(sc2ncn1CC[C@@H]1CCOC1)CCCC3	ZINC000450561140	DF	On-Demand	Anodyne	HTR1B	16	41
O=c1c2c3c(sc2ncn1CC[C@H]1CCOC1)CCCC3	ZINC000450561143	DF	On-Demand	Anodyne	HTR1B	16	41
Cn1cc(-c2ccc(C(=O)NCC(=O)C3CC3)o2)cn1	ZINC000450561156	CD	On-Demand	Anodyne	MMP13	16	43
Cn1cc(-c2ccc(C(=O)NCC(=O)C3CC3)o2)cn1	ZINC000450561156	CD	On-Demand	Anodyne	SCN10A	18	40
CCc1cc(CCCN2CCc3ccc(O)cc3C2)on1	ZINC000450561160	CF	On-Demand	Anodyne	CHRNA6	0	40
CN(CCCC(=O)c1ccccc1)CC(=O)NCc1ccccc1	ZINC000450561164	DF	On-Demand	Anodyne	THRA	0	43
CN(CCCC(=O)c1ccccc1)CC(=O)NCc1ccccc1	ZINC000450561164	DF	On-Demand	Anodyne	LTA4H	31	45
CN(CCCC(=O)c1ccccc1)CC(=O)NCc1ccccc1	ZINC000450561164	DF	On-Demand	Anodyne	FURIN	44	35
COc1cc(Br)ccc1CCCNC(=O)Cn1cc(C(C)=O)nn1	ZINC000450561166	GE	On-Demand	Anodyne	MTNR1B	23	42
COC(=O)[C@@H]1CN(c2nc(C)c(S(N)(=O)=O)s2)C[C@H]1c1ccc(O)cc1	ZINC000450561176	GD	On-Demand	Anodyne	SLC6A1	28	40
c1ccc(OC2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450561182	DH	On-Demand	Anodyne	PDE3A	15	40
c1ccc(OC2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450561182	DH	On-Demand	Anodyne	SCN9A	0	42
c1ccc(OC2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450561182	DH	On-Demand	Anodyne	PDE3B	15	40
c1ccc(OC2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450561182	DH	On-Demand	Anodyne	SCN5A	82	42
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	DRD2	16	48
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	DRD4	43	33
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	CHRM3	15	42
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	CCR3	32	41
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	BDKRB1	21	41
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	FAAH	24	43
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	PARP1	19	40
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	MCHR1	18	42
COC(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1Cl	ZINC000450561184	GF	On-Demand	Anodyne	MGLL	0	40
Cc1ccn2ncc(C(=O)N3CC[C@H](c4cccc(C(F)(F)F)c4)C3)c2c1	ZINC000450561186	FI	On-Demand	Anodyne	CACNA1B	44	38
Cc1ccn2ncc(C(=O)N3CC[C@H](c4cccc(C(F)(F)F)c4)C3)c2c1	ZINC000450561186	FI	On-Demand	Anodyne	SLC9A1	40	36
Cc1ccn2ncc(C(=O)N3CC[C@H](c4cccc(C(F)(F)F)c4)C3)c2c1	ZINC000450561186	FI	On-Demand	Anodyne	RBP4	29	41
Cc1ccn2ncc(C(=O)N3CC[C@@H](c4cccc(C(F)(F)F)c4)C3)c2c1	ZINC000450561187	FI	On-Demand	Anodyne	CACNA1B	44	38
Cc1ccn2ncc(C(=O)N3CC[C@@H](c4cccc(C(F)(F)F)c4)C3)c2c1	ZINC000450561187	FI	On-Demand	Anodyne	SLC9A1	40	36
Cc1ccn2ncc(C(=O)N3CC[C@@H](c4cccc(C(F)(F)F)c4)C3)c2c1	ZINC000450561187	FI	On-Demand	Anodyne	RBP4	29	41
COc1ccc(-c2noc(CN3CCN(C(=O)c4cccc(O)c4)CC3)n2)nn1	ZINC000450561189	GD	On-Demand	Anodyne	ALS	55	30
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561202	FG	On-Demand	Anodyne	P2RY12	48	38
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561202	FG	On-Demand	Anodyne	HRH3	23	41
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561202	FG	On-Demand	Anodyne	ADAM17	20	40
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561202	FG	On-Demand	Anodyne	COLA	79	40
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561202	FG	On-Demand	Anodyne	CPT1A	72	39
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561202	FG	On-Demand	Anodyne	EPHX2	20	43
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561202	FG	On-Demand	Anodyne	ELOVL6	0	40
CCOC(=O)COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561202	FG	On-Demand	Anodyne	LIMK2	20	42
C[C@@H]1[C@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCN1C	ZINC000450561204	DE	On-Demand	Anodyne	SLC6A1	62	32
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561206	FG	On-Demand	Anodyne	P2RY12	48	38
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561206	FG	On-Demand	Anodyne	HRH3	23	41
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561206	FG	On-Demand	Anodyne	ADAM17	20	40
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561206	FG	On-Demand	Anodyne	COLA	79	40
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561206	FG	On-Demand	Anodyne	CPT1A	72	39
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561206	FG	On-Demand	Anodyne	EPHX2	20	43
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561206	FG	On-Demand	Anodyne	ELOVL6	0	40
CCOC(=O)COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450561206	FG	On-Demand	Anodyne	LIMK2	20	42
C[C@@H]1[C@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)CCCN1C	ZINC000450561207	DE	On-Demand	Anodyne	SLC6A1	62	32
C[C@@H]1[C@@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCN1C	ZINC000450561210	DE	On-Demand	Anodyne	SLC6A1	62	32
C[C@@H]1[C@@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)CCCN1C	ZINC000450561213	DE	On-Demand	Anodyne	SLC6A1	62	32
COc1ccc(C2(CNC(=O)C[C@@H]3CC[C@H]4C[C@H]34)CCC2)cc1	ZINC000450561232	DH	On-Demand	Anodyne	KCNA3	44	39
COc1ccc(C2(CNC(=O)C[C@@H]3CC[C@H]4C[C@H]34)CCC2)cc1	ZINC000450561232	DH	On-Demand	Anodyne	ACAT	0	47
COc1ccc(C2(CNC(=O)C[C@@H]3CC[C@H]4C[C@@H]34)CCC2)cc1	ZINC000450561233	DH	On-Demand	Anodyne	KCNA3	44	39
COc1ccc(C2(CNC(=O)C[C@@H]3CC[C@H]4C[C@@H]34)CCC2)cc1	ZINC000450561233	DH	On-Demand	Anodyne	ACAT	0	47
COc1ccc(C2(CNC(=O)C[C@@H]3CC[C@@H]4C[C@@H]34)CCC2)cc1	ZINC000450561234	DH	On-Demand	Anodyne	KCNA3	44	39
COc1ccc(C2(CNC(=O)C[C@@H]3CC[C@@H]4C[C@@H]34)CCC2)cc1	ZINC000450561234	DH	On-Demand	Anodyne	ACAT	0	47
COc1ccc(C2(CNC(=O)C[C@@H]3CC[C@@H]4C[C@H]34)CCC2)cc1	ZINC000450561235	DH	On-Demand	Anodyne	ACAT	0	47
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1)C(F)(F)F	ZINC000450561244	GI	On-Demand	Anodyne	CHRM2	15	42
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1)C(F)(F)F	ZINC000450561244	GI	On-Demand	Anodyne	MLNR	22	40
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1)C(F)(F)F	ZINC000450561244	GI	On-Demand	Anodyne	FAAH	15	42
C[C@@H](c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1)C(F)(F)F	ZINC000450561244	GI	On-Demand	Anodyne	MGLL	0	41
C[C@H](c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1)C(F)(F)F	ZINC000450561245	GI	On-Demand	Anodyne	CHRM2	15	42
C[C@H](c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1)C(F)(F)F	ZINC000450561245	GI	On-Demand	Anodyne	MLNR	22	40
C[C@H](c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1)C(F)(F)F	ZINC000450561245	GI	On-Demand	Anodyne	FAAH	15	42
C[C@H](c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1)C(F)(F)F	ZINC000450561245	GI	On-Demand	Anodyne	MGLL	0	41
Cc1cccc(Cl)c1C(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1	ZINC000450561246	FH	On-Demand	Anodyne	CCR5	28	42
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(OC)c3)CCC2)cc1	ZINC000450561249	FG	On-Demand	Anodyne	TRPV1	37	50
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(OC)c3)CCC2)cc1	ZINC000450561249	FG	On-Demand	Anodyne	KCNA3	42	45
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(OC)c3)CCC2)cc1	ZINC000450561249	FG	On-Demand	Anodyne	MTNR1A	34	43
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(OC)c3)CCC2)cc1	ZINC000450561249	FG	On-Demand	Anodyne	MTNR1B	22	44
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(OC)c3)CCC2)cc1	ZINC000450561249	FG	On-Demand	Anodyne	NCE103	33	43
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(OC)c3)CCC2)cc1	ZINC000450561249	FG	On-Demand	Anodyne	P96878_MYCTU	23	43
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(OC)c3)CCC2)cc1	ZINC000450561249	FG	On-Demand	Anodyne	ACAT	0	52
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(OC)c3)CCC2)cc1	ZINC000450561249	FG	On-Demand	Anodyne	CAN2	0	43
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2cc(C)cc(C)c2)C1	ZINC000450561250	CH	On-Demand	Anodyne	ADAM10	24	44
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2cc(C)cc(C)c2)C1	ZINC000450561254	CH	On-Demand	Anodyne	ADAM10	24	44
Cc1cccc(Cl)c1C(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1	ZINC000450561255	FH	On-Demand	Anodyne	CCR5	28	42
CC(C)(O)C(C)(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450561256	EE	On-Demand	Anodyne	PTGER3	19	40
CC(C)(O)C(C)(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450561256	EE	On-Demand	Anodyne	CACNA1I	16	49
CC(C)(O)C(C)(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450561256	EE	On-Demand	Anodyne	IMDH_CRYPV	42	34
CCN1CC[C@H](N(C)C[C@H](O)[C@@H](C)c2ccccc2)[C@@H](C)C1	ZINC000450561258	DF	On-Demand	Anodyne	CCR5	43	38
CCN1CC[C@H](N(C)C[C@H](O)[C@H](C)c2ccccc2)[C@H](C)C1	ZINC000450561260	DF	On-Demand	Anodyne	CCR5	43	38
FC1(F)CC[C@@H](CN2CCN(c3ncccc3Cl)CC2)C1	ZINC000450561261	DG	On-Demand	Anodyne	OPRL1	16	41
CCN1CC[C@H](N(C)C[C@H](O)[C@H](C)c2ccccc2)[C@@H](C)C1	ZINC000450561262	DF	On-Demand	Anodyne	CCR5	43	38
CCN1CC[C@H](N(C)C[C@H](O)[C@@H](C)c2ccccc2)[C@H](C)C1	ZINC000450561263	DF	On-Demand	Anodyne	CCR5	43	38
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)C[S@@](C)=O)c1	ZINC000450561272	CD	On-Demand	Anodyne	GPR88	0	44
FC1(F)CC[C@H](CN2CCN(c3ncccc3Cl)CC2)C1	ZINC000450561273	DG	On-Demand	Anodyne	OPRL1	16	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](C)C[S@](C)=O)c1	ZINC000450561274	CD	On-Demand	Anodyne	GPR88	0	44
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](C)C[S@@](C)=O)c1	ZINC000450561275	CD	On-Demand	Anodyne	GPR88	0	44
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)C[S@](C)=O)c1	ZINC000450561277	CD	On-Demand	Anodyne	GPR88	0	44
O=C(NCCCNc1cccc(F)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450561282	EG	On-Demand	Anodyne	TBK1	56	46
O=C(NCCCNc1cccc(F)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450561283	EG	On-Demand	Anodyne	TBK1	56	46
O=C(C1CCN(C[C@@H]2CCCCC2(F)F)CC1)N(Cc1ccccc1)C1CC1	ZINC000450561284	GJ	On-Demand	Anodyne	CCR5	53	48
O=C(C1CCN(C[C@@H]2CCCCC2(F)F)CC1)N(Cc1ccccc1)C1CC1	ZINC000450561284	GJ	On-Demand	Anodyne	CACNA1G	20	45
O=C(C1CCN(C[C@H]2CCCCC2(F)F)CC1)N(Cc1ccccc1)C1CC1	ZINC000450561289	GJ	On-Demand	Anodyne	CCR5	53	48
O=C(C1CCN(C[C@H]2CCCCC2(F)F)CC1)N(Cc1ccccc1)C1CC1	ZINC000450561289	GJ	On-Demand	Anodyne	CACNA1G	20	45
COc1cc(Br)ccc1CCCNC(=O)c1ccsn1	ZINC000450561290	FG	On-Demand	Anodyne	MTNR1B	20	40
CCOC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)CC12COC2	ZINC000450561296	EE	On-Demand	Anodyne	AKT1	32	41
Cc1ccn(-c2ccccc2C(=O)N2CCN(C)[C@H](C)[C@@H]2C)n1	ZINC000450561298	DE	On-Demand	Anodyne	AVPR2	20	40
CCOC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)CC12COC2	ZINC000450561299	EE	On-Demand	Anodyne	AKT1	32	41
Cc1ccn(-c2ccccc2C(=O)N2CCN(C)[C@@H](C)[C@@H]2C)n1	ZINC000450561300	DE	On-Demand	Anodyne	AVPR2	20	40
CN(CCc1ccccc1O)C(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450561301	FF	On-Demand	Anodyne	PREP	75	46
Cc1ccn(-c2ccccc2C(=O)N2CCN(C)[C@H](C)[C@H]2C)n1	ZINC000450561302	DE	On-Demand	Anodyne	AVPR2	20	40
O=C(CCCN1CCCC[C@H]1c1cn[nH]c1)c1ccccc1	ZINC000450561303	CH	On-Demand	Anodyne	SLC6A1	46	35
O=C(CCCN1CCCC[C@H]1c1cn[nH]c1)c1ccccc1	ZINC000450561303	CH	On-Demand	Anodyne	CPT1A	66	35
O=C(CCCN1CCCC[C@H]1c1cn[nH]c1)c1ccccc1	ZINC000450561303	CH	On-Demand	Anodyne	CYP2J2	51	36
Cc1ccn(-c2ccccc2C(=O)N2CCN(C)[C@@H](C)[C@H]2C)n1	ZINC000450561304	DE	On-Demand	Anodyne	AVPR2	20	40
O=C(CCCN1CCCC[C@@H]1c1cn[nH]c1)c1ccccc1	ZINC000450561305	CH	On-Demand	Anodyne	SLC6A1	46	35
O=C(CCCN1CCCC[C@@H]1c1cn[nH]c1)c1ccccc1	ZINC000450561305	CH	On-Demand	Anodyne	CPT1A	66	35
O=C(CCCN1CCCC[C@@H]1c1cn[nH]c1)c1ccccc1	ZINC000450561305	CH	On-Demand	Anodyne	CYP2J2	51	36
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	CA2	25	50
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	LTA4H	18	41
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	CA1	21	50
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	CA5B	31	50
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	CA4	26	50
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	CA5A	36	50
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	MMP2	23	40
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	MMP3	15	40
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	MMP8	31	40
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	MMP9	28	40
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	MMP1	26	40
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	E1	0	51
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	LIMK2	46	42
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	RORC	63	51
CCS(=O)(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450561309	FE	On-Demand	Anodyne	NAMPT	35	40
CCN1CC[C@@H](N(C)Cc2ccn(CCc3ccccc3)n2)[C@@H](C)C1	ZINC000450561312	EG	On-Demand	Anodyne	SIGMAR1	16	40
CCN1CC[C@H](N(C)Cc2ccn(CCc3ccccc3)n2)[C@H](C)C1	ZINC000450561315	EG	On-Demand	Anodyne	SIGMAR1	16	40
CCN1CC[C@H](N(C)Cc2ccn(CCc3ccccc3)n2)[C@@H](C)C1	ZINC000450561317	EG	On-Demand	Anodyne	SIGMAR1	16	40
CCN1CC[C@@H](N(C)Cc2ccn(CCc3ccccc3)n2)[C@H](C)C1	ZINC000450561319	EG	On-Demand	Anodyne	SIGMAR1	16	40
CN1C(=O)C[C@@H](C(=O)NCCCNc2ccccc2F)[C@@H]1c1cccnc1	ZINC000450561327	FE	On-Demand	Anodyne	NAMPT	18	40
CCSc1cccnc1C(=O)NCCCNc1cccc(F)c1	ZINC000450561332	EH	On-Demand	Anodyne	TBK1	17	44
CO[C@H](Cc1ccccc1)C(=O)N(C)CCc1ccccc1O	ZINC000450561343	DF	On-Demand	Anodyne	CPA1	40	34
CO[C@@H](Cc1ccccc1)C(=O)N(C)CCc1ccccc1O	ZINC000450561344	DF	On-Demand	Anodyne	CPA1	40	34
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450561371	FH	On-Demand	Anodyne	PYGL	0	49
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450561371	FH	On-Demand	Anodyne	MAPK1	30	42
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450561371	FH	On-Demand	Anodyne	EPHX2	35	42
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450561371	FH	On-Demand	Anodyne	ERBB4	46	35
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450561371	FH	On-Demand	Anodyne	MCHR1	50	43
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450561371	FH	On-Demand	Anodyne	CACNA1G	36	41
Cc1cccc(O)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450561386	EG	On-Demand	Anodyne	DGAT1	26	42
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450561403	EG	On-Demand	Anodyne	MME	49	39
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450561403	EG	On-Demand	Anodyne	AMP1_PLAFQ	51	42
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450561405	EG	On-Demand	Anodyne	MME	49	39
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccc(F)c(F)c1F	ZINC000450561405	EG	On-Demand	Anodyne	AMP1_PLAFQ	51	42
COc1ccc(-c2noc(CN3CCC(Nc4ccc(F)cc4)CC3)n2)nn1	ZINC000450561411	GF	On-Demand	Anodyne	SSTR5	51	35
CCOC(=O)c1ccc(CN(C(C)C)C2CCCC2)nc1	ZINC000450561412	CG	On-Demand	Anodyne	SCARB1	53	36
Cc1cccc(N(CCC(N)=O)C[C@@H]2CCCCC2(F)F)c1	ZINC000450561419	DH	On-Demand	Anodyne	AMY2	43	29
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)CCN1C1CCN(C)CC1	ZINC000450561427	FD	On-Demand	Anodyne	L3MBTL1	0	44
C[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)CCN1C1CCN(C)CC1	ZINC000450561427	FD	On-Demand	Anodyne	L3MBTL3	50	44
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)CCN1C1CCN(C)CC1	ZINC000450561428	FD	On-Demand	Anodyne	L3MBTL1	0	44
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)CCN1C1CCN(C)CC1	ZINC000450561428	FD	On-Demand	Anodyne	L3MBTL3	50	44
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1Cc1ccc(C(C)=O)cc1	ZINC000450561436	FH	On-Demand	Anodyne	DRD2	45	36
Cc1cccc(N(CCC(N)=O)C[C@H]2CCCCC2(F)F)c1	ZINC000450561437	DH	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@@H]1CN(c2ccncc2C)C[C@H]1c1ccc(O)cc1	ZINC000450561439	DE	On-Demand	Anodyne	SLC6A1	70	44
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1Cc1ccc(C(C)=O)cc1	ZINC000450561442	FH	On-Demand	Anodyne	DRD2	45	36
COC(=O)[C@@H](c1ccccc1)N(C)C[C@H]1CCC(F)(F)C1	ZINC000450561443	CG	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@H](c1ccccc1)N(C)C[C@H]1CCC(F)(F)C1	ZINC000450561444	CG	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H]1CCC(F)(F)C1	ZINC000450561445	CG	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@@H](c1ccccc1)N(C)C[C@@H]1CCC(F)(F)C1	ZINC000450561446	CG	On-Demand	Anodyne	AMY2	43	29
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450561471	FF	On-Demand	Bother	CCR5	20	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCO[C@H]1C	ZINC000450561476	CD	On-Demand	Anodyne	MME	71	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCO[C@H]1C	ZINC000450561476	CD	On-Demand	Anodyne	ANPEP	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCO[C@H]1C	ZINC000450561476	CD	On-Demand	Anodyne	TIMP3	68	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCO[C@H]1C	ZINC000450561476	CD	On-Demand	Anodyne	PSMB8	60	35
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCO[C@H]1C	ZINC000450561477	CD	On-Demand	Anodyne	MME	71	35
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCO[C@H]1C	ZINC000450561477	CD	On-Demand	Anodyne	ANPEP	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCO[C@H]1C	ZINC000450561477	CD	On-Demand	Anodyne	TIMP3	68	38
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCO[C@H]1C	ZINC000450561477	CD	On-Demand	Anodyne	PSMB8	60	35
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCO[C@@H]1C	ZINC000450561478	CD	On-Demand	Anodyne	MME	71	35
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCO[C@@H]1C	ZINC000450561478	CD	On-Demand	Anodyne	ANPEP	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCO[C@@H]1C	ZINC000450561478	CD	On-Demand	Anodyne	TIMP3	68	38
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCO[C@@H]1C	ZINC000450561478	CD	On-Demand	Anodyne	PSMB8	60	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCO[C@@H]1C	ZINC000450561479	CD	On-Demand	Anodyne	MME	71	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCO[C@@H]1C	ZINC000450561479	CD	On-Demand	Anodyne	ANPEP	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCO[C@@H]1C	ZINC000450561479	CD	On-Demand	Anodyne	TIMP3	68	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCO[C@@H]1C	ZINC000450561479	CD	On-Demand	Anodyne	PSMB8	60	35
CO[C@H](Cc1ccccc1)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450561483	FF	On-Demand	Bother	CCR5	20	41
CO[C@H](Cc1ccccc1)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450561484	FF	On-Demand	Bother	CCR5	20	41
CO[C@@H](Cc1ccccc1)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450561485	FF	On-Demand	Bother	CCR5	20	41
CCOC(=O)c1ccc(CN2CCC(NC(C)C)CC2)nc1	ZINC000450561505	DE	On-Demand	Anodyne	CHRM1	17	41
CCOC(=O)c1ccc(CN2CCC(NC(C)C)CC2)nc1	ZINC000450561505	DE	On-Demand	Anodyne	P2RY12	31	40
CCOC(=O)c1ccc(CN2CCC(NC(C)C)CC2)nc1	ZINC000450561505	DE	On-Demand	Anodyne	CHRM3	15	41
CCOC(=O)c1ccc(CN2CCC(NC(C)C)CC2)nc1	ZINC000450561505	DE	On-Demand	Anodyne	SSTR5	62	48
CCOC(=O)c1ccc(CN2CCC(NC(C)C)CC2)nc1	ZINC000450561505	DE	On-Demand	Anodyne	MCHR1	25	41
CCOC(=O)c1ccc(CN2CCC(NC(C)C)CC2)nc1	ZINC000450561505	DE	On-Demand	Anodyne	SCARB1	46	34
C[C@H](O)CCN1CCCc2c(NC(=O)Nc3ccccc3F)cccc21	ZINC000450561515	FH	On-Demand	Anodyne	KCNQ2	73	41
C[C@@H](O)CCN1CCCc2c(NC(=O)Nc3ccccc3F)cccc21	ZINC000450561522	FH	On-Demand	Anodyne	KCNQ2	73	41
C[C@@H](Nc1ccc(C(=O)NCCO)nn1)c1ccc(F)cc1Cl	ZINC000450561536	ED	On-Demand	Anodyne	ALPL	43	38
CC(C)(C)[C@H](NCC/C=C/c1ccccc1)C(N)=O	ZINC000450561547	CF	On-Demand	Anodyne	GRIK1	26	41
CC(C)(C)[C@@H](NCC/C=C\c1ccccc1)C(N)=O	ZINC000450561548	CF	On-Demand	Anodyne	GRIK1	26	41
CC(C)(C)[C@@H](NCC/C=C/c1ccccc1)C(N)=O	ZINC000450561550	CF	On-Demand	Anodyne	GRIK1	26	41
CC(C)(C)[C@H](NCC/C=C\c1ccccc1)C(N)=O	ZINC000450561551	CF	On-Demand	Anodyne	GRIK1	26	41
COc1cccc(OCCC(=O)N2CCC[C@H]2c2ncc[nH]2)c1	ZINC000450561552	DF	On-Demand	Anodyne	PRCP	40	39
COc1cccc(OCCC(=O)N2CCC[C@H]2c2ncc[nH]2)c1	ZINC000450561552	DF	On-Demand	Anodyne	COLA	122	41
COc1cccc(OCCC(=O)N2CCC[C@H]2c2ncc[nH]2)c1	ZINC000450561552	DF	On-Demand	Anodyne	CPT1A	106	40
COc1cccc(OCCC(=O)N2CCC[C@H]2c2ncc[nH]2)c1	ZINC000450561552	DF	On-Demand	Anodyne	CHRNA10	34	44
Cc1ccc(C(=O)Nc2cccc(CCN3CCCC3)c2)c(C(C)C)n1	ZINC000450561553	FI	On-Demand	Anodyne	HTR1A	24	56
Cc1ccc(C(=O)Nc2cccc(CCN3CCCC3)c2)c(C(C)C)n1	ZINC000450561553	FI	On-Demand	Anodyne	HTR1D	68	56
Cc1ccc(C(=O)Nc2cccc(CCN3CCCC3)c2)c(C(C)C)n1	ZINC000450561553	FI	On-Demand	Anodyne	HTR1B	57	56
Cc1ccc(C(=O)Nc2cccc(CCN3CCCC3)c2)c(C(C)C)n1	ZINC000450561553	FI	On-Demand	Anodyne	MCHR1	29	42
Cc1ccc(C(=O)Nc2cccc(CCN3CCCC3)c2)c(C(C)C)n1	ZINC000450561553	FI	On-Demand	Anodyne	P2RY14	42	31
Cc1ccc(C(=O)Nc2cccc(CCN3CCCC3)c2)c(C(C)C)n1	ZINC000450561553	FI	On-Demand	Anodyne	BIRC2	40	35
Cc1ccc(C(=O)Nc2cccc(CCN3CCCC3)c2)c(C(C)C)n1	ZINC000450561553	FI	On-Demand	Anodyne	KCNK3	53	36
Cc1ccc(C(=O)Nc2cccc(CCN3CCCC3)c2)c(C(C)C)n1	ZINC000450561553	FI	On-Demand	Anodyne	KCNK9	44	36
COc1cccc(OCCC(=O)N2CCC[C@@H]2c2ncc[nH]2)c1	ZINC000450561554	DF	On-Demand	Anodyne	PRCP	40	39
COc1cccc(OCCC(=O)N2CCC[C@@H]2c2ncc[nH]2)c1	ZINC000450561554	DF	On-Demand	Anodyne	COLA	122	41
COc1cccc(OCCC(=O)N2CCC[C@@H]2c2ncc[nH]2)c1	ZINC000450561554	DF	On-Demand	Anodyne	CPT1A	106	40
COc1cccc(OCCC(=O)N2CCC[C@@H]2c2ncc[nH]2)c1	ZINC000450561554	DF	On-Demand	Anodyne	CHRNA10	34	44
C[C@H](Nc1ccc(C(=O)NCCO)nn1)c1ccc(F)cc1Cl	ZINC000450561556	ED	On-Demand	Anodyne	ALPL	43	38
CC[C@](NC[C@@H](O)[C@@H](C)c1ccccc1)(C(=O)OC)c1ccccc1	ZINC000450561559	EG	On-Demand	Anodyne	AMY2	55	33
O=C(c1cccc2c1CCCC2)N1C[C@H]2[C@H](O)CC[C@H]2C1	ZINC000450561560	CE	On-Demand	Anodyne	FABP4	45	34
CC[C@](NC[C@H](O)[C@H](C)c1ccccc1)(C(=O)OC)c1ccccc1	ZINC000450561562	EG	On-Demand	Anodyne	AMY2	55	33
CC[C@](NC[C@H](O)[C@@H](C)c1ccccc1)(C(=O)OC)c1ccccc1	ZINC000450561564	EG	On-Demand	Anodyne	AMY2	55	33
CC[C@](NC[C@@H](O)[C@H](C)c1ccccc1)(C(=O)OC)c1ccccc1	ZINC000450561566	EG	On-Demand	Anodyne	AMY2	55	33
O=C(c1cccc2c1CCCC2)N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000450561570	CE	On-Demand	Anodyne	FABP4	45	34
O=C(c1cccc2c1CCCC2)N1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000450561572	CE	On-Demand	Anodyne	FABP4	45	34
O=C(c1cccc2c1CCCC2)N1C[C@H]2[C@@H](O)CC[C@H]2C1	ZINC000450561573	CE	On-Demand	Anodyne	FABP4	45	34
O=C1CCCCN1CC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450561589	GG	On-Demand	Anodyne	ACHE	40	60
O=C1CCCCN1CC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450561589	GG	On-Demand	Anodyne	SIGMAR1	44	40
C/C=C\COc1cccc(CC(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450561593	FE	On-Demand	Anodyne	HRH2	45	36
C/C=C/COc1cccc(CC(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450561594	FE	On-Demand	Anodyne	HRH2	45	36
CC[C@@](NCC[C@@H]1CCOC1)(C(=O)OC)c1ccccc1	ZINC000450561611	CE	On-Demand	Anodyne	AMY2	55	32
CC[C@](NCC[C@@H]1CCOC1)(C(=O)OC)c1ccccc1	ZINC000450561612	CE	On-Demand	Anodyne	AMY2	55	32
CC[C@](NCC[C@H]1CCOC1)(C(=O)OC)c1ccccc1	ZINC000450561613	CE	On-Demand	Anodyne	AMY2	55	32
CC[C@@](NCC[C@H]1CCOC1)(C(=O)OC)c1ccccc1	ZINC000450561614	CE	On-Demand	Anodyne	AMY2	55	32
Cn1cc(-c2ccc(C(=O)Nc3ncn(C4CCCCC4)n3)o2)cn1	ZINC000450561644	EE	On-Demand	Anodyne	MMP13	16	47
COC[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450561652	BD	On-Demand	Anodyne	HPGDS	16	44
CC(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450561664	DG	On-Demand	Bother	TAAR1	16	42
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	DRD2	15	41
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	ACHE	28	42
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	HRH1	19	40
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	AVPR1B	44	36
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	HTR4	40	39
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	CHAT	25	40
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	SSTR5	63	40
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	CCR3	34	46
COc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1Cl	ZINC000450561670	FH	On-Demand	Anodyne	MCHR1	21	40
COc1ccc(CNC(=O)CCNC(C)(C)c2noc(C)n2)c(OC)c1	ZINC000450561687	FD	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCNC(C)(C)c2noc(C)n2)c(OC)c1	ZINC000450561687	FD	On-Demand	Anodyne	MTNR1B	42	37
CCOc1ccccc1CN(CCCn1ccnc1)CC1CCC(=O)CC1	ZINC000450561693	FH	On-Demand	Anodyne	CYP19A1	15	41
C=CCOc1ccc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)cc1	ZINC000450561706	FE	On-Demand	Mild	LTA4H	29	40
C=CCOc1ccc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)cc1	ZINC000450561706	FE	On-Demand	Mild	BRS3	21	40
C=CCOc1ccc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)cc1	ZINC000450561708	FE	On-Demand	Mild	LTA4H	29	40
C=CCOc1ccc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)cc1	ZINC000450561708	FE	On-Demand	Mild	BRS3	21	40
CC[C@@](NCc1ccccc1OC1CC1)(C(=O)OC)c1ccccc1	ZINC000450561709	EH	On-Demand	Anodyne	AMY2	56	32
CC(F)(F)CCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450561711	DG	On-Demand	Anodyne	DHOD	0	44
O=C(c1cnc(NCCCC2CCOCC2)c(Cl)c1)N1CCOCC1	ZINC000450561715	FF	On-Demand	Anodyne	LRRK2	28	41
CC[C@](NCc1ccccc1OC1CC1)(C(=O)OC)c1ccccc1	ZINC000450561717	EH	On-Demand	Anodyne	AMY2	56	32
C[C@H](OCCc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450561731	DD	On-Demand	Anodyne	CAPN2	73	38
C[C@H](OCCc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450561731	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	41
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1Cc1cccc(C(C)=O)c1	ZINC000450561733	FH	On-Demand	Anodyne	CCR3	18	42
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1Cc1cccc(C(C)=O)c1	ZINC000450561733	FH	On-Demand	Anodyne	ACKR3	44	30
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1Cc1cccc(C(C)=O)c1	ZINC000450561735	FH	On-Demand	Anodyne	CCR3	18	42
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1Cc1cccc(C(C)=O)c1	ZINC000450561735	FH	On-Demand	Anodyne	ACKR3	44	30
C[C@@H](OCCc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450561737	DD	On-Demand	Anodyne	CAPN2	73	38
C[C@@H](OCCc1ccccc1)C(=O)NCCCn1ccnn1	ZINC000450561737	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	41
Cc1sccc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450561741	FH	On-Demand	Anodyne	CNR2	0	48
Cc1sccc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450561741	FH	On-Demand	Anodyne	EPHX2	27	43
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450561742	GH	On-Demand	Anodyne	F2	27	41
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450561742	GH	On-Demand	Anodyne	FKBP1A	42	35
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450561742	GH	On-Demand	Anodyne	CTRA_BOVIN	49	30
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450561742	GH	On-Demand	Anodyne	TRY1_BOVIN	43	32
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450561742	GH	On-Demand	Anodyne	BRCA1	61	32
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450561744	GH	On-Demand	Anodyne	F2	27	41
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450561744	GH	On-Demand	Anodyne	FKBP1A	42	35
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450561744	GH	On-Demand	Anodyne	CTRA_BOVIN	49	30
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450561744	GH	On-Demand	Anodyne	TRY1_BOVIN	43	32
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450561744	GH	On-Demand	Anodyne	BRCA1	61	32
CCC(=O)C1(C(=O)NCCn2c3ccccc3c3ccccc32)CC1	ZINC000450561746	EH	On-Demand	Anodyne	FABP4	15	40
CCC(=O)C1(C(=O)NCCn2c3ccccc3c3ccccc32)CC1	ZINC000450561746	EH	On-Demand	Anodyne	MCHR2	42	34
O=C(NC1CC1)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450561747	EG	On-Demand	Bother	TTK	25	40
COC(=O)C(C)(C)N(C)CC1CCC(=O)CC1	ZINC000450561748	BD	On-Demand	Anodyne	AMY2	44	30
CC[C@](NC[C@@H]1C[C@H]2CC[C@H]1O2)(C(=O)OC)c1ccccc1	ZINC000450561749	DF	On-Demand	Anodyne	AMY2	45	31
CC[C@](NC[C@H]1C[C@H]2CC[C@H]1O2)(C(=O)OC)c1ccccc1	ZINC000450561750	DF	On-Demand	Anodyne	AMY2	45	31
CC[C@@](NC[C@H]1C[C@H]2CC[C@H]1O2)(C(=O)OC)c1ccccc1	ZINC000450561751	DF	On-Demand	Anodyne	AMY2	45	31
CC[C@@](NC[C@@H]1C[C@H]2CC[C@H]1O2)(C(=O)OC)c1ccccc1	ZINC000450561752	DF	On-Demand	Anodyne	AMY2	45	31
CCOc1cc(C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)on1	ZINC000450561763	ED	On-Demand	Anodyne	GALR1	43	31
CCOc1cc(C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)on1	ZINC000450561765	ED	On-Demand	Anodyne	GALR1	43	31
COc1cc(CC(=O)NCCCn2ccnn2)ccc1Cl	ZINC000450561768	DD	On-Demand	Anodyne	TRPV1	0	46
COc1cc(CC(=O)NCCCn2ccnn2)ccc1Cl	ZINC000450561768	DD	On-Demand	Anodyne	NCE103	26	48
CC(=O)[C@@](C)(O)CN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	ZINC000450561771	GB	On-Demand	Anodyne	PKM	40	40
CC(=O)[C@](C)(O)CN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	ZINC000450561781	GB	On-Demand	Anodyne	PKM	40	40
CCOc1cc(C(=O)NCC2(CO)CCC2)on1	ZINC000450561786	CC	On-Demand	Anodyne	HCN1	41	32
CCOc1cc(C(=O)NCC2(CO)CCC2)on1	ZINC000450561786	CC	On-Demand	Anodyne	HCN4	41	32
COc1cc(Br)c(C(=O)NCC2(CO)CCC2)cc1OC	ZINC000450561799	FE	On-Demand	Anodyne	KCNA3	47	39
COc1cc(Br)c(C(=O)NCC2(CO)CCC2)cc1OC	ZINC000450561799	FE	On-Demand	Anodyne	SLC6A5	15	42
COc1cc(Br)c(C(=O)NCC2(CO)CCC2)cc1OC	ZINC000450561799	FE	On-Demand	Anodyne	HCN1	55	39
COc1cc(Br)c(C(=O)NCC2(CO)CCC2)cc1OC	ZINC000450561799	FE	On-Demand	Anodyne	HCN4	50	38
C[C@H]1Cc2cccc(C(=O)NCC[C@@H](C)N3CCCCC3)c2O1	ZINC000450561808	DG	On-Demand	Anodyne	HCN1	43	33
C[C@H]1Cc2cccc(C(=O)NCC[C@@H](C)N3CCCCC3)c2O1	ZINC000450561808	DG	On-Demand	Anodyne	HCN4	41	35
C[C@H]1Cc2cccc(C(=O)NCC[C@H](C)N3CCCCC3)c2O1	ZINC000450561809	DG	On-Demand	Anodyne	HCN1	43	33
C[C@H]1Cc2cccc(C(=O)NCC[C@H](C)N3CCCCC3)c2O1	ZINC000450561809	DG	On-Demand	Anodyne	HCN4	41	35
C[C@@H]1Cc2cccc(C(=O)NCC[C@@H](C)N3CCCCC3)c2O1	ZINC000450561810	DG	On-Demand	Anodyne	HCN1	43	33
C[C@@H]1Cc2cccc(C(=O)NCC[C@@H](C)N3CCCCC3)c2O1	ZINC000450561810	DG	On-Demand	Anodyne	HCN4	41	35
C[C@@H](CCNC(=O)c1cccc2c1O[C@H](C)C2)N1CCCCC1	ZINC000450561811	DG	On-Demand	Anodyne	HCN1	43	33
C[C@@H](CCNC(=O)c1cccc2c1O[C@H](C)C2)N1CCCCC1	ZINC000450561811	DG	On-Demand	Anodyne	HCN4	41	35
C[C@H](CCO)CCNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450561816	GI	On-Demand	Anodyne	NPBWR1	43	37
C[C@@H](CCO)CCNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450561817	GI	On-Demand	Anodyne	NPBWR1	43	37
c1nc(NCCCC2CCOCC2)c2ncn(C3CC3)c2n1	ZINC000450561819	DF	On-Demand	Anodyne	ADORA1	41	44
c1nc(NCCCC2CCOCC2)c2ncn(C3CC3)c2n1	ZINC000450561819	DF	On-Demand	Anodyne	ADORA2A	0	44
c1nc(NCCCC2CCOCC2)c2ncn(C3CC3)c2n1	ZINC000450561819	DF	On-Demand	Anodyne	Q4VQ11_PIG	42	41
COC(=O)C1(CNC(=O)c2cn(CC3CC3)nn2)CCCCC1	ZINC000450561832	DD	On-Demand	Anodyne	HCN4	52	34
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@H](C(C)(C)C)C2)cn1	ZINC000450561850	EH	On-Demand	Anodyne	L3MBTL3	40	38
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@@H](C(C)(C)C)C2)cn1	ZINC000450561852	EH	On-Demand	Anodyne	L3MBTL3	40	38
O=C(NCC[C@@H]1CCOC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450561862	CE	On-Demand	Anodyne	PDE8B	19	40
O=C(NCC[C@H]1CCOC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450561863	CE	On-Demand	Anodyne	PDE8B	19	40
O=C(NCC[C@@H]1CCOC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450561864	CE	On-Demand	Anodyne	PDE8B	19	40
O=C(NCC[C@H]1CCOC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450561865	CE	On-Demand	Anodyne	PDE8B	19	40
CC(=O)NC1CCC(N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450561872	GH	On-Demand	Anodyne	RBP4	81	36
COc1ccc(-c2nnc(SCC(=O)CC[C@@H]3CCCCO3)o2)cc1	ZINC000450561876	FH	On-Demand	Anodyne	GSK3A	16	43
COc1ccc(-c2nnc(SCC(=O)CC[C@H]3CCCCO3)o2)cc1	ZINC000450561877	FH	On-Demand	Anodyne	GSK3A	16	43
Cc1cccc([C@H]2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)C2)c1	ZINC000450561898	DE	On-Demand	Anodyne	PARP2	42	36
Cc1cccc([C@H]2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)C2)c1	ZINC000450561898	DE	On-Demand	Anodyne	SLC9A1	43	36
Cc1cccc([C@H]2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)C2)c1	ZINC000450561898	DE	On-Demand	Anodyne	FASN	40	34
Cc1cccc([C@@H]2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)C2)c1	ZINC000450561905	DE	On-Demand	Anodyne	PARP2	42	36
Cc1cccc([C@@H]2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)C2)c1	ZINC000450561905	DE	On-Demand	Anodyne	SLC9A1	43	36
Cc1cccc([C@@H]2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)C2)c1	ZINC000450561905	DE	On-Demand	Anodyne	FASN	40	34
CC(=O)CCCCCSc1nc2ccccc2n1C	ZINC000450561941	CH	On-Demand	Anodyne	PTGDR2	18	53
COC(=O)c1coc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)n1	ZINC000450561943	FE	On-Demand	Anodyne	SLC6A1	46	33
COC(=O)c1coc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)n1	ZINC000450561944	FE	On-Demand	Anodyne	SLC6A1	46	33
COc1ccc(-c2noc(CN3CCN([C@@H](C#N)c4ccccc4)CC3)n2)nn1	ZINC000450561945	GD	On-Demand	Mild	PTAFR	30	41
COc1ccc(-c2noc(CN3CCN([C@H](C#N)c4ccccc4)CC3)n2)nn1	ZINC000450561947	GD	On-Demand	Mild	PTAFR	30	41
O=C(Cc1ccc(O)c(F)c1)NCC[C@H]1CCOC1	ZINC000450561950	CD	On-Demand	Anodyne	CAN2	0	40
O=C(Cc1ccc(O)c(F)c1)NCC[C@@H]1CCOC1	ZINC000450561951	CD	On-Demand	Anodyne	CAN2	0	40
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	DRD2	28	40
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	DRD1	19	46
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	DRD4	15	44
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	HTR2A	28	46
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	HTR2C	25	48
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	SLC6A1	144	40
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	ERG2	19	40
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	HTR1F	49	38
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	CCR3	61	37
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	SLC18A3	0	43
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	HTR3B	0	42
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	MCHR1	15	45
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561983	GH	On-Demand	Anodyne	CYP2J2	49	39
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	DRD2	28	40
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	DRD1	19	46
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	DRD4	15	44
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	HTR2A	28	46
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	HTR2C	25	48
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	SLC6A1	144	40
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	ERG2	19	40
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	HTR1F	49	38
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	CCR3	61	37
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	SLC18A3	0	43
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	HTR3B	0	42
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	MCHR1	15	45
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nc1	ZINC000450561984	GH	On-Demand	Anodyne	CYP2J2	49	39
Fc1ccc(-c2nc(CN3CCN(CCc4cscn4)CC3)cs2)cc1	ZINC000450561985	GH	On-Demand	Anodyne	SCN9A	0	40
CC[C@H](O)CC(=O)N1CCc2ccc(C(=O)OC)cc2C1	ZINC000450561996	CD	On-Demand	Anodyne	SRD5A1	30	41
CC[C@H](O)CC(=O)N1CCc2ccc(C(=O)OC)cc2C1	ZINC000450561996	CD	On-Demand	Anodyne	SRD5A2	34	41
CC[C@H](O)CC(=O)N1CCc2ccc(C(=O)OC)cc2C1	ZINC000450561996	CD	On-Demand	Anodyne	HDAC6	39	41
CC[C@@H](O)CC(=O)N1CCc2ccc(C(=O)OC)cc2C1	ZINC000450561997	CD	On-Demand	Anodyne	SRD5A1	30	41
CC[C@@H](O)CC(=O)N1CCc2ccc(C(=O)OC)cc2C1	ZINC000450561997	CD	On-Demand	Anodyne	SRD5A2	34	41
CC[C@@H](O)CC(=O)N1CCc2ccc(C(=O)OC)cc2C1	ZINC000450561997	CD	On-Demand	Anodyne	HDAC6	39	41
COc1ccc(-c2noc(CN3CCC[C@@H]3C(=O)Nc3nccs3)n2)nn1	ZINC000450562015	GD	On-Demand	Anodyne	MAP1	88	35
COc1ccc(-c2noc(CN3CCC[C@H]3C(=O)Nc3nccs3)n2)nn1	ZINC000450562019	GD	On-Demand	Anodyne	MAP1	88	35
C[C@@H]1C[C@]1(C#N)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562023	DH	On-Demand	Mild	CACNA1B	50	38
C[C@@H]1C[C@]1(C#N)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562023	DH	On-Demand	Mild	CCR2	84	46
C[C@@H]1C[C@]1(C#N)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562023	DH	On-Demand	Mild	RBP4	34	43
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562025	DH	On-Demand	Mild	CACNA1B	50	38
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562025	DH	On-Demand	Mild	CCR2	84	46
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562025	DH	On-Demand	Mild	RBP4	34	43
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562027	DH	On-Demand	Mild	CACNA1B	50	38
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562027	DH	On-Demand	Mild	CCR2	84	46
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562027	DH	On-Demand	Mild	RBP4	34	43
C[C@@H]1C[C@]1(C#N)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450562029	DH	On-Demand	Mild	CACNA1B	50	38
C[C@H](CN1CCC(Oc2ccccn2)CC1)S(C)(=O)=O	ZINC000450562031	CD	On-Demand	Anodyne	SCN5A	54	35
Cc1ccnc(-c2noc(CN(C)CC(=O)NCc3ccccc3)n2)c1	ZINC000450562034	FE	On-Demand	Anodyne	UL54	47	32
C[C@@H](CN1CCC(Oc2ccccn2)CC1)S(C)(=O)=O	ZINC000450562038	CD	On-Demand	Anodyne	SCN5A	54	35
CCOCc1nc(C)c(C(=O)N2CC[C@H](c3cccc(C)c3)C2)s1	ZINC000450562040	EH	On-Demand	Anodyne	MGEA5	23	42
CCOCc1nc(C)c(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)s1	ZINC000450562042	EH	On-Demand	Anodyne	MGEA5	23	42
CC(F)(F)CCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O	ZINC000450562043	EH	On-Demand	Anodyne	BACE1	0	50
COc1ccc(Oc2ccc(C(=O)NCC(=O)C3CC3)nc2)cc1	ZINC000450562055	EF	On-Demand	Anodyne	ACACA	23	41
O=C(NCCCNc1cccc(F)c1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450562062	GG	On-Demand	Anodyne	TBK1	46	44
O=C(NCCCNc1cccc(F)c1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450562065	GG	On-Demand	Anodyne	TBK1	46	44
CCOC(=O)c1ccc(CN2CCc3ccc(S(=O)(=O)NC)cc32)nc1	ZINC000450562071	GD	On-Demand	Anodyne	P2RY12	34	43
CN(C[C@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562073	EH	On-Demand	Anodyne	CHRM2	15	44
CN(C[C@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562073	EH	On-Demand	Anodyne	CCR5	21	46
CN(C[C@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562073	EH	On-Demand	Anodyne	MCHR1	24	40
CN(C[C@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562073	EH	On-Demand	Anodyne	L3MBTL1	0	40
CN(C[C@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562073	EH	On-Demand	Anodyne	L3MBTL3	66	40
CN(C[C@@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562074	EH	On-Demand	Anodyne	CHRM2	15	44
CN(C[C@@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562074	EH	On-Demand	Anodyne	CCR5	21	46
CN(C[C@@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562074	EH	On-Demand	Anodyne	MCHR1	24	40
CN(C[C@@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562074	EH	On-Demand	Anodyne	L3MBTL1	0	40
CN(C[C@@H]1CCC(F)(F)C1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562074	EH	On-Demand	Anodyne	L3MBTL3	66	40
O=C(CCCN1CCC[C@H]1C(=O)Nc1nccs1)c1ccccc1	ZINC000450562084	EG	On-Demand	Anodyne	MAP	0	41
O=C(CCCN1CCC[C@H]1C(=O)Nc1nccs1)c1ccccc1	ZINC000450562084	EG	On-Demand	Anodyne	MAP1	96	38
O=C(CCCN1CCC[C@H]1C(=O)Nc1nccs1)c1ccccc1	ZINC000450562084	EG	On-Demand	Anodyne	PREP	46	48
O=C(CCCN1CCC[C@H]1C(=O)Nc1nccs1)c1ccccc1	ZINC000450562084	EG	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCC[C@@H]1C(=O)Nc1nccs1)c1ccccc1	ZINC000450562086	EG	On-Demand	Anodyne	MAP	0	41
O=C(CCCN1CCC[C@@H]1C(=O)Nc1nccs1)c1ccccc1	ZINC000450562086	EG	On-Demand	Anodyne	MAP1	96	38
O=C(CCCN1CCC[C@@H]1C(=O)Nc1nccs1)c1ccccc1	ZINC000450562086	EG	On-Demand	Anodyne	PREP	46	48
O=C(CCCN1CCC[C@@H]1C(=O)Nc1nccs1)c1ccccc1	ZINC000450562086	EG	On-Demand	Anodyne	CYP2J2	49	34
COc1cc(Br)ccc1CCCNC(=O)C1(CF)CCOCC1	ZINC000450562094	GG	On-Demand	Anodyne	MTNR1B	15	43
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	CHRM2	17	43
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	DRD2	17	45
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	DRD4	40	43
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	ACHE	25	43
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	DRD3	0	45
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	KCNH2	20	41
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	CHRM3	28	48
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	SIGMAR1	35	45
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	SSTR5	63	39
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	CCKAR	15	40
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	CCR3	58	44
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	MLNR	34	40
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	FAAH	15	41
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	CCKBR	25	40
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	CXCR3	29	49
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	MCHR1	55	43
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	CCR8	19	40
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	KCNK3	52	38
CC(=O)c1cccc(CN2CCC(Nc3cccc(C)c3)CC2)c1	ZINC000450562100	DI	On-Demand	Anodyne	KCNK9	43	38
Cc1cccc(O)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450562106	CF	On-Demand	Anodyne	PRNP	45	39
Cc1cccc(O)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450562106	CF	On-Demand	Anodyne	HDAC1	22	41
Cc1cccc(O)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450562106	CF	On-Demand	Anodyne	SHH	46	38
C[C@@H](O)CCCn1cnc2sc3c(c2c1=O)CCCCC3	ZINC000450562110	DF	On-Demand	Anodyne	HTR1B	17	42
C[C@H](O)CCCn1cnc2sc3c(c2c1=O)CCCCC3	ZINC000450562112	DF	On-Demand	Anodyne	HTR1B	17	42
Cc1cccc(Cl)c1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562120	FI	On-Demand	Anodyne	HSD11B1	0	43
Cc1cccc(Cl)c1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562120	FI	On-Demand	Anodyne	CCR5	35	44
Cc1cccc(Cl)c1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562120	FI	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cccc(Cl)c1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562120	FI	On-Demand	Anodyne	L3MBTL3	81	43
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	OPRK1	41	41
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	TACR2	70	41
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	NPY2R	33	41
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	CCR5	44	56
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	PYGL	0	56
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	TACR3	42	32
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	MAPK1	34	45
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	CCR2	0	43
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	EPHX2	30	53
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	TYK2	57	41
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	MCHR1	42	47
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562131	EG	On-Demand	Anodyne	PPX1	0	40
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	OPRK1	41	41
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	TACR2	70	41
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	NPY2R	33	41
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	CCR5	44	56
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	PYGL	0	56
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	TACR3	42	32
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	MAPK1	34	45
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	CCR2	0	43
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	EPHX2	30	53
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	TYK2	57	41
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	MCHR1	42	47
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562132	EG	On-Demand	Anodyne	PPX1	0	40
Cn1nc(C(=O)NCCCNc2cccc(F)c2)c2c1CCCC2	ZINC000450562150	EF	On-Demand	Anodyne	DRD4	40	30
Cc1cccc(NC2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450562152	EG	On-Demand	Anodyne	SSTR5	54	34
COc1cc(CN2C(=O)NC3(CCCCC3)C2=O)ccc1Cl	ZINC000450562155	DG	On-Demand	Anodyne	PDE7A	28	47
CN(CCC1=CCCCC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562159	EI	On-Demand	Anodyne	L3MBTL1	0	44
CN(CCC1=CCCCC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450562159	EI	On-Demand	Anodyne	L3MBTL3	91	44
CC(=O)NC[C@H](CC(=O)Nc1cc(S(N)(=O)=O)ccc1O)CC(C)C	ZINC000450562166	FD	On-Demand	Anodyne	CA2	68	42
CC(=O)NC[C@H](CC(=O)Nc1cc(S(N)(=O)=O)ccc1O)CC(C)C	ZINC000450562166	FD	On-Demand	Anodyne	CA1	56	41
CC(=O)NC[C@H](CC(=O)Nc1cc(S(N)(=O)=O)ccc1O)CC(C)C	ZINC000450562166	FD	On-Demand	Anodyne	CA5B	60	37
CC(=O)NC[C@H](CC(=O)Nc1cc(S(N)(=O)=O)ccc1O)CC(C)C	ZINC000450562166	FD	On-Demand	Anodyne	CA4	77	42
CC(=O)NC[C@H](CC(=O)Nc1cc(S(N)(=O)=O)ccc1O)CC(C)C	ZINC000450562166	FD	On-Demand	Anodyne	CA5A	65	37
CC(=O)NC[C@H](CC(=O)Nc1cc(S(N)(=O)=O)ccc1O)CC(C)C	ZINC000450562166	FD	On-Demand	Anodyne	CA14	22	41
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1O	ZINC000450562177	EF	On-Demand	Anodyne	TRPV1	22	47
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1O	ZINC000450562177	EF	On-Demand	Anodyne	P2RX7	0	43
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1O	ZINC000450562177	EF	On-Demand	Anodyne	NCE103	32	47
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1O	ZINC000450562177	EF	On-Demand	Anodyne	P96878_MYCTU	22	47
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1O	ZINC000450562177	EF	On-Demand	Anodyne	CAN2	0	47
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	HRH1	23	41
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	OPRK1	33	44
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	NPY2R	29	41
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	CCR3	30	41
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	PYGL	0	54
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	TACR3	49	31
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	MAPK1	31	42
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	CCR2	19	53
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	EPHX2	27	53
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	TYK2	55	39
O=C1CCC(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450562178	GI	On-Demand	Anodyne	MCHR1	27	41
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCC1	ZINC000450562179	DE	On-Demand	Mild	CA2	57	37
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCC1	ZINC000450562179	DE	On-Demand	Mild	CA1	52	37
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCC1	ZINC000450562179	DE	On-Demand	Mild	CA7	44	34
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCC1	ZINC000450562179	DE	On-Demand	Mild	CA5B	52	34
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCC1	ZINC000450562179	DE	On-Demand	Mild	CA4	63	37
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCC1	ZINC000450562179	DE	On-Demand	Mild	CA5A	55	34
C=CCC1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCCC1	ZINC000450562179	DE	On-Demand	Mild	P96878_MYCTU	40	31
C[C@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562181	GF	On-Demand	Anodyne	NPY2R	42	38
C[C@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562181	GF	On-Demand	Anodyne	MAPK1	34	41
C[C@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562181	GF	On-Demand	Anodyne	EPHX2	43	47
C[C@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562181	GF	On-Demand	Anodyne	ERBB4	53	34
C[C@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562181	GF	On-Demand	Anodyne	ENV	41	32
C[C@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562181	GF	On-Demand	Anodyne	MCHR1	43	43
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562187	GF	On-Demand	Anodyne	NPY2R	42	38
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562187	GF	On-Demand	Anodyne	MAPK1	34	41
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562187	GF	On-Demand	Anodyne	EPHX2	43	47
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562187	GF	On-Demand	Anodyne	ERBB4	53	34
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562187	GF	On-Demand	Anodyne	ENV	41	32
C[C@@H](CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450562187	GF	On-Demand	Anodyne	MCHR1	43	43
CCOC(=O)[C@@H]1CN(c2cc(C)nc3ccccc23)CC12COC2	ZINC000450562188	EF	On-Demand	Anodyne	ADAM17	62	36
CCOC(=O)[C@H]1CN(c2cc(C)nc3ccccc23)CC12COC2	ZINC000450562193	EF	On-Demand	Anodyne	ADAM17	62	36
C[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(C2CC2)c1	ZINC000450562206	EH	On-Demand	Bother	TAAR1	19	43
C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(C2CC2)c1	ZINC000450562207	EH	On-Demand	Bother	TAAR1	19	43
CCOC(=O)c1ccc(CN2CCC(N(C)S(=O)(=O)CC)CC2)nc1	ZINC000450562213	FD	On-Demand	Anodyne	SSTR5	49	42
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450562219	GH	On-Demand	Anodyne	F2	27	41
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450562219	GH	On-Demand	Anodyne	FKBP1A	42	35
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450562219	GH	On-Demand	Anodyne	CTRA_BOVIN	49	30
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450562219	GH	On-Demand	Anodyne	TRY1_BOVIN	43	32
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450562219	GH	On-Demand	Anodyne	BRCA1	61	32
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450562221	GH	On-Demand	Anodyne	F2	27	41
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450562221	GH	On-Demand	Anodyne	FKBP1A	42	35
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450562221	GH	On-Demand	Anodyne	CTRA_BOVIN	49	30
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450562221	GH	On-Demand	Anodyne	TRY1_BOVIN	43	32
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450562221	GH	On-Demand	Anodyne	BRCA1	61	32
CC(C)(C(=O)NCCC(=O)NCc1ccccn1)c1cccc2ccccc12	ZINC000450562227	GG	On-Demand	Anodyne	SUCNR1	60	36
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	FKBP1A	35	50
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	CELA1	45	33
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	ELANE	54	36
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	XPNPEP1	0	40
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	MMP13	40	43
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	TRY1_BOVIN	60	34
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	CCR4	0	46
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	ADAM17	43	42
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	ITGA4	49	50
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	CAPNS1	22	54
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	MMP3	44	43
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	MMP8	28	40
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	XPNPEP2	0	40
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	CAPN1	23	59
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	MMP9	29	44
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	MMP7	57	43
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	MMP1	49	47
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	XIAP	81	41
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	BIRC3	42	33
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	SFRP1	52	34
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	BIRC8	53	33
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	WNT3	55	33
C[C@@H](C[S@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562290	FC	On-Demand	Anodyne	BRCA1	59	33
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	FKBP1A	35	50
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	CELA1	45	33
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	ELANE	54	36
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	XPNPEP1	0	40
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	MMP13	40	43
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	TRY1_BOVIN	60	34
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	CCR4	0	46
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	ADAM17	43	42
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	ITGA4	49	50
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	CAPNS1	22	54
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	MMP3	44	43
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	MMP8	28	40
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	XPNPEP2	0	40
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	CAPN1	23	59
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	MMP9	29	44
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	MMP7	57	43
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	MMP1	49	47
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	XIAP	81	41
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	BIRC3	42	33
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	SFRP1	52	34
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	BIRC8	53	33
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	WNT3	55	33
C[C@@H](C[S@@](C)=O)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450562293	FC	On-Demand	Anodyne	BRCA1	59	33
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	HTR1A	20	45
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	DRD4	64	40
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	ACHE	17	43
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	AKT2	46	42
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	PRNP	51	35
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	FAAH	27	43
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	SORD	74	38
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	AKT1	24	42
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	MGLL	0	40
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	MRGPRX1	42	39
CC(=O)c1ccc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)cc1	ZINC000450562302	FH	On-Demand	Anodyne	SLC6A7	0	41
CCOC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1	ZINC000450562308	FE	On-Demand	Bother	SSTR5	47	41
CCOC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1	ZINC000450562308	FE	On-Demand	Bother	SLC27A4	44	32
CCOC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1	ZINC000450562313	FE	On-Demand	Bother	SSTR5	47	41
CCOC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc1	ZINC000450562313	FE	On-Demand	Bother	SLC27A4	44	32
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)c1	ZINC000450562326	FF	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)c1	ZINC000450562326	FF	On-Demand	Anodyne	CCR3	29	42
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)c1	ZINC000450562326	FF	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)C3)CC2)c1	ZINC000450562326	FF	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)c1	ZINC000450562327	FF	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)c1	ZINC000450562327	FF	On-Demand	Anodyne	CCR3	29	42
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)c1	ZINC000450562327	FF	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)C3)CC2)c1	ZINC000450562327	FF	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)c1	ZINC000450562329	FF	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)c1	ZINC000450562329	FF	On-Demand	Anodyne	CCR3	29	42
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)c1	ZINC000450562329	FF	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)C3)CC2)c1	ZINC000450562329	FF	On-Demand	Anodyne	ADIPOR2	0	40
COc1ccc(C(=O)NCCN2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450562330	GD	On-Demand	Anodyne	HTR1A	23	45
COc1ccc(C(=O)NCCN2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450562330	GD	On-Demand	Anodyne	DRD2	26	45
COc1ccc(C(=O)NCCN2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450562330	GD	On-Demand	Anodyne	DRD4	55	41
COc1ccc(C(=O)NCCN2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450562330	GD	On-Demand	Anodyne	DRD3	51	43
COc1ccc(C(=O)NCCN2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450562330	GD	On-Demand	Anodyne	PLD1	40	45
COc1ccc(C(=O)NCCN2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450562330	GD	On-Demand	Anodyne	CYP2D6	0	43
COc1ccc(C(=O)NCCN2CCN([C@@H](C)c3csnn3)CC2)cc1	ZINC000450562330	GD	On-Demand	Anodyne	PLD2	56	34
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)c1	ZINC000450562333	FF	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)c1	ZINC000450562333	FF	On-Demand	Anodyne	CCR3	29	42
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)c1	ZINC000450562333	FF	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1cccc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)C3)CC2)c1	ZINC000450562333	FF	On-Demand	Anodyne	ADIPOR2	0	40
COc1ccc(C(=O)NCCN2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450562334	GD	On-Demand	Anodyne	HTR1A	23	45
COc1ccc(C(=O)NCCN2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450562334	GD	On-Demand	Anodyne	DRD2	26	45
COc1ccc(C(=O)NCCN2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450562334	GD	On-Demand	Anodyne	DRD4	55	41
COc1ccc(C(=O)NCCN2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450562334	GD	On-Demand	Anodyne	DRD3	51	43
COc1ccc(C(=O)NCCN2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450562334	GD	On-Demand	Anodyne	PLD1	40	45
COc1ccc(C(=O)NCCN2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450562334	GD	On-Demand	Anodyne	CYP2D6	0	43
COc1ccc(C(=O)NCCN2CCN([C@H](C)c3csnn3)CC2)cc1	ZINC000450562334	GD	On-Demand	Anodyne	PLD2	56	34
CCOCc1nc(C)c(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)s1	ZINC000450562368	GE	On-Demand	Anodyne	SCD1	20	43
CCOCc1nc(C)c(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)s1	ZINC000450562368	GE	On-Demand	Anodyne	SCD	16	43
CCOCc1nc(C)c(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)s1	ZINC000450562378	GE	On-Demand	Anodyne	SCD1	20	43
CCOCc1nc(C)c(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)s1	ZINC000450562378	GE	On-Demand	Anodyne	SCD	16	43
CC1(C(=O)Nc2cccc(CCN3CCCC3)c2)CCC(=O)CC1	ZINC000450562395	EG	On-Demand	Anodyne	HTR1D	33	42
CC1(C(=O)Nc2cccc(CCN3CCCC3)c2)CCC(=O)CC1	ZINC000450562395	EG	On-Demand	Anodyne	HTR1B	24	41
CC1(C(=O)Nc2cccc(CCN3CCCC3)c2)CCC(=O)CC1	ZINC000450562395	EG	On-Demand	Anodyne	BIRC2	53	34
C[C@@H](O)CCCNC(C)(C)Cc1ccc(Br)cc1	ZINC000450562404	DH	On-Demand	Anodyne	ADRB1	0	40
C[C@H](O)CCCNC(C)(C)Cc1ccc(Br)cc1	ZINC000450562405	DH	On-Demand	Anodyne	ADRB1	0	40
C[C@H]1OCC[C@@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450562415	DE	On-Demand	Bother	CACNA1C	47	33
C[C@H]1OCC[C@@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450562415	DE	On-Demand	Bother	CACNA1D	79	33
C[C@H]1OCC[C@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450562417	DE	On-Demand	Bother	CACNA1C	47	33
C[C@H]1OCC[C@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450562417	DE	On-Demand	Bother	CACNA1D	79	33
C[C@@H]1OCC[C@@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450562419	DE	On-Demand	Bother	CACNA1C	47	33
C[C@@H]1OCC[C@@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450562419	DE	On-Demand	Bother	CACNA1D	79	33
C[C@@H]1OCC[C@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450562421	DE	On-Demand	Bother	CACNA1C	47	33
C[C@@H]1OCC[C@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450562421	DE	On-Demand	Bother	CACNA1D	79	33
C[C@@H]1CCO[C@@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450562442	FG	On-Demand	Anodyne	HTR1A	0	40
C[C@@H]1CCO[C@@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450562442	FG	On-Demand	Anodyne	HTR1D	42	38
C[C@@H]1CCO[C@@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450562442	FG	On-Demand	Anodyne	HTR1B	33	40
C[C@@H]1CCO[C@@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450562442	FG	On-Demand	Anodyne	MPO	63	37
C[C@@H]1CCO[C@@H]1C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450562442	FG	On-Demand	Anodyne	MTNR1A	19	46
Cc1nnc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)n1C	ZINC000450562473	CD	On-Demand	Anodyne	CSNK1D	19	40
Cc1nnc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)n1C	ZINC000450562473	CD	On-Demand	Anodyne	CSNK1E	25	40
CCOC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)nc1	ZINC000450562478	GD	On-Demand	Anodyne	SSTR5	53	46
CCOC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)nc1	ZINC000450562478	GD	On-Demand	Anodyne	FAAH	17	41
CCOC(=O)c1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)nc1	ZINC000450562478	GD	On-Demand	Anodyne	SCARB1	56	40
CC(=O)c1cccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)c1	ZINC000450562482	EH	On-Demand	Anodyne	LTA4H	18	40
CC(=O)c1cccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)C)c1	ZINC000450562482	EH	On-Demand	Anodyne	CCR3	24	40
O=C(c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)nc1)N1CCc2ccccc21	ZINC000450562505	FH	On-Demand	Anodyne	AVPR2	42	42
COc1cc(CN2CCN(c3ncc(C)s3)CC2)ccc1Cl	ZINC000450562509	EG	On-Demand	Anodyne	DRD1	0	45
COc1cc(CN2CCN(c3ncc(C)s3)CC2)ccc1Cl	ZINC000450562509	EG	On-Demand	Anodyne	DRD4	25	40
CC(=O)[C@](C)(O)CN1CCN(CCNS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450562516	GC	On-Demand	Anodyne	HTR7	25	52
CC(=O)[C@@](C)(O)CN1CCN(CCNS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450562518	GC	On-Demand	Anodyne	HTR7	25	52
COC[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562520	GF	On-Demand	Anodyne	HTR1D	35	42
COC[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562520	GF	On-Demand	Anodyne	HTR1B	30	42
COC[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562520	GF	On-Demand	Anodyne	NQO2	27	43
COC[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562520	GF	On-Demand	Anodyne	MTNR1A	22	48
COC[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562520	GF	On-Demand	Anodyne	MTNR1B	15	48
COC[C@@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562520	GF	On-Demand	Anodyne	ABCG2	26	43
COC[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562530	GF	On-Demand	Anodyne	HTR1D	35	42
COC[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562530	GF	On-Demand	Anodyne	HTR1B	30	42
COC[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562530	GF	On-Demand	Anodyne	NQO2	27	43
COC[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562530	GF	On-Demand	Anodyne	MTNR1A	22	48
COC[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562530	GF	On-Demand	Anodyne	MTNR1B	15	48
COC[C@]1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CCOC1	ZINC000450562530	GF	On-Demand	Anodyne	ABCG2	26	43
O=[N+]([O-])c1cc2ccccc2nc1NCCCC1CCOCC1	ZINC000450562537	DG	On-Demand	Bother	PRKCQ	45	38
CSc1cccc(C(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450562538	DE	On-Demand	Anodyne	DRD4	44	34
CC(F)(F)CCCNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450562540	EH	On-Demand	Anodyne	NPBWR1	41	41
COc1cccc(OCCC(=O)N[C@@H](CO)c2sccc2C)c1	ZINC000450562565	EF	On-Demand	Anodyne	MTNR1A	26	43
COc1cccc(OCCC(=O)N[C@H](CO)c2sccc2C)c1	ZINC000450562567	EF	On-Demand	Anodyne	MTNR1A	26	43
CCN(C1CCN(Cc2ccc(Cl)c(OC)c2)CC1)S(C)(=O)=O	ZINC000450562584	FF	On-Demand	Anodyne	AVPR1B	41	34
CCN(C1CCN(Cc2ccc(Cl)c(OC)c2)CC1)S(C)(=O)=O	ZINC000450562584	FF	On-Demand	Anodyne	SSTR5	73	45
O=C(CC1CC(F)(F)C1)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450562590	FH	On-Demand	Anodyne	EPHX2	28	41
O=C(CC1CC(F)(F)C1)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450562590	FH	On-Demand	Anodyne	ENV	40	32
O=C(C[C@@H]1COc2ccccc2O1)NCCCn1ccnn1	ZINC000450562600	DD	On-Demand	Anodyne	ADRA2B	21	41
O=C(C[C@H]1COc2ccccc2O1)NCCCn1ccnn1	ZINC000450562605	DD	On-Demand	Anodyne	ADRA2B	21	41
CN1CCN(S(=O)(=O)c2ccc(NCCCC3CCOCC3)nc2)CC1	ZINC000450562606	GD	On-Demand	Anodyne	NMT1	19	53
CN1CCN(S(=O)(=O)c2ccc(NCCCC3CCOCC3)nc2)CC1	ZINC000450562606	GD	On-Demand	Anodyne	MERTK	33	41
CN1CCN(S(=O)(=O)c2ccc(NCCCC3CCOCC3)nc2)CC1	ZINC000450562606	GD	On-Demand	Anodyne	GCKR	50	33
CC(C)C[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562643	GI	On-Demand	Anodyne	CTSK	25	42
CC(C)C[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562643	GI	On-Demand	Anodyne	ADAM17	22	53
CC(C)C[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562643	GI	On-Demand	Anodyne	MAP1	103	39
CC(C)C[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562643	GI	On-Demand	Anodyne	MMP3	31	46
CC(C)C[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562643	GI	On-Demand	Anodyne	MMP9	21	53
CC(C)C[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562643	GI	On-Demand	Anodyne	MMP1	22	53
CC(C)C[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562643	GI	On-Demand	Anodyne	HPN	58	32
CC(C)C[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562644	GI	On-Demand	Anodyne	CTSK	25	42
CC(C)C[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562644	GI	On-Demand	Anodyne	ADAM17	22	53
CC(C)C[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562644	GI	On-Demand	Anodyne	MAP1	103	39
CC(C)C[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562644	GI	On-Demand	Anodyne	MMP3	31	46
CC(C)C[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562644	GI	On-Demand	Anodyne	MMP9	21	53
CC(C)C[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562644	GI	On-Demand	Anodyne	MMP1	22	53
CC(C)C[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)Nc1nccs1	ZINC000450562644	GI	On-Demand	Anodyne	HPN	58	32
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ncn(C3CCCCC3)n2)c1	ZINC000450562645	GH	On-Demand	Anodyne	EPHX2	19	40
N#C[C@@H](c1ccccc1)N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450562675	FF	On-Demand	Mild	PTAFR	37	44
N#C[C@H](c1ccccc1)N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450562677	FF	On-Demand	Mild	PTAFR	37	44
C[C@@H](CCO)CCNc1ccnc2c(Cl)cccc12	ZINC000450562682	CH	On-Demand	Anodyne	HRP1_PLAFA	43	33
C[C@@H](CCO)CCNc1ccnc2c(Cl)cccc12	ZINC000450562682	CH	On-Demand	Anodyne	HNMT	46	34
C[C@H](CCO)CCNc1ccnc2c(Cl)cccc12	ZINC000450562683	CH	On-Demand	Anodyne	HRP1_PLAFA	43	33
C[C@H](CCO)CCNc1ccnc2c(Cl)cccc12	ZINC000450562683	CH	On-Demand	Anodyne	HNMT	46	34
COc1ccc(-c2ccnc(NCC[C@@H](C)CCO)n2)cc1	ZINC000450562701	DE	On-Demand	Anodyne	CLK4	26	57
COc1ccc(-c2ccnc(NCC[C@@H](C)CCO)n2)cc1	ZINC000450562701	DE	On-Demand	Anodyne	DYRK1B	15	57
COc1ccc(-c2ccnc(NCC[C@H](C)CCO)n2)cc1	ZINC000450562703	DE	On-Demand	Anodyne	CLK4	24	57
CC(=O)c1cccc(CN2CCC[C@H]2c2ncc(-c3ccc(F)cc3)[nH]2)c1	ZINC000450562704	FJ	On-Demand	Anodyne	PRCP	16	51
CC(=O)c1cccc(CN2CCC[C@H]2c2ncc(-c3ccc(F)cc3)[nH]2)c1	ZINC000450562704	FJ	On-Demand	Anodyne	CCR3	46	39
CC(=O)c1cccc(CN2CCC[C@@H]2c2ncc(-c3ccc(F)cc3)[nH]2)c1	ZINC000450562707	FJ	On-Demand	Anodyne	PRCP	16	51
CC(=O)c1cccc(CN2CCC[C@@H]2c2ncc(-c3ccc(F)cc3)[nH]2)c1	ZINC000450562707	FJ	On-Demand	Anodyne	CCR3	46	39
Cc1cc(Nc2cnn(C3CCOCC3)c2C)c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450562714	GJ	On-Demand	Bother	LRRK2	16	53
COc1ccc(C2(CNC(=O)[C@]3(C#N)C[C@H]3C)CCC2)cc1	ZINC000450562745	CF	On-Demand	Mild	KCNA3	41	41
COc1ccc(C2(CNC(=O)[C@]3(C#N)C[C@H]3C)CCC2)cc1	ZINC000450562745	CF	On-Demand	Mild	MTNR1A	19	40
COc1ccc(C2(CNC(=O)[C@]3(C#N)C[C@H]3C)CCC2)cc1	ZINC000450562745	CF	On-Demand	Mild	ACAT	0	51
COc1ccc(C2(CNC(=O)[C@@]3(C#N)C[C@H]3C)CCC2)cc1	ZINC000450562747	CF	On-Demand	Mild	KCNA3	41	41
COc1ccc(C2(CNC(=O)[C@@]3(C#N)C[C@H]3C)CCC2)cc1	ZINC000450562747	CF	On-Demand	Mild	MTNR1A	19	40
COc1ccc(C2(CNC(=O)[C@@]3(C#N)C[C@H]3C)CCC2)cc1	ZINC000450562747	CF	On-Demand	Mild	ACAT	0	51
COc1ccc(C2(CNC(=O)[C@@]3(C#N)C[C@@H]3C)CCC2)cc1	ZINC000450562748	CF	On-Demand	Mild	KCNA3	41	41
COc1ccc(C2(CNC(=O)[C@@]3(C#N)C[C@@H]3C)CCC2)cc1	ZINC000450562748	CF	On-Demand	Mild	MTNR1A	19	40
COc1ccc(C2(CNC(=O)[C@@]3(C#N)C[C@@H]3C)CCC2)cc1	ZINC000450562748	CF	On-Demand	Mild	ACAT	0	51
COc1ccc(C2(CNC(=O)[C@]3(C#N)C[C@@H]3C)CCC2)cc1	ZINC000450562749	CF	On-Demand	Mild	KCNA3	41	41
COc1ccc(C2(CNC(=O)[C@]3(C#N)C[C@@H]3C)CCC2)cc1	ZINC000450562749	CF	On-Demand	Mild	MTNR1A	19	40
COc1ccc(C2(CNC(=O)[C@]3(C#N)C[C@@H]3C)CCC2)cc1	ZINC000450562749	CF	On-Demand	Mild	ACAT	0	51
COc1cc(-c2noc(CN3CCN(C(=O)c4ccccc4O)CC3)n2)ncn1	ZINC000450562750	GD	On-Demand	Anodyne	MT-CYB	51	35
Cc1cccc(Cl)c1CN1C(=O)NC2(CCCCC2)C1=O	ZINC000450562792	DG	On-Demand	Anodyne	PDE7A	26	40
COc1cc(CN2CCCc3ccc(S(N)(=O)=O)cc32)ccc1Cl	ZINC000450562794	FF	On-Demand	Anodyne	C3SWJ7_ECOLX	0	46
CN(C)CCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450562802	EE	On-Demand	Mild	HTR1A	50	37
CN(C)CCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450562802	EE	On-Demand	Mild	ADRA1D	41	41
CN(CCN1CCC[C@H]1CS(N)(=O)=O)Cc1ccccc1	ZINC000450562804	DC	On-Demand	Anodyne	SIGMAR1	20	41
CN(CCN1CCC[C@@H]1CS(N)(=O)=O)Cc1ccccc1	ZINC000450562805	DC	On-Demand	Anodyne	SIGMAR1	20	41
Cc1cncc(-c2nc(CN(C)C3CCN(Cc4ccccc4)CC3)no2)c1	ZINC000450562807	GH	On-Demand	Anodyne	ACHE	25	40
Cc1cncc(-c2nc(CN(C)C3CCN(Cc4ccccc4)CC3)no2)c1	ZINC000450562807	GH	On-Demand	Anodyne	SIGMAR1	32	40
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	HTR4	40	35
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	SIGMAR1	19	43
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	CHRNA7	26	40
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	PYGL	0	59
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	MAPK1	37	43
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	CCR2	15	47
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	EPHX2	38	51
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	TYK2	51	41
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	MCHR1	47	46
CCC(=O)CCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450562810	FI	On-Demand	Anodyne	CACNA1G	33	40
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2nnc(C3CC3)s2)C1=O	ZINC000450562826	FE	On-Demand	Bother	SLC27A4	49	32
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2nnc(C3CC3)s2)C1=O	ZINC000450562827	FE	On-Demand	Bother	SLC27A4	49	32
O=C(C1=C(c2ccccc2)CCC1)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1	ZINC000450562836	GI	On-Demand	Anodyne	PREP	20	40
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	DRD2	23	44
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	DRD4	49	38
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	ACHE	32	48
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	HRH1	29	40
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	DRD3	16	44
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	HRH3	26	45
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	SIGMAR1	48	45
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	SSTR5	59	36
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	CCR3	44	37
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	SCN5A	73	38
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	MCHR1	38	41
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450562837	DG	On-Demand	Anodyne	ADIPOR2	0	40
O=C(C1=C(c2ccccc2)CCC1)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1	ZINC000450562839	GI	On-Demand	Anodyne	PREP	20	40
CO[C@@H](Cc1ccccc1)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450562849	EF	On-Demand	Anodyne	VACHT_TETCF	0	45
CO[C@@H](Cc1ccccc1)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450562849	EF	On-Demand	Anodyne	ABCB1	29	40
CO[C@H](Cc1ccccc1)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450562851	EF	On-Demand	Anodyne	VACHT_TETCF	0	45
CO[C@H](Cc1ccccc1)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450562851	EF	On-Demand	Anodyne	ABCB1	29	40
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2C(=O)Nc2nccs2)cc1	ZINC000450562857	GF	On-Demand	Anodyne	MAP1	97	37
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2C(=O)Nc2nccs2)cc1	ZINC000450562857	GF	On-Demand	Anodyne	GCK	26	43
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)cc1	ZINC000450562860	GF	On-Demand	Anodyne	MAP1	97	37
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)cc1	ZINC000450562860	GF	On-Demand	Anodyne	GCK	26	43
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccccc2O)CC1	ZINC000450562871	FE	On-Demand	Anodyne	ABCB1	47	42
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccccc2O)CC1	ZINC000450562874	FE	On-Demand	Anodyne	ABCB1	47	42
COc1ccc(C2(CNC(=O)C3CC(C)(O)C3)CCC2)cc1	ZINC000450562883	DE	On-Demand	Anodyne	ACAT	0	51
CC[C@]1(C)COCCN1C(=O)c1cccc2c1CCCC2	ZINC000450562890	CG	On-Demand	Anodyne	FABP4	43	38
CC[C@@]1(C)COCCN1C(=O)c1cccc2c1CCCC2	ZINC000450562892	CG	On-Demand	Anodyne	FABP4	43	38
c1ccc2nc(N3CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)ccc2c1	ZINC000450562914	DF	On-Demand	Anodyne	HTR3A	32	49
c1ccc2nc(N3CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)ccc2c1	ZINC000450562914	DF	On-Demand	Anodyne	SORD	16	46
c1ccc2nc(N3CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)ccc2c1	ZINC000450562915	DF	On-Demand	Anodyne	HTR3A	32	49
c1ccc2nc(N3CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)ccc2c1	ZINC000450562915	DF	On-Demand	Anodyne	SORD	16	46
CCOC(=O)COc1ccc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cc1	ZINC000450562916	FG	On-Demand	Anodyne	ADORA2B	40	38
CCOC(=O)COc1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450562918	DG	On-Demand	Anodyne	LTA4H	34	49
CCOC(=O)COc1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450562918	DG	On-Demand	Anodyne	HDAC8	18	40
CCOC(=O)COc1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450562918	DG	On-Demand	Anodyne	HDAC10	15	40
CCOC(=O)COc1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450562918	DG	On-Demand	Anodyne	PLA2G4B	41	31
CCOC(=O)COc1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450562918	DG	On-Demand	Anodyne	PPO2	18	44
CCOC(=O)COc1ccc(NC(=O)CCCC(C)C)cc1	ZINC000450562918	DG	On-Demand	Anodyne	O69638_MYCTO	0	42
CN(CCC1CCN(c2ccncc2)CC1)C(=O)CS(=O)(=O)C1CC1	ZINC000450562925	FD	On-Demand	Anodyne	F10	15	42
CCc1ccc(OCc2nnc(SCC[C@H](C)O)n2Cc2ccccc2)cc1	ZINC000450562937	GI	On-Demand	Anodyne	AGTR1	28	42
CCc1ccc(OCc2nnc(SCC[C@@H](C)O)n2Cc2ccccc2)cc1	ZINC000450562939	GI	On-Demand	Anodyne	AGTR1	28	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](C)C[S@](C)=O)cc2)c1	ZINC000450562940	FE	On-Demand	Anodyne	CTSB	24	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](C)C[S@](C)=O)cc2)c1	ZINC000450562940	FE	On-Demand	Anodyne	E1	0	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](C)C[S@@](C)=O)cc2)c1	ZINC000450562952	FE	On-Demand	Anodyne	CTSB	24	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](C)C[S@@](C)=O)cc2)c1	ZINC000450562952	FE	On-Demand	Anodyne	E1	0	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](C)C[S@@](C)=O)cc2)c1	ZINC000450562954	FE	On-Demand	Anodyne	CTSB	24	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](C)C[S@@](C)=O)cc2)c1	ZINC000450562954	FE	On-Demand	Anodyne	E1	0	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](C)C[S@](C)=O)cc2)c1	ZINC000450562956	FE	On-Demand	Anodyne	CTSB	24	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](C)C[S@](C)=O)cc2)c1	ZINC000450562956	FE	On-Demand	Anodyne	E1	0	43
CCc1cccc(C(=O)NC(C)(C)C(C)(C)O)n1	ZINC000450562982	CD	On-Demand	Anodyne	PDE5A	22	41
CC(C)(O)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450562990	EG	On-Demand	Anodyne	FFAR1	0	44
COc1cc(CN2CCN(Cc3noc(C)n3)CC2)ccc1Cl	ZINC000450562993	EE	On-Demand	Anodyne	SSTR5	55	40
CN1CCN(S(=O)(=O)c2ccc(NCCC(C)(F)F)nc2)CC1	ZINC000450563016	EC	On-Demand	Anodyne	TGM2	24	43
CN1CCN(S(=O)(=O)c2ccc(NCCC(C)(F)F)nc2)CC1	ZINC000450563016	EC	On-Demand	Anodyne	GCK	60	34
CN1CCN(S(=O)(=O)c2ccc(NCCC(C)(F)F)nc2)CC1	ZINC000450563016	EC	On-Demand	Anodyne	GCKR	65	34
N#C[C@H](CCc1ccccc1)C(=O)N1CCOC[C@H]1C(N)=O	ZINC000450563032	DC	On-Demand	Mild	ACE	47	39
N#C[C@@H](CCc1ccccc1)C(=O)N1CCOC[C@H]1C(N)=O	ZINC000450563037	DC	On-Demand	Mild	ACE	47	39
N#C[C@H](CCc1ccccc1)C(=O)N1CCOC[C@@H]1C(N)=O	ZINC000450563039	DC	On-Demand	Mild	ACE	47	39
N#C[C@@H](CCc1ccccc1)C(=O)N1CCOC[C@@H]1C(N)=O	ZINC000450563040	DC	On-Demand	Mild	ACE	47	39
C[C@@H](O)CCN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	ZINC000450563057	FC	On-Demand	Anodyne	HTR1B	23	41
C[C@@H](O)CCN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	ZINC000450563057	FC	On-Demand	Anodyne	PKM	36	40
C[C@H](O)CCN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	ZINC000450563063	FC	On-Demand	Anodyne	HTR1B	23	41
C[C@H](O)CCN1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1	ZINC000450563063	FC	On-Demand	Anodyne	PKM	36	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC(F)C3)cc2)c1	ZINC000450563088	EF	On-Demand	Anodyne	MMP13	0	48
Cn1nc(C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)c2c1CCCC2	ZINC000450563089	FD	On-Demand	Anodyne	GHRL	52	35
Cn1nc(C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)c2c1CCCC2	ZINC000450563095	FD	On-Demand	Anodyne	GHRL	52	35
COC(=O)C1CCC(NC(=O)Cc2ccc(O)c(OC)c2)(C(=O)OC)CC1	ZINC000450563119	GD	On-Demand	Anodyne	TRPV1	29	46
COC(=O)C1CCC(NC(=O)Cc2ccc(O)c(OC)c2)(C(=O)OC)CC1	ZINC000450563119	GD	On-Demand	Anodyne	SHBG	19	41
COC(=O)C1CCC(NC(=O)Cc2ccc(O)c(OC)c2)(C(=O)OC)CC1	ZINC000450563119	GD	On-Demand	Anodyne	NCE103	33	42
COC(=O)C1CCC(NC(=O)Cc2ccc(O)c(OC)c2)(C(=O)OC)CC1	ZINC000450563119	GD	On-Demand	Anodyne	P96878_MYCTU	23	42
COC(=O)C1CCC(NC(=O)Cc2ccc(O)c(OC)c2)(C(=O)OC)CC1	ZINC000450563119	GD	On-Demand	Anodyne	CAN2	0	42
CCOC(=O)[C@H](C)N(C)CC/C=C/c1ccccc1	ZINC000450563120	CF	On-Demand	Anodyne	CACNA1B	49	40
CCOC(=O)[C@H](C)N(C)CC/C=C/c1ccccc1	ZINC000450563120	CF	On-Demand	Anodyne	ADORA3	0	41
CCOC(=O)[C@@H](C)N(C)CC/C=C/c1ccccc1	ZINC000450563121	CF	On-Demand	Anodyne	CACNA1B	49	40
CCOC(=O)[C@@H](C)N(C)CC/C=C/c1ccccc1	ZINC000450563121	CF	On-Demand	Anodyne	ADORA3	0	41
CCOC(=O)[C@@H](C)N(C)CC/C=C\c1ccccc1	ZINC000450563122	CF	On-Demand	Anodyne	CACNA1B	49	40
CCOC(=O)[C@@H](C)N(C)CC/C=C\c1ccccc1	ZINC000450563122	CF	On-Demand	Anodyne	ADORA3	0	41
CCOC(=O)[C@H](C)N(C)CC/C=C\c1ccccc1	ZINC000450563123	CF	On-Demand	Anodyne	CACNA1B	49	40
CCOC(=O)[C@H](C)N(C)CC/C=C\c1ccccc1	ZINC000450563123	CF	On-Demand	Anodyne	ADORA3	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563124	FD	On-Demand	Anodyne	ACE	53	47
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563124	FD	On-Demand	Anodyne	MME	42	47
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563124	FD	On-Demand	Anodyne	C3AR1	40	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563124	FD	On-Demand	Anodyne	C5AR1	40	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563124	FD	On-Demand	Anodyne	XIAP	33	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563124	FD	On-Demand	Anodyne	BIRC3	36	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563124	FD	On-Demand	Anodyne	BIRC2	49	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563132	FD	On-Demand	Anodyne	ACE	53	47
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563132	FD	On-Demand	Anodyne	MME	42	47
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563132	FD	On-Demand	Anodyne	C3AR1	40	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563132	FD	On-Demand	Anodyne	C5AR1	40	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563132	FD	On-Demand	Anodyne	XIAP	33	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563132	FD	On-Demand	Anodyne	BIRC3	36	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450563132	FD	On-Demand	Anodyne	BIRC2	49	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563135	FD	On-Demand	Anodyne	ACE	53	47
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563135	FD	On-Demand	Anodyne	MME	42	47
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563135	FD	On-Demand	Anodyne	C3AR1	40	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563135	FD	On-Demand	Anodyne	C5AR1	40	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563135	FD	On-Demand	Anodyne	XIAP	33	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563135	FD	On-Demand	Anodyne	BIRC3	36	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563135	FD	On-Demand	Anodyne	BIRC2	49	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563138	FD	On-Demand	Anodyne	ACE	53	47
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563138	FD	On-Demand	Anodyne	MME	42	47
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563138	FD	On-Demand	Anodyne	C3AR1	40	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563138	FD	On-Demand	Anodyne	C5AR1	40	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563138	FD	On-Demand	Anodyne	XIAP	33	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563138	FD	On-Demand	Anodyne	BIRC3	36	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450563138	FD	On-Demand	Anodyne	BIRC2	49	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H]1CCCc2c(F)cc(F)cc21	ZINC000450563145	GF	On-Demand	Anodyne	CA2	17	41
COC(=O)[C@H](c1ccccc1)N(C)CC1CCC(=O)CC1	ZINC000450563146	CF	On-Demand	Anodyne	AMY2	48	33
COC(=O)[C@@H](c1ccccc1)N(C)CC1CCC(=O)CC1	ZINC000450563147	CF	On-Demand	Anodyne	AMY2	48	33
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1CCCc2c(F)cc(F)cc21	ZINC000450563151	GF	On-Demand	Anodyne	CA2	17	41
CNC(=O)c1ccc(N[C@H](C)c2cccc(C3CC3)c2)c([N+](=O)[O-])c1	ZINC000450563176	EI	On-Demand	Bother	TAAR1	17	45
CNC(=O)c1ccc(N[C@@H](C)c2cccc(C3CC3)c2)c([N+](=O)[O-])c1	ZINC000450563181	EI	On-Demand	Bother	TAAR1	17	45
CCC(CC)Oc1ccc(C(=O)N[C@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000450563185	GH	On-Demand	Anodyne	CHRNA7	19	40
CCC(CC)Oc1ccc(C(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000450563186	GH	On-Demand	Anodyne	CHRNA7	19	40
CCC(=O)C1(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)CC1	ZINC000450563193	FF	On-Demand	Anodyne	EPHX2	24	40
O=[N+]([O-])c1cccnc1NCCCC1CCOCC1	ZINC000450563194	CF	On-Demand	Bother	PRKCQ	40	36
CCS(=O)(=O)N(C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450563197	EF	On-Demand	Anodyne	SLC6A1	0	41
CCS(=O)(=O)N(C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450563197	EF	On-Demand	Anodyne	SIGMAR1	24	46
CCS(=O)(=O)N(C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450563197	EF	On-Demand	Anodyne	NPY1R	0	40
Nc1ncnc(N[C@@H]2CCCc3c(F)cccc32)c1Cl	ZINC000450563198	CG	On-Demand	Anodyne	KCNN3	19	44
Brc1cncc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c1	ZINC000450563205	CG	On-Demand	Anodyne	CHRNA4	42	56
Nc1ncnc(N[C@H]2CCCc3c(F)cccc32)c1Cl	ZINC000450563206	CG	On-Demand	Anodyne	KCNN3	19	44
C[C@@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1cncc(Cl)c1	ZINC000450563226	DI	On-Demand	Anodyne	HCRTR2	0	50
CCCOc1ccc(C(=O)Nc2ncn(C3CCCCC3)n2)c(OC)c1	ZINC000450563227	FH	On-Demand	Anodyne	AGER	0	40
C[C@H]1c2ccc(F)cc2C[C@@H](C)N1C(=O)c1cncc(Cl)c1	ZINC000450563229	DI	On-Demand	Anodyne	HCRTR2	0	50
C[C@H]1Cc2cc(F)ccc2[C@H](C)N1C(=O)c1cncc(Cl)c1	ZINC000450563231	DI	On-Demand	Anodyne	HCRTR2	0	50
C[C@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1cncc(Cl)c1	ZINC000450563232	DI	On-Demand	Anodyne	HCRTR2	0	50
C[C@]1(F)CCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450563240	CG	On-Demand	Anodyne	PDE3B	51	31
COc1cc(CC(=O)NCC[C@@H]2CCO[C@H](C)C2)ccc1Cl	ZINC000450563241	EG	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NCC[C@@H]2CCO[C@H](C)C2)ccc1Cl	ZINC000450563241	EG	On-Demand	Anodyne	NCE103	25	47
COc1cc(CC(=O)NCC[C@@H]2CCO[C@H](C)C2)ccc1Cl	ZINC000450563241	EG	On-Demand	Anodyne	CAN2	0	47
C[C@@]1(F)CCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450563242	CG	On-Demand	Anodyne	PDE3B	51	31
COc1cc(CC(=O)NCC[C@H]2CCO[C@H](C)C2)ccc1Cl	ZINC000450563243	EG	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NCC[C@H]2CCO[C@H](C)C2)ccc1Cl	ZINC000450563243	EG	On-Demand	Anodyne	NCE103	25	47
COc1cc(CC(=O)NCC[C@H]2CCO[C@H](C)C2)ccc1Cl	ZINC000450563243	EG	On-Demand	Anodyne	CAN2	0	47
COc1cc(CC(=O)NCC[C@@H]2CCO[C@@H](C)C2)ccc1Cl	ZINC000450563246	EG	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NCC[C@@H]2CCO[C@@H](C)C2)ccc1Cl	ZINC000450563246	EG	On-Demand	Anodyne	NCE103	25	47
COc1cc(CC(=O)NCC[C@@H]2CCO[C@@H](C)C2)ccc1Cl	ZINC000450563246	EG	On-Demand	Anodyne	CAN2	0	47
CC[C@@](NCC1(C#N)CCC1)(C(=O)OC)c1ccccc1	ZINC000450563247	CF	On-Demand	Mild	AMY2	52	31
COc1cc(CC(=O)NCC[C@H]2CCO[C@@H](C)C2)ccc1Cl	ZINC000450563248	EG	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NCC[C@H]2CCO[C@@H](C)C2)ccc1Cl	ZINC000450563248	EG	On-Demand	Anodyne	NCE103	25	47
COc1cc(CC(=O)NCC[C@H]2CCO[C@@H](C)C2)ccc1Cl	ZINC000450563248	EG	On-Demand	Anodyne	CAN2	0	47
CC[C@](NCC1(C#N)CCC1)(C(=O)OC)c1ccccc1	ZINC000450563254	CF	On-Demand	Mild	AMY2	52	31
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C(=O)OC)c2ccccc2)cc1	ZINC000450563301	FF	On-Demand	Anodyne	CA2	41	37
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C(=O)OC)c2ccccc2)cc1	ZINC000450563301	FF	On-Demand	Anodyne	CA4	47	38
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C(=O)OC)c2ccccc2)cc1	ZINC000450563301	FF	On-Demand	Anodyne	LIMK2	42	39
CCS(=O)(=O)c1ccc(CN(C)[C@H](C(=O)OC)c2ccccc2)cc1	ZINC000450563302	FF	On-Demand	Anodyne	CA2	41	37
CCS(=O)(=O)c1ccc(CN(C)[C@H](C(=O)OC)c2ccccc2)cc1	ZINC000450563302	FF	On-Demand	Anodyne	CA4	47	38
CCS(=O)(=O)c1ccc(CN(C)[C@H](C(=O)OC)c2ccccc2)cc1	ZINC000450563302	FF	On-Demand	Anodyne	LIMK2	42	39
Cc1nc(-c2ccccn2)nc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c1C	ZINC000450563303	DG	On-Demand	Anodyne	METAP1	27	40
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)Cc1nnc(C2CC2)s1	ZINC000450563304	GG	On-Demand	Anodyne	SCD1	33	40
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)Cc1nnc(C2CC2)s1	ZINC000450563304	GG	On-Demand	Anodyne	SCD	20	40
C=CC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450563308	EH	On-Demand	Mild	HTR1D	40	45
C=CC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450563308	EH	On-Demand	Mild	HTR1B	28	41
C=CC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450563308	EH	On-Demand	Mild	NQO2	18	46
C=CC(C)(C)C(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450563308	EH	On-Demand	Mild	MPO	78	42
COc1ccccc1Oc1ccc(C(=O)NCC2(CO)CCC2)nc1	ZINC000450563317	EF	On-Demand	Anodyne	KCNA3	42	40
COc1ccccc1Oc1ccc(C(=O)NCC2(CO)CCC2)nc1	ZINC000450563317	EF	On-Demand	Anodyne	HCN1	65	40
COc1ccccc1Oc1ccc(C(=O)NCC2(CO)CCC2)nc1	ZINC000450563317	EF	On-Demand	Anodyne	HCN4	55	39
COC(=O)C1(NCCC(=O)NCc2ccc(OC)cc2OC)CCC(C)CC1	ZINC000450563319	GE	On-Demand	Anodyne	MTNR1A	58	37
COC(=O)C1(NCCC(=O)NCc2ccc(OC)cc2OC)CCC(C)CC1	ZINC000450563319	GE	On-Demand	Anodyne	MTNR1B	45	37
C[C@@H]1Cc2cccc(C(=O)NCC3(CO)CCC3)c2O1	ZINC000450563327	CD	On-Demand	Anodyne	HCN1	64	36
C[C@@H]1Cc2cccc(C(=O)NCC3(CO)CCC3)c2O1	ZINC000450563327	CD	On-Demand	Anodyne	HCN4	54	35
C[C@H]1Cc2cccc(C(=O)NCC3(CO)CCC3)c2O1	ZINC000450563328	CD	On-Demand	Anodyne	HCN1	64	36
C[C@H]1Cc2cccc(C(=O)NCC3(CO)CCC3)c2O1	ZINC000450563328	CD	On-Demand	Anodyne	HCN4	54	35
C[C@H](CCNC(=O)c1cn(CC2CC2)nn1)N1CCCCC1	ZINC000450563342	DD	On-Demand	Anodyne	CCR5	39	40
CCS(=O)(=O)c1ccc(CN(C)C(C)(C)C(=O)OC)cc1	ZINC000450563352	DD	On-Demand	Anodyne	PTPRB	60	36
CCS(=O)(=O)c1ccc(CN(C)C(C)(C)C(=O)OC)cc1	ZINC000450563352	DD	On-Demand	Anodyne	RORC	51	41
CCSc1cccnc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450563361	GH	On-Demand	Anodyne	ABL1	21	40
CCSc1cccnc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450563361	GH	On-Demand	Anodyne	HTR2A	22	41
CCSc1cccnc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450563361	GH	On-Demand	Anodyne	PTGER1	15	42
CCSc1cccnc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450563361	GH	On-Demand	Anodyne	GRM4	41	35
CCSc1cccnc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450563361	GH	On-Demand	Anodyne	EPHX2	31	41
CCSc1cccnc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450563361	GH	On-Demand	Anodyne	TYK2	19	43
C[C@@H](CCNC(=O)c1cn(CC2CC2)nn1)N1CCCCC1	ZINC000450563362	DD	On-Demand	Anodyne	CCR5	39	40
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CS(=O)(=O)c3ccccc32)n1	ZINC000450563386	EE	On-Demand	Bother	PRKCQ	42	36
COc1cc(CN2CCN(Cc3noc(C(C)(C)C)n3)CC2)ccc1Cl	ZINC000450563387	GG	On-Demand	Anodyne	SSTR5	55	38
Cc1ccc([N+](=O)[O-])c(NC[C@H]2CS(=O)(=O)c3ccccc32)n1	ZINC000450563389	EE	On-Demand	Bother	PRKCQ	42	36
CCOC(=O)c1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)on1	ZINC000450563391	GF	On-Demand	Anodyne	PTGER1	15	42
O=C(NCC1(CO)CCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450563392	CD	On-Demand	Anodyne	CACNA1G	20	43
O=C(NCC1(CO)CCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450563394	CD	On-Demand	Anodyne	CACNA1G	20	43
O=C(NCC1(CO)CCC1)c1ccccc1-n1cc(Br)cn1	ZINC000450563396	FF	On-Demand	Anodyne	HCN1	55	34
O=C(NCC1(CO)CCC1)c1ccccc1-n1cc(Br)cn1	ZINC000450563396	FF	On-Demand	Anodyne	HCN4	53	34
COC(=O)C1(CNC(=O)c2cccc(C(F)(F)F)n2)CCCCC1	ZINC000450563398	EF	On-Demand	Anodyne	HCN4	50	33
CN1CCN(S(=O)(=O)c2ccc(NCCCC(C)(F)F)nc2)CC1	ZINC000450563413	FD	On-Demand	Anodyne	TGM2	15	42
CN1CCN(S(=O)(=O)c2ccc(NCCCC(C)(F)F)nc2)CC1	ZINC000450563413	FD	On-Demand	Anodyne	GCK	59	34
CN1CCN(S(=O)(=O)c2ccc(NCCCC(C)(F)F)nc2)CC1	ZINC000450563413	FD	On-Demand	Anodyne	GCKR	74	35
C[C@H](O)CCN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450563419	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
C[C@H](O)CCN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450563420	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
C[C@@H](O)CCN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450563422	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
C[C@@H](O)CCN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450563424	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
COC(=O)[C@H](C)NC(=O)c1ccc(NCCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450563432	FF	On-Demand	Bother	TAAR1	18	45
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450563433	FF	On-Demand	Bother	TAAR1	18	45
Cc1csc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450563446	FH	On-Demand	Anodyne	ABL1	37	41
Cc1csc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450563446	FH	On-Demand	Anodyne	CNR2	0	51
Cc1csc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450563446	FH	On-Demand	Anodyne	EPHX2	27	44
Cc1csc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c1	ZINC000450563446	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
CCn1c(SCc2cn(C)nc2C)nc2ccccc21	ZINC000450563463	CG	On-Demand	Anodyne	PTGDR2	19	49
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450563477	EH	On-Demand	Mild	CCR2	30	43
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450563477	EH	On-Demand	Mild	RBP4	19	40
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450563478	EH	On-Demand	Mild	CCR2	30	43
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450563478	EH	On-Demand	Mild	RBP4	19	40
COc1cccc(-n2cc(C(=O)NCC3(CO)CCC3)nn2)c1	ZINC000450563491	DD	On-Demand	Anodyne	DRD4	44	34
CC(C)NC(=O)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000450563509	GF	On-Demand	Bother	PIN1	25	40
CC(C)NC(=O)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000450563509	GF	On-Demand	Bother	TAAR1	20	44
CC(C)NC(=O)c1ccc(NC[C@H](O)Cc2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000450563513	GF	On-Demand	Bother	PIN1	25	40
CC(C)NC(=O)c1ccc(NC[C@H](O)Cc2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000450563513	GF	On-Demand	Bother	TAAR1	20	44
COc1ccc(C2(CNC(=O)C(C)(C)C(C)(F)F)CCC2)cc1	ZINC000450563515	EH	On-Demand	Anodyne	KCNA3	42	36
COc1ccc(C2(CNC(=O)C(C)(C)C(C)(F)F)CCC2)cc1	ZINC000450563515	EH	On-Demand	Anodyne	NMBR	52	41
COc1ccc(C2(CNC(=O)C(C)(C)C(C)(F)F)CCC2)cc1	ZINC000450563515	EH	On-Demand	Anodyne	MTNR1A	15	42
COc1ccc(C2(CNC(=O)C(C)(C)C(C)(F)F)CCC2)cc1	ZINC000450563515	EH	On-Demand	Anodyne	GRPR	28	41
COc1ccc(C2(CNC(=O)C(C)(C)C(C)(F)F)CCC2)cc1	ZINC000450563515	EH	On-Demand	Anodyne	ACAT	0	52
COC(=O)C1(CNC(=O)c2cccc(C#N)c2Br)CCCCC1	ZINC000450563519	GG	On-Demand	Mild	HCN1	58	38
COC(=O)C1(CNC(=O)c2cccc(C#N)c2Br)CCCCC1	ZINC000450563519	GG	On-Demand	Mild	HCN4	54	36
CN(C)C(=O)NCCNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450563536	DE	On-Demand	Anodyne	PSBA	0	43
COc1ccc(C2(CNC(=O)c3ccc(-n4nnnc4C)cc3F)CCC2)cc1	ZINC000450563556	GF	On-Demand	Anodyne	KCNA3	44	37
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450563558	ED	On-Demand	Bother	BDKRB1	25	47
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450563558	ED	On-Demand	Bother	COLA	68	34
CN(CCc1ccccc1O)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450563562	GE	On-Demand	Anodyne	FKBP1A	39	45
CN(CCc1ccccc1O)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450563562	GE	On-Demand	Anodyne	CCR4	20	46
CN(CCc1ccccc1O)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450563562	GE	On-Demand	Anodyne	ITGA4	31	41
CN(CCc1ccccc1O)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450563562	GE	On-Demand	Anodyne	CAPNS1	20	41
CN(CCc1ccccc1O)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450563562	GE	On-Demand	Anodyne	CAPN1	15	44
Cc1cccc(Cl)c1C(=O)NCC(=O)C1CC1	ZINC000450563569	CE	On-Demand	Anodyne	P2RX7	19	44
C[C@H](CCO)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450563570	ED	On-Demand	Bother	BDKRB1	25	47
C[C@H](CCO)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450563570	ED	On-Demand	Bother	COLA	68	34
O=C(NCCCNc1ccccc1F)c1cnc(C2CC2)nc1	ZINC000450563598	DF	On-Demand	Anodyne	TBK1	41	35
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1ncc([N+](=O)[O-])cn1	ZINC000450563600	FH	On-Demand	Bother	POL	0	42
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1ncc([N+](=O)[O-])cn1	ZINC000450563602	FH	On-Demand	Bother	POL	0	42
Cc1cccc([C@H]2CCN(C(=O)c3cc(C)n(C(C)C)n3)C2)c1	ZINC000450563610	DH	On-Demand	Anodyne	HPGD	18	40
O=C(Nc1nccs1)[C@H]1CCCN1Cc1ccn(CC(F)(F)F)n1	ZINC000450563614	FF	On-Demand	Anodyne	MAP1	44	36
Cc1cccc([C@@H]2CCN(C(=O)c3cc(C)n(C(C)C)n3)C2)c1	ZINC000450563615	DH	On-Demand	Anodyne	HPGD	19	42
O=C(Nc1nccs1)[C@@H]1CCCN1Cc1ccn(CC(F)(F)F)n1	ZINC000450563619	FF	On-Demand	Anodyne	MAP1	44	36
CCN1CCN(C[C@H](O)COCCOC)c2ccccc21	ZINC000450563645	CD	On-Demand	Anodyne	HSP90AB1	42	44
CCN1CCN(C[C@@H](O)COCCOC)c2ccccc21	ZINC000450563646	CD	On-Demand	Anodyne	HSP90AB1	42	44
CSc1cccc(C(=O)NCC(=O)C2CC2)c1	ZINC000450563649	BE	On-Demand	Anodyne	DRD4	40	31
CSc1cccc(C(=O)NCC(=O)C2CC2)c1	ZINC000450563649	BE	On-Demand	Anodyne	CCR2	47	43
CC(C)c1oc([C@@H]2CCCN2CC2CCC(=O)CC2)nc1-c1ccccc1	ZINC000450563661	FK	On-Demand	Anodyne	PTGIR	17	40
CC(C)c1oc([C@H]2CCCN2CC2CCC(=O)CC2)nc1-c1ccccc1	ZINC000450563680	FK	On-Demand	Anodyne	PTGIR	17	40
CCC(CC)(CC)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450563693	CH	On-Demand	Anodyne	RORC	41	34
COC(=O)c1csc(Cn2cnc3sc4c(c3c2=O)CC[C@@H](C)C4)n1	ZINC000450563696	GF	On-Demand	Anodyne	HTR1B	19	40
COC(=O)c1csc(Cn2cnc3sc4c(c3c2=O)CC[C@H](C)C4)n1	ZINC000450563699	GF	On-Demand	Anodyne	HTR1B	19	40
CC(C)(C)[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450563735	EI	On-Demand	Bother	CACNA1B	45	39
CC(C)(C)[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450563735	EI	On-Demand	Bother	LIPG	52	37
CC(C)(C)[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450563735	EI	On-Demand	Bother	PPXII	0	41
CC(C)(C)[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450563738	EI	On-Demand	Bother	CACNA1B	45	39
CC(C)(C)[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450563738	EI	On-Demand	Bother	LIPG	52	37
CC(C)(C)[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450563738	EI	On-Demand	Bother	PPXII	0	41
Cc1ccn(CC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450563740	EG	On-Demand	Anodyne	CACNA1B	46	34
Cc1ccn(CC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450563740	EG	On-Demand	Anodyne	LIPG	41	32
Cc1ccn(CC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450563741	EG	On-Demand	Anodyne	CACNA1B	46	34
Cc1ccn(CC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450563741	EG	On-Demand	Anodyne	LIPG	41	32
CCOC(=O)C(C)(C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450563743	CF	On-Demand	Anodyne	CTSB	31	41
CCOC(=O)C(C)(C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450563743	CF	On-Demand	Anodyne	AMY2	54	33
COC(=O)c1csc(CN2CCN(c3ccc4ccccc4n3)CC2)n1	ZINC000450563744	FF	On-Demand	Anodyne	HTR3A	39	53
CCOC(=O)C(C)(C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450563745	CF	On-Demand	Anodyne	CTSB	31	41
CCOC(=O)C(C)(C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450563745	CF	On-Demand	Anodyne	AMY2	54	33
C[C@@H]1C[C@@H](CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCO1	ZINC000450563758	EE	On-Demand	Anodyne	CACNA1I	15	40
C[C@H]1C[C@H](CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCO1	ZINC000450563759	EE	On-Demand	Anodyne	CACNA1I	15	40
CCOC(=O)c1ccc(CSc2nnc(-c3ccco3)n2CC)nc1	ZINC000450563761	FG	On-Demand	Anodyne	SLC27A1	35	40
CNS(=O)(=O)NCC(=O)Nc1ccc2ccn(CCOC)c2c1	ZINC000450563771	EC	On-Demand	Anodyne	NAMPT	0	42
O=C(C1CCN(Cc2cnn[nH]2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450563795	EE	On-Demand	Anodyne	SIGMAR1	30	43
CC(F)(F)CCNc1nccc2ccc(F)cc12	ZINC000450563834	CH	On-Demand	Anodyne	HTT	0	40
O=C(NCCO)c1ccc(NCCCC2CCOCC2)nn1	ZINC000450563869	DC	On-Demand	Anodyne	SCD1	19	41
c1ccc(-c2nccc(N3CCN(Cc4cnn[nH]4)CC3)n2)cc1	ZINC000450563871	DD	On-Demand	Anodyne	DRD4	26	45
c1ccc(-c2nccc(N3CCN(Cc4cnn[nH]4)CC3)n2)cc1	ZINC000450563871	DD	On-Demand	Anodyne	SORD	43	36
Cc1cc(NC(=O)[C@H](C)OCc2ccc(F)cc2)ccc1-n1nnnc1C(C)C	ZINC000450563894	GH	On-Demand	Anodyne	CCR3	43	32
Cc1cc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)ccc1-n1nnnc1C(C)C	ZINC000450563897	GH	On-Demand	Anodyne	CCR3	43	32
Cc1cccc(Cl)c1CN1CCN(Cc2nnnn2-c2ccccc2)CC1	ZINC000450563898	GF	On-Demand	Anodyne	P2RX7	21	40
C[C@@H]1CN(C(=O)c2cn(CCc3ccccc3)nn2)CC(C)(C)C1	ZINC000450563902	EG	On-Demand	Anodyne	THYX_PBCV1	0	43
O=C1NCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@H]1Cc1ccccc1	ZINC000450563903	FE	On-Demand	Anodyne	BRS3	34	46
C[C@H]1CN(C(=O)c2cn(CCc3ccccc3)nn2)CC(C)(C)C1	ZINC000450563904	EG	On-Demand	Anodyne	THYX_PBCV1	0	43
O=C1NCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@@H]1Cc1ccccc1	ZINC000450563908	FE	On-Demand	Anodyne	BRS3	34	46
O=[N+]([O-])c1cc(Br)cnc1NCCCC1CCOCC1	ZINC000450563910	EG	On-Demand	Bother	PRKCQ	43	35
Cc1ccc(C(=O)N[C@@H](CO)c2cccc(Br)c2)c(C)n1	ZINC000450563919	EF	On-Demand	Anodyne	MAPK1	44	36
Cc1ccc(C(=O)N[C@@H](CO)c2cccc(Br)c2)c(C)n1	ZINC000450563919	EF	On-Demand	Anodyne	SORT1	19	42
Cc1ccc(C(=O)N[C@H](CO)c2cccc(Br)c2)c(C)n1	ZINC000450563920	EF	On-Demand	Anodyne	MAPK1	44	36
Cc1ccc(C(=O)N[C@H](CO)c2cccc(Br)c2)c(C)n1	ZINC000450563920	EF	On-Demand	Anodyne	SORT1	19	42
O=C1CCCCN1CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450563921	EH	On-Demand	Anodyne	DRD4	15	43
O=C1CCCCN1CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450563921	EH	On-Demand	Anodyne	HRH3	23	46
O=C1CCCCN1CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450563921	EH	On-Demand	Anodyne	SIGMAR1	34	49
O=C1CCCCN1CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450563921	EH	On-Demand	Anodyne	CACNA1D	58	42
CC1CCN(C(=O)c2ccc(=NCCCC3CCOCC3)[nH]c2)CC1	ZINC000450563955	EF	On-Demand	Anodyne	L3MBTL3	45	33
CCN(CC)S(=O)(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450563959	GG	On-Demand	Bother	BDKRB1	23	45
N#Cc1cccc(N[C@H]2CCCc3c(F)cccc32)n1	ZINC000450563965	CH	On-Demand	Mild	KCNN3	21	41
N#Cc1cccc(N[C@@H]2CCCc3c(F)cccc32)n1	ZINC000450563967	CH	On-Demand	Mild	KCNN3	21	41
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[S@@](C)=O)nc2)c1	ZINC000450563973	EE	On-Demand	Anodyne	ACACB	24	43
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[S@@](C)=O)nc2)c1	ZINC000450563973	EE	On-Demand	Anodyne	MTNR1A	25	40
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[S@@](C)=O)nc2)c1	ZINC000450563973	EE	On-Demand	Anodyne	MTNR1B	24	43
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[S@](C)=O)nc2)c1	ZINC000450563974	EE	On-Demand	Anodyne	ACACB	24	43
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[S@](C)=O)nc2)c1	ZINC000450563974	EE	On-Demand	Anodyne	MTNR1A	25	40
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)C[S@](C)=O)nc2)c1	ZINC000450563974	EE	On-Demand	Anodyne	MTNR1B	24	43
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[S@@](C)=O)nc2)c1	ZINC000450563977	EE	On-Demand	Anodyne	ACACB	24	43
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[S@@](C)=O)nc2)c1	ZINC000450563977	EE	On-Demand	Anodyne	MTNR1A	25	40
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[S@@](C)=O)nc2)c1	ZINC000450563977	EE	On-Demand	Anodyne	MTNR1B	24	43
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[S@](C)=O)nc2)c1	ZINC000450563979	EE	On-Demand	Anodyne	ACACB	24	43
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[S@](C)=O)nc2)c1	ZINC000450563979	EE	On-Demand	Anodyne	MTNR1A	25	40
COc1cccc(Oc2ccc(C(=O)N[C@H](C)C[S@](C)=O)nc2)c1	ZINC000450563979	EE	On-Demand	Anodyne	MTNR1B	24	43
CC(=O)c1cccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563982	EF	On-Demand	Bother	SIGMAR1	20	46
CC(=O)c1cccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563982	EF	On-Demand	Bother	SSTR5	40	39
CC(=O)c1cccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563982	EF	On-Demand	Bother	CCR2	19	48
CC(=O)c1cccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563982	EF	On-Demand	Bother	CXCR3	26	42
CC(=O)c1cccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563982	EF	On-Demand	Bother	MCHR1	25	40
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563983	EF	On-Demand	Bother	SIGMAR1	20	46
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563983	EF	On-Demand	Bother	SSTR5	40	39
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563983	EF	On-Demand	Bother	CCR2	19	48
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563983	EF	On-Demand	Bother	CXCR3	26	42
CC(=O)c1cccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450563983	EF	On-Demand	Bother	MCHR1	25	40
Fc1ccc([C@@H](NCc2cn(CC3CC3)nn2)c2ccccc2)cc1	ZINC000450563984	EH	On-Demand	Anodyne	SLC6A3	19	44
CN(c1ncnc2scc(-c3ccccc3)c12)[C@H]1CCN2CCO[C@H]1C2	ZINC000450564000	FG	On-Demand	Anodyne	ADRB3	26	42
CN(c1ncnc2scc(-c3ccccc3)c12)[C@@H]1CCN2CCO[C@H]1C2	ZINC000450564003	FG	On-Demand	Anodyne	ADRB3	26	42
Fc1ccc([C@H](NCc2cn(CC3CC3)nn2)c2ccccc2)cc1	ZINC000450564010	EH	On-Demand	Anodyne	SLC6A3	19	44
CNC(=O)c1ccc(NCCCC2CCOCC2)c([N+](=O)[O-])c1	ZINC000450564014	DF	On-Demand	Bother	TAAR1	17	42
COCCOC[C@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564016	FD	On-Demand	Anodyne	ADRB2	0	41
COCCOC[C@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564016	FD	On-Demand	Anodyne	P2RY12	41	33
COCCOC[C@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564016	FD	On-Demand	Anodyne	CYP2D6	23	41
COCCOC[C@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564016	FD	On-Demand	Anodyne	ABCB1	84	41
COCCOC[C@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564016	FD	On-Demand	Anodyne	SORD	92	39
COCCOC[C@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564016	FD	On-Demand	Anodyne	HSP90AB1	45	48
COCCOC[C@@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564017	FD	On-Demand	Anodyne	ADRB2	0	41
COCCOC[C@@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564017	FD	On-Demand	Anodyne	P2RY12	41	33
COCCOC[C@@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564017	FD	On-Demand	Anodyne	CYP2D6	23	41
COCCOC[C@@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564017	FD	On-Demand	Anodyne	ABCB1	84	41
COCCOC[C@@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564017	FD	On-Demand	Anodyne	SORD	92	39
COCCOC[C@@H](O)CN1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450564017	FD	On-Demand	Anodyne	HSP90AB1	45	48
CCCNC(=O)c1ccc(NCCCC2CCOCC2)nc1	ZINC000450564036	DE	On-Demand	Anodyne	AXL	32	40
CCCNC(=O)c1ccc(NCCCC2CCOCC2)nc1	ZINC000450564036	DE	On-Demand	Anodyne	TYRO3	33	40
CCCNC(=O)c1ccc(NCCCC2CCOCC2)nc1	ZINC000450564036	DE	On-Demand	Anodyne	MERTK	41	40
CC(F)(F)CCCNc1nc(C(F)F)nc2ccccc12	ZINC000450564041	DH	On-Demand	Anodyne	SLC2A1	23	41
CC(F)(F)CCCNc1nc(C(F)F)nc2ccccc12	ZINC000450564041	DH	On-Demand	Anodyne	HT1	22	41
CC(F)(F)CCCNc1nc(C(F)F)nc2ccccc12	ZINC000450564041	DH	On-Demand	Anodyne	LMGT2	20	41
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	DRD2	17	45
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	DRD4	19	43
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	HRH2	32	40
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	F10	21	41
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	CHRM3	17	43
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	SIGMAR1	21	42
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	TRY2_BOVIN	52	37
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	CCR3	74	46
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	MLNR	42	38
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	CCR2	15	41
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	ST14	75	38
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	MCHR1	19	41
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	BIRC2	25	40
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	SFRP1	108	35
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	WNT3	68	35
CC(=O)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564054	GF	On-Demand	Anodyne	TMPRSS6	46	34
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	DRD2	17	45
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	DRD4	19	43
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	HRH2	32	40
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	F10	21	41
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	CHRM3	17	43
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	SIGMAR1	21	42
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	TRY2_BOVIN	52	37
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	CCR3	74	46
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	MLNR	42	38
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	CCR2	15	41
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	ST14	75	38
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	MCHR1	19	41
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	BIRC2	25	40
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	SFRP1	108	35
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	WNT3	68	35
CC(=O)c1cccc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)c1	ZINC000450564055	GF	On-Demand	Anodyne	TMPRSS6	46	34
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@](C)(F)C2)c1	ZINC000450564061	CF	On-Demand	Bother	TAAR1	21	41
CCc1cc(NC[C@@H]2CS(=O)(=O)c3ccccc32)n2ncnc2n1	ZINC000450564071	ED	On-Demand	Anodyne	DHOD	0	50
CCc1cc(NC[C@H]2CS(=O)(=O)c3ccccc32)n2ncnc2n1	ZINC000450564072	ED	On-Demand	Anodyne	DHOD	0	50
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@@](C)(F)C2)c1	ZINC000450564073	CF	On-Demand	Bother	TAAR1	21	41
CC(=O)c1cn(CC(=O)NCCc2c[nH]c3ccc(Br)cc23)nn1	ZINC000450564100	GE	On-Demand	Anodyne	HTR1D	32	40
CC(=O)c1cn(CC(=O)NCCc2c[nH]c3ccc(Br)cc23)nn1	ZINC000450564100	GE	On-Demand	Anodyne	HTR1B	21	40
CC(=O)c1cn(CC(=O)NCCc2c[nH]c3ccc(Br)cc23)nn1	ZINC000450564100	GE	On-Demand	Anodyne	NQO2	18	43
CC(=O)c1cn(CC(=O)NCCc2c[nH]c3ccc(Br)cc23)nn1	ZINC000450564100	GE	On-Demand	Anodyne	MPO	51	37
Cc1ccc(S(=O)(=O)NCCN2CCN(CCc3cscn3)CC2)cc1	ZINC000450564104	GD	On-Demand	Anodyne	HTR7	27	50
C[C@H](CCO)CCNc1cncc(SCc2ccccc2)n1	ZINC000450564107	DH	On-Demand	Anodyne	CXCR2	0	41
C[C@@H](CCO)CCNc1cncc(SCc2ccccc2)n1	ZINC000450564108	DH	On-Demand	Anodyne	CXCR2	0	41
C[C@@H]1CC[C@H](C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)O1	ZINC000450564123	DD	On-Demand	Anodyne	GALR1	45	32
C[C@@H]1CC[C@H](C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)O1	ZINC000450564123	DD	On-Demand	Anodyne	GHRL	59	33
C[C@@H]1CC[C@H](C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)O1	ZINC000450564125	DD	On-Demand	Anodyne	GALR1	45	32
C[C@@H]1CC[C@H](C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)O1	ZINC000450564125	DD	On-Demand	Anodyne	GHRL	59	33
C[C@H](OCCc1ccccc1)C(=O)NCC1(CO)CCC1	ZINC000450564140	CD	On-Demand	Anodyne	TIMP3	50	33
C[C@@H](OCCc1ccccc1)C(=O)NCC1(CO)CCC1	ZINC000450564141	CD	On-Demand	Anodyne	TIMP3	50	33
CCn1c(SCc2ccc(S(=O)(=O)CC)cc2)nc2ccccc21	ZINC000450564142	FI	On-Demand	Anodyne	PTGDR2	21	55
CCC(CC)Oc1ccc(C(=O)NCC2(CO)CCC2)cc1	ZINC000450564163	DG	On-Demand	Anodyne	HCN1	51	32
CCC(CC)Oc1ccc(C(=O)NCC2(CO)CCC2)cc1	ZINC000450564163	DG	On-Demand	Anodyne	HCN4	49	32
CCC[C@H](O)CN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450564202	DH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@@H](O)CN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450564205	DH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@H](O)CN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450564207	DH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@@H](O)CN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450564210	DH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
Cc1ccn2ncc(C(=O)NCC3(CO)CCC3)c2c1	ZINC000450564212	CD	On-Demand	Anodyne	HCN1	50	31
Cc1ccn2ncc(C(=O)NCC3(CO)CCC3)c2c1	ZINC000450564212	CD	On-Demand	Anodyne	HCN4	48	31
C[C@H](CCNC(=O)[C@H]1CCN(c2ccccc2)C1)N1CCCCC1	ZINC000450564235	EF	On-Demand	Anodyne	GPBAR1	28	42
C[C@H](CCNC(=O)[C@@H]1CCN(c2ccccc2)C1)N1CCCCC1	ZINC000450564236	EF	On-Demand	Anodyne	GPBAR1	28	42
C[C@@H](CCNC(=O)[C@H]1CCN(c2ccccc2)C1)N1CCCCC1	ZINC000450564237	EF	On-Demand	Anodyne	GPBAR1	28	42
C[C@@H](CCNC(=O)[C@@H]1CCN(c2ccccc2)C1)N1CCCCC1	ZINC000450564238	EF	On-Demand	Anodyne	GPBAR1	28	42
O=C(NCC1(CO)CCC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450564248	EF	On-Demand	Bother	AKR1C4	0	40
O=C(NCC1(CO)CCC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450564248	EF	On-Demand	Bother	PPXII	0	41
COC(=O)C(C)(C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564250	CE	On-Demand	Anodyne	MME	44	33
COC(=O)C(C)(C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564250	CE	On-Demand	Anodyne	CTSB	40	43
COC(=O)C(C)(C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564250	CE	On-Demand	Anodyne	AMY2	53	32
COC(=O)C(C)(C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564251	CE	On-Demand	Anodyne	MME	44	33
COC(=O)C(C)(C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564251	CE	On-Demand	Anodyne	CTSB	40	43
COC(=O)C(C)(C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564251	CE	On-Demand	Anodyne	AMY2	53	32
CCc1ccc(NC(=O)C[C@H](O)CC)cc1C	ZINC000450564273	BF	On-Demand	Anodyne	SLC1A1	64	41
CCc1ccc(NC(=O)C[C@H](O)CC)cc1C	ZINC000450564273	BF	On-Demand	Anodyne	SLC1A3	70	41
CCc1ccc(NC(=O)C[C@H](O)CC)cc1C	ZINC000450564273	BF	On-Demand	Anodyne	SLC1A2	77	44
C[C@H]1C[C@@H](CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCO1	ZINC000450564274	EE	On-Demand	Anodyne	CACNA1I	15	40
C[C@@H]1C[C@H](CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCO1	ZINC000450564275	EE	On-Demand	Anodyne	CACNA1I	15	40
CCc1ccc(NC(=O)C[C@@H](O)CC)cc1C	ZINC000450564283	BF	On-Demand	Anodyne	SLC1A1	64	41
CCc1ccc(NC(=O)C[C@@H](O)CC)cc1C	ZINC000450564283	BF	On-Demand	Anodyne	SLC1A3	70	41
CCc1ccc(NC(=O)C[C@@H](O)CC)cc1C	ZINC000450564283	BF	On-Demand	Anodyne	SLC1A2	77	44
O=C(Cc1sccc1Br)N1CCC(Cc2cccnc2)CC1	ZINC000450564292	GH	On-Demand	Anodyne	GRIN2B	37	41
O=C(Cc1sccc1Br)N1CCC(Cc2cccnc2)CC1	ZINC000450564292	GH	On-Demand	Anodyne	CHRNA7	49	42
O=C(Cc1sccc1Br)N1CCC(Cc2cccnc2)CC1	ZINC000450564292	GH	On-Demand	Anodyne	C3AR1	50	43
O=C(Cc1sccc1Br)N1CCC(Cc2cccnc2)CC1	ZINC000450564292	GH	On-Demand	Anodyne	ACHP_LYMST	25	42
O=C(Cc1sccc1Br)N1CCC(Cc2cccnc2)CC1	ZINC000450564292	GH	On-Demand	Anodyne	ETHR	42	38
Cc1cc(C)cc(C2=CCN(C(=O)C3(C)CCC(=O)CC3)CC2)c1	ZINC000450564294	EI	On-Demand	Anodyne	ADAM10	22	44
Cn1c(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c2n(c1=O)CCCC2	ZINC000450564300	GG	On-Demand	Anodyne	CACNA1B	41	35
Cn1c(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c2n(c1=O)CCCC2	ZINC000450564304	GG	On-Demand	Anodyne	CACNA1B	41	35
CCS(=O)(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1	ZINC000450564305	FF	On-Demand	Anodyne	ADORA2B	45	37
CCS(=O)(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1	ZINC000450564305	FF	On-Demand	Anodyne	SIGMAR1	34	41
CCS(=O)(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1	ZINC000450564305	FF	On-Demand	Anodyne	RORC	50	34
O=C1CC[C@H](CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564317	FG	On-Demand	Anodyne	CACNA1B	45	34
O=C1CC[C@H](CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564317	FG	On-Demand	Anodyne	CCR2	31	41
O=C1CC[C@H](CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564317	FG	On-Demand	Anodyne	ETHR	43	36
O=C1CC[C@@H](CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564318	FG	On-Demand	Anodyne	CACNA1B	45	34
O=C1CC[C@@H](CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564318	FG	On-Demand	Anodyne	CCR2	31	41
O=C1CC[C@@H](CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564318	FG	On-Demand	Anodyne	ETHR	43	36
O=C1CC[C@H](CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564319	FG	On-Demand	Anodyne	CACNA1B	45	34
O=C1CC[C@H](CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564319	FG	On-Demand	Anodyne	CCR2	31	41
O=C1CC[C@H](CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564319	FG	On-Demand	Anodyne	ETHR	43	36
O=C1CC[C@@H](CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564320	FG	On-Demand	Anodyne	CACNA1B	45	34
O=C1CC[C@@H](CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564320	FG	On-Demand	Anodyne	CCR2	31	41
O=C1CC[C@@H](CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)N1	ZINC000450564320	FG	On-Demand	Anodyne	ETHR	43	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C[C@@H]1C	ZINC000450564342	GG	On-Demand	Anodyne	SLC6A3	15	42
C[C@H]1CN(C[C@@H](O)[C@H](C)c2ccccc2)CCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450564343	GG	On-Demand	Anodyne	SLC6A3	15	42
CCOC(=O)C(C)(C)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450564358	CE	On-Demand	Anodyne	AMY2	57	36
CCOC(=O)C(C)(C)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450564360	CE	On-Demand	Anodyne	AMY2	57	36
CCOC(=O)C(C)(C)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450564361	CE	On-Demand	Anodyne	AMY2	57	36
CCOC(=O)C(C)(C)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450564363	CE	On-Demand	Anodyne	AMY2	57	36
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450564372	GG	On-Demand	Bother	MGLL	0	48
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450564372	GG	On-Demand	Bother	CCR8	32	43
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450564372	GG	On-Demand	Bother	ABHD6	0	48
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450564372	GG	On-Demand	Bother	L3MBTL3	40	35
C[C@@H]1CCCN(c2cc(NC[C@@H](O)Cc3cccc(F)c3)ncn2)C1	ZINC000450564373	EF	On-Demand	Anodyne	PRCP	0	45
C[C@@H]1CCCN(c2cc(NC[C@H](O)Cc3cccc(F)c3)ncn2)C1	ZINC000450564375	EF	On-Demand	Anodyne	PRCP	0	45
C[C@H]1CCCN(c2cc(NC[C@H](O)Cc3cccc(F)c3)ncn2)C1	ZINC000450564377	EF	On-Demand	Anodyne	PRCP	0	45
C[C@H]1CCCN(c2cc(NC[C@@H](O)Cc3cccc(F)c3)ncn2)C1	ZINC000450564380	EF	On-Demand	Anodyne	PRCP	0	45
O=C(c1cc2n(n1)CCCC2)N1CCCCc2cc(Br)ccc21	ZINC000450564382	FH	On-Demand	Anodyne	AVPR2	22	41
CC(C)N(C[C@H](O)[C@H](C)c1ccccc1)C1CCC1	ZINC000450564384	CG	On-Demand	Anodyne	AOC3	17	40
CC(C)N(C[C@@H](O)[C@H](C)c1ccccc1)C1CCC1	ZINC000450564385	CG	On-Demand	Anodyne	AOC3	17	40
CC(C)N(C[C@@H](O)[C@@H](C)c1ccccc1)C1CCC1	ZINC000450564386	CG	On-Demand	Anodyne	AOC3	17	40
CC(C)N(C[C@H](O)[C@@H](C)c1ccccc1)C1CCC1	ZINC000450564387	CG	On-Demand	Anodyne	AOC3	17	40
COC(=O)C1(CNC(=O)c2cc3cccnc3s2)CCCCC1	ZINC000450564394	EG	On-Demand	Anodyne	HCN1	50	32
COC(=O)C1(CNC(=O)c2cc3cccnc3s2)CCCCC1	ZINC000450564394	EG	On-Demand	Anodyne	HCN4	48	32
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450564399	EJ	On-Demand	Anodyne	CACNA1B	57	41
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450564399	EJ	On-Demand	Anodyne	SLC9A1	44	39
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450564399	EJ	On-Demand	Anodyne	CCR2	63	46
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450564399	EJ	On-Demand	Anodyne	RBP4	34	45
COC(=O)c1csc(CN(CCO)[C@H]2CCCc3ccccc32)n1	ZINC000450564401	EF	On-Demand	Anodyne	CXCR4	40	36
CCOC(=O)COc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1	ZINC000450564402	EF	On-Demand	Anodyne	P4HTM	0	41
COC(=O)c1csc(CN(CCO)[C@@H]2CCCc3ccccc32)n1	ZINC000450564403	EF	On-Demand	Anodyne	CXCR4	40	36
CCOC(=O)[C@H]1CN(c2ncnc3sc4c(c23)CCC4)CC12COC2	ZINC000450564404	FE	On-Demand	Anodyne	RBP4	17	44
CCOC(=O)[C@@H]1CN(c2ncnc3sc4c(c23)CCC4)CC12COC2	ZINC000450564405	FE	On-Demand	Anodyne	RBP4	17	44
CCOc1cc(C(=O)N2CCC[C@@H]2c2ccc(Br)s2)on1	ZINC000450564424	FH	On-Demand	Anodyne	COLA	59	37
CCOc1cc(C(=O)N2CCC[C@@H]2c2ccc(Br)s2)on1	ZINC000450564424	FH	On-Demand	Anodyne	CPT1A	47	33
CCOc1cc(C(=O)N2CCC[C@H]2c2ccc(Br)s2)on1	ZINC000450564425	FH	On-Demand	Anodyne	COLA	59	37
CCOc1cc(C(=O)N2CCC[C@H]2c2ccc(Br)s2)on1	ZINC000450564425	FH	On-Demand	Anodyne	CPT1A	47	33
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450564426	EJ	On-Demand	Anodyne	CACNA1B	57	41
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450564426	EJ	On-Demand	Anodyne	SLC9A1	44	39
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450564426	EJ	On-Demand	Anodyne	CCR2	63	46
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450564426	EJ	On-Demand	Anodyne	RBP4	34	45
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CSc3ccccc32)n1	ZINC000450564429	EG	On-Demand	Bother	PRKCQ	41	34
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CSc3ccccc32)n1	ZINC000450564430	EG	On-Demand	Bother	PRKCQ	41	34
COc1ccc(-c2noc(Cn3cnc4sc5c(c4c3=O)CCC5)n2)nn1	ZINC000450564439	GD	On-Demand	Anodyne	HTR1B	17	40
CCc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450564440	FF	On-Demand	Anodyne	DRD2	31	44
CCc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450564440	FF	On-Demand	Anodyne	DRD1	23	49
CCc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450564440	FF	On-Demand	Anodyne	DRD4	22	44
CCc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450564440	FF	On-Demand	Anodyne	HTR2A	25	44
CCc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450564440	FF	On-Demand	Anodyne	PLA2G2A	35	40
CCc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450564440	FF	On-Demand	Anodyne	SLC18A3	0	48
CCc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450564440	FF	On-Demand	Anodyne	CYP2J2	54	40
CCN(CCN(C)Cc1ccccc1)CC(=O)Nc1c(C)cccc1C	ZINC000450564456	FH	On-Demand	Anodyne	LTA4H	20	43
COC(=O)c1csc(CN2CCc3ccc(O)cc3C2)n1	ZINC000450564459	DE	On-Demand	Anodyne	ABCG2	0	41
O=C(CN(Cc1cccnc1)CC1CC(F)(F)C1)Nc1ccc(Cl)cc1	ZINC000450564463	GI	On-Demand	Anodyne	NAMPT	50	45
O=C(CN(Cc1cccnc1)CC1CC(F)(F)C1)Nc1ccc(Cl)cc1	ZINC000450564463	GI	On-Demand	Anodyne	NR1D1	49	39
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cc(C#N)[nH]c3C)C2)c1	ZINC000450564466	DG	On-Demand	Mild	FASN	42	36
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cc(C#N)[nH]c3C)C2)c1	ZINC000450564468	DG	On-Demand	Mild	FASN	42	36
COc1cc(-c2noc(CN(C)C3CCN(Cc4ccccc4)CC3)n2)ncn1	ZINC000450564474	GF	On-Demand	Anodyne	ACHE	28	41
COc1cc(-c2noc(CN(C)C3CCN(Cc4ccccc4)CC3)n2)ncn1	ZINC000450564474	GF	On-Demand	Anodyne	SIGMAR1	36	40
COc1cc(-c2noc(CN(C)C3CCN(Cc4ccccc4)CC3)n2)ncn1	ZINC000450564474	GF	On-Demand	Anodyne	SSTR5	42	33
CC(C)(O)C(C)(C)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450564475	EH	On-Demand	Anodyne	PRCP	47	38
CC(C)(O)C(C)(C)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450564483	EH	On-Demand	Anodyne	PRCP	47	38
CC(C)(O)C(C)(C)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450564486	EH	On-Demand	Anodyne	PRCP	47	38
CC[C@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)c1nccs1	ZINC000450564487	GG	On-Demand	Anodyne	MTNR1A	40	40
CC[C@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)c1nccs1	ZINC000450564487	GG	On-Demand	Anodyne	MTNR1B	28	40
CC(C)(O)C(C)(C)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450564488	EH	On-Demand	Anodyne	PRCP	47	38
CC[C@@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)c1nccs1	ZINC000450564490	GG	On-Demand	Anodyne	MTNR1A	40	40
CC[C@@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)c1nccs1	ZINC000450564490	GG	On-Demand	Anodyne	MTNR1B	28	40
CCOC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)nc1	ZINC000450564491	GG	On-Demand	Anodyne	HTR1A	20	45
CCOC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)nc1	ZINC000450564491	GG	On-Demand	Anodyne	HTR3A	44	51
CCOC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)nc1	ZINC000450564491	GG	On-Demand	Anodyne	P2RY12	40	43
CCOC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)nc1	ZINC000450564491	GG	On-Demand	Anodyne	SORD	25	43
Oc1ccc2c(c1)CN(CC1=CCCCC1)CC2	ZINC000450564500	BG	On-Demand	Anodyne	SLC6A5	18	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1ncn(C(C)(C)C)n1	ZINC000450564506	FG	On-Demand	Anodyne	MAP3K5	51	35
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	HTR1A	22	55
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	DRD2	34	47
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	DRD1	29	56
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	DRD4	25	46
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	HTR2A	46	52
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	HTR2C	34	55
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	DRD3	22	56
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	ERG2	24	50
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	HTR7	36	47
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	CYP2J2	53	38
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	NET	0	52
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	AP2S1	0	47
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450564507	FF	On-Demand	Anodyne	SLC6A7	0	41
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1cnnc(O)c1Cl	ZINC000450564508	GH	On-Demand	Anodyne	POL	0	40
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1cnnc(O)c1Cl	ZINC000450564509	GH	On-Demand	Anodyne	POL	0	40
CC(C)(C)[C@H]1CCN(C(=O)CCc2ccc(C(N)=O)cc2)C1	ZINC000450564510	DF	On-Demand	Anodyne	CYP2J2	50	38
CC(C)(C)[C@@H]1CCN(C(=O)CCc2ccc(C(N)=O)cc2)C1	ZINC000450564511	DF	On-Demand	Anodyne	CYP2J2	50	38
COc1ccc(-c2nnc(SCC(=O)CC(C)(C)C3CC3)o2)cc1	ZINC000450564514	EI	On-Demand	Anodyne	GSK3B	15	47
COc1ccc(-c2nnc(SCC(=O)CC(C)(C)C3CC3)o2)cc1	ZINC000450564514	EI	On-Demand	Anodyne	GSK3A	22	43
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564528	EI	On-Demand	Anodyne	CACNA1B	54	36
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564528	EI	On-Demand	Anodyne	SLC9A1	42	39
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564528	EI	On-Demand	Anodyne	CCR2	78	41
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564528	EI	On-Demand	Anodyne	RBP4	21	44
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564528	EI	On-Demand	Anodyne	RHOA	0	41
CCc1cccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564528	EI	On-Demand	Anodyne	MAP3K12	38	40
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564531	EI	On-Demand	Anodyne	CACNA1B	54	36
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564531	EI	On-Demand	Anodyne	SLC9A1	42	39
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564531	EI	On-Demand	Anodyne	CCR2	78	41
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564531	EI	On-Demand	Anodyne	RBP4	21	44
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564531	EI	On-Demand	Anodyne	RHOA	0	41
CCc1cccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450564531	EI	On-Demand	Anodyne	MAP3K12	38	40
COC(=O)C1(CN2CCN(c3ncccc3Cl)CC2)CC1	ZINC000450564536	DD	On-Demand	Anodyne	TRPV1	15	46
COC(=O)c1sc2nc(C)nc(NC[C@@H](O)Cc3cccc(F)c3)c2c1C	ZINC000450564537	GG	On-Demand	Anodyne	CHRM4	17	41
COC(=O)c1sc2nc(C)nc(NC[C@H](O)Cc3cccc(F)c3)c2c1C	ZINC000450564545	GG	On-Demand	Anodyne	CHRM4	17	41
Oc1ccc2c(c1)CN(Cc1ccccc1OC1CC1)CC2	ZINC000450564546	CG	On-Demand	Anodyne	SLC6A5	28	47
COC(=O)c1ccc2c(c1)CN(C(=O)c1nc3ccccc3nc1C1CC1)CC2	ZINC000450564564	GG	On-Demand	Anodyne	HDAC6	36	41
NS(=O)(=O)C[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450564566	DD	On-Demand	Anodyne	HRH3	28	43
NS(=O)(=O)C[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450564566	DD	On-Demand	Anodyne	SPHK2	36	43
NS(=O)(=O)C[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450564566	DD	On-Demand	Anodyne	SPHK1	48	38
NS(=O)(=O)C[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450564568	DD	On-Demand	Anodyne	HRH3	28	43
NS(=O)(=O)C[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450564568	DD	On-Demand	Anodyne	SPHK2	36	43
NS(=O)(=O)C[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450564568	DD	On-Demand	Anodyne	SPHK1	48	38
C1=C(CN2CCC(Oc3ccccn3)CC2)CCCC1	ZINC000450564582	CG	On-Demand	Anodyne	SCN5A	64	37
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	CHRM2	25	42
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	DRD2	16	43
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	DRD4	39	41
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	ACHE	39	44
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	OPRM1	15	45
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	DRD3	25	42
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	P2RY12	34	41
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	CHRM3	23	41
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	LTA4H	23	43
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	SIGMAR1	52	44
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	SSTR5	50	42
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	CCR3	20	41
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	F2RL3	19	41
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	MCHR1	41	41
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	NOD2	25	41
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	ADIPOR1	0	42
CCOC(=O)c1ccc(CN(C)C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450564586	FG	On-Demand	Anodyne	ADIPOR2	0	42
CC(=O)CCCCCn1cnc2sc3c(c2c1=O)CC[C@@H](C)C3	ZINC000450564596	EH	On-Demand	Anodyne	HTR1B	21	42
CC(=O)CCCCCn1cnc2sc3c(c2c1=O)CC[C@H](C)C3	ZINC000450564597	EH	On-Demand	Anodyne	HTR1B	21	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCCC1CCOCC1	ZINC000450564611	FD	On-Demand	Anodyne	CA2	41	48
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCCC1CCOCC1	ZINC000450564611	FD	On-Demand	Anodyne	CA1	40	35
C[C@@H]1C[C@@H](CCNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000450564616	FI	On-Demand	Anodyne	RBP4	74	36
C[C@H]1C[C@@H](CCNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000450564617	FI	On-Demand	Anodyne	RBP4	74	36
C[C@H]1C[C@H](CCNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000450564618	FI	On-Demand	Anodyne	RBP4	74	36
C[C@@H]1C[C@H](CCNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000450564619	FI	On-Demand	Anodyne	RBP4	74	36
CC[C@@H]1CCC[C@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450564628	DE	On-Demand	Anodyne	GALR1	47	34
CC[C@@H]1CCC[C@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450564628	DE	On-Demand	Anodyne	GHRL	53	34
CC[C@@H]1CCC[C@@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450564629	DE	On-Demand	Anodyne	GALR1	47	34
CC[C@@H]1CCC[C@@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450564629	DE	On-Demand	Anodyne	GHRL	53	34
CC[C@@H]1CCC[C@@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450564630	DE	On-Demand	Anodyne	GALR1	47	34
CC[C@@H]1CCC[C@@H]1C(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450564630	DE	On-Demand	Anodyne	GHRL	53	34
CC[C@@H]1CCC[C@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450564631	DE	On-Demand	Anodyne	GALR1	47	34
CC[C@@H]1CCC[C@H]1C(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450564631	DE	On-Demand	Anodyne	GHRL	53	34
C[C@@H]1C[C@H](CCNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCO1	ZINC000450564637	GI	On-Demand	Anodyne	PYGL	40	36
C[C@@H]1C[C@@H](CCNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCO1	ZINC000450564638	GI	On-Demand	Anodyne	PYGL	40	36
C[C@H]1C[C@@H](CCNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCO1	ZINC000450564639	GI	On-Demand	Anodyne	PYGL	40	36
C[C@H]1C[C@H](CCNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCO1	ZINC000450564640	GI	On-Demand	Anodyne	PYGL	40	36
COc1ccc(C(=O)NCCN2CCN(CC34CCC(CC3)C4)CC2)cc1	ZINC000450564649	FF	On-Demand	Anodyne	HTR1A	27	46
COc1ccc(C(=O)NCCN2CCN(CC34CCC(CC3)C4)CC2)cc1	ZINC000450564649	FF	On-Demand	Anodyne	DRD2	30	46
COc1ccc(C(=O)NCCN2CCN(CC34CCC(CC3)C4)CC2)cc1	ZINC000450564649	FF	On-Demand	Anodyne	DRD1	0	41
COc1ccc(C(=O)NCCN2CCN(CC34CCC(CC3)C4)CC2)cc1	ZINC000450564649	FF	On-Demand	Anodyne	DRD4	59	45
COc1ccc(C(=O)NCCN2CCN(CC34CCC(CC3)C4)CC2)cc1	ZINC000450564649	FF	On-Demand	Anodyne	DRD3	38	41
COc1ccc(C(=O)NCCN2CCN(CC34CCC(CC3)C4)CC2)cc1	ZINC000450564649	FF	On-Demand	Anodyne	PLD1	47	38
COc1ccc(C(=O)NCCN2CCN(CC34CCC(CC3)C4)CC2)cc1	ZINC000450564649	FF	On-Demand	Anodyne	PLD2	79	39
COc1ccc(C(=O)NCCN2CCN(CC34CCC(CC3)C4)CC2)cc1	ZINC000450564649	FF	On-Demand	Anodyne	AP2S1	0	40
CCN(c1ccccc1)S(=O)(=O)c1ccc(=NCCC(C)(F)F)[nH]c1	ZINC000450564678	FG	On-Demand	Anodyne	NR1I2	19	43
CCOC(=O)[C@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564688	CE	On-Demand	Anodyne	CTSB	27	41
CCOC(=O)[C@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564688	CE	On-Demand	Anodyne	CAPNS1	48	38
CCOC(=O)[C@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564688	CE	On-Demand	Anodyne	NPR	51	36
CCOC(=O)[C@@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564689	CE	On-Demand	Anodyne	CTSB	27	41
CCOC(=O)[C@@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564689	CE	On-Demand	Anodyne	CAPNS1	48	38
CCOC(=O)[C@@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564689	CE	On-Demand	Anodyne	NPR	51	36
CCOC(=O)[C@@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564690	CE	On-Demand	Anodyne	CTSB	27	41
CCOC(=O)[C@@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564690	CE	On-Demand	Anodyne	CAPNS1	48	38
CCOC(=O)[C@@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450564690	CE	On-Demand	Anodyne	NPR	51	36
CCOC(=O)[C@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564691	CE	On-Demand	Anodyne	CTSB	27	41
CCOC(=O)[C@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564691	CE	On-Demand	Anodyne	CAPNS1	48	38
CCOC(=O)[C@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450564691	CE	On-Demand	Anodyne	NPR	51	36
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1Cl	ZINC000450564735	FE	On-Demand	Anodyne	TSHR	41	31
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1Cl	ZINC000450564735	FE	On-Demand	Anodyne	OPRK1	24	43
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1Cl	ZINC000450564735	FE	On-Demand	Anodyne	HCRTR1	15	41
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1Cl	ZINC000450564735	FE	On-Demand	Anodyne	BRS3	29	42
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1Cl	ZINC000450564735	FE	On-Demand	Anodyne	ITGA4	15	40
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)ccc1Cl	ZINC000450564735	FE	On-Demand	Anodyne	MBTPS1	49	33
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1Cl	ZINC000450564736	FE	On-Demand	Anodyne	TSHR	41	31
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1Cl	ZINC000450564736	FE	On-Demand	Anodyne	OPRK1	24	43
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1Cl	ZINC000450564736	FE	On-Demand	Anodyne	HCRTR1	15	41
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1Cl	ZINC000450564736	FE	On-Demand	Anodyne	BRS3	29	42
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1Cl	ZINC000450564736	FE	On-Demand	Anodyne	ITGA4	15	40
COc1cc(CC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)ccc1Cl	ZINC000450564736	FE	On-Demand	Anodyne	MBTPS1	49	33
COCc1cc(NCCC(C)(F)F)n2ncnc2n1	ZINC000450564738	CD	On-Demand	Anodyne	DHOD	0	47
Cn1ncc2c(NCCCC3CCOCC3)ccnc21	ZINC000450564751	CF	On-Demand	Anodyne	HNMT	41	32
Cc1cc(C(F)(F)F)ccc1C(=O)NCCC(=O)NCc1ccccn1	ZINC000450564766	FF	On-Demand	Anodyne	MTTP	34	42
CC(=O)CCCCCn1cnc2c(cnn2-c2ccccc2)c1=O	ZINC000450564786	DF	On-Demand	Anodyne	HTR7	15	44
CC(F)(F)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450564793	GH	On-Demand	Bother	MTNN	49	35
CC(F)(F)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450564793	GH	On-Demand	Bother	BCL2L1	38	42
CC(F)(F)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450564793	GH	On-Demand	Bother	BCL2	33	42
CC(F)(F)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450564793	GH	On-Demand	Bother	MCL1	0	44
CC(F)(F)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450564793	GH	On-Demand	Bother	LIMK2	43	34
CCOC(=O)c1ccc(CN2CCc3[nH]c4ccccc4c3C2)nc1	ZINC000450564794	EG	On-Demand	Anodyne	NR1H4	0	42
CCOC(=O)c1ccc(CN2CCc3[nH]c4ccccc4c3C2)nc1	ZINC000450564794	EG	On-Demand	Anodyne	NOD2	25	41
CN(C)c1nccc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)n1	ZINC000450564815	CD	On-Demand	Anodyne	SORD	43	38
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450564821	GH	On-Demand	Anodyne	CASR	46	40
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450564821	GH	On-Demand	Anodyne	SIGMAR1	15	46
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450564821	GH	On-Demand	Anodyne	NPY2R	43	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450564821	GH	On-Demand	Anodyne	F2R	41	31
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450564821	GH	On-Demand	Anodyne	MAPK1	33	47
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450564821	GH	On-Demand	Anodyne	MTOR	40	37
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450564821	GH	On-Demand	Anodyne	EPHX2	51	42
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450564821	GH	On-Demand	Anodyne	MCHR1	18	40
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450564822	GH	On-Demand	Anodyne	CASR	46	40
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450564822	GH	On-Demand	Anodyne	SIGMAR1	15	46
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450564822	GH	On-Demand	Anodyne	NPY2R	43	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450564822	GH	On-Demand	Anodyne	F2R	41	31
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450564822	GH	On-Demand	Anodyne	MAPK1	33	47
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450564822	GH	On-Demand	Anodyne	MTOR	40	37
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450564822	GH	On-Demand	Anodyne	EPHX2	51	42
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450564822	GH	On-Demand	Anodyne	MCHR1	18	40
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	DRD2	20	42
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	TRPV1	28	47
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	P2RX7	0	42
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	MTNR1B	15	40
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	PTGDR	32	43
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	PTGDR2	23	43
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	NCE103	26	47
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	P96878_MYCTU	19	47
COc1cc(CC(=O)NCCCNc2ccccc2F)ccc1Cl	ZINC000450564829	FH	On-Demand	Anodyne	CAN2	0	47
O=C(c1cc2n(n1)CCC2)N1CCCCc2cc(Br)ccc21	ZINC000450564830	FH	On-Demand	Anodyne	AVPR2	26	41
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	HTR1A	15	51
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	DRD4	47	36
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	ACHE	21	40
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	HRH2	64	55
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	HTR1D	31	47
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	HTR1B	30	47
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	AVPR1B	32	40
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	KCNH2	15	42
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	PDGFRB	15	43
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	HTR7	17	44
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	HRH3	39	59
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	SIGMAR1	22	50
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	NPY2R	0	40
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	CCR3	24	45
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	CHRNA7	20	46
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	MTNR1A	36	44
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	MTNR1B	31	40
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	ROCK2	29	42
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	ABCB1	37	41
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	MET	20	44
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	EPHX2	21	44
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	FLT3	15	43
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	MCHR1	28	40
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	CACNA1G	15	42
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	PSMB2	43	32
COc1cccc(OCCC(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450564850	FH	On-Demand	Anodyne	BIRC2	17	43
COCCOC[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000450564870	EE	On-Demand	Anodyne	CTSD	20	43
COCCOC[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000450564870	EE	On-Demand	Anodyne	BACE1	21	43
COCCOC[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000450564871	EE	On-Demand	Anodyne	CTSD	20	43
COCCOC[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000450564871	EE	On-Demand	Anodyne	BACE1	21	43
O=C(Cc1scnc1-c1ccccc1)NCC1(Cc2ccc(F)cc2)CC1	ZINC000450564879	GJ	On-Demand	Anodyne	NPFFR1	19	40
COc1ccc(C2(CNC(=O)c3ccc(C(C)(F)F)nc3)CCC2)cc1	ZINC000450564889	FI	On-Demand	Anodyne	KCNA3	43	36
COc1ccc(C2(CNC(=O)c3ccc(C(C)(F)F)nc3)CCC2)cc1	ZINC000450564889	FI	On-Demand	Anodyne	ACAT	0	44
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450564890	FG	On-Demand	Anodyne	P2RX7	18	40
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450564890	FG	On-Demand	Anodyne	EPHX2	37	42
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450564890	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450564891	DH	On-Demand	Anodyne	ABHD11	0	40
COC(=O)[C@H](NCC/C=C\c1ccccc1)c1ccc(OC)cc1	ZINC000450564892	EH	On-Demand	Anodyne	MMP2	18	47
COC(=O)[C@H](NCC/C=C\c1ccccc1)c1ccc(OC)cc1	ZINC000450564892	EH	On-Demand	Anodyne	MMP9	20	47
COC(=O)[C@H](NCC/C=C\c1ccccc1)c1ccc(OC)cc1	ZINC000450564892	EH	On-Demand	Anodyne	GRIK1	15	43
COC(=O)[C@H](NCC/C=C\c1ccccc1)c1ccc(OC)cc1	ZINC000450564892	EH	On-Demand	Anodyne	MMP1	16	43
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450564893	DH	On-Demand	Anodyne	ABHD11	0	40
COC(=O)[C@@H](NCC/C=C/c1ccccc1)c1ccc(OC)cc1	ZINC000450564894	EH	On-Demand	Anodyne	MMP2	18	47
COC(=O)[C@@H](NCC/C=C/c1ccccc1)c1ccc(OC)cc1	ZINC000450564894	EH	On-Demand	Anodyne	MMP9	20	47
COC(=O)[C@@H](NCC/C=C/c1ccccc1)c1ccc(OC)cc1	ZINC000450564894	EH	On-Demand	Anodyne	GRIK1	15	43
COC(=O)[C@@H](NCC/C=C/c1ccccc1)c1ccc(OC)cc1	ZINC000450564894	EH	On-Demand	Anodyne	MMP1	16	43
COC(=O)[C@@H](NCC/C=C\c1ccccc1)c1ccc(OC)cc1	ZINC000450564895	EH	On-Demand	Anodyne	MMP2	18	47
COC(=O)[C@@H](NCC/C=C\c1ccccc1)c1ccc(OC)cc1	ZINC000450564895	EH	On-Demand	Anodyne	MMP9	20	47
COC(=O)[C@@H](NCC/C=C\c1ccccc1)c1ccc(OC)cc1	ZINC000450564895	EH	On-Demand	Anodyne	GRIK1	15	43
COC(=O)[C@@H](NCC/C=C\c1ccccc1)c1ccc(OC)cc1	ZINC000450564895	EH	On-Demand	Anodyne	MMP1	16	43
COC(=O)[C@H](NCC/C=C/c1ccccc1)c1ccc(OC)cc1	ZINC000450564897	EH	On-Demand	Anodyne	MMP2	18	47
COC(=O)[C@H](NCC/C=C/c1ccccc1)c1ccc(OC)cc1	ZINC000450564897	EH	On-Demand	Anodyne	MMP9	20	47
COC(=O)[C@H](NCC/C=C/c1ccccc1)c1ccc(OC)cc1	ZINC000450564897	EH	On-Demand	Anodyne	GRIK1	15	43
COC(=O)[C@H](NCC/C=C/c1ccccc1)c1ccc(OC)cc1	ZINC000450564897	EH	On-Demand	Anodyne	MMP1	16	43
Fc1cc(F)c2c(c1)[C@@H](Nc1ccccn1)CCC2	ZINC000450564904	CH	On-Demand	Anodyne	KCNN3	23	40
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ocnc3-c3ccccc3)C2)c1	ZINC000450564905	EJ	On-Demand	Anodyne	SMO	44	40
Fc1cc(F)c2c(c1)[C@H](Nc1ccccn1)CCC2	ZINC000450564906	CH	On-Demand	Anodyne	KCNN3	23	40
C[C@H](c1csnn1)N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450564921	FG	On-Demand	Anodyne	CCR3	88	41
C[C@H](c1csnn1)N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450564921	FG	On-Demand	Anodyne	PRMT3	56	36
C[C@H](c1csnn1)N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450564924	FG	On-Demand	Anodyne	CCR3	88	41
C[C@H](c1csnn1)N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450564924	FG	On-Demand	Anodyne	PRMT3	56	36
C[C@@H](c1csnn1)N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450564926	FG	On-Demand	Anodyne	CCR3	88	41
C[C@@H](c1csnn1)N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450564926	FG	On-Demand	Anodyne	PRMT3	56	36
C[C@@H](c1csnn1)N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450564929	FG	On-Demand	Anodyne	CCR3	88	41
C[C@@H](c1csnn1)N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450564929	FG	On-Demand	Anodyne	PRMT3	56	36
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ocnc3-c3ccccc3)C2)c1	ZINC000450564931	EJ	On-Demand	Anodyne	SMO	44	40
C[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(C2CC2)c1	ZINC000450564932	FI	On-Demand	Bother	BDKRB1	21	40
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccnc(N2CCOCC2)n1	ZINC000450564933	EF	On-Demand	Anodyne	SORD	49	37
C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccc(C2CC2)c1	ZINC000450564935	FI	On-Demand	Bother	BDKRB1	21	40
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccnc(N2CCOCC2)n1	ZINC000450564937	EF	On-Demand	Anodyne	SORD	49	37
COc1cc(CC(=O)N2C[C@@H]3CC[C@H](O)[C@H]3C2)ccc1Cl	ZINC000450564943	DE	On-Demand	Anodyne	OPRM1	15	40
COc1cc(CC(=O)N2C[C@@H]3CC[C@H](O)[C@H]3C2)ccc1Cl	ZINC000450564943	DE	On-Demand	Anodyne	OPRK1	42	41
COc1cc(CC(=O)N2C[C@@H]3CC[C@H](O)[C@H]3C2)ccc1Cl	ZINC000450564943	DE	On-Demand	Anodyne	CCR1	30	40
CN(C)CCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450564944	GD	On-Demand	Anodyne	ADRB1	0	51
CN(C)CCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450564944	GD	On-Demand	Anodyne	HTR1A	50	42
CN(C)CCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450564944	GD	On-Demand	Anodyne	DRD2	40	48
CN(C)CCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450564944	GD	On-Demand	Anodyne	DRD1	22	47
CN(C)CCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450564944	GD	On-Demand	Anodyne	DRD4	28	42
CN(C)CCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450564944	GD	On-Demand	Anodyne	DRD3	34	50
COc1cc(CC(=O)N2C[C@H]3[C@H](O)CC[C@H]3C2)ccc1Cl	ZINC000450564945	DE	On-Demand	Anodyne	OPRM1	15	40
COc1cc(CC(=O)N2C[C@H]3[C@H](O)CC[C@H]3C2)ccc1Cl	ZINC000450564945	DE	On-Demand	Anodyne	OPRK1	42	41
COc1cc(CC(=O)N2C[C@H]3[C@H](O)CC[C@H]3C2)ccc1Cl	ZINC000450564945	DE	On-Demand	Anodyne	CCR1	30	40
COc1cc(CC(=O)N2C[C@H]3[C@@H](O)CC[C@H]3C2)ccc1Cl	ZINC000450564947	DE	On-Demand	Anodyne	OPRM1	15	40
COc1cc(CC(=O)N2C[C@H]3[C@@H](O)CC[C@H]3C2)ccc1Cl	ZINC000450564947	DE	On-Demand	Anodyne	OPRK1	42	41
COc1cc(CC(=O)N2C[C@H]3[C@@H](O)CC[C@H]3C2)ccc1Cl	ZINC000450564947	DE	On-Demand	Anodyne	CCR1	30	40
COc1cc(CC(=O)N2C[C@@H]3CC[C@@H](O)[C@H]3C2)ccc1Cl	ZINC000450564950	DE	On-Demand	Anodyne	OPRM1	15	40
COc1cc(CC(=O)N2C[C@@H]3CC[C@@H](O)[C@H]3C2)ccc1Cl	ZINC000450564950	DE	On-Demand	Anodyne	OPRK1	42	41
COc1cc(CC(=O)N2C[C@@H]3CC[C@@H](O)[C@H]3C2)ccc1Cl	ZINC000450564950	DE	On-Demand	Anodyne	CCR1	30	40
N#CC1(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)CCC1	ZINC000450564951	EG	On-Demand	Mild	CCR3	82	49
COc1ccc(-c2noc(CN3CCC(Nc4cccc(C)c4)CC3)n2)nn1	ZINC000450564953	GF	On-Demand	Anodyne	SSTR5	62	37
N#CC1(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)CCC1	ZINC000450564963	EG	On-Demand	Mild	CCR3	82	49
CCCN(Cc1cccc(C(C)=O)c1)C[C@H]1CCCCO1	ZINC000450564965	CH	On-Demand	Anodyne	OXTR	25	40
CCCN(Cc1cccc(C(C)=O)c1)C[C@H]1CCCCO1	ZINC000450564965	CH	On-Demand	Anodyne	AVPR1A	16	40
CCCN(Cc1cccc(C(C)=O)c1)C[C@@H]1CCCCO1	ZINC000450564967	CH	On-Demand	Anodyne	OXTR	25	40
CCCN(Cc1cccc(C(C)=O)c1)C[C@@H]1CCCCO1	ZINC000450564967	CH	On-Demand	Anodyne	AVPR1A	16	40
O=C(Cc1cc2ccccc2s1)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1	ZINC000450564977	GI	On-Demand	Anodyne	PREP	23	61
Cc1ccc(S(=O)(=O)NCCN2CCN(CC[C@H](C)O)CC2)cc1	ZINC000450564980	FC	On-Demand	Anodyne	HTR7	25	47
Cc1ccc(C(=O)NCC2(CO)CCC2)c2c1CCC2	ZINC000450564985	CE	On-Demand	Anodyne	HCN4	48	32
O=C(Cc1cc2ccccc2s1)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1	ZINC000450564997	GI	On-Demand	Anodyne	PREP	23	61
CCOC(=O)COc1ccc(NC(=O)C[S@@](=O)CC)cc1	ZINC000450565000	DD	On-Demand	Anodyne	ACR	45	38
CCOC(=O)COc1ccc(NC(=O)C[S@](=O)CC)cc1	ZINC000450565002	DD	On-Demand	Anodyne	ACR	45	38
Cc1ccc(S(=O)(=O)NCCN2CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450565005	FC	On-Demand	Anodyne	HTR7	25	47
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	DRD2	32	48
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	DRD1	29	54
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	DRD4	32	48
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	HTR2A	29	55
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	HTR2C	16	55
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	DRD3	21	54
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	HTR7	29	48
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	SIGMAR1	16	55
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	HTR5A	19	56
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	CHRNA6	0	43
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	SLC18A3	22	55
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	ABCB1	18	48
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	SLC6A5	17	40
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccc(F)cc1	ZINC000450565007	DH	On-Demand	Anodyne	CYP2J2	51	36
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450565008	GH	On-Demand	Anodyne	ABL1	43	38
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450565008	GH	On-Demand	Anodyne	RAF1	21	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450565008	GH	On-Demand	Anodyne	ABL2	42	33
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450565008	GH	On-Demand	Anodyne	EPHX2	36	44
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450565008	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	26	41
O=C(NCCCNc1cccc(F)c1)C1(C(=O)C2CC2)CC1	ZINC000450565035	DF	On-Demand	Anodyne	TBK1	27	43
CCOC(=O)[C@@H]1CN(c2nc(-c3ccc(OC)cc3)no2)CC12COC2	ZINC000450565036	FD	On-Demand	Anodyne	S1PR1	17	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C(C)(C)C)C2)c1	ZINC000450565038	DH	On-Demand	Anodyne	NPBWR1	59	33
CCC(=O)CCCN1CCCC[C@H]1c1cc2ccccc2[nH]1	ZINC000450565039	CI	On-Demand	Anodyne	Q7YY07_CRYPV	63	37
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450565040	DH	On-Demand	Anodyne	NPBWR1	59	33
CCC(=O)CCCN1CCCC[C@@H]1c1cc2ccccc2[nH]1	ZINC000450565041	CI	On-Demand	Anodyne	Q7YY07_CRYPV	63	37
CC(C)(C)[C@H]1CCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450565044	CH	On-Demand	Anodyne	SLC18A3	15	40
CC(C)(C)[C@H]1CCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450565044	CH	On-Demand	Anodyne	L3MBTL1	0	43
CC(C)(C)[C@H]1CCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450565044	CH	On-Demand	Anodyne	L3MBTL3	58	43
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(-n2nnnc2C(C)C)c(C)c1	ZINC000450565046	FI	On-Demand	Anodyne	NPY2R	31	40
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450565049	CH	On-Demand	Anodyne	L3MBTL1	0	43
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450565049	CH	On-Demand	Anodyne	L3MBTL3	47	43
CCOC(=O)[C@H]1CN(c2nc(-c3ccc(OC)cc3)no2)CC12COC2	ZINC000450565050	FD	On-Demand	Anodyne	S1PR1	17	41
COCc1nn(C)cc1C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450565052	EE	On-Demand	Anodyne	KCNA3	42	41
COCc1nn(C)cc1C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450565052	EE	On-Demand	Anodyne	MTNR1A	19	42
COc1cc(CC(=O)N(C)C2CCC(NC(C)=O)CC2)ccc1Cl	ZINC000450565056	FF	On-Demand	Anodyne	OPRK1	23	44
CCCOc1ccc(C(=O)NCC2(CO)CCC2)c(OC)c1	ZINC000450565071	DE	On-Demand	Anodyne	KCNA3	42	44
CCCOc1ccc(C(=O)NCC2(CO)CCC2)c(OC)c1	ZINC000450565071	DE	On-Demand	Anodyne	SLC6A5	15	47
CCCOc1ccc(C(=O)NCC2(CO)CCC2)c(OC)c1	ZINC000450565071	DE	On-Demand	Anodyne	HCN1	65	39
CCCOc1ccc(C(=O)NCC2(CO)CCC2)c(OC)c1	ZINC000450565071	DE	On-Demand	Anodyne	HCN4	56	38
Cc1nc(C)n(CCCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450565072	GH	On-Demand	Anodyne	CCR2	47	41
Cc1nc(C)n(CCCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450565072	GH	On-Demand	Anodyne	MCHR1	16	41
Cc1nc(C)n(CCCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450565072	GH	On-Demand	Anodyne	ETHR	53	35
CCCc1cc(C(=O)NCCCNc2ccccc2F)no1	ZINC000450565073	DF	On-Demand	Anodyne	HDAC10	20	42
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(-n2nnnc2C(C)C)c(C)c1	ZINC000450565079	FI	On-Demand	Anodyne	NPY2R	31	40
C[C@@H](OCCc1ccccc1)C(=O)N(C)C[C@H]1CC=CCC1	ZINC000450565082	DG	On-Demand	Anodyne	AMY2	44	31
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	DRD4	37	41
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	HTR1D	22	40
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	HRH1	32	40
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	OPRK1	0	53
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	HTR1F	56	36
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	SIGMAR1	19	40
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	SSTR5	74	37
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	CCR3	41	40
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	CCR2	28	41
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	CXCR3	25	40
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	MCHR1	33	41
COC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1Cl	ZINC000450565083	GI	On-Demand	Anodyne	MCHR2	56	34
Cc1nc(C)n(CCCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450565084	GH	On-Demand	Anodyne	CCR2	47	41
Cc1nc(C)n(CCCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450565084	GH	On-Demand	Anodyne	MCHR1	16	41
Cc1nc(C)n(CCCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450565084	GH	On-Demand	Anodyne	ETHR	53	35
C[C@H](OCCc1ccccc1)C(=O)N(C)C[C@@H]1CC=CCC1	ZINC000450565085	DG	On-Demand	Anodyne	AMY2	44	31
C[C@@H](OCCc1ccccc1)C(=O)N(C)C[C@@H]1CC=CCC1	ZINC000450565088	DG	On-Demand	Anodyne	AMY2	44	31
C[C@H](OCCc1ccccc1)C(=O)N(C)C[C@H]1CC=CCC1	ZINC000450565091	DG	On-Demand	Anodyne	AMY2	44	31
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565102	FI	On-Demand	Anodyne	CACNA1B	47	36
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565102	FI	On-Demand	Anodyne	CCR2	56	43
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565103	FI	On-Demand	Anodyne	CACNA1B	47	36
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565103	FI	On-Demand	Anodyne	CCR2	56	43
CCOC(=O)[C@H]1CN(c2ccc(S(C)(=O)=O)cc2F)CC12COC2	ZINC000450565111	FD	On-Demand	Anodyne	SLC6A9	19	41
CCOC(=O)[C@H]1CN(c2ccc(S(C)(=O)=O)cc2F)CC12COC2	ZINC000450565111	FD	On-Demand	Anodyne	GPR119	31	43
Cc1ccn(-c2ccccc2C(=O)NCC2(CO)CCC2)n1	ZINC000450565121	CE	On-Demand	Anodyne	HCN1	58	36
Cc1ccn(-c2ccccc2C(=O)NCC2(CO)CCC2)n1	ZINC000450565121	CE	On-Demand	Anodyne	HCN4	53	34
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	HTR1A	34	54
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	DRD2	34	45
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	HTR2A	33	43
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	HTR2C	28	47
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	DRD3	36	43
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	HTR7	52	55
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	SLC18A3	22	40
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1	ZINC000450565123	FF	On-Demand	Anodyne	SLC6A7	0	40
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CCc2cscn2)CC1	ZINC000450565127	GI	On-Demand	Anodyne	PYGL	0	51
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CCc2cscn2)CC1	ZINC000450565127	GI	On-Demand	Anodyne	MAPK1	23	41
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CCc2cscn2)CC1	ZINC000450565127	GI	On-Demand	Anodyne	EPHX2	19	46
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CCc2cscn2)CC1	ZINC000450565127	GI	On-Demand	Anodyne	TYK2	49	37
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CCc2cscn2)CC1	ZINC000450565127	GI	On-Demand	Anodyne	MCHR1	19	41
CCOC(=O)[C@@H]1CN(c2ccc(S(C)(=O)=O)cc2F)CC12COC2	ZINC000450565134	FD	On-Demand	Anodyne	SLC6A9	19	41
CCOC(=O)[C@@H]1CN(c2ccc(S(C)(=O)=O)cc2F)CC12COC2	ZINC000450565134	FD	On-Demand	Anodyne	GPR119	31	43
C[C@]1(F)CCCN(c2ccc3ccccc3n2)C1	ZINC000450565140	BH	On-Demand	Anodyne	HTR3A	26	42
O=C(CCNC(=O)[C@H]1CCN(c2ccccc2)C1)NCc1ccccn1	ZINC000450565141	FD	On-Demand	Anodyne	GPBAR1	23	43
C[C@@]1(F)CCCN(c2ccc3ccccc3n2)C1	ZINC000450565143	BH	On-Demand	Anodyne	HTR3A	26	42
O=C(CCNC(=O)[C@@H]1CCN(c2ccccc2)C1)NCc1ccccn1	ZINC000450565145	FD	On-Demand	Anodyne	GPBAR1	23	43
CCCN(Cc1ccc(C(=O)OCC)cn1)C[C@@H]1CCCCO1	ZINC000450565146	DG	On-Demand	Anodyne	OXTR	26	42
CCCN(Cc1ccc(C(=O)OCC)cn1)C[C@@H]1CCCCO1	ZINC000450565146	DG	On-Demand	Anodyne	AVPR1A	18	42
CCCN(Cc1ccc(C(=O)OCC)cn1)C[C@H]1CCCCO1	ZINC000450565149	DG	On-Demand	Anodyne	OXTR	26	42
CCCN(Cc1ccc(C(=O)OCC)cn1)C[C@H]1CCCCO1	ZINC000450565149	DG	On-Demand	Anodyne	AVPR1A	18	42
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	DRD2	16	41
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	DRD4	41	39
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	HRH1	38	41
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	DRD3	26	40
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	KCNH2	16	40
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	SIGMAR1	35	45
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	SSTR5	69	39
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	CCR3	64	41
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	UTS2R	17	40
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	SCN5A	59	35
COC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1Cl	ZINC000450565155	FH	On-Demand	Anodyne	MCHR1	40	43
COc1cccc(OCCC(=O)N[C@H]2CC23CCCCC3)c1	ZINC000450565162	DG	On-Demand	Anodyne	MTNR1A	35	45
COc1cccc(OCCC(=O)N[C@@H]2CC23CCCCC3)c1	ZINC000450565166	DG	On-Demand	Anodyne	MTNR1A	35	45
COC(=O)c1csc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)n1	ZINC000450565174	FE	On-Demand	Mild	PTAFR	50	45
COC(=O)c1csc(CN2CCN([C@H](C#N)c3ccccc3)CC2)n1	ZINC000450565183	FE	On-Demand	Mild	PTAFR	50	45
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(CO)CCC3)cc2)c1	ZINC000450565187	FF	On-Demand	Anodyne	E1	0	45
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(CO)CCC3)cc2)c1	ZINC000450565187	FF	On-Demand	Anodyne	ACAT	0	41
O=C(c1ccnn1CC(F)(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565194	GI	On-Demand	Anodyne	CACNA1B	40	34
O=C(c1ccnn1CC(F)(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565194	GI	On-Demand	Anodyne	CCR2	52	42
O=C(c1ccnn1CC(F)(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565194	GI	On-Demand	Anodyne	RBP4	21	41
Cc1cc(C(=O)NCCCNc2ccccc2F)nn1C(C)C	ZINC000450565195	DG	On-Demand	Anodyne	CTSA	51	36
O=C(c1ccnn1CC(F)(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565197	GI	On-Demand	Anodyne	CACNA1B	40	34
O=C(c1ccnn1CC(F)(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565197	GI	On-Demand	Anodyne	CCR2	52	42
O=C(c1ccnn1CC(F)(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450565197	GI	On-Demand	Anodyne	RBP4	21	41
CCC(=O)CCCN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450565229	EI	On-Demand	Anodyne	PRCP	24	49
CCC(=O)CCCN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450565232	EI	On-Demand	Anodyne	PRCP	24	49
CCOC(=O)COc1ccc(NC(=O)C[C@H]2COc3ccccc3O2)cc1	ZINC000450565235	FF	On-Demand	Anodyne	PTGER2	0	40
CCOC(=O)COc1ccc(NC(=O)C[C@H]2COc3ccccc3O2)cc1	ZINC000450565235	FF	On-Demand	Anodyne	PTGDR	31	40
CCOC(=O)COc1ccc(NC(=O)C[C@@H]2COc3ccccc3O2)cc1	ZINC000450565238	FF	On-Demand	Anodyne	PTGER2	0	40
CCOC(=O)COc1ccc(NC(=O)C[C@@H]2COc3ccccc3O2)cc1	ZINC000450565238	FF	On-Demand	Anodyne	PTGDR	31	40
COC(=O)C1(CNC(=O)c2cc3n(n2)CCCC3)CCCCC1	ZINC000450565251	DE	On-Demand	Anodyne	HCN4	51	34
CCC[C@@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450565254	CE	On-Demand	Anodyne	SCN5A	54	35
CCC[C@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450565257	CE	On-Demand	Anodyne	SCN5A	54	35
COc1ccc(OC(F)(F)F)c(C(=O)NCC2(CO)CCC2)c1	ZINC000450565259	EE	On-Demand	Anodyne	HCN1	50	34
COc1ccc(OC(F)(F)F)c(C(=O)NCC2(CO)CCC2)c1	ZINC000450565259	EE	On-Demand	Anodyne	HCN4	48	34
COc1ccc(-c2nnc(SCCCCCC(C)=O)o2)cc1	ZINC000450565261	DH	On-Demand	Anodyne	GSK3B	16	52
COc1ccc(-c2nnc(SCCCCCC(C)=O)o2)cc1	ZINC000450565261	DH	On-Demand	Anodyne	GSK3A	28	45
COc1ccc(-c2nnc(SCCCCCC(C)=O)o2)cc1	ZINC000450565261	DH	On-Demand	Anodyne	ALOX15	60	41
C[C@H](CCNC(=O)c1cccc(C(F)(F)F)n1)N1CCCCC1	ZINC000450565276	EG	On-Demand	Anodyne	CCR5	39	41
C[C@@H](CCNC(=O)c1cccc(C(F)(F)F)n1)N1CCCCC1	ZINC000450565280	EG	On-Demand	Anodyne	CCR5	39	41
CCC(=O)C1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450565281	EH	On-Demand	Anodyne	CACNA1B	49	36
CCC(=O)C1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450565281	EH	On-Demand	Anodyne	CCR2	105	46
CCC(=O)C1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450565281	EH	On-Demand	Anodyne	RBP4	26	41
CCC(=O)C1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450565286	EH	On-Demand	Anodyne	CACNA1B	49	36
CCC(=O)C1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450565286	EH	On-Demand	Anodyne	CCR2	105	46
CCC(=O)C1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450565286	EH	On-Demand	Anodyne	RBP4	26	41
CC[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450565295	CD	On-Demand	Anodyne	CA2	73	44
CC[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450565295	CD	On-Demand	Anodyne	CA1	63	42
CC[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450565295	CD	On-Demand	Anodyne	CA7	57	40
CC[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450565295	CD	On-Demand	Anodyne	CA5B	45	38
CC[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450565295	CD	On-Demand	Anodyne	CA4	77	44
CC[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450565295	CD	On-Demand	Anodyne	CA5A	52	38
CC[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450565295	CD	On-Demand	Anodyne	CA12	31	40
CC[C@@H]1C[C@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450565295	CD	On-Demand	Anodyne	P96878_MYCTU	47	34
CC1CC(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)(c2cccc(Cl)c2)C1	ZINC000450565304	GF	On-Demand	Anodyne	CA2	36	40
CC1CC(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)(c2cccc(Cl)c2)C1	ZINC000450565304	GF	On-Demand	Anodyne	CA5B	48	37
CC1CC(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)(c2cccc(Cl)c2)C1	ZINC000450565304	GF	On-Demand	Anodyne	CA4	42	38
CC1CC(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)(c2cccc(Cl)c2)C1	ZINC000450565304	GF	On-Demand	Anodyne	CA5A	51	37
CCOC(=O)COc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450565318	FG	On-Demand	Anodyne	MTNR1A	24	44
CCOC(=O)COc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450565318	FG	On-Demand	Anodyne	MTNR1B	27	44
CCOC(=O)COc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450565318	FG	On-Demand	Anodyne	NAMPT	23	42
CCOC(=O)COc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450565318	FG	On-Demand	Anodyne	GPR88	0	41
COc1cc(Br)ccc1CCCNC(=O)C(C)(C)OC(C)C	ZINC000450565329	FH	On-Demand	Anodyne	MTNR1B	17	40
CC[S@](=O)CC(=O)NCCCc1ccc(Br)cc1OC	ZINC000450565359	FE	On-Demand	Anodyne	MTNR1A	37	42
CC[S@](=O)CC(=O)NCCCc1ccc(Br)cc1OC	ZINC000450565359	FE	On-Demand	Anodyne	MTNR1B	37	42
CC[S@@](=O)CC(=O)NCCCc1ccc(Br)cc1OC	ZINC000450565360	FE	On-Demand	Anodyne	MTNR1A	37	42
CC[S@@](=O)CC(=O)NCCCc1ccc(Br)cc1OC	ZINC000450565360	FE	On-Demand	Anodyne	MTNR1B	37	42
CCOC(=O)[C@@H]1CN(c2ccc3ccccc3n2)CC12COC2	ZINC000450565364	DE	On-Demand	Anodyne	HTR3A	28	40
CCOC(=O)[C@@H]1CN(c2ccc3ccccc3n2)CC12COC2	ZINC000450565364	DE	On-Demand	Anodyne	PDE1B	0	41
CCOC(=O)[C@H]1CN(c2ccc3ccccc3n2)CC12COC2	ZINC000450565365	DE	On-Demand	Anodyne	HTR3A	28	40
CCOC(=O)[C@H]1CN(c2ccc3ccccc3n2)CC12COC2	ZINC000450565365	DE	On-Demand	Anodyne	PDE1B	0	41
C[C@H](C[S@](C)=O)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450565370	DD	On-Demand	Anodyne	CTSV	52	36
C[C@@H](C[S@](C)=O)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450565371	DD	On-Demand	Anodyne	CTSV	52	36
C[C@@H](C[S@@](C)=O)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450565372	DD	On-Demand	Anodyne	CTSV	52	36
C[C@H](C[S@@](C)=O)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450565373	DD	On-Demand	Anodyne	CTSV	52	36
COc1cccc(OCCC(=O)N[C@@H](CO)c2ccc(F)cc2)c1	ZINC000450565379	EE	On-Demand	Anodyne	MTNR1A	32	45
COc1cccc(OCCC(=O)N[C@H](CO)c2ccc(F)cc2)c1	ZINC000450565380	EE	On-Demand	Anodyne	MTNR1A	32	45
COc1cc(Br)ccc1CCCNC(=O)CC1(O)CCC1	ZINC000450565381	FF	On-Demand	Anodyne	MTNR1B	19	42
COC(=O)c1ccc(CN2CCC[C@@H]2CS(N)(=O)=O)cc1Cl	ZINC000450565386	ED	On-Demand	Anodyne	DRD2	43	41
COC(=O)c1ccc(CN2CCC[C@@H]2CS(N)(=O)=O)cc1Cl	ZINC000450565386	ED	On-Demand	Anodyne	OPRK1	0	40
COC(=O)c1ccc(CN2CCC[C@H]2CS(N)(=O)=O)cc1Cl	ZINC000450565387	ED	On-Demand	Anodyne	DRD2	43	41
COC(=O)c1ccc(CN2CCC[C@H]2CS(N)(=O)=O)cc1Cl	ZINC000450565387	ED	On-Demand	Anodyne	OPRK1	0	40
O=C(Nc1nccs1)[C@H]1CCCN1CC12CCC(CC1)C2	ZINC000450565390	DG	On-Demand	Anodyne	MAP	0	42
O=C(Nc1nccs1)[C@H]1CCCN1CC12CCC(CC1)C2	ZINC000450565390	DG	On-Demand	Anodyne	HSD11B1	41	36
O=C(Nc1nccs1)[C@H]1CCCN1CC12CCC(CC1)C2	ZINC000450565390	DG	On-Demand	Anodyne	MAP1	83	42
O=C(Nc1nccs1)[C@@H]1CCCN1CC12CCC(CC1)C2	ZINC000450565391	DG	On-Demand	Anodyne	MAP	0	42
O=C(Nc1nccs1)[C@@H]1CCCN1CC12CCC(CC1)C2	ZINC000450565391	DG	On-Demand	Anodyne	HSD11B1	41	36
O=C(Nc1nccs1)[C@@H]1CCCN1CC12CCC(CC1)C2	ZINC000450565391	DG	On-Demand	Anodyne	MAP1	83	42
Cc1ccc(C(=O)N[C@@H](CO)c2ccc(F)cc2)c(C)n1	ZINC000450565401	CE	In-Stock	Anodyne	MAPK1	42	36
Cc1ccc(C(=O)N[C@@H](CO)c2ccc(F)cc2)c(C)n1	ZINC000450565401	CE	In-Stock	Anodyne	UTS2	41	33
Cc1ccc(C(=O)N[C@H](CO)c2ccc(F)cc2)c(C)n1	ZINC000450565402	CE	In-Stock	Anodyne	MAPK1	42	36
Cc1ccc(C(=O)N[C@H](CO)c2ccc(F)cc2)c(C)n1	ZINC000450565402	CE	In-Stock	Anodyne	UTS2	41	33
CC(F)(F)CCNc1c(C#N)cnc2c(Br)cccc12	ZINC000450565416	EI	On-Demand	Mild	MAP3K8	63	38
O=C1NCCN(C(=O)CSC2CC2)[C@H]1Cc1ccccc1	ZINC000450565419	DD	On-Demand	Anodyne	GALR1	45	32
O=C1NCCN(C(=O)CSC2CC2)[C@@H]1Cc1ccccc1	ZINC000450565420	DD	On-Demand	Anodyne	GALR1	45	32
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	THRA	43	41
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	DRD2	36	48
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	DRD1	25	51
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	DRD4	29	52
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	HTR2A	39	61
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	HTR2C	30	63
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	ERG2	23	48
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	THRB	39	41
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	SLC18A3	0	49
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	HTR3B	0	48
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	CYP2J2	66	47
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	NET	0	48
CCS(=O)(=O)N(C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450565422	FF	On-Demand	Anodyne	AP2S1	0	48
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450565423	ED	On-Demand	Anodyne	CHRNA7	25	43
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450565424	ED	On-Demand	Anodyne	CHRNA7	25	43
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	HTR1A	28	46
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	DRD2	31	46
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	DRD4	59	45
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	DRD3	53	46
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	SIGMAR1	15	45
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	CCR3	18	49
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	PLD1	59	49
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	PLD2	88	39
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	MCHR1	21	42
COc1ccc(C(=O)NCCN2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565436	GE	On-Demand	Anodyne	CACNA1I	44	38
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	HTR1A	28	46
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	DRD2	31	46
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	DRD4	59	45
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	DRD3	53	46
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	SIGMAR1	15	45
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	CCR3	18	49
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	PLD1	59	49
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	PLD2	88	39
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	MCHR1	21	42
COc1ccc(C(=O)NCCN2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450565437	GE	On-Demand	Anodyne	CACNA1I	44	38
Cc1ccccc1CCc1cc(NC(=O)C2CCN(C)CC2)n[nH]1	ZINC000450565442	EE	On-Demand	Anodyne	HTR1F	64	38
Cc1ccccc1CCc1cc(NC(=O)C2CCN(C)CC2)n[nH]1	ZINC000450565442	EE	On-Demand	Anodyne	GSK3B	18	47
Cc1ccccc1CCc1cc(NC(=O)C2CCN(C)CC2)n[nH]1	ZINC000450565442	EE	On-Demand	Anodyne	GSK3A	24	44
Cc1ccccc1CCc1cc(NC(=O)C2CCN(C)CC2)n[nH]1	ZINC000450565442	EE	On-Demand	Anodyne	LIMK2	26	42
CO[C@@H](Cc1ccccc1)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450565454	FE	On-Demand	Anodyne	DRD4	15	43
CO[C@@H](Cc1ccccc1)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450565454	FE	On-Demand	Anodyne	SLC6A3	17	44
CO[C@@H](Cc1ccccc1)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450565454	FE	On-Demand	Anodyne	SIGMAR1	38	42
CO[C@@H](Cc1ccccc1)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450565454	FE	On-Demand	Anodyne	ADAM10	16	41
CO[C@H](Cc1ccccc1)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450565455	FE	On-Demand	Anodyne	DRD4	15	43
CO[C@H](Cc1ccccc1)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450565455	FE	On-Demand	Anodyne	SLC6A3	17	44
CO[C@H](Cc1ccccc1)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450565455	FE	On-Demand	Anodyne	SIGMAR1	38	42
CO[C@H](Cc1ccccc1)CN1CCC(CC(=O)N2CCN(C)CC2)CC1	ZINC000450565455	FE	On-Demand	Anodyne	ADAM10	16	41
Cn1c(C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)c2n(c1=O)CCCC2	ZINC000450565460	FC	On-Demand	Anodyne	GHRL	51	32
Cn1c(C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)c2n(c1=O)CCCC2	ZINC000450565461	FC	On-Demand	Anodyne	GHRL	51	32
FC(F)(F)c1cc(NCCCC2CCOCC2)n2ncnc2n1	ZINC000450565478	EF	On-Demand	Anodyne	DHOD	0	50
O=C1NCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@H]1Cc1ccccc1	ZINC000450565480	GD	On-Demand	Anodyne	THYX_PBCV1	0	41
O=C1NCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@@H]1Cc1ccccc1	ZINC000450565481	GD	On-Demand	Anodyne	THYX_PBCV1	0	41
O=C1NCCN(C(=O)c2cnc(C3CC3)nc2)[C@H]1Cc1ccccc1	ZINC000450565514	ED	On-Demand	Anodyne	GALR1	44	32
O=C1NCCN(C(=O)c2cnc(C3CC3)nc2)[C@H]1Cc1ccccc1	ZINC000450565514	ED	On-Demand	Anodyne	GHRL	49	31
O=C1NCCN(C(=O)c2cnc(C3CC3)nc2)[C@@H]1Cc1ccccc1	ZINC000450565516	ED	On-Demand	Anodyne	GALR1	44	32
O=C1NCCN(C(=O)c2cnc(C3CC3)nc2)[C@@H]1Cc1ccccc1	ZINC000450565516	ED	On-Demand	Anodyne	GHRL	49	31
CN1CCN(C(=O)CC2CCN(CC/C=C\c3ccccc3)CC2)CC1	ZINC000450565526	FF	On-Demand	Anodyne	SIGMAR1	27	46
CN1CCN(C(=O)CC2CCN(CC/C=C\c3ccccc3)CC2)CC1	ZINC000450565526	FF	On-Demand	Anodyne	CYP2J2	43	30
CN1CCN(C(=O)CC2CCN(CC/C=C/c3ccccc3)CC2)CC1	ZINC000450565527	FF	On-Demand	Anodyne	SIGMAR1	27	46
CN1CCN(C(=O)CC2CCN(CC/C=C/c3ccccc3)CC2)CC1	ZINC000450565527	FF	On-Demand	Anodyne	CYP2J2	43	30
CN1CCN(C(=O)CC2CCN(Cc3ccccc3OC3CC3)CC2)CC1	ZINC000450565537	FF	On-Demand	Anodyne	HRH1	17	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@@H]1CCO[C@H](C)C1	ZINC000450565538	EH	On-Demand	Anodyne	CCR2	42	37
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@H]1CCO[C@H](C)C1	ZINC000450565539	EH	On-Demand	Anodyne	CCR2	42	37
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@@H]1CCO[C@@H](C)C1	ZINC000450565541	EH	On-Demand	Anodyne	CCR2	42	37
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@H]1CCO[C@@H](C)C1	ZINC000450565542	EH	On-Demand	Anodyne	CCR2	42	37
CC(C)(C(=O)N1CC(F)C1)c1cccc2ccccc12	ZINC000450565554	CG	On-Demand	Anodyne	KCNJ11	43	33
C[C@H](NC(=O)C1(C)CCC(=O)CC1)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450565555	FJ	On-Demand	Anodyne	SDH1	0	49
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)c1ccc(-c2ccc(F)cc2)cc1	ZINC000450565556	FJ	On-Demand	Anodyne	SDH1	0	49
CC1CCC(NC(=O)CN2CCN(CC/C=C\c3ccccc3)CC2)CC1	ZINC000450565567	FG	On-Demand	Anodyne	DRD4	0	41
CC1CCC(NC(=O)CN2CCN(CC/C=C\c3ccccc3)CC2)CC1	ZINC000450565567	FG	On-Demand	Anodyne	SIGMAR1	22	41
CC1CCC(NC(=O)CN2CCN(CC/C=C/c3ccccc3)CC2)CC1	ZINC000450565569	FG	On-Demand	Anodyne	DRD4	0	41
CC1CCC(NC(=O)CN2CCN(CC/C=C/c3ccccc3)CC2)CC1	ZINC000450565569	FG	On-Demand	Anodyne	SIGMAR1	22	41
CC(F)(F)c1ccc(C(=O)NCCC(=O)NCc2ccccn2)cn1	ZINC000450565581	EE	On-Demand	Anodyne	F2	16	43
COc1nccc(Cn2cc(C(F)(F)F)cc(Cl)c2=O)n1	ZINC000450565587	DE	On-Demand	Anodyne	NPBWR1	31	40
CCNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450565594	FF	On-Demand	Anodyne	LUXN	0	40
C[C@H](c1ccccc1)[C@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450565642	CF	On-Demand	Anodyne	DRD1	15	49
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450565643	CF	On-Demand	Anodyne	DRD1	15	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450565644	CF	On-Demand	Anodyne	DRD1	15	49
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450565645	CF	On-Demand	Anodyne	DRD1	15	49
N#Cc1ccnc(N[C@H]2CCCc3c(F)cccc32)c1	ZINC000450565652	CH	On-Demand	Mild	MAP3K12	46	33
N#Cc1ccnc(N[C@@H]2CCCc3c(F)cccc32)c1	ZINC000450565654	CH	On-Demand	Mild	MAP3K12	46	33
CCC[C@H](O)CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450565655	EF	On-Demand	Anodyne	CCR3	106	44
CCOC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)nc1	ZINC000450565660	FH	On-Demand	Anodyne	SSTR5	46	38
CCOC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)nc1	ZINC000450565660	FH	On-Demand	Anodyne	CCR2	55	46
CCc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)no1	ZINC000450565664	EF	On-Demand	Anodyne	DRD4	22	40
CCc1nc(CN2CCN(CCc3ccc(Cl)cc3)CC2)no1	ZINC000450565664	EF	On-Demand	Anodyne	PLA2G2A	0	42
CCOC(=O)COc1ccc(NC(=O)c2cccc(CC)n2)cc1	ZINC000450565667	EF	On-Demand	Anodyne	PDE5A	30	45
CCOC(=O)COc1ccc(NC(=O)c2cccc(CC)n2)cc1	ZINC000450565667	EF	On-Demand	Anodyne	P4HTM	0	44
CCC[C@@H](O)CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450565669	EF	On-Demand	Anodyne	CCR3	106	44
CCC[C@@H](O)CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450565671	EF	On-Demand	Anodyne	CCR3	106	44
CCC[C@H](O)CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000450565674	EF	On-Demand	Anodyne	CCR3	106	44
c1cnc2[nH]cc(C3CCN(Cc4cnn[nH]4)CC3)c2c1	ZINC000450565690	CE	On-Demand	Anodyne	CCR2	0	45
c1cnc2[nH]cc(C3CCN(Cc4cnn[nH]4)CC3)c2c1	ZINC000450565690	CE	On-Demand	Anodyne	CDC7	40	39
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccc(S(C)(=O)=O)cn1	ZINC000450565705	EG	On-Demand	Anodyne	GCKR	42	31
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccc(S(C)(=O)=O)cn1	ZINC000450565707	EG	On-Demand	Anodyne	GCKR	42	31
COc1ccc2cc([C@@]3(C)NC(=O)N(CCCCCC(C)=O)C3=O)ccc2c1	ZINC000450565708	GH	On-Demand	Anodyne	P2RY12	32	40
CCS(=O)(=O)c1ccc(CN(CC2CC2)CC2CC2)cc1	ZINC000450565718	DG	On-Demand	Anodyne	RORC	21	43
COc1ccc2cc([C@]3(C)NC(=O)N(CCCCCC(C)=O)C3=O)ccc2c1	ZINC000450565724	GH	On-Demand	Anodyne	P2RY12	32	40
COc1ccc(CNC(=O)CCN[C@H](c2ncccc2C)C(C)C)c(OC)c1	ZINC000450565729	GG	On-Demand	Anodyne	PDGFRB	37	40
COc1ccc(CNC(=O)CCN[C@H](c2ncccc2C)C(C)C)c(OC)c1	ZINC000450565729	GG	On-Demand	Anodyne	MTNR1A	46	40
COc1ccc(CNC(=O)CCN[C@H](c2ncccc2C)C(C)C)c(OC)c1	ZINC000450565729	GG	On-Demand	Anodyne	MTNR1B	37	40
COc1ccc(CNC(=O)CCN[C@H](c2ncccc2C)C(C)C)c(OC)c1	ZINC000450565729	GG	On-Demand	Anodyne	CSF1R	15	40
CCOC(=O)c1ccc(CN(CC(=O)N2CCCCC2)c2cccc(C)c2)nc1	ZINC000450565741	GH	On-Demand	Anodyne	P2RY12	30	43
COc1ccc(CNC(=O)CCN[C@@H](c2ncccc2C)C(C)C)c(OC)c1	ZINC000450565742	GG	On-Demand	Anodyne	PDGFRB	37	40
COc1ccc(CNC(=O)CCN[C@@H](c2ncccc2C)C(C)C)c(OC)c1	ZINC000450565742	GG	On-Demand	Anodyne	MTNR1A	46	40
COc1ccc(CNC(=O)CCN[C@@H](c2ncccc2C)C(C)C)c(OC)c1	ZINC000450565742	GG	On-Demand	Anodyne	MTNR1B	37	40
COc1ccc(CNC(=O)CCN[C@@H](c2ncccc2C)C(C)C)c(OC)c1	ZINC000450565742	GG	On-Demand	Anodyne	CSF1R	15	40
CCOC(=O)[C@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC12COC2	ZINC000450565753	GF	On-Demand	Anodyne	HDAC1	30	40
CCOC(=O)[C@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC12COC2	ZINC000450565753	GF	On-Demand	Anodyne	P4HTM	0	41
CCOC(=O)[C@@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC12COC2	ZINC000450565756	GF	On-Demand	Anodyne	HDAC1	30	40
CCOC(=O)[C@@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC12COC2	ZINC000450565756	GF	On-Demand	Anodyne	P4HTM	0	41
COC(=O)c1csc(CN2CCN(c3ncccc3Cl)CC2)n1	ZINC000450565762	FE	On-Demand	Anodyne	HTR1A	17	41
COC(=O)c1csc(CN2CCN(c3ncccc3Cl)CC2)n1	ZINC000450565762	FE	On-Demand	Anodyne	DRD2	18	44
COC(=O)c1csc(CN2CCN(c3ncccc3Cl)CC2)n1	ZINC000450565762	FE	On-Demand	Anodyne	DRD3	24	41
COC(=O)c1csc(CN2CCN(c3ncccc3Cl)CC2)n1	ZINC000450565762	FE	On-Demand	Anodyne	TRPV1	16	43
Cc1cccc2c1O[C@H](C(=O)NCCCNc1cccc(F)c1)C2	ZINC000450565784	EG	On-Demand	Anodyne	TBK1	20	41
Cc1cccc2c1O[C@@H](C(=O)NCCCNc1cccc(F)c1)C2	ZINC000450565787	EG	On-Demand	Anodyne	TBK1	20	41
CCOC(=O)COc1ccc(NC(=O)CC[C@@H]2CCC(=O)N2)cc1	ZINC000450565793	ED	On-Demand	Anodyne	ADORA2B	42	36
CCOC(=O)COc1ccc(NC(=O)CC[C@H]2CCC(=O)N2)cc1	ZINC000450565795	ED	On-Demand	Anodyne	ADORA2B	42	36
O=C1CCCCN1CC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450565842	EH	On-Demand	Anodyne	SIGMAR1	23	51
O=C1CCCCN1CC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450565844	EH	On-Demand	Anodyne	SIGMAR1	23	51
C[C@H](CCO)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450565857	EH	On-Demand	Bother	COLA	47	33
C[C@H](CCO)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450565857	EH	On-Demand	Bother	TAAR1	15	44
C[C@H](CCO)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450565857	EH	On-Demand	Bother	MCL1	0	40
Cn1ncc2c(NC[C@H](O)Cc3cccc(F)c3)ncnc21	ZINC000450565860	DD	On-Demand	Anodyne	ABL1	43	52
Cn1ncc2c(NC[C@H](O)Cc3cccc(F)c3)ncnc21	ZINC000450565860	DD	On-Demand	Anodyne	SRC	0	52
Cn1ncc2c(NC[C@@H](O)Cc3cccc(F)c3)ncnc21	ZINC000450565861	DD	On-Demand	Anodyne	ABL1	43	52
Cn1ncc2c(NC[C@@H](O)Cc3cccc(F)c3)ncnc21	ZINC000450565861	DD	On-Demand	Anodyne	SRC	0	52
C[C@@H](CCO)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450565869	EH	On-Demand	Bother	COLA	47	33
C[C@@H](CCO)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450565869	EH	On-Demand	Bother	TAAR1	15	44
C[C@@H](CCO)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450565869	EH	On-Demand	Bother	MCL1	0	40
COC(=O)C1(CNC(=O)[C@H](C)OCCc2ccccc2)CCCCC1	ZINC000450565872	EF	On-Demand	Anodyne	TIMP3	46	34
COC(=O)C1(CNC(=O)[C@@H](C)OCCc2ccccc2)CCCCC1	ZINC000450565874	EF	On-Demand	Anodyne	TIMP3	46	34
CCOC(=O)c1ccc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)nc1	ZINC000450565878	FF	On-Demand	Mild	P2RY12	34	43
CCOC(=O)c1ccc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)nc1	ZINC000450565878	FF	On-Demand	Mild	PTAFR	54	44
CCOC(=O)c1ccc(CN2CCN([C@H](C#N)c3ccccc3)CC2)nc1	ZINC000450565880	FF	On-Demand	Mild	P2RY12	34	43
CCOC(=O)c1ccc(CN2CCN([C@H](C#N)c3ccccc3)CC2)nc1	ZINC000450565880	FF	On-Demand	Mild	PTAFR	54	44
COc1cc(OC)c2ncnc(NC[C@@H]3CS(=O)(=O)c4ccccc43)c2c1	ZINC000450565881	GE	On-Demand	Anodyne	PDE6A	40	31
COc1cc(OC)c2ncnc(NC[C@H]3CS(=O)(=O)c4ccccc43)c2c1	ZINC000450565884	GE	On-Demand	Anodyne	PDE6A	40	31
CC(C)O[C@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450565892	FH	On-Demand	Anodyne	CACNA1B	42	35
CC(C)O[C@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450565892	FH	On-Demand	Anodyne	CCR2	72	42
CC(C)O[C@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450565894	FH	On-Demand	Anodyne	CACNA1B	42	35
CC(C)O[C@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450565894	FH	On-Demand	Anodyne	CCR2	72	42
CC(C)O[C@@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450565896	FH	On-Demand	Anodyne	CACNA1B	42	35
CC(C)O[C@@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450565896	FH	On-Demand	Anodyne	CCR2	72	42
CC(C)O[C@@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450565898	FH	On-Demand	Anodyne	CACNA1B	42	35
CC(C)O[C@@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCOC1	ZINC000450565898	FH	On-Demand	Anodyne	CCR2	72	42
N#C[C@@H](c1ccccc1)N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450565912	EH	On-Demand	Mild	PTAFR	39	43
N#C[C@H](c1ccccc1)N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450565915	EH	On-Demand	Mild	PTAFR	39	43
N#C[C@@H](c1ccccc1)N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450565918	EH	On-Demand	Mild	PTAFR	39	43
N#C[C@H](c1ccccc1)N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450565919	EH	On-Demand	Mild	PTAFR	39	43
Cc1nc(-c2c(C)noc2C)sc1C(=O)NCCCNc1ccccc1F	ZINC000450565926	GI	On-Demand	Anodyne	SCD1	20	42
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	ADRB2	0	48
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	HTR1A	75	44
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	DRD2	59	48
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	DRD1	23	43
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	DRD4	32	48
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	ADRA1D	48	48
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	ADRA1A	48	48
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	ADRA1B	30	48
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	DRD3	55	48
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	DRD5	17	43
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	HTR7	42	40
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	ABCB1	85	49
CN(C)CCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450565927	GE	On-Demand	Anodyne	HSP90AB1	42	51
N#CC1(CN2CCC[C@@H]2C(=O)Nc2nccs2)CCC1	ZINC000450565947	CE	On-Demand	Mild	MAP1	59	38
CCOC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)nc1	ZINC000450565955	EF	On-Demand	Anodyne	SCN9A	0	41
CCOC(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)nc1	ZINC000450565955	EF	On-Demand	Anodyne	SCN5A	35	41
N#CC1(CN2CCC[C@H]2C(=O)Nc2nccs2)CCC1	ZINC000450565957	CE	On-Demand	Mild	MAP1	59	38
CC(C)c1nccc(N2[C@@H](C)C[C@H](CC(F)(F)F)[C@H]2C)n1	ZINC000450565958	DI	On-Demand	Anodyne	SORD	74	39
CC(C)c1nccc(N2[C@@H](C)C[C@@H](CC(F)(F)F)[C@H]2C)n1	ZINC000450565960	DI	On-Demand	Anodyne	SORD	74	39
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@@H](C)c3ccccc3)C2)nc1	ZINC000450565989	FG	On-Demand	Anodyne	SLC6A1	99	41
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@@H](C)c3ccccc3)C2)nc1	ZINC000450565989	FG	On-Demand	Anodyne	EPHX2	17	41
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@H](C)c3ccccc3)C2)nc1	ZINC000450565991	FG	On-Demand	Anodyne	SLC6A1	99	41
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@@H](O)[C@H](C)c3ccccc3)C2)nc1	ZINC000450565991	FG	On-Demand	Anodyne	EPHX2	17	41
CCc1cccc(C(=O)NCC2(C(=O)OC)CCCCC2)n1	ZINC000450565994	DE	On-Demand	Anodyne	HCN1	56	34
CCc1cccc(C(=O)NCC2(C(=O)OC)CCCCC2)n1	ZINC000450565994	DE	On-Demand	Anodyne	HCN4	53	34
COC(=O)C1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450565998	FE	On-Demand	Anodyne	DRD4	43	34
COC(=O)C1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450565998	FE	On-Demand	Anodyne	HCN1	52	35
COC(=O)C1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450565998	FE	On-Demand	Anodyne	HCN4	48	33
CC(=O)c1cccc(CN2CCC[C@H]2CS(N)(=O)=O)c1	ZINC000450566006	CD	On-Demand	Anodyne	HRH3	17	40
CC(=O)c1cccc(CN2CCC[C@H]2CS(N)(=O)=O)c1	ZINC000450566006	CD	On-Demand	Anodyne	TRY2_BOVIN	50	33
CC(=O)c1cccc(CN2CCC[C@@H]2CS(N)(=O)=O)c1	ZINC000450566007	CD	On-Demand	Anodyne	HRH3	17	40
CC(=O)c1cccc(CN2CCC[C@@H]2CS(N)(=O)=O)c1	ZINC000450566007	CD	On-Demand	Anodyne	TRY2_BOVIN	50	33
CN(C[C@H]1C[C@H]2CC[C@H]1O2)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450566026	EF	On-Demand	Anodyne	L3MBTL3	61	39
CC(=O)c1ccc(CN2CCc3[nH]c4ccc(F)cc4c3C2)cc1	ZINC000450566029	DI	On-Demand	Anodyne	NOD2	40	35
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	HTR1D	33	44
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	HTR1B	28	44
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	NQO2	32	52
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	MPO	69	39
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	BRS3	26	40
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	MTNR1A	27	52
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	MTNR1B	19	52
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	GRPR	51	32
CC(=O)N[C@H](C(=O)NCCc1c[nH]c2ccc(Br)cc12)C(C)(C)C	ZINC000450566032	GG	On-Demand	Anodyne	ABCG2	24	40
CN(C[C@@H]1C[C@H]2CC[C@H]1O2)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450566034	EF	On-Demand	Anodyne	L3MBTL3	61	39
COc1cccc([C@@H]2C[C@H]2C(=O)N(C)C[C@@H]2CC=CCC2)c1	ZINC000450566063	CH	On-Demand	Anodyne	GPR88	0	44
COc1cccc([C@@H]2C[C@H]2C(=O)N(C)C[C@H]2CC=CCC2)c1	ZINC000450566065	CH	On-Demand	Anodyne	GPR88	0	44
C[C@H](CCO)CCNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450566084	EE	On-Demand	Anodyne	HTR3A	25	52
C[C@@H](CCO)CCNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450566085	EE	On-Demand	Anodyne	HTR3A	25	52
O=C(NCC1(CO)CCC1)c1ccc(I)cc1F	ZINC000450566087	FE	On-Demand	Anodyne	MAP2K1	53	33
CN(Cc1cn(CC2CC2)nn1)C1CCN(Cc2ccccc2)CC1	ZINC000450566120	EF	On-Demand	Anodyne	DRD2	0	46
CN(Cc1cn(CC2CC2)nn1)C1CCN(Cc2ccccc2)CC1	ZINC000450566120	EF	On-Demand	Anodyne	DRD4	26	41
CN(Cc1cn(CC2CC2)nn1)C1CCN(Cc2ccccc2)CC1	ZINC000450566120	EF	On-Demand	Anodyne	DRD3	22	44
CC(F)(F)CCn1cnc2sc3c(c2c1=O)CCCCC3	ZINC000450566156	DH	On-Demand	Anodyne	HTR1B	17	43
COc1ccccc1Oc1ccc(C(=O)NCCc2nnc3n2CCCC3)nc1	ZINC000450566163	GF	On-Demand	Anodyne	HTR1A	22	41
COc1ccccc1Oc1ccc(C(=O)NCCc2nnc3n2CCCC3)nc1	ZINC000450566163	GF	On-Demand	Anodyne	DRD2	30	41
COc1ccccc1Oc1ccc(C(=O)NCCc2nnc3n2CCCC3)nc1	ZINC000450566163	GF	On-Demand	Anodyne	DRD3	43	41
COc1ccccc1Oc1ccc(C(=O)NCCc2nnc3n2CCCC3)nc1	ZINC000450566163	GF	On-Demand	Anodyne	SCD1	17	40
COc1ccccc1Oc1ccc(C(=O)NCCc2nnc3n2CCCC3)nc1	ZINC000450566163	GF	On-Demand	Anodyne	HCN1	52	34
COc1ccccc1Oc1ccc(C(=O)NCCc2nnc3n2CCCC3)nc1	ZINC000450566163	GF	On-Demand	Anodyne	HCN4	48	33
O=C(CN(Cc1cccnc1)C[C@H]1C[C@H]2CC[C@H]1O2)Nc1ccc(Cl)cc1	ZINC000450566167	GH	On-Demand	Anodyne	NAMPT	39	40
O=C(CN(Cc1cccnc1)C[C@H]1C[C@H]2CC[C@H]1O2)Nc1ccc(Cl)cc1	ZINC000450566167	GH	On-Demand	Anodyne	NR1D1	45	38
O=C(CN(Cc1cccnc1)C[C@@H]1C[C@H]2CC[C@H]1O2)Nc1ccc(Cl)cc1	ZINC000450566168	GH	On-Demand	Anodyne	NAMPT	39	40
O=C(CN(Cc1cccnc1)C[C@@H]1C[C@H]2CC[C@H]1O2)Nc1ccc(Cl)cc1	ZINC000450566168	GH	On-Demand	Anodyne	NR1D1	45	38
CC(=O)CCCCCn1nnc(-c2ccccc2C)n1	ZINC000450566172	CF	On-Demand	Anodyne	SOAT1	16	40
C[C@@H](O)CCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566173	EF	On-Demand	Anodyne	MAPK1	36	44
C[C@H](O)CCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566174	EF	On-Demand	Anodyne	MAPK1	36	44
Cc1ccc(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c(C)n1	ZINC000450566179	EF	On-Demand	Anodyne	MAP	0	42
Cc1ccc(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c(C)n1	ZINC000450566179	EF	On-Demand	Anodyne	ADAM17	0	54
Cc1ccc(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c(C)n1	ZINC000450566180	EF	On-Demand	Anodyne	MAP	0	42
Cc1ccc(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c(C)n1	ZINC000450566180	EF	On-Demand	Anodyne	ADAM17	0	54
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(N2CCC2)nc1	ZINC000450566195	GI	On-Demand	Anodyne	AKT1	0	41
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(N2CCC2)nc1	ZINC000450566195	GI	On-Demand	Anodyne	SCD1	16	43
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(N2CCC2)nc1	ZINC000450566195	GI	On-Demand	Anodyne	HPGDS	33	45
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(N2CCC2)nc1	ZINC000450566196	GI	On-Demand	Anodyne	AKT1	0	41
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(N2CCC2)nc1	ZINC000450566196	GI	On-Demand	Anodyne	SCD1	16	43
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(N2CCC2)nc1	ZINC000450566196	GI	On-Demand	Anodyne	HPGDS	33	45
O=C(NCCO)c1ccc(N2CCc3c(F)ccc(Br)c3C2)nn1	ZINC000450566197	GD	On-Demand	Anodyne	SCD1	46	44
O=C(NCCO)c1ccc(N2CCc3c(F)ccc(Br)c3C2)nn1	ZINC000450566197	GD	On-Demand	Anodyne	SCD	38	41
CC[S@@](=O)CC(=O)NCCn1c2ccccc2c2ccccc21	ZINC000450566201	EF	On-Demand	Anodyne	CNR1	28	41
CC[S@](=O)CC(=O)NCCn1c2ccccc2c2ccccc21	ZINC000450566203	EF	On-Demand	Anodyne	CNR1	28	41
CC(=O)c1cccc(CN2CCc3[nH]c4ccc(F)cc4c3C2)c1	ZINC000450566207	DI	On-Demand	Anodyne	HTR5A	17	48
CC(=O)c1cccc(CN2CCc3[nH]c4ccc(F)cc4c3C2)c1	ZINC000450566207	DI	On-Demand	Anodyne	MCHR2	22	40
COCCOC[C@@H](O)CN1CCN(Cc2noc(C(C)(C)C)n2)CC1	ZINC000450566271	FC	On-Demand	Anodyne	ACOX1	33	42
COCCOC[C@@H](O)CN1CCN(Cc2noc(C(C)(C)C)n2)CC1	ZINC000450566271	FC	On-Demand	Anodyne	HSP90AB1	36	41
O=C(c1cc(F)c(N2CCOCC2)c(F)c1)N1CC(F)C1	ZINC000450566272	DD	On-Demand	Anodyne	AKR1C3	30	40
COCCOC[C@H](O)CN1CCN(Cc2noc(C(C)(C)C)n2)CC1	ZINC000450566277	FC	On-Demand	Anodyne	ACOX1	33	42
COCCOC[C@H](O)CN1CCN(Cc2noc(C(C)(C)C)n2)CC1	ZINC000450566277	FC	On-Demand	Anodyne	HSP90AB1	36	41
COC(=O)C1CCC(NC(=O)Cc2ccc(Cl)c(OC)c2)(C(=O)OC)CC1	ZINC000450566292	GE	On-Demand	Anodyne	NCE103	24	40
COC(=O)C1CCC(NC(=O)Cc2ccc(Cl)c(OC)c2)(C(=O)OC)CC1	ZINC000450566292	GE	On-Demand	Anodyne	P96878_MYCTU	16	40
Cc1ccc(S(=O)(=O)NCCN2CCN(CCC3=CCCCC3)CC2)cc1	ZINC000450566326	GF	On-Demand	Anodyne	HTR7	23	52
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@H](C)c3ccccc3)C2)nc1	ZINC000450566331	FG	On-Demand	Anodyne	SLC6A1	99	41
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@H](C)c3ccccc3)C2)nc1	ZINC000450566331	FG	On-Demand	Anodyne	EPHX2	17	41
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@@H](C)c3ccccc3)C2)nc1	ZINC000450566333	FG	On-Demand	Anodyne	SLC6A1	99	41
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@H](O)[C@@H](C)c3ccccc3)C2)nc1	ZINC000450566333	FG	On-Demand	Anodyne	EPHX2	17	41
CCS(=O)(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450566350	GE	On-Demand	Anodyne	CA2	20	43
CCS(=O)(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450566350	GE	On-Demand	Anodyne	TYMS	0	45
CCS(=O)(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450566350	GE	On-Demand	Anodyne	CA1	18	43
CCS(=O)(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450566350	GE	On-Demand	Anodyne	CA7	38	43
CCS(=O)(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450566350	GE	On-Demand	Anodyne	CA14	20	43
CCS(=O)(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450566350	GE	On-Demand	Anodyne	CA12	22	43
CCS(=O)(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450566350	GE	On-Demand	Anodyne	CA9	20	40
Fc1cccc2c1CCC[C@H]2Nc1ncc(Cl)cn1	ZINC000450566356	CH	On-Demand	Anodyne	KCNN3	16	43
Fc1cccc2c1CCC[C@@H]2Nc1ncc(Cl)cn1	ZINC000450566357	CH	On-Demand	Anodyne	KCNN3	16	43
Cc1cccc([C@@H]2CCN(C(=O)[C@H](C)Oc3ccccn3)C2)c1	ZINC000450566369	DG	On-Demand	Anodyne	MGEA5	23	41
Cc1cccc([C@@H]2CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)c1	ZINC000450566379	DG	On-Demand	Anodyne	MGEA5	23	41
Cc1cccc([C@H]2CCN(C(=O)[C@H](C)Oc3ccccn3)C2)c1	ZINC000450566381	DG	On-Demand	Anodyne	MGEA5	23	41
Cc1cccc([C@H]2CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)c1	ZINC000450566383	DG	On-Demand	Anodyne	MGEA5	23	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000450566406	EG	On-Demand	Mild	PTAFR	47	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000450566415	EG	On-Demand	Mild	PTAFR	47	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000450566418	EG	On-Demand	Mild	PTAFR	47	47
CCCc1c(NC(=O)Cc2cn(C)nc2C)cnn1-c1cccc(F)c1	ZINC000450566421	FG	On-Demand	Anodyne	P2RX7	21	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000450566422	EG	On-Demand	Mild	PTAFR	47	47
Cc1nn(C)cc1CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566466	FG	On-Demand	Anodyne	CACNA1B	48	36
Cc1nn(C)cc1CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566466	FG	On-Demand	Anodyne	CCR2	53	43
Cc1nn(C)cc1CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566466	FG	On-Demand	Anodyne	RBP4	17	40
Cc1nn(C)cc1CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566466	FG	On-Demand	Anodyne	LIPG	41	30
Cc1nn(C)cc1CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566470	FG	On-Demand	Anodyne	CACNA1B	48	36
Cc1nn(C)cc1CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566470	FG	On-Demand	Anodyne	CCR2	53	43
Cc1nn(C)cc1CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566470	FG	On-Demand	Anodyne	RBP4	17	40
Cc1nn(C)cc1CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566470	FG	On-Demand	Anodyne	LIPG	41	30
C[C@H](CN1CCN([C@H](C#N)c2ccccc2)CC1)S(C)(=O)=O	ZINC000450566477	DD	On-Demand	Mild	PTAFR	23	45
C[C@@H](CN1CCN([C@H](C#N)c2ccccc2)CC1)S(C)(=O)=O	ZINC000450566482	DD	On-Demand	Mild	PTAFR	23	45
C[C@@H](CN1CCN([C@@H](C#N)c2ccccc2)CC1)S(C)(=O)=O	ZINC000450566483	DD	On-Demand	Mild	PTAFR	23	45
C[C@H](CN1CCN([C@@H](C#N)c2ccccc2)CC1)S(C)(=O)=O	ZINC000450566484	DD	On-Demand	Mild	PTAFR	23	45
C(=C\c1ccccc1)\CCN1CCC[C@H](c2ncc[nH]2)C1	ZINC000450566495	CH	On-Demand	Anodyne	SLC6A1	70	37
C(=C\c1ccccc1)\CCN1CCC[C@@H](c2ncc[nH]2)C1	ZINC000450566496	CH	On-Demand	Anodyne	SLC6A1	70	37
C(=C/c1ccccc1)\CCN1CCC[C@@H](c2ncc[nH]2)C1	ZINC000450566497	CH	On-Demand	Anodyne	SLC6A1	70	37
C(=C/c1ccccc1)\CCN1CCC[C@H](c2ncc[nH]2)C1	ZINC000450566500	CH	On-Demand	Anodyne	SLC6A1	70	37
COc1ccc(C2(CNC(=O)[C@@H]3CC34CCSCC4)CCC2)cc1	ZINC000450566520	EH	On-Demand	Anodyne	KCNA3	41	35
COc1ccc(C2(CNC(=O)[C@@H]3CC34CCSCC4)CCC2)cc1	ZINC000450566520	EH	On-Demand	Anodyne	MTNR1A	22	42
COc1ccc(C2(CNC(=O)[C@@H]3CC34CCSCC4)CCC2)cc1	ZINC000450566520	EH	On-Demand	Anodyne	ACAT	0	50
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450566526	FF	On-Demand	Bother	CCR5	27	44
COc1ccc(C2(CNC(=O)[C@H]3CC34CCSCC4)CCC2)cc1	ZINC000450566527	EH	On-Demand	Anodyne	KCNA3	41	35
COc1ccc(C2(CNC(=O)[C@H]3CC34CCSCC4)CCC2)cc1	ZINC000450566527	EH	On-Demand	Anodyne	MTNR1A	22	42
COc1ccc(C2(CNC(=O)[C@H]3CC34CCSCC4)CCC2)cc1	ZINC000450566527	EH	On-Demand	Anodyne	ACAT	0	50
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450566528	FF	On-Demand	Bother	CCR5	27	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450566530	FF	On-Demand	Bother	CCR5	27	44
O=C(c1ccnc(OC(F)F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566531	GI	On-Demand	Anodyne	SLC9A1	40	36
O=C(c1ccnc(OC(F)F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566531	GI	On-Demand	Anodyne	CCR2	49	39
O=C(c1ccnc(OC(F)F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566531	GI	On-Demand	Anodyne	RBP4	21	46
O=C(c1ccnc(OC(F)F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566531	GI	On-Demand	Anodyne	RHOA	0	40
O=C(c1ccnc(OC(F)F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566531	GI	On-Demand	Anodyne	HPGD	21	40
O=C(c1ccnc(OC(F)F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566531	GI	On-Demand	Anodyne	MAP3K12	39	42
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450566532	FF	On-Demand	Bother	CCR5	27	44
O=C(c1ccnc(OC(F)F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566540	GI	On-Demand	Anodyne	SLC9A1	40	36
O=C(c1ccnc(OC(F)F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566540	GI	On-Demand	Anodyne	CCR2	49	39
O=C(c1ccnc(OC(F)F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566540	GI	On-Demand	Anodyne	RBP4	21	46
O=C(c1ccnc(OC(F)F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566540	GI	On-Demand	Anodyne	RHOA	0	40
O=C(c1ccnc(OC(F)F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566540	GI	On-Demand	Anodyne	HPGD	21	40
O=C(c1ccnc(OC(F)F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566540	GI	On-Demand	Anodyne	MAP3K12	39	42
O=C(NCC[C@H]1CCOC1)c1cn(CCc2ccccc2)nn1	ZINC000450566541	DD	On-Demand	Anodyne	LGALS3	15	40
O=C(NCC[C@@H]1CCOC1)c1cn(CCc2ccccc2)nn1	ZINC000450566543	DD	On-Demand	Anodyne	LGALS3	15	40
CC[C@H](O)CC(=O)Nc1ccc2ccn(CCOC)c2c1	ZINC000450566557	CE	On-Demand	Anodyne	ADA	30	41
CC[C@H](O)CC(=O)Nc1ccc2ccn(CCOC)c2c1	ZINC000450566557	CE	On-Demand	Anodyne	ENPP1	55	32
CC[C@H](O)CC(=O)Nc1ccc2ccn(CCOC)c2c1	ZINC000450566557	CE	On-Demand	Anodyne	NAMPT	0	40
CC[C@@H](O)CC(=O)Nc1ccc2ccn(CCOC)c2c1	ZINC000450566558	CE	On-Demand	Anodyne	ADA	30	41
CC[C@@H](O)CC(=O)Nc1ccc2ccn(CCOC)c2c1	ZINC000450566558	CE	On-Demand	Anodyne	ENPP1	55	32
CC[C@@H](O)CC(=O)Nc1ccc2ccn(CCOC)c2c1	ZINC000450566558	CE	On-Demand	Anodyne	NAMPT	0	40
CCN(CC(=O)Nc1c(C)cccc1C)C[C@H](C)S(C)(=O)=O	ZINC000450566560	ED	On-Demand	Anodyne	ACAT	0	42
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566562	DH	On-Demand	Anodyne	ACE	42	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566562	DH	On-Demand	Anodyne	GHRHR	45	32
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566562	DH	On-Demand	Anodyne	GRIN2B	21	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566562	DH	On-Demand	Anodyne	CCR1	38	42
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566562	DH	On-Demand	Anodyne	AMY2	49	34
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566563	DH	On-Demand	Anodyne	ACE	42	38
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566563	DH	On-Demand	Anodyne	GHRHR	45	32
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566563	DH	On-Demand	Anodyne	GRIN2B	21	40
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566563	DH	On-Demand	Anodyne	CCR1	38	42
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450566563	DH	On-Demand	Anodyne	AMY2	49	34
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566566	DH	On-Demand	Anodyne	CHRM1	16	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566566	DH	On-Demand	Anodyne	ACE	50	41
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566566	DH	On-Demand	Anodyne	GHRHR	45	32
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566566	DH	On-Demand	Anodyne	CHRM3	18	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566566	DH	On-Demand	Anodyne	GRIN2B	21	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566566	DH	On-Demand	Anodyne	CCR1	38	42
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566566	DH	On-Demand	Anodyne	AMY2	49	34
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566567	DH	On-Demand	Anodyne	ACE	42	38
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566567	DH	On-Demand	Anodyne	GHRHR	45	32
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566567	DH	On-Demand	Anodyne	GRIN2B	21	40
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566567	DH	On-Demand	Anodyne	CCR1	38	42
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450566567	DH	On-Demand	Anodyne	AMY2	49	34
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566578	GJ	On-Demand	Anodyne	CACNA1B	59	41
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566578	GJ	On-Demand	Anodyne	SLC9A1	40	39
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566578	GJ	On-Demand	Anodyne	CCR2	59	41
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566578	GJ	On-Demand	Anodyne	RBP4	28	47
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566578	GJ	On-Demand	Anodyne	SFRP1	52	35
CCN(CC(=O)Nc1c(C)cccc1C)C[C@@H](C)S(C)(=O)=O	ZINC000450566579	ED	On-Demand	Anodyne	ACAT	0	42
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566582	GJ	On-Demand	Anodyne	CACNA1B	59	41
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566582	GJ	On-Demand	Anodyne	SLC9A1	40	39
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566582	GJ	On-Demand	Anodyne	CCR2	59	41
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566582	GJ	On-Demand	Anodyne	RBP4	28	47
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450566582	GJ	On-Demand	Anodyne	SFRP1	52	35
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CC34CCSCC4)C2)c1	ZINC000450566584	DH	On-Demand	Anodyne	ADAM10	18	45
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CC34CCSCC4)C2)c1	ZINC000450566584	DH	On-Demand	Anodyne	MGEA5	15	41
COC(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1Cl	ZINC000450566587	FF	On-Demand	Anodyne	UL54	71	35
COC(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1Cl	ZINC000450566587	FF	On-Demand	Anodyne	NCE103	22	47
COC(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1Cl	ZINC000450566587	FF	On-Demand	Anodyne	CAN2	0	47
COC(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1Cl	ZINC000450566587	FF	On-Demand	Anodyne	PDS	42	35
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450566588	GH	On-Demand	Anodyne	TACR3	55	31
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450566588	GH	On-Demand	Anodyne	MAPK1	30	41
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450566588	GH	On-Demand	Anodyne	EPHX2	25	50
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450566588	GH	On-Demand	Anodyne	TYK2	46	38
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566590	GF	On-Demand	Bother	SSTR2	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566590	GF	On-Demand	Bother	SSTR1	24	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566590	GF	On-Demand	Bother	MGLL	0	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566590	GF	On-Demand	Bother	ABHD6	0	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566590	GF	On-Demand	Bother	KCNJ1	27	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566592	GF	On-Demand	Bother	SSTR2	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566592	GF	On-Demand	Bother	SSTR1	24	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566592	GF	On-Demand	Bother	MGLL	0	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566592	GF	On-Demand	Bother	ABHD6	0	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566592	GF	On-Demand	Bother	KCNJ1	27	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566594	GF	On-Demand	Bother	SSTR2	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566594	GF	On-Demand	Bother	SSTR1	24	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566594	GF	On-Demand	Bother	MGLL	0	43
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566594	GF	On-Demand	Bother	ABHD6	0	43
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566594	GF	On-Demand	Bother	KCNJ1	27	42
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CC34CCSCC4)C2)c1	ZINC000450566595	DH	On-Demand	Anodyne	LIPE	15	40
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CC34CCSCC4)C2)c1	ZINC000450566595	DH	On-Demand	Anodyne	ADAM10	21	45
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CC34CCSCC4)C2)c1	ZINC000450566595	DH	On-Demand	Anodyne	MGEA5	15	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566596	GF	On-Demand	Bother	SSTR2	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566596	GF	On-Demand	Bother	SSTR1	24	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566596	GF	On-Demand	Bother	MGLL	0	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566596	GF	On-Demand	Bother	ABHD6	0	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450566596	GF	On-Demand	Bother	KCNJ1	27	42
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3CC34CCSCC4)C2)c1	ZINC000450566597	DH	On-Demand	Anodyne	LIPE	15	40
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3CC34CCSCC4)C2)c1	ZINC000450566597	DH	On-Demand	Anodyne	ADAM10	21	45
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3CC34CCSCC4)C2)c1	ZINC000450566597	DH	On-Demand	Anodyne	MGEA5	15	41
CCNS(=O)(=O)c1ccc2c(c1)N(C[C@H]1CCNC(=O)CC1)CC2	ZINC000450566602	FD	On-Demand	Anodyne	PNMT	16	42
CCNS(=O)(=O)c1ccc2c(c1)N(C[C@@H]1CCNC(=O)CC1)CC2	ZINC000450566604	FD	On-Demand	Anodyne	PNMT	16	42
COc1cccc(OCCC(=O)N2CC[C@H](C)C3(CCC3)C2)c1	ZINC000450566628	DH	On-Demand	Anodyne	MTNR1A	16	40
COc1cccc(OCCC(=O)N2CC[C@H](C)C3(CCC3)C2)c1	ZINC000450566628	DH	On-Demand	Anodyne	MTNR1B	23	40
COc1cccc(OCCC(=O)N2CC[C@H](C)C3(CCC3)C2)c1	ZINC000450566628	DH	On-Demand	Anodyne	CHRNA10	19	41
COc1cccc(OCCC(=O)N2CC[C@@H](C)C3(CCC3)C2)c1	ZINC000450566629	DH	On-Demand	Anodyne	MTNR1A	15	40
C[C@@H](CN1CCN(c2ccc3ccccc3n2)CC1)S(C)(=O)=O	ZINC000450566630	ED	On-Demand	Anodyne	HTR3A	40	56
C[C@H](CN1CCN(c2ccc3ccccc3n2)CC1)S(C)(=O)=O	ZINC000450566631	ED	On-Demand	Anodyne	HTR3A	40	56
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450566633	FE	On-Demand	Bother	MGLL	0	40
Cc1cncc(-c2nc(CN(C)CC(=O)NCc3ccccc3)no2)c1	ZINC000450566636	FE	On-Demand	Anodyne	UL54	41	30
COC(=O)C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450566652	GE	On-Demand	Anodyne	CA2	16	46
COC(=O)C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450566652	GE	On-Demand	Anodyne	SLC6A9	17	40
COC(=O)C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450566652	GE	On-Demand	Anodyne	HCN1	51	32
COC(=O)C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450566652	GE	On-Demand	Anodyne	HCN4	49	32
Cc1c(Nc2nc(O)c3cnn(-c4ccccc4)c3n2)cnn1C1CCOCC1	ZINC000450566671	GF	On-Demand	Anodyne	PDE1C	30	40
O[C@H](Cc1ccccc1)CN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450566674	FH	On-Demand	Anodyne	PRCP	23	48
O[C@H](Cc1ccccc1)CN1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450566674	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
O[C@H](Cc1ccccc1)CN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450566675	FH	On-Demand	Anodyne	PRCP	23	48
O[C@H](Cc1ccccc1)CN1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000450566675	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
O=C(CCCN1CCNC(=O)[C@@H]1c1cccs1)c1ccc(F)cc1	ZINC000450566676	EG	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1CCNC(=O)[C@@H]1c1cccs1)c1ccc(F)cc1	ZINC000450566676	EG	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCNC(=O)[C@@H]1c1cccs1)c1ccc(F)cc1	ZINC000450566676	EG	On-Demand	Anodyne	CYP2J2	45	31
O=C(CCCN1CCNC(=O)[C@H]1c1cccs1)c1ccc(F)cc1	ZINC000450566677	EG	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1CCNC(=O)[C@H]1c1cccs1)c1ccc(F)cc1	ZINC000450566677	EG	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCNC(=O)[C@H]1c1cccs1)c1ccc(F)cc1	ZINC000450566677	EG	On-Demand	Anodyne	CYP2J2	45	31
COC(=O)C1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450566690	GF	On-Demand	Anodyne	HCN1	53	33
COC(=O)C1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450566690	GF	On-Demand	Anodyne	HCN4	50	32
COC(=O)C1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450566690	GF	On-Demand	Anodyne	PDEC	0	41
COC(=O)C1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450566691	GF	On-Demand	Anodyne	HCN1	53	33
COC(=O)C1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450566691	GF	On-Demand	Anodyne	HCN4	50	32
COC(=O)C1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450566691	GF	On-Demand	Anodyne	PDEC	0	41
C[C@@H](CCNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1)N1CCCCC1	ZINC000450566703	GG	On-Demand	Anodyne	CCR5	26	43
C[C@H](CCNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1)N1CCCCC1	ZINC000450566704	GG	On-Demand	Anodyne	CCR5	26	43
CN(CC1(C#N)CCC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450566706	DF	On-Demand	Mild	L3MBTL1	0	43
CN(CC1(C#N)CCC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450566706	DF	On-Demand	Mild	L3MBTL3	69	43
C[C@H](CCO)CCNc1nc2ccccc2nc1N1CCCC1	ZINC000450566713	DG	On-Demand	Anodyne	HTR3A	15	41
C[C@@H](CCO)CCNc1nc2ccccc2nc1N1CCCC1	ZINC000450566714	DG	On-Demand	Anodyne	HTR3A	15	41
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566716	GE	On-Demand	Anodyne	CCR3	21	42
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566716	GE	On-Demand	Anodyne	EPHX2	23	40
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566716	GE	On-Demand	Anodyne	ERBB4	40	35
COCCOC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566716	GE	On-Demand	Anodyne	MCHR1	34	40
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566721	GE	On-Demand	Anodyne	CCR3	21	42
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566721	GE	On-Demand	Anodyne	EPHX2	23	40
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566721	GE	On-Demand	Anodyne	ERBB4	40	35
COCCOC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450566721	GE	On-Demand	Anodyne	MCHR1	34	40
O=C(NCC(=O)C1CC1)c1cc2ccncc2s1	ZINC000450566727	CE	On-Demand	Anodyne	NAMPT	18	43
COc1ccccc1-n1cnc2cc(C(=O)NCC(=O)C3CC3)ccc21	ZINC000450566730	EF	On-Demand	Anodyne	DRD1	0	40
COc1ccccc1-n1cnc2cc(C(=O)NCC(=O)C3CC3)ccc21	ZINC000450566730	EF	On-Demand	Anodyne	PDGFRB	0	45
CCC[C@H](OC)C(=O)NCCCc1ccc(Br)cc1OC	ZINC000450566762	FG	On-Demand	Anodyne	MTNR1A	34	40
CCC[C@H](OC)C(=O)NCCCc1ccc(Br)cc1OC	ZINC000450566762	FG	On-Demand	Anodyne	MTNR1B	34	41
CCC[C@@H](OC)C(=O)NCCCc1ccc(Br)cc1OC	ZINC000450566763	FG	On-Demand	Anodyne	MTNR1A	34	40
CCC[C@@H](OC)C(=O)NCCCc1ccc(Br)cc1OC	ZINC000450566763	FG	On-Demand	Anodyne	MTNR1B	34	41
C[C@@H](O)CCN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450566765	CD	On-Demand	Anodyne	MAP	0	41
C[C@H](O)CCN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450566766	CD	On-Demand	Anodyne	MAP	0	41
C[C@H](O)CCN1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000450566767	CD	On-Demand	Anodyne	MAP	0	41
C[C@@H](O)CCN1CCC[C@H]1C(=O)Nc1nccs1	ZINC000450566768	CD	On-Demand	Anodyne	MAP	0	41
CCOC(=O)[C@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC12COC2	ZINC000450566775	FF	On-Demand	Bother	LIPG	40	36
CCOC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC12COC2	ZINC000450566776	FF	On-Demand	Bother	LIPG	40	36
CN(CCc1ccccc1O)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450566801	GF	On-Demand	Mild	PGR	26	42
CN(CCc1ccccc1O)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450566802	GF	On-Demand	Mild	PGR	26	42
COc1cc(CC(=O)NCC(=O)C2CC2)ccc1Cl	ZINC000450566807	CD	On-Demand	Anodyne	CAN2	0	47
CCc1ccc(S(C)(=O)=O)cc1C(=O)N[C@@H](CO)c1cccc(F)c1	ZINC000450566810	FE	On-Demand	Anodyne	PTGER3	62	42
CCc1ccc(S(C)(=O)=O)cc1C(=O)N[C@H](CO)c1cccc(F)c1	ZINC000450566814	FE	On-Demand	Anodyne	PTGER3	62	42
O=C1CCC(CN(CC(=O)Nc2ccc(Cl)cc2)Cc2cccnc2)CC1	ZINC000450566827	GH	On-Demand	Anodyne	CHRNA7	34	41
O=C1CCC(CN(CC(=O)Nc2ccc(Cl)cc2)Cc2cccnc2)CC1	ZINC000450566827	GH	On-Demand	Anodyne	NAMPT	49	43
O=C1CCC(CN(CC(=O)Nc2ccc(Cl)cc2)Cc2cccnc2)CC1	ZINC000450566827	GH	On-Demand	Anodyne	NR1D1	56	39
O=C(NCC(=O)C1CC1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450566829	EF	On-Demand	Anodyne	PYGL	71	43
COc1cccc(-n2cc(C(=O)N(C)C[C@H]3CC=CCC3)nn2)c1	ZINC000450566832	EF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(-n2cc(C(=O)N(C)C[C@@H]3CC=CCC3)nn2)c1	ZINC000450566833	EF	On-Demand	Anodyne	DRD4	40	31
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	ABL1	53	43
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	HTR2A	15	40
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	KIT	15	41
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	CNR2	0	46
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	IKBKB	52	34
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	ABL2	46	33
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	EPHX2	26	40
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	CSF1R	46	40
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)ncc1C(N)=O	ZINC000450566845	GE	On-Demand	Anodyne	STAT6	63	41
COc1ccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)O)nc2)cc1	ZINC000450566848	EG	On-Demand	Anodyne	NPBWR1	50	38
CCc1cc(NC[C@@H]2CSc3ccccc32)n2ncnc2n1	ZINC000450566849	DF	On-Demand	Anodyne	DHOD	0	53
CCc1cc(NC[C@H]2CSc3ccccc32)n2ncnc2n1	ZINC000450566850	DF	On-Demand	Anodyne	DHOD	0	53
O=C(CC1(O)CCC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450566874	FF	On-Demand	Anodyne	HTR1A	0	44
O=C(CC1(O)CCC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450566874	FF	On-Demand	Anodyne	ACHE	30	40
O=C(CC1(O)CCC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450566874	FF	On-Demand	Anodyne	HTR1D	40	44
O=C(CC1(O)CCC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450566874	FF	On-Demand	Anodyne	HTR1B	38	42
O=C(CC1(O)CCC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450566874	FF	On-Demand	Anodyne	MPO	75	40
CCC(=O)C1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CC1	ZINC000450566885	FG	On-Demand	Anodyne	HTR1A	0	44
CCC(=O)C1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CC1	ZINC000450566885	FG	On-Demand	Anodyne	HTR1D	53	40
CCC(=O)C1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CC1	ZINC000450566885	FG	On-Demand	Anodyne	HTR1B	35	44
CCC(=O)C1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CC1	ZINC000450566885	FG	On-Demand	Anodyne	MPO	78	40
CCC(=O)C1(C(=O)NCCc2c[nH]c3ccc(Br)cc23)CC1	ZINC000450566885	FG	On-Demand	Anodyne	ABCG2	24	40
CCS(=O)(=O)c1ccc(CN[C@H](C(N)=O)C(C)(C)C)cc1	ZINC000450566889	DD	On-Demand	Anodyne	CA2	27	43
CCS(=O)(=O)c1ccc(CN[C@@H](C(N)=O)C(C)(C)C)cc1	ZINC000450566890	DD	On-Demand	Anodyne	CA2	27	43
COc1cc(CC(=O)Nc2ncn(C3CCCCC3)n2)ccc1Cl	ZINC000450566893	EH	On-Demand	Anodyne	OPRK1	20	40
CC(C)C[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566919	FD	On-Demand	Anodyne	MAP	0	40
CC(C)C[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566919	FD	On-Demand	Anodyne	ADAM17	0	56
CC(C)C[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566919	FD	On-Demand	Anodyne	MAP1	115	40
CC(C)C[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566919	FD	On-Demand	Anodyne	MMP3	0	41
CC(C)C[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566919	FD	On-Demand	Anodyne	MMP9	0	56
CC(C)C[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566919	FD	On-Demand	Anodyne	MMP1	0	56
CC(C)C[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566919	FD	On-Demand	Anodyne	GCK	42	51
CC(C)C[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566919	FD	On-Demand	Anodyne	HPN	50	33
CC(C)C[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566920	FD	On-Demand	Anodyne	MAP	0	40
CC(C)C[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566920	FD	On-Demand	Anodyne	ADAM17	0	56
CC(C)C[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566920	FD	On-Demand	Anodyne	MAP1	115	40
CC(C)C[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566920	FD	On-Demand	Anodyne	MMP3	0	41
CC(C)C[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566920	FD	On-Demand	Anodyne	MMP9	0	56
CC(C)C[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566920	FD	On-Demand	Anodyne	MMP1	0	56
CC(C)C[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566920	FD	On-Demand	Anodyne	GCK	42	51
CC(C)C[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)Nc1nccs1	ZINC000450566920	FD	On-Demand	Anodyne	HPN	50	33
N#C[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450566943	CE	On-Demand	Mild	DRD2	28	40
N#C[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450566943	CE	On-Demand	Mild	CYP2J2	47	33
Cc1cccc([C@@H]2CCN(C(=O)[C@@H]3CC34CCSCC4)C2)c1	ZINC000450566945	DH	On-Demand	Anodyne	ADAM10	18	45
Cc1cccc([C@@H]2CCN(C(=O)[C@@H]3CC34CCSCC4)C2)c1	ZINC000450566945	DH	On-Demand	Anodyne	MGEA5	15	41
CO[C@@H](Cc1ccccc1)CN1CCC(Oc2ccccn2)CC1	ZINC000450566948	EG	On-Demand	Anodyne	SCN9A	0	42
CO[C@@H](Cc1ccccc1)CN1CCC(Oc2ccccn2)CC1	ZINC000450566948	EG	On-Demand	Anodyne	SCN5A	37	42
CO[C@H](Cc1ccccc1)CN1CCC(Oc2ccccn2)CC1	ZINC000450566949	EG	On-Demand	Anodyne	SCN9A	0	42
CO[C@H](Cc1ccccc1)CN1CCC(Oc2ccccn2)CC1	ZINC000450566949	EG	On-Demand	Anodyne	SCN5A	37	42
C=C[C@@H]1OCC[C@H]1C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450566952	DF	On-Demand	Mild	MTNR1A	19	41
C=C[C@@H]1OCC[C@H]1C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450566952	DF	On-Demand	Mild	ACAT	0	44
C[C@H](NC(=O)CC1(O)CCC1)c1ccc(CNC(=O)CC2(O)CCC2)cc1	ZINC000450566961	FE	On-Demand	Anodyne	SDH1	0	40
C[C@@H](NC(=O)CC1(O)CCC1)c1ccc(CNC(=O)CC2(O)CCC2)cc1	ZINC000450566962	FE	On-Demand	Anodyne	SDH1	0	40
N#C[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450566977	CE	On-Demand	Mild	DRD2	28	40
N#C[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450566977	CE	On-Demand	Mild	CYP2J2	47	33
CCOC(=O)COc1ccc(NC(=O)c2scnc2C(C)C)cc1	ZINC000450566979	EG	On-Demand	Anodyne	P4HTM	0	44
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566980	FG	On-Demand	Anodyne	ACE	24	41
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566980	FG	On-Demand	Anodyne	CTSK	15	41
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566980	FG	On-Demand	Anodyne	CTSL	21	41
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566980	FG	On-Demand	Anodyne	APP	17	44
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566980	FG	On-Demand	Anodyne	MMP1	29	48
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566980	FG	On-Demand	Anodyne	BIRC2	60	44
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566980	FG	On-Demand	Anodyne	BIRC8	41	35
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566981	FG	On-Demand	Anodyne	ACE	24	41
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566981	FG	On-Demand	Anodyne	CTSK	15	41
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566981	FG	On-Demand	Anodyne	CTSL	21	41
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566981	FG	On-Demand	Anodyne	APP	17	44
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566981	FG	On-Demand	Anodyne	MMP1	29	48
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566981	FG	On-Demand	Anodyne	BIRC2	60	44
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450566981	FG	On-Demand	Anodyne	BIRC8	41	35
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	HTR1A	103	42
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	DRD2	76	43
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	DRD4	40	43
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	ADRA1D	78	49
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	ADRA1A	72	49
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	ADRA1B	52	40
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	DRD3	77	43
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	HTR7	60	40
COC(=O)C1(CN2CCN(c3ccccc3OCCN(C)C)CC2)CC1	ZINC000450566985	FD	On-Demand	Anodyne	AP2S1	0	43
COC(=O)C1(CN2CCc3ccc(O)cc3C2)CC1	ZINC000450567006	CD	On-Demand	Anodyne	ABCB1	15	40
COC(=O)C1(CN2CCc3ccc(O)cc3C2)CC1	ZINC000450567006	CD	On-Demand	Anodyne	SLC6A5	25	41
COc1ccc(C2(CNC(=O)c3ccc(-c4cnn(C)c4)o3)CCC2)cc1	ZINC000450567022	FH	On-Demand	Anodyne	MTNR1A	20	44
COc1ccc(C2(CNC(=O)c3ccc(-c4cnn(C)c4)o3)CCC2)cc1	ZINC000450567022	FH	On-Demand	Anodyne	ACAT	0	45
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)C2)c1	ZINC000450567027	EF	On-Demand	Anodyne	FASN	40	34
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cc(C)c(C(N)=O)cn3)C2)c1	ZINC000450567031	EF	On-Demand	Anodyne	FASN	40	34
CCc1cccc(C(=O)NCCCNc2ccccc2F)n1	ZINC000450567058	DG	On-Demand	Anodyne	PDE5A	20	40
O=C1CC[C@@H](CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CCN1	ZINC000450567074	GH	On-Demand	Anodyne	TYK2	53	39
O=C1CC[C@@H](CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CCN1	ZINC000450567074	GH	On-Demand	Anodyne	MCHR1	15	41
O=C1CC[C@H](CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CCN1	ZINC000450567076	GH	On-Demand	Anodyne	TYK2	53	39
O=C1CC[C@H](CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CCN1	ZINC000450567076	GH	On-Demand	Anodyne	MCHR1	15	41
COC(=O)c1coc(CN2CCC(Oc3ccccn3)CC2)n1	ZINC000450567082	DD	On-Demand	Anodyne	SCN5A	54	34
CN(CCN1CCNC(=O)[C@@H]1c1ccccc1)Cc1ccccc1	ZINC000450567097	DE	On-Demand	Anodyne	SIGMAR1	15	53
CN(CCN1CCNC(=O)[C@H]1c1ccccc1)Cc1ccccc1	ZINC000450567099	DE	On-Demand	Anodyne	SIGMAR1	15	53
COC(=O)c1csc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)n1	ZINC000450567101	GD	On-Demand	Anodyne	TRPC6	47	36
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc1	ZINC000450567103	FF	On-Demand	Anodyne	SIGMAR1	30	48
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc1	ZINC000450567103	FF	On-Demand	Anodyne	SSTR5	42	35
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc1	ZINC000450567103	FF	On-Demand	Anodyne	MCHR1	38	40
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc1	ZINC000450567103	FF	On-Demand	Anodyne	ADIPOR1	0	45
CC(=O)c1ccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)cc1	ZINC000450567103	FF	On-Demand	Anodyne	ADIPOR2	0	45
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	CACNA1B	57	40
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	SLC9A1	49	42
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	CCR2	66	40
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	RBP4	23	48
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	SFRP1	71	42
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	WNT3	50	33
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	HPGD	38	41
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	MAP3K12	39	42
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567168	GJ	On-Demand	Anodyne	SLC6A7	0	42
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(F)F	ZINC000450567169	GE	On-Demand	Bother	BCL2L1	81	33
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(F)F	ZINC000450567169	GE	On-Demand	Bother	BCL2	57	37
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	CACNA1B	57	40
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	SLC9A1	49	42
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	CCR2	66	40
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	RBP4	23	48
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	SFRP1	71	42
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	WNT3	50	33
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	HPGD	38	41
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	MAP3K12	39	42
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cn1	ZINC000450567170	GJ	On-Demand	Anodyne	SLC6A7	0	42
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(F)F	ZINC000450567171	GE	On-Demand	Bother	BCL2L1	81	33
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(F)F	ZINC000450567171	GE	On-Demand	Bother	BCL2	57	37
O=C(Cc1ccc(OC(F)F)c(F)c1)NCC[C@H]1CCOC1	ZINC000450567185	DF	On-Demand	Anodyne	PDEC	0	43
O=C(Cc1ccc(OC(F)F)c(F)c1)NCC[C@@H]1CCOC1	ZINC000450567186	DF	On-Demand	Anodyne	PDEC	0	43
Cc1ccc(NC(=O)CCCC(=O)C(C)(C)C)cc1-c1nnnn1C1CC1	ZINC000450567202	FH	On-Demand	Anodyne	LDLR	0	41
c1cnc2[nH]cc(C3CCN(Cc4cn(CC5CC5)nn4)CC3)c2c1	ZINC000450567221	EF	On-Demand	Anodyne	CCR2	0	47
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@H]3CCOC3)CCC2)cc1	ZINC000450567232	GH	On-Demand	Anodyne	KCNA3	54	45
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@H]3CCOC3)CCC2)cc1	ZINC000450567232	GH	On-Demand	Anodyne	MTNR1A	22	40
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@H]3CCOC3)CCC2)cc1	ZINC000450567232	GH	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@H]3CCOC3)CCC2)cc1	ZINC000450567232	GH	On-Demand	Anodyne	ACAT	0	45
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@H]3CCOC3)CCC2)cc1	ZINC000450567232	GH	On-Demand	Anodyne	PDEC	0	42
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@@H]3CCOC3)CCC2)cc1	ZINC000450567236	GH	On-Demand	Anodyne	KCNA3	54	45
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@@H]3CCOC3)CCC2)cc1	ZINC000450567236	GH	On-Demand	Anodyne	MTNR1A	22	40
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@@H]3CCOC3)CCC2)cc1	ZINC000450567236	GH	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@@H]3CCOC3)CCC2)cc1	ZINC000450567236	GH	On-Demand	Anodyne	ACAT	0	45
COc1ccc(C2(CNC(=O)Cc3ccccc3O[C@@H]3CCOC3)CCC2)cc1	ZINC000450567236	GH	On-Demand	Anodyne	PDEC	0	42
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)Cc1nnc(C(C)C)s1	ZINC000450567249	GG	On-Demand	Anodyne	SCD1	38	42
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)Cc1nnc(C(C)C)s1	ZINC000450567249	GG	On-Demand	Anodyne	SCD	26	42
CCn1c(SCCC(=O)NC(=O)NCCC(F)(F)F)nc2ccccc21	ZINC000450567255	GG	On-Demand	Anodyne	PTGDR2	17	44
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	DRD4	27	45
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	DRD3	0	45
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	HTR4	43	35
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	F10	41	32
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	SSTR5	77	51
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	CCR3	31	41
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	UTS2R	28	40
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	CCR2	18	44
COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567263	FG	On-Demand	Bother	MCHR1	25	43
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	GRIN2B	36	41
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	PTAFR	24	42
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	CCKAR	0	41
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	NPY2R	40	37
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	CCR3	87	43
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	CHRNA7	53	47
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	C3AR1	52	46
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	EPHX2	28	49
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	ST14	49	36
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	MCHR1	20	40
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	SCD	19	40
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	ACHP_LYMST	25	44
O=C(NCC(=O)N1CCC(Cc2cccnc2)CC1)Nc1cccc(Cl)c1	ZINC000450567267	GG	On-Demand	Anodyne	NAMPT	57	42
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	DRD4	27	45
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	DRD3	0	45
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	HTR4	43	35
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	F10	41	32
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	SSTR5	77	51
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	CCR3	31	41
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	UTS2R	28	40
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	CCR2	18	44
COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl	ZINC000450567269	FG	On-Demand	Bother	MCHR1	25	43
CC(C)N1CCCC[C@@H]1CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567270	EI	On-Demand	Anodyne	CCR2	22	45
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450567271	GH	On-Demand	Anodyne	TRPV1	15	40
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450567271	GH	On-Demand	Anodyne	SIGMAR1	16	41
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450567271	GH	On-Demand	Anodyne	GRM4	45	43
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450567271	GH	On-Demand	Anodyne	MAPK1	32	45
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450567271	GH	On-Demand	Anodyne	EPHX2	21	46
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450567271	GH	On-Demand	Anodyne	TYK2	63	40
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450567271	GH	On-Demand	Anodyne	CXCR3	20	40
Nc1ncccc1CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450567271	GH	On-Demand	Anodyne	MCHR1	28	41
CC(C)N1CCCC[C@H]1CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567272	EI	On-Demand	Anodyne	CCR2	22	45
CC(=O)CCCCCN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450567278	EF	On-Demand	Bother	SLC27A4	51	34
CC(=O)CCCCCN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450567280	EF	On-Demand	Bother	SLC27A4	51	34
COC(=O)c1ccc2c(c1)CN(C(=O)CCOc1cccc(OC)c1)CC2	ZINC000450567281	FF	On-Demand	Anodyne	DRD4	46	35
COC(=O)c1ccc2c(c1)CN(C(=O)CCOc1cccc(OC)c1)CC2	ZINC000450567281	FF	On-Demand	Anodyne	MTNR1A	22	41
COC(=O)c1ccc2c(c1)CN(C(=O)CCOc1cccc(OC)c1)CC2	ZINC000450567281	FF	On-Demand	Anodyne	HDAC6	38	45
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	HTR1A	59	59
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	DRD2	43	54
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	DRD4	26	43
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	HTR1D	38	45
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	HTR1B	34	45
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	HTR2A	46	52
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	HTR2C	19	43
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	DRD3	36	43
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	HTR7	51	44
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	SIGMAR1	35	52
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	CCR3	56	42
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	MCHR1	22	40
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@H](O)C1CCC1	ZINC000450567286	GG	On-Demand	Anodyne	BIRC2	62	41
COC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450567298	FG	On-Demand	Anodyne	TRPV1	22	41
COC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450567298	FG	On-Demand	Anodyne	NCE103	26	44
COC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450567298	FG	On-Demand	Anodyne	P96878_MYCTU	17	44
COC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450567298	FG	On-Demand	Anodyne	CAN2	0	44
Nc1nc(N[C@@H]2CCCc3c(F)cccc32)ncc1[N+](=O)[O-]	ZINC000450567306	DE	On-Demand	Bother	PRKCQ	46	44
COCCOC[C@H](O)CN1CCN(c2ncc(C)s2)CC1	ZINC000450567313	DC	On-Demand	Anodyne	ACOX1	72	32
COCCOC[C@H](O)CN1CCN(c2ncc(C)s2)CC1	ZINC000450567313	DC	On-Demand	Anodyne	ABCB1	43	33
COCCOC[C@H](O)CN1CCN(c2ncc(C)s2)CC1	ZINC000450567313	DC	On-Demand	Anodyne	HSP90AB1	42	44
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	HTR1A	59	59
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	DRD2	43	54
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	DRD4	26	43
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	HTR1D	38	45
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	HTR1B	34	45
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	HTR2A	46	52
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	HTR2C	19	43
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	DRD3	36	43
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	HTR7	51	44
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	SIGMAR1	35	52
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	CCR3	56	42
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	MCHR1	22	40
O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)[C@@H](O)C1CCC1	ZINC000450567316	GG	On-Demand	Anodyne	BIRC2	62	41
COCCOC[C@@H](O)CN1CCN(c2ncc(C)s2)CC1	ZINC000450567321	DC	On-Demand	Anodyne	ACOX1	72	32
COCCOC[C@@H](O)CN1CCN(c2ncc(C)s2)CC1	ZINC000450567321	DC	On-Demand	Anodyne	ABCB1	43	33
COCCOC[C@@H](O)CN1CCN(c2ncc(C)s2)CC1	ZINC000450567321	DC	On-Demand	Anodyne	HSP90AB1	42	44
Nc1nc(N[C@H]2CCCc3c(F)cccc32)ncc1[N+](=O)[O-]	ZINC000450567322	DE	On-Demand	Bother	PRKCQ	46	44
CC(=O)N[C@H](C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C(C)(C)C	ZINC000450567329	FH	On-Demand	Anodyne	CACNA1B	43	38
CC(=O)N[C@H](C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C(C)(C)C	ZINC000450567329	FH	On-Demand	Anodyne	CCR1	43	38
CC(=O)N[C@H](C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C(C)(C)C	ZINC000450567329	FH	On-Demand	Anodyne	CCR2	66	44
CC(=O)N[C@H](C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C(C)(C)C	ZINC000450567329	FH	On-Demand	Anodyne	MCHR1	18	42
CC(=O)N[C@H](C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C(C)(C)C	ZINC000450567332	FH	On-Demand	Anodyne	CACNA1B	43	38
CC(=O)N[C@H](C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C(C)(C)C	ZINC000450567332	FH	On-Demand	Anodyne	CCR1	43	38
CC(=O)N[C@H](C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C(C)(C)C	ZINC000450567332	FH	On-Demand	Anodyne	CCR2	66	44
CC(=O)N[C@H](C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C(C)(C)C	ZINC000450567332	FH	On-Demand	Anodyne	MCHR1	18	42
COc1ccccc1COC1CCN(C(=O)[C@]2(C)CCC[C@@H]2C)CC1	ZINC000450567334	EI	On-Demand	Anodyne	MBTPS1	50	34
C[C@@H]1C[C@H](CNC(=O)COc2c(Cl)cc(Cl)cc2Cl)CCO1	ZINC000450567335	FH	On-Demand	Anodyne	CACNA1I	43	32
C[C@H]1C[C@@H](CNC(=O)COc2c(Cl)cc(Cl)cc2Cl)CCO1	ZINC000450567336	FH	On-Demand	Anodyne	CACNA1I	43	32
COc1ccccc1COC1CCN(C(=O)[C@@]2(C)CCC[C@H]2C)CC1	ZINC000450567337	EI	On-Demand	Anodyne	MBTPS1	50	34
C[C@H]1C[C@H](CNC(=O)COc2c(Cl)cc(Cl)cc2Cl)CCO1	ZINC000450567338	FH	On-Demand	Anodyne	CACNA1I	43	32
COc1ccccc1COC1CCN(C(=O)[C@]2(C)CCC[C@H]2C)CC1	ZINC000450567339	EI	On-Demand	Anodyne	MBTPS1	50	34
C[C@@H]1C[C@@H](CNC(=O)COc2c(Cl)cc(Cl)cc2Cl)CCO1	ZINC000450567340	FH	On-Demand	Anodyne	CACNA1I	43	32
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)c1	ZINC000450567341	DH	On-Demand	Anodyne	SLC9A1	42	38
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)c1	ZINC000450567341	DH	On-Demand	Anodyne	HPGD	17	42
COc1ccccc1COC1CCN(C(=O)[C@@]2(C)CCC[C@@H]2C)CC1	ZINC000450567342	EI	On-Demand	Anodyne	MBTPS1	50	34
COC[C@@H](C)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450567344	CF	On-Demand	Anodyne	CHRM5	38	43
NS(=O)(=O)CCN1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450567348	EC	On-Demand	Anodyne	SIGMAR1	27	51
NS(=O)(=O)CCN1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450567348	EC	On-Demand	Anodyne	KCNJ1	42	45
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)c1	ZINC000450567355	DH	On-Demand	Anodyne	HRH4	15	41
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)c1	ZINC000450567355	DH	On-Demand	Anodyne	SLC9A1	42	38
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)c1	ZINC000450567355	DH	On-Demand	Anodyne	HPGD	17	42
C[C@H](CN(C)CC(=O)NCc1ccccc1)S(C)(=O)=O	ZINC000450567356	CC	On-Demand	Anodyne	ANPEP	26	41
C[C@H](CN(C)CC(=O)NCc1ccccc1)S(C)(=O)=O	ZINC000450567356	CC	On-Demand	Anodyne	AMP1_PLAFQ	42	39
C[C@H](CN(C)CC(=O)NCc1ccccc1)S(C)(=O)=O	ZINC000450567356	CC	On-Demand	Anodyne	RORC	25	46
C[C@H](CN(C)CC(=O)NCc1ccccc1)S(C)(=O)=O	ZINC000450567356	CC	On-Demand	Anodyne	PDS	40	32
C[C@@H](CN(C)CC(=O)NCc1ccccc1)S(C)(=O)=O	ZINC000450567360	CC	On-Demand	Anodyne	ANPEP	26	41
C[C@@H](CN(C)CC(=O)NCc1ccccc1)S(C)(=O)=O	ZINC000450567360	CC	On-Demand	Anodyne	AMP1_PLAFQ	42	39
C[C@@H](CN(C)CC(=O)NCc1ccccc1)S(C)(=O)=O	ZINC000450567360	CC	On-Demand	Anodyne	RORC	25	46
C[C@@H](CN(C)CC(=O)NCc1ccccc1)S(C)(=O)=O	ZINC000450567360	CC	On-Demand	Anodyne	PDS	40	32
CC(=O)c1ccc(CN2CCC[C@H]2c2ncc(-c3ccc(F)cc3)[nH]2)cc1	ZINC000450567366	FJ	On-Demand	Anodyne	PRCP	19	49
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cnc(C4CC4)nc3)C2)c1	ZINC000450567367	DH	On-Demand	Anodyne	L3MBTL3	42	34
CC(=O)c1ccc(CN2CCC[C@@H]2c2ncc(-c3ccc(F)cc3)[nH]2)cc1	ZINC000450567368	FJ	On-Demand	Anodyne	PRCP	19	49
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cnc(C4CC4)nc3)C2)c1	ZINC000450567369	DH	On-Demand	Anodyne	L3MBTL3	42	34
C[C@H](CCNC(=O)c1cc2cccnc2s1)N1CCCCC1	ZINC000450567370	DG	On-Demand	Anodyne	CCR5	19	41
C[C@H](CCNC(=O)c1cc2cccnc2s1)N1CCCCC1	ZINC000450567370	DG	On-Demand	Anodyne	SIRT3	40	33
C[C@H](CCNC(=O)c1cc2cccnc2s1)N1CCCCC1	ZINC000450567370	DG	On-Demand	Anodyne	SIRT2	44	33
C[C@H](CCNC(=O)c1cc2cccnc2s1)N1CCCCC1	ZINC000450567370	DG	On-Demand	Anodyne	SIRT1	40	33
C[C@@H](CCNC(=O)c1cc2cccnc2s1)N1CCCCC1	ZINC000450567372	DG	On-Demand	Anodyne	CCR5	19	41
C[C@@H](CCNC(=O)c1cc2cccnc2s1)N1CCCCC1	ZINC000450567372	DG	On-Demand	Anodyne	SIRT3	40	33
C[C@@H](CCNC(=O)c1cc2cccnc2s1)N1CCCCC1	ZINC000450567372	DG	On-Demand	Anodyne	SIRT2	44	33
C[C@@H](CCNC(=O)c1cc2cccnc2s1)N1CCCCC1	ZINC000450567372	DG	On-Demand	Anodyne	SIRT1	40	33
Cc1cc(C)cc([C@@H]2CCN(C(=O)Cc3ccccc3O[C@@H]3CCOC3)C2)c1	ZINC000450567376	GI	On-Demand	Anodyne	ADAM10	25	43
Cc1cc(C)cc([C@@H]2CCN(C(=O)Cc3ccccc3O[C@H]3CCOC3)C2)c1	ZINC000450567379	GI	On-Demand	Anodyne	ADAM10	25	43
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	PGR	0	45
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	AR	0	43
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	DRD2	31	47
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	DRD1	23	53
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	DRD4	22	47
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	HTR2A	32	53
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	HTR2C	24	53
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	ADRA1A	15	47
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	ADRA2B	0	47
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	ERG2	22	47
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	SIGMAR1	16	53
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	SLC18A3	0	47
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	HTR3B	0	45
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	MGLL	0	40
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	CYP2J2	50	35
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	ABHD6	0	40
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	KCNJ1	28	42
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000450567384	GG	On-Demand	Bother	AP2S1	0	47
N#Cc1ccc(OCC(=O)NCC2(CO)CCC2)cc1Br	ZINC000450567385	FD	On-Demand	Mild	TRPV4	41	31
COCCn1ccc2ccc(NC(=O)CCOc3cccc(OC)c3)cc21	ZINC000450567387	FH	On-Demand	Anodyne	ADA	42	46
COCCn1ccc2ccc(NC(=O)CCOc3cccc(OC)c3)cc21	ZINC000450567387	FH	On-Demand	Anodyne	MTNR1A	35	44
COCCn1ccc2ccc(NC(=O)CCOc3cccc(OC)c3)cc21	ZINC000450567387	FH	On-Demand	Anodyne	MTNR1B	29	43
COCCn1ccc2ccc(NC(=O)CCOc3cccc(OC)c3)cc21	ZINC000450567387	FH	On-Demand	Anodyne	ENPP1	49	30
COCCn1ccc2ccc(NC(=O)CCOc3cccc(OC)c3)cc21	ZINC000450567387	FH	On-Demand	Anodyne	NAMPT	0	41
COCCn1ccc2ccc(NC(=O)CCOc3cccc(OC)c3)cc21	ZINC000450567387	FH	On-Demand	Anodyne	BRPF1	0	42
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	HTR1A	83	44
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	DRD2	68	42
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	DRD4	27	41
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	ADRA1D	81	44
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	ADRA1A	75	44
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	ADRA1B	52	39
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	DRD3	57	41
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	HTR7	50	40
C[C@@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567404	FD	On-Demand	Anodyne	ABCB1	45	37
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	HTR1A	83	44
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	DRD2	68	42
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	DRD4	27	41
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	ADRA1D	81	44
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	ADRA1A	75	44
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	ADRA1B	52	39
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	DRD3	57	41
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	HTR7	50	40
C[C@H](CN1CCN(c2ccccc2OCCN(C)C)CC1)S(C)(=O)=O	ZINC000450567405	FD	On-Demand	Anodyne	ABCB1	45	37
COC(=O)C1(CNC(=O)Cc2ccc(O)c(F)c2)CCCCC1	ZINC000450567408	DE	On-Demand	Anodyne	CAN2	0	40
CCn1c(SCc2ccn(CC(F)(F)F)n2)nc2ccccc21	ZINC000450567426	EI	On-Demand	Anodyne	PTGDR2	17	40
COC(=O)c1cccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)c1Cl	ZINC000450567436	GG	On-Demand	Anodyne	MAP1	107	36
COC(=O)c1cccc(CN2CCC[C@H]2C(=O)Nc2nccs2)c1Cl	ZINC000450567437	GG	On-Demand	Anodyne	MAP1	107	36
COc1cc(Br)ccc1CCCNC(=O)c1cnc(C2CC2)nc1	ZINC000450567440	GG	On-Demand	Anodyne	MTNR1B	20	41
CC(=O)CCCCCn1cnc2scc(-c3ccc(F)cc3)c2c1=O	ZINC000450567448	FI	On-Demand	Anodyne	TGM2	18	42
OCCN(Cc1cn(CC2CC2)nn1)[C@H]1CCCc2ccccc21	ZINC000450567449	EF	On-Demand	Anodyne	CXCR4	45	40
OCCN(Cc1cn(CC2CC2)nn1)[C@@H]1CCCc2ccccc21	ZINC000450567450	EF	On-Demand	Anodyne	CXCR4	45	40
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CSc3ccccc32)c([N+](=O)[O-])c1	ZINC000450567458	GG	On-Demand	Bother	BDKRB1	23	43
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CSc3ccccc32)c([N+](=O)[O-])c1	ZINC000450567459	GG	On-Demand	Bother	BDKRB1	23	43
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000450567461	FG	On-Demand	Anodyne	EGFR	24	40
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000450567461	FG	On-Demand	Anodyne	MAPK1	29	40
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000450567461	FG	On-Demand	Anodyne	EPHX2	27	41
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000450567461	FG	On-Demand	Anodyne	ERBB4	49	33
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000450567461	FG	On-Demand	Anodyne	ENV	42	33
COC(=O)C1(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000450567461	FG	On-Demand	Anodyne	MCHR1	35	43
CCC[C@@H](O)CN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450567462	FG	On-Demand	Anodyne	GRIN1	0	44
CCC[C@@H](O)CN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450567462	FG	On-Demand	Anodyne	NAMPT	38	45
CCC[C@@H](O)CN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450567462	FG	On-Demand	Anodyne	NR1D1	46	39
CCC[C@H](O)CN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450567463	FG	On-Demand	Anodyne	GRIN1	0	44
CCC[C@H](O)CN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450567463	FG	On-Demand	Anodyne	NAMPT	38	45
CCC[C@H](O)CN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450567463	FG	On-Demand	Anodyne	NR1D1	46	39
COC(=O)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450567478	EF	On-Demand	Anodyne	GPR88	0	45
COC(=O)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450567480	EF	On-Demand	Anodyne	GPR88	0	45
CC(C)N1CCCC[C@H]1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450567481	FG	On-Demand	Anodyne	HRH3	0	42
CC(C)N1CCCC[C@H]1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450567481	FG	On-Demand	Anodyne	CCR5	23	41
CC(C)N1CCCC[C@H]1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450567481	FG	On-Demand	Anodyne	L3MBTL1	0	45
CC(C)N1CCCC[C@H]1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450567481	FG	On-Demand	Anodyne	L3MBTL3	81	45
COC(=O)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450567482	EF	On-Demand	Anodyne	GPR88	0	45
COC(=O)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450567483	EF	On-Demand	Anodyne	GPR88	0	45
CC(C)N1CCCC[C@@H]1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450567493	FG	On-Demand	Anodyne	HRH3	0	42
CC(C)N1CCCC[C@@H]1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450567493	FG	On-Demand	Anodyne	CCR5	23	41
CC(C)N1CCCC[C@@H]1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450567493	FG	On-Demand	Anodyne	L3MBTL1	0	45
CC(C)N1CCCC[C@@H]1CN(C)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450567493	FG	On-Demand	Anodyne	L3MBTL3	81	45
C[C@]1(F)CCCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450567502	CH	On-Demand	Anodyne	HNMT	40	31
C[C@]1(F)CCCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450567502	CH	On-Demand	Anodyne	HTT	0	44
C[C@@]1(F)CCCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450567503	CH	On-Demand	Anodyne	HNMT	40	31
C[C@@]1(F)CCCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450567503	CH	On-Demand	Anodyne	HTT	0	44
CCOC(=O)[C@@H]1CN(c2ncnc3scc(-c4ccccc4)c23)CC12COC2	ZINC000450567507	GG	On-Demand	Anodyne	ADRB2	16	43
CCOC(=O)[C@@H]1CN(c2ncnc3scc(-c4ccccc4)c23)CC12COC2	ZINC000450567507	GG	On-Demand	Anodyne	ADRB3	30	47
CCOc1nc2ccc(C(=O)Nc3ncn(C4CCCCC4)n3)cc2[nH]1	ZINC000450567509	FG	On-Demand	Anodyne	FTSZ	0	44
CCOC(=O)[C@H]1CN(c2ncnc3scc(-c4ccccc4)c23)CC12COC2	ZINC000450567511	GG	On-Demand	Anodyne	ADRB2	16	43
CCOC(=O)[C@H]1CN(c2ncnc3scc(-c4ccccc4)c23)CC12COC2	ZINC000450567511	GG	On-Demand	Anodyne	ADRB3	30	47
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	CA2	18	48
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	BMP1	83	41
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	CA1	17	48
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	MMP13	64	49
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	ADAM17	24	40
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	MMP2	46	40
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	MMP3	56	39
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	MMP8	36	40
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	MMP9	55	43
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	MMP12	30	40
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	CA12	16	48
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	MMP7	44	40
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	CA9	32	48
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	MMP1	56	40
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567534	GE	On-Demand	Anodyne	RORC	53	37
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	CA2	18	48
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	BMP1	83	41
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	CA1	17	48
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	MMP13	64	49
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	ADAM17	24	40
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	MMP2	46	40
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	MMP3	56	39
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	MMP8	36	40
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	MMP9	55	43
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	MMP12	30	40
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	CA12	16	48
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	MMP7	44	40
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	CA9	32	48
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	MMP1	56	40
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(OC)cc2)cc1	ZINC000450567537	GE	On-Demand	Anodyne	RORC	53	37
CCOC(=O)[C@@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)CC12COC2	ZINC000450567550	FF	On-Demand	Mild	AR	22	54
CCOC(=O)[C@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)CC12COC2	ZINC000450567551	FF	On-Demand	Mild	AR	22	54
CCC(C)(C)N(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450567560	CG	On-Demand	Anodyne	RORC	22	42
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)CCc1ccccc1O	ZINC000450567576	EI	On-Demand	Anodyne	TACR1	15	46
O=C(CSC1CC1)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450567584	EG	On-Demand	Anodyne	EPHX2	29	41
CN(CCc1ccccc1O)C(=O)C(C)(C)C1CCC1	ZINC000450567592	CG	On-Demand	Anodyne	AMY2	50	36
Cc1ccc(C(=O)NCC(=O)C2CC2)cc1C(=O)NCC(=O)C1CC1	ZINC000450567600	ED	On-Demand	Anodyne	MAPK14	29	41
Cc1ccc(C(=O)NCC(=O)C2CC2)cc1C(=O)NCC(=O)C1CC1	ZINC000450567600	ED	On-Demand	Anodyne	HSPB1	0	41
Cc1nn(C)cc1CC(=O)NCCCNc1cccc(F)c1	ZINC000450567627	DE	On-Demand	Anodyne	P2RX7	53	43
COc1cc(CC(=O)NCCCNc2cccc(F)c2)ccc1O	ZINC000450567628	EF	On-Demand	Anodyne	TRPV1	42	62
COc1cc(CC(=O)NCCCNc2cccc(F)c2)ccc1O	ZINC000450567628	EF	On-Demand	Anodyne	CAN2	0	47
Cc1cccc(NC2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450567640	DE	On-Demand	Anodyne	PTPN2	42	33
Cc1cccc(NC2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450567641	DE	On-Demand	Anodyne	PTPN2	42	33
CO[C@@H](Cc1ccccc1)CN(C)CC(=O)NCc1ccccc1	ZINC000450567654	EE	On-Demand	Anodyne	MME	37	43
CO[C@@H](Cc1ccccc1)CN(C)CC(=O)NCc1ccccc1	ZINC000450567654	EE	On-Demand	Anodyne	CPA1	40	33
CO[C@@H](Cc1ccccc1)CN(C)CC(=O)NCc1ccccc1	ZINC000450567654	EE	On-Demand	Anodyne	AMP1_PLAFQ	41	41
CO[C@@H](Cc1ccccc1)CN(C)CC(=O)NCc1ccccc1	ZINC000450567654	EE	On-Demand	Anodyne	PDS	45	37
CO[C@H](Cc1ccccc1)CN(C)CC(=O)NCc1ccccc1	ZINC000450567658	EE	On-Demand	Anodyne	MME	37	43
CO[C@H](Cc1ccccc1)CN(C)CC(=O)NCc1ccccc1	ZINC000450567658	EE	On-Demand	Anodyne	CPA1	40	33
CO[C@H](Cc1ccccc1)CN(C)CC(=O)NCc1ccccc1	ZINC000450567658	EE	On-Demand	Anodyne	AMP1_PLAFQ	41	41
CO[C@H](Cc1ccccc1)CN(C)CC(=O)NCc1ccccc1	ZINC000450567658	EE	On-Demand	Anodyne	PDS	45	37
COCCn1ccc2ccc(NC(=O)C3(Cc4ccccc4)CCOCC3)cc21	ZINC000450567664	GI	On-Demand	Anodyne	NAMPT	0	43
CCOC(=O)[C@H]1CN(c2ncnc3c2ncn3C2CC2)CC12COC2	ZINC000450567665	ED	On-Demand	Anodyne	OXGR1	74	36
CCOC(=O)[C@@H]1CN(c2ncnc3c2ncn3C2CC2)CC12COC2	ZINC000450567670	ED	On-Demand	Anodyne	OXGR1	74	36
CCSc1cccnc1C(=O)NCC1(C(=O)OC)CCCCC1	ZINC000450567671	EG	On-Demand	Anodyne	HCN4	51	33
O=C(NCCCNc1cccc(F)c1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450567675	GF	On-Demand	Anodyne	BCHE	19	40
O=C(NCCCNc1cccc(F)c1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450567675	GF	On-Demand	Anodyne	TBK1	22	47
CCC(=O)CCCN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567691	CH	On-Demand	Anodyne	HTR1A	24	43
CCC(=O)CCCN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567691	CH	On-Demand	Anodyne	DRD2	21	41
CCC(=O)CCCN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567691	CH	On-Demand	Anodyne	HTR1D	31	40
CCC(=O)CCCN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567691	CH	On-Demand	Anodyne	HTR1B	25	41
CCC(=O)CCCN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567691	CH	On-Demand	Anodyne	HTR1F	90	41
CCC(=O)CCCN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567691	CH	On-Demand	Anodyne	HTR1E	15	40
CCC(=O)CCCN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567691	CH	On-Demand	Anodyne	CCR2	18	46
CCC(=O)CCCN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450567691	CH	On-Demand	Anodyne	Q7YY07_CRYPV	44	35
CC[C@@]1(C)COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450567695	FH	On-Demand	Anodyne	PRCP	15	44
O=C(N[C@H](CO)CC(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450567700	DD	On-Demand	Anodyne	HPGDS	33	53
O=C(N[C@@H](CO)CC(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450567701	DD	On-Demand	Anodyne	HPGDS	33	53
CC[C@]1(C)COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450567704	FH	On-Demand	Anodyne	PRCP	15	44
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	HTR1A	82	63
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	DRD2	54	60
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	DRD4	47	42
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	HTR2A	49	50
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	HTR2C	28	47
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	SLC6A4	21	61
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	ADRA1A	18	41
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	DRD3	58	52
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	HTR3A	62	60
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	HTR7	104	50
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	SORD	24	48
CCC(=O)CCCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450567707	DG	On-Demand	Anodyne	CYP2J2	44	31
C[C@@H](CCO)CCNc1ccnc2cc(F)ccc12	ZINC000450567718	CG	On-Demand	Anodyne	HRP1_PLAFA	96	35
C[C@@H](CCO)CCNc1ccnc2cc(F)ccc12	ZINC000450567718	CG	On-Demand	Anodyne	KCNN3	22	40
C[C@@H](CCO)CCNc1ccnc2cc(F)ccc12	ZINC000450567718	CG	On-Demand	Anodyne	BOTA	23	44
CC(=O)[C@@](C)(O)CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450567719	FE	On-Demand	Anodyne	CCR5	46	45
C[C@H](CCO)CCNc1ccnc2cc(F)ccc12	ZINC000450567721	CG	On-Demand	Anodyne	HRP1_PLAFA	96	35
C[C@H](CCO)CCNc1ccnc2cc(F)ccc12	ZINC000450567721	CG	On-Demand	Anodyne	KCNN3	22	40
C[C@H](CCO)CCNc1ccnc2cc(F)ccc12	ZINC000450567721	CG	On-Demand	Anodyne	BOTA	23	44
CC(=O)[C@](C)(O)CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450567722	FE	On-Demand	Anodyne	CCR5	46	45
CCOC(=O)[C@H]1CN(c2ncc(C(F)(F)F)s2)CC12COC2	ZINC000450567728	EE	On-Demand	Anodyne	MLYCD	51	33
CCOC(=O)[C@@H]1CN(c2ncc(C(F)(F)F)s2)CC12COC2	ZINC000450567730	EE	On-Demand	Anodyne	MLYCD	51	33
O=[N+]([O-])c1ccc2nc(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)ccc2c1	ZINC000450567731	DG	On-Demand	Bother	SLC6A4	0	49
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	HTR1A	39	62
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	DRD2	37	48
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	DRD1	33	58
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	DRD4	31	56
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	HTR2A	39	62
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	HTR2C	26	51
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	DRD3	22	44
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	ERG2	22	48
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	HTR7	44	43
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	SLC18A3	0	49
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	HTR3B	0	44
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	CYP2J2	53	38
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	AP2S1	0	48
Cc1cnc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450567736	EG	On-Demand	Anodyne	SLC27A1	42	32
FC1(F)CC(CN2CCN(c3ccc4ccccc4n3)CC2)C1	ZINC000450567767	DG	On-Demand	Anodyne	HTR3A	37	54
FC1(F)CC(CN2CCN(c3ccc4ccccc4n3)CC2)C1	ZINC000450567767	DG	On-Demand	Anodyne	PDE1B	0	40
FC1(F)CC(CN2CCN(c3ccc4ccccc4n3)CC2)C1	ZINC000450567767	DG	On-Demand	Anodyne	SORD	21	48
CC(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450567774	DF	On-Demand	Anodyne	ACHE	0	47
CC(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450567774	DF	On-Demand	Anodyne	LTA4H	26	49
CC(=O)c1ccc(CN(C)CC(=O)NCc2ccccc2)cc1	ZINC000450567774	DF	On-Demand	Anodyne	LIMK2	42	39
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	CNR1	27	45
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	DRD4	32	40
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	SLC6A1	23	40
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	HRH3	25	42
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	SIGMAR1	38	55
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	MMP2	45	32
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	NR1H4	28	40
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	EPHX2	36	48
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	BIRC2	72	48
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)NC1CCCCC1	ZINC000450567796	FF	On-Demand	Anodyne	MRGPRX1	41	35
CCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450567816	DG	On-Demand	Anodyne	CA7	23	56
CCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450567816	DG	On-Demand	Anodyne	ADAM17	15	41
CCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450567816	DG	On-Demand	Anodyne	MMP14	25	42
CCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450567816	DG	On-Demand	Anodyne	ADAMTS4	42	39
CCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450567816	DG	On-Demand	Anodyne	PIR	0	40
COC(=O)C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCCC1	ZINC000450567825	GF	On-Demand	Bother	CACNA1C	51	35
COC(=O)C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCCC1	ZINC000450567825	GF	On-Demand	Bother	CACNA1D	83	34
COC(=O)c1coc(CN(Cc2ccc3c(c2)OCO3)C2(C)CCCC2)n1	ZINC000450567827	FH	On-Demand	Anodyne	BMP1	48	35
Cc1cc(C)cc([C@H]2CCN(C(=O)Cc3ccccc3O[C@@H]3CCOC3)C2)c1	ZINC000450567831	GI	On-Demand	Anodyne	ADAM10	25	43
Cc1cc(C)cc([C@H]2CCN(C(=O)Cc3ccccc3O[C@H]3CCOC3)C2)c1	ZINC000450567836	GI	On-Demand	Anodyne	ADAM10	25	43
COc1cc(-c2noc(CN3CCC(Oc4ccccn4)CC3)n2)ncn1	ZINC000450567852	FD	On-Demand	Anodyne	PDE3B	23	40
COc1cc(-c2noc(CN3CCC(Oc4ccccn4)CC3)n2)ncn1	ZINC000450567852	FD	On-Demand	Anodyne	SCN5A	50	36
O=C(N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1(CF)CCOCC1	ZINC000450567861	FH	On-Demand	Anodyne	CACNA1B	47	35
O=C(N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)C1(CF)CCOCC1	ZINC000450567861	FH	On-Demand	Anodyne	CCR2	61	39
O=C(N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1(CF)CCOCC1	ZINC000450567865	FH	On-Demand	Anodyne	CACNA1B	47	35
O=C(N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)C1(CF)CCOCC1	ZINC000450567865	FH	On-Demand	Anodyne	CCR2	61	39
COc1cccc(-n2cc(C(=O)N3CC[C@H](c4cccc(C)c4)C3)nn2)c1	ZINC000450567868	FG	On-Demand	Anodyne	CCKAR	24	41
COc1cccc(-n2cc(C(=O)N3CC[C@@H](c4cccc(C)c4)C3)nn2)c1	ZINC000450567871	FG	On-Demand	Anodyne	CCKAR	24	41
COC(=O)C1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450567882	GD	On-Demand	Anodyne	HCN1	51	32
COC(=O)C1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450567882	GD	On-Demand	Anodyne	HCN4	49	32
COC(=O)c1cc(NC[C@@H](O)Cc2cccc(F)c2)cc(C)c1[N+](=O)[O-]	ZINC000450567892	FF	On-Demand	Bother	CACNA1D	32	40
COC(=O)c1cc(NC[C@H](O)Cc2cccc(F)c2)cc(C)c1[N+](=O)[O-]	ZINC000450567893	FF	On-Demand	Bother	CACNA1D	32	40
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450567896	GJ	On-Demand	Anodyne	NPY2R	31	41
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450567896	GJ	On-Demand	Anodyne	MAPK1	32	42
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450567896	GJ	On-Demand	Anodyne	CCR2	16	50
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450567896	GJ	On-Demand	Anodyne	EPHX2	27	51
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450567896	GJ	On-Demand	Anodyne	TYK2	56	39
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450567896	GJ	On-Demand	Anodyne	ENV	44	34
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450567896	GJ	On-Demand	Anodyne	MCHR1	37	41
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CC[C@@H](C)O3)C2)c1	ZINC000450567900	CF	On-Demand	Anodyne	ADAM10	18	42
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CC[C@@H](C)O3)C2)c1	ZINC000450567900	CF	On-Demand	Anodyne	MGEA5	15	42
COC(=O)C1(CN2CCC[C@H]2c2nc(-c3ccccc3)c(C(C)C)o2)CC1	ZINC000450567905	FJ	On-Demand	Anodyne	PTGIR	15	45
COC(=O)C1(CN2CCC[C@H]2c2nc(-c3ccccc3)c(C(C)C)o2)CC1	ZINC000450567905	FJ	On-Demand	Anodyne	CPT1A	67	36
CC(=O)N[C@H](C(=O)N1CC[C@H](c2cccc(C)c2)C1)C(C)(C)C	ZINC000450567910	DF	On-Demand	Anodyne	CCR1	42	42
CC(C)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450567920	CH	On-Demand	Anodyne	SIGMAR1	20	42
CC(C)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450567921	CH	On-Demand	Anodyne	SIGMAR1	21	61
C[C@@H]1OCC[C@]1(C)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450567927	EH	On-Demand	Anodyne	PRCP	49	33
COc1ccc(-c2noc(CN(C)C3CCN(Cc4ccccc4)CC3)n2)nn1	ZINC000450567928	GF	On-Demand	Anodyne	ACHE	29	45
COc1ccc(-c2noc(CN(C)C3CCN(Cc4ccccc4)CC3)n2)nn1	ZINC000450567928	GF	On-Demand	Anodyne	SIGMAR1	37	40
CC(=O)CCCCCn1cnc2sc3c(c2c1=O)CCC3	ZINC000450567929	DG	On-Demand	Anodyne	HTR1B	17	43
Cn1nc(-c2ccccc2)cc1C(=O)Nc1ncn(C(C)(C)C)n1	ZINC000450567930	DE	On-Demand	Anodyne	CTSV	44	31
COc1cc(CC(=O)N2CC(CO)C2)ccc1Cl	ZINC000450567933	CD	On-Demand	Anodyne	OPRK1	39	42
COc1cc(CC(=O)N2CC(CO)C2)ccc1Cl	ZINC000450567933	CD	On-Demand	Anodyne	CCR1	34	41
C[C@@H]1OCC[C@]1(C)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450567934	EH	On-Demand	Anodyne	PRCP	49	33
C[C@@H]1OCC[C@]1(C)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450567935	EH	On-Demand	Anodyne	PRCP	49	33
C[C@@H]1OCC[C@]1(C)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450567936	EH	On-Demand	Anodyne	PRCP	49	33
C[C@H]1Cc2cc(F)ccc2[C@H](C)N1C(=O)c1cnn(-c2ccncc2)c1	ZINC000450567941	FH	On-Demand	Anodyne	HCRTR2	0	40
CC(=O)N[C@H](C(=O)N1CC[C@@H](c2cccc(C)c2)C1)C(C)(C)C	ZINC000450567942	DF	On-Demand	Anodyne	CCR1	42	42
COC(=O)c1cccc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)c1Cl	ZINC000450567943	GH	On-Demand	Mild	PTAFR	46	45
C[C@H]1c2ccc(F)cc2C[C@@H](C)N1C(=O)c1cnn(-c2ccncc2)c1	ZINC000450567944	FH	On-Demand	Anodyne	HCRTR2	0	40
C[C@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1cnn(-c2ccncc2)c1	ZINC000450567945	FH	On-Demand	Anodyne	HCRTR2	0	40
C[C@@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1cnn(-c2ccncc2)c1	ZINC000450567946	FH	On-Demand	Anodyne	HCRTR2	0	40
COC(=O)C1(CN2CCC[C@@H]2c2nc(-c3ccccc3)c(C(C)C)o2)CC1	ZINC000450567951	FJ	On-Demand	Anodyne	PTGIR	15	45
COC(=O)C1(CN2CCC[C@@H]2c2nc(-c3ccccc3)c(C(C)C)o2)CC1	ZINC000450567951	FJ	On-Demand	Anodyne	CPT1A	67	36
O=C(CCCC(=O)C1CC1)NCCCNc1cccc(F)c1	ZINC000450567952	DF	On-Demand	Anodyne	TBK1	24	43
COC(=O)c1cccc(CN2CCN([C@H](C#N)c3ccccc3)CC2)c1Cl	ZINC000450567953	GH	On-Demand	Mild	PTAFR	46	45
COc1ccc(-c2noc(CN3CCc4ccc(O)cc4C3)n2)nn1	ZINC000450567956	ED	On-Demand	Anodyne	ABCB1	0	42
COc1cccc(OCCC(=O)N2CCN(C3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450567970	GE	On-Demand	Anodyne	CHRNA10	28	42
COc1cccc(OCCC(=O)N2CCN(C3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450567972	GE	On-Demand	Anodyne	CHRNA10	28	42
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@H]3C(N)=O)ccc21	ZINC000450567985	GD	On-Demand	Anodyne	PLK1	47	35
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@H]3C(N)=O)ccc21	ZINC000450567985	GD	On-Demand	Anodyne	HPGD	53	62
Cc1nc(-c2ccccn2)nc(NC[C@@H](O)Cc2cccc(F)c2)c1C	ZINC000450567987	FF	On-Demand	Anodyne	METAP1	71	44
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@@H]3C(N)=O)ccc21	ZINC000450567988	GD	On-Demand	Anodyne	PLK1	47	35
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@@H]3C(N)=O)ccc21	ZINC000450567988	GD	On-Demand	Anodyne	HPGD	53	62
Cc1nc(-c2ccccn2)nc(NC[C@H](O)Cc2cccc(F)c2)c1C	ZINC000450567989	FF	On-Demand	Anodyne	METAP1	71	44
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450567997	GI	On-Demand	Anodyne	LRRK2	0	40
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450568000	GI	On-Demand	Anodyne	LRRK2	0	40
CCC(CC)Oc1ccc(C(=O)N2C[C@H]3[C@H](O)CC[C@H]3C2)cc1	ZINC000450568005	DG	On-Demand	Anodyne	L3MBTL3	45	42
CCC(CC)Oc1ccc(C(=O)N2C[C@@H]3CC[C@@H](O)[C@H]3C2)cc1	ZINC000450568006	DG	On-Demand	Anodyne	L3MBTL3	45	42
CCC(CC)Oc1ccc(C(=O)N2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1	ZINC000450568007	DG	On-Demand	Anodyne	L3MBTL3	45	42
CCS(=O)(=O)c1ccc(CN(Cc2cccc(C)c2)Cc2ccccn2)cc1	ZINC000450568021	GI	On-Demand	Anodyne	RORC	17	40
C[C@H](CCO)CCN=c1ccc(C(=O)N2CCc3ccccc32)c[nH]1	ZINC000450568024	EF	On-Demand	Anodyne	AVPR2	36	40
O=C(N[C@H](CO)c1cccc(F)c1)[C@H](O)C1CCC1	ZINC000450568026	CD	On-Demand	Anodyne	METAP2	15	51
C[C@@H](OCCc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450568027	CE	On-Demand	Anodyne	NPR	51	35
O=C(N[C@H](CO)c1cccc(F)c1)[C@@H](O)C1CCC1	ZINC000450568028	CD	On-Demand	Anodyne	METAP2	15	51
C[C@H](OCCc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450568029	CE	On-Demand	Anodyne	NPR	51	35
O=C(N[C@@H](CO)c1cccc(F)c1)[C@H](O)C1CCC1	ZINC000450568030	CD	On-Demand	Anodyne	METAP2	15	51
C[C@H](OCCc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450568031	CE	On-Demand	Anodyne	NPR	51	35
O=C(N[C@@H](CO)c1cccc(F)c1)[C@@H](O)C1CCC1	ZINC000450568032	CD	On-Demand	Anodyne	METAP2	15	51
C[C@@H](OCCc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450568033	CE	On-Demand	Anodyne	NPR	51	35
C[C@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1nccs1	ZINC000450568037	FI	On-Demand	Anodyne	MAP1	58	35
C[C@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1nccs1	ZINC000450568037	FI	On-Demand	Anodyne	FFAR2	25	43
C[C@@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1nccs1	ZINC000450568040	FI	On-Demand	Anodyne	MAP1	58	35
C[C@@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1nccs1	ZINC000450568040	FI	On-Demand	Anodyne	FFAR2	25	43
C[C@@H](CCO)CCN=c1ccc(C(=O)N2CCc3ccccc32)c[nH]1	ZINC000450568046	EF	On-Demand	Anodyne	AVPR2	36	40
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	HTR1A	38	52
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	DRD2	46	45
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	DRD1	23	43
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	ACHE	28	43
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	HTR2A	31	46
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	HRH1	25	43
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	DRD3	43	50
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	OPRK1	25	44
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	HTR7	48	45
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	SIGMAR1	56	45
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	SLC18A3	23	40
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	ABCB1	0	40
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	CACNA1G	23	42
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	MGLL	0	41
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	CYP2J2	62	43
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1	ZINC000450568048	EG	On-Demand	Anodyne	NPFFR1	42	32
COC(=O)c1ccc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)cc1Cl	ZINC000450568063	GH	On-Demand	Mild	PTAFR	46	42
COC(=O)c1ccc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)cc1Cl	ZINC000450568063	GH	On-Demand	Mild	SIGMAR1	26	42
COC(=O)c1ccc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)cc1Cl	ZINC000450568063	GH	On-Demand	Mild	FAAH	15	40
COC(=O)c1ccc(CN2CCN([C@H](C#N)c3ccccc3)CC2)cc1Cl	ZINC000450568065	GH	On-Demand	Mild	PTAFR	46	42
COC(=O)c1ccc(CN2CCN([C@H](C#N)c3ccccc3)CC2)cc1Cl	ZINC000450568065	GH	On-Demand	Mild	SIGMAR1	26	42
COC(=O)c1ccc(CN2CCN([C@H](C#N)c3ccccc3)CC2)cc1Cl	ZINC000450568065	GH	On-Demand	Mild	FAAH	15	40
COc1ccc(C2(CNC(=O)C3(CF)CCOCC3)CCC2)cc1	ZINC000450568068	EF	On-Demand	Anodyne	ACAT	0	51
COc1ccc(-c2nnc(SC[C@H](Cc3ccccc3)OC)o2)cc1	ZINC000450568070	FI	On-Demand	Anodyne	GSK3B	22	53
COc1ccc(-c2nnc(SC[C@H](Cc3ccccc3)OC)o2)cc1	ZINC000450568070	FI	On-Demand	Anodyne	GSK3A	46	46
COc1ccc(-c2nnc(SC[C@H](Cc3ccccc3)OC)o2)cc1	ZINC000450568070	FI	On-Demand	Anodyne	TERT	22	41
COc1ccc(-c2nnc(SC[C@@H](Cc3ccccc3)OC)o2)cc1	ZINC000450568071	FI	On-Demand	Anodyne	GSK3B	22	53
COc1ccc(-c2nnc(SC[C@@H](Cc3ccccc3)OC)o2)cc1	ZINC000450568071	FI	On-Demand	Anodyne	GSK3A	46	46
COc1ccc(-c2nnc(SC[C@@H](Cc3ccccc3)OC)o2)cc1	ZINC000450568071	FI	On-Demand	Anodyne	TERT	22	41
COC(=O)c1ccc2c(c1)CN(C(=O)C1(C)CCC(=O)CC1)CC2	ZINC000450568081	EF	On-Demand	Anodyne	SRD5A1	22	41
COC(=O)c1ccc2c(c1)CN(C(=O)C1(C)CCC(=O)CC1)CC2	ZINC000450568081	EF	On-Demand	Anodyne	SRD5A2	27	41
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2ccc(C)cn2)C1	ZINC000450568082	FG	On-Demand	Anodyne	SLC6A1	103	38
COC(=O)C1(CN2CCC[C@H]2c2ncc(-c3ccc(F)cc3)[nH]2)CC1	ZINC000450568084	EG	On-Demand	Anodyne	PRCP	0	45
COC(=O)C1(CN2CCC[C@@H]2c2ncc(-c3ccc(F)cc3)[nH]2)CC1	ZINC000450568085	EG	On-Demand	Anodyne	PRCP	0	45
COC(=O)C1(CNC(=O)c2cc3ccncc3s2)CCCCC1	ZINC000450568086	EG	On-Demand	Anodyne	VCAM1	46	37
COc1cc(CN2C(=O)NC3(CCCC3)C2=O)ccc1Cl	ZINC000450568091	DF	On-Demand	Anodyne	PDE7A	25	45
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2ccc(C)cn2)C1	ZINC000450568092	FG	On-Demand	Anodyne	SLC6A1	103	38
CO[C@H](Cc1ccccc1)CN1CCC[C@H](C(=O)Nc2ccc(C)cn2)C1	ZINC000450568094	FG	On-Demand	Anodyne	SLC6A1	103	38
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](C(=O)Nc2ccc(C)cn2)C1	ZINC000450568095	FG	On-Demand	Anodyne	SLC6A1	103	38
Cc1c(NC[C@H](O)Cc2cccc(F)c2)nn2c(C(F)(F)F)nnc2c1C	ZINC000450568098	GE	On-Demand	Anodyne	CACNA2D1	19	41
Cc1c(NC[C@@H](O)Cc2cccc(F)c2)nn2c(C(F)(F)F)nnc2c1C	ZINC000450568099	GE	On-Demand	Anodyne	CACNA2D1	19	41
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450568102	CG	On-Demand	Anodyne	ACE	44	34
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450568102	CG	On-Demand	Anodyne	AMY2	44	31
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450568102	CG	On-Demand	Anodyne	CYP2J2	45	32
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450568103	CG	On-Demand	Anodyne	ACE	44	34
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450568103	CG	On-Demand	Anodyne	AMY2	44	31
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450568103	CG	On-Demand	Anodyne	CYP2J2	45	32
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450568105	CG	On-Demand	Anodyne	ACE	44	34
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450568105	CG	On-Demand	Anodyne	AMY2	44	31
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450568105	CG	On-Demand	Anodyne	CYP2J2	45	32
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450568107	CG	On-Demand	Anodyne	ACE	44	34
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450568107	CG	On-Demand	Anodyne	AMY2	44	31
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450568107	CG	On-Demand	Anodyne	CYP2J2	45	32
CCOC(=O)C(C)(C)N(C)CC[C@@H](C)O	ZINC000450568108	BD	On-Demand	Anodyne	CHRNA4	50	36
CCOC(=O)C(C)(C)N(C)CC[C@H](C)O	ZINC000450568111	BD	On-Demand	Anodyne	CHRNA4	50	36
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)c1	ZINC000450568120	EI	On-Demand	Anodyne	SLC9A1	42	40
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)c1	ZINC000450568120	EI	On-Demand	Anodyne	RBP4	40	38
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)c1	ZINC000450568120	EI	On-Demand	Anodyne	SFRP1	74	35
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)c1	ZINC000450568120	EI	On-Demand	Anodyne	WNT3	53	31
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)c1	ZINC000450568123	EI	On-Demand	Anodyne	SLC9A1	42	40
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)c1	ZINC000450568123	EI	On-Demand	Anodyne	RBP4	40	38
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)c1	ZINC000450568123	EI	On-Demand	Anodyne	SFRP1	74	35
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)c1	ZINC000450568123	EI	On-Demand	Anodyne	WNT3	53	31
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450568125	FF	On-Demand	Anodyne	SSTR5	63	43
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450568125	FF	On-Demand	Anodyne	SCN9A	0	41
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccn3)CC2)cc1	ZINC000450568125	FF	On-Demand	Anodyne	SCN5A	63	37
CC(=O)CCCCCn1cnc2sc3c(c2c1=O)CCCC3	ZINC000450568128	DG	On-Demand	Anodyne	HTR1B	17	43
COc1cc(-c2noc(CN3CCC[C@@H]3C(=O)Nc3nccs3)n2)ncn1	ZINC000450568136	GD	On-Demand	Anodyne	MAP1	43	33
COc1cc(-c2noc(CN3CCC[C@H]3C(=O)Nc3nccs3)n2)ncn1	ZINC000450568137	GD	On-Demand	Anodyne	MAP1	43	33
CC(=O)N[C@H](C(=O)N(C)CCc1ccccc1O)C(C)(C)C	ZINC000450568142	DD	On-Demand	Anodyne	PDF	48	31
C[C@@H](CCO)CCNc1ccnc2cc(Br)ccc12	ZINC000450568149	DH	On-Demand	Anodyne	HRP1_PLAFA	96	35
C[C@H](CCO)CCNc1ccnc2cc(Br)ccc12	ZINC000450568150	DH	On-Demand	Anodyne	HRP1_PLAFA	96	35
Cc1cccc([C@H]2CCN(C(=O)c3ccccc3-n3ccc(C)n3)C2)c1	ZINC000450568155	EI	On-Demand	Anodyne	AVPR2	19	40
Cc1cccc([C@H]2CCN(C(=O)c3ccccc3-n3ccc(C)n3)C2)c1	ZINC000450568155	EI	On-Demand	Anodyne	HPGD	18	44
COc1cc(CC(=O)Nc2ncn(C(C)(C)C)n2)ccc1O	ZINC000450568162	DD	On-Demand	Anodyne	TRPV1	40	52
CCn1c(SCc2nc(C(=O)OC)co2)nc2ccccc21	ZINC000450568171	DG	On-Demand	Anodyne	PTGDR2	21	52
COc1cc(Br)ccc1CCCNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450568178	GG	On-Demand	Anodyne	MTNR1B	40	46
COc1cc(Br)ccc1CCCNC(=O)[C@H](C)Oc1ccccn1	ZINC000450568179	GG	On-Demand	Anodyne	MTNR1B	40	46
C[C@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568197	DD	On-Demand	Anodyne	CA2	48	42
C[C@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568197	DD	On-Demand	Anodyne	CA1	43	38
C[C@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568197	DD	On-Demand	Anodyne	CA4	53	42
C[C@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568197	DD	On-Demand	Anodyne	CA5A	40	34
C[C@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568197	DD	On-Demand	Anodyne	P96878_MYCTU	41	32
C[C@@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568198	DD	On-Demand	Anodyne	CA2	48	42
C[C@@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568198	DD	On-Demand	Anodyne	CA1	43	38
C[C@@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568198	DD	On-Demand	Anodyne	CA4	53	42
C[C@@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568198	DD	On-Demand	Anodyne	CA5A	40	34
C[C@@]1(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CC=CCC1	ZINC000450568198	DD	On-Demand	Anodyne	P96878_MYCTU	41	32
COc1cc(Br)ccc1CCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450568207	GH	On-Demand	Anodyne	TRPV1	36	58
COc1cc(Br)ccc1CCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450568207	GH	On-Demand	Anodyne	MTNR1A	20	46
COc1cc(Br)ccc1CCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450568207	GH	On-Demand	Anodyne	MTNR1B	21	47
COc1cc(Br)ccc1CCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450568207	GH	On-Demand	Anodyne	NCE103	28	47
COc1cc(Br)ccc1CCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450568207	GH	On-Demand	Anodyne	P96878_MYCTU	19	47
COc1cc(Br)ccc1CCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450568207	GH	On-Demand	Anodyne	CAN2	0	47
CN(Cc1ccn(CC(F)(F)F)n1)C1CCN(Cc2ccccc2)CC1	ZINC000450568211	FH	On-Demand	Anodyne	DRD2	0	45
CN(Cc1ccn(CC(F)(F)F)n1)C1CCN(Cc2ccccc2)CC1	ZINC000450568211	FH	On-Demand	Anodyne	DRD4	22	40
CN(Cc1ccn(CC(F)(F)F)n1)C1CCN(Cc2ccccc2)CC1	ZINC000450568211	FH	On-Demand	Anodyne	DRD3	0	41
CN(Cc1ccn(CC(F)(F)F)n1)C1CCN(Cc2ccccc2)CC1	ZINC000450568211	FH	On-Demand	Anodyne	SIGMAR1	44	45
Cc1cc(-c2nc(C(=O)NC(C)(C)C(C)(C)O)co2)ccn1	ZINC000450568223	DE	On-Demand	Anodyne	IRAK4	21	42
CCCc1cc(NCCCC(C)(F)F)n2ncnc2n1	ZINC000450568228	CF	On-Demand	Anodyne	DHOD	0	54
COc1cc(-c2noc(CN3CCC(c4nc5ccccc5[nH]4)CC3)n2)ncn1	ZINC000450568242	GF	On-Demand	Anodyne	SSTR5	46	34
CC[C@](NC[C@@H]1COCCO1)(C(=O)OC)c1ccccc1	ZINC000450568260	CD	On-Demand	Anodyne	AMY2	52	31
CC[C@](NC[C@H]1COCCO1)(C(=O)OC)c1ccccc1	ZINC000450568261	CD	On-Demand	Anodyne	AMY2	52	31
CC[C@@](NC[C@H]1COCCO1)(C(=O)OC)c1ccccc1	ZINC000450568262	CD	On-Demand	Anodyne	AMY2	52	31
CC[C@@](NC[C@@H]1COCCO1)(C(=O)OC)c1ccccc1	ZINC000450568263	CD	On-Demand	Anodyne	AMY2	52	31
CO[C@H]1COCC[C@@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568275	GG	On-Demand	Anodyne	NQO2	17	43
CO[C@H]1COCC[C@@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568275	GG	On-Demand	Anodyne	MTNR1A	21	48
CO[C@H]1COCC[C@@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568275	GG	On-Demand	Anodyne	ABCG2	24	41
CO[C@H]1COCC[C@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568276	GG	On-Demand	Anodyne	NQO2	17	43
CO[C@H]1COCC[C@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568276	GG	On-Demand	Anodyne	MTNR1A	21	48
CO[C@H]1COCC[C@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568276	GG	On-Demand	Anodyne	ABCG2	24	41
CO[C@@H]1COCC[C@@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568277	GG	On-Demand	Anodyne	NQO2	17	43
CO[C@@H]1COCC[C@@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568277	GG	On-Demand	Anodyne	MTNR1A	21	48
CO[C@@H]1COCC[C@@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568277	GG	On-Demand	Anodyne	ABCG2	24	41
CO[C@@H]1COCC[C@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568278	GG	On-Demand	Anodyne	NQO2	17	43
CO[C@@H]1COCC[C@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568278	GG	On-Demand	Anodyne	MTNR1A	21	48
CO[C@@H]1COCC[C@H]1CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450568278	GG	On-Demand	Anodyne	ABCG2	24	41
O=C(CS(=O)(=O)C1CC1)Nc1cccc(CCN2CCCC2)c1	ZINC000450568300	ED	On-Demand	Anodyne	HTR1D	32	43
O=C(CS(=O)(=O)C1CC1)Nc1cccc(CCN2CCCC2)c1	ZINC000450568300	ED	On-Demand	Anodyne	HTR1B	27	43
O=C(CS(=O)(=O)C1CC1)Nc1cccc(CCN2CCCC2)c1	ZINC000450568300	ED	On-Demand	Anodyne	CCR3	45	38
C[C@@H]1C[C@@]1(C#N)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450568305	EF	On-Demand	Mild	EPHX2	24	40
C[C@H]1C[C@@]1(C#N)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450568306	EF	On-Demand	Mild	EPHX2	24	40
C[C@@H]1C[C@]1(C#N)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450568307	EF	On-Demand	Mild	EPHX2	24	40
C[C@H]1C[C@]1(C#N)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450568308	EF	On-Demand	Mild	EPHX2	24	40
CC[C@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450568312	DG	On-Demand	Anodyne	CCR2	61	38
CC[C@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450568312	DG	On-Demand	Anodyne	PDS	42	35
CC[C@@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450568313	DG	On-Demand	Anodyne	CCR2	61	38
CC[C@@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450568313	DG	On-Demand	Anodyne	PDS	42	35
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450568314	DG	On-Demand	Anodyne	CCR2	61	38
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450568314	DG	On-Demand	Anodyne	PDS	42	35
CC[C@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450568315	DG	On-Demand	Anodyne	CCR2	61	38
CC[C@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450568315	DG	On-Demand	Anodyne	PDS	42	35
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CC1(F)F	ZINC000450568320	EF	On-Demand	Anodyne	P2RX7	19	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CC1(F)F	ZINC000450568320	EF	On-Demand	Anodyne	EPHX2	35	43
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H]1CC1(F)F	ZINC000450568320	EF	On-Demand	Anodyne	ENV	40	31
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CC1(F)F	ZINC000450568321	EF	On-Demand	Anodyne	P2RX7	19	41
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CC1(F)F	ZINC000450568321	EF	On-Demand	Anodyne	EPHX2	35	43
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H]1CC1(F)F	ZINC000450568321	EF	On-Demand	Anodyne	ENV	40	31
O=C(NCCCNc1cccc(F)c1)[C@@H]1CCCCC1(F)F	ZINC000450568335	DH	On-Demand	Anodyne	TBK1	46	51
O=C(NCCCNc1cccc(F)c1)[C@H]1CCCCC1(F)F	ZINC000450568336	DH	On-Demand	Anodyne	TBK1	46	51
O=C(C1CCN(Cc2cnns2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450568353	FF	On-Demand	Anodyne	SIGMAR1	30	42
O=C(C1CCN(Cc2cnns2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450568353	FF	On-Demand	Anodyne	CCR5	18	42
CC(=O)CCCCCSc1nnc(-c2ccco2)n1Cc1ccccc1	ZINC000450568356	FJ	On-Demand	Anodyne	HCRTR2	18	40
CCOC(=O)COc1ccc(NC(=O)C(C)(C)C2CCC2)cc1	ZINC000450568357	DG	On-Demand	Anodyne	S1PR4	27	42
CCOC(=O)COc1ccc(NC(=O)C(C)(C)C2CCC2)cc1	ZINC000450568357	DG	On-Demand	Anodyne	EPHX2	25	53
Cc1cccc([C@@H]2CCN(C(=O)c3ccccc3-n3ccc(C)n3)C2)c1	ZINC000450568358	EI	On-Demand	Anodyne	AVPR2	19	40
Cc1cccc([C@@H]2CCN(C(=O)c3ccccc3-n3ccc(C)n3)C2)c1	ZINC000450568358	EI	On-Demand	Anodyne	HPGD	18	44
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568362	DI	On-Demand	Anodyne	ERBB2	0	41
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568362	DI	On-Demand	Anodyne	TACR1	35	41
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568362	DI	On-Demand	Anodyne	CACNA1B	48	36
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568362	DI	On-Demand	Anodyne	SLC9A1	41	36
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568362	DI	On-Demand	Anodyne	CCR2	56	41
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568362	DI	On-Demand	Anodyne	ADAM10	28	41
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568364	DI	On-Demand	Anodyne	ERBB2	0	41
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568364	DI	On-Demand	Anodyne	TACR1	35	41
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568364	DI	On-Demand	Anodyne	CACNA1B	48	36
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568364	DI	On-Demand	Anodyne	SLC9A1	41	36
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568364	DI	On-Demand	Anodyne	CCR2	56	41
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568364	DI	On-Demand	Anodyne	ADAM10	28	41
COC(=O)c1ccc(CN2CCN(c3ncc(C)s3)CC2)cc1Cl	ZINC000450568375	FG	On-Demand	Anodyne	PARE	41	35
COc1ccc([C@]2(C)NC(=O)N(Cc3cccc(S(C)(=O)=O)c3)C2=O)cc1	ZINC000450568379	GE	On-Demand	Anodyne	MMP13	15	40
COc1ccc([C@@]2(C)NC(=O)N(Cc3cccc(S(C)(=O)=O)c3)C2=O)cc1	ZINC000450568381	GE	On-Demand	Anodyne	MMP13	15	40
CC(C)(C)[C@@H]1CCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450568392	CG	On-Demand	Anodyne	HRH4	24	61
CC(C)(C)[C@H]1CCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450568395	CG	On-Demand	Anodyne	HRH4	24	61
O=C(N[C@@H](CO)CC(F)(F)F)c1c[nH]c2nccc-2c1	ZINC000450568406	CD	On-Demand	Anodyne	AKT1	40	31
CCC[C@H](O)CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450568407	EG	On-Demand	Anodyne	CCR5	55	45
CCC[C@H](O)CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450568407	EG	On-Demand	Anodyne	ABCB1	53	42
O=C(N[C@H](CO)CC(F)(F)F)c1c[nH]c2nccc-2c1	ZINC000450568408	CD	On-Demand	Anodyne	AKT1	40	31
CCC[C@@H](O)CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450568409	EG	On-Demand	Anodyne	CCR5	55	45
CCC[C@@H](O)CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450568409	EG	On-Demand	Anodyne	ABCB1	53	42
CCOC(=O)[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC12COC2	ZINC000450568415	ED	On-Demand	Bother	CACNA1C	41	34
CCOC(=O)[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC12COC2	ZINC000450568415	ED	On-Demand	Bother	CACNA1D	53	33
CCOC(=O)[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC12COC2	ZINC000450568416	ED	On-Demand	Bother	CACNA1C	41	34
CCOC(=O)[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC12COC2	ZINC000450568416	ED	On-Demand	Bother	CACNA1D	53	33
CCC(CC)Oc1ccc(C(=O)N2C[C@@H]3CC[C@H](O)[C@H]3C2)cc1	ZINC000450568421	DG	On-Demand	Anodyne	L3MBTL3	45	42
Cc1cccc([C@H]2CCN(C(=O)CCCC(C)C)C2)c1	ZINC000450568422	CI	On-Demand	Anodyne	CCR1	35	40
Cc1cccc([C@H]2CCN(C(=O)CCCC(C)C)C2)c1	ZINC000450568422	CI	On-Demand	Anodyne	ADAM10	15	41
Cc1cccc([C@@H]2CCN(C(=O)CCCC(C)C)C2)c1	ZINC000450568426	CI	On-Demand	Anodyne	CCR1	35	40
Cc1cccc([C@@H]2CCN(C(=O)CCCC(C)C)C2)c1	ZINC000450568426	CI	On-Demand	Anodyne	ADAM10	15	41
Fc1cc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)c2cc1F	ZINC000450568427	CG	On-Demand	Anodyne	PDE3A	43	32
Fc1cc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)c2cc1F	ZINC000450568427	CG	On-Demand	Anodyne	PDE3B	41	32
CCC[C@H](O)CN1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000450568439	CE	On-Demand	Mild	PTAFR	48	47
O=C(CN1CCN(Cc2cn(CC3CC3)nn2)CC1)NC1CCCCC1	ZINC000450568444	FD	On-Demand	Anodyne	SCARB1	41	36
Cc1cccc(Cl)c1CN1CCC(NC(C)C)CC1	ZINC000450568451	CH	On-Demand	Anodyne	SIGMAR1	18	45
CCC[C@@H](O)CN1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000450568454	CE	On-Demand	Mild	PTAFR	48	47
CCC[C@H](O)CN1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000450568457	CE	On-Demand	Mild	PTAFR	48	47
CCC[C@@H](O)CN1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000450568459	CE	On-Demand	Mild	PTAFR	48	47
COc1ccc(C2(CNC(=O)[C@@H](NC(C)=O)C(C)(C)C)CCC2)cc1	ZINC000450568462	EF	On-Demand	Anodyne	ACAT	0	50
CC(C)(C)OC(=O)CN(CC1CCC(=O)CC1)c1ccccc1	ZINC000450568466	DH	On-Demand	Anodyne	AMY2	48	34
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	HTR1A	36	48
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	DRD2	38	53
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	DRD4	33	45
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	HTR1D	33	40
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	HTR1B	31	43
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	HTR2A	31	47
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	HTR2C	22	49
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	ADRA1A	16	49
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	HRH1	35	45
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	DRD3	18	45
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	HTR1F	78	40
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	HTR7	31	41
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	SIGMAR1	17	48
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	CCR2	26	47
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	MCHR1	15	49
O=C(CCCN1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1	ZINC000450568467	EI	On-Demand	Anodyne	CYP2J2	60	42
COc1ccc(CC(=O)NCCCNc2cccc(F)c2)c(Cl)c1OC	ZINC000450568472	GH	On-Demand	Anodyne	P2RX7	45	41
COc1ccc(CC(=O)NCCCNc2cccc(F)c2)c(Cl)c1OC	ZINC000450568472	GH	On-Demand	Anodyne	TBK1	18	43
CC[C@@H](Nc1ncc(C#N)cc1Cl)C(F)F	ZINC000450568474	BG	On-Demand	Mild	IRAK4	15	41
CC[C@H](Nc1ncc(C#N)cc1Cl)C(F)F	ZINC000450568477	BG	On-Demand	Mild	IRAK4	15	41
Oc1cccc(CN2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450568485	GG	On-Demand	Anodyne	DRD2	17	49
Oc1cccc(CN2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450568485	GG	On-Demand	Anodyne	DRD4	23	43
Oc1cccc(CN2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450568485	GG	On-Demand	Anodyne	OPRM1	17	47
Oc1cccc(CN2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450568485	GG	On-Demand	Anodyne	OPRD1	16	47
Oc1cccc(CN2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450568485	GG	On-Demand	Anodyne	OPRK1	17	41
Oc1cccc(CN2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450568485	GG	On-Demand	Anodyne	SIGMAR1	37	44
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1	ZINC000450568487	GE	On-Demand	Anodyne	FABI	50	37
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1	ZINC000450568487	GE	On-Demand	Anodyne	TRY2_BOVIN	65	37
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1	ZINC000450568487	GE	On-Demand	Anodyne	LSS	17	44
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1	ZINC000450568487	GE	On-Demand	Anodyne	FAAH	15	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1	ZINC000450568487	GE	On-Demand	Anodyne	PARP1	18	41
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1	ZINC000450568487	GE	On-Demand	Anodyne	RORC	46	38
COc1ccc(-c2noc(CN3CCN(C(=O)c4ccccc4O)CC3)n2)nn1	ZINC000450568490	GD	On-Demand	Anodyne	MT-CYB	42	32
CC[C@H](O)CC(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000450568494	CF	On-Demand	Anodyne	ADAM10	25	43
CC[C@@H](O)CC(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000450568497	CF	On-Demand	Anodyne	ADAM10	25	43
NC(=O)c1ccc(CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450568500	GH	On-Demand	Anodyne	SLC9A1	47	42
NC(=O)c1ccc(CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450568500	GH	On-Demand	Anodyne	CCR2	53	43
NC(=O)c1ccc(CCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450568500	GH	On-Demand	Anodyne	MCHR1	15	40
NC(=O)c1ccc(CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450568503	GH	On-Demand	Anodyne	SLC9A1	47	42
NC(=O)c1ccc(CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450568503	GH	On-Demand	Anodyne	CCR2	53	43
NC(=O)c1ccc(CCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450568503	GH	On-Demand	Anodyne	MCHR1	15	40
COC(=O)c1csc(CN2CCC(c3c[nH]c4ncccc34)CC2)n1	ZINC000450568509	FG	On-Demand	Anodyne	HTR1F	46	33
COC(=O)c1csc(CN2CCC(c3c[nH]c4ncccc34)CC2)n1	ZINC000450568509	FG	On-Demand	Anodyne	CCR2	29	45
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)c1	ZINC000450568510	FF	On-Demand	Anodyne	DRD4	43	39
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)c1	ZINC000450568510	FF	On-Demand	Anodyne	SIGMAR1	29	48
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)c1	ZINC000450568510	FF	On-Demand	Anodyne	CCR3	26	44
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)c1	ZINC000450568510	FF	On-Demand	Anodyne	MCHR1	37	43
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)c1	ZINC000450568510	FF	On-Demand	Anodyne	ADIPOR1	0	44
CC(=O)c1cccc(CN2CCN(CC(=O)NC3CCC(C)CC3)CC2)c1	ZINC000450568510	FF	On-Demand	Anodyne	ADIPOR2	0	44
COc1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450568522	FH	On-Demand	Anodyne	GSK3B	22	53
COc1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450568522	FH	On-Demand	Anodyne	GSK3A	36	48
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568524	EI	On-Demand	Anodyne	CACNA1B	40	35
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568524	EI	On-Demand	Anodyne	CCR2	46	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568528	EI	On-Demand	Anodyne	CACNA1B	40	35
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568528	EI	On-Demand	Anodyne	CCR2	46	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568530	EI	On-Demand	Anodyne	CACNA1B	40	35
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568530	EI	On-Demand	Anodyne	CCR2	46	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568533	EI	On-Demand	Anodyne	CACNA1B	40	35
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450568533	EI	On-Demand	Anodyne	CCR2	46	42
COc1ccc(CNC(=O)CCN2CCC[C@H](c3ncc[nH]3)C2)c(OC)c1	ZINC000450568555	FE	On-Demand	Anodyne	ACKR3	44	31
Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1-c1nnnn1C1CC1	ZINC000450568556	GH	On-Demand	Anodyne	CCR3	76	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](c3ncc[nH]3)C2)c(OC)c1	ZINC000450568558	FE	On-Demand	Anodyne	ACKR3	44	31
Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1-c1nnnn1C1CC1	ZINC000450568559	GH	On-Demand	Anodyne	CCR3	76	36
C[C@@H](CCO)CCNc1c(C#N)cnc2c(Br)cccc12	ZINC000450568561	EH	On-Demand	Mild	MAP3K8	36	41
COC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1Cl	ZINC000450568562	FH	On-Demand	Anodyne	HRH1	19	44
COC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1Cl	ZINC000450568562	FH	On-Demand	Anodyne	CCR3	26	44
COC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1Cl	ZINC000450568562	FH	On-Demand	Anodyne	SCN5A	64	39
C[C@H](CCO)CCNc1c(C#N)cnc2c(Br)cccc12	ZINC000450568567	EH	On-Demand	Mild	MAP3K8	36	41
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1O	ZINC000450568569	CD	On-Demand	Anodyne	TRPV1	43	55
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1O	ZINC000450568569	CD	On-Demand	Anodyne	MTNR1A	16	46
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1O	ZINC000450568569	CD	On-Demand	Anodyne	MTNR1B	16	46
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1O	ZINC000450568569	CD	On-Demand	Anodyne	SHBG	18	40
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1O	ZINC000450568569	CD	On-Demand	Anodyne	NCE103	39	46
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1O	ZINC000450568569	CD	On-Demand	Anodyne	MTCA1	15	42
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1O	ZINC000450568569	CD	On-Demand	Anodyne	P96878_MYCTU	25	46
Cc1cc(C)n2nc(SCc3ccn(CC(F)(F)F)n3)nc2n1	ZINC000450568574	EF	On-Demand	Anodyne	DHODH	19	43
COc1ccc(C2(CNC(=O)CC[C@H]3CCC(=O)N3)CCC2)cc1	ZINC000450568585	EE	On-Demand	Anodyne	MTNR1A	23	46
COc1ccc(C2(CNC(=O)CC[C@@H]3CCC(=O)N3)CCC2)cc1	ZINC000450568587	EE	On-Demand	Anodyne	MTNR1A	23	46
CO[C@H]1COCC[C@@H]1CC(=O)N1CCCCc2cc(Br)ccc21	ZINC000450568591	GH	On-Demand	Anodyne	CCR2	24	42
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCCc2cc(Br)ccc21	ZINC000450568593	GH	On-Demand	Anodyne	CCR2	24	42
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCCc2cc(Br)ccc21	ZINC000450568596	GH	On-Demand	Anodyne	CCR2	24	42
CO[C@H]1COCC[C@H]1CC(=O)N1CCCCc2cc(Br)ccc21	ZINC000450568599	GH	On-Demand	Anodyne	CCR2	24	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000450568602	DF	On-Demand	Anodyne	CACNA1B	50	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000450568602	DF	On-Demand	Anodyne	LIPG	50	35
CCOC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)nc1	ZINC000450568603	GF	On-Demand	Anodyne	SLC6A1	82	32
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@H]2[C@@H](O)CC[C@H]2C1	ZINC000450568605	DF	On-Demand	Anodyne	CACNA1B	50	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@H]2[C@@H](O)CC[C@H]2C1	ZINC000450568605	DF	On-Demand	Anodyne	LIPG	50	35
CCOC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)nc1	ZINC000450568606	GF	On-Demand	Anodyne	SLC6A1	82	32
Cc1cccc([C@@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000450568608	FH	On-Demand	Bother	CACNA1C	52	36
Cc1cccc([C@@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000450568608	FH	On-Demand	Bother	CACNA1D	80	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000450568609	DF	On-Demand	Anodyne	CACNA1B	50	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000450568609	DF	On-Demand	Anodyne	LIPG	50	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@H]2[C@H](O)CC[C@H]2C1	ZINC000450568612	DF	On-Demand	Anodyne	CACNA1B	50	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@H]2[C@H](O)CC[C@H]2C1	ZINC000450568612	DF	On-Demand	Anodyne	LIPG	50	35
Cc1cccc([C@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000450568614	FH	On-Demand	Bother	CACNA1C	52	36
Cc1cccc([C@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000450568614	FH	On-Demand	Bother	CACNA1D	80	36
COC(=O)c1coc(CN2CCC(c3c[nH]c4ncccc34)CC2)n1	ZINC000450568619	EF	On-Demand	Anodyne	HTR1F	48	35
COC(=O)c1coc(CN2CCC(c3c[nH]c4ncccc34)CC2)n1	ZINC000450568619	EF	On-Demand	Anodyne	CCR2	34	45
CCOC(=O)[C@H]1CN(c2nc(-c3ccccc3)ns2)CC12COC2	ZINC000450568633	EE	On-Demand	Anodyne	FAAH	16	43
CCOC(=O)[C@@H]1CN(c2nc(-c3ccccc3)ns2)CC12COC2	ZINC000450568634	EE	On-Demand	Anodyne	FAAH	16	43
O=C(Cc1cc2ccccc2s1)N[C@H](CO)CC(F)(F)F	ZINC000450568635	DF	On-Demand	Anodyne	PIN1	27	43
O=C(Cc1cc2ccccc2s1)N[C@@H](CO)CC(F)(F)F	ZINC000450568636	DF	On-Demand	Anodyne	PIN1	27	43
CC[C@H](Nc1ncc([N+](=O)[O-])s1)C(F)F	ZINC000450568645	BF	On-Demand	Bother	MAPK9	0	47
COC[C@@]1(C(=O)NCC2(c3ccc(OC)cc3)CCC2)CCOC1	ZINC000450568654	EE	On-Demand	Anodyne	MTNR1A	17	41
COC[C@]1(C(=O)NCC2(c3ccc(OC)cc3)CCC2)CCOC1	ZINC000450568655	EE	On-Demand	Anodyne	MTNR1A	17	41
O=C(N1CCC(Cc2cccnc2)CC1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450568656	FJ	On-Demand	Anodyne	CCR3	25	43
O=C(N1CCC(Cc2cccnc2)CC1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450568656	FJ	On-Demand	Anodyne	CHRNA7	49	48
O=C(N1CCC(Cc2cccnc2)CC1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450568656	FJ	On-Demand	Anodyne	C3AR1	48	42
O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccn(CCc4ccccc4)n3)C2)nc1	ZINC000450568657	GG	On-Demand	Bother	SIGMAR1	19	43
O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccn(CCc4ccccc4)n3)C2)nc1	ZINC000450568658	GG	On-Demand	Bother	SIGMAR1	19	43
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450568663	GI	On-Demand	Anodyne	L3MBTL3	51	37
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450568663	GI	On-Demand	Anodyne	MAP3K12	35	43
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000450568666	GF	On-Demand	Anodyne	ACE	40	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000450568666	GF	On-Demand	Anodyne	DRD4	25	41
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000450568666	GF	On-Demand	Anodyne	MME	40	37
CO[C@H](Cc1ccccc1)CN1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000450568666	GF	On-Demand	Anodyne	SIGMAR1	23	44
CC[C@@H](Nc1ncc([N+](=O)[O-])s1)C(F)F	ZINC000450568668	BF	On-Demand	Bother	MAPK9	0	47
CO[C@@H](Cc1ccccc1)CN1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000450568669	GF	On-Demand	Anodyne	ACE	40	37
CO[C@@H](Cc1ccccc1)CN1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000450568669	GF	On-Demand	Anodyne	DRD4	25	41
CO[C@@H](Cc1ccccc1)CN1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000450568669	GF	On-Demand	Anodyne	MME	40	37
CO[C@@H](Cc1ccccc1)CN1CCN(CC(=O)NC2CCC(C)CC2)CC1	ZINC000450568669	GF	On-Demand	Anodyne	SIGMAR1	23	44
O=[N+]([O-])c1ccc(NC[C@H]2CS(=O)(=O)c3ccccc32)cc1C(F)(F)F	ZINC000450568670	GH	On-Demand	Bother	AADAC	0	42
O=[N+]([O-])c1ccc(NC[C@@H]2CS(=O)(=O)c3ccccc32)cc1C(F)(F)F	ZINC000450568675	GH	On-Demand	Bother	AADAC	0	42
O=C1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc2N1	ZINC000450568678	EH	On-Demand	Anodyne	DRD2	34	46
O=C1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc2N1	ZINC000450568678	EH	On-Demand	Anodyne	DRD4	15	48
O=C1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc2N1	ZINC000450568678	EH	On-Demand	Anodyne	HTR2A	22	47
O=C1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc2N1	ZINC000450568678	EH	On-Demand	Anodyne	ERG2	20	43
O=C1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc2N1	ZINC000450568678	EH	On-Demand	Anodyne	SLC18A3	0	51
O=C1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc2N1	ZINC000450568678	EH	On-Demand	Anodyne	HTR3B	0	43
O=C1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc2N1	ZINC000450568678	EH	On-Demand	Anodyne	CYP2J2	48	35
O=C1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc2N1	ZINC000450568678	EH	On-Demand	Anodyne	AP2S1	0	43
CCC(=O)C1(C(=O)NCc2ccc([C@H](C)NC(=O)C3(C(=O)CC)CC3)cc2)CC1	ZINC000450568685	GF	On-Demand	Anodyne	SDH1	0	43
CCC(=O)C1(C(=O)NCc2ccc([C@@H](C)NC(=O)C3(C(=O)CC)CC3)cc2)CC1	ZINC000450568686	GF	On-Demand	Anodyne	SDH1	0	43
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450568689	GI	On-Demand	Anodyne	L3MBTL3	51	37
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450568689	GI	On-Demand	Anodyne	MAP3K12	35	43
CC(=O)NC[C@H](CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)CC(C)C	ZINC000450568692	GI	On-Demand	Anodyne	TACR1	37	40
CC(=O)NC[C@H](CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)CC(C)C	ZINC000450568692	GI	On-Demand	Anodyne	CCR2	77	45
CC(=O)NC[C@H](CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)CC(C)C	ZINC000450568705	GI	On-Demand	Anodyne	TACR1	37	40
CC(=O)NC[C@H](CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)CC(C)C	ZINC000450568705	GI	On-Demand	Anodyne	CCR2	77	45
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccccc1	ZINC000450568708	DH	On-Demand	Anodyne	DRD4	24	51
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccccc1	ZINC000450568708	DH	On-Demand	Anodyne	SLC6A1	40	35
COC(=O)c1ccc(CC(=O)N2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450568709	DF	On-Demand	Anodyne	CYP2J2	45	34
C[C@@H](OCCc1ccccc1)C(=O)N1CC(F)C1	ZINC000450568710	CD	On-Demand	Anodyne	ACE	50	36
COC(=O)c1ccc(CC(=O)N2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450568711	DF	On-Demand	Anodyne	CYP2J2	45	34
COc1nccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)n1	ZINC000450568721	ED	On-Demand	Anodyne	TYMS	23	42
C[C@H](OCCc1ccccc1)C(=O)N1CC(F)C1	ZINC000450568723	CD	On-Demand	Anodyne	ACE	50	36
C[C@H](O)CCN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450568744	CC	On-Demand	Anodyne	BIRC2	44	36
CCN1C(=O)C[C@H](C(=O)NCC[C@@H](C)N2CCCCC2)[C@H]1c1cccnc1	ZINC000450568745	FE	On-Demand	Anodyne	CCR5	32	44
CCN1C(=O)C[C@H](C(=O)NCC[C@H](C)N2CCCCC2)[C@H]1c1cccnc1	ZINC000450568746	FE	On-Demand	Anodyne	CCR5	32	44
C[C@@H](O)CCN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450568748	CC	On-Demand	Anodyne	BIRC2	44	36
CO[C@@H](Cc1ccccc1)C(=O)NCC1(CO)CCC1	ZINC000450568774	CD	On-Demand	Anodyne	ACAT	0	42
CO[C@H](Cc1ccccc1)C(=O)NCC1(CO)CCC1	ZINC000450568776	CD	On-Demand	Anodyne	ACAT	0	42
O=c1c2c(-c3ccc(Cl)cc3)csc2ncn1CC1CC(F)(F)C1	ZINC000450568794	FJ	On-Demand	Anodyne	Q8MHZ5_SHEEP	19	40
CCC(=O)CCCN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450568804	FH	On-Demand	Anodyne	NAMPT	35	43
CCC(=O)CCCN(CC(=O)Nc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450568804	FH	On-Demand	Anodyne	NR1D1	44	40
CCn1c(SCC2(OC)CCC2)nc2ccccc21	ZINC000450568810	CH	On-Demand	Anodyne	PTGDR2	17	42
Cc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450568818	EE	On-Demand	Anodyne	DRD2	34	48
Cc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450568818	EE	On-Demand	Anodyne	DRD1	25	53
Cc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450568818	EE	On-Demand	Anodyne	HTR2A	25	47
Cc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450568818	EE	On-Demand	Anodyne	ERG2	22	48
Cc1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450568818	EE	On-Demand	Anodyne	CYP2J2	54	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N(C)CCc1ccccc1O	ZINC000450568824	EF	On-Demand	Anodyne	CTSK	24	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N(C)CCc1ccccc1O	ZINC000450568824	EF	On-Demand	Anodyne	CAPNS1	44	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N(C)CCc1ccccc1O	ZINC000450568824	EF	On-Demand	Anodyne	CAPN2	47	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N(C)CCc1ccccc1O	ZINC000450568824	EF	On-Demand	Anodyne	FPR1	50	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N(C)CCc1ccccc1O	ZINC000450568824	EF	On-Demand	Anodyne	NPR	56	34
COc1cc(CN2CCC[C@@H]2CS(N)(=O)=O)ccc1Cl	ZINC000450568834	DD	On-Demand	Anodyne	DRD2	41	41
COc1cc(CN2CCC[C@H]2CS(N)(=O)=O)ccc1Cl	ZINC000450568835	DD	On-Demand	Anodyne	DRD2	41	41
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3)n2)c(OC)c1	ZINC000450568853	FE	On-Demand	Anodyne	PDGFRB	40	41
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3)n2)c(OC)c1	ZINC000450568853	FE	On-Demand	Anodyne	HTR7	26	42
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3)n2)c(OC)c1	ZINC000450568853	FE	On-Demand	Anodyne	MTNR1A	67	37
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3)n2)c(OC)c1	ZINC000450568853	FE	On-Demand	Anodyne	MTNR1B	68	37
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3)n2)c(OC)c1	ZINC000450568853	FE	On-Demand	Anodyne	SOAT1	30	42
COc1ccc(CNC(=O)CCn2nnc(-c3ccccc3)n2)c(OC)c1	ZINC000450568853	FE	On-Demand	Anodyne	CSF1R	15	41
COc1ccc(CNC(=O)CCN2CCC[C@H]2CS(N)(=O)=O)c(OC)c1	ZINC000450568855	GC	On-Demand	Anodyne	DRD2	29	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2CS(N)(=O)=O)c(OC)c1	ZINC000450568855	GC	On-Demand	Anodyne	ACKR3	62	32
COc1ccc(CNC(=O)CCN2CCC[C@@H]2CS(N)(=O)=O)c(OC)c1	ZINC000450568860	GC	On-Demand	Anodyne	DRD2	29	40
COc1ccc(CNC(=O)CCN2CCC[C@@H]2CS(N)(=O)=O)c(OC)c1	ZINC000450568860	GC	On-Demand	Anodyne	ACKR3	62	32
CN(CC1=CCCCC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450568869	DH	On-Demand	Anodyne	L3MBTL1	0	43
CN(CC1=CCCCC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450568869	DH	On-Demand	Anodyne	L3MBTL3	87	43
Cc1ccc(C(=O)Nc2cc(S(=O)(=O)NC3CC3)ccc2O)c(C(C)C)n1	ZINC000450568882	GF	On-Demand	Anodyne	CCR8	64	33
O=C(Nc1nccs1)[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450568892	EG	On-Demand	Anodyne	MAP1	91	39
O=C(Nc1nccs1)[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450568892	EG	On-Demand	Anodyne	PREP	27	45
O=C(Nc1nccs1)[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450568892	EG	On-Demand	Anodyne	GPBAR1	0	42
O=C(Nc1nccs1)[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450568893	EG	On-Demand	Anodyne	MAP1	91	39
O=C(Nc1nccs1)[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450568893	EG	On-Demand	Anodyne	PREP	27	45
O=C(Nc1nccs1)[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450568893	EG	On-Demand	Anodyne	GPBAR1	0	42
CCC(=O)C1(C(=O)NCCCc2ccc(Br)cc2OC)CC1	ZINC000450568908	FG	On-Demand	Anodyne	MTNR1B	19	40
CN(CC/C=C\c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450568909	EI	On-Demand	Anodyne	L3MBTL1	0	42
CN(CC/C=C\c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450568909	EI	On-Demand	Anodyne	L3MBTL3	72	42
CN(CC/C=C/c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450568910	EI	On-Demand	Anodyne	L3MBTL1	0	42
CN(CC/C=C/c1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450568910	EI	On-Demand	Anodyne	L3MBTL3	72	42
CCOC(=O)c1ccc(CN2CCC[C@H]2C(=O)Nc2nccs2)nc1	ZINC000450568911	FE	On-Demand	Anodyne	MAP1	84	36
CCOC(=O)c1ccc(CN2CCC[C@@H]2C(=O)Nc2nccs2)nc1	ZINC000450568912	FE	On-Demand	Anodyne	MAP1	84	36
Cc1cccc(O)c1NC(=O)CCCC(=O)C1CC1	ZINC000450568929	CF	On-Demand	Anodyne	ACAT	0	50
CC[C@@]1(C)COCCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450568938	CD	On-Demand	Anodyne	TRPV1	15	45
CC[C@@]1(C)COCCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450568938	CD	On-Demand	Anodyne	SHBG	18	44
CC[C@]1(C)COCCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450568939	CD	On-Demand	Anodyne	TRPV1	15	45
CC[C@]1(C)COCCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450568939	CD	On-Demand	Anodyne	SHBG	18	44
COC(=O)c1coc(CN2CCN(c3ccccc3OCCN(C)C)CC2)n1	ZINC000450568958	GD	On-Demand	Anodyne	HTR1A	94	40
COC(=O)c1coc(CN2CCN(c3ccccc3OCCN(C)C)CC2)n1	ZINC000450568958	GD	On-Demand	Anodyne	DRD2	71	41
COC(=O)c1coc(CN2CCN(c3ccccc3OCCN(C)C)CC2)n1	ZINC000450568958	GD	On-Demand	Anodyne	DRD4	41	41
COC(=O)c1coc(CN2CCN(c3ccccc3OCCN(C)C)CC2)n1	ZINC000450568958	GD	On-Demand	Anodyne	ADRA1D	67	42
COC(=O)c1coc(CN2CCN(c3ccccc3OCCN(C)C)CC2)n1	ZINC000450568958	GD	On-Demand	Anodyne	ADRA1A	61	43
COC(=O)c1coc(CN2CCN(c3ccccc3OCCN(C)C)CC2)n1	ZINC000450568958	GD	On-Demand	Anodyne	DRD3	76	41
COC(=O)c1coc(CN2CCN(c3ccccc3OCCN(C)C)CC2)n1	ZINC000450568958	GD	On-Demand	Anodyne	HTR7	57	40
COC(=O)c1coc(CN2CCN(c3ccccc3OCCN(C)C)CC2)n1	ZINC000450568958	GD	On-Demand	Anodyne	AP2S1	0	41
CCOC(=O)COc1ccc(NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450568961	FE	On-Demand	Anodyne	ENPP1	47	33
CCOC(=O)c1ccc(CN(C(C)C)C2CCC2)nc1	ZINC000450568971	CG	On-Demand	Anodyne	SCARB1	51	35
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1ccc(C(N)=O)cn1	ZINC000450568981	FG	On-Demand	Anodyne	POL	0	42
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1ccc(C(N)=O)cn1	ZINC000450568982	FG	On-Demand	Anodyne	POL	0	42
C[C@@H](C[S@@](C)=O)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450569004	DD	On-Demand	Anodyne	CTSV	43	29
C[C@H](C[S@](C)=O)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450569005	DD	On-Demand	Anodyne	CTSV	43	29
C[C@H](C[S@@](C)=O)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450569006	DD	On-Demand	Anodyne	CTSV	43	29
C[C@@H](C[S@](C)=O)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450569008	DD	On-Demand	Anodyne	CTSV	43	29
COC(=O)c1cccc(CN(C)CC(=O)NCc2ccccc2)c1Cl	ZINC000450569018	FF	On-Demand	Anodyne	PDS	41	35
C[C@H](c1ccccc1)[C@H](O)CN1CCc2ccc(S(=O)(=O)N(C)C)cc21	ZINC000450569022	FE	On-Demand	Anodyne	CCR5	15	40
CC(C)(C)OC(=O)CN(CC[C@H]1CCOC1)c1ccccc1	ZINC000450569025	DG	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)CN(CC[C@@H]1CCOC1)c1ccccc1	ZINC000450569026	DG	On-Demand	Anodyne	AMY2	44	30
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2ccc(S(=O)(=O)N(C)C)cc21	ZINC000450569027	FE	On-Demand	Anodyne	CCR5	15	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2ccc(S(=O)(=O)N(C)C)cc21	ZINC000450569029	FE	On-Demand	Anodyne	CCR5	15	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2ccc(S(=O)(=O)N(C)C)cc21	ZINC000450569030	FE	On-Demand	Anodyne	CCR5	15	40
COC(=O)c1ccc(CN(C)Cc2cccc(C)n2)cc1Cl	ZINC000450569039	DG	On-Demand	Anodyne	ACAT	48	34
CCC(=O)CCCN1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1	ZINC000450569047	FK	On-Demand	Anodyne	PTGIR	15	44
CCC(=O)CCCN1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1	ZINC000450569047	FK	On-Demand	Anodyne	CPT1A	41	33
CCC(=O)CCCN1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1	ZINC000450569047	FK	On-Demand	Anodyne	Q7YY07_CRYPV	42	30
CCC(=O)CCCN1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1	ZINC000450569048	FK	On-Demand	Anodyne	PTGIR	15	44
CCC(=O)CCCN1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1	ZINC000450569048	FK	On-Demand	Anodyne	CPT1A	41	33
CCC(=O)CCCN1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1	ZINC000450569048	FK	On-Demand	Anodyne	Q7YY07_CRYPV	42	30
COC(=O)c1ccc2c(c1)CN(C(=O)[C@@H](O)C1CCC1)CC2	ZINC000450569052	DD	On-Demand	Anodyne	HDAC6	17	42
COC(=O)c1ccc2c(c1)CN(C(=O)[C@H](O)C1CCC1)CC2	ZINC000450569053	DD	On-Demand	Anodyne	HDAC6	17	42
CC(C)(C)[C@H]1CCN(C(=O)c2ocnc2-c2ccccc2)C1	ZINC000450569054	CH	On-Demand	Anodyne	SMO	45	40
CC(C)(C)[C@@H]1CCN(C(=O)c2ocnc2-c2ccccc2)C1	ZINC000450569056	CH	On-Demand	Anodyne	SMO	45	40
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569067	EH	On-Demand	Anodyne	ERBB2	27	40
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569067	EH	On-Demand	Anodyne	MMP2	0	40
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569067	EH	On-Demand	Anodyne	ADAM10	42	40
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569067	EH	On-Demand	Anodyne	HPGD	18	43
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569069	EH	On-Demand	Anodyne	ERBB2	27	40
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569069	EH	On-Demand	Anodyne	MMP2	0	40
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569069	EH	On-Demand	Anodyne	ADAM10	42	40
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569069	EH	On-Demand	Anodyne	HPGD	18	43
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569071	EH	On-Demand	Anodyne	ERBB2	27	40
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569071	EH	On-Demand	Anodyne	MMP2	0	40
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569071	EH	On-Demand	Anodyne	ADAM10	42	40
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569071	EH	On-Demand	Anodyne	HPGD	18	43
Cc1cccc([C@@H]2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569072	EH	On-Demand	Anodyne	ERBB2	27	40
Cc1cccc([C@@H]2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569072	EH	On-Demand	Anodyne	MMP2	0	40
Cc1cccc([C@@H]2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569072	EH	On-Demand	Anodyne	ADAM10	42	40
Cc1cccc([C@@H]2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)c1	ZINC000450569072	EH	On-Demand	Anodyne	HPGD	18	43
CC(C)(C)[C@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450569077	EI	On-Demand	Anodyne	MAPK13	42	30
CCOC(=O)[C@@H]1CN(c2nn3c(C)nnc3c3ccccc23)CC12COC2	ZINC000450569080	FD	On-Demand	Anodyne	CREBBP	43	35
CCOC(=O)[C@@H]1CN(c2nn3c(C)nnc3c3ccccc23)CC12COC2	ZINC000450569080	FD	On-Demand	Anodyne	CECR2	0	40
CCOC(=O)[C@@H]1CN(c2nn3c(C)nnc3c3ccccc23)CC12COC2	ZINC000450569080	FD	On-Demand	Anodyne	BRD9	54	35
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450569081	EI	On-Demand	Anodyne	MAPK13	42	30
O=C(c1cccc(O)c1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450569083	EG	On-Demand	Anodyne	SLC6A5	32	42
O=C(c1cccc(O)c1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450569084	EG	On-Demand	Anodyne	SLC6A5	32	42
CCOC(=O)[C@H]1CN(c2nn3c(C)nnc3c3ccccc23)CC12COC2	ZINC000450569092	FD	On-Demand	Anodyne	CREBBP	43	35
CCOC(=O)[C@H]1CN(c2nn3c(C)nnc3c3ccccc23)CC12COC2	ZINC000450569092	FD	On-Demand	Anodyne	CECR2	0	40
CCOC(=O)[C@H]1CN(c2nn3c(C)nnc3c3ccccc23)CC12COC2	ZINC000450569092	FD	On-Demand	Anodyne	BRD9	54	35
CCC[C@@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450569095	DF	On-Demand	Anodyne	MMP8	30	46
CCC[C@@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450569095	DF	On-Demand	Anodyne	CAPN1	24	48
CCC[C@@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450569095	DF	On-Demand	Anodyne	CAPN2	32	49
CCC[C@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450569097	DF	On-Demand	Anodyne	MMP8	30	46
CCC[C@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450569097	DF	On-Demand	Anodyne	CAPN1	24	48
CCC[C@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450569097	DF	On-Demand	Anodyne	CAPN2	32	49
CCc1ccc([C@H](CO)NC(=O)c2cc(S(C)(=O)=O)ccc2CC)cc1	ZINC000450569101	GF	On-Demand	Anodyne	PTGER3	66	34
CCc1ccc([C@@H](CO)NC(=O)c2cc(S(C)(=O)=O)ccc2CC)cc1	ZINC000450569104	GF	On-Demand	Anodyne	PTGER3	66	34
COC(=O)C1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCCCC1	ZINC000450569112	FG	On-Demand	Anodyne	HCN1	42	35
CC(=O)NC1CCC(N(C)C(=O)c2cc(Cl)c3ccccc3n2)CC1	ZINC000450569114	FG	On-Demand	Anodyne	TNKS	52	33
COc1ccc(CNC(=O)CCNC(C)(C)c2ccccc2OC)c(OC)c1	ZINC000450569144	GG	On-Demand	Anodyne	HTR7	21	40
COc1ccc(CNC(=O)CCNC(C)(C)c2ccccc2OC)c(OC)c1	ZINC000450569144	GG	On-Demand	Anodyne	MTNR1A	85	39
COc1ccc(CNC(=O)CCNC(C)(C)c2ccccc2OC)c(OC)c1	ZINC000450569144	GG	On-Demand	Anodyne	MTNR1B	76	38
COc1ccc(CNC(=O)CCNC(C)(C)c2ccccc2OC)c(OC)c1	ZINC000450569144	GG	On-Demand	Anodyne	MT-ND1	15	40
COc1cc(OC)c2ncnc(NC[C@@H](O)Cc3cccc(F)c3)c2c1	ZINC000450569148	FE	On-Demand	Anodyne	PDE6A	41	32
COc1cc(OC)c2ncnc(NC[C@@H](O)Cc3cccc(F)c3)c2c1	ZINC000450569148	FE	On-Demand	Anodyne	CLK4	16	46
Cc1cccc(-c2noc(SCC(=O)N3CCOC[C@@H]3C(N)=O)n2)c1	ZINC000450569151	FC	On-Demand	Anodyne	GRM5	0	45
Cc1cccc(-c2noc(SCC(=O)N3CCOC[C@H]3C(N)=O)n2)c1	ZINC000450569152	FC	On-Demand	Anodyne	GRM5	0	45
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450569156	FI	On-Demand	Anodyne	GPBAR1	40	35
COc1cc(OC)c2ncnc(NC[C@H](O)Cc3cccc(F)c3)c2c1	ZINC000450569160	FE	On-Demand	Anodyne	PDE6A	41	32
COc1cc(OC)c2ncnc(NC[C@H](O)Cc3cccc(F)c3)c2c1	ZINC000450569160	FE	On-Demand	Anodyne	CLK4	16	46
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450569170	FI	On-Demand	Anodyne	GPBAR1	40	35
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450569171	FI	On-Demand	Anodyne	GPBAR1	40	35
COc1cccc([C@H]2C[C@H](C)CN2C(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450569173	FI	On-Demand	Anodyne	GPBAR1	40	35
COc1cccc(Oc2ccc(C(=O)NCC3(CO)CCC3)nc2)c1	ZINC000450569174	EF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N[C@@H](CO)c2ccc(Br)cc2)c1	ZINC000450569180	GG	On-Demand	Anodyne	MTNR1A	36	45
COc1cccc(OCCC(=O)N[C@@H](CO)c2ccc(Br)cc2)c1	ZINC000450569180	GG	On-Demand	Anodyne	MTNR1B	37	45
COc1cccc(OCCC(=O)N[C@@H](CO)c2ccc(Br)cc2)c1	ZINC000450569180	GG	On-Demand	Anodyne	GPR88	0	46
COc1cccc(OCCC(=O)N[C@H](CO)c2ccc(Br)cc2)c1	ZINC000450569182	GG	On-Demand	Anodyne	MTNR1A	36	45
COc1cccc(OCCC(=O)N[C@H](CO)c2ccc(Br)cc2)c1	ZINC000450569182	GG	On-Demand	Anodyne	MTNR1B	37	45
COc1cccc(OCCC(=O)N[C@H](CO)c2ccc(Br)cc2)c1	ZINC000450569182	GG	On-Demand	Anodyne	GPR88	0	46
C[C@@H](CCO)CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450569186	EE	On-Demand	Anodyne	LRRK2	27	41
CN(CCN1CCC(Oc2ccccn2)CC1)Cc1ccccc1	ZINC000450569187	EG	On-Demand	Anodyne	SIGMAR1	37	42
CN(CCN1CCC(Oc2ccccn2)CC1)Cc1ccccc1	ZINC000450569187	EG	On-Demand	Anodyne	SCN9A	0	40
CN(CCN1CCC(Oc2ccccn2)CC1)Cc1ccccc1	ZINC000450569187	EG	On-Demand	Anodyne	SCN5A	57	36
C[C@H](CCO)CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450569190	EE	On-Demand	Anodyne	LRRK2	27	41
O=C(Cc1scnc1-c1ccccc1)N1CCC(Cc2cccnc2)CC1	ZINC000450569202	GI	On-Demand	Anodyne	GRIN2B	57	43
O=C(Cc1scnc1-c1ccccc1)N1CCC(Cc2cccnc2)CC1	ZINC000450569202	GI	On-Demand	Anodyne	CHRNA7	47	41
O=C(Cc1scnc1-c1ccccc1)N1CCC(Cc2cccnc2)CC1	ZINC000450569202	GI	On-Demand	Anodyne	C3AR1	49	43
O=C(Cc1scnc1-c1ccccc1)N1CCC(Cc2cccnc2)CC1	ZINC000450569202	GI	On-Demand	Anodyne	ACHP_LYMST	23	41
CCC(=O)CCCN1CCC(Oc2ccccn2)CC1	ZINC000450569206	CF	On-Demand	Anodyne	HTR1A	24	40
CCC(=O)CCCN1CCC(Oc2ccccn2)CC1	ZINC000450569206	CF	On-Demand	Anodyne	SCN5A	45	34
CCC(=O)CCCN1CCC(Oc2ccccn2)CC1	ZINC000450569206	CF	On-Demand	Anodyne	CYP2J2	51	36
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C2)c1	ZINC000450569216	DG	On-Demand	Anodyne	L3MBTL3	49	34
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)Cc1nnc(C2CC2)s1	ZINC000450569220	GI	On-Demand	Anodyne	RBP4	50	31
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C2)c1	ZINC000450569223	DG	On-Demand	Anodyne	L3MBTL3	49	34
O=C(NCC(=O)N1CCC[C@@H]1c1ncc[nH]1)Nc1cccc(Cl)c1	ZINC000450569229	EF	On-Demand	Anodyne	PRCP	41	36
O=C(NCC(=O)N1CCC[C@@H]1c1ncc[nH]1)Nc1cccc(Cl)c1	ZINC000450569229	EF	On-Demand	Anodyne	COLA	47	43
O=C(NCC(=O)N1CCC[C@@H]1c1ncc[nH]1)Nc1cccc(Cl)c1	ZINC000450569229	EF	On-Demand	Anodyne	FAP	0	40
O=C(NCC(=O)N1CCC[C@H]1c1ncc[nH]1)Nc1cccc(Cl)c1	ZINC000450569231	EF	On-Demand	Anodyne	PRCP	41	36
O=C(NCC(=O)N1CCC[C@H]1c1ncc[nH]1)Nc1cccc(Cl)c1	ZINC000450569231	EF	On-Demand	Anodyne	COLA	47	43
O=C(NCC(=O)N1CCC[C@H]1c1ncc[nH]1)Nc1cccc(Cl)c1	ZINC000450569231	EF	On-Demand	Anodyne	FAP	0	40
COC(=O)c1cccc(CN2CCN(c3ncc(C)s3)CC2)c1Cl	ZINC000450569249	FG	On-Demand	Anodyne	PARE	43	37
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)ncnc2cc1F	ZINC000450569256	DG	On-Demand	Anodyne	EGFR	22	40
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)ncnc2cc1F	ZINC000450569256	DG	On-Demand	Anodyne	PDE3A	58	44
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)ncnc2cc1F	ZINC000450569256	DG	On-Demand	Anodyne	PDGFRB	67	39
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)ncnc2cc1F	ZINC000450569256	DG	On-Demand	Anodyne	PDE3B	85	44
Cc1cccc([C@H]2CCN(C(=O)c3cccc(C#N)c3Br)C2)c1	ZINC000450569265	FI	On-Demand	Mild	HPGD	16	40
C[C@H](CCNC(=O)c1cccc(C#N)c1Br)N1CCCCC1	ZINC000450569269	FG	On-Demand	Mild	CCR5	15	41
Cc1cccc([C@@H]2CCN(C(=O)c3cccc(C#N)c3Br)C2)c1	ZINC000450569271	FI	On-Demand	Mild	HPGD	16	40
Cc1cccc([C@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)c1	ZINC000450569273	FI	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1cccc([C@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)c1	ZINC000450569273	FI	On-Demand	Anodyne	CCR5	24	42
Cc1cccc([C@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)c1	ZINC000450569273	FI	On-Demand	Anodyne	TPSAB1	28	40
Cc1cccc([C@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)c1	ZINC000450569273	FI	On-Demand	Anodyne	HPGD	16	43
C[C@@H](CCNC(=O)c1cccc(C#N)c1Br)N1CCCCC1	ZINC000450569276	FG	On-Demand	Mild	CCR5	15	41
Cc1cccc([C@@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)c1	ZINC000450569280	FI	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1cccc([C@@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)c1	ZINC000450569280	FI	On-Demand	Anodyne	CCR5	24	42
Cc1cccc([C@@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)c1	ZINC000450569280	FI	On-Demand	Anodyne	TPSAB1	28	40
Cc1cccc([C@@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)c1	ZINC000450569280	FI	On-Demand	Anodyne	HPGD	16	43
COc1ccc(C2(CNC(=O)c3ccc(C#N)n3C)CCC2)cc1	ZINC000450569282	DF	On-Demand	Mild	ACAT	0	48
COC(=O)c1coc(CN2CCc3[nH]c4ccccc4c3C2)n1	ZINC000450569319	DF	On-Demand	Anodyne	HTR5A	15	46
CCOC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)nc1	ZINC000450569323	FE	On-Demand	Anodyne	OPRD1	22	41
CCOC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)nc1	ZINC000450569323	FE	On-Demand	Anodyne	CHRM3	15	47
CCOC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)nc1	ZINC000450569323	FE	On-Demand	Anodyne	SSTR5	48	42
COc1cc(CC(=O)NCC[C@@H]2CCOC2)ccc1Cl	ZINC000450569343	CE	On-Demand	Anodyne	TRPV1	22	42
COc1cc(CC(=O)NCC[C@@H]2CCOC2)ccc1Cl	ZINC000450569343	CE	On-Demand	Anodyne	NCE103	28	49
COc1cc(CC(=O)NCC[C@H]2CCOC2)ccc1Cl	ZINC000450569345	CE	On-Demand	Anodyne	TRPV1	22	42
COc1cc(CC(=O)NCC[C@H]2CCOC2)ccc1Cl	ZINC000450569345	CE	On-Demand	Anodyne	NCE103	28	49
COc1cc(CC(=O)NCC[C@H](C)N2CCCCC2)ccc1Cl	ZINC000450569346	EG	On-Demand	Anodyne	OPRK1	37	50
COc1cc(CC(=O)NCC[C@H](C)N2CCCCC2)ccc1Cl	ZINC000450569346	EG	On-Demand	Anodyne	ABCC8	26	43
COc1cc(CC(=O)NCC[C@H](C)N2CCCCC2)ccc1Cl	ZINC000450569346	EG	On-Demand	Anodyne	TRPV1	29	42
COc1cc(CC(=O)NCC[C@H](C)N2CCCCC2)ccc1Cl	ZINC000450569346	EG	On-Demand	Anodyne	NCE103	27	47
COc1cc(CC(=O)NCC[C@H](C)N2CCCCC2)ccc1Cl	ZINC000450569346	EG	On-Demand	Anodyne	CAN2	0	47
COc1cc(CC(=O)NCC[C@@H](C)N2CCCCC2)ccc1Cl	ZINC000450569348	EG	On-Demand	Anodyne	OPRK1	37	50
COc1cc(CC(=O)NCC[C@@H](C)N2CCCCC2)ccc1Cl	ZINC000450569348	EG	On-Demand	Anodyne	ABCC8	26	43
COc1cc(CC(=O)NCC[C@@H](C)N2CCCCC2)ccc1Cl	ZINC000450569348	EG	On-Demand	Anodyne	TRPV1	29	42
COc1cc(CC(=O)NCC[C@@H](C)N2CCCCC2)ccc1Cl	ZINC000450569348	EG	On-Demand	Anodyne	NCE103	27	47
COc1cc(CC(=O)NCC[C@@H](C)N2CCCCC2)ccc1Cl	ZINC000450569348	EG	On-Demand	Anodyne	CAN2	0	47
COC(=O)C1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450569349	DE	On-Demand	Mild	HCN4	49	33
C[C@@H](CCNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)N1CCCCC1	ZINC000450569350	FF	On-Demand	Anodyne	CCR5	39	40
C[C@H](CCNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)N1CCCCC1	ZINC000450569351	FF	On-Demand	Anodyne	CCR5	39	40
C[C@@H](CCO)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450569352	EG	On-Demand	Anodyne	KCNK3	49	40
C[C@@H](CCO)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450569352	EG	On-Demand	Anodyne	KCNK9	23	40
C[C@H](CCO)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450569354	EG	On-Demand	Anodyne	KCNK3	49	40
C[C@H](CCO)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450569354	EG	On-Demand	Anodyne	KCNK9	23	40
CC(=O)NC1CCC(N(C)C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450569356	FF	On-Demand	Anodyne	FASN	25	43
COc1cc(CC(=O)N2CCOC[C@@H]2C(N)=O)ccc1Cl	ZINC000450569366	DC	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CCOC[C@@H]2C(N)=O)ccc1Cl	ZINC000450569366	DC	On-Demand	Anodyne	OPRK1	44	42
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@H]3C2)c(OC)c1	ZINC000450569367	FD	On-Demand	Anodyne	HTR1A	15	41
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@H]3C2)c(OC)c1	ZINC000450569367	FD	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@H]3C2)c(OC)c1	ZINC000450569367	FD	On-Demand	Anodyne	HTR7	25	41
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@H]3C2)c(OC)c1	ZINC000450569367	FD	On-Demand	Anodyne	SIGMAR1	18	42
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@H]3C2)c(OC)c1	ZINC000450569367	FD	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@H]3C2)c(OC)c1	ZINC000450569367	FD	On-Demand	Anodyne	EBP	43	42
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@@H]3C2)c(OC)c1	ZINC000450569369	FD	On-Demand	Anodyne	HTR1A	15	41
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@@H]3C2)c(OC)c1	ZINC000450569369	FD	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@@H]3C2)c(OC)c1	ZINC000450569369	FD	On-Demand	Anodyne	HTR7	25	41
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@@H]3C2)c(OC)c1	ZINC000450569369	FD	On-Demand	Anodyne	SIGMAR1	18	42
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@@H]3C2)c(OC)c1	ZINC000450569369	FD	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN2CCN3CCCC[C@@H]3C2)c(OC)c1	ZINC000450569369	FD	On-Demand	Anodyne	EBP	43	42
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cnn4ccc(C)cc34)C2)c1	ZINC000450569370	EH	On-Demand	Anodyne	EPHB3	28	42
COc1cc(CC(=O)N2CCOC[C@H]2C(N)=O)ccc1Cl	ZINC000450569375	DC	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CCOC[C@H]2C(N)=O)ccc1Cl	ZINC000450569375	DC	On-Demand	Anodyne	OPRK1	44	42
C[C@@H](CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450569376	FE	On-Demand	Anodyne	CCR3	137	51
C[C@@H](CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450569376	FE	On-Demand	Anodyne	CYP2D6	19	49
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cnn4ccc(C)cc34)C2)c1	ZINC000450569378	EH	On-Demand	Anodyne	EPHB3	28	42
Fc1ccc(-c2cnc([C@@H]3CCCN3CCc3cscn3)[nH]2)cc1	ZINC000450569382	EI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
C[C@H](CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450569383	FE	On-Demand	Anodyne	CCR3	137	51
C[C@H](CN1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450569383	FE	On-Demand	Anodyne	CYP2D6	19	49
Fc1ccc(-c2cnc([C@H]3CCCN3CCc3cscn3)[nH]2)cc1	ZINC000450569384	EI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
C[C@@H](CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450569385	FE	On-Demand	Anodyne	CCR3	137	51
C[C@@H](CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450569385	FE	On-Demand	Anodyne	CYP2D6	19	49
C[C@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569386	GG	On-Demand	Bother	COLA	85	34
C[C@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569386	GG	On-Demand	Bother	MTNN	45	35
C[C@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569386	GG	On-Demand	Bother	BCL2L1	71	39
C[C@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569386	GG	On-Demand	Bother	BCL2	61	35
C[C@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569386	GG	On-Demand	Bother	MCL1	0	44
C[C@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569386	GG	On-Demand	Bother	LIMK2	43	35
C[C@H](CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450569387	FE	On-Demand	Anodyne	CCR3	137	51
C[C@H](CN1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1)S(C)(=O)=O	ZINC000450569387	FE	On-Demand	Anodyne	CYP2D6	19	49
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569388	GG	On-Demand	Bother	COLA	85	34
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569388	GG	On-Demand	Bother	MTNN	45	35
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569388	GG	On-Demand	Bother	BCL2L1	71	39
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569388	GG	On-Demand	Bother	BCL2	61	35
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569388	GG	On-Demand	Bother	MCL1	0	44
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450569388	GG	On-Demand	Bother	LIMK2	43	35
O=C(NC[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)Nc1cccc(F)c1	ZINC000450569409	FG	On-Demand	Anodyne	CCR3	128	53
O=C(NC[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)Nc1cccc(F)c1	ZINC000450569409	FG	On-Demand	Anodyne	CYP2D6	19	45
O=C(NC[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)Nc1cccc(F)c1	ZINC000450569411	FG	On-Demand	Anodyne	CCR3	128	53
O=C(NC[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)Nc1cccc(F)c1	ZINC000450569411	FG	On-Demand	Anodyne	CYP2D6	19	45
O=C(NC[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)Nc1cccc(F)c1	ZINC000450569414	FG	On-Demand	Anodyne	CCR3	128	53
O=C(NC[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)Nc1cccc(F)c1	ZINC000450569414	FG	On-Demand	Anodyne	CYP2D6	19	45
O=C(NC[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)Nc1cccc(F)c1	ZINC000450569416	FG	On-Demand	Anodyne	CCR3	128	53
O=C(NC[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)Nc1cccc(F)c1	ZINC000450569416	FG	On-Demand	Anodyne	CYP2D6	19	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569426	FE	On-Demand	Anodyne	DRD4	17	48
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569426	FE	On-Demand	Anodyne	SIGMAR1	17	49
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569426	FE	On-Demand	Anodyne	ACOX1	50	38
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569426	FE	On-Demand	Anodyne	EPHX2	29	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569426	FE	On-Demand	Anodyne	BIRC2	57	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569426	FE	On-Demand	Anodyne	NMUR2	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569426	FE	On-Demand	Anodyne	NMUR1	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569426	FE	On-Demand	Anodyne	SCARB1	41	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569427	FE	On-Demand	Anodyne	DRD4	17	48
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569427	FE	On-Demand	Anodyne	SIGMAR1	17	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569427	FE	On-Demand	Anodyne	ACOX1	50	38
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569427	FE	On-Demand	Anodyne	EPHX2	29	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569427	FE	On-Demand	Anodyne	BIRC2	57	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569427	FE	On-Demand	Anodyne	NMUR2	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569427	FE	On-Demand	Anodyne	NMUR1	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569427	FE	On-Demand	Anodyne	SCARB1	41	37
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569428	FE	On-Demand	Anodyne	DRD4	17	48
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569428	FE	On-Demand	Anodyne	SIGMAR1	17	49
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569428	FE	On-Demand	Anodyne	ACOX1	50	38
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569428	FE	On-Demand	Anodyne	EPHX2	29	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569428	FE	On-Demand	Anodyne	BIRC2	57	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569428	FE	On-Demand	Anodyne	NMUR2	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569428	FE	On-Demand	Anodyne	NMUR1	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569428	FE	On-Demand	Anodyne	SCARB1	41	37
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569429	FE	On-Demand	Anodyne	DRD4	17	48
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569429	FE	On-Demand	Anodyne	SIGMAR1	17	49
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569429	FE	On-Demand	Anodyne	ACOX1	50	38
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569429	FE	On-Demand	Anodyne	EPHX2	29	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569429	FE	On-Demand	Anodyne	BIRC2	57	45
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569429	FE	On-Demand	Anodyne	NMUR2	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569429	FE	On-Demand	Anodyne	NMUR1	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000450569429	FE	On-Demand	Anodyne	SCARB1	41	37
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)C(C)(C)O)ccc21	ZINC000450569448	FG	On-Demand	Anodyne	PDGFRB	15	49
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)C(C)(C)O)ccc21	ZINC000450569448	FG	On-Demand	Anodyne	CPT1A	47	33
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)C(C)(C)O)ccc21	ZINC000450569448	FG	On-Demand	Anodyne	HPGD	49	61
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)C(C)(C)O	ZINC000450569450	DG	On-Demand	Anodyne	SORT1	16	43
C[C@H](O)CCn1cnc2scc(-c3ccc(F)cc3)c2c1=O	ZINC000450569455	DG	On-Demand	Anodyne	TGM2	18	42
C[C@@H](O)CCn1cnc2scc(-c3ccc(F)cc3)c2c1=O	ZINC000450569456	DG	On-Demand	Anodyne	TGM2	18	42
C[C@H](Cn1nnc(-c2ccccc2)n1)S(C)(=O)=O	ZINC000450569457	CC	On-Demand	Anodyne	SCARB1	37	42
C[C@@H](Cn1nnc(-c2ccccc2)n1)S(C)(=O)=O	ZINC000450569458	CC	On-Demand	Anodyne	SCARB1	37	42
COc1cc(CN2CCC[C@@H]2C(=O)Nc2nccs2)ccc1Cl	ZINC000450569461	FG	On-Demand	Anodyne	DRD2	41	35
COc1cc(CN2CCC[C@@H]2C(=O)Nc2nccs2)ccc1Cl	ZINC000450569461	FG	On-Demand	Anodyne	SSTR5	40	38
COc1cc(CN2CCC[C@@H]2C(=O)Nc2nccs2)ccc1Cl	ZINC000450569461	FG	On-Demand	Anodyne	MAP1	107	38
COc1cc(CN2CCC[C@H]2C(=O)Nc2nccs2)ccc1Cl	ZINC000450569462	FG	On-Demand	Anodyne	DRD2	41	35
COc1cc(CN2CCC[C@H]2C(=O)Nc2nccs2)ccc1Cl	ZINC000450569462	FG	On-Demand	Anodyne	SSTR5	40	38
COc1cc(CN2CCC[C@H]2C(=O)Nc2nccs2)ccc1Cl	ZINC000450569462	FG	On-Demand	Anodyne	MAP1	107	38
O=C(CN(Cc1cccnc1)C[C@@H]1COCCO1)Nc1ccc(Cl)cc1	ZINC000450569474	GF	On-Demand	Anodyne	NAMPT	40	41
O=C(CN(Cc1cccnc1)C[C@@H]1COCCO1)Nc1ccc(Cl)cc1	ZINC000450569474	GF	On-Demand	Anodyne	NR1D1	45	39
O=C(CN(Cc1cccnc1)C[C@H]1COCCO1)Nc1ccc(Cl)cc1	ZINC000450569475	GF	On-Demand	Anodyne	NAMPT	40	41
O=C(CN(Cc1cccnc1)C[C@H]1COCCO1)Nc1ccc(Cl)cc1	ZINC000450569475	GF	On-Demand	Anodyne	NR1D1	45	39
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450569476	FI	On-Demand	Anodyne	MAPK1	35	43
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450569476	FI	On-Demand	Anodyne	EPHX2	32	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450569476	FI	On-Demand	Anodyne	TYK2	41	33
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450569476	FI	On-Demand	Anodyne	ERBB4	46	35
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450569476	FI	On-Demand	Anodyne	ENV	46	35
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450569476	FI	On-Demand	Anodyne	MCHR1	48	46
CN(C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569482	EI	On-Demand	Anodyne	CHRM2	18	41
CN(C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569482	EI	On-Demand	Anodyne	DRD2	18	42
CN(C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569482	EI	On-Demand	Anodyne	DRD4	45	41
CN(C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569482	EI	On-Demand	Anodyne	ACHE	44	48
CN(C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569482	EI	On-Demand	Anodyne	SIGMAR1	97	49
CN(C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569482	EI	On-Demand	Anodyne	CCR5	29	40
CN(C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569482	EI	On-Demand	Anodyne	CACNA1G	30	49
CN(C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569483	EI	On-Demand	Anodyne	CHRM2	18	41
CN(C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569483	EI	On-Demand	Anodyne	DRD2	18	42
CN(C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569483	EI	On-Demand	Anodyne	DRD4	45	41
CN(C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569483	EI	On-Demand	Anodyne	ACHE	44	48
CN(C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569483	EI	On-Demand	Anodyne	SIGMAR1	97	49
CN(C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569483	EI	On-Demand	Anodyne	CCR5	29	40
CN(C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000450569483	EI	On-Demand	Anodyne	CACNA1G	30	49
CN(CC1(C#N)CCC1)C1CCN(Cc2ccccc2)CC1	ZINC000450569486	CG	On-Demand	Mild	DRD2	0	52
CN(CC1(C#N)CCC1)C1CCN(Cc2ccccc2)CC1	ZINC000450569486	CG	On-Demand	Mild	ACHE	33	41
CN(CC1(C#N)CCC1)C1CCN(Cc2ccccc2)CC1	ZINC000450569486	CG	On-Demand	Mild	DRD3	0	40
CN(CC1(C#N)CCC1)C1CCN(Cc2ccccc2)CC1	ZINC000450569486	CG	On-Demand	Mild	SIGMAR1	78	52
CN(CC1(C#N)CCC1)C1CCN(Cc2ccccc2)CC1	ZINC000450569486	CG	On-Demand	Mild	NPFFR1	42	33
C[C@@H]1CCc2c(sc3ncn(CCC(C)(F)F)c(=O)c23)C1	ZINC000450569501	DH	On-Demand	Anodyne	HTR1B	18	44
C[C@H]1CCc2c(sc3ncn(CCC(C)(F)F)c(=O)c23)C1	ZINC000450569502	DH	On-Demand	Anodyne	HTR1B	21	44
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450569522	FJ	On-Demand	Anodyne	MAPK1	29	41
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450569522	FJ	On-Demand	Anodyne	EPHX2	27	45
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450569522	FJ	On-Demand	Anodyne	ERBB4	40	34
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450569522	FJ	On-Demand	Anodyne	ENV	47	36
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450569522	FJ	On-Demand	Anodyne	MCHR1	48	46
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450569523	FJ	On-Demand	Anodyne	MAPK1	29	41
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450569523	FJ	On-Demand	Anodyne	EPHX2	27	45
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450569523	FJ	On-Demand	Anodyne	ERBB4	40	34
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450569523	FJ	On-Demand	Anodyne	ENV	47	36
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450569523	FJ	On-Demand	Anodyne	MCHR1	48	46
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	DRD2	23	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	DRD4	49	43
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	ACHE	31	43
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	HRH2	24	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	CHRM3	25	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	SIGMAR1	37	56
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	NPY2R	48	46
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	CCR3	77	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	F2R	40	30
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	GUAB	0	46
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	MAPK1	35	46
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	FAAH	24	40
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	CCR2	18	41
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	EPHX2	33	41
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	TYK2	42	38
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	CXCR3	39	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	MCHR1	96	45
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	CACNA1G	53	44
CC(=O)c1cccc(CN2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c1	ZINC000450569525	GJ	On-Demand	Anodyne	CACNA1I	43	36
CC[C@@]1(C)COCCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450569540	EE	On-Demand	Anodyne	EPHX2	22	42
CC[C@]1(C)COCCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450569541	EE	On-Demand	Anodyne	EPHX2	22	42
CCn1ccnc(N[C@@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450569542	FF	On-Demand	Anodyne	CASP8	40	34
CCn1ccnc(N[C@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450569543	FF	On-Demand	Anodyne	CASP8	40	34
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1nccnc1C#N	ZINC000450569544	FG	On-Demand	Mild	PAPA1_CARPA	45	41
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1nccnc1C#N	ZINC000450569544	FG	On-Demand	Mild	CTRB_BOVIN	55	32
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1nccnc1C#N	ZINC000450569544	FG	On-Demand	Mild	POL	0	41
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1nccnc1C#N	ZINC000450569545	FG	On-Demand	Mild	PAPA1_CARPA	45	41
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1nccnc1C#N	ZINC000450569545	FG	On-Demand	Mild	CTRB_BOVIN	55	32
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1nccnc1C#N	ZINC000450569545	FG	On-Demand	Mild	POL	0	41
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450569559	EF	On-Demand	Anodyne	AOC3	33	40
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450569560	EF	On-Demand	Anodyne	AOC3	33	40
COC(=O)[C@H](c1ccccc1)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450569562	EF	On-Demand	Anodyne	AOC3	33	40
COC(=O)[C@H](c1ccccc1)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450569563	EF	On-Demand	Anodyne	AOC3	33	40
CC1CCN(C(=O)c2ccc(NC[C@@H](O)Cc3cccc(F)c3)nc2)CC1	ZINC000450569572	FG	On-Demand	Anodyne	BDKRB1	23	41
CC1CCN(C(=O)c2ccc(NC[C@H](O)Cc3cccc(F)c3)nc2)CC1	ZINC000450569573	FG	On-Demand	Anodyne	BDKRB1	23	41
CCOC(=O)c1ccc(CN(C)[C@H](C(=O)OC)c2ccccc2)nc1	ZINC000450569580	EF	On-Demand	Anodyne	P2RY12	19	42
CCOC(=O)c1ccc(CN(C)[C@@H](C(=O)OC)c2ccccc2)nc1	ZINC000450569581	EF	On-Demand	Anodyne	P2RY12	19	42
COc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450569602	DH	On-Demand	Anodyne	GSK3B	0	56
COc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450569602	DH	On-Demand	Anodyne	GSK3A	34	48
COc1ccc(-c2nnc(SC[C@H]3CCC(F)(F)C3)o2)cc1	ZINC000450569603	EI	On-Demand	Anodyne	GSK3A	25	44
CC(C)(C)C(=O)Nc1ccc(C(=O)NCCCNc2ccccc2F)cn1	ZINC000450569605	FG	On-Demand	Anodyne	F10	0	40
CC(C)(C)C(=O)Nc1ccc(C(=O)NCCCNc2ccccc2F)cn1	ZINC000450569605	FG	On-Demand	Anodyne	HDAC1	0	41
CC(C)(C)C(=O)Nc1ccc(C(=O)NCCCNc2ccccc2F)cn1	ZINC000450569605	FG	On-Demand	Anodyne	GCK	19	41
COc1ccc(-c2nnc(SC[C@@H]3CCC(F)(F)C3)o2)cc1	ZINC000450569612	EI	On-Demand	Anodyne	GSK3A	25	44
O=C(CSC1CC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569617	EH	On-Demand	Anodyne	CACNA1B	47	36
O=C(CSC1CC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569617	EH	On-Demand	Anodyne	CCR2	62	45
O=C(CSC1CC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569617	EH	On-Demand	Anodyne	RBP4	26	43
O=C(CSC1CC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569617	EH	On-Demand	Anodyne	LIPG	50	33
O=C(CSC1CC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569621	EH	On-Demand	Anodyne	CACNA1B	47	36
O=C(CSC1CC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569621	EH	On-Demand	Anodyne	CCR2	62	45
O=C(CSC1CC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569621	EH	On-Demand	Anodyne	RBP4	26	43
O=C(CSC1CC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569621	EH	On-Demand	Anodyne	LIPG	50	33
CC(=O)c1ccc(CN2C(=O)NC3(CCC(C(C)(C)C)CC3)C2=O)cc1	ZINC000450569635	FH	On-Demand	Anodyne	GCGR	41	39
CC(=O)c1ccc(CN2C(=O)NC3(CCC(C(C)(C)C)CC3)C2=O)cc1	ZINC000450569635	FH	On-Demand	Anodyne	CYP2J2	44	31
CCOC(=O)[C@@H]1CN(c2cc(C)nc3c(OC)cccc23)CC12COC2	ZINC000450569645	FF	On-Demand	Anodyne	BDKRB2	41	30
CCOC(=O)[C@H]1CN(c2cc(C)nc3c(OC)cccc23)CC12COC2	ZINC000450569653	FF	On-Demand	Anodyne	BDKRB2	41	30
COc1ccc(C2(CNC(=O)c3cc(C#N)[nH]c3C)CCC2)cc1	ZINC000450569655	DG	On-Demand	Mild	KCNA3	42	42
COc1ccc(C2(CNC(=O)c3cc(C#N)[nH]c3C)CCC2)cc1	ZINC000450569655	DG	On-Demand	Mild	ACAT	0	44
Cc1nnc2c3ccccc3c(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)nn12	ZINC000450569657	DF	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)nn12	ZINC000450569657	DF	On-Demand	Anodyne	BRD9	55	36
COC(=O)C1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCCCC1	ZINC000450569658	EF	On-Demand	Anodyne	HCN1	49	32
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450569681	GF	On-Demand	Bother	CACNA1D	46	36
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450569683	GF	On-Demand	Bother	CACNA1D	46	36
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450569686	GF	On-Demand	Bother	CACNA1D	46	36
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000450569689	GF	On-Demand	Bother	CACNA1D	46	36
C[C@H](C[S@](C)=O)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450569691	ED	On-Demand	Bother	CACNA1D	42	36
C[C@@H](C[S@@](C)=O)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450569692	ED	On-Demand	Bother	CACNA1D	42	36
C[C@H](C[S@@](C)=O)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450569695	ED	On-Demand	Bother	CACNA1D	42	36
C[C@@H](C[S@](C)=O)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450569697	ED	On-Demand	Bother	CACNA1D	42	36
COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1Cl	ZINC000450569706	GF	On-Demand	Anodyne	DRD2	22	41
COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1Cl	ZINC000450569706	GF	On-Demand	Anodyne	DRD4	47	39
COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1Cl	ZINC000450569706	GF	On-Demand	Anodyne	HTR4	25	42
COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1Cl	ZINC000450569706	GF	On-Demand	Anodyne	SIGMAR1	32	43
COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1Cl	ZINC000450569706	GF	On-Demand	Anodyne	CCR3	30	40
COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1Cl	ZINC000450569706	GF	On-Demand	Anodyne	FAAH	24	43
COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3O)CC2)cc1Cl	ZINC000450569706	GF	On-Demand	Anodyne	CACNA1G	22	42
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450569710	ED	On-Demand	Bother	SLC27A4	51	33
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450569714	ED	On-Demand	Bother	SLC27A4	51	33
CN(CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1	ZINC000450569715	FF	On-Demand	Bother	SIGMAR1	24	42
CN(CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1	ZINC000450569715	FF	On-Demand	Bother	CCR5	27	44
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450569717	ED	On-Demand	Bother	SLC27A4	51	33
CN(CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1	ZINC000450569718	FF	On-Demand	Bother	SIGMAR1	24	42
CN(CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1	ZINC000450569718	FF	On-Demand	Bother	CCR5	27	44
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1nccc(CO)n1	ZINC000450569719	FG	On-Demand	Anodyne	POL	0	42
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450569721	ED	On-Demand	Bother	SLC27A4	51	33
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1nccc(CO)n1	ZINC000450569723	FG	On-Demand	Anodyne	POL	0	42
C[C@H](CCO)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450569724	FC	On-Demand	Anodyne	TGM2	22	41
C[C@H](CCO)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450569724	FC	On-Demand	Anodyne	GCKR	58	31
CC(=O)[C@@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569734	ED	On-Demand	Anodyne	HTR1A	76	40
CC(=O)[C@@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569734	ED	On-Demand	Anodyne	DRD2	67	43
CC(=O)[C@@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569734	ED	On-Demand	Anodyne	ADRA1D	72	47
CC(=O)[C@@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569734	ED	On-Demand	Anodyne	HTR2A	30	42
CC(=O)[C@@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569734	ED	On-Demand	Anodyne	ADRA1A	48	39
CC(=O)[C@@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569734	ED	On-Demand	Anodyne	DRD3	54	42
CC(=O)[C@@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569734	ED	On-Demand	Anodyne	HTR7	53	41
CC(=O)[C@@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569734	ED	On-Demand	Anodyne	AP2S1	0	43
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450569744	FC	On-Demand	Anodyne	TGM2	22	41
C[C@@H](CCO)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450569744	FC	On-Demand	Anodyne	GCKR	58	31
CCS(=O)(=O)c1ccc(CN2CCc3[nH]c4ccccc4c3C2)cc1	ZINC000450569753	FH	On-Demand	Anodyne	DRD5	19	43
CCS(=O)(=O)c1ccc(CN2CCc3[nH]c4ccccc4c3C2)cc1	ZINC000450569753	FH	On-Demand	Anodyne	HTR5A	18	48
N#C[C@@H](c1ccccc1)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450569762	CF	On-Demand	Mild	PTAFR	40	47
N#C[C@H](c1ccccc1)N1CCN(CC2(C#N)CCC2)CC1	ZINC000450569766	CF	On-Demand	Mild	PTAFR	40	47
COc1cc(CN2CCN(CCS(N)(=O)=O)CC2)ccc1Cl	ZINC000450569767	EC	On-Demand	Anodyne	HTR4	47	35
COc1cc(CN2CCN(CCS(N)(=O)=O)CC2)ccc1Cl	ZINC000450569767	EC	On-Demand	Anodyne	SIGMAR1	26	43
COc1cc(CN2CCN(CCS(N)(=O)=O)CC2)ccc1Cl	ZINC000450569767	EC	On-Demand	Anodyne	SSTR5	48	42
COc1cc(CN2CCN(CCS(N)(=O)=O)CC2)ccc1Cl	ZINC000450569767	EC	On-Demand	Anodyne	UTS2R	26	44
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450569769	EG	On-Demand	Anodyne	SORD	41	40
CC(=O)[C@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569772	ED	On-Demand	Anodyne	HTR1A	76	40
CC(=O)[C@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569772	ED	On-Demand	Anodyne	DRD2	67	43
CC(=O)[C@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569772	ED	On-Demand	Anodyne	ADRA1D	72	47
CC(=O)[C@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569772	ED	On-Demand	Anodyne	HTR2A	30	42
CC(=O)[C@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569772	ED	On-Demand	Anodyne	ADRA1A	48	39
CC(=O)[C@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569772	ED	On-Demand	Anodyne	DRD3	54	42
CC(=O)[C@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569772	ED	On-Demand	Anodyne	HTR7	53	41
CC(=O)[C@](C)(O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450569772	ED	On-Demand	Anodyne	AP2S1	0	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450569773	EG	On-Demand	Anodyne	SORD	41	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450569777	EG	On-Demand	Anodyne	SORD	41	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450569780	EG	On-Demand	Anodyne	SORD	41	40
N#CC1(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)CCC1	ZINC000450569803	FH	On-Demand	Mild	CCR5	23	44
CCOC(=O)[C@H]1CN(c2nc(-c3cccc(Cl)c3)no2)CC12COC2	ZINC000450569807	FE	On-Demand	Anodyne	GRM5	26	42
CCOC(=O)[C@@H]1CN(c2nc(-c3cccc(Cl)c3)no2)CC12COC2	ZINC000450569809	FE	On-Demand	Anodyne	GRM5	26	42
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)CC1CCC(=O)CC1	ZINC000450569819	FI	On-Demand	Anodyne	RBP4	56	32
C[C@H](OCCc1ccccc1)C(=O)N[C@]1(C)CCO[C@H]1C	ZINC000450569821	CE	On-Demand	Anodyne	TIMP3	46	31
C[C@H](OCCc1ccccc1)C(=O)N[C@]1(C)CCO[C@@H]1C	ZINC000450569823	CE	On-Demand	Anodyne	TIMP3	46	31
C[C@H](OCCc1ccccc1)C(=O)N[C@@]1(C)CCO[C@@H]1C	ZINC000450569826	CE	On-Demand	Anodyne	TIMP3	46	31
C[C@H](OCCc1ccccc1)C(=O)N[C@@]1(C)CCO[C@H]1C	ZINC000450569828	CE	On-Demand	Anodyne	TIMP3	46	31
CCn1c(SCC[C@H]2CCOC2)nc2ccccc21	ZINC000450569834	CH	On-Demand	Anodyne	PTGDR2	15	40
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)CCCC(C)C)c1	ZINC000450569835	DI	On-Demand	Anodyne	RORC	26	40
CCn1c(SCC[C@@H]2CCOC2)nc2ccccc21	ZINC000450569837	CH	On-Demand	Anodyne	PTGDR2	15	40
COc1cccc([C@H]2C[C@H](C)CN2C(=O)CCCC(C)C)c1	ZINC000450569838	DI	On-Demand	Anodyne	RORC	26	40
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)CCCC(C)C)c1	ZINC000450569839	DI	On-Demand	Anodyne	RORC	26	40
C[C@H](CCNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCCCC1	ZINC000450569840	FH	On-Demand	Bother	CCR5	15	41
C[C@H](CCNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCCCC1	ZINC000450569840	FH	On-Demand	Bother	LIPG	46	35
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)CCCC(C)C)c1	ZINC000450569842	DI	On-Demand	Anodyne	RORC	26	40
C[C@@H](CCNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCCCC1	ZINC000450569844	FH	On-Demand	Bother	CCR5	15	41
C[C@@H](CCNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCCCC1	ZINC000450569844	FH	On-Demand	Bother	LIPG	46	35
CN(CC(=O)NCc1ccccc1)Cc1ccccc1OC1CC1	ZINC000450569851	DF	On-Demand	Anodyne	TSPO	0	44
CCOC(=O)c1cc(C(=O)N2CC[C@@H](C(C)(C)C)C2)[nH]c1C	ZINC000450569861	DG	On-Demand	Anodyne	AKR1C3	17	40
Cc1cc(C(=O)N2CCCCc3cc(Br)ccc32)ncc1C(N)=O	ZINC000450569865	GG	On-Demand	Anodyne	AVPR2	44	48
CCOC(=O)c1cc(C(=O)N2CC[C@H](C(C)(C)C)C2)[nH]c1C	ZINC000450569866	DG	On-Demand	Anodyne	AKR1C3	17	40
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	HTR1A	37	60
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	DRD2	53	63
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	DRD1	27	49
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	DRD4	45	60
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	HTR2A	53	60
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	HTR2C	30	59
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	ADRA1A	17	49
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	HRH1	27	60
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	ADRA1B	15	48
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	DRD3	26	63
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	HTR4	0	43
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	ERG2	21	44
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	HTR7	37	48
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	HRH3	16	40
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	SIGMAR1	34	63
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	CCR3	39	42
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	SLC18A3	0	48
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	PLD2	44	36
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	CYP2J2	62	44
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	NET	0	44
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	MEN1	40	37
O=C(CCCN1CCC(Oc2ccccn2)CC1)c1ccc(F)cc1	ZINC000450569868	EH	On-Demand	Anodyne	AP2S1	0	44
C[C@@H](C[S@@](C)=O)N(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450569869	EG	On-Demand	Anodyne	GPR88	0	47
C[C@H](C[S@@](C)=O)N(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450569870	EG	On-Demand	Anodyne	GPR88	0	47
C[C@@H](C[S@](C)=O)N(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450569871	EG	On-Demand	Anodyne	GPR88	0	47
Oc1cccc(CN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450569879	DG	On-Demand	Anodyne	OPRM1	21	40
Oc1cccc(CN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450569879	DG	On-Demand	Anodyne	OPRD1	25	40
Oc1cccc(CN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450569879	DG	On-Demand	Anodyne	OPRK1	24	41
Oc1cccc(CN2CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450569879	DG	On-Demand	Anodyne	CHRM3	16	43
COC(=O)C1(CNC(=O)c2ccc(C3CC3)nc2C)CCCCC1	ZINC000450569883	EG	On-Demand	Anodyne	HCN1	54	33
COC(=O)C1(CNC(=O)c2ccc(C3CC3)nc2C)CCCCC1	ZINC000450569883	EG	On-Demand	Anodyne	HCN4	52	33
CCOC(=O)COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450569888	FG	On-Demand	Anodyne	TRPV1	19	44
CCOC(=O)COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450569888	FG	On-Demand	Anodyne	P4HTM	0	59
Oc1cccc(CN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450569889	DG	On-Demand	Anodyne	OPRM1	21	40
Oc1cccc(CN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450569889	DG	On-Demand	Anodyne	OPRD1	25	40
Oc1cccc(CN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450569889	DG	On-Demand	Anodyne	OPRK1	24	41
Oc1cccc(CN2CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450569889	DG	On-Demand	Anodyne	CHRM3	16	43
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450569892	GG	On-Demand	Anodyne	GCK	60	33
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450569892	GG	On-Demand	Anodyne	GCKR	82	38
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450569896	GG	On-Demand	Anodyne	GCK	60	33
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450569896	GG	On-Demand	Anodyne	GCKR	82	38
COc1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)o2)cc1	ZINC000450569898	EG	On-Demand	Anodyne	GSK3B	22	52
COc1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)o2)cc1	ZINC000450569898	EG	On-Demand	Anodyne	GSK3A	36	48
N#Cc1cc(Br)ccc1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450569901	GH	On-Demand	Mild	GRIN2B	50	39
N#Cc1cc(Br)ccc1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450569901	GH	On-Demand	Mild	CHRNA7	51	46
N#Cc1cc(Br)ccc1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450569901	GH	On-Demand	Mild	C3AR1	43	40
N#Cc1cc(Br)ccc1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450569901	GH	On-Demand	Mild	ACHP_LYMST	25	46
COC(=O)[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569910	GF	On-Demand	Anodyne	ADRB2	17	40
COC(=O)[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569910	GF	On-Demand	Anodyne	ADRB3	27	40
COC(=O)[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569910	GF	On-Demand	Anodyne	MME	40	36
COC(=O)[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569910	GF	On-Demand	Anodyne	ANPEP	52	34
COC(=O)[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569910	GF	On-Demand	Anodyne	CAPN2	41	32
COC(=O)[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569910	GF	On-Demand	Anodyne	POL	0	40
Cc1c(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cnn1C1CCOCC1	ZINC000450569911	FI	On-Demand	Bother	LRRK2	16	53
Cc1c(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cnn1C1CCOCC1	ZINC000450569911	FI	On-Demand	Bother	AADAC	0	43
COC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569913	GF	On-Demand	Anodyne	ADRB2	17	40
COC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569913	GF	On-Demand	Anodyne	ADRB3	27	40
COC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569913	GF	On-Demand	Anodyne	MME	40	36
COC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569913	GF	On-Demand	Anodyne	ANPEP	52	34
COC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569913	GF	On-Demand	Anodyne	CAPN2	41	32
COC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(Br)cc1	ZINC000450569913	GF	On-Demand	Anodyne	POL	0	40
O=C(NCC1(CO)CCC1)c1cn(CCc2ccccc2)nn1	ZINC000450569923	DD	On-Demand	Anodyne	HCN1	50	31
O=C(NCC1(CO)CCC1)c1cn(CCc2ccccc2)nn1	ZINC000450569923	DD	On-Demand	Anodyne	HCN4	48	31
O=C(c1cc2n(n1)CCCC2)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569925	FH	On-Demand	Anodyne	CACNA1B	50	38
O=C(c1cc2n(n1)CCCC2)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569925	FH	On-Demand	Anodyne	HPGD	16	40
O=C(c1cc2n(n1)CCCC2)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569927	FH	On-Demand	Anodyne	CACNA1B	50	38
O=C(c1cc2n(n1)CCCC2)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569927	FH	On-Demand	Anodyne	HPGD	16	40
C[C@H](CN1CCN(C(=O)c2cccc(O)c2)CC1)S(C)(=O)=O	ZINC000450569934	EC	On-Demand	Anodyne	TRY2_BOVIN	48	35
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NCC2(CO)CCC2)cc1OC	ZINC000450569935	GD	On-Demand	Anodyne	NMBR	69	40
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NCC2(CO)CCC2)cc1OC	ZINC000450569935	GD	On-Demand	Anodyne	GRPR	39	40
C[C@@H](CN1CCN(C(=O)c2cccc(O)c2)CC1)S(C)(=O)=O	ZINC000450569936	EC	On-Demand	Anodyne	TRY2_BOVIN	48	35
COc1ccc(C2(CNC(=O)c3cc(C)c(C(N)=O)cn3)CCC2)cc1	ZINC000450569939	FE	On-Demand	Anodyne	KCNA3	45	39
COc1ccc(C2(CNC(=O)c3cc(C)c(C(N)=O)cn3)CCC2)cc1	ZINC000450569939	FE	On-Demand	Anodyne	ACAT	0	44
COC(=O)C1(CNC(=O)c2cc3n(n2)CCC3)CCCCC1	ZINC000450569943	DD	On-Demand	Anodyne	HCN1	54	35
COC(=O)C1(CNC(=O)c2cc3n(n2)CCC3)CCCCC1	ZINC000450569943	DD	On-Demand	Anodyne	HCN4	52	35
COC(=O)[C@@H](NCc1nccc(OC)n1)c1ccccc1C(F)(F)F	ZINC000450569949	FF	On-Demand	Anodyne	PLK1	41	36
COc1ccc(C2(CNC(=O)[C@H]3CC3(F)F)CCC2)cc1	ZINC000450569951	CF	On-Demand	Anodyne	MTNR1A	30	48
COc1ccc(C2(CNC(=O)[C@H]3CC3(F)F)CCC2)cc1	ZINC000450569951	CF	On-Demand	Anodyne	MTNR1B	22	48
COc1ccc(C2(CNC(=O)[C@H]3CC3(F)F)CCC2)cc1	ZINC000450569951	CF	On-Demand	Anodyne	ACAT	0	52
COC(=O)[C@H](NCc1nccc(OC)n1)c1ccccc1C(F)(F)F	ZINC000450569952	FF	On-Demand	Anodyne	PLK1	41	36
COc1ccc(C2(CNC(=O)[C@@H]3CC3(F)F)CCC2)cc1	ZINC000450569954	CF	On-Demand	Anodyne	MTNR1A	30	48
COc1ccc(C2(CNC(=O)[C@@H]3CC3(F)F)CCC2)cc1	ZINC000450569954	CF	On-Demand	Anodyne	MTNR1B	22	48
COc1ccc(C2(CNC(=O)[C@@H]3CC3(F)F)CCC2)cc1	ZINC000450569954	CF	On-Demand	Anodyne	ACAT	0	52
COc1ccccc1COC1CCN(C(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000450569955	GI	On-Demand	Anodyne	CHRM2	16	40
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569958	GJ	On-Demand	Anodyne	CACNA1B	48	37
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569958	GJ	On-Demand	Anodyne	SLC9A1	40	38
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569958	GJ	On-Demand	Anodyne	CCR2	35	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569958	GJ	On-Demand	Anodyne	RBP4	23	47
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569967	GJ	On-Demand	Anodyne	CACNA1B	48	37
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569967	GJ	On-Demand	Anodyne	SLC9A1	40	38
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569967	GJ	On-Demand	Anodyne	CCR2	35	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450569967	GJ	On-Demand	Anodyne	RBP4	23	47
CSc1cccc(C(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)c1	ZINC000450569993	FH	On-Demand	Anodyne	MAPK14	21	40
CSc1cccc(C(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)c1	ZINC000450569993	FH	On-Demand	Anodyne	KCNK3	60	36
CCOc1ccc(OCc2nnc(C3CC3)s2)cc1	ZINC000450569999	CG	On-Demand	Anodyne	CACNA2D1	27	40
FC1(F)CC(CN2CCC[C@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)C1	ZINC000450570005	FJ	On-Demand	Anodyne	PRCP	17	41
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@@H]1CCC(F)(F)C1	ZINC000450570008	GJ	On-Demand	Anodyne	RBP4	45	31
CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C[C@H]1CCC(F)(F)C1	ZINC000450570009	GJ	On-Demand	Anodyne	RBP4	45	31
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570035	FH	On-Demand	Anodyne	EPHX2	19	40
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570035	FH	On-Demand	Anodyne	TYK2	43	32
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570036	FH	On-Demand	Anodyne	EPHX2	19	40
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570036	FH	On-Demand	Anodyne	TYK2	43	32
COC(=O)c1ccc(CC(=O)N(C)CCc2ccccc2O)cc1	ZINC000450570038	EE	On-Demand	Anodyne	MBTPS1	45	32
CN(C)C(=O)NCCNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450570046	EC	On-Demand	Anodyne	PSBA	0	60
Cc1ccc(C(=O)Nc2c(C)cccc2O)c2c1CCC2	ZINC000450570063	CH	On-Demand	Anodyne	S1PR4	27	42
O=C(CCCN1CCC[C@H]1C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450570065	FG	On-Demand	Anodyne	MAP	0	42
O=C(CCCN1CCC[C@H]1C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450570065	FG	On-Demand	Anodyne	MAP1	80	42
O=C(CCCN1CCC[C@H]1C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450570065	FG	On-Demand	Anodyne	PREP	17	41
O=C(CCCN1CCC[C@@H]1C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450570066	FG	On-Demand	Anodyne	MAP	0	42
O=C(CCCN1CCC[C@@H]1C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450570066	FG	On-Demand	Anodyne	MAP1	80	42
O=C(CCCN1CCC[C@@H]1C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450570066	FG	On-Demand	Anodyne	PREP	17	41
CCC(=O)CCCN1CCC[C@H](c2nc3ccccc3n2C(C)C)C1	ZINC000450570074	EJ	On-Demand	Anodyne	SLC6A1	80	35
CCC(=O)CCCN1CCC[C@@H](c2nc3ccccc3n2C(C)C)C1	ZINC000450570075	EJ	On-Demand	Anodyne	SLC6A1	80	35
CCC(C)(C)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450570077	BG	On-Demand	Anodyne	AOC3	23	41
CCC(C)(C)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450570078	BG	On-Demand	Anodyne	AOC3	23	41
CCC(C)(C)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450570079	BG	On-Demand	Anodyne	AOC3	23	41
CCC(C)(C)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450570080	BG	On-Demand	Anodyne	AOC3	23	41
N#CC1(CN(CC(=O)Nc2ccc(Cl)cc2)Cc2cccnc2)CCC1	ZINC000450570082	FH	On-Demand	Mild	NAMPT	39	43
N#CC1(CN(CC(=O)Nc2ccc(Cl)cc2)Cc2cccnc2)CCC1	ZINC000450570082	FH	On-Demand	Mild	NR1D1	31	43
Cc1cnc(NC[C@@H]2CSc3ccccc32)c([N+](=O)[O-])c1	ZINC000450570085	DH	On-Demand	Bother	PRKCQ	46	38
Cc1cnc(NC[C@H]2CSc3ccccc32)c([N+](=O)[O-])c1	ZINC000450570086	DH	On-Demand	Bother	PRKCQ	46	38
Cc1cccc(O)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450570096	FH	On-Demand	Anodyne	LCK	33	42
Cc1cccc(O)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450570096	FH	On-Demand	Anodyne	PDE4D	17	42
Cc1cccc(O)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450570096	FH	On-Demand	Anodyne	SHH	42	36
COC(=O)C1(CN(CC(=O)Nc2ccc(Cl)cc2)Cc2cccnc2)CC1	ZINC000450570105	GG	On-Demand	Anodyne	NAMPT	46	44
COC(=O)C1(CN(CC(=O)Nc2ccc(Cl)cc2)Cc2cccnc2)CC1	ZINC000450570105	GG	On-Demand	Anodyne	NR1D1	39	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450570108	GD	On-Demand	Anodyne	CA2	32	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450570108	GD	On-Demand	Anodyne	CA1	35	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450570108	GD	On-Demand	Anodyne	CA7	35	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450570108	GD	On-Demand	Anodyne	CA5B	62	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450570108	GD	On-Demand	Anodyne	CA4	40	35
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450570108	GD	On-Demand	Anodyne	CA5A	67	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450570108	GD	On-Demand	Anodyne	CA12	18	45
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450570108	GD	On-Demand	Anodyne	CA9	35	45
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450570109	GD	On-Demand	Anodyne	CA2	32	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450570109	GD	On-Demand	Anodyne	CA1	35	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450570109	GD	On-Demand	Anodyne	CA7	35	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450570109	GD	On-Demand	Anodyne	CA5B	62	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450570109	GD	On-Demand	Anodyne	CA4	40	35
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450570109	GD	On-Demand	Anodyne	CA5A	67	41
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450570109	GD	On-Demand	Anodyne	CA12	18	45
NS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450570109	GD	On-Demand	Anodyne	CA9	35	45
C[C@@H](c1csnn1)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450570112	FH	On-Demand	Anodyne	EPHX2	17	41
C[C@H](c1csnn1)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000450570113	FH	On-Demand	Anodyne	EPHX2	17	41
CC1CCN(C(=O)c2ccc(NC[C@H]3CSc4ccccc43)nc2)CC1	ZINC000450570117	FI	On-Demand	Anodyne	L3MBTL3	53	37
CC1CCN(C(=O)c2ccc(NC[C@@H]3CSc4ccccc43)nc2)CC1	ZINC000450570118	FI	On-Demand	Anodyne	L3MBTL3	53	37
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	DRD2	24	41
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	DRD4	54	41
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	HRH1	15	41
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	DRD3	25	41
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	CHRM3	17	42
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	SIGMAR1	41	43
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	ADAM17	17	41
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	MCHR1	24	41
COC(=O)c1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1Cl	ZINC000450570130	FG	On-Demand	Anodyne	CACNA1G	27	40
COc1cc(CC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570133	GH	On-Demand	Anodyne	TACR1	40	35
COc1cc(CC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570133	GH	On-Demand	Anodyne	CACNA1B	55	37
COc1cc(CC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570133	GH	On-Demand	Anodyne	MLNR	18	43
COc1cc(CC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570133	GH	On-Demand	Anodyne	CCR2	68	51
COc1cc(CC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570133	GH	On-Demand	Anodyne	RBP4	22	41
COc1cc(CC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570133	GH	On-Demand	Anodyne	LIPG	42	32
COc1cc(CC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570134	GH	On-Demand	Anodyne	TACR1	40	35
COc1cc(CC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570134	GH	On-Demand	Anodyne	CACNA1B	55	37
COc1cc(CC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570134	GH	On-Demand	Anodyne	MLNR	18	43
COc1cc(CC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570134	GH	On-Demand	Anodyne	CCR2	68	51
COc1cc(CC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570134	GH	On-Demand	Anodyne	RBP4	22	41
COc1cc(CC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)ccc1O	ZINC000450570134	GH	On-Demand	Anodyne	LIPG	42	32
Cc1cccc([C@H]2CCN(C(=O)c3scnc3C(C)C)C2)c1	ZINC000450570139	DI	On-Demand	Anodyne	HPGD	20	40
Cc1cccc([C@@H]2CCN(C(=O)c3scnc3C(C)C)C2)c1	ZINC000450570140	DI	On-Demand	Anodyne	HPGD	20	40
CCn1nnc(C)c1CSc1nc2ccccc2n1CC	ZINC000450570156	DG	On-Demand	Anodyne	PTGDR2	18	44
COc1ccc(CNC(=O)CCN(C(C)C)C2CCOCC2)c(OC)c1	ZINC000450570175	FF	On-Demand	Anodyne	MTNR1A	46	37
COC(=O)c1csc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)n1	ZINC000450570192	FE	On-Demand	Anodyne	SLC6A1	63	36
COC(=O)c1csc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)n1	ZINC000450570194	FE	On-Demand	Anodyne	SLC6A1	63	36
COc1ccc(C2(CNC(=O)c3scnc3C(C)C)CCC2)cc1	ZINC000450570201	EI	On-Demand	Anodyne	KCNA3	44	38
COc1ccc(C2(CNC(=O)c3scnc3C(C)C)CCC2)cc1	ZINC000450570201	EI	On-Demand	Anodyne	ACAT	0	52
Cc1cccc(C2=CCN(C(=O)C3(C)CCC(=O)CC3)CC2)c1	ZINC000450570202	DH	On-Demand	Anodyne	ADAM10	30	48
CCCc1nc(C)c(CSc2nnc(-c3ccc(OC)cc3)o2)o1	ZINC000450570219	EI	On-Demand	Anodyne	GSK3B	19	55
CCCc1nc(C)c(CSc2nnc(-c3ccc(OC)cc3)o2)o1	ZINC000450570219	EI	On-Demand	Anodyne	GSK3A	42	48
COc1ccc(C2(CNC(=O)CSC3CC3)CCC2)cc1	ZINC000450570231	DG	On-Demand	Anodyne	KCNA3	39	41
COc1ccc(C2(CNC(=O)CSC3CC3)CCC2)cc1	ZINC000450570231	DG	On-Demand	Anodyne	MTNR1A	26	44
COc1ccc(C2(CNC(=O)CSC3CC3)CCC2)cc1	ZINC000450570231	DG	On-Demand	Anodyne	MTNR1B	20	44
COc1ccc(C2(CNC(=O)CSC3CC3)CCC2)cc1	ZINC000450570231	DG	On-Demand	Anodyne	ACAT	0	51
FC1(F)CC(CN2CCC[C@@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)C1	ZINC000450570238	FJ	On-Demand	Anodyne	PRCP	17	41
COc1ccc(C2(CNC(=O)[C@@H]3C[C@H]3C(F)(F)F)CCC2)cc1	ZINC000450570241	EG	On-Demand	Anodyne	MTNR1A	22	43
COc1ccc(C2(CNC(=O)[C@@H]3C[C@H]3C(F)(F)F)CCC2)cc1	ZINC000450570241	EG	On-Demand	Anodyne	ACAT	0	49
O=C(c1cc2ccncc2s1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570243	GJ	On-Demand	Anodyne	SLC9A1	40	40
O=C(c1cc2ccncc2s1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570243	GJ	On-Demand	Anodyne	RBP4	23	41
O=C(c1cc2ccncc2s1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570245	GJ	On-Demand	Anodyne	SLC9A1	40	40
O=C(c1cc2ccncc2s1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570245	GJ	On-Demand	Anodyne	RBP4	23	41
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	DRD2	31	44
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	DRD1	20	48
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	DRD4	18	51
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	HTR2A	24	51
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	HTR2C	16	48
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	DRD3	15	51
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	ERG2	21	44
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	HTR7	15	44
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	SLC18A3	0	45
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)no1	ZINC000450570261	GG	On-Demand	Anodyne	CYP2J2	56	43
COC(=O)c1cccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)c1Cl	ZINC000450570275	GF	On-Demand	Anodyne	DRD4	43	33
C[C@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC(C)(C)C1	ZINC000450570292	EG	On-Demand	Bother	CACNA1D	64	32
C[C@@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC(C)(C)C1	ZINC000450570295	EG	On-Demand	Bother	CACNA1D	64	32
O=C(CCc1nc2cnccc2[nH]1)NCCCNc1cccc(F)c1	ZINC000450570307	EF	On-Demand	Anodyne	TBK1	16	45
CCSc1cccnc1C(=O)NCC1(CO)CCC1	ZINC000450570315	CE	On-Demand	Anodyne	HCN4	47	31
CCOC(=O)COc1ccc(NC(=O)c2nn(C)c3c2CCCC3)cc1	ZINC000450570318	FE	On-Demand	Anodyne	P4HTM	0	40
N#CC1(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CCC1	ZINC000450570333	FI	On-Demand	Mild	NPY2R	19	40
N#CC1(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CCC1	ZINC000450570333	FI	On-Demand	Mild	EPHX2	19	47
N#CC1(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CCC1	ZINC000450570333	FI	On-Demand	Mild	TYK2	45	37
N#CC1(CN2CCC(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)CCC1	ZINC000450570333	FI	On-Demand	Mild	MCHR1	25	40
CCS(=O)(=O)c1ccc(CN2CCC(Nc3cccc(C)c3)CC2)cc1	ZINC000450570343	FH	On-Demand	Anodyne	SSTR5	71	45
CCS(=O)(=O)c1ccc(CN2CCC(Nc3cccc(C)c3)CC2)cc1	ZINC000450570343	FH	On-Demand	Anodyne	MLNR	41	42
COC(=O)C1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450570352	DG	On-Demand	Anodyne	DRD4	40	30
COC(=O)C1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450570352	DG	On-Demand	Anodyne	HCN1	50	32
COC(=O)C1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450570352	DG	On-Demand	Anodyne	HCN4	47	32
COC[C@@H](C)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450570358	CG	On-Demand	Anodyne	CHRM5	39	43
COC[C@@H](C)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450570358	CG	On-Demand	Anodyne	NPPA	43	34
C[C@H](Oc1ccccn1)C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450570359	DE	On-Demand	Anodyne	CCR5	37	43
C[C@H](Oc1ccccn1)C(=O)NCC[C@H](C)N1CCCCC1	ZINC000450570362	DE	On-Demand	Anodyne	CCR5	37	43
C[C@@H](Oc1ccccn1)C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450570364	DE	On-Demand	Anodyne	CCR5	37	43
C[C@@H](CCNC(=O)[C@@H](C)Oc1ccccn1)N1CCCCC1	ZINC000450570365	DE	On-Demand	Anodyne	CCR5	37	43
COc1ccc(C2(CNC(=O)CC3CC(F)(F)C3)CCC2)cc1	ZINC000450570370	DH	On-Demand	Anodyne	KCNA3	44	38
COc1ccc(C2(CNC(=O)CC3CC(F)(F)C3)CCC2)cc1	ZINC000450570370	DH	On-Demand	Anodyne	MTNR1A	24	44
COc1ccc(C2(CNC(=O)CC3CC(F)(F)C3)CCC2)cc1	ZINC000450570370	DH	On-Demand	Anodyne	MTNR1B	16	44
COc1ccc(C2(CNC(=O)CC3CC(F)(F)C3)CCC2)cc1	ZINC000450570370	DH	On-Demand	Anodyne	ACAT	0	52
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570376	FE	On-Demand	Anodyne	HTR1A	45	40
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570376	FE	On-Demand	Anodyne	DRD2	28	44
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570376	FE	On-Demand	Anodyne	DRD4	19	44
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570376	FE	On-Demand	Anodyne	ADRA1D	36	40
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570376	FE	On-Demand	Anodyne	ADRA1A	31	40
CN(C)CCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570376	FE	On-Demand	Anodyne	ADRA1B	24	40
CN(C)CCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570378	FE	On-Demand	Anodyne	HTR1A	45	40
CN(C)CCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570378	FE	On-Demand	Anodyne	DRD2	28	44
CN(C)CCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570378	FE	On-Demand	Anodyne	DRD4	19	44
CN(C)CCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570378	FE	On-Demand	Anodyne	ADRA1D	36	40
CN(C)CCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570378	FE	On-Demand	Anodyne	ADRA1A	31	40
CN(C)CCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450570378	FE	On-Demand	Anodyne	ADRA1B	24	40
COc1cccc(-n2cc(C(=O)NCC[C@H](C)N3CCCCC3)nn2)c1	ZINC000450570404	FE	On-Demand	Anodyne	DRD4	51	38
COc1cccc(-n2cc(C(=O)NCC[C@H](C)N3CCCCC3)nn2)c1	ZINC000450570404	FE	On-Demand	Anodyne	DRD3	21	47
COc1cccc(-n2cc(C(=O)NCC[C@H](C)N3CCCCC3)nn2)c1	ZINC000450570404	FE	On-Demand	Anodyne	CCR5	22	45
COc1cccc(-n2cc(C(=O)NCC[C@@H](C)N3CCCCC3)nn2)c1	ZINC000450570405	FE	On-Demand	Anodyne	DRD4	51	38
COc1cccc(-n2cc(C(=O)NCC[C@@H](C)N3CCCCC3)nn2)c1	ZINC000450570405	FE	On-Demand	Anodyne	DRD3	21	47
COc1cccc(-n2cc(C(=O)NCC[C@@H](C)N3CCCCC3)nn2)c1	ZINC000450570405	FE	On-Demand	Anodyne	CCR5	22	45
C[C@@H](CCO)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450570406	CB	On-Demand	Anodyne	CA2	44	36
C[C@H](CCO)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450570415	CB	On-Demand	Anodyne	CA2	44	36
Cc1sccc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570430	EJ	On-Demand	Anodyne	CACNA1B	54	42
Cc1sccc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570430	EJ	On-Demand	Anodyne	SLC9A1	40	35
Cc1sccc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570430	EJ	On-Demand	Anodyne	CCR2	54	44
Cc1sccc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570430	EJ	On-Demand	Anodyne	RBP4	32	44
FC(F)(F)c1cccnc1N1C[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1	ZINC000450570432	CG	On-Demand	Anodyne	TRPV1	29	41
CCc1nc(C)c(CSc2nc3ccccc3n2CC)o1	ZINC000450570435	DI	On-Demand	Anodyne	PTGDR2	17	43
Cc1sccc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570438	EJ	On-Demand	Anodyne	CACNA1B	54	42
Cc1sccc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570438	EJ	On-Demand	Anodyne	SLC9A1	40	35
Cc1sccc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570438	EJ	On-Demand	Anodyne	CCR2	54	44
Cc1sccc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570438	EJ	On-Demand	Anodyne	RBP4	32	44
Oc1ccc2c(c1)CN(Cc1ccn(CCc3ccccc3)n1)CC2	ZINC000450570440	EG	On-Demand	Anodyne	SLC6A5	23	51
Cc1cccc([C@H]2CCN(C(=O)c3nn(C)c4c3CCCC4)C2)c1	ZINC000450570441	DG	On-Demand	Anodyne	HPGD	23	41
CN(CC(=O)NCc1ccccc1)Cc1cccnc1N	ZINC000450570443	CD	On-Demand	Anodyne	CA5B	15	40
CN(CC(=O)NCc1ccccc1)Cc1cccnc1N	ZINC000450570443	CD	On-Demand	Anodyne	CA5A	18	40
Cc1cccc([C@@H]2CCN(C(=O)c3nn(C)c4c3CCCC4)C2)c1	ZINC000450570444	DG	On-Demand	Anodyne	HPGD	23	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450570447	EF	On-Demand	Anodyne	ADRB2	0	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450570447	EF	On-Demand	Anodyne	ADRB3	24	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450570449	EF	On-Demand	Anodyne	ADRB2	0	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450570449	EF	On-Demand	Anodyne	ADRB3	24	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450570451	EF	On-Demand	Anodyne	ADRB2	0	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450570451	EF	On-Demand	Anodyne	ADRB3	24	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450570455	EF	On-Demand	Anodyne	ADRB2	0	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450570455	EF	On-Demand	Anodyne	ADRB3	24	45
C1=C[C@H]2C[C@H]1[C@@H]1CN(c3nc4ccccc4nc3N3CCOCC3)C[C@@H]12	ZINC000450570456	EF	On-Demand	Anodyne	PIK3CA	16	47
COC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450570458	FF	On-Demand	Anodyne	CTSV	44	30
COC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450570458	FF	On-Demand	Anodyne	NPPA	44	36
COC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450570458	FF	On-Demand	Anodyne	HCN1	53	34
COC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450570458	FF	On-Demand	Anodyne	HCN4	50	34
C[C@@H](O)CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450570520	CD	On-Demand	Bother	CCR5	25	45
C[C@@H](O)CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450570520	CD	On-Demand	Bother	BIRC2	42	42
C[C@@H](O)CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450570521	CD	On-Demand	Bother	CCR5	25	45
C[C@@H](O)CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450570521	CD	On-Demand	Bother	BIRC2	42	42
C[C@H](O)CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450570522	CD	On-Demand	Bother	CCR5	25	45
C[C@H](O)CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450570522	CD	On-Demand	Bother	BIRC2	42	42
C[C@H](O)CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450570523	CD	On-Demand	Bother	CCR5	25	45
C[C@H](O)CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450570523	CD	On-Demand	Bother	BIRC2	42	42
CCOC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)CC12COC2	ZINC000450570524	DC	On-Demand	Anodyne	AKT2	44	41
CCOC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)CC12COC2	ZINC000450570524	DC	On-Demand	Anodyne	AKT3	40	40
CCOC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)CC12COC2	ZINC000450570524	DC	On-Demand	Anodyne	ROCK2	42	40
CCOC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)CC12COC2	ZINC000450570524	DC	On-Demand	Anodyne	AKT1	28	40
CCOC(=O)[C@@H]1CN(c2ncnc3[nH]ccc23)CC12COC2	ZINC000450570529	DC	On-Demand	Anodyne	AKT2	44	41
CCOC(=O)[C@@H]1CN(c2ncnc3[nH]ccc23)CC12COC2	ZINC000450570529	DC	On-Demand	Anodyne	AKT3	40	40
CCOC(=O)[C@@H]1CN(c2ncnc3[nH]ccc23)CC12COC2	ZINC000450570529	DC	On-Demand	Anodyne	ROCK2	42	40
CCOC(=O)[C@@H]1CN(c2ncnc3[nH]ccc23)CC12COC2	ZINC000450570529	DC	On-Demand	Anodyne	AKT1	28	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H]2[C@H](O)CC[C@H]2C1	ZINC000450570548	EG	On-Demand	Anodyne	MC3R	40	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H]2[C@H](O)CC[C@H]2C1	ZINC000450570548	EG	On-Demand	Anodyne	MC5R	28	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H]2[C@H](O)CC[C@H]2C1	ZINC000450570548	EG	On-Demand	Anodyne	MC1R	26	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000450570549	EG	On-Demand	Anodyne	MC3R	40	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000450570549	EG	On-Demand	Anodyne	MC5R	28	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000450570549	EG	On-Demand	Anodyne	MC1R	26	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000450570550	EG	On-Demand	Anodyne	MC3R	40	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000450570550	EG	On-Demand	Anodyne	MC5R	28	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000450570550	EG	On-Demand	Anodyne	MC1R	26	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H]2[C@@H](O)CC[C@H]2C1	ZINC000450570551	EG	On-Demand	Anodyne	MC3R	40	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H]2[C@@H](O)CC[C@H]2C1	ZINC000450570551	EG	On-Demand	Anodyne	MC5R	28	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H]2[C@@H](O)CC[C@H]2C1	ZINC000450570551	EG	On-Demand	Anodyne	MC1R	26	40
CCOC(=O)[C@H]1CN(c2nc3ccccc3n2C)CC12COC2	ZINC000450570563	DD	On-Demand	Anodyne	PDE6D	50	38
COc1ccc([C@]2(C)NC(=O)N(Cc3ccc(Cl)c(OC)c3)C2=O)cc1	ZINC000450570564	FG	On-Demand	Anodyne	PROKR1	63	39
COc1ccc([C@]2(C)NC(=O)N(Cc3ccc(Cl)c(OC)c3)C2=O)cc1	ZINC000450570564	FG	On-Demand	Anodyne	NPBWR1	57	40
COc1ccc([C@@]2(C)NC(=O)N(Cc3ccc(Cl)c(OC)c3)C2=O)cc1	ZINC000450570565	FG	On-Demand	Anodyne	PROKR1	63	39
COc1ccc([C@@]2(C)NC(=O)N(Cc3ccc(Cl)c(OC)c3)C2=O)cc1	ZINC000450570565	FG	On-Demand	Anodyne	NPBWR1	57	40
CCOC(=O)[C@@H]1CN(c2nc3ccccc3n2C)CC12COC2	ZINC000450570567	DD	On-Demand	Anodyne	PDE6D	50	38
CC(F)(F)C(C)(C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450570568	DD	On-Demand	Anodyne	F2	0	45
CCc1ccc([C@H](CO)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450570575	EF	On-Demand	Anodyne	GPR88	0	46
CCc1ccc([C@@H](CO)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450570576	EF	On-Demand	Anodyne	GPR88	0	46
C[C@H]1c2ccc(F)cc2C[C@@H](C)N1C(=O)c1cnc(C2CC2)nc1	ZINC000450570596	EH	On-Demand	Anodyne	HCRTR2	0	45
C[C@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1cnc(C2CC2)nc1	ZINC000450570604	EH	On-Demand	Anodyne	HCRTR2	0	45
C[C@H]1Cc2cc(F)ccc2[C@H](C)N1C(=O)c1cnc(C2CC2)nc1	ZINC000450570607	EH	On-Demand	Anodyne	HCRTR2	0	45
C[C@@H]1Cc2cc(F)ccc2[C@@H](C)N1C(=O)c1cnc(C2CC2)nc1	ZINC000450570609	EH	On-Demand	Anodyne	HCRTR2	0	45
CCS(=O)(=O)c1ccc(CN(CC(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450570620	GH	On-Demand	Anodyne	RORC	35	44
CCc1nc(CN2CCN(Cc3ccc(S(=O)(=O)CC)cc3)CC2)no1	ZINC000450570627	GD	On-Demand	Anodyne	PLA2G2A	24	45
C[C@@H]1[C@@H](C)N(C(=O)c2ccc(N3CCC3)nc2)CCN1C	ZINC000450570628	CD	On-Demand	Anodyne	HPGDS	15	41
CCOC(=O)[C@H]1CN(c2ncnc3sc4c(c23)CCCC4)CC12COC2	ZINC000450570629	FF	On-Demand	Anodyne	RBP4	17	43
CCOC(=O)[C@@H]1CN(c2ncnc3sc4c(c23)CCCC4)CC12COC2	ZINC000450570630	FF	On-Demand	Anodyne	RBP4	17	43
Cc1cccc(O)c1NC(=O)c1cccc2c1CCCC2	ZINC000450570631	CH	On-Demand	Anodyne	AVPR2	38	45
Cc1cccc(O)c1NC(=O)c1cccc2c1CCCC2	ZINC000450570631	CH	On-Demand	Anodyne	AVPR1A	17	45
CCOC(=O)C(C)(C)N(C)CCN(C)Cc1ccccc1	ZINC000450570644	CE	On-Demand	Anodyne	ACHE	0	41
CCOC(=O)C(C)(C)N(C)CCN(C)Cc1ccccc1	ZINC000450570644	CE	On-Demand	Anodyne	AMY2	58	38
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)C(C)(C)O)cc2)c1	ZINC000450570648	FG	On-Demand	Anodyne	CHRM3	15	43
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)C(C)(C)O)cc2)c1	ZINC000450570648	FG	On-Demand	Anodyne	MMP13	15	52
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)C(C)(C)O)cc2)c1	ZINC000450570648	FG	On-Demand	Anodyne	FBP1	15	41
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)C(C)(C)O)cc2)c1	ZINC000450570648	FG	On-Demand	Anodyne	E1	0	48
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)C(C)(C)O)cc2)c1	ZINC000450570648	FG	On-Demand	Anodyne	KCNK3	40	35
NS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450570656	ED	On-Demand	Anodyne	DRD4	0	46
NS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450570656	ED	On-Demand	Anodyne	SLC18A3	0	40
NS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450570656	ED	On-Demand	Anodyne	HTR3B	0	43
NS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450570656	ED	On-Demand	Anodyne	CYP2J2	47	33
NS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450570657	ED	On-Demand	Anodyne	DRD4	0	46
NS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450570657	ED	On-Demand	Anodyne	SLC18A3	0	40
NS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450570657	ED	On-Demand	Anodyne	HTR3B	0	43
NS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450570657	ED	On-Demand	Anodyne	CYP2J2	47	33
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	DRD2	29	42
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	DRD4	0	47
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	HTR2A	28	50
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	HTR2C	18	53
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	INHA	16	44
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	HRH3	0	40
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	SIGMAR1	15	47
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	HSD11B1	0	57
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	CCR3	20	40
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	CCR5	16	41
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	SLC18A3	24	47
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	SLC9A1	27	40
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	LSS	20	63
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	HTR3B	0	42
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	MCHR1	22	42
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	CYP2J2	53	38
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	L3MBTL1	0	43
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	L3MBTL3	82	43
CN(CCCC(=O)c1ccc(F)cc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570662	GI	On-Demand	Anodyne	SLC6A7	0	44
CCc1cccc(C(=O)NCC(=O)C2CC2)n1	ZINC000450570663	BD	On-Demand	Anodyne	PDE5A	0	42
CN(Cc1nnc(C2CC2)s1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570682	FG	On-Demand	Anodyne	SMO	40	37
CN(Cc1nnc(C2CC2)s1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000450570682	FG	On-Demand	Anodyne	L3MBTL3	47	34
C/C=C\COc1cccc(CC(=O)N2CC(CO)C2)c1	ZINC000450570684	CD	On-Demand	Anodyne	UPP1	40	31
CCOC(=O)[C@@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC12COC2	ZINC000450570690	GE	On-Demand	Anodyne	ACACB	23	42
CCOC(=O)[C@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC12COC2	ZINC000450570691	GE	On-Demand	Anodyne	ACACB	23	42
CN(CCc1ccccc1O)C(=O)c1cccc2c1CCCC2	ZINC000450570693	DH	On-Demand	Anodyne	FABP4	41	34
CN(CCc1ccccc1O)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450570697	FI	On-Demand	Anodyne	GPR88	0	44
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	CA2	99	48
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	CA1	85	48
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	CA7	52	42
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	CA5B	65	42
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	CA4	106	47
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	CA5A	71	42
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	CA12	42	41
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	CA9	52	41
CC(C)CCCC(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570699	DD	On-Demand	Anodyne	P96878_MYCTU	51	37
O=C(Nc1cc(S(=O)(=O)NC2CC2)ccc1O)[C@@H](O)C1CCC1	ZINC000450570704	EC	On-Demand	Anodyne	SFRP1	41	30
O=C(Nc1cc(S(=O)(=O)NC2CC2)ccc1O)[C@H](O)C1CCC1	ZINC000450570705	EC	On-Demand	Anodyne	SFRP1	41	30
COC(=O)c1csc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450570711	FG	On-Demand	Anodyne	CHRM2	18	45
COC(=O)c1csc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450570711	FG	On-Demand	Anodyne	DRD2	15	45
COC(=O)c1csc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450570711	FG	On-Demand	Anodyne	DRD4	35	40
COC(=O)c1csc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450570711	FG	On-Demand	Anodyne	ACHE	38	43
COC(=O)c1csc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450570711	FG	On-Demand	Anodyne	DRD3	30	41
COC(=O)c1csc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450570711	FG	On-Demand	Anodyne	LTA4H	19	41
COC(=O)c1csc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450570711	FG	On-Demand	Anodyne	SIGMAR1	69	47
COC(=O)c1csc(CN(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000450570711	FG	On-Demand	Anodyne	MCHR1	34	42
O=C(Nc1nccs1)[C@@H]1CCCN1CCC1=CCCCC1	ZINC000450570720	DG	On-Demand	Anodyne	MAP1	59	39
O=C(Nc1nccs1)[C@H]1CCCN1CCC1=CCCCC1	ZINC000450570721	DG	On-Demand	Anodyne	MAP1	59	39
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[S@](C)=O)ccc21	ZINC000450570722	FF	On-Demand	Anodyne	PDGFRB	0	45
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[S@](C)=O)ccc21	ZINC000450570722	FF	On-Demand	Anodyne	CPT1A	44	31
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[S@](C)=O)ccc21	ZINC000450570722	FF	On-Demand	Anodyne	PLK1	45	34
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[S@](C)=O)ccc21	ZINC000450570722	FF	On-Demand	Anodyne	HPGD	44	56
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[S@](C)=O)ccc21	ZINC000450570723	FF	On-Demand	Anodyne	PDGFRB	0	45
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[S@](C)=O)ccc21	ZINC000450570723	FF	On-Demand	Anodyne	CPT1A	44	31
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[S@](C)=O)ccc21	ZINC000450570723	FF	On-Demand	Anodyne	PLK1	45	34
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[S@](C)=O)ccc21	ZINC000450570723	FF	On-Demand	Anodyne	HPGD	44	56
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[S@@](C)=O)ccc21	ZINC000450570724	FF	On-Demand	Anodyne	PDGFRB	0	45
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[S@@](C)=O)ccc21	ZINC000450570724	FF	On-Demand	Anodyne	CPT1A	44	31
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[S@@](C)=O)ccc21	ZINC000450570724	FF	On-Demand	Anodyne	PLK1	45	34
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)C[S@@](C)=O)ccc21	ZINC000450570724	FF	On-Demand	Anodyne	HPGD	44	56
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[S@@](C)=O)ccc21	ZINC000450570725	FF	On-Demand	Anodyne	PDGFRB	0	45
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[S@@](C)=O)ccc21	ZINC000450570725	FF	On-Demand	Anodyne	CPT1A	44	31
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[S@@](C)=O)ccc21	ZINC000450570725	FF	On-Demand	Anodyne	PLK1	45	34
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)C[S@@](C)=O)ccc21	ZINC000450570725	FF	On-Demand	Anodyne	HPGD	44	56
CSc1cccc(C(=O)Nc2ncn(C(C)(C)C)n2)c1	ZINC000450570726	CG	On-Demand	Anodyne	KCNK3	52	33
C[C@H](CCO)CCNc1ncnc2ccc(I)cc12	ZINC000450570729	FE	On-Demand	Anodyne	CLK4	58	36
C[C@H](CCO)CCNc1ncnc2ccc(I)cc12	ZINC000450570729	FE	On-Demand	Anodyne	CD38	31	46
C[C@@H](CCO)CCNc1ncnc2ccc(I)cc12	ZINC000450570730	FE	On-Demand	Anodyne	CLK4	58	36
C[C@@H](CCO)CCNc1ncnc2ccc(I)cc12	ZINC000450570730	FE	On-Demand	Anodyne	CD38	31	46
Cc1sccc1C(=O)NCC1(CO)CCC1	ZINC000450570747	BD	On-Demand	Anodyne	HCN1	53	33
Cc1sccc1C(=O)NCC1(CO)CCC1	ZINC000450570747	BD	On-Demand	Anodyne	HCN4	51	33
CCn1c(SCc2nnc(C(C)C)s2)nc2ccccc21	ZINC000450570751	DI	On-Demand	Anodyne	PTGDR2	17	42
Cc1csc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450570753	EJ	On-Demand	Anodyne	CACNA1B	50	38
Cc1csc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450570753	EJ	On-Demand	Anodyne	SLC9A1	42	35
Cc1csc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450570753	EJ	On-Demand	Anodyne	CCR2	57	42
Cc1csc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450570753	EJ	On-Demand	Anodyne	RBP4	33	45
Cc1csc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450570754	EJ	On-Demand	Anodyne	CACNA1B	50	38
Cc1csc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450570754	EJ	On-Demand	Anodyne	SLC9A1	42	35
Cc1csc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450570754	EJ	On-Demand	Anodyne	CCR2	57	42
Cc1csc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450570754	EJ	On-Demand	Anodyne	RBP4	33	45
COc1ccc(-c2nnc(SCc3cc(C(C)(C)C)on3)o2)cc1	ZINC000450570755	EI	On-Demand	Anodyne	GSK3B	21	55
COc1ccc(-c2nnc(SCc3cc(C(C)(C)C)on3)o2)cc1	ZINC000450570755	EI	On-Demand	Anodyne	GSK3A	51	53
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CC2(C#N)CCC2)C1=O	ZINC000450570756	EE	On-Demand	Mild	SLC27A4	42	31
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CC2(C#N)CCC2)C1=O	ZINC000450570757	EE	On-Demand	Mild	SLC27A4	42	31
CCn1c(SCCCCCC(C)=O)nc2ccccc21	ZINC000450570758	CI	On-Demand	Anodyne	PTGDR2	20	62
Cc1cccc([C@H]2CCN(C(=O)c3cc4c(=O)n(C)c(=O)n(C)c4s3)C2)c1	ZINC000450570760	GE	On-Demand	Anodyne	SLC16A1	46	36
Cc1cccc([C@@H]2CCN(C(=O)c3cc4c(=O)n(C)c(=O)n(C)c4s3)C2)c1	ZINC000450570762	GE	On-Demand	Anodyne	SLC16A1	46	36
CC(C)c1ncsc1C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450570763	DG	On-Demand	Anodyne	CCR5	39	41
CC(C)c1ncsc1C(=O)NCC[C@H](C)N1CCCCC1	ZINC000450570765	DG	On-Demand	Anodyne	CCR5	39	41
COc1ccc(C2(CNC(=O)[C@]3(OC(C)C)CCOC3)CCC2)cc1	ZINC000450570770	EF	On-Demand	Anodyne	ACAT	0	52
COc1ccc(C2(CNC(=O)[C@@]3(OC(C)C)CCOC3)CCC2)cc1	ZINC000450570772	EF	On-Demand	Anodyne	ACAT	0	52
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	HTR1A	32	41
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	DRD2	46	46
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	DRD4	77	40
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	DRD3	49	40
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	P2RY12	31	41
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	TRPV1	18	45
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	SIGMAR1	27	43
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	SSTR5	40	35
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	CCR3	26	40
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	BDKRB1	16	40
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	FAAH	29	43
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	CXCR3	31	42
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	MCHR1	20	41
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	CACNA1G	26	42
COC(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl	ZINC000450570774	GG	On-Demand	Anodyne	ABCG2	21	42
O=C(c1cc2cccnc2s1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570775	GJ	On-Demand	Anodyne	SLC9A1	42	39
O=C(c1cc2cccnc2s1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570775	GJ	On-Demand	Anodyne	CCR2	40	35
O=C(c1cc2cccnc2s1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570775	GJ	On-Demand	Anodyne	RBP4	25	42
O=C(c1cc2cccnc2s1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570775	GJ	On-Demand	Anodyne	MAP3K12	36	41
O=C(c1cc2cccnc2s1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570776	GJ	On-Demand	Anodyne	SLC9A1	42	39
O=C(c1cc2cccnc2s1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570776	GJ	On-Demand	Anodyne	CCR2	40	35
O=C(c1cc2cccnc2s1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570776	GJ	On-Demand	Anodyne	RBP4	25	42
O=C(c1cc2cccnc2s1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450570776	GJ	On-Demand	Anodyne	MAP3K12	36	41
Cc1csc2c(NC[C@H](O)Cc3cccc(F)c3)ncnc12	ZINC000450570777	DF	On-Demand	Anodyne	LPAR2	19	40
Cc1csc2c(NC[C@@H](O)Cc3cccc(F)c3)ncnc12	ZINC000450570779	DF	On-Demand	Anodyne	LPAR2	19	40
O=C(c1ccccc1O)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450570789	EG	On-Demand	Anodyne	SLC6A5	32	43
O=C(c1ccccc1O)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450570790	EG	On-Demand	Anodyne	SLC6A5	32	43
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450570793	CI	On-Demand	Anodyne	ERBB2	0	43
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450570793	CI	On-Demand	Anodyne	ADAM10	28	45
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450570794	CI	On-Demand	Anodyne	ERBB2	0	43
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450570794	CI	On-Demand	Anodyne	ADAM10	28	45
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450570795	CI	On-Demand	Anodyne	ERBB2	0	43
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450570795	CI	On-Demand	Anodyne	ADAM10	28	45
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450570796	CI	On-Demand	Anodyne	ERBB2	0	43
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450570796	CI	On-Demand	Anodyne	ADAM10	28	45
Cc1cccc([C@@H]2CCN(C(=O)c3ccsc3Br)C2)c1	ZINC000450570797	FI	On-Demand	Anodyne	TPSAB1	29	41
Cc1cccc([C@H]2CCN(C(=O)c3ccsc3Br)C2)c1	ZINC000450570799	FI	On-Demand	Anodyne	TPSAB1	29	41
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(F)F	ZINC000450570803	CG	On-Demand	Anodyne	EGFR	22	41
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(F)F	ZINC000450570803	CG	On-Demand	Anodyne	FLT1	25	44
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(F)F	ZINC000450570803	CG	On-Demand	Anodyne	EPHA2	44	35
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)C(F)F	ZINC000450570805	CG	On-Demand	Anodyne	EGFR	22	41
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)C(F)F	ZINC000450570805	CG	On-Demand	Anodyne	FLT1	25	44
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)C(F)F	ZINC000450570805	CG	On-Demand	Anodyne	EPHA2	44	35
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(F)c3)CCC2)cc1	ZINC000450570810	EG	On-Demand	Anodyne	KCNA3	36	40
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(F)c3)CCC2)cc1	ZINC000450570810	EG	On-Demand	Anodyne	MTNR1A	28	42
COc1ccc(C2(CNC(=O)Cc3ccc(O)c(F)c3)CCC2)cc1	ZINC000450570810	EG	On-Demand	Anodyne	ACAT	0	47
CCOC(=O)c1ccc(CSc2nc3ccccc3n2CC)nc1	ZINC000450570814	EH	On-Demand	Anodyne	SLC27A1	25	41
CCC(=O)C1(C(=O)NCC2(c3ccc(OC)cc3)CCC2)CC1	ZINC000450570831	DF	On-Demand	Anodyne	MTNR1A	26	44
COc1cc(Br)ccc1CCCNC(=O)CSC1CC1	ZINC000450570832	FG	On-Demand	Anodyne	QRFPR	40	34
Cc1cccc([C@H]2CCN(C(=O)c3ccnc(OC(F)F)c3)C2)c1	ZINC000450570839	EH	On-Demand	Anodyne	HPGD	37	44
CCn1nnc(C)c1CSc1nnc(COc2cccc(C)c2)o1	ZINC000450570840	EG	On-Demand	Anodyne	PTK2	23	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC[C@H](C)CCO	ZINC000450570847	EC	On-Demand	Anodyne	CA2	56	57
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC[C@H](C)CCO	ZINC000450570847	EC	On-Demand	Anodyne	CA1	49	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC[C@H](C)CCO	ZINC000450570847	EC	On-Demand	Anodyne	CA4	50	39
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC[C@@H](C)CCO	ZINC000450570848	EC	On-Demand	Anodyne	CA2	56	57
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC[C@@H](C)CCO	ZINC000450570848	EC	On-Demand	Anodyne	CA1	49	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC[C@@H](C)CCO	ZINC000450570848	EC	On-Demand	Anodyne	CA4	50	39
Cc1cccc([C@@H]2CCN(C(=O)c3ccnc(OC(F)F)c3)C2)c1	ZINC000450570849	EH	On-Demand	Anodyne	HPGD	37	44
CC(=O)NC1CCC(N(C)C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450570850	GH	On-Demand	Anodyne	PRCP	40	35
CC(=O)NC1CCC(N(C)C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450570852	GH	On-Demand	Anodyne	PRCP	40	35
CC(=O)NC1CCC(N(C)C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450570853	GH	On-Demand	Anodyne	PRCP	40	35
CC(=O)NC1CCC(N(C)C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450570854	GH	On-Demand	Anodyne	PRCP	40	35
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CC(CO)C1	ZINC000450570858	EE	On-Demand	Anodyne	HRH4	27	47
CC[C@@H](Nc1ncnc2c(C)csc12)C(F)F	ZINC000450570862	CG	On-Demand	Anodyne	LPAR2	22	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450570864	EG	On-Demand	Anodyne	SCN5A	51	36
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450570865	EG	On-Demand	Anodyne	SCN5A	51	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450570866	EG	On-Demand	Anodyne	SCN5A	51	36
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450570867	EG	On-Demand	Anodyne	SCN5A	51	36
Cc1cccc([C@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C2)c1	ZINC000450570868	DG	On-Demand	Anodyne	HPGD	29	40
CC[C@H](Nc1ncnc2c(C)csc12)C(F)F	ZINC000450570869	CG	On-Demand	Anodyne	LPAR2	22	46
Cc1cccc([C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C2)c1	ZINC000450570871	DG	On-Demand	Anodyne	HPGD	29	40
CC1=C(C(=O)Nc2cc(S(N)(=O)=O)ccc2O)CCC(C)(C)C1	ZINC000450570876	EF	On-Demand	Anodyne	MTCA1	57	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570878	GD	On-Demand	Anodyne	CA2	68	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570878	GD	On-Demand	Anodyne	FOLH1	43	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570878	GD	On-Demand	Anodyne	CA1	55	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570878	GD	On-Demand	Anodyne	CA7	32	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570878	GD	On-Demand	Anodyne	CA4	70	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570878	GD	On-Demand	Anodyne	CA5A	40	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000450570878	GD	On-Demand	Anodyne	CA14	30	44
COc1cc(CC(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)ccc1Cl	ZINC000450570883	GH	On-Demand	Anodyne	ENPP1	56	32
COc1cc(CC(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)ccc1Cl	ZINC000450570883	GH	On-Demand	Anodyne	IMDH_CRYPV	19	41
C[C@@H](O)CCCn1cnc2sc3c(c2c1=O)CCC3	ZINC000450570885	CE	On-Demand	Anodyne	HTR1B	17	43
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CO)CCC1	ZINC000450570890	CD	On-Demand	Anodyne	CTSV	44	30
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CO)CCC1	ZINC000450570890	CD	On-Demand	Anodyne	HCN1	49	30
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CO)CCC1	ZINC000450570890	CD	On-Demand	Anodyne	HCN4	47	30
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1Cl	ZINC000450570892	CE	On-Demand	Anodyne	TRPV1	24	42
COc1cc(CC(=O)NCC2(CO)CCC2)ccc1Cl	ZINC000450570892	CE	On-Demand	Anodyne	NCE103	29	45
C[C@H](O)CCCn1cnc2sc3c(c2c1=O)CCC3	ZINC000450570895	CE	On-Demand	Anodyne	HTR1B	17	43
O=C(NCC1(CO)CCC1)c1ccn(CCc2ccccc2)n1	ZINC000450570899	DE	On-Demand	Anodyne	HCN4	51	33
CCOc1nc2ccc(C(=O)NCC3(CO)CCC3)cc2[nH]1	ZINC000450570902	DD	On-Demand	Anodyne	HCN1	43	33
CCOc1nc2ccc(C(=O)NCC3(CO)CCC3)cc2[nH]1	ZINC000450570902	DD	On-Demand	Anodyne	HCN4	42	33
O=C(NCC1(CO)CCC1)c1cccc2c1CCCC2	ZINC000450570913	CE	On-Demand	Anodyne	FABP4	40	33
O=C(NCC1(CO)CCC1)c1cccc2c1CCCC2	ZINC000450570913	CE	On-Demand	Anodyne	HCN1	62	35
O=C(NCC1(CO)CCC1)c1cccc2c1CCCC2	ZINC000450570913	CE	On-Demand	Anodyne	HCN4	51	34
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)nc1	ZINC000450570925	GD	On-Demand	Anodyne	NPY1R	42	34
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)nc1	ZINC000450570925	GD	On-Demand	Anodyne	NPY2R	76	41
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)nc1	ZINC000450570925	GD	On-Demand	Anodyne	NPY5R	23	41
O=S(=O)(NCC1CC1)c1ccc(NC[C@H](O)Cc2cccc(F)c2)nc1	ZINC000450570929	GD	On-Demand	Anodyne	NPY1R	42	34
O=S(=O)(NCC1CC1)c1ccc(NC[C@H](O)Cc2cccc(F)c2)nc1	ZINC000450570929	GD	On-Demand	Anodyne	NPY2R	76	41
O=S(=O)(NCC1CC1)c1ccc(NC[C@H](O)Cc2cccc(F)c2)nc1	ZINC000450570929	GD	On-Demand	Anodyne	NPY5R	23	41
COc1ccc(-c2nnc(SCCN(C)Cc3ccccc3)o2)cc1	ZINC000450570931	FH	On-Demand	Anodyne	GSK3B	25	53
COc1ccc(-c2nnc(SCCN(C)Cc3ccccc3)o2)cc1	ZINC000450570931	FH	On-Demand	Anodyne	GSK3A	41	48
COc1ccc(-c2nnc(SCCN(C)Cc3ccccc3)o2)cc1	ZINC000450570931	FH	On-Demand	Anodyne	TERT	25	43
COc1ccc(-c2nnc(SCCN(C)Cc3ccccc3)o2)cc1	ZINC000450570931	FH	On-Demand	Anodyne	RTT109	0	40
C[C@H]1[C@@H](C)N(C)CCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450570935	CD	On-Demand	Anodyne	HPGDS	15	41
C[C@H]1[C@@H](C)N(C(=O)c2ccc(N3CCC3)nc2)CCN1C	ZINC000450570938	CD	On-Demand	Anodyne	HPGDS	15	41
C[C@H]1[C@H](C)N(C(=O)c2ccc(N3CCC3)nc2)CCN1C	ZINC000450570940	CD	On-Demand	Anodyne	HPGDS	15	41
Oc1ccc2c(c1)CN(Cc1cnn[nH]1)CC2	ZINC000450570942	BD	On-Demand	Anodyne	SLC6A5	17	41
COc1ccc(C2(CNC(=O)CCCC(=O)C(C)(C)C)CCC2)cc1	ZINC000450570943	EI	On-Demand	Anodyne	KCNA3	42	36
COc1ccc(C2(CNC(=O)CCCC(=O)C(C)(C)C)CCC2)cc1	ZINC000450570943	EI	On-Demand	Anodyne	MTNR1A	22	47
COc1ccc(C2(CNC(=O)CCCC(=O)C(C)(C)C)CCC2)cc1	ZINC000450570943	EI	On-Demand	Anodyne	ACAT	0	49
C[C@H]1[C@H](C)N(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCN1C	ZINC000450570958	ED	On-Demand	Anodyne	UL80	25	48
C[C@H]1[C@H](C)N(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCN1C	ZINC000450570958	ED	On-Demand	Anodyne	PREP	113	59
C[C@H]1[C@H](C)N(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCN1C	ZINC000450570958	ED	On-Demand	Anodyne	SFRP1	46	42
C[C@H]1[C@H](C)N(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCN1C	ZINC000450570958	ED	On-Demand	Anodyne	WNT3	44	42
COc1ccc(C2(CNC(=O)C[C@@H](CNC(C)=O)CC(C)C)CCC2)cc1	ZINC000450570959	FG	On-Demand	Anodyne	MTNR1A	24	42
COc1ccc(C2(CNC(=O)C[C@@H](CNC(C)=O)CC(C)C)CCC2)cc1	ZINC000450570959	FG	On-Demand	Anodyne	MTNR1B	18	42
COc1ccc(C2(CNC(=O)C[C@@H](CNC(C)=O)CC(C)C)CCC2)cc1	ZINC000450570959	FG	On-Demand	Anodyne	ACAT	0	49
C[C@H]1[C@@H](C)N(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCN1C	ZINC000450570961	ED	On-Demand	Anodyne	UL80	25	48
C[C@H]1[C@@H](C)N(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCN1C	ZINC000450570961	ED	On-Demand	Anodyne	PREP	113	59
C[C@H]1[C@@H](C)N(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCN1C	ZINC000450570961	ED	On-Demand	Anodyne	SFRP1	46	42
C[C@H]1[C@@H](C)N(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCN1C	ZINC000450570961	ED	On-Demand	Anodyne	WNT3	44	42
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	DRD2	19	44
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	DRD1	37	44
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	DRD5	41	37
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	ABCB1B	45	36
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	ABCB1	32	65
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	SLC6A5	16	40
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	ABCG2	34	43
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	NOD1	17	42
COc1cc(CN2CCc3ccc(O)cc3C2)ccc1Cl	ZINC000450570964	DH	On-Demand	Anodyne	NOD2	45	42
CNC(=O)CN(CC[C@@H](C)O)Cc1cccc(C(F)(F)F)c1	ZINC000450570965	DE	On-Demand	Anodyne	CETP	0	42
CNC(=O)CN(CC[C@H](C)O)Cc1cccc(C(F)(F)F)c1	ZINC000450570967	DE	On-Demand	Anodyne	CETP	0	42
CCOC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)CC12COC2	ZINC000450570970	FF	On-Demand	Mild	AR	32	42
CCOC(=O)[C@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)CC12COC2	ZINC000450570973	FF	On-Demand	Mild	AR	32	42
O=C(NCC[C@@H]1CCOC1)c1ccc(I)cc1F	ZINC000450570974	FF	On-Demand	Anodyne	MAP2K1	44	31
O=C(NCC[C@H]1CCOC1)c1ccc(I)cc1F	ZINC000450570976	FF	On-Demand	Anodyne	MAP2K1	44	31
COC(=O)c1cccc(CN2CCc3ccc(O)cc3C2)c1Cl	ZINC000450570980	EG	On-Demand	Anodyne	ABCB1	23	43
COC(=O)c1cccc(CN2CCc3ccc(O)cc3C2)c1Cl	ZINC000450570980	EG	On-Demand	Anodyne	HSD17B3	41	41
COC(=O)c1cccc(CN2CCc3ccc(O)cc3C2)c1Cl	ZINC000450570980	EG	On-Demand	Anodyne	SLC6A5	45	55
COC(=O)c1cccc(CN2CCc3ccc(O)cc3C2)c1Cl	ZINC000450570980	EG	On-Demand	Anodyne	ABCG2	34	41
COC(=O)c1cccc(CN2CCc3ccc(O)cc3C2)c1Cl	ZINC000450570980	EG	On-Demand	Anodyne	NOD2	45	39
CCOC(=O)COc1ccc(NC(=O)c2cc(C(=O)OCC)no2)cc1	ZINC000450570996	FE	On-Demand	Anodyne	P4HTM	0	41
COCCn1ccc2ccc(NC(=O)[C@@H](O)C3CCC3)cc21	ZINC000450571012	DE	On-Demand	Anodyne	NAMPT	25	44
COCCn1ccc2ccc(NC(=O)[C@H](O)C3CCC3)cc21	ZINC000450571015	DE	On-Demand	Anodyne	NAMPT	25	44
CCOC(=O)COc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450571016	GG	On-Demand	Anodyne	LTA4H	20	46
CCOC(=O)COc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450571016	GG	On-Demand	Anodyne	FAAH	21	43
CCOC(=O)COc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450571016	GG	On-Demand	Anodyne	ACE2	15	41
CCOC(=O)COc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450571017	GG	On-Demand	Anodyne	LTA4H	20	46
CCOC(=O)COc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450571017	GG	On-Demand	Anodyne	FAAH	21	43
CCOC(=O)COc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450571017	GG	On-Demand	Anodyne	ACE2	15	41
Cn1nc(C(=O)N2CCCCc3cc(Br)ccc32)c2c1CCCC2	ZINC000450571019	GI	On-Demand	Anodyne	CNR1	56	40
Cn1nc(C(=O)N2CCCCc3cc(Br)ccc32)c2c1CCCC2	ZINC000450571019	GI	On-Demand	Anodyne	AVPR2	35	41
C[C@@H]1[C@@H](C)N(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C	ZINC000450571029	EF	On-Demand	Bother	LIPG	40	34
C[C@@H]1[C@@H](C)N(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C	ZINC000450571029	EF	On-Demand	Bother	PPXII	0	41
C[C@H]1[C@H](C)N(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C	ZINC000450571030	EF	On-Demand	Bother	LIPG	40	34
C[C@H]1[C@H](C)N(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C	ZINC000450571030	EF	On-Demand	Bother	PPXII	0	41
C[C@H]1[C@@H](C)N(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C	ZINC000450571031	EF	On-Demand	Bother	LIPG	40	34
C[C@H]1[C@@H](C)N(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C	ZINC000450571031	EF	On-Demand	Bother	PPXII	0	41
C[C@H]1[C@@H](C)N(C)CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450571033	EF	On-Demand	Bother	LIPG	40	34
C[C@H]1[C@@H](C)N(C)CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450571033	EF	On-Demand	Bother	PPXII	0	41
COCCOC[C@@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450571037	ED	On-Demand	Anodyne	CTSS	0	52
COCCOC[C@@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450571037	ED	On-Demand	Anodyne	CCR2	28	44
COCCOC[C@@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450571037	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
COCCOC[C@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450571038	ED	On-Demand	Anodyne	CTSS	0	52
COCCOC[C@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450571038	ED	On-Demand	Anodyne	CCR2	28	44
COCCOC[C@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450571038	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
CCc1cccc(C(=O)NCCCNc2cccc(F)c2)n1	ZINC000450571045	DG	On-Demand	Anodyne	TBK1	17	45
CCOC(=O)COc1ccc(NC(=O)Cc2ccc(OC(F)F)c(F)c2)cc1	ZINC000450571047	GH	On-Demand	Anodyne	MET	23	40
O=c1c(Cl)c(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)cnn1Cc1ccccc1	ZINC000450571053	FG	On-Demand	Anodyne	NPBWR1	20	40
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571057	FG	On-Demand	Mild	PAPA1_CARPA	45	40
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571057	FG	On-Demand	Mild	CTSL	15	40
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571057	FG	On-Demand	Mild	CHEK1	16	42
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571057	FG	On-Demand	Mild	CTRB_BOVIN	55	33
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571057	FG	On-Demand	Mild	POL	0	40
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571058	FG	On-Demand	Mild	PAPA1_CARPA	45	40
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571058	FG	On-Demand	Mild	CTSL	15	40
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571058	FG	On-Demand	Mild	CHEK1	16	42
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571058	FG	On-Demand	Mild	CTRB_BOVIN	55	33
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1cnc(C#N)cn1	ZINC000450571058	FG	On-Demand	Mild	POL	0	40
Cc1ccc(F)c(CC(=O)NCCCNc2cccc(F)c2)c1	ZINC000450571059	DG	On-Demand	Anodyne	KCNK3	36	42
Cc1ccc(F)c(CC(=O)NCCCNc2cccc(F)c2)c1	ZINC000450571059	DG	On-Demand	Anodyne	KCNK9	27	42
CNS(=O)(=O)c1ccc2c(c1)N(Cc1cccc(C(C)=O)c1)CC2	ZINC000450571061	EE	On-Demand	Anodyne	TRY2_BOVIN	75	38
CNS(=O)(=O)c1ccc2c(c1)N(Cc1cccc(C(C)=O)c1)CC2	ZINC000450571061	EE	On-Demand	Anodyne	AKR1C3	40	34
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571062	GJ	On-Demand	Anodyne	COLA	24	40
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571062	GJ	On-Demand	Anodyne	CPT1A	23	40
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571065	GJ	On-Demand	Anodyne	COLA	24	40
CC(C)(C)C(=O)CCCC(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571065	GJ	On-Demand	Anodyne	CPT1A	23	40
COC(=O)[C@H](c1ccccc1)N(C)C[C@H]1CCCCC1(F)F	ZINC000450571072	DH	On-Demand	Anodyne	AMY2	49	34
COC(=O)[C@H](c1ccccc1)N(C)C[C@@H]1CCCCC1(F)F	ZINC000450571074	DH	On-Demand	Anodyne	AMY2	49	34
COC(=O)[C@@H](c1ccccc1)N(C)C[C@H]1CCCCC1(F)F	ZINC000450571076	DH	On-Demand	Anodyne	AMY2	49	34
COC(=O)[C@@H](c1ccccc1)N(C)C[C@@H]1CCCCC1(F)F	ZINC000450571078	DH	On-Demand	Anodyne	AMY2	49	34
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	DRD2	18	41
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	DRD4	37	45
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	ACHE	22	44
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	HTR1D	30	44
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	HTR1B	18	44
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	HTR1F	75	38
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	HRH3	15	42
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	SSTR5	51	36
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	CCR2	16	46
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	MCHR1	28	41
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	MCHR2	46	36
CC(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450571080	EI	On-Demand	Anodyne	CDC7	42	37
CCOC(=O)[C@H]1CN(c2noc(-c3ccccc3)n2)CC12COC2	ZINC000450571101	ED	On-Demand	Anodyne	PDE8B	43	32
CCOC(=O)[C@@H]1CN(c2noc(-c3ccccc3)n2)CC12COC2	ZINC000450571102	ED	On-Demand	Anodyne	PDE8B	43	32
CCN(CCCC(=O)c1ccccc1)CC(=O)Nc1c(C)cccc1C	ZINC000450571143	FI	On-Demand	Anodyne	ACAT	0	43
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571148	GF	On-Demand	Bother	ABCB1	15	40
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571148	GF	On-Demand	Bother	MGLL	0	48
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571148	GF	On-Demand	Bother	ABHD6	0	48
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571149	GF	On-Demand	Bother	ABCB1	15	40
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571149	GF	On-Demand	Bother	MGLL	0	48
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571149	GF	On-Demand	Bother	ABHD6	0	48
CCOC(=O)c1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)nc1	ZINC000450571150	GE	On-Demand	Bother	SLC27A4	49	34
COc1cccc(-n2cc(C(=O)N3CC[C@@H](C(C)(C)C)C3)nn2)c1	ZINC000450571155	EF	On-Demand	Anodyne	DRD4	40	32
COc1cccc(-n2cc(C(=O)N3CC[C@@H](C(C)(C)C)C3)nn2)c1	ZINC000450571155	EF	On-Demand	Anodyne	CCKAR	0	40
COc1cccc(-n2cc(C(=O)N3CC[C@H](C(C)(C)C)C3)nn2)c1	ZINC000450571156	EF	On-Demand	Anodyne	DRD4	40	32
COc1cccc(-n2cc(C(=O)N3CC[C@H](C(C)(C)C)C3)nn2)c1	ZINC000450571156	EF	On-Demand	Anodyne	CCKAR	0	40
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	HTR1A	26	62
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	DRD2	40	51
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	DRD1	30	56
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	DRD4	24	51
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	HTR2A	44	55
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	HTR2C	38	58
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	DRD3	23	58
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	DRD5	22	51
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	ERG2	24	50
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	HTR7	41	50
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	SLC18A3	23	55
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	HTR3B	0	53
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	NET	0	52
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	AP2S1	0	50
O=C(CCCN1CCN(C(=O)c2ccccc2O)CC1)c1ccc(F)cc1	ZINC000450571163	FF	On-Demand	Anodyne	SLC6A7	0	41
Cc1ccc(NC(=O)[C@H]2CCCN(CC3(C#N)CCC3)C2)nc1	ZINC000450571168	DF	On-Demand	Mild	SLC6A1	47	33
Cc1ccc(NC(=O)[C@@H]2CCCN(CC3(C#N)CCC3)C2)nc1	ZINC000450571169	DF	On-Demand	Mild	SLC6A1	47	33
COCCOC[C@@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450571172	DC	On-Demand	Anodyne	ADRB3	44	37
COCCOC[C@@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450571172	DC	On-Demand	Anodyne	ABCB1	49	40
COCCOC[C@@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450571172	DC	On-Demand	Anodyne	SCN5A	51	32
COCCOC[C@@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450571172	DC	On-Demand	Anodyne	HSP90AB1	40	41
COCCOC[C@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450571173	DC	On-Demand	Anodyne	ADRB3	44	37
COCCOC[C@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450571173	DC	On-Demand	Anodyne	ABCB1	49	40
COCCOC[C@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450571173	DC	On-Demand	Anodyne	SCN5A	51	32
COCCOC[C@H](O)CN1CCC(Oc2ccccn2)CC1	ZINC000450571173	DC	On-Demand	Anodyne	HSP90AB1	40	41
COC(=O)C1(CNC(=O)c2ccc3cnccc3c2)CCCCC1	ZINC000450571181	EG	On-Demand	Anodyne	AKT1	0	42
CCn1c(SCc2nnc(C3CC3)s2)nc2ccccc21	ZINC000450571195	DI	On-Demand	Anodyne	PTGDR2	16	40
O=C(Cc1ccc(O)c(F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571221	FI	On-Demand	Anodyne	CACNA1B	52	35
O=C(Cc1ccc(O)c(F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571221	FI	On-Demand	Anodyne	MLNR	18	42
O=C(Cc1ccc(O)c(F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571221	FI	On-Demand	Anodyne	CCR2	60	43
O=C(Cc1ccc(O)c(F)c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571221	FI	On-Demand	Anodyne	LIPG	42	34
O=C(Cc1ccc(O)c(F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571223	FI	On-Demand	Anodyne	CACNA1B	52	35
O=C(Cc1ccc(O)c(F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571223	FI	On-Demand	Anodyne	MLNR	18	42
O=C(Cc1ccc(O)c(F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571223	FI	On-Demand	Anodyne	CCR2	60	43
O=C(Cc1ccc(O)c(F)c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571223	FI	On-Demand	Anodyne	LIPG	42	34
CCOC(=O)c1cc(C(=O)NCC2(C(=O)OC)CCCCC2)on1	ZINC000450571243	ED	On-Demand	Anodyne	HCN1	52	32
CCOC(=O)c1cc(C(=O)NCC2(C(=O)OC)CCCCC2)on1	ZINC000450571243	ED	On-Demand	Anodyne	HCN4	50	32
CCOC(=O)c1cc(C(=O)NCC2(C(=O)OC)CCCCC2)[nH]c1C	ZINC000450571245	FE	On-Demand	Anodyne	HCN1	49	31
CCOC(=O)c1cc(C(=O)NCC2(C(=O)OC)CCCCC2)[nH]c1C	ZINC000450571245	FE	On-Demand	Anodyne	HCN4	47	31
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C)c(-c2nnnn2C2CC2)c1	ZINC000450571251	GG	On-Demand	Anodyne	TIMP3	41	31
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(C)c(-c2nnnn2C2CC2)c1	ZINC000450571254	GG	On-Demand	Anodyne	TIMP3	41	31
CCNS(=O)(=O)[C@H]1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450571255	FE	On-Demand	Anodyne	MDM2	87	37
CCNS(=O)(=O)[C@@H]1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450571256	FE	On-Demand	Anodyne	MDM2	87	37
O=C(c1cnc(NC[C@@H](O)Cc2cccc(F)c2)c(Cl)c1)N1CCOCC1	ZINC000450571262	GE	On-Demand	Anodyne	STAT6	46	40
CSc1cccc(C(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450571268	DG	On-Demand	Anodyne	DRD4	46	35
CSc1cccc(C(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450571268	DG	On-Demand	Anodyne	CCR5	18	42
CSc1cccc(C(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450571268	DG	On-Demand	Anodyne	DPP7	20	45
CSc1cccc(C(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450571269	DG	On-Demand	Anodyne	DRD4	46	35
CSc1cccc(C(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450571269	DG	On-Demand	Anodyne	CCR5	18	42
CSc1cccc(C(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450571269	DG	On-Demand	Anodyne	DPP7	20	45
O=C(c1cnc(NC[C@H](O)Cc2cccc(F)c2)c(Cl)c1)N1CCOCC1	ZINC000450571271	GE	On-Demand	Anodyne	STAT6	46	40
Cc1cc(C)cc([C@@H]2CCN(C(=O)C3CC(C)(O)C3)C2)c1	ZINC000450571273	CF	On-Demand	Anodyne	L3MBTL3	51	38
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450571277	FF	On-Demand	Bother	L3MBTL3	43	34
Cc1cc(C)cc([C@H]2CCN(C(=O)C3CC(C)(O)C3)C2)c1	ZINC000450571279	CF	On-Demand	Anodyne	L3MBTL3	51	38
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450571280	FF	On-Demand	Bother	L3MBTL3	43	34
O=C([C@@H](O)C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000450571291	CE	On-Demand	Anodyne	GRIN2B	54	42
O=C([C@@H](O)C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000450571291	CE	On-Demand	Anodyne	CHRNA7	40	44
O=C([C@@H](O)C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000450571291	CE	On-Demand	Anodyne	C3AR1	58	52
O=C([C@@H](O)C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000450571291	CE	On-Demand	Anodyne	ACHP_LYMST	24	44
O=C([C@H](O)C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000450571294	CE	On-Demand	Anodyne	GRIN2B	54	42
O=C([C@H](O)C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000450571294	CE	On-Demand	Anodyne	CHRNA7	40	44
O=C([C@H](O)C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000450571294	CE	On-Demand	Anodyne	C3AR1	58	52
O=C([C@H](O)C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000450571294	CE	On-Demand	Anodyne	ACHP_LYMST	24	44
CCOC(=O)c1ccc(CN2CCC[C@H]2c2ncc(-c3ccc(F)cc3)[nH]2)nc1	ZINC000450571299	GI	On-Demand	Anodyne	SSTR3	26	40
O=C(NCCCNc1cccc(F)c1)c1cccc(C(F)(F)F)n1	ZINC000450571302	EG	On-Demand	Anodyne	TBK1	16	43
COC(=O)c1ccc2c(c1)CN(C(=O)Cc1sccc1Br)CC2	ZINC000450571303	GG	On-Demand	Anodyne	HDAC6	37	40
CCOC(=O)c1ccc(CN2CCC[C@@H]2c2ncc(-c3ccc(F)cc3)[nH]2)nc1	ZINC000450571304	GI	On-Demand	Anodyne	SSTR3	26	40
C[C@H](CCO)CCNc1ncnc2cc(Br)ccc12	ZINC000450571313	DF	On-Demand	Anodyne	EGFR	66	41
C[C@@H](CCO)CCNc1ncnc2cc(Br)ccc12	ZINC000450571315	DF	On-Demand	Anodyne	EGFR	66	41
CCN(CC)S(=O)(=O)c1ccc(NCC[C@@H](C)CCO)c([N+](=O)[O-])c1	ZINC000450571317	FE	On-Demand	Bother	COLA	69	34
CCN(CC)S(=O)(=O)c1ccc(NCC[C@H](C)CCO)c([N+](=O)[O-])c1	ZINC000450571318	FE	On-Demand	Bother	COLA	69	34
Cc1cccc([C@H]2CCN(C(=O)c3ccsc3C)C2)c1	ZINC000450571321	CH	On-Demand	Anodyne	TPSAB1	29	42
Cc1cccc([C@H]2CCN(C(=O)c3ccsc3C)C2)c1	ZINC000450571321	CH	On-Demand	Anodyne	HPGD	17	41
Cc1cccc([C@@H]2CCN(C(=O)c3ccsc3C)C2)c1	ZINC000450571323	CH	On-Demand	Anodyne	TPSAB1	29	42
Cc1cccc([C@@H]2CCN(C(=O)c3ccsc3C)C2)c1	ZINC000450571323	CH	On-Demand	Anodyne	HPGD	17	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	ACE	56	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	OPRM1	18	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	MME	35	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	CTRA_BOVIN	40	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	TRY1_BOVIN	50	33
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	COLA	30	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	CPT1A	27	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	PREP	55	35
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	CELA2A	40	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571345	GI	On-Demand	Anodyne	BRCA1	44	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	ACE	56	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	OPRM1	18	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	MME	35	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	CTRA_BOVIN	40	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	TRY1_BOVIN	50	33
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	COLA	30	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	CPT1A	27	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	PREP	55	35
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	CELA2A	40	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571349	GI	On-Demand	Anodyne	BRCA1	44	31
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571353	GG	On-Demand	Bother	DRD4	28	41
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571353	GG	On-Demand	Bother	SIGMAR1	15	43
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571353	GG	On-Demand	Bother	SSTR5	73	43
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571353	GG	On-Demand	Bother	UTS2R	22	40
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571353	GG	On-Demand	Bother	MLNR	40	32
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571353	GG	On-Demand	Bother	CCR2	17	44
COC(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571353	GG	On-Demand	Bother	MCHR1	28	44
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	ACE	56	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	OPRM1	18	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	MME	35	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	CTRA_BOVIN	40	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	TRY1_BOVIN	50	33
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	COLA	30	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	CPT1A	27	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	PREP	55	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	CELA2A	40	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571355	GI	On-Demand	Anodyne	BRCA1	44	31
COC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571358	GG	On-Demand	Bother	DRD4	28	41
COC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571358	GG	On-Demand	Bother	SIGMAR1	15	43
COC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571358	GG	On-Demand	Bother	SSTR5	73	43
COC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571358	GG	On-Demand	Bother	UTS2R	22	40
COC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571358	GG	On-Demand	Bother	MLNR	40	32
COC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571358	GG	On-Demand	Bother	CCR2	17	44
COC(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl	ZINC000450571358	GG	On-Demand	Bother	MCHR1	28	44
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	ACE	56	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	OPRM1	18	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	MME	35	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	CTRA_BOVIN	40	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	TRY1_BOVIN	50	33
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	COLA	30	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	CPT1A	27	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	PREP	55	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	CELA2A	40	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571359	GI	On-Demand	Anodyne	BRCA1	44	31
C[C@H](CCO)CCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450571360	DG	On-Demand	Mild	MAP3K8	67	35
C[C@@H](CCO)CCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450571363	DG	On-Demand	Mild	MAP3K8	67	35
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1(CO)CCC1	ZINC000450571375	DF	On-Demand	Anodyne	MTTP	49	35
COc1ccc(C2(CNC(=O)c3ccn(CCn4cccn4)n3)CCC2)cc1	ZINC000450571408	GF	On-Demand	Anodyne	KCNA3	47	38
COc1ccc(C2(CNC(=O)c3ccn(CCn4cccn4)n3)CCC2)cc1	ZINC000450571408	GF	On-Demand	Anodyne	ACAT	0	46
COc1ccc(C2(CNC(=O)c3ccn(CCn4cccn4)n3)CCC2)cc1	ZINC000450571408	GF	On-Demand	Anodyne	HCN1	62	36
COc1ccc(C2(CNC(=O)c3ccn(CCn4cccn4)n3)CCC2)cc1	ZINC000450571408	GF	On-Demand	Anodyne	HCN4	49	33
COC(=O)c1ccc2c(c1)CN(C(=O)C1(Cc3ccccc3)CCOCC1)CC2	ZINC000450571409	GG	On-Demand	Anodyne	HDAC6	35	41
CCOC(=O)[C@@H]1CN(c2ncc(-c3ccccc3)s2)CC12COC2	ZINC000450571426	EF	On-Demand	Anodyne	LUCI_LUCLA	17	41
CCOC(=O)[C@H]1CN(c2ncc(-c3ccccc3)s2)CC12COC2	ZINC000450571428	EF	On-Demand	Anodyne	LUCI_LUCLA	17	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450571445	DG	On-Demand	Anodyne	CCR1	28	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450571445	DG	On-Demand	Anodyne	RHODESAIN	0	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450571447	DG	On-Demand	Anodyne	CCR1	28	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450571447	DG	On-Demand	Anodyne	RHODESAIN	0	41
CCOC(=O)[C@H]1CN(c2ncnc3cccc(C)c23)CC12COC2	ZINC000450571451	ED	On-Demand	Anodyne	AKT1	0	42
CCOC(=O)[C@@H]1CN(c2ncnc3cccc(C)c23)CC12COC2	ZINC000450571453	ED	On-Demand	Anodyne	AKT1	0	42
CCC[C@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450571455	BD	On-Demand	Anodyne	DRD1	15	52
CCC[C@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450571455	BD	On-Demand	Anodyne	DRD5	38	41
CCC[C@@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450571457	BD	On-Demand	Anodyne	DRD1	15	52
CCC[C@@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450571457	BD	On-Demand	Anodyne	DRD5	38	41
O=C(NCCCNc1cccc(F)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450571472	DF	On-Demand	Anodyne	TBK1	24	44
C[C@@H](O)CCSc1nnc(-c2ccco2)n1Cc1ccccc1	ZINC000450571475	EG	On-Demand	Anodyne	HCRTR2	0	40
C[C@H](O)CCSc1nnc(-c2ccco2)n1Cc1ccccc1	ZINC000450571476	EG	On-Demand	Anodyne	HCRTR2	0	40
CC(=O)[C@@](C)(O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571478	EC	On-Demand	Bother	MGLL	0	40
CC(=O)[C@@](C)(O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571478	EC	On-Demand	Bother	ABHD6	0	40
C1=C[C@H]2C[C@H]1[C@@H]1CN(c3ccnc(Cc4ccccc4)n3)C[C@@H]12	ZINC000450571483	DG	On-Demand	Anodyne	SORD	43	40
CC(=O)[C@](C)(O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571484	EC	On-Demand	Bother	MGLL	0	40
CC(=O)[C@](C)(O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450571484	EC	On-Demand	Bother	ABHD6	0	40
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1ccc(C(N)=O)nn1	ZINC000450571487	FE	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1ccc(C(N)=O)nn1	ZINC000450571488	FE	On-Demand	Anodyne	FPR1	40	35
CC(F)(F)c1ccc(C(=O)NCCCNc2ccccc2F)cn1	ZINC000450571489	EH	On-Demand	Anodyne	EPHX2	0	40
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)Cc1ccccc1	ZINC000450571492	GF	On-Demand	Anodyne	CETP	0	43
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)Cc1ccccc1	ZINC000450571492	GF	On-Demand	Anodyne	BACE2	37	40
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)Cc1ccccc1	ZINC000450571492	GF	On-Demand	Anodyne	PDS	41	37
CN(CCN(C)Cc1ccccc1)CC(=O)NCc1ccccc1	ZINC000450571496	EE	On-Demand	Anodyne	LTA4H	29	49
CN(CCN(C)Cc1ccccc1)CC(=O)NCc1ccccc1	ZINC000450571496	EE	On-Demand	Anodyne	TSPO	37	41
CN(CCN(C)Cc1ccccc1)CC(=O)NCc1ccccc1	ZINC000450571496	EE	On-Demand	Anodyne	AMP1_PLAFQ	40	39
CN(CCN(C)Cc1ccccc1)CC(=O)NCc1ccccc1	ZINC000450571496	EE	On-Demand	Anodyne	LIMK2	41	38
CN(CCN(C)Cc1ccccc1)CC(=O)NCc1ccccc1	ZINC000450571496	EE	On-Demand	Anodyne	PDS	41	33
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450571505	FG	On-Demand	Anodyne	HRH1	17	42
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450571505	FG	On-Demand	Anodyne	CCR3	19	42
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450571505	FG	On-Demand	Anodyne	EPHX2	22	49
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450571506	FG	On-Demand	Anodyne	HRH1	17	42
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450571506	FG	On-Demand	Anodyne	CCR3	19	42
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450571506	FG	On-Demand	Anodyne	EPHX2	22	49
Cc1ccc(S(=O)(=O)NCCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450571517	GD	On-Demand	Anodyne	HTR7	17	48
Cc1ccc(S(=O)(=O)NCCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1	ZINC000450571525	GD	On-Demand	Anodyne	HTR7	17	48
COc1ccc(CNC(=O)CCNC(C)(C)c2nc(C)cs2)c(OC)c1	ZINC000450571550	GF	On-Demand	Anodyne	MTNR1A	43	38
O=C(NCC1(CO)CCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450571584	FE	On-Demand	Anodyne	TRPC6	52	33
O=C(NCC1(CO)CCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450571584	FE	On-Demand	Anodyne	TRPC3	46	33
Cc1cnc(NC[C@@H]2CS(=O)(=O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000450571589	EE	On-Demand	Bother	PRKCQ	46	39
Cc1cnc(NC[C@H]2CS(=O)(=O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000450571590	EE	On-Demand	Bother	PRKCQ	46	39
C[C@H](CCO)CCNc1ncccc1OCc1ccccc1	ZINC000450571594	DG	On-Demand	Anodyne	PPIA	54	43
C[C@@H](CCO)CCNc1ncccc1OCc1ccccc1	ZINC000450571595	DG	On-Demand	Anodyne	PPIA	54	43
COC(=O)C1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCCCC1	ZINC000450571596	FG	On-Demand	Anodyne	HCN1	66	40
COC(=O)C1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCCCC1	ZINC000450571596	FG	On-Demand	Anodyne	HCN4	58	39
CCS(=O)(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1	ZINC000450571629	EF	On-Demand	Anodyne	MLNR	15	41
CCS(=O)(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1	ZINC000450571629	EF	On-Demand	Anodyne	SLC6A5	18	43
CCS(=O)(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1	ZINC000450571629	EF	On-Demand	Anodyne	NOD1	31	41
CCS(=O)(=O)c1ccc(CN2CCc3ccc(O)cc3C2)cc1	ZINC000450571629	EF	On-Demand	Anodyne	NOD2	46	39
CCOC(=O)c1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)[nH]c1C	ZINC000450571632	GI	On-Demand	Anodyne	TACR1	45	34
CCOC(=O)c1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)[nH]c1C	ZINC000450571632	GI	On-Demand	Anodyne	CACNA1B	55	37
CCOC(=O)c1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)[nH]c1C	ZINC000450571632	GI	On-Demand	Anodyne	SLC9A1	44	37
CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)[nH]c1C	ZINC000450571633	GI	On-Demand	Anodyne	TACR1	45	34
CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)[nH]c1C	ZINC000450571633	GI	On-Demand	Anodyne	CACNA1B	55	37
CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)[nH]c1C	ZINC000450571633	GI	On-Demand	Anodyne	SLC9A1	44	37
COC(=O)c1ccc(CN2C(=O)NC3(CCCCCC3)C2=O)cc1Cl	ZINC000450571638	FG	On-Demand	Anodyne	Q9FYV8_MAIZE	43	39
COc1ccc(C2(CNC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)CCC2)cc1	ZINC000450571647	FI	On-Demand	Anodyne	KCNA3	43	35
COc1ccc(C2(CNC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)CCC2)cc1	ZINC000450571647	FI	On-Demand	Anodyne	MTNR1A	60	47
COc1ccc(C2(CNC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)CCC2)cc1	ZINC000450571647	FI	On-Demand	Anodyne	MTNR1B	48	47
COc1ccc(C2(CNC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)CCC2)cc1	ZINC000450571647	FI	On-Demand	Anodyne	ACAT	0	51
COc1ccc(C2(CNC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)CCC2)cc1	ZINC000450571647	FI	On-Demand	Anodyne	NPBWR1	55	32
CC(C)(C)OC(=O)CC[C@@H](Cc1ccccc1)Nc1ccc2nnnn2n1	ZINC000450571652	FE	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)CC[C@H](Cc1ccccc1)Nc1ccc2nnnn2n1	ZINC000450571653	FE	On-Demand	Anodyne	FPR1	40	35
CCNS(=O)(=O)c1ccc2c(c1)N(CC1CC(F)(F)C1)CC2	ZINC000450571656	EE	On-Demand	Anodyne	PNMT	15	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN2CCCC[C@H]2C1	ZINC000450571659	CE	On-Demand	Anodyne	SLC6A1	0	43
C[C@H](c1ccccc1)[C@H](O)CN1CCN2CCCC[C@@H]2C1	ZINC000450571660	CE	On-Demand	Anodyne	SLC6A1	0	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCN2CCCC[C@H]2C1	ZINC000450571661	CE	On-Demand	Anodyne	SLC6A1	0	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCN2CCCC[C@@H]2C1	ZINC000450571662	CE	On-Demand	Anodyne	SLC6A1	0	43
COc1ccc(-c2nnc(SCC[C@@H](C)O)o2)cc1	ZINC000450571685	CF	On-Demand	Anodyne	GSK3B	0	56
COc1ccc(-c2nnc(SCC[C@@H](C)O)o2)cc1	ZINC000450571685	CF	On-Demand	Anodyne	GSK3A	34	48
COc1ccc(-c2nnc(SCC[C@H](C)O)o2)cc1	ZINC000450571686	CF	On-Demand	Anodyne	GSK3B	0	56
COc1ccc(-c2nnc(SCC[C@H](C)O)o2)cc1	ZINC000450571686	CF	On-Demand	Anodyne	GSK3A	34	48
CCC[C@H](OC)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450571687	DG	On-Demand	Anodyne	MTNR1A	22	44
CCC[C@H](OC)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450571687	DG	On-Demand	Anodyne	MTNR1B	18	43
CCC[C@H](OC)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450571687	DG	On-Demand	Anodyne	ACAT	0	53
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	HTR1A	108	48
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	DRD2	95	53
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	DRD1	32	41
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	DRD4	74	53
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	ADRA1D	79	45
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	HTR2A	34	41
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	ADRA1A	68	45
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	ADRA1B	45	42
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	DRD3	85	53
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	HTR7	57	46
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	SIGMAR1	20	41
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	ESRRG	43	32
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	ABCB1	45	39
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	AP2S1	0	46
CC(=O)c1ccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)cc1	ZINC000450571689	GG	On-Demand	Anodyne	ALPHA-1A	0	41
C[C@H](OCc1ccc(F)cc1)C(=O)NCCCNc1cccc(F)c1	ZINC000450571691	EG	On-Demand	Anodyne	CCR3	29	40
C[C@H](OCc1ccc(F)cc1)C(=O)NCCCNc1cccc(F)c1	ZINC000450571691	EG	On-Demand	Anodyne	LEF	45	32
C[C@@H](OCc1ccc(F)cc1)C(=O)NCCCNc1cccc(F)c1	ZINC000450571692	EG	On-Demand	Anodyne	CCR3	29	40
C[C@@H](OCc1ccc(F)cc1)C(=O)NCCCNc1cccc(F)c1	ZINC000450571692	EG	On-Demand	Anodyne	LEF	45	32
COCCn1ccc2ccc(NC(=O)CS(=O)(=O)C3CC3)cc21	ZINC000450571694	ED	On-Demand	Anodyne	CYSLTR1	0	47
COCCn1ccc2ccc(NC(=O)CS(=O)(=O)C3CC3)cc21	ZINC000450571694	ED	On-Demand	Anodyne	NAMPT	23	42
CCC[C@@H](OC)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450571700	DG	On-Demand	Anodyne	MTNR1A	22	44
CCC[C@@H](OC)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450571700	DG	On-Demand	Anodyne	MTNR1B	18	43
CCC[C@@H](OC)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450571700	DG	On-Demand	Anodyne	ACAT	0	53
CC[C@@H]1C[C@H]1C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450571701	CG	On-Demand	Anodyne	MTNR1A	28	44
CC[C@@H]1C[C@H]1C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450571701	CG	On-Demand	Anodyne	ACAT	0	51
O=C1CCC(CN2CCC[C@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)CC1	ZINC000450571703	FJ	On-Demand	Anodyne	PRCP	15	42
O=C1CCC(CN2CCC[C@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)CC1	ZINC000450571703	FJ	On-Demand	Anodyne	GRIN2D	42	30
O=C1CCC(CN2CCC[C@@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)CC1	ZINC000450571705	FJ	On-Demand	Anodyne	PRCP	15	42
O=C1CCC(CN2CCC[C@@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)CC1	ZINC000450571705	FJ	On-Demand	Anodyne	GRIN2D	42	30
COC(=O)c1csc(CN2CCN(C(=O)c3cccc(O)c3)CC2)n1	ZINC000450571708	FD	On-Demand	Anodyne	TRPC6	45	34
C[C@H](Oc1ccccn1)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571709	FH	On-Demand	Anodyne	CCR2	51	41
C[C@H](Oc1ccccn1)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571709	FH	On-Demand	Anodyne	RHOA	0	40
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571710	FH	On-Demand	Anodyne	CCR2	51	41
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571710	FH	On-Demand	Anodyne	RHOA	0	40
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571711	FH	On-Demand	Anodyne	CCR2	51	41
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571711	FH	On-Demand	Anodyne	RHOA	0	40
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571712	FH	On-Demand	Anodyne	CCR2	51	41
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450571712	FH	On-Demand	Anodyne	RHOA	0	40
COc1cc(CC(=O)N2CC[C@H](c3cc(C)cc(C)c3)C2)ccc1O	ZINC000450571717	EH	On-Demand	Anodyne	TRPV1	0	44
COc1cc(CC(=O)N2CC[C@H](c3cc(C)cc(C)c3)C2)ccc1O	ZINC000450571717	EH	On-Demand	Anodyne	RORC	48	36
COc1cc(CC(=O)N2CC[C@@H](c3cc(C)cc(C)c3)C2)ccc1O	ZINC000450571734	EH	On-Demand	Anodyne	TRPV1	0	44
COc1cc(CC(=O)N2CC[C@@H](c3cc(C)cc(C)c3)C2)ccc1O	ZINC000450571734	EH	On-Demand	Anodyne	RORC	48	36
COc1ccc(CNC(=O)CCNC(C)(C)c2nccs2)c(OC)c1	ZINC000450571742	FF	On-Demand	Anodyne	MTNR1A	42	40
Cc1ccc(S(=O)(=O)NCCN2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450571745	FC	On-Demand	Anodyne	HTR7	22	48
O=C(NCCCNc1cccc(F)c1)c1ccnc(OC(F)F)c1	ZINC000450571747	EG	On-Demand	Anodyne	TBK1	16	43
CCOc1ccc(OCc2cn(C)nc2C)cc1	ZINC000450571757	BF	On-Demand	Anodyne	CACNA2D1	63	42
CCOc1ccc(OCc2cn(C)nc2C)cc1	ZINC000450571757	BF	On-Demand	Anodyne	CACNA2D2	53	34
Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccn(CC(F)(F)F)n3)C2)nc1	ZINC000450571774	GF	On-Demand	Anodyne	SLC6A1	59	31
Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccn(CC(F)(F)F)n3)C2)nc1	ZINC000450571777	GF	On-Demand	Anodyne	SLC6A1	59	31
COC(=O)c1csc(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)n1	ZINC000450571791	GD	On-Demand	Bother	CACNA1D	66	35
COC(=O)c1csc(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)n1	ZINC000450571791	GD	On-Demand	Bother	SLC27A4	50	32
COC(=O)c1csc(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)n1	ZINC000450571804	GD	On-Demand	Bother	CACNA1D	66	35
COC(=O)c1csc(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)n1	ZINC000450571804	GD	On-Demand	Bother	SLC27A4	50	32
C[C@@H](c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1)C(F)(F)F	ZINC000450571805	GI	On-Demand	Anodyne	FAAH	18	42
C[C@@H](c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1)C(F)(F)F	ZINC000450571805	GI	On-Demand	Anodyne	PARP1	18	41
C[C@@H](c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1)C(F)(F)F	ZINC000450571805	GI	On-Demand	Anodyne	MGLL	0	43
C[C@H](c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1)C(F)(F)F	ZINC000450571806	GI	On-Demand	Anodyne	FAAH	18	42
C[C@H](c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1)C(F)(F)F	ZINC000450571806	GI	On-Demand	Anodyne	PARP1	18	41
C[C@H](c1ccc(CN2CCN(C(=O)c3cccc(O)c3)CC2)cc1)C(F)(F)F	ZINC000450571806	GI	On-Demand	Anodyne	MGLL	0	43
CCC[C@@H](O)CN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000450571807	FG	On-Demand	Anodyne	ABCB1	0	42
CCC[C@@H](O)CN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000450571807	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	46
COc1cc(-c2noc(CN3CCC(Nc4cccc(C)c4)CC3)n2)ncn1	ZINC000450571808	GF	On-Demand	Anodyne	SSTR5	62	35
CCC[C@H](O)CN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000450571809	FG	On-Demand	Anodyne	ABCB1	0	42
CCC[C@H](O)CN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000450571809	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	46
CC[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(F)F	ZINC000450571811	CF	On-Demand	Anodyne	DHOD	0	53
CC[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(F)F	ZINC000450571814	CF	On-Demand	Anodyne	DHOD	0	53
COc1cccc(OCCC(=O)N2CCN(C)[C@@H](C)[C@@H]2C)c1	ZINC000450571819	DE	On-Demand	Anodyne	DRD4	46	35
COc1cccc(OCCC(=O)N2CCN(C)[C@H](C)[C@@H]2C)c1	ZINC000450571821	DE	On-Demand	Anodyne	DRD4	46	35
COc1cccc(OCCC(=O)N2CCN(C)[C@@H](C)[C@H]2C)c1	ZINC000450571823	DE	On-Demand	Anodyne	DRD4	46	35
COC(=O)c1ccc2c(c1)CN(C(=O)C1(Cc3cccc(Cl)c3)CC1)CC2	ZINC000450571824	GI	On-Demand	Anodyne	HDAC6	34	42
COC(=O)c1ccc2c(c1)CN(C(=O)C1(Cc3cccc(Cl)c3)CC1)CC2	ZINC000450571824	GI	On-Demand	Anodyne	HSD17B3	23	42
COc1cccc(OCCC(=O)N2CCN(C)[C@H](C)[C@H]2C)c1	ZINC000450571825	DE	On-Demand	Anodyne	DRD4	46	35
COC(=O)c1cccc(CN2CCN(C(=O)c3ccccc3O)CC2)c1Cl	ZINC000450571836	GF	On-Demand	Anodyne	P2RX7	25	40
COC(=O)c1cccc(CN2CCN(C(=O)c3ccccc3O)CC2)c1Cl	ZINC000450571836	GF	On-Demand	Anodyne	MT-CYB	40	31
C[C@@H](Oc1ccccn1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571843	GI	On-Demand	Anodyne	ADAM17	33	41
COCCOC[C@@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450571844	CC	On-Demand	Anodyne	ABCB1	40	39
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571845	GI	On-Demand	Anodyne	ADAM17	33	41
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H]1c1ccc(Br)s1	ZINC000450571846	GI	On-Demand	Anodyne	ADAM17	33	41
C[C@@H](Oc1ccccn1)C(=O)N1CCC[C@@H]1c1ccc(Br)s1	ZINC000450571848	GI	On-Demand	Anodyne	ADAM17	33	41
COCCOC[C@H](O)CN1CCc2ccc(O)cc2C1	ZINC000450571867	CC	On-Demand	Anodyne	ABCB1	40	39
COc1ccc(C2(CNC(=O)Cn3cc(C(C)=O)nn3)CCC2)cc1	ZINC000450571885	ED	On-Demand	Anodyne	ACAT	0	45
COC(=O)c1ccc2c(c1)CN(C(=O)c1ccc(C)nc1C(C)C)CC2	ZINC000450571887	FG	On-Demand	Anodyne	BCL2	0	41
O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC(Cc2cccnc2)CC1	ZINC000450571890	GG	On-Demand	Bother	GRIN2B	48	41
O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC(Cc2cccnc2)CC1	ZINC000450571890	GG	On-Demand	Bother	CHRNA7	41	35
O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC(Cc2cccnc2)CC1	ZINC000450571890	GG	On-Demand	Bother	C3AR1	43	47
O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC(Cc2cccnc2)CC1	ZINC000450571890	GG	On-Demand	Bother	MGLL	0	45
COCc1cc(NC[C@@H](O)Cc2cccc(F)c2)n2ncnc2n1	ZINC000450571929	ED	On-Demand	Anodyne	DHOD	0	40
COCc1cc(NC[C@H](O)Cc2cccc(F)c2)n2ncnc2n1	ZINC000450571930	ED	On-Demand	Anodyne	DHOD	0	40
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	DRD4	26	43
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	KCNH2	15	45
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	SSTR5	41	43
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	SSTR1	27	40
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	FAAH	18	49
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	MGLL	0	57
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	CCR8	41	45
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	ABHD6	0	57
COc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl	ZINC000450571940	GG	On-Demand	Bother	KCNJ1	34	44
COc1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1	ZINC000450571946	EI	On-Demand	Anodyne	GSK3B	20	57
COc1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1	ZINC000450571946	EI	On-Demand	Anodyne	GSK3A	47	49
CC(C)(C)[C@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450571964	DG	On-Demand	Anodyne	ABHD11	0	41
CC(C)(C)[C@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450571966	DG	On-Demand	Anodyne	ABHD11	0	41
CC(C)(C)[C@@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450571967	DG	On-Demand	Anodyne	ABHD11	0	41
CC(C)(C)[C@@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450571968	DG	On-Demand	Anodyne	ABHD11	0	41
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@H]2CCCC2(F)F)C1=O	ZINC000450571969	FF	On-Demand	Bother	SLC27A4	54	36
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@H]2CCCC2(F)F)C1=O	ZINC000450571971	FF	On-Demand	Bother	SLC27A4	54	36
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@@H]2CCCC2(F)F)C1=O	ZINC000450571973	FF	On-Demand	Bother	SLC27A4	54	36
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@@H]2CCCC2(F)F)C1=O	ZINC000450571975	FF	On-Demand	Bother	SLC27A4	54	36
COC(=O)c1ccc2c(c1)CN(C(=O)CS(=O)(=O)C1CC1)CC2	ZINC000450571976	EC	On-Demand	Anodyne	SRD5A1	22	40
COC(=O)c1ccc2c(c1)CN(C(=O)CS(=O)(=O)C1CC1)CC2	ZINC000450571976	EC	On-Demand	Anodyne	SRD5A2	24	40
COC(=O)c1ccc2c(c1)CN(C(=O)CS(=O)(=O)C1CC1)CC2	ZINC000450571976	EC	On-Demand	Anodyne	HDAC6	37	40
COc1ccc(-c2nnc(SCc3oc(C(C)C)nc3C)o2)cc1	ZINC000450571983	EI	On-Demand	Anodyne	GSK3B	19	56
COc1ccc(-c2nnc(SCc3oc(C(C)C)nc3C)o2)cc1	ZINC000450571983	EI	On-Demand	Anodyne	GSK3A	43	48
CCOCc1nc(C)c(C(=O)NCC2(c3ccc(OC)cc3)CCC2)s1	ZINC000450571986	FH	On-Demand	Anodyne	ACAT	0	44
COc1ccc(C2(CNC(=O)c3cn(-c4cccc(OC)c4)nn3)CCC2)cc1	ZINC000450572000	GG	On-Demand	Anodyne	DRD4	45	35
COc1ccc(C2(CNC(=O)c3cn(-c4cccc(OC)c4)nn3)CCC2)cc1	ZINC000450572000	GG	On-Demand	Anodyne	KCNA3	43	36
COc1ccc(C2(CNC(=O)c3cn(-c4cccc(OC)c4)nn3)CCC2)cc1	ZINC000450572000	GG	On-Demand	Anodyne	MTNR1A	32	41
COc1ccc(C2(CNC(=O)c3cn(-c4cccc(OC)c4)nn3)CCC2)cc1	ZINC000450572000	GG	On-Demand	Anodyne	MTNR1B	28	41
COc1ccc(C2(CNC(=O)c3cn(-c4cccc(OC)c4)nn3)CCC2)cc1	ZINC000450572000	GG	On-Demand	Anodyne	ACAT	0	48
CSc1cccc(C(=O)N2CC[C@H](c3cccc(C)c3)C2)c1	ZINC000450572003	DI	On-Demand	Anodyne	HSD11B1	0	47
CSc1cccc(C(=O)N2CC[C@H](c3cccc(C)c3)C2)c1	ZINC000450572003	DI	On-Demand	Anodyne	RHOA	0	43
CSc1cccc(C(=O)N2CC[C@H](c3cccc(C)c3)C2)c1	ZINC000450572003	DI	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CC[C@H](c3cccc(C)c3)C2)c1	ZINC000450572003	DI	On-Demand	Anodyne	L3MBTL3	54	42
CSc1cccc(C(=O)N2CC[C@H](c3cccc(C)c3)C2)c1	ZINC000450572003	DI	On-Demand	Anodyne	HPGD	23	46
CSc1cccc(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1	ZINC000450572006	DI	On-Demand	Anodyne	HSD11B1	0	47
CSc1cccc(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1	ZINC000450572006	DI	On-Demand	Anodyne	RHOA	0	43
CSc1cccc(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1	ZINC000450572006	DI	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1	ZINC000450572006	DI	On-Demand	Anodyne	L3MBTL3	45	42
CSc1cccc(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1	ZINC000450572006	DI	On-Demand	Anodyne	HPGD	21	42
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cn(CC3CC3)nn2)C1=O	ZINC000450572008	FD	On-Demand	Bother	SLC27A4	43	35
CN(C)C(=O)c1ccc(N[C@@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)nc1	ZINC000450572009	GH	On-Demand	Anodyne	POL	0	41
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cn(CC3CC3)nn2)C1=O	ZINC000450572010	FD	On-Demand	Bother	SLC27A4	43	35
O=C(c1ccsn1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572011	EH	On-Demand	Anodyne	CACNA1B	43	36
O=C(c1ccsn1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572011	EH	On-Demand	Anodyne	CCR2	44	42
O=C(c1ccsn1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572011	EH	On-Demand	Anodyne	RBP4	26	44
O=C(c1ccsn1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572012	EH	On-Demand	Anodyne	CACNA1B	43	36
O=C(c1ccsn1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572012	EH	On-Demand	Anodyne	CCR2	44	42
O=C(c1ccsn1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572012	EH	On-Demand	Anodyne	RBP4	26	44
CN(C)C(=O)c1ccc(N[C@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)nc1	ZINC000450572013	GH	On-Demand	Anodyne	POL	0	41
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	HTR1A	91	47
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	DRD2	83	46
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	DRD1	34	41
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	ADRA1D	78	49
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	HTR2A	41	45
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	ADRA1A	56	40
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	ADRA1B	36	41
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	DRD3	63	40
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	HTR7	72	42
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	ABCB1	42	37
C[C@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572015	DD	On-Demand	Anodyne	HSP90AB1	35	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450572016	EF	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@H](c1ccccc1)[C@H](O)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450572016	EF	On-Demand	Anodyne	ABCB1	0	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450572017	EF	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450572017	EF	On-Demand	Anodyne	ABCB1	0	40
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	HTR1A	91	47
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	DRD2	83	46
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	DRD1	34	41
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	ADRA1D	78	49
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	HTR2A	41	45
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	ADRA1A	56	40
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	ADRA1B	36	41
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	DRD3	63	40
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	HTR7	72	42
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	ABCB1	42	37
C[C@@H](O)CCN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450572018	DD	On-Demand	Anodyne	HSP90AB1	35	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450572019	EF	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450572019	EF	On-Demand	Anodyne	ABCB1	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450572021	EF	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2cccc(O)c2)CC1	ZINC000450572021	EF	On-Demand	Anodyne	ABCB1	0	40
Cc1cccc(C2=CCN(C(=O)C3(Cc4ccccc4)CCOCC3)CC2)c1	ZINC000450572023	GJ	On-Demand	Anodyne	ADAM10	30	43
O=C(CC[C@@H]1CCC(=O)N1)NCCCNc1cccc(F)c1	ZINC000450572025	DD	On-Demand	Anodyne	TBK1	15	42
O=C(CC[C@H]1CCC(=O)N1)NCCCNc1cccc(F)c1	ZINC000450572026	DD	On-Demand	Anodyne	TBK1	15	42
COc1ccc(C(=O)N2CC[C@@H](C(C)(C)C)C2)cc1S(C)(=O)=O	ZINC000450572057	EF	On-Demand	Anodyne	SLC9A1	20	40
COc1ccc(C(=O)N2CC[C@@H](C(C)(C)C)C2)cc1S(C)(=O)=O	ZINC000450572057	EF	On-Demand	Anodyne	L3MBTL3	66	39
COc1ccc(C(=O)N2CC[C@H](C(C)(C)C)C2)cc1S(C)(=O)=O	ZINC000450572059	EF	On-Demand	Anodyne	SLC9A1	20	40
COc1ccc(C(=O)N2CC[C@H](C(C)(C)C)C2)cc1S(C)(=O)=O	ZINC000450572059	EF	On-Demand	Anodyne	L3MBTL3	66	39
CC[C@H](C)N(Cc1nc(O)c2ccccc2n1)Cc1ccccc1OC1CC1	ZINC000450572082	GJ	On-Demand	Anodyne	TNKS	49	35
Cc1cccc([C@@H]2CCN(C(=O)C(C)(C)OC(C)C)C2)c1	ZINC000450572090	CH	On-Demand	Anodyne	HPGD	18	40
COc1ccc(C2(CNC(=O)CCCn3nc(C)nc3C)CCC2)cc1	ZINC000450572091	FF	On-Demand	Anodyne	ACAT	0	46
CC[C@@H](C)N(Cc1nc(O)c2ccccc2n1)Cc1ccccc1OC1CC1	ZINC000450572092	GJ	On-Demand	Anodyne	TNKS	49	35
CC(C)NC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450572094	EF	On-Demand	Bother	TAAR1	23	48
N#CC1(CN2CCN(c3ccc4ccccc4n3)CC2)CCC1	ZINC000450572095	DG	On-Demand	Mild	HTR3A	36	52
NS(=O)(=O)c1ccc2c(c1)N(CC1CC(F)(F)C1)CCC2	ZINC000450572096	DE	On-Demand	Anodyne	CA7	24	43
NS(=O)(=O)c1ccc2c(c1)N(CC1CC(F)(F)C1)CCC2	ZINC000450572096	DE	On-Demand	Anodyne	CA14	16	43
FC1(F)CC[C@@H](CN2CCC(c3c[nH]c4ncccc34)CC2)C1	ZINC000450572097	DI	On-Demand	Anodyne	CCR2	22	52
FC1(F)CC[C@H](CN2CCC(c3c[nH]c4ncccc34)CC2)C1	ZINC000450572099	DI	On-Demand	Anodyne	CCR2	22	52
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	CHRM2	17	44
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	DRD2	21	48
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	DRD4	41	42
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	ACHE	43	47
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	HRH1	15	41
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	DRD3	0	42
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	CHRM3	28	43
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	SIGMAR1	51	44
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	CCR3	38	45
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	CCR5	39	46
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	MCHR1	31	40
CC(=O)c1cccc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c1	ZINC000450572101	GI	On-Demand	Anodyne	CACNA1G	25	41
FC(F)(F)Cn1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)n1	ZINC000450572114	GG	On-Demand	Anodyne	HTR3A	35	48
COc1cccc(OCCC(=O)N[C@H](CO)CC(F)(F)F)c1	ZINC000450572123	DD	On-Demand	Anodyne	MTNR1A	36	40
COc1cccc(OCCC(=O)N[C@H](CO)CC(F)(F)F)c1	ZINC000450572123	DD	On-Demand	Anodyne	MTNR1B	34	45
COc1cccc(OCCC(=O)N[C@H](CO)CC(F)(F)F)c1	ZINC000450572123	DD	On-Demand	Anodyne	PDS	53	33
COc1cccc(OCCC(=O)N[C@@H](CO)CC(F)(F)F)c1	ZINC000450572124	DD	On-Demand	Anodyne	MTNR1A	36	40
COc1cccc(OCCC(=O)N[C@@H](CO)CC(F)(F)F)c1	ZINC000450572124	DD	On-Demand	Anodyne	MTNR1B	34	45
COc1cccc(OCCC(=O)N[C@@H](CO)CC(F)(F)F)c1	ZINC000450572124	DD	On-Demand	Anodyne	PDS	53	33
CC[C@]1(C)COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450572132	EH	On-Demand	Anodyne	RBP4	90	39
CC[C@@]1(C)COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450572134	EH	On-Demand	Anodyne	RBP4	90	39
CC(C)c1ncsc1C(=O)NCCCNc1cccc(F)c1	ZINC000450572136	DH	On-Demand	Anodyne	TBK1	16	44
Cn1ccnc(N[C@@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450572139	FE	On-Demand	Anodyne	PGC	41	32
Cn1ccnc(N[C@@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450572139	FE	On-Demand	Anodyne	CASP3	44	34
Cn1ccnc(N[C@@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450572139	FE	On-Demand	Anodyne	CASP8	40	34
Cn1ccnc(N[C@@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450572139	FE	On-Demand	Anodyne	FPR1	40	36
Cn1ccnc(N[C@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450572140	FE	On-Demand	Anodyne	PGC	41	32
Cn1ccnc(N[C@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450572140	FE	On-Demand	Anodyne	CASP3	44	34
Cn1ccnc(N[C@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450572140	FE	On-Demand	Anodyne	CASP8	40	34
Cn1ccnc(N[C@H](CCC(=O)OC(C)(C)C)Cc2ccccc2)c1=O	ZINC000450572140	FE	On-Demand	Anodyne	FPR1	40	36
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CCC2=CCCCC2)CC1	ZINC000450572145	EG	On-Demand	Bother	KCNJ1	32	43
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	HTR1A	112	59
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	DRD2	95	59
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	DRD1	31	41
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	DRD4	66	50
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	ADRA1D	72	43
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	HTR1D	27	41
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	HTR2A	32	41
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	ADRA1A	65	53
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	ADRA1B	43	53
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	DRD3	85	53
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	HTR7	61	41
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	SIGMAR1	15	41
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	ABCB1	52	45
CC(=O)c1cccc(CN2CCN(c3ccccc3OCCN(C)C)CC2)c1	ZINC000450572149	GG	On-Demand	Anodyne	AP2S1	0	42
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450572183	GE	On-Demand	Bother	DRD4	15	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450572183	GE	On-Demand	Bother	SSTR5	51	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450572184	GE	On-Demand	Bother	DRD4	15	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1	ZINC000450572184	GE	On-Demand	Bother	SSTR5	51	41
c1cnc2[nH]cc(C3CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)c2c1	ZINC000450572189	DG	On-Demand	Anodyne	CCR2	16	45
c1cnc2[nH]cc(C3CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)c2c1	ZINC000450572190	DG	On-Demand	Anodyne	CCR2	16	45
CCOC(=O)[C@H]1CN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])CC12COC2	ZINC000450572200	FC	On-Demand	Bother	TAAR1	16	40
CCOC(=O)[C@@H]1CN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])CC12COC2	ZINC000450572201	FC	On-Demand	Bother	TAAR1	16	40
CC[C@@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450572202	DE	On-Demand	Anodyne	MMP8	37	47
CC[C@@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450572202	DE	On-Demand	Anodyne	CAPN1	22	50
CC[C@@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450572202	DE	On-Demand	Anodyne	CAPN2	39	44
CC[C@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450572203	DE	On-Demand	Anodyne	MMP8	37	47
CC[C@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450572203	DE	On-Demand	Anodyne	CAPN1	22	50
CC[C@H](CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450572203	DE	On-Demand	Anodyne	CAPN2	39	44
CC(C)N1CCCC[C@H]1CN1CCC(Oc2ccccn2)CC1	ZINC000450572209	DG	On-Demand	Anodyne	SCN5A	40	33
CC(C)N1CCCC[C@@H]1CN1CCC(Oc2ccccn2)CC1	ZINC000450572210	DG	On-Demand	Anodyne	SCN5A	40	33
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450572217	GG	On-Demand	Anodyne	TACR1	23	40
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450572217	GG	On-Demand	Anodyne	CETP	0	41
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450572217	GG	On-Demand	Anodyne	PHES	0	41
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450572218	GG	On-Demand	Anodyne	TACR1	23	40
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450572218	GG	On-Demand	Anodyne	CETP	0	41
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450572218	GG	On-Demand	Anodyne	PHES	0	41
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450572219	GG	On-Demand	Anodyne	TACR1	23	40
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450572219	GG	On-Demand	Anodyne	CETP	0	41
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450572219	GG	On-Demand	Anodyne	PHES	0	41
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450572220	GG	On-Demand	Anodyne	TACR1	23	40
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450572220	GG	On-Demand	Anodyne	CETP	0	41
CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450572220	GG	On-Demand	Anodyne	PHES	0	41
COc1ccc(C2(CNC(=O)Cn3ccc(C)n3)CCC2)cc1	ZINC000450572240	DE	On-Demand	Anodyne	ACAT	0	47
CCCOc1ccc(C(=O)NCC[C@@H]2CCOC2)c(OC)c1	ZINC000450572241	DF	On-Demand	Anodyne	NQO2	29	41
CCCOc1ccc(C(=O)NCC[C@H]2CCOC2)c(OC)c1	ZINC000450572242	DF	On-Demand	Anodyne	NQO2	29	41
c1ccc(OC2CC2)c(CN2CCN3CCCC[C@H]3C2)c1	ZINC000450572255	CF	On-Demand	Anodyne	SIGMAR1	15	40
c1ccc(OC2CC2)c(CN2CCN3CCCC[C@@H]3C2)c1	ZINC000450572256	CF	On-Demand	Anodyne	SIGMAR1	15	40
CN(C)CCOc1ccccc1N1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450572277	GF	On-Demand	Anodyne	HTR1A	54	36
CN(C)CCOc1ccccc1N1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450572277	GF	On-Demand	Anodyne	DRD2	37	42
CN(C)CCOc1ccccc1N1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450572277	GF	On-Demand	Anodyne	DRD1	0	41
CN(C)CCOc1ccccc1N1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450572277	GF	On-Demand	Anodyne	DRD4	21	42
CN(C)CCOc1ccccc1N1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450572277	GF	On-Demand	Anodyne	DRD3	29	42
CC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450572280	EH	On-Demand	Anodyne	HTR1A	32	53
CC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450572280	EH	On-Demand	Anodyne	DRD2	26	60
CC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450572280	EH	On-Demand	Anodyne	DRD4	64	41
CC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450572280	EH	On-Demand	Anodyne	DRD3	24	43
CC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450572280	EH	On-Demand	Anodyne	HTR3A	49	60
CC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450572280	EH	On-Demand	Anodyne	SORD	32	48
CC(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450572280	EH	On-Demand	Anodyne	MGLL	0	40
O=C1CCC(CN2CCC(Oc3ccccn3)CC2)CC1	ZINC000450572291	CF	On-Demand	Anodyne	HRH1	21	41
O=C1CCC(CN2CCC(Oc3ccccn3)CC2)CC1	ZINC000450572291	CF	On-Demand	Anodyne	CCR3	16	41
O=C(NCC[C@@H]1CCOC1)c1cncc(Cl)c1	ZINC000450572294	CD	In-Stock	Anodyne	CACNA1I	43	35
CCS(=O)(=O)c1ccc(CN2CCCN(C)c3ccc(F)cc32)cc1	ZINC000450572295	FG	On-Demand	Anodyne	CASP3	0	41
CCS(=O)(=O)c1ccc(CN2CCCN(C)c3ccc(F)cc32)cc1	ZINC000450572295	FG	On-Demand	Anodyne	CASP7	33	41
O=C(NCC[C@H]1CCOC1)c1cncc(Cl)c1	ZINC000450572298	CD	In-Stock	Anodyne	CACNA1I	43	35
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@@H]3CCCCC3(F)F)C2)nc1	ZINC000450572302	FH	On-Demand	Anodyne	SLC6A1	60	33
Cc1ccc(NC(=O)[C@H]2CCCN(C[C@@H]3CCCCC3(F)F)C2)nc1	ZINC000450572303	FH	On-Demand	Anodyne	SLC6A1	60	33
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@H]3CCCCC3(F)F)C2)nc1	ZINC000450572304	FH	On-Demand	Anodyne	SLC6A1	60	33
Cc1ccc(NC(=O)[C@H]2CCCN(C[C@H]3CCCCC3(F)F)C2)nc1	ZINC000450572305	FH	On-Demand	Anodyne	SLC6A1	60	33
Cc1cccc([C@H]2CCN(C(=O)c3cn(CCc4ccccc4)nn3)C2)c1	ZINC000450572306	FG	On-Demand	Anodyne	THYX_PBCV1	0	44
Cc1cccc([C@@H]2CCN(C(=O)c3cn(CCc4ccccc4)nn3)C2)c1	ZINC000450572309	FG	On-Demand	Anodyne	THYX_PBCV1	0	44
CO[C@@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450572310	CD	On-Demand	Anodyne	MME	58	38
CO[C@@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450572310	CD	On-Demand	Anodyne	TIMP3	60	36
CO[C@@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450572310	CD	On-Demand	Anodyne	NPR	47	33
CO[C@@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450572310	CD	On-Demand	Anodyne	AMP1_PLAFQ	55	36
CO[C@@H](Cc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450572311	CD	On-Demand	Anodyne	MME	58	38
CO[C@@H](Cc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450572311	CD	On-Demand	Anodyne	TIMP3	60	36
CO[C@@H](Cc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450572311	CD	On-Demand	Anodyne	NPR	47	33
CO[C@@H](Cc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450572311	CD	On-Demand	Anodyne	AMP1_PLAFQ	55	36
CO[C@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450572312	CD	On-Demand	Anodyne	MME	58	38
CO[C@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450572312	CD	On-Demand	Anodyne	TIMP3	60	36
CO[C@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450572312	CD	On-Demand	Anodyne	NPR	47	33
CO[C@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCOC1	ZINC000450572312	CD	On-Demand	Anodyne	AMP1_PLAFQ	55	36
CO[C@H](Cc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450572313	CD	On-Demand	Anodyne	MME	58	38
CO[C@H](Cc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450572313	CD	On-Demand	Anodyne	TIMP3	60	36
CO[C@H](Cc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450572313	CD	On-Demand	Anodyne	NPR	47	33
CO[C@H](Cc1ccccc1)C(=O)NCC[C@H]1CCOC1	ZINC000450572313	CD	On-Demand	Anodyne	AMP1_PLAFQ	55	36
COC(=O)c1csc(CN2CCN(C(=O)c3ccccc3O)CC2)n1	ZINC000450572320	FD	On-Demand	Anodyne	TRPC6	47	35
COc1cccc(OCCC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	ZINC000450572327	GF	On-Demand	Anodyne	MTNR1A	22	45
COc1cccc(OCCC(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	ZINC000450572327	GF	On-Demand	Anodyne	MTNR1B	25	45
COc1cccc(OCCC(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	ZINC000450572328	GF	On-Demand	Anodyne	MTNR1A	22	45
COc1cccc(OCCC(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c1	ZINC000450572328	GF	On-Demand	Anodyne	MTNR1B	25	45
CCc1cccc(C(=O)N2CC[C@H](c3cc(C)cc(C)c3)C2)n1	ZINC000450572348	DH	On-Demand	Anodyne	HSD11B1	0	44
CCOC(=O)[C@H]1CN(c2ccc(S(=O)(=O)NC)cc2F)CC12COC2	ZINC000450572365	FC	On-Demand	Anodyne	LEF	49	31
Cc1ccn(CC(=O)N2CCCCc3cc(Br)ccc32)n1	ZINC000450572366	EG	On-Demand	Anodyne	AVPR2	16	41
CCc1cccc(C(=O)N2CC[C@@H](c3cc(C)cc(C)c3)C2)n1	ZINC000450572368	DH	On-Demand	Anodyne	HSD11B1	0	44
CCc1cccc(C(=O)N2CC[C@@H](c3cc(C)cc(C)c3)C2)n1	ZINC000450572368	DH	On-Demand	Anodyne	PDE7A	15	43
CCOC(=O)[C@@H]1CN(c2ccc(S(=O)(=O)NC)cc2F)CC12COC2	ZINC000450572375	FC	On-Demand	Anodyne	LEF	49	31
COc1ccc(C(=O)N2CC[C@H](c3cc(C)cc(C)c3)C2)cc1S(C)(=O)=O	ZINC000450572379	GG	On-Demand	Anodyne	SLC9A1	25	42
COc1ccc(C(=O)N2CC[C@H](c3cc(C)cc(C)c3)C2)cc1S(C)(=O)=O	ZINC000450572379	GG	On-Demand	Anodyne	L3MBTL3	79	39
COc1ccc(C(=O)N2CC[C@@H](c3cc(C)cc(C)c3)C2)cc1S(C)(=O)=O	ZINC000450572381	GG	On-Demand	Anodyne	SLC9A1	25	42
COc1ccc(C(=O)N2CC[C@@H](c3cc(C)cc(C)c3)C2)cc1S(C)(=O)=O	ZINC000450572381	GG	On-Demand	Anodyne	L3MBTL3	79	39
COC(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1Cl	ZINC000450572398	GF	On-Demand	Anodyne	C3SWJ7_ECOLX	0	42
CCS(=O)(=O)c1ccc(CN2CC=C(c3c(C)[nH]c4ccccc34)CC2)cc1	ZINC000450572399	GJ	On-Demand	Anodyne	PTGS2	52	38
O=C1CCCCN1CC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450572413	EG	On-Demand	Anodyne	CCR3	17	40
CCC[C@H](O)CN(C)CC(=O)NCc1ccccc1	ZINC000450572414	CD	On-Demand	Anodyne	UL54	42	33
CCC[C@H](O)CN(C)CC(=O)NCc1ccccc1	ZINC000450572414	CD	On-Demand	Anodyne	PDS	42	34
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	HTR1A	15	40
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	DRD2	22	42
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	DRD4	46	39
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	ACHE	31	44
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	HRH1	23	49
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	DRD3	18	42
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	CHRM3	21	41
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	PRSS2	47	33
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	HRH3	17	40
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	SSTR5	59	36
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	CCR3	48	36
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	FAAH	23	42
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	SCN5A	68	38
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	MCHR1	32	41
CC(=O)c1cccc(CN2CCC(Oc3ccccn3)CC2)c1	ZINC000450572415	DG	On-Demand	Anodyne	ABHD6	0	42
CCC[C@@H](O)CN(C)CC(=O)NCc1ccccc1	ZINC000450572416	CD	On-Demand	Anodyne	UL54	42	33
CCC[C@@H](O)CN(C)CC(=O)NCc1ccccc1	ZINC000450572416	CD	On-Demand	Anodyne	PDS	42	34
COC(=O)c1coc(CN2CCN(c3ccc4ccccc4n3)CC2)n1	ZINC000450572423	FE	On-Demand	Anodyne	HTR1A	21	49
COC(=O)c1coc(CN2CCN(c3ccc4ccccc4n3)CC2)n1	ZINC000450572423	FE	On-Demand	Anodyne	DRD3	21	47
COC(=O)c1coc(CN2CCN(c3ccc4ccccc4n3)CC2)n1	ZINC000450572423	FE	On-Demand	Anodyne	HTR3A	41	53
COc1cccc(-n2cc(C(=O)N3CC[C@H](c4cc(C)cc(C)c4)C3)nn2)c1	ZINC000450572433	GH	On-Demand	Anodyne	CCKAR	26	41
CC(=O)c1cccc(CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)c1	ZINC000450572435	GG	On-Demand	Anodyne	TRY2_BOVIN	41	34
CC(=O)c1cccc(CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)c1	ZINC000450572435	GG	On-Demand	Anodyne	CASP7	0	40
CC(=O)c1cccc(CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)c1	ZINC000450572435	GG	On-Demand	Anodyne	AKR1C3	69	41
CC(=O)c1cccc(CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)c1	ZINC000450572435	GG	On-Demand	Anodyne	AKR1C1	22	41
COc1cccc(-n2cc(C(=O)N3CC[C@@H](c4cc(C)cc(C)c4)C3)nn2)c1	ZINC000450572445	GH	On-Demand	Anodyne	CCKAR	26	41
CC(=O)N[C@H](C(=O)NCCCNc1cccc(F)c1)C(C)(C)C	ZINC000450572447	DE	On-Demand	Anodyne	MMP3	18	41
CCC(=O)CCCN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000450572448	GH	On-Demand	Anodyne	DRD1	0	46
CCC(=O)CCCN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000450572448	GH	On-Demand	Anodyne	DRD4	18	46
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	HTR1A	33	68
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	CHRM1	17	47
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	DRD2	42	49
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	DRD1	17	47
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	DRD4	50	47
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	ACHE	16	43
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	ADRA1D	24	47
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	HTR2A	41	48
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	HTR2C	33	50
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	SLC6A1	52	33
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	ADRA1A	20	42
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	HRH1	19	42
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	ADRA1B	21	47
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	DRD3	34	47
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	ITGAL	42	37
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	HTR7	61	44
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	PTPN2	44	35
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	SIGMAR1	37	46
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	CCKAR	23	41
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	CCR3	40	39
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	CCKBR	32	41
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	EPHX2	20	44
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	MCHR1	38	60
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	CYP2J2	68	53
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	KCNK3	53	38
Cc1cccc(NC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450572449	EJ	On-Demand	Anodyne	KCNK9	42	38
CCNS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccccc1)CC2	ZINC000450572487	FG	On-Demand	Anodyne	CYP2J2	48	34
CCOC(=O)[C@@H]1CN(c2c(C)cnc3c(OC)cccc23)CC12COC2	ZINC000450572488	FF	On-Demand	Anodyne	ATP4A	18	42
CNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(Cl)c(OC)c1)CC2	ZINC000450572489	FF	On-Demand	Anodyne	HTR6	0	41
CCOC(=O)[C@H]1CN(c2c(C)cnc3c(OC)cccc23)CC12COC2	ZINC000450572491	FF	On-Demand	Anodyne	ATP4A	18	42
CNC(=O)c1cccnc1N1C[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1	ZINC000450572495	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	33
FC(F)(F)Cn1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)n1	ZINC000450572514	FH	On-Demand	Anodyne	CCR2	0	43
COc1ccc(C2(CNC(=O)Cc3cn(C)nc3C)CCC2)cc1	ZINC000450572533	EF	On-Demand	Anodyne	ACAT	0	48
CCn1nnc(C)c1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572534	FG	On-Demand	Anodyne	CACNA1B	41	35
CCn1nnc(C)c1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572534	FG	On-Demand	Anodyne	CCR5	41	35
CCn1nnc(C)c1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572534	FG	On-Demand	Anodyne	CCR2	42	38
CCn1nnc(C)c1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572538	FG	On-Demand	Anodyne	CACNA1B	41	35
CCn1nnc(C)c1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572538	FG	On-Demand	Anodyne	CCR5	41	35
CCn1nnc(C)c1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572538	FG	On-Demand	Anodyne	CCR2	42	38
Cc1c(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)nn2c1OCCC2	ZINC000450572547	GH	On-Demand	Anodyne	CACNA1B	47	39
Cc1c(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)nn2c1OCCC2	ZINC000450572547	GH	On-Demand	Anodyne	CCR2	26	41
Cc1c(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)nn2c1OCCC2	ZINC000450572548	GH	On-Demand	Anodyne	CACNA1B	47	39
Cc1c(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)nn2c1OCCC2	ZINC000450572548	GH	On-Demand	Anodyne	CCR2	26	41
NS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccc(F)cc1)CCC2	ZINC000450572553	GF	On-Demand	Anodyne	DRD4	0	43
NS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccc(F)cc1)CCC2	ZINC000450572553	GF	On-Demand	Anodyne	ERG2	19	40
NS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccc(F)cc1)CCC2	ZINC000450572553	GF	On-Demand	Anodyne	SLC18A3	0	43
NS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccc(F)cc1)CCC2	ZINC000450572553	GF	On-Demand	Anodyne	HTR3B	0	42
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572556	EH	On-Demand	Mild	CACNA1B	53	41
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572556	EH	On-Demand	Mild	CCR2	34	41
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572556	EH	On-Demand	Mild	RBP4	21	40
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572558	EH	On-Demand	Mild	CACNA1B	53	41
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572558	EH	On-Demand	Mild	CCR2	34	41
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572558	EH	On-Demand	Mild	RBP4	21	40
COC(=O)c1coc(CN2CCCc3ccc(S(N)(=O)=O)cc32)n1	ZINC000450572564	FD	On-Demand	Anodyne	TYMS	0	40
COC(=O)c1coc(CN2CCCc3ccc(S(N)(=O)=O)cc32)n1	ZINC000450572564	FD	On-Demand	Anodyne	C3SWJ7_ECOLX	0	40
NS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccccc1)CCC2	ZINC000450572589	FF	On-Demand	Anodyne	AKR1C3	45	33
NS(=O)(=O)c1ccc2c(c1)N(CCCC(=O)c1ccccc1)CCC2	ZINC000450572589	FF	On-Demand	Anodyne	CYP2J2	48	34
Cn1c(C#N)ccc1C(=O)N1CCCCc2cc(Br)ccc21	ZINC000450572590	FH	On-Demand	Mild	AVPR2	27	41
COc1ccc(-c2nnc(SC[C@H]3CCCC3(F)F)o2)cc1	ZINC000450572595	EI	On-Demand	Anodyne	GSK3B	17	49
COc1ccc(-c2nnc(SC[C@H]3CCCC3(F)F)o2)cc1	ZINC000450572595	EI	On-Demand	Anodyne	GSK3A	36	45
COc1ccc(-c2nnc(SC[C@@H]3CCCC3(F)F)o2)cc1	ZINC000450572597	EI	On-Demand	Anodyne	GSK3B	17	49
COc1ccc(-c2nnc(SC[C@@H]3CCCC3(F)F)o2)cc1	ZINC000450572597	EI	On-Demand	Anodyne	GSK3A	36	45
COc1ccc(C2(CNC(=O)c3cccc(C#N)c3Br)CCC2)cc1	ZINC000450572605	GI	On-Demand	Mild	KCNA3	54	44
COc1ccc(C2(CNC(=O)c3cccc(C#N)c3Br)CCC2)cc1	ZINC000450572605	GI	On-Demand	Mild	ACAT	0	48
Cc1cncc(-c2nc(CN3CCN(c4ncccc4Cl)CC3)no2)c1	ZINC000450572607	FF	On-Demand	Anodyne	ACOX1	32	40
COc1ccc(CNC(=O)CCN2CCc3ccc(O)cc3C2)c(OC)c1	ZINC000450572608	FE	On-Demand	Anodyne	DRD4	43	33
COc1ccc(CNC(=O)CCN2CCc3ccc(O)cc3C2)c(OC)c1	ZINC000450572608	FE	On-Demand	Anodyne	DRD3	19	42
COc1ccc(CNC(=O)CCN2CCc3ccc(O)cc3C2)c(OC)c1	ZINC000450572608	FE	On-Demand	Anodyne	HTR7	36	41
COc1ccc(CNC(=O)CCN2CCc3ccc(O)cc3C2)c(OC)c1	ZINC000450572608	FE	On-Demand	Anodyne	ABCB1B	66	38
COc1ccc(CNC(=O)CCN2CCc3ccc(O)cc3C2)c(OC)c1	ZINC000450572608	FE	On-Demand	Anodyne	MTNR1A	52	40
COc1ccc(CNC(=O)CCN2CCc3ccc(O)cc3C2)c(OC)c1	ZINC000450572608	FE	On-Demand	Anodyne	MTNR1B	50	40
COc1ccc(CNC(=O)CCN2CCc3ccc(O)cc3C2)c(OC)c1	ZINC000450572608	FE	On-Demand	Anodyne	ABCB1	27	42
CC(=O)CCCCCSc1nnc(-c2cccs2)n1Cc1ccccc1	ZINC000450572619	GK	On-Demand	Anodyne	AGTR1	15	41
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)nc1	ZINC000450572622	FH	On-Demand	Anodyne	HTR2A	15	41
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)nc1	ZINC000450572622	FH	On-Demand	Anodyne	HTR2C	20	42
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)nc1	ZINC000450572622	FH	On-Demand	Anodyne	SLC6A1	141	43
Cc1ccc(NC(=O)[C@H]2CCCN(CCCC(=O)c3ccccc3)C2)nc1	ZINC000450572622	FH	On-Demand	Anodyne	CYP2J2	56	45
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)nc1	ZINC000450572623	FH	On-Demand	Anodyne	HTR2A	15	41
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)nc1	ZINC000450572623	FH	On-Demand	Anodyne	HTR2C	20	42
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)nc1	ZINC000450572623	FH	On-Demand	Anodyne	SLC6A1	141	43
Cc1ccc(NC(=O)[C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)nc1	ZINC000450572623	FH	On-Demand	Anodyne	CYP2J2	56	45
O=C(CCCC(=O)N1CCC[C@@H]1c1ccc(Br)s1)C1CC1	ZINC000450572638	FI	On-Demand	Anodyne	COLA	51	45
O=C(CCCC(=O)N1CCC[C@@H]1c1ccc(Br)s1)C1CC1	ZINC000450572638	FI	On-Demand	Anodyne	CPT1A	48	45
O=C(CCCC(=O)N1CCC[C@@H]1c1ccc(Br)s1)C1CC1	ZINC000450572638	FI	On-Demand	Anodyne	PREP	40	38
O=C(CCCC(=O)N1CCC[C@H]1c1ccc(Br)s1)C1CC1	ZINC000450572639	FI	On-Demand	Anodyne	COLA	51	45
O=C(CCCC(=O)N1CCC[C@H]1c1ccc(Br)s1)C1CC1	ZINC000450572639	FI	On-Demand	Anodyne	CPT1A	48	45
O=C(CCCC(=O)N1CCC[C@H]1c1ccc(Br)s1)C1CC1	ZINC000450572639	FI	On-Demand	Anodyne	PREP	40	38
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1	ZINC000450572640	EI	On-Demand	Anodyne	ADAM10	23	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1	ZINC000450572640	EI	On-Demand	Anodyne	NPBWR1	64	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](c3cccc(C)c3)C2)c1	ZINC000450572646	EI	On-Demand	Anodyne	ADAM10	23	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](c3cccc(C)c3)C2)c1	ZINC000450572646	EI	On-Demand	Anodyne	NPBWR1	64	33
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	DRD1	23	42
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	DRD3	24	47
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	DRD5	42	41
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	HTR7	36	42
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	HTR5A	30	54
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	CHRNA6	0	49
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	ABCB1B	43	37
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	SLC6A5	30	46
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	AKR1C3	45	42
O=C(CCCN1CCc2ccc(O)cc2C1)c1ccccc1	ZINC000450572649	CG	On-Demand	Anodyne	CYP2J2	56	40
O=C(NCCCNc1ccccc1F)c1cccc(C(F)(F)F)n1	ZINC000450572654	EG	On-Demand	Anodyne	TRPV1	50	32
CCOC(=O)[C@H]1CN(c2ccc(C#N)c(Cl)c2)CC12COC2	ZINC000450572655	DE	On-Demand	Mild	AR	25	42
CCOC(=O)[C@@H]1CN(c2ccc(C#N)c(Cl)c2)CC12COC2	ZINC000450572659	DE	On-Demand	Mild	AR	25	42
C[C@H](C1CCC1)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572668	DG	On-Demand	Anodyne	EPHX2	15	53
C[C@H](C1CCC1)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572668	DG	On-Demand	Anodyne	MCHR1	15	40
C[C@H](C1CCC1)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572668	DG	On-Demand	Anodyne	PSBA	0	44
C[C@@H](C1CCC1)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572669	DG	On-Demand	Anodyne	EPHX2	15	53
C[C@@H](C1CCC1)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572669	DG	On-Demand	Anodyne	MCHR1	15	40
C[C@@H](C1CCC1)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572669	DG	On-Demand	Anodyne	PSBA	0	44
O=C1CCCc2occ(C(=O)N3CC[C@@H](c4cccc(C(F)(F)F)c4)C3)c21	ZINC000450572674	GI	On-Demand	Anodyne	CACNA1B	50	38
CCNS(=O)(=O)[C@@H]1CCN(C(=O)c2c(C)cccc2Cl)C1	ZINC000450572675	ED	On-Demand	Anodyne	CCR5	32	40
O=C1CCCc2occ(C(=O)N3CC[C@H](c4cccc(C(F)(F)F)c4)C3)c21	ZINC000450572677	GI	On-Demand	Anodyne	CACNA1B	50	38
COc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)ncnc2c1F	ZINC000450572678	DG	On-Demand	Anodyne	PDE3A	44	35
COc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)ncnc2c1F	ZINC000450572678	DG	On-Demand	Anodyne	PDE3B	65	35
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	DRD2	29	42
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	DRD1	20	49
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	HTR2A	25	49
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	HTR2C	23	52
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	SLC6A1	78	36
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	HTR2B	19	41
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCC[C@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572679	DG	On-Demand	Anodyne	CYP2J2	50	35
CCOC(=O)[C@H]1CN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC12COC2	ZINC000450572680	GD	On-Demand	Anodyne	ADRA1D	19	47
CCOC(=O)[C@H]1CN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC12COC2	ZINC000450572680	GD	On-Demand	Anodyne	ADRA1A	15	47
CCOC(=O)[C@H]1CN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC12COC2	ZINC000450572680	GD	On-Demand	Anodyne	ADRA1B	46	47
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	DRD2	29	42
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	DRD1	20	49
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	HTR2A	25	49
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	HTR2C	23	52
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	SLC6A1	78	36
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	HTR2B	19	41
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(F)cc1	ZINC000450572681	DG	On-Demand	Anodyne	CYP2J2	50	35
CCNS(=O)(=O)[C@H]1CCN(C(=O)c2c(C)cccc2Cl)C1	ZINC000450572683	ED	On-Demand	Anodyne	CCR5	32	40
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)cc1	ZINC000450572689	FG	On-Demand	Anodyne	SLC6A1	86	34
CC(=O)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)cc1	ZINC000450572689	FG	On-Demand	Anodyne	GPBAR1	0	40
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)cc1	ZINC000450572691	FG	On-Demand	Anodyne	SLC6A1	86	34
CC(=O)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)cc1	ZINC000450572691	FG	On-Demand	Anodyne	GPBAR1	0	40
CCOC(=O)[C@@H]1CN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC12COC2	ZINC000450572698	GD	On-Demand	Anodyne	ADRA1D	19	47
CCOC(=O)[C@@H]1CN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC12COC2	ZINC000450572698	GD	On-Demand	Anodyne	ADRA1A	15	47
CCOC(=O)[C@@H]1CN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC12COC2	ZINC000450572698	GD	On-Demand	Anodyne	ADRA1B	46	47
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450572701	EG	On-Demand	Anodyne	CXCR3	18	41
CCn1c(SCc2nc(C(=O)OC)co2)nnc1-c1cccs1	ZINC000450572704	FG	On-Demand	Anodyne	SLC27A1	46	40
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450572710	EG	On-Demand	Anodyne	CXCR3	18	41
CC(C)c1ncsc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572711	FJ	On-Demand	Anodyne	CACNA1B	48	36
CC(C)c1ncsc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572711	FJ	On-Demand	Anodyne	SLC9A1	40	35
CC(C)c1ncsc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572711	FJ	On-Demand	Anodyne	CCR2	56	43
CC(C)c1ncsc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572711	FJ	On-Demand	Anodyne	RBP4	20	40
CC(C)c1ncsc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572714	FJ	On-Demand	Anodyne	CACNA1B	48	36
CC(C)c1ncsc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572714	FJ	On-Demand	Anodyne	SLC9A1	40	35
CC(C)c1ncsc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572714	FJ	On-Demand	Anodyne	CCR2	56	43
CC(C)c1ncsc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572714	FJ	On-Demand	Anodyne	RBP4	20	40
C[C@@H](CN1CCc2ccc(O)cc2C1)S(C)(=O)=O	ZINC000450572716	CD	On-Demand	Anodyne	DRD5	37	40
C[C@H](CN1CCc2ccc(O)cc2C1)S(C)(=O)=O	ZINC000450572720	CD	On-Demand	Anodyne	DRD5	37	40
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450572722	EI	On-Demand	Anodyne	SLC9A1	47	39
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450572722	EI	On-Demand	Anodyne	SFRP1	44	41
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450572722	EI	On-Demand	Anodyne	L3MBTL3	54	38
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450572722	EI	On-Demand	Anodyne	HPGD	27	40
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450572727	EI	On-Demand	Anodyne	SLC9A1	47	39
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450572727	EI	On-Demand	Anodyne	SFRP1	44	41
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450572727	EI	On-Demand	Anodyne	L3MBTL3	54	38
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450572727	EI	On-Demand	Anodyne	HPGD	27	40
C[C@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572741	GG	On-Demand	Anodyne	CCR3	29	40
C[C@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572741	GG	On-Demand	Anodyne	MAPK1	31	41
C[C@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572741	GG	On-Demand	Anodyne	EPHX2	39	56
C[C@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572741	GG	On-Demand	Anodyne	TYK2	51	41
C[C@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572741	GG	On-Demand	Anodyne	MCHR1	28	41
O=C(c1ccccc1O)N1CCN(CC2=CCCCC2)CC1	ZINC000450572752	DF	On-Demand	Anodyne	FABP4	45	35
C[C@@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572768	GG	On-Demand	Anodyne	CCR3	29	40
C[C@@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572768	GG	On-Demand	Anodyne	MAPK1	31	41
C[C@@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572768	GG	On-Demand	Anodyne	EPHX2	39	56
C[C@@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572768	GG	On-Demand	Anodyne	TYK2	51	41
C[C@@H](CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450572768	GG	On-Demand	Anodyne	MCHR1	28	41
O=C(NCCCNc1ccccc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450572777	GG	On-Demand	Anodyne	DRD2	17	42
O=C(NCCCNc1ccccc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450572777	GG	On-Demand	Anodyne	DRD4	42	32
O=C(NCCCNc1ccccc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450572777	GG	On-Demand	Anodyne	DRD3	36	42
O=C(NCCCNc1ccccc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450572777	GG	On-Demand	Anodyne	PIK3CB	22	43
O=C(NCCCNc1ccccc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450572777	GG	On-Demand	Anodyne	DGAT1	19	44
O=C1CCC(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)CC1	ZINC000450572796	FH	On-Demand	Anodyne	SIGMAR1	35	40
O=C1CCC(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)CC1	ZINC000450572796	FH	On-Demand	Anodyne	CCR5	37	44
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572798	GG	On-Demand	Anodyne	F7	31	44
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572799	GG	On-Demand	Anodyne	F7	31	44
CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572800	GG	On-Demand	Anodyne	F7	31	44
CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450572801	GG	On-Demand	Anodyne	F7	31	44
Cc1ccc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3)c2c1	ZINC000450572804	CG	On-Demand	Anodyne	PDE3B	65	34
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC[C@H]3CCOC3)cc2)c1	ZINC000450572836	FG	On-Demand	Anodyne	LDLR	0	40
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)C(F)F	ZINC000450572837	BG	On-Demand	Bother	PGR	22	42
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)C(F)F	ZINC000450572837	BG	On-Demand	Bother	AR	0	42
CC[C@H](Nc1ccc([N+](=O)[O-])cc1)C(F)F	ZINC000450572838	BG	On-Demand	Bother	PGR	22	42
CC[C@H](Nc1ccc([N+](=O)[O-])cc1)C(F)F	ZINC000450572838	BG	On-Demand	Bother	AR	0	42
CCOC(=O)COc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1	ZINC000450572840	GG	On-Demand	Anodyne	P4HTM	0	55
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC[C@@H]3CCOC3)cc2)c1	ZINC000450572841	FG	On-Demand	Anodyne	LDLR	0	40
CCc1cc(CCCN2CCN(c3ccc4ccccc4n3)CC2)on1	ZINC000450572850	FH	On-Demand	Anodyne	HTR1A	26	48
CCc1cc(CCCN2CCN(c3ccc4ccccc4n3)CC2)on1	ZINC000450572850	FH	On-Demand	Anodyne	DRD2	17	46
CCc1cc(CCCN2CCN(c3ccc4ccccc4n3)CC2)on1	ZINC000450572850	FH	On-Demand	Anodyne	DRD4	16	42
CCc1cc(CCCN2CCN(c3ccc4ccccc4n3)CC2)on1	ZINC000450572850	FH	On-Demand	Anodyne	HTR2A	15	44
CCc1cc(CCCN2CCN(c3ccc4ccccc4n3)CC2)on1	ZINC000450572850	FH	On-Demand	Anodyne	DRD3	30	44
CCc1cc(CCCN2CCN(c3ccc4ccccc4n3)CC2)on1	ZINC000450572850	FH	On-Demand	Anodyne	HTR3A	46	48
CCc1cc(CCCN2CCN(c3ccc4ccccc4n3)CC2)on1	ZINC000450572850	FH	On-Demand	Anodyne	HTR7	22	44
C[C@H](O)CCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O	ZINC000450572851	EF	On-Demand	Anodyne	BACE1	0	48
C[C@@H](O)CCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O	ZINC000450572852	EF	On-Demand	Anodyne	BACE1	0	48
Cc1cnc(CCCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)o1	ZINC000450572863	FI	On-Demand	Anodyne	CCR2	75	41
Cc1cnc(CCCC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)o1	ZINC000450572863	FI	On-Demand	Anodyne	ETHR	58	35
Cc1cnc(CCCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)o1	ZINC000450572872	FI	On-Demand	Anodyne	CCR2	75	41
Cc1cnc(CCCC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)o1	ZINC000450572872	FI	On-Demand	Anodyne	ETHR	58	35
O=C(c1cnc(C2CC2)nc1)N1CCCCc2cc(Br)ccc21	ZINC000450572888	FI	On-Demand	Anodyne	AVPR2	42	44
Cc1cccc(C2=CCN(C(=O)[C@@H](O)C3CCC3)CC2)c1	ZINC000450572890	CF	On-Demand	Anodyne	ADAM10	28	46
Cc1cccc(C2=CCN(C(=O)[C@H](O)C3CCC3)CC2)c1	ZINC000450572891	CF	On-Demand	Anodyne	ADAM10	28	46
CN(C)S(=O)(=O)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000450572892	GD	On-Demand	Bother	BDKRB1	0	49
CN(C)S(=O)(=O)c1ccc(NC[C@@H](O)Cc2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000450572892	GD	On-Demand	Bother	COLA	58	35
Cc1cccc2c1C[C@H](C(=O)NCCCNc1cccc(F)c1)O2	ZINC000450572893	EG	On-Demand	Anodyne	TBK1	20	41
Cc1cccc2c1C[C@@H](C(=O)NCCCNc1cccc(F)c1)O2	ZINC000450572894	EG	On-Demand	Anodyne	TBK1	20	41
CCn1c(SCc2nc(-c3ccc(OC)nn3)no2)nnc1-c1ccco1	ZINC000450572895	GF	On-Demand	Anodyne	WNT3A	21	41
CCn1c(SCc2nc(-c3ccc(OC)nn3)no2)nnc1-c1ccco1	ZINC000450572895	GF	On-Demand	Anodyne	TNKS2	17	42
CCn1c(SCc2nc(-c3ccc(OC)nn3)no2)nnc1-c1ccco1	ZINC000450572895	GF	On-Demand	Anodyne	AXIN2	0	44
CN(C)S(=O)(=O)c1ccc(NC[C@H](O)Cc2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000450572896	GD	On-Demand	Bother	BDKRB1	0	49
CN(C)S(=O)(=O)c1ccc(NC[C@H](O)Cc2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000450572896	GD	On-Demand	Bother	COLA	58	35
C[C@@H]1CCC[C@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572897	DH	On-Demand	Anodyne	GRIN2B	57	42
C[C@@H]1CCC[C@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572897	DH	On-Demand	Anodyne	CHRNA7	48	38
C[C@@H]1CCC[C@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572897	DH	On-Demand	Anodyne	C3AR1	50	43
C[C@@H]1CCC[C@@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572899	DH	On-Demand	Anodyne	GRIN2B	57	42
C[C@@H]1CCC[C@@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572899	DH	On-Demand	Anodyne	CHRNA7	48	38
C[C@@H]1CCC[C@@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572899	DH	On-Demand	Anodyne	C3AR1	50	43
C[C@H]1CCC[C@@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572900	DH	On-Demand	Anodyne	GRIN2B	44	42
C[C@H]1CCC[C@@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572900	DH	On-Demand	Anodyne	C3AR1	50	43
C[C@H]1CCC[C@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572901	DH	On-Demand	Anodyne	GRIN2B	57	42
C[C@H]1CCC[C@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572901	DH	On-Demand	Anodyne	CHRNA7	48	38
C[C@H]1CCC[C@]1(C)C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000450572901	DH	On-Demand	Anodyne	C3AR1	50	43
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	HTR1A	34	43
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	DRD2	26	41
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	PDE3A	29	41
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	PDGFRB	47	39
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	HTR7	40	43
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	SIGMAR1	16	42
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	CCR3	20	42
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	MTNR1A	46	35
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	MTNR1B	40	36
COc1ccc(CNC(=O)CCN2CCC(Oc3ccccn3)CC2)c(OC)c1	ZINC000450572921	GF	On-Demand	Anodyne	PDE3B	53	41
C[C@H](O)CCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450572930	CE	On-Demand	Anodyne	HTR1A	30	56
C[C@H](O)CCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450572930	CE	On-Demand	Anodyne	HTR3A	50	60
C[C@H](O)CCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450572930	CE	On-Demand	Anodyne	HTR7	33	44
C[C@H](O)CCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450572930	CE	On-Demand	Anodyne	SORD	63	35
C[C@@H](O)CCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450572932	CE	On-Demand	Anodyne	HTR1A	30	56
C[C@@H](O)CCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450572932	CE	On-Demand	Anodyne	HTR3A	50	60
C[C@@H](O)CCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450572932	CE	On-Demand	Anodyne	HTR7	33	44
C[C@@H](O)CCN1CCN(c2ccc3ccccc3n2)CC1	ZINC000450572932	CE	On-Demand	Anodyne	SORD	63	35
Cn1cc(-c2ccc(C(=O)N3CC[C@H](c4cccc(C(F)(F)F)c4)C3)o2)cn1	ZINC000450572933	GI	On-Demand	Anodyne	CCR2	37	40
CCN(CC(=O)Nc1c(C)cccc1C)Cc1ccccc1OC1CC1	ZINC000450572934	FI	On-Demand	Anodyne	ACAT	0	41
C[C@H](c1ccccc1)[C@@H](O)CN(C)CC(=O)NCc1ccccc1	ZINC000450572936	EE	On-Demand	Anodyne	UL54	58	36
Cn1cc(-c2ccc(C(=O)N3CC[C@@H](c4cccc(C(F)(F)F)c4)C3)o2)cn1	ZINC000450572937	GI	On-Demand	Anodyne	CCR2	37	40
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CC(=O)NCc1ccccc1	ZINC000450572952	EE	On-Demand	Anodyne	UL54	58	36
C[C@@H](c1ccccc1)[C@H](O)CN(C)CC(=O)NCc1ccccc1	ZINC000450572953	EE	On-Demand	Anodyne	UL54	58	36
C[C@H](c1ccccc1)[C@H](O)CN(C)CC(=O)NCc1ccccc1	ZINC000450572954	EE	On-Demand	Anodyne	UL54	58	36
Cc1cccc([C@H]2CCN(C(=O)c3c(C4CC4)noc3C)C2)c1	ZINC000450572964	DH	On-Demand	Anodyne	HPGD	16	40
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450572965	FF	On-Demand	Anodyne	MAPK1	30	41
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(Cc2cnn[nH]2)CC1	ZINC000450572965	FF	On-Demand	Anodyne	TYK2	58	38
CC(C)(C)[C@@H]1CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450572970	CG	On-Demand	Anodyne	GNAI1	0	42
CC(C)(C)[C@@H]1CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450572970	CG	On-Demand	Anodyne	GNAI3	0	40
CC(C)(C)[C@@H]1CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450572970	CG	On-Demand	Anodyne	GNAO1	0	40
CC(C)(C)[C@H]1CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450572971	CG	On-Demand	Anodyne	GNAI1	0	42
CC(C)(C)[C@H]1CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450572971	CG	On-Demand	Anodyne	GNAI3	0	40
CC(C)(C)[C@H]1CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450572971	CG	On-Demand	Anodyne	GNAO1	0	40
Cn1c(C#N)ccc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572972	EH	On-Demand	Mild	CACNA1B	48	36
Cn1c(C#N)ccc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572972	EH	On-Demand	Mild	CCR2	35	41
Cn1c(C#N)ccc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572972	EH	On-Demand	Mild	RBP4	20	42
Cn1c(C#N)ccc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572973	EH	On-Demand	Mild	CACNA1B	48	36
Cn1c(C#N)ccc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572973	EH	On-Demand	Mild	CCR2	35	41
Cn1c(C#N)ccc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450572973	EH	On-Demand	Mild	RBP4	20	42
FC1(F)CC(CN2CCC(Oc3ccccn3)CC2)C1	ZINC000450572974	CF	On-Demand	Anodyne	SCN5A	40	36
CC[C@@]1(C)COCCN1C(=O)CCOc1cccc(OC)c1	ZINC000450572976	DE	On-Demand	Anodyne	MTNR1A	17	40
CC[C@]1(C)COCCN1C(=O)CCOc1cccc(OC)c1	ZINC000450572979	DE	On-Demand	Anodyne	MTNR1A	17	40
CC(C)c1nnc(CN(C)CC(=O)NCc2ccccc2)s1	ZINC000450572987	DE	On-Demand	Anodyne	UL54	43	33
CCC(=O)CCCN(C)CC(=O)NCc1ccccc1	ZINC000450572991	CD	On-Demand	Anodyne	LTA4H	31	43
CCC(=O)CCCN(C)CC(=O)NCc1ccccc1	ZINC000450572991	CD	On-Demand	Anodyne	TSPO	42	36
CCOc1cc(C(=O)NCC2(c3ccc(OC)cc3)CCC2)on1	ZINC000450573000	EF	On-Demand	Anodyne	ACAT	0	47
CCC(=O)CCCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450573006	FH	On-Demand	Anodyne	SIGMAR1	37	40
CCC(=O)CCCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450573006	FH	On-Demand	Anodyne	CCR5	50	44
CCC(=O)CCCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450573006	FH	On-Demand	Anodyne	CYP2J2	55	40
C[C@H](C[S@@](C)=O)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450573025	EG	On-Demand	Anodyne	RBP4	55	38
C[C@@H](C[S@](C)=O)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450573026	EG	On-Demand	Anodyne	RBP4	55	38
C[C@@H](C[S@@](C)=O)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450573027	EG	On-Demand	Anodyne	RBP4	55	38
C[C@H](O)CCN1CCCc2ccc(S(N)(=O)=O)cc21	ZINC000450573055	CC	On-Demand	Anodyne	CA14	25	44
C[C@@H](O)CCN1CCCc2ccc(S(N)(=O)=O)cc21	ZINC000450573060	CC	On-Demand	Anodyne	CA14	25	44
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1	ZINC000450573079	FG	On-Demand	Bother	HTR2A	17	42
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1	ZINC000450573079	FG	On-Demand	Bother	HTR2C	16	42
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1	ZINC000450573079	FG	On-Demand	Bother	CYP2J2	55	39
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1	ZINC000450573080	FG	On-Demand	Bother	HTR2A	17	42
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1	ZINC000450573080	FG	On-Demand	Bother	HTR2C	16	42
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1	ZINC000450573080	FG	On-Demand	Bother	CYP2J2	55	39
COc1cc(CC(=O)N(C)[C@H](C)C[S@@](C)=O)ccc1Cl	ZINC000450573086	DE	On-Demand	Anodyne	OPRK1	22	49
COc1cc(CC(=O)N(C)[C@@H](C)C[S@](C)=O)ccc1Cl	ZINC000450573087	DE	On-Demand	Anodyne	OPRK1	22	49
COc1cc(CC(=O)N(C)[C@H](C)C[S@](C)=O)ccc1Cl	ZINC000450573088	DE	On-Demand	Anodyne	OPRK1	22	49
COc1cc(CC(=O)N(C)[C@@H](C)C[S@@](C)=O)ccc1Cl	ZINC000450573089	DE	On-Demand	Anodyne	OPRK1	22	49
CS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c(F)c1	ZINC000450573091	DE	On-Demand	Anodyne	SLC6A9	23	45
CCC(CC)Oc1ccc(C(=O)NCCC(=O)NCc2ccccn2)cc1	ZINC000450573103	FG	On-Demand	Anodyne	PDS	40	33
COC(=O)C1(CN2CCN(CCNS(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000450573105	GC	On-Demand	Anodyne	HTR7	24	55
Cc1ccc(NC(=O)[C@H]2CCCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)nc1	ZINC000450573129	EF	On-Demand	Anodyne	SLC6A1	53	34
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)nc1	ZINC000450573130	EF	On-Demand	Anodyne	SLC6A1	53	34
Cc1ccc(NC(=O)[C@H]2CCCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)nc1	ZINC000450573131	EF	On-Demand	Anodyne	SLC6A1	53	34
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450573134	FG	On-Demand	Bother	MGLL	0	49
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450573134	FG	On-Demand	Bother	ABHD6	0	43
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450573134	FG	On-Demand	Bother	KCNJ1	26	41
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450573135	FG	On-Demand	Bother	MGLL	0	49
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450573135	FG	On-Demand	Bother	ABHD6	0	43
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450573135	FG	On-Demand	Bother	KCNJ1	26	41
Cc1ccc(NC(=O)[C@@H]2CCCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)nc1	ZINC000450573137	EF	On-Demand	Anodyne	SLC6A1	53	34
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450573141	EI	On-Demand	Anodyne	SLC9A1	49	41
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450573141	EI	On-Demand	Anodyne	SFRP1	43	41
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450573141	EI	On-Demand	Anodyne	L3MBTL3	43	37
Cc1cccc([C@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450573141	EI	On-Demand	Anodyne	HPGD	40	48
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450573142	EI	On-Demand	Anodyne	SLC9A1	49	41
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450573142	EI	On-Demand	Anodyne	SFRP1	43	41
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450573142	EI	On-Demand	Anodyne	L3MBTL3	43	37
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)nc3)C2)c1	ZINC000450573142	EI	On-Demand	Anodyne	HPGD	40	48
CCOC(=O)c1ccc(CN2CCN3CCCC[C@H]3C2)nc1	ZINC000450573143	DD	On-Demand	Anodyne	L3MBTL3	59	36
CCOC(=O)c1ccc(CN2CCN3CCCC[C@@H]3C2)nc1	ZINC000450573144	DD	On-Demand	Anodyne	L3MBTL3	59	36
COc1cc(CN2CCN3CCCC[C@H]3C2)ccc1Cl	ZINC000450573147	CG	On-Demand	Anodyne	SIGMAR1	29	58
COc1cc(CN2CCN3CCCC[C@H]3C2)ccc1Cl	ZINC000450573147	CG	On-Demand	Anodyne	SSTR5	43	36
COc1cc(CN2CCN3CCCC[C@H]3C2)ccc1Cl	ZINC000450573147	CG	On-Demand	Anodyne	EBP	26	40
COc1cc(CN2CCN3CCCC[C@@H]3C2)ccc1Cl	ZINC000450573148	CG	On-Demand	Anodyne	SIGMAR1	29	58
COc1cc(CN2CCN3CCCC[C@@H]3C2)ccc1Cl	ZINC000450573148	CG	On-Demand	Anodyne	SSTR5	43	36
COc1cc(CN2CCN3CCCC[C@@H]3C2)ccc1Cl	ZINC000450573148	CG	On-Demand	Anodyne	EBP	26	40
Nc1ncccc1CN1CCc2ccc(O)cc2C1	ZINC000450573149	CD	On-Demand	Anodyne	SLC6A5	28	48
CCC[C@@H](OC)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573154	EH	On-Demand	Anodyne	TACR1	49	35
CCC[C@@H](OC)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573154	EH	On-Demand	Anodyne	CACNA1B	49	36
CCC[C@@H](OC)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573154	EH	On-Demand	Anodyne	CCR2	75	45
CCC[C@@H](OC)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573154	EH	On-Demand	Anodyne	RBP4	22	40
CCC[C@H](OC)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573155	EH	On-Demand	Anodyne	TACR1	49	35
CCC[C@H](OC)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573155	EH	On-Demand	Anodyne	CACNA1B	49	36
CCC[C@H](OC)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573155	EH	On-Demand	Anodyne	CCR2	75	45
CCC[C@H](OC)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573155	EH	On-Demand	Anodyne	RBP4	22	40
CCC[C@@H](OC)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573156	EH	On-Demand	Anodyne	TACR1	49	35
CCC[C@@H](OC)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573156	EH	On-Demand	Anodyne	CACNA1B	49	36
CCC[C@@H](OC)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573156	EH	On-Demand	Anodyne	CCR2	75	45
CCC[C@@H](OC)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573156	EH	On-Demand	Anodyne	RBP4	22	40
CCC[C@H](OC)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573157	EH	On-Demand	Anodyne	TACR1	49	35
CCC[C@H](OC)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573157	EH	On-Demand	Anodyne	CACNA1B	49	36
CCC[C@H](OC)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573157	EH	On-Demand	Anodyne	CCR2	75	45
CCC[C@H](OC)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573157	EH	On-Demand	Anodyne	RBP4	22	40
CC(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450573172	EE	On-Demand	Anodyne	CA2	35	46
CC(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450573172	EE	On-Demand	Anodyne	CA1	29	41
CC(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450573172	EE	On-Demand	Anodyne	CA7	40	41
CC(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450573172	EE	On-Demand	Anodyne	CA14	25	41
CC(=O)c1ccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)cc1	ZINC000450573172	EE	On-Demand	Anodyne	CA12	32	41
CCCc1nc(C)c(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)o1	ZINC000450573173	FF	On-Demand	Bother	SLC27A4	42	31
CCCc1nc(C)c(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)o1	ZINC000450573176	FF	On-Demand	Bother	SLC27A4	42	31
CCNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(C(=O)OCC)cn1)CC2	ZINC000450573210	GE	On-Demand	Anodyne	P2RY12	28	41
COC(=O)c1csc(CN2c3ccccc3N(C)CC[C@H]2C)n1	ZINC000450573212	EG	On-Demand	Anodyne	TRPC3	42	35
COC(=O)c1csc(CN2c3ccccc3N(C)CC[C@@H]2C)n1	ZINC000450573213	EG	On-Demand	Anodyne	TRPC3	42	35
O=C(C1CCN(CC2=CCCCC2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450573219	FI	On-Demand	Anodyne	ACHE	18	40
O=C(C1CCN(CC2=CCCCC2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450573219	FI	On-Demand	Anodyne	SIGMAR1	36	44
O=C(C1CCN(CC2=CCCCC2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450573219	FI	On-Demand	Anodyne	CCR5	30	45
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	HTR1A	30	42
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	DRD2	48	42
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	DRD4	58	42
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	ACHE	19	47
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	HRH1	24	41
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	DRD3	34	41
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	OPRK1	0	42
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	HTR4	57	36
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	TACR1	28	44
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	HTR7	25	42
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	SIGMAR1	32	42
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	SSTR5	58	39
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	CCR3	30	43
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	UTS2R	23	40
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	TACR3	24	44
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	CACNA1G	20	41
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	MGLL	0	40
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	CCR8	42	43
COc1cc(CN2CCN(C(=O)c3ccccc3O)CC2)ccc1Cl	ZINC000450573222	FG	On-Demand	Anodyne	ABHD6	0	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450573229	EH	On-Demand	Anodyne	CCR2	53	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450573231	EH	On-Demand	Anodyne	CCR2	53	46
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450573232	EH	On-Demand	Anodyne	CCR2	53	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000450573233	EH	On-Demand	Anodyne	CCR2	53	46
COc1ccc(C2(CNC(=O)C3(C(F)(F)F)CCC3)CCC2)cc1	ZINC000450573237	EH	On-Demand	Anodyne	KCNA3	44	37
COc1ccc(C2(CNC(=O)C3(C(F)(F)F)CCC3)CCC2)cc1	ZINC000450573237	EH	On-Demand	Anodyne	NMBR	50	40
COc1ccc(C2(CNC(=O)C3(C(F)(F)F)CCC3)CCC2)cc1	ZINC000450573237	EH	On-Demand	Anodyne	GRPR	24	40
COc1ccc(C2(CNC(=O)C3(C(F)(F)F)CCC3)CCC2)cc1	ZINC000450573237	EH	On-Demand	Anodyne	ACAT	0	52
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573239	FH	On-Demand	Anodyne	OPRM1	0	41
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573239	FH	On-Demand	Anodyne	OPRK1	45	43
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573239	FH	On-Demand	Anodyne	CCR3	34	46
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573239	FH	On-Demand	Anodyne	MAPK1	33	45
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573239	FH	On-Demand	Anodyne	EPHX2	33	53
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573239	FH	On-Demand	Anodyne	TYK2	51	41
CCC[C@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573239	FH	On-Demand	Anodyne	MCHR1	22	43
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573240	FH	On-Demand	Anodyne	OPRM1	0	41
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573240	FH	On-Demand	Anodyne	OPRK1	45	43
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573240	FH	On-Demand	Anodyne	CCR3	34	46
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573240	FH	On-Demand	Anodyne	MAPK1	33	45
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573240	FH	On-Demand	Anodyne	EPHX2	33	53
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573240	FH	On-Demand	Anodyne	TYK2	51	41
CCC[C@@H](O)CN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1	ZINC000450573240	FH	On-Demand	Anodyne	MCHR1	22	43
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	DRD2	27	40
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	DRD1	15	41
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	DRD4	0	43
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	HRH2	18	42
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	HTR2A	23	47
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	HTR2C	19	48
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	ADRA1B	15	42
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	ADRA2B	15	40
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	ERG2	19	40
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	SLC18A3	0	41
O=C(CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573242	FG	On-Demand	Bother	CYP2J2	48	34
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	DRD2	27	40
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	DRD1	15	41
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	DRD4	0	43
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	HRH2	18	42
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	HTR2A	23	47
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	HTR2C	19	48
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	ADRA1B	15	42
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	ADRA2B	15	40
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	ERG2	19	40
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	SLC18A3	0	41
O=C(CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1	ZINC000450573243	FG	On-Demand	Bother	CYP2J2	48	34
CCOC(=O)COc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450573253	FG	On-Demand	Anodyne	PFK	0	41
CCOC(=O)c1ccc(CN2CCC(CN3CCCCC3=O)CC2)nc1	ZINC000450573258	FE	On-Demand	Anodyne	SSTR5	41	41
CC(C)CCCC(=O)NCCC(=O)NCc1ccccn1	ZINC000450573272	CE	On-Demand	Anodyne	SUCNR1	40	33
CC[C@@H](Nc1ccc(C(=O)NC)cc1[N+](=O)[O-])C(F)F	ZINC000450573273	CE	On-Demand	Bother	TAAR1	17	44
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450573274	FG	On-Demand	Anodyne	DRD4	17	44
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450573274	FG	On-Demand	Anodyne	HTR2A	15	44
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450573274	FG	On-Demand	Anodyne	DRD3	20	44
CC(C)(C)c1nc(CN2CCN(CCCC(=O)c3ccccc3)CC2)no1	ZINC000450573274	FG	On-Demand	Anodyne	CYP2J2	64	49
CC[C@H](Nc1ccc(C(=O)NC)cc1[N+](=O)[O-])C(F)F	ZINC000450573275	CE	On-Demand	Bother	TAAR1	17	44
COC(=O)c1csc(CN2CCC(Nc3cccc(C)c3)CC2)n1	ZINC000450573280	EG	On-Demand	Anodyne	PTPN2	42	33
COC(=O)c1csc(CN2CCC(Nc3cccc(C)c3)CC2)n1	ZINC000450573280	EG	On-Demand	Anodyne	SSTR5	62	37
COC(=O)c1csc(CN2CCC(Nc3cccc(C)c3)CC2)n1	ZINC000450573280	EG	On-Demand	Anodyne	TRPC6	53	34
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450573293	EE	On-Demand	Bother	L3MBTL3	42	34
Cc1cccc(CNC(C)(C)c2nc(C)cs2)n1	ZINC000450573299	CG	On-Demand	Anodyne	INHA	16	40
CC(=O)c1cccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)c1	ZINC000450573320	EE	On-Demand	Anodyne	AKR1C3	46	32
CCC[C@@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450573325	CE	On-Demand	Anodyne	ABCB1	47	37
C[C@H](O)CCN1CCC[C@@H]1c1ncc(-c2ccc(Cl)cc2)[nH]1	ZINC000450573326	DH	On-Demand	Anodyne	PRCP	21	52
CCC[C@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450573330	CE	On-Demand	Anodyne	ABCB1	47	37
C[C@H](O)CCN1CCC[C@H]1c1ncc(-c2ccc(Cl)cc2)[nH]1	ZINC000450573333	DH	On-Demand	Anodyne	PRCP	21	52
C[C@@H](O)CCN1CCC[C@@H]1c1ncc(-c2ccc(Cl)cc2)[nH]1	ZINC000450573334	DH	On-Demand	Anodyne	PRCP	21	52
C[C@@H](O)CCN1CCC[C@H]1c1ncc(-c2ccc(Cl)cc2)[nH]1	ZINC000450573336	DH	On-Demand	Anodyne	PRCP	21	52
Cc1csc(C(=O)NCCCNc2cccc(F)c2)c1	ZINC000450573361	CG	On-Demand	Anodyne	KCNK3	31	40
O=C(c1ccc(N2CCC2)nc1)N1CCCCc2cc(Br)ccc21	ZINC000450573363	GI	On-Demand	Anodyne	AVPR2	40	51
CC[C@@H](Nc1ccccc1[N+](=O)[O-])C(F)F	ZINC000450573364	BG	On-Demand	Bother	COLA	74	33
CC[C@H](Nc1ccccc1[N+](=O)[O-])C(F)F	ZINC000450573365	BG	On-Demand	Bother	COLA	74	33
CC[C@H](Nc1ncnc2ccc(C)cc12)C(F)F	ZINC000450573366	CG	On-Demand	Anodyne	CLK4	47	35
CC[C@H](Nc1ncnc2ccc(C)cc12)C(F)F	ZINC000450573366	CG	On-Demand	Anodyne	HTT	0	41
CC[C@@H](Nc1ncnc2ccc(C)cc12)C(F)F	ZINC000450573367	CG	On-Demand	Anodyne	CLK4	47	35
CC[C@@H](Nc1ncnc2ccc(C)cc12)C(F)F	ZINC000450573367	CG	On-Demand	Anodyne	HTT	0	41
CCOC(=O)[C@@H]1CN(c2ncccc2OCc2ccccc2)CC12COC2	ZINC000450573382	FF	On-Demand	Anodyne	PPIA	38	40
CCOC(=O)[C@H]1CN(c2ncccc2OCc2ccccc2)CC12COC2	ZINC000450573383	FF	On-Demand	Anodyne	PPIA	38	40
FC(F)(F)c1cnc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)s1	ZINC000450573384	CG	On-Demand	Anodyne	MLYCD	64	39
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450573388	GG	On-Demand	Anodyne	HTR1A	16	49
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450573388	GG	On-Demand	Anodyne	HTR3A	43	53
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450573388	GG	On-Demand	Anodyne	HTR7	16	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc4ccccc4n3)CC2)cc1	ZINC000450573388	GG	On-Demand	Anodyne	SORD	16	44
CCc1ccc([C@H](CO)NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450573396	GF	On-Demand	Anodyne	ADRB3	18	41
CCc1ccc([C@H](CO)NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450573396	GF	On-Demand	Anodyne	F7	30	44
CCc1ccc([C@@H](CO)NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450573397	GF	On-Demand	Anodyne	ADRB3	18	41
CCc1ccc([C@@H](CO)NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450573397	GF	On-Demand	Anodyne	F7	30	44
CCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450573398	DG	On-Demand	Anodyne	MAOB	56	38
CCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450573398	DG	On-Demand	Anodyne	CA7	20	46
CCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450573398	DG	On-Demand	Anodyne	FFAR1	44	41
CCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450573398	DG	On-Demand	Anodyne	PIR	0	40
Cn1c(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)nc2ccccc21	ZINC000450573399	CF	On-Demand	Anodyne	HRH1	0	56
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	HTR1A	69	46
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	DRD2	53	46
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	DRD1	27	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	DRD4	27	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	ADRA1D	50	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	ADRA1A	48	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	ADRA1B	28	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	DRD3	50	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	HTR7	40	39
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	ABCB1	51	39
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	HSP90AB1	37	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573430	GF	On-Demand	Anodyne	AP2S1	0	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	HTR1A	69	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	DRD2	53	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	DRD1	27	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	DRD4	27	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	ADRA1D	50	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	ADRA1A	48	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	ADRA1B	28	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	DRD3	50	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	HTR7	40	39
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	ABCB1	51	39
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	HSP90AB1	37	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573431	GF	On-Demand	Anodyne	AP2S1	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	HTR1A	69	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	DRD2	53	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	DRD1	27	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	DRD4	27	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	ADRA1D	50	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	ADRA1A	48	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	ADRA1B	28	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	DRD3	50	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	HTR7	40	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	ABCB1	51	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	HSP90AB1	37	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573432	GF	On-Demand	Anodyne	AP2S1	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	HTR1A	69	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	DRD2	53	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	DRD1	27	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	DRD4	27	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	ADRA1D	50	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	ADRA1A	48	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	ADRA1B	28	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	DRD3	50	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	HTR7	40	39
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	ABCB1	51	39
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	HSP90AB1	37	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450573433	GF	On-Demand	Anodyne	AP2S1	0	40
C[C@H](CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)S(C)(=O)=O	ZINC000450573446	FC	On-Demand	Bother	KCNJ1	26	43
C[C@@H](CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)S(C)(=O)=O	ZINC000450573447	FC	On-Demand	Bother	KCNJ1	26	43
CC(=O)c1cccc(CN(C)CC(=O)NCc2ccccc2)c1	ZINC000450573463	DF	On-Demand	Anodyne	UL54	47	32
CC(=O)c1cccc(CN(C)CC(=O)NCc2ccccc2)c1	ZINC000450573463	DF	On-Demand	Anodyne	PDS	41	34
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	HTR1A	18	53
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	ADRA2A	0	40
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	AR	0	51
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	DRD2	28	40
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	DRD1	15	41
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	DRD4	18	43
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	ADRA1D	20	40
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	HTR2A	23	55
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	ADRA1A	24	40
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	ADRA1B	20	41
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	DRD3	15	43
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	ADRA2B	26	40
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	ADRA2C	0	43
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	HTR7	20	45
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	SIGMAR1	16	55
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	SLC18A3	0	40
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	MGLL	0	45
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	CYP2J2	60	43
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	ABHD6	0	45
O=C(CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000450573466	GG	On-Demand	Bother	KCNJ1	30	43
CC(F)(F)c1ccc(C(=O)NCCCNc2cccc(F)c2)cn1	ZINC000450573471	EH	On-Demand	Anodyne	TBK1	26	54
C[C@@H](c1csnn1)N1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450573473	FH	On-Demand	Anodyne	CCR5	15	41
C[C@H](c1csnn1)N1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450573474	FH	On-Demand	Anodyne	CCR5	15	41
CCOC(=O)c1ccc(CN2CCC(Nc3cccc(C)c3)CC2)nc1	ZINC000450573475	FH	On-Demand	Anodyne	CHRM1	15	41
CCOC(=O)c1ccc(CN2CCC(Nc3cccc(C)c3)CC2)nc1	ZINC000450573475	FH	On-Demand	Anodyne	P2RY12	45	51
CCOC(=O)c1ccc(CN2CCC(Nc3cccc(C)c3)CC2)nc1	ZINC000450573475	FH	On-Demand	Anodyne	CHRM3	19	41
CCOC(=O)c1ccc(CN2CCC(Nc3cccc(C)c3)CC2)nc1	ZINC000450573475	FH	On-Demand	Anodyne	PTPN2	41	32
CCOC(=O)c1ccc(CN2CCC(Nc3cccc(C)c3)CC2)nc1	ZINC000450573475	FH	On-Demand	Anodyne	SSTR5	70	45
CCCc1c(NC(=O)c2cc(C)n(C(C)C)n2)cnn1-c1cccc(F)c1	ZINC000450573476	FI	On-Demand	Anodyne	NPY5R	15	41
CNS(=O)(=O)c1ccc2c(c1)N(C[C@H](Cc1ccccc1)OC)CC2	ZINC000450573499	FE	On-Demand	Anodyne	TRY2_BOVIN	61	34
CNS(=O)(=O)c1ccc2c(c1)N(C[C@@H](Cc1ccccc1)OC)CC2	ZINC000450573500	FE	On-Demand	Anodyne	TRY2_BOVIN	61	34
CC(C)N(CCCC(=O)c1ccccc1)C1CCC1	ZINC000450573501	CH	On-Demand	Anodyne	AMY2	46	32
CC(C)N(CCCC(=O)c1ccccc1)C1CCC1	ZINC000450573501	CH	On-Demand	Anodyne	CYP2J2	50	36
CCOC(=O)[C@H]1CN(c2ncc(C(=O)N(C)C)cc2Cl)CC12COC2	ZINC000450573512	FD	On-Demand	Anodyne	P2RY12	27	40
CCOC(=O)[C@@H]1CN(c2ncc(C(=O)N(C)C)cc2Cl)CC12COC2	ZINC000450573513	FD	On-Demand	Anodyne	P2RY12	27	40
CC(=O)c1ccc(CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)cc1	ZINC000450573526	GG	On-Demand	Anodyne	CASP3	27	41
CC(=O)c1ccc(CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)cc1	ZINC000450573526	GG	On-Demand	Anodyne	CASP7	20	41
CC(=O)c1ccc(CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)cc1	ZINC000450573526	GG	On-Demand	Anodyne	AKR1C3	61	38
CC(=O)c1ccc(CN2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)cc1	ZINC000450573526	GG	On-Demand	Anodyne	C3SWJ7_ECOLX	0	42
CCOC(=O)[C@@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)CC12COC2	ZINC000450573529	GD	On-Demand	Anodyne	SCD1	42	40
CCOC(=O)[C@@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)CC12COC2	ZINC000450573529	GD	On-Demand	Anodyne	SCD	34	40
O=C(c1cc2n(n1)CCC2)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573531	EG	On-Demand	Anodyne	CACNA1B	51	39
O=C(c1cc2n(n1)CCC2)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573531	EG	On-Demand	Anodyne	SLC9A1	40	37
O=C(c1cc2n(n1)CCC2)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573531	EG	On-Demand	Anodyne	CCR2	26	40
CCOC(=O)[C@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)CC12COC2	ZINC000450573532	GD	On-Demand	Anodyne	SCD1	42	40
CCOC(=O)[C@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)CC12COC2	ZINC000450573532	GD	On-Demand	Anodyne	SCD	34	40
O=C(c1cc2n(n1)CCC2)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573538	EG	On-Demand	Anodyne	CACNA1B	51	39
O=C(c1cc2n(n1)CCC2)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573538	EG	On-Demand	Anodyne	SLC9A1	40	37
O=C(c1cc2n(n1)CCC2)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573538	EG	On-Demand	Anodyne	CCR2	26	40
CCOC(=O)COc1ccc(NC(=O)Cc2cn(C)nc2C)cc1	ZINC000450573559	ED	On-Demand	Anodyne	ADORA2B	45	37
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	DRD2	23	42
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	DRD4	53	47
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	ACHE	23	40
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	HRH1	31	42
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	DRD3	26	42
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	PDE3A	30	46
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	SIGMAR1	34	42
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	SSTR5	88	48
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	CCR3	37	40
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	UTS2R	25	42
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	SCN9A	0	40
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	PDE3B	53	46
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	SCN5A	67	37
COc1cc(CN2CCC(Oc3ccccn3)CC2)ccc1Cl	ZINC000450573567	EH	On-Demand	Anodyne	MCHR1	21	40
COc1cccc(OCCC(=O)N2CCC(Cc3cccnc3)CC2)c1	ZINC000450573572	FG	On-Demand	Anodyne	GRIN2B	40	43
COc1cccc(OCCC(=O)N2CCC(Cc3cccnc3)CC2)c1	ZINC000450573572	FG	On-Demand	Anodyne	NPY2R	54	38
COc1cccc(OCCC(=O)N2CCC(Cc3cccnc3)CC2)c1	ZINC000450573572	FG	On-Demand	Anodyne	CCR3	29	42
COc1cccc(OCCC(=O)N2CCC(Cc3cccnc3)CC2)c1	ZINC000450573572	FG	On-Demand	Anodyne	CHRNA7	49	47
COc1cccc(OCCC(=O)N2CCC(Cc3cccnc3)CC2)c1	ZINC000450573572	FG	On-Demand	Anodyne	C3AR1	54	52
COCCOC[C@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450573590	EC	On-Demand	Anodyne	ABCB1	58	42
COCCOC[C@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450573590	EC	On-Demand	Anodyne	HSP90AB1	49	51
C1=C[C@H]2C[C@H]1[C@@H]1CN(c3nc4ccccc4[nH]3)C[C@@H]12	ZINC000450573602	CF	On-Demand	Anodyne	KCNN3	30	43
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573603	GI	On-Demand	Anodyne	HTR1A	18	42
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573603	GI	On-Demand	Anodyne	SLC6A1	52	37
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573603	GI	On-Demand	Anodyne	HTR7	15	42
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573603	GI	On-Demand	Anodyne	CYP2J2	50	41
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573603	GI	On-Demand	Anodyne	ACKR3	64	34
COCCOC[C@@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450573604	EC	On-Demand	Anodyne	ABCB1	58	42
COCCOC[C@@H](O)CN1CCN(c2ncccc2Cl)CC1	ZINC000450573604	EC	On-Demand	Anodyne	HSP90AB1	49	51
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	HTR1A	30	58
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	DRD2	45	57
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	DRD1	31	57
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	DRD4	36	57
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	ACHE	16	45
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	HTR2A	37	50
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	HTR2C	31	54
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	SLC6A4	22	46
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	HRH1	22	57
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	DRD3	27	57
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	SLC6A3	19	53
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	DRD5	17	47
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	ERG2	24	51
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	HTR7	38	48
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	SIGMAR1	41	50
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	CCR3	33	40
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	SLC18A3	15	49
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	ABCB1	18	48
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	MCHR1	15	42
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	CACNA1G	41	39
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	NET	0	53
O=C(CCCN1CCN(Cc2cccc(O)c2)CC1)c1ccc(F)cc1	ZINC000450573605	FG	On-Demand	Anodyne	AP2S1	0	48
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573607	GI	On-Demand	Anodyne	HTR1A	18	42
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573607	GI	On-Demand	Anodyne	SLC6A1	52	37
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573607	GI	On-Demand	Anodyne	HTR7	15	42
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573607	GI	On-Demand	Anodyne	CYP2J2	50	41
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450573607	GI	On-Demand	Anodyne	ACKR3	64	34
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450573612	CF	On-Demand	Mild	ADAM10	18	41
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450573615	CF	On-Demand	Mild	ADAM10	18	41
COc1ccc(C2(CNC(=O)CC3(O)CCC3)CCC2)cc1	ZINC000450573616	DF	On-Demand	Anodyne	MTNR1A	26	46
COc1ccc(C2(CNC(=O)CC3(O)CCC3)CCC2)cc1	ZINC000450573616	DF	On-Demand	Anodyne	ACAT	0	54
COc1ccc(C2(CNC(=O)C(C)(C)OC(C)C)CCC2)cc1	ZINC000450573619	DG	On-Demand	Anodyne	NMBR	51	40
COc1ccc(C2(CNC(=O)C(C)(C)OC(C)C)CCC2)cc1	ZINC000450573619	DG	On-Demand	Anodyne	ACAT	0	54
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450573624	GH	On-Demand	Anodyne	AGTR2	41	35
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450573624	GH	On-Demand	Anodyne	ACKR3	66	35
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450573625	GH	On-Demand	Anodyne	AGTR2	41	35
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450573625	GH	On-Demand	Anodyne	ACKR3	66	35
CNS(=O)(=O)c1ccc(N2[C@@H](C)C[C@@H](CC(F)(F)F)[C@H]2C)nc1	ZINC000450573626	FF	On-Demand	Anodyne	GCKR	21	40
CNS(=O)(=O)c1ccc(N2[C@@H](C)C[C@H](CC(F)(F)F)[C@H]2C)nc1	ZINC000450573628	FF	On-Demand	Anodyne	GCKR	21	40
Cc1cccc([C@H]2CCN(C(=O)c3cc(-c4ccccc4)nn3C)C2)c1	ZINC000450573639	EI	On-Demand	Anodyne	HPGD	18	47
Cc1cccc([C@@H]2CCN(C(=O)c3cc(-c4ccccc4)nn3C)C2)c1	ZINC000450573644	EI	On-Demand	Anodyne	HPGD	18	47
CCSc1cccnc1C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000450573645	EI	On-Demand	Anodyne	HPGD	20	42
CCSc1cccnc1C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000450573646	EI	On-Demand	Anodyne	HPGD	20	42
COC(=O)C1(CSc2nnc(-c3ccc(OC)cc3)o2)CCCC1	ZINC000450573649	EH	On-Demand	Anodyne	GSK3B	22	49
COC(=O)C1(CSc2nnc(-c3ccc(OC)cc3)o2)CCCC1	ZINC000450573649	EH	On-Demand	Anodyne	GSK3A	36	45
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450573659	FG	On-Demand	Bother	SLC27A4	54	37
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450573661	FG	On-Demand	Bother	SLC27A4	54	37
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450573662	FG	On-Demand	Bother	SLC27A4	54	37
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450573663	FG	On-Demand	Bother	SLC27A4	54	37
C[C@@H]1C[C@@H](CNC(=O)c2c(Cl)cc(F)cc2Br)CCO1	ZINC000450573664	FH	On-Demand	Anodyne	CACNA1I	47	31
C[C@H]1C[C@H](CNC(=O)c2c(Cl)cc(F)cc2Br)CCO1	ZINC000450573668	FH	On-Demand	Anodyne	CACNA1I	47	31
C[C@H]1C[C@@H](CNC(=O)c2c(Cl)cc(F)cc2Br)CCO1	ZINC000450573670	FH	On-Demand	Anodyne	CACNA1I	47	31
C[C@@H]1C[C@H](CNC(=O)c2c(Cl)cc(F)cc2Br)CCO1	ZINC000450573671	FH	On-Demand	Anodyne	CACNA1I	47	31
FC(F)(F)Cn1ccc(CN2CCC(Oc3ccccn3)CC2)n1	ZINC000450573676	EF	On-Demand	Anodyne	SCN9A	0	42
FC(F)(F)Cn1ccc(CN2CCC(Oc3ccccn3)CC2)n1	ZINC000450573676	EF	On-Demand	Anodyne	SCN5A	44	42
CCC[C@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450573680	CD	On-Demand	Anodyne	ADRB3	15	44
CCC[C@@H](O)CN1CCC(CN2CCCCC2=O)CC1	ZINC000450573681	CD	On-Demand	Anodyne	ADRB3	15	44
CCc1ccc([C@@H](CO)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450573712	CD	On-Demand	Anodyne	GPR88	0	40
CCc1ccc([C@H](CO)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450573713	CD	On-Demand	Anodyne	GPR88	0	40
COc1ccc(C2(CNC(=O)c3cn(CCc4ccccc4)nn3)CCC2)cc1	ZINC000450573723	GG	On-Demand	Anodyne	KCNA3	51	43
COc1ccc(C2(CNC(=O)c3cn(CCc4ccccc4)nn3)CCC2)cc1	ZINC000450573723	GG	On-Demand	Anodyne	ACAT	0	48
COc1ccc(C2(CNC(=O)c3cn(CCc4ccccc4)nn3)CCC2)cc1	ZINC000450573723	GG	On-Demand	Anodyne	HCN1	48	36
c1ccc(CCn2ccc(CN3CCC(Oc4ccccn4)CC3)n2)cc1	ZINC000450573724	FH	On-Demand	Anodyne	SIGMAR1	22	42
c1ccc(CCn2ccc(CN3CCC(Oc4ccccn4)CC3)n2)cc1	ZINC000450573724	FH	On-Demand	Anodyne	SCN9A	23	48
c1ccc(CCn2ccc(CN3CCC(Oc4ccccn4)CC3)n2)cc1	ZINC000450573724	FH	On-Demand	Anodyne	SCN5A	88	41
CCS(=O)(=O)c1ccc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)cc1	ZINC000450573727	GF	On-Demand	Mild	PTAFR	46	43
CCS(=O)(=O)c1ccc(CN2CCN([C@@H](C#N)c3ccccc3)CC2)cc1	ZINC000450573727	GF	On-Demand	Mild	SIGMAR1	20	40
CCS(=O)(=O)c1ccc(CN2CCN([C@H](C#N)c3ccccc3)CC2)cc1	ZINC000450573728	GF	On-Demand	Mild	PTAFR	46	43
CCS(=O)(=O)c1ccc(CN2CCN([C@H](C#N)c3ccccc3)CC2)cc1	ZINC000450573728	GF	On-Demand	Mild	SIGMAR1	20	40
C[C@@H](CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1)S(C)(=O)=O	ZINC000450573730	GE	On-Demand	Anodyne	CCR5	68	47
C[C@H](CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1)S(C)(=O)=O	ZINC000450573731	GE	On-Demand	Anodyne	CCR5	68	47
Cc1cc(C(=O)N2CCCCc3cc(Br)ccc32)nn1C(C)C	ZINC000450573744	GJ	On-Demand	Anodyne	AVPR2	33	41
CCN(C[C@H](O)Cc1ccccc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1	ZINC000450573747	GH	On-Demand	Anodyne	SORD	47	38
CC[C@@H](Nc1ncnc2c1cnn2-c1ccccc1)C(F)F	ZINC000450573757	DG	On-Demand	Anodyne	GSK3B	15	45
CC[C@H](Nc1ncnc2c1cnn2-c1ccccc1)C(F)F	ZINC000450573758	DG	On-Demand	Anodyne	GSK3B	15	45
Nc1ncccc1CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450573763	FG	On-Demand	Anodyne	CCR5	20	41
C[C@H](c1csnn1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000450573767	EF	On-Demand	Anodyne	HTR3A	30	43
C[C@@H](c1csnn1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000450573768	EF	On-Demand	Anodyne	HTR3A	30	43
O=C1CC[C@H](CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)CCN1	ZINC000450573771	GF	On-Demand	Anodyne	CCR5	29	41
O=C1CC[C@@H](CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)CCN1	ZINC000450573772	GF	On-Demand	Anodyne	CCR5	29	41
CCNS(=O)(=O)c1ccc2c(c1)N(Cc1cccc(C(C)=O)c1)CC2	ZINC000450573778	FF	On-Demand	Anodyne	TRY2_BOVIN	60	37
CC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C(F)F	ZINC000450573784	CG	On-Demand	Bother	TAAR1	15	43
CC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C(F)F	ZINC000450573785	CG	On-Demand	Bother	TAAR1	15	43
O=C(NCCCNc1cccc(F)c1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450573795	GG	On-Demand	Anodyne	DRD4	41	33
O=C(NCCCNc1cccc(F)c1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450573795	GG	On-Demand	Anodyne	EPHX2	19	41
O=C(NCCCNc1cccc(F)c1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450573795	GG	On-Demand	Anodyne	PIK3CB	36	44
O=C(NCCCNc1cccc(F)c1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450573795	GG	On-Demand	Anodyne	TBK1	22	40
O=C(NCCCNc1cccc(F)c1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450573795	GG	On-Demand	Anodyne	STAT6	40	35
CN(CCCC(=O)c1ccc(F)cc1)CC(=O)NCc1ccccc1	ZINC000450573809	EG	On-Demand	Anodyne	THRA	0	43
CN(CCCC(=O)c1ccc(F)cc1)CC(=O)NCc1ccccc1	ZINC000450573809	EG	On-Demand	Anodyne	ACHE	0	41
CN(CCCC(=O)c1ccc(F)cc1)CC(=O)NCc1ccccc1	ZINC000450573809	EG	On-Demand	Anodyne	LTA4H	29	47
CN(CCCC(=O)c1ccc(F)cc1)CC(=O)NCc1ccccc1	ZINC000450573809	EG	On-Demand	Anodyne	LIMK2	36	42
CCOC(=O)COc1ccc(NC(=O)c2cc3c([nH]2)CCCC3)cc1	ZINC000450573812	EG	On-Demand	Anodyne	NOD2	34	40
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450573820	GI	On-Demand	Anodyne	CCR5	75	45
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000450573821	GI	On-Demand	Anodyne	CCR5	75	45
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@H]1CC12CCCCC2	ZINC000450573831	EG	On-Demand	Anodyne	CCKBR	0	41
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@H]1CC12CCCCC2	ZINC000450573831	EG	On-Demand	Anodyne	ACAT	0	45
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@@H]1CC12CCCCC2	ZINC000450573832	EG	On-Demand	Anodyne	CCKBR	0	41
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@@H]1CC12CCCCC2	ZINC000450573832	EG	On-Demand	Anodyne	ACAT	0	45
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1	ZINC000450573833	GF	On-Demand	Anodyne	DRD2	21	48
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1	ZINC000450573833	GF	On-Demand	Anodyne	DRD4	42	44
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1	ZINC000450573833	GF	On-Demand	Anodyne	HTR2A	15	40
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1	ZINC000450573833	GF	On-Demand	Anodyne	DRD3	18	44
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1	ZINC000450573833	GF	On-Demand	Anodyne	ADORA2B	43	35
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1	ZINC000450573833	GF	On-Demand	Anodyne	HTR7	16	40
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1	ZINC000450573833	GF	On-Demand	Anodyne	SIGMAR1	16	40
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1	ZINC000450573833	GF	On-Demand	Anodyne	HTR6	15	40
Cc1cccc([C@H]2CCN(C(=O)C(C)(C)C(C)(F)F)C2)c1	ZINC000450573834	CH	On-Demand	Anodyne	SLC9A1	41	38
Cc1cccc([C@@H]2CCN(C(=O)C(C)(C)C(C)(F)F)C2)c1	ZINC000450573835	CH	On-Demand	Anodyne	SLC9A1	41	38
CCc1ccc([C@@H](CO)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450573836	CD	On-Demand	Anodyne	GPR88	0	40
CCc1ccc([C@H](CO)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450573838	CD	On-Demand	Anodyne	GPR88	0	40
COC(=O)[C@@H](C)NC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450573840	GE	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450573842	GE	On-Demand	Bother	TAAR1	20	45
O=C(c1cc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450573847	FG	On-Demand	Bother	L3MBTL1	0	41
O=C(c1cc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450573847	FG	On-Demand	Bother	L3MBTL3	15	41
COc1ccc(C2(CNC(=O)CCc3ccc(C(N)=O)cc3)CCC2)cc1	ZINC000450573853	FF	On-Demand	Anodyne	KCNA3	31	44
COc1ccc(C2(CNC(=O)CCc3ccc(C(N)=O)cc3)CCC2)cc1	ZINC000450573853	FF	On-Demand	Anodyne	MTNR1A	23	45
COc1ccc(C2(CNC(=O)CCc3ccc(C(N)=O)cc3)CCC2)cc1	ZINC000450573853	FF	On-Demand	Anodyne	ACAT	0	47
Cc1cccc([C@H]2CCN(C(=O)c3cc4cccnc4s3)C2)c1	ZINC000450573854	DI	On-Demand	Anodyne	MGEA5	23	43
Cc1cccc([C@H]2CCN(C(=O)c3cc4cccnc4s3)C2)c1	ZINC000450573854	DI	On-Demand	Anodyne	HPGD	16	41
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@@H]1c1ncc[nH]1	ZINC000450573856	FI	On-Demand	Anodyne	PRCP	45	42
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@@H]1c1ncc[nH]1	ZINC000450573856	FI	On-Demand	Anodyne	COLA	116	40
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@@H]1c1ncc[nH]1	ZINC000450573856	FI	On-Demand	Anodyne	CPT1A	111	40
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@H]1c1ncc[nH]1	ZINC000450573857	FI	On-Demand	Anodyne	PRCP	45	42
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@H]1c1ncc[nH]1	ZINC000450573857	FI	On-Demand	Anodyne	COLA	116	40
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@H]1c1ncc[nH]1	ZINC000450573857	FI	On-Demand	Anodyne	CPT1A	111	40
c1ccc(OC2CCN(CCc3cscn3)CC2)nc1	ZINC000450573858	CF	On-Demand	Anodyne	SCN9A	23	47
c1ccc(OC2CCN(CCc3cscn3)CC2)nc1	ZINC000450573858	CF	On-Demand	Anodyne	SCN5A	90	43
Cc1cccc([C@@H]2CCN(C(=O)c3cc4cccnc4s3)C2)c1	ZINC000450573859	DI	On-Demand	Anodyne	MGEA5	23	43
Cc1cccc([C@H]2CCN(C(=O)c3cc4ccncc4s3)C2)c1	ZINC000450573860	DI	On-Demand	Anodyne	MGEA5	15	41
Cc1cccc([C@@H]2CCN(C(=O)c3cc4ccncc4s3)C2)c1	ZINC000450573861	DI	On-Demand	Anodyne	MGEA5	15	41
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450573878	GI	On-Demand	Anodyne	SCD1	47	46
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450573878	GI	On-Demand	Anodyne	SCD	37	46
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450573881	GI	On-Demand	Anodyne	SCD1	47	46
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450573881	GI	On-Demand	Anodyne	SCD	37	46
c1ccc(OC2CCN(Cc3cnn[nH]3)CC2)nc1	ZINC000450573884	CD	On-Demand	Anodyne	SCN5A	60	37
Cc1cccc(Cl)c1CN1CCN(CC(=O)N[C@H]2CCS(=O)(=O)C2)CC1	ZINC000450573885	GD	On-Demand	Anodyne	DRD4	20	42
Cc1cccc(Cl)c1CN1CCN(CC(=O)N[C@H]2CCS(=O)(=O)C2)CC1	ZINC000450573885	GD	On-Demand	Anodyne	SIGMAR1	15	46
Cc1cccc(Cl)c1CN1CCN(CC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1	ZINC000450573894	GD	On-Demand	Anodyne	DRD4	20	42
Cc1cccc(Cl)c1CN1CCN(CC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1	ZINC000450573894	GD	On-Demand	Anodyne	SIGMAR1	15	46
CCOC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)CC12COC2	ZINC000450573905	FD	On-Demand	Anodyne	PDE3A	43	39
CCOC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)CC12COC2	ZINC000450573905	FD	On-Demand	Anodyne	PDGFRB	64	42
CCOC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)CC12COC2	ZINC000450573905	FD	On-Demand	Anodyne	PDE3B	47	39
CCOC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)CC12COC2	ZINC000450573907	FD	On-Demand	Anodyne	PDE3A	43	39
CCOC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)CC12COC2	ZINC000450573907	FD	On-Demand	Anodyne	PDGFRB	64	42
CCOC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)CC12COC2	ZINC000450573907	FD	On-Demand	Anodyne	PDE3B	47	39
O=C(CC1(O)CCC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573924	EG	On-Demand	Anodyne	CACNA1B	53	37
O=C(CC1(O)CCC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573924	EG	On-Demand	Anodyne	CCR2	48	40
O=C(CC1(O)CCC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573924	EG	On-Demand	Anodyne	LIPG	48	32
O=C(CC1(O)CCC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573925	EG	On-Demand	Anodyne	CACNA1B	53	37
O=C(CC1(O)CCC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573925	EG	On-Demand	Anodyne	CCR2	48	40
O=C(CC1(O)CCC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450573925	EG	On-Demand	Anodyne	LIPG	48	32
COc1cccc(Oc2ccc(C(=O)NCC[C@H]3CCOC3)nc2)c1	ZINC000450573930	EG	On-Demand	Anodyne	DRD4	43	32
COc1cccc(Oc2ccc(C(=O)NCC[C@@H]3CCOC3)nc2)c1	ZINC000450573931	EG	On-Demand	Anodyne	DRD4	43	32
CCCc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)no1	ZINC000450573932	FI	On-Demand	Anodyne	CACNA1B	42	35
CCCc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)no1	ZINC000450573932	FI	On-Demand	Anodyne	CCR2	49	41
CCCc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)no1	ZINC000450573932	FI	On-Demand	Anodyne	RBP4	20	40
CCCc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)no1	ZINC000450573932	FI	On-Demand	Anodyne	ETHR	52	35
CCCc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)no1	ZINC000450573935	FI	On-Demand	Anodyne	CACNA1B	42	35
CCCc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)no1	ZINC000450573935	FI	On-Demand	Anodyne	CCR2	49	41
CCCc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)no1	ZINC000450573935	FI	On-Demand	Anodyne	RBP4	20	40
CCCc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)no1	ZINC000450573935	FI	On-Demand	Anodyne	ETHR	52	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	SMPD2	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	CTSB	19	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	MMP8	36	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	REN	23	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	CAPN1	45	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	CAPN2	61	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	FPR1	48	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	NPR	43	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450573937	GD	On-Demand	Anodyne	HPN	52	32
CSc1cccc(C(=O)N2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450573940	CH	On-Demand	Anodyne	RHOA	0	43
CSc1cccc(C(=O)N2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450573940	CH	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450573940	CH	On-Demand	Anodyne	L3MBTL3	40	42
CSc1cccc(C(=O)N2CC[C@H](C(C)(C)C)C2)c1	ZINC000450573941	CH	On-Demand	Anodyne	RHOA	0	43
CSc1cccc(C(=O)N2CC[C@H](C(C)(C)C)C2)c1	ZINC000450573941	CH	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CC[C@H](C(C)(C)C)C2)c1	ZINC000450573941	CH	On-Demand	Anodyne	L3MBTL3	40	42
Clc1cccnc1N1CCN(CCc2cscn2)CC1	ZINC000450573942	DF	On-Demand	Anodyne	ABCC1	56	36
COC(=O)c1coc(CN2CCC[C@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)n1	ZINC000450573945	GH	On-Demand	Anodyne	PRCP	17	48
COC(=O)c1coc(CN2CCC[C@@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)n1	ZINC000450573948	GH	On-Demand	Anodyne	PRCP	17	48
CNS(=O)(=O)NCC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000450573961	FC	On-Demand	Anodyne	F10	15	40
CC[C@H](CC(F)(F)F)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450573964	EI	On-Demand	Anodyne	KCNA3	43	36
CC[C@H](CC(F)(F)F)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450573964	EI	On-Demand	Anodyne	ACAT	0	50
CC[C@@H](CC(F)(F)F)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450573968	EI	On-Demand	Anodyne	KCNA3	43	36
CC[C@@H](CC(F)(F)F)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450573968	EI	On-Demand	Anodyne	ACAT	0	50
COC(=O)c1csc(CN2CCC(Oc3ccccn3)CC2)n1	ZINC000450573970	EE	On-Demand	Anodyne	SCN5A	62	35
C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1c1ccnc(N2CCCCC2)n1	ZINC000450573972	EI	On-Demand	Anodyne	SORD	57	38
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](C)C[S@](C)=O)ccc21	ZINC000450573975	GF	On-Demand	Anodyne	PDGFRB	0	43
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](C)C[S@](C)=O)ccc21	ZINC000450573975	GF	On-Demand	Anodyne	PLK1	55	35
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](C)C[S@](C)=O)ccc21	ZINC000450573975	GF	On-Demand	Anodyne	HPGD	46	56
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](C)C[S@@](C)=O)ccc21	ZINC000450573976	GF	On-Demand	Anodyne	PDGFRB	0	43
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](C)C[S@@](C)=O)ccc21	ZINC000450573976	GF	On-Demand	Anodyne	PLK1	55	35
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](C)C[S@@](C)=O)ccc21	ZINC000450573976	GF	On-Demand	Anodyne	HPGD	46	56
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](C)C[S@@](C)=O)ccc21	ZINC000450573977	GF	On-Demand	Anodyne	PDGFRB	0	43
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](C)C[S@@](C)=O)ccc21	ZINC000450573977	GF	On-Demand	Anodyne	PLK1	55	35
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](C)C[S@@](C)=O)ccc21	ZINC000450573977	GF	On-Demand	Anodyne	HPGD	46	56
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](C)C[S@](C)=O)ccc21	ZINC000450573978	GF	On-Demand	Anodyne	PDGFRB	0	43
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](C)C[S@](C)=O)ccc21	ZINC000450573978	GF	On-Demand	Anodyne	PLK1	55	35
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](C)C[S@](C)=O)ccc21	ZINC000450573978	GF	On-Demand	Anodyne	HPGD	46	56
C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1c1ccnc(N2CCCCC2)n1	ZINC000450573980	EI	On-Demand	Anodyne	SORD	57	38
COCCOC[C@@H](O)CN1CCCN(Cc2ccccc2)c2ccccc21	ZINC000450573981	FF	On-Demand	Anodyne	ABCB1	40	37
COCCOC[C@@H](O)CN1CCCN(Cc2ccccc2)c2ccccc21	ZINC000450573981	FF	On-Demand	Anodyne	HSP90AB1	39	40
COCCOC[C@H](O)CN1CCCN(Cc2ccccc2)c2ccccc21	ZINC000450573985	FF	On-Demand	Anodyne	ABCB1	40	37
COCCOC[C@H](O)CN1CCCN(Cc2ccccc2)c2ccccc21	ZINC000450573985	FF	On-Demand	Anodyne	HSP90AB1	39	40
O=C(c1cnc(N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c(Cl)c1)N1CCOCC1	ZINC000450574016	FE	On-Demand	Anodyne	CXCR3	26	43
O=C(NCCCNc1cccc(F)c1)c1cc2n(n1)CCCC2	ZINC000450574046	DF	On-Demand	Anodyne	TBK1	24	43
O=C(C1CCN(Cc2cn(CC3CC3)nn2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450574047	GG	On-Demand	Anodyne	ACHE	30	41
O=C(C1CCN(Cc2cn(CC3CC3)nn2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450574047	GG	On-Demand	Anodyne	SIGMAR1	35	41
O=C(C1CCN(Cc2cn(CC3CC3)nn2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450574047	GG	On-Demand	Anodyne	CCR5	15	41
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	HTR1A	99	43
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	DRD2	84	58
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	DRD4	42	58
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	ADRA1D	57	43
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	ADRA1A	56	43
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	ADRA1B	32	41
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	DRD3	79	58
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	HTR7	59	41
CCc1cc(CCCN2CCN(c3ccccc3OCCN(C)C)CC2)on1	ZINC000450574050	GF	On-Demand	Anodyne	AP2S1	0	40
COc1cccc(OCCC(=O)N[C@H](C)[C@@H](OC)c2ccc(F)cc2)c1	ZINC000450574060	FG	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc(OCCC(=O)N[C@H](C)[C@@H](OC)c2ccc(F)cc2)c1	ZINC000450574060	FG	On-Demand	Anodyne	MTNR1B	29	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H](OC)c2ccc(F)cc2)c1	ZINC000450574061	FG	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H](OC)c2ccc(F)cc2)c1	ZINC000450574061	FG	On-Demand	Anodyne	MTNR1B	29	40
COc1cccc(OCCC(=O)N[C@H](C)[C@H](OC)c2ccc(F)cc2)c1	ZINC000450574062	FG	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc(OCCC(=O)N[C@H](C)[C@H](OC)c2ccc(F)cc2)c1	ZINC000450574062	FG	On-Demand	Anodyne	MTNR1B	29	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@H](OC)c2ccc(F)cc2)c1	ZINC000450574063	FG	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@H](OC)c2ccc(F)cc2)c1	ZINC000450574063	FG	On-Demand	Anodyne	MTNR1B	29	40
Cn1c(C#N)ccc1C(=O)NCCCNc1cccc(F)c1	ZINC000450574064	DE	On-Demand	Mild	KISS1R	43	31
CC(C)N1CCCC[C@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574078	GG	On-Demand	Anodyne	HTR1A	56	41
CC(C)N1CCCC[C@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574078	GG	On-Demand	Anodyne	DRD2	37	40
CC(C)N1CCCC[C@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574078	GG	On-Demand	Anodyne	ADRA1D	43	38
CC(C)N1CCCC[C@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574078	GG	On-Demand	Anodyne	ADRA1A	42	41
CC(C)N1CCCC[C@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574078	GG	On-Demand	Anodyne	ADRA1B	31	41
CC(C)N1CCCC[C@@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574079	GG	On-Demand	Anodyne	HTR1A	56	41
CC(C)N1CCCC[C@@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574079	GG	On-Demand	Anodyne	DRD2	37	40
CC(C)N1CCCC[C@@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574079	GG	On-Demand	Anodyne	ADRA1D	43	38
CC(C)N1CCCC[C@@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574079	GG	On-Demand	Anodyne	ADRA1A	42	41
CC(C)N1CCCC[C@@H]1CN1CCN(c2ccccc2OCCN(C)C)CC1	ZINC000450574079	GG	On-Demand	Anodyne	ADRA1B	31	41
Cn1ncc(Br)c1C(=O)NCCCNc1cccc(F)c1	ZINC000450574084	FF	On-Demand	Anodyne	TBK1	29	49
CC(C)c1nnc(CN2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)s1	ZINC000450574090	GI	On-Demand	Anodyne	CCR5	31	42
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	HTR1A	66	64
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	DRD2	41	59
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	HTR1D	40	49
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	HTR1B	33	49
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	HTR2A	54	53
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	HTR2C	28	44
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	SLC6A4	18	53
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	DRD3	39	44
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	SLC6A3	22	53
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	HTR7	70	45
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	SIGMAR1	30	53
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	NPY2R	40	36
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	ABCB1	41	41
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574091	GG	On-Demand	Anodyne	MCHR1	15	41
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	HTR1A	66	64
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	DRD2	41	59
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	HTR1D	40	49
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	HTR1B	33	49
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	HTR2A	54	53
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	HTR2C	28	44
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	SLC6A4	18	53
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	DRD3	39	44
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	SLC6A3	22	53
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	HTR7	70	45
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	SIGMAR1	30	53
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	NPY2R	40	36
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	ABCB1	41	41
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000450574092	GG	On-Demand	Anodyne	MCHR1	15	41
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450574093	GI	On-Demand	Anodyne	EPHX2	15	48
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450574093	GI	On-Demand	Anodyne	TYK2	55	37
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450574094	GI	On-Demand	Anodyne	EPHX2	15	48
O=C(Nc1ccc(Cl)c(Cl)c1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450574094	GI	On-Demand	Anodyne	TYK2	55	37
CC1(O)CC(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574129	EG	On-Demand	Anodyne	TACR1	33	42
CC1(O)CC(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574129	EG	On-Demand	Anodyne	CACNA1B	58	41
CC1(O)CC(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574129	EG	On-Demand	Anodyne	SLC9A1	42	39
CC1(O)CC(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574129	EG	On-Demand	Anodyne	CCR2	65	39
CC1(O)CC(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574129	EG	On-Demand	Anodyne	SFRP1	58	32
CC1(O)CC(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574129	EG	On-Demand	Anodyne	WNT3	49	31
CC1(O)CC(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574130	EG	On-Demand	Anodyne	TACR1	33	42
CC1(O)CC(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574130	EG	On-Demand	Anodyne	CACNA1B	58	41
CC1(O)CC(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574130	EG	On-Demand	Anodyne	SLC9A1	42	39
CC1(O)CC(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574130	EG	On-Demand	Anodyne	CCR2	65	39
CC1(O)CC(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574130	EG	On-Demand	Anodyne	SFRP1	58	32
CC1(O)CC(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1	ZINC000450574130	EG	On-Demand	Anodyne	WNT3	49	31
N#C[C@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC12CCCC2	ZINC000450574133	FI	On-Demand	Mild	CCR2	50	43
N#C[C@@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC12CCCC2	ZINC000450574134	FI	On-Demand	Mild	CCR2	50	43
N#C[C@@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC12CCCC2	ZINC000450574135	FI	On-Demand	Mild	CCR2	50	43
N#C[C@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC12CCCC2	ZINC000450574136	FI	On-Demand	Mild	CCR2	50	43
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)c1	ZINC000450574148	FG	On-Demand	Anodyne	SLC6A1	88	38
CC(=O)c1cccc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)c1	ZINC000450574148	FG	On-Demand	Anodyne	MAP3K12	21	40
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)c1	ZINC000450574149	FG	On-Demand	Anodyne	SLC6A1	88	38
CC(=O)c1cccc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)c1	ZINC000450574149	FG	On-Demand	Anodyne	MAP3K12	21	40
COC(=O)c1csc(CN2CCN(Cc3cccc(O)c3)CC2)n1	ZINC000450574150	ED	On-Demand	Anodyne	FAAH	21	40
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	HTR1A	18	50
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	DRD2	26	50
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	DRD4	45	39
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	DRD3	0	44
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	TACR1	0	41
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	SSTR5	45	36
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	TACR3	19	41
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	FAAH	21	40
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	MCHR1	25	42
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	MGLL	0	41
COc1cc(CN2CCN(C(=O)c3cccc(O)c3)CC2)ccc1Cl	ZINC000450574157	FG	On-Demand	Anodyne	CCR8	49	46
COc1cc(CN2C(=O)NC3(CCCCCC3)C2=O)ccc1Cl	ZINC000450574159	EG	On-Demand	Anodyne	PDE7A	28	47
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccnn3CC(F)(F)F)C2)c1	ZINC000450574160	FH	On-Demand	Anodyne	ETHR	45	32
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccnn3CC(F)(F)F)C2)c1	ZINC000450574161	FH	On-Demand	Anodyne	ETHR	45	32
COc1ccc(C2(CNC(=O)C3(C(=O)C4CC4)CC3)CCC2)cc1	ZINC000450574166	EF	On-Demand	Anodyne	ACAT	0	52
Cc1cccc(C2=CCN(C(=O)[C@@]3(C)CC=CCC3)CC2)c1	ZINC000450574168	CI	On-Demand	Anodyne	ADAM10	29	46
Cc1cccc(C2=CCN(C(=O)[C@]3(C)CC=CCC3)CC2)c1	ZINC000450574169	CI	On-Demand	Anodyne	ADAM10	29	46
Cc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)nn1C(C)C	ZINC000450574172	FI	On-Demand	Anodyne	CACNA1B	42	36
Cc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)nn1C(C)C	ZINC000450574172	FI	On-Demand	Anodyne	SLC9A1	38	42
Cc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)nn1C(C)C	ZINC000450574172	FI	On-Demand	Anodyne	CCR2	52	43
Cc1cc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)nn1C(C)C	ZINC000450574172	FI	On-Demand	Anodyne	RBP4	21	40
Cc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)nn1C(C)C	ZINC000450574174	FI	On-Demand	Anodyne	CACNA1B	42	36
Cc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)nn1C(C)C	ZINC000450574174	FI	On-Demand	Anodyne	SLC9A1	38	42
Cc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)nn1C(C)C	ZINC000450574174	FI	On-Demand	Anodyne	CCR2	52	43
Cc1cc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)nn1C(C)C	ZINC000450574174	FI	On-Demand	Anodyne	RBP4	21	40
CCSc1cccnc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574186	GJ	On-Demand	Anodyne	CACNA1B	41	34
CCSc1cccnc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574186	GJ	On-Demand	Anodyne	CCR2	69	42
CCSc1cccnc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574186	GJ	On-Demand	Anodyne	MAP3K12	35	40
CCSc1cccnc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574189	GJ	On-Demand	Anodyne	CACNA1B	41	34
CCSc1cccnc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574189	GJ	On-Demand	Anodyne	CCR2	69	42
CCSc1cccnc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574189	GJ	On-Demand	Anodyne	MAP3K12	35	40
CCS(=O)(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450574194	GH	On-Demand	Anodyne	DRD4	17	45
CCS(=O)(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450574194	GH	On-Demand	Anodyne	SSTR5	51	38
CCS(=O)(=O)c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000450574194	GH	On-Demand	Anodyne	CCR2	32	46
Clc1cccnc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450574195	CD	On-Demand	Anodyne	DRD4	40	42
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450574205	FI	On-Demand	Anodyne	MGEA5	22	42
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450574205	FI	On-Demand	Anodyne	HPGD	26	42
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450574205	FI	On-Demand	Anodyne	MAP3K12	37	43
Cc1cccc([C@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450574206	FI	On-Demand	Anodyne	MGEA5	22	42
Cc1cccc([C@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450574206	FI	On-Demand	Anodyne	HPGD	26	42
Cc1cccc([C@H]2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)C2)c1	ZINC000450574206	FI	On-Demand	Anodyne	MAP3K12	37	43
O=C([C@H]1CC1(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574212	DH	On-Demand	Anodyne	CACNA1B	48	36
O=C([C@H]1CC1(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574212	DH	On-Demand	Anodyne	CCR2	62	47
O=C([C@H]1CC1(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574212	DH	On-Demand	Anodyne	RBP4	29	44
COC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1Cl	ZINC000450574213	GI	On-Demand	Anodyne	DRD4	20	43
COC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1Cl	ZINC000450574213	GI	On-Demand	Anodyne	HTR1F	58	36
COC(=O)c1cccc(CN2CCC(c3c[nH]c4ncccc34)CC2)c1Cl	ZINC000450574213	GI	On-Demand	Anodyne	CCR2	35	44
C[C@H](C[S@@](C)=O)N(C)C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450574214	GF	On-Demand	Anodyne	CYP2D6	15	40
C[C@H](C[S@](C)=O)N(C)C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450574215	GF	On-Demand	Anodyne	CYP2D6	15	40
C[C@H](C[S@@](C)=O)N(C)C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450574216	GF	On-Demand	Anodyne	CYP2D6	15	40
O=C([C@@H]1CC1(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574217	DH	On-Demand	Anodyne	CACNA1B	48	36
O=C([C@@H]1CC1(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574217	DH	On-Demand	Anodyne	CCR2	62	47
O=C([C@@H]1CC1(F)F)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574217	DH	On-Demand	Anodyne	RBP4	29	44
C[C@H](C[S@](C)=O)N(C)C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450574218	GF	On-Demand	Anodyne	CYP2D6	15	40
O=C([C@@H]1CC1(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574219	DH	On-Demand	Anodyne	CACNA1B	48	36
O=C([C@@H]1CC1(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574219	DH	On-Demand	Anodyne	CCR2	62	47
O=C([C@@H]1CC1(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574219	DH	On-Demand	Anodyne	RBP4	29	44
O=C([C@H]1CC1(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574221	DH	On-Demand	Anodyne	CACNA1B	48	36
O=C([C@H]1CC1(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574221	DH	On-Demand	Anodyne	CCR2	62	47
O=C([C@H]1CC1(F)F)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574221	DH	On-Demand	Anodyne	RBP4	29	44
CC(C)CC(CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450574238	EF	On-Demand	Anodyne	MMP2	17	49
CC(C)CC(CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450574238	EF	On-Demand	Anodyne	MMP8	43	49
CC(C)CC(CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450574238	EF	On-Demand	Anodyne	MMP9	15	44
CC(C)CC(CC(C)C)C(=O)NCCC(=O)NCc1ccccn1	ZINC000450574238	EF	On-Demand	Anodyne	CAPN2	24	46
O=C(c1ccc(N2CCC2)nc1)N1CCC(Cc2cccnc2)CC1	ZINC000450574246	EF	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc(N2CCC2)nc1)N1CCC(Cc2cccnc2)CC1	ZINC000450574246	EF	On-Demand	Anodyne	SLC6A7	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@@H]1CCOC1	ZINC000450574254	DG	On-Demand	Anodyne	LDLR	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@@H]1CCOC1	ZINC000450574254	DG	On-Demand	Anodyne	CCR2	41	37
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@@H]1CCOC1	ZINC000450574254	DG	On-Demand	Anodyne	LIPG	23	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@H]1CCOC1	ZINC000450574256	DG	On-Demand	Anodyne	LDLR	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@H]1CCOC1	ZINC000450574256	DG	On-Demand	Anodyne	CCR2	41	37
Cc1cc(C(F)(F)F)ccc1C(=O)NCC[C@H]1CCOC1	ZINC000450574256	DG	On-Demand	Anodyne	LIPG	23	40
c1ccc(CCn2ccc(CN3CCC(c4c[nH]c5ncccc45)CC3)n2)cc1	ZINC000450574257	GI	On-Demand	Anodyne	DRD4	19	53
c1ccc(CCn2ccc(CN3CCC(c4c[nH]c5ncccc45)CC3)n2)cc1	ZINC000450574257	GI	On-Demand	Anodyne	CCR2	0	40
COc1ccc(C2(CNC(=O)c3cncc(Cl)c3)CCC2)cc1	ZINC000450574277	EH	On-Demand	Anodyne	DRD4	43	34
COc1ccc(C2(CNC(=O)c3cncc(Cl)c3)CCC2)cc1	ZINC000450574277	EH	On-Demand	Anodyne	KCNA3	46	38
COc1ccc(C2(CNC(=O)c3cncc(Cl)c3)CCC2)cc1	ZINC000450574277	EH	On-Demand	Anodyne	SCN10A	46	36
COc1ccc(C2(CNC(=O)c3cncc(Cl)c3)CCC2)cc1	ZINC000450574277	EH	On-Demand	Anodyne	ACAT	0	47
COc1cccc(OCCC(=O)N[C@@H](CO)c2cccc(Br)c2)c1	ZINC000450574299	GG	On-Demand	Anodyne	MTNR1A	36	48
COc1cccc(OCCC(=O)N[C@@H](CO)c2cccc(Br)c2)c1	ZINC000450574299	GG	On-Demand	Anodyne	MTNR1B	37	48
COc1cccc(OCCC(=O)N[C@@H](CO)c2cccc(Br)c2)c1	ZINC000450574299	GG	On-Demand	Anodyne	GPR88	0	44
COc1cccc(OCCC(=O)N[C@H](CO)c2cccc(Br)c2)c1	ZINC000450574300	GG	On-Demand	Anodyne	MTNR1A	36	48
COc1cccc(OCCC(=O)N[C@H](CO)c2cccc(Br)c2)c1	ZINC000450574300	GG	On-Demand	Anodyne	MTNR1B	37	48
COc1cccc(OCCC(=O)N[C@H](CO)c2cccc(Br)c2)c1	ZINC000450574300	GG	On-Demand	Anodyne	GPR88	0	44
COc1ccc(OC(F)(F)F)c(C(=O)NCCC(=O)NCc2ccccn2)c1	ZINC000450574303	GE	On-Demand	Anodyne	MTNR1B	30	44
Cc1ccc(S(=O)(=O)NCCN2CCN(CC3=CCCCC3)CC2)cc1	ZINC000450574306	GE	On-Demand	Anodyne	HTR7	23	52
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574309	GI	On-Demand	Anodyne	DRD2	59	36
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574309	GI	On-Demand	Anodyne	DRD1	15	46
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574309	GI	On-Demand	Anodyne	SLC6A1	15	40
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574309	GI	On-Demand	Anodyne	CCR3	15	41
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574309	GI	On-Demand	Anodyne	ACKR3	54	37
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574310	GI	On-Demand	Anodyne	DRD2	59	36
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574310	GI	On-Demand	Anodyne	DRD1	15	46
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574310	GI	On-Demand	Anodyne	SLC6A1	15	40
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574310	GI	On-Demand	Anodyne	CCR3	15	41
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450574310	GI	On-Demand	Anodyne	ACKR3	54	37
C[C@H](CN1CCC(c2c[nH]c3ncccc23)CC1)S(C)(=O)=O	ZINC000450574318	DE	On-Demand	Anodyne	CCR2	44	49
C[C@H](CN1CCC(c2c[nH]c3ncccc23)CC1)S(C)(=O)=O	ZINC000450574318	DE	On-Demand	Anodyne	CDC7	43	35
C[C@@H](CN1CCC(c2c[nH]c3ncccc23)CC1)S(C)(=O)=O	ZINC000450574319	DE	On-Demand	Anodyne	CCR2	44	49
C[C@@H](CN1CCC(c2c[nH]c3ncccc23)CC1)S(C)(=O)=O	ZINC000450574319	DE	On-Demand	Anodyne	CDC7	43	35
O=C(N[C@H](CO)c1ccc(Br)cc1)[C@H](O)C1CCC1	ZINC000450574320	ED	On-Demand	Anodyne	SDH1	0	45
O=C(N[C@H](CO)c1ccc(Br)cc1)[C@@H](O)C1CCC1	ZINC000450574321	ED	On-Demand	Anodyne	SDH1	0	45
O=C(N[C@@H](CO)c1ccc(Br)cc1)[C@H](O)C1CCC1	ZINC000450574322	ED	On-Demand	Anodyne	SDH1	0	45
O=C(N[C@@H](CO)c1ccc(Br)cc1)[C@@H](O)C1CCC1	ZINC000450574323	ED	On-Demand	Anodyne	SDH1	0	45
CCc1cc(CCCN2CCC(c3c[nH]c4ncccc34)CC2)on1	ZINC000450574324	EH	On-Demand	Anodyne	CCR2	0	43
O=C1CCC(CN2CCC(c3c[nH]c4ncccc34)CC2)CC1	ZINC000450574329	DH	On-Demand	Anodyne	OPRL1	0	77
O=C1CCC(CN2CCC(c3c[nH]c4ncccc34)CC2)CC1	ZINC000450574329	DH	On-Demand	Anodyne	CCR2	29	57
O=C1CCC(CN2CCC(c3c[nH]c4ncccc34)CC2)CC1	ZINC000450574329	DH	On-Demand	Anodyne	CDC7	51	38
Cc1cnc(N2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450574332	EG	On-Demand	Anodyne	SCD1	21	41
CCS(=O)(=O)c1ccc(Cn2cc(C(F)(F)F)cc(Cl)c2=O)cc1	ZINC000450574344	GG	On-Demand	Anodyne	RORC	56	40
CC(C)(C(=O)NCCCNc1cccc(F)c1)C1CCC1	ZINC000450574361	CH	On-Demand	Anodyne	TBK1	28	48
CCOC(=O)COc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450574368	GG	On-Demand	Anodyne	TSHR	55	33
CCOC(=O)COc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450574368	GG	On-Demand	Anodyne	ADORA2B	28	41
CCOC(=O)COc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450574368	GG	On-Demand	Anodyne	CA9	19	43
CCOC(=O)COc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450574368	GG	On-Demand	Anodyne	PFK	0	43
CCOC(=O)COc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450574368	GG	On-Demand	Anodyne	IMDH_CRYPV	16	41
Cc1ccc(F)c(CSc2nc3nc(C)cc(C)n3n2)c1	ZINC000450574369	DG	On-Demand	Anodyne	DHODH	0	53
C[C@H]1[C@@H](C)N(C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450574370	EE	On-Demand	Anodyne	EPHX2	22	43
C[C@H]1[C@@H](C)N(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1C	ZINC000450574371	EE	On-Demand	Anodyne	EPHX2	22	43
C[C@H]1[C@H](C)N(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1C	ZINC000450574372	EE	On-Demand	Anodyne	EPHX2	22	43
C[C@@H]1[C@@H](C)N(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCN1C	ZINC000450574373	EE	On-Demand	Anodyne	EPHX2	22	43
CCOC(=O)COc1ccc(NC(=O)[C@@H]2C[C@H]2CC)cc1	ZINC000450574378	CF	On-Demand	Anodyne	HDAC8	0	40
CC(C)N(Cc1ccn(CCc2ccccc2)n1)C1CCC1	ZINC000450574384	CH	On-Demand	Anodyne	SLC18A2	33	41
C[C@@H](O)CCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450574385	DD	On-Demand	Bother	KCNJ1	30	45
C[C@H](O)CCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450574386	DD	On-Demand	Bother	KCNJ1	30	45
COc1cccc(OCCC(=O)N(C)[C@H](C)C2CCC2)c1	ZINC000450574397	CG	On-Demand	Anodyne	MTNR1A	31	45
COc1cccc(OCCC(=O)N(C)[C@H](C)C2CCC2)c1	ZINC000450574397	CG	On-Demand	Anodyne	MTNR1B	32	43
COc1cccc(OCCC(=O)N(C)[C@@H](C)C2CCC2)c1	ZINC000450574398	CG	On-Demand	Anodyne	MTNR1A	31	45
COc1cccc(OCCC(=O)N(C)[C@@H](C)C2CCC2)c1	ZINC000450574398	CG	On-Demand	Anodyne	MTNR1B	32	43
CC[C@@H]1C[C@H]1C(=O)NCCCNc1cccc(F)c1	ZINC000450574402	CF	On-Demand	Anodyne	TBK1	39	48
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450574403	FD	On-Demand	Bother	MGLL	0	43
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450574403	FD	On-Demand	Bother	ABHD6	0	41
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450574403	FD	On-Demand	Bother	L3MBTL3	43	39
O=C(C1CCN(CC2CC(F)(F)C2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450574406	FH	On-Demand	Anodyne	SIGMAR1	33	40
O=C(C1CCN(CC2CC(F)(F)C2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450574406	FH	On-Demand	Anodyne	CCR5	38	44
O=C(C1CCN(CC2CC(F)(F)C2)CC1)N(Cc1ccccc1)C1CC1	ZINC000450574406	FH	On-Demand	Anodyne	TACR3	40	34
CCc1nc(CN2CCN(Cc3ccc(Cl)c(OC)c3)CC2)no1	ZINC000450574410	FF	On-Demand	Anodyne	SSTR5	61	41
Cc1cccc([C@@H]2CCN(C(=O)[C@@H]3CCCCC3(F)F)C2)c1	ZINC000450574433	DI	On-Demand	Anodyne	ADAM10	21	45
Cc1cccc([C@H]2CCN(C(=O)[C@@H]3CCCCC3(F)F)C2)c1	ZINC000450574434	DI	On-Demand	Anodyne	ADAM10	21	45
Cc1cccc([C@@H]2CCN(C(=O)[C@H]3CCCCC3(F)F)C2)c1	ZINC000450574435	DI	On-Demand	Anodyne	ADAM10	21	45
Cc1cccc([C@H]2CCN(C(=O)[C@H]3CCCCC3(F)F)C2)c1	ZINC000450574436	DI	On-Demand	Anodyne	ADAM10	21	45
COc1ccc(C2(CNC(=O)c3cc(OC)c(F)cc3[N+](=O)[O-])CCC2)cc1	ZINC000450574437	GH	On-Demand	Bother	KCNA3	51	42
COc1ccc(C2(CNC(=O)c3cc(OC)c(F)cc3[N+](=O)[O-])CCC2)cc1	ZINC000450574437	GH	On-Demand	Bother	NMBR	51	39
COc1ccc(C2(CNC(=O)c3cc(OC)c(F)cc3[N+](=O)[O-])CCC2)cc1	ZINC000450574437	GH	On-Demand	Bother	ACAT	0	44
CS(=O)(=O)c1cccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)c1	ZINC000450574438	GD	On-Demand	Anodyne	TYMS	0	42
CS(=O)(=O)c1cccc(CN2CCCc3ccc(S(N)(=O)=O)cc32)c1	ZINC000450574438	GD	On-Demand	Anodyne	CA7	23	41
Cc1cccc([C@H]2CCN(C(=O)C3(C(=O)C4CC4)CC3)C2)c1	ZINC000450574445	CG	On-Demand	Anodyne	ADAM10	18	44
Cc1cccc([C@@H]2CCN(C(=O)C3(C(=O)C4CC4)CC3)C2)c1	ZINC000450574446	CG	On-Demand	Anodyne	ADAM10	18	44
Cc1ccc(NC(=O)[C@H]2CCCN(Cc3noc(-c4cncc(C)c4)n3)C2)nc1	ZINC000450574449	GF	On-Demand	Anodyne	PDE8B	16	40
Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3noc(-c4cncc(C)c4)n3)C2)nc1	ZINC000450574450	GF	On-Demand	Anodyne	PDE8B	16	40
COCc1nn(C)cc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574461	FG	On-Demand	Anodyne	CACNA1B	57	38
COCc1nn(C)cc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574461	FG	On-Demand	Anodyne	CCR2	44	37
COCc1nn(C)cc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574461	FG	On-Demand	Anodyne	LIPG	49	34
COCc1nn(C)cc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574462	FG	On-Demand	Anodyne	CACNA1B	57	38
COCc1nn(C)cc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574462	FG	On-Demand	Anodyne	CCR2	44	37
COCc1nn(C)cc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574462	FG	On-Demand	Anodyne	LIPG	49	34
Cc1cccc([C@@H]2CCN(C(=O)C[C@H]3COc4ccccc4O3)C2)c1	ZINC000450574463	EH	On-Demand	Anodyne	MGEA5	15	40
Cc1cccc([C@@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C2)c1	ZINC000450574464	EH	On-Demand	Anodyne	MGEA5	15	40
Cc1cccc([C@H]2CCN(C(=O)C[C@H]3COc4ccccc4O3)C2)c1	ZINC000450574465	EH	On-Demand	Anodyne	MGEA5	15	40
Cc1cccc([C@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C2)c1	ZINC000450574466	EH	On-Demand	Anodyne	MGEA5	15	40
COc1ccc(C2(CNC(=O)c3cc(C)n(C(C)C)n3)CCC2)cc1	ZINC000450574471	EH	On-Demand	Anodyne	KCNA3	43	37
COc1ccc(C2(CNC(=O)c3cc(C)n(C(C)C)n3)CCC2)cc1	ZINC000450574471	EH	On-Demand	Anodyne	SOAT1	16	43
COc1ccc(C2(CNC(=O)c3cc(C)n(C(C)C)n3)CCC2)cc1	ZINC000450574471	EH	On-Demand	Anodyne	ACAT	0	49
Cc1cc(C)cc([C@H]2CCN(C(=O)c3cncc(Cl)c3)C2)c1	ZINC000450574475	DH	On-Demand	Anodyne	L3MBTL1	0	41
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cncc(Cl)c3)C2)c1	ZINC000450574476	DH	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCC(Cc3cccnc3)CC2)c(C(C)C)n1	ZINC000450574488	EI	On-Demand	Anodyne	CHRM2	16	43
Cc1ccc(C(=O)N2CCC(Cc3cccnc3)CC2)c(C(C)C)n1	ZINC000450574488	EI	On-Demand	Anodyne	HTR1D	19	41
Cc1ccc(C(=O)N2CCC(Cc3cccnc3)CC2)c(C(C)C)n1	ZINC000450574488	EI	On-Demand	Anodyne	HTR1B	17	41
Cc1ccc(C(=O)N2CCC(Cc3cccnc3)CC2)c(C(C)C)n1	ZINC000450574488	EI	On-Demand	Anodyne	GRIN2B	59	40
Cc1ccc(C(=O)N2CCC(Cc3cccnc3)CC2)c(C(C)C)n1	ZINC000450574488	EI	On-Demand	Anodyne	CHRNA7	48	40
Cc1ccc(C(=O)N2CCC(Cc3cccnc3)CC2)c(C(C)C)n1	ZINC000450574488	EI	On-Demand	Anodyne	C3AR1	48	43
COC(=O)c1cccc(CN2CCN(c3ncccc3Cl)CC2)c1Cl	ZINC000450574489	GG	On-Demand	Anodyne	DRD2	35	46
COC(=O)c1cccc(CN2CCN(c3ncccc3Cl)CC2)c1Cl	ZINC000450574489	GG	On-Demand	Anodyne	DRD4	49	39
COC(=O)c1cccc(CN2CCN(c3ncccc3Cl)CC2)c1Cl	ZINC000450574489	GG	On-Demand	Anodyne	DRD3	47	39
COC(=O)c1cccc(CN2CCN(c3ncccc3Cl)CC2)c1Cl	ZINC000450574489	GG	On-Demand	Anodyne	TRPV1	15	42
COC(=O)c1cccc(CN2CCN(c3ncccc3Cl)CC2)c1Cl	ZINC000450574489	GG	On-Demand	Anodyne	P2RX7	17	43
COC(=O)c1cccc(CN2CCN(c3ncccc3Cl)CC2)c1Cl	ZINC000450574489	GG	On-Demand	Anodyne	G2YM83_BOTF4	43	30
COc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1	ZINC000450574498	DG	On-Demand	Anodyne	TYMS	0	40
COc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1	ZINC000450574498	DG	On-Demand	Anodyne	GSK3B	18	53
COc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1	ZINC000450574498	DG	On-Demand	Anodyne	GSK3A	40	51
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	MME	40	38
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	MMP13	17	42
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	CTSB	16	40
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	KCNA3	42	43
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	TIMP3	50	33
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	NMBR	42	38
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	SOAT1	16	42
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	CAPN2	45	31
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	MMP1	31	42
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	AMP1_PLAFQ	40	33
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	PSMB8	58	35
COc1ccc(C2(CNC(=O)[C@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574503	FG	On-Demand	Anodyne	ACAT	0	56
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	MME	40	38
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	MMP13	17	42
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	CTSB	16	40
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	KCNA3	42	43
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	TIMP3	50	33
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	NMBR	42	38
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	SOAT1	16	42
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	CAPN2	45	31
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	MMP1	31	42
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	AMP1_PLAFQ	40	33
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	PSMB8	58	35
COc1ccc(C2(CNC(=O)[C@@H](Cc3ccccc3)OC)CCC2)cc1	ZINC000450574504	FG	On-Demand	Anodyne	ACAT	0	56
O=C(c1ccccc1O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450574505	EG	On-Demand	Anodyne	DRD2	24	51
O=C(c1ccccc1O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450574505	EG	On-Demand	Anodyne	DRD4	29	41
O=C(c1ccccc1O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450574505	EG	On-Demand	Anodyne	HTR2A	23	42
O=C(c1ccccc1O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450574505	EG	On-Demand	Anodyne	FABI	30	40
O=C(c1ccccc1O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450574505	EG	On-Demand	Anodyne	SIGMAR1	36	51
O=C(c1ccccc1O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450574505	EG	On-Demand	Anodyne	PARP1	45	42
O=C(c1ccccc1O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450574505	EG	On-Demand	Anodyne	DHCR7	0	47
O=C(c1ccccc1O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450574505	EG	On-Demand	Anodyne	KCNJ1	55	38
COc1ccc(-c2nnc(SCC3=CCCCC3)o2)cc1	ZINC000450574513	DI	On-Demand	Anodyne	GSK3B	24	60
COc1ccc(-c2nnc(SCC3=CCCCC3)o2)cc1	ZINC000450574513	DI	On-Demand	Anodyne	GSK3A	52	54
COc1ccc(-c2nnc(SCC3=CCCCC3)o2)cc1	ZINC000450574513	DI	On-Demand	Anodyne	TERT	24	43
COc1ccc(C2(CNC(=O)CCCc3ncc(C)o3)CCC2)cc1	ZINC000450574514	EH	On-Demand	Anodyne	MTNR1A	24	43
COc1ccc(C2(CNC(=O)CCCc3ncc(C)o3)CCC2)cc1	ZINC000450574514	EH	On-Demand	Anodyne	MTNR1B	15	46
COc1ccc(C2(CNC(=O)CCCc3ncc(C)o3)CCC2)cc1	ZINC000450574514	EH	On-Demand	Anodyne	ACAT	0	44
C[C@@H](c1csnn1)N1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000450574526	DE	On-Demand	Mild	PTAFR	42	45
C[C@H](c1csnn1)N1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000450574527	DE	On-Demand	Mild	PTAFR	42	45
C[C@H](c1csnn1)N1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000450574528	DE	On-Demand	Mild	PTAFR	42	45
C[C@@H](c1csnn1)N1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000450574529	DE	On-Demand	Mild	PTAFR	42	45
CCOC(=O)c1cc(C(=O)NCC2(c3ccc(OC)cc3)CCC2)on1	ZINC000450574538	FF	On-Demand	Anodyne	ACAT	0	44
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@H]2CCOC2)c1	ZINC000450574544	EF	On-Demand	Anodyne	NQO2	31	40
COc1ccc(OC(F)(F)F)c(C(=O)NCC[C@@H]2CCOC2)c1	ZINC000450574545	EF	On-Demand	Anodyne	NQO2	31	40
Cc1onc(C2CC2)c1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574547	FJ	On-Demand	Anodyne	CCR2	38	42
Cc1onc(C2CC2)c1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574547	FJ	On-Demand	Anodyne	RBP4	20	40
Cc1onc(C2CC2)c1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574548	FJ	On-Demand	Anodyne	CCR2	38	42
Cc1onc(C2CC2)c1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574548	FJ	On-Demand	Anodyne	RBP4	20	40
O=C(c1cnc(C2CC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574554	FI	On-Demand	Anodyne	CACNA1B	42	36
O=C(c1cnc(C2CC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574554	FI	On-Demand	Anodyne	SLC9A1	42	38
O=C(c1cnc(C2CC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574554	FI	On-Demand	Anodyne	CCR2	63	41
O=C(c1cnc(C2CC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574554	FI	On-Demand	Anodyne	RBP4	26	48
O=C(c1cnc(C2CC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574554	FI	On-Demand	Anodyne	MLYCD	36	40
O=C(c1cnc(C2CC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574554	FI	On-Demand	Anodyne	HPGD	24	42
O=C(c1cnc(C2CC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574554	FI	On-Demand	Anodyne	MAP3K12	42	42
O=C(c1cnc(C2CC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574555	FI	On-Demand	Anodyne	CACNA1B	42	36
O=C(c1cnc(C2CC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574555	FI	On-Demand	Anodyne	SLC9A1	42	38
O=C(c1cnc(C2CC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574555	FI	On-Demand	Anodyne	CCR2	63	41
O=C(c1cnc(C2CC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574555	FI	On-Demand	Anodyne	RBP4	26	48
O=C(c1cnc(C2CC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574555	FI	On-Demand	Anodyne	MLYCD	36	40
O=C(c1cnc(C2CC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574555	FI	On-Demand	Anodyne	HPGD	24	42
O=C(c1cnc(C2CC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574555	FI	On-Demand	Anodyne	MAP3K12	42	42
O=C(N1CCC(Cc2cccnc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450574557	GH	On-Demand	Anodyne	GRIN2B	71	43
O=C(N1CCC(Cc2cccnc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450574557	GH	On-Demand	Anodyne	CHRNA7	49	40
O=C(N1CCC(Cc2cccnc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450574557	GH	On-Demand	Anodyne	C3AR1	48	42
O=C(N1CCC(Cc2cccnc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450574557	GH	On-Demand	Anodyne	ACHP_LYMST	24	40
C=CC(C)(C)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450574559	CG	On-Demand	Mild	NMBR	51	41
C=CC(C)(C)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450574559	CG	On-Demand	Mild	MTNR1A	18	40
C=CC(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574560	DI	On-Demand	Mild	CACNA1B	55	40
C=CC(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574560	DI	On-Demand	Mild	CCR2	74	44
C=CC(C)(C)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574560	DI	On-Demand	Mild	RBP4	32	43
C=CC(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574561	DI	On-Demand	Mild	CACNA1B	55	40
C=CC(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574561	DI	On-Demand	Mild	CCR2	74	44
C=CC(C)(C)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450574561	DI	On-Demand	Mild	RBP4	32	43
CCC(CC)(CCSc1nnc(-c2ccc(OC)cc2)o1)C(=O)OC	ZINC000450574571	FI	On-Demand	Anodyne	GSK3B	15	49
CCC(CC)(CCSc1nnc(-c2ccc(OC)cc2)o1)C(=O)OC	ZINC000450574571	FI	On-Demand	Anodyne	GSK3A	24	43
CCC(CC)(CCSc1nnc(-c2ccc(OC)cc2)o1)C(=O)OC	ZINC000450574571	FI	On-Demand	Anodyne	ALOX15	50	41
Cc1cccc([C@H]2CCN(C(=O)c3cc(F)c(N4CCOCC4)c(F)c3)C2)c1	ZINC000450574572	GH	On-Demand	Anodyne	HPGD	15	41
Cc1cccc([C@@H]2CCN(C(=O)c3cc(F)c(N4CCOCC4)c(F)c3)C2)c1	ZINC000450574573	GH	On-Demand	Anodyne	HPGD	15	41
COC(=O)c1coc(CN2CCc3ccc(O)cc3C2)n1	ZINC000450574578	CD	On-Demand	Anodyne	ABCB1B	40	31
Cc1ccn2ncc(C(=O)N3CC[C@@H](C(C)(C)C)C3)c2c1	ZINC000450574581	CG	On-Demand	Anodyne	EPHB3	25	43
Cc1ccn2ncc(C(=O)N3CC[C@H](C(C)(C)C)C3)c2c1	ZINC000450574582	CG	On-Demand	Anodyne	EPHB3	25	43
CC(C)(C)[C@H]1CCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450574585	EG	On-Demand	Anodyne	PDE4D	15	40
CC(C)(C)[C@@H]1CCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450574586	EG	On-Demand	Anodyne	PDE4D	15	40
CC(C)(C)[C@H]1CCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450574587	EG	On-Demand	Anodyne	PDE4D	15	40
CC(C)(C)[C@@H]1CCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450574588	EG	On-Demand	Anodyne	PDE4D	15	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450574589	DH	On-Demand	Anodyne	CCR1	29	41
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450574589	DH	On-Demand	Anodyne	DPP4	16	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450574590	DH	On-Demand	Anodyne	CCR1	29	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450574590	DH	On-Demand	Anodyne	DPP4	16	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450574591	DH	On-Demand	Anodyne	CCR1	29	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](C(C)(C)C)C1	ZINC000450574591	DH	On-Demand	Anodyne	DPP4	16	42
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450574592	DH	On-Demand	Anodyne	CCR1	29	41
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](C(C)(C)C)C1	ZINC000450574592	DH	On-Demand	Anodyne	DPP4	16	42
O=C(NCC1(Cc2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450574595	EG	On-Demand	Anodyne	HDAC1	26	42
O=C(NCC1(Cc2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450574595	EG	On-Demand	Anodyne	SLC27A1	46	36
Cc1cncc(-c2nc(CN3CCN([C@@H](C#N)c4ccccc4)CC3)no2)c1	ZINC000450574597	FF	On-Demand	Mild	PTAFR	36	43
Cc1cncc(-c2nc(CN3CCN([C@@H](C#N)c4ccccc4)CC3)no2)c1	ZINC000450574597	FF	On-Demand	Mild	ACOX1	33	40
Cc1cncc(-c2nc(CN3CCN([C@H](C#N)c4ccccc4)CC3)no2)c1	ZINC000450574598	FF	On-Demand	Mild	PTAFR	36	43
Cc1cncc(-c2nc(CN3CCN([C@H](C#N)c4ccccc4)CC3)no2)c1	ZINC000450574598	FF	On-Demand	Mild	ACOX1	33	40
Cn1c(C#N)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574599	CD	On-Demand	Mild	SDH1	0	43
Cn1c(C#N)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574600	CD	On-Demand	Mild	SDH1	0	43
COc1ccc(OC(F)(F)F)c(C(=O)N2CCOCC3(CCOCC3)C2)c1	ZINC000450574612	GF	On-Demand	Anodyne	EPHX2	30	40
CNC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450574629	FC	On-Demand	Anodyne	DRD4	45	34
CNC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450574629	FC	On-Demand	Anodyne	HTR7	42	46
CNC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450574629	FC	On-Demand	Anodyne	MTNR1A	57	38
CC[C@@H]1C[C@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574631	CE	On-Demand	Anodyne	PTGFR	29	40
CC[C@@H]1C[C@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574631	CE	On-Demand	Anodyne	AMP1_PLAFQ	54	38
CC[C@@H]1C[C@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574632	CE	On-Demand	Anodyne	PTGFR	29	40
CC[C@@H]1C[C@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574632	CE	On-Demand	Anodyne	AMP1_PLAFQ	54	38
CS(=O)(=O)c1ccc(N2CCC3(CCC(O)CC3)CC2)nc1	ZINC000450574635	DE	On-Demand	Anodyne	GPR119	19	51
FC1(F)CCC[C@H]1CSc1nnc(-c2ccc(Br)cc2)o1	ZINC000450574642	GK	On-Demand	Anodyne	TERT	20	43
FC1(F)CCC[C@@H]1CSc1nnc(-c2ccc(Br)cc2)o1	ZINC000450574643	GK	On-Demand	Anodyne	TERT	20	43
CC[C@](C)(NCc1cccc(C)n1)c1nc(C)cs1	ZINC000450574650	CH	On-Demand	Anodyne	INHA	17	40
CC[C@@](C)(NCc1cccc(C)n1)c1nc(C)cs1	ZINC000450574651	CH	On-Demand	Anodyne	INHA	17	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCOCC2)C1	ZINC000450574653	GH	On-Demand	Anodyne	PRCP	56	35
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCOCC2)C1	ZINC000450574654	GH	On-Demand	Anodyne	PRCP	56	35
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCOCC2)C1	ZINC000450574655	GH	On-Demand	Anodyne	PRCP	56	35
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCOCC2)C1	ZINC000450574656	GH	On-Demand	Anodyne	PRCP	56	35
Cc1nn(C)cc1CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574657	DD	On-Demand	Anodyne	P2RX7	22	40
Cc1nn(C)cc1CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574658	DD	On-Demand	Anodyne	P2RX7	22	40
CCOC(=O)c1sc2ncnc(N3CCC4(CCC(O)CC4)CC3)c2c1C	ZINC000450574674	GH	On-Demand	Anodyne	SIRT3	44	35
O=C(Cc1ccc(O)c(F)c1)NC[C@@H](O)CCc1ccccc1	ZINC000450574675	DE	On-Demand	Anodyne	ADRB2	57	41
O=C(Cc1ccc(O)c(F)c1)NC[C@@H](O)CCc1ccccc1	ZINC000450574675	DE	On-Demand	Anodyne	CAN2	0	49
O=C(Cc1ccc(O)c(F)c1)NC[C@H](O)CCc1ccccc1	ZINC000450574676	DE	On-Demand	Anodyne	ADRB2	57	41
O=C(Cc1ccc(O)c(F)c1)NC[C@H](O)CCc1ccccc1	ZINC000450574676	DE	On-Demand	Anodyne	CAN2	0	49
COc1cc(CC(=O)N2CCOCC3(CCOCC3)C2)ccc1Cl	ZINC000450574685	FF	On-Demand	Anodyne	LRRK2	22	40
CCOC(=O)c1ccc(CN2CCCc3c2cccc3S(N)(=O)=O)nc1	ZINC000450574697	GD	On-Demand	Anodyne	P2RY12	22	40
CC[C@H](C)[C@H](O)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450574701	BD	On-Demand	Anodyne	TPP2	40	38
CC[C@H](C)[C@H](O)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450574702	BD	On-Demand	Anodyne	TPP2	40	38
CC[C@H](C)[C@H](O)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450574703	BD	On-Demand	Anodyne	TPP2	40	38
CC[C@H](C)[C@H](O)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450574704	BD	On-Demand	Anodyne	TPP2	40	38
CC(=O)CCCCCOc1ccccc1C(N)=O	ZINC000450574707	BE	On-Demand	Anodyne	ABCB1	18	41
CC(=O)CCCCCOc1ccccc1C(N)=O	ZINC000450574707	BE	On-Demand	Anodyne	PARP1	0	49
Cc1nsc(N2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450574728	DF	On-Demand	Anodyne	ABCC1	49	34
CSc1cccc(C(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450574755	DG	On-Demand	Anodyne	MMP12	17	43
CSc1cccc(C(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450574756	DG	On-Demand	Anodyne	MMP12	17	43
COc1cc(CN(C)Cc2nc3ccccc3n2C)ccc1Cl	ZINC000450574758	EH	On-Demand	Anodyne	GRM2	16	44
COc1cc(CN(C)Cc2nc3ccccc3n2C)ccc1Cl	ZINC000450574758	EH	On-Demand	Anodyne	ALDH3A1	17	43
Cn1nc(-c2ccccc2)cc1C(=O)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450574759	GH	On-Demand	Anodyne	CTSV	43	31
Cn1nc(-c2ccccc2)cc1C(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450574760	GH	On-Demand	Anodyne	CTSV	43	31
CC(C)c1ncsc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574773	DF	On-Demand	Anodyne	ANPEP	45	32
CC(C)c1ncsc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574773	DF	On-Demand	Anodyne	LAP3	43	34
CC(C)c1ncsc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574773	DF	On-Demand	Anodyne	AMP1_PLAFQ	49	36
CC(C)c1ncsc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574774	DF	On-Demand	Anodyne	ANPEP	45	32
CC(C)c1ncsc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574774	DF	On-Demand	Anodyne	LAP3	43	34
CC(C)c1ncsc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574774	DF	On-Demand	Anodyne	AMP1_PLAFQ	49	36
O=C(NC[C@H](O)CCc1ccccc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450574776	EF	On-Demand	Anodyne	GPBAR1	27	43
O=C(NC[C@@H](O)CCc1ccccc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450574777	EF	On-Demand	Anodyne	GPBAR1	27	43
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450574778	EF	On-Demand	Anodyne	GPBAR1	27	43
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450574779	EF	On-Demand	Anodyne	GPBAR1	27	43
CC(C)c1nccc(N2CCC3(CCC(O)CC3)CC2)n1	ZINC000450574784	CG	On-Demand	Anodyne	SORD	75	42
Cc1cccc(CNC(C)(C)c2nc(C)c(C)s2)n1	ZINC000450574790	CG	On-Demand	Anodyne	NPY1R	23	41
N#CC1(COc2ccccc2C(N)=O)CCC1	ZINC000450574797	BD	On-Demand	Mild	HCN1	40	31
N#CC1(COc2ccccc2C(N)=O)CCC1	ZINC000450574797	BD	On-Demand	Mild	HCN4	40	31
COC(=O)c1csc(CN2CCN(CC3CC3)c3ccccc32)n1	ZINC000450574802	EG	On-Demand	Anodyne	TRPC6	45	33
C[C@@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@H]1CO	ZINC000450574803	ED	On-Demand	Anodyne	PREP	63	36
C[C@@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@H]1CO	ZINC000450574803	ED	On-Demand	Anodyne	THYX_PBCV1	0	42
C[C@@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@@H]1CO	ZINC000450574804	ED	On-Demand	Anodyne	PREP	63	36
C[C@@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@@H]1CO	ZINC000450574804	ED	On-Demand	Anodyne	THYX_PBCV1	0	42
C[C@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@@H]1CO	ZINC000450574805	ED	On-Demand	Anodyne	PREP	63	36
C[C@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@@H]1CO	ZINC000450574805	ED	On-Demand	Anodyne	THYX_PBCV1	0	42
C[C@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@H]1CO	ZINC000450574806	ED	On-Demand	Anodyne	PREP	63	36
C[C@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)[C@H]1CO	ZINC000450574806	ED	On-Demand	Anodyne	THYX_PBCV1	0	42
O=C([C@H]1CCN(c2ccccc2)C1)N1CCOCC2(CCOCC2)C1	ZINC000450574816	EE	On-Demand	Anodyne	AKR1C3	26	43
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCOCC2(CCOCC2)C1	ZINC000450574817	EE	On-Demand	Anodyne	AKR1C3	26	43
Cc1ccc(Br)cc1CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574824	GG	On-Demand	Anodyne	MME	37	43
Cc1ccc(Br)cc1CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574824	GG	On-Demand	Anodyne	ANPEP	40	39
Cc1ccc(Br)cc1CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574824	GG	On-Demand	Anodyne	FURIN	45	32
Cc1ccc(Br)cc1CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574824	GG	On-Demand	Anodyne	AMP1_PLAFQ	45	39
Cc1ccc(Br)cc1CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574825	GG	On-Demand	Anodyne	MME	37	43
Cc1ccc(Br)cc1CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574825	GG	On-Demand	Anodyne	ANPEP	40	39
Cc1ccc(Br)cc1CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574825	GG	On-Demand	Anodyne	FURIN	45	32
Cc1ccc(Br)cc1CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574825	GG	On-Demand	Anodyne	AMP1_PLAFQ	45	39
CCc1cc(CCCN2CCN(C(=O)NC)CC2)on1	ZINC000450574833	CD	On-Demand	Anodyne	PLA2G2A	40	41
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	HTR1A	36	52
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	DRD2	30	52
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	DRD1	18	42
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	DRD4	32	42
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	HTR2A	25	52
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	HTR2C	17	46
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	ADRA1A	15	40
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	HRH1	17	52
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	DRD3	26	52
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	HTR7	50	46
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	SIGMAR1	16	44
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	HTR3B	0	40
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccccc1	ZINC000450574838	FG	On-Demand	Anodyne	CYP2J2	56	39
CC(C)(C)C(=O)Nc1ccc(C(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)cn1	ZINC000450574856	GG	On-Demand	Anodyne	GCK	16	40
CC(C)(C)C(=O)Nc1ccc(C(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)cn1	ZINC000450574857	GG	On-Demand	Anodyne	GCK	16	40
C[C@@H]1CCCN(C(=O)CCCC(=O)C(C)(C)C)[C@@H]1CO	ZINC000450574871	CE	On-Demand	Anodyne	PREP	15	41
C[C@@H]1CCCN(C(=O)CCCC(=O)C(C)(C)C)[C@H]1CO	ZINC000450574872	CE	On-Demand	Anodyne	PREP	15	41
C[C@H]1CCCN(C(=O)CCCC(=O)C(C)(C)C)[C@@H]1CO	ZINC000450574873	CE	On-Demand	Anodyne	PREP	15	41
C[C@H]1CCCN(C(=O)CCCC(=O)C(C)(C)C)[C@H]1CO	ZINC000450574874	CE	On-Demand	Anodyne	PREP	15	41
CCc1nc(C)c(COc2ccc(Br)cc2C(C)=O)o1	ZINC000450574879	EI	On-Demand	Anodyne	SLC22A12	57	34
COc1ccc(CNC(=O)CCNC(C)(C)c2nc(C)c(C)s2)c(OC)c1	ZINC000450574902	GG	On-Demand	Anodyne	MTNR1A	41	35
COCCOC[C@@H](O)CN1CCN(CC2CC2)c2ccccc21	ZINC000450574923	DD	On-Demand	Anodyne	HSP90AB1	39	41
COCCOC[C@H](O)CN1CCN(CC2CC2)c2ccccc21	ZINC000450574924	DD	On-Demand	Anodyne	HSP90AB1	39	41
CC(=O)c1cc(Cl)ccc1OCc1ccn(CC(F)(F)F)n1	ZINC000450574959	EH	On-Demand	Anodyne	PTGER1	55	38
CC(C)OC(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574967	CE	On-Demand	Anodyne	CTRB1	25	40
CC(C)OC(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574967	CE	On-Demand	Anodyne	MMP3	45	39
CC(C)OC(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574967	CE	On-Demand	Anodyne	CELA2A	22	40
CC(C)OC(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574967	CE	On-Demand	Anodyne	CAPN2	41	31
CC(C)OC(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574967	CE	On-Demand	Anodyne	NPR	57	33
CC(C)OC(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450574967	CE	On-Demand	Anodyne	AMP1_PLAFQ	45	40
CC(C)OC(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574968	CE	On-Demand	Anodyne	CTRB1	25	40
CC(C)OC(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574968	CE	On-Demand	Anodyne	MMP3	45	39
CC(C)OC(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574968	CE	On-Demand	Anodyne	CELA2A	22	40
CC(C)OC(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574968	CE	On-Demand	Anodyne	CAPN2	41	31
CC(C)OC(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574968	CE	On-Demand	Anodyne	NPR	57	33
CC(C)OC(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450574968	CE	On-Demand	Anodyne	AMP1_PLAFQ	45	40
Cc1cc(N2CCC3(CCC(O)CC3)CC2)c2ccccc2n1	ZINC000450574971	DI	On-Demand	Anodyne	HTR1D	45	36
Cc1cc(N2CCC3(CCC(O)CC3)CC2)c2ccccc2n1	ZINC000450574971	DI	On-Demand	Anodyne	ADAM17	52	36
Cn1c(SCCC(C)(F)F)nnc1-c1ccc(Cl)cc1	ZINC000450574974	DI	On-Demand	Anodyne	DRD2	0	44
Cn1c(SCCC(C)(F)F)nnc1-c1ccc(Cl)cc1	ZINC000450574974	DI	On-Demand	Anodyne	DRD3	23	44
Cn1c(SCCC(C)(F)F)nnc1-c1ccc(Cl)cc1	ZINC000450574974	DI	On-Demand	Anodyne	KCNH2	25	44
Cn1c(SCCC(C)(F)F)nnc1-c1ccc(Cl)cc1	ZINC000450574974	DI	On-Demand	Anodyne	HSD11B1	30	43
CCc1nc(C)c(CSc2nnc(-c3ccc(Br)cc3)o2)o1	ZINC000450574997	GJ	On-Demand	Anodyne	GSK3B	18	41
CCc1nc(C)c(CSc2nnc(-c3ccc(Br)cc3)o2)o1	ZINC000450574997	GJ	On-Demand	Anodyne	GSK3A	44	39
CCc1nc(C)c(CSc2nnc(-c3ccc(Br)cc3)o2)o1	ZINC000450574997	GJ	On-Demand	Anodyne	TERT	24	46
COc1cccc(OCCC(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)c1	ZINC000450574998	FG	On-Demand	Anodyne	MTNR1A	21	41
COc1cccc(OCCC(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)c1	ZINC000450574999	FG	On-Demand	Anodyne	MTNR1A	21	41
CC(=O)c1cccc(CN(C)Cc2nc3ccccc3n2C)c1	ZINC000450575001	DG	On-Demand	Anodyne	MAOA	17	43
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450575011	GH	On-Demand	Anodyne	TACR1	15	42
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450575012	GH	On-Demand	Anodyne	TACR1	15	42
COC(=O)[C@@H]1COCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450575024	FC	On-Demand	Anodyne	MTNR1A	44	37
COC(=O)[C@H]1COCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450575025	FC	On-Demand	Anodyne	MTNR1A	44	37
O=c1c(Cl)c(N2CCC3(CCC(O)CC3)CC2)cnn1Cc1ccccc1	ZINC000450575039	GG	On-Demand	Anodyne	AADAT	15	43
O=c1c(Cl)c(N2CCC3(CCC(O)CC3)CC2)cnn1Cc1ccccc1	ZINC000450575039	GG	On-Demand	Anodyne	MRGPRX1	30	40
CC(F)(F)C(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575054	CF	On-Demand	Anodyne	SDH1	0	42
CC(F)(F)C(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575054	CF	On-Demand	Anodyne	POL	0	40
CC(F)(F)C(C)(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575054	CF	On-Demand	Anodyne	AMP1_PLAFQ	47	39
CC(F)(F)C(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575055	CF	On-Demand	Anodyne	SDH1	0	42
CC(F)(F)C(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575055	CF	On-Demand	Anodyne	POL	0	40
CC(F)(F)C(C)(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575055	CF	On-Demand	Anodyne	AMP1_PLAFQ	47	39
CCc1cc(Nc2cn(C)nc2C2CCCCC2)n2ncnc2n1	ZINC000450575063	EG	On-Demand	Anodyne	DHOD	0	48
CC(=O)CCCCCSc1nnc(-c2ccc(Cl)cc2)n1C	ZINC000450575065	EI	On-Demand	Anodyne	DRD3	17	46
CC(=O)CCCCCSc1nnc(-c2ccc(Cl)cc2)n1C	ZINC000450575065	EI	On-Demand	Anodyne	KCNH2	16	46
CC(=O)CCCCCSc1nnc(-c2ccc(Cl)cc2)n1C	ZINC000450575065	EI	On-Demand	Anodyne	HSD11B1	15	41
CN1CCC[C@H]1C(=O)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450575092	DD	On-Demand	Anodyne	PREP	52	35
CN1CCC[C@H]1C(=O)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450575092	DD	On-Demand	Anodyne	BRCA1	44	32
CN1CCC[C@@H]1C(=O)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450575093	DD	On-Demand	Anodyne	PREP	52	35
CN1CCC[C@@H]1C(=O)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450575093	DD	On-Demand	Anodyne	BRCA1	44	32
CN1CCC[C@H]1C(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450575094	DD	On-Demand	Anodyne	PREP	52	35
CN1CCC[C@H]1C(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450575094	DD	On-Demand	Anodyne	BRCA1	44	32
CN1CCC[C@@H]1C(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450575095	DD	On-Demand	Anodyne	PREP	52	35
CN1CCC[C@@H]1C(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450575095	DD	On-Demand	Anodyne	BRCA1	44	32
C[C@H](O)CCSc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2	ZINC000450575108	GH	On-Demand	Anodyne	EDNRB	18	40
C[C@H](O)CCSc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2	ZINC000450575108	GH	On-Demand	Anodyne	EDNRA	23	40
C[C@@H](O)CCSc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2	ZINC000450575109	GH	On-Demand	Anodyne	EDNRB	18	40
C[C@@H](O)CCSc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2	ZINC000450575109	GH	On-Demand	Anodyne	EDNRA	23	40
Cn1cc(-c2ccc(C(=O)NC[C@@H](O)CCc3ccccc3)o2)cn1	ZINC000450575111	EE	On-Demand	Anodyne	MMP13	19	42
Cn1cc(-c2ccc(C(=O)NC[C@H](O)CCc3ccccc3)o2)cn1	ZINC000450575112	EE	On-Demand	Anodyne	MMP13	19	42
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575123	GG	On-Demand	Anodyne	PPARG	17	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575123	GG	On-Demand	Anodyne	PPARA	20	44
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575123	GG	On-Demand	Anodyne	PPARD	25	44
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575123	GG	On-Demand	Anodyne	ABCB1	44	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575123	GG	On-Demand	Anodyne	KCNK3	26	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575123	GG	On-Demand	Anodyne	KCNK9	25	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575124	GG	On-Demand	Anodyne	PPARG	17	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575124	GG	On-Demand	Anodyne	PPARA	20	44
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575124	GG	On-Demand	Anodyne	PPARD	25	44
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575124	GG	On-Demand	Anodyne	ABCB1	44	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575124	GG	On-Demand	Anodyne	KCNK3	26	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575124	GG	On-Demand	Anodyne	KCNK9	25	40
C[C@@H](CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1nccs1	ZINC000450575125	FJ	On-Demand	Anodyne	GPR88	0	42
Brc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450575126	FI	On-Demand	Anodyne	GSK3A	40	36
Brc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450575126	FI	On-Demand	Anodyne	TERT	23	47
Brc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450575127	FI	On-Demand	Anodyne	GSK3A	40	36
Brc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450575127	FI	On-Demand	Anodyne	TERT	23	47
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	ADRB1	25	43
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	PPARG	23	41
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	ADRB3	29	42
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	CNR2	33	46
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	KCNA3	35	40
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	ABCB1	30	42
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	HCRTR2	16	44
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	PTGES	25	42
CCCOc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575133	FG	On-Demand	Anodyne	PDS	41	32
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	ADRB1	25	43
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	PPARG	23	41
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	ADRB3	29	42
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	CNR2	33	46
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	KCNA3	35	40
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	ABCB1	30	42
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	HCRTR2	16	44
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	PTGES	25	42
CCCOc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(OC)c1	ZINC000450575134	FG	On-Demand	Anodyne	PDS	41	32
COC(=O)c1ccc(CC(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)cc1	ZINC000450575139	FF	On-Demand	Anodyne	CCR5	15	48
COC(=O)c1ccc(CC(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)cc1	ZINC000450575140	FF	On-Demand	Anodyne	CCR5	15	48
COc1cccc([C@@H]2C[C@H]2C(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)c1	ZINC000450575141	FH	On-Demand	Anodyne	GPR88	0	48
COc1cccc([C@@H]2C[C@H]2C(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)c1	ZINC000450575142	FH	On-Demand	Anodyne	GPR88	0	48
CNC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450575152	FE	On-Demand	Anodyne	DRD4	16	44
CNC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450575152	FE	On-Demand	Anodyne	HTR2A	18	44
CNC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450575152	FE	On-Demand	Anodyne	DRD3	17	44
CNC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450575152	FE	On-Demand	Anodyne	HTR7	15	41
CNC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450575152	FE	On-Demand	Anodyne	HDAC8	19	43
CNC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450575152	FE	On-Demand	Anodyne	CYP2J2	60	43
C[C@@H](CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1nccs1	ZINC000450575154	FJ	On-Demand	Anodyne	RBP4	48	41
CCc1c(C(=O)NC[C@@H](O)CCc2ccccc2)oc2ccccc12	ZINC000450575156	EH	On-Demand	Anodyne	MTNR1A	20	43
CCc1c(C(=O)NC[C@@H](O)CCc2ccccc2)oc2ccccc12	ZINC000450575156	EH	On-Demand	Anodyne	MTNR1B	23	43
CCc1c(C(=O)NC[C@H](O)CCc2ccccc2)oc2ccccc12	ZINC000450575157	EH	On-Demand	Anodyne	MTNR1A	20	43
CCc1c(C(=O)NC[C@H](O)CCc2ccccc2)oc2ccccc12	ZINC000450575157	EH	On-Demand	Anodyne	MTNR1B	23	43
CN(Cc1nc2ccccc2n1C)CC1CC(F)(F)C1	ZINC000450575168	CG	On-Demand	Anodyne	GRM2	15	41
CCOC(=O)c1cc(C(=O)NC[C@H](O)CCc2ccccc2)on1	ZINC000450575169	ED	On-Demand	Anodyne	CAPN2	54	32
CCOC(=O)c1cc(C(=O)NC[C@@H](O)CCc2ccccc2)on1	ZINC000450575170	ED	On-Demand	Anodyne	CAPN2	54	32
COc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575174	GD	On-Demand	Anodyne	CYSLTR1	47	34
COc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575174	GD	On-Demand	Anodyne	ADRB3	17	43
COc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575174	GD	On-Demand	Anodyne	COLA	48	37
COc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575174	GD	On-Demand	Anodyne	CPT1A	49	34
COc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575174	GD	On-Demand	Anodyne	ITGAV	45	45
COc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575175	GD	On-Demand	Anodyne	CYSLTR1	47	34
COc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575175	GD	On-Demand	Anodyne	ADRB3	17	43
COc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575175	GD	On-Demand	Anodyne	COLA	48	37
COc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575175	GD	On-Demand	Anodyne	CPT1A	49	34
COc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)cc1S(C)(=O)=O	ZINC000450575175	GD	On-Demand	Anodyne	ITGAV	45	45
NC(=O)c1ccccc1OC[C@H]1CCCC1(F)F	ZINC000450575176	CF	On-Demand	Anodyne	PARP1	26	44
NC(=O)c1ccccc1OC[C@H]1CCCC1(F)F	ZINC000450575176	CF	On-Demand	Anodyne	HCN1	42	33
NC(=O)c1ccccc1OC[C@H]1CCCC1(F)F	ZINC000450575176	CF	On-Demand	Anodyne	HCN4	43	34
NC(=O)c1ccccc1OC[C@@H]1CCCC1(F)F	ZINC000450575177	CF	On-Demand	Anodyne	PARP1	26	44
NC(=O)c1ccccc1OC[C@@H]1CCCC1(F)F	ZINC000450575177	CF	On-Demand	Anodyne	HCN1	42	33
NC(=O)c1ccccc1OC[C@@H]1CCCC1(F)F	ZINC000450575177	CF	On-Demand	Anodyne	HCN4	43	34
CCCc1nc(C)c(CSc2nnc(-c3ccc(Br)cc3)o2)o1	ZINC000450575184	GK	On-Demand	Anodyne	GSK3B	18	40
CCCc1nc(C)c(CSc2nnc(-c3ccc(Br)cc3)o2)o1	ZINC000450575184	GK	On-Demand	Anodyne	GSK3A	43	38
CCCc1nc(C)c(CSc2nnc(-c3ccc(Br)cc3)o2)o1	ZINC000450575184	GK	On-Demand	Anodyne	TERT	23	44
CC1(O)CC(C(=O)NC[C@@H](O)CCc2ccccc2)C1	ZINC000450575192	CD	On-Demand	Anodyne	SDH1	0	42
CC1(O)CC(C(=O)NC[C@H](O)CCc2ccccc2)C1	ZINC000450575193	CD	On-Demand	Anodyne	SDH1	0	42
CC[C@@H](C)[C@@H](O)C(=O)NCc1cccc(-c2ncc[nH]2)c1	ZINC000450575194	CE	On-Demand	Anodyne	ACE2	44	39
CC[C@@H](C)[C@@H](O)C(=O)NCc1cccc(-c2ncc[nH]2)c1	ZINC000450575194	CE	On-Demand	Anodyne	PDS	42	33
CC[C@H](C)[C@H](O)C(=O)NCc1cccc(-c2ncc[nH]2)c1	ZINC000450575195	CE	On-Demand	Anodyne	ACE2	44	39
CC[C@H](C)[C@H](O)C(=O)NCc1cccc(-c2ncc[nH]2)c1	ZINC000450575195	CE	On-Demand	Anodyne	PDS	42	33
CC[C@@H](C)[C@H](O)C(=O)NCc1cccc(-c2ncc[nH]2)c1	ZINC000450575196	CE	On-Demand	Anodyne	ACE2	44	39
CC[C@@H](C)[C@H](O)C(=O)NCc1cccc(-c2ncc[nH]2)c1	ZINC000450575196	CE	On-Demand	Anodyne	PDS	42	33
CC[C@H](C)[C@@H](O)C(=O)NCc1cccc(-c2ncc[nH]2)c1	ZINC000450575197	CE	On-Demand	Anodyne	ACE2	44	39
CC[C@H](C)[C@@H](O)C(=O)NCc1cccc(-c2ncc[nH]2)c1	ZINC000450575197	CE	On-Demand	Anodyne	PDS	42	33
COc1cccc(-n2cc(C(=O)N(Cc3ccccc3)[C@@H](CO)C3CC3)nn2)c1	ZINC000450575211	GF	On-Demand	Anodyne	ESRRA	21	40
COc1cccc(-n2cc(C(=O)N(Cc3ccccc3)[C@H](CO)C3CC3)nn2)c1	ZINC000450575212	GF	On-Demand	Anodyne	ESRRA	21	40
N#Cc1cc(N2CCC3(CCC(O)CC3)CC2)ccc1C(F)(F)F	ZINC000450575216	EI	On-Demand	Mild	AR	26	47
COc1cc(CC(=O)N2CCC[C@H](C)[C@@H]2CO)ccc1O	ZINC000450575219	CD	On-Demand	Anodyne	OPRK1	32	43
COc1cc(CC(=O)N2CCC[C@H](C)[C@@H]2CO)ccc1O	ZINC000450575219	CD	On-Demand	Anodyne	TRPV1	19	43
COc1cc(CC(=O)N2CCC[C@H](C)[C@@H]2CO)ccc1O	ZINC000450575219	CD	On-Demand	Anodyne	SHBG	18	40
COc1cc(CC(=O)N2CCC[C@@H](C)[C@H]2CO)ccc1O	ZINC000450575220	CD	On-Demand	Anodyne	OPRK1	32	43
COc1cc(CC(=O)N2CCC[C@@H](C)[C@H]2CO)ccc1O	ZINC000450575220	CD	On-Demand	Anodyne	TRPV1	19	43
COc1cc(CC(=O)N2CCC[C@@H](C)[C@H]2CO)ccc1O	ZINC000450575220	CD	On-Demand	Anodyne	SHBG	18	40
COc1cc(CC(=O)N2CCC[C@H](C)[C@H]2CO)ccc1O	ZINC000450575221	CD	On-Demand	Anodyne	OPRK1	32	43
COc1cc(CC(=O)N2CCC[C@H](C)[C@H]2CO)ccc1O	ZINC000450575221	CD	On-Demand	Anodyne	TRPV1	19	43
COc1cc(CC(=O)N2CCC[C@H](C)[C@H]2CO)ccc1O	ZINC000450575221	CD	On-Demand	Anodyne	SHBG	18	40
COc1cc(CC(=O)N2CCC[C@@H](C)[C@@H]2CO)ccc1O	ZINC000450575222	CD	On-Demand	Anodyne	OPRK1	32	43
COc1cc(CC(=O)N2CCC[C@@H](C)[C@@H]2CO)ccc1O	ZINC000450575222	CD	On-Demand	Anodyne	TRPV1	19	43
COc1cc(CC(=O)N2CCC[C@@H](C)[C@@H]2CO)ccc1O	ZINC000450575222	CD	On-Demand	Anodyne	SHBG	18	40
O=C(c1cnc(N2CCC3(CCC(O)CC3)CC2)c(Cl)c1)N1CCOCC1	ZINC000450575245	GF	On-Demand	Anodyne	LRRK2	19	40
N#Cc1ccc(N2CCC3(CCC(O)CC3)CC2)cc1C(F)(F)F	ZINC000450575252	EI	On-Demand	Mild	AR	34	49
CS(=O)(=O)c1ccc(N2CCC3(CCC(O)CC3)CC2)cc1	ZINC000450575282	DF	On-Demand	Anodyne	GPR119	18	46
Cc1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)c(Cl)c1Cl	ZINC000450575287	FI	On-Demand	Anodyne	MME	33	44
Cc1ccc(C(=O)NC[C@H](O)CCc2ccccc2)c(Cl)c1Cl	ZINC000450575288	FI	On-Demand	Anodyne	MME	33	44
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450575302	EF	On-Demand	Anodyne	XPNPEP1	0	41
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450575302	EF	On-Demand	Anodyne	XPNPEP2	0	41
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450575302	EF	On-Demand	Anodyne	FKBP12.6	0	42
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450575302	EF	On-Demand	Anodyne	POL	0	40
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450575303	EF	On-Demand	Anodyne	XPNPEP1	0	41
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450575303	EF	On-Demand	Anodyne	XPNPEP2	0	41
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450575303	EF	On-Demand	Anodyne	FKBP12.6	0	42
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450575303	EF	On-Demand	Anodyne	POL	0	40
O=C(NC[C@@H](O)CCc1ccccc1)[C@H]1CCCCN1C1CCCC1	ZINC000450575304	EF	On-Demand	Anodyne	XPNPEP1	0	41
O=C(NC[C@@H](O)CCc1ccccc1)[C@H]1CCCCN1C1CCCC1	ZINC000450575304	EF	On-Demand	Anodyne	XPNPEP2	0	41
O=C(NC[C@@H](O)CCc1ccccc1)[C@H]1CCCCN1C1CCCC1	ZINC000450575304	EF	On-Demand	Anodyne	FKBP12.6	0	42
O=C(NC[C@@H](O)CCc1ccccc1)[C@H]1CCCCN1C1CCCC1	ZINC000450575304	EF	On-Demand	Anodyne	POL	0	40
O=C(NC[C@H](O)CCc1ccccc1)[C@H]1CCCCN1C1CCCC1	ZINC000450575305	EF	On-Demand	Anodyne	XPNPEP1	0	41
O=C(NC[C@H](O)CCc1ccccc1)[C@H]1CCCCN1C1CCCC1	ZINC000450575305	EF	On-Demand	Anodyne	XPNPEP2	0	41
O=C(NC[C@H](O)CCc1ccccc1)[C@H]1CCCCN1C1CCCC1	ZINC000450575305	EF	On-Demand	Anodyne	FKBP12.6	0	42
O=C(NC[C@H](O)CCc1ccccc1)[C@H]1CCCCN1C1CCCC1	ZINC000450575305	EF	On-Demand	Anodyne	POL	0	40
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@H]2C(=O)OC)cc1	ZINC000450575307	FF	On-Demand	Anodyne	MMP26	0	43
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@H]2C(=O)OC)cc1	ZINC000450575307	FF	On-Demand	Anodyne	MMP15	0	43
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@H]2C(=O)OC)cc1	ZINC000450575307	FF	On-Demand	Anodyne	MMP16	0	43
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@H]2C(=O)OC)cc1	ZINC000450575307	FF	On-Demand	Anodyne	MMP1	27	42
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@H]2C(=O)OC)cc1	ZINC000450575307	FF	On-Demand	Anodyne	NOD2	40	35
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@@H]2C(=O)OC)cc1	ZINC000450575308	FF	On-Demand	Anodyne	MMP26	0	43
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@@H]2C(=O)OC)cc1	ZINC000450575308	FF	On-Demand	Anodyne	MMP15	0	43
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@@H]2C(=O)OC)cc1	ZINC000450575308	FF	On-Demand	Anodyne	MMP16	0	43
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@@H]2C(=O)OC)cc1	ZINC000450575308	FF	On-Demand	Anodyne	MMP1	27	42
CCS(=O)(=O)c1ccc(CN2CCc3ccccc3[C@@H]2C(=O)OC)cc1	ZINC000450575308	FF	On-Demand	Anodyne	NOD2	40	35
CCS(=O)(=O)c1ccc(CN(CC(=O)N(C)C)c2ccccc2)cc1	ZINC000450575311	FF	On-Demand	Anodyne	LIMK2	40	42
O=C(CCCC(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450575313	DE	On-Demand	Anodyne	PTGFR	35	44
O=C(CCCC(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450575313	DE	On-Demand	Anodyne	HDAC8	16	44
O=C(CCCC(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450575313	DE	On-Demand	Anodyne	HDAC10	27	40
O=C(CCCC(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450575313	DE	On-Demand	Anodyne	HDAC2	19	40
O=C(CCCC(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450575313	DE	On-Demand	Anodyne	HDAC6	17	40
O=C(CCCC(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450575313	DE	On-Demand	Anodyne	ABCB1	46	38
O=C(CCCC(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450575313	DE	On-Demand	Anodyne	HDAC11	24	40
O=C(CCCC(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450575313	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	34
O=C(CCCC(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450575314	DE	On-Demand	Anodyne	PTGFR	35	44
O=C(CCCC(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450575314	DE	On-Demand	Anodyne	HDAC8	16	44
O=C(CCCC(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450575314	DE	On-Demand	Anodyne	HDAC10	27	40
O=C(CCCC(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450575314	DE	On-Demand	Anodyne	HDAC2	19	40
O=C(CCCC(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450575314	DE	On-Demand	Anodyne	HDAC6	17	40
O=C(CCCC(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450575314	DE	On-Demand	Anodyne	ABCB1	46	38
O=C(CCCC(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450575314	DE	On-Demand	Anodyne	HDAC11	24	40
O=C(CCCC(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450575314	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	34
Cc1nc(-c2c(C)noc2C)sc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575323	GG	On-Demand	Anodyne	SCD1	24	48
Cc1nc(-c2c(C)noc2C)sc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575323	GG	On-Demand	Anodyne	SCD	21	43
Cc1nc(-c2c(C)noc2C)sc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575324	GG	On-Demand	Anodyne	SCD1	24	48
Cc1nc(-c2c(C)noc2C)sc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575324	GG	On-Demand	Anodyne	SCD	21	43
CCc1cc2c(N3CCC4(CCC(O)CC4)CC3)ncnc2s1	ZINC000450575341	EH	On-Demand	Anodyne	SIRT3	45	31
C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C)[C@@H]1CO	ZINC000450575345	BC	On-Demand	Anodyne	PREP	50	34
C[C@@H]1CCCN(C(=O)[C@H]2CCCN2C)[C@@H]1CO	ZINC000450575346	BC	On-Demand	Anodyne	PREP	50	34
C[C@@H]1CCCN(C(=O)[C@H]2CCCN2C)[C@H]1CO	ZINC000450575347	BC	On-Demand	Anodyne	PREP	50	34
C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C)[C@H]1CO	ZINC000450575348	BC	On-Demand	Anodyne	PREP	50	34
C[C@@H](O)CCCn1cnc2c(Cl)cc(Cl)cc2c1=O	ZINC000450575352	DF	On-Demand	Anodyne	DNAE	44	43
C[C@H](O)CCCn1cnc2c(Cl)cc(Cl)cc2c1=O	ZINC000450575353	DF	On-Demand	Anodyne	DNAE	44	43
NS(=O)(=O)c1cccc2c1CCCN2CCCC(=O)c1ccccc1	ZINC000450575366	FF	On-Demand	Anodyne	CYP2J2	50	37
O=C(NC[C@@H](O)CCc1ccccc1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450575367	GF	On-Demand	Anodyne	PDE8B	46	31
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450575368	GF	On-Demand	Anodyne	PDE8B	46	31
O=C(NC[C@H](O)CCc1ccccc1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450575369	GF	On-Demand	Anodyne	PDE8B	46	31
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450575370	GF	On-Demand	Anodyne	PDE8B	46	31
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC)CC2)cc1	ZINC000450575371	EC	On-Demand	Anodyne	RORC	56	33
C[C@H]1CCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)[C@H]1CO	ZINC000450575400	EF	On-Demand	Anodyne	OPRK1	22	40
C[C@H]1CCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)[C@@H]1CO	ZINC000450575401	EF	On-Demand	Anodyne	OPRK1	22	40
C[C@@H]1CCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)[C@H]1CO	ZINC000450575402	EF	On-Demand	Anodyne	OPRK1	22	40
C[C@@H]1CCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)[C@@H]1CO	ZINC000450575403	EF	On-Demand	Anodyne	OPRK1	22	40
FC1(F)CC(CSc2nnc(-c3ccc(Br)cc3)o2)C1	ZINC000450575425	FJ	On-Demand	Anodyne	TERT	22	45
C[C@H]1CCCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)[C@@H]1CO	ZINC000450575436	DE	On-Demand	Anodyne	TRPC6	45	33
C[C@@H]1CCCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)[C@H]1CO	ZINC000450575437	DE	On-Demand	Anodyne	TRPC6	45	33
C[C@@H]1CCCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)[C@@H]1CO	ZINC000450575438	DE	On-Demand	Anodyne	TRPC6	45	33
C[C@H]1CCCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)[C@H]1CO	ZINC000450575439	DE	On-Demand	Anodyne	TRPC6	45	33
CC(=O)CCCCCSc1nnc(-c2ccc(Br)cc2)o1	ZINC000450575446	FJ	On-Demand	Anodyne	TERT	21	42
C[C@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)[C@H]1CO	ZINC000450575448	CF	On-Demand	Anodyne	PREP	57	38
C[C@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)[C@@H]1CO	ZINC000450575449	CF	On-Demand	Anodyne	PREP	57	38
C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)[C@H]1CO	ZINC000450575450	CF	On-Demand	Anodyne	PREP	57	38
C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)[C@@H]1CO	ZINC000450575451	CF	On-Demand	Anodyne	PREP	57	38
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575452	DG	On-Demand	Anodyne	MME	35	42
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575452	DG	On-Demand	Anodyne	ANPEP	46	35
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575452	DG	On-Demand	Anodyne	LAP3	44	35
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575453	DG	On-Demand	Anodyne	MME	35	42
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575453	DG	On-Demand	Anodyne	ANPEP	46	35
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450575453	DG	On-Demand	Anodyne	LAP3	44	35
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575454	DG	On-Demand	Anodyne	MME	35	42
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575454	DG	On-Demand	Anodyne	ANPEP	46	35
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575454	DG	On-Demand	Anodyne	LAP3	44	35
CC[C@H](CC(F)(F)F)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575455	DG	On-Demand	Anodyne	MME	35	42
CC[C@H](CC(F)(F)F)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575455	DG	On-Demand	Anodyne	ANPEP	46	35
CC[C@H](CC(F)(F)F)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450575455	DG	On-Demand	Anodyne	LAP3	44	35
CC(=O)CCCCCn1cnc2c(Cl)cc(Cl)cc2c1=O	ZINC000450575459	EH	On-Demand	Anodyne	DNAE	61	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450575466	DG	On-Demand	Anodyne	CACNA1B	50	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450575466	DG	On-Demand	Anodyne	LIPG	56	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450575467	DG	On-Demand	Anodyne	CACNA1B	50	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450575467	DG	On-Demand	Anodyne	LIPG	56	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450575468	DG	On-Demand	Anodyne	CACNA1B	50	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450575468	DG	On-Demand	Anodyne	LIPG	56	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450575469	DG	On-Demand	Anodyne	CACNA1B	50	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450575469	DG	On-Demand	Anodyne	LIPG	56	40
OC1CCC2(CC1)CCN(c1ncncc1-c1ccccc1)CC2	ZINC000450575482	DH	On-Demand	Anodyne	SLC9A1	0	54
COC(=O)[C@H]1c2ccccc2CCN1CC[C@@H](C)O	ZINC000450575485	CD	On-Demand	Anodyne	MTNR1B	33	41
COC(=O)[C@@H]1c2ccccc2CCN1CC[C@H](C)O	ZINC000450575486	CD	On-Demand	Anodyne	MTNR1B	33	41
COC(=O)[C@@H]1c2ccccc2CCN1CC[C@@H](C)O	ZINC000450575487	CD	On-Demand	Anodyne	MTNR1B	33	41
COC(=O)[C@H]1c2ccccc2CCN1CC[C@H](C)O	ZINC000450575488	CD	On-Demand	Anodyne	MTNR1B	33	41
CCC(=O)C1(C(=O)NC[C@@H](O)CCc2ccccc2)CC1	ZINC000450575489	CD	On-Demand	Anodyne	SDH1	0	42
CCC(=O)C1(C(=O)NC[C@H](O)CCc2ccccc2)CC1	ZINC000450575490	CD	On-Demand	Anodyne	SDH1	0	42
O=C(NC[C@@H](O)CCc1ccccc1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450575495	GF	On-Demand	Anodyne	ABCB1	25	40
O=C(NC[C@H](O)CCc1ccccc1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450575496	GF	On-Demand	Anodyne	ABCB1	25	40
COC(=O)[C@@H]1c2ccccc2CCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450575498	EF	On-Demand	Anodyne	AGTR2	43	34
COC(=O)[C@@H]1c2ccccc2CCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450575498	EF	On-Demand	Anodyne	MTNR1B	34	42
COC(=O)[C@@H]1c2ccccc2CCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450575499	EF	On-Demand	Anodyne	AGTR2	43	34
COC(=O)[C@@H]1c2ccccc2CCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450575499	EF	On-Demand	Anodyne	MTNR1B	34	42
COC(=O)[C@@H]1c2ccccc2CCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450575500	EF	On-Demand	Anodyne	AGTR2	43	34
COC(=O)[C@@H]1c2ccccc2CCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450575500	EF	On-Demand	Anodyne	MTNR1B	34	42
COC(=O)[C@@H]1c2ccccc2CCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450575501	EF	On-Demand	Anodyne	AGTR2	43	34
COC(=O)[C@@H]1c2ccccc2CCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450575501	EF	On-Demand	Anodyne	MTNR1B	34	42
CCn1cc(C(=O)N2CCC[C@@H](C)[C@H]2CO)c2ccccc21	ZINC000450575508	DF	On-Demand	Anodyne	CNR1	0	51
CCn1cc(C(=O)N2CCC[C@@H](C)[C@H]2CO)c2ccccc21	ZINC000450575508	DF	On-Demand	Anodyne	CNR2	25	40
CCn1cc(C(=O)N2CCC[C@@H](C)[C@H]2CO)c2ccccc21	ZINC000450575508	DF	On-Demand	Anodyne	TPSAB1	32	47
CCn1cc(C(=O)N2CCC[C@@H](C)[C@@H]2CO)c2ccccc21	ZINC000450575509	DF	On-Demand	Anodyne	CNR1	0	51
CCn1cc(C(=O)N2CCC[C@@H](C)[C@@H]2CO)c2ccccc21	ZINC000450575509	DF	On-Demand	Anodyne	CNR2	25	40
CCn1cc(C(=O)N2CCC[C@@H](C)[C@@H]2CO)c2ccccc21	ZINC000450575509	DF	On-Demand	Anodyne	TPSAB1	32	47
CCn1cc(C(=O)N2CCC[C@H](C)[C@@H]2CO)c2ccccc21	ZINC000450575510	DF	On-Demand	Anodyne	CNR1	0	51
CCn1cc(C(=O)N2CCC[C@H](C)[C@@H]2CO)c2ccccc21	ZINC000450575510	DF	On-Demand	Anodyne	CNR2	25	40
CCn1cc(C(=O)N2CCC[C@H](C)[C@@H]2CO)c2ccccc21	ZINC000450575510	DF	On-Demand	Anodyne	TPSAB1	32	47
CCn1cc(C(=O)N2CCC[C@H](C)[C@H]2CO)c2ccccc21	ZINC000450575511	DF	On-Demand	Anodyne	CNR1	0	51
CCn1cc(C(=O)N2CCC[C@H](C)[C@H]2CO)c2ccccc21	ZINC000450575511	DF	On-Demand	Anodyne	CNR2	25	40
CCn1cc(C(=O)N2CCC[C@H](C)[C@H]2CO)c2ccccc21	ZINC000450575511	DF	On-Demand	Anodyne	TPSAB1	32	47
CC(=O)c1cc(Cl)ccc1OCc1oc(C(C)C)nc1C	ZINC000450575524	DJ	On-Demand	Anodyne	PTGER1	46	38
COC(=O)C1(CN2CCc3cc(-c4ccccc4)oc3C2)CC1	ZINC000450575525	DG	On-Demand	Anodyne	CHRM5	31	40
O=C(NC[C@H](O)CCc1ccccc1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450575542	EH	On-Demand	Anodyne	SCN9A	0	52
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450575543	EH	On-Demand	Anodyne	SCN9A	0	52
O=C(NC[C@H](O)CCc1ccccc1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450575544	EH	On-Demand	Anodyne	SCN9A	0	52
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450575545	EH	On-Demand	Anodyne	SCN9A	0	52
CCCCCn1c(SC[C@H](O)CC#N)nc2ccccc21	ZINC000450575563	DH	On-Demand	Mild	PTGDR2	17	40
CCNC(=O)c1ccc(N2CCC3(CCC(O)CC3)CC2)nn1	ZINC000450575571	DD	On-Demand	Anodyne	SCD1	51	44
CCNC(=O)c1ccc(N2CCC3(CCC(O)CC3)CC2)nn1	ZINC000450575571	DD	On-Demand	Anodyne	SCD	43	41
Cc1cc(-c2nc(C(=O)NC[C@@H](O)CCc3ccccc3)co2)ccn1	ZINC000450575631	FF	On-Demand	Anodyne	TBXA2R	19	40
Cc1cc(-c2nc(C(=O)NC[C@H](O)CCc3ccccc3)co2)ccn1	ZINC000450575632	FF	On-Demand	Anodyne	TBXA2R	19	40
COc1cc(CN2CCN(c3nc(C)ns3)CC2)ccc1Cl	ZINC000450575635	EF	On-Demand	Anodyne	DRD1	0	43
COC(=O)[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450575650	DD	On-Demand	Anodyne	DRD2	31	40
COC(=O)[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450575650	DD	On-Demand	Anodyne	DRD4	0	40
COC(=O)[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450575650	DD	On-Demand	Anodyne	SLC18A3	0	40
COC(=O)[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450575650	DD	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450575651	DD	On-Demand	Anodyne	DRD2	31	40
COC(=O)[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450575651	DD	On-Demand	Anodyne	DRD4	0	40
COC(=O)[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450575651	DD	On-Demand	Anodyne	SLC18A3	0	40
COC(=O)[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450575651	DD	On-Demand	Anodyne	CYP2J2	48	34
OC1CCC2(CC1)CCN(c1ncccc1C(F)(F)F)CC2	ZINC000450575682	DH	On-Demand	Anodyne	TRPV1	34	48
CCS(=O)(=O)c1ccc(CN2CCOC[C@H]2C(=O)OC)cc1	ZINC000450575688	EC	On-Demand	Anodyne	MMP13	25	45
CCS(=O)(=O)c1ccc(CN2CCOC[C@@H]2C(=O)OC)cc1	ZINC000450575689	EC	On-Demand	Anodyne	MMP13	25	45
CC(=O)c1cccc(CN2CCCc3c2cccc3S(N)(=O)=O)c1	ZINC000450575697	EE	On-Demand	Anodyne	TRY2_BOVIN	52	33
Brc1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)o2)cc1	ZINC000450575726	FI	On-Demand	Anodyne	TERT	0	42
Brc1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)o2)cc1	ZINC000450575727	FI	On-Demand	Anodyne	TERT	0	42
NC(=O)c1cnc(N2CCC3(CCC(O)CC3)CC2)c(Cl)c1	ZINC000450575730	DE	On-Demand	Anodyne	P2RY12	28	41
NC(=O)c1cnc(N2CCC3(CCC(O)CC3)CC2)c(Cl)c1	ZINC000450575730	DE	On-Demand	Anodyne	CXCR3	29	44
COC(=O)[C@@H]1c2ccccc2CCN1Cc1nc(-c2cc(OC)ncn2)no1	ZINC000450575738	GD	On-Demand	Anodyne	MT-CYB	50	34
COC(=O)[C@H]1c2ccccc2CCN1Cc1nc(-c2cc(OC)ncn2)no1	ZINC000450575739	GD	On-Demand	Anodyne	MT-CYB	50	34
CCOC(=O)c1ccc(CN2CCc3ccccc3[C@@H]2C(=O)OC)nc1	ZINC000450575754	FF	On-Demand	Anodyne	NOD2	25	40
CCOC(=O)c1ccc(CN2CCc3ccccc3[C@H]2C(=O)OC)nc1	ZINC000450575755	FF	On-Demand	Anodyne	NOD2	25	40
Cc1cc(N2CCC3(CCC(O)CC3)CC2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450575770	FH	On-Demand	Bother	GYRB	0	51
CCCc1nc(C)c(COc2ccc(Cl)cc2C(C)=O)o1	ZINC000450575772	DI	On-Demand	Anodyne	PTGER1	44	37
CN(CCCC(=O)c1ccc(F)cc1)Cc1nc2ccccc2n1C	ZINC000450575822	EH	On-Demand	Anodyne	CDPK1	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@H]3CO)cc2)c1	ZINC000450575840	GG	On-Demand	Anodyne	CHRM3	15	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@H]3CO)cc2)c1	ZINC000450575840	GG	On-Demand	Anodyne	HCRTR1	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@H]3CO)cc2)c1	ZINC000450575840	GG	On-Demand	Anodyne	MMP13	19	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@H]3CO)cc2)c1	ZINC000450575840	GG	On-Demand	Anodyne	PREP	46	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@H]3CO)cc2)c1	ZINC000450575840	GG	On-Demand	Anodyne	HCRTR2	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@H]3CO)cc2)c1	ZINC000450575841	GG	On-Demand	Anodyne	CHRM3	15	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@H]3CO)cc2)c1	ZINC000450575841	GG	On-Demand	Anodyne	HCRTR1	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@H]3CO)cc2)c1	ZINC000450575841	GG	On-Demand	Anodyne	MMP13	19	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@H]3CO)cc2)c1	ZINC000450575841	GG	On-Demand	Anodyne	PREP	46	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@H]3CO)cc2)c1	ZINC000450575841	GG	On-Demand	Anodyne	HCRTR2	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@@H]3CO)cc2)c1	ZINC000450575842	GG	On-Demand	Anodyne	CHRM3	15	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@@H]3CO)cc2)c1	ZINC000450575842	GG	On-Demand	Anodyne	HCRTR1	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@@H]3CO)cc2)c1	ZINC000450575842	GG	On-Demand	Anodyne	MMP13	19	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@@H]3CO)cc2)c1	ZINC000450575842	GG	On-Demand	Anodyne	PREP	46	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@@H](C)[C@@H]3CO)cc2)c1	ZINC000450575842	GG	On-Demand	Anodyne	HCRTR2	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@@H]3CO)cc2)c1	ZINC000450575843	GG	On-Demand	Anodyne	CHRM3	15	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@@H]3CO)cc2)c1	ZINC000450575843	GG	On-Demand	Anodyne	HCRTR1	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@@H]3CO)cc2)c1	ZINC000450575843	GG	On-Demand	Anodyne	MMP13	19	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@@H]3CO)cc2)c1	ZINC000450575843	GG	On-Demand	Anodyne	PREP	46	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC[C@H](C)[C@@H]3CO)cc2)c1	ZINC000450575843	GG	On-Demand	Anodyne	HCRTR2	0	40
COc1ccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c(Cl)c1OC	ZINC000450575844	GG	On-Demand	Anodyne	TRPV1	0	43
COc1ccc(CC(=O)NC[C@H](O)CCc2ccccc2)c(Cl)c1OC	ZINC000450575845	GG	On-Demand	Anodyne	TRPV1	0	43
C/C=C/COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575847	FG	On-Demand	Anodyne	ABCB1	24	40
C/C=C/COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575847	FG	On-Demand	Anodyne	TSPAN17	0	44
C/C=C/COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575847	FG	On-Demand	Anodyne	POLG_WNV	40	33
C/C=C/COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575847	FG	On-Demand	Anodyne	CRTM	52	37
C/C=C/COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575847	FG	On-Demand	Anodyne	PDS	62	35
C/C=C\COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575848	FG	On-Demand	Anodyne	ABCB1	24	40
C/C=C\COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575848	FG	On-Demand	Anodyne	TSPAN17	0	44
C/C=C\COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575848	FG	On-Demand	Anodyne	POLG_WNV	40	33
C/C=C\COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575848	FG	On-Demand	Anodyne	CRTM	52	37
C/C=C\COc1cccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450575848	FG	On-Demand	Anodyne	PDS	62	35
C/C=C\COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575849	FG	On-Demand	Anodyne	ABCB1	24	40
C/C=C\COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575849	FG	On-Demand	Anodyne	TSPAN17	0	44
C/C=C\COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575849	FG	On-Demand	Anodyne	POLG_WNV	40	33
C/C=C\COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575849	FG	On-Demand	Anodyne	CRTM	52	37
C/C=C\COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575849	FG	On-Demand	Anodyne	PDS	62	35
C/C=C/COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575850	FG	On-Demand	Anodyne	ABCB1	24	40
C/C=C/COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575850	FG	On-Demand	Anodyne	TSPAN17	0	44
C/C=C/COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575850	FG	On-Demand	Anodyne	POLG_WNV	40	33
C/C=C/COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575850	FG	On-Demand	Anodyne	CRTM	52	37
C/C=C/COc1cccc(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450575850	FG	On-Demand	Anodyne	PDS	62	35
COC(=O)c1coc(CN2CCc3cc(-c4ccccc4)oc3C2)n1	ZINC000450575852	EG	On-Demand	Anodyne	CHRM5	30	41
O=C1C[C@]2(CCCN(CCCC(=O)c3ccccc3)C2)CN1	ZINC000450575853	DE	On-Demand	Anodyne	DRD2	32	49
O=C1C[C@@]2(CCCN(CCCC(=O)c3ccccc3)C2)CN1	ZINC000450575854	DE	On-Demand	Anodyne	DRD2	32	49
Cc1ccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c(Br)c1	ZINC000450575863	GG	On-Demand	Anodyne	MME	27	41
Cc1ccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c(Br)c1	ZINC000450575863	GG	On-Demand	Anodyne	ANPEP	42	37
Cc1ccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c(Br)c1	ZINC000450575863	GG	On-Demand	Anodyne	CA9	15	40
Cc1ccc(CC(=O)NC[C@@H](O)CCc2ccccc2)c(Br)c1	ZINC000450575863	GG	On-Demand	Anodyne	AMP1_PLAFQ	43	36
Cc1ccc(CC(=O)NC[C@H](O)CCc2ccccc2)c(Br)c1	ZINC000450575864	GG	On-Demand	Anodyne	MME	27	41
Cc1ccc(CC(=O)NC[C@H](O)CCc2ccccc2)c(Br)c1	ZINC000450575864	GG	On-Demand	Anodyne	ANPEP	42	37
Cc1ccc(CC(=O)NC[C@H](O)CCc2ccccc2)c(Br)c1	ZINC000450575864	GG	On-Demand	Anodyne	CA9	15	40
Cc1ccc(CC(=O)NC[C@H](O)CCc2ccccc2)c(Br)c1	ZINC000450575864	GG	On-Demand	Anodyne	AMP1_PLAFQ	43	36
CCOC(=O)c1ccc(CN2CCN(C(=O)NC)CC2)nc1	ZINC000450575934	DC	On-Demand	Anodyne	P2RY12	53	45
CCOC(=O)c1ccc(CN2CCN(C(=O)NC)CC2)nc1	ZINC000450575934	DC	On-Demand	Anodyne	SSTR5	44	36
C[C@H]1C[C@@H](C(=O)NC[C@@H](O)CCc2ccccc2)CC[C@H]1C	ZINC000450575942	DG	On-Demand	Anodyne	ACE	44	35
C[C@H]1C[C@@H](C(=O)NC[C@@H](O)CCc2ccccc2)CC[C@H]1C	ZINC000450575942	DG	On-Demand	Anodyne	SLC18A2	40	37
C[C@@H]1CC[C@H](C(=O)NC[C@@H](O)CCc2ccccc2)C[C@H]1C	ZINC000450575943	DG	On-Demand	Anodyne	ACE	44	35
C[C@@H]1CC[C@H](C(=O)NC[C@@H](O)CCc2ccccc2)C[C@H]1C	ZINC000450575943	DG	On-Demand	Anodyne	SLC18A2	40	37
C[C@H]1C[C@@H](C(=O)NC[C@H](O)CCc2ccccc2)CC[C@H]1C	ZINC000450575944	DG	On-Demand	Anodyne	ACE	44	35
C[C@H]1C[C@@H](C(=O)NC[C@H](O)CCc2ccccc2)CC[C@H]1C	ZINC000450575944	DG	On-Demand	Anodyne	SLC18A2	40	37
C[C@@H]1CC[C@H](C(=O)NC[C@H](O)CCc2ccccc2)C[C@H]1C	ZINC000450575945	DG	On-Demand	Anodyne	ACE	44	35
C[C@@H]1CC[C@H](C(=O)NC[C@H](O)CCc2ccccc2)C[C@H]1C	ZINC000450575945	DG	On-Demand	Anodyne	SLC18A2	40	37
O=C(CC1CC(F)(F)C1)NC[C@@H](O)CCc1ccccc1	ZINC000450575974	CF	On-Demand	Anodyne	SDH1	0	41
O=C(CC1CC(F)(F)C1)NC[C@H](O)CCc1ccccc1	ZINC000450575975	CF	On-Demand	Anodyne	SDH1	0	41
C[C@@H](CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1Cl)c1nccs1	ZINC000450575976	EI	On-Demand	Anodyne	GPR88	0	41
O=C(c1ccc(S(=O)(=O)C2CC2)cc1)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450575977	GG	On-Demand	Anodyne	LIMK2	46	41
O=C(c1ccc(S(=O)(=O)C2CC2)cc1)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450575978	GG	On-Demand	Anodyne	LIMK2	46	41
CNC(=O)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450575982	DE	On-Demand	Anodyne	DRD4	44	36
Cn1c(SCC2(C#N)CCC2)nnc1-c1ccc(Cl)cc1	ZINC000450575986	DH	On-Demand	Mild	HSD11B1	24	48
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450575988	DE	On-Demand	Anodyne	FAP	0	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450575989	DE	On-Demand	Anodyne	FAP	0	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450575990	DE	On-Demand	Anodyne	FAP	0	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450575991	DE	On-Demand	Anodyne	FAP	0	40
CC[C@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)c1nc(C)cs1	ZINC000450575998	GG	On-Demand	Anodyne	MTNR1A	42	36
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450575999	EG	On-Demand	Anodyne	DEF	0	41
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450575999	EG	On-Demand	Anodyne	COLA	120	47
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450575999	EG	On-Demand	Anodyne	CPT1A	103	46
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576000	EG	On-Demand	Anodyne	DEF	0	41
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576000	EG	On-Demand	Anodyne	COLA	120	47
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576000	EG	On-Demand	Anodyne	CPT1A	103	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576001	EG	On-Demand	Anodyne	DEF	0	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576001	EG	On-Demand	Anodyne	COLA	120	47
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576001	EG	On-Demand	Anodyne	CPT1A	103	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576002	EG	On-Demand	Anodyne	DEF	0	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576002	EG	On-Demand	Anodyne	COLA	120	47
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576002	EG	On-Demand	Anodyne	CPT1A	103	46
COCCn1c(SCc2ccc(C(C)=O)cc2)nc2ccccc21	ZINC000450576006	EI	On-Demand	Anodyne	HRH1	20	46
COCCn1c(SCc2ccc(C(C)=O)cc2)nc2ccccc21	ZINC000450576006	EI	On-Demand	Anodyne	PTGDR2	23	59
CCOC1(C)CN(c2ncnc3ccc(I)cc23)C1	ZINC000450576018	FF	On-Demand	Anodyne	HTT	0	42
CC(=O)CCCCCOc1cc(C)ccc1Cl	ZINC000450576019	CI	On-Demand	Anodyne	THRA	31	42
CC(=O)CCCCCOc1cc(C)ccc1Cl	ZINC000450576019	CI	On-Demand	Anodyne	THRB	31	42
O=C(CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1)C1CC1	ZINC000450576026	GI	On-Demand	Anodyne	COLA	157	60
O=C(CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1)C1CC1	ZINC000450576026	GI	On-Demand	Anodyne	CPT1A	148	60
O=C(CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1)C1CC1	ZINC000450576026	GI	On-Demand	Anodyne	PREP	53	38
O=C(CCCC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1)C1CC1	ZINC000450576027	GI	On-Demand	Anodyne	COLA	157	60
O=C(CCCC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1)C1CC1	ZINC000450576027	GI	On-Demand	Anodyne	CPT1A	148	60
O=C(CCCC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1)C1CC1	ZINC000450576027	GI	On-Demand	Anodyne	PREP	53	38
Cc1ccc(C2=CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)cn1	ZINC000450576037	EF	On-Demand	Anodyne	GPBAR1	20	40
CS[C@H]1CN(C(=O)c2ccc(C)c3c2CCC3)C[C@H]1N1CCCC1	ZINC000450576040	EG	On-Demand	Anodyne	L3MBTL3	59	38
CS[C@H]1CN(C(=O)c2ccc(C)c3c2CCC3)C[C@@H]1N1CCCC1	ZINC000450576041	EG	On-Demand	Anodyne	L3MBTL3	59	38
CS[C@@H]1CN(C(=O)c2ccc(C)c3c2CCC3)C[C@@H]1N1CCCC1	ZINC000450576042	EG	On-Demand	Anodyne	L3MBTL3	59	38
CS[C@@H]1CN(C(=O)c2ccc(C)c3c2CCC3)C[C@H]1N1CCCC1	ZINC000450576043	EG	On-Demand	Anodyne	L3MBTL3	59	38
CC[C@@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)c1nc(C)cs1	ZINC000450576055	GG	On-Demand	Anodyne	MTNR1A	42	36
OC1CCC2(CC1)CCN(c1ncnc3sc4c(c13)CCCC4)CC2	ZINC000450576075	FI	On-Demand	Anodyne	RBP4	18	44
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576100	CF	On-Demand	Anodyne	ACE	42	35
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576100	CF	On-Demand	Anodyne	AMP1_PLAFQ	40	38
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576100	CF	On-Demand	Anodyne	Q82323_9DELA	59	31
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576101	CF	On-Demand	Anodyne	ACE	42	35
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576101	CF	On-Demand	Anodyne	AMP1_PLAFQ	40	38
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576101	CF	On-Demand	Anodyne	Q82323_9DELA	59	31
CN(CCCC(=O)c1ccccc1)Cc1nc2ccccc2n1C	ZINC000450576117	DH	On-Demand	Anodyne	CYP2J2	43	30
O=C(Cc1ccc(OC(F)F)c(F)c1)NC[C@@H](O)CCc1ccccc1	ZINC000450576123	FG	On-Demand	Anodyne	PDEC	0	44
O=C(Cc1ccc(OC(F)F)c(F)c1)NC[C@H](O)CCc1ccccc1	ZINC000450576126	FG	On-Demand	Anodyne	PDEC	0	44
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	ACE	30	41
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	MME	62	47
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	ANPEP	74	38
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	FCER2	53	33
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	SDH1	0	41
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	KLK3	53	31
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	CTSB	45	43
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	CTSK	29	42
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	CTSL	22	42
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	CAPNS1	47	35
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	MMP2	27	45
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	MMP3	60	44
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	PAM	0	40
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	DNPEP	0	40
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	CAPN1	84	41
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	CAPN2	105	40
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	ACE2	41	35
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	LAP3	54	48
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	MMP1	27	40
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	FPR1	47	37
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	POL	0	41
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	NPR	78	42
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	AMP1_PLAFQ	52	47
CC[C@@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576128	CG	On-Demand	Anodyne	PDS	40	33
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	ACE	30	41
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	MME	62	47
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	ANPEP	74	38
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	FCER2	53	33
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	SDH1	0	41
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	KLK3	53	31
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	CTSB	45	43
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	CTSK	29	42
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	CTSL	22	42
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	CAPNS1	47	35
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	MMP2	27	45
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	MMP3	60	44
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	PAM	0	40
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	DNPEP	0	40
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	CAPN1	84	41
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	CAPN2	105	40
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	ACE2	41	35
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	LAP3	54	48
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	MMP1	27	40
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	FPR1	47	37
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	POL	0	41
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	NPR	78	42
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	AMP1_PLAFQ	52	47
CC[C@H](CC(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576129	CG	On-Demand	Anodyne	PDS	40	33
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	ACE	30	41
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	MME	62	47
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	ANPEP	74	38
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	FCER2	53	33
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	SDH1	0	41
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	KLK3	53	31
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	CTSB	45	43
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	CTSK	29	42
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	CTSL	22	42
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	CAPNS1	47	35
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	MMP2	27	45
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	MMP3	60	44
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	PAM	0	40
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	DNPEP	0	40
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	CAPN1	84	41
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	CAPN2	105	40
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	ACE2	41	35
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	LAP3	54	48
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	MMP1	27	40
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	FPR1	47	37
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	POL	0	41
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	NPR	78	42
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	AMP1_PLAFQ	52	47
CC[C@@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576130	CG	On-Demand	Anodyne	PDS	40	33
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	ACE	30	41
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	MME	62	47
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	ANPEP	74	38
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	FCER2	53	33
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	SDH1	0	41
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	KLK3	53	31
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	CTSB	45	43
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	CTSK	29	42
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	CTSL	22	42
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	CAPNS1	47	35
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	MMP2	27	45
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	MMP3	60	44
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	PAM	0	40
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	DNPEP	0	40
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	CAPN1	84	41
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	CAPN2	105	40
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	ACE2	41	35
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	LAP3	54	48
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	MMP1	27	40
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	FPR1	47	37
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	POL	0	41
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	NPR	78	42
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	AMP1_PLAFQ	52	47
CC[C@H](CC(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576131	CG	On-Demand	Anodyne	PDS	40	33
CS[C@H]1CN(C(=O)c2cnc(C3CC3)nc2)C[C@H]1N1CCCC1	ZINC000450576134	EE	On-Demand	Anodyne	L3MBTL3	38	41
CS[C@H]1CN(C(=O)c2cnc(C3CC3)nc2)C[C@@H]1N1CCCC1	ZINC000450576135	EE	On-Demand	Anodyne	L3MBTL3	38	41
CS[C@@H]1CN(C(=O)c2cnc(C3CC3)nc2)C[C@H]1N1CCCC1	ZINC000450576136	EE	On-Demand	Anodyne	L3MBTL3	38	41
CS[C@@H]1CN(C(=O)c2cnc(C3CC3)nc2)C[C@@H]1N1CCCC1	ZINC000450576137	EE	On-Demand	Anodyne	L3MBTL3	38	41
COc1ccc(CNC(=O)CCNC2(CCO)CCCCC2)c(OC)c1	ZINC000450576138	FE	On-Demand	Anodyne	MTNR1A	52	39
CCOC1(C)CN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450576141	CF	On-Demand	Anodyne	SORD	23	42
CC(=O)c1cc(Cl)ccc1OCc1nnc(C2CC2)s1	ZINC000450576148	DH	On-Demand	Anodyne	PTGER1	42	36
Cc1cc(C(=O)NC[C@@H](O)CCc2ccccc2)ncc1C(N)=O	ZINC000450576156	ED	On-Demand	Anodyne	STAT6	59	36
Cc1cc(C(=O)NC[C@H](O)CCc2ccccc2)ncc1C(N)=O	ZINC000450576157	ED	On-Demand	Anodyne	STAT6	59	36
COCCOC[C@@H](O)CN1CCc2cc(-c3ccccc3)oc2C1	ZINC000450576165	EE	On-Demand	Anodyne	ABCB1	40	34
COCCOC[C@H](O)CN1CCc2cc(-c3ccccc3)oc2C1	ZINC000450576166	EE	On-Demand	Anodyne	ABCB1	40	34
CCOC(=O)c1cc(N2CCC3(CCC(O)CC3)CC2)ncc1Cl	ZINC000450576175	FG	On-Demand	Anodyne	IKBKB	40	33
C[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]1CO	ZINC000450576179	EF	On-Demand	Anodyne	HCRTR1	22	40
C[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]1CO	ZINC000450576179	EF	On-Demand	Anodyne	COLA	100	39
C[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]1CO	ZINC000450576179	EF	On-Demand	Anodyne	HCRTR2	0	40
C[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@H]1CO	ZINC000450576180	EF	On-Demand	Anodyne	HCRTR1	22	40
C[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@H]1CO	ZINC000450576180	EF	On-Demand	Anodyne	COLA	100	39
C[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@H]1CO	ZINC000450576180	EF	On-Demand	Anodyne	HCRTR2	0	40
C[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]1CO	ZINC000450576181	EF	On-Demand	Anodyne	HCRTR1	22	40
C[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]1CO	ZINC000450576181	EF	On-Demand	Anodyne	COLA	100	39
C[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]1CO	ZINC000450576181	EF	On-Demand	Anodyne	HCRTR2	0	40
C[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@H]1CO	ZINC000450576182	EF	On-Demand	Anodyne	HCRTR1	22	40
C[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@H]1CO	ZINC000450576182	EF	On-Demand	Anodyne	COLA	100	39
C[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)[C@H]1CO	ZINC000450576182	EF	On-Demand	Anodyne	HCRTR2	0	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)[C@H](C)C1	ZINC000450576191	GG	On-Demand	Anodyne	SLC6A3	15	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C[C@H]1C	ZINC000450576192	GG	On-Demand	Anodyne	SLC6A3	15	42
COC1(CSc2nnc(-c3ccc(Cl)cc3)n2C)CCC1	ZINC000450576195	DH	On-Demand	Anodyne	HSD11B1	33	45
CCC[C@@H]1CCC[C@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576196	DG	On-Demand	Anodyne	ACE	43	37
CCC[C@@H]1CCC[C@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576196	DG	On-Demand	Anodyne	SLC18A2	43	39
CCC[C@@H]1CCC[C@@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576197	DG	On-Demand	Anodyne	ACE	43	37
CCC[C@@H]1CCC[C@@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576197	DG	On-Demand	Anodyne	SLC18A2	43	39
CCC[C@@H]1CCC[C@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576198	DG	On-Demand	Anodyne	ACE	43	37
CCC[C@@H]1CCC[C@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576198	DG	On-Demand	Anodyne	SLC18A2	43	39
CC1(F)CC(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1	ZINC000450576209	FF	On-Demand	Bother	EPHX2	15	50
Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C(F)(F)F)CC2)cn1	ZINC000450576216	GJ	On-Demand	Anodyne	RBP4	74	42
Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C(F)(F)F)CC2)cn1	ZINC000450576216	GJ	On-Demand	Anodyne	ADAM10	33	41
Nc1nsc(N2CCN(CCc3c(Cl)cccc3Cl)CC2)n1	ZINC000450576222	FF	On-Demand	Anodyne	DRD2	15	43
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576223	CF	On-Demand	Anodyne	COLA	49	40
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576223	CF	On-Demand	Anodyne	CPT1A	35	40
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576224	CF	On-Demand	Anodyne	COLA	49	40
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576224	CF	On-Demand	Anodyne	CPT1A	35	40
O=C(N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576233	GG	On-Demand	Anodyne	DRD4	27	43
O=C(N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576233	GG	On-Demand	Anodyne	DRD3	15	47
O=C(N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576233	GG	On-Demand	Anodyne	TACR2	37	43
O=C(N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576233	GG	On-Demand	Anodyne	CCR3	20	41
O=C(N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576233	GG	On-Demand	Anodyne	MCHR1	21	43
O=C(N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576233	GG	On-Demand	Anodyne	BIRC2	46	40
O=C(N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576234	GG	On-Demand	Anodyne	DRD4	27	43
O=C(N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576234	GG	On-Demand	Anodyne	DRD3	15	47
O=C(N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576234	GG	On-Demand	Anodyne	TACR2	37	43
O=C(N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576234	GG	On-Demand	Anodyne	CCR3	20	41
O=C(N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576234	GG	On-Demand	Anodyne	MCHR1	21	43
O=C(N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000450576234	GG	On-Demand	Anodyne	BIRC2	46	40
COC(=O)C1(CNC2(C(=O)Nc3ccc(OC)c(OC)c3)CCCC2)CC1	ZINC000450576236	GE	On-Demand	Anodyne	ENPP1	78	37
COC(=O)c1csc(CN2CC=C(c3ccc(Cl)cc3)CC2)n1	ZINC000450576242	EH	On-Demand	Anodyne	TRPC6	44	35
COc1ccc(NC(=O)C2(NC[C@H](O)Cc3ccccc3)CCCC2)cc1OC	ZINC000450576245	GG	On-Demand	Anodyne	ADRB1	18	41
COc1ccc(NC(=O)C2(NC[C@H](O)Cc3ccccc3)CCCC2)cc1OC	ZINC000450576245	GG	On-Demand	Anodyne	ADRB3	18	41
COc1ccc(NC(=O)C2(NC[C@H](O)Cc3ccccc3)CCCC2)cc1OC	ZINC000450576245	GG	On-Demand	Anodyne	TIMP3	60	34
COc1ccc(NC(=O)C2(NC[C@H](O)Cc3ccccc3)CCCC2)cc1OC	ZINC000450576245	GG	On-Demand	Anodyne	ENPP1	68	34
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	DRD4	29	51
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	DRD3	20	40
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	ELANE	17	40
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	CNR2	15	46
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	CASP8	23	40
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	TRY2_BOVIN	47	32
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	CCR3	35	44
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	CASP1	36	42
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	DPP7	15	43
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	MCHR1	20	56
C[C@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576248	FE	On-Demand	Anodyne	BIRC2	49	42
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	DRD4	29	51
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	DRD3	20	40
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	ELANE	17	40
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	CNR2	15	46
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	CASP8	23	40
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	TRY2_BOVIN	47	32
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	CCR3	35	44
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	CASP1	36	42
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	DPP7	15	43
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	MCHR1	20	56
C[C@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576249	FE	On-Demand	Anodyne	BIRC2	49	42
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	DRD4	29	51
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	DRD3	20	40
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	ELANE	17	40
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	CNR2	15	46
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	CASP8	23	40
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	TRY2_BOVIN	47	32
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	CCR3	35	44
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	CASP1	36	42
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	DPP7	15	43
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	MCHR1	20	56
C[C@@H](CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576250	FE	On-Demand	Anodyne	BIRC2	49	42
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	DRD4	29	51
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	DRD3	20	40
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	ELANE	17	40
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	CNR2	15	46
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	CASP8	23	40
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	TRY2_BOVIN	47	32
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	CCR3	35	44
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	CASP1	36	42
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	DPP7	15	43
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	MCHR1	20	56
C[C@@H](CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1)S(C)(=O)=O	ZINC000450576251	FE	On-Demand	Anodyne	BIRC2	49	42
Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2)cn1	ZINC000450576260	EH	On-Demand	Anodyne	ADAM10	38	44
Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2)cn1	ZINC000450576260	EH	On-Demand	Anodyne	ADAM33	0	41
Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2)cn1	ZINC000450576260	EH	On-Demand	Anodyne	ADAM8	0	41
O=C1CCC(CN2CC=C(c3ccc(Cl)cc3)CC2)CC1	ZINC000450576269	DI	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	34
CCOC1(C)CN(c2ccnc(C(C)C)n2)C1	ZINC000450576278	BE	On-Demand	Anodyne	SORD	103	42
COC(=O)C1(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)CC1	ZINC000450576280	FF	On-Demand	Anodyne	DRD3	26	44
COC(=O)C1(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)CC1	ZINC000450576280	FF	On-Demand	Anodyne	MCHR1	22	42
COC(=O)C1(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)CC1	ZINC000450576281	FF	On-Demand	Anodyne	DRD3	26	44
COC(=O)C1(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)CC1	ZINC000450576281	FF	On-Demand	Anodyne	MCHR1	22	42
COc1ccc(NC(=O)C2(NCc3cccc(C)n3)CCCC2)cc1OC	ZINC000450576285	FG	On-Demand	Anodyne	ENPP1	62	37
COc1ccc(NC(=O)C2(NCc3cccc(C)n3)CCCC2)cc1OC	ZINC000450576285	FG	On-Demand	Anodyne	DRTS_TRYCR	44	31
CCC[C@@H]1CCC[C@@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576287	DG	On-Demand	Anodyne	ACE	43	37
CCC[C@@H]1CCC[C@@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576287	DG	On-Demand	Anodyne	SLC18A2	43	39
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576297	CD	On-Demand	Mild	SDH1	0	43
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576298	CD	On-Demand	Mild	SDH1	0	43
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576299	CD	On-Demand	Mild	SDH1	0	43
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576300	CD	On-Demand	Mild	SDH1	0	43
N#Cc1cc(Br)ccc1N1CCC2(CCC(O)CC2)CC1	ZINC000450576327	EH	On-Demand	Mild	AR	23	40
O=C1C[C@]2(CCCN(CCCC(=O)c3ccc(Br)cc3)C2)CN1	ZINC000450576337	GG	On-Demand	Anodyne	DRD2	29	43
O=C1C[C@]2(CCCN(CCCC(=O)c3ccc(Br)cc3)C2)CN1	ZINC000450576337	GG	On-Demand	Anodyne	DRD4	0	43
O=C1C[C@]2(CCCN(CCCC(=O)c3ccc(Br)cc3)C2)CN1	ZINC000450576337	GG	On-Demand	Anodyne	CYP2J2	45	33
O=C1C[C@@]2(CCCN(CCCC(=O)c3ccc(Br)cc3)C2)CN1	ZINC000450576338	GG	On-Demand	Anodyne	DRD2	29	43
O=C1C[C@@]2(CCCN(CCCC(=O)c3ccc(Br)cc3)C2)CN1	ZINC000450576338	GG	On-Demand	Anodyne	DRD4	0	43
O=C1C[C@@]2(CCCN(CCCC(=O)c3ccc(Br)cc3)C2)CN1	ZINC000450576338	GG	On-Demand	Anodyne	CYP2J2	45	33
NS(=O)(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450576367	GF	On-Demand	Anodyne	DRD4	0	44
NS(=O)(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450576367	GF	On-Demand	Anodyne	HTR2A	17	44
NS(=O)(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450576367	GF	On-Demand	Anodyne	HTR2C	15	44
NS(=O)(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450576367	GF	On-Demand	Anodyne	ERG2	19	41
NS(=O)(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450576367	GF	On-Demand	Anodyne	SLC18A3	0	43
NS(=O)(=O)c1cccc2c1CCCN2CCCC(=O)c1ccc(F)cc1	ZINC000450576367	GF	On-Demand	Anodyne	CYP2J2	45	33
COc1ccc(CNC(=O)CCN(C)Cc2nc3ccccc3n2C)c(OC)c1	ZINC000450576378	GF	On-Demand	Anodyne	MTNR1A	42	35
COc1ccc(CNC(=O)CCN(C)Cc2nc3ccccc3n2C)c(OC)c1	ZINC000450576378	GF	On-Demand	Anodyne	PDE10A	15	41
Cc1ccc(F)c(CC(=O)NC[C@@H](O)CCc2ccccc2)c1	ZINC000450576388	DF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
Cc1ccc(F)c(CC(=O)NC[C@H](O)CCc2ccccc2)c1	ZINC000450576389	DF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	PPARA	23	46
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	TACR1	23	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	PPARD	30	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	ABCB1	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	MTTP	56	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	CCR2	58	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	PHES	0	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	MLYCD	22	43
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450576396	FH	On-Demand	Anodyne	PDS	41	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	PPARA	23	46
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	TACR1	23	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	PPARD	30	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	ABCB1	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	MTTP	56	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	CCR2	58	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	PHES	0	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	MLYCD	22	43
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450576397	FH	On-Demand	Anodyne	PDS	41	38
CC[C@H](CO)N(C)c1ccnc2ccc(Cl)cc12	ZINC000450576404	CG	On-Demand	Anodyne	HNMT	40	31
CC[C@H](CO)N(C)c1ccnc2ccc(Cl)cc12	ZINC000450576404	CG	On-Demand	Anodyne	RBP_CHICK	0	41
CC[C@@H](CO)N(C)c1ccnc2ccc(Cl)cc12	ZINC000450576405	CG	On-Demand	Anodyne	HNMT	40	31
CC[C@@H](CO)N(C)c1ccnc2ccc(Cl)cc12	ZINC000450576405	CG	On-Demand	Anodyne	RBP_CHICK	0	41
Cc1ccc(C2=CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)cn1	ZINC000450576408	EH	On-Demand	Anodyne	ADAM10	51	39
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)cn1	ZINC000450576409	EH	On-Demand	Anodyne	ADAM10	51	39
Ic1ccc2ncnc(N3CC4(CC4)C3)c2c1	ZINC000450576432	EF	On-Demand	Anodyne	HTT	0	42
O=C(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccc2ccccc2c1	ZINC000450576438	FI	On-Demand	Anodyne	DRD4	27	52
O=C(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccc2ccccc2c1	ZINC000450576438	FI	On-Demand	Anodyne	CCR3	47	45
O=C(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccc2ccccc2c1	ZINC000450576438	FI	On-Demand	Anodyne	MCHR1	17	57
O=C(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccc2ccccc2c1	ZINC000450576438	FI	On-Demand	Anodyne	BIRC2	41	35
O=C(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccc2ccccc2c1	ZINC000450576442	FI	On-Demand	Anodyne	DRD4	27	52
O=C(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccc2ccccc2c1	ZINC000450576442	FI	On-Demand	Anodyne	CCR3	47	45
O=C(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccc2ccccc2c1	ZINC000450576442	FI	On-Demand	Anodyne	MCHR1	17	57
O=C(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccc2ccccc2c1	ZINC000450576442	FI	On-Demand	Anodyne	BIRC2	41	35
CCOC(=O)c1ccc(CN2CCN(C)c3cc(F)ccc32)nc1	ZINC000450576447	EF	On-Demand	Anodyne	P2RY12	26	40
COCCn1c(SCC2CC(F)(F)C2)nc2ccccc21	ZINC000450576455	DH	On-Demand	Anodyne	HRH1	28	49
CO[C@@H](Cc1ccccc1)CN1CCc2ccccc2[C@H]1CO	ZINC000450576475	DF	On-Demand	Anodyne	MTNR1B	27	40
CO[C@@H](Cc1ccccc1)CN1CCc2ccccc2[C@@H]1CO	ZINC000450576476	DF	On-Demand	Anodyne	MTNR1B	27	40
CO[C@H](Cc1ccccc1)CN1CCc2ccccc2[C@@H]1CO	ZINC000450576477	DF	On-Demand	Anodyne	MTNR1B	27	40
CO[C@H](Cc1ccccc1)CN1CCc2ccccc2[C@H]1CO	ZINC000450576478	DF	On-Demand	Anodyne	MTNR1B	27	40
CCCc1cc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)no1	ZINC000450576480	DG	On-Demand	Anodyne	CPT1A	44	41
CCCc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)no1	ZINC000450576481	DG	On-Demand	Anodyne	CPT1A	44	41
CCCOc1ccc(OCc2nc(-c3ccc(OC)nn3)no2)cc1	ZINC000450576501	EF	On-Demand	Anodyne	ACACA	0	52
CNS(=O)(=O)C[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450576509	FD	On-Demand	Anodyne	HRH3	23	40
CNS(=O)(=O)C[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450576510	FD	On-Demand	Anodyne	HRH3	23	40
COc1cc(CC(=O)N(C)C[C@@H](C)c2nccs2)ccc1Cl	ZINC000450576530	EH	On-Demand	Anodyne	OPRK1	0	50
COc1cc(CC(=O)N(C)C[C@H](C)c2nccs2)ccc1Cl	ZINC000450576532	EH	On-Demand	Anodyne	OPRK1	0	50
O=C(Cc1ccccc1O[C@H]1CCOC1)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450576538	GG	On-Demand	Anodyne	PDEC	0	42
O=C(Cc1ccccc1O[C@@H]1CCOC1)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450576539	GG	On-Demand	Anodyne	PDEC	0	42
O=C(Cc1ccccc1O[C@H]1CCOC1)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450576541	GG	On-Demand	Anodyne	PDEC	0	42
O=C(Cc1ccccc1O[C@@H]1CCOC1)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450576543	GG	On-Demand	Anodyne	PDEC	0	42
CC(C)N1CCCC[C@@H]1CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450576562	FG	On-Demand	Anodyne	CCR2	50	38
CC(C)N1CCCC[C@H]1CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450576564	FG	On-Demand	Anodyne	CCR2	50	38
CC[C@H](CO)N(C)c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450576565	EH	On-Demand	Anodyne	ADRB3	0	40
CC(C)N1CCCC[C@@H]1CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450576566	FG	On-Demand	Anodyne	CCR2	50	38
CC[C@@H](CO)N(C)c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450576568	EH	On-Demand	Anodyne	ADRB3	0	40
O=C(Nc1nncs1)c1ccc(N2CCC3(CCC(O)CC3)CC2)nc1	ZINC000450576569	FF	On-Demand	Anodyne	HDAC1	29	44
CC(C)N1CCCC[C@H]1CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450576570	FG	On-Demand	Anodyne	CCR2	50	38
CCOC(=O)c1ccc(CN(C)c2ccc(C(=O)N3CCOCC3)cc2C)nc1	ZINC000450576571	GF	On-Demand	Anodyne	LRRK2	21	41
COc1ccc2nc(S[C@@H]3C[C@@H](C)CCC3=O)[nH]c2c1	ZINC000450576582	CG	On-Demand	Anodyne	CYP2C8	23	43
COc1ccc2nc(S[C@@H]3C[C@@H](C)CCC3=O)[nH]c2c1	ZINC000450576582	CG	On-Demand	Anodyne	CYP2C19	35	46
COc1ccc2nc(S[C@H]3C[C@H](C)CCC3=O)[nH]c2c1	ZINC000450576583	CG	On-Demand	Anodyne	CYP2C8	23	43
COc1ccc2nc(S[C@H]3C[C@H](C)CCC3=O)[nH]c2c1	ZINC000450576583	CG	On-Demand	Anodyne	CYP2C19	35	46
COc1ccc2nc(S[C@H]3C[C@@H](C)CCC3=O)[nH]c2c1	ZINC000450576585	CG	On-Demand	Anodyne	CYP2C8	23	43
COc1ccc2nc(S[C@H]3C[C@@H](C)CCC3=O)[nH]c2c1	ZINC000450576585	CG	On-Demand	Anodyne	CYP2C19	35	46
CSc1ccc2ncnc(N3CCC4(CCC(O)CC4)CC3)c2c1	ZINC000450576587	EH	On-Demand	Anodyne	PDE3A	43	33
CSc1ccc2ncnc(N3CCC4(CCC(O)CC4)CC3)c2c1	ZINC000450576587	EH	On-Demand	Anodyne	PDGFRB	22	40
CSc1ccc2ncnc(N3CCC4(CCC(O)CC4)CC3)c2c1	ZINC000450576587	EH	On-Demand	Anodyne	PDE3B	64	33
CSc1ccc2ncnc(N3CCC4(CCC(O)CC4)CC3)c2c1	ZINC000450576587	EH	On-Demand	Anodyne	SIRT3	51	31
CSc1ccc2ncnc(N3CCC4(CCC(O)CC4)CC3)c2c1	ZINC000450576587	EH	On-Demand	Anodyne	SIRT2	44	31
CSc1ccc2ncnc(N3CCC4(CCC(O)CC4)CC3)c2c1	ZINC000450576587	EH	On-Demand	Anodyne	SIRT1	40	30
CSc1ccc2ncnc(N3CCC4(CCC(O)CC4)CC3)c2c1	ZINC000450576587	EH	On-Demand	Anodyne	HTT	0	42
COc1ccc2nc(S[C@@H]3C[C@H](C)CCC3=O)[nH]c2c1	ZINC000450576588	CG	On-Demand	Anodyne	CYP2C8	23	43
COc1ccc2nc(S[C@@H]3C[C@H](C)CCC3=O)[nH]c2c1	ZINC000450576588	CG	On-Demand	Anodyne	CYP2C19	35	46
OC1CCC2(CC1)CCN(c1ncnc3cc(Br)ccc13)CC2	ZINC000450576602	GH	On-Demand	Anodyne	PDE3A	42	31
OC1CCC2(CC1)CCN(c1ncnc3cc(Br)ccc13)CC2	ZINC000450576602	GH	On-Demand	Anodyne	PDE3B	62	32
CC(F)(F)c1ccc(C(=O)NC[C@@H](O)CCc2ccccc2)cn1	ZINC000450576619	EF	On-Demand	Anodyne	EPHX2	0	42
CC(F)(F)c1ccc(C(=O)NC[C@H](O)CCc2ccccc2)cn1	ZINC000450576634	EF	On-Demand	Anodyne	EPHX2	0	42
CCOc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2cccnc2)cc1	ZINC000450576635	GI	On-Demand	Anodyne	CACNA2D1	46	36
CCOc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2cccnc2)cc1	ZINC000450576635	GI	On-Demand	Anodyne	VCP	65	36
CC(=O)c1cn(CC(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)nn1	ZINC000450576637	GF	On-Demand	Anodyne	COLA	129	59
CC(=O)c1cn(CC(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)nn1	ZINC000450576637	GF	On-Demand	Anodyne	CPT1A	124	59
CC(=O)c1cn(CC(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)nn1	ZINC000450576638	GF	On-Demand	Anodyne	COLA	129	59
CC(=O)c1cn(CC(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)nn1	ZINC000450576638	GF	On-Demand	Anodyne	CPT1A	124	59
CCOc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2cccnc2)cc1	ZINC000450576641	GI	On-Demand	Anodyne	CACNA2D1	46	36
CCOc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2cccnc2)cc1	ZINC000450576641	GI	On-Demand	Anodyne	VCP	65	36
CS(=O)(=O)CC1CCC(Nc2cc(-n3cccn3)nc(N)n2)CC1	ZINC000450576650	FD	On-Demand	Anodyne	HRH4	21	44
C[C@H](c1ccccc1)[C@@H](O)CN[C@](C)(C(N)=O)c1cccc(Cl)c1	ZINC000450576657	EF	On-Demand	Anodyne	KIF11	29	41
C[C@H](c1ccccc1)[C@H](O)CN[C@@](C)(C(N)=O)c1cccc(Cl)c1	ZINC000450576658	EF	On-Demand	Anodyne	KIF11	29	41
C[C@H](c1ccccc1)[C@@H](O)CN[C@@](C)(C(N)=O)c1cccc(Cl)c1	ZINC000450576659	EF	On-Demand	Anodyne	KIF11	29	41
C[C@H](c1ccccc1)[C@H](O)CN[C@](C)(C(N)=O)c1cccc(Cl)c1	ZINC000450576660	EF	On-Demand	Anodyne	KIF11	29	41
COC(=O)c1coc(CNC2(c3ccccc3)CCCCC2)n1	ZINC000450576701	DG	On-Demand	Anodyne	NPPA	43	37
Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)CC2)cn1	ZINC000450576702	DG	On-Demand	Anodyne	ADAM10	31	40
COCCn1c(SCc2cccc(S(C)(=O)=O)c2)nc2ccccc21	ZINC000450576703	GG	On-Demand	Anodyne	PTGDR2	21	51
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)ccc1Cl	ZINC000450576714	FH	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)ccc1Cl	ZINC000450576714	FH	On-Demand	Anodyne	OPRK1	48	46
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)ccc1Cl	ZINC000450576714	FH	On-Demand	Anodyne	COLA	111	44
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)ccc1Cl	ZINC000450576714	FH	On-Demand	Anodyne	CPT1A	93	44
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)ccc1Cl	ZINC000450576715	FH	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)ccc1Cl	ZINC000450576715	FH	On-Demand	Anodyne	OPRK1	48	46
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)ccc1Cl	ZINC000450576715	FH	On-Demand	Anodyne	COLA	111	44
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)ccc1Cl	ZINC000450576715	FH	On-Demand	Anodyne	CPT1A	93	44
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450576717	GK	On-Demand	Anodyne	CPT1A	114	51
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450576718	GK	On-Demand	Anodyne	CPT1A	114	51
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450576719	GK	On-Demand	Anodyne	CPT1A	114	51
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450576720	GK	On-Demand	Anodyne	CPT1A	114	51
Cc1nc([C@H]2CCCCCN2C(=O)c2ccnn2CC(F)(F)F)no1	ZINC000450576721	FF	On-Demand	Anodyne	COLA	51	40
Cc1nc([C@H]2CCCCCN2C(=O)c2ccnn2CC(F)(F)F)no1	ZINC000450576721	FF	On-Demand	Anodyne	CPT1A	46	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccnn2CC(F)(F)F)no1	ZINC000450576722	FF	On-Demand	Anodyne	COLA	51	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccnn2CC(F)(F)F)no1	ZINC000450576722	FF	On-Demand	Anodyne	CPT1A	46	40
CCc1cc(CCCN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)on1	ZINC000450576726	GH	On-Demand	Anodyne	DRD4	23	41
CCc1cc(CCCN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)on1	ZINC000450576726	GH	On-Demand	Anodyne	DRD3	18	43
CCc1cc(CCCN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)on1	ZINC000450576726	GH	On-Demand	Anodyne	INHA	62	34
CCc1cc(CCCN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)on1	ZINC000450576726	GH	On-Demand	Anodyne	BIRC2	50	36
CCc1cc(CCCN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)on1	ZINC000450576727	GH	On-Demand	Anodyne	DRD4	23	41
CCc1cc(CCCN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)on1	ZINC000450576727	GH	On-Demand	Anodyne	DRD3	18	43
CCc1cc(CCCN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)on1	ZINC000450576727	GH	On-Demand	Anodyne	INHA	62	34
CCc1cc(CCCN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)on1	ZINC000450576727	GH	On-Demand	Anodyne	BIRC2	50	36
COCCn1c(SCC(=O)c2ccc(C(=O)OC)o2)nc2ccccc21	ZINC000450576730	FG	On-Demand	Anodyne	HRH1	0	43
COCCn1c(SCC(=O)c2ccc(C(=O)OC)o2)nc2ccccc21	ZINC000450576730	FG	On-Demand	Anodyne	PTGDR2	19	46
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450576732	EF	On-Demand	Anodyne	OPRK1	29	41
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450576732	EF	On-Demand	Anodyne	COLA	106	46
Cc1nc([C@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450576733	EF	On-Demand	Anodyne	OPRK1	29	41
Cc1nc([C@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450576733	EF	On-Demand	Anodyne	COLA	106	46
O=C(N[C@H]1CCCN(Cc2cnn[nH]2)C1)c1ccc2ccccc2c1	ZINC000450576783	EE	On-Demand	Anodyne	DRD4	25	51
O=C(N[C@@H]1CCCN(Cc2cnn[nH]2)C1)c1ccc2ccccc2c1	ZINC000450576784	EE	On-Demand	Anodyne	DRD4	25	51
Cc1cc(NC2CCC(CS(C)(=O)=O)CC2)n2c(nc3ccccc32)c1C#N	ZINC000450576791	GH	On-Demand	Mild	CSNK2A1	40	38
Cc1cc(NC2CCC(CS(C)(=O)=O)CC2)n2c(nc3ccccc32)c1C#N	ZINC000450576791	GH	On-Demand	Mild	HIPK2	40	33
COc1cc2c(NC3CC(C)(F)C3)ncnc2cc1F	ZINC000450576795	CG	On-Demand	Anodyne	FLT1	24	46
COc1cc2c(NC3CC(C)(F)C3)ncnc2cc1F	ZINC000450576795	CG	On-Demand	Anodyne	EPHA2	46	36
CN(CCN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450576803	GG	On-Demand	Anodyne	PDS	50	38
CN(CCN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450576804	GG	On-Demand	Anodyne	PDS	50	38
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576805	CF	On-Demand	Anodyne	COLA	52	40
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576805	CF	On-Demand	Anodyne	CPT1A	35	40
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576807	CF	On-Demand	Anodyne	COLA	52	40
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(C)n1	ZINC000450576807	CF	On-Demand	Anodyne	CPT1A	35	40
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576808	CF	On-Demand	Anodyne	COLA	52	40
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576808	CF	On-Demand	Anodyne	CPT1A	35	40
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576809	CF	On-Demand	Anodyne	COLA	52	40
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(C)n1	ZINC000450576809	CF	On-Demand	Anodyne	CPT1A	35	40
COc1cc(NC(=O)CN(C)C[C@](C)(O)C(C)=O)cc(OC)c1	ZINC000450576849	DC	On-Demand	Anodyne	LTA4H	15	40
COc1cc(NC(=O)CN(C)C[C@@](C)(O)C(C)=O)cc(OC)c1	ZINC000450576850	DC	On-Demand	Anodyne	LTA4H	15	40
CCCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450576856	DG	On-Demand	Anodyne	MAOA	17	41
CCCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450576856	DG	On-Demand	Anodyne	MAOB	53	41
CCCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450576856	DG	On-Demand	Anodyne	CA7	21	49
CCCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450576856	DG	On-Demand	Anodyne	PLA2G4B	46	39
CCCOc1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450576856	DG	On-Demand	Anodyne	FFAR1	44	38
COCCn1c(SCC(=O)CC[C@@H]2CCCCO2)nc2ccccc21	ZINC000450576860	FH	On-Demand	Anodyne	HRH1	0	42
COCCn1c(SCC(=O)CC[C@H]2CCCCO2)nc2ccccc21	ZINC000450576862	FH	On-Demand	Anodyne	HRH1	0	42
CCOC(=O)c1ccc(CN(C)CC(=O)Nc2cc(OC)cc(OC)c2)nc1	ZINC000450576865	GE	On-Demand	Anodyne	P2RY12	21	41
C[C@@H]1CCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)[C@H]1CO	ZINC000450576878	EG	On-Demand	Anodyne	TRPC6	45	32
C[C@@H]1CCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)[C@@H]1CO	ZINC000450576879	EG	On-Demand	Anodyne	TRPC6	45	32
C[C@H]1CCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)[C@@H]1CO	ZINC000450576880	EG	On-Demand	Anodyne	TRPC6	45	32
C[C@H]1CCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)[C@H]1CO	ZINC000450576881	EG	On-Demand	Anodyne	TRPC6	45	32
C[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)[C@@H]1CO	ZINC000450576884	DE	On-Demand	Anodyne	SLC6A1	69	33
C[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)[C@@H]1CO	ZINC000450576884	DE	On-Demand	Anodyne	PREP	80	38
C[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)[C@@H]1CO	ZINC000450576885	DE	On-Demand	Anodyne	SLC6A1	69	33
C[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)[C@@H]1CO	ZINC000450576885	DE	On-Demand	Anodyne	PREP	80	38
C[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)[C@H]1CO	ZINC000450576886	DE	On-Demand	Anodyne	SLC6A1	69	33
C[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)[C@H]1CO	ZINC000450576886	DE	On-Demand	Anodyne	PREP	80	38
C[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)[C@H]1CO	ZINC000450576887	DE	On-Demand	Anodyne	SLC6A1	69	33
C[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)[C@H]1CO	ZINC000450576887	DE	On-Demand	Anodyne	PREP	80	38
CNS(=O)(=O)c1ccc(N2CCC3(CCC(O)CC3)CC2)c(F)c1	ZINC000450576899	FE	On-Demand	Anodyne	SLC6A9	22	45
NC(=O)N1CCC[C@H](C(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)C1	ZINC000450576900	ED	On-Demand	Anodyne	DPP7	51	43
NC(=O)N1CCC[C@@H](C(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)C1	ZINC000450576901	ED	On-Demand	Anodyne	DPP7	51	43
NC(=O)N1CCC[C@H](C(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)C1	ZINC000450576902	ED	On-Demand	Anodyne	DPP7	51	43
NC(=O)N1CCC[C@@H](C(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)C1	ZINC000450576903	ED	On-Demand	Anodyne	DPP7	51	43
CC(=O)c1cc(Cl)ccc1OCc1cc(C(C)(C)C)on1	ZINC000450576918	DI	On-Demand	Anodyne	PTGER1	58	38
CC(=O)c1cc(Cl)ccc1OCc1cc(C(C)(C)C)on1	ZINC000450576918	DI	On-Demand	Anodyne	FLT3	41	37
CC(F)(F)CCSc1nnc(-c2ccc(Br)cc2)o1	ZINC000450576929	EJ	On-Demand	Anodyne	TYMS	0	42
CC(F)(F)CCSc1nnc(-c2ccc(Br)cc2)o1	ZINC000450576929	EJ	On-Demand	Anodyne	TERT	22	45
Cc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450576935	EF	On-Demand	Anodyne	DRD2	36	48
Cc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450576935	EF	On-Demand	Anodyne	DRD1	28	58
Cc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450576935	EF	On-Demand	Anodyne	DRD4	24	48
Cc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450576935	EF	On-Demand	Anodyne	SLC18A3	0	47
Cc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450576935	EF	On-Demand	Anodyne	HTR3B	0	46
Cc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450576935	EF	On-Demand	Anodyne	NET	0	53
Cc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450576935	EF	On-Demand	Anodyne	AP2S1	0	48
Cc1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)no1	ZINC000450577003	GJ	On-Demand	Anodyne	CPT1A	38	40
CC(=O)c1ccc(NC2CC(C)(F)C2)c([N+](=O)[O-])c1	ZINC000450577008	CG	On-Demand	Bother	AKR1C3	16	42
CCOC1(C)CN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C1	ZINC000450577021	CD	On-Demand	Bother	TAAR1	19	41
COc1cc(CC(=O)N2C[C@H](N3CCCC3)[C@H](SC)C2)ccc1Cl	ZINC000450577029	FF	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2C[C@H](N3CCCC3)[C@H](SC)C2)ccc1Cl	ZINC000450577029	FF	On-Demand	Anodyne	OPRK1	48	44
COc1cc(CC(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)ccc1Cl	ZINC000450577030	FF	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)ccc1Cl	ZINC000450577030	FF	On-Demand	Anodyne	OPRK1	48	44
COc1cc(CC(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)ccc1Cl	ZINC000450577031	FF	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)ccc1Cl	ZINC000450577031	FF	On-Demand	Anodyne	OPRK1	48	44
COc1cc(CC(=O)N2C[C@H](SC)[C@H](N3CCCC3)C2)ccc1Cl	ZINC000450577032	FF	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2C[C@H](SC)[C@H](N3CCCC3)C2)ccc1Cl	ZINC000450577032	FF	On-Demand	Anodyne	OPRK1	48	44
CC1(F)CC(Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1	ZINC000450577045	DE	On-Demand	Bother	TBXA2R	21	42
c1ccc(-c2csc3ncnc(N4CC5(CC5)C4)c23)cc1	ZINC000450577051	CH	On-Demand	Anodyne	ADRB3	0	49
CSc1cccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450577052	EH	On-Demand	Anodyne	COLA	86	43
CSc1cccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450577052	EH	On-Demand	Anodyne	CPT1A	85	43
CSc1cccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450577052	EH	On-Demand	Anodyne	GRM5	15	49
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450577053	EH	On-Demand	Anodyne	COLA	86	43
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450577053	EH	On-Demand	Anodyne	CPT1A	85	43
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450577053	EH	On-Demand	Anodyne	GRM5	15	49
C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)[C@@H]1CO	ZINC000450577055	DG	On-Demand	Anodyne	UTS2R	44	30
C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)[C@H]1CO	ZINC000450577056	DG	On-Demand	Anodyne	UTS2R	44	30
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450577075	FJ	On-Demand	Anodyne	ADAM10	40	43
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450577075	FJ	On-Demand	Anodyne	ADAM33	0	40
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450577075	FJ	On-Demand	Anodyne	ADAM8	0	40
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)ccc1O	ZINC000450577081	EF	On-Demand	Anodyne	COLA	108	45
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)ccc1O	ZINC000450577082	EF	On-Demand	Anodyne	COLA	108	45
C[C@H](c1ccccc1)[C@H](O)CN1CCc2ccccc2[C@H]1CO	ZINC000450577101	DF	On-Demand	Anodyne	MTNR1B	28	46
C[C@H](c1ccccc1)[C@H](O)CN1CCc2ccccc2[C@@H]1CO	ZINC000450577102	DF	On-Demand	Anodyne	MTNR1B	28	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2ccccc2[C@@H]1CO	ZINC000450577103	DF	On-Demand	Anodyne	MTNR1B	28	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2ccccc2[C@H]1CO	ZINC000450577104	DF	On-Demand	Anodyne	MTNR1B	28	46
CCOC1(C)CN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450577127	FD	On-Demand	Bother	TAAR1	21	42
CCOC1(C)CN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450577128	FD	On-Demand	Bother	TAAR1	21	42
Cc1nc([C@H]2CCCCCN2C(=O)c2c(Br)cnn2C)no1	ZINC000450577135	FF	On-Demand	Anodyne	COLA	48	40
Cc1nc([C@H]2CCCCCN2C(=O)c2c(Br)cnn2C)no1	ZINC000450577135	FF	On-Demand	Anodyne	CPT1A	42	40
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2c2nc3ccccc3n2C)cc1	ZINC000450577136	GH	On-Demand	Anodyne	HRH1	25	42
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2c2nc3ccccc3n2C)cc1	ZINC000450577136	GH	On-Demand	Anodyne	HRH3	0	44
Cc1nc([C@@H]2CCCCCN2C(=O)c2c(Br)cnn2C)no1	ZINC000450577137	FF	On-Demand	Anodyne	COLA	48	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2c(Br)cnn2C)no1	ZINC000450577137	FF	On-Demand	Anodyne	CPT1A	42	40
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2c2nc3ccccc3n2C)cc1	ZINC000450577143	GH	On-Demand	Anodyne	HRH1	25	42
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2c2nc3ccccc3n2C)cc1	ZINC000450577143	GH	On-Demand	Anodyne	HRH3	0	44
COc1ccc(CNC(=O)CCN2CCC(c3cnc[nH]3)CC2)c(OC)c1	ZINC000450577153	FE	On-Demand	Anodyne	CARM1	45	32
CS(=O)(=O)CC1CCC(Nc2ncnc3c2cnn3-c2ccccc2)CC1	ZINC000450577159	GF	On-Demand	Anodyne	GPR119	21	42
COc1cc2c(NC3CCC(CS(C)(=O)=O)CC3)ncnc2cc1F	ZINC000450577173	FF	On-Demand	Anodyne	EGFR	37	43
COc1cc2c(NC3CCC(CS(C)(=O)=O)CC3)ncnc2cc1F	ZINC000450577173	FF	On-Demand	Anodyne	PDE3A	43	32
COc1cc2c(NC3CCC(CS(C)(=O)=O)CC3)ncnc2cc1F	ZINC000450577173	FF	On-Demand	Anodyne	FGFR1	0	41
COc1cc2c(NC3CCC(CS(C)(=O)=O)CC3)ncnc2cc1F	ZINC000450577173	FF	On-Demand	Anodyne	FLT1	24	41
COc1cc2c(NC3CCC(CS(C)(=O)=O)CC3)ncnc2cc1F	ZINC000450577173	FF	On-Demand	Anodyne	PDE3B	63	32
COc1cc2c(NC3CCC(CS(C)(=O)=O)CC3)ncnc2cc1F	ZINC000450577173	FF	On-Demand	Anodyne	EPHA2	45	35
CCS(=O)(=O)c1ccc(CN[C@@](C)(C(N)=O)c2cccc(Cl)c2)cc1	ZINC000450577174	GF	On-Demand	Anodyne	RORC	59	43
CCS(=O)(=O)c1ccc(CN[C@](C)(C(N)=O)c2cccc(Cl)c2)cc1	ZINC000450577175	GF	On-Demand	Anodyne	RORC	59	43
CCOC1(C)CN(c2c(C#N)cnc3c(F)ccc(Cl)c23)C1	ZINC000450577192	DH	On-Demand	Mild	MAP3K8	85	35
O=C(NC[C@@H](O)CCc1ccccc1)c1ccnc(OC(F)F)c1	ZINC000450577207	EE	On-Demand	Anodyne	KDM4E	23	46
O=C(NC[C@H](O)CCc1ccccc1)c1ccnc(OC(F)F)c1	ZINC000450577208	EE	On-Demand	Anodyne	KDM4E	23	46
Cc1cccc(Cl)c1CNC(C)(C)c1nc(C)c(C)s1	ZINC000450577211	DJ	On-Demand	Anodyne	EIF2AK1	41	36
OC1CCC2(CC1)CCN(c1ncc(-c3ccccc3)s1)CC2	ZINC000450577215	EI	On-Demand	Anodyne	LUCI_LUCLA	19	44
OC1CCC2(CC1)CCN(c1ncc(-c3ccccc3)s1)CC2	ZINC000450577215	EI	On-Demand	Anodyne	MLYCD	62	41
OC1CCC2(CC1)CCN(c1ccnc(C3CC3)n1)CC2	ZINC000450577216	CF	On-Demand	Anodyne	SORD	61	34
CCC(=O)CCCN1CCC[C@H]1c1nc2ccccc2n1C(C)C	ZINC000450577228	EJ	On-Demand	Anodyne	Q7YY07_CRYPV	56	33
CCC(=O)CCCN1CCC[C@@H]1c1nc2ccccc2n1C(C)C	ZINC000450577229	EJ	On-Demand	Anodyne	Q7YY07_CRYPV	56	33
O=C(Cc1ccccc1O[C@H]1CCOC1)NC[C@@H](O)CCc1ccccc1	ZINC000450577230	FF	On-Demand	Anodyne	PDEC	0	47
O=C(Cc1ccccc1O[C@H]1CCOC1)NC[C@H](O)CCc1ccccc1	ZINC000450577231	FF	On-Demand	Anodyne	PDEC	0	47
O=C(Cc1ccccc1O[C@@H]1CCOC1)NC[C@@H](O)CCc1ccccc1	ZINC000450577232	FF	On-Demand	Anodyne	PDEC	0	47
O=C(Cc1ccccc1O[C@@H]1CCOC1)NC[C@H](O)CCc1ccccc1	ZINC000450577233	FF	On-Demand	Anodyne	PDEC	0	47
CCn1nnc(C)c1COc1ccc(Cl)cc1C(C)=O	ZINC000450577236	CG	On-Demand	Anodyne	PTGER1	46	36
CCc1nc(C)c(COc2ccc(Cl)cc2C(C)=O)o1	ZINC000450577238	CH	On-Demand	Anodyne	PTGER1	51	37
COc1ccccc1-n1cnc2cc(C(=O)N3CCC[C@@H](C)[C@H]3CO)ccc21	ZINC000450577239	GG	On-Demand	Anodyne	HPGD	57	65
COc1ccccc1-n1cnc2cc(C(=O)N3CCC[C@H](C)[C@H]3CO)ccc21	ZINC000450577240	GG	On-Demand	Anodyne	HPGD	57	65
COc1ccccc1-n1cnc2cc(C(=O)N3CCC[C@@H](C)[C@@H]3CO)ccc21	ZINC000450577241	GG	On-Demand	Anodyne	HPGD	57	65
COc1ccccc1-n1cnc2cc(C(=O)N3CCC[C@H](C)[C@@H]3CO)ccc21	ZINC000450577242	GG	On-Demand	Anodyne	HPGD	57	65
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC2(CCC(O)CC2)CC1	ZINC000450577243	FI	On-Demand	Bother	SERPINE1	16	43
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC2(CCC(O)CC2)CC1	ZINC000450577243	FI	On-Demand	Bother	LIPG	49	33
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)[C@H]1CO	ZINC000450577244	EH	On-Demand	Anodyne	PRCP	48	36
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)[C@H]1CO	ZINC000450577244	EH	On-Demand	Anodyne	TRPC6	34	40
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)[C@H]1CO	ZINC000450577244	EH	On-Demand	Anodyne	TRPC3	23	40
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)[C@@H]1CO	ZINC000450577245	EH	On-Demand	Anodyne	PRCP	48	36
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)[C@@H]1CO	ZINC000450577245	EH	On-Demand	Anodyne	TRPC6	34	40
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)[C@@H]1CO	ZINC000450577245	EH	On-Demand	Anodyne	TRPC3	23	40
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)[C@H]1CO	ZINC000450577246	EH	On-Demand	Anodyne	PRCP	48	36
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)[C@H]1CO	ZINC000450577246	EH	On-Demand	Anodyne	TRPC6	34	40
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)[C@H]1CO	ZINC000450577246	EH	On-Demand	Anodyne	TRPC3	23	40
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)[C@@H]1CO	ZINC000450577247	EH	On-Demand	Anodyne	PRCP	48	36
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)[C@@H]1CO	ZINC000450577247	EH	On-Demand	Anodyne	TRPC6	34	40
C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)[C@@H]1CO	ZINC000450577247	EH	On-Demand	Anodyne	TRPC3	23	40
C[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H]1CO	ZINC000450577269	EE	On-Demand	Anodyne	HRH2	15	44
C[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H]1CO	ZINC000450577269	EE	On-Demand	Anodyne	UTS2R	46	32
C[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H]1CO	ZINC000450577269	EE	On-Demand	Anodyne	EPHX2	20	53
C[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H]1CO	ZINC000450577270	EE	On-Demand	Anodyne	HRH2	15	44
C[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H]1CO	ZINC000450577270	EE	On-Demand	Anodyne	UTS2R	46	32
C[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H]1CO	ZINC000450577270	EE	On-Demand	Anodyne	EPHX2	20	53
C[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H]1CO	ZINC000450577273	EE	On-Demand	Anodyne	HRH2	15	44
C[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H]1CO	ZINC000450577273	EE	On-Demand	Anodyne	UTS2R	46	32
C[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H]1CO	ZINC000450577273	EE	On-Demand	Anodyne	EPHX2	20	53
C[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H]1CO	ZINC000450577274	EE	On-Demand	Anodyne	HRH2	15	44
C[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H]1CO	ZINC000450577274	EE	On-Demand	Anodyne	UTS2R	46	32
C[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H]1CO	ZINC000450577274	EE	On-Demand	Anodyne	EPHX2	20	53
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	PAPA1_CARPA	49	36
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	CTRB1	25	40
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	MMP2	29	51
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	MMP3	47	47
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	CELA2A	22	40
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	MMP12	24	40
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	MMP1	23	43
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	AMP1_PLAFQ	48	42
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	GAG-PRO	54	38
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	BIRC2	30	40
CC(=O)N[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577300	DD	On-Demand	Anodyne	Q82323_9DELA	69	34
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	PAPA1_CARPA	49	36
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	CTRB1	25	40
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	MMP2	29	51
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	MMP3	47	47
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	CELA2A	22	40
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	MMP12	24	40
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	MMP1	23	43
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	AMP1_PLAFQ	48	42
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	GAG-PRO	54	38
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	BIRC2	30	40
CC(=O)N[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C(C)(C)C	ZINC000450577301	DD	On-Demand	Anodyne	Q82323_9DELA	69	34
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577312	EF	On-Demand	Anodyne	DRD3	0	43
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577312	EF	On-Demand	Anodyne	CAPN2	67	42
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577313	EF	On-Demand	Anodyne	DRD3	0	43
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577313	EF	On-Demand	Anodyne	CAPN2	67	42
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577316	EF	On-Demand	Anodyne	DRD3	0	43
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577316	EF	On-Demand	Anodyne	CAPN2	67	42
C[C@H](O)CCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577317	EF	On-Demand	Anodyne	DRD3	0	43
C[C@H](O)CCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577317	EF	On-Demand	Anodyne	CAPN2	67	42
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)o1	ZINC000450577318	GI	On-Demand	Anodyne	PRCP	15	40
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)o1	ZINC000450577318	GI	On-Demand	Anodyne	COLA	155	58
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)o1	ZINC000450577318	GI	On-Demand	Anodyne	CPT1A	145	58
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)o1	ZINC000450577318	GI	On-Demand	Anodyne	PREP	52	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCOCC2(CCOCC2)C1	ZINC000450577322	FG	On-Demand	Anodyne	CACNA1B	37	46
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCOCC2(CCOCC2)C1	ZINC000450577322	FG	On-Demand	Anodyne	SLC6A9	20	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCOCC2(CCOCC2)C1	ZINC000450577322	FG	On-Demand	Anodyne	EPHX2	17	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCOCC2(CCOCC2)C1	ZINC000450577322	FG	On-Demand	Anodyne	LRRK2	27	40
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)o1	ZINC000450577324	GI	On-Demand	Anodyne	PRCP	15	40
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)o1	ZINC000450577324	GI	On-Demand	Anodyne	COLA	155	58
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)o1	ZINC000450577324	GI	On-Demand	Anodyne	CPT1A	145	58
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)o1	ZINC000450577324	GI	On-Demand	Anodyne	PREP	52	40
Cc1nc([C@H]2CCCCCN2C(=O)c2ccsc2Br)no1	ZINC000450577326	FH	On-Demand	Anodyne	COLA	59	40
Cc1nc([C@H]2CCCCCN2C(=O)c2ccsc2Br)no1	ZINC000450577326	FH	On-Demand	Anodyne	CPT1A	50	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccsc2Br)no1	ZINC000450577328	FH	On-Demand	Anodyne	COLA	59	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccsc2Br)no1	ZINC000450577328	FH	On-Demand	Anodyne	CPT1A	50	40
Cc1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)no1	ZINC000450577330	FI	On-Demand	Anodyne	COLA	83	44
Cc1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)no1	ZINC000450577330	FI	On-Demand	Anodyne	CPT1A	81	44
Cc1ccc(C2=CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450577337	GJ	On-Demand	Anodyne	PRCP	54	41
Cc1ccc(C2=CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450577338	GJ	On-Demand	Anodyne	PRCP	54	41
Cc1ccc(C2=CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450577339	GJ	On-Demand	Anodyne	PRCP	54	41
Cc1ccc(C2=CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)cn1	ZINC000450577340	GJ	On-Demand	Anodyne	PRCP	54	41
C=CCOc1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)cc1	ZINC000450577341	FH	On-Demand	Mild	COLA	138	51
C=CCOc1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)cc1	ZINC000450577341	FH	On-Demand	Mild	CPT1A	118	51
C=CCOc1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)cc1	ZINC000450577342	FH	On-Demand	Mild	COLA	138	51
C=CCOc1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)cc1	ZINC000450577342	FH	On-Demand	Mild	CPT1A	118	51
COc1cc(CN2CCc3ccccc3[C@@H]2CO)ccc1Cl	ZINC000450577343	DG	On-Demand	Anodyne	HCRTR1	20	42
COc1cc(CN2CCc3ccccc3[C@H]2CO)ccc1Cl	ZINC000450577345	DG	On-Demand	Anodyne	HCRTR1	20	42
CS(=O)(=O)CC1CCC(Nc2ccc([N+](=O)[O-])cc2OC(F)F)CC1	ZINC000450577365	GG	On-Demand	Bother	CYP19A1	15	52
O=C(c1ccsn1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450577381	FH	On-Demand	Anodyne	COLA	118	51
O=C(c1ccsn1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450577381	FH	On-Demand	Anodyne	CPT1A	100	48
COC(=O)c1csc(CN2CCC(Nc3cc(OC)cc(OC)c3)CC2)n1	ZINC000450577382	GG	On-Demand	Anodyne	SSTR5	55	37
COC(=O)c1csc(CN2CCC(Nc3cc(OC)cc(OC)c3)CC2)n1	ZINC000450577382	GG	On-Demand	Anodyne	MCHR1	20	43
O=C(c1ccsn1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450577383	FH	On-Demand	Anodyne	COLA	118	51
O=C(c1ccsn1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450577383	FH	On-Demand	Anodyne	CPT1A	100	48
CCOC1(C)CN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450577385	DE	On-Demand	Anodyne	LRRK2	23	42
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)on1	ZINC000450577458	EE	On-Demand	Anodyne	CPT1A	65	41
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)on1	ZINC000450577463	EE	On-Demand	Anodyne	CPT1A	65	41
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	DRD2	21	48
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	DRD4	37	48
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	ACHE	23	42
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	DRD3	23	48
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	KCNH2	18	45
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	CHRM3	25	40
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	SSTR5	63	39
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	CCR3	63	45
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	BDKRB1	31	40
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	CCR2	20	42
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	MCHR1	47	52
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577466	GI	On-Demand	Anodyne	BIRC2	42	36
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	DRD2	21	48
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	DRD4	37	48
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	ACHE	23	42
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	DRD3	23	48
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	KCNH2	18	45
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	CHRM3	25	40
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	SSTR5	63	39
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	CCR3	63	45
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	BDKRB1	31	40
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	CCR2	20	42
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	MCHR1	47	52
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1	ZINC000450577467	GI	On-Demand	Anodyne	BIRC2	42	36
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577469	EE	On-Demand	Anodyne	HDAC1	27	41
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577469	EE	On-Demand	Anodyne	FASN	16	40
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577469	EE	On-Demand	Anodyne	HPGDS	17	42
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577470	EE	On-Demand	Anodyne	HDAC1	27	41
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577470	EE	On-Demand	Anodyne	FASN	16	40
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577470	EE	On-Demand	Anodyne	HPGDS	17	42
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577471	EE	On-Demand	Anodyne	HDAC1	27	41
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577471	EE	On-Demand	Anodyne	FASN	16	40
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577471	EE	On-Demand	Anodyne	HPGDS	17	42
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577472	EE	On-Demand	Anodyne	HDAC1	27	41
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577472	EE	On-Demand	Anodyne	FASN	16	40
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450577472	EE	On-Demand	Anodyne	HPGDS	17	42
COC(=O)c1ccc(CN2CCC(c3cnc[nH]3)CC2)cc1Cl	ZINC000450577485	EG	On-Demand	Anodyne	SIGMAR1	23	42
COC(=O)c1ccc(CN2CCC(c3cnc[nH]3)CC2)cc1Cl	ZINC000450577485	EG	On-Demand	Anodyne	SSTR5	41	35
COC(=O)c1ccc(CN2CCC(c3cnc[nH]3)CC2)cc1Cl	ZINC000450577485	EG	On-Demand	Anodyne	MCHR1	38	44
COc1ccc2nc(SCCC(C)(F)F)[nH]c2c1	ZINC000450577496	CH	On-Demand	Anodyne	CYP2C8	36	56
COc1ccc2nc(SCCC(C)(F)F)[nH]c2c1	ZINC000450577496	CH	On-Demand	Anodyne	CYP1A2	29	70
COc1ccc2nc(SCCC(C)(F)F)[nH]c2c1	ZINC000450577496	CH	On-Demand	Anodyne	CYP2C19	51	66
C[C@@H]1CCCN(C(=O)CCc2ccc(C(N)=O)cc2)[C@H]1CO	ZINC000450577498	DD	On-Demand	Anodyne	PREP	45	37
Cc1nc2ccnn2cc1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450577502	DD	On-Demand	Anodyne	DDR1	41	33
Cc1nc2ccnn2cc1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450577503	DD	On-Demand	Anodyne	DDR1	41	33
C[C@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)[C@@H]1CO	ZINC000450577509	CD	On-Demand	Anodyne	ENPP2	18	45
C[C@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)[C@@H]1CO	ZINC000450577509	CD	On-Demand	Anodyne	HPGDS	15	41
C[C@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)[C@H]1CO	ZINC000450577510	CD	On-Demand	Anodyne	ENPP2	18	45
C[C@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)[C@H]1CO	ZINC000450577510	CD	On-Demand	Anodyne	HPGDS	15	41
C[C@@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)[C@H]1CO	ZINC000450577511	CD	On-Demand	Anodyne	ENPP2	18	45
C[C@@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)[C@H]1CO	ZINC000450577511	CD	On-Demand	Anodyne	HPGDS	15	41
C[C@@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)[C@@H]1CO	ZINC000450577512	CD	On-Demand	Anodyne	ENPP2	18	45
C[C@@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)[C@@H]1CO	ZINC000450577512	CD	On-Demand	Anodyne	HPGDS	15	41
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	HTR1A	23	62
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	DRD2	31	48
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	DRD1	26	54
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	DRD4	29	62
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	HTR2A	29	62
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	HTR2C	21	51
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	DRD3	21	62
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	DRD5	16	42
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	HTR7	29	48
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	SIGMAR1	17	56
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	NET	0	50
O=C(CCCN1CCN(Cc2nccn2C(F)F)CC1)c1ccc(F)cc1	ZINC000450577525	GG	On-Demand	Anodyne	AP2S1	0	48
CCOC(=O)c1ccc(CN2CCC[C@H]2c2nc3ccccc3n2C(C)C)nc1	ZINC000450577541	GJ	On-Demand	Anodyne	PDE6D	46	33
CCOC(=O)c1ccc(CN2CCC[C@@H]2c2nc3ccccc3n2C(C)C)nc1	ZINC000450577542	GJ	On-Demand	Anodyne	PDE6D	46	33
O=C(CCc1ccc2ccccc2c1O)NC[C@@H](O)CCc1ccccc1	ZINC000450577562	FH	On-Demand	Anodyne	ALOX5	15	45
O=C(CCc1ccc2ccccc2c1O)NC[C@H](O)CCc1ccccc1	ZINC000450577563	FH	On-Demand	Anodyne	ALOX5	15	45
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2cc(F)c(C)cc2F)no1	ZINC000450577580	EH	On-Demand	Anodyne	COLA	104	45
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2cc(F)c(C)cc2F)no1	ZINC000450577580	EH	On-Demand	Anodyne	CPT1A	101	45
Cc1nc([C@H]2CCCCCN2C(=O)Cc2cc(F)c(C)cc2F)no1	ZINC000450577583	EH	On-Demand	Anodyne	COLA	104	45
Cc1nc([C@H]2CCCCCN2C(=O)Cc2cc(F)c(C)cc2F)no1	ZINC000450577583	EH	On-Demand	Anodyne	CPT1A	101	45
O=C1CC[C@@H](CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577584	GF	On-Demand	Anodyne	DRD4	24	48
O=C1CC[C@@H](CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577584	GF	On-Demand	Anodyne	CCR3	32	42
O=C1CC[C@@H](CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577584	GF	On-Demand	Anodyne	PLD2	55	39
O=C1CC[C@H](CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577585	GF	On-Demand	Anodyne	DRD4	24	48
O=C1CC[C@H](CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577585	GF	On-Demand	Anodyne	CCR3	32	42
O=C1CC[C@H](CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577585	GF	On-Demand	Anodyne	PLD2	55	39
O=C1CC[C@@H](CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577587	GF	On-Demand	Anodyne	DRD4	24	48
O=C1CC[C@@H](CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577587	GF	On-Demand	Anodyne	CCR3	32	42
O=C1CC[C@@H](CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577587	GF	On-Demand	Anodyne	PLD2	55	39
O=C1CC[C@H](CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577589	GF	On-Demand	Anodyne	DRD4	24	48
O=C1CC[C@H](CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577589	GF	On-Demand	Anodyne	CCR3	32	42
O=C1CC[C@H](CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCN1	ZINC000450577589	GF	On-Demand	Anodyne	PLD2	55	39
COc1cc(CC(=O)N2CCC[C@@H](C)[C@H]2CO)ccc1Cl	ZINC000450577602	DF	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2CCC[C@@H](C)[C@H]2CO)ccc1Cl	ZINC000450577602	DF	On-Demand	Anodyne	OPRK1	23	46
COc1cc(CC(=O)N2CCC[C@@H](C)[C@H]2CO)ccc1Cl	ZINC000450577602	DF	On-Demand	Anodyne	MTNR1B	25	40
COc1cc(CC(=O)N2CCC[C@H](C)[C@@H]2CO)ccc1Cl	ZINC000450577609	DF	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2CCC[C@H](C)[C@@H]2CO)ccc1Cl	ZINC000450577609	DF	On-Demand	Anodyne	OPRK1	23	46
COc1cc(CC(=O)N2CCC[C@H](C)[C@@H]2CO)ccc1Cl	ZINC000450577609	DF	On-Demand	Anodyne	MTNR1B	25	40
COc1ccc(NC(=O)C2(NCCC[C@H](C)O)CCCC2)cc1OC	ZINC000450577610	FF	On-Demand	Anodyne	ENPP1	59	34
COc1cc(CC(=O)N2CCC[C@@H](C)[C@@H]2CO)ccc1Cl	ZINC000450577611	DF	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2CCC[C@@H](C)[C@@H]2CO)ccc1Cl	ZINC000450577611	DF	On-Demand	Anodyne	OPRK1	23	46
COc1cc(CC(=O)N2CCC[C@@H](C)[C@@H]2CO)ccc1Cl	ZINC000450577611	DF	On-Demand	Anodyne	MTNR1B	25	40
COc1ccc(NC(=O)C2(NCCC[C@@H](C)O)CCCC2)cc1OC	ZINC000450577612	FF	On-Demand	Anodyne	ENPP1	59	34
CC[C@H](CO)N(C)c1ccnc(N2CCOCC2)n1	ZINC000450577613	CC	On-Demand	Anodyne	EPHB4	80	37
COc1cc(CC(=O)N2CCC[C@H](C)[C@H]2CO)ccc1Cl	ZINC000450577614	DF	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2CCC[C@H](C)[C@H]2CO)ccc1Cl	ZINC000450577614	DF	On-Demand	Anodyne	OPRK1	23	46
COc1cc(CC(=O)N2CCC[C@H](C)[C@H]2CO)ccc1Cl	ZINC000450577614	DF	On-Demand	Anodyne	MTNR1B	25	40
CC[C@@H](CO)N(C)c1ccnc(N2CCOCC2)n1	ZINC000450577616	CC	On-Demand	Anodyne	EPHB4	80	37
Cn1nc(C(=O)NC[C@@H](O)CCc2ccccc2)c2c1CCCC2	ZINC000450577622	EE	On-Demand	Anodyne	FABP4	43	33
Cn1nc(C(=O)NC[C@H](O)CCc2ccccc2)c2c1CCCC2	ZINC000450577623	EE	On-Demand	Anodyne	FABP4	43	33
C[C@@H]1CCCN(C(=O)CCc2ccc(C(N)=O)cc2)[C@@H]1CO	ZINC000450577630	DD	On-Demand	Anodyne	PREP	45	37
C[C@H]1CCCN(C(=O)CCc2ccc(C(N)=O)cc2)[C@@H]1CO	ZINC000450577632	DD	On-Demand	Anodyne	PREP	45	37
C[C@H]1CCCN(C(=O)CCc2ccc(C(N)=O)cc2)[C@H]1CO	ZINC000450577634	DD	On-Demand	Anodyne	PREP	45	37
CCCNC(=O)C1(NCc2cccc(C(=O)OC)c2Cl)CCCCC1	ZINC000450577644	FG	On-Demand	Anodyne	HCN1	49	30
CCCNC(=O)C1(NCc2cccc(C(=O)OC)c2Cl)CCCCC1	ZINC000450577644	FG	On-Demand	Anodyne	HCN4	47	30
CS(=O)(=O)CC1CCC(Nc2ncnc3sc4c(c23)CCCC4)CC1	ZINC000450577661	GH	On-Demand	Anodyne	IRAK4	18	63
Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c(O)n1	ZINC000450577666	CF	On-Demand	Anodyne	HRH3	28	40
Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c(O)n1	ZINC000450577669	CF	On-Demand	Anodyne	HRH3	28	40
CS(=O)(=O)CC1CCC(Nc2cnc3cc(Cl)c(Cl)cc3n2)CC1	ZINC000450577684	GH	On-Demand	Anodyne	GLP1R	52	35
Fc1ccc(-c2csc3ncnc(N4CC5(CC5)C4)c23)cc1	ZINC000450577692	DI	On-Demand	Anodyne	ADRB3	0	41
CCCNC(=O)C1(NCc2nnc(C(C)C)s2)CCCCC1	ZINC000450577693	DF	On-Demand	Anodyne	MME	21	40
O=C(N[C@@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450577698	FI	On-Demand	Anodyne	MCHR1	20	42
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450577699	CE	On-Demand	Anodyne	ACE	42	39
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450577699	CE	On-Demand	Anodyne	FKBP1A	68	41
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450577699	CE	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450577699	CE	On-Demand	Anodyne	SLC6A3	27	51
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450577699	CE	On-Demand	Anodyne	AGTR2	43	35
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450577699	CE	On-Demand	Anodyne	PREP	40	36
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450577699	CE	On-Demand	Anodyne	BIRC8	40	31
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450577700	CE	On-Demand	Anodyne	ACE	42	39
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450577700	CE	On-Demand	Anodyne	FKBP1A	68	41
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450577700	CE	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450577700	CE	On-Demand	Anodyne	SLC6A3	27	51
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450577700	CE	On-Demand	Anodyne	AGTR2	43	35
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450577700	CE	On-Demand	Anodyne	PREP	40	36
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450577700	CE	On-Demand	Anodyne	BIRC8	40	31
O=C(N[C@@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450577701	FI	On-Demand	Anodyne	MCHR1	20	42
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450577702	CE	On-Demand	Anodyne	ACE	42	39
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450577702	CE	On-Demand	Anodyne	FKBP1A	68	41
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450577702	CE	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450577702	CE	On-Demand	Anodyne	SLC6A3	27	51
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450577702	CE	On-Demand	Anodyne	AGTR2	43	35
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450577702	CE	On-Demand	Anodyne	PREP	40	36
COC(=O)[C@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450577702	CE	On-Demand	Anodyne	BIRC8	40	31
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450577704	CE	On-Demand	Anodyne	ACE	42	39
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450577704	CE	On-Demand	Anodyne	FKBP1A	68	41
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450577704	CE	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450577704	CE	On-Demand	Anodyne	SLC6A3	27	51
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450577704	CE	On-Demand	Anodyne	AGTR2	43	35
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450577704	CE	On-Demand	Anodyne	PREP	40	36
COC(=O)[C@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450577704	CE	On-Demand	Anodyne	BIRC8	40	31
O=C(N[C@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450577705	FI	On-Demand	Anodyne	MCHR1	20	42
O=C(N[C@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450577707	FI	On-Demand	Anodyne	MCHR1	20	42
Cc1cccc(CN(Cc2cn(CC3CC3)nn2)Cc2cccc(C)n2)n1	ZINC000450577724	FG	On-Demand	Anodyne	HSP90AB1	19	45
CCC1CCC(NC[C@H](O)Cc2ccccc2)(C(=O)OC)CC1	ZINC000450577725	DF	On-Demand	Anodyne	TIMP3	63	36
COc1ccc2nc(SCc3ccn(CC(F)(F)F)n3)[nH]c2c1	ZINC000450577737	EH	On-Demand	Anodyne	CYP2C8	35	53
COc1ccc2nc(SCc3ccn(CC(F)(F)F)n3)[nH]c2c1	ZINC000450577737	EH	On-Demand	Anodyne	CYP1A2	22	56
COc1ccc2nc(SCc3ccn(CC(F)(F)F)n3)[nH]c2c1	ZINC000450577737	EH	On-Demand	Anodyne	CYP2C19	46	56
CCCCNC(=O)C1(NCc2nc(-c3ccc(OC)nn3)no2)CCCCC1	ZINC000450577749	GE	On-Demand	Anodyne	NPPA	50	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450577750	GI	On-Demand	Anodyne	COLA	123	55
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450577750	GI	On-Demand	Anodyne	CPT1A	118	55
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450577750	GI	On-Demand	Anodyne	GRM5	18	43
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450577751	GI	On-Demand	Anodyne	COLA	123	55
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450577751	GI	On-Demand	Anodyne	CPT1A	118	55
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450577751	GI	On-Demand	Anodyne	GRM5	18	43
COc1ccc2c(c1OC)CCN(C(=O)C1(Cc3ccccc3)CCOCC1)C2	ZINC000450577753	GH	On-Demand	Anodyne	AGTR2	50	38
COc1cc(CN2CCC(c3cnc[nH]3)CC2)ccc1Cl	ZINC000450577769	DG	On-Demand	Anodyne	HRH1	15	42
COc1cc(CN2CCC(c3cnc[nH]3)CC2)ccc1Cl	ZINC000450577769	DG	On-Demand	Anodyne	SSTR5	62	41
COc1cc(CN2CCC(c3cnc[nH]3)CC2)ccc1Cl	ZINC000450577769	DG	On-Demand	Anodyne	MCHR1	16	41
COc1cc(NC2CCN(C[C@@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577779	GH	On-Demand	Anodyne	DRD4	19	42
COc1cc(NC2CCN(C[C@@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577779	GH	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cc(NC2CCN(C[C@@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577779	GH	On-Demand	Anodyne	SIGMAR1	26	42
COc1cc(NC2CCN(C[C@@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577779	GH	On-Demand	Anodyne	SSTR5	43	35
COc1cc(NC2CCN(C[C@@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577779	GH	On-Demand	Anodyne	CCR3	17	40
COc1cc(NC2CCN(C[C@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577780	GH	On-Demand	Anodyne	DRD4	19	42
COc1cc(NC2CCN(C[C@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577780	GH	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cc(NC2CCN(C[C@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577780	GH	On-Demand	Anodyne	SIGMAR1	26	42
COc1cc(NC2CCN(C[C@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577780	GH	On-Demand	Anodyne	SSTR5	43	35
COc1cc(NC2CCN(C[C@H](Cc3ccccc3)OC)CC2)cc(OC)c1	ZINC000450577780	GH	On-Demand	Anodyne	CCR3	17	40
CCOC1(C)CN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450577782	GD	On-Demand	Bother	PHOSPHO1	0	42
CCOC1(C)CN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450577782	GD	On-Demand	Bother	PMM2	0	42
C[C@@H](c1ccc(CN[C@@](C)(C(N)=O)c2cccc(Cl)c2)cc1)C(F)(F)F	ZINC000450577788	GI	On-Demand	Anodyne	PDS	55	39
C[C@H](c1ccc(CN[C@@](C)(C(N)=O)c2cccc(Cl)c2)cc1)C(F)(F)F	ZINC000450577789	GI	On-Demand	Anodyne	PDS	55	39
C[C@@H](c1ccc(CN[C@](C)(C(N)=O)c2cccc(Cl)c2)cc1)C(F)(F)F	ZINC000450577790	GI	On-Demand	Anodyne	PDS	55	39
C[C@H](c1ccc(CN[C@](C)(C(N)=O)c2cccc(Cl)c2)cc1)C(F)(F)F	ZINC000450577791	GI	On-Demand	Anodyne	PDS	55	39
COc1cc(NC2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)cc(OC)c1	ZINC000450577798	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
COc1cc(NC2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)cc(OC)c1	ZINC000450577798	GH	On-Demand	Anodyne	CCR3	20	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(-c3cnn(C)c3)o2)no1	ZINC000450577799	FG	On-Demand	Anodyne	COLA	44	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(-c3cnn(C)c3)o2)no1	ZINC000450577799	FG	On-Demand	Anodyne	CPT1A	39	40
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(-c3cnn(C)c3)o2)no1	ZINC000450577800	FG	On-Demand	Anodyne	COLA	44	40
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(-c3cnn(C)c3)o2)no1	ZINC000450577800	FG	On-Demand	Anodyne	CPT1A	39	40
CCOC1(C)CN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450577806	CG	On-Demand	Anodyne	GRM5	22	43
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)[nH]c1C	ZINC000450577819	FF	On-Demand	Anodyne	COLA	61	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)[nH]c1C	ZINC000450577819	FF	On-Demand	Anodyne	CPT1A	49	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)[nH]c1C	ZINC000450577820	FF	On-Demand	Anodyne	COLA	61	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)[nH]c1C	ZINC000450577820	FF	On-Demand	Anodyne	CPT1A	49	40
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	DRD2	15	42
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	DRD4	33	50
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	DRD3	27	41
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	ACOX1	41	35
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	CCR3	28	40
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	CYP2D6	0	41
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	ABCB1	52	39
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	MCHR1	19	53
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577827	GE	On-Demand	Anodyne	BIRC2	43	40
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	DRD2	15	42
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	DRD4	33	50
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	DRD3	27	41
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	ACOX1	41	35
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	CCR3	28	40
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	CYP2D6	0	41
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	ABCB1	52	39
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	MCHR1	19	53
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577828	GE	On-Demand	Anodyne	BIRC2	43	40
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	DRD2	15	42
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	DRD4	33	50
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	DRD3	27	41
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	ACOX1	41	35
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	CCR3	28	40
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	CYP2D6	0	41
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	ABCB1	52	39
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	MCHR1	19	53
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577829	GE	On-Demand	Anodyne	BIRC2	43	40
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	DRD2	15	42
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	DRD4	33	50
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	DRD3	27	41
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	ACOX1	41	35
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	CCR3	28	40
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	CYP2D6	0	41
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	ABCB1	52	39
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	MCHR1	19	53
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450577830	GE	On-Demand	Anodyne	BIRC2	43	40
CS[C@H]1CN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C[C@@H]1N1CCCC1	ZINC000450577831	GH	On-Demand	Anodyne	L3MBTL3	55	35
CS[C@H]1CN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C[C@H]1N1CCCC1	ZINC000450577832	GH	On-Demand	Anodyne	L3MBTL3	55	35
CS[C@@H]1CN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C[C@@H]1N1CCCC1	ZINC000450577833	GH	On-Demand	Anodyne	L3MBTL3	55	35
CS[C@@H]1CN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C[C@H]1N1CCCC1	ZINC000450577834	GH	On-Demand	Anodyne	L3MBTL3	55	35
CC1(F)CC(Nc2ncnc3cc(Br)ccc23)C1	ZINC000450577848	DH	On-Demand	Anodyne	EGFR	68	40
CC1(F)CC(Nc2ncnc3cc(Br)ccc23)C1	ZINC000450577848	DH	On-Demand	Anodyne	CD38	41	36
COc1cc(NC2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)cc(OC)c1	ZINC000450577849	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
COc1cc(NC2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)cc(OC)c1	ZINC000450577849	GH	On-Demand	Anodyne	CCR3	20	40
COc1cc(NC2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)cc(OC)c1	ZINC000450577851	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
COc1cc(NC2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)cc(OC)c1	ZINC000450577851	GH	On-Demand	Anodyne	CCR3	20	40
COc1cc(NC2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)cc(OC)c1	ZINC000450577852	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
COc1cc(NC2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)cc(OC)c1	ZINC000450577852	GH	On-Demand	Anodyne	CCR3	20	40
CS(=O)(=O)CC1CCC(Nc2nccc(OCc3ccccc3)n2)CC1	ZINC000450577861	GG	On-Demand	Anodyne	MAPK9	41	41
CS(=O)(=O)CC1CCC(Nc2nccc(OCc3ccccc3)n2)CC1	ZINC000450577861	GG	On-Demand	Anodyne	MAPK10	0	41
CS(=O)(=O)CC1CCC(Nc2nccc(OCc3ccccc3)n2)CC1	ZINC000450577861	GG	On-Demand	Anodyne	MAPK8	43	41
CC1(F)CC(N=c2c([N+](=O)[O-])c[nH]c3ccccc23)C1	ZINC000450577867	CF	On-Demand	Bother	NMBR	46	30
Cc1cccc(Cl)c1C(=O)N1CCC2(CCCN2C)CC1	ZINC000450577870	DG	On-Demand	Anodyne	CCR5	30	42
CNS(=O)(=O)C[C@@H]1CCCN1Cc1cccc(C(C)=O)c1	ZINC000450577871	DD	On-Demand	Anodyne	TRY2_BOVIN	58	32
CNS(=O)(=O)C[C@H]1CCCN1Cc1cccc(C(C)=O)c1	ZINC000450577872	DD	On-Demand	Anodyne	TRY2_BOVIN	58	32
C[C@@H]1CCCN(C(=O)COc2cccc(Br)c2C#N)[C@@H]1CO	ZINC000450577884	FE	On-Demand	Mild	CPT1A	71	39
C[C@H]1CCCN(C(=O)COc2cccc(Br)c2C#N)[C@H]1CO	ZINC000450577886	FE	On-Demand	Mild	CPT1A	71	39
C[C@@H]1CCCN(C(=O)COc2cccc(Br)c2C#N)[C@H]1CO	ZINC000450577887	FE	On-Demand	Mild	CPT1A	71	39
C[C@H]1CCCN(C(=O)COc2cccc(Br)c2C#N)[C@@H]1CO	ZINC000450577889	FE	On-Demand	Mild	CPT1A	71	39
CCNC(=O)c1ccc(N2CC(C)(OCC)C2)nn1	ZINC000450577906	CC	On-Demand	Anodyne	SCD1	42	39
CCNC(=O)c1ccc(N2CC(C)(OCC)C2)nn1	ZINC000450577906	CC	On-Demand	Anodyne	SCD	23	40
C[C@@H]1CCCN(C(=O)Cc2cc3ccccc3s2)[C@H]1CO	ZINC000450577924	DG	On-Demand	Anodyne	PREP	45	33
C[C@@H]1CCCN(C(=O)Cc2cc3ccccc3s2)[C@H]1CO	ZINC000450577924	DG	On-Demand	Anodyne	TRPC6	45	32
C[C@@H]1CCCN(C(=O)Cc2cc3ccccc3s2)[C@@H]1CO	ZINC000450577925	DG	On-Demand	Anodyne	PREP	45	33
C[C@@H]1CCCN(C(=O)Cc2cc3ccccc3s2)[C@@H]1CO	ZINC000450577925	DG	On-Demand	Anodyne	TRPC6	45	32
C[C@H]1CCCN(C(=O)Cc2cc3ccccc3s2)[C@@H]1CO	ZINC000450577926	DG	On-Demand	Anodyne	PREP	45	33
C[C@H]1CCCN(C(=O)Cc2cc3ccccc3s2)[C@@H]1CO	ZINC000450577926	DG	On-Demand	Anodyne	TRPC6	45	32
C[C@H]1CCCN(C(=O)Cc2cc3ccccc3s2)[C@H]1CO	ZINC000450577927	DG	On-Demand	Anodyne	PREP	45	33
C[C@H]1CCCN(C(=O)Cc2cc3ccccc3s2)[C@H]1CO	ZINC000450577927	DG	On-Demand	Anodyne	TRPC6	45	32
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C#N)n2C)no1	ZINC000450577929	DE	On-Demand	Mild	CPT1A	30	41
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C#N)n2C)no1	ZINC000450577931	DE	On-Demand	Mild	CPT1A	30	41
CCOC1(C)CN(c2ccnc(C(=O)NCc3ccccc3)c2)C1	ZINC000450577932	EF	On-Demand	Anodyne	RPS27	24	42
CCOC1(C)CN(c2ccnc(C(=O)NCc3ccccc3)c2)C1	ZINC000450577932	EF	On-Demand	Anodyne	PDS	44	35
CC[C@@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577940	CD	On-Demand	Anodyne	PAPA1_CARPA	45	33
CC[C@@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577940	CD	On-Demand	Anodyne	CYSP_TRYCR	40	35
CC[C@@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577940	CD	On-Demand	Anodyne	CAPNS1	40	32
CC[C@@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577940	CD	On-Demand	Anodyne	HLA-DRB1	41	32
CC[C@@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577940	CD	On-Demand	Anodyne	CAPN2	45	32
CC[C@@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577940	CD	On-Demand	Anodyne	CTRB_BOVIN	45	33
CC[C@@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577940	CD	On-Demand	Anodyne	PDS	40	34
CC[C@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577941	CD	On-Demand	Anodyne	PAPA1_CARPA	45	33
CC[C@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577941	CD	On-Demand	Anodyne	CYSP_TRYCR	40	35
CC[C@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577941	CD	On-Demand	Anodyne	CAPNS1	40	32
CC[C@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577941	CD	On-Demand	Anodyne	HLA-DRB1	41	32
CC[C@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577941	CD	On-Demand	Anodyne	CAPN2	45	32
CC[C@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577941	CD	On-Demand	Anodyne	CTRB_BOVIN	45	33
CC[C@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577941	CD	On-Demand	Anodyne	PDS	40	34
CC[C@@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577942	CD	On-Demand	Anodyne	PAPA1_CARPA	45	33
CC[C@@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577942	CD	On-Demand	Anodyne	CYSP_TRYCR	40	35
CC[C@@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577942	CD	On-Demand	Anodyne	CAPNS1	40	32
CC[C@@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577942	CD	On-Demand	Anodyne	HLA-DRB1	41	32
CC[C@@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577942	CD	On-Demand	Anodyne	CAPN2	45	32
CC[C@@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577942	CD	On-Demand	Anodyne	CTRB_BOVIN	45	33
CC[C@@](C)(NC[C@@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577942	CD	On-Demand	Anodyne	PDS	40	34
CC[C@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577943	CD	On-Demand	Anodyne	PAPA1_CARPA	45	33
CC[C@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577943	CD	On-Demand	Anodyne	CYSP_TRYCR	40	35
CC[C@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577943	CD	On-Demand	Anodyne	CAPNS1	40	32
CC[C@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577943	CD	On-Demand	Anodyne	HLA-DRB1	41	32
CC[C@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577943	CD	On-Demand	Anodyne	CAPN2	45	32
CC[C@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577943	CD	On-Demand	Anodyne	CTRB_BOVIN	45	33
CC[C@](C)(NC[C@H](Cc1ccccc1)OC)C(N)=O	ZINC000450577943	CD	On-Demand	Anodyne	PDS	40	34
CN(CCN1C[C@H]2CCC[C@@H]21)Cc1ccccc1	ZINC000450577944	BF	On-Demand	Anodyne	SLC18A2	26	41
CN(CCN1C[C@H]2CCC[C@@H]21)Cc1ccccc1	ZINC000450577944	BF	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCN1C[C@@H]2CCC[C@@H]21)Cc1ccccc1	ZINC000450577945	BF	On-Demand	Anodyne	SLC18A2	26	41
CN(CCN1C[C@@H]2CCC[C@@H]21)Cc1ccccc1	ZINC000450577945	BF	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCN1C[C@H]2CCC[C@H]21)Cc1ccccc1	ZINC000450577946	BF	On-Demand	Anodyne	SLC18A2	26	41
CN(CCN1C[C@H]2CCC[C@H]21)Cc1ccccc1	ZINC000450577946	BF	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCN1C[C@@H]2CCC[C@H]21)Cc1ccccc1	ZINC000450577947	BF	On-Demand	Anodyne	SLC18A2	26	41
CN(CCN1C[C@@H]2CCC[C@H]21)Cc1ccccc1	ZINC000450577947	BF	On-Demand	Anodyne	SIGMAR1	26	43
C[C@@H]1CCCN(C(=O)c2cccc3c2CCCC3)[C@@H]1CO	ZINC000450577953	CF	On-Demand	Anodyne	FABP4	44	34
C[C@@H]1CCCN(C(=O)c2cccc3c2CCCC3)[C@H]1CO	ZINC000450577954	CF	On-Demand	Anodyne	FABP4	44	34
C[C@H]1CCCN(C(=O)c2cccc3c2CCCC3)[C@H]1CO	ZINC000450577955	CF	On-Demand	Anodyne	FABP4	44	34
C[C@H]1CCCN(C(=O)c2cccc3c2CCCC3)[C@@H]1CO	ZINC000450577956	CF	On-Demand	Anodyne	FABP4	44	34
CC[C@@H](Nc1nc(-c2cccnc2)nc2sc3c(c12)CCCC3)C(N)=O	ZINC000450577964	FG	On-Demand	Anodyne	EEF2K	41	44
Cc1sc2ncnc(NC3CCC(CS(C)(=O)=O)CC3)c2c1C	ZINC000450577993	FG	On-Demand	Anodyne	IRAK4	17	40
COc1cc(NC(=O)CN(C)CCCC(=O)c2ccc(F)cc2)cc(OC)c1	ZINC000450577995	GG	On-Demand	Anodyne	LTA4H	27	55
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)CCOc1cccc(OC)c1	ZINC000450577996	EF	On-Demand	Anodyne	MTNR1A	31	43
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)CCOc1cccc(OC)c1	ZINC000450577997	EF	On-Demand	Anodyne	MTNR1A	31	43
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)CCOc1cccc(OC)c1	ZINC000450577998	EF	On-Demand	Anodyne	MTNR1A	31	43
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)CCOc1cccc(OC)c1	ZINC000450577999	EF	On-Demand	Anodyne	MTNR1A	31	43
C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@@H]1CO	ZINC000450578008	EG	On-Demand	Anodyne	RBP4	76	41
C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@@H]1CO	ZINC000450578008	EG	On-Demand	Anodyne	SFRP1	66	35
C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@@H]1CO	ZINC000450578008	EG	On-Demand	Anodyne	WNT3	71	36
C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@H]1CO	ZINC000450578009	EG	On-Demand	Anodyne	RBP4	76	41
C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@H]1CO	ZINC000450578009	EG	On-Demand	Anodyne	SFRP1	66	35
C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@H]1CO	ZINC000450578009	EG	On-Demand	Anodyne	WNT3	71	36
OC1CCC2(CC1)CCN(c1ncnc3cc(F)c(F)cc13)CC2	ZINC000450578012	EG	On-Demand	Anodyne	PDE3A	43	32
OC1CCC2(CC1)CCN(c1ncnc3cc(F)c(F)cc13)CC2	ZINC000450578012	EG	On-Demand	Anodyne	PDE3B	64	33
Cn1cc(Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c(C2CCCCC2)n1	ZINC000450578021	GH	On-Demand	Bother	TBXA2R	19	41
CC(F)(F)CCn1cnc2c(Cl)cc(Cl)cc2c1=O	ZINC000450578022	DH	On-Demand	Anodyne	Q9M629_MAIZE	42	30
Cc1cccc2c1C[C@@H](C(=O)NC[C@H](O)CCc1ccccc1)O2	ZINC000450578042	EE	On-Demand	Anodyne	MTNR1A	19	42
Cc1cccc2c1C[C@@H](C(=O)NC[C@H](O)CCc1ccccc1)O2	ZINC000450578042	EE	On-Demand	Anodyne	MTNR1B	15	45
Cc1cccc2c1C[C@@H](C(=O)NC[C@@H](O)CCc1ccccc1)O2	ZINC000450578043	EE	On-Demand	Anodyne	MTNR1A	19	42
Cc1cccc2c1C[C@@H](C(=O)NC[C@@H](O)CCc1ccccc1)O2	ZINC000450578043	EE	On-Demand	Anodyne	MTNR1B	15	45
Cc1cccc2c1C[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)O2	ZINC000450578044	EE	On-Demand	Anodyne	MTNR1A	19	42
Cc1cccc2c1C[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)O2	ZINC000450578044	EE	On-Demand	Anodyne	MTNR1B	15	45
Cc1cccc2c1C[C@H](C(=O)NC[C@H](O)CCc1ccccc1)O2	ZINC000450578045	EE	On-Demand	Anodyne	MTNR1A	19	42
Cc1cccc2c1C[C@H](C(=O)NC[C@H](O)CCc1ccccc1)O2	ZINC000450578045	EE	On-Demand	Anodyne	MTNR1B	15	45
O=C(NC[C@@H](O)CCc1ccccc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450578057	FE	On-Demand	Anodyne	CA2	27	44
O=C(NC[C@@H](O)CCc1ccccc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450578057	FE	On-Demand	Anodyne	TGM2	26	41
O=C(NC[C@@H](O)CCc1ccccc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450578057	FE	On-Demand	Anodyne	E1	0	40
O=C(NC[C@@H](O)CCc1ccccc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450578057	FE	On-Demand	Anodyne	LIMK2	41	35
O=C(NC[C@H](O)CCc1ccccc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450578058	FE	On-Demand	Anodyne	CA2	27	44
O=C(NC[C@H](O)CCc1ccccc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450578058	FE	On-Demand	Anodyne	TGM2	26	41
O=C(NC[C@H](O)CCc1ccccc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450578058	FE	On-Demand	Anodyne	E1	0	40
O=C(NC[C@H](O)CCc1ccccc1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450578058	FE	On-Demand	Anodyne	LIMK2	41	35
OC1CCC2(CC1)CCN(c1ncc(C(F)(F)F)s1)CC2	ZINC000450578060	DH	On-Demand	Anodyne	MLYCD	75	46
CC(C)O[C@@]1(C(=O)NC[C@H](O)CCc2ccccc2)CCOC1	ZINC000450578063	DD	On-Demand	Anodyne	CAPN2	45	32
CC(C)O[C@]1(C(=O)NC[C@@H](O)CCc2ccccc2)CCOC1	ZINC000450578064	DD	On-Demand	Anodyne	CAPN2	45	32
CC(C)O[C@]1(C(=O)NC[C@H](O)CCc2ccccc2)CCOC1	ZINC000450578065	DD	On-Demand	Anodyne	CAPN2	45	32
CC(C)O[C@@]1(C(=O)NC[C@@H](O)CCc2ccccc2)CCOC1	ZINC000450578066	DD	On-Demand	Anodyne	CAPN2	45	32
CCC(=O)c1cc(Br)ccc1OCc1oc(CC)nc1C	ZINC000450578067	FI	On-Demand	Anodyne	SLC22A12	56	33
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450578082	FF	On-Demand	Anodyne	ACE	28	43
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450578082	FF	On-Demand	Anodyne	CELA1	48	35
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450578082	FF	On-Demand	Anodyne	ELANE	50	39
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450578082	FF	On-Demand	Anodyne	LMCPB	0	42
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450578082	FF	On-Demand	Anodyne	FAP	0	51
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450578083	FF	On-Demand	Anodyne	ACE	28	43
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450578083	FF	On-Demand	Anodyne	CELA1	48	35
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450578083	FF	On-Demand	Anodyne	ELANE	50	39
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450578083	FF	On-Demand	Anodyne	LMCPB	0	42
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450578083	FF	On-Demand	Anodyne	FAP	0	51
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450578084	FF	On-Demand	Anodyne	ACE	28	43
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450578084	FF	On-Demand	Anodyne	CELA1	48	35
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450578084	FF	On-Demand	Anodyne	ELANE	50	39
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450578084	FF	On-Demand	Anodyne	LMCPB	0	42
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450578084	FF	On-Demand	Anodyne	FAP	0	51
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450578085	FF	On-Demand	Anodyne	ACE	28	43
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450578085	FF	On-Demand	Anodyne	CELA1	48	35
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450578085	FF	On-Demand	Anodyne	ELANE	50	39
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450578085	FF	On-Demand	Anodyne	LMCPB	0	42
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450578085	FF	On-Demand	Anodyne	FAP	0	51
COc1cccc2c(N3CCC4(CCC(O)CC4)CC3)nccc12	ZINC000450578095	EH	On-Demand	Anodyne	PDE3B	58	35
CN(C)c1nccc(N2CCC3(CCC(O)CC3)CC2)n1	ZINC000450578096	CE	On-Demand	Anodyne	SORD	67	34
CCOC1(C)CN(c2ncccc2C(=O)NC)C1	ZINC000450578106	BD	On-Demand	Anodyne	G2YM83_BOTF4	57	31
Cc1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2C(F)(F)F)no1	ZINC000450578119	DG	On-Demand	Anodyne	CPT1A	47	40
Cc1nc([C@@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2C(F)(F)F)no1	ZINC000450578120	DG	On-Demand	Anodyne	CPT1A	47	40
CC[C@H](CO)N(C)c1nc(C)nc2sc3c(c12)CCCC3	ZINC000450578122	DG	On-Demand	Anodyne	CEL	19	40
CC[C@@H](CO)N(C)c1nc(C)nc2sc3c(c12)CCCC3	ZINC000450578123	DG	On-Demand	Anodyne	CEL	19	40
CCOC1(C)CN(c2cc(C#N)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450578127	DF	On-Demand	Mild	F2RL3	44	31
Cc1ccc2ncnc(NC3CC(C)(F)C3)c2c1	ZINC000450578128	BG	On-Demand	Anodyne	CD38	87	42
Cc1nn(C)cc1CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450578136	GG	On-Demand	Anodyne	COLA	134	59
Cc1nn(C)cc1CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450578136	GG	On-Demand	Anodyne	CPT1A	128	59
Cc1nn(C)cc1CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450578137	GG	On-Demand	Anodyne	COLA	134	59
Cc1nn(C)cc1CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450578137	GG	On-Demand	Anodyne	CPT1A	128	59
CC(C)N1CCCC[C@H]1CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578139	GH	On-Demand	Anodyne	CTSV	20	40
CC(C)N1CCCC[C@H]1CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578139	GH	On-Demand	Anodyne	MCHR1	22	41
CC(C)N1CCCC[C@H]1CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578139	GH	On-Demand	Anodyne	BIRC2	49	40
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578140	GH	On-Demand	Anodyne	CTSV	20	40
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578140	GH	On-Demand	Anodyne	MCHR1	22	41
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578140	GH	On-Demand	Anodyne	BIRC2	49	40
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578141	GH	On-Demand	Anodyne	CTSV	20	40
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578141	GH	On-Demand	Anodyne	MCHR1	22	41
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578141	GH	On-Demand	Anodyne	BIRC2	49	40
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578142	GH	On-Demand	Anodyne	CTSV	20	40
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578142	GH	On-Demand	Anodyne	MCHR1	22	41
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578142	GH	On-Demand	Anodyne	BIRC2	49	40
CNS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578145	ED	On-Demand	Anodyne	DRD2	40	39
CNS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578145	ED	On-Demand	Anodyne	DRD4	0	44
CNS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578145	ED	On-Demand	Anodyne	SLC18A3	0	40
CNS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578145	ED	On-Demand	Anodyne	HTR3B	0	42
CNS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578145	ED	On-Demand	Anodyne	CYP2J2	48	34
CNS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578147	ED	On-Demand	Anodyne	DRD2	40	39
CNS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578147	ED	On-Demand	Anodyne	DRD4	0	44
CNS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578147	ED	On-Demand	Anodyne	SLC18A3	0	40
CNS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578147	ED	On-Demand	Anodyne	HTR3B	0	42
CNS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450578147	ED	On-Demand	Anodyne	CYP2J2	48	34
CS(=O)(=O)CC1CCC(Nc2ccnc3cc(Cl)ccc23)CC1	ZINC000450578149	FH	On-Demand	Anodyne	HRP1_PLAFA	114	41
CS(=O)(=O)CC1CCC(Nc2ccnc3cc(Cl)ccc23)CC1	ZINC000450578149	FH	On-Demand	Anodyne	HNMT	60	43
CS(=O)(=O)CC1CCC(Nc2ccnc3cc(Cl)ccc23)CC1	ZINC000450578149	FH	On-Demand	Anodyne	BOTA	37	44
C=CCn1c(SCC2(OC)CCC2)nc2cc(Cl)ccc2c1=O	ZINC000450578150	FH	On-Demand	Mild	SKA	0	41
Cn1c([C@@H]2CCCN2CCCC(=O)c2ccccc2)nc2ccccc21	ZINC000450578172	EI	On-Demand	Anodyne	PREP	15	42
Cn1c([C@@H]2CCCN2CCCC(=O)c2ccccc2)nc2ccccc21	ZINC000450578172	EI	On-Demand	Anodyne	CYP2J2	52	37
Cn1c([C@H]2CCCN2CCCC(=O)c2ccccc2)nc2ccccc21	ZINC000450578174	EI	On-Demand	Anodyne	PREP	15	42
Cn1c([C@H]2CCCN2CCCC(=O)c2ccccc2)nc2ccccc21	ZINC000450578174	EI	On-Demand	Anodyne	CYP2J2	52	37
COc1cccc(OCCC(=O)N2CCC[C@H](C)[C@@H]2CO)c1	ZINC000450578176	DE	On-Demand	Anodyne	FAP	0	44
COc1cccc(OCCC(=O)N2CCC[C@@H](C)[C@@H]2CO)c1	ZINC000450578179	DE	On-Demand	Anodyne	FAP	0	44
COc1cccc(OCCC(=O)N2CCC[C@@H](C)[C@H]2CO)c1	ZINC000450578180	DE	On-Demand	Anodyne	FAP	0	44
COc1cccc(OCCC(=O)N2CCC[C@H](C)[C@H]2CO)c1	ZINC000450578181	DE	On-Demand	Anodyne	FAP	0	44
CS(=O)(=O)CC1CCC(Nc2nccc(C(F)F)n2)CC1	ZINC000450578187	DE	On-Demand	Anodyne	MAPK1	61	36
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450578191	CD	On-Demand	Anodyne	HCRTR1	24	40
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450578191	CD	On-Demand	Anodyne	HCRTR2	24	40
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450578192	CD	On-Demand	Anodyne	HCRTR1	24	40
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450578192	CD	On-Demand	Anodyne	HCRTR2	24	40
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450578194	CD	On-Demand	Anodyne	HCRTR1	24	40
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450578194	CD	On-Demand	Anodyne	HCRTR2	24	40
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450578198	CD	On-Demand	Anodyne	HCRTR1	24	40
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450578198	CD	On-Demand	Anodyne	HCRTR2	24	40
COc1ccc(NC(=O)C2(NCc3cn(CC4CC4)nn3)CCCC2)cc1OC	ZINC000450578208	GF	On-Demand	Anodyne	ENPP1	70	34
COc1ccc(NC(=O)C2(NCc3cn(CC4CC4)nn3)CCCC2)cc1OC	ZINC000450578208	GF	On-Demand	Anodyne	DRTS_TRYCR	43	30
C[C@H]1CCCN(C(=O)c2ccc(-c3cnn(C)c3)o2)[C@H]1CO	ZINC000450578214	DD	On-Demand	Anodyne	TRPC6	44	31
COCCn1c(SC[C@@H]2C[C@H]3CC[C@H]2O3)nc2ccccc21	ZINC000450578216	DG	On-Demand	Anodyne	HRH1	20	46
COCCn1c(SC[C@H]2C[C@H]3CC[C@H]2O3)nc2ccccc21	ZINC000450578217	DG	On-Demand	Anodyne	HRH1	20	46
C[C@@H]1CCCN(C(=O)c2ccc(-c3cnn(C)c3)o2)[C@@H]1CO	ZINC000450578220	DD	On-Demand	Anodyne	TRPC6	44	31
C[C@H]1CCCN(C(=O)c2ccc(-c3cnn(C)c3)o2)[C@@H]1CO	ZINC000450578222	DD	On-Demand	Anodyne	TRPC6	44	31
C[C@@H]1CCCN(C(=O)c2ccc(-c3cnn(C)c3)o2)[C@H]1CO	ZINC000450578224	DD	On-Demand	Anodyne	TRPC6	44	31
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)no1	ZINC000450578225	GH	On-Demand	Anodyne	COLA	60	39
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)no1	ZINC000450578225	GH	On-Demand	Anodyne	CPT1A	59	39
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)no1	ZINC000450578230	GH	On-Demand	Anodyne	COLA	60	39
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)no1	ZINC000450578230	GH	On-Demand	Anodyne	CPT1A	59	39
COc1cc(NC2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)cc(OC)c1	ZINC000450578262	GH	On-Demand	Anodyne	SSTR5	58	37
COc1cc(NC2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)cc(OC)c1	ZINC000450578262	GH	On-Demand	Anodyne	MCHR1	15	42
COCCn1c(SCc2nc(C(=O)OC)co2)nc2ccccc21	ZINC000450578271	EF	On-Demand	Anodyne	PTGDR2	20	49
CCOC1(C)CN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1	ZINC000450578277	DE	On-Demand	Bother	TAAR1	22	40
Cc1cnc(CCCC(=O)NC[C@@H](O)CCc2ccccc2)o1	ZINC000450578302	DE	On-Demand	Anodyne	FAAH	56	36
Cc1cnc(CCCC(=O)NC[C@@H](O)CCc2ccccc2)o1	ZINC000450578302	DE	On-Demand	Anodyne	CES1	41	36
Cc1cnc(CCCC(=O)NC[C@@H](O)CCc2ccccc2)o1	ZINC000450578302	DE	On-Demand	Anodyne	CES1D	58	34
Cc1cnc(CCCC(=O)NC[C@H](O)CCc2ccccc2)o1	ZINC000450578303	DE	On-Demand	Anodyne	FAAH	56	36
Cc1cnc(CCCC(=O)NC[C@H](O)CCc2ccccc2)o1	ZINC000450578303	DE	On-Demand	Anodyne	CES1	41	36
Cc1cnc(CCCC(=O)NC[C@H](O)CCc2ccccc2)o1	ZINC000450578303	DE	On-Demand	Anodyne	CES1D	58	34
COC1(CSc2nnc(-c3ccc(Br)cc3)o2)CCC1	ZINC000450578308	FI	On-Demand	Anodyne	GSK3B	0	42
COC1(CSc2nnc(-c3ccc(Br)cc3)o2)CCC1	ZINC000450578308	FI	On-Demand	Anodyne	TERT	22	44
COC(=O)[C@@H]1COCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450578324	FE	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@H]1COCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450578325	FE	On-Demand	Anodyne	CYP2J2	48	34
COc1cc(CN2CCN(Cc3nccn3C(F)F)CC2)ccc1Cl	ZINC000450578336	FG	On-Demand	Anodyne	SSTR5	48	37
CC(C)(C(=O)NC[C@@H](O)CCc1ccccc1)C1CCC1	ZINC000450578337	CF	On-Demand	Anodyne	ACE	49	40
CC(C)(C(=O)NC[C@@H](O)CCc1ccccc1)C1CCC1	ZINC000450578337	CF	On-Demand	Anodyne	SLC18A2	49	37
CC(C)(C(=O)NC[C@@H](O)CCc1ccccc1)C1CCC1	ZINC000450578337	CF	On-Demand	Anodyne	MME	32	40
CC(C)(C(=O)NC[C@@H](O)CCc1ccccc1)C1CCC1	ZINC000450578337	CF	On-Demand	Anodyne	AMY2	46	32
CC(C)(C(=O)NC[C@@H](O)CCc1ccccc1)C1CCC1	ZINC000450578337	CF	On-Demand	Anodyne	MMP3	24	41
CC(C)(C(=O)NC[C@H](O)CCc1ccccc1)C1CCC1	ZINC000450578338	CF	On-Demand	Anodyne	ACE	49	40
CC(C)(C(=O)NC[C@H](O)CCc1ccccc1)C1CCC1	ZINC000450578338	CF	On-Demand	Anodyne	SLC18A2	49	37
CC(C)(C(=O)NC[C@H](O)CCc1ccccc1)C1CCC1	ZINC000450578338	CF	On-Demand	Anodyne	MME	32	40
CC(C)(C(=O)NC[C@H](O)CCc1ccccc1)C1CCC1	ZINC000450578338	CF	On-Demand	Anodyne	AMY2	46	32
CC(C)(C(=O)NC[C@H](O)CCc1ccccc1)C1CCC1	ZINC000450578338	CF	On-Demand	Anodyne	MMP3	24	41
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450578372	ED	On-Demand	Anodyne	SLC6A9	40	37
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450578373	ED	On-Demand	Anodyne	SLC6A9	40	37
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450578374	ED	On-Demand	Anodyne	SLC6A9	40	37
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450578375	ED	On-Demand	Anodyne	SLC6A9	40	37
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	HTR1A	90	44
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	DRD2	81	47
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	DRD1	30	41
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	DRD4	30	40
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	ADRA1D	85	46
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	HTR2A	42	46
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	ADRA1A	58	41
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	ADRA1B	43	40
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	DRD3	70	44
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	HTR7	63	42
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	HSP90AB1	36	44
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	AP2S1	0	44
COCCOc1ccccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450578389	ED	On-Demand	Anodyne	ALPHA-1A	0	41
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	HTR1A	90	44
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	DRD2	81	47
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	DRD1	30	41
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	DRD4	30	40
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	ADRA1D	85	46
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	HTR2A	42	46
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	ADRA1A	58	41
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	ADRA1B	43	40
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	DRD3	70	44
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	HTR7	63	42
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	HSP90AB1	36	44
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	AP2S1	0	44
COCCOc1ccccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450578391	ED	On-Demand	Anodyne	ALPHA-1A	0	41
C[C@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450578401	FJ	On-Demand	Anodyne	RBP4	68	39
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450578404	FJ	On-Demand	Anodyne	RBP4	56	39
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450578406	FJ	On-Demand	Anodyne	RBP4	68	39
COCC(=O)N1CCc2c(NC(=O)Cc3ccc(O)c(F)c3)cccc21	ZINC000450578407	FE	On-Demand	Anodyne	KCNQ2	36	42
COc1ccc(COCCNC(=O)c2c(C)cccc2Cl)cc1	ZINC000450578413	EH	On-Demand	Anodyne	DRD4	46	37
CCC[C@@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450578437	FC	On-Demand	Anodyne	TGM2	15	41
CCC[C@@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450578437	FC	On-Demand	Anodyne	GCKR	59	33
CCC[C@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450578438	FC	On-Demand	Anodyne	TGM2	15	41
CCC[C@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450578438	FC	On-Demand	Anodyne	GCKR	59	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c1	ZINC000450578439	EH	On-Demand	Anodyne	GPBAR1	0	43
COc1cccc([C@@H]2C[C@H]2C(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)c1	ZINC000450578440	EH	On-Demand	Anodyne	GPBAR1	0	43
COc1cccc([C@@H]2C[C@H]2C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c1	ZINC000450578441	EH	On-Demand	Anodyne	GPBAR1	0	43
COc1cccc([C@@H]2C[C@H]2C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)c1	ZINC000450578442	EH	On-Demand	Anodyne	GPBAR1	0	43
CCOC(=O)c1cc(C(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)on1	ZINC000450578445	GC	On-Demand	Bother	CACNA1C	42	35
CCOC(=O)c1cc(C(=O)NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)on1	ZINC000450578445	GC	On-Demand	Bother	CACNA1D	63	35
COC(=O)c1sc(NC(=O)Cc2ccc(O)c(F)c2)nc1C1CCCC1	ZINC000450578446	GH	On-Demand	Anodyne	CSNK1D	39	40
COC(=O)c1sc(NC(=O)Cc2ccc(O)c(F)c2)nc1C1CCCC1	ZINC000450578446	GH	On-Demand	Anodyne	CDK5	36	42
COc1ccc(COCCNC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450578448	GG	On-Demand	Anodyne	MMP13	23	40
COc1ccc(COCCNC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450578448	GG	On-Demand	Anodyne	SLC12A5	47	42
COc1ccc(COCCNC(=O)Cc2cc3ccccc3s2)cc1	ZINC000450578458	FH	On-Demand	Anodyne	MTNR1A	50	39
COc1ccc([C@H](OC)[C@@H](C)NC(=O)Cc2scnc2-c2ccccc2)cc1	ZINC000450578464	GI	On-Demand	Anodyne	PTGDR2	16	42
COc1ccc([C@@H](OC)[C@H](C)NC(=O)Cc2scnc2-c2ccccc2)cc1	ZINC000450578466	GI	On-Demand	Anodyne	PTGDR2	16	42
COc1ccc([C@H](OC)[C@H](C)NC(=O)Cc2scnc2-c2ccccc2)cc1	ZINC000450578467	GI	On-Demand	Anodyne	PTGDR2	16	42
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)Cc2scnc2-c2ccccc2)cc1	ZINC000450578468	GI	On-Demand	Anodyne	PTGDR2	16	42
CCOC1(C)CN(c2ccc(S(=O)(=O)NCC3CC3)cn2)C1	ZINC000450578488	ED	On-Demand	Anodyne	NPY2R	42	39
CS[C@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@H]1N1CCCC1	ZINC000450578489	EF	On-Demand	Anodyne	SLC18A3	24	41
CS[C@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@H]1N1CCCC1	ZINC000450578489	EF	On-Demand	Anodyne	L3MBTL1	0	44
CS[C@@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@H]1N1CCCC1	ZINC000450578491	EF	On-Demand	Anodyne	SLC18A3	24	41
CS[C@@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@H]1N1CCCC1	ZINC000450578491	EF	On-Demand	Anodyne	L3MBTL1	0	44
CS[C@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@@H]1N1CCCC1	ZINC000450578492	EF	On-Demand	Anodyne	SLC18A3	24	41
CS[C@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@@H]1N1CCCC1	ZINC000450578492	EF	On-Demand	Anodyne	L3MBTL1	0	44
CS[C@@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@@H]1N1CCCC1	ZINC000450578493	EF	On-Demand	Anodyne	SLC18A3	24	41
CS[C@@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@@H]1N1CCCC1	ZINC000450578493	EF	On-Demand	Anodyne	L3MBTL1	0	44
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)[nH]2)no1	ZINC000450578495	EG	On-Demand	Anodyne	COLA	42	39
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)[nH]2)no1	ZINC000450578495	EG	On-Demand	Anodyne	CPT1A	40	39
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)[nH]2)no1	ZINC000450578498	EG	On-Demand	Anodyne	COLA	42	39
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)[nH]2)no1	ZINC000450578498	EG	On-Demand	Anodyne	CPT1A	40	39
COc1cccc(OCCC(=O)N2CCc3c(ccc(OC)c3OC)C2)c1	ZINC000450578509	FG	On-Demand	Anodyne	DRD4	43	33
COc1cccc(OCCC(=O)N2CCc3c(ccc(OC)c3OC)C2)c1	ZINC000450578509	FG	On-Demand	Anodyne	AGTR2	54	36
COc1cccc(OCCC(=O)N2CCc3c(ccc(OC)c3OC)C2)c1	ZINC000450578509	FG	On-Demand	Anodyne	CPT2	15	42
COc1cccc(OCCC(=O)N2CCc3c(ccc(OC)c3OC)C2)c1	ZINC000450578509	FG	On-Demand	Anodyne	ABCB1	0	41
CSc1cccc(C(=O)N2C[C@H](SC)[C@H](N3CCCC3)C2)c1	ZINC000450578510	EG	On-Demand	Anodyne	RHOA	0	42
CSc1cccc(C(=O)N2C[C@H](SC)[C@H](N3CCCC3)C2)c1	ZINC000450578510	EG	On-Demand	Anodyne	L3MBTL1	0	45
CSc1cccc(C(=O)N2C[C@H](SC)[C@H](N3CCCC3)C2)c1	ZINC000450578510	EG	On-Demand	Anodyne	L3MBTL3	60	45
CSc1cccc(C(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)c1	ZINC000450578513	EG	On-Demand	Anodyne	RHOA	0	42
CSc1cccc(C(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)c1	ZINC000450578513	EG	On-Demand	Anodyne	L3MBTL1	0	45
CSc1cccc(C(=O)N2C[C@H](SC)[C@@H](N3CCCC3)C2)c1	ZINC000450578513	EG	On-Demand	Anodyne	L3MBTL3	60	45
CSc1cccc(C(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)c1	ZINC000450578514	EG	On-Demand	Anodyne	RHOA	0	42
CSc1cccc(C(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)c1	ZINC000450578514	EG	On-Demand	Anodyne	L3MBTL1	0	45
CSc1cccc(C(=O)N2C[C@@H](SC)[C@H](N3CCCC3)C2)c1	ZINC000450578514	EG	On-Demand	Anodyne	L3MBTL3	60	45
CSc1cccc(C(=O)N2C[C@H](N3CCCC3)[C@H](SC)C2)c1	ZINC000450578515	EG	On-Demand	Anodyne	RHOA	0	42
CSc1cccc(C(=O)N2C[C@H](N3CCCC3)[C@H](SC)C2)c1	ZINC000450578515	EG	On-Demand	Anodyne	L3MBTL1	0	45
CSc1cccc(C(=O)N2C[C@H](N3CCCC3)[C@H](SC)C2)c1	ZINC000450578515	EG	On-Demand	Anodyne	L3MBTL3	60	45
C[C@@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578516	FE	On-Demand	Anodyne	DRD4	21	40
C[C@@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578516	FE	On-Demand	Anodyne	HTR4	40	34
C[C@@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578516	FE	On-Demand	Anodyne	CTSL	21	41
C[C@@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578516	FE	On-Demand	Anodyne	CCR3	22	40
C[C@@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578516	FE	On-Demand	Anodyne	CTSV	39	40
C[C@@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578516	FE	On-Demand	Anodyne	MCHR1	24	43
C[C@@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578516	FE	On-Demand	Anodyne	BIRC2	49	40
C[C@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578530	FE	On-Demand	Anodyne	DRD4	21	40
C[C@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578530	FE	On-Demand	Anodyne	HTR4	40	34
C[C@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578530	FE	On-Demand	Anodyne	CTSL	21	41
C[C@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578530	FE	On-Demand	Anodyne	CCR3	22	40
C[C@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578530	FE	On-Demand	Anodyne	CTSV	39	40
C[C@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578530	FE	On-Demand	Anodyne	MCHR1	24	43
C[C@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578530	FE	On-Demand	Anodyne	BIRC2	49	40
C[C@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578533	FE	On-Demand	Anodyne	DRD4	21	40
C[C@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578533	FE	On-Demand	Anodyne	HTR4	40	34
C[C@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578533	FE	On-Demand	Anodyne	CTSL	21	41
C[C@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578533	FE	On-Demand	Anodyne	CCR3	22	40
C[C@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578533	FE	On-Demand	Anodyne	CTSV	39	40
C[C@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578533	FE	On-Demand	Anodyne	MCHR1	24	43
C[C@H](CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578533	FE	On-Demand	Anodyne	BIRC2	49	40
C[C@@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578535	FE	On-Demand	Anodyne	DRD4	21	40
C[C@@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578535	FE	On-Demand	Anodyne	HTR4	40	34
C[C@@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578535	FE	On-Demand	Anodyne	CTSL	21	41
C[C@@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578535	FE	On-Demand	Anodyne	CCR3	22	40
C[C@@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578535	FE	On-Demand	Anodyne	CTSV	39	40
C[C@@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578535	FE	On-Demand	Anodyne	MCHR1	24	43
C[C@@H](CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1)S(C)(=O)=O	ZINC000450578535	FE	On-Demand	Anodyne	BIRC2	49	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc2c(c1)C(=O)NCC2	ZINC000450578536	FE	On-Demand	Anodyne	ANPEP	28	40
Clc1ccc(CCN2C[C@@H]3CCC[C@H]32)cc1	ZINC000450578546	BG	On-Demand	Anodyne	CACNA1D	41	46
COc1ccc(NC(=O)C2(NC[C@@H]3CCNC(=O)CC3)CCCC2)cc1OC	ZINC000450578548	GE	On-Demand	Anodyne	ENPP1	68	33
COc1ccc(NC(=O)C2(NC[C@H]3CCNC(=O)CC3)CCCC2)cc1OC	ZINC000450578549	GE	On-Demand	Anodyne	ENPP1	68	33
Cc1cccc(Cl)c1C(=O)N1CCC=C(F)C1	ZINC000450578555	CG	On-Demand	Anodyne	P2RX7	24	43
Clc1ccc(CCN2C[C@@H]3CCC[C@@H]32)cc1	ZINC000450578556	BG	On-Demand	Anodyne	CACNA1D	41	46
Clc1ccc(CCN2C[C@H]3CCC[C@@H]32)cc1	ZINC000450578559	BG	On-Demand	Anodyne	CACNA1D	41	46
Clc1ccc(CCN2C[C@H]3CCC[C@H]32)cc1	ZINC000450578560	BG	On-Demand	Anodyne	CACNA1D	41	46
COC(=O)[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578570	EG	On-Demand	Anodyne	MME	48	35
COC(=O)[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578570	EG	On-Demand	Anodyne	ANPEP	69	37
COC(=O)[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578570	EG	On-Demand	Anodyne	FCER2	41	32
COC(=O)[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578570	EG	On-Demand	Anodyne	CAPNS1	49	37
COC(=O)[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578570	EG	On-Demand	Anodyne	CAPN1	44	40
COC(=O)[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578570	EG	On-Demand	Anodyne	CAPN2	53	35
COC(=O)[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578570	EG	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578570	EG	On-Demand	Anodyne	NPR	45	39
COC(=O)[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578571	EG	On-Demand	Anodyne	MME	48	35
COC(=O)[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578571	EG	On-Demand	Anodyne	ANPEP	69	37
COC(=O)[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578571	EG	On-Demand	Anodyne	FCER2	41	32
COC(=O)[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578571	EG	On-Demand	Anodyne	CAPNS1	49	37
COC(=O)[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578571	EG	On-Demand	Anodyne	CAPN1	44	40
COC(=O)[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578571	EG	On-Demand	Anodyne	CAPN2	53	35
COC(=O)[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578571	EG	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578571	EG	On-Demand	Anodyne	NPR	45	39
COC(=O)[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578573	EG	On-Demand	Anodyne	MME	48	35
COC(=O)[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578573	EG	On-Demand	Anodyne	ANPEP	69	37
COC(=O)[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578573	EG	On-Demand	Anodyne	FCER2	41	32
COC(=O)[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578573	EG	On-Demand	Anodyne	CAPNS1	49	37
COC(=O)[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578573	EG	On-Demand	Anodyne	CAPN1	44	40
COC(=O)[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578573	EG	On-Demand	Anodyne	CAPN2	53	35
COC(=O)[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578573	EG	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578573	EG	On-Demand	Anodyne	NPR	45	39
COc1ccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)cc1S(C)(=O)=O	ZINC000450578574	GF	On-Demand	Anodyne	COLA	63	41
COc1ccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)cc1S(C)(=O)=O	ZINC000450578574	GF	On-Demand	Anodyne	CPT1A	61	41
COC(=O)[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578575	EG	On-Demand	Anodyne	MME	48	35
COC(=O)[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578575	EG	On-Demand	Anodyne	ANPEP	69	37
COC(=O)[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578575	EG	On-Demand	Anodyne	FCER2	41	32
COC(=O)[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578575	EG	On-Demand	Anodyne	CAPNS1	49	37
COC(=O)[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578575	EG	On-Demand	Anodyne	CAPN1	44	40
COC(=O)[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578575	EG	On-Demand	Anodyne	CAPN2	53	35
COC(=O)[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578575	EG	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450578575	EG	On-Demand	Anodyne	NPR	45	39
COc1ccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)cc1S(C)(=O)=O	ZINC000450578576	GF	On-Demand	Anodyne	COLA	63	41
COc1ccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)cc1S(C)(=O)=O	ZINC000450578576	GF	On-Demand	Anodyne	CPT1A	61	41
c1ccc(-c2nnc3ccc(N4CC5(CC5)C4)nn23)cc1	ZINC000450578605	CE	On-Demand	Anodyne	LRRK2	25	42
Cc1nc([C@@H]2CCCCCN2C(=O)c2cc(C)n(C(C)C)n2)no1	ZINC000450578621	EG	On-Demand	Anodyne	COLA	55	41
Cc1nc([C@@H]2CCCCCN2C(=O)c2cc(C)n(C(C)C)n2)no1	ZINC000450578621	EG	On-Demand	Anodyne	CPT1A	43	41
Cc1nc([C@H]2CCCCCN2C(=O)c2cc(C)n(C(C)C)n2)no1	ZINC000450578626	EG	On-Demand	Anodyne	COLA	55	41
Cc1nc([C@H]2CCCCCN2C(=O)c2cc(C)n(C(C)C)n2)no1	ZINC000450578626	EG	On-Demand	Anodyne	CPT1A	43	41
CO[C@@H](Cc1ccccc1)C(=O)N1CC=C(c2ccc(C)nc2)CC1	ZINC000450578658	EG	On-Demand	Anodyne	ADAM10	25	42
CO[C@H](Cc1ccccc1)C(=O)N1CC=C(c2ccc(C)nc2)CC1	ZINC000450578661	EG	On-Demand	Anodyne	ADAM10	25	42
COc1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c(Cl)c1OC	ZINC000450578674	GH	On-Demand	Anodyne	COLA	99	44
COc1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c(Cl)c1OC	ZINC000450578674	GH	On-Demand	Anodyne	CPT1A	94	44
COc1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c(Cl)c1OC	ZINC000450578676	GH	On-Demand	Anodyne	COLA	99	44
COc1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c(Cl)c1OC	ZINC000450578676	GH	On-Demand	Anodyne	CPT1A	94	44
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1ccc2cnccc2c1	ZINC000450578689	EG	On-Demand	Anodyne	AKT1	0	44
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1ccc2cnccc2c1	ZINC000450578690	EG	On-Demand	Anodyne	AKT1	0	44
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1ccc2cnccc2c1	ZINC000450578691	EG	On-Demand	Anodyne	AKT1	0	44
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1ccc2cnccc2c1	ZINC000450578692	EG	On-Demand	Anodyne	AKT1	0	44
COc1ccc2nc(SCCC(=O)NC(=O)NCCC(F)(F)F)[nH]c2c1	ZINC000450578694	GF	On-Demand	Anodyne	CYP2C8	24	44
COc1ccc2nc(SCCC(=O)NC(=O)NCCC(F)(F)F)[nH]c2c1	ZINC000450578694	GF	On-Demand	Anodyne	CYP1A2	21	53
COc1ccc2nc(SCCC(=O)NC(=O)NCCC(F)(F)F)[nH]c2c1	ZINC000450578694	GF	On-Demand	Anodyne	CYP2C19	37	51
CS(=O)(=O)CC1CCC(Nc2cc(-c3ccccc3)nc3ncnn23)CC1	ZINC000450578695	GF	On-Demand	Anodyne	DHOD	0	45
CCC[C@H](CNc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])OC	ZINC000450578707	FF	On-Demand	Bother	BDKRB1	26	53
CCC[C@@H](CNc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])OC	ZINC000450578708	FF	On-Demand	Bother	BDKRB1	26	53
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	HTR1A	77	45
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	DRD2	66	43
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	ADRA1D	61	44
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	HTR2A	30	41
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	ADRA1A	51	45
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	ADRA1B	39	40
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	DRD3	56	41
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	HTR7	47	38
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450578736	FH	On-Demand	Anodyne	AP2S1	0	42
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	HTR1A	77	45
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	DRD2	66	43
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	ADRA1D	61	44
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	HTR2A	30	41
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	ADRA1A	51	45
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	ADRA1B	39	40
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	DRD3	56	41
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	HTR7	47	38
COCCOc1ccccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450578738	FH	On-Demand	Anodyne	AP2S1	0	42
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	HTR1A	74	44
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	DRD2	70	41
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	ADRA1D	72	44
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	HTR2A	29	44
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	ADRA1A	55	44
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	ADRA1B	50	44
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	DRD3	56	39
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	HTR7	46	38
COCCOc1ccccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450578740	FG	On-Demand	Anodyne	AP2S1	0	40
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	HTR1A	74	44
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	DRD2	70	41
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	ADRA1D	72	44
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	HTR2A	29	44
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	ADRA1A	55	44
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	ADRA1B	50	44
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	DRD3	56	39
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	HTR7	46	38
COCCOc1ccccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450578741	FG	On-Demand	Anodyne	AP2S1	0	40
CC(C)(CC(=O)COc1ccccc1C(N)=O)C1CC1	ZINC000450578746	CF	On-Demand	Anodyne	AMY2	46	33
CC(C)(CC(=O)COc1ccccc1C(N)=O)C1CC1	ZINC000450578746	CF	On-Demand	Anodyne	PARP1	0	45
Cn1c(SCC[C@H]2CCOC2)nnc1-c1ccc(Cl)cc1	ZINC000450578749	DH	On-Demand	Anodyne	DRD3	16	44
Cn1c(SCC[C@H]2CCOC2)nnc1-c1ccc(Cl)cc1	ZINC000450578749	DH	On-Demand	Anodyne	KCNH2	0	44
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1ccc(Cl)cc1	ZINC000450578751	DH	On-Demand	Anodyne	KCNH2	0	44
CCCCCn1c(SCc2nc(C(=O)OC)co2)nc2ccccc21	ZINC000450578752	FI	On-Demand	Anodyne	PTGDR2	19	48
O=C(NC[C@H](O)CCc1ccccc1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450578809	GH	On-Demand	Anodyne	RBP4	75	43
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450578811	GH	On-Demand	Anodyne	RBP4	75	43
CCc1cccc(C(=O)NC[C@@H](O)CCc2ccccc2)n1	ZINC000450578814	CE	On-Demand	Anodyne	PDE5A	24	41
CCc1cccc(C(=O)NC[C@H](O)CCc2ccccc2)n1	ZINC000450578815	CE	On-Demand	Anodyne	PDE5A	24	41
O=[N+]([O-])c1ccc(N2CCC3(CCC(O)CC3)CC2)cc1C(F)(F)F	ZINC000450578816	FI	On-Demand	Bother	SERPINE1	16	42
O=[N+]([O-])c1ccc(N2CCC3(CCC(O)CC3)CC2)cc1C(F)(F)F	ZINC000450578816	FI	On-Demand	Bother	AADAC	0	40
COc1cc(CC(=O)NC[C@@H](O)CCc2ccccc2)ccc1Cl	ZINC000450578817	EG	On-Demand	Anodyne	TRPV1	40	53
COc1cc(CC(=O)NC[C@@H](O)CCc2ccccc2)ccc1Cl	ZINC000450578817	EG	On-Demand	Anodyne	NCE103	28	46
COc1cc(CC(=O)NC[C@@H](O)CCc2ccccc2)ccc1Cl	ZINC000450578817	EG	On-Demand	Anodyne	MBTPS1	44	31
COc1cc(CC(=O)NC[C@@H](O)CCc2ccccc2)ccc1Cl	ZINC000450578817	EG	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)NC[C@H](O)CCc2ccccc2)ccc1Cl	ZINC000450578821	EG	On-Demand	Anodyne	TRPV1	40	53
COc1cc(CC(=O)NC[C@H](O)CCc2ccccc2)ccc1Cl	ZINC000450578821	EG	On-Demand	Anodyne	NCE103	28	46
COc1cc(CC(=O)NC[C@H](O)CCc2ccccc2)ccc1Cl	ZINC000450578821	EG	On-Demand	Anodyne	MBTPS1	44	31
COc1cc(CC(=O)NC[C@H](O)CCc2ccccc2)ccc1Cl	ZINC000450578821	EG	On-Demand	Anodyne	CAN2	0	46
CCCOc1ccc(C(=O)N2CCN3CCOC[C@@H]3C2)c(OC)c1	ZINC000450578830	ED	On-Demand	Anodyne	OXTR	0	42
CCCOc1ccc(C(=O)N2CCN3CCOC[C@H]3C2)c(OC)c1	ZINC000450578832	ED	On-Demand	Anodyne	OXTR	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	MME	50	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	ANPEP	68	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	FCER2	63	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	SDH1	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	RNPEP	26	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	KLK3	66	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CTSB	57	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	PAPA1_CARPA	43	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CYSP_TRYCR	39	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CTSK	47	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CTSL	59	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CAPNS1	52	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	MMP2	29	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	MMP3	71	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	REN	46	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	PAM	0	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CTSS	48	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CAPN1	101	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	MMP9	24	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CAPN2	115	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	LAP3	25	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	PROTEASE	0	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	MMP1	42	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	FPR1	64	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	CTRB_BOVIN	47	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	POL	0	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	NPR	82	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	AMP1_PLAFQ	47	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	PSMB5	68	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	Q9NAW4_PLAFA	52	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450578841	FF	On-Demand	Anodyne	VM1B1_BOTAS	0	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	MME	50	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	ANPEP	68	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	FCER2	63	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	SDH1	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	RNPEP	26	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	KLK3	66	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CTSB	57	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	PAPA1_CARPA	43	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CYSP_TRYCR	39	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CTSK	47	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CTSL	59	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CAPNS1	52	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	MMP2	29	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	MMP3	71	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	REN	46	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	PAM	0	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CTSS	48	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CAPN1	101	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	MMP9	24	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CAPN2	115	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	LAP3	25	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	PROTEASE	0	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	MMP1	42	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	FPR1	64	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	CTRB_BOVIN	47	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	POL	0	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	NPR	82	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	AMP1_PLAFQ	47	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	PSMB5	68	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	Q9NAW4_PLAFA	52	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450578842	FF	On-Demand	Anodyne	VM1B1_BOTAS	0	40
N#Cc1cc(C(F)(F)F)ccc1N1CCC2(CCC(O)CC2)CC1	ZINC000450578843	EI	On-Demand	Mild	LIPG	48	34
CCC[C@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578847	EF	On-Demand	Anodyne	DRD3	0	51
CCC[C@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578849	EF	On-Demand	Anodyne	DRD4	25	40
CCC[C@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578849	EF	On-Demand	Anodyne	DRD3	0	51
CCC[C@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578849	EF	On-Demand	Anodyne	BIRC2	45	39
C[C@@H](O)CCN(CC(=O)Nc1ccc(F)cc1)C(C)(C)C	ZINC000450578850	CF	On-Demand	Anodyne	LTA4H	0	42
C[C@H](O)CCN(CC(=O)Nc1ccc(F)cc1)C(C)(C)C	ZINC000450578851	CF	On-Demand	Anodyne	LTA4H	0	42
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578852	EF	On-Demand	Anodyne	DRD3	0	51
CN(C)S(=O)(=O)c1ccc(NCC2=CCCCC2)c([N+](=O)[O-])c1	ZINC000450578856	EF	On-Demand	Bother	BDKRB1	23	42
CCC[C@@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450578861	EF	On-Demand	Anodyne	DRD3	0	51
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C)nc1O	ZINC000450578879	CE	On-Demand	Anodyne	MME	55	36
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C)nc1O	ZINC000450578879	CE	On-Demand	Anodyne	ANPEP	63	36
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C)nc1O	ZINC000450578879	CE	On-Demand	Anodyne	GPR142	40	33
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(C)nc1O	ZINC000450578887	CE	On-Demand	Anodyne	MME	55	36
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(C)nc1O	ZINC000450578887	CE	On-Demand	Anodyne	ANPEP	63	36
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(C)nc1O	ZINC000450578887	CE	On-Demand	Anodyne	GPR142	40	33
Cc1nc([C@@H]2CCCCCN2C(=O)CCCC(C)C)no1	ZINC000450578888	CH	On-Demand	Anodyne	CPT1A	67	45
Cc1nc([C@H]2CCCCCN2C(=O)CCCC(C)C)no1	ZINC000450578890	CH	On-Demand	Anodyne	CPT1A	67	45
CSc1ccc2ncnc(NC3CC(C)(F)C3)c2c1	ZINC000450578892	CH	On-Demand	Anodyne	CD38	72	40
COc1cc2c(N3CCC4(CCC(O)CC4)CC3)ccnc2cc1F	ZINC000450578910	EH	On-Demand	Anodyne	PDE3A	44	34
COc1cc2c(N3CCC4(CCC(O)CC4)CC3)ccnc2cc1F	ZINC000450578910	EH	On-Demand	Anodyne	PDE3B	42	34
CCOC(=O)c1ccc(CN2CCC(Nc3cc(OC)cc(OC)c3)CC2)nc1	ZINC000450578937	GG	On-Demand	Anodyne	P2RY12	44	45
CCOC(=O)c1ccc(CN2CCC(Nc3cc(OC)cc(OC)c3)CC2)nc1	ZINC000450578937	GG	On-Demand	Anodyne	CHRM3	15	43
CCOC(=O)c1ccc(CN2CCC(Nc3cc(OC)cc(OC)c3)CC2)nc1	ZINC000450578937	GG	On-Demand	Anodyne	SSTR5	91	46
CCOC(=O)c1ccc(CN2CCC(Nc3cc(OC)cc(OC)c3)CC2)nc1	ZINC000450578937	GG	On-Demand	Anodyne	MCHR1	37	46
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CC[C@H](C)O	ZINC000450578942	DD	On-Demand	Anodyne	HRH3	0	41
O=C1CCC(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578945	FH	On-Demand	Anodyne	DRD4	24	53
O=C1CCC(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578945	FH	On-Demand	Anodyne	DRD3	15	41
O=C1CCC(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578945	FH	On-Demand	Anodyne	CCR3	42	40
O=C1CCC(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578945	FH	On-Demand	Anodyne	PLD1	39	41
O=C1CCC(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578945	FH	On-Demand	Anodyne	CAPN2	50	38
O=C1CCC(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578945	FH	On-Demand	Anodyne	PLD2	47	41
O=C1CCC(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578945	FH	On-Demand	Anodyne	MCHR1	18	59
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CC[C@@H](C)O	ZINC000450578946	DD	On-Demand	Anodyne	HRH3	0	41
O=C1CCC(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578948	FH	On-Demand	Anodyne	DRD4	24	53
O=C1CCC(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578948	FH	On-Demand	Anodyne	DRD3	15	41
O=C1CCC(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578948	FH	On-Demand	Anodyne	CCR3	42	40
O=C1CCC(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578948	FH	On-Demand	Anodyne	PLD1	39	41
O=C1CCC(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578948	FH	On-Demand	Anodyne	CAPN2	50	38
O=C1CCC(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578948	FH	On-Demand	Anodyne	PLD2	47	41
O=C1CCC(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450578948	FH	On-Demand	Anodyne	MCHR1	18	59
CNS(=O)(=O)C[C@H]1CCCN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450578958	FD	On-Demand	Anodyne	DRD2	45	39
CNS(=O)(=O)C[C@@H]1CCCN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450578959	FD	On-Demand	Anodyne	DRD2	45	39
Cn1c(C#N)ccc1C(=O)N1CCCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450578971	GE	On-Demand	Mild	SLC6A9	15	40
CN(CCN1CCC(c2cnc[nH]2)CC1)Cc1ccccc1	ZINC000450578979	CF	On-Demand	Anodyne	SIGMAR1	35	42
C[C@@H](O)CCN1CC2(CCCC2)c2ccccc21	ZINC000450578987	BG	On-Demand	Anodyne	SLC18A3	24	40
C[C@H](O)CCN1CC2(CCCC2)c2ccccc21	ZINC000450578988	BG	On-Demand	Anodyne	SLC18A3	24	40
CCN(CC)S(=O)(=O)c1ccc(OCCC[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000450578999	FE	On-Demand	Bother	BDKRB1	22	42
CCN(CC)S(=O)(=O)c1ccc(OCCC[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000450578999	FE	On-Demand	Bother	COLA	56	33
CCN(CC)S(=O)(=O)c1ccc(OCCC[C@H](C)O)c([N+](=O)[O-])c1	ZINC000450579002	FE	On-Demand	Bother	BDKRB1	22	42
CCN(CC)S(=O)(=O)c1ccc(OCCC[C@H](C)O)c([N+](=O)[O-])c1	ZINC000450579002	FE	On-Demand	Bother	COLA	56	33
COc1cc(CC(=O)N2CC=C(c3ccc(C)nc3)CC2)ccc1Cl	ZINC000450579012	FH	On-Demand	Anodyne	CCR1	25	40
COc1cc(CC(=O)N2CC=C(c3ccc(C)nc3)CC2)ccc1Cl	ZINC000450579012	FH	On-Demand	Anodyne	QDPR	0	43
COc1cc(NC(=O)CN(C)Cc2ccc(Cl)c(OC)c2)cc(OC)c1	ZINC000450579016	GG	On-Demand	Anodyne	LTA4H	21	41
FC(F)(F)c1cc(N2CC3(CC3)C2)n2ncnc2n1	ZINC000450579017	CD	On-Demand	Anodyne	DHOD	0	45
CCOC1(C)CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C1	ZINC000450579018	GD	On-Demand	Bother	BCL2L1	57	33
CCOC1(C)CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C1	ZINC000450579018	GD	On-Demand	Bother	BCL2	45	33
COCCn1c(SCC[C@H]2CCOC2)nc2ccccc21	ZINC000450579022	DG	On-Demand	Anodyne	HRH1	18	46
COCCn1c(SCC[C@@H]2CCOC2)nc2ccccc21	ZINC000450579023	DG	On-Demand	Anodyne	HRH1	18	46
Cc1ccc(C2=CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)cn1	ZINC000450579028	FH	On-Demand	Anodyne	ADAM10	21	41
Cc1ccc(C2=CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)cn1	ZINC000450579029	FH	On-Demand	Anodyne	ADAM10	21	41
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)n1	ZINC000450579044	GI	On-Demand	Anodyne	COLA	126	56
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)n1	ZINC000450579044	GI	On-Demand	Anodyne	CPT1A	121	56
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)n1	ZINC000450579044	GI	On-Demand	Anodyne	GRM5	15	42
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)n1	ZINC000450579045	GI	On-Demand	Anodyne	COLA	126	56
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)n1	ZINC000450579045	GI	On-Demand	Anodyne	CPT1A	121	56
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)n1	ZINC000450579045	GI	On-Demand	Anodyne	GRM5	15	42
CS[C@H]1CN(C(=O)c2cc3n(n2)CCCC3)C[C@H]1N1CCCC1	ZINC000450579046	ED	On-Demand	Anodyne	L3MBTL3	47	35
CS[C@H]1CN(C(=O)c2cc3n(n2)CCCC3)C[C@@H]1N1CCCC1	ZINC000450579048	ED	On-Demand	Anodyne	L3MBTL3	47	35
CS[C@@H]1CN(C(=O)c2cc3n(n2)CCCC3)C[C@H]1N1CCCC1	ZINC000450579049	ED	On-Demand	Anodyne	L3MBTL3	47	35
CS[C@@H]1CN(C(=O)c2cc3n(n2)CCCC3)C[C@@H]1N1CCCC1	ZINC000450579051	ED	On-Demand	Anodyne	L3MBTL3	47	35
CC(=O)CCCCCSc1ccc(F)cc1	ZINC000450579077	BI	On-Demand	Anodyne	THRB	0	43
COc1cc(NC(=O)CN(C)Cc2cccnc2N)cc(OC)c1	ZINC000450579085	ED	On-Demand	Anodyne	ZAP70	42	37
CNS(=O)(=O)C[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450579087	ED	On-Demand	Anodyne	DRD2	44	40
CNS(=O)(=O)C[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450579087	ED	On-Demand	Anodyne	SSTR5	44	36
CNS(=O)(=O)C[C@@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450579088	ED	On-Demand	Anodyne	DRD2	44	40
CNS(=O)(=O)C[C@@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450579088	ED	On-Demand	Anodyne	SSTR5	44	36
CC1CCN(C(=O)c2ccc(NC[C@@H]3CCCCC3(F)F)nc2)CC1	ZINC000450579100	FI	On-Demand	Anodyne	L3MBTL3	66	39
CC1CCN(C(=O)c2ccc(NC[C@H]3CCCCC3(F)F)nc2)CC1	ZINC000450579101	FI	On-Demand	Anodyne	L3MBTL3	66	39
CN(C[C@H]1C[C@H]2CC[C@H]1O2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579106	DF	On-Demand	Anodyne	ACHE	16	42
CN(C[C@H]1C[C@H]2CC[C@H]1O2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579106	DF	On-Demand	Anodyne	SIGMAR1	37	41
CN(C[C@@H]1C[C@H]2CC[C@H]1O2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579107	DF	On-Demand	Anodyne	ACHE	16	42
CN(C[C@@H]1C[C@H]2CC[C@H]1O2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579107	DF	On-Demand	Anodyne	SIGMAR1	37	41
CN(C[C@H]1C[C@H]2CC[C@H]1O2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579108	DF	On-Demand	Anodyne	ACHE	16	42
CN(C[C@H]1C[C@H]2CC[C@H]1O2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579108	DF	On-Demand	Anodyne	SIGMAR1	37	41
CN(C[C@@H]1C[C@H]2CC[C@H]1O2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579109	DF	On-Demand	Anodyne	ACHE	16	42
CN(C[C@@H]1C[C@H]2CC[C@H]1O2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579109	DF	On-Demand	Anodyne	SIGMAR1	37	41
CCCNC(=O)c1ccc(NC[C@H]2CCCCC2(F)F)nc1	ZINC000450579111	DG	On-Demand	Anodyne	KCNQ1	0	42
CCCNC(=O)c1ccc(NC[C@H]2CCCCC2(F)F)nc1	ZINC000450579111	DG	On-Demand	Anodyne	IKBKB	15	40
CCCNC(=O)c1ccc(NC[C@@H]2CCCCC2(F)F)nc1	ZINC000450579112	DG	On-Demand	Anodyne	KCNQ1	0	42
CCCNC(=O)c1ccc(NC[C@@H]2CCCCC2(F)F)nc1	ZINC000450579112	DG	On-Demand	Anodyne	IKBKB	15	40
CN(C[C@H]1CCC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579115	DH	On-Demand	Anodyne	CHRM2	17	42
CN(C[C@H]1CCC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579115	DH	On-Demand	Anodyne	ACHE	31	43
CN(C[C@H]1CCC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579115	DH	On-Demand	Anodyne	CHRM3	18	42
CN(C[C@H]1CCC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579115	DH	On-Demand	Anodyne	SIGMAR1	63	42
CN(C[C@@H]1CCC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579116	DH	On-Demand	Anodyne	CHRM2	17	42
CN(C[C@@H]1CCC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579116	DH	On-Demand	Anodyne	ACHE	31	43
CN(C[C@@H]1CCC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579116	DH	On-Demand	Anodyne	CHRM3	18	42
CN(C[C@@H]1CCC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579116	DH	On-Demand	Anodyne	SIGMAR1	63	42
CN(C[C@H]1CCC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579117	DH	On-Demand	Anodyne	CHRM2	17	42
CN(C[C@H]1CCC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579117	DH	On-Demand	Anodyne	ACHE	31	43
CN(C[C@H]1CCC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579117	DH	On-Demand	Anodyne	CHRM3	18	42
CN(C[C@H]1CCC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579117	DH	On-Demand	Anodyne	SIGMAR1	63	42
CN(C[C@@H]1CCC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579118	DH	On-Demand	Anodyne	CHRM2	17	42
CN(C[C@@H]1CCC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579118	DH	On-Demand	Anodyne	ACHE	31	43
CN(C[C@@H]1CCC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579118	DH	On-Demand	Anodyne	CHRM3	18	42
CN(C[C@@H]1CCC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579118	DH	On-Demand	Anodyne	SIGMAR1	63	42
CCN(CC(F)F)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450579121	CF	On-Demand	Anodyne	P2RY12	16	41
CCN(CC(F)F)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450579122	CF	On-Demand	Anodyne	P2RY12	16	41
CCC[C@H](CNc1cc(COC)nc2ncnn12)OC	ZINC000450579123	CD	On-Demand	Anodyne	DHOD	0	43
CCC[C@@H](CNc1cc(COC)nc2ncnn12)OC	ZINC000450579124	CD	On-Demand	Anodyne	DHOD	0	43
CCC[C@H](CNc1c(C#N)cnc2c(F)cc(F)cc12)OC	ZINC000450579145	DH	On-Demand	Mild	MAP3K8	66	37
CCC[C@@H](CNc1c(C#N)cnc2c(F)cc(F)cc12)OC	ZINC000450579146	DH	On-Demand	Mild	MAP3K8	107	37
CC(C)CC(CC(C)C)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450579148	GG	On-Demand	Bother	CA2	17	42
CC(C)CC(CC(C)C)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450579148	GG	On-Demand	Bother	COLA	62	39
CN(Cc1cn(CC2CC2)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579149	EE	On-Demand	Anodyne	DRD3	20	40
CN(Cc1cn(CC2CC2)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579149	EE	On-Demand	Anodyne	SIGMAR1	37	40
CN(Cc1cn(CC2CC2)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450579149	EE	On-Demand	Anodyne	HSP90AB1	17	42
CN(Cc1cn(CC2CC2)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579150	EE	On-Demand	Anodyne	DRD3	20	40
CN(Cc1cn(CC2CC2)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579150	EE	On-Demand	Anodyne	SIGMAR1	37	40
CN(Cc1cn(CC2CC2)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450579150	EE	On-Demand	Anodyne	HSP90AB1	17	42
Cc1csc([C@H](C)CNC(=O)c2cc3ccncc3s2)n1	ZINC000450579172	DH	On-Demand	Anodyne	SELE	38	41
Cc1csc([C@H](C)CNC(=O)c2cc3ccncc3s2)n1	ZINC000450579172	DH	On-Demand	Anodyne	ICAM1	35	41
N#CC[C@@H](O)CSc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2	ZINC000450579202	GG	On-Demand	Mild	GSK3A	28	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC2(CCC(O)CC2)CC1	ZINC000450579213	GD	On-Demand	Anodyne	CA2	17	43
COc1cc(CC(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)ccc1Cl	ZINC000450579214	FH	On-Demand	Anodyne	OPRK1	0	45
COc1cc(CC(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)ccc1Cl	ZINC000450579214	FH	On-Demand	Anodyne	CCR5	15	41
COc1cc(CC(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)ccc1Cl	ZINC000450579215	FH	On-Demand	Anodyne	OPRK1	0	45
COc1cc(CC(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)ccc1Cl	ZINC000450579215	FH	On-Demand	Anodyne	CCR5	15	41
C[C@@H]1CCCN(C(=O)c2ccc(I)cc2F)[C@@H]1CO	ZINC000450579230	GF	On-Demand	Anodyne	MAP2K1	40	39
C[C@@H]1CCCN(C(=O)c2ccc(I)cc2F)[C@H]1CO	ZINC000450579231	GF	On-Demand	Anodyne	MAP2K1	40	39
C[C@H]1CCCN(C(=O)c2ccc(I)cc2F)[C@@H]1CO	ZINC000450579232	GF	On-Demand	Anodyne	MAP2K1	40	39
C[C@H]1CCCN(C(=O)c2ccc(I)cc2F)[C@H]1CO	ZINC000450579233	GF	On-Demand	Anodyne	MAP2K1	40	39
CC(C)(CC(=O)CSc1nnc(-c2ccc(Br)cc2)o1)C1CC1	ZINC000450579245	GJ	On-Demand	Anodyne	TERT	18	40
CCCCn1c(SCc2ccnc(OC)n2)nnc1-c1ccc(OC)cc1	ZINC000450579246	GH	On-Demand	Anodyne	WNT3A	19	40
C[C@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@@H]1CO	ZINC000450579285	DE	On-Demand	Anodyne	SFRP1	42	32
C[C@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@@H]1CO	ZINC000450579285	DE	On-Demand	Anodyne	WNT3	40	31
C[C@@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@H]1CO	ZINC000450579286	DE	On-Demand	Anodyne	SFRP1	42	32
C[C@@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@H]1CO	ZINC000450579286	DE	On-Demand	Anodyne	WNT3	40	31
C[C@@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@@H]1CO	ZINC000450579287	DE	On-Demand	Anodyne	SFRP1	42	32
C[C@@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@@H]1CO	ZINC000450579287	DE	On-Demand	Anodyne	WNT3	40	31
C[C@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@H]1CO	ZINC000450579288	DE	On-Demand	Anodyne	SFRP1	42	32
C[C@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)[C@H]1CO	ZINC000450579288	DE	On-Demand	Anodyne	WNT3	40	31
O=C(c1ccc(N2CCC2)nc1)N(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000450579290	FF	On-Demand	Anodyne	SMO	0	40
O=C(c1ccc(N2CCC2)nc1)N(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000450579291	FF	On-Demand	Anodyne	SMO	0	40
CS(=O)(=O)c1ccc(N2CCC3(CCC(O)CC3)CC2)c(F)c1	ZINC000450579292	EF	On-Demand	Anodyne	SLC6A9	28	50
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450579300	FH	On-Demand	Anodyne	COLA	66	45
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450579300	FH	On-Demand	Anodyne	CPT1A	59	45
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450579300	FH	On-Demand	Anodyne	GRM5	0	41
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450579301	FH	On-Demand	Anodyne	COLA	66	45
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450579301	FH	On-Demand	Anodyne	CPT1A	59	45
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450579301	FH	On-Demand	Anodyne	GRM5	0	41
CCS(=O)(=O)c1ccc(CN(CC2CC2)c2ccccc2)cc1	ZINC000450579302	EH	On-Demand	Anodyne	CNR2	0	45
CCS(=O)(=O)c1ccc(CN(CC2CC2)c2ccccc2)cc1	ZINC000450579302	EH	On-Demand	Anodyne	RORC	26	43
COc1cc(CC(=O)NCc2nnc(C3CC3)n2C2CC2)ccc1Cl	ZINC000450579308	FG	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NCc2nnc(C3CC3)n2C2CC2)ccc1Cl	ZINC000450579308	FG	On-Demand	Anodyne	CAN2	0	41
O=C1C[C@]2(CCCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450579312	DE	On-Demand	Anodyne	ERG2	22	48
O=C1C[C@]2(CCCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450579312	DE	On-Demand	Anodyne	CYP2J2	46	33
O=C1C[C@@]2(CCCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450579313	DE	On-Demand	Anodyne	ERG2	22	48
O=C1C[C@@]2(CCCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450579313	DE	On-Demand	Anodyne	CYP2J2	46	33
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)no1	ZINC000450579321	GH	On-Demand	Anodyne	COLA	96	44
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)no1	ZINC000450579321	GH	On-Demand	Anodyne	CPT1A	93	44
Cc1nc([C@H]2CCCCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)no1	ZINC000450579324	GH	On-Demand	Anodyne	COLA	96	44
Cc1nc([C@H]2CCCCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)no1	ZINC000450579324	GH	On-Demand	Anodyne	CPT1A	93	44
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579326	DE	On-Demand	Anodyne	DRD2	15	44
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579326	DE	On-Demand	Anodyne	DRD4	23	43
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579326	DE	On-Demand	Anodyne	SLC6A1	65	32
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579326	DE	On-Demand	Anodyne	DRD3	20	45
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579326	DE	On-Demand	Anodyne	TACR2	15	40
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579326	DE	On-Demand	Anodyne	CTSL	21	40
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579326	DE	On-Demand	Anodyne	MCHR1	27	43
C[C@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579326	DE	On-Demand	Anodyne	BIRC2	73	44
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579327	DE	On-Demand	Anodyne	DRD2	15	44
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579327	DE	On-Demand	Anodyne	DRD4	23	43
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579327	DE	On-Demand	Anodyne	SLC6A1	65	32
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579327	DE	On-Demand	Anodyne	DRD3	20	45
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579327	DE	On-Demand	Anodyne	TACR2	15	40
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579327	DE	On-Demand	Anodyne	CTSL	21	40
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579327	DE	On-Demand	Anodyne	MCHR1	27	43
C[C@@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579327	DE	On-Demand	Anodyne	BIRC2	73	44
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579329	DE	On-Demand	Anodyne	DRD2	15	44
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579329	DE	On-Demand	Anodyne	DRD4	23	43
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579329	DE	On-Demand	Anodyne	SLC6A1	65	32
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579329	DE	On-Demand	Anodyne	DRD3	20	45
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579329	DE	On-Demand	Anodyne	TACR2	15	40
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579329	DE	On-Demand	Anodyne	CTSL	21	40
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579329	DE	On-Demand	Anodyne	MCHR1	27	43
C[C@@H](O)CCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579329	DE	On-Demand	Anodyne	BIRC2	73	44
C[C@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579331	DE	On-Demand	Anodyne	DRD2	15	44
C[C@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579331	DE	On-Demand	Anodyne	DRD4	23	43
C[C@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579331	DE	On-Demand	Anodyne	SLC6A1	65	32
C[C@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579331	DE	On-Demand	Anodyne	DRD3	20	45
C[C@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579331	DE	On-Demand	Anodyne	TACR2	15	40
C[C@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579331	DE	On-Demand	Anodyne	CTSL	21	40
C[C@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579331	DE	On-Demand	Anodyne	MCHR1	27	43
C[C@H](O)CCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579331	DE	On-Demand	Anodyne	BIRC2	73	44
CN(C)C(=O)CN(C[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450579349	DG	On-Demand	Anodyne	AMY2	44	30
CN(C)C(=O)CN(C[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450579350	DG	On-Demand	Anodyne	AMY2	44	30
Cc1nc([C@H]2CCCCCN2C(=O)c2ccsc2C)no1	ZINC000450579351	DH	On-Demand	Anodyne	COLA	70	42
Cc1nc([C@H]2CCCCCN2C(=O)c2ccsc2C)no1	ZINC000450579351	DH	On-Demand	Anodyne	CPT1A	68	42
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccsc2C)no1	ZINC000450579352	DH	On-Demand	Anodyne	COLA	70	42
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccsc2C)no1	ZINC000450579352	DH	On-Demand	Anodyne	CPT1A	68	42
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579354	GD	On-Demand	Anodyne	DRD4	24	41
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579354	GD	On-Demand	Anodyne	DRD3	24	49
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579354	GD	On-Demand	Anodyne	SSTR5	40	34
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579354	GD	On-Demand	Anodyne	MCHR1	23	41
COCCOC[C@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579354	GD	On-Demand	Anodyne	BIRC2	43	38
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579355	GD	On-Demand	Anodyne	DRD4	24	41
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579355	GD	On-Demand	Anodyne	DRD3	24	49
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579355	GD	On-Demand	Anodyne	SSTR5	40	34
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579355	GD	On-Demand	Anodyne	MCHR1	23	41
COCCOC[C@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579355	GD	On-Demand	Anodyne	BIRC2	43	38
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579356	GD	On-Demand	Anodyne	DRD4	24	41
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579356	GD	On-Demand	Anodyne	DRD3	24	49
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579356	GD	On-Demand	Anodyne	SSTR5	40	34
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579356	GD	On-Demand	Anodyne	MCHR1	23	41
COCCOC[C@@H](O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579356	GD	On-Demand	Anodyne	BIRC2	43	38
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579357	GD	On-Demand	Anodyne	DRD4	24	41
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579357	GD	On-Demand	Anodyne	DRD3	24	49
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579357	GD	On-Demand	Anodyne	SSTR5	40	34
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579357	GD	On-Demand	Anodyne	MCHR1	23	41
COCCOC[C@@H](O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450579357	GD	On-Demand	Anodyne	BIRC2	43	38
COc1ccc2nc(SCC3(C#N)CCC3)[nH]c2c1	ZINC000450579383	CG	On-Demand	Mild	CYP2C8	32	51
COc1ccc2nc(SCC3(C#N)CCC3)[nH]c2c1	ZINC000450579383	CG	On-Demand	Mild	CYP1A2	24	57
COc1ccc2nc(SCC3(C#N)CCC3)[nH]c2c1	ZINC000450579383	CG	On-Demand	Mild	CYP2C19	44	56
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nnc(C2CC2)n1C1CC1	ZINC000450579386	FH	On-Demand	Anodyne	CCR2	64	36
COc1ccc2c(c1OC)CCN(C(=O)[C@@H](O)C1CCC1)C2	ZINC000450579387	DD	On-Demand	Anodyne	AGTR2	53	41
CO[C@H](CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450579388	GG	On-Demand	Anodyne	TACR1	36	43
CO[C@H](CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450579388	GG	On-Demand	Anodyne	PDS	65	42
COc1ccc2c(c1OC)CCN(C(=O)[C@H](O)C1CCC1)C2	ZINC000450579389	DD	On-Demand	Anodyne	AGTR2	53	41
CO[C@@H](CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450579393	GG	On-Demand	Anodyne	TACR1	36	43
CO[C@@H](CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450579393	GG	On-Demand	Anodyne	PDS	65	42
Cc1nc([C@H]2CCCCCN2C(=O)c2cncc(Cl)c2)no1	ZINC000450579394	DG	On-Demand	Anodyne	CPT1A	51	40
Cc1nc([C@H]2CCCCCN2C(=O)c2cncc(Cl)c2)no1	ZINC000450579394	DG	On-Demand	Anodyne	GRM5	17	41
CO[C@@H](CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450579395	GG	On-Demand	Anodyne	TACR1	36	43
CO[C@@H](CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450579395	GG	On-Demand	Anodyne	PDS	65	42
Cc1nc([C@@H]2CCCCCN2C(=O)c2cncc(Cl)c2)no1	ZINC000450579396	DG	On-Demand	Anodyne	CPT1A	51	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2cncc(Cl)c2)no1	ZINC000450579396	DG	On-Demand	Anodyne	GRM5	17	41
CO[C@H](CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450579397	GG	On-Demand	Anodyne	TACR1	36	43
CO[C@H](CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450579397	GG	On-Demand	Anodyne	PDS	65	42
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579401	GG	On-Demand	Anodyne	DRD2	15	42
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579401	GG	On-Demand	Anodyne	DRD4	36	50
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579401	GG	On-Demand	Anodyne	DRD3	25	41
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579401	GG	On-Demand	Anodyne	SSTR5	43	36
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579401	GG	On-Demand	Anodyne	CCR3	31	42
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579401	GG	On-Demand	Anodyne	UTS2R	23	41
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579401	GG	On-Demand	Anodyne	MCHR1	23	57
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579401	GG	On-Demand	Anodyne	BIRC2	40	36
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579402	GG	On-Demand	Anodyne	DRD2	15	42
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579402	GG	On-Demand	Anodyne	DRD4	36	50
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579402	GG	On-Demand	Anodyne	DRD3	25	41
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579402	GG	On-Demand	Anodyne	SSTR5	43	36
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579402	GG	On-Demand	Anodyne	CCR3	31	42
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579402	GG	On-Demand	Anodyne	UTS2R	23	41
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579402	GG	On-Demand	Anodyne	MCHR1	23	57
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)n1	ZINC000450579402	GG	On-Demand	Anodyne	BIRC2	40	36
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(N)=O	ZINC000450579421	GD	On-Demand	Bother	BCL2L1	71	35
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(N)=O	ZINC000450579421	GD	On-Demand	Bother	BCL2	62	35
C[C@H](O)CCCN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450579428	DE	On-Demand	Anodyne	PDS	40	35
C[C@H](O)CCCN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450579429	DE	On-Demand	Anodyne	PDS	40	35
C[C@@H](O)CCCN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450579430	DE	On-Demand	Anodyne	PDS	40	35
CCOC1(C)CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450579431	EF	On-Demand	Anodyne	AVPR2	47	43
C[C@@H](O)CCCN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450579432	DE	On-Demand	Anodyne	PDS	40	35
CCOC1(C)CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450579490	DE	On-Demand	Bother	TAAR1	18	43
C[C@@](NCc1ccccc1OC1CC1)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450579496	GH	On-Demand	Anodyne	CCR2	71	36
C[C@](NCc1ccccc1OC1CC1)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450579497	GH	On-Demand	Anodyne	CCR2	71	36
Clc1ccc2nc(SC[C@@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450579512	CH	On-Demand	Anodyne	CYP2C19	15	43
Clc1ccc2nc(SC[C@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450579513	CH	On-Demand	Anodyne	CYP2C19	15	43
CCN(CC(F)F)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450579514	DE	On-Demand	Anodyne	OPRD1	30	41
COCCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450579518	EF	On-Demand	Mild	HTR1A	74	41
COCCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450579518	EF	On-Demand	Mild	DRD2	65	41
COCCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450579518	EF	On-Demand	Mild	ADRA1D	60	42
COCCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450579518	EF	On-Demand	Mild	HTR2A	30	40
COCCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450579518	EF	On-Demand	Mild	ADRA1A	46	40
COCCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450579518	EF	On-Demand	Mild	ADRA1B	35	40
COCCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450579518	EF	On-Demand	Mild	DRD3	57	39
COCCOc1ccccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450579518	EF	On-Demand	Mild	HTR7	46	38
COC(=O)c1sc(NC(=O)Cc2ccc(O)c(OC)c2)nc1C1CCCC1	ZINC000450579525	GG	On-Demand	Anodyne	TRPV1	0	41
COC(=O)c1sc(NC(=O)Cc2ccc(O)c(OC)c2)nc1C1CCCC1	ZINC000450579525	GG	On-Demand	Anodyne	CSNK1D	40	42
COC(=O)c1sc(NC(=O)Cc2ccc(O)c(OC)c2)nc1C1CCCC1	ZINC000450579525	GG	On-Demand	Anodyne	CDK5	31	40
CCc1ccc(C2=CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)cc1	ZINC000450579532	EH	On-Demand	Anodyne	SLC6A7	0	45
CCC[C@@H](CNc1cnn(Cc2ccccc2)c(=O)c1Cl)OC	ZINC000450579542	EG	On-Demand	Anodyne	NPBWR1	56	45
CCC[C@H](CNc1cnn(Cc2ccccc2)c(=O)c1Cl)OC	ZINC000450579543	EG	On-Demand	Anodyne	NPBWR1	56	45
CCS(=O)(=O)c1ccc(CN(C)Cc2nc(-c3cccnc3)no2)cc1	ZINC000450579572	FF	On-Demand	Anodyne	ADRB3	19	43
CCOC(=O)c1ccc(CN(CC(N)=O)[C@H](C)c2ccccc2)nc1	ZINC000450579573	EE	On-Demand	Anodyne	P2RY12	15	41
O=C(c1cncc(Cl)c1)N1CCN2CCOC[C@H]2C1	ZINC000450579575	CC	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1cncc(Cl)c1)N1CCN2CCOC[C@@H]2C1	ZINC000450579576	CC	On-Demand	Anodyne	L3MBTL1	0	40
COCC(=O)N1CCc2c(NC(=O)[C@H](C)OCCc3ccccc3)cccc21	ZINC000450579598	GF	On-Demand	Anodyne	KCNQ2	54	35
CS(=O)(=O)c1ccc(N2CCc3c(Cl)cc(F)cc3C2)nc1	ZINC000450579612	EF	On-Demand	Anodyne	GPR119	15	43
Cc1cc(-c2nc(C(=O)N[C@@H](CCO)C(C)(C)C)co2)ccn1	ZINC000450579613	DF	On-Demand	Anodyne	IRAK4	20	41
Cc1cc(-c2nc(C(=O)N[C@H](CCO)C(C)(C)C)co2)ccn1	ZINC000450579614	DF	On-Demand	Anodyne	IRAK4	20	41
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCOC(C)C)cc2)c1	ZINC000450579617	FG	On-Demand	Anodyne	ANPEP	17	45
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCOC(C)C)cc2)c1	ZINC000450579617	FG	On-Demand	Anodyne	PTAFR	15	44
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCOC(C)C)cc2)c1	ZINC000450579617	FG	On-Demand	Anodyne	ROCK2	20	41
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCOC(C)C)cc2)c1	ZINC000450579617	FG	On-Demand	Anodyne	KCNK3	46	37
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCOC(C)C)cc2)c1	ZINC000450579617	FG	On-Demand	Anodyne	KCNK9	41	37
COC(=O)c1csc(CN2CCc3cc(-c4ccccc4)oc3C2)n1	ZINC000450579679	FH	On-Demand	Anodyne	CHRM5	27	40
COC(=O)c1csc(CN2CCc3cc(-c4ccccc4)oc3C2)n1	ZINC000450579679	FH	On-Demand	Anodyne	ABCB1B	52	32
CCOc1ccc2c(c1)CCN(CC[C@@H](C)O)C2	ZINC000450579686	BE	On-Demand	Anodyne	ABCB1	17	41
CCOc1ccc2c(c1)CCN(CC[C@@H](C)O)C2	ZINC000450579686	BE	On-Demand	Anodyne	NOD2	25	40
CCOc1ccc2c(c1)CCN(CC[C@H](C)O)C2	ZINC000450579687	BE	On-Demand	Anodyne	ABCB1	17	41
CCOc1ccc2c(c1)CCN(CC[C@H](C)O)C2	ZINC000450579687	BE	On-Demand	Anodyne	NOD2	25	40
CS(=O)(=O)CC1CCC(Nc2ccnc(N3CCCCC3)n2)CC1	ZINC000450579749	FD	On-Demand	Anodyne	PRKD1	64	34
CC[C@@](C)(NCc1ccc(Cl)c(OC)c1)C(N)=O	ZINC000450579751	CE	On-Demand	Anodyne	TRPV1	0	41
CC[C@@](C)(NCc1ccc(Cl)c(OC)c1)C(N)=O	ZINC000450579751	CE	On-Demand	Anodyne	PDE6A	42	33
CC[C@@](C)(NCc1ccc(Cl)c(OC)c1)C(N)=O	ZINC000450579751	CE	On-Demand	Anodyne	MT-ND1	24	42
CC[C@@](C)(NCc1ccc(Cl)c(OC)c1)C(N)=O	ZINC000450579751	CE	On-Demand	Anodyne	DRTS_TRYCR	45	31
CC(=O)c1cc(Cl)ccc1OCC1(C#N)CCC1	ZINC000450579752	CH	On-Demand	Mild	PTGDR2	29	41
CC[C@](C)(NCc1ccc(Cl)c(OC)c1)C(N)=O	ZINC000450579753	CE	On-Demand	Anodyne	TRPV1	0	41
CC[C@](C)(NCc1ccc(Cl)c(OC)c1)C(N)=O	ZINC000450579753	CE	On-Demand	Anodyne	PDE6A	42	33
CC[C@](C)(NCc1ccc(Cl)c(OC)c1)C(N)=O	ZINC000450579753	CE	On-Demand	Anodyne	MT-ND1	24	42
CC[C@](C)(NCc1ccc(Cl)c(OC)c1)C(N)=O	ZINC000450579753	CE	On-Demand	Anodyne	DRTS_TRYCR	45	31
Cc1csc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450579782	DH	On-Demand	Anodyne	COLA	66	42
Cc1csc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450579782	DH	On-Demand	Anodyne	CPT1A	46	39
Cc1csc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450579784	DH	On-Demand	Anodyne	COLA	66	42
Cc1csc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450579784	DH	On-Demand	Anodyne	CPT1A	46	39
COc1cccc(-n2cc(C(=O)N[C@@H]3CC[C@H](C)[C@H](C)C3)nn2)c1	ZINC000450579800	EF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@@H]3CC[C@@H](C)[C@@H](C)C3)nn2)c1	ZINC000450579801	EF	On-Demand	Anodyne	DRD4	43	33
Cc1cc(C2CCN(C(=O)c3c(C)cccc3Cl)CC2)n[nH]1	ZINC000450579802	DH	On-Demand	Anodyne	CCR5	42	39
Cc1cc(C2CCN(C(=O)c3c(C)cccc3Cl)CC2)n[nH]1	ZINC000450579802	DH	On-Demand	Anodyne	L3MBTL3	61	36
COc1ccc(NC(=O)C2(NCCc3cscn3)CCCC2)cc1OC	ZINC000450579804	GG	On-Demand	Anodyne	ENPP1	70	34
C[C@@H]1CCCN(C(=O)COc2ccc(C#N)c(Br)c2)[C@H]1CO	ZINC000450579808	FE	On-Demand	Mild	CPT1A	96	41
C[C@@H]1CCCN(C(=O)COc2ccc(C#N)c(Br)c2)[C@H]1CO	ZINC000450579808	FE	On-Demand	Mild	CPT2	42	37
C[C@@H]1CCCN(C(=O)COc2ccc(C#N)c(Br)c2)[C@@H]1CO	ZINC000450579809	FE	On-Demand	Mild	CPT1A	96	41
C[C@@H]1CCCN(C(=O)COc2ccc(C#N)c(Br)c2)[C@@H]1CO	ZINC000450579809	FE	On-Demand	Mild	CPT2	42	37
CS[C@H]1CN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C[C@H]1N1CCCC1	ZINC000450579810	GF	On-Demand	Anodyne	RIR1_HHV11	44	31
C[C@H]1CCCN(C(=O)COc2ccc(C#N)c(Br)c2)[C@H]1CO	ZINC000450579811	FE	On-Demand	Mild	CPT1A	96	41
C[C@H]1CCCN(C(=O)COc2ccc(C#N)c(Br)c2)[C@H]1CO	ZINC000450579811	FE	On-Demand	Mild	CPT2	42	37
C[C@H]1CCCN(C(=O)COc2ccc(C#N)c(Br)c2)[C@@H]1CO	ZINC000450579812	FE	On-Demand	Mild	CPT1A	96	41
C[C@H]1CCCN(C(=O)COc2ccc(C#N)c(Br)c2)[C@@H]1CO	ZINC000450579812	FE	On-Demand	Mild	CPT2	42	37
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H](C)[C@H]2CO)c1	ZINC000450579815	DE	On-Demand	Anodyne	UTS2R	47	34
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H](C)[C@@H]2CO)c1	ZINC000450579818	DE	On-Demand	Anodyne	UTS2R	47	34
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](C)[C@H]2CO)c1	ZINC000450579820	DE	On-Demand	Anodyne	UTS2R	47	34
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](C)[C@@H]2CO)c1	ZINC000450579822	DE	On-Demand	Anodyne	UTS2R	47	34
CS[C@@H]1CN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C[C@H]1N1CCCC1	ZINC000450579826	GF	On-Demand	Anodyne	RIR1_HHV11	44	31
CS[C@H]1CN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C[C@@H]1N1CCCC1	ZINC000450579828	GF	On-Demand	Anodyne	RIR1_HHV11	44	31
CS[C@@H]1CN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C[C@@H]1N1CCCC1	ZINC000450579831	GF	On-Demand	Anodyne	RIR1_HHV11	44	31
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)n1	ZINC000450579833	DG	On-Demand	Anodyne	CPT1A	77	44
CCOC1(C)CN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C1	ZINC000450579836	EF	On-Demand	Anodyne	NPBWR1	55	43
C[C@H]1CCCN(C(=O)c2cc3ccc(Br)cc3s2)[C@H]1CO	ZINC000450579841	FH	On-Demand	Anodyne	TRPC6	45	32
C[C@H]1CCCN(C(=O)c2cc3ccc(Br)cc3s2)[C@@H]1CO	ZINC000450579842	FH	On-Demand	Anodyne	TRPC6	45	32
C[C@@H]1CCCN(C(=O)c2cc3ccc(Br)cc3s2)[C@H]1CO	ZINC000450579843	FH	On-Demand	Anodyne	TRPC6	45	32
C[C@@H]1CCCN(C(=O)c2cc3ccc(Br)cc3s2)[C@@H]1CO	ZINC000450579844	FH	On-Demand	Anodyne	TRPC6	45	32
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450579848	GF	On-Demand	Anodyne	EPHX2	22	53
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450579848	GF	On-Demand	Anodyne	ACAT	0	40
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)n1	ZINC000450579849	DG	On-Demand	Anodyne	CPT1A	77	44
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450579850	GF	On-Demand	Anodyne	EPHX2	22	53
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450579850	GF	On-Demand	Anodyne	ACAT	0	40
COc1cccc2c(N3CCC4(CCC(O)CC4)CC3)ccnc12	ZINC000450579851	EH	On-Demand	Anodyne	ADRA1B	15	41
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450579852	GF	On-Demand	Anodyne	EPHX2	22	53
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450579852	GF	On-Demand	Anodyne	ACAT	0	40
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450579854	GF	On-Demand	Anodyne	EPHX2	22	53
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450579854	GF	On-Demand	Anodyne	ACAT	0	40
CN(CCN1CCC[C@@]2(CNC(=O)C2)C1)Cc1ccccc1	ZINC000450579859	DD	On-Demand	Anodyne	SIGMAR1	16	43
CCOC1(C)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450579864	CF	On-Demand	Anodyne	HTT	0	47
CCOC1(C)CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450579865	ED	On-Demand	Anodyne	P2RY12	32	45
CCOC1(C)CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450579865	ED	On-Demand	Anodyne	LRRK2	23	40
CN(CCN1CCC[C@]2(CNC(=O)C2)C1)Cc1ccccc1	ZINC000450579868	DD	On-Demand	Anodyne	SIGMAR1	16	43
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450579873	DG	On-Demand	Anodyne	Q82323_9DELA	53	31
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450579882	DG	On-Demand	Anodyne	Q82323_9DELA	53	31
O=C(CC1(O)CCC1)NC[C@@H](O)CCc1ccccc1	ZINC000450579886	CD	On-Demand	Anodyne	LTB4R	30	40
CC[C@@](C)(NCC12CC3CC(CC(C3)C1)C2)C(N)=O	ZINC000450579888	CE	On-Demand	Anodyne	EPHX2	24	43
CC[C@](C)(NCC12CC3CC(CC(C3)C1)C2)C(N)=O	ZINC000450579890	CE	On-Demand	Anodyne	EPHX2	24	43
O=C(CC1(O)CCC1)NC[C@H](O)CCc1ccccc1	ZINC000450579895	CD	On-Demand	Anodyne	LTB4R	30	40
CC(=O)c1cc(Cl)ccc1OCc1cn(C)nc1C	ZINC000450579899	CG	On-Demand	Anodyne	PTGER1	62	38
CN(C)c1nc(NC2CCC(CS(C)(=O)=O)CC2)nc2ccccc12	ZINC000450579907	FE	On-Demand	Anodyne	ADRA2A	26	62
CN(C)c1nc(NC2CCC(CS(C)(=O)=O)CC2)nc2ccccc12	ZINC000450579907	FE	On-Demand	Anodyne	NPY2R	26	62
CN(C)c1nc(NC2CCC(CS(C)(=O)=O)CC2)nc2ccccc12	ZINC000450579907	FE	On-Demand	Anodyne	NPY5R	18	55
CN(C)c1nc(NC2CCC(CS(C)(=O)=O)CC2)nc2ccccc12	ZINC000450579907	FE	On-Demand	Anodyne	MCHR1	19	57
CCOC1(C)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450579908	CD	On-Demand	Anodyne	P2RY12	35	50
CCOC1(C)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450579908	CD	On-Demand	Anodyne	CXCR3	27	42
COCCn1c(SCCCCCC(C)=O)nc2ccccc21	ZINC000450579932	DH	On-Demand	Anodyne	HRH1	15	46
COCCn1c(SCCCCCC(C)=O)nc2ccccc21	ZINC000450579932	DH	On-Demand	Anodyne	PTGDR2	19	57
Cc1c(C(=O)N2CCC[C@H](C)[C@H]2CO)nn2c1OCCC2	ZINC000450579946	CD	On-Demand	Anodyne	TRPC6	44	33
Cc1c(C(=O)N2CCC[C@H](C)[C@@H]2CO)nn2c1OCCC2	ZINC000450579947	CD	On-Demand	Anodyne	TRPC6	44	33
COCC(=O)N1CCc2c(NC(=O)[C@@H](C)OCCc3ccccc3)cccc21	ZINC000450579949	GF	On-Demand	Anodyne	KCNQ2	54	35
Cc1c(C(=O)N2CCC[C@@H](C)[C@@H]2CO)nn2c1OCCC2	ZINC000450579950	CD	On-Demand	Anodyne	TRPC6	44	33
Cc1c(C(=O)N2CCC[C@@H](C)[C@H]2CO)nn2c1OCCC2	ZINC000450579954	CD	On-Demand	Anodyne	TRPC6	44	33
CCOC1(C)CN(c2ncc(C(F)(F)F)s2)C1	ZINC000450579980	CF	On-Demand	Anodyne	MLYCD	56	38
CC1(F)CC(Nc2ncnc3cc(F)c(F)cc23)C1	ZINC000450579992	CG	On-Demand	Anodyne	CD38	41	36
CCCNC(=O)C1(NCc2nc(-c3ccc(OC)nn3)no2)CCCCC1	ZINC000450580006	FD	On-Demand	Anodyne	NPPA	51	41
CCn1nnc(C)c1CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450580008	FE	On-Demand	Anodyne	PDS	40	33
CCn1nnc(C)c1CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450580012	FE	On-Demand	Anodyne	PDS	40	33
CS(=O)(=O)CC1CCC(Nc2ncccc2OCc2ccccc2)CC1	ZINC000450580024	FH	On-Demand	Anodyne	PPIA	52	44
C[C@@H](O)CCN1CCC[C@H]1CC(=O)c1cccs1	ZINC000450580025	CF	On-Demand	Anodyne	NAMPT	45	36
C[C@H](O)CCN1CCC[C@@H]1CC(=O)c1cccs1	ZINC000450580026	CF	On-Demand	Anodyne	NAMPT	45	36
C[C@H](O)CCN1CCC[C@H]1CC(=O)c1cccs1	ZINC000450580027	CF	On-Demand	Anodyne	NAMPT	45	36
CCCOc1ccc(C(=O)NCc2ccc3c(c2)C(=O)NCC3)c(OC)c1	ZINC000450580030	FF	On-Demand	Anodyne	CSNK1G2	50	34
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450580042	FJ	On-Demand	Anodyne	NAMPT	26	44
C[C@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450580043	FJ	On-Demand	Anodyne	NAMPT	26	44
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450580044	FJ	On-Demand	Anodyne	NAMPT	26	44
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN2CCOC[C@H]2C1	ZINC000450580054	FF	On-Demand	Anodyne	PRCP	63	38
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN2CCOC[C@H]2C1	ZINC000450580054	FF	On-Demand	Anodyne	MC3R	40	38
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN2CCOC[C@H]2C1	ZINC000450580055	FF	On-Demand	Anodyne	PRCP	63	38
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN2CCOC[C@H]2C1	ZINC000450580055	FF	On-Demand	Anodyne	MC3R	40	38
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN2CCOC[C@@H]2C1	ZINC000450580056	FF	On-Demand	Anodyne	PRCP	63	38
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN2CCOC[C@@H]2C1	ZINC000450580056	FF	On-Demand	Anodyne	MC3R	40	38
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN2CCOC[C@@H]2C1	ZINC000450580057	FF	On-Demand	Anodyne	PRCP	63	38
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN2CCOC[C@@H]2C1	ZINC000450580057	FF	On-Demand	Anodyne	MC3R	40	38
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	HTR1A	93	42
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	DRD2	74	45
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	DRD1	28	41
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	DRD4	44	45
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	ADRA1D	62	43
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	HTR2A	32	43
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	ADRA1A	59	40
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	ADRA1B	38	43
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	DRD3	74	45
COCCOc1ccccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450580059	GG	On-Demand	Anodyne	HTR7	54	41
COCCOC[C@@H](O)CN1CCCCc2ccc(OC)cc21	ZINC000450580064	DD	On-Demand	Anodyne	HSP90AB1	36	40
COCCOC[C@H](O)CN1CCCCc2ccc(OC)cc21	ZINC000450580065	DD	On-Demand	Anodyne	HSP90AB1	36	40
CCn1c(SCc2nc(C(=O)OC)cs2)nnc1-c1ccccc1	ZINC000450580067	FH	On-Demand	Anodyne	SLC27A1	47	42
CCC[C@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])OC	ZINC000450580069	DF	On-Demand	Bother	TAAR1	18	47
CCC[C@@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])OC	ZINC000450580070	DF	On-Demand	Bother	TAAR1	18	47
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	HTR1A	103	46
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	DRD2	81	46
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	DRD1	28	42
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	DRD4	52	46
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	ADRA1D	70	43
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	HTR2A	34	45
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	ADRA1A	63	43
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	DRD3	84	46
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	HTR7	56	39
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	AP2S1	0	45
CCOC(=O)c1ccc(CN2CCN(c3ccccc3OCCOC)CC2)nc1	ZINC000450580085	GF	On-Demand	Anodyne	ALPHA-1A	0	41
COc1cccc(-n2cc(C(=O)N[C@@H]3CC[C@H](C)[C@@H](C)C3)nn2)c1	ZINC000450580095	EF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@@H]3CC[C@@H](C)[C@H](C)C3)nn2)c1	ZINC000450580096	EF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(Oc2ccc(C(=O)N[C@H](CCO)C(C)(C)C)nc2)c1	ZINC000450580109	FG	On-Demand	Anodyne	ACACB	15	40
COc1cccc(Oc2ccc(C(=O)N[C@H](CCO)C(C)(C)C)nc2)c1	ZINC000450580109	FG	On-Demand	Anodyne	MTNR1B	25	42
COc1cccc(Oc2ccc(C(=O)N[C@@H](CCO)C(C)(C)C)nc2)c1	ZINC000450580110	FG	On-Demand	Anodyne	ACACB	15	40
COc1cccc(Oc2ccc(C(=O)N[C@@H](CCO)C(C)(C)C)nc2)c1	ZINC000450580110	FG	On-Demand	Anodyne	MTNR1B	25	42
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H](CCO)C(C)(C)C	ZINC000450580123	DF	On-Demand	Anodyne	CTSV	52	36
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H](CCO)C(C)(C)C	ZINC000450580124	DF	On-Demand	Anodyne	CTSV	52	36
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450580125	FF	On-Demand	Anodyne	KCNQ2	52	38
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450580126	FF	On-Demand	Anodyne	KCNQ2	52	38
Cc1cc([C@@H](C)Nc2ncc(C)c(C)n2)ccc1F	ZINC000450580130	CH	On-Demand	Anodyne	NTRK1	17	46
CCS(=O)(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450580145	EG	On-Demand	Anodyne	MLNR	23	42
CCS(=O)(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450580145	EG	On-Demand	Anodyne	NOD2	45	38
CCOc1ccc2c(c1)CCN(Cc1ccc(C(C)=O)cc1)C2	ZINC000450580147	DH	On-Demand	Anodyne	HRH3	25	45
CCOc1ccc2c(c1)CCN(Cc1ccc(C(C)=O)cc1)C2	ZINC000450580147	DH	On-Demand	Anodyne	SIGMAR1	24	42
CCOc1ccc2c(c1)CCN(Cc1ccc(C(C)=O)cc1)C2	ZINC000450580147	DH	On-Demand	Anodyne	ABCB1	30	46
CCOc1ccc2c(c1)CCN(Cc1ccc(C(C)=O)cc1)C2	ZINC000450580147	DH	On-Demand	Anodyne	MCHR1	15	40
CCOc1ccc2c(c1)CCN(Cc1ccc(C(C)=O)cc1)C2	ZINC000450580147	DH	On-Demand	Anodyne	NOD1	21	50
CCOc1ccc2c(c1)CCN(Cc1ccc(C(C)=O)cc1)C2	ZINC000450580147	DH	On-Demand	Anodyne	NOD2	61	61
COc1cccc(C(=O)CCCC(=O)N=c2nc(C)[nH]n2C)c1	ZINC000450580150	DD	On-Demand	Anodyne	DRD4	43	33
Cc1cc(C(=O)N2CCO[C@@H](CCc3ccccc3)C2)ncc1C(N)=O	ZINC000450580165	FD	On-Demand	Anodyne	STAT6	54	34
Cc1cc(C(=O)N2CCO[C@H](CCc3ccccc3)C2)ncc1C(N)=O	ZINC000450580166	FD	On-Demand	Anodyne	STAT6	54	34
C[C@]1(NC(=O)c2cccc3c2CCCC3)CCCOC1	ZINC000450580172	CF	On-Demand	Anodyne	G2YM83_BOTF4	40	35
C[C@@]1(NC(=O)c2cccc3c2CCCC3)CCCOC1	ZINC000450580173	CF	On-Demand	Anodyne	G2YM83_BOTF4	40	35
CCOC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)nc1	ZINC000450580176	FD	On-Demand	Anodyne	SSTR5	41	36
CCOC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)nc1	ZINC000450580177	FD	On-Demand	Anodyne	SSTR5	41	36
CC(C)NS(=O)(=O)[C@H]1CCN(CCC2=CCCCC2)C1	ZINC000450580191	DE	On-Demand	Anodyne	BIRC2	53	32
CC(C)NS(=O)(=O)[C@@H]1CCN(CCC2=CCCCC2)C1	ZINC000450580192	DE	On-Demand	Anodyne	BIRC2	53	32
COc1cc(CC(=O)N[C@@]2(C)CCCOC2)ccc1Cl	ZINC000450580193	CF	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@@]2(C)CCCOC2)ccc1Cl	ZINC000450580193	CF	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@]2(C)CCCOC2)ccc1Cl	ZINC000450580194	CF	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@]2(C)CCCOC2)ccc1Cl	ZINC000450580194	CF	On-Demand	Anodyne	CAN2	0	41
Cc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)c(O)n1	ZINC000450580199	CF	On-Demand	Anodyne	G2YM83_BOTF4	56	39
Cc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)c(O)n1	ZINC000450580200	CF	On-Demand	Anodyne	G2YM83_BOTF4	56	39
CC[C@@H](CO)N(C)c1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450580201	GF	On-Demand	Bother	COLA	89	35
CC[C@@H](CO)N(C)c1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450580201	GF	On-Demand	Bother	LIMK2	51	39
CC[C@H](CO)N(C)c1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450580202	GF	On-Demand	Bother	COLA	89	35
CC[C@H](CO)N(C)c1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450580202	GF	On-Demand	Bother	LIMK2	51	39
CCc1cc(N(C)[C@@H](CC)CO)n2ncnc2n1	ZINC000450580206	BC	On-Demand	Anodyne	DHOD	0	40
CCc1cc(N(C)[C@H](CC)CO)n2ncnc2n1	ZINC000450580207	BC	On-Demand	Anodyne	DHOD	0	40
COc1ccc(NC(=O)C2(NC[C@H]3COCCO3)CCCC2)cc1OC	ZINC000450580211	FD	On-Demand	Anodyne	ENPP1	67	32
COc1ccc(NC(=O)C2(NC[C@@H]3COCCO3)CCCC2)cc1OC	ZINC000450580212	FD	On-Demand	Anodyne	ENPP1	67	32
CCOC1(C)CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450580223	CF	On-Demand	Anodyne	PDE3B	58	35
CCOC(=O)c1ccc(CSc2nc3ccccc3n2CCOC)nc1	ZINC000450580233	FH	On-Demand	Anodyne	PTGDR2	19	44
C[C@@H](O)CCN1CCC[C@@H]1CC(=O)c1cccs1	ZINC000450580244	CF	On-Demand	Anodyne	NAMPT	45	36
CS(=O)(=O)CC1CCC(Nc2nccc(N[C@H]3CCCOC3)n2)CC1	ZINC000450580245	FD	On-Demand	Anodyne	MAPK1	54	33
CS(=O)(=O)CC1CCC(Nc2nccc(N[C@H]3CCCOC3)n2)CC1	ZINC000450580245	FD	On-Demand	Anodyne	MAPK8	28	40
CS(=O)(=O)CC1CCC(Nc2nccc(N[C@@H]3CCCOC3)n2)CC1	ZINC000450580246	FD	On-Demand	Anodyne	MAPK1	54	33
CS(=O)(=O)CC1CCC(Nc2nccc(N[C@@H]3CCCOC3)n2)CC1	ZINC000450580246	FD	On-Demand	Anodyne	MAPK8	28	40
CCOC1(C)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450580247	EF	On-Demand	Anodyne	ACACA	28	43
CCOC1(C)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450580247	EF	On-Demand	Anodyne	ACACB	27	45
CCOC1(C)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450580247	EF	On-Demand	Anodyne	TNKS	59	33
CCC(CC)(CC(=O)OC)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450580257	EF	On-Demand	Anodyne	RORC	42	33
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450580258	ED	On-Demand	Anodyne	DRD3	0	41
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450580258	ED	On-Demand	Anodyne	BIRC2	42	38
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450580259	ED	On-Demand	Anodyne	DRD3	0	41
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450580259	ED	On-Demand	Anodyne	BIRC2	42	38
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450580260	ED	On-Demand	Anodyne	DRD3	0	41
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450580260	ED	On-Demand	Anodyne	BIRC2	42	38
CCC[C@H](O)CN[C@@H](c1ccccc1)[C@H](C)C(=O)OC	ZINC000450580261	CE	On-Demand	Anodyne	CAPN2	42	35
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450580262	ED	On-Demand	Anodyne	DRD3	0	41
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450580262	ED	On-Demand	Anodyne	BIRC2	42	38
CCC[C@H](O)CN[C@H](c1ccccc1)[C@H](C)C(=O)OC	ZINC000450580263	CE	On-Demand	Anodyne	CAPN2	42	35
CCC[C@H](O)CN[C@H](c1ccccc1)[C@@H](C)C(=O)OC	ZINC000450580264	CE	On-Demand	Anodyne	CAPN2	42	35
CCC[C@H](O)CN[C@@H](c1ccccc1)[C@@H](C)C(=O)OC	ZINC000450580266	CE	On-Demand	Anodyne	CAPN2	42	35
O=C(N[C@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580267	FH	On-Demand	Anodyne	DRD4	22	50
O=C(N[C@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580267	FH	On-Demand	Anodyne	SLC6A1	45	32
O=C(N[C@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580267	FH	On-Demand	Anodyne	DRD3	15	41
O=C(N[C@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580267	FH	On-Demand	Anodyne	CCR3	28	41
O=C(N[C@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580267	FH	On-Demand	Anodyne	UTS2R	23	40
O=C(N[C@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580267	FH	On-Demand	Anodyne	MCHR1	18	54
O=C(N[C@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580267	FH	On-Demand	Anodyne	BIRC2	44	37
O=C(N[C@@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580268	FH	On-Demand	Anodyne	DRD4	22	50
O=C(N[C@@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580268	FH	On-Demand	Anodyne	SLC6A1	45	32
O=C(N[C@@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580268	FH	On-Demand	Anodyne	DRD3	15	41
O=C(N[C@@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580268	FH	On-Demand	Anodyne	CCR3	28	41
O=C(N[C@@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580268	FH	On-Demand	Anodyne	UTS2R	23	40
O=C(N[C@@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580268	FH	On-Demand	Anodyne	MCHR1	18	54
O=C(N[C@@H]1CCCN(CCc2cscn2)C1)c1ccc2ccccc2c1	ZINC000450580268	FH	On-Demand	Anodyne	BIRC2	44	37
CCOC1(C)CN(c2ccc(S(=O)(=O)Nc3cc(F)cc(F)c3)cn2)C1	ZINC000450580269	GF	On-Demand	Anodyne	MGAT1	43	29
Cc1ccc(Cn2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450580291	FH	On-Demand	Anodyne	AGTR1	35	41
Cc1ccc(Cn2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450580291	FH	On-Demand	Anodyne	PTGDR2	24	44
Cc1ccc(Cn2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450580295	FH	On-Demand	Anodyne	AGTR1	35	41
Cc1ccc(Cn2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450580295	FH	On-Demand	Anodyne	PTGDR2	24	44
CCOC1(C)CN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450580308	DE	On-Demand	Anodyne	HCN1	41	31
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1cc2cccnc2s1	ZINC000450580347	EG	On-Demand	Anodyne	TACR2	40	34
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cc2cccnc2s1	ZINC000450580349	EG	On-Demand	Anodyne	TACR2	40	34
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1cc2cccnc2s1	ZINC000450580352	EG	On-Demand	Anodyne	TACR2	40	34
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1cc2cccnc2s1	ZINC000450580356	EG	On-Demand	Anodyne	TACR2	40	34
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450580367	GG	On-Demand	Bother	BDKRB1	22	40
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450580369	GG	On-Demand	Bother	BDKRB1	22	40
CCc1cccc(C(=O)NC[C@H](C)c2nc(C)cs2)n1	ZINC000450580371	CF	On-Demand	Anodyne	ITGAV	40	35
CS(=O)(=O)CC1CCC(Nc2cc(N3CCC[C@H]3CO)ncn2)CC1	ZINC000450580377	FD	On-Demand	Anodyne	PRCP	0	41
CS(=O)(=O)CC1CCC(Nc2cc(N3CCC[C@@H]3CO)ncn2)CC1	ZINC000450580378	FD	On-Demand	Anodyne	PRCP	0	41
CCc1cccc(C(=O)NC[C@@H](C)c2nc(C)cs2)n1	ZINC000450580379	CF	On-Demand	Anodyne	ITGAV	40	35
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450580390	EF	On-Demand	Anodyne	MMP13	0	42
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450580391	EF	On-Demand	Anodyne	MMP13	0	42
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450580392	EF	On-Demand	Anodyne	MMP13	0	42
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450580393	EF	On-Demand	Anodyne	MMP13	0	42
Cc1csc([C@H](C)CNC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450580397	EG	On-Demand	Anodyne	CTSV	47	34
Cc1csc([C@H](C)CNC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450580397	EG	On-Demand	Anodyne	SLC12A5	22	42
Cc1csc([C@@H](C)CNC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450580398	EG	On-Demand	Anodyne	CTSV	47	34
Cc1csc([C@@H](C)CNC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450580398	EG	On-Demand	Anodyne	SLC12A5	22	42
O=C(c1ccc(NC[C@@H]2CCCCC2(F)F)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450580401	GG	On-Demand	Bother	L3MBTL1	0	41
O=C(c1ccc(NC[C@@H]2CCCCC2(F)F)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450580401	GG	On-Demand	Bother	L3MBTL3	17	41
O=C(c1ccc(NC[C@H]2CCCCC2(F)F)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450580406	GG	On-Demand	Bother	L3MBTL1	0	41
O=C(c1ccc(NC[C@H]2CCCCC2(F)F)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450580406	GG	On-Demand	Bother	L3MBTL3	17	41
COCC(=O)N1CCc2c(NC(=O)[C@H]3Cc4cccc(C)c4O3)cccc21	ZINC000450580427	FE	On-Demand	Anodyne	CYSLTR2	41	32
COCC(=O)N1CCc2c(NC(=O)[C@@H]3Cc4cccc(C)c4O3)cccc21	ZINC000450580432	FE	On-Demand	Anodyne	CYSLTR2	41	32
CCCOc1ccc(OCCC(C)(F)F)cc1	ZINC000450580440	BH	On-Demand	Anodyne	PLA2G4B	50	35
Clc1ccc2nc(SCC[C@H]3CCOC3)[nH]c2c1	ZINC000450580441	CH	On-Demand	Anodyne	CYP1A2	15	42
Clc1ccc2nc(SCC[C@H]3CCOC3)[nH]c2c1	ZINC000450580441	CH	On-Demand	Anodyne	CYP2C19	16	42
Clc1ccc2nc(SCC[C@@H]3CCOC3)[nH]c2c1	ZINC000450580442	CH	On-Demand	Anodyne	CYP1A2	15	42
Clc1ccc2nc(SCC[C@@H]3CCOC3)[nH]c2c1	ZINC000450580442	CH	On-Demand	Anodyne	CYP2C19	16	42
COCC(=O)N1CCc2c(NC(=O)c3ccc(C(F)(F)F)cc3C)cccc21	ZINC000450580447	GH	On-Demand	Anodyne	AVPR2	51	39
COCC(=O)N1CCc2c(NC(=O)c3ccc(C(F)(F)F)cc3C)cccc21	ZINC000450580447	GH	On-Demand	Anodyne	MTTP	64	38
Cc1cc(N2CC3(CC3)C2)nc(-c2ccccn2)n1	ZINC000450580458	CE	On-Demand	Anodyne	METAP1	28	40
CCOC1(C)CN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450580463	CD	On-Demand	Anodyne	PTGS2	39	42
CS(=O)(=O)CC1CCC(Nc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450580464	FI	On-Demand	Anodyne	HRP1_PLAFA	60	31
CSc1ccc2ncnc(NC3CCC(CS(C)(=O)=O)CC3)c2c1	ZINC000450580465	FG	On-Demand	Anodyne	CD38	60	41
COc1cccc(OCCC(=O)NCc2ccnc(SC)c2)c1	ZINC000450580466	EF	On-Demand	Anodyne	MTNR1A	45	42
COc1cccc(OCCC(=O)NCc2ccnc(SC)c2)c1	ZINC000450580466	EF	On-Demand	Anodyne	MTNR1B	41	42
COc1cccc(OCCC(=O)NCc2ccnc(SC)c2)c1	ZINC000450580466	EF	On-Demand	Anodyne	PDS	41	34
COC(=O)CNC(=O)c1ccc(NC[C@H]2CCCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450580474	GF	On-Demand	Bother	TAAR1	19	40
COC(=O)CNC(=O)c1ccc(NC[C@@H]2CCCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450580475	GF	On-Demand	Bother	TAAR1	19	40
C[C@H](c1ccc(COc2ccc(CO)cc2)cc1)C(F)(F)F	ZINC000450580482	DI	On-Demand	Anodyne	SLC15A1	0	40
C[C@H](c1ccc(COc2ccc(CO)cc2)cc1)C(F)(F)F	ZINC000450580482	DI	On-Demand	Anodyne	FFAR1	36	42
O=S(=O)(c1cccnc1NC[C@@H]1CCCCC1(F)F)N1CCCCC1	ZINC000450580485	FG	On-Demand	Anodyne	EPHX2	16	43
O=S(=O)(c1cccnc1NC[C@H]1CCCCC1(F)F)N1CCCCC1	ZINC000450580486	FG	On-Demand	Anodyne	EPHX2	16	43
C[C@@H](c1ccc(COc2ccc(CO)cc2)cc1)C(F)(F)F	ZINC000450580488	DI	On-Demand	Anodyne	SLC15A1	0	40
C[C@@H](c1ccc(COc2ccc(CO)cc2)cc1)C(F)(F)F	ZINC000450580488	DI	On-Demand	Anodyne	FFAR1	38	43
CC(=O)c1cccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)c1	ZINC000450580497	EF	On-Demand	Anodyne	DRD3	0	40
CC(=O)c1cccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)c1	ZINC000450580497	EF	On-Demand	Anodyne	L3MBTL1	0	41
CC(=O)c1cccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)c1	ZINC000450580497	EF	On-Demand	Anodyne	MBTD1	0	41
CCS(=O)(=O)c1ccc(CN(CC(N)=O)[C@H](C)c2ccccc2)cc1	ZINC000450580509	FF	On-Demand	Anodyne	RORC	35	45
CCNC(=O)c1ccc(N2CCc3c(Cl)cc(F)cc3C2)nn1	ZINC000450580516	EF	On-Demand	Anodyne	SCD1	44	43
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450580519	FE	On-Demand	Anodyne	KCNQ2	69	35
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450580519	FE	On-Demand	Anodyne	TRY2_BOVIN	67	35
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450580520	FE	On-Demand	Anodyne	KCNQ2	69	35
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450580520	FE	On-Demand	Anodyne	TRY2_BOVIN	67	35
CC(C)(C)[C@@H](CCO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450580529	CD	On-Demand	Anodyne	HPGDS	23	44
C[C@]1(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCOC1	ZINC000450580562	DE	On-Demand	Bother	CACNA1D	52	32
C[C@@]1(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCOC1	ZINC000450580563	DE	On-Demand	Bother	CACNA1D	52	32
CCC[C@@H]1CCCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450580564	CG	On-Demand	Anodyne	OPRK1	38	53
CCC[C@H]1CCCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450580565	CG	On-Demand	Anodyne	OPRK1	38	53
CC(C)n1cnnc1S[C@H](C)C(=O)Nc1nccs1	ZINC000450580573	CE	On-Demand	Anodyne	MAP1	105	38
CC(C)n1cnnc1S[C@@H](C)C(=O)Nc1nccs1	ZINC000450580574	CE	On-Demand	Anodyne	MAP1	105	38
C[C@H]1C[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)CC[C@H]1C	ZINC000450580585	CH	On-Demand	Anodyne	MAPK14	21	41
C[C@H]1C[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)CC[C@H]1C	ZINC000450580585	CH	On-Demand	Anodyne	MAPK13	62	35
C[C@@H]1CC[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)C[C@H]1C	ZINC000450580586	CH	On-Demand	Anodyne	MAPK14	21	41
C[C@@H]1CC[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)C[C@H]1C	ZINC000450580586	CH	On-Demand	Anodyne	MAPK13	62	35
C[C@H]1C[C@H](NC(=O)c2ccc(C(C)(F)F)nc2)CC[C@H]1C	ZINC000450580587	CH	On-Demand	Anodyne	MAPK13	44	32
C[C@@H]1CC[C@H](NC(=O)c2ccc(C(C)(F)F)nc2)C[C@H]1C	ZINC000450580588	CH	On-Demand	Anodyne	MAPK14	21	41
C[C@@H]1CC[C@H](NC(=O)c2ccc(C(C)(F)F)nc2)C[C@H]1C	ZINC000450580588	CH	On-Demand	Anodyne	MAPK13	62	35
CC1(F)CC(Nc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C1	ZINC000450580595	DD	On-Demand	Bother	CA2	20	40
CC1(F)CC(Nc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C1	ZINC000450580595	DD	On-Demand	Bother	CA1	21	40
COc1ccc(NC(=O)C2(NC[C@H]3C[C@H]4CC[C@H]3O4)CCCC2)cc1OC	ZINC000450580632	FG	On-Demand	Anodyne	ENPP1	61	32
COc1ccc(NC(=O)C2(NC[C@@H]3C[C@H]4CC[C@H]3O4)CCCC2)cc1OC	ZINC000450580633	FG	On-Demand	Anodyne	ENPP1	61	32
C[C@@H](O)CCN1CC=C(c2ccc(Cl)cc2)CC1	ZINC000450580636	CG	On-Demand	Anodyne	QDPR	0	42
C[C@H](O)CCN1CC=C(c2ccc(Cl)cc2)CC1	ZINC000450580637	CG	On-Demand	Anodyne	QDPR	0	42
COc1cc(CN2CCN(c3nc(N)ns3)CC2)ccc1Cl	ZINC000450580638	ED	On-Demand	Anodyne	DRD1	20	42
COc1cc(CN2CCN(c3nc(N)ns3)CC2)ccc1Cl	ZINC000450580638	ED	On-Demand	Anodyne	SSTR5	43	36
COCCOC[C@@H](O)CN1CC=C(c2ccc(Cl)cc2)CC1	ZINC000450580646	EE	On-Demand	Anodyne	HSP90AB1	34	42
COCCOC[C@H](O)CN1CC=C(c2ccc(Cl)cc2)CC1	ZINC000450580647	EE	On-Demand	Anodyne	HSP90AB1	34	42
CCOC1(C)CN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450580660	ED	On-Demand	Anodyne	HRH1	0	43
CCOC1(C)CN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450580660	ED	On-Demand	Anodyne	HTR3A	25	52
CCOC1(C)CN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450580660	ED	On-Demand	Anodyne	HRH4	31	42
Cc1nc([C@@H]2CCCCCN2C(=O)CCCC(=O)C2CC2)no1	ZINC000450580665	DF	On-Demand	Anodyne	COLA	100	46
Cc1nc([C@@H]2CCCCCN2C(=O)CCCC(=O)C2CC2)no1	ZINC000450580665	DF	On-Demand	Anodyne	CPT1A	84	45
Cc1nc([C@H]2CCCCCN2C(=O)CCCC(=O)C2CC2)no1	ZINC000450580666	DF	On-Demand	Anodyne	COLA	100	46
Cc1nc([C@H]2CCCCCN2C(=O)CCCC(=O)C2CC2)no1	ZINC000450580666	DF	On-Demand	Anodyne	CPT1A	84	45
COc1ccc(NC(=O)C2(NCC3CC(F)(F)C3)CCCC2)cc1OC	ZINC000450580676	FH	On-Demand	Anodyne	ENPP1	56	32
COc1ccc2nc(SCc3cn(C)nc3C)[nH]c2c1	ZINC000450580681	CF	On-Demand	Anodyne	CYP2C8	37	59
COc1ccc2nc(SCc3cn(C)nc3C)[nH]c2c1	ZINC000450580681	CF	On-Demand	Anodyne	CYP1A2	25	57
COc1ccc2nc(SCc3cn(C)nc3C)[nH]c2c1	ZINC000450580681	CF	On-Demand	Anodyne	CYP2C19	50	61
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450580683	FD	On-Demand	Bother	PDE5A	17	43
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450580684	FD	On-Demand	Bother	PDE5A	17	43
CC(F)(F)CCn1cnc2ccc([N+](=O)[O-])cc2c1=O	ZINC000450580697	CE	On-Demand	Bother	F2RL3	45	32
CC(=O)CCCCCn1cnc2ccc([N+](=O)[O-])cc2c1=O	ZINC000450580701	DE	On-Demand	Bother	F2RL3	44	33
COc1cc(OC)c2ncnc(N3CC4(CC4)C3)c2c1	ZINC000450580728	CE	On-Demand	Anodyne	PDE3A	45	36
CCC[C@@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450580729	FE	On-Demand	Bother	BCL2L1	43	34
CCC[C@@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450580729	FE	On-Demand	Bother	LRRK2	22	40
CCC[C@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450580730	FE	On-Demand	Bother	BCL2L1	43	34
CCC[C@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450580730	FE	On-Demand	Bother	LRRK2	22	40
COc1ccc2nc(SCC3(OC)CCC3)[nH]c2c1	ZINC000450580733	CG	On-Demand	Anodyne	CYP2C8	35	55
COc1ccc2nc(SCC3(OC)CCC3)[nH]c2c1	ZINC000450580733	CG	On-Demand	Anodyne	CYP1A2	27	65
COc1ccc2nc(SCC3(OC)CCC3)[nH]c2c1	ZINC000450580733	CG	On-Demand	Anodyne	CYP2C19	49	60
CCCOc1cccc2c(NC3CCC(CS(C)(=O)=O)CC3)ccnc12	ZINC000450580757	GI	On-Demand	Anodyne	MAPK9	19	40
COc1cc(CNC2(C(N)=O)CCCCC2)ccc1Cl	ZINC000450580768	CF	On-Demand	Anodyne	PDE6A	40	31
CCc1nn(C)cc1CNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450580776	EE	On-Demand	Anodyne	P2RX7	45	38
COc1ccc(COCCNC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450580790	EC	On-Demand	Anodyne	GBA2	15	41
COc1ccc(COCCNC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450580790	EC	On-Demand	Anodyne	CA9	17	42
CN(CCc1cscn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450580802	DF	On-Demand	Anodyne	DRD3	0	40
CN(CCc1cscn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450580802	DF	On-Demand	Anodyne	SIGMAR1	33	41
CN(CCc1cscn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450580802	DF	On-Demand	Anodyne	SCN9A	0	45
CN(CCc1cscn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450580802	DF	On-Demand	Anodyne	SCN5A	62	43
CN(CCc1cscn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450580804	DF	On-Demand	Anodyne	DRD3	0	40
CN(CCc1cscn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450580804	DF	On-Demand	Anodyne	SIGMAR1	33	41
CN(CCc1cscn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450580804	DF	On-Demand	Anodyne	SCN9A	0	45
CN(CCc1cscn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450580804	DF	On-Demand	Anodyne	SCN5A	62	43
CCOC1(C)CN(c2nc(C)nc3sc4c(c23)CCC4)C1	ZINC000450580814	DG	On-Demand	Anodyne	CEL	18	42
Cc1cc(C)c(C(=O)N2CCN3CCOC[C@H]3C2)cc1Br	ZINC000450580828	FE	On-Demand	Anodyne	L3MBTL1	0	42
Cc1cc(C)c(C(=O)N2CCN3CCOC[C@H]3C2)cc1Br	ZINC000450580828	FE	On-Demand	Anodyne	L3MBTL3	16	42
Cc1cc(C)c(C(=O)N2CCN3CCOC[C@@H]3C2)cc1Br	ZINC000450580829	FE	On-Demand	Anodyne	L3MBTL1	0	42
Cc1cc(C)c(C(=O)N2CCN3CCOC[C@@H]3C2)cc1Br	ZINC000450580829	FE	On-Demand	Anodyne	L3MBTL3	16	42
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CC1CCC(=O)CC1	ZINC000450580843	EF	On-Demand	Anodyne	CNR1	0	42
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CC1CCC(=O)CC1	ZINC000450580843	EF	On-Demand	Anodyne	CNR2	0	40
COC(=O)C1(NCC23CC4CC(CC(C4)C2)C3)CCS(=O)(=O)CC1	ZINC000450580856	FD	On-Demand	Anodyne	EPHX2	0	40
COc1ccc2nc(C)nc(NC3CCC(CS(C)(=O)=O)CC3)c2c1	ZINC000450580865	FF	On-Demand	Anodyne	CCR4	15	45
CC(C)(C)[C@@H](CCO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450580902	EH	On-Demand	Anodyne	RBP4	89	45
CCC[C@@H]1CCCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450580906	CH	On-Demand	Anodyne	SFRP1	47	39
CCC[C@@H]1CCCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450580906	CH	On-Demand	Anodyne	WNT3	40	31
CCC[C@H]1CCCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450580907	CH	On-Demand	Anodyne	SFRP1	47	39
CCC[C@H]1CCCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450580907	CH	On-Demand	Anodyne	WNT3	40	31
CCSc1nnc(SCc2nc(-c3cc(C)ccn3)no2)s1	ZINC000450580936	FH	On-Demand	Anodyne	TNKS2	15	40
Cc1ccc([C@@H](C)Nc2nccc(C(F)F)n2)cc1F	ZINC000450580941	CI	On-Demand	Anodyne	HTR7	18	42
CCC[C@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC000450580977	CG	On-Demand	Anodyne	HCRTR1	19	41
CCC[C@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC000450580977	CG	On-Demand	Anodyne	HCRTR2	16	42
CCC[C@@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC000450580978	CG	On-Demand	Anodyne	HCRTR1	19	41
CCC[C@@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC000450580978	CG	On-Demand	Anodyne	HCRTR2	16	42
CC(C)OCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450580981	CE	On-Demand	Anodyne	MME	46	41
CC(C)OCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450580981	CE	On-Demand	Anodyne	PAPA1_CARPA	43	34
CC(C)OCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450580981	CE	On-Demand	Anodyne	MTNR1B	40	38
CC(C)OCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450580981	CE	On-Demand	Anodyne	CAPN1	41	35
CC(C)OCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450580981	CE	On-Demand	Anodyne	CAPN2	73	35
CC(C)OCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450580981	CE	On-Demand	Anodyne	ACE2	40	34
CC(C)OCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450580981	CE	On-Demand	Anodyne	NPR	54	37
CC(C)OCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450580981	CE	On-Demand	Anodyne	AMP1_PLAFQ	58	44
CC(C)OCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450580982	CE	On-Demand	Anodyne	MME	46	41
CC(C)OCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450580982	CE	On-Demand	Anodyne	PAPA1_CARPA	43	34
CC(C)OCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450580982	CE	On-Demand	Anodyne	MTNR1B	40	38
CC(C)OCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450580982	CE	On-Demand	Anodyne	CAPN1	41	35
CC(C)OCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450580982	CE	On-Demand	Anodyne	CAPN2	73	35
CC(C)OCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450580982	CE	On-Demand	Anodyne	ACE2	40	34
CC(C)OCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450580982	CE	On-Demand	Anodyne	NPR	54	37
CC(C)OCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450580982	CE	On-Demand	Anodyne	AMP1_PLAFQ	58	44
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000450580991	GK	On-Demand	Anodyne	TACR1	45	39
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000450580992	GK	On-Demand	Anodyne	TACR1	45	39
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000450580993	GK	On-Demand	Anodyne	TACR1	45	39
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000450580994	GK	On-Demand	Anodyne	TACR1	45	39
COCCn1c(S[C@@H]2C[C@@H](C)CCC2=O)nc2ccccc21	ZINC000450581000	DH	On-Demand	Anodyne	HRH1	0	46
COCCn1c(S[C@H]2C[C@@H](C)CCC2=O)nc2ccccc21	ZINC000450581001	DH	On-Demand	Anodyne	HRH1	0	46
COCCn1c(S[C@@H]2C[C@H](C)CCC2=O)nc2ccccc21	ZINC000450581002	DH	On-Demand	Anodyne	HRH1	0	46
COCCn1c(S[C@H]2C[C@H](C)CCC2=O)nc2ccccc21	ZINC000450581003	DH	On-Demand	Anodyne	HRH1	0	46
CS[C@@H]1CN(C(=O)c2ccnc(OC(F)F)c2)C[C@H]1N1CCCC1	ZINC000450581006	FE	On-Demand	Anodyne	L3MBTL3	40	33
CS[C@H]1CN(C(=O)c2ccnc(OC(F)F)c2)C[C@H]1N1CCCC1	ZINC000450581007	FE	On-Demand	Anodyne	L3MBTL3	40	33
CS[C@@H]1CN(C(=O)c2ccnc(OC(F)F)c2)C[C@@H]1N1CCCC1	ZINC000450581008	FE	On-Demand	Anodyne	L3MBTL3	40	33
CS[C@H]1CN(C(=O)c2ccnc(OC(F)F)c2)C[C@@H]1N1CCCC1	ZINC000450581009	FE	On-Demand	Anodyne	L3MBTL3	40	33
CCOC1(C)CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450581013	EG	On-Demand	Anodyne	PRNP	67	39
CCOC1(C)CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450581013	EG	On-Demand	Anodyne	HDAC1	30	41
CCOC1(C)CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450581013	EG	On-Demand	Anodyne	P4HTM	0	48
COc1ccc2c(c1OC)CCN(C(=O)Cc1cc3ccccc3s1)C2	ZINC000450581027	FI	On-Demand	Anodyne	AGTR2	40	33
CCC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581051	EG	On-Demand	Anodyne	DRD4	28	51
CCC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581051	EG	On-Demand	Anodyne	DRD3	0	40
CCC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581051	EG	On-Demand	Anodyne	CCR4	0	42
CCC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581051	EG	On-Demand	Anodyne	CAPN2	65	41
CCC[C@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581051	EG	On-Demand	Anodyne	BIRC2	45	41
CCC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581052	EG	On-Demand	Anodyne	DRD4	28	51
CCC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581052	EG	On-Demand	Anodyne	DRD3	0	40
CCC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581052	EG	On-Demand	Anodyne	CCR4	0	42
CCC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581052	EG	On-Demand	Anodyne	CAPN2	65	41
CCC[C@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581052	EG	On-Demand	Anodyne	BIRC2	45	41
CCC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581053	EG	On-Demand	Anodyne	DRD4	28	51
CCC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581053	EG	On-Demand	Anodyne	DRD3	0	40
CCC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581053	EG	On-Demand	Anodyne	CCR4	0	42
CCC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581053	EG	On-Demand	Anodyne	CAPN2	65	41
CCC[C@@H](O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581053	EG	On-Demand	Anodyne	BIRC2	45	41
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581054	EG	On-Demand	Anodyne	DRD4	28	51
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581054	EG	On-Demand	Anodyne	DRD3	0	40
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581054	EG	On-Demand	Anodyne	CCR4	0	42
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581054	EG	On-Demand	Anodyne	CAPN2	65	41
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581054	EG	On-Demand	Anodyne	BIRC2	45	41
Cc1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)no1	ZINC000450581066	GJ	On-Demand	Anodyne	CPT1A	59	42
Cc1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)no1	ZINC000450581066	GJ	On-Demand	Anodyne	RBP4	71	35
Cc1nc([C@@H]2CCCCCN2C(=O)C(CC(C)C)CC(C)C)no1	ZINC000450581078	EJ	On-Demand	Anodyne	COLA	44	40
Cc1nc([C@@H]2CCCCCN2C(=O)C(CC(C)C)CC(C)C)no1	ZINC000450581078	EJ	On-Demand	Anodyne	CPT1A	43	40
Cc1nc([C@H]2CCCCCN2C(=O)C(CC(C)C)CC(C)C)no1	ZINC000450581079	EJ	On-Demand	Anodyne	COLA	44	40
Cc1nc([C@H]2CCCCCN2C(=O)C(CC(C)C)CC(C)C)no1	ZINC000450581079	EJ	On-Demand	Anodyne	CPT1A	43	40
CCOC1(C)CN(c2nc(O)c3ccccc3n2)C1	ZINC000450581090	CD	On-Demand	Anodyne	METG	47	31
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450581092	FH	On-Demand	Anodyne	COLA	127	54
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450581092	FH	On-Demand	Anodyne	CPT1A	108	51
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450581095	FH	On-Demand	Anodyne	COLA	127	54
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450581095	FH	On-Demand	Anodyne	CPT1A	108	51
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450581098	FH	On-Demand	Anodyne	COLA	127	54
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450581098	FH	On-Demand	Anodyne	CPT1A	108	51
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450581100	FH	On-Demand	Anodyne	COLA	127	54
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450581100	FH	On-Demand	Anodyne	CPT1A	108	51
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	HTR1A	32	49
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	DRD2	38	59
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	DRD1	26	56
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	DRD4	23	56
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	HTR2A	35	48
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	HTR2C	24	51
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	DRD3	17	59
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	ERG2	22	48
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	HTR7	33	48
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	SLC18A3	19	45
Nc1nsc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450581101	ED	On-Demand	Anodyne	CYP2J2	50	36
COCCOc1ccccc1N1CCN(CCc2cscn2)CC1	ZINC000450581113	EF	On-Demand	Anodyne	DRD1	47	42
COCCOc1ccccc1N1CCN(CCc2cscn2)CC1	ZINC000450581113	EF	On-Demand	Anodyne	DRD3	26	42
COCCOc1ccccc1N1CCN(CCc2cscn2)CC1	ZINC000450581113	EF	On-Demand	Anodyne	AP2S1	0	43
COCCOc1ccccc1N1CCN(CCc2cscn2)CC1	ZINC000450581113	EF	On-Demand	Anodyne	ALPHA-1A	0	40
COc1ccc2nc(SCC3CC(F)(F)C3)[nH]c2c1	ZINC000450581147	CH	On-Demand	Anodyne	CYP2C8	33	53
COc1ccc2nc(SCC3CC(F)(F)C3)[nH]c2c1	ZINC000450581147	CH	On-Demand	Anodyne	CYP1A2	26	76
COc1ccc2nc(SCC3CC(F)(F)C3)[nH]c2c1	ZINC000450581147	CH	On-Demand	Anodyne	CYP2C19	48	61
O=C([C@H]1CCN(c2ccccc2)C1)N1CCN2CCOC[C@H]2C1	ZINC000450581150	DD	On-Demand	Anodyne	AKR1C3	25	44
COc1cccc2c(NC3CCC(CS(C)(=O)=O)CC3)c(C)cnc12	ZINC000450581152	FH	On-Demand	Anodyne	ATP4A	22	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCN2CCOC[C@H]2C1	ZINC000450581155	DD	On-Demand	Anodyne	AKR1C3	25	44
O=C([C@H]1CCN(c2ccccc2)C1)N1CCN2CCOC[C@@H]2C1	ZINC000450581156	DD	On-Demand	Anodyne	AKR1C3	25	44
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCN2CCOC[C@@H]2C1	ZINC000450581158	DD	On-Demand	Anodyne	AKR1C3	25	44
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	DRD1	61	49
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	SLC6A4	0	44
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	DRD3	32	44
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	ADRA2B	0	51
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	HTR6	0	45
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	ABCB1	57	48
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	HSP90AB1	35	41
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	AP2S1	0	55
CCC(=O)CCCN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581160	EF	On-Demand	Anodyne	ALPHA-1A	0	49
Cc1csc2c(NC3CCC(CS(C)(=O)=O)CC3)ncnc12	ZINC000450581173	EG	On-Demand	Anodyne	LPAR2	20	40
COc1cc(NC(=O)CN(C)Cc2ccccc2OC2CC2)cc(OC)c1	ZINC000450581187	FG	On-Demand	Anodyne	TSPO	42	33
CC[C@](C)(NCCN(C)Cc1ccccc1)C(N)=O	ZINC000450581190	CD	On-Demand	Anodyne	ACHE	15	40
CC[C@@](C)(NCCN(C)Cc1ccccc1)C(N)=O	ZINC000450581191	CD	On-Demand	Anodyne	ACHE	15	40
CCOC1(C)CN(c2ncnc3ccc(C)cc23)C1	ZINC000450581192	CF	On-Demand	Anodyne	PDE3B	46	35
CCOC1(C)CN(c2ncnc3ccc(C)cc23)C1	ZINC000450581192	CF	On-Demand	Anodyne	HTT	0	43
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	CHRM2	17	46
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	DRD2	25	46
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	DRD4	45	41
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	ACHE	29	43
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	HRH2	28	43
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	HRH1	18	42
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	DRD3	26	42
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	CHRM3	24	46
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	LTA4H	22	48
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	SIGMAR1	42	44
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	SSTR5	73	43
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	CCR3	70	42
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	FAAH	20	44
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	CXCR3	24	43
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	MCHR1	59	58
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	CCR8	36	50
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	AKR1C3	15	41
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	ADIPOR1	0	42
COc1cc(NC2CCN(Cc3cccc(C(C)=O)c3)CC2)cc(OC)c1	ZINC000450581197	FH	On-Demand	Anodyne	ADIPOR2	0	42
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	CA7	25	58
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	MMP13	33	40
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	ADAM17	17	40
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	MMP2	18	40
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	MMP14	15	40
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	PLA2G4B	51	36
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	MMP9	16	40
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	ADAMTS4	40	38
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	CA9	15	40
CCCOc1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450581200	EH	On-Demand	Anodyne	MMP1	15	46
CCOC1(C)CN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C1	ZINC000450581209	EC	On-Demand	Anodyne	CA2	37	47
CCOC1(C)CN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C1	ZINC000450581209	EC	On-Demand	Anodyne	CA7	45	38
C[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@@H]1CO	ZINC000450581227	DE	On-Demand	Anodyne	COLA	69	37
C[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@@H]1CO	ZINC000450581227	DE	On-Demand	Anodyne	CPT1A	53	37
C[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@@H]1CO	ZINC000450581227	DE	On-Demand	Anodyne	PREP	40	34
C[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@H]1CO	ZINC000450581228	DE	On-Demand	Anodyne	COLA	69	37
C[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@H]1CO	ZINC000450581228	DE	On-Demand	Anodyne	CPT1A	53	37
C[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@H]1CO	ZINC000450581228	DE	On-Demand	Anodyne	PREP	40	34
C[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@H]1CO	ZINC000450581229	DE	On-Demand	Anodyne	COLA	69	37
C[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@H]1CO	ZINC000450581229	DE	On-Demand	Anodyne	CPT1A	53	37
C[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@H]1CO	ZINC000450581229	DE	On-Demand	Anodyne	PREP	40	34
C[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@@H]1CO	ZINC000450581230	DE	On-Demand	Anodyne	COLA	69	37
C[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@@H]1CO	ZINC000450581230	DE	On-Demand	Anodyne	CPT1A	53	37
C[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@@H]1CO	ZINC000450581230	DE	On-Demand	Anodyne	PREP	40	34
CCc1cc(NC[C@@H]2CCCCC2(F)F)n2ncnc2n1	ZINC000450581235	CF	On-Demand	Anodyne	DHOD	0	48
CCc1cc(NC[C@H]2CCCCC2(F)F)n2ncnc2n1	ZINC000450581236	CF	On-Demand	Anodyne	DHOD	0	48
CCC[C@@H](CC(C)C)C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450581240	EH	On-Demand	Anodyne	KCNQ2	49	39
CCC[C@H](CC(C)C)C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450581241	EH	On-Demand	Anodyne	KCNQ2	49	39
CC[C@H]1CC[C@H](C)N1C(=O)CCOc1cccc(OC)c1	ZINC000450581243	CG	On-Demand	Anodyne	MTNR1A	28	43
CC[C@H]1CC[C@@H](C)N1C(=O)CCOc1cccc(OC)c1	ZINC000450581245	CG	On-Demand	Anodyne	MTNR1A	28	43
COC(=O)c1coc(CN2CCC(Nc3cc(OC)cc(OC)c3)CC2)n1	ZINC000450581246	GF	On-Demand	Anodyne	SSTR5	62	37
COC(=O)c1coc(CN2CCC(Nc3cc(OC)cc(OC)c3)CC2)n1	ZINC000450581246	GF	On-Demand	Anodyne	MCHR1	19	42
CC[C@@H]1CC[C@H](C)N1C(=O)CCOc1cccc(OC)c1	ZINC000450581247	CG	On-Demand	Anodyne	MTNR1A	28	43
COc1ccc(-c2nnc(N3CC4(CC4)C3)c3ccccc23)cc1	ZINC000450581257	DH	On-Demand	Anodyne	SMO	38	41
CCOC1(C)CN(c2ccc3ccccc3n2)C1	ZINC000450581260	BF	On-Demand	Anodyne	HTR3A	25	44
COc1cc(NC(=O)CN(C)CC/C=C\c2ccccc2)cc(OC)c1	ZINC000450581261	FH	On-Demand	Anodyne	LTA4H	23	41
COc1cc(NC(=O)CN(C)CC/C=C/c2ccccc2)cc(OC)c1	ZINC000450581262	FH	On-Demand	Anodyne	LTA4H	23	41
CCOC1(C)CN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C1	ZINC000450581263	EF	On-Demand	Anodyne	P2RY12	32	45
CCCOc1ccc(OCc2cccc(C)n2)cc1	ZINC000450581264	CH	On-Demand	Anodyne	CYSLTR1	23	42
CCCOc1ccc(OCc2cccc(C)n2)cc1	ZINC000450581264	CH	On-Demand	Anodyne	PLA2G4B	51	33
COc1ccc2nc(SCCCCCC(C)=O)[nH]c2c1	ZINC000450581265	CH	On-Demand	Anodyne	CYP2C8	38	53
COc1ccc2nc(SCCCCCC(C)=O)[nH]c2c1	ZINC000450581265	CH	On-Demand	Anodyne	SOAT1	39	50
COc1ccc2nc(SCCCCCC(C)=O)[nH]c2c1	ZINC000450581265	CH	On-Demand	Anodyne	CYP1A2	29	72
COc1ccc2nc(SCCCCCC(C)=O)[nH]c2c1	ZINC000450581265	CH	On-Demand	Anodyne	CYP2C19	51	72
COc1ccc2nc(SCCCCCC(C)=O)[nH]c2c1	ZINC000450581265	CH	On-Demand	Anodyne	HDA106	0	42
COc1ccc2nc(SCCCCCC(C)=O)[nH]c2c1	ZINC000450581265	CH	On-Demand	Anodyne	HD1B	0	40
COc1ccc2nc(SCCCCCC(C)=O)[nH]c2c1	ZINC000450581265	CH	On-Demand	Anodyne	ENPP1	53	35
CC(C)NS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450581284	EE	On-Demand	Anodyne	BIRC2	84	48
CC(C)NS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450581285	EE	On-Demand	Anodyne	BIRC2	84	48
Cc1cccc(CN[C@](C)(C(N)=O)c2cccc(Cl)c2)n1	ZINC000450581291	DF	On-Demand	Anodyne	DPP8	18	41
Cc1cccc(CN[C@@](C)(C(N)=O)c2cccc(Cl)c2)n1	ZINC000450581294	DF	On-Demand	Anodyne	DPP8	18	41
CCCNC(=O)C1(NC[C@@H](Cc2ccccc2)OC)CCCCC1	ZINC000450581302	EG	On-Demand	Anodyne	MME	40	35
CCCNC(=O)C1(NC[C@@H](Cc2ccccc2)OC)CCCCC1	ZINC000450581302	EG	On-Demand	Anodyne	TACR2	43	34
CCCNC(=O)C1(NC[C@@H](Cc2ccccc2)OC)CCCCC1	ZINC000450581302	EG	On-Demand	Anodyne	TIMP3	47	35
CCCNC(=O)C1(NC[C@@H](Cc2ccccc2)OC)CCCCC1	ZINC000450581302	EG	On-Demand	Anodyne	NPPA	40	31
CCCNC(=O)C1(NC[C@H](Cc2ccccc2)OC)CCCCC1	ZINC000450581303	EG	On-Demand	Anodyne	MME	40	35
CCCNC(=O)C1(NC[C@H](Cc2ccccc2)OC)CCCCC1	ZINC000450581303	EG	On-Demand	Anodyne	TACR2	43	34
CCCNC(=O)C1(NC[C@H](Cc2ccccc2)OC)CCCCC1	ZINC000450581303	EG	On-Demand	Anodyne	TIMP3	47	35
CCCNC(=O)C1(NC[C@H](Cc2ccccc2)OC)CCCCC1	ZINC000450581303	EG	On-Demand	Anodyne	NPPA	40	31
C[C@@H](O)CCN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450581304	DC	On-Demand	Anodyne	ADRB3	0	43
C[C@@H](O)CCN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450581307	DC	On-Demand	Anodyne	ADRB3	0	43
C[C@H](O)CCN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450581310	DC	On-Demand	Anodyne	ADRB3	0	43
C[C@@](NCc1ccn(CC(F)(F)F)n1)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450581311	GF	On-Demand	Anodyne	PDS	41	33
C[C@H](O)CCN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450581312	DC	On-Demand	Anodyne	ADRB3	0	43
C[C@](NCc1ccn(CC(F)(F)F)n1)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450581313	GF	On-Demand	Anodyne	PDS	41	33
CCOc1ccc2c(c1)CCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450581335	DH	On-Demand	Anodyne	HRH2	27	41
CCOc1ccc2c(c1)CCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450581335	DH	On-Demand	Anodyne	SIGMAR1	26	41
CCOc1ccc2c(c1)CCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450581335	DH	On-Demand	Anodyne	ABCB1	32	40
CCOc1ccc2c(c1)CCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450581335	DH	On-Demand	Anodyne	AKR1C3	35	40
CCOc1ccc2c(c1)CCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450581335	DH	On-Demand	Anodyne	NOD1	18	43
CCOc1ccc2c(c1)CCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450581335	DH	On-Demand	Anodyne	NOD2	52	53
COC(=O)c1cccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)c1Cl	ZINC000450581340	GG	On-Demand	Anodyne	HCN1	40	31
COC(=O)c1cccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)c1Cl	ZINC000450581340	GG	On-Demand	Anodyne	HCN4	40	31
CCC[C@H]1CCCCN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450581349	DG	On-Demand	Anodyne	OPRK1	16	53
CCC[C@@H]1CCCCN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450581350	DG	On-Demand	Anodyne	OPRK1	16	53
CCOC1(C)CN(c2nc(-c3ccccc3)ns2)C1	ZINC000450581356	CF	On-Demand	Anodyne	FAAH	0	43
COC(=O)c1ccc(CC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)cc1	ZINC000450581366	GD	On-Demand	Anodyne	KCNQ2	28	40
CCOC1(C)CN(c2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3)cn2)C1	ZINC000450581379	GF	On-Demand	Anodyne	MLNR	0	44
CCOC1(C)CN(c2ccc(C(=O)NC)nn2)C1	ZINC000450581383	CC	On-Demand	Anodyne	SCD1	40	36
COC(=O)c1cnc(NCc2cc(C3CC3)ccc2F)c([N+](=O)[O-])c1	ZINC000450581393	EG	On-Demand	Bother	PRKCQ	46	44
O=C(Cc1cc2ccccc2s1)NCC1CCN(c2ccncc2)CC1	ZINC000450581398	FH	On-Demand	Anodyne	F10	21	51
CCOC1(C)CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450581422	CE	On-Demand	Anodyne	PDE3A	52	43
CCOC1(C)CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450581422	CE	On-Demand	Anodyne	PDGFRB	64	42
CCOC1(C)CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450581422	CE	On-Demand	Anodyne	PDE3B	77	43
CCOc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)on1	ZINC000450581440	DF	On-Demand	Anodyne	COLA	102	43
CCOc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)on1	ZINC000450581440	DF	On-Demand	Anodyne	CPT1A	76	42
CCOc1cc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)on1	ZINC000450581441	DF	On-Demand	Anodyne	COLA	102	43
CCOc1cc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)on1	ZINC000450581441	DF	On-Demand	Anodyne	CPT1A	76	42
Cc1nc([C@H]2CCCCCN2C(=O)c2cccc(C(F)(F)F)n2)no1	ZINC000450581443	FH	On-Demand	Anodyne	COLA	61	46
Cc1nc([C@H]2CCCCCN2C(=O)c2cccc(C(F)(F)F)n2)no1	ZINC000450581443	FH	On-Demand	Anodyne	CPT1A	53	46
Cc1nc([C@@H]2CCCCCN2C(=O)c2cccc(C(F)(F)F)n2)no1	ZINC000450581444	FH	On-Demand	Anodyne	COLA	61	46
Cc1nc([C@@H]2CCCCCN2C(=O)c2cccc(C(F)(F)F)n2)no1	ZINC000450581444	FH	On-Demand	Anodyne	CPT1A	53	46
COc1ccc(NC(=O)C2(NCc3cnns3)CCCC2)cc1OC	ZINC000450581453	FF	On-Demand	Anodyne	IMPDH2	0	44
COc1ccc(NC(=O)C2(NCc3cnns3)CCCC2)cc1OC	ZINC000450581453	FF	On-Demand	Anodyne	ENPP1	56	36
CC[C@H](CO)N(C)c1ncnc2scc(-c3ccccc3)c12	ZINC000450581456	DH	On-Demand	Anodyne	ADRB3	0	40
CC[C@@H](CO)N(C)c1ncnc2scc(-c3ccccc3)c12	ZINC000450581457	DH	On-Demand	Anodyne	ADRB3	0	40
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	HTR1A	17	42
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	DRD2	32	44
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	DRD4	30	54
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	HTR2A	17	54
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	SLC6A1	98	36
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	DRD3	34	44
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	HTR7	21	42
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	CAPN2	47	36
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	MCHR1	22	56
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	CYP2J2	47	33
CCC(=O)CCCN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581477	FH	On-Demand	Anodyne	BIRC2	49	40
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	HTR1A	17	42
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	DRD2	32	44
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	DRD4	30	54
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	HTR2A	17	54
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	SLC6A1	98	36
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	DRD3	34	44
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	HTR7	21	42
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	CAPN2	47	36
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	MCHR1	22	56
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	CYP2J2	47	33
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450581478	FH	On-Demand	Anodyne	BIRC2	49	40
CC[C@H](CO)N(C)c1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450581489	DC	On-Demand	Anodyne	NPY2R	46	37
CC[C@@H](CO)N(C)c1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450581494	DC	On-Demand	Anodyne	NPY2R	46	37
CC(C)(C)Oc1cc(N[C@@H](CO)c2ccc(F)cc2)ccc1[N+](=O)[O-]	ZINC000450581499	EI	On-Demand	Bother	PGR	15	44
CC(C)(C)Oc1cc(N[C@H](CO)c2ccc(F)cc2)ccc1[N+](=O)[O-]	ZINC000450581506	EI	On-Demand	Bother	PGR	15	44
CC[C@@H]1CC[C@@H](C)N1C(=O)CCOc1cccc(OC)c1	ZINC000450581512	CG	On-Demand	Anodyne	MTNR1A	28	43
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	ADRB2	26	53
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	HTR1A	78	50
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	DRD4	37	43
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	ADRA1D	72	53
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	HTR2A	44	50
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	ADRA1A	49	40
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	DRD3	75	58
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	HTR7	58	40
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	ABCB1	67	50
CCC[C@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581515	DD	On-Demand	Anodyne	HSP90AB1	46	53
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	ADRB2	26	53
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	HTR1A	78	50
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	DRD4	37	43
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	ADRA1D	72	53
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	HTR2A	44	50
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	ADRA1A	49	40
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	DRD3	75	58
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	HTR7	58	40
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	ABCB1	67	50
CCC[C@@H](O)CN1CCN(c2ccccc2OCCOC)CC1	ZINC000450581516	DD	On-Demand	Anodyne	HSP90AB1	46	53
CC[C@H](COCC(F)(F)F)Nc1ncnc2c(C)csc12	ZINC000450581520	DH	On-Demand	Anodyne	LPAR2	20	40
CC[C@@H](COCC(F)(F)F)Nc1ncnc2c(C)csc12	ZINC000450581521	DH	On-Demand	Anodyne	LPAR2	20	40
CC[C@H](COCC(F)(F)F)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450581539	GF	On-Demand	Anodyne	LRRK2	34	40
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581542	FE	On-Demand	Anodyne	DRD4	29	40
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581542	FE	On-Demand	Anodyne	HTR4	59	35
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581542	FE	On-Demand	Anodyne	SIGMAR1	15	40
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581542	FE	On-Demand	Anodyne	CCR3	33	40
COC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581542	FE	On-Demand	Anodyne	MCHR1	25	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450581546	CD	On-Demand	Anodyne	PEPD	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450581547	CD	On-Demand	Anodyne	PEPD	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450581548	CD	On-Demand	Anodyne	PEPD	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450581549	CD	On-Demand	Anodyne	PEPD	0	40
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581552	FE	On-Demand	Anodyne	DRD4	29	40
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581552	FE	On-Demand	Anodyne	HTR4	59	35
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581552	FE	On-Demand	Anodyne	SIGMAR1	15	40
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581552	FE	On-Demand	Anodyne	CCR3	33	40
COC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)cc1Cl	ZINC000450581552	FE	On-Demand	Anodyne	MCHR1	25	42
CC[C@@H](COCC(F)(F)F)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450581554	GF	On-Demand	Anodyne	LRRK2	34	40
CCc1cc(NC2CCC(CS(C)(=O)=O)CC2)n2ncnc2n1	ZINC000450581565	ED	On-Demand	Anodyne	DHOD	0	44
Cc1ccc2ncnc(NC(CF)CF)c2c1	ZINC000450581569	BF	On-Demand	Anodyne	CLK4	68	41
Cc1ccc2ncnc(NC(CF)CF)c2c1	ZINC000450581569	BF	On-Demand	Anodyne	CD38	69	42
O=[N+]([O-])c1ccc(NC(CF)CF)cc1	ZINC000450581599	BE	On-Demand	Bother	PGR	23	46
O=[N+]([O-])c1ccc(NC(CF)CF)cc1	ZINC000450581599	BE	On-Demand	Bother	AR	0	46
O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC(CF)CF	ZINC000450581615	CG	On-Demand	Bother	TRXR2	0	45
O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC(CF)CF	ZINC000450581615	CG	On-Demand	Bother	AKR1C4	0	53
CCOC(=O)c1ccc(CN(CCCO)Cc2cccc(Cl)c2)nc1	ZINC000450581664	FG	On-Demand	Anodyne	P2RY12	20	40
CCN(CC)S(=O)(=O)c1ccc(OCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450581666	FG	On-Demand	Bother	BDKRB1	16	40
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	HTR1A	82	43
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	DRD2	76	45
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	DRD1	33	44
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	DRD4	43	47
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	ADRA1D	64	44
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	HTR2A	36	45
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	ADRA1A	45	38
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	ADRA1B	34	41
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	DRD3	62	39
COCCOc1ccccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450581708	DD	On-Demand	Anodyne	HTR7	59	44
CCCOc1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450581717	CG	On-Demand	Anodyne	MAL12	0	41
COc1cc(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)ccc1Cl	ZINC000450581723	GH	On-Demand	Anodyne	PDE5A	17	42
COc1cc(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)ccc1Cl	ZINC000450581723	GH	On-Demand	Anodyne	PDS	41	41
Cc1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c(O)n1	ZINC000450581743	EE	On-Demand	Anodyne	MTOR	17	40
O=C(c1ccc2cnccc2c1)N1CCO[C@H](C2CCCCC2)C1	ZINC000450581758	DH	On-Demand	Anodyne	AKT1	0	40
COc1cc(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)ccc1Cl	ZINC000450581759	GH	On-Demand	Anodyne	PDE5A	17	42
COc1cc(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)ccc1Cl	ZINC000450581759	GH	On-Demand	Anodyne	PDS	41	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2cnc[nH]2)CC1	ZINC000450581761	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2cnc[nH]2)CC1	ZINC000450581762	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2cnc[nH]2)CC1	ZINC000450581763	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2cnc[nH]2)CC1	ZINC000450581764	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COc1cc(NC2CCN(C[C@@H]3CCCCN3C(C)C)CC2)cc(OC)c1	ZINC000450581769	GH	On-Demand	Anodyne	EHMT2	44	33
CC[C@@H](CO)N(C)c1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450581770	EE	On-Demand	Anodyne	AVPR2	61	37
O=C(c1ccc2cnccc2c1)N1CCO[C@@H](C2CCCCC2)C1	ZINC000450581771	DH	On-Demand	Anodyne	AKT1	0	40
CC[C@H](CO)N(C)c1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450581772	EE	On-Demand	Anodyne	AVPR2	61	37
CCN1CCN(C(=O)c2cccc(C#N)c2Br)CC1=O	ZINC000450581773	ED	On-Demand	Mild	P2RX7	24	60
CCOC1(C)CN(c2c(C#N)cnc3ccc(Cl)cc23)C1	ZINC000450581780	DG	On-Demand	Mild	SRC	45	38
COc1cc(NC2CCN(C[C@H]3CCCCN3C(C)C)CC2)cc(OC)c1	ZINC000450581787	GH	On-Demand	Anodyne	EHMT2	44	33
CC(=O)c1cccc(CN2CCC(c3cnc[nH]3)CC2)c1	ZINC000450581794	CF	On-Demand	Anodyne	DRD3	0	40
Cc1ccc(F)c(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450581797	EH	On-Demand	Anodyne	COLA	107	49
Cc1ccc(F)c(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450581797	EH	On-Demand	Anodyne	CPT1A	104	49
C[C@H](c1ccccc1)[C@H](O)CN1CCc2ccc(F)cc2C1	ZINC000450581798	CG	On-Demand	Anodyne	MTNR1B	22	44
Cc1ccc(F)c(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450581799	EH	On-Demand	Anodyne	COLA	107	49
Cc1ccc(F)c(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450581799	EH	On-Demand	Anodyne	CPT1A	104	49
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2ccc(F)cc2C1	ZINC000450581800	CG	On-Demand	Anodyne	MTNR1B	22	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2ccc(F)cc2C1	ZINC000450581802	CG	On-Demand	Anodyne	MTNR1B	22	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2ccc(F)cc2C1	ZINC000450581803	CG	On-Demand	Anodyne	MTNR1B	22	44
CCC[C@H](CNc1ccc(C(=O)CC)cc1[N+](=O)[O-])OC	ZINC000450581807	CG	On-Demand	Bother	TAAR1	15	44
COc1ccc(C(=O)N[C@@H](CCO)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450581809	ED	On-Demand	Anodyne	COLA	53	35
COc1ccc(C(=O)N[C@@H](CCO)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450581809	ED	On-Demand	Anodyne	CPT1A	51	35
CCC[C@@H](CNc1ccc(C(=O)CC)cc1[N+](=O)[O-])OC	ZINC000450581810	CG	On-Demand	Bother	TAAR1	15	44
COc1ccc(C(=O)N[C@H](CCO)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450581811	ED	On-Demand	Anodyne	COLA	53	35
COc1ccc(C(=O)N[C@H](CCO)C(C)(C)C)cc1S(C)(=O)=O	ZINC000450581811	ED	On-Demand	Anodyne	CPT1A	51	35
COCc1cc(NC2CC(C)(F)C2)n2ncnc2n1	ZINC000450581831	CD	On-Demand	Anodyne	DHOD	0	45
CCC[C@@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581835	CE	On-Demand	Anodyne	DRD2	0	49
CCC[C@@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581835	CE	On-Demand	Anodyne	ACHE	33	42
CCC[C@@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581835	CE	On-Demand	Anodyne	DRD3	26	41
CCC[C@@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581835	CE	On-Demand	Anodyne	SIGMAR1	69	46
CCC[C@@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581835	CE	On-Demand	Anodyne	CCR5	47	40
CCC[C@@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581835	CE	On-Demand	Anodyne	SLC18A3	23	41
CCC[C@@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581837	CE	On-Demand	Anodyne	DRD2	0	49
CCC[C@@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581837	CE	On-Demand	Anodyne	ACHE	33	42
CCC[C@@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581837	CE	On-Demand	Anodyne	DRD3	26	41
CCC[C@@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581837	CE	On-Demand	Anodyne	SIGMAR1	69	46
CCC[C@@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581837	CE	On-Demand	Anodyne	CCR5	47	40
CCC[C@@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581837	CE	On-Demand	Anodyne	SLC18A3	23	41
CCC[C@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581839	CE	On-Demand	Anodyne	DRD2	0	49
CCC[C@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581839	CE	On-Demand	Anodyne	ACHE	33	42
CCC[C@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581839	CE	On-Demand	Anodyne	DRD3	26	41
CCC[C@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581839	CE	On-Demand	Anodyne	SIGMAR1	69	46
CCC[C@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581839	CE	On-Demand	Anodyne	CCR5	47	40
CCC[C@H](O)CN(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450581839	CE	On-Demand	Anodyne	SLC18A3	23	41
CCC[C@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581840	CE	On-Demand	Anodyne	DRD2	0	49
CCC[C@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581840	CE	On-Demand	Anodyne	ACHE	33	42
CCC[C@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581840	CE	On-Demand	Anodyne	DRD3	26	41
CCC[C@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581840	CE	On-Demand	Anodyne	SIGMAR1	69	46
CCC[C@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581840	CE	On-Demand	Anodyne	CCR5	47	40
CCC[C@H](O)CN(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450581840	CE	On-Demand	Anodyne	SLC18A3	23	41
COC(=O)CCN1CCN(C(=O)c2ccc(OC)c(S(C)(=O)=O)c2)C[C@H]1C	ZINC000450581842	GC	On-Demand	Anodyne	L3MBTL3	45	32
CC(C)(CCCO)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450581844	CD	On-Demand	Anodyne	HPGDS	16	44
COC(=O)C1(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450581846	FF	On-Demand	Anodyne	SLC6A1	48	32
COC(=O)C1(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450581846	FF	On-Demand	Anodyne	DRD3	22	42
COC(=O)C1(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450581846	FF	On-Demand	Anodyne	CAPN2	52	38
COC(=O)C1(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450581846	FF	On-Demand	Anodyne	BIRC2	40	35
COC(=O)C1(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450581849	FF	On-Demand	Anodyne	SLC6A1	48	32
COC(=O)C1(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450581849	FF	On-Demand	Anodyne	DRD3	22	42
COC(=O)C1(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450581849	FF	On-Demand	Anodyne	CAPN2	52	38
COC(=O)C1(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CC1	ZINC000450581849	FF	On-Demand	Anodyne	BIRC2	40	35
CNC(=O)c1cccnc1N1CCc2c(Cl)cc(F)cc2C1	ZINC000450581856	DF	On-Demand	Anodyne	TRPV1	15	41
CCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450581859	FG	On-Demand	Anodyne	HRH3	17	46
CCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450581859	FG	On-Demand	Anodyne	ABCB1	0	47
CCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450581859	FG	On-Demand	Anodyne	NOD1	30	41
CCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450581859	FG	On-Demand	Anodyne	NOD2	50	52
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@H]1N1CCCC1	ZINC000450581872	FH	On-Demand	Anodyne	VACHT_TETCF	0	41
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@H]1N1CCCC1	ZINC000450581872	FH	On-Demand	Anodyne	SLC18A3	23	41
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@H]1N1CCCC1	ZINC000450581872	FH	On-Demand	Anodyne	L3MBTL3	40	31
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@H]1N1CCCC1	ZINC000450581875	FH	On-Demand	Anodyne	VACHT_TETCF	0	41
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@H]1N1CCCC1	ZINC000450581875	FH	On-Demand	Anodyne	SLC18A3	23	41
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@H]1N1CCCC1	ZINC000450581875	FH	On-Demand	Anodyne	L3MBTL3	40	31
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@@H]1N1CCCC1	ZINC000450581877	FH	On-Demand	Anodyne	VACHT_TETCF	0	41
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@@H]1N1CCCC1	ZINC000450581877	FH	On-Demand	Anodyne	SLC18A3	23	41
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@@H]1N1CCCC1	ZINC000450581877	FH	On-Demand	Anodyne	L3MBTL3	40	31
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@@H]1N1CCCC1	ZINC000450581879	FH	On-Demand	Anodyne	VACHT_TETCF	0	41
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@@H]1N1CCCC1	ZINC000450581879	FH	On-Demand	Anodyne	SLC18A3	23	41
CS[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@@H]1N1CCCC1	ZINC000450581879	FH	On-Demand	Anodyne	L3MBTL3	40	31
O=C1N[C@]2(CCOc3ccccc32)C(=O)N1Cc1cc(Cl)sc1Cl	ZINC000450581881	GH	On-Demand	Anodyne	AKR1B1	0	46
COC(=O)CCN1CCN(C(=O)c2ccc(OC)c(S(C)(=O)=O)c2)C[C@@H]1C	ZINC000450581882	GC	On-Demand	Anodyne	L3MBTL3	45	32
O=C1N[C@@]2(CCOc3ccccc32)C(=O)N1Cc1cc(Cl)sc1Cl	ZINC000450581886	GH	On-Demand	Anodyne	AKR1B1	0	46
C[C@]1(NC(=O)c2cc3ccc(Br)cc3s2)CCCOC1	ZINC000450581896	FH	On-Demand	Anodyne	TACR2	41	34
CCc1cc(NCC2=CCCCC2)n2ncnc2n1	ZINC000450581906	CF	On-Demand	Anodyne	DHOD	0	50
C[C@@]1(NC(=O)c2cc3ccc(Br)cc3s2)CCCOC1	ZINC000450581913	FH	On-Demand	Anodyne	TACR2	41	34
CC[C@@H](CO)N(C)c1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450581946	DF	On-Demand	Anodyne	PRNP	44	33
CC[C@@H](CO)N(C)c1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450581946	DF	On-Demand	Anodyne	P4HTM	0	51
CC[C@H](CO)N(C)c1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450581947	DF	On-Demand	Anodyne	PRNP	44	33
CC[C@H](CO)N(C)c1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450581947	DF	On-Demand	Anodyne	P4HTM	0	51
COc1cccc(OCCC(=O)N2CCC3(CCCN3C)CC2)c1	ZINC000450582005	EF	On-Demand	Anodyne	DRD4	41	31
CCOC1(C)CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450582008	DE	On-Demand	Anodyne	SCD1	36	41
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450582010	GE	On-Demand	Anodyne	SCN9A	33	47
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450582010	GE	On-Demand	Anodyne	DYRK2	50	38
C[C@](NC[C@@H]1CCCCC1(F)F)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450582014	FH	On-Demand	Anodyne	AMY2	42	29
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450582019	GE	On-Demand	Anodyne	SCN9A	33	47
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450582019	GE	On-Demand	Anodyne	DYRK2	50	38
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450582022	GE	On-Demand	Anodyne	SCN9A	33	47
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450582022	GE	On-Demand	Anodyne	DYRK2	50	38
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450582024	GE	On-Demand	Anodyne	SCN9A	33	47
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450582024	GE	On-Demand	Anodyne	DYRK2	50	38
C[C@@](NC[C@H]1CCCCC1(F)F)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450582026	FH	On-Demand	Anodyne	AMY2	42	29
COCCn1c(SCC2(OC)CCC2)nc2ccccc21	ZINC000450582027	DG	On-Demand	Anodyne	PTGDR2	15	40
C[C@](NC[C@H]1CCCCC1(F)F)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450582028	FH	On-Demand	Anodyne	AMY2	42	29
C[C@@](NC[C@@H]1CCCCC1(F)F)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450582037	FH	On-Demand	Anodyne	AMY2	42	29
CCN(CC(F)F)C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450582038	EF	On-Demand	Anodyne	CCR5	17	40
COCCn1c(SCC2(C#N)CCC2)nc2ccccc21	ZINC000450582053	DG	On-Demand	Mild	HRH1	15	47
Cc1cccc(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)n1	ZINC000450582060	EF	On-Demand	Anodyne	SORT1	19	42
COC(=O)CC1(NCc2ccc(Cl)c(OC)c2)CCOCC1	ZINC000450582061	EF	On-Demand	Anodyne	PDE6A	42	32
Cc1cccc(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)n1	ZINC000450582076	EF	On-Demand	Anodyne	SORT1	19	42
COc1ccc2c(c1OC)CCN(C(=O)Cc1scnc1-c1ccccc1)C2	ZINC000450582079	GH	On-Demand	Anodyne	AGTR2	42	35
COc1ccc2c(c1OC)CCN(C(=O)Cc1scnc1-c1ccccc1)C2	ZINC000450582079	GH	On-Demand	Anodyne	CPT2	15	41
COCCOC[C@@H](O)CN1C[C@H](c2ccccc2)C(C)(C)C1	ZINC000450582106	DE	On-Demand	Anodyne	ABCB1	42	33
COCCOC[C@H](O)CN1C[C@H](c2ccccc2)C(C)(C)C1	ZINC000450582109	DE	On-Demand	Anodyne	ABCB1	42	33
COCCOC[C@@H](O)CN1C[C@@H](c2ccccc2)C(C)(C)C1	ZINC000450582111	DE	On-Demand	Anodyne	ABCB1	42	33
COCCOC[C@H](O)CN1C[C@@H](c2ccccc2)C(C)(C)C1	ZINC000450582113	DE	On-Demand	Anodyne	ABCB1	42	33
CCC[C@@H]1CCCCN1C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450582125	FH	On-Demand	Anodyne	OPRK1	27	49
COC(=O)CNC(=O)c1ccc(NCC2=CCCCC2)c([N+](=O)[O-])c1	ZINC000450582126	EE	On-Demand	Bother	TAAR1	17	41
CCC[C@H]1CCCCN1C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450582129	FH	On-Demand	Anodyne	OPRK1	27	49
Cc1nc([C@@H]2CCCCCN2C(=O)CCCC(=O)C(C)(C)C)no1	ZINC000450582142	EH	On-Demand	Anodyne	COLA	93	45
Cc1nc([C@@H]2CCCCCN2C(=O)CCCC(=O)C(C)(C)C)no1	ZINC000450582142	EH	On-Demand	Anodyne	CPT1A	90	45
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	HTR1A	72	50
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	DRD2	65	40
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	DRD4	35	43
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	ADRA1D	60	50
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	HTR2A	32	40
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	ADRA1A	50	50
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	ADRA1B	39	50
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	DRD3	58	39
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	HTR7	43	38
COCCOc1ccccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450582148	ED	On-Demand	Anodyne	AP2S1	0	40
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	HTR1A	72	50
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	DRD2	65	40
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	DRD4	35	43
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	ADRA1D	60	50
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	HTR2A	32	40
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	ADRA1A	50	50
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	ADRA1B	39	50
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	DRD3	58	39
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	HTR7	43	38
COCCOc1ccccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450582149	ED	On-Demand	Anodyne	AP2S1	0	40
Cc1nc([C@H]2CCCCCN2C(=O)CCCC(=O)C(C)(C)C)no1	ZINC000450582152	EH	On-Demand	Anodyne	COLA	93	45
Cc1nc([C@H]2CCCCCN2C(=O)CCCC(=O)C(C)(C)C)no1	ZINC000450582152	EH	On-Demand	Anodyne	CPT1A	90	45
CS[C@H]1CN(C(=O)c2cccc(C#N)c2Br)C[C@H]1N1CCCC1	ZINC000450582153	GF	On-Demand	Mild	L3MBTL3	40	35
CS[C@H]1CN(C(=O)c2cccc(C#N)c2Br)C[C@@H]1N1CCCC1	ZINC000450582170	GF	On-Demand	Mild	L3MBTL3	40	35
CS[C@@H]1CN(C(=O)c2cccc(C#N)c2Br)C[C@H]1N1CCCC1	ZINC000450582171	GF	On-Demand	Mild	L3MBTL3	40	35
CS[C@@H]1CN(C(=O)c2cccc(C#N)c2Br)C[C@@H]1N1CCCC1	ZINC000450582172	GF	On-Demand	Mild	L3MBTL3	40	35
COC(=O)c1csc(CN2CCc3ccc(F)cc3C2)n1	ZINC000450582180	DF	On-Demand	Anodyne	ABCB1	22	46
COC(=O)c1csc(CN2CCc3ccc(F)cc3C2)n1	ZINC000450582180	DF	On-Demand	Anodyne	ABCG2	34	40
COC(=O)c1csc(CN2CCc3ccc(F)cc3C2)n1	ZINC000450582180	DF	On-Demand	Anodyne	NOD2	42	38
COCc1cc([N+](=O)[O-])ccc1NC[C@H]1CCCCC1(F)F	ZINC000450582186	DH	On-Demand	Bother	CACNA1D	51	33
COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCCC1(F)F	ZINC000450582188	DH	On-Demand	Bother	CACNA1D	51	33
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	HTR1A	29	46
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	DRD2	34	42
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	DRD4	38	40
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	ACHE	33	40
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	HTR1B	19	40
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	HTR2A	19	44
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	DRD3	24	40
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	SIGMAR1	66	43
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	SSTR5	54	36
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	NPY2R	42	38
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	CCR3	43	44
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	CCR5	23	43
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	HTR6	15	40
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	ABCB1	22	40
COc1cc(NC2CCN(CCN(C)Cc3ccccc3)CC2)cc(OC)c1	ZINC000450582193	GH	On-Demand	Anodyne	MCHR1	30	48
CC(C)n1cnnc1[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450582227	EH	On-Demand	Anodyne	SIGMAR1	15	42
CC(C)n1cnnc1[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450582227	EH	On-Demand	Anodyne	BIRC2	59	44
C[C@@](NCc1cn(CC2CC2)nn1)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450582229	FE	On-Demand	Anodyne	CCR2	44	36
CC(C)n1cnnc1[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450582231	EH	On-Demand	Anodyne	SIGMAR1	15	42
CC(C)n1cnnc1[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450582231	EH	On-Demand	Anodyne	BIRC2	59	44
C[C@](NCc1cn(CC2CC2)nn1)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450582232	FE	On-Demand	Anodyne	CCR2	44	36
CCOC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)nc1	ZINC000450582233	DF	On-Demand	Anodyne	NOD1	29	46
CCOC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)nc1	ZINC000450582233	DF	On-Demand	Anodyne	NOD2	45	46
COc1cc(NC(=O)CN(C)C[C@@H]2CCCCN2C(C)C)cc(OC)c1	ZINC000450582253	FF	On-Demand	Anodyne	LTA4H	15	44
COc1cc(NC(=O)CN(C)C[C@H]2CCCCN2C(C)C)cc(OC)c1	ZINC000450582256	FF	On-Demand	Anodyne	LTA4H	15	44
CCN(CC(F)F)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450582268	CG	On-Demand	Anodyne	OPRK1	19	47
CCN(CC(F)F)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450582268	CG	On-Demand	Anodyne	HCRTR2	15	42
C[C@H]1CCCN(C(=O)Cc2sccc2Br)[C@@H]1CO	ZINC000450582269	EF	On-Demand	Anodyne	TRPC6	44	32
C[C@@H]1CCCN(C(=O)Cc2sccc2Br)[C@H]1CO	ZINC000450582271	EF	On-Demand	Anodyne	TRPC6	44	32
C[C@@H]1CCCN(C(=O)Cc2sccc2Br)[C@@H]1CO	ZINC000450582273	EF	On-Demand	Anodyne	TRPC6	44	32
C[C@H]1CCCN(C(=O)Cc2sccc2Br)[C@H]1CO	ZINC000450582274	EF	On-Demand	Anodyne	TRPC6	44	32
CCCOc1ccc(OCc2nc(C(=O)OC)cs2)cc1	ZINC000450582282	DG	On-Demand	Anodyne	PLA2G4B	43	31
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	HTR1A	112	44
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	DRD2	86	44
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	DRD1	30	40
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	DRD4	53	49
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	ADRA1D	74	45
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	HTR2A	43	42
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	ADRA1A	74	46
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	ADRA1B	51	39
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	DRD3	93	42
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450582334	GE	On-Demand	Anodyne	HTR7	62	41
CNS(=O)(=O)C[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582348	DD	On-Demand	Anodyne	HRH1	34	40
CNS(=O)(=O)C[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582348	DD	On-Demand	Anodyne	ADRA1B	23	40
CNS(=O)(=O)C[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582348	DD	On-Demand	Anodyne	HRH3	34	43
CNS(=O)(=O)C[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582348	DD	On-Demand	Anodyne	SPHK2	57	45
CNS(=O)(=O)C[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582348	DD	On-Demand	Anodyne	SPHK1	69	39
CC(=O)N[C@H](C(=O)NCc1ccc(Cl)c(C)c1)C(C)(C)C	ZINC000450582356	DF	On-Demand	Anodyne	TRPV1	0	40
CNS(=O)(=O)C[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582369	DD	On-Demand	Anodyne	HRH1	34	40
CNS(=O)(=O)C[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582369	DD	On-Demand	Anodyne	ADRA1B	23	40
CNS(=O)(=O)C[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582369	DD	On-Demand	Anodyne	HRH3	34	43
CNS(=O)(=O)C[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582369	DD	On-Demand	Anodyne	SPHK2	57	45
CNS(=O)(=O)C[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450582369	DD	On-Demand	Anodyne	SPHK1	69	39
COc1ccc(-c2ccnc(NC3CCC(CS(C)(=O)=O)CC3)n2)cc1	ZINC000450582370	GG	On-Demand	Anodyne	IKBKB	24	53
COc1ccc(-c2ccnc(NC3CCC(CS(C)(=O)=O)CC3)n2)cc1	ZINC000450582370	GG	On-Demand	Anodyne	MAPK1	60	43
COc1ccc(-c2ccnc(NC3CCC(CS(C)(=O)=O)CC3)n2)cc1	ZINC000450582370	GG	On-Demand	Anodyne	MAPK8	36	44
COc1ccc(-c2ccnc(NC3CCC(CS(C)(=O)=O)CC3)n2)cc1	ZINC000450582370	GG	On-Demand	Anodyne	VCP	19	40
COc1ccc(-c2ccnc(NC3CCC(CS(C)(=O)=O)CC3)n2)cc1	ZINC000450582370	GG	On-Demand	Anodyne	SMG1	58	31
CC[C@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)C(N)=O	ZINC000450582377	EC	On-Demand	Anodyne	MTNR1A	61	39
CC[C@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)C(N)=O	ZINC000450582377	EC	On-Demand	Anodyne	MT-ND1	23	40
CC(C)OCCNC(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450582386	CE	On-Demand	Anodyne	BRAF	30	43
CC[C@@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)C(N)=O	ZINC000450582391	EC	On-Demand	Anodyne	MTNR1A	61	39
CC[C@@](C)(NCCC(=O)NCc1ccc(OC)cc1OC)C(N)=O	ZINC000450582391	EC	On-Demand	Anodyne	MT-ND1	23	40
CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450582397	DD	On-Demand	Anodyne	OPRK1	37	40
CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450582397	DD	On-Demand	Anodyne	CCR1	33	43
COC(=O)c1csc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450582409	EF	On-Demand	Anodyne	DRD3	27	43
Cc1cc(CNC(=O)c2cc(C)n(C(C)C)n2)ccc1Cl	ZINC000450582415	DH	On-Demand	Anodyne	MMP13	0	44
CCN(CC)S(=O)(=O)c1ccc(NC2CC(C)(F)C2)c([N+](=O)[O-])c1	ZINC000450582436	FF	On-Demand	Bother	BDKRB1	22	41
COCCn1c(SCCC(C)(F)F)nc2ccccc21	ZINC000450582452	DH	On-Demand	Anodyne	HRH1	18	49
COC(=O)c1csc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450582483	EF	On-Demand	Anodyne	DRD3	27	43
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	CHRM2	24	46
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	DRD2	24	48
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	DRD4	58	48
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	ACHE	47	48
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	SLC6A1	42	33
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	OPRM1	20	43
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	DRD3	29	41
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	OPRD1	19	53
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	OPRK1	22	44
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	LTA4H	15	46
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	SIGMAR1	65	46
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	CCR3	44	45
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	CCR5	43	40
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	MLNR	48	38
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	MCHR1	33	42
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1cccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582484	DH	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	CHRM2	24	46
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	DRD2	24	48
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	DRD4	58	48
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	ACHE	47	48
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	SLC6A1	42	33
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	OPRM1	20	43
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	DRD3	29	41
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	OPRD1	19	53
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	OPRK1	22	44
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	LTA4H	15	46
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	SIGMAR1	65	46
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	CCR3	44	45
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	CCR5	43	40
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	MLNR	48	38
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	MCHR1	33	42
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1cccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450582485	DH	On-Demand	Anodyne	ADIPOR2	0	40
Cc1ccc(F)c(CN2C(=O)N[C@]3(CCOc4ccccc43)C2=O)c1	ZINC000450582496	EF	On-Demand	Anodyne	AKR1B1	0	44
Cc1ccc(F)c(CN2C(=O)N[C@@]3(CCOc4ccccc43)C2=O)c1	ZINC000450582500	EF	On-Demand	Anodyne	AKR1B1	0	44
CCC[C@@H]1CCCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450582546	EH	On-Demand	Anodyne	CPT2	26	41
CCC[C@@H]1CCCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450582546	EH	On-Demand	Anodyne	PDEC	0	41
COC(=O)c1sc(NC(=O)c2ccc3cnccc3c2)nc1C1CCCC1	ZINC000450582556	GI	On-Demand	Anodyne	AKT1	0	43
COCc1cc(N(C)CCc2ccccc2C)n2ncnc2n1	ZINC000450582558	DE	On-Demand	Anodyne	DHOD	0	41
CC[C@H](CC(C)C)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450582563	FF	On-Demand	Bother	COLA	50	38
CC[C@@H](CC(C)C)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450582564	FF	On-Demand	Bother	COLA	50	38
CCC[C@@H]1CCCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450582568	EH	On-Demand	Anodyne	CPT2	26	41
CCC[C@@H]1CCCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450582568	EH	On-Demand	Anodyne	PDEC	0	41
CCC[C@H]1CCCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450582570	EH	On-Demand	Anodyne	CPT2	26	41
CCC[C@H]1CCCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450582570	EH	On-Demand	Anodyne	PDEC	0	41
CCC[C@H]1CCCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450582571	EH	On-Demand	Anodyne	CPT2	26	41
CCC[C@H]1CCCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450582571	EH	On-Demand	Anodyne	PDEC	0	41
CCC(CC)Oc1ccc(C(=O)N(CC)CC(F)F)cc1	ZINC000450582575	CH	On-Demand	Anodyne	OPRM1	15	40
CCC(CC)Oc1ccc(C(=O)N(CC)CC(F)F)cc1	ZINC000450582575	CH	On-Demand	Anodyne	OPRD1	18	40
COc1cc(NC2CCN(Cc3nnc(C4CC4)s3)CC2)cc(OC)c1	ZINC000450582579	FH	On-Demand	Anodyne	SSTR5	48	36
COc1ccc2nc(SCC[C@@H]3CCOC3)[nH]c2c1	ZINC000450582597	CG	On-Demand	Anodyne	CYP2C8	32	50
COc1ccc2nc(SCC[C@@H]3CCOC3)[nH]c2c1	ZINC000450582597	CG	On-Demand	Anodyne	CYP1A2	24	65
COc1ccc2nc(SCC[C@@H]3CCOC3)[nH]c2c1	ZINC000450582597	CG	On-Demand	Anodyne	CYP2C19	42	58
COc1ccc2nc(SCC[C@H]3CCOC3)[nH]c2c1	ZINC000450582600	CG	On-Demand	Anodyne	CYP2C8	32	50
COc1ccc2nc(SCC[C@H]3CCOC3)[nH]c2c1	ZINC000450582600	CG	On-Demand	Anodyne	CYP1A2	24	65
COc1ccc2nc(SCC[C@H]3CCOC3)[nH]c2c1	ZINC000450582600	CG	On-Demand	Anodyne	CYP2C19	42	58
CCOCc1nc(C)c(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)s1	ZINC000450582605	FG	On-Demand	Anodyne	COLA	41	38
COc1cc(NC(=O)CN(C)C[C@@H](O)[C@H](C)c2ccccc2)cc(OC)c1	ZINC000450582607	FF	On-Demand	Anodyne	SLC6A9	0	40
COc1cc(NC(=O)CN(C)C[C@@H](O)[C@@H](C)c2ccccc2)cc(OC)c1	ZINC000450582608	FF	On-Demand	Anodyne	SLC6A9	0	40
COc1cc(NC(=O)CN(C)C[C@H](O)[C@H](C)c2ccccc2)cc(OC)c1	ZINC000450582609	FF	On-Demand	Anodyne	SLC6A9	0	40
CCOC(=O)c1ccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)nc1	ZINC000450582610	FE	On-Demand	Anodyne	HRH3	25	51
COc1cc(NC(=O)CN(C)C[C@H](O)[C@@H](C)c2ccccc2)cc(OC)c1	ZINC000450582611	FF	On-Demand	Anodyne	SLC6A9	0	40
CCOCc1nc(C)c(C(=O)N2CCCCC[C@H]2c2noc(C)n2)s1	ZINC000450582622	FG	On-Demand	Anodyne	COLA	41	38
CS[C@H]1CN(C(=O)c2ccc(C(C)(F)F)nc2)C[C@@H]1N1CCCC1	ZINC000450582645	FF	On-Demand	Anodyne	L3MBTL1	0	42
CS[C@H]1CN(C(=O)c2ccc(C(C)(F)F)nc2)C[C@H]1N1CCCC1	ZINC000450582647	FF	On-Demand	Anodyne	L3MBTL1	0	42
CS[C@@H]1CN(C(=O)c2ccc(C(C)(F)F)nc2)C[C@@H]1N1CCCC1	ZINC000450582648	FF	On-Demand	Anodyne	L3MBTL1	0	42
CS[C@@H]1CN(C(=O)c2ccc(C(C)(F)F)nc2)C[C@H]1N1CCCC1	ZINC000450582649	FF	On-Demand	Anodyne	L3MBTL1	0	42
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582651	FE	On-Demand	Anodyne	DRD4	29	52
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582651	FE	On-Demand	Anodyne	DRD3	17	41
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582651	FE	On-Demand	Anodyne	SSTR5	33	40
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582651	FE	On-Demand	Anodyne	CCR3	35	43
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582651	FE	On-Demand	Anodyne	MCHR1	19	57
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582651	FE	On-Demand	Anodyne	BIRC2	43	38
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582651	FE	On-Demand	Anodyne	HPGDS	43	38
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582654	FE	On-Demand	Anodyne	DRD4	29	52
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582654	FE	On-Demand	Anodyne	DRD3	17	41
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582654	FE	On-Demand	Anodyne	SSTR5	33	40
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582654	FE	On-Demand	Anodyne	CCR3	35	43
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582654	FE	On-Demand	Anodyne	MCHR1	19	57
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582654	FE	On-Demand	Anodyne	BIRC2	43	38
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582654	FE	On-Demand	Anodyne	HPGDS	43	38
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582655	FE	On-Demand	Anodyne	DRD4	29	52
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582655	FE	On-Demand	Anodyne	DRD3	17	41
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582655	FE	On-Demand	Anodyne	SSTR5	33	40
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582655	FE	On-Demand	Anodyne	CCR3	35	43
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582655	FE	On-Demand	Anodyne	MCHR1	19	57
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582655	FE	On-Demand	Anodyne	BIRC2	43	38
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582655	FE	On-Demand	Anodyne	HPGDS	43	38
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582656	FE	On-Demand	Anodyne	DRD4	29	52
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582656	FE	On-Demand	Anodyne	DRD3	17	41
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582656	FE	On-Demand	Anodyne	SSTR5	33	40
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582656	FE	On-Demand	Anodyne	CCR3	35	43
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582656	FE	On-Demand	Anodyne	MCHR1	19	57
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582656	FE	On-Demand	Anodyne	BIRC2	43	38
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC000450582656	FE	On-Demand	Anodyne	HPGDS	43	38
CN1CCCC12CCN(C(=O)CNC(=O)Nc1cccc(Cl)c1)CC2	ZINC000450582658	FF	On-Demand	Anodyne	EPHX2	25	48
CN1CCCC12CCN(C(=O)CNC(=O)Nc1cccc(Cl)c1)CC2	ZINC000450582658	FF	On-Demand	Anodyne	CACNA1I	15	47
CC[C@@H]1C[C@H]1C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450582659	DD	On-Demand	Anodyne	KCNQ2	51	32
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	HTR1A	111	50
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	DRD2	86	50
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	DRD1	29	41
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	DRD4	53	50
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	ADRA1D	75	52
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	HTR1B	27	40
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	HTR2A	45	45
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	SLC6A4	17	48
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	ADRA1A	72	52
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	ADRA1B	53	52
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	DRD3	87	50
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	HTR7	66	42
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	VACHT_TETCF	0	48
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	ABCB1	97	54
COCCOc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450582661	FE	On-Demand	Anodyne	AP2S1	0	41
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CC=C(c2ccc(C)nc2)CC1	ZINC000450582662	GG	On-Demand	Anodyne	SLC6A9	40	37
Cc1csc([C@@H](C)CNC(=O)[C@@H]2CCN(c3ccccc3)C2)n1	ZINC000450582681	EG	On-Demand	Anodyne	PDE8B	47	31
Cc1csc([C@@H](C)CNC(=O)[C@@H]2CCN(c3ccccc3)C2)n1	ZINC000450582681	EG	On-Demand	Anodyne	GPBAR1	0	40
Cc1csc([C@H](C)CNC(=O)[C@H]2CCN(c3ccccc3)C2)n1	ZINC000450582682	EG	On-Demand	Anodyne	PDE8B	47	31
Cc1csc([C@H](C)CNC(=O)[C@H]2CCN(c3ccccc3)C2)n1	ZINC000450582682	EG	On-Demand	Anodyne	GPBAR1	0	40
Cc1csc([C@H](C)CNC(=O)[C@@H]2CCN(c3ccccc3)C2)n1	ZINC000450582683	EG	On-Demand	Anodyne	PDE8B	47	31
Cc1csc([C@H](C)CNC(=O)[C@@H]2CCN(c3ccccc3)C2)n1	ZINC000450582683	EG	On-Demand	Anodyne	GPBAR1	0	40
Cc1csc([C@@H](C)CNC(=O)[C@H]2CCN(c3ccccc3)C2)n1	ZINC000450582684	EG	On-Demand	Anodyne	PDE8B	47	31
Cc1csc([C@@H](C)CNC(=O)[C@H]2CCN(c3ccccc3)C2)n1	ZINC000450582684	EG	On-Demand	Anodyne	GPBAR1	0	40
COCCn1c(SCc2cccc(C(C)=O)c2)nc2ccccc21	ZINC000450582686	EI	On-Demand	Anodyne	HRH1	15	43
COCCn1c(SCc2cccc(C(C)=O)c2)nc2ccccc21	ZINC000450582686	EI	On-Demand	Anodyne	PTGDR2	23	73
COc1ccc(COCCNC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450582691	EE	On-Demand	Anodyne	DRD4	43	33
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	HTR1A	100	50
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	ADRA2A	15	44
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	DRD2	107	54
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	DRD1	41	47
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	DRD4	82	47
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	ACHE	19	43
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	ADRA1D	85	45
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	HTR1B	15	40
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	HTR2A	48	45
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	HTR2C	17	42
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	SLC6A4	17	45
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	ADRA1A	57	43
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	ADRA1B	47	45
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	DRD3	93	49
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	HTR7	67	44
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	UTS2R	18	40
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	SLC9A1	43	30
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	ABCB1	46	37
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	NOD2	42	36
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	AP2S1	0	48
COCCOc1ccccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450582696	FG	On-Demand	Anodyne	ALPHA-1A	0	47
CCN(CC(F)F)C(=O)c1ccc2cnccc2c1	ZINC000450582711	CF	On-Demand	Anodyne	OPRM1	0	41
CCN(CC(F)F)C(=O)c1ccc2cnccc2c1	ZINC000450582711	CF	On-Demand	Anodyne	OPRD1	0	41
CC(C)(C)[C@H](CCO)NC(=O)c1ccc2cnccc2c1	ZINC000450582737	CF	On-Demand	Anodyne	AKT1	25	48
CC(C)(C)[C@@H](CCO)NC(=O)c1ccc2cnccc2c1	ZINC000450582739	CF	On-Demand	Anodyne	AKT1	25	48
CCOC1(C)CN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450582764	CE	On-Demand	Anodyne	P2RY12	29	43
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450582778	EJ	On-Demand	Anodyne	ADAM10	40	43
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450582778	EJ	On-Demand	Anodyne	ADAM33	0	40
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450582778	EJ	On-Demand	Anodyne	ADAM8	0	40
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450582786	EJ	On-Demand	Anodyne	ADAM10	40	43
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450582786	EJ	On-Demand	Anodyne	ADAM33	0	40
Cc1ccc(C2=CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450582786	EJ	On-Demand	Anodyne	ADAM8	0	40
Cc1ccc(C2=CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450582787	EJ	On-Demand	Anodyne	ADAM10	40	43
Cc1ccc(C2=CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450582787	EJ	On-Demand	Anodyne	ADAM33	0	40
Cc1ccc(C2=CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)cn1	ZINC000450582787	EJ	On-Demand	Anodyne	ADAM8	0	40
Cc1ccc(C2=CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450582792	EJ	On-Demand	Anodyne	ADAM10	40	43
Cc1ccc(C2=CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450582792	EJ	On-Demand	Anodyne	ADAM33	0	40
Cc1ccc(C2=CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)cn1	ZINC000450582792	EJ	On-Demand	Anodyne	ADAM8	0	40
COC(=O)[C@H](C)[C@H](NC[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450582804	EH	On-Demand	Anodyne	AMY2	46	31
COC(=O)[C@H](C)[C@@H](NC[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450582805	EH	On-Demand	Anodyne	AMY2	46	31
COC(=O)[C@H](C)[C@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450582806	EH	On-Demand	Anodyne	AMY2	46	31
COC(=O)[C@H](C)[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450582807	EH	On-Demand	Anodyne	AMY2	46	31
O=C(CCCN1CCC(c2cnc[nH]2)CC1)c1ccc(Br)cc1	ZINC000450582811	GI	On-Demand	Anodyne	HTR2A	15	43
O=C(CCCN1CCC(c2cnc[nH]2)CC1)c1ccc(Br)cc1	ZINC000450582811	GI	On-Demand	Anodyne	CYP2J2	57	41
O=C(CCCC(=O)N1CCO[C@H](CCc2ccccc2)C1)C1CC1	ZINC000450582828	EF	On-Demand	Anodyne	CYP2J2	44	32
O=C(CCCC(=O)N1CCO[C@@H](CCc2ccccc2)C1)C1CC1	ZINC000450582831	EF	On-Demand	Anodyne	CYP2J2	44	32
COCCn1c(SCc2nnc(C3CC3)s2)nc2ccccc21	ZINC000450582832	EH	On-Demand	Anodyne	HRH1	20	45
CC[C@H](CO)N(C)c1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450582835	GG	On-Demand	Anodyne	PDS	21	55
CC[C@@H](CO)N(C)c1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450582836	GG	On-Demand	Anodyne	PDS	21	55
CC(C)(C)C(=O)CCCC(=O)N1CCO[C@H](CCc2ccccc2)C1	ZINC000450582840	EH	On-Demand	Anodyne	CYP2J2	44	32
CC(C)(C)C(=O)CCCC(=O)N1CCO[C@@H](CCc2ccccc2)C1	ZINC000450582842	EH	On-Demand	Anodyne	CYP2J2	44	32
C=CCN(C(=O)c1ccc(N2CCC2)nc1)C1CC1	ZINC000450582855	CE	On-Demand	Mild	HPGDS	15	42
Cc1cccc(Cl)c1CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450582856	FI	On-Demand	Anodyne	EIF2AK1	40	33
Cc1cccc(Cl)c1CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450582858	FI	On-Demand	Anodyne	EIF2AK1	40	33
Cc1ccc(C(=O)N2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c(C(C)C)n1	ZINC000450582862	GI	On-Demand	Anodyne	LIPE	23	42
Cc1ccc(C(=O)N2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c(C(C)C)n1	ZINC000450582862	GI	On-Demand	Anodyne	LIPG	50	54
Cc1cc(C2CCN(C(=O)Cc3cc4ccccc4s3)CC2)n[nH]1	ZINC000450582867	EH	On-Demand	Anodyne	ETHR	43	38
Cc1ccc(C(=O)N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c(C(C)C)n1	ZINC000450582870	GI	On-Demand	Anodyne	LIPE	23	42
Cc1ccc(C(=O)N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c(C(C)C)n1	ZINC000450582870	GI	On-Demand	Anodyne	LIPG	50	54
Cc1ccc(Cl)c(OCCC(C)(F)F)c1	ZINC000450582874	BI	On-Demand	Anodyne	S1PR4	0	42
C[C@H]1C[C@H](NC(=O)c2cc3n(n2)CCC3)CC[C@H]1C	ZINC000450582880	CE	On-Demand	Anodyne	MAPK13	50	34
COCCn1c(SCc2cn(CC3CC3)nn2)nc2ccccc21	ZINC000450582881	EF	On-Demand	Anodyne	HRH1	0	44
C[C@@H]1CC[C@@H](NC(=O)c2cc3n(n2)CCC3)C[C@H]1C	ZINC000450582882	CE	On-Demand	Anodyne	MAPK13	50	34
C[C@@H]1CC[C@H](NC(=O)c2cc3n(n2)CCC3)C[C@H]1C	ZINC000450582883	CE	On-Demand	Anodyne	MAPK13	50	34
C[C@H]1C[C@@H](NC(=O)c2cc3n(n2)CCC3)CC[C@H]1C	ZINC000450582885	CE	On-Demand	Anodyne	MAPK13	50	34
CCOC1(C)CN(c2ccc(S(=O)(=O)NC)cc2F)C1	ZINC000450582888	DD	On-Demand	Anodyne	SLC6A9	15	42
CCC[C@H](CNc1cc(CC)nc2ncnn12)OC	ZINC000450582905	CD	On-Demand	Anodyne	DHOD	0	51
CCC[C@@H](CNc1cc(CC)nc2ncnn12)OC	ZINC000450582906	CD	On-Demand	Anodyne	DHOD	0	51
CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582932	EF	On-Demand	Anodyne	MC4R	48	39
CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582932	EF	On-Demand	Anodyne	MC3R	45	44
CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582932	EF	On-Demand	Anodyne	MC5R	35	44
CCN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582933	EF	On-Demand	Anodyne	MC4R	48	39
CCN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582933	EF	On-Demand	Anodyne	MC3R	45	44
CCN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582933	EF	On-Demand	Anodyne	MC5R	35	44
CCN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582934	EF	On-Demand	Anodyne	MC4R	48	39
CCN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582934	EF	On-Demand	Anodyne	MC3R	45	44
CCN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582934	EF	On-Demand	Anodyne	MC5R	35	44
CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582935	EF	On-Demand	Anodyne	MC4R	48	39
CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582935	EF	On-Demand	Anodyne	MC3R	45	44
CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1=O	ZINC000450582935	EF	On-Demand	Anodyne	MC5R	35	44
COc1cc(CC(=O)NC[C@H](C)c2nc(C)cs2)ccc1Cl	ZINC000450582955	EH	On-Demand	Anodyne	TRPV1	22	43
COc1cc(CC(=O)NC[C@H](C)c2nc(C)cs2)ccc1Cl	ZINC000450582955	EH	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)NC[C@H](C)c2nc(C)cs2)ccc1Cl	ZINC000450582955	EH	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)NC[C@@H](C)c2nc(C)cs2)ccc1Cl	ZINC000450582956	EH	On-Demand	Anodyne	TRPV1	22	43
COc1cc(CC(=O)NC[C@@H](C)c2nc(C)cs2)ccc1Cl	ZINC000450582956	EH	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)NC[C@@H](C)c2nc(C)cs2)ccc1Cl	ZINC000450582956	EH	On-Demand	Anodyne	CAN2	0	41
NC(=O)c1ncc(Br)cc1NC[C@H]1CCCCC1(F)F	ZINC000450582999	EG	On-Demand	Anodyne	SYK	47	34
NC(=O)c1ncc(Br)cc1NC[C@@H]1CCCCC1(F)F	ZINC000450583001	EG	On-Demand	Anodyne	SYK	47	34
CCc1nn(C)cc1CNC(=O)COc1c(Cl)cc(Cl)cc1Cl	ZINC000450583003	GH	On-Demand	Anodyne	P2RX7	45	38
CN1CCN(S(=O)(=O)c2ccc(NC[C@@H]3CCCCC3(F)F)nc2)CC1	ZINC000450583005	GD	On-Demand	Anodyne	TGM2	26	41
CN1CCN(S(=O)(=O)c2ccc(NC[C@@H]3CCCCC3(F)F)nc2)CC1	ZINC000450583005	GD	On-Demand	Anodyne	GCKR	45	31
CN1CCN(S(=O)(=O)c2ccc(NC[C@H]3CCCCC3(F)F)nc2)CC1	ZINC000450583009	GD	On-Demand	Anodyne	TGM2	26	41
CN1CCN(S(=O)(=O)c2ccc(NC[C@H]3CCCCC3(F)F)nc2)CC1	ZINC000450583009	GD	On-Demand	Anodyne	GCKR	45	31
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)cc2C)no1	ZINC000450583072	FI	On-Demand	Anodyne	COLA	53	41
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)cc2C)no1	ZINC000450583072	FI	On-Demand	Anodyne	CPT1A	53	41
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)cc2C)no1	ZINC000450583072	FI	On-Demand	Anodyne	GRM5	0	43
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)cc2C)no1	ZINC000450583078	FI	On-Demand	Anodyne	COLA	53	41
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)cc2C)no1	ZINC000450583078	FI	On-Demand	Anodyne	CPT1A	53	41
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(F)(F)F)cc2C)no1	ZINC000450583078	FI	On-Demand	Anodyne	GRM5	0	43
Cc1cnc(CCCC(=O)NCc2ccc(Cl)c(C)c2)o1	ZINC000450583080	DH	On-Demand	Anodyne	P2RX7	20	43
Cc1cnc(CCCC(=O)NCc2ccc(Cl)c(C)c2)o1	ZINC000450583080	DH	On-Demand	Anodyne	SUCNR1	33	49
CNS(=O)(=O)NCC(=O)N1CCc2c(ccc(OC)c2OC)C1	ZINC000450583084	EB	On-Demand	Anodyne	AGTR2	46	34
CCCc1cc(NC(CF)CF)n2ncnc2n1	ZINC000450583095	CD	On-Demand	Anodyne	DHOD	0	48
CCn1nnc(C)c1CSc1nc2ccccc2n1CCOC	ZINC000450583103	EF	On-Demand	Anodyne	PTGDR2	17	40
C[C@@H]1CCCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)[C@@H]1CO	ZINC000450583118	GE	On-Demand	Mild	AR	18	41
C[C@@H]1CCCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)[C@H]1CO	ZINC000450583125	GE	On-Demand	Mild	AR	18	41
C[C@@H]1CCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)[C@H]1CO	ZINC000450583127	GE	On-Demand	Mild	AR	18	41
C[C@@H]1CCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)[C@@H]1CO	ZINC000450583131	GE	On-Demand	Mild	AR	18	41
COc1ccc(C(=O)N2CC=C(c3ccc(C)nc3)CC2)cc1S(C)(=O)=O	ZINC000450583138	GF	On-Demand	Anodyne	QDPR	0	43
CCCOc1ccc(C(=O)N2CC=C(c3ccc(C)nc3)CC2)c(OC)c1	ZINC000450583143	FI	On-Demand	Anodyne	QDPR	0	42
CS(=O)(=O)CC1CCC(Nc2c(C#N)cnc3c(F)cc(F)cc23)CC1	ZINC000450583145	GG	On-Demand	Mild	MAP3K8	56	34
CCOc1cc(C(=O)NCc2ccc(Cl)c(C)c2)on1	ZINC000450583146	CF	On-Demand	Anodyne	PFK	0	42
C[C@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C[C@H]1O	ZINC000450583162	DE	On-Demand	Anodyne	SLC12A5	53	35
C[C@@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C[C@H]1O	ZINC000450583163	DE	On-Demand	Anodyne	SLC12A5	53	35
C[C@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C[C@@H]1O	ZINC000450583164	DE	On-Demand	Anodyne	SLC12A5	53	35
C[C@@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C[C@@H]1O	ZINC000450583165	DE	On-Demand	Anodyne	SLC12A5	53	35
C[C@@H]1CC[C@@H](NC(=O)c2cc(O)ccc2F)C[C@H]1C	ZINC000450583175	CG	For-Sale	Anodyne	MAPK13	43	30
C[C@@H]1CC[C@H](NC(=O)c2cc(O)ccc2F)C[C@H]1C	ZINC000450583178	CG	For-Sale	Anodyne	MAPK13	43	30
Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3CC(C)C)CC2)cn1	ZINC000450583179	CH	On-Demand	Anodyne	ADAM10	31	44
C[C@H]1C[C@H](NC(=O)c2cc(O)ccc2F)CC[C@H]1C	ZINC000450583181	CG	For-Sale	Anodyne	MAPK13	43	30
C[C@H]1C[C@@H](NC(=O)c2cc(O)ccc2F)CC[C@H]1C	ZINC000450583182	CG	For-Sale	Anodyne	MAPK13	43	30
CS(=O)(=O)CC1CCC(Nc2ncnc3cc(F)c(F)cc23)CC1	ZINC000450583188	FF	On-Demand	Anodyne	CD38	36	44
CC[C@@H](CO)N(C)c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450583199	EG	On-Demand	Anodyne	PSBA	0	43
CC[C@@H](CO)N(C)c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450583199	EG	On-Demand	Anodyne	KCNK3	71	40
CC[C@@H](CO)N(C)c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450583199	EG	On-Demand	Anodyne	KCNK9	45	41
CC[C@H](CO)N(C)c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450583200	EG	On-Demand	Anodyne	PSBA	0	43
CC[C@H](CO)N(C)c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450583200	EG	On-Demand	Anodyne	KCNK3	71	40
CC[C@H](CO)N(C)c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450583200	EG	On-Demand	Anodyne	KCNK9	45	41
COC(=O)c1csc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583201	GG	On-Demand	Anodyne	DRD4	26	45
COC(=O)c1csc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583201	GG	On-Demand	Anodyne	DRD3	22	45
COC(=O)c1csc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583201	GG	On-Demand	Anodyne	SSTR5	58	36
COC(=O)c1csc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583201	GG	On-Demand	Anodyne	CHRNA7	15	41
COC(=O)c1csc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583201	GG	On-Demand	Anodyne	MCHR1	29	43
COC(=O)c1csc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583202	GG	On-Demand	Anodyne	DRD4	26	45
COC(=O)c1csc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583202	GG	On-Demand	Anodyne	DRD3	22	45
COC(=O)c1csc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583202	GG	On-Demand	Anodyne	SSTR5	58	36
COC(=O)c1csc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583202	GG	On-Demand	Anodyne	CHRNA7	15	41
COC(=O)c1csc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450583202	GG	On-Demand	Anodyne	MCHR1	29	43
CC(C)OCCNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450583206	CE	On-Demand	Anodyne	EPHX2	24	42
CCOC1(C)CN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C1	ZINC000450583210	DG	On-Demand	Bother	F2RL3	45	31
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCOC1	ZINC000450583234	CD	On-Demand	Anodyne	MME	46	35
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCOC1	ZINC000450583234	CD	On-Demand	Anodyne	TIMP3	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCOC1	ZINC000450583234	CD	On-Demand	Anodyne	PSMB8	66	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCOC1	ZINC000450583237	CD	On-Demand	Anodyne	MME	46	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCOC1	ZINC000450583237	CD	On-Demand	Anodyne	TIMP3	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCOC1	ZINC000450583237	CD	On-Demand	Anodyne	PSMB8	66	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCCOC1	ZINC000450583238	CD	On-Demand	Anodyne	MME	46	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCCOC1	ZINC000450583238	CD	On-Demand	Anodyne	TIMP3	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCCOC1	ZINC000450583238	CD	On-Demand	Anodyne	PSMB8	66	36
COc1ccc(C(=O)N2CCO[C@H](C3CCCCC3)C2)cc1S(C)(=O)=O	ZINC000450583239	GF	On-Demand	Anodyne	L3MBTL3	61	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCCOC1	ZINC000450583240	CD	On-Demand	Anodyne	MME	46	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCCOC1	ZINC000450583240	CD	On-Demand	Anodyne	TIMP3	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@]1(C)CCCOC1	ZINC000450583240	CD	On-Demand	Anodyne	PSMB8	66	36
COc1ccc(C(=O)N2CCO[C@@H](C3CCCCC3)C2)cc1S(C)(=O)=O	ZINC000450583244	GF	On-Demand	Anodyne	L3MBTL3	61	34
CCc1nc(C)c(CSc2nc3ccccc3n2CCOC)o1	ZINC000450583259	EH	On-Demand	Anodyne	PTGDR2	16	40
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1csc(S(N)(=O)=O)c1	ZINC000450583264	GB	On-Demand	Anodyne	CA2	32	54
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1csc(S(N)(=O)=O)c1	ZINC000450583264	GB	On-Demand	Anodyne	FOLH1	48	38
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1csc(S(N)(=O)=O)c1	ZINC000450583264	GB	On-Demand	Anodyne	F2RL1	43	31
CCOc1ccc2c(c1)CCN(Cc1cccnc1N)C2	ZINC000450583269	CF	On-Demand	Anodyne	NOD2	33	41
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1cc2ccncc2s1	ZINC000450583272	EG	On-Demand	Anodyne	TACR2	42	36
Cc1nc2ccnn2cc1C(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450583273	CF	On-Demand	Anodyne	DDR1	37	41
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cc2ccncc2s1	ZINC000450583275	EG	On-Demand	Anodyne	TACR2	42	36
CC[C@@H]1C[C@H]1C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450583277	CG	On-Demand	Anodyne	P2RX7	27	44
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1cc2ccncc2s1	ZINC000450583278	EG	On-Demand	Anodyne	TACR2	42	36
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1cc2ccncc2s1	ZINC000450583279	EG	On-Demand	Anodyne	TACR2	42	36
Cc1nc2ccnn2cc1C(=O)N[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450583280	CF	On-Demand	Anodyne	DDR1	37	41
Cc1nc2ccnn2cc1C(=O)N[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450583284	CF	On-Demand	Anodyne	DDR1	37	41
Cc1nc2ccnn2cc1C(=O)N[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450583286	CF	On-Demand	Anodyne	DDR1	37	41
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583292	GF	On-Demand	Bother	CACNA1C	61	39
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583292	GF	On-Demand	Bother	CACNA1D	94	39
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583294	GF	On-Demand	Bother	CACNA1C	61	39
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583294	GF	On-Demand	Bother	CACNA1D	94	39
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583295	GF	On-Demand	Bother	CACNA1C	61	39
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583295	GF	On-Demand	Bother	CACNA1D	94	39
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583297	GF	On-Demand	Bother	CACNA1C	61	39
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583297	GF	On-Demand	Bother	CACNA1D	94	39
CS(=O)(=O)CC1CCC(Nc2ncnc3cc(Br)ccc23)CC1	ZINC000450583299	GG	On-Demand	Anodyne	EGFR	60	40
CS(=O)(=O)CC1CCC(Nc2ncnc3cc(Br)ccc23)CC1	ZINC000450583299	GG	On-Demand	Anodyne	CD38	46	38
CC[C@@H](Nc1ccc(S(=O)(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-])C(N)=O	ZINC000450583300	GE	On-Demand	Bother	BCL2L1	66	33
CC[C@@H](Nc1ccc(S(=O)(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-])C(N)=O	ZINC000450583300	GE	On-Demand	Bother	BCL2	49	31
CC[C@@H](Nc1ccc(S(=O)(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-])C(N)=O	ZINC000450583300	GE	On-Demand	Bother	SFRP1	41	32
CCN1CCN(C(=O)c2cc(OC)ccc2OC(F)(F)F)CC1=O	ZINC000450583302	ED	On-Demand	Anodyne	P2RX7	0	51
CC1(F)CC(Nc2ncnc3cc(Cl)ccc23)C1	ZINC000450583307	CH	On-Demand	Anodyne	CD38	41	34
COc1ccc(C(=O)N[C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1S(C)(=O)=O	ZINC000450583314	EF	On-Demand	Anodyne	COLA	45	35
COc1ccc(C(=O)N[C@@H]2CC[C@H](C)[C@H](C)C2)cc1S(C)(=O)=O	ZINC000450583315	EF	On-Demand	Anodyne	COLA	45	35
COc1ccc(C(=O)N[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1S(C)(=O)=O	ZINC000450583317	EF	On-Demand	Anodyne	COLA	45	35
COc1ccc(C(=O)N[C@@H]2CC[C@@H](C)[C@H](C)C2)cc1S(C)(=O)=O	ZINC000450583319	EF	On-Demand	Anodyne	COLA	45	35
CCc1cc2c(NC3CCC(CS(C)(=O)=O)CC3)ncnc2s1	ZINC000450583320	FG	On-Demand	Anodyne	CD38	35	42
Cc1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c(Br)c1	ZINC000450583331	GI	On-Demand	Anodyne	COLA	105	47
Cc1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c(Br)c1	ZINC000450583331	GI	On-Demand	Anodyne	CPT1A	103	47
Cc1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c(Br)c1	ZINC000450583339	GI	On-Demand	Anodyne	COLA	105	47
Cc1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c(Br)c1	ZINC000450583339	GI	On-Demand	Anodyne	CPT1A	103	47
CCOc1ccc(-n2c(SCC3(C#N)CCC3)nnc2-c2cccnc2)cc1	ZINC000450583359	GJ	On-Demand	Mild	CACNA2D1	60	38
CCOc1ccc(-n2c(SCC3(C#N)CCC3)nnc2-c2cccnc2)cc1	ZINC000450583359	GJ	On-Demand	Mild	VCP	62	39
COC(=O)[C@H](C)[C@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1	ZINC000450583377	EH	On-Demand	Anodyne	ADRB1	15	42
COC(=O)[C@H](C)[C@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1	ZINC000450583377	EH	On-Demand	Anodyne	ADRB3	36	42
COC(=O)[C@H](C)[C@@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1	ZINC000450583378	EH	On-Demand	Anodyne	ADRB1	15	42
COC(=O)[C@H](C)[C@@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1	ZINC000450583378	EH	On-Demand	Anodyne	ADRB3	36	42
COC(=O)[C@@H](C)[C@@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1	ZINC000450583379	EH	On-Demand	Anodyne	ADRB1	15	42
COC(=O)[C@@H](C)[C@@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1	ZINC000450583379	EH	On-Demand	Anodyne	ADRB3	36	42
COC(=O)[C@@H](C)[C@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1	ZINC000450583380	EH	On-Demand	Anodyne	ADRB1	15	42
COC(=O)[C@@H](C)[C@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1	ZINC000450583380	EH	On-Demand	Anodyne	ADRB3	36	42
CCC[C@H](CNc1ncnc2[nH]c3ccccc3c12)OC	ZINC000450583400	CG	On-Demand	Anodyne	UTS2R	26	44
CCC[C@@H](CNc1ncnc2[nH]c3ccccc3c12)OC	ZINC000450583401	CG	On-Demand	Anodyne	UTS2R	26	44
COc1ccc(COCCNC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450583408	GF	On-Demand	Anodyne	HRH2	20	44
COc1ccc(COCCNC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450583408	GF	On-Demand	Anodyne	PPIA	22	42
COc1ccc(COCCNC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450583408	GF	On-Demand	Anodyne	PTGER3	17	43
COc1ccc(COCCNC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450583408	GF	On-Demand	Anodyne	F7	16	42
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCN2CCOC[C@@H]2C1	ZINC000450583413	GE	On-Demand	Anodyne	HRH4	23	45
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCN2CCOC[C@H]2C1	ZINC000450583414	GE	On-Demand	Anodyne	HRH4	23	45
CCc1nc2ccccc2n1C1CCN(C(=O)[C@@]2(C)CCC[C@@H]2C)CC1	ZINC000450583423	FJ	On-Demand	Anodyne	OPRL1	21	43
CCc1nc2ccccc2n1C1CCN(C(=O)[C@@]2(C)CCC[C@@H]2C)CC1	ZINC000450583423	FJ	On-Demand	Anodyne	FPR2	34	49
CCc1nc2ccccc2n1C1CCN(C(=O)[C@]2(C)CCC[C@@H]2C)CC1	ZINC000450583424	FJ	On-Demand	Anodyne	OPRL1	21	43
CCc1nc2ccccc2n1C1CCN(C(=O)[C@]2(C)CCC[C@@H]2C)CC1	ZINC000450583424	FJ	On-Demand	Anodyne	FPR2	34	49
CCc1nc2ccccc2n1C1CCN(C(=O)[C@]2(C)CCC[C@H]2C)CC1	ZINC000450583425	FJ	On-Demand	Anodyne	OPRL1	21	43
CCc1nc2ccccc2n1C1CCN(C(=O)[C@]2(C)CCC[C@H]2C)CC1	ZINC000450583425	FJ	On-Demand	Anodyne	FPR2	34	49
CCc1nc2ccccc2n1C1CCN(C(=O)[C@@]2(C)CCC[C@H]2C)CC1	ZINC000450583426	FJ	On-Demand	Anodyne	OPRL1	21	43
CCc1nc2ccccc2n1C1CCN(C(=O)[C@@]2(C)CCC[C@H]2C)CC1	ZINC000450583426	FJ	On-Demand	Anodyne	FPR2	34	49
COCCOc1ccccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450583431	EE	On-Demand	Anodyne	DRD2	77	49
COCCOc1ccccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450583431	EE	On-Demand	Anodyne	DRD1	36	48
COCCOc1ccccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450583431	EE	On-Demand	Anodyne	DRD4	47	42
COCCOc1ccccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450583431	EE	On-Demand	Anodyne	ADRA1D	62	42
COCCOc1ccccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450583431	EE	On-Demand	Anodyne	HTR2A	36	49
COCCOc1ccccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450583431	EE	On-Demand	Anodyne	ADRA1A	46	43
COCCOc1ccccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450583431	EE	On-Demand	Anodyne	DRD3	62	39
COCCOc1ccccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450583431	EE	On-Demand	Anodyne	HTR7	57	50
CCN(CC(F)F)C(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450583448	CI	On-Demand	Anodyne	AMY2	45	32
COc1ccc(COCCNC(=O)Cc2sccc2Br)cc1	ZINC000450583465	GG	On-Demand	Anodyne	CA9	20	43
CCN(CC(F)F)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450583471	EF	On-Demand	Anodyne	PIK3CD	25	42
CCN(CC(F)F)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450583471	EF	On-Demand	Anodyne	PIK3CB	35	42
CN(CC1(C#N)CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450583474	CF	On-Demand	Mild	SIGMAR1	58	44
CN(CC1(C#N)CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450583483	CF	On-Demand	Mild	SIGMAR1	58	44
N#Cc1cnc(NC[C@@H]2CCCCC2(F)F)c(Cl)c1	ZINC000450583489	CH	On-Demand	Mild	IRAK4	16	44
N#Cc1cnc(NC[C@H]2CCCCC2(F)F)c(Cl)c1	ZINC000450583490	CH	On-Demand	Mild	IRAK4	16	44
CC[C@@H](CC(C)C)C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450583497	EG	On-Demand	Anodyne	KCNQ2	57	39
CC[C@H](CC(C)C)C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450583501	EG	On-Demand	Anodyne	KCNQ2	57	39
CCN(CC(F)F)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450583521	FF	On-Demand	Mild	NR3C2	0	41
N#Cc1ccc(NCc2cc(C3CC3)ccc2F)cn1	ZINC000450583523	CH	On-Demand	Mild	MAP3K8	45	30
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](C)c1nccs1	ZINC000450583524	EF	On-Demand	Anodyne	HPN	68	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](C)c1nccs1	ZINC000450583526	EF	On-Demand	Anodyne	HPN	68	37
CCN(CC(F)F)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450583527	FF	On-Demand	Mild	NR3C2	0	41
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450583528	FG	On-Demand	Anodyne	KCNQ2	52	37
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450583530	FG	On-Demand	Anodyne	KCNQ2	52	37
Cc1cccc(Cl)c1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450583535	EH	On-Demand	Anodyne	CHRM1	0	44
Cc1cccc(Cl)c1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450583535	EH	On-Demand	Anodyne	DRD4	43	34
Cc1cccc(Cl)c1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450583535	EH	On-Demand	Anodyne	HTR4	55	35
Cc1cccc(Cl)c1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450583535	EH	On-Demand	Anodyne	F10	24	54
Cc1cccc(Cl)c1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450583535	EH	On-Demand	Anodyne	LCK	40	41
Cc1cccc(Cl)c1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450583535	EH	On-Demand	Anodyne	CACNA1I	65	42
COc1ccc(CNC(=O)CCN2CCc3ccc(F)cc3C2)c(OC)c1	ZINC000450583543	FF	On-Demand	Anodyne	ABCB1	33	43
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450583559	ED	On-Demand	Anodyne	NPY1R	26	40
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450583559	ED	On-Demand	Anodyne	CCKBR	41	39
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450583559	ED	On-Demand	Anodyne	EPHX2	31	45
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450583559	ED	On-Demand	Anodyne	MCHR1	22	40
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450583562	ED	On-Demand	Anodyne	NPY1R	26	40
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450583562	ED	On-Demand	Anodyne	CCKBR	41	39
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450583562	ED	On-Demand	Anodyne	EPHX2	31	45
C[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450583562	ED	On-Demand	Anodyne	MCHR1	22	40
CCC[C@@H](CNc1nc(-c2ccccn2)nc(C)c1C)OC	ZINC000450583564	DF	On-Demand	Anodyne	METAP1	88	43
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450583565	ED	On-Demand	Anodyne	NPY1R	26	40
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450583565	ED	On-Demand	Anodyne	CCKBR	41	39
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450583565	ED	On-Demand	Anodyne	EPHX2	31	45
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450583565	ED	On-Demand	Anodyne	MCHR1	22	40
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450583566	ED	On-Demand	Anodyne	NPY1R	26	40
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450583566	ED	On-Demand	Anodyne	CCKBR	41	39
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450583566	ED	On-Demand	Anodyne	EPHX2	31	45
C[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450583566	ED	On-Demand	Anodyne	MCHR1	22	40
CCC[C@H](CNc1nc(-c2ccccn2)nc(C)c1C)OC	ZINC000450583568	DF	On-Demand	Anodyne	METAP1	88	43
CN1CCCC12CCN(C(=O)C1(Cc3ccccc3)CCOCC1)CC2	ZINC000450583578	FG	On-Demand	Anodyne	SLC12A5	57	36
COC(=O)c1ccc([N+](=O)[O-])c(NC2CC(C)(F)C2)c1	ZINC000450583581	CF	On-Demand	Bother	CACNA1D	64	35
O=[N+]([O-])c1ccc(N2CC3(CC3)C2)cc1C(F)(F)F	ZINC000450583582	CG	On-Demand	Bother	AADAC	0	40
CC[C@@H](O)CC(=O)N1CCc2c(ccc(OC)c2OC)C1	ZINC000450583585	CD	On-Demand	Anodyne	AGTR2	43	33
CC[C@H](O)CC(=O)N1CCc2c(ccc(OC)c2OC)C1	ZINC000450583588	CD	On-Demand	Anodyne	AGTR2	43	33
Cc1nc([C@@H]2CCCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)no1	ZINC000450583589	GG	On-Demand	Bother	COLA	120	48
Cc1nc([C@@H]2CCCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)no1	ZINC000450583589	GG	On-Demand	Bother	CPT1A	114	48
Cc1nc([C@H]2CCCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)no1	ZINC000450583591	GG	On-Demand	Bother	COLA	120	48
Cc1nc([C@H]2CCCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)no1	ZINC000450583591	GG	On-Demand	Bother	CPT1A	114	48
O=C(CCCN1CCc2ccccc2[C@@H]1CO)c1ccc(F)cc1	ZINC000450583602	EG	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1CCc2ccccc2[C@@H]1CO)c1ccc(F)cc1	ZINC000450583602	EG	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CCc2ccccc2[C@@H]1CO)c1ccc(F)cc1	ZINC000450583602	EG	On-Demand	Anodyne	HTR2A	22	52
O=C(CCCN1CCc2ccccc2[C@@H]1CO)c1ccc(F)cc1	ZINC000450583602	EG	On-Demand	Anodyne	HTR2C	22	52
O=C(CCCN1CCc2ccccc2[C@@H]1CO)c1ccc(F)cc1	ZINC000450583602	EG	On-Demand	Anodyne	SLC18A3	0	51
O=C(CCCN1CCc2ccccc2[C@@H]1CO)c1ccc(F)cc1	ZINC000450583602	EG	On-Demand	Anodyne	HTR3B	0	57
O=C(CCCN1CCc2ccccc2[C@@H]1CO)c1ccc(F)cc1	ZINC000450583602	EG	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCc2ccccc2[C@H]1CO)c1ccc(F)cc1	ZINC000450583604	EG	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1CCc2ccccc2[C@H]1CO)c1ccc(F)cc1	ZINC000450583604	EG	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CCc2ccccc2[C@H]1CO)c1ccc(F)cc1	ZINC000450583604	EG	On-Demand	Anodyne	HTR2A	22	52
O=C(CCCN1CCc2ccccc2[C@H]1CO)c1ccc(F)cc1	ZINC000450583604	EG	On-Demand	Anodyne	HTR2C	22	52
O=C(CCCN1CCc2ccccc2[C@H]1CO)c1ccc(F)cc1	ZINC000450583604	EG	On-Demand	Anodyne	SLC18A3	0	51
O=C(CCCN1CCc2ccccc2[C@H]1CO)c1ccc(F)cc1	ZINC000450583604	EG	On-Demand	Anodyne	HTR3B	0	57
O=C(CCCN1CCc2ccccc2[C@H]1CO)c1ccc(F)cc1	ZINC000450583604	EG	On-Demand	Anodyne	CYP2J2	49	35
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450583619	GF	On-Demand	Anodyne	KCNQ2	58	35
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450583624	GF	On-Demand	Anodyne	KCNQ2	58	35
CCCOc1cccc(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450583627	GH	On-Demand	Anodyne	HRH2	25	43
CCCOc1cccc(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450583627	GH	On-Demand	Anodyne	PPARA	17	41
CCCOc1cccc(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450583627	GH	On-Demand	Anodyne	GALR3	54	33
CCCOc1cccc(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450583627	GH	On-Demand	Anodyne	PDS	83	50
Cc1cc(CNC(=O)[C@H]2CC23CCSCC3)ccc1Cl	ZINC000450583629	DH	On-Demand	Anodyne	P2RX7	26	40
Cc1nc(=NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n(C)[nH]1	ZINC000450583630	DD	On-Demand	Bother	CACNA1D	50	32
Cc1nc(=NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n(C)[nH]1	ZINC000450583630	DD	On-Demand	Bother	IRAK4	26	41
CCCOc1cccc(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450583631	GH	On-Demand	Anodyne	HRH2	25	43
CCCOc1cccc(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450583631	GH	On-Demand	Anodyne	PPARA	17	41
CCCOc1cccc(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450583631	GH	On-Demand	Anodyne	GALR3	54	33
CCCOc1cccc(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450583631	GH	On-Demand	Anodyne	PDS	83	50
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450583632	GI	On-Demand	Mild	COLA	105	54
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450583632	GI	On-Demand	Mild	CPT1A	103	54
COc1ccc2nc(SC[C@@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450583634	CG	On-Demand	Anodyne	CYP2C8	31	48
COc1ccc2nc(SC[C@@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450583634	CG	On-Demand	Anodyne	CYP1A2	22	65
COc1ccc2nc(SC[C@@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450583634	CG	On-Demand	Anodyne	CYP2C19	40	53
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450583635	GI	On-Demand	Mild	COLA	105	54
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450583635	GI	On-Demand	Mild	CPT1A	103	54
COc1ccc2nc(SC[C@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450583636	CG	On-Demand	Anodyne	CYP2C8	31	48
COc1ccc2nc(SC[C@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450583636	CG	On-Demand	Anodyne	CYP1A2	22	65
COc1ccc2nc(SC[C@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450583636	CG	On-Demand	Anodyne	CYP2C19	40	53
Cc1cc(CNC(=O)[C@@H]2CC23CCSCC3)ccc1Cl	ZINC000450583645	DH	On-Demand	Anodyne	P2RX7	26	40
Cc1cc(CNC(=O)[C@H]2CC2(F)F)ccc1Cl	ZINC000450583652	CF	On-Demand	Anodyne	P2RX7	35	42
O=C(c1ccc2scc(Br)c2c1)N1CCN2CCOC[C@H]2C1	ZINC000450583656	GF	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc2scc(Br)c2c1)N1CCN2CCOC[C@H]2C1	ZINC000450583656	GF	On-Demand	Anodyne	L3MBTL3	41	37
O=C(c1ccc2scc(Br)c2c1)N1CCN2CCOC[C@@H]2C1	ZINC000450583657	GF	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc2scc(Br)c2c1)N1CCN2CCOC[C@@H]2C1	ZINC000450583657	GF	On-Demand	Anodyne	L3MBTL3	41	37
CC[S@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450583665	FF	On-Demand	Anodyne	COLA	141	59
CC[S@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450583665	FF	On-Demand	Anodyne	CPT1A	95	59
CC[S@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450583666	FF	On-Demand	Anodyne	COLA	141	59
CC[S@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450583666	FF	On-Demand	Anodyne	CPT1A	95	59
CC[S@@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450583668	FF	On-Demand	Anodyne	COLA	141	59
CC[S@@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450583668	FF	On-Demand	Anodyne	CPT1A	95	59
CC[S@@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450583669	FF	On-Demand	Anodyne	COLA	141	59
CC[S@@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450583669	FF	On-Demand	Anodyne	CPT1A	95	59
Cc1cc(CNC(=O)[C@@H]2CC2(F)F)ccc1Cl	ZINC000450583680	CF	On-Demand	Anodyne	P2RX7	35	42
COc1ccc2c(N3CC4(CC4)C3)ncnc2c1F	ZINC000450583701	CE	On-Demand	Anodyne	PDE3B	52	33
COC(=O)CCN1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1C	ZINC000450583708	GD	On-Demand	Anodyne	EPHX2	19	44
COC(=O)CCN1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1C	ZINC000450583720	GD	On-Demand	Anodyne	EPHX2	19	44
CS[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C[C@H]1N1CCCC1	ZINC000450583736	GH	On-Demand	Anodyne	RBP4	88	38
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CCCC(=O)c1ccccc1	ZINC000450583738	GH	On-Demand	Anodyne	CYP2J2	47	35
CS[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C[C@@H]1N1CCCC1	ZINC000450583741	GH	On-Demand	Anodyne	RBP4	88	38
CS[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C[C@H]1N1CCCC1	ZINC000450583746	GH	On-Demand	Anodyne	RBP4	88	38
CS[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C[C@@H]1N1CCCC1	ZINC000450583753	GH	On-Demand	Anodyne	RBP4	88	38
Cn1cc(-c2ccc(C(=O)N[C@@H](CCO)C(C)(C)C)o2)cn1	ZINC000450583758	DE	On-Demand	Anodyne	MMP13	18	43
Cn1cc(-c2ccc(C(=O)N[C@H](CCO)C(C)(C)C)o2)cn1	ZINC000450583762	DE	On-Demand	Anodyne	MMP13	18	43
COC(=O)c1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)cc1	ZINC000450583765	FF	On-Demand	Anodyne	COLA	116	47
COC(=O)c1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)cc1	ZINC000450583765	FF	On-Demand	Anodyne	CPT1A	80	46
c1nc(N2CC3(CC3)C2)c2c3c(sc2n1)CCC3	ZINC000450583778	CF	On-Demand	Anodyne	RBP4	19	48
COC(=O)c1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)cc1	ZINC000450583782	FF	On-Demand	Anodyne	COLA	116	47
COC(=O)c1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)cc1	ZINC000450583782	FF	On-Demand	Anodyne	CPT1A	80	46
N#CC1(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCC1	ZINC000450583785	EH	On-Demand	Mild	DRD4	25	50
N#CC1(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCC1	ZINC000450583785	EH	On-Demand	Mild	CCR3	24	42
N#CC1(CN2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)CCC1	ZINC000450583785	EH	On-Demand	Mild	FAP	0	48
CCOC(=O)c1cc(C(=O)NCc2ccc(Cl)c(C)c2)on1	ZINC000450583788	DF	On-Demand	Anodyne	PFK	0	42
N#CC1(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCC1	ZINC000450583791	EH	On-Demand	Mild	DRD4	25	50
N#CC1(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCC1	ZINC000450583791	EH	On-Demand	Mild	CCR3	24	42
N#CC1(CN2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)CCC1	ZINC000450583791	EH	On-Demand	Mild	FAP	0	48
COc1ccc(CNC(=O)CCN2C[C@H]3CCC[C@H]32)c(OC)c1	ZINC000450583809	DE	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN2C[C@@H]3CCC[C@H]32)c(OC)c1	ZINC000450583811	DE	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN2C[C@@H]3CCC[C@@H]32)c(OC)c1	ZINC000450583813	DE	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN2C[C@H]3CCC[C@@H]32)c(OC)c1	ZINC000450583815	DE	On-Demand	Anodyne	MTR1B_CHICK	0	41
C/C=C/COc1cccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450583852	FI	On-Demand	Anodyne	COLA	136	51
C/C=C/COc1cccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450583852	FI	On-Demand	Anodyne	CPT1A	128	51
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450583853	FI	On-Demand	Anodyne	COLA	136	51
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450583853	FI	On-Demand	Anodyne	CPT1A	128	51
C/C=C/COc1cccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450583854	FI	On-Demand	Anodyne	COLA	136	51
C/C=C/COc1cccc(CC(=O)N2CCCCC[C@H]2c2noc(C)n2)c1	ZINC000450583854	FI	On-Demand	Anodyne	CPT1A	128	51
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450583855	FI	On-Demand	Anodyne	COLA	136	51
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@@H]2c2noc(C)n2)c1	ZINC000450583855	FI	On-Demand	Anodyne	CPT1A	128	51
CCN(CC)S(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450583877	FE	On-Demand	Bother	COLA	62	34
CCN(CC)S(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450583877	FE	On-Demand	Bother	BCL2L1	68	34
CCN(CC)S(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450583877	FE	On-Demand	Bother	BCL2	53	33
CCN(CC)S(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450583877	FE	On-Demand	Bother	BCL2L2	43	31
CCc1cc(N(C)CCc2ccccc2C)n2ncnc2n1	ZINC000450583882	CF	On-Demand	Anodyne	DHOD	0	44
O=C(c1cnc(N[C@@H](CO)c2ccc(F)cc2)c(Cl)c1)N1CCOCC1	ZINC000450583884	GE	On-Demand	Anodyne	MAPK1	64	40
O=C(c1cnc(N[C@H](CO)c2ccc(F)cc2)c(Cl)c1)N1CCOCC1	ZINC000450583885	GE	On-Demand	Anodyne	MAPK1	64	40
O=C(CCC(=O)N1CCN2CCOC[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000450583898	ED	On-Demand	Bother	MGLL	0	47
O=C(CCC(=O)N1CCN2CCOC[C@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000450583899	ED	On-Demand	Bother	MGLL	0	47
COCCOc1ccccc1N1CCN([C@@H](C)c2csnn2)CC1	ZINC000450583900	EE	On-Demand	Anodyne	DRD2	40	37
COCCOc1ccccc1N1CCN([C@@H](C)c2csnn2)CC1	ZINC000450583900	EE	On-Demand	Anodyne	DRD3	41	33
COCCOc1ccccc1N1CCN([C@H](C)c2csnn2)CC1	ZINC000450583901	EE	On-Demand	Anodyne	DRD2	40	37
COCCOc1ccccc1N1CCN([C@H](C)c2csnn2)CC1	ZINC000450583901	EE	On-Demand	Anodyne	DRD3	41	33
CCC[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450583906	EH	On-Demand	Anodyne	AVPR2	82	40
CCC[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450583906	EH	On-Demand	Anodyne	AVPR1A	47	40
CCC[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450583907	EH	On-Demand	Anodyne	AVPR2	82	40
CCC[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450583907	EH	On-Demand	Anodyne	AVPR1A	47	40
CCOC(=O)c1ccc(CN(CC(=O)Nc2ccc(F)cc2)C(C)(C)C)nc1	ZINC000450583910	GH	On-Demand	Anodyne	LTA4H	17	41
CCC[C@@H](CC(C)C)C(=O)NC[C@@H](C)c1nccs1	ZINC000450583912	CH	On-Demand	Anodyne	HPN	42	33
CCC[C@@H](CC(C)C)C(=O)NC[C@H](C)c1nccs1	ZINC000450583919	CH	On-Demand	Anodyne	HPN	42	33
OC[C@@H]1CCCN1c1cc(N2CCc3c(Cl)cc(F)cc3C2)ncn1	ZINC000450583924	FF	On-Demand	Anodyne	PRCP	42	39
OC[C@H]1CCCN1c1cc(N2CCc3c(Cl)cc(F)cc3C2)ncn1	ZINC000450583925	FF	On-Demand	Anodyne	PRCP	42	39
C[C@H]1C[C@@H](NC(=O)c2cccc(C#N)c2Br)CC[C@H]1C	ZINC000450583933	EH	On-Demand	Mild	EZH2	44	35
C[C@@H]1CC[C@@H](NC(=O)c2cccc(C#N)c2Br)C[C@H]1C	ZINC000450583940	EH	On-Demand	Mild	EZH2	44	35
C[C@H]1C[C@H](NC(=O)c2cccc(C#N)c2Br)CC[C@H]1C	ZINC000450583941	EH	On-Demand	Mild	EZH2	44	35
C[C@@H]1CC[C@H](NC(=O)c2cccc(C#N)c2Br)C[C@H]1C	ZINC000450583942	EH	On-Demand	Mild	EZH2	44	35
CCC[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583958	EH	On-Demand	Bother	CACNA1C	42	34
CCC[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583958	EH	On-Demand	Bother	CACNA1D	62	33
CCC[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583958	EH	On-Demand	Bother	COLA	0	41
CCC[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583958	EH	On-Demand	Bother	PREP	18	43
CCC[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583960	EH	On-Demand	Bother	CACNA1C	42	34
CCC[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583960	EH	On-Demand	Bother	CACNA1D	62	33
CCC[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583960	EH	On-Demand	Bother	COLA	0	41
CCC[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450583960	EH	On-Demand	Bother	PREP	18	43
C[C@H]1C[C@@H](NC(=O)c2cc3n(n2)CCCC3)CC[C@H]1C	ZINC000450583984	CF	On-Demand	Anodyne	MAPK13	48	32
C[C@H]1C[C@H](NC(=O)c2cc3n(n2)CCCC3)CC[C@H]1C	ZINC000450583986	CF	On-Demand	Anodyne	MAPK13	48	32
C[C@@H]1CC[C@@H](NC(=O)c2cc3n(n2)CCCC3)C[C@H]1C	ZINC000450583988	CF	On-Demand	Anodyne	MAPK13	48	32
C[C@@H]1CC[C@H](NC(=O)c2cc3n(n2)CCCC3)C[C@H]1C	ZINC000450583990	CF	On-Demand	Anodyne	MAPK13	48	32
CCS(=O)(=O)c1ccc(CN(CCCO)Cc2cccc(Cl)c2)cc1	ZINC000450584011	GH	On-Demand	Anodyne	RORC	48	47
COc1cc(CN2C(=O)N[C@]3(CCOc4ccccc43)C2=O)ccc1Cl	ZINC000450584012	FG	On-Demand	Anodyne	AKR1B1	0	42
COc1cc(CN2C(=O)N[C@@]3(CCOc4ccccc43)C2=O)ccc1Cl	ZINC000450584013	FG	On-Demand	Anodyne	AKR1B1	0	42
Cc1nnc2c3ccccc3c(NC3CCC(CS(C)(=O)=O)CC3)nn12	ZINC000450584023	FE	On-Demand	Anodyne	CREBBP	47	39
Cc1nnc2c3ccccc3c(NC3CCC(CS(C)(=O)=O)CC3)nn12	ZINC000450584023	FE	On-Demand	Anodyne	BRD9	61	44
COC(=O)[C@@H](C)NC(=O)c1ccc(NCC2=CCCCC2)c([N+](=O)[O-])c1	ZINC000450584030	FF	On-Demand	Bother	TAAR1	17	41
COC(=O)[C@H](C)NC(=O)c1ccc(NCC2=CCCCC2)c([N+](=O)[O-])c1	ZINC000450584031	FF	On-Demand	Bother	TAAR1	17	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](C)c1nccs1	ZINC000450584038	EI	On-Demand	Anodyne	PPARA	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](C)c1nccs1	ZINC000450584038	EI	On-Demand	Anodyne	PPARD	27	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](C)c1nccs1	ZINC000450584038	EI	On-Demand	Anodyne	SORT1	15	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](C)c1nccs1	ZINC000450584052	EI	On-Demand	Anodyne	PPARA	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](C)c1nccs1	ZINC000450584052	EI	On-Demand	Anodyne	PPARD	27	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](C)c1nccs1	ZINC000450584052	EI	On-Demand	Anodyne	SORT1	15	42
CCC[C@@H]1CCCCN1C(=O)c1cc2cccnc2s1	ZINC000450584068	CI	On-Demand	Anodyne	HCRTR1	34	41
CCC[C@@H]1CCCCN1C(=O)c1cc2cccnc2s1	ZINC000450584068	CI	On-Demand	Anodyne	HCRTR2	27	41
CCC[C@H]1CCCCN1C(=O)c1cc2cccnc2s1	ZINC000450584070	CI	On-Demand	Anodyne	HCRTR1	28	41
CCC[C@H]1CCCCN1C(=O)c1cc2cccnc2s1	ZINC000450584070	CI	On-Demand	Anodyne	HCRTR2	27	41
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584097	EI	On-Demand	Anodyne	CPT1A	126	56
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584097	EI	On-Demand	Anodyne	GRM5	15	43
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584103	EI	On-Demand	Anodyne	CPT1A	126	56
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584103	EI	On-Demand	Anodyne	GRM5	15	43
COc1ccc(NC(=O)C2(NC[C@H]3CCC(F)(F)C3)CCCC2)cc1OC	ZINC000450584105	GH	On-Demand	Anodyne	ENPP1	66	31
COc1ccc(NC(=O)C2(NC[C@@H]3CCC(F)(F)C3)CCCC2)cc1OC	ZINC000450584106	GH	On-Demand	Anodyne	ENPP1	66	31
CCCOc1ccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)c(OC)c1	ZINC000450584108	FH	On-Demand	Anodyne	COLA	90	44
CCCOc1ccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)c(OC)c1	ZINC000450584108	FH	On-Demand	Anodyne	CPT1A	72	44
Cc1ccc(F)c(CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCO4)C2=O)c1	ZINC000450584113	FF	On-Demand	Anodyne	SCN9A	0	44
CCCOc1ccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)c(OC)c1	ZINC000450584114	FH	On-Demand	Anodyne	COLA	90	44
CCCOc1ccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)c(OC)c1	ZINC000450584114	FH	On-Demand	Anodyne	CPT1A	72	44
Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CC2)cn1	ZINC000450584116	FI	On-Demand	Anodyne	ADAM10	36	40
Cc1ccc(F)c(CN2C(=O)N[C@](C)(c3ccc4c(c3)OCO4)C2=O)c1	ZINC000450584122	FF	On-Demand	Anodyne	SCN9A	0	44
O=C([C@@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584130	EH	On-Demand	Anodyne	COLA	123	53
O=C([C@@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584130	EH	On-Demand	Anodyne	CPT1A	119	53
O=C([C@@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584130	EH	On-Demand	Anodyne	GRM5	0	45
O=C([C@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584133	EH	On-Demand	Anodyne	COLA	123	53
O=C([C@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584133	EH	On-Demand	Anodyne	CPT1A	119	53
O=C([C@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584133	EH	On-Demand	Anodyne	GRM5	0	45
O=C([C@@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584137	EH	On-Demand	Anodyne	COLA	123	53
O=C([C@@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584137	EH	On-Demand	Anodyne	CPT1A	119	53
O=C([C@@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584137	EH	On-Demand	Anodyne	GRM5	0	45
O=C([C@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584141	EH	On-Demand	Anodyne	COLA	123	53
O=C([C@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584141	EH	On-Demand	Anodyne	CPT1A	119	53
O=C([C@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584141	EH	On-Demand	Anodyne	GRM5	0	45
C[C@H](c1ccccc1)[C@@H](O)CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584142	GG	On-Demand	Anodyne	TACR1	26	42
C[C@H](c1ccccc1)[C@@H](O)CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584142	GG	On-Demand	Anodyne	PHES	0	43
C[C@H](c1ccccc1)[C@@H](O)CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584142	GG	On-Demand	Anodyne	PDS	42	41
C[C@H](c1ccccc1)[C@H](O)CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584145	GG	On-Demand	Anodyne	TACR1	26	42
C[C@H](c1ccccc1)[C@H](O)CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584145	GG	On-Demand	Anodyne	PHES	0	43
C[C@H](c1ccccc1)[C@H](O)CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584145	GG	On-Demand	Anodyne	PDS	42	41
C[C@H](c1ccccc1)[C@@H](O)CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584146	GG	On-Demand	Anodyne	TACR1	26	42
C[C@H](c1ccccc1)[C@@H](O)CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584146	GG	On-Demand	Anodyne	PHES	0	43
C[C@H](c1ccccc1)[C@@H](O)CN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584146	GG	On-Demand	Anodyne	PDS	42	41
C[C@H](c1ccccc1)[C@H](O)CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584149	GG	On-Demand	Anodyne	TACR1	26	42
C[C@H](c1ccccc1)[C@H](O)CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584149	GG	On-Demand	Anodyne	PHES	0	43
C[C@H](c1ccccc1)[C@H](O)CN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450584149	GG	On-Demand	Anodyne	PDS	42	41
Cc1ccc(NC(=O)c2ccc(N3CC4(CC4)C3)c([N+](=O)[O-])c2)cc1	ZINC000450584176	EH	On-Demand	Bother	PRNP	50	33
Cc1ccc(NC(=O)c2ccc(N3CC4(CC4)C3)c([N+](=O)[O-])c2)cc1	ZINC000450584176	EH	On-Demand	Bother	TAAR1	45	51
c1ccc(-c2nc3c(c(N4CC5(CC5)C4)n2)CCC3)nc1	ZINC000450584179	CF	On-Demand	Anodyne	METAP2	26	40
COC(=O)c1ccc(CN2C[C@H]3CCC[C@H]32)cc1Cl	ZINC000450584182	CG	On-Demand	Anodyne	OPRK1	22	41
COC(=O)c1ccc(CN2C[C@@H]3CCC[C@@H]32)cc1Cl	ZINC000450584184	CG	On-Demand	Anodyne	OPRK1	22	41
COC(=O)c1ccc(CN2C[C@H]3CCC[C@@H]32)cc1Cl	ZINC000450584186	CG	On-Demand	Anodyne	OPRK1	22	41
COC(=O)c1ccc(CN2C[C@@H]3CCC[C@H]32)cc1Cl	ZINC000450584188	CG	On-Demand	Anodyne	OPRK1	22	41
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cccnc2)cc1	ZINC000450584190	GI	On-Demand	Anodyne	CACNA2D1	82	41
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cccnc2)cc1	ZINC000450584190	GI	On-Demand	Anodyne	CACNA2D2	54	32
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cccnc2)cc1	ZINC000450584190	GI	On-Demand	Anodyne	WNT3A	20	47
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cccnc2)cc1	ZINC000450584190	GI	On-Demand	Anodyne	VCP	67	39
COc1cc2c(N3CC4(CC4)C3)ncnc2cc1F	ZINC000450584202	CE	On-Demand	Anodyne	PDE3A	55	43
COc1cc2c(N3CC4(CC4)C3)ncnc2cc1F	ZINC000450584202	CE	On-Demand	Anodyne	PDGFRB	66	44
COc1cc2c(N3CC4(CC4)C3)ncnc2cc1F	ZINC000450584202	CE	On-Demand	Anodyne	PDE3B	81	43
CCOc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2cccnc2)cc1	ZINC000450584205	GJ	On-Demand	Anodyne	CACNA2D1	62	42
CCOc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2cccnc2)cc1	ZINC000450584205	GJ	On-Demand	Anodyne	VCP	57	34
CC[C@H](CO)N(C)c1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450584210	FG	On-Demand	Anodyne	NPBWR1	48	39
CC[C@@H](CO)N(C)c1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450584211	FG	On-Demand	Anodyne	NPBWR1	48	39
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@@H]2CO)c(OC)c1	ZINC000450584216	GE	On-Demand	Anodyne	HCRTR1	16	42
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@@H]2CO)c(OC)c1	ZINC000450584216	GE	On-Demand	Anodyne	HTR7	30	43
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@@H]2CO)c(OC)c1	ZINC000450584216	GE	On-Demand	Anodyne	MTNR1A	58	39
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@@H]2CO)c(OC)c1	ZINC000450584216	GE	On-Demand	Anodyne	MTNR1B	65	39
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@@H]2CO)c(OC)c1	ZINC000450584216	GE	On-Demand	Anodyne	HCRTR2	20	40
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@H]2CO)c(OC)c1	ZINC000450584217	GE	On-Demand	Anodyne	HCRTR1	16	42
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@H]2CO)c(OC)c1	ZINC000450584217	GE	On-Demand	Anodyne	HTR7	30	43
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@H]2CO)c(OC)c1	ZINC000450584217	GE	On-Demand	Anodyne	MTNR1A	58	39
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@H]2CO)c(OC)c1	ZINC000450584217	GE	On-Demand	Anodyne	MTNR1B	65	39
COc1ccc(CNC(=O)CCN2CCc3ccccc3[C@H]2CO)c(OC)c1	ZINC000450584217	GE	On-Demand	Anodyne	HCRTR2	20	40
COC[C@](C)(CC(=O)OC)NCc1ccc(Cl)c(OC)c1	ZINC000450584227	DE	On-Demand	Anodyne	TRPV1	20	40
COC[C@@](C)(CC(=O)OC)NCc1ccc(Cl)c(OC)c1	ZINC000450584229	DE	On-Demand	Anodyne	TRPV1	20	40
COCCn1c(SCc2nc(C(=O)OC)cs2)nc2ccccc21	ZINC000450584236	FG	On-Demand	Anodyne	PTGDR2	19	49
CCOC1(C)CN(c2ccc(C(=O)c3ccccc3C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450584237	GG	On-Demand	Bother	TAAR1	19	40
COC(=O)[C@H](C)[C@@H](NCc1ccccc1OC1CC1)c1ccccc1	ZINC000450584239	EH	On-Demand	Anodyne	TACR3	0	40
COC(=O)[C@@H](C)[C@@H](NCc1ccccc1OC1CC1)c1ccccc1	ZINC000450584244	EH	On-Demand	Anodyne	TACR3	0	40
COC(=O)[C@H](C)[C@H](NCc1ccccc1OC1CC1)c1ccccc1	ZINC000450584246	EH	On-Demand	Anodyne	TACR3	0	40
N=c1nc(N2CCN(CCc3ccc(Cl)cc3)CC2)s[nH]1	ZINC000450584247	DD	On-Demand	Anodyne	DRD2	15	49
N=c1nc(N2CCN(CCc3ccc(Cl)cc3)CC2)s[nH]1	ZINC000450584247	DD	On-Demand	Anodyne	DRD4	20	44
COC(=O)[C@@H](C)[C@H](NCc1ccccc1OC1CC1)c1ccccc1	ZINC000450584248	EH	On-Demand	Anodyne	TACR3	0	40
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	HTR1A	62	49
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	DRD2	59	47
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	DRD1	23	42
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	DRD4	32	44
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	HTR2A	41	47
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	HTR2C	25	44
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	DRD3	40	41
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	HTR7	72	49
Nc1nsc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450584254	ED	On-Demand	Anodyne	CYP2J2	57	41
CC(=O)c1ccc(CN2CCC(c3cnc[nH]3)CC2)cc1	ZINC000450584256	CF	On-Demand	Anodyne	SIGMAR1	32	43
COc1ccc2nc(S[C@H](C)c3csnn3)[nH]c2c1	ZINC000450584258	CG	On-Demand	Anodyne	CYP2C8	24	44
COc1ccc2nc(S[C@H](C)c3csnn3)[nH]c2c1	ZINC000450584258	CG	On-Demand	Anodyne	CYP2C19	37	54
COc1ccc2nc(S[C@@H](C)c3csnn3)[nH]c2c1	ZINC000450584262	CG	On-Demand	Anodyne	CYP2C8	24	44
COc1ccc2nc(S[C@@H](C)c3csnn3)[nH]c2c1	ZINC000450584262	CG	On-Demand	Anodyne	CYP2C19	37	54
CCOC1(C)CN(c2ccc(S(N)(=O)=O)cn2)C1	ZINC000450584270	CC	On-Demand	Anodyne	CA7	17	40
Cc1[nH]c(C#N)cc1C(=O)N1CCCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450584278	GE	On-Demand	Mild	SLC6A9	19	40
CCOC1(C)CN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450584288	CE	On-Demand	Anodyne	LUCI_PHOPE	15	40
Cn1c(C#N)ccc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584294	GH	On-Demand	Mild	COLA	104	56
Cn1c(C#N)ccc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450584294	GH	On-Demand	Mild	CPT1A	101	56
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(CCC(=O)OC)[C@@H](C)C1	ZINC000450584297	GD	On-Demand	Anodyne	SLC6A9	42	38
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCN(CCC(=O)OC)[C@H](C)C1	ZINC000450584298	GD	On-Demand	Anodyne	SLC6A9	42	38
CCN1CCN(C(=O)c2ccc(I)cc2F)CC1=O	ZINC000450584305	GD	On-Demand	Anodyne	P2RX7	22	47
CC(C)(C)[C@@H](CCO)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450584306	EE	On-Demand	Anodyne	PDE4D	15	40
CC(C)(C)[C@@H](CCO)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450584307	EE	On-Demand	Anodyne	PDE4D	15	40
CC(C)(C)[C@H](CCO)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450584308	EE	On-Demand	Anodyne	PDE4D	15	40
CC(C)(C)[C@H](CCO)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450584309	EE	On-Demand	Anodyne	PDE4D	15	40
CCOC(=O)c1cc(C(=O)N2CCN(CC)C(=O)C2)on1	ZINC000450584346	CC	On-Demand	Anodyne	PLA2G2A	0	41
COc1ccc(COCCNC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450584404	DE	On-Demand	Anodyne	PROKR1	52	32
CCCc1cc(NC[C@H]2CCCCC2(F)F)n2ncnc2n1	ZINC000450584417	DG	On-Demand	Anodyne	DHOD	0	40
CCCc1cc(NC[C@@H]2CCCCC2(F)F)n2ncnc2n1	ZINC000450584418	DG	On-Demand	Anodyne	DHOD	0	40
COC(=O)c1coc(CN2CCCCc3ccc(OC)cc32)n1	ZINC000450584438	DF	On-Demand	Anodyne	TYMS	19	44
C[C@]1(C(=O)N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CC=CCC1	ZINC000450584451	FH	On-Demand	Anodyne	LIPE	23	44
C[C@]1(C(=O)N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CC=CCC1	ZINC000450584451	FH	On-Demand	Anodyne	LIPG	44	52
C[C@@]1(C(=O)N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CC=CCC1	ZINC000450584452	FH	On-Demand	Anodyne	LIPE	23	44
C[C@@]1(C(=O)N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CC=CCC1	ZINC000450584452	FH	On-Demand	Anodyne	LIPG	44	52
C[C@@]1(C(=O)N2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CC=CCC1	ZINC000450584453	FH	On-Demand	Anodyne	LIPE	23	44
C[C@@]1(C(=O)N2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CC=CCC1	ZINC000450584453	FH	On-Demand	Anodyne	LIPG	44	52
C[C@]1(C(=O)N2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CC=CCC1	ZINC000450584454	FH	On-Demand	Anodyne	LIPE	23	44
C[C@]1(C(=O)N2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CC=CCC1	ZINC000450584454	FH	On-Demand	Anodyne	LIPG	44	52
CCOC(=O)c1ccc(CSc2nnc(-c3ccccc3)n2CC)nc1	ZINC000450584459	FH	On-Demand	Anodyne	SLC27A1	43	46
CCC[C@H]1CCCCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450584487	CG	On-Demand	Anodyne	EPHB3	25	43
CCC[C@@H]1CCCCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450584494	CG	On-Demand	Anodyne	EPHB3	25	43
COc1cc(CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCO4)C2=O)ccc1Cl	ZINC000450584509	GG	On-Demand	Anodyne	SCN9A	0	49
COc1cc(CN2C(=O)N[C@](C)(c3ccc4c(c3)OCO4)C2=O)ccc1Cl	ZINC000450584510	GG	On-Demand	Anodyne	SCN9A	0	49
CCN(CC(F)F)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450584515	EH	On-Demand	Anodyne	MTNR1A	30	41
CCN(CC(F)F)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450584515	EH	On-Demand	Anodyne	MTNR1B	30	42
CCC[C@H]1CCCCN1C(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450584527	FI	On-Demand	Anodyne	HCRTR1	15	49
CCC[C@@H]1CCCCN1C(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450584529	FI	On-Demand	Anodyne	HCRTR1	15	49
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@@H](O)C2)c1	ZINC000450584537	CD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)N2CC[C@@H](C)[C@H](O)C2)c1	ZINC000450584538	CD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@H](O)C2)c1	ZINC000450584539	CD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)N2CC[C@H](C)[C@@H](O)C2)c1	ZINC000450584540	CD	On-Demand	Anodyne	DRD4	41	32
Cn1c(SCC[C@H]2CCOC2)nnc1-c1ccccc1Cl	ZINC000450584545	DH	On-Demand	Anodyne	KCNH2	0	43
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1ccccc1Cl	ZINC000450584546	DH	On-Demand	Anodyne	DRD3	16	43
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1ccccc1Cl	ZINC000450584546	DH	On-Demand	Anodyne	KCNH2	0	43
COC(=O)c1ccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)cc1Cl	ZINC000450584547	GG	On-Demand	Anodyne	HRH3	22	43
COC(=O)c1ccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)cc1Cl	ZINC000450584547	GG	On-Demand	Anodyne	CCR3	40	43
COC(=O)c1ccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)cc1Cl	ZINC000450584547	GG	On-Demand	Anodyne	CXCR3	25	44
COC(=O)c1ccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)cc1Cl	ZINC000450584547	GG	On-Demand	Anodyne	MCHR1	33	41
CC(C)N1CCC(N2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450584548	EG	On-Demand	Anodyne	SIGMAR1	29	44
CC(C)N1CCC(N2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450584548	EG	On-Demand	Anodyne	L3MBTL3	40	47
Cc1cc([C@@H](C)N=c2ccc(C(=O)NCCO)n[nH]2)ccc1F	ZINC000450584553	DD	On-Demand	Anodyne	ALPL	52	39
C[C@H](CNC(=O)Cc1ccc(O)c(F)c1)c1nccs1	ZINC000450584557	CE	On-Demand	Anodyne	TRPV1	0	47
C[C@@H](CNC(=O)Cc1ccc(O)c(F)c1)c1nccs1	ZINC000450584558	CE	On-Demand	Anodyne	TRPV1	0	47
CC(C)n1cnnc1[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450584562	DI	On-Demand	Anodyne	SLC6A1	63	35
CC(C)n1cnnc1[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450584563	DI	On-Demand	Anodyne	SLC6A1	63	35
CC(C)n1cnnc1[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450584564	DI	On-Demand	Anodyne	SLC6A1	63	35
CC(C)n1cnnc1[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450584565	DI	On-Demand	Anodyne	SLC6A1	63	35
CCC[C@@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584571	EH	On-Demand	Anodyne	FKBP1A	46	38
CCC[C@@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584571	EH	On-Demand	Anodyne	SLC18A2	42	38
CCC[C@@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584571	EH	On-Demand	Anodyne	HCRTR1	21	42
CCC[C@@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584571	EH	On-Demand	Anodyne	PREP	60	35
CCC[C@@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584571	EH	On-Demand	Anodyne	HCRTR2	0	42
CCC[C@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584572	EH	On-Demand	Anodyne	FKBP1A	46	38
CCC[C@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584572	EH	On-Demand	Anodyne	SLC18A2	42	38
CCC[C@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584572	EH	On-Demand	Anodyne	HCRTR1	21	42
CCC[C@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584572	EH	On-Demand	Anodyne	PREP	60	35
CCC[C@H]1CCCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450584572	EH	On-Demand	Anodyne	HCRTR2	0	42
Cn1c(C#N)ccc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584584	GH	On-Demand	Mild	COLA	104	56
Cn1c(C#N)ccc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450584584	GH	On-Demand	Mild	CPT1A	101	56
CCOC(=O)c1cccnc1N1CC(C)(OCC)C1	ZINC000450584602	CD	On-Demand	Anodyne	P2RY12	45	36
CCOC1(C)CN(c2ncnc3ccc(SC)cc23)C1	ZINC000450584623	CF	On-Demand	Anodyne	HTT	0	44
COc1cc(C(=O)N2CC=C(c3ccc(C)nc3)CC2)c([N+](=O)[O-])cc1F	ZINC000450584656	FG	On-Demand	Bother	QDPR	0	41
CCC(=O)CCCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450584660	EG	On-Demand	Anodyne	DRD4	22	45
CCC(=O)CCCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450584660	EG	On-Demand	Anodyne	SLC6A1	68	34
CCC(=O)CCCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450584660	EG	On-Demand	Anodyne	DRD3	0	42
CCC(=O)CCCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450584660	EG	On-Demand	Anodyne	BIRC2	46	39
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450584662	EG	On-Demand	Anodyne	DRD4	22	45
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450584662	EG	On-Demand	Anodyne	SLC6A1	68	34
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450584662	EG	On-Demand	Anodyne	DRD3	0	42
CCC(=O)CCCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000450584662	EG	On-Demand	Anodyne	BIRC2	46	39
CNS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450584664	DD	On-Demand	Anodyne	DRD2	46	35
CNS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450584664	DD	On-Demand	Anodyne	SLC6A1	61	42
CNS(=O)(=O)C[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450584664	DD	On-Demand	Anodyne	CYP2J2	55	39
CNS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450584666	DD	On-Demand	Anodyne	DRD2	46	35
CNS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450584666	DD	On-Demand	Anodyne	SLC6A1	61	42
CNS(=O)(=O)C[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450584666	DD	On-Demand	Anodyne	CYP2J2	55	39
CNS(=O)(=O)C[C@@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450584667	GC	On-Demand	Anodyne	MTNR1A	40	35
CNS(=O)(=O)C[C@@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450584667	GC	On-Demand	Anodyne	ACKR3	64	32
CNS(=O)(=O)C[C@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450584668	GC	On-Demand	Anodyne	MTNR1A	40	35
CNS(=O)(=O)C[C@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450584668	GC	On-Demand	Anodyne	ACKR3	64	32
CCOC1(C)CN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450584669	FD	On-Demand	Bother	TAAR1	18	41
CCOC1(C)CN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450584684	DE	On-Demand	Anodyne	PDE3B	57	36
CCOC1(C)CN(c2ncnc3[nH]ccc23)C1	ZINC000450584703	BD	On-Demand	Anodyne	AKT2	52	47
CCOC1(C)CN(c2ncnc3[nH]ccc23)C1	ZINC000450584703	BD	On-Demand	Anodyne	AKT3	37	42
CCOC1(C)CN(c2ncnc3[nH]ccc23)C1	ZINC000450584703	BD	On-Demand	Anodyne	JAK3	16	55
CCOC1(C)CN(c2ncnc3[nH]ccc23)C1	ZINC000450584703	BD	On-Demand	Anodyne	ROCK2	43	42
CCOC1(C)CN(c2ncnc3[nH]ccc23)C1	ZINC000450584703	BD	On-Demand	Anodyne	AKT1	25	43
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@@H]1c1noc(C)n1)CC(C)C	ZINC000450584708	FG	On-Demand	Anodyne	COLA	50	41
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@@H]1c1noc(C)n1)CC(C)C	ZINC000450584708	FG	On-Demand	Anodyne	CPT1A	41	40
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@H]1c1noc(C)n1)CC(C)C	ZINC000450584712	FG	On-Demand	Anodyne	COLA	50	41
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@H]1c1noc(C)n1)CC(C)C	ZINC000450584712	FG	On-Demand	Anodyne	CPT1A	41	40
CCOC1(C)CN(c2cc(C)nc3ccccc23)C1	ZINC000450584719	CG	On-Demand	Anodyne	METAP1	30	42
CCOC1(C)CN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450584720	DD	On-Demand	Bother	F2RL3	45	32
COCCn1c(SCc2cn(C)nc2C)nc2ccccc21	ZINC000450584728	DG	On-Demand	Anodyne	PTGDR2	19	46
CCCNC(=O)C1(NCc2ccn(CCc3ccccc3)n2)CCCCC1	ZINC000450584777	FG	On-Demand	Anodyne	HCN1	52	32
CCCNC(=O)C1(NCc2ccn(CCc3ccccc3)n2)CCCCC1	ZINC000450584777	FG	On-Demand	Anodyne	HCN4	49	32
Cc1nc2ccnn2cc1C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450584793	CD	On-Demand	Anodyne	HCRTR1	44	38
Cc1nc2ccnn2cc1C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450584793	CD	On-Demand	Anodyne	HCRTR2	44	38
Cc1nc2ccnn2cc1C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450584794	CD	On-Demand	Anodyne	HCRTR1	44	38
Cc1nc2ccnn2cc1C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450584794	CD	On-Demand	Anodyne	HCRTR2	44	38
CCn1cc(C(=O)N[C@@H](CCO)C(C)(C)C)c2ccccc21	ZINC000450584796	DG	On-Demand	Anodyne	CNR2	23	42
CCn1cc(C(=O)N[C@H](CCO)C(C)(C)C)c2ccccc21	ZINC000450584797	DG	On-Demand	Anodyne	CNR2	23	42
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HTR1A	207	76
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	ADRA2A	18	49
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	THRA	0	47
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	DRD2	167	68
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	DRD1	72	53
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	DRD4	103	64
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	ADRA1D	104	54
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HTR1B	31	43
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HTR2A	112	50
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HTR2C	63	49
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	SLC6A4	38	60
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	ADRA1A	111	54
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HRH1	36	50
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	ADRA1B	81	50
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	DRD3	160	59
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	ADRA2B	17	44
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	ADRA2C	20	50
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	DRD5	37	49
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	THRB	0	47
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HTR7	153	76
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	SIGMAR1	37	49
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HTR5A	16	43
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HTR6	0	45
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	SLC18A3	24	45
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	SLC9A1	41	33
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	HTR3B	0	40
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	ABCB1	65	45
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	CYP2J2	59	41
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	AP2S1	0	56
COCCOc1ccccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450584828	GG	On-Demand	Anodyne	ALPHA-1A	0	53
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450584840	CG	On-Demand	Anodyne	ACE	54	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450584840	CG	On-Demand	Anodyne	MME	76	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450584840	CG	On-Demand	Anodyne	TIMP3	56	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450584840	CG	On-Demand	Anodyne	AMP1_PLAFQ	45	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450584841	CG	On-Demand	Anodyne	ACE	54	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450584841	CG	On-Demand	Anodyne	MME	76	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450584841	CG	On-Demand	Anodyne	TIMP3	56	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450584841	CG	On-Demand	Anodyne	AMP1_PLAFQ	45	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450584844	CG	On-Demand	Anodyne	ACE	54	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450584844	CG	On-Demand	Anodyne	MME	76	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450584844	CG	On-Demand	Anodyne	TIMP3	56	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450584844	CG	On-Demand	Anodyne	AMP1_PLAFQ	45	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450584845	CG	On-Demand	Anodyne	ACE	54	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450584845	CG	On-Demand	Anodyne	MME	76	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450584845	CG	On-Demand	Anodyne	TIMP3	56	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450584845	CG	On-Demand	Anodyne	AMP1_PLAFQ	45	34
COc1cc(CC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)ccc1Cl	ZINC000450584846	GF	On-Demand	Anodyne	KCNQ2	33	41
COc1cc(CC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)ccc1Cl	ZINC000450584846	GF	On-Demand	Anodyne	COLA	43	39
COc1cc(CC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)ccc1Cl	ZINC000450584846	GF	On-Demand	Anodyne	CPT1A	41	39
COc1cc(CC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)ccc1Cl	ZINC000450584846	GF	On-Demand	Anodyne	CPT1B	41	39
COC(=O)C1(CN(CC(=O)Nc2ccc(F)cc2)C(C)(C)C)CC1	ZINC000450584860	EF	On-Demand	Anodyne	LTA4H	16	41
CCC[C@@H](CNc1cnc(-c2ccccc2)cn1)OC	ZINC000450584888	CG	On-Demand	Anodyne	TPH1	29	41
CCC[C@H](CNc1cnc(-c2ccccc2)cn1)OC	ZINC000450584889	CG	On-Demand	Anodyne	TPH1	29	41
O=C1N[C@]2(CCOc3ccccc32)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450584896	FG	On-Demand	Anodyne	AKR1B1	0	48
O=C1N[C@]2(CCOc3ccccc32)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450584896	FG	On-Demand	Anodyne	SCN9A	0	43
O=C1N[C@@]2(CCOc3ccccc32)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450584897	FG	On-Demand	Anodyne	AKR1B1	0	48
O=C1N[C@@]2(CCOc3ccccc32)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450584897	FG	On-Demand	Anodyne	SCN9A	0	43
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	CHRM2	26	45
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	DRD2	22	47
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	DRD4	61	47
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	ACHE	49	53
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	OPRM1	17	44
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	DRD3	28	45
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	OPRD1	21	48
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	OPRK1	17	42
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	LTA4H	33	52
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	HRH3	21	45
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	SIGMAR1	72	50
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	CCR3	31	44
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	CCR5	54	41
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	SLC18A3	26	43
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	MLNR	68	37
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	SLC6A5	23	42
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	MCHR1	34	48
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	MBTPS1	66	36
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584915	DH	On-Demand	Anodyne	ADIPOR2	0	41
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	CHRM2	26	45
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	DRD2	22	47
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	DRD4	61	47
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	ACHE	49	53
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	OPRM1	17	44
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	DRD3	28	45
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	OPRD1	21	48
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	OPRK1	17	42
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	LTA4H	33	52
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	HRH3	21	45
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	SIGMAR1	72	50
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	CCR3	31	44
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	CCR5	54	41
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	SLC18A3	26	43
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	MLNR	68	37
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	SLC6A5	23	42
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	MCHR1	34	48
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	MBTPS1	66	36
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450584917	DH	On-Demand	Anodyne	ADIPOR2	0	41
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450584918	GF	On-Demand	Anodyne	KCNQ2	46	37
COc1ccc([C@H](OC)[C@@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450584919	FF	On-Demand	Anodyne	NPBWR1	40	39
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450584920	GF	On-Demand	Anodyne	KCNQ2	46	37
COc1ccc([C@H](OC)[C@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450584921	FF	On-Demand	Anodyne	NPBWR1	40	39
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450584923	FF	On-Demand	Anodyne	NPBWR1	40	39
COc1ccc([C@@H](OC)[C@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450584925	FF	On-Demand	Anodyne	NPBWR1	40	39
CCN(CC(F)F)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450584938	CG	On-Demand	Anodyne	SLC6A2	16	42
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](CCO)C(C)(C)C	ZINC000450584940	DH	On-Demand	Anodyne	SORT1	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](CCO)C(C)(C)C	ZINC000450584940	DH	On-Demand	Anodyne	MTTP	43	34
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](CCO)C(C)(C)C	ZINC000450584942	DH	On-Demand	Anodyne	SORT1	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](CCO)C(C)(C)C	ZINC000450584942	DH	On-Demand	Anodyne	MTTP	43	34
CCc1nn(C)cc1CNC(=O)c1c(C)cccc1Cl	ZINC000450584974	CF	On-Demand	Anodyne	P2RX7	40	38
CC(C)(C)[C@@H](CCO)NC(=O)c1cc2ccncc2s1	ZINC000450584991	CF	On-Demand	Anodyne	SELE	51	36
CC(C)(C)[C@@H](CCO)NC(=O)c1cc2ccncc2s1	ZINC000450584991	CF	On-Demand	Anodyne	ICAM1	46	36
CC(C)(C)[C@H](CCO)NC(=O)c1cc2ccncc2s1	ZINC000450584992	CF	On-Demand	Anodyne	SELE	51	36
CC(C)(C)[C@H](CCO)NC(=O)c1cc2ccncc2s1	ZINC000450584992	CF	On-Demand	Anodyne	ICAM1	46	36
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	DRD2	32	44
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	DRD4	18	49
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	HTR2A	40	59
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	HTR2C	30	55
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	SLC6A1	41	33
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	ERG2	20	44
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	HTR7	24	44
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	SIGMAR1	17	51
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	CCR3	41	39
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	HTR3B	0	45
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	CYP2J2	55	39
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584996	FE	On-Demand	Anodyne	BIRC2	40	36
CCn1nc(C)c(CC(=O)N=c2nc(Cc3ccc(F)cc3F)[nH]s2)c1C	ZINC000450584997	GF	On-Demand	Anodyne	P2RX7	30	48
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	DRD2	32	44
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	DRD4	18	49
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	HTR2A	40	59
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	HTR2C	30	55
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	SLC6A1	41	33
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	ERG2	20	44
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	HTR7	24	44
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	SIGMAR1	17	51
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	CCR3	41	39
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	HTR3B	0	45
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	CYP2J2	55	39
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450584998	FE	On-Demand	Anodyne	BIRC2	40	36
C[C@@H](CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O)S(C)(=O)=O	ZINC000450584999	FC	On-Demand	Anodyne	SCN9A	0	45
C[C@@H](CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O)S(C)(=O)=O	ZINC000450584999	FC	On-Demand	Anodyne	DYRK2	49	33
Cc1cnc([C@H](C)CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)s1	ZINC000450585000	GI	On-Demand	Anodyne	PYGL	52	37
C[C@H](CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O)S(C)(=O)=O	ZINC000450585003	FC	On-Demand	Anodyne	SCN9A	0	45
C[C@H](CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O)S(C)(=O)=O	ZINC000450585003	FC	On-Demand	Anodyne	DYRK2	49	33
C[C@H](CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O)S(C)(=O)=O	ZINC000450585004	FC	On-Demand	Anodyne	SCN9A	0	45
C[C@H](CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O)S(C)(=O)=O	ZINC000450585004	FC	On-Demand	Anodyne	DYRK2	49	33
Cc1cnc([C@@H](C)CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)s1	ZINC000450585005	GI	On-Demand	Anodyne	PYGL	52	37
C[C@@H](CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O)S(C)(=O)=O	ZINC000450585006	FC	On-Demand	Anodyne	SCN9A	0	45
C[C@@H](CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O)S(C)(=O)=O	ZINC000450585006	FC	On-Demand	Anodyne	DYRK2	49	33
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC(CF)CF	ZINC000450585007	FE	On-Demand	Bother	BCL2L1	98	35
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC(CF)CF	ZINC000450585007	FE	On-Demand	Bother	BCL2	82	38
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC(CF)CF	ZINC000450585007	FE	On-Demand	Bother	BCL2L2	44	31
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN2CCOC[C@H]2C1	ZINC000450585009	EE	On-Demand	Anodyne	CACNA1B	41	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN2CCOC[C@H]2C1	ZINC000450585009	EE	On-Demand	Anodyne	SLC6A9	21	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN2CCOC[C@@H]2C1	ZINC000450585011	EE	On-Demand	Anodyne	CACNA1B	41	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN2CCOC[C@@H]2C1	ZINC000450585011	EE	On-Demand	Anodyne	SLC6A9	21	41
C[C@H]1N(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCC12CCOCC2	ZINC000450585023	FI	On-Demand	Anodyne	RBP4	77	36
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCO[C@H](C2CCCCC2)C1	ZINC000450585025	FG	On-Demand	Anodyne	CPT2	43	36
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCO[C@H](C2CCCCC2)C1	ZINC000450585025	FG	On-Demand	Anodyne	PREP	82	53
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCO[C@H](C2CCCCC2)C1	ZINC000450585025	FG	On-Demand	Anodyne	SFRP1	42	41
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCO[C@H](C2CCCCC2)C1	ZINC000450585025	FG	On-Demand	Anodyne	WNT3	43	41
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCO[C@@H](C2CCCCC2)C1	ZINC000450585028	FG	On-Demand	Anodyne	CPT2	43	36
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCO[C@@H](C2CCCCC2)C1	ZINC000450585028	FG	On-Demand	Anodyne	PREP	82	53
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCO[C@@H](C2CCCCC2)C1	ZINC000450585028	FG	On-Demand	Anodyne	SFRP1	42	41
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCO[C@@H](C2CCCCC2)C1	ZINC000450585028	FG	On-Demand	Anodyne	WNT3	43	41
CCOc1ccc2c(c1)CCN(Cc1cnns1)C2	ZINC000450585035	CE	On-Demand	Anodyne	NOD2	24	40
CCS(=O)(=O)c1ccc(COc2ccc(CO)cc2)cc1	ZINC000450585042	DF	On-Demand	Anodyne	MMP13	23	40
CCS(=O)(=O)c1ccc(COc2ccc(CO)cc2)cc1	ZINC000450585042	DF	On-Demand	Anodyne	MMP14	25	47
CCS(=O)(=O)c1ccc(COc2ccc(CO)cc2)cc1	ZINC000450585042	DF	On-Demand	Anodyne	ADAMTS4	49	40
CCS(=O)(=O)c1ccc(COc2ccc(CO)cc2)cc1	ZINC000450585042	DF	On-Demand	Anodyne	FFAR1	32	40
CCS(=O)(=O)c1ccc(COc2ccc(CO)cc2)cc1	ZINC000450585042	DF	On-Demand	Anodyne	FFAR4	41	31
CC[C@H](CC(C)C)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450585050	EG	On-Demand	Anodyne	KCNQ2	61	39
CC[C@@H](CC(C)C)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450585052	EG	On-Demand	Anodyne	KCNQ2	61	39
Cc1cc(CNC(=O)c2cn(CC(C)C)nc2C(F)F)ccc1Cl	ZINC000450585070	FI	On-Demand	Anodyne	P2RX7	42	39
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2cc(Br)ccc2C)no1	ZINC000450585074	GI	On-Demand	Anodyne	COLA	108	45
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2cc(Br)ccc2C)no1	ZINC000450585074	GI	On-Demand	Anodyne	CPT1A	106	45
Cc1nc([C@H]2CCCCCN2C(=O)Cc2cc(Br)ccc2C)no1	ZINC000450585077	GI	On-Demand	Anodyne	COLA	108	45
Cc1nc([C@H]2CCCCCN2C(=O)Cc2cc(Br)ccc2C)no1	ZINC000450585077	GI	On-Demand	Anodyne	CPT1A	106	45
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	HTR1A	102	52
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	DRD2	79	52
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	DRD1	28	40
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	DRD4	46	44
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	ADRA1D	76	46
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	HTR2A	42	45
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	SLC6A4	17	44
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	ADRA1A	72	46
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	ADRA1B	51	46
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	DRD3	81	45
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	HTR7	60	41
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	ABCB1	63	44
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	HSP90AB1	40	47
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585085	GF	On-Demand	Anodyne	AP2S1	0	43
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	HTR1A	102	52
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	DRD2	79	52
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	DRD1	28	40
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	DRD4	46	44
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	ADRA1D	76	46
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	HTR2A	42	45
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	SLC6A4	17	44
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	ADRA1A	72	46
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	ADRA1B	51	46
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	DRD3	81	45
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	HTR7	60	41
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	ABCB1	63	44
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	HSP90AB1	40	47
COCCOc1ccccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450585087	GF	On-Demand	Anodyne	AP2S1	0	43
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	HTR1A	102	52
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	DRD2	79	52
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	DRD1	28	40
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	DRD4	46	44
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	ADRA1D	76	46
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	HTR2A	42	45
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	SLC6A4	17	44
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	ADRA1A	72	46
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	ADRA1B	51	46
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	DRD3	81	45
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	HTR7	60	41
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	ABCB1	63	44
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	HSP90AB1	40	47
COCCOc1ccccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585090	GF	On-Demand	Anodyne	AP2S1	0	43
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	HTR1A	102	52
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	DRD2	79	52
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	DRD1	28	40
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	DRD4	46	44
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	ADRA1D	76	46
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	HTR2A	42	45
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	SLC6A4	17	44
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	ADRA1A	72	46
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	ADRA1B	51	46
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	DRD3	81	45
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	HTR7	60	41
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	ABCB1	63	44
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	HSP90AB1	40	47
COCCOc1ccccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450585091	GF	On-Demand	Anodyne	AP2S1	0	43
O=C(N[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)c1ccc2ccccc2c1	ZINC000450585103	FH	On-Demand	Anodyne	DRD4	21	48
O=C(N[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)c1ccc2ccccc2c1	ZINC000450585105	FH	On-Demand	Anodyne	DRD4	21	48
O=C(N[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1)c1ccc2ccccc2c1	ZINC000450585106	FH	On-Demand	Anodyne	DRD4	21	48
O=C(N[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1)c1ccc2ccccc2c1	ZINC000450585107	FH	On-Demand	Anodyne	DRD4	21	48
Cc1nc2ccnn2cc1C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450585128	CD	On-Demand	Anodyne	HCRTR1	44	38
Cc1nc2ccnn2cc1C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450585128	CD	On-Demand	Anodyne	HCRTR2	44	38
Cc1nc2ccnn2cc1C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450585129	CD	On-Demand	Anodyne	HCRTR1	44	38
Cc1nc2ccnn2cc1C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450585129	CD	On-Demand	Anodyne	HCRTR2	44	38
C[C@@H]1CCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@H]1CO	ZINC000450585140	EE	On-Demand	Bother	CACNA1D	41	31
C[C@@H]1CCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1CO	ZINC000450585142	EE	On-Demand	Bother	CACNA1D	41	31
C[C@H]1CCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1CO	ZINC000450585144	EE	On-Demand	Bother	CACNA1D	41	31
C[C@H]1CCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@H]1CO	ZINC000450585146	EE	On-Demand	Bother	CACNA1D	41	31
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450585148	GF	On-Demand	Anodyne	PDEC	0	40
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450585149	GH	On-Demand	Anodyne	COLA	140	55
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450585149	GH	On-Demand	Anodyne	CPT1A	131	55
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450585150	GH	On-Demand	Anodyne	COLA	140	55
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450585150	GH	On-Demand	Anodyne	CPT1A	131	55
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450585151	GH	On-Demand	Anodyne	COLA	140	55
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450585151	GH	On-Demand	Anodyne	CPT1A	131	55
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450585152	GH	On-Demand	Anodyne	COLA	140	55
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450585152	GH	On-Demand	Anodyne	CPT1A	131	55
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450585154	GF	On-Demand	Anodyne	PDEC	0	40
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450585155	GF	On-Demand	Anodyne	PDEC	0	40
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450585156	GF	On-Demand	Anodyne	PDEC	0	40
COC(=O)[C@H](C)[C@H](NCCC[C@H](C)O)c1ccccc1	ZINC000450585165	CE	On-Demand	Anodyne	C3AR1	46	33
COC(=O)[C@H](C)[C@@H](NCCC[C@H](C)O)c1ccccc1	ZINC000450585166	CE	On-Demand	Anodyne	C3AR1	46	33
COC(=O)[C@H](C)[C@H](NCCC[C@@H](C)O)c1ccccc1	ZINC000450585167	CE	On-Demand	Anodyne	C3AR1	46	33
COC(=O)[C@H](C)[C@@H](NCCC[C@@H](C)O)c1ccccc1	ZINC000450585168	CE	On-Demand	Anodyne	C3AR1	46	33
O=C(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450585181	EH	On-Demand	Anodyne	CCR3	34	41
O=C(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450585181	EH	On-Demand	Anodyne	MCHR1	22	43
O=C(N[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450585181	EH	On-Demand	Anodyne	BIRC2	41	35
O=C(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450585183	EH	On-Demand	Anodyne	CCR3	34	41
O=C(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450585183	EH	On-Demand	Anodyne	MCHR1	22	43
O=C(N[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1cc2ccccc2o1	ZINC000450585183	EH	On-Demand	Anodyne	BIRC2	41	35
CCS(=O)(=O)c1ccc(CN[C@H](c2ccccc2)[C@@H](C)C(=O)OC)cc1	ZINC000450585185	GG	On-Demand	Anodyne	RORC	42	40
CCS(=O)(=O)c1ccc(CN[C@@H](c2ccccc2)[C@@H](C)C(=O)OC)cc1	ZINC000450585186	GG	On-Demand	Anodyne	RORC	42	40
CCS(=O)(=O)c1ccc(CN[C@@H](c2ccccc2)[C@H](C)C(=O)OC)cc1	ZINC000450585187	GG	On-Demand	Anodyne	RORC	42	40
CCS(=O)(=O)c1ccc(CN[C@H](c2ccccc2)[C@H](C)C(=O)OC)cc1	ZINC000450585188	GG	On-Demand	Anodyne	RORC	42	40
CS[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@H]1N1CCCC1	ZINC000450585191	FH	On-Demand	Anodyne	L3MBTL1	0	40
CS[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@H]1N1CCCC1	ZINC000450585191	FH	On-Demand	Anodyne	L3MBTL3	45	34
CS[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@@H]1N1CCCC1	ZINC000450585192	FH	On-Demand	Anodyne	L3MBTL1	0	40
CS[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@@H]1N1CCCC1	ZINC000450585192	FH	On-Demand	Anodyne	L3MBTL3	45	34
CS[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@H]1N1CCCC1	ZINC000450585193	FH	On-Demand	Anodyne	L3MBTL1	0	40
CS[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@H]1N1CCCC1	ZINC000450585193	FH	On-Demand	Anodyne	L3MBTL3	45	34
CS[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@@H]1N1CCCC1	ZINC000450585194	FH	On-Demand	Anodyne	L3MBTL1	0	40
CS[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@@H]1N1CCCC1	ZINC000450585194	FH	On-Demand	Anodyne	L3MBTL3	45	34
C[C@@H]1CCCN(C(=O)c2ccsc2Br)[C@@H]1CO	ZINC000450585215	DF	On-Demand	Anodyne	TRPC6	47	34
C[C@@H]1CCCN(C(=O)c2ccsc2Br)[C@H]1CO	ZINC000450585218	DF	On-Demand	Anodyne	TRPC6	47	34
C[C@H]1CCCN(C(=O)c2ccsc2Br)[C@@H]1CO	ZINC000450585220	DF	On-Demand	Anodyne	TRPC6	47	34
C[C@H]1CCCN(C(=O)c2ccsc2Br)[C@H]1CO	ZINC000450585222	DF	On-Demand	Anodyne	TRPC6	47	34
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CC1CC(F)(F)C1	ZINC000450585227	EF	On-Demand	Anodyne	HRH3	0	42
CCS(=O)(=O)c1ccc(CSc2nc3ccccc3n2CCOC)cc1	ZINC000450585239	GH	On-Demand	Anodyne	HRH1	18	45
CCS(=O)(=O)c1ccc(CSc2nc3ccccc3n2CCOC)cc1	ZINC000450585239	GH	On-Demand	Anodyne	PTGDR2	20	53
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC=C(c3ccc(C)nc3)CC2)c1	ZINC000450585256	EH	On-Demand	Anodyne	QDPR	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC=C(c3ccc(C)nc3)CC2)c1	ZINC000450585256	EH	On-Demand	Anodyne	ADAM10	35	47
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585258	GF	On-Demand	Anodyne	DRD4	26	45
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585258	GF	On-Demand	Anodyne	DRD3	22	45
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585258	GF	On-Demand	Anodyne	SSTR5	52	36
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585258	GF	On-Demand	Anodyne	MCHR1	28	43
COC(=O)c1coc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585258	GF	On-Demand	Anodyne	BIRC2	40	36
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585260	GF	On-Demand	Anodyne	DRD4	26	45
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585260	GF	On-Demand	Anodyne	DRD3	22	45
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585260	GF	On-Demand	Anodyne	SSTR5	52	36
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585260	GF	On-Demand	Anodyne	MCHR1	28	43
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)n1	ZINC000450585260	GF	On-Demand	Anodyne	BIRC2	40	36
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450585265	FE	On-Demand	Anodyne	THYX_PBCV1	0	42
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450585266	FE	On-Demand	Anodyne	THYX_PBCV1	0	42
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450585267	FE	On-Demand	Anodyne	THYX_PBCV1	0	42
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450585268	FE	On-Demand	Anodyne	THYX_PBCV1	0	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CC=C(c3ccc(C)nc3)CC2)c1	ZINC000450585270	GI	On-Demand	Anodyne	QDPR	0	40
c1nc(N2CC3(CC3)C2)c2c3c(sc2n1)CCCC3	ZINC000450585272	CG	On-Demand	Anodyne	RBP4	18	45
CCCOc1ccc(OCc2nc(C(=O)OC)co2)cc1	ZINC000450585273	CF	On-Demand	Anodyne	PLA2G4B	43	31
COc1cc(NC(=O)CN(C)CCN(C)Cc2ccccc2)cc(OC)c1	ZINC000450585274	FF	On-Demand	Anodyne	ACHE	31	50
COc1cc(NC(=O)CN(C)CCN(C)Cc2ccccc2)cc(OC)c1	ZINC000450585274	FF	On-Demand	Anodyne	LTA4H	0	49
COc1cc(NC(=O)CN(C)CCN(C)Cc2ccccc2)cc(OC)c1	ZINC000450585274	FF	On-Demand	Anodyne	SLC6A9	34	42
CCc1nn(C)cc1CNC(=O)c1c(Cl)cc(F)cc1Br	ZINC000450585317	FG	On-Demand	Anodyne	P2RX7	44	38
CC(C)C[C@H](C)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450585321	GG	On-Demand	Anodyne	P2RX7	42	40
CC(C)C[C@H](C)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450585321	GG	On-Demand	Anodyne	Q95J97_RABIT	0	48
COc1ccc2c(c1)N(Cc1ccn(CC(F)(F)F)n1)CCCC2	ZINC000450585323	EH	On-Demand	Anodyne	TYMS	0	41
CC(C)C[C@@H](C)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450585325	GG	On-Demand	Anodyne	P2RX7	42	40
CC(C)C[C@@H](C)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450585325	GG	On-Demand	Anodyne	Q95J97_RABIT	0	48
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450585327	GE	On-Demand	Anodyne	P2RX7	43	46
CCC[C@H](O)CN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450585327	GE	On-Demand	Anodyne	ROCK2	0	55
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450585330	GE	On-Demand	Anodyne	P2RX7	43	46
CCC[C@@H](O)CN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450585330	GE	On-Demand	Anodyne	ROCK2	0	55
COCCOc1ccccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450585334	EF	On-Demand	Anodyne	DRD1	39	46
COCCOc1ccccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450585334	EF	On-Demand	Anodyne	DRD3	27	40
COCCOc1ccccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450585334	EF	On-Demand	Anodyne	ABCB1	32	42
COCCOc1ccccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450585334	EF	On-Demand	Anodyne	AP2S1	0	41
COCCOc1ccccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450585334	EF	On-Demand	Anodyne	ALPHA-1A	0	41
COc1cccc(OCCC(=O)N[C@H](c2ccccc2)[C@@H]2CCOC2)c1	ZINC000450585337	FG	On-Demand	Anodyne	AGTR2	59	33
COc1cccc(OCCC(=O)N[C@H](c2ccccc2)[C@@H]2CCOC2)c1	ZINC000450585337	FG	On-Demand	Anodyne	MTNR1A	30	40
COc1cccc(OCCC(=O)N[C@H](c2ccccc2)[C@H]2CCOC2)c1	ZINC000450585338	FG	On-Demand	Anodyne	AGTR2	59	33
COc1cccc(OCCC(=O)N[C@H](c2ccccc2)[C@H]2CCOC2)c1	ZINC000450585338	FG	On-Demand	Anodyne	MTNR1A	30	40
COc1cccc(OCCC(=O)N[C@@H](c2ccccc2)[C@@H]2CCOC2)c1	ZINC000450585339	FG	On-Demand	Anodyne	AGTR2	59	33
COc1cccc(OCCC(=O)N[C@@H](c2ccccc2)[C@@H]2CCOC2)c1	ZINC000450585339	FG	On-Demand	Anodyne	MTNR1A	30	40
COc1cccc(OCCC(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)c1	ZINC000450585340	FG	On-Demand	Anodyne	AGTR2	59	33
COc1cccc(OCCC(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)c1	ZINC000450585340	FG	On-Demand	Anodyne	MTNR1A	30	40
CCC[C@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450585341	EE	On-Demand	Bother	BDKRB1	25	51
CCC[C@@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450585342	EE	On-Demand	Bother	BDKRB1	25	51
CC[C@H](CO)N(C)c1nn2c(C)nnc2c2ccccc12	ZINC000450585350	CD	On-Demand	Anodyne	CECR2	0	40
CC[C@@H](CO)N(C)c1nn2c(C)nnc2c2ccccc12	ZINC000450585351	CD	On-Demand	Anodyne	CECR2	0	40
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	DRD4	23	45
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	SIGMAR1	30	42
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	CCR3	39	40
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	MLNR	42	35
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	HDAC6	52	36
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	MCHR1	17	45
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	NOD1	37	48
CC(=O)c1ccc(CN2CCc3ccc(F)cc3C2)cc1	ZINC000450585360	CH	On-Demand	Anodyne	NOD2	55	48
COCC(=O)N1CCc2c(NC(=O)[C@H](C)OCc3ccc(F)cc3)cccc21	ZINC000450585408	GF	On-Demand	Anodyne	KCNQ2	45	37
COCC(=O)N1CCc2c(NC(=O)[C@@H](C)OCc3ccc(F)cc3)cccc21	ZINC000450585410	GF	On-Demand	Anodyne	KCNQ2	45	37
CN(Cc1ccn(CC(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450585427	FG	On-Demand	Anodyne	SIGMAR1	28	40
CN(Cc1ccn(CC(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450585428	FG	On-Demand	Anodyne	SIGMAR1	28	40
CCC[C@H](CNc1ncc(C(=O)N2CCOCC2)cc1Cl)OC	ZINC000450585429	EE	On-Demand	Anodyne	LRRK2	30	43
CCC[C@@H](CNc1ncc(C(=O)N2CCOCC2)cc1Cl)OC	ZINC000450585430	EE	On-Demand	Anodyne	LRRK2	30	43
CCO[C@@H]1COCC[C@H]1NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450585434	ED	On-Demand	Anodyne	DRD4	40	31
O=S(=O)(c1cccc2cnccc12)N1CCCN(CC2=CCCCC2)CC1	ZINC000450585435	GG	On-Demand	Anodyne	P2RX7	40	46
O=S(=O)(c1cccc2cnccc12)N1CCCN(CC2=CCCCC2)CC1	ZINC000450585435	GG	On-Demand	Anodyne	Q95J97_RABIT	0	41
CCO[C@@H]1COCC[C@@H]1NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450585437	ED	On-Demand	Anodyne	DRD4	40	31
CCO[C@H]1COCC[C@@H]1NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450585438	ED	On-Demand	Anodyne	DRD4	40	31
CCO[C@H]1COCC[C@H]1NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450585439	ED	On-Demand	Anodyne	DRD4	40	31
CCC[C@@H](CNc1cc(-c2ccccc2)nc2ncnn12)OC	ZINC000450585459	DG	On-Demand	Anodyne	DHOD	0	41
CCC[C@H](CNc1cc(-c2ccccc2)nc2ncnn12)OC	ZINC000450585460	DG	On-Demand	Anodyne	DHOD	0	41
CC[C@@H](c1ccccc1)N(CC(=O)OC)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450585527	GH	On-Demand	Anodyne	LIMK2	40	39
CC[C@@H](c1ccccc1)N(CC(=O)OC)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450585527	GH	On-Demand	Anodyne	RORC	40	43
CC[C@H](c1ccccc1)N(CC(=O)OC)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450585530	GH	On-Demand	Anodyne	LIMK2	40	39
CC[C@H](c1ccccc1)N(CC(=O)OC)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450585530	GH	On-Demand	Anodyne	RORC	40	43
CCC[C@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585539	CG	On-Demand	Anodyne	ACE	55	43
CCC[C@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585539	CG	On-Demand	Anodyne	FKBP1A	56	37
CCC[C@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585539	CG	On-Demand	Anodyne	SLC18A2	51	40
CCC[C@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585539	CG	On-Demand	Anodyne	MME	35	43
CCC[C@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585539	CG	On-Demand	Anodyne	CTRA_BOVIN	42	32
CCC[C@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585539	CG	On-Demand	Anodyne	PREP	46	39
CCC[C@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585539	CG	On-Demand	Anodyne	CELA2A	49	32
CCC[C@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585539	CG	On-Demand	Anodyne	BRCA1	45	32
CCC[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585540	CG	On-Demand	Anodyne	ACE	55	43
CCC[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585540	CG	On-Demand	Anodyne	FKBP1A	56	37
CCC[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585540	CG	On-Demand	Anodyne	SLC18A2	51	40
CCC[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585540	CG	On-Demand	Anodyne	MME	35	43
CCC[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585540	CG	On-Demand	Anodyne	CTRA_BOVIN	42	32
CCC[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585540	CG	On-Demand	Anodyne	PREP	46	39
CCC[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585540	CG	On-Demand	Anodyne	CELA2A	49	32
CCC[C@@H]1CCCCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450585540	CG	On-Demand	Anodyne	BRCA1	45	32
CCC[C@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585542	CG	On-Demand	Anodyne	ACE	55	43
CCC[C@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585542	CG	On-Demand	Anodyne	FKBP1A	56	37
CCC[C@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585542	CG	On-Demand	Anodyne	SLC18A2	51	40
CCC[C@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585542	CG	On-Demand	Anodyne	MME	35	43
CCC[C@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585542	CG	On-Demand	Anodyne	CTRA_BOVIN	42	32
CCC[C@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585542	CG	On-Demand	Anodyne	PREP	46	39
CCC[C@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585542	CG	On-Demand	Anodyne	CELA2A	49	32
CCC[C@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585542	CG	On-Demand	Anodyne	BRCA1	45	32
CCC[C@@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585544	CG	On-Demand	Anodyne	ACE	55	43
CCC[C@@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585544	CG	On-Demand	Anodyne	FKBP1A	56	37
CCC[C@@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585544	CG	On-Demand	Anodyne	SLC18A2	51	40
CCC[C@@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585544	CG	On-Demand	Anodyne	MME	35	43
CCC[C@@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585544	CG	On-Demand	Anodyne	CTRA_BOVIN	42	32
CCC[C@@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585544	CG	On-Demand	Anodyne	PREP	46	39
CCC[C@@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585544	CG	On-Demand	Anodyne	CELA2A	49	32
CCC[C@@H]1CCCCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450585544	CG	On-Demand	Anodyne	BRCA1	45	32
COC[C@@](C)(O)CCNc1nccc(-c2ccc(OC)cc2)n1	ZINC000450585566	DE	On-Demand	Anodyne	CLK4	23	54
COC[C@](C)(O)CCNc1nccc(-c2ccc(OC)cc2)n1	ZINC000450585568	DE	On-Demand	Anodyne	CLK4	23	54
CC1(F)CC(Nc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450585591	CG	On-Demand	Anodyne	DHOD	0	50
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	DRD2	21	48
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	DRD4	49	52
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	ACHE	27	45
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	DRD3	29	49
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	KCNH2	18	55
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	HRH3	21	44
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	SIGMAR1	37	42
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	SSTR5	69	40
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	CCR3	60	47
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	UTS2R	25	43
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	CCR2	19	43
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	SLC6A5	32	41
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	MCHR1	53	56
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585592	GI	On-Demand	Anodyne	BIRC2	41	35
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	DRD2	21	48
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	DRD4	49	52
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	ACHE	27	45
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	DRD3	29	49
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	KCNH2	18	55
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	HRH3	21	44
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	SIGMAR1	37	42
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	SSTR5	69	40
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	CCR3	60	47
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	UTS2R	25	43
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	CCR2	19	43
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	SLC6A5	32	41
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	MCHR1	53	56
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)cc1	ZINC000450585595	GI	On-Demand	Anodyne	BIRC2	41	35
CCOC1(C)CN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000450585597	DD	On-Demand	Bother	CACNA1D	41	32
COc1cc(CN2CCN(C3CCN(C(C)C)CC3)CC2)ccc1Cl	ZINC000450585602	FG	On-Demand	Anodyne	SSTR5	46	37
COc1cc(CN2CCN(C3CCN(C(C)C)CC3)CC2)ccc1Cl	ZINC000450585602	FG	On-Demand	Anodyne	CCR3	20	42
COc1cc(CN2CCN(C3CCN(C(C)C)CC3)CC2)ccc1Cl	ZINC000450585602	FG	On-Demand	Anodyne	EHMT2	49	35
Cc1ccccc1CCN(C)c1ncc([N+](=O)[O-])s1	ZINC000450585608	CG	On-Demand	Bother	COLA	46	32
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C)c3c2CCC3)no1	ZINC000450585619	EH	On-Demand	Anodyne	COLA	61	40
Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C)c3c2CCC3)no1	ZINC000450585619	EH	On-Demand	Anodyne	CPT1A	60	40
CC[C@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585623	DC	On-Demand	Anodyne	FOLH1	52	42
CC[C@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585623	DC	On-Demand	Anodyne	HLA-A	48	48
CC[C@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585623	DC	On-Demand	Anodyne	CAPN1	61	36
CC[C@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585623	DC	On-Demand	Anodyne	CAPN2	83	36
CC[C@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585623	DC	On-Demand	Anodyne	NPR	50	44
CC[C@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585623	DC	On-Demand	Anodyne	GSP	0	42
CC[C@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585623	DC	On-Demand	Anodyne	F2RL1	58	37
CC[C@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585623	DC	On-Demand	Anodyne	LASB	0	41
CC[C@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585626	DC	On-Demand	Anodyne	FOLH1	52	42
CC[C@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585626	DC	On-Demand	Anodyne	HLA-A	48	48
CC[C@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585626	DC	On-Demand	Anodyne	CAPN1	61	36
CC[C@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585626	DC	On-Demand	Anodyne	CAPN2	83	36
CC[C@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585626	DC	On-Demand	Anodyne	NPR	50	44
CC[C@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585626	DC	On-Demand	Anodyne	GSP	0	42
CC[C@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585626	DC	On-Demand	Anodyne	F2RL1	58	37
CC[C@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585626	DC	On-Demand	Anodyne	LASB	0	41
CC[C@@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585628	DC	On-Demand	Anodyne	FOLH1	52	42
CC[C@@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585628	DC	On-Demand	Anodyne	HLA-A	48	48
CC[C@@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585628	DC	On-Demand	Anodyne	CAPN1	61	36
CC[C@@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585628	DC	On-Demand	Anodyne	CAPN2	83	36
CC[C@@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585628	DC	On-Demand	Anodyne	NPR	50	44
CC[C@@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585628	DC	On-Demand	Anodyne	GSP	0	42
CC[C@@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585628	DC	On-Demand	Anodyne	F2RL1	58	37
CC[C@@H](C)[C@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585628	DC	On-Demand	Anodyne	LASB	0	41
CC[C@@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585629	DC	On-Demand	Anodyne	FOLH1	52	42
CC[C@@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585629	DC	On-Demand	Anodyne	HLA-A	48	48
CC[C@@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585629	DC	On-Demand	Anodyne	CAPN1	61	36
CC[C@@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585629	DC	On-Demand	Anodyne	CAPN2	83	36
CC[C@@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585629	DC	On-Demand	Anodyne	NPR	50	44
CC[C@@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585629	DC	On-Demand	Anodyne	GSP	0	42
CC[C@@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585629	DC	On-Demand	Anodyne	F2RL1	58	37
CC[C@@H](C)[C@@H](O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450585629	DC	On-Demand	Anodyne	LASB	0	41
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C)c3c2CCC3)no1	ZINC000450585635	EH	On-Demand	Anodyne	COLA	61	40
Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C)c3c2CCC3)no1	ZINC000450585635	EH	On-Demand	Anodyne	CPT1A	60	40
CCOC1(C)CN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450585652	CD	On-Demand	Anodyne	SLC6A9	25	44
COC(=O)c1cnc(N(C)CCc2ccccc2C)c([N+](=O)[O-])c1	ZINC000450585657	EF	On-Demand	Bother	CACNA1D	50	31
COC(=O)c1cnc(N(C)CCc2ccccc2C)c([N+](=O)[O-])c1	ZINC000450585657	EF	On-Demand	Bother	COLA	72	34
CC1(F)CC(Nc2ncnc3sc4c(c23)CCC4)C1	ZINC000450585678	CG	On-Demand	Anodyne	IRAK4	15	63
COc1ccc(-c2csc3ncnc(NC(CF)CF)c23)cc1	ZINC000450585690	EI	On-Demand	Anodyne	ADRB3	19	40
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450585694	EC	On-Demand	Anodyne	NPY1R	41	33
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450585694	EC	On-Demand	Anodyne	NPY2R	49	35
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450585695	EC	On-Demand	Anodyne	NPY1R	41	33
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450585695	EC	On-Demand	Anodyne	NPY2R	49	35
COC[C@](C)(O)CCNc1ncnc2sc(-c3ccccc3)cc12	ZINC000450585696	EH	On-Demand	Anodyne	FDPS	15	42
COC[C@@](C)(O)CCNc1ncnc2sc(-c3ccccc3)cc12	ZINC000450585697	EH	On-Demand	Anodyne	FDPS	15	42
Cc1cc(Cl)c2ncc(C#N)c(NC3CCC(CS(C)(=O)=O)CC3)c2c1	ZINC000450585734	GI	On-Demand	Mild	MAP3K8	69	36
CCOCc1nc(C)c(C(=O)NCc2ccc(Cl)c(C)c2)s1	ZINC000450585751	EH	On-Demand	Anodyne	CHRM4	29	42
CCOCc1nc(C)c(C(=O)NCc2ccc(Cl)c(C)c2)s1	ZINC000450585751	EH	On-Demand	Anodyne	SCD1	47	45
CCOCc1nc(C)c(C(=O)NCc2ccc(Cl)c(C)c2)s1	ZINC000450585751	EH	On-Demand	Anodyne	SCD	40	41
Cc1cc(N2CC3(CC3)C2)nc(-c2cccnc2)n1	ZINC000450585787	CE	On-Demand	Anodyne	ROS1	36	40
COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450585792	FF	On-Demand	Anodyne	CTSV	44	30
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450585799	FF	On-Demand	Anodyne	CTSV	44	30
COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450585800	FF	On-Demand	Anodyne	CTSV	44	30
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450585801	FF	On-Demand	Anodyne	CTSV	44	30
CCn1cc(C(=O)N2CC=C(c3ccc(C)nc3)CC2)c2ccccc21	ZINC000450585816	EI	On-Demand	Anodyne	TPSAB1	26	42
COc1cc(NC(=O)CN(C)C[C@H](Cc2ccccc2)OC)cc(OC)c1	ZINC000450585822	FF	On-Demand	Anodyne	NPY5R	24	41
COc1cc(NC(=O)CN(C)C[C@@H](Cc2ccccc2)OC)cc(OC)c1	ZINC000450585823	FF	On-Demand	Anodyne	NPY5R	24	41
CNC(=O)c1cc([N+](=O)[O-])ccc1NC1CCC(CS(C)(=O)=O)CC1	ZINC000450585824	FD	On-Demand	Bother	TBXA2R	19	42
COc1ccc(NC(=O)C2(NC[C@@H]3CCCCC3(F)F)CCCC2)cc1OC	ZINC000450585832	GI	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(NC(=O)C2(NC[C@@H]3CCCCC3(F)F)CCCC2)cc1OC	ZINC000450585832	GI	On-Demand	Anodyne	ENPP1	67	32
COc1ccc(NC(=O)C2(NC[C@H]3CCCCC3(F)F)CCCC2)cc1OC	ZINC000450585833	GI	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(NC(=O)C2(NC[C@H]3CCCCC3(F)F)CCCC2)cc1OC	ZINC000450585833	GI	On-Demand	Anodyne	ENPP1	67	32
CC(C)(C)C(=O)CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450585909	GJ	On-Demand	Anodyne	CPT1A	146	59
CC(C)(C)C(=O)CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450585909	GJ	On-Demand	Anodyne	PREP	45	37
CC(C)(C)C(=O)CCCC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450585910	GJ	On-Demand	Anodyne	CPT1A	146	59
CC(C)(C)C(=O)CCCC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450585910	GJ	On-Demand	Anodyne	PREP	45	37
CCOC1(C)CN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450585913	DD	On-Demand	Anodyne	HDAC1	28	40
Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)c(O)n1	ZINC000450585917	DF	On-Demand	Anodyne	ACAT	45	36
Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)c(O)n1	ZINC000450585918	DF	On-Demand	Anodyne	ACAT	45	36
COCC(=O)N1CCc2c(NC(=O)c3cccc(SC)c3)cccc21	ZINC000450585928	FG	On-Demand	Anodyne	DRD4	41	33
O=C(c1ccc2cnccc2c1)N1CCN2CCOC[C@@H]2C1	ZINC000450585929	CD	On-Demand	Anodyne	L3MBTL1	0	43
O=C(c1ccc2cnccc2c1)N1CCN2CCOC[C@@H]2C1	ZINC000450585929	CD	On-Demand	Anodyne	L3MBTL3	41	33
O=C(c1ccc2cnccc2c1)N1CCN2CCOC[C@H]2C1	ZINC000450585930	CD	On-Demand	Anodyne	L3MBTL1	0	43
O=C(c1ccc2cnccc2c1)N1CCN2CCOC[C@H]2C1	ZINC000450585930	CD	On-Demand	Anodyne	L3MBTL3	41	33
COc1ccc([C@@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585937	FG	On-Demand	Anodyne	ACACA	42	42
COc1ccc([C@@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585937	FG	On-Demand	Anodyne	ACACB	19	43
COc1ccc([C@@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585937	FG	On-Demand	Anodyne	MTNR1A	49	45
COc1ccc([C@@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585937	FG	On-Demand	Anodyne	MTNR1B	45	45
COc1ccc([C@@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585937	FG	On-Demand	Anodyne	GPR88	0	40
COc1ccc([C@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585938	FG	On-Demand	Anodyne	ACACA	42	42
COc1ccc([C@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585938	FG	On-Demand	Anodyne	ACACB	19	43
COc1ccc([C@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585938	FG	On-Demand	Anodyne	MTNR1A	49	45
COc1ccc([C@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585938	FG	On-Demand	Anodyne	MTNR1B	45	45
COc1ccc([C@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585938	FG	On-Demand	Anodyne	GPR88	0	40
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585939	FG	On-Demand	Anodyne	ACACA	42	42
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585939	FG	On-Demand	Anodyne	ACACB	19	43
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585939	FG	On-Demand	Anodyne	MTNR1A	49	45
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585939	FG	On-Demand	Anodyne	MTNR1B	45	45
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585939	FG	On-Demand	Anodyne	GPR88	0	40
COc1ccc([C@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585940	FG	On-Demand	Anodyne	ACACA	42	42
COc1ccc([C@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585940	FG	On-Demand	Anodyne	ACACB	19	43
COc1ccc([C@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585940	FG	On-Demand	Anodyne	MTNR1A	49	45
COc1ccc([C@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585940	FG	On-Demand	Anodyne	MTNR1B	45	45
COc1ccc([C@H](OC)[C@H](C)NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450585940	FG	On-Demand	Anodyne	GPR88	0	40
CCC(=O)CCCN(CC(=O)Nc1ccc(F)cc1)C(C)(C)C	ZINC000450585957	DH	On-Demand	Anodyne	LTA4H	17	43
Cc1cccc(Cl)c1C(=O)NCC(C)(C)CCCO	ZINC000450585990	CG	On-Demand	Anodyne	E3UJZ5_SPOLI	45	39
CCC[C@@H]1CCCCN1C(=O)c1cc(OCC)no1	ZINC000450586061	CF	On-Demand	Anodyne	COLA	53	33
CCC[C@H]1CCCCN1C(=O)c1cc(OCC)no1	ZINC000450586062	CF	On-Demand	Anodyne	COLA	53	33
CNC(=O)c1ccc(NCc2cc(C3CC3)ccc2F)c([N+](=O)[O-])c1	ZINC000450586064	EH	On-Demand	Bother	TAAR1	17	41
CCC[C@@H](CNc1cc(N2CCC[C@H](CO)C2)ncn1)OC	ZINC000450586077	DD	On-Demand	Anodyne	PRCP	0	42
CCC[C@@H](CNc1cc(N2CCC[C@@H](CO)C2)ncn1)OC	ZINC000450586079	DD	On-Demand	Anodyne	PRCP	0	42
CCC[C@H](CNc1cc(N2CCC[C@H](CO)C2)ncn1)OC	ZINC000450586080	DD	On-Demand	Anodyne	PRCP	0	42
CCC[C@H](CNc1cc(N2CCC[C@@H](CO)C2)ncn1)OC	ZINC000450586081	DD	On-Demand	Anodyne	PRCP	0	42
COC(=O)c1sc(NC(=O)c2ccc(C#N)o2)nc1C1CCCC1	ZINC000450586091	EG	On-Demand	Mild	CSF1R	24	40
C[C@H](CNC(=O)CCc1ccc2ccccc2c1O)c1nccs1	ZINC000450586145	EH	On-Demand	Anodyne	SUCNR1	48	36
C[C@@H](CNC(=O)CCc1ccc2ccccc2c1O)c1nccs1	ZINC000450586146	EH	On-Demand	Anodyne	SUCNR1	48	36
CCc1cc(CCCN2CCc3ccc(F)cc3C2)on1	ZINC000450586153	CG	On-Demand	Anodyne	CHRNA6	0	40
COC(=O)c1cccc(CN2CCN(c3nc(C)cc(C)n3)CC2)c1Cl	ZINC000450586183	FF	On-Demand	Anodyne	HTR1A	25	40
COC(=O)c1cccc(CN2CCN(c3nc(C)cc(C)n3)CC2)c1Cl	ZINC000450586183	FF	On-Demand	Anodyne	HTR7	24	40
O=C1C(=O)N(C2CCCC2)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450586190	DF	On-Demand	Anodyne	CACNA1C	40	56
O=C1C(=O)N(C2CCCC2)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450586190	DF	On-Demand	Anodyne	CACNA1D	112	56
CCc1cc(NCC[C@@](C)(O)COC)n2ncnc2n1	ZINC000450586203	CC	On-Demand	Anodyne	DHOD	0	52
CCc1cc(NCC[C@](C)(O)COC)n2ncnc2n1	ZINC000450586204	CC	On-Demand	Anodyne	DHOD	0	52
CCCCn1cc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)c(C)n1	ZINC000450586205	GG	On-Demand	Anodyne	P2RX7	54	40
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450586208	FD	On-Demand	Anodyne	MTNR1B	27	41
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450586209	FD	On-Demand	Anodyne	MTNR1B	27	41
O=C(CCCC(=O)C1CC1)Nc1cccc(-n2cnnc2O)c1	ZINC000450586214	DE	On-Demand	Anodyne	PARP10	0	40
CCO[C@@H]1COCC[C@@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450586217	DE	On-Demand	Anodyne	CCR2	21	42
CCO[C@H]1COCC[C@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450586218	DE	On-Demand	Anodyne	CCR2	21	42
CCO[C@@H]1COCC[C@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450586219	DE	On-Demand	Anodyne	CCR2	21	42
CCO[C@H]1COCC[C@@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450586220	DE	On-Demand	Anodyne	CCR2	21	42
C[C@@H]1N(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC12CCOCC2	ZINC000450586235	FI	On-Demand	Anodyne	PRCP	53	35
C[C@@H]1N(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC12CCOCC2	ZINC000450586236	FI	On-Demand	Anodyne	PRCP	53	35
C[C@@H]1N(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC12CCOCC2	ZINC000450586237	FI	On-Demand	Anodyne	PRCP	53	35
C[C@@H]1N(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC12CCOCC2	ZINC000450586238	FI	On-Demand	Anodyne	PRCP	53	35
COc1cc(NC2CCN(Cc3cn(CC4CC4)nn3)CC2)cc(OC)c1	ZINC000450586264	FF	On-Demand	Anodyne	SSTR5	65	37
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	DRD2	22	42
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	DRD4	42	40
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	ACHE	29	45
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	HRH1	16	40
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	DRD3	0	44
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	KCNH2	17	48
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	LTA4H	32	41
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	HRH3	17	40
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	SIGMAR1	43	47
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	SSTR5	76	43
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	CHEK2	22	41
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	CCR3	60	40
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	UTS2R	20	42
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	MLNR	52	41
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	CCR2	16	41
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	SLC6A5	28	40
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	PDK1	50	39
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	MCHR1	64	58
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	CACNA1G	27	41
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	CCR8	26	43
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	NOD1	26	41
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	NOD2	41	41
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	ADIPOR1	0	41
COc1cc(NC2CCN(Cc3ccc(C(C)=O)cc3)CC2)cc(OC)c1	ZINC000450586271	FH	On-Demand	Anodyne	ADIPOR2	0	41
CC(C)[C@@H]1OCCC[C@H]1Nc1ccnc(N[C@@H](CO)c2ccc(F)cc2)n1	ZINC000450586281	FF	On-Demand	Anodyne	NTRK1	15	41
CC(C)[C@@H]1OCCC[C@H]1Nc1ccnc(N[C@H](CO)c2ccc(F)cc2)n1	ZINC000450586283	FF	On-Demand	Anodyne	NTRK1	15	41
CC(C)[C@@H]1OCCC[C@@H]1Nc1ccnc(N[C@@H](CO)c2ccc(F)cc2)n1	ZINC000450586285	FF	On-Demand	Anodyne	NTRK1	15	41
CC(C)[C@@H]1OCCC[C@@H]1Nc1ccnc(N[C@H](CO)c2ccc(F)cc2)n1	ZINC000450586286	FF	On-Demand	Anodyne	NTRK1	15	41
CCCOc1ccc(OCc2cn(C)nc2C)cc1	ZINC000450586310	CG	On-Demand	Anodyne	CYP2C19	15	42
CCN(CC)S(=O)(=O)c1ccc(OCC[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000450586326	ED	On-Demand	Bother	BDKRB1	17	40
CCN(CC)S(=O)(=O)c1ccc(OCC[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000450586326	ED	On-Demand	Bother	COLA	48	33
CCN(CC)S(=O)(=O)c1ccc(OCC[C@H](C)O)c([N+](=O)[O-])c1	ZINC000450586328	ED	On-Demand	Bother	BDKRB1	17	40
CCN(CC)S(=O)(=O)c1ccc(OCC[C@H](C)O)c([N+](=O)[O-])c1	ZINC000450586328	ED	On-Demand	Bother	COLA	48	33
CCOC1(C)CN(c2ncccc2C(F)(F)F)C1	ZINC000450586329	CF	On-Demand	Anodyne	TRPV1	28	41
COC[C@@](C)(O)CCNc1ccnc2cc(Cl)ccc12	ZINC000450586335	CG	On-Demand	Anodyne	HRP1_PLAFA	124	46
COC[C@@](C)(O)CCNc1ccnc2cc(Cl)ccc12	ZINC000450586335	CG	On-Demand	Anodyne	HNMT	74	49
COC[C@@](C)(O)CCNc1ccnc2cc(Cl)ccc12	ZINC000450586335	CG	On-Demand	Anodyne	BOTA	44	57
COC[C@@](C)(O)CCNc1ccnc2cc(Cl)ccc12	ZINC000450586335	CG	On-Demand	Anodyne	RBP_CHICK	0	43
COC[C@](C)(O)CCNc1ccnc2cc(Cl)ccc12	ZINC000450586337	CG	On-Demand	Anodyne	HRP1_PLAFA	124	46
COC[C@](C)(O)CCNc1ccnc2cc(Cl)ccc12	ZINC000450586337	CG	On-Demand	Anodyne	HNMT	74	49
COC[C@](C)(O)CCNc1ccnc2cc(Cl)ccc12	ZINC000450586337	CG	On-Demand	Anodyne	BOTA	44	57
COC[C@](C)(O)CCNc1ccnc2cc(Cl)ccc12	ZINC000450586337	CG	On-Demand	Anodyne	RBP_CHICK	0	43
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CC[C@H]1CCOC1	ZINC000450586363	EE	On-Demand	Anodyne	L3MBTL3	40	34
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)CC[C@@H]1CCOC1	ZINC000450586367	EE	On-Demand	Anodyne	L3MBTL3	40	34
CCOC1(C)CN(c2cnn(-c3cccc(C(F)(F)F)c3)c(=O)c2Cl)C1	ZINC000450586369	GH	On-Demand	Anodyne	GALR3	54	32
COc1ccc(-c2csc3ncnc(N4CC5(CC5)C4)c23)cc1	ZINC000450586371	DH	On-Demand	Anodyne	ADRB3	0	46
CC(=O)c1cn(CC(=O)NCc2ccc(Cl)c(C)c2)nn1	ZINC000450586403	DD	On-Demand	Anodyne	P2RX7	15	42
CC(C)CCCC(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450586420	BE	On-Demand	Anodyne	PREP	22	40
CC(C)CCCC(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450586421	BE	On-Demand	Anodyne	PREP	22	40
CC(C)CCCC(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450586422	BE	On-Demand	Anodyne	PREP	22	40
CC(C)CCCC(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450586423	BE	On-Demand	Anodyne	PREP	22	40
CCc1nc2ccccc2n1C1CCN(C(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000450586425	GJ	On-Demand	Anodyne	CCR5	19	45
CCc1nc2ccccc2n1C1CCN(C(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000450586425	GJ	On-Demand	Anodyne	FPR2	36	53
O=C(c1cccc2c1CCCC2)N1CCN2CCOC[C@@H]2C1	ZINC000450586428	DD	On-Demand	Anodyne	L3MBTL3	43	37
O=C(c1cccc2c1CCCC2)N1CCN2CCOC[C@H]2C1	ZINC000450586429	DD	On-Demand	Anodyne	L3MBTL3	43	37
Cc1csc([C@@H](C)CNC(=O)c2ccc(C(F)(F)F)cc2C)n1	ZINC000450586430	EI	On-Demand	Anodyne	SORT1	16	42
Cc1csc([C@H](C)CNC(=O)c2ccc(C(F)(F)F)cc2C)n1	ZINC000450586431	EI	On-Demand	Anodyne	SORT1	16	42
CC[C@@H]1CC[C@@H](C)N1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450586437	DG	On-Demand	Anodyne	CACNA1I	15	42
CC[C@H]1CC[C@H](C)N1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450586438	DG	On-Demand	Anodyne	CACNA1I	15	42
CC[C@H]1CC[C@@H](C)N1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450586439	DG	On-Demand	Anodyne	CACNA1I	15	42
CC[C@@H]1CC[C@H](C)N1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450586440	DG	On-Demand	Anodyne	CACNA1I	15	42
CC(C)NS(=O)(=O)[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450586464	DE	On-Demand	Anodyne	SLC6A1	44	33
CC(C)NS(=O)(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450586465	DE	On-Demand	Anodyne	SLC6A1	44	33
CC(C)NS(=O)(=O)[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450586466	DE	On-Demand	Anodyne	SLC6A1	44	33
CC(C)NS(=O)(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450586467	DE	On-Demand	Anodyne	SLC6A1	44	33
Cc1cccc(Cl)c1CN1C(=O)N[C@]2(CCOc3ccccc32)C1=O	ZINC000450586497	FG	On-Demand	Anodyne	AKR1B1	0	46
CC(C)NS(=O)(=O)[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450586501	FF	On-Demand	Anodyne	BIRC2	72	34
Cc1cccc(Cl)c1CN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O	ZINC000450586502	FG	On-Demand	Anodyne	AKR1B1	0	46
CC(C)NS(=O)(=O)[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450586503	FF	On-Demand	Anodyne	BIRC2	72	34
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450586519	GH	On-Demand	Anodyne	CACNA1B	42	35
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450586519	GH	On-Demand	Anodyne	CPT1A	23	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450586519	GH	On-Demand	Anodyne	SORT1	16	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450586519	GH	On-Demand	Anodyne	MTTP	41	38
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450586519	GH	On-Demand	Anodyne	CCR8	40	30
CC[C@@H](O)CC(=O)NCCOCc1ccc(OC)cc1	ZINC000450586520	CD	On-Demand	Anodyne	MTNR1A	45	36
CC[C@H](O)CC(=O)NCCOCc1ccc(OC)cc1	ZINC000450586521	CD	On-Demand	Anodyne	MTNR1A	45	36
CCOc1ccc2c(c1)CCN(Cc1nc(C(=O)OC)cs1)C2	ZINC000450586533	EF	On-Demand	Anodyne	ABCB1	22	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](CCO)C(C)(C)C)cc2)c1	ZINC000450586545	GG	On-Demand	Anodyne	CTRB_BOVIN	48	36
Cc1ccc(C(=O)N2CCN3CCOC[C@@H]3C2)c2c1CCC2	ZINC000450586549	DD	On-Demand	Anodyne	L3MBTL3	54	35
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](CCO)C(C)(C)C)cc2)c1	ZINC000450586550	GG	On-Demand	Anodyne	CTRB_BOVIN	48	36
CC(=O)NC[C@H](CC(=O)N[C@@H](CCO)C(C)(C)C)CC(C)C	ZINC000450586559	DE	On-Demand	Anodyne	PGA	43	34
CC(=O)NC[C@H](CC(=O)N[C@H](CCO)C(C)(C)C)CC(C)C	ZINC000450586560	DE	On-Demand	Anodyne	PGA	43	34
CCC[C@H]1CCCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450586561	DH	On-Demand	Anodyne	OPRK1	0	41
CCC[C@H]1CCCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450586561	DH	On-Demand	Anodyne	COLA	45	32
CCC[C@@H]1CCCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450586562	DH	On-Demand	Anodyne	OPRK1	0	41
CCC[C@@H]1CCCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450586562	DH	On-Demand	Anodyne	COLA	45	32
Cc1ccc(C(=O)N2CCN3CCOC[C@H]3C2)c2c1CCC2	ZINC000450586564	DD	On-Demand	Anodyne	L3MBTL3	54	35
CCOC(=O)c1cc(C(=O)Nc2nc(C3CCCC3)c(C(=O)OC)s2)on1	ZINC000450586575	GG	On-Demand	Anodyne	DHODH	21	48
COc1cc(CN2CCC[C@H](c3nncn3C(C)C)C2)ccc1Cl	ZINC000450586589	EH	On-Demand	Anodyne	SSTR5	42	36
COc1cc(CN2CCC[C@@H](c3nncn3C(C)C)C2)ccc1Cl	ZINC000450586591	EH	On-Demand	Anodyne	SSTR5	42	36
CC(C)(C(=O)N1CCO[C@H](CCc2ccccc2)C1)C1CCC1	ZINC000450586604	DH	On-Demand	Anodyne	SLC18A2	44	41
CC(C)(C(=O)N1CCO[C@@H](CCc2ccccc2)C1)C1CCC1	ZINC000450586605	DH	On-Demand	Anodyne	SLC18A2	44	41
CCS(=O)(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586609	FG	On-Demand	Anodyne	DRD2	0	43
CCS(=O)(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586609	FG	On-Demand	Anodyne	ACHE	25	41
CCS(=O)(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586609	FG	On-Demand	Anodyne	SIGMAR1	53	43
CCS(=O)(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586609	FG	On-Demand	Anodyne	CCR5	56	37
CCS(=O)(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586609	FG	On-Demand	Anodyne	LSS	15	41
CCS(=O)(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586609	FG	On-Demand	Anodyne	RORC	25	40
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586610	FG	On-Demand	Anodyne	DRD2	0	43
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586610	FG	On-Demand	Anodyne	ACHE	25	41
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586610	FG	On-Demand	Anodyne	SIGMAR1	53	43
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586610	FG	On-Demand	Anodyne	CCR5	56	37
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586610	FG	On-Demand	Anodyne	LSS	15	41
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000450586610	FG	On-Demand	Anodyne	RORC	25	40
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	HTR1A	76	42
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	DRD2	70	44
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	DRD1	29	43
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	DRD4	37	44
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	ADRA1D	58	47
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	HTR2A	31	44
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	ADRA1A	45	42
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	ADRA1B	33	47
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	DRD3	61	39
COCCOc1ccccc1N1CCN(Cc2cnns2)CC1	ZINC000450586614	ED	On-Demand	Anodyne	HTR7	51	42
COC(=O)c1coc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450586615	EE	On-Demand	Anodyne	DRD4	34	40
COC(=O)c1coc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450586615	EE	On-Demand	Anodyne	SIGMAR1	45	41
COC(=O)c1coc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450586616	EE	On-Demand	Anodyne	DRD4	34	40
COC(=O)c1coc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450586616	EE	On-Demand	Anodyne	SIGMAR1	45	41
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	HTR1A	83	41
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	DRD2	69	49
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	DRD1	25	41
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	DRD4	43	45
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	ADRA1D	47	38
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	HTR2A	24	45
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	ADRA1A	46	38
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	DRD3	69	49
COCCOc1ccccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450586619	GF	On-Demand	Anodyne	HTR7	42	44
COC[C@@](C)(O)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450586647	EC	On-Demand	Anodyne	CA2	49	51
COC[C@@](C)(O)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450586647	EC	On-Demand	Anodyne	CA1	44	38
COC[C@@](C)(O)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450586647	EC	On-Demand	Anodyne	CA4	43	38
COC[C@](C)(O)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450586648	EC	On-Demand	Anodyne	CA2	49	51
COC[C@](C)(O)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450586648	EC	On-Demand	Anodyne	CA1	44	38
COC[C@](C)(O)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450586648	EC	On-Demand	Anodyne	CA4	43	38
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1n1ccnc1	ZINC000450586673	GI	On-Demand	Anodyne	CYP2J2	53	38
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1n1ccnc1	ZINC000450586674	GI	On-Demand	Anodyne	CYP2J2	53	38
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1n1ccnc1	ZINC000450586675	GI	On-Demand	Anodyne	CYP2J2	53	38
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1n1ccnc1	ZINC000450586676	GI	On-Demand	Anodyne	CYP2J2	53	38
COC(=O)C1(CSc2nc3cc(Cl)cnc3[nH]2)CCCC1	ZINC000450586677	EG	On-Demand	Anodyne	ENPP1	41	33
Cc1nn(C)cc1CSc1nc2cc(Cl)cnc2[nH]1	ZINC000450586703	CF	On-Demand	Anodyne	ENPP1	24	45
CCCCn1cc(CNC(=O)c2c(C)cccc2Cl)c(C)n1	ZINC000450586713	DH	On-Demand	Anodyne	P2RX7	33	43
COc1cc(NC(=O)CN(C)CCCC(=O)c2ccccc2)cc(OC)c1	ZINC000450586729	FG	On-Demand	Anodyne	LTA4H	35	48
COc1cc(NC(=O)CN(C)CCCC(=O)c2ccccc2)cc(OC)c1	ZINC000450586729	FG	On-Demand	Anodyne	SLC6A9	22	41
CS(=O)(=O)CC1CCC(Nc2cc(N3CCCC3)ncn2)CC1	ZINC000450586739	EE	On-Demand	Anodyne	HRH4	19	40
CNC(=O)c1ccc(N2CC3(CC3)C2)c([N+](=O)[O-])c1	ZINC000450586740	CD	On-Demand	Bother	TAAR1	19	46
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	HTR1A	71	67
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	THRA	0	41
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	CHRM1	18	48
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	DRD2	78	52
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	DRD1	31	48
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	DRD4	68	52
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	ACHE	26	42
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	ADRA1D	36	48
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	HTR2A	49	49
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	HTR2C	31	52
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	SLC6A1	51	35
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	ADRA1A	44	39
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	HRH1	24	48
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	ADRA1B	37	48
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	DRD3	77	49
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	HTR4	65	38
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	LTA4H	20	43
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	HTR7	89	53
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	TACR2	16	48
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	SIGMAR1	62	48
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	SSTR5	31	40
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	CCR3	49	46
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	FLT1	0	40
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	EBP	40	46
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	PDGFRA	24	40
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	MCHR1	46	54
COc1cc(NC2CCN(CCCC(=O)c3ccccc3)CC2)cc(OC)c1	ZINC000450586741	GI	On-Demand	Anodyne	CYP2J2	66	47
Clc1ccc(CCN2CCC(c3cnc[nH]3)CC2)cc1	ZINC000450586757	CG	On-Demand	Anodyne	SIGMAR1	21	46
C[C@@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1	ZINC000450586788	FH	On-Demand	Anodyne	TBXA2R	31	52
C[C@@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1	ZINC000450586788	FH	On-Demand	Anodyne	ALOX5AP	42	36
C[C@@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1	ZINC000450586788	FH	On-Demand	Anodyne	PTGDR2	20	44
C[C@@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1	ZINC000450586788	FH	On-Demand	Anodyne	PTGES2	63	35
CN(C(=O)c1cc(C2CC2)[nH]n1)[C@H](C(N)=O)c1cccc(Br)c1	ZINC000450586789	GE	On-Demand	Anodyne	CDK2	0	46
CN(C(=O)c1cc(C2CC2)[nH]n1)[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000450586790	GE	On-Demand	Anodyne	CDK2	0	46
C[C@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1	ZINC000450586793	FH	On-Demand	Anodyne	TBXA2R	31	52
C[C@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1	ZINC000450586793	FH	On-Demand	Anodyne	ALOX5AP	42	36
C[C@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1	ZINC000450586793	FH	On-Demand	Anodyne	PTGDR2	20	44
C[C@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1	ZINC000450586793	FH	On-Demand	Anodyne	PTGES2	63	35
CCC[C@@H]1CCCCN1C(=O)c1ccsc1C	ZINC000450586809	CH	On-Demand	Anodyne	HCRTR1	23	43
CCC[C@@H]1CCCCN1C(=O)c1ccsc1C	ZINC000450586809	CH	On-Demand	Anodyne	HCRTR2	16	43
C[C@@](NCc1nnc(C2CC2)s1)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450586813	FF	On-Demand	Anodyne	CCR2	47	36
C[C@](NCc1nnc(C2CC2)s1)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000450586814	FF	On-Demand	Anodyne	CCR2	47	36
CCC[C@H]1CCCCN1C(=O)c1ccsc1C	ZINC000450586818	CH	On-Demand	Anodyne	HCRTR1	23	43
CCC[C@H]1CCCCN1C(=O)c1ccsc1C	ZINC000450586818	CH	On-Demand	Anodyne	HCRTR2	16	43
O=C(CCC(=O)N1CCO[C@@H](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1	ZINC000450586820	GG	On-Demand	Bother	IRAK4	22	41
O=C(CCC(=O)N1CCO[C@H](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1	ZINC000450586821	GG	On-Demand	Bother	IRAK4	22	41
CC(C)OCCNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450586826	ED	On-Demand	Anodyne	E1	0	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCO[C@@H](CCc2ccccc2)C1	ZINC000450586845	GG	On-Demand	Anodyne	PDEC	0	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCO[C@H](CCc2ccccc2)C1	ZINC000450586846	GG	On-Demand	Anodyne	PDEC	0	44
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCO[C@@H](CCc2ccccc2)C1	ZINC000450586847	GG	On-Demand	Anodyne	PDEC	0	44
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCO[C@H](CCc2ccccc2)C1	ZINC000450586848	GG	On-Demand	Anodyne	PDEC	0	44
CC[C@](C)(NCCCCc1ccc(Cl)c(Cl)c1)C(N)=O	ZINC000450586853	DH	On-Demand	Anodyne	SCNN1A	56	33
CC[C@@](C)(NCCCCc1ccc(Cl)c(Cl)c1)C(N)=O	ZINC000450586854	DH	On-Demand	Anodyne	SCNN1A	56	33
CCN1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1=O	ZINC000450586863	GE	On-Demand	Anodyne	CHRM3	15	45
C[C@@H]1CCO[C@@H]1C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450586871	EC	On-Demand	Bother	SLC27A4	42	31
Cn1c(SC[C@@H]2CCCC2(F)F)nnc1-c1ccccc1Cl	ZINC000450586903	EJ	On-Demand	Anodyne	HSD11B1	20	43
Cn1c(SC[C@H]2CCCC2(F)F)nnc1-c1ccccc1Cl	ZINC000450586906	EJ	On-Demand	Anodyne	HSD11B1	20	43
COc1cc(CC(=O)NC[C@H](C)c2nccs2)ccc1Cl	ZINC000450586912	DG	On-Demand	Anodyne	TRPV1	15	40
COc1cc(CC(=O)NC[C@H](C)c2nccs2)ccc1Cl	ZINC000450586912	DG	On-Demand	Anodyne	MAP1	41	34
COc1cc(CC(=O)NC[C@H](C)c2nccs2)ccc1Cl	ZINC000450586912	DG	On-Demand	Anodyne	NCE103	25	42
COc1cc(CC(=O)NC[C@H](C)c2nccs2)ccc1Cl	ZINC000450586912	DG	On-Demand	Anodyne	PFK	0	40
COc1cc(CC(=O)NC[C@H](C)c2nccs2)ccc1Cl	ZINC000450586912	DG	On-Demand	Anodyne	P96878_MYCTU	16	42
COc1cc(CC(=O)NC[C@H](C)c2nccs2)ccc1Cl	ZINC000450586912	DG	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)NC[C@@H](C)c2nccs2)ccc1Cl	ZINC000450586914	DG	On-Demand	Anodyne	TRPV1	15	40
COc1cc(CC(=O)NC[C@@H](C)c2nccs2)ccc1Cl	ZINC000450586914	DG	On-Demand	Anodyne	MAP1	41	34
COc1cc(CC(=O)NC[C@@H](C)c2nccs2)ccc1Cl	ZINC000450586914	DG	On-Demand	Anodyne	NCE103	25	42
COc1cc(CC(=O)NC[C@@H](C)c2nccs2)ccc1Cl	ZINC000450586914	DG	On-Demand	Anodyne	PFK	0	40
COc1cc(CC(=O)NC[C@@H](C)c2nccs2)ccc1Cl	ZINC000450586914	DG	On-Demand	Anodyne	P96878_MYCTU	16	42
COc1cc(CC(=O)NC[C@@H](C)c2nccs2)ccc1Cl	ZINC000450586914	DG	On-Demand	Anodyne	CAN2	0	42
CS(=O)(=O)CC1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450586916	DD	On-Demand	Anodyne	JAK1	76	40
CS(=O)(=O)CC1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450586916	DD	On-Demand	Anodyne	JAK2	24	48
CN(CCCC(=O)c1ccccc1)Cc1nc(-c2cccnc2)no1	ZINC000450586932	EG	On-Demand	Anodyne	TSPO	15	46
CCC[C@@H]1CCCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450586936	CH	On-Demand	Anodyne	PREP	15	40
CCN1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC1=O	ZINC000450586940	FD	On-Demand	Anodyne	TRPC6	83	43
CCN1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC1=O	ZINC000450586940	FD	On-Demand	Anodyne	TRPC3	61	43
CC(=O)N[C@H](C(=O)N1CCO[C@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586959	EE	On-Demand	Anodyne	GHRHR	43	37
CC(=O)N[C@H](C(=O)N1CCO[C@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586959	EE	On-Demand	Anodyne	GAG-PRO	62	36
CC(=O)N[C@H](C(=O)N1CCO[C@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586959	EE	On-Demand	Anodyne	BIRC2	37	40
CC(=O)N[C@H](C(=O)N1CCO[C@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586959	EE	On-Demand	Anodyne	Q82323_9DELA	65	31
CC(=O)N[C@H](C(=O)N1CCO[C@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586959	EE	On-Demand	Anodyne	VHL	42	34
CC(=O)N[C@H](C(=O)N1CCO[C@@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586963	EE	On-Demand	Anodyne	GHRHR	43	37
CC(=O)N[C@H](C(=O)N1CCO[C@@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586963	EE	On-Demand	Anodyne	GAG-PRO	62	36
CC(=O)N[C@H](C(=O)N1CCO[C@@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586963	EE	On-Demand	Anodyne	BIRC2	37	40
CC(=O)N[C@H](C(=O)N1CCO[C@@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586963	EE	On-Demand	Anodyne	Q82323_9DELA	65	31
CC(=O)N[C@H](C(=O)N1CCO[C@@H](CCc2ccccc2)C1)C(C)(C)C	ZINC000450586963	EE	On-Demand	Anodyne	VHL	42	34
CCN(CC(F)F)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450586990	FH	On-Demand	Anodyne	PDGFRB	0	44
CCN(CC(F)F)C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450586990	FH	On-Demand	Anodyne	HPGD	49	60
Cc1csc([C@H](C)CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)n1	ZINC000450586998	GI	On-Demand	Anodyne	PYGL	49	36
Cc1csc([C@@H](C)CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)n1	ZINC000450587000	GI	On-Demand	Anodyne	PYGL	49	36
CO[C@@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587002	DH	On-Demand	Anodyne	PPARA	21	40
CO[C@@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587002	DH	On-Demand	Anodyne	MME	60	46
CO[C@@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587002	DH	On-Demand	Anodyne	TIMP3	40	35
CO[C@@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587002	DH	On-Demand	Anodyne	ACE2	43	32
CO[C@@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587002	DH	On-Demand	Anodyne	AMP1_PLAFQ	61	44
CO[C@@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587002	DH	On-Demand	Anodyne	PDS	45	36
CO[C@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587003	DH	On-Demand	Anodyne	PPARA	21	40
CO[C@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587003	DH	On-Demand	Anodyne	MME	60	46
CO[C@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587003	DH	On-Demand	Anodyne	TIMP3	40	35
CO[C@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587003	DH	On-Demand	Anodyne	ACE2	43	32
CO[C@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587003	DH	On-Demand	Anodyne	AMP1_PLAFQ	61	44
CO[C@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)c(C)c1	ZINC000450587003	DH	On-Demand	Anodyne	PDS	45	36
COC1CCC(CCNC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450587009	FI	On-Demand	Anodyne	MAPK14	21	43
COC1CCC(CCNC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450587009	FI	On-Demand	Anodyne	MAPK13	42	31
COC1CCC(CCNC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450587009	FI	On-Demand	Anodyne	HSPB1	0	40
CCOc1ccc2c(c1)CCN(CC1CCC(=O)CC1)C2	ZINC000450587010	CG	On-Demand	Anodyne	HRH3	21	57
CCOc1ccc2c(c1)CCN(CC1CCC(=O)CC1)C2	ZINC000450587010	CG	On-Demand	Anodyne	SIGMAR1	17	43
Cc1cnc([C@@H](C)CNC(=O)c2ccc(C(F)(F)F)cc2C)s1	ZINC000450587017	EI	On-Demand	Anodyne	PPARD	30	40
Cc1cnc([C@H](C)CNC(=O)c2ccc(C(F)(F)F)cc2C)s1	ZINC000450587020	EI	On-Demand	Anodyne	PPARD	30	40
CN(Cc1nnc(C2CC2)s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450587047	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
CN(Cc1nnc(C2CC2)s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450587047	EG	On-Demand	Anodyne	SIGMAR1	34	41
CN(Cc1nnc(C2CC2)s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450587049	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
CN(Cc1nnc(C2CC2)s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450587049	EG	On-Demand	Anodyne	SIGMAR1	34	41
CC(=O)c1ccc(NCc2cc(C3CC3)ccc2F)nc1	ZINC000450587077	CH	On-Demand	Anodyne	BDKRB1	23	41
C[C@@H](Oc1ccccn1)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450587079	GD	On-Demand	Bother	COLA	75	40
C[C@@H](Oc1ccccn1)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450587079	GD	On-Demand	Bother	MMP8	20	41
C[C@H](Oc1ccccn1)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450587080	GD	On-Demand	Bother	COLA	75	40
C[C@H](Oc1ccccn1)C(=O)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450587080	GD	On-Demand	Bother	MMP8	20	41
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	HTR1A	91	44
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	DRD2	68	48
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	DRD4	42	48
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	ADRA1D	55	44
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	HTR2A	27	40
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	ADRA1A	53	44
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	ADRA1B	43	44
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	DRD3	69	41
COCCOc1ccccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587084	EE	On-Demand	Anodyne	HTR7	47	41
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	HTR1A	91	44
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	DRD2	68	48
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	DRD4	42	48
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	ADRA1D	55	44
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	HTR2A	27	40
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	ADRA1A	53	44
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	ADRA1B	43	44
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	DRD3	69	41
COCCOc1ccccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450587086	EE	On-Demand	Anodyne	HTR7	47	41
COc1nccc(CNc2nc3ccccc3nc2N2CCOCC2)n1	ZINC000450587140	FD	On-Demand	Anodyne	EPHB4	61	36
COc1nccc(CNc2nc3ccccc3nc2N2CCN(C)CC2)n1	ZINC000450587167	FD	On-Demand	Anodyne	HRH4	30	42
COc1ccc(Oc2ccc(C(=O)NCCOC(C)C)nc2)cc1	ZINC000450587169	EG	On-Demand	Anodyne	ACACA	64	39
CC(C)OCCNC(=O)c1ccc2cnccc2c1	ZINC000450587170	CE	On-Demand	Anodyne	DRD4	42	32
CC(C)OCCNC(=O)c1ccc2cnccc2c1	ZINC000450587170	CE	On-Demand	Anodyne	AKT1	24	47
CC(C)OCCNC(=O)c1ccc2cnccc2c1	ZINC000450587170	CE	On-Demand	Anodyne	CYP17A1	0	41
CCC[C@H](O)CN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450587203	ED	On-Demand	Anodyne	ADRB2	0	45
CCC[C@H](O)CN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450587203	ED	On-Demand	Anodyne	ADRB3	31	45
CCC[C@@H](O)CN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450587204	ED	On-Demand	Anodyne	ADRB2	0	45
CCC[C@@H](O)CN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450587204	ED	On-Demand	Anodyne	ADRB3	31	45
CCC[C@H](O)CN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450587205	ED	On-Demand	Anodyne	ADRB2	0	45
CCC[C@H](O)CN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450587205	ED	On-Demand	Anodyne	ADRB3	31	45
CCC[C@@H](O)CN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450587206	ED	On-Demand	Anodyne	ADRB2	0	45
CCC[C@@H](O)CN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450587206	ED	On-Demand	Anodyne	ADRB3	31	45
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450587240	EE	On-Demand	Anodyne	PPARD	26	43
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450587240	EE	On-Demand	Anodyne	CCR2	33	40
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450587241	EE	On-Demand	Anodyne	PPARD	26	43
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450587241	EE	On-Demand	Anodyne	CCR2	33	40
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450587276	GH	On-Demand	Anodyne	CA2	36	42
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450587276	GH	On-Demand	Anodyne	CA1	30	42
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450587276	GH	On-Demand	Anodyne	CA7	21	45
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450587276	GH	On-Demand	Anodyne	CA14	20	40
CCCOc1cccc(Cn2cc(S(=O)(=O)N(CC)CC)ccc2=O)c1	ZINC000450587284	GF	On-Demand	Anodyne	UPP1	45	40
CCCOc1cccc(Cn2cc(S(=O)(=O)N(CC)CC)ccc2=O)c1	ZINC000450587284	GF	On-Demand	Anodyne	SQLE	50	34
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc(I)cc1F	ZINC000450587287	GD	On-Demand	Anodyne	MAP2K1	40	34
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc(I)cc1F	ZINC000450587288	GD	On-Demand	Anodyne	MAP2K1	40	34
CCOC(=O)[C@@](C)(O)CNC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450587320	EC	On-Demand	Anodyne	DRD4	42	34
CCOC(=O)[C@](C)(O)CNC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450587321	EC	On-Demand	Anodyne	DRD4	42	34
COc1nccc(CN(C)c2ccc(C(=O)N3CCOCC3)cc2C)n1	ZINC000450587324	FD	On-Demand	Anodyne	EPHB4	49	34
CS(=O)(=O)CC1CCC(Nc2nc3c(F)cccc3o2)CC1	ZINC000450587330	EE	On-Demand	Anodyne	SSTR5	43	37
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450587331	DE	On-Demand	Anodyne	ACE	53	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450587331	DE	On-Demand	Anodyne	FKBP1A	49	38
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450587331	DE	On-Demand	Anodyne	SLC18A2	40	37
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450587331	DE	On-Demand	Anodyne	MME	15	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450587331	DE	On-Demand	Anodyne	PREP	70	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450587331	DE	On-Demand	Anodyne	AMY2	44	30
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450587331	DE	On-Demand	Anodyne	ACE2	29	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@H]1CO	ZINC000450587331	DE	On-Demand	Anodyne	BRCA1	61	33
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450587332	DE	On-Demand	Anodyne	ACE	53	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450587332	DE	On-Demand	Anodyne	FKBP1A	49	38
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450587332	DE	On-Demand	Anodyne	SLC18A2	40	37
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450587332	DE	On-Demand	Anodyne	MME	15	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450587332	DE	On-Demand	Anodyne	PREP	70	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450587332	DE	On-Demand	Anodyne	AMY2	44	30
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450587332	DE	On-Demand	Anodyne	ACE2	29	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C)[C@@H]1CO	ZINC000450587332	DE	On-Demand	Anodyne	BRCA1	61	33
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450587333	DE	On-Demand	Anodyne	ACE	53	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450587333	DE	On-Demand	Anodyne	FKBP1A	49	38
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450587333	DE	On-Demand	Anodyne	SLC18A2	40	37
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450587333	DE	On-Demand	Anodyne	MME	15	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450587333	DE	On-Demand	Anodyne	PREP	70	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450587333	DE	On-Demand	Anodyne	AMY2	44	30
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450587333	DE	On-Demand	Anodyne	ACE2	29	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@H]1CO	ZINC000450587333	DE	On-Demand	Anodyne	BRCA1	61	33
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450587334	DE	On-Demand	Anodyne	ACE	53	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450587334	DE	On-Demand	Anodyne	FKBP1A	49	38
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450587334	DE	On-Demand	Anodyne	SLC18A2	40	37
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450587334	DE	On-Demand	Anodyne	MME	15	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450587334	DE	On-Demand	Anodyne	PREP	70	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450587334	DE	On-Demand	Anodyne	AMY2	44	30
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450587334	DE	On-Demand	Anodyne	ACE2	29	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C)[C@@H]1CO	ZINC000450587334	DE	On-Demand	Anodyne	BRCA1	61	33
O=C(CCCN1C[C@@H]2CCC[C@H]21)c1ccc(Br)cc1	ZINC000450587342	DH	On-Demand	Anodyne	HDAC8	18	41
O=C(CCCN1C[C@@H]2CCC[C@H]21)c1ccc(Br)cc1	ZINC000450587342	DH	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1C[C@H]2CCC[C@@H]21)c1ccc(Br)cc1	ZINC000450587343	DH	On-Demand	Anodyne	HDAC8	18	41
O=C(CCCN1C[C@H]2CCC[C@@H]21)c1ccc(Br)cc1	ZINC000450587343	DH	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1C[C@H]2CCC[C@H]21)c1ccc(Br)cc1	ZINC000450587344	DH	On-Demand	Anodyne	HDAC8	18	41
O=C(CCCN1C[C@H]2CCC[C@H]21)c1ccc(Br)cc1	ZINC000450587344	DH	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1C[C@@H]2CCC[C@@H]21)c1ccc(Br)cc1	ZINC000450587345	DH	On-Demand	Anodyne	HDAC8	18	41
O=C(CCCN1C[C@@H]2CCC[C@@H]21)c1ccc(Br)cc1	ZINC000450587345	DH	On-Demand	Anodyne	CYP2J2	49	34
Cc1ccc(F)c(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450587357	FH	On-Demand	Anodyne	CCR2	43	40
Cc1ccc(F)c(CN[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450587357	FH	On-Demand	Anodyne	PDS	40	35
Cc1ccc(F)c(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450587363	FH	On-Demand	Anodyne	CCR2	43	40
Cc1ccc(F)c(CN[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c1	ZINC000450587363	FH	On-Demand	Anodyne	PDS	40	35
CCOC1(C)CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450587364	CF	On-Demand	Anodyne	CEL	17	40
CCOC1(C)CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450587364	CF	On-Demand	Anodyne	RBP4	19	47
CCc1nc2ccccc2n1C1CCN(C(=O)[C@]2(C)CC=CCC2)CC1	ZINC000450587380	FJ	On-Demand	Anodyne	FPR2	35	51
CCc1nc2ccccc2n1C1CCN(C(=O)[C@@]2(C)CC=CCC2)CC1	ZINC000450587381	FJ	On-Demand	Anodyne	FPR2	35	51
CCN(CC(F)F)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450587393	DI	On-Demand	Anodyne	PRCP	46	35
CCN(CC(F)F)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450587393	DI	On-Demand	Anodyne	MC3R	32	43
CCN(CC(F)F)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450587393	DI	On-Demand	Anodyne	MC5R	27	43
O=[N+]([O-])c1ccc(NC(CF)CF)cc1C(F)(F)F	ZINC000450587398	CG	On-Demand	Bother	AADAC	0	59
Cc1cc(CNC(=O)CC[C@@H]2CCC(=O)N2)ccc1Cl	ZINC000450587399	CE	On-Demand	Anodyne	P2RX7	38	42
Cc1cc(CNC(=O)CC[C@H]2CCC(=O)N2)ccc1Cl	ZINC000450587400	CE	On-Demand	Anodyne	P2RX7	38	42
c1ccc2c(c1)oc1c(N3CC4(CC4)C3)ncnc12	ZINC000450587440	CF	On-Demand	Anodyne	HRH4	20	64
CCN(CC(F)F)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450587441	DI	On-Demand	Anodyne	PRCP	45	35
CCN(CC(F)F)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450587441	DI	On-Demand	Anodyne	MC3R	32	43
CCN(CC(F)F)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450587441	DI	On-Demand	Anodyne	MC5R	27	43
CCN(CC(F)F)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450587442	DI	On-Demand	Anodyne	PRCP	45	35
CCN(CC(F)F)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450587442	DI	On-Demand	Anodyne	MC3R	32	43
CCN(CC(F)F)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450587442	DI	On-Demand	Anodyne	MC5R	27	43
CCN(CC(F)F)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450587443	DI	On-Demand	Anodyne	PRCP	45	35
CCN(CC(F)F)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450587443	DI	On-Demand	Anodyne	MC3R	32	43
CCN(CC(F)F)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450587443	DI	On-Demand	Anodyne	MC5R	27	43
CCC[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450587445	EH	On-Demand	Anodyne	AVPR2	37	40
CCC[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450587445	EH	On-Demand	Anodyne	GPBAR1	25	42
CCC[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450587446	EH	On-Demand	Anodyne	AVPR2	37	40
CCC[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450587446	EH	On-Demand	Anodyne	GPBAR1	25	42
Cc1sccc1C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450587449	EF	On-Demand	Anodyne	CCR8	45	31
C[C@@H](O)CCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450587456	DD	On-Demand	Anodyne	SCN9A	31	50
C[C@@H](O)CCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450587456	DD	On-Demand	Anodyne	DYRK2	54	36
C[C@H](O)CCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450587457	DD	On-Demand	Anodyne	SCN9A	31	50
C[C@H](O)CCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450587457	DD	On-Demand	Anodyne	DYRK2	54	36
C[C@H](O)CCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450587458	DD	On-Demand	Anodyne	SCN9A	31	50
C[C@H](O)CCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450587458	DD	On-Demand	Anodyne	DYRK2	54	36
C[C@@H](O)CCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450587459	DD	On-Demand	Anodyne	SCN9A	31	50
C[C@@H](O)CCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450587459	DD	On-Demand	Anodyne	DYRK2	54	36
CC(=O)CCCCCSc1nnc(-c2ccccc2Cl)n1C	ZINC000450587460	EI	On-Demand	Anodyne	DRD3	20	45
CC(=O)CCCCCSc1nnc(-c2ccccc2Cl)n1C	ZINC000450587460	EI	On-Demand	Anodyne	KCNH2	23	45
CCC[C@@H]1CCCCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450587462	CG	On-Demand	Anodyne	HCRTR1	19	44
CCC[C@@H]1CCCCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450587462	CG	On-Demand	Anodyne	HCRTR2	19	44
CCC[C@H]1CCCCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450587463	CG	On-Demand	Anodyne	HCRTR1	19	44
CCC[C@H]1CCCCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450587463	CG	On-Demand	Anodyne	HCRTR2	19	44
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	HTR1A	92	46
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	DRD2	86	46
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	DRD1	35	43
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	DRD4	44	36
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	ADRA1D	93	48
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	HTR2A	46	40
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	HTR2C	24	40
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	ADRA1A	69	48
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	ADRA1B	52	40
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	DRD3	76	45
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	HTR7	69	42
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	HSP90AB1	34	41
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	HCN1	40	33
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	AP2S1	0	46
COCCOc1ccccc1N1CCN(CC2(C(=O)OC)CC2)CC1	ZINC000450587476	ED	On-Demand	Anodyne	ALPHA-1A	0	43
COC[C@@](C)(O)CCN=c1c([N+](=O)[O-])c[nH]c2ccccc12	ZINC000450587487	DD	On-Demand	Bother	NMBR	54	32
COC[C@](C)(O)CCN=c1c([N+](=O)[O-])c[nH]c2ccccc12	ZINC000450587488	DD	On-Demand	Bother	NMBR	54	32
COC(=O)c1cncc(NCC[C@H]2CCc3ccccc32)n1	ZINC000450587495	CF	On-Demand	Anodyne	NQO2	39	42
COC(=O)c1cncc(NCC[C@@H]2CCc3ccccc32)n1	ZINC000450587496	CF	On-Demand	Anodyne	NQO2	39	42
COc1nccc(CNc2cc(C)nc3ncnn23)n1	ZINC000450587512	CC	On-Demand	Anodyne	DHOD	0	53
COCC(=O)N1CCc2c(NC(=O)[C@H](Cc3ccccc3)OC)cccc21	ZINC000450587523	FE	On-Demand	Anodyne	KCNQ2	68	35
COCC(=O)N1CCc2c(NC(=O)[C@@H](Cc3ccccc3)OC)cccc21	ZINC000450587524	FE	On-Demand	Anodyne	KCNQ2	68	35
CCN(CC(F)F)C(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450587529	CD	On-Demand	Anodyne	PDF	46	34
CCc1cccc(C(=O)NCCOC(C)C)n1	ZINC000450587559	BD	On-Demand	Anodyne	PDE5A	32	48
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CC[C@H](C)[C@H](C)C2)c(F)c1	ZINC000450587561	EF	On-Demand	Anodyne	MAPK13	75	35
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CC[C@H](C)[C@@H](C)C2)c(F)c1	ZINC000450587562	EF	On-Demand	Anodyne	MAPK13	75	35
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CC[C@@H](C)[C@H](C)C2)c(F)c1	ZINC000450587563	EF	On-Demand	Anodyne	MAPK13	75	35
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CC[C@@H](C)[C@@H](C)C2)c(F)c1	ZINC000450587564	EF	On-Demand	Anodyne	MAPK13	75	35
C[C@H](O)CCN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450587569	FD	On-Demand	Anodyne	P2RX7	45	47
C[C@H](O)CCN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450587569	FD	On-Demand	Anodyne	ROCK2	0	57
C[C@H](O)CCN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450587569	FD	On-Demand	Anodyne	Q95J97_RABIT	0	45
C[C@@H](O)CCN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450587570	FD	On-Demand	Anodyne	P2RX7	45	47
C[C@@H](O)CCN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450587570	FD	On-Demand	Anodyne	ROCK2	0	57
C[C@@H](O)CCN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1	ZINC000450587570	FD	On-Demand	Anodyne	Q95J97_RABIT	0	45
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cc(C2CC2)ccc1F	ZINC000450587575	GF	On-Demand	Anodyne	CA2	37	47
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cc(C2CC2)ccc1F	ZINC000450587575	GF	On-Demand	Anodyne	CA1	38	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cc(C2CC2)ccc1F	ZINC000450587575	GF	On-Demand	Anodyne	CA7	40	39
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cc(C2CC2)ccc1F	ZINC000450587575	GF	On-Demand	Anodyne	CA4	37	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cc(C2CC2)ccc1F	ZINC000450587575	GF	On-Demand	Anodyne	CA12	22	42
CCSc1nnc(SCc2ccc(C(=O)OC)c(Cl)c2)s1	ZINC000450587576	FI	On-Demand	Anodyne	PTPRG	0	41
CC(=O)CCCCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450587585	FE	On-Demand	Anodyne	SCN9A	0	45
CC(=O)CCCCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450587586	FE	On-Demand	Anodyne	SCN9A	0	45
CCc1cc2c(NCc3ccnc(OC)n3)ncnc2s1	ZINC000450587587	DF	On-Demand	Anodyne	CLK4	45	37
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450587592	FJ	On-Demand	Anodyne	PRCP	46	36
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450587602	EF	On-Demand	Anodyne	TIMP3	43	34
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450587603	EF	On-Demand	Anodyne	TIMP3	43	34
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450587604	EF	On-Demand	Anodyne	TIMP3	43	34
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450587605	EF	On-Demand	Anodyne	TIMP3	43	34
O=C(Nc1n[nH]c(C2CCC2)n1)c1ccc(I)cc1F	ZINC000450587610	GG	On-Demand	Anodyne	MAP2K1	52	34
CC(C)OCCNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450587615	EE	On-Demand	Mild	AR	16	40
CC(C)OCCNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450587616	EE	On-Demand	Mild	AR	16	40
CC(C)OCCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450587624	CE	On-Demand	Anodyne	P2RY12	49	34
CC(C)OCCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450587624	CE	On-Demand	Anodyne	GPBAR1	29	42
CC[C@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450587628	DG	On-Demand	Anodyne	SLC1A1	48	37
CC[C@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450587628	DG	On-Demand	Anodyne	SLC1A3	46	37
CC[C@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450587628	DG	On-Demand	Anodyne	SLC1A2	51	37
CC[C@@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450587629	DG	On-Demand	Anodyne	SLC1A1	48	37
CC[C@@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450587629	DG	On-Demand	Anodyne	SLC1A3	46	37
CC[C@@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450587629	DG	On-Demand	Anodyne	SLC1A2	51	37
CC(C)OCCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450587633	CE	On-Demand	Anodyne	P2RY12	49	34
CC(C)OCCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450587633	CE	On-Demand	Anodyne	GPBAR1	29	42
Cc1ccn2ncc(C(=O)N3CCO[C@H](CCc4ccccc4)C3)c2c1	ZINC000450587634	EG	On-Demand	Anodyne	EPHB3	25	41
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450587635	FJ	On-Demand	Anodyne	PRCP	46	36
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450587636	FJ	On-Demand	Anodyne	PRCP	46	36
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450587637	FJ	On-Demand	Anodyne	PRCP	46	36
COC1CCC(CCNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450587638	FF	On-Demand	Anodyne	LDLR	0	40
Cc1ccn2ncc(C(=O)N3CCO[C@@H](CCc4ccccc4)C3)c2c1	ZINC000450587657	EG	On-Demand	Anodyne	EPHB3	25	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](CCO)C(C)(C)C)c1	ZINC000450587663	DF	On-Demand	Anodyne	GPR88	0	44
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](CCO)C(C)(C)C)c1	ZINC000450587664	DF	On-Demand	Anodyne	GPR88	0	44
CCO[C@@H]1COCC[C@@H]1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450587678	DD	On-Demand	Anodyne	TIMP3	67	36
CCO[C@@H]1COCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450587681	DD	On-Demand	Anodyne	TIMP3	67	36
CCO[C@@H]1COCC[C@@H]1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450587684	DD	On-Demand	Anodyne	TIMP3	67	36
CCO[C@@H]1COCC[C@H]1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450587686	DD	On-Demand	Anodyne	TIMP3	67	36
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)C[C@@H]1CCCCC1(F)F	ZINC000450587687	FH	On-Demand	Anodyne	CNR1	0	42
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)C[C@@H]1CCCCC1(F)F	ZINC000450587687	FH	On-Demand	Anodyne	CNR2	0	40
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)C[C@@H]1CCCCC1(F)F	ZINC000450587687	FH	On-Demand	Anodyne	L3MBTL3	47	36
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)C[C@H]1CCCCC1(F)F	ZINC000450587689	FH	On-Demand	Anodyne	CNR1	0	42
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)C[C@H]1CCCCC1(F)F	ZINC000450587689	FH	On-Demand	Anodyne	CNR2	0	40
Cc1cc(C(=O)N2CCOCC2)ccc1N(C)C[C@H]1CCCCC1(F)F	ZINC000450587689	FH	On-Demand	Anodyne	L3MBTL3	47	36
CCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450587704	CG	On-Demand	Anodyne	HTR5A	24	42
CCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450587704	CG	On-Demand	Anodyne	CHRNA6	0	43
CCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450587704	CG	On-Demand	Anodyne	NOD2	33	42
Cc1nc(=NC(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)n(C)[nH]1	ZINC000450587707	ED	On-Demand	Anodyne	MAP3K5	44	35
CCC[C@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587717	CI	On-Demand	Anodyne	HCRTR1	0	50
CCC[C@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587717	CI	On-Demand	Anodyne	COLA	59	35
CCC[C@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587717	CI	On-Demand	Anodyne	CPT1A	59	35
CCC[C@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587717	CI	On-Demand	Anodyne	AKT1	0	40
CCC[C@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587717	CI	On-Demand	Anodyne	L3MBTL1	0	41
CCC[C@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587717	CI	On-Demand	Anodyne	L3MBTL3	47	41
Cc1cc(CNC(=O)c2nn3c(c2C)OCCC3)ccc1Cl	ZINC000450587737	DF	On-Demand	Anodyne	CNR1	24	50
Cc1cc(CNC(=O)c2nn3c(c2C)OCCC3)ccc1Cl	ZINC000450587737	DF	On-Demand	Anodyne	PFK	0	41
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	HTR1A	87	43
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	DRD2	72	56
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	DRD1	27	52
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	DRD4	48	52
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	ADRA1D	54	39
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	HTR2A	27	43
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	ADRA1A	50	39
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	DRD3	73	56
COCCOc1ccccc1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450587742	FE	On-Demand	Anodyne	HTR7	48	39
CCC[C@@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587746	CI	On-Demand	Anodyne	HCRTR1	0	50
CCC[C@@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587746	CI	On-Demand	Anodyne	COLA	59	35
CCC[C@@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587746	CI	On-Demand	Anodyne	CPT1A	59	35
CCC[C@@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587746	CI	On-Demand	Anodyne	AKT1	0	40
CCC[C@@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587746	CI	On-Demand	Anodyne	L3MBTL1	0	41
CCC[C@@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC000450587746	CI	On-Demand	Anodyne	L3MBTL3	41	41
Cc1nc(NC2CCC(CS(C)(=O)=O)CC2)c2cc[nH]c2n1	ZINC000450587748	DE	On-Demand	Anodyne	JAK1	43	38
C[C@@H]1CCCN(C(=O)C[C@H]2CSc3ccccc3O2)[C@@H]1CO	ZINC000450587750	DF	On-Demand	Anodyne	PREP	41	33
C[C@@H]1CCCN(C(=O)C[C@@H]2CSc3ccccc3O2)[C@H]1CO	ZINC000450587751	DF	On-Demand	Anodyne	PREP	41	33
C[C@@H]1CCCN(C(=O)C[C@@H]2CSc3ccccc3O2)[C@@H]1CO	ZINC000450587752	DF	On-Demand	Anodyne	PREP	41	33
C[C@@H]1CCCN(C(=O)C[C@H]2CSc3ccccc3O2)[C@H]1CO	ZINC000450587753	DF	On-Demand	Anodyne	PREP	41	33
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1cc2ccccc2s1	ZINC000450587765	GE	On-Demand	Anodyne	FOLH1	47	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1cc2ccccc2s1	ZINC000450587765	GE	On-Demand	Anodyne	CTSK	31	46
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1cc2ccccc2s1	ZINC000450587765	GE	On-Demand	Anodyne	CAPNS1	44	35
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1cc2ccccc2s1	ZINC000450587765	GE	On-Demand	Anodyne	CAPN1	51	37
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1cc2ccccc2s1	ZINC000450587765	GE	On-Demand	Anodyne	CAPN2	81	37
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1cc2ccccc2s1	ZINC000450587765	GE	On-Demand	Anodyne	NPR	76	39
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1cc2ccccc2s1	ZINC000450587765	GE	On-Demand	Anodyne	KISS1R	46	32
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)Cc1cc2ccccc2s1	ZINC000450587765	GE	On-Demand	Anodyne	F2RL1	54	45
COCCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450587777	EF	On-Demand	Anodyne	DRD1	37	43
COCCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450587777	EF	On-Demand	Anodyne	DRD3	28	43
COCCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450587777	EF	On-Demand	Anodyne	ABCB1	23	40
COCCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450587777	EF	On-Demand	Anodyne	AP2S1	0	42
COCCOc1ccccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450587777	EF	On-Demand	Anodyne	ALPHA-1A	0	41
COc1cc2c(NC(CF)CF)ncnc2cc1F	ZINC000450587790	CE	On-Demand	Anodyne	EGFR	28	44
COc1cc2c(NC(CF)CF)ncnc2cc1F	ZINC000450587790	CE	On-Demand	Anodyne	FGFR1	23	48
COc1cc2c(NC(CF)CF)ncnc2cc1F	ZINC000450587790	CE	On-Demand	Anodyne	FLT1	27	47
COc1cc2c(NC(CF)CF)ncnc2cc1F	ZINC000450587790	CE	On-Demand	Anodyne	FBP1	0	47
COc1cc2c(NC(CF)CF)ncnc2cc1F	ZINC000450587790	CE	On-Demand	Anodyne	ERBB4	24	41
COc1cc2c(NC(CF)CF)ncnc2cc1F	ZINC000450587790	CE	On-Demand	Anodyne	EPHA2	47	37
COc1cc2c(NC(CF)CF)ncnc2cc1F	ZINC000450587790	CE	On-Demand	Anodyne	MKNK1	23	42
Cc1ccccc1CCN(C)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450587807	FG	On-Demand	Bother	COLA	53	33
COc1ccc(CNC(=O)CCNC2(C(N)=O)CCCCC2)c(OC)c1	ZINC000450587837	FD	On-Demand	Anodyne	MTNR1A	47	38
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450587838	FG	On-Demand	Anodyne	DRD2	36	42
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450587838	FG	On-Demand	Anodyne	DRD3	0	42
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450587838	FG	On-Demand	Anodyne	CYP2J2	49	37
CCOC(=O)c1ccc(CN2CCC(c3cnc[nH]3)CC2)nc1	ZINC000450587840	DE	On-Demand	Anodyne	SSTR5	29	40
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450587841	FG	On-Demand	Anodyne	DRD2	36	42
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450587841	FG	On-Demand	Anodyne	DRD3	0	42
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450587841	FG	On-Demand	Anodyne	CYP2J2	49	37
CC(C)[C@H](O)CC(=O)N[C@H](CCO)C(C)(C)C	ZINC000450587851	BD	On-Demand	Anodyne	PGA	49	33
CC(C)[C@H](O)CC(=O)N[C@@H](CCO)C(C)(C)C	ZINC000450587852	BD	On-Demand	Anodyne	PGA	49	33
CC(C)[C@@H](O)CC(=O)N[C@@H](CCO)C(C)(C)C	ZINC000450587854	BD	On-Demand	Anodyne	PGA	49	33
CC(C)[C@@H](O)CC(=O)N[C@H](CCO)C(C)(C)C	ZINC000450587855	BD	On-Demand	Anodyne	PGA	49	33
COC(=O)C1(N(C)CCC(=O)NCc2ccc(OC)cc2OC)CCCC1	ZINC000450587862	GE	On-Demand	Anodyne	MTNR1A	50	40
COC(=O)C1(N(C)CCC(=O)NCc2ccc(OC)cc2OC)CCCC1	ZINC000450587862	GE	On-Demand	Anodyne	MTNR1B	36	40
COC[C@@](C)(O)CCNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450587866	EG	On-Demand	Anodyne	HRP1_PLAFA	72	32
COC[C@@](C)(O)CCNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450587866	EG	On-Demand	Anodyne	HNMT	48	34
COC[C@](C)(O)CCNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450587868	EG	On-Demand	Anodyne	HRP1_PLAFA	72	32
COC[C@](C)(O)CCNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450587868	EG	On-Demand	Anodyne	HNMT	48	34
O=[N+]([O-])c1ccccc1NC(CF)CF	ZINC000450587882	BE	On-Demand	Bother	COLA	75	34
O=[N+]([O-])c1ccccc1NC(CF)CF	ZINC000450587882	BE	On-Demand	Bother	PQSD	0	42
COC[C@](C)(O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450587889	EC	On-Demand	Bother	CA2	29	43
COC(=O)C1(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)CC1	ZINC000450587894	GH	On-Demand	Anodyne	ALOX5	28	43
COC(=O)C1(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)CC1	ZINC000450587894	GH	On-Demand	Anodyne	LTA4H	15	42
COC(=O)C1(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)CC1	ZINC000450587894	GH	On-Demand	Anodyne	ADAM17	30	44
CCC(CC)Oc1ccc(C(=O)NCCOC(C)C)cc1	ZINC000450587900	CG	On-Demand	Anodyne	KCNQ1	0	43
CC[C@@H](c1ccccc1)N(CC(=O)OC)Cc1ccn(CC(F)(F)F)n1	ZINC000450587902	FH	On-Demand	Anodyne	NR1H2	0	41
CC[C@H](c1ccccc1)N(CC(=O)OC)Cc1ccn(CC(F)(F)F)n1	ZINC000450587904	FH	On-Demand	Anodyne	NR1H2	0	41
COC[C@@](C)(O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450587917	EC	On-Demand	Bother	CA2	29	43
CC[C@@H](O)CN(Cc1ccccc1)Cc1cn(CC2CC2)nn1	ZINC000450587924	DE	On-Demand	Anodyne	HSP90AB1	0	40
CC[C@H](O)CN(Cc1ccccc1)Cc1cn(CC2CC2)nn1	ZINC000450587926	DE	On-Demand	Anodyne	HSP90AB1	0	40
CS(=O)(=O)c1ccc(NC[C@H]2CCCN2CCCO)c(C(F)(F)F)c1	ZINC000450587943	GE	On-Demand	Anodyne	SFRP1	115	42
CS(=O)(=O)c1ccc(NC[C@H]2CCCN2CCCO)c(C(F)(F)F)c1	ZINC000450587943	GE	On-Demand	Anodyne	WNT3	82	37
CS(=O)(=O)c1ccc(NC[C@@H]2CCCN2CCCO)c(C(F)(F)F)c1	ZINC000450587947	GE	On-Demand	Anodyne	SFRP1	115	42
CS(=O)(=O)c1ccc(NC[C@@H]2CCCN2CCCO)c(C(F)(F)F)c1	ZINC000450587947	GE	On-Demand	Anodyne	WNT3	82	37
CN1CCN(S(=O)(=O)c2ccc(NC[C@@H]3CCCN3CCCO)nc2)CC1	ZINC000450587950	GB	On-Demand	Anodyne	GCKR	55	32
CN1CCN(S(=O)(=O)c2ccc(NC[C@H]3CCCN3CCCO)nc2)CC1	ZINC000450587960	GB	On-Demand	Anodyne	GCKR	55	32
C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1nccs1	ZINC000450587965	FI	On-Demand	Anodyne	RBP4	68	41
COc1cc(NC[C@H]2CCCN2CCCO)c(F)cc1[N+](=O)[O-]	ZINC000450587970	EE	On-Demand	Bother	ACKR3	45	31
COc1cc(NC[C@@H]2CCCN2CCCO)c(F)cc1[N+](=O)[O-]	ZINC000450587972	EE	On-Demand	Bother	ACKR3	45	31
COC(=O)C[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450588018	EF	On-Demand	Anodyne	DRD3	0	41
COC(=O)C[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450588018	EF	On-Demand	Anodyne	HRH3	22	42
COC(=O)C[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450588019	EF	On-Demand	Anodyne	DRD3	0	41
COC(=O)C[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450588019	EF	On-Demand	Anodyne	HRH3	22	42
C[C@H](O)CCSc1nc2cc(Br)cnc2[nH]1	ZINC000450588028	DF	On-Demand	Anodyne	ENPP1	25	48
C[C@@H](O)CCSc1nc2cc(Br)cnc2[nH]1	ZINC000450588029	DF	On-Demand	Anodyne	ENPP1	25	48
CC1(O)CC(C(=O)N[C@@H](CC(F)(F)F)c2ccc(Br)cc2)C1	ZINC000450588055	GH	On-Demand	Anodyne	SDH1	0	51
CC1(O)CC(C(=O)N[C@H](CC(F)(F)F)c2ccc(Br)cc2)C1	ZINC000450588056	GH	On-Demand	Anodyne	SDH1	0	51
CC(=O)c1ccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)cc1	ZINC000450588085	DD	On-Demand	Anodyne	BIRC2	43	31
CC(=O)c1ccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)cc1	ZINC000450588086	DD	On-Demand	Anodyne	BIRC2	43	31
O=C(NCC1CCN(c2ccncc2)CC1)[C@@H](O)C1CCC1	ZINC000450588087	DD	On-Demand	Anodyne	F10	18	44
O=C(NCC1CCN(c2ccncc2)CC1)[C@H](O)C1CCC1	ZINC000450588088	DD	On-Demand	Anodyne	F10	18	44
CCS(=O)(=O)c1ccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)cc1	ZINC000450588108	GE	On-Demand	Anodyne	HRH3	17	46
CCS(=O)(=O)c1ccc(CN2CCN(C3CCN(C(C)C)CC3)CC2)cc1	ZINC000450588108	GE	On-Demand	Anodyne	L3MBTL3	25	40
CCS(=O)(=O)c1ccc(N[C@H](C)c2ccc(F)c(C)c2)cc1	ZINC000450588113	DI	On-Demand	Anodyne	LEF	64	40
COc1cc(CC(=O)N[C@@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450588115	DF	On-Demand	Anodyne	TRPV1	37	42
COc1cc(CC(=O)N[C@@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450588115	DF	On-Demand	Anodyne	P2RX7	0	41
COc1cc(CC(=O)N[C@@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450588115	DF	On-Demand	Anodyne	NCE103	27	41
COc1cc(CC(=O)N[C@@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450588115	DF	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450588116	DF	On-Demand	Anodyne	TRPV1	37	42
COc1cc(CC(=O)N[C@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450588116	DF	On-Demand	Anodyne	P2RX7	0	41
COc1cc(CC(=O)N[C@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450588116	DF	On-Demand	Anodyne	NCE103	27	41
COc1cc(CC(=O)N[C@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450588116	DF	On-Demand	Anodyne	CAN2	0	41
CC(C)NS(=O)(=O)[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450588128	ED	On-Demand	Anodyne	SIGMAR1	31	42
CC(C)NS(=O)(=O)[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450588128	ED	On-Demand	Anodyne	CCR5	46	37
CC(C)NS(=O)(=O)[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450588128	ED	On-Demand	Anodyne	BIRC2	45	36
CC(C)NS(=O)(=O)[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450588129	ED	On-Demand	Anodyne	SIGMAR1	31	42
CC(C)NS(=O)(=O)[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450588129	ED	On-Demand	Anodyne	CCR5	46	37
CC(C)NS(=O)(=O)[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450588129	ED	On-Demand	Anodyne	BIRC2	45	36
CC(C)(C)[C@@H](CCO)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450588134	FH	On-Demand	Anodyne	PYGL	41	35
CC(C)(C)[C@H](CCO)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450588135	FH	On-Demand	Anodyne	PYGL	41	35
COc1cc(CC(=O)N(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)ccc1Cl	ZINC000450588136	GI	On-Demand	Anodyne	OPRK1	0	43
COc1cc(CC(=O)N(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1Cl	ZINC000450588137	GI	On-Demand	Anodyne	OPRK1	0	43
COc1cc(CC(=O)N(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)ccc1Cl	ZINC000450588138	GI	On-Demand	Anodyne	OPRK1	0	43
COc1cc(CC(=O)N(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1Cl	ZINC000450588139	GI	On-Demand	Anodyne	OPRK1	0	43
COC(=O)c1csc(CN2CCCCc3ccc(OC)cc32)n1	ZINC000450588156	EG	On-Demand	Anodyne	TYMS	0	40
CCN(CC(F)F)C(=O)c1cccc(SC)c1	ZINC000450588159	CG	On-Demand	Anodyne	OPRD1	17	49
CCC[C@H](OC)C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450588165	DD	On-Demand	Anodyne	KCNQ2	48	39
CCC[C@@H](OC)C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450588166	DD	On-Demand	Anodyne	KCNQ2	48	39
COc1ccc2c(c1)N(Cc1cnns1)CCCC2	ZINC000450588176	CF	On-Demand	Anodyne	TYMS	18	42
CC[C@@H](CO)N(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450588187	CE	On-Demand	Anodyne	TUBB3	33	45
CC[C@H](CO)N(C)c1ncnc2[nH]c3ccccc3c12	ZINC000450588188	CE	On-Demand	Anodyne	TUBB3	33	45
CCN(CC(F)F)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450588200	DF	On-Demand	Anodyne	PDEC	0	41
CCN(CC(F)F)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450588201	DF	On-Demand	Anodyne	PDEC	0	41
COCCOc1ccccc1N1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450588222	FF	On-Demand	Anodyne	DRD1	36	42
COCCOc1ccccc1N1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450588222	FF	On-Demand	Anodyne	DRD3	57	36
CCN(CC(F)F)C(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450588223	EG	On-Demand	Anodyne	PDEC	0	41
CCN(CC(F)F)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450588228	EG	On-Demand	Bother	PPXII	0	40
COc1ccc(-c2noc(CN(C)[C@H]3CCN(Cc4ccccc4)C3)n2)nn1	ZINC000450588229	GE	On-Demand	Anodyne	ACHE	17	42
COc1ccc(-c2noc(CN(C)[C@@H]3CCN(Cc4ccccc4)C3)n2)nn1	ZINC000450588230	GE	On-Demand	Anodyne	ACHE	17	42
COC(=O)c1coc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)n1	ZINC000450588308	FH	On-Demand	Anodyne	CYP11B2	21	44
C=CCOc1ccc(CC(=O)N[C@H]2CCOC[C@H]2OCC)cc1	ZINC000450588321	DE	On-Demand	Mild	PHZR	0	45
C=CCOc1ccc(CC(=O)N[C@@H]2CCOC[C@H]2OCC)cc1	ZINC000450588322	DE	On-Demand	Mild	PHZR	0	45
C=CCOc1ccc(CC(=O)N[C@H]2CCOC[C@@H]2OCC)cc1	ZINC000450588323	DE	On-Demand	Mild	PHZR	0	45
C=CCOc1ccc(CC(=O)N[C@@H]2CCOC[C@@H]2OCC)cc1	ZINC000450588324	DE	On-Demand	Mild	PHZR	0	45
Cc1ccn2ncc(C(=O)N3CCC4(CCOCC4)[C@@H]3C)c2c1	ZINC000450588340	DF	On-Demand	Anodyne	EPHB3	19	40
Cc1ccn2ncc(C(=O)N3CCC4(CCOCC4)[C@H]3C)c2c1	ZINC000450588341	DF	On-Demand	Anodyne	EPHB3	19	40
CCO[C@@H]1COCC[C@H]1NC(=O)c1oc2ccccc2c1CC	ZINC000450588359	DF	On-Demand	Anodyne	MMP12	0	45
CCO[C@@H]1COCC[C@H]1NC(=O)c1oc2ccccc2c1CC	ZINC000450588359	DF	On-Demand	Anodyne	MMP7	0	45
CCO[C@@H]1COCC[C@@H]1NC(=O)c1oc2ccccc2c1CC	ZINC000450588360	DF	On-Demand	Anodyne	MMP12	0	45
CCO[C@@H]1COCC[C@@H]1NC(=O)c1oc2ccccc2c1CC	ZINC000450588360	DF	On-Demand	Anodyne	MMP7	0	45
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	FOLH1	47	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	ANPEP	33	51
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	TIMP3	48	33
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	CAPNS1	53	35
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	HLA-DRB1	45	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	CAPN1	65	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	CAPN2	106	35
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	FPR1	44	37
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450588361	GE	On-Demand	Anodyne	NPR	67	39
CCO[C@H]1COCC[C@@H]1NC(=O)c1oc2ccccc2c1CC	ZINC000450588363	DF	On-Demand	Anodyne	MMP12	0	45
CCO[C@H]1COCC[C@@H]1NC(=O)c1oc2ccccc2c1CC	ZINC000450588363	DF	On-Demand	Anodyne	MMP7	0	45
CCO[C@H]1COCC[C@H]1NC(=O)c1oc2ccccc2c1CC	ZINC000450588364	DF	On-Demand	Anodyne	MMP12	0	45
CCO[C@H]1COCC[C@H]1NC(=O)c1oc2ccccc2c1CC	ZINC000450588364	DF	On-Demand	Anodyne	MMP7	0	45
CCOC(=O)[C@@](C)(O)CNC(=O)c1cccc(CC)n1	ZINC000450588367	CC	On-Demand	Anodyne	PDE5A	0	41
CCOC(=O)[C@](C)(O)CNC(=O)c1cccc(CC)n1	ZINC000450588377	CC	On-Demand	Anodyne	PDE5A	0	41
CCCOc1cccc(CN2CCC[C@H](c3nncn3C3CC3)C2)c1	ZINC000450588392	EH	On-Demand	Anodyne	HRH2	30	43
CCCOc1cccc(CN2CCC[C@H](c3nncn3C3CC3)C2)c1	ZINC000450588392	EH	On-Demand	Anodyne	HRH3	15	42
CCCOc1cccc(CN2CCC[C@@H](c3nncn3C3CC3)C2)c1	ZINC000450588393	EH	On-Demand	Anodyne	HRH2	30	43
CCCOc1cccc(CN2CCC[C@@H](c3nncn3C3CC3)C2)c1	ZINC000450588393	EH	On-Demand	Anodyne	HRH3	15	42
FCC(CF)Nc1ncnc2ccccc12	ZINC000450588397	BE	On-Demand	Anodyne	EGFR	17	48
FCC(CF)Nc1ncnc2ccccc12	ZINC000450588397	BE	On-Demand	Anodyne	CLK4	46	33
FCC(CF)Nc1ncnc2ccccc12	ZINC000450588397	BE	On-Demand	Anodyne	HTT	0	43
FCC(CF)Nc1ncnc2ccccc12	ZINC000450588397	BE	On-Demand	Anodyne	USP10	0	41
FCC(CF)Nc1ncnc2ccccc12	ZINC000450588397	BE	On-Demand	Anodyne	USP13	0	41
CCCCn1cc(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)c(C)n1	ZINC000450588413	FJ	On-Demand	Anodyne	P2RX7	51	37
FCC(CF)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450588448	CD	On-Demand	Anodyne	DHOD	0	59
CCc1cc(NC[C@H]2CCCN2CCCO)n2ncnc2n1	ZINC000450588462	DC	On-Demand	Anodyne	DHOD	0	44
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	MME	18	44
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	ANPEP	47	38
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	CTSK	51	40
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	CTSL	33	40
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	CAPNS1	55	37
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	CTSS	24	40
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	CAPN1	74	38
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	CAPN2	108	35
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	FPR1	41	34
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	NPR	79	41
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	KISS1R	46	31
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450588463	FE	On-Demand	Anodyne	F2RL1	50	34
CCc1cc(NC[C@@H]2CCCN2CCCO)n2ncnc2n1	ZINC000450588475	DC	On-Demand	Anodyne	DHOD	0	44
CCN1CCN(C(=O)c2cc(Cl)c(Br)cc2F)CC1=O	ZINC000450588502	FF	On-Demand	Anodyne	P2RX7	22	58
CC[C@H](COCC(F)(F)F)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450588512	GG	On-Demand	Anodyne	GCK	51	31
CC[C@H](COCC(F)(F)F)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450588512	GG	On-Demand	Anodyne	GCKR	72	33
COc1cc(OC)c2ncc(C#N)c(NC[C@@H]3CCCN3CCCO)c2c1	ZINC000450588522	FE	On-Demand	Mild	SRC	54	37
CC[C@@H](COCC(F)(F)F)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450588523	GG	On-Demand	Anodyne	GCK	51	31
CC[C@@H](COCC(F)(F)F)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450588523	GG	On-Demand	Anodyne	GCKR	72	33
COc1cc(OC)c2ncc(C#N)c(NC[C@H]3CCCN3CCCO)c2c1	ZINC000450588525	FE	On-Demand	Mild	SRC	54	37
Cc1ccc(C(=O)NCC2CCN(c3ccncc3)CC2)c(C(C)C)n1	ZINC000450588541	FH	On-Demand	Anodyne	F10	19	45
Cc1ccc(C(=O)NCC2CCN(c3ccncc3)CC2)c(C(C)C)n1	ZINC000450588541	FH	On-Demand	Anodyne	CACNA1I	44	34
C[C@@]1(c2ccc3c(c2)OCO3)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450588566	FG	On-Demand	Anodyne	SCN9A	28	44
C[C@@]1(c2ccc3c(c2)OCO3)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450588567	FG	On-Demand	Anodyne	SCN9A	28	44
C[C@]1(c2ccc3c(c2)OCO3)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450588568	FG	On-Demand	Anodyne	SCN9A	28	44
C[C@]1(c2ccc3c(c2)OCO3)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450588569	FG	On-Demand	Anodyne	SCN9A	28	44
Cn1c(SCC2(C#N)CCC2)nnc1-c1ccccc1Cl	ZINC000450588575	DH	On-Demand	Mild	HSD11B1	24	47
CCOc1ccc2c(c1)CCN(Cc1nc(C(=O)OC)co1)C2	ZINC000450588588	DE	On-Demand	Anodyne	NOD2	44	43
CCC[C@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450588635	CI	On-Demand	Anodyne	HCRTR1	29	45
CCC[C@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450588635	CI	On-Demand	Anodyne	COLA	95	37
CCC[C@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450588635	CI	On-Demand	Anodyne	CPT1A	91	37
CCC[C@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450588635	CI	On-Demand	Anodyne	HCRTR2	0	45
CCC[C@@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450588636	CI	On-Demand	Anodyne	HCRTR1	26	45
CCC[C@@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450588636	CI	On-Demand	Anodyne	COLA	95	37
CCC[C@@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450588636	CI	On-Demand	Anodyne	CPT1A	84	37
CCC[C@@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450588636	CI	On-Demand	Anodyne	HCRTR2	0	45
C[C@H](OCCc1ccccc1)C(=O)N1CCC(C)(CN2CCN(C)CC2)CC1	ZINC000450588643	GF	On-Demand	Anodyne	GHRHR	47	34
C[C@H](OCCc1ccccc1)C(=O)N1CCC(C)(CN2CCN(C)CC2)CC1	ZINC000450588643	GF	On-Demand	Anodyne	SIGMAR1	17	42
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(C)(CN2CCN(C)CC2)CC1	ZINC000450588644	GF	On-Demand	Anodyne	GHRHR	47	34
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(C)(CN2CCN(C)CC2)CC1	ZINC000450588644	GF	On-Demand	Anodyne	SIGMAR1	17	42
C/C=C\COc1cccc(CC(=O)NCCOC(C)C)c1	ZINC000450588651	CF	On-Demand	Anodyne	CAN2	0	40
C/C=C\COc1cccc(CC(=O)NCCOC(C)C)c1	ZINC000450588651	CF	On-Demand	Anodyne	PDS	48	33
COc1nccc(CNc2cc(N3CCOCC3)ncn2)n1	ZINC000450588655	DC	On-Demand	Anodyne	EPHB4	68	37
COc1nccc(CNc2cc(N3CCOCC3)ncn2)n1	ZINC000450588655	DC	On-Demand	Anodyne	SMG1	43	35
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	DRD2	21	41
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	DRD4	43	32
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	HRH2	47	47
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	DRD3	22	44
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	LTA4H	15	42
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	CCR3	75	44
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	MLNR	45	33
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	FAAH	21	41
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	CCR2	22	47
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	MCHR1	45	49
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	CCR8	29	41
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	BIRC2	37	41
COc1cc(N[C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588659	FH	On-Demand	Anodyne	ACKR3	48	31
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	DRD2	21	41
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	DRD4	43	32
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	HRH2	47	47
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	DRD3	22	44
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	LTA4H	15	42
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	CCR3	75	44
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	MLNR	45	33
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	FAAH	21	41
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	CCR2	22	47
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	MCHR1	45	49
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	CCR8	29	41
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	BIRC2	37	41
COc1cc(N[C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)cc(OC)c1	ZINC000450588660	FH	On-Demand	Anodyne	ACKR3	48	31
CCOC(=O)c1ccc(CN(C)[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450588663	FF	On-Demand	Anodyne	MLNR	42	36
CCOC(=O)c1ccc(CN(C)[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450588664	FF	On-Demand	Anodyne	MLNR	42	36
COCC(=O)N1CCc2c(NC(=O)c3cc(C)n(C(C)C)n3)cccc21	ZINC000450588671	FF	On-Demand	Anodyne	KCNQ2	42	33
CN1CCN(CC2(C)CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)CC2)CC1	ZINC000450588678	FF	On-Demand	Anodyne	HRH4	27	41
COCCOc1ccccc1N1CCN(C[C@@H]2CCNC(=O)CC2)CC1	ZINC000450588702	FD	On-Demand	Anodyne	DRD1	37	43
COCCOc1ccccc1N1CCN(C[C@@H]2CCNC(=O)CC2)CC1	ZINC000450588702	FD	On-Demand	Anodyne	DRD3	50	39
COCCOc1ccccc1N1CCN(C[C@H]2CCNC(=O)CC2)CC1	ZINC000450588704	FD	On-Demand	Anodyne	DRD1	37	43
COCCOc1ccccc1N1CCN(C[C@H]2CCNC(=O)CC2)CC1	ZINC000450588704	FD	On-Demand	Anodyne	DRD3	50	39
COC1CCC(CCNC(=O)c2cn(CC3CC3)nn2)CC1	ZINC000450588722	DE	On-Demand	Anodyne	SIRT2	43	30
CC(C)OCCNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450588726	EE	On-Demand	Anodyne	PDE8B	48	33
CC(C)OCCNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450588727	EE	On-Demand	Anodyne	PDE8B	48	33
COC1CCC(CCNC(=O)c2cccc(SC)c2)CC1	ZINC000450588738	DH	On-Demand	Anodyne	DRD4	44	34
COC1CCC(CCNC(=O)c2cccc(SC)c2)CC1	ZINC000450588738	DH	On-Demand	Anodyne	LDLR	0	40
COC1CCC(CCNC(=O)c2cccc(SC)c2)CC1	ZINC000450588738	DH	On-Demand	Anodyne	SIRT3	45	41
COC1CCC(CCNC(=O)c2cccc(SC)c2)CC1	ZINC000450588738	DH	On-Demand	Anodyne	SIRT2	53	41
COC1CCC(CCNC(=O)c2cccc(SC)c2)CC1	ZINC000450588738	DH	On-Demand	Anodyne	SIRT1	45	41
Cc1ccc(C(=O)N2CCN3CCOC[C@H]3C2)c(Cl)c1Cl	ZINC000450588747	EE	On-Demand	Anodyne	P2RX7	21	40
CCc1cc(NCCn2cc(Br)ccc2=O)n2ncnc2n1	ZINC000450588750	FD	On-Demand	Anodyne	DHOD	0	48
Cc1ccc(C(=O)N2CCN3CCOC[C@@H]3C2)c(Cl)c1Cl	ZINC000450588754	EE	On-Demand	Anodyne	P2RX7	21	40
COc1ccc([C@@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588767	GH	On-Demand	Anodyne	NR3C2	23	43
COc1ccc([C@@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588767	GH	On-Demand	Anodyne	TIMP3	49	38
COc1ccc([C@@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588767	GH	On-Demand	Anodyne	PSMB8	46	41
COc1ccc([C@@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588767	GH	On-Demand	Anodyne	PSMB9	0	41
COc1ccc([C@@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588767	GH	On-Demand	Anodyne	PSMB10	0	41
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588768	GH	On-Demand	Anodyne	NR3C2	23	43
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588768	GH	On-Demand	Anodyne	TIMP3	49	38
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588768	GH	On-Demand	Anodyne	PSMB8	46	41
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588768	GH	On-Demand	Anodyne	PSMB9	0	41
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588768	GH	On-Demand	Anodyne	PSMB10	0	41
COc1ccc([C@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588769	GH	On-Demand	Anodyne	NR3C2	23	43
COc1ccc([C@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588769	GH	On-Demand	Anodyne	TIMP3	49	38
COc1ccc([C@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588769	GH	On-Demand	Anodyne	PSMB8	46	41
COc1ccc([C@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588769	GH	On-Demand	Anodyne	PSMB9	0	41
COc1ccc([C@H](OC)[C@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588769	GH	On-Demand	Anodyne	PSMB10	0	41
COc1ccc([C@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588770	GH	On-Demand	Anodyne	NR3C2	23	43
COc1ccc([C@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588770	GH	On-Demand	Anodyne	TIMP3	49	38
COc1ccc([C@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588770	GH	On-Demand	Anodyne	PSMB8	46	41
COc1ccc([C@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588770	GH	On-Demand	Anodyne	PSMB9	0	41
COc1ccc([C@H](OC)[C@@H](C)NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450588770	GH	On-Demand	Anodyne	PSMB10	0	41
COCC(=O)N1CCc2c(NC(=O)Cc3ccc(O)c(OC)c3)cccc21	ZINC000450588773	FE	On-Demand	Anodyne	TRPV1	16	43
CCSc1cccnc1C(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450588784	FF	On-Demand	Anodyne	G2YM83_BOTF4	44	34
Cc1cc(NC[C@@H]2CCCCC2(F)F)nc(-c2cccnc2)n1	ZINC000450588792	DH	On-Demand	Anodyne	ROS1	50	34
Cc1cc(NC[C@H]2CCCCC2(F)F)nc(-c2cccnc2)n1	ZINC000450588793	DH	On-Demand	Anodyne	ROS1	50	34
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCN2CCOC[C@H]2C1	ZINC000450588796	FD	On-Demand	Bother	SLC6A9	0	47
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCN2CCOC[C@@H]2C1	ZINC000450588798	FD	On-Demand	Bother	SLC6A9	0	47
COCC(=O)N1CCc2c(NC(=O)Cc3ccc(Cl)c(OC)c3)cccc21	ZINC000450588803	GG	On-Demand	Anodyne	KCNQ2	33	41
COC1CCC(CCNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450588805	FG	On-Demand	Bother	CACNA1C	48	39
COC1CCC(CCNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450588805	FG	On-Demand	Bother	CACNA1D	81	39
COCCCn1cnnc1SCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450588833	FG	On-Demand	Anodyne	DNAE	49	38
COC1CCC(CCNC(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450588835	DF	On-Demand	Anodyne	EPHB3	35	48
COc1cc(CC(=O)NCCC2CCC(OC)CC2)ccc1O	ZINC000450588836	DF	On-Demand	Anodyne	TRPV1	24	46
COc1cc(CC(=O)NCCC2CCC(OC)CC2)ccc1O	ZINC000450588836	DF	On-Demand	Anodyne	NCE103	32	49
COc1cc(CC(=O)NCCC2CCC(OC)CC2)ccc1O	ZINC000450588836	DF	On-Demand	Anodyne	P96878_MYCTU	22	49
COc1cc(CC(=O)NCCC2CCC(OC)CC2)ccc1O	ZINC000450588836	DF	On-Demand	Anodyne	CAN2	0	49
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450588846	DE	On-Demand	Anodyne	SCN9A	0	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450588846	DE	On-Demand	Anodyne	AMY2	45	32
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450588847	DE	On-Demand	Anodyne	SCN9A	0	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450588847	DE	On-Demand	Anodyne	AMY2	45	32
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450588848	DE	On-Demand	Anodyne	SCN9A	0	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450588848	DE	On-Demand	Anodyne	AMY2	45	32
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450588849	DE	On-Demand	Anodyne	SCN9A	0	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450588849	DE	On-Demand	Anodyne	AMY2	45	32
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCC[C@](C)(O)COC	ZINC000450588859	EE	On-Demand	Bother	CACNA1D	51	34
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCC[C@@](C)(O)COC	ZINC000450588860	EE	On-Demand	Bother	CACNA1D	51	34
CNS(=O)(=O)c1ccc(N[C@@H](CC(C)C)CN2CCCC2)c([N+](=O)[O-])c1	ZINC000450588874	GE	On-Demand	Bother	BCL2L1	113	35
CNS(=O)(=O)c1ccc(N[C@@H](CC(C)C)CN2CCCC2)c([N+](=O)[O-])c1	ZINC000450588874	GE	On-Demand	Bother	BCL2	96	33
CNS(=O)(=O)c1ccc(N[C@@H](CC(C)C)CN2CCCC2)c([N+](=O)[O-])c1	ZINC000450588874	GE	On-Demand	Bother	BCL2L2	51	34
COc1ccc(-n2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450588884	FG	On-Demand	Anodyne	CCKAR	22	41
COc1ccc(-n2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450588884	FG	On-Demand	Anodyne	CCKBR	27	44
COc1ccc(-n2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450588884	FG	On-Demand	Anodyne	CXCR3	24	45
COc1ccc(-n2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450588884	FG	On-Demand	Anodyne	NPBWR1	69	37
COc1ccc(-n2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450588885	FG	On-Demand	Anodyne	CCKAR	22	41
COc1ccc(-n2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450588885	FG	On-Demand	Anodyne	CCKBR	27	44
COc1ccc(-n2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450588885	FG	On-Demand	Anodyne	CXCR3	24	45
COc1ccc(-n2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450588885	FG	On-Demand	Anodyne	NPBWR1	69	37
CNC(=O)c1ccc(NCC[C@](C)(O)COC)c([N+](=O)[O-])c1	ZINC000450588886	DD	On-Demand	Bother	TAAR1	17	48
CNC(=O)c1ccc(NCC[C@@](C)(O)COC)c([N+](=O)[O-])c1	ZINC000450588887	DD	On-Demand	Bother	TAAR1	17	48
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(-n2cnnc2O)c1	ZINC000450588920	EF	On-Demand	Anodyne	PARP10	0	40
CCC[C@@H](CC(C)C)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450588942	FG	On-Demand	Anodyne	KCNQ2	55	41
CCC[C@H](CC(C)C)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450588943	FG	On-Demand	Anodyne	KCNQ2	55	41
O=C([C@H](O)C1CCC1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450588944	EE	On-Demand	Anodyne	LIPE	24	45
O=C([C@H](O)C1CCC1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450588944	EE	On-Demand	Anodyne	LIPG	49	54
O=C([C@@H](O)C1CCC1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450588945	EE	On-Demand	Anodyne	LIPE	24	45
O=C([C@@H](O)C1CCC1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450588945	EE	On-Demand	Anodyne	LIPG	49	54
O=C([C@@H](O)C1CCC1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450588946	EE	On-Demand	Anodyne	LIPE	24	45
O=C([C@@H](O)C1CCC1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450588946	EE	On-Demand	Anodyne	LIPG	49	54
O=C([C@H](O)C1CCC1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450588947	EE	On-Demand	Anodyne	LIPE	24	45
O=C([C@H](O)C1CCC1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450588947	EE	On-Demand	Anodyne	LIPG	49	54
COc1cccc(OCCC(=O)N[C@@]2(C)CCCOC2)c1	ZINC000450588951	CE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N[C@@]2(C)CCCOC2)c1	ZINC000450588951	CE	On-Demand	Anodyne	MTNR1A	35	44
COc1cccc(OCCC(=O)N[C@]2(C)CCCOC2)c1	ZINC000450588952	CE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N[C@]2(C)CCCOC2)c1	ZINC000450588952	CE	On-Demand	Anodyne	MTNR1A	35	44
C[C@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC[C@H]1C	ZINC000450588971	EG	On-Demand	Anodyne	ACE	27	44
C[C@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC[C@H]1C	ZINC000450588971	EG	On-Demand	Anodyne	PREP	60	48
C[C@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC[C@H]1C	ZINC000450588971	EG	On-Demand	Anodyne	XIAP	43	37
C[C@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC[C@H]1C	ZINC000450588971	EG	On-Demand	Anodyne	SFRP1	54	41
C[C@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC[C@H]1C	ZINC000450588971	EG	On-Demand	Anodyne	WNT3	43	41
C[C@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC[C@H]1C	ZINC000450588971	EG	On-Demand	Anodyne	TMPRSS11D	54	35
C[C@@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450588972	EG	On-Demand	Anodyne	ACE	27	44
C[C@@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450588972	EG	On-Demand	Anodyne	PREP	60	48
C[C@@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450588972	EG	On-Demand	Anodyne	XIAP	43	37
C[C@@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450588972	EG	On-Demand	Anodyne	SFRP1	54	41
C[C@@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450588972	EG	On-Demand	Anodyne	WNT3	43	41
C[C@@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450588972	EG	On-Demand	Anodyne	TMPRSS11D	54	35
CCn1c(Cc2ccccc2)nnc1SCc1ccn(CC(F)(F)F)n1	ZINC000450588981	GH	On-Demand	Anodyne	SLC27A1	41	37
COc1cc(CC(=O)N(C)C2CC(O)C2)ccc1O	ZINC000450588997	CC	On-Demand	Anodyne	TRPV1	22	44
COc1cc(CC(=O)N(C)C2CC(O)C2)ccc1O	ZINC000450588997	CC	On-Demand	Anodyne	SELL	0	40
COc1cc(CC(=O)N(C)C2CC(O)C2)ccc1O	ZINC000450588997	CC	On-Demand	Anodyne	NCE103	22	43
COc1cc(CC(=O)N(C)C2CC(O)C2)ccc1O	ZINC000450588997	CC	On-Demand	Anodyne	CAN2	0	43
C[C@@H]1CC[C@H](NC(=O)c2cncc(Cl)c2)C[C@H]1C	ZINC000450589022	CG	On-Demand	Anodyne	MAPK13	44	34
C[C@H]1C[C@H](NC(=O)c2cncc(Cl)c2)CC[C@H]1C	ZINC000450589023	CG	On-Demand	Anodyne	MAPK13	44	34
C[C@@H]1CC[C@@H](NC(=O)c2cncc(Cl)c2)C[C@H]1C	ZINC000450589024	CG	On-Demand	Anodyne	MAPK13	44	34
C[C@H]1C[C@@H](NC(=O)c2cncc(Cl)c2)CC[C@H]1C	ZINC000450589025	CG	On-Demand	Anodyne	MAPK13	44	34
COC(=O)CCN1CCN(C(=O)c2cnn3ccc(C)cc23)C[C@@H]1C	ZINC000450589048	ED	On-Demand	Anodyne	EPHB3	19	40
COC(=O)CCN1CCN(C(=O)c2cnn3ccc(C)cc23)C[C@H]1C	ZINC000450589060	ED	On-Demand	Anodyne	EPHB3	19	40
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@@H](CO)C(C)(C)C	ZINC000450589099	CE	On-Demand	Anodyne	AOC3	24	41
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H](CO)C(C)(C)C	ZINC000450589102	CE	On-Demand	Anodyne	AOC3	24	41
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@@H](CO)C(C)(C)C	ZINC000450589104	CE	On-Demand	Anodyne	AOC3	24	41
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H](CO)C(C)(C)C	ZINC000450589106	CE	On-Demand	Anodyne	AOC3	24	41
Cc1nc(-c2cccnc2)nc(NC[C@@H]2CCCN2CCCO)c1C	ZINC000450589107	ED	On-Demand	Anodyne	ROS1	41	35
Cc1nc(-c2cccnc2)nc(NC[C@H]2CCCN2CCCO)c1C	ZINC000450589115	ED	On-Demand	Anodyne	ROS1	41	35
CCCN(CC(=O)OC(C)(C)C)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450589128	EF	On-Demand	Anodyne	POL	0	44
CCCN(CC(=O)OC(C)(C)C)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450589130	EF	On-Demand	Anodyne	POL	0	44
COC(=O)c1cn(C2CCN(C(=O)Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450589137	GE	On-Demand	Anodyne	OPRK1	39	40
COC(=O)c1cn(C2CCN(C(=O)Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450589137	GE	On-Demand	Anodyne	CCR3	22	40
COC(=O)CCN1CCN(C(=O)c2cc(-c3ccccc3)nn2C)C[C@@H]1C	ZINC000450589152	FD	On-Demand	Anodyne	P2RY12	141	34
COC(=O)CCN1CCN(C(=O)c2cc(-c3ccccc3)nn2C)C[C@H]1C	ZINC000450589153	FD	On-Demand	Anodyne	P2RY12	141	34
COc1cc2c(NC[C@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589163	ED	On-Demand	Anodyne	EGFR	34	43
COc1cc2c(NC[C@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589163	ED	On-Demand	Anodyne	FGFR1	21	43
COc1cc2c(NC[C@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589163	ED	On-Demand	Anodyne	AURKB	43	46
COc1cc2c(NC[C@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589163	ED	On-Demand	Anodyne	FLT1	32	43
COc1cc2c(NC[C@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589163	ED	On-Demand	Anodyne	AURKA	43	46
COc1cc2c(NC[C@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589163	ED	On-Demand	Anodyne	EPHA2	40	34
COc1cc2c(NC[C@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589163	ED	On-Demand	Anodyne	EHMT2	53	31
COc1cc2c(NC[C@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589163	ED	On-Demand	Anodyne	ACKR3	45	32
COc1cc2c(NC[C@@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589164	ED	On-Demand	Anodyne	EGFR	34	43
COc1cc2c(NC[C@@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589164	ED	On-Demand	Anodyne	FGFR1	21	43
COc1cc2c(NC[C@@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589164	ED	On-Demand	Anodyne	AURKB	43	46
COc1cc2c(NC[C@@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589164	ED	On-Demand	Anodyne	FLT1	32	43
COc1cc2c(NC[C@@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589164	ED	On-Demand	Anodyne	AURKA	43	46
COc1cc2c(NC[C@@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589164	ED	On-Demand	Anodyne	EPHA2	40	34
COc1cc2c(NC[C@@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589164	ED	On-Demand	Anodyne	EHMT2	53	31
COc1cc2c(NC[C@@H]3CCCN3CCCO)ncnc2cc1F	ZINC000450589164	ED	On-Demand	Anodyne	ACKR3	45	32
COC(=O)CCN1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C[C@@H]1C	ZINC000450589168	FD	On-Demand	Anodyne	HRH3	27	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C[C@H]1C	ZINC000450589169	FD	On-Demand	Anodyne	HRH3	27	40
COC(=O)CCN1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C[C@@H]1C	ZINC000450589170	FD	On-Demand	Anodyne	HRH3	27	40
COC(=O)CCN1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C[C@H]1C	ZINC000450589171	FD	On-Demand	Anodyne	HRH3	27	40
N#Cc1ccc(NC[C@@H]2CCCN2CCCO)cc1C(F)(F)F	ZINC000450589176	EF	On-Demand	Mild	AR	35	40
N#Cc1ccc(NC[C@H]2CCCN2CCCO)cc1C(F)(F)F	ZINC000450589177	EF	On-Demand	Mild	AR	35	40
Cc1cc(CNC(=O)c2cc3n(n2)CCCC3)ccc1Cl	ZINC000450589228	DG	On-Demand	Anodyne	CNR2	19	47
Cc1cc(CNC(=O)c2cc3n(n2)CCCC3)ccc1Cl	ZINC000450589228	DG	On-Demand	Anodyne	P2RX7	20	40
Cc1cc(CNC(=O)c2cc3n(n2)CCCC3)ccc1Cl	ZINC000450589228	DG	On-Demand	Anodyne	RPA1	55	36
Cc1cc(CNC(=O)CC2(O)CCC2)ccc1Cl	ZINC000450589233	CF	On-Demand	Anodyne	P2RX7	19	44
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	HTR1A	100	49
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	ADRA2A	15	41
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	DRD2	99	53
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	DRD1	47	43
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	DRD4	46	59
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	ADRA1D	73	45
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	HTR1B	16	40
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	HTR2A	60	44
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	HTR2C	32	41
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	ADRA1A	54	42
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	ADRA1B	38	41
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	DRD3	86	62
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	HTR7	80	44
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	SIGMAR1	19	43
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	ABCB1	0	46
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	AP2S1	0	43
CCc1cc(CCCN2CCN(c3ccccc3OCCOC)CC2)on1	ZINC000450589258	FG	On-Demand	Anodyne	ALPHA-1A	0	43
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCC1=CCCCC1	ZINC000450589269	GF	On-Demand	Bother	DDIT3	0	42
CC[C@H](CO)N(C)c1nc(-c2ccc(OC)cc2)no1	ZINC000450589277	CD	On-Demand	Anodyne	LUCI_PHOPE	17	45
CC[C@@H](CO)N(C)c1nc(-c2ccc(OC)cc2)no1	ZINC000450589278	CD	On-Demand	Anodyne	LUCI_PHOPE	17	45
COCC(=O)N1CCc2c(NC(=O)Cc3ccc(C(=O)OC)cc3)cccc21	ZINC000450589295	GE	On-Demand	Anodyne	KCNQ2	28	40
Cc1csc([C@H](C)CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)n1	ZINC000450589296	EI	On-Demand	Anodyne	SCN9A	22	40
Cc1csc([C@H](C)CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)n1	ZINC000450589297	EI	On-Demand	Anodyne	SCN9A	22	40
Cc1csc([C@H](C)CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)n1	ZINC000450589298	EI	On-Demand	Anodyne	SCN9A	22	40
Cc1csc([C@H](C)CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)n1	ZINC000450589299	EI	On-Demand	Anodyne	SCN9A	22	40
COCC(=O)N1CCc2c(NC(=O)c3cnc(C4CC4)nc3)cccc21	ZINC000450589304	FE	On-Demand	Anodyne	CYSLTR2	41	31
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	HTR1A	96	44
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	DRD2	75	42
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	DRD4	37	40
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	ADRA1D	80	39
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	HTR2A	30	43
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	ADRA1A	75	42
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	ADRA1B	61	40
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	DRD3	70	39
COCCOc1ccccc1N1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450589306	GG	On-Demand	Anodyne	HTR7	52	40
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	HTR1A	96	44
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	DRD2	75	42
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	DRD4	37	40
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	ADRA1D	80	39
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	HTR2A	30	43
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	ADRA1A	75	42
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	ADRA1B	61	40
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	DRD3	70	39
COCCOc1ccccc1N1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450589307	GG	On-Demand	Anodyne	HTR7	52	40
CCC[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450589311	ED	On-Demand	Anodyne	NPY1R	42	34
CCC[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450589311	ED	On-Demand	Anodyne	NPY2R	46	36
CCC[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450589312	ED	On-Demand	Anodyne	NPY1R	42	34
CCC[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450589312	ED	On-Demand	Anodyne	NPY2R	46	36
O=S(=O)(c1ccc(NC[C@@H]2CCCCC2(F)F)nc1)N1CCCCC1	ZINC000450589316	FF	On-Demand	Anodyne	EPHX2	18	41
O=S(=O)(c1ccc(NC[C@H]2CCCCC2(F)F)nc1)N1CCCCC1	ZINC000450589317	FF	On-Demand	Anodyne	EPHX2	18	41
Cc1csc([C@H](C)CNC(=O)Cc2ccc(O)c(F)c2)n1	ZINC000450589320	DF	On-Demand	Anodyne	TRPV1	23	52
Cc1csc([C@@H](C)CNC(=O)Cc2ccc(O)c(F)c2)n1	ZINC000450589321	DF	On-Demand	Anodyne	TRPV1	23	52
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCCCC1(F)F	ZINC000450589322	FE	On-Demand	Anodyne	CA2	33	49
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCCCC1(F)F	ZINC000450589323	FE	On-Demand	Anodyne	CA2	33	49
CCSc1cccnc1C(=O)Nc1nc(C2CCCC2)c(C(=O)OC)s1	ZINC000450589325	GI	On-Demand	Anodyne	MAP1	65	37
CCC(=O)CCCN(C)Cc1nc(-c2cccnc2)no1	ZINC000450589331	CE	On-Demand	Anodyne	TSPO	15	44
CCc1nn(C)cc1CNC(=O)CCOc1cccc(OC)c1	ZINC000450589337	DE	On-Demand	Anodyne	MTNR1A	63	43
CCc1nn(C)cc1CNC(=O)CCOc1cccc(OC)c1	ZINC000450589337	DE	On-Demand	Anodyne	MTNR1B	50	43
COC[C@@](C)(O)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450589341	ED	On-Demand	Anodyne	ACACB	26	42
COC[C@@](C)(O)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450589341	ED	On-Demand	Anodyne	METG	86	35
COC[C@@](C)(O)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450589341	ED	On-Demand	Anodyne	TNKS	56	31
COC[C@](C)(O)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450589342	ED	On-Demand	Anodyne	ACACB	26	42
COC[C@](C)(O)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450589342	ED	On-Demand	Anodyne	METG	86	35
COC[C@](C)(O)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450589342	ED	On-Demand	Anodyne	TNKS	56	31
CC(C)CCNS(=O)(=O)c1ccc(N2CCOC[C@@H]2C)nc1	ZINC000450589343	ED	On-Demand	Anodyne	MTOR	24	40
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589356	GE	On-Demand	Anodyne	DRD3	22	41
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589356	GE	On-Demand	Anodyne	CYSLTR1	40	33
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589356	GE	On-Demand	Anodyne	CPT1A	45	31
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589356	GE	On-Demand	Anodyne	PLK1	41	35
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589356	GE	On-Demand	Anodyne	HPGD	47	55
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589357	GE	On-Demand	Anodyne	DRD3	22	41
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589357	GE	On-Demand	Anodyne	CYSLTR1	40	33
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589357	GE	On-Demand	Anodyne	CPT1A	45	31
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589357	GE	On-Demand	Anodyne	PLK1	41	35
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450589357	GE	On-Demand	Anodyne	HPGD	47	55
COC[C@@](C)(O)CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450589375	FD	On-Demand	Anodyne	LRRK2	29	41
COC[C@](C)(O)CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450589377	FD	On-Demand	Anodyne	LRRK2	29	41
CCC[C@@H]1CCCCN1C(=O)c1cccc(C#N)c1Br	ZINC000450589392	EI	On-Demand	Mild	HCRTR1	17	45
CCC[C@@H]1CCCCN1C(=O)c1cccc(C#N)c1Br	ZINC000450589392	EI	On-Demand	Mild	HCRTR2	16	45
CCC[C@H]1CCCCN1C(=O)c1cccc(C#N)c1Br	ZINC000450589394	EI	On-Demand	Mild	HCRTR1	17	45
CCC[C@H]1CCCCN1C(=O)c1cccc(C#N)c1Br	ZINC000450589394	EI	On-Demand	Mild	HCRTR2	16	45
CC(C)(C)[C@@H](CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450589395	CD	On-Demand	Anodyne	CAN2	0	40
CC(C)(C)[C@H](CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450589396	CD	On-Demand	Anodyne	CAN2	0	40
CC(C)NS(=O)(=O)[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450589428	ED	On-Demand	Anodyne	BIRC2	40	37
CC(C)NS(=O)(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450589429	ED	On-Demand	Anodyne	BIRC2	40	37
Cc1cc(C)nc(N2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450589430	CC	On-Demand	Anodyne	SORD	36	40
CC(C)NS(=O)(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450589431	ED	On-Demand	Anodyne	BIRC2	40	37
CC(C)NS(=O)(=O)[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450589432	ED	On-Demand	Anodyne	BIRC2	40	37
Cc1cc(C)nc(N2CCN(CC[C@H](C)O)CC2)n1	ZINC000450589437	CC	On-Demand	Anodyne	SORD	36	40
COC[C@@](C)(O)CCNc1ncnc2c1ncn2C1CC1	ZINC000450589439	CD	On-Demand	Anodyne	ADORA1	51	42
COC[C@@](C)(O)CCNc1ncnc2c1ncn2C1CC1	ZINC000450589439	CD	On-Demand	Anodyne	ADORA2A	23	42
COC[C@@](C)(O)CCNc1ncnc2c1ncn2C1CC1	ZINC000450589439	CD	On-Demand	Anodyne	ADORA3	66	36
COC[C@](C)(O)CCNc1ncnc2c1ncn2C1CC1	ZINC000450589442	CD	On-Demand	Anodyne	ADORA1	51	42
COC[C@](C)(O)CCNc1ncnc2c1ncn2C1CC1	ZINC000450589442	CD	On-Demand	Anodyne	ADORA2A	23	42
COC[C@](C)(O)CCNc1ncnc2c1ncn2C1CC1	ZINC000450589442	CD	On-Demand	Anodyne	ADORA3	66	36
Cc1cccc(Cl)c1CNC1(CO)CCCC1	ZINC000450589449	CG	On-Demand	Anodyne	EIF2AK1	41	36
COc1nccc(CNc2cc(C(F)(F)F)nc3ncnn23)n1	ZINC000450589451	ED	On-Demand	Anodyne	DHOD	0	52
CO[C@H](COc1ccc(CO)cc1)Cc1ccccc1	ZINC000450589454	CF	On-Demand	Anodyne	LTA4H	31	42
CO[C@H](COc1ccc(CO)cc1)Cc1ccccc1	ZINC000450589454	CF	On-Demand	Anodyne	SLC15A1	0	40
CO[C@H](COc1ccc(CO)cc1)Cc1ccccc1	ZINC000450589454	CF	On-Demand	Anodyne	FFAR4	40	35
CO[C@H](COc1ccc(CO)cc1)Cc1ccccc1	ZINC000450589454	CF	On-Demand	Anodyne	PDS	55	41
CO[C@@H](COc1ccc(CO)cc1)Cc1ccccc1	ZINC000450589456	CF	On-Demand	Anodyne	LTA4H	31	42
CO[C@@H](COc1ccc(CO)cc1)Cc1ccccc1	ZINC000450589456	CF	On-Demand	Anodyne	SLC15A1	0	40
CO[C@@H](COc1ccc(CO)cc1)Cc1ccccc1	ZINC000450589456	CF	On-Demand	Anodyne	FFAR4	40	35
CO[C@@H](COc1ccc(CO)cc1)Cc1ccccc1	ZINC000450589456	CF	On-Demand	Anodyne	PDS	55	41
CS(=O)(=O)c1ccc(N2CCc3c(Cl)cc(F)cc3C2)c(F)c1	ZINC000450589473	FH	On-Demand	Anodyne	SLC6A9	22	43
C[C@H](c1ccc(CN2C(=O)C(=O)N(C3CCCC3)C2=O)cc1)C(F)(F)F	ZINC000450589514	FH	On-Demand	Anodyne	CACNA1D	46	39
CC(C)CC(CC(C)C)C(=O)NC[C@@H](C)c1nccs1	ZINC000450589515	CI	On-Demand	Anodyne	HPN	48	33
CC(C)CC(CC(C)C)C(=O)NC[C@H](C)c1nccs1	ZINC000450589517	CI	On-Demand	Anodyne	HPN	50	33
CS(=O)(=O)c1ccc(NCc2cc(C3CC3)ccc2F)c(F)c1	ZINC000450589523	EH	On-Demand	Anodyne	GPR119	23	43
C[C@@H](c1ccc(CN2C(=O)C(=O)N(C3CCCC3)C2=O)cc1)C(F)(F)F	ZINC000450589526	FH	On-Demand	Anodyne	CACNA1D	46	39
COC[C@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589527	FF	On-Demand	Anodyne	COLA	42	35
COC[C@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589527	FF	On-Demand	Anodyne	CPT1A	54	31
COC[C@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589527	FF	On-Demand	Anodyne	CSF1R	23	41
COC[C@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589527	FF	On-Demand	Anodyne	TAAR1	24	46
COC[C@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589527	FF	On-Demand	Anodyne	KCNK3	67	39
COC[C@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589527	FF	On-Demand	Anodyne	KCNK9	64	39
COC[C@@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589530	FF	On-Demand	Anodyne	COLA	42	35
COC[C@@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589530	FF	On-Demand	Anodyne	CPT1A	54	31
COC[C@@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589530	FF	On-Demand	Anodyne	CSF1R	23	41
COC[C@@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589530	FF	On-Demand	Anodyne	TAAR1	24	46
COC[C@@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589530	FF	On-Demand	Anodyne	KCNK3	67	39
COC[C@@](C)(O)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450589530	FF	On-Demand	Anodyne	KCNK9	64	39
COc1nccc(CNc2cc(N3CCCCC3)ncn2)n1	ZINC000450589531	DD	On-Demand	Anodyne	GALR2	44	35
CCSc1cccnc1C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450589532	GF	On-Demand	Anodyne	G2YM83_BOTF4	51	36
C[C@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2OCC[C@@H]2C)C1	ZINC000450589618	CE	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2OCC[C@@H]2C)C1	ZINC000450589619	CE	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1CCO[C@H]1C(=O)N1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450589620	CE	On-Demand	Anodyne	CHRNA2	39	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCCOC(C)C	ZINC000450589621	CG	On-Demand	Anodyne	PPARA	23	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCCOC(C)C	ZINC000450589621	CG	On-Demand	Anodyne	PPARD	38	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCCOC(C)C	ZINC000450589621	CG	On-Demand	Anodyne	MTTP	40	34
CC(=O)N[C@H](C(=O)NCCOC(C)C)C(C)(C)C	ZINC000450589626	CD	On-Demand	Anodyne	PROTEASE	18	41
COC(=O)CCN1CCN(C(=O)c2c(C)cccc2Cl)C[C@H]1C	ZINC000450589646	EE	On-Demand	Anodyne	CCR5	25	43
COC(=O)CCN1CCN(C(=O)c2c(C)cccc2Cl)C[C@@H]1C	ZINC000450589647	EE	On-Demand	Anodyne	CCR5	25	43
COC[C@@](C)(O)CCNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450589650	CD	On-Demand	Bother	TAAR1	17	47
COC[C@](C)(O)CCNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450589651	CD	On-Demand	Bother	TAAR1	17	47
COc1ccc(CNC(=O)CCN(C)Cc2nc3ccccc3o2)c(OC)c1	ZINC000450589660	GF	On-Demand	Anodyne	MTNR1A	65	37
COc1ccc(CNC(=O)CCN(C)Cc2nc3ccccc3o2)c(OC)c1	ZINC000450589660	GF	On-Demand	Anodyne	MTNR1B	60	36
CCn1c(Cc2ccccc2)nnc1SCC1CC(F)(F)C1	ZINC000450589669	DI	On-Demand	Anodyne	SLC27A1	41	33
CCCOc1ccc(C(=O)Nc2cccc3c2CCN3C(=O)COC)c(OC)c1	ZINC000450589673	GG	On-Demand	Anodyne	CYSLTR2	45	32
Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCc2ccc(Cl)c(C)c2)CC3)c1	ZINC000450589696	GI	On-Demand	Anodyne	P2RX7	35	41
Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCc2ccc(Cl)c(C)c2)CC3)c1	ZINC000450589696	GI	On-Demand	Anodyne	EPHX2	26	50
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@@H](c1ccccc1)[C@@H]1CCOC1	ZINC000450589700	GG	On-Demand	Anodyne	CASR	0	51
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCc2ccc(Cl)c(C)c2)CC3)c1	ZINC000450589701	GI	On-Demand	Anodyne	P2RX7	35	41
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCc2ccc(Cl)c(C)c2)CC3)c1	ZINC000450589701	GI	On-Demand	Anodyne	EPHX2	26	50
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@H](c1ccccc1)[C@@H]1CCOC1	ZINC000450589710	GG	On-Demand	Anodyne	CASR	0	51
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@H](c1ccccc1)[C@H]1CCOC1	ZINC000450589713	GG	On-Demand	Anodyne	CASR	0	51
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@@H](c1ccccc1)[C@H]1CCOC1	ZINC000450589714	GG	On-Demand	Anodyne	CASR	0	51
CN1C(=O)CC[C@H]1C(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450589721	DE	On-Demand	Anodyne	P2RX7	26	48
CN1C(=O)CC[C@@H]1C(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450589722	DE	On-Demand	Anodyne	P2RX7	26	48
C/C=C/COc1cccc(CC(=O)N2CCN(CC)C(=O)C2)c1	ZINC000450589753	DD	On-Demand	Anodyne	BRS3	16	40
C/C=C\COc1cccc(CC(=O)N2CCN(CC)C(=O)C2)c1	ZINC000450589755	DD	On-Demand	Anodyne	BRS3	16	40
CCc1cc(N[C@@H](CC)COCC(F)(F)F)n2ncnc2n1	ZINC000450589761	DE	On-Demand	Anodyne	DHOD	0	54
CC(=O)CCCCCN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O	ZINC000450589770	EE	On-Demand	Anodyne	AKR1B1	24	52
CCc1cc(N[C@H](CC)COCC(F)(F)F)n2ncnc2n1	ZINC000450589774	DE	On-Demand	Anodyne	DHOD	0	54
CCN1CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1=O	ZINC000450589780	GE	On-Demand	Anodyne	PDGFRB	17	41
CCN1CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1=O	ZINC000450589780	GE	On-Demand	Anodyne	HPGD	59	69
CC(=O)CCCCCN1C(=O)N[C@]2(CCOc3ccccc32)C1=O	ZINC000450589784	EE	On-Demand	Anodyne	AKR1B1	24	52
CC(C)(C)[C@H](CCO)NC(=O)CCc1ccc2c(c1)OCCO2	ZINC000450589813	DE	On-Demand	Anodyne	LUXR	30	43
CC(C)(C)[C@@H](CCO)NC(=O)CCc1ccc2c(c1)OCCO2	ZINC000450589820	DE	On-Demand	Anodyne	LUXR	30	43
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)c3nc(C)cs3)nc2)c1	ZINC000450589844	GI	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)c3nc(C)cs3)nc2)c1	ZINC000450589844	GI	On-Demand	Anodyne	MTNR1B	19	40
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)c3nc(C)cs3)nc2)c1	ZINC000450589846	GI	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)c3nc(C)cs3)nc2)c1	ZINC000450589846	GI	On-Demand	Anodyne	MTNR1B	19	40
O=C(c1cc(F)c(N2CCOCC2)c(F)c1)N1CCN2CCOC[C@@H]2C1	ZINC000450589855	FC	On-Demand	Anodyne	L3MBTL1	0	41
CCCOc1ccc2c(c1)CCN(CC1(C(=O)OC)CC1)C2	ZINC000450589866	DF	On-Demand	Anodyne	HRH3	16	47
O=C(c1cc(F)c(N2CCOCC2)c(F)c1)N1CCN2CCOC[C@H]2C1	ZINC000450589868	FC	On-Demand	Anodyne	L3MBTL1	0	41
COc1ccc2c(c1)N(CC[C@@H](C)O)CCCC2	ZINC000450589871	BF	On-Demand	Anodyne	DRD5	16	41
COc1ccc2c(c1)N(CC[C@H](C)O)CCCC2	ZINC000450589874	BF	On-Demand	Anodyne	DRD5	16	41
CCOC(=O)c1ccc(CN(C)Cc2nc3ccccc3o2)nc1	ZINC000450589875	EG	On-Demand	Anodyne	SLC27A1	17	40
COCCNC(=O)c1ccc(NC[C@@H]2CCCN2CCCO)nc1	ZINC000450589879	EC	On-Demand	Anodyne	IKBKB	0	47
CC(C)c1nnc(CSc2nc3ccc(Cl)cc3[nH]2)s1	ZINC000450589880	DI	On-Demand	Anodyne	CYP2C8	26	40
CC(C)c1nnc(CSc2nc3ccc(Cl)cc3[nH]2)s1	ZINC000450589880	DI	On-Demand	Anodyne	CYP1A2	16	41
CC(C)c1nnc(CSc2nc3ccc(Cl)cc3[nH]2)s1	ZINC000450589880	DI	On-Demand	Anodyne	CYP2C19	36	47
COCCNC(=O)c1ccc(NC[C@H]2CCCN2CCCO)nc1	ZINC000450589888	EC	On-Demand	Anodyne	IKBKB	0	47
C[C@H]1CCC[C@@H](CO)N1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450589893	CE	On-Demand	Anodyne	SLC18A2	82	40
C[C@H](c1ccccc1)[C@H](O)CN1[C@H](C)CCC[C@@H]1CO	ZINC000450589895	CE	On-Demand	Anodyne	SLC18A2	82	40
C[C@H](c1ccccc1)[C@H](O)CN1[C@H](CO)CCC[C@H]1C	ZINC000450589897	CE	On-Demand	Anodyne	SLC18A2	82	40
C[C@H]1CCC[C@H](CO)N1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450589898	CE	On-Demand	Anodyne	SLC18A2	82	40
COC(=O)C1(CN(C)Cc2nc(-c3cccnc3)no2)CC1	ZINC000450589905	DD	On-Demand	Anodyne	SOAT1	40	31
CCO[C@H]1COCC[C@H]1NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450589906	EE	On-Demand	Anodyne	INHA	61	32
CCO[C@@H]1COCC[C@H]1NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450589908	EE	On-Demand	Anodyne	INHA	61	32
CCO[C@@H]1COCC[C@@H]1NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450589909	EE	On-Demand	Anodyne	INHA	61	32
CCO[C@H]1COCC[C@@H]1NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450589910	EE	On-Demand	Anodyne	INHA	61	32
Cc1csc([C@@H](C)CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450589922	FI	On-Demand	Anodyne	RBP4	59	36
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	HTR1A	105	57
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	ADRA2A	15	42
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	DRD2	106	62
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	DRD1	40	47
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	DRD4	73	54
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	HRH2	34	44
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	ADRA1D	82	43
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	HTR1D	30	42
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	HTR2A	55	45
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	HTR2C	23	41
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	SLC6A4	22	42
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	ADRA1A	56	43
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	HRH1	17	44
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	ADRA1B	45	43
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	DRD3	91	56
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	HTR7	67	45
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	SIGMAR1	21	45
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	ABCB1	52	38
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	AP2S1	0	44
COCCOc1ccccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450589928	FG	On-Demand	Anodyne	ALPHA-1A	0	47
COC(=O)C[C@@H]1CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450589936	CE	On-Demand	Anodyne	SLC6A1	0	40
COC(=O)C[C@@H]1CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450589936	CE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)C[C@@H]1CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450589936	CE	On-Demand	Anodyne	SLC18A2	37	42
COC(=O)C[C@@H]1CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450589937	CE	On-Demand	Anodyne	SLC6A1	0	40
COC(=O)C[C@@H]1CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450589937	CE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)C[C@@H]1CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450589937	CE	On-Demand	Anodyne	SLC18A2	37	42
COC(=O)C[C@@H]1CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450589938	CE	On-Demand	Anodyne	SLC6A1	0	40
COC(=O)C[C@@H]1CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450589938	CE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)C[C@@H]1CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450589938	CE	On-Demand	Anodyne	SLC18A2	37	42
COC(=O)C[C@@H]1CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450589939	CE	On-Demand	Anodyne	SLC6A1	0	40
COC(=O)C[C@@H]1CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450589939	CE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)C[C@@H]1CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450589939	CE	On-Demand	Anodyne	SLC18A2	37	42
CC(C)(C)[C@H](CCO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450589957	EH	On-Demand	Anodyne	MC4R	18	43
CC(C)(C)[C@H](CCO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450589957	EH	On-Demand	Anodyne	MC3R	32	43
CC(C)(C)[C@H](CCO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450589957	EH	On-Demand	Anodyne	MC5R	27	43
CC(C)(C)[C@H](CCO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450589958	EH	On-Demand	Anodyne	MC4R	18	43
CC(C)(C)[C@H](CCO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450589958	EH	On-Demand	Anodyne	MC3R	32	43
CC(C)(C)[C@H](CCO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450589958	EH	On-Demand	Anodyne	MC5R	27	43
CC(C)(C)[C@H](CCO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450589959	EH	On-Demand	Anodyne	MC4R	18	43
CC(C)(C)[C@H](CCO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450589959	EH	On-Demand	Anodyne	MC3R	32	43
CC(C)(C)[C@H](CCO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450589959	EH	On-Demand	Anodyne	MC5R	27	43
CC(C)(C)[C@H](CCO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450589960	EH	On-Demand	Anodyne	MC4R	18	43
CC(C)(C)[C@H](CCO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450589960	EH	On-Demand	Anodyne	MC3R	32	43
CC(C)(C)[C@H](CCO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450589960	EH	On-Demand	Anodyne	MC5R	27	43
CCC[C@@H]1CCCCN1C(=O)c1cc(O)ccc1F	ZINC000450589973	CG	For-Sale	Anodyne	HCRTR1	20	43
CCC[C@H]1CCCCN1C(=O)c1cc(O)ccc1F	ZINC000450589974	CG	For-Sale	Anodyne	HCRTR1	20	43
CCc1cc(NCc2cc(C3CC3)ccc2F)n2ncnc2n1	ZINC000450590018	DG	On-Demand	Anodyne	DHOD	0	50
CCOc1ccc2c(c1)CCN(Cc1cnn[nH]1)C2	ZINC000450590019	CD	On-Demand	Anodyne	HRH3	15	46
CCOc1ccc2c(c1)CCN(Cc1cnn[nH]1)C2	ZINC000450590019	CD	On-Demand	Anodyne	NOD2	34	42
O=[N+]([O-])c1ccc(NCc2cc(C3CC3)ccc2F)cn1	ZINC000450590038	CH	On-Demand	Bother	PRKCQ	22	42
CCC[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590040	DH	On-Demand	Anodyne	HCRTR1	0	48
CCC[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590040	DH	On-Demand	Anodyne	COLA	97	39
CCC[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590040	DH	On-Demand	Anodyne	HCRTR2	0	48
COC[C@@](C)(O)CCN=c1c(C#N)c[nH]c2c(F)ccc(Cl)c12	ZINC000450590059	EF	On-Demand	Mild	HSP90AB1	54	34
COC[C@](C)(O)CCN=c1c(C#N)c[nH]c2c(F)ccc(Cl)c12	ZINC000450590060	EF	On-Demand	Mild	HSP90AB1	54	34
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450590077	DG	On-Demand	Anodyne	HRP1_PLAFA	94	33
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450590077	DG	On-Demand	Anodyne	HNMT	50	35
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450590077	DG	On-Demand	Anodyne	BOTA	18	40
COC[C@](C)(O)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450590078	DG	On-Demand	Anodyne	HRP1_PLAFA	94	33
COC[C@](C)(O)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450590078	DG	On-Demand	Anodyne	HNMT	50	35
COC[C@](C)(O)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450590078	DG	On-Demand	Anodyne	BOTA	18	40
COC[C@@](C)(O)CCNc1ccnc2cc(Br)ccc12	ZINC000450590103	EG	On-Demand	Anodyne	HRP1_PLAFA	87	33
COC[C@@](C)(O)CCNc1ccnc2cc(Br)ccc12	ZINC000450590103	EG	On-Demand	Anodyne	HNMT	50	35
COC[C@](C)(O)CCNc1ccnc2cc(Br)ccc12	ZINC000450590104	EG	On-Demand	Anodyne	HRP1_PLAFA	87	33
COC[C@](C)(O)CCNc1ccnc2cc(Br)ccc12	ZINC000450590104	EG	On-Demand	Anodyne	HNMT	50	35
CCOC(=O)[C@@](C)(O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590132	ED	On-Demand	Anodyne	P2RY12	58	36
CCOC(=O)[C@@](C)(O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590132	ED	On-Demand	Anodyne	CTSV	48	33
CCOC(=O)[C@](C)(O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590133	ED	On-Demand	Anodyne	P2RY12	58	36
CCOC(=O)[C@](C)(O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590133	ED	On-Demand	Anodyne	CTSV	48	33
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	HTR1A	114	44
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	DRD2	92	44
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	DRD1	40	42
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	DRD4	45	44
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	ADRA1D	104	46
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	HTR2A	37	41
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	ADRA1A	95	46
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	ADRA1B	73	43
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	DRD3	85	43
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	HTR7	70	42
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	ABCB1	59	44
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	HSP90AB1	37	44
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	AP2S1	0	42
COCCOc1ccccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450590177	FD	On-Demand	Anodyne	ALPHA-1A	0	41
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	HTR1A	114	44
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	DRD2	92	44
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	DRD1	40	42
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	DRD4	45	44
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	ADRA1D	104	46
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	HTR2A	37	41
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	ADRA1A	95	46
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	ADRA1B	73	43
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	DRD3	85	43
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	HTR7	70	42
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	ABCB1	59	44
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	HSP90AB1	37	44
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	AP2S1	0	42
COCCOc1ccccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450590179	FD	On-Demand	Anodyne	ALPHA-1A	0	41
CCc1nc2ccccc2n1C1CCN(C(=O)[C@@H](O)C2CCC2)CC1	ZINC000450590182	EF	On-Demand	Anodyne	FPR2	36	51
CCc1nc2ccccc2n1C1CCN(C(=O)[C@H](O)C2CCC2)CC1	ZINC000450590183	EF	On-Demand	Anodyne	FPR2	36	51
COc1cc(CC(=O)N2CCN3CCOC[C@H]3C2)ccc1Cl	ZINC000450590184	DD	On-Demand	Anodyne	OPRK1	39	42
COc1cc(CC(=O)N2CCN3CCOC[C@@H]3C2)ccc1Cl	ZINC000450590185	DD	On-Demand	Anodyne	OPRK1	39	42
FCC(CF)Nc1ncnc2cc(Cl)ccc12	ZINC000450590197	CG	On-Demand	Anodyne	EGFR	31	40
FCC(CF)Nc1ncnc2cc(Cl)ccc12	ZINC000450590197	CG	On-Demand	Anodyne	HNMT	41	32
FCC(CF)Nc1ncnc2cc(Cl)ccc12	ZINC000450590197	CG	On-Demand	Anodyne	HTT	0	48
CSc1ccc2ncnc(NC(CF)CF)c2c1	ZINC000450590205	CG	On-Demand	Anodyne	CLK4	64	37
CSc1ccc2ncnc(NC(CF)CF)c2c1	ZINC000450590205	CG	On-Demand	Anodyne	CD38	51	40
CSc1ccc2ncnc(NC(CF)CF)c2c1	ZINC000450590205	CG	On-Demand	Anodyne	HTT	0	43
CSc1ccc2ncnc(NC(CF)CF)c2c1	ZINC000450590205	CG	On-Demand	Anodyne	USP10	0	46
CSc1ccc2ncnc(NC(CF)CF)c2c1	ZINC000450590205	CG	On-Demand	Anodyne	USP13	0	46
CC(C)C[C@@H](CN1CCCC1)Nc1nc(O)c2ccccc2n1	ZINC000450590230	DF	On-Demand	Anodyne	CACNA2D1	18	46
CC(C)C[C@@H](CN1CCCC1)Nc1nc(O)c2ccccc2n1	ZINC000450590230	DF	On-Demand	Anodyne	HNMT	60	35
CS(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450590252	CD	On-Demand	Bother	BDKRB1	23	47
CS(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450590252	CD	On-Demand	Bother	BCL2L1	72	35
CS(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450590252	CD	On-Demand	Bother	BCL2	40	33
COc1cc(CC(=O)NC[C@H](C)c2nc(C)cs2)ccc1O	ZINC000450590257	DF	On-Demand	Anodyne	TRPV1	28	54
COc1cc(CC(=O)NC[C@H](C)c2nc(C)cs2)ccc1O	ZINC000450590257	DF	On-Demand	Anodyne	NCE103	23	42
COc1cc(CC(=O)NC[C@H](C)c2nc(C)cs2)ccc1O	ZINC000450590257	DF	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)NC[C@@H](C)c2nc(C)cs2)ccc1O	ZINC000450590263	DF	On-Demand	Anodyne	TRPV1	28	54
COc1cc(CC(=O)NC[C@@H](C)c2nc(C)cs2)ccc1O	ZINC000450590263	DF	On-Demand	Anodyne	NCE103	23	42
COc1cc(CC(=O)NC[C@@H](C)c2nc(C)cs2)ccc1O	ZINC000450590263	DF	On-Demand	Anodyne	CAN2	0	42
COC(=O)CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@H]1C	ZINC000450590287	FF	On-Demand	Anodyne	CACNA1B	40	33
COC(=O)CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@H]1C	ZINC000450590287	FF	On-Demand	Anodyne	LIPG	50	35
COC(=O)CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@H]1C	ZINC000450590287	FF	On-Demand	Anodyne	SMO	24	40
COC(=O)CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@@H]1C	ZINC000450590288	FF	On-Demand	Anodyne	CACNA1B	40	33
COC(=O)CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@@H]1C	ZINC000450590288	FF	On-Demand	Anodyne	LIPG	50	35
COC(=O)CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@@H]1C	ZINC000450590288	FF	On-Demand	Anodyne	SMO	24	40
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	HTR1A	122	58
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	DRD2	112	51
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	DRD1	47	45
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	DRD4	58	45
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	ADRA1D	98	51
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	HTR2A	68	52
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	HTR2C	38	44
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	SLC6A4	34	55
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	ADRA1A	72	45
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	ADRA1B	57	44
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	DRD3	96	47
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	HTR7	95	47
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	ABCB1	51	39
COCCOc1ccccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450590294	DD	On-Demand	Anodyne	HSP90AB1	39	46
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	HTR1A	122	58
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	DRD2	112	51
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	DRD1	47	45
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	DRD4	58	45
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	ADRA1D	98	51
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	HTR2A	68	52
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	HTR2C	38	44
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	SLC6A4	34	55
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	ADRA1A	72	45
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	ADRA1B	57	44
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	DRD3	96	47
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	HTR7	95	47
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	ABCB1	51	39
COCCOc1ccccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450590298	DD	On-Demand	Anodyne	HSP90AB1	39	46
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NC(CF)CF	ZINC000450590320	FD	On-Demand	Bother	BCL2L1	110	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NC(CF)CF	ZINC000450590320	FD	On-Demand	Bother	BCL2	94	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NC(CF)CF	ZINC000450590320	FD	On-Demand	Bother	BCL2L2	46	33
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NC(CF)CF	ZINC000450590320	FD	On-Demand	Bother	DDIT3	0	41
FCC(CF)Nc1ncnc2ccc(I)cc12	ZINC000450590352	EF	On-Demand	Anodyne	HTT	0	42
FCC(CF)Nc1ncnc2ccc(I)cc12	ZINC000450590352	EF	On-Demand	Anodyne	USP10	0	44
FCC(CF)Nc1ncnc2ccc(I)cc12	ZINC000450590352	EF	On-Demand	Anodyne	USP13	0	44
COc1ccc(CNC(=O)CCN(C)[C@@H](CO)C(C)(C)C)c(OC)c1	ZINC000450590371	FE	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN(C)[C@@H](CO)C(C)(C)C)c(OC)c1	ZINC000450590371	FE	On-Demand	Anodyne	MTNR1B	42	38
COc1ccc(CNC(=O)CCN(C)[C@@H](CO)C(C)(C)C)c(OC)c1	ZINC000450590371	FE	On-Demand	Anodyne	MT-ND1	17	40
COc1ccc(CNC(=O)CCN(C)[C@H](CO)C(C)(C)C)c(OC)c1	ZINC000450590372	FE	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN(C)[C@H](CO)C(C)(C)C)c(OC)c1	ZINC000450590372	FE	On-Demand	Anodyne	MTNR1B	42	38
COc1ccc(CNC(=O)CCN(C)[C@H](CO)C(C)(C)C)c(OC)c1	ZINC000450590372	FE	On-Demand	Anodyne	MT-ND1	17	40
Cc1cc(Cl)c2ncc(C#N)c(NC[C@@H]3CCCN3CCCO)c2c1	ZINC000450590379	FG	On-Demand	Mild	MAP3K8	67	37
Cc1cc(Cl)c2ncc(C#N)c(NC[C@H]3CCCN3CCCO)c2c1	ZINC000450590380	FG	On-Demand	Mild	MAP3K8	67	37
OCCCN1CCC[C@H]1CNc1ccnc2cc(F)ccc12	ZINC000450590386	DF	On-Demand	Anodyne	HRP1_PLAFA	84	35
OCCCN1CCC[C@H]1CNc1ccnc2cc(F)ccc12	ZINC000450590386	DF	On-Demand	Anodyne	HNMT	69	42
OCCCN1CCC[C@@H]1CNc1ccnc2cc(F)ccc12	ZINC000450590390	DF	On-Demand	Anodyne	HRP1_PLAFA	84	35
OCCCN1CCC[C@@H]1CNc1ccnc2cc(F)ccc12	ZINC000450590390	DF	On-Demand	Anodyne	HNMT	69	42
Cc1cc(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1Cl	ZINC000450590401	FH	On-Demand	Anodyne	P2RX7	30	44
Cc1cc(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1Cl	ZINC000450590401	FH	On-Demand	Anodyne	PDE4D	15	42
Cc1cc(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1Cl	ZINC000450590401	FH	On-Demand	Anodyne	PDEC	0	42
Cc1cc(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1Cl	ZINC000450590403	FH	On-Demand	Anodyne	P2RX7	30	44
Cc1cc(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1Cl	ZINC000450590403	FH	On-Demand	Anodyne	PDE4D	15	42
Cc1cc(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1Cl	ZINC000450590403	FH	On-Demand	Anodyne	PDEC	0	42
O=C(CC1(O)CCC1)Nc1ccc(F)cc1OCC(F)F	ZINC000450590406	DF	On-Demand	Anodyne	CCR1	24	40
CCC[C@@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590410	DH	On-Demand	Anodyne	HCRTR1	0	48
CCC[C@@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590410	DH	On-Demand	Anodyne	COLA	97	39
CCC[C@@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450590410	DH	On-Demand	Anodyne	HCRTR2	0	48
CCOC(=O)c1ccc(CN2CCc3cc(OCC)ccc3C2)nc1	ZINC000450590434	EG	On-Demand	Anodyne	NOD1	29	46
CCOC(=O)c1ccc(CN2CCc3cc(OCC)ccc3C2)nc1	ZINC000450590434	EG	On-Demand	Anodyne	NOD2	48	46
COc1cc(CC(=O)N2CCC3(CCOCC3)[C@H]2C)ccc1Cl	ZINC000450590447	EG	On-Demand	Anodyne	OPRM1	0	41
COc1cc(CC(=O)N2CCC3(CCOCC3)[C@H]2C)ccc1Cl	ZINC000450590447	EG	On-Demand	Anodyne	OPRK1	43	42
COc1cc(CC(=O)N2CCC3(CCOCC3)[C@@H]2C)ccc1Cl	ZINC000450590448	EG	On-Demand	Anodyne	OPRM1	0	41
COc1cc(CC(=O)N2CCC3(CCOCC3)[C@@H]2C)ccc1Cl	ZINC000450590448	EG	On-Demand	Anodyne	OPRK1	43	42
CNC(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450590450	CD	On-Demand	Bother	TAAR1	18	47
COc1cc(Br)c(C(=O)N[C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1OC	ZINC000450590461	FI	On-Demand	Anodyne	HTR4	30	41
COc1cc(Br)c(C(=O)N[C@@H]2CC[C@@H](C)[C@H](C)C2)cc1OC	ZINC000450590462	FI	On-Demand	Anodyne	HTR4	30	41
COc1cc(Br)c(C(=O)N[C@@H]2CC[C@H](C)[C@H](C)C2)cc1OC	ZINC000450590463	FI	On-Demand	Anodyne	HTR4	30	41
COc1cc(Br)c(C(=O)N[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1OC	ZINC000450590464	FI	On-Demand	Anodyne	HTR4	30	41
CCC[C@H]1CCCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450590469	CG	On-Demand	Anodyne	CPT1A	44	35
CCC[C@H]1CCCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450590470	CG	On-Demand	Anodyne	CPT1A	44	35
CCC[C@@H]1CCCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450590471	CG	On-Demand	Anodyne	CPT1A	44	35
CCC[C@@H]1CCCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450590472	CG	On-Demand	Anodyne	CPT1A	44	35
CCC[C@H]1CCCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450590473	DH	On-Demand	Anodyne	ABHD11	0	40
CCC[C@@H]1CCCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450590474	DH	On-Demand	Anodyne	ABHD11	0	40
CCC[C@@H]1CCCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450590475	DH	On-Demand	Anodyne	ABHD11	0	40
CCC[C@H]1CCCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450590476	DH	On-Demand	Anodyne	PREP	59	37
CCC[C@H]1CCCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450590476	DH	On-Demand	Anodyne	ABHD11	0	40
C[C@@]1(NC(=O)c2ccc(I)cc2F)CCCOC1	ZINC000450590492	FF	On-Demand	Anodyne	MAP2K1	54	34
C[C@]1(NC(=O)c2ccc(I)cc2F)CCCOC1	ZINC000450590493	FF	On-Demand	Anodyne	MAP2K1	54	34
C[C@@]1(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCCOC1	ZINC000450590502	EG	On-Demand	Anodyne	RBP4	56	36
COC1CCC(CCNC(=O)c2ccn(CCc3ccccc3)n2)CC1	ZINC000450590519	FG	On-Demand	Anodyne	ACHE	18	47
COC(=O)c1coc(CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCO4)C2=O)n1	ZINC000450590522	FD	On-Demand	Anodyne	SCN9A	0	42
COC(=O)c1coc(CN2C(=O)N[C@](C)(c3ccc4c(c3)OCO4)C2=O)n1	ZINC000450590523	FD	On-Demand	Anodyne	SCN9A	0	42
N#Cc1cc(Br)ccc1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450590546	GG	On-Demand	Mild	F10	20	54
N#Cc1cc(Br)ccc1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450590546	GG	On-Demand	Mild	CETP	0	44
N#Cc1cc(Br)ccc1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450590546	GG	On-Demand	Mild	CACNA1I	58	36
CS(=O)(=O)c1ccc(NC[C@@H]2CCCCC2(F)F)c(C(F)(F)F)c1	ZINC000450590611	FI	On-Demand	Anodyne	SFRP1	54	32
CS(=O)(=O)c1ccc(NC[C@@H]2CCCCC2(F)F)c(C(F)(F)F)c1	ZINC000450590611	FI	On-Demand	Anodyne	WNT3	43	32
CS(=O)(=O)c1ccc(NC[C@H]2CCCCC2(F)F)c(C(F)(F)F)c1	ZINC000450590612	FI	On-Demand	Anodyne	SFRP1	54	32
CS(=O)(=O)c1ccc(NC[C@H]2CCCCC2(F)F)c(C(F)(F)F)c1	ZINC000450590612	FI	On-Demand	Anodyne	WNT3	43	32
CCOC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450590630	CC	On-Demand	Anodyne	TRPV1	27	56
CCOC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450590630	CC	On-Demand	Anodyne	NCE103	26	40
CCOC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450590630	CC	On-Demand	Anodyne	CAN2	0	40
CCOC(=O)[C@](C)(O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450590632	CC	On-Demand	Anodyne	TRPV1	27	56
CCOC(=O)[C@](C)(O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450590632	CC	On-Demand	Anodyne	NCE103	26	40
CCOC(=O)[C@](C)(O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450590632	CC	On-Demand	Anodyne	CAN2	0	40
CCN1C(=O)C[C@H](C(=O)NCCOC(C)C)[C@H]1c1cccnc1	ZINC000450590650	DD	On-Demand	Anodyne	NAMPT	18	40
CCC(=O)CCCN1CCCC[C@H]1c1ccc(F)cc1F	ZINC000450590651	CI	On-Demand	Anodyne	Q7YY07_CRYPV	43	30
CCC(=O)CCCN1CCCC[C@@H]1c1ccc(F)cc1F	ZINC000450590652	CI	On-Demand	Anodyne	Q7YY07_CRYPV	43	30
COC[C@@](C)(O)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450590656	FG	On-Demand	Bother	TAAR1	16	44
COC[C@](C)(O)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450590657	FG	On-Demand	Bother	TAAR1	16	44
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(Br)cc12	ZINC000450590674	FG	On-Demand	Anodyne	HRP1_PLAFA	58	35
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(Br)cc12	ZINC000450590674	FG	On-Demand	Anodyne	HNMT	47	33
COC[C@](C)(O)CCNc1ccnc2cc(F)c(Br)cc12	ZINC000450590675	FG	On-Demand	Anodyne	HRP1_PLAFA	58	35
COC[C@](C)(O)CCNc1ccnc2cc(F)c(Br)cc12	ZINC000450590675	FG	On-Demand	Anodyne	HNMT	47	33
COC[C@@](C)(O)CCN=c1ccc2ccc(F)cc2[nH]1	ZINC000450590702	CD	On-Demand	Anodyne	NR3C2	19	40
COC[C@](C)(O)CCN=c1ccc2ccc(F)cc2[nH]1	ZINC000450590703	CD	On-Demand	Anodyne	NR3C2	19	40
COC[C@@](C)(O)CCNc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450590716	GG	On-Demand	Anodyne	NPBWR1	50	40
COC[C@](C)(O)CCNc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450590717	GG	On-Demand	Anodyne	NPBWR1	50	40
CCOC(=O)c1ccc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)nc1	ZINC000450590718	GI	On-Demand	Anodyne	CYP11B2	17	40
CCOC(=O)c1ccc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)nc1	ZINC000450590718	GI	On-Demand	Anodyne	SOAT2	56	31
CCOC(=O)c1ccc(CN2CCN(c3nc(C)cc(C)n3)CC2)nc1	ZINC000450590739	FD	On-Demand	Anodyne	P2RY12	51	41
CCOC(=O)c1ccc(CN2CCN(c3nc(C)cc(C)n3)CC2)nc1	ZINC000450590739	FD	On-Demand	Anodyne	SSTR5	41	33
CCCCn1cc(CNC(=O)CCOc2cccc(OC)c2)c(C)n1	ZINC000450590740	EG	On-Demand	Anodyne	MTNR1A	54	43
CCCCn1cc(CNC(=O)CCOc2cccc(OC)c2)c(C)n1	ZINC000450590740	EG	On-Demand	Anodyne	MTNR1B	46	43
CCn1c(SCc2nc(C(=O)OC)co2)nnc1-c1ccccc1	ZINC000450590744	EG	On-Demand	Anodyne	SLC27A1	48	42
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000450590754	EB	On-Demand	Anodyne	MMP2	15	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000450590754	EB	On-Demand	Anodyne	MMP8	15	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000450590754	EB	On-Demand	Anodyne	MMP9	17	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000450590754	EB	On-Demand	Anodyne	MMP12	24	41
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000450590755	EB	On-Demand	Anodyne	MMP2	15	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000450590755	EB	On-Demand	Anodyne	MMP8	15	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000450590755	EB	On-Demand	Anodyne	MMP9	17	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000450590755	EB	On-Demand	Anodyne	MMP12	24	41
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000450590756	EB	On-Demand	Anodyne	MMP2	15	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000450590756	EB	On-Demand	Anodyne	MMP8	15	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000450590756	EB	On-Demand	Anodyne	MMP9	17	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000450590756	EB	On-Demand	Anodyne	MMP12	24	41
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000450590757	EB	On-Demand	Anodyne	MMP2	15	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000450590757	EB	On-Demand	Anodyne	MMP8	15	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000450590757	EB	On-Demand	Anodyne	MMP9	17	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000450590757	EB	On-Demand	Anodyne	MMP12	24	41
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	HTR1A	115	44
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	DRD2	87	44
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	DRD1	32	41
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	DRD4	56	43
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	ADRA1D	77	41
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	HTR2A	48	42
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	ADRA1A	72	45
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	ADRA1B	48	39
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	DRD3	100	44
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	HTR7	63	41
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	AP2S1	0	43
COCCOc1ccccc1N1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450590785	GD	On-Demand	Anodyne	ALPHA-1A	0	41
CCC(CC)Oc1ccc(C(=O)N2CCN3CCOC[C@@H]3C2)cc1	ZINC000450590789	EE	On-Demand	Anodyne	HRH3	15	41
CCC(CC)Oc1ccc(C(=O)N2CCN3CCOC[C@@H]3C2)cc1	ZINC000450590789	EE	On-Demand	Anodyne	L3MBTL3	48	39
CCC(CC)Oc1ccc(C(=O)N2CCN3CCOC[C@H]3C2)cc1	ZINC000450590790	EE	On-Demand	Anodyne	HRH3	15	41
CCC(CC)Oc1ccc(C(=O)N2CCN3CCOC[C@H]3C2)cc1	ZINC000450590790	EE	On-Demand	Anodyne	L3MBTL3	48	39
COc1ccccc1-n1cnc2cc(C(=O)N(C)C3CC(O)C3)ccc21	ZINC000450590833	FF	On-Demand	Anodyne	PDGFRB	0	44
COc1ccccc1-n1cnc2cc(C(=O)N(C)C3CC(O)C3)ccc21	ZINC000450590833	FF	On-Demand	Anodyne	PLK1	45	33
CC[C@H]1CN(C(=O)CCc2ccc(C(N)=O)cc2)CCN1Cc1ccccc1	ZINC000450590836	GF	On-Demand	Anodyne	SIGMAR1	18	41
CC[C@@H]1CN(C(=O)CCc2ccc(C(N)=O)cc2)CCN1Cc1ccccc1	ZINC000450590837	GF	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)c1cccc(CSc2nnc(-c3ccco3)n2CC(C)C)c1	ZINC000450590848	FJ	On-Demand	Anodyne	HCRTR2	16	43
CC[C@H]1CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCN1Cc1ccccc1	ZINC000450590861	FF	On-Demand	Anodyne	GHRHR	51	34
CC[C@H]1CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCN1Cc1ccccc1	ZINC000450590861	FF	On-Demand	Anodyne	GAG-PRO	51	34
CC[C@@H]1CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCN1Cc1ccccc1	ZINC000450590862	FF	On-Demand	Anodyne	GHRHR	51	34
CC[C@@H]1CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CCN1Cc1ccccc1	ZINC000450590862	FF	On-Demand	Anodyne	GAG-PRO	51	34
CCn1c(Cc2ccccc2)nnc1SCc1ccnc(OC)n1	ZINC000450590878	EF	On-Demand	Anodyne	SLC27A1	42	34
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	HTR1A	18	58
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	DRD2	35	47
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	DRD1	27	54
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	DRD4	25	50
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	HTR2A	36	53
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	HTR2C	23	58
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	ADRA1B	15	44
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	DRD3	17	52
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	SLC6A3	17	43
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	ERG2	22	47
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	HTR1F	28	41
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	HTR7	21	47
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	MC4R	52	41
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	HRH3	20	42
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	SIGMAR1	26	54
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	SLC18A3	0	48
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	HTR3B	0	54
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	CYP2J2	58	41
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	NET	0	48
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	L3MBTL3	60	38
CC(C)N1CCC(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450590886	GG	On-Demand	Anodyne	AP2S1	0	47
CCC[C@H](OC)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450590887	ED	On-Demand	Anodyne	KCNQ2	48	39
CCC[C@@H](OC)C(=O)Nc1cccc2c1CCN2S(C)(=O)=O	ZINC000450590888	ED	On-Demand	Anodyne	KCNQ2	48	39
CCn1c(Cc2ccccc2)nnc1SCC1(OC)CCC1	ZINC000450590893	DH	On-Demand	Anodyne	SLC27A1	40	36
COc1cc(CC(=O)N[C@H](C)c2nnc(C)s2)ccc1Cl	ZINC000450590895	EF	On-Demand	Anodyne	CAN2	0	43
COc1cc(CC(=O)N[C@@H](C)c2nnc(C)s2)ccc1Cl	ZINC000450590897	EF	On-Demand	Anodyne	CAN2	0	43
C[C@@H]1CCC[C@]1(C)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450590904	DG	On-Demand	Anodyne	F10	18	45
C[C@@H]1CCC[C@@]1(C)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450590906	DG	On-Demand	Anodyne	F10	18	45
C[C@H]1CCC[C@@]1(C)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450590907	DG	On-Demand	Anodyne	F10	18	45
C[C@H]1CCC[C@]1(C)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000450590909	DG	On-Demand	Anodyne	F10	18	45
CC(=O)c1cccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)c1	ZINC000450590910	DD	On-Demand	Anodyne	DRD4	22	43
CC(=O)c1cccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)c1	ZINC000450590910	DD	On-Demand	Anodyne	TRY2_BOVIN	87	37
CC(=O)c1cccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)c1	ZINC000450590910	DD	On-Demand	Anodyne	CCR3	40	39
CC(=O)c1cccc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)c1	ZINC000450590910	DD	On-Demand	Anodyne	ST14	50	34
CC(=O)c1cccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)c1	ZINC000450590911	DD	On-Demand	Anodyne	DRD4	22	43
CC(=O)c1cccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)c1	ZINC000450590911	DD	On-Demand	Anodyne	TRY2_BOVIN	87	37
CC(=O)c1cccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)c1	ZINC000450590911	DD	On-Demand	Anodyne	CCR3	40	39
CC(=O)c1cccc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)c1	ZINC000450590911	DD	On-Demand	Anodyne	ST14	50	34
O=[N+]([O-])c1ccc(NC[C@H]2CCCN2CCCO)cc1C(F)(F)F	ZINC000450590919	EF	On-Demand	Bother	AADAC	0	42
O=[N+]([O-])c1ccc(NC[C@@H]2CCCN2CCCO)cc1C(F)(F)F	ZINC000450590920	EF	On-Demand	Bother	AADAC	0	42
CCc1cnccc1[C@H](C)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450590921	FI	On-Demand	Anodyne	GPR142	44	33
CCc1cnccc1[C@@H](C)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450590922	FI	On-Demand	Anodyne	GPR142	44	33
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@H](C)[C@H](O)C1	ZINC000450590936	FD	On-Demand	Anodyne	L3MBTL1	0	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@H](C)[C@H](O)C1	ZINC000450590936	FD	On-Demand	Anodyne	L3MBTL3	88	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@H](C)[C@H](O)C1	ZINC000450590936	FD	On-Demand	Anodyne	MBTD1	0	40
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@H](C)[C@H](O)C1	ZINC000450590936	FD	On-Demand	Anodyne	TP53BP1	0	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@@H](C)[C@H](O)C1	ZINC000450590937	FD	On-Demand	Anodyne	L3MBTL1	0	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@@H](C)[C@H](O)C1	ZINC000450590937	FD	On-Demand	Anodyne	L3MBTL3	88	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@@H](C)[C@H](O)C1	ZINC000450590937	FD	On-Demand	Anodyne	MBTD1	0	40
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@@H](C)[C@H](O)C1	ZINC000450590937	FD	On-Demand	Anodyne	TP53BP1	0	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@H](C)[C@@H](O)C1	ZINC000450590940	FD	On-Demand	Anodyne	L3MBTL1	0	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@H](C)[C@@H](O)C1	ZINC000450590940	FD	On-Demand	Anodyne	L3MBTL3	88	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@H](C)[C@@H](O)C1	ZINC000450590940	FD	On-Demand	Anodyne	MBTD1	0	40
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@H](C)[C@@H](O)C1	ZINC000450590940	FD	On-Demand	Anodyne	TP53BP1	0	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@@H](C)[C@@H](O)C1	ZINC000450590943	FD	On-Demand	Anodyne	L3MBTL1	0	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@@H](C)[C@@H](O)C1	ZINC000450590943	FD	On-Demand	Anodyne	L3MBTL3	88	46
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@@H](C)[C@@H](O)C1	ZINC000450590943	FD	On-Demand	Anodyne	MBTD1	0	40
Cc1ccc(C(=O)N2CC[C@H](C)[C@H](O)C2)cc1C(=O)N1CC[C@@H](C)[C@@H](O)C1	ZINC000450590943	FD	On-Demand	Anodyne	TP53BP1	0	46
COC(=O)c1csc(CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCO4)C2=O)n1	ZINC000450590946	GD	On-Demand	Anodyne	SCN9A	0	41
COC(=O)c1csc(CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCO4)C2=O)n1	ZINC000450590946	GD	On-Demand	Anodyne	DYRK2	69	35
COC(=O)c1csc(CN2C(=O)N[C@](C)(c3ccc4c(c3)OCO4)C2=O)n1	ZINC000450590952	GD	On-Demand	Anodyne	SCN9A	0	41
COC(=O)c1csc(CN2C(=O)N[C@](C)(c3ccc4c(c3)OCO4)C2=O)n1	ZINC000450590952	GD	On-Demand	Anodyne	DYRK2	69	35
C[C@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000450590958	EG	On-Demand	Bother	CACNA1D	56	33
C[C@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000450590958	EG	On-Demand	Bother	LUXR	17	41
C[C@@H]1CC[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000450590959	EG	On-Demand	Bother	CACNA1D	56	33
C[C@@H]1CC[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000450590959	EG	On-Demand	Bother	LUXR	17	41
C[C@@H]1CC[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000450590960	EG	On-Demand	Bother	CACNA1D	56	33
C[C@@H]1CC[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000450590960	EG	On-Demand	Bother	LUXR	17	41
C[C@H]1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000450590961	EG	On-Demand	Bother	CACNA1D	56	33
C[C@H]1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000450590961	EG	On-Demand	Bother	LUXR	17	41
CCC[C@@H]1CCCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450590971	DH	On-Demand	Anodyne	HCRTR1	0	40
CCC[C@@H]1CCCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450590971	DH	On-Demand	Anodyne	HCRTR2	0	40
CCC[C@H]1CCCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450590973	DH	On-Demand	Anodyne	HCRTR1	0	40
CCC[C@H]1CCCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450590973	DH	On-Demand	Anodyne	HCRTR2	0	40
CCOc1ccc2c(c1)CCN(C[C@](C)(O)C(C)=O)C2	ZINC000450591015	CD	On-Demand	Anodyne	NOD2	34	42
CCOc1ccc2c(c1)CCN(C[C@@](C)(O)C(C)=O)C2	ZINC000450591016	CD	On-Demand	Anodyne	NOD2	34	42
O=[N+]([O-])c1cc(Cl)ccc1NC(CF)CF	ZINC000450591030	CF	On-Demand	Bother	PDE7B	0	43
O=[N+]([O-])c1cc(Cl)ccc1NC(CF)CF	ZINC000450591030	CF	On-Demand	Bother	PDE7A	0	43
CCN1CCN(C(=O)c2ccccc2-n2ccc(C)n2)CC1=O	ZINC000450591037	DD	On-Demand	Anodyne	P2RX7	0	55
CCN1CCN(C(=O)c2ccccc2-n2ccc(C)n2)CC1=O	ZINC000450591037	DD	On-Demand	Anodyne	BCL2	0	41
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)c3ncc(C)s3)nc2)c1	ZINC000450591038	GI	On-Demand	Anodyne	MTNR1A	19	41
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)c3ncc(C)s3)nc2)c1	ZINC000450591038	GI	On-Demand	Anodyne	MTNR1B	22	41
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)c3ncc(C)s3)nc2)c1	ZINC000450591039	GI	On-Demand	Anodyne	MTNR1A	19	41
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)c3ncc(C)s3)nc2)c1	ZINC000450591039	GI	On-Demand	Anodyne	MTNR1B	22	41
CCC(CC)Oc1ccc(C(=O)N2CCN(CC)C(=O)C2)cc1	ZINC000450591040	DF	On-Demand	Anodyne	PLA2G2A	0	42
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450591066	GD	On-Demand	Anodyne	CTRB1	24	40
C[C@H](CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O)S(C)(=O)=O	ZINC000450591073	FC	On-Demand	Anodyne	SCN9A	0	41
C[C@@H](CN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O)S(C)(=O)=O	ZINC000450591074	FC	On-Demand	Anodyne	SCN9A	0	41
C[C@@H](CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O)S(C)(=O)=O	ZINC000450591076	FC	On-Demand	Anodyne	SCN9A	0	41
C[C@H](CN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O)S(C)(=O)=O	ZINC000450591078	FC	On-Demand	Anodyne	SCN9A	0	41
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450591090	GD	On-Demand	Anodyne	CTRB1	24	40
CC[C@H](COCC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000450591099	CG	On-Demand	Bother	PGR	19	42
CC[C@H](COCC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000450591099	CG	On-Demand	Bother	AR	17	42
CC[C@@H](COCC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000450591100	CG	On-Demand	Bother	PGR	19	42
CC[C@@H](COCC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000450591100	CG	On-Demand	Bother	AR	17	42
CCS(=O)(=O)c1ccc(NCC[C@](C)(O)COC)cc1	ZINC000450591146	DD	On-Demand	Anodyne	CYNT	19	42
CCS(=O)(=O)c1ccc(NCC[C@@](C)(O)COC)cc1	ZINC000450591147	DD	On-Demand	Anodyne	CYNT	19	42
C[C@H]1C[C@H](c2cccnc2)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450591152	FH	On-Demand	Bother	CACNA1C	49	33
C[C@H]1C[C@H](c2cccnc2)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450591152	FH	On-Demand	Bother	CACNA1D	63	32
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450591153	FH	On-Demand	Bother	CACNA1C	49	33
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450591153	FH	On-Demand	Bother	CACNA1D	63	32
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450591154	FH	On-Demand	Bother	CACNA1C	49	33
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450591154	FH	On-Demand	Bother	CACNA1D	63	32
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450591155	FH	On-Demand	Bother	CACNA1C	49	33
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450591155	FH	On-Demand	Bother	CACNA1D	63	32
CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1=O	ZINC000450591172	DE	On-Demand	Anodyne	P2RX7	26	44
CC[C@H](COCC(F)(F)F)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450591198	FF	On-Demand	Anodyne	LRRK2	23	44
CC[C@@H](COCC(F)(F)F)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450591199	FF	On-Demand	Anodyne	LRRK2	23	44
Cc1cc(C)nc(N2CCN(Cc3ccccc3OC3CC3)CC2)n1	ZINC000450591204	EF	On-Demand	Anodyne	DRD1	26	43
Cc1cc(C)nc(N2CCN(Cc3ccccc3OC3CC3)CC2)n1	ZINC000450591204	EF	On-Demand	Anodyne	DRD3	0	42
COC[C@](C)(O)CCNc1ncnc2scc(-c3ccccc3)c12	ZINC000450591208	EH	On-Demand	Anodyne	ADRB3	25	41
COC[C@@](C)(O)CCNc1ncnc2scc(-c3ccccc3)c12	ZINC000450591211	EH	On-Demand	Anodyne	ADRB3	25	41
CCc1cc(CCCSc2nc3cc(Cl)cnc3[nH]2)on1	ZINC000450591214	DH	On-Demand	Anodyne	ENPP1	15	40
FCC(CF)Nc1ncnc2c1ncn2C1CC1	ZINC000450591219	CD	On-Demand	Anodyne	ADORA1	42	46
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450591227	FB	On-Demand	Anodyne	TGM2	20	43
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450591227	FB	On-Demand	Anodyne	GCK	57	35
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450591227	FB	On-Demand	Anodyne	GCKR	51	32
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450591233	FB	On-Demand	Anodyne	TGM2	20	43
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450591233	FB	On-Demand	Anodyne	GCK	57	35
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450591233	FB	On-Demand	Anodyne	GCKR	51	32
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450591239	GH	On-Demand	Bother	COLA	78	36
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450591239	GH	On-Demand	Bother	BCL2L1	109	36
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450591239	GH	On-Demand	Bother	BCL2	91	35
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450591239	GH	On-Demand	Bother	BCL2L2	50	35
COC[C@@](C)(O)CCNc1ccnc2c(Cl)cccc12	ZINC000450591244	CG	On-Demand	Anodyne	HNMT	43	32
COC[C@](C)(O)CCNc1ccnc2c(Cl)cccc12	ZINC000450591245	CG	On-Demand	Anodyne	HNMT	43	32
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(C)cccc1Cl	ZINC000450591249	FE	On-Demand	Anodyne	ANPEP	35	40
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(C)cccc1Cl	ZINC000450591249	FE	On-Demand	Anodyne	CTSB	24	44
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(C)cccc1Cl	ZINC000450591249	FE	On-Demand	Anodyne	CAPN1	46	35
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(C)cccc1Cl	ZINC000450591249	FE	On-Demand	Anodyne	CAPN2	87	35
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(C)cccc1Cl	ZINC000450591249	FE	On-Demand	Anodyne	NPR	66	38
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(C)cccc1Cl	ZINC000450591249	FE	On-Demand	Anodyne	F2RL1	50	33
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450591292	GC	On-Demand	Mild	AR	23	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450591293	GC	On-Demand	Mild	AR	23	43
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450591294	GC	On-Demand	Mild	AR	23	43
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450591295	GC	On-Demand	Mild	AR	23	43
Cc1cc(CNC(=O)CC2CC(F)(F)C2)ccc1Cl	ZINC000450591321	CH	On-Demand	Anodyne	P2RX7	28	42
CCSc1nnc(SCCC(=O)NCc2ccc(OC)cc2OC)s1	ZINC000450591348	GG	On-Demand	Anodyne	MTNR1A	49	37
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(C(=O)OCC)cn2)CC1	ZINC000450591358	GD	On-Demand	Anodyne	SSTR5	45	42
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(C(=O)OCC)cn2)CC1	ZINC000450591358	GD	On-Demand	Anodyne	CACNA1G	36	40
COC(=O)c1coc(CN2CCc3ccc(F)cc3C2)n1	ZINC000450591363	CE	On-Demand	Anodyne	ABCB1	0	45
COC(=O)c1coc(CN2CCc3ccc(F)cc3C2)n1	ZINC000450591363	CE	On-Demand	Anodyne	NOD2	40	36
CC(C)(C)[C@H](CCO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450591378	EE	On-Demand	Anodyne	CTSG	26	40
CC(C)(C)[C@H](CCO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450591378	EE	On-Demand	Anodyne	CTRB1	34	40
CC(C)(C)[C@H](CCO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450591378	EE	On-Demand	Anodyne	CELA2A	26	40
CC(C)(C)[C@@H](CCO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450591379	EE	On-Demand	Anodyne	CTSG	26	40
CC(C)(C)[C@@H](CCO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450591379	EE	On-Demand	Anodyne	CTRB1	34	40
CC(C)(C)[C@@H](CCO)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450591379	EE	On-Demand	Anodyne	CELA2A	26	40
CC(F)(F)CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450591394	EE	On-Demand	Anodyne	CLK1	48	35
CC(F)(F)CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450591394	EE	On-Demand	Anodyne	DYRK2	59	35
CC(F)(F)CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450591396	EE	On-Demand	Anodyne	CLK1	48	35
CC(F)(F)CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450591396	EE	On-Demand	Anodyne	DYRK2	59	35
C[C@]1(C(=O)NCC2CCN(c3ccncc3)CC2)CC=CCC1	ZINC000450591407	DG	On-Demand	Anodyne	F10	17	43
C[C@@]1(C(=O)NCC2CCN(c3ccncc3)CC2)CC=CCC1	ZINC000450591408	DG	On-Demand	Anodyne	F10	17	43
CC(=O)CCCCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450591413	EE	On-Demand	Anodyne	DYRK2	54	35
CC(=O)CCCCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000450591415	EE	On-Demand	Anodyne	DYRK2	54	35
CCO[C@H]1COCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450591427	FG	On-Demand	Anodyne	CCR2	28	41
CCO[C@H]1COCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450591428	FG	On-Demand	Anodyne	CCR2	28	41
CCO[C@@H]1COCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450591429	FG	On-Demand	Anodyne	CCR2	28	41
CCO[C@@H]1COCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450591430	FG	On-Demand	Anodyne	CCR2	28	41
CN(CC1(O)CCC1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450591438	DD	On-Demand	Bother	CACNA1D	41	33
CCOc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)C2	ZINC000450591451	GG	On-Demand	Anodyne	DRD3	15	41
CCOc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)C2	ZINC000450591451	GG	On-Demand	Anodyne	HTR7	34	46
CCOc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)C2	ZINC000450591451	GG	On-Demand	Anodyne	ABCB1B	49	35
CCOc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)C2	ZINC000450591451	GG	On-Demand	Anodyne	MTNR1A	57	40
CCOc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)C2	ZINC000450591451	GG	On-Demand	Anodyne	MTNR1B	57	40
CCOc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)C2	ZINC000450591451	GG	On-Demand	Anodyne	ABCB1	28	43
COc1cc(OC)c2ncnc(NC[C@H]3CCCN3CCCO)c2c1	ZINC000450591466	ED	On-Demand	Anodyne	PDE6A	43	34
COc1cc(OC)c2ncnc(NC[C@@H]3CCCN3CCCO)c2c1	ZINC000450591467	ED	On-Demand	Anodyne	PDE6A	43	34
COCCNC(=O)c1ccc(N2CCc3c(Cl)cc(F)cc3C2)nc1	ZINC000450591486	FF	On-Demand	Anodyne	DRD4	46	36
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1Cl	ZINC000450591489	DI	On-Demand	Anodyne	DRD2	0	43
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1Cl	ZINC000450591489	DI	On-Demand	Anodyne	DRD3	22	43
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1Cl	ZINC000450591489	DI	On-Demand	Anodyne	KCNH2	23	40
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1Cl	ZINC000450591489	DI	On-Demand	Anodyne	HSD11B1	28	55
CCc1cc(N[C@@H](CC(C)C)CN2CCCC2)n2ncnc2n1	ZINC000450591492	DF	On-Demand	Anodyne	DHOD	0	46
CCOC(=O)CNC(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450591495	GE	On-Demand	Anodyne	LTA4H	15	57
CCOC(=O)CNC(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450591495	GE	On-Demand	Anodyne	SIGMAR1	32	48
CCOC(=O)CNC(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450591495	GE	On-Demand	Anodyne	CACNA1G	50	49
COc1ccc(-c2csc3ncnc(NC[C@@H]4CCCN4CCCO)c23)cc1	ZINC000450591496	GH	On-Demand	Anodyne	ADRB3	26	46
COc1ccc(-c2csc3ncnc(NC[C@@H]4CCCN4CCCO)c23)cc1	ZINC000450591496	GH	On-Demand	Anodyne	TNK2	45	39
COc1ccc(-c2csc3ncnc(NC[C@H]4CCCN4CCCO)c23)cc1	ZINC000450591497	GH	On-Demand	Anodyne	ADRB3	26	46
COc1ccc(-c2csc3ncnc(NC[C@H]4CCCN4CCCO)c23)cc1	ZINC000450591497	GH	On-Demand	Anodyne	TNK2	45	39
N#Cc1ccccc1-c1ccc(CNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450591504	DG	On-Demand	Mild	PROC	47	33
N#Cc1ccccc1-c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450591505	DG	On-Demand	Mild	PROC	47	33
C[C@@H](O)CCSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1	ZINC000450591523	GJ	On-Demand	Anodyne	HCRTR2	22	45
C[C@H](O)CCSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1	ZINC000450591524	GJ	On-Demand	Anodyne	HCRTR2	22	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(-n2cnnc2O)c1	ZINC000450591553	FE	On-Demand	Anodyne	ANPEP	22	40
COC[C@@](C)(O)CCNc1ccnc(C(=O)NCc2ccccc2)c1	ZINC000450591564	EE	On-Demand	Anodyne	PDS	41	33
COC[C@](C)(O)CCNc1ccnc(C(=O)NCc2ccccc2)c1	ZINC000450591565	EE	On-Demand	Anodyne	PDS	41	33
C[C@H]1COCCN1c1nc(NC(C)(C)C)nc(N2CCOC[C@@H]2C)n1	ZINC000450591603	FD	On-Demand	Anodyne	MTOR	42	41
CCOc1ccc2c(c1)CCN(C[C@H](O)COCCOC)C2	ZINC000450591667	DD	On-Demand	Anodyne	ACOX1	49	34
CCOc1ccc2c(c1)CCN(C[C@H](O)COCCOC)C2	ZINC000450591667	DD	On-Demand	Anodyne	HSP90AB1	40	42
CCOc1ccc2c(c1)CCN(C[C@H](O)COCCOC)C2	ZINC000450591667	DD	On-Demand	Anodyne	NOD2	25	40
CCOc1ccc2c(c1)CCN(C[C@@H](O)COCCOC)C2	ZINC000450591668	DD	On-Demand	Anodyne	ACOX1	49	34
CCOc1ccc2c(c1)CCN(C[C@@H](O)COCCOC)C2	ZINC000450591668	DD	On-Demand	Anodyne	HSP90AB1	40	42
CCOc1ccc2c(c1)CCN(C[C@@H](O)COCCOC)C2	ZINC000450591668	DD	On-Demand	Anodyne	NOD2	25	40
O=[N+]([O-])c1cccnc1NCc1cc(C2CC2)ccc1F	ZINC000450591676	CH	On-Demand	Bother	PRKCQ	28	43
CC(C)(C)[C@@H](CCO)NC(=O)c1ccc(I)cc1F	ZINC000450591685	GF	On-Demand	Anodyne	MAP2K1	54	38
CC(C)(C)[C@H](CCO)NC(=O)c1ccc(I)cc1F	ZINC000450591686	GF	On-Demand	Anodyne	MAP2K1	54	38
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591693	EE	On-Demand	Anodyne	HTR2A	22	55
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591693	EE	On-Demand	Anodyne	HTR2C	27	47
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591693	EE	On-Demand	Anodyne	SLC6A1	102	38
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591693	EE	On-Demand	Anodyne	CYP2J2	63	45
CC(C)NS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591693	EE	On-Demand	Anodyne	BIRC2	60	34
Cc1nc(C)n(CCCC(=O)NCc2ccc(Cl)c(C)c2)n1	ZINC000450591702	DF	On-Demand	Anodyne	P2RX7	31	43
Cc1nc(C)n(CCCC(=O)NCc2ccc(Cl)c(C)c2)n1	ZINC000450591702	DF	On-Demand	Anodyne	DNAE	42	34
COc1cc(CC(=O)N(C)CC2(O)CCC2)ccc1Cl	ZINC000450591722	CE	On-Demand	Anodyne	OPRK1	24	47
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591728	EE	On-Demand	Anodyne	HTR2A	22	55
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591728	EE	On-Demand	Anodyne	HTR2C	27	47
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591728	EE	On-Demand	Anodyne	SLC6A1	102	38
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591728	EE	On-Demand	Anodyne	CYP2J2	63	45
CC(C)NS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450591728	EE	On-Demand	Anodyne	BIRC2	60	34
COC[C@@](C)(O)CCNc1cnc2ccccc2n1	ZINC000450591739	CD	On-Demand	Anodyne	METG	45	34
COC[C@](C)(O)CCNc1cnc2ccccc2n1	ZINC000450591740	CD	On-Demand	Anodyne	METG	45	34
COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C[C@H]1C	ZINC000450591742	FD	On-Demand	Anodyne	DRD4	40	30
COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C[C@H]1C	ZINC000450591742	FD	On-Demand	Anodyne	NPBWR1	62	34
COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C[C@@H]1C	ZINC000450591743	FD	On-Demand	Anodyne	DRD4	40	30
COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C[C@@H]1C	ZINC000450591743	FD	On-Demand	Anodyne	NPBWR1	62	34
COC1CCC(CCNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450591803	FH	On-Demand	Bother	LIPC	0	43
COC1CCC(CCNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450591803	FH	On-Demand	Bother	LIPG	48	43
CCN(CC)S(=O)(=O)c1ccc(NCC[C@](C)(O)COC)c([N+](=O)[O-])c1	ZINC000450591805	GD	On-Demand	Bother	BDKRB1	0	48
CCN(CC)S(=O)(=O)c1ccc(NCC[C@@](C)(O)COC)c([N+](=O)[O-])c1	ZINC000450591808	GD	On-Demand	Bother	BDKRB1	0	48
CC(C)(C)[C@@H](CCO)NC(=O)c1cccc(C#N)c1Br	ZINC000450591809	EF	On-Demand	Mild	CTRB_BOVIN	48	35
COC(=O)CNC(=O)c1ccc(N(C)CCc2ccccc2C)c([N+](=O)[O-])c1	ZINC000450591811	GE	On-Demand	Bother	COLA	40	32
CC(C)OCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450591816	CD	On-Demand	Anodyne	CAN2	0	53
CC(C)(C)[C@H](CCO)NC(=O)c1cccc(C#N)c1Br	ZINC000450591818	EF	On-Demand	Mild	CTRB_BOVIN	48	35
COCCOC[C@H](O)CN1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000450591836	EE	On-Demand	Anodyne	COLA	59	34
COCCOC[C@H](O)CN1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000450591836	EE	On-Demand	Anodyne	CPT1A	53	34
COCCOC[C@@H](O)CN1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000450591838	EE	On-Demand	Anodyne	COLA	59	34
COCCOC[C@@H](O)CN1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000450591838	EE	On-Demand	Anodyne	CPT1A	53	34
COCCOC[C@@H](O)CN1CCCC[C@H]1c1nc2ccccc2o1	ZINC000450591840	EE	On-Demand	Anodyne	COLA	59	34
COCCOC[C@@H](O)CN1CCCC[C@H]1c1nc2ccccc2o1	ZINC000450591840	EE	On-Demand	Anodyne	CPT1A	53	34
COCCOC[C@H](O)CN1CCCC[C@H]1c1nc2ccccc2o1	ZINC000450591841	EE	On-Demand	Anodyne	COLA	59	34
COCCOC[C@H](O)CN1CCCC[C@H]1c1nc2ccccc2o1	ZINC000450591841	EE	On-Demand	Anodyne	CPT1A	53	34
CC[C@@H]1C[C@H]1C(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1	ZINC000450591865	FJ	On-Demand	Anodyne	SDH1	0	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](CC(F)(F)F)c1ccc(Br)cc1	ZINC000450591866	FJ	On-Demand	Anodyne	SDH1	0	40
C[C@@H](O)CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450591875	DC	On-Demand	Anodyne	SCN9A	27	49
C[C@H](O)CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450591878	DC	On-Demand	Anodyne	SCN9A	27	49
C[C@H](O)CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450591881	DC	On-Demand	Anodyne	SCN9A	27	49
C[C@@H](O)CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450591883	DC	On-Demand	Anodyne	SCN9A	27	49
O=C(NCCO)c1ccc(N2CCc3c(Cl)cc(F)cc3C2)nn1	ZINC000450591884	FD	On-Demand	Anodyne	SCD1	56	49
O=C(NCCO)c1ccc(N2CCc3c(Cl)cc(F)cc3C2)nn1	ZINC000450591884	FD	On-Demand	Anodyne	SCD	47	42
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591885	GE	On-Demand	Anodyne	DRD2	26	40
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591885	GE	On-Demand	Anodyne	DRD1	15	42
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591885	GE	On-Demand	Anodyne	DRD4	0	42
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591885	GE	On-Demand	Anodyne	HTR2A	19	42
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591885	GE	On-Demand	Anodyne	HTR2C	15	42
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591885	GE	On-Demand	Anodyne	ERG2	18	40
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591885	GE	On-Demand	Anodyne	SLC18A3	0	40
COc1cc(C(=O)N2CCO[C@@H](CCc3ccccc3)C2)c([N+](=O)[O-])cc1F	ZINC000450591886	GG	On-Demand	Bother	DRD4	15	43
COc1cc(C(=O)N2CCO[C@H](CCc3ccccc3)C2)c([N+](=O)[O-])cc1F	ZINC000450591887	GG	On-Demand	Bother	DRD4	15	43
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591888	GE	On-Demand	Anodyne	DRD2	26	40
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591888	GE	On-Demand	Anodyne	DRD1	15	42
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591888	GE	On-Demand	Anodyne	DRD4	0	42
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591888	GE	On-Demand	Anodyne	HTR2A	19	42
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591888	GE	On-Demand	Anodyne	HTR2C	15	42
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591888	GE	On-Demand	Anodyne	ERG2	18	40
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1c1nccn2cnnc12	ZINC000450591888	GE	On-Demand	Anodyne	SLC18A3	0	40
CC(C)c1ncsc1C(=O)NC[C@@H](C)c1nccs1	ZINC000450591895	CG	On-Demand	Anodyne	MAP1	54	38
CC(C)c1ncsc1C(=O)NC[C@H](C)c1nccs1	ZINC000450591897	CG	On-Demand	Anodyne	MAP1	54	38
COc1nccc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)n1	ZINC000450591906	FD	On-Demand	Anodyne	BDKRB1	0	40
COc1nccc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)n1	ZINC000450591906	FD	On-Demand	Anodyne	PTK6	28	42
COc1nccc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)n1	ZINC000450591906	FD	On-Demand	Anodyne	LRRK2	36	46
C[C@H](O)CCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450591919	ED	On-Demand	Anodyne	SCN9A	28	45
CCc1cccc(C(=O)NC[C@H](C)c2nccs2)n1	ZINC000450591920	CF	On-Demand	Anodyne	MAP	0	47
CCc1cccc(C(=O)NC[C@@H](C)c2nccs2)n1	ZINC000450591921	CF	On-Demand	Anodyne	MAP	0	47
C[C@@H](O)CCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450591925	ED	On-Demand	Anodyne	SCN9A	28	45
C[C@H](O)CCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450591927	ED	On-Demand	Anodyne	SCN9A	28	45
C[C@@H](O)CCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450591930	ED	On-Demand	Anodyne	SCN9A	28	45
COC(=O)c1cn(C2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)nn1	ZINC000450591934	GD	On-Demand	Anodyne	PREP	22	40
COC(=O)c1cn(C2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)nn1	ZINC000450591935	GD	On-Demand	Anodyne	PREP	22	40
CCCOc1ccc2c(c1)CCN(Cc1nc(C(=O)OC)cs1)C2	ZINC000450591936	EG	On-Demand	Anodyne	NOD2	43	39
CC(C)OCCNC(=O)c1cc2ccncc2s1	ZINC000450591941	CE	On-Demand	Anodyne	SELE	60	38
CC(C)OCCNC(=O)c1cc2ccncc2s1	ZINC000450591941	CE	On-Demand	Anodyne	ICAM1	49	33
CC(C)OCCNC(=O)c1cc2ccncc2s1	ZINC000450591941	CE	On-Demand	Anodyne	VCAM1	48	35
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	HTR1A	17	61
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	THRA	0	43
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	DRD2	33	43
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	DRD1	23	48
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	DRD4	25	48
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	HRH2	0	43
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	ADRA1D	30	42
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	HTR2A	39	49
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	HTR2C	26	61
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	HRH1	18	46
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	ADRA1B	24	43
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	DRD3	21	48
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	ADRA2B	15	43
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	ERG2	20	43
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	HTR7	18	43
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	SIGMAR1	20	57
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	CCR3	32	40
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	SLC18A3	16	44
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	CACNA1G	48	50
CCOC(=O)CNC(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450591947	GE	On-Demand	Anodyne	CYP2J2	62	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCOC(C)C	ZINC000450591956	DE	On-Demand	Anodyne	CTSS	20	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCOC(C)C	ZINC000450591956	DE	On-Demand	Anodyne	CAPN1	31	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCOC(C)C	ZINC000450591956	DE	On-Demand	Anodyne	CAPN2	40	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCOC(C)C	ZINC000450591956	DE	On-Demand	Anodyne	NPR	48	33
CN(CC1(O)CCC1)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450591963	FF	On-Demand	Anodyne	TRPC6	65	36
CN(CC1(O)CCC1)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450591963	FF	On-Demand	Anodyne	TRPC3	51	36
CCN1C(=O)C[C@H](C(=O)NCCC2CCC(OC)CC2)[C@H]1c1cccnc1	ZINC000450591981	FF	On-Demand	Anodyne	NAMPT	20	42
COc1cccc(-n2cc(C(=O)N(C)CC3(O)CCC3)nn2)c1	ZINC000450591989	DD	On-Demand	Anodyne	DRD4	40	31
CC[C@@H](O)CC(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450591998	CF	On-Demand	Anodyne	SDH1	0	40
CC[C@@H](O)CC(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450591998	CF	On-Demand	Anodyne	CCR1	31	41
CC[C@H](O)CC(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450592000	CF	On-Demand	Anodyne	SDH1	0	40
CC[C@H](O)CC(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450592000	CF	On-Demand	Anodyne	CCR1	31	41
OCCCN1CCC[C@H]1CNc1cc(N2CCCC2)ncn1	ZINC000450592027	DD	On-Demand	Anodyne	PRCP	0	42
OCCCN1CCC[C@@H]1CNc1cc(N2CCCC2)ncn1	ZINC000450592028	DD	On-Demand	Anodyne	PRCP	0	42
COC[C@@](C)(O)CCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450592039	ED	On-Demand	Bother	TAAR1	18	46
COC[C@](C)(O)CCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450592040	ED	On-Demand	Bother	TAAR1	18	46
COC1(CSc2nnc(-c3ccccc3Cl)n2C)CCC1	ZINC000450592046	DH	On-Demand	Anodyne	KCNH2	0	41
COC1(CSc2nnc(-c3ccccc3Cl)n2C)CCC1	ZINC000450592046	DH	On-Demand	Anodyne	HSD11B1	27	48
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450592048	FC	On-Demand	Anodyne	TGM2	19	42
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450592048	FC	On-Demand	Anodyne	GCK	47	34
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450592051	FC	On-Demand	Anodyne	TGM2	19	42
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450592051	FC	On-Demand	Anodyne	GCK	47	34
COc1cc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)ccc1Cl	ZINC000450592054	EE	On-Demand	Anodyne	DRD4	26	41
COc1cc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)ccc1Cl	ZINC000450592054	EE	On-Demand	Anodyne	SSTR5	57	39
COc1cc(CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)ccc1Cl	ZINC000450592054	EE	On-Demand	Anodyne	CCR3	26	42
COc1cc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)ccc1Cl	ZINC000450592055	EE	On-Demand	Anodyne	DRD4	26	41
COc1cc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)ccc1Cl	ZINC000450592055	EE	On-Demand	Anodyne	SSTR5	57	39
COc1cc(CN2CC[C@H](S(=O)(=O)NC(C)C)C2)ccc1Cl	ZINC000450592055	EE	On-Demand	Anodyne	CCR3	26	42
O=C(NCC1CCN(c2ccncc2)CC1)c1c(Cl)cc(Cl)cc1Cl	ZINC000450592061	GJ	On-Demand	Anodyne	HTR4	40	38
O=C(NCC1CCN(c2ccncc2)CC1)c1c(Cl)cc(Cl)cc1Cl	ZINC000450592061	GJ	On-Demand	Anodyne	F10	28	60
O=C(NCC1CCN(c2ccncc2)CC1)c1c(Cl)cc(Cl)cc1Cl	ZINC000450592061	GJ	On-Demand	Anodyne	CACNA1I	81	44
COC[C@](C)(O)CCNc1ccc([N+](=O)[O-])cc1C	ZINC000450592068	CE	On-Demand	Bother	CACNA1C	41	34
COC[C@](C)(O)CCNc1ccc([N+](=O)[O-])cc1C	ZINC000450592068	CE	On-Demand	Bother	CACNA1D	66	34
COC[C@@](C)(O)CCNc1ccc([N+](=O)[O-])cc1C	ZINC000450592070	CE	On-Demand	Bother	CACNA1C	41	34
COC[C@@](C)(O)CCNc1ccc([N+](=O)[O-])cc1C	ZINC000450592070	CE	On-Demand	Bother	CACNA1D	66	34
O=C(NCC1CCN(c2ccncc2)CC1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450592073	GI	On-Demand	Anodyne	F10	22	51
O=C(NCC1CCN(c2ccncc2)CC1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450592073	GI	On-Demand	Anodyne	CACNA1I	63	39
CCC[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450592078	DH	On-Demand	Anodyne	GPR88	0	42
COC[C@@](C)(O)CCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450592086	DF	On-Demand	Mild	MAP3K8	49	35
COC[C@](C)(O)CCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450592087	DF	On-Demand	Mild	MAP3K8	49	35
CC(C)OCCNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450592112	CG	On-Demand	Anodyne	SCN9A	0	47
CC(C)OCCNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450592112	CG	On-Demand	Anodyne	AMY2	43	30
CC(C)OCCNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450592114	CG	On-Demand	Anodyne	SCN9A	0	47
CC(C)OCCNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450592114	CG	On-Demand	Anodyne	AMY2	43	30
CC(C)OCCNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450592116	CG	On-Demand	Anodyne	SCN9A	0	47
CC(C)OCCNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450592116	CG	On-Demand	Anodyne	AMY2	43	30
CC(C)OCCNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450592118	CG	On-Demand	Anodyne	SCN9A	0	47
CC(C)OCCNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450592118	CG	On-Demand	Anodyne	AMY2	43	30
C[C@H](O)CCSc1nc2cc(Cl)cnc2[nH]1	ZINC000450592131	CE	On-Demand	Anodyne	ENPP1	26	48
Cn1nc(C(=O)N2CCO[C@@H](CCc3ccccc3)C2)c2c1CCCC2	ZINC000450592135	FF	On-Demand	Anodyne	PTGER4	40	33
Cn1nc(C(=O)N2CCO[C@@H](CCc3ccccc3)C2)c2c1CCCC2	ZINC000450592135	FF	On-Demand	Anodyne	MGLL	0	40
C[C@@H](O)CCSc1nc2cc(Cl)cnc2[nH]1	ZINC000450592136	CE	On-Demand	Anodyne	ENPP1	26	48
Cn1nc(C(=O)N2CCO[C@H](CCc3ccccc3)C2)c2c1CCCC2	ZINC000450592138	FF	On-Demand	Anodyne	PTGER4	40	33
Cn1nc(C(=O)N2CCO[C@H](CCc3ccccc3)C2)c2c1CCCC2	ZINC000450592138	FF	On-Demand	Anodyne	MGLL	0	40
CC(C)N1CCC(N2CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450592213	GI	On-Demand	Anodyne	MC4R	23	41
CC(C)N1CCC(N2CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450592213	GI	On-Demand	Anodyne	SIGMAR1	21	40
CC(C)N1CCC(N2CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450592213	GI	On-Demand	Anodyne	L3MBTL3	49	43
COC[C@](C)(O)CCNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450592243	DF	On-Demand	Bother	AADAC	0	51
COC[C@@](C)(O)CCNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450592244	DF	On-Demand	Bother	AADAC	0	51
Cc1cc(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592262	GH	On-Demand	Anodyne	P2RX7	43	42
Cc1cc(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592262	GH	On-Demand	Anodyne	EPHX2	25	49
Cc1cc(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592262	GH	On-Demand	Anodyne	PDE8B	56	33
Cc1cc(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592262	GH	On-Demand	Anodyne	RPA1	42	33
Cc1cc(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592262	GH	On-Demand	Anodyne	TMPRSS11D	42	31
Cc1cc(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592263	GH	On-Demand	Anodyne	P2RX7	43	42
Cc1cc(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592263	GH	On-Demand	Anodyne	EPHX2	25	49
Cc1cc(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592263	GH	On-Demand	Anodyne	PDE8B	56	33
Cc1cc(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592263	GH	On-Demand	Anodyne	RPA1	42	33
Cc1cc(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1Cl	ZINC000450592263	GH	On-Demand	Anodyne	TMPRSS11D	42	31
Cc1ccc(NS(=O)(=O)c2ccc(NC(CF)CF)c([N+](=O)[O-])c2)c(C)c1	ZINC000450592272	GH	On-Demand	Bother	BCL2L1	71	34
Cc1ccc(NS(=O)(=O)c2ccc(NC(CF)CF)c([N+](=O)[O-])c2)c(C)c1	ZINC000450592272	GH	On-Demand	Bother	BCL2	59	34
O=C(c1ccc(N[C@@H](CO)c2ccc(F)cc2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450592280	GE	On-Demand	Bother	BCL2L1	58	36
O=C(c1ccc(N[C@@H](CO)c2ccc(F)cc2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450592280	GE	On-Demand	Bother	BCL2	40	35
O=C(c1ccc(N[C@H](CO)c2ccc(F)cc2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450592281	GE	On-Demand	Bother	BCL2L1	58	36
O=C(c1ccc(N[C@H](CO)c2ccc(F)cc2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450592281	GE	On-Demand	Bother	BCL2	40	35
CSc1cccc(C(=O)N2CCO[C@H](C3CCCCC3)C2)c1	ZINC000450592282	DH	On-Demand	Anodyne	RHOA	0	46
CSc1cccc(C(=O)N2CCO[C@@H](C3CCCCC3)C2)c1	ZINC000450592283	DH	On-Demand	Anodyne	RHOA	0	46
CC(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450592291	CF	On-Demand	Bother	TAAR1	17	46
CC(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450592291	CF	On-Demand	Bother	AKR1C3	20	46
Cc1cnc([C@H](C)CNC(=O)Cc2ccc(O)c(F)c2)s1	ZINC000450592293	DF	On-Demand	Anodyne	TRPV1	0	46
Cc1cnc([C@@H](C)CNC(=O)Cc2ccc(O)c(F)c2)s1	ZINC000450592295	DF	On-Demand	Anodyne	TRPV1	0	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)CCc1ccccc1C	ZINC000450592326	FE	On-Demand	Anodyne	CA2	54	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)CCc1ccccc1C	ZINC000450592326	FE	On-Demand	Anodyne	CA1	48	39
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)CCc1ccccc1C	ZINC000450592326	FE	On-Demand	Anodyne	CA5B	55	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)CCc1ccccc1C	ZINC000450592326	FE	On-Demand	Anodyne	CA4	57	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)CCc1ccccc1C	ZINC000450592326	FE	On-Demand	Anodyne	CA5A	59	36
CC[C@H]1CN(C(=O)CC2(O)CCC2)CCN1Cc1ccccc1	ZINC000450592328	DE	On-Demand	Anodyne	SIGMAR1	21	40
CC[C@@H]1CN(C(=O)CC2(O)CCC2)CCN1Cc1ccccc1	ZINC000450592329	DE	On-Demand	Anodyne	SIGMAR1	21	40
C[C@H]1N(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCC12CCOCC2	ZINC000450592336	GI	On-Demand	Anodyne	PDE6D	84	38
C[C@H]1N(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCC12CCOCC2	ZINC000450592336	GI	On-Demand	Anodyne	IMDH_CRYPV	25	42
C[C@@H]1N(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCC12CCOCC2	ZINC000450592337	GI	On-Demand	Anodyne	PDE6D	84	38
C[C@@H]1N(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCC12CCOCC2	ZINC000450592337	GI	On-Demand	Anodyne	IMDH_CRYPV	25	42
OCCCN1CCC[C@@H]1CNc1nnc(-c2ccccc2Cl)s1	ZINC000450592344	FF	On-Demand	Anodyne	SPHK1	22	46
OCCCN1CCC[C@H]1CNc1nnc(-c2ccccc2Cl)s1	ZINC000450592347	FF	On-Demand	Anodyne	SPHK1	22	46
CCn1c(Cc2ccccc2)nnc1SCc1ccc(C(C)=O)cc1	ZINC000450592348	FI	On-Demand	Anodyne	AGTR1	19	45
CCn1c(Cc2ccccc2)nnc1SCc1ccc(C(C)=O)cc1	ZINC000450592348	FI	On-Demand	Anodyne	SLC5A2	0	40
CCn1c(Cc2ccccc2)nnc1SCc1ccc(C(C)=O)cc1	ZINC000450592348	FI	On-Demand	Anodyne	SLC27A1	53	43
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](O)C1CCC1	ZINC000450592362	DB	On-Demand	Anodyne	FOLH1	42	37
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](O)C1CCC1	ZINC000450592362	DB	On-Demand	Anodyne	HLA-A	41	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](O)C1CCC1	ZINC000450592362	DB	On-Demand	Anodyne	NPR	21	40
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](O)C1CCC1	ZINC000450592362	DB	On-Demand	Anodyne	F2RL1	47	32
COc1cccc(-n2cc(C(=O)N[C@@]3(C)CCCOC3)nn2)c1	ZINC000450592367	DD	On-Demand	Anodyne	ESRRA	17	41
COc1cccc(-n2cc(C(=O)N[C@]3(C)CCCOC3)nn2)c1	ZINC000450592368	DD	On-Demand	Anodyne	ESRRA	17	41
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](O)C1CCC1	ZINC000450592371	DB	On-Demand	Anodyne	FOLH1	42	37
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](O)C1CCC1	ZINC000450592371	DB	On-Demand	Anodyne	HLA-A	41	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](O)C1CCC1	ZINC000450592371	DB	On-Demand	Anodyne	NPR	21	40
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](O)C1CCC1	ZINC000450592371	DB	On-Demand	Anodyne	F2RL1	47	32
CCOc1ccc2c(c1)CCN(CC1(C(=O)OC)CC1)C2	ZINC000450592375	CE	On-Demand	Anodyne	NOD2	42	45
C[C@H]1CC[C@@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)C[C@H]1C	ZINC000450592401	DI	On-Demand	Anodyne	CHRNA2	40	41
C[C@H]1CC[C@@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)C[C@H]1C	ZINC000450592401	DI	On-Demand	Anodyne	CHRNA4	16	41
C[C@H]1CC[C@@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)C[C@H]1C	ZINC000450592401	DI	On-Demand	Anodyne	CRTY	0	41
C[C@H]1CC[C@@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)C[C@@H]1C	ZINC000450592402	DI	On-Demand	Anodyne	CHRNA2	40	41
C[C@H]1CC[C@@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)C[C@@H]1C	ZINC000450592402	DI	On-Demand	Anodyne	CHRNA4	16	41
C[C@H]1CC[C@@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)C[C@@H]1C	ZINC000450592402	DI	On-Demand	Anodyne	CRTY	0	41
C[C@H]1C[C@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)CC[C@H]1C	ZINC000450592403	DI	On-Demand	Anodyne	CHRNA2	40	41
C[C@H]1C[C@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)CC[C@H]1C	ZINC000450592403	DI	On-Demand	Anodyne	CHRNA4	16	41
C[C@H]1C[C@H](C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)CC[C@H]1C	ZINC000450592403	DI	On-Demand	Anodyne	CRTY	0	41
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)C1	ZINC000450592404	DI	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)C1	ZINC000450592404	DI	On-Demand	Anodyne	CHRNA4	16	41
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)C1	ZINC000450592404	DI	On-Demand	Anodyne	CRTY	0	41
CCO[C@@H]1COCC[C@@H]1NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450592429	GF	On-Demand	Anodyne	TRPC6	62	34
CCO[C@@H]1COCC[C@@H]1NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450592429	GF	On-Demand	Anodyne	TRPC3	48	34
CCO[C@H]1COCC[C@H]1NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450592430	GF	On-Demand	Anodyne	TRPC6	62	34
CCO[C@H]1COCC[C@H]1NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450592430	GF	On-Demand	Anodyne	TRPC3	48	34
CCO[C@@H]1COCC[C@H]1NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450592431	GF	On-Demand	Anodyne	TRPC6	62	34
CCO[C@@H]1COCC[C@H]1NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450592431	GF	On-Demand	Anodyne	TRPC3	48	34
CCO[C@H]1COCC[C@@H]1NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450592432	GF	On-Demand	Anodyne	TRPC6	62	34
CCO[C@H]1COCC[C@@H]1NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450592432	GF	On-Demand	Anodyne	TRPC3	48	34
CC(=O)c1cccc(CN2CCc3ccc(F)cc3C2)c1	ZINC000450592450	CH	On-Demand	Anodyne	DRD2	17	41
CC(=O)c1cccc(CN2CCc3ccc(F)cc3C2)c1	ZINC000450592450	CH	On-Demand	Anodyne	DRD4	15	40
CC(=O)c1cccc(CN2CCc3ccc(F)cc3C2)c1	ZINC000450592450	CH	On-Demand	Anodyne	SIGMAR1	26	41
CC(=O)c1cccc(CN2CCc3ccc(F)cc3C2)c1	ZINC000450592450	CH	On-Demand	Anodyne	CCR3	48	43
CC(=O)c1cccc(CN2CCc3ccc(F)cc3C2)c1	ZINC000450592450	CH	On-Demand	Anodyne	HDAC6	41	35
CC(=O)c1cccc(CN2CCc3ccc(F)cc3C2)c1	ZINC000450592450	CH	On-Demand	Anodyne	AKR1C3	38	47
CC(=O)c1cccc(CN2CCc3ccc(F)cc3C2)c1	ZINC000450592450	CH	On-Demand	Anodyne	NOD1	31	41
CC(=O)c1cccc(CN2CCc3ccc(F)cc3C2)c1	ZINC000450592450	CH	On-Demand	Anodyne	NOD2	47	41
COc1cccc(OCCC(=O)Nc2ccc(F)cc2OCC(F)F)c1	ZINC000450592463	FH	On-Demand	Anodyne	MTNR1A	23	42
COc1cccc(OCCC(=O)Nc2ccc(F)cc2OCC(F)F)c1	ZINC000450592463	FH	On-Demand	Anodyne	MTNR1B	30	49
C[C@H](Oc1ccccn1)C(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450592480	EG	On-Demand	Anodyne	P2RY1	20	41
C[C@@H](Oc1ccccn1)C(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450592486	EG	On-Demand	Anodyne	P2RY1	20	41
COc1nccc(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])n1	ZINC000450592525	FD	On-Demand	Bother	BDKRB1	0	41
COC(=O)[C@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450592533	DE	On-Demand	Anodyne	SLC6A1	42	32
COC(=O)[C@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450592533	DE	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)[C@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450592533	DE	On-Demand	Anodyne	CACNA1B	46	34
COC(=O)[C@@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450592545	DE	On-Demand	Anodyne	SLC6A1	42	32
COC(=O)[C@@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450592545	DE	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)[C@@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450592545	DE	On-Demand	Anodyne	CACNA1B	46	34
CCn1c(Cc2ccccc2)nnc1SC[C@@H]1CCCC1(F)F	ZINC000450592548	EI	On-Demand	Anodyne	SLC27A1	40	33
COC(=O)[C@@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450592555	DE	On-Demand	Anodyne	SLC6A1	42	32
COC(=O)[C@@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450592555	DE	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)[C@@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450592555	DE	On-Demand	Anodyne	CACNA1B	46	34
COC1CCC(CCNC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450592556	EG	On-Demand	Anodyne	SIRT2	46	32
COC1CCC(CCNC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450592556	EG	On-Demand	Anodyne	SIRT1	41	31
COC(=O)[C@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450592559	DE	On-Demand	Anodyne	SLC6A1	42	32
COC(=O)[C@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450592559	DE	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)[C@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450592559	DE	On-Demand	Anodyne	CACNA1B	46	34
COC1CCC(CCNC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450592560	EG	On-Demand	Anodyne	SIRT2	46	32
COC1CCC(CCNC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450592560	EG	On-Demand	Anodyne	SIRT1	41	31
CCn1c(Cc2ccccc2)nnc1SC[C@H]1CCCC1(F)F	ZINC000450592566	EI	On-Demand	Anodyne	SLC27A1	40	33
CCn1c(Cc2ccccc2)nnc1SCCC(C)(F)F	ZINC000450592570	DI	On-Demand	Anodyne	SLC27A1	45	39
CC(F)(F)CCSc1nc2cc(Cl)cnc2[nH]1	ZINC000450592622	CH	On-Demand	Anodyne	ENPP1	25	46
COc1nccc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])n1	ZINC000450592623	ED	On-Demand	Bother	TAAR1	17	44
F[C@@H]1CCN(c2cc(N3CCCCC3)ncn2)C1	ZINC000450592629	CE	On-Demand	Anodyne	PRCP	31	40
F[C@H]1CCN(c2cc(N3CCCCC3)ncn2)C1	ZINC000450592630	CE	On-Demand	Anodyne	PRCP	31	40
COC(=O)[C@@H](NCCCNc1ncnc2ccc(C)cc12)C(C)C	ZINC000450592637	ED	On-Demand	Anodyne	CLK4	42	38
CCN1C(=O)CCc2cc(NC(=O)c3ccc(-c4cnn(C)c4)o3)ccc21	ZINC000450592665	FG	On-Demand	Anodyne	SCN10A	17	42
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)on1	ZINC000450592668	FD	On-Demand	Anodyne	SLC6A1	65	38
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)on1	ZINC000450592668	FD	On-Demand	Anodyne	SLC6A4	19	40
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)on1	ZINC000450592668	FD	On-Demand	Anodyne	SLC6A3	38	40
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)on1	ZINC000450592671	FD	On-Demand	Anodyne	SLC6A1	65	38
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)on1	ZINC000450592671	FD	On-Demand	Anodyne	SLC6A4	19	40
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)on1	ZINC000450592671	FD	On-Demand	Anodyne	SLC6A3	38	40
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)on1	ZINC000450592674	FD	On-Demand	Anodyne	SLC6A1	65	38
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)on1	ZINC000450592674	FD	On-Demand	Anodyne	SLC6A4	19	40
CCc1cc(CCCN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)on1	ZINC000450592674	FD	On-Demand	Anodyne	SLC6A3	38	40
CCCOc1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC)c(OC)c1	ZINC000450592678	GI	On-Demand	Anodyne	KCNK3	42	37
CCCOc1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC)c(OC)c1	ZINC000450592678	GI	On-Demand	Anodyne	BRPF1	0	40
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H](F)C3)nc2)CC1	ZINC000450592680	EC	On-Demand	Anodyne	GCK	58	33
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H](F)C3)nc2)CC1	ZINC000450592680	EC	On-Demand	Anodyne	GCKR	41	35
COC(=O)C1(N(C)CCCC(=O)c2ccc(F)cc2)CCCC1	ZINC000450592681	DG	On-Demand	Anodyne	DRD2	28	40
COC(=O)C1(N(C)CCCC(=O)c2ccc(F)cc2)CCCC1	ZINC000450592681	DG	On-Demand	Anodyne	ERG2	18	40
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@H](F)C3)nc2)CC1	ZINC000450592682	EC	On-Demand	Anodyne	GCK	58	33
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@H](F)C3)nc2)CC1	ZINC000450592682	EC	On-Demand	Anodyne	GCKR	41	35
O=[N+]([O-])c1ccccc1CN(Cc1ccn(CC(F)(F)F)n1)C1CC1	ZINC000450592684	FH	On-Demand	Bother	COLA	53	35
Cc1nccc(N2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)n1	ZINC000450592685	FD	On-Demand	Anodyne	SORD	55	38
Cc1nccc(N2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)n1	ZINC000450592685	FD	On-Demand	Anodyne	GPBAR1	0	41
COCC1(C)CCN(C(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450592698	EG	On-Demand	Anodyne	SLC12A5	64	39
N#Cc1cccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450592699	BF	On-Demand	Mild	CHRNA10	65	51
N#Cc1cccc(OC[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450592704	BF	On-Demand	Mild	CHRNA10	65	51
CCC[C@H](NC(=O)c1ccc(C2CC2)nc1C)C(=O)OC	ZINC000450592707	CE	On-Demand	Anodyne	P2RY12	43	31
CCC[C@@H](NC(=O)c1ccc(C2CC2)nc1C)C(=O)OC	ZINC000450592708	CE	On-Demand	Anodyne	P2RY12	43	31
Cn1cc(NC(=O)CCCC(=O)C2CC2)c(-c2ccccc2)n1	ZINC000450592721	DG	On-Demand	Anodyne	HDAC1	20	40
Cn1cc(NC(=O)CCCC(=O)C2CC2)c(-c2ccccc2)n1	ZINC000450592721	DG	On-Demand	Anodyne	HDAC7	15	40
CN(CCC1CC1)CCN(C)Cc1ccccc1	ZINC000450592743	BF	On-Demand	Anodyne	ACHE	20	46
CN(CCC1CC1)CCN(C)Cc1ccccc1	ZINC000450592743	BF	On-Demand	Anodyne	SIGMAR1	19	44
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000450592745	ED	On-Demand	Anodyne	ACE	70	37
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000450592745	ED	On-Demand	Anodyne	SLC6A1	138	47
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000450592745	ED	On-Demand	Anodyne	SLC6A4	38	47
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000450592745	ED	On-Demand	Anodyne	SLC6A3	81	53
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000450592745	ED	On-Demand	Anodyne	SLC18A2	57	39
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000450592745	ED	On-Demand	Anodyne	MME	92	37
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000450592745	ED	On-Demand	Anodyne	VACHT_TETCF	0	41
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)Cc1ccccc1	ZINC000450592745	ED	On-Demand	Anodyne	TIMP3	48	35
CCC[C@H](OC)C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450592747	FH	On-Demand	Anodyne	PRSS2	56	33
CCC[C@@H](OC)C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450592748	FH	On-Demand	Anodyne	PRSS2	56	33
CCOC(=O)c1ccc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)nc1	ZINC000450592750	FG	On-Demand	Bother	COLA	91	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(C)(CN2CCN(C)CC2)CC1	ZINC000450592766	GH	On-Demand	Anodyne	EPHX2	20	48
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@@H](F)C1	ZINC000450592779	FD	On-Demand	Bother	CASP3	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@@H](F)C1	ZINC000450592779	FD	On-Demand	Bother	CASP7	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@@H](F)C1	ZINC000450592779	FD	On-Demand	Bother	PHOSPHO1	0	42
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@@H](F)C1	ZINC000450592779	FD	On-Demand	Bother	PMM2	0	42
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@@H](F)C1	ZINC000450592779	FD	On-Demand	Bother	DDIT3	0	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@H](F)C1	ZINC000450592780	FD	On-Demand	Bother	CASP3	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@H](F)C1	ZINC000450592780	FD	On-Demand	Bother	CASP7	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@H](F)C1	ZINC000450592780	FD	On-Demand	Bother	PHOSPHO1	0	42
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@H](F)C1	ZINC000450592780	FD	On-Demand	Bother	PMM2	0	42
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@H](F)C1	ZINC000450592780	FD	On-Demand	Bother	DDIT3	0	41
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@]1(C)CC=CCC1	ZINC000450592808	DD	On-Demand	Anodyne	FOLH1	41	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@]1(C)CC=CCC1	ZINC000450592809	DD	On-Demand	Anodyne	FOLH1	41	36
CO[C@H](Cc1ccccc1)C(=O)N1CCO[C@H](C2CCCCC2)C1	ZINC000450592818	EG	On-Demand	Anodyne	SSTR3	73	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCO[C@H](C2CCCCC2)C1	ZINC000450592819	EG	On-Demand	Anodyne	SSTR3	73	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@H](C2CCCCC2)C1	ZINC000450592820	EG	On-Demand	Anodyne	SSTR3	73	31
CO[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H](C2CCCCC2)C1	ZINC000450592821	EG	On-Demand	Anodyne	SSTR3	73	31
CC(C)[C@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450592822	EH	On-Demand	Anodyne	SLC1A1	47	33
CC(C)[C@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450592822	EH	On-Demand	Anodyne	SLC1A3	50	33
CC(C)[C@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450592822	EH	On-Demand	Anodyne	SLC1A2	57	33
CC(C)[C@@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450592823	EH	On-Demand	Anodyne	SLC1A1	47	33
CC(C)[C@@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450592823	EH	On-Demand	Anodyne	SLC1A3	50	33
CC(C)[C@@H](O)CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000450592823	EH	On-Demand	Anodyne	SLC1A2	57	33
Cc1ccccc1CCN(C)c1ncccc1[N+](=O)[O-]	ZINC000450592827	CF	On-Demand	Bother	COLA	57	34
COC(=O)CCN1CCN(C(=O)Cc2ccc(O)c(OC)c2)C[C@H]1C	ZINC000450592830	FD	On-Demand	Anodyne	TRPV1	0	40
COC(=O)CCN1CCN(C(=O)Cc2ccc(O)c(OC)c2)C[C@H]1C	ZINC000450592830	FD	On-Demand	Anodyne	RORC	40	32
COC(=O)CCN1CCN(C(=O)Cc2ccc(O)c(OC)c2)C[C@@H]1C	ZINC000450592831	FD	On-Demand	Anodyne	TRPV1	0	40
COC(=O)CCN1CCN(C(=O)Cc2ccc(O)c(OC)c2)C[C@@H]1C	ZINC000450592831	FD	On-Demand	Anodyne	RORC	40	32
FCC(CF)Nc1ncnc2cc(F)c(F)cc12	ZINC000450592832	CF	On-Demand	Anodyne	USP10	0	43
FCC(CF)Nc1ncnc2cc(F)c(F)cc12	ZINC000450592832	CF	On-Demand	Anodyne	USP13	0	43
COc1cc(CC(=O)N2CCC3(CCOCC3)[C@H]2C)ccc1O	ZINC000450592850	DE	On-Demand	Anodyne	TRPV1	15	44
COc1cc(CC(=O)N2CCC3(CCOCC3)[C@H]2C)ccc1O	ZINC000450592850	DE	On-Demand	Anodyne	SHBG	18	43
COc1cc(CC(=O)N2CCC3(CCOCC3)[C@@H]2C)ccc1O	ZINC000450592851	DE	On-Demand	Anodyne	TRPV1	15	44
COc1cc(CC(=O)N2CCC3(CCOCC3)[C@@H]2C)ccc1O	ZINC000450592851	DE	On-Demand	Anodyne	SHBG	18	43
CCN1CCN(C(=O)c2ccc(C)c3c2CCC3)CC1=O	ZINC000450592852	CD	On-Demand	Anodyne	P2RX7	18	56
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@H]1C	ZINC000450592864	GG	On-Demand	Anodyne	MC4R	41	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@H]1C	ZINC000450592864	GG	On-Demand	Anodyne	PRCP	52	38
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@H]1C	ZINC000450592864	GG	On-Demand	Anodyne	MC3R	41	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@H]1C	ZINC000450592864	GG	On-Demand	Anodyne	MC5R	32	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@@H]1C	ZINC000450592865	GG	On-Demand	Anodyne	MC4R	41	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@@H]1C	ZINC000450592865	GG	On-Demand	Anodyne	PRCP	52	38
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@@H]1C	ZINC000450592865	GG	On-Demand	Anodyne	MC3R	41	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@@H]1C	ZINC000450592865	GG	On-Demand	Anodyne	MC5R	32	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@H]1C	ZINC000450592866	GG	On-Demand	Anodyne	MC4R	41	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@H]1C	ZINC000450592866	GG	On-Demand	Anodyne	PRCP	52	38
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@H]1C	ZINC000450592866	GG	On-Demand	Anodyne	MC3R	41	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@H]1C	ZINC000450592866	GG	On-Demand	Anodyne	MC5R	32	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@@H]1C	ZINC000450592867	GG	On-Demand	Anodyne	MC4R	41	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@@H]1C	ZINC000450592867	GG	On-Demand	Anodyne	PRCP	52	38
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@@H]1C	ZINC000450592867	GG	On-Demand	Anodyne	MC3R	41	40
COC(=O)CCN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@@H]1C	ZINC000450592867	GG	On-Demand	Anodyne	MC5R	32	40
CC[C@@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592875	DB	On-Demand	Anodyne	FOLH1	51	40
CC[C@@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592875	DB	On-Demand	Anodyne	CTSD	15	41
CC[C@@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592875	DB	On-Demand	Anodyne	CAPN2	60	34
CC[C@@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592875	DB	On-Demand	Anodyne	NPR	26	41
CC[C@@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592875	DB	On-Demand	Anodyne	F2RL1	50	33
CC[C@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592876	DB	On-Demand	Anodyne	FOLH1	51	40
CC[C@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592876	DB	On-Demand	Anodyne	CTSD	15	41
CC[C@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592876	DB	On-Demand	Anodyne	CAPN2	60	34
CC[C@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592876	DB	On-Demand	Anodyne	NPR	26	41
CC[C@H](O)CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)OC	ZINC000450592876	DB	On-Demand	Anodyne	F2RL1	50	33
OC[C@H](Nc1nccc(N[C@@H]2CCCOC2)n1)c1ccc(F)cc1	ZINC000450592878	ED	On-Demand	Anodyne	MAPK1	63	37
OC[C@H](Nc1nccc(N[C@H]2CCCOC2)n1)c1ccc(F)cc1	ZINC000450592879	ED	On-Demand	Anodyne	MAPK1	63	37
OC[C@@H](Nc1nccc(N[C@@H]2CCCOC2)n1)c1ccc(F)cc1	ZINC000450592880	ED	On-Demand	Anodyne	MAPK1	63	37
OC[C@@H](Nc1nccc(N[C@H]2CCCOC2)n1)c1ccc(F)cc1	ZINC000450592881	ED	On-Demand	Anodyne	MAPK1	63	37
O=C(Nc1cccc(Cl)c1)c1ccc(NC[C@H]2CCCN2CCCO)nc1	ZINC000450592888	GG	On-Demand	Anodyne	TAAR1	15	41
O=C(Nc1cccc(Cl)c1)c1ccc(NC[C@@H]2CCCN2CCCO)nc1	ZINC000450592889	GG	On-Demand	Anodyne	TAAR1	15	41
CN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)C1CC(O)C1	ZINC000450592893	DF	On-Demand	Anodyne	PRCP	47	35
CN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)C1CC(O)C1	ZINC000450592894	DF	On-Demand	Anodyne	PRCP	47	35
CN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)C1CC(O)C1	ZINC000450592895	DF	On-Demand	Anodyne	PRCP	47	35
CN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)C1CC(O)C1	ZINC000450592896	DF	On-Demand	Anodyne	PRCP	47	35
O=[N+]([O-])c1cccnc1NC[C@H]1CCCN1CCCO	ZINC000450592899	CD	On-Demand	Bother	PRKCQ	43	34
O=[N+]([O-])c1cccnc1NC[C@@H]1CCCN1CCCO	ZINC000450592900	CD	On-Demand	Bother	PRKCQ	43	34
COC[C@@](C)(O)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450592918	FD	On-Demand	Bother	BCL2L1	24	42
COC[C@@](C)(O)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450592918	FD	On-Demand	Bother	BCL2	19	42
COC[C@@](C)(O)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450592918	FD	On-Demand	Bother	LRRK2	21	40
COC[C@](C)(O)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450592921	FD	On-Demand	Bother	BCL2L1	24	42
COC[C@](C)(O)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450592921	FD	On-Demand	Bother	BCL2	19	42
COC[C@](C)(O)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450592921	FD	On-Demand	Bother	LRRK2	21	40
CC[C@@H](c1ccccc1)N(CC(=O)OC)CC1CC(F)(F)C1	ZINC000450592926	DH	On-Demand	Anodyne	KCNA5	26	40
CC[C@H](c1ccccc1)N(CC(=O)OC)CC1CC(F)(F)C1	ZINC000450592927	DH	On-Demand	Anodyne	KCNA5	26	40
COC[C@@](C)(O)CCNc1cc(N2CCC[C@H](C)C2)ncn1	ZINC000450592939	DD	On-Demand	Anodyne	PRCP	0	45
COC[C@@](C)(O)CCNc1cc(N2CCC[C@@H](C)C2)ncn1	ZINC000450592940	DD	On-Demand	Anodyne	PRCP	0	45
COC(=O)C[C@@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450592941	CG	On-Demand	Anodyne	SLC6A1	71	34
COC(=O)C[C@@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450592941	CG	On-Demand	Anodyne	ACKR3	54	36
COC[C@](C)(O)CCNc1cc(N2CCC[C@@H](C)C2)ncn1	ZINC000450592942	DD	On-Demand	Anodyne	PRCP	0	45
COC[C@](C)(O)CCNc1cc(N2CCC[C@H](C)C2)ncn1	ZINC000450592943	DD	On-Demand	Anodyne	PRCP	0	45
COC(=O)C[C@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450592950	CG	On-Demand	Anodyne	SLC6A1	71	34
COC(=O)C[C@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450592950	CG	On-Demand	Anodyne	ACKR3	54	36
COC(=O)C[C@@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450592952	CG	On-Demand	Anodyne	SLC6A1	71	34
COC(=O)C[C@@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450592952	CG	On-Demand	Anodyne	ACKR3	54	36
COC(=O)C[C@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450592953	CG	On-Demand	Anodyne	SLC6A1	71	34
COC(=O)C[C@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450592953	CG	On-Demand	Anodyne	ACKR3	54	36
CCO[C@@H]1COCC[C@@H]1NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450592985	GF	On-Demand	Anodyne	PYGL	43	38
CCO[C@H]1COCC[C@@H]1NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450592986	GF	On-Demand	Anodyne	PYGL	43	38
CCO[C@H]1COCC[C@H]1NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450592987	GF	On-Demand	Anodyne	PYGL	43	38
CCO[C@@H]1COCC[C@H]1NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450592988	GF	On-Demand	Anodyne	PYGL	43	38
CCn1c(Cc2ccccc2)nnc1SCC(=O)c1ccc(C(=O)OC)o1	ZINC000450592991	GG	On-Demand	Anodyne	AGTR1	15	46
CCn1c(Cc2ccccc2)nnc1SCC(=O)c1ccc(C(=O)OC)o1	ZINC000450592991	GG	On-Demand	Anodyne	SLC27A1	52	48
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593004	DC	On-Demand	Anodyne	MME	56	35
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593004	DC	On-Demand	Anodyne	PAPA1_CARPA	48	36
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593004	DC	On-Demand	Anodyne	CYSP_TRYCR	40	35
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593004	DC	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593004	DC	On-Demand	Anodyne	CAPN2	45	34
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593004	DC	On-Demand	Anodyne	NPR	49	36
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593004	DC	On-Demand	Anodyne	AMP1_PLAFQ	41	35
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593005	DC	On-Demand	Anodyne	MME	56	35
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593005	DC	On-Demand	Anodyne	PAPA1_CARPA	48	36
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593005	DC	On-Demand	Anodyne	CYSP_TRYCR	40	35
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593005	DC	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593005	DC	On-Demand	Anodyne	CAPN2	45	34
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593005	DC	On-Demand	Anodyne	NPR	49	36
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593005	DC	On-Demand	Anodyne	AMP1_PLAFQ	41	35
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593006	DC	On-Demand	Anodyne	MME	56	35
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593006	DC	On-Demand	Anodyne	PAPA1_CARPA	48	36
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593006	DC	On-Demand	Anodyne	CYSP_TRYCR	40	35
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593006	DC	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593006	DC	On-Demand	Anodyne	CAPN2	45	34
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593006	DC	On-Demand	Anodyne	NPR	49	36
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450593006	DC	On-Demand	Anodyne	AMP1_PLAFQ	41	35
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593008	DC	On-Demand	Anodyne	MME	56	35
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593008	DC	On-Demand	Anodyne	PAPA1_CARPA	48	36
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593008	DC	On-Demand	Anodyne	CYSP_TRYCR	40	35
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593008	DC	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593008	DC	On-Demand	Anodyne	CAPN2	45	34
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593008	DC	On-Demand	Anodyne	NPR	49	36
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450593008	DC	On-Demand	Anodyne	AMP1_PLAFQ	41	35
COc1cc2c(NC[C@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593009	EF	On-Demand	Anodyne	HRP1_PLAFA	73	32
COc1cc2c(NC[C@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593009	EF	On-Demand	Anodyne	FGFR2	49	35
COc1cc2c(NC[C@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593009	EF	On-Demand	Anodyne	AURKB	21	41
COc1cc2c(NC[C@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593009	EF	On-Demand	Anodyne	HNMT	61	36
COc1cc2c(NC[C@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593009	EF	On-Demand	Anodyne	MET	53	35
COc1cc2c(NC[C@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593009	EF	On-Demand	Anodyne	AURKA	24	40
COc1cc2c(NC[C@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593009	EF	On-Demand	Anodyne	ACKR3	57	33
COc1cc2c(NC[C@@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593011	EF	On-Demand	Anodyne	HRP1_PLAFA	73	32
COc1cc2c(NC[C@@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593011	EF	On-Demand	Anodyne	FGFR2	49	35
COc1cc2c(NC[C@@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593011	EF	On-Demand	Anodyne	AURKB	21	41
COc1cc2c(NC[C@@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593011	EF	On-Demand	Anodyne	HNMT	61	36
COc1cc2c(NC[C@@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593011	EF	On-Demand	Anodyne	MET	53	35
COc1cc2c(NC[C@@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593011	EF	On-Demand	Anodyne	AURKA	24	40
COc1cc2c(NC[C@@H]3CCCN3CCCO)ccnc2cc1F	ZINC000450593011	EF	On-Demand	Anodyne	ACKR3	57	33
COc1ccc(CNC(=O)CCN(C)C2CCC(CO)CC2)c(OC)c1	ZINC000450593025	FE	On-Demand	Anodyne	MTNR1A	58	37
COc1ccc(CNC(=O)CCN(C)C2CCC(CO)CC2)c(OC)c1	ZINC000450593025	FE	On-Demand	Anodyne	MTNR1B	42	34
C[C@@H]1CCC[C@H](CO)N1CC/C=C\c1ccccc1	ZINC000450593031	CG	On-Demand	Anodyne	SLC18A2	46	42
C[C@@H]1CCC[C@@H](CO)N1CC/C=C\c1ccccc1	ZINC000450593033	CG	On-Demand	Anodyne	SLC18A2	46	42
C[C@@H]1CCC[C@H](CO)N1CC/C=C/c1ccccc1	ZINC000450593034	CG	On-Demand	Anodyne	SLC18A2	46	42
C[C@@H]1CCC[C@@H](CO)N1CC/C=C/c1ccccc1	ZINC000450593035	CG	On-Demand	Anodyne	SLC18A2	46	42
CCOC(=O)[C@@](C)(O)CNC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450593040	ED	On-Demand	Anodyne	IRAK4	22	44
CCOC(=O)[C@](C)(O)CNC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450593041	ED	On-Demand	Anodyne	IRAK4	22	44
COC(=O)c1ccc(CN2CCN(c3nc(C)cc(C)n3)CC2)cc1Cl	ZINC000450593048	FF	On-Demand	Anodyne	DRD4	37	41
COC(=O)c1ccc(CN2CCN(c3nc(C)cc(C)n3)CC2)cc1Cl	ZINC000450593048	FF	On-Demand	Anodyne	MCHR1	24	41
CC[C@@H]1CN(C(=O)c2nn(C)c3c2CCCC3)CCN1Cc1ccccc1	ZINC000450593066	FG	On-Demand	Anodyne	FABP4	43	38
CC[C@H]1CN(C(=O)c2nn(C)c3c2CCCC3)CCN1Cc1ccccc1	ZINC000450593068	FG	On-Demand	Anodyne	FABP4	43	38
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	HTR1A	82	71
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	DRD2	78	71
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	DRD1	49	69
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	DRD4	51	61
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	ADRA1D	41	52
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	HTR1D	36	42
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	HTR1B	27	42
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	HTR2A	80	71
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	HTR2C	63	55
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	SLC6A4	30	43
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	ADRA1A	40	41
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	HRH1	21	71
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	ADRA1B	30	47
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	DRD3	65	61
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	DRD5	22	45
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	ERG2	24	52
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	HTR7	89	48
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	SIGMAR1	24	67
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	SLC18A3	0	50
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	HTR3B	0	49
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	CYP2J2	55	41
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	NET	0	56
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	AP2S1	0	52
Cc1cc(C)nc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450593074	FG	On-Demand	Anodyne	SLC27A1	41	36
Cc1ccc(F)c(CC(=O)N2CCN(c3ccnc(C)n3)CC2)c1	ZINC000450593106	EE	On-Demand	Anodyne	SORD	53	38
C[C@@H]1CCC[C@@]1(C)C(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450593124	FE	On-Demand	Anodyne	GRIN1	45	37
C[C@@H]1CCC[C@]1(C)C(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450593125	FE	On-Demand	Anodyne	GRIN1	45	37
C[C@H]1CCC[C@]1(C)C(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450593126	FE	On-Demand	Anodyne	GRIN1	45	37
C[C@H]1CCC[C@@]1(C)C(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450593127	FE	On-Demand	Anodyne	GRIN1	45	37
Clc1ccc(CCN2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1	ZINC000450593128	DH	On-Demand	Anodyne	SIGMAR1	17	42
Clc1ccc(CCN2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1	ZINC000450593128	DH	On-Demand	Anodyne	BIRC2	44	42
Clc1ccc(CCN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cc1	ZINC000450593129	DH	On-Demand	Anodyne	SIGMAR1	17	42
Clc1ccc(CCN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cc1	ZINC000450593129	DH	On-Demand	Anodyne	BIRC2	44	42
Clc1ccc(CCN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)cc1	ZINC000450593130	DH	On-Demand	Anodyne	SIGMAR1	17	42
Clc1ccc(CCN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)cc1	ZINC000450593130	DH	On-Demand	Anodyne	BIRC2	44	42
Clc1ccc(CCN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1	ZINC000450593131	DH	On-Demand	Anodyne	SIGMAR1	17	42
Clc1ccc(CCN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1	ZINC000450593131	DH	On-Demand	Anodyne	BIRC2	44	42
CCNC(=O)c1ccc(N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)nn1	ZINC000450593132	DF	On-Demand	Anodyne	SCD1	41	40
CCNC(=O)c1ccc(N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)nn1	ZINC000450593133	DF	On-Demand	Anodyne	SCD1	41	40
CCNC(=O)c1ccc(N2[C@@H](C)[C@H](c3ccccc3)C[C@H]2C)nn1	ZINC000450593134	DF	On-Demand	Anodyne	SCD1	41	40
CCNC(=O)c1ccc(N2[C@@H](C)[C@@H](c3ccccc3)C[C@H]2C)nn1	ZINC000450593135	DF	On-Demand	Anodyne	SCD1	41	40
Cc1nc(-c2ccccn2)nc(N2CC[C@@H](F)C2)c1C	ZINC000450593141	CF	On-Demand	Anodyne	METAP1	38	43
Cc1nc(-c2ccccn2)nc(N2CC[C@H](F)C2)c1C	ZINC000450593142	CF	On-Demand	Anodyne	METAP1	38	43
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](F)C1	ZINC000450593169	DC	On-Demand	Anodyne	CA2	35	47
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](F)C1	ZINC000450593169	DC	On-Demand	Anodyne	CA7	41	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](F)C1	ZINC000450593169	DC	On-Demand	Anodyne	CA4	26	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](F)C1	ZINC000450593169	DC	On-Demand	Anodyne	LIPG	50	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](F)C1	ZINC000450593169	DC	On-Demand	Anodyne	Q5TU56_ANOGA	0	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](F)C1	ZINC000450593170	DC	On-Demand	Anodyne	CA2	35	47
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](F)C1	ZINC000450593170	DC	On-Demand	Anodyne	CA7	41	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](F)C1	ZINC000450593170	DC	On-Demand	Anodyne	CA4	26	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](F)C1	ZINC000450593170	DC	On-Demand	Anodyne	LIPG	50	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](F)C1	ZINC000450593170	DC	On-Demand	Anodyne	Q5TU56_ANOGA	0	42
COc1cc(OC)c2ncnc(NCc3ccnc(OC)n3)c2c1	ZINC000450593200	ED	On-Demand	Anodyne	PDE6A	45	35
N#Cc1cnc(NCC[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1	ZINC000450593210	DG	On-Demand	Mild	PRKCQ	38	41
N#Cc1cnc(NCC[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1	ZINC000450593211	DG	On-Demand	Mild	PRKCQ	38	41
CC(C)OCCNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450593228	ED	On-Demand	Anodyne	PIK3CD	23	47
CC(C)OCCNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450593228	ED	On-Demand	Anodyne	PIK3CB	40	47
CCOC(=O)c1ccc(CN2CCC[C@@H](Nc3cc(OC)cc(OC)c3)C2)nc1	ZINC000450593230	GG	On-Demand	Anodyne	P2RY12	43	45
CCOC(=O)c1ccc(CN2CCC[C@@H](Nc3cc(OC)cc(OC)c3)C2)nc1	ZINC000450593230	GG	On-Demand	Anodyne	SSTR5	45	39
CCOC(=O)c1ccc(CN2CCC[C@@H](Nc3cc(OC)cc(OC)c3)C2)nc1	ZINC000450593230	GG	On-Demand	Anodyne	MCHR1	15	42
CCOC(=O)c1ccc(CN2CCC[C@H](Nc3cc(OC)cc(OC)c3)C2)nc1	ZINC000450593232	GG	On-Demand	Anodyne	P2RY12	43	45
CCOC(=O)c1ccc(CN2CCC[C@H](Nc3cc(OC)cc(OC)c3)C2)nc1	ZINC000450593232	GG	On-Demand	Anodyne	SSTR5	45	39
CCOC(=O)c1ccc(CN2CCC[C@H](Nc3cc(OC)cc(OC)c3)C2)nc1	ZINC000450593232	GG	On-Demand	Anodyne	MCHR1	15	42
Cc1ccc(F)c(CC(=O)NCCOC(C)C)c1	ZINC000450593236	CE	On-Demand	Anodyne	P2RX7	30	41
COc1nccc(CNc2cc(N3CCCC3)ncn2)n1	ZINC000450593259	CD	On-Demand	Anodyne	GALR2	43	33
COc1ccc(C(=O)NCCC2CCC(OC)CC2)cc1S(C)(=O)=O	ZINC000450593270	FE	On-Demand	Anodyne	CPT1A	46	33
C[C@@H](O)CCN1CC=C(c2ccccc2C(F)(F)F)CC1	ZINC000450593293	CH	On-Demand	Anodyne	HSD11B1	17	44
C[C@H](O)CCN1CC=C(c2ccccc2C(F)(F)F)CC1	ZINC000450593294	CH	On-Demand	Anodyne	HSD11B1	17	44
COC(=O)CCN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@H]1C	ZINC000450593309	FF	On-Demand	Anodyne	SLC6A3	18	45
COC(=O)CCN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@H]1C	ZINC000450593309	FF	On-Demand	Anodyne	NPBWR1	46	32
COC(=O)CCN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@H]1C	ZINC000450593310	FF	On-Demand	Anodyne	SLC6A3	18	45
COC(=O)CCN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@H]1C	ZINC000450593310	FF	On-Demand	Anodyne	NPBWR1	46	32
COC(=O)CCN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@@H]1C	ZINC000450593311	FF	On-Demand	Anodyne	SLC6A3	18	45
COC(=O)CCN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C[C@@H]1C	ZINC000450593311	FF	On-Demand	Anodyne	NPBWR1	46	32
COC(=O)CCN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@@H]1C	ZINC000450593312	FF	On-Demand	Anodyne	SLC6A3	18	45
COC(=O)CCN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C[C@@H]1C	ZINC000450593312	FF	On-Demand	Anodyne	NPBWR1	46	32
CCOC(=O)[C@@](C)(O)CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450593323	EC	On-Demand	Anodyne	THYX_PBCV1	0	44
COC(=O)CCN1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C[C@@H]1C	ZINC000450593324	GD	On-Demand	Anodyne	HRH3	18	41
CCOC(=O)[C@](C)(O)CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450593325	EC	On-Demand	Anodyne	THYX_PBCV1	0	44
COC(=O)CCN1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C[C@H]1C	ZINC000450593326	GD	On-Demand	Anodyne	HRH3	18	41
Cc1cc(CNC(=O)c2c(C3CC3)noc2C)ccc1Cl	ZINC000450593347	DH	On-Demand	Anodyne	PFK	0	41
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450593358	FE	On-Demand	Anodyne	RBP4	68	38
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450593360	FE	On-Demand	Anodyne	RBP4	68	38
COC(=O)CCN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000450593366	GD	On-Demand	Bother	CACNA1C	53	34
COC(=O)CCN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000450593366	GD	On-Demand	Bother	CACNA1D	82	34
COC(=O)CCN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000450593368	GD	On-Demand	Bother	CACNA1C	53	34
COC(=O)CCN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000450593368	GD	On-Demand	Bother	CACNA1D	82	34
Cc1cc(CNC(=O)Cc2cn(C)nc2C)ccc1Cl	ZINC000450593371	CF	On-Demand	Anodyne	P2RX7	71	53
Cc1cc(CNC(=O)Cc2cn(C)nc2C)ccc1Cl	ZINC000450593371	CF	On-Demand	Anodyne	NCE103	22	40
Cc1cc(CNC(=O)Cc2cn(C)nc2C)ccc1Cl	ZINC000450593371	CF	On-Demand	Anodyne	CAN2	0	40
CCN1CCN(C(=O)c2cc(Br)c(C)cc2C)CC1=O	ZINC000450593378	EE	On-Demand	Anodyne	P2RX7	15	53
CC(C)(C)[C@H](CCO)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450593389	EG	On-Demand	Anodyne	ROCK2	26	40
CC(C)(C)[C@@H](CCO)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450593390	EG	On-Demand	Anodyne	ROCK2	26	40
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)C[C@@H]1C	ZINC000450593391	FD	On-Demand	Anodyne	DRD4	41	31
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)C[C@@H]1C	ZINC000450593391	FD	On-Demand	Anodyne	MTNR1A	20	41
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)C[C@@H]1C	ZINC000450593391	FD	On-Demand	Anodyne	MTNR1B	29	41
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)C[C@H]1C	ZINC000450593393	FD	On-Demand	Anodyne	DRD4	41	31
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)C[C@H]1C	ZINC000450593393	FD	On-Demand	Anodyne	MTNR1A	20	41
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)C[C@H]1C	ZINC000450593393	FD	On-Demand	Anodyne	MTNR1B	29	41
CC(C)[C@@H]1OCCC[C@H]1Nc1nccc(N[C@@H](CO)c2ccc(F)cc2)n1	ZINC000450593399	FF	On-Demand	Anodyne	MAPK1	42	34
CC(C)[C@@H]1OCCC[C@H]1Nc1nccc(N[C@H](CO)c2ccc(F)cc2)n1	ZINC000450593401	FF	On-Demand	Anodyne	MAPK1	42	34
CC(C)[C@@H]1OCCC[C@@H]1Nc1nccc(N[C@@H](CO)c2ccc(F)cc2)n1	ZINC000450593404	FF	On-Demand	Anodyne	MAPK1	42	34
CC(C)[C@@H]1OCCC[C@@H]1Nc1nccc(N[C@H](CO)c2ccc(F)cc2)n1	ZINC000450593406	FF	On-Demand	Anodyne	MAPK1	42	34
COc1ccc2c(NC[C@H]3CCCN3CCCO)ncnc2c1F	ZINC000450593410	ED	On-Demand	Anodyne	PDE6A	42	34
COc1ccc2c(NC[C@H]3CCCN3CCCO)ncnc2c1F	ZINC000450593410	ED	On-Demand	Anodyne	AURKA	15	40
COc1ccc2c(NC[C@H]3CCCN3CCCO)ncnc2c1F	ZINC000450593410	ED	On-Demand	Anodyne	ACKR3	44	30
COc1ccc2c(NC[C@@H]3CCCN3CCCO)ncnc2c1F	ZINC000450593413	ED	On-Demand	Anodyne	PDE6A	42	34
COc1ccc2c(NC[C@@H]3CCCN3CCCO)ncnc2c1F	ZINC000450593413	ED	On-Demand	Anodyne	AURKA	15	40
COc1ccc2c(NC[C@@H]3CCCN3CCCO)ncnc2c1F	ZINC000450593413	ED	On-Demand	Anodyne	ACKR3	44	30
CCCN(CC(=O)OC(C)(C)C)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450593423	FE	On-Demand	Anodyne	DRD4	42	32
CCCN(CC(=O)OC(C)(C)C)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450593423	FE	On-Demand	Anodyne	ESRRA	19	40
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593430	DF	On-Demand	Anodyne	HRP1_PLAFA	40	30
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593430	DF	On-Demand	Anodyne	FGFR2	42	39
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593430	DF	On-Demand	Anodyne	FLT1	0	43
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593430	DF	On-Demand	Anodyne	HNMT	45	31
COC[C@@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593430	DF	On-Demand	Anodyne	PDGFRA	41	35
COC[C@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593431	DF	On-Demand	Anodyne	HRP1_PLAFA	40	30
COC[C@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593431	DF	On-Demand	Anodyne	FGFR2	42	39
COC[C@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593431	DF	On-Demand	Anodyne	FLT1	0	43
COC[C@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593431	DF	On-Demand	Anodyne	HNMT	45	31
COC[C@](C)(O)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000450593431	DF	On-Demand	Anodyne	PDGFRA	41	35
CCOC(=O)CNC(=O)C1CCN(CC2=CCCCC2)CC1	ZINC000450593433	DD	On-Demand	Anodyne	CACNA1G	30	40
COC[C@](C)(O)CCNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450593445	ED	On-Demand	Anodyne	PTR1	47	35
COC[C@](C)(O)CCNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450593445	ED	On-Demand	Anodyne	L3MBTL3	50	33
COC[C@@](C)(O)CCNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450593447	ED	On-Demand	Anodyne	PTR1	47	35
COC[C@@](C)(O)CCNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450593447	ED	On-Demand	Anodyne	L3MBTL3	50	33
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593464	DD	On-Demand	Anodyne	CTSG	26	40
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593464	DD	On-Demand	Anodyne	CTRB1	33	40
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593464	DD	On-Demand	Anodyne	AMY2	52	31
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593464	DD	On-Demand	Anodyne	CELA2A	26	40
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593464	DD	On-Demand	Anodyne	CAPN2	56	33
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593464	DD	On-Demand	Anodyne	NPR	52	34
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593465	DD	On-Demand	Anodyne	CTSG	26	40
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593465	DD	On-Demand	Anodyne	CTRB1	33	40
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593465	DD	On-Demand	Anodyne	AMY2	52	31
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593465	DD	On-Demand	Anodyne	CELA2A	26	40
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593465	DD	On-Demand	Anodyne	CAPN2	56	33
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450593465	DD	On-Demand	Anodyne	NPR	52	34
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593466	DD	On-Demand	Anodyne	CTSG	26	40
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593466	DD	On-Demand	Anodyne	CTRB1	33	40
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593466	DD	On-Demand	Anodyne	AMY2	52	31
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593466	DD	On-Demand	Anodyne	CELA2A	26	40
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593466	DD	On-Demand	Anodyne	CAPN2	56	33
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593466	DD	On-Demand	Anodyne	NPR	52	34
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593467	DD	On-Demand	Anodyne	CTSG	26	40
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593467	DD	On-Demand	Anodyne	CTRB1	33	40
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593467	DD	On-Demand	Anodyne	AMY2	52	31
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593467	DD	On-Demand	Anodyne	CELA2A	26	40
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593467	DD	On-Demand	Anodyne	CAPN2	56	33
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450593467	DD	On-Demand	Anodyne	NPR	52	34
COc1cccc(OCCC(=O)NCCc2sccc2C)c1	ZINC000450593478	DG	On-Demand	Anodyne	MTNR1A	84	41
COc1cccc(OCCC(=O)NCCc2sccc2C)c1	ZINC000450593478	DG	On-Demand	Anodyne	MTNR1B	66	41
COc1cc(CN2CCN(c3nc(C)cc(C)n3)CC2)ccc1Cl	ZINC000450593479	EG	On-Demand	Anodyne	DRD2	26	46
COc1cc(CN2CCN(c3nc(C)cc(C)n3)CC2)ccc1Cl	ZINC000450593479	EG	On-Demand	Anodyne	DRD1	28	46
COc1cc(CN2CCN(c3nc(C)cc(C)n3)CC2)ccc1Cl	ZINC000450593479	EG	On-Demand	Anodyne	DRD4	47	45
COc1cc(CN2CCN(c3nc(C)cc(C)n3)CC2)ccc1Cl	ZINC000450593479	EG	On-Demand	Anodyne	DRD3	31	44
COc1cc(CN2CCN(c3nc(C)cc(C)n3)CC2)ccc1Cl	ZINC000450593479	EG	On-Demand	Anodyne	SSTR5	52	39
CC(=O)c1ccc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)cc1	ZINC000450593505	FJ	On-Demand	Anodyne	CCR3	45	34
CC(=O)c1ccc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)cc1	ZINC000450593507	FJ	On-Demand	Anodyne	CCR3	45	34
COC[C@@](C)(O)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450593513	DE	On-Demand	Anodyne	UTS2R	37	50
COC[C@](C)(O)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450593514	DE	On-Demand	Anodyne	UTS2R	37	50
CC(=O)c1ccc(CN(C)c2ccccc2N(C)C)cc1	ZINC000450593525	CH	On-Demand	Anodyne	LIMK2	40	36
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@@H]1CCCN1CCCO	ZINC000450593541	EF	On-Demand	Mild	MAP3K8	38	43
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@H]1CCCN1CCCO	ZINC000450593542	EF	On-Demand	Mild	MAP3K8	38	43
OCCCN1CCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593548	DG	On-Demand	Anodyne	ANPEP	0	40
OCCCN1CCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593548	DG	On-Demand	Anodyne	HRP1_PLAFA	128	46
OCCCN1CCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593548	DG	On-Demand	Anodyne	HNMT	89	56
OCCCN1CCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593548	DG	On-Demand	Anodyne	BOTA	39	47
OCCCN1CCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593548	DG	On-Demand	Anodyne	RBP_CHICK	0	40
OCCCN1CCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593549	DG	On-Demand	Anodyne	ANPEP	0	40
OCCCN1CCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593549	DG	On-Demand	Anodyne	HRP1_PLAFA	128	46
OCCCN1CCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593549	DG	On-Demand	Anodyne	HNMT	89	56
OCCCN1CCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593549	DG	On-Demand	Anodyne	BOTA	39	47
OCCCN1CCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450593549	DG	On-Demand	Anodyne	RBP_CHICK	0	40
CN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C1CC(O)C1	ZINC000450593551	ED	On-Demand	Mild	NR3C2	17	41
CN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C1CC(O)C1	ZINC000450593551	ED	On-Demand	Mild	AR	16	51
CN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C1CC(O)C1	ZINC000450593552	ED	On-Demand	Mild	NR3C2	17	41
CN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C1CC(O)C1	ZINC000450593552	ED	On-Demand	Mild	AR	16	51
CCO[C@@H]1COCC[C@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450593558	ED	On-Demand	Anodyne	PDEC	0	40
CCO[C@@H]1COCC[C@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450593559	ED	On-Demand	Anodyne	PDEC	0	40
CCO[C@@H]1COCC[C@@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450593560	ED	On-Demand	Anodyne	PDEC	0	40
CCO[C@@H]1COCC[C@@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450593561	ED	On-Demand	Anodyne	PDEC	0	40
Cc1nc(S[C@H](C)C(=O)Nc2nccs2)c2c(C)c(C)sc2n1	ZINC000450593562	FI	On-Demand	Anodyne	MAP1	72	37
Cc1nc(S[C@@H](C)C(=O)Nc2nccs2)c2c(C)c(C)sc2n1	ZINC000450593563	FI	On-Demand	Anodyne	MAP1	72	37
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CC(F)(F)F)n1	ZINC000450593584	GD	On-Demand	Anodyne	SLC6A1	69	38
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CC(F)(F)F)n1	ZINC000450593584	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CC(F)(F)F)n1	ZINC000450593585	GD	On-Demand	Anodyne	SLC6A1	69	38
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CC(F)(F)F)n1	ZINC000450593585	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CC(F)(F)F)n1	ZINC000450593586	GD	On-Demand	Anodyne	SLC6A1	69	38
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CC(F)(F)F)n1	ZINC000450593586	GD	On-Demand	Anodyne	SLC6A3	38	41
CCCN1C(=O)CCc2cc(NC(=O)c3c(C)cccc3Cl)ccc21	ZINC000450593587	FJ	On-Demand	Anodyne	TYK2	41	34
O=C(C[C@@H]1CC[C@H]2C[C@H]12)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450593594	GI	On-Demand	Anodyne	PRSS2	43	29
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450593595	GI	On-Demand	Anodyne	PRSS2	43	29
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450593596	GI	On-Demand	Anodyne	PRSS2	43	29
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450593597	GI	On-Demand	Anodyne	PRSS2	43	29
CCN1C(=O)CCc2cc(NC(=O)C[C@@H]3CC[C@@H]4C[C@@H]34)ccc21	ZINC000450593607	DG	On-Demand	Anodyne	NAMPT	16	41
CCN1C(=O)CCc2cc(NC(=O)C[C@@H]3CC[C@H]4C[C@@H]34)ccc21	ZINC000450593608	DG	On-Demand	Anodyne	NAMPT	16	41
CCN1C(=O)CCc2cc(NC(=O)C[C@@H]3CC[C@@H]4C[C@H]34)ccc21	ZINC000450593609	DG	On-Demand	Anodyne	NAMPT	16	41
CCN1C(=O)CCc2cc(NC(=O)C[C@@H]3CC[C@H]4C[C@H]34)ccc21	ZINC000450593610	DG	On-Demand	Anodyne	NAMPT	16	41
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@H](F)C1	ZINC000450593611	CG	On-Demand	Mild	LIPC	0	40
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@H](F)C1	ZINC000450593611	CG	On-Demand	Mild	LIPG	63	43
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H](F)C1	ZINC000450593612	CG	On-Demand	Mild	LIPC	0	40
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H](F)C1	ZINC000450593612	CG	On-Demand	Mild	LIPG	63	43
Cn1cc(NC(=O)CCCC(=O)C(C)(C)C)c(-c2ccccc2)n1	ZINC000450593628	EH	On-Demand	Anodyne	HDAC1	17	40
Cn1cc(NC(=O)CCCC(=O)C(C)(C)C)c(-c2ccccc2)n1	ZINC000450593628	EH	On-Demand	Anodyne	ACAT	0	40
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)nc1	ZINC000450593629	GD	On-Demand	Anodyne	SLC6A1	70	37
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)nc1	ZINC000450593629	GD	On-Demand	Anodyne	SLC6A3	40	40
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)nc1	ZINC000450593629	GD	On-Demand	Anodyne	PTR1	47	35
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)nc1	ZINC000450593630	GD	On-Demand	Anodyne	SLC6A1	70	37
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)nc1	ZINC000450593630	GD	On-Demand	Anodyne	SLC6A3	40	40
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)nc1	ZINC000450593630	GD	On-Demand	Anodyne	PTR1	47	35
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)nc1	ZINC000450593631	GD	On-Demand	Anodyne	SLC6A1	70	37
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)nc1	ZINC000450593631	GD	On-Demand	Anodyne	SLC6A3	40	40
CCOC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)nc1	ZINC000450593631	GD	On-Demand	Anodyne	PTR1	47	35
CCS(=O)(=O)c1ccc(CN(CCO)C2CCCCC2)cc1	ZINC000450593632	EF	On-Demand	Anodyne	RORC	17	45
COC(=O)[C@@H](NCCCNc1nc(-c2cccnc2)nc(C)c1C)C(C)C	ZINC000450593633	FE	On-Demand	Anodyne	ROS1	40	34
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Oc3ccccc3OC)cn2)[C@]12CCCO2	ZINC000450593635	GG	On-Demand	Anodyne	HCN1	49	30
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Oc3ccccc3OC)cn2)[C@]12CCCO2	ZINC000450593635	GG	On-Demand	Anodyne	HCN4	47	30
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Oc3ccccc3OC)cn2)[C@@]12CCCO2	ZINC000450593636	GG	On-Demand	Anodyne	HCN1	49	30
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Oc3ccccc3OC)cn2)[C@@]12CCCO2	ZINC000450593636	GG	On-Demand	Anodyne	HCN4	47	30
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Oc3ccccc3OC)cn2)[C@]12CCCO2	ZINC000450593637	GG	On-Demand	Anodyne	HCN1	49	30
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Oc3ccccc3OC)cn2)[C@]12CCCO2	ZINC000450593637	GG	On-Demand	Anodyne	HCN4	47	30
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Oc3ccccc3OC)cn2)[C@@]12CCCO2	ZINC000450593638	GG	On-Demand	Anodyne	HCN1	49	30
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Oc3ccccc3OC)cn2)[C@@]12CCCO2	ZINC000450593638	GG	On-Demand	Anodyne	HCN4	47	30
Cc1nccc(N2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450593653	FG	On-Demand	Anodyne	ERBB2	0	43
Cc1nccc(N2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450593653	FG	On-Demand	Anodyne	SSTR3	56	35
Cc1nccc(N2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450593653	FG	On-Demand	Anodyne	SORD	68	37
Cc1nccc(N2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450593653	FG	On-Demand	Anodyne	NPBWR1	70	35
COC(=O)C1(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1	ZINC000450593656	DF	On-Demand	Bother	COLA	106	41
COC(=O)C1(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1	ZINC000450593656	DF	On-Demand	Bother	PQSD	0	42
CC[C@H](CSC)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450593659	DG	On-Demand	Anodyne	MTNR1A	29	46
CC[C@H](CSC)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450593659	DG	On-Demand	Anodyne	PDS	66	36
CC[C@@H](CSC)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450593660	DG	On-Demand	Anodyne	MTNR1A	29	46
CC[C@@H](CSC)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450593660	DG	On-Demand	Anodyne	PDS	66	36
Cc1nccc(N2CCN(C(=O)CCCC(=O)C3CC3)CC2)n1	ZINC000450593680	DD	On-Demand	Anodyne	SORD	71	37
CC1(C(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)CCC(=O)CC1	ZINC000450593681	FJ	On-Demand	Anodyne	TRPM8	51	37
COC[C@@](C)(O)CCNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450593684	FE	On-Demand	Anodyne	NPBWR1	53	43
COC[C@](C)(O)CCNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450593685	FE	On-Demand	Anodyne	NPBWR1	53	43
CCOC(=O)[C@@](C)(O)CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450593686	GE	On-Demand	Anodyne	PYGL	50	38
CCOC(=O)[C@](C)(O)CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450593687	GE	On-Demand	Anodyne	PYGL	50	38
CCO[C@@H]1COCC[C@H]1NC(=O)c1ccnc(OC(F)F)c1	ZINC000450593697	DD	On-Demand	Anodyne	CCR2	15	43
CCO[C@H]1COCC[C@H]1NC(=O)c1ccnc(OC(F)F)c1	ZINC000450593698	DD	On-Demand	Anodyne	CCR2	15	43
CCO[C@H]1COCC[C@@H]1NC(=O)c1ccnc(OC(F)F)c1	ZINC000450593699	DD	On-Demand	Anodyne	CCR2	15	43
CCO[C@@H]1COCC[C@@H]1NC(=O)c1ccnc(OC(F)F)c1	ZINC000450593700	DD	On-Demand	Anodyne	CCR2	15	43
COC[C@](C)(O)CCNc1ncccc1OCc1ccccc1	ZINC000450593703	DF	On-Demand	Anodyne	PPIA	41	48
COC[C@@](C)(O)CCNc1ncccc1OCc1ccccc1	ZINC000450593704	DF	On-Demand	Anodyne	PPIA	41	48
COC[C@@](C)(O)CCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450593711	ED	On-Demand	Bother	TAAR1	17	45
COC[C@](C)(O)CCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450593712	ED	On-Demand	Bother	TAAR1	17	45
CCOC(=O)[C@@](C)(O)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450593713	FC	On-Demand	Bother	CACNA1C	52	36
CCOC(=O)[C@@](C)(O)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450593713	FC	On-Demand	Bother	IRAK4	23	42
CCOC(=O)[C@](C)(O)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450593714	FC	On-Demand	Bother	CACNA1C	52	36
CCOC(=O)[C@](C)(O)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450593714	FC	On-Demand	Bother	IRAK4	23	42
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450593737	FG	On-Demand	Bother	MTOR	65	42
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450593737	FG	On-Demand	Bother	TAAR1	32	46
O=C1C(=O)N(C2CCCC2)C(=O)N1CC/C=C\c1ccccc1	ZINC000450593762	DF	On-Demand	Anodyne	CACNA1C	0	43
O=C1C(=O)N(C2CCCC2)C(=O)N1CC/C=C\c1ccccc1	ZINC000450593762	DF	On-Demand	Anodyne	CACNA1D	27	43
O=C1C(=O)N(C2CCCC2)C(=O)N1CC/C=C/c1ccccc1	ZINC000450593766	DF	On-Demand	Anodyne	CACNA1C	0	43
O=C1C(=O)N(C2CCCC2)C(=O)N1CC/C=C/c1ccccc1	ZINC000450593766	DF	On-Demand	Anodyne	CACNA1D	27	43
CC(C)C[C@@H](CN1CCCC1)Nc1ncnc2c1ncn2C1CC1	ZINC000450593771	EG	On-Demand	Anodyne	ADORA1	27	41
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1ccc(F)cc1OCC(F)F	ZINC000450593778	GH	On-Demand	Anodyne	PDE4D	15	41
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1ccc(F)cc1OCC(F)F	ZINC000450593778	GH	On-Demand	Anodyne	PDEC	0	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1ccc(F)cc1OCC(F)F	ZINC000450593779	GH	On-Demand	Anodyne	PDE4D	15	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1ccc(F)cc1OCC(F)F	ZINC000450593779	GH	On-Demand	Anodyne	PDEC	0	41
COc1cc(CN2CCC[C@H](c3nncn3C3CC3)C2)ccc1Cl	ZINC000450593786	EH	On-Demand	Anodyne	DRD4	15	43
COc1cc(CN2CCC[C@H](c3nncn3C3CC3)C2)ccc1Cl	ZINC000450593786	EH	On-Demand	Anodyne	SSTR5	43	37
COc1cc(CN2CCC[C@@H](c3nncn3C3CC3)C2)ccc1Cl	ZINC000450593788	EH	On-Demand	Anodyne	DRD4	15	43
COc1cc(CN2CCC[C@@H](c3nncn3C3CC3)C2)ccc1Cl	ZINC000450593788	EH	On-Demand	Anodyne	SSTR5	43	37
CCn1c(Cc2ccccc2)nnc1SCc1cccc(C(C)=O)c1	ZINC000450593791	FI	On-Demand	Anodyne	AGTR1	16	47
CCn1c(Cc2ccccc2)nnc1SCc1cccc(C(C)=O)c1	ZINC000450593791	FI	On-Demand	Anodyne	SLC27A1	51	43
CN(C(=O)c1csc(Nc2cc(F)cc(F)c2)n1)C1CC(O)C1	ZINC000450593794	EE	On-Demand	Anodyne	TRPC6	70	40
CN(C(=O)c1csc(Nc2cc(F)cc(F)c2)n1)C1CC(O)C1	ZINC000450593794	EE	On-Demand	Anodyne	TRPC3	54	40
CCN1CCN(C(=O)c2ccccc2-n2cc(Br)cn2)CC1=O	ZINC000450593808	GD	On-Demand	Anodyne	P2RX7	26	53
CCN1CCN(C(=O)c2ccsc2Br)CC1=O	ZINC000450593846	DD	On-Demand	Anodyne	P2RX7	0	57
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450593869	EI	On-Demand	Anodyne	SDH1	0	40
O=[N+]([O-])c1cnc(NC(CF)CF)s1	ZINC000450593870	BD	On-Demand	Bother	MAPK9	15	43
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450593873	EI	On-Demand	Anodyne	SDH1	0	40
CCO[C@@H]1COCC[C@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450593883	EF	On-Demand	Anodyne	ADAM17	27	44
CCO[C@@H]1COCC[C@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450593883	EF	On-Demand	Anodyne	MMP12	0	43
CCO[C@@H]1COCC[C@@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450593886	EF	On-Demand	Anodyne	ADAM17	27	44
CCO[C@@H]1COCC[C@@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450593886	EF	On-Demand	Anodyne	MMP12	0	43
CCO[C@H]1COCC[C@@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450593888	EF	On-Demand	Anodyne	ADAM17	27	44
CCO[C@H]1COCC[C@@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450593888	EF	On-Demand	Anodyne	MMP12	0	43
CCO[C@H]1COCC[C@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450593891	EF	On-Demand	Anodyne	ADAM17	27	44
CCO[C@H]1COCC[C@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450593891	EF	On-Demand	Anodyne	MMP12	0	43
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCCN1CCCO	ZINC000450593897	FC	On-Demand	Anodyne	CASP3	23	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCCN1CCCO	ZINC000450593897	FC	On-Demand	Anodyne	CA7	27	56
COCCOC[C@H](O)CN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450593902	GC	On-Demand	Anodyne	ADRB2	24	45
COCCOC[C@H](O)CN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450593902	GC	On-Demand	Anodyne	ADRB3	34	45
COCCOC[C@@H](O)CN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450593905	GC	On-Demand	Anodyne	ADRB2	24	45
COCCOC[C@@H](O)CN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450593905	GC	On-Demand	Anodyne	ADRB3	34	45
COCCOC[C@H](O)CN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450593907	GC	On-Demand	Anodyne	ADRB2	24	45
COCCOC[C@H](O)CN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450593907	GC	On-Demand	Anodyne	ADRB3	34	45
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCCN1CCCO	ZINC000450593908	FC	On-Demand	Anodyne	CASP3	23	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCCN1CCCO	ZINC000450593908	FC	On-Demand	Anodyne	CA7	27	56
COCCOC[C@@H](O)CN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450593909	GC	On-Demand	Anodyne	ADRB2	24	45
COCCOC[C@@H](O)CN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450593909	GC	On-Demand	Anodyne	ADRB3	34	45
CCc1cnccc1[C@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450593920	EG	On-Demand	Anodyne	MTNR1A	40	42
CCc1cnccc1[C@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450593920	EG	On-Demand	Anodyne	MTNR1B	37	42
COCCOC[C@H](O)CN1CCN(C(=O)COc2cc(C)cc(C)c2)CC1	ZINC000450593921	GC	On-Demand	Anodyne	ACOX1	65	33
COCCOC[C@H](O)CN1CCN(C(=O)COc2cc(C)cc(C)c2)CC1	ZINC000450593921	GC	On-Demand	Anodyne	ABCB1	46	36
COCCOC[C@H](O)CN1CCN(C(=O)COc2cc(C)cc(C)c2)CC1	ZINC000450593921	GC	On-Demand	Anodyne	HSP90AB1	39	41
CCc1cnccc1[C@@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450593923	EG	On-Demand	Anodyne	MTNR1A	40	42
CCc1cnccc1[C@@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450593923	EG	On-Demand	Anodyne	MTNR1B	37	42
Cc1ccc(NC(=O)c2ccc(NC[C@@H]3CCCN3CCCO)nc2)cc1	ZINC000450593926	FF	On-Demand	Anodyne	P4HTM	0	44
Cc1ccc(NC(=O)c2ccc(NC[C@@H]3CCCN3CCCO)nc2)cc1	ZINC000450593926	FF	On-Demand	Anodyne	PFG6PD	0	40
Cc1ccc(NC(=O)c2ccc(NC[C@H]3CCCN3CCCO)nc2)cc1	ZINC000450593928	FF	On-Demand	Anodyne	P4HTM	0	44
Cc1ccc(NC(=O)c2ccc(NC[C@H]3CCCN3CCCO)nc2)cc1	ZINC000450593928	FF	On-Demand	Anodyne	PFG6PD	0	40
Cc1cc(CNC(=O)c2cnc(C3CC3)nc2)ccc1Cl	ZINC000450593929	DG	On-Demand	Anodyne	CXCR3	23	43
COc1cc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])cc1F	ZINC000450593930	EE	On-Demand	Bother	ACKR3	45	31
COc1cc(NC[C@@H]2CCCN2CCCO)c([N+](=O)[O-])cc1F	ZINC000450593932	EE	On-Demand	Bother	ACKR3	45	31
COCCOC[C@@H](O)CN1CCN(C(=O)COc2cc(C)cc(C)c2)CC1	ZINC000450593945	GC	On-Demand	Anodyne	ACOX1	65	33
COCCOC[C@@H](O)CN1CCN(C(=O)COc2cc(C)cc(C)c2)CC1	ZINC000450593945	GC	On-Demand	Anodyne	ABCB1	46	36
COCCOC[C@@H](O)CN1CCN(C(=O)COc2cc(C)cc(C)c2)CC1	ZINC000450593945	GC	On-Demand	Anodyne	HSP90AB1	39	41
CCSc1cccnc1C(=O)NCCC1CCC(OC)CC1	ZINC000450593947	DH	On-Demand	Anodyne	SIRT3	41	32
CCSc1cccnc1C(=O)NCCC1CCC(OC)CC1	ZINC000450593947	DH	On-Demand	Anodyne	SIRT1	41	32
Cc1cc(CNC(=O)C2CC(C)(O)C2)ccc1Cl	ZINC000450593948	CE	On-Demand	Anodyne	EPHX2	17	47
CC[C@H](COCC(F)(F)F)Nc1cc(-c2ccccc2)nc2ncnn12	ZINC000450593950	FH	On-Demand	Anodyne	DHOD	0	40
CC[C@@H](COCC(F)(F)F)Nc1cc(-c2ccccc2)nc2ncnn12	ZINC000450593951	FH	On-Demand	Anodyne	DHOD	0	40
CCn1c(Cc2ccccc2)nnc1SCc1oc(C(C)C)nc1C	ZINC000450593959	FJ	On-Demand	Anodyne	SLC27A1	44	38
CCn1nnc(C)c1Cn1c(=O)oc2ccccc21	ZINC000450593963	CD	On-Demand	Anodyne	MIF	17	42
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1ccc(C)nc1C(C)C	ZINC000450593972	FD	On-Demand	Anodyne	FOLH1	50	38
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1ccc(C)nc1C(C)C	ZINC000450593972	FD	On-Demand	Anodyne	F2RL1	50	34
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N(C)CC2(O)CCC2)cc1	ZINC000450593989	GE	On-Demand	Anodyne	MMP2	19	46
Cc1ccccc1CCN(C)c1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450594010	FF	On-Demand	Anodyne	CHRM5	15	40
Cc1ccccc1CCN(C)c1ncnc2[nH]ccc12	ZINC000450594020	CF	On-Demand	Anodyne	JAK3	20	46
COCCOC[C@H](O)CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450594025	DD	On-Demand	Anodyne	CYP2D6	23	40
COCCOC[C@H](O)CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450594025	DD	On-Demand	Anodyne	ABCB1	54	39
COCCOC[C@H](O)CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450594025	DD	On-Demand	Anodyne	HSP90AB1	40	42
COCCOC[C@H](O)CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450594025	DD	On-Demand	Anodyne	BIRC2	35	40
COCCOC[C@H](O)CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450594026	DD	On-Demand	Anodyne	CYP2D6	23	40
COCCOC[C@H](O)CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450594026	DD	On-Demand	Anodyne	ABCB1	54	39
COCCOC[C@H](O)CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450594026	DD	On-Demand	Anodyne	HSP90AB1	40	42
COCCOC[C@H](O)CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450594026	DD	On-Demand	Anodyne	BIRC2	35	40
COCCOC[C@@H](O)CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450594027	DD	On-Demand	Anodyne	CYP2D6	23	40
COCCOC[C@@H](O)CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450594027	DD	On-Demand	Anodyne	ABCB1	54	39
COCCOC[C@@H](O)CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450594027	DD	On-Demand	Anodyne	HSP90AB1	40	42
COCCOC[C@@H](O)CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450594027	DD	On-Demand	Anodyne	BIRC2	35	40
COCCOC[C@@H](O)CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450594028	DD	On-Demand	Anodyne	CYP2D6	23	40
COCCOC[C@@H](O)CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450594028	DD	On-Demand	Anodyne	ABCB1	54	39
COCCOC[C@@H](O)CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450594028	DD	On-Demand	Anodyne	HSP90AB1	40	42
COCCOC[C@@H](O)CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450594028	DD	On-Demand	Anodyne	BIRC2	35	40
COC1CCC(CCNC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450594032	FJ	On-Demand	Anodyne	SLC6A1	41	43
COC1CCC(CCNC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450594032	FJ	On-Demand	Anodyne	SLC6A3	20	44
CC(C)OCCNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450594033	CD	On-Demand	Anodyne	MMP13	17	42
CC(C)OCCNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450594033	CD	On-Demand	Anodyne	SCN10A	19	42
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H]2CCCCC2(F)F)C1	ZINC000450594055	DH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H]2CCCCC2(F)F)C1	ZINC000450594055	DH	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2CCCCC2(F)F)C1	ZINC000450594056	DH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2CCCCC2(F)F)C1	ZINC000450594056	DH	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CCCCC2(F)F)C1	ZINC000450594057	DH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CCCCC2(F)F)C1	ZINC000450594057	DH	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@H]2CCCCC2(F)F)C1	ZINC000450594058	DH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@H]2CCCCC2(F)F)C1	ZINC000450594058	DH	On-Demand	Anodyne	CRTY	0	40
COC(=O)CNC(=O)c1ccc(NCc2ccnc(OC)n2)c([N+](=O)[O-])c1	ZINC000450594062	GC	On-Demand	Bother	TAAR1	20	46
Cc1nn(C)cc1CSc1nc2cc(Br)cnc2[nH]1	ZINC000450594070	EG	On-Demand	Anodyne	ENPP1	24	44
CN1CCN(CC2(C)CCN(C(=O)c3cccc4c3CCCC4)CC2)CC1	ZINC000450594075	FG	On-Demand	Anodyne	FABP4	46	38
CCC[C@@H](NC(=O)c1ccc(Br)cc1C#N)C(=O)OC	ZINC000450594087	EE	On-Demand	Mild	CTRB_BOVIN	48	34
CCC[C@H](NC(=O)c1ccc(Br)cc1C#N)C(=O)OC	ZINC000450594088	EE	On-Demand	Mild	CTRB_BOVIN	48	34
COc1ccc(CNC(=O)CCN2CCN(c3nccn3C)CC2)c(OC)c1	ZINC000450594090	GD	On-Demand	Anodyne	HTR1A	55	45
COc1ccc(CNC(=O)CCN2CCN(c3nccn3C)CC2)c(OC)c1	ZINC000450594090	GD	On-Demand	Anodyne	DRD2	41	44
COc1ccc(CNC(=O)CCN2CCN(c3nccn3C)CC2)c(OC)c1	ZINC000450594090	GD	On-Demand	Anodyne	DRD4	46	35
COc1ccc(CNC(=O)CCN2CCN(c3nccn3C)CC2)c(OC)c1	ZINC000450594090	GD	On-Demand	Anodyne	HTR2A	18	45
COc1ccc(CNC(=O)CCN2CCN(c3nccn3C)CC2)c(OC)c1	ZINC000450594090	GD	On-Demand	Anodyne	DRD3	58	38
COc1ccc(CNC(=O)CCN2CCN(c3nccn3C)CC2)c(OC)c1	ZINC000450594090	GD	On-Demand	Anodyne	PDGFRB	56	41
COc1ccc(CNC(=O)CCN2CCN(c3nccn3C)CC2)c(OC)c1	ZINC000450594090	GD	On-Demand	Anodyne	HTR7	61	48
COc1ccc(CNC(=O)CCN2CCN(c3nccn3C)CC2)c(OC)c1	ZINC000450594090	GD	On-Demand	Anodyne	CSF1R	15	41
N#Cc1cnc2c(F)ccc(Cl)c2c1N1CC[C@@H](F)C1	ZINC000450594093	CG	On-Demand	Mild	MAP3K8	43	33
N#Cc1cnc2c(F)ccc(Cl)c2c1N1CC[C@H](F)C1	ZINC000450594094	CG	On-Demand	Mild	MAP3K8	43	33
CCCOc1ccc(C(=O)Nc2ccc(F)cc2NS(C)(=O)=O)c(OC)c1	ZINC000450594095	GG	On-Demand	Anodyne	KCNK3	46	35
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](C)S(C)(=O)=O	ZINC000450594100	EB	On-Demand	Anodyne	SLC6A1	66	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](C)S(C)(=O)=O	ZINC000450594101	EB	On-Demand	Anodyne	SLC6A1	66	39
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](C)S(C)(=O)=O	ZINC000450594102	EB	On-Demand	Anodyne	SLC6A1	66	39
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](C)S(C)(=O)=O	ZINC000450594103	EB	On-Demand	Anodyne	SLC6A1	66	39
COC(=O)[C@@H](NCCCNc1cc(C)nc(-c2cccnc2)n1)C(C)C	ZINC000450594105	FD	On-Demand	Anodyne	ROS1	63	43
C=CCC1(C(=O)N2CCN(c3ccnc(C)n3)CC2)CCCC1	ZINC000450594115	DF	On-Demand	Mild	SORD	69	38
Cc1nn(C)cc1CC(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450594116	GG	On-Demand	Anodyne	PRSS2	45	31
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	PRNP	32	46
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	HDAC1	34	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	GRM5	23	43
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	TYK2	58	36
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	RPS6KA3	19	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	MCHR1	20	48
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	TAAR1	43	49
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	DGAT1	40	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	KCNK3	63	42
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450594120	DH	On-Demand	Anodyne	KCNK9	23	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	PRNP	32	46
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	HDAC1	34	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	GRM5	23	43
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	TYK2	58	36
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	RPS6KA3	19	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	MCHR1	20	48
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	TAAR1	43	49
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	DGAT1	40	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	KCNK3	63	42
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450594121	DH	On-Demand	Anodyne	KCNK9	23	40
C[C@]1(c2ccccc2)C[C@@H]1C(=O)Nc1ccc(F)cc1NS(C)(=O)=O	ZINC000450594122	FG	On-Demand	Anodyne	TRPV1	15	44
COC(=O)[C@@H](O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450594132	DE	On-Demand	Anodyne	SIGMAR1	20	43
COC(=O)[C@H](O)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450594133	DE	On-Demand	Anodyne	SIGMAR1	20	43
CC(F)(F)C(C)(C)C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450594137	GJ	On-Demand	Anodyne	PRSS2	45	31
CC(F)(F)C(C)(C)C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450594137	GJ	On-Demand	Anodyne	EPHX2	23	41
CC(F)(F)C(C)(C)C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450594137	GJ	On-Demand	Anodyne	SCD1	18	42
COC(=O)c1ccc(N2CC[C@@H](F)C2)nn1	ZINC000450594138	BC	On-Demand	Anodyne	SCD	22	40
COC(=O)c1ccc(N2CC[C@H](F)C2)nn1	ZINC000450594139	BC	On-Demand	Anodyne	SCD	22	40
F[C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450594144	CF	On-Demand	Anodyne	GRM5	32	56
F[C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450594145	CF	On-Demand	Anodyne	GRM5	32	56
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3Cc4c(C)cccc4O3)ccc21	ZINC000450594166	FG	On-Demand	Anodyne	NAMPT	0	44
CCN1C(=O)CCc2cc(NC(=O)[C@H]3Cc4c(C)cccc4O3)ccc21	ZINC000450594167	FG	On-Demand	Anodyne	NAMPT	0	44
CC(C)(CS(C)(=O)=O)NC(=O)c1ccc(I)cc1F	ZINC000450594171	GD	On-Demand	Anodyne	H9CNL0_SPOEX	0	44
CC(C)c1nnc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)s1	ZINC000450594187	EH	On-Demand	Bother	COLA	121	38
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CC[C@@H](F)C1	ZINC000450594188	FF	On-Demand	Bother	CASP7	48	39
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CC[C@H](F)C1	ZINC000450594189	FF	On-Demand	Bother	CASP7	48	39
CC(F)(F)CCN1C(=O)C(=O)N(C2CCCC2)C1=O	ZINC000450594198	CD	On-Demand	Anodyne	CACNA1D	16	43
C[C@@H]1CCN(CCc2ccc(Cl)cc2)C[C@@H]1n1ccnc1	ZINC000450594202	DH	On-Demand	Anodyne	HMOX1	45	39
C[C@@H]1CCN(CCc2ccc(Cl)cc2)C[C@H]1n1ccnc1	ZINC000450594203	DH	On-Demand	Anodyne	HMOX1	45	39
C[C@H]1CCN(CCc2ccc(Cl)cc2)C[C@H]1n1ccnc1	ZINC000450594204	DH	On-Demand	Anodyne	HMOX1	45	39
C[C@H]1CCN(CCc2ccc(Cl)cc2)C[C@@H]1n1ccnc1	ZINC000450594205	DH	On-Demand	Anodyne	HMOX1	45	39
COc1cc(C#N)ccc1OCCCCCC(C)=O	ZINC000450594223	CG	On-Demand	Mild	PDEB1	0	42
CC[C@H](c1ccccc1)N(CC[C@H](C)O)CC(=O)OC	ZINC000450594233	CE	On-Demand	Anodyne	KCNA5	31	42
CC[C@@H](c1ccccc1)N(CC[C@@H](C)O)CC(=O)OC	ZINC000450594234	CE	On-Demand	Anodyne	KCNA5	31	42
CC[C@H](c1ccccc1)N(CC[C@@H](C)O)CC(=O)OC	ZINC000450594235	CE	On-Demand	Anodyne	KCNA5	31	42
CC[C@@H](c1ccccc1)N(CC[C@H](C)O)CC(=O)OC	ZINC000450594236	CE	On-Demand	Anodyne	KCNA5	31	42
COc1cc(CN2CC[C@H](C)[C@@H](n3ccnc3)C2)ccc1Cl	ZINC000450594254	DH	On-Demand	Anodyne	DRD4	19	41
COc1cc(CN2CC[C@H](C)[C@@H](n3ccnc3)C2)ccc1Cl	ZINC000450594254	DH	On-Demand	Anodyne	SSTR5	46	36
COc1cc(CN2CC[C@@H](C)[C@@H](n3ccnc3)C2)ccc1Cl	ZINC000450594255	DH	On-Demand	Anodyne	DRD4	19	41
COc1cc(CN2CC[C@@H](C)[C@@H](n3ccnc3)C2)ccc1Cl	ZINC000450594255	DH	On-Demand	Anodyne	SSTR5	46	36
COc1cc(CN2CC[C@@H](C)[C@H](n3ccnc3)C2)ccc1Cl	ZINC000450594256	DH	On-Demand	Anodyne	DRD4	19	41
COc1cc(CN2CC[C@@H](C)[C@H](n3ccnc3)C2)ccc1Cl	ZINC000450594256	DH	On-Demand	Anodyne	SSTR5	46	36
COc1cc(CN2CC[C@H](C)[C@H](n3ccnc3)C2)ccc1Cl	ZINC000450594257	DH	On-Demand	Anodyne	DRD4	19	41
COc1cc(CN2CC[C@H](C)[C@H](n3ccnc3)C2)ccc1Cl	ZINC000450594257	DH	On-Demand	Anodyne	SSTR5	46	36
CCOC(=O)[C@@](C)(O)CNC(=O)c1cccc2c1CCCC2	ZINC000450594258	DD	On-Demand	Anodyne	AVPR2	19	41
CCOC(=O)[C@](C)(O)CNC(=O)c1cccc2c1CCCC2	ZINC000450594259	DD	On-Demand	Anodyne	AVPR2	19	41
COc1cccc2c(NC[C@@H]3CCCN3CCCO)ccnc12	ZINC000450594278	DF	On-Demand	Anodyne	HNMT	49	35
COc1cccc2c(NC[C@H]3CCCN3CCCO)ccnc12	ZINC000450594279	DF	On-Demand	Anodyne	HNMT	49	35
CCCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450594280	CH	On-Demand	Anodyne	KCNQ1	0	40
CCCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450594280	CH	On-Demand	Anodyne	HTR7	17	48
CCCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450594280	CH	On-Demand	Anodyne	HRH3	45	57
CCCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450594280	CH	On-Demand	Anodyne	SIGMAR1	21	40
CCCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450594280	CH	On-Demand	Anodyne	HTR5A	30	45
CCCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450594280	CH	On-Demand	Anodyne	CHRNA6	0	41
CCCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450594280	CH	On-Demand	Anodyne	PLA2G4B	80	34
CCCOc1ccc2c(c1)CCN(CCCC(=O)CC)C2	ZINC000450594280	CH	On-Demand	Anodyne	ABCB1	19	47
CCn1c(S[C@@H](C)C(=O)Nc2nccs2)nnc1-c1cccc(Cl)c1	ZINC000450594281	GI	On-Demand	Anodyne	MAP	0	40
CCn1c(S[C@@H](C)C(=O)Nc2nccs2)nnc1-c1cccc(Cl)c1	ZINC000450594281	GI	On-Demand	Anodyne	MAP1	75	39
CCn1c(S[C@H](C)C(=O)Nc2nccs2)nnc1-c1cccc(Cl)c1	ZINC000450594282	GI	On-Demand	Anodyne	MAP	0	40
CCn1c(S[C@H](C)C(=O)Nc2nccs2)nnc1-c1cccc(Cl)c1	ZINC000450594282	GI	On-Demand	Anodyne	MAP1	75	39
CCn1c(Cc2ccccc2)nnc1SCc1nc(-c2cc(C)ccn2)no1	ZINC000450594291	GH	On-Demand	Anodyne	TNKS2	16	41
CCn1c(Cc2ccccc2)nnc1SCc1nc(-c2cc(C)ccn2)no1	ZINC000450594291	GH	On-Demand	Anodyne	SLC27A1	45	40
Cc1ccsc1CCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450594292	DF	On-Demand	Anodyne	HPGDS	20	43
COC(=O)[C@H](C)NC(=O)c1ccc(N2CCOC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450594293	FD	On-Demand	Bother	TAAR1	19	46
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCOC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450594294	FD	On-Demand	Bother	TAAR1	19	46
O=[N+]([O-])c1cc(Br)cnc1NC[C@H]1CCCN1CCCO	ZINC000450594307	FE	On-Demand	Bother	PRKCQ	44	35
O=[N+]([O-])c1cc(Br)cnc1NC[C@@H]1CCCN1CCCO	ZINC000450594308	FE	On-Demand	Bother	PRKCQ	44	35
O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1CCCN1CCCO	ZINC000450594319	DD	On-Demand	Bother	PRKCQ	45	38
O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1CCCN1CCCO	ZINC000450594320	DD	On-Demand	Bother	PRKCQ	45	38
CCc1cnccc1[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450594321	FG	On-Demand	Anodyne	F7	31	43
CCc1cnccc1[C@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450594322	FG	On-Demand	Anodyne	F7	31	43
COC(=O)CCN1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C[C@@H]1C	ZINC000450594353	GC	On-Demand	Anodyne	DRD4	41	32
COC(=O)CCN1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C[C@H]1C	ZINC000450594354	GC	On-Demand	Anodyne	DRD4	41	32
CC(C)NC(=O)c1ccc(N[C@@H](CO)c2ccc(F)cc2)c([N+](=O)[O-])c1	ZINC000450594372	FG	On-Demand	Bother	TAAR1	18	48
CC(C)NC(=O)c1ccc(N[C@H](CO)c2ccc(F)cc2)c([N+](=O)[O-])c1	ZINC000450594374	FG	On-Demand	Bother	TAAR1	18	48
C=CCC1(C(=O)N[C@@H](C)c2nnc(C)s2)CCCC1	ZINC000450594377	CG	On-Demand	Mild	MME	19	40
C=CCC1(C(=O)N[C@H](C)c2nnc(C)s2)CCCC1	ZINC000450594378	CG	On-Demand	Mild	MME	19	40
CCn1c(Cc2ccccc2)nnc1SCC[C@@H](C)O	ZINC000450594383	CF	On-Demand	Anodyne	SLC27A1	44	36
CCn1c(Cc2ccccc2)nnc1SCC[C@H](C)O	ZINC000450594384	CF	On-Demand	Anodyne	SLC27A1	44	36
CN1CCN(S(=O)(=O)c2ccc(N[C@@H](CO)c3ccc(F)cc3)nc2)CC1	ZINC000450594391	GD	On-Demand	Anodyne	GCK	50	32
CN1CCN(S(=O)(=O)c2ccc(N[C@@H](CO)c3ccc(F)cc3)nc2)CC1	ZINC000450594391	GD	On-Demand	Anodyne	GCKR	67	31
CN1CCN(S(=O)(=O)c2ccc(N[C@H](CO)c3ccc(F)cc3)nc2)CC1	ZINC000450594393	GD	On-Demand	Anodyne	GCK	50	32
CN1CCN(S(=O)(=O)c2ccc(N[C@H](CO)c3ccc(F)cc3)nc2)CC1	ZINC000450594393	GD	On-Demand	Anodyne	GCKR	67	31
COC(=O)CCN1CCN(C(=O)c2cn(CCc3ccccc3)nn2)C[C@@H]1C	ZINC000450594397	GD	On-Demand	Anodyne	THYX_PBCV1	0	41
COC(=O)CCN1CCN(C(=O)c2cn(CCc3ccccc3)nn2)C[C@H]1C	ZINC000450594398	GD	On-Demand	Anodyne	THYX_PBCV1	0	41
CCN1CCN(C(=O)c2ccc(C)c(Cl)c2Cl)CC1=O	ZINC000450594405	DF	On-Demand	Anodyne	P2RX7	29	71
COC(=O)CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450594438	FD	On-Demand	Anodyne	OPRK1	33	41
COC(=O)CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450594438	FD	On-Demand	Anodyne	CCR1	39	41
COC(=O)CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450594439	FD	On-Demand	Anodyne	OPRK1	33	41
COC(=O)CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450594439	FD	On-Demand	Anodyne	CCR1	39	41
COC1(CSc2nnc(COc3ccccc3Cl)n2C2CC2)CCC1	ZINC000450594445	GJ	On-Demand	Anodyne	VCP	46	34
Cc1csc2c(NC(CF)CF)ncnc12	ZINC000450594450	BF	On-Demand	Anodyne	LPAR2	24	49
CCN1CCN(C(=O)c2cc(Cl)c(F)cc2Br)CC1=O	ZINC000450594462	FF	On-Demand	Anodyne	P2RX7	27	58
COC(=O)CCN1CCN(C(=O)c2cc3c([nH]2)CCCC3)C[C@H]1C	ZINC000450594463	ED	On-Demand	Anodyne	HRH4	22	60
COC(=O)CCN1CCN(C(=O)c2cc3c([nH]2)CCCC3)C[C@@H]1C	ZINC000450594464	ED	On-Demand	Anodyne	HRH4	22	60
N#Cc1cc([N+](=O)[O-])ccc1NC(CF)CF	ZINC000450594481	BE	On-Demand	Mild	GRB7	0	40
Cc1cc(C)cc(OCC(=O)N2CCN(CCC[C@H](C)O)CC2)c1	ZINC000450594485	ED	On-Demand	Anodyne	GPR183	0	41
Cc1cc(C)cc(OCC(=O)N2CCN(CCC[C@@H](C)O)CC2)c1	ZINC000450594486	ED	On-Demand	Anodyne	GPR183	0	41
CCO[C@@H]1COCC[C@@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594535	GF	On-Demand	Anodyne	ADAM17	22	42
CCO[C@@H]1COCC[C@@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594535	GF	On-Demand	Anodyne	MMP12	0	42
CCO[C@@H]1COCC[C@@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594535	GF	On-Demand	Anodyne	MMP7	0	42
COC(=O)c1coc(CN2CCC[C@H](Nc3ccccc3)C2)n1	ZINC000450594536	DF	On-Demand	Anodyne	SLC6A1	43	33
COC(=O)c1coc(CN2CCC[C@H](Nc3ccccc3)C2)n1	ZINC000450594536	DF	On-Demand	Anodyne	BIRC2	43	36
COC(=O)c1coc(CN2CCC[C@@H](Nc3ccccc3)C2)n1	ZINC000450594537	DF	On-Demand	Anodyne	SLC6A1	43	33
COC(=O)c1coc(CN2CCC[C@@H](Nc3ccccc3)C2)n1	ZINC000450594537	DF	On-Demand	Anodyne	BIRC2	43	36
CCO[C@@H]1COCC[C@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594539	GF	On-Demand	Anodyne	ADAM17	22	42
CCO[C@@H]1COCC[C@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594539	GF	On-Demand	Anodyne	MMP12	0	42
CCO[C@@H]1COCC[C@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594539	GF	On-Demand	Anodyne	MMP7	0	42
CCO[C@H]1COCC[C@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594540	GF	On-Demand	Anodyne	ADAM17	22	42
CCO[C@H]1COCC[C@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594540	GF	On-Demand	Anodyne	MMP12	0	42
CCO[C@H]1COCC[C@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594540	GF	On-Demand	Anodyne	MMP7	0	42
CCO[C@H]1COCC[C@@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594541	GF	On-Demand	Anodyne	ADAM17	22	42
CCO[C@H]1COCC[C@@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594541	GF	On-Demand	Anodyne	MMP12	0	42
CCO[C@H]1COCC[C@@H]1NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450594541	GF	On-Demand	Anodyne	MMP7	0	42
CC1=C(C(=O)Nc2ccc(F)cc2NS(C)(=O)=O)CCC(C)(C)C1	ZINC000450594558	FH	On-Demand	Anodyne	PLA2G7	41	43
CCC(=O)c1ccc(NCc2ccnc(OC)n2)c([N+](=O)[O-])c1	ZINC000450594566	DF	On-Demand	Bother	TAAR1	17	45
CNS(=O)(=O)c1ccc(NCC[C@@](C)(O)COC)c([N+](=O)[O-])c1	ZINC000450594581	EC	On-Demand	Bother	BDKRB1	0	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C/c1ccccc1	ZINC000450594583	EF	On-Demand	Anodyne	SLC6A1	135	52
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C/c1ccccc1	ZINC000450594583	EF	On-Demand	Anodyne	SLC6A4	39	52
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C/c1ccccc1	ZINC000450594583	EF	On-Demand	Anodyne	SLC6A3	76	54
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C\c1ccccc1	ZINC000450594585	EF	On-Demand	Anodyne	SLC6A1	135	52
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C\c1ccccc1	ZINC000450594585	EF	On-Demand	Anodyne	SLC6A4	39	52
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C\c1ccccc1	ZINC000450594585	EF	On-Demand	Anodyne	SLC6A3	76	54
CC(C)OCCNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450594587	CH	On-Demand	Anodyne	AMY2	46	32
CNS(=O)(=O)c1ccc(NCC[C@](C)(O)COC)c([N+](=O)[O-])c1	ZINC000450594588	EC	On-Demand	Bother	BDKRB1	0	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C\c1ccccc1	ZINC000450594589	EF	On-Demand	Anodyne	SLC6A1	135	52
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C\c1ccccc1	ZINC000450594589	EF	On-Demand	Anodyne	SLC6A4	39	52
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C\c1ccccc1	ZINC000450594589	EF	On-Demand	Anodyne	SLC6A3	76	54
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C/c1ccccc1	ZINC000450594593	EF	On-Demand	Anodyne	SLC6A1	135	52
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C/c1ccccc1	ZINC000450594593	EF	On-Demand	Anodyne	SLC6A4	39	52
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC/C=C/c1ccccc1	ZINC000450594593	EF	On-Demand	Anodyne	SLC6A3	76	54
COCC1(C)CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450594595	DH	On-Demand	Anodyne	CHRM5	35	40
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	DRD2	31	43
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	DRD4	22	53
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	HTR2A	33	53
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	HTR2C	27	56
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	SLC6A1	63	35
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	ERG2	20	43
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	SLC18A3	15	46
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594612	EH	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	DRD2	31	43
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	DRD4	22	53
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	HTR2A	33	53
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	HTR2C	27	56
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	SLC6A1	63	35
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	ERG2	20	43
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	SLC18A3	15	46
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594616	EH	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	DRD2	31	43
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	DRD4	22	53
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	HTR2A	33	53
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	HTR2C	27	56
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	SLC6A1	63	35
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	ERG2	20	43
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	SLC18A3	15	46
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594619	EH	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	DRD2	31	43
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	DRD4	22	53
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	HTR2A	33	53
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	HTR2C	27	56
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	SLC6A1	63	35
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	ERG2	20	43
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	SLC18A3	15	46
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccc(F)cc1	ZINC000450594621	EH	On-Demand	Anodyne	CYP2J2	54	38
CCOC(=O)c1sc2ncnc(NCC[C@](C)(O)COC)c2c1C	ZINC000450594628	FE	On-Demand	Anodyne	MKNK2	19	41
CCOC(=O)c1sc2ncnc(NCC[C@@](C)(O)COC)c2c1C	ZINC000450594631	FE	On-Demand	Anodyne	MKNK2	19	41
COC(=O)c1ccc(C(=O)CN2C(=O)C(=O)N(C3CCCC3)C2=O)o1	ZINC000450594634	EC	On-Demand	Anodyne	CACNA1D	0	40
COc1ccc(-c2noc(CN3CCCC[C@H]3c3nc4ccccc4o3)n2)nn1	ZINC000450594652	GG	On-Demand	Anodyne	COLA	45	39
COc1ccc(-c2noc(CN3CCCC[C@H]3c3nc4ccccc4o3)n2)nn1	ZINC000450594652	GG	On-Demand	Anodyne	CPT1A	43	39
COc1ccc(-c2noc(CN3CCCC[C@@H]3c3nc4ccccc4o3)n2)nn1	ZINC000450594656	GG	On-Demand	Anodyne	COLA	45	39
COc1ccc(-c2noc(CN3CCCC[C@@H]3c3nc4ccccc4o3)n2)nn1	ZINC000450594656	GG	On-Demand	Anodyne	CPT1A	43	39
CCO[C@@H]1COCC[C@@H]1NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450594690	GF	On-Demand	Anodyne	HPGD	35	51
CCO[C@H]1COCC[C@H]1NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450594691	GF	On-Demand	Anodyne	HPGD	35	51
CCO[C@@H]1COCC[C@H]1NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450594693	GF	On-Demand	Anodyne	HPGD	35	51
CCO[C@H]1COCC[C@@H]1NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450594695	GF	On-Demand	Anodyne	HPGD	35	51
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450594709	EC	On-Demand	Anodyne	HLA-DRB1	40	32
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450594709	EC	On-Demand	Anodyne	CAPN2	49	34
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450594709	EC	On-Demand	Anodyne	NPR	54	38
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450594711	EC	On-Demand	Anodyne	HLA-DRB1	40	32
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450594711	EC	On-Demand	Anodyne	CAPN2	49	34
CCOC(=O)[C@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450594711	EC	On-Demand	Anodyne	NPR	54	38
Cc1cc(N2CC[C@@H](F)C2)nc(-c2cccnc2)n1	ZINC000450594734	CE	On-Demand	Anodyne	ROS1	37	43
Cc1cc(N2CC[C@H](F)C2)nc(-c2cccnc2)n1	ZINC000450594738	CE	On-Demand	Anodyne	ROS1	37	43
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450594741	FE	On-Demand	Anodyne	HDAC1	23	43
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450594741	FE	On-Demand	Anodyne	HPGDS	15	42
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)CCCC(=O)C1CC1	ZINC000450594743	EE	On-Demand	Anodyne	TRPV1	45	33
C=CC(C)(C)C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450594746	FI	On-Demand	Mild	PRSS2	44	31
COC(=O)[C@@H](NCCCNc1c(F)cccc1[N+](=O)[O-])C(C)C	ZINC000450594755	EE	On-Demand	Bother	COLA	72	34
Cc1cccc(Cl)c1C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450594756	FJ	On-Demand	Anodyne	ENV	41	33
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450594757	FJ	On-Demand	Anodyne	ENV	41	33
Cc1cccc(Cl)c1C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1	ZINC000450594758	FJ	On-Demand	Anodyne	ENV	41	33
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1	ZINC000450594759	FJ	On-Demand	Anodyne	ENV	41	33
CC(=O)NC[C@H](CC(=O)N1CCN(c2ccnc(C)n2)CC1)CC(C)C	ZINC000450594764	FD	On-Demand	Anodyne	SORD	67	38
COC(=O)c1csc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)n1	ZINC000450594771	GI	On-Demand	Anodyne	CYP11B2	25	44
CCO[C@@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450594777	FD	On-Demand	Bother	CACNA1D	52	32
CCO[C@@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450594777	FD	On-Demand	Bother	LUXR	17	41
CCO[C@@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450594778	FD	On-Demand	Bother	CACNA1D	52	32
CCO[C@@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450594778	FD	On-Demand	Bother	LUXR	17	41
CCO[C@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450594779	FD	On-Demand	Bother	CACNA1D	52	32
CCO[C@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450594779	FD	On-Demand	Bother	LUXR	17	41
CCO[C@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450594780	FD	On-Demand	Bother	CACNA1D	52	32
CCO[C@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450594780	FD	On-Demand	Bother	LUXR	17	41
Cc1nc(-c2ccccn2)nc(NC[C@@H]2CCCN2CCCO)c1C	ZINC000450594786	ED	On-Demand	Anodyne	METAP1	44	43
Cc1nc(-c2ccccn2)nc(NC[C@H]2CCCN2CCCO)c1C	ZINC000450594787	ED	On-Demand	Anodyne	METAP1	44	43
COC(=O)c1ccc(CN2[C@@H](C)CCC[C@H]2CO)cc1Cl	ZINC000450594792	DF	On-Demand	Anodyne	OPRK1	0	41
COC(=O)c1ccc(CN2[C@H](C)CCC[C@@H]2CO)cc1Cl	ZINC000450594793	DF	On-Demand	Anodyne	OPRK1	0	41
COC(=O)c1ccc(CN2[C@@H](C)CCC[C@@H]2CO)cc1Cl	ZINC000450594794	DF	On-Demand	Anodyne	OPRK1	0	41
COC(=O)c1ccc(CN2[C@H](CO)CCC[C@H]2C)cc1Cl	ZINC000450594795	DF	On-Demand	Anodyne	OPRK1	0	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@]12CCCO2	ZINC000450594820	GH	On-Demand	Anodyne	RBP4	54	34
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@@]12CCCO2	ZINC000450594821	GH	On-Demand	Anodyne	RBP4	54	34
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@@]12CCCO2	ZINC000450594822	GH	On-Demand	Anodyne	RBP4	54	34
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@]12CCCO2	ZINC000450594823	GH	On-Demand	Anodyne	RBP4	54	34
CCn1c(Cc2ccccc2)nnc1SCc1cn(CC2CC2)nn1	ZINC000450594830	FG	On-Demand	Anodyne	SLC27A1	41	33
CC(C)C[C@@H](CN1CCCC1)Nc1ccc(S(C)(=O)=O)cc1F	ZINC000450594871	EG	On-Demand	Anodyne	SLC6A9	15	40
CN(C)c1nc(NC[C@@H]2CCCN2CCCO)nc2ccccc12	ZINC000450594874	ED	On-Demand	Anodyne	ADRA2A	17	51
CN(C)c1nc(NC[C@@H]2CCCN2CCCO)nc2ccccc12	ZINC000450594874	ED	On-Demand	Anodyne	HNMT	43	32
CN(C)c1nc(NC[C@H]2CCCN2CCCO)nc2ccccc12	ZINC000450594875	ED	On-Demand	Anodyne	ADRA2A	17	51
CN(C)c1nc(NC[C@H]2CCCN2CCCO)nc2ccccc12	ZINC000450594875	ED	On-Demand	Anodyne	HNMT	43	32
OCCCN1CCC[C@@H]1CNc1ccnc2c(Cl)cccc12	ZINC000450594876	DG	On-Demand	Anodyne	HRP1_PLAFA	64	36
OCCCN1CCC[C@@H]1CNc1ccnc2c(Cl)cccc12	ZINC000450594876	DG	On-Demand	Anodyne	HNMT	72	39
OCCCN1CCC[C@H]1CNc1ccnc2c(Cl)cccc12	ZINC000450594877	DG	On-Demand	Anodyne	HRP1_PLAFA	64	36
OCCCN1CCC[C@H]1CNc1ccnc2c(Cl)cccc12	ZINC000450594877	DG	On-Demand	Anodyne	HNMT	72	39
CC[C@H](COCC(F)(F)F)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450594891	GH	On-Demand	Bother	TAAR1	16	45
CC[C@@H](COCC(F)(F)F)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450594892	GH	On-Demand	Bother	TAAR1	16	45
CNS(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450594899	DD	On-Demand	Bother	BCL2L1	100	37
CNS(=O)(=O)c1ccc(NC(CF)CF)c([N+](=O)[O-])c1	ZINC000450594899	DD	On-Demand	Bother	BCL2	67	32
CCn1cc(C(=O)N2CCN(CCC(=O)OC)[C@@H](C)C2)c2ccccc21	ZINC000450594900	FE	On-Demand	Anodyne	CNR1	25	51
CCn1cc(C(=O)N2CCN(CCC(=O)OC)[C@@H](C)C2)c2ccccc21	ZINC000450594900	FE	On-Demand	Anodyne	CNR2	27	52
CCn1cc(C(=O)N2CCN(CCC(=O)OC)[C@@H](C)C2)c2ccccc21	ZINC000450594900	FE	On-Demand	Anodyne	TPSAB1	32	46
CCn1cc(C(=O)N2CCN(CCC(=O)OC)[C@H](C)C2)c2ccccc21	ZINC000450594901	FE	On-Demand	Anodyne	CNR1	25	51
CCn1cc(C(=O)N2CCN(CCC(=O)OC)[C@H](C)C2)c2ccccc21	ZINC000450594901	FE	On-Demand	Anodyne	CNR2	27	52
CCn1cc(C(=O)N2CCN(CCC(=O)OC)[C@H](C)C2)c2ccccc21	ZINC000450594901	FE	On-Demand	Anodyne	TPSAB1	32	46
Cc1cc(=NC(CF)CF)[nH]c(-c2ccccn2)n1	ZINC000450594907	CD	On-Demand	Anodyne	MAP	0	45
CCSc1cccnc1C(=O)NC[C@H](C)c1nccs1	ZINC000450594913	DG	On-Demand	Anodyne	MAP	0	41
CCSc1cccnc1C(=O)NC[C@H](C)c1nccs1	ZINC000450594913	DG	On-Demand	Anodyne	MAP1	88	41
CCSc1cccnc1C(=O)NC[C@@H](C)c1nccs1	ZINC000450594914	DG	On-Demand	Anodyne	MAP	0	41
CCSc1cccnc1C(=O)NC[C@@H](C)c1nccs1	ZINC000450594914	DG	On-Demand	Anodyne	MAP1	88	41
Cn1c(SCC[C@@H]2CCOC2)nc2sc3c(c2c1=O)CCC3	ZINC000450594915	EG	On-Demand	Anodyne	CEL	19	40
Cn1c(SCC[C@H]2CCOC2)nc2sc3c(c2c1=O)CCC3	ZINC000450594916	EG	On-Demand	Anodyne	CEL	19	40
CN1CCN(S(=O)(=O)c2ccc(NC(CF)CF)c([N+](=O)[O-])c2)CC1	ZINC000450594924	GD	On-Demand	Bother	BDKRB1	0	40
CN1CCN(S(=O)(=O)c2ccc(NC(CF)CF)c([N+](=O)[O-])c2)CC1	ZINC000450594924	GD	On-Demand	Bother	BCL2L1	100	35
CN1CCN(S(=O)(=O)c2ccc(NC(CF)CF)c([N+](=O)[O-])c2)CC1	ZINC000450594924	GD	On-Demand	Bother	BCL2	68	34
CN1CCN(S(=O)(=O)c2ccc(NC(CF)CF)c([N+](=O)[O-])c2)CC1	ZINC000450594924	GD	On-Demand	Bother	BCL2L2	41	32
Cc1ccccc1CCN(C)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450594929	EF	On-Demand	Bother	COLA	53	32
C[C@H]1N(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCC12CCOCC2	ZINC000450594936	GH	On-Demand	Anodyne	PRCP	18	42
C[C@@H]1N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC12CCOCC2	ZINC000450594943	FF	On-Demand	Bother	CACNA1C	44	32
C[C@@H]1N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC12CCOCC2	ZINC000450594943	FF	On-Demand	Bother	CACNA1D	61	32
C[C@H]1N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC12CCOCC2	ZINC000450594944	FF	On-Demand	Bother	CACNA1C	44	32
C[C@H]1N(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC12CCOCC2	ZINC000450594944	FF	On-Demand	Bother	CACNA1D	61	32
COC(=O)CCN1CCN(C(=O)c2ocnc2-c2ccccc2)C[C@@H]1C	ZINC000450594964	FE	On-Demand	Anodyne	SMO	46	43
COC(=O)CCN1CCN(C(=O)c2ocnc2-c2ccccc2)C[C@H]1C	ZINC000450594965	FE	On-Demand	Anodyne	SMO	46	43
CC(C)C[C@@H](CN1CCCC1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450595036	FF	On-Demand	Bother	BCL2L1	52	34
CC(C)C[C@@H](CN1CCCC1)Nc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450595037	EF	On-Demand	Bother	BCL2L1	54	32
CC(C)C[C@@H](CN1CCCC1)Nc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450595037	EF	On-Demand	Bother	BCL2	46	30
CCOC(=O)[C@@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450595041	DD	On-Demand	Anodyne	SELE	60	37
CCOC(=O)[C@@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450595041	DD	On-Demand	Anodyne	VCAM1	45	33
CCOC(=O)[C@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450595042	DD	On-Demand	Anodyne	SELE	60	37
CCOC(=O)[C@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450595042	DD	On-Demand	Anodyne	VCAM1	45	33
O=C1CC[C@H](CN2CCC[C@H](CCCc3ccccc3)C2)CCN1	ZINC000450595056	EH	On-Demand	Anodyne	SIGMAR1	21	40
O=C1CC[C@H](CN2CCC[C@@H](CCCc3ccccc3)C2)CCN1	ZINC000450595059	EH	On-Demand	Anodyne	SIGMAR1	21	40
O=C1CC[C@@H](CN2CCC[C@H](CCCc3ccccc3)C2)CCN1	ZINC000450595060	EH	On-Demand	Anodyne	SIGMAR1	21	40
O=C1CC[C@@H](CN2CCC[C@@H](CCCc3ccccc3)C2)CCN1	ZINC000450595065	EH	On-Demand	Anodyne	SIGMAR1	21	40
C[C@@H](O)CCN1CCC(Sc2ccc(Cl)cc2)CC1	ZINC000450595070	CH	On-Demand	Anodyne	EBP	18	47
C[C@H](O)CCN1CCC(Sc2ccc(Cl)cc2)CC1	ZINC000450595071	CH	On-Demand	Anodyne	EBP	19	47
COC[C@](C)(O)CCNc1cc(C)nc2ncnn12	ZINC000450595074	CC	On-Demand	Anodyne	DHOD	0	61
COC[C@@](C)(O)CCNc1cc(C)nc2ncnn12	ZINC000450595075	CC	On-Demand	Anodyne	DHOD	0	61
CCOC(=O)[C@](C)(O)CNC(=O)c1cncc(Cl)c1	ZINC000450595080	CC	On-Demand	Anodyne	SCN10A	40	38
CCOC(=O)[C@@](C)(O)CNC(=O)c1cncc(Cl)c1	ZINC000450595084	CC	On-Demand	Anodyne	SCN10A	40	38
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595086	EH	On-Demand	Anodyne	DRD2	29	40
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595086	EH	On-Demand	Anodyne	DRD4	0	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595086	EH	On-Demand	Anodyne	HTR2A	29	50
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595086	EH	On-Demand	Anodyne	HTR2C	23	52
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595086	EH	On-Demand	Anodyne	ERG2	19	40
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595086	EH	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595086	EH	On-Demand	Anodyne	CYP2J2	53	38
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595088	EH	On-Demand	Anodyne	DRD2	29	40
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595088	EH	On-Demand	Anodyne	DRD4	0	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595088	EH	On-Demand	Anodyne	HTR2A	29	50
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595088	EH	On-Demand	Anodyne	HTR2C	23	52
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595088	EH	On-Demand	Anodyne	ERG2	19	40
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595088	EH	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1n1ccnc1	ZINC000450595088	EH	On-Demand	Anodyne	CYP2J2	53	38
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595090	EH	On-Demand	Anodyne	DRD2	29	40
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595090	EH	On-Demand	Anodyne	DRD4	0	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595090	EH	On-Demand	Anodyne	HTR2A	29	50
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595090	EH	On-Demand	Anodyne	HTR2C	23	52
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595090	EH	On-Demand	Anodyne	ERG2	19	40
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595090	EH	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595090	EH	On-Demand	Anodyne	CYP2J2	53	38
c1ccc(OCCSCc2cn(CC3CC3)nn2)cc1	ZINC000450595091	CG	On-Demand	Anodyne	FIMH	16	46
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595092	EH	On-Demand	Anodyne	DRD2	29	40
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595092	EH	On-Demand	Anodyne	DRD4	0	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595092	EH	On-Demand	Anodyne	HTR2A	29	50
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595092	EH	On-Demand	Anodyne	HTR2C	23	52
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595092	EH	On-Demand	Anodyne	ERG2	19	40
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595092	EH	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1n1ccnc1	ZINC000450595092	EH	On-Demand	Anodyne	CYP2J2	53	38
CCOC(=O)[C@H]1CN(Cc2ccc(C(C)=O)cc2)Cc2ccccc21	ZINC000450595093	EH	On-Demand	Anodyne	NOD1	29	44
CCOC(=O)[C@H]1CN(Cc2ccc(C(C)=O)cc2)Cc2ccccc21	ZINC000450595093	EH	On-Demand	Anodyne	NOD2	46	44
COC[C@@](C)(O)CCNc1ccnc(N2CCOCC2)n1	ZINC000450595098	CB	On-Demand	Anodyne	EPHB4	55	31
COC[C@](C)(O)CCNc1ccnc(N2CCOCC2)n1	ZINC000450595099	CB	On-Demand	Anodyne	EPHB4	55	31
COC[C@@](C)(O)CCNc1cnc(-c2ccccc2)cn1	ZINC000450595100	CE	On-Demand	Anodyne	TPH1	29	41
COC[C@](C)(O)CCNc1cnc(-c2ccccc2)cn1	ZINC000450595101	CE	On-Demand	Anodyne	TPH1	29	41
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450595104	FE	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450595105	FE	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@@H]1CN(Cc2ccc(C(C)=O)cc2)Cc2ccccc21	ZINC000450595106	EH	On-Demand	Anodyne	NOD1	29	44
CCOC(=O)[C@@H]1CN(Cc2ccc(C(C)=O)cc2)Cc2ccccc21	ZINC000450595106	EH	On-Demand	Anodyne	NOD2	46	44
COc1ccc(CNC(=O)CCN2CCC[C@H]2C(C)(C)O)c(OC)c1	ZINC000450595107	FD	On-Demand	Anodyne	MTNR1A	57	38
COc1ccc(CNC(=O)CCN2CCC[C@H]2C(C)(C)O)c(OC)c1	ZINC000450595107	FD	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN2CCC[C@H]2C(C)(C)O)c(OC)c1	ZINC000450595107	FD	On-Demand	Anodyne	ACKR3	41	30
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C(C)(C)O)c(OC)c1	ZINC000450595108	FD	On-Demand	Anodyne	MTNR1A	57	38
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C(C)(C)O)c(OC)c1	ZINC000450595108	FD	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C(C)(C)O)c(OC)c1	ZINC000450595108	FD	On-Demand	Anodyne	ACKR3	41	30
F[C@@H]1CCN(c2nc(-c3ccccn3)nc3c2CCC3)C1	ZINC000450595115	CF	On-Demand	Anodyne	METAP1	16	44
F[C@H]1CCN(c2nc(-c3ccccn3)nc3c2CCC3)C1	ZINC000450595116	CF	On-Demand	Anodyne	METAP1	16	44
CCC(=O)CCCN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450595117	CG	On-Demand	Bother	COLA	102	39
CCC(=O)CCCN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450595117	CG	On-Demand	Bother	PQSD	0	40
CC(C)(CS(C)(=O)=O)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450595125	GE	On-Demand	Anodyne	TRPC6	59	32
CC(C)(CS(C)(=O)=O)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450595125	GE	On-Demand	Anodyne	TRPC3	46	32
CCOC(=O)c1cccnc1N1CC[C@H](F)C1	ZINC000450595132	BD	On-Demand	Anodyne	P2RY12	51	38
F[C@@H]1CCN(c2ncnc3c2oc2ccccc23)C1	ZINC000450595133	CF	On-Demand	Anodyne	HRH4	23	64
F[C@H]1CCN(c2ncnc3c2oc2ccccc23)C1	ZINC000450595134	CF	On-Demand	Anodyne	HRH4	23	64
COC(=O)[C@@H](O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450595136	EF	On-Demand	Anodyne	HTR4	65	36
COC(=O)[C@@H](O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450595136	EF	On-Demand	Anodyne	SIGMAR1	16	40
COC(=O)[C@H](O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450595137	EF	On-Demand	Anodyne	HTR4	65	36
COC(=O)[C@H](O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450595137	EF	On-Demand	Anodyne	SIGMAR1	16	40
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nc(-c2cc(C)ccn2)no1	ZINC000450595148	GD	On-Demand	Anodyne	SLC6A1	68	38
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nc(-c2cc(C)ccn2)no1	ZINC000450595148	GD	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nc(-c2cc(C)ccn2)no1	ZINC000450595149	GD	On-Demand	Anodyne	SLC6A1	68	38
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nc(-c2cc(C)ccn2)no1	ZINC000450595149	GD	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nc(-c2cc(C)ccn2)no1	ZINC000450595150	GD	On-Demand	Anodyne	SLC6A1	68	38
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nc(-c2cc(C)ccn2)no1	ZINC000450595150	GD	On-Demand	Anodyne	SLC6A3	38	40
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1NS(C)(=O)=O	ZINC000450595164	EF	On-Demand	Anodyne	TRPV1	67	34
Cc1csc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)c1	ZINC000450595170	GJ	On-Demand	Anodyne	PRSS2	43	30
Cc1csc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)c1	ZINC000450595170	GJ	On-Demand	Anodyne	CCR3	25	40
Cc1csc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)c1	ZINC000450595170	GJ	On-Demand	Anodyne	EPHX2	15	42
COC1(CSc2nnc(CN3CCCC3)n2Cc2ccccc2)CCC1	ZINC000450595171	FH	On-Demand	Anodyne	SIGMAR1	27	40
CCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595176	CF	On-Demand	Anodyne	FOLH1	29	40
CCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595176	CF	On-Demand	Anodyne	CAPNS1	41	36
CCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595176	CF	On-Demand	Anodyne	CAPN1	56	38
CCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595176	CF	On-Demand	Anodyne	CAPN2	85	41
CCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595176	CF	On-Demand	Anodyne	NPR	38	59
CCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595177	CF	On-Demand	Anodyne	FOLH1	29	40
CCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595177	CF	On-Demand	Anodyne	CAPNS1	41	36
CCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595177	CF	On-Demand	Anodyne	CAPN1	56	38
CCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595177	CF	On-Demand	Anodyne	CAPN2	85	41
CCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595177	CF	On-Demand	Anodyne	NPR	38	59
CCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595178	CF	On-Demand	Anodyne	FOLH1	29	40
CCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595178	CF	On-Demand	Anodyne	CAPNS1	41	36
CCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595178	CF	On-Demand	Anodyne	CAPN1	56	38
CCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595178	CF	On-Demand	Anodyne	CAPN2	85	41
CCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450595178	CF	On-Demand	Anodyne	NPR	38	59
CCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595179	CF	On-Demand	Anodyne	FOLH1	29	40
CCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595179	CF	On-Demand	Anodyne	CAPNS1	41	36
CCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595179	CF	On-Demand	Anodyne	CAPN1	56	38
CCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595179	CF	On-Demand	Anodyne	CAPN2	85	41
CCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450595179	CF	On-Demand	Anodyne	NPR	38	59
Cc1nccc(N2CCN(C(=O)C(C)(C)OC(C)C)CC2)n1	ZINC000450595181	DD	On-Demand	Anodyne	SORD	49	38
O=C1N[C@]2(CCSC2)C(=O)N1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450595198	FH	On-Demand	Anodyne	DNAE	41	31
O=C1N[C@@]2(CCSC2)C(=O)N1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450595199	FH	On-Demand	Anodyne	DNAE	41	31
CCC[C@@H](OC)C(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450595219	DG	On-Demand	Anodyne	SDH1	0	40
CCC[C@H](OC)C(=O)Nc1ccc(F)cc1OCC(F)F	ZINC000450595220	DG	On-Demand	Anodyne	SDH1	0	40
CCCc1cc(C(=O)N(C)CC2(O)CCC2)no1	ZINC000450595244	CD	On-Demand	Anodyne	S1PR3	16	56
COC1CCC(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450595270	FJ	On-Demand	Anodyne	RBP4	77	38
CN1CCN(CC2(C)CCN(C(=O)c3ccc4cnccc4c3)CC2)CC1	ZINC000450595296	FF	On-Demand	Anodyne	ACACB	40	37
CNC(=O)c1ccc(N[C@@H](CC(C)C)CN2CCCC2)c([N+](=O)[O-])c1	ZINC000450595310	EF	On-Demand	Bother	BCL2L1	58	32
CNC(=O)c1ccc(N[C@@H](CC(C)C)CN2CCCC2)c([N+](=O)[O-])c1	ZINC000450595310	EF	On-Demand	Bother	BCL2	46	31
CNC(=O)c1ccc(N[C@@H](CC(C)C)CN2CCCC2)c([N+](=O)[O-])c1	ZINC000450595310	EF	On-Demand	Bother	TAAR1	18	43
CCOC(=O)c1ccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)nc1	ZINC000450595348	FI	On-Demand	Anodyne	SSTR5	40	44
CCOC(=O)c1ccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)nc1	ZINC000450595348	FI	On-Demand	Anodyne	COLA	79	42
CCOC(=O)c1ccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)nc1	ZINC000450595348	FI	On-Demand	Anodyne	CPT1A	77	42
CCOC(=O)c1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)nc1	ZINC000450595349	FI	On-Demand	Anodyne	SSTR5	40	44
CCOC(=O)c1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)nc1	ZINC000450595349	FI	On-Demand	Anodyne	COLA	79	42
CCOC(=O)c1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)nc1	ZINC000450595349	FI	On-Demand	Anodyne	CPT1A	77	42
CC(C)OCCNC(=O)[C@H]1CC12CCSCC2	ZINC000450595363	CE	On-Demand	Anodyne	EPHX2	0	51
CC(C)OCCNC(=O)[C@@H]1CC12CCSCC2	ZINC000450595364	CE	On-Demand	Anodyne	EPHX2	0	51
CC(C)OCCNC(=O)C(C)(C)C1CCC1	ZINC000450595368	BE	On-Demand	Anodyne	AMY2	43	29
Cc1ccccc1CCN(C)c1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450595380	GG	On-Demand	Bother	BCL2L1	45	35
Cc1ccc(F)c(CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCCO4)C2=O)c1	ZINC000450595382	FF	On-Demand	Anodyne	SCN9A	22	41
Cc1ccccc1CCN(C)c1cc(C(F)(F)F)nc2ncnn12	ZINC000450595383	EG	On-Demand	Anodyne	DHOD	0	43
Cc1ccc(F)c(CN2C(=O)N[C@](C)(c3ccc4c(c3)OCCO4)C2=O)c1	ZINC000450595389	FF	On-Demand	Anodyne	SCN9A	22	41
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c[nH]c2nccc-2c1	ZINC000450595397	EC	On-Demand	Anodyne	FOLH1	47	35
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c[nH]c2nccc-2c1	ZINC000450595397	EC	On-Demand	Anodyne	PLM1_PLAFA	42	32
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c[nH]c2nccc-2c1	ZINC000450595397	EC	On-Demand	Anodyne	KISS1R	48	32
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c[nH]c2nccc-2c1	ZINC000450595397	EC	On-Demand	Anodyne	F2RL1	51	37
Cc1cc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1Cl	ZINC000450595434	GH	On-Demand	Anodyne	P2RX7	28	45
Cc1cc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1Cl	ZINC000450595434	GH	On-Demand	Anodyne	CA5B	29	41
Cc1cc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1Cl	ZINC000450595434	GH	On-Demand	Anodyne	CA5A	29	41
Cc1cc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1Cl	ZINC000450595434	GH	On-Demand	Anodyne	CA9	24	45
Cc1cc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1Cl	ZINC000450595434	GH	On-Demand	Anodyne	E1	0	42
Cc1cc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1Cl	ZINC000450595434	GH	On-Demand	Anodyne	PFK	0	42
Cc1cc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1Cl	ZINC000450595434	GH	On-Demand	Anodyne	RORC	45	38
CC[C@@H](COCC(F)(F)F)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450595477	GI	On-Demand	Anodyne	AVPR2	86	40
CC[C@@H](COCC(F)(F)F)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450595477	GI	On-Demand	Anodyne	AVPR1A	54	40
CC[C@H](COCC(F)(F)F)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450595478	GI	On-Demand	Anodyne	AVPR2	86	40
CC[C@H](COCC(F)(F)F)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450595478	GI	On-Demand	Anodyne	AVPR1A	54	40
CC1(O)CC(C(=O)NCC[C@@H](NC(=O)C2CC(C)(O)C2)c2ccccc2)C1	ZINC000450595488	FD	On-Demand	Anodyne	CCR5	27	43
CC1(O)CC(C(=O)NCC[C@H](NC(=O)C2CC(C)(O)C2)c2ccccc2)C1	ZINC000450595489	FD	On-Demand	Anodyne	CCR5	27	43
CCCCn1c(SCc2cccc(C(C)=O)c2)nnc1[C@@H](CC)N(C)C	ZINC000450595512	FJ	On-Demand	Anodyne	AGTR1	15	44
CCCCn1c(SCc2cccc(C(C)=O)c2)nnc1[C@H](CC)N(C)C	ZINC000450595513	FJ	On-Demand	Anodyne	AGTR1	15	44
COC[C@@](C)(O)CCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450595540	FE	On-Demand	Anodyne	ROS1	56	40
COC[C@](C)(O)CCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450595541	FE	On-Demand	Anodyne	ROS1	56	40
COC[C@@](C)(O)CCNc1ncnc2ccc(I)cc12	ZINC000450595564	GD	On-Demand	Anodyne	CLK4	55	35
COC[C@@](C)(O)CCNc1ncnc2ccc(I)cc12	ZINC000450595564	GD	On-Demand	Anodyne	CD38	52	35
COC[C@](C)(O)CCNc1ncnc2ccc(I)cc12	ZINC000450595565	GD	On-Demand	Anodyne	CLK4	55	35
COC[C@](C)(O)CCNc1ncnc2ccc(I)cc12	ZINC000450595565	GD	On-Demand	Anodyne	CD38	52	35
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450595584	GH	On-Demand	Anodyne	LRRK2	19	40
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450595585	GH	On-Demand	Anodyne	LRRK2	19	40
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450595586	GH	On-Demand	Anodyne	LRRK2	19	40
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450595587	GH	On-Demand	Anodyne	LRRK2	19	40
CC[C@@H]1C[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450595603	CF	On-Demand	Anodyne	NAMPT	32	46
CCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450595608	CC	On-Demand	Anodyne	PROTEASE	0	42
CCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450595609	CC	On-Demand	Anodyne	PROTEASE	0	42
C[C@H](CN1CCC(Sc2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450595614	EG	On-Demand	Anodyne	EBP	16	40
C[C@@H](CN1CCC(Sc2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450595615	EG	On-Demand	Anodyne	EBP	16	40
CCN1C(=O)CCc2cc(NC(=O)Cc3ccc(Cl)c(OC)c3)ccc21	ZINC000450595642	FH	On-Demand	Anodyne	IMDH_CRYPV	20	45
Cc1nccc(N2CCN(C(=O)[C@@H]3Cc4c(C)cccc4O3)CC2)n1	ZINC000450595667	ED	On-Demand	Anodyne	SORD	49	37
Cc1nccc(N2CCN(C(=O)[C@H]3Cc4c(C)cccc4O3)CC2)n1	ZINC000450595668	ED	On-Demand	Anodyne	SORD	49	37
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H]2CCCN2CCCO)nc1	ZINC000450595669	FC	On-Demand	Anodyne	ADAMTS5	21	40
COc1cccc(-n2cc(C(=O)NC(C)(C)CS(C)(=O)=O)nn2)c1	ZINC000450595671	FC	On-Demand	Anodyne	DRD4	43	33
O=S(=O)(NCC1CC1)c1ccc(NC[C@H]2CCCN2CCCO)nc1	ZINC000450595673	FC	On-Demand	Anodyne	ADAMTS5	21	40
COC(=O)c1cnc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450595680	ED	On-Demand	Bother	PRKCQ	40	35
CSc1cccc(C(=O)N2CCN(c3ccnc(C)n3)CC2)c1	ZINC000450595686	EE	On-Demand	Anodyne	SORD	56	38
CC[C@H](COCC(F)(F)F)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450595694	EH	On-Demand	Anodyne	EGFR	41	43
CC[C@H](COCC(F)(F)F)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450595694	EH	On-Demand	Anodyne	FGFR1	0	40
CC[C@@H](COCC(F)(F)F)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450595696	EH	On-Demand	Anodyne	EGFR	41	43
CC[C@@H](COCC(F)(F)F)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450595696	EH	On-Demand	Anodyne	FGFR1	0	40
COC(=O)c1cnc(NC[C@@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450595702	ED	On-Demand	Bother	PRKCQ	40	35
CC(C)OCCNC(=O)c1cc2ccc(Br)cc2s1	ZINC000450595710	EH	On-Demand	Anodyne	ICAM1	18	42
CC[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H](C)C[C@H]1c1cccnc1	ZINC000450595746	CH	On-Demand	Anodyne	CHRNA2	40	42
CC[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H](C)C[C@H]1c1cccnc1	ZINC000450595746	CH	On-Demand	Anodyne	CRTY	0	42
CC[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1	ZINC000450595748	CH	On-Demand	Anodyne	CHRNA2	40	42
CC[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1	ZINC000450595748	CH	On-Demand	Anodyne	CRTY	0	42
CC[C@@H]1CCC[C@@H]1C(=O)N1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450595750	CH	On-Demand	Anodyne	CHRNA2	40	42
CC[C@@H]1CCC[C@@H]1C(=O)N1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450595750	CH	On-Demand	Anodyne	CRTY	0	42
CC[C@@H]1CCC[C@@H]1C(=O)N1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450595752	CH	On-Demand	Anodyne	CHRNA2	40	42
CC[C@@H]1CCC[C@@H]1C(=O)N1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450595752	CH	On-Demand	Anodyne	CRTY	0	42
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CC(=O)OC)cc1	ZINC000450595760	EE	On-Demand	Anodyne	DRD2	49	41
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CC(=O)OC)cc1	ZINC000450595760	EE	On-Demand	Anodyne	CASP3	56	38
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CC(=O)OC)cc1	ZINC000450595760	EE	On-Demand	Anodyne	CASP7	73	38
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CC(=O)OC)cc1	ZINC000450595761	EE	On-Demand	Anodyne	DRD2	49	41
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CC(=O)OC)cc1	ZINC000450595761	EE	On-Demand	Anodyne	CASP3	56	38
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CC(=O)OC)cc1	ZINC000450595761	EE	On-Demand	Anodyne	CASP7	73	38
OCCCN1CCC[C@@H]1CNc1ccnc2ccsc12	ZINC000450595783	CF	On-Demand	Anodyne	HNMT	40	31
OCCCN1CCC[C@H]1CNc1ccnc2ccsc12	ZINC000450595816	CF	On-Demand	Anodyne	HNMT	40	31
Cc1nccc(N2CCN(C(=O)c3cn(CC(C)C)nc3C(F)F)CC2)n1	ZINC000450595831	GF	On-Demand	Anodyne	SORD	51	36
COc1ccc(CNC(=O)CCN(CCO)C2CCCCC2)c(OC)c1	ZINC000450595833	FE	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN(CCO)C2CCCCC2)c(OC)c1	ZINC000450595833	FE	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN(CCO)C2CCCCC2)c(OC)c1	ZINC000450595833	FE	On-Demand	Anodyne	MTNR1B	42	35
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1ccc(C(=O)NCCO)nn1	ZINC000450595834	ED	On-Demand	Anodyne	SCD1	43	46
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1ccc(C(=O)NCCO)nn1	ZINC000450595835	ED	On-Demand	Anodyne	SCD1	43	46
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1ccc(C(=O)NCCO)nn1	ZINC000450595837	ED	On-Demand	Anodyne	SCD1	43	46
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1ccc(C(=O)NCCO)nn1	ZINC000450595839	ED	On-Demand	Anodyne	SCD1	43	46
COC(=O)[C@@H](NCCCNc1cc(-c2ccccc2)nc2ncnn12)C(C)C	ZINC000450595840	GE	On-Demand	Anodyne	P2RY12	78	34
CCCOc1ccc2c(c1)CCN(Cc1nc(C(=O)OC)co1)C2	ZINC000450595862	EF	On-Demand	Anodyne	NOD2	41	37
COc1cc(CC(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)ccc1Cl	ZINC000450595863	EH	On-Demand	Anodyne	OPRK1	19	43
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	F2	83	42
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	PLG	45	39
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	PRSS1	0	46
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	ACE	50	41
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	FKBP1A	56	49
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	OPRM1	25	44
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	OPRD1	0	41
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	P2RY12	42	36
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	ELANE	55	40
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	TRHR	51	38
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CMA1	38	43
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CTRA_BOVIN	61	34
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	PRSS3	0	46
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CASP3	45	39
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	XPNPEP1	0	40
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	MMP13	75	47
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	TRY1_BOVIN	111	38
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	NTSR1	74	33
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	NTSR2	40	31
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CTSG	41	32
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CCR4	0	43
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	ADAM17	47	43
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	ITGA4	78	51
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CAPNS1	35	53
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	MMP2	35	44
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	MMP3	83	47
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	MMP8	40	44
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CELA2A	50	34
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	LGMN	61	37
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	XPNPEP2	0	40
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CAPN1	42	58
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	MMP9	41	46
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	MMP12	16	42
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	CASP7	49	33
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	NS3	0	40
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	TPSAB1	15	46
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	MMP7	78	47
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	MMP1	79	51
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	XIAP	68	40
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	SFRP1	61	33
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	WNT3	58	33
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	BRCA1	59	32
CCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450595874	FD	On-Demand	Anodyne	TMPRSS11D	55	34
COc1cc(CC(=O)N2C[C@H](C)C[C@H]2c2cccnc2)ccc1Cl	ZINC000450595875	EH	On-Demand	Anodyne	OPRK1	19	43
COc1cc(CC(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)ccc1Cl	ZINC000450595876	EH	On-Demand	Anodyne	OPRK1	19	43
COc1cc(CC(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)ccc1Cl	ZINC000450595877	EH	On-Demand	Anodyne	OPRK1	19	43
COc1ccc(-c2ccnc(NC[C@@H]3CCCN3CCCO)n2)cc1	ZINC000450595880	EE	On-Demand	Anodyne	HRH3	19	44
CC(C)OCCNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450595881	DF	On-Demand	Anodyne	CAN2	0	41
COc1ccc(-c2ccnc(NC[C@H]3CCCN3CCCO)n2)cc1	ZINC000450595882	EE	On-Demand	Anodyne	HRH3	19	44
O=C(CCCN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1)c1ccccc1	ZINC000450595883	GF	On-Demand	Anodyne	HTR2A	16	43
O=C(CCCN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1)c1ccccc1	ZINC000450595883	GF	On-Demand	Anodyne	SLC6A1	61	34
O=C(CCCN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1)c1ccccc1	ZINC000450595883	GF	On-Demand	Anodyne	CYP2J2	59	43
CCOC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450595885	ED	On-Demand	Anodyne	TRPV1	26	44
CCOC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450595885	ED	On-Demand	Anodyne	NCE103	27	44
CCOC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450595885	ED	On-Demand	Anodyne	CAN2	0	44
CCOC(=O)[C@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450595886	ED	On-Demand	Anodyne	TRPV1	26	44
CCOC(=O)[C@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450595886	ED	On-Demand	Anodyne	NCE103	27	44
CCOC(=O)[C@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450595886	ED	On-Demand	Anodyne	CAN2	0	44
O=C(CCCN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1)c1ccccc1	ZINC000450595897	GF	On-Demand	Anodyne	HTR2A	16	43
O=C(CCCN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1)c1ccccc1	ZINC000450595897	GF	On-Demand	Anodyne	SLC6A1	61	34
O=C(CCCN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1)c1ccccc1	ZINC000450595897	GF	On-Demand	Anodyne	CYP2J2	59	43
OCCCN1CCC[C@@H]1CNc1nc(C(F)F)nc2ccccc12	ZINC000450595900	EE	On-Demand	Anodyne	SLC2A1	17	40
OCCCN1CCC[C@@H]1CNc1nc(C(F)F)nc2ccccc12	ZINC000450595900	EE	On-Demand	Anodyne	HNMT	43	33
OCCCN1CCC[C@H]1CNc1nc(C(F)F)nc2ccccc12	ZINC000450595901	EE	On-Demand	Anodyne	SLC2A1	17	40
OCCCN1CCC[C@H]1CNc1nc(C(F)F)nc2ccccc12	ZINC000450595901	EE	On-Demand	Anodyne	HNMT	43	33
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@@H]1C	ZINC000450595948	GD	On-Demand	Anodyne	SLC6A1	49	32
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@@H]1C	ZINC000450595948	GD	On-Demand	Anodyne	HRH3	25	43
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@@H]1C	ZINC000450595948	GD	On-Demand	Anodyne	CPT2	41	35
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@@H]1C	ZINC000450595948	GD	On-Demand	Anodyne	PREP	118	55
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@@H]1C	ZINC000450595948	GD	On-Demand	Anodyne	SFRP1	45	39
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@@H]1C	ZINC000450595948	GD	On-Demand	Anodyne	WNT3	55	39
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@@H]1C	ZINC000450595948	GD	On-Demand	Anodyne	TMPRSS11D	45	33
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450595950	GD	On-Demand	Anodyne	SLC6A1	49	32
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450595950	GD	On-Demand	Anodyne	HRH3	25	43
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450595950	GD	On-Demand	Anodyne	CPT2	41	35
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450595950	GD	On-Demand	Anodyne	PREP	118	55
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450595950	GD	On-Demand	Anodyne	SFRP1	45	39
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450595950	GD	On-Demand	Anodyne	WNT3	55	39
COC(=O)CCN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C[C@H]1C	ZINC000450595950	GD	On-Demand	Anodyne	TMPRSS11D	45	33
COC[C@@](C)(O)CCNc1ncnc2cc(Br)ccc12	ZINC000450595951	EE	On-Demand	Anodyne	EGFR	65	40
COC[C@@](C)(O)CCNc1ncnc2cc(Br)ccc12	ZINC000450595951	EE	On-Demand	Anodyne	FBP1	18	40
COC[C@@](C)(O)CCNc1ncnc2cc(Br)ccc12	ZINC000450595951	EE	On-Demand	Anodyne	ERBB4	23	40
COC[C@@](C)(O)CCNc1ncnc2cc(Br)ccc12	ZINC000450595951	EE	On-Demand	Anodyne	CD38	22	40
COC[C@](C)(O)CCNc1ncnc2cc(Br)ccc12	ZINC000450595953	EE	On-Demand	Anodyne	EGFR	65	40
COC[C@](C)(O)CCNc1ncnc2cc(Br)ccc12	ZINC000450595953	EE	On-Demand	Anodyne	FBP1	18	40
COC[C@](C)(O)CCNc1ncnc2cc(Br)ccc12	ZINC000450595953	EE	On-Demand	Anodyne	ERBB4	23	40
COC[C@](C)(O)CCNc1ncnc2cc(Br)ccc12	ZINC000450595953	EE	On-Demand	Anodyne	CD38	22	40
CCOC(=O)[C@@](C)(O)CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450595956	GD	On-Demand	Anodyne	TRPC6	51	32
CCOC(=O)[C@](C)(O)CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450595959	GD	On-Demand	Anodyne	TRPC6	51	32
CC(C)OCCNC(=O)c1ccnc(OC(F)F)c1	ZINC000450595971	CD	On-Demand	Anodyne	KDM4E	23	40
COc1cccc(-n2cc(C(=O)N3C[C@H](C)C[C@@H]3c3cccnc3)nn2)c1	ZINC000450595977	FF	On-Demand	Anodyne	GPBAR1	41	43
COc1cccc(-n2cc(C(=O)N3C[C@@H](C)C[C@@H]3c3cccnc3)nn2)c1	ZINC000450595979	FF	On-Demand	Anodyne	GPBAR1	41	43
COc1cccc(-n2cc(C(=O)N3C[C@H](C)C[C@H]3c3cccnc3)nn2)c1	ZINC000450595981	FF	On-Demand	Anodyne	GPBAR1	41	43
COc1cccc(-n2cc(C(=O)N3C[C@@H](C)C[C@H]3c3cccnc3)nn2)c1	ZINC000450595983	FF	On-Demand	Anodyne	GPBAR1	41	43
COc1cc(CC(=O)NC[C@H](C)c2ncc(C)s2)ccc1Cl	ZINC000450595996	EH	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)NC[C@H](C)c2ncc(C)s2)ccc1Cl	ZINC000450595996	EH	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)NC[C@@H](C)c2ncc(C)s2)ccc1Cl	ZINC000450595997	EH	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)NC[C@@H](C)c2ncc(C)s2)ccc1Cl	ZINC000450595997	EH	On-Demand	Anodyne	CAN2	0	41
FC(F)(F)Cn1ccc(CSc2nc3cc(Cl)cnc3[nH]2)n1	ZINC000450596006	EH	On-Demand	Anodyne	ENPP1	23	42
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450596052	EH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450596052	EH	On-Demand	Anodyne	CHRNA4	15	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450596052	EH	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450596053	EH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450596053	EH	On-Demand	Anodyne	CHRNA4	15	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450596053	EH	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450596054	EH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450596054	EH	On-Demand	Anodyne	CHRNA4	15	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450596054	EH	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450596055	EH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450596055	EH	On-Demand	Anodyne	CHRNA4	15	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450596055	EH	On-Demand	Anodyne	CRTY	0	40
CC(C)(C)c1cc(Cn2c(=O)oc3ccccc32)no1	ZINC000450596058	CF	On-Demand	Anodyne	MIF	17	42
CC(C)C[C@@H](CN1CCCC1)Nc1ncc([N+](=O)[O-])s1	ZINC000450596090	CF	On-Demand	Bother	MAPK9	15	43
Cc1ccnc(-c2noc(CSc3nnc(-c4ccco4)n3CC(C)C)n2)c1	ZINC000450596094	GI	On-Demand	Anodyne	TNKS2	16	41
CCCOc1ccc2c(c1)CCN(CC[C@@H](C)O)C2	ZINC000450596116	CF	On-Demand	Anodyne	ABCB1	0	45
CCCOc1ccc2c(c1)CCN(CC[C@H](C)O)C2	ZINC000450596118	CF	On-Demand	Anodyne	ABCB1	0	45
CC[C@H](O)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450596136	FG	On-Demand	Anodyne	RORC	45	52
CC[C@H](O)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450596136	FG	On-Demand	Anodyne	RORB	0	41
CC[C@@H](O)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450596138	FG	On-Demand	Anodyne	RORC	45	52
CC[C@@H](O)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450596138	FG	On-Demand	Anodyne	RORB	0	41
CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)[C@H](O)C1CCC1	ZINC000450596163	FF	On-Demand	Anodyne	SDH1	0	47
CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)[C@@H](O)C1CCC1	ZINC000450596165	FF	On-Demand	Anodyne	SDH1	0	47
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	F2	83	42
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	PLG	45	39
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	PRSS1	0	46
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	ACE	50	41
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	FKBP1A	56	49
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	OPRM1	25	44
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	OPRD1	0	41
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	P2RY12	42	36
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	ELANE	55	40
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	TRHR	51	38
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CMA1	38	43
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CTRA_BOVIN	61	34
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	PRSS3	0	46
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CASP3	45	39
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	XPNPEP1	0	40
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	MMP13	75	47
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	TRY1_BOVIN	111	38
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	NTSR1	74	33
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	NTSR2	40	31
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CTSG	41	32
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CCR4	0	43
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	ADAM17	47	43
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	ITGA4	78	51
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CAPNS1	35	53
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	MMP2	35	44
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	MMP3	83	47
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	MMP8	40	44
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CELA2A	50	34
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	LGMN	61	37
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	XPNPEP2	0	40
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CAPN1	42	58
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	MMP9	41	46
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	MMP12	16	42
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	CASP7	49	33
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	NS3	0	40
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	TPSAB1	15	46
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	MMP7	78	47
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	MMP1	79	51
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	XIAP	68	40
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	SFRP1	61	33
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	WNT3	58	33
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	BRCA1	59	32
CCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450596167	FD	On-Demand	Anodyne	TMPRSS11D	55	34
CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)[C@@H](O)C1CCC1	ZINC000450596168	FF	On-Demand	Anodyne	SDH1	0	47
CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)[C@H](O)C1CCC1	ZINC000450596170	FF	On-Demand	Anodyne	SDH1	0	47
C[C@@H]1CCC[C@@H](CO)N1Cc1ccn(CCc2ccccc2)n1	ZINC000450596173	DF	On-Demand	Anodyne	SLC18A2	53	43
C[C@H]1CCC[C@@H](CO)N1Cc1ccn(CCc2ccccc2)n1	ZINC000450596176	DF	On-Demand	Anodyne	SLC18A2	53	43
CCCCn1c(SCc2ccc(C(C)=O)cc2)nnc1[C@@H](CC)N(C)C	ZINC000450596177	FJ	On-Demand	Anodyne	AGTR1	15	40
C[C@H]1CCC[C@H](CO)N1Cc1ccn(CCc2ccccc2)n1	ZINC000450596178	DF	On-Demand	Anodyne	SLC18A2	53	43
C[C@@H]1CCC[C@H](CO)N1Cc1ccn(CCc2ccccc2)n1	ZINC000450596180	DF	On-Demand	Anodyne	SLC18A2	53	43
CCCCn1c(SCc2ccc(C(C)=O)cc2)nnc1[C@H](CC)N(C)C	ZINC000450596181	FJ	On-Demand	Anodyne	AGTR1	15	40
CC(C)(C)c1nnc2ccc(NC[C@H]3CCCN3CCCO)nn12	ZINC000450596182	ED	On-Demand	Anodyne	IKBKB	17	45
CC(C)(C)c1nnc2ccc(NC[C@@H]3CCCN3CCCO)nn12	ZINC000450596184	ED	On-Demand	Anodyne	IKBKB	17	45
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2[C@@H](C)c1csnn1	ZINC000450596196	ED	On-Demand	Anodyne	SLC6A1	63	35
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2[C@H](C)c1csnn1	ZINC000450596201	ED	On-Demand	Anodyne	SLC6A1	63	35
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2[C@H](C)c1csnn1	ZINC000450596203	ED	On-Demand	Anodyne	SLC6A1	63	35
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2[C@@H](C)c1csnn1	ZINC000450596205	ED	On-Demand	Anodyne	SLC6A1	63	35
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450596206	EC	On-Demand	Anodyne	TGM2	20	43
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450596206	EC	On-Demand	Anodyne	GCK	51	35
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450596206	EC	On-Demand	Anodyne	GCKR	43	35
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450596211	EC	On-Demand	Anodyne	TGM2	20	43
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450596211	EC	On-Demand	Anodyne	GCK	51	35
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450596211	EC	On-Demand	Anodyne	GCKR	43	35
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	DRD4	24	41
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	SLC6A3	16	43
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	LTA4H	15	61
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	HRH3	19	45
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	SIGMAR1	25	45
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	CCR5	16	45
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	EPHX2	19	43
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	CACNA1G	55	55
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	CACNA1I	66	37
CCOC(=O)CNC(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450596235	FE	On-Demand	Anodyne	GPBAR1	17	40
Cc1cc(CNC(=O)c2nn(C)c3c2CCCC3)ccc1Cl	ZINC000450596251	DG	On-Demand	Anodyne	CNR1	51	32
Cc1cc(CNC(=O)c2nn(C)c3c2CCCC3)ccc1Cl	ZINC000450596251	DG	On-Demand	Anodyne	CNR2	18	48
Cc1cc(CNC(=O)c2nn(C)c3c2CCCC3)ccc1Cl	ZINC000450596251	DG	On-Demand	Anodyne	P2RX7	24	40
Cc1cc(CNC(=O)c2nn(C)c3c2CCCC3)ccc1Cl	ZINC000450596251	DG	On-Demand	Anodyne	RPA1	41	35
O=C(c1cnc(N2CC[C@@H](F)C2)c(Cl)c1)N1CCOCC1	ZINC000450596268	DD	On-Demand	Anodyne	CXCR3	32	41
O=C(c1cnc(N2CC[C@@H](F)C2)c(Cl)c1)N1CCOCC1	ZINC000450596268	DD	On-Demand	Anodyne	AKR1C3	24	40
O=C(c1cnc(N2CC[C@H](F)C2)c(Cl)c1)N1CCOCC1	ZINC000450596270	DD	On-Demand	Anodyne	CXCR3	32	41
O=C(c1cnc(N2CC[C@H](F)C2)c(Cl)c1)N1CCOCC1	ZINC000450596270	DD	On-Demand	Anodyne	AKR1C3	24	40
CC(=O)CCCCCN1C(=O)C(=O)N(C2CCCC2)C1=O	ZINC000450596271	CD	On-Demand	Anodyne	CACNA1D	21	40
CCN1CCN(C(=O)c2ccc(-n3nnnc3C)cc2F)CC1=O	ZINC000450596273	EC	On-Demand	Anodyne	P2RX7	0	45
Cn1nc(C(=O)Nc2ccc(F)cc2NS(C)(=O)=O)c2c1CCCC2	ZINC000450596330	FE	On-Demand	Anodyne	PLA2G7	26	40
N#Cc1ccc(N2CC[C@@H](F)C2)cc1C(F)(F)F	ZINC000450596362	CG	On-Demand	Mild	AR	30	51
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450596363	FC	On-Demand	Anodyne	PDE8B	47	33
N#Cc1ccc(N2CC[C@H](F)C2)cc1C(F)(F)F	ZINC000450596364	CG	On-Demand	Mild	AR	30	51
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450596366	FC	On-Demand	Anodyne	PDE8B	47	33
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450596369	FC	On-Demand	Anodyne	PDE8B	47	33
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450596371	FC	On-Demand	Anodyne	PDE8B	47	33
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450596394	GD	On-Demand	Anodyne	CTSK	40	38
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450596394	GD	On-Demand	Anodyne	CAPN1	43	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450596394	GD	On-Demand	Anodyne	CAPN2	70	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450596394	GD	On-Demand	Anodyne	NPR	67	37
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450596394	GD	On-Demand	Anodyne	F2RL1	50	35
CCN1C(=O)CCc2cc(NC(=O)c3scnc3C(C)C)ccc21	ZINC000450596398	EH	On-Demand	Anodyne	NAMPT	0	42
Cn1ncc2c(NC(CF)CF)ncnc21	ZINC000450596404	BD	On-Demand	Anodyne	SRC	0	41
Cc1nccc(N2CCN(C(=O)c3cccc(C#N)c3Br)CC2)n1	ZINC000450596411	GE	On-Demand	Mild	SORD	45	35
COc1cc(CC(=O)NC(C)(C)CS(C)(=O)=O)ccc1Cl	ZINC000450596413	ED	On-Demand	Anodyne	TRPV1	22	43
COc1cc(CC(=O)NC(C)(C)CS(C)(=O)=O)ccc1Cl	ZINC000450596413	ED	On-Demand	Anodyne	NCE103	28	44
COc1cc(CC(=O)NC(C)(C)CS(C)(=O)=O)ccc1Cl	ZINC000450596413	ED	On-Demand	Anodyne	CAN2	0	44
O=C([C@@H](O)C1CCC1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450596414	EH	On-Demand	Anodyne	CCR1	42	39
O=C([C@@H](O)C1CCC1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450596414	EH	On-Demand	Anodyne	EPHX2	19	44
O=C([C@@H](O)C1CCC1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450596414	EH	On-Demand	Anodyne	TRPM8	47	38
O=C([C@H](O)C1CCC1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450596415	EH	On-Demand	Anodyne	CCR1	42	39
O=C([C@H](O)C1CCC1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450596415	EH	On-Demand	Anodyne	EPHX2	19	44
O=C([C@H](O)C1CCC1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450596415	EH	On-Demand	Anodyne	TRPM8	47	38
CCOC(=O)c1cc(C(=O)N2CCN(c3ccnc(C)n3)CC2)on1	ZINC000450596417	EC	On-Demand	Anodyne	GYRB	0	44
CCOC(=O)c1cc(C(=O)N2CCN(c3ccnc(C)n3)CC2)on1	ZINC000450596417	EC	On-Demand	Anodyne	P2RY12	62	37
CCOC(=O)c1cc(C(=O)N2CCN(c3ccnc(C)n3)CC2)on1	ZINC000450596417	EC	On-Demand	Anodyne	SORD	50	39
Cc1ccccc1CCN(C)c1ccnc(N2CCOCC2)n1	ZINC000450596421	DE	On-Demand	Anodyne	EPHB4	79	42
CNC(=O)c1ccc(N(C)CCc2ccccc2C)c([N+](=O)[O-])c1	ZINC000450596434	EF	On-Demand	Bother	COLA	59	34
Cc1ccccc1CCN(C)c1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450596436	FG	On-Demand	Anodyne	P2RY12	17	41
Cc1ccccc1CCN(C)c1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450596436	FG	On-Demand	Anodyne	LRRK2	18	41
Cc1sccc1C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450596442	GJ	On-Demand	Anodyne	HRH1	25	42
Cc1sccc1C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450596442	GJ	On-Demand	Anodyne	PRSS2	47	33
Cc1sccc1C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450596442	GJ	On-Demand	Anodyne	CCR3	20	42
Cc1sccc1C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450596442	GJ	On-Demand	Anodyne	L3MBTL1	0	40
CCOC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)nc1	ZINC000450596446	ED	On-Demand	Anodyne	SSTR5	46	38
CCOC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)nc1	ZINC000450596447	ED	On-Demand	Anodyne	SSTR5	46	38
Cc1ccc(C(=O)Nc2ccc(F)cc2NS(C)(=O)=O)c2c1CCC2	ZINC000450596476	FG	On-Demand	Anodyne	PLA2G7	38	44
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596477	GE	On-Demand	Anodyne	SLC6A1	87	45
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596477	GE	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596477	GE	On-Demand	Anodyne	SLC6A3	54	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596481	GE	On-Demand	Anodyne	SLC6A1	87	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596481	GE	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596481	GE	On-Demand	Anodyne	SLC6A3	54	47
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596482	GE	On-Demand	Anodyne	SLC6A1	87	45
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596482	GE	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccn(CCc2ccccc2)n1	ZINC000450596482	GE	On-Demand	Anodyne	SLC6A3	54	47
C[C@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450596515	EI	On-Demand	Anodyne	NAMPT	29	42
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450596516	EI	On-Demand	Anodyne	NAMPT	29	42
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450596517	EI	On-Demand	Anodyne	NAMPT	29	42
CN1CCN(CC2(C)CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)CC1	ZINC000450596519	GH	On-Demand	Anodyne	ADAM10	44	39
CCc1cc(CCCN2CCC[C@@H](Nc3ccccc3)C2)on1	ZINC000450596527	DH	On-Demand	Anodyne	SIGMAR1	15	41
CCc1cc(CCCN2CCC[C@H](Nc3ccccc3)C2)on1	ZINC000450596528	DH	On-Demand	Anodyne	SIGMAR1	15	41
CCC(=O)CCCN1CCCC[C@H]1c1nc2ccccc2o1	ZINC000450596531	DI	On-Demand	Anodyne	COLA	80	35
CCC(=O)CCCN1CCCC[C@H]1c1nc2ccccc2o1	ZINC000450596531	DI	On-Demand	Anodyne	CPT1A	78	35
CCC(=O)CCCN1CCCC[C@H]1c1nc2ccccc2o1	ZINC000450596531	DI	On-Demand	Anodyne	Q7YY07_CRYPV	61	34
CCC(=O)CCCN1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000450596532	DI	On-Demand	Anodyne	COLA	80	35
CCC(=O)CCCN1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000450596532	DI	On-Demand	Anodyne	CPT1A	78	35
CCC(=O)CCCN1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000450596532	DI	On-Demand	Anodyne	Q7YY07_CRYPV	61	34
COC1CCC(CCNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450596534	EI	On-Demand	Anodyne	SLC6A1	19	40
COC1CCC(CCNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450596535	EI	On-Demand	Anodyne	SLC6A1	19	40
COC1CCC(CCNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450596536	EI	On-Demand	Anodyne	SLC6A1	19	40
COC1CCC(CCNC(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450596537	EI	On-Demand	Anodyne	SLC6A1	19	40
COC1CCC(CCNC(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450596538	FF	On-Demand	Anodyne	THYX_PBCV1	0	40
CC(C)(CC(=O)COc1cccc(C#N)c1)C1CC1	ZINC000450596543	CG	On-Demand	Mild	PLA2G4B	37	40
CC(C)(CC(=O)COc1cccc(C#N)c1)C1CC1	ZINC000450596543	CG	On-Demand	Mild	CHRNA10	44	46
FC(F)(F)Cn1ccc(CSc2nc3cc(Br)cnc3[nH]2)n1	ZINC000450596549	GH	On-Demand	Anodyne	ENPP1	16	41
COC(=O)c1ccc(CC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)cc1	ZINC000450596573	GD	On-Demand	Anodyne	KCNJ1	42	33
CCOC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)nc1	ZINC000450596581	EG	On-Demand	Anodyne	SLC6A1	77	32
CCOC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)nc1	ZINC000450596581	EG	On-Demand	Anodyne	P2RY12	71	47
CCOC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)nc1	ZINC000450596581	EG	On-Demand	Anodyne	LTA4H	26	42
CCOC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)nc1	ZINC000450596581	EG	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)nc1	ZINC000450596582	EG	On-Demand	Anodyne	SLC6A1	77	32
CCOC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)nc1	ZINC000450596582	EG	On-Demand	Anodyne	P2RY12	71	47
CCOC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)nc1	ZINC000450596582	EG	On-Demand	Anodyne	LTA4H	26	42
CCOC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)nc1	ZINC000450596582	EG	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)CNC(=O)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450596617	FD	On-Demand	Anodyne	CACNA1G	40	41
CCOC(=O)CNC(=O)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450596619	FD	On-Demand	Anodyne	CACNA1G	40	41
CCOC(=O)CNC(=O)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450596621	FD	On-Demand	Anodyne	CACNA1G	40	41
CCOC(=O)CNC(=O)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450596623	FD	On-Demand	Anodyne	CACNA1G	40	41
CCOC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596643	GE	On-Demand	Anodyne	AVPR1B	44	39
CCOC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596643	GE	On-Demand	Anodyne	PDE6D	84	43
CCOC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596643	GE	On-Demand	Anodyne	HDAC8	24	40
CCOC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596643	GE	On-Demand	Anodyne	HDAC6	18	40
CCOC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596643	GE	On-Demand	Anodyne	PTGDR2	15	41
CCOC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596643	GE	On-Demand	Anodyne	IMDH_CRYPV	35	52
CCOC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596646	GE	On-Demand	Anodyne	AVPR1B	44	39
CCOC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596646	GE	On-Demand	Anodyne	PDE6D	84	43
CCOC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596646	GE	On-Demand	Anodyne	HDAC8	24	40
CCOC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596646	GE	On-Demand	Anodyne	HDAC6	18	40
CCOC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596646	GE	On-Demand	Anodyne	PTGDR2	15	41
CCOC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450596646	GE	On-Demand	Anodyne	IMDH_CRYPV	35	52
CCOC(=O)CNC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450596651	FE	On-Demand	Anodyne	SIGMAR1	18	44
CCOC(=O)CNC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450596651	FE	On-Demand	Anodyne	EPHX2	18	41
CCOC(=O)CNC(=O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450596651	FE	On-Demand	Anodyne	CACNA1G	47	55
COc1ccc(CNC(=O)CCN(C)Cc2cccc(N(C)C)c2)c(OC)c1	ZINC000450596654	GF	On-Demand	Anodyne	ACHE	0	46
COc1ccc(CNC(=O)CCN(C)Cc2cccc(N(C)C)c2)c(OC)c1	ZINC000450596654	GF	On-Demand	Anodyne	MTNR1A	75	41
COc1ccc(CNC(=O)CCN(C)Cc2cccc(N(C)C)c2)c(OC)c1	ZINC000450596654	GF	On-Demand	Anodyne	MTNR1B	71	41
COc1ccc(CNC(=O)CCN(C)Cc2cccc(N(C)C)c2)c(OC)c1	ZINC000450596654	GF	On-Demand	Anodyne	HCRTR2	15	41
CCOC(=O)c1ccc(CSc2nnc(Cc3ccccc3)n2CC)nc1	ZINC000450596656	GH	On-Demand	Anodyne	SLC27A1	51	50
O=[N+]([O-])c1ccc(-c2csc(NC[C@@H]3CCCN3CCCO)n2)cc1	ZINC000450596687	FE	On-Demand	Bother	MAOB	16	49
O=[N+]([O-])c1ccc(-c2csc(NC[C@@H]3CCCN3CCCO)n2)cc1	ZINC000450596687	FE	On-Demand	Bother	SPHK2	69	43
O=[N+]([O-])c1ccc(-c2csc(NC[C@@H]3CCCN3CCCO)n2)cc1	ZINC000450596687	FE	On-Demand	Bother	SPHK1	61	43
O=[N+]([O-])c1ccc(-c2csc(NC[C@H]3CCCN3CCCO)n2)cc1	ZINC000450596690	FE	On-Demand	Bother	MAOB	16	49
O=[N+]([O-])c1ccc(-c2csc(NC[C@H]3CCCN3CCCO)n2)cc1	ZINC000450596690	FE	On-Demand	Bother	SPHK2	69	43
O=[N+]([O-])c1ccc(-c2csc(NC[C@H]3CCCN3CCCO)n2)cc1	ZINC000450596690	FE	On-Demand	Bother	SPHK1	61	43
C(=C\c1ccccc1)\CCN1CCC[C@H](c2nncn2C2CC2)C1	ZINC000450596720	DH	On-Demand	Anodyne	SLC6A1	59	37
C(=C/c1ccccc1)\CCN1CCC[C@@H](c2nncn2C2CC2)C1	ZINC000450596722	DH	On-Demand	Anodyne	SLC6A1	59	37
C(=C/c1ccccc1)\CCN1CCC[C@H](c2nncn2C2CC2)C1	ZINC000450596724	DH	On-Demand	Anodyne	SLC6A1	59	37
C(=C\c1ccccc1)\CCN1CCC[C@@H](c2nncn2C2CC2)C1	ZINC000450596726	DH	On-Demand	Anodyne	SLC6A1	59	37
CC(C)CCCC(=O)Nc1cccc(-n2cnnc2O)c1	ZINC000450596732	CF	On-Demand	Anodyne	HDAC3	41	40
CC(C)CCCC(=O)Nc1cccc(-n2cnnc2O)c1	ZINC000450596732	CF	On-Demand	Anodyne	HDAC6	33	40
NS(=O)(=O)c1ccc(NC[C@H]2CCCN2CCCO)c(C(F)(F)F)c1	ZINC000450596748	GD	On-Demand	Anodyne	SFRP1	90	35
NS(=O)(=O)c1ccc(NC[C@H]2CCCN2CCCO)c(C(F)(F)F)c1	ZINC000450596748	GD	On-Demand	Anodyne	WNT3	71	35
NS(=O)(=O)c1ccc(NC[C@@H]2CCCN2CCCO)c(C(F)(F)F)c1	ZINC000450596750	GD	On-Demand	Anodyne	SFRP1	90	35
NS(=O)(=O)c1ccc(NC[C@@H]2CCCN2CCCO)c(C(F)(F)F)c1	ZINC000450596750	GD	On-Demand	Anodyne	WNT3	71	35
CN1CCC[C@H](C(=O)Nc2ccc(Br)c3ccccc23)C1=O	ZINC000450596768	FG	On-Demand	Anodyne	CCR8	62	35
CN1CCC[C@@H](C(=O)Nc2ccc(Br)c3ccccc23)C1=O	ZINC000450596769	FG	On-Demand	Anodyne	CCR8	62	35
CN(CCc1ccc(Cl)cc1)C1CCC(CO)CC1	ZINC000450596775	CG	On-Demand	Anodyne	C5AR1	24	43
CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1CC(O)C1	ZINC000450596779	DD	On-Demand	Bother	CACNA1D	47	33
CCOc1nc2ccc(C(=O)N3CCN(CC)C(=O)C3)cc2[nH]1	ZINC000450596789	DD	On-Demand	Anodyne	PLA2G2A	0	42
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NC(CF)CF	ZINC000450596822	GF	On-Demand	Bother	BCL2L1	98	35
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NC(CF)CF	ZINC000450596822	GF	On-Demand	Bother	BCL2	82	38
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NC(CF)CF	ZINC000450596822	GF	On-Demand	Bother	BCL2L2	44	31
COC(=O)[C@@H](NCCCNc1ccc2nnc(-c3ccccc3)n2n1)C(C)C	ZINC000450596882	GD	On-Demand	Anodyne	LRRK2	35	41
Cc1cnc([C@H](C)CNC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450596883	EG	On-Demand	Anodyne	CTSV	45	34
Cc1cnc([C@@H](C)CNC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450596885	EG	On-Demand	Anodyne	CTSV	45	34
Cc1nccc(N2CCN(C(=O)c3ccc4c(c3)OC(F)(F)O4)CC2)n1	ZINC000450596895	FE	On-Demand	Anodyne	SORD	57	39
Cc1nccc(N2CCN(C(=O)c3ccc4c(c3)OC(F)(F)O4)CC2)n1	ZINC000450596895	FE	On-Demand	Anodyne	SLC6A7	0	41
Cc1cc(N2CC[C@@H](F)C2)c2ccccc2n1	ZINC000450596905	BG	On-Demand	Anodyne	HTR1D	56	39
Cc1cc(N2CC[C@@H](F)C2)c2ccccc2n1	ZINC000450596905	BG	On-Demand	Anodyne	HTR1B	50	39
Cc1cc(N2CC[C@@H](F)C2)c2ccccc2n1	ZINC000450596905	BG	On-Demand	Anodyne	METAP1	41	35
Cc1cc(N2CC[C@H](F)C2)c2ccccc2n1	ZINC000450596911	BG	On-Demand	Anodyne	HTR1D	56	39
Cc1cc(N2CC[C@H](F)C2)c2ccccc2n1	ZINC000450596911	BG	On-Demand	Anodyne	HTR1B	50	39
Cc1cc(N2CC[C@H](F)C2)c2ccccc2n1	ZINC000450596911	BG	On-Demand	Anodyne	METAP1	41	35
Cc1nccc(N2CCN(C(=O)c3cc(-c4ccccc4)nn3C)CC2)n1	ZINC000450596913	FE	On-Demand	Anodyne	SORD	70	42
Cc1nccc(N2CCN(C(=O)c3cc(-c4ccccc4)nn3C)CC2)n1	ZINC000450596913	FE	On-Demand	Anodyne	SLC6A7	0	44
O=C(CCCN1CCOCC12CCC2)c1ccccc1	ZINC000450596942	CF	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1CCOCC12CCC2)c1ccccc1	ZINC000450596942	CF	On-Demand	Anodyne	CYP2J2	52	37
COC[C@]1(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)CCOC1	ZINC000450596946	GF	On-Demand	Anodyne	PRSS2	64	32
COC[C@@]1(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)CCOC1	ZINC000450596948	GF	On-Demand	Anodyne	PRSS2	64	32
Cc1ccnc(-c2noc(CN(Cc3ccccc3[N+](=O)[O-])C3CC3)n2)c1	ZINC000450596959	FH	On-Demand	Bother	COLA	47	31
C[C@H](CN1CCC[C@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596960	DG	On-Demand	Anodyne	SLC18A2	39	43
C[C@H](CN1CCC[C@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596960	DG	On-Demand	Anodyne	CCR5	16	41
C[C@H](CN1CCC[C@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596960	DG	On-Demand	Anodyne	BIRC2	41	37
C[C@@H](CN1CCC[C@@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596961	DG	On-Demand	Anodyne	SLC18A2	39	43
C[C@@H](CN1CCC[C@@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596961	DG	On-Demand	Anodyne	CCR5	16	41
C[C@@H](CN1CCC[C@@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596961	DG	On-Demand	Anodyne	BIRC2	41	37
C[C@H](CN1CCC[C@@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596962	DG	On-Demand	Anodyne	SLC18A2	39	43
C[C@H](CN1CCC[C@@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596962	DG	On-Demand	Anodyne	CCR5	16	41
C[C@H](CN1CCC[C@@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596962	DG	On-Demand	Anodyne	BIRC2	41	37
C[C@@H](CN1CCC[C@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596963	DG	On-Demand	Anodyne	SLC18A2	39	43
C[C@@H](CN1CCC[C@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596963	DG	On-Demand	Anodyne	CCR5	16	41
C[C@@H](CN1CCC[C@H](CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450596963	DG	On-Demand	Anodyne	BIRC2	41	37
C[C@H](c1ccccc1)[C@H](O)CN(CCO)C1CCCCC1	ZINC000450596964	CF	On-Demand	Anodyne	AMY2	44	31
C[C@@H](c1ccccc1)[C@H](O)CN(CCO)C1CCCCC1	ZINC000450596965	CF	On-Demand	Anodyne	AMY2	44	31
C[C@H](c1ccccc1)[C@@H](O)CN(CCO)C1CCCCC1	ZINC000450596966	CF	On-Demand	Anodyne	AMY2	44	31
C[C@@H](c1ccccc1)[C@@H](O)CN(CCO)C1CCCCC1	ZINC000450596967	CF	On-Demand	Anodyne	AMY2	44	31
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	HTR1A	33	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	THRA	0	44
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	CHRM1	23	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	DRD2	43	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	DRD1	22	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	ADRA1D	22	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	HTR2A	26	50
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	HTR2C	25	53
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	SLC6A1	53	35
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	ADRA1A	23	40
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	HRH1	32	44
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	DRD3	35	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	SLC6A3	24	44
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	HTR4	51	38
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	CHRM4	28	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	CHRM5	32	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	ADRA2B	0	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	CHRM3	25	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	HTR7	51	50
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	SIGMAR1	30	45
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	SLC18A3	22	40
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	ABCB1	22	52
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596970	DD	On-Demand	Anodyne	CYP2J2	72	51
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	HTR1A	33	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	THRA	0	44
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	CHRM1	23	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	DRD2	43	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	DRD1	22	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	ADRA1D	22	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	HTR2A	26	50
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	HTR2C	25	53
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	SLC6A1	53	35
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	ADRA1A	23	40
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	HRH1	32	44
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	DRD3	35	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	SLC6A3	24	44
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	HTR4	51	38
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	CHRM4	28	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	CHRM5	32	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	ADRA2B	0	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	CHRM3	25	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	HTR7	51	50
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	SIGMAR1	30	45
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	SLC18A3	22	40
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	ABCB1	22	52
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450596971	DD	On-Demand	Anodyne	CYP2J2	72	51
COC(=O)c1coc(CN2CCC[C@H](CCCc3ccccc3)C2)n1	ZINC000450596976	EH	On-Demand	Anodyne	PREP	46	34
COC(=O)c1coc(CN2CCC[C@H](CCCc3ccccc3)C2)n1	ZINC000450596976	EH	On-Demand	Anodyne	FAAH	25	48
COC(=O)c1coc(CN2CCC[C@@H](CCCc3ccccc3)C2)n1	ZINC000450596977	EH	On-Demand	Anodyne	PREP	46	34
COC(=O)c1coc(CN2CCC[C@@H](CCCc3ccccc3)C2)n1	ZINC000450596977	EH	On-Demand	Anodyne	FAAH	25	48
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450596982	DC	On-Demand	Anodyne	SLC6A1	51	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450596982	DC	On-Demand	Anodyne	SLC6A4	16	43
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450596982	DC	On-Demand	Anodyne	SLC6A3	33	43
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450596982	DC	On-Demand	Anodyne	PPM1B	0	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450596982	DC	On-Demand	Anodyne	PPP1CC	0	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450596982	DC	On-Demand	Anodyne	Q8AWE3_CHICK	25	41
OCCCN1CCC[C@H]1CNc1ccc2ccc(Cl)cc2n1	ZINC000450597016	DF	On-Demand	Anodyne	HNMT	42	33
OCCCN1CCC[C@@H]1CNc1ccc2ccc(Cl)cc2n1	ZINC000450597017	DF	On-Demand	Anodyne	HNMT	42	33
C[C@H]1CC[C@@H](C(=O)N[C@H](CCNC(=O)[C@H]2CC[C@@H](C)O2)c2ccccc2)O1	ZINC000450597023	FE	On-Demand	Anodyne	CCR5	27	42
C[C@H]1CC[C@@H](C(=O)N[C@@H](CCNC(=O)[C@H]2CC[C@@H](C)O2)c2ccccc2)O1	ZINC000450597024	FE	On-Demand	Anodyne	CCR5	27	42
Cc1nnc2c3ccccc3c(NC[C@@H]3CCCN3CCCO)nn12	ZINC000450597058	ED	On-Demand	Anodyne	CREBBP	41	31
Cc1nnc2c3ccccc3c(NC[C@@H]3CCCN3CCCO)nn12	ZINC000450597058	ED	On-Demand	Anodyne	BRD9	51	32
Cc1cc(C)nc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)n1	ZINC000450597060	EE	On-Demand	Anodyne	SORD	49	48
Cc1nnc2c3ccccc3c(NC[C@H]3CCCN3CCCO)nn12	ZINC000450597061	ED	On-Demand	Anodyne	CREBBP	41	31
Cc1nnc2c3ccccc3c(NC[C@H]3CCCN3CCCO)nn12	ZINC000450597061	ED	On-Demand	Anodyne	BRD9	51	32
Cc1cc(NC[C@@H]2CCCN2CCCO)nc(-c2cccnc2)n1	ZINC000450597063	ED	On-Demand	Anodyne	ROS1	63	42
Cc1cc(NC[C@H]2CCCN2CCCO)nc(-c2cccnc2)n1	ZINC000450597064	ED	On-Demand	Anodyne	ROS1	63	42
Cc1cc(C)nc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)n1	ZINC000450597065	EE	On-Demand	Anodyne	SORD	49	48
Cc1cc(C)nc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)n1	ZINC000450597067	EE	On-Demand	Anodyne	SORD	49	48
Cc1cc(C)nc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)n1	ZINC000450597070	EE	On-Demand	Anodyne	SORD	49	48
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450597083	ED	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450597085	ED	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450597087	ED	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450597089	ED	On-Demand	Anodyne	FKBP12.6	0	42
CCS(=O)(=O)c1ccc(CN2C(=O)C(=O)N(C3CCCC3)C2=O)cc1	ZINC000450597097	FD	On-Demand	Anodyne	CACNA1D	40	38
COC(=O)c1cn(C2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)nn1	ZINC000450597099	GG	On-Demand	Anodyne	NPBWR1	51	32
COC[C@@](C)(O)CCNc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450597123	ED	On-Demand	Anodyne	PIM1	15	60
COC[C@@](C)(O)CCNc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450597123	ED	On-Demand	Anodyne	LRRK2	27	41
COC[C@](C)(O)CCNc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450597126	ED	On-Demand	Anodyne	PIM1	15	60
COC[C@](C)(O)CCNc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450597126	ED	On-Demand	Anodyne	LRRK2	27	41
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450597134	GE	On-Demand	Anodyne	SCN9A	27	41
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450597141	GE	On-Demand	Anodyne	SCN9A	27	41
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450597144	GE	On-Demand	Anodyne	SCN9A	27	41
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450597146	GE	On-Demand	Anodyne	SCN9A	27	41
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	HTR1A	41	40
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	DRD2	49	44
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	TSHR	50	34
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	HTR2A	15	44
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	SLC6A1	94	36
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	DRD3	49	39
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	PDGFRB	41	38
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	TACR1	15	44
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	HTR7	48	46
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	HRH3	15	40
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	SIGMAR1	29	48
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	CCR3	24	44
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	MTNR1B	65	38
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	BIRC2	47	40
COc1ccc(CNC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597153	GG	On-Demand	Anodyne	ACKR3	61	35
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	HTR1A	41	40
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	DRD2	49	44
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	TSHR	50	34
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	HTR2A	15	44
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	SLC6A1	94	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	DRD3	49	39
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	PDGFRB	41	38
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	TACR1	15	44
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	HTR7	48	46
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	HRH3	15	40
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	SIGMAR1	29	48
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	CCR3	24	44
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	MTNR1B	65	38
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	BIRC2	47	40
COc1ccc(CNC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c(OC)c1	ZINC000450597154	GG	On-Demand	Anodyne	ACKR3	61	35
COC[C@@](C)(O)CCNc1ccc(C(=O)NC2CCCC2)nn1	ZINC000450597173	DC	On-Demand	Anodyne	CNR2	17	40
COC[C@](C)(O)CCNc1ccc(C(=O)NC2CCCC2)nn1	ZINC000450597179	DC	On-Demand	Anodyne	CNR2	17	40
Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCCN2CCCO)n1	ZINC000450597188	CD	On-Demand	Bother	PRKCQ	44	34
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCCN2CCCO)n1	ZINC000450597189	CD	On-Demand	Bother	PRKCQ	44	34
Cc1c([N+](=O)[O-])cnc(NC[C@H]2CCCN2CCCO)c1Br	ZINC000450597194	FD	On-Demand	Bother	PRKCQ	45	36
Cc1c([N+](=O)[O-])cnc(NC[C@@H]2CCCN2CCCO)c1Br	ZINC000450597210	FD	On-Demand	Bother	PRKCQ	45	36
COc1nccc(CNc2ncnc3c2ncn3C2CC2)n1	ZINC000450597219	CD	On-Demand	Anodyne	ADORA1	40	38
COc1nccc(CNc2ncnc3c2ncn3C2CC2)n1	ZINC000450597219	CD	On-Demand	Anodyne	ADORA2A	16	41
COc1nccc(CNc2ncnc3c2ncn3C2CC2)n1	ZINC000450597219	CD	On-Demand	Anodyne	ADORA3	47	40
CC(=O)c1ccc(CN2CCO[C@@H](CN3C(=O)c4ccccc4C3=O)C2)cc1	ZINC000450597254	GE	On-Demand	Anodyne	DRD4	27	49
CC(=O)c1ccc(CN2CCO[C@H](CN3C(=O)c4ccccc4C3=O)C2)cc1	ZINC000450597255	GE	On-Demand	Anodyne	DRD4	27	49
CCC(=O)CCCN1CCC[C@H](Nc2cc(OC)cc(OC)c2)C1	ZINC000450597256	EG	On-Demand	Anodyne	SLC6A1	58	33
CCC(=O)CCCN1CCC[C@H](Nc2cc(OC)cc(OC)c2)C1	ZINC000450597256	EG	On-Demand	Anodyne	CCR3	22	42
CCC(=O)CCCN1CCC[C@H](Nc2cc(OC)cc(OC)c2)C1	ZINC000450597256	EG	On-Demand	Anodyne	BIRC2	42	39
CCC(=O)CCCN1CCC[C@@H](Nc2cc(OC)cc(OC)c2)C1	ZINC000450597257	EG	On-Demand	Anodyne	SLC6A1	58	33
CCC(=O)CCCN1CCC[C@@H](Nc2cc(OC)cc(OC)c2)C1	ZINC000450597257	EG	On-Demand	Anodyne	CCR3	22	42
CCC(=O)CCCN1CCC[C@@H](Nc2cc(OC)cc(OC)c2)C1	ZINC000450597257	EG	On-Demand	Anodyne	BIRC2	42	39
COC1CCC(CCNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450597271	GI	On-Demand	Anodyne	SLC6A1	63	42
COC1CCC(CCNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450597271	GI	On-Demand	Anodyne	SLC6A4	18	44
COC1CCC(CCNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450597271	GI	On-Demand	Anodyne	SLC6A3	32	44
CCN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1=O	ZINC000450597290	FD	On-Demand	Mild	HTR1B	17	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597297	DC	On-Demand	Anodyne	SLC6A1	51	39
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597297	DC	On-Demand	Anodyne	SLC6A4	16	43
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597297	DC	On-Demand	Anodyne	SLC6A3	33	43
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597297	DC	On-Demand	Anodyne	PPM1B	0	41
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597297	DC	On-Demand	Anodyne	PPP1CC	0	41
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597297	DC	On-Demand	Anodyne	Q8AWE3_CHICK	25	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597303	DC	On-Demand	Anodyne	SLC6A1	51	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597303	DC	On-Demand	Anodyne	SLC6A4	16	43
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597303	DC	On-Demand	Anodyne	SLC6A3	33	43
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597303	DC	On-Demand	Anodyne	PPM1B	0	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597303	DC	On-Demand	Anodyne	PPP1CC	0	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450597303	DC	On-Demand	Anodyne	Q8AWE3_CHICK	25	41
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450597306	DC	On-Demand	Anodyne	SLC6A1	51	39
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450597306	DC	On-Demand	Anodyne	SLC6A4	16	43
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450597306	DC	On-Demand	Anodyne	SLC6A3	33	43
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450597306	DC	On-Demand	Anodyne	PPM1B	0	41
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450597306	DC	On-Demand	Anodyne	PPP1CC	0	41
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450597306	DC	On-Demand	Anodyne	Q8AWE3_CHICK	25	41
COC(=O)[C@@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597314	GC	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597314	GC	On-Demand	Anodyne	HTR4	50	37
COC(=O)[C@@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597314	GC	On-Demand	Anodyne	HTR7	33	42
COC(=O)[C@@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597314	GC	On-Demand	Anodyne	MTNR1A	70	40
COC(=O)[C@@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597314	GC	On-Demand	Anodyne	MTNR1B	59	40
COC(=O)[C@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597315	GC	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597315	GC	On-Demand	Anodyne	HTR4	50	37
COC(=O)[C@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597315	GC	On-Demand	Anodyne	HTR7	33	42
COC(=O)[C@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597315	GC	On-Demand	Anodyne	MTNR1A	70	40
COC(=O)[C@H](O)C1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450597315	GC	On-Demand	Anodyne	MTNR1B	59	40
Cc1cc(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)ccc1Cl	ZINC000450597320	CG	On-Demand	Anodyne	P2RX7	51	33
COC(=O)c1cccc(CN2CCC([C@H](O)C(=O)OC)CC2)c1Cl	ZINC000450597321	FD	On-Demand	Anodyne	DRD4	15	41
COC(=O)c1cccc(CN2CCC([C@@H](O)C(=O)OC)CC2)c1Cl	ZINC000450597322	FD	On-Demand	Anodyne	DRD4	15	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597342	FD	On-Demand	Anodyne	ACE	65	36
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597342	FD	On-Demand	Anodyne	SLC6A1	125	46
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597342	FD	On-Demand	Anodyne	SLC6A4	34	46
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597342	FD	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597342	FD	On-Demand	Anodyne	MME	80	36
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597342	FD	On-Demand	Anodyne	TIMP3	44	37
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597344	FD	On-Demand	Anodyne	ACE	65	36
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597344	FD	On-Demand	Anodyne	SLC6A1	125	46
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597344	FD	On-Demand	Anodyne	SLC6A4	34	46
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597344	FD	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597344	FD	On-Demand	Anodyne	MME	80	36
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597344	FD	On-Demand	Anodyne	TIMP3	44	37
CO[C@H](Cc1ccccc1)C(=O)N1CCc2c(Br)ccc(F)c2C1	ZINC000450597345	GH	On-Demand	Anodyne	AMP1_PLAFQ	15	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCc2c(Br)ccc(F)c2C1	ZINC000450597346	GH	On-Demand	Anodyne	AMP1_PLAFQ	15	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597347	FD	On-Demand	Anodyne	ACE	65	36
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597347	FD	On-Demand	Anodyne	SLC6A1	125	46
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597347	FD	On-Demand	Anodyne	SLC6A4	34	46
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597347	FD	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597347	FD	On-Demand	Anodyne	MME	80	36
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](Cc1ccccc1)OC	ZINC000450597347	FD	On-Demand	Anodyne	TIMP3	44	37
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597349	FD	On-Demand	Anodyne	ACE	65	36
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597349	FD	On-Demand	Anodyne	SLC6A1	125	46
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597349	FD	On-Demand	Anodyne	SLC6A4	34	46
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597349	FD	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597349	FD	On-Demand	Anodyne	MME	80	36
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](Cc1ccccc1)OC	ZINC000450597349	FD	On-Demand	Anodyne	TIMP3	44	37
Cc1nccc(N2CCN(C(=O)[C@]3(OC(C)C)CCOC3)CC2)n1	ZINC000450597376	ED	On-Demand	Anodyne	SORD	40	34
Cc1nccc(N2CCN(C(=O)[C@@]3(OC(C)C)CCOC3)CC2)n1	ZINC000450597385	ED	On-Demand	Anodyne	SORD	40	34
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	THRA	0	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	DRD2	32	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	DRD1	15	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	DRD4	0	51
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	HTR2A	20	49
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	HTR2C	15	50
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	SLC6A1	125	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	SLC6A4	36	51
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	SLC6A3	68	54
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	ERG2	18	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	SLC18A3	16	51
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597387	GE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	THRA	0	40
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	DRD2	32	40
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	DRD1	15	42
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	DRD4	0	51
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	HTR2A	20	49
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	HTR2C	15	50
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	SLC6A1	125	47
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	SLC6A4	36	51
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	SLC6A3	68	54
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	ERG2	18	40
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	SLC18A3	16	51
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597389	GE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	THRA	0	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	DRD2	32	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	DRD1	15	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	DRD4	0	51
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	HTR2A	20	49
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	HTR2C	15	50
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	SLC6A1	125	47
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	SLC6A4	36	51
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	SLC6A3	68	54
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	ERG2	18	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	SLC18A3	16	51
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccc(F)cc1	ZINC000450597391	GE	On-Demand	Anodyne	CYP2J2	49	35
CO[C@H](Cc1ccccc1)CN(CCO)C1CCCCC1	ZINC000450597398	CF	On-Demand	Anodyne	SLC18A2	43	34
CO[C@H](Cc1ccccc1)CN(CCO)C1CCCCC1	ZINC000450597398	CF	On-Demand	Anodyne	AMY2	44	30
CO[C@@H](Cc1ccccc1)CN(CCO)C1CCCCC1	ZINC000450597399	CF	On-Demand	Anodyne	SLC18A2	43	34
CO[C@@H](Cc1ccccc1)CN(CCO)C1CCCCC1	ZINC000450597399	CF	On-Demand	Anodyne	AMY2	44	30
COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C[C@@H]1C	ZINC000450597402	GF	On-Demand	Anodyne	RBP4	90	39
COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C[C@H]1C	ZINC000450597403	GF	On-Demand	Anodyne	RBP4	90	39
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3O[C@H](C)C4)ccc21	ZINC000450597420	FH	On-Demand	Anodyne	MTTP	68	35
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3O[C@H](C)C4)ccc21	ZINC000450597420	FH	On-Demand	Anodyne	NAMPT	29	43
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3O[C@@H](C)C4)ccc21	ZINC000450597423	FH	On-Demand	Anodyne	MTTP	68	35
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3O[C@@H](C)C4)ccc21	ZINC000450597423	FH	On-Demand	Anodyne	NAMPT	29	43
CCCN1C(=O)CCc2cc(NC(=O)CCOc3cccc(OC)c3)ccc21	ZINC000450597449	GH	On-Demand	Anodyne	DRD4	42	32
CCCN1C(=O)CCc2cc(NC(=O)CCOc3cccc(OC)c3)ccc21	ZINC000450597449	GH	On-Demand	Anodyne	MTNR1A	25	46
CCCN1C(=O)CCc2cc(NC(=O)CCOc3cccc(OC)c3)ccc21	ZINC000450597449	GH	On-Demand	Anodyne	MTNR1B	28	47
CCCN1C(=O)CCc2cc(NC(=O)CCOc3cccc(OC)c3)ccc21	ZINC000450597449	GH	On-Demand	Anodyne	BRPF1	0	42
Cc1nccc(N2CCN(C(=O)C(C)(C)C3CCC3)CC2)n1	ZINC000450597476	DE	On-Demand	Anodyne	SORD	62	38
O=[N+]([O-])c1ccccc1CN(C[C@@H]1CCC(F)(F)C1)C1CC1	ZINC000450597481	DH	On-Demand	Bother	COLA	108	35
O=[N+]([O-])c1ccccc1CN(C[C@H]1CCC(F)(F)C1)C1CC1	ZINC000450597482	DH	On-Demand	Bother	COLA	108	35
CC(C)(C)c1cc(CSc2nc3cc(Cl)cnc3[nH]2)no1	ZINC000450597485	DI	On-Demand	Anodyne	ENPP1	23	42
CCOC(=O)CNC(=O)C1CCN(CCC2=CCCCC2)CC1	ZINC000450597488	DE	On-Demand	Anodyne	CACNA1G	33	40
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCCN2CCCO)n1	ZINC000450597489	ED	On-Demand	Bother	PRKCQ	40	33
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCCN2CCCO)n1	ZINC000450597491	ED	On-Demand	Bother	PRKCQ	40	33
CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)C1(C)CCC(=O)CC1	ZINC000450597493	GH	On-Demand	Anodyne	SDH1	0	46
CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)C1(C)CCC(=O)CC1	ZINC000450597496	GH	On-Demand	Anodyne	SDH1	0	46
CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)C1(C)CCC(=O)CC1	ZINC000450597498	GH	On-Demand	Anodyne	SDH1	0	46
CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)C1(C)CCC(=O)CC1	ZINC000450597500	GH	On-Demand	Anodyne	SDH1	0	46
C[C@@H](O)CCN1C(=O)C(=O)N(C2CCCC2)C1=O	ZINC000450597522	CC	On-Demand	Anodyne	CACNA1D	0	44
C[C@H](O)CCN1C(=O)C(=O)N(C2CCCC2)C1=O	ZINC000450597523	CC	On-Demand	Anodyne	CACNA1D	0	44
CCOC(=O)c1cc(C(=O)N2CCN(Cc3ccccc3)[C@@H](CC)C2)on1	ZINC000450597525	FF	On-Demand	Anodyne	P2RY12	42	33
CCOC(=O)c1cc(C(=O)N2CCN(Cc3ccccc3)[C@H](CC)C2)on1	ZINC000450597528	FF	On-Demand	Anodyne	P2RY12	42	33
CC(=O)c1ccc(CSc2nnc([C@H](C)N(C)C)n2-c2ccc(F)cc2)cc1	ZINC000450597548	GJ	On-Demand	Anodyne	PLA2G7	53	34
CC(=O)c1ccc(CSc2nnc([C@@H](C)N(C)C)n2-c2ccc(F)cc2)cc1	ZINC000450597549	GJ	On-Demand	Anodyne	PLA2G7	53	34
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	HTR1A	17	46
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	DRD4	17	44
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	HTR2A	25	49
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	HTR2C	23	52
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	SLC6A1	176	46
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	DRD3	15	49
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	HTR7	19	44
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	SIGMAR1	32	57
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	PREP	16	42
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	HTR3B	0	41
CS[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597558	CH	On-Demand	Anodyne	CYP2J2	65	47
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	HTR1A	17	46
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	DRD4	17	44
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	HTR2A	25	49
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	HTR2C	23	52
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	SLC6A1	176	46
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	DRD3	15	49
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	HTR7	19	44
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	SIGMAR1	32	57
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	PREP	16	42
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	HTR3B	0	41
CS[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450597559	CH	On-Demand	Anodyne	CYP2J2	65	47
OCCCN1CCC[C@@H]1CN=c1[nH]cnc2cc(Cl)ccc12	ZINC000450597560	DD	On-Demand	Anodyne	HNMT	48	34
OCCCN1CCC[C@H]1CN=c1[nH]cnc2cc(Cl)ccc12	ZINC000450597561	DD	On-Demand	Anodyne	HNMT	48	34
CCn1c(Cc2ccccc2)nnc1SCc1cccc(S(C)(=O)=O)c1	ZINC000450597583	GH	On-Demand	Anodyne	SLC27A1	44	36
CCO[C@H]1COCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450597603	EF	On-Demand	Anodyne	CCR2	47	46
CCO[C@H]1COCC[C@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450597609	EF	On-Demand	Anodyne	CCR2	47	46
CCO[C@@H]1COCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450597611	EF	On-Demand	Anodyne	CCR2	47	46
CCO[C@@H]1COCC[C@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450597613	EF	On-Demand	Anodyne	CCR2	47	46
COC(=O)C[C@@H]1CCCN1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450597621	EH	On-Demand	Anodyne	DRD2	47	41
COC(=O)C[C@@H]1CCCN1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450597621	EH	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)C[C@@H]1CCCN1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450597621	EH	On-Demand	Anodyne	LTA4H	15	40
COC(=O)C[C@H]1CCCN1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450597623	EH	On-Demand	Anodyne	DRD2	47	41
COC(=O)C[C@H]1CCCN1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450597623	EH	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)C[C@H]1CCCN1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450597623	EH	On-Demand	Anodyne	LTA4H	15	40
COC(=O)C[C@H]1CCCN1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450597625	EH	On-Demand	Anodyne	DRD2	47	41
COC(=O)C[C@H]1CCCN1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450597625	EH	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)C[C@H]1CCCN1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450597625	EH	On-Demand	Anodyne	LTA4H	15	40
COC(=O)C[C@@H]1CCCN1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450597627	EH	On-Demand	Anodyne	DRD2	47	41
COC(=O)C[C@@H]1CCCN1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450597627	EH	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)C[C@@H]1CCCN1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450597627	EH	On-Demand	Anodyne	LTA4H	15	40
COC[C@@](C)(O)CCNc1ccnc2cc(F)ccc12	ZINC000450597629	CF	On-Demand	Anodyne	HRP1_PLAFA	87	33
COC[C@@](C)(O)CCNc1ccnc2cc(F)ccc12	ZINC000450597629	CF	On-Demand	Anodyne	HNMT	50	35
COC[C@](C)(O)CCNc1ccnc2cc(F)ccc12	ZINC000450597631	CF	On-Demand	Anodyne	HRP1_PLAFA	87	33
COC[C@](C)(O)CCNc1ccnc2cc(F)ccc12	ZINC000450597631	CF	On-Demand	Anodyne	HNMT	50	35
CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450597643	EE	On-Demand	Anodyne	AMY2	48	34
CCOC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450597645	EE	On-Demand	Anodyne	AMY2	48	34
CN(CCN1CCC[C@@H](c2nncn2C2CC2)C1)Cc1ccccc1	ZINC000450597676	EF	On-Demand	Anodyne	SLC6A1	47	32
CN(CCN1CCC[C@H](c2nncn2C2CC2)C1)Cc1ccccc1	ZINC000450597677	EF	On-Demand	Anodyne	SLC6A1	47	32
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450597689	FC	On-Demand	Anodyne	CA2	21	45
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450597689	FC	On-Demand	Anodyne	HPGDS	15	40
Cc1cc(CNC(=O)CCCC(=O)C2CC2)ccc1Cl	ZINC000450597717	CG	On-Demand	Anodyne	P2RX7	19	42
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cn(CC2CC2)nn1	ZINC000450597718	EC	On-Demand	Anodyne	SLC6A1	50	43
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cn(CC2CC2)nn1	ZINC000450597718	EC	On-Demand	Anodyne	SLC6A3	31	43
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cn(CC2CC2)nn1	ZINC000450597724	EC	On-Demand	Anodyne	SLC6A1	50	43
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cn(CC2CC2)nn1	ZINC000450597724	EC	On-Demand	Anodyne	SLC6A3	31	43
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cn(CC2CC2)nn1	ZINC000450597725	EC	On-Demand	Anodyne	SLC6A1	50	43
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cn(CC2CC2)nn1	ZINC000450597725	EC	On-Demand	Anodyne	SLC6A3	31	43
CCC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC	ZINC000450597726	CD	On-Demand	Anodyne	P2RY12	46	34
CCC[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC	ZINC000450597728	CD	On-Demand	Anodyne	P2RY12	46	34
Cc1nccc(N2CCN(C(=O)Cc3ccc(O)c(F)c3)CC2)n1	ZINC000450597744	ED	On-Demand	Anodyne	SORD	59	40
Cc1nccc(N2CCN(C(=O)Cc3ccc(O)c(F)c3)CC2)n1	ZINC000450597744	ED	On-Demand	Anodyne	ECE2	0	40
Cc1cnc([C@@H](C)CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)s1	ZINC000450597746	FI	On-Demand	Anodyne	RBP4	60	37
Cc1ccn(CC(=O)NCc2ccc(Cl)c(C)c2)n1	ZINC000450597747	CE	On-Demand	Anodyne	P2RX7	40	45
O=[N+]([O-])c1ccccc1CN(CCc1cscn1)C1CC1	ZINC000450597748	DG	On-Demand	Bother	COLA	76	32
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(F)cc1NS(C)(=O)=O	ZINC000450597749	FG	On-Demand	Anodyne	TRPV1	90	36
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(F)cc1NS(C)(=O)=O	ZINC000450597752	FG	On-Demand	Anodyne	TRPV1	90	36
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(Cl)c2ccccc2n1C	ZINC000450597753	GE	On-Demand	Anodyne	CAPN1	48	38
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(Cl)c2ccccc2n1C	ZINC000450597753	GE	On-Demand	Anodyne	CAPN2	87	38
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(Cl)c2ccccc2n1C	ZINC000450597753	GE	On-Demand	Anodyne	NPR	65	37
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(Cl)c2ccccc2n1C	ZINC000450597753	GE	On-Demand	Anodyne	KISS1R	47	32
COC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)c1c(Cl)c2ccccc2n1C	ZINC000450597753	GE	On-Demand	Anodyne	F2RL1	43	33
CC1(O)CC(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)C1	ZINC000450597759	FF	On-Demand	Anodyne	HRH3	0	42
CC1(O)CC(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)C1	ZINC000450597759	FF	On-Demand	Anodyne	CCR5	0	44
CC1(O)CC(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)C1	ZINC000450597759	FF	On-Demand	Anodyne	L3MBTL1	0	43
CCN1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1=O	ZINC000450597766	FE	On-Demand	Anodyne	HRH4	27	50
F[C@@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450597767	CE	On-Demand	Anodyne	LRRK2	23	43
F[C@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450597768	CE	On-Demand	Anodyne	LRRK2	23	43
CCCOc1ccc(C(=O)N2CCN(CCC(=O)OC)[C@@H](C)C2)c(OC)c1	ZINC000450597774	GE	On-Demand	Anodyne	OXTR	22	41
CCCOc1ccc(C(=O)N2CCN(CCC(=O)OC)[C@@H](C)C2)c(OC)c1	ZINC000450597774	GE	On-Demand	Anodyne	THRB	36	40
CCCOc1ccc(C(=O)N2CCN(CCC(=O)OC)[C@H](C)C2)c(OC)c1	ZINC000450597775	GE	On-Demand	Anodyne	OXTR	22	41
CCCOc1ccc(C(=O)N2CCN(CCC(=O)OC)[C@H](C)C2)c(OC)c1	ZINC000450597775	GE	On-Demand	Anodyne	THRB	36	40
Cc1ccc(F)c(CSc2nnc(CN3CCCC3)n2Cc2ccccc2)c1	ZINC000450597801	GJ	On-Demand	Anodyne	AGTR1	17	40
CCc1cccc(C(=O)NC(C)(C)CS(C)(=O)=O)n1	ZINC000450597811	CD	On-Demand	Anodyne	PDE5A	23	41
C[C@@H]1CCO[C@@H]1C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450597816	FG	On-Demand	Anodyne	PRSS2	54	31
Cc1nccc(N2CCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2)n1	ZINC000450597840	EE	On-Demand	Anodyne	SORD	80	38
COc1ccc(CNC(=O)CCN2CCOCC23CCC3)c(OC)c1	ZINC000450597843	ED	On-Demand	Anodyne	MTNR1A	42	36
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450597844	GI	On-Demand	Anodyne	EPHX2	18	44
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450597844	GI	On-Demand	Anodyne	SCD1	18	41
O=C(c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450597845	DD	On-Demand	Bother	SLC6A9	0	42
O=C(c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450597846	DD	On-Demand	Bother	SLC6A9	0	42
COC(=O)[C@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597847	DD	On-Demand	Anodyne	ACE	40	36
COC(=O)[C@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597847	DD	On-Demand	Anodyne	MME	41	35
COC(=O)[C@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597847	DD	On-Demand	Anodyne	SIGMAR1	32	40
COC(=O)[C@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597847	DD	On-Demand	Anodyne	TIMP3	49	34
COC(=O)[C@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597847	DD	On-Demand	Anodyne	ABCB1	32	41
COC(=O)[C@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597848	DD	On-Demand	Anodyne	ACE	40	36
COC(=O)[C@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597848	DD	On-Demand	Anodyne	MME	41	35
COC(=O)[C@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597848	DD	On-Demand	Anodyne	SIGMAR1	32	40
COC(=O)[C@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597848	DD	On-Demand	Anodyne	TIMP3	49	34
COC(=O)[C@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597848	DD	On-Demand	Anodyne	ABCB1	32	41
COC(=O)[C@@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597849	DD	On-Demand	Anodyne	ACE	40	36
COC(=O)[C@@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597849	DD	On-Demand	Anodyne	MME	41	35
COC(=O)[C@@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597849	DD	On-Demand	Anodyne	SIGMAR1	32	40
COC(=O)[C@@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597849	DD	On-Demand	Anodyne	TIMP3	49	34
COC(=O)[C@@H](O)C1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450597849	DD	On-Demand	Anodyne	ABCB1	32	41
COC(=O)[C@@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597850	DD	On-Demand	Anodyne	ACE	40	36
COC(=O)[C@@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597850	DD	On-Demand	Anodyne	MME	41	35
COC(=O)[C@@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597850	DD	On-Demand	Anodyne	SIGMAR1	32	40
COC(=O)[C@@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597850	DD	On-Demand	Anodyne	TIMP3	49	34
COC(=O)[C@@H](O)C1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450597850	DD	On-Demand	Anodyne	ABCB1	32	41
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	LIPE	16	42
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	FASN	44	51
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	RBP4	21	40
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	MLYCD	26	41
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	SFRP1	18	48
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	HPGDS	16	44
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	L3MBTL3	54	41
O=C(c1ccc(N2CCC2)nc1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450597855	GI	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)[C@@H](NCCCNc1nc2ccccc2s1)C(C)C	ZINC000450597862	DE	On-Demand	Anodyne	CSNK1D	29	43
COC(=O)[C@@H](NCCCNc1nc2ccccc2s1)C(C)C	ZINC000450597862	DE	On-Demand	Anodyne	TRY1_BOVIN	33	41
COC(=O)[C@@H](NCCCNc1nc2ccccc2s1)C(C)C	ZINC000450597862	DE	On-Demand	Anodyne	ST14	42	39
COC(=O)[C@@H](NCCCNc1nc2ccccc2s1)C(C)C	ZINC000450597862	DE	On-Demand	Anodyne	BCL2L1	41	34
COC(=O)[C@@H](NCCCNc1nc2ccccc2s1)C(C)C	ZINC000450597862	DE	On-Demand	Anodyne	TMPRSS6	68	39
CCCOc1ccc(C(=O)NCCC2CCC(OC)CC2)c(OC)c1	ZINC000450597868	EH	On-Demand	Anodyne	NQO2	34	42
CCCOc1ccc(C(=O)NCCC2CCC(OC)CC2)c(OC)c1	ZINC000450597868	EH	On-Demand	Anodyne	KCNA3	40	38
CN1CCN(CC2(C)CCN(C(=O)c3ccc4c(c3)OC(F)(F)O4)CC2)CC1	ZINC000450597871	GE	On-Demand	Anodyne	ACACA	40	34
COc1nccc(CNc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])n1	ZINC000450597877	FD	On-Demand	Bother	TAAR1	19	40
COc1nccc(CNc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])n1	ZINC000450597877	FD	On-Demand	Bother	LRRK2	33	44
COC(=O)c1ccc([N+](=O)[O-])c(NCC[C@H]2CCc3ccccc32)n1	ZINC000450597897	EG	On-Demand	Bother	PRKCQ	27	40
COC(=O)c1ccc([N+](=O)[O-])c(NCC[C@@H]2CCc3ccccc32)n1	ZINC000450597898	EG	On-Demand	Bother	PRKCQ	27	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)CSC2CC2)C1	ZINC000450597901	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)CSC2CC2)C1	ZINC000450597901	CF	On-Demand	Anodyne	CRTY	0	40
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)CSC2CC2)C1	ZINC000450597902	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)CSC2CC2)C1	ZINC000450597902	CF	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)CSC2CC2)C1	ZINC000450597903	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)CSC2CC2)C1	ZINC000450597903	CF	On-Demand	Anodyne	CRTY	0	40
C[C@H]1C[C@H](c2cccnc2)N(C(=O)CSC2CC2)C1	ZINC000450597904	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@H](c2cccnc2)N(C(=O)CSC2CC2)C1	ZINC000450597904	CF	On-Demand	Anodyne	CRTY	0	40
O=C(NCc1cc(Cl)cc2c1OCC2)[C@H]1CCN(c2ccccc2)C1	ZINC000450597905	FG	On-Demand	Anodyne	EPHX2	19	41
O=C(NCc1cc(Cl)cc2c1OCC2)[C@@H]1CCN(c2ccccc2)C1	ZINC000450597906	FG	On-Demand	Anodyne	EPHX2	19	41
COC1CCC(CCNC(=O)c2cc(C)c(C(N)=O)cn2)CC1	ZINC000450597909	DD	On-Demand	Anodyne	SIRT3	53	33
COC1CCC(CCNC(=O)c2cc(C)c(C(N)=O)cn2)CC1	ZINC000450597909	DD	On-Demand	Anodyne	SIRT2	54	33
COC1CCC(CCNC(=O)c2cc(C)c(C(N)=O)cn2)CC1	ZINC000450597909	DD	On-Demand	Anodyne	SIRT1	53	33
CC(C)OCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450597920	CE	On-Demand	Anodyne	P2RY12	56	34
CC(C)OCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450597920	CE	On-Demand	Anodyne	CTSV	47	33
CCOc1nc2ccc(C(=O)Nc3n[nH]c(C4CCC4)n3)cc2[nH]1	ZINC000450598000	EF	On-Demand	Anodyne	FTSZ	0	46
FC1(F)CC(CSc2nc3cc(Cl)cnc3[nH]2)C1	ZINC000450598016	CH	On-Demand	Anodyne	ENPP1	23	43
CCn1c(Cc2ccccc2)nnc1SC[C@H](O)CC#N	ZINC000450598037	DE	On-Demand	Mild	SLC27A1	42	35
COC[C@](C)(O)CCNc1ccc(S(C)(=O)=O)cc1	ZINC000450598042	CD	On-Demand	Anodyne	PTGS2	15	41
COC[C@@](C)(O)CCNc1ccc(S(C)(=O)=O)cc1	ZINC000450598043	CD	On-Demand	Anodyne	PTGS2	15	41
CCn1nnc(C)c1CSc1nnc(Cc2ccccc2)n1CC	ZINC000450598109	EG	On-Demand	Anodyne	SLC27A1	43	35
COCCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450598110	GH	On-Demand	Anodyne	DGAT1	42	39
COCCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450598110	GH	On-Demand	Anodyne	HPGDS	19	40
CCS(=O)(=O)c1ccc(CN2[C@@H](C)CCC[C@@H]2CO)cc1	ZINC000450598136	DE	On-Demand	Anodyne	HRH3	16	51
CCS(=O)(=O)c1ccc(CN2[C@H](CO)CCC[C@H]2C)cc1	ZINC000450598137	DE	On-Demand	Anodyne	HRH3	16	51
CCS(=O)(=O)c1ccc(CN2[C@H](C)CCC[C@@H]2CO)cc1	ZINC000450598138	DE	On-Demand	Anodyne	HRH3	16	51
CCS(=O)(=O)c1ccc(CN2[C@@H](C)CCC[C@H]2CO)cc1	ZINC000450598139	DE	On-Demand	Anodyne	HRH3	16	51
C[C@@H]1CCC[C@@H](CO)N1CCc1ccc(Cl)cc1	ZINC000450598151	CG	On-Demand	Anodyne	SLC18A2	71	40
C[C@@H]1CCC[C@H](CO)N1CCc1ccc(Cl)cc1	ZINC000450598152	CG	On-Demand	Anodyne	SLC18A2	71	40
C[C@H]1CCC[C@H](CO)N1CCc1ccc(Cl)cc1	ZINC000450598153	CG	On-Demand	Anodyne	SLC18A2	71	40
C[C@H]1CCC[C@@H](CO)N1CCc1ccc(Cl)cc1	ZINC000450598154	CG	On-Demand	Anodyne	SLC18A2	71	40
CCC[C@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OC	ZINC000450598177	EF	On-Demand	Anodyne	P2RY12	62	31
CCC[C@@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OC	ZINC000450598178	EF	On-Demand	Anodyne	P2RY12	62	31
F[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450598182	CG	On-Demand	Anodyne	RBP4	19	48
F[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450598183	CG	On-Demand	Anodyne	RBP4	19	48
C=CCC1(C(=O)N2CCN(c3ccnc(C)n3)CC2)CCCCC1	ZINC000450598202	EF	On-Demand	Mild	SORD	62	37
N#CC1(CSc2nnc(CN3CCCC3)n2Cc2ccccc2)CCC1	ZINC000450598210	FH	On-Demand	Mild	SIGMAR1	20	42
N#CC1(CSc2nnc(CN3CCCC3)n2Cc2ccccc2)CCC1	ZINC000450598210	FH	On-Demand	Mild	NPFFR1	43	34
CCS(=O)(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1	ZINC000450598212	FD	On-Demand	Anodyne	ACHE	21	41
CCS(=O)(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1	ZINC000450598212	FD	On-Demand	Anodyne	SIGMAR1	32	41
CCS(=O)(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1	ZINC000450598212	FD	On-Demand	Anodyne	SSTR5	53	41
CCS(=O)(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1	ZINC000450598212	FD	On-Demand	Anodyne	MMP13	37	42
CCS(=O)(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1	ZINC000450598212	FD	On-Demand	Anodyne	BDKRB1	19	40
CCS(=O)(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1	ZINC000450598212	FD	On-Demand	Anodyne	ADAM17	26	42
CCS(=O)(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1	ZINC000450598212	FD	On-Demand	Anodyne	MMP9	26	42
CCS(=O)(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1	ZINC000450598212	FD	On-Demand	Anodyne	MMP1	26	42
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1	ZINC000450598213	FD	On-Demand	Anodyne	ACHE	21	41
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1	ZINC000450598213	FD	On-Demand	Anodyne	SIGMAR1	32	41
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1	ZINC000450598213	FD	On-Demand	Anodyne	SSTR5	53	41
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1	ZINC000450598213	FD	On-Demand	Anodyne	MMP13	37	42
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1	ZINC000450598213	FD	On-Demand	Anodyne	BDKRB1	19	40
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1	ZINC000450598213	FD	On-Demand	Anodyne	ADAM17	26	42
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1	ZINC000450598213	FD	On-Demand	Anodyne	MMP9	26	42
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1	ZINC000450598213	FD	On-Demand	Anodyne	MMP1	26	42
CCN1C(=O)CCc2cc(NC(=O)C(C)(C)C3CCC3)ccc21	ZINC000450598241	DH	On-Demand	Anodyne	NAMPT	29	43
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450598254	ED	On-Demand	Bother	TAAR1	23	49
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450598255	ED	On-Demand	Bother	TAAR1	23	49
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450598256	ED	On-Demand	Bother	TAAR1	23	49
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450598257	ED	On-Demand	Bother	TAAR1	23	49
NC(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450598263	CD	On-Demand	Bother	MDAA	0	45
NC(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450598264	CD	On-Demand	Bother	MDAA	0	45
CC[C@@H]1CN2CCC[C@H]2CN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450598265	EG	On-Demand	Anodyne	OPRK1	23	40
CC[C@@H]1CN2CCC[C@H]2CN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450598265	EG	On-Demand	Anodyne	CCR3	24	42
CC[C@H]1CN2CCC[C@H]2CN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450598266	EG	On-Demand	Anodyne	OPRK1	23	40
CC[C@H]1CN2CCC[C@H]2CN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450598266	EG	On-Demand	Anodyne	CCR3	24	42
CC[C@@H]1CN2CCC[C@@H]2CN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450598267	EG	On-Demand	Anodyne	OPRK1	23	40
CC[C@@H]1CN2CCC[C@@H]2CN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450598267	EG	On-Demand	Anodyne	CCR3	24	42
CC[C@H]1CN2CCC[C@@H]2CN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450598268	EG	On-Demand	Anodyne	OPRK1	23	40
CC[C@H]1CN2CCC[C@@H]2CN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450598268	EG	On-Demand	Anodyne	CCR3	24	42
COC[C@@](C)(O)CCNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450598304	GG	On-Demand	Bother	TAAR1	23	55
COC[C@](C)(O)CCNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450598305	GG	On-Demand	Bother	TAAR1	23	55
Cc1cc(C)nc(N2CCN(C[C@@H](C)S(C)(=O)=O)CC2)n1	ZINC000450598312	DC	On-Demand	Anodyne	SORD	23	41
Cc1cc(C)nc(N2CCN(C[C@H](C)S(C)(=O)=O)CC2)n1	ZINC000450598313	DC	On-Demand	Anodyne	SORD	23	41
CCCc1cc(NCC[C@](C)(O)COC)n2ncnc2n1	ZINC000450598320	CD	On-Demand	Anodyne	DHOD	0	46
CCCc1cc(NCC[C@@](C)(O)COC)n2ncnc2n1	ZINC000450598321	CD	On-Demand	Anodyne	DHOD	0	46
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	F2	41	43
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	FKBP1A	48	52
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	MMP13	55	43
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	ADAM17	45	43
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	ITGA4	43	45
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	CAPNS1	23	46
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	MMP2	25	41
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	MMP3	58	43
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	MMP8	29	41
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	CAPN1	19	48
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	MMP9	30	41
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	MMP7	72	43
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	MMP1	60	46
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	SFRP1	122	39
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	WNT3	89	39
CCOC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598322	GC	On-Demand	Anodyne	TMPRSS11D	59	34
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	F2	41	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	FKBP1A	48	52
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	MMP13	55	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	ADAM17	45	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	ITGA4	43	45
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	CAPNS1	23	46
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	MMP2	25	41
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	MMP3	58	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	MMP8	29	41
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	CAPN1	19	48
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	MMP9	30	41
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	MMP7	72	43
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	MMP1	60	46
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	SFRP1	122	39
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	WNT3	89	39
CCOC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450598323	GC	On-Demand	Anodyne	TMPRSS11D	59	34
CCS(=O)(=O)c1ccc(CN2CCN(c3nc(C)cc(C)n3)CC2)cc1	ZINC000450598335	FE	On-Demand	Anodyne	ADORA2B	43	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000450598365	GH	On-Demand	Anodyne	CAPN1	22	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000450598365	GH	On-Demand	Anodyne	CAPN2	21	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000450598366	GH	On-Demand	Anodyne	CAPN1	22	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000450598366	GH	On-Demand	Anodyne	CAPN2	21	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000450598367	GH	On-Demand	Anodyne	CAPN1	22	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000450598367	GH	On-Demand	Anodyne	CAPN2	21	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000450598368	GH	On-Demand	Anodyne	CAPN1	22	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000450598368	GH	On-Demand	Anodyne	CAPN2	21	49
O=C(Nc1ccc(F)cc1OCC(F)F)c1ccc(N2CCC2)nc1	ZINC000450598391	FG	On-Demand	Anodyne	HDAC1	22	44
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	DRD3	23	44
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	LTA4H	32	44
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	HRH3	26	42
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	SIGMAR1	23	41
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	SSTR5	41	36
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	CHEK2	19	42
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	CCR3	67	41
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	UTS2R	18	40
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	MLNR	56	38
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	CCR2	22	54
COc1cc(N[C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598408	FH	On-Demand	Anodyne	MCHR1	45	49
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	DRD3	23	44
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	LTA4H	32	44
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	HRH3	26	42
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	SIGMAR1	23	41
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	SSTR5	41	36
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	CHEK2	19	42
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	CCR3	67	41
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	UTS2R	18	40
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	MLNR	56	38
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	CCR2	22	54
COc1cc(N[C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)cc(OC)c1	ZINC000450598409	FH	On-Demand	Anodyne	MCHR1	45	49
CC(C)OCCNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450598416	DD	On-Demand	Anodyne	PDE4D	15	42
CCn1c(Cc2ccccc2)nnc1SCc1nc(C(=O)OC)co1	ZINC000450598417	FF	On-Demand	Anodyne	SLC27A1	53	45
CC(C)OCCNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450598418	DD	On-Demand	Anodyne	PDE4D	15	42
OCCCN1CCC[C@@H]1CNc1ccnc2c(Br)cccc12	ZINC000450598429	FG	On-Demand	Anodyne	HNMT	51	37
OCCCN1CCC[C@H]1CNc1ccnc2c(Br)cccc12	ZINC000450598430	FG	On-Demand	Anodyne	HNMT	51	37
CCn1c(Cc2ccccc2)nnc1SCCCCCC(C)=O	ZINC000450598441	EI	On-Demand	Anodyne	SLC27A1	46	39
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	DRD1	16	45
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	DRD4	22	52
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	HTR2A	23	49
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	HTR2C	21	51
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	SLC6A1	65	36
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598451	FH	On-Demand	Anodyne	CYP2J2	50	35
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	DRD1	16	45
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	DRD4	22	52
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	HTR2A	23	49
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	HTR2C	21	51
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	SLC6A1	65	36
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H](c2nncn2C2CC2)C1)c1ccc(F)cc1	ZINC000450598452	FH	On-Demand	Anodyne	CYP2J2	50	35
CC(=O)c1cccc(CN2CCO[C@@H](CN3C(=O)c4ccccc4C3=O)C2)c1	ZINC000450598453	GE	On-Demand	Anodyne	DRD4	24	45
CC(=O)c1cccc(CN2CCO[C@H](CN3C(=O)c4ccccc4C3=O)C2)c1	ZINC000450598456	GE	On-Demand	Anodyne	DRD4	24	45
COc1cc(-c2noc(CN3CCCC[C@H]3c3nc4ccccc4o3)n2)ncn1	ZINC000450598482	GG	On-Demand	Anodyne	COLA	53	40
COc1cc(-c2noc(CN3CCCC[C@H]3c3nc4ccccc4o3)n2)ncn1	ZINC000450598482	GG	On-Demand	Anodyne	CPT1A	51	40
COc1cc(-c2noc(CN3CCCC[C@@H]3c3nc4ccccc4o3)n2)ncn1	ZINC000450598483	GG	On-Demand	Anodyne	COLA	53	40
COc1cc(-c2noc(CN3CCCC[C@@H]3c3nc4ccccc4o3)n2)ncn1	ZINC000450598483	GG	On-Demand	Anodyne	CPT1A	51	40
COC1CCC(CCNC(=O)[C@H](C)Oc2ccccn2)CC1	ZINC000450598488	DF	On-Demand	Anodyne	SIRT3	41	31
COC1CCC(CCNC(=O)[C@H](C)Oc2ccccn2)CC1	ZINC000450598488	DF	On-Demand	Anodyne	SIRT2	45	32
COC1CCC(CCNC(=O)[C@H](C)Oc2ccccn2)CC1	ZINC000450598488	DF	On-Demand	Anodyne	SIRT1	41	31
COC1CCC(CCNC(=O)[C@@H](C)Oc2ccccn2)CC1	ZINC000450598490	DF	On-Demand	Anodyne	SIRT3	41	31
COC1CCC(CCNC(=O)[C@@H](C)Oc2ccccn2)CC1	ZINC000450598490	DF	On-Demand	Anodyne	SIRT2	45	32
COC1CCC(CCNC(=O)[C@@H](C)Oc2ccccn2)CC1	ZINC000450598490	DF	On-Demand	Anodyne	SIRT1	41	31
O=[N+]([O-])c1cccc2c(NC[C@H]3CCCN3CCCO)ccnc12	ZINC000450598513	EE	On-Demand	Bother	HNMT	44	34
O=[N+]([O-])c1cccc2c(NC[C@@H]3CCCN3CCCO)ccnc12	ZINC000450598514	EE	On-Demand	Bother	HNMT	44	34
COC(=O)c1cn(C2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)nn1	ZINC000450598516	FE	On-Demand	Anodyne	L3MBTL3	82	38
CC(C)OCCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450598521	DG	On-Demand	Anodyne	MAPK14	17	40
CC(C)OCCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450598521	DG	On-Demand	Anodyne	F3	69	32
CC(C)OCCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450598521	DG	On-Demand	Anodyne	ROCK2	36	43
CC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000450598528	DI	On-Demand	Anodyne	CAPN1	15	43
CCCc1cc(C(=O)N(C)C2CC(O)C2)no1	ZINC000450598529	BD	On-Demand	Anodyne	S1PR3	0	61
CC(=O)N[C@H](C(=O)N(C)CC1(O)CCC1)C(C)(C)C	ZINC000450598536	CC	On-Demand	Anodyne	PDF	47	35
CC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000450598540	DI	On-Demand	Anodyne	CAPN1	15	43
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000450598541	DI	On-Demand	Anodyne	CAPN1	15	43
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000450598542	DI	On-Demand	Anodyne	CAPN1	15	43
COc1cc(CC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)ccc1Cl	ZINC000450598543	GF	On-Demand	Anodyne	TACR1	0	43
COc1cc(CC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)ccc1Cl	ZINC000450598543	GF	On-Demand	Anodyne	TACR2	20	43
COc1cc(CC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)ccc1Cl	ZINC000450598543	GF	On-Demand	Anodyne	CCR1	28	40
COc1cc(CC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)ccc1Cl	ZINC000450598543	GF	On-Demand	Anodyne	GHSR	15	41
CCC[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC	ZINC000450598565	BC	On-Demand	Anodyne	METAP2	26	40
CCC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC	ZINC000450598566	BC	On-Demand	Anodyne	METAP2	26	40
CCC[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC	ZINC000450598567	BC	On-Demand	Anodyne	METAP2	26	40
CCC[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC	ZINC000450598568	BC	On-Demand	Anodyne	METAP2	26	40
Fc1ccc(-c2csc3ncnc(N4CC[C@@H](F)C4)c23)cc1	ZINC000450598569	DI	On-Demand	Anodyne	ADRB2	17	54
Fc1ccc(-c2csc3ncnc(N4CC[C@@H](F)C4)c23)cc1	ZINC000450598569	DI	On-Demand	Anodyne	ADRB3	16	54
Fc1ccc(-c2csc3ncnc(N4CC[C@H](F)C4)c23)cc1	ZINC000450598570	DI	On-Demand	Anodyne	ADRB2	17	54
Fc1ccc(-c2csc3ncnc(N4CC[C@H](F)C4)c23)cc1	ZINC000450598570	DI	On-Demand	Anodyne	ADRB3	16	54
CC[C@@H]1C[C@H]1C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450598584	FH	On-Demand	Anodyne	PRSS2	47	32
CC[C@@H]1C[C@H]1C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450598584	FH	On-Demand	Anodyne	HRH3	0	40
CC[C@@H]1C[C@H]1C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450598584	FH	On-Demand	Anodyne	EPHX2	17	42
CCN1C(=O)CCc2cc(NC(=O)c3ccc(C(C)(F)F)nc3)ccc21	ZINC000450598587	FH	On-Demand	Anodyne	TRPV1	15	40
CC1=C(C(=O)N2CCN(c3ccnc(C)n3)CC2)CCC(C)(C)C1	ZINC000450598590	EF	On-Demand	Anodyne	SORD	46	37
COC(=O)[C@@H](NCCCNc1nc(-c2ccccn2)nc2c1CCC2)C(C)C	ZINC000450598597	GE	On-Demand	Anodyne	ACHE	45	34
COC(=O)[C@@H](NCCCNc1nc(-c2ccccn2)nc2c1CCC2)C(C)C	ZINC000450598597	GE	On-Demand	Anodyne	BCHE	68	33
Cc1nccc(N2CCN(C(=O)c3ccnc(OC(F)F)c3)CC2)n1	ZINC000450598598	ED	On-Demand	Anodyne	SORD	48	38
Cc1nccc(N2CCN(C(=O)c3ccnc(OC(F)F)c3)CC2)n1	ZINC000450598598	ED	On-Demand	Anodyne	SLC6A7	0	40
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@H]3CC(C)C)ccc21	ZINC000450598599	DH	On-Demand	Anodyne	NAMPT	28	44
Cc1nccc(N2CCN(C(=O)c3cc(C#N)[nH]c3C)CC2)n1	ZINC000450598606	DD	On-Demand	Mild	SORD	45	38
Cc1nccc(N2CCN(C(=O)c3cc(C#N)[nH]c3C)CC2)n1	ZINC000450598606	DD	On-Demand	Mild	FASN	42	38
Cc1nccc(N2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)n1	ZINC000450598614	FE	On-Demand	Anodyne	P2RY12	46	35
Cc1nccc(N2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)n1	ZINC000450598614	FE	On-Demand	Anodyne	SORD	114	41
Cc1nccc(N2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)n1	ZINC000450598614	FE	On-Demand	Anodyne	SLC6A7	0	44
Cc1nccc(N2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)n1	ZINC000450598615	FE	On-Demand	Anodyne	P2RY12	46	35
Cc1nccc(N2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)n1	ZINC000450598615	FE	On-Demand	Anodyne	SORD	114	41
Cc1nccc(N2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)n1	ZINC000450598615	FE	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1CCNC(=O)CC1	ZINC000450598620	EC	On-Demand	Anodyne	SLC6A1	38	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1CCNC(=O)CC1	ZINC000450598620	EC	On-Demand	Anodyne	SLC6A3	26	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1CCNC(=O)CC1	ZINC000450598621	EC	On-Demand	Anodyne	SLC6A1	38	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1CCNC(=O)CC1	ZINC000450598621	EC	On-Demand	Anodyne	SLC6A3	26	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1CCNC(=O)CC1	ZINC000450598622	EC	On-Demand	Anodyne	SLC6A1	38	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1CCNC(=O)CC1	ZINC000450598622	EC	On-Demand	Anodyne	SLC6A3	26	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1CCNC(=O)CC1	ZINC000450598623	EC	On-Demand	Anodyne	SLC6A1	38	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1CCNC(=O)CC1	ZINC000450598623	EC	On-Demand	Anodyne	SLC6A3	26	42
CCS(=O)(=O)c1ccc(CN2CCC[C@H]([C@@H]3CCOC3)C2)cc1	ZINC000450598624	EF	On-Demand	Anodyne	HRH3	16	41
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)cc1	ZINC000450598625	EF	On-Demand	Anodyne	HRH3	16	41
CCS(=O)(=O)c1ccc(CN2CCC[C@H]([C@H]3CCOC3)C2)cc1	ZINC000450598626	EF	On-Demand	Anodyne	HRH3	16	41
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]([C@H]3CCOC3)C2)cc1	ZINC000450598627	EF	On-Demand	Anodyne	HRH3	16	41
CNS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450598628	CC	On-Demand	Anodyne	GCKR	25	44
CNS(=O)(=O)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450598629	CC	On-Demand	Anodyne	GCKR	25	44
CCC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450598630	DD	On-Demand	Anodyne	ACACA	25	40
CCC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450598630	DD	On-Demand	Anodyne	MTNR1B	52	48
CCC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450598630	DD	On-Demand	Anodyne	NOD1	50	32
CCC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450598630	DD	On-Demand	Anodyne	PDS	29	41
CCC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450598631	DD	On-Demand	Anodyne	ACACA	25	40
CCC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450598631	DD	On-Demand	Anodyne	MTNR1B	52	48
CCC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450598631	DD	On-Demand	Anodyne	NOD1	50	32
CCC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450598631	DD	On-Demand	Anodyne	PDS	29	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nnc(C(C)C)s1	ZINC000450598632	FD	On-Demand	Anodyne	SLC6A1	65	35
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nnc(C(C)C)s1	ZINC000450598633	FD	On-Demand	Anodyne	SLC6A1	65	35
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nnc(C(C)C)s1	ZINC000450598634	FD	On-Demand	Anodyne	SLC6A1	65	35
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnns1	ZINC000450598646	DC	On-Demand	Anodyne	SLC6A1	84	37
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnns1	ZINC000450598646	DC	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnns1	ZINC000450598647	DC	On-Demand	Anodyne	SLC6A1	84	37
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnns1	ZINC000450598647	DC	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnns1	ZINC000450598648	DC	On-Demand	Anodyne	SLC6A1	84	37
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnns1	ZINC000450598648	DC	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@H](O)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450598650	FG	On-Demand	Anodyne	SIGMAR1	37	43
COC(=O)[C@H](O)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450598650	FG	On-Demand	Anodyne	SSTR5	41	32
COC(=O)[C@H](O)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450598650	FG	On-Demand	Anodyne	CACNA1G	42	41
COC(=O)[C@@H](O)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450598651	FG	On-Demand	Anodyne	SIGMAR1	37	43
COC(=O)[C@@H](O)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450598651	FG	On-Demand	Anodyne	SSTR5	41	32
COC(=O)[C@@H](O)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450598651	FG	On-Demand	Anodyne	CACNA1G	42	41
COC(=O)[C@H](O)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450598652	FG	On-Demand	Anodyne	SIGMAR1	37	43
COC(=O)[C@H](O)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450598652	FG	On-Demand	Anodyne	SSTR5	41	32
COC(=O)[C@H](O)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450598652	FG	On-Demand	Anodyne	CACNA1G	42	41
COC(=O)[C@@H](O)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450598653	FG	On-Demand	Anodyne	SIGMAR1	37	43
COC(=O)[C@@H](O)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450598653	FG	On-Demand	Anodyne	SSTR5	41	32
COC(=O)[C@@H](O)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450598653	FG	On-Demand	Anodyne	CACNA1G	42	41
CCO[C@@H]1COCC[C@@H]1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450598663	DD	On-Demand	Anodyne	TIMP3	62	33
CCO[C@@H]1COCC[C@H]1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450598664	DD	On-Demand	Anodyne	TIMP3	62	33
CCO[C@@H]1COCC[C@@H]1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450598666	DD	On-Demand	Anodyne	TIMP3	62	33
CCO[C@@H]1COCC[C@H]1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450598668	DD	On-Demand	Anodyne	TIMP3	62	33
CCOC(=O)c1c[nH]c2ccc(OC)cc2c1=NCC[C@](C)(O)COC	ZINC000450598670	FE	On-Demand	Anodyne	MTNR1A	15	40
CCOC(=O)c1c[nH]c2ccc(OC)cc2c1=NCC[C@@](C)(O)COC	ZINC000450598671	FE	On-Demand	Anodyne	MTNR1A	15	40
COC[C@@](C)(O)CCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450598672	ED	On-Demand	Anodyne	DHOD	0	42
COC[C@](C)(O)CCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450598673	ED	On-Demand	Anodyne	DHOD	0	42
COc1ccc(Nc2nc(N3CCOC[C@@H]3C)cc(N3CCOC[C@@H]3C)n2)cc1	ZINC000450598690	GF	On-Demand	Anodyne	MTOR	46	38
COc1ccc(Nc2nc(N3CCOC[C@@H]3C)cc(N3CCOC[C@@H]3C)n2)cc1	ZINC000450598690	GF	On-Demand	Anodyne	GALR2	63	43
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1nc(C2CCC2)n[nH]1	ZINC000450598693	DH	On-Demand	Anodyne	SORT1	17	45
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1nc(C2CCC2)n[nH]1	ZINC000450598693	DH	On-Demand	Anodyne	MTTP	41	35
COC[C@@](C)(O)CCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450598712	FD	On-Demand	Anodyne	AVPR2	101	42
COC[C@@](C)(O)CCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450598712	FD	On-Demand	Anodyne	AVPR1A	62	40
COC[C@](C)(O)CCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450598713	FD	On-Demand	Anodyne	AVPR2	101	42
COC[C@](C)(O)CCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450598713	FD	On-Demand	Anodyne	AVPR1A	62	40
COC[C@@](C)(O)CCNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450598726	EG	On-Demand	Mild	SRC	55	36
COC[C@@](C)(O)CCNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450598726	EG	On-Demand	Mild	MAP3K8	55	38
COC[C@](C)(O)CCNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450598727	EG	On-Demand	Mild	SRC	55	36
COC[C@](C)(O)CCNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450598727	EG	On-Demand	Mild	MAP3K8	55	38
COC[C@@](C)(O)CCNc1nc(-c2ccc(F)cc2)cs1	ZINC000450598732	DF	On-Demand	Anodyne	MAOB	19	44
COC[C@](C)(O)CCNc1nc(-c2ccc(F)cc2)cs1	ZINC000450598733	DF	On-Demand	Anodyne	MAOB	19	44
COC[C@@](C)(O)CCNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450598750	FD	On-Demand	Anodyne	HTR3A	26	48
COC[C@@](C)(O)CCNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450598750	FD	On-Demand	Anodyne	HRH4	31	48
COC[C@](C)(O)CCNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450598751	FD	On-Demand	Anodyne	HTR3A	26	48
COC[C@](C)(O)CCNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450598751	FD	On-Demand	Anodyne	HRH4	31	48
Cc1ccsc1CCNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450598752	FG	On-Demand	Anodyne	PSBA	0	42
CC(C)C[C@@H](CN1CCCC1)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450598801	FG	On-Demand	Anodyne	DHOD	0	47
O=C(NC1CC1)c1cc(NC[C@@H]2CCCN2CCCO)nc2ccccc12	ZINC000450598806	FD	On-Demand	Anodyne	CNR2	20	41
O=C(NC1CC1)c1cc(NC[C@@H]2CCCN2CCCO)nc2ccccc12	ZINC000450598806	FD	On-Demand	Anodyne	ACACB	24	41
O=C(NC1CC1)c1cc(NC[C@@H]2CCCN2CCCO)nc2ccccc12	ZINC000450598806	FD	On-Demand	Anodyne	TNKS	45	32
O=C(NC1CC1)c1cc(NC[C@H]2CCCN2CCCO)nc2ccccc12	ZINC000450598807	FD	On-Demand	Anodyne	CNR2	20	41
O=C(NC1CC1)c1cc(NC[C@H]2CCCN2CCCO)nc2ccccc12	ZINC000450598807	FD	On-Demand	Anodyne	ACACB	24	41
O=C(NC1CC1)c1cc(NC[C@H]2CCCN2CCCO)nc2ccccc12	ZINC000450598807	FD	On-Demand	Anodyne	TNKS	45	32
COc1ccc(CNC(=O)CCN2[C@H](C)CCC[C@@H]2CO)c(OC)c1	ZINC000450598820	FD	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN2[C@H](C)CCC[C@@H]2CO)c(OC)c1	ZINC000450598820	FD	On-Demand	Anodyne	MTNR1B	44	36
COc1ccc(CNC(=O)CCN2[C@@H](C)CCC[C@@H]2CO)c(OC)c1	ZINC000450598821	FD	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN2[C@@H](C)CCC[C@@H]2CO)c(OC)c1	ZINC000450598821	FD	On-Demand	Anodyne	MTNR1B	44	36
COc1ccc(CNC(=O)CCN2[C@@H](C)CCC[C@H]2CO)c(OC)c1	ZINC000450598822	FD	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN2[C@@H](C)CCC[C@H]2CO)c(OC)c1	ZINC000450598822	FD	On-Demand	Anodyne	MTNR1B	44	36
COc1ccc(CNC(=O)CCN2[C@H](CO)CCC[C@H]2C)c(OC)c1	ZINC000450598823	FD	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN2[C@H](CO)CCC[C@H]2C)c(OC)c1	ZINC000450598823	FD	On-Demand	Anodyne	MTNR1B	44	36
OCCCN1CCC[C@@H]1CNc1ncnc2[nH]c3ccccc3c12	ZINC000450598826	EE	On-Demand	Anodyne	TNK2	45	38
OCCCN1CCC[C@H]1CNc1ncnc2[nH]c3ccccc3c12	ZINC000450598827	EE	On-Demand	Anodyne	TNK2	45	38
CC[C@H](O)CC(=O)NCc1ccc(-c2ccccc2C#N)cc1	ZINC000450598859	DG	On-Demand	Mild	GRIA2	20	43
CC[C@H](O)CC(=O)NCc1ccc(-c2ccccc2C#N)cc1	ZINC000450598859	DG	On-Demand	Mild	GRIA4	26	43
CC[C@@H](O)CC(=O)NCc1ccc(-c2ccccc2C#N)cc1	ZINC000450598860	DG	On-Demand	Mild	GRIA2	20	43
CC[C@@H](O)CC(=O)NCc1ccc(-c2ccccc2C#N)cc1	ZINC000450598860	DG	On-Demand	Mild	GRIA4	26	43
CCCNC(=O)c1ccc(NC[C@@H]2CCCN2CCCO)nc1	ZINC000450598861	DD	On-Demand	Anodyne	IKBKB	0	48
CCCNC(=O)c1ccc(NC[C@H]2CCCN2CCCO)nc1	ZINC000450598862	DD	On-Demand	Anodyne	IKBKB	0	48
CSc1ccc2ncnc(NC[C@H]3CCCN3CCCO)c2c1	ZINC000450598863	EE	On-Demand	Anodyne	CLK4	50	35
CSc1ccc2ncnc(NC[C@@H]3CCCN3CCCO)c2c1	ZINC000450598864	EE	On-Demand	Anodyne	CLK4	50	35
COC1CCC(CCNC(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450598871	EG	On-Demand	Anodyne	TIMP3	64	42
COC1CCC(CCNC(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450598872	EG	On-Demand	Anodyne	TIMP3	64	42
Cc1nn(C)cc1CC(=O)NCc1cc(Cl)cc2c1OCC2	ZINC000450598888	DE	On-Demand	Anodyne	P2RX7	47	38
C[C@H]1CC[C@@H](C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)O1	ZINC000450598900	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1CC[C@@H](C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)O1	ZINC000450598900	CF	On-Demand	Anodyne	CRTY	0	40
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@H](C)O2)C1	ZINC000450598901	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@H](C)O2)C1	ZINC000450598901	CF	On-Demand	Anodyne	CRTY	0	40
C[C@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@H](C)O2)C1	ZINC000450598902	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2CC[C@H](C)O2)C1	ZINC000450598902	CF	On-Demand	Anodyne	CRTY	0	40
COC1CCC(CCNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450598917	GG	On-Demand	Anodyne	CACNA1I	53	35
COC(=O)c1csc(CN2CCCC[C@H]2c2nc3ccccc3o2)n1	ZINC000450598935	FH	On-Demand	Anodyne	COLA	56	43
COC(=O)c1csc(CN2CCCC[C@H]2c2nc3ccccc3o2)n1	ZINC000450598935	FH	On-Demand	Anodyne	CPT1A	48	40
COC(=O)c1csc(CN2CCCC[C@@H]2c2nc3ccccc3o2)n1	ZINC000450598936	FH	On-Demand	Anodyne	COLA	56	43
COC(=O)c1csc(CN2CCCC[C@@H]2c2nc3ccccc3o2)n1	ZINC000450598936	FH	On-Demand	Anodyne	CPT1A	48	40
COC1CCC(CCNC(=O)c2ccccc2-n2ccc(C)n2)CC1	ZINC000450598947	EH	On-Demand	Anodyne	SIRT3	40	30
COC1CCC(CCNC(=O)c2ccccc2-n2ccc(C)n2)CC1	ZINC000450598947	EH	On-Demand	Anodyne	SIRT1	40	30
COC1CCC(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC000450598961	DH	On-Demand	Anodyne	SELE	46	35
COC1CCC(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC000450598961	DH	On-Demand	Anodyne	ICAM1	43	35
COC1CCC(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC000450598961	DH	On-Demand	Anodyne	VCAM1	40	35
COC1CCC(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC000450598961	DH	On-Demand	Anodyne	SIRT3	44	34
COC1CCC(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC000450598961	DH	On-Demand	Anodyne	SIRT2	48	34
COC1CCC(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC000450598961	DH	On-Demand	Anodyne	SIRT1	44	34
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	DRD4	33	41
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	ACHE	21	41
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	HTR4	72	39
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	SIGMAR1	30	43
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	SSTR5	69	38
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	CCR3	35	42
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	MCHR1	40	45
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598967	FD	On-Demand	Anodyne	ARG2	15	41
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	DRD4	33	41
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	ACHE	21	41
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	HTR4	72	39
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	SIGMAR1	30	43
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	SSTR5	69	38
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	CCR3	35	42
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	MCHR1	40	45
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)OC)CC2)cc1Cl	ZINC000450598968	FD	On-Demand	Anodyne	ARG2	15	41
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1ccc(C#N)cn1	ZINC000450598973	CH	On-Demand	Mild	SGPL1	0	42
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1ccc(C#N)cn1	ZINC000450598974	CH	On-Demand	Mild	SGPL1	0	42
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1ccc(C#N)cn1	ZINC000450598975	CH	On-Demand	Mild	SGPL1	0	42
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1ccc(C#N)cn1	ZINC000450598976	CH	On-Demand	Mild	SGPL1	0	42
O=C1CC[C@@H](CN(Cc2ccccc2[N+](=O)[O-])C2CC2)CCN1	ZINC000450598988	DE	On-Demand	Bother	COLA	75	33
O=C1CC[C@H](CN(Cc2ccccc2[N+](=O)[O-])C2CC2)CCN1	ZINC000450598989	DE	On-Demand	Bother	COLA	75	33
COC[C@@](C)(O)CCNc1ncnc2c1cnn2-c1ccccc1	ZINC000450599002	EE	On-Demand	Anodyne	GSK3B	15	44
COC[C@@](C)(O)CCNc1ncnc2c1cnn2-c1ccccc1	ZINC000450599002	EE	On-Demand	Anodyne	SRC	17	45
COC[C@](C)(O)CCNc1ncnc2c1cnn2-c1ccccc1	ZINC000450599003	EE	On-Demand	Anodyne	GSK3B	15	44
COC[C@](C)(O)CCNc1ncnc2c1cnn2-c1ccccc1	ZINC000450599003	EE	On-Demand	Anodyne	SRC	17	45
COC(=O)c1ccccc1C(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450599026	FG	On-Demand	Bother	TAAR1	17	43
COC(=O)c1ccccc1C(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450599035	FG	On-Demand	Bother	TAAR1	17	43
COc1cc(-c2noc(CN3CCC[C@H]3CC(=O)c3ccc(F)cc3)n2)ncn1	ZINC000450599043	GF	On-Demand	Anodyne	ACKR3	52	35
COc1cc(-c2noc(CN3CCC[C@@H]3CC(=O)c3ccc(F)cc3)n2)ncn1	ZINC000450599044	GF	On-Demand	Anodyne	ACKR3	52	35
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1(C(=O)OC)CC1	ZINC000450599046	EC	On-Demand	Anodyne	SLC6A1	62	36
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1(C(=O)OC)CC1	ZINC000450599048	EC	On-Demand	Anodyne	SLC6A1	62	36
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1(C(=O)OC)CC1	ZINC000450599050	EC	On-Demand	Anodyne	SLC6A1	62	36
O=C(CSC1CC1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450599052	FH	On-Demand	Anodyne	PRSS2	46	33
CCC[C@@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450599054	EE	On-Demand	Bother	CCR3	24	42
CCC[C@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450599056	EE	On-Demand	Bother	CCR3	24	42
O=[N+]([O-])c1ccccc1CN(CC1CC(F)(F)C1)C1CC1	ZINC000450599067	CH	On-Demand	Bother	COLA	112	37
CCOCc1nc(C)c(C(=O)Nc2ccc(F)cc2NS(C)(=O)=O)s1	ZINC000450599070	GF	On-Demand	Anodyne	PLA2G7	30	40
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)cc1	ZINC000450599077	GD	On-Demand	Anodyne	SLC6A1	96	46
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)cc1	ZINC000450599077	GD	On-Demand	Anodyne	SLC6A4	29	46
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)cc1	ZINC000450599077	GD	On-Demand	Anodyne	SLC6A3	52	47
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)cc1	ZINC000450599077	GD	On-Demand	Anodyne	RORC	49	33
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)cc1	ZINC000450599079	GD	On-Demand	Anodyne	SLC6A1	96	46
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)cc1	ZINC000450599079	GD	On-Demand	Anodyne	SLC6A4	29	46
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)cc1	ZINC000450599079	GD	On-Demand	Anodyne	SLC6A3	52	47
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)cc1	ZINC000450599079	GD	On-Demand	Anodyne	RORC	49	33
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)cc1	ZINC000450599081	GD	On-Demand	Anodyne	SLC6A1	96	46
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)cc1	ZINC000450599081	GD	On-Demand	Anodyne	SLC6A4	29	46
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)cc1	ZINC000450599081	GD	On-Demand	Anodyne	SLC6A3	52	47
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)cc1	ZINC000450599081	GD	On-Demand	Anodyne	RORC	49	33
COc1cc(CN2C(=O)C(=O)N(C3CCCC3)C2=O)ccc1Cl	ZINC000450599086	EF	On-Demand	Anodyne	CACNA1C	0	45
COc1cc(CN2C(=O)C(=O)N(C3CCCC3)C2=O)ccc1Cl	ZINC000450599086	EF	On-Demand	Anodyne	CACNA1D	49	45
CCCCn1cc(CNC(=O)Cc2cc3ccccc3s2)c(C)n1	ZINC000450599098	EI	On-Demand	Anodyne	P2RX7	46	39
CCC[C@@H](NC(=O)CNS(=O)(=O)NC)C(=O)OC	ZINC000450599099	CA	On-Demand	Anodyne	NOD1	50	32
CCC[C@H](NC(=O)CNS(=O)(=O)NC)C(=O)OC	ZINC000450599100	CA	On-Demand	Anodyne	NOD1	50	32
O=C(c1cc(N2CC[C@@H](F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450599106	DE	On-Demand	Bother	L3MBTL1	0	45
O=C(c1cc(N2CC[C@H](F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450599109	DE	On-Demand	Bother	L3MBTL1	0	45
CCC(=O)C1(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)CC1	ZINC000450599110	GH	On-Demand	Anodyne	PRSS2	60	31
O=C(CCCN1CCOCC12CCC2)c1ccc(Br)cc1	ZINC000450599129	FH	On-Demand	Anodyne	HDAC8	18	40
O=C(CCCN1CCOCC12CCC2)c1ccc(Br)cc1	ZINC000450599129	FH	On-Demand	Anodyne	CYP2J2	45	32
COC[C@@](C)(O)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450599159	FE	On-Demand	Anodyne	ADRA1D	15	43
COC[C@@](C)(O)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450599159	FE	On-Demand	Anodyne	AVPR2	45	40
COC[C@@](C)(O)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450599159	FE	On-Demand	Anodyne	GPBAR1	20	44
COC[C@](C)(O)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450599160	FE	On-Demand	Anodyne	ADRA1D	15	43
COC[C@](C)(O)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450599160	FE	On-Demand	Anodyne	AVPR2	45	40
COC[C@](C)(O)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450599160	FE	On-Demand	Anodyne	GPBAR1	20	44
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccc(F)cc2OCC(F)F)cn1	ZINC000450599173	GI	On-Demand	Anodyne	F10	26	42
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccc(F)cc2OCC(F)F)cn1	ZINC000450599173	GI	On-Demand	Anodyne	GCK	26	41
CCn1c(Cc2ccccc2)nnc1SCC(=O)CC(C)(C)C1CC1	ZINC000450599195	FI	On-Demand	Anodyne	SLC27A1	47	40
OCCCN1CCC[C@H]1CNc1nccc(OCc2ccccc2)n1	ZINC000450599201	EE	On-Demand	Anodyne	GRIN2B	18	40
OCCCN1CCC[C@@H]1CNc1nccc(OCc2ccccc2)n1	ZINC000450599202	EE	On-Demand	Anodyne	GRIN2B	18	40
Cc1cc(NC[C@H]2CCCN2CCCO)n2ncnc2n1	ZINC000450599209	CC	On-Demand	Anodyne	DHOD	0	48
Cc1cc(NC[C@@H]2CCCN2CCCO)n2ncnc2n1	ZINC000450599210	CC	On-Demand	Anodyne	DHOD	0	48
Cc1ccc2c(NC[C@@H]3CCCN3CCCO)ccnc2n1	ZINC000450599215	DE	On-Demand	Anodyne	HNMT	41	31
Cc1ccc2c(NC[C@H]3CCCN3CCCO)ccnc2n1	ZINC000450599216	DE	On-Demand	Anodyne	HNMT	41	31
Clc1ccc(CCN2CCC[C@H](c3nncn3C3CC3)C2)cc1	ZINC000450599236	EH	On-Demand	Anodyne	BIRC2	32	40
Clc1ccc(CCN2CCC[C@@H](c3nncn3C3CC3)C2)cc1	ZINC000450599237	EH	On-Demand	Anodyne	BIRC2	32	40
CCOC(=O)CNC(=O)C1CCN(Cc2cc(Br)ccc2C)CC1	ZINC000450599254	GF	On-Demand	Anodyne	CACNA1G	42	42
CCS(=O)(=O)c1ccc(CN2CCCC[C@H](SC)C2)cc1	ZINC000450599255	EG	On-Demand	Anodyne	HRH3	21	41
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H](SC)C2)cc1	ZINC000450599256	EG	On-Demand	Anodyne	HRH3	21	41
CCC[C@@H](OC)C(=O)Nc1cccc(-n2cnnc2O)c1	ZINC000450599269	CD	On-Demand	Anodyne	PARP10	0	44
CCC[C@H](OC)C(=O)Nc1cccc(-n2cnnc2O)c1	ZINC000450599272	CD	On-Demand	Anodyne	PARP10	0	44
C[C@@H](CN1CCC[C@@H](Nc2ccccc2)C1)S(C)(=O)=O	ZINC000450599301	CD	On-Demand	Anodyne	BIRC2	46	42
C[C@H](CN1CCC[C@H](Nc2ccccc2)C1)S(C)(=O)=O	ZINC000450599303	CD	On-Demand	Anodyne	BIRC2	46	42
C[C@H](CN1CCC[C@@H](Nc2ccccc2)C1)S(C)(=O)=O	ZINC000450599305	CD	On-Demand	Anodyne	BIRC2	46	42
C[C@@H](CN1CCC[C@H](Nc2ccccc2)C1)S(C)(=O)=O	ZINC000450599306	CD	On-Demand	Anodyne	BIRC2	46	42
O=c1c(Cl)c(N2CC[C@H](F)C2)cnn1-c1cccc(C(F)(F)F)c1	ZINC000450599308	FG	On-Demand	Anodyne	LIPG	50	37
O=c1c(Cl)c(N2CC[C@@H](F)C2)cnn1-c1cccc(C(F)(F)F)c1	ZINC000450599311	FG	On-Demand	Anodyne	LIPG	50	37
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2[C@H](C)CC(C)C	ZINC000450599314	CD	On-Demand	Anodyne	SLC6A1	66	36
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2[C@@H](C)CC(C)C	ZINC000450599317	CD	On-Demand	Anodyne	SLC6A1	66	36
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2[C@H](C)CC(C)C	ZINC000450599319	CD	On-Demand	Anodyne	SLC6A1	66	36
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2[C@@H](C)CC(C)C	ZINC000450599321	CD	On-Demand	Anodyne	SLC6A1	66	36
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599324	CC	On-Demand	Anodyne	SLC6A1	91	43
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599324	CC	On-Demand	Anodyne	SLC6A4	25	43
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599324	CC	On-Demand	Anodyne	SLC6A3	47	44
CCOC(=O)[C@@](C)(O)CNC(=O)c1cnn2ccc(C)cc12	ZINC000450599334	DC	On-Demand	Anodyne	EPHB3	34	48
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599335	CC	On-Demand	Anodyne	SLC6A1	91	43
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599335	CC	On-Demand	Anodyne	SLC6A4	25	43
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599335	CC	On-Demand	Anodyne	SLC6A3	47	44
CCOC(=O)[C@](C)(O)CNC(=O)c1cnn2ccc(C)cc12	ZINC000450599336	DC	On-Demand	Anodyne	EPHB3	34	48
CCC[C@@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599338	CC	On-Demand	Anodyne	SLC6A1	91	43
CCC[C@@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599338	CC	On-Demand	Anodyne	SLC6A4	25	43
CCC[C@@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450599338	CC	On-Demand	Anodyne	SLC6A3	47	44
COC[C@](C)(O)CCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450599339	DF	On-Demand	Mild	AR	22	48
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@H]2C(=O)OC	ZINC000450599341	CC	On-Demand	Anodyne	SLC6A1	91	43
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@H]2C(=O)OC	ZINC000450599341	CC	On-Demand	Anodyne	SLC6A4	25	43
CCC[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@H]2C(=O)OC	ZINC000450599341	CC	On-Demand	Anodyne	SLC6A3	47	44
COC[C@@](C)(O)CCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450599342	DF	On-Demand	Mild	AR	22	48
COC(=O)[C@@H](NCCCNc1ncnc2cc(F)c(OC)cc12)C(C)C	ZINC000450599352	FD	On-Demand	Anodyne	EGFR	51	43
COC(=O)[C@@H](NCCCNc1ncnc2cc(F)c(OC)cc12)C(C)C	ZINC000450599352	FD	On-Demand	Anodyne	ERBB2	19	41
COC(=O)[C@@H](NCCCNc1ncnc2cc(F)c(OC)cc12)C(C)C	ZINC000450599352	FD	On-Demand	Anodyne	PDE6A	41	31
COc1cc(CN2CCN(c3nccn3C)CC2)ccc1Cl	ZINC000450599369	DE	On-Demand	Anodyne	DRD2	19	41
COc1cc(CN2CCN(c3nccn3C)CC2)ccc1Cl	ZINC000450599369	DE	On-Demand	Anodyne	DRD1	19	46
COc1cc(CN2CCN(c3nccn3C)CC2)ccc1Cl	ZINC000450599369	DE	On-Demand	Anodyne	DRD4	27	41
COc1cc(CN2CCN(c3nccn3C)CC2)ccc1Cl	ZINC000450599369	DE	On-Demand	Anodyne	DRD3	22	42
COc1cc(CN2CCN(c3nccn3C)CC2)ccc1Cl	ZINC000450599369	DE	On-Demand	Anodyne	SIGMAR1	18	42
COc1cc(CN2CCN(c3nccn3C)CC2)ccc1Cl	ZINC000450599369	DE	On-Demand	Anodyne	SSTR5	51	37
COc1cc(CC(=O)NCCC2CCC(OC)CC2)ccc1Cl	ZINC000450599375	EH	On-Demand	Anodyne	HTR4	45	41
COc1cc(CC(=O)NCCC2CCC(OC)CC2)ccc1Cl	ZINC000450599375	EH	On-Demand	Anodyne	TRPV1	33	46
COc1cc(CC(=O)NCCC2CCC(OC)CC2)ccc1Cl	ZINC000450599375	EH	On-Demand	Anodyne	NCE103	25	48
COc1cc(CC(=O)NCCC2CCC(OC)CC2)ccc1Cl	ZINC000450599375	EH	On-Demand	Anodyne	CAN2	0	48
CCN1C(=O)CCc2cc(NC(=O)[C@H]3Cc4cccc(C)c4O3)ccc21	ZINC000450599382	FG	On-Demand	Anodyne	NAMPT	23	43
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3Cc4cccc(C)c4O3)ccc21	ZINC000450599383	FG	On-Demand	Anodyne	NAMPT	23	43
Cc1nccc(N2CCN(C(=O)C[C@@H]3CC[C@@H]4C[C@H]34)CC2)n1	ZINC000450599384	DD	On-Demand	Anodyne	SORD	48	38
Cc1nccc(N2CCN(C(=O)C[C@@H]3CC[C@H]4C[C@H]34)CC2)n1	ZINC000450599392	DD	On-Demand	Anodyne	SORD	55	38
Cc1nccc(N2CCN(C(=O)C[C@@H]3CC[C@@H]4C[C@@H]34)CC2)n1	ZINC000450599394	DD	On-Demand	Anodyne	SORD	55	38
Cc1nccc(N2CCN(C(=O)C[C@@H]3CC[C@H]4C[C@@H]34)CC2)n1	ZINC000450599397	DD	On-Demand	Anodyne	SORD	48	38
F[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450599410	CH	On-Demand	Anodyne	ADRB2	15	55
F[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450599410	CH	On-Demand	Anodyne	ADRB3	20	57
CC(C)(C)c1cc(CSc2nc3cc(Br)cnc3[nH]2)no1	ZINC000450599416	FI	On-Demand	Anodyne	ENPP1	16	42
F[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450599424	CH	On-Demand	Anodyne	ADRB2	15	55
F[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450599424	CH	On-Demand	Anodyne	ADRB3	20	57
COC[C@](C)(O)CCNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450599427	CC	On-Demand	Bother	TAAR1	17	46
COC[C@@](C)(O)CCNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450599428	CC	On-Demand	Bother	TAAR1	17	46
Cc1nc2ccnn2cc1C(=O)NCCOC(C)C	ZINC000450599429	CD	On-Demand	Anodyne	DDR1	57	41
COc1cc(CN(C)CCCn2ccnc2C)ccc1Cl	ZINC000450599435	DG	On-Demand	Anodyne	CACNA1C	16	40
FC1(F)CC(CSc2nc3cc(Br)cnc3[nH]2)C1	ZINC000450599470	EH	On-Demand	Anodyne	ENPP1	16	42
CCc1cccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)n1	ZINC000450599482	GI	On-Demand	Anodyne	HRH1	34	41
CCc1cccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)n1	ZINC000450599482	GI	On-Demand	Anodyne	PRSS2	76	33
CCc1cccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)n1	ZINC000450599482	GI	On-Demand	Anodyne	HRH3	17	44
CCc1cccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)n1	ZINC000450599482	GI	On-Demand	Anodyne	CCR3	30	41
CCc1cccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)n1	ZINC000450599482	GI	On-Demand	Anodyne	CCR5	26	41
CCc1cccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)n1	ZINC000450599482	GI	On-Demand	Anodyne	L3MBTL1	0	42
CCc1cccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)n1	ZINC000450599482	GI	On-Demand	Anodyne	MBTD1	0	41
Cc1ccnc(N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)n1	ZINC000450599494	CH	On-Demand	Anodyne	SORD	41	33
Cc1ccnc(N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)n1	ZINC000450599495	CH	On-Demand	Anodyne	SORD	41	33
Cc1ccnc(N2[C@@H](C)[C@H](c3ccccc3)C[C@H]2C)n1	ZINC000450599496	CH	On-Demand	Anodyne	SORD	41	33
Cc1ccnc(N2[C@@H](C)[C@@H](c3ccccc3)C[C@H]2C)n1	ZINC000450599497	CH	On-Demand	Anodyne	SORD	41	33
COc1nccc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)n1	ZINC000450599499	FE	On-Demand	Bother	PTR1	30	40
COC(=O)[C@@H](O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450599505	DE	On-Demand	Anodyne	MMP2	40	34
COC(=O)[C@H](O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450599506	DE	On-Demand	Anodyne	MMP2	40	34
CC(C)C[C@@H](CN1CCCC1)Nc1ccnc2c1cnn2C	ZINC000450599541	DF	On-Demand	Anodyne	HNMT	51	35
CCn1c(Cc2ccccc2)nnc1SCc1nnc(C2CC2)s1	ZINC000450599542	FH	On-Demand	Anodyne	SLC27A1	42	34
CCOC(=O)CNC(=O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450599621	GF	On-Demand	Anodyne	HTR4	57	42
CCOC(=O)CNC(=O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450599621	GF	On-Demand	Anodyne	P2RX7	16	40
CCOC(=O)CNC(=O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450599621	GF	On-Demand	Anodyne	EPHX2	22	41
CCOC(=O)CNC(=O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450599621	GF	On-Demand	Anodyne	CACNA1G	45	46
CCOC(=O)CNC(=O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450599621	GF	On-Demand	Anodyne	CACNA1I	50	37
OCCCN1CCC[C@H]1CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450599624	GE	On-Demand	Anodyne	ROS1	51	38
OCCCN1CCC[C@@H]1CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450599625	GE	On-Demand	Anodyne	ROS1	51	38
CCn1c(Cc2ccccc2)nnc1SCn1cccn1	ZINC000450599632	CF	On-Demand	Anodyne	SLC27A1	47	40
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450599635	GD	On-Demand	Bother	BDKRB1	0	41
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450599635	GD	On-Demand	Bother	BCL2L1	90	33
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450599635	GD	On-Demand	Bother	BCL2	68	32
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450599635	GD	On-Demand	Bother	BCL2L2	42	33
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450599636	GD	On-Demand	Bother	BDKRB1	0	41
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450599636	GD	On-Demand	Bother	BCL2L1	90	33
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450599636	GD	On-Demand	Bother	BCL2	68	32
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450599636	GD	On-Demand	Bother	BCL2L2	42	33
COC(=O)c1cn(C2CCN(C(=O)c3cc(-c4ccccc4)nn3C)CC2)nn1	ZINC000450599663	GD	On-Demand	Anodyne	MAP3K7	44	36
COC[C@@](C)(O)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450599676	FD	On-Demand	Bother	BDKRB1	0	45
COC[C@](C)(O)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450599677	FD	On-Demand	Bother	BDKRB1	0	45
CN1CCN(CC2(C)CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000450599692	GE	On-Demand	Anodyne	ERBB2	0	43
CN1CCN(CC2(C)CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000450599692	GE	On-Demand	Anodyne	MMP2	0	43
CN1CCN(CC2(C)CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000450599692	GE	On-Demand	Anodyne	ADAM10	38	43
CN1CCN(CC2(C)CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000450599693	GE	On-Demand	Anodyne	ERBB2	0	43
CN1CCN(CC2(C)CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000450599693	GE	On-Demand	Anodyne	MMP2	0	43
CN1CCN(CC2(C)CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000450599693	GE	On-Demand	Anodyne	ADAM10	38	43
CC(=O)CCCCCSc1ncnc2c1cnn2-c1ccccc1	ZINC000450599698	EI	On-Demand	Anodyne	GCK	24	42
Cc1cc(C)cc(OCC(=O)N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450599719	FE	On-Demand	Anodyne	CPT2	40	37
Cc1cc(C)cc(OCC(=O)N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450599720	FE	On-Demand	Anodyne	CPT2	40	37
CCCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450599762	FH	On-Demand	Anodyne	HRH3	18	49
CCCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450599762	FH	On-Demand	Anodyne	MMP13	20	41
CCCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450599762	FH	On-Demand	Anodyne	ADAM17	21	41
CCCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450599762	FH	On-Demand	Anodyne	NOD1	29	40
CCCOc1ccc2c(c1)CCN(Cc1ccc(S(=O)(=O)CC)cc1)C2	ZINC000450599762	FH	On-Demand	Anodyne	NOD2	47	43
CC[C@H]1CN(C(=O)CC2CC(F)(F)C2)CCN1Cc1ccccc1	ZINC000450599767	EH	On-Demand	Anodyne	SIGMAR1	24	42
CC[C@@H]1CN(C(=O)CC2CC(F)(F)C2)CCN1Cc1ccccc1	ZINC000450599769	EH	On-Demand	Anodyne	SIGMAR1	24	42
CC[C@@H](O)CC(=O)N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1	ZINC000450599802	EI	On-Demand	Anodyne	AKT1	20	42
CC[C@@H](O)CC(=O)N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1	ZINC000450599804	EI	On-Demand	Anodyne	AKT1	20	42
CC[C@H](O)CC(=O)N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1	ZINC000450599805	EI	On-Demand	Anodyne	AKT1	20	42
CC[C@H](O)CC(=O)N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1	ZINC000450599807	EI	On-Demand	Anodyne	AKT1	20	42
OCCCN1CCC[C@@H]1CNc1ncccc1OCc1ccccc1	ZINC000450599810	EF	On-Demand	Anodyne	PPIA	41	39
OCCCN1CCC[C@H]1CNc1ncccc1OCc1ccccc1	ZINC000450599811	EF	On-Demand	Anodyne	PPIA	41	39
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599818	DF	On-Demand	Anodyne	DRD2	66	40
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599818	DF	On-Demand	Anodyne	DRD4	0	45
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599818	DF	On-Demand	Anodyne	DRD3	0	45
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599818	DF	On-Demand	Anodyne	SLC18A3	0	41
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599818	DF	On-Demand	Anodyne	HTR3B	0	42
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599818	DF	On-Demand	Anodyne	CYP2J2	49	37
COC(=O)C[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599818	DF	On-Demand	Anodyne	ACKR3	54	36
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599819	DF	On-Demand	Anodyne	DRD2	66	40
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599819	DF	On-Demand	Anodyne	DRD4	0	45
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599819	DF	On-Demand	Anodyne	DRD3	0	45
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599819	DF	On-Demand	Anodyne	SLC18A3	0	41
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599819	DF	On-Demand	Anodyne	HTR3B	0	42
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599819	DF	On-Demand	Anodyne	CYP2J2	49	37
COC(=O)C[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450599819	DF	On-Demand	Anodyne	ACKR3	54	36
COC(=O)C[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599820	CF	On-Demand	Anodyne	DRD2	58	48
COC(=O)C[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599820	CF	On-Demand	Anodyne	DRD3	25	44
COC(=O)C[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599820	CF	On-Demand	Anodyne	HTR4	58	36
COC(=O)C[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599820	CF	On-Demand	Anodyne	CCR3	30	43
COC(=O)C[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599820	CF	On-Demand	Anodyne	ACKR3	61	31
COC(=O)C[C@@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599821	CF	On-Demand	Anodyne	DRD2	58	48
COC(=O)C[C@@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599821	CF	On-Demand	Anodyne	DRD3	25	44
COC(=O)C[C@@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599821	CF	On-Demand	Anodyne	HTR4	58	36
COC(=O)C[C@@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599821	CF	On-Demand	Anodyne	CCR3	30	43
COC(=O)C[C@@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450599821	CF	On-Demand	Anodyne	ACKR3	61	31
C[C@]1(C(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)CC=CCC1	ZINC000450599829	FE	On-Demand	Anodyne	GRIN1	53	39
C[C@@]1(C(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)CC=CCC1	ZINC000450599832	FE	On-Demand	Anodyne	GRIN1	53	39
CC(C)NC(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450599836	CE	On-Demand	Bother	TAAR1	35	49
CC(C)NC(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450599839	CE	On-Demand	Bother	TAAR1	35	49
CN1CCN(CC2(C)CCN(C(=O)c3cc4c([nH]3)CCCC4)CC2)CC1	ZINC000450599842	FE	On-Demand	Anodyne	HRH4	28	70
CC(C)(CS(C)(=O)=O)NC(=O)c1cc2ccncc2s1	ZINC000450599880	DD	On-Demand	Anodyne	VCAM1	40	33
O=C(c1ccc(NC[C@@H]2CCCN2CCCO)nc1)N1CCc2ccccc21	ZINC000450599882	GF	On-Demand	Anodyne	AVPR2	80	40
O=C(c1ccc(NC[C@@H]2CCCN2CCCO)nc1)N1CCc2ccccc21	ZINC000450599882	GF	On-Demand	Anodyne	AVPR1A	42	40
O=C(c1ccc(NC[C@H]2CCCN2CCCO)nc1)N1CCc2ccccc21	ZINC000450599884	GF	On-Demand	Anodyne	AVPR2	80	40
O=C(c1ccc(NC[C@H]2CCCN2CCCO)nc1)N1CCc2ccccc21	ZINC000450599884	GF	On-Demand	Anodyne	AVPR1A	42	40
OCCCN1CCC[C@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450599888	ED	On-Demand	Anodyne	DHOD	0	46
OCCCN1CCC[C@@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450599890	ED	On-Demand	Anodyne	DHOD	0	46
CC(C)(C)OC1CC(Sc2nnc(CN3CCCC3)n2-c2ccccc2)C1	ZINC000450599892	GI	On-Demand	Anodyne	VCP	72	47
Cc1nccc(N2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450599903	FG	On-Demand	Anodyne	ERBB2	0	41
Cc1nccc(N2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450599903	FG	On-Demand	Anodyne	SSTR3	47	34
Cc1nccc(N2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450599903	FG	On-Demand	Anodyne	SORD	68	37
Cc1nccc(N2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450599903	FG	On-Demand	Anodyne	NPBWR1	70	35
OCCCN1CCC[C@H]1CNc1cc(N2CCCCC2)ncn1	ZINC000450599904	DD	On-Demand	Anodyne	PRCP	0	41
Cc1nccc(N2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450599905	FG	On-Demand	Anodyne	ERBB2	0	41
Cc1nccc(N2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450599905	FG	On-Demand	Anodyne	SSTR3	47	34
Cc1nccc(N2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450599905	FG	On-Demand	Anodyne	SORD	68	37
Cc1nccc(N2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450599905	FG	On-Demand	Anodyne	NPBWR1	70	35
OCCCN1CCC[C@@H]1CNc1cc(N2CCCCC2)ncn1	ZINC000450599906	DD	On-Demand	Anodyne	PRCP	0	41
Cc1nccc(N2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450599908	FG	On-Demand	Anodyne	ERBB2	0	41
Cc1nccc(N2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450599908	FG	On-Demand	Anodyne	SSTR3	47	34
Cc1nccc(N2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450599908	FG	On-Demand	Anodyne	SORD	68	37
Cc1nccc(N2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450599908	FG	On-Demand	Anodyne	NPBWR1	70	35
Cc1nccc(N2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450599909	FG	On-Demand	Anodyne	ERBB2	0	41
Cc1nccc(N2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450599909	FG	On-Demand	Anodyne	SSTR3	47	34
Cc1nccc(N2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450599909	FG	On-Demand	Anodyne	SORD	68	37
Cc1nccc(N2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450599909	FG	On-Demand	Anodyne	NPBWR1	70	35
COCCn1cc2c(n1)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)CCC2	ZINC000450599913	FE	On-Demand	Anodyne	ACE	34	41
COCCn1cc2c(n1)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)CCC2	ZINC000450599913	FE	On-Demand	Anodyne	MME	30	41
COCCn1cc2c(n1)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)CCC2	ZINC000450599916	FE	On-Demand	Anodyne	ACE	34	41
COCCn1cc2c(n1)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)CCC2	ZINC000450599916	FE	On-Demand	Anodyne	MME	30	41
COCCn1cc2c(n1)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)CCC2	ZINC000450599918	FE	On-Demand	Anodyne	ACE	34	41
COCCn1cc2c(n1)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)CCC2	ZINC000450599918	FE	On-Demand	Anodyne	MME	30	41
COCCn1cc2c(n1)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)CCC2	ZINC000450599919	FE	On-Demand	Anodyne	ACE	34	41
COCCn1cc2c(n1)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)CCC2	ZINC000450599919	FE	On-Demand	Anodyne	MME	30	41
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599926	GG	On-Demand	Anodyne	MC4R	67	40
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599926	GG	On-Demand	Anodyne	PRCP	59	41
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599926	GG	On-Demand	Anodyne	MC3R	52	40
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599926	GG	On-Demand	Anodyne	MC5R	38	40
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599926	GG	On-Demand	Anodyne	SORD	40	35
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599926	GG	On-Demand	Anodyne	NPBWR1	75	39
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599930	GG	On-Demand	Anodyne	MC4R	67	40
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599930	GG	On-Demand	Anodyne	PRCP	59	41
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599930	GG	On-Demand	Anodyne	MC3R	52	40
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599930	GG	On-Demand	Anodyne	MC5R	38	40
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599930	GG	On-Demand	Anodyne	SORD	40	35
Cc1nccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599930	GG	On-Demand	Anodyne	NPBWR1	75	39
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599931	GG	On-Demand	Anodyne	MC4R	67	40
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599931	GG	On-Demand	Anodyne	PRCP	59	41
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599931	GG	On-Demand	Anodyne	MC3R	52	40
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599931	GG	On-Demand	Anodyne	MC5R	38	40
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599931	GG	On-Demand	Anodyne	SORD	40	35
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599931	GG	On-Demand	Anodyne	NPBWR1	75	39
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599932	GG	On-Demand	Anodyne	MC4R	67	40
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599932	GG	On-Demand	Anodyne	PRCP	59	41
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599932	GG	On-Demand	Anodyne	MC3R	52	40
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599932	GG	On-Demand	Anodyne	MC5R	38	40
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599932	GG	On-Demand	Anodyne	SORD	40	35
Cc1nccc(N2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)n1	ZINC000450599932	GG	On-Demand	Anodyne	NPBWR1	75	39
COc1cc2nc(N3CC[C@@H](F)C3)[nH]c(=N)c2cc1OC	ZINC000450599946	CD	On-Demand	Anodyne	PDE3A	49	38
COc1cc2nc(N3CC[C@@H](F)C3)[nH]c(=N)c2cc1OC	ZINC000450599946	CD	On-Demand	Anodyne	CCR4	45	42
COc1cc2nc(N3CC[C@@H](F)C3)[nH]c(=N)c2cc1OC	ZINC000450599946	CD	On-Demand	Anodyne	PDE3B	72	38
COc1cc2nc(N3CC[C@@H](F)C3)[nH]c(=N)c2cc1OC	ZINC000450599946	CD	On-Demand	Anodyne	EHMT2	45	39
COc1cc2nc(N3CC[C@H](F)C3)[nH]c(=N)c2cc1OC	ZINC000450599947	CD	On-Demand	Anodyne	PDE3A	49	38
COc1cc2nc(N3CC[C@H](F)C3)[nH]c(=N)c2cc1OC	ZINC000450599947	CD	On-Demand	Anodyne	CCR4	45	42
COc1cc2nc(N3CC[C@H](F)C3)[nH]c(=N)c2cc1OC	ZINC000450599947	CD	On-Demand	Anodyne	PDE3B	72	38
COc1cc2nc(N3CC[C@H](F)C3)[nH]c(=N)c2cc1OC	ZINC000450599947	CD	On-Demand	Anodyne	EHMT2	45	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599948	ED	On-Demand	Anodyne	SLC6A1	125	46
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599948	ED	On-Demand	Anodyne	SLC6A4	36	48
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599948	ED	On-Demand	Anodyne	SLC6A3	67	52
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599949	ED	On-Demand	Anodyne	SLC6A1	125	46
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599949	ED	On-Demand	Anodyne	SLC6A4	36	48
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599949	ED	On-Demand	Anodyne	SLC6A3	67	52
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599950	ED	On-Demand	Anodyne	SLC6A1	125	46
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599950	ED	On-Demand	Anodyne	SLC6A4	36	48
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccc(C(C)=O)c1	ZINC000450599950	ED	On-Demand	Anodyne	SLC6A3	67	52
COc1ccc(CNC(=O)CCN(C)CCC2CC2)c(OC)c1	ZINC000450599961	DE	On-Demand	Anodyne	MTR1B_CHICK	0	42
CN(C)CCNS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450599962	FC	On-Demand	Bother	BCL2L1	45	33
CN(C)CCNS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450599962	FC	On-Demand	Bother	BCL2	46	31
CN(C)CCNS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450599963	FC	On-Demand	Bother	BCL2L1	45	33
CN(C)CCNS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450599963	FC	On-Demand	Bother	BCL2	46	31
COc1cc(CC(=O)N2CCN(c3ccnc(C)n3)CC2)ccc1Cl	ZINC000450599964	FE	On-Demand	Anodyne	CCR1	26	49
COc1cc(CC(=O)N2CCN(c3ccnc(C)n3)CC2)ccc1Cl	ZINC000450599964	FE	On-Demand	Anodyne	SORD	43	38
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450599965	FD	On-Demand	Anodyne	SLC6A1	133	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450599965	FD	On-Demand	Anodyne	SLC6A4	35	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450599965	FD	On-Demand	Anodyne	SLC6A3	82	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450599966	FD	On-Demand	Anodyne	SLC6A1	133	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450599966	FD	On-Demand	Anodyne	SLC6A4	35	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450599966	FD	On-Demand	Anodyne	SLC6A3	82	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450599967	FD	On-Demand	Anodyne	SLC6A1	133	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450599967	FD	On-Demand	Anodyne	SLC6A4	35	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450599967	FD	On-Demand	Anodyne	SLC6A3	82	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)[C@H](C)c1ccccc1	ZINC000450599968	FD	On-Demand	Anodyne	SLC6A1	133	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)[C@H](C)c1ccccc1	ZINC000450599968	FD	On-Demand	Anodyne	SLC6A4	35	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H](O)[C@H](C)c1ccccc1	ZINC000450599968	FD	On-Demand	Anodyne	SLC6A3	82	47
CC(C)(CS(C)(=O)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450599971	GF	On-Demand	Anodyne	AVPR1B	38	42
CC(C)(CS(C)(=O)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450599971	GF	On-Demand	Anodyne	PDE6D	73	38
CC(C)(CS(C)(=O)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450599971	GF	On-Demand	Anodyne	HDAC8	21	40
CC(C)(CS(C)(=O)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450599971	GF	On-Demand	Anodyne	HDAC6	16	41
CC(C)(CS(C)(=O)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450599971	GF	On-Demand	Anodyne	IMDH_CRYPV	37	54
COC(=O)[C@@H](NCCCNc1cnc2ccccc2n1)C(C)C	ZINC000450599972	DE	On-Demand	Anodyne	METG	49	33
CCCc1nc(C)c(CSc2nnc(Cc3ccccc3)n2CC)o1	ZINC000450599995	FI	On-Demand	Anodyne	SLC27A1	45	38
COC(=O)C[C@@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450600020	FD	On-Demand	Anodyne	DRD2	44	42
COC(=O)C[C@@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450600020	FD	On-Demand	Anodyne	MTNR1A	51	38
COC(=O)C[C@@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450600020	FD	On-Demand	Anodyne	MTNR1B	42	38
COC(=O)C[C@@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450600020	FD	On-Demand	Anodyne	ACKR3	66	33
COC(=O)C[C@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450600021	FD	On-Demand	Anodyne	DRD2	44	42
COC(=O)C[C@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450600021	FD	On-Demand	Anodyne	MTNR1A	51	38
COC(=O)C[C@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450600021	FD	On-Demand	Anodyne	MTNR1B	42	38
COC(=O)C[C@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450600021	FD	On-Demand	Anodyne	ACKR3	66	33
Cc1cnc(NC[C@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450600032	CD	On-Demand	Bother	PRKCQ	44	36
Cc1cnc(NC[C@@H]2CCCN2CCCO)c([N+](=O)[O-])c1	ZINC000450600033	CD	On-Demand	Bother	PRKCQ	44	36
OCCCN1CCC[C@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450600041	DE	On-Demand	Anodyne	MAOB	22	41
OCCCN1CCC[C@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450600041	DE	On-Demand	Anodyne	SPHK2	77	45
OCCCN1CCC[C@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450600041	DE	On-Demand	Anodyne	SPHK1	64	39
OCCCN1CCC[C@@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450600042	DE	On-Demand	Anodyne	MAOB	22	41
OCCCN1CCC[C@@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450600042	DE	On-Demand	Anodyne	SPHK2	77	45
OCCCN1CCC[C@@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450600042	DE	On-Demand	Anodyne	SPHK1	64	39
CCn1c(Cc2ccccc2)nnc1SC[C@H](Cc1ccccc1)OC	ZINC000450600049	FI	On-Demand	Anodyne	SLC27A1	43	37
CCn1c(Cc2ccccc2)nnc1SC[C@@H](Cc1ccccc1)OC	ZINC000450600050	FI	On-Demand	Anodyne	SLC27A1	43	37
OCCCN1CCC[C@@H]1CNc1ccnc2cc(F)cnc12	ZINC000450600051	DE	On-Demand	Anodyne	HNMT	45	31
OCCCN1CCC[C@H]1CNc1ccnc2cc(F)cnc12	ZINC000450600052	DE	On-Demand	Anodyne	HNMT	45	31
CN(CC1(O)CCC1)C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450600056	FE	On-Demand	Mild	TRPV4	41	31
COC(=O)[C@@H](NCCCNc1ncnc2cc(Cl)ccc12)C(C)C	ZINC000450600070	FE	On-Demand	Anodyne	HRP1_PLAFA	83	36
COC(=O)[C@@H](NCCCNc1ncnc2cc(Cl)ccc12)C(C)C	ZINC000450600070	FE	On-Demand	Anodyne	PDE6A	40	30
CC[C@@H](CC(C)C)C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450600084	DF	On-Demand	Anodyne	SORD	49	38
CC[C@H](CC(C)C)C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450600085	DF	On-Demand	Anodyne	SORD	49	38
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450600086	CD	On-Demand	Anodyne	SORD	70	41
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450600086	CD	On-Demand	Anodyne	NPBWR1	58	32
Cc1ccc2c(C)cc(N3CC[C@@H](F)C3)nc2c1	ZINC000450600087	BG	On-Demand	Anodyne	HRH4	17	41
Cc1ccc2c(C)cc(N3CC[C@H](F)C3)nc2c1	ZINC000450600088	BG	On-Demand	Anodyne	HRH4	17	41
COC(=O)c1ccc(CN2CCC[C@@H]([C@H]3CCOC3)C2)cc1Cl	ZINC000450600090	EG	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CCC[C@H]([C@H]3CCOC3)C2)cc1Cl	ZINC000450600091	EG	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)cc1Cl	ZINC000450600092	EG	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CCC[C@H]([C@@H]3CCOC3)C2)cc1Cl	ZINC000450600093	EG	On-Demand	Anodyne	DRD3	0	41
Cc1nccc(N2CCN(C(=O)[C@@H](C)Oc3ccccn3)CC2)n1	ZINC000450600106	ED	On-Demand	Anodyne	METAP1	35	41
Cc1nccc(N2CCN(C(=O)[C@@H](C)Oc3ccccn3)CC2)n1	ZINC000450600106	ED	On-Demand	Anodyne	SORD	30	45
Cc1nccc(N2CCN(C(=O)[C@H](C)Oc3ccccn3)CC2)n1	ZINC000450600107	ED	On-Demand	Anodyne	METAP1	35	41
Cc1nccc(N2CCN(C(=O)[C@H](C)Oc3ccccn3)CC2)n1	ZINC000450600107	ED	On-Demand	Anodyne	SORD	30	45
COCc1nc(N2CC[C@@H](F)C2)c2c(-c3ccccc3)csc2n1	ZINC000450600113	EI	On-Demand	Anodyne	ADRB3	27	43
COCc1nc(N2CC[C@H](F)C2)c2c(-c3ccccc3)csc2n1	ZINC000450600114	EI	On-Demand	Anodyne	ADRB3	27	43
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450600117	FH	On-Demand	Anodyne	DRD3	0	41
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450600117	FH	On-Demand	Anodyne	HRH3	16	41
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450600117	FH	On-Demand	Anodyne	CCR2	18	47
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450600117	FH	On-Demand	Anodyne	NPFFR1	42	32
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450600119	FH	On-Demand	Anodyne	DRD3	0	41
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450600119	FH	On-Demand	Anodyne	HRH3	16	41
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450600119	FH	On-Demand	Anodyne	CCR2	18	47
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450600119	FH	On-Demand	Anodyne	NPFFR1	42	32
COc1nccc(CNc2cc(N3CCC[C@@H](CO)C3)ncn2)n1	ZINC000450600124	ED	On-Demand	Anodyne	PRCP	0	40
COCCn1cc2c(n1)[C@@H](NC(=O)c1cn(-c3cccc(OC)c3)nn1)CCC2	ZINC000450600125	GD	On-Demand	Anodyne	DRD4	42	33
COc1nccc(CNc2cc(N3CCC[C@H](CO)C3)ncn2)n1	ZINC000450600126	ED	On-Demand	Anodyne	PRCP	0	40
COCCn1cc2c(n1)[C@H](NC(=O)c1cn(-c3cccc(OC)c3)nn1)CCC2	ZINC000450600127	GD	On-Demand	Anodyne	DRD4	42	33
COc1nccc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])n1	ZINC000450600128	EE	On-Demand	Bother	TAAR1	18	46
CCC[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)C(=O)OC	ZINC000450600129	DG	On-Demand	Anodyne	TIMP3	68	38
CCC[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)C(=O)OC	ZINC000450600131	DG	On-Demand	Anodyne	TIMP3	68	38
CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450600145	EF	On-Demand	Anodyne	RORC	17	41
CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450600149	EF	On-Demand	Anodyne	RORC	17	41
CC(C)N1CCCC[C@H]1CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450600160	DH	On-Demand	Anodyne	BIRC2	42	38
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450600161	DH	On-Demand	Anodyne	BIRC2	42	38
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](Nc2ccccc2)C1	ZINC000450600162	DH	On-Demand	Anodyne	BIRC2	42	38
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](Nc2ccccc2)C1	ZINC000450600163	DH	On-Demand	Anodyne	BIRC2	42	38
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)ccc21	ZINC000450600167	EH	On-Demand	Anodyne	NAMPT	29	46
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)ccc21	ZINC000450600168	EH	On-Demand	Anodyne	NAMPT	29	46
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)ccc21	ZINC000450600169	EH	On-Demand	Anodyne	NAMPT	29	46
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)ccc21	ZINC000450600170	EH	On-Demand	Anodyne	NAMPT	29	46
CCC[C@H](NC(=O)[C@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450600172	DG	On-Demand	Anodyne	SLC6A3	18	42
CCC[C@H](NC(=O)[C@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450600172	DG	On-Demand	Anodyne	GPR88	0	42
CCC[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450600174	DG	On-Demand	Anodyne	SLC6A3	18	42
CCC[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450600174	DG	On-Demand	Anodyne	GPR88	0	42
CCC[C@H](NC(=O)[C@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450600176	DG	On-Demand	Anodyne	SLC6A3	18	42
CCC[C@H](NC(=O)[C@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450600176	DG	On-Demand	Anodyne	GPR88	0	42
CCC[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450600178	DG	On-Demand	Anodyne	SLC6A3	18	42
CCC[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450600178	DG	On-Demand	Anodyne	GPR88	0	42
CCC[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(=O)OC	ZINC000450600200	EF	On-Demand	Bother	PPXII	0	40
CCC[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(=O)OC	ZINC000450600201	EF	On-Demand	Bother	PPXII	0	40
CCCN1C(=O)CCc2cc(NC(=O)[C@@H](O)C3CCC3)ccc21	ZINC000450600202	DE	On-Demand	Anodyne	NAMPT	29	47
CCCN1C(=O)CCc2cc(NC(=O)[C@H](O)C3CCC3)ccc21	ZINC000450600203	DE	On-Demand	Anodyne	NAMPT	29	47
CCc1cc(NCCCN[C@H](C(=O)OC)C(C)C)n2ncnc2n1	ZINC000450600212	ED	On-Demand	Anodyne	DHOD	0	45
NC(=O)c1cc([N+](=O)[O-])cnc1NCC[C@H]1CCc2ccccc21	ZINC000450600213	EF	On-Demand	Bother	PRKCQ	34	40
NC(=O)c1cc([N+](=O)[O-])cnc1NCC[C@@H]1CCc2ccccc21	ZINC000450600214	EF	On-Demand	Bother	PRKCQ	34	40
CC(C)OCCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450600233	EG	On-Demand	Anodyne	AVPR1B	44	42
CC(C)OCCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450600233	EG	On-Demand	Anodyne	IMDH_CRYPV	39	55
CC(=O)CCCCCOc1cccc(C#N)c1	ZINC000450600250	BG	On-Demand	Mild	THRA	26	44
CC(=O)CCCCCOc1cccc(C#N)c1	ZINC000450600250	BG	On-Demand	Mild	P2RY12	0	40
CC(=O)CCCCCOc1cccc(C#N)c1	ZINC000450600250	BG	On-Demand	Mild	MTNR1A	17	42
CC(=O)CCCCCOc1cccc(C#N)c1	ZINC000450600250	BG	On-Demand	Mild	MTNR1B	22	42
CC(=O)CCCCCOc1cccc(C#N)c1	ZINC000450600250	BG	On-Demand	Mild	PLA2G4B	77	45
CC(=O)CCCCCOc1cccc(C#N)c1	ZINC000450600250	BG	On-Demand	Mild	ACR	30	42
CN(CCN1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1)Cc1ccccc1	ZINC000450600251	GE	On-Demand	Anodyne	SIGMAR1	18	40
CN(CCN1CCO[C@@H](CN2C(=O)c3ccccc3C2=O)C1)Cc1ccccc1	ZINC000450600252	GE	On-Demand	Anodyne	SIGMAR1	18	40
COc1nccc(CNc2ccnc(N3CCOCC3)n2)n1	ZINC000450600264	DC	On-Demand	Anodyne	EPHB4	40	34
COc1nccc(CNc2cc(N3CCC[C@@H](C)C3)ncn2)n1	ZINC000450600271	DE	On-Demand	Anodyne	PRCP	17	40
COc1nccc(CNc2cc(N3CCC[C@H](C)C3)ncn2)n1	ZINC000450600272	DE	On-Demand	Anodyne	PRCP	17	40
CCOC(=O)CNC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450600294	EE	On-Demand	Anodyne	SLC6A1	63	33
CCOC(=O)CNC(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450600294	EE	On-Demand	Anodyne	CACNA1G	36	44
CCOC(=O)CNC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450600295	EE	On-Demand	Anodyne	SLC6A1	63	33
CCOC(=O)CNC(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450600295	EE	On-Demand	Anodyne	CACNA1G	36	44
O=[N+]([O-])c1cc2ccccc2nc1NC[C@@H]1CCCN1CCCO	ZINC000450600299	ED	On-Demand	Bother	PRKCQ	45	35
O=[N+]([O-])c1cc2ccccc2nc1NC[C@H]1CCCN1CCCO	ZINC000450600300	ED	On-Demand	Bother	PRKCQ	45	35
CCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600304	EE	On-Demand	Anodyne	KLK3	63	34
CCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600304	EE	On-Demand	Anodyne	CTSB	38	42
CCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600304	EE	On-Demand	Anodyne	CAPNS1	53	41
CCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600304	EE	On-Demand	Anodyne	HLA-DRB1	46	37
CCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600304	EE	On-Demand	Anodyne	CAPN1	84	43
CCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600304	EE	On-Demand	Anodyne	CAPN2	108	45
CCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600304	EE	On-Demand	Anodyne	FPR1	52	36
CCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600304	EE	On-Demand	Anodyne	NPR	51	47
CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600305	EE	On-Demand	Anodyne	KLK3	63	34
CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600305	EE	On-Demand	Anodyne	CTSB	38	42
CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600305	EE	On-Demand	Anodyne	CAPNS1	53	41
CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600305	EE	On-Demand	Anodyne	HLA-DRB1	46	37
CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600305	EE	On-Demand	Anodyne	CAPN1	84	43
CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600305	EE	On-Demand	Anodyne	CAPN2	108	45
CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600305	EE	On-Demand	Anodyne	FPR1	52	36
CCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450600305	EE	On-Demand	Anodyne	NPR	51	47
CCc1cccc(C(=O)N2CCN(c3ccnc(C)n3)CC2)n1	ZINC000450600317	DD	On-Demand	Anodyne	SORD	67	40
C[C@H](c1ccccc1)[C@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450600318	EH	On-Demand	Bother	COLA	132	43
C[C@H](c1ccccc1)[C@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450600318	EH	On-Demand	Bother	PQSD	0	40
C[C@@H](c1ccccc1)[C@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450600319	EH	On-Demand	Bother	COLA	132	43
C[C@@H](c1ccccc1)[C@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450600319	EH	On-Demand	Bother	PQSD	0	40
C[C@H](c1ccccc1)[C@@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450600320	EH	On-Demand	Bother	COLA	132	43
C[C@H](c1ccccc1)[C@@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450600320	EH	On-Demand	Bother	PQSD	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450600321	EH	On-Demand	Bother	COLA	132	43
C[C@@H](c1ccccc1)[C@@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450600321	EH	On-Demand	Bother	PQSD	0	40
c1ccc(CCC[C@H]2CCCN(Cc3cnn[nH]3)C2)cc1	ZINC000450600324	CG	On-Demand	Anodyne	SIGMAR1	22	42
c1ccc(CCC[C@@H]2CCCN(Cc3cnn[nH]3)C2)cc1	ZINC000450600325	CG	On-Demand	Anodyne	SIGMAR1	22	42
F[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C1	ZINC000450600326	CE	On-Demand	Anodyne	PDE3B	53	33
F[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C1	ZINC000450600327	CE	On-Demand	Anodyne	PDE3B	53	33
Cc1nccc(N2CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC2)n1	ZINC000450600332	GE	On-Demand	Anodyne	P2RY12	80	36
Cc1nccc(N2CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC2)n1	ZINC000450600332	GE	On-Demand	Anodyne	SORD	72	38
Cc1nnc([C@@H](C)NC(=O)c2ccc(C(F)(F)F)cc2C)s1	ZINC000450600343	EH	On-Demand	Anodyne	SORT1	16	43
Cc1nnc([C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2C)s1	ZINC000450600344	EH	On-Demand	Anodyne	SORT1	16	43
Cc1ccn(-c2ccccc2C(=O)N2CCN(c3ccnc(C)n3)CC2)n1	ZINC000450600347	FE	On-Demand	Anodyne	SORD	55	37
Cc1ccn(-c2ccccc2C(=O)N2CCN(c3ccnc(C)n3)CC2)n1	ZINC000450600347	FE	On-Demand	Anodyne	SLC6A7	0	41
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC34CCSCC4)ccc21	ZINC000450600349	EG	On-Demand	Anodyne	NAMPT	27	46
CCN1C(=O)CCc2cc(NC(=O)[C@H]3CC34CCSCC4)ccc21	ZINC000450600350	EG	On-Demand	Anodyne	NAMPT	27	46
O=C(c1ccsn1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450600351	FH	On-Demand	Anodyne	HRH1	33	41
O=C(c1ccsn1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450600351	FH	On-Demand	Anodyne	PRSS2	44	31
O=C(c1ccsn1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450600351	FH	On-Demand	Anodyne	CCR3	31	41
O=C(c1ccsn1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450600351	FH	On-Demand	Anodyne	L3MBTL1	0	40
CN(CC1(O)CCC1)C(=O)c1ccc(I)cc1F	ZINC000450600372	FE	On-Demand	Anodyne	MAP2K1	20	42
OCCCN1CCC[C@@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450600385	EG	On-Demand	Anodyne	HRP1_PLAFA	100	37
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450600386	GE	On-Demand	Anodyne	CA2	16	42
OCCCN1CCC[C@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450600387	EG	On-Demand	Anodyne	HRP1_PLAFA	100	37
CC1CCN(C(=O)c2ccc(NC[C@H]3CCCN3CCCO)nc2)CC1	ZINC000450600399	FE	On-Demand	Anodyne	L3MBTL3	46	37
CC[C@H](CSC)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450600401	EG	On-Demand	Anodyne	PSBA	0	45
CC1CCN(C(=O)c2ccc(NC[C@@H]3CCCN3CCCO)nc2)CC1	ZINC000450600402	FE	On-Demand	Anodyne	L3MBTL3	46	37
CC[C@@H](CSC)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450600408	EG	On-Demand	Anodyne	PSBA	0	45
Cc1nccc(N2CCN(C(=O)[C@@H]3CC34CCSCC4)CC2)n1	ZINC000450600436	ED	On-Demand	Anodyne	SORD	43	36
Cc1nccc(N2CCN(C(=O)[C@H]3CC34CCSCC4)CC2)n1	ZINC000450600437	ED	On-Demand	Anodyne	SORD	43	36
Cc1nc(C)n(CCCC(=O)Nc2ccc(Br)c3ccccc23)n1	ZINC000450600444	GI	On-Demand	Anodyne	PTPN22	30	42
Cc1nccc(N2CCN(C(=O)[C@@H]3C[C@H]3CC(C)C)CC2)n1	ZINC000450600448	DE	On-Demand	Anodyne	SORD	49	34
COC(=O)c1ccc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1Cl	ZINC000450600453	FH	On-Demand	Anodyne	CCR3	33	41
COC(=O)c1ccc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1Cl	ZINC000450600453	FH	On-Demand	Anodyne	MCHR1	18	40
COC(=O)c1ccc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1Cl	ZINC000450600455	FH	On-Demand	Anodyne	CCR3	33	41
COC(=O)c1ccc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1Cl	ZINC000450600455	FH	On-Demand	Anodyne	MCHR1	18	40
COC(=O)c1ccc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)cc1Cl	ZINC000450600458	FH	On-Demand	Anodyne	CCR3	33	41
COC(=O)c1ccc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)cc1Cl	ZINC000450600458	FH	On-Demand	Anodyne	MCHR1	18	40
COC(=O)c1ccc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cc1Cl	ZINC000450600460	FH	On-Demand	Anodyne	CCR3	33	41
COC(=O)c1ccc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cc1Cl	ZINC000450600460	FH	On-Demand	Anodyne	MCHR1	18	40
COc1cccc(Oc2ccc(C(=O)NCCOC(C)C)nc2)c1	ZINC000450600488	EG	On-Demand	Anodyne	DRD4	45	34
COc1cccc(Oc2ccc(C(=O)NCCOC(C)C)nc2)c1	ZINC000450600488	EG	On-Demand	Anodyne	ACACA	41	40
COc1cccc(Oc2ccc(C(=O)NCCOC(C)C)nc2)c1	ZINC000450600488	EG	On-Demand	Anodyne	MTNR1B	50	44
CCC[C@H](O)CN1CCN(C(=O)COc2cc(C)cc(C)c2)CC1	ZINC000450600504	ED	On-Demand	Anodyne	ACOX1	49	32
CCC[C@@H](O)CN1CCN(C(=O)COc2cc(C)cc(C)c2)CC1	ZINC000450600505	ED	On-Demand	Anodyne	ACOX1	49	32
COc1cc(CN2CCN(c3nccn4cnnc34)[C@H](C)C2)ccc1Cl	ZINC000450600541	FE	On-Demand	Anodyne	DRD4	17	42
COc1cc(CN2CCN(c3nccn4cnnc34)[C@@H](C)C2)ccc1Cl	ZINC000450600542	FE	On-Demand	Anodyne	DRD4	17	42
COc1cccc(-n2cc(C(=O)NCCC3CCC(OC)CC3)nn2)c1	ZINC000450600548	FF	On-Demand	Anodyne	DRD4	47	37
COc1cccc(-n2cc(C(=O)NCCC3CCC(OC)CC3)nn2)c1	ZINC000450600548	FF	On-Demand	Anodyne	SIRT1	42	35
CC(=O)c1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)cc1	ZINC000450600549	EJ	On-Demand	Anodyne	COLA	76	40
CC(=O)c1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)cc1	ZINC000450600549	EJ	On-Demand	Anodyne	CPT1A	73	40
CC(=O)c1ccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)cc1	ZINC000450600550	EJ	On-Demand	Anodyne	COLA	76	40
CC(=O)c1ccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)cc1	ZINC000450600550	EJ	On-Demand	Anodyne	CPT1A	73	40
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2ccnn2CC(F)(F)F)C1	ZINC000450600558	EG	On-Demand	Anodyne	NAMPT	22	40
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccnn2CC(F)(F)F)C1	ZINC000450600559	EG	On-Demand	Anodyne	NAMPT	22	40
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccnn2CC(F)(F)F)C1	ZINC000450600560	EG	On-Demand	Anodyne	NAMPT	22	40
C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2ccnn2CC(F)(F)F)C1	ZINC000450600561	EG	On-Demand	Anodyne	NAMPT	22	40
COC1CCC(CCNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450600570	GG	On-Demand	Anodyne	CA9	22	42
COC1CCC(CCNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450600570	GG	On-Demand	Anodyne	E1	0	43
CO[C@H](Cc1ccccc1)C(=O)N(C)C1CC(O)C1	ZINC000450600585	CD	On-Demand	Anodyne	PPARA	15	40
CO[C@@H](Cc1ccccc1)C(=O)N(C)C1CC(O)C1	ZINC000450600586	CD	On-Demand	Anodyne	PPARA	15	40
COc1cc(CC(=O)N(C)CC2(O)CCC2)ccc1O	ZINC000450600589	CD	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N(C)C2CC(O)C2)ccc1Cl	ZINC000450600591	CD	On-Demand	Anodyne	OPRK1	31	46
OCCCN1CCC[C@@H]1CNc1ncnc2c1ncn2C1CC1	ZINC000450600601	DD	On-Demand	Anodyne	ADORA1	35	45
OCCCN1CCC[C@@H]1CNc1ncnc2c1ncn2C1CC1	ZINC000450600601	DD	On-Demand	Anodyne	ADORA2A	0	41
OCCCN1CCC[C@@H]1CNc1ncnc2c1ncn2C1CC1	ZINC000450600601	DD	On-Demand	Anodyne	Q4VQ11_PIG	41	39
OCCCN1CCC[C@H]1CNc1ncnc2c1ncn2C1CC1	ZINC000450600602	DD	On-Demand	Anodyne	ADORA1	35	45
OCCCN1CCC[C@H]1CNc1ncnc2c1ncn2C1CC1	ZINC000450600602	DD	On-Demand	Anodyne	ADORA2A	0	41
OCCCN1CCC[C@H]1CNc1ncnc2c1ncn2C1CC1	ZINC000450600602	DD	On-Demand	Anodyne	Q4VQ11_PIG	41	39
CCO[C@@H]1COCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450600605	FG	On-Demand	Anodyne	RBP4	57	34
CCO[C@@H]1COCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450600606	FG	On-Demand	Anodyne	RBP4	57	34
CCO[C@H]1COCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450600607	FG	On-Demand	Anodyne	RBP4	57	34
CCO[C@H]1COCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450600608	FG	On-Demand	Anodyne	RBP4	57	34
CCNC(=O)c1ccc(NC[C@@H]2CCCN2CCCO)nc1	ZINC000450600628	DD	On-Demand	Anodyne	IKBKB	0	49
CCNC(=O)c1ccc(NC[C@H]2CCCN2CCCO)nc1	ZINC000450600629	DD	On-Demand	Anodyne	IKBKB	0	49
C=CC(C)(C)C(=O)N1CCN(Cc2ccccc2)[C@@H](CC)C1	ZINC000450600635	DG	On-Demand	Mild	SIGMAR1	19	42
C=CC(C)(C)C(=O)N1CCN(Cc2ccccc2)[C@H](CC)C1	ZINC000450600637	DG	On-Demand	Mild	SIGMAR1	19	42
OCCCN1CCC[C@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450600639	FG	On-Demand	Anodyne	HRP1_PLAFA	88	41
OCCCN1CCC[C@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450600639	FG	On-Demand	Anodyne	HNMT	69	42
OCCCN1CCC[C@@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450600640	FG	On-Demand	Anodyne	HRP1_PLAFA	88	41
OCCCN1CCC[C@@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450600640	FG	On-Demand	Anodyne	HNMT	69	42
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450600670	FI	On-Demand	Bother	F2RL3	45	33
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450600675	FI	On-Demand	Bother	F2RL3	45	33
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450600676	FI	On-Demand	Bother	F2RL3	45	33
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450600677	FI	On-Demand	Bother	F2RL3	45	33
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)cc1Cl	ZINC000450600678	GE	On-Demand	Anodyne	SLC6A1	103	44
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)cc1Cl	ZINC000450600678	GE	On-Demand	Anodyne	SLC6A4	31	44
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)cc1Cl	ZINC000450600678	GE	On-Demand	Anodyne	SLC6A3	54	47
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)cc1Cl	ZINC000450600681	GE	On-Demand	Anodyne	SLC6A1	103	44
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)cc1Cl	ZINC000450600681	GE	On-Demand	Anodyne	SLC6A4	31	44
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)cc1Cl	ZINC000450600681	GE	On-Demand	Anodyne	SLC6A3	54	47
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)cc1Cl	ZINC000450600683	GE	On-Demand	Anodyne	SLC6A1	103	44
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)cc1Cl	ZINC000450600683	GE	On-Demand	Anodyne	SLC6A4	31	44
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)cc1Cl	ZINC000450600683	GE	On-Demand	Anodyne	SLC6A3	54	47
Cn1ccnc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450600686	FE	On-Demand	Anodyne	DRD4	26	40
Cc1ccc(CC(=O)N2CCN(c3ccnc(C)n3)CC2)c(Br)c1	ZINC000450600698	GF	On-Demand	Anodyne	SORD	62	41
Cc1nnc([C@H](C)NC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450600704	EF	On-Demand	Anodyne	CTSV	52	42
Cc1nnc([C@@H](C)NC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450600708	EF	On-Demand	Anodyne	CTSV	52	42
CCN1C(=O)CCc2cc(NC(=O)c3cn4nccc4nc3C)ccc21	ZINC000450600711	EF	On-Demand	Anodyne	DDR1	51	34
N#Cc1cc(Cl)ccc1N1CC[C@H](F)C1	ZINC000450600739	BF	On-Demand	Mild	NOS2	19	40
N#Cc1cc(Cl)ccc1N1CC[C@H](F)C1	ZINC000450600739	BF	On-Demand	Mild	NOS3	17	40
N#Cc1cc(Cl)ccc1N1CC[C@@H](F)C1	ZINC000450600740	BF	On-Demand	Mild	NOS2	19	40
N#Cc1cc(Cl)ccc1N1CC[C@@H](F)C1	ZINC000450600740	BF	On-Demand	Mild	NOS3	17	40
CNC(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450600749	CD	On-Demand	Bother	TAAR1	24	46
CNC(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450600750	CD	On-Demand	Bother	TAAR1	24	46
CCCc1cc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)no1	ZINC000450600751	GI	On-Demand	Anodyne	PRSS2	43	31
CC(C)(C)CCC1(O)CC(C(=O)Nc2ccc(F)cc2NS(C)(=O)=O)C1	ZINC000450600756	GG	On-Demand	Anodyne	TRPV1	42	33
COc1ccc(OC(F)(F)F)c(C(=O)N2CCN(c3ccnc(C)n3)CC2)c1	ZINC000450600770	GF	On-Demand	Anodyne	SLC6A7	0	40
O=c1oc2ccccc2n1CC1=CCCCC1	ZINC000450600779	BG	On-Demand	Anodyne	MIF	18	43
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1ccnc(OC)n1	ZINC000450600780	FE	On-Demand	Bother	CACNA1D	63	34
COC1CCC(CCNC(=O)c2cc(C)cs2)CC1	ZINC000450600786	CG	On-Demand	Anodyne	SIRT3	43	33
COC1CCC(CCNC(=O)c2cc(C)cs2)CC1	ZINC000450600786	CG	On-Demand	Anodyne	SIRT2	47	33
COC1CCC(CCNC(=O)c2cc(C)cs2)CC1	ZINC000450600786	CG	On-Demand	Anodyne	SIRT1	43	33
CC(C)c1nnc(Cn2c(=O)oc3ccccc32)s1	ZINC000450600789	CF	On-Demand	Anodyne	MIF	17	40
CC(=O)c1ccc(S(C)(=O)=O)c(NCC[C@@H]2CCc3ccccc32)c1	ZINC000450600809	FH	On-Demand	Anodyne	NQO2	36	40
CC(=O)c1ccc(S(C)(=O)=O)c(NCC[C@H]2CCc3ccccc32)c1	ZINC000450600810	FH	On-Demand	Anodyne	NQO2	36	40
COc1ccc(CC(=O)NCCOC(C)C)c(Cl)c1OC	ZINC000450600822	DE	On-Demand	Anodyne	PDE4D	15	45
CSc1cccc(C(=O)NCCOC(C)C)c1	ZINC000450600831	CF	On-Demand	Anodyne	DRD4	43	33
CCOc1nc2ccc(C(=O)NCCC3CCC(OC)CC3)cc2[nH]1	ZINC000450600837	EG	On-Demand	Anodyne	GRM1	0	45
CCOc1nc2ccc(C(=O)NCCC3CCC(OC)CC3)cc2[nH]1	ZINC000450600837	EG	On-Demand	Anodyne	SIRT3	44	39
CCOc1nc2ccc(C(=O)NCCC3CCC(OC)CC3)cc2[nH]1	ZINC000450600837	EG	On-Demand	Anodyne	SIRT2	47	39
CCOc1nc2ccc(C(=O)NCCC3CCC(OC)CC3)cc2[nH]1	ZINC000450600837	EG	On-Demand	Anodyne	SIRT1	44	39
COC(=O)c1cn(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)nn1	ZINC000450600848	GF	On-Demand	Anodyne	CACNA1B	41	40
COC(=O)c1cn(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)nn1	ZINC000450600848	GF	On-Demand	Anodyne	LIPG	44	34
COC(=O)c1cn(C2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)nn1	ZINC000450600848	GF	On-Demand	Anodyne	L3MBTL3	51	39
CCS(=O)(=O)c1ccc(CN(C)Cc2ncc(-c3ccccc3)[nH]2)cc1	ZINC000450600877	FH	On-Demand	Anodyne	BRS3	15	41
CCS(=O)(=O)c1ccc(CN(C)Cc2ncc(-c3ccccc3)[nH]2)cc1	ZINC000450600877	FH	On-Demand	Anodyne	RORC	22	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1	ZINC000450600906	DI	On-Demand	Anodyne	CHRNA2	39	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1	ZINC000450600906	DI	On-Demand	Anodyne	CRTY	0	40
COC(=O)c1cn(C2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)nn1	ZINC000450600907	GF	On-Demand	Anodyne	NPBWR1	51	32
CCC[C@@H]1CCC[C@@H]1C(=O)N1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450600908	DI	On-Demand	Anodyne	CHRNA2	39	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450600908	DI	On-Demand	Anodyne	CRTY	0	40
COC(=O)c1cn(C2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)nn1	ZINC000450600909	GF	On-Demand	Anodyne	NPBWR1	51	32
COC(=O)c1cn(C2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)nn1	ZINC000450600910	GF	On-Demand	Anodyne	NPBWR1	51	32
COC(=O)c1cn(C2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)nn1	ZINC000450600911	GF	On-Demand	Anodyne	NPBWR1	51	32
COc1cccc2c(NC[C@@H]3CCCN3CCCO)nccc12	ZINC000450600921	DF	On-Demand	Anodyne	ACKR3	43	30
COc1cccc2c(NC[C@H]3CCCN3CCCO)nccc12	ZINC000450600922	DF	On-Demand	Anodyne	ACKR3	43	30
CCOc1nc2ccc(C(=O)N[C@H]3CCOC[C@H]3OCC)cc2[nH]1	ZINC000450600940	ED	On-Demand	Anodyne	ADAM17	23	40
CCOc1nc2ccc(C(=O)N[C@H]3CCOC[C@H]3OCC)cc2[nH]1	ZINC000450600940	ED	On-Demand	Anodyne	MMP12	0	40
CCOc1nc2ccc(C(=O)N[C@@H]3CCOC[C@@H]3OCC)cc2[nH]1	ZINC000450600941	ED	On-Demand	Anodyne	ADAM17	23	40
CCOc1nc2ccc(C(=O)N[C@@H]3CCOC[C@@H]3OCC)cc2[nH]1	ZINC000450600941	ED	On-Demand	Anodyne	MMP12	0	40
CCOc1nc2ccc(C(=O)N[C@@H]3CCOC[C@H]3OCC)cc2[nH]1	ZINC000450600942	ED	On-Demand	Anodyne	ADAM17	23	40
CCOc1nc2ccc(C(=O)N[C@@H]3CCOC[C@H]3OCC)cc2[nH]1	ZINC000450600942	ED	On-Demand	Anodyne	MMP12	0	40
CCOc1nc2ccc(C(=O)N[C@H]3CCOC[C@@H]3OCC)cc2[nH]1	ZINC000450600943	ED	On-Demand	Anodyne	ADAM17	23	40
CCOc1nc2ccc(C(=O)N[C@H]3CCOC[C@@H]3OCC)cc2[nH]1	ZINC000450600943	ED	On-Demand	Anodyne	MMP12	0	40
CCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450600984	ED	On-Demand	Anodyne	PTGER3	22	40
CCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450600984	ED	On-Demand	Anodyne	F7	30	44
CCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450600984	ED	On-Demand	Anodyne	PSBA	0	41
CCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450600985	ED	On-Demand	Anodyne	PTGER3	22	40
CCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450600985	ED	On-Demand	Anodyne	F7	30	44
CCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450600985	ED	On-Demand	Anodyne	PSBA	0	41
O=C(CCCC(=O)N1CCC(Oc2cccc(Br)c2)CC1)C1CC1	ZINC000450600988	GH	On-Demand	Anodyne	PRSS2	46	32
CCc1c(C(=O)N2CCN(c3ccnc(C)n3)CC2)oc2ccccc12	ZINC000450600991	FG	On-Demand	Anodyne	SORD	61	38
CCc1cc(N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)n2ncnc2n1	ZINC000450600994	DG	On-Demand	Anodyne	DHOD	0	43
CCc1cc(N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)n2ncnc2n1	ZINC000450600995	DG	On-Demand	Anodyne	DHOD	0	43
CCc1cc(N2[C@@H](C)[C@H](c3ccccc3)C[C@H]2C)n2ncnc2n1	ZINC000450600996	DG	On-Demand	Anodyne	DHOD	0	43
CCc1cc(N2[C@@H](C)[C@@H](c3ccccc3)C[C@H]2C)n2ncnc2n1	ZINC000450600997	DG	On-Demand	Anodyne	DHOD	0	43
CCOC(=O)c1ccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)nc1	ZINC000450600998	FH	On-Demand	Anodyne	ACKR3	40	33
CCOC(=O)c1ccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)nc1	ZINC000450600999	FH	On-Demand	Anodyne	ACKR3	40	33
Cc1nccc(N2CCN(C(=O)CC3(O)CCC3)CC2)n1	ZINC000450601006	CC	On-Demand	Anodyne	SORD	65	41
CCN1C(=O)CCc2cc(NC(=O)C(C)(C)C(C)(F)F)ccc21	ZINC000450601016	DH	On-Demand	Anodyne	NAMPT	0	43
CCOC(=O)c1ccc(CN2CCC(N3CCCNC3=O)CC2)nc1	ZINC000450601025	ED	On-Demand	Anodyne	SSTR5	44	37
O=C(NCc1ccccc1)c1cc(N2CC[C@H](F)C2)ccn1	ZINC000450601028	CF	On-Demand	Anodyne	MMP13	0	41
O=C(NCc1ccccc1)c1cc(N2CC[C@@H](F)C2)ccn1	ZINC000450601029	CF	On-Demand	Anodyne	MMP13	0	41
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3CCCC4)ccc21	ZINC000450601031	EI	On-Demand	Anodyne	AVPR2	81	42
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3CCCC4)ccc21	ZINC000450601031	EI	On-Demand	Anodyne	AVPR1A	37	42
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3CCCC4)ccc21	ZINC000450601031	EI	On-Demand	Anodyne	MTTP	40	32
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3CCCC4)ccc21	ZINC000450601031	EI	On-Demand	Anodyne	KCNK3	54	37
CCN1C(=O)CCc2cc(NC(=O)c3cccc4c3CCCC4)ccc21	ZINC000450601031	EI	On-Demand	Anodyne	KCNK9	40	33
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450601036	DD	On-Demand	Anodyne	SLC6A1	66	40
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450601036	DD	On-Demand	Anodyne	SLC6A4	18	40
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450601036	DD	On-Demand	Anodyne	SLC6A3	38	40
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450601037	DD	On-Demand	Anodyne	SLC6A1	66	40
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450601037	DD	On-Demand	Anodyne	SLC6A4	18	40
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@@H]2C(=O)OC	ZINC000450601037	DD	On-Demand	Anodyne	SLC6A3	38	40
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@H]2C(=O)OC	ZINC000450601038	DD	On-Demand	Anodyne	SLC6A1	66	40
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@H]2C(=O)OC	ZINC000450601038	DD	On-Demand	Anodyne	SLC6A4	18	40
CCC(=O)CCCN1[C@H]2CC[C@H]1[C@H](C(=O)OC)[C@H]2C(=O)OC	ZINC000450601038	DD	On-Demand	Anodyne	SLC6A3	38	40
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601047	ED	On-Demand	Anodyne	SDH1	0	41
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601047	ED	On-Demand	Anodyne	CAPN2	45	35
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601047	ED	On-Demand	Anodyne	POL	0	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601048	ED	On-Demand	Anodyne	SDH1	0	41
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601048	ED	On-Demand	Anodyne	CAPN2	45	35
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601048	ED	On-Demand	Anodyne	POL	0	40
Cn1ccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450601056	DE	On-Demand	Anodyne	DRD4	23	46
Cn1ccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450601056	DE	On-Demand	Anodyne	ABCB1A	41	33
CC(=O)c1ccc(CN2CCC(N3CCCNC3=O)CC2)cc1	ZINC000450601069	DE	On-Demand	Anodyne	L3MBTL1	0	47
CC(=O)c1ccc(CN2CCC(N3CCCNC3=O)CC2)cc1	ZINC000450601069	DE	On-Demand	Anodyne	MBTD1	0	47
Cn1nc(-c2ccccc2)cc1C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450601085	FD	On-Demand	Anodyne	P2RX3	18	41
Cn1nc(-c2ccccc2)cc1C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450601085	FD	On-Demand	Anodyne	SLC6A7	0	46
Cc1cccc(Cl)c1C(=O)N1CCC(OCCN2C[C@H](C)O[C@H](C)C2)CC1	ZINC000450601105	GG	On-Demand	Anodyne	SLC6A1	41	36
Cc1cccc(Cl)c1C(=O)N1CCC(OCCN2C[C@H](C)O[C@H](C)C2)CC1	ZINC000450601105	GG	On-Demand	Anodyne	CCR5	36	45
Cc1cccc(Cl)c1C(=O)N1CCC(OCCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000450601106	GG	On-Demand	Anodyne	SLC6A1	41	36
Cc1cccc(Cl)c1C(=O)N1CCC(OCCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000450601106	GG	On-Demand	Anodyne	CCR5	36	45
Cc1cccc(Cl)c1C(=O)N1CCC(OCCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000450601107	GG	On-Demand	Anodyne	SLC6A1	41	36
Cc1cccc(Cl)c1C(=O)N1CCC(OCCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000450601107	GG	On-Demand	Anodyne	CCR5	36	45
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	ADRB1	39	45
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	TSHR	40	32
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	ADRB3	55	45
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	LTA4H	56	53
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	SLC15A1	0	40
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	FAAH	27	41
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	NPY5R	29	41
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	SLC1A1	31	40
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	ACE2	49	43
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	SLC1A2	57	44
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	ADAMTS4	42	39
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	FFAR1	46	42
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	YOPH	0	40
CC[C@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601116	CG	On-Demand	Anodyne	PDS	77	39
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	ADRB1	39	45
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	TSHR	40	32
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	ADRB3	55	45
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	LTA4H	56	53
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	SLC15A1	0	40
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	FAAH	27	41
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	NPY5R	29	41
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	SLC1A1	31	40
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	ACE2	49	43
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	SLC1A2	57	44
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	ADAMTS4	42	39
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	FFAR1	46	42
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	YOPH	0	40
CC[C@@H](O)CC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000450601117	CG	On-Demand	Anodyne	PDS	77	39
Cc1ccc(-c2nnc(SCC(=O)CC(C)(C)C3CC3)o2)cc1C	ZINC000450601118	EJ	On-Demand	Anodyne	GSK3A	40	37
N#Cc1cc(N2CC[C@@H](F)C2)ccc1C(F)(F)F	ZINC000450601119	CG	On-Demand	Mild	AR	33	47
N#Cc1cc(N2CC[C@H](F)C2)ccc1C(F)(F)F	ZINC000450601120	CG	On-Demand	Mild	AR	33	47
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450601122	FE	On-Demand	Anodyne	DRD2	50	41
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450601122	FE	On-Demand	Anodyne	OPRK1	15	42
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450601122	FE	On-Demand	Anodyne	HTR4	51	39
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450601122	FE	On-Demand	Anodyne	SIGMAR1	20	44
COC(=O)[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C(=O)OC	ZINC000450601123	FE	On-Demand	Anodyne	DRD2	50	41
COC(=O)[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C(=O)OC	ZINC000450601123	FE	On-Demand	Anodyne	OPRK1	15	42
COC(=O)[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C(=O)OC	ZINC000450601123	FE	On-Demand	Anodyne	HTR4	51	39
COC(=O)[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C(=O)OC	ZINC000450601123	FE	On-Demand	Anodyne	SIGMAR1	20	44
COC(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C(=O)OC	ZINC000450601124	FE	On-Demand	Anodyne	DRD2	50	41
COC(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C(=O)OC	ZINC000450601124	FE	On-Demand	Anodyne	OPRK1	15	42
COC(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C(=O)OC	ZINC000450601124	FE	On-Demand	Anodyne	HTR4	51	39
COC(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C(=O)OC	ZINC000450601124	FE	On-Demand	Anodyne	SIGMAR1	20	44
COC(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C(=O)OC	ZINC000450601125	FE	On-Demand	Anodyne	DRD2	50	41
COC(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C(=O)OC	ZINC000450601125	FE	On-Demand	Anodyne	OPRK1	15	42
COC(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C(=O)OC	ZINC000450601125	FE	On-Demand	Anodyne	HTR4	51	39
COC(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C(=O)OC	ZINC000450601125	FE	On-Demand	Anodyne	SIGMAR1	20	44
Cc1nc2ccnn2cc1C(=O)NCC1(CN(C)C)CCCC1	ZINC000450601126	DD	On-Demand	Anodyne	HCN1	52	32
Cc1nc2ccnn2cc1C(=O)NCC1(CN(C)C)CCCC1	ZINC000450601126	DD	On-Demand	Anodyne	HCN4	50	32
COc1ccccc1C1(CNC(=O)c2ccsc2Br)CCC1	ZINC000450601127	GI	On-Demand	Anodyne	KCNA3	57	46
COc1ccccc1C1(CNC(=O)c2ccsc2Br)CCC1	ZINC000450601127	GI	On-Demand	Anodyne	ACAT	0	50
COc1ccccc1C1(CNC(=O)c2ccsc2Br)CCC1	ZINC000450601127	GI	On-Demand	Anodyne	HCN1	78	44
COc1ccccc1C1(CNC(=O)c2ccsc2Br)CCC1	ZINC000450601127	GI	On-Demand	Anodyne	HCN4	54	40
N#C[C@@H]1CC[C@H](Sc2nnc(CN3CCCCC3)n2-c2ccccc2)C1	ZINC000450601131	FI	On-Demand	Mild	VCP	66	48
N#C[C@H]1CC[C@@H](Sc2nnc(CN3CCCCC3)n2-c2ccccc2)C1	ZINC000450601132	FI	On-Demand	Mild	VCP	66	48
N#C[C@@H]1CC[C@@H](Sc2nnc(CN3CCCCC3)n2-c2ccccc2)C1	ZINC000450601133	FI	On-Demand	Mild	VCP	66	48
N#C[C@H]1CC[C@H](Sc2nnc(CN3CCCCC3)n2-c2ccccc2)C1	ZINC000450601134	FI	On-Demand	Mild	VCP	66	48
O=C(c1ccc(I)cc1F)N1CCOCC2(CCC2)C1	ZINC000450601154	GG	On-Demand	Anodyne	MAP2K1	17	41
COc1ccccc1C1(CNC(=O)CCCC(=O)C(C)(C)C)CCC1	ZINC000450601164	EI	On-Demand	Anodyne	KCNA3	46	39
COc1ccccc1C1(CNC(=O)CCCC(=O)C(C)(C)C)CCC1	ZINC000450601164	EI	On-Demand	Anodyne	ACAT	0	51
COc1cccc2c(N3CC[C@H](F)C3)ccnc12	ZINC000450601177	BF	On-Demand	Anodyne	PDE3A	45	35
COc1cccc2c(N3CC[C@H](F)C3)ccnc12	ZINC000450601177	BF	On-Demand	Anodyne	PDE3B	67	35
CCn1c(Cc2ccccc2)nnc1SC[C@@H]1COCCO1	ZINC000450601195	DE	On-Demand	Anodyne	SLC27A1	40	33
CCn1c(Cc2ccccc2)nnc1SC[C@H]1COCCO1	ZINC000450601196	DE	On-Demand	Anodyne	SLC27A1	40	33
COC(=O)C[C@@H]1CCCN1CCC1=CCCCC1	ZINC000450601201	CF	On-Demand	Anodyne	HRH3	0	43
COC(=O)C[C@H]1CCCN1CCC1=CCCCC1	ZINC000450601202	CF	On-Demand	Anodyne	HRH3	0	43
CCn1c(Cc2ccccc2)nnc1SCc1nnc(C(C)C)s1	ZINC000450601216	FI	On-Demand	Anodyne	SLC27A1	44	36
OCCCN1CCC[C@@H]1CNc1ccnc2cc(Br)cnc12	ZINC000450601227	FF	On-Demand	Anodyne	HNMT	45	31
OCCCN1CCC[C@H]1CNc1ccnc2cc(Br)cnc12	ZINC000450601228	FF	On-Demand	Anodyne	HNMT	45	31
COc1cccc(-n2cc(C(=O)N(C)C3CC(O)C3)nn2)c1	ZINC000450601229	DC	On-Demand	Anodyne	DRD4	41	32
OCCCN1CCC[C@H]1CNc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450601231	FE	On-Demand	Anodyne	HRH1	33	41
OCCCN1CCC[C@H]1CNc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450601231	FE	On-Demand	Anodyne	ADRA1B	20	41
OCCCN1CCC[C@H]1CNc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450601231	FE	On-Demand	Anodyne	SPHK2	45	42
OCCCN1CCC[C@H]1CNc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450601231	FE	On-Demand	Anodyne	SPHK1	37	42
OCCCN1CCC[C@@H]1CNc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450601232	FE	On-Demand	Anodyne	HRH1	33	41
OCCCN1CCC[C@@H]1CNc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450601232	FE	On-Demand	Anodyne	ADRA1B	20	41
OCCCN1CCC[C@@H]1CNc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450601232	FE	On-Demand	Anodyne	SPHK2	45	42
OCCCN1CCC[C@@H]1CNc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450601232	FE	On-Demand	Anodyne	SPHK1	37	42
C=CCNC(=O)c1ccc(NC[C@@H]2CCCN2CCCO)nc1	ZINC000450601243	DD	On-Demand	Mild	IKBKB	0	44
C=CCNC(=O)c1ccc(NC[C@H]2CCCN2CCCO)nc1	ZINC000450601244	DD	On-Demand	Mild	IKBKB	0	44
CCC[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H](C)C[C@H]1c1cccnc1	ZINC000450601246	DI	On-Demand	Anodyne	CHRNA2	39	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H](C)C[C@H]1c1cccnc1	ZINC000450601246	DI	On-Demand	Anodyne	CRTY	0	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450601247	DI	On-Demand	Anodyne	CHRNA2	39	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450601247	DI	On-Demand	Anodyne	CRTY	0	40
CCn1c(Cc2ccccc2)nnc1SCc1cc(C(C)(C)C)on1	ZINC000450601250	FI	On-Demand	Anodyne	SLC27A1	47	41
CCn1c(Cc2ccccc2)nnc1SCc1cn(C)nc1C	ZINC000450601252	EG	On-Demand	Anodyne	SLC27A1	42	33
CC[C@H]1CN(C(=O)Cc2ccc(O)c(OC)c2)CCN1Cc1ccccc1	ZINC000450601258	FG	On-Demand	Anodyne	SIGMAR1	26	44
CC[C@H]1CN(C(=O)Cc2ccc(O)c(OC)c2)CCN1Cc1ccccc1	ZINC000450601258	FG	On-Demand	Anodyne	RORC	45	35
CC[C@@H]1CN(C(=O)Cc2ccc(O)c(OC)c2)CCN1Cc1ccccc1	ZINC000450601259	FG	On-Demand	Anodyne	SIGMAR1	26	44
CC[C@@H]1CN(C(=O)Cc2ccc(O)c(OC)c2)CCN1Cc1ccccc1	ZINC000450601259	FG	On-Demand	Anodyne	RORC	45	35
OCCCN1CCC[C@H]1CNc1nn2cc(-c3ccc(Cl)cc3)nc2s1	ZINC000450601273	GF	On-Demand	Anodyne	SPHK1	18	41
OCCCN1CCC[C@@H]1CNc1nn2cc(-c3ccc(Cl)cc3)nc2s1	ZINC000450601275	GF	On-Demand	Anodyne	SPHK1	18	41
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	DRD2	30	48
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	DRD4	62	48
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	ACHE	35	51
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	SLC6A1	100	37
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	DRD3	24	45
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	OPRD1	18	40
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	LTA4H	42	54
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	HRH3	33	49
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	SIGMAR1	53	47
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	CCR3	82	43
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	MLNR	83	45
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	CCR2	26	48
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	MCHR1	35	45
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	BIRC2	39	45
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	NPFFR1	43	40
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	NOD2	42	36
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	BRD2	28	44
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	BRD3	21	44
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000450601301	DH	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	DRD2	30	48
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	DRD4	62	48
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	ACHE	35	51
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	SLC6A1	100	37
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	DRD3	24	45
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	OPRD1	18	40
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	LTA4H	42	54
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	HRH3	33	49
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	SIGMAR1	53	47
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	CCR3	82	43
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	MLNR	83	45
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	CCR2	26	48
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	MCHR1	35	45
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	BIRC2	39	45
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	NPFFR1	43	40
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	NOD2	42	36
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	BRD2	28	44
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	BRD3	21	44
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000450601302	DH	On-Demand	Anodyne	ADIPOR2	0	40
COc1ccccc1Oc1ccc(C(=O)NCCC2CCC(OC)CC2)nc1	ZINC000450601307	GI	On-Demand	Anodyne	DRD2	16	41
COc1ccccc1Oc1ccc(C(=O)NCCC2CCC(OC)CC2)nc1	ZINC000450601307	GI	On-Demand	Anodyne	DRD3	28	41
COc1ccccc1Oc1ccc(C(=O)NCCC2CCC(OC)CC2)nc1	ZINC000450601307	GI	On-Demand	Anodyne	PDGFRA	26	41
COc1ccccc1Oc1ccc(C(=O)NCCC2CCC(OC)CC2)nc1	ZINC000450601307	GI	On-Demand	Anodyne	SCD1	27	43
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	HTR1A	22	61
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	DRD2	38	47
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	DRD1	29	49
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	DRD4	22	46
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	ADRA1D	28	45
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	HTR2A	37	53
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	HTR2C	29	61
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	HRH1	22	49
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	ADRA1B	22	46
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	ERG2	22	47
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	HTR7	28	47
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	CCR3	44	38
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601325	EE	On-Demand	Anodyne	CYP2J2	63	44
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	HTR1A	22	61
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	DRD2	38	47
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	DRD1	29	49
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	DRD4	22	46
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	ADRA1D	28	45
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	HTR2A	37	53
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	HTR2C	29	61
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	HRH1	22	49
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	ADRA1B	22	46
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	ERG2	22	47
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	HTR7	28	47
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	CCR3	44	38
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450601326	EE	On-Demand	Anodyne	CYP2J2	63	44
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601332	FE	On-Demand	Anodyne	SLC6A1	110	43
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601332	FE	On-Demand	Anodyne	SLC6A4	30	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601332	FE	On-Demand	Anodyne	SLC6A3	60	47
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601334	FE	On-Demand	Anodyne	SLC6A1	110	43
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601334	FE	On-Demand	Anodyne	SLC6A4	30	47
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601334	FE	On-Demand	Anodyne	SLC6A3	60	47
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601337	FE	On-Demand	Anodyne	SLC6A1	110	43
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601337	FE	On-Demand	Anodyne	SLC6A4	30	47
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccccc1OC1CC1	ZINC000450601337	FE	On-Demand	Anodyne	SLC6A3	60	47
COC(=O)[C@H](O)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450601343	DD	On-Demand	Anodyne	SLC6A1	0	42
COC(=O)[C@H](O)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450601343	DD	On-Demand	Anodyne	SLC6A3	23	42
COC(=O)[C@H](O)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450601346	DD	On-Demand	Anodyne	SLC6A1	0	42
COC(=O)[C@H](O)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450601346	DD	On-Demand	Anodyne	SLC6A3	23	42
COC(=O)[C@H](O)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450601348	DD	On-Demand	Anodyne	SLC6A1	0	42
COC(=O)[C@H](O)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450601348	DD	On-Demand	Anodyne	SLC6A3	23	42
COC(=O)[C@H](O)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450601350	DD	On-Demand	Anodyne	SLC6A1	0	42
COC(=O)[C@H](O)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450601350	DD	On-Demand	Anodyne	SLC6A3	23	42
O=[N+]([O-])c1ccccc1CN(Cc1cn(CC2CC2)nn1)C1CC1	ZINC000450601352	EF	On-Demand	Bother	COLA	87	34
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCc1cscn1	ZINC000450601353	DD	On-Demand	Anodyne	SLC6A1	80	38
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCc1cscn1	ZINC000450601353	DD	On-Demand	Anodyne	SLC6A3	43	38
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCc1cscn1	ZINC000450601355	DD	On-Demand	Anodyne	SLC6A1	80	38
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCc1cscn1	ZINC000450601355	DD	On-Demand	Anodyne	SLC6A3	43	38
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCc1cscn1	ZINC000450601357	DD	On-Demand	Anodyne	SLC6A1	80	38
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCc1cscn1	ZINC000450601357	DD	On-Demand	Anodyne	SLC6A3	43	38
CC(F)(F)CCSc1nc2cc(Br)cnc2[nH]1	ZINC000450601366	DH	On-Demand	Anodyne	ENPP1	24	45
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2ccnc(OC)n2)c([N+](=O)[O-])c1	ZINC000450601370	GD	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2ccnc(OC)n2)c([N+](=O)[O-])c1	ZINC000450601372	GD	On-Demand	Bother	TAAR1	20	45
Cc1nccc(N2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)n1	ZINC000450601386	EE	On-Demand	Anodyne	SORD	45	35
CCn1c(SCC[C@H](C)O)nc2scc(-c3cccs3)c2c1=O	ZINC000450601404	FI	On-Demand	Anodyne	PDE7A	43	40
COC1CCC(CCNC(=O)Cc2ccccc2O[C@H]2CCOC2)CC1	ZINC000450601411	FG	On-Demand	Anodyne	PDEC	0	41
CCn1c(SCC[C@@H](C)O)nc2scc(-c3cccs3)c2c1=O	ZINC000450601412	FI	On-Demand	Anodyne	PDE7A	43	40
COC1CCC(CCNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CC1	ZINC000450601413	FG	On-Demand	Anodyne	PDEC	0	41
CO[C@@H](Cc1ccccc1)C(=O)NCc1cc(Cl)cc2c1OCC2	ZINC000450601414	EG	On-Demand	Anodyne	AMP1_PLAFQ	46	38
O=S(=O)(NCC1CC1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450601415	CD	On-Demand	Anodyne	NPY1R	40	34
O=S(=O)(NCC1CC1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450601415	CD	On-Demand	Anodyne	NPY2R	45	37
O=S(=O)(NCC1CC1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450601416	CD	On-Demand	Anodyne	NPY1R	40	34
O=S(=O)(NCC1CC1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450601416	CD	On-Demand	Anodyne	NPY2R	45	37
CO[C@H](Cc1ccccc1)C(=O)NCc1cc(Cl)cc2c1OCC2	ZINC000450601417	EG	On-Demand	Anodyne	AMP1_PLAFQ	46	38
Cc1nccc(N2CCN(C(=O)[C@]3(C#N)C[C@H]3C)CC2)n1	ZINC000450601430	CC	On-Demand	Mild	SORD	43	35
Cc1nccc(N2CCN(C(=O)[C@@]3(C#N)C[C@H]3C)CC2)n1	ZINC000450601431	CC	On-Demand	Mild	SORD	43	35
Cc1nccc(N2CCN(C(=O)[C@]3(C#N)C[C@@H]3C)CC2)n1	ZINC000450601432	CC	On-Demand	Mild	SORD	43	35
Cc1nccc(N2CCN(C(=O)[C@@]3(C#N)C[C@@H]3C)CC2)n1	ZINC000450601433	CC	On-Demand	Mild	SORD	43	35
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nnc(C2CC2)s1	ZINC000450601434	FD	On-Demand	Anodyne	SLC6A1	44	34
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nnc(C2CC2)s1	ZINC000450601435	FD	On-Demand	Anodyne	SLC6A1	44	34
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1nnc(C2CC2)s1	ZINC000450601436	FD	On-Demand	Anodyne	SLC6A1	44	34
CCCN1C(=O)CCc2cc(NC(=O)C[C@@H](O)CC)ccc21	ZINC000450601437	DE	On-Demand	Anodyne	SLC1A2	44	34
CCCN1C(=O)CCc2cc(NC(=O)C[C@H](O)CC)ccc21	ZINC000450601438	DE	On-Demand	Anodyne	SLC1A2	44	34
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601450	EH	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601450	EH	On-Demand	Anodyne	HTR2A	23	51
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601450	EH	On-Demand	Anodyne	HTR2C	23	49
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601450	EH	On-Demand	Anodyne	SLC6A1	139	40
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601450	EH	On-Demand	Anodyne	HTR7	15	45
O=C(CCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601450	EH	On-Demand	Anodyne	CYP2J2	62	44
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601451	EH	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601451	EH	On-Demand	Anodyne	HTR2A	23	51
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601451	EH	On-Demand	Anodyne	HTR2C	23	49
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601451	EH	On-Demand	Anodyne	SLC6A1	139	40
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601451	EH	On-Demand	Anodyne	HTR7	15	45
O=C(CCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601451	EH	On-Demand	Anodyne	CYP2J2	62	44
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601452	EH	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601452	EH	On-Demand	Anodyne	HTR2A	23	51
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601452	EH	On-Demand	Anodyne	HTR2C	23	49
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601452	EH	On-Demand	Anodyne	SLC6A1	139	40
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601452	EH	On-Demand	Anodyne	HTR7	15	45
O=C(CCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601452	EH	On-Demand	Anodyne	CYP2J2	62	44
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601453	EH	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601453	EH	On-Demand	Anodyne	HTR2A	23	51
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601453	EH	On-Demand	Anodyne	HTR2C	23	49
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601453	EH	On-Demand	Anodyne	SLC6A1	139	40
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601453	EH	On-Demand	Anodyne	HTR7	15	45
O=C(CCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1)c1ccccc1	ZINC000450601453	EH	On-Demand	Anodyne	CYP2J2	62	44
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450601464	FH	On-Demand	Anodyne	DHOD	0	43
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450601465	FH	On-Demand	Anodyne	DHOD	0	43
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450601466	FH	On-Demand	Anodyne	DHOD	0	43
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450601467	FH	On-Demand	Anodyne	DHOD	0	43
COc1cccc2c(N3CC[C@@H](F)C3)ccnc12	ZINC000450601476	BF	On-Demand	Anodyne	PDE3A	45	35
COc1cccc2c(N3CC[C@@H](F)C3)ccnc12	ZINC000450601476	BF	On-Demand	Anodyne	PDE3B	67	35
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601478	DD	On-Demand	Anodyne	MME	66	39
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601478	DD	On-Demand	Anodyne	PAPA1_CARPA	57	37
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601478	DD	On-Demand	Anodyne	CYSP_TRYCR	46	34
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601478	DD	On-Demand	Anodyne	CTSL	26	41
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601478	DD	On-Demand	Anodyne	CAPNS1	57	32
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601478	DD	On-Demand	Anodyne	CAPN1	47	38
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601478	DD	On-Demand	Anodyne	CAPN2	61	38
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601478	DD	On-Demand	Anodyne	ACE2	55	36
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601480	DD	On-Demand	Anodyne	MME	66	39
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601480	DD	On-Demand	Anodyne	PAPA1_CARPA	57	37
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601480	DD	On-Demand	Anodyne	CYSP_TRYCR	46	34
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601480	DD	On-Demand	Anodyne	CTSL	26	41
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601480	DD	On-Demand	Anodyne	CAPNS1	57	32
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601480	DD	On-Demand	Anodyne	CAPN1	47	38
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601480	DD	On-Demand	Anodyne	CAPN2	61	38
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450601480	DD	On-Demand	Anodyne	ACE2	55	36
COc1cc(CC(=O)N2CCc3c2cccc3C(F)(F)F)ccc1O	ZINC000450601485	FH	On-Demand	Anodyne	EIF2AK3	47	35
Cc1nc(SCC[C@@H]2CCOC2)[nH]c1Cc1ccccc1	ZINC000450601496	DH	On-Demand	Anodyne	GRIN2B	17	40
Cc1nc(SCC[C@H]2CCOC2)[nH]c1Cc1ccccc1	ZINC000450601497	DH	On-Demand	Anodyne	GRIN2B	17	40
COc1ccccc1C1(CNC(=O)c2ccc(C(C)(F)F)nc2)CCC1	ZINC000450601499	FI	On-Demand	Anodyne	KCNA3	47	39
COc1ccccc1C1(CNC(=O)c2ccc(C(C)(F)F)nc2)CCC1	ZINC000450601499	FI	On-Demand	Anodyne	HCN1	50	33
COc1ccccc1C1(CNC(=O)c2ccc(C(C)(F)F)nc2)CCC1	ZINC000450601499	FI	On-Demand	Anodyne	HCN4	48	33
Cc1ccn2ncc(C(=O)NC(C)(C)CS(C)(=O)=O)c2c1	ZINC000450601504	DD	On-Demand	Anodyne	EPHB3	36	53
F[C@H]1CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450601505	CG	On-Demand	Anodyne	PPIA	45	35
F[C@@H]1CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450601506	CG	On-Demand	Anodyne	PPIA	45	35
COc1ccccc1NC(=O)CN1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450601519	GF	On-Demand	Anodyne	DRD4	23	42
COc1ccccc1NC(=O)CN1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450601520	GF	On-Demand	Anodyne	DRD4	23	42
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	TRPV1	33	50
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	KCNA3	42	45
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	MTNR1A	24	42
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	MTNR1B	17	42
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	NCE103	34	43
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	P96878_MYCTU	23	43
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	ACAT	0	53
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	HCN1	52	36
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	HCN4	49	36
COc1cc(CC(=O)NCC2(c3ccccc3OC)CCC2)ccc1O	ZINC000450601524	FG	On-Demand	Anodyne	CAN2	0	43
COc1cc2c(N3CC[C@@H](F)C3)ccnc2cc1F	ZINC000450601534	CF	On-Demand	Anodyne	PDE3A	53	41
COc1cc2c(N3CC[C@@H](F)C3)ccnc2cc1F	ZINC000450601534	CF	On-Demand	Anodyne	PDE3B	78	41
COc1cc2c(N3CC[C@H](F)C3)ccnc2cc1F	ZINC000450601535	CF	On-Demand	Anodyne	PDE3A	53	41
COc1cc2c(N3CC[C@H](F)C3)ccnc2cc1F	ZINC000450601535	CF	On-Demand	Anodyne	PDE3B	78	41
CC(F)(F)c1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)cn1	ZINC000450601540	FE	On-Demand	Anodyne	SLC6A9	26	40
CC(F)(F)c1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)cn1	ZINC000450601540	FE	On-Demand	Anodyne	SLC6A7	0	50
COCc1nn(C)cc1C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450601558	EE	On-Demand	Anodyne	KCNA3	46	44
COCc1nn(C)cc1C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450601558	EE	On-Demand	Anodyne	HCN1	68	44
COCc1nn(C)cc1C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450601558	EE	On-Demand	Anodyne	HCN4	55	40
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601560	EE	On-Demand	Anodyne	SLC6A1	76	37
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601560	EE	On-Demand	Anodyne	SLC6A3	25	42
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601560	EE	On-Demand	Anodyne	PREP	56	45
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601560	EE	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601560	EE	On-Demand	Anodyne	ACKR3	50	32
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601561	EE	On-Demand	Anodyne	SLC6A1	76	37
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601561	EE	On-Demand	Anodyne	SLC6A3	25	42
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601561	EE	On-Demand	Anodyne	PREP	56	45
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601561	EE	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)[C@H]1C(=O)OC	ZINC000450601561	EE	On-Demand	Anodyne	ACKR3	50	32
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@@H]1C(=O)OC	ZINC000450601562	EE	On-Demand	Anodyne	SLC6A1	76	37
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@@H]1C(=O)OC	ZINC000450601562	EE	On-Demand	Anodyne	SLC6A3	25	42
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@@H]1C(=O)OC	ZINC000450601562	EE	On-Demand	Anodyne	PREP	56	45
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@@H]1C(=O)OC	ZINC000450601562	EE	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)[C@@H]1C(=O)OC	ZINC000450601562	EE	On-Demand	Anodyne	ACKR3	50	32
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccccc1	ZINC000450601563	EE	On-Demand	Anodyne	SLC6A1	76	37
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccccc1	ZINC000450601563	EE	On-Demand	Anodyne	SLC6A3	25	42
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccccc1	ZINC000450601563	EE	On-Demand	Anodyne	PREP	56	45
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccccc1	ZINC000450601563	EE	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccccc1	ZINC000450601563	EE	On-Demand	Anodyne	ACKR3	50	32
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCc3c2cccc3C(F)(F)F)cn1	ZINC000450601569	GI	On-Demand	Anodyne	AVPR2	45	38
COCCC(C)(C)CNC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450601574	FF	On-Demand	Mild	TRPV4	42	32
CC[C@H]1CN(C(=O)CCCC(=O)C2CC2)CCN1Cc1ccccc1	ZINC000450601599	EG	On-Demand	Anodyne	PREP	40	37
CC[C@@H]1CN(C(=O)CCCC(=O)C2CC2)CCN1Cc1ccccc1	ZINC000450601600	EG	On-Demand	Anodyne	PREP	40	37
OCCCN1CCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450601617	FE	On-Demand	Anodyne	EGFR	41	38
OCCCN1CCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450601618	FE	On-Demand	Anodyne	EGFR	41	38
COC(=O)c1cn(C2CCN(C(=O)c3cccc(SC)c3)CC2)nn1	ZINC000450601621	FE	On-Demand	Anodyne	L3MBTL1	0	42
COC(=O)c1cn(C2CCN(C(=O)c3cccc(SC)c3)CC2)nn1	ZINC000450601621	FE	On-Demand	Anodyne	L3MBTL3	69	42
CCc1cc(CCCSc2nnc(Cc3ccccc3)n2CC)on1	ZINC000450601629	FI	On-Demand	Anodyne	SLC27A1	40	33
CS(=O)(=O)c1cccc(Br)c1NC[C@H]1CCCN1CCCO	ZINC000450601632	GE	On-Demand	Anodyne	DRD2	16	40
CS(=O)(=O)c1cccc(Br)c1NC[C@@H]1CCCN1CCCO	ZINC000450601633	GE	On-Demand	Anodyne	DRD2	16	40
CCn1c(Cc2ccccc2)nnc1SCCN(C)Cc1ccccc1	ZINC000450601645	FI	On-Demand	Anodyne	SLC27A1	44	38
COC(=O)C[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601650	CE	On-Demand	Anodyne	ACE	51	40
COC(=O)C[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601650	CE	On-Demand	Anodyne	DRD2	39	41
COC(=O)C[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601650	CE	On-Demand	Anodyne	OPRM1	26	41
COC(=O)C[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601650	CE	On-Demand	Anodyne	DRD3	0	41
COC(=O)C[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601650	CE	On-Demand	Anodyne	SLC18A2	51	45
COC(=O)C[C@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601650	CE	On-Demand	Anodyne	MME	41	37
COC(=O)C[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601651	CE	On-Demand	Anodyne	ACE	51	40
COC(=O)C[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601651	CE	On-Demand	Anodyne	DRD2	39	41
COC(=O)C[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601651	CE	On-Demand	Anodyne	OPRM1	26	41
COC(=O)C[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601651	CE	On-Demand	Anodyne	DRD3	0	41
COC(=O)C[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601651	CE	On-Demand	Anodyne	SLC18A2	51	45
COC(=O)C[C@@H]1CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450601651	CE	On-Demand	Anodyne	MME	41	37
COC(=O)C[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601652	CE	On-Demand	Anodyne	ACE	51	40
COC(=O)C[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601652	CE	On-Demand	Anodyne	DRD2	39	41
COC(=O)C[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601652	CE	On-Demand	Anodyne	OPRM1	26	41
COC(=O)C[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601652	CE	On-Demand	Anodyne	DRD3	0	41
COC(=O)C[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601652	CE	On-Demand	Anodyne	SLC18A2	51	45
COC(=O)C[C@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601652	CE	On-Demand	Anodyne	MME	41	37
COC(=O)C[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601653	CE	On-Demand	Anodyne	ACE	51	40
COC(=O)C[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601653	CE	On-Demand	Anodyne	DRD2	39	41
COC(=O)C[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601653	CE	On-Demand	Anodyne	OPRM1	26	41
COC(=O)C[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601653	CE	On-Demand	Anodyne	DRD3	0	41
COC(=O)C[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601653	CE	On-Demand	Anodyne	SLC18A2	51	45
COC(=O)C[C@@H]1CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450601653	CE	On-Demand	Anodyne	MME	41	37
CCOc1nc2ccc(C(=O)N3CCC(n4cc(C(=O)OC)nn4)CC3)cc2[nH]1	ZINC000450601657	GD	On-Demand	Anodyne	L3MBTL3	62	35
Cc1ccc(C(=O)NCCOc2ccc(NS(C)(=O)=O)cc2)c(C(C)C)n1	ZINC000450601686	GF	On-Demand	Anodyne	GRIN1	50	37
O=C(NC1CC1)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450601690	CE	On-Demand	Bother	MAPK13	42	35
O=C(NC1CC1)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450601691	CE	On-Demand	Bother	MAPK13	42	35
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@@H](C)O	ZINC000450601694	CC	On-Demand	Anodyne	SLC6A1	92	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@@H](C)O	ZINC000450601694	CC	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@@H](C)O	ZINC000450601694	CC	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@H](C)O	ZINC000450601695	CC	On-Demand	Anodyne	SLC6A1	92	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@H](C)O	ZINC000450601695	CC	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@H](C)O	ZINC000450601695	CC	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@H](C)O	ZINC000450601696	CC	On-Demand	Anodyne	SLC6A1	92	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@H](C)O	ZINC000450601696	CC	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@H](C)O	ZINC000450601696	CC	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@@H](C)O	ZINC000450601697	CC	On-Demand	Anodyne	SLC6A1	92	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@@H](C)O	ZINC000450601697	CC	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC[C@@H](C)O	ZINC000450601697	CC	On-Demand	Anodyne	SLC6A3	51	42
CC(C)OC(C)(C)C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450601698	GI	On-Demand	Anodyne	PRSS2	43	30
CC(C)OC(C)(C)C(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450601698	GI	On-Demand	Anodyne	GPR119	17	40
CCC[C@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601702	CF	On-Demand	Anodyne	FOLH1	32	40
CCC[C@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601702	CF	On-Demand	Anodyne	CAPNS1	42	37
CCC[C@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601702	CF	On-Demand	Anodyne	CAPN1	47	39
CCC[C@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601702	CF	On-Demand	Anodyne	CAPN2	77	42
CCC[C@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601702	CF	On-Demand	Anodyne	NPR	38	60
CCC[C@H](NC(=O)[C@H](CCC)CC(C)C)C(=O)OC	ZINC000450601703	CF	On-Demand	Anodyne	FOLH1	32	40
CCC[C@H](NC(=O)[C@H](CCC)CC(C)C)C(=O)OC	ZINC000450601703	CF	On-Demand	Anodyne	CAPNS1	42	37
CCC[C@H](NC(=O)[C@H](CCC)CC(C)C)C(=O)OC	ZINC000450601703	CF	On-Demand	Anodyne	CAPN1	47	39
CCC[C@H](NC(=O)[C@H](CCC)CC(C)C)C(=O)OC	ZINC000450601703	CF	On-Demand	Anodyne	CAPN2	77	42
CCC[C@H](NC(=O)[C@H](CCC)CC(C)C)C(=O)OC	ZINC000450601703	CF	On-Demand	Anodyne	NPR	38	60
CCC[C@@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601704	CF	On-Demand	Anodyne	FOLH1	32	40
CCC[C@@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601704	CF	On-Demand	Anodyne	CAPNS1	42	37
CCC[C@@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601704	CF	On-Demand	Anodyne	CAPN1	47	39
CCC[C@@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601704	CF	On-Demand	Anodyne	CAPN2	77	42
CCC[C@@H](CC(C)C)C(=O)N[C@H](CCC)C(=O)OC	ZINC000450601704	CF	On-Demand	Anodyne	NPR	38	60
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CCC)C(=O)OC	ZINC000450601705	CF	On-Demand	Anodyne	FOLH1	32	40
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CCC)C(=O)OC	ZINC000450601705	CF	On-Demand	Anodyne	CAPNS1	42	37
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CCC)C(=O)OC	ZINC000450601705	CF	On-Demand	Anodyne	CAPN1	47	39
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CCC)C(=O)OC	ZINC000450601705	CF	On-Demand	Anodyne	CAPN2	77	42
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CCC)C(=O)OC	ZINC000450601705	CF	On-Demand	Anodyne	NPR	38	60
COc1ccc([N+](=O)[O-])c(N2CC[C@@H](F)C2)c1	ZINC000450601706	BE	On-Demand	Bother	TAAR1	17	40
COc1ccc([N+](=O)[O-])c(N2CC[C@H](F)C2)c1	ZINC000450601707	BE	On-Demand	Bother	TAAR1	17	40
O=C(c1ccc(N2CC[C@H](F)C2)nc1)N1CCc2ccccc21	ZINC000450601708	DF	On-Demand	Anodyne	AVPR2	48	44
O=C(c1ccc(N2CC[C@@H](F)C2)nc1)N1CCc2ccccc21	ZINC000450601709	DF	On-Demand	Anodyne	AVPR2	48	44
Cc1nccc(N2[C@@H](C)[C@H](c3ccccc3)C[C@H]2C)n1	ZINC000450601710	CH	On-Demand	Anodyne	SORD	59	36
Cc1nccc(N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)n1	ZINC000450601711	CH	On-Demand	Anodyne	SORD	59	36
Cc1nccc(N2[C@@H](C)[C@@H](c3ccccc3)C[C@H]2C)n1	ZINC000450601712	CH	On-Demand	Anodyne	SORD	59	36
Cc1nccc(N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)n1	ZINC000450601713	CH	On-Demand	Anodyne	SORD	59	36
CCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450601714	EH	On-Demand	Anodyne	MAPK14	16	41
CCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450601714	EH	On-Demand	Anodyne	NOD2	32	40
CCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450601714	EH	On-Demand	Anodyne	KCNK3	90	37
CCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450601714	EH	On-Demand	Anodyne	KCNK9	42	36
CCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450601714	EH	On-Demand	Anodyne	BRPF1	0	41
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	BMP1	21	40
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	KCNA5	0	48
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	MMP13	28	46
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	KLK3	63	34
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	CTSB	49	55
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	PAPA1_CARPA	55	36
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	CTSK	30	46
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	CA14	16	44
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	CAPNS1	70	55
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	MMP2	41	55
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	MMP3	41	42
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	MMP8	21	55
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	HLA-DRB1	58	50
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	CAPN1	110	62
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	MMP9	27	42
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	CAPN2	138	69
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	MMP7	22	42
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	MMP1	18	42
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	FPR1	60	37
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	NPR	56	42
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	PSMB5	46	48
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	LEF	42	40
CCC[C@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601735	GE	On-Demand	Anodyne	F2RL1	47	31
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	BMP1	21	40
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	KCNA5	0	48
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	MMP13	28	46
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	KLK3	63	34
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	CTSB	49	55
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	PAPA1_CARPA	55	36
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	CTSK	30	46
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	CA14	16	44
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	CAPNS1	70	55
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	MMP2	41	55
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	MMP3	41	42
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	MMP8	21	55
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	HLA-DRB1	58	50
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	CAPN1	110	62
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	MMP9	27	42
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	CAPN2	138	69
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	MMP7	22	42
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	MMP1	18	42
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	FPR1	60	37
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	NPR	56	42
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	PSMB5	46	48
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	LEF	42	40
CCC[C@@H](NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1)C(=O)OC	ZINC000450601736	GE	On-Demand	Anodyne	F2RL1	47	31
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1ccc(C(=O)Nc2nncs2)cn1	ZINC000450601741	GH	On-Demand	Anodyne	HDAC1	0	40
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1ccc(C(=O)Nc2nncs2)cn1	ZINC000450601742	GH	On-Demand	Anodyne	HDAC1	0	40
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1ccc(C(=O)Nc2nncs2)cn1	ZINC000450601743	GH	On-Demand	Anodyne	HDAC1	0	40
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1ccc(C(=O)Nc2nncs2)cn1	ZINC000450601744	GH	On-Demand	Anodyne	HDAC1	0	40
Cc1ccn(-c2ccccc2C(=O)N2CCN(c3ncc(F)cn3)CC2)n1	ZINC000450601751	FE	On-Demand	Anodyne	HCRTR2	19	40
Cc1ccn(-c2ccccc2C(=O)N2CCN(c3ncc(F)cn3)CC2)n1	ZINC000450601751	FE	On-Demand	Anodyne	SLC6A7	0	43
CN(C)CC1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCC1	ZINC000450601760	FE	On-Demand	Anodyne	HCN1	54	34
CN(C)CC1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCC1	ZINC000450601760	FE	On-Demand	Anodyne	HCN4	49	31
COCCNC(=O)c1ccc(N2[C@@H](C)[C@@H](c3ccccc3)C[C@H]2C)nc1	ZINC000450601769	FG	On-Demand	Anodyne	HDAC1	0	41
COCCNC(=O)c1ccc(N2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)nc1	ZINC000450601771	FG	On-Demand	Anodyne	HDAC1	0	41
COCCNC(=O)c1ccc(N2[C@@H](C)[C@H](c3ccccc3)C[C@H]2C)nc1	ZINC000450601773	FG	On-Demand	Anodyne	HDAC1	0	41
COCCNC(=O)c1ccc(N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)nc1	ZINC000450601774	FG	On-Demand	Anodyne	HDAC1	0	41
CCN1CC[C@@H](NC(=O)C2(C)CCC(=O)CC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450601797	GH	On-Demand	Anodyne	ENV	46	35
CCN1CC[C@@H](NC(=O)C2(C)CCC(=O)CC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450601801	GH	On-Demand	Anodyne	ENV	46	35
CCN1CC[C@H](NC(=O)C2(C)CCC(=O)CC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450601802	GH	On-Demand	Anodyne	ENV	46	35
Cc1nccc(N2CCN(C(=O)c3ccc(C)c(Cl)c3Cl)CC2)n1	ZINC000450601804	FG	On-Demand	Anodyne	SORD	66	41
CCN1CC[C@H](NC(=O)C2(C)CCC(=O)CC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450601806	GH	On-Demand	Anodyne	ENV	46	35
F[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450601834	CH	On-Demand	Anodyne	LIPG	56	39
F[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450601841	CH	On-Demand	Anodyne	LIPG	56	39
COCCC(C)(C)CNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450601851	EG	On-Demand	Anodyne	TRPV1	23	41
COCCC(C)(C)CNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450601851	EG	On-Demand	Anodyne	CAN2	0	40
O=C([C@H]1CCN(c2ccccc2)C1)N1CCOCC2(CCC2)C1	ZINC000450601862	DF	On-Demand	Anodyne	AKR1C3	22	42
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCOCC2(CCC2)C1	ZINC000450601864	DF	On-Demand	Anodyne	AKR1C3	22	42
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	ADRB2	17	42
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	ADRB1	42	47
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	ADRB3	43	42
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	LTA4H	63	46
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	CACNA1B	25	42
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	SCN2A	19	44
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	ADAM17	20	52
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	TIMP3	66	34
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	GUAB	0	40
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	S1PR4	21	41
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	FFAR1	34	40
O=C(Nc1ccc(COc2ccccc2)cc1)[C@H](O)C1CCC1	ZINC000450601867	DG	On-Demand	Anodyne	YOPH	0	41
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	ADRB2	17	42
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	ADRB1	42	47
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	ADRB3	43	42
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	LTA4H	63	46
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	CACNA1B	25	42
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	SCN2A	19	44
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	ADAM17	20	52
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	TIMP3	66	34
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	GUAB	0	40
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	S1PR4	21	41
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	FFAR1	34	40
O=C(Nc1ccc(COc2ccccc2)cc1)[C@@H](O)C1CCC1	ZINC000450601869	DG	On-Demand	Anodyne	YOPH	0	41
COC1CCC(CCNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450601878	DF	On-Demand	Anodyne	MME	70	37
COC1CCC(CCNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450601878	DF	On-Demand	Anodyne	PAPA1_CARPA	43	34
COC1CCC(CCNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450601878	DF	On-Demand	Anodyne	TIMP3	70	46
COC1CCC(CCNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450601878	DF	On-Demand	Anodyne	F11	45	35
COC1CCC(CCNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450601878	DF	On-Demand	Anodyne	AMP1_PLAFQ	59	37
COC1CCC(CCNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450601879	DF	On-Demand	Anodyne	MME	70	37
COC1CCC(CCNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450601879	DF	On-Demand	Anodyne	PAPA1_CARPA	43	34
COC1CCC(CCNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450601879	DF	On-Demand	Anodyne	TIMP3	70	46
COC1CCC(CCNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450601879	DF	On-Demand	Anodyne	F11	45	35
COC1CCC(CCNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450601879	DF	On-Demand	Anodyne	AMP1_PLAFQ	59	37
CCc1nc(C)c(COc2cccc(C#N)c2)o1	ZINC000450601881	BF	On-Demand	Mild	MAOB	15	42
Cc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1C	ZINC000450601887	DH	On-Demand	Anodyne	TERT	22	43
Cc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1C	ZINC000450601888	DH	On-Demand	Anodyne	GSK3A	45	38
Cc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1C	ZINC000450601888	DH	On-Demand	Anodyne	TERT	22	43
COc1ccccc1NC(=O)CN1CCN(CC2(C#N)CCC2)CC1	ZINC000450601889	ED	On-Demand	Mild	ADRA1D	18	40
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450601904	GG	On-Demand	Anodyne	NPBWR1	52	40
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450601904	GG	On-Demand	Anodyne	SLC6A7	0	46
COCCC(C)(C)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450601908	FF	On-Demand	Anodyne	PDE8B	48	35
COCCC(C)(C)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450601909	FF	On-Demand	Anodyne	PDE8B	48	35
CCS(=O)(=O)c1ccc(COc2cc(C(=O)OC)cc(C(=O)OC)c2)cc1	ZINC000450601914	GF	On-Demand	Anodyne	MMP13	19	42
CCS(=O)(=O)c1ccc(COc2cc(C(=O)OC)cc(C(=O)OC)c2)cc1	ZINC000450601914	GF	On-Demand	Anodyne	ADAMTS4	53	42
CCS(=O)(=O)c1ccc(COc2cc(C(=O)OC)cc(C(=O)OC)c2)cc1	ZINC000450601914	GF	On-Demand	Anodyne	RORC	60	36
COc1cnc(N2CC[C@@H](F)C2)nc1N1CC[C@@H](F)C1	ZINC000450601917	CD	On-Demand	Anodyne	PDE3A	49	38
COc1cnc(N2CC[C@@H](F)C2)nc1N1CC[C@@H](F)C1	ZINC000450601917	CD	On-Demand	Anodyne	PDE3B	72	38
COc1cnc(N2CC[C@H](F)C2)nc1N1CC[C@H](F)C1	ZINC000450601919	CD	On-Demand	Anodyne	PDE3A	49	38
COc1cnc(N2CC[C@H](F)C2)nc1N1CC[C@H](F)C1	ZINC000450601919	CD	On-Demand	Anodyne	PDE3B	72	38
COc1cnc(N2CC[C@@H](F)C2)nc1N1CC[C@H](F)C1	ZINC000450601921	CD	On-Demand	Anodyne	PDE3A	49	38
COc1cnc(N2CC[C@@H](F)C2)nc1N1CC[C@H](F)C1	ZINC000450601921	CD	On-Demand	Anodyne	PDE3B	72	38
COc1cnc(N2CC[C@H](F)C2)nc1N1CC[C@@H](F)C1	ZINC000450601922	CD	On-Demand	Anodyne	PDE3A	49	38
COc1cnc(N2CC[C@H](F)C2)nc1N1CC[C@@H](F)C1	ZINC000450601922	CD	On-Demand	Anodyne	PDE3B	72	38
CCOCc1nc(C)c(C(=O)NCC2(c3ccccc3OC)CCC2)s1	ZINC000450601923	FH	On-Demand	Anodyne	HCN1	50	32
CCOCc1nc(C)c(C(=O)NCC2(c3ccccc3OC)CCC2)s1	ZINC000450601923	FH	On-Demand	Anodyne	HCN4	48	32
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601941	FH	On-Demand	Anodyne	COLA	44	36
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601941	FH	On-Demand	Anodyne	CPT1A	53	31
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601941	FH	On-Demand	Anodyne	PRNP	30	40
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601941	FH	On-Demand	Anodyne	HDAC1	33	42
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601941	FH	On-Demand	Anodyne	TAAR1	40	43
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601943	FH	On-Demand	Anodyne	COLA	44	36
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601943	FH	On-Demand	Anodyne	CPT1A	53	31
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601943	FH	On-Demand	Anodyne	PRNP	30	40
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601943	FH	On-Demand	Anodyne	HDAC1	33	42
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450601943	FH	On-Demand	Anodyne	TAAR1	40	43
COCCOC[C@@H](O)CN1CC=C(c2ccccc2C(F)(F)F)CC1	ZINC000450601956	FF	On-Demand	Anodyne	HSP90AB1	38	41
COCCOC[C@H](O)CN1CC=C(c2ccccc2C(F)(F)F)CC1	ZINC000450601957	FF	On-Demand	Anodyne	HSP90AB1	38	41
COC1CCC(CCNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450601971	EG	On-Demand	Anodyne	P2RY12	48	35
COC1CCC(CCNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450601971	EG	On-Demand	Anodyne	ACACB	23	40
COC1CCC(CCNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450601971	EG	On-Demand	Anodyne	CTSV	46	31
COC1CCC(CCNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450601971	EG	On-Demand	Anodyne	SIRT3	40	30
COC1CCC(CCNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450601971	EG	On-Demand	Anodyne	SIRT1	40	30
COC1CCC(CCNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450601971	EG	On-Demand	Anodyne	VCP	63	39
CC(=O)N[C@H](C(=O)N(C)C1CC(O)C1)C(C)(C)C	ZINC000450601991	CC	On-Demand	Anodyne	PDF	49	32
O=[N+]([O-])c1cnc2ccc(NC[C@H]3CCCN3CCCO)nn12	ZINC000450602001	DC	On-Demand	Bother	IKBKB	30	47
O=[N+]([O-])c1cnc2ccc(NC[C@@H]3CCCN3CCCO)nn12	ZINC000450602002	DC	On-Demand	Bother	IKBKB	30	47
CCn1c(Cc2ccccc2)nnc1SCC1(C(=O)OC)CCCC1	ZINC000450602028	FH	On-Demand	Anodyne	SLC27A1	46	41
CCc1cc(NC[C@@H]2CCCN2CCCO)nc(-c2ccccn2)n1	ZINC000450602037	ED	On-Demand	Anodyne	HRH3	16	40
CCc1cc(NC[C@H]2CCCN2CCCO)nc(-c2ccccn2)n1	ZINC000450602038	ED	On-Demand	Anodyne	HRH3	16	40
CN1C(=O)CC[C@H]1C(=O)Nc1ccc(Br)c2ccccc12	ZINC000450602041	EG	On-Demand	Anodyne	CCR8	40	32
CN1C(=O)CC[C@@H]1C(=O)Nc1ccc(Br)c2ccccc12	ZINC000450602042	EG	On-Demand	Anodyne	CCR8	40	32
CC1(C(=O)Nc2ccc(Br)c3ccccc23)CCC(=O)CC1	ZINC000450602043	FJ	On-Demand	Anodyne	CETP	0	42
CCOC(=O)c1ccc(CN2CCCC[C@H](SC)C2)nc1	ZINC000450602046	DF	On-Demand	Anodyne	SLC6A1	44	31
CCOC(=O)c1ccc(CN2CCCC[C@@H](SC)C2)nc1	ZINC000450602047	DF	On-Demand	Anodyne	SLC6A1	44	31
CN1CCN(c2nc3ccccc3nc2NC[C@@H]2CCCN2CCCO)CC1	ZINC000450602053	GD	On-Demand	Anodyne	HTR3A	22	47
CN1CCN(c2nc3ccccc3nc2NC[C@H]2CCCN2CCCO)CC1	ZINC000450602054	GD	On-Demand	Anodyne	HTR3A	22	47
CCc1nc(C)c(CSc2nnc(Cc3ccccc3)n2CC)o1	ZINC000450602060	EI	On-Demand	Anodyne	SLC27A1	46	39
COC(=O)c1coc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)n1	ZINC000450602068	EF	On-Demand	Bother	COLA	97	38
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	DRD4	43	42
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	ACHE	31	43
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	HRH1	23	47
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	HTR4	74	44
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	SIGMAR1	28	47
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	SSTR5	87	47
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	CCR3	33	42
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	MCHR1	37	44
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	CACNA1G	54	49
CCOC(=O)CNC(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450602080	FE	On-Demand	Anodyne	CACNA1I	46	40
CCn1c(Cc2ccccc2)nnc1SCc1nc(C(=O)OC)cs1	ZINC000450602088	FG	On-Demand	Anodyne	SLC27A1	53	45
CCn1c(Cc2ccccc2)nnc1SCC(=O)CC[C@H]1CCCCO1	ZINC000450602090	FH	On-Demand	Anodyne	SLC27A1	42	40
CCn1c(Cc2ccccc2)nnc1SCC(=O)CC[C@@H]1CCCCO1	ZINC000450602091	FH	On-Demand	Anodyne	SLC27A1	42	40
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602099	GI	On-Demand	Anodyne	SLC6A1	59	34
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602099	GI	On-Demand	Anodyne	CYP2J2	55	38
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602100	GI	On-Demand	Anodyne	SLC6A1	59	34
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602100	GI	On-Demand	Anodyne	CYP2J2	55	38
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602101	GI	On-Demand	Anodyne	SLC6A1	59	34
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602101	GI	On-Demand	Anodyne	CYP2J2	55	38
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602102	GI	On-Demand	Anodyne	SLC6A1	59	34
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602102	GI	On-Demand	Anodyne	CYP2J2	55	38
CCN1C(=O)CCc2cc(NC(=O)C3CC(O)(CCC(C)(C)C)C3)ccc21	ZINC000450602163	FH	On-Demand	Anodyne	NAMPT	22	43
CN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CC(O)C1	ZINC000450602168	DE	On-Demand	Bother	PPXII	0	41
O=[N+]([O-])c1ccccc1CN(C[C@H]1C[C@H]2CC[C@H]1O2)C1CC1	ZINC000450602182	DG	On-Demand	Bother	COLA	75	32
O=[N+]([O-])c1ccccc1CN(C[C@@H]1C[C@H]2CC[C@H]1O2)C1CC1	ZINC000450602183	DG	On-Demand	Bother	COLA	75	32
CC(C)(CS(C)(=O)=O)NC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450602184	GD	On-Demand	Mild	TRPV4	43	32
O=C1CC[C@@H](CSc2nnc(CN3CCCC3)n2Cc2ccccc2)CCN1	ZINC000450602185	GF	On-Demand	Anodyne	ACHE	21	40
O=C1CC[C@H](CSc2nnc(CN3CCCC3)n2Cc2ccccc2)CCN1	ZINC000450602186	GF	On-Demand	Anodyne	ACHE	21	40
CCC(CC)Oc1ccc(C(=O)N2CCN(c3ccnc(C)n3)CC2)cc1	ZINC000450602190	FG	On-Demand	Anodyne	SORD	57	37
CCC(CC)Oc1ccc(C(=O)N2CCN(c3ccnc(C)n3)CC2)cc1	ZINC000450602190	FG	On-Demand	Anodyne	SLC6A7	0	49
Cc1ccc(-c2nnc(SCC3CC(F)(F)C3)o2)cc1C	ZINC000450602203	DI	On-Demand	Anodyne	GSK3A	47	37
Cc1ccc(-c2nnc(SCC3CC(F)(F)C3)o2)cc1C	ZINC000450602203	DI	On-Demand	Anodyne	TERT	22	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCC2)C1	ZINC000450602208	FI	On-Demand	Anodyne	MC4R	42	36
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCC2)C1	ZINC000450602208	FI	On-Demand	Anodyne	PRCP	51	35
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCC2)C1	ZINC000450602209	FI	On-Demand	Anodyne	MC4R	42	36
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCC2)C1	ZINC000450602209	FI	On-Demand	Anodyne	PRCP	51	35
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCC2)C1	ZINC000450602210	FI	On-Demand	Anodyne	MC4R	42	36
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCC2)C1	ZINC000450602210	FI	On-Demand	Anodyne	PRCP	51	35
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCC2)C1	ZINC000450602211	FI	On-Demand	Anodyne	MC4R	42	36
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCOCC2(CCC2)C1	ZINC000450602211	FI	On-Demand	Anodyne	PRCP	51	35
CC[C@H](O)CC(=O)N[C@@H]1CCN(CC)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450602226	EF	On-Demand	Anodyne	ENV	42	33
CC[C@H](O)CC(=O)N[C@H]1CCN(CC)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450602227	EF	On-Demand	Anodyne	ENV	42	33
CC[C@H](O)CC(=O)N[C@@H]1CCN(CC)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450602228	EF	On-Demand	Anodyne	ENV	42	33
CC[C@H](O)CC(=O)N[C@H]1CCN(CC)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450602229	EF	On-Demand	Anodyne	ENV	42	33
F[C@@H]1CCN(c2nnc(-c3ccccc3Cl)s2)C1	ZINC000450602264	CG	On-Demand	Anodyne	HRH3	15	66
F[C@H]1CCN(c2nnc(-c3ccccc3Cl)s2)C1	ZINC000450602265	CG	On-Demand	Anodyne	HRH3	15	66
COc1cc(Br)c(C(=O)NCC2(CN(C)C)CCCC2)cc1OC	ZINC000450602266	GG	On-Demand	Anodyne	KCNA3	42	36
COc1cc(Br)c(C(=O)NCC2(CN(C)C)CCCC2)cc1OC	ZINC000450602266	GG	On-Demand	Anodyne	SLC6A5	15	44
COc1cc(Br)c(C(=O)NCC2(CN(C)C)CCCC2)cc1OC	ZINC000450602266	GG	On-Demand	Anodyne	HCN1	54	39
COc1cc(Br)c(C(=O)NCC2(CN(C)C)CCCC2)cc1OC	ZINC000450602266	GG	On-Demand	Anodyne	HCN4	50	37
O=C(c1ccnc(OC(F)F)c1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450602267	FD	On-Demand	Anodyne	SLC6A7	0	48
COCCC(C)(C)CNC(=O)c1cc2n(n1)CCC2	ZINC000450602270	CD	On-Demand	Anodyne	CACNA1I	42	33
COc1ccccc1C1(CNC(=O)c2ccsc2C)CCC1	ZINC000450602271	DH	On-Demand	Anodyne	KCNA3	63	51
COc1ccccc1C1(CNC(=O)c2ccsc2C)CCC1	ZINC000450602271	DH	On-Demand	Anodyne	HCN1	82	47
COc1ccccc1C1(CNC(=O)c2ccsc2C)CCC1	ZINC000450602271	DH	On-Demand	Anodyne	HCN4	58	42
COc1ccccc1C1(CNC(=O)CCCc2ncc(C)o2)CCC1	ZINC000450602272	EH	On-Demand	Anodyne	KCNA3	41	36
COc1ccccc1C1(CNC(=O)CCCc2ncc(C)o2)CCC1	ZINC000450602272	EH	On-Demand	Anodyne	MTNR1A	21	42
CCOC(=O)c1cnccc1N1CC[C@@H](F)C1	ZINC000450602277	BD	On-Demand	Anodyne	LIPG	48	36
CCOC(=O)c1cnccc1N1CC[C@H](F)C1	ZINC000450602278	BD	On-Demand	Anodyne	LIPG	48	36
COc1ccc(OC(F)(F)F)c(C(=O)NCCC2CCC(OC)CC2)c1	ZINC000450602293	GH	On-Demand	Anodyne	NQO2	35	42
COc1ccc(OC(F)(F)F)c(C(=O)NCCC2CCC(OC)CC2)c1	ZINC000450602293	GH	On-Demand	Anodyne	MTNR1A	40	38
CCc1cccc(C(=O)NCCC2CCC(OC)CC2)n1	ZINC000450602305	CF	On-Demand	Anodyne	GRM1	0	42
COC1CCC(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450602330	CG	On-Demand	Anodyne	SCN10A	40	35
COC1CCC(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450602330	CG	On-Demand	Anodyne	CACNA1I	57	38
Cc1cccc(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)n1	ZINC000450602351	GJ	On-Demand	Anodyne	ALOX5	22	43
Cc1nccc(N2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)CC2)n1	ZINC000450602419	DD	On-Demand	Anodyne	SORD	69	38
Cc1nccc(N2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)CC2)n1	ZINC000450602419	DD	On-Demand	Anodyne	NPBWR1	55	33
CCOC(=O)[C@H]1CN(C[C@@H](C)S(C)(=O)=O)Cc2ccccc21	ZINC000450602442	ED	On-Demand	Anodyne	CHRM5	15	40
CCOC(=O)[C@@H]1CN(C[C@@H](C)S(C)(=O)=O)Cc2ccccc21	ZINC000450602443	ED	On-Demand	Anodyne	CHRM5	15	40
CCOC(=O)[C@@H]1CN(C[C@H](C)S(C)(=O)=O)Cc2ccccc21	ZINC000450602444	ED	On-Demand	Anodyne	CHRM5	15	40
CCOC(=O)[C@H]1CN(C[C@H](C)S(C)(=O)=O)Cc2ccccc21	ZINC000450602445	ED	On-Demand	Anodyne	CHRM5	15	40
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450602451	GG	On-Demand	Anodyne	RBP4	94	40
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450602451	GG	On-Demand	Anodyne	SLC6A7	0	44
CCN1C(=O)CCc2cc(NC(=O)c3ccsc3Br)ccc21	ZINC000450602453	GI	On-Demand	Anodyne	NOS1	16	46
CCN1C(=O)CCc2cc(NC(=O)c3ccsc3Br)ccc21	ZINC000450602453	GI	On-Demand	Anodyne	NAMPT	32	47
CC(=O)CCCCCSc1nnc(-c2ccc(C)c(C)c2)o1	ZINC000450602476	DJ	On-Demand	Anodyne	GSK3B	15	40
CC(=O)CCCCCSc1nnc(-c2ccc(C)c(C)c2)o1	ZINC000450602476	DJ	On-Demand	Anodyne	GSK3A	46	40
CC(=O)CCCCCSc1nnc(-c2ccc(C)c(C)c2)o1	ZINC000450602476	DJ	On-Demand	Anodyne	ALOX15	43	36
COCCNC(=O)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450602494	CD	On-Demand	Anodyne	DRD4	41	31
COCCNC(=O)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450602499	CD	On-Demand	Anodyne	DRD4	41	31
O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@@H](O)C1CCC1	ZINC000450602507	EF	On-Demand	Anodyne	ENV	44	34
O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)[C@H](O)C1CCC1	ZINC000450602508	EF	On-Demand	Anodyne	ENV	44	34
O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)[C@@H](O)C1CCC1	ZINC000450602509	EF	On-Demand	Anodyne	ENV	44	34
O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)[C@H](O)C1CCC1	ZINC000450602510	EF	On-Demand	Anodyne	ENV	44	34
CCOC(=O)c1cnc2ccccc2c1N1CC[C@@H](F)C1	ZINC000450602511	CF	On-Demand	Anodyne	ADORA1	0	44
CCOC(=O)c1cnc2ccccc2c1N1CC[C@H](F)C1	ZINC000450602512	CF	On-Demand	Anodyne	ADORA1	0	44
CC[C@@H](CC(C)C)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450602513	DH	On-Demand	Anodyne	NAMPT	0	43
CC[C@H](CC(C)C)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450602515	DH	On-Demand	Anodyne	NAMPT	0	43
COc1ccccc1C1(CNC(=O)c2cn(CC3CC3)nn2)CCC1	ZINC000450602538	EF	On-Demand	Anodyne	HCN1	59	36
COc1ccccc1C1(CNC(=O)c2cn(CC3CC3)nn2)CCC1	ZINC000450602538	EF	On-Demand	Anodyne	HCN4	57	36
COc1ccccc1C1(CNC(=O)c2cc(C)n(C(C)C)n2)CCC1	ZINC000450602539	EH	On-Demand	Anodyne	KCNA3	50	41
COc1ccccc1C1(CNC(=O)c2cc(C)n(C(C)C)n2)CCC1	ZINC000450602539	EH	On-Demand	Anodyne	SOAT1	17	47
COc1ccccc1C1(CNC(=O)c2cc(C)n(C(C)C)n2)CCC1	ZINC000450602539	EH	On-Demand	Anodyne	ACAT	0	51
COc1ccccc1C1(CNC(=O)c2cc(C)n(C(C)C)n2)CCC1	ZINC000450602539	EH	On-Demand	Anodyne	HCN1	72	43
COc1ccccc1C1(CNC(=O)c2cc(C)n(C(C)C)n2)CCC1	ZINC000450602539	EH	On-Demand	Anodyne	HCN4	54	43
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(=O)OC)[C@H]2C(=O)OC)cc1	ZINC000450602545	GD	On-Demand	Anodyne	HRH3	0	46
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(=O)OC)[C@H]2C(=O)OC)cc1	ZINC000450602545	GD	On-Demand	Anodyne	RORC	52	33
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(=O)OC)[C@H]2C(=O)OC)cc1	ZINC000450602546	GD	On-Demand	Anodyne	HRH3	0	46
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(=O)OC)[C@H]2C(=O)OC)cc1	ZINC000450602546	GD	On-Demand	Anodyne	RORC	52	33
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(=O)OC)[C@@H]2C(=O)OC)cc1	ZINC000450602547	GD	On-Demand	Anodyne	HRH3	0	46
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(=O)OC)[C@@H]2C(=O)OC)cc1	ZINC000450602547	GD	On-Demand	Anodyne	RORC	52	33
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(=O)OC)[C@@H]2C(=O)OC)cc1	ZINC000450602548	GD	On-Demand	Anodyne	HRH3	0	46
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(=O)OC)[C@@H]2C(=O)OC)cc1	ZINC000450602548	GD	On-Demand	Anodyne	RORC	52	33
Cc1cc(N2CC[C@@H](F)C2)c2cc(F)ccc2n1	ZINC000450602553	BG	On-Demand	Anodyne	GYRB	0	57
Cc1cc(N2CC[C@@H](F)C2)c2cc(F)ccc2n1	ZINC000450602553	BG	On-Demand	Anodyne	DHODH	49	38
Cc1cc(N2CC[C@H](F)C2)c2cc(F)ccc2n1	ZINC000450602554	BG	On-Demand	Anodyne	GYRB	0	57
Cc1cc(N2CC[C@H](F)C2)c2cc(F)ccc2n1	ZINC000450602554	BG	On-Demand	Anodyne	DHODH	49	38
F[C@H]1CCN(c2nc(C3CC3)cc(N3CC[C@@H](F)C3)n2)C1	ZINC000450602559	CE	On-Demand	Anodyne	HRH4	37	50
F[C@H]1CCN(c2cc(C3CC3)nc(N3CC[C@@H](F)C3)n2)C1	ZINC000450602560	CE	On-Demand	Anodyne	HRH4	37	50
F[C@H]1CCN(c2cc(C3CC3)nc(N3CC[C@H](F)C3)n2)C1	ZINC000450602561	CE	On-Demand	Anodyne	HRH4	37	50
F[C@@H]1CCN(c2cc(C3CC3)nc(N3CC[C@@H](F)C3)n2)C1	ZINC000450602562	CE	On-Demand	Anodyne	HRH4	37	50
COCCC(C)(C)CNC(=O)c1ccc(I)cc1F	ZINC000450602577	GG	On-Demand	Anodyne	MAP2K1	41	35
COCCC(C)(C)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450602583	DF	On-Demand	Anodyne	P2RY12	63	35
COCCC(C)(C)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450602583	DF	On-Demand	Anodyne	CTSV	52	37
COCCC(C)(C)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450602583	DF	On-Demand	Anodyne	AGER	0	40
COc1ccccc1C1(CNC(=O)CCCC(=O)C2CC2)CCC1	ZINC000450602584	EG	On-Demand	Anodyne	KCNA3	42	43
COc1ccccc1C1(CNC(=O)CCCC(=O)C2CC2)CCC1	ZINC000450602584	EG	On-Demand	Anodyne	ACAT	0	50
COc1ccc(-c2nnc(N3CC[C@H](F)C3)c3ccccc23)cc1	ZINC000450602592	DH	On-Demand	Anodyne	CACNA2D1	20	40
COc1ccc(-c2nnc(N3CC[C@H](F)C3)c3ccccc23)cc1	ZINC000450602592	DH	On-Demand	Anodyne	PDE3A	42	36
COc1ccc(-c2nnc(N3CC[C@H](F)C3)c3ccccc23)cc1	ZINC000450602592	DH	On-Demand	Anodyne	PDE3B	41	36
COc1ccc(-c2nnc(N3CC[C@H](F)C3)c3ccccc23)cc1	ZINC000450602592	DH	On-Demand	Anodyne	CACNA2D2	34	40
COc1ccc(-c2nnc(N3CC[C@H](F)C3)c3ccccc23)cc1	ZINC000450602592	DH	On-Demand	Anodyne	SMO	52	56
COC1CCC(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC000450602614	DH	On-Demand	Anodyne	SIRT3	60	39
COC1CCC(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC000450602614	DH	On-Demand	Anodyne	SIRT2	60	39
COC1CCC(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC000450602614	DH	On-Demand	Anodyne	SIRT1	60	39
CC(F)(F)CCN[C@@H](c1ccc(F)cc1)c1ccccn1	ZINC000450602616	CH	On-Demand	Anodyne	HRH1	16	45
CC(F)(F)CCN[C@H](c1ccc(F)cc1)c1ccccn1	ZINC000450602617	CH	On-Demand	Anodyne	HRH1	16	45
CCCc1cc(NCc2ccnc(OC)n2)n2ncnc2n1	ZINC000450602643	CD	On-Demand	Anodyne	DHOD	0	43
O=c1c(Cl)c(N2CC[C@@H](F)C2)cnn1-c1ccc(C(F)(F)F)cn1	ZINC000450602647	FF	On-Demand	Anodyne	LIPG	43	38
O=c1c(Cl)c(N2CC[C@H](F)C2)cnn1-c1ccc(C(F)(F)F)cn1	ZINC000450602649	FF	On-Demand	Anodyne	LIPG	43	38
COC(=O)c1csc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)n1	ZINC000450602651	FC	On-Demand	Anodyne	SLC6A1	64	35
COC(=O)c1csc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)n1	ZINC000450602653	FC	On-Demand	Anodyne	SLC6A1	64	35
COC(=O)c1csc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)n1	ZINC000450602655	FC	On-Demand	Anodyne	SLC6A1	64	35
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1	ZINC000450602657	FH	On-Demand	Bother	COLA	103	40
CC(=O)c1ccc(CSc2nnc(CN3CCCC3)n2-c2ccccc2)cc1	ZINC000450602659	GI	On-Demand	Anodyne	SLC5A2	0	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1CCC(F)(F)C1	ZINC000450602661	ED	On-Demand	Anodyne	SLC6A1	33	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1CCC(F)(F)C1	ZINC000450602661	ED	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1CCC(F)(F)C1	ZINC000450602664	ED	On-Demand	Anodyne	SLC6A1	33	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1CCC(F)(F)C1	ZINC000450602664	ED	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1CCC(F)(F)C1	ZINC000450602666	ED	On-Demand	Anodyne	SLC6A1	33	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@H]1CCC(F)(F)C1	ZINC000450602666	ED	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1CCC(F)(F)C1	ZINC000450602668	ED	On-Demand	Anodyne	SLC6A1	33	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@H]1CCC(F)(F)C1	ZINC000450602668	ED	On-Demand	Anodyne	SLC6A3	23	40
CC(C)(CS(C)(=O)=O)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450602670	DD	On-Demand	Anodyne	EPHX2	0	41
Cc1nccc(N2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)n1	ZINC000450602672	EF	On-Demand	Anodyne	SLC6A7	0	42
COc1ccc(-c2nnc(N3CC[C@@H](F)C3)c3ccccc23)cc1	ZINC000450602676	DH	On-Demand	Anodyne	CACNA2D1	20	40
COc1ccc(-c2nnc(N3CC[C@@H](F)C3)c3ccccc23)cc1	ZINC000450602676	DH	On-Demand	Anodyne	PDE3A	42	36
COc1ccc(-c2nnc(N3CC[C@@H](F)C3)c3ccccc23)cc1	ZINC000450602676	DH	On-Demand	Anodyne	PDE3B	41	36
COc1ccc(-c2nnc(N3CC[C@@H](F)C3)c3ccccc23)cc1	ZINC000450602676	DH	On-Demand	Anodyne	CACNA2D2	34	40
COc1ccc(-c2nnc(N3CC[C@@H](F)C3)c3ccccc23)cc1	ZINC000450602676	DH	On-Demand	Anodyne	SMO	52	56
CC(C)(CS(C)(=O)=O)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450602684	FF	On-Demand	Anodyne	MC3R	34	42
CC(C)(CS(C)(=O)=O)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450602684	FF	On-Demand	Anodyne	MC5R	27	42
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450602690	FF	On-Demand	Anodyne	MC3R	34	42
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450602690	FF	On-Demand	Anodyne	MC5R	27	42
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450602692	FF	On-Demand	Anodyne	MC3R	34	42
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450602692	FF	On-Demand	Anodyne	MC5R	27	42
CC(C)(CS(C)(=O)=O)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450602694	FF	On-Demand	Anodyne	MC3R	34	42
CC(C)(CS(C)(=O)=O)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450602694	FF	On-Demand	Anodyne	MC5R	27	42
NS(=O)(=O)c1ccc(NCc2cc(C3CC3)ccc2F)c([N+](=O)[O-])c1	ZINC000450602719	FF	On-Demand	Bother	CA2	16	43
NS(=O)(=O)c1ccc(NCc2cc(C3CC3)ccc2F)c([N+](=O)[O-])c1	ZINC000450602719	FF	On-Demand	Bother	CA1	18	43
CN1CCN(CC2(C)CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)CC1	ZINC000450602737	GG	On-Demand	Anodyne	ADAM10	44	39
CN1CCN(CC2(C)CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)CC1	ZINC000450602740	GG	On-Demand	Anodyne	ADAM10	44	39
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	MMP13	27	45
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	CTSK	27	42
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	CTSL	22	42
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	MMP2	30	53
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	MMP3	19	45
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	MMP8	17	53
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	CTSS	23	42
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	CAPN1	22	54
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	MMP9	19	53
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	MMP7	24	41
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450602741	GF	On-Demand	Anodyne	PSMB5	36	50
CN1CCN(CC2(C)CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)CC1	ZINC000450602743	GG	On-Demand	Anodyne	ADAM10	44	39
CN1CCN(CC2(C)CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)CC1	ZINC000450602745	GG	On-Demand	Anodyne	ADAM10	44	39
COc1nccc(CNc2ccc(S(C)(=O)=O)cc2C(F)(F)F)n1	ZINC000450602756	FF	On-Demand	Anodyne	PTGS2	17	40
C[C@@H](O)CCCN[C@H](c1cccc(Cl)c1)c1ccccn1	ZINC000450602758	DH	On-Demand	Anodyne	HRH1	0	45
C[C@@H](O)CCCN[C@@H](c1cccc(Cl)c1)c1ccccn1	ZINC000450602760	DH	On-Demand	Anodyne	HRH1	0	45
C(=C\c1ccccc1)\CCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1	ZINC000450602762	DI	On-Demand	Anodyne	SLC6A1	47	36
C[C@H](O)CCCN[C@@H](c1cccc(Cl)c1)c1ccccn1	ZINC000450602764	DH	On-Demand	Anodyne	HRH1	0	45
C[C@H](O)CCCN[C@H](c1cccc(Cl)c1)c1ccccn1	ZINC000450602766	DH	On-Demand	Anodyne	HRH1	0	45
Clc1ccc(CCN2CCC[C@@H]([C@H]3CCOC3)C2)cc1	ZINC000450602773	CH	On-Demand	Anodyne	HRH3	16	43
Clc1ccc(CCN2CCC[C@@H]([C@H]3CCOC3)C2)cc1	ZINC000450602773	CH	On-Demand	Anodyne	SIGMAR1	17	44
Clc1ccc(CCN2CCC[C@@H]([C@H]3CCOC3)C2)cc1	ZINC000450602773	CH	On-Demand	Anodyne	BIRC2	42	42
Clc1ccc(CCN2CCC[C@H]([C@H]3CCOC3)C2)cc1	ZINC000450602774	CH	On-Demand	Anodyne	HRH3	16	43
Clc1ccc(CCN2CCC[C@H]([C@H]3CCOC3)C2)cc1	ZINC000450602774	CH	On-Demand	Anodyne	SIGMAR1	17	44
Clc1ccc(CCN2CCC[C@H]([C@H]3CCOC3)C2)cc1	ZINC000450602774	CH	On-Demand	Anodyne	BIRC2	42	42
Clc1ccc(CCN2CCC[C@@H]([C@@H]3CCOC3)C2)cc1	ZINC000450602775	CH	On-Demand	Anodyne	HRH3	16	43
Clc1ccc(CCN2CCC[C@@H]([C@@H]3CCOC3)C2)cc1	ZINC000450602775	CH	On-Demand	Anodyne	SIGMAR1	17	44
Clc1ccc(CCN2CCC[C@@H]([C@@H]3CCOC3)C2)cc1	ZINC000450602775	CH	On-Demand	Anodyne	BIRC2	42	42
Clc1ccc(CCN2CCC[C@H]([C@@H]3CCOC3)C2)cc1	ZINC000450602776	CH	On-Demand	Anodyne	HRH3	16	43
Clc1ccc(CCN2CCC[C@H]([C@@H]3CCOC3)C2)cc1	ZINC000450602776	CH	On-Demand	Anodyne	SIGMAR1	17	44
Clc1ccc(CCN2CCC[C@H]([C@@H]3CCOC3)C2)cc1	ZINC000450602776	CH	On-Demand	Anodyne	BIRC2	42	42
C(=C/c1ccccc1)\CCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1	ZINC000450602779	DI	On-Demand	Anodyne	SLC6A1	47	36
C(=C/c1ccccc1)\CCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1	ZINC000450602780	DI	On-Demand	Anodyne	SLC6A1	47	36
C(=C\c1ccccc1)\CCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1	ZINC000450602781	DI	On-Demand	Anodyne	SLC6A1	47	36
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450602784	EH	On-Demand	Anodyne	PRNP	53	38
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450602784	EH	On-Demand	Anodyne	HDAC1	31	43
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450602784	EH	On-Demand	Anodyne	P4HTM	0	47
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450602784	EH	On-Demand	Anodyne	DGAT1	40	35
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450602786	EH	On-Demand	Anodyne	PRNP	53	38
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450602786	EH	On-Demand	Anodyne	HDAC1	31	43
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450602786	EH	On-Demand	Anodyne	P4HTM	0	47
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450602786	EH	On-Demand	Anodyne	DGAT1	40	35
O=[N+]([O-])c1ccccc1CN(C[C@H]1COCCO1)C1CC1	ZINC000450602794	CD	On-Demand	Bother	COLA	82	33
O=[N+]([O-])c1ccccc1CN(C[C@@H]1COCCO1)C1CC1	ZINC000450602796	CD	On-Demand	Bother	COLA	82	33
O=C(c1cncc(Cl)c1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450602800	GI	On-Demand	Anodyne	HRH1	38	46
O=C(c1cncc(Cl)c1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450602800	GI	On-Demand	Anodyne	PRSS2	43	30
O=C(c1cncc(Cl)c1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450602800	GI	On-Demand	Anodyne	HRH3	15	45
O=C(c1cncc(Cl)c1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450602800	GI	On-Demand	Anodyne	CCR3	34	49
O=C(c1cncc(Cl)c1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450602800	GI	On-Demand	Anodyne	EPHX2	18	42
O=C(c1cncc(Cl)c1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450602800	GI	On-Demand	Anodyne	SCD1	18	45
O=C(c1cncc(Cl)c1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450602800	GI	On-Demand	Anodyne	L3MBTL1	0	46
O=C(c1cncc(Cl)c1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450602800	GI	On-Demand	Anodyne	MBTD1	0	43
COC(=O)[C@@H]1CCCN(CC/C=C/c2ccccc2)[C@H]1C(=O)OC	ZINC000450602801	EF	On-Demand	Anodyne	SLC6A1	22	40
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CC/C=C\c1ccccc1	ZINC000450602802	EF	On-Demand	Anodyne	SLC6A1	22	40
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CC/C=C/c1ccccc1	ZINC000450602803	EF	On-Demand	Anodyne	SLC6A1	22	40
COC(=O)[C@@H]1CCCN(CC/C=C\c2ccccc2)[C@H]1C(=O)OC	ZINC000450602804	EF	On-Demand	Anodyne	SLC6A1	22	40
COCCC(C)(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450602809	DG	On-Demand	Anodyne	TRPV1	23	51
COCCC(C)(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450602809	DG	On-Demand	Anodyne	NCE103	32	50
COCCC(C)(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450602809	DG	On-Demand	Anodyne	P96878_MYCTU	19	49
COCCC(C)(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450602809	DG	On-Demand	Anodyne	CAN2	0	50
COC[C@]1(C)CCN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450602810	GD	On-Demand	Bother	TAAR1	20	42
COC[C@]1(C)CCN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450602811	GD	On-Demand	Bother	TAAR1	20	42
COC[C@@]1(C)CCN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450602812	GD	On-Demand	Bother	TAAR1	20	42
COC[C@@]1(C)CCN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450602813	GD	On-Demand	Bother	TAAR1	20	42
CCN1C(=O)CCc2cc(NC(=O)Cc3ccc(O)c(OC)c3)ccc21	ZINC000450602815	FF	On-Demand	Anodyne	TRPV1	0	44
CCN1C(=O)CCc2cc(NC(=O)Cc3ccc(O)c(OC)c3)ccc21	ZINC000450602815	FF	On-Demand	Anodyne	ENPP1	49	30
COC(=O)c1ccc(CC(=O)N2CCN(c3ccnc(C)n3)CC2)cc1	ZINC000450602817	FD	On-Demand	Anodyne	SORD	58	38
COC[C@@]1(C)CCN(c2cc(C)nc3ccccc23)C1	ZINC000450602822	CG	On-Demand	Anodyne	ADAM17	46	37
COC[C@]1(C)CCN(c2cc(C)nc3ccccc23)C1	ZINC000450602824	CG	On-Demand	Anodyne	ADAM17	46	37
COc1ccccc1C1(CNC(=O)[C@@H](NC(C)=O)C(C)(C)C)CCC1	ZINC000450602825	EF	On-Demand	Anodyne	ACAT	0	52
CCN1C(=O)CCc2cc(NC(=O)c3ccc(C(F)(F)F)cc3C)ccc21	ZINC000450602828	GJ	On-Demand	Anodyne	MTTP	72	39
CC[C@@H](O)CC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450602837	EC	On-Demand	Anodyne	ADRB2	25	45
CC[C@@H](O)CC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450602837	EC	On-Demand	Anodyne	ADRB1	22	45
CC[C@@H](O)CC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450602837	EC	On-Demand	Anodyne	GRIN1	42	47
CC[C@H](O)CC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450602838	EC	On-Demand	Anodyne	ADRB2	25	45
CC[C@H](O)CC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450602838	EC	On-Demand	Anodyne	ADRB1	22	45
CC[C@H](O)CC(=O)NCCOc1ccc(NS(C)(=O)=O)cc1	ZINC000450602838	EC	On-Demand	Anodyne	GRIN1	42	47
CN(C)CCCNS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450602853	FD	On-Demand	Bother	BDKRB1	0	41
CN(C)CCCNS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450602853	FD	On-Demand	Bother	BCL2L1	78	35
CN(C)CCCNS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450602853	FD	On-Demand	Bother	BCL2	64	31
CN(C)CCCNS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450602856	FD	On-Demand	Bother	BDKRB1	0	41
CN(C)CCCNS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450602856	FD	On-Demand	Bother	BCL2L1	78	35
CN(C)CCCNS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450602856	FD	On-Demand	Bother	BCL2	64	31
COC(=O)c1csc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)n1	ZINC000450602871	EG	On-Demand	Bother	COLA	97	38
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H](F)C2)nn1	ZINC000450602874	CE	On-Demand	Anodyne	SCD1	56	55
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H](F)C2)nn1	ZINC000450602874	CE	On-Demand	Anodyne	SCD	39	43
O=C(Nc1ccccc1)c1ccc(N2CC[C@H](F)C2)nn1	ZINC000450602875	CE	On-Demand	Anodyne	SCD1	56	55
O=C(Nc1ccccc1)c1ccc(N2CC[C@H](F)C2)nn1	ZINC000450602875	CE	On-Demand	Anodyne	SCD	39	43
COCCC(C)(C)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450602888	DI	On-Demand	Anodyne	AMY2	45	31
COc1ccccc1C1(CNC(=O)C2(C(F)(F)F)CCC2)CCC1	ZINC000450602898	EH	On-Demand	Anodyne	KCNA3	49	41
COc1ccccc1C1(CNC(=O)C2(C(F)(F)F)CCC2)CCC1	ZINC000450602898	EH	On-Demand	Anodyne	ACAT	0	54
COc1ccccc1C1(CNC(=O)C2(C(F)(F)F)CCC2)CCC1	ZINC000450602898	EH	On-Demand	Anodyne	HCN1	47	36
COc1ccccc1C1(CNC(=O)C2(C(F)(F)F)CCC2)CCC1	ZINC000450602898	EH	On-Demand	Anodyne	HCN4	40	34
C=CCNC(=O)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450602899	BD	On-Demand	Mild	HPGDS	28	42
C=CCNC(=O)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450602900	BD	On-Demand	Mild	HPGDS	28	42
CC[C@H](CC(F)(F)F)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450602901	EI	On-Demand	Anodyne	KCNA3	47	39
CC[C@H](CC(F)(F)F)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450602901	EI	On-Demand	Anodyne	ACAT	0	52
CC[C@H](CC(F)(F)F)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450602901	EI	On-Demand	Anodyne	HCN1	57	36
CC[C@H](CC(F)(F)F)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450602901	EI	On-Demand	Anodyne	HCN4	49	36
CC[C@@H](CC(F)(F)F)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450602902	EI	On-Demand	Anodyne	KCNA3	47	39
CC[C@@H](CC(F)(F)F)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450602902	EI	On-Demand	Anodyne	ACAT	0	52
CC[C@@H](CC(F)(F)F)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450602902	EI	On-Demand	Anodyne	HCN1	57	36
CC[C@@H](CC(F)(F)F)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450602902	EI	On-Demand	Anodyne	HCN4	49	36
Cc1cc(C)c(C(=O)N2CCN(c3ncc(F)cn3)CC2)cc1Br	ZINC000450602903	GF	On-Demand	Anodyne	SLC6A7	0	43
O=C(c1cccnc1N1CC[C@H](F)C1)N1CCc2ccccc21	ZINC000450602908	DF	On-Demand	Anodyne	HCRTR1	44	34
O=C(c1cccnc1N1CC[C@@H](F)C1)N1CCc2ccccc21	ZINC000450602909	DF	On-Demand	Anodyne	HCRTR1	44	34
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	PPARG	15	41
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	CHRM3	15	44
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	MMP13	22	49
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	ECR	49	34
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	PPARD	17	41
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	ROCK2	18	41
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	MT-ND1	24	43
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	E3UJZ5_SPOLI	45	34
COCCC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450602910	GH	On-Demand	Anodyne	KCNK3	44	38
CCOc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)on1	ZINC000450602911	EF	On-Demand	Anodyne	ACAT	0	48
CCOc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)on1	ZINC000450602911	EF	On-Demand	Anodyne	HCN1	57	35
COCCC(C)(C)CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450602912	EF	On-Demand	Anodyne	PDEC	0	40
COCCC(C)(C)CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450602913	EF	On-Demand	Anodyne	PDEC	0	40
Cc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c2c1CCC2	ZINC000450602919	EE	On-Demand	Anodyne	HCRTR1	26	42
F[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450602922	CG	On-Demand	Anodyne	HNMT	41	32
F[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450602923	CG	On-Demand	Anodyne	HNMT	41	32
F[C@@H]1CCN(c2nnc(-c3ccccn3)s2)C1	ZINC000450602926	CE	On-Demand	Anodyne	HRH3	15	65
F[C@H]1CCN(c2nnc(-c3ccccn3)s2)C1	ZINC000450602927	CE	On-Demand	Anodyne	HRH3	15	65
COCCC(C)(C)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450602932	DH	On-Demand	Anodyne	SCN9A	24	41
COCCC(C)(C)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450602933	DH	On-Demand	Anodyne	SCN9A	24	41
COCCC(C)(C)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450602934	DH	On-Demand	Anodyne	SCN9A	24	41
COCCC(C)(C)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450602935	DH	On-Demand	Anodyne	SCN9A	24	41
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602939	FH	On-Demand	Anodyne	HTR2A	15	43
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602939	FH	On-Demand	Anodyne	HTR2C	17	45
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602939	FH	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602940	FH	On-Demand	Anodyne	HTR2A	15	43
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602940	FH	On-Demand	Anodyne	HTR2C	17	45
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602940	FH	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602941	FH	On-Demand	Anodyne	HTR2A	15	43
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602941	FH	On-Demand	Anodyne	HTR2C	17	45
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602941	FH	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602942	FH	On-Demand	Anodyne	HTR2A	15	43
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602942	FH	On-Demand	Anodyne	HTR2C	17	45
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1	ZINC000450602942	FH	On-Demand	Anodyne	CYP2J2	60	42
CN(C)CC1(CNC(=O)c2ccsc2Br)CCCC1	ZINC000450602950	EG	On-Demand	Anodyne	HCN1	49	30
CN(C)CC1(CNC(=O)c2ccsc2Br)CCCC1	ZINC000450602950	EG	On-Demand	Anodyne	HCN4	46	30
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@H]2C)CCC1	ZINC000450602971	CF	On-Demand	Mild	KCNA3	43	42
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@H]2C)CCC1	ZINC000450602971	CF	On-Demand	Mild	ACAT	0	51
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@H]2C)CCC1	ZINC000450602971	CF	On-Demand	Mild	HCN1	41	34
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@H]2C)CCC1	ZINC000450602971	CF	On-Demand	Mild	HCN4	40	34
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@H]2C)CCC1	ZINC000450602971	CF	On-Demand	Mild	EZH2	45	35
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@H]2C)CCC1	ZINC000450602972	CF	On-Demand	Mild	KCNA3	43	42
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@H]2C)CCC1	ZINC000450602972	CF	On-Demand	Mild	ACAT	0	51
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@H]2C)CCC1	ZINC000450602972	CF	On-Demand	Mild	HCN1	41	34
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@H]2C)CCC1	ZINC000450602972	CF	On-Demand	Mild	HCN4	40	34
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@H]2C)CCC1	ZINC000450602972	CF	On-Demand	Mild	EZH2	45	35
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602973	CF	On-Demand	Mild	KCNA3	43	42
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602973	CF	On-Demand	Mild	ACAT	0	51
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602973	CF	On-Demand	Mild	HCN1	41	34
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602973	CF	On-Demand	Mild	HCN4	40	34
COc1ccccc1C1(CNC(=O)[C@@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602973	CF	On-Demand	Mild	EZH2	45	35
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602974	CF	On-Demand	Mild	KCNA3	43	42
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602974	CF	On-Demand	Mild	ACAT	0	51
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602974	CF	On-Demand	Mild	HCN1	41	34
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602974	CF	On-Demand	Mild	HCN4	40	34
COc1ccccc1C1(CNC(=O)[C@]2(C#N)C[C@@H]2C)CCC1	ZINC000450602974	CF	On-Demand	Mild	EZH2	45	35
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450602977	CG	On-Demand	Anodyne	HTR2C	22	51
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450602977	CG	On-Demand	Anodyne	SLC6A1	76	38
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450602977	CG	On-Demand	Anodyne	CYP2J2	69	48
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450602978	CG	On-Demand	Anodyne	HTR2C	22	51
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450602978	CG	On-Demand	Anodyne	SLC6A1	76	38
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450602978	CG	On-Demand	Anodyne	CYP2J2	69	48
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450602979	CG	On-Demand	Anodyne	HTR2C	22	51
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450602979	CG	On-Demand	Anodyne	SLC6A1	76	38
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450602979	CG	On-Demand	Anodyne	CYP2J2	69	48
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450602980	CG	On-Demand	Anodyne	HTR2C	22	51
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450602980	CG	On-Demand	Anodyne	SLC6A1	76	38
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450602980	CG	On-Demand	Anodyne	CYP2J2	69	48
Cc1nccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450602995	FG	On-Demand	Anodyne	TRPV1	19	41
Cc1nccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450602995	FG	On-Demand	Anodyne	SLC6A9	32	41
Cc1nccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450602995	FG	On-Demand	Anodyne	SORD	47	38
Cc1nccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450602995	FG	On-Demand	Anodyne	SCD1	21	40
Cc1nccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450602995	FG	On-Demand	Anodyne	LIPG	46	33
Cc1nccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450602995	FG	On-Demand	Anodyne	SLC6A7	0	45
CCC[C@@H](CC(C)C)C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450603002	DF	On-Demand	Anodyne	SORD	90	41
CCC[C@H](CC(C)C)C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450603003	DF	On-Demand	Anodyne	SORD	90	41
Cc1nccc(N2CCN(C(=O)c3ccc(-c4cnn(C)c4)o3)CC2)n1	ZINC000450603008	FD	On-Demand	Anodyne	SORD	45	34
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450603019	GF	On-Demand	Anodyne	EPHX2	18	41
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450603020	GF	On-Demand	Anodyne	EPHX2	18	41
O=C(c1c[nH]c2nccc-2c1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450603034	FJ	On-Demand	Anodyne	FASN	36	40
O=C(c1c[nH]c2nccc-2c1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450603034	FJ	On-Demand	Anodyne	RBP4	22	41
O=C(c1c[nH]c2nccc-2c1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450603034	FJ	On-Demand	Anodyne	L3MBTL3	44	33
O=C(c1c[nH]c2nccc-2c1)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450603034	FJ	On-Demand	Anodyne	SLC6A7	0	43
O=C(c1cnc(N2CC[C@@H](F)C2)c(Cl)c1)N1CCCCC1	ZINC000450603036	DF	On-Demand	Anodyne	P2RY12	25	42
O=C(c1cnc(N2CC[C@@H](F)C2)c(Cl)c1)N1CCCCC1	ZINC000450603036	DF	On-Demand	Anodyne	CXCR3	35	42
O=C(c1cnc(N2CC[C@@H](F)C2)c(Cl)c1)N1CCCCC1	ZINC000450603036	DF	On-Demand	Anodyne	L3MBTL3	52	35
O=C(c1cnc(N2CC[C@H](F)C2)c(Cl)c1)N1CCCCC1	ZINC000450603040	DF	On-Demand	Anodyne	P2RY12	25	42
O=C(c1cnc(N2CC[C@H](F)C2)c(Cl)c1)N1CCCCC1	ZINC000450603040	DF	On-Demand	Anodyne	CXCR3	35	42
O=C(c1cnc(N2CC[C@H](F)C2)c(Cl)c1)N1CCCCC1	ZINC000450603040	DF	On-Demand	Anodyne	L3MBTL3	52	35
CC(C)(CS(C)(=O)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450603053	DD	On-Demand	Anodyne	AKT1	0	41
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603065	DC	On-Demand	Anodyne	SLC6A1	86	40
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603065	DC	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603065	DC	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603069	DC	On-Demand	Anodyne	SLC6A1	86	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603069	DC	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603069	DC	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603070	DC	On-Demand	Anodyne	SLC6A1	86	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603070	DC	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cccnc1N	ZINC000450603070	DC	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)c1coc(CN2CCCC[C@H]2c2nc3ccccc3o2)n1	ZINC000450603078	EG	On-Demand	Anodyne	COLA	57	38
COC(=O)c1coc(CN2CCCC[C@H]2c2nc3ccccc3o2)n1	ZINC000450603078	EG	On-Demand	Anodyne	CPT1A	42	38
COC(=O)[C@@H](NCCCNc1ncnc2c(F)c(OC)ccc12)C(C)C	ZINC000450603079	FD	On-Demand	Anodyne	PDE6A	44	33
COC(=O)c1coc(CN2CCCC[C@@H]2c2nc3ccccc3o2)n1	ZINC000450603080	EG	On-Demand	Anodyne	COLA	57	38
COC(=O)c1coc(CN2CCCC[C@@H]2c2nc3ccccc3o2)n1	ZINC000450603080	EG	On-Demand	Anodyne	CPT1A	42	38
Cc1cc(C(=O)Nc2ccc(F)cc2NS(C)(=O)=O)nn1C(C)C	ZINC000450603081	FF	On-Demand	Anodyne	PLA2G7	41	46
O=C(N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc2c1CCCC2	ZINC000450603088	FI	On-Demand	Anodyne	HTR3A	18	40
CCN1C(=O)CCc2cc(NC(=O)Cn3ccc(C)n3)ccc21	ZINC000450603090	DE	On-Demand	Anodyne	CALCRL	40	32
O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccc2c1CCCC2	ZINC000450603091	FI	On-Demand	Anodyne	HTR3A	18	40
O=C(N[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccc2c1CCCC2	ZINC000450603093	FI	On-Demand	Anodyne	HTR3A	18	40
O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc2c1CCCC2	ZINC000450603094	FI	On-Demand	Anodyne	HTR3A	18	40
CC(C)OCCNC(=O)c1cccc(C#N)c1Br	ZINC000450603108	DE	On-Demand	Mild	ADRB1	42	34
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603114	FD	On-Demand	Anodyne	ACHE	18	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603114	FD	On-Demand	Anodyne	SLC6A1	134	46
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603114	FD	On-Demand	Anodyne	SLC6A4	37	48
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603114	FD	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603114	FD	On-Demand	Anodyne	SIGMAR1	29	40
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603115	FD	On-Demand	Anodyne	ACHE	18	41
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603115	FD	On-Demand	Anodyne	SLC6A1	134	46
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603115	FD	On-Demand	Anodyne	SLC6A4	37	48
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603115	FD	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603115	FD	On-Demand	Anodyne	SIGMAR1	29	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603116	FD	On-Demand	Anodyne	ACHE	18	41
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603116	FD	On-Demand	Anodyne	SLC6A1	134	46
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603116	FD	On-Demand	Anodyne	SLC6A4	37	48
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603116	FD	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCN(C)Cc1ccccc1	ZINC000450603116	FD	On-Demand	Anodyne	SIGMAR1	29	40
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603117	FE	On-Demand	Anodyne	DRD2	32	40
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603117	FE	On-Demand	Anodyne	SLC6A4	34	44
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603117	FE	On-Demand	Anodyne	SLC6A3	60	45
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603117	FE	On-Demand	Anodyne	HTR4	47	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603118	FE	On-Demand	Anodyne	DRD2	32	40
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603118	FE	On-Demand	Anodyne	SLC6A4	34	44
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603118	FE	On-Demand	Anodyne	SLC6A3	60	45
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603118	FE	On-Demand	Anodyne	HTR4	47	41
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603119	FE	On-Demand	Anodyne	DRD2	32	40
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603119	FE	On-Demand	Anodyne	SLC6A4	34	44
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603119	FE	On-Demand	Anodyne	SLC6A3	60	45
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(Cl)c(OC)c1	ZINC000450603119	FE	On-Demand	Anodyne	HTR4	47	41
COCCn1cc2c(n1)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)CCC2	ZINC000450603121	FF	On-Demand	Anodyne	DRD4	40	30
COCC1(C)CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450603123	FF	On-Demand	Anodyne	HRH2	15	42
COCC1(C)CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450603123	FF	On-Demand	Anodyne	EPHX2	26	48
COCC1(C)CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450603123	FF	On-Demand	Anodyne	CACNA1I	15	47
COCC1(C)CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450603123	FF	On-Demand	Anodyne	PRMT3	17	40
COc1cc(CC(=O)NCCOC(C)C)ccc1Cl	ZINC000450603144	CE	On-Demand	Anodyne	OPRK1	0	41
COc1cc(CC(=O)NCCOC(C)C)ccc1Cl	ZINC000450603144	CE	On-Demand	Anodyne	TRPV1	41	47
COc1cc(CC(=O)NCCOC(C)C)ccc1Cl	ZINC000450603144	CE	On-Demand	Anodyne	PTGDR	28	40
COc1cc(CC(=O)NCCOC(C)C)ccc1Cl	ZINC000450603144	CE	On-Demand	Anodyne	NCE103	33	54
COC1CCC(CCNC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450603185	DF	On-Demand	Anodyne	TRPV1	0	51
COC1CCC(CCNC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450603185	DF	On-Demand	Anodyne	NCE103	25	44
COC1CCC(CCNC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450603185	DF	On-Demand	Anodyne	CAN2	0	44
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450603190	GI	On-Demand	Anodyne	NAMPT	19	41
C[C@H]1C[C@H](c2cccnc2)N(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450603191	GI	On-Demand	Anodyne	NAMPT	19	41
COc1cc(OC)c2ncc(C#N)c(N3CC[C@@H](F)C3)c2c1	ZINC000450603193	DF	On-Demand	Mild	PDE3A	40	36
COc1cc(OC)c2ncc(C#N)c(N3CC[C@@H](F)C3)c2c1	ZINC000450603193	DF	On-Demand	Mild	PDE3B	59	36
COc1cc(OC)c2ncc(C#N)c(N3CC[C@H](F)C3)c2c1	ZINC000450603194	DF	On-Demand	Mild	PDE3A	40	36
COc1cc(OC)c2ncc(C#N)c(N3CC[C@H](F)C3)c2c1	ZINC000450603194	DF	On-Demand	Mild	PDE3B	59	36
CCc1cc(N2CC[C@@H](F)C2)c2ccccc2n1	ZINC000450603202	BG	On-Demand	Anodyne	METAP1	41	34
CCc1cc(N2CC[C@H](F)C2)c2ccccc2n1	ZINC000450603203	BG	On-Demand	Anodyne	METAP1	41	34
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450603212	FF	On-Demand	Anodyne	GPR88	0	40
COc1cccc2c(N3CC[C@@H](F)C3)cc(C)nc12	ZINC000450603213	CG	On-Demand	Anodyne	PDE3B	53	32
COc1cccc2c(N3CC[C@H](F)C3)cc(C)nc12	ZINC000450603214	CG	On-Demand	Anodyne	PDE3B	53	32
COCCC(C)(C)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450603221	DH	On-Demand	Anodyne	PPARA	0	41
F[C@@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450603224	CF	On-Demand	Anodyne	PDE3A	41	34
F[C@@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450603224	CF	On-Demand	Anodyne	PDE3B	60	34
F[C@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450603225	CF	On-Demand	Anodyne	PDE3A	41	34
F[C@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450603225	CF	On-Demand	Anodyne	PDE3B	60	34
CCS(=O)(=O)c1ccc(CSc2nnc(-c3ccc(C)c(C)c3)o2)cc1	ZINC000450603226	GI	On-Demand	Anodyne	GSK3B	26	47
CCS(=O)(=O)c1ccc(CSc2nnc(-c3ccc(C)c(C)c3)o2)cc1	ZINC000450603226	GI	On-Demand	Anodyne	GSK3A	63	47
CCS(=O)(=O)c1ccc(CSc2nnc(-c3ccc(C)c(C)c3)o2)cc1	ZINC000450603226	GI	On-Demand	Anodyne	TERT	30	53
Cc1ccc(F)c(CC(=O)N2CCN(c3ncc(F)cn3)CC2)c1	ZINC000450603230	ED	On-Demand	Anodyne	HCRTR1	38	40
Cc1ccc(F)c(CC(=O)N2CCN(c3ncc(F)cn3)CC2)c1	ZINC000450603230	ED	On-Demand	Anodyne	HCRTR2	25	40
Cc1ccc(F)c(CC(=O)N2CCN(c3ncc(F)cn3)CC2)c1	ZINC000450603230	ED	On-Demand	Anodyne	SLC6A7	0	40
COc1ccccc1C1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCC1	ZINC000450603235	FE	On-Demand	Anodyne	KCNA3	50	42
COc1ccccc1C1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCC1	ZINC000450603235	FE	On-Demand	Anodyne	CSF1R	46	41
COc1ccccc1C1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCC1	ZINC000450603235	FE	On-Demand	Anodyne	HCN1	75	39
COc1ccccc1C1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCC1	ZINC000450603235	FE	On-Demand	Anodyne	HCN4	53	37
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCc2c1cccc2C(F)(F)F	ZINC000450603253	GI	On-Demand	Anodyne	SCD1	22	40
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCc2c1cccc2C(F)(F)F	ZINC000450603253	GI	On-Demand	Anodyne	SCD	23	40
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCc2c1cccc2C(F)(F)F	ZINC000450603254	GI	On-Demand	Anodyne	SCD1	22	40
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCc2c1cccc2C(F)(F)F	ZINC000450603254	GI	On-Demand	Anodyne	SCD	23	40
C=C[C@@H]1OCC[C@H]1C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450603255	DF	On-Demand	Mild	KCNA3	43	41
Cc1cc(Cl)c2ncc(C#N)c(N3CC[C@@H](F)C3)c2c1	ZINC000450603256	CH	On-Demand	Mild	MAP3K8	40	33
Cc1cc(Cl)c2ncc(C#N)c(N3CC[C@H](F)C3)c2c1	ZINC000450603257	CH	On-Demand	Mild	MAP3K8	40	33
COc1ccccc1C1(CNC(=O)Cc2cn(C)nc2C)CCC1	ZINC000450603258	EF	On-Demand	Anodyne	ACAT	0	50
Cc1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)o2)cc1C	ZINC000450603268	DI	On-Demand	Anodyne	GSK3A	43	34
Cc1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)o2)cc1C	ZINC000450603269	DI	On-Demand	Anodyne	GSK3A	43	34
COC(=O)c1coc(CSc2nnc(-c3ccc(C)c(C)c3)o2)n1	ZINC000450603270	EG	On-Demand	Anodyne	GSK3B	0	48
COC(=O)c1coc(CSc2nnc(-c3ccc(C)c(C)c3)o2)n1	ZINC000450603270	EG	On-Demand	Anodyne	GSK3A	40	48
COC(=O)c1coc(CSc2nnc(-c3ccc(C)c(C)c3)o2)n1	ZINC000450603270	EG	On-Demand	Anodyne	ALOX15	50	37
F[C@H]1CCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450603275	BD	On-Demand	Anodyne	HRH4	19	47
F[C@@H]1CCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450603276	BD	On-Demand	Anodyne	HRH4	19	47
O=[N+]([O-])c1ccc2nc(N3CC[C@H](F)C3)ccc2c1	ZINC000450603310	CF	On-Demand	Bother	SLC6A4	17	54
O=[N+]([O-])c1ccc2nc(N3CC[C@@H](F)C3)ccc2c1	ZINC000450603311	CF	On-Demand	Bother	SLC6A4	17	54
Cc1nccc(N2CCN(C(=O)c3cc(Br)c(C)cc3C)CC2)n1	ZINC000450603314	GG	On-Demand	Anodyne	SORD	62	40
Cc1nccc(N2CCN(C(=O)c3cc(Br)c(C)cc3C)CC2)n1	ZINC000450603314	GG	On-Demand	Anodyne	SLC6A7	0	40
CC[C@H](CC(F)(F)F)C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450603315	EE	On-Demand	Anodyne	SORD	69	40
CC[C@@H](CC(F)(F)F)C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450603316	EE	On-Demand	Anodyne	SORD	69	40
COC(=O)CNC(=O)c1ccc(N2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450603318	ED	On-Demand	Bother	TAAR1	28	49
COC(=O)CNC(=O)c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000450603319	ED	On-Demand	Bother	TAAR1	28	49
C[C@]1(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CC=CCC1	ZINC000450603361	EI	On-Demand	Anodyne	ENV	44	35
C[C@]1(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)CC=CCC1	ZINC000450603362	EI	On-Demand	Anodyne	ENV	44	35
C[C@]1(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)CC=CCC1	ZINC000450603363	EI	On-Demand	Anodyne	ENV	44	35
C[C@]1(C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CC=CCC1	ZINC000450603364	EI	On-Demand	Anodyne	ENV	44	35
Cc1ccn(CC(=O)N2CCN(c3ccnc(C)n3)CC2)n1	ZINC000450603367	DC	On-Demand	Anodyne	SORD	65	43
c1ccc(CCC[C@H]2CCCN(Cc3cnns3)C2)cc1	ZINC000450603371	DH	On-Demand	Anodyne	SIGMAR1	25	42
c1ccc(CCC[C@@H]2CCCN(Cc3cnns3)C2)cc1	ZINC000450603372	DH	On-Demand	Anodyne	SIGMAR1	25	42
CC(C)(C(=O)N1CCC(Oc2cccc(Br)c2)CC1)C1CCC1	ZINC000450603374	GJ	On-Demand	Anodyne	PRSS2	48	33
CCN(CCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1)CC(C)C	ZINC000450603375	FH	On-Demand	Anodyne	ENPP2	19	40
CCN(CCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1)CC(C)C	ZINC000450603375	FH	On-Demand	Anodyne	L3MBTL3	51	36
O=[N+]([O-])c1ccc(N2CC[C@@H](F)C2)cc1C(F)(F)F	ZINC000450603379	CG	On-Demand	Bother	AADAC	0	42
O=[N+]([O-])c1ccc(N2CC[C@H](F)C2)cc1C(F)(F)F	ZINC000450603380	CG	On-Demand	Bother	AADAC	0	42
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603381	GH	On-Demand	Anodyne	CASP3	32	40
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603381	GH	On-Demand	Anodyne	CASP7	53	40
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603382	GH	On-Demand	Anodyne	CASP3	32	40
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603382	GH	On-Demand	Anodyne	CASP7	53	40
Cc1cc(-c2nc(C(=O)NC(C)(C)CS(C)(=O)=O)co2)ccn1	ZINC000450603385	ED	On-Demand	Anodyne	IRAK4	21	42
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@@]3(C)c3ccccc3)ccc21	ZINC000450603387	EH	On-Demand	Anodyne	NOS1	15	44
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@@]3(C)c3ccccc3)ccc21	ZINC000450603387	EH	On-Demand	Anodyne	NAMPT	31	45
O=C(CCCN1CCC(N2CCCNC2=O)CC1)c1ccc(F)cc1	ZINC000450603388	EF	On-Demand	Anodyne	DRD2	35	48
O=C(CCCN1CCC(N2CCCNC2=O)CC1)c1ccc(F)cc1	ZINC000450603388	EF	On-Demand	Anodyne	DRD1	0	49
O=C(CCCN1CCC(N2CCCNC2=O)CC1)c1ccc(F)cc1	ZINC000450603388	EF	On-Demand	Anodyne	DRD4	26	53
O=C(CCCN1CCC(N2CCCNC2=O)CC1)c1ccc(F)cc1	ZINC000450603388	EF	On-Demand	Anodyne	PLD1	41	36
O=C(CCCN1CCC(N2CCCNC2=O)CC1)c1ccc(F)cc1	ZINC000450603388	EF	On-Demand	Anodyne	SLC18A3	0	48
O=C(CCCN1CCC(N2CCCNC2=O)CC1)c1ccc(F)cc1	ZINC000450603388	EF	On-Demand	Anodyne	HTR3B	0	52
COC(=O)[C@@H]1CCCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)[C@H]1C(=O)OC	ZINC000450603395	GG	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)[C@@H]1CCCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)[C@H]1C(=O)OC	ZINC000450603396	GG	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450603397	GG	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450603398	GG	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)[C@H]1CCCN(Cc2ccccc2OC2CC2)[C@H]1C(=O)OC	ZINC000450603399	EE	On-Demand	Anodyne	MBTPS1	40	32
COC(=O)[C@@H]1CCCN(Cc2ccccc2OC2CC2)[C@H]1C(=O)OC	ZINC000450603400	EE	On-Demand	Anodyne	MBTPS1	40	32
COC(=O)[C@H]1CCCN(Cc2ccccc2OC2CC2)[C@@H]1C(=O)OC	ZINC000450603401	EE	On-Demand	Anodyne	MBTPS1	40	32
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccccc1OC1CC1	ZINC000450603402	EE	On-Demand	Anodyne	MBTPS1	40	32
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	HTR1A	19	43
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	DRD2	28	45
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	DRD1	0	43
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	DRD4	41	34
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	ADRA1D	25	40
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	DRD3	41	45
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	PDGFRB	18	47
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	CPT1A	45	31
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	PLK1	49	33
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	HPGD	47	58
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	AP2S1	0	40
COc1ccccc1-n1cnc2cc(C(=O)NCCOC(C)C)ccc21	ZINC000450603409	FG	On-Demand	Anodyne	ALPHA-1A	0	41
COc1ccccc1C1(CNC(=O)[C@H](Cc2ccccc2)OC)CCC1	ZINC000450603415	FG	On-Demand	Anodyne	MME	64	39
COc1ccccc1C1(CNC(=O)[C@H](Cc2ccccc2)OC)CCC1	ZINC000450603415	FG	On-Demand	Anodyne	KCNA3	43	43
COc1ccccc1C1(CNC(=O)[C@H](Cc2ccccc2)OC)CCC1	ZINC000450603415	FG	On-Demand	Anodyne	TIMP3	62	35
COc1ccccc1C1(CNC(=O)[C@H](Cc2ccccc2)OC)CCC1	ZINC000450603415	FG	On-Demand	Anodyne	ECE1	31	40
COc1ccccc1C1(CNC(=O)[C@H](Cc2ccccc2)OC)CCC1	ZINC000450603415	FG	On-Demand	Anodyne	ACAT	0	54
COc1ccccc1C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CCC1	ZINC000450603416	FG	On-Demand	Anodyne	MME	64	39
COc1ccccc1C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CCC1	ZINC000450603416	FG	On-Demand	Anodyne	KCNA3	43	43
COc1ccccc1C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CCC1	ZINC000450603416	FG	On-Demand	Anodyne	TIMP3	62	35
COc1ccccc1C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CCC1	ZINC000450603416	FG	On-Demand	Anodyne	ECE1	31	40
COc1ccccc1C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CCC1	ZINC000450603416	FG	On-Demand	Anodyne	ACAT	0	54
COc1ccccc1C1(CNC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)CCC1	ZINC000450603434	DH	On-Demand	Anodyne	KCNA3	48	43
COc1ccccc1C1(CNC(=O)C[C@@H]2CC[C@H]3C[C@H]23)CCC1	ZINC000450603435	DH	On-Demand	Anodyne	KCNA3	48	43
COC1CCC(CCNC(=O)c2cccc(C(F)(F)F)n2)CC1	ZINC000450603436	EG	On-Demand	Anodyne	TRPV1	70	35
COc1ccccc1C1(CNC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)CCC1	ZINC000450603437	DH	On-Demand	Anodyne	KCNA3	48	43
COc1ccccc1C1(CNC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)CCC1	ZINC000450603438	DH	On-Demand	Anodyne	KCNA3	48	43
COc1nccc(CNc2nc3ccccc3nc2N2CCCCC2)n1	ZINC000450603439	FG	On-Demand	Anodyne	HNMT	66	36
CC(=O)c1cccc(CN2CCCC[C@H]2c2nc3ccccc3o2)c1	ZINC000450603441	EJ	On-Demand	Anodyne	COLA	86	37
CC(=O)c1cccc(CN2CCCC[C@H]2c2nc3ccccc3o2)c1	ZINC000450603441	EJ	On-Demand	Anodyne	CPT1A	82	37
COc1ccccc1C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCC1	ZINC000450603442	GG	On-Demand	Anodyne	KCNA3	55	48
COc1ccccc1C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCC1	ZINC000450603442	GG	On-Demand	Anodyne	TGM2	16	40
COc1ccccc1C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCC1	ZINC000450603442	GG	On-Demand	Anodyne	ACAT	0	50
COc1ccccc1C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCC1	ZINC000450603442	GG	On-Demand	Anodyne	HCN1	56	38
COc1ccccc1C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCC1	ZINC000450603442	GG	On-Demand	Anodyne	HCN4	52	36
CC(=O)c1cccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)c1	ZINC000450603443	EJ	On-Demand	Anodyne	COLA	86	37
CC(=O)c1cccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)c1	ZINC000450603443	EJ	On-Demand	Anodyne	CPT1A	82	37
COc1cc(CN2CCC[C@@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450603488	DH	On-Demand	Anodyne	DRD4	24	45
COc1cc(CN2CCC[C@@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450603488	DH	On-Demand	Anodyne	SSTR5	44	38
COc1cc(CN2CCC[C@@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450603488	DH	On-Demand	Anodyne	CCR3	15	40
COc1cc(CN2CCC[C@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450603489	DH	On-Demand	Anodyne	DRD4	24	45
COc1cc(CN2CCC[C@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450603489	DH	On-Demand	Anodyne	SSTR5	44	38
COc1cc(CN2CCC[C@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450603489	DH	On-Demand	Anodyne	CCR3	15	40
COc1cc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450603491	DH	On-Demand	Anodyne	DRD4	24	45
COc1cc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450603491	DH	On-Demand	Anodyne	SSTR5	44	38
COc1cc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450603491	DH	On-Demand	Anodyne	CCR3	15	40
COc1cc(CN2CCC[C@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450603492	DH	On-Demand	Anodyne	DRD4	24	45
COc1cc(CN2CCC[C@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450603492	DH	On-Demand	Anodyne	SSTR5	44	38
COc1cc(CN2CCC[C@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450603492	DH	On-Demand	Anodyne	CCR3	15	40
COc1ccccc1C1(CNC(=O)Cn2cc(C(C)=O)nn2)CCC1	ZINC000450603493	ED	On-Demand	Anodyne	MTNR1A	19	40
COc1nccc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)n1	ZINC000450603496	EC	On-Demand	Anodyne	NPY1R	40	33
COc1nccc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)n1	ZINC000450603496	EC	On-Demand	Anodyne	NPY2R	53	37
CC(F)(F)CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450603497	EE	On-Demand	Anodyne	SCN9A	24	42
CC(F)(F)CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O	ZINC000450603498	EE	On-Demand	Anodyne	SCN9A	24	42
COC[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(F)c(F)c1	ZINC000450603508	FG	On-Demand	Anodyne	MTNR1A	28	44
COC[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(F)c(F)c1	ZINC000450603508	FG	On-Demand	Anodyne	MTNR1B	32	45
COC[C@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(F)c(F)c1	ZINC000450603510	FG	On-Demand	Anodyne	MTNR1A	28	44
COC[C@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(F)c(F)c1	ZINC000450603510	FG	On-Demand	Anodyne	MTNR1B	32	45
COC[C@@]1(C)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450603512	CF	On-Demand	Anodyne	PDE3A	44	33
COC[C@]1(C)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450603514	CF	On-Demand	Anodyne	PDE3A	44	33
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@](C)(COC)C1	ZINC000450603516	FG	On-Demand	Anodyne	ATP4A	19	49
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@](C)(COC)C1	ZINC000450603519	FG	On-Demand	Anodyne	ATP4A	19	49
CC1=C(C(=O)N2CCN(c3ncc(F)cn3)CC2)CCC(C)(C)C1	ZINC000450603520	EF	On-Demand	Anodyne	SLC6A7	0	42
COCCOC[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCCCC1	ZINC000450603527	GG	On-Demand	Anodyne	CTSD	24	46
COCCOC[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCCCC1	ZINC000450603527	GG	On-Demand	Anodyne	BACE1	23	44
COC[C@]1(C)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450603535	CD	On-Demand	Anodyne	P2RY12	29	43
COC[C@]1(C)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450603535	CD	On-Demand	Anodyne	CXCR3	26	42
COC[C@@]1(C)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450603536	CD	On-Demand	Anodyne	P2RY12	29	43
COC[C@@]1(C)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450603536	CD	On-Demand	Anodyne	CXCR3	26	42
COCCOC[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCCCC1	ZINC000450603539	GG	On-Demand	Anodyne	CTSD	24	46
COCCOC[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCCCC1	ZINC000450603539	GG	On-Demand	Anodyne	BACE1	23	44
COc1cc(N[C@H]2CCCN(CC[C@H](C)O)C2)cc(OC)c1	ZINC000450603541	DE	On-Demand	Anodyne	BIRC2	48	41
COc1cc(N[C@H]2CCCN(CC[C@@H](C)O)C2)cc(OC)c1	ZINC000450603543	DE	On-Demand	Anodyne	BIRC2	48	41
COc1cc(N[C@@H]2CCCN(CC[C@H](C)O)C2)cc(OC)c1	ZINC000450603545	DE	On-Demand	Anodyne	BIRC2	48	41
COc1cc(N[C@@H]2CCCN(CC[C@@H](C)O)C2)cc(OC)c1	ZINC000450603547	DE	On-Demand	Anodyne	BIRC2	48	41
CCCOc1cccc2c(NCc3ccnc(OC)n3)ccnc12	ZINC000450603555	DG	On-Demand	Anodyne	KCNN3	15	42
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450603562	EF	On-Demand	Anodyne	CTSK	16	44
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450603562	EF	On-Demand	Anodyne	CTSS	22	44
COCCC(C)(C)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450603562	EF	On-Demand	Anodyne	CAPN1	22	40
COCCOC[C@@H](O)CN1CCc2cc(-c3ccccc3)ccc21	ZINC000450603575	EF	On-Demand	Anodyne	CYP11B2	15	42
COCCOC[C@H](O)CN1CCc2cc(-c3ccccc3)ccc21	ZINC000450603576	EF	On-Demand	Anodyne	CYP11B2	15	42
COc1ccccc1C1(CNC(=O)CC[C@H]2CCC(=O)N2)CCC1	ZINC000450603578	EE	On-Demand	Anodyne	KCNA3	41	42
COc1ccccc1C1(CNC(=O)CC[C@H]2CCC(=O)N2)CCC1	ZINC000450603578	EE	On-Demand	Anodyne	MTNR1A	19	43
COc1ccccc1C1(CNC(=O)CC[C@@H]2CCC(=O)N2)CCC1	ZINC000450603580	EE	On-Demand	Anodyne	KCNA3	41	42
COc1ccccc1C1(CNC(=O)CC[C@@H]2CCC(=O)N2)CCC1	ZINC000450603580	EE	On-Demand	Anodyne	MTNR1A	19	43
CCCc1nc(C)c(CSc2nnc(-c3ccc(C)c(C)c3)o2)o1	ZINC000450603588	EJ	On-Demand	Anodyne	GSK3A	49	38
CCCc1nc(C)c(CSc2nnc(-c3ccc(C)c(C)c3)o2)o1	ZINC000450603588	EJ	On-Demand	Anodyne	TERT	22	42
Cc1nccc(N2CCN(C(=O)Cc3cc(Br)ccc3C)CC2)n1	ZINC000450603601	GF	On-Demand	Anodyne	SORD	54	41
CC[C@@H](O)CC(=O)Nc1cn(C)nc1-c1ccccc1	ZINC000450603618	CE	On-Demand	Anodyne	TACR3	40	34
CC[C@H](O)CC(=O)Nc1cn(C)nc1-c1ccccc1	ZINC000450603619	CE	On-Demand	Anodyne	TACR3	40	34
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1ccc(S(C)(=O)=O)cc1	ZINC000450603623	EH	On-Demand	Anodyne	PTGS2	43	41
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1ccc(S(C)(=O)=O)cc1	ZINC000450603624	EH	On-Demand	Anodyne	PTGS2	43	41
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1ccc(S(C)(=O)=O)cc1	ZINC000450603625	EH	On-Demand	Anodyne	PTGS2	43	41
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1ccc(S(C)(=O)=O)cc1	ZINC000450603626	EH	On-Demand	Anodyne	PTGS2	43	41
CC(=O)c1cccc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1	ZINC000450603637	DH	On-Demand	Bother	COLA	125	42
COC(=O)[C@@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450603641	DD	On-Demand	Anodyne	HCN1	40	32
COC(=O)[C@@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450603641	DD	On-Demand	Anodyne	HCN4	40	32
COC(=O)[C@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450603642	DD	On-Demand	Anodyne	HCN1	40	32
COC(=O)[C@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450603642	DD	On-Demand	Anodyne	HCN4	40	32
Cc1nccc(N2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)CC2)n1	ZINC000450603643	EE	On-Demand	Anodyne	SORD	42	36
NS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c(C(F)(F)F)c1	ZINC000450603644	DD	On-Demand	Anodyne	HSD11B1	0	45
NS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c(C(F)(F)F)c1	ZINC000450603644	DD	On-Demand	Anodyne	LIPG	47	34
NS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c(C(F)(F)F)c1	ZINC000450603644	DD	On-Demand	Anodyne	SFRP1	44	33
NS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c(C(F)(F)F)c1	ZINC000450603645	DD	On-Demand	Anodyne	HSD11B1	0	45
NS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c(C(F)(F)F)c1	ZINC000450603645	DD	On-Demand	Anodyne	LIPG	47	34
NS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c(C(F)(F)F)c1	ZINC000450603645	DD	On-Demand	Anodyne	SFRP1	44	33
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1ccnc(N2CCOCC2)n1	ZINC000450603650	EG	On-Demand	Anodyne	SORD	53	39
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1ccnc(N2CCOCC2)n1	ZINC000450603651	EG	On-Demand	Anodyne	SORD	53	39
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1ccnc(N2CCOCC2)n1	ZINC000450603652	EG	On-Demand	Anodyne	SORD	53	39
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1ccnc(N2CCOCC2)n1	ZINC000450603653	EG	On-Demand	Anodyne	SORD	53	39
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)ccc21	ZINC000450603663	EG	On-Demand	Anodyne	NAMPT	29	45
COCC1(C)CCN(C(=O)c2cccnc2-n2cc(Br)cn2)CC1	ZINC000450603664	GF	On-Demand	Anodyne	CCR5	24	42
Cn1nc(-c2ccccc2)cc1C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450603693	ED	On-Demand	Anodyne	LPXC	0	45
Cn1nc(-c2ccccc2)cc1C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450603693	ED	On-Demand	Anodyne	CTSV	49	33
COc1ccccc1C1(CNC(=O)CC2(O)CCC2)CCC1	ZINC000450603700	DF	On-Demand	Anodyne	KCNA3	42	41
COc1ccccc1C1(CNC(=O)CC2(O)CCC2)CCC1	ZINC000450603700	DF	On-Demand	Anodyne	ACAT	0	55
COc1cccc(-n2cc(C(=O)NCC3(c4ccccc4OC)CCC3)nn2)c1	ZINC000450603707	GG	On-Demand	Anodyne	DRD4	42	33
COc1cccc(-n2cc(C(=O)NCC3(c4ccccc4OC)CCC3)nn2)c1	ZINC000450603707	GG	On-Demand	Anodyne	KCNA3	42	36
COc1cccc(-n2cc(C(=O)NCC3(c4ccccc4OC)CCC3)nn2)c1	ZINC000450603707	GG	On-Demand	Anodyne	MTNR1A	20	42
COc1cccc(-n2cc(C(=O)NCC3(c4ccccc4OC)CCC3)nn2)c1	ZINC000450603707	GG	On-Demand	Anodyne	MTNR1B	18	42
COc1cccc(-n2cc(C(=O)NCC3(c4ccccc4OC)CCC3)nn2)c1	ZINC000450603707	GG	On-Demand	Anodyne	HCN1	53	36
COc1cccc(-n2cc(C(=O)NCC3(c4ccccc4OC)CCC3)nn2)c1	ZINC000450603707	GG	On-Demand	Anodyne	HCN4	48	35
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	DRD2	32	45
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	DRD1	18	48
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	HTR2A	30	52
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	ERG2	21	45
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	SLC18A3	15	44
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603712	DG	On-Demand	Anodyne	WNT3A	45	31
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	DRD2	32	45
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	DRD1	18	48
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	HTR2A	30	52
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	ERG2	21	45
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	SLC18A3	15	44
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603713	DG	On-Demand	Anodyne	WNT3A	45	31
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	DRD2	32	45
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	DRD1	18	48
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	HTR2A	30	52
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	ERG2	21	45
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	SLC18A3	15	44
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603714	DG	On-Demand	Anodyne	WNT3A	45	31
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	DRD2	32	45
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	DRD1	18	48
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	HTR2A	30	52
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	ERG2	21	45
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	SLC18A3	15	44
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450603715	DG	On-Demand	Anodyne	WNT3A	45	31
COC[C@@]1(C)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450603728	EI	On-Demand	Anodyne	ADRB2	18	48
COC[C@@]1(C)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450603728	EI	On-Demand	Anodyne	ADRB3	32	49
COC[C@]1(C)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450603729	EI	On-Demand	Anodyne	ADRB2	18	48
COC[C@]1(C)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450603729	EI	On-Demand	Anodyne	ADRB3	32	49
Cc1ccc(-c2nnc(SCc3oc(C(C)C)nc3C)o2)cc1C	ZINC000450603734	EK	On-Demand	Anodyne	GSK3A	49	39
Cc1ccc(-c2nnc(SCc3oc(C(C)C)nc3C)o2)cc1C	ZINC000450603734	EK	On-Demand	Anodyne	TERT	26	42
F[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450603735	BG	On-Demand	Anodyne	LUCI_LUCLA	19	46
F[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450603735	BG	On-Demand	Anodyne	MLYCD	53	37
F[C@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450603736	BG	On-Demand	Anodyne	LUCI_LUCLA	19	46
F[C@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450603736	BG	On-Demand	Anodyne	MLYCD	53	37
COC[C@@]1(C)CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450603737	DG	On-Demand	Anodyne	RBP4	18	45
COC[C@]1(C)CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450603738	DG	On-Demand	Anodyne	RBP4	18	45
Cc1nn(C)cc1CC(=O)N1CCc2c1cccc2C(F)(F)F	ZINC000450603744	DF	On-Demand	Anodyne	EIF2AK3	59	38
COc1cc(CC(=O)N2CCN(c3ncc(F)cn3)CC2)ccc1Cl	ZINC000450603759	FE	On-Demand	Anodyne	IGF1R	16	40
COc1cc(CC(=O)N2CCN(c3ncc(F)cn3)CC2)ccc1Cl	ZINC000450603759	FE	On-Demand	Anodyne	PLA2G7	31	43
COc1cc(CC(=O)N2CCN(c3ncc(F)cn3)CC2)ccc1Cl	ZINC000450603759	FE	On-Demand	Anodyne	CCR1	32	51
O=[N+]([O-])c1cccc2ncnc(N3CC[C@@H](F)C3)c12	ZINC000450603760	CE	On-Demand	Bother	PDE3B	45	32
O=[N+]([O-])c1cccc2ncnc(N3CC[C@H](F)C3)c12	ZINC000450603761	CE	On-Demand	Bother	PDE3B	45	32
Cc1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1C	ZINC000450603780	EJ	On-Demand	Anodyne	GSK3A	50	38
Cc1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1C	ZINC000450603780	EJ	On-Demand	Anodyne	TERT	25	43
COC(=O)[C@@H]1CCCN(C[C@H](O)[C@H](C)c2ccccc2)[C@H]1C(=O)OC	ZINC000450603787	ED	On-Demand	Anodyne	SLC6A3	24	43
COC(=O)[C@@H]1CCCN(C[C@H](O)[C@H](C)c2ccccc2)[C@H]1C(=O)OC	ZINC000450603787	ED	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450603788	ED	On-Demand	Anodyne	SLC6A3	24	43
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450603788	ED	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H]1CCCN(C[C@H](O)[C@@H](C)c2ccccc2)[C@H]1C(=O)OC	ZINC000450603789	ED	On-Demand	Anodyne	SLC6A3	24	43
COC(=O)[C@@H]1CCCN(C[C@H](O)[C@@H](C)c2ccccc2)[C@H]1C(=O)OC	ZINC000450603789	ED	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450603790	ED	On-Demand	Anodyne	SLC6A3	24	43
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450603790	ED	On-Demand	Anodyne	POL	0	41
COc1ccc(CNC(=O)CCNC2(CO)CCCC2)c(OC)c1	ZINC000450603803	ED	On-Demand	Anodyne	MTNR1A	57	37
COc1ccc(CNC(=O)CCNC2(CO)CCCC2)c(OC)c1	ZINC000450603803	ED	On-Demand	Anodyne	MTNR1B	44	39
Cc1ccn2ncc(C(=O)N3CCC(C)(CN4CCN(C)CC4)CC3)c2c1	ZINC000450603804	FE	On-Demand	Anodyne	EPHB3	27	42
COC(=O)c1csc(CN2CCC[C@H](Nc3ccccc3)C2)n1	ZINC000450603826	EG	On-Demand	Anodyne	SLC6A1	67	34
COC(=O)c1csc(CN2CCC[C@@H](Nc3ccccc3)C2)n1	ZINC000450603827	EG	On-Demand	Anodyne	SLC6A1	67	34
CC(C)OCCNC(=O)COc1cccc(Br)c1C#N	ZINC000450603868	EE	On-Demand	Mild	ADRB1	42	34
CC(C)OCCNC(=O)COc1cccc(Br)c1C#N	ZINC000450603868	EE	On-Demand	Mild	CYSP_TRYCR	15	41
COc1ccc(OC(F)(F)F)c(C(=O)NCCOC(C)C)c1	ZINC000450603883	DF	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(OC(F)(F)F)c(C(=O)NCCOC(C)C)c1	ZINC000450603883	DF	On-Demand	Anodyne	TRPV1	0	42
COc1ccc(OC(F)(F)F)c(C(=O)NCCOC(C)C)c1	ZINC000450603883	DF	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(OC(F)(F)F)c(C(=O)NCCOC(C)C)c1	ZINC000450603883	DF	On-Demand	Anodyne	KCNK3	26	41
COc1ccc(OC(F)(F)F)c(C(=O)NCCOC(C)C)c1	ZINC000450603883	DF	On-Demand	Anodyne	KCNK9	27	41
CCN(CC)S(=O)(=O)c1ccc(NCc2ccnc(OC)n2)c([N+](=O)[O-])c1	ZINC000450603896	GE	On-Demand	Bother	BDKRB1	0	43
Cc1nccc(N2CCN(C(=O)CC3CC(F)(F)C3)CC2)n1	ZINC000450603898	DD	On-Demand	Anodyne	SORD	41	33
COc1ccc(CC(=O)N2CCN(c3ccnc(C)n3)CC2)c(Cl)c1OC	ZINC000450603899	GE	On-Demand	Anodyne	CCR1	38	40
COc1ccc(CC(=O)N2CCN(c3ccnc(C)n3)CC2)c(Cl)c1OC	ZINC000450603899	GE	On-Demand	Anodyne	SORD	46	36
Cc1nccc(N2CCN(C(=O)C(C)(C)C(C)(F)F)CC2)n1	ZINC000450603901	DE	On-Demand	Anodyne	SORD	64	40
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603908	GF	On-Demand	Anodyne	THRA	0	44
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603908	GF	On-Demand	Anodyne	DRD1	19	45
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603908	GF	On-Demand	Anodyne	DRD4	15	45
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603908	GF	On-Demand	Anodyne	HTR2A	18	45
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603908	GF	On-Demand	Anodyne	HTR2C	16	46
COC(=O)[C@@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603908	GF	On-Demand	Anodyne	CYP2J2	63	44
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603909	GF	On-Demand	Anodyne	THRA	0	44
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603909	GF	On-Demand	Anodyne	DRD1	19	45
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603909	GF	On-Demand	Anodyne	DRD4	15	45
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603909	GF	On-Demand	Anodyne	HTR2A	18	45
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603909	GF	On-Demand	Anodyne	HTR2C	16	46
COC(=O)[C@H](O)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450603909	GF	On-Demand	Anodyne	CYP2J2	63	44
CCOC(=O)[C@H]1CN(CC[C@@H](C)O)Cc2ccccc21	ZINC000450603917	CD	On-Demand	Anodyne	CHRM5	17	40
CCOC(=O)[C@@H]1CN(CC[C@@H](C)O)Cc2ccccc21	ZINC000450603918	CD	On-Demand	Anodyne	CHRM5	17	40
CCOC(=O)[C@@H]1CN(CC[C@H](C)O)Cc2ccccc21	ZINC000450603919	CD	On-Demand	Anodyne	CHRM5	17	40
CCOC(=O)[C@H]1CN(CC[C@H](C)O)Cc2ccccc21	ZINC000450603920	CD	On-Demand	Anodyne	CHRM5	17	40
O=C1CCC(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1	ZINC000450603921	DG	On-Demand	Bother	COLA	90	35
O=C1CCC(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1	ZINC000450603921	DG	On-Demand	Bother	PQSD	0	40
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)c1Cl	ZINC000450603924	GE	On-Demand	Anodyne	SLC6A1	98	41
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)c1Cl	ZINC000450603924	GE	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@H]3C(=O)OC)c1Cl	ZINC000450603924	GE	On-Demand	Anodyne	SLC6A3	51	45
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)c1Cl	ZINC000450603925	GE	On-Demand	Anodyne	SLC6A1	98	41
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)c1Cl	ZINC000450603925	GE	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC)[C@@H]3C(=O)OC)c1Cl	ZINC000450603925	GE	On-Demand	Anodyne	SLC6A3	51	45
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)c1Cl	ZINC000450603926	GE	On-Demand	Anodyne	SLC6A1	98	41
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)c1Cl	ZINC000450603926	GE	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)c1cccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC)[C@@H]3C(=O)OC)c1Cl	ZINC000450603926	GE	On-Demand	Anodyne	SLC6A3	51	45
CCC[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450603935	EF	On-Demand	Anodyne	P2RY12	102	34
CCC[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450603936	EF	On-Demand	Anodyne	P2RY12	102	34
CC(C)(CS(C)(=O)=O)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450603958	DD	On-Demand	Anodyne	TRPV1	68	33
COC[C@@]1(C(=O)N2CCN(c3ccnc(C)n3)CC2)CCOC1	ZINC000450603959	DC	On-Demand	Anodyne	SORD	55	35
COC[C@]1(C(=O)N2CCN(c3ccnc(C)n3)CC2)CCOC1	ZINC000450603960	DC	On-Demand	Anodyne	SORD	55	35
CCN1C(=O)CCc2cc(NC(=O)c3ccc(C)c4c3CCC4)ccc21	ZINC000450603961	EI	On-Demand	Anodyne	AVPR2	41	38
CCSc1cccnc1C(=O)N1CCN(c2ccnc(C)n2)CC1	ZINC000450603962	EE	On-Demand	Anodyne	SORD	64	38
CC(=O)c1ccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603974	EI	On-Demand	Anodyne	SIGMAR1	22	73
CC(=O)c1ccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603974	EI	On-Demand	Anodyne	CCR3	41	42
CC(=O)c1ccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603974	EI	On-Demand	Anodyne	ACKR3	40	34
CC(=O)c1ccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603975	EI	On-Demand	Anodyne	SIGMAR1	22	73
CC(=O)c1ccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603975	EI	On-Demand	Anodyne	CCR3	41	42
CC(=O)c1ccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)cc1	ZINC000450603975	EI	On-Demand	Anodyne	ACKR3	40	34
CCS(=O)(=O)c1ccc(CSc2nc(C)c(Cc3ccccc3)[nH]2)cc1	ZINC000450603987	GI	On-Demand	Anodyne	CTSB	0	43
F[C@@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450603993	EF	On-Demand	Anodyne	PDE3A	44	33
F[C@@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450603993	EF	On-Demand	Anodyne	PDE3B	65	33
F[C@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450603994	EF	On-Demand	Anodyne	PDE3A	44	33
F[C@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450603994	EF	On-Demand	Anodyne	PDE3B	65	33
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H](F)C2)CC1	ZINC000450603998	DD	On-Demand	Anodyne	HRH1	0	48
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H](F)C2)CC1	ZINC000450603998	DD	On-Demand	Anodyne	HTR3A	26	57
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H](F)C2)CC1	ZINC000450603998	DD	On-Demand	Anodyne	HRH4	47	57
c1ccc(CCC[C@@H]2CCCN(C[C@H]3COCCO3)C2)cc1	ZINC000450604004	DG	On-Demand	Anodyne	CCR5	15	40
c1ccc(CCC[C@H]2CCCN(C[C@H]3COCCO3)C2)cc1	ZINC000450604005	DG	On-Demand	Anodyne	CCR5	15	40
c1ccc(CCC[C@H]2CCCN(C[C@@H]3COCCO3)C2)cc1	ZINC000450604006	DG	On-Demand	Anodyne	CCR5	15	40
c1ccc(CCC[C@@H]2CCCN(C[C@@H]3COCCO3)C2)cc1	ZINC000450604007	DG	On-Demand	Anodyne	CCR5	15	40
CN1CCN(c2nc3ccccc3nc2N2CC[C@H](F)C2)CC1	ZINC000450604012	DD	On-Demand	Anodyne	HRH1	0	48
CN1CCN(c2nc3ccccc3nc2N2CC[C@H](F)C2)CC1	ZINC000450604012	DD	On-Demand	Anodyne	HTR3A	26	57
CN1CCN(c2nc3ccccc3nc2N2CC[C@H](F)C2)CC1	ZINC000450604012	DD	On-Demand	Anodyne	HRH4	47	57
O=[N+]([O-])c1ccccc1CN(Cc1cnns1)C1CC1	ZINC000450604016	CF	On-Demand	Bother	COLA	88	33
CC1(O)CC(C(=O)N2CCc3c2cccc3C(F)(F)F)C1	ZINC000450604020	CF	On-Demand	Anodyne	SFRP1	55	31
COC[C@@]1(C)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450604026	GG	On-Demand	Anodyne	PDE3A	43	33
COC[C@@]1(C)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450604026	GG	On-Demand	Anodyne	PDE3B	64	33
COC[C@@]1(C)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450604026	GG	On-Demand	Anodyne	HTT	0	40
COC[C@]1(C)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450604027	GG	On-Demand	Anodyne	PDE3A	43	33
COC[C@]1(C)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450604027	GG	On-Demand	Anodyne	PDE3B	64	33
COC[C@]1(C)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450604027	GG	On-Demand	Anodyne	HTT	0	40
CS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c(C(F)(F)F)c1	ZINC000450604043	DF	On-Demand	Anodyne	HSD11B1	22	47
CS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c(C(F)(F)F)c1	ZINC000450604043	DF	On-Demand	Anodyne	CACNA1B	37	40
CS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c(C(F)(F)F)c1	ZINC000450604043	DF	On-Demand	Anodyne	LIPG	47	34
CS(=O)(=O)c1ccc(N2CC[C@@H](F)C2)c(C(F)(F)F)c1	ZINC000450604043	DF	On-Demand	Anodyne	SFRP1	41	33
CS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c(C(F)(F)F)c1	ZINC000450604044	DF	On-Demand	Anodyne	HSD11B1	22	47
CS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c(C(F)(F)F)c1	ZINC000450604044	DF	On-Demand	Anodyne	CACNA1B	37	40
CS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c(C(F)(F)F)c1	ZINC000450604044	DF	On-Demand	Anodyne	LIPG	47	34
CS(=O)(=O)c1ccc(N2CC[C@H](F)C2)c(C(F)(F)F)c1	ZINC000450604044	DF	On-Demand	Anodyne	SFRP1	41	33
O=C(CS(=O)(=O)C1CC1)Nc1ccc(COc2ccccc2)cc1	ZINC000450604066	EF	On-Demand	Anodyne	ELOVL6	0	41
COc1ccccc1NC(=O)CN1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450604081	FF	On-Demand	Anodyne	DRD4	20	41
COc1ccccc1NC(=O)CN1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450604081	FF	On-Demand	Anodyne	HTR4	15	41
COc1ccccc1NC(=O)CN1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450604082	FF	On-Demand	Anodyne	DRD4	20	41
COc1ccccc1NC(=O)CN1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450604082	FF	On-Demand	Anodyne	HTR4	15	41
COc1ccc2nc(N3CC[C@H](F)C3)c(C)nc2c1	ZINC000450604091	CE	On-Demand	Anodyne	PDE3A	44	40
COc1ccc2nc(N3CC[C@H](F)C3)c(C)nc2c1	ZINC000450604091	CE	On-Demand	Anodyne	PDE3B	65	40
COc1ccc2nc(N3CC[C@@H](F)C3)c(C)nc2c1	ZINC000450604092	CE	On-Demand	Anodyne	PDE3A	44	40
COc1ccc2nc(N3CC[C@@H](F)C3)c(C)nc2c1	ZINC000450604092	CE	On-Demand	Anodyne	PDE3B	65	40
COc1ccccc1NC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450604093	GG	On-Demand	Anodyne	HTR1A	58	51
COc1ccccc1NC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450604093	GG	On-Demand	Anodyne	DRD2	46	51
COc1ccccc1NC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450604093	GG	On-Demand	Anodyne	DRD4	46	43
COc1ccccc1NC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450604093	GG	On-Demand	Anodyne	ADRA1D	36	43
COc1ccccc1NC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450604093	GG	On-Demand	Anodyne	DRD3	58	47
COc1ccccc1NC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450604093	GG	On-Demand	Anodyne	HTR4	15	48
COc1ccccc1NC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450604093	GG	On-Demand	Anodyne	HTR7	44	39
COc1ccccc1NC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450604093	GG	On-Demand	Anodyne	SIGMAR1	15	53
COc1ccccc1NC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450604094	GG	On-Demand	Anodyne	HTR1A	58	51
COc1ccccc1NC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450604094	GG	On-Demand	Anodyne	DRD2	46	51
COc1ccccc1NC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450604094	GG	On-Demand	Anodyne	DRD4	46	43
COc1ccccc1NC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450604094	GG	On-Demand	Anodyne	ADRA1D	36	43
COc1ccccc1NC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450604094	GG	On-Demand	Anodyne	DRD3	58	47
COc1ccccc1NC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450604094	GG	On-Demand	Anodyne	HTR4	15	48
COc1ccccc1NC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450604094	GG	On-Demand	Anodyne	HTR7	44	39
COc1ccccc1NC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450604094	GG	On-Demand	Anodyne	SIGMAR1	15	53
COc1ccc2c(N3CC[C@@H](F)C3)c([N+](=O)[O-])cnc2c1	ZINC000450604097	CF	On-Demand	Bother	PDE3A	41	35
COc1ccc2c(N3CC[C@@H](F)C3)c([N+](=O)[O-])cnc2c1	ZINC000450604097	CF	On-Demand	Bother	PDE3B	57	35
COc1ccc2c(N3CC[C@H](F)C3)c([N+](=O)[O-])cnc2c1	ZINC000450604098	CF	On-Demand	Bother	PDE3A	41	35
COc1ccc2c(N3CC[C@H](F)C3)c([N+](=O)[O-])cnc2c1	ZINC000450604098	CF	On-Demand	Bother	PDE3B	57	35
F[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450604108	CH	On-Demand	Anodyne	LIPG	53	35
F[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450604111	CH	On-Demand	Anodyne	LIPG	53	35
CCC[C@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450604112	CF	On-Demand	Bother	COLA	23	40
CCC[C@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450604112	CF	On-Demand	Bother	PQSD	0	41
CCC[C@@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450604114	CF	On-Demand	Bother	COLA	23	40
CCC[C@@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450604114	CF	On-Demand	Bother	PQSD	0	41
O=c1c(Cl)c(N2CC[C@@H](F)C2)cnn1Cc1ccccc1	ZINC000450604115	DE	On-Demand	Anodyne	NPBWR1	24	40
O=c1c(Cl)c(N2CC[C@H](F)C2)cnn1Cc1ccccc1	ZINC000450604116	DE	On-Demand	Anodyne	NPBWR1	24	40
COC(=O)c1ccc(CN2CCC[C@H]2C(C)(C)O)cc1Cl	ZINC000450604123	DF	On-Demand	Anodyne	DRD2	45	37
COC(=O)c1ccc(CN2CCC[C@H]2C(C)(C)O)cc1Cl	ZINC000450604123	DF	On-Demand	Anodyne	CACNA1I	41	34
COC(=O)c1ccc(CN2CCC[C@@H]2C(C)(C)O)cc1Cl	ZINC000450604126	DF	On-Demand	Anodyne	DRD2	45	37
COC(=O)c1ccc(CN2CCC[C@@H]2C(C)(C)O)cc1Cl	ZINC000450604126	DF	On-Demand	Anodyne	CACNA1I	41	34
COc1ccccc1NC(=O)CN1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450604143	GE	On-Demand	Anodyne	DRD4	32	44
C[C@@H]1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1(C)C	ZINC000450604156	CG	On-Demand	Anodyne	HRH4	21	60
C[C@H]1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1(C)C	ZINC000450604157	CG	On-Demand	Anodyne	HRH4	21	60
O=C(Nc1nncs1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450604162	CD	On-Demand	Anodyne	HDAC1	29	44
O=C(Nc1nncs1)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450604162	CD	On-Demand	Anodyne	HPGDS	23	41
O=C(Nc1nncs1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450604163	CD	On-Demand	Anodyne	HDAC1	29	44
O=C(Nc1nncs1)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450604163	CD	On-Demand	Anodyne	HPGDS	23	41
Clc1ccc(CCN2CC[C@@H]([C@H]3CCOC3)C2)cc1	ZINC000450604171	CG	On-Demand	Anodyne	SIGMAR1	19	43
Clc1ccc(CCN2CC[C@H]([C@H]3CCOC3)C2)cc1	ZINC000450604172	CG	On-Demand	Anodyne	SIGMAR1	19	43
Clc1ccc(CCN2CC[C@@H]([C@@H]3CCOC3)C2)cc1	ZINC000450604173	CG	On-Demand	Anodyne	SIGMAR1	19	43
Clc1ccc(CCN2CC[C@H]([C@@H]3CCOC3)C2)cc1	ZINC000450604175	CG	On-Demand	Anodyne	SIGMAR1	19	43
COc1ccccc1C1(CNC(=O)[C@@H]2CCCN(C)C2=O)CCC1	ZINC000450604179	EE	On-Demand	Anodyne	HTR1A	31	40
COc1ccccc1C1(CNC(=O)[C@@H]2CCCN(C)C2=O)CCC1	ZINC000450604179	EE	On-Demand	Anodyne	HCN1	54	36
COc1ccccc1C1(CNC(=O)[C@@H]2CCCN(C)C2=O)CCC1	ZINC000450604179	EE	On-Demand	Anodyne	HCN4	52	36
COc1ccccc1C1(CNC(=O)[C@H]2CCCN(C)C2=O)CCC1	ZINC000450604181	EE	On-Demand	Anodyne	HTR1A	31	40
COc1ccccc1C1(CNC(=O)[C@H]2CCCN(C)C2=O)CCC1	ZINC000450604181	EE	On-Demand	Anodyne	HCN1	54	36
COc1ccccc1C1(CNC(=O)[C@H]2CCCN(C)C2=O)CCC1	ZINC000450604181	EE	On-Demand	Anodyne	HCN4	52	36
COc1ccccc1C1(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCC1	ZINC000450604186	EG	On-Demand	Anodyne	KCNA3	42	42
COc1ccccc1C1(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCC1	ZINC000450604186	EG	On-Demand	Anodyne	ACAT	0	51
COc1ccccc1C1(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCC1	ZINC000450604186	EG	On-Demand	Anodyne	HCN1	41	34
COc1ccccc1C1(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCC1	ZINC000450604186	EG	On-Demand	Anodyne	HCN4	40	34
COc1ccc(-c2noc(CN3CCC[C@H]3CC(=O)c3ccc(F)cc3)n2)nn1	ZINC000450604194	GF	On-Demand	Anodyne	ACKR3	40	34
COc1ccc(-c2noc(CN3CCC[C@@H]3CC(=O)c3ccc(F)cc3)n2)nn1	ZINC000450604195	GF	On-Demand	Anodyne	ACKR3	40	34
Cc1ccn(-c2ccccc2C(=O)NCC2(CN(C)C)CCCC2)n1	ZINC000450604201	EG	On-Demand	Anodyne	HCN1	58	36
Cc1ccn(-c2ccccc2C(=O)NCC2(CN(C)C)CCCC2)n1	ZINC000450604201	EG	On-Demand	Anodyne	HCN4	53	34
O=C(CCCN1CCOCC12CCC2)c1ccc(F)cc1	ZINC000450604206	CG	On-Demand	Anodyne	DRD2	32	47
O=C(CCCN1CCOCC12CCC2)c1ccc(F)cc1	ZINC000450604206	CG	On-Demand	Anodyne	ERG2	22	46
O=C(CCCN1CCOCC12CCC2)c1ccc(F)cc1	ZINC000450604206	CG	On-Demand	Anodyne	CYP2J2	45	32
C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1CO	ZINC000450604207	CD	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1CO	ZINC000450604209	CD	On-Demand	Anodyne	VACHT_TETCF	0	41
COC(=O)c1ccc(CN2CC[C@H]([C@H]3CCOC3)C2)cc1Cl	ZINC000450604211	DF	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CC[C@H]([C@H]3CCOC3)C2)cc1Cl	ZINC000450604211	DF	On-Demand	Anodyne	MCHR1	27	42
COC(=O)c1ccc(CN2CC[C@@H]([C@H]3CCOC3)C2)cc1Cl	ZINC000450604213	DF	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CC[C@@H]([C@H]3CCOC3)C2)cc1Cl	ZINC000450604213	DF	On-Demand	Anodyne	MCHR1	27	42
COC(=O)c1ccc(CN2CC[C@H]([C@@H]3CCOC3)C2)cc1Cl	ZINC000450604214	DF	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CC[C@H]([C@@H]3CCOC3)C2)cc1Cl	ZINC000450604214	DF	On-Demand	Anodyne	MCHR1	27	42
COC(=O)c1ccc(CN2CC[C@@H]([C@@H]3CCOC3)C2)cc1Cl	ZINC000450604216	DF	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CC[C@@H]([C@@H]3CCOC3)C2)cc1Cl	ZINC000450604216	DF	On-Demand	Anodyne	MCHR1	27	42
CS(=O)(=O)Nc1ccc(OCCNC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450604217	GD	On-Demand	Anodyne	HPGDS	15	41
COc1ccc(CNC(=O)CCN2CCC[C@@H](C)[C@@H]2CO)c(OC)c1	ZINC000450604231	FD	On-Demand	Anodyne	MTNR1A	51	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](C)[C@@H]2CO)c(OC)c1	ZINC000450604231	FD	On-Demand	Anodyne	MTNR1B	43	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](C)[C@@H]2CO)c(OC)c1	ZINC000450604231	FD	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(CNC(=O)CCN2CCC[C@@H](C)[C@H]2CO)c(OC)c1	ZINC000450604234	FD	On-Demand	Anodyne	MTNR1A	51	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](C)[C@H]2CO)c(OC)c1	ZINC000450604234	FD	On-Demand	Anodyne	MTNR1B	43	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](C)[C@H]2CO)c(OC)c1	ZINC000450604234	FD	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(CNC(=O)CCN2CCC[C@H](C)[C@H]2CO)c(OC)c1	ZINC000450604236	FD	On-Demand	Anodyne	MTNR1A	51	36
COc1ccc(CNC(=O)CCN2CCC[C@H](C)[C@H]2CO)c(OC)c1	ZINC000450604236	FD	On-Demand	Anodyne	MTNR1B	43	36
COc1ccc(CNC(=O)CCN2CCC[C@H](C)[C@H]2CO)c(OC)c1	ZINC000450604236	FD	On-Demand	Anodyne	ACKR3	42	32
COc1ccc(CNC(=O)CCN2CCC[C@H](C)[C@@H]2CO)c(OC)c1	ZINC000450604239	FD	On-Demand	Anodyne	MTNR1A	51	36
COc1ccc(CNC(=O)CCN2CCC[C@H](C)[C@@H]2CO)c(OC)c1	ZINC000450604239	FD	On-Demand	Anodyne	MTNR1B	43	36
COc1ccc(CNC(=O)CCN2CCC[C@H](C)[C@@H]2CO)c(OC)c1	ZINC000450604239	FD	On-Demand	Anodyne	ACKR3	42	32
CC(=O)c1cccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)c1	ZINC000450604240	EI	On-Demand	Anodyne	DRD2	17	48
CC(=O)c1cccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)c1	ZINC000450604240	EI	On-Demand	Anodyne	SIGMAR1	15	69
CC(=O)c1cccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)c1	ZINC000450604240	EI	On-Demand	Anodyne	CCR3	60	47
CC(=O)c1cccc(CN2CCC[C@H]2CC(=O)c2ccc(F)cc2)c1	ZINC000450604240	EI	On-Demand	Anodyne	ACKR3	53	34
CC(=O)c1cccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)c1	ZINC000450604242	EI	On-Demand	Anodyne	DRD2	17	48
CC(=O)c1cccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)c1	ZINC000450604242	EI	On-Demand	Anodyne	SIGMAR1	15	69
CC(=O)c1cccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)c1	ZINC000450604242	EI	On-Demand	Anodyne	CCR3	60	47
CC(=O)c1cccc(CN2CCC[C@@H]2CC(=O)c2ccc(F)cc2)c1	ZINC000450604242	EI	On-Demand	Anodyne	ACKR3	53	34
COC(=O)c1cccc(CN2CCC[C@H]([C@@H]3CCOC3)C2)c1Cl	ZINC000450604243	EG	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)c1cccc(CN2CCC[C@@H]([C@H]3CCOC3)C2)c1Cl	ZINC000450604244	EG	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)c1cccc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)c1Cl	ZINC000450604245	EG	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)c1cccc(CN2CCC[C@H]([C@H]3CCOC3)C2)c1Cl	ZINC000450604246	EG	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	ACHE	31	46
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	HRH1	23	41
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	CHRM3	25	44
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	SIGMAR1	40	41
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	SSTR5	55	37
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	TRY2_BOVIN	57	34
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	CCR3	44	40
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	MCHR1	44	43
COC(=O)[C@@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604247	DD	On-Demand	Anodyne	CCR8	26	41
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	ACHE	31	46
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	HRH1	23	41
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	CHRM3	25	44
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	SIGMAR1	40	41
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	SSTR5	55	37
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	TRY2_BOVIN	57	34
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	CCR3	44	40
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	MCHR1	44	43
COC(=O)[C@H](O)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450604248	DD	On-Demand	Anodyne	CCR8	26	41
F[C@H]1CCN(c2cc(C(F)(F)F)nc3ncnn23)C1	ZINC000450604249	CD	On-Demand	Anodyne	DHOD	0	43
F[C@@H]1CCN(c2cc(C(F)(F)F)nc3ncnn23)C1	ZINC000450604250	CD	On-Demand	Anodyne	DHOD	0	43
Cc1cc(N2CC[C@@H](F)C2)n2ncnc2n1	ZINC000450604267	BC	On-Demand	Anodyne	DHOD	0	45
Cc1cc(N2CC[C@H](F)C2)n2ncnc2n1	ZINC000450604270	BC	On-Demand	Anodyne	DHOD	0	45
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1=CCCCC1	ZINC000450604287	DD	On-Demand	Anodyne	SLC6A1	79	38
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1=CCCCC1	ZINC000450604287	DD	On-Demand	Anodyne	SLC6A3	41	38
c1ccc(Cn2c(CN3CCCCC3)nnc2SCC[C@@H]2CCOC2)cc1	ZINC000450604302	GH	On-Demand	Anodyne	ACHE	21	42
c1ccc(Cn2c(CN3CCCCC3)nnc2SCC[C@H]2CCOC2)cc1	ZINC000450604303	GH	On-Demand	Anodyne	ACHE	21	42
CCOC(=O)c1cc(N2CC[C@@H](F)C2)ncc1Cl	ZINC000450604312	CE	On-Demand	Anodyne	Q9FYV8_MAIZE	32	40
CCOC(=O)c1cc(N2CC[C@H](F)C2)ncc1Cl	ZINC000450604313	CE	On-Demand	Anodyne	Q9FYV8_MAIZE	32	40
CC1CC(C(=O)N2CCN(c3ncc(F)cn3)CC2)(c2cccc(Cl)c2)C1	ZINC000450604316	GG	On-Demand	Anodyne	SLC6A7	0	40
COc1ccccc1C1(CNC(=O)C2(CF)CCOCC2)CCC1	ZINC000450604321	EF	On-Demand	Anodyne	ACAT	0	52
Cc1nnc2c3ccccc3c(N3CC[C@H](F)C3)nn12	ZINC000450604338	CE	On-Demand	Anodyne	CREBBP	46	37
Cc1nnc2c3ccccc3c(N3CC[C@H](F)C3)nn12	ZINC000450604338	CE	On-Demand	Anodyne	BRD9	59	37
Cc1nnc2c3ccccc3c(N3CC[C@@H](F)C3)nn12	ZINC000450604339	CE	On-Demand	Anodyne	CREBBP	46	37
Cc1nnc2c3ccccc3c(N3CC[C@@H](F)C3)nn12	ZINC000450604339	CE	On-Demand	Anodyne	BRD9	59	37
COc1ccccc1C1(CNC(=O)C2CC(C)(O)C2)CCC1	ZINC000450604340	DE	On-Demand	Anodyne	KCNA3	43	42
COc1ccccc1C1(CNC(=O)C2CC(C)(O)C2)CCC1	ZINC000450604340	DE	On-Demand	Anodyne	ACAT	0	53
COc1ccccc1C1(CNC(=O)C2CC(C)(O)C2)CCC1	ZINC000450604340	DE	On-Demand	Anodyne	HCN1	41	34
COc1ccccc1C1(CNC(=O)C2CC(C)(O)C2)CCC1	ZINC000450604340	DE	On-Demand	Anodyne	HCN4	41	34
COC[C@@]1(C)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450604346	ED	On-Demand	Anodyne	ADRA1D	15	46
COC[C@@]1(C)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450604346	ED	On-Demand	Anodyne	ADRA1B	43	53
COC[C@@]1(C)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450604346	ED	On-Demand	Anodyne	EHMT2	51	35
COC[C@]1(C)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450604347	ED	On-Demand	Anodyne	ADRA1D	15	46
COC[C@]1(C)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450604347	ED	On-Demand	Anodyne	ADRA1B	43	53
COC[C@]1(C)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450604347	ED	On-Demand	Anodyne	EHMT2	51	35
COCCC(C)(C)CNC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450604361	EI	On-Demand	Anodyne	KCNJ11	52	37
COc1ccccc1C1(CNC(=O)[C@@H]2OCC[C@@H]2C)CCC1	ZINC000450604369	DF	On-Demand	Anodyne	KCNA3	42	41
COc1ccccc1C1(CNC(=O)[C@@H]2OCC[C@@H]2C)CCC1	ZINC000450604369	DF	On-Demand	Anodyne	ACAT	0	50
CCOC(=O)c1ccc(CN2CCC[C@@H](C(=O)OC)[C@H]2C(=O)OC)nc1	ZINC000450604370	FD	On-Demand	Anodyne	PTR1	47	35
CCOC(=O)c1ccc(CN2CCC[C@H](C(=O)OC)[C@H]2C(=O)OC)nc1	ZINC000450604371	FD	On-Demand	Anodyne	PTR1	47	35
CCOC(=O)c1ccc(CN2CCC[C@@H](C(=O)OC)[C@@H]2C(=O)OC)nc1	ZINC000450604372	FD	On-Demand	Anodyne	PTR1	47	35
CCOC(=O)c1ccc(CN2CCC[C@H](C(=O)OC)[C@@H]2C(=O)OC)nc1	ZINC000450604373	FD	On-Demand	Anodyne	PTR1	47	35
COc1ccccc1C1(CNC(=O)[C@]2(OC(C)C)CCOC2)CCC1	ZINC000450604388	EF	On-Demand	Anodyne	ACAT	0	55
COc1ccccc1C1(CNC(=O)[C@@]2(OC(C)C)CCOC2)CCC1	ZINC000450604389	EF	On-Demand	Anodyne	ACAT	0	55
Cc1cnc2c(C)cccc2c1N1CC[C@@H](F)C1	ZINC000450604392	BG	On-Demand	Anodyne	ATP4A	25	45
Cc1cnc2c(C)cccc2c1N1CC[C@H](F)C1	ZINC000450604393	BG	On-Demand	Anodyne	ATP4A	25	45
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](F)C3)nc2)cc1	ZINC000450604394	CG	On-Demand	Anodyne	PRNP	62	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](F)C3)nc2)cc1	ZINC000450604394	CG	On-Demand	Anodyne	P4HTM	0	54
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](F)C3)nc2)cc1	ZINC000450604394	CG	On-Demand	Anodyne	MCHR1	26	56
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](F)C3)nc2)cc1	ZINC000450604394	CG	On-Demand	Anodyne	DGAT1	54	41
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](F)C3)nc2)cc1	ZINC000450604394	CG	On-Demand	Anodyne	HPGDS	27	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](F)C3)nc2)cc1	ZINC000450604395	CG	On-Demand	Anodyne	PRNP	62	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](F)C3)nc2)cc1	ZINC000450604395	CG	On-Demand	Anodyne	P4HTM	0	54
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](F)C3)nc2)cc1	ZINC000450604395	CG	On-Demand	Anodyne	MCHR1	26	56
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](F)C3)nc2)cc1	ZINC000450604395	CG	On-Demand	Anodyne	DGAT1	54	41
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](F)C3)nc2)cc1	ZINC000450604395	CG	On-Demand	Anodyne	HPGDS	27	40
Cc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3nccs3)o2)cc1C	ZINC000450604396	FH	On-Demand	Anodyne	MAP1	65	34
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1=CCCCC1	ZINC000450604397	DD	On-Demand	Anodyne	SLC6A1	79	38
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1=CCCCC1	ZINC000450604397	DD	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1=CCCCC1	ZINC000450604398	DD	On-Demand	Anodyne	SLC6A1	79	38
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1=CCCCC1	ZINC000450604398	DD	On-Demand	Anodyne	SLC6A3	41	38
Cc1nccc(N2CCN(C(=O)C3CC(O)(CCC(C)(C)C)C3)CC2)n1	ZINC000450604408	FE	On-Demand	Anodyne	SORD	57	37
Cc1nccc(N2CCN(C(=O)C(C)(C)c3cccc4ccccc34)CC2)n1	ZINC000450604409	FH	On-Demand	Anodyne	SORD	60	41
CN(C)[C@@H]1CC[C@H]2[C@@H](C1)OCCN2CCc1ccc(Cl)cc1	ZINC000450604418	DG	On-Demand	Anodyne	HRH3	19	43
CN(C)[C@@H]1CC[C@@H]2[C@H](C1)OCCN2CCc1ccc(Cl)cc1	ZINC000450604419	DG	On-Demand	Anodyne	HRH3	19	43
CN(C)[C@@H]1CC[C@@H]2[C@@H](C1)OCCN2CCc1ccc(Cl)cc1	ZINC000450604420	DG	On-Demand	Anodyne	HRH3	19	43
CN(C)[C@@H]1CC[C@H]2[C@H](C1)OCCN2CCc1ccc(Cl)cc1	ZINC000450604421	DG	On-Demand	Anodyne	HRH3	19	43
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450604428	EE	On-Demand	Anodyne	TRPV1	48	33
CC(C)(C)C(=O)CCCC(=O)Nc1ccc(F)cc1NS(C)(=O)=O	ZINC000450604431	FF	On-Demand	Anodyne	TRPV1	36	41
CCCN1C(=O)CCc2cc(NC(=O)[C@]3(C)CCC[C@H]3C)ccc21	ZINC000450604432	EI	On-Demand	Anodyne	NAMPT	26	44
CCCN1C(=O)CCc2cc(NC(=O)[C@]3(C)CCC[C@@H]3C)ccc21	ZINC000450604433	EI	On-Demand	Anodyne	NAMPT	26	44
CCCN1C(=O)CCc2cc(NC(=O)[C@@]3(C)CCC[C@H]3C)ccc21	ZINC000450604434	EI	On-Demand	Anodyne	NAMPT	26	44
CCCN1C(=O)CCc2cc(NC(=O)[C@@]3(C)CCC[C@@H]3C)ccc21	ZINC000450604435	EI	On-Demand	Anodyne	NAMPT	26	44
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2C(C)(C)O)cc1	ZINC000450604446	DE	On-Demand	Anodyne	HRH3	15	50
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2C(C)(C)O)cc1	ZINC000450604447	DE	On-Demand	Anodyne	HRH3	15	50
COc1ccc(-c2csc3ncnc(N4CC[C@@H](F)C4)c23)cc1	ZINC000450604450	EH	On-Demand	Anodyne	ADRB2	15	56
COc1ccc(-c2csc3ncnc(N4CC[C@@H](F)C4)c23)cc1	ZINC000450604450	EH	On-Demand	Anodyne	PDE3A	47	38
COc1ccc(-c2csc3ncnc(N4CC[C@@H](F)C4)c23)cc1	ZINC000450604450	EH	On-Demand	Anodyne	ADRB3	18	56
COc1ccc(-c2csc3ncnc(N4CC[C@@H](F)C4)c23)cc1	ZINC000450604450	EH	On-Demand	Anodyne	PDE3B	44	38
COc1ccc(-c2csc3ncnc(N4CC[C@H](F)C4)c23)cc1	ZINC000450604451	EH	On-Demand	Anodyne	ADRB2	15	56
COc1ccc(-c2csc3ncnc(N4CC[C@H](F)C4)c23)cc1	ZINC000450604451	EH	On-Demand	Anodyne	PDE3A	47	38
COc1ccc(-c2csc3ncnc(N4CC[C@H](F)C4)c23)cc1	ZINC000450604451	EH	On-Demand	Anodyne	ADRB3	18	56
COc1ccc(-c2csc3ncnc(N4CC[C@H](F)C4)c23)cc1	ZINC000450604451	EH	On-Demand	Anodyne	PDE3B	44	38
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)c1cccc2c1CCCC2	ZINC000450604456	FG	On-Demand	Anodyne	PLA2G7	42	44
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)c1cccc2c1CCCC2	ZINC000450604456	FG	On-Demand	Anodyne	PPARD	0	43
C[C@@H](O)CCN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450604465	CE	On-Demand	Bother	COLA	24	42
C[C@H](O)CCN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000450604466	CE	On-Demand	Bother	COLA	24	42
C/C=C\COc1cccc(CC(=O)N2CCN(c3ccnc(C)n3)CC2)c1	ZINC000450604469	FF	On-Demand	Anodyne	GPR183	0	42
C/C=C/COc1cccc(CC(=O)N2CCN(c3ccnc(C)n3)CC2)c1	ZINC000450604470	FF	On-Demand	Anodyne	GPR183	0	42
COC(=O)c1ccc(CC(=O)NC(C)(C)CS(C)(=O)=O)cc1	ZINC000450604471	EC	On-Demand	Anodyne	PTPRB	30	42
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450604487	DD	On-Demand	Anodyne	TRPV1	50	35
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450604488	DD	On-Demand	Anodyne	TRPV1	50	35
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604490	DD	On-Demand	Anodyne	SLC6A1	74	47
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604490	DD	On-Demand	Anodyne	SLC6A4	20	47
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604490	DD	On-Demand	Anodyne	SLC6A3	39	47
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604491	DD	On-Demand	Anodyne	SLC6A1	74	47
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604491	DD	On-Demand	Anodyne	SLC6A4	20	47
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604491	DD	On-Demand	Anodyne	SLC6A3	39	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604492	DD	On-Demand	Anodyne	SLC6A1	74	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604492	DD	On-Demand	Anodyne	SLC6A4	20	47
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CCC(=O)CC1	ZINC000450604492	DD	On-Demand	Anodyne	SLC6A3	39	47
Cc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3nccs3)o2)cc1C	ZINC000450604497	FH	On-Demand	Anodyne	MAP1	65	34
C[C@H]1Cc2cccc(C(=O)NCC3(CN(C)C)CCCC3)c2O1	ZINC000450604519	DF	On-Demand	Anodyne	HCN1	55	34
C[C@H]1Cc2cccc(C(=O)NCC3(CN(C)C)CCCC3)c2O1	ZINC000450604519	DF	On-Demand	Anodyne	HCN4	53	34
C[C@@H]1Cc2cccc(C(=O)NCC3(CN(C)C)CCCC3)c2O1	ZINC000450604520	DF	On-Demand	Anodyne	HCN1	55	34
C[C@@H]1Cc2cccc(C(=O)NCC3(CN(C)C)CCCC3)c2O1	ZINC000450604520	DF	On-Demand	Anodyne	HCN4	53	34
COCCC(C)(C)CNC(=O)c1ccc2cnccc2c1	ZINC000450604521	CG	On-Demand	Anodyne	DRD4	40	30
C[C@@H](Oc1ccccn1)C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604544	ED	On-Demand	Anodyne	SLC6A7	0	42
C[C@H](Oc1ccccn1)C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604545	ED	On-Demand	Anodyne	SLC6A7	0	42
CCNC(=O)c1ccc(N2CC[C@](C)(COC)C2)nn1	ZINC000450604546	CD	On-Demand	Anodyne	SCD1	42	39
CCNC(=O)c1ccc(N2CC[C@@](C)(COC)C2)nn1	ZINC000450604547	CD	On-Demand	Anodyne	SCD1	42	39
CCOC(=O)c1cc(C(=O)NCC2(c3ccccc3OC)CCC2)on1	ZINC000450604550	FF	On-Demand	Anodyne	HCN1	57	36
CCC[C@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604553	DG	On-Demand	Anodyne	KCNA3	39	40
CCC[C@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604553	DG	On-Demand	Anodyne	MTNR1A	18	40
CCC[C@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604553	DG	On-Demand	Anodyne	SOAT1	15	42
CCC[C@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604553	DG	On-Demand	Anodyne	ACAT	0	55
CCC[C@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604553	DG	On-Demand	Anodyne	HCN1	41	35
CCC[C@@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604554	DG	On-Demand	Anodyne	KCNA3	39	40
CCC[C@@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604554	DG	On-Demand	Anodyne	MTNR1A	18	40
CCC[C@@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604554	DG	On-Demand	Anodyne	SOAT1	15	42
CCC[C@@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604554	DG	On-Demand	Anodyne	ACAT	0	55
CCC[C@@H](OC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450604554	DG	On-Demand	Anodyne	HCN1	41	35
COC[C@@]1(C)CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450604556	FI	On-Demand	Anodyne	ADRB3	28	42
COC[C@]1(C)CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450604557	FI	On-Demand	Anodyne	ADRB3	28	42
COc1ccccc1C1(CNC(=O)CCc2ccc(C(N)=O)cc2)CCC1	ZINC000450604566	FF	On-Demand	Anodyne	ACAT	0	49
Cc1ccn(CC(=O)N2CCC(Oc3cccc(Br)c3)CC2)n1	ZINC000450604581	GG	On-Demand	Anodyne	PRSS2	44	32
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnn[nH]1	ZINC000450604582	CB	On-Demand	Anodyne	SLC6A1	108	38
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnn[nH]1	ZINC000450604582	CB	On-Demand	Anodyne	SLC6A3	47	39
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnn[nH]1	ZINC000450604583	CB	On-Demand	Anodyne	SLC6A1	108	38
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnn[nH]1	ZINC000450604583	CB	On-Demand	Anodyne	SLC6A3	47	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnn[nH]1	ZINC000450604584	CB	On-Demand	Anodyne	SLC6A1	108	38
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1cnn[nH]1	ZINC000450604584	CB	On-Demand	Anodyne	SLC6A3	47	39
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CC(F)(F)C1	ZINC000450604597	DD	On-Demand	Anodyne	SLC6A1	48	42
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CC(F)(F)C1	ZINC000450604597	DD	On-Demand	Anodyne	SLC6A3	29	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CC(F)(F)C1	ZINC000450604598	DD	On-Demand	Anodyne	SLC6A1	48	42
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CC(F)(F)C1	ZINC000450604598	DD	On-Demand	Anodyne	SLC6A3	29	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CC(F)(F)C1	ZINC000450604599	DD	On-Demand	Anodyne	SLC6A1	48	42
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CC1CC(F)(F)C1	ZINC000450604599	DD	On-Demand	Anodyne	SLC6A3	29	42
CCN1C(=O)CCc2cc(NC(=O)CC3CC(F)(F)C3)ccc21	ZINC000450604600	DG	On-Demand	Anodyne	NAMPT	15	44
COC[C@@]1(C)CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450604615	FH	On-Demand	Bother	TAAR1	16	41
COC[C@]1(C)CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450604616	FH	On-Demand	Bother	TAAR1	16	41
Cc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1C	ZINC000450604617	CI	On-Demand	Anodyne	TERT	0	42
COCC1(C)CCN(C(=O)CCOc2cccc(OC)c2)CC1	ZINC000450604639	DF	On-Demand	Anodyne	DRD4	40	30
COCC1(C)CCN(C(=O)CCOc2cccc(OC)c2)CC1	ZINC000450604639	DF	On-Demand	Anodyne	MTNR1A	27	44
Cn1ccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450604672	EG	On-Demand	Anodyne	DRD2	18	42
Cn1ccnc1N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450604672	EG	On-Demand	Anodyne	DRD3	15	41
CC(=O)N[C@H](C(=O)N1CCN(c2ccnc(C)n2)CC1)C(C)(C)C	ZINC000450604678	EC	On-Demand	Anodyne	SORD	77	40
N#CC1(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1	ZINC000450604679	CG	On-Demand	Mild	COLA	87	34
CS(=O)(=O)Nc1ccc(OCCNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450604693	EC	On-Demand	Anodyne	ADRB2	24	41
CS(=O)(=O)Nc1ccc(OCCNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450604693	EC	On-Demand	Anodyne	ADRB1	24	41
CS(=O)(=O)Nc1ccc(OCCNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450604693	EC	On-Demand	Anodyne	GRIN1	37	42
CS(=O)(=O)Nc1ccc(OCCNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450604694	EC	On-Demand	Anodyne	ADRB2	24	41
CS(=O)(=O)Nc1ccc(OCCNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450604694	EC	On-Demand	Anodyne	ADRB1	24	41
CS(=O)(=O)Nc1ccc(OCCNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450604694	EC	On-Demand	Anodyne	GRIN1	37	42
CC[C@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604695	EH	On-Demand	Anodyne	CCR1	47	43
CC[C@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604695	EH	On-Demand	Anodyne	LIPE	19	53
CC[C@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604695	EH	On-Demand	Anodyne	CCR2	39	41
CC[C@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604695	EH	On-Demand	Anodyne	EPHX2	25	50
CC[C@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604695	EH	On-Demand	Anodyne	MCHR1	25	42
CC[C@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604695	EH	On-Demand	Anodyne	LIPG	44	36
CC[C@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604695	EH	On-Demand	Anodyne	ETHR	63	33
CC[C@@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604696	EH	On-Demand	Anodyne	CCR1	47	43
CC[C@@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604696	EH	On-Demand	Anodyne	LIPE	19	53
CC[C@@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604696	EH	On-Demand	Anodyne	CCR2	39	41
CC[C@@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604696	EH	On-Demand	Anodyne	EPHX2	25	50
CC[C@@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604696	EH	On-Demand	Anodyne	MCHR1	25	42
CC[C@@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604696	EH	On-Demand	Anodyne	LIPG	44	36
CC[C@@H](O)CC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450604696	EH	On-Demand	Anodyne	ETHR	63	33
CCC(=O)CCCN1CCC[C@H]1C(C)(C)CC	ZINC000450604712	BH	On-Demand	Anodyne	GBA2	40	30
CCC(=O)CCCN1CCC[C@@H]1C(C)(C)CC	ZINC000450604713	BH	On-Demand	Anodyne	GBA2	40	30
COC[C@@]1(C)CCN(c2ccnc(C(C)C)n2)C1	ZINC000450604725	BE	On-Demand	Anodyne	SORD	100	41
COC[C@]1(C)CCN(c2ccnc(C(C)C)n2)C1	ZINC000450604726	BE	On-Demand	Anodyne	SORD	100	41
CCCc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)no1	ZINC000450604731	EG	On-Demand	Anodyne	KCNA3	39	40
CCCc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)no1	ZINC000450604731	EG	On-Demand	Anodyne	HCN1	54	36
CCCc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)no1	ZINC000450604731	EG	On-Demand	Anodyne	HCN4	51	36
CCN1CC[C@H](NC(=O)[C@@H](O)C2CCC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450604757	FF	On-Demand	Anodyne	ENV	44	34
CCN1CC[C@H](NC(=O)[C@H](O)C2CCC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450604758	FF	On-Demand	Anodyne	ENV	44	34
CCN1CC[C@H](NC(=O)[C@@H](O)C2CCC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450604759	FF	On-Demand	Anodyne	ENV	44	34
CCN1CC[C@H](NC(=O)[C@H](O)C2CCC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450604760	FF	On-Demand	Anodyne	ENV	44	34
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCOCC2(CCC2)C1	ZINC000450604761	GH	On-Demand	Anodyne	HRH4	18	44
COC(=O)c1ccc(CC(=O)NCC2(c3ccccc3OC)CCC2)cc1	ZINC000450604769	FG	On-Demand	Anodyne	KCNA3	43	48
COC(=O)c1ccc(CC(=O)NCC2(c3ccccc3OC)CCC2)cc1	ZINC000450604769	FG	On-Demand	Anodyne	MTNR1A	19	42
COC(=O)c1ccc(CC(=O)NCC2(c3ccccc3OC)CCC2)cc1	ZINC000450604769	FG	On-Demand	Anodyne	ACAT	0	52
COC(=O)c1ccc(CC(=O)NCC2(c3ccccc3OC)CCC2)cc1	ZINC000450604769	FG	On-Demand	Anodyne	MBTPS1	40	33
COCCC(C)(C)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450604770	GH	On-Demand	Anodyne	HTR1A	16	41
COCCC(C)(C)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450604770	GH	On-Demand	Anodyne	DRD2	20	40
COCCC(C)(C)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450604770	GH	On-Demand	Anodyne	DRD3	33	43
COCCC(C)(C)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450604770	GH	On-Demand	Anodyne	CYSLTR1	51	37
COCCC(C)(C)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450604770	GH	On-Demand	Anodyne	PDGFRB	16	45
COCCC(C)(C)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450604770	GH	On-Demand	Anodyne	CPT1A	49	34
COCCC(C)(C)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450604770	GH	On-Demand	Anodyne	PLK1	43	35
COCCC(C)(C)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450604770	GH	On-Demand	Anodyne	HPGD	44	56
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604771	FG	On-Demand	Anodyne	NPBWR1	56	30
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604771	FG	On-Demand	Anodyne	SLC6A7	0	44
CC(=O)N[C@H](C(=O)NCC1(CN(C)C)CCCC1)C(C)(C)C	ZINC000450604772	DD	On-Demand	Anodyne	PDF	55	34
COc1cccc(N2CC[C@@H](F)C2)c1[N+](=O)[O-]	ZINC000450604779	BE	On-Demand	Bother	ADRA1D	23	40
COc1cccc(N2CC[C@@H](F)C2)c1[N+](=O)[O-]	ZINC000450604779	BE	On-Demand	Bother	ADRA1A	20	40
COc1cccc(N2CC[C@@H](F)C2)c1[N+](=O)[O-]	ZINC000450604779	BE	On-Demand	Bother	ADRA1B	26	40
COc1cccc(N2CC[C@H](F)C2)c1[N+](=O)[O-]	ZINC000450604780	BE	On-Demand	Bother	ADRA1D	23	40
COc1cccc(N2CC[C@H](F)C2)c1[N+](=O)[O-]	ZINC000450604780	BE	On-Demand	Bother	ADRA1A	20	40
COc1cccc(N2CC[C@H](F)C2)c1[N+](=O)[O-]	ZINC000450604780	BE	On-Demand	Bother	ADRA1B	26	40
CO[C@H](Cc1ccccc1)CN1CC[C@@H]([C@H]2CCOC2)C1	ZINC000450604787	CF	On-Demand	Anodyne	ABCB1	0	41
CO[C@H](Cc1ccccc1)CN1CC[C@@H]([C@@H]2CCOC2)C1	ZINC000450604788	CF	On-Demand	Anodyne	ABCB1	0	41
CO[C@H](Cc1ccccc1)CN1CC[C@H]([C@H]2CCOC2)C1	ZINC000450604789	CF	On-Demand	Anodyne	ABCB1	0	41
CO[C@H](Cc1ccccc1)CN1CC[C@H]([C@@H]2CCOC2)C1	ZINC000450604790	CF	On-Demand	Anodyne	ABCB1	0	41
COC(=O)[C@@H](NCCCNc1nc2ccccc2cc1[N+](=O)[O-])C(C)C	ZINC000450604818	FE	On-Demand	Bother	COLA	42	32
COC(=O)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450604821	FD	On-Demand	Anodyne	ACHE	41	37
COC(=O)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450604821	FD	On-Demand	Anodyne	SLC6A3	20	42
COC(=O)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450604821	FD	On-Demand	Anodyne	SIGMAR1	45	41
COC(=O)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450604821	FD	On-Demand	Anodyne	MCHR1	19	40
COC(=O)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450604822	FD	On-Demand	Anodyne	ACHE	41	37
COC(=O)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450604822	FD	On-Demand	Anodyne	SLC6A3	20	42
COC(=O)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450604822	FD	On-Demand	Anodyne	SIGMAR1	45	41
COC(=O)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450604822	FD	On-Demand	Anodyne	MCHR1	19	40
CCN1C(=O)CCc2cc(NC(=O)[C@H]3CCC[C@H]3c3ccccc3)ccc21	ZINC000450604825	FJ	On-Demand	Anodyne	NOS1	15	43
CCN1C(=O)CCc2cc(NC(=O)[C@H]3CCC[C@@H]3c3ccccc3)ccc21	ZINC000450604826	FJ	On-Demand	Anodyne	NOS1	15	43
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3CCC[C@H]3c3ccccc3)ccc21	ZINC000450604827	FJ	On-Demand	Anodyne	NOS1	15	43
CCN1C(=O)CCc2cc(NC(=O)[C@@H]3CCC[C@@H]3c3ccccc3)ccc21	ZINC000450604828	FJ	On-Demand	Anodyne	NOS1	15	43
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CS(C)(=O)=O)nc2)c1	ZINC000450604836	GE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CS(C)(=O)=O)nc2)c1	ZINC000450604836	GE	On-Demand	Anodyne	RAF1	28	41
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CS(C)(=O)=O)nc2)c1	ZINC000450604836	GE	On-Demand	Anodyne	MTNR1A	29	42
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CS(C)(=O)=O)nc2)c1	ZINC000450604836	GE	On-Demand	Anodyne	MTNR1B	29	42
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CS(C)(=O)=O)nc2)c1	ZINC000450604836	GE	On-Demand	Anodyne	GCK	19	42
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CS(C)(=O)=O)nc2)c1	ZINC000450604836	GE	On-Demand	Anodyne	Q8MMZ8_EIMTE	38	41
CC(=O)c1ccc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1	ZINC000450604837	DH	On-Demand	Bother	COLA	127	49
O=C(CC1CC(F)(F)C1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450604838	GI	On-Demand	Anodyne	PRSS2	44	30
COc1cc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)ccc1Cl	ZINC000450604839	EH	On-Demand	Anodyne	DRD4	22	40
COc1cc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)ccc1Cl	ZINC000450604839	EH	On-Demand	Anodyne	SSTR5	43	36
COc1cc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)ccc1Cl	ZINC000450604840	EH	On-Demand	Anodyne	DRD4	22	40
COc1cc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)ccc1Cl	ZINC000450604840	EH	On-Demand	Anodyne	SSTR5	43	36
COc1cc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)ccc1Cl	ZINC000450604841	EH	On-Demand	Anodyne	DRD4	22	40
COc1cc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)ccc1Cl	ZINC000450604841	EH	On-Demand	Anodyne	SSTR5	43	36
COc1cc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)ccc1Cl	ZINC000450604842	EH	On-Demand	Anodyne	DRD4	22	40
COc1cc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)ccc1Cl	ZINC000450604842	EH	On-Demand	Anodyne	SSTR5	43	36
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450604849	EI	On-Demand	Anodyne	NOS1	15	42
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450604849	EI	On-Demand	Anodyne	NAMPT	30	45
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450604850	EI	On-Demand	Anodyne	NOS1	15	42
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450604850	EI	On-Demand	Anodyne	NAMPT	30	45
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450604851	EI	On-Demand	Anodyne	NOS1	15	42
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450604851	EI	On-Demand	Anodyne	NAMPT	30	45
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450604852	EI	On-Demand	Anodyne	NOS1	15	42
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450604852	EI	On-Demand	Anodyne	NAMPT	30	45
COC(=O)[C@@H](O)C1CCN(Cc2cc(Br)ccc2C)CC1	ZINC000450604853	FF	On-Demand	Anodyne	CCR5	17	43
COC(=O)[C@H](O)C1CCN(Cc2cc(Br)ccc2C)CC1	ZINC000450604854	FF	On-Demand	Anodyne	CCR5	17	43
COC(=O)[C@@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604856	DD	On-Demand	Anodyne	ACHE	26	48
COC(=O)[C@@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604856	DD	On-Demand	Anodyne	SIGMAR1	42	44
COC(=O)[C@@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604856	DD	On-Demand	Anodyne	SSTR5	50	39
COC(=O)[C@@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604856	DD	On-Demand	Anodyne	MCHR1	41	41
COC(=O)[C@@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604856	DD	On-Demand	Anodyne	CACNA1I	32	41
COC(=O)[C@@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604856	DD	On-Demand	Anodyne	NOD2	43	38
COC(=O)[C@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604857	DD	On-Demand	Anodyne	ACHE	26	48
COC(=O)[C@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604857	DD	On-Demand	Anodyne	SIGMAR1	42	44
COC(=O)[C@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604857	DD	On-Demand	Anodyne	SSTR5	50	39
COC(=O)[C@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604857	DD	On-Demand	Anodyne	MCHR1	41	41
COC(=O)[C@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604857	DD	On-Demand	Anodyne	CACNA1I	32	41
COC(=O)[C@H](O)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450604857	DD	On-Demand	Anodyne	NOD2	43	38
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604864	ED	On-Demand	Anodyne	SLC6A1	116	48
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604864	ED	On-Demand	Anodyne	SLC6A4	35	48
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604864	ED	On-Demand	Anodyne	SLC6A3	63	52
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604865	ED	On-Demand	Anodyne	SLC6A1	116	48
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604865	ED	On-Demand	Anodyne	SLC6A4	35	48
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604865	ED	On-Demand	Anodyne	SLC6A3	63	52
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604866	ED	On-Demand	Anodyne	SLC6A1	116	48
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604866	ED	On-Demand	Anodyne	SLC6A4	35	48
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2Cc1ccc(C(C)=O)cc1	ZINC000450604866	ED	On-Demand	Anodyne	SLC6A3	63	52
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCC1=CCCCC1	ZINC000450604871	DE	On-Demand	Anodyne	SLC6A1	81	39
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCC1=CCCCC1	ZINC000450604871	DE	On-Demand	Anodyne	SLC6A3	44	39
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCC1=CCCCC1	ZINC000450604872	DE	On-Demand	Anodyne	SLC6A1	81	39
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCC1=CCCCC1	ZINC000450604872	DE	On-Demand	Anodyne	SLC6A3	44	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCC1=CCCCC1	ZINC000450604873	DE	On-Demand	Anodyne	SLC6A1	81	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCC1=CCCCC1	ZINC000450604873	DE	On-Demand	Anodyne	SLC6A3	44	39
CCc1cc(CCCN(Cc2ccccc2[N+](=O)[O-])C2CC2)on1	ZINC000450604874	EH	On-Demand	Bother	COLA	83	31
CS(=O)(=O)c1cccc(CSCCOc2ccccc2)c1	ZINC000450604875	DG	On-Demand	Anodyne	CACNA2D1	18	40
F[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450604878	CG	On-Demand	Anodyne	HRP1_PLAFA	87	39
F[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450604878	CG	On-Demand	Anodyne	HNMT	55	39
F[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450604879	CG	On-Demand	Anodyne	HRP1_PLAFA	87	39
F[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450604879	CG	On-Demand	Anodyne	HNMT	55	39
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604884	FE	On-Demand	Anodyne	SLC6A4	41	48
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604884	FE	On-Demand	Anodyne	SLC6A3	76	51
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604884	FE	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604885	FE	On-Demand	Anodyne	SLC6A4	41	48
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604885	FE	On-Demand	Anodyne	SLC6A3	76	51
COC(=O)[C@H]1[C@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604885	FE	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604886	FE	On-Demand	Anodyne	SLC6A4	41	48
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604886	FE	On-Demand	Anodyne	SLC6A3	76	51
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2CCCC(=O)c1ccccc1	ZINC000450604886	FE	On-Demand	Anodyne	CYP2J2	57	41
CC(C)(CS(C)(=O)=O)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450604896	FD	On-Demand	Anodyne	LPXC	0	44
COc1ccccc1NC(=O)CN1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450604897	GG	On-Demand	Anodyne	HTR1A	29	40
COc1ccccc1NC(=O)CN1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450604897	GG	On-Demand	Anodyne	DRD4	28	45
COc1ccccc1NC(=O)CN1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450604897	GG	On-Demand	Anodyne	CCR3	15	41
COc1ccccc1NC(=O)CN1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450604897	GG	On-Demand	Anodyne	HCN1	41	32
COc1ccccc1NC(=O)CN1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450604897	GG	On-Demand	Anodyne	HCN4	41	32
COc1ccccc1NC(=O)CN1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450604898	GG	On-Demand	Anodyne	HTR1A	29	40
COc1ccccc1NC(=O)CN1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450604898	GG	On-Demand	Anodyne	DRD4	28	45
COc1ccccc1NC(=O)CN1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450604898	GG	On-Demand	Anodyne	CCR3	15	41
COc1ccccc1NC(=O)CN1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450604898	GG	On-Demand	Anodyne	HCN1	41	32
COc1ccccc1NC(=O)CN1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450604898	GG	On-Demand	Anodyne	HCN4	41	32
C[C@@H]1CCCN(Cc2cccc(S(C)(=O)=O)c2)[C@H]1CO	ZINC000450604909	CD	On-Demand	Anodyne	HRH3	15	40
C[C@@H]1CCCN(Cc2cccc(S(C)(=O)=O)c2)[C@@H]1CO	ZINC000450604910	CD	On-Demand	Anodyne	HRH3	15	40
C[C@H]1CCCN(Cc2cccc(S(C)(=O)=O)c2)[C@@H]1CO	ZINC000450604911	CD	On-Demand	Anodyne	HRH3	15	40
C[C@H]1CCCN(Cc2cccc(S(C)(=O)=O)c2)[C@H]1CO	ZINC000450604912	CD	On-Demand	Anodyne	HRH3	15	40
COc1ccccc1C1(CNC(=O)C[C@H]2CCOC[C@H]2OC)CCC1	ZINC000450604913	EF	On-Demand	Anodyne	KCNA3	37	42
COc1ccccc1C1(CNC(=O)C[C@H]2CCOC[C@H]2OC)CCC1	ZINC000450604913	EF	On-Demand	Anodyne	MTNR1A	18	40
COc1ccccc1C1(CNC(=O)C[C@@H]2CCOC[C@H]2OC)CCC1	ZINC000450604914	EF	On-Demand	Anodyne	KCNA3	37	42
COc1ccccc1C1(CNC(=O)C[C@@H]2CCOC[C@H]2OC)CCC1	ZINC000450604914	EF	On-Demand	Anodyne	MTNR1A	18	40
COc1ccccc1C1(CNC(=O)C[C@H]2CCOC[C@@H]2OC)CCC1	ZINC000450604915	EF	On-Demand	Anodyne	KCNA3	37	42
COc1ccccc1C1(CNC(=O)C[C@H]2CCOC[C@@H]2OC)CCC1	ZINC000450604915	EF	On-Demand	Anodyne	MTNR1A	18	40
COc1ccccc1C1(CNC(=O)C[C@@H]2CCOC[C@@H]2OC)CCC1	ZINC000450604916	EF	On-Demand	Anodyne	KCNA3	37	42
COc1ccccc1C1(CNC(=O)C[C@@H]2CCOC[C@@H]2OC)CCC1	ZINC000450604916	EF	On-Demand	Anodyne	MTNR1A	18	40
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C)[C@@H]2CO)cc1	ZINC000450604917	DE	On-Demand	Anodyne	HRH3	21	52
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C)[C@@H]2CO)cc1	ZINC000450604917	DE	On-Demand	Anodyne	SPHK1	15	46
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C)[C@@H]2CO)cc1	ZINC000450604918	DE	On-Demand	Anodyne	HRH3	21	52
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C)[C@@H]2CO)cc1	ZINC000450604918	DE	On-Demand	Anodyne	SPHK1	15	46
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C)[C@H]2CO)cc1	ZINC000450604919	DE	On-Demand	Anodyne	HRH3	21	52
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C)[C@H]2CO)cc1	ZINC000450604919	DE	On-Demand	Anodyne	SPHK1	15	46
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C)[C@H]2CO)cc1	ZINC000450604920	DE	On-Demand	Anodyne	HRH3	21	52
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C)[C@H]2CO)cc1	ZINC000450604920	DE	On-Demand	Anodyne	SPHK1	15	46
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1cccc(C(C)=O)c1	ZINC000450604929	ED	On-Demand	Anodyne	HRH3	0	41
COC(=O)[C@H]1CCCN(Cc2cccc(C(C)=O)c2)[C@@H]1C(=O)OC	ZINC000450604930	ED	On-Demand	Anodyne	HRH3	0	41
COC(=O)[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)[C@H]1C(=O)OC	ZINC000450604931	ED	On-Demand	Anodyne	HRH3	0	41
COC(=O)[C@H]1CCCN(Cc2cccc(C(C)=O)c2)[C@H]1C(=O)OC	ZINC000450604932	ED	On-Demand	Anodyne	HRH3	0	41
COCCC(C)(C)CNC(=O)c1cccc(SC)c1	ZINC000450604933	CG	On-Demand	Anodyne	DRD4	42	32
COc1ccccc1NC(=O)CN1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450604943	GD	On-Demand	Anodyne	ADRB1	0	46
COc1ccccc1NC(=O)CN1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450604943	GD	On-Demand	Anodyne	DRD2	26	46
COc1ccccc1NC(=O)CN1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450604943	GD	On-Demand	Anodyne	DRD4	45	43
COc1ccccc1NC(=O)CN1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450604943	GD	On-Demand	Anodyne	DRD3	28	46
Cc1ccc(-c2nnc(SC[C@H]3CCC(F)(F)C3)o2)cc1C	ZINC000450604949	DJ	On-Demand	Anodyne	GSK3A	40	34
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604966	GG	On-Demand	Anodyne	MC4R	63	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604966	GG	On-Demand	Anodyne	PRCP	59	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604966	GG	On-Demand	Anodyne	MC3R	49	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604966	GG	On-Demand	Anodyne	MC5R	37	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604966	GG	On-Demand	Anodyne	NPBWR1	59	39
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604967	GG	On-Demand	Anodyne	MC4R	63	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604967	GG	On-Demand	Anodyne	PRCP	59	42
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604967	GG	On-Demand	Anodyne	MC3R	49	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604967	GG	On-Demand	Anodyne	MC5R	37	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604967	GG	On-Demand	Anodyne	NPBWR1	59	39
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604968	GG	On-Demand	Anodyne	MC4R	63	40
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604968	GG	On-Demand	Anodyne	PRCP	59	42
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604968	GG	On-Demand	Anodyne	MC3R	49	40
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604968	GG	On-Demand	Anodyne	MC5R	37	40
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604968	GG	On-Demand	Anodyne	NPBWR1	59	39
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604969	GG	On-Demand	Anodyne	MC4R	63	40
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604969	GG	On-Demand	Anodyne	PRCP	59	42
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604969	GG	On-Demand	Anodyne	MC3R	49	40
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604969	GG	On-Demand	Anodyne	MC5R	37	40
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCN(c2ncc(F)cn2)CC1	ZINC000450604969	GG	On-Demand	Anodyne	NPBWR1	59	39
COCCC(C)(C)CNC(=O)Cc1cc(Br)ccc1C	ZINC000450604977	EG	On-Demand	Anodyne	CAN2	0	41
Cc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c(Cl)c1Cl	ZINC000450604987	FG	On-Demand	Anodyne	HCRTR1	20	41
Cc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c(Cl)c1Cl	ZINC000450604987	FG	On-Demand	Anodyne	P2RX7	48	52
Cc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c(Cl)c1Cl	ZINC000450604987	FG	On-Demand	Anodyne	HCRTR2	19	41
Cc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c(Cl)c1Cl	ZINC000450604987	FG	On-Demand	Anodyne	SLC6A7	0	43
COCCC(C)(C)CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450604992	FF	On-Demand	Anodyne	CACNA1I	44	36
COC[C@@]1(C)CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450604993	FE	On-Demand	Anodyne	LRRK2	26	40
COC[C@]1(C)CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450604994	FE	On-Demand	Anodyne	LRRK2	26	40
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)c1cc2n(n1)CCCC2	ZINC000450605005	FD	On-Demand	Anodyne	PLA2G7	43	45
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605016	EE	On-Demand	Anodyne	GHRHR	57	32
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605016	EE	On-Demand	Anodyne	MME	24	47
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605016	EE	On-Demand	Anodyne	CTSK	38	41
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605016	EE	On-Demand	Anodyne	TIMP3	73	39
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605016	EE	On-Demand	Anodyne	CAPNS1	40	34
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605016	EE	On-Demand	Anodyne	CAPN1	51	39
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605016	EE	On-Demand	Anodyne	NPPA	59	38
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605016	EE	On-Demand	Anodyne	SLC12A5	46	35
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605017	EE	On-Demand	Anodyne	GHRHR	57	32
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605017	EE	On-Demand	Anodyne	MME	24	47
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605017	EE	On-Demand	Anodyne	CTSK	38	41
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605017	EE	On-Demand	Anodyne	TIMP3	73	39
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605017	EE	On-Demand	Anodyne	CAPNS1	40	34
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605017	EE	On-Demand	Anodyne	CAPN1	51	39
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605017	EE	On-Demand	Anodyne	NPPA	59	38
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450605017	EE	On-Demand	Anodyne	SLC12A5	46	35
CCOC(=O)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450605026	BD	On-Demand	Anodyne	P2RY12	29	40
CCOC(=O)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450605027	BD	On-Demand	Anodyne	P2RY12	29	40
COc1cc(CN2CCC(N3CCCNC3=O)CC2)ccc1Cl	ZINC000450605042	EF	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC(N3CCCNC3=O)CC2)ccc1Cl	ZINC000450605042	EF	On-Demand	Anodyne	SSTR5	58	38
COc1cc(CN2CCC(N3CCCNC3=O)CC2)ccc1Cl	ZINC000450605042	EF	On-Demand	Anodyne	CCR3	16	44
COc1cc(CN2CCC(N3CCCNC3=O)CC2)ccc1Cl	ZINC000450605042	EF	On-Demand	Anodyne	MCHR1	15	40
COc1cc(CN2CCC(N3CCCNC3=O)CC2)ccc1Cl	ZINC000450605042	EF	On-Demand	Anodyne	CCR8	24	40
COc1cc(CN2CCC[C@H]2C(C)(C)O)ccc1Cl	ZINC000450605045	CG	On-Demand	Anodyne	DRD2	42	37
COc1cc(CN2CCC[C@H]2C(C)(C)O)ccc1Cl	ZINC000450605045	CG	On-Demand	Anodyne	SSTR5	43	37
COc1cc(CN2CCC[C@@H]2C(C)(C)O)ccc1Cl	ZINC000450605046	CG	On-Demand	Anodyne	DRD2	42	37
COc1cc(CN2CCC[C@@H]2C(C)(C)O)ccc1Cl	ZINC000450605046	CG	On-Demand	Anodyne	SSTR5	43	37
O=C(CC1(O)CCC1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450605053	FG	On-Demand	Anodyne	PRSS2	44	30
COC(=O)[C@@H](NCCCNc1cnc(C#N)cn1)C(C)C	ZINC000450605061	CC	On-Demand	Mild	CHEK1	16	40
CCC[C@H](NC(=O)C[C@H](O)CC)C(=O)OC	ZINC000450605068	BC	On-Demand	Anodyne	NOD1	50	32
CCC[C@@H](NC(=O)C[C@@H](O)CC)C(=O)OC	ZINC000450605069	BC	On-Demand	Anodyne	NOD1	50	32
CCC[C@H](NC(=O)C[C@@H](O)CC)C(=O)OC	ZINC000450605070	BC	On-Demand	Anodyne	NOD1	50	32
CCC[C@@H](NC(=O)C[C@H](O)CC)C(=O)OC	ZINC000450605071	BC	On-Demand	Anodyne	NOD1	50	32
CN(C)CC1(CNC(=O)c2cn(CC3CC3)nn2)CCCC1	ZINC000450605101	DD	On-Demand	Anodyne	HCN4	40	32
C/C=C\COc1cccc(CC(=O)NCC(C)(C)CCOC)c1	ZINC000450605104	DG	On-Demand	Anodyne	NCE103	15	40
C/C=C\COc1cccc(CC(=O)NCC(C)(C)CCOC)c1	ZINC000450605104	DG	On-Demand	Anodyne	CRTM	40	35
C/C=C\COc1cccc(CC(=O)NCC(C)(C)CCOC)c1	ZINC000450605104	DG	On-Demand	Anodyne	CAN2	0	40
C/C=C\COc1cccc(CC(=O)NCC(C)(C)CCOC)c1	ZINC000450605104	DG	On-Demand	Anodyne	PDS	47	32
COCCC(C)(C)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450605105	CE	On-Demand	Anodyne	TRPV1	32	61
COCCC(C)(C)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450605105	CE	On-Demand	Anodyne	NCE103	30	53
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](F)C3)c2c1	ZINC000450605109	DG	On-Demand	Anodyne	PDE3A	50	42
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](F)C3)c2c1	ZINC000450605109	DG	On-Demand	Anodyne	PDE3B	72	42
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](F)C3)c2c1	ZINC000450605110	DG	On-Demand	Anodyne	PDE3A	50	42
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](F)C3)c2c1	ZINC000450605110	DG	On-Demand	Anodyne	PDE3B	72	42
CCOCCO[C@H]1CCN(CCc2cscn2)C1	ZINC000450605140	CD	On-Demand	Anodyne	SCN5A	41	33
C[C@@H]1Cc2cccc(C(=O)N3CCN(c4ncc(F)cn4)CC3)c2O1	ZINC000450605143	ED	On-Demand	Anodyne	SLC6A7	0	42
C[C@H]1Cc2cccc(C(=O)N3CCN(c4ncc(F)cn4)CC3)c2O1	ZINC000450605144	ED	On-Demand	Anodyne	SLC6A7	0	42
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450605145	FF	On-Demand	Anodyne	RBP4	57	36
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450605145	FF	On-Demand	Anodyne	SFRP1	53	32
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450605145	FF	On-Demand	Anodyne	WNT3	41	31
CCC(=O)C1(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000450605168	DF	On-Demand	Anodyne	KCNA3	39	42
CCC(=O)C1(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000450605168	DF	On-Demand	Anodyne	ACAT	0	56
CCC(=O)C1(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000450605168	DF	On-Demand	Anodyne	HCN1	50	34
CCC(=O)C1(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000450605168	DF	On-Demand	Anodyne	HCN4	48	34
COC(=O)c1ccc(CC(=O)N2CCc3c2cccc3C(F)(F)F)cc1	ZINC000450605186	FH	On-Demand	Anodyne	EIF2AK3	41	33
F[C@H]1CCN(c2cc(N3CC[C@@H](F)C3)nc(-c3ccccc3)n2)C1	ZINC000450605187	EG	On-Demand	Anodyne	PKNB	23	45
F[C@H]1CCN(c2cc(N3CC[C@H](F)C3)nc(-c3ccccc3)n2)C1	ZINC000450605188	EG	On-Demand	Anodyne	PKNB	23	45
F[C@@H]1CCN(c2cc(N3CC[C@@H](F)C3)nc(-c3ccccc3)n2)C1	ZINC000450605189	EG	On-Demand	Anodyne	PKNB	23	45
C[C@@H]1CCN(C(=O)CCCC(=O)C2CC2)CC1(C)C	ZINC000450605194	CG	On-Demand	Anodyne	GNAI1	0	40
C[C@H]1CCN(C(=O)CCCC(=O)C2CC2)CC1(C)C	ZINC000450605195	CG	On-Demand	Anodyne	GNAI1	0	40
Cc1nccc(N2CCN(C(=O)c3cc(C)n(C(C)C)n3)CC2)n1	ZINC000450605222	ED	On-Demand	Anodyne	SORD	66	41
Cc1nccc(N2CCN(C(=O)Cc3ccc(OC(F)F)c(F)c3)CC2)n1	ZINC000450605223	GE	On-Demand	Anodyne	SORD	43	36
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	DRD2	41	43
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	DRD4	49	46
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	ACHE	27	44
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	HRH1	29	47
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	AVPR1B	41	34
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	HTR4	74	38
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	SSTR5	77	45
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	CCR3	48	43
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	PDK1	45	35
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	MCHR1	45	48
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	CACNA1G	28	40
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	CACNA1I	32	40
COC(=O)[C@@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605224	EE	On-Demand	Anodyne	CCR8	26	40
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	DRD2	41	43
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	DRD4	49	46
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	ACHE	27	44
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	HRH1	29	47
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	AVPR1B	41	34
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	HTR4	74	38
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	SSTR5	77	45
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	CCR3	48	43
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	PDK1	45	35
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	MCHR1	45	48
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	CACNA1G	28	40
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	CACNA1I	32	40
COC(=O)[C@H](O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450605225	EE	On-Demand	Anodyne	CCR8	26	40
F[C@H]1CCN(c2nc(CN3CCOCC3)nc3scc(-c4ccccc4)c23)C1	ZINC000450605226	GH	On-Demand	Anodyne	ADRB3	26	42
F[C@@H]1CCN(c2nc(CN3CCOCC3)nc3scc(-c4ccccc4)c23)C1	ZINC000450605227	GH	On-Demand	Anodyne	ADRB3	26	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450605250	EH	On-Demand	Bother	AVPR2	22	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450605250	EH	On-Demand	Bother	PRNP	45	34
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450605250	EH	On-Demand	Bother	TAAR1	45	55
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450605251	EH	On-Demand	Bother	AVPR2	22	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450605251	EH	On-Demand	Bother	PRNP	45	34
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450605251	EH	On-Demand	Bother	TAAR1	45	55
CCN1C(=O)CCc2cc(NC(=O)CC3(O)CCC3)ccc21	ZINC000450605260	DE	On-Demand	Anodyne	NAMPT	15	44
CN(CCN1CCC[C@@H]([C@H]2CCOC2)C1)Cc1ccccc1	ZINC000450605280	DF	On-Demand	Anodyne	SLC6A1	95	37
CN(CCN1CCC[C@@H]([C@H]2CCOC2)C1)Cc1ccccc1	ZINC000450605280	DF	On-Demand	Anodyne	SIGMAR1	29	44
CN(CCN1CCC[C@H]([C@H]2CCOC2)C1)Cc1ccccc1	ZINC000450605281	DF	On-Demand	Anodyne	SLC6A1	95	37
CN(CCN1CCC[C@H]([C@H]2CCOC2)C1)Cc1ccccc1	ZINC000450605281	DF	On-Demand	Anodyne	SIGMAR1	29	44
CN(CCN1CCC[C@H]([C@@H]2CCOC2)C1)Cc1ccccc1	ZINC000450605282	DF	On-Demand	Anodyne	SLC6A1	95	37
CN(CCN1CCC[C@H]([C@@H]2CCOC2)C1)Cc1ccccc1	ZINC000450605282	DF	On-Demand	Anodyne	SIGMAR1	29	44
CN(CCN1CCC[C@@H]([C@@H]2CCOC2)C1)Cc1ccccc1	ZINC000450605283	DF	On-Demand	Anodyne	SLC6A1	95	37
CN(CCN1CCC[C@@H]([C@@H]2CCOC2)C1)Cc1ccccc1	ZINC000450605283	DF	On-Demand	Anodyne	SIGMAR1	29	44
CN(C)Cc1nc(N2CC[C@H](F)C2)c2c(-c3ccccc3)csc2n1	ZINC000450605291	FH	On-Demand	Anodyne	ADRB3	0	44
CN(C)Cc1nc(N2CC[C@@H](F)C2)c2c(-c3ccccc3)csc2n1	ZINC000450605292	FH	On-Demand	Anodyne	ADRB3	0	44
CCC(CC)Oc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)cc1	ZINC000450605301	FG	On-Demand	Anodyne	SLC6A7	0	53
CCNC(=O)c1ccc(N2CC[C@@H](F)C2)nn1	ZINC000450605307	BC	On-Demand	Anodyne	SCD1	57	50
CCNC(=O)c1ccc(N2CC[C@@H](F)C2)nn1	ZINC000450605307	BC	On-Demand	Anodyne	SCD	45	44
CCNC(=O)c1ccc(N2CC[C@H](F)C2)nn1	ZINC000450605308	BC	On-Demand	Anodyne	SCD1	57	50
CCNC(=O)c1ccc(N2CC[C@H](F)C2)nn1	ZINC000450605308	BC	On-Demand	Anodyne	SCD	45	44
COCCC(C)(C)CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450605315	DF	On-Demand	Anodyne	P2RY12	44	34
COCCC(C)(C)CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450605315	DF	On-Demand	Anodyne	CACNA1I	53	34
COCCC(C)(C)CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450605316	DF	On-Demand	Anodyne	P2RY12	44	34
COCCC(C)(C)CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450605316	DF	On-Demand	Anodyne	CACNA1I	53	34
COc1ccccc1C1(CNC(=O)[C@H](C)Oc2ccccn2)CCC1	ZINC000450605331	EG	On-Demand	Anodyne	ACAT	0	52
COc1ccccc1C1(CNC(=O)[C@@H](C)Oc2ccccn2)CCC1	ZINC000450605332	EG	On-Demand	Anodyne	ACAT	0	52
F[C@H]1CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450605333	CC	On-Demand	Anodyne	SMG1	41	33
F[C@@H]1CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450605334	CC	On-Demand	Anodyne	SMG1	41	33
CCc1nc(C)c(CSc2nnc(-c3ccc(C)c(C)c3)o2)o1	ZINC000450605340	EJ	On-Demand	Anodyne	GSK3B	18	40
CCc1nc(C)c(CSc2nnc(-c3ccc(C)c(C)c3)o2)o1	ZINC000450605340	EJ	On-Demand	Anodyne	GSK3A	50	40
CCc1nc(C)c(CSc2nnc(-c3ccc(C)c(C)c3)o2)o1	ZINC000450605340	EJ	On-Demand	Anodyne	TERT	26	43
O=C(NCc1ccccc1-n1ccnc1)[C@@H](O)C1CCC1	ZINC000450605341	CD	On-Demand	Anodyne	NOS2	82	33
O=C(NCc1ccccc1-n1ccnc1)[C@H](O)C1CCC1	ZINC000450605342	CD	On-Demand	Anodyne	NOS2	82	33
CC(F)(F)c1ccc(C(=O)N2CCc3c2cccc3C(F)(F)F)cn1	ZINC000450605343	FI	On-Demand	Anodyne	SFRP1	58	40
Cn1cc(-c2ccc(C(=O)N3CCN(c4ncc(F)cn4)CC3)o2)cn1	ZINC000450605346	FD	On-Demand	Anodyne	SLC6A7	0	41
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	ACE	49	37
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	SLC6A1	24	42
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	SLC6A3	22	42
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	SLC18A2	47	36
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	MME	48	37
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	VACHT_TETCF	0	41
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	PREP	40	38
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	POL	0	44
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450605361	ED	On-Demand	Anodyne	BRCA1	52	34
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	ACE	49	37
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	SLC6A1	24	42
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	SLC6A3	22	42
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	SLC18A2	47	36
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	MME	48	37
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	VACHT_TETCF	0	41
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	PREP	40	38
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	POL	0	44
COC(=O)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450605362	ED	On-Demand	Anodyne	BRCA1	52	34
N#C[C@@H]1CC[C@@H](Sc2nnc(CN3CCCCC3)n2-c2ccc(F)cc2)C1	ZINC000450605363	GI	On-Demand	Mild	VCP	46	38
N#C[C@H]1CC[C@@H](Sc2nnc(CN3CCCCC3)n2-c2ccc(F)cc2)C1	ZINC000450605364	GI	On-Demand	Mild	VCP	46	38
N#C[C@@H]1CC[C@H](Sc2nnc(CN3CCCCC3)n2-c2ccc(F)cc2)C1	ZINC000450605365	GI	On-Demand	Mild	VCP	46	38
N#C[C@H]1CC[C@H](Sc2nnc(CN3CCCCC3)n2-c2ccc(F)cc2)C1	ZINC000450605366	GI	On-Demand	Mild	VCP	46	38
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](F)C1	ZINC000450605367	DF	On-Demand	Anodyne	ATP4A	20	52
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](F)C1	ZINC000450605368	DF	On-Demand	Anodyne	ATP4A	20	52
COc1ccccc1C1(CNC(=O)C[C@@H](CNC(C)=O)CC(C)C)CCC1	ZINC000450605373	FG	On-Demand	Anodyne	ACAT	0	52
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605383	GE	On-Demand	Anodyne	HTR1A	24	45
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605383	GE	On-Demand	Anodyne	DRD2	22	45
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605383	GE	On-Demand	Anodyne	DRD4	25	43
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605383	GE	On-Demand	Anodyne	TACR1	24	41
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605383	GE	On-Demand	Anodyne	ACOX1	53	38
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605383	GE	On-Demand	Anodyne	CYP2D6	0	40
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605384	GE	On-Demand	Anodyne	HTR1A	24	45
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605384	GE	On-Demand	Anodyne	DRD2	22	45
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605384	GE	On-Demand	Anodyne	DRD4	25	43
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605384	GE	On-Demand	Anodyne	TACR1	24	41
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605384	GE	On-Demand	Anodyne	ACOX1	53	38
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605384	GE	On-Demand	Anodyne	CYP2D6	0	40
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605385	GE	On-Demand	Anodyne	HTR1A	24	45
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605385	GE	On-Demand	Anodyne	DRD2	22	45
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605385	GE	On-Demand	Anodyne	DRD4	25	43
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605385	GE	On-Demand	Anodyne	TACR1	24	41
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605385	GE	On-Demand	Anodyne	ACOX1	53	38
COc1ccccc1NC(=O)CN1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450605385	GE	On-Demand	Anodyne	CYP2D6	0	40
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605386	GE	On-Demand	Anodyne	HTR1A	24	45
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605386	GE	On-Demand	Anodyne	DRD2	22	45
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605386	GE	On-Demand	Anodyne	DRD4	25	43
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605386	GE	On-Demand	Anodyne	TACR1	24	41
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605386	GE	On-Demand	Anodyne	ACOX1	53	38
COc1ccccc1NC(=O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450605386	GE	On-Demand	Anodyne	CYP2D6	0	40
C[C@H](O)CCSc1nnc(CN2CCCCC2)n1Cc1ccccc1	ZINC000450605393	FG	On-Demand	Anodyne	AGTR1	16	41
C[C@H](O)CCSc1nnc(CN2CCCCC2)n1Cc1ccccc1	ZINC000450605393	FG	On-Demand	Anodyne	SIGMAR1	17	40
C[C@@H](O)CCSc1nnc(CN2CCCCC2)n1Cc1ccccc1	ZINC000450605394	FG	On-Demand	Anodyne	AGTR1	16	41
C[C@@H](O)CCSc1nnc(CN2CCCCC2)n1Cc1ccccc1	ZINC000450605394	FG	On-Demand	Anodyne	SIGMAR1	17	40
Cc1cncc(-c2nc(CN(Cc3ccccc3[N+](=O)[O-])C3CC3)no2)c1	ZINC000450605415	FH	On-Demand	Bother	COLA	85	34
CC(=O)c1cccc(CN(C)CCC2CC2)c1	ZINC000450605419	BG	On-Demand	Anodyne	ACHE	15	43
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1nccc(C(F)F)n1	ZINC000450605420	DI	On-Demand	Anodyne	SORD	42	33
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1nccc(C(F)F)n1	ZINC000450605421	DI	On-Demand	Anodyne	SORD	42	33
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1nccc(C(F)F)n1	ZINC000450605422	DI	On-Demand	Anodyne	SORD	42	33
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1nccc(C(F)F)n1	ZINC000450605423	DI	On-Demand	Anodyne	SORD	42	33
Cn1ncc2c(N3CC[C@@H](F)C3)ncnc21	ZINC000450605424	BC	On-Demand	Anodyne	PDE3A	43	34
Cn1ncc2c(N3CC[C@H](F)C3)ncnc21	ZINC000450605425	BC	On-Demand	Anodyne	PDE3A	43	34
COc1ccc(-c2noc(CN(Cc3ccccc3[N+](=O)[O-])C3CC3)n2)nn1	ZINC000450605426	GF	On-Demand	Bother	COLA	86	35
CCC(=O)C1(C(=O)N2CCN(c3ccnc(C)n3)CC2)CC1	ZINC000450605433	DD	On-Demand	Anodyne	SORD	41	34
O=[N+]([O-])c1ccccc1CN(Cc1nnc(C2CC2)s1)C1CC1	ZINC000450605434	EG	On-Demand	Bother	COLA	78	32
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450605436	EH	On-Demand	Anodyne	P2RY12	26	41
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450605436	EH	On-Demand	Anodyne	CXCR3	24	42
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450605437	EH	On-Demand	Anodyne	P2RY12	26	41
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450605437	EH	On-Demand	Anodyne	CXCR3	24	42
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450605438	EH	On-Demand	Anodyne	P2RY12	26	41
C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450605438	EH	On-Demand	Anodyne	CXCR3	24	42
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450605439	EH	On-Demand	Anodyne	P2RY12	26	41
C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1c1ncc(C(N)=O)cc1Cl	ZINC000450605439	EH	On-Demand	Anodyne	CXCR3	24	42
CCN1C(=O)CCc2cc(NC(=O)CCCC(=O)C3CC3)ccc21	ZINC000450605444	EG	On-Demand	Anodyne	NAMPT	28	44
Cc1nccc(N2CCN(C(=O)C(CC(C)C)CC(C)C)CC2)n1	ZINC000450605451	EG	On-Demand	Anodyne	SORD	97	44
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@](C)(O)C(C)=O	ZINC000450605462	DB	On-Demand	Anodyne	SLC6A1	77	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@](C)(O)C(C)=O	ZINC000450605463	DB	On-Demand	Anodyne	SLC6A1	77	39
COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@](C)(O)C(C)=O	ZINC000450605464	DB	On-Demand	Anodyne	SLC6A1	77	39
COC(=O)[C@H]1[C@@H](C(=O)OC)[C@H]2CC[C@H]1N2C[C@@](C)(O)C(C)=O	ZINC000450605465	DB	On-Demand	Anodyne	SLC6A1	77	39
Cc1nccc(N2CCN(C(=O)c3ccsc3Br)CC2)n1	ZINC000450605466	FF	On-Demand	Anodyne	SORD	57	37
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H](F)C1	ZINC000450605479	CG	On-Demand	Bother	LIPC	0	40
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H](F)C1	ZINC000450605479	CG	On-Demand	Bother	LIPG	64	41
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H](F)C1	ZINC000450605480	CG	On-Demand	Bother	LIPC	0	40
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H](F)C1	ZINC000450605480	CG	On-Demand	Bother	LIPG	64	41
CC(C)(O)[C@@H]1CCCN1Cc1ccccc1OC1CC1	ZINC000450605483	CF	On-Demand	Anodyne	SLC5A4	49	30
CC(C)(O)[C@H]1CCCN1Cc1ccccc1OC1CC1	ZINC000450605484	CF	On-Demand	Anodyne	SLC5A4	49	30
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)CS(C)(=O)=O	ZINC000450605489	EF	On-Demand	Anodyne	H9CNL0_SPOEX	0	51
CN(C)CC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCC1	ZINC000450605505	EF	On-Demand	Anodyne	CACNA1G	22	41
CN(C)CC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCC1	ZINC000450605506	EF	On-Demand	Anodyne	CACNA1G	22	41
Cc1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1C	ZINC000450605512	FI	On-Demand	Anodyne	GSK3B	18	41
Cc1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1C	ZINC000450605512	FI	On-Demand	Anodyne	GSK3A	49	38
Cc1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1C	ZINC000450605512	FI	On-Demand	Anodyne	TERT	23	43
COc1ccc2nc(C)nc(N3CC[C@H](F)C3)c2c1	ZINC000450605521	CE	On-Demand	Anodyne	PDE3A	52	44
COc1ccc2nc(C)nc(N3CC[C@H](F)C3)c2c1	ZINC000450605521	CE	On-Demand	Anodyne	PDE3B	75	44
COc1ccc2nc(C)nc(N3CC[C@H](F)C3)c2c1	ZINC000450605521	CE	On-Demand	Anodyne	PDE10A	0	42
COc1ccc2nc(C)nc(N3CC[C@@H](F)C3)c2c1	ZINC000450605522	CE	On-Demand	Anodyne	PDE3A	52	44
COc1ccc2nc(C)nc(N3CC[C@@H](F)C3)c2c1	ZINC000450605522	CE	On-Demand	Anodyne	PDE3B	75	44
COc1ccc2nc(C)nc(N3CC[C@@H](F)C3)c2c1	ZINC000450605522	CE	On-Demand	Anodyne	PDE10A	0	42
F[C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450605533	CH	On-Demand	Anodyne	LIPG	49	34
F[C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450605534	CH	On-Demand	Anodyne	LIPG	49	34
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C)C(C)(C)C2)c1	ZINC000450605537	DH	On-Demand	Anodyne	NPBWR1	52	30
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](C)C(C)(C)C2)c1	ZINC000450605538	DH	On-Demand	Anodyne	NPBWR1	52	30
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3OC)CC2)on1	ZINC000450605552	GE	On-Demand	Anodyne	HTR1A	72	40
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3OC)CC2)on1	ZINC000450605552	GE	On-Demand	Anodyne	DRD2	59	49
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3OC)CC2)on1	ZINC000450605552	GE	On-Demand	Anodyne	DRD4	49	49
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3OC)CC2)on1	ZINC000450605552	GE	On-Demand	Anodyne	ADRA1D	38	40
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3OC)CC2)on1	ZINC000450605552	GE	On-Demand	Anodyne	DRD3	72	49
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3OC)CC2)on1	ZINC000450605552	GE	On-Demand	Anodyne	HTR4	27	48
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3OC)CC2)on1	ZINC000450605552	GE	On-Demand	Anodyne	HTR7	50	38
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3OC)CC2)on1	ZINC000450605552	GE	On-Demand	Anodyne	SIGMAR1	18	45
C[C@H]1CCCN(Cc2ccccc2OC2CC2)[C@H]1CO	ZINC000450605566	CF	On-Demand	Anodyne	SLC5A4	52	32
C[C@@H]1CCCN(Cc2ccccc2OC2CC2)[C@H]1CO	ZINC000450605567	CF	On-Demand	Anodyne	SLC5A4	52	32
C[C@@H]1CCCN(Cc2ccccc2OC2CC2)[C@@H]1CO	ZINC000450605568	CF	On-Demand	Anodyne	SLC5A4	52	32
C[C@H]1CCCN(Cc2ccccc2OC2CC2)[C@@H]1CO	ZINC000450605569	CF	On-Demand	Anodyne	SLC5A4	52	32
CC[C@@H]1C[C@H]1C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450605590	CG	On-Demand	Anodyne	KCNA3	42	41
CC[C@@H]1C[C@H]1C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450605590	CG	On-Demand	Anodyne	ACAT	0	53
CC[C@@H]1C[C@H]1C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450605590	CG	On-Demand	Anodyne	HCN1	51	33
CC[C@@H]1C[C@H]1C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450605590	CG	On-Demand	Anodyne	HCN4	49	33
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450605593	GE	On-Demand	Anodyne	SLC6A3	15	43
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450605593	GE	On-Demand	Anodyne	PREP	50	34
COC(=O)[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@@H]1C(=O)OC	ZINC000450605594	GE	On-Demand	Anodyne	SLC6A3	15	43
COC(=O)[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@@H]1C(=O)OC	ZINC000450605594	GE	On-Demand	Anodyne	PREP	50	34
COC(=O)[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1C(=O)OC	ZINC000450605595	GE	On-Demand	Anodyne	SLC6A3	15	43
COC(=O)[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1C(=O)OC	ZINC000450605595	GE	On-Demand	Anodyne	PREP	50	34
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450605596	GC	On-Demand	Mild	AR	30	43
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450605597	GC	On-Demand	Mild	AR	30	43
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450605598	GC	On-Demand	Mild	AR	30	43
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450605599	GC	On-Demand	Mild	AR	30	43
CCN(C(=O)C1CC(C)(O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605601	DE	On-Demand	Anodyne	DRD4	35	40
CCN(C(=O)C1CC(C)(O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605601	DE	On-Demand	Anodyne	ACHE	27	40
CCN(C(=O)C1CC(C)(O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605601	DE	On-Demand	Anodyne	CCR5	48	48
CCN(C(=O)C1CC(C)(O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605602	DE	On-Demand	Anodyne	DRD4	35	40
CCN(C(=O)C1CC(C)(O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605602	DE	On-Demand	Anodyne	ACHE	27	40
CCN(C(=O)C1CC(C)(O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605602	DE	On-Demand	Anodyne	CCR5	48	48
Clc1ccc(CCN2CCC[C@H](Cn3ccnn3)C2)cc1	ZINC000450605603	DF	On-Demand	Anodyne	BIRC2	26	42
Clc1ccc(CCN2CCC[C@@H](Cn3ccnn3)C2)cc1	ZINC000450605604	DF	On-Demand	Anodyne	BIRC2	26	42
CCN(CC(=O)N[C@@H]1CN(C)NC1=O)C1CC1	ZINC000450605607	BA	On-Demand	Anodyne	LASR	40	30
CCN(CC(=O)N[C@H]1CN(C)NC1=O)C1CC1	ZINC000450605608	BA	On-Demand	Anodyne	LASR	40	30
COc1ccc(Cc2nnc(SC[C@@H](Cc3ccccc3)OC)o2)cc1	ZINC000450605611	FI	On-Demand	Anodyne	PTK2	0	46
COc1ccc(Cc2nnc(SC[C@H](Cc3ccccc3)OC)o2)cc1	ZINC000450605612	FI	On-Demand	Anodyne	PTK2	0	46
CN1C[C@@H](NC(=O)[C@H](OC(C)(C)C)c2ccccc2)C(=O)N1	ZINC000450605613	DD	On-Demand	Anodyne	BIRC8	45	36
CN1C[C@@H](NC(=O)[C@@H](OC(C)(C)C)c2ccccc2)C(=O)N1	ZINC000450605614	DD	On-Demand	Anodyne	BIRC8	45	36
CN1C[C@H](NC(=O)[C@H](OC(C)(C)C)c2ccccc2)C(=O)N1	ZINC000450605615	DD	On-Demand	Anodyne	BIRC8	45	36
CN1C[C@H](NC(=O)[C@@H](OC(C)(C)C)c2ccccc2)C(=O)N1	ZINC000450605616	DD	On-Demand	Anodyne	BIRC8	45	36
CCOC(=O)c1ccc(CN2CC[C@H](Oc3ccccc3Cl)C2)nc1	ZINC000450605619	FH	On-Demand	Anodyne	P2RY12	27	40
CCOC(=O)c1ccc(CN2CC[C@H](Oc3ccccc3Cl)C2)nc1	ZINC000450605619	FH	On-Demand	Anodyne	SSTR5	44	36
CCOC(=O)c1ccc(CN2CC[C@H](Oc3ccccc3Cl)C2)nc1	ZINC000450605619	FH	On-Demand	Anodyne	UTS2R	18	41
CCOC(=O)c1ccc(CN2CC[C@H](Oc3ccccc3Cl)C2)nc1	ZINC000450605619	FH	On-Demand	Anodyne	SCD1	35	43
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)nc1	ZINC000450605620	FH	On-Demand	Anodyne	P2RY12	27	40
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)nc1	ZINC000450605620	FH	On-Demand	Anodyne	SSTR5	44	36
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)nc1	ZINC000450605620	FH	On-Demand	Anodyne	UTS2R	18	41
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)nc1	ZINC000450605620	FH	On-Demand	Anodyne	SCD1	35	43
CN1C[C@@H](NC(=O)CCCC(=O)c2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450605632	FD	On-Demand	Anodyne	KMO	0	40
CN1C[C@H](NC(=O)CCCC(=O)c2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450605633	FD	On-Demand	Anodyne	KMO	0	40
CCN(C(=O)c1ccn(CCn2cccn2)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605650	GF	On-Demand	Anodyne	ACHE	30	44
CCN(C(=O)c1ccn(CCn2cccn2)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605650	GF	On-Demand	Anodyne	OPRD1	15	42
CCN(C(=O)c1ccn(CCn2cccn2)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605650	GF	On-Demand	Anodyne	SIGMAR1	30	44
CCN(C(=O)c1ccn(CCn2cccn2)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605650	GF	On-Demand	Anodyne	CCR5	51	45
CCN(C(=O)c1ccn(CCn2cccn2)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605651	GF	On-Demand	Anodyne	ACHE	30	44
CCN(C(=O)c1ccn(CCn2cccn2)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605651	GF	On-Demand	Anodyne	OPRD1	15	42
CCN(C(=O)c1ccn(CCn2cccn2)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605651	GF	On-Demand	Anodyne	SIGMAR1	30	44
CCN(C(=O)c1ccn(CCn2cccn2)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605651	GF	On-Demand	Anodyne	CCR5	51	45
CN1C[C@@H](NC(=O)Cc2ccc(NC(=O)C3CC3)cc2)C(=O)N1	ZINC000450605653	DC	On-Demand	Anodyne	LUXR	49	36
CN1C[C@H](NC(=O)Cc2ccc(NC(=O)C3CC3)cc2)C(=O)N1	ZINC000450605654	DC	On-Demand	Anodyne	LUXR	49	36
CC(=O)[C@@](C)(O)CN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450605655	CE	On-Demand	Anodyne	SCD1	34	43
CC(=O)[C@](C)(O)CN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450605656	CE	On-Demand	Anodyne	SCD1	34	43
CC(=O)[C@](C)(O)CN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450605657	CE	On-Demand	Anodyne	SCD1	34	43
CC(=O)[C@@](C)(O)CN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450605658	CE	On-Demand	Anodyne	SCD1	34	43
CCN(C(=O)[C@@H]1OCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605692	DF	On-Demand	Anodyne	SIGMAR1	44	43
CCN(C(=O)[C@@H]1OCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605693	DF	On-Demand	Anodyne	SIGMAR1	44	43
COC(=O)[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1C(=O)OC	ZINC000450605696	GE	On-Demand	Anodyne	SLC6A3	15	43
COC(=O)[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1C(=O)OC	ZINC000450605696	GE	On-Demand	Anodyne	PREP	50	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCOCC2(CCC2)C1	ZINC000450605697	EH	On-Demand	Anodyne	CACNA1B	36	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCOCC2(CCC2)C1	ZINC000450605697	EH	On-Demand	Anodyne	EPHX2	15	43
Cc1cccc2c1C[C@@H](C(=O)N1CCN(c3ncc(F)cn3)CC1)O2	ZINC000450605712	ED	On-Demand	Anodyne	SLC6A7	0	41
Cc1cccc2c1C[C@H](C(=O)N1CCN(c3ncc(F)cn3)CC1)O2	ZINC000450605713	ED	On-Demand	Anodyne	SLC6A7	0	41
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450605720	GD	On-Demand	Mild	AR	22	43
CC(C)(CS(C)(=O)=O)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450605721	GD	On-Demand	Mild	AR	22	43
C[C@H]1CCC[C@@]1(C)C(=O)NCc1ccccc1-n1ccnc1	ZINC000450605722	CG	On-Demand	Anodyne	NOS2	85	34
C[C@@H]1CCC[C@]1(C)C(=O)NCc1ccccc1-n1ccnc1	ZINC000450605723	CG	On-Demand	Anodyne	NOS2	85	34
C[C@H]1CCC[C@]1(C)C(=O)NCc1ccccc1-n1ccnc1	ZINC000450605724	CG	On-Demand	Anodyne	NOS2	85	34
C[C@@H]1CCC[C@@]1(C)C(=O)NCc1ccccc1-n1ccnc1	ZINC000450605725	CG	On-Demand	Anodyne	NOS2	85	34
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1	ZINC000450605728	EF	On-Demand	Anodyne	BIRC8	41	33
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1	ZINC000450605729	EF	On-Demand	Anodyne	BIRC8	41	33
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1	ZINC000450605730	EF	On-Demand	Anodyne	BIRC8	41	33
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1	ZINC000450605731	EF	On-Demand	Anodyne	BIRC8	41	33
COc1ccccc1C1(CNC(=O)Cn2ccc(C)n2)CCC1	ZINC000450605732	DE	On-Demand	Anodyne	ACAT	0	48
COc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)c([N+](=O)[O-])cc1F	ZINC000450605735	GH	On-Demand	Bother	KCNA3	52	42
COc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)c([N+](=O)[O-])cc1F	ZINC000450605735	GH	On-Demand	Bother	NMBR	53	35
COc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)c([N+](=O)[O-])cc1F	ZINC000450605735	GH	On-Demand	Bother	GRPR	25	43
COc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)c([N+](=O)[O-])cc1F	ZINC000450605735	GH	On-Demand	Bother	HCN1	63	38
COc1cc(C(=O)NCC2(c3ccccc3OC)CCC2)c([N+](=O)[O-])cc1F	ZINC000450605735	GH	On-Demand	Bother	HCN4	50	36
C[C@@]1(C(=O)NCc2ccccc2-n2ccnc2)CC=CCC1	ZINC000450605754	CG	On-Demand	Anodyne	NOS2	69	30
C[C@]1(C(=O)NCc2ccccc2-n2ccnc2)CC=CCC1	ZINC000450605755	CG	On-Demand	Anodyne	NOS2	69	30
COc1ccccc1C1(CNC(=O)C(C)(C)OC(C)C)CCC1	ZINC000450605756	DG	On-Demand	Anodyne	NMBR	44	43
COc1ccccc1C1(CNC(=O)C(C)(C)OC(C)C)CCC1	ZINC000450605756	DG	On-Demand	Anodyne	GRPR	30	43
COc1ccccc1C1(CNC(=O)C(C)(C)OC(C)C)CCC1	ZINC000450605756	DG	On-Demand	Anodyne	ACAT	0	57
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605757	FF	On-Demand	Anodyne	NPBWR1	42	33
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605757	FF	On-Demand	Anodyne	SLC6A7	0	41
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605758	FF	On-Demand	Anodyne	NPBWR1	42	33
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605758	FF	On-Demand	Anodyne	SLC6A7	0	41
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605759	FF	On-Demand	Anodyne	NPBWR1	42	33
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605759	FF	On-Demand	Anodyne	SLC6A7	0	41
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605760	FF	On-Demand	Anodyne	NPBWR1	42	33
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605760	FF	On-Demand	Anodyne	SLC6A7	0	41
CCOC(=O)c1cc(C(=O)NCC2(CN(C)C)CCCC2)on1	ZINC000450605765	DD	On-Demand	Anodyne	HCN1	40	31
CCOC(=O)c1cc(C(=O)NCC2(CN(C)C)CCCC2)on1	ZINC000450605765	DD	On-Demand	Anodyne	HCN4	40	31
CCc1cc(CCCSc2nnc(-c3ccc(C)c(C)c3)o2)on1	ZINC000450605781	EJ	On-Demand	Anodyne	GSK3A	40	34
C[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1CO	ZINC000450605785	DF	On-Demand	Anodyne	HRH3	25	41
C[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1CO	ZINC000450605786	DF	On-Demand	Anodyne	HRH3	25	41
C[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@@H]1CO	ZINC000450605787	DF	On-Demand	Anodyne	HRH3	25	41
C[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)[C@@H]1CO	ZINC000450605788	DF	On-Demand	Anodyne	HRH3	25	41
CCOCc1nc(C)c(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)s1	ZINC000450605802	GH	On-Demand	Anodyne	SIGMAR1	28	41
CCOCc1nc(C)c(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)s1	ZINC000450605802	GH	On-Demand	Anodyne	CCR5	45	45
CCOCc1nc(C)c(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)s1	ZINC000450605803	GH	On-Demand	Anodyne	SIGMAR1	28	41
CCOCc1nc(C)c(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)s1	ZINC000450605803	GH	On-Demand	Anodyne	CCR5	45	45
CN1C[C@@H](NC(=O)[C@@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605804	DC	On-Demand	Anodyne	ACE	42	35
CN1C[C@@H](NC(=O)[C@@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605804	DC	On-Demand	Anodyne	FKBP1A	48	38
CN1C[C@@H](NC(=O)[C@@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605804	DC	On-Demand	Anodyne	HSD11B1	35	40
CN1C[C@@H](NC(=O)[C@@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605804	DC	On-Demand	Anodyne	BIRC8	42	33
CN1C[C@H](NC(=O)[C@@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605805	DC	On-Demand	Anodyne	ACE	42	35
CN1C[C@H](NC(=O)[C@@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605805	DC	On-Demand	Anodyne	FKBP1A	48	38
CN1C[C@H](NC(=O)[C@@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605805	DC	On-Demand	Anodyne	HSD11B1	35	40
CN1C[C@H](NC(=O)[C@@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605805	DC	On-Demand	Anodyne	BIRC8	42	33
CN1C[C@@H](NC(=O)[C@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605806	DC	On-Demand	Anodyne	ACE	42	35
CN1C[C@@H](NC(=O)[C@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605806	DC	On-Demand	Anodyne	FKBP1A	48	38
CN1C[C@@H](NC(=O)[C@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605806	DC	On-Demand	Anodyne	HSD11B1	35	40
CN1C[C@@H](NC(=O)[C@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605806	DC	On-Demand	Anodyne	BIRC8	42	33
CN1C[C@H](NC(=O)[C@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605807	DC	On-Demand	Anodyne	ACE	42	35
CN1C[C@H](NC(=O)[C@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605807	DC	On-Demand	Anodyne	FKBP1A	48	38
CN1C[C@H](NC(=O)[C@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605807	DC	On-Demand	Anodyne	HSD11B1	35	40
CN1C[C@H](NC(=O)[C@H]2CCCCN2Cc2ccccc2)C(=O)N1	ZINC000450605807	DC	On-Demand	Anodyne	BIRC8	42	33
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450605823	CC	On-Demand	Anodyne	P2RX7	48	40
C[C@H](Cc1ccccc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450605823	CC	On-Demand	Anodyne	BIRC8	41	31
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450605824	CC	On-Demand	Anodyne	P2RX7	48	40
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450605824	CC	On-Demand	Anodyne	BIRC8	41	31
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450605825	CC	On-Demand	Anodyne	P2RX7	48	40
C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450605825	CC	On-Demand	Anodyne	BIRC8	41	31
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450605826	CC	On-Demand	Anodyne	P2RX7	48	40
C[C@H](Cc1ccccc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450605826	CC	On-Demand	Anodyne	BIRC8	41	31
CCN(C(=O)[C@H]1CCCN(C)C1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605829	ED	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@H]1CCCN(C)C1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605829	ED	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)[C@H]1CCCN(C)C1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605829	ED	On-Demand	Anodyne	SLC6A1	64	32
CCN(C(=O)[C@H]1CCCN(C)C1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605829	ED	On-Demand	Anodyne	SIGMAR1	45	43
CCN(C(=O)[C@@H]1CCCN(C)C1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605830	ED	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@@H]1CCCN(C)C1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605830	ED	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)[C@@H]1CCCN(C)C1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605830	ED	On-Demand	Anodyne	SLC6A1	64	32
CCN(C(=O)[C@@H]1CCCN(C)C1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605830	ED	On-Demand	Anodyne	SIGMAR1	45	43
CCN(C(=O)[C@H]1CCCN(C)C1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605831	ED	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@H]1CCCN(C)C1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605831	ED	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)[C@H]1CCCN(C)C1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605831	ED	On-Demand	Anodyne	SLC6A1	64	32
CCN(C(=O)[C@H]1CCCN(C)C1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605831	ED	On-Demand	Anodyne	SIGMAR1	45	43
CCN(C(=O)[C@@H]1CCCN(C)C1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605832	ED	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@@H]1CCCN(C)C1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605832	ED	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)[C@@H]1CCCN(C)C1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605832	ED	On-Demand	Anodyne	SLC6A1	64	32
CCN(C(=O)[C@@H]1CCCN(C)C1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605832	ED	On-Demand	Anodyne	SIGMAR1	45	43
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1	ZINC000450605861	GH	On-Demand	Anodyne	MME	43	37
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1	ZINC000450605861	GH	On-Demand	Anodyne	TIMP3	55	34
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1	ZINC000450605861	GH	On-Demand	Anodyne	PLAU	47	36
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1	ZINC000450605861	GH	On-Demand	Anodyne	TPSAB1	40	33
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1	ZINC000450605862	GH	On-Demand	Anodyne	MME	43	37
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1	ZINC000450605862	GH	On-Demand	Anodyne	TIMP3	55	34
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1	ZINC000450605862	GH	On-Demand	Anodyne	PLAU	47	36
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1	ZINC000450605862	GH	On-Demand	Anodyne	TPSAB1	40	33
CN1C[C@@H](NC(=O)CCc2ccoc2)C(=O)N1	ZINC000450605872	BB	On-Demand	Anodyne	LUXR	55	38
CN1C[C@H](NC(=O)CCc2ccoc2)C(=O)N1	ZINC000450605873	BB	On-Demand	Anodyne	LUXR	55	38
COC(=O)[C@@](C)(O)CNC(=O)c1cc(F)c2ccccc2c1	ZINC000450605874	DD	On-Demand	Anodyne	KCNJ11	75	35
COC(=O)[C@](C)(O)CNC(=O)c1cc(F)c2ccccc2c1	ZINC000450605875	DD	On-Demand	Anodyne	KCNJ11	75	35
CCC(=O)CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1	ZINC000450605891	DH	On-Demand	Anodyne	SLC6A1	85	39
CCC(=O)CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1	ZINC000450605892	DH	On-Demand	Anodyne	SLC6A1	85	39
CCN(C(=O)c1ccc(-c2cnn(C)c2)o1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605895	GG	On-Demand	Anodyne	ACHE	25	40
CCN(C(=O)c1ccc(-c2cnn(C)c2)o1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605895	GG	On-Demand	Anodyne	SIGMAR1	30	40
CCN(C(=O)c1ccc(-c2cnn(C)c2)o1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450605895	GG	On-Demand	Anodyne	CCR5	50	42
COc1cc(OC)c2ncnc(N3CC[C@@H](F)C3)c2c1	ZINC000450605899	CE	On-Demand	Anodyne	PDE3A	61	48
COc1cc(OC)c2ncnc(N3CC[C@@H](F)C3)c2c1	ZINC000450605899	CE	On-Demand	Anodyne	PDE3B	89	48
COc1cc(OC)c2ncnc(N3CC[C@H](F)C3)c2c1	ZINC000450605900	CE	On-Demand	Anodyne	PDE3A	61	48
COc1cc(OC)c2ncnc(N3CC[C@H](F)C3)c2c1	ZINC000450605900	CE	On-Demand	Anodyne	PDE3B	89	48
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450605901	ED	On-Demand	Anodyne	ACE	52	38
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450605901	ED	On-Demand	Anodyne	MME	45	37
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450605901	ED	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@H](Cc1ccccc1)OC	ZINC000450605901	ED	On-Demand	Anodyne	BRCA1	51	32
COC(=O)[C@@H]1CCCN(C[C@@H](Cc2ccccc2)OC)[C@H]1C(=O)OC	ZINC000450605902	ED	On-Demand	Anodyne	ACE	52	38
COC(=O)[C@@H]1CCCN(C[C@@H](Cc2ccccc2)OC)[C@H]1C(=O)OC	ZINC000450605902	ED	On-Demand	Anodyne	MME	45	37
COC(=O)[C@@H]1CCCN(C[C@@H](Cc2ccccc2)OC)[C@H]1C(=O)OC	ZINC000450605902	ED	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H]1CCCN(C[C@@H](Cc2ccccc2)OC)[C@H]1C(=O)OC	ZINC000450605902	ED	On-Demand	Anodyne	BRCA1	51	32
COC(=O)[C@@H]1CCCN(C[C@H](Cc2ccccc2)OC)[C@H]1C(=O)OC	ZINC000450605903	ED	On-Demand	Anodyne	ACE	52	38
COC(=O)[C@@H]1CCCN(C[C@H](Cc2ccccc2)OC)[C@H]1C(=O)OC	ZINC000450605903	ED	On-Demand	Anodyne	MME	45	37
COC(=O)[C@@H]1CCCN(C[C@H](Cc2ccccc2)OC)[C@H]1C(=O)OC	ZINC000450605903	ED	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H]1CCCN(C[C@H](Cc2ccccc2)OC)[C@H]1C(=O)OC	ZINC000450605903	ED	On-Demand	Anodyne	BRCA1	51	32
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450605904	ED	On-Demand	Anodyne	ACE	52	38
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450605904	ED	On-Demand	Anodyne	MME	45	37
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450605904	ED	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450605904	ED	On-Demand	Anodyne	BRCA1	51	32
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCOCC2(CCC2)C1	ZINC000450605913	FH	On-Demand	Anodyne	RBP4	69	38
O=C(c1ccsc1Br)N1CCN(c2ncc(F)cn2)CC1	ZINC000450605927	FE	On-Demand	Anodyne	SLC6A7	0	43
COc1ccccc1C1(CNC(=O)CCCn2nc(C)nc2C)CCC1	ZINC000450605930	FF	On-Demand	Anodyne	ACAT	0	48
F[C@@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450605935	EH	On-Demand	Anodyne	SCD1	33	43
F[C@@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450605935	EH	On-Demand	Anodyne	SCD	24	43
F[C@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450605936	EH	On-Demand	Anodyne	SCD1	33	43
F[C@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450605936	EH	On-Demand	Anodyne	SCD	24	43
COc1ccc(-c2noc(N3CC[C@H](F)C3)n2)cc1	ZINC000450605941	CE	On-Demand	Anodyne	LUCI_PHOPE	22	44
COc1ccc(-c2noc(N3CC[C@@H](F)C3)n2)cc1	ZINC000450605942	CE	On-Demand	Anodyne	LUCI_PHOPE	22	44
Cc1ccc(-c2nnc(SC[C@H]3CCCC3(F)F)o2)cc1C	ZINC000450605944	DJ	On-Demand	Anodyne	GSK3A	46	35
COC1(CSc2nnc(-c3ccc(C)c(C)c3)o2)CCC1	ZINC000450605947	DI	On-Demand	Anodyne	GSK3B	15	42
COC1(CSc2nnc(-c3ccc(C)c(C)c3)o2)CCC1	ZINC000450605947	DI	On-Demand	Anodyne	GSK3A	38	42
COC1(CSc2nnc(-c3ccc(C)c(C)c3)o2)CCC1	ZINC000450605947	DI	On-Demand	Anodyne	TERT	22	41
COc1ccc2c(N3CC[C@@H](F)C3)ncnc2c1F	ZINC000450605964	CE	On-Demand	Anodyne	PDE3A	57	45
COc1ccc2c(N3CC[C@@H](F)C3)ncnc2c1F	ZINC000450605964	CE	On-Demand	Anodyne	PDE3B	84	45
COc1ccc2c(N3CC[C@H](F)C3)ncnc2c1F	ZINC000450605965	CE	On-Demand	Anodyne	PDE3A	57	45
COc1ccc2c(N3CC[C@H](F)C3)ncnc2c1F	ZINC000450605965	CE	On-Demand	Anodyne	PDE3B	84	45
Cc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1C	ZINC000450605974	DH	On-Demand	Anodyne	GSK3B	22	43
Cc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1C	ZINC000450605974	DH	On-Demand	Anodyne	GSK3A	54	42
Cc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1C	ZINC000450605974	DH	On-Demand	Anodyne	TERT	29	50
COc1ccccc1C1(CNC(=O)c2ccnn2CC(F)(F)F)CCC1	ZINC000450605988	FG	On-Demand	Anodyne	HCN1	53	36
COc1ccccc1C1(CNC(=O)c2ccnn2CC(F)(F)F)CCC1	ZINC000450605988	FG	On-Demand	Anodyne	HCN4	50	36
CCN(C(=O)c1ccc(-c2cnn(C)c2)o1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605996	GG	On-Demand	Anodyne	ACHE	25	40
CCN(C(=O)c1ccc(-c2cnn(C)c2)o1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605996	GG	On-Demand	Anodyne	SIGMAR1	30	40
CCN(C(=O)c1ccc(-c2cnn(C)c2)o1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450605996	GG	On-Demand	Anodyne	CCR5	50	42
CCOC(=O)c1ccc(NC[C@H](Cc2ccccc2)OC)nc1	ZINC000450606000	DF	On-Demand	Anodyne	CACNA1C	48	37
CCOC(=O)c1ccc(NC[C@H](Cc2ccccc2)OC)nc1	ZINC000450606000	DF	On-Demand	Anodyne	CAPNS1	44	32
CCOC(=O)c1ccc(NC[C@H](Cc2ccccc2)OC)nc1	ZINC000450606000	DF	On-Demand	Anodyne	CTRB_BOVIN	46	33
CCOC(=O)c1ccc(NC[C@@H](Cc2ccccc2)OC)nc1	ZINC000450606001	DF	On-Demand	Anodyne	CACNA1C	48	37
CCOC(=O)c1ccc(NC[C@@H](Cc2ccccc2)OC)nc1	ZINC000450606001	DF	On-Demand	Anodyne	CAPNS1	44	32
CCOC(=O)c1ccc(NC[C@@H](Cc2ccccc2)OC)nc1	ZINC000450606001	DF	On-Demand	Anodyne	CTRB_BOVIN	46	33
C[C@H](O)CCN1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000450606023	DG	On-Demand	Anodyne	INHA	24	46
C[C@@H](O)CCN1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000450606024	DG	On-Demand	Anodyne	INHA	24	46
CCCOc1ccc(C(=O)NCCc2ccn(C)n2)c(OC)c1	ZINC000450606039	DE	On-Demand	Anodyne	CNR2	37	41
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450606040	CB	On-Demand	Anodyne	ACE	46	35
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450606040	CB	On-Demand	Anodyne	BIRC8	40	32
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450606041	CB	On-Demand	Anodyne	ACE	46	35
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450606041	CB	On-Demand	Anodyne	BIRC8	40	32
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450606042	CB	On-Demand	Anodyne	ACE	46	35
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450606042	CB	On-Demand	Anodyne	BIRC8	40	32
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450606043	CB	On-Demand	Anodyne	ACE	46	35
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450606043	CB	On-Demand	Anodyne	BIRC8	40	32
CN1C[C@@H](NC(=O)CCCc2ccc(F)c(F)c2)C(=O)N1	ZINC000450606044	CC	On-Demand	Anodyne	LUXR	51	35
CN1C[C@H](NC(=O)CCCc2ccc(F)c(F)c2)C(=O)N1	ZINC000450606045	CC	On-Demand	Anodyne	LUXR	51	35
c1nc(CCN2CCC(CCCN3CCCC3)CC2)cs1	ZINC000450606055	DG	On-Demand	Anodyne	NPY1R	48	41
CNS(=O)(=O)c1ccc(NC[C@H](Cc2ccccc2)OC)c([N+](=O)[O-])c1	ZINC000450606064	GE	On-Demand	Bother	BDKRB1	0	48
CNS(=O)(=O)c1ccc(NC[C@@H](Cc2ccccc2)OC)c([N+](=O)[O-])c1	ZINC000450606065	GE	On-Demand	Bother	BDKRB1	0	48
C/C=C\COc1cccc(CC(=O)NCCc2ccn(C)n2)c1	ZINC000450606074	DE	On-Demand	Anodyne	MTNR1A	36	40
C/C=C\COc1cccc(CC(=O)NCCc2ccn(C)n2)c1	ZINC000450606074	DE	On-Demand	Anodyne	CAN2	0	40
C/C=C/COc1cccc(CC(=O)NCCc2ccn(C)n2)c1	ZINC000450606075	DE	On-Demand	Anodyne	MTNR1A	36	40
C/C=C/COc1cccc(CC(=O)NCCc2ccn(C)n2)c1	ZINC000450606075	DE	On-Demand	Anodyne	CAN2	0	40
COc1ccc2cccc(CC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450606076	DC	On-Demand	Anodyne	NQO2	44	47
COc1ccc2cccc(CC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450606076	DC	On-Demand	Anodyne	TRPV1	0	41
COc1ccc2cccc(CC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450606076	DC	On-Demand	Anodyne	MTR1B_CHICK	0	45
COc1ccc2cccc(CC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450606076	DC	On-Demand	Anodyne	MTNR1A	85	50
COc1ccc2cccc(CC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450606076	DC	On-Demand	Anodyne	MTNR1B	66	39
COc1ccc2cccc(CC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450606076	DC	On-Demand	Anodyne	EBP	28	41
COc1ccc2cccc(CC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450606077	DC	On-Demand	Anodyne	NQO2	44	47
COc1ccc2cccc(CC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450606077	DC	On-Demand	Anodyne	TRPV1	0	41
COc1ccc2cccc(CC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450606077	DC	On-Demand	Anodyne	MTR1B_CHICK	0	45
COc1ccc2cccc(CC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450606077	DC	On-Demand	Anodyne	MTNR1A	85	50
COc1ccc2cccc(CC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450606077	DC	On-Demand	Anodyne	MTNR1B	66	39
COc1ccc2cccc(CC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450606077	DC	On-Demand	Anodyne	EBP	28	41
CN1C[C@H](NC(=O)[C@@H]2CC2(C)C)C(=O)N1	ZINC000450606089	BB	On-Demand	Anodyne	DPEP1	49	35
CN1C[C@@H](NC(=O)[C@@H]2CC2(C)C)C(=O)N1	ZINC000450606090	BB	On-Demand	Anodyne	DPEP1	49	35
CC(C)c1noc(Cc2ccc(NC(=O)[C@H](C)OCCc3ccccc3)cc2)n1	ZINC000450606092	GI	On-Demand	Anodyne	TPSAB1	67	40
CC(C)c1noc(Cc2ccc(NC(=O)[C@H](C)OCCc3ccccc3)cc2)n1	ZINC000450606092	GI	On-Demand	Anodyne	TRYT_CANLF	0	40
CC(C)c1noc(Cc2ccc(NC(=O)[C@@H](C)OCCc3ccccc3)cc2)n1	ZINC000450606093	GI	On-Demand	Anodyne	TPSAB1	67	40
CC(C)c1noc(Cc2ccc(NC(=O)[C@@H](C)OCCc3ccccc3)cc2)n1	ZINC000450606093	GI	On-Demand	Anodyne	TRYT_CANLF	0	40
COc1ccccc1C1(CNC(=O)CC2CC(F)(F)C2)CCC1	ZINC000450606104	DH	On-Demand	Anodyne	KCNA3	41	41
COc1cc(CC(=O)NCC2(CN(C)C)CCCC2)ccc1Cl	ZINC000450606105	EG	On-Demand	Anodyne	TRPV1	22	44
COc1cc(CC(=O)NCC2(CN(C)C)CCCC2)ccc1Cl	ZINC000450606105	EG	On-Demand	Anodyne	NCE103	26	44
COc1cc(CC(=O)NCC2(CN(C)C)CCCC2)ccc1Cl	ZINC000450606105	EG	On-Demand	Anodyne	CAN2	0	44
COC(=O)c1cccc(CN2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)c1Cl	ZINC000450606120	GG	On-Demand	Anodyne	P2RX7	18	40
COC(=O)c1cccc(CN2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)c1Cl	ZINC000450606121	GG	On-Demand	Anodyne	P2RX7	18	40
COC(=O)c1cccc(CN2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)c1Cl	ZINC000450606122	GG	On-Demand	Anodyne	P2RX7	18	40
COC(=O)c1cccc(CN2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)c1Cl	ZINC000450606123	GG	On-Demand	Anodyne	P2RX7	18	40
COc1cccc(-n2cc(C(=O)NCC3(CN(C)C)CCCC3)nn2)c1	ZINC000450606137	FE	On-Demand	Anodyne	DRD4	44	34
Cc1ccc(-c2nnc(SCC[C@@H](C)O)o2)cc1C	ZINC000450606138	CG	On-Demand	Anodyne	TERT	22	42
Cc1ccc(-c2nnc(SCC[C@H](C)O)o2)cc1C	ZINC000450606139	CG	On-Demand	Anodyne	TERT	22	42
COC[C@@]1(C)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450606144	FE	On-Demand	Anodyne	HTR3A	28	49
COC[C@@]1(C)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450606144	FE	On-Demand	Anodyne	HRH4	22	49
COC[C@]1(C)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450606145	FE	On-Demand	Anodyne	HTR3A	28	49
COC[C@]1(C)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450606145	FE	On-Demand	Anodyne	HRH4	22	49
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCc1ccc(Cl)cc1	ZINC000450606146	EE	On-Demand	Anodyne	SLC6A3	28	48
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCc1ccc(Cl)cc1	ZINC000450606146	EE	On-Demand	Anodyne	HRH3	41	47
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCc1ccc(Cl)cc1	ZINC000450606146	EE	On-Demand	Anodyne	CCR1	43	38
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCc1ccc(Cl)cc1	ZINC000450606146	EE	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1C(=O)OC	ZINC000450606147	EE	On-Demand	Anodyne	SLC6A3	28	48
COC(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1C(=O)OC	ZINC000450606147	EE	On-Demand	Anodyne	HRH3	41	47
COC(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1C(=O)OC	ZINC000450606147	EE	On-Demand	Anodyne	CCR1	43	38
COC(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1C(=O)OC	ZINC000450606147	EE	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1C(=O)OC	ZINC000450606148	EE	On-Demand	Anodyne	SLC6A3	28	48
COC(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1C(=O)OC	ZINC000450606148	EE	On-Demand	Anodyne	HRH3	41	47
COC(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1C(=O)OC	ZINC000450606148	EE	On-Demand	Anodyne	CCR1	43	38
COC(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1C(=O)OC	ZINC000450606148	EE	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1C(=O)OC	ZINC000450606149	EE	On-Demand	Anodyne	SLC6A3	28	48
COC(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1C(=O)OC	ZINC000450606149	EE	On-Demand	Anodyne	HRH3	41	47
COC(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1C(=O)OC	ZINC000450606149	EE	On-Demand	Anodyne	CCR1	43	38
COC(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1C(=O)OC	ZINC000450606149	EE	On-Demand	Anodyne	BIRC2	36	40
COCCC(C)(C)CNC(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450606154	EG	On-Demand	Anodyne	TRPV1	0	42
C[C@@H]1CCN(C(=O)c2ccc3cnccc3c2)CC1(C)C	ZINC000450606159	CH	On-Demand	Anodyne	L3MBTL1	0	42
C[C@@H]1CCN(C(=O)c2ccc3cnccc3c2)CC1(C)C	ZINC000450606159	CH	On-Demand	Anodyne	L3MBTL3	40	42
C[C@H]1CCN(C(=O)c2ccc3cnccc3c2)CC1(C)C	ZINC000450606160	CH	On-Demand	Anodyne	L3MBTL1	0	42
C[C@H]1CCN(C(=O)c2ccc3cnccc3c2)CC1(C)C	ZINC000450606160	CH	On-Demand	Anodyne	L3MBTL3	40	42
F[C@@H]1CCN(c2noc3ccc(Br)cc23)C1	ZINC000450606173	CG	On-Demand	Anodyne	HRH4	15	42
F[C@H]1CCN(c2noc3ccc(Br)cc23)C1	ZINC000450606174	CG	On-Demand	Anodyne	HRH4	15	42
COc1ccccc1C1(CNC(=O)c2scnc2C(C)C)CCC1	ZINC000450606179	EI	On-Demand	Anodyne	KCNA3	47	40
COc1ccccc1C1(CNC(=O)c2scnc2C(C)C)CCC1	ZINC000450606179	EI	On-Demand	Anodyne	SOAT1	15	42
COc1ccccc1C1(CNC(=O)c2scnc2C(C)C)CCC1	ZINC000450606179	EI	On-Demand	Anodyne	ACAT	0	54
COc1ccccc1C1(CNC(=O)c2scnc2C(C)C)CCC1	ZINC000450606179	EI	On-Demand	Anodyne	HCN1	63	38
COc1ccccc1C1(CNC(=O)c2scnc2C(C)C)CCC1	ZINC000450606179	EI	On-Demand	Anodyne	HCN4	50	38
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450606188	ED	On-Demand	Anodyne	SLC6A7	0	48
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	HTR1A	35	42
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	DRD2	34	47
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	DRD4	48	47
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	ACHE	16	40
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	TACR1	28	41
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	HTR7	30	41
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	SIGMAR1	17	51
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	CCR3	24	41
COc1ccccc1NC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450606189	GF	On-Demand	Anodyne	MBTPS1	49	36
COc1ccccc1C1(CNC(=O)c2ccc(C#N)n2C)CCC1	ZINC000450606194	DF	On-Demand	Mild	KCNA3	40	39
COc1ccccc1C1(CNC(=O)c2ccc(C#N)n2C)CCC1	ZINC000450606194	DF	On-Demand	Mild	ACAT	0	50
COc1ccccc1C1(CNC(=O)c2ccc(C#N)n2C)CCC1	ZINC000450606194	DF	On-Demand	Mild	HCN1	52	36
COc1ccccc1C1(CNC(=O)c2ccc(C#N)n2C)CCC1	ZINC000450606194	DF	On-Demand	Mild	HCN4	49	36
COC[C@@]1(C)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450606195	FI	On-Demand	Anodyne	ADRB3	29	50
COC(=O)c1coc(CN2CCC(CCCN3CCCC3)CC2)n1	ZINC000450606202	EF	On-Demand	Anodyne	HTR4	46	31
CN1C[C@@H](NC(=O)COC/C=C\c2ccccc2)C(=O)N1	ZINC000450606208	CC	On-Demand	Anodyne	CACNA1B	40	34
CN1C[C@@H](NC(=O)COC/C=C\c2ccccc2)C(=O)N1	ZINC000450606208	CC	On-Demand	Anodyne	PLM2_PLAFA	31	42
CN1C[C@H](NC(=O)COC/C=C/c2ccccc2)C(=O)N1	ZINC000450606209	CC	On-Demand	Anodyne	CACNA1B	40	34
CN1C[C@H](NC(=O)COC/C=C/c2ccccc2)C(=O)N1	ZINC000450606209	CC	On-Demand	Anodyne	PLM2_PLAFA	31	42
CN1C[C@@H](NC(=O)COC/C=C/c2ccccc2)C(=O)N1	ZINC000450606210	CC	On-Demand	Anodyne	CACNA1B	40	34
CN1C[C@@H](NC(=O)COC/C=C/c2ccccc2)C(=O)N1	ZINC000450606210	CC	On-Demand	Anodyne	PLM2_PLAFA	31	42
CN1C[C@H](NC(=O)COC/C=C\c2ccccc2)C(=O)N1	ZINC000450606211	CC	On-Demand	Anodyne	CACNA1B	40	34
CN1C[C@H](NC(=O)COC/C=C\c2ccccc2)C(=O)N1	ZINC000450606211	CC	On-Demand	Anodyne	PLM2_PLAFA	31	42
CO[C@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450606214	FG	On-Demand	Bother	CTRB_BOVIN	43	30
CO[C@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450606214	FG	On-Demand	Bother	TAAR1	18	45
CO[C@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450606214	FG	On-Demand	Bother	BLA1_STEMA	24	40
CO[C@@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450606215	FG	On-Demand	Bother	CTRB_BOVIN	43	30
CO[C@@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450606215	FG	On-Demand	Bother	TAAR1	18	45
CO[C@@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450606215	FG	On-Demand	Bother	BLA1_STEMA	24	40
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)N[C@@H]3CN(C)NC3=O)cc12	ZINC000450606222	FB	On-Demand	Anodyne	P2RX3	15	40
Cc1nn(C)c2sc(C(=O)N[C@H](C)C(=O)N[C@H]3CN(C)NC3=O)cc12	ZINC000450606223	FB	On-Demand	Anodyne	P2RX3	15	40
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)N[C@@H]3CN(C)NC3=O)cc12	ZINC000450606224	FB	On-Demand	Anodyne	P2RX3	15	40
Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)N[C@H]3CN(C)NC3=O)cc12	ZINC000450606225	FB	On-Demand	Anodyne	P2RX3	15	40
CO[C@@H](CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)Cc1ccccc1	ZINC000450606247	GE	On-Demand	Anodyne	TGM2	19	44
CO[C@@H](CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)Cc1ccccc1	ZINC000450606247	GE	On-Demand	Anodyne	NAMPT	28	43
CO[C@H](CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)Cc1ccccc1	ZINC000450606248	GE	On-Demand	Anodyne	TGM2	19	44
CO[C@H](CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)Cc1ccccc1	ZINC000450606248	GE	On-Demand	Anodyne	NAMPT	28	43
C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606255	ED	On-Demand	Anodyne	TACR1	44	36
C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606255	ED	On-Demand	Anodyne	SCN9A	26	46
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606256	ED	On-Demand	Anodyne	TACR1	44	36
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606256	ED	On-Demand	Anodyne	SCN9A	26	46
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606257	ED	On-Demand	Anodyne	TACR1	44	36
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606257	ED	On-Demand	Anodyne	SCN9A	26	46
C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606258	ED	On-Demand	Anodyne	TACR1	44	36
C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606258	ED	On-Demand	Anodyne	SCN9A	26	46
CCOc1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000450606266	EF	On-Demand	Anodyne	SIGMAR1	42	41
CCOc1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000450606266	EF	On-Demand	Anodyne	CCR5	51	44
CCOc1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000450606267	EF	On-Demand	Anodyne	SIGMAR1	42	41
CCOc1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000450606267	EF	On-Demand	Anodyne	CCR5	51	44
COCCOC1(CNc2c(C#N)cnc3c(F)cc(F)cc23)CCOCC1	ZINC000450606272	GG	On-Demand	Mild	MAP3K8	69	34
CCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606273	GG	On-Demand	Anodyne	ACHE	20	40
CCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606273	GG	On-Demand	Anodyne	SIGMAR1	25	41
CCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606273	GG	On-Demand	Anodyne	CCR5	54	43
CCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606274	GG	On-Demand	Anodyne	ACHE	20	40
CCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606274	GG	On-Demand	Anodyne	SIGMAR1	25	41
CCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606274	GG	On-Demand	Anodyne	CCR5	54	43
COC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450606282	EC	On-Demand	Anodyne	TRPV1	0	41
COC(=O)[C@](C)(O)CNC(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450606283	EC	On-Demand	Anodyne	TRPV1	0	41
COC(=O)c1coc(CN2CCCC[C@H]2CCCc2ccccc2)n1	ZINC000450606291	EH	On-Demand	Anodyne	FKBP1A	44	36
COC(=O)c1coc(CN2CCCC[C@H]2CCCc2ccccc2)n1	ZINC000450606291	EH	On-Demand	Anodyne	SLC18A2	33	41
COC(=O)c1coc(CN2CCCC[C@H]2CCCc2ccccc2)n1	ZINC000450606291	EH	On-Demand	Anodyne	PREP	43	34
COC(=O)c1coc(CN2CCCC[C@H]2CCCc2ccccc2)n1	ZINC000450606291	EH	On-Demand	Anodyne	FAAH	20	48
COC(=O)c1coc(CN2CCCC[C@@H]2CCCc2ccccc2)n1	ZINC000450606292	EH	On-Demand	Anodyne	FKBP1A	44	36
COC(=O)c1coc(CN2CCCC[C@@H]2CCCc2ccccc2)n1	ZINC000450606292	EH	On-Demand	Anodyne	SLC18A2	33	41
COC(=O)c1coc(CN2CCCC[C@@H]2CCCc2ccccc2)n1	ZINC000450606292	EH	On-Demand	Anodyne	PREP	43	34
COC(=O)c1coc(CN2CCCC[C@@H]2CCCc2ccccc2)n1	ZINC000450606292	EH	On-Demand	Anodyne	FAAH	20	48
CSc1cccc(C(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)c1	ZINC000450606293	FJ	On-Demand	Anodyne	KCNK3	59	35
COC[C@]1(C)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450606296	FI	On-Demand	Anodyne	ADRB3	29	50
COc1ccc(-c2ccnc(N3CC[C@@H](F)C3)n2)cc1	ZINC000450606299	CF	On-Demand	Anodyne	DKK1	0	50
COc1ccc(-c2ccnc(N3CC[C@H](F)C3)n2)cc1	ZINC000450606300	CF	On-Demand	Anodyne	DKK1	0	50
Cc1nc2ccccc2c(N2CC[C@@H](F)C2)c1C	ZINC000450606314	BG	On-Demand	Anodyne	ADRA2B	0	42
Cc1nc2ccccc2c(N2CC[C@@H](F)C2)c1C	ZINC000450606314	BG	On-Demand	Anodyne	ADRA2C	0	42
Cc1nc2ccccc2c(N2CC[C@@H](F)C2)c1C	ZINC000450606314	BG	On-Demand	Anodyne	ATP4A	31	41
Cc1nc2ccccc2c(N2CC[C@H](F)C2)c1C	ZINC000450606315	BG	On-Demand	Anodyne	ADRA2B	0	42
Cc1nc2ccccc2c(N2CC[C@H](F)C2)c1C	ZINC000450606315	BG	On-Demand	Anodyne	ADRA2C	0	42
Cc1nc2ccccc2c(N2CC[C@H](F)C2)c1C	ZINC000450606315	BG	On-Demand	Anodyne	ATP4A	31	41
COCCC(C)(C)CNC(=O)c1cc2n(n1)CCCC2	ZINC000450606322	CE	On-Demand	Anodyne	CACNA1I	43	35
COc1cc(Cl)c(Cl)cc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606371	DD	On-Demand	Anodyne	DRD3	0	43
COc1cc(Cl)c(Cl)cc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606371	DD	On-Demand	Anodyne	HTR3A	28	45
COc1cc(Cl)c(Cl)cc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606371	DD	On-Demand	Anodyne	HTR4	72	46
COc1cc(Cl)c(Cl)cc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606372	DD	On-Demand	Anodyne	DRD3	0	43
COc1cc(Cl)c(Cl)cc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606372	DD	On-Demand	Anodyne	HTR3A	28	45
COc1cc(Cl)c(Cl)cc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606372	DD	On-Demand	Anodyne	HTR4	72	46
CN1C[C@H](NC(=O)c2ccc(OC3CCCCC3)cc2)C(=O)N1	ZINC000450606387	DD	On-Demand	Anodyne	EPHX2	15	41
CC[C@@H](O)CC(=O)NCc1ccccc1-n1ccnc1	ZINC000450606388	CD	On-Demand	Anodyne	NOS2	92	35
CC[C@H](O)CC(=O)NCc1ccccc1-n1ccnc1	ZINC000450606389	CD	On-Demand	Anodyne	NOS2	92	35
CCc1cccc(C(=O)NCC2(CN(C)C)CCCC2)n1	ZINC000450606394	CE	On-Demand	Anodyne	HCN1	50	31
CCc1cccc(C(=O)NCC2(CN(C)C)CCCC2)n1	ZINC000450606394	CE	On-Demand	Anodyne	HCN4	48	31
CN1C[C@@H](NC(=O)c2ccc(OC3CCCCC3)cc2)C(=O)N1	ZINC000450606395	DD	On-Demand	Anodyne	EPHX2	15	41
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450606396	GD	On-Demand	Anodyne	CYP2D6	15	41
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450606397	GD	On-Demand	Anodyne	CYP2D6	15	41
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450606398	GD	On-Demand	Anodyne	CYP2D6	15	41
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450606399	GD	On-Demand	Anodyne	CYP2D6	15	41
C=CCN1C(=O)C(=O)N(CCCCCC(C)=O)C1=O	ZINC000450606412	CD	On-Demand	Mild	PAOX	31	40
COC(=O)[C@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450606416	CC	On-Demand	Anodyne	ICAM1	45	35
COC(=O)[C@@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450606417	CC	On-Demand	Anodyne	ICAM1	45	35
FC(F)(F)c1ccc(N2CCN(CCc3cscn3)CC2)cc1	ZINC000450606424	EH	On-Demand	Anodyne	HTR1A	15	42
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450606426	DG	On-Demand	Anodyne	HTR2A	18	45
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450606426	DG	On-Demand	Anodyne	HTR2C	19	47
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450606426	DG	On-Demand	Anodyne	SLC6A1	128	43
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450606426	DG	On-Demand	Anodyne	CYP2J2	63	44
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450606427	DG	On-Demand	Anodyne	HTR2A	18	45
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450606427	DG	On-Demand	Anodyne	HTR2C	19	47
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450606427	DG	On-Demand	Anodyne	SLC6A1	128	43
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450606427	DG	On-Demand	Anodyne	CYP2J2	63	44
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450606428	DG	On-Demand	Anodyne	HTR2A	18	45
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450606428	DG	On-Demand	Anodyne	HTR2C	19	47
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450606428	DG	On-Demand	Anodyne	SLC6A1	128	43
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccccc1	ZINC000450606428	DG	On-Demand	Anodyne	CYP2J2	63	44
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450606429	DG	On-Demand	Anodyne	HTR2A	18	45
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450606429	DG	On-Demand	Anodyne	HTR2C	19	47
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450606429	DG	On-Demand	Anodyne	SLC6A1	128	43
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccccc1	ZINC000450606429	DG	On-Demand	Anodyne	CYP2J2	63	44
CCN(C(=O)Cc1cn(C)nc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606435	EE	On-Demand	Anodyne	DRD4	27	40
CCN(C(=O)Cc1cn(C)nc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606435	EE	On-Demand	Anodyne	CCR5	52	46
CCN(C(=O)Cc1cn(C)nc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606436	EE	On-Demand	Anodyne	DRD4	27	40
CCN(C(=O)Cc1cn(C)nc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606436	EE	On-Demand	Anodyne	CCR5	52	46
CCOc1ccccc1Oc1ccccc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606445	FD	On-Demand	Anodyne	HCN1	66	39
CCOc1ccccc1Oc1ccccc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450606445	FD	On-Demand	Anodyne	HCN4	48	36
CCOc1ccccc1Oc1ccccc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606446	FD	On-Demand	Anodyne	HCN1	66	39
CCOc1ccccc1Oc1ccccc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450606446	FD	On-Demand	Anodyne	HCN4	48	36
CC(C)Cc1ccc(CCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450606447	DD	On-Demand	Anodyne	LUXR	54	40
CC(C)Cc1ccc(CCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450606448	DD	On-Demand	Anodyne	LUXR	54	40
COCCCOc1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450606458	DC	On-Demand	Anodyne	DRD4	45	34
COCCCOc1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450606459	DC	On-Demand	Anodyne	DRD4	45	34
CN1C[C@@H](NC(=O)c2cccc(OC(F)(F)F)c2)C(=O)N1	ZINC000450606463	DC	On-Demand	Anodyne	DRD4	41	31
CN1C[C@H](NC(=O)c2cccc(OC(F)(F)F)c2)C(=O)N1	ZINC000450606464	DC	On-Demand	Anodyne	DRD4	41	31
CCN(C(=O)c1ccc(C#N)n1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606482	EF	On-Demand	Mild	SIGMAR1	35	41
CCN(C(=O)c1ccc(C#N)n1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606482	EF	On-Demand	Mild	CCR5	40	39
CCN(C(=O)c1ccc(C#N)n1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606483	EF	On-Demand	Mild	SIGMAR1	35	41
CCN(C(=O)c1ccc(C#N)n1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606483	EF	On-Demand	Mild	CCR5	40	39
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450606485	ED	On-Demand	Anodyne	RBP4	63	40
CC(C)c1noc(Cc2ccc(NC(=O)[C@H](C)OCc3ccc(F)cc3)cc2)n1	ZINC000450606486	GI	On-Demand	Anodyne	TPSAB1	56	35
CC(C)c1noc(Cc2ccc(NC(=O)[C@@H](C)OCc3ccc(F)cc3)cc2)n1	ZINC000450606487	GI	On-Demand	Anodyne	TPSAB1	56	35
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	DRD4	26	43
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	ACHE	27	40
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	OPRM1	15	43
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	OPRD1	15	43
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	SIGMAR1	33	42
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	CCR5	34	40
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	MLNR	44	40
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	CCR2	30	45
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606488	FH	On-Demand	Anodyne	MBTPS1	44	32
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	DRD4	26	43
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	ACHE	27	40
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	OPRM1	15	43
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	OPRD1	15	43
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	SIGMAR1	33	42
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	CCR5	34	40
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	MLNR	44	40
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	CCR2	30	45
CCN(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606489	FH	On-Demand	Anodyne	MBTPS1	44	32
Cc1ccnc(-c2noc(CN3CCC(CCCN4CCCC4)CC3)n2)c1	ZINC000450606490	FH	On-Demand	Anodyne	NPY1R	41	34
CCCc1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)no1	ZINC000450606492	EG	On-Demand	Anodyne	DRD4	32	40
CCCc1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)no1	ZINC000450606492	EG	On-Demand	Anodyne	ACHE	35	42
CCCc1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)no1	ZINC000450606492	EG	On-Demand	Anodyne	CCR5	34	41
CCCc1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)no1	ZINC000450606492	EG	On-Demand	Anodyne	S1PR3	0	53
CCCc1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)no1	ZINC000450606493	EG	On-Demand	Anodyne	DRD4	32	40
CCCc1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)no1	ZINC000450606493	EG	On-Demand	Anodyne	ACHE	35	42
CCCc1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)no1	ZINC000450606493	EG	On-Demand	Anodyne	CCR5	34	41
CCCc1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)no1	ZINC000450606493	EG	On-Demand	Anodyne	S1PR3	0	53
CSc1cccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c1	ZINC000450606503	EE	On-Demand	Anodyne	INHA	17	40
COc1ccccc1C1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCC1	ZINC000450606510	GF	On-Demand	Anodyne	KCNA3	48	40
COc1ccccc1C1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCC1	ZINC000450606510	GF	On-Demand	Anodyne	HCN1	68	38
COc1ccccc1C1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCC1	ZINC000450606510	GF	On-Demand	Anodyne	HCN4	51	37
COc1ccccc1C1(CNC(=O)C(C)(C)C(C)(F)F)CCC1	ZINC000450606514	EH	On-Demand	Anodyne	KCNA3	47	39
COc1ccccc1C1(CNC(=O)C(C)(C)C(C)(F)F)CCC1	ZINC000450606514	EH	On-Demand	Anodyne	NMBR	50	44
COc1ccccc1C1(CNC(=O)C(C)(C)C(C)(F)F)CCC1	ZINC000450606514	EH	On-Demand	Anodyne	GRPR	31	44
COc1ccccc1C1(CNC(=O)C(C)(C)C(C)(F)F)CCC1	ZINC000450606514	EH	On-Demand	Anodyne	ACAT	0	53
F[C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450606528	DE	On-Demand	Anodyne	PIK3CA	24	40
F[C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450606528	DE	On-Demand	Anodyne	PIK3CB	22	40
F[C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450606529	DE	On-Demand	Anodyne	PIK3CA	24	40
F[C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450606529	DE	On-Demand	Anodyne	PIK3CB	22	40
COc1ccc(CNC(=O)CCN2CC[C@H]([C@@H]3CCOC3)C2)c(OC)c1	ZINC000450606530	FE	On-Demand	Anodyne	MTNR1A	46	36
COc1ccc(CNC(=O)CCN2CC[C@H]([C@@H]3CCOC3)C2)c(OC)c1	ZINC000450606530	FE	On-Demand	Anodyne	MTNR1B	40	36
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@@H]3CCOC3)C2)c(OC)c1	ZINC000450606531	FE	On-Demand	Anodyne	MTNR1A	46	36
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@@H]3CCOC3)C2)c(OC)c1	ZINC000450606531	FE	On-Demand	Anodyne	MTNR1B	40	36
COc1ccc(CNC(=O)CCN2CC[C@H]([C@H]3CCOC3)C2)c(OC)c1	ZINC000450606532	FE	On-Demand	Anodyne	MTNR1A	46	36
COc1ccc(CNC(=O)CCN2CC[C@H]([C@H]3CCOC3)C2)c(OC)c1	ZINC000450606532	FE	On-Demand	Anodyne	MTNR1B	40	36
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@H]3CCOC3)C2)c(OC)c1	ZINC000450606533	FE	On-Demand	Anodyne	MTNR1A	46	36
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@H]3CCOC3)C2)c(OC)c1	ZINC000450606533	FE	On-Demand	Anodyne	MTNR1B	40	36
COC[C@@]1(C)CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450606548	DG	On-Demand	Anodyne	GRM5	20	40
COC[C@]1(C)CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450606549	DG	On-Demand	Anodyne	GRM5	20	40
COCCC(C)(C)CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450606559	FH	On-Demand	Anodyne	PYGL	61	40
COc1ccccc1C1(CNC(=O)[C@@H]2CC23CCSCC3)CCC1	ZINC000450606560	EH	On-Demand	Anodyne	KCNA3	46	39
COc1ccccc1C1(CNC(=O)[C@@H]2CC23CCSCC3)CCC1	ZINC000450606560	EH	On-Demand	Anodyne	ACAT	0	52
CC(C)C[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450606561	CD	On-Demand	Anodyne	BIRC8	45	34
COc1ccccc1C1(CNC(=O)[C@H]2CC23CCSCC3)CCC1	ZINC000450606562	EH	On-Demand	Anodyne	KCNA3	46	39
COc1ccccc1C1(CNC(=O)[C@H]2CC23CCSCC3)CCC1	ZINC000450606562	EH	On-Demand	Anodyne	ACAT	0	52
CC(C)C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450606563	CD	On-Demand	Anodyne	BIRC8	45	34
CC(C)C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450606565	CD	On-Demand	Anodyne	BIRC8	45	34
CC(C)C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450606566	CD	On-Demand	Anodyne	BIRC8	45	34
COC(=O)[C@@](C)(O)CNC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450606567	EE	On-Demand	Anodyne	KCNJ11	55	34
COC(=O)[C@](C)(O)CNC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450606568	EE	On-Demand	Anodyne	KCNJ11	55	34
COC(=O)C1(CSc2nnc(-c3ccc(C)c(C)c3)o2)CCCC1	ZINC000450606573	EI	On-Demand	Anodyne	GSK3B	16	43
COC(=O)C1(CSc2nnc(-c3ccc(C)c(C)c3)o2)CCCC1	ZINC000450606573	EI	On-Demand	Anodyne	GSK3A	45	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450606584	FF	On-Demand	Anodyne	SLC6A9	40	48
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450606584	FF	On-Demand	Anodyne	SLC6A7	0	52
Cn1ccc(CCNC(=O)c2cn(CCc3ccccc3)nn2)n1	ZINC000450606586	DD	On-Demand	Anodyne	LGALS3	15	40
COc1ccccc1C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCC1	ZINC000450606591	GG	On-Demand	Anodyne	KCNA3	49	43
COc1ccccc1C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCC1	ZINC000450606591	GG	On-Demand	Anodyne	HCN1	71	41
COc1ccccc1C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCC1	ZINC000450606591	GG	On-Demand	Anodyne	HCN4	52	37
COc1ccc(Nc2cc(N3CC[C@@H](F)C3)ncn2)c(OC)c1	ZINC000450606592	DF	On-Demand	Anodyne	PDE3A	49	39
COc1ccc(Nc2cc(N3CC[C@@H](F)C3)ncn2)c(OC)c1	ZINC000450606592	DF	On-Demand	Anodyne	PDE3B	69	39
COc1ccc(Nc2cc(N3CC[C@@H](F)C3)ncn2)c(OC)c1	ZINC000450606592	DF	On-Demand	Anodyne	GALR2	43	36
COc1ccc(Nc2cc(N3CC[C@H](F)C3)ncn2)c(OC)c1	ZINC000450606595	DF	On-Demand	Anodyne	PDE3A	49	39
COc1ccc(Nc2cc(N3CC[C@H](F)C3)ncn2)c(OC)c1	ZINC000450606595	DF	On-Demand	Anodyne	PDE3B	69	39
COc1ccc(Nc2cc(N3CC[C@H](F)C3)ncn2)c(OC)c1	ZINC000450606595	DF	On-Demand	Anodyne	GALR2	43	36
COC(=O)c1ccc(CC(=O)NC[C@](C)(O)C(=O)OC)cc1	ZINC000450606602	DC	On-Demand	Anodyne	PTPRB	24	43
COC(=O)c1ccc(CC(=O)NC[C@@](C)(O)C(=O)OC)cc1	ZINC000450606604	DC	On-Demand	Anodyne	PTPRB	24	43
CO[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450606606	FF	On-Demand	Bother	BDKRB1	26	48
CO[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450606610	FF	On-Demand	Bother	BDKRB1	26	48
CC(C)c1nc(C(=O)N[C@@H]2CN(C)NC2=O)nn1-c1ccccc1F	ZINC000450606618	EC	On-Demand	Anodyne	CTSA	47	33
CC(C)c1nc(C(=O)N[C@H]2CN(C)NC2=O)nn1-c1ccccc1F	ZINC000450606619	EC	On-Demand	Anodyne	CTSA	47	33
N#CC1(CSc2nnc(CN3CCCCC3)n2Cc2ccccc2)CCC1	ZINC000450606630	GI	On-Demand	Mild	SIGMAR1	17	41
N#CC1(CSc2nnc(CN3CCCCC3)n2Cc2ccccc2)CCC1	ZINC000450606630	GI	On-Demand	Mild	NPFFR1	42	33
CC(=O)c1cccc(CN2CC[C@H]([C@@H]3CCOC3)C2)c1	ZINC000450606631	CF	On-Demand	Anodyne	DRD4	24	40
CC(=O)c1cccc(CN2CC[C@H]([C@@H]3CCOC3)C2)c1	ZINC000450606631	CF	On-Demand	Anodyne	CCR3	32	40
CC(=O)c1cccc(CN2CC[C@@H]([C@@H]3CCOC3)C2)c1	ZINC000450606632	CF	On-Demand	Anodyne	DRD4	24	40
CC(=O)c1cccc(CN2CC[C@@H]([C@@H]3CCOC3)C2)c1	ZINC000450606632	CF	On-Demand	Anodyne	CCR3	32	40
CC(=O)c1cccc(CN2CC[C@H]([C@H]3CCOC3)C2)c1	ZINC000450606633	CF	On-Demand	Anodyne	DRD4	24	40
CC(=O)c1cccc(CN2CC[C@H]([C@H]3CCOC3)C2)c1	ZINC000450606633	CF	On-Demand	Anodyne	CCR3	32	40
CC(=O)c1cccc(CN2CC[C@@H]([C@H]3CCOC3)C2)c1	ZINC000450606634	CF	On-Demand	Anodyne	DRD4	24	40
CC(=O)c1cccc(CN2CC[C@@H]([C@H]3CCOC3)C2)c1	ZINC000450606634	CF	On-Demand	Anodyne	CCR3	32	40
COc1ccccc1C1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCC1	ZINC000450606639	FH	On-Demand	Anodyne	KCNA3	38	40
COc1ccccc1C1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCC1	ZINC000450606639	FH	On-Demand	Anodyne	MTNR1A	19	41
COc1ccccc1C1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCC1	ZINC000450606639	FH	On-Demand	Anodyne	HCN1	57	39
COc1ccccc1C1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCC1	ZINC000450606639	FH	On-Demand	Anodyne	HCN4	50	36
CCN(C(=O)c1cc2n(n1)CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606663	FF	On-Demand	Anodyne	ACHE	0	46
CCN(C(=O)c1cc2n(n1)CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606664	FF	On-Demand	Anodyne	ACHE	0	46
CCn1nnc(C)c1CSc1nnc(Cc2ccc(OC)cc2)o1	ZINC000450606673	EF	On-Demand	Anodyne	PTK2	25	54
CCN(C(=O)[C@@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606680	DF	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606680	DF	On-Demand	Anodyne	DRD4	36	40
CCN(C(=O)[C@@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606680	DF	On-Demand	Anodyne	ACHE	28	41
CCN(C(=O)[C@@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606680	DF	On-Demand	Anodyne	CCR5	46	44
CCN(C(=O)[C@@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606680	DF	On-Demand	Anodyne	CACNA1G	27	41
CCN(C(=O)[C@@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606681	DF	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606681	DF	On-Demand	Anodyne	DRD4	36	40
CCN(C(=O)[C@@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606681	DF	On-Demand	Anodyne	ACHE	28	41
CCN(C(=O)[C@@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606681	DF	On-Demand	Anodyne	CCR5	46	44
CCN(C(=O)[C@@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606681	DF	On-Demand	Anodyne	CACNA1G	27	41
CCN(C(=O)[C@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606682	DF	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606682	DF	On-Demand	Anodyne	DRD4	36	40
CCN(C(=O)[C@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606682	DF	On-Demand	Anodyne	ACHE	28	41
CCN(C(=O)[C@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606682	DF	On-Demand	Anodyne	CCR5	46	44
CCN(C(=O)[C@H]1CC1(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606682	DF	On-Demand	Anodyne	CACNA1G	27	41
CCN(C(=O)[C@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606683	DF	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606683	DF	On-Demand	Anodyne	DRD4	36	40
CCN(C(=O)[C@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606683	DF	On-Demand	Anodyne	ACHE	28	41
CCN(C(=O)[C@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606683	DF	On-Demand	Anodyne	CCR5	46	44
CCN(C(=O)[C@H]1CC1(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606683	DF	On-Demand	Anodyne	CACNA1G	27	41
COCCC(C)(C)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450606721	FH	On-Demand	Anodyne	DRD4	40	31
COCCC(C)(C)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450606721	FH	On-Demand	Anodyne	MTNR1A	42	43
COCCC(C)(C)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450606721	FH	On-Demand	Anodyne	MTNR1B	48	46
COC[C@]1(C)CCN(c2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)C1	ZINC000450606745	GH	On-Demand	Anodyne	NPBWR1	45	39
COC[C@@]1(C)CCN(c2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)C1	ZINC000450606746	GH	On-Demand	Anodyne	NPBWR1	45	39
COCCC(C)(C)CNC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450606747	EI	On-Demand	Anodyne	CACNA1I	45	37
COCCC(C)(C)CNC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450606748	EI	On-Demand	Anodyne	CACNA1I	45	37
COCCC(C)(C)CNC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450606749	EI	On-Demand	Anodyne	CACNA1I	45	37
COCCC(C)(C)CNC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450606750	EI	On-Demand	Anodyne	CACNA1I	45	37
CC(C)(C)OC(=O)c1cccc(N2CC[C@H](F)C2)n1	ZINC000450606755	CF	On-Demand	Anodyne	PRKCQ	0	43
CC(C)(C)OC(=O)c1cccc(N2CC[C@@H](F)C2)n1	ZINC000450606756	CF	On-Demand	Anodyne	PRKCQ	0	43
F[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450606778	EF	On-Demand	Anodyne	PDE3A	54	41
F[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450606778	EF	On-Demand	Anodyne	HTT	0	42
F[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450606779	EF	On-Demand	Anodyne	PDE3A	54	41
F[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450606779	EF	On-Demand	Anodyne	HTT	0	42
C[C@@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000450606795	EG	On-Demand	Bother	CACNA1D	50	33
Cc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1S(=O)(=O)NC1CCCC1	ZINC000450606831	GC	On-Demand	Anodyne	CCR8	80	38
Cc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1S(=O)(=O)NC1CCCC1	ZINC000450606831	GC	On-Demand	Anodyne	BRD4	24	44
Cc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1S(=O)(=O)NC1CCCC1	ZINC000450606832	GC	On-Demand	Anodyne	CCR8	80	38
Cc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1S(=O)(=O)NC1CCCC1	ZINC000450606832	GC	On-Demand	Anodyne	BRD4	24	44
O=C(CCCN1C[C@H](O)C[C@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606847	FH	On-Demand	Anodyne	DRD2	25	42
O=C(CCCN1C[C@H](O)C[C@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606847	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1C[C@H](O)C[C@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606847	FH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1C[C@@H](O)C[C@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606848	FH	On-Demand	Anodyne	DRD2	25	42
O=C(CCCN1C[C@@H](O)C[C@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606848	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1C[C@@H](O)C[C@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606848	FH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606849	FH	On-Demand	Anodyne	DRD2	25	42
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606849	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606849	FH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1C[C@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606850	FH	On-Demand	Anodyne	DRD2	25	42
O=C(CCCN1C[C@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606850	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1C[C@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000450606850	FH	On-Demand	Anodyne	ERG2	19	42
Cn1ccc(CCNC(=O)CCc2ccc3ccccc3c2O)n1	ZINC000450606854	DF	On-Demand	Anodyne	SUCNR1	43	35
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606862	DG	On-Demand	Anodyne	DRD2	15	41
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606862	DG	On-Demand	Anodyne	DRD4	34	41
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606862	DG	On-Demand	Anodyne	ACHE	28	41
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606862	DG	On-Demand	Anodyne	SIGMAR1	52	46
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606862	DG	On-Demand	Anodyne	CCR5	50	44
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606863	DG	On-Demand	Anodyne	DRD2	15	41
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606863	DG	On-Demand	Anodyne	DRD4	34	41
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606863	DG	On-Demand	Anodyne	ACHE	28	41
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606863	DG	On-Demand	Anodyne	SIGMAR1	52	46
CC[C@@H]1C[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606863	DG	On-Demand	Anodyne	CCR5	50	44
COC(=O)c1coc(CN2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000450606871	EF	On-Demand	Anodyne	SCD1	28	43
COC(=O)c1coc(CN2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000450606872	EF	On-Demand	Anodyne	SCD1	28	43
CCN(C(=O)c1c2n(c(=O)n1C)CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606881	GE	On-Demand	Anodyne	ACHE	27	40
CCN(C(=O)c1c2n(c(=O)n1C)CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606881	GE	On-Demand	Anodyne	SLC6A1	59	32
CCN(C(=O)c1c2n(c(=O)n1C)CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606881	GE	On-Demand	Anodyne	SIGMAR1	33	40
CCN(C(=O)c1c2n(c(=O)n1C)CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606881	GE	On-Demand	Anodyne	CCR5	49	41
CCN(C(=O)c1c2n(c(=O)n1C)CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606882	GE	On-Demand	Anodyne	ACHE	27	40
CCN(C(=O)c1c2n(c(=O)n1C)CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606882	GE	On-Demand	Anodyne	SLC6A1	59	32
CCN(C(=O)c1c2n(c(=O)n1C)CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606882	GE	On-Demand	Anodyne	SIGMAR1	33	40
CCN(C(=O)c1c2n(c(=O)n1C)CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606882	GE	On-Demand	Anodyne	CCR5	49	41
CCN(C(=O)c1cc(C)n(C(C)C)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606885	FH	On-Demand	Anodyne	DRD4	41	40
CCN(C(=O)c1cc(C)n(C(C)C)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606885	FH	On-Demand	Anodyne	ACHE	28	40
CCN(C(=O)c1cc(C)n(C(C)C)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450606885	FH	On-Demand	Anodyne	CCR5	49	42
CCN(C(=O)c1cc(C)n(C(C)C)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606886	FH	On-Demand	Anodyne	DRD4	41	40
CCN(C(=O)c1cc(C)n(C(C)C)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606886	FH	On-Demand	Anodyne	ACHE	28	40
CCN(C(=O)c1cc(C)n(C(C)C)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450606886	FH	On-Demand	Anodyne	CCR5	49	42
CCc1cc(N[C@@H]2CCCN(CCCO)C2)n2ncnc2n1	ZINC000450606897	DC	On-Demand	Anodyne	DHOD	0	42
CCc1cc(N[C@H]2CCCN(CCCO)C2)n2ncnc2n1	ZINC000450606898	DC	On-Demand	Anodyne	DHOD	0	42
CC(C)c1cc(N[C@H]2CCCN(CCCO)C2)nc(C(C)C)n1	ZINC000450606904	DE	On-Demand	Anodyne	BIRC2	41	32
CC(C)c1cc(N[C@@H]2CCCN(CCCO)C2)nc(C(C)C)n1	ZINC000450606905	DE	On-Demand	Anodyne	BIRC2	41	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)CC2(O)CCC2)cc1	ZINC000450606907	DE	On-Demand	Anodyne	TIMP3	43	33
COC(=O)[C@H](C)Cc1ccc(NC(=O)CC2(O)CCC2)cc1	ZINC000450606907	DE	On-Demand	Anodyne	SLC1A2	47	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CC2(O)CCC2)cc1	ZINC000450606908	DE	On-Demand	Anodyne	TIMP3	43	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CC2(O)CCC2)cc1	ZINC000450606908	DE	On-Demand	Anodyne	SLC1A2	47	32
Cc1c([N+](=O)[O-])cnc(NC[C@H]2CCCCN2CCO)c1Br	ZINC000450606918	FD	On-Demand	Bother	PRKCQ	44	37
Cc1c([N+](=O)[O-])cnc(NC[C@@H]2CCCCN2CCO)c1Br	ZINC000450606919	FD	On-Demand	Bother	PRKCQ	44	37
Cc1ccccc1-c1nnc(SCC[C@H]2CCOC2)o1	ZINC000450606927	CH	On-Demand	Anodyne	TYMS	0	41
Cc1ccccc1-c1nnc(SCC[C@@H]2CCOC2)o1	ZINC000450606928	CH	On-Demand	Anodyne	TYMS	0	41
C[C@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606935	FH	On-Demand	Anodyne	CACNA1B	47	36
C[C@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606935	FH	On-Demand	Anodyne	CETP	0	44
C[C@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606935	FH	On-Demand	Anodyne	CCR5	38	42
C[C@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606935	FH	On-Demand	Anodyne	CCR2	37	41
C[C@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606935	FH	On-Demand	Anodyne	CACNA1G	21	43
C[C@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606935	FH	On-Demand	Anodyne	CYP2J2	44	31
C[C@@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606936	FH	On-Demand	Anodyne	CACNA1B	47	36
C[C@@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606936	FH	On-Demand	Anodyne	CETP	0	44
C[C@@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606936	FH	On-Demand	Anodyne	CCR5	38	42
C[C@@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606936	FH	On-Demand	Anodyne	CCR2	37	41
C[C@@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606936	FH	On-Demand	Anodyne	CACNA1G	21	43
C[C@@H](O)CCCN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450606936	FH	On-Demand	Anodyne	CYP2J2	44	31
CC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2cccc(C(F)(F)F)c2)cc1	ZINC000450606938	FI	On-Demand	Anodyne	CCR2	34	40
CC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2cccc(C(F)(F)F)c2)cc1	ZINC000450606939	FI	On-Demand	Anodyne	CCR2	34	40
CC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2cccc(C(F)(F)F)c2)cc1	ZINC000450606940	FI	On-Demand	Anodyne	CCR2	34	40
CC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2cccc(C(F)(F)F)c2)cc1	ZINC000450606941	FI	On-Demand	Anodyne	CCR2	34	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1	ZINC000450606942	GH	On-Demand	Anodyne	P4HTM	0	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1	ZINC000450606942	GH	On-Demand	Anodyne	GCK	27	45
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1	ZINC000450606943	GH	On-Demand	Anodyne	P4HTM	0	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1	ZINC000450606943	GH	On-Demand	Anodyne	GCK	27	45
CCc1cc(CCCN2CCN([C@@H](C)c3cccc(F)c3)CC2)on1	ZINC000450606971	EH	On-Demand	Anodyne	MC4R	44	41
CCc1cc(CCCN2CCN([C@H](C)c3cccc(F)c3)CC2)on1	ZINC000450606972	EH	On-Demand	Anodyne	MC4R	44	41
C[C@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000450606996	EG	On-Demand	Bother	CACNA1D	50	33
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607001	DH	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607001	DH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607001	DH	On-Demand	Anodyne	HTR2A	28	48
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607001	DH	On-Demand	Anodyne	HTR2C	17	54
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607001	DH	On-Demand	Anodyne	SLC6A1	109	37
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607001	DH	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607001	DH	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607001	DH	On-Demand	Anodyne	CYP2J2	55	38
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607002	DH	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607002	DH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607002	DH	On-Demand	Anodyne	HTR2A	28	48
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607002	DH	On-Demand	Anodyne	HTR2C	17	54
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607002	DH	On-Demand	Anodyne	SLC6A1	109	37
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607002	DH	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607002	DH	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607002	DH	On-Demand	Anodyne	CYP2J2	55	38
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607003	DH	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607003	DH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607003	DH	On-Demand	Anodyne	HTR2A	28	48
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607003	DH	On-Demand	Anodyne	HTR2C	17	54
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607003	DH	On-Demand	Anodyne	SLC6A1	109	37
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607003	DH	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607003	DH	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607003	DH	On-Demand	Anodyne	CYP2J2	55	38
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607004	DH	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607004	DH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607004	DH	On-Demand	Anodyne	HTR2A	28	48
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607004	DH	On-Demand	Anodyne	HTR2C	17	54
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607004	DH	On-Demand	Anodyne	SLC6A1	109	37
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607004	DH	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607004	DH	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@@H]([C@H]2CCOC2)C1)c1ccc(F)cc1	ZINC000450607004	DH	On-Demand	Anodyne	CYP2J2	55	38
CN(C)c1nccc(N2CC[C@@H](F)C2)n1	ZINC000450607008	BD	On-Demand	Anodyne	SORD	61	33
CN(C)c1nccc(N2CC[C@H](F)C2)n1	ZINC000450607009	BD	On-Demand	Anodyne	SORD	61	33
c1ccc(Cn2c(CN3CCCCC3)nnc2SCn2cccn2)cc1	ZINC000450607035	FG	On-Demand	Anodyne	AGTR1	19	40
COCCC(C)(C)CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450607045	GF	On-Demand	Mild	AR	24	42
COCCC(C)(C)CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450607046	GF	On-Demand	Mild	AR	24	42
COc1ccccc1NC(=O)CN1CCN(CCC2=CCCCC2)CC1	ZINC000450607066	FG	On-Demand	Anodyne	HTR1A	43	37
COc1ccccc1NC(=O)CN1CCN(CCC2=CCCCC2)CC1	ZINC000450607066	FG	On-Demand	Anodyne	ADRA1D	25	41
COc1ccccc1NC(=O)CN1CCN(CCC2=CCCCC2)CC1	ZINC000450607066	FG	On-Demand	Anodyne	ADRA1A	24	40
COCCC(C)(C)CNC(=O)c1cc2ccncc2s1	ZINC000450607072	CG	On-Demand	Anodyne	SELE	52	36
COCCC(C)(C)CNC(=O)c1cc2ccncc2s1	ZINC000450607072	CG	On-Demand	Anodyne	ICAM1	44	36
COCCC(C)(C)CNC(=O)c1cc2ccncc2s1	ZINC000450607072	CG	On-Demand	Anodyne	VCAM1	53	36
O=C1CC[C@@H]2CN(CCc3ccc(Cl)cc3)CC[C@H]2N1C1CC1	ZINC000450607097	EG	On-Demand	Anodyne	CACNA1C	0	42
O=C1CC[C@@H]2CN(CCc3ccc(Cl)cc3)CC[C@H]2N1C1CC1	ZINC000450607097	EG	On-Demand	Anodyne	CACNA1D	63	42
O=C1CC[C@@H]2CN(CCc3ccc(Cl)cc3)CC[C@H]2N1C1CC1	ZINC000450607097	EG	On-Demand	Anodyne	BIRC2	29	42
O=C1CC[C@H]2CN(CCc3ccc(Cl)cc3)CC[C@H]2N1C1CC1	ZINC000450607098	EG	On-Demand	Anodyne	CACNA1C	0	42
O=C1CC[C@H]2CN(CCc3ccc(Cl)cc3)CC[C@H]2N1C1CC1	ZINC000450607098	EG	On-Demand	Anodyne	CACNA1D	63	42
O=C1CC[C@H]2CN(CCc3ccc(Cl)cc3)CC[C@H]2N1C1CC1	ZINC000450607098	EG	On-Demand	Anodyne	BIRC2	29	42
O=C1CC[C@@H]2CN(CCc3ccc(Cl)cc3)CC[C@@H]2N1C1CC1	ZINC000450607099	EG	On-Demand	Anodyne	CACNA1C	0	42
O=C1CC[C@@H]2CN(CCc3ccc(Cl)cc3)CC[C@@H]2N1C1CC1	ZINC000450607099	EG	On-Demand	Anodyne	CACNA1D	63	42
O=C1CC[C@@H]2CN(CCc3ccc(Cl)cc3)CC[C@@H]2N1C1CC1	ZINC000450607099	EG	On-Demand	Anodyne	BIRC2	29	42
O=C1CC[C@H]2CN(CCc3ccc(Cl)cc3)CC[C@@H]2N1C1CC1	ZINC000450607100	EG	On-Demand	Anodyne	CACNA1C	0	42
O=C1CC[C@H]2CN(CCc3ccc(Cl)cc3)CC[C@@H]2N1C1CC1	ZINC000450607100	EG	On-Demand	Anodyne	CACNA1D	63	42
O=C1CC[C@H]2CN(CCc3ccc(Cl)cc3)CC[C@@H]2N1C1CC1	ZINC000450607100	EG	On-Demand	Anodyne	BIRC2	29	42
Cc1nn(C)cc1CC(=O)Nc1ccccc1C(=O)OC(C)(C)C	ZINC000450607115	EF	On-Demand	Anodyne	FAS	17	40
CSc1ccc2ncnc(NC[C@H]3CCCCN3CCO)c2c1	ZINC000450607116	EE	On-Demand	Anodyne	CLK4	45	35
CSc1ccc2ncnc(NC[C@H]3CCCCN3CCO)c2c1	ZINC000450607116	EE	On-Demand	Anodyne	DYRK1B	19	40
CSc1ccc2ncnc(NC[C@@H]3CCCCN3CCO)c2c1	ZINC000450607117	EE	On-Demand	Anodyne	CLK4	45	35
CSc1ccc2ncnc(NC[C@@H]3CCCCN3CCO)c2c1	ZINC000450607117	EE	On-Demand	Anodyne	DYRK1B	19	40
CC(C)c1nnc(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)s1	ZINC000450607126	GF	On-Demand	Anodyne	GNAI1	0	41
CC(C)c1nnc(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)s1	ZINC000450607126	GF	On-Demand	Anodyne	GNAI3	0	41
CC(C)c1nnc(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)s1	ZINC000450607126	GF	On-Demand	Anodyne	GNAO1	0	41
CCCCn1c(=O)c2ccccc2n2c(SCCC(C)(F)F)nnc12	ZINC000450607127	FH	On-Demand	Anodyne	RORB	0	40
CN(C)CC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCC1	ZINC000450607139	FF	On-Demand	Anodyne	HCN1	50	31
CN(C)CC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCC1	ZINC000450607139	FF	On-Demand	Anodyne	HCN4	48	31
CN(C)CC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCC1	ZINC000450607140	FF	On-Demand	Anodyne	HCN1	50	31
CN(C)CC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCC1	ZINC000450607140	FF	On-Demand	Anodyne	HCN4	48	31
COc1cccc2c(N3CC[C@@H](F)C3)c(C)cnc12	ZINC000450607141	CG	On-Demand	Anodyne	PDE3A	44	35
COc1cccc2c(N3CC[C@@H](F)C3)c(C)cnc12	ZINC000450607141	CG	On-Demand	Anodyne	PDE3B	65	35
COc1cccc2c(N3CC[C@@H](F)C3)c(C)cnc12	ZINC000450607141	CG	On-Demand	Anodyne	ATP4A	36	40
COc1cccc2c(N3CC[C@H](F)C3)c(C)cnc12	ZINC000450607142	CG	On-Demand	Anodyne	PDE3A	44	35
COc1cccc2c(N3CC[C@H](F)C3)c(C)cnc12	ZINC000450607142	CG	On-Demand	Anodyne	PDE3B	65	35
COc1cccc2c(N3CC[C@H](F)C3)c(C)cnc12	ZINC000450607142	CG	On-Demand	Anodyne	ATP4A	36	40
CN(C)CC1(CNC(=O)COc2ccc(C#N)c(Br)c2)CCCC1	ZINC000450607150	GF	On-Demand	Mild	TRPV4	40	30
CCOc1nc2ccc(C(=O)N3CCN(c4ncc(F)cn4)CC3)cc2[nH]1	ZINC000450607170	FD	On-Demand	Anodyne	P2RY12	30	41
CCOc1nc2ccc(C(=O)N3CCN(c4ncc(F)cn4)CC3)cc2[nH]1	ZINC000450607170	FD	On-Demand	Anodyne	CCKAR	24	40
CCOc1nc2ccc(C(=O)N3CCN(c4ncc(F)cn4)CC3)cc2[nH]1	ZINC000450607170	FD	On-Demand	Anodyne	SLC6A7	0	47
CC(C)NS(=O)(=O)c1cccnc1N1CC[C@H](F)C1	ZINC000450607171	CD	On-Demand	Anodyne	PRKCQ	40	31
CC(C)NS(=O)(=O)c1cccnc1N1CC[C@@H](F)C1	ZINC000450607172	CD	On-Demand	Anodyne	PRKCQ	40	31
O=C(c1ccc2c(c1)OC(F)(F)O2)N1CCN(c2ncc(F)cn2)CC1	ZINC000450607173	FD	On-Demand	Anodyne	SLC6A7	0	48
COC[C@@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450607175	GI	On-Demand	Bother	TAAR1	39	50
COC[C@]1(C)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450607176	GI	On-Demand	Bother	TAAR1	39	50
CN(C)c1nc(N2CC[C@H](F)C2)nc2ccccc12	ZINC000450607179	CE	On-Demand	Anodyne	ADRA2A	0	42
CN(C)c1nc(N2CC[C@@H](F)C2)nc2ccccc12	ZINC000450607180	CE	On-Demand	Anodyne	ADRA2A	0	42
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	DRD2	32	42
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	DRD1	0	44
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	DRD4	23	49
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	HTR2A	32	49
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	HTR2C	24	55
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	SLC6A1	40	35
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	HRH1	23	44
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	SLC18A3	0	43
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	HTR3B	0	45
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450607208	DF	On-Demand	Anodyne	CYP2J2	57	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)cc1	ZINC000450607211	GF	On-Demand	Anodyne	NAMPT	45	41
O=C(NCCCN1CCCCC1)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450607212	FG	On-Demand	Anodyne	GNAI1	0	43
O=C(NCCCN1CCCCC1)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450607212	FG	On-Demand	Anodyne	GNAI3	0	43
O=C(NCCCN1CCCCC1)C1CCN(CC23CCC(CC2)C3)CC1	ZINC000450607212	FG	On-Demand	Anodyne	GNAO1	0	43
OCCN1CCCC[C@@H]1CN=c1[nH]cnc2cc(Cl)ccc12	ZINC000450607215	DD	On-Demand	Anodyne	HNMT	49	34
OCCN1CCCC[C@H]1CN=c1[nH]cnc2cc(Cl)ccc12	ZINC000450607216	DD	On-Demand	Anodyne	HNMT	49	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450607223	FH	On-Demand	Anodyne	TRPV1	17	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450607223	FH	On-Demand	Anodyne	CXCR2	15	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450607223	FH	On-Demand	Anodyne	P4HTM	0	46
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450607224	FH	On-Demand	Anodyne	TRPV1	17	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450607224	FH	On-Demand	Anodyne	CXCR2	15	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450607224	FH	On-Demand	Anodyne	P4HTM	0	46
OCCCN1CCC[C@H](Nc2ccc3nnc(-c4ccccc4F)n3n2)C1	ZINC000450607225	FD	On-Demand	Anodyne	SLC6A1	42	36
OCCCN1CCC[C@@H](Nc2ccc3nnc(-c4ccccc4F)n3n2)C1	ZINC000450607226	FD	On-Demand	Anodyne	SLC6A1	42	36
OCCCN1CCC[C@@H](N=c2[nH]c3c(F)cccc3o2)C1	ZINC000450607231	CD	On-Demand	Anodyne	SLC6A1	40	34
OCCCN1CCC[C@H](N=c2[nH]c3c(F)cccc3o2)C1	ZINC000450607232	CD	On-Demand	Anodyne	SLC6A1	40	34
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450607254	CG	On-Demand	Anodyne	TIMP3	42	32
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450607255	CG	On-Demand	Anodyne	TIMP3	42	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@H]2COc3ccccc3O2)cc1	ZINC000450607261	FG	On-Demand	Anodyne	TIMP3	41	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@@H]2COc3ccccc3O2)cc1	ZINC000450607262	FG	On-Demand	Anodyne	TIMP3	41	31
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C[C@@H]2COc3ccccc3O2)cc1	ZINC000450607263	FG	On-Demand	Anodyne	TIMP3	41	31
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C[C@H]2COc3ccccc3O2)cc1	ZINC000450607264	FG	On-Demand	Anodyne	TIMP3	41	31
C[C@@H](c1cccc(F)c1)N1CCN(CCC[C@@H](C)O)CC1	ZINC000450607265	CF	On-Demand	Anodyne	SLC6A3	22	47
C[C@@H](c1cccc(F)c1)N1CCN(CCC[C@@H](C)O)CC1	ZINC000450607265	CF	On-Demand	Anodyne	MC4R	61	44
C[C@H](O)CCCN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450607266	CF	On-Demand	Anodyne	SLC6A3	22	47
C[C@H](O)CCCN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450607266	CF	On-Demand	Anodyne	MC4R	61	44
C[C@@H](O)CCCN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450607267	CF	On-Demand	Anodyne	SLC6A3	22	47
C[C@@H](O)CCCN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450607267	CF	On-Demand	Anodyne	MC4R	61	44
C[C@H](O)CCCN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450607268	CF	On-Demand	Anodyne	SLC6A3	22	47
C[C@H](O)CCCN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450607268	CF	On-Demand	Anodyne	MC4R	61	44
CN1C[C@H](NC(=O)Cc2cccc(OCc3cccnc3)c2)C(=O)N1	ZINC000450607269	EC	On-Demand	Anodyne	UPP1	41	32
CN1C[C@@H](NC(=O)Cc2cccc(OCc3cccnc3)c2)C(=O)N1	ZINC000450607270	EC	On-Demand	Anodyne	UPP1	41	32
COCCC(C)(C)CNC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450607278	EG	On-Demand	Anodyne	GRIN2B	0	41
COc1ccccc1C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000450607290	GH	On-Demand	Bother	CACNA1C	40	33
COc1ccccc1C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000450607290	GH	On-Demand	Bother	CACNA1D	67	33
COc1ccccc1C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000450607290	GH	On-Demand	Bother	NMBR	43	34
COc1ccccc1C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000450607290	GH	On-Demand	Bother	MTNR1A	17	40
COc1ccccc1C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000450607290	GH	On-Demand	Bother	GRPR	20	42
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	CHRM2	15	41
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	DRD2	25	47
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	ACHE	64	57
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	HTR2A	16	42
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	HRH1	16	41
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	HTR4	61	36
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	HRH3	62	55
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	SIGMAR1	72	47
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	NPY1R	42	35
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	BCHE	0	47
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	CCR3	52	48
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	CCR5	23	41
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	MCHR1	38	40
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	CACNA1G	40	38
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	CACNA1I	58	41
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	CYP2J2	54	39
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	L3MBTL3	26	46
CC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450607300	EH	On-Demand	Anodyne	MBTD1	0	46
COCCC(C)(C)CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450607306	FF	On-Demand	Anodyne	CACNA1I	37	41
CC(C)(CS(C)(=O)=O)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450607325	FD	On-Demand	Bother	CACNA1D	41	31
COc1ccccc1C1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCC1	ZINC000450607330	GI	On-Demand	Anodyne	KCNA3	51	41
COc1ccccc1C1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCC1	ZINC000450607330	GI	On-Demand	Anodyne	ACAT	0	50
COc1ccccc1C1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCC1	ZINC000450607330	GI	On-Demand	Anodyne	HCN1	75	41
COc1ccccc1C1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCC1	ZINC000450607330	GI	On-Demand	Anodyne	HCN4	53	41
COc1cc2c(N3CC[C@@H](F)C3)ncnc2cc1F	ZINC000450607332	CE	On-Demand	Anodyne	PDE3A	73	55
COc1cc2c(N3CC[C@@H](F)C3)ncnc2cc1F	ZINC000450607332	CE	On-Demand	Anodyne	PDGFRB	71	43
COc1cc2c(N3CC[C@@H](F)C3)ncnc2cc1F	ZINC000450607332	CE	On-Demand	Anodyne	FGFR1	0	41
COc1cc2c(N3CC[C@@H](F)C3)ncnc2cc1F	ZINC000450607332	CE	On-Demand	Anodyne	FLT1	22	41
COc1cc2c(N3CC[C@@H](F)C3)ncnc2cc1F	ZINC000450607332	CE	On-Demand	Anodyne	PDE3B	107	55
COc1cc2c(N3CC[C@H](F)C3)ncnc2cc1F	ZINC000450607333	CE	On-Demand	Anodyne	PDE3A	73	55
COc1cc2c(N3CC[C@H](F)C3)ncnc2cc1F	ZINC000450607333	CE	On-Demand	Anodyne	PDGFRB	71	43
COc1cc2c(N3CC[C@H](F)C3)ncnc2cc1F	ZINC000450607333	CE	On-Demand	Anodyne	FGFR1	0	41
COc1cc2c(N3CC[C@H](F)C3)ncnc2cc1F	ZINC000450607333	CE	On-Demand	Anodyne	FLT1	22	41
COc1cc2c(N3CC[C@H](F)C3)ncnc2cc1F	ZINC000450607333	CE	On-Demand	Anodyne	PDE3B	107	55
COCCC(C)(C)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450607352	FH	On-Demand	Anodyne	AVPR1B	42	44
COCCC(C)(C)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450607352	FH	On-Demand	Anodyne	PDE6D	79	46
COCCC(C)(C)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450607352	FH	On-Demand	Anodyne	HDAC8	30	44
COCCC(C)(C)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450607352	FH	On-Demand	Anodyne	HDAC6	24	44
COCCC(C)(C)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450607352	FH	On-Demand	Anodyne	PLM2_PLAFA	0	40
COCCC(C)(C)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450607352	FH	On-Demand	Anodyne	IMDH_CRYPV	37	56
CN(C)CC1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCCC1	ZINC000450607358	FF	On-Demand	Anodyne	HCN1	55	34
CN1C[C@H](NC(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607360	FD	On-Demand	Anodyne	LTA4H	28	40
CN1C[C@H](NC(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607360	FD	On-Demand	Anodyne	ADAM17	35	40
CN1C[C@H](NC(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607360	FD	On-Demand	Anodyne	GPR88	0	41
CN1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607362	FD	On-Demand	Anodyne	LTA4H	28	40
CN1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607362	FD	On-Demand	Anodyne	ADAM17	35	40
CN1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607362	FD	On-Demand	Anodyne	GPR88	0	41
CN1C[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607363	FD	On-Demand	Anodyne	LTA4H	28	40
CN1C[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607363	FD	On-Demand	Anodyne	ADAM17	35	40
CN1C[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607363	FD	On-Demand	Anodyne	GPR88	0	41
CN1C[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607364	FD	On-Demand	Anodyne	LTA4H	28	40
CN1C[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607364	FD	On-Demand	Anodyne	ADAM17	35	40
CN1C[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450607364	FD	On-Demand	Anodyne	GPR88	0	41
Cc1ccc(-c2nnc(SCc3cc(C(C)(C)C)on3)o2)cc1C	ZINC000450607370	EJ	On-Demand	Anodyne	GSK3A	51	39
Cc1ccc(-c2nnc(SCc3cc(C(C)(C)C)on3)o2)cc1C	ZINC000450607370	EJ	On-Demand	Anodyne	TERT	26	45
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	HTR1A	94	46
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	DRD2	58	44
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	DRD4	33	40
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	HTR2A	60	46
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	ADRA1A	30	45
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	DRD3	53	46
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	DRD5	26	44
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	HTR7	109	47
CN1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607378	EC	On-Demand	Anodyne	CYP2J2	46	32
CN(C)CC1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCC1	ZINC000450607383	FF	On-Demand	Bother	CACNA1D	40	32
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	HTR1A	94	46
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	DRD2	58	44
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	DRD4	33	40
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	HTR2A	60	46
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	ADRA1A	30	45
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	DRD3	53	46
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	DRD5	26	44
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	HTR7	109	47
CN1C[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450607390	EC	On-Demand	Anodyne	CYP2J2	46	32
CN1C[C@@H](NC(=O)CCCc2csc3ccccc23)C(=O)N1	ZINC000450607398	DD	On-Demand	Anodyne	FFAR2	53	32
CN1C[C@H](NC(=O)CCCc2csc3ccccc23)C(=O)N1	ZINC000450607400	DD	On-Demand	Anodyne	FFAR2	53	32
CN1C[C@H](NC(=O)CC(Cc2ccccc2)Cc2ccccc2)C(=O)N1	ZINC000450607402	FD	On-Demand	Anodyne	ACE	50	36
CN1C[C@H](NC(=O)CC(Cc2ccccc2)Cc2ccccc2)C(=O)N1	ZINC000450607402	FD	On-Demand	Anodyne	MME	65	36
CN1C[C@@H](NC(=O)CC(Cc2ccccc2)Cc2ccccc2)C(=O)N1	ZINC000450607405	FD	On-Demand	Anodyne	ACE	50	36
CN1C[C@@H](NC(=O)CC(Cc2ccccc2)Cc2ccccc2)C(=O)N1	ZINC000450607405	FD	On-Demand	Anodyne	MME	65	36
COc1ccc(-c2nnn(Cc3nnc(C4CC4)s3)n2)cc1OC	ZINC000450607406	EE	On-Demand	Anodyne	SCARB1	25	43
CN1C[C@H](NC(=O)Cc2ccc(Br)c(F)c2)C(=O)N1	ZINC000450607418	EC	On-Demand	Anodyne	LUXR	44	37
CN1C[C@@H](NC(=O)Cc2ccc(Br)c(F)c2)C(=O)N1	ZINC000450607421	EC	On-Demand	Anodyne	LUXR	44	37
CCSc1ccc(CC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450607424	CC	On-Demand	Anodyne	LUXR	43	40
CCSc1ccc(CC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450607425	CC	On-Demand	Anodyne	LUXR	43	40
FC1(F)CC(CN2CC[C@@H](Oc3ccccc3Cl)C2)C1	ZINC000450607427	DH	On-Demand	Anodyne	SCD1	26	40
FC1(F)CC(CN2CC[C@H](Oc3ccccc3Cl)C2)C1	ZINC000450607428	DH	On-Demand	Anodyne	SCD1	26	40
COc1ccc(SCCC(=O)N[C@@H]2CN(C)NC2=O)cc1OC	ZINC000450607430	EC	On-Demand	Anodyne	ENPP1	53	32
COc1ccc(SCCC(=O)N[C@H]2CN(C)NC2=O)cc1OC	ZINC000450607432	EC	On-Demand	Anodyne	ENPP1	53	32
COc1ccc(-c2nnn(C[C@@H]3COCCO3)n2)cc1OC	ZINC000450607458	DC	On-Demand	Anodyne	SCARB1	21	40
COc1ccc(-c2nnn(C[C@H]3COCCO3)n2)cc1OC	ZINC000450607459	DC	On-Demand	Anodyne	SCARB1	21	40
COc1ccc(-c2nnn(CCC[C@H](C)O)n2)cc1OC	ZINC000450607474	CD	On-Demand	Anodyne	SCARB1	35	45
COc1ccc(-c2nnn(CCC[C@@H](C)O)n2)cc1OC	ZINC000450607475	CD	On-Demand	Anodyne	SCARB1	35	45
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	MAOB	19	48
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	CA7	16	49
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	MMP13	15	55
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	ADAM17	15	48
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	PPARD	42	47
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	MMP2	16	43
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	MMP14	26	40
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	SLC6A5	33	41
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	MMP9	15	43
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	PSEN1	30	40
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	ADAMTS4	49	41
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	FFAR1	17	51
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000450607477	EI	On-Demand	Anodyne	RORC	26	47
CCCC[C@@H](NC(=O)c1cc2c([nH]1)CCCC2)C(=O)OC	ZINC000450607482	CE	On-Demand	Anodyne	CCKAR	0	45
CCCC[C@@H](NC(=O)c1cc2c([nH]1)CCCC2)C(=O)OC	ZINC000450607482	CE	On-Demand	Anodyne	NOD1	45	31
CCCC[C@H](NC(=O)c1cc2c([nH]1)CCCC2)C(=O)OC	ZINC000450607483	CE	On-Demand	Anodyne	CCKAR	0	45
CCCC[C@H](NC(=O)c1cc2c([nH]1)CCCC2)C(=O)OC	ZINC000450607483	CE	On-Demand	Anodyne	NOD1	45	31
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@@H]1CCCCO1	ZINC000450607504	GI	On-Demand	Anodyne	AVPR1B	54	43
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@@H]1CCCCO1	ZINC000450607504	GI	On-Demand	Anodyne	BCHE	46	35
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@@H]1CCCCO1	ZINC000450607504	GI	On-Demand	Anodyne	PDE6D	90	39
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@@H]1CCCCO1	ZINC000450607504	GI	On-Demand	Anodyne	NS5B	0	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@@H]1CCCCO1	ZINC000450607504	GI	On-Demand	Anodyne	IMDH_CRYPV	33	49
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@H]1CCCCO1	ZINC000450607505	GI	On-Demand	Anodyne	AVPR1B	54	43
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@H]1CCCCO1	ZINC000450607505	GI	On-Demand	Anodyne	BCHE	46	35
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@H]1CCCCO1	ZINC000450607505	GI	On-Demand	Anodyne	PDE6D	90	39
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@H]1CCCCO1	ZINC000450607505	GI	On-Demand	Anodyne	NS5B	0	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCCC[C@H]1CCCCO1	ZINC000450607505	GI	On-Demand	Anodyne	IMDH_CRYPV	33	49
COc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1OC(C)C	ZINC000450607514	EG	On-Demand	Anodyne	COLA	47	37
COc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1OC(C)C	ZINC000450607514	EG	On-Demand	Anodyne	CPT1A	40	35
COc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1OC(C)C	ZINC000450607514	EG	On-Demand	Anodyne	CPT2	41	35
COc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1OC(C)C	ZINC000450607514	EG	On-Demand	Anodyne	ENPP1	55	33
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450607529	DB	On-Demand	Anodyne	UTS2	43	34
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450607530	DB	On-Demand	Anodyne	UTS2	43	34
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450607531	DB	On-Demand	Anodyne	UTS2	43	34
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450607532	DB	On-Demand	Anodyne	UTS2	43	34
CCC(=O)CCCN1C[C@@H](C#N)[C@]2(C1)C(=O)Nc1ccccc12	ZINC000450607533	DE	On-Demand	Mild	HTR7	21	40
CCC(=O)CCCN1C[C@@H](C#N)[C@@]2(C1)C(=O)Nc1ccccc12	ZINC000450607534	DE	On-Demand	Mild	HTR7	21	40
CCC(=O)CCCN1C[C@H](C#N)[C@@]2(C1)C(=O)Nc1ccccc12	ZINC000450607535	DE	On-Demand	Mild	HTR7	21	40
CCC(=O)CCCN1C[C@H](C#N)[C@]2(C1)C(=O)Nc1ccccc12	ZINC000450607536	DE	On-Demand	Mild	HTR7	21	40
COc1ccc([N+](=O)[O-])cc1OCCC(C)(F)F	ZINC000450607553	CG	On-Demand	Bother	CYP19A1	15	41
COc1ccc([N+](=O)[O-])cc1OCCC(C)(F)F	ZINC000450607553	CG	On-Demand	Bother	S1PR4	18	43
COc1ccc(OC(F)(F)F)c(C(=O)NCCC[C@H]2CCCCO2)c1	ZINC000450607558	FH	On-Demand	Anodyne	NQO2	29	43
COc1ccc(OC(F)(F)F)c(C(=O)NCCC[C@@H]2CCCCO2)c1	ZINC000450607559	FH	On-Demand	Anodyne	NQO2	29	43
COc1ccc(NC(=O)[C@@]2(C#N)C[C@H]2C)cc1OC(C)C	ZINC000450607567	CF	On-Demand	Mild	ENPP1	58	34
COc1ccc(NC(=O)[C@]2(C#N)C[C@H]2C)cc1OC(C)C	ZINC000450607568	CF	On-Demand	Mild	ENPP1	58	34
COc1ccc(NC(=O)[C@@]2(C#N)C[C@@H]2C)cc1OC(C)C	ZINC000450607569	CF	On-Demand	Mild	ENPP1	58	34
COc1ccc(NC(=O)[C@]2(C#N)C[C@@H]2C)cc1OC(C)C	ZINC000450607570	CF	On-Demand	Mild	ENPP1	58	34
COc1ccc(CNC(=O)CCN2CCOC[C@@H](C)C2)c(OC)c1	ZINC000450607575	ED	On-Demand	Anodyne	MTNR1A	41	37
COc1ccc(CNC(=O)CCN2CCOC[C@H](C)C2)c(OC)c1	ZINC000450607576	ED	On-Demand	Anodyne	MTNR1A	41	37
CN1C[C@H](NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	ZINC000450607581	FB	On-Demand	Anodyne	EPHX2	21	47
CN1C[C@H](NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	ZINC000450607581	FB	On-Demand	Anodyne	TGM2	41	41
CN1C[C@H](NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	ZINC000450607581	FB	On-Demand	Anodyne	NAMPT	30	41
CN1C[C@@H](NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	ZINC000450607582	FB	On-Demand	Anodyne	EPHX2	21	47
CN1C[C@@H](NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	ZINC000450607582	FB	On-Demand	Anodyne	TGM2	41	41
CN1C[C@@H](NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)C(=O)N1	ZINC000450607582	FB	On-Demand	Anodyne	NAMPT	30	41
CCOCCO[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450607589	GH	On-Demand	Anodyne	CYP2J2	58	41
CN(C)CC1(CNC(=O)c2ccc3cnccc3c2)CCCC1	ZINC000450607590	DG	On-Demand	Anodyne	AKT1	17	41
COc1ccccc1C1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCC1	ZINC000450607591	GH	On-Demand	Anodyne	KCNA3	49	42
COc1ccccc1C1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCC1	ZINC000450607591	GH	On-Demand	Anodyne	PDE4D	15	41
COc1ccccc1C1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCC1	ZINC000450607591	GH	On-Demand	Anodyne	PDEC	0	43
COc1ccccc1C1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCC1	ZINC000450607592	GH	On-Demand	Anodyne	KCNA3	49	42
COc1ccccc1C1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCC1	ZINC000450607592	GH	On-Demand	Anodyne	PDE4D	15	41
COc1ccccc1C1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCC1	ZINC000450607592	GH	On-Demand	Anodyne	PDEC	0	43
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1Cc1ccc(C(C)=O)cc1	ZINC000450607593	ED	On-Demand	Anodyne	LTA4H	22	40
COC(=O)[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)[C@@H]1C(=O)OC	ZINC000450607594	ED	On-Demand	Anodyne	LTA4H	22	40
COC(=O)[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)[C@H]1C(=O)OC	ZINC000450607595	ED	On-Demand	Anodyne	LTA4H	22	40
COC(=O)[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)[C@H]1C(=O)OC	ZINC000450607596	ED	On-Demand	Anodyne	LTA4H	22	40
CCCNC(=O)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450607597	CD	On-Demand	Anodyne	HDAC1	24	42
CCCNC(=O)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450607597	CD	On-Demand	Anodyne	PLD2	42	33
CCCNC(=O)c1ccc(N2CC[C@@H](F)C2)nc1	ZINC000450607597	CD	On-Demand	Anodyne	SCD1	21	46
CCCNC(=O)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450607598	CD	On-Demand	Anodyne	HDAC1	24	42
CCCNC(=O)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450607598	CD	On-Demand	Anodyne	PLD2	42	33
CCCNC(=O)c1ccc(N2CC[C@H](F)C2)nc1	ZINC000450607598	CD	On-Demand	Anodyne	SCD1	21	46
COC(=O)[C@H]1CCCN(CCN(C)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450607599	ED	On-Demand	Anodyne	ACHE	0	41
COC(=O)[C@H]1CCCN(CCN(C)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450607599	ED	On-Demand	Anodyne	PREP	44	37
COC(=O)[C@H]1CCCN(CCN(C)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450607599	ED	On-Demand	Anodyne	ACKR3	64	33
COC(=O)[C@@H]1CCCN(CCN(C)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450607600	ED	On-Demand	Anodyne	ACHE	0	41
COC(=O)[C@@H]1CCCN(CCN(C)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450607600	ED	On-Demand	Anodyne	PREP	44	37
COC(=O)[C@@H]1CCCN(CCN(C)Cc2ccccc2)[C@H]1C(=O)OC	ZINC000450607600	ED	On-Demand	Anodyne	ACKR3	64	33
COC(=O)[C@H]1CCCN(CCN(C)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450607601	ED	On-Demand	Anodyne	ACHE	0	41
COC(=O)[C@H]1CCCN(CCN(C)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450607601	ED	On-Demand	Anodyne	PREP	44	37
COC(=O)[C@H]1CCCN(CCN(C)Cc2ccccc2)[C@@H]1C(=O)OC	ZINC000450607601	ED	On-Demand	Anodyne	ACKR3	64	33
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCN(C)Cc1ccccc1	ZINC000450607602	ED	On-Demand	Anodyne	ACHE	0	41
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCN(C)Cc1ccccc1	ZINC000450607602	ED	On-Demand	Anodyne	PREP	44	37
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCN(C)Cc1ccccc1	ZINC000450607602	ED	On-Demand	Anodyne	ACKR3	64	33
C=CC(C)(C)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450607604	CG	On-Demand	Mild	KCNA3	42	40
C=CC(C)(C)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450607604	CG	On-Demand	Mild	NMBR	48	34
C=CC(C)(C)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450607604	CG	On-Demand	Mild	GRPR	21	44
COc1ccccc1C1(CNC(=O)c2cncc(Cl)c2)CCC1	ZINC000450607626	EH	On-Demand	Anodyne	DRD3	22	43
COc1ccccc1C1(CNC(=O)c2cncc(Cl)c2)CCC1	ZINC000450607626	EH	On-Demand	Anodyne	KCNA3	51	41
COc1ccccc1C1(CNC(=O)c2cncc(Cl)c2)CCC1	ZINC000450607626	EH	On-Demand	Anodyne	SCN2A	18	40
COc1ccccc1C1(CNC(=O)c2cncc(Cl)c2)CCC1	ZINC000450607626	EH	On-Demand	Anodyne	SCN10A	50	42
COc1ccccc1C1(CNC(=O)c2cncc(Cl)c2)CCC1	ZINC000450607626	EH	On-Demand	Anodyne	ACAT	0	48
COc1ccccc1C1(CNC(=O)c2cncc(Cl)c2)CCC1	ZINC000450607626	EH	On-Demand	Anodyne	HCN1	44	36
COc1ccc(CC(=O)N2CCN(c3ncc(F)cn3)CC2)c(Cl)c1OC	ZINC000450607627	GE	On-Demand	Anodyne	CCR1	43	38
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450607630	DD	On-Demand	Anodyne	SFRP1	45	33
CC(C)(CS(C)(=O)=O)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450607631	DD	On-Demand	Anodyne	SFRP1	45	33
CC(C)Oc1ccc2nccc(N3CC[C@@H](F)C3)c2c1	ZINC000450607634	CH	On-Demand	Anodyne	PDE3B	48	32
CC(C)Oc1ccc2nccc(N3CC[C@H](F)C3)c2c1	ZINC000450607635	CH	On-Demand	Anodyne	PDE3B	48	32
COc1ccccc1C1(CNC(=O)c2cc(C#N)[nH]c2C)CCC1	ZINC000450607651	DG	On-Demand	Mild	KCNA3	47	45
COc1ccccc1C1(CNC(=O)c2cc(C#N)[nH]c2C)CCC1	ZINC000450607651	DG	On-Demand	Mild	HCN1	65	41
COc1ccccc1C1(CNC(=O)c2cc(C#N)[nH]c2C)CCC1	ZINC000450607651	DG	On-Demand	Mild	HCN4	54	39
COc1ccccc1C1(CNC(=O)c2cc(C#N)[nH]c2C)CCC1	ZINC000450607651	DG	On-Demand	Mild	EZH2	44	34
O=C(Cc1ccc(O)c(F)c1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450607656	ED	On-Demand	Anodyne	ECE2	0	42
CCCC[C@@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)C(=O)OC	ZINC000450607679	EF	On-Demand	Anodyne	PCSK5	40	31
CCCC[C@@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)C(=O)OC	ZINC000450607679	EF	On-Demand	Anodyne	NOD1	44	31
CCCC[C@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)C(=O)OC	ZINC000450607680	EF	On-Demand	Anodyne	PCSK5	40	31
CCCC[C@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)C(=O)OC	ZINC000450607680	EF	On-Demand	Anodyne	NOD1	44	31
CC(C)[C@H](CC(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450607681	CD	On-Demand	Anodyne	BIRC8	41	31
CC(C)[C@@H](CC(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450607683	CD	On-Demand	Anodyne	BIRC8	41	31
CC(C)[C@H](CC(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450607685	CD	On-Demand	Anodyne	BIRC8	41	31
O=C1CCC(CN2CCN(C3c4ccccc4-c4ccccc43)CC2)CC1	ZINC000450607687	FI	On-Demand	Anodyne	INHA	23	41
CC(C)[C@@H](CC(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450607688	CD	On-Demand	Anodyne	BIRC8	41	31
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C)c(C)c3)o2)nc1	ZINC000450607689	FI	On-Demand	Anodyne	GSK3B	17	47
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C)c(C)c3)o2)nc1	ZINC000450607689	FI	On-Demand	Anodyne	GSK3A	50	47
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C)c(C)c3)o2)nc1	ZINC000450607689	FI	On-Demand	Anodyne	ALOX15	60	43
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C)c(C)c3)o2)nc1	ZINC000450607689	FI	On-Demand	Anodyne	TERT	24	40
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607702	FE	On-Demand	Anodyne	ACHE	31	42
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607702	FE	On-Demand	Anodyne	OPRM1	15	49
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607702	FE	On-Demand	Anodyne	OPRD1	23	50
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607702	FE	On-Demand	Anodyne	SIGMAR1	28	42
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607702	FE	On-Demand	Anodyne	SSTR5	40	36
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607702	FE	On-Demand	Anodyne	CCR5	43	42
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607702	FE	On-Demand	Anodyne	MLNR	42	35
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607702	FE	On-Demand	Anodyne	NPFFR1	43	33
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607705	FE	On-Demand	Anodyne	ACHE	31	42
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607705	FE	On-Demand	Anodyne	OPRM1	15	49
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607705	FE	On-Demand	Anodyne	OPRD1	23	50
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607705	FE	On-Demand	Anodyne	SIGMAR1	28	42
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607705	FE	On-Demand	Anodyne	SSTR5	40	36
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607705	FE	On-Demand	Anodyne	CCR5	43	42
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607705	FE	On-Demand	Anodyne	MLNR	42	35
CCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607705	FE	On-Demand	Anodyne	NPFFR1	43	33
CN1C[C@@H](NC(=O)CCCCCc2cccs2)C(=O)N1	ZINC000450607739	CD	On-Demand	Anodyne	LUXR	41	35
CN1C[C@H](NC(=O)CCCCCc2cccs2)C(=O)N1	ZINC000450607740	CD	On-Demand	Anodyne	LUXR	41	35
COc1ccccc1C1(CNC(=O)c2cccc(C#N)c2Br)CCC1	ZINC000450607747	GI	On-Demand	Mild	KCNA3	55	46
COc1ccccc1C1(CNC(=O)c2cccc(C#N)c2Br)CCC1	ZINC000450607747	GI	On-Demand	Mild	ACAT	0	49
COc1ccccc1C1(CNC(=O)c2cccc(C#N)c2Br)CCC1	ZINC000450607747	GI	On-Demand	Mild	HCN1	77	41
COc1ccccc1C1(CNC(=O)c2cccc(C#N)c2Br)CCC1	ZINC000450607747	GI	On-Demand	Mild	HCN4	54	39
COc1ccccc1C1(CNC(=O)c2cccc(C#N)c2Br)CCC1	ZINC000450607747	GI	On-Demand	Mild	EZH2	45	36
CCc1nc2ccccc2c(C(=O)N[C@H]2CN(C)NC2=O)c1C	ZINC000450607756	DD	On-Demand	Anodyne	TACR3	54	37
CCc1nc2ccccc2c(C(=O)N[C@@H]2CN(C)NC2=O)c1C	ZINC000450607758	DD	On-Demand	Anodyne	TACR3	54	37
COC(=O)c1coc(CSc2nc3ccccc3c(=O)n2CCC(C)C)n1	ZINC000450607759	GH	On-Demand	Anodyne	PTGDR2	15	40
Cn1ccc(CCNC(=O)c2cccc(C(F)(F)F)n2)n1	ZINC000450607761	CD	On-Demand	Anodyne	CARM1	49	32
COc1cc(Br)c(C(=O)N2CCn3c(O)nnc3C2)cc1OC	ZINC000450607777	GD	On-Demand	Anodyne	P2RX7	32	40
CN1C[C@H](NC(=O)[C@H]2C[C@H]2c2cccc(Br)c2)C(=O)N1	ZINC000450607780	ED	On-Demand	Anodyne	F2RL1	19	41
CN1C[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)C(=O)N1	ZINC000450607786	ED	On-Demand	Anodyne	F2RL1	19	41
CN1C[C@H](NC(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)C(=O)N1	ZINC000450607787	ED	On-Demand	Anodyne	F2RL1	19	41
CN1C[C@H](NC(=O)[C@H]2C[C@@H]2c2cccc(Br)c2)C(=O)N1	ZINC000450607788	ED	On-Demand	Anodyne	F2RL1	19	41
CO[C@H](CSc1nc2ccccc2c(=O)n1CCCO)Cc1ccccc1	ZINC000450607796	GG	On-Demand	Anodyne	SLC16A1	46	33
CO[C@@H](CSc1nc2ccccc2c(=O)n1CCCO)Cc1ccccc1	ZINC000450607798	GG	On-Demand	Anodyne	SLC16A1	46	33
c1ccc(CCC[C@H]2CCCCN2C[C@H]2COCCO2)cc1	ZINC000450607799	DG	On-Demand	Anodyne	SLC18A2	42	46
c1ccc(CCC[C@@H]2CCCCN2C[C@H]2COCCO2)cc1	ZINC000450607801	DG	On-Demand	Anodyne	SLC18A2	42	46
c1ccc(CCC[C@@H]2CCCCN2C[C@@H]2COCCO2)cc1	ZINC000450607803	DG	On-Demand	Anodyne	SLC18A2	42	46
c1ccc(CCC[C@H]2CCCCN2C[C@@H]2COCCO2)cc1	ZINC000450607806	DG	On-Demand	Anodyne	SLC18A2	42	46
C[C@@H](CSc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450607816	CC	On-Demand	Anodyne	BIRC8	42	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn3nccc3nc2C)cc1	ZINC000450607818	FF	On-Demand	Anodyne	DDR1	47	39
C[C@@H](CSc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450607819	CC	On-Demand	Anodyne	BIRC8	42	32
C[C@H](CSc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450607820	CC	On-Demand	Anodyne	BIRC8	42	32
C[C@H](CSc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450607821	CC	On-Demand	Anodyne	BIRC8	42	32
COc1cc(OCC(=O)N[C@@H]2CN(C)NC2=O)ccc1[N+](=O)[O-]	ZINC000450607822	DB	On-Demand	Bother	TRAR	34	41
COc1cc(OCC(=O)N[C@H]2CN(C)NC2=O)ccc1[N+](=O)[O-]	ZINC000450607829	DB	On-Demand	Bother	TRAR	34	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn3nccc3nc2C)cc1	ZINC000450607831	FF	On-Demand	Anodyne	DDR1	47	39
C[C@H](CN1CC[C@H](Oc2ccccc2Cl)C1)S(C)(=O)=O	ZINC000450607848	DE	On-Demand	Anodyne	PDE3B	26	42
C[C@@H](CN1CC[C@@H](Oc2ccccc2Cl)C1)S(C)(=O)=O	ZINC000450607850	DE	On-Demand	Anodyne	PDE3B	26	42
C[C@@H](CN1CC[C@H](Oc2ccccc2Cl)C1)S(C)(=O)=O	ZINC000450607852	DE	On-Demand	Anodyne	PDE3B	26	42
C[C@H](CN1CC[C@@H](Oc2ccccc2Cl)C1)S(C)(=O)=O	ZINC000450607854	DE	On-Demand	Anodyne	PDE3B	26	42
O=C(NCCCN1CCCCC1)C1CCN(CCc2cscn2)CC1	ZINC000450607861	FE	On-Demand	Anodyne	HRH3	15	43
O=C(NCCCN1CCCCC1)C1CCN(CCc2cscn2)CC1	ZINC000450607861	FE	On-Demand	Anodyne	HNMT	54	31
O=C(NCCCN1CCCCC1)C1CCN(CCc2cscn2)CC1	ZINC000450607861	FE	On-Demand	Anodyne	GNAI1	0	40
O=C(NCCCN1CCCCC1)C1CCN(CCc2cscn2)CC1	ZINC000450607861	FE	On-Demand	Anodyne	GNAI3	0	40
O=C(NCCCN1CCCCC1)C1CCN(CCc2cscn2)CC1	ZINC000450607861	FE	On-Demand	Anodyne	GNAO1	0	40
O=C(NCCCN1CCCCC1)C1CCN(CCc2cscn2)CC1	ZINC000450607861	FE	On-Demand	Anodyne	TBK1	65	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2CC(C)(O)C2)cc1	ZINC000450607873	DE	On-Demand	Anodyne	TIMP3	42	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2CC(C)(O)C2)cc1	ZINC000450607874	DE	On-Demand	Anodyne	TIMP3	42	32
CC(F)(F)CCSc1nc2ccccc2c(=O)n1CCCO	ZINC000450607882	EF	On-Demand	Anodyne	SLC16A1	47	34
COc1ccc(-c2nnn(C[C@@H](C)S(C)(=O)=O)n2)cc1OC	ZINC000450607884	EC	On-Demand	Anodyne	SCARB1	46	47
COc1ccc(-c2nnn(C[C@H](C)S(C)(=O)=O)n2)cc1OC	ZINC000450607887	EC	On-Demand	Anodyne	SCARB1	46	47
COc1ccc(CNC(=O)CCN(C)CCc2nccs2)c(OC)c1	ZINC000450607889	FE	On-Demand	Anodyne	MTNR1A	42	40
COc1ccc(CNC(=O)CCN(C)CCc2nccs2)c(OC)c1	ZINC000450607889	FE	On-Demand	Anodyne	MTNR1B	31	40
COCCc1ccc(OCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450607900	EC	On-Demand	Anodyne	TRAR	46	33
COCCc1ccc(OCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450607900	EC	On-Demand	Anodyne	CVIR	0	44
COCCc1ccc(OCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450607914	EC	On-Demand	Anodyne	TRAR	46	33
COCCc1ccc(OCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450607914	EC	On-Demand	Anodyne	CVIR	0	44
CCN(CCC1CC1)C(=O)c1cc2cccnc2s1	ZINC000450607922	CH	On-Demand	Anodyne	SIRT3	41	31
CCN(CCC1CC1)C(=O)c1cc2cccnc2s1	ZINC000450607922	CH	On-Demand	Anodyne	SIRT1	40	31
COC(=O)Cc1ccc(NC[C@H](Cc2ccccc2)OC)c([N+](=O)[O-])c1	ZINC000450607932	FF	On-Demand	Bother	BDKRB1	22	41
COC(=O)Cc1ccc(NC[C@H](Cc2ccccc2)OC)c([N+](=O)[O-])c1	ZINC000450607932	FF	On-Demand	Bother	BLA1_STEMA	17	47
CN1C[C@H](NC(=O)Cc2cc(Cl)ccc2Br)C(=O)N1	ZINC000450607933	ED	On-Demand	Anodyne	P2RX7	47	40
COC(=O)Cc1ccc(NC[C@@H](Cc2ccccc2)OC)c([N+](=O)[O-])c1	ZINC000450607935	FF	On-Demand	Bother	BDKRB1	22	41
COC(=O)Cc1ccc(NC[C@@H](Cc2ccccc2)OC)c([N+](=O)[O-])c1	ZINC000450607935	FF	On-Demand	Bother	BLA1_STEMA	17	47
CN1C[C@@H](NC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)C(=O)N1	ZINC000450607937	FA	On-Demand	Bother	SLC27A4	48	31
CN1C[C@@H](NC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)C(=O)N1	ZINC000450607937	FA	On-Demand	Bother	LUXR	17	42
CN1C[C@@H](NC(=O)Cc2cc(Cl)ccc2Br)C(=O)N1	ZINC000450607939	ED	On-Demand	Anodyne	P2RX7	47	40
CN1C[C@H](NC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)C(=O)N1	ZINC000450607950	FA	On-Demand	Bother	SLC27A4	48	31
CN1C[C@H](NC(=O)CNC(=O)NCc2ccc([N+](=O)[O-])cc2)C(=O)N1	ZINC000450607950	FA	On-Demand	Bother	LUXR	17	42
COc1cc(OC)cc(-c2nnc(SCc3nnc(C4CC4)s3)o2)c1	ZINC000450607964	GH	On-Demand	Anodyne	GSK3B	0	42
COc1cc(OC)cc(-c2nnc(SCc3nnc(C4CC4)s3)o2)c1	ZINC000450607964	GH	On-Demand	Anodyne	GSK3A	38	42
Clc1ccccc1O[C@@H]1CCN(Cc2nnc(C3CC3)s2)C1	ZINC000450607978	EH	On-Demand	Anodyne	SCD1	24	42
Clc1ccccc1O[C@H]1CCN(Cc2nnc(C3CC3)s2)C1	ZINC000450607979	EH	On-Demand	Anodyne	SCD1	24	42
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)CCCC3)C(=O)N1	ZINC000450607980	ED	On-Demand	Anodyne	P2RY12	31	44
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)CCCC3)C(=O)N1	ZINC000450607980	ED	On-Demand	Anodyne	CVIR	0	40
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)CCCC3)C(=O)N1	ZINC000450607981	ED	On-Demand	Anodyne	P2RY12	31	44
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)CCCC3)C(=O)N1	ZINC000450607981	ED	On-Demand	Anodyne	CVIR	0	40
CCN(C(=O)c1ccsc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607982	EH	On-Demand	Anodyne	CHRM2	15	44
CCN(C(=O)c1ccsc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607982	EH	On-Demand	Anodyne	DRD2	15	43
CCN(C(=O)c1ccsc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607982	EH	On-Demand	Anodyne	DRD4	45	43
CCN(C(=O)c1ccsc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607982	EH	On-Demand	Anodyne	ACHE	33	45
CCN(C(=O)c1ccsc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607982	EH	On-Demand	Anodyne	SIGMAR1	47	46
CCN(C(=O)c1ccsc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450607982	EH	On-Demand	Anodyne	CCR5	51	45
CCN(C(=O)c1ccsc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607983	EH	On-Demand	Anodyne	CHRM2	15	44
CCN(C(=O)c1ccsc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607983	EH	On-Demand	Anodyne	DRD2	15	43
CCN(C(=O)c1ccsc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607983	EH	On-Demand	Anodyne	DRD4	45	43
CCN(C(=O)c1ccsc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607983	EH	On-Demand	Anodyne	ACHE	33	45
CCN(C(=O)c1ccsc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607983	EH	On-Demand	Anodyne	SIGMAR1	47	46
CCN(C(=O)c1ccsc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450607983	EH	On-Demand	Anodyne	CCR5	51	45
Cc1noc(C)c1COc1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450608034	EC	On-Demand	Anodyne	NR1H4	40	37
Cc1noc(C)c1COc1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450608035	EC	On-Demand	Anodyne	NR1H4	40	37
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450608040	DH	On-Demand	Anodyne	NCE103	22	40
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450608041	DH	On-Demand	Anodyne	NCE103	22	40
Clc1ccccc1OC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450608045	DH	On-Demand	Anodyne	SCD1	22	41
Clc1ccccc1OC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450608046	DH	On-Demand	Anodyne	SCD1	22	41
COc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1OC(C)C	ZINC000450608047	GH	On-Demand	Anodyne	TSHR	57	35
COc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1OC(C)C	ZINC000450608047	GH	On-Demand	Anodyne	CPT1A	47	33
COc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1OC(C)C	ZINC000450608047	GH	On-Demand	Anodyne	GRM4	21	41
COc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1OC(C)C	ZINC000450608047	GH	On-Demand	Anodyne	ABCB1	16	40
COc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1OC(C)C	ZINC000450608047	GH	On-Demand	Anodyne	IMPDH2	0	40
COc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1OC(C)C	ZINC000450608047	GH	On-Demand	Anodyne	ENPP1	74	36
CC(C)c1cc(C(=O)N[C@H]2CN(C)NC2=O)c2cnn(C(C)C)c2n1	ZINC000450608056	ED	On-Demand	Anodyne	EZH2	19	43
CC(C)c1cc(C(=O)N[C@@H]2CN(C)NC2=O)c2cnn(C(C)C)c2n1	ZINC000450608057	ED	On-Demand	Anodyne	EZH2	19	43
COC(=O)c1coc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450608059	FG	On-Demand	Anodyne	SSTR5	45	36
COC(=O)c1coc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450608059	FG	On-Demand	Anodyne	SCD1	42	46
COC(=O)c1coc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450608059	FG	On-Demand	Anodyne	SCD	21	42
COc1ccccc1C(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)C(C)C	ZINC000450608060	EB	On-Demand	Anodyne	BRPF1	0	40
COc1ccccc1C(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)C(C)C	ZINC000450608061	EB	On-Demand	Anodyne	BRPF1	0	40
COc1ccccc1C(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)C(C)C	ZINC000450608062	EB	On-Demand	Anodyne	BRPF1	0	40
COc1ccccc1C(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)C(C)C	ZINC000450608063	EB	On-Demand	Anodyne	BRPF1	0	40
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608086	DB	On-Demand	Anodyne	HDAC10	41	39
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608086	DB	On-Demand	Anodyne	HDAC6	19	40
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608086	DB	On-Demand	Anodyne	HDAC11	43	39
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608086	DB	On-Demand	Anodyne	BIRC2	49	33
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608086	DB	On-Demand	Anodyne	BIRC8	47	37
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608087	DB	On-Demand	Anodyne	HDAC10	41	39
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608087	DB	On-Demand	Anodyne	HDAC6	19	40
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608087	DB	On-Demand	Anodyne	HDAC11	43	39
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608087	DB	On-Demand	Anodyne	BIRC2	49	33
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608087	DB	On-Demand	Anodyne	BIRC8	47	37
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608088	DB	On-Demand	Anodyne	HDAC10	41	39
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608088	DB	On-Demand	Anodyne	HDAC6	19	40
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608088	DB	On-Demand	Anodyne	HDAC11	43	39
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608088	DB	On-Demand	Anodyne	BIRC2	49	33
C[C@@H](NC(=O)Nc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608088	DB	On-Demand	Anodyne	BIRC8	47	37
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608089	DB	On-Demand	Anodyne	HDAC10	41	39
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608089	DB	On-Demand	Anodyne	HDAC6	19	40
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608089	DB	On-Demand	Anodyne	HDAC11	43	39
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608089	DB	On-Demand	Anodyne	BIRC2	49	33
C[C@H](NC(=O)Nc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608089	DB	On-Demand	Anodyne	BIRC8	47	37
COc1ccc(Cl)cc1NCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450608111	DC	On-Demand	Anodyne	CPT1A	43	30
COc1ccccc1C1(CNC(=O)C2(C(=O)C3CC3)CC2)CCC1	ZINC000450608113	EF	On-Demand	Anodyne	ACAT	0	54
COc1ccc(Cl)cc1NCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608114	DC	On-Demand	Anodyne	CPT1A	43	30
CN1C[C@@H](NC(=O)CCCCc2ccc(Br)cc2)C(=O)N1	ZINC000450608115	FD	On-Demand	Anodyne	LUXR	47	39
CN1C[C@@H](NC(=O)CCCCc2ccc(Br)cc2)C(=O)N1	ZINC000450608115	FD	On-Demand	Anodyne	TRAR	36	46
CN1C[C@H](NC(=O)CCCCc2ccc(Br)cc2)C(=O)N1	ZINC000450608117	FD	On-Demand	Anodyne	LUXR	47	39
CN1C[C@H](NC(=O)CCCCc2ccc(Br)cc2)C(=O)N1	ZINC000450608117	FD	On-Demand	Anodyne	TRAR	36	46
CN1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)C(=O)N1	ZINC000450608124	EB	On-Demand	Anodyne	PREP	44	34
CN1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)C(=O)N1	ZINC000450608124	EB	On-Demand	Anodyne	XIAP	15	41
COc1ccccc1C1(CNC(=O)[C@H]2CC2(F)F)CCC1	ZINC000450608126	CF	On-Demand	Anodyne	KCNA3	43	42
COc1ccccc1C1(CNC(=O)[C@H]2CC2(F)F)CCC1	ZINC000450608126	CF	On-Demand	Anodyne	ACAT	0	53
COc1ccccc1C1(CNC(=O)[C@H]2CC2(F)F)CCC1	ZINC000450608126	CF	On-Demand	Anodyne	HCN1	40	34
COc1ccccc1C1(CNC(=O)[C@@H]2CC2(F)F)CCC1	ZINC000450608127	CF	On-Demand	Anodyne	KCNA3	43	42
COc1ccccc1C1(CNC(=O)[C@@H]2CC2(F)F)CCC1	ZINC000450608127	CF	On-Demand	Anodyne	ACAT	0	53
COc1ccccc1C1(CNC(=O)[C@@H]2CC2(F)F)CCC1	ZINC000450608127	CF	On-Demand	Anodyne	HCN1	40	34
CN1C[C@H](NC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)C(=O)N1	ZINC000450608129	EB	On-Demand	Anodyne	PREP	44	34
CN1C[C@H](NC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)C(=O)N1	ZINC000450608129	EB	On-Demand	Anodyne	XIAP	15	41
CN1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)C(=O)N1	ZINC000450608130	EB	On-Demand	Anodyne	PREP	44	34
CN1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)C(=O)N1	ZINC000450608130	EB	On-Demand	Anodyne	XIAP	15	41
CN1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)C(=O)N1	ZINC000450608131	EB	On-Demand	Anodyne	PREP	44	34
CN1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)C(=O)N1	ZINC000450608131	EB	On-Demand	Anodyne	XIAP	15	41
Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608132	GC	On-Demand	Anodyne	P2RX7	22	42
Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450608136	GC	On-Demand	Anodyne	P2RX7	22	42
COc1ccccc1C1(CNC(=O)c2c(Br)cnn2C)CCC1	ZINC000450608143	GG	On-Demand	Anodyne	KCNA3	48	39
COc1ccccc1C1(CNC(=O)c2c(Br)cnn2C)CCC1	ZINC000450608143	GG	On-Demand	Anodyne	ACAT	0	50
COc1ccccc1C1(CNC(=O)c2c(Br)cnn2C)CCC1	ZINC000450608143	GG	On-Demand	Anodyne	HCN1	75	42
COc1ccccc1C1(CNC(=O)c2c(Br)cnn2C)CCC1	ZINC000450608143	GG	On-Demand	Anodyne	HCN4	52	38
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCOCC2(CCC2)C1	ZINC000450608145	FG	On-Demand	Bother	SLC6A9	16	43
CN(CCN1CC[C@@H]([C@H]2CCOC2)C1)Cc1ccccc1	ZINC000450608148	CE	On-Demand	Anodyne	SIGMAR1	43	40
CN(CCN1CC[C@@H]([C@@H]2CCOC2)C1)Cc1ccccc1	ZINC000450608149	CE	On-Demand	Anodyne	SIGMAR1	43	40
CN(CCN1CC[C@H]([C@H]2CCOC2)C1)Cc1ccccc1	ZINC000450608150	CE	On-Demand	Anodyne	SIGMAR1	43	40
CN(CCN1CC[C@H]([C@@H]2CCOC2)C1)Cc1ccccc1	ZINC000450608151	CE	On-Demand	Anodyne	SIGMAR1	43	40
CN1C[C@H](NC(=O)CCOc2ccc(Cl)cc2Cl)C(=O)N1	ZINC000450608156	ED	On-Demand	Anodyne	S1PR4	23	40
CN1C[C@@H](NC(=O)CCOc2ccc(Cl)cc2Cl)C(=O)N1	ZINC000450608158	ED	On-Demand	Anodyne	S1PR4	23	40
COC[C@@]1(C)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450608165	FG	On-Demand	Anodyne	AVPR2	45	38
COC[C@]1(C)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450608167	FG	On-Demand	Anodyne	AVPR2	45	38
CO[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)Cc1ccccc1	ZINC000450608174	GH	On-Demand	Anodyne	AVPR2	95	45
CO[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)Cc1ccccc1	ZINC000450608174	GH	On-Demand	Anodyne	AVPR1A	52	42
CO[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)Cc1ccccc1	ZINC000450608175	GH	On-Demand	Anodyne	AVPR2	95	45
CO[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)Cc1ccccc1	ZINC000450608175	GH	On-Demand	Anodyne	AVPR1A	52	42
CCCC[C@H](NC(=O)C[S@](=O)CC)C(=O)OC	ZINC000450608194	CC	On-Demand	Anodyne	NOD1	91	38
CCN(C(=O)[C@@H]1CC12CCSCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608201	FH	On-Demand	Anodyne	SIGMAR1	46	40
CCN(C(=O)[C@@H]1CC12CCSCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608203	FH	On-Demand	Anodyne	SIGMAR1	46	40
CCN(C(=O)[C@H]1CC12CCSCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608205	FH	On-Demand	Anodyne	SIGMAR1	46	40
CCN(C(=O)[C@H]1CC12CCSCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608206	FH	On-Demand	Anodyne	SIGMAR1	46	40
CCCC[C@@H](NC(=O)C[S@](=O)CC)C(=O)OC	ZINC000450608208	CC	On-Demand	Anodyne	NOD1	91	38
CCCC[C@@H](NC(=O)C[S@@](=O)CC)C(=O)OC	ZINC000450608209	CC	On-Demand	Anodyne	NOD1	91	38
CCCC[C@H](NC(=O)C[S@@](=O)CC)C(=O)OC	ZINC000450608212	CC	On-Demand	Anodyne	NOD1	91	38
COc1cc(CN2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)ccc1Cl	ZINC000450608215	EG	On-Demand	Anodyne	SSTR5	42	34
COCCOC1(CNc2ncnc3cc(Br)ccc23)CCOCC1	ZINC000450608217	GE	On-Demand	Anodyne	EGFR	75	39
COc1cc(CN2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)ccc1Cl	ZINC000450608219	EG	On-Demand	Anodyne	SSTR5	42	34
COc1cc(CN2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)ccc1Cl	ZINC000450608222	EG	On-Demand	Anodyne	SSTR5	42	34
COc1cc(CN2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)ccc1Cl	ZINC000450608224	EG	On-Demand	Anodyne	SSTR5	42	34
C[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1CO	ZINC000450608230	CF	On-Demand	Anodyne	KCNH2	0	43
C[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1CO	ZINC000450608230	CF	On-Demand	Anodyne	HRH3	58	43
C[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1CO	ZINC000450608230	CF	On-Demand	Anodyne	CACNA1D	35	44
C[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1CO	ZINC000450608230	CF	On-Demand	Anodyne	SPHK2	36	42
C[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1CO	ZINC000450608231	CF	On-Demand	Anodyne	KCNH2	0	43
C[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1CO	ZINC000450608231	CF	On-Demand	Anodyne	HRH3	58	43
C[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1CO	ZINC000450608231	CF	On-Demand	Anodyne	CACNA1D	35	44
C[C@@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1CO	ZINC000450608231	CF	On-Demand	Anodyne	SPHK2	36	42
C[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1CO	ZINC000450608232	CF	On-Demand	Anodyne	KCNH2	0	43
C[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1CO	ZINC000450608232	CF	On-Demand	Anodyne	HRH3	58	43
C[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1CO	ZINC000450608232	CF	On-Demand	Anodyne	CACNA1D	35	44
C[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@@H]1CO	ZINC000450608232	CF	On-Demand	Anodyne	SPHK2	36	42
C[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1CO	ZINC000450608234	CF	On-Demand	Anodyne	KCNH2	0	43
C[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1CO	ZINC000450608234	CF	On-Demand	Anodyne	HRH3	58	43
C[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1CO	ZINC000450608234	CF	On-Demand	Anodyne	CACNA1D	35	44
C[C@H]1CCCN(CCc2ccc(Cl)cc2)[C@H]1CO	ZINC000450608234	CF	On-Demand	Anodyne	SPHK2	36	42
CN1C[C@@H](NC(=O)Cc2cccc(OCC(F)(F)F)c2)C(=O)N1	ZINC000450608239	EC	On-Demand	Anodyne	UPP1	41	32
CN1C[C@H](NC(=O)Cc2cccc(OCC(F)(F)F)c2)C(=O)N1	ZINC000450608240	EC	On-Demand	Anodyne	UPP1	41	32
CCCC[C@H](NC(=O)C[C@H]1CCOC[C@@H]1OC)C(=O)OC	ZINC000450608253	DD	On-Demand	Anodyne	NOD1	50	32
CCCC[C@H](NC(=O)C[C@@H]1CCOC[C@@H]1OC)C(=O)OC	ZINC000450608256	DD	On-Demand	Anodyne	NOD1	50	32
CCCC[C@H](NC(=O)C[C@H]1CCOC[C@H]1OC)C(=O)OC	ZINC000450608257	DD	On-Demand	Anodyne	NOD1	50	32
CCCC[C@H](NC(=O)C[C@@H]1CCOC[C@H]1OC)C(=O)OC	ZINC000450608259	DD	On-Demand	Anodyne	NOD1	50	32
CCc1cccc(CC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450608263	CC	On-Demand	Anodyne	LUXR	44	37
CCc1cccc(CC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450608264	CC	On-Demand	Anodyne	LUXR	44	37
CC(=O)CCCCCSc1nnc(-c2ccc(C)cc2)n1C	ZINC000450608282	DI	On-Demand	Anodyne	DRD3	16	43
CC(=O)CCCCCSc1nnc(-c2ccc(C)cc2)n1C	ZINC000450608282	DI	On-Demand	Anodyne	KCNH2	0	43
CC(=O)[C@@](C)(O)CN1CCC[C@H](Oc2ccccc2Cl)C1	ZINC000450608283	DF	On-Demand	Anodyne	SLC6A1	70	36
CC(=O)[C@@](C)(O)CN1CCC[C@@H](Oc2ccccc2Cl)C1	ZINC000450608284	DF	On-Demand	Anodyne	SLC6A1	70	36
CC(=O)[C@](C)(O)CN1CCC[C@@H](Oc2ccccc2Cl)C1	ZINC000450608286	DF	On-Demand	Anodyne	SLC6A1	70	36
CC(=O)[C@](C)(O)CN1CCC[C@H](Oc2ccccc2Cl)C1	ZINC000450608288	DF	On-Demand	Anodyne	SLC6A1	70	36
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608289	FE	On-Demand	Anodyne	DRD2	36	40
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608289	FE	On-Demand	Anodyne	HTR2A	21	45
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608289	FE	On-Demand	Anodyne	ERG2	18	40
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608289	FE	On-Demand	Anodyne	HRH3	15	46
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608289	FE	On-Demand	Anodyne	HTR3B	0	42
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608289	FE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608289	FE	On-Demand	Anodyne	ACKR3	41	35
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608291	FE	On-Demand	Anodyne	DRD2	36	40
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608291	FE	On-Demand	Anodyne	HTR2A	21	45
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608291	FE	On-Demand	Anodyne	ERG2	18	40
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608291	FE	On-Demand	Anodyne	HRH3	15	46
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608291	FE	On-Demand	Anodyne	HTR3B	0	42
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608291	FE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C(=O)OC	ZINC000450608291	FE	On-Demand	Anodyne	ACKR3	41	35
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(=O)OC	ZINC000450608293	FE	On-Demand	Anodyne	DRD2	36	40
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(=O)OC	ZINC000450608293	FE	On-Demand	Anodyne	HTR2A	21	45
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(=O)OC	ZINC000450608293	FE	On-Demand	Anodyne	ERG2	18	40
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(=O)OC	ZINC000450608293	FE	On-Demand	Anodyne	HRH3	15	46
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(=O)OC	ZINC000450608293	FE	On-Demand	Anodyne	HTR3B	0	42
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(=O)OC	ZINC000450608293	FE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(=O)OC	ZINC000450608293	FE	On-Demand	Anodyne	ACKR3	41	35
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450608294	FE	On-Demand	Anodyne	DRD2	36	40
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450608294	FE	On-Demand	Anodyne	HTR2A	21	45
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450608294	FE	On-Demand	Anodyne	ERG2	18	40
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450608294	FE	On-Demand	Anodyne	HRH3	15	46
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450608294	FE	On-Demand	Anodyne	HTR3B	0	42
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450608294	FE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@@H]1[C@H](C(=O)OC)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450608294	FE	On-Demand	Anodyne	ACKR3	41	35
CCS(=O)(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450608303	GH	On-Demand	Anodyne	ACHE	47	51
CCS(=O)(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450608303	GH	On-Demand	Anodyne	HRH3	45	51
CCS(=O)(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450608303	GH	On-Demand	Anodyne	SIGMAR1	45	40
CCS(=O)(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)cc1	ZINC000450608303	GH	On-Demand	Anodyne	NPY1R	40	32
Cc1cc(N2CC[C@H](F)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450608319	CF	On-Demand	Bother	GYRB	0	55
COC(=O)[C@@](C)(O)CNC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450608320	DC	On-Demand	Anodyne	IRAK4	21	43
Cc1cc(N2CC[C@@H](F)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450608321	CF	On-Demand	Bother	GYRB	0	55
COC(=O)[C@](C)(O)CNC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450608322	DC	On-Demand	Anodyne	IRAK4	21	43
CO[C@H](CNc1ccc(S(=O)(=O)N2CCCC2)cn1)Cc1ccccc1	ZINC000450608324	GD	On-Demand	Anodyne	TGM2	22	44
CO[C@H](CNc1ccc(S(=O)(=O)N2CCCC2)cn1)Cc1ccccc1	ZINC000450608324	GD	On-Demand	Anodyne	NAMPT	30	41
CO[C@@H](CNc1ccc(S(=O)(=O)N2CCCC2)cn1)Cc1ccccc1	ZINC000450608326	GD	On-Demand	Anodyne	TGM2	22	44
CO[C@@H](CNc1ccc(S(=O)(=O)N2CCCC2)cn1)Cc1ccccc1	ZINC000450608326	GD	On-Demand	Anodyne	NAMPT	30	41
COC(=O)c1csc(CN2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000450608342	FG	On-Demand	Anodyne	PDE3A	15	40
COC(=O)c1csc(CN2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000450608342	FG	On-Demand	Anodyne	PDE3B	25	40
COC(=O)c1csc(CN2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000450608342	FG	On-Demand	Anodyne	SCD1	32	43
COC(=O)c1csc(CN2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000450608343	FG	On-Demand	Anodyne	PDE3A	15	40
COC(=O)c1csc(CN2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000450608343	FG	On-Demand	Anodyne	PDE3B	25	40
COC(=O)c1csc(CN2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000450608343	FG	On-Demand	Anodyne	SCD1	32	43
COC(=O)[C@](C)(O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450608349	DD	On-Demand	Anodyne	PPARD	29	40
COC(=O)[C@](C)(O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450608349	DD	On-Demand	Anodyne	CCR2	32	41
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450608350	DD	On-Demand	Anodyne	PPARD	29	40
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450608350	DD	On-Demand	Anodyne	CCR2	32	41
COC(=O)[C@@](C)(O)CNC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450608351	DC	On-Demand	Anodyne	ADRA2B	17	40
COC(=O)[C@@](C)(O)CNC(=O)C[C@H]1COc2ccccc2O1	ZINC000450608352	DC	On-Demand	Anodyne	ADRA2B	17	40
COC(=O)[C@](C)(O)CNC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450608353	DC	On-Demand	Anodyne	ADRA2B	17	40
COC(=O)[C@](C)(O)CNC(=O)C[C@H]1COc2ccccc2O1	ZINC000450608354	DC	On-Demand	Anodyne	ADRA2B	17	40
CCN(C(=O)c1ccsn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608370	DF	On-Demand	Anodyne	DRD4	37	42
CCN(C(=O)c1ccsn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608370	DF	On-Demand	Anodyne	ACHE	29	40
CCN(C(=O)c1ccsn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608370	DF	On-Demand	Anodyne	SIGMAR1	45	41
CCN(C(=O)c1ccsn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608371	DF	On-Demand	Anodyne	DRD4	37	42
CCN(C(=O)c1ccsn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608371	DF	On-Demand	Anodyne	ACHE	29	40
CCN(C(=O)c1ccsn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608371	DF	On-Demand	Anodyne	SIGMAR1	45	41
COc1cc2cc(C(=O)N[C@@H]3CN(C)NC3=O)[nH]c2cc1OC	ZINC000450608389	DC	On-Demand	Anodyne	PYGM	41	40
COc1cc2cc(C(=O)N[C@H]3CN(C)NC3=O)[nH]c2cc1OC	ZINC000450608390	DC	On-Demand	Anodyne	PYGM	41	40
CC(C)(CNc1c(F)cc(C#N)cc1F)c1ccccn1	ZINC000450608404	CH	On-Demand	Mild	GRM5	18	42
CC(C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccn1	ZINC000450608413	GF	On-Demand	Bother	BCL2L1	44	35
CC(C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccn1	ZINC000450608413	GF	On-Demand	Bother	BCL2	35	41
COc1ccc(OC(F)(F)F)c(C(=O)N2CCn3c(O)nnc3C2)c1	ZINC000450608424	FD	On-Demand	Anodyne	P2RX7	37	40
O=[N+]([O-])c1cc2ccccc2nc1NC[C@@H]1CCCCN1CCO	ZINC000450608443	ED	On-Demand	Bother	PRKCQ	44	35
O=[N+]([O-])c1cc2ccccc2nc1NC[C@H]1CCCCN1CCO	ZINC000450608444	ED	On-Demand	Bother	PRKCQ	44	35
Cc1nc(-c2ccccc2)c(C(=O)N[C@@H]2CN(C)NC2=O)s1	ZINC000450608448	DD	On-Demand	Anodyne	HCRTR1	0	41
Cc1nc(-c2ccccc2)c(C(=O)N[C@H]2CN(C)NC2=O)s1	ZINC000450608450	DD	On-Demand	Anodyne	HCRTR1	0	41
CC[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450608452	DC	On-Demand	Anodyne	ACE	41	35
CC[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450608455	DC	On-Demand	Anodyne	ACE	41	35
CC[C@H](C(=O)N[C@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450608457	DC	On-Demand	Anodyne	ACE	41	35
COc1ccc([N+](=O)[O-])cc1OCC[C@@H]1CCOC1	ZINC000450608458	CE	On-Demand	Bother	KCNMA1	19	40
CC[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N(C)Cc1ccccc1	ZINC000450608459	DC	On-Demand	Anodyne	ACE	41	35
COc1ccc([N+](=O)[O-])cc1OCC[C@H]1CCOC1	ZINC000450608464	CE	On-Demand	Bother	KCNMA1	19	40
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450608465	EB	On-Demand	Anodyne	MMP2	18	41
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450608465	EB	On-Demand	Anodyne	MMP9	15	41
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450608465	EB	On-Demand	Anodyne	BIRC2	49	36
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450608465	EB	On-Demand	Anodyne	BIRC8	43	32
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450608473	EB	On-Demand	Anodyne	MMP2	18	41
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450608473	EB	On-Demand	Anodyne	MMP9	15	41
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450608473	EB	On-Demand	Anodyne	BIRC2	49	36
Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450608473	EB	On-Demand	Anodyne	BIRC8	43	32
COc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2ccncc2)cc1	ZINC000450608474	GH	On-Demand	Anodyne	WNT3A	23	49
CC[C@H](CC(F)(F)F)NC(=O)c1cc2cccnc2s1	ZINC000450608475	DH	On-Demand	Anodyne	AKT1	51	32
COc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2ccncc2)cc1	ZINC000450608476	GH	On-Demand	Anodyne	WNT3A	23	49
CC[C@@H](CC(F)(F)F)NC(=O)c1cc2cccnc2s1	ZINC000450608477	DH	On-Demand	Anodyne	AKT1	51	32
CCC(=O)C1(C(=O)NCc2nc3ccccc3n2C2CC2)CC1	ZINC000450608478	DF	On-Demand	Anodyne	FPR2	28	41
Cc1cc(C)c(C(=O)N2CCn3c(O)nnc3C2)cc1Br	ZINC000450608487	FE	On-Demand	Anodyne	P2RX7	39	44
CC(=O)[C@@](C)(O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450608488	DF	On-Demand	Anodyne	CCR3	30	41
CC(=O)[C@@](C)(O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450608488	DF	On-Demand	Anodyne	SCD1	45	47
CC(=O)[C@@](C)(O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450608488	DF	On-Demand	Anodyne	SCD	30	45
CC(=O)[C@](C)(O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450608489	DF	On-Demand	Anodyne	CCR3	30	41
CC(=O)[C@](C)(O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450608489	DF	On-Demand	Anodyne	SCD1	45	47
CC(=O)[C@](C)(O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450608489	DF	On-Demand	Anodyne	SCD	30	45
O=C(NCc1nc2ccccc2n1C1CC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450608491	EH	On-Demand	Anodyne	PLD1	48	34
O=C(NCc1nc2ccccc2n1C1CC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450608491	EH	On-Demand	Anodyne	FPR2	29	41
COc1cc(CC(=O)NCCC[C@@H]2CCCCO2)ccc1Cl	ZINC000450608498	EG	On-Demand	Anodyne	TRPV1	0	45
COc1cc(CC(=O)NCCC[C@@H]2CCCCO2)ccc1Cl	ZINC000450608498	EG	On-Demand	Anodyne	SSTR3	0	43
COc1cc(CC(=O)NCCC[C@@H]2CCCCO2)ccc1Cl	ZINC000450608498	EG	On-Demand	Anodyne	NCE103	25	47
COc1cc(CC(=O)NCCC[C@@H]2CCCCO2)ccc1Cl	ZINC000450608498	EG	On-Demand	Anodyne	CAN2	0	47
COc1cc(CC(=O)NCCC[C@H]2CCCCO2)ccc1Cl	ZINC000450608500	EG	On-Demand	Anodyne	TRPV1	0	45
COc1cc(CC(=O)NCCC[C@H]2CCCCO2)ccc1Cl	ZINC000450608500	EG	On-Demand	Anodyne	SSTR3	0	43
COc1cc(CC(=O)NCCC[C@H]2CCCCO2)ccc1Cl	ZINC000450608500	EG	On-Demand	Anodyne	NCE103	25	47
COc1cc(CC(=O)NCCC[C@H]2CCCCO2)ccc1Cl	ZINC000450608500	EG	On-Demand	Anodyne	CAN2	0	47
CN1C[C@@H](NC(=O)CCc2nc3ccccc3[nH]2)C(=O)N1	ZINC000450608511	CB	On-Demand	Anodyne	CYSP_TRYCR	0	42
CN1C[C@@H](NC(=O)CCc2nc3ccccc3[nH]2)C(=O)N1	ZINC000450608511	CB	On-Demand	Anodyne	PARP3	22	40
CN1C[C@@H](NC(=O)CCc2nc3ccccc3[nH]2)C(=O)N1	ZINC000450608511	CB	On-Demand	Anodyne	LUXR	45	30
CN1C[C@@H](NC(=O)CCc2nc3ccccc3[nH]2)C(=O)N1	ZINC000450608511	CB	On-Demand	Anodyne	ISPE	0	43
CN1C[C@H](NC(=O)CCc2nc3ccccc3[nH]2)C(=O)N1	ZINC000450608515	CB	On-Demand	Anodyne	CYSP_TRYCR	0	42
CN1C[C@H](NC(=O)CCc2nc3ccccc3[nH]2)C(=O)N1	ZINC000450608515	CB	On-Demand	Anodyne	PARP3	22	40
CN1C[C@H](NC(=O)CCc2nc3ccccc3[nH]2)C(=O)N1	ZINC000450608515	CB	On-Demand	Anodyne	LUXR	45	30
CN1C[C@H](NC(=O)CCc2nc3ccccc3[nH]2)C(=O)N1	ZINC000450608515	CB	On-Demand	Anodyne	ISPE	0	43
CCC(CC)(CCSc1nnc(-c2ccco2)n1C)C(=O)OC	ZINC000450608523	EH	On-Demand	Anodyne	DRD3	43	36
Cc1cncc(-c2nc(CN3CCC(Oc4ccccc4Cl)CC3)no2)c1	ZINC000450608530	GI	On-Demand	Anodyne	SCD1	34	47
CC(C)(C)OC(=O)c1ccccc1NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450608531	FG	On-Demand	Anodyne	NR1H4	0	40
CC(C)(C)OC(=O)c1ccccc1NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450608531	FG	On-Demand	Anodyne	HCAR2	36	50
CC(C)(C)OC(=O)c1ccccc1NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450608531	FG	On-Demand	Anodyne	PAGA	0	43
CC(C)(CNc1ccc(C(=O)N2CCc3ccccc32)cn1)c1ccccn1	ZINC000450608537	FI	On-Demand	Anodyne	AVPR2	87	41
CC(C)(CNc1ccc(C(=O)N2CCc3ccccc32)cn1)c1ccccn1	ZINC000450608537	FI	On-Demand	Anodyne	AVPR1A	49	41
CN(CCN1C(=O)c2ccccc2C1=O)Cc1cn(CC2CC2)nn1	ZINC000450608538	ED	On-Demand	Anodyne	HSP90AB1	23	56
Cc1cccc(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)n1	ZINC000450608544	FF	On-Demand	Anodyne	PDE8A	0	45
Cc1cccc(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)n1	ZINC000450608544	FF	On-Demand	Anodyne	GNAI1	0	41
Cc1cccc(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)n1	ZINC000450608544	FF	On-Demand	Anodyne	GNAI3	0	41
Cc1cccc(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)n1	ZINC000450608544	FF	On-Demand	Anodyne	GNAO1	0	41
COc1ccc(NC(=O)c2cn3nccc3nc2C)cc1OC(C)C	ZINC000450608557	EG	On-Demand	Anodyne	ENPP1	63	39
COc1ccc(NC(=O)c2cn3nccc3nc2C)cc1OC(C)C	ZINC000450608557	EG	On-Demand	Anodyne	KCNK3	40	39
CC[C@@H](C)[C@H](CNc1ncc(C(=O)N2CCOCC2)cc1Cl)OC	ZINC000450608567	FF	On-Demand	Anodyne	LRRK2	29	43
CC[C@@H](C)[C@@H](CNc1ncc(C(=O)N2CCOCC2)cc1Cl)OC	ZINC000450608568	FF	On-Demand	Anodyne	LRRK2	29	43
CC[C@H](C)[C@@H](CNc1ncc(C(=O)N2CCOCC2)cc1Cl)OC	ZINC000450608569	FF	On-Demand	Anodyne	LRRK2	29	43
CC[C@H](C)[C@H](CNc1ncc(C(=O)N2CCOCC2)cc1Cl)OC	ZINC000450608570	FF	On-Demand	Anodyne	LRRK2	29	43
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	DRD2	35	45
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	DRD4	74	45
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	ACHE	43	49
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	HRH1	42	48
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	DRD3	29	45
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	OPRK1	15	47
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	KCNH2	16	41
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	LTA4H	30	44
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	HRH3	30	50
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	SIGMAR1	57	44
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	SSTR5	67	41
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	CCR3	69	48
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	UTS2R	29	48
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	SLC18A3	19	40
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	SCN5A	44	32
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	MCHR1	41	40
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	CCR8	26	41
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	CYP2J2	43	31
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	SCD1	43	47
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	SCD	26	50
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	CYP3A43	0	40
CC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450608587	EJ	On-Demand	Anodyne	MBTPS1	45	39
C[C@H](C#N)CN(Cc1cc(Cl)cc(CN(C[C@@H](C)C#N)C2CC2)c1)C1CC1	ZINC000450608593	GJ	On-Demand	Mild	NOS2	16	43
C[C@H](C#N)CN(Cc1cc(Cl)cc(CN(C[C@H](C)C#N)C2CC2)c1)C1CC1	ZINC000450608597	GJ	On-Demand	Mild	NOS2	16	43
C[C@@H](C#N)CN(Cc1cc(Cl)cc(CN(C[C@@H](C)C#N)C2CC2)c1)C1CC1	ZINC000450608599	GJ	On-Demand	Mild	NOS2	16	43
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608617	DC	On-Demand	Anodyne	SERPINE1	41	41
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450608618	DC	On-Demand	Anodyne	SERPINE1	41	41
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608619	DC	On-Demand	Anodyne	SERPINE1	41	41
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450608620	DC	On-Demand	Anodyne	SERPINE1	41	41
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	ACE	25	52
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	SSTR2	95	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	GNRHR	0	42
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	OPRM1	22	50
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	OPRD1	24	50
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MME	28	51
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	EDNRB	58	39
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	EDNRA	56	47
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	TACR1	35	43
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MC4R	47	46
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	BMP1	31	46
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	TACR2	58	46
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	CCKAR	108	48
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	NTSR1	39	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	CTSL	37	42
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	BRS3	27	49
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	UTS2R	0	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	NMBR	50	41
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MC3R	63	47
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MC5R	65	41
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MMP2	31	54
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MMP8	50	54
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MMP14	26	45
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	GRPR	82	39
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	ECE1	65	48
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	SSTR3	58	39
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MMP11	79	41
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	CCKBR	74	45
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	GHSR	75	50
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MMP9	30	52
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MC1R	86	47
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	ADAM9	47	48
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	C5AR1	50	43
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MMP7	25	45
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MMP1	31	50
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	NPR	37	51
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	MAGI3	0	42
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	SSSIM	27	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	SLC15A2	0	49
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	KISS1R	72	39
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	ERAP2	45	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	PSMB8	23	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	ERAP1	0	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	LASB	0	51
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	CD36	0	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	PSMB9	0	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	NRDE	0	47
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608623	FC	On-Demand	Anodyne	DSBA	0	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	ACE	25	52
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	SSTR2	95	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	GNRHR	0	42
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	OPRM1	22	50
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	OPRD1	24	50
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MME	28	51
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	EDNRB	58	39
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	EDNRA	56	47
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	TACR1	35	43
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MC4R	47	46
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	BMP1	31	46
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	TACR2	58	46
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	CCKAR	108	48
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	NTSR1	39	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	CTSL	37	42
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	BRS3	27	49
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	UTS2R	0	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	NMBR	50	41
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MC3R	63	47
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MC5R	65	41
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MMP2	31	54
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MMP8	50	54
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MMP14	26	45
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	GRPR	82	39
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	ECE1	65	48
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	SSTR3	58	39
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MMP11	79	41
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	CCKBR	74	45
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	GHSR	75	50
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MMP9	30	52
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MC1R	86	47
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	ADAM9	47	48
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	C5AR1	50	43
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MMP7	25	45
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MMP1	31	50
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	NPR	37	51
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	MAGI3	0	42
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	SSSIM	27	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	SLC15A2	0	49
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	KISS1R	72	39
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	ERAP2	45	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	PSMB8	23	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	ERAP1	0	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	LASB	0	51
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	CD36	0	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	PSMB9	0	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	NRDE	0	47
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450608625	FC	On-Demand	Anodyne	DSBA	0	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	ACE	25	52
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	SSTR2	95	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	GNRHR	0	42
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	OPRM1	22	50
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	OPRD1	24	50
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MME	28	51
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	EDNRB	58	39
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	EDNRA	56	47
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	TACR1	35	43
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MC4R	47	46
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	BMP1	31	46
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	TACR2	58	46
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	CCKAR	108	48
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	NTSR1	39	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	CTSL	37	42
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	BRS3	27	49
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	UTS2R	0	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	NMBR	50	41
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MC3R	63	47
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MC5R	65	41
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MMP2	31	54
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MMP8	50	54
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MMP14	26	45
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	GRPR	82	39
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	ECE1	65	48
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	SSTR3	58	39
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MMP11	79	41
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	CCKBR	74	45
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	GHSR	75	50
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MMP9	30	52
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MC1R	86	47
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	ADAM9	47	48
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	C5AR1	50	43
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MMP7	25	45
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MMP1	31	50
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	NPR	37	51
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	MAGI3	0	42
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	SSSIM	27	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	SLC15A2	0	49
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	KISS1R	72	39
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	ERAP2	45	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	PSMB8	23	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	ERAP1	0	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	LASB	0	51
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	CD36	0	44
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	PSMB9	0	40
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	NRDE	0	47
CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608627	FC	On-Demand	Anodyne	DSBA	0	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	ACE	25	52
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	SSTR2	95	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	GNRHR	0	42
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	OPRM1	22	50
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	OPRD1	24	50
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MME	28	51
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	EDNRB	58	39
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	EDNRA	56	47
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	TACR1	35	43
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MC4R	47	46
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	BMP1	31	46
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	TACR2	58	46
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	CCKAR	108	48
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	NTSR1	39	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	CTSL	37	42
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	BRS3	27	49
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	UTS2R	0	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	NMBR	50	41
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MC3R	63	47
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MC5R	65	41
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MMP2	31	54
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MMP8	50	54
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MMP14	26	45
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	GRPR	82	39
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	ECE1	65	48
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	SSTR3	58	39
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MMP11	79	41
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	CCKBR	74	45
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	GHSR	75	50
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MMP9	30	52
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MC1R	86	47
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	ADAM9	47	48
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	C5AR1	50	43
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MMP7	25	45
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MMP1	31	50
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	NPR	37	51
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	MAGI3	0	42
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	SSSIM	27	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	SLC15A2	0	49
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	KISS1R	72	39
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	ERAP2	45	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	PSMB8	23	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	ERAP1	0	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	LASB	0	51
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	CD36	0	44
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	PSMB9	0	40
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	NRDE	0	47
CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450608629	FC	On-Demand	Anodyne	DSBA	0	40
COc1ccccc1C1(CNC(=O)CSC2CC2)CCC1	ZINC000450608632	DG	On-Demand	Anodyne	KCNA3	44	45
COc1ccccc1C1(CNC(=O)CSC2CC2)CCC1	ZINC000450608632	DG	On-Demand	Anodyne	MTNR1A	22	40
COc1ccccc1C1(CNC(=O)CSC2CC2)CCC1	ZINC000450608632	DG	On-Demand	Anodyne	QRFPR	40	35
COc1ccccc1C1(CNC(=O)CSC2CC2)CCC1	ZINC000450608632	DG	On-Demand	Anodyne	ACAT	0	53
COc1ccccc1C1(CNC(=O)CSC2CC2)CCC1	ZINC000450608632	DG	On-Demand	Anodyne	HCN1	53	35
COc1ccccc1C1(CNC(=O)CSC2CC2)CCC1	ZINC000450608632	DG	On-Demand	Anodyne	HCN4	51	35
COC(=O)c1csc(CN2CCC(C)(c3ccccc3)CC2)n1	ZINC000450608636	EG	On-Demand	Anodyne	SIGMAR1	24	44
COC(=O)c1csc(CN2CCC(C)(c3ccccc3)CC2)n1	ZINC000450608636	EG	On-Demand	Anodyne	NPFFR1	51	36
COC[C@@]1(C)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450608667	EF	On-Demand	Anodyne	DRD3	0	41
COC[C@@]1(C)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450608667	EF	On-Demand	Anodyne	TNKS	57	31
COC[C@]1(C)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450608669	EF	On-Demand	Anodyne	DRD3	0	41
COC[C@]1(C)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450608669	EF	On-Demand	Anodyne	TNKS	57	31
CCc1ccccc1O[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450608677	FD	On-Demand	Anodyne	BIRC8	41	31
CCc1ccccc1O[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450608679	FD	On-Demand	Anodyne	BIRC8	41	31
C(=C/c1ccccc1)\CCN1CCC[C@H]([C@H]2CCOC2)C1	ZINC000450608680	CH	On-Demand	Anodyne	SLC6A1	100	40
CCc1ccccc1O[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450608681	FD	On-Demand	Anodyne	BIRC8	41	31
CCc1ccccc1O[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450608682	FD	On-Demand	Anodyne	BIRC8	41	31
C(=C/c1ccccc1)\CCN1CCC[C@H]([C@@H]2CCOC2)C1	ZINC000450608683	CH	On-Demand	Anodyne	SLC6A1	100	40
C(=C\c1ccccc1)\CCN1CCC[C@H]([C@@H]2CCOC2)C1	ZINC000450608685	CH	On-Demand	Anodyne	SLC6A1	100	40
C(=C\c1ccccc1)\CCN1CCC[C@H]([C@H]2CCOC2)C1	ZINC000450608687	CH	On-Demand	Anodyne	SLC6A1	100	40
COc1ccccc1C1(CNC(=O)Cc2ccc(O)c(F)c2)CCC1	ZINC000450608705	EG	On-Demand	Anodyne	TRPV1	0	44
COc1ccccc1C1(CNC(=O)Cc2ccc(O)c(F)c2)CCC1	ZINC000450608705	EG	On-Demand	Anodyne	KCNA3	40	43
COc1ccccc1C1(CNC(=O)Cc2ccc(O)c(F)c2)CCC1	ZINC000450608705	EG	On-Demand	Anodyne	ACAT	0	48
CN1C[C@@H](NC(=O)[C@H]2CCN2Cc2ccccc2)C(=O)N1	ZINC000450608710	CB	On-Demand	Anodyne	BIRC8	51	33
CN1C[C@@H](NC(=O)[C@@H]2CCN2Cc2ccccc2)C(=O)N1	ZINC000450608714	CB	On-Demand	Anodyne	BIRC8	51	33
CN1C[C@H](NC(=O)[C@H]2CCN2Cc2ccccc2)C(=O)N1	ZINC000450608716	CB	On-Demand	Anodyne	BIRC8	51	33
CN1C[C@H](NC(=O)[C@@H]2CCN2Cc2ccccc2)C(=O)N1	ZINC000450608717	CB	On-Demand	Anodyne	BIRC8	51	33
CCN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608723	FG	On-Demand	Anodyne	DRD4	31	40
CCN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608723	FG	On-Demand	Anodyne	ACHE	27	46
CCN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608723	FG	On-Demand	Anodyne	OPRM1	16	44
CCN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608723	FG	On-Demand	Anodyne	OPRD1	16	41
CCN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608723	FG	On-Demand	Anodyne	SIGMAR1	40	42
CCN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608723	FG	On-Demand	Anodyne	CCR5	45	44
CCN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608723	FG	On-Demand	Anodyne	MCHR1	25	42
CCN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608723	FG	On-Demand	Anodyne	MBTPS1	44	33
CCN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608725	FG	On-Demand	Anodyne	DRD4	31	40
CCN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608725	FG	On-Demand	Anodyne	ACHE	27	46
CCN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608725	FG	On-Demand	Anodyne	OPRM1	16	44
CCN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608725	FG	On-Demand	Anodyne	OPRD1	16	41
CCN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608725	FG	On-Demand	Anodyne	SIGMAR1	40	42
CCN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608725	FG	On-Demand	Anodyne	CCR5	45	44
CCN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608725	FG	On-Demand	Anodyne	MCHR1	25	42
CCN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608725	FG	On-Demand	Anodyne	MBTPS1	44	33
CN(C)CC1(CNC(=O)c2ccn(CCn3cccn3)n2)CCCC1	ZINC000450608729	ED	On-Demand	Anodyne	HCN1	55	34
CN(C)CC1(CNC(=O)c2ccn(CCn3cccn3)n2)CCCC1	ZINC000450608729	ED	On-Demand	Anodyne	HCN4	53	34
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](F)C2)c1	ZINC000450608731	CD	On-Demand	Bother	TAAR1	18	43
C[C@H](c1csnn1)N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450608732	DG	On-Demand	Anodyne	PDE3B	19	40
C[C@H](c1csnn1)N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450608732	DG	On-Demand	Anodyne	SCD1	37	42
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H](F)C2)c1	ZINC000450608734	CD	On-Demand	Bother	TAAR1	18	43
C[C@H](c1csnn1)N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450608742	DG	On-Demand	Anodyne	PDE3B	19	40
C[C@H](c1csnn1)N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450608742	DG	On-Demand	Anodyne	SCD1	37	42
C[C@@H](c1csnn1)N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450608743	DG	On-Demand	Anodyne	PDE3B	19	40
C[C@@H](c1csnn1)N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450608743	DG	On-Demand	Anodyne	SCD1	37	42
C[C@@H](c1csnn1)N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450608744	DG	On-Demand	Anodyne	PDE3B	19	40
C[C@@H](c1csnn1)N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450608744	DG	On-Demand	Anodyne	SCD1	37	42
C[C@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608748	BF	On-Demand	Anodyne	OPRM1	20	46
C[C@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608748	BF	On-Demand	Anodyne	OPRD1	16	46
C[C@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608748	BF	On-Demand	Anodyne	OPRK1	22	44
C[C@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608748	BF	On-Demand	Anodyne	OPRL1	31	52
C[C@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608748	BF	On-Demand	Anodyne	SIGMAR1	31	42
C[C@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608748	BF	On-Demand	Anodyne	CCR1	27	40
C[C@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608748	BF	On-Demand	Anodyne	KCNA3	0	48
C[C@@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608749	BF	On-Demand	Anodyne	OPRM1	20	46
C[C@@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608749	BF	On-Demand	Anodyne	OPRD1	16	46
C[C@@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608749	BF	On-Demand	Anodyne	OPRK1	22	44
C[C@@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608749	BF	On-Demand	Anodyne	OPRL1	31	52
C[C@@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608749	BF	On-Demand	Anodyne	SIGMAR1	31	42
C[C@@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608749	BF	On-Demand	Anodyne	CCR1	27	40
C[C@@H](O)CCN1CCC(C)(c2ccccc2)CC1	ZINC000450608749	BF	On-Demand	Anodyne	KCNA3	0	48
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450608754	CD	On-Demand	Anodyne	SLC6A7	0	40
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608769	GD	On-Demand	Anodyne	DRD2	18	43
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608769	GD	On-Demand	Anodyne	DRD3	29	43
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608769	GD	On-Demand	Anodyne	CYSLTR1	40	33
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608769	GD	On-Demand	Anodyne	PDGFRB	15	45
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608769	GD	On-Demand	Anodyne	CPT1A	47	32
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608769	GD	On-Demand	Anodyne	HPGD	50	59
COC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608770	GD	On-Demand	Anodyne	DRD2	18	43
COC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608770	GD	On-Demand	Anodyne	DRD3	29	43
COC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608770	GD	On-Demand	Anodyne	CYSLTR1	40	33
COC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608770	GD	On-Demand	Anodyne	PDGFRB	15	45
COC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608770	GD	On-Demand	Anodyne	CPT1A	47	32
COC(=O)[C@](C)(O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450608770	GD	On-Demand	Anodyne	HPGD	50	59
COC(=O)[C@](C)(O)CNC(=O)c1cccc(SC)c1	ZINC000450608771	CD	On-Demand	Anodyne	DRD4	40	32
COC(=O)[C@@](C)(O)CNC(=O)c1cccc(SC)c1	ZINC000450608772	CD	On-Demand	Anodyne	DRD4	40	32
COCCC(C)(C)CNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450608774	EE	On-Demand	Anodyne	CACNA1I	50	37
COc1ccccc1C1(CNC(=O)c2ccn(CCn3cccn3)n2)CCC1	ZINC000450608779	GF	On-Demand	Anodyne	KCNA3	49	39
COc1ccccc1C1(CNC(=O)c2ccn(CCn3cccn3)n2)CCC1	ZINC000450608779	GF	On-Demand	Anodyne	HCN1	82	43
COc1ccccc1C1(CNC(=O)c2ccn(CCn3cccn3)n2)CCC1	ZINC000450608779	GF	On-Demand	Anodyne	HCN4	57	40
CN1C[C@@H](NC(=O)CCCSc2ccc(Br)cc2)C(=O)N1	ZINC000450608785	FD	On-Demand	Anodyne	FAS	34	40
CN1C[C@H](NC(=O)CCCSc2ccc(Br)cc2)C(=O)N1	ZINC000450608787	FD	On-Demand	Anodyne	FAS	34	40
C[C@@H](O)C[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450608788	DF	On-Demand	Anodyne	SLC18A2	50	39
C[C@@H](O)C[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450608788	DF	On-Demand	Anodyne	HRH3	28	40
COC(=O)c1csc(CSc2nnc(-c3ccc(C)c(C)c3)o2)n1	ZINC000450608789	FH	On-Demand	Anodyne	GSK3B	16	49
COC(=O)c1csc(CSc2nnc(-c3ccc(C)c(C)c3)o2)n1	ZINC000450608789	FH	On-Demand	Anodyne	GSK3A	40	49
COC(=O)c1csc(CSc2nnc(-c3ccc(C)c(C)c3)o2)n1	ZINC000450608789	FH	On-Demand	Anodyne	ALOX15	46	36
COC(=O)c1csc(CSc2nnc(-c3ccc(C)c(C)c3)o2)n1	ZINC000450608789	FH	On-Demand	Anodyne	PIK3CG	0	45
COC(=O)c1csc(CSc2nnc(-c3ccc(C)c(C)c3)o2)n1	ZINC000450608789	FH	On-Demand	Anodyne	TERT	22	40
C[C@H](O)C[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450608790	DF	On-Demand	Anodyne	SLC18A2	50	39
C[C@H](O)C[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450608790	DF	On-Demand	Anodyne	HRH3	28	40
C[C@H](O)C[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450608792	DF	On-Demand	Anodyne	SLC18A2	50	39
C[C@H](O)C[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450608792	DF	On-Demand	Anodyne	HRH3	28	40
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	HTR1A	18	46
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	DRD2	33	49
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	DRD4	17	46
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	HTR2A	40	46
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	HTR2C	24	48
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	SLC6A1	144	43
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	DRD3	16	46
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	SIGMAR1	18	48
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	MCHR1	15	42
O=C(CCCN1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608793	FJ	On-Demand	Anodyne	CYP2J2	56	41
C[C@@H](O)C[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450608794	DF	On-Demand	Anodyne	SLC18A2	50	39
C[C@@H](O)C[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450608794	DF	On-Demand	Anodyne	HRH3	28	40
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	HTR1A	18	46
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	DRD2	33	49
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	DRD4	17	46
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	HTR2A	40	46
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	HTR2C	24	48
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	SLC6A1	144	43
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	DRD3	16	46
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	SIGMAR1	18	48
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	MCHR1	15	42
O=C(CCCN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1	ZINC000450608796	FJ	On-Demand	Anodyne	CYP2J2	56	41
COc1cc(CN2CC[C@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450608803	CG	On-Demand	Anodyne	DRD4	22	46
COc1cc(CN2CC[C@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450608803	CG	On-Demand	Anodyne	SSTR5	56	39
COc1cc(CN2CC[C@@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450608805	CG	On-Demand	Anodyne	DRD4	22	46
COc1cc(CN2CC[C@@H]([C@H]3CCOC3)C2)ccc1Cl	ZINC000450608805	CG	On-Demand	Anodyne	SSTR5	56	39
COc1cc(CN2CC[C@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450608808	CG	On-Demand	Anodyne	DRD4	22	46
COc1cc(CN2CC[C@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450608808	CG	On-Demand	Anodyne	SSTR5	56	39
COc1cc(CN2CC[C@@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450608810	CG	On-Demand	Anodyne	DRD4	22	46
COc1cc(CN2CC[C@@H]([C@@H]3CCOC3)C2)ccc1Cl	ZINC000450608810	CG	On-Demand	Anodyne	SSTR5	56	39
COC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450608813	ED	On-Demand	Anodyne	TRPV1	24	40
COC(=O)[C@](C)(O)CNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450608816	ED	On-Demand	Anodyne	TRPV1	24	40
CCc1nc(C)c(CSc2nc3ccccc3c(=O)n2CCCO)o1	ZINC000450608831	FF	On-Demand	Anodyne	SLC16A1	46	33
CCN(C(=O)C[S@@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608842	DD	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)C[S@@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608842	DD	On-Demand	Anodyne	DRD4	41	40
CCN(C(=O)C[S@@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608842	DD	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)C[S@@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608842	DD	On-Demand	Anodyne	DRD3	24	40
CCN(C(=O)C[S@@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608842	DD	On-Demand	Anodyne	CCR5	49	49
CCN(C(=O)C[S@@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608842	DD	On-Demand	Anodyne	SLC18A3	22	40
CCN(C(=O)C[S@@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608842	DD	On-Demand	Anodyne	NPFFR1	40	33
CCN(C(=O)C[S@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608844	DD	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)C[S@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608844	DD	On-Demand	Anodyne	DRD4	41	40
CCN(C(=O)C[S@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608844	DD	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)C[S@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608844	DD	On-Demand	Anodyne	DRD3	24	40
CCN(C(=O)C[S@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608844	DD	On-Demand	Anodyne	CCR5	49	49
CCN(C(=O)C[S@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608844	DD	On-Demand	Anodyne	SLC18A3	22	40
CCN(C(=O)C[S@](=O)CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450608844	DD	On-Demand	Anodyne	NPFFR1	40	33
CCOC(=O)c1ccc(CN2CCC[C@H]2C[C@@H](C)O)nc1	ZINC000450608845	CD	On-Demand	Anodyne	ACKR3	50	31
CCN(C(=O)C[S@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608846	DD	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)C[S@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608846	DD	On-Demand	Anodyne	DRD4	41	40
CCN(C(=O)C[S@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608846	DD	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)C[S@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608846	DD	On-Demand	Anodyne	DRD3	24	40
CCN(C(=O)C[S@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608846	DD	On-Demand	Anodyne	CCR5	49	49
CCN(C(=O)C[S@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608846	DD	On-Demand	Anodyne	SLC18A3	22	40
CCN(C(=O)C[S@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608846	DD	On-Demand	Anodyne	NPFFR1	40	33
CCOC(=O)c1ccc(CN2CCC[C@@H]2C[C@@H](C)O)nc1	ZINC000450608847	CD	On-Demand	Anodyne	ACKR3	50	31
CCN(C(=O)C[S@@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608848	DD	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)C[S@@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608848	DD	On-Demand	Anodyne	DRD4	41	40
CCN(C(=O)C[S@@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608848	DD	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)C[S@@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608848	DD	On-Demand	Anodyne	DRD3	24	40
CCN(C(=O)C[S@@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608848	DD	On-Demand	Anodyne	CCR5	49	49
CCN(C(=O)C[S@@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608848	DD	On-Demand	Anodyne	SLC18A3	22	40
CCN(C(=O)C[S@@](=O)CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450608848	DD	On-Demand	Anodyne	NPFFR1	40	33
CCOC(=O)c1ccc(CN2CCC[C@@H]2C[C@H](C)O)nc1	ZINC000450608849	CD	On-Demand	Anodyne	ACKR3	50	31
CN1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)C(=O)N1	ZINC000450608856	CB	On-Demand	Bother	SLC27A4	47	31
CN1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)C(=O)N1	ZINC000450608857	CB	On-Demand	Bother	SLC27A4	47	31
CCCOc1cccc(CC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450608860	CC	On-Demand	Anodyne	TSPAN17	0	43
CCCOc1cccc(CC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450608861	CC	On-Demand	Anodyne	TSPAN17	0	43
O=C(CCCN1CCC[C@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608887	EF	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608887	EF	On-Demand	Anodyne	CCR3	41	37
O=C(CCCN1CCC[C@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608887	EF	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCC[C@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608887	EF	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCC[C@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608887	EF	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1CCC[C@@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608888	EF	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608888	EF	On-Demand	Anodyne	CCR3	41	37
O=C(CCCN1CCC[C@@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608888	EF	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCC[C@@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608888	EF	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCC[C@@H](Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450608888	EF	On-Demand	Anodyne	CYP2J2	48	34
CCc1c(C(=O)NCCc2ccn(C)n2)oc2ccccc12	ZINC000450608892	CF	On-Demand	Anodyne	INHA	51	33
COCCC(C)(C)CNC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450608925	DF	On-Demand	Anodyne	IRAK4	22	45
COc1ccc(CCC(=O)N[C@@H]2CN(C)NC2=O)cc1Cl	ZINC000450608932	DC	On-Demand	Anodyne	HTR4	30	40
COc1ccc(CCC(=O)N[C@@H]2CN(C)NC2=O)cc1Cl	ZINC000450608932	DC	On-Demand	Anodyne	PDE6A	41	32
COc1ccc(CCC(=O)N[C@@H]2CN(C)NC2=O)cc1Cl	ZINC000450608932	DC	On-Demand	Anodyne	LUXR	37	40
COc1ccc(CCC(=O)N[C@H]2CN(C)NC2=O)cc1Cl	ZINC000450608933	DC	On-Demand	Anodyne	HTR4	30	40
COc1ccc(CCC(=O)N[C@H]2CN(C)NC2=O)cc1Cl	ZINC000450608933	DC	On-Demand	Anodyne	PDE6A	41	32
COc1ccc(CCC(=O)N[C@H]2CN(C)NC2=O)cc1Cl	ZINC000450608933	DC	On-Demand	Anodyne	LUXR	37	40
COc1ccc(NC(=O)Cn2cc(C(C)=O)nn2)cc1OC(C)C	ZINC000450608936	ED	On-Demand	Anodyne	ENPP1	69	40
O=C(NCCC[C@@H]1CCCCO1)c1ccc(-c2ccncc2)c(F)c1	ZINC000450608947	EH	On-Demand	Anodyne	ROCK2	24	41
O=C(NCCC[C@H]1CCCCO1)c1ccc(-c2ccncc2)c(F)c1	ZINC000450608948	EH	On-Demand	Anodyne	ROCK2	24	41
COc1ccc(NC(=O)c2ccc(-n3nnnc3C)cc2F)cc1OC(C)C	ZINC000450608969	GG	On-Demand	Anodyne	ENPP1	68	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC[C@H]1CCCCO1	ZINC000450608994	EG	On-Demand	Anodyne	PFDN6	0	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC[C@@H]1CCCCO1	ZINC000450608995	EG	On-Demand	Anodyne	PFDN6	0	46
CCOC(=O)c1ccc(CN2CCC[C@H]2C[C@H](C)O)nc1	ZINC000450608999	CD	On-Demand	Anodyne	ACKR3	50	31
CCC[C@@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450609006	CG	On-Demand	Anodyne	HRH1	38	42
CCC[C@@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450609006	CG	On-Demand	Anodyne	ABCB1	30	40
CCC[C@@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450609006	CG	On-Demand	Anodyne	SCD1	41	43
CCC[C@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450609007	CG	On-Demand	Anodyne	HRH1	38	42
CCC[C@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450609007	CG	On-Demand	Anodyne	ABCB1	30	40
CCC[C@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450609007	CG	On-Demand	Anodyne	SCD1	41	43
Cc1cc(NCc2nc(C)c(Br)s2)n2ncnc2n1	ZINC000450609010	EF	On-Demand	Anodyne	DHOD	0	52
CC(=O)c1cccc(CN2CCO[C@@]3(CCc4ccccc43)C2)c1	ZINC000450609013	DH	On-Demand	Anodyne	SIGMAR1	39	50
CC(=O)c1cccc(CN2CCO[C@@]3(CCc4ccccc43)C2)c1	ZINC000450609013	DH	On-Demand	Anodyne	MCHR2	55	33
CC(=O)c1cccc(CN2CCO[C@]3(CCc4ccccc43)C2)c1	ZINC000450609014	DH	On-Demand	Anodyne	SIGMAR1	39	50
CC(=O)c1cccc(CN2CCO[C@]3(CCc4ccccc43)C2)c1	ZINC000450609014	DH	On-Demand	Anodyne	MCHR2	55	33
O=C(NCCC[C@H]1CCCCO1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450609015	FI	On-Demand	Anodyne	RBP4	73	36
COc1ccc(NC(=O)c2cn(CC3CC3)nn2)cc1OC(C)C	ZINC000450609030	EF	On-Demand	Anodyne	COLA	46	34
CO[C@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450609031	GF	On-Demand	Bother	COLA	75	34
CO[C@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450609031	GF	On-Demand	Bother	BCL2L1	55	32
CO[C@@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450609034	GF	On-Demand	Bother	COLA	75	34
CO[C@@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450609034	GF	On-Demand	Bother	BCL2L1	55	32
CCCC[C@@H](NC(=O)Cn1ccc(C)n1)C(=O)OC	ZINC000450609037	CD	On-Demand	Anodyne	NOD1	62	36
CCCC[C@H](NC(=O)Cn1ccc(C)n1)C(=O)OC	ZINC000450609038	CD	On-Demand	Anodyne	NOD1	62	36
CCN(CCC1CC1)C(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450609047	CE	On-Demand	Anodyne	PDF	66	35
CN1C[C@@H](NC(=O)CCSc2ccc(Br)cc2)C(=O)N1	ZINC000450609048	FD	On-Demand	Anodyne	TRAR	28	40
CN1C[C@@H](NC(=O)CCSc2ccc(Br)cc2)C(=O)N1	ZINC000450609048	FD	On-Demand	Anodyne	FAS	37	42
Cc1ccc(-c2nnn(CC(=O)N[C@@H]3CN(C)NC3=O)n2)cc1	ZINC000450609052	DB	On-Demand	Anodyne	SCARB1	51	46
CN1C[C@H](NC(=O)CCSc2ccc(Br)cc2)C(=O)N1	ZINC000450609053	FD	On-Demand	Anodyne	TRAR	28	40
CN1C[C@H](NC(=O)CCSc2ccc(Br)cc2)C(=O)N1	ZINC000450609053	FD	On-Demand	Anodyne	FAS	37	42
COC(=O)[C@](C)(O)CNC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450609058	FD	On-Demand	Anodyne	GRIN2B	0	41
COC(=O)[C@@](C)(O)CNC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450609059	FD	On-Demand	Anodyne	GRIN2B	0	41
O[C@H](Cc1ccccc1)CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1	ZINC000450609065	FH	On-Demand	Anodyne	VACHT_TETCF	0	41
O[C@H](Cc1ccccc1)CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1	ZINC000450609066	FH	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1ccc(-c2nnn(CC(=O)N[C@H]3CN(C)NC3=O)n2)cc1	ZINC000450609069	DB	On-Demand	Anodyne	SCARB1	51	46
COc1ccc(C(=O)N[C@@H](C(=O)N[C@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609073	GC	On-Demand	Anodyne	CTSL	17	41
COc1ccc(C(=O)N[C@@H](C(=O)N[C@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609073	GC	On-Demand	Anodyne	MTTP	74	36
COc1ccc(C(=O)N[C@@H](C(=O)N[C@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609073	GC	On-Demand	Anodyne	BIRC8	47	33
COc1ccc(C(=O)N[C@@H](C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609074	GC	On-Demand	Anodyne	CTSL	17	41
COc1ccc(C(=O)N[C@@H](C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609074	GC	On-Demand	Anodyne	MTTP	74	36
COc1ccc(C(=O)N[C@@H](C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609074	GC	On-Demand	Anodyne	BIRC8	47	33
COc1ccc(C(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609075	GC	On-Demand	Anodyne	CTSL	17	41
COc1ccc(C(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609075	GC	On-Demand	Anodyne	MTTP	74	36
COc1ccc(C(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609075	GC	On-Demand	Anodyne	BIRC8	47	33
COc1ccc(C(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609076	GC	On-Demand	Anodyne	CTSL	17	41
COc1ccc(C(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609076	GC	On-Demand	Anodyne	MTTP	74	36
COc1ccc(C(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc2)cc1	ZINC000450609076	GC	On-Demand	Anodyne	BIRC8	47	33
CN1C[C@@H](NC(=O)CCc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450609083	DD	On-Demand	Anodyne	DNAE	40	31
CN1C[C@@H](NC(=O)CCc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450609083	DD	On-Demand	Anodyne	LUXR	54	44
CN1C[C@H](NC(=O)Cn2c(C3CCCCC3)nc3ccccc32)C(=O)N1	ZINC000450609085	FD	On-Demand	Anodyne	HRH1	15	46
CN1C[C@@H](NC(=O)Cn2c(C3CCCCC3)nc3ccccc32)C(=O)N1	ZINC000450609086	FD	On-Demand	Anodyne	HRH1	15	46
CN1C[C@H](NC(=O)CCc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450609094	DD	On-Demand	Anodyne	DNAE	40	31
CN1C[C@H](NC(=O)CCc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450609094	DD	On-Demand	Anodyne	LUXR	54	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCCc2ccn(C)n2)cc1	ZINC000450609096	GD	On-Demand	Anodyne	CAPNS1	18	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCCc2ccn(C)n2)cc1	ZINC000450609096	GD	On-Demand	Anodyne	MMP2	16	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCCc2ccn(C)n2)cc1	ZINC000450609096	GD	On-Demand	Anodyne	PSMB5	30	40
COC(=O)[C@@](C)(O)CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450609111	FD	On-Demand	Anodyne	TRPC6	61	33
COC(=O)[C@@](C)(O)CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450609111	FD	On-Demand	Anodyne	TRPC3	47	33
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450609119	EC	On-Demand	Anodyne	P2RX7	46	49
Cc1csc2c(N[C@@H]3CCCN(CCCO)C3)ncnc12	ZINC000450609121	DE	On-Demand	Anodyne	LPAR2	20	40
Cc1csc2c(N[C@H]3CCCN(CCCO)C3)ncnc12	ZINC000450609122	DE	On-Demand	Anodyne	LPAR2	20	40
COC(=O)[C@](C)(O)CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450609123	FD	On-Demand	Anodyne	TRPC6	61	33
COC(=O)[C@](C)(O)CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450609123	FD	On-Demand	Anodyne	TRPC3	47	33
CC(C)(CN=c1cc(NCC2CC2)nc[nH]1)c1ccccn1	ZINC000450609124	CF	On-Demand	Anodyne	GPR39	0	44
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609126	EC	On-Demand	Anodyne	P2RX7	46	49
CCN(CCC1CC1)C(=O)c1ccc2cnccc2c1	ZINC000450609128	CG	On-Demand	Anodyne	OPRD1	22	40
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450609137	DC	On-Demand	Anodyne	GPR88	0	40
Cc1ccc2[nH]cc(CCC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450609142	DC	On-Demand	Anodyne	HTR1D	78	44
Cc1ccc2[nH]cc(CCC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450609142	DC	On-Demand	Anodyne	HTR1B	66	39
Cc1ccc2[nH]cc(CCC(=O)N[C@H]3CN(C)NC3=O)c2c1	ZINC000450609142	DC	On-Demand	Anodyne	MPO	58	40
Cc1ccc2[nH]cc(CCC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450609145	DC	On-Demand	Anodyne	HTR1D	78	44
Cc1ccc2[nH]cc(CCC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450609145	DC	On-Demand	Anodyne	HTR1B	66	39
Cc1ccc2[nH]cc(CCC(=O)N[C@@H]3CN(C)NC3=O)c2c1	ZINC000450609145	DC	On-Demand	Anodyne	MPO	58	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCCc1ccn(C)n1	ZINC000450609149	DF	On-Demand	Anodyne	SORT1	15	40
COc1cc(Cl)c(C(=O)N[C@@H]2CN(C)NC2=O)cc1OC	ZINC000450609155	DC	On-Demand	Anodyne	HTR3A	0	40
COc1cc(Cl)c(C(=O)N[C@@H]2CN(C)NC2=O)cc1OC	ZINC000450609155	DC	On-Demand	Anodyne	HTR4	60	41
CC[C@@H](O)CC(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000450609156	CF	On-Demand	Anodyne	SLC1A1	32	41
CC[C@@H](O)CC(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000450609156	CF	On-Demand	Anodyne	SLC1A2	47	41
CC[C@H](O)CC(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000450609157	CF	On-Demand	Anodyne	SLC1A1	32	41
CC[C@H](O)CC(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000450609157	CF	On-Demand	Anodyne	SLC1A2	47	41
COC[C@@]1(C)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450609158	DG	On-Demand	Anodyne	PDE3A	42	32
COC[C@@]1(C)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450609158	DG	On-Demand	Anodyne	PDE3B	62	32
COC[C@@]1(C)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450609158	DG	On-Demand	Anodyne	HTT	0	41
COC[C@]1(C)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450609159	DG	On-Demand	Anodyne	PDE3A	42	32
COC[C@]1(C)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450609159	DG	On-Demand	Anodyne	PDE3B	62	32
COC[C@]1(C)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450609159	DG	On-Demand	Anodyne	HTT	0	41
COc1cc(Cl)c(C(=O)N[C@H]2CN(C)NC2=O)cc1OC	ZINC000450609165	DC	On-Demand	Anodyne	HTR3A	0	40
COc1cc(Cl)c(C(=O)N[C@H]2CN(C)NC2=O)cc1OC	ZINC000450609165	DC	On-Demand	Anodyne	HTR4	60	41
CCN(C(=O)c1cn(CC2CC2)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609166	FE	On-Demand	Anodyne	ACHE	37	46
CCN(C(=O)c1cn(CC2CC2)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609166	FE	On-Demand	Anodyne	SIGMAR1	39	47
CCN(C(=O)c1cn(CC2CC2)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609166	FE	On-Demand	Anodyne	CCR5	54	44
CCN(C(=O)c1cn(CC2CC2)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609167	FE	On-Demand	Anodyne	ACHE	37	46
CCN(C(=O)c1cn(CC2CC2)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609167	FE	On-Demand	Anodyne	SIGMAR1	39	47
CCN(C(=O)c1cn(CC2CC2)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609167	FE	On-Demand	Anodyne	CCR5	54	44
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	HRH2	49	38
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	PPARG	44	40
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	PPARA	40	40
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	CYSLTR2	73	35
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	SIGMAR1	19	43
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	ADAM17	18	41
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	UPP1	60	37
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	PPARD	21	40
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	PLA2G4B	33	42
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	TSPAN17	0	49
CN1C[C@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609182	GD	On-Demand	Anodyne	CRTM	43	36
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	HRH2	49	38
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	PPARG	44	40
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	PPARA	40	40
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	CYSLTR2	73	35
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	SIGMAR1	19	43
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	ADAM17	18	41
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	UPP1	60	37
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	PPARD	21	40
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	PLA2G4B	33	42
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	TSPAN17	0	49
CN1C[C@@H](NC(=O)Cc2cccc(OCCCOc3ccccc3)c2)C(=O)N1	ZINC000450609184	GD	On-Demand	Anodyne	CRTM	43	36
COc1cc(CC(=O)NCCc2ccn(C)n2)ccc1Cl	ZINC000450609197	DD	On-Demand	Anodyne	TRPV1	23	43
COc1cc(CC(=O)NCCc2ccn(C)n2)ccc1Cl	ZINC000450609197	DD	On-Demand	Anodyne	NCE103	26	53
Cc1nc(C(F)(F)F)ccc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609216	DC	On-Demand	Anodyne	SHH	27	41
CCN(C(=O)c1c(Br)cnn1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609220	GF	On-Demand	Anodyne	DRD4	29	40
CCN(C(=O)c1c(Br)cnn1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609220	GF	On-Demand	Anodyne	ACHE	28	42
CCN(C(=O)c1c(Br)cnn1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609220	GF	On-Demand	Anodyne	DRD3	22	40
CCN(C(=O)c1c(Br)cnn1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609220	GF	On-Demand	Anodyne	SIGMAR1	34	43
CCN(C(=O)c1c(Br)cnn1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609220	GF	On-Demand	Anodyne	CCR5	49	44
CCN(C(=O)c1c(Br)cnn1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609222	GF	On-Demand	Anodyne	DRD4	29	40
CCN(C(=O)c1c(Br)cnn1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609222	GF	On-Demand	Anodyne	ACHE	28	42
CCN(C(=O)c1c(Br)cnn1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609222	GF	On-Demand	Anodyne	DRD3	22	40
CCN(C(=O)c1c(Br)cnn1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609222	GF	On-Demand	Anodyne	SIGMAR1	34	43
CCN(C(=O)c1c(Br)cnn1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609222	GF	On-Demand	Anodyne	CCR5	49	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450609223	GH	On-Demand	Anodyne	SCN9A	0	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450609223	GH	On-Demand	Anodyne	FPR1	41	32
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	ANPEP	45	32
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	PAPA1_CARPA	46	34
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	CTSG	26	42
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	CTRB1	34	42
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	MMP3	50	41
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	CELA2A	27	42
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	LAP3	43	34
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	MMP1	22	41
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	NPR	57	36
COC(=O)[C@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609230	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	40
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	ANPEP	45	32
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	PAPA1_CARPA	46	34
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	CTSG	26	42
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	CTRB1	34	42
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	MMP3	50	41
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	CELA2A	27	42
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	LAP3	43	34
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	MMP1	22	41
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	NPR	57	36
COC(=O)[C@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609232	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	40
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	ANPEP	45	32
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	PAPA1_CARPA	46	34
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	CTSG	26	42
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	CTRB1	34	42
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	MMP3	50	41
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	CELA2A	27	42
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	LAP3	43	34
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	MMP1	22	41
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	NPR	57	36
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000450609233	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	40
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	ANPEP	45	32
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	PAPA1_CARPA	46	34
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	CTSG	26	42
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	CTRB1	34	42
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	MMP3	50	41
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	CELA2A	27	42
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	LAP3	43	34
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	MMP1	22	41
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	NPR	57	36
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000450609234	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	40
Cc1nc(C(F)(F)F)ccc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609242	DC	On-Demand	Anodyne	SHH	27	41
CCN(C(=O)CSC1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609257	DG	On-Demand	Anodyne	CHRM2	18	41
CCN(C(=O)CSC1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609257	DG	On-Demand	Anodyne	DRD2	15	42
CCN(C(=O)CSC1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609257	DG	On-Demand	Anodyne	DRD4	36	41
CCN(C(=O)CSC1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609257	DG	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)CSC1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609257	DG	On-Demand	Anodyne	OPRM1	15	45
CCN(C(=O)CSC1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609257	DG	On-Demand	Anodyne	OPRD1	15	45
CCN(C(=O)CSC1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609257	DG	On-Demand	Anodyne	SIGMAR1	50	46
CCN(C(=O)CSC1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609257	DG	On-Demand	Anodyne	CCR5	46	44
CCN(C(=O)CSC1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609259	DG	On-Demand	Anodyne	CHRM2	18	41
CCN(C(=O)CSC1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609259	DG	On-Demand	Anodyne	DRD2	15	42
CCN(C(=O)CSC1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609259	DG	On-Demand	Anodyne	DRD4	36	41
CCN(C(=O)CSC1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609259	DG	On-Demand	Anodyne	ACHE	27	41
CCN(C(=O)CSC1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609259	DG	On-Demand	Anodyne	OPRM1	15	45
CCN(C(=O)CSC1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609259	DG	On-Demand	Anodyne	OPRD1	15	45
CCN(C(=O)CSC1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609259	DG	On-Demand	Anodyne	SIGMAR1	50	46
CCN(C(=O)CSC1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609259	DG	On-Demand	Anodyne	CCR5	46	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@H]1OC	ZINC000450609268	FG	On-Demand	Anodyne	RBP4	52	34
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@@H]1OC	ZINC000450609270	FG	On-Demand	Anodyne	RBP4	52	34
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@H]1OC	ZINC000450609271	FG	On-Demand	Anodyne	RBP4	52	34
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[C@@H]1OC	ZINC000450609272	FG	On-Demand	Anodyne	RBP4	52	34
CCN(C(=O)c1cc2ccncc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609290	FI	On-Demand	Anodyne	ACHE	28	41
CCN(C(=O)c1cc2ccncc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609290	FI	On-Demand	Anodyne	TACR2	44	37
CCN(C(=O)c1cc2ccncc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609290	FI	On-Demand	Anodyne	SIGMAR1	28	40
CCN(C(=O)c1cc2ccncc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609290	FI	On-Demand	Anodyne	CCR5	48	42
CCN(C(=O)c1cc2ccncc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609292	FI	On-Demand	Anodyne	ACHE	28	41
CCN(C(=O)c1cc2ccncc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609292	FI	On-Demand	Anodyne	TACR2	44	37
CCN(C(=O)c1cc2ccncc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609292	FI	On-Demand	Anodyne	SIGMAR1	28	40
CCN(C(=O)c1cc2ccncc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609292	FI	On-Demand	Anodyne	CCR5	48	42
COc1cc(OC)cc(-c2nnc(SCCC(C)(F)F)o2)c1	ZINC000450609296	EH	On-Demand	Anodyne	GSK3A	21	41
O=C(CC[C@@H]1CCCCO1)CSc1nc2ccccc2c(=O)n1CCCO	ZINC000450609309	GF	On-Demand	Anodyne	TNKS	45	32
O=C(CC[C@H]1CCCCO1)CSc1nc2ccccc2c(=O)n1CCCO	ZINC000450609314	GF	On-Demand	Anodyne	TNKS	45	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1	ZINC000450609315	EG	On-Demand	Anodyne	PTGER1	21	41
CN1C[C@H](NC(=O)Cc2cccc(OCc3ccc(Cl)cc3)c2)C(=O)N1	ZINC000450609316	FD	On-Demand	Anodyne	SLC6A5	24	43
CN1C[C@@H](NC(=O)Cc2cccc(OCc3ccc(Cl)cc3)c2)C(=O)N1	ZINC000450609317	FD	On-Demand	Anodyne	SLC6A5	24	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1	ZINC000450609319	EG	On-Demand	Anodyne	PTGER1	21	41
CCCC[C@H](NC(=O)CC1(O)CCC1)C(=O)OC	ZINC000450609324	CD	On-Demand	Anodyne	NOD1	86	36
CCCC[C@@H](NC(=O)CC1(O)CCC1)C(=O)OC	ZINC000450609327	CD	On-Demand	Anodyne	NOD1	86	36
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	BMP1	88	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	MMP13	54	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	MMP2	43	39
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	MMP3	65	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	MMP8	44	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	MMP9	46	38
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	MMP12	24	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	MMP7	64	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609329	FB	On-Demand	Anodyne	MMP1	65	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	BMP1	88	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	MMP13	54	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	MMP2	43	39
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	MMP3	65	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	MMP8	44	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	MMP9	46	38
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	MMP12	24	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	MMP7	64	42
COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609330	FB	On-Demand	Anodyne	MMP1	65	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	BMP1	88	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	MMP13	54	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	MMP2	43	39
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	MMP3	65	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	MMP8	44	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	MMP9	46	38
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	MMP12	24	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	MMP7	64	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609331	FB	On-Demand	Anodyne	MMP1	65	42
CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450609334	DG	On-Demand	Anodyne	MMP13	18	42
CC[C@H](CC(F)(F)F)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450609335	DG	On-Demand	Anodyne	MMP13	18	42
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	BMP1	67	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	MMP13	74	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	ADAM17	17	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	MMP2	49	39
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	MMP3	80	39
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	MMP8	49	39
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	MMP9	61	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	MMP7	64	36
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450609365	GB	On-Demand	Anodyne	MMP1	69	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	BMP1	67	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	MMP13	74	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	ADAM17	17	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	MMP2	49	39
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	MMP3	80	39
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	MMP8	49	39
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	MMP9	61	40
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	MMP7	64	36
COc1ccc(S(=O)(=O)N(C)CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609366	GB	On-Demand	Anodyne	MMP1	69	40
CN1C[C@H](NC(=O)CSc2ccc3ccccc3c2)C(=O)N1	ZINC000450609367	DD	On-Demand	Anodyne	CAPN2	23	45
CN1C[C@@H](NC(=O)CSc2ccc3ccccc3c2)C(=O)N1	ZINC000450609368	DD	On-Demand	Anodyne	CAPN2	23	45
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	TSHR	55	35
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	CPT1A	45	34
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	FLT1	16	41
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	GRM4	23	41
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	ABCB1	0	40
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	ENPP1	74	35
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	IMDH_CRYPV	20	40
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	KCNK3	39	40
COc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1OC(C)C	ZINC000450609371	GI	On-Demand	Anodyne	KCNK9	35	40
CCN(C(=O)c1cc(C)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609375	EH	On-Demand	Anodyne	CHRM2	15	42
CCN(C(=O)c1cc(C)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609375	EH	On-Demand	Anodyne	DRD2	17	42
CCN(C(=O)c1cc(C)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609375	EH	On-Demand	Anodyne	DRD4	49	42
CCN(C(=O)c1cc(C)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609375	EH	On-Demand	Anodyne	ACHE	37	45
CCN(C(=O)c1cc(C)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609375	EH	On-Demand	Anodyne	SIGMAR1	46	44
CCN(C(=O)c1cc(C)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609375	EH	On-Demand	Anodyne	CCR5	60	47
CCN(C(=O)c1cc(C)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609375	EH	On-Demand	Anodyne	MCHR1	22	40
CCN(C(=O)c1cc(C)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609377	EH	On-Demand	Anodyne	CHRM2	15	42
CCN(C(=O)c1cc(C)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609377	EH	On-Demand	Anodyne	DRD2	17	42
CCN(C(=O)c1cc(C)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609377	EH	On-Demand	Anodyne	DRD4	49	42
CCN(C(=O)c1cc(C)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609377	EH	On-Demand	Anodyne	ACHE	37	45
CCN(C(=O)c1cc(C)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609377	EH	On-Demand	Anodyne	SIGMAR1	46	44
CCN(C(=O)c1cc(C)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609377	EH	On-Demand	Anodyne	CCR5	60	47
CCN(C(=O)c1cc(C)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609377	EH	On-Demand	Anodyne	MCHR1	22	40
COC(=O)[C@@](C)(O)CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450609383	FD	On-Demand	Anodyne	PYGL	47	38
COC(=O)[C@](C)(O)CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450609385	FD	On-Demand	Anodyne	PYGL	47	38
CCN(C(=O)CC1(O)CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609387	DE	On-Demand	Anodyne	CCR5	58	45
CCN(C(=O)CC1(O)CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609388	DE	On-Demand	Anodyne	CCR5	58	45
O=C1CCC(CN2CCC(CCCN3CCCC3)CC2)CC1	ZINC000450609396	DG	On-Demand	Anodyne	NPY1R	41	38
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	TSHR	41	33
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	LTA4H	40	44
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	ADORA2A	0	43
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	ADORA2B	34	43
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	CYSLTR2	47	30
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	HRAS	41	31
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	MMP1	22	40
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	LUXN	0	42
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	ADIPOR1	0	42
CN1C[C@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609397	FD	On-Demand	Anodyne	ADIPOR2	0	42
C[C@@H](CCC(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609400	CD	On-Demand	Anodyne	BIRC8	42	32
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	TSHR	41	33
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	LTA4H	40	44
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	ADORA2A	0	43
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	ADORA2B	34	43
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	CYSLTR2	47	30
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	HRAS	41	31
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	MMP1	22	40
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	LUXN	0	42
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	ADIPOR1	0	42
CN1C[C@@H](NC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)N1	ZINC000450609401	FD	On-Demand	Anodyne	ADIPOR2	0	42
COc1ccc(NC(=O)[C@H]2Cc3cccc(C)c3O2)cc1OC(C)C	ZINC000450609404	EH	On-Demand	Anodyne	CFTR	18	41
C[C@H](CCC(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609405	CD	On-Demand	Anodyne	BIRC8	42	32
C[C@@H](CCC(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609406	CD	On-Demand	Anodyne	BIRC8	42	32
C[C@H](CCC(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609407	CD	On-Demand	Anodyne	BIRC8	42	32
COc1ccc(NC(=O)[C@@H]2Cc3cccc(C)c3O2)cc1OC(C)C	ZINC000450609409	EH	On-Demand	Anodyne	CFTR	18	41
CC(=O)N[C@H](CC(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609413	DB	On-Demand	Anodyne	CCR5	17	42
CC(=O)N[C@H](CC(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609413	DB	On-Demand	Anodyne	BIRC8	40	31
CN1C[C@H](NC(=O)Cc2ccc(OCc3ccccn3)cc2)C(=O)N1	ZINC000450609415	EC	On-Demand	Anodyne	SCN9A	0	42
CN1C[C@@H](NC(=O)Cc2ccc(OCc3ccccn3)cc2)C(=O)N1	ZINC000450609416	EC	On-Demand	Anodyne	SCN9A	0	42
CC(=O)N[C@H](CC(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609420	DB	On-Demand	Anodyne	CCR5	17	42
CC(=O)N[C@H](CC(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609420	DB	On-Demand	Anodyne	BIRC8	40	31
CC(=O)N[C@@H](CC(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609422	DB	On-Demand	Anodyne	CCR5	17	42
CC(=O)N[C@@H](CC(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609422	DB	On-Demand	Anodyne	BIRC8	40	31
CC(=O)N[C@@H](CC(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609424	DB	On-Demand	Anodyne	CCR5	17	42
CC(=O)N[C@@H](CC(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450609424	DB	On-Demand	Anodyne	BIRC8	40	31
O=c1c2sc(-c3ccc(Cl)cc3)cc2ncn1CC[C@@H]1CCOC1	ZINC000450609429	FI	On-Demand	Anodyne	MCHR1	41	54
O=c1c2sc(-c3ccc(Cl)cc3)cc2ncn1CC[C@H]1CCOC1	ZINC000450609431	FI	On-Demand	Anodyne	MCHR1	41	54
C[C@@H](O)CCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450609443	CF	On-Demand	Anodyne	SLC6A1	40	35
C[C@@H](O)CCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450609443	CF	On-Demand	Anodyne	PDE3B	26	42
C[C@@H](O)CCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450609443	CF	On-Demand	Anodyne	SCD1	33	42
C[C@H](O)CCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450609444	CF	On-Demand	Anodyne	SLC6A1	40	35
C[C@H](O)CCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450609444	CF	On-Demand	Anodyne	PDE3B	26	42
C[C@H](O)CCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450609444	CF	On-Demand	Anodyne	SCD1	33	42
C[C@H](O)CCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450609446	CF	On-Demand	Anodyne	SLC6A1	40	35
C[C@H](O)CCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450609446	CF	On-Demand	Anodyne	PDE3B	26	42
C[C@H](O)CCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450609446	CF	On-Demand	Anodyne	SCD1	33	42
C[C@@H](O)CCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450609448	CF	On-Demand	Anodyne	SLC6A1	40	35
C[C@@H](O)CCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450609448	CF	On-Demand	Anodyne	PDE3B	26	42
C[C@@H](O)CCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450609448	CF	On-Demand	Anodyne	SCD1	33	42
COc1ccc(NC(=O)Cc2cn(C)nc2C)cc1OC(C)C	ZINC000450609451	DF	On-Demand	Anodyne	PDGFRB	28	41
COc1ccc(NC(=O)Cc2cn(C)nc2C)cc1OC(C)C	ZINC000450609451	DF	On-Demand	Anodyne	ENPP1	70	41
COc1ccc(NC(=O)Cc2cn(C)nc2C)cc1OC(C)C	ZINC000450609451	DF	On-Demand	Anodyne	IMDH_CRYPV	31	45
COC(=O)C1(CN2CCC(Oc3ccccc3Cl)CC2)CC1	ZINC000450609453	DG	On-Demand	Anodyne	SCD1	43	47
COC(=O)C1(CN2CCC(Oc3ccccc3Cl)CC2)CC1	ZINC000450609453	DG	On-Demand	Anodyne	SCD	30	46
O=C1CCC(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)CC1	ZINC000450609461	EH	On-Demand	Anodyne	Q8MHZ5_SHEEP	63	40
O=C1CCC(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)CC1	ZINC000450609463	EH	On-Demand	Anodyne	Q8MHZ5_SHEEP	63	40
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	BMP1	88	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	MMP13	54	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	MMP2	43	39
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	MMP3	65	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	MMP8	44	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	MMP9	46	38
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	MMP12	24	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	MMP7	64	42
COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450609486	FB	On-Demand	Anodyne	MMP1	65	42
CCCOc1cccc(CSc2nnc(Cc3ccc(OC)cc3)o2)c1	ZINC000450609492	FJ	On-Demand	Anodyne	GSK3A	28	43
CCCOc1cccc(CSc2nnc(Cc3ccc(OC)cc3)o2)c1	ZINC000450609492	FJ	On-Demand	Anodyne	CPB	0	51
COC(=O)c1csc(CN2CC[C@@H](C)C[C@@H](C)C2)n1	ZINC000450609524	CF	On-Demand	Anodyne	TRPC6	50	39
COC(=O)c1csc(CN2CC[C@@H](C)C[C@H](C)C2)n1	ZINC000450609525	CF	On-Demand	Anodyne	TRPC6	50	39
COC(=O)c1csc(CN2CC[C@H](C)C[C@H](C)C2)n1	ZINC000450609526	CF	On-Demand	Anodyne	TRPC6	50	39
COC(=O)c1csc(CN2CC[C@H](C)C[C@@H](C)C2)n1	ZINC000450609527	CF	On-Demand	Anodyne	TRPC6	50	39
CCCC[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC	ZINC000450609535	FF	On-Demand	Mild	CCR3	0	42
CCCC[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC	ZINC000450609538	FF	On-Demand	Mild	CCR3	0	42
CSc1cccc(C(=O)NCCc2ccn(C)n2)c1	ZINC000450609544	CE	On-Demand	Anodyne	DRD4	45	34
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](Cc1ccccc1)OC	ZINC000450609551	EF	On-Demand	Bother	CCR3	0	40
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](Cc1ccccc1)OC	ZINC000450609552	EF	On-Demand	Bother	CCR3	0	40
CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609553	DB	On-Demand	Anodyne	PLM1_PLAFA	54	35
CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609553	DB	On-Demand	Anodyne	PLM2_PLAFA	27	40
CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609554	DB	On-Demand	Anodyne	PLM1_PLAFA	54	35
CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609554	DB	On-Demand	Anodyne	PLM2_PLAFA	27	40
CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609555	DB	On-Demand	Anodyne	PLM1_PLAFA	54	35
CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609555	DB	On-Demand	Anodyne	PLM2_PLAFA	27	40
CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609556	DB	On-Demand	Anodyne	PLM1_PLAFA	54	35
CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609556	DB	On-Demand	Anodyne	PLM2_PLAFA	27	40
C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609560	ED	On-Demand	Anodyne	UGCG	33	40
C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609560	ED	On-Demand	Anodyne	MC4R	48	36
C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609560	ED	On-Demand	Anodyne	P2RX7	50	51
C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609561	ED	On-Demand	Anodyne	UGCG	33	40
C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609561	ED	On-Demand	Anodyne	MC4R	48	36
C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609561	ED	On-Demand	Anodyne	P2RX7	50	51
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609562	ED	On-Demand	Anodyne	UGCG	33	40
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609562	ED	On-Demand	Anodyne	MC4R	48	36
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609562	ED	On-Demand	Anodyne	P2RX7	50	51
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609563	ED	On-Demand	Anodyne	UGCG	33	40
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609563	ED	On-Demand	Anodyne	MC4R	48	36
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609563	ED	On-Demand	Anodyne	P2RX7	50	51
CCCC[C@H](NC(=O)c1ccn(CCn2cccn2)n1)C(=O)OC	ZINC000450609579	ED	On-Demand	Anodyne	P2RY12	113	34
CCCC[C@@H](NC(=O)c1ccn(CCn2cccn2)n1)C(=O)OC	ZINC000450609580	ED	On-Demand	Anodyne	P2RY12	113	34
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609581	GD	On-Demand	Anodyne	CA2	47	40
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609581	GD	On-Demand	Anodyne	CA1	42	43
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609581	GD	On-Demand	Anodyne	CA7	28	43
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609581	GD	On-Demand	Anodyne	CA5B	39	43
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609581	GD	On-Demand	Anodyne	CA4	45	35
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609581	GD	On-Demand	Anodyne	CA5A	44	43
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609582	GD	On-Demand	Anodyne	CA2	47	40
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609582	GD	On-Demand	Anodyne	CA1	42	43
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609582	GD	On-Demand	Anodyne	CA7	28	43
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609582	GD	On-Demand	Anodyne	CA5B	39	43
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609582	GD	On-Demand	Anodyne	CA4	45	35
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)Cc1ccccc1	ZINC000450609582	GD	On-Demand	Anodyne	CA5A	44	43
COC(=O)c1cncc(NC[C@H]2CCC[C@H]2c2ccccc2)n1	ZINC000450609597	DG	On-Demand	Anodyne	VCP	57	36
COC(=O)c1cncc(NC[C@@H]2CCC[C@H]2c2ccccc2)n1	ZINC000450609598	DG	On-Demand	Anodyne	VCP	57	36
COC(=O)c1cncc(NC[C@H]2CCC[C@@H]2c2ccccc2)n1	ZINC000450609599	DG	On-Demand	Anodyne	VCP	57	36
COC(=O)c1cncc(NC[C@@H]2CCC[C@@H]2c2ccccc2)n1	ZINC000450609600	DG	On-Demand	Anodyne	VCP	57	36
COc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OC1CCCC1	ZINC000450609602	ED	On-Demand	Anodyne	PDE4A	29	49
COc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OC1CCCC1	ZINC000450609602	ED	On-Demand	Anodyne	PDE4D	22	49
COc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OC1CCCC1	ZINC000450609602	ED	On-Demand	Anodyne	PDEC	0	41
COc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OC1CCCC1	ZINC000450609603	ED	On-Demand	Anodyne	PDE4A	29	49
COc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OC1CCCC1	ZINC000450609603	ED	On-Demand	Anodyne	PDE4D	22	49
COc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OC1CCCC1	ZINC000450609603	ED	On-Demand	Anodyne	PDEC	0	41
CC(C)[C@H](SCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609608	DD	On-Demand	Anodyne	ACE	47	35
CC(C)[C@H](SCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609608	DD	On-Demand	Anodyne	BIRC8	40	32
CC(C)[C@H](SCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609609	DD	On-Demand	Anodyne	ACE	47	35
CC(C)[C@H](SCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609609	DD	On-Demand	Anodyne	BIRC8	40	32
CC(C)[C@@H](SCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609610	DD	On-Demand	Anodyne	ACE	47	35
CC(C)[C@@H](SCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609610	DD	On-Demand	Anodyne	BIRC8	40	32
CC(C)[C@@H](SCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609611	DD	On-Demand	Anodyne	ACE	47	35
CC(C)[C@@H](SCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609611	DD	On-Demand	Anodyne	BIRC8	40	32
Cc1ccc(F)c(CSc2nc3ccccc3c(=O)n2CCCO)c1	ZINC000450609612	FH	On-Demand	Anodyne	PTGDR2	16	40
Cc1ccc(F)c(CSc2nc3ccccc3c(=O)n2CCCO)c1	ZINC000450609612	FH	On-Demand	Anodyne	SLC16A1	45	32
CN(C[C@H](O)C(F)(F)F)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450609617	FD	On-Demand	Anodyne	PSBA	0	45
CN(C[C@@H](O)C(F)(F)F)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450609619	FD	On-Demand	Anodyne	PSBA	0	45
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609621	GH	On-Demand	Anodyne	SLC1A2	43	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609621	GH	On-Demand	Anodyne	CA9	15	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609621	GH	On-Demand	Anodyne	NCE103	24	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609621	GH	On-Demand	Anodyne	PFK	0	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609621	GH	On-Demand	Anodyne	ENPP1	66	33
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609621	GH	On-Demand	Anodyne	P96878_MYCTU	15	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609621	GH	On-Demand	Anodyne	IMDH_CRYPV	22	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609621	GH	On-Demand	Anodyne	CAN2	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609625	GH	On-Demand	Anodyne	SLC1A2	43	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609625	GH	On-Demand	Anodyne	CA9	15	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609625	GH	On-Demand	Anodyne	NCE103	24	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609625	GH	On-Demand	Anodyne	PFK	0	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609625	GH	On-Demand	Anodyne	ENPP1	66	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609625	GH	On-Demand	Anodyne	P96878_MYCTU	15	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609625	GH	On-Demand	Anodyne	IMDH_CRYPV	22	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450609625	GH	On-Demand	Anodyne	CAN2	0	40
CCOCCO[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450609646	CG	On-Demand	Anodyne	SIGMAR1	18	42
Cc1cc(C(=O)Nc2ccccc2C(=O)OC(C)(C)C)ncc1C(N)=O	ZINC000450609699	FF	On-Demand	Anodyne	PAGA	0	44
Cc1nc([C@@H]2CCCCN2CCc2ccc(Cl)cc2)n[nH]1	ZINC000450609700	DH	On-Demand	Anodyne	HRH3	36	41
Cc1nc([C@@H]2CCCCN2CCc2ccc(Cl)cc2)n[nH]1	ZINC000450609700	DH	On-Demand	Anodyne	SPHK2	32	43
Cc1nc([C@H]2CCCCN2CCc2ccc(Cl)cc2)n[nH]1	ZINC000450609701	DH	On-Demand	Anodyne	HRH3	36	41
Cc1nc([C@H]2CCCCN2CCc2ccc(Cl)cc2)n[nH]1	ZINC000450609701	DH	On-Demand	Anodyne	SPHK2	32	43
CNC(=O)c1ccc(N[C@@H]2CCCN(CCCO)C2)c([N+](=O)[O-])c1	ZINC000450609713	ED	On-Demand	Bother	BIRC2	40	37
CNC(=O)c1ccc(N[C@H]2CCCN(CCCO)C2)c([N+](=O)[O-])c1	ZINC000450609714	ED	On-Demand	Bother	BIRC2	40	37
CC(=O)[C@@](C)(O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450609725	FD	On-Demand	Anodyne	GNAI1	0	46
CC(=O)[C@@](C)(O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450609725	FD	On-Demand	Anodyne	GNAI3	0	46
CC(=O)[C@@](C)(O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450609725	FD	On-Demand	Anodyne	GNAO1	0	46
CC(=O)[C@](C)(O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450609726	FD	On-Demand	Anodyne	GNAI1	0	46
CC(=O)[C@](C)(O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450609726	FD	On-Demand	Anodyne	GNAI3	0	46
CC(=O)[C@](C)(O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450609726	FD	On-Demand	Anodyne	GNAO1	0	46
COc1cc(OC)cc(-c2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450609727	EG	On-Demand	Anodyne	TYMS	0	40
COc1cc(OC)cc(-c2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450609727	EG	On-Demand	Anodyne	GSK3B	0	46
COc1cc(OC)cc(-c2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450609727	EG	On-Demand	Anodyne	GSK3A	36	44
COc1cc(OC)cc(-c2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450609727	EG	On-Demand	Anodyne	TERT	24	40
COC(=O)c1ccc(CN(CCc2nccs2)C(C)C)cc1Cl	ZINC000450609735	FI	On-Demand	Anodyne	GRIN1	33	42
FC(F)(F)c1ccc(N2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450609742	FG	On-Demand	Anodyne	DRD4	15	46
O=S(=O)(NCC1CC1)c1ccc(NCc2cccc(C(F)(F)F)n2)nc1	ZINC000450609745	GE	On-Demand	Anodyne	NPY1R	45	36
O=S(=O)(NCC1CC1)c1ccc(NCc2cccc(C(F)(F)F)n2)nc1	ZINC000450609745	GE	On-Demand	Anodyne	NPY2R	73	42
O=S(=O)(NCC1CC1)c1ccc(NCc2cccc(C(F)(F)F)n2)nc1	ZINC000450609745	GE	On-Demand	Anodyne	NPY5R	21	42
O=S(=O)(NCC1CC1)c1ccc(NCc2cccc(C(F)(F)F)n2)nc1	ZINC000450609745	GE	On-Demand	Anodyne	ADAMTS5	23	40
CCOc1nc2ccc(C(=O)NCCc3ccn(C)n3)cc2[nH]1	ZINC000450609750	DD	On-Demand	Anodyne	DRD4	40	31
CCOc1nc2ccc(C(=O)NCCc3ccn(C)n3)cc2[nH]1	ZINC000450609750	DD	On-Demand	Anodyne	F9	28	40
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)CCC3)C(=O)N1	ZINC000450609753	DC	On-Demand	Anodyne	P2RY12	31	44
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)CCC3)C(=O)N1	ZINC000450609753	DC	On-Demand	Anodyne	CVIR	0	40
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)CCC3)C(=O)N1	ZINC000450609754	DC	On-Demand	Anodyne	P2RY12	31	44
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)CCC3)C(=O)N1	ZINC000450609754	DC	On-Demand	Anodyne	CVIR	0	40
CCNS(=O)(=O)c1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450609761	EB	On-Demand	Anodyne	AKR1C3	17	41
CCNS(=O)(=O)c1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450609763	EB	On-Demand	Anodyne	AKR1C3	17	41
CN1C[C@@H](NC(=O)COc2cccc3ccccc23)C(=O)N1	ZINC000450609764	CC	On-Demand	Anodyne	GUAB	0	45
CN1C[C@@H](NC(=O)COc2cccc3ccccc23)C(=O)N1	ZINC000450609764	CC	On-Demand	Anodyne	CAPN2	31	43
CN1C[C@H](NC(=O)COc2cccc3ccccc23)C(=O)N1	ZINC000450609765	CC	On-Demand	Anodyne	GUAB	0	45
CN1C[C@H](NC(=O)COc2cccc3ccccc23)C(=O)N1	ZINC000450609765	CC	On-Demand	Anodyne	CAPN2	31	43
CCS(=O)(=O)c1ccc(CNC(C)(C)CN(C)Cc2ccccc2)cc1	ZINC000450609767	FG	On-Demand	Anodyne	RORC	27	44
CCN(C(=O)CC1CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609777	EH	On-Demand	Anodyne	ACHE	36	44
CCN(C(=O)CC1CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609777	EH	On-Demand	Anodyne	OPRD1	15	42
CCN(C(=O)CC1CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609777	EH	On-Demand	Anodyne	SIGMAR1	52	45
CCN(C(=O)CC1CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609777	EH	On-Demand	Anodyne	CCR5	63	45
CCN(C(=O)CC1CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609779	EH	On-Demand	Anodyne	ACHE	36	44
CCN(C(=O)CC1CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609779	EH	On-Demand	Anodyne	OPRD1	15	42
CCN(C(=O)CC1CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609779	EH	On-Demand	Anodyne	SIGMAR1	52	45
CCN(C(=O)CC1CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609779	EH	On-Demand	Anodyne	CCR5	63	45
CCN(C(=O)[C@H](C)Oc1ccccn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609781	FF	On-Demand	Anodyne	DRD3	23	48
CCN(C(=O)[C@@H](C)Oc1ccccn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609782	FF	On-Demand	Anodyne	DRD3	23	48
CCN(C(=O)[C@@H](C)Oc1ccccn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450609783	FF	On-Demand	Anodyne	DRD3	23	48
CCN(C(=O)[C@H](C)Oc1ccccn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450609784	FF	On-Demand	Anodyne	DRD3	23	48
CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609785	EC	On-Demand	Anodyne	DAC	43	31
CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609787	EC	On-Demand	Anodyne	DAC	43	31
CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609788	EC	On-Demand	Anodyne	DAC	43	31
CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609789	EC	On-Demand	Anodyne	DAC	43	31
CN1C[C@@H](NC(=O)CCc2ccc3c(c2)OCCO3)C(=O)N1	ZINC000450609795	DB	On-Demand	Anodyne	LUXR	74	56
CN1C[C@@H](NC(=O)CCc2ccc3c(c2)OCCO3)C(=O)N1	ZINC000450609795	DB	On-Demand	Anodyne	TRAR	45	42
CN1C[C@@H](NC(=O)CCc2ccc3c(c2)OCCO3)C(=O)N1	ZINC000450609795	DB	On-Demand	Anodyne	LASR	39	42
CN1C[C@H](NC(=O)CCc2ccc3c(c2)OCCO3)C(=O)N1	ZINC000450609799	DB	On-Demand	Anodyne	LUXR	74	56
CN1C[C@H](NC(=O)CCc2ccc3c(c2)OCCO3)C(=O)N1	ZINC000450609799	DB	On-Demand	Anodyne	TRAR	45	42
CN1C[C@H](NC(=O)CCc2ccc3c(c2)OCCO3)C(=O)N1	ZINC000450609799	DB	On-Demand	Anodyne	LASR	39	42
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450609800	CB	On-Demand	Bother	KCNMA1	25	42
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450609812	CB	On-Demand	Bother	KCNMA1	25	42
CN1C[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)N1	ZINC000450609820	DC	On-Demand	Bother	NMBR	60	32
CN1C[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)N1	ZINC000450609821	DC	On-Demand	Bother	NMBR	60	32
CC(=O)N[C@H](C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1)C(C)(C)C	ZINC000450609827	FG	On-Demand	Anodyne	ADAM17	0	41
CN1C[C@@H](NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)C(=O)N1	ZINC000450609828	FD	On-Demand	Anodyne	LTA4H	59	44
CN1C[C@@H](NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)C(=O)N1	ZINC000450609828	FD	On-Demand	Anodyne	CYSLTR2	56	35
CN1C[C@@H](NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)C(=O)N1	ZINC000450609828	FD	On-Demand	Anodyne	TRAR	44	36
CN1C[C@@H](NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)C(=O)N1	ZINC000450609828	FD	On-Demand	Anodyne	PHZR	0	44
CN1C[C@H](NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)C(=O)N1	ZINC000450609833	FD	On-Demand	Anodyne	LTA4H	59	44
CN1C[C@H](NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)C(=O)N1	ZINC000450609833	FD	On-Demand	Anodyne	CYSLTR2	56	35
CN1C[C@H](NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)C(=O)N1	ZINC000450609833	FD	On-Demand	Anodyne	TRAR	44	36
CN1C[C@H](NC(=O)Cc2ccc(OCCOc3ccccc3)cc2)C(=O)N1	ZINC000450609833	FD	On-Demand	Anodyne	PHZR	0	44
Clc1ccccc1OC1CCN(Cc2cnns2)CC1	ZINC000450609840	DG	On-Demand	Anodyne	SCN5A	49	35
Clc1ccccc1OC1CCN(Cc2cnns2)CC1	ZINC000450609840	DG	On-Demand	Anodyne	SCD1	46	45
COCCOC1(CNc2cc(C)nc3c(OC)cccc23)CCOCC1	ZINC000450609847	FG	On-Demand	Anodyne	BDKRB2	59	33
O=C1CCCN1Cc1nnc(SCCc2ccc(Cl)cc2)o1	ZINC000450609853	EG	On-Demand	Anodyne	SLC5A2	42	32
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450609855	GH	On-Demand	Anodyne	E1	0	41
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450609856	GH	On-Demand	Anodyne	E1	0	41
CN(Cc1cccnc1)C[C@@H]1CCC(F)(F)C1	ZINC000450609857	BF	On-Demand	Anodyne	NR1D1	41	34
CN(Cc1cccnc1)C[C@H]1CCC(F)(F)C1	ZINC000450609859	BF	On-Demand	Anodyne	NR1D1	41	34
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1cccc(C(=O)c2ccccc2)c1	ZINC000450609866	FD	On-Demand	Anodyne	BIRC8	42	32
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1cccc(C(=O)c2ccccc2)c1	ZINC000450609866	FD	On-Demand	Anodyne	SLC22A7	0	50
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1cccc(C(=O)c2ccccc2)c1	ZINC000450609870	FD	On-Demand	Anodyne	BIRC8	42	32
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1cccc(C(=O)c2ccccc2)c1	ZINC000450609870	FD	On-Demand	Anodyne	SLC22A7	0	50
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1cccc(C(=O)c2ccccc2)c1	ZINC000450609872	FD	On-Demand	Anodyne	BIRC8	42	32
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1cccc(C(=O)c2ccccc2)c1	ZINC000450609872	FD	On-Demand	Anodyne	SLC22A7	0	50
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1cccc(C(=O)c2ccccc2)c1	ZINC000450609873	FD	On-Demand	Anodyne	BIRC8	42	32
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1cccc(C(=O)c2ccccc2)c1	ZINC000450609873	FD	On-Demand	Anodyne	SLC22A7	0	50
COc1cccc(-n2c(C)nnc2SCC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450609878	GC	On-Demand	Anodyne	TGM2	20	40
Cc1nc(C(C)C)oc1CSc1nc2ccccc2c(=O)n1CCCO	ZINC000450609881	FG	On-Demand	Anodyne	SLC16A1	49	35
Cc1c(CC(=O)N[C@H]2CN(C)NC2=O)cccc1[N+](=O)[O-]	ZINC000450609887	CB	On-Demand	Bother	COLA	56	32
COc1cccc(-n2c(C)nnc2SCC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450609888	GC	On-Demand	Anodyne	TGM2	20	40
COc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1OC(C)C	ZINC000450609889	FI	On-Demand	Anodyne	TSHR	53	33
COc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1OC(C)C	ZINC000450609889	FI	On-Demand	Anodyne	CFTR	18	42
COc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1OC(C)C	ZINC000450609889	FI	On-Demand	Anodyne	C5AR1	0	41
COc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1OC(C)C	ZINC000450609889	FI	On-Demand	Anodyne	ENPP1	71	34
Cc1c(CC(=O)N[C@@H]2CN(C)NC2=O)cccc1[N+](=O)[O-]	ZINC000450609890	CB	On-Demand	Bother	COLA	56	32
COc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1OC(C)C	ZINC000450609892	FI	On-Demand	Anodyne	TSHR	53	33
COc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1OC(C)C	ZINC000450609892	FI	On-Demand	Anodyne	CFTR	18	42
COc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1OC(C)C	ZINC000450609892	FI	On-Demand	Anodyne	C5AR1	0	41
COc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1OC(C)C	ZINC000450609892	FI	On-Demand	Anodyne	ENPP1	71	34
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450609893	FH	On-Demand	Anodyne	PDE4D	15	41
FC(F)(F)Cn1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000450609900	FH	On-Demand	Anodyne	SCD1	30	40
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450609901	FH	On-Demand	Anodyne	PDE4D	15	41
Cc1cccc(C)c1[C@@H](C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450609902	FH	On-Demand	Anodyne	PDE4D	15	41
FC(F)(F)Cn1ccc(CN2CC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000450609903	FH	On-Demand	Anodyne	SCD1	30	40
Cc1cccc(C)c1[C@H](C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450609904	FH	On-Demand	Anodyne	PDE4D	15	41
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	ACE	57	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	MME	75	35
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	FCER2	51	31
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	CTSB	41	35
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	PAPA1_CARPA	43	38
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	CYSP_TRYCR	50	40
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	CTSK	23	41
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	CTSL	49	44
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	NPFFR2	56	34
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	TIMP3	64	34
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	SCN9A	0	41
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	ACE2	56	34
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	CTSV	43	30
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	C5AR1	47	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	FPR1	41	35
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	BLA1_STEMA	54	33
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	BRCA1	51	31
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609908	FC	On-Demand	Anodyne	NPFFR1	44	33
COc1cc(CN2CCC[C@H](Cn3ccnn3)C2)ccc1Cl	ZINC000450609909	DF	On-Demand	Anodyne	SSTR5	41	37
COc1cc(CN2CCC[C@@H](Cn3ccnn3)C2)ccc1Cl	ZINC000450609910	DF	On-Demand	Anodyne	SSTR5	41	37
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	ACE	57	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	MME	75	35
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	FCER2	51	31
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	CTSB	41	35
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	PAPA1_CARPA	43	38
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	CYSP_TRYCR	50	40
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	CTSK	23	41
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	CTSL	49	44
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	NPFFR2	56	34
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	TIMP3	64	34
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	SCN9A	0	41
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	ACE2	56	34
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	CTSV	43	30
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	C5AR1	47	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	FPR1	41	35
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	BLA1_STEMA	54	33
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	BRCA1	51	31
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609916	FC	On-Demand	Anodyne	NPFFR1	44	33
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	ACE	57	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	MME	75	35
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	FCER2	51	31
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	CTSB	41	35
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	PAPA1_CARPA	43	38
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	CYSP_TRYCR	50	40
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	CTSK	23	41
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	CTSL	49	44
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	NPFFR2	56	34
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	TIMP3	64	34
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	SCN9A	0	41
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	ACE2	56	34
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	CTSV	43	30
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	C5AR1	47	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	FPR1	41	35
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	BLA1_STEMA	54	33
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	BRCA1	51	31
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609918	FC	On-Demand	Anodyne	NPFFR1	44	33
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	ACE	57	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	MME	75	35
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	FCER2	51	31
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	CTSB	41	35
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	PAPA1_CARPA	43	38
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	CYSP_TRYCR	50	40
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	CTSK	23	41
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	CTSL	49	44
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	NPFFR2	56	34
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	TIMP3	64	34
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	SCN9A	0	41
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	ACE2	56	34
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	CTSV	43	30
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	C5AR1	47	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	FPR1	41	35
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	BLA1_STEMA	54	33
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	BRCA1	51	31
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccco2)C(=O)N1	ZINC000450609919	FC	On-Demand	Anodyne	NPFFR1	44	33
CC(=O)[C@](C)(O)CN1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000450609923	FF	On-Demand	Anodyne	INHA	26	49
O[C@H]1CCN(Cc2cc(CN3CC[C@@H](O)C3)cc(C(F)(F)F)c2)C1	ZINC000450609927	ED	On-Demand	Anodyne	TACR1	24	41
O[C@H]1CCN(Cc2cc(CN3CC[C@@H](O)C3)cc(C(F)(F)F)c2)C1	ZINC000450609927	ED	On-Demand	Anodyne	MCHR1	18	43
CCCC[C@@H](NC(=O)c1cn(-c2cccnc2)nn1)C(=O)OC	ZINC000450609938	DD	On-Demand	Anodyne	P2RY12	88	33
CCCC[C@H](NC(=O)c1cn(-c2cccnc2)nn1)C(=O)OC	ZINC000450609939	DD	On-Demand	Anodyne	P2RY12	88	33
CCCOc1ccc(C(=O)N(CC)CCC2CC2)c(OC)c1	ZINC000450609952	DH	On-Demand	Anodyne	ACKR3	61	31
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)n2cccn2)C(=O)N1	ZINC000450609962	CB	On-Demand	Anodyne	BIRC8	41	33
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)n2cccn2)C(=O)N1	ZINC000450609966	CB	On-Demand	Anodyne	BIRC8	41	33
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)n2cccn2)C(=O)N1	ZINC000450609967	CB	On-Demand	Anodyne	BIRC8	41	33
CN1C[C@H](NC(=O)[C@H](c2ccccc2)n2cccn2)C(=O)N1	ZINC000450609968	CB	On-Demand	Anodyne	BIRC8	41	33
CCCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1)C(=O)OC	ZINC000450609969	GF	On-Demand	Anodyne	P2RY12	128	33
CCCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1)C(=O)OC	ZINC000450609969	GF	On-Demand	Anodyne	CCKAR	0	41
CCCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1)C(=O)OC	ZINC000450609971	GF	On-Demand	Anodyne	P2RY12	128	33
CCCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1)C(=O)OC	ZINC000450609971	GF	On-Demand	Anodyne	CCKAR	0	41
CCCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1)C(=O)OC	ZINC000450609972	GF	On-Demand	Anodyne	P2RY12	128	33
CCCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1)C(=O)OC	ZINC000450609972	GF	On-Demand	Anodyne	CCKAR	0	41
CCCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1)C(=O)OC	ZINC000450609973	GF	On-Demand	Anodyne	P2RY12	128	33
CCCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1)C(=O)OC	ZINC000450609973	GF	On-Demand	Anodyne	CCKAR	0	41
CN1C[C@H](NC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450609992	GB	On-Demand	Anodyne	PLG	43	30
CN1C[C@H](NC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450609994	GB	On-Demand	Anodyne	PLG	43	30
CN1C[C@@H](NC(=O)[C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450609995	GB	On-Demand	Anodyne	PLG	43	30
CN1C[C@@H](NC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450609996	GB	On-Demand	Anodyne	PLG	43	30
CN1C[C@@H](NC(=O)CSCc2coc(-c3ccccc3)n2)C(=O)N1	ZINC000450609997	ED	On-Demand	Anodyne	PDE8B	50	32
CN1C[C@H](NC(=O)CSCc2coc(-c3ccccc3)n2)C(=O)N1	ZINC000450609998	ED	On-Demand	Anodyne	PDE8B	50	32
COC(=O)COc1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450610004	DB	On-Demand	Anodyne	DRD4	44	34
COC(=O)COc1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450610005	DB	On-Demand	Anodyne	DRD4	44	34
CCCC[C@@H](NC(=O)CCc1nc2cnccc2[nH]1)C(=O)OC	ZINC000450610014	DD	On-Demand	Anodyne	NOD1	85	35
CCCC[C@H](NC(=O)CCc1nc2cnccc2[nH]1)C(=O)OC	ZINC000450610015	DD	On-Demand	Anodyne	NOD1	85	35
CCCCc1ccc(C(=O)CCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610019	ED	On-Demand	Anodyne	THRA	33	44
CCCCc1ccc(C(=O)CCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610019	ED	On-Demand	Anodyne	THRB	0	44
CCCCc1ccc(C(=O)CCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610019	ED	On-Demand	Anodyne	CYP2J2	27	41
CCCCc1ccc(C(=O)CCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610019	ED	On-Demand	Anodyne	LUXR	41	33
CCCCc1ccc(C(=O)CCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610020	ED	On-Demand	Anodyne	THRA	33	44
CCCCc1ccc(C(=O)CCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610020	ED	On-Demand	Anodyne	THRB	0	44
CCCCc1ccc(C(=O)CCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610020	ED	On-Demand	Anodyne	CYP2J2	27	41
CCCCc1ccc(C(=O)CCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610020	ED	On-Demand	Anodyne	LUXR	41	33
CCCC[C@@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610021	CF	On-Demand	Anodyne	FOLH1	27	46
CCCC[C@@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610021	CF	On-Demand	Anodyne	PLA2G2C	0	41
CCCC[C@@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610021	CF	On-Demand	Anodyne	NMT1	23	47
CCCC[C@@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610021	CF	On-Demand	Anodyne	Q6UB75_PIG	0	43
CCCC[C@@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610021	CF	On-Demand	Anodyne	HDA106	0	41
CCCC[C@@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610021	CF	On-Demand	Anodyne	TLR2	0	42
CCCC[C@@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610021	CF	On-Demand	Anodyne	NOD1	117	51
CCCC[C@@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610021	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	41
CCCC[C@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610022	CF	On-Demand	Anodyne	FOLH1	27	46
CCCC[C@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610022	CF	On-Demand	Anodyne	PLA2G2C	0	41
CCCC[C@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610022	CF	On-Demand	Anodyne	NMT1	23	47
CCCC[C@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610022	CF	On-Demand	Anodyne	Q6UB75_PIG	0	43
CCCC[C@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610022	CF	On-Demand	Anodyne	HDA106	0	41
CCCC[C@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610022	CF	On-Demand	Anodyne	TLR2	0	42
CCCC[C@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610022	CF	On-Demand	Anodyne	NOD1	117	51
CCCC[C@H](NC(=O)CCCC(C)C)C(=O)OC	ZINC000450610022	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	41
COc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2ccncc2)cc1	ZINC000450610035	GH	On-Demand	Anodyne	WNT3A	23	51
COc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2ccncc2)cc1	ZINC000450610035	GH	On-Demand	Anodyne	AXIN2	0	41
Cn1c(SCCC(C)(F)F)nnc1-c1ccco1	ZINC000450610038	CG	On-Demand	Anodyne	DRD3	65	39
CC(C)(CNc1ccc(C#N)c(Cl)c1)c1ccccn1	ZINC000450610039	CH	On-Demand	Mild	MAP3K8	49	38
CC(=O)[C@@](C)(O)CN1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000450610041	FF	On-Demand	Anodyne	INHA	26	49
CC(C)N1CCCC[C@H]1CN1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000450610048	ED	On-Demand	Anodyne	HRH3	0	42
CC(C)N1CCCC[C@H]1CN1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000450610048	ED	On-Demand	Anodyne	L3MBTL1	0	40
CC(C)N1CCCC[C@H]1CN1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000450610048	ED	On-Demand	Anodyne	L3MBTL3	56	34
CC(C)N1CCCC[C@@H]1CN1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000450610049	ED	On-Demand	Anodyne	HRH3	0	42
CC(C)N1CCCC[C@@H]1CN1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000450610049	ED	On-Demand	Anodyne	L3MBTL1	0	40
CC(C)N1CCCC[C@@H]1CN1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000450610049	ED	On-Demand	Anodyne	L3MBTL3	56	34
COc1cc(CC(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)ccc1Cl	ZINC000450610058	GJ	On-Demand	Anodyne	TPSAB1	45	36
COc1cc(CC(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)ccc1Cl	ZINC000450610058	GJ	On-Demand	Anodyne	PFK	0	42
COc1cc(CC(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)ccc1Cl	ZINC000450610058	GJ	On-Demand	Anodyne	IMDH_CRYPV	17	40
COC[C@@]1(C)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450610063	EG	On-Demand	Anodyne	PDE3A	42	32
COC[C@]1(C)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450610064	EG	On-Demand	Anodyne	PDE3A	42	32
CCC(C)(C)c1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610069	CD	On-Demand	Anodyne	NAAA	22	41
CCC(C)(C)c1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610070	CD	On-Demand	Anodyne	NAAA	22	41
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC000450610071	DC	On-Demand	Anodyne	MTR1B_CHICK	0	40
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC000450610071	DC	On-Demand	Anodyne	MTNR1A	27	44
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC000450610071	DC	On-Demand	Anodyne	MTNR1B	25	42
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC000450610076	DC	On-Demand	Anodyne	MTR1B_CHICK	0	40
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC000450610076	DC	On-Demand	Anodyne	MTNR1A	27	44
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC000450610076	DC	On-Demand	Anodyne	MTNR1B	25	42
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC000450610077	DC	On-Demand	Anodyne	MTR1B_CHICK	0	40
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC000450610077	DC	On-Demand	Anodyne	MTNR1A	27	44
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC000450610077	DC	On-Demand	Anodyne	MTNR1B	25	42
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC000450610079	DC	On-Demand	Anodyne	MTR1B_CHICK	0	40
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC000450610079	DC	On-Demand	Anodyne	MTNR1A	27	44
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC000450610079	DC	On-Demand	Anodyne	MTNR1B	25	42
CC1CCN(C(=O)c2ccc(NCC(C)(C)c3ccccn3)nc2)CC1	ZINC000450610098	FH	On-Demand	Anodyne	L3MBTL3	40	31
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	HTR1A	30	50
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	DRD2	34	48
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	DRD4	21	41
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	HTR2A	19	41
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	DRD3	51	48
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	HRH3	27	48
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	SIGMAR1	33	43
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	CCR3	31	41
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	CHRNA7	23	43
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	MTNR1A	15	40
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	CACNA1G	46	46
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	GNAI1	0	40
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	GNAI3	0	40
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	GNAO1	0	40
O=C(NCCCN1CCCCC1)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450610099	GG	On-Demand	Anodyne	TBK1	51	39
Cc1ccccc1-c1nnc(SCc2cn(C)nc2C)o1	ZINC000450610120	DG	On-Demand	Anodyne	TYMS	0	42
Cc1ccccc1-c1nnc(SCc2cn(C)nc2C)o1	ZINC000450610120	DG	On-Demand	Anodyne	ALOX15	47	32
COCCOC1(CNc2ncnc3c(OC)cc(OC)cc23)CCOCC1	ZINC000450610134	GD	On-Demand	Anodyne	PDE6A	40	30
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610142	DC	On-Demand	Anodyne	P2RY12	31	41
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610142	DC	On-Demand	Anodyne	EDNRB	46	37
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610142	DC	On-Demand	Anodyne	EDNRA	42	34
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610142	DC	On-Demand	Anodyne	DYRK2	51	32
CN1C[C@@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610142	DC	On-Demand	Anodyne	CVIR	0	44
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610143	DC	On-Demand	Anodyne	P2RY12	31	41
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610143	DC	On-Demand	Anodyne	EDNRB	46	37
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610143	DC	On-Demand	Anodyne	EDNRA	42	34
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610143	DC	On-Demand	Anodyne	DYRK2	51	32
CN1C[C@H](NC(=O)CCCOc2ccc3c(c2)OCO3)C(=O)N1	ZINC000450610143	DC	On-Demand	Anodyne	CVIR	0	44
CCn1nnc(C)c1CSc1nnc(-c2cc(OC)cc(OC)c2)o1	ZINC000450610157	FF	On-Demand	Anodyne	GSK3A	27	41
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	DRD2	16	42
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	DRD4	42	44
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	ACHE	42	48
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	OPRM1	16	43
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	DRD3	15	40
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	OPRD1	21	43
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	SIGMAR1	41	46
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	CCR3	29	41
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	CCR5	76	45
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	MLNR	43	35
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	CCR2	53	48
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610180	GH	On-Demand	Anodyne	CACNA1G	31	41
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	DRD2	16	42
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	DRD4	42	44
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	ACHE	42	48
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	OPRM1	16	43
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	DRD3	15	40
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	OPRD1	21	43
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	SIGMAR1	41	46
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	CCR3	29	41
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	CCR5	76	45
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	MLNR	43	35
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	CCR2	53	48
CCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610183	GH	On-Demand	Anodyne	CACNA1G	31	41
CN(Cc1cccnc1)Cc1cc(Cl)cc(CN(C)Cc2cccnc2)c1	ZINC000450610203	GI	On-Demand	Anodyne	NR1D1	48	44
COc1cc(CN(C)[C@H](C)CO)ccc1Cl	ZINC000450610205	BE	On-Demand	Anodyne	TTR	0	41
COCCOC1(CNc2ncnc3ccc(SC)cc23)CCOCC1	ZINC000450610210	FE	On-Demand	Anodyne	CLK4	50	35
OCCN1CCCC[C@H]1CNc1ccc2nnc(C(F)(F)F)n2n1	ZINC000450610218	EC	On-Demand	Anodyne	IKBKB	15	41
OCCN1CCCC[C@@H]1CNc1ccc2nnc(C(F)(F)F)n2n1	ZINC000450610219	EC	On-Demand	Anodyne	IKBKB	15	41
COc1cc(CSc2nnc(Cc3csc(C)n3)o2)ccc1Cl	ZINC000450610220	FI	On-Demand	Anodyne	CPB	0	53
COc1cc(CN(C)[C@@H](C)CO)ccc1Cl	ZINC000450610222	BE	On-Demand	Anodyne	TTR	0	41
N#CC1(CN2CCC(Oc3ccccc3Cl)CC2)CCC1	ZINC000450610223	DH	On-Demand	Mild	SCD1	21	42
Cc1ccc(F)c(CC(=O)NCCc2ccn(C)n2)c1	ZINC000450610231	CD	On-Demand	Anodyne	P2RX7	45	40
COC(=O)[C@@](C)(O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450610247	DC	On-Demand	Anodyne	CTSV	51	35
COC(=O)[C@@](C)(O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450610247	DC	On-Demand	Anodyne	MT-CYB	42	33
COC(=O)[C@](C)(O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450610248	DC	On-Demand	Anodyne	CTSV	51	35
COC(=O)[C@](C)(O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450610248	DC	On-Demand	Anodyne	MT-CYB	42	33
COC(=O)c1ccc(CN(C)CCN2C(=O)c3ccccc3C2=O)cc1Cl	ZINC000450610250	GF	On-Demand	Anodyne	ACHE	17	53
CN1C[C@@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)C(=O)N1	ZINC000450610275	GE	On-Demand	Anodyne	ALPL	44	35
CN1C[C@@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)C(=O)N1	ZINC000450610275	GE	On-Demand	Anodyne	DPP8	64	34
CN1C[C@@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)C(=O)N1	ZINC000450610275	GE	On-Demand	Anodyne	DPP9	65	34
CN1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)C(=O)N1	ZINC000450610276	GE	On-Demand	Anodyne	ALPL	44	35
CN1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)C(=O)N1	ZINC000450610276	GE	On-Demand	Anodyne	DPP8	64	34
CN1C[C@H](NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)C(=O)N1	ZINC000450610276	GE	On-Demand	Anodyne	DPP9	65	34
O=C(NCCO)c1ccc(NC[C@H]2CCC[C@H]2c2ccccc2)nn1	ZINC000450610286	ED	On-Demand	Anodyne	SCD1	33	41
O=C(NCCO)c1ccc(NC[C@@H]2CCC[C@H]2c2ccccc2)nn1	ZINC000450610287	ED	On-Demand	Anodyne	SCD1	33	41
O=C(NCCO)c1ccc(NC[C@H]2CCC[C@@H]2c2ccccc2)nn1	ZINC000450610288	ED	On-Demand	Anodyne	SCD1	33	41
O=C(NCCO)c1ccc(NC[C@@H]2CCC[C@@H]2c2ccccc2)nn1	ZINC000450610290	ED	On-Demand	Anodyne	SCD1	33	41
CN1C[C@@H](NC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)C(=O)N1	ZINC000450610298	GB	On-Demand	Anodyne	EPHX2	45	64
CN1C[C@H](NC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)C(=O)N1	ZINC000450610300	GB	On-Demand	Anodyne	EPHX2	45	64
c1ccc2c(c1)CC[C@]21CN(Cc2cn(CC3CC3)nn2)CCO1	ZINC000450610349	DE	On-Demand	Anodyne	SIGMAR1	15	45
c1ccc2c(c1)CC[C@@]21CN(Cc2cn(CC3CC3)nn2)CCO1	ZINC000450610351	DE	On-Demand	Anodyne	SIGMAR1	15	45
COc1ccc(CC(=O)NCc2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)cc1	ZINC000450610357	GC	On-Demand	Anodyne	SSTR3	21	45
COc1ccc(CC(=O)NCc2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)cc1	ZINC000450610357	GC	On-Demand	Anodyne	CA9	19	47
COc1ccc(CC(=O)NCc2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)cc1	ZINC000450610357	GC	On-Demand	Anodyne	NAAA	22	40
COc1ccc(CC(=O)NCc2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)cc1	ZINC000450610357	GC	On-Demand	Anodyne	PHZR	0	40
COc1ccc(CC(=O)NCc2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)cc1	ZINC000450610360	GC	On-Demand	Anodyne	SSTR3	21	45
COc1ccc(CC(=O)NCc2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)cc1	ZINC000450610360	GC	On-Demand	Anodyne	CA9	19	47
COc1ccc(CC(=O)NCc2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)cc1	ZINC000450610360	GC	On-Demand	Anodyne	NAAA	22	40
COc1ccc(CC(=O)NCc2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)cc1	ZINC000450610360	GC	On-Demand	Anodyne	PHZR	0	40
CCCC[C@@H](NC(=O)[C@H]1CCCN(C)C1=O)C(=O)OC	ZINC000450610367	CC	On-Demand	Anodyne	TRHR	47	34
Cc1cc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)ncc1C(N)=O	ZINC000450610372	GD	On-Demand	Anodyne	NOD2	40	35
CCCC[C@H](NC(=O)[C@H]1CCCN(C)C1=O)C(=O)OC	ZINC000450610373	CC	On-Demand	Anodyne	TRHR	47	34
CCCC[C@H](NC(=O)[C@@H]1CCCN(C)C1=O)C(=O)OC	ZINC000450610374	CC	On-Demand	Anodyne	TRHR	47	34
CCCC[C@@H](NC(=O)[C@@H]1CCCN(C)C1=O)C(=O)OC	ZINC000450610375	CC	On-Demand	Anodyne	TRHR	47	34
CC(=O)[C@@](C)(O)CN1CCC[C@@H](COc2ccccc2Cl)C1	ZINC000450610386	EF	On-Demand	Anodyne	SLC6A1	60	35
CC(=O)[C@](C)(O)CN1CCC[C@@H](COc2ccccc2Cl)C1	ZINC000450610388	EF	On-Demand	Anodyne	SLC6A1	60	35
CC(=O)[C@](C)(O)CN1CCC[C@H](COc2ccccc2Cl)C1	ZINC000450610389	EF	On-Demand	Anodyne	SLC6A1	60	35
Cc1nc(CNc2ccc(S(C)(=O)=O)cc2)sc1Br	ZINC000450610393	FG	On-Demand	Anodyne	GHSR	16	44
C[C@@H](Sc1nc2ccccc2c(=O)n1CCCO)C(=O)C1CCOCC1	ZINC000450610418	GE	On-Demand	Anodyne	SLC16A1	46	35
C[C@H](Sc1nc2ccccc2c(=O)n1CCCO)C(=O)C1CCOCC1	ZINC000450610419	GE	On-Demand	Anodyne	SLC16A1	46	35
CCc1cc(NC[C@H](Cc2ccccc2)OC)n2ncnc2n1	ZINC000450610420	DE	On-Demand	Anodyne	DHOD	0	54
CCc1cc(NC[C@@H](Cc2ccccc2)OC)n2ncnc2n1	ZINC000450610421	DE	On-Demand	Anodyne	DHOD	0	54
Cc1ccccc1-n1c(C)nnc1SCCC(C)(F)F	ZINC000450610423	CI	On-Demand	Anodyne	SLC6A5	17	43
CN1C[C@@H](NC(=O)CCSc2ccccn2)C(=O)N1	ZINC000450610432	CC	On-Demand	Anodyne	FAS	19	42
CN1C[C@H](NC(=O)CCSc2ccccn2)C(=O)N1	ZINC000450610433	CC	On-Demand	Anodyne	FAS	19	42
CN1C[C@@H](NC(=O)CCCc2cc(F)ccc2F)C(=O)N1	ZINC000450610438	CC	On-Demand	Anodyne	MPO	24	41
CN1C[C@H](NC(=O)CCCc2cc(F)ccc2F)C(=O)N1	ZINC000450610439	CC	On-Demand	Anodyne	MPO	24	41
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	DRD2	19	44
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	DRD4	42	44
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	ACHE	32	46
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	OPRM1	0	43
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	DRD3	30	45
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	OPRK1	28	41
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	SIGMAR1	45	44
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	SSTR5	67	38
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	CCR5	51	50
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	MCHR1	34	42
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	CCR8	29	42
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	MBTPS1	57	40
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610444	FG	On-Demand	Anodyne	RORC	46	36
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	DRD2	19	44
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	DRD4	42	44
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	ACHE	32	46
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	OPRM1	0	43
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	DRD3	30	45
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	OPRK1	28	41
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	SIGMAR1	45	44
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	SSTR5	67	38
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	CCR5	51	50
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	MCHR1	34	42
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	CCR8	29	42
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	MBTPS1	57	40
CCN(C(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610445	FG	On-Demand	Anodyne	RORC	46	36
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610447	EF	On-Demand	Mild	DRD4	25	41
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610447	EF	On-Demand	Mild	SIGMAR1	29	40
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610448	EF	On-Demand	Mild	DRD4	25	41
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610448	EF	On-Demand	Mild	SIGMAR1	29	40
COC(=O)[C@@](C)(O)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450610450	EC	On-Demand	Bother	CACNA1D	80	34
COC(=O)[C@](C)(O)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450610451	EC	On-Demand	Bother	CACNA1D	80	34
CCN(C(=O)Cn1ccc(C)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610452	EE	On-Demand	Anodyne	ACHE	25	41
CCN(C(=O)Cn1ccc(C)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610452	EE	On-Demand	Anodyne	SIGMAR1	39	41
CCN(C(=O)Cn1ccc(C)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610452	EE	On-Demand	Anodyne	CCR5	42	40
CCN(C(=O)Cn1ccc(C)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610453	EE	On-Demand	Anodyne	ACHE	25	41
CCN(C(=O)Cn1ccc(C)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610453	EE	On-Demand	Anodyne	SIGMAR1	39	41
CCN(C(=O)Cn1ccc(C)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610453	EE	On-Demand	Anodyne	CCR5	42	40
COc1ccc(Cc2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450610460	GH	On-Demand	Anodyne	PTK2	0	45
CCN(C(=O)CCc1nc2cnccc2[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610462	GG	On-Demand	Anodyne	CCR5	33	40
CCN(C(=O)CCc1nc2cnccc2[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610463	GG	On-Demand	Anodyne	CCR5	33	40
CCc1cc(CCCN2CC[C@H](Oc3ccccc3Cl)C2)on1	ZINC000450610464	EH	On-Demand	Anodyne	SCD1	25	40
CCc1cc(CCCN2CC[C@@H](Oc3ccccc3Cl)C2)on1	ZINC000450610465	EH	On-Demand	Anodyne	SCD1	25	40
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610467	FG	On-Demand	Anodyne	SIGMAR1	44	49
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610467	FG	On-Demand	Anodyne	CCR3	32	42
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610467	FG	On-Demand	Anodyne	CCR5	52	50
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610467	FG	On-Demand	Anodyne	MLNR	55	36
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610467	FG	On-Demand	Anodyne	MCHR1	24	41
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610468	FG	On-Demand	Anodyne	SIGMAR1	44	49
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610468	FG	On-Demand	Anodyne	CCR3	32	42
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610468	FG	On-Demand	Anodyne	CCR5	52	50
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610468	FG	On-Demand	Anodyne	MLNR	55	36
CCN(C(=O)Cc1ccc(O)c(F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610468	FG	On-Demand	Anodyne	MCHR1	24	41
CN1C[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450610469	CC	On-Demand	Anodyne	LUXR	43	42
CN1C[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450610469	CC	On-Demand	Anodyne	TRAR	29	42
CN1C[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450610470	CC	On-Demand	Anodyne	LUXR	43	42
CN1C[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450610470	CC	On-Demand	Anodyne	TRAR	29	42
COC(=O)[C@](C)(O)CNC(=O)c1ccc(C(C)(F)F)cc1	ZINC000450610493	DD	On-Demand	Anodyne	TRPV1	15	41
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(C)(F)F)cc1	ZINC000450610494	DD	On-Demand	Anodyne	TRPV1	15	41
COc1cccc(-n2cc(C(=O)NCCc3ccn(C)n3)nn2)c1	ZINC000450610495	EC	On-Demand	Anodyne	DRD4	51	39
Cc1cc(F)c(CC(=O)NCCc2ccn(C)n2)cc1F	ZINC000450610508	CD	On-Demand	Anodyne	P2RX7	43	37
CC(=O)c1cccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610513	FJ	On-Demand	Anodyne	DRD2	16	41
CC(=O)c1cccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610513	FJ	On-Demand	Anodyne	SLC6A1	40	35
CC(=O)c1cccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610513	FJ	On-Demand	Anodyne	SSTR5	44	39
CC(=O)c1cccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610513	FJ	On-Demand	Anodyne	CCR3	80	41
CC(=O)c1cccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610513	FJ	On-Demand	Anodyne	MCHR1	32	41
CC(=O)c1cccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610514	FJ	On-Demand	Anodyne	DRD2	16	41
CC(=O)c1cccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610514	FJ	On-Demand	Anodyne	SLC6A1	40	35
CC(=O)c1cccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610514	FJ	On-Demand	Anodyne	SSTR5	44	39
CC(=O)c1cccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610514	FJ	On-Demand	Anodyne	CCR3	80	41
CC(=O)c1cccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c1	ZINC000450610514	FJ	On-Demand	Anodyne	MCHR1	32	41
COc1ccc(Cc2nnc(SCc3cn(CC4CC4)nn3)o2)cc1	ZINC000450610515	FF	On-Demand	Anodyne	PTK2	0	47
CCC(=O)CCCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450610516	CH	On-Demand	Anodyne	SLC6A1	94	37
CCC(=O)CCCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450610516	CH	On-Demand	Anodyne	HTR4	44	35
CCC(=O)CCCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450610516	CH	On-Demand	Anodyne	CYP2J2	50	36
CCC(=O)CCCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450610516	CH	On-Demand	Anodyne	SCD1	33	42
CCC(=O)CCCN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450610516	CH	On-Demand	Anodyne	SCD	17	42
CCC(=O)CCCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450610517	CH	On-Demand	Anodyne	SLC6A1	94	37
CCC(=O)CCCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450610517	CH	On-Demand	Anodyne	HTR4	44	35
CCC(=O)CCCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450610517	CH	On-Demand	Anodyne	CYP2J2	50	36
CCC(=O)CCCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450610517	CH	On-Demand	Anodyne	SCD1	33	42
CCC(=O)CCCN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450610517	CH	On-Demand	Anodyne	SCD	17	42
FC(F)(F)Cn1ccc(CN2CCN(c3ccc(C(F)(F)F)cc3)CC2)n1	ZINC000450610518	GH	On-Demand	Anodyne	DRD4	19	46
C[C@@H](CN1CCN(C2c3ccccc3-c3ccccc32)CC1)S(C)(=O)=O	ZINC000450610523	FF	On-Demand	Anodyne	INHA	23	43
C[C@H](CN1CCN(C2c3ccccc3-c3ccccc32)CC1)S(C)(=O)=O	ZINC000450610524	FF	On-Demand	Anodyne	INHA	23	43
CC(=O)[C@@](C)(O)CN1CCC[C@H](COc2ccccc2Cl)C1	ZINC000450610525	EF	On-Demand	Anodyne	SLC6A1	60	35
COc1cccc(-c2cc(C(=O)N[C@@H]3CN(C)NC3=O)n[nH]2)c1	ZINC000450610526	DC	On-Demand	Anodyne	DRD4	40	31
COc1cccc(-c2cc(C(=O)N[C@@H]3CN(C)NC3=O)n[nH]2)c1	ZINC000450610526	DC	On-Demand	Anodyne	TUBB2B	23	40
COc1cccc(-c2cc(C(=O)N[C@@H]3CN(C)NC3=O)n[nH]2)c1	ZINC000450610526	DC	On-Demand	Anodyne	TUBA1A	24	40
COc1cccc(-c2cc(C(=O)N[C@H]3CN(C)NC3=O)n[nH]2)c1	ZINC000450610528	DC	On-Demand	Anodyne	DRD4	40	31
COc1cccc(-c2cc(C(=O)N[C@H]3CN(C)NC3=O)n[nH]2)c1	ZINC000450610528	DC	On-Demand	Anodyne	TUBB2B	23	40
COc1cccc(-c2cc(C(=O)N[C@H]3CN(C)NC3=O)n[nH]2)c1	ZINC000450610528	DC	On-Demand	Anodyne	TUBA1A	24	40
CCN(C(=O)c1cnn2ccc(C)cc12)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450610532	FG	On-Demand	Anodyne	EPHB3	31	43
CCN(C(=O)c1cnn2ccc(C)cc12)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450610535	FG	On-Demand	Anodyne	EPHB3	31	43
COc1ccc(NC(=O)C2(C(=O)C3CC3)CC2)cc1OC(C)C	ZINC000450610537	DG	On-Demand	Anodyne	ENPP1	55	32
CN1C[C@@H](NC(=O)COc2ccc(F)cc2Cl)C(=O)N1	ZINC000450610552	DC	On-Demand	Anodyne	P2RX7	44	42
CN1C[C@H](NC(=O)COc2ccc(F)cc2Cl)C(=O)N1	ZINC000450610553	DC	On-Demand	Anodyne	P2RX7	44	42
CC(C)N1C(=O)C(=O)N(CCc2ccc(Cl)cc2)C1=O	ZINC000450610554	CE	On-Demand	Anodyne	CACNA1C	28	44
CC(C)N1C(=O)C(=O)N(CCc2ccc(Cl)cc2)C1=O	ZINC000450610554	CE	On-Demand	Anodyne	CACNA1D	80	54
COc1ccc(NC(=O)c2cccc(C(F)(F)F)n2)cc1OC(C)C	ZINC000450610564	FI	On-Demand	Anodyne	GRM4	38	47
COc1ccc(NC(=O)c2cccc(C(F)(F)F)n2)cc1OC(C)C	ZINC000450610564	FI	On-Demand	Anodyne	SHH	36	41
COc1ccc(NC(=O)c2cccc(C(F)(F)F)n2)cc1OC(C)C	ZINC000450610564	FI	On-Demand	Anodyne	SCD1	0	40
COc1ccc(NC(=O)c2cccc(C(F)(F)F)n2)cc1OC(C)C	ZINC000450610564	FI	On-Demand	Anodyne	ENPP1	78	37
COc1ccc(NC(=O)c2cccc(C(F)(F)F)n2)cc1OC(C)C	ZINC000450610564	FI	On-Demand	Anodyne	KCNK3	55	43
COc1ccc(NC(=O)c2cccc(C(F)(F)F)n2)cc1OC(C)C	ZINC000450610564	FI	On-Demand	Anodyne	KCNK9	51	43
CCOC(=O)c1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)[nH]c1C	ZINC000450610567	FH	On-Demand	Anodyne	ENPP1	65	38
CCOC(=O)c1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)[nH]c1C	ZINC000450610567	FH	On-Demand	Anodyne	KCNK3	50	38
CCOC(=O)c1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)[nH]c1C	ZINC000450610567	FH	On-Demand	Anodyne	KCNK9	42	38
CCOc1ccc(OCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610589	DC	On-Demand	Anodyne	P2RY12	27	41
CCOc1ccc(OCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610589	DC	On-Demand	Anodyne	PHZR	0	44
CCOc1ccc(OCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610589	DC	On-Demand	Anodyne	CVIR	0	47
CCOc1ccc(OCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610591	DC	On-Demand	Anodyne	P2RY12	27	41
CCOc1ccc(OCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610591	DC	On-Demand	Anodyne	PHZR	0	44
CCOc1ccc(OCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610591	DC	On-Demand	Anodyne	CVIR	0	47
Cn1nc(-c2ccccc2)cc1C(=O)NCCC[C@@H]1CCCCO1	ZINC000450610592	EG	On-Demand	Anodyne	INHA	40	38
Cn1nc(-c2ccccc2)cc1C(=O)NCCC[C@@H]1CCCCO1	ZINC000450610592	EG	On-Demand	Anodyne	COLA	40	36
Cn1nc(-c2ccccc2)cc1C(=O)NCCC[C@@H]1CCCCO1	ZINC000450610592	EG	On-Demand	Anodyne	MGLL	0	40
Cn1nc(-c2ccccc2)cc1C(=O)NCCC[C@H]1CCCCO1	ZINC000450610593	EG	On-Demand	Anodyne	INHA	40	38
Cn1nc(-c2ccccc2)cc1C(=O)NCCC[C@H]1CCCCO1	ZINC000450610593	EG	On-Demand	Anodyne	COLA	40	36
Cn1nc(-c2ccccc2)cc1C(=O)NCCC[C@H]1CCCCO1	ZINC000450610593	EG	On-Demand	Anodyne	MGLL	0	40
COCCn1cc(C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc21	ZINC000450610595	DC	On-Demand	Anodyne	CNR1	24	54
COCCn1cc(C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc21	ZINC000450610595	DC	On-Demand	Anodyne	CNR2	38	54
COCCn1cc(C(=O)N[C@H]2CN(C)NC2=O)c2ccccc21	ZINC000450610596	DC	On-Demand	Anodyne	CNR1	24	54
COCCn1cc(C(=O)N[C@H]2CN(C)NC2=O)c2ccccc21	ZINC000450610596	DC	On-Demand	Anodyne	CNR2	38	54
Cc1nc(CNc2cc(C(F)(F)F)nc3ncnn23)sc1Br	ZINC000450610597	GG	On-Demand	Anodyne	DHOD	0	50
COc1ccc(C(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450610604	EB	On-Demand	Anodyne	ELANE	23	44
COc1ccc(C(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450610605	EB	On-Demand	Anodyne	ELANE	23	44
COc1ccc(C(=O)N[C@@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450610606	EB	On-Demand	Anodyne	ELANE	23	44
COc1ccc(C(=O)N[C@@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450610608	EB	On-Demand	Anodyne	ELANE	23	44
COc1cc(CN2CCC(Cn3ccnn3)CC2)ccc1Cl	ZINC000450610609	DF	On-Demand	Anodyne	HRH1	0	43
COc1cc(CN2CCC(Cn3ccnn3)CC2)ccc1Cl	ZINC000450610609	DF	On-Demand	Anodyne	SIGMAR1	23	40
COc1cc(CN2CCC(Cn3ccnn3)CC2)ccc1Cl	ZINC000450610609	DF	On-Demand	Anodyne	SSTR5	68	42
COc1cc(CN2CCC(Cn3ccnn3)CC2)ccc1Cl	ZINC000450610609	DF	On-Demand	Anodyne	CCR3	29	43
C[C@H](C#N)CN(Cc1cc(CN(C[C@@H](C)C#N)C2CC2)ccc1F)C1CC1	ZINC000450610613	FI	On-Demand	Mild	NOS2	16	45
COC(=O)c1csc(CN2CCC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000450610618	FH	On-Demand	Anodyne	SLC6A1	57	35
COC(=O)c1csc(CN2CCC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000450610618	FH	On-Demand	Anodyne	SCD1	26	40
C[C@H](C#N)CN(Cc1ccc(F)c(CN(C[C@H](C)C#N)C2CC2)c1)C1CC1	ZINC000450610619	FI	On-Demand	Mild	NOS2	16	45
COC(=O)c1csc(CN2CCC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000450610620	FH	On-Demand	Anodyne	SLC6A1	57	35
COC(=O)c1csc(CN2CCC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000450610620	FH	On-Demand	Anodyne	SCD1	26	40
C[C@@H](C#N)CN(Cc1ccc(F)c(CN(C[C@@H](C)C#N)C2CC2)c1)C1CC1	ZINC000450610621	FI	On-Demand	Mild	NOS2	16	45
C[C@H](C#N)CN(Cc1ccc(F)c(CN(C[C@@H](C)C#N)C2CC2)c1)C1CC1	ZINC000450610623	FI	On-Demand	Mild	NOS2	16	45
CC(=O)CCCCCSc1nnc(-c2ccccc2C)o1	ZINC000450610631	DI	On-Demand	Anodyne	TYMS	0	42
CC(=O)CCCCCSc1nnc(-c2ccccc2C)o1	ZINC000450610631	DI	On-Demand	Anodyne	ALOX15	63	38
COc1ccc(NC(=O)C(C)(C)OC(C)C)cc1OC(C)C	ZINC000450610632	DH	On-Demand	Anodyne	KCNK3	41	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1	ZINC000450610635	GG	On-Demand	Anodyne	TIMP3	80	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000450610637	GG	On-Demand	Anodyne	TIMP3	80	36
FC1(F)CC(CN2CCO[C@@]3(CCc4ccccc43)C2)C1	ZINC000450610638	CG	On-Demand	Anodyne	SIGMAR1	21	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000450610639	GG	On-Demand	Anodyne	TIMP3	80	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1	ZINC000450610640	GG	On-Demand	Anodyne	TIMP3	80	36
FC1(F)CC(CN2CCO[C@]3(CCc4ccccc43)C2)C1	ZINC000450610644	CG	On-Demand	Anodyne	SIGMAR1	21	44
COc1ccc(NC(=O)Cc2ccc(OC)c(OC)c2Cl)cc1OC(C)C	ZINC000450610651	GI	On-Demand	Anodyne	ENPP1	81	40
COc1ccc(NC(=O)Cc2ccc(OC)c(OC)c2Cl)cc1OC(C)C	ZINC000450610651	GI	On-Demand	Anodyne	IMDH_CRYPV	35	45
COc1ccc(NC(=O)c2scnc2C(C)C)cc1OC(C)C	ZINC000450610652	EI	On-Demand	Anodyne	GRM4	19	40
COc1ccc(NC(=O)c2scnc2C(C)C)cc1OC(C)C	ZINC000450610652	EI	On-Demand	Anodyne	ENPP1	75	36
COc1ccc(NC(=O)c2scnc2C(C)C)cc1OC(C)C	ZINC000450610652	EI	On-Demand	Anodyne	KCNK3	40	40
COc1ccc(NC(=O)c2scnc2C(C)C)cc1OC(C)C	ZINC000450610652	EI	On-Demand	Anodyne	KCNK9	35	40
CN1C[C@@H](NC(=O)CSCc2cccc(Cl)c2)C(=O)N1	ZINC000450610670	DD	On-Demand	Anodyne	CACNA2D1	0	43
CN1C[C@H](NC(=O)CSCc2cccc(Cl)c2)C(=O)N1	ZINC000450610671	DD	On-Demand	Anodyne	CACNA2D1	0	43
CCc1cc2c(NCc3cccc(C(F)(F)F)n3)ncnc2s1	ZINC000450610672	EI	On-Demand	Anodyne	CLK4	46	35
CCCC[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C(=O)OC	ZINC000450610676	EF	On-Demand	Anodyne	CTSK	38	42
CCCC[C@@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C(=O)OC	ZINC000450610678	EF	On-Demand	Anodyne	CTSK	38	42
CCCC[C@@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C(=O)OC	ZINC000450610680	EF	On-Demand	Anodyne	CTSK	38	42
CCCC[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C(=O)OC	ZINC000450610682	EF	On-Demand	Anodyne	CTSK	38	42
O=c1c2sc(-c3ccc(Cl)cc3)cc2ncn1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450610687	FI	On-Demand	Anodyne	MCHR1	38	44
O=c1c2sc(-c3ccc(Cl)cc3)cc2ncn1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450610690	FI	On-Demand	Anodyne	MCHR1	38	44
COc1ccc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1OC(C)C	ZINC000450610693	FH	On-Demand	Anodyne	SCN10A	20	41
COc1ccc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1OC(C)C	ZINC000450610693	FH	On-Demand	Anodyne	IMPDH2	0	43
COc1ccc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1OC(C)C	ZINC000450610693	FH	On-Demand	Anodyne	ENPP1	59	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@]2(OC(C)C)CCOC2)cc1	ZINC000450610715	EF	On-Demand	Anodyne	TIMP3	41	31
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@]2(OC(C)C)CCOC2)cc1	ZINC000450610716	EF	On-Demand	Anodyne	TIMP3	41	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@]2(OC(C)C)CCOC2)cc1	ZINC000450610717	EF	On-Demand	Anodyne	TIMP3	41	31
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@]2(OC(C)C)CCOC2)cc1	ZINC000450610718	EF	On-Demand	Anodyne	TIMP3	41	31
CSc1cccc(C(=O)NCc2nc3ccccc3n2C2CC2)c1	ZINC000450610719	EI	On-Demand	Anodyne	PLD1	49	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@H]2CCOC[C@H]2OC)cc1	ZINC000450610721	EE	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@@H]2CCOC[C@@H]2OC)cc1	ZINC000450610722	EE	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@@H]2CCOC[C@H]2OC)cc1	ZINC000450610723	EE	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@H]2CCOC[C@@H]2OC)cc1	ZINC000450610724	EE	On-Demand	Anodyne	TIMP3	40	31
CN1C[C@@H](NC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)C(=O)N1	ZINC000450610730	FB	On-Demand	Anodyne	NPY2R	69	38
CN1C[C@H](NC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)C(=O)N1	ZINC000450610733	FB	On-Demand	Anodyne	NPY2R	69	38
CCC(CC)(CNCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450610742	EF	On-Demand	Anodyne	PTPRB	53	36
CN1C[C@@H](NC(=O)CNC(=O)c2cc(-c3ccccc3)on2)C(=O)N1	ZINC000450610753	EB	On-Demand	Anodyne	HDAC10	19	46
CN1C[C@H](NC(=O)CNC(=O)c2cc(-c3ccccc3)on2)C(=O)N1	ZINC000450610754	EB	On-Demand	Anodyne	HDAC10	19	46
CCCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610764	DE	On-Demand	Anodyne	SSTR2	42	33
CCCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610764	DE	On-Demand	Anodyne	GHRHR	48	34
CCCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610764	DE	On-Demand	Anodyne	P2RY12	176	42
CCCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610764	DE	On-Demand	Anodyne	TRY1_BOVIN	49	34
CCCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610764	DE	On-Demand	Anodyne	CTSK	57	40
CCCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610766	DE	On-Demand	Anodyne	SSTR2	42	33
CCCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610766	DE	On-Demand	Anodyne	GHRHR	48	34
CCCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610766	DE	On-Demand	Anodyne	P2RY12	176	42
CCCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610766	DE	On-Demand	Anodyne	TRY1_BOVIN	49	34
CCCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610766	DE	On-Demand	Anodyne	CTSK	57	40
CCCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610768	DE	On-Demand	Anodyne	SSTR2	42	33
CCCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610768	DE	On-Demand	Anodyne	GHRHR	48	34
CCCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610768	DE	On-Demand	Anodyne	P2RY12	176	42
CCCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610768	DE	On-Demand	Anodyne	TRY1_BOVIN	49	34
CCCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610768	DE	On-Demand	Anodyne	CTSK	57	40
CCCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610769	DE	On-Demand	Anodyne	SSTR2	42	33
CCCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610769	DE	On-Demand	Anodyne	GHRHR	48	34
CCCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610769	DE	On-Demand	Anodyne	P2RY12	176	42
CCCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610769	DE	On-Demand	Anodyne	TRY1_BOVIN	49	34
CCCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC	ZINC000450610769	DE	On-Demand	Anodyne	CTSK	57	40
O=[N+]([O-])c1ccc(N[C@H]2CCCN(CCCO)C2)nc1-c1ccccc1	ZINC000450610779	FE	On-Demand	Bother	SLC6A1	68	35
O=[N+]([O-])c1ccc(N[C@@H]2CCCN(CCCO)C2)nc1-c1ccccc1	ZINC000450610782	FE	On-Demand	Bother	SLC6A1	68	35
CN1C[C@@H](NC(=O)CCCOc2ccc(Cl)cc2)C(=O)N1	ZINC000450610794	DC	On-Demand	Anodyne	P2RY12	22	41
CN1C[C@@H](NC(=O)CCCOc2ccc(Cl)cc2)C(=O)N1	ZINC000450610794	DC	On-Demand	Anodyne	TRAR	38	43
CN1C[C@@H](NC(=O)CCCOc2ccc(Cl)cc2)C(=O)N1	ZINC000450610794	DC	On-Demand	Anodyne	CVIR	0	59
CN1C[C@H](NC(=O)CCCOc2ccc(Cl)cc2)C(=O)N1	ZINC000450610798	DC	On-Demand	Anodyne	P2RY12	22	41
CN1C[C@H](NC(=O)CCCOc2ccc(Cl)cc2)C(=O)N1	ZINC000450610798	DC	On-Demand	Anodyne	TRAR	38	43
CN1C[C@H](NC(=O)CCCOc2ccc(Cl)cc2)C(=O)N1	ZINC000450610798	DC	On-Demand	Anodyne	CVIR	0	59
C[C@H]1C[C@]1(C#N)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450610801	CF	On-Demand	Mild	SMO	45	33
CN1C[C@H](NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C(=O)N1	ZINC000450610802	FC	On-Demand	Anodyne	NPFFR1	45	32
CN1C[C@@H](NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C(=O)N1	ZINC000450610803	FC	On-Demand	Anodyne	NPFFR1	45	32
C[C@@H]1C[C@@]1(C#N)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450610804	CF	On-Demand	Mild	SMO	45	33
CN1C[C@@H](NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C(=O)N1	ZINC000450610805	FC	On-Demand	Anodyne	NPFFR1	45	32
C[C@H]1C[C@@]1(C#N)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450610806	CF	On-Demand	Mild	SMO	45	33
C[C@@H]1C[C@]1(C#N)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450610807	CF	On-Demand	Mild	SMO	45	33
Cc1cc(=N[C@H]2CCCN(CCCO)C2)nc(-c2ccncc2)[nH]1	ZINC000450610810	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Cc1cc(=N[C@@H]2CCCN(CCCO)C2)nc(-c2ccncc2)[nH]1	ZINC000450610811	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
COc1ccc(C(=O)NCc2nc3ccccc3n2C2CC2)cc1S(C)(=O)=O	ZINC000450610812	GF	On-Demand	Anodyne	CPT1A	47	33
COc1ccc(C(=O)NCc2nc3ccccc3n2C2CC2)cc1S(C)(=O)=O	ZINC000450610812	GF	On-Demand	Anodyne	NS5B	0	46
CC(C)NC(=O)c1ccc(NCC(C)(C)c2ccccn2)c([N+](=O)[O-])c1	ZINC000450610825	FH	On-Demand	Bother	COLA	45	32
CC(C)NC(=O)c1ccc(NCC(C)(C)c2ccccn2)c([N+](=O)[O-])c1	ZINC000450610825	FH	On-Demand	Bother	TAAR1	17	42
CN1C[C@H](NC(=O)c2ccccc2OC2CCCCC2)C(=O)N1	ZINC000450610834	DD	On-Demand	Anodyne	HCN4	41	32
CN1C[C@@H](NC(=O)c2ccccc2OC2CCCCC2)C(=O)N1	ZINC000450610835	DD	On-Demand	Anodyne	HCN4	41	32
COCCOC1(CNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450610840	FH	On-Demand	Anodyne	HRP1_PLAFA	40	30
COCCOC1(CNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450610840	FH	On-Demand	Anodyne	HNMT	41	32
COc1ccc2c(c1)C=C(C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450610858	DB	On-Demand	Anodyne	ALOX12	15	41
COc1ccc2c(c1)C=C(C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450610859	DB	On-Demand	Anodyne	ALOX12	15	41
COC(=O)[C@@](C)(O)CNC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450610861	DD	On-Demand	Anodyne	ECR	42	34
COC(=O)[C@](C)(O)CNC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450610862	DD	On-Demand	Anodyne	ECR	42	34
COC(=O)[C@](C)(O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450610867	FD	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@](C)(O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450610867	FD	On-Demand	Anodyne	MTNR1B	31	42
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450610868	FD	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450610868	FD	On-Demand	Anodyne	MTNR1B	31	42
COC(=O)[C@](C)(O)CNC(=O)[C@@H](C)c1ccc2c(c1)OCO2	ZINC000450610869	DC	On-Demand	Anodyne	PDE10A	0	40
COC(=O)[C@@](C)(O)CNC(=O)[C@H](C)c1ccc2c(c1)OCO2	ZINC000450610870	DC	On-Demand	Anodyne	PDE10A	0	40
COC(=O)[C@](C)(O)CNC(=O)[C@H](C)c1ccc2c(c1)OCO2	ZINC000450610871	DC	On-Demand	Anodyne	PDE10A	0	40
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)c1ccc2c(c1)OCO2	ZINC000450610872	DC	On-Demand	Anodyne	PDE10A	0	40
CN1C[C@@H](NC(=O)c2cc(NC(=O)NC(C)(C)C)ccc2Cl)C(=O)N1	ZINC000450610877	FD	On-Demand	Anodyne	IMDH_CRYPV	44	43
CN1C[C@H](NC(=O)c2cc(NC(=O)NC(C)(C)C)ccc2Cl)C(=O)N1	ZINC000450610878	FD	On-Demand	Anodyne	IMDH_CRYPV	44	43
COc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1-c1ccnn1C	ZINC000450610883	EC	On-Demand	Anodyne	HTR2A	24	45
COc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1-c1ccnn1C	ZINC000450610884	EC	On-Demand	Anodyne	HTR2A	24	45
COc1cc(Br)c(C(=O)NCCc2ccn(C)n2)cc1OC	ZINC000450610909	FE	On-Demand	Anodyne	DRD2	19	43
COc1cc(Br)c(C(=O)NCCc2ccn(C)n2)cc1OC	ZINC000450610909	FE	On-Demand	Anodyne	DRD3	32	43
C(=C\c1ccccc1)\CCN1CCC[C@H](Cn2ccnn2)C1	ZINC000450610916	CG	On-Demand	Anodyne	SLC6A1	42	34
C(=C/c1ccccc1)\CCN1CCC[C@@H](Cn2ccnn2)C1	ZINC000450610917	CG	On-Demand	Anodyne	SLC6A1	42	34
C(=C/c1ccccc1)\CCN1CCC[C@H](Cn2ccnn2)C1	ZINC000450610918	CG	On-Demand	Anodyne	SLC6A1	42	34
C(=C\c1ccccc1)\CCN1CCC[C@@H](Cn2ccnn2)C1	ZINC000450610919	CG	On-Demand	Anodyne	SLC6A1	42	34
CCc1cc(NCC2(OCCOC)CCOCC2)n2ncnc2n1	ZINC000450610920	ED	On-Demand	Anodyne	DHOD	0	45
CN1C[C@H](NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C(=O)N1	ZINC000450610940	FC	On-Demand	Anodyne	NPFFR1	45	32
C[C@@H](O)CCSc1nc2ccccc2c(=O)n1CCCO	ZINC000450610959	DD	On-Demand	Anodyne	SLC16A1	53	38
Clc1ccccc1OC1CCN(Cc2cnn[nH]2)CC1	ZINC000450610960	CF	On-Demand	Anodyne	SCD1	33	45
C[C@H](O)CCSc1nc2ccccc2c(=O)n1CCCO	ZINC000450610961	DD	On-Demand	Anodyne	SLC16A1	53	38
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610963	DB	On-Demand	Anodyne	CASP3	22	42
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610963	DB	On-Demand	Anodyne	CAPN2	55	42
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610963	DB	On-Demand	Anodyne	BIRC3	43	36
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610963	DB	On-Demand	Anodyne	BIRC2	57	32
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610963	DB	On-Demand	Anodyne	BIRC8	47	36
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610964	DB	On-Demand	Anodyne	CASP3	22	42
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610964	DB	On-Demand	Anodyne	CAPN2	55	42
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610964	DB	On-Demand	Anodyne	BIRC3	43	36
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610964	DB	On-Demand	Anodyne	BIRC2	57	32
C[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610964	DB	On-Demand	Anodyne	BIRC8	47	36
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610965	DB	On-Demand	Anodyne	CASP3	22	42
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610965	DB	On-Demand	Anodyne	CAPN2	55	42
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610965	DB	On-Demand	Anodyne	BIRC3	43	36
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610965	DB	On-Demand	Anodyne	BIRC2	57	32
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450610965	DB	On-Demand	Anodyne	BIRC8	47	36
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610966	DB	On-Demand	Anodyne	CASP3	22	42
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610966	DB	On-Demand	Anodyne	CAPN2	55	42
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610966	DB	On-Demand	Anodyne	BIRC3	43	36
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610966	DB	On-Demand	Anodyne	BIRC2	57	32
C[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450610966	DB	On-Demand	Anodyne	BIRC8	47	36
COc1ccc(SCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450610967	CC	On-Demand	Anodyne	FAS	45	43
COc1ccc(SCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450610968	CC	On-Demand	Anodyne	FAS	45	43
CC[C@H](C)[C@H](CNc1cc(-c2ccccc2)nc2ncnn12)OC	ZINC000450610976	EG	On-Demand	Anodyne	DHOD	0	41
CC[C@@H](C)[C@H](CNc1cc(-c2ccccc2)nc2ncnn12)OC	ZINC000450610977	EG	On-Demand	Anodyne	DHOD	0	41
CC[C@@H](C)[C@@H](CNc1cc(-c2ccccc2)nc2ncnn12)OC	ZINC000450610979	EG	On-Demand	Anodyne	DHOD	0	41
CC[C@H](C)[C@@H](CNc1cc(-c2ccccc2)nc2ncnn12)OC	ZINC000450610980	EG	On-Demand	Anodyne	DHOD	0	41
COC(=O)Cn1cc(COc2ccc(C(F)(F)F)cc2)nn1	ZINC000450610982	DE	On-Demand	Anodyne	PPARD	41	39
CCCC[C@@H](NC(=O)c1ccc(I)cc1F)C(=O)OC	ZINC000450610990	GF	On-Demand	Anodyne	FOLH1	16	40
CCCC[C@@H](NC(=O)c1ccc(I)cc1F)C(=O)OC	ZINC000450610990	GF	On-Demand	Anodyne	MAP2K1	50	36
CCCC[C@H](NC(=O)c1ccc(I)cc1F)C(=O)OC	ZINC000450610991	GF	On-Demand	Anodyne	FOLH1	16	40
CCCC[C@H](NC(=O)c1ccc(I)cc1F)C(=O)OC	ZINC000450610991	GF	On-Demand	Anodyne	MAP2K1	50	36
CN1C[C@@H](NC(=O)CCc2cccc(Br)c2)C(=O)N1	ZINC000450610993	EC	On-Demand	Anodyne	LUXR	48	58
CN1C[C@@H](NC(=O)CCc2cccc(Br)c2)C(=O)N1	ZINC000450610993	EC	On-Demand	Anodyne	TRAR	27	41
CN1C[C@@H](NC(=O)CCc2cccc(Br)c2)C(=O)N1	ZINC000450610993	EC	On-Demand	Anodyne	LASR	29	41
CN1C[C@H](NC(=O)CCc2cccc(Br)c2)C(=O)N1	ZINC000450610994	EC	On-Demand	Anodyne	LUXR	48	58
CN1C[C@H](NC(=O)CCc2cccc(Br)c2)C(=O)N1	ZINC000450610994	EC	On-Demand	Anodyne	TRAR	27	41
CN1C[C@H](NC(=O)CCc2cccc(Br)c2)C(=O)N1	ZINC000450610994	EC	On-Demand	Anodyne	LASR	29	41
C=CCOc1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450610996	FI	On-Demand	Mild	TSHR	54	32
C=CCOc1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450610996	FI	On-Demand	Mild	CA9	15	41
C=CCOc1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450610996	FI	On-Demand	Mild	ENPP1	79	38
C=CCOc1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450610996	FI	On-Demand	Mild	DRTS_TRYCR	45	31
COc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N[C@@H]5CN(C)NC5=O)(C4)C2)C3)cc1	ZINC000450611010	GD	On-Demand	Anodyne	BOTA	22	48
COc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N[C@H]5CN(C)NC5=O)(C4)C2)C3)cc1	ZINC000450611013	GD	On-Demand	Anodyne	BOTA	22	48
CN1C[C@@H](NC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)C(=O)N1	ZINC000450611029	GD	On-Demand	Anodyne	CCR2	50	33
CN1C[C@H](NC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)C(=O)N1	ZINC000450611030	GD	On-Demand	Anodyne	CCR2	50	33
CN1C[C@@H](NC(=O)CCOc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450611031	ED	On-Demand	Anodyne	CVIR	0	40
CN1C[C@H](NC(=O)CCOc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450611032	ED	On-Demand	Anodyne	CVIR	0	40
Cc1ccnc(-c2noc(CN3CCC(Oc4ccccc4Cl)CC3)n2)c1	ZINC000450611041	GI	On-Demand	Anodyne	SSTR5	42	36
Cc1ccnc(-c2noc(CN3CCC(Oc4ccccc4Cl)CC3)n2)c1	ZINC000450611041	GI	On-Demand	Anodyne	SCN5A	49	40
Cc1ccnc(-c2noc(CN3CCC(Oc4ccccc4Cl)CC3)n2)c1	ZINC000450611041	GI	On-Demand	Anodyne	SCD1	36	51
CC(C)[C@@H](Sc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611051	DD	On-Demand	Anodyne	BIRC8	40	31
CC(C)[C@H](Sc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611053	DD	On-Demand	Anodyne	BIRC8	40	31
CC(C)[C@@H](Sc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611054	DD	On-Demand	Anodyne	BIRC8	40	31
CC(C)[C@H](Sc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611055	DD	On-Demand	Anodyne	BIRC8	40	31
COc1ccc(NC(=O)Cc2cc(C)ccc2F)cc1OC(C)C	ZINC000450611060	EI	On-Demand	Anodyne	ENPP1	81	38
COc1ccc(NC(=O)Cc2cc(C)ccc2F)cc1OC(C)C	ZINC000450611060	EI	On-Demand	Anodyne	DRTS_TRYCR	44	30
CCCC[C@H](NC(=O)C1CC(C)(O)C1)C(=O)OC	ZINC000450611068	CC	On-Demand	Anodyne	NOD1	44	31
CCCC[C@@H](NC(=O)C1CC(C)(O)C1)C(=O)OC	ZINC000450611069	CC	On-Demand	Anodyne	NOD1	44	31
CCC(=O)c1ccc(OCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450611075	DC	On-Demand	Anodyne	ADORA2B	46	34
CCC(=O)c1ccc(OCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450611075	DC	On-Demand	Anodyne	TRAR	33	40
CCC(=O)c1ccc(OCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450611076	DC	On-Demand	Anodyne	ADORA2B	46	34
CCC(=O)c1ccc(OCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450611076	DC	On-Demand	Anodyne	TRAR	33	40
FC(F)(F)c1cccc(CNc2nc3ccccc3nc2N2CCOCC2)n1	ZINC000450611087	GG	On-Demand	Anodyne	PIK3CA	15	45
CC[C@@H](C)[C@@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450611092	FD	On-Demand	Anodyne	TGM2	15	40
CCCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611094	FE	On-Demand	Anodyne	GHRHR	49	33
CCCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611094	FE	On-Demand	Anodyne	P2RY12	176	35
CCCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611094	FE	On-Demand	Anodyne	TRY1_BOVIN	59	35
CCCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611094	FE	On-Demand	Anodyne	CTSK	51	38
CCCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611095	FE	On-Demand	Anodyne	GHRHR	49	33
CCCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611095	FE	On-Demand	Anodyne	P2RY12	176	35
CCCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611095	FE	On-Demand	Anodyne	TRY1_BOVIN	59	35
CCCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611095	FE	On-Demand	Anodyne	CTSK	51	38
CCCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611096	FE	On-Demand	Anodyne	GHRHR	49	33
CCCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611096	FE	On-Demand	Anodyne	P2RY12	176	35
CCCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611096	FE	On-Demand	Anodyne	TRY1_BOVIN	59	35
CCCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611096	FE	On-Demand	Anodyne	CTSK	51	38
CCCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611097	FE	On-Demand	Anodyne	GHRHR	49	33
CCCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611097	FE	On-Demand	Anodyne	P2RY12	176	35
CCCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611097	FE	On-Demand	Anodyne	TRY1_BOVIN	59	35
CCCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC	ZINC000450611097	FE	On-Demand	Anodyne	CTSK	51	38
CC[C@H](C)[C@@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450611099	FD	On-Demand	Anodyne	TGM2	15	40
CC[C@H](C)[C@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450611101	FD	On-Demand	Anodyne	TGM2	15	40
CC[C@@H](C)[C@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450611103	FD	On-Demand	Anodyne	TGM2	15	40
CCCC[C@@H](NC(=O)CC[C@H]1CCC(=O)N1)C(=O)OC	ZINC000450611107	CC	On-Demand	Anodyne	NOD1	88	36
CCCC[C@H](NC(=O)CC[C@H]1CCC(=O)N1)C(=O)OC	ZINC000450611108	CC	On-Demand	Anodyne	NOD1	88	36
CCCC[C@H](NC(=O)CC[C@@H]1CCC(=O)N1)C(=O)OC	ZINC000450611109	CC	On-Demand	Anodyne	NOD1	88	36
CCCC[C@@H](NC(=O)CC[C@@H]1CCC(=O)N1)C(=O)OC	ZINC000450611110	CC	On-Demand	Anodyne	NOD1	88	36
Cc1nn(C)cc1CSc1nc2ccccc2c(=O)n1CCCO	ZINC000450611118	EE	On-Demand	Anodyne	SLC16A1	46	33
Cc1noc(C)c1COc1ccc(CC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450611120	FC	On-Demand	Anodyne	RORC	19	47
Cc1noc(C)c1COc1ccc(CC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450611128	FC	On-Demand	Anodyne	RORC	19	47
COc1ccc(COCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450611158	DC	On-Demand	Anodyne	P2RY12	0	40
COc1ccc(COCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450611158	DC	On-Demand	Anodyne	UGCG	28	43
COc1ccc(COCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450611158	DC	On-Demand	Anodyne	CVIR	0	40
CC[C@@H](CC(C)C)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611163	DI	On-Demand	Anodyne	PLD1	41	31
CC[C@@H](CC(C)C)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611163	DI	On-Demand	Anodyne	FPR2	29	42
CC[C@H](CC(C)C)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611164	DI	On-Demand	Anodyne	PLD1	41	31
CC[C@H](CC(C)C)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611164	DI	On-Demand	Anodyne	FPR2	29	42
COc1ccc(COCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450611166	DC	On-Demand	Anodyne	P2RY12	0	40
COc1ccc(COCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450611166	DC	On-Demand	Anodyne	UGCG	28	43
COc1ccc(COCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450611166	DC	On-Demand	Anodyne	CVIR	0	40
C=CCOc1ccc(CC(=O)NCCc2ccn(C)n2)cc1	ZINC000450611180	CD	On-Demand	Mild	MTNR1A	25	46
COc1ccc(Cc2nnc(SCc3cn(C)nc3C)o2)cc1	ZINC000450611185	EG	On-Demand	Anodyne	PTK2	23	48
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cnn3ccc(C)cc23)cc1	ZINC000450611196	FG	On-Demand	Anodyne	EPHB3	37	51
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cnn3ccc(C)cc23)cc1	ZINC000450611198	FG	On-Demand	Anodyne	EPHB3	37	51
CS[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450611207	CC	On-Demand	Anodyne	BIRC8	43	33
CS[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450611211	CC	On-Demand	Anodyne	BIRC8	43	33
CS[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450611212	CC	On-Demand	Anodyne	BIRC8	43	33
CS[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450611213	CC	On-Demand	Anodyne	BIRC8	43	33
COCc1cc(NC[C@H](Cc2ccccc2)OC)n2ncnc2n1	ZINC000450611214	ED	On-Demand	Anodyne	DHOD	0	45
COCc1cc(NC[C@@H](Cc2ccccc2)OC)n2ncnc2n1	ZINC000450611215	ED	On-Demand	Anodyne	DHOD	0	45
CCc1cccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611226	EG	On-Demand	Anodyne	DRD4	37	44
CCc1cccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611226	EG	On-Demand	Anodyne	ACHE	29	41
CCc1cccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611226	EG	On-Demand	Anodyne	SIGMAR1	46	42
CCc1cccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611226	EG	On-Demand	Anodyne	CCR3	26	41
CCc1cccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611226	EG	On-Demand	Anodyne	CCR5	51	45
CCc1cccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611227	EG	On-Demand	Anodyne	DRD4	37	44
CCc1cccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611227	EG	On-Demand	Anodyne	ACHE	29	41
CCc1cccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611227	EG	On-Demand	Anodyne	SIGMAR1	46	42
CCc1cccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611227	EG	On-Demand	Anodyne	CCR3	26	41
CCc1cccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450611227	EG	On-Demand	Anodyne	CCR5	51	45
COCCOC1(CNc2nccc(-c3ccc(OC)cc3)n2)CCOCC1	ZINC000450611236	FF	On-Demand	Anodyne	SMG1	40	33
COC(=O)C1(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)CC1	ZINC000450611241	FD	On-Demand	Anodyne	GNAI1	0	45
COC(=O)C1(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)CC1	ZINC000450611241	FD	On-Demand	Anodyne	GNAI3	0	45
COC(=O)C1(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)CC1	ZINC000450611241	FD	On-Demand	Anodyne	GNAO1	0	45
CC(C)(CNc1ccc(S(C)(=O)=O)cn1)c1ccccn1	ZINC000450611246	DE	On-Demand	Anodyne	PTGS2	16	41
O=C(c1ccnc(OC(F)F)c1)N1CCn2c(O)nnc2C1	ZINC000450611260	DC	On-Demand	Anodyne	P2RX7	25	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611267	FH	On-Demand	Anodyne	P2RY12	47	33
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611267	FH	On-Demand	Anodyne	KCNQ2	18	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611267	FH	On-Demand	Anodyne	HRH3	22	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611267	FH	On-Demand	Anodyne	NPY2R	42	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611267	FH	On-Demand	Anodyne	TIMP3	58	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611267	FH	On-Demand	Anodyne	ITGA4	48	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611267	FH	On-Demand	Anodyne	ACE2	44	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611268	FH	On-Demand	Anodyne	P2RY12	47	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611268	FH	On-Demand	Anodyne	KCNQ2	18	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611268	FH	On-Demand	Anodyne	HRH3	22	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611268	FH	On-Demand	Anodyne	NPY2R	42	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611268	FH	On-Demand	Anodyne	TIMP3	58	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611268	FH	On-Demand	Anodyne	ITGA4	48	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611268	FH	On-Demand	Anodyne	ACE2	44	33
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611269	FH	On-Demand	Anodyne	P2RY12	47	33
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611269	FH	On-Demand	Anodyne	KCNQ2	18	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611269	FH	On-Demand	Anodyne	HRH3	22	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611269	FH	On-Demand	Anodyne	NPY2R	42	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611269	FH	On-Demand	Anodyne	TIMP3	58	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611269	FH	On-Demand	Anodyne	ITGA4	48	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611269	FH	On-Demand	Anodyne	ACE2	44	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611270	FH	On-Demand	Anodyne	P2RY12	47	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611270	FH	On-Demand	Anodyne	KCNQ2	18	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611270	FH	On-Demand	Anodyne	HRH3	22	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611270	FH	On-Demand	Anodyne	NPY2R	42	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611270	FH	On-Demand	Anodyne	TIMP3	58	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611270	FH	On-Demand	Anodyne	ITGA4	48	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450611270	FH	On-Demand	Anodyne	ACE2	44	33
CC(C)CCCC(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611282	CH	On-Demand	Anodyne	OPRL1	16	42
CC(C)CCCC(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611282	CH	On-Demand	Anodyne	FPR2	28	41
CC(=O)c1ccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611283	FJ	On-Demand	Anodyne	SIGMAR1	19	42
CC(=O)c1ccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611283	FJ	On-Demand	Anodyne	SSTR5	48	42
CC(=O)c1ccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611283	FJ	On-Demand	Anodyne	CCR3	86	38
CC(=O)c1ccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611283	FJ	On-Demand	Anodyne	MLNR	53	35
CC(=O)c1ccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611283	FJ	On-Demand	Anodyne	MCHR1	32	49
CC(C)OC(C)(C)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611284	DG	On-Demand	Anodyne	PLD1	53	32
CC(C)OC(C)(C)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611284	DG	On-Demand	Anodyne	FPR2	27	40
CC(=O)c1ccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611287	FJ	On-Demand	Anodyne	SIGMAR1	19	42
CC(=O)c1ccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611287	FJ	On-Demand	Anodyne	SSTR5	48	42
CC(=O)c1ccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611287	FJ	On-Demand	Anodyne	CCR3	86	38
CC(=O)c1ccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611287	FJ	On-Demand	Anodyne	MLNR	53	35
CC(=O)c1ccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)cc1	ZINC000450611287	FJ	On-Demand	Anodyne	MCHR1	32	49
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611294	EI	On-Demand	Anodyne	PRSS1	32	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611294	EI	On-Demand	Anodyne	PRNP	44	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611294	EI	On-Demand	Anodyne	PLAU	44	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611294	EI	On-Demand	Anodyne	KCNK3	95	38
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611294	EI	On-Demand	Anodyne	KCNK9	60	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611296	EI	On-Demand	Anodyne	PRSS1	32	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611296	EI	On-Demand	Anodyne	PRNP	44	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611296	EI	On-Demand	Anodyne	PLAU	44	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611296	EI	On-Demand	Anodyne	KCNK3	95	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cccc(SC)c2)cc1	ZINC000450611296	EI	On-Demand	Anodyne	KCNK9	60	37
COc1ccc(-c2noc(CN3CCC(CCCN4CCCC4)CC3)n2)nn1	ZINC000450611299	GF	On-Demand	Anodyne	NPY1R	42	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450611300	FH	On-Demand	Anodyne	SLC1A2	45	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450611300	FH	On-Demand	Anodyne	CA9	15	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450611300	FH	On-Demand	Anodyne	LEF	41	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450611300	FH	On-Demand	Anodyne	PFK	0	43
CN1C[C@@H](NC(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)C(=O)N1	ZINC000450611301	ED	On-Demand	Anodyne	TACR3	42	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450611302	FH	On-Demand	Anodyne	SLC1A2	45	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450611302	FH	On-Demand	Anodyne	CA9	15	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450611302	FH	On-Demand	Anodyne	LEF	41	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450611302	FH	On-Demand	Anodyne	PFK	0	43
CN1C[C@H](NC(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)C(=O)N1	ZINC000450611304	ED	On-Demand	Anodyne	TACR3	42	34
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611305	FA	On-Demand	Mild	ITGA4	56	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450611307	FG	On-Demand	Anodyne	MMP13	0	48
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450611308	FG	On-Demand	Anodyne	MMP13	0	48
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611310	FA	On-Demand	Mild	ITGA4	56	32
C[C@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611312	FA	On-Demand	Mild	ITGA4	56	32
C[C@@H](NS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611314	FA	On-Demand	Mild	ITGA4	56	32
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450611320	FI	On-Demand	Anodyne	NR1H4	0	40
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450611320	FI	On-Demand	Anodyne	HDAC1	30	41
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450611320	FI	On-Demand	Anodyne	PAGA	0	40
COCCOC1(CNc2nc(N(C)C)c3ccccc3n2)CCOCC1	ZINC000450611327	FD	On-Demand	Anodyne	ADRA2A	16	47
CCN(CCC1CC1)C(=O)CCCC(=O)C1CC1	ZINC000450611332	CF	On-Demand	Anodyne	PHF8	0	41
CCN(CCC1CC1)C(=O)CCCC(=O)C1CC1	ZINC000450611332	CF	On-Demand	Anodyne	KDM7A	0	41
O=C1CCC(CN2CCC[C@H](Oc3ccccc3Cl)C2)CC1	ZINC000450611333	DH	On-Demand	Anodyne	SLC6A1	40	35
O=C1CCC(CN2CCC[C@@H](Oc3ccccc3Cl)C2)CC1	ZINC000450611334	DH	On-Demand	Anodyne	SLC6A1	40	35
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450611337	EF	On-Demand	Anodyne	TRPV1	35	45
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450611337	EF	On-Demand	Anodyne	ACAT	0	40
CCCC[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450611337	EF	On-Demand	Anodyne	CAN2	0	41
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450611338	EF	On-Demand	Anodyne	TRPV1	35	45
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450611338	EF	On-Demand	Anodyne	ACAT	0	40
CCCC[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450611338	EF	On-Demand	Anodyne	CAN2	0	41
CN1C[C@@H](NC(=O)COc2ccccc2C(F)(F)F)C(=O)N1	ZINC000450611344	DC	On-Demand	Anodyne	RBP4	44	32
CN1C[C@H](NC(=O)COc2ccccc2C(F)(F)F)C(=O)N1	ZINC000450611345	DC	On-Demand	Anodyne	RBP4	44	32
CO[C@H](CNc1nn2c(C(F)(F)F)nnc2c(C)c1C)Cc1ccccc1	ZINC000450611362	GF	On-Demand	Anodyne	CACNA2D1	21	41
CO[C@@H](CNc1nn2c(C(F)(F)F)nnc2c(C)c1C)Cc1ccccc1	ZINC000450611368	GF	On-Demand	Anodyne	CACNA2D1	21	41
CN1C[C@H](NC(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)C(=O)N1	ZINC000450611378	FC	On-Demand	Anodyne	EPHX2	33	44
CN1C[C@@H](NC(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)C(=O)N1	ZINC000450611379	FC	On-Demand	Anodyne	EPHX2	33	44
COC(=O)c1csc(CSc2nc3ccccc3c(=O)n2CCCO)n1	ZINC000450611380	GE	On-Demand	Anodyne	PTGDR2	15	40
COc1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1OC(C)C	ZINC000450611381	DH	On-Demand	Anodyne	ENPP1	69	33
COc1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1OC(C)C	ZINC000450611381	DH	On-Demand	Anodyne	KCNK3	45	41
COc1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1OC(C)C	ZINC000450611381	DH	On-Demand	Anodyne	KCNK9	43	41
Clc1ccccc1O[C@H]1CCCN(CCc2cscn2)C1	ZINC000450611391	DH	On-Demand	Anodyne	SCN5A	43	39
Clc1ccccc1O[C@@H]1CCCN(CCc2cscn2)C1	ZINC000450611392	DH	On-Demand	Anodyne	SCN5A	43	39
CCCC[C@@H](NC(=O)c1cc2cccnc2s1)C(=O)OC	ZINC000450611397	DF	On-Demand	Anodyne	P2RY12	62	34
CCCC[C@H](NC(=O)c1cc2cccnc2s1)C(=O)OC	ZINC000450611398	DF	On-Demand	Anodyne	P2RY12	62	34
CCOc1ccc2c(c1)C[C@H](C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450611400	DC	On-Demand	Anodyne	ROCK2	31	41
CCOc1ccc2c(c1)C[C@H](C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450611400	DC	On-Demand	Anodyne	CDC42BPA	0	41
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N[C@H]3CN(C)NC3=O)CC2)c(C)c1	ZINC000450611405	GC	On-Demand	Anodyne	EPHX2	55	69
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N[C@@H]3CN(C)NC3=O)CC2)c(C)c1	ZINC000450611406	GC	On-Demand	Anodyne	EPHX2	55	69
COc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1OC(C)C	ZINC000450611411	FH	On-Demand	Anodyne	GRM4	17	42
COc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1OC(C)C	ZINC000450611411	FH	On-Demand	Anodyne	ENPP1	61	37
COc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1OC(C)C	ZINC000450611411	FH	On-Demand	Anodyne	GLMU	0	41
COc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1OC(C)C	ZINC000450611411	FH	On-Demand	Anodyne	KCNK3	48	35
COc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1OC(C)C	ZINC000450611411	FH	On-Demand	Anodyne	KCNK9	54	35
CCOc1ccc2c(c1)C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450611412	DC	On-Demand	Anodyne	ROCK2	31	41
CCOc1ccc2c(c1)C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450611412	DC	On-Demand	Anodyne	CDC42BPA	0	41
CCOc1ccc2c(c1)C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450611413	DC	On-Demand	Anodyne	ROCK2	31	41
CCOc1ccc2c(c1)C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450611413	DC	On-Demand	Anodyne	CDC42BPA	0	41
CCOc1ccc2c(c1)C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450611414	DC	On-Demand	Anodyne	ROCK2	31	41
CCOc1ccc2c(c1)C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450611414	DC	On-Demand	Anodyne	CDC42BPA	0	41
CCCC[C@H](NC(=O)Cc1cc(F)c(C)cc1F)C(=O)OC	ZINC000450611428	DF	On-Demand	Anodyne	NOD1	65	35
CCCC[C@@H](NC(=O)Cc1cc(F)c(C)cc1F)C(=O)OC	ZINC000450611431	DF	On-Demand	Anodyne	NOD1	65	35
CN1C[C@H](NC(=O)C(C)(C)CCCc2ccccc2)C(=O)N1	ZINC000450611432	DD	On-Demand	Anodyne	GHRHR	40	32
CN1C[C@@H](NC(=O)C(C)(C)CCCc2ccccc2)C(=O)N1	ZINC000450611433	DD	On-Demand	Anodyne	GHRHR	40	32
CN1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611434	DB	On-Demand	Anodyne	ACE	27	42
CN1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611434	DB	On-Demand	Anodyne	PREP	46	46
CN1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611434	DB	On-Demand	Anodyne	XIAP	42	36
CN1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611434	DB	On-Demand	Anodyne	TMPRSS11D	46	32
COc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611435	EG	On-Demand	Anodyne	GUAB	0	41
COc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611435	EG	On-Demand	Anodyne	GRM4	44	49
COc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611435	EG	On-Demand	Anodyne	ENPP1	63	40
COc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611435	EG	On-Demand	Anodyne	IMDH_CRYPV	37	43
COc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611435	EG	On-Demand	Anodyne	GLMU	0	42
COc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611436	EG	On-Demand	Anodyne	GUAB	0	41
COc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611436	EG	On-Demand	Anodyne	GRM4	44	49
COc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611436	EG	On-Demand	Anodyne	ENPP1	63	40
COc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611436	EG	On-Demand	Anodyne	IMDH_CRYPV	37	43
COc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1OC(C)C	ZINC000450611436	EG	On-Demand	Anodyne	GLMU	0	42
CN1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611438	DB	On-Demand	Anodyne	ACE	27	42
CN1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611438	DB	On-Demand	Anodyne	PREP	46	46
CN1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611438	DB	On-Demand	Anodyne	XIAP	42	36
CN1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611438	DB	On-Demand	Anodyne	TMPRSS11D	46	32
CN1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611439	DB	On-Demand	Anodyne	ACE	27	42
CN1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611439	DB	On-Demand	Anodyne	PREP	46	46
CN1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611439	DB	On-Demand	Anodyne	XIAP	42	36
CN1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611439	DB	On-Demand	Anodyne	TMPRSS11D	46	32
CN1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611440	DB	On-Demand	Anodyne	ACE	27	42
CN1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611440	DB	On-Demand	Anodyne	PREP	46	46
CN1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611440	DB	On-Demand	Anodyne	XIAP	42	36
CN1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)C(=O)N1	ZINC000450611440	DB	On-Demand	Anodyne	TMPRSS11D	46	32
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](n3cc(C(=O)OC)nn3)C2)cc1	ZINC000450611472	GF	On-Demand	Anodyne	L3MBTL3	44	38
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](n3cc(C(=O)OC)nn3)C2)cc1	ZINC000450611478	GF	On-Demand	Anodyne	L3MBTL3	44	38
CC[C@H](C)[C@@H](CNc1cc(COC)nc2ncnn12)OC	ZINC000450611483	CD	On-Demand	Anodyne	DHOD	0	43
CC[C@H](C)[C@H](CNc1cc(COC)nc2ncnn12)OC	ZINC000450611485	CD	On-Demand	Anodyne	DHOD	0	43
CC[C@@H](C)[C@H](CNc1cc(COC)nc2ncnn12)OC	ZINC000450611486	CD	On-Demand	Anodyne	DHOD	0	43
CC[C@@H](C)[C@@H](CNc1cc(COC)nc2ncnn12)OC	ZINC000450611488	CD	On-Demand	Anodyne	DHOD	0	43
FC(F)(F)c1cccc(CNc2ncnc3sc4c(c23)CCC4)n1	ZINC000450611516	FI	On-Demand	Anodyne	RBP4	18	44
COc1ccc(Cc2nnc(SCCN(C)Cc3ccccc3)o2)cc1	ZINC000450611541	FH	On-Demand	Anodyne	PTGER1	0	41
COc1ccc(Cc2nnc(SCCN(C)Cc3ccccc3)o2)cc1	ZINC000450611541	FH	On-Demand	Anodyne	PTK2	22	48
Cc1nc(-c2ccccc2)oc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611549	DC	On-Demand	Anodyne	PDE8B	59	34
Cc1nc(-c2ccccc2)oc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611550	DC	On-Demand	Anodyne	PDE8B	59	34
CN1C[C@@H](NC(=O)c2cccc3nc[nH]c23)C(=O)N1	ZINC000450611556	CB	On-Demand	Anodyne	HTR4	17	40
CN1C[C@H](NC(=O)c2cccc3nc[nH]c23)C(=O)N1	ZINC000450611557	CB	On-Demand	Anodyne	HTR4	17	40
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450611562	FG	On-Demand	Anodyne	SLC6A1	78	32
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450611562	FG	On-Demand	Anodyne	OPRM1	16	41
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450611562	FG	On-Demand	Anodyne	FABP4	50	36
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450611562	FG	On-Demand	Anodyne	SIGMAR1	43	38
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450611562	FG	On-Demand	Anodyne	CCR5	43	38
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450611562	FG	On-Demand	Anodyne	MBTPS1	45	38
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450611563	FG	On-Demand	Anodyne	SLC6A1	78	32
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450611563	FG	On-Demand	Anodyne	OPRM1	16	41
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450611563	FG	On-Demand	Anodyne	FABP4	50	36
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450611563	FG	On-Demand	Anodyne	SIGMAR1	43	38
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450611563	FG	On-Demand	Anodyne	CCR5	43	38
CCN(C(=O)c1nn(C)c2c1CCCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450611563	FG	On-Demand	Anodyne	MBTPS1	45	38
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611570	EB	On-Demand	Anodyne	SSTR4	41	32
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611571	EB	On-Demand	Anodyne	SSTR4	41	32
Cc1nnnn1[C@H](Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611572	EB	On-Demand	Anodyne	SSTR4	41	32
Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611573	EB	On-Demand	Anodyne	SSTR4	41	32
CCN(C(=O)Cn1cc(C(C)=O)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450611584	FD	On-Demand	Anodyne	ACHE	16	41
CCN(C(=O)Cn1cc(C(C)=O)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450611585	FD	On-Demand	Anodyne	ACHE	16	41
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450611587	FD	On-Demand	Anodyne	SLC6A1	28	40
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450611588	FD	On-Demand	Anodyne	SLC6A1	28	40
CC(C)C[C@@H]1C[C@H]1C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611606	DH	On-Demand	Anodyne	CCR5	18	40
CC(C)C[C@@H]1C[C@H]1C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450611606	DH	On-Demand	Anodyne	FPR2	26	40
CCOC(=O)c1ccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)nc1	ZINC000450611611	GH	On-Demand	Anodyne	SSTR5	42	39
CCOC(=O)c1ccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)nc1	ZINC000450611612	GH	On-Demand	Anodyne	SSTR5	42	39
Clc1ccc([C@H](c2ccccc2)N2CCN(Cc3cnns3)CC2)cc1	ZINC000450611615	GI	On-Demand	Anodyne	OPRD1	0	45
Clc1ccc([C@@H](c2ccccc2)N2CCN(Cc3cnns3)CC2)cc1	ZINC000450611616	GI	On-Demand	Anodyne	OPRD1	0	45
COC(=O)[C@@](C)(O)CNC(=O)CCCC(=O)c1cccc(OC)c1	ZINC000450611619	ED	On-Demand	Anodyne	DRD4	45	36
COC(=O)[C@@](C)(O)CNC(=O)CCCC(=O)c1cccc(OC)c1	ZINC000450611619	ED	On-Demand	Anodyne	MTNR1A	35	40
COC(=O)[C@](C)(O)CNC(=O)CCCC(=O)c1cccc(OC)c1	ZINC000450611620	ED	On-Demand	Anodyne	DRD4	45	36
COC(=O)[C@](C)(O)CNC(=O)CCCC(=O)c1cccc(OC)c1	ZINC000450611620	ED	On-Demand	Anodyne	MTNR1A	35	40
Cn1ccc(CCNC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)n1	ZINC000450611622	EG	On-Demand	Anodyne	PRCP	45	35
Cn1ccc(CCNC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)n1	ZINC000450611623	EG	On-Demand	Anodyne	PRCP	45	35
Cn1ccc(CCNC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)n1	ZINC000450611624	EG	On-Demand	Anodyne	PRCP	45	35
Cn1ccc(CCNC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)n1	ZINC000450611625	EG	On-Demand	Anodyne	PRCP	45	35
CN1C[C@H](NC(=O)c2ccccc2NC2CCCCC2)C(=O)N1	ZINC000450611636	DD	On-Demand	Anodyne	CNR1	16	42
CN1C[C@@H](NC(=O)c2ccccc2NC2CCCCC2)C(=O)N1	ZINC000450611638	DD	On-Demand	Anodyne	CNR1	16	42
Clc1ccccc1O[C@H]1CCN(Cc2cnns2)C1	ZINC000450611661	CF	On-Demand	Anodyne	SCD1	25	41
COC1(CSc2nnc(-c3ccccc3C)o2)CCC1	ZINC000450611663	CH	On-Demand	Anodyne	ALOX15	50	37
CCCC[C@@H](NC(=O)CCCc1ncc(C)o1)C(=O)OC	ZINC000450611665	CE	On-Demand	Anodyne	NOD1	88	39
Clc1ccccc1O[C@@H]1CCN(Cc2cnns2)C1	ZINC000450611666	CF	On-Demand	Anodyne	SCD1	25	41
Cc1nc(N[C@@H]2CCCN(CCCO)C2)c2cc[nH]c2n1	ZINC000450611670	CD	On-Demand	Anodyne	EHMT2	45	31
Cc1nc(N[C@H]2CCCN(CCCO)C2)c2cc[nH]c2n1	ZINC000450611672	CD	On-Demand	Anodyne	EHMT2	45	31
CN1C[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611673	EB	On-Demand	Anodyne	PTGER3	26	43
CN1C[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611673	EB	On-Demand	Anodyne	CCKAR	25	40
CN1C[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611673	EB	On-Demand	Anodyne	CCKBR	39	40
CN1C[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611673	EB	On-Demand	Anodyne	EPHX2	15	43
CN1C[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611673	EB	On-Demand	Anodyne	CACNA1I	15	43
CCCC[C@H](NC(=O)CCCc1ncc(C)o1)C(=O)OC	ZINC000450611674	CE	On-Demand	Anodyne	NOD1	88	39
CCCc1cc(NCc2nc(C)c(Br)s2)n2ncnc2n1	ZINC000450611675	FG	On-Demand	Anodyne	DHOD	0	45
CN1C[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611676	EB	On-Demand	Anodyne	PTGER3	26	43
CN1C[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611676	EB	On-Demand	Anodyne	CCKAR	25	40
CN1C[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611676	EB	On-Demand	Anodyne	CCKBR	39	40
CN1C[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611676	EB	On-Demand	Anodyne	EPHX2	15	43
CN1C[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(=O)N1	ZINC000450611676	EB	On-Demand	Anodyne	CACNA1I	15	43
Cc1cc(NC[C@H]2CCCCN2CCO)n2ncnc2n1	ZINC000450611682	CC	On-Demand	Anodyne	DHOD	0	47
Cc1cc(NC[C@@H]2CCCCN2CCO)n2ncnc2n1	ZINC000450611683	CC	On-Demand	Anodyne	DHOD	0	47
O=C(CCc1cccc(F)c1Br)N1CCn2c(O)nnc2C1	ZINC000450611698	FD	On-Demand	Anodyne	P2RX7	21	41
CCO[C@@H]1C[C@H](NC(=O)Cc2ccccc2O[C@H]2CCOC2)[C@@H]1OC	ZINC000450611707	ED	On-Demand	Anodyne	PDEC	0	40
CCO[C@@H]1C[C@H](NC(=O)Cc2ccccc2O[C@@H]2CCOC2)[C@@H]1OC	ZINC000450611708	ED	On-Demand	Anodyne	PDEC	0	40
CCO[C@@H]1C[C@H](NC(=O)Cc2ccccc2O[C@@H]2CCOC2)[C@H]1OC	ZINC000450611709	ED	On-Demand	Anodyne	PDEC	0	40
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1CCCO	ZINC000450611710	EG	On-Demand	Anodyne	SLC16A1	49	36
CCO[C@@H]1C[C@H](NC(=O)Cc2ccccc2O[C@H]2CCOC2)[C@H]1OC	ZINC000450611711	ED	On-Demand	Anodyne	PDEC	0	40
Cc1cc(C)c2oc(N[C@H]3CCCN(CCCO)C3)nc2c1	ZINC000450611727	DE	On-Demand	Anodyne	SSTR5	44	33
Cc1cc(C)c2oc(N[C@@H]3CCCN(CCCO)C3)nc2c1	ZINC000450611728	DE	On-Demand	Anodyne	SSTR5	44	33
CCCC[C@H](NC(=O)c1ccc(-c2ccncc2)c(F)c1)C(=O)OC	ZINC000450611733	EG	On-Demand	Anodyne	ROCK2	36	40
CCCC[C@H](NC(=O)c1ccc(-c2ccncc2)c(F)c1)C(=O)OC	ZINC000450611733	EG	On-Demand	Anodyne	ERAP2	41	43
CCCC[C@@H](NC(=O)c1ccc(-c2ccncc2)c(F)c1)C(=O)OC	ZINC000450611734	EG	On-Demand	Anodyne	ROCK2	36	40
CCCC[C@@H](NC(=O)c1ccc(-c2ccncc2)c(F)c1)C(=O)OC	ZINC000450611734	EG	On-Demand	Anodyne	ERAP2	41	43
CCCC[C@@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OC	ZINC000450611740	CD	On-Demand	Anodyne	P2RY12	189	40
CCCC[C@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OC	ZINC000450611743	CD	On-Demand	Anodyne	P2RY12	189	40
COc1cc(-n2cccc2)c(Cl)cc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611744	ED	On-Demand	Anodyne	HTR3A	25	40
COc1cc(-n2cccc2)c(Cl)cc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611744	ED	On-Demand	Anodyne	HTR4	54	40
CN1C[C@@H](NC(=O)c2ccc(C(=O)OC(C)(C)C)cc2)C(=O)N1	ZINC000450611747	DC	On-Demand	Anodyne	PHZR	0	40
COc1cc(-n2cccc2)c(Cl)cc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611748	ED	On-Demand	Anodyne	HTR3A	25	40
COc1cc(-n2cccc2)c(Cl)cc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611748	ED	On-Demand	Anodyne	HTR4	54	40
COc1cc(CN2CCC[C@H]2C[C@H](C)O)ccc1Cl	ZINC000450611750	CG	On-Demand	Anodyne	DRD2	46	43
COc1cc(CN2CCC[C@H]2C[C@H](C)O)ccc1Cl	ZINC000450611750	CG	On-Demand	Anodyne	ACKR3	62	32
COc1cc(CN2CCC[C@@H]2C[C@@H](C)O)ccc1Cl	ZINC000450611752	CG	On-Demand	Anodyne	DRD2	46	43
COc1cc(CN2CCC[C@@H]2C[C@@H](C)O)ccc1Cl	ZINC000450611752	CG	On-Demand	Anodyne	ACKR3	62	32
COc1cc(CN2CCC[C@@H]2C[C@H](C)O)ccc1Cl	ZINC000450611753	CG	On-Demand	Anodyne	DRD2	46	43
COc1cc(CN2CCC[C@@H]2C[C@H](C)O)ccc1Cl	ZINC000450611753	CG	On-Demand	Anodyne	ACKR3	62	32
COc1cc(CN2CCC[C@H]2C[C@@H](C)O)ccc1Cl	ZINC000450611754	CG	On-Demand	Anodyne	DRD2	46	43
COc1cc(CN2CCC[C@H]2C[C@@H](C)O)ccc1Cl	ZINC000450611754	CG	On-Demand	Anodyne	ACKR3	62	32
CC(C)C[C@@H](C)Sc1nc2ccccc2c(=O)n1CCCO	ZINC000450611755	DG	On-Demand	Anodyne	SLC16A1	54	39
CC(C)C[C@H](C)Sc1nc2ccccc2c(=O)n1CCCO	ZINC000450611756	DG	On-Demand	Anodyne	SLC16A1	54	39
CN1C[C@H](NC(=O)c2ccc(C(=O)OC(C)(C)C)cc2)C(=O)N1	ZINC000450611758	DC	On-Demand	Anodyne	PHZR	0	40
COc1cc(CC(=O)N2CCn3c(O)nnc3C2)ccc1Cl	ZINC000450611773	DD	On-Demand	Anodyne	P2RX7	22	40
COc1cc(CC(=O)N2CCn3c(O)nnc3C2)ccc1Cl	ZINC000450611773	DD	On-Demand	Anodyne	CCR1	34	42
CCCC[C@@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611782	CF	On-Demand	Anodyne	CCKAR	0	41
CCCC[C@@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611782	CF	On-Demand	Anodyne	CTSK	30	41
CCCC[C@@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611782	CF	On-Demand	Anodyne	CTRB1	27	40
CCCC[C@@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611782	CF	On-Demand	Anodyne	ERAP2	42	43
CCCC[C@@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611782	CF	On-Demand	Anodyne	ERAP1	0	41
CCCC[C@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611783	CF	On-Demand	Anodyne	CCKAR	0	41
CCCC[C@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611783	CF	On-Demand	Anodyne	CTSK	30	41
CCCC[C@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611783	CF	On-Demand	Anodyne	CTRB1	27	40
CCCC[C@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611783	CF	On-Demand	Anodyne	ERAP2	42	43
CCCC[C@H](NC(=O)c1cccc(SC)c1)C(=O)OC	ZINC000450611783	CF	On-Demand	Anodyne	ERAP1	0	41
CCN(CCC1CC1)C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450611789	DG	On-Demand	Bother	ACKR3	44	30
CCCC[C@@H](NC(=O)[C@@H](CCC)OC)C(=O)OC	ZINC000450611797	CD	On-Demand	Anodyne	NOD1	65	33
CCCC[C@@H](NC(=O)[C@H](CCC)OC)C(=O)OC	ZINC000450611798	CD	On-Demand	Anodyne	NOD1	65	33
CCCC[C@H](NC(=O)[C@H](CCC)OC)C(=O)OC	ZINC000450611799	CD	On-Demand	Anodyne	NOD1	65	33
CCCC[C@H](NC(=O)[C@@H](CCC)OC)C(=O)OC	ZINC000450611800	CD	On-Demand	Anodyne	NOD1	65	33
COc1ccc(-c2nnn(C[C@H]3CCCC3(F)F)n2)cc1OC	ZINC000450611801	DF	On-Demand	Anodyne	SCARB1	49	46
COc1ccc(-c2nnn(C[C@@H]3CCCC3(F)F)n2)cc1OC	ZINC000450611802	DF	On-Demand	Anodyne	SCARB1	49	46
COc1ccc2c(c1)C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450611805	DB	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc2c(c1)C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450611805	DB	On-Demand	Anodyne	ROCK2	36	51
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	HTR1A	26	45
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	DRD2	29	53
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	ADRA1D	29	40
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	HTR2A	29	41
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	SLC6A1	105	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	ADRA1A	35	40
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	ADRA1B	27	40
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	DRD3	46	53
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	HRH3	25	43
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	SIGMAR1	30	48
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	CCR3	19	43
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	CHRNA7	31	46
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	PYGL	0	43
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	HNMT	53	33
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	EPHX2	17	40
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	CACNA1G	45	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	GNAI1	0	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	GNAI3	0	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	GNAO1	0	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	CYP2J2	43	30
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450611806	GH	On-Demand	Anodyne	TBK1	47	34
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	HTR1A	26	45
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	DRD2	29	53
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	ADRA1D	29	40
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	HTR2A	29	41
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	SLC6A1	105	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	ADRA1A	35	40
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	ADRA1B	27	40
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	DRD3	46	53
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	HRH3	25	43
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	SIGMAR1	30	48
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	CCR3	19	43
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	CHRNA7	31	46
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	PYGL	0	43
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	HNMT	53	33
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	EPHX2	17	40
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	CACNA1G	45	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	GNAI1	0	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	GNAI3	0	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	GNAO1	0	42
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	CYP2J2	43	30
O=C(NCCCN1CCCCC1)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450611807	GH	On-Demand	Anodyne	TBK1	47	34
COc1ccc2c(c1)C[C@H](C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450611811	DB	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc2c(c1)C[C@H](C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450611811	DB	On-Demand	Anodyne	ROCK2	36	51
Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N[C@H]5CN(C)NC5=O)(C4)C2)C3)cc1	ZINC000450611812	FE	On-Demand	Anodyne	BOTA	22	45
COc1ccc2c(c1)C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450611813	DB	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc2c(c1)C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)CO2	ZINC000450611813	DB	On-Demand	Anodyne	ROCK2	36	51
COc1ccc2c(c1)C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450611815	DB	On-Demand	Anodyne	MTNR1A	15	45
COc1ccc2c(c1)C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)CO2	ZINC000450611815	DB	On-Demand	Anodyne	ROCK2	36	51
Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N[C@@H]5CN(C)NC5=O)(C4)C2)C3)cc1	ZINC000450611821	FE	On-Demand	Anodyne	BOTA	22	45
CCOC(=O)c1cc(C(=O)NCc2nc3ccccc3n2C2CC2)on1	ZINC000450611823	FE	On-Demand	Anodyne	SMO	48	36
COCCNC(=O)c1ccc(NCCOc2ccc(F)c(Cl)c2)nc1	ZINC000450611824	FE	On-Demand	Anodyne	ALPL	15	41
COCCNC(=O)c1ccc(NCCOc2ccc(F)c(Cl)c2)nc1	ZINC000450611824	FE	On-Demand	Anodyne	GCK	24	41
COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1OC(C)C	ZINC000450611839	FI	On-Demand	Anodyne	COLA	53	38
COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1OC(C)C	ZINC000450611839	FI	On-Demand	Anodyne	CPT1A	52	38
COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1OC(C)C	ZINC000450611839	FI	On-Demand	Anodyne	CPT2	44	34
COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1OC(C)C	ZINC000450611839	FI	On-Demand	Anodyne	P4HTM	0	41
COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1OC(C)C	ZINC000450611839	FI	On-Demand	Anodyne	ENPP1	72	35
COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1OC(C)C	ZINC000450611839	FI	On-Demand	Anodyne	KCNK3	49	38
COc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1OC(C)C	ZINC000450611839	FI	On-Demand	Anodyne	KCNK9	42	38
O=C(c1ccccc1)c1ccc(N[C@@H]2CCCN(CCCO)C2)c([N+](=O)[O-])c1	ZINC000450611841	GG	On-Demand	Bother	SLC6A1	85	34
CN1C[C@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611847	EB	On-Demand	Anodyne	DRD2	24	40
CN1C[C@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611847	EB	On-Demand	Anodyne	DRD4	57	40
CN1C[C@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611847	EB	On-Demand	Anodyne	ACHE	29	45
CN1C[C@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611847	EB	On-Demand	Anodyne	DRD3	22	40
CN1C[C@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611847	EB	On-Demand	Anodyne	LTA4H	16	40
CN1C[C@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611847	EB	On-Demand	Anodyne	SIGMAR1	54	46
CN1C[C@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611847	EB	On-Demand	Anodyne	NPFFR1	47	33
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	ACE	75	47
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	OPRM1	41	37
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	MME	100	37
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	ANPEP	58	33
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	TACR1	31	40
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	MC4R	51	37
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	FCER2	76	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CTSB	62	44
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	TRY2_BOVIN	70	34
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	SRC	0	40
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	PAPA1_CARPA	51	51
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CYSP_TRYCR	53	42
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CTSK	28	42
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CTSL	66	39
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CCR3	0	47
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	NPFFR2	61	44
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	TIMP3	68	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	SCN9A	0	45
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	MC3R	51	38
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CAPNS1	49	30
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	HLA-DRB1	45	38
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	PAM	0	42
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CTSS	35	51
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CAPN1	57	37
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	MMP9	30	42
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	ACE2	68	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	MC1R	55	37
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	C5AR1	47	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	MMP1	33	42
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	FPR1	55	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	CTRB_BOVIN	47	34
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	POL	0	41
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	XIAP	40	33
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	SLC15A2	0	52
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	BLA1_STEMA	61	39
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	KISS1R	62	37
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	QRFPR	47	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	BRCA1	61	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	NPFFR1	54	40
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611849	FC	On-Demand	Anodyne	DERP1	0	46
CN1C[C@@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611850	EB	On-Demand	Anodyne	DRD2	24	40
CN1C[C@@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611850	EB	On-Demand	Anodyne	DRD4	57	40
CN1C[C@@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611850	EB	On-Demand	Anodyne	ACHE	29	45
CN1C[C@@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611850	EB	On-Demand	Anodyne	DRD3	22	40
CN1C[C@@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611850	EB	On-Demand	Anodyne	LTA4H	16	40
CN1C[C@@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611850	EB	On-Demand	Anodyne	SIGMAR1	54	46
CN1C[C@@H](NC(=O)CN2CCN(Cc3ccccc3)CC2)C(=O)N1	ZINC000450611850	EB	On-Demand	Anodyne	NPFFR1	47	33
CCN1CCN(c2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2F)CC1	ZINC000450611851	EC	On-Demand	Anodyne	NPY2R	46	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	ACE	75	47
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	OPRM1	41	37
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	MME	100	37
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	ANPEP	58	33
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	TACR1	31	40
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	MC4R	51	37
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	FCER2	76	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CTSB	62	44
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	TRY2_BOVIN	70	34
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	SRC	0	40
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	PAPA1_CARPA	51	51
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CYSP_TRYCR	53	42
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CTSK	28	42
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CTSL	66	39
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CCR3	0	47
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	NPFFR2	61	44
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	TIMP3	68	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	SCN9A	0	45
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	MC3R	51	38
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CAPNS1	49	30
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	HLA-DRB1	45	38
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	PAM	0	42
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CTSS	35	51
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CAPN1	57	37
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	MMP9	30	42
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	ACE2	68	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	MC1R	55	37
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	C5AR1	47	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	MMP1	33	42
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	FPR1	55	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	CTRB_BOVIN	47	34
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	POL	0	41
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	XIAP	40	33
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	SLC15A2	0	52
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	BLA1_STEMA	61	39
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	KISS1R	62	37
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	QRFPR	47	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	BRCA1	61	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	NPFFR1	54	40
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611852	FC	On-Demand	Anodyne	DERP1	0	46
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	ACE	75	47
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	OPRM1	41	37
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	MME	100	37
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	ANPEP	58	33
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	TACR1	31	40
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	MC4R	51	37
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	FCER2	76	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CTSB	62	44
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	TRY2_BOVIN	70	34
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	SRC	0	40
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	PAPA1_CARPA	51	51
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CYSP_TRYCR	53	42
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CTSK	28	42
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CTSL	66	39
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CCR3	0	47
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	NPFFR2	61	44
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	TIMP3	68	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	SCN9A	0	45
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	MC3R	51	38
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CAPNS1	49	30
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	HLA-DRB1	45	38
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	PAM	0	42
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CTSS	35	51
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CAPN1	57	37
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	MMP9	30	42
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	ACE2	68	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	MC1R	55	37
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	C5AR1	47	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	MMP1	33	42
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	FPR1	55	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	CTRB_BOVIN	47	34
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	POL	0	41
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	XIAP	40	33
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	SLC15A2	0	52
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	BLA1_STEMA	61	39
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	KISS1R	62	37
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	QRFPR	47	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	BRCA1	61	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	NPFFR1	54	40
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611853	FC	On-Demand	Anodyne	DERP1	0	46
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	ACE	75	47
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	OPRM1	41	37
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	MME	100	37
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	ANPEP	58	33
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	TACR1	31	40
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	MC4R	51	37
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	FCER2	76	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CTSB	62	44
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	TRY2_BOVIN	70	34
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	SRC	0	40
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	PAPA1_CARPA	51	51
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CYSP_TRYCR	53	42
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CTSK	28	42
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CTSL	66	39
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CCR3	0	47
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	NPFFR2	61	44
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	TIMP3	68	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	SCN9A	0	45
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	MC3R	51	38
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CAPNS1	49	30
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	HLA-DRB1	45	38
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	PAM	0	42
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CTSS	35	51
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CAPN1	57	37
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	MMP9	30	42
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	ACE2	68	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	MC1R	55	37
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	C5AR1	47	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	MMP1	33	42
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	FPR1	55	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	CTRB_BOVIN	47	34
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	POL	0	41
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	XIAP	40	33
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	SLC15A2	0	52
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	BLA1_STEMA	61	39
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	KISS1R	62	37
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	QRFPR	47	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	BRCA1	61	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	NPFFR1	54	40
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450611854	FC	On-Demand	Anodyne	DERP1	0	46
CC[C@H](CC(F)(F)F)NC(=O)c1cc2ccncc2s1	ZINC000450611855	DH	On-Demand	Anodyne	AKT1	51	32
CC[C@@H](CC(F)(F)F)NC(=O)c1cc2ccncc2s1	ZINC000450611856	DH	On-Demand	Anodyne	AKT1	51	32
CCN1CCN(c2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2F)CC1	ZINC000450611858	EC	On-Demand	Anodyne	NPY2R	46	36
O=c1c2ccccc2nc(SCc2cc[nH]n2)n1CCCO	ZINC000450611860	DD	On-Demand	Anodyne	SLC16A1	46	32
COc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1OC(C)C	ZINC000450611869	GH	On-Demand	Bother	CACNA1D	54	36
COc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1OC(C)C	ZINC000450611869	GH	On-Demand	Bother	PYGL	0	41
COc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1OC(C)C	ZINC000450611869	GH	On-Demand	Bother	ENPP1	76	37
COc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1OC(C)C	ZINC000450611869	GH	On-Demand	Bother	SENP1	0	41
CCCNC(=O)c1ccc(NC[C@H](Cc2ccccc2)OC)nc1	ZINC000450611871	EF	On-Demand	Anodyne	EPHX2	0	45
CCCNC(=O)c1ccc(NC[C@@H](Cc2ccccc2)OC)nc1	ZINC000450611872	EF	On-Demand	Anodyne	EPHX2	0	45
CC1(CSc2nc3ccccc3c(=O)n2CCCO)CCC1	ZINC000450611873	DG	On-Demand	Anodyne	SLC16A1	45	32
COc1ccc(C(=O)CCC(=O)N[C@@H]2CN(C)NC2=O)cc1OC	ZINC000450611877	EC	On-Demand	Anodyne	ENPP1	40	31
COc1ccc(C(=O)CCC(=O)N[C@@H]2CN(C)NC2=O)cc1OC	ZINC000450611877	EC	On-Demand	Anodyne	PDEC	0	40
COc1ccc(C(=O)CCC(=O)N[C@H]2CN(C)NC2=O)cc1OC	ZINC000450611878	EC	On-Demand	Anodyne	ENPP1	40	31
COc1ccc(C(=O)CCC(=O)N[C@H]2CN(C)NC2=O)cc1OC	ZINC000450611878	EC	On-Demand	Anodyne	PDEC	0	40
CN1C[C@H](NC(=O)c2cccc3[nH]ncc23)C(=O)N1	ZINC000450611879	CB	On-Demand	Anodyne	TRPV1	36	41
CN1C[C@@H](NC(=O)c2cccc3[nH]ncc23)C(=O)N1	ZINC000450611880	CB	On-Demand	Anodyne	TRPV1	36	41
COCCCn1c(SCc2cccc(C(C)=O)c2)nc2ccccc2c1=O	ZINC000450611882	GH	On-Demand	Anodyne	PTGDR2	18	59
CC(=O)c1ccc(CN2CCN(c3nc(C)c(C)s3)CC2)cc1	ZINC000450611888	EG	On-Demand	Anodyne	DRD4	15	44
CN1C[C@H](NC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C(=O)N1	ZINC000450611894	GB	On-Demand	Anodyne	MMP8	16	42
CN1C[C@H](NC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C(=O)N1	ZINC000450611894	GB	On-Demand	Anodyne	MMP1	18	42
CN1C[C@@H](NC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C(=O)N1	ZINC000450611895	GB	On-Demand	Anodyne	MMP8	16	42
CN1C[C@@H](NC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C(=O)N1	ZINC000450611895	GB	On-Demand	Anodyne	MMP1	18	42
CN1C[C@H](NC(=O)c2ccccc2OCCOc2ccccc2)C(=O)N1	ZINC000450611899	FD	On-Demand	Anodyne	HCN1	51	34
CN1C[C@H](NC(=O)c2ccccc2OCCOc2ccccc2)C(=O)N1	ZINC000450611899	FD	On-Demand	Anodyne	HCN4	41	31
CN1C[C@@H](NC(=O)c2ccccc2OCCOc2ccccc2)C(=O)N1	ZINC000450611900	FD	On-Demand	Anodyne	HCN1	51	34
CN1C[C@@H](NC(=O)c2ccccc2OCCOc2ccccc2)C(=O)N1	ZINC000450611900	FD	On-Demand	Anodyne	HCN4	41	31
CN1C[C@H](NC(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C(=O)N1	ZINC000450611922	EC	On-Demand	Anodyne	EPHX2	32	41
CN1C[C@@H](NC(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C(=O)N1	ZINC000450611923	EC	On-Demand	Anodyne	EPHX2	32	41
CCOC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)nc1	ZINC000450611930	FH	On-Demand	Anodyne	P2RY12	28	41
CCOC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)nc1	ZINC000450611930	FH	On-Demand	Anodyne	SSTR5	51	41
CCOC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)nc1	ZINC000450611930	FH	On-Demand	Anodyne	SCN9A	0	41
CCOC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)nc1	ZINC000450611930	FH	On-Demand	Anodyne	SCN5A	57	41
CCOC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)nc1	ZINC000450611930	FH	On-Demand	Anodyne	SCD1	46	46
CCOC(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)nc1	ZINC000450611930	FH	On-Demand	Anodyne	SCD	31	41
COc1ccc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cc1OC(C)C	ZINC000450611931	EI	On-Demand	Anodyne	ENPP1	75	36
COc1ccc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cc1OC(C)C	ZINC000450611931	EI	On-Demand	Anodyne	KCNK3	50	40
COc1ccc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cc1OC(C)C	ZINC000450611931	EI	On-Demand	Anodyne	KCNK9	39	40
CN1C[C@H](NC(=O)CCc2ccnc3ccccc23)C(=O)N1	ZINC000450611933	CC	On-Demand	Anodyne	HNMT	44	32
CN1C[C@@H](NC(=O)CCc2ccnc3ccccc23)C(=O)N1	ZINC000450611934	CC	On-Demand	Anodyne	HNMT	44	32
CN1C[C@@H](NC(=O)CCSc2ccnc3cc(Cl)ccc23)C(=O)N1	ZINC000450611940	FD	On-Demand	Anodyne	HRP1_PLAFA	104	39
CN1C[C@@H](NC(=O)CCSc2ccnc3cc(Cl)ccc23)C(=O)N1	ZINC000450611940	FD	On-Demand	Anodyne	HNMT	49	34
CN1C[C@H](NC(=O)CCSc2ccnc3cc(Cl)ccc23)C(=O)N1	ZINC000450611941	FD	On-Demand	Anodyne	HRP1_PLAFA	104	39
CN1C[C@H](NC(=O)CCSc2ccnc3cc(Cl)ccc23)C(=O)N1	ZINC000450611941	FD	On-Demand	Anodyne	HNMT	49	34
c1nn[nH]c1CN1CCC(CCCN2CCCC2)CC1	ZINC000450611948	CD	On-Demand	Anodyne	NPY1R	40	34
COC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450611949	FD	On-Demand	Anodyne	AVPR1B	40	40
COC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450611949	FD	On-Demand	Anodyne	HDAC8	26	41
COC(=O)[C@@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450611949	FD	On-Demand	Anodyne	IMDH_CRYPV	35	53
COC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450611950	FD	On-Demand	Anodyne	AVPR1B	40	40
COC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450611950	FD	On-Demand	Anodyne	HDAC8	26	41
COC(=O)[C@](C)(O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450611950	FD	On-Demand	Anodyne	IMDH_CRYPV	35	53
COCCOC1(CNc2ncnc3cc(F)c(OC)cc23)CCOCC1	ZINC000450611958	FD	On-Demand	Anodyne	EGFR	37	40
COCCOC1(CNc2ncnc3cc(F)c(OC)cc23)CCOCC1	ZINC000450611958	FD	On-Demand	Anodyne	FGFR1	22	42
COCCOC1(CNc2ncnc3cc(F)c(OC)cc23)CCOCC1	ZINC000450611958	FD	On-Demand	Anodyne	FLT1	33	43
COCCOC1(CNc2ncnc3cc(F)c(OC)cc23)CCOCC1	ZINC000450611958	FD	On-Demand	Anodyne	EPHA2	46	35
COCCOC1(CNc2ncnc3scc(-c4ccccc4)c23)CCOCC1	ZINC000450611963	GH	On-Demand	Anodyne	TNK2	46	33
C[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611967	CC	On-Demand	Anodyne	AVPR1A	30	43
C[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611968	CC	On-Demand	Anodyne	AVPR1A	30	43
C[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450611969	CC	On-Demand	Anodyne	AVPR1A	30	43
C[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450611970	CC	On-Demand	Anodyne	AVPR1A	30	43
COC(=O)[C@@](C)(O)CNC(=O)c1cnn2ccc(C)cc12	ZINC000450611980	CC	On-Demand	Anodyne	EPHB3	36	51
COC(=O)[C@](C)(O)CNC(=O)c1cnn2ccc(C)cc12	ZINC000450611981	CC	On-Demand	Anodyne	EPHB3	36	51
CN1C[C@H](NC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)N1	ZINC000450611987	DC	On-Demand	Anodyne	HCRTR1	22	41
CN1C[C@H](NC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)N1	ZINC000450611987	DC	On-Demand	Anodyne	SCN9A	0	41
CN1C[C@H](NC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)N1	ZINC000450611987	DC	On-Demand	Anodyne	SLC6A9	23	41
CN1C[C@@H](NC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)N1	ZINC000450611988	DC	On-Demand	Anodyne	HCRTR1	22	41
CN1C[C@@H](NC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)N1	ZINC000450611988	DC	On-Demand	Anodyne	SCN9A	0	41
CN1C[C@@H](NC(=O)Cc2cccc(OC(F)(F)F)c2)C(=O)N1	ZINC000450611988	DC	On-Demand	Anodyne	SLC6A9	23	41
COCCOC1(CNc2ncnc3ccc(C)cc23)CCOCC1	ZINC000450611992	ED	On-Demand	Anodyne	CLK4	56	38
Cc1cncc(-c2nc(CN3CC[C@H](Oc4ccccc4Cl)C3)no2)c1	ZINC000450611997	FH	On-Demand	Anodyne	SCD1	25	44
Cc1cncc(-c2nc(CN3CC[C@@H](Oc4ccccc4Cl)C3)no2)c1	ZINC000450611998	FH	On-Demand	Anodyne	SCD1	25	44
CC1(c2ccccc2)CCN(C[C@@H]2CCNC(=O)CC2)CC1	ZINC000450612001	DF	On-Demand	Anodyne	OPRL1	17	43
CC1(c2ccccc2)CCN(C[C@H]2CCNC(=O)CC2)CC1	ZINC000450612002	DF	On-Demand	Anodyne	OPRL1	17	43
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612005	GD	On-Demand	Anodyne	ECR	41	34
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612005	GD	On-Demand	Anodyne	PPARD	15	42
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612005	GD	On-Demand	Anodyne	ROCK2	16	40
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612005	GD	On-Demand	Anodyne	MT-ND1	17	41
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612005	GD	On-Demand	Anodyne	KCNK3	46	39
COC(=O)[C@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612006	GD	On-Demand	Anodyne	ECR	41	34
COC(=O)[C@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612006	GD	On-Demand	Anodyne	PPARD	15	42
COC(=O)[C@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612006	GD	On-Demand	Anodyne	ROCK2	16	40
COC(=O)[C@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612006	GD	On-Demand	Anodyne	MT-ND1	17	41
COC(=O)[C@](C)(O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450612006	GD	On-Demand	Anodyne	KCNK3	46	39
CO[C@H](CNc1ncc(C(=O)N2CCOCC2)cc1Cl)Cc1ccccc1	ZINC000450612008	GF	On-Demand	Anodyne	LRRK2	32	41
CO[C@@H](CNc1ncc(C(=O)N2CCOCC2)cc1Cl)Cc1ccccc1	ZINC000450612009	GF	On-Demand	Anodyne	LRRK2	32	41
CCN(C(=O)c1ocnc1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612027	GI	On-Demand	Anodyne	DRD4	36	42
CCN(C(=O)c1ocnc1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612027	GI	On-Demand	Anodyne	ACHE	29	42
CCN(C(=O)c1ocnc1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612027	GI	On-Demand	Anodyne	SIGMAR1	31	44
CCN(C(=O)c1ocnc1-c1ccccc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612027	GI	On-Demand	Anodyne	CCR5	45	44
CCN(C(=O)c1ocnc1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612028	GI	On-Demand	Anodyne	DRD4	36	42
CCN(C(=O)c1ocnc1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612028	GI	On-Demand	Anodyne	ACHE	29	42
CCN(C(=O)c1ocnc1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612028	GI	On-Demand	Anodyne	SIGMAR1	31	44
CCN(C(=O)c1ocnc1-c1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612028	GI	On-Demand	Anodyne	CCR5	45	44
CN1C[C@H](NC(=O)c2cccc(NC(=O)CCCc3cccs3)c2)C(=O)N1	ZINC000450612029	GD	On-Demand	Anodyne	PTPRF	20	46
CN1C[C@@H](NC(=O)c2cccc(NC(=O)CCCc3cccs3)c2)C(=O)N1	ZINC000450612032	GD	On-Demand	Anodyne	PTPRF	20	46
COc1ccc(OC(F)(F)F)c(C(=O)NCCc2ccn(C)n2)c1	ZINC000450612037	EE	On-Demand	Anodyne	DRD4	41	32
COc1ccc(OC(F)(F)F)c(C(=O)NCCc2ccn(C)n2)c1	ZINC000450612037	EE	On-Demand	Anodyne	MTNR1A	51	39
COc1ccc(OC(F)(F)F)c(C(=O)NCCc2ccn(C)n2)c1	ZINC000450612037	EE	On-Demand	Anodyne	MTNR1B	46	38
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2ccc(OC)cc2c1	ZINC000450612065	DD	On-Demand	Anodyne	DRD4	45	36
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2ccc(OC)cc2c1	ZINC000450612065	DD	On-Demand	Anodyne	MTNR1A	47	37
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2ccc(OC)cc2c1	ZINC000450612065	DD	On-Demand	Anodyne	MT-ND1	24	42
COC(=O)[C@](C)(O)CNC(=O)c1ccc2ccc(OC)cc2c1	ZINC000450612071	DD	On-Demand	Anodyne	DRD4	45	36
COC(=O)[C@](C)(O)CNC(=O)c1ccc2ccc(OC)cc2c1	ZINC000450612071	DD	On-Demand	Anodyne	MTNR1A	47	37
COC(=O)[C@](C)(O)CNC(=O)c1ccc2ccc(OC)cc2c1	ZINC000450612071	DD	On-Demand	Anodyne	MT-ND1	24	42
COCCOC1(CNc2nn3c(C)nnc3c3ccccc23)CCOCC1	ZINC000450612072	FD	On-Demand	Anodyne	CREBBP	46	39
COCCOC1(CNc2nn3c(C)nnc3c3ccccc23)CCOCC1	ZINC000450612072	FD	On-Demand	Anodyne	BRD9	58	39
CCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1OCCCC	ZINC000450612085	FE	On-Demand	Anodyne	THRA	51	37
CCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1OCCCC	ZINC000450612085	FE	On-Demand	Anodyne	THRB	42	37
CCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1OCCCC	ZINC000450612085	FE	On-Demand	Anodyne	PLA2G4B	53	38
CCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1OCCCC	ZINC000450612086	FE	On-Demand	Anodyne	THRA	51	37
CCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1OCCCC	ZINC000450612086	FE	On-Demand	Anodyne	THRB	42	37
CCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1OCCCC	ZINC000450612086	FE	On-Demand	Anodyne	PLA2G4B	53	38
COc1ccc(-c2nnn(Cc3cn(CC4CC4)nn3)n2)cc1OC	ZINC000450612094	ED	On-Demand	Anodyne	SCARB1	48	46
COC(=O)c1ccc(NC[C@H]2CCC[C@H]2c2ccccc2)nn1	ZINC000450612099	DF	On-Demand	Anodyne	VCP	54	35
COC(=O)c1ccc(NC[C@@H]2CCC[C@H]2c2ccccc2)nn1	ZINC000450612100	DF	On-Demand	Anodyne	VCP	54	35
COC(=O)c1ccc(NC[C@H]2CCC[C@@H]2c2ccccc2)nn1	ZINC000450612101	DF	On-Demand	Anodyne	VCP	54	35
COC(=O)c1ccc(NC[C@@H]2CCC[C@@H]2c2ccccc2)nn1	ZINC000450612102	DF	On-Demand	Anodyne	VCP	54	35
C[C@H](O)C[C@@H]1CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450612110	CE	On-Demand	Anodyne	SLC18A2	63	42
C[C@H](O)C[C@@H]1CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450612111	CE	On-Demand	Anodyne	SLC18A2	63	42
C[C@H](O)C[C@@H]1CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450612112	CE	On-Demand	Anodyne	SLC18A2	63	42
C[C@H](O)C[C@@H]1CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450612113	CE	On-Demand	Anodyne	SLC18A2	63	42
CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@H]3CN(C)NC3=O)c2)cc1	ZINC000450612124	GD	On-Demand	Anodyne	CYSLTR2	68	34
CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@H]3CN(C)NC3=O)c2)cc1	ZINC000450612124	GD	On-Demand	Anodyne	NAAA	15	41
CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@H]3CN(C)NC3=O)c2)cc1	ZINC000450612124	GD	On-Demand	Anodyne	FFAR1	44	43
CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@H]3CN(C)NC3=O)c2)cc1	ZINC000450612124	GD	On-Demand	Anodyne	FFAR4	44	40
CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@@H]3CN(C)NC3=O)c2)cc1	ZINC000450612125	GD	On-Demand	Anodyne	CYSLTR2	68	34
CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@@H]3CN(C)NC3=O)c2)cc1	ZINC000450612125	GD	On-Demand	Anodyne	NAAA	15	41
CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@@H]3CN(C)NC3=O)c2)cc1	ZINC000450612125	GD	On-Demand	Anodyne	FFAR1	44	43
CC(=O)CCc1ccc(OCc2cccc(C(=O)N[C@@H]3CN(C)NC3=O)c2)cc1	ZINC000450612125	GD	On-Demand	Anodyne	FFAR4	44	40
O=C(c1ccccc1)c1ccc(N[C@H]2CCCN(CCCO)C2)c([N+](=O)[O-])c1	ZINC000450612132	GG	On-Demand	Bother	SLC6A1	85	34
CC(C)C[C@@H](C)N1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450612140	EG	On-Demand	Anodyne	GNAI1	0	45
CC(C)C[C@@H](C)N1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450612140	EG	On-Demand	Anodyne	GNAI3	0	45
CC(C)C[C@@H](C)N1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450612140	EG	On-Demand	Anodyne	GNAO1	0	45
CC(C)C[C@H](C)N1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450612142	EG	On-Demand	Anodyne	GNAI1	0	45
CC(C)C[C@H](C)N1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450612142	EG	On-Demand	Anodyne	GNAI3	0	45
CC(C)C[C@H](C)N1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450612142	EG	On-Demand	Anodyne	GNAO1	0	45
OCCN1CCCC[C@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450612151	ED	On-Demand	Anodyne	DHOD	0	47
OCCN1CCCC[C@@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450612153	ED	On-Demand	Anodyne	DHOD	0	47
Cc1ccc(Br)cc1CC(=O)N1CCn2c(O)nnc2C1	ZINC000450612160	FD	On-Demand	Anodyne	P2RX7	23	41
CC(C)(C)OC(=O)c1ccccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450612164	EH	On-Demand	Anodyne	RBP4	52	35
COc1ccc(NC(=O)C(C)(C)C(C)(F)F)cc1OC(C)C	ZINC000450612172	DI	On-Demand	Anodyne	ENPP1	73	35
COc1ccc(NC(=O)C(C)(C)C(C)(F)F)cc1OC(C)C	ZINC000450612172	DI	On-Demand	Anodyne	KCNK3	46	44
COc1ccc(NC(=O)C(C)(C)C(C)(F)F)cc1OC(C)C	ZINC000450612172	DI	On-Demand	Anodyne	KCNK9	45	44
CC[C@@H](C)[C@@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])OC	ZINC000450612181	EF	On-Demand	Bother	TAAR1	17	44
CC[C@@H](C)[C@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])OC	ZINC000450612182	EF	On-Demand	Bother	TAAR1	17	44
CC[C@H](C)[C@@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])OC	ZINC000450612183	EF	On-Demand	Bother	TAAR1	17	44
CC[C@H](C)[C@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])OC	ZINC000450612185	EF	On-Demand	Bother	TAAR1	17	44
O=C(NCCCN1CCCCC1)C1CCN(CC2=CCCCC2)CC1	ZINC000450612190	EG	On-Demand	Anodyne	GNAI1	0	44
O=C(NCCCN1CCCCC1)C1CCN(CC2=CCCCC2)CC1	ZINC000450612190	EG	On-Demand	Anodyne	GNAI3	0	44
O=C(NCCCN1CCCCC1)C1CCN(CC2=CCCCC2)CC1	ZINC000450612190	EG	On-Demand	Anodyne	GNAO1	0	44
O=C(CCCC(=O)C1CC1)NCc1nc2ccccc2n1C1CC1	ZINC000450612192	EG	On-Demand	Anodyne	HTR7	27	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCn2c(O)nnc2C1	ZINC000450612193	ED	On-Demand	Anodyne	P2RX7	48	46
COCCOC[C@H](O)CN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450612203	ED	On-Demand	Anodyne	CYP2D6	24	41
COCCOC[C@H](O)CN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450612203	ED	On-Demand	Anodyne	ABCB1	42	37
COCCOC[C@H](O)CN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450612203	ED	On-Demand	Anodyne	HSP90AB1	39	43
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	ACE	44	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	PPARA	15	47
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	MME	123	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	ANPEP	68	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	FCER2	55	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	CTSB	52	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	PAPA1_CARPA	68	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	CYSP_TRYCR	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	CPA1	40	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	CTRB1	27	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	CAPNS1	77	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	MMP8	17	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	HLA-DRB1	51	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	SOAT1	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	CAPN1	87	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	MMP9	17	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	CAPN2	74	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	ACE2	67	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	FPR1	62	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	AMP1_PLAFQ	49	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612206	DH	On-Demand	Anodyne	PSMB8	48	33
COCCOC[C@H](O)CN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450612207	ED	On-Demand	Anodyne	CYP2D6	24	41
COCCOC[C@H](O)CN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450612207	ED	On-Demand	Anodyne	ABCB1	42	37
COCCOC[C@H](O)CN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450612207	ED	On-Demand	Anodyne	HSP90AB1	39	43
COCCOC[C@@H](O)CN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450612208	ED	On-Demand	Anodyne	CYP2D6	24	41
COCCOC[C@@H](O)CN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450612208	ED	On-Demand	Anodyne	ABCB1	42	37
COCCOC[C@@H](O)CN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450612208	ED	On-Demand	Anodyne	HSP90AB1	39	43
COCCOC[C@@H](O)CN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450612209	ED	On-Demand	Anodyne	CYP2D6	24	41
COCCOC[C@@H](O)CN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450612209	ED	On-Demand	Anodyne	ABCB1	42	37
COCCOC[C@@H](O)CN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450612209	ED	On-Demand	Anodyne	HSP90AB1	39	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000450612211	DH	On-Demand	Anodyne	SOAT1	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	ACE	44	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	PPARA	15	47
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	MME	123	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	ANPEP	68	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	FCER2	55	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	CTSB	52	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	PAPA1_CARPA	68	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	CYSP_TRYCR	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	CPA1	40	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	CTRB1	27	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	CAPNS1	77	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	MMP8	17	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	HLA-DRB1	51	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	SOAT1	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	CAPN1	87	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	MMP9	17	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	CAPN2	74	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	ACE2	67	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	FPR1	62	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	AMP1_PLAFQ	49	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000450612212	DH	On-Demand	Anodyne	PSMB8	48	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000450612213	DH	On-Demand	Anodyne	SOAT1	0	40
C[C@@H](O)CCSc1nc2ccsc2c(=O)n1Cc1ccccc1	ZINC000450612217	EG	On-Demand	Anodyne	ERCC5	25	40
C[C@@H](O)CCSc1nc2ccsc2c(=O)n1Cc1ccccc1	ZINC000450612217	EG	On-Demand	Anodyne	KIF11	0	49
C[C@H](O)CCSc1nc2ccsc2c(=O)n1Cc1ccccc1	ZINC000450612218	EG	On-Demand	Anodyne	ERCC5	25	40
C[C@H](O)CCSc1nc2ccsc2c(=O)n1Cc1ccccc1	ZINC000450612218	EG	On-Demand	Anodyne	KIF11	0	49
CC(C)CCCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612221	BC	On-Demand	Anodyne	LASR	43	37
CC(C)CCCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450612222	BC	On-Demand	Anodyne	LASR	43	37
Cc1ccc(F)c(CC(=O)NCc2nc3ccccc3n2C2CC2)c1	ZINC000450612223	EH	On-Demand	Anodyne	PLD1	75	37
Cc1ccc(F)c(CC(=O)NCc2nc3ccccc3n2C2CC2)c1	ZINC000450612223	EH	On-Demand	Anodyne	PLD2	47	37
CC[C@@H]1C[C@H]1C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450612225	CG	On-Demand	Anodyne	CCR5	15	41
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCn2c(O)nnc2C1	ZINC000450612227	FD	On-Demand	Bother	P2RX7	38	42
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCn2c(O)nnc2C1	ZINC000450612227	FD	On-Demand	Bother	PPXII	0	41
OC[C@H]1CCCN1c1cc(NCCOc2ccc(F)c(Cl)c2)ncn1	ZINC000450612228	FF	On-Demand	Anodyne	PRCP	24	41
OC[C@@H]1CCCN1c1cc(NCCOc2ccc(F)c(Cl)c2)ncn1	ZINC000450612230	FF	On-Demand	Anodyne	PRCP	24	41
CCCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612231	DD	On-Demand	Anodyne	THRA	57	46
CCCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612231	DD	On-Demand	Anodyne	THRB	45	46
CCCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612231	DD	On-Demand	Anodyne	CYSLTR2	46	33
CCCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612231	DD	On-Demand	Anodyne	HRH3	25	42
CCCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612231	DD	On-Demand	Anodyne	PLA2G4B	84	43
CCCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612231	DD	On-Demand	Anodyne	GBA2	46	32
CCCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612232	DD	On-Demand	Anodyne	THRA	57	46
CCCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612232	DD	On-Demand	Anodyne	THRB	45	46
CCCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612232	DD	On-Demand	Anodyne	CYSLTR2	46	33
CCCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612232	DD	On-Demand	Anodyne	HRH3	25	42
CCCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612232	DD	On-Demand	Anodyne	PLA2G4B	84	43
CCCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612232	DD	On-Demand	Anodyne	GBA2	46	32
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	ACE	80	40
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	GHRHR	43	34
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	MME	45	35
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	SSTR4	44	36
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	NPFFR2	45	33
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	HDAC10	40	37
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	MMP3	50	38
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	HDAC11	43	38
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	BIRC2	55	37
C[C@@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612243	CD	On-Demand	Anodyne	BIRC8	41	33
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	ACE	80	40
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	GHRHR	43	34
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	MME	45	35
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	SSTR4	44	36
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	NPFFR2	45	33
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	HDAC10	40	37
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	MMP3	50	38
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	HDAC11	43	38
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	BIRC2	55	37
C[C@@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612244	CD	On-Demand	Anodyne	BIRC8	41	33
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	ACE	80	40
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	GHRHR	43	34
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	MME	45	35
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	SSTR4	44	36
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	NPFFR2	45	33
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	HDAC10	40	37
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	MMP3	50	38
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	HDAC11	43	38
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	BIRC2	55	37
C[C@H](CCCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612245	CD	On-Demand	Anodyne	BIRC8	41	33
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	ACE	80	40
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	GHRHR	43	34
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	MME	45	35
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	SSTR4	44	36
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	NPFFR2	45	33
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	HDAC10	40	37
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	MMP3	50	38
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	HDAC11	43	38
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	BIRC2	55	37
C[C@H](CCCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612246	CD	On-Demand	Anodyne	BIRC8	41	33
COC(=O)c1ccc(C(=O)CSc2nnc(Cc3csc(C)n3)o2)o1	ZINC000450612247	GF	On-Demand	Anodyne	CPB	0	40
CNC(=O)c1ccc(NCC(C)(C)c2ccccn2)c([N+](=O)[O-])c1	ZINC000450612255	EF	On-Demand	Bother	TAAR1	17	42
COc1ccc(NC(=O)CCCC(=O)C(C)(C)C)cc1OC(C)C	ZINC000450612258	EI	On-Demand	Anodyne	ENPP1	81	38
COc1ccc(NC(=O)CCCC(=O)C(C)(C)C)cc1OC(C)C	ZINC000450612258	EI	On-Demand	Anodyne	ACAT	0	51
CCCOc1ccc(C(=O)CCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612261	EC	On-Demand	Anodyne	THRA	26	44
CCCOc1ccc(C(=O)CCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612261	EC	On-Demand	Anodyne	THRB	0	43
CCCOc1ccc(C(=O)CCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612262	EC	On-Demand	Anodyne	THRA	26	44
CCCOc1ccc(C(=O)CCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612262	EC	On-Demand	Anodyne	THRB	0	43
COCc1nn(C)cc1C(=O)NC(c1ccccc1C)c1ccccc1C	ZINC000450612283	FH	On-Demand	Anodyne	CTSA	56	41
COc1ccc(NC(=O)CCc2nc3cnccc3[nH]2)cc1OC(C)C	ZINC000450612287	FG	On-Demand	Anodyne	IMPDH2	0	40
COc1ccc(NC(=O)CCc2nc3cnccc3[nH]2)cc1OC(C)C	ZINC000450612287	FG	On-Demand	Anodyne	ENPP1	76	46
COc1cc(C)nc(N[C@@H]2CCCN(CCCO)C2)n1	ZINC000450612288	CD	On-Demand	Anodyne	EHMT2	47	30
COc1cc(C)nc(N[C@H]2CCCN(CCCO)C2)n1	ZINC000450612294	CD	On-Demand	Anodyne	EHMT2	47	30
C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612297	EA	On-Demand	Anodyne	BIRC3	44	37
C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612297	EA	On-Demand	Anodyne	BIRC2	55	35
C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612297	EA	On-Demand	Anodyne	BIRC8	48	37
O=C(NCCCN1CCCCC1)C1CCN(Cc2cc[nH]n2)CC1	ZINC000450612298	ED	On-Demand	Anodyne	HRP1_PLAFA	30	44
O=C(NCCCN1CCCCC1)C1CCN(Cc2cc[nH]n2)CC1	ZINC000450612298	ED	On-Demand	Anodyne	HNMT	60	33
O=C(NCCCN1CCCCC1)C1CCN(Cc2cc[nH]n2)CC1	ZINC000450612298	ED	On-Demand	Anodyne	GNAI1	0	40
O=C(NCCCN1CCCCC1)C1CCN(Cc2cc[nH]n2)CC1	ZINC000450612298	ED	On-Demand	Anodyne	GNAI3	0	40
O=C(NCCCN1CCCCC1)C1CCN(Cc2cc[nH]n2)CC1	ZINC000450612298	ED	On-Demand	Anodyne	GNAO1	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450612299	GH	On-Demand	Bother	CACNA1C	52	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450612299	GH	On-Demand	Bother	CACNA1D	85	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450612299	GH	On-Demand	Bother	CCR3	0	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450612299	GH	On-Demand	Bother	SENP1	0	43
C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612300	EA	On-Demand	Anodyne	BIRC3	44	37
C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612300	EA	On-Demand	Anodyne	BIRC2	55	35
C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612300	EA	On-Demand	Anodyne	BIRC8	48	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450612302	GH	On-Demand	Bother	CACNA1C	52	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450612302	GH	On-Demand	Bother	CACNA1D	85	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450612302	GH	On-Demand	Bother	CCR3	0	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000450612302	GH	On-Demand	Bother	SENP1	0	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450612303	FH	On-Demand	Anodyne	MTNR1A	20	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450612303	FH	On-Demand	Anodyne	MTNR1B	27	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450612303	FH	On-Demand	Anodyne	NPY5R	20	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450612303	FH	On-Demand	Anodyne	ELOVL6	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450612303	FH	On-Demand	Anodyne	NAMPT	25	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450612303	FH	On-Demand	Anodyne	GPR88	0	45
CN1C[C@@H](NC(=O)c2cc3ccc(C(F)(F)F)cc3[nH]2)C(=O)N1	ZINC000450612304	ED	On-Demand	Anodyne	PYGL	32	46
CN1C[C@@H](NC(=O)c2cc3ccc(C(F)(F)F)cc3[nH]2)C(=O)N1	ZINC000450612304	ED	On-Demand	Anodyne	PYGM	42	46
CN1C[C@H](NC(=O)c2cc3ccc(C(F)(F)F)cc3[nH]2)C(=O)N1	ZINC000450612305	ED	On-Demand	Anodyne	PYGL	32	46
CN1C[C@H](NC(=O)c2cc3ccc(C(F)(F)F)cc3[nH]2)C(=O)N1	ZINC000450612305	ED	On-Demand	Anodyne	PYGM	42	46
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CC3CC3)nn2)cc1	ZINC000450612311	EE	On-Demand	Anodyne	TIMP3	41	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CC3CC3)nn2)cc1	ZINC000450612312	EE	On-Demand	Anodyne	TIMP3	41	32
CN1C[C@H](NC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)C(=O)N1	ZINC000450612313	GB	On-Demand	Anodyne	F2	23	40
CN1C[C@H](NC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)C(=O)N1	ZINC000450612313	GB	On-Demand	Anodyne	HTR7	23	45
CN1C[C@H](NC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)C(=O)N1	ZINC000450612313	GB	On-Demand	Anodyne	TRY2_BOVIN	72	36
CN1C[C@@H](NC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)C(=O)N1	ZINC000450612314	GB	On-Demand	Anodyne	F2	23	40
CN1C[C@@H](NC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)C(=O)N1	ZINC000450612314	GB	On-Demand	Anodyne	HTR7	23	45
CN1C[C@@H](NC(=O)CCNS(=O)(=O)c2ccc3ccccc3c2)C(=O)N1	ZINC000450612314	GB	On-Demand	Anodyne	TRY2_BOVIN	72	36
COCc1cc(NCCOc2ccc(F)c(Cl)c2)n2ncnc2n1	ZINC000450612315	FF	On-Demand	Anodyne	DHOD	0	41
COc1cc(CN(C)Cc2cccnc2)ccc1Cl	ZINC000450612325	CG	On-Demand	Anodyne	NR1D1	46	41
COc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1OC(C)C	ZINC000450612328	GI	On-Demand	Anodyne	COLA	51	36
COc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1OC(C)C	ZINC000450612328	GI	On-Demand	Anodyne	CPT1A	49	36
COc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1OC(C)C	ZINC000450612328	GI	On-Demand	Anodyne	CPT2	45	35
COc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1OC(C)C	ZINC000450612328	GI	On-Demand	Anodyne	GCK	28	43
COc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1OC(C)C	ZINC000450612328	GI	On-Demand	Anodyne	ENPP1	72	36
COc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1OC(C)C	ZINC000450612328	GI	On-Demand	Anodyne	KCNK3	44	35
COc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1OC(C)C	ZINC000450612328	GI	On-Demand	Anodyne	KCNK9	42	35
COC(=O)c1cccc(CC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450612336	CB	On-Demand	Anodyne	LEPB	0	44
COC(=O)c1cccc(CC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450612337	CB	On-Demand	Anodyne	LEPB	0	44
COCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612347	DC	On-Demand	Anodyne	KCNQ1	0	41
COCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612347	DC	On-Demand	Anodyne	HRH3	24	40
COCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612348	DC	On-Demand	Anodyne	KCNQ1	0	41
COCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612348	DC	On-Demand	Anodyne	HRH3	24	40
CCN(C(=O)c1cncc(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612351	EG	On-Demand	Anodyne	DRD4	40	42
CCN(C(=O)c1cncc(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612351	EG	On-Demand	Anodyne	ACHE	31	42
CCN(C(=O)c1cncc(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612351	EG	On-Demand	Anodyne	DRD3	27	40
CCN(C(=O)c1cncc(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612351	EG	On-Demand	Anodyne	SIGMAR1	41	42
CCN(C(=O)c1cncc(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612351	EG	On-Demand	Anodyne	SSTR5	41	39
CCN(C(=O)c1cncc(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612351	EG	On-Demand	Anodyne	CCR5	46	42
CCN(C(=O)c1cncc(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612351	EG	On-Demand	Anodyne	MCHR1	28	44
CCN(C(=O)c1cncc(Cl)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612351	EG	On-Demand	Anodyne	CACNA1I	45	37
CCN(C(=O)c1cncc(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612352	EG	On-Demand	Anodyne	DRD4	40	42
CCN(C(=O)c1cncc(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612352	EG	On-Demand	Anodyne	ACHE	31	42
CCN(C(=O)c1cncc(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612352	EG	On-Demand	Anodyne	DRD3	27	40
CCN(C(=O)c1cncc(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612352	EG	On-Demand	Anodyne	SIGMAR1	41	42
CCN(C(=O)c1cncc(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612352	EG	On-Demand	Anodyne	SSTR5	41	39
CCN(C(=O)c1cncc(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612352	EG	On-Demand	Anodyne	CCR5	46	42
CCN(C(=O)c1cncc(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612352	EG	On-Demand	Anodyne	MCHR1	28	44
CCN(C(=O)c1cncc(Cl)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612352	EG	On-Demand	Anodyne	CACNA1I	45	37
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	CHRM2	21	42
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	DRD4	40	42
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	ACHE	36	44
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	OPRM1	26	56
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	OPRD1	29	56
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	OPRK1	16	49
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	LTA4H	20	43
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	SIGMAR1	50	47
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	CCR5	64	51
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	MCHR1	23	41
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	CYP2J2	48	37
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	MBTPS1	73	39
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612368	GF	On-Demand	Anodyne	NPFFR1	47	36
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	CHRM2	21	42
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	DRD4	40	42
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	ACHE	36	44
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	OPRM1	26	56
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	OPRD1	29	56
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	OPRK1	16	49
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	LTA4H	20	43
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	SIGMAR1	50	47
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	CCR5	64	51
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	MCHR1	23	41
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	CYP2J2	48	37
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	MBTPS1	73	39
CCN(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612369	GF	On-Demand	Anodyne	NPFFR1	47	36
C=CCn1c(SCc2oc(CC)nc2C)nc2ccccc21	ZINC000450612374	DI	On-Demand	Mild	PTGDR2	16	40
CN1C[C@H](NC(=O)Cc2cc(Br)ccc2F)C(=O)N1	ZINC000450612377	EC	On-Demand	Anodyne	P2RX7	25	41
CN1C[C@@H](NC(=O)Cc2cc(Br)ccc2F)C(=O)N1	ZINC000450612378	EC	On-Demand	Anodyne	P2RX7	25	41
CCC[C@@H](O)CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1	ZINC000450612384	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCC[C@H](O)CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1	ZINC000450612385	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCC[C@H](O)CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1	ZINC000450612386	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCC[C@@H](O)CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1	ZINC000450612388	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CN1C[C@@H](NC(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)C(=O)N1	ZINC000450612398	FC	On-Demand	Anodyne	TRPV1	29	43
CN1C[C@H](NC(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)C(=O)N1	ZINC000450612400	FC	On-Demand	Anodyne	TRPV1	29	43
CN1C[C@H](NC(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)C(=O)N1	ZINC000450612402	FC	On-Demand	Anodyne	TRPV1	29	43
CN1C[C@@H](NC(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)C(=O)N1	ZINC000450612404	FC	On-Demand	Anodyne	TRPV1	29	43
CCN(CCC1CC1)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450612407	CH	On-Demand	Anodyne	SLC6A2	15	42
CN1C[C@@H](NC(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)C(=O)N1	ZINC000450612408	EC	On-Demand	Anodyne	PHZR	0	44
CC(C)c1nnc(CSc2nc3ccccc3c(=O)n2CCCO)s1	ZINC000450612410	GG	On-Demand	Anodyne	SLC16A1	48	34
CN1C[C@H](NC(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)C(=O)N1	ZINC000450612414	EC	On-Demand	Anodyne	PHZR	0	44
C=CCOc1ccccc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612427	CC	On-Demand	Mild	HCN1	41	31
C=CCOc1ccccc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612427	CC	On-Demand	Mild	HCN4	41	31
C=CCOc1ccccc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612429	CC	On-Demand	Mild	HCN1	41	31
C=CCOc1ccccc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612429	CC	On-Demand	Mild	HCN4	41	31
CCC(=O)CCCN1CCC(CCCN2CCCC2)CC1	ZINC000450612450	CG	On-Demand	Anodyne	NPY1R	40	37
CCC(=O)CCCN1CCC(CCCN2CCCC2)CC1	ZINC000450612450	CG	On-Demand	Anodyne	CYP2J2	47	34
COCCOC1(CNc2ccnc3cc(F)ccc23)CCOCC1	ZINC000450612461	EF	On-Demand	Anodyne	HNMT	40	31
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612471	FH	On-Demand	Anodyne	ACHE	25	40
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612471	FH	On-Demand	Anodyne	SIGMAR1	36	41
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612471	FH	On-Demand	Anodyne	CCR5	36	40
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612471	FH	On-Demand	Anodyne	CCR2	17	42
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612471	FH	On-Demand	Anodyne	CACNA1G	32	43
CCCC[C@@H](NC(=O)c1cn2nccc2nc1C)C(=O)OC	ZINC000450612473	DD	On-Demand	Anodyne	P2RY12	43	31
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612474	FH	On-Demand	Anodyne	ACHE	25	40
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612474	FH	On-Demand	Anodyne	SIGMAR1	36	41
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612474	FH	On-Demand	Anodyne	CCR5	36	40
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612474	FH	On-Demand	Anodyne	CCR2	17	42
CCN(C(=O)c1ccc(C(F)(F)F)[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612474	FH	On-Demand	Anodyne	CACNA1G	32	43
CCCC[C@H](NC(=O)c1cn2nccc2nc1C)C(=O)OC	ZINC000450612477	DD	On-Demand	Anodyne	P2RY12	43	31
COCCOc1cccc(CC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450612484	DB	On-Demand	Anodyne	UPP1	58	36
COCCOc1cccc(CC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450612486	DB	On-Demand	Anodyne	UPP1	58	36
COc1ccc(-c2noc(NCC(C)(C)c3ccccn3)n2)cc1	ZINC000450612488	DF	On-Demand	Anodyne	LUCI_PHOPE	49	42
CCCC[C@H](NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(=O)OC	ZINC000450612489	FE	On-Demand	Anodyne	P2RY12	54	38
CCCC[C@H](NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(=O)OC	ZINC000450612489	FE	On-Demand	Anodyne	NOD1	54	33
CCCC[C@@H](NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(=O)OC	ZINC000450612491	FE	On-Demand	Anodyne	P2RY12	54	38
CCCC[C@@H](NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(=O)OC	ZINC000450612491	FE	On-Demand	Anodyne	NOD1	54	33
CN1C[C@H](NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)C(=O)N1	ZINC000450612512	GD	On-Demand	Anodyne	CCR2	45	34
CN1C[C@@H](NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)C(=O)N1	ZINC000450612513	GD	On-Demand	Anodyne	CCR2	45	34
CC(=O)CCCCCOc1ccccc1Br	ZINC000450612516	CH	On-Demand	Anodyne	THRA	30	41
CC(=O)CCCCCOc1ccccc1Br	ZINC000450612516	CH	On-Demand	Anodyne	THRB	21	41
CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1CC)C(=O)OC	ZINC000450612526	BD	On-Demand	Anodyne	NOD1	49	31
CCCC[C@H](NC(=O)[C@@H]1C[C@H]1CC)C(=O)OC	ZINC000450612527	BD	On-Demand	Anodyne	NOD1	49	31
C[C@H](NC(=O)C1CCCCC1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612528	CB	On-Demand	Anodyne	BIRC8	42	34
C[C@@H](NC(=O)C1CCCCC1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612529	CB	On-Demand	Anodyne	BIRC8	42	34
C[C@@H](NC(=O)C1CCCCC1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612530	CB	On-Demand	Anodyne	BIRC8	42	34
C[C@H](NC(=O)C1CCCCC1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612531	CB	On-Demand	Anodyne	BIRC8	42	34
Cc1cccc(C)c1[C@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450612541	FI	On-Demand	Bother	CACNA1C	49	35
Cc1cccc(C)c1[C@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450612541	FI	On-Demand	Bother	CACNA1D	79	35
Cc1cccc(C)c1[C@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450612541	FI	On-Demand	Bother	DDX3X	0	40
Cc1cccc(C)c1[C@@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450612542	FI	On-Demand	Bother	CACNA1C	49	35
Cc1cccc(C)c1[C@@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450612542	FI	On-Demand	Bother	CACNA1D	79	35
Cc1cccc(C)c1[C@@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450612542	FI	On-Demand	Bother	DDX3X	0	40
CC(=O)[C@](C)(O)CN(C)Cc1cccnc1	ZINC000450612543	BC	On-Demand	Anodyne	NR1D1	44	36
CC(=O)[C@@](C)(O)CN(C)Cc1cccnc1	ZINC000450612544	BC	On-Demand	Anodyne	NR1D1	44	36
COc1ccc(NC(=O)CC2CC(F)(F)C2)cc1OC(C)C	ZINC000450612561	DH	On-Demand	Anodyne	ENPP1	81	38
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	CHRM2	19	44
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	HTR1A	16	48
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	DRD2	38	48
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	DRD4	72	42
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	ACHE	48	44
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	HRH1	45	54
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	DRD3	25	42
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	OPRK1	15	54
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	HTR4	15	41
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	CHRM3	31	41
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	PRSS2	47	33
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	HRH3	18	43
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	SIGMAR1	57	44
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	SSTR5	70	43
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	CCR3	89	54
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	UTS2R	27	47
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	SCN5A	48	33
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	MCHR1	40	41
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	CCR8	36	44
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	SCD1	44	52
CC(=O)c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1	ZINC000450612562	EJ	On-Demand	Anodyne	SCD	23	45
COc1ccc(NC(=O)C[C@H]2COc3ccccc3O2)cc1OC(C)C	ZINC000450612601	FH	On-Demand	Anodyne	ADRA1D	23	42
COc1ccc(NC(=O)C[C@H]2COc3ccccc3O2)cc1OC(C)C	ZINC000450612601	FH	On-Demand	Anodyne	ADRA1A	20	42
COc1ccc(NC(=O)C[C@H]2COc3ccccc3O2)cc1OC(C)C	ZINC000450612601	FH	On-Demand	Anodyne	ADRA1B	18	42
COc1ccc(NC(=O)C[C@H]2COc3ccccc3O2)cc1OC(C)C	ZINC000450612601	FH	On-Demand	Anodyne	ENPP1	61	35
COc1ccc(NC(=O)C[C@@H]2COc3ccccc3O2)cc1OC(C)C	ZINC000450612602	FH	On-Demand	Anodyne	ADRA1D	23	42
COc1ccc(NC(=O)C[C@@H]2COc3ccccc3O2)cc1OC(C)C	ZINC000450612602	FH	On-Demand	Anodyne	ADRA1A	20	42
COc1ccc(NC(=O)C[C@@H]2COc3ccccc3O2)cc1OC(C)C	ZINC000450612602	FH	On-Demand	Anodyne	ADRA1B	18	42
COc1ccc(NC(=O)C[C@@H]2COc3ccccc3O2)cc1OC(C)C	ZINC000450612602	FH	On-Demand	Anodyne	ENPP1	61	35
O=C(Cc1ccc(O)c(F)c1)NCCC[C@H]1CCCCO1	ZINC000450612615	CF	On-Demand	Anodyne	NCE103	26	43
O=C(Cc1ccc(O)c(F)c1)NCCC[C@H]1CCCCO1	ZINC000450612615	CF	On-Demand	Anodyne	CAN2	0	43
O=C(Cc1ccc(O)c(F)c1)NCCC[C@@H]1CCCCO1	ZINC000450612616	CF	On-Demand	Anodyne	NCE103	26	43
O=C(Cc1ccc(O)c(F)c1)NCCC[C@@H]1CCCCO1	ZINC000450612616	CF	On-Demand	Anodyne	CAN2	0	43
COc1cc(CC(=O)N[C@H]2CN(C)NC2=O)ccc1Cl	ZINC000450612653	CC	On-Demand	Anodyne	HTR4	41	33
COc1cc(CC(=O)N[C@@H]2CN(C)NC2=O)ccc1Cl	ZINC000450612654	CC	On-Demand	Anodyne	HTR4	41	33
COc1cc(CN2CCN([C@@H]3CS(=O)(=O)C[C@@H]3O)CC2)ccc1Cl	ZINC000450612656	FC	On-Demand	Anodyne	SSTR5	40	35
COc1cc(CN2CCN([C@H]3CS(=O)(=O)C[C@@H]3O)CC2)ccc1Cl	ZINC000450612657	FC	On-Demand	Anodyne	SSTR5	40	35
COc1cc(CN2CCN([C@@H]3CS(=O)(=O)C[C@H]3O)CC2)ccc1Cl	ZINC000450612658	FC	On-Demand	Anodyne	SSTR5	40	35
COc1cc(CN2CCN([C@H]3CS(=O)(=O)C[C@H]3O)CC2)ccc1Cl	ZINC000450612659	FC	On-Demand	Anodyne	SSTR5	40	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(C(=O)C3CC3)CC2)cc1	ZINC000450612663	EF	On-Demand	Anodyne	TIMP3	61	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(C(=O)C3CC3)CC2)cc1	ZINC000450612664	EF	On-Demand	Anodyne	TIMP3	61	35
CC(C)(CNc1ccc([N+](=O)[O-])cc1F)c1ccccn1	ZINC000450612685	CH	On-Demand	Bother	F2RL3	45	33
CCCC[C@@H](NC(=O)[C@H]1CC1(F)F)C(=O)OC	ZINC000450612711	BD	On-Demand	Anodyne	NOD1	49	31
CCCC[C@@H](NC(=O)[C@@H]1CC1(F)F)C(=O)OC	ZINC000450612724	BD	On-Demand	Anodyne	NOD1	49	31
CCCC[C@H](NC(=O)[C@H]1CC1(F)F)C(=O)OC	ZINC000450612726	BD	On-Demand	Anodyne	NOD1	49	31
CCCC[C@H](NC(=O)[C@@H]1CC1(F)F)C(=O)OC	ZINC000450612727	BD	On-Demand	Anodyne	NOD1	49	31
CN1C[C@H](NC(=O)c2ccc(OCC(F)(F)F)cc2)C(=O)N1	ZINC000450612753	DC	On-Demand	Anodyne	SLC6A5	33	41
CN1C[C@@H](NC(=O)c2ccc(OCC(F)(F)F)cc2)C(=O)N1	ZINC000450612755	DC	On-Demand	Anodyne	SLC6A5	33	41
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612780	EG	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612780	EG	On-Demand	Anodyne	DRD4	32	41
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612780	EG	On-Demand	Anodyne	ACHE	30	44
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612780	EG	On-Demand	Anodyne	SIGMAR1	45	43
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612780	EG	On-Demand	Anodyne	CCR5	42	41
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450612780	EG	On-Demand	Anodyne	CACNA1G	26	40
COc1cc(OC)c2ncnc(N[C@@H]3CCCN(CCCO)C3)c2c1	ZINC000450612783	ED	On-Demand	Anodyne	EHMT2	73	35
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612784	EG	On-Demand	Anodyne	DRD2	0	43
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612784	EG	On-Demand	Anodyne	DRD4	32	41
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612784	EG	On-Demand	Anodyne	ACHE	30	44
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612784	EG	On-Demand	Anodyne	SIGMAR1	45	43
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612784	EG	On-Demand	Anodyne	CCR5	42	41
CCN(C(=O)[C@@H]1C[C@H]1C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450612784	EG	On-Demand	Anodyne	CACNA1G	26	40
COC(=O)[C@](C)(O)CNC(=O)C1CCN(c2noc3ccc(Cl)cc23)CC1	ZINC000450612787	GD	On-Demand	Anodyne	PTGES	31	42
COc1cc(OC)c2ncnc(N[C@H]3CCCN(CCCO)C3)c2c1	ZINC000450612794	ED	On-Demand	Anodyne	EHMT2	73	35
COC(=O)[C@@](C)(O)CNC(=O)C1CCN(c2noc3ccc(Cl)cc23)CC1	ZINC000450612800	GD	On-Demand	Anodyne	PTGES	31	42
CN1C[C@@H](NC(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)C(=O)N1	ZINC000450612802	GD	On-Demand	Anodyne	PARC	0	44
CN1C[C@@H](NC(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)C(=O)N1	ZINC000450612802	GD	On-Demand	Anodyne	G	0	44
CN1C[C@H](NC(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)C(=O)N1	ZINC000450612804	GD	On-Demand	Anodyne	PARC	0	44
CN1C[C@H](NC(=O)c2cn(C3CC3)c3cc(Cl)c(F)cc3c2=O)C(=O)N1	ZINC000450612804	GD	On-Demand	Anodyne	G	0	44
Cc1ccc(-c2nnc(SCCC(C)(F)F)n2C)cc1	ZINC000450612811	CH	On-Demand	Anodyne	DRD3	24	43
Cc1ccc(-c2nnc(SCCC(C)(F)F)n2C)cc1	ZINC000450612811	CH	On-Demand	Anodyne	KCNH2	20	43
CCC[C@H](O)CN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450612813	CF	On-Demand	Anodyne	MC4R	45	40
CCC[C@@H](O)CN1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC000450612814	CF	On-Demand	Anodyne	MC4R	45	40
CCC[C@@H](O)CN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450612816	CF	On-Demand	Anodyne	MC4R	45	40
CN1C[C@H](NC(=O)CCc2ccc3ccccc3c2)C(=O)N1	ZINC000450612817	CD	On-Demand	Anodyne	CXCR4	40	38
CN1C[C@H](NC(=O)CCc2ccc3ccccc3c2)C(=O)N1	ZINC000450612817	CD	On-Demand	Anodyne	LUXR	53	46
CCC[C@H](O)CN1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC000450612819	CF	On-Demand	Anodyne	MC4R	45	40
CN1C[C@@H](NC(=O)CCc2ccc3ccccc3c2)C(=O)N1	ZINC000450612828	CD	On-Demand	Anodyne	CXCR4	40	38
CN1C[C@@H](NC(=O)CCc2ccc3ccccc3c2)C(=O)N1	ZINC000450612828	CD	On-Demand	Anodyne	LUXR	53	46
CC(C)Cn1cc(C(=O)N[C@H]2CN(C)NC2=O)c2ccccc21	ZINC000450612833	DD	On-Demand	Anodyne	CNR1	32	41
CCC[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)C(C)C	ZINC000450612836	BC	On-Demand	Anodyne	MMP1	0	40
CCC[C@H](C(=O)N[C@H]1CN(C)NC1=O)C(C)C	ZINC000450612837	BC	On-Demand	Anodyne	MMP1	0	40
CC(C)Cn1cc(C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc21	ZINC000450612838	DD	On-Demand	Anodyne	CNR1	32	41
CCC[C@H](C(=O)N[C@@H]1CN(C)NC1=O)C(C)C	ZINC000450612839	BC	On-Demand	Anodyne	MMP1	0	40
CCC[C@@H](C(=O)N[C@H]1CN(C)NC1=O)C(C)C	ZINC000450612840	BC	On-Demand	Anodyne	MMP1	0	40
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	CHRM2	17	41
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	HTR1A	22	44
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	CHRM1	15	41
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	DRD2	35	44
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	ACHE	67	53
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	HRH2	44	39
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	HTR2A	18	47
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	SLC6A1	49	32
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	HRH1	20	45
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	DRD3	20	41
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	HTR4	52	34
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	CHRM3	28	42
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	HRH3	44	46
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	SIGMAR1	81	42
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	NPY1R	44	39
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	CCR3	79	47
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	CCR5	18	42
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	BDKRB1	37	40
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	ST14	55	34
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	MCHR1	56	42
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	CACNA1G	41	38
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	CACNA1I	46	40
CC(=O)c1cccc(CN2CCC(CCCN3CCCC3)CC2)c1	ZINC000450612857	EH	On-Demand	Anodyne	CYP2J2	49	34
CCC[C@@H](O)CN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450612865	CF	On-Demand	Anodyne	SCD1	29	40
CCC[C@@H](O)CN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450612866	CF	On-Demand	Anodyne	SCD1	29	40
CCC[C@H](O)CN1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000450612867	CF	On-Demand	Anodyne	SCD1	29	40
CCC[C@H](O)CN1CC[C@H](Oc2ccccc2Cl)C1	ZINC000450612868	CF	On-Demand	Anodyne	SCD1	29	40
CN1C[C@@H](NC(=O)C(=O)NCCCc2ccccc2)C(=O)N1	ZINC000450612870	DB	On-Demand	Anodyne	FKBP1A	20	40
CN1C[C@@H](NC(=O)C(=O)NCCCc2ccccc2)C(=O)N1	ZINC000450612870	DB	On-Demand	Anodyne	SSTR4	41	36
CN1C[C@@H](NC(=O)C(=O)NCCCc2ccccc2)C(=O)N1	ZINC000450612870	DB	On-Demand	Anodyne	AMP1_PLAFQ	25	44
CN1C[C@H](NC(=O)C(=O)NCCCc2ccccc2)C(=O)N1	ZINC000450612872	DB	On-Demand	Anodyne	FKBP1A	20	40
CN1C[C@H](NC(=O)C(=O)NCCCc2ccccc2)C(=O)N1	ZINC000450612872	DB	On-Demand	Anodyne	SSTR4	41	36
CN1C[C@H](NC(=O)C(=O)NCCCc2ccccc2)C(=O)N1	ZINC000450612872	DB	On-Demand	Anodyne	AMP1_PLAFQ	25	44
O=C(CCCN1C[C@H](O)C[C@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612876	EH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1C[C@H](O)C[C@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612876	EH	On-Demand	Anodyne	HTR2A	16	42
O=C(CCCN1C[C@H](O)C[C@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612876	EH	On-Demand	Anodyne	CYP2J2	46	33
COc1ccc(-c2nnn(CC3CC(F)(F)C3)n2)cc1OC	ZINC000450612884	DE	On-Demand	Anodyne	SCARB1	38	44
CN1C[C@H](NC(=O)COc2ccc(F)c(Cl)c2)C(=O)N1	ZINC000450612885	DC	On-Demand	Anodyne	TRPV4	41	32
CN1C[C@H](NC(=O)COc2ccc(F)c(Cl)c2)C(=O)N1	ZINC000450612885	DC	On-Demand	Anodyne	TRAR	32	45
O=C(CCCN1C[C@@H](O)C[C@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612886	EH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1C[C@@H](O)C[C@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612886	EH	On-Demand	Anodyne	HTR2A	16	42
O=C(CCCN1C[C@@H](O)C[C@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612886	EH	On-Demand	Anodyne	CYP2J2	46	33
CN1C[C@@H](NC(=O)COc2ccc(F)c(Cl)c2)C(=O)N1	ZINC000450612887	DC	On-Demand	Anodyne	TRPV4	41	32
CN1C[C@@H](NC(=O)COc2ccc(F)c(Cl)c2)C(=O)N1	ZINC000450612887	DC	On-Demand	Anodyne	TRAR	32	45
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612888	EH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612888	EH	On-Demand	Anodyne	HTR2A	16	42
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612888	EH	On-Demand	Anodyne	CYP2J2	46	33
O=C(CCCN1C[C@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612891	EH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1C[C@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612891	EH	On-Demand	Anodyne	HTR2A	16	42
O=C(CCCN1C[C@H](O)C[C@@H]1c1cc(F)ccc1F)c1ccccc1	ZINC000450612891	EH	On-Demand	Anodyne	CYP2J2	46	33
C[C@H](OCCc1ccccc1)C(=O)NCCc1ccn(C)n1	ZINC000450612894	DD	On-Demand	Anodyne	AMP1_PLAFQ	31	42
C[C@@H](OCCc1ccccc1)C(=O)NCCc1ccn(C)n1	ZINC000450612895	DD	On-Demand	Anodyne	AMP1_PLAFQ	31	42
CN1C[C@H](NC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450612908	FB	On-Demand	Anodyne	HTR1A	17	41
CN1C[C@H](NC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450612908	FB	On-Demand	Anodyne	ADAM10	39	41
CN1C[C@@H](NC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450612909	FB	On-Demand	Anodyne	HTR1A	17	41
CN1C[C@@H](NC(=O)CCC(=O)N2CCN(c3ccccc3)CC2)C(=O)N1	ZINC000450612909	FB	On-Demand	Anodyne	ADAM10	39	41
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612927	GG	On-Demand	Anodyne	CA2	42	40
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612927	GG	On-Demand	Anodyne	CA1	37	41
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612927	GG	On-Demand	Anodyne	CA7	24	41
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612927	GG	On-Demand	Anodyne	CA5B	34	41
CO[C@@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612927	GG	On-Demand	Anodyne	CA5A	39	41
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612928	GG	On-Demand	Anodyne	CA2	42	40
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612928	GG	On-Demand	Anodyne	CA1	37	41
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612928	GG	On-Demand	Anodyne	CA7	24	41
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612928	GG	On-Demand	Anodyne	CA5B	34	41
CO[C@H](CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)Cc1ccccc1	ZINC000450612928	GG	On-Demand	Anodyne	CA5A	39	41
CN(C)C(=O)c1ccc(NCCOc2ccc(F)c(Cl)c2)nc1	ZINC000450612938	EE	On-Demand	Anodyne	F10	17	41
Cn1cc(-c2ccc(C(=O)NCCC[C@@H]3CCCCO3)o2)cn1	ZINC000450612952	DF	On-Demand	Anodyne	MMP13	0	43
Cn1cc(-c2ccc(C(=O)NCCC[C@H]3CCCCO3)o2)cn1	ZINC000450612953	DF	On-Demand	Anodyne	MMP13	0	43
COc1ccc(OC)c(CC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450612954	CB	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc(OC)c(CC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450612955	CB	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc(OCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612960	CB	On-Demand	Anodyne	ADORA2B	51	33
COc1ccc(OCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612960	CB	On-Demand	Anodyne	MMP1	28	40
COc1ccc(OCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450612960	CB	On-Demand	Anodyne	TRAR	35	43
COc1ccc(OCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612961	CB	On-Demand	Anodyne	ADORA2B	51	33
COc1ccc(OCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612961	CB	On-Demand	Anodyne	MMP1	28	40
COc1ccc(OCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450612961	CB	On-Demand	Anodyne	TRAR	35	43
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612968	GB	On-Demand	Anodyne	CASP3	26	42
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612968	GB	On-Demand	Anodyne	TACR2	22	41
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612968	GB	On-Demand	Anodyne	CAPN2	55	42
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612968	GB	On-Demand	Anodyne	HDAC11	42	35
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612969	GB	On-Demand	Anodyne	CASP3	26	42
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612969	GB	On-Demand	Anodyne	TACR2	22	41
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612969	GB	On-Demand	Anodyne	CAPN2	55	42
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450612969	GB	On-Demand	Anodyne	HDAC11	42	35
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612970	GB	On-Demand	Anodyne	CASP3	26	42
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612970	GB	On-Demand	Anodyne	TACR2	22	41
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612970	GB	On-Demand	Anodyne	CAPN2	55	42
CSCC[C@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612970	GB	On-Demand	Anodyne	HDAC11	42	35
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612971	GB	On-Demand	Anodyne	CASP3	26	42
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612971	GB	On-Demand	Anodyne	TACR2	22	41
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612971	GB	On-Demand	Anodyne	CAPN2	55	42
CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450612971	GB	On-Demand	Anodyne	HDAC11	42	35
COc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cc1OC(C)C	ZINC000450612994	GJ	On-Demand	Bother	MTTP	44	38
COc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cc1OC(C)C	ZINC000450612994	GJ	On-Demand	Bother	ENPP1	48	29
COc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cc1OC(C)C	ZINC000450612994	GJ	On-Demand	Bother	PPXII	0	42
COc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cc1OC(C)C	ZINC000450612994	GJ	On-Demand	Bother	KCNK3	52	41
COc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cc1OC(C)C	ZINC000450612994	GJ	On-Demand	Bother	KCNK9	44	41
COc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cc1OC(C)C	ZINC000450612994	GJ	On-Demand	Bother	AADAC	0	45
CN1C[C@@H](NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C(=O)N1	ZINC000450613003	EB	On-Demand	Anodyne	DCK	41	35
CN1C[C@@H](NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C(=O)N1	ZINC000450613003	EB	On-Demand	Anodyne	SFRP1	61	33
CN1C[C@H](NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C(=O)N1	ZINC000450613004	EB	On-Demand	Anodyne	DCK	41	35
CN1C[C@H](NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C(=O)N1	ZINC000450613004	EB	On-Demand	Anodyne	SFRP1	61	33
CN(C[C@H]1CCCO1)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450613009	EH	On-Demand	Anodyne	OXTR	24	42
CN(C[C@H]1CCCO1)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450613009	EH	On-Demand	Anodyne	PRCP	40	32
CN(C[C@H]1CCCO1)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450613010	EH	On-Demand	Anodyne	OXTR	24	42
CN(C[C@H]1CCCO1)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450613010	EH	On-Demand	Anodyne	PRCP	40	32
CN(C[C@H]1CCCO1)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450613011	EH	On-Demand	Anodyne	OXTR	24	42
CN(C[C@H]1CCCO1)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450613011	EH	On-Demand	Anodyne	PRCP	40	32
CN(C[C@H]1CCCO1)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450613012	EH	On-Demand	Anodyne	OXTR	24	42
CN(C[C@H]1CCCO1)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450613012	EH	On-Demand	Anodyne	PRCP	40	32
COc1ccc(NC(=O)C[C@@H](CNC(C)=O)CC(C)C)cc1OC(C)C	ZINC000450613015	FH	On-Demand	Anodyne	ENPP1	66	39
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H](C)CO	ZINC000450613021	BD	On-Demand	Anodyne	AOC3	24	42
C[C@@H](CO)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450613022	BD	On-Demand	Anodyne	AOC3	24	42
C[C@@H](CO)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450613023	BD	On-Demand	Anodyne	AOC3	24	42
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H](C)CO	ZINC000450613024	BD	On-Demand	Anodyne	AOC3	24	42
CN1C[C@H](NC(=O)[C@H]2C[C@H]2c2ccc(F)c(F)c2)C(=O)N1	ZINC000450613040	CC	On-Demand	Anodyne	SLC6A1	0	43
CN1C[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(F)c(F)c2)C(=O)N1	ZINC000450613041	CC	On-Demand	Anodyne	SLC6A1	0	43
CN1C[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(F)c(F)c2)C(=O)N1	ZINC000450613042	CC	On-Demand	Anodyne	SLC6A1	0	43
CN1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)C(=O)N1	ZINC000450613043	CC	On-Demand	Anodyne	SLC6A1	0	43
CN1C[C@@H](NC(=O)CCCCOc2ccc(Br)cc2)C(=O)N1	ZINC000450613046	FD	On-Demand	Anodyne	TRAR	50	42
CN1C[C@@H](NC(=O)CCCCOc2ccc(Br)cc2)C(=O)N1	ZINC000450613046	FD	On-Demand	Anodyne	CVIR	0	43
CN1C[C@H](NC(=O)CCCCOc2ccc(Br)cc2)C(=O)N1	ZINC000450613047	FD	On-Demand	Anodyne	TRAR	50	42
CN1C[C@H](NC(=O)CCCCOc2ccc(Br)cc2)C(=O)N1	ZINC000450613047	FD	On-Demand	Anodyne	CVIR	0	43
CC(=O)c1cccc(CSc2nc3ccccc3c(=O)n2CCCO)c1	ZINC000450613050	FG	On-Demand	Anodyne	PTGDR2	18	62
CC(=O)c1cccc(CSc2nc3ccccc3c(=O)n2CCCO)c1	ZINC000450613050	FG	On-Demand	Anodyne	SLC16A1	46	34
CNC(=O)CCCN(C)CC/C=C/c1ccccc1	ZINC000450613060	CF	On-Demand	Anodyne	HDAC8	21	40
CNC(=O)CCCN(C)CC/C=C\c1ccccc1	ZINC000450613061	CF	On-Demand	Anodyne	HDAC8	21	40
CN1C[C@H](NC(=O)CNS(=O)(=O)c2ccc(Cl)s2)C(=O)N1	ZINC000450613075	FB	On-Demand	Anodyne	CCR4	45	33
CN1C[C@@H](NC(=O)CNS(=O)(=O)c2ccc(Cl)s2)C(=O)N1	ZINC000450613076	FB	On-Demand	Anodyne	CCR4	45	33
CC(C)CC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613077	EC	On-Demand	Anodyne	XIAP	47	37
CC(C)CC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613077	EC	On-Demand	Anodyne	Q82323_9DELA	70	35
CC(C)CC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613077	EC	On-Demand	Anodyne	BIRC8	46	36
CC(C)CC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613078	EC	On-Demand	Anodyne	XIAP	47	37
CC(C)CC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613078	EC	On-Demand	Anodyne	Q82323_9DELA	70	35
CC(C)CC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613078	EC	On-Demand	Anodyne	BIRC8	46	36
CC(C)CC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613079	EC	On-Demand	Anodyne	XIAP	47	37
CC(C)CC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613079	EC	On-Demand	Anodyne	Q82323_9DELA	70	35
CC(C)CC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613079	EC	On-Demand	Anodyne	BIRC8	46	36
CC(C)CC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613081	EC	On-Demand	Anodyne	XIAP	47	37
CC(C)CC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613081	EC	On-Demand	Anodyne	Q82323_9DELA	70	35
CC(C)CC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450613081	EC	On-Demand	Anodyne	BIRC8	46	36
CN1C[C@@H](NC(=O)CCCCc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450613087	EE	On-Demand	Anodyne	DNAE	40	32
CN1C[C@@H](NC(=O)CCCCc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450613087	EE	On-Demand	Anodyne	LUXR	57	37
CN1C[C@H](NC(=O)CCCCc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450613088	EE	On-Demand	Anodyne	DNAE	40	32
CN1C[C@H](NC(=O)CCCCc2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450613088	EE	On-Demand	Anodyne	LUXR	57	37
CO[C@H](CNc1cnc(C(=O)OC(C)(C)C)cn1)Cc1ccccc1	ZINC000450613095	EG	On-Demand	Anodyne	PAPA1_CARPA	43	39
CO[C@H](CNc1cnc(C(=O)OC(C)(C)C)cn1)Cc1ccccc1	ZINC000450613095	EG	On-Demand	Anodyne	POL	0	41
CO[C@@H](CNc1cnc(C(=O)OC(C)(C)C)cn1)Cc1ccccc1	ZINC000450613096	EG	On-Demand	Anodyne	PAPA1_CARPA	43	39
CO[C@@H](CNc1cnc(C(=O)OC(C)(C)C)cn1)Cc1ccccc1	ZINC000450613096	EG	On-Demand	Anodyne	POL	0	41
COc1cc(NCc2nc(C)c(Br)s2)ccc1[N+](=O)[O-]	ZINC000450613103	FH	On-Demand	Bother	DRTS_TRYCR	54	33
CN1C[C@H](NC(=O)Cc2cc(F)ccc2Br)C(=O)N1	ZINC000450613104	EC	On-Demand	Anodyne	P2RX7	24	40
CN1C[C@@H](NC(=O)Cc2cc(F)ccc2Br)C(=O)N1	ZINC000450613106	EC	On-Demand	Anodyne	P2RX7	24	40
Cc1cccc(C)c1[C@H](C)NC(=O)C1CC(C)(O)C1	ZINC000450613112	CF	On-Demand	Anodyne	SDH1	0	45
Cc1cccc(C)c1[C@@H](C)NC(=O)C1CC(C)(O)C1	ZINC000450613113	CF	On-Demand	Anodyne	SDH1	0	45
CCCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC	ZINC000450613114	CD	On-Demand	Anodyne	CAN2	0	42
CCCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC	ZINC000450613115	CD	On-Demand	Anodyne	CAN2	0	42
CCOC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)nc1	ZINC000450613128	FG	On-Demand	Anodyne	ACHE	20	43
CCOC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)nc1	ZINC000450613128	FG	On-Demand	Anodyne	HTR4	39	43
CCOC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)nc1	ZINC000450613128	FG	On-Demand	Anodyne	HRH3	24	45
CCOC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)nc1	ZINC000450613128	FG	On-Demand	Anodyne	SSTR5	44	36
CCOC(=O)c1ccc(CN2CCC(CCCN3CCCC3)CC2)nc1	ZINC000450613128	FG	On-Demand	Anodyne	NPY1R	42	36
CCN1CCN(c2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)CC1	ZINC000450613134	EB	On-Demand	Anodyne	PRNP	45	48
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN(c2ccccc2)C1=O	ZINC000450613138	EC	On-Demand	Anodyne	AMY2	42	29
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN(c2ccccc2)C1=O	ZINC000450613139	EC	On-Demand	Anodyne	AMY2	42	29
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000450613140	EC	On-Demand	Anodyne	AMY2	42	29
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000450613141	EC	On-Demand	Anodyne	AMY2	42	29
CCN1CCN(c2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)CC1	ZINC000450613143	EB	On-Demand	Anodyne	PRNP	45	48
CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1CC(C)C)C(=O)OC	ZINC000450613145	CF	On-Demand	Anodyne	NOD1	53	34
CCCC[C@H](NC(=O)[C@@H]1C[C@H]1CC(C)C)C(=O)OC	ZINC000450613146	CF	On-Demand	Anodyne	NOD1	53	34
C[C@H](CN1CCC[C@@H](Oc2ccccc2Cl)C1)S(C)(=O)=O	ZINC000450613158	EF	On-Demand	Anodyne	SLC6A1	41	34
C[C@H](CN1CCC[C@H](Oc2ccccc2Cl)C1)S(C)(=O)=O	ZINC000450613159	EF	On-Demand	Anodyne	SLC6A1	41	34
C[C@@H](CN1CCC[C@@H](Oc2ccccc2Cl)C1)S(C)(=O)=O	ZINC000450613160	EF	On-Demand	Anodyne	SLC6A1	41	34
C[C@@H](CN1CCC[C@H](Oc2ccccc2Cl)C1)S(C)(=O)=O	ZINC000450613161	EF	On-Demand	Anodyne	SLC6A1	41	34
CN1C[C@H](NC(=O)CCCCCNC(=O)NC2CCCCC2)C(=O)N1	ZINC000450613169	FC	On-Demand	Anodyne	EPHX2	20	53
CN1C[C@@H](NC(=O)CCCCCNC(=O)NC2CCCCC2)C(=O)N1	ZINC000450613172	FC	On-Demand	Anodyne	EPHX2	20	53
COc1ccc(-c2noc(CN3CCCC[C@@H]3CCCc3ccccc3)n2)nn1	ZINC000450613180	GH	On-Demand	Anodyne	SLC18A2	35	42
COc1ccc(-c2noc(CN3CCCC[C@H]3CCCc3ccccc3)n2)nn1	ZINC000450613183	GH	On-Demand	Anodyne	SLC18A2	35	42
CCCC[C@@H](NC(=O)[C@H](CC)CC(F)(F)F)C(=O)OC	ZINC000450613184	CF	On-Demand	Anodyne	NOD1	63	33
CCCC[C@@H](NC(=O)[C@H](CC)CC(F)(F)F)C(=O)OC	ZINC000450613184	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	41
CCCC[C@H](NC(=O)[C@@H](CC)CC(F)(F)F)C(=O)OC	ZINC000450613185	CF	On-Demand	Anodyne	NOD1	63	33
CCCC[C@H](NC(=O)[C@@H](CC)CC(F)(F)F)C(=O)OC	ZINC000450613185	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	41
COc1ccc(C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450613186	CC	On-Demand	Anodyne	MMP1	46	42
COc1ccc(C[C@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450613186	CC	On-Demand	Anodyne	PSMB8	45	32
CCCC[C@@H](NC(=O)[C@@H](CC)CC(F)(F)F)C(=O)OC	ZINC000450613187	CF	On-Demand	Anodyne	NOD1	63	33
CCCC[C@@H](NC(=O)[C@@H](CC)CC(F)(F)F)C(=O)OC	ZINC000450613187	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	41
CCCC[C@H](NC(=O)[C@H](CC)CC(F)(F)F)C(=O)OC	ZINC000450613188	CF	On-Demand	Anodyne	NOD1	63	33
CCCC[C@H](NC(=O)[C@H](CC)CC(F)(F)F)C(=O)OC	ZINC000450613188	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	41
COc1ccc(-c2nnn(CC3(OC)CCC3)n2)cc1OC	ZINC000450613189	DD	On-Demand	Anodyne	SCARB1	25	42
COc1ccc(C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450613193	CC	On-Demand	Anodyne	MMP1	46	42
COc1ccc(C[C@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450613193	CC	On-Demand	Anodyne	PSMB8	45	32
COc1ccc(C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450613194	CC	On-Demand	Anodyne	MMP1	46	42
COc1ccc(C[C@@H](C)C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450613194	CC	On-Demand	Anodyne	PSMB8	45	32
COc1ccc(C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450613195	CC	On-Demand	Anodyne	MMP1	46	42
COc1ccc(C[C@@H](C)C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450613195	CC	On-Demand	Anodyne	PSMB8	45	32
COc1cc2c(cc1OC)CN(CC(=O)N[C@@H]1CN(C)NC1=O)CC2	ZINC000450613207	EB	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)CN(CC(=O)N[C@@H]1CN(C)NC1=O)CC2	ZINC000450613207	EB	On-Demand	Anodyne	ABCB1B	66	40
COc1cc2c(cc1OC)CN(CC(=O)N[C@@H]1CN(C)NC1=O)CC2	ZINC000450613207	EB	On-Demand	Anodyne	ABCB1	23	44
COc1cc2c(cc1OC)CN(CC(=O)N[C@H]1CN(C)NC1=O)CC2	ZINC000450613208	EB	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)CN(CC(=O)N[C@H]1CN(C)NC1=O)CC2	ZINC000450613208	EB	On-Demand	Anodyne	ABCB1B	66	40
COc1cc2c(cc1OC)CN(CC(=O)N[C@H]1CN(C)NC1=O)CC2	ZINC000450613208	EB	On-Demand	Anodyne	ABCB1	23	44
COC(=O)[C@@](C)(O)CNC(=O)CSCc1ccc(Br)cc1	ZINC000450613209	GD	On-Demand	Anodyne	LTA4H	24	40
COC(=O)[C@](C)(O)CNC(=O)CSCc1ccc(Br)cc1	ZINC000450613210	GD	On-Demand	Anodyne	LTA4H	24	40
C[C@@H](COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450613215	CC	On-Demand	Anodyne	CAPN2	40	39
C[C@@H](COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450613216	CC	On-Demand	Anodyne	CAPN2	40	39
C[C@H](COc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450613217	CC	On-Demand	Anodyne	CAPN2	40	39
C[C@H](COc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450613218	CC	On-Demand	Anodyne	CAPN2	40	39
C=CCn1c(SCc2cn(C)nc2C)nc2ccccc21	ZINC000450613219	CH	On-Demand	Mild	PTGDR2	17	46
CN1C[C@@H](NC(=O)C2(Cc3ccccc3)CCC2)C(=O)N1	ZINC000450613220	CC	On-Demand	Anodyne	SLC12A5	43	33
CN1C[C@H](NC(=O)C2(Cc3ccccc3)CCC2)C(=O)N1	ZINC000450613221	CC	On-Demand	Anodyne	SLC12A5	43	33
Cn1c(C(=O)Nc2ccccc2C(=O)OC(C)(C)C)c2n(c1=O)CCCC2	ZINC000450613238	FF	On-Demand	Anodyne	BRD1	0	40
Cn1c(C(=O)Nc2ccccc2C(=O)OC(C)(C)C)c2n(c1=O)CCCC2	ZINC000450613238	FF	On-Demand	Anodyne	BRPF1	0	40
CC(=O)[C@](C)(O)CN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450613256	FF	On-Demand	Anodyne	TACR1	33	40
CC(=O)[C@](C)(O)CN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450613256	FF	On-Demand	Anodyne	CACNA1B	54	38
CC(=O)[C@](C)(O)CN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450613256	FF	On-Demand	Anodyne	CCR2	48	36
CC(=O)[C@](C)(O)CN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450613256	FF	On-Demand	Anodyne	LIPG	42	32
CC(=O)[C@@](C)(O)CN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450613257	FF	On-Demand	Anodyne	TACR1	33	40
CC(=O)[C@@](C)(O)CN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450613257	FF	On-Demand	Anodyne	CACNA1B	54	38
CC(=O)[C@@](C)(O)CN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450613257	FF	On-Demand	Anodyne	CCR2	48	36
CC(=O)[C@@](C)(O)CN1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450613257	FF	On-Demand	Anodyne	LIPG	42	32
COc1cc2c(NC[C@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613278	ED	On-Demand	Anodyne	EGFR	36	43
COc1cc2c(NC[C@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613278	ED	On-Demand	Anodyne	FGFR1	22	44
COc1cc2c(NC[C@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613278	ED	On-Demand	Anodyne	AURKB	42	43
COc1cc2c(NC[C@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613278	ED	On-Demand	Anodyne	FLT1	32	44
COc1cc2c(NC[C@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613278	ED	On-Demand	Anodyne	PDE3B	51	31
COc1cc2c(NC[C@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613278	ED	On-Demand	Anodyne	AURKA	42	41
COc1cc2c(NC[C@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613278	ED	On-Demand	Anodyne	EPHA2	43	34
COc1cc2c(NC[C@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613278	ED	On-Demand	Anodyne	EHMT2	61	33
COc1cc2c(NC[C@@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613279	ED	On-Demand	Anodyne	EGFR	36	43
COc1cc2c(NC[C@@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613279	ED	On-Demand	Anodyne	FGFR1	22	44
COc1cc2c(NC[C@@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613279	ED	On-Demand	Anodyne	AURKB	42	43
COc1cc2c(NC[C@@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613279	ED	On-Demand	Anodyne	FLT1	32	44
COc1cc2c(NC[C@@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613279	ED	On-Demand	Anodyne	PDE3B	51	31
COc1cc2c(NC[C@@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613279	ED	On-Demand	Anodyne	AURKA	42	41
COc1cc2c(NC[C@@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613279	ED	On-Demand	Anodyne	EPHA2	43	34
COc1cc2c(NC[C@@H]3CCCCN3CCO)ncnc2cc1F	ZINC000450613279	ED	On-Demand	Anodyne	EHMT2	61	33
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)cc1	ZINC000450613281	FG	On-Demand	Anodyne	PRSS1	29	42
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)cc1	ZINC000450613281	FG	On-Demand	Anodyne	CHRM2	15	42
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)cc1	ZINC000450613281	FG	On-Demand	Anodyne	ADRB1	18	41
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)cc1	ZINC000450613281	FG	On-Demand	Anodyne	CHRM3	22	40
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)cc1	ZINC000450613281	FG	On-Demand	Anodyne	F3	40	35
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)cc1	ZINC000450613281	FG	On-Demand	Anodyne	ACR	64	42
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)cc1	ZINC000450613281	FG	On-Demand	Anodyne	CA9	18	46
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)cc1	ZINC000450613281	FG	On-Demand	Anodyne	PPO2	16	40
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)cc1	ZINC000450613282	FG	On-Demand	Anodyne	PRSS1	29	42
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)cc1	ZINC000450613282	FG	On-Demand	Anodyne	CHRM2	15	42
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)cc1	ZINC000450613282	FG	On-Demand	Anodyne	ADRB1	18	41
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)cc1	ZINC000450613282	FG	On-Demand	Anodyne	CHRM3	22	40
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)cc1	ZINC000450613282	FG	On-Demand	Anodyne	F3	40	35
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)cc1	ZINC000450613282	FG	On-Demand	Anodyne	ACR	64	42
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)cc1	ZINC000450613282	FG	On-Demand	Anodyne	CA9	18	46
COC(=O)c1ccc(CC(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)cc1	ZINC000450613282	FG	On-Demand	Anodyne	PPO2	16	40
CCC[C@H](OC)C(=O)Nc1ccccc1C(=O)OC(C)(C)C	ZINC000450613293	DG	On-Demand	Anodyne	KCNQ2	43	37
CCC[C@@H](OC)C(=O)Nc1ccccc1C(=O)OC(C)(C)C	ZINC000450613294	DG	On-Demand	Anodyne	KCNQ2	43	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)C(C)(C)C2CCC2)cc1	ZINC000450613300	DH	On-Demand	Anodyne	TIMP3	42	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(C)(C)C2CCC2)cc1	ZINC000450613301	DH	On-Demand	Anodyne	TIMP3	48	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C(C)(C)C2CCC2)cc1	ZINC000450613301	DH	On-Demand	Anodyne	AMY2	43	29
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	ADRA1D	58	42
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	HTR2A	27	40
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	ADRA1A	54	42
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	ADRA1B	42	42
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	DRD3	17	43
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	HRP1_PLAFA	17	42
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	HRH3	20	48
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	SIGMAR1	16	44
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	CCR3	32	40
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	HNMT	46	32
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	EPHX2	39	41
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	CACNA1G	53	43
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	GNAI1	0	40
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	GNAI3	0	40
Cc1ccc(F)c(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000450613325	GG	On-Demand	Anodyne	GNAO1	0	40
CCOCCO[C@H]1CCN(Cc2ccc(C(=O)OCC)cn2)C1	ZINC000450613331	DD	On-Demand	Anodyne	LIPG	15	41
COc1ccc(NC(=O)CCc2ccc(C(N)=O)cc2)cc1OC(C)C	ZINC000450613354	FG	On-Demand	Anodyne	ENPP1	66	38
COc1ccc(NC(=O)CCc2ccc(C(N)=O)cc2)cc1OC(C)C	ZINC000450613354	FG	On-Demand	Anodyne	DRTS_TRYCR	46	33
COc1ccc(NC(=O)CCc2ccc(C(N)=O)cc2)cc1OC(C)C	ZINC000450613354	FG	On-Demand	Anodyne	PARP10	0	40
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	DRD4	41	38
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	ACHE	23	40
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	HRH1	26	40
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	HRH3	17	42
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	SIGMAR1	41	42
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	SSTR5	61	42
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	SCN5A	43	32
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	SCD1	33	41
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1	ZINC000450613355	GI	On-Demand	Anodyne	SCD	15	42
Cc1ccc(F)c(CSc2nnc(CN3CCCC3=O)o2)c1	ZINC000450613358	DF	On-Demand	Anodyne	PTK2	23	42
O=C(Nc1ccc(CN2C(=O)CCCC2=O)cc1)c1ccc(C(F)(F)F)[nH]1	ZINC000450613404	GG	On-Demand	Anodyne	NOD2	40	36
CCN(CCC1CC1)C(=O)c1ccc(Oc2ccccc2OC)cn1	ZINC000450613422	EI	On-Demand	Anodyne	ACKR3	63	33
CCCC[C@@H](NC(=O)c1cc(C)c(C(N)=O)cn1)C(=O)OC	ZINC000450613433	DC	On-Demand	Anodyne	P2RY12	55	34
CCCC[C@H](NC(=O)c1cc(C)c(C(N)=O)cn1)C(=O)OC	ZINC000450613434	DC	On-Demand	Anodyne	P2RY12	55	34
CC(C)n1ncc2c(C(=O)N[C@H]3CN(C)NC3=O)cc(-c3ccccc3)nc21	ZINC000450613444	GD	On-Demand	Anodyne	EZH2	20	43
CC(C)n1ncc2c(C(=O)N[C@@H]3CN(C)NC3=O)cc(-c3ccccc3)nc21	ZINC000450613445	GD	On-Demand	Anodyne	EZH2	20	43
Cn1ccc(CCNC(=O)[C@H]2CCN(c3ccccc3)C2)n1	ZINC000450613461	CD	On-Demand	Anodyne	GPBAR1	36	44
Cn1ccc(CCNC(=O)[C@@H]2CCN(c3ccccc3)C2)n1	ZINC000450613468	CD	On-Demand	Anodyne	GPBAR1	36	44
COc1cc(CN2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)ccc1Cl	ZINC000450613489	FH	On-Demand	Anodyne	CCR1	31	41
Clc1ccccc1OC1CCN(C[C@H]2COCCO2)CC1	ZINC000450613490	DF	On-Demand	Anodyne	HRH1	23	44
Clc1ccccc1OC1CCN(C[C@H]2COCCO2)CC1	ZINC000450613490	DF	On-Demand	Anodyne	SCD1	26	42
Clc1ccccc1OC1CCN(C[C@@H]2COCCO2)CC1	ZINC000450613491	DF	On-Demand	Anodyne	HRH1	23	44
Clc1ccccc1OC1CCN(C[C@@H]2COCCO2)CC1	ZINC000450613491	DF	On-Demand	Anodyne	SCD1	26	42
CCc1cc(NCc2cccc(C(F)(F)F)n2)n2ncnc2n1	ZINC000450613492	DF	On-Demand	Anodyne	DHOD	0	60
COc1cc(CN2C[C@H](O)C[C@H]2c2cc(F)ccc2F)ccc1Cl	ZINC000450613498	FH	On-Demand	Anodyne	CCR1	31	41
COc1cc(CN2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)ccc1Cl	ZINC000450613499	FH	On-Demand	Anodyne	CCR1	31	41
COc1cc(CN2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)ccc1Cl	ZINC000450613500	FH	On-Demand	Anodyne	CCR1	31	41
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	MME	74	37
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	FCER2	48	33
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	PAPA1_CARPA	51	42
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	CYSP_TRYCR	41	34
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	CTSL	28	42
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	CTSS	19	42
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	CAPN2	44	31
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	ACE2	41	35
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	FPR1	44	34
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	NPR	43	34
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613508	CC	On-Demand	Anodyne	AMP1_PLAFQ	54	40
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	MME	74	37
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	FCER2	48	33
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	PAPA1_CARPA	51	42
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	CYSP_TRYCR	41	34
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	CTSL	28	42
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	CTSS	19	42
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	CAPN2	44	31
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	ACE2	41	35
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	FPR1	44	34
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	NPR	43	34
COC(=O)[C@](C)(O)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450613509	CC	On-Demand	Anodyne	AMP1_PLAFQ	54	40
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	MME	74	37
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	FCER2	48	33
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	PAPA1_CARPA	51	42
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	CYSP_TRYCR	41	34
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	CTSL	28	42
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	CTSS	19	42
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	CAPN2	44	31
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	ACE2	41	35
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	FPR1	44	34
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	NPR	43	34
COC(=O)[C@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613510	CC	On-Demand	Anodyne	AMP1_PLAFQ	54	40
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	MME	74	37
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	FCER2	48	33
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	PAPA1_CARPA	51	42
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	CYSP_TRYCR	41	34
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	CTSL	28	42
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	CTSS	19	42
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	CAPN2	44	31
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	ACE2	41	35
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	FPR1	44	34
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	NPR	43	34
COC(=O)[C@@](C)(O)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450613511	CC	On-Demand	Anodyne	AMP1_PLAFQ	54	40
COC(=O)[C@@](C)(O)CNC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450613517	EB	On-Demand	Anodyne	DRD4	44	36
COC(=O)[C@@](C)(O)CNC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450613517	EB	On-Demand	Anodyne	ESRRA	20	44
COC(=O)[C@](C)(O)CNC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450613518	EB	On-Demand	Anodyne	DRD4	44	36
COC(=O)[C@](C)(O)CNC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450613518	EB	On-Demand	Anodyne	ESRRA	20	44
C[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450613524	CC	On-Demand	Anodyne	SCN9A	0	44
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccc(Br)cc1	ZINC000450613527	ED	On-Demand	Anodyne	SDH1	0	41
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccc(Br)cc1	ZINC000450613529	ED	On-Demand	Anodyne	SDH1	0	41
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccc(Br)cc1	ZINC000450613531	ED	On-Demand	Anodyne	SDH1	0	41
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccc(Br)cc1	ZINC000450613532	ED	On-Demand	Anodyne	SDH1	0	41
CCC(=O)c1ccc(NCC(C)(C)c2ccccn2)c([N+](=O)[O-])c1	ZINC000450613533	EH	On-Demand	Bother	TAAR1	15	40
C[C@@H](Cc1cccc(F)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450613534	CC	On-Demand	Anodyne	SCN9A	0	44
C[C@@H](Cc1cccc(F)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450613535	CC	On-Demand	Anodyne	SCN9A	0	44
C[C@H](Cc1cccc(F)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450613536	CC	On-Demand	Anodyne	SCN9A	0	44
COC(=O)c1cn([C@@H]2CCN(C(=O)Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450613541	GD	On-Demand	Anodyne	OPRK1	38	41
COC(=O)c1cn([C@H]2CCN(C(=O)Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450613544	GD	On-Demand	Anodyne	OPRK1	38	41
CCCc1cc(C(=O)N(CC)CCC2CC2)no1	ZINC000450613559	CF	On-Demand	Anodyne	S1PR3	0	63
COc1ccc(C(=O)NCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450613561	DA	On-Demand	Anodyne	CCR2	16	41
COc1ccc(C(=O)NCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450613561	DA	On-Demand	Anodyne	MMP1	19	53
COc1ccc(C(=O)NCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450613566	DA	On-Demand	Anodyne	CCR2	16	41
COc1ccc(C(=O)NCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450613566	DA	On-Demand	Anodyne	MMP1	19	53
COCCOC1(CNc2ncnc3[nH]c4ccccc4c23)CCOCC1	ZINC000450613575	FF	On-Demand	Anodyne	UTS2R	26	44
O[C@@H]1C[C@@H](c2cc(F)ccc2F)N(Cc2ccccc2OC2CC2)C1	ZINC000450613576	EH	On-Demand	Anodyne	SLC5A4	45	35
O[C@@H]1C[C@H](c2cc(F)ccc2F)N(Cc2ccccc2OC2CC2)C1	ZINC000450613577	EH	On-Demand	Anodyne	SLC5A4	45	35
O[C@H]1C[C@H](c2cc(F)ccc2F)N(Cc2ccccc2OC2CC2)C1	ZINC000450613578	EH	On-Demand	Anodyne	SLC5A4	45	35
O[C@H]1C[C@@H](c2cc(F)ccc2F)N(Cc2ccccc2OC2CC2)C1	ZINC000450613579	EH	On-Demand	Anodyne	SLC5A4	45	35
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	FKBP1A	54	54
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	MMP13	55	47
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	CCR4	0	41
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	ADAM17	52	43
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	ITGA4	44	45
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	AMY2	42	29
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	CAPNS1	20	48
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	MMP2	31	41
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	MMP3	57	47
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	MMP8	35	42
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	CAPN1	19	50
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	MMP9	34	43
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	MMP7	79	47
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	MMP1	63	51
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	SFRP1	104	38
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	WNT3	85	38
COC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613585	FB	On-Demand	Anodyne	TMPRSS11D	46	33
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	FKBP1A	54	54
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	MMP13	55	47
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	CCR4	0	41
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	ADAM17	52	43
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	ITGA4	44	45
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	AMY2	42	29
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	CAPNS1	20	48
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	MMP2	31	41
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	MMP3	57	47
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	MMP8	35	42
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	CAPN1	19	50
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	MMP9	34	43
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	MMP7	79	47
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	MMP1	63	51
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	SFRP1	104	38
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	WNT3	85	38
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450613586	FB	On-Demand	Anodyne	TMPRSS11D	46	33
CCN(CCC1CC1)C(=O)[C@H](C)OCCc1ccccc1	ZINC000450613592	CG	On-Demand	Anodyne	AMY2	61	37
CCN(CCC1CC1)C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450613593	CG	On-Demand	Anodyne	AMY2	61	37
C[C@@H](O)CCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450613596	CF	On-Demand	Anodyne	OPRM1	0	42
C[C@@H](O)CCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450613596	CF	On-Demand	Anodyne	OPRL1	38	42
C[C@@H](O)CCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450613596	CF	On-Demand	Anodyne	SCD1	53	45
C[C@H](O)CCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450613597	CF	On-Demand	Anodyne	OPRM1	0	42
C[C@H](O)CCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450613597	CF	On-Demand	Anodyne	OPRL1	38	42
C[C@H](O)CCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450613597	CF	On-Demand	Anodyne	SCD1	53	45
COc1ccc([N+](=O)[O-])cc1OCCCCCC(C)=O	ZINC000450613599	CG	On-Demand	Bother	KCNMA1	25	41
COc1ccc([N+](=O)[O-])cc1OCCCCCC(C)=O	ZINC000450613599	CG	On-Demand	Bother	ACR	34	42
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)N(C)C)C(=O)N1	ZINC000450613600	CB	On-Demand	Anodyne	BIRC8	43	33
CC(C)COc1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450613602	CC	On-Demand	Anodyne	DRD4	42	32
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@@H](O)C1	ZINC000450613603	CH	On-Demand	Anodyne	OPRK1	17	44
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@@H](O)C1	ZINC000450613604	CH	On-Demand	Anodyne	OPRK1	17	44
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@H](O)C1	ZINC000450613605	CH	On-Demand	Anodyne	OPRK1	17	44
CC(C)COc1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450613606	CC	On-Demand	Anodyne	DRD4	42	32
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)N(C)C)C(=O)N1	ZINC000450613608	CB	On-Demand	Anodyne	BIRC8	43	33
CN1C[C@H](NC(=O)[C@H](c2ccccc2)N(C)C)C(=O)N1	ZINC000450613610	CB	On-Demand	Anodyne	BIRC8	43	33
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)N(C)C)C(=O)N1	ZINC000450613612	CB	On-Demand	Anodyne	BIRC8	43	33
NC(=O)c1ccc(OCC2=CCCCC2)cc1	ZINC000450613615	BF	On-Demand	Anodyne	ACR	35	41
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1	ZINC000450613624	FF	On-Demand	Anodyne	SCN10A	23	41
COC(=O)[C@](C)(O)CNC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1	ZINC000450613625	FF	On-Demand	Anodyne	SCN10A	23	41
CCN(C(=O)c1cn(C)nc1COC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450613628	FE	On-Demand	Anodyne	DRD4	37	41
CCN(C(=O)c1cn(C)nc1COC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450613628	FE	On-Demand	Anodyne	ACHE	34	42
CCN(C(=O)c1cn(C)nc1COC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450613628	FE	On-Demand	Anodyne	SIGMAR1	38	42
CCN(C(=O)c1cn(C)nc1COC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450613628	FE	On-Demand	Anodyne	CCR5	55	46
CCN(C(=O)c1cn(C)nc1COC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450613629	FE	On-Demand	Anodyne	DRD4	37	41
CCN(C(=O)c1cn(C)nc1COC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450613629	FE	On-Demand	Anodyne	ACHE	34	42
CCN(C(=O)c1cn(C)nc1COC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450613629	FE	On-Demand	Anodyne	SIGMAR1	38	42
CCN(C(=O)c1cn(C)nc1COC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450613629	FE	On-Demand	Anodyne	CCR5	55	46
Cn1c(SCC2CC(F)(F)C2)nnc1-c1ccco1	ZINC000450613652	CG	On-Demand	Anodyne	DRD3	58	36
Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)nn1-c1cccc(Cl)c1	ZINC000450613689	EC	On-Demand	Anodyne	NPY5R	18	49
Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)nn1-c1cccc(Cl)c1	ZINC000450613690	EC	On-Demand	Anodyne	NPY5R	18	49
O=C(NCc1nc2ccccc2n1C1CC1)[C@@H]1CC1(F)F	ZINC000450613700	CF	On-Demand	Anodyne	CCR5	15	41
O=C(NCc1nc2ccccc2n1C1CC1)[C@H]1CC1(F)F	ZINC000450613701	CF	On-Demand	Anodyne	CCR5	15	41
CCOCCO[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450613702	DF	On-Demand	Anodyne	SSTR5	66	42
CCOCCO[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450613702	DF	On-Demand	Anodyne	UTS2R	27	40
COc1ccc2nc(C(F)(F)F)nc(N[C@@H]3CCCN(CCCO)C3)c2c1	ZINC000450613712	GE	On-Demand	Anodyne	CCR4	23	45
COc1ccc2nc(C(F)(F)F)nc(N[C@@H]3CCCN(CCCO)C3)c2c1	ZINC000450613712	GE	On-Demand	Anodyne	EHMT2	82	36
COc1ccc2nc(C(F)(F)F)nc(N[C@H]3CCCN(CCCO)C3)c2c1	ZINC000450613713	GE	On-Demand	Anodyne	CCR4	23	45
COc1ccc2nc(C(F)(F)F)nc(N[C@H]3CCCN(CCCO)C3)c2c1	ZINC000450613713	GE	On-Demand	Anodyne	EHMT2	82	36
O=[N+]([O-])c1cc(F)ccc1N[C@@H]1CCCN(CCCO)C1	ZINC000450613725	CD	On-Demand	Bother	CCR3	24	40
O=[N+]([O-])c1cc(F)ccc1N[C@H]1CCCN(CCCO)C1	ZINC000450613726	CD	On-Demand	Bother	CCR3	24	40
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@H](O)C1	ZINC000450613732	CH	On-Demand	Anodyne	OPRK1	17	44
CCCN(CCC)C(=O)CCCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450613737	DC	On-Demand	Anodyne	LASR	44	36
CCCN(CCC)C(=O)CCCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450613738	DC	On-Demand	Anodyne	LASR	44	36
COc1cc(-c2noc(CN3CC[C@@H](Oc4ccccc4Cl)C3)n2)ncn1	ZINC000450613744	GF	On-Demand	Anodyne	PDE3A	28	44
COc1cc(-c2noc(CN3CC[C@@H](Oc4ccccc4Cl)C3)n2)ncn1	ZINC000450613744	GF	On-Demand	Anodyne	PDE3B	46	34
COc1cc(-c2noc(CN3CC[C@@H](Oc4ccccc4Cl)C3)n2)ncn1	ZINC000450613744	GF	On-Demand	Anodyne	SCD1	18	43
COc1cc(-c2noc(CN3CC[C@H](Oc4ccccc4Cl)C3)n2)ncn1	ZINC000450613745	GF	On-Demand	Anodyne	PDE3A	28	44
COc1cc(-c2noc(CN3CC[C@H](Oc4ccccc4Cl)C3)n2)ncn1	ZINC000450613745	GF	On-Demand	Anodyne	PDE3B	46	34
COc1cc(-c2noc(CN3CC[C@H](Oc4ccccc4Cl)C3)n2)ncn1	ZINC000450613745	GF	On-Demand	Anodyne	SCD1	18	43
COC(=O)[C@@](C)(O)CNC(=O)c1csc(-c2ccc(Cl)cc2)c1	ZINC000450613746	FF	On-Demand	Anodyne	SCN10A	42	34
COC(=O)[C@](C)(O)CNC(=O)c1csc(-c2ccc(Cl)cc2)c1	ZINC000450613747	FF	On-Demand	Anodyne	SCN10A	42	34
CN1C[C@H](NC(=O)c2ccc(CN3CCSCC3)cc2)C(=O)N1	ZINC000450613770	EC	On-Demand	Anodyne	DRD4	17	40
CN1C[C@@H](NC(=O)c2ccc(CN3CCSCC3)cc2)C(=O)N1	ZINC000450613772	EC	On-Demand	Anodyne	DRD4	17	40
CCCC[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C(=O)OC	ZINC000450613786	DE	On-Demand	Anodyne	C3AR1	33	45
CCCC[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C(=O)OC	ZINC000450613788	DE	On-Demand	Anodyne	C3AR1	33	45
CCCC[C@H](NC(=O)Cc1cc(C)ccc1F)C(=O)OC	ZINC000450613792	CF	On-Demand	Anodyne	NOD1	65	37
CCCC[C@@H](NC(=O)Cc1cc(C)ccc1F)C(=O)OC	ZINC000450613793	CF	On-Demand	Anodyne	NOD1	65	37
CCCCCOCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450613809	BB	On-Demand	Anodyne	LUXR	32	40
CCCCCOCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450613809	BB	On-Demand	Anodyne	LASR	49	40
COC(=O)[C@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613814	DD	On-Demand	Anodyne	DRD4	40	32
COC(=O)[C@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613814	DD	On-Demand	Anodyne	ECR	40	35
COC(=O)[C@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613814	DD	On-Demand	Anodyne	COLA	50	34
COC(=O)[C@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613814	DD	On-Demand	Anodyne	CPT1A	47	33
COC(=O)[C@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613814	DD	On-Demand	Anodyne	MT-ND1	24	40
COC(=O)[C@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613814	DD	On-Demand	Anodyne	ADCYAP1R1	44	36
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613815	DD	On-Demand	Anodyne	DRD4	40	32
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613815	DD	On-Demand	Anodyne	ECR	40	35
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613815	DD	On-Demand	Anodyne	COLA	50	34
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613815	DD	On-Demand	Anodyne	CPT1A	47	33
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613815	DD	On-Demand	Anodyne	MT-ND1	24	40
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(OC)c(Cl)c1	ZINC000450613815	DD	On-Demand	Anodyne	ADCYAP1R1	44	36
CCCCCOCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450613817	BB	On-Demand	Anodyne	LUXR	32	40
CCCCCOCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450613817	BB	On-Demand	Anodyne	LASR	49	40
COC(=O)c1cn([C@@H]2CCN(C(=O)c3cnn4ccc(C)cc34)C2)nn1	ZINC000450613828	FD	On-Demand	Anodyne	EPHB3	26	42
COC(=O)c1cn([C@H]2CCN(C(=O)c3cnn4ccc(C)cc34)C2)nn1	ZINC000450613838	FD	On-Demand	Anodyne	EPHB3	26	42
CCOC(=O)c1cc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)on1	ZINC000450613845	GE	On-Demand	Anodyne	NOD1	26	42
CCOC(=O)c1cc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)on1	ZINC000450613845	GE	On-Demand	Anodyne	NOD2	41	42
COC(=O)c1cn([C@H]2CCN(C(=O)[C@@H](C)OCc3ccc(F)cc3)C2)nn1	ZINC000450613846	GD	On-Demand	Anodyne	CCR3	78	35
COC(=O)c1cn([C@@H]2CCN(C(=O)[C@@H](C)OCc3ccc(F)cc3)C2)nn1	ZINC000450613850	GD	On-Demand	Anodyne	CCR3	78	35
COC(=O)c1cn([C@@H]2CCN(C(=O)[C@H](C)OCc3ccc(F)cc3)C2)nn1	ZINC000450613851	GD	On-Demand	Anodyne	CCR3	78	35
COC(=O)c1cn([C@H]2CCN(C(=O)[C@H](C)OCc3ccc(F)cc3)C2)nn1	ZINC000450613853	GD	On-Demand	Anodyne	CCR3	78	35
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC000450613866	GI	On-Demand	Anodyne	CYP2J2	52	38
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC000450613868	GI	On-Demand	Anodyne	CYP2J2	52	38
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC000450613869	GI	On-Demand	Anodyne	CYP2J2	52	38
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC000450613870	GI	On-Demand	Anodyne	CYP2J2	52	38
CCCC[C@@H](NC(=O)c1cccc(CC)n1)C(=O)OC	ZINC000450613877	CE	On-Demand	Anodyne	PDE5A	29	44
CCCC[C@@H](NC(=O)c1cccc(CC)n1)C(=O)OC	ZINC000450613877	CE	On-Demand	Anodyne	P2RY12	163	41
CCCC[C@H](NC(=O)c1cccc(CC)n1)C(=O)OC	ZINC000450613878	CE	On-Demand	Anodyne	PDE5A	29	44
CCCC[C@H](NC(=O)c1cccc(CC)n1)C(=O)OC	ZINC000450613878	CE	On-Demand	Anodyne	P2RY12	163	41
COC(=O)c1coc(Cn2nnc(-c3ccc(OC)c(OC)c3)n2)n1	ZINC000450613880	ED	On-Demand	Anodyne	SCARB1	44	44
CCOC(=O)c1ccc(CN2CCC(Cn3ccnn3)CC2)nc1	ZINC000450613889	ED	On-Demand	Anodyne	SSTR5	46	38
CCCC[C@@H](NC(=O)CCCn1nc(C)nc1C)C(=O)OC	ZINC000450613893	DD	On-Demand	Anodyne	NOD1	93	42
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450613902	ED	On-Demand	Anodyne	SLC6A1	22	41
CCCC[C@H](NC(=O)CCCn1nc(C)nc1C)C(=O)OC	ZINC000450613906	DD	On-Demand	Anodyne	NOD1	93	42
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	ACE	42	42
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	MME	49	33
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	MC4R	18	43
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	FCER2	44	32
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	PAPA1_CARPA	32	42
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	CYSP_TRYCR	47	38
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	CTSL	45	41
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	TIMP3	51	39
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	MC3R	21	43
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	CTSS	23	46
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	MMP9	23	40
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	ACE2	40	34
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	C5AR1	44	36
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	MMP7	22	43
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	MMP1	20	43
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	PSMB5	49	39
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	BLA1_STEMA	47	35
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	KISS1R	56	33
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	NPFFR1	43	37
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	GPR142	58	32
CN1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613907	FB	On-Demand	Anodyne	DERP1	0	40
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	ACE	42	42
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	MME	49	33
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	MC4R	18	43
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	FCER2	44	32
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	PAPA1_CARPA	32	42
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	CYSP_TRYCR	47	38
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	CTSL	45	41
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	TIMP3	51	39
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	MC3R	21	43
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	CTSS	23	46
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	MMP9	23	40
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	ACE2	40	34
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	C5AR1	44	36
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	MMP7	22	43
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	MMP1	20	43
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	PSMB5	49	39
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	BLA1_STEMA	47	35
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	KISS1R	56	33
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	NPFFR1	43	37
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	GPR142	58	32
CN1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613912	FB	On-Demand	Anodyne	DERP1	0	40
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	ACE	42	42
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	MME	49	33
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	MC4R	18	43
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	FCER2	44	32
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	PAPA1_CARPA	32	42
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	CYSP_TRYCR	47	38
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	CTSL	45	41
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	TIMP3	51	39
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	MC3R	21	43
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	CTSS	23	46
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	MMP9	23	40
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	ACE2	40	34
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	C5AR1	44	36
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	MMP7	22	43
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	MMP1	20	43
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	PSMB5	49	39
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	BLA1_STEMA	47	35
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	KISS1R	56	33
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	NPFFR1	43	37
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	GPR142	58	32
CN1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613916	FB	On-Demand	Anodyne	DERP1	0	40
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	ACE	42	42
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	MME	49	33
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	MC4R	18	43
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	FCER2	44	32
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	PAPA1_CARPA	32	42
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	CYSP_TRYCR	47	38
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	CTSL	45	41
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	TIMP3	51	39
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	MC3R	21	43
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	CTSS	23	46
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	MMP9	23	40
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	ACE2	40	34
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	C5AR1	44	36
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	MMP7	22	43
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	MMP1	20	43
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	PSMB5	49	39
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	BLA1_STEMA	47	35
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	KISS1R	56	33
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	NPFFR1	43	37
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	GPR142	58	32
CN1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)C(=O)N1	ZINC000450613920	FB	On-Demand	Anodyne	DERP1	0	40
Clc1ccc([C@H](c2ccccc2)N2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450613930	FG	On-Demand	Anodyne	OPRD1	0	47
Clc1ccc([C@H](c2ccccc2)N2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450613930	FG	On-Demand	Anodyne	OPRK1	0	47
Clc1ccc([C@H](c2ccccc2)N2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450613930	FG	On-Demand	Anodyne	OPRL1	20	45
CCOc1ccccc1C(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)C(C)C	ZINC000450613937	FC	On-Demand	Anodyne	HCN1	51	38
CCOc1ccccc1C(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)C(C)C	ZINC000450613937	FC	On-Demand	Anodyne	HCN4	48	37
CCOc1ccccc1C(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)C(C)C	ZINC000450613941	FC	On-Demand	Anodyne	HCN1	51	38
CCOc1ccccc1C(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)C(C)C	ZINC000450613941	FC	On-Demand	Anodyne	HCN4	48	37
CCOc1ccccc1C(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)C(C)C	ZINC000450613943	FC	On-Demand	Anodyne	HCN1	51	38
CCOc1ccccc1C(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)C(C)C	ZINC000450613943	FC	On-Demand	Anodyne	HCN4	48	37
CCOc1ccccc1C(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)C(C)C	ZINC000450613944	FC	On-Demand	Anodyne	HCN1	51	38
CCOc1ccccc1C(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)C(C)C	ZINC000450613944	FC	On-Demand	Anodyne	HCN4	48	37
Clc1ccc([C@@H](c2ccccc2)N2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450613945	FG	On-Demand	Anodyne	OPRD1	0	47
Clc1ccc([C@@H](c2ccccc2)N2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450613945	FG	On-Demand	Anodyne	OPRK1	0	47
Clc1ccc([C@@H](c2ccccc2)N2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450613945	FG	On-Demand	Anodyne	OPRL1	20	45
CN1C[C@@H](NC(=O)Cc2ccc3c(c2)CCO3)C(=O)N1	ZINC000450613951	CB	On-Demand	Anodyne	LUXR	62	38
CN1C[C@H](NC(=O)Cc2ccc3c(c2)CCO3)C(=O)N1	ZINC000450613955	CB	On-Demand	Anodyne	LUXR	62	38
CN1C[C@H](NC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)C(=O)N1	ZINC000450613964	FD	On-Demand	Anodyne	AKR1B1	15	42
CN1C[C@H](NC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)C(=O)N1	ZINC000450613964	FD	On-Demand	Anodyne	AKR1B7	0	40
CN1C[C@@H](NC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)C(=O)N1	ZINC000450613969	FD	On-Demand	Anodyne	AKR1B1	15	42
CN1C[C@@H](NC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)C(=O)N1	ZINC000450613969	FD	On-Demand	Anodyne	AKR1B7	0	40
CSCc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450613971	CC	On-Demand	Anodyne	NAAA	21	42
CSCc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450613972	CC	On-Demand	Anodyne	NAAA	21	42
COc1ccc(NC(=O)c2nn3c(c2C)OCCC3)cc1OC(C)C	ZINC000450613973	EG	On-Demand	Anodyne	ENPP1	51	31
CCN1C(=O)C[C@H](C(=O)Nc2ccc(OC)c(OC(C)C)c2)[C@H]1c1cccnc1	ZINC000450613980	GG	On-Demand	Anodyne	ENPP1	69	36
COc1ccc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1OC(C)C	ZINC000450613981	GH	On-Demand	Anodyne	PDE4D	20	50
COc1ccc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1OC(C)C	ZINC000450613981	GH	On-Demand	Anodyne	ENPP1	71	36
COc1ccc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1OC(C)C	ZINC000450613981	GH	On-Demand	Anodyne	PDEC	0	44
COc1ccc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1OC(C)C	ZINC000450613982	GH	On-Demand	Anodyne	PDE4D	20	50
COc1ccc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1OC(C)C	ZINC000450613982	GH	On-Demand	Anodyne	ENPP1	71	36
COc1ccc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1OC(C)C	ZINC000450613982	GH	On-Demand	Anodyne	PDEC	0	44
COc1ccc(CNC(=O)CCN(C)[C@H](C)CO)c(OC)c1	ZINC000450613987	DD	On-Demand	Anodyne	MTNR1A	59	44
COc1ccc(CNC(=O)CCN(C)[C@H](C)CO)c(OC)c1	ZINC000450613987	DD	On-Demand	Anodyne	MTNR1B	44	44
COc1ccc(CNC(=O)CCN(C)[C@@H](C)CO)c(OC)c1	ZINC000450613988	DD	On-Demand	Anodyne	MTNR1A	59	44
COc1ccc(CNC(=O)CCN(C)[C@@H](C)CO)c(OC)c1	ZINC000450613988	DD	On-Demand	Anodyne	MTNR1B	44	44
COc1ccc(NC(=O)c2cc(C)c(C(N)=O)cn2)cc1OC(C)C	ZINC000450613989	EF	On-Demand	Anodyne	IMPDH2	0	40
COc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1OC(C)C	ZINC000450613991	FI	On-Demand	Anodyne	ENPP1	74	35
COc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1OC(C)C	ZINC000450613991	FI	On-Demand	Anodyne	DRTS_TRYCR	44	32
COc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1OC(C)C	ZINC000450613992	FI	On-Demand	Anodyne	ENPP1	74	35
COc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1OC(C)C	ZINC000450613992	FI	On-Demand	Anodyne	DRTS_TRYCR	44	32
COC(=O)c1cc(NCc2cccc(C(F)(F)F)n2)cc(C)c1[N+](=O)[O-]	ZINC000450614009	FH	On-Demand	Bother	CACNA1D	47	36
NC(=O)c1ccc(OCCC2=CCCCC2)cc1	ZINC000450614014	BG	On-Demand	Anodyne	SAT1	0	40
NC(=O)c1ccc(OCCC2=CCCCC2)cc1	ZINC000450614014	BG	On-Demand	Anodyne	ACR	36	40
COc1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1OC(C)C	ZINC000450614017	GH	On-Demand	Anodyne	COLA	69	36
COc1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1OC(C)C	ZINC000450614017	GH	On-Demand	Anodyne	CPT1A	69	36
COc1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1OC(C)C	ZINC000450614017	GH	On-Demand	Anodyne	CPT2	47	36
COc1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1OC(C)C	ZINC000450614017	GH	On-Demand	Anodyne	CPT1B	50	35
COc1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1OC(C)C	ZINC000450614017	GH	On-Demand	Anodyne	ENPP1	61	32
COc1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1OC(C)C	ZINC000450614017	GH	On-Demand	Anodyne	KCNK3	70	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	HTR1A	48	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	DRD2	44	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	DRD4	38	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	ADRA1D	15	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	HTR2A	29	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	HTR2C	19	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	SLC6A1	54	34
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	HRH1	48	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	ADRA1B	16	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	DRD3	42	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	HTR4	73	38
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	CHRM3	17	41
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	HTR7	60	39
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	CCR3	38	40
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	CYP2J2	52	37
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	SCD1	39	46
CCC(=O)CCCN1CCC(Oc2ccccc2Cl)CC1	ZINC000450614024	DH	On-Demand	Anodyne	SCD	22	45
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450614029	EB	On-Demand	Anodyne	MTNR1B	0	49
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450614030	EB	On-Demand	Anodyne	MTNR1B	0	49
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450614031	EB	On-Demand	Anodyne	MTNR1B	0	49
CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450614035	FF	On-Demand	Anodyne	COLA	49	37
CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450614035	FF	On-Demand	Anodyne	CPT1A	44	30
CC[C@H](CC(F)(F)F)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450614036	FF	On-Demand	Anodyne	COLA	49	37
CC[C@H](CC(F)(F)F)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450614036	FF	On-Demand	Anodyne	CPT1A	44	30
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2)[C@@H](CO)C2CC2)cc1	ZINC000450614037	FG	On-Demand	Anodyne	GALR1	43	31
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2)[C@@H](CO)C2CC2)cc1	ZINC000450614037	FG	On-Demand	Anodyne	RORC	28	43
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2)[C@H](CO)C2CC2)cc1	ZINC000450614038	FG	On-Demand	Anodyne	GALR1	43	31
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2)[C@H](CO)C2CC2)cc1	ZINC000450614038	FG	On-Demand	Anodyne	RORC	28	43
Cc1cc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])ccn1	ZINC000450614052	EF	On-Demand	Bother	MAPK14	41	36
Cc1cc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])ccn1	ZINC000450614052	EF	On-Demand	Bother	TAAR1	15	44
C/C=C/COc1cccc(CC(=O)N[C@@H](CC)CC(F)(F)F)c1	ZINC000450614055	EI	On-Demand	Anodyne	PDS	83	38
C/C=C/COc1cccc(CC(=O)N[C@H](CC)CC(F)(F)F)c1	ZINC000450614056	EI	On-Demand	Anodyne	PDS	83	38
C/C=C\COc1cccc(CC(=O)N[C@@H](CC)CC(F)(F)F)c1	ZINC000450614057	EI	On-Demand	Anodyne	PDS	83	38
C/C=C\COc1cccc(CC(=O)N[C@H](CC)CC(F)(F)F)c1	ZINC000450614058	EI	On-Demand	Anodyne	PDS	83	38
COC(=O)c1sc2nc(C)nc(NCc3ccnc(C)c3)c2c1C	ZINC000450614062	EG	On-Demand	Anodyne	CHRM4	19	47
C=CCn1c(SCC[C@@H](C)O)nc2ccccc21	ZINC000450614076	CG	On-Demand	Mild	PTGDR2	17	44
C=CCn1c(SCC[C@H](C)O)nc2ccccc21	ZINC000450614077	CG	On-Demand	Mild	PTGDR2	17	44
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450614086	DD	On-Demand	Anodyne	SCN9A	26	41
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450614086	DD	On-Demand	Anodyne	AMY2	46	31
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450614087	DD	On-Demand	Anodyne	SCN9A	26	41
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450614087	DD	On-Demand	Anodyne	AMY2	46	31
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450614088	DD	On-Demand	Anodyne	SCN9A	26	41
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450614088	DD	On-Demand	Anodyne	AMY2	46	31
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450614089	DD	On-Demand	Anodyne	SCN9A	26	41
COC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450614089	DD	On-Demand	Anodyne	AMY2	46	31
C=CCOc1ccc(C(F)(F)F)cc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450614125	ED	On-Demand	Mild	LIPG	45	33
C=CCOc1ccc(C(F)(F)F)cc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450614126	ED	On-Demand	Mild	LIPG	45	33
CCN(C(=O)CCCC(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614133	EG	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)CCCC(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614133	EG	On-Demand	Anodyne	CCR5	45	43
CCN(C(=O)CCCC(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614133	EG	On-Demand	Anodyne	CYP2J2	46	33
CCN(C(=O)CCCC(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614135	EG	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)CCCC(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614135	EG	On-Demand	Anodyne	CCR5	45	43
CCN(C(=O)CCCC(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614135	EG	On-Demand	Anodyne	CYP2J2	46	33
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	HTR1A	32	55
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	DRD2	39	56
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	DRD1	23	51
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	DRD4	61	51
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	HTR2A	35	51
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	HTR2C	23	45
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	HRH1	18	51
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	DRD3	41	51
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	LTA4H	28	48
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	ERG2	19	46
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	HTR7	47	46
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	KCNA5	0	60
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	SIGMAR1	21	48
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	PRCP	21	40
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	CCR1	50	39
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	CHRNA7	35	51
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	PRNP	41	38
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	EPHX2	23	44
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	MCHR1	34	56
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	CACNA1G	19	60
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	CYP2J2	58	43
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	IMDH_CRYPV	25	42
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	AP2S1	0	46
O=C(CN1CCN(CCCC(=O)c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000450614154	GH	On-Demand	Anodyne	SENP1	0	42
CN1C[C@@H](NC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)C(=O)N1	ZINC000450614158	FC	On-Demand	Anodyne	RBP4	44	31
CN1C[C@H](NC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)C(=O)N1	ZINC000450614160	FC	On-Demand	Anodyne	RBP4	44	31
CN1C[C@H](NC(=O)CCCCOc2cccc(C#N)c2)C(=O)N1	ZINC000450614162	DC	On-Demand	Mild	CYSLTR2	40	31
CN1C[C@@H](NC(=O)CCCCOc2cccc(C#N)c2)C(=O)N1	ZINC000450614168	DC	On-Demand	Mild	CYSLTR2	40	31
CCN(CCC1CC1)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450614171	DF	On-Demand	Anodyne	DRD4	43	33
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614173	FI	On-Demand	Anodyne	DRD4	38	43
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614173	FI	On-Demand	Anodyne	ACHE	35	44
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614173	FI	On-Demand	Anodyne	SIGMAR1	42	43
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614173	FI	On-Demand	Anodyne	CCR5	66	45
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614173	FI	On-Demand	Anodyne	CCR2	22	41
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614173	FI	On-Demand	Anodyne	CACNA1G	37	42
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614176	FI	On-Demand	Anodyne	DRD4	38	43
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614176	FI	On-Demand	Anodyne	ACHE	35	44
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614176	FI	On-Demand	Anodyne	SIGMAR1	42	43
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614176	FI	On-Demand	Anodyne	CCR5	66	45
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614176	FI	On-Demand	Anodyne	CCR2	22	41
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614176	FI	On-Demand	Anodyne	CACNA1G	37	42
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614178	FI	On-Demand	Anodyne	DRD4	38	43
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614178	FI	On-Demand	Anodyne	ACHE	35	44
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614178	FI	On-Demand	Anodyne	SIGMAR1	42	43
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614178	FI	On-Demand	Anodyne	CCR5	66	45
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614178	FI	On-Demand	Anodyne	CCR2	22	41
CC[C@@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614178	FI	On-Demand	Anodyne	CACNA1G	37	42
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614180	FI	On-Demand	Anodyne	DRD4	38	43
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614180	FI	On-Demand	Anodyne	ACHE	35	44
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614180	FI	On-Demand	Anodyne	SIGMAR1	42	43
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614180	FI	On-Demand	Anodyne	CCR5	66	45
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614180	FI	On-Demand	Anodyne	CCR2	22	41
CC[C@H](CC(F)(F)F)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614180	FI	On-Demand	Anodyne	CACNA1G	37	42
OCCN1CCCC[C@@H]1CNc1nc(C(F)F)nc2ccccc12	ZINC000450614198	EE	On-Demand	Anodyne	HNMT	49	35
CN1CCN(Cc2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)CC1	ZINC000450614200	EB	On-Demand	Anodyne	DRD4	29	40
CN1CCN(Cc2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)CC1	ZINC000450614200	EB	On-Demand	Anodyne	SIGMAR1	22	41
CN1CCN(Cc2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)CC1	ZINC000450614200	EB	On-Demand	Anodyne	HDAC6	0	40
CN1CCN(Cc2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)CC1	ZINC000450614200	EB	On-Demand	Anodyne	NOD2	41	34
OCCN1CCCC[C@H]1CNc1nc(C(F)F)nc2ccccc12	ZINC000450614202	EE	On-Demand	Anodyne	HNMT	49	35
CN1CCN(Cc2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)CC1	ZINC000450614203	EB	On-Demand	Anodyne	DRD4	29	40
CN1CCN(Cc2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)CC1	ZINC000450614203	EB	On-Demand	Anodyne	SIGMAR1	22	41
CN1CCN(Cc2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)CC1	ZINC000450614203	EB	On-Demand	Anodyne	HDAC6	0	40
CN1CCN(Cc2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)CC1	ZINC000450614203	EB	On-Demand	Anodyne	NOD2	41	34
CN1C[C@@H](NC(=O)CCCc2ccc(Cl)cc2)C(=O)N1	ZINC000450614231	CD	On-Demand	Anodyne	CVIR	0	42
CN1C[C@H](NC(=O)CCCc2ccc(Cl)cc2)C(=O)N1	ZINC000450614233	CD	On-Demand	Anodyne	CVIR	0	42
CCS(=O)(=O)c1ccc(CN2CC[C@H](Oc3ccccc3Cl)C2)cc1	ZINC000450614241	GH	On-Demand	Anodyne	SSTR5	42	39
CCS(=O)(=O)c1ccc(CN2CC[C@H](Oc3ccccc3Cl)C2)cc1	ZINC000450614241	GH	On-Demand	Anodyne	UTS2R	27	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1	ZINC000450614242	GH	On-Demand	Anodyne	SSTR5	42	39
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Oc3ccccc3Cl)C2)cc1	ZINC000450614242	GH	On-Demand	Anodyne	UTS2R	27	41
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	HTR1A	20	44
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	DRD2	28	55
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	DRD4	32	41
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	HTR2A	34	44
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	HTR2C	22	44
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	SLC6A1	26	42
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	SLC6A4	17	42
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	HRH1	15	41
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	ADRA1B	30	41
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	DRD3	34	55
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	HRP1_PLAFA	43	48
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	HRH3	56	65
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	SIGMAR1	49	53
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	CCR1	41	37
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	CCR3	30	44
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	SCN2A	21	40
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	CCR4	28	40
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	CHRNA7	28	51
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	PYGL	0	41
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	MMP2	46	33
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	HNMT	76	37
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	EPHX2	34	52
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	MCHR1	26	47
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	CACNA1G	53	48
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	GNAI1	0	42
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	GNAI3	0	42
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	GNAO1	0	42
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	TBK1	55	35
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	GPBAR1	28	48
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	BIRC2	46	41
O=C(NCCCN1CCCCC1)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450614250	GH	On-Demand	Anodyne	L3MBTL3	35	41
COC(=O)c1cccc(CN2CCc3ccc(C(C)=O)cc3CC2)c1Cl	ZINC000450614257	FH	On-Demand	Anodyne	SLC6A5	21	41
COC(=O)c1cccc(CN2CCc3ccc(C(C)=O)cc3CC2)c1Cl	ZINC000450614257	FH	On-Demand	Anodyne	NOD2	42	36
C[C@@H](O)CCN1CCC[C@@H](Oc2ccccc2Cl)C1	ZINC000450614288	CF	On-Demand	Anodyne	SLC6A1	113	41
C[C@@H](O)CCN1CCC[C@H](Oc2ccccc2Cl)C1	ZINC000450614290	CF	On-Demand	Anodyne	SLC6A1	113	41
C[C@H](O)CCN1CCC[C@@H](Oc2ccccc2Cl)C1	ZINC000450614292	CF	On-Demand	Anodyne	SLC6A1	113	41
C[C@H](O)CCN1CCC[C@H](Oc2ccccc2Cl)C1	ZINC000450614294	CF	On-Demand	Anodyne	SLC6A1	113	41
CC[C@@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450614313	EG	On-Demand	Anodyne	PDE4D	15	40
CC[C@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450614315	EG	On-Demand	Anodyne	PDE4D	15	40
CC[C@@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450614316	EG	On-Demand	Anodyne	PDE4D	15	40
CC[C@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450614318	EG	On-Demand	Anodyne	PDE4D	15	40
CC(C)(CNc1ncc(C(=O)N2CCOCC2)cc1Cl)c1ccccn1	ZINC000450614336	FF	On-Demand	Anodyne	LRRK2	28	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450614342	GE	On-Demand	Mild	P2RY12	80	35
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450614363	EB	On-Demand	Anodyne	MTNR1B	0	49
CCC[C@H](O)CN1CCO[C@]2(CCc3ccccc32)C1	ZINC000450614367	CE	On-Demand	Anodyne	SIGMAR1	15	42
CCC[C@@H](O)CN1CCO[C@]2(CCc3ccccc32)C1	ZINC000450614369	CE	On-Demand	Anodyne	SIGMAR1	15	42
CCC[C@H](O)CN1CCO[C@@]2(CCc3ccccc32)C1	ZINC000450614372	CE	On-Demand	Anodyne	SIGMAR1	15	42
CCC[C@@H](O)CN1CCO[C@@]2(CCc3ccccc32)C1	ZINC000450614374	CE	On-Demand	Anodyne	SIGMAR1	15	42
COC[C@@]1(C)CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450614379	DE	On-Demand	Anodyne	CREBBP	43	33
COC[C@@]1(C)CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450614379	DE	On-Demand	Anodyne	BRD9	54	33
COC[C@]1(C)CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450614380	DE	On-Demand	Anodyne	CREBBP	43	33
COC[C@]1(C)CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450614380	DE	On-Demand	Anodyne	BRD9	54	33
CCn1nnc(C)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450614381	GD	On-Demand	Anodyne	GNAI1	0	43
CCn1nnc(C)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450614381	GD	On-Demand	Anodyne	GNAI3	0	43
CCn1nnc(C)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450614381	GD	On-Demand	Anodyne	GNAO1	0	43
O=C(NCCC[C@@H]1CCCCO1)c1cn(-c2cccnc2)nn1	ZINC000450614384	DD	On-Demand	Anodyne	TBXAS1	17	41
O=C(NCCC[C@H]1CCCCO1)c1cn(-c2cccnc2)nn1	ZINC000450614386	DD	On-Demand	Anodyne	TBXAS1	17	41
Cn1cnc([N+](=O)[O-])c1NCCOc1ccc(F)c(Cl)c1	ZINC000450614428	DF	On-Demand	Bother	S1PR4	0	40
Cn1c(NCCOc2ccc(F)c(Cl)c2)nc2c1c(O)nc(=O)n2C	ZINC000450614442	FD	On-Demand	Anodyne	PROKR1	65	33
O=C(c1cc(Cl)c(Br)cc1F)N1CCn2c(O)nnc2C1	ZINC000450614445	GE	On-Demand	Anodyne	P2RX7	50	50
Cc1ccccc1C(NC(=O)[C@@H]1CCCN(C)C1=O)c1ccccc1C	ZINC000450614465	FG	On-Demand	Anodyne	BIRC8	45	32
Cc1ccccc1C(NC(=O)[C@H]1CCCN(C)C1=O)c1ccccc1C	ZINC000450614471	FG	On-Demand	Anodyne	BIRC8	45	32
COc1ccc(NC(=O)c2ccsc2Br)cc1OC(C)C	ZINC000450614497	FJ	On-Demand	Anodyne	GRM4	17	42
COc1ccc(NC(=O)c2ccsc2Br)cc1OC(C)C	ZINC000450614497	FJ	On-Demand	Anodyne	ENPP1	70	35
COc1ccc(NC(=O)c2ccsc2Br)cc1OC(C)C	ZINC000450614497	FJ	On-Demand	Anodyne	KCNK3	43	42
COc1ccc(NC(=O)c2ccsc2Br)cc1OC(C)C	ZINC000450614497	FJ	On-Demand	Anodyne	KCNK9	37	42
CC(=O)c1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)cc1	ZINC000450614504	DH	On-Demand	Anodyne	SIGMAR1	53	53
CC(=O)c1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)cc1	ZINC000450614504	DH	On-Demand	Anodyne	SLC18A3	42	38
CC(=O)c1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)cc1	ZINC000450614504	DH	On-Demand	Anodyne	MCHR2	55	32
CC(=O)c1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)cc1	ZINC000450614504	DH	On-Demand	Anodyne	NOD2	42	36
CC(=O)c1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)cc1	ZINC000450614505	DH	On-Demand	Anodyne	SIGMAR1	53	53
CC(=O)c1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)cc1	ZINC000450614505	DH	On-Demand	Anodyne	SLC18A3	42	38
CC(=O)c1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)cc1	ZINC000450614505	DH	On-Demand	Anodyne	MCHR2	55	32
CC(=O)c1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)cc1	ZINC000450614505	DH	On-Demand	Anodyne	NOD2	42	36
CC(=O)CCCCCn1cnc2cc(-c3ccc(Cl)cc3)sc2c1=O	ZINC000450614513	FJ	On-Demand	Anodyne	MCHR1	42	52
Clc1ccccc1OC1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450614523	EG	On-Demand	Anodyne	SCN5A	55	38
Clc1ccccc1OC1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450614523	EG	On-Demand	Anodyne	SCD1	32	44
c1ccc(CCC[C@@H]2CCCCN2Cc2cnns2)cc1	ZINC000450614543	DH	On-Demand	Anodyne	SLC18A2	44	46
c1ccc(CCC[C@H]2CCCCN2Cc2cnns2)cc1	ZINC000450614544	DH	On-Demand	Anodyne	SLC18A2	44	46
COCCOC1(CNc2ncccc2OCc2ccccc2)CCOCC1	ZINC000450614546	FG	On-Demand	Anodyne	PPIA	50	40
COC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450614547	DC	On-Demand	Anodyne	TRPV1	24	47
COC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450614547	DC	On-Demand	Anodyne	NCE103	31	50
COC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450614547	DC	On-Demand	Anodyne	CAN2	0	50
COC(=O)[C@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450614548	DC	On-Demand	Anodyne	TRPV1	24	47
COC(=O)[C@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450614548	DC	On-Demand	Anodyne	NCE103	31	50
COC(=O)[C@](C)(O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450614548	DC	On-Demand	Anodyne	CAN2	0	50
CCN(C(=O)c1cnn2c1CCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614551	EF	On-Demand	Anodyne	ACHE	33	40
CCN(C(=O)c1cnn2c1CCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614551	EF	On-Demand	Anodyne	CCR5	35	41
CCN(C(=O)c1cnn2c1CCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614552	EF	On-Demand	Anodyne	ACHE	33	40
CCN(C(=O)c1cnn2c1CCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614552	EF	On-Demand	Anodyne	CCR5	35	41
CCc1cc(CCCN2CCC(CCCN3CCCC3)CC2)on1	ZINC000450614562	EH	On-Demand	Anodyne	NPY1R	40	34
CCN(C(=O)c1cc2cccnc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614567	FI	On-Demand	Anodyne	ACHE	33	49
CCN(C(=O)c1cc2cccnc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614567	FI	On-Demand	Anodyne	SIGMAR1	29	40
CCN(C(=O)c1cc2cccnc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614567	FI	On-Demand	Anodyne	CCR5	46	41
CCN(C(=O)c1cc2cccnc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614568	FI	On-Demand	Anodyne	ACHE	33	49
CCN(C(=O)c1cc2cccnc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614568	FI	On-Demand	Anodyne	SIGMAR1	29	40
CCN(C(=O)c1cc2cccnc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614568	FI	On-Demand	Anodyne	CCR5	46	41
CO[C@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450614587	FG	On-Demand	Bother	TAAR1	17	42
CO[C@@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450614588	FG	On-Demand	Bother	TAAR1	17	42
CC(C)CC(CC(C)C)C(=O)NCCc1ccn(C)n1	ZINC000450614604	CF	On-Demand	Anodyne	AMP1_PLAFQ	22	40
FC(F)(F)Cn1ccc(CN2CCC(CCCN3CCCC3)CC2)n1	ZINC000450614607	FH	On-Demand	Anodyne	NPY1R	40	33
COc1ccc(-c2noc(CN3CC[C@@H](Oc4ccccc4Cl)C3)n2)nn1	ZINC000450614615	GF	On-Demand	Anodyne	SCD1	28	54
COc1ccc(-c2noc(CN3CC[C@H](Oc4ccccc4Cl)C3)n2)nn1	ZINC000450614617	GF	On-Demand	Anodyne	SCD1	28	54
COC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2cc(F)ccc2F)cc1Cl	ZINC000450614619	GH	On-Demand	Anodyne	CCR1	27	42
COC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)cc1Cl	ZINC000450614622	GH	On-Demand	Anodyne	CCR1	27	42
COC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)cc1Cl	ZINC000450614624	GH	On-Demand	Anodyne	CCR1	27	42
CCCC[C@@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC	ZINC000450614625	CD	On-Demand	Anodyne	P2RY12	139	34
COC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)cc1Cl	ZINC000450614626	GH	On-Demand	Anodyne	CCR1	27	42
CO[C@H](CNc1ccc([N+](=O)[O-])cc1)Cc1ccccc1	ZINC000450614627	CG	On-Demand	Bother	CCR3	23	42
CO[C@@H](CNc1ccc([N+](=O)[O-])cc1)Cc1ccccc1	ZINC000450614628	CG	On-Demand	Bother	CCR3	23	42
CCCC[C@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC	ZINC000450614630	CD	On-Demand	Anodyne	P2RY12	139	34
CNC(=O)CCCN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450614638	CE	On-Demand	Anodyne	THRA	34	43
CNC(=O)CCCN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450614638	CE	On-Demand	Anodyne	THRB	0	40
CNC(=O)CCCN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450614638	CE	On-Demand	Anodyne	LSS	33	43
CCN(C(=O)c1ccnn1CC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614639	GG	On-Demand	Anodyne	ACHE	33	42
CCN(C(=O)c1ccnn1CC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614639	GG	On-Demand	Anodyne	SIGMAR1	29	43
CCN(C(=O)c1ccnn1CC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450614639	GG	On-Demand	Anodyne	CCR5	42	41
CCN(C(=O)c1ccnn1CC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614641	GG	On-Demand	Anodyne	ACHE	33	42
CCN(C(=O)c1ccnn1CC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614641	GG	On-Demand	Anodyne	SIGMAR1	29	43
CCN(C(=O)c1ccnn1CC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450614641	GG	On-Demand	Anodyne	CCR5	42	41
CCN(CCC1CC1)C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450614647	DG	On-Demand	Anodyne	ACHE	19	42
CCN(CCC1CC1)C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450614647	DG	On-Demand	Anodyne	OPRM1	18	43
CCN(CCC1CC1)C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450614647	DG	On-Demand	Anodyne	OPRD1	18	41
COC(=O)[C@](C)(O)CNC(=O)c1ccc(I)cc1F	ZINC000450614654	GD	On-Demand	Anodyne	MAP2K1	40	33
COC(=O)[C@@](C)(O)CNC(=O)c1ccc(I)cc1F	ZINC000450614655	GD	On-Demand	Anodyne	MAP2K1	40	33
COC(=O)c1cc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)ccc1Br	ZINC000450614668	GF	On-Demand	Anodyne	EPHX1	0	40
CN(C)CCCNS(=O)(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450614690	GD	On-Demand	Bother	BDKRB1	0	49
CN(C)CCCNS(=O)(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450614690	GD	On-Demand	Bother	BCL2L1	73	34
CN(C)CCCNS(=O)(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450614690	GD	On-Demand	Bother	BCL2	65	34
COC(=O)c1csc(Cn2nnc(-c3ccc(OC)c(OC)c3)n2)n1	ZINC000450614691	FD	On-Demand	Anodyne	ENPP1	62	33
COC(=O)c1csc(Cn2nnc(-c3ccc(OC)c(OC)c3)n2)n1	ZINC000450614691	FD	On-Demand	Anodyne	SCARB1	44	44
CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450614692	FC	On-Demand	Anodyne	DAC	22	41
CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450614694	FC	On-Demand	Anodyne	DAC	22	41
COC(=O)c1cnc(NC[C@H](Cc2ccccc2)OC)nc1	ZINC000450614710	DD	On-Demand	Anodyne	TPH1	42	32
COC(=O)c1cnc(NC[C@@H](Cc2ccccc2)OC)nc1	ZINC000450614711	DD	On-Demand	Anodyne	TPH1	42	32
CC[C@@H](CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450614734	CE	On-Demand	Anodyne	EPHX2	23	54
CC[C@@H](CC(C)C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450614735	CE	On-Demand	Anodyne	EPHX2	23	54
CC[C@H](CC(C)C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450614736	CE	On-Demand	Anodyne	EPHX2	23	54
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450614737	CE	On-Demand	Anodyne	EPHX2	23	54
CCCOc1ccc(C(=O)N2CC[C@@H](n3cc(C(=O)OC)nn3)C2)c(OC)c1	ZINC000450614740	GD	On-Demand	Anodyne	OXTR	26	43
CCCOc1ccc(C(=O)N2CC[C@H](n3cc(C(=O)OC)nn3)C2)c(OC)c1	ZINC000450614743	GD	On-Demand	Anodyne	OXTR	26	43
COc1ccc(CNC(=O)CCN(C)CC2(O)CCCC2)c(OC)c1	ZINC000450614744	FD	On-Demand	Anodyne	MTNR1A	58	43
COc1ccc(CNC(=O)CCN(C)CC2(O)CCCC2)c(OC)c1	ZINC000450614744	FD	On-Demand	Anodyne	MTNR1B	44	43
CCN(CCC1CC1)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450614748	EH	On-Demand	Bother	LIPG	27	41
Cc1ccc(Br)cc1CC(=O)NC1Cc2ccccc2C1	ZINC000450614758	EH	On-Demand	Anodyne	CA7	15	40
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(Br)cc1	ZINC000450614774	GI	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(Br)cc1	ZINC000450614774	GI	On-Demand	Anodyne	HTR2A	18	44
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(Br)cc1	ZINC000450614774	GI	On-Demand	Anodyne	HTR2C	18	45
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(Br)cc1	ZINC000450614774	GI	On-Demand	Anodyne	CYP2J2	61	43
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(Br)cc1	ZINC000450614776	GI	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(Br)cc1	ZINC000450614776	GI	On-Demand	Anodyne	HTR2A	18	44
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(Br)cc1	ZINC000450614776	GI	On-Demand	Anodyne	HTR2C	18	45
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(Br)cc1	ZINC000450614776	GI	On-Demand	Anodyne	CYP2J2	61	43
Cc1cc(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])ccn1	ZINC000450614778	FE	On-Demand	Bother	BDKRB1	23	42
CN(CCN1CC[C@H](S(N)(=O)=O)C1)Cc1ccccc1	ZINC000450614780	CC	On-Demand	Anodyne	SIGMAR1	50	46
CN(CCN1CC[C@H](S(N)(=O)=O)C1)Cc1ccccc1	ZINC000450614780	CC	On-Demand	Anodyne	CCR5	45	37
CN(CCN1CC[C@@H](S(N)(=O)=O)C1)Cc1ccccc1	ZINC000450614782	CC	On-Demand	Anodyne	SIGMAR1	50	46
CN(CCN1CC[C@@H](S(N)(=O)=O)C1)Cc1ccccc1	ZINC000450614782	CC	On-Demand	Anodyne	CCR5	45	37
Cc1ccccc1COc1cccc(CC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450614784	FD	On-Demand	Anodyne	ADAM17	39	41
Cc1ccccc1COc1cccc(CC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450614784	FD	On-Demand	Anodyne	UPP1	50	33
Cc1ccccc1COc1cccc(CC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450614789	FD	On-Demand	Anodyne	ADAM17	39	41
Cc1ccccc1COc1cccc(CC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450614789	FD	On-Demand	Anodyne	UPP1	50	33
COC(=O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450614799	FH	On-Demand	Anodyne	SCN5A	44	35
COC(=O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450614799	FH	On-Demand	Anodyne	SCD1	46	46
COC(=O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450614799	FH	On-Demand	Anodyne	SCD	25	42
COC(=O)c1csc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450614799	FH	On-Demand	Anodyne	TRPC6	44	32
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450614801	FD	On-Demand	Anodyne	HRP1_PLAFA	100	36
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450614801	FD	On-Demand	Anodyne	HNMT	47	33
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450614802	FD	On-Demand	Anodyne	HRP1_PLAFA	100	36
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450614802	FD	On-Demand	Anodyne	HNMT	47	33
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450614803	FD	On-Demand	Anodyne	HRP1_PLAFA	100	36
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450614803	FD	On-Demand	Anodyne	HNMT	47	33
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450614804	FD	On-Demand	Anodyne	HRP1_PLAFA	100	36
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450614804	FD	On-Demand	Anodyne	HNMT	47	33
O=C1CC[C@H](CN2CCCC[C@H]2CCCc2ccccc2)CCN1	ZINC000450614805	EH	On-Demand	Anodyne	SLC18A2	35	43
CC(F)(F)CCOc1ccccc1F	ZINC000450614813	BG	On-Demand	Anodyne	SDH1	0	40
C[C@H](c1csnn1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000450614815	DH	On-Demand	Anodyne	SCD1	50	46
C[C@@H](c1csnn1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000450614816	DH	On-Demand	Anodyne	SCD1	50	46
CN1C[C@@H](NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C(=O)N1	ZINC000450614817	GB	On-Demand	Anodyne	EPHX2	23	42
CN1C[C@@H](NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C(=O)N1	ZINC000450614817	GB	On-Demand	Anodyne	AKR1C3	28	42
CN1C[C@H](NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C(=O)N1	ZINC000450614818	GB	On-Demand	Anodyne	EPHX2	23	42
CN1C[C@H](NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C(=O)N1	ZINC000450614818	GB	On-Demand	Anodyne	AKR1C3	28	42
CN1C[C@H](NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C(=O)N1	ZINC000450614819	GB	On-Demand	Anodyne	EPHX2	23	42
CN1C[C@H](NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C(=O)N1	ZINC000450614819	GB	On-Demand	Anodyne	AKR1C3	28	42
CN1C[C@@H](NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C(=O)N1	ZINC000450614820	GB	On-Demand	Anodyne	EPHX2	23	42
CN1C[C@@H](NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C(=O)N1	ZINC000450614820	GB	On-Demand	Anodyne	AKR1C3	28	42
O=C1CC[C@@H](CN2CCCC[C@H]2CCCc2ccccc2)CCN1	ZINC000450614822	EH	On-Demand	Anodyne	SLC18A2	35	43
O=C1CC[C@H](CN2CCCC[C@@H]2CCCc2ccccc2)CCN1	ZINC000450614823	EH	On-Demand	Anodyne	SLC18A2	35	43
O=C1CC[C@@H](CN2CCCC[C@@H]2CCCc2ccccc2)CCN1	ZINC000450614824	EH	On-Demand	Anodyne	SLC18A2	35	43
CC(C)(CC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CC1	ZINC000450614848	CE	On-Demand	Bother	SLC27A4	48	31
CN1C[C@H](NC(=O)c2cc3c(OC(F)F)cccc3[nH]2)C(=O)N1	ZINC000450614861	DC	On-Demand	Anodyne	PYGM	37	40
CN1C[C@@H](NC(=O)c2cc3c(OC(F)F)cccc3[nH]2)C(=O)N1	ZINC000450614862	DC	On-Demand	Anodyne	PYGM	37	40
COC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614876	DC	On-Demand	Anodyne	PAPA1_CARPA	41	32
COC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614876	DC	On-Demand	Anodyne	CTSG	25	40
COC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614876	DC	On-Demand	Anodyne	CTRB1	33	40
COC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614876	DC	On-Demand	Anodyne	AMY2	43	30
COC(=O)[C@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614876	DC	On-Demand	Anodyne	CELA2A	26	40
COC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614877	DC	On-Demand	Anodyne	PAPA1_CARPA	41	32
COC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614877	DC	On-Demand	Anodyne	CTSG	25	40
COC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614877	DC	On-Demand	Anodyne	CTRB1	33	40
COC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614877	DC	On-Demand	Anodyne	AMY2	43	30
COC(=O)[C@@](C)(O)CNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450614877	DC	On-Demand	Anodyne	CELA2A	26	40
COC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614878	DC	On-Demand	Anodyne	PAPA1_CARPA	41	32
COC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614878	DC	On-Demand	Anodyne	CTSG	25	40
COC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614878	DC	On-Demand	Anodyne	CTRB1	33	40
COC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614878	DC	On-Demand	Anodyne	AMY2	43	30
COC(=O)[C@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614878	DC	On-Demand	Anodyne	CELA2A	26	40
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614879	DC	On-Demand	Anodyne	PAPA1_CARPA	41	32
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614879	DC	On-Demand	Anodyne	CTSG	25	40
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614879	DC	On-Demand	Anodyne	CTRB1	33	40
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614879	DC	On-Demand	Anodyne	AMY2	43	30
COC(=O)[C@@](C)(O)CNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450614879	DC	On-Demand	Anodyne	CELA2A	26	40
Clc1ccccc1O[C@H]1CCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450614882	EF	On-Demand	Anodyne	SCD1	19	40
Clc1ccccc1O[C@@H]1CCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450614883	EF	On-Demand	Anodyne	SCD1	19	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(CF)CCOCC2)cc1	ZINC000450614889	EF	On-Demand	Anodyne	TIMP3	44	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(CF)CCOCC2)cc1	ZINC000450614890	EF	On-Demand	Anodyne	TIMP3	44	35
COC[C@@]1(C(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)CCOC1	ZINC000450614895	EE	On-Demand	Anodyne	TIMP3	43	34
COC[C@@]1(C(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)CCOC1	ZINC000450614895	EE	On-Demand	Anodyne	PSMB8	41	33
COC[C@]1(C(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)CCOC1	ZINC000450614896	EE	On-Demand	Anodyne	TIMP3	43	34
COC[C@]1(C(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)CCOC1	ZINC000450614896	EE	On-Demand	Anodyne	PSMB8	41	33
COC[C@]1(C(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)CCOC1	ZINC000450614897	EE	On-Demand	Anodyne	TIMP3	43	34
COC[C@]1(C(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)CCOC1	ZINC000450614897	EE	On-Demand	Anodyne	PSMB8	41	33
COC[C@@]1(C(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)CCOC1	ZINC000450614898	EE	On-Demand	Anodyne	TIMP3	43	34
COC[C@@]1(C(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)CCOC1	ZINC000450614898	EE	On-Demand	Anodyne	PSMB8	41	33
COc1ccc(NC(=O)CC2(O)CCC2)cc1OC(C)C	ZINC000450614913	CF	On-Demand	Anodyne	ENPP1	72	42
CC(F)(F)CCOc1ccc(C(N)=O)cc1	ZINC000450614914	BE	On-Demand	Anodyne	KCNQ1	0	41
CC(F)(F)CCOc1ccc(C(N)=O)cc1	ZINC000450614914	BE	On-Demand	Anodyne	SAT1	0	42
CC(F)(F)CCOc1ccc(C(N)=O)cc1	ZINC000450614914	BE	On-Demand	Anodyne	PLA2G4B	69	39
CC(F)(F)CCOc1ccc(C(N)=O)cc1	ZINC000450614914	BE	On-Demand	Anodyne	ACR	40	42
CC(F)(F)CCOc1ccc(C(N)=O)cc1	ZINC000450614914	BE	On-Demand	Anodyne	MVFR	0	46
COc1ccc(CC(=O)NCCc2ccn(C)n2)c(Cl)c1OC	ZINC000450614935	ED	On-Demand	Anodyne	CAN2	0	40
Cc1cc(C(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)ncc1C(N)=O	ZINC000450614964	GF	On-Demand	Anodyne	TPSAB1	42	32
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)C1	ZINC000450614968	GC	On-Demand	Anodyne	AKR1C3	24	48
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)C1	ZINC000450614968	GC	On-Demand	Anodyne	RAC1	0	48
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)C1	ZINC000450614985	GC	On-Demand	Anodyne	AKR1C3	24	48
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)C1	ZINC000450614985	GC	On-Demand	Anodyne	RAC1	0	48
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)C1	ZINC000450614986	GC	On-Demand	Anodyne	AKR1C3	24	48
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N[C@@H]3CN(C)NC3=O)cc2)C1	ZINC000450614986	GC	On-Demand	Anodyne	RAC1	0	48
FC(F)(F)Cn1ccc(COc2ccc(Cl)cc2Cl)n1	ZINC000450614987	EI	On-Demand	Anodyne	S1PR4	23	44
CCC[C@H](OC)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450614988	CC	On-Demand	Anodyne	EPHX2	22	47
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)C1	ZINC000450614989	GC	On-Demand	Anodyne	AKR1C3	24	48
C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N[C@H]3CN(C)NC3=O)cc2)C1	ZINC000450614989	GC	On-Demand	Anodyne	RAC1	0	48
CCC[C@@H](OC)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450614994	CC	On-Demand	Anodyne	EPHX2	22	47
CCC[C@H](OC)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450614997	CC	On-Demand	Anodyne	EPHX2	22	47
CCC[C@@H](OC)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450615001	CC	On-Demand	Anodyne	EPHX2	22	47
C=CCn1c(SCc2c(C)nnn2CC)nc2ccccc21	ZINC000450615004	DG	On-Demand	Mild	PTGDR2	16	40
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	CPT1A	59	37
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	CPT2	44	34
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	GRM4	19	40
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	ROCK2	16	44
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	CPT1B	42	36
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	IMPDH2	0	41
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	TAAR1	36	41
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	ENPP1	75	36
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	SMO	17	40
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	KCNK3	123	47
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	KCNK9	84	44
COc1ccc(NC(=O)c2cccc(SC)c2)cc1OC(C)C	ZINC000450615012	EI	On-Demand	Anodyne	BRPF1	0	41
CCOc1ccccc1-c1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450615019	ED	On-Demand	Anodyne	PTGER1	24	40
CCOc1ccccc1-c1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450615021	ED	On-Demand	Anodyne	PTGER1	24	40
COC(=O)[C@@](C)(O)CNC(=O)c1ccc2cnccc2c1	ZINC000450615034	CC	On-Demand	Anodyne	AKT1	0	41
COC(=O)[C@](C)(O)CNC(=O)c1ccc2cnccc2c1	ZINC000450615038	CC	On-Demand	Anodyne	AKT1	0	41
COC[C@@]1(C)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450615043	DF	On-Demand	Anodyne	PDE3A	52	39
COC[C@@]1(C)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450615043	DF	On-Demand	Anodyne	PDE3B	76	39
COC[C@]1(C)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450615046	DF	On-Demand	Anodyne	PDE3A	52	39
COC[C@]1(C)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450615046	DF	On-Demand	Anodyne	PDE3B	76	39
C=CCNc1nnc(S[C@H](C)C(=O)Nc2nccs2)s1	ZINC000450615047	EE	On-Demand	Mild	MAP1	90	41
C=CCNc1nnc(S[C@@H](C)C(=O)Nc2nccs2)s1	ZINC000450615052	EE	On-Demand	Mild	MAP1	90	41
CCOC(=O)c1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450615055	GG	On-Demand	Anodyne	ACHE	29	40
CCOC(=O)c1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450615055	GG	On-Demand	Anodyne	SIGMAR1	28	40
CCOC(=O)c1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450615055	GG	On-Demand	Anodyne	CCR5	46	44
CCOC(=O)c1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450615055	GG	On-Demand	Anodyne	MBTPS1	61	38
CCS(=O)(=O)c1ccc(CSc2nnc(Cc3csc(C)n3)o2)cc1	ZINC000450615058	GH	On-Demand	Anodyne	CPB	0	41
CCOC(=O)c1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450615061	GG	On-Demand	Anodyne	ACHE	29	40
CCOC(=O)c1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450615061	GG	On-Demand	Anodyne	SIGMAR1	28	40
CCOC(=O)c1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450615061	GG	On-Demand	Anodyne	CCR5	46	44
CCOC(=O)c1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450615061	GG	On-Demand	Anodyne	MBTPS1	61	38
CCCC[C@@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)C(=O)OC	ZINC000450615064	FF	On-Demand	Anodyne	NOD1	49	31
COc1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)c([N+](=O)[O-])cc1F	ZINC000450615065	GH	On-Demand	Bother	GRM4	17	42
COc1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)c([N+](=O)[O-])cc1F	ZINC000450615065	GH	On-Demand	Bother	TAAR1	25	43
COc1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)c([N+](=O)[O-])cc1F	ZINC000450615065	GH	On-Demand	Bother	ENPP1	60	31
COc1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)c([N+](=O)[O-])cc1F	ZINC000450615065	GH	On-Demand	Bother	KCNK3	40	38
CCCC[C@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)C(=O)OC	ZINC000450615067	FF	On-Demand	Anodyne	NOD1	49	31
CCN(CCC1CC1)C(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450615068	EE	On-Demand	Anodyne	ACKR3	70	38
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615071	GG	On-Demand	Anodyne	DRD4	28	41
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615071	GG	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615071	GG	On-Demand	Anodyne	DRD3	0	41
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615071	GG	On-Demand	Anodyne	OPRD1	20	45
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615071	GG	On-Demand	Anodyne	SIGMAR1	32	41
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615071	GG	On-Demand	Anodyne	CCR5	56	41
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615071	GG	On-Demand	Anodyne	MLNR	48	38
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615071	GG	On-Demand	Anodyne	CCR2	15	40
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615074	GG	On-Demand	Anodyne	DRD4	28	41
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615074	GG	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615074	GG	On-Demand	Anodyne	DRD3	0	41
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615074	GG	On-Demand	Anodyne	OPRD1	20	45
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615074	GG	On-Demand	Anodyne	SIGMAR1	32	41
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615074	GG	On-Demand	Anodyne	CCR5	56	41
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615074	GG	On-Demand	Anodyne	MLNR	48	38
CCN(C(=O)c1ccnc(OC(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615074	GG	On-Demand	Anodyne	CCR2	15	40
O=C(c1ccc(I)cc1F)N1CCn2c(O)nnc2C1	ZINC000450615083	GD	On-Demand	Anodyne	P2RX7	39	44
CCO[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450615108	CC	On-Demand	Anodyne	BIRC8	42	32
CCO[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450615110	CC	On-Demand	Anodyne	BIRC8	42	32
CCO[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450615111	CC	On-Demand	Anodyne	BIRC8	42	32
CCO[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450615113	CC	On-Demand	Anodyne	BIRC8	42	32
N#C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450615114	FG	On-Demand	Mild	HTR7	16	40
Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)nn1-c1ccc(Cl)c(Cl)c1	ZINC000450615116	FD	On-Demand	Anodyne	NPY5R	15	41
Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)nn1-c1ccc(Cl)c(Cl)c1	ZINC000450615116	FD	On-Demand	Anodyne	RPA1	78	39
N#C[C@H]1CN(CCc2ccc(Cl)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450615117	FG	On-Demand	Mild	HTR7	16	40
N#C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450615118	FG	On-Demand	Mild	HTR7	16	40
Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)nn1-c1ccc(Cl)c(Cl)c1	ZINC000450615119	FD	On-Demand	Anodyne	NPY5R	15	41
Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)nn1-c1ccc(Cl)c(Cl)c1	ZINC000450615119	FD	On-Demand	Anodyne	RPA1	78	39
N#C[C@H]1CN(CCc2ccc(Cl)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450615120	FG	On-Demand	Mild	HTR7	16	40
COc1ccc(NC(=O)CCCn2nc(C)nc2C)cc1OC(C)C	ZINC000450615123	EG	On-Demand	Anodyne	ENPP1	69	40
CCOC(=O)c1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)on1	ZINC000450615124	EF	On-Demand	Anodyne	DRTS_TRYCR	44	33
O=C(c1cc(Br)c(F)cc1O)N1CCn2c(O)nnc2C1	ZINC000450615125	FD	On-Demand	Anodyne	P2RX7	40	47
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450615126	CD	On-Demand	Anodyne	MMP1	23	44
CC(C)CC(CC(C)C)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450615127	CD	On-Demand	Anodyne	MMP1	23	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cc(C)c(C(N)=O)cn2)cc1	ZINC000450615138	FE	On-Demand	Anodyne	CSF1R	46	36
CO[C@@H](CNc1ccc(S(N)(=O)=O)cn1)Cc1ccccc1	ZINC000450615140	DC	On-Demand	Anodyne	CA2	42	40
CO[C@@H](CNc1ccc(S(N)(=O)=O)cn1)Cc1ccccc1	ZINC000450615140	DC	On-Demand	Anodyne	CA1	31	40
CO[C@@H](CNc1ccc(S(N)(=O)=O)cn1)Cc1ccccc1	ZINC000450615140	DC	On-Demand	Anodyne	CA7	32	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cc(C)c(C(N)=O)cn2)cc1	ZINC000450615141	FE	On-Demand	Anodyne	CSF1R	46	36
CO[C@H](CNc1ccc(S(N)(=O)=O)cn1)Cc1ccccc1	ZINC000450615142	DC	On-Demand	Anodyne	CA2	42	40
CO[C@H](CNc1ccc(S(N)(=O)=O)cn1)Cc1ccccc1	ZINC000450615142	DC	On-Demand	Anodyne	CA1	31	40
CO[C@H](CNc1ccc(S(N)(=O)=O)cn1)Cc1ccccc1	ZINC000450615142	DC	On-Demand	Anodyne	CA7	32	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)[C@H]1OC	ZINC000450615151	DE	On-Demand	Anodyne	GPR88	0	41
COCCCn1c(SCc2ccc(C(C)=O)cc2)nc2ccccc2c1=O	ZINC000450615153	GH	On-Demand	Anodyne	PTGDR2	18	47
Cc1ccccc1C(NC(=O)c1cc2n(n1)CCC2)c1ccccc1C	ZINC000450615160	EH	On-Demand	Anodyne	CTSA	61	40
CCCC[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OC	ZINC000450615170	DF	On-Demand	Anodyne	SELE	60	36
CCCC[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OC	ZINC000450615170	DF	On-Demand	Anodyne	ICAM1	57	35
CCCC[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OC	ZINC000450615170	DF	On-Demand	Anodyne	VCAM1	52	33
CCCC[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OC	ZINC000450615173	DF	On-Demand	Anodyne	SELE	60	36
CCCC[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OC	ZINC000450615173	DF	On-Demand	Anodyne	ICAM1	57	35
CCCC[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OC	ZINC000450615173	DF	On-Demand	Anodyne	VCAM1	52	33
Cc1cccc(NC(=O)NCC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450615220	DB	On-Demand	Anodyne	PTGER3	22	42
Cc1cccc(NC(=O)NCC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450615220	DB	On-Demand	Anodyne	CCKAR	50	42
Cc1cccc(NC(=O)NCC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450615220	DB	On-Demand	Anodyne	HDAC10	27	42
Cc1cccc(NC(=O)NCC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450615220	DB	On-Demand	Anodyne	CCKBR	54	40
Cc1cccc(NC(=O)NCC(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450615220	DB	On-Demand	Anodyne	HDAC11	23	42
Cc1cccc(NC(=O)NCC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450615222	DB	On-Demand	Anodyne	PTGER3	22	42
Cc1cccc(NC(=O)NCC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450615222	DB	On-Demand	Anodyne	CCKAR	50	42
Cc1cccc(NC(=O)NCC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450615222	DB	On-Demand	Anodyne	HDAC10	27	42
Cc1cccc(NC(=O)NCC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450615222	DB	On-Demand	Anodyne	CCKBR	54	40
Cc1cccc(NC(=O)NCC(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450615222	DB	On-Demand	Anodyne	HDAC11	23	42
O=C(CCCN1CCC[C@H](Cn2ccnn2)C1)c1ccc(Br)cc1	ZINC000450615237	GG	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1CCC[C@@H](Cn2ccnn2)C1)c1ccc(Br)cc1	ZINC000450615238	GG	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450615240	EC	On-Demand	Anodyne	CTSS	25	45
COC(=O)[C@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450615240	EC	On-Demand	Anodyne	NPR	49	37
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450615241	EC	On-Demand	Anodyne	CTSS	25	45
COC(=O)[C@@](C)(O)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450615241	EC	On-Demand	Anodyne	NPR	49	37
CN1C[C@@H](NC(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)C(=O)N1	ZINC000450615243	FD	On-Demand	Anodyne	S1PR4	15	40
CN1C[C@@H](NC(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)C(=O)N1	ZINC000450615243	FD	On-Demand	Anodyne	S1PR5	24	40
CN1C[C@H](NC(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)C(=O)N1	ZINC000450615244	FD	On-Demand	Anodyne	S1PR4	15	40
CN1C[C@H](NC(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)C(=O)N1	ZINC000450615244	FD	On-Demand	Anodyne	S1PR5	24	40
COC(=O)C1(CN2CC[C@@H](Oc3ccccc3Cl)C2)CC1	ZINC000450615245	DF	On-Demand	Anodyne	SCD1	33	43
COC(=O)C1(CN2CC[C@H](Oc3ccccc3Cl)C2)CC1	ZINC000450615246	DF	On-Demand	Anodyne	SCD1	33	43
COC(=O)[C@](C)(O)CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450615247	FD	On-Demand	Bother	PPXII	0	41
COC(=O)[C@@](C)(O)CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450615248	FD	On-Demand	Bother	PPXII	0	41
CN1C[C@@H](NC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615258	FB	On-Demand	Anodyne	SLC6A1	47	31
CN1C[C@@H](NC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615258	FB	On-Demand	Anodyne	CPT1A	112	38
CN1C[C@@H](NC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615258	FB	On-Demand	Anodyne	CPT2	48	36
CN1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615259	FB	On-Demand	Anodyne	SLC6A1	47	31
CN1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615259	FB	On-Demand	Anodyne	CPT1A	112	38
CN1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615259	FB	On-Demand	Anodyne	CPT2	48	36
CN1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615260	FB	On-Demand	Anodyne	SLC6A1	47	31
CN1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615260	FB	On-Demand	Anodyne	CPT1A	112	38
CN1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615260	FB	On-Demand	Anodyne	CPT2	48	36
CN1C[C@H](NC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615261	FB	On-Demand	Anodyne	SLC6A1	47	31
CN1C[C@H](NC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615261	FB	On-Demand	Anodyne	CPT1A	112	38
CN1C[C@H](NC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)C(=O)N1	ZINC000450615261	FB	On-Demand	Anodyne	CPT2	48	36
COC(=O)[C@](C)(O)CNC(=O)c1cc(Cl)cc(OC)c1	ZINC000450615264	DD	On-Demand	Anodyne	DRD4	43	34
COC(=O)[C@](C)(O)CNC(=O)c1cc(Cl)cc(OC)c1	ZINC000450615264	DD	On-Demand	Anodyne	CACNA1I	57	41
COC(=O)[C@@](C)(O)CNC(=O)c1cc(Cl)cc(OC)c1	ZINC000450615265	DD	On-Demand	Anodyne	DRD4	43	34
COC(=O)[C@@](C)(O)CNC(=O)c1cc(Cl)cc(OC)c1	ZINC000450615265	DD	On-Demand	Anodyne	CACNA1I	57	41
C[C@H](CN1CCN(c2ccc(C(F)(F)F)cc2)CC1)S(C)(=O)=O	ZINC000450615279	FE	On-Demand	Anodyne	SLC6A9	15	44
C[C@@H](CN1CCN(c2ccc(C(F)(F)F)cc2)CC1)S(C)(=O)=O	ZINC000450615280	FE	On-Demand	Anodyne	SLC6A9	15	44
C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450615284	FD	On-Demand	Anodyne	LEF	49	32
C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450615285	FD	On-Demand	Anodyne	LEF	49	32
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450615286	FD	On-Demand	Anodyne	LEF	49	32
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450615287	FD	On-Demand	Anodyne	LEF	49	32
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	CHRM2	21	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	CHRM1	16	49
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	DRD2	19	55
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	DRD4	50	44
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	ACHE	40	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	OPRM1	20	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	DRD3	28	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	OPRD1	26	51
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	OPRK1	18	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	CHRM3	29	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	LTA4H	27	46
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	SIGMAR1	51	55
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	SSTR5	40	34
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	CCR3	33	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	CCR5	77	63
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	SLC18A3	20	42
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	MLNR	58	33
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	MCHR1	35	44
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	MBTPS1	81	39
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	NPFFR1	34	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	NOD2	42	39
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	ADIPOR1	0	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615288	GG	On-Demand	Anodyne	ADIPOR2	0	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	CHRM2	21	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	CHRM1	16	49
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	DRD2	19	55
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	DRD4	50	44
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	ACHE	40	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	OPRM1	20	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	DRD3	28	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	OPRD1	26	51
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	OPRK1	18	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	CHRM3	29	43
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	LTA4H	27	46
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	SIGMAR1	51	55
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	SSTR5	40	34
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	CCR3	33	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	CCR5	77	63
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	SLC18A3	20	42
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	MLNR	58	33
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	MCHR1	35	44
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	MBTPS1	81	39
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	NPFFR1	34	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	NOD2	42	39
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	ADIPOR1	0	40
CCN(C(=O)Cc1ccc(C(=O)OC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615289	GG	On-Demand	Anodyne	ADIPOR2	0	40
CCC[C@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615298	DF	On-Demand	Anodyne	DRD2	0	42
CCC[C@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615298	DF	On-Demand	Anodyne	DRD4	36	40
CCC[C@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615298	DF	On-Demand	Anodyne	ACHE	33	42
CCC[C@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615298	DF	On-Demand	Anodyne	DRD3	29	40
CCC[C@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615298	DF	On-Demand	Anodyne	CCR5	50	48
CCC[C@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615298	DF	On-Demand	Anodyne	MCHR1	25	41
CCC[C@@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615300	DF	On-Demand	Anodyne	DRD2	0	42
CCC[C@@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615300	DF	On-Demand	Anodyne	DRD4	36	40
CCC[C@@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615300	DF	On-Demand	Anodyne	ACHE	33	42
CCC[C@@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615300	DF	On-Demand	Anodyne	DRD3	29	40
CCC[C@@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615300	DF	On-Demand	Anodyne	CCR5	50	48
CCC[C@@H](OC)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615300	DF	On-Demand	Anodyne	MCHR1	25	41
CCC[C@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615302	DF	On-Demand	Anodyne	DRD2	0	42
CCC[C@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615302	DF	On-Demand	Anodyne	DRD4	36	40
CCC[C@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615302	DF	On-Demand	Anodyne	ACHE	33	42
CCC[C@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615302	DF	On-Demand	Anodyne	DRD3	29	40
CCC[C@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615302	DF	On-Demand	Anodyne	CCR5	50	48
CCC[C@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615302	DF	On-Demand	Anodyne	MCHR1	25	41
CCC[C@@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615305	DF	On-Demand	Anodyne	DRD2	0	42
CCC[C@@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615305	DF	On-Demand	Anodyne	DRD4	36	40
CCC[C@@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615305	DF	On-Demand	Anodyne	ACHE	33	42
CCC[C@@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615305	DF	On-Demand	Anodyne	DRD3	29	40
CCC[C@@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615305	DF	On-Demand	Anodyne	CCR5	50	48
CCC[C@@H](OC)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615305	DF	On-Demand	Anodyne	MCHR1	25	41
CC(C)Cc1ccc(CCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450615310	DD	On-Demand	Anodyne	LUXR	40	34
CC(C)Cc1ccc(CCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450615311	DD	On-Demand	Anodyne	LUXR	40	34
Cn1ccc(CCNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)n1	ZINC000450615319	FD	On-Demand	Anodyne	DRD4	41	33
CCOC(=O)c1sc2nc(C)nc(NCc3ccnc(C)c3)c2c1C	ZINC000450615326	FH	On-Demand	Anodyne	CHRM4	21	48
CCc1nc(C)c(COc2cccc([N+](=O)[O-])c2)o1	ZINC000450615354	CG	On-Demand	Bother	CACNA1D	41	32
COc1ccc(Nc2nc(C(=O)N[C@@H]3CN(C)NC3=O)cs2)cc1	ZINC000450615355	EC	On-Demand	Anodyne	TRPC3	57	52
COc1ccc(Nc2nc(C(=O)N[C@H]3CN(C)NC3=O)cs2)cc1	ZINC000450615357	EC	On-Demand	Anodyne	TRPC3	57	52
CN(C[C@H](O)Cc1ccccc1)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450615369	GF	On-Demand	Anodyne	SLC18A2	48	36
CN(C[C@H](O)Cc1ccccc1)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450615369	GF	On-Demand	Anodyne	VACHT_TETCF	0	51
CN(C[C@H](O)Cc1ccccc1)[C@H]1CCCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450615369	GF	On-Demand	Anodyne	SIGMAR1	26	46
CN(C[C@H](O)Cc1ccccc1)[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450615372	GF	On-Demand	Anodyne	SLC18A2	48	36
CN(C[C@H](O)Cc1ccccc1)[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450615372	GF	On-Demand	Anodyne	VACHT_TETCF	0	51
CN(C[C@H](O)Cc1ccccc1)[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450615372	GF	On-Demand	Anodyne	SIGMAR1	26	46
CC(C)c1nnc(COc2ccc(Cl)cc2Cl)s1	ZINC000450615374	DJ	On-Demand	Anodyne	S1PR4	27	43
COc1ccc(NC(=O)Cc2ccc(OC(F)F)c(F)c2)cc1OC(C)C	ZINC000450615382	GI	On-Demand	Anodyne	ENPP1	78	37
COc1ccc(NC(=O)Cc2ccc(OC(F)F)c(F)c2)cc1OC(C)C	ZINC000450615382	GI	On-Demand	Anodyne	DRTS_TRYCR	43	30
CN1C[C@@H](NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)C(=O)N1	ZINC000450615384	EB	On-Demand	Bother	LUXR	17	40
COc1cc(CN2CC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615386	DD	On-Demand	Anodyne	DRD4	33	45
COc1cc(CN2CC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615386	DD	On-Demand	Anodyne	DRD3	24	45
COc1cc(CN2CC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615386	DD	On-Demand	Anodyne	HTR3A	0	41
COc1cc(CN2CC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615386	DD	On-Demand	Anodyne	HTR4	38	41
COc1cc(CN2CC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615386	DD	On-Demand	Anodyne	SSTR5	59	44
COc1cc(CN2CC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615386	DD	On-Demand	Anodyne	CCR1	34	42
COc1cc(CN2CC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615386	DD	On-Demand	Anodyne	CCR3	26	41
COc1cc(CN2CC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615386	DD	On-Demand	Anodyne	UTS2R	35	47
CN1C[C@H](NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)C(=O)N1	ZINC000450615387	EB	On-Demand	Bother	LUXR	17	40
O=C1CC[C@H](CN2CCC(Oc3ccccc3Cl)CC2)CCN1	ZINC000450615388	EG	On-Demand	Anodyne	HRH1	25	43
O=C1CC[C@H](CN2CCC(Oc3ccccc3Cl)CC2)CCN1	ZINC000450615388	EG	On-Demand	Anodyne	CCR3	23	42
O=C1CC[C@H](CN2CCC(Oc3ccccc3Cl)CC2)CCN1	ZINC000450615388	EG	On-Demand	Anodyne	SCD1	27	44
O=C1CC[C@@H](CN2CCC(Oc3ccccc3Cl)CC2)CCN1	ZINC000450615389	EG	On-Demand	Anodyne	HRH1	25	43
O=C1CC[C@@H](CN2CCC(Oc3ccccc3Cl)CC2)CCN1	ZINC000450615389	EG	On-Demand	Anodyne	CCR3	23	42
O=C1CC[C@@H](CN2CCC(Oc3ccccc3Cl)CC2)CCN1	ZINC000450615389	EG	On-Demand	Anodyne	SCD1	27	44
COc1cc(CN2CC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615394	DD	On-Demand	Anodyne	DRD4	33	45
COc1cc(CN2CC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615394	DD	On-Demand	Anodyne	DRD3	24	45
COc1cc(CN2CC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615394	DD	On-Demand	Anodyne	HTR3A	0	41
COc1cc(CN2CC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615394	DD	On-Demand	Anodyne	HTR4	38	41
COc1cc(CN2CC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615394	DD	On-Demand	Anodyne	SSTR5	59	44
COc1cc(CN2CC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615394	DD	On-Demand	Anodyne	CCR1	34	42
COc1cc(CN2CC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615394	DD	On-Demand	Anodyne	CCR3	26	41
COc1cc(CN2CC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450615394	DD	On-Demand	Anodyne	UTS2R	35	47
COc1ccc(NC(=O)c2cc(C#N)[nH]c2C)cc1OC(C)C	ZINC000450615395	DG	On-Demand	Mild	ENPP1	60	35
COc1ccc(NC(=O)c2cc(C#N)[nH]c2C)cc1OC(C)C	ZINC000450615395	DG	On-Demand	Mild	KCNK3	48	41
COc1ccc(NC(=O)c2cc(C#N)[nH]c2C)cc1OC(C)C	ZINC000450615395	DG	On-Demand	Mild	KCNK9	46	41
Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450615407	FD	On-Demand	Anodyne	PPARA	0	52
Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450615411	FD	On-Demand	Anodyne	PPARA	0	52
CN1C[C@@H](NC(=O)[C@H]2COc3ccccc3C2)C(=O)N1	ZINC000450615412	CB	On-Demand	Anodyne	ROCK2	29	44
CN1C[C@H](NC(=O)[C@H]2COc3ccccc3C2)C(=O)N1	ZINC000450615414	CB	On-Demand	Anodyne	ROCK2	29	44
CN1C[C@H](NC(=O)[C@@H]2COc3ccccc3C2)C(=O)N1	ZINC000450615416	CB	On-Demand	Anodyne	ROCK2	29	44
CN1C[C@@H](NC(=O)[C@@H]2COc3ccccc3C2)C(=O)N1	ZINC000450615417	CB	On-Demand	Anodyne	ROCK2	29	44
Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCCC[C@@H]2CCCCO2)CC3)c1	ZINC000450615422	GG	On-Demand	Anodyne	PDE8B	22	41
Cc1cc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])ccn1	ZINC000450615424	EG	On-Demand	Bother	TAAR1	15	41
Clc1cccc(OC[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450615425	BG	On-Demand	Anodyne	CHRNA10	57	47
Clc1cccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450615426	BG	On-Demand	Anodyne	CHRNA10	57	47
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCCC[C@@H]2CCCCO2)CC3)c1	ZINC000450615427	GG	On-Demand	Anodyne	PDE8B	22	41
CCCc1c(NC(=O)c2ccsc2C)cnn1-c1cc(C)ccn1	ZINC000450615428	EI	On-Demand	Anodyne	GPR142	53	39
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCCC[C@H]2CCCCO2)CC3)c1	ZINC000450615429	GG	On-Demand	Anodyne	PDE8B	22	41
Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCCC[C@H]2CCCCO2)CC3)c1	ZINC000450615430	GG	On-Demand	Anodyne	PDE8B	22	41
CC(F)(F)CCOc1ccc([N+](=O)[O-])cc1	ZINC000450615436	BG	On-Demand	Bother	ACR	18	49
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC	ZINC000450615440	FE	On-Demand	Anodyne	CA2	32	47
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC	ZINC000450615440	FE	On-Demand	Anodyne	P2RY12	64	32
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC	ZINC000450615442	FE	On-Demand	Anodyne	CA2	32	47
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC	ZINC000450615442	FE	On-Demand	Anodyne	P2RY12	64	32
CCOc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1C	ZINC000450615444	CC	On-Demand	Anodyne	SSTR5	43	36
CCOc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1C	ZINC000450615446	CC	On-Demand	Anodyne	SSTR5	43	36
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450615471	GH	On-Demand	Anodyne	HRH1	33	41
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450615471	GH	On-Demand	Anodyne	HRH3	0	42
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450615471	GH	On-Demand	Anodyne	ALDH3A1	40	37
CC(F)(F)CCn1cnc2cc(-c3ccc(Cl)cc3)sc2c1=O	ZINC000450615475	FJ	On-Demand	Anodyne	MCHR1	43	51
COc1ccc(NC(=O)c2cn(CC(C)C)nc2C(F)F)cc1OC(C)C	ZINC000450615482	GJ	On-Demand	Anodyne	ENPP1	74	35
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450615484	GH	On-Demand	Anodyne	HRH1	33	41
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450615484	GH	On-Demand	Anodyne	HRH3	0	42
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450615484	GH	On-Demand	Anodyne	ALDH3A1	40	37
CCN(CCC1CC1)C(=O)c1ccnc(OC(F)F)c1	ZINC000450615486	CF	On-Demand	Anodyne	PDE4D	36	45
CC(C)c1nnc(CN2CCC(Oc3ccccc3Cl)CC2)s1	ZINC000450615498	FI	On-Demand	Anodyne	SCN5A	44	34
CC(C)c1nnc(CN2CCC(Oc3ccccc3Cl)CC2)s1	ZINC000450615498	FI	On-Demand	Anodyne	SCD1	54	45
CC(C)c1nnc(CN2CCC(Oc3ccccc3Cl)CC2)s1	ZINC000450615498	FI	On-Demand	Anodyne	SCD	24	42
NC(=O)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450615508	BD	On-Demand	Anodyne	CHEK2	49	43
NC(=O)c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450615510	BD	On-Demand	Anodyne	CHEK2	49	43
c1csc(-c2nc(SC[C@H]3COCCO3)[nH]c2-c2cccs2)c1	ZINC000450615542	FI	On-Demand	Anodyne	SOAT1	21	45
Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)nc2ccccc12	ZINC000450615545	CC	On-Demand	Anodyne	ADAM17	36	40
c1csc(-c2nc(SC[C@@H]3COCCO3)[nH]c2-c2cccs2)c1	ZINC000450615546	FI	On-Demand	Anodyne	SOAT1	21	45
Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)nc2ccccc12	ZINC000450615547	CC	On-Demand	Anodyne	ADAM17	36	40
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450615549	EI	On-Demand	Anodyne	ENPP1	72	34
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450615550	EI	On-Demand	Anodyne	ENPP1	72	34
FC(F)(F)Cn1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)n1	ZINC000450615551	FG	On-Demand	Anodyne	SIGMAR1	15	43
CCCC[C@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC	ZINC000450615552	EE	On-Demand	Anodyne	P2RY12	73	32
CCCC[C@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC	ZINC000450615552	EE	On-Demand	Anodyne	NOD1	40	30
FC(F)(F)Cn1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)n1	ZINC000450615553	FG	On-Demand	Anodyne	SIGMAR1	15	43
CCCC[C@@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC	ZINC000450615555	EE	On-Demand	Anodyne	P2RY12	73	32
CCCC[C@@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC	ZINC000450615555	EE	On-Demand	Anodyne	NOD1	40	30
COc1ccc(C(=O)N[C@@H](C)c2c(C)cccc2C)cc1S(C)(=O)=O	ZINC000450615567	FG	On-Demand	Anodyne	COLA	42	33
COc1ccc(C(=O)N[C@@H](C)c2c(C)cccc2C)cc1S(C)(=O)=O	ZINC000450615567	FG	On-Demand	Anodyne	CPT1A	45	31
COc1ccc(C(=O)N[C@H](C)c2c(C)cccc2C)cc1S(C)(=O)=O	ZINC000450615573	FG	On-Demand	Anodyne	COLA	42	33
COc1ccc(C(=O)N[C@H](C)c2c(C)cccc2C)cc1S(C)(=O)=O	ZINC000450615573	FG	On-Demand	Anodyne	CPT1A	45	31
O=C(NCCC[C@@H]1CCCCO1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450615574	FF	On-Demand	Anodyne	PDE8B	26	45
O=C(NCCC[C@H]1CCCCO1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450615575	FF	On-Demand	Anodyne	PDE8B	26	45
CCCC[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615576	CD	On-Demand	Anodyne	CTSK	48	44
CCCC[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615576	CD	On-Demand	Anodyne	MMP3	17	41
CCCC[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615576	CD	On-Demand	Anodyne	CAPN1	21	41
CCCC[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615576	CD	On-Demand	Anodyne	CAPN2	42	34
CCCC[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615576	CD	On-Demand	Anodyne	ACE2	45	35
O=C(NCCC[C@@H]1CCCCO1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450615577	FF	On-Demand	Anodyne	PDE8B	26	45
O=C(NCCC[C@H]1CCCCO1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450615578	FF	On-Demand	Anodyne	PDE8B	26	45
CCCC[C@@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615579	CD	On-Demand	Anodyne	CTSK	48	44
CCCC[C@@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615579	CD	On-Demand	Anodyne	MMP3	17	41
CCCC[C@@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615579	CD	On-Demand	Anodyne	CAPN1	21	41
CCCC[C@@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615579	CD	On-Demand	Anodyne	CAPN2	42	34
CCCC[C@@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615579	CD	On-Demand	Anodyne	ACE2	45	35
CCCC[C@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615580	CD	On-Demand	Anodyne	CTSK	48	44
CCCC[C@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615580	CD	On-Demand	Anodyne	MMP3	17	41
CCCC[C@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615580	CD	On-Demand	Anodyne	CAPN1	21	41
CCCC[C@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615580	CD	On-Demand	Anodyne	CAPN2	42	34
CCCC[C@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615580	CD	On-Demand	Anodyne	ACE2	45	35
CCCC[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615582	CD	On-Demand	Anodyne	CTSK	48	44
CCCC[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615582	CD	On-Demand	Anodyne	MMP3	17	41
CCCC[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615582	CD	On-Demand	Anodyne	CAPN1	21	41
CCCC[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615582	CD	On-Demand	Anodyne	CAPN2	42	34
CCCC[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC	ZINC000450615582	CD	On-Demand	Anodyne	ACE2	45	35
Cc1cccc(C)c1[C@@H](C)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450615586	CI	On-Demand	Anodyne	SDH1	0	44
Cc1cccc(C)c1[C@H](C)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450615587	CI	On-Demand	Anodyne	SDH1	0	44
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)[C@@H]1OC	ZINC000450615591	DE	On-Demand	Anodyne	GPR88	0	41
COc1cc(OC)c2ncnc(NC[C@H]3CCCCN3CCO)c2c1	ZINC000450615595	ED	On-Demand	Anodyne	PDE6A	44	36
COc1cc(OC)c2ncnc(NC[C@@H]3CCCCN3CCO)c2c1	ZINC000450615596	ED	On-Demand	Anodyne	PDE6A	44	36
COCCNC(=O)c1ccc(NC[C@H](Cc2ccccc2)OC)nc1	ZINC000450615608	EE	On-Demand	Anodyne	GCK	25	46
COCCNC(=O)c1ccc(NC[C@@H](Cc2ccccc2)OC)nc1	ZINC000450615609	EE	On-Demand	Anodyne	GCK	25	46
CC(C)Cn1cc(C(=O)NCc2nc3ccccc3n2C2CC2)c(C(F)F)n1	ZINC000450615610	GI	On-Demand	Anodyne	FPR2	27	40
CN1C[C@H](NC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C(=O)N1	ZINC000450615615	EC	On-Demand	Anodyne	PLG	40	32
CN1C[C@H](NC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C(=O)N1	ZINC000450615615	EC	On-Demand	Anodyne	SSTR3	24	41
CN1C[C@H](NC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C(=O)N1	ZINC000450615615	EC	On-Demand	Anodyne	PHZR	0	42
CN1C[C@@H](NC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C(=O)N1	ZINC000450615617	EC	On-Demand	Anodyne	PLG	40	32
CN1C[C@@H](NC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C(=O)N1	ZINC000450615617	EC	On-Demand	Anodyne	SSTR3	24	41
CN1C[C@@H](NC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)C(=O)N1	ZINC000450615617	EC	On-Demand	Anodyne	PHZR	0	42
CN1C[C@@H](NC(=O)Cc2ccc(O)c(F)c2)C(=O)N1	ZINC000450615622	CB	On-Demand	Anodyne	LUXR	40	38
CN1C[C@H](NC(=O)Cc2ccc(O)c(F)c2)C(=O)N1	ZINC000450615623	CB	On-Demand	Anodyne	LUXR	40	38
Cc1ccccc1-c1nnc(S[C@H](C)C(=O)C2CCCCC2)o1	ZINC000450615624	EJ	On-Demand	Anodyne	ALOX15	0	41
Cc1ccccc1-c1nnc(S[C@@H](C)C(=O)C2CCCCC2)o1	ZINC000450615625	EJ	On-Demand	Anodyne	ALOX15	0	41
CCCc1cc(NC[C@H](Cc2ccccc2)OC)n2ncnc2n1	ZINC000450615666	EF	On-Demand	Anodyne	DHOD	0	47
CCCc1cc(NC[C@@H](Cc2ccccc2)OC)n2ncnc2n1	ZINC000450615668	EF	On-Demand	Anodyne	DHOD	0	47
COC(=O)C1(CN2CCC(C)(c3ccccc3)CC2)CC1	ZINC000450615678	CF	On-Demand	Anodyne	ADRA1D	36	40
COC(=O)C1(CN2CCC(C)(c3ccccc3)CC2)CC1	ZINC000450615678	CF	On-Demand	Anodyne	ADRA1A	32	40
COC(=O)C1(CN2CCC(C)(c3ccccc3)CC2)CC1	ZINC000450615678	CF	On-Demand	Anodyne	ADRA1B	31	40
COC(=O)C1(CN2CCC(C)(c3ccccc3)CC2)CC1	ZINC000450615678	CF	On-Demand	Anodyne	SIGMAR1	27	46
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450615683	EH	On-Demand	Anodyne	SLC1A2	58	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450615685	EH	On-Demand	Anodyne	SLC1A2	58	40
O=C(NCCCN1CCCCC1)C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450615691	GD	On-Demand	Anodyne	TBK1	40	39
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCn2c(O)nnc2C1	ZINC000450615692	DC	On-Demand	Anodyne	P2RX7	36	43
CC(C)(CNc1ccc([N+](=O)[O-])cc1OC(F)F)c1ccccn1	ZINC000450615697	EH	On-Demand	Bother	F2RL3	43	30
CN1C[C@@H](NC(=O)c2ccccc2OC(F)(F)F)C(=O)N1	ZINC000450615704	DC	On-Demand	Anodyne	KCNK3	33	44
CN1C[C@@H](NC(=O)c2ccccc2OC(F)(F)F)C(=O)N1	ZINC000450615704	DC	On-Demand	Anodyne	KCNK9	38	46
CN1C[C@H](NC(=O)c2ccccc2OC(F)(F)F)C(=O)N1	ZINC000450615705	DC	On-Demand	Anodyne	KCNK3	33	44
CN1C[C@H](NC(=O)c2ccccc2OC(F)(F)F)C(=O)N1	ZINC000450615705	DC	On-Demand	Anodyne	KCNK9	38	46
Cc1nc(Cc2nnc(SCc3c(C)cccc3Cl)o2)cs1	ZINC000450615706	FJ	On-Demand	Anodyne	CPB	0	47
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H]1OC	ZINC000450615715	ED	On-Demand	Anodyne	CAPN2	40	33
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H]1OC	ZINC000450615716	ED	On-Demand	Anodyne	CAPN2	40	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H]1OC	ZINC000450615717	ED	On-Demand	Anodyne	CAPN2	40	33
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H]1OC	ZINC000450615718	ED	On-Demand	Anodyne	CAPN2	40	33
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615732	CC	On-Demand	Anodyne	SSTR4	40	31
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615732	CC	On-Demand	Anodyne	XIAP	51	37
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615732	CC	On-Demand	Anodyne	BIRC3	44	33
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615732	CC	On-Demand	Anodyne	BIRC2	49	35
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615732	CC	On-Demand	Anodyne	BIRC8	47	37
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615733	CC	On-Demand	Anodyne	SSTR4	40	31
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615733	CC	On-Demand	Anodyne	XIAP	51	37
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615733	CC	On-Demand	Anodyne	BIRC3	44	33
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615733	CC	On-Demand	Anodyne	BIRC2	49	35
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615733	CC	On-Demand	Anodyne	BIRC8	47	37
CN1C[C@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615734	CC	On-Demand	Anodyne	SSTR4	40	31
CN1C[C@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615734	CC	On-Demand	Anodyne	XIAP	51	37
CN1C[C@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615734	CC	On-Demand	Anodyne	BIRC3	44	33
CN1C[C@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615734	CC	On-Demand	Anodyne	BIRC2	49	35
CN1C[C@H](NC(=O)[C@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615734	CC	On-Demand	Anodyne	BIRC8	47	37
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615735	CC	On-Demand	Anodyne	SSTR4	40	31
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615735	CC	On-Demand	Anodyne	XIAP	51	37
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615735	CC	On-Demand	Anodyne	BIRC3	44	33
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615735	CC	On-Demand	Anodyne	BIRC2	49	35
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)C2CC2)C(=O)N1	ZINC000450615735	CC	On-Demand	Anodyne	BIRC8	47	37
CCN(C(=O)CC[C@H]1CCC(=O)N1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615740	EE	On-Demand	Anodyne	SIGMAR1	41	39
CCN(C(=O)CC[C@H]1CCC(=O)N1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615741	EE	On-Demand	Anodyne	SIGMAR1	41	39
CCN(C(=O)CC[C@@H]1CCC(=O)N1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450615742	EE	On-Demand	Anodyne	SIGMAR1	41	39
CCN(C(=O)CC[C@@H]1CCC(=O)N1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450615743	EE	On-Demand	Anodyne	SIGMAR1	41	39
COC(=O)c1coc(CN2CCN(C3c4ccccc4-c4ccccc43)CC2)n1	ZINC000450615744	GG	On-Demand	Anodyne	INHA	22	40
CO[C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450615745	EG	On-Demand	Bother	BDKRB1	0	41
CO[C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450615746	EG	On-Demand	Bother	BDKRB1	0	41
COCCOC1(CNc2ccc(C(=O)Nc3ccc(C)cc3)cn2)CCOCC1	ZINC000450615747	GG	On-Demand	Anodyne	P4HTM	0	44
CC(C)(CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F)c1ccccn1	ZINC000450615754	FH	On-Demand	Anodyne	PTGS2	26	41
CC(C)(CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F)c1ccccn1	ZINC000450615754	FH	On-Demand	Anodyne	NR1H3	43	38
CC(C)(CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F)c1ccccn1	ZINC000450615754	FH	On-Demand	Anodyne	NR1H2	34	41
CC(C)(CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F)c1ccccn1	ZINC000450615754	FH	On-Demand	Anodyne	SFRP1	66	34
CC(C)(CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F)c1ccccn1	ZINC000450615754	FH	On-Demand	Anodyne	WNT3	43	34
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccn(C)n1	ZINC000450615755	CD	On-Demand	Anodyne	MME	49	37
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccn(C)n1	ZINC000450615755	CD	On-Demand	Anodyne	AMP1_PLAFQ	47	42
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccn(C)n1	ZINC000450615755	CD	On-Demand	Anodyne	GPR142	18	43
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccn(C)n1	ZINC000450615756	CD	On-Demand	Anodyne	MME	49	37
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccn(C)n1	ZINC000450615756	CD	On-Demand	Anodyne	AMP1_PLAFQ	47	42
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccn(C)n1	ZINC000450615756	CD	On-Demand	Anodyne	GPR142	18	43
CCOC(=O)c1ccc(CN2CC[C@H](C)C[C@H](C)C2)nc1	ZINC000450615765	CG	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@@H](C)C[C@H](C)C2)nc1	ZINC000450615766	CG	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](C)C[C@@H](C)C2)nc1	ZINC000450615767	CG	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@@H](C)C[C@@H](C)C2)nc1	ZINC000450615768	CG	On-Demand	Anodyne	SSTR5	42	35
CN1C[C@H](NC(=O)c2cccc(OC3CCCCC3)c2)C(=O)N1	ZINC000450615775	DD	On-Demand	Anodyne	DRD4	40	30
CN1C[C@@H](NC(=O)c2cccc(OC3CCCCC3)c2)C(=O)N1	ZINC000450615776	DD	On-Demand	Anodyne	DRD4	40	30
Cc1cccc(N2CCN(CCC(=O)N[C@H]3CN(C)NC3=O)CC2)c1	ZINC000450615784	EB	On-Demand	Anodyne	HTR1A	45	51
Cc1cccc(N2CCN(CCC(=O)N[C@H]3CN(C)NC3=O)CC2)c1	ZINC000450615784	EB	On-Demand	Anodyne	DRD2	18	51
Cc1cccc(N2CCN(CCC(=O)N[C@H]3CN(C)NC3=O)CC2)c1	ZINC000450615784	EB	On-Demand	Anodyne	HTR2A	27	51
Cc1cccc(N2CCN(CCC(=O)N[C@H]3CN(C)NC3=O)CC2)c1	ZINC000450615784	EB	On-Demand	Anodyne	DRD3	15	46
Cc1cccc(N2CCN(CCC(=O)N[C@H]3CN(C)NC3=O)CC2)c1	ZINC000450615784	EB	On-Demand	Anodyne	HTR7	48	42
Cc1cccc(N2CCN(CCC(=O)N[C@@H]3CN(C)NC3=O)CC2)c1	ZINC000450615785	EB	On-Demand	Anodyne	HTR1A	45	51
Cc1cccc(N2CCN(CCC(=O)N[C@@H]3CN(C)NC3=O)CC2)c1	ZINC000450615785	EB	On-Demand	Anodyne	DRD2	18	51
Cc1cccc(N2CCN(CCC(=O)N[C@@H]3CN(C)NC3=O)CC2)c1	ZINC000450615785	EB	On-Demand	Anodyne	HTR2A	27	51
Cc1cccc(N2CCN(CCC(=O)N[C@@H]3CN(C)NC3=O)CC2)c1	ZINC000450615785	EB	On-Demand	Anodyne	DRD3	15	46
Cc1cccc(N2CCN(CCC(=O)N[C@@H]3CN(C)NC3=O)CC2)c1	ZINC000450615785	EB	On-Demand	Anodyne	HTR7	48	42
COC(=O)c1csc(CN2CCC(CCCN3CCCC3)CC2)n1	ZINC000450615789	FG	On-Demand	Anodyne	NPY1R	44	34
CCOCc1nc(C)c(C(=O)NCCc2ccn(C)n2)s1	ZINC000450615805	DD	On-Demand	Anodyne	SCD1	31	40
CCOCc1nc(C)c(C(=O)NCCc2ccn(C)n2)s1	ZINC000450615805	DD	On-Demand	Anodyne	SCD	25	40
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450615807	DE	On-Demand	Anodyne	SCN9A	0	41
COC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450615807	DE	On-Demand	Anodyne	AMY2	49	33
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450615808	DE	On-Demand	Anodyne	SCN9A	0	41
COC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450615808	DE	On-Demand	Anodyne	AMY2	49	33
C[C@H](c1ccccc1)[C@](C)(O)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450615811	CC	On-Demand	Anodyne	BIRC8	40	31
C[C@H](c1ccccc1)[C@](C)(O)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450615812	CC	On-Demand	Anodyne	BIRC8	40	31
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450615813	CC	On-Demand	Anodyne	BIRC8	40	31
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450615814	CC	On-Demand	Anodyne	BIRC8	40	31
C[C@@H](O)CCN1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450615821	DF	On-Demand	Anodyne	HTR1A	28	49
C[C@@H](O)CCN1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450615821	DF	On-Demand	Anodyne	HTR7	27	46
C[C@H](O)CCN1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450615822	DF	On-Demand	Anodyne	HTR1A	28	49
C[C@H](O)CCN1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450615822	DF	On-Demand	Anodyne	HTR7	27	46
CN1C[C@@H](NC(=O)CCc2cn(C)c3ccccc23)C(=O)N1	ZINC000450615825	DC	On-Demand	Anodyne	PRKCG	42	35
CN1C[C@H](NC(=O)CCc2cn(C)c3ccccc23)C(=O)N1	ZINC000450615826	DC	On-Demand	Anodyne	PRKCG	42	35
COC(=O)[C@](C)(O)CNC(=O)c1cncc(Cl)c1	ZINC000450615830	CC	On-Demand	Anodyne	SCN10A	45	37
COC(=O)[C@@](C)(O)CNC(=O)c1cncc(Cl)c1	ZINC000450615831	CC	On-Demand	Anodyne	SCN10A	45	37
OCCOC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450615832	CE	On-Demand	Anodyne	SLC5A4	60	34
Fc1cc2nccc(NCC3=CCOCC3)c2cc1Br	ZINC000450615836	EH	On-Demand	Anodyne	HRP1_PLAFA	60	32
Fc1cc2nccc(NCC3=CCOCC3)c2cc1Br	ZINC000450615836	EH	On-Demand	Anodyne	HNMT	43	33
OCCOC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450615840	EE	On-Demand	Anodyne	SIGMAR1	43	56
OCCOC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450615840	EE	On-Demand	Anodyne	SCN5A	57	33
CC(=O)c1ccc(CN2CCCC[C@H]2C(=O)OC(C)(C)C)cc1	ZINC000450615843	DH	On-Demand	Anodyne	FKBP1A	45	36
CC(=O)c1ccc(CN2CCCC[C@@H]2C(=O)OC(C)(C)C)cc1	ZINC000450615844	DH	On-Demand	Anodyne	FKBP1A	45	36
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)CO)CC1	ZINC000450615855	CC	On-Demand	Anodyne	ABCB1	47	36
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)CO)CC1	ZINC000450615856	CC	On-Demand	Anodyne	ABCB1	47	36
CCCCN(CCCO)C(=O)Cc1scnc1-c1ccccc1	ZINC000450615860	EG	On-Demand	Anodyne	TSPO	54	50
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	THRA	49	46
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	P2RY12	0	41
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	THRB	25	46
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	KCNQ1	0	41
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	CHEK2	38	42
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	SAT1	0	54
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	PLA2G4B	94	45
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	ACR	64	54
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	S100B	0	54
CC(=O)CCCCCOc1ccc(C(N)=O)cc1	ZINC000450615875	BE	On-Demand	Anodyne	SLC47A1	24	54
CCc1ccc(NC(=O)C[C@@H](O)CC)cc1CC	ZINC000450615891	BF	On-Demand	Anodyne	SLC1A1	55	36
CCc1ccc(NC(=O)C[C@@H](O)CC)cc1CC	ZINC000450615891	BF	On-Demand	Anodyne	SLC1A3	60	36
CCc1ccc(NC(=O)C[C@@H](O)CC)cc1CC	ZINC000450615891	BF	On-Demand	Anodyne	SLC1A2	68	38
CCc1ccc(NC(=O)C[C@H](O)CC)cc1CC	ZINC000450615892	BF	On-Demand	Anodyne	SLC1A1	55	36
CCc1ccc(NC(=O)C[C@H](O)CC)cc1CC	ZINC000450615892	BF	On-Demand	Anodyne	SLC1A3	60	36
CCc1ccc(NC(=O)C[C@H](O)CC)cc1CC	ZINC000450615892	BF	On-Demand	Anodyne	SLC1A2	68	38
COCc1cc(NCCOc2ccc(Cl)c(Cl)c2)n2ncnc2n1	ZINC000450615898	FG	On-Demand	Anodyne	DHOD	0	41
Cc1ccc(C(=O)NC[C@@]2(O)CCN(C)C2)c(Cl)c1Cl	ZINC000450615902	DE	On-Demand	Anodyne	HCN1	50	30
Cc1ccc(C(=O)NC[C@@]2(O)CCN(C)C2)c(Cl)c1Cl	ZINC000450615902	DE	On-Demand	Anodyne	HCN4	47	30
Clc1ccccc1OC1CCN(CCc2cscn2)CC1	ZINC000450615905	DH	On-Demand	Anodyne	SCN9A	0	48
Clc1ccccc1OC1CCN(CCc2cscn2)CC1	ZINC000450615905	DH	On-Demand	Anodyne	SCN5A	39	48
Clc1ccccc1OC1CCN(CCc2cscn2)CC1	ZINC000450615905	DH	On-Demand	Anodyne	SCD1	37	46
Cc1ccc(C(=O)NC[C@]2(O)CCN(C)C2)c(Cl)c1Cl	ZINC000450615912	DE	On-Demand	Anodyne	HCN1	50	30
Cc1ccc(C(=O)NC[C@]2(O)CCN(C)C2)c(Cl)c1Cl	ZINC000450615912	DE	On-Demand	Anodyne	HCN4	47	30
COc1ccc(CNC(=O)CCN2CCN(C(=O)CO)CC2)c(OC)c1	ZINC000450615926	FB	On-Demand	Anodyne	HTR1A	22	42
COc1ccc(CNC(=O)CCN2CCN(C(=O)CO)CC2)c(OC)c1	ZINC000450615926	FB	On-Demand	Anodyne	DRD4	45	34
COc1ccc(CNC(=O)CCN2CCN(C(=O)CO)CC2)c(OC)c1	ZINC000450615926	FB	On-Demand	Anodyne	HTR7	41	48
COc1ccc(CNC(=O)CCN2CCN(C(=O)CO)CC2)c(OC)c1	ZINC000450615926	FB	On-Demand	Anodyne	MTNR1A	56	37
COc1ccc(CNC(=O)CCN2CCN(C(=O)CO)CC2)c(OC)c1	ZINC000450615926	FB	On-Demand	Anodyne	MTNR1B	44	38
O=C(CO)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450615936	CD	On-Demand	Anodyne	GPR183	0	43
CN(CCc1cccc(NC(=O)c2nc3ccccc3nc2C2CC2)c1)C1CC1	ZINC000450615942	GI	On-Demand	Anodyne	KCNK3	44	34
Cc1ccc(Oc2ccc(OCC(=O)N[C@H]3CN(C)NC3=O)cc2)cc1	ZINC000450615943	FD	On-Demand	Anodyne	ADORA2A	0	40
Cc1ccc(Oc2ccc(OCC(=O)N[C@H]3CN(C)NC3=O)cc2)cc1	ZINC000450615943	FD	On-Demand	Anodyne	ADORA2B	44	36
Cc1ccc(Oc2ccc(OCC(=O)N[C@H]3CN(C)NC3=O)cc2)cc1	ZINC000450615943	FD	On-Demand	Anodyne	TRAR	34	41
Cc1ccc(Oc2ccc(OCC(=O)N[C@@H]3CN(C)NC3=O)cc2)cc1	ZINC000450615944	FD	On-Demand	Anodyne	ADORA2A	0	40
Cc1ccc(Oc2ccc(OCC(=O)N[C@@H]3CN(C)NC3=O)cc2)cc1	ZINC000450615944	FD	On-Demand	Anodyne	ADORA2B	44	36
Cc1ccc(Oc2ccc(OCC(=O)N[C@@H]3CN(C)NC3=O)cc2)cc1	ZINC000450615944	FD	On-Demand	Anodyne	TRAR	34	41
CC[C@H](CC#N)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450615947	CG	On-Demand	Mild	SORT1	15	40
CC[C@@H](CC#N)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450615948	CG	On-Demand	Mild	SORT1	15	40
CCCCN(CCCO)C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450615949	GG	On-Demand	Anodyne	TSPO	19	41
COC(=O)C1(NCc2ccccc2OC2CC2)CCCC1	ZINC000450615950	CF	On-Demand	Anodyne	HCN1	50	33
COC(=O)C1(NCc2ccccc2OC2CC2)CCCC1	ZINC000450615950	CF	On-Demand	Anodyne	HCN4	49	33
CCC(CC)Oc1ccc(C(=O)NC[C@]2(O)CCN(C)C2)cc1	ZINC000450615951	DE	On-Demand	Anodyne	HCN1	51	32
CCC(CC)Oc1ccc(C(=O)NC[C@]2(O)CCN(C)C2)cc1	ZINC000450615951	DE	On-Demand	Anodyne	HCN4	49	32
CCC(CC)Oc1ccc(C(=O)NC[C@@]2(O)CCN(C)C2)cc1	ZINC000450615952	DE	On-Demand	Anodyne	HCN1	51	32
CCC(CC)Oc1ccc(C(=O)NC[C@@]2(O)CCN(C)C2)cc1	ZINC000450615952	DE	On-Demand	Anodyne	HCN4	49	32
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615961	EH	On-Demand	Anodyne	HTR1A	19	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615961	EH	On-Demand	Anodyne	HTR2A	15	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615961	EH	On-Demand	Anodyne	CYSLTR2	43	30
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615961	EH	On-Demand	Anodyne	HTR7	19	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615961	EH	On-Demand	Anodyne	CYP2J2	55	39
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615966	EH	On-Demand	Anodyne	HTR1A	19	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615966	EH	On-Demand	Anodyne	HTR2A	15	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615966	EH	On-Demand	Anodyne	CYSLTR2	43	30
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615966	EH	On-Demand	Anodyne	HTR7	19	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450615966	EH	On-Demand	Anodyne	CYP2J2	55	39
CO[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)Cc1ccccc1	ZINC000450615983	GD	On-Demand	Anodyne	NPY1R	46	38
CO[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)Cc1ccccc1	ZINC000450615983	GD	On-Demand	Anodyne	NPY2R	97	42
CO[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)Cc1ccccc1	ZINC000450615983	GD	On-Demand	Anodyne	NPY5R	27	42
CO[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)Cc1ccccc1	ZINC000450615986	GD	On-Demand	Anodyne	NPY1R	46	38
CO[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)Cc1ccccc1	ZINC000450615986	GD	On-Demand	Anodyne	NPY2R	97	42
CO[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)Cc1ccccc1	ZINC000450615986	GD	On-Demand	Anodyne	NPY5R	27	42
Clc1ccccc1OC1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450615991	EI	On-Demand	Anodyne	SCN5A	43	33
Clc1ccccc1OC1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450615991	EI	On-Demand	Anodyne	SCD1	43	46
Clc1ccccc1OC1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450615991	EI	On-Demand	Anodyne	SCD	19	40
Fc1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450615999	BF	On-Demand	Anodyne	LTA4H	0	40
Fc1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450615999	BF	On-Demand	Anodyne	CHRNA10	41	35
Cc1ccccc1C(NC(=O)Cc1cn(C)nc1C)c1ccccc1C	ZINC000450616003	EH	On-Demand	Anodyne	CTSA	53	36
Fc1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450616010	BF	On-Demand	Anodyne	LTA4H	0	40
Fc1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450616010	BF	On-Demand	Anodyne	CHRNA10	41	35
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1	ZINC000450616014	GE	On-Demand	Anodyne	EPHX2	62	47
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1	ZINC000450616016	GE	On-Demand	Anodyne	EPHX2	62	47
COCCCn1c(SCc2nc(C(=O)OC)co2)nc2ccccc2c1=O	ZINC000450616029	GE	On-Demand	Anodyne	PTGDR2	15	40
CCCC[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC	ZINC000450616041	CE	On-Demand	Anodyne	NOD1	53	35
COCCOC[C@H](O)CN1CCc2ccc(C(C)=O)cc2CC1	ZINC000450616047	DD	On-Demand	Anodyne	ABCB1	39	41
COCCOC[C@@H](O)CN1CCc2ccc(C(C)=O)cc2CC1	ZINC000450616048	DD	On-Demand	Anodyne	ABCB1	39	41
CC[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450616049	GG	On-Demand	Anodyne	RORC	53	36
CC[C@H](CC(F)(F)F)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450616051	GG	On-Demand	Anodyne	RORC	53	36
CC[C@@H](C)[C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])OC	ZINC000450616052	CG	On-Demand	Bother	TAAR1	17	47
O=C(CN1CCN(Cc2cnns2)CC1)Nc1ccc(Cl)cc1	ZINC000450616053	FD	On-Demand	Anodyne	CETP	0	41
O=C(CN1CCN(Cc2cnns2)CC1)Nc1ccc(Cl)cc1	ZINC000450616053	FD	On-Demand	Anodyne	IMDH_CRYPV	26	41
CC[C@H](C)[C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])OC	ZINC000450616054	CG	On-Demand	Bother	TAAR1	17	47
CC[C@@H](C)[C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])OC	ZINC000450616055	CG	On-Demand	Bother	TAAR1	17	47
CC[C@H](C)[C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])OC	ZINC000450616057	CG	On-Demand	Bother	TAAR1	17	47
CN(CCCC(=O)c1ccc(F)cc1)CCN1C(=O)c2ccccc2C1=O	ZINC000450616061	FG	On-Demand	Anodyne	DRD2	30	41
CN(CCCC(=O)c1ccc(F)cc1)CCN1C(=O)c2ccccc2C1=O	ZINC000450616061	FG	On-Demand	Anodyne	DRD4	0	41
CN(CCCC(=O)c1ccc(F)cc1)CCN1C(=O)c2ccccc2C1=O	ZINC000450616061	FG	On-Demand	Anodyne	SLC18A3	0	42
CCCC[C@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC	ZINC000450616062	CE	On-Demand	Anodyne	NOD1	53	35
CN1C[C@@H](NC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C(=O)N1	ZINC000450616072	EC	On-Demand	Anodyne	SPHK1	39	40
CN1C[C@H](NC(=O)CCCc2nc(-c3ccc(F)cc3)no2)C(=O)N1	ZINC000450616073	EC	On-Demand	Anodyne	SPHK1	39	40
CCN(CCC1CC1)C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450616078	DG	On-Demand	Anodyne	PFDN6	0	40
CN1C[C@H](NC(=O)CCOc2ccccc2-c2ccccc2)C(=O)N1	ZINC000450616084	ED	On-Demand	Anodyne	HTR7	16	44
CN1C[C@@H](NC(=O)CCOc2ccccc2-c2ccccc2)C(=O)N1	ZINC000450616086	ED	On-Demand	Anodyne	HTR7	16	44
CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616087	FC	On-Demand	Anodyne	OPRD1	65	36
CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616087	FC	On-Demand	Anodyne	CFTR	53	34
CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616087	FC	On-Demand	Anodyne	ADAM9	55	32
CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616093	FC	On-Demand	Anodyne	OPRD1	65	36
CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616093	FC	On-Demand	Anodyne	CFTR	53	34
CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616093	FC	On-Demand	Anodyne	ADAM9	55	32
CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616095	FC	On-Demand	Anodyne	OPRD1	65	36
CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616095	FC	On-Demand	Anodyne	CFTR	53	34
CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616095	FC	On-Demand	Anodyne	ADAM9	55	32
CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616097	FC	On-Demand	Anodyne	OPRD1	65	36
CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616097	FC	On-Demand	Anodyne	CFTR	53	34
CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616097	FC	On-Demand	Anodyne	ADAM9	55	32
Cc1ccc(-n2nc(C)c(CC(=O)N[C@H]3CN(C)NC3=O)c2C)cc1Cl	ZINC000450616098	GD	On-Demand	Anodyne	P2RX7	50	45
Cc1ccc(-n2nc(C)c(CC(=O)N[C@@H]3CN(C)NC3=O)c2C)cc1Cl	ZINC000450616100	GD	On-Demand	Anodyne	P2RX7	50	45
CCCC[C@@H](CC)CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616122	CD	On-Demand	Anodyne	LASR	44	38
CCCC[C@@H](CC)CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450616124	CD	On-Demand	Anodyne	LASR	44	38
CC(C)(CC(=O)COc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450616125	CG	On-Demand	Bother	PLA2G4B	56	37
CC(C)(CC(=O)COc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450616125	CG	On-Demand	Bother	MGLL	0	42
CC(C)(CC(=O)COc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450616125	CG	On-Demand	Bother	SLC27A4	54	36
CC(C)(CC(=O)COc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450616125	CG	On-Demand	Bother	ABHD6	0	42
CCCC[C@H](CC)CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450616126	CD	On-Demand	Anodyne	LASR	44	38
CCCC[C@H](CC)CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616128	CD	On-Demand	Anodyne	LASR	44	38
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616136	FB	On-Demand	Anodyne	MC3R	42	36
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616136	FB	On-Demand	Anodyne	MC5R	56	39
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616136	FB	On-Demand	Anodyne	GRPR	68	34
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616136	FB	On-Demand	Anodyne	GHSR	19	45
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616136	FB	On-Demand	Anodyne	MC1R	53	36
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616136	FB	On-Demand	Anodyne	C5AR1	44	38
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616136	FB	On-Demand	Anodyne	KISS1R	49	34
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616136	FB	On-Demand	Anodyne	NRDE	0	41
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616141	FB	On-Demand	Anodyne	MC3R	42	36
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616141	FB	On-Demand	Anodyne	MC5R	56	39
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616141	FB	On-Demand	Anodyne	GRPR	68	34
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616141	FB	On-Demand	Anodyne	GHSR	19	45
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616141	FB	On-Demand	Anodyne	MC1R	53	36
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616141	FB	On-Demand	Anodyne	C5AR1	44	38
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616141	FB	On-Demand	Anodyne	KISS1R	49	34
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616141	FB	On-Demand	Anodyne	NRDE	0	41
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616143	FB	On-Demand	Anodyne	MC3R	42	36
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616143	FB	On-Demand	Anodyne	MC5R	56	39
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616143	FB	On-Demand	Anodyne	GRPR	68	34
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616143	FB	On-Demand	Anodyne	GHSR	19	45
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616143	FB	On-Demand	Anodyne	MC1R	53	36
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616143	FB	On-Demand	Anodyne	C5AR1	44	38
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616143	FB	On-Demand	Anodyne	KISS1R	49	34
CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616143	FB	On-Demand	Anodyne	NRDE	0	41
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616146	FB	On-Demand	Anodyne	MC3R	42	36
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616146	FB	On-Demand	Anodyne	MC5R	56	39
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616146	FB	On-Demand	Anodyne	GRPR	68	34
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616146	FB	On-Demand	Anodyne	GHSR	19	45
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616146	FB	On-Demand	Anodyne	MC1R	53	36
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616146	FB	On-Demand	Anodyne	C5AR1	44	38
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616146	FB	On-Demand	Anodyne	KISS1R	49	34
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616146	FB	On-Demand	Anodyne	NRDE	0	41
CC(C)c1nnc(CN2CCN(c3ccc(C(F)(F)F)cc3)CC2)s1	ZINC000450616175	FI	On-Demand	Anodyne	DRD4	16	48
COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)N[C@H]2CN(C)NC2=O)CC1	ZINC000450616176	GC	On-Demand	Anodyne	EPHX2	15	40
COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)N[C@@H]2CN(C)NC2=O)CC1	ZINC000450616188	GC	On-Demand	Anodyne	EPHX2	15	40
COC(=O)c1coc(CN2CCC[C@@H](Oc3ccccc3Cl)C2)n1	ZINC000450616190	FG	On-Demand	Anodyne	SCD1	26	40
Clc1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450616191	CF	On-Demand	Anodyne	CHRNA10	28	44
Clc1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450616191	CF	On-Demand	Anodyne	MAL12	0	41
Clc1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450616191	CF	On-Demand	Anodyne	FIMH	23	45
Clc1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450616191	CF	On-Demand	Anodyne	VCP	24	42
COC(=O)c1coc(CN2CCC[C@H](Oc3ccccc3Cl)C2)n1	ZINC000450616192	FG	On-Demand	Anodyne	SCD1	26	40
CCCC[C@H](NC(=O)CSC1CC1)C(=O)OC	ZINC000450616218	CD	On-Demand	Anodyne	NOD1	90	38
CCCC[C@@H](NC(=O)CSC1CC1)C(=O)OC	ZINC000450616219	CD	On-Demand	Anodyne	NOD1	90	38
CNC(=O)CCCN(C)Cc1ccn(CCc2ccccc2)n1	ZINC000450616220	DE	On-Demand	Anodyne	HDAC7	28	40
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	ACE	52	36
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	GRIN1	0	45
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	GRIN2B	55	52
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	GALR1	48	34
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	CCR3	42	40
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	GRIN2C	22	45
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	GRIN3A	0	40
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	BIRC2	50	35
C[C@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616230	EC	On-Demand	Anodyne	BIRC8	52	34
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	ACE	52	36
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	GRIN1	0	45
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	GRIN2B	55	52
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	GALR1	48	34
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	CCR3	42	40
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	GRIN2C	22	45
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	GRIN3A	0	40
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	BIRC2	50	35
C[C@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616235	EC	On-Demand	Anodyne	BIRC8	52	34
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	ACE	52	36
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	GRIN1	0	45
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	GRIN2B	55	52
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	GALR1	48	34
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	CCR3	42	40
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	GRIN2C	22	45
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	GRIN3A	0	40
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	BIRC2	50	35
C[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616237	EC	On-Demand	Anodyne	BIRC8	52	34
CO[C@@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450616238	GF	On-Demand	Bother	BCL2L1	69	36
CO[C@@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450616238	GF	On-Demand	Bother	BCL2	46	34
CO[C@@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450616238	GF	On-Demand	Bother	TAAR1	18	42
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	ACE	52	36
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	GRIN1	0	45
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	GRIN2B	55	52
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	GALR1	48	34
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	CCR3	42	40
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	GRIN2C	22	45
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	GRIN3A	0	40
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	BIRC2	50	35
C[C@@H](C(=O)N[C@H]1CN(C)NC1=O)N1CCC(Cc2ccccc2)CC1	ZINC000450616240	EC	On-Demand	Anodyne	BIRC8	52	34
CO[C@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450616241	GF	On-Demand	Bother	BCL2L1	69	36
CO[C@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450616241	GF	On-Demand	Bother	BCL2	46	34
CO[C@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450616241	GF	On-Demand	Bother	TAAR1	18	42
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	DRD4	33	46
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	ACHE	29	45
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	OPRM1	19	46
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	OPRD1	19	46
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	LTA4H	17	44
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	SIGMAR1	37	41
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	CCR3	37	43
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	CCR5	43	44
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	SLC18A3	19	41
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	MLNR	41	36
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	AKT1	0	55
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	MCHR1	32	40
CCN(C(=O)c1ccc2cnccc2c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616243	FH	On-Demand	Anodyne	MBTPS1	45	33
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	DRD4	33	46
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	ACHE	29	45
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	OPRM1	19	46
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	OPRD1	19	46
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	LTA4H	17	44
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	SIGMAR1	37	41
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	CCR3	37	43
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	CCR5	43	44
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	SLC18A3	19	41
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	MLNR	41	36
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	AKT1	0	55
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	MCHR1	32	40
CCN(C(=O)c1ccc2cnccc2c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616247	FH	On-Demand	Anodyne	MBTPS1	45	33
CC(C)CC(CC(C)C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450616280	DF	On-Demand	Anodyne	EPHX2	26	51
CCOC(=O)c1cc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000450616282	FF	On-Demand	Anodyne	CCR5	37	40
CC(C)CC(CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450616283	DF	On-Demand	Anodyne	EPHX2	26	51
CCOC(=O)c1cc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000450616285	FF	On-Demand	Anodyne	CCR5	37	40
CCN(C(=O)c1cc2n(n1)CCC2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450616291	EF	On-Demand	Anodyne	ACHE	0	49
CCN(C(=O)c1cc2n(n1)CCC2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450616293	EF	On-Demand	Anodyne	ACHE	0	49
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	ACE	41	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	OPRM1	28	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	OPRD1	32	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	PPARA	17	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	F9	43	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	MME	102	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	LTA4H	28	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	ANPEP	97	38
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	FCER2	72	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	CTSB	44	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	PAPA1_CARPA	67	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	CYSP_TRYCR	41	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	CPA1	47	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	TIMP3	72	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	CAPNS1	58	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	MMP3	51	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	HLA-DRB1	48	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	SOAT1	22	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	HDAC2	17	45
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	NPY5R	29	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	CAPN1	62	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	CAPN2	71	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	ACE2	73	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	PLAU	56	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	LAP3	42	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	SLC1A2	24	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	FPR1	49	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	NPR	58	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	AMP1_PLAFQ	40	38
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	ACPS	0	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	PENP_PENJA	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	SLC15A2	0	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	PSMB8	44	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616313	FG	On-Demand	Anodyne	GPR142	46	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	ACE	41	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	OPRM1	28	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	OPRD1	32	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	PPARA	17	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	F9	43	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	MME	102	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	LTA4H	28	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	ANPEP	97	38
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	FCER2	72	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	CTSB	44	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	PAPA1_CARPA	67	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	CYSP_TRYCR	41	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	CPA1	47	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	TIMP3	72	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	CAPNS1	58	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	MMP3	51	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	HLA-DRB1	48	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	SOAT1	22	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	HDAC2	17	45
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	NPY5R	29	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	CAPN1	62	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	CAPN2	71	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	ACE2	73	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	PLAU	56	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	LAP3	42	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	SLC1A2	24	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	FPR1	49	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	NPR	58	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	AMP1_PLAFQ	40	38
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	ACPS	0	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	PENP_PENJA	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	SLC15A2	0	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	PSMB8	44	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616314	FG	On-Demand	Anodyne	GPR142	46	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	ACE	41	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	OPRM1	28	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	OPRD1	32	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	PPARA	17	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	F9	43	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	MME	102	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	LTA4H	28	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	ANPEP	97	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	FCER2	72	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	CTSB	44	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	PAPA1_CARPA	67	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	CYSP_TRYCR	41	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	CPA1	47	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	TIMP3	72	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	CAPNS1	58	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	MMP3	51	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	HLA-DRB1	48	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	SOAT1	22	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	HDAC2	17	45
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	NPY5R	29	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	CAPN1	62	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	CAPN2	71	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	ACE2	73	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	PLAU	56	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	LAP3	42	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	SLC1A2	24	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	FPR1	49	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	POL	0	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	NPR	58	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	AMP1_PLAFQ	40	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	ACPS	0	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	PENP_PENJA	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	SLC15A2	0	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	PSMB8	44	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](Cc2ccccc2)OC)cc1	ZINC000450616315	FG	On-Demand	Anodyne	GPR142	46	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	ACE	41	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	OPRM1	28	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	OPRD1	32	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	PPARA	17	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	F9	43	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	MME	102	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	LTA4H	28	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	ANPEP	97	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	FCER2	72	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	CTSB	44	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	PAPA1_CARPA	67	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	CYSP_TRYCR	41	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	CPA1	47	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	TIMP3	72	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	CAPNS1	58	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	MMP3	51	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	HLA-DRB1	48	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	SOAT1	22	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	HDAC2	17	45
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	NPY5R	29	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	CAPN1	62	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	CAPN2	71	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	ACE2	73	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	PLAU	56	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	LAP3	42	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	SLC1A2	24	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	FPR1	49	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	POL	0	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	NPR	58	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	AMP1_PLAFQ	40	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	ACPS	0	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	PENP_PENJA	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	SLC15A2	0	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	PSMB8	44	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](Cc2ccccc2)OC)cc1	ZINC000450616316	FG	On-Demand	Anodyne	GPR142	46	34
CCc1nc(C)c(CSc2nnc(-c3ccccc3C)o2)o1	ZINC000450616319	DI	On-Demand	Anodyne	ALOX15	47	32
CCc1nc(C)c(CSc2nnc(-c3ccccc3C)o2)o1	ZINC000450616319	DI	On-Demand	Anodyne	TERT	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)CC2CC(F)(F)C2)cc1	ZINC000450616320	EG	On-Demand	Anodyne	TIMP3	42	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CC2CC(F)(F)C2)cc1	ZINC000450616321	EG	On-Demand	Anodyne	TIMP3	42	32
O=C(NCCCN1CCCCC1)C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450616330	GF	On-Demand	Anodyne	TBK1	54	38
C[C@@H](c1cccc(F)c1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450616334	DG	On-Demand	Anodyne	CCR5	43	33
C[C@H](c1cccc(F)c1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450616335	DG	On-Demand	Anodyne	CCR5	43	33
C[C@@H](c1cccc(F)c1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450616336	DG	On-Demand	Anodyne	CCR5	43	33
C[C@H](c1cccc(F)c1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450616337	DG	On-Demand	Anodyne	CCR5	43	33
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450616342	EH	On-Demand	Anodyne	CCR5	19	42
CC(C)Cc1ccc(CC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450616352	CC	On-Demand	Anodyne	LUXR	41	38
CC(C)Cc1ccc(CC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450616354	CC	On-Demand	Anodyne	LUXR	41	38
CC(=O)c1ccc(CN2CCc3c(F)cccc3C2)cc1	ZINC000450616360	CH	On-Demand	Anodyne	DRD4	41	38
CC(=O)c1ccc(CN2CCc3c(F)cccc3C2)cc1	ZINC000450616360	CH	On-Demand	Anodyne	ACHE	16	46
CC(=O)c1ccc(CN2CCc3c(F)cccc3C2)cc1	ZINC000450616360	CH	On-Demand	Anodyne	FABI	54	35
CC(=O)c1ccc(CN2CCc3c(F)cccc3C2)cc1	ZINC000450616360	CH	On-Demand	Anodyne	HDAC6	20	40
CC(=O)c1ccc(CN2CCc3c(F)cccc3C2)cc1	ZINC000450616360	CH	On-Demand	Anodyne	NOD1	37	49
CC(=O)c1ccc(CN2CCc3c(F)cccc3C2)cc1	ZINC000450616360	CH	On-Demand	Anodyne	NOD2	55	48
CCCOc1ccc(C(=O)N2CCn3c(O)nnc3C2)c(OC)c1	ZINC000450616365	ED	On-Demand	Anodyne	P2RX7	30	40
CCS(=O)(=O)c1ccc(CN2CCCC[C@H]2C(=O)OC(C)(C)C)cc1	ZINC000450616381	FG	On-Demand	Anodyne	FKBP1A	53	37
CCS(=O)(=O)c1ccc(CN2CCCC[C@H]2C(=O)OC(C)(C)C)cc1	ZINC000450616381	FG	On-Demand	Anodyne	GPR119	17	40
CCS(=O)(=O)c1ccc(CN2CCCC[C@H]2C(=O)OC(C)(C)C)cc1	ZINC000450616381	FG	On-Demand	Anodyne	WNT3	40	33
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H]2C(=O)OC(C)(C)C)cc1	ZINC000450616382	FG	On-Demand	Anodyne	FKBP1A	53	37
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H]2C(=O)OC(C)(C)C)cc1	ZINC000450616382	FG	On-Demand	Anodyne	GPR119	17	40
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H]2C(=O)OC(C)(C)C)cc1	ZINC000450616382	FG	On-Demand	Anodyne	WNT3	40	33
CC(C)n1ncc2c(C(=O)N[C@H]3CN(C)NC3=O)cc(C3CC3)nc21	ZINC000450616399	EC	On-Demand	Anodyne	EZH2	17	57
OCCN1CCCC[C@@H]1CNc1nc2cccc(F)c2s1	ZINC000450616402	DE	On-Demand	Anodyne	SPHK1	23	40
Cc1ccc(NC(=O)N2CCN(CC[C@H]3CCOC3)CC2)cc1Cl	ZINC000450616403	FG	On-Demand	Anodyne	PYGL	0	45
Cc1ccc(NC(=O)N2CCN(CC[C@H]3CCOC3)CC2)cc1Cl	ZINC000450616403	FG	On-Demand	Anodyne	CCR2	15	56
OCCN1CCCC[C@H]1CNc1nc2cccc(F)c2s1	ZINC000450616404	DE	On-Demand	Anodyne	SPHK1	23	40
CC(C)n1ncc2c(C(=O)N[C@@H]3CN(C)NC3=O)cc(C3CC3)nc21	ZINC000450616406	EC	On-Demand	Anodyne	EZH2	17	57
O=C(NCCC[C@@H]1CCCCO1)c1cccc2c1CCCC2	ZINC000450616407	DH	On-Demand	Anodyne	FABP4	40	34
Cc1ccc(NC(=O)N2CCN(CC[C@@H]3CCOC3)CC2)cc1Cl	ZINC000450616408	FG	On-Demand	Anodyne	PYGL	0	45
Cc1ccc(NC(=O)N2CCN(CC[C@@H]3CCOC3)CC2)cc1Cl	ZINC000450616408	FG	On-Demand	Anodyne	CCR2	15	56
O=C(NCCC[C@H]1CCCCO1)c1cccc2c1CCCC2	ZINC000450616409	DH	On-Demand	Anodyne	FABP4	40	34
C[C@H](c1ccccc1)[C@@H](O)CN1CCO[C@]2(CCc3ccccc32)C1	ZINC000450616431	EG	On-Demand	Anodyne	SIGMAR1	18	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCO[C@@]2(CCc3ccccc32)C1	ZINC000450616433	EG	On-Demand	Anodyne	SIGMAR1	18	44
C[C@H](c1ccccc1)[C@H](O)CN1CCO[C@@]2(CCc3ccccc32)C1	ZINC000450616434	EG	On-Demand	Anodyne	SIGMAR1	18	44
C[C@H](c1ccccc1)[C@H](O)CN1CCO[C@]2(CCc3ccccc32)C1	ZINC000450616435	EG	On-Demand	Anodyne	SIGMAR1	18	44
CCC(=O)C1(C(=O)Nc2ccc(OC)c(OC(C)C)c2)CC1	ZINC000450616440	DG	On-Demand	Anodyne	ENPP1	59	34
COc1ccc(NC(=O)c2coc3c2C(=O)CCC3)cc1OC(C)C	ZINC000450616443	EH	On-Demand	Anodyne	ENPP1	53	29
C[C@@H]1COCCN(CCN(C)Cc2ccccc2)C1	ZINC000450616447	CE	On-Demand	Anodyne	SIGMAR1	24	43
CCS(=O)(=O)c1ccc(CN2CCN([C@@H](C)c3cccc(F)c3)CC2)cc1	ZINC000450616470	GG	On-Demand	Anodyne	RORC	49	33
CCS(=O)(=O)c1ccc(CN2CCN([C@H](C)c3cccc(F)c3)CC2)cc1	ZINC000450616473	GG	On-Demand	Anodyne	RORC	49	33
C[C@H]1COCCN(CCN(C)Cc2ccccc2)C1	ZINC000450616475	CE	On-Demand	Anodyne	SIGMAR1	24	43
COc1ccc(NC(=O)CC[C@H]2CCC(=O)N2)cc1OC(C)C	ZINC000450616478	DE	On-Demand	Anodyne	ENPP1	66	38
COc1ccc(NC(=O)CC[C@@H]2CCC(=O)N2)cc1OC(C)C	ZINC000450616479	DE	On-Demand	Anodyne	ENPP1	66	38
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450616480	FC	On-Demand	Anodyne	PANK1	0	47
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450616480	FC	On-Demand	Anodyne	PANK2	0	41
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450616480	FC	On-Demand	Anodyne	PANK3	0	45
CCc1cccc(C(=O)NC2Cc3ccccc3C2)n1	ZINC000450616490	CF	On-Demand	Anodyne	PDE5A	24	43
CCc1cccc(C(=O)NC2Cc3ccccc3C2)n1	ZINC000450616490	CF	On-Demand	Anodyne	ADAM9	45	31
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616499	FC	On-Demand	Anodyne	PANK1	0	47
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616499	FC	On-Demand	Anodyne	PANK2	0	41
Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616499	FC	On-Demand	Anodyne	PANK3	0	45
COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1OC(C)C	ZINC000450616500	FH	On-Demand	Anodyne	CFTR	17	40
COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1OC(C)C	ZINC000450616500	FH	On-Demand	Anodyne	ALK	15	44
COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1OC(C)C	ZINC000450616500	FH	On-Demand	Anodyne	ENPP1	54	32
COc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1OC(C)C	ZINC000450616500	FH	On-Demand	Anodyne	LIMK2	15	40
COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1OC(C)C	ZINC000450616501	FH	On-Demand	Anodyne	CFTR	17	40
COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1OC(C)C	ZINC000450616501	FH	On-Demand	Anodyne	ALK	15	44
COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1OC(C)C	ZINC000450616501	FH	On-Demand	Anodyne	ENPP1	54	32
COc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1OC(C)C	ZINC000450616501	FH	On-Demand	Anodyne	LIMK2	15	40
O=C(NCCC[C@@H]1CCCCO1)c1ccc2cnccc2c1	ZINC000450616508	CG	On-Demand	Anodyne	AKT1	18	44
O=C(NCCC[C@H]1CCCCO1)c1ccc2cnccc2c1	ZINC000450616515	CG	On-Demand	Anodyne	AKT1	18	44
CC(C)(CNc1ncccc1C(=O)N1CCc2ccccc21)c1ccccn1	ZINC000450616516	FI	On-Demand	Anodyne	AVPR2	53	39
C[C@H](CN1CCC(Oc2ccccc2Cl)CC1)S(C)(=O)=O	ZINC000450616517	EF	On-Demand	Anodyne	HRH1	28	43
C[C@@H](CN1CCC(Oc2ccccc2Cl)CC1)S(C)(=O)=O	ZINC000450616518	EF	On-Demand	Anodyne	HRH1	28	43
CC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450616521	BE	On-Demand	Anodyne	HRH3	15	49
CC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450616521	BE	On-Demand	Anodyne	PLA2G4B	81	40
CC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450616523	BE	On-Demand	Anodyne	HRH3	15	49
CC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450616523	BE	On-Demand	Anodyne	PLA2G4B	81	40
CCN(CCC1CC1)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450616534	DG	On-Demand	Anodyne	PDE4D	15	40
CCN(CCC1CC1)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450616534	DG	On-Demand	Anodyne	PDEC	0	40
CCN(CCC1CC1)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450616536	DG	On-Demand	Anodyne	PDE4D	15	40
CCN(CCC1CC1)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450616536	DG	On-Demand	Anodyne	PDEC	0	40
CN1C[C@@H](NC(=O)c2nnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)C(=O)N1	ZINC000450616544	GD	On-Demand	Anodyne	CCR2	45	36
Cc1cc(CNc2cc(N3CCC[C@H]3CO)ncn2)ccn1	ZINC000450616546	CD	On-Demand	Anodyne	PRCP	16	41
Cc1cc(CNc2cc(N3CCC[C@H]3CO)ncn2)ccn1	ZINC000450616546	CD	On-Demand	Anodyne	CDK1	15	41
CN1C[C@H](NC(=O)c2nnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)C(=O)N1	ZINC000450616549	GD	On-Demand	Anodyne	CCR2	45	36
CC[C@H](CC#N)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450616557	CH	On-Demand	Mild	CTSK	17	41
CC[C@@H](CC#N)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450616558	CH	On-Demand	Mild	CTSK	17	41
COC(=O)c1cn([C@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)C2)nn1	ZINC000450616559	GE	On-Demand	Anodyne	NPBWR1	59	31
Cc1cc(CNc2cc(N3CCC[C@@H]3CO)ncn2)ccn1	ZINC000450616560	CD	On-Demand	Anodyne	PRCP	16	41
Cc1cc(CNc2cc(N3CCC[C@@H]3CO)ncn2)ccn1	ZINC000450616560	CD	On-Demand	Anodyne	CDK1	15	41
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	ANPEP	32	43
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	SSTR4	52	36
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	CTSB	15	42
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	PCSK5	43	34
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	POL	0	41
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	XIAP	47	42
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	BIRC3	47	31
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	BIRC8	42	32
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	BRCA1	43	31
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616569	EB	On-Demand	Anodyne	DERP1	0	42
COC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1Cl	ZINC000450616570	GF	On-Demand	Anodyne	SLC6A1	61	35
COC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1Cl	ZINC000450616570	GF	On-Demand	Anodyne	GLRA1	45	33
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	ANPEP	32	43
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	SSTR4	52	36
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	CTSB	15	42
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	PCSK5	43	34
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	POL	0	41
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	XIAP	47	42
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	BIRC3	47	31
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	BIRC8	42	32
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	BRCA1	43	31
CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616571	EB	On-Demand	Anodyne	DERP1	0	42
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	ANPEP	32	43
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	SSTR4	52	36
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	CTSB	15	42
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	PCSK5	43	34
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	POL	0	41
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	XIAP	47	42
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	BIRC3	47	31
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	BIRC8	42	32
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	BRCA1	43	31
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616573	EB	On-Demand	Anodyne	DERP1	0	42
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	ANPEP	32	43
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	SSTR4	52	36
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	CTSB	15	42
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	PCSK5	43	34
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	POL	0	41
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	XIAP	47	42
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	BIRC3	47	31
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	BIRC8	42	32
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	BRCA1	43	31
CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616574	EB	On-Demand	Anodyne	DERP1	0	42
Cc1ccc(-n2nc(C(=O)N[C@@H]3CN(C)NC3=O)c3c2CCC3)c(F)c1	ZINC000450616588	FC	On-Demand	Anodyne	CNR1	41	36
NS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450616590	CD	On-Demand	Anodyne	DRD4	17	40
NS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450616590	CD	On-Demand	Anodyne	SLC6A1	16	44
NS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450616590	CD	On-Demand	Anodyne	SIGMAR1	23	44
NS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450616590	CD	On-Demand	Anodyne	BIRC2	32	41
Cc1ccc(-n2nc(C(=O)N[C@H]3CN(C)NC3=O)c3c2CCC3)c(F)c1	ZINC000450616592	FC	On-Demand	Anodyne	CNR1	41	36
COC(=O)c1cn([C@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)nn1	ZINC000450616602	GD	On-Demand	Anodyne	FAS	19	41
NS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450616604	CD	On-Demand	Anodyne	DRD4	17	40
NS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450616604	CD	On-Demand	Anodyne	SLC6A1	16	44
NS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450616604	CD	On-Demand	Anodyne	SIGMAR1	23	44
NS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450616604	CD	On-Demand	Anodyne	BIRC2	32	41
COC(=O)c1cn([C@@H]2CCN(C(=O)c3ccn(CCc4ccccc4)n3)C2)nn1	ZINC000450616608	GD	On-Demand	Anodyne	FAS	19	41
FC(F)(F)c1cccc(CNc2ccnc(N3CCOCC3)n2)n1	ZINC000450616629	ED	On-Demand	Anodyne	PIK3CA	15	47
COC(=O)c1csc(CN2CCC[C@@H](COc3ccccc3Cl)C2)n1	ZINC000450616638	GH	On-Demand	Anodyne	SLC6A1	55	35
COC(=O)c1csc(CN2CCC[C@H](COc3ccccc3Cl)C2)n1	ZINC000450616639	GH	On-Demand	Anodyne	SLC6A1	55	35
COC(=O)c1cn([C@@H]2CCN(C(=O)c3ccc(C)c4c3CCC4)C2)nn1	ZINC000450616643	FD	On-Demand	Anodyne	L3MBTL3	62	37
COC(=O)c1cn([C@H]2CCN(C(=O)c3ccc(C)c4c3CCC4)C2)nn1	ZINC000450616645	FD	On-Demand	Anodyne	L3MBTL3	62	37
CC(C)c1nnc(CN2CCO[C@]3(CCc4ccccc43)C2)s1	ZINC000450616646	EG	On-Demand	Anodyne	SIGMAR1	16	45
COCc1cc([N+](=O)[O-])ccc1NCc1nc(C)c(Br)s1	ZINC000450616647	FH	On-Demand	Bother	CACNA1D	48	32
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2C[C@H](C)O)cc1	ZINC000450616655	DE	On-Demand	Anodyne	CASP3	43	34
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2C[C@H](C)O)cc1	ZINC000450616655	DE	On-Demand	Anodyne	CASP7	45	34
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2C[C@@H](C)O)cc1	ZINC000450616656	DE	On-Demand	Anodyne	CASP3	43	34
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2C[C@@H](C)O)cc1	ZINC000450616656	DE	On-Demand	Anodyne	CASP7	45	34
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2C[C@@H](C)O)cc1	ZINC000450616657	DE	On-Demand	Anodyne	CASP3	43	34
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2C[C@@H](C)O)cc1	ZINC000450616657	DE	On-Demand	Anodyne	CASP7	45	34
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2C[C@H](C)O)cc1	ZINC000450616658	DE	On-Demand	Anodyne	CASP3	43	34
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2C[C@H](C)O)cc1	ZINC000450616658	DE	On-Demand	Anodyne	CASP7	45	34
CCC[C@@H](CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450616669	DF	On-Demand	Anodyne	EPHX2	21	50
CCC[C@H](CC(C)C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450616671	DF	On-Demand	Anodyne	EPHX2	21	50
CCC[C@H](CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450616673	DF	On-Demand	Anodyne	EPHX2	21	50
CCC[C@@H](CC(C)C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450616674	DF	On-Demand	Anodyne	EPHX2	21	50
COc1ccc(CNC(=O)CCSc2nc3ccccc3[nH]2)c(OC)c1	ZINC000450616675	FG	On-Demand	Anodyne	CYP2C8	24	42
COc1ccc(CNC(=O)CCSc2nc3ccccc3[nH]2)c(OC)c1	ZINC000450616675	FG	On-Demand	Anodyne	MTNR1A	49	35
COc1ccc(CNC(=O)CCSc2nc3ccccc3[nH]2)c(OC)c1	ZINC000450616675	FG	On-Demand	Anodyne	CYP1A2	22	47
COc1ccc(CNC(=O)CCSc2nc3ccccc3[nH]2)c(OC)c1	ZINC000450616675	FG	On-Demand	Anodyne	CYP2C19	38	44
COc1ccc(CNC(=O)CCSc2nc3ccccc3[nH]2)c(OC)c1	ZINC000450616675	FG	On-Demand	Anodyne	ENPP1	59	37
COc1ccc(CNC(=O)CCSc2nc3ccccc3[nH]2)c(OC)c1	ZINC000450616675	FG	On-Demand	Anodyne	TNKS	47	33
COc1ccc(CNC(=O)CCSc2nc3ccccc3[nH]2)c(OC)c1	ZINC000450616675	FG	On-Demand	Anodyne	FABK	0	42
Cc1cnc(CCCC(=O)Nc2cc(F)c(Br)c(F)c2)o1	ZINC000450616678	FH	On-Demand	Anodyne	HDAC3	15	42
CN1C[C@H](NC(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)C(=O)N1	ZINC000450616684	EC	On-Demand	Anodyne	HDAC8	0	45
CN1C[C@@H](NC(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)C(=O)N1	ZINC000450616685	EC	On-Demand	Anodyne	HDAC8	0	45
CN1C[C@H](NC(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)C(=O)N1	ZINC000450616687	EC	On-Demand	Anodyne	HDAC8	0	45
CN1C[C@@H](NC(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)C(=O)N1	ZINC000450616690	EC	On-Demand	Anodyne	HDAC8	0	45
COC(=O)c1cc(NC(=O)Cc2cn(C)nc2C)ccc1Br	ZINC000450616693	FE	On-Demand	Anodyne	ENPP1	64	32
COC(=O)c1cc(NC(=O)Cc2cn(C)nc2C)ccc1Br	ZINC000450616693	FE	On-Demand	Anodyne	IMDH_CRYPV	26	42
CC1=CCN(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC000450616694	DF	On-Demand	Anodyne	PLD1	27	40
CC1=CCN(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC000450616694	DF	On-Demand	Anodyne	PLD2	51	40
CC1=CCN(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC000450616694	DF	On-Demand	Anodyne	SIRT3	40	32
CC1=CCN(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC000450616694	DF	On-Demand	Anodyne	SIRT2	48	38
CC1=CCN(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC000450616694	DF	On-Demand	Anodyne	SIRT1	40	32
Cc1nn(C)c(C)c1CCCNC(=O)Cc1cc2ccccc2s1	ZINC000450616722	EH	On-Demand	Anodyne	P2RX7	39	43
COC(=O)c1coc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)n1	ZINC000450616743	GD	On-Demand	Anodyne	CETP	23	41
CCCC[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C(=O)OC	ZINC000450616749	EF	On-Demand	Anodyne	CTSK	62	38
CCCC[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C(=O)OC	ZINC000450616749	EF	On-Demand	Anodyne	AGER	0	45
CCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C(=O)OC	ZINC000450616750	EF	On-Demand	Anodyne	CTSK	62	38
CCCC[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C(=O)OC	ZINC000450616750	EF	On-Demand	Anodyne	AGER	0	45
CCN(Cc1ccccc1)c1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450616760	FD	On-Demand	Anodyne	NAMPT	48	33
CCN(Cc1ccccc1)c1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450616761	FD	On-Demand	Anodyne	NAMPT	48	33
CCN(CCC1CC1)C(=O)c1cc(OC)c(OC)cc1Br	ZINC000450616762	FH	On-Demand	Anodyne	ACKR3	44	31
CN1C[C@H](NC(=O)CCOc2ccc(F)cc2Cl)C(=O)N1	ZINC000450616763	DC	On-Demand	Anodyne	P2RX7	34	40
CC(=O)N1CC[C@@H](CN(C)CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450616764	GG	On-Demand	Anodyne	LSS	23	46
CC(=O)N1CC[C@H](CN(C)CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450616765	GG	On-Demand	Anodyne	LSS	23	46
CC(=O)c1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450616766	BF	On-Demand	Anodyne	SHC	23	40
CC(=O)c1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450616767	BF	On-Demand	Anodyne	SHC	23	40
CN1C[C@@H](NC(=O)CCOc2ccc(F)cc2Cl)C(=O)N1	ZINC000450616769	DC	On-Demand	Anodyne	P2RX7	34	40
CCS(=O)(=O)c1ccc(CN(C)Cc2cccc(OC(C)C)c2)cc1	ZINC000450616783	FH	On-Demand	Anodyne	ACHE	0	40
CC(C)c1nnc(CN2CCO[C@@]3(CCc4ccccc43)C2)s1	ZINC000450616798	EG	On-Demand	Anodyne	SIGMAR1	16	45
COc1ccc(NC(=O)c2c(C3CC3)noc2C)cc1OC(C)C	ZINC000450616809	EH	On-Demand	Anodyne	ENPP1	67	32
CCc1cc(NCCOc2ccc(F)c(Cl)c2)n2ncnc2n1	ZINC000450616811	EF	On-Demand	Anodyne	DHOD	0	49
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616829	GG	On-Demand	Mild	DRD2	31	46
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616829	GG	On-Demand	Mild	DRD1	15	46
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616829	GG	On-Demand	Mild	DRD4	0	48
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616829	GG	On-Demand	Mild	HTR2A	17	46
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616829	GG	On-Demand	Mild	ERG2	20	42
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616829	GG	On-Demand	Mild	HTR7	25	46
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616829	GG	On-Demand	Mild	SLC18A3	0	50
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616829	GG	On-Demand	Mild	CYP2J2	51	36
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616830	GG	On-Demand	Mild	DRD2	31	46
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616830	GG	On-Demand	Mild	DRD1	15	46
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616830	GG	On-Demand	Mild	DRD4	0	48
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616830	GG	On-Demand	Mild	HTR2A	17	46
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616830	GG	On-Demand	Mild	ERG2	20	42
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616830	GG	On-Demand	Mild	HTR7	25	46
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616830	GG	On-Demand	Mild	SLC18A3	0	50
N#C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616830	GG	On-Demand	Mild	CYP2J2	51	36
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616831	GG	On-Demand	Mild	DRD2	31	46
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616831	GG	On-Demand	Mild	DRD1	15	46
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616831	GG	On-Demand	Mild	DRD4	0	48
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616831	GG	On-Demand	Mild	HTR2A	17	46
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616831	GG	On-Demand	Mild	ERG2	20	42
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616831	GG	On-Demand	Mild	HTR7	25	46
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616831	GG	On-Demand	Mild	SLC18A3	0	50
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450616831	GG	On-Demand	Mild	CYP2J2	51	36
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616832	GG	On-Demand	Mild	DRD2	31	46
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616832	GG	On-Demand	Mild	DRD1	15	46
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616832	GG	On-Demand	Mild	DRD4	0	48
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616832	GG	On-Demand	Mild	HTR2A	17	46
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616832	GG	On-Demand	Mild	ERG2	20	42
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616832	GG	On-Demand	Mild	HTR7	25	46
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616832	GG	On-Demand	Mild	SLC18A3	0	50
N#C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450616832	GG	On-Demand	Mild	CYP2J2	51	36
O=C(NCCC[C@H]1CCCCO1)c1cn(CC2CC2)nn1	ZINC000450616835	CD	On-Demand	Anodyne	PDE8B	46	35
O=C(NCCC[C@@H]1CCCCO1)c1cn(CC2CC2)nn1	ZINC000450616838	CD	On-Demand	Anodyne	PDE8B	46	35
CN1C[C@H](NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)C(=O)N1	ZINC000450616840	GD	On-Demand	Anodyne	EPHX2	28	46
CN1C[C@H](NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)C(=O)N1	ZINC000450616840	GD	On-Demand	Anodyne	SFRP1	18	40
CN1C[C@H](NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)C(=O)N1	ZINC000450616840	GD	On-Demand	Anodyne	L3MBTL3	72	37
CN1C[C@@H](NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)C(=O)N1	ZINC000450616841	GD	On-Demand	Anodyne	EPHX2	28	46
CN1C[C@@H](NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)C(=O)N1	ZINC000450616841	GD	On-Demand	Anodyne	SFRP1	18	40
CN1C[C@@H](NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)C(=O)N1	ZINC000450616841	GD	On-Demand	Anodyne	L3MBTL3	72	37
CCCCCn1c(=O)c2ccccc2n2c(SCCC(C)(F)F)nnc12	ZINC000450616850	GI	On-Demand	Anodyne	RORB	0	40
O=C(NCCC[C@H]1CCCCO1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450616854	GI	On-Demand	Anodyne	PYGL	53	46
O=C(NCCC[C@H]1CCCCO1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450616854	GI	On-Demand	Anodyne	PLD2	43	33
O=C(NCCC[C@@H]1CCCCO1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450616855	GI	On-Demand	Anodyne	PYGL	53	46
O=C(NCCC[C@@H]1CCCCO1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450616855	GI	On-Demand	Anodyne	PLD2	43	33
Cc1nc([C@H](C)Sc2nc3ccccc3c(=O)n2CCCO)no1	ZINC000450616889	EE	On-Demand	Anodyne	SLC16A1	47	34
COc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1S(=O)(=O)NC(C)(C)C	ZINC000450616897	GB	On-Demand	Anodyne	COLA	54	36
COc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1S(=O)(=O)NC(C)(C)C	ZINC000450616897	GB	On-Demand	Anodyne	CPT1A	51	36
Cc1nc([C@@H](C)Sc2nc3ccccc3c(=O)n2CCCO)no1	ZINC000450616898	EE	On-Demand	Anodyne	SLC16A1	47	34
COc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1S(=O)(=O)NC(C)(C)C	ZINC000450616903	GB	On-Demand	Anodyne	COLA	54	36
COc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1S(=O)(=O)NC(C)(C)C	ZINC000450616903	GB	On-Demand	Anodyne	CPT1A	51	36
OCCCN1CCC[C@H](Nc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450616904	FE	On-Demand	Anodyne	DHOD	0	42
OCCCN1CCC[C@@H](Nc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450616906	FE	On-Demand	Anodyne	DHOD	0	42
CC(C)(CNc1ncc(C(N)=O)cc1Cl)c1ccccn1	ZINC000450616923	DF	On-Demand	Anodyne	F2	0	42
CCc1cc(CCCN2CCC(Oc3ccccc3Cl)CC2)on1	ZINC000450616947	EI	On-Demand	Anodyne	HTR4	17	42
CCc1cc(CCCN2CCC(Oc3ccccc3Cl)CC2)on1	ZINC000450616947	EI	On-Demand	Anodyne	SCD1	38	43
C[C@@H](NS(=O)(=O)c1ccccc1C(F)(F)F)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616950	GB	On-Demand	Anodyne	RBP4	59	36
C[C@@H](NS(=O)(=O)c1ccccc1C(F)(F)F)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616953	GB	On-Demand	Anodyne	RBP4	59	36
C[C@H](NS(=O)(=O)c1ccccc1C(F)(F)F)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616955	GB	On-Demand	Anodyne	RBP4	59	36
C[C@H](NS(=O)(=O)c1ccccc1C(F)(F)F)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616958	GB	On-Demand	Anodyne	RBP4	59	36
CCOC(=O)c1cc(C(=O)NCc2nc3ccccc3n2C2CC2)[nH]c1C	ZINC000450616961	FG	On-Demand	Anodyne	PLD1	51	35
CCOC(=O)c1cc(C(=O)NCc2nc3ccccc3n2C2CC2)[nH]c1C	ZINC000450616961	FG	On-Demand	Anodyne	PLD2	41	35
CCOC(=O)c1cc(C(=O)NCc2nc3ccccc3n2C2CC2)[nH]c1C	ZINC000450616961	FG	On-Demand	Anodyne	FPR2	30	43
CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616964	DB	On-Demand	Anodyne	ELANE	23	40
CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616964	DB	On-Demand	Anodyne	CCR1	26	44
CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616964	DB	On-Demand	Anodyne	BIRC8	42	32
CC(C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616965	DB	On-Demand	Anodyne	ELANE	23	40
CC(C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616965	DB	On-Demand	Anodyne	CCR1	26	44
CC(C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450616965	DB	On-Demand	Anodyne	BIRC8	42	32
CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616967	DB	On-Demand	Anodyne	ELANE	23	40
CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616967	DB	On-Demand	Anodyne	CCR1	26	44
CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616967	DB	On-Demand	Anodyne	BIRC8	42	32
CN1C[C@H](NC(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)C(=O)N1	ZINC000450616968	DD	On-Demand	Anodyne	PYGL	33	47
CN1C[C@H](NC(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)C(=O)N1	ZINC000450616968	DD	On-Demand	Anodyne	PYGM	43	47
CC(C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616969	DB	On-Demand	Anodyne	ELANE	23	40
CC(C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616969	DB	On-Demand	Anodyne	CCR1	26	44
CC(C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450616969	DB	On-Demand	Anodyne	BIRC8	42	32
CN1C[C@@H](NC(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)C(=O)N1	ZINC000450616970	DD	On-Demand	Anodyne	PYGL	33	47
CN1C[C@@H](NC(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)C(=O)N1	ZINC000450616970	DD	On-Demand	Anodyne	PYGM	43	47
CCCOc1ccc(C(=O)NCCN2CC=C(C)CC2)c(OC)c1	ZINC000450616976	EF	On-Demand	Anodyne	DRD4	45	36
CCCOc1ccc(C(=O)NCCN2CC=C(C)CC2)c(OC)c1	ZINC000450616976	EF	On-Demand	Anodyne	DRD3	0	45
Cc1cc(C)c(S(=O)(=O)N2CCC[C@H]2C(=O)N[C@@H]2CN(C)NC2=O)c(C)c1	ZINC000450616987	GC	On-Demand	Anodyne	EPHX2	31	44
Cc1cc(C)c(S(=O)(=O)N2CCC[C@H]2C(=O)N[C@H]2CN(C)NC2=O)c(C)c1	ZINC000450616991	GC	On-Demand	Anodyne	EPHX2	31	44
Cc1cc(C)c(S(=O)(=O)N2CCC[C@@H]2C(=O)N[C@@H]2CN(C)NC2=O)c(C)c1	ZINC000450616992	GC	On-Demand	Anodyne	EPHX2	31	44
Cc1cc(C)c(S(=O)(=O)N2CCC[C@@H]2C(=O)N[C@H]2CN(C)NC2=O)c(C)c1	ZINC000450616993	GC	On-Demand	Anodyne	EPHX2	31	44
CCN(CCC1CC1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450616997	CF	On-Demand	Anodyne	AMY2	57	34
CCN(CCC1CC1)C(=O)[C@H](Cc1ccccc1)OC	ZINC000450616997	CF	On-Demand	Anodyne	F11	45	35
CCN(CCC1CC1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450616999	CF	On-Demand	Anodyne	AMY2	57	34
CCN(CCC1CC1)C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450616999	CF	On-Demand	Anodyne	F11	45	35
CCC(=O)C1(C(=O)N2CC=C(c3cccc(Br)c3)CC2)CC1	ZINC000450617016	FH	On-Demand	Anodyne	ADAM10	33	41
CCN(CCC1CC1)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450617017	CH	On-Demand	Anodyne	OPRK1	27	42
CCN(CCC1CC1)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450617017	CH	On-Demand	Anodyne	HTR4	23	40
CC(C)(CNc1ncccc1C(F)(F)F)c1ccccn1	ZINC000450617052	CH	On-Demand	Anodyne	F2	15	41
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617067	FC	On-Demand	Anodyne	HCN1	47	36
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617067	FC	On-Demand	Anodyne	HCN4	47	36
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617071	FC	On-Demand	Anodyne	HCN1	47	36
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617071	FC	On-Demand	Anodyne	HCN4	47	36
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617072	FC	On-Demand	Anodyne	HCN1	47	36
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617072	FC	On-Demand	Anodyne	HCN4	47	36
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617073	FC	On-Demand	Anodyne	HCN1	47	36
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617073	FC	On-Demand	Anodyne	HCN4	47	36
COc1cccc(OCCC(=O)Nc2cccc(CCN(C)C3CC3)c2)c1	ZINC000450617084	FH	On-Demand	Anodyne	HRH2	26	42
COc1cccc(OCCC(=O)Nc2cccc(CCN(C)C3CC3)c2)c1	ZINC000450617084	FH	On-Demand	Anodyne	LTA4H	16	42
COc1cccc(OCCC(=O)Nc2cccc(CCN(C)C3CC3)c2)c1	ZINC000450617084	FH	On-Demand	Anodyne	MTNR1A	40	44
O=C(c1ccc(O)nc1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450617085	EE	On-Demand	Anodyne	KCNJ1	51	37
CCOc1ccc2nc(SCC[C@H]3CCOC3)[nH]c2c1	ZINC000450617086	CG	On-Demand	Anodyne	CYP2C19	38	48
CCOc1ccc2nc(SCC[C@@H]3CCOC3)[nH]c2c1	ZINC000450617087	CG	On-Demand	Anodyne	CYP2C19	38	48
CCCC[C@@H](NC(=O)c1coc(-c2ccnc(C)c2)n1)C(=O)OC	ZINC000450617093	EF	On-Demand	Anodyne	P2RY12	111	34
CCCC[C@H](NC(=O)c1coc(-c2ccnc(C)c2)n1)C(=O)OC	ZINC000450617098	EF	On-Demand	Anodyne	P2RY12	111	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450617113	EG	On-Demand	Anodyne	LTA4H	24	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450617114	EG	On-Demand	Anodyne	LTA4H	24	40
COC(=O)c1ccc(CN2CC=C(C)CC2)cc1Cl	ZINC000450617121	CG	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1coc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)n1	ZINC000450617122	GD	On-Demand	Anodyne	SLC27A1	44	37
CCSc1cccnc1C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450617149	FH	On-Demand	Anodyne	TIMP3	53	30
CCSc1cccnc1C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450617149	FH	On-Demand	Anodyne	PLAU	43	33
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	HTR1A	19	48
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	DRD2	23	45
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	DRD4	51	41
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	DRD3	42	45
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	COLA	61	36
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	CPT1A	59	35
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	CPT2	44	35
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	PLD2	52	38
COc1ccc(C(=O)NCCN2CC=C(C)CC2)cc1S(C)(=O)=O	ZINC000450617152	FD	On-Demand	Anodyne	CPT1B	40	35
CCSc1cccnc1C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450617164	FH	On-Demand	Anodyne	TIMP3	53	30
CCSc1cccnc1C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450617164	FH	On-Demand	Anodyne	PLAU	43	33
Cc1ccccc1-c1nnc(SC[C@H]2CCCC2(F)F)o1	ZINC000450617174	DJ	On-Demand	Anodyne	ALOX15	45	37
CCCC[C@@H](NC(=O)Cc1cn(C)nc1C)C(=O)OC	ZINC000450617179	CD	On-Demand	Anodyne	NOD1	62	36
Cc1ccccc1-c1nnc(SC[C@@H]2CCCC2(F)F)o1	ZINC000450617180	DJ	On-Demand	Anodyne	ALOX15	45	37
CCCC[C@H](NC(=O)Cc1cn(C)nc1C)C(=O)OC	ZINC000450617186	CD	On-Demand	Anodyne	NOD1	62	36
COc1cc(CN2CC[C@H](C3CCOCC3)C2)ccc1Cl	ZINC000450617204	DH	On-Demand	Anodyne	DRD4	30	48
COc1cc(CN2CC[C@H](C3CCOCC3)C2)ccc1Cl	ZINC000450617204	DH	On-Demand	Anodyne	SIGMAR1	15	41
COc1cc(CN2CC[C@H](C3CCOCC3)C2)ccc1Cl	ZINC000450617204	DH	On-Demand	Anodyne	SSTR5	59	40
COc1cc(CN2CC[C@@H](C3CCOCC3)C2)ccc1Cl	ZINC000450617205	DH	On-Demand	Anodyne	DRD4	30	48
COc1cc(CN2CC[C@@H](C3CCOCC3)C2)ccc1Cl	ZINC000450617205	DH	On-Demand	Anodyne	SIGMAR1	15	41
COc1cc(CN2CC[C@@H](C3CCOCC3)C2)ccc1Cl	ZINC000450617205	DH	On-Demand	Anodyne	SSTR5	59	40
Clc1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450617206	CF	On-Demand	Anodyne	MAL12	0	43
CC1(CO)CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450617211	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Clc1ccc(CCN2CC[C@H](C3CCOCC3)C2)cc1	ZINC000450617219	CH	On-Demand	Anodyne	DRD4	15	40
Clc1ccc(CCN2CC[C@H](C3CCOCC3)C2)cc1	ZINC000450617219	CH	On-Demand	Anodyne	SIGMAR1	23	44
Clc1ccc(CCN2CC[C@H](C3CCOCC3)C2)cc1	ZINC000450617219	CH	On-Demand	Anodyne	L3MBTL3	27	40
Clc1ccc(CCN2CC[C@@H](C3CCOCC3)C2)cc1	ZINC000450617221	CH	On-Demand	Anodyne	DRD4	15	40
Clc1ccc(CCN2CC[C@@H](C3CCOCC3)C2)cc1	ZINC000450617221	CH	On-Demand	Anodyne	SIGMAR1	23	44
Clc1ccc(CCN2CC[C@@H](C3CCOCC3)C2)cc1	ZINC000450617221	CH	On-Demand	Anodyne	L3MBTL3	27	40
COc1cc(Br)c(C(=O)NCCN2CC=C(C)CC2)cc1OC	ZINC000450617222	GF	On-Demand	Anodyne	HTR1A	17	41
COc1cc(Br)c(C(=O)NCCN2CC=C(C)CC2)cc1OC	ZINC000450617222	GF	On-Demand	Anodyne	DRD2	33	50
COc1cc(Br)c(C(=O)NCCN2CC=C(C)CC2)cc1OC	ZINC000450617222	GF	On-Demand	Anodyne	DRD4	44	35
COc1cc(Br)c(C(=O)NCCN2CC=C(C)CC2)cc1OC	ZINC000450617222	GF	On-Demand	Anodyne	DRD3	47	52
COc1cc(Br)c(C(=O)NCCN2CC=C(C)CC2)cc1OC	ZINC000450617222	GF	On-Demand	Anodyne	HTR4	38	46
FC1(F)CCCC[C@@H]1CSc1nnnn1-c1ccccc1	ZINC000450617241	DH	On-Demand	Anodyne	CELA2A	29	42
FC1(F)CCCC[C@H]1CSc1nnnn1-c1ccccc1	ZINC000450617242	DH	On-Demand	Anodyne	CELA2A	29	42
Cc1cc(CNc2cc(N3CCCCC3)ncn2)ccn1	ZINC000450617246	CF	On-Demand	Anodyne	HRH4	20	59
Cc1cc(CNc2cc(N3CCCC3)ncn2)ccn1	ZINC000450617267	CE	On-Demand	Anodyne	HRH4	20	60
C[C@H]1CCC(=O)[C@@H](Sc2nnnn2-c2ccccc2)C1	ZINC000450617268	CF	On-Demand	Anodyne	CELA2A	29	42
C[C@H]1CCC(=O)[C@@H](Sc2nnnn2-c2ccccc2)C1	ZINC000450617268	CF	On-Demand	Anodyne	EP300	0	40
C[C@H]1CCC(=O)[C@H](Sc2nnnn2-c2ccccc2)C1	ZINC000450617269	CF	On-Demand	Anodyne	CELA2A	29	42
C[C@H]1CCC(=O)[C@H](Sc2nnnn2-c2ccccc2)C1	ZINC000450617269	CF	On-Demand	Anodyne	EP300	0	40
C[C@@H]1CCC(=O)[C@@H](Sc2nnnn2-c2ccccc2)C1	ZINC000450617270	CF	On-Demand	Anodyne	CELA2A	29	42
C[C@@H]1CCC(=O)[C@@H](Sc2nnnn2-c2ccccc2)C1	ZINC000450617270	CF	On-Demand	Anodyne	EP300	0	40
C[C@@H]1CCC(=O)[C@H](Sc2nnnn2-c2ccccc2)C1	ZINC000450617271	CF	On-Demand	Anodyne	CELA2A	29	42
C[C@@H]1CCC(=O)[C@H](Sc2nnnn2-c2ccccc2)C1	ZINC000450617271	CF	On-Demand	Anodyne	EP300	0	40
Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450617274	GF	On-Demand	Bother	CACNA1C	48	35
Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450617274	GF	On-Demand	Bother	CACNA1D	80	35
Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450617275	GF	On-Demand	Bother	CACNA1C	48	35
Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450617275	GF	On-Demand	Bother	CACNA1D	80	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCOC[C@@H]1CC(=O)c1ccccc1	ZINC000450617290	FG	On-Demand	Anodyne	Q8WSF8_APLCA	15	47
C[C@H](c1ccccc1)[C@H](O)CN1CCOC[C@H]1CC(=O)c1ccccc1	ZINC000450617291	FG	On-Demand	Anodyne	Q8WSF8_APLCA	15	47
C[C@H](c1ccccc1)[C@H](O)CN1CCOC[C@@H]1CC(=O)c1ccccc1	ZINC000450617292	FG	On-Demand	Anodyne	Q8WSF8_APLCA	15	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCOC[C@H]1CC(=O)c1ccccc1	ZINC000450617293	FG	On-Demand	Anodyne	Q8WSF8_APLCA	15	47
COc1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450617296	CE	On-Demand	Anodyne	FIMH	19	41
O=C1CCC(CN2CCC(Oc3ccccc3Cl)CC2)CC1	ZINC000450617302	DH	On-Demand	Anodyne	HRH1	25	46
O=C1CCC(CN2CCC(Oc3ccccc3Cl)CC2)CC1	ZINC000450617302	DH	On-Demand	Anodyne	CCR3	28	46
O=C1CCC(CN2CCC(Oc3ccccc3Cl)CC2)CC1	ZINC000450617302	DH	On-Demand	Anodyne	SCD1	35	44
O=C1CCC(CN2CCC(Oc3ccccc3Cl)CC2)CC1	ZINC000450617302	DH	On-Demand	Anodyne	SCD	16	43
CC(=O)CCCCCN1C(=O)C(=O)N(C(C)C)C1=O	ZINC000450617303	CD	On-Demand	Anodyne	PAOX	40	41
CCC[C@@H](CC(C)C)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	ZINC000450617304	FI	On-Demand	Anodyne	MMP3	16	41
CCC[C@H](CC(C)C)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	ZINC000450617305	FI	On-Demand	Anodyne	MMP3	16	41
COC[C@@]1(C(=O)Nc2ccc(OC)c(OC(C)C)c2)CCOC1	ZINC000450617318	DE	On-Demand	Anodyne	ENPP1	58	34
COC[C@]1(C(=O)Nc2ccc(OC)c(OC(C)C)c2)CCOC1	ZINC000450617319	DE	On-Demand	Anodyne	ENPP1	58	34
CC[C@H](C)[C@@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])OC	ZINC000450617320	EG	On-Demand	Bother	TAAR1	18	48
CC[C@H](C)[C@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])OC	ZINC000450617321	EG	On-Demand	Bother	TAAR1	18	48
CC[C@@H](C)[C@@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])OC	ZINC000450617322	EG	On-Demand	Bother	TAAR1	18	48
CC[C@@H](C)[C@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])OC	ZINC000450617323	EG	On-Demand	Bother	TAAR1	18	48
CCCC[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617324	DF	On-Demand	Anodyne	P2RY12	99	33
CCCC[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617324	DF	On-Demand	Anodyne	CCKAR	24	45
CCCC[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617324	DF	On-Demand	Anodyne	CTSK	40	37
CCCC[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617324	DF	On-Demand	Anodyne	CCKBR	0	45
CCCC[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617324	DF	On-Demand	Anodyne	AKT1	23	46
CCCC[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617324	DF	On-Demand	Anodyne	ERAP2	41	43
CCCC[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617326	DF	On-Demand	Anodyne	P2RY12	99	33
CCCC[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617326	DF	On-Demand	Anodyne	CCKAR	24	45
CCCC[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617326	DF	On-Demand	Anodyne	CTSK	40	37
CCCC[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617326	DF	On-Demand	Anodyne	CCKBR	0	45
CCCC[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617326	DF	On-Demand	Anodyne	AKT1	23	46
CCCC[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC	ZINC000450617326	DF	On-Demand	Anodyne	ERAP2	41	43
COc1ccc(CNC(=O)CCN(C)Cc2cccnc2)c(OC)c1	ZINC000450617327	EE	On-Demand	Anodyne	PDGFRB	34	41
COc1ccc(CNC(=O)CCN(C)Cc2cccnc2)c(OC)c1	ZINC000450617327	EE	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN(C)Cc2cccnc2)c(OC)c1	ZINC000450617327	EE	On-Demand	Anodyne	MTNR1B	49	37
CC(C)[C@@H](Oc1ccccc1C#N)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617328	DC	On-Demand	Mild	SDH1	0	41
CC(C)[C@H](Oc1ccccc1C#N)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617333	DC	On-Demand	Mild	SDH1	0	41
CN1C[C@@H](NC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)C(=O)N1	ZINC000450617334	FB	On-Demand	Anodyne	TBXA2R	43	35
CN1C[C@@H](NC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)C(=O)N1	ZINC000450617334	FB	On-Demand	Anodyne	LEF	55	32
CC(C)[C@H](Oc1ccccc1C#N)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617335	DC	On-Demand	Mild	SDH1	0	41
CC(C)[C@@H](Oc1ccccc1C#N)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617336	DC	On-Demand	Mild	SDH1	0	41
CCS(=O)(=O)c1ccc(CN2CCC(C)(c3ccccc3)CC2)cc1	ZINC000450617337	FI	On-Demand	Anodyne	DRD4	17	40
CCS(=O)(=O)c1ccc(CN2CCC(C)(c3ccccc3)CC2)cc1	ZINC000450617337	FI	On-Demand	Anodyne	SIGMAR1	71	44
CCS(=O)(=O)c1ccc(CN2CCC(C)(c3ccccc3)CC2)cc1	ZINC000450617337	FI	On-Demand	Anodyne	MMP13	15	44
CCS(=O)(=O)c1ccc(CN2CCC(C)(c3ccccc3)CC2)cc1	ZINC000450617337	FI	On-Demand	Anodyne	ADAM17	23	44
CCS(=O)(=O)c1ccc(CN2CCC(C)(c3ccccc3)CC2)cc1	ZINC000450617337	FI	On-Demand	Anodyne	MCHR2	71	35
CCS(=O)(=O)c1ccc(CN2CCC(C)(c3ccccc3)CC2)cc1	ZINC000450617337	FI	On-Demand	Anodyne	NPFFR1	47	37
CN1C[C@H](NC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)C(=O)N1	ZINC000450617338	FB	On-Demand	Anodyne	TBXA2R	43	35
CN1C[C@H](NC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)C(=O)N1	ZINC000450617338	FB	On-Demand	Anodyne	LEF	55	32
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617341	FF	On-Demand	Mild	DRD2	28	41
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617341	FF	On-Demand	Mild	DRD4	0	42
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617341	FF	On-Demand	Mild	HTR7	18	41
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617341	FF	On-Demand	Mild	SLC18A3	0	42
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617341	FF	On-Demand	Mild	CYP2J2	52	37
CCN(CCC1CC1)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450617342	DF	On-Demand	Anodyne	THYX_PBCV1	0	40
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617343	FF	On-Demand	Mild	DRD2	28	41
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617343	FF	On-Demand	Mild	DRD4	0	42
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617343	FF	On-Demand	Mild	HTR7	18	41
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617343	FF	On-Demand	Mild	SLC18A3	0	42
N#C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617343	FF	On-Demand	Mild	CYP2J2	52	37
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617344	FF	On-Demand	Mild	DRD2	28	41
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617344	FF	On-Demand	Mild	DRD4	0	42
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617344	FF	On-Demand	Mild	HTR7	18	41
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617344	FF	On-Demand	Mild	SLC18A3	0	42
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@]12C(=O)Nc1ccccc12	ZINC000450617344	FF	On-Demand	Mild	CYP2J2	52	37
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617346	FF	On-Demand	Mild	DRD2	28	41
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617346	FF	On-Demand	Mild	DRD4	0	42
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617346	FF	On-Demand	Mild	HTR7	18	41
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617346	FF	On-Demand	Mild	SLC18A3	0	42
N#C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@]12C(=O)Nc1ccccc12	ZINC000450617346	FF	On-Demand	Mild	CYP2J2	52	37
CCCC[C@H](NC(=O)CC1CC(F)(F)C1)C(=O)OC	ZINC000450617349	CE	On-Demand	Anodyne	NOD1	87	36
CCCC[C@@H](NC(=O)CC1CC(F)(F)C1)C(=O)OC	ZINC000450617350	CE	On-Demand	Anodyne	NOD1	87	36
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	F2	47	37
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	ACE	40	42
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	OPRM1	22	40
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	OPRD1	16	41
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	CELA1	51	37
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	ELANE	80	47
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	CMA1	41	40
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	TRY1_BOVIN	81	37
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	PREP	55	46
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	LGMN	60	36
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	PEPD	0	42
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	XPNPEP2	0	42
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	XIAP	61	44
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	FAP	0	42
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	BRCA1	65	37
Cc1cccc(C)c1[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617356	FH	On-Demand	Anodyne	TMPRSS11D	53	36
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	F2	47	37
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	ACE	40	42
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	OPRM1	22	40
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	OPRD1	16	41
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	CELA1	51	37
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	ELANE	80	47
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	CMA1	41	40
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	TRY1_BOVIN	81	37
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	PREP	55	46
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	LGMN	60	36
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	PEPD	0	42
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	XPNPEP2	0	42
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	XIAP	61	44
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	FAP	0	42
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	BRCA1	65	37
Cc1cccc(C)c1[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450617360	FH	On-Demand	Anodyne	TMPRSS11D	53	36
O=C(CCCN1CCC(Cn2ccnn2)CC1)c1ccc(F)cc1	ZINC000450617377	EF	On-Demand	Anodyne	DRD2	30	45
O=C(CCCN1CCC(Cn2ccnn2)CC1)c1ccc(F)cc1	ZINC000450617377	EF	On-Demand	Anodyne	DRD1	0	47
O=C(CCCN1CCC(Cn2ccnn2)CC1)c1ccc(F)cc1	ZINC000450617377	EF	On-Demand	Anodyne	DRD4	24	46
O=C(CCCN1CCC(Cn2ccnn2)CC1)c1ccc(F)cc1	ZINC000450617377	EF	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCC(Cn2ccnn2)CC1)c1ccc(F)cc1	ZINC000450617377	EF	On-Demand	Anodyne	HTR3B	0	45
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	BMP1	48	43
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP13	97	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	ADAM17	24	48
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP2	67	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP3	78	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP8	52	54
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP14	20	42
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	CAPN1	0	46
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP9	65	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP12	75	53
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP7	68	53
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	ADAMTS4	66	37
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	MMP1	64	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617390	GB	On-Demand	Anodyne	LEF	27	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	BMP1	48	43
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP13	97	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	ADAM17	24	48
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP2	67	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP3	78	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP8	52	54
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP14	20	42
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	CAPN1	0	46
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP9	65	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP12	75	53
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP7	68	53
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	ADAMTS4	66	37
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	MMP1	64	63
COc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CN(C)NC2=O)C(C)C)cc1	ZINC000450617392	GB	On-Demand	Anodyne	LEF	27	63
CNC(=O)CCCN(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450617400	CD	On-Demand	Anodyne	ACER2	0	40
CNC(=O)CCCN(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450617403	CD	On-Demand	Anodyne	ACER2	0	40
CN(CCc1cscn1)[C@H]1CCCN(CCc2cscn2)CC1	ZINC000450617404	FG	On-Demand	Anodyne	SCN5A	40	32
CNC(=O)CCCN(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450617405	CD	On-Demand	Anodyne	ACER2	0	40
CN(CCc1cscn1)[C@@H]1CCCN(CCc2cscn2)CC1	ZINC000450617406	FG	On-Demand	Anodyne	SCN5A	40	32
CNC(=O)CCCN(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450617407	CD	On-Demand	Anodyne	ACER2	0	40
CCC(=O)c1ccc(NCc2nc(C)c(Br)s2)c([N+](=O)[O-])c1	ZINC000450617416	GI	On-Demand	Bother	DRTS_TOXGO	18	43
CN(C[C@H]1CCCO1)C(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450617421	CG	On-Demand	Anodyne	OXTR	28	44
CN(C[C@H]1CCCO1)C(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450617421	CG	On-Demand	Anodyne	AVPR1A	18	42
CN(C[C@H]1CCCO1)C(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450617422	CG	On-Demand	Anodyne	OXTR	28	44
CN(C[C@H]1CCCO1)C(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450617422	CG	On-Demand	Anodyne	AVPR1A	18	42
CN(C[C@H]1CCCO1)C(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450617423	CG	On-Demand	Anodyne	OXTR	28	44
CN(C[C@H]1CCCO1)C(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450617423	CG	On-Demand	Anodyne	AVPR1A	18	42
CN(C[C@H]1CCCO1)C(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450617424	CG	On-Demand	Anodyne	OXTR	28	44
CN(C[C@H]1CCCO1)C(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450617424	CG	On-Demand	Anodyne	AVPR1A	18	42
CCCC[C@H](NC(=O)C[C@@H]1CC[C@H]2C[C@H]12)C(=O)OC	ZINC000450617456	CE	On-Demand	Anodyne	NOD1	85	35
CCCC[C@H](NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12)C(=O)OC	ZINC000450617458	CE	On-Demand	Anodyne	NOD1	85	35
CCCC[C@H](NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12)C(=O)OC	ZINC000450617459	CE	On-Demand	Anodyne	NOD1	85	35
CCCC[C@H](NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12)C(=O)OC	ZINC000450617461	CE	On-Demand	Anodyne	NOD1	85	35
Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617471	FD	On-Demand	Anodyne	SCD1	31	40
Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617471	FD	On-Demand	Anodyne	SCD	25	40
CO[C@H](CNc1cc(N2CCCCC2)ncn1)Cc1ccccc1	ZINC000450617479	EG	On-Demand	Anodyne	GALR2	43	34
CO[C@@H](CNc1cc(N2CCCCC2)ncn1)Cc1ccccc1	ZINC000450617480	EG	On-Demand	Anodyne	GALR2	43	34
O=[N+]([O-])c1ccc(NC[C@H]2CCCCN2CCO)cc1C(F)(F)F	ZINC000450617502	EF	On-Demand	Bother	AADAC	0	43
O=[N+]([O-])c1ccc(NC[C@@H]2CCCCN2CCO)cc1C(F)(F)F	ZINC000450617503	EF	On-Demand	Bother	AADAC	0	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	AGTR1	15	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	MME	59	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	ANPEP	69	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	FCER2	56	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	PAPA1_CARPA	43	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	CYSP_TRYCR	48	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	TIMP3	42	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	CAPNS1	58	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	MMP3	48	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	MMP8	52	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	MMP14	62	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	HLA-DRB1	43	30
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	MMP11	65	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	CAPN1	52	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	CAPN2	52	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	PLAU	51	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	FPR1	50	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617506	GG	On-Demand	Anodyne	FAS	21	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	AGTR1	15	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	MME	59	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	ANPEP	69	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	FCER2	56	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	PAPA1_CARPA	43	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	CYSP_TRYCR	48	33
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	TIMP3	42	33
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	CAPNS1	58	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	MMP3	48	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	MMP8	52	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	MMP14	62	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	HLA-DRB1	43	30
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	MMP11	65	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	CAPN1	52	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	CAPN2	52	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	PLAU	51	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	FPR1	50	38
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)cc1	ZINC000450617507	GG	On-Demand	Anodyne	FAS	21	40
COc1cc(C(=O)N2CCn3c(O)nnc3C2)c([N+](=O)[O-])cc1F	ZINC000450617552	EC	On-Demand	Bother	P2RX7	23	44
Cc1nc([C@H]2CCCCN2CC/C=C\c2ccccc2)n[nH]1	ZINC000450617564	CH	On-Demand	Anodyne	CPT1A	40	34
Cc1nc([C@@H]2CCCCN2CC/C=C\c2ccccc2)n[nH]1	ZINC000450617566	CH	On-Demand	Anodyne	CPT1A	40	34
Cc1nc([C@H]2CCCCN2CC/C=C/c2ccccc2)n[nH]1	ZINC000450617567	CH	On-Demand	Anodyne	CPT1A	40	34
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	HTR1A	25	46
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	DRD2	35	47
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	DRD1	31	46
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	DRD4	26	44
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	HTR2A	25	50
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	DRD3	35	47
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	DRD5	47	38
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	HTR7	37	46
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	SIGMAR1	28	49
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	HTR5A	15	50
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	CHRNA6	0	41
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	SLC18A3	0	49
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	HTR3B	0	43
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	ABCB1	0	44
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	CYP2J2	65	47
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450617568	EH	On-Demand	Anodyne	CDPK1	0	42
Cc1nc([C@@H]2CCCCN2CC/C=C/c2ccccc2)n[nH]1	ZINC000450617569	CH	On-Demand	Anodyne	CPT1A	40	34
CCn1nnc(C)c1Cn1cnc2ccccc21	ZINC000450617570	BE	On-Demand	Anodyne	PKM	22	41
CCn1nnc(C)c1Cn1cnc2ccccc21	ZINC000450617570	BE	On-Demand	Anodyne	NR1I2	43	35
COC(=O)c1ccc(CN2CCCC[C@H]2c2n[nH]c(C)n2)cc1Cl	ZINC000450617571	EG	On-Demand	Anodyne	OPRK1	24	40
COC(=O)c1ccc(CN2CCCC[C@@H]2c2n[nH]c(C)n2)cc1Cl	ZINC000450617572	EG	On-Demand	Anodyne	OPRK1	24	40
CCC(CC)(CCSc1nnc(-c2ccccc2C)o1)C(=O)OC	ZINC000450617579	EJ	On-Demand	Anodyne	ALOX15	65	38
COC(=O)c1cc(NC(=O)CC2(O)CCC2)ccc1Br	ZINC000450617581	EE	On-Demand	Anodyne	ENPP1	48	29
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)cc1	ZINC000450617593	DG	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)cc1	ZINC000450617594	DG	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)cc1	ZINC000450617595	DG	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)cc1	ZINC000450617596	DG	On-Demand	Anodyne	TIMP3	40	31
CC(=O)c1cccc(CN(C)Cc2cccc(OC(C)C)c2)c1	ZINC000450617599	DI	On-Demand	Anodyne	ACHE	22	44
CC(=O)c1cccc(CN(C)Cc2cccc(OC(C)C)c2)c1	ZINC000450617599	DI	On-Demand	Anodyne	HSD17B2	25	41
CC(C)N1CCCC[C@H]1CN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450617612	GG	On-Demand	Anodyne	OPRK1	0	45
CC(C)N1CCCC[C@@H]1CN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450617616	GG	On-Demand	Anodyne	OPRK1	0	45
Cc1csc(C(=O)N2CCN(c3cccc(C#N)n3)CC2)c1	ZINC000450617619	DE	On-Demand	Mild	SLC6A7	0	43
CCCCCn1cc(C(=O)N[C@H]2CN(C)NC2=O)c2ccccc21	ZINC000450617620	ED	On-Demand	Anodyne	CNR1	48	53
CCCCCn1cc(C(=O)N[C@H]2CN(C)NC2=O)c2ccccc21	ZINC000450617620	ED	On-Demand	Anodyne	CNR2	70	56
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cn1	ZINC000450617627	ED	On-Demand	Anodyne	EPHX2	47	48
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cn1	ZINC000450617627	ED	On-Demand	Anodyne	SFRP1	72	41
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cn1	ZINC000450617627	ED	On-Demand	Anodyne	WNT3	48	29
CC(F)(F)c1ccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cn1	ZINC000450617629	ED	On-Demand	Anodyne	EPHX2	47	48
CC(F)(F)c1ccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cn1	ZINC000450617629	ED	On-Demand	Anodyne	SFRP1	72	41
CC(F)(F)c1ccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cn1	ZINC000450617629	ED	On-Demand	Anodyne	WNT3	48	29
CCCCCn1cc(C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc21	ZINC000450617631	ED	On-Demand	Anodyne	CNR1	48	53
CCCCCn1cc(C(=O)N[C@@H]2CN(C)NC2=O)c2ccccc21	ZINC000450617631	ED	On-Demand	Anodyne	CNR2	70	56
CN(CCCC(=O)c1ccc(F)cc1)C[C@H]1CCC[C@@H]1O	ZINC000450617633	CF	On-Demand	Anodyne	THRA	42	36
COc1cc(OC)cc(-c2nnc(SC[C@@H](Cc3ccccc3)OC)o2)c1	ZINC000450617634	GI	On-Demand	Anodyne	GSK3B	17	42
COc1cc(OC)cc(-c2nnc(SC[C@@H](Cc3ccccc3)OC)o2)c1	ZINC000450617634	GI	On-Demand	Anodyne	GSK3A	45	41
COc1cc(OC)cc(-c2nnc(SC[C@@H](Cc3ccccc3)OC)o2)c1	ZINC000450617634	GI	On-Demand	Anodyne	TERT	0	40
CN(CCCC(=O)c1ccc(F)cc1)C[C@H]1CCC[C@H]1O	ZINC000450617635	CF	On-Demand	Anodyne	THRA	42	36
CN(CCCC(=O)c1ccc(F)cc1)C[C@@H]1CCC[C@H]1O	ZINC000450617636	CF	On-Demand	Anodyne	THRA	42	36
CN(CCCC(=O)c1ccc(F)cc1)C[C@@H]1CCC[C@@H]1O	ZINC000450617637	CF	On-Demand	Anodyne	THRA	42	36
CC[C@@H](CC(F)(F)F)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450617639	EF	On-Demand	Anodyne	ESRRA	20	40
COc1cc(OC)cc(-c2nnc(SC[C@H](Cc3ccccc3)OC)o2)c1	ZINC000450617641	GI	On-Demand	Anodyne	GSK3B	17	42
COc1cc(OC)cc(-c2nnc(SC[C@H](Cc3ccccc3)OC)o2)c1	ZINC000450617641	GI	On-Demand	Anodyne	GSK3A	45	41
COc1cc(OC)cc(-c2nnc(SC[C@H](Cc3ccccc3)OC)o2)c1	ZINC000450617641	GI	On-Demand	Anodyne	TERT	0	40
CC[C@H](CC(F)(F)F)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450617642	EF	On-Demand	Anodyne	ESRRA	20	40
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450617644	ED	On-Demand	Mild	CCR2	15	40
CN1C[C@@H](NC(=O)c2c[nH]c3cccnc23)C(=O)N1	ZINC000450617649	CB	On-Demand	Anodyne	HTR1D	22	41
CN1C[C@@H](NC(=O)c2c[nH]c3cccnc23)C(=O)N1	ZINC000450617649	CB	On-Demand	Anodyne	HTR1F	56	41
CO[C@@H]1COCC[C@H]1CC(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450617650	ED	On-Demand	Mild	CCR2	15	40
CN1C[C@H](NC(=O)c2c[nH]c3cccnc23)C(=O)N1	ZINC000450617651	CB	On-Demand	Anodyne	HTR1D	22	41
CN1C[C@H](NC(=O)c2c[nH]c3cccnc23)C(=O)N1	ZINC000450617651	CB	On-Demand	Anodyne	HTR1F	56	41
CO[C@H]1COCC[C@H]1CC(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450617653	ED	On-Demand	Mild	CCR2	15	40
CO[C@H]1COCC[C@@H]1CC(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450617655	ED	On-Demand	Mild	CCR2	15	40
COC(=O)c1csc(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)n1	ZINC000450617664	FG	On-Demand	Anodyne	COLA	45	39
COC(=O)c1csc(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)n1	ZINC000450617664	FG	On-Demand	Anodyne	CPT1A	42	39
COC(=O)c1csc(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)n1	ZINC000450617666	FG	On-Demand	Anodyne	COLA	45	39
COC(=O)c1csc(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)n1	ZINC000450617666	FG	On-Demand	Anodyne	CPT1A	42	39
COC(=O)C1(NC[C@H](Cc2ccccc2)OC)CCCC1	ZINC000450617677	CE	On-Demand	Anodyne	MME	50	37
COC(=O)C1(NC[C@H](Cc2ccccc2)OC)CCCC1	ZINC000450617677	CE	On-Demand	Anodyne	TIMP3	46	37
COC(=O)C1(NC[C@H](Cc2ccccc2)OC)CCCC1	ZINC000450617677	CE	On-Demand	Anodyne	ECE1	35	43
COC(=O)C1(NC[C@@H](Cc2ccccc2)OC)CCCC1	ZINC000450617678	CE	On-Demand	Anodyne	MME	50	37
COC(=O)C1(NC[C@@H](Cc2ccccc2)OC)CCCC1	ZINC000450617678	CE	On-Demand	Anodyne	TIMP3	46	37
COC(=O)C1(NC[C@@H](Cc2ccccc2)OC)CCCC1	ZINC000450617678	CE	On-Demand	Anodyne	ECE1	35	43
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450617686	FJ	On-Demand	Anodyne	MC3R	16	43
O=C(CO)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450617695	DD	On-Demand	Anodyne	KCNJ1	42	34
CC1=CCN(CCNC(=O)c2cccc(C(F)(F)F)n2)CC1	ZINC000450617698	DE	On-Demand	Anodyne	DRD4	41	32
CC[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450617700	FJ	On-Demand	Anodyne	MC3R	16	43
CC[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450617701	FJ	On-Demand	Anodyne	MC3R	16	43
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450617702	FJ	On-Demand	Anodyne	MC3R	16	43
Brc1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450617703	DG	On-Demand	Anodyne	MAL12	0	40
CCc1cccc(C(=O)NCCN2CC=C(C)CC2)n1	ZINC000450617718	CE	On-Demand	Anodyne	DRD4	44	35
CCc1cccc(C(=O)NCCN2CC=C(C)CC2)n1	ZINC000450617718	CE	On-Demand	Anodyne	PLD2	47	32
CC1=CCN(CCNC(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450617725	CE	On-Demand	Anodyne	DRD4	40	33
CC(C)N(CC1CCC(=O)CC1)C[C@H](O)COc1ccc(CC(N)=O)cc1	ZINC000450617738	GD	On-Demand	Anodyne	ADRB1	15	50
CC(C)N(CC1CCC(=O)CC1)C[C@@H](O)COc1ccc(CC(N)=O)cc1	ZINC000450617740	GD	On-Demand	Anodyne	ADRB1	15	50
CCc1c(C(=O)NC[C@@]2(O)CCN(C)C2)oc2ccccc12	ZINC000450617750	DD	On-Demand	Anodyne	HCN1	44	34
CCc1c(C(=O)NC[C@]2(O)CCN(C)C2)oc2ccccc12	ZINC000450617751	DD	On-Demand	Anodyne	HCN1	44	34
CC(=O)NC[C@H](CC(=O)NC1Cc2ccccc2C1)CC(C)C	ZINC000450617791	DE	On-Demand	Anodyne	Q8I6Z5_PLAF7	0	40
Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617798	FD	On-Demand	Anodyne	SCD1	31	40
Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617798	FD	On-Demand	Anodyne	SCD	25	40
CCc1cccc(C(=O)N[C@@H](CC)CC(F)(F)F)n1	ZINC000450617799	CG	On-Demand	Anodyne	PDE5A	24	42
CCc1cccc(C(=O)N[C@H](CC)CC(F)(F)F)n1	ZINC000450617800	CG	On-Demand	Anodyne	PDE5A	24	42
COc1ccc(NC(=O)CCCc2ncc(C)o2)cc1OC(C)C	ZINC000450617801	EH	On-Demand	Anodyne	IMPDH2	0	42
COc1ccc(NC(=O)CCCc2ncc(C)o2)cc1OC(C)C	ZINC000450617801	EH	On-Demand	Anodyne	ENPP1	83	41
COCc1cc([N+](=O)[O-])ccc1NC[C@H](Cc1ccccc1)OC	ZINC000450617815	EG	On-Demand	Bother	F2RL3	46	38
COCc1cc([N+](=O)[O-])ccc1NC[C@@H](Cc1ccccc1)OC	ZINC000450617816	EG	On-Demand	Bother	F2RL3	46	38
CN1C[C@@H](NC(=O)c2ccc(OCC(F)(F)C(F)F)nc2)C(=O)N1	ZINC000450617827	FC	On-Demand	Anodyne	SCN9A	0	43
CN1C[C@H](NC(=O)c2ccc(OCC(F)(F)C(F)F)nc2)C(=O)N1	ZINC000450617828	FC	On-Demand	Anodyne	SCN9A	0	43
CC(C)[C@H](CC1CCCCC1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617831	CD	On-Demand	Anodyne	MMP1	25	42
CC(C)[C@@H](CC1CCCCC1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617832	CD	On-Demand	Anodyne	MMP1	25	42
CC(C)[C@H](CC1CCCCC1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617833	CD	On-Demand	Anodyne	MMP1	25	42
CC(C)[C@@H](CC1CCCCC1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617835	CD	On-Demand	Anodyne	MMP1	25	42
Cc1nc(CNc2nccn(C(F)F)c2=O)sc1Br	ZINC000450617837	FE	On-Demand	Anodyne	CASP3	55	36
Cc1nc(CNc2nccn(C(F)F)c2=O)sc1Br	ZINC000450617837	FE	On-Demand	Anodyne	CASP7	53	36
COc1ccc(NC(=O)CCCC(=O)C2CC2)cc1OC(C)C	ZINC000450617848	DH	On-Demand	Anodyne	MTNR1B	19	40
COc1ccc(NC(=O)CCCC(=O)C2CC2)cc1OC(C)C	ZINC000450617848	DH	On-Demand	Anodyne	HDAC3	21	41
COc1ccc(NC(=O)CCCC(=O)C2CC2)cc1OC(C)C	ZINC000450617848	DH	On-Demand	Anodyne	ENPP1	79	39
COc1ccc(Cn2cc(C(=O)N[C@H]3CN(C)NC3=O)cn2)cc1	ZINC000450617852	EC	On-Demand	Anodyne	PROKR1	51	31
COc1ccc(Cn2cc(C(=O)N[C@@H]3CN(C)NC3=O)cn2)cc1	ZINC000450617857	EC	On-Demand	Anodyne	PROKR1	51	31
COc1ccc(NC(=O)c2ccc(C#N)n2C)cc1OC(C)C	ZINC000450617858	DF	On-Demand	Mild	ENPP1	58	34
C[C@H](c1ccccc1)[C@@H](O)CN(C)Cc1cccnc1	ZINC000450617862	CF	On-Demand	Anodyne	KCNA5	48	39
C[C@H](c1ccccc1)[C@H](O)CN(C)Cc1cccnc1	ZINC000450617864	CF	On-Demand	Anodyne	KCNA5	48	39
C[C@@H](c1ccccc1)[C@H](O)CN(C)Cc1cccnc1	ZINC000450617865	CF	On-Demand	Anodyne	KCNA5	48	39
C[C@@H](c1ccccc1)[C@@H](O)CN(C)Cc1cccnc1	ZINC000450617866	CF	On-Demand	Anodyne	KCNA5	48	39
CCc1cccc(C(=O)NCCC[C@@H]2CCCCO2)n1	ZINC000450617867	CF	On-Demand	Anodyne	PDE5A	0	40
CCc1cccc(C(=O)NCCC[C@H]2CCCCO2)n1	ZINC000450617868	CF	On-Demand	Anodyne	PDE5A	0	40
CCN(CC)C(=O)c1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450617878	DC	On-Demand	Anodyne	OPRM1	25	41
CCN(CC)C(=O)c1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450617878	DC	On-Demand	Anodyne	OPRD1	26	41
CCN(CC)C(=O)c1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450617879	DC	On-Demand	Anodyne	OPRM1	25	41
CCN(CC)C(=O)c1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450617879	DC	On-Demand	Anodyne	OPRD1	26	41
Cc1cccc(C)c1[C@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450617880	DH	On-Demand	Anodyne	MMP13	0	43
Cc1cccc(C)c1[C@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450617880	DH	On-Demand	Anodyne	S1PR4	31	44
CCCCOc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1OCC	ZINC000450617882	ED	On-Demand	Anodyne	SSTR5	40	34
CCCCOc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1OCC	ZINC000450617883	ED	On-Demand	Anodyne	SSTR5	40	34
Cc1cccc(C)c1[C@@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450617886	DH	On-Demand	Anodyne	MMP13	0	43
Cc1cccc(C)c1[C@@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450617886	DH	On-Demand	Anodyne	S1PR4	31	44
O=C1CC[C@H](COc2ccc(C(F)(F)F)cc2)CCN1	ZINC000450617888	CG	On-Demand	Anodyne	LTA4H	18	47
O=C1CC[C@@H](COc2ccc(C(F)(F)F)cc2)CCN1	ZINC000450617890	CG	On-Demand	Anodyne	LTA4H	18	47
COc1ccccc1Oc1ccc(C(=O)NCCC[C@@H]2CCCCO2)nc1	ZINC000450617893	FH	On-Demand	Anodyne	DRD3	25	40
COc1ccccc1Oc1ccc(C(=O)NCCC[C@@H]2CCCCO2)nc1	ZINC000450617893	FH	On-Demand	Anodyne	TYRO3	18	41
COc1ccccc1Oc1ccc(C(=O)NCCC[C@H]2CCCCO2)nc1	ZINC000450617894	FH	On-Demand	Anodyne	DRD3	25	40
COc1ccccc1Oc1ccc(C(=O)NCCC[C@H]2CCCCO2)nc1	ZINC000450617894	FH	On-Demand	Anodyne	TYRO3	18	41
C[C@@H](CN1CCO[C@@]2(CCc3ccccc32)C1)S(C)(=O)=O	ZINC000450617895	DD	On-Demand	Anodyne	SIGMAR1	15	43
C[C@H](CN1CCO[C@@]2(CCc3ccccc32)C1)S(C)(=O)=O	ZINC000450617896	DD	On-Demand	Anodyne	SIGMAR1	15	43
C[C@H](CN1CCO[C@]2(CCc3ccccc32)C1)S(C)(=O)=O	ZINC000450617897	DD	On-Demand	Anodyne	SIGMAR1	15	43
C[C@@H](CN1CCO[C@]2(CCc3ccccc32)C1)S(C)(=O)=O	ZINC000450617898	DD	On-Demand	Anodyne	SIGMAR1	15	43
CCCC[C@@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C(=O)OC	ZINC000450617911	DF	On-Demand	Anodyne	GHRHR	54	33
CCCC[C@@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C(=O)OC	ZINC000450617911	DF	On-Demand	Anodyne	CTSK	46	40
CCCC[C@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C(=O)OC	ZINC000450617912	DF	On-Demand	Anodyne	GHRHR	54	33
CCCC[C@H](NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C(=O)OC	ZINC000450617912	DF	On-Demand	Anodyne	CTSK	46	40
CN1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617913	EB	On-Demand	Anodyne	SLC6A1	54	34
CN1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617913	EB	On-Demand	Anodyne	F2R	27	44
CN1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617913	EB	On-Demand	Anodyne	BIRC3	15	41
CN1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617913	EB	On-Demand	Anodyne	BIRC2	39	46
CN1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617913	EB	On-Demand	Anodyne	BIRC8	23	41
CN1C[C@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617918	EB	On-Demand	Anodyne	SLC6A1	54	34
CN1C[C@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617918	EB	On-Demand	Anodyne	F2R	27	44
CN1C[C@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617918	EB	On-Demand	Anodyne	BIRC3	15	41
CN1C[C@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617918	EB	On-Demand	Anodyne	BIRC2	39	46
CN1C[C@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617918	EB	On-Demand	Anodyne	BIRC8	23	41
CN1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617919	EB	On-Demand	Anodyne	SLC6A1	54	34
CN1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617919	EB	On-Demand	Anodyne	F2R	27	44
CN1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617919	EB	On-Demand	Anodyne	BIRC3	15	41
CN1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617919	EB	On-Demand	Anodyne	BIRC2	39	46
CN1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617919	EB	On-Demand	Anodyne	BIRC8	23	41
CN1C[C@@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617920	EB	On-Demand	Anodyne	SLC6A1	54	34
CN1C[C@@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617920	EB	On-Demand	Anodyne	F2R	27	44
CN1C[C@@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617920	EB	On-Demand	Anodyne	BIRC3	15	41
CN1C[C@@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617920	EB	On-Demand	Anodyne	BIRC2	39	46
CN1C[C@@H](NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C(=O)N1	ZINC000450617920	EB	On-Demand	Anodyne	BIRC8	23	41
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C[C@H](C)O	ZINC000450617922	CE	On-Demand	Anodyne	SLC18A2	71	37
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C[C@@H](C)O	ZINC000450617923	CE	On-Demand	Anodyne	SLC18A2	71	37
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1C[C@@H](C)O	ZINC000450617924	CE	On-Demand	Anodyne	SLC18A2	71	37
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1C[C@H](C)O	ZINC000450617925	CE	On-Demand	Anodyne	SLC18A2	71	37
COC(=O)c1cn([C@H]2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)C2)nn1	ZINC000450617946	FD	On-Demand	Anodyne	NPBWR1	57	32
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450617947	CG	On-Demand	Anodyne	ENPP1	60	34
CCCC[C@H](NC(=O)Cn1cc(C(C)=O)nn1)C(=O)OC	ZINC000450617951	CC	On-Demand	Anodyne	NOD1	56	33
CCCC[C@@H](NC(=O)Cn1cc(C(C)=O)nn1)C(=O)OC	ZINC000450617952	CC	On-Demand	Anodyne	NOD1	56	33
C[C@H](c1ccccc1)[C@H](O)CN(C)CC1(O)CCCC1	ZINC000450617955	CE	On-Demand	Anodyne	ADRA1A	0	46
C[C@@H](c1ccccc1)[C@H](O)CN(C)CC1(O)CCCC1	ZINC000450617957	CE	On-Demand	Anodyne	ADRA1A	0	46
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CC1(O)CCCC1	ZINC000450617958	CE	On-Demand	Anodyne	ADRA1A	0	46
C[C@H](c1ccccc1)[C@@H](O)CN(C)CC1(O)CCCC1	ZINC000450617959	CE	On-Demand	Anodyne	ADRA1A	0	46
C[C@H](Sc1nc2ccccc2c(=O)n1CCCO)c1csnn1	ZINC000450617961	EE	On-Demand	Anodyne	SLC16A1	47	34
C[C@@H](Sc1nc2ccccc2c(=O)n1CCCO)c1csnn1	ZINC000450617962	EE	On-Demand	Anodyne	SLC16A1	47	34
CCCN1CCC[C@@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617980	CB	On-Demand	Anodyne	HSD11B1	46	37
CCCN1CCC[C@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617983	CB	On-Demand	Anodyne	HSD11B1	46	37
CCCN1CCC[C@@H]1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450617985	CB	On-Demand	Anodyne	HSD11B1	46	37
CCCN1CCC[C@H]1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450617987	CB	On-Demand	Anodyne	HSD11B1	46	37
Cc1ccccc1-c1nnc(SCC(=O)CC(C)(C)C2CC2)o1	ZINC000450618007	EJ	On-Demand	Anodyne	ALOX15	52	37
Cc1cc(OCc2ccccc2)nc(N[C@@H]2CCCN(CCCO)C2)n1	ZINC000450618016	FF	On-Demand	Anodyne	SIGMAR1	15	42
Cc1cc(OCc2ccccc2)nc(N[C@H]2CCCN(CCCO)C2)n1	ZINC000450618017	FF	On-Demand	Anodyne	SIGMAR1	15	42
COC(=O)C1(CN2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450618022	GH	On-Demand	Anodyne	TACR1	46	37
COC(=O)C1(CN2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450618022	GH	On-Demand	Anodyne	SIGMAR1	15	45
COC(=O)C1(CN2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450618022	GH	On-Demand	Anodyne	CACNA1B	47	38
COC(=O)C1(CN2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450618022	GH	On-Demand	Anodyne	TACR3	26	40
COC(=O)C1(CN2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450618022	GH	On-Demand	Anodyne	CCR2	117	40
COC(=O)C1(CN2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450618022	GH	On-Demand	Anodyne	CACNA1I	17	43
COC(=O)C1(CN2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450618022	GH	On-Demand	Anodyne	SLC12A5	15	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cc3c([nH]2)CCCC3)cc1	ZINC000450618033	EG	On-Demand	Anodyne	CCKAR	0	53
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cc3c([nH]2)CCCC3)cc1	ZINC000450618034	EG	On-Demand	Anodyne	CCKAR	0	53
CCC(=O)C1(C(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)CC1	ZINC000450618035	DF	On-Demand	Anodyne	TIMP3	65	35
CCC(=O)C1(C(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)CC1	ZINC000450618036	DF	On-Demand	Anodyne	TIMP3	65	35
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@]2(O)CCN(C)C2)cc1	ZINC000450618045	GC	On-Demand	Anodyne	LUXN	0	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@]2(O)CCN(C)C2)cc1	ZINC000450618047	GC	On-Demand	Anodyne	LUXN	0	40
CCCCN(CCCO)C(=O)c1ccccc1-n1ccc(C)n1	ZINC000450618048	DF	On-Demand	Anodyne	BCL2	0	42
COC(=O)[C@H]1CCN(C[C@H](Cc2ccccc2)OC)c2ccccc21	ZINC000450618057	EG	On-Demand	Anodyne	ACE	50	35
COC(=O)[C@H]1CCN(C[C@H](Cc2ccccc2)OC)c2ccccc21	ZINC000450618057	EG	On-Demand	Anodyne	MME	44	34
COC(=O)[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)c2ccccc21	ZINC000450618059	EG	On-Demand	Anodyne	ACE	50	35
COC(=O)[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)c2ccccc21	ZINC000450618059	EG	On-Demand	Anodyne	MME	44	34
COC(=O)[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)c2ccccc21	ZINC000450618061	EG	On-Demand	Anodyne	ACE	50	35
COC(=O)[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)c2ccccc21	ZINC000450618061	EG	On-Demand	Anodyne	MME	44	34
COC(=O)[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)c2ccccc21	ZINC000450618064	EG	On-Demand	Anodyne	ACE	50	35
COC(=O)[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)c2ccccc21	ZINC000450618064	EG	On-Demand	Anodyne	MME	44	34
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)c2c(Cl)cc(Cl)cc2Cl)O1	ZINC000450618066	GG	On-Demand	Anodyne	CACNA1I	51	33
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)c2c(Cl)cc(Cl)cc2Cl)O1	ZINC000450618067	GG	On-Demand	Anodyne	CACNA1I	51	33
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)c2c(Cl)cc(Cl)cc2Cl)O1	ZINC000450618068	GG	On-Demand	Anodyne	CACNA1I	51	33
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)c2c(Cl)cc(Cl)cc2Cl)O1	ZINC000450618069	GG	On-Demand	Anodyne	CACNA1I	51	33
CCC[C@H](O)CN1CCN(C(=O)Nc2ccc(C)c(Cl)c2)CC1	ZINC000450618071	EF	On-Demand	Anodyne	PYGL	0	43
CCC[C@H](O)CN1CCN(C(=O)Nc2ccc(C)c(Cl)c2)CC1	ZINC000450618071	EF	On-Demand	Anodyne	ABCB1	0	48
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618074	FH	On-Demand	Anodyne	MME	18	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618074	FH	On-Demand	Anodyne	TIMP3	44	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618074	FH	On-Demand	Anodyne	NPY5R	19	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618074	FH	On-Demand	Anodyne	ACE2	23	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618075	FH	On-Demand	Anodyne	MME	18	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618075	FH	On-Demand	Anodyne	TIMP3	44	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618075	FH	On-Demand	Anodyne	NPY5R	19	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618075	FH	On-Demand	Anodyne	ACE2	23	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618076	FH	On-Demand	Anodyne	MME	18	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618076	FH	On-Demand	Anodyne	TIMP3	44	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618076	FH	On-Demand	Anodyne	NPY5R	19	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618076	FH	On-Demand	Anodyne	ACE2	23	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618077	FH	On-Demand	Anodyne	MME	18	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618077	FH	On-Demand	Anodyne	TIMP3	44	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618077	FH	On-Demand	Anodyne	NPY5R	19	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450618077	FH	On-Demand	Anodyne	ACE2	23	40
CCC[C@@H](O)CN1CCN(C(=O)Nc2ccc(C)c(Cl)c2)CC1	ZINC000450618082	EF	On-Demand	Anodyne	PYGL	0	43
CCC[C@@H](O)CN1CCN(C(=O)Nc2ccc(C)c(Cl)c2)CC1	ZINC000450618082	EF	On-Demand	Anodyne	ABCB1	0	48
CC1=CCN(CCNC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450618100	DE	On-Demand	Anodyne	SLC6A1	78	32
CC1=CCN(CCNC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450618103	DE	On-Demand	Anodyne	SLC6A1	78	32
CC(=O)CCCCCOc1ccc(C#N)cc1	ZINC000450618114	BG	On-Demand	Mild	THRA	27	40
CC(=O)CCCCCOc1ccc(C#N)cc1	ZINC000450618114	BG	On-Demand	Mild	P2RY12	0	41
CC(=O)CCCCCOc1ccc(C#N)cc1	ZINC000450618114	BG	On-Demand	Mild	THRB	0	40
CC(=O)CCCCCOc1ccc(C#N)cc1	ZINC000450618114	BG	On-Demand	Mild	PLA2G4B	82	42
CC(=O)CCCCCOc1ccc(C#N)cc1	ZINC000450618114	BG	On-Demand	Mild	MEN1	40	34
CC(=O)CCCCCOc1ccc(C#N)cc1	ZINC000450618114	BG	On-Demand	Mild	PDEB1	0	40
O=C(c1cc(Cl)c(F)cc1Br)N1CCn2c(O)nnc2C1	ZINC000450618125	GE	On-Demand	Anodyne	P2RX7	50	50
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450618129	EG	On-Demand	Anodyne	FOLH1	32	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450618129	EG	On-Demand	Anodyne	TRPV1	0	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450618129	EG	On-Demand	Anodyne	SLC1A2	40	37
COCc1cc([N+](=O)[O-])ccc1NCc1ccnc(C)c1	ZINC000450618130	CG	On-Demand	Bother	CACNA1D	51	33
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450618131	EG	On-Demand	Anodyne	FOLH1	32	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450618131	EG	On-Demand	Anodyne	TRPV1	0	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450618131	EG	On-Demand	Anodyne	SLC1A2	40	37
O=C1CCC(=O)N1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450618140	DG	On-Demand	Anodyne	SIGMAR1	19	50
O=C1CCC(=O)N1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450618140	DG	On-Demand	Anodyne	DNAE	53	32
O=C(CC[C@@H]1CCCCO1)COc1ccc(Cl)cc1	ZINC000450618158	CH	On-Demand	Anodyne	CPT1A	44	41
O=C(CC[C@@H]1CCCCO1)COc1ccc(Cl)cc1	ZINC000450618158	CH	On-Demand	Anodyne	PLA2G4B	59	33
O=C(CC[C@@H]1CCCCO1)COc1ccc(Cl)cc1	ZINC000450618158	CH	On-Demand	Anodyne	TRAR	28	44
CC1=CCN(CCNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450618159	EE	On-Demand	Bother	DRD4	41	32
O=C(CC[C@H]1CCCCO1)COc1ccc(Cl)cc1	ZINC000450618160	CH	On-Demand	Anodyne	CPT1A	44	41
O=C(CC[C@H]1CCCCO1)COc1ccc(Cl)cc1	ZINC000450618160	CH	On-Demand	Anodyne	PLA2G4B	59	33
O=C(CC[C@H]1CCCCO1)COc1ccc(Cl)cc1	ZINC000450618160	CH	On-Demand	Anodyne	TRAR	28	44
CC[C@H](C)[C@@H](CNc1ccc(S(N)(=O)=O)cn1)OC	ZINC000450618165	CD	On-Demand	Anodyne	CA1	16	41
CC[C@@H](C)[C@H](CNc1ccc(S(N)(=O)=O)cn1)OC	ZINC000450618167	CD	On-Demand	Anodyne	CA1	16	41
CC[C@@H](C)[C@@H](CNc1ccc(S(N)(=O)=O)cn1)OC	ZINC000450618168	CD	On-Demand	Anodyne	CA1	16	41
CC[C@H](C)[C@H](CNc1ccc(S(N)(=O)=O)cn1)OC	ZINC000450618169	CD	On-Demand	Anodyne	CA1	16	41
C[C@@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618170	FH	On-Demand	Anodyne	ESR1	56	36
C[C@@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618170	FH	On-Demand	Anodyne	LTA4H	55	47
C[C@@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618170	FH	On-Demand	Anodyne	HRH3	48	44
C[C@@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618170	FH	On-Demand	Anodyne	PSMB2	56	47
C[C@@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618170	FH	On-Demand	Anodyne	PSMB5	19	47
C[C@@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618170	FH	On-Demand	Anodyne	PSMB1	48	47
C[C@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618171	FH	On-Demand	Anodyne	ESR1	56	36
C[C@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618171	FH	On-Demand	Anodyne	LTA4H	55	47
C[C@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618171	FH	On-Demand	Anodyne	HRH3	48	44
C[C@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618171	FH	On-Demand	Anodyne	PSMB2	56	47
C[C@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618171	FH	On-Demand	Anodyne	PSMB5	19	47
C[C@]1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC=CCC1	ZINC000450618171	FH	On-Demand	Anodyne	PSMB1	48	47
CCc1cc2c(NCc3ccnc(C)c3)ncnc2s1	ZINC000450618173	CH	On-Demand	Anodyne	CLK4	61	40
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	ESR1	67	40
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	THRA	0	43
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	HRH2	32	44
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	ESR2	38	41
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	LTA4H	63	46
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	HRH3	63	46
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	ABCB1	0	42
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	PSMB2	58	47
CC[C@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618181	ED	On-Demand	Anodyne	PSMB1	51	47
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	ESR1	67	40
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	THRA	0	43
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	HRH2	32	44
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	ESR2	38	41
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	LTA4H	63	46
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	HRH3	63	46
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	ABCB1	0	42
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	PSMB2	58	47
CC[C@@H](O)CC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450618183	ED	On-Demand	Anodyne	PSMB1	51	47
O=[N+]([O-])c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450618200	CE	On-Demand	Bother	FIMH	17	41
COC(=O)c1cc(NC(=O)CCCn2nc(C)nc2C)ccc1Br	ZINC000450618203	GF	On-Demand	Anodyne	ENPP1	60	32
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@]1(O)CCN(C)C1	ZINC000450618205	DD	On-Demand	Anodyne	SLC6A9	29	44
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@]1(O)CCN(C)C1	ZINC000450618206	DD	On-Demand	Anodyne	SLC6A9	29	44
CCC(CC)(CCN1C(=O)c2ccccc2C1=O)C(=O)OC	ZINC000450618214	DF	On-Demand	Anodyne	17HSDCL	0	42
CCC(CC)(CCN1C(=O)c2ccccc2C1=O)C(=O)OC	ZINC000450618214	DF	On-Demand	Anodyne	FBPC	0	42
Cc1cc(CNc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])ccn1	ZINC000450618216	GD	On-Demand	Bother	DDIT3	0	40
CCCOc1ccc(C(=O)NC[C@@]2(O)CCN(C)C2)c(OC)c1	ZINC000450618226	DD	On-Demand	Anodyne	HCN1	71	43
CCCOc1ccc(C(=O)NC[C@@]2(O)CCN(C)C2)c(OC)c1	ZINC000450618226	DD	On-Demand	Anodyne	HCN4	56	38
CCCOc1ccc(C(=O)NC[C@]2(O)CCN(C)C2)c(OC)c1	ZINC000450618227	DD	On-Demand	Anodyne	HCN1	71	43
CCCOc1ccc(C(=O)NC[C@]2(O)CCN(C)C2)c(OC)c1	ZINC000450618227	DD	On-Demand	Anodyne	HCN4	56	38
CC(C)Oc1cccc(CN(C)Cc2ccn(CC(F)(F)F)n2)c1	ZINC000450618234	EH	On-Demand	Anodyne	CETP	0	41
CCc1cc(CCCN2CCN(CC(=O)Nc3ccccc3F)CC2)on1	ZINC000450618250	FF	On-Demand	Anodyne	DRD4	0	45
C[C@H](OCCc1ccccc1)C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450618258	FE	On-Demand	Mild	P2RY12	40	34
C[C@@H](OCCc1ccccc1)C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450618259	FE	On-Demand	Mild	P2RY12	40	34
O=C(CC[C@@H]1CCCCO1)COc1cccc(Cl)c1	ZINC000450618260	CH	On-Demand	Anodyne	CPT1A	85	39
O=C(CC[C@H]1CCCCO1)COc1cccc(Cl)c1	ZINC000450618261	CH	On-Demand	Anodyne	CPT1A	76	37
O=[N+]([O-])c1ccc(OCc2nnc(C3CC3)s2)cc1	ZINC000450618263	CF	On-Demand	Bother	ACR	20	40
COc1ccc(NC(=O)C(C)(C)C2CCC2)cc1OC(C)C	ZINC000450618267	DI	On-Demand	Anodyne	ENPP1	69	33
CC(=O)c1cccc(CN2CC[C@@H](C3CCOCC3)C2)c1	ZINC000450618276	CG	On-Demand	Anodyne	CCR3	36	41
CC(=O)c1cccc(CN2CC[C@H](C3CCOCC3)C2)c1	ZINC000450618278	CG	On-Demand	Anodyne	CCR3	36	41
CC[C@H](CC(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450618303	CG	On-Demand	Anodyne	MME	25	44
CC[C@H](CC(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450618303	CG	On-Demand	Anodyne	KCNQ2	41	33
CC[C@H](CC(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450618303	CG	On-Demand	Anodyne	CAPN2	51	33
CC[C@H](CC(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450618303	CG	On-Demand	Anodyne	POL	0	45
CC[C@@H](CC(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450618304	CG	On-Demand	Anodyne	MME	25	44
CC[C@@H](CC(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450618304	CG	On-Demand	Anodyne	KCNQ2	41	33
CC[C@@H](CC(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450618304	CG	On-Demand	Anodyne	CAPN2	51	33
CC[C@@H](CC(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450618304	CG	On-Demand	Anodyne	POL	0	45
CO[C@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)Cc1ccccc1	ZINC000450618305	FH	On-Demand	Anodyne	PTR1	48	36
CCS(=O)(=O)c1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)cc1	ZINC000450618308	FG	On-Demand	Anodyne	SIGMAR1	32	42
CCS(=O)(=O)c1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)cc1	ZINC000450618309	FG	On-Demand	Anodyne	SIGMAR1	32	42
CO[C@@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)Cc1ccccc1	ZINC000450618312	FH	On-Demand	Anodyne	PTR1	48	36
CN1C[C@H](NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2)C(=O)N1	ZINC000450618317	EC	On-Demand	Anodyne	HSD17B2	45	32
CN1C[C@H](NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)C(=O)N1	ZINC000450618318	EC	On-Demand	Anodyne	HSD17B2	45	32
CN1C[C@H](NC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)C(=O)N1	ZINC000450618319	EC	On-Demand	Anodyne	HSD17B2	45	32
CN1C[C@H](NC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2ccccc2)C(=O)N1	ZINC000450618320	EC	On-Demand	Anodyne	HSD17B2	45	32
COc1ccc(NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)cc1OC(C)C	ZINC000450618327	DH	On-Demand	Anodyne	ENPP1	78	37
COc1ccc(NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)cc1OC(C)C	ZINC000450618330	DH	On-Demand	Anodyne	ENPP1	78	37
COc1ccc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)cc1OC(C)C	ZINC000450618332	DH	On-Demand	Anodyne	ENPP1	78	37
COc1ccc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)cc1OC(C)C	ZINC000450618333	DH	On-Demand	Anodyne	ENPP1	78	37
COc1cccc(Oc2ccc(C(=O)NCCC[C@@H]3CCCCO3)nc2)c1	ZINC000450618334	FH	On-Demand	Anodyne	DRD4	46	35
COc1cccc(Oc2ccc(C(=O)NCCC[C@H]3CCCCO3)nc2)c1	ZINC000450618335	FH	On-Demand	Anodyne	DRD4	46	35
Cc1cc(C(F)(F)F)ccc1C(=O)NCCC[C@@H]1CCCCO1	ZINC000450618348	EI	On-Demand	Anodyne	LDLR	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCCC[C@@H]1CCCCO1	ZINC000450618348	EI	On-Demand	Anodyne	CCR2	69	45
COc1cc(CSc2nc3ccccc3c(=O)n2CCCO)ccc1Cl	ZINC000450618351	GH	On-Demand	Anodyne	PTGDR2	18	47
Cc1cc(C(F)(F)F)ccc1C(=O)NCCC[C@H]1CCCCO1	ZINC000450618353	EI	On-Demand	Anodyne	LDLR	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCCC[C@H]1CCCCO1	ZINC000450618353	EI	On-Demand	Anodyne	CCR2	69	45
CCOC(=O)c1cc2cc(C(=O)N[C@@H]3CN(C)NC3=O)ccc2[nH]1	ZINC000450618361	EC	On-Demand	Anodyne	PYGM	39	40
CN(CCC1=CCCCC1)Cc1cccnc1	ZINC000450618362	BG	On-Demand	Anodyne	NR1D1	42	37
CN1C[C@@H](NC(=O)Cn2c(=O)n(C)c3ccccc32)C(=O)N1	ZINC000450618366	DA	On-Demand	Anodyne	CALCRL	23	42
CCOC(=O)c1cc2cc(C(=O)N[C@H]3CN(C)NC3=O)ccc2[nH]1	ZINC000450618371	EC	On-Demand	Anodyne	PYGM	39	40
CN1C[C@H](NC(=O)Cn2c(=O)n(C)c3ccccc32)C(=O)N1	ZINC000450618372	DA	On-Demand	Anodyne	CALCRL	23	42
CN(CCCC(=O)c1ccccc1)CCN1C(=O)c2ccccc2C1=O	ZINC000450618374	FF	On-Demand	Anodyne	THRA	0	41
COc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1OC(C)C	ZINC000450618402	EH	On-Demand	Anodyne	COLA	43	33
COc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1OC(C)C	ZINC000450618402	EH	On-Demand	Anodyne	CPT1A	40	33
COc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1OC(C)C	ZINC000450618402	EH	On-Demand	Anodyne	GRM4	26	45
COc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1OC(C)C	ZINC000450618402	EH	On-Demand	Anodyne	ENPP1	77	38
CCN(CCC1CC1)C(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450618403	EH	On-Demand	Anodyne	ACKR3	63	32
CCS(=O)(=O)c1ccc(CN(C)Cc2cccnc2)cc1	ZINC000450618414	DF	On-Demand	Anodyne	NAMPT	36	40
CCS(=O)(=O)c1ccc(CN(C)Cc2cccnc2)cc1	ZINC000450618414	DF	On-Demand	Anodyne	NR1D1	48	40
CCOc1nc2ccc(C(=O)N(CC)CCC3CC3)cc2[nH]1	ZINC000450618425	DG	On-Demand	Anodyne	ACKR3	58	33
COc1ccc(NC(=O)Cn2ccc(C)n2)cc1OC(C)C	ZINC000450618432	DF	On-Demand	Anodyne	ENPP1	71	41
COc1ccc(NC(=O)Cn2ccc(C)n2)cc1OC(C)C	ZINC000450618432	DF	On-Demand	Anodyne	IMDH_CRYPV	22	40
COc1ccc(NC(=O)c2nn(C)c3c2CCCC3)cc1OC(C)C	ZINC000450618435	EG	On-Demand	Anodyne	ENPP1	54	33
CN1C[C@H](NC(=O)CNC(=O)c2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450618451	EC	On-Demand	Anodyne	CACNA1I	17	44
CN1C[C@@H](NC(=O)CNC(=O)c2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000450618453	EC	On-Demand	Anodyne	CACNA1I	17	44
COC(=O)c1cn([C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)C2)nn1	ZINC000450618472	GE	On-Demand	Anodyne	LIPG	48	33
COC(=O)c1cn([C@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)C2)nn1	ZINC000450618473	GE	On-Demand	Anodyne	LIPG	48	33
c1ccc(CCn2ccc(CN3CCC(Cn4ccnn4)CC3)n2)cc1	ZINC000450618476	FF	On-Demand	Anodyne	SIGMAR1	32	40
COC1(CSc2nc3ccsc3c(=O)n2Cc2ccccc2)CCC1	ZINC000450618483	FI	On-Demand	Anodyne	KIF11	15	41
O=C(NCCC[C@H]1CCCCO1)c1cc(Cl)c2ccccc2n1	ZINC000450618489	EH	On-Demand	Anodyne	ACHE	61	39
O=C(NCCC[C@H]1CCCCO1)c1cc(Cl)c2ccccc2n1	ZINC000450618489	EH	On-Demand	Anodyne	BCHE	81	38
O=C(NCCC[C@H]1CCCCO1)c1cc(Cl)c2ccccc2n1	ZINC000450618489	EH	On-Demand	Anodyne	SSTR3	22	42
O=C(NCCC[C@@H]1CCCCO1)c1cc(Cl)c2ccccc2n1	ZINC000450618490	EH	On-Demand	Anodyne	ACHE	61	39
O=C(NCCC[C@@H]1CCCCO1)c1cc(Cl)c2ccccc2n1	ZINC000450618490	EH	On-Demand	Anodyne	BCHE	81	38
O=C(NCCC[C@@H]1CCCCO1)c1cc(Cl)c2ccccc2n1	ZINC000450618490	EH	On-Demand	Anodyne	SSTR3	22	42
COc1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1OC(C)C	ZINC000450618491	EF	On-Demand	Anodyne	ENPP1	53	32
CC(C)(CNc1ccc(S(=O)(=O)NCC2CC2)cn1)c1ccccn1	ZINC000450618499	FF	On-Demand	Anodyne	NPY2R	79	38
CC(C)(CNc1ccc(S(=O)(=O)NCC2CC2)cn1)c1ccccn1	ZINC000450618499	FF	On-Demand	Anodyne	GPR39	0	42
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)[C@H]1OC	ZINC000450618507	FF	On-Demand	Anodyne	MTNR1B	17	40
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)[C@H]1OC	ZINC000450618508	FF	On-Demand	Anodyne	MTNR1B	17	40
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)[C@@H]1OC	ZINC000450618509	FF	On-Demand	Anodyne	MTNR1B	17	40
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)[C@@H]1OC	ZINC000450618510	FF	On-Demand	Anodyne	MTNR1B	17	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	FOLH1	45	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	MME	43	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	ANPEP	42	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	FCER2	63	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	PAPA1_CARPA	42	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	CTSK	41	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	CTSL	34	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	PGA	24	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	ADAM17	26	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	TIMP3	67	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	CAPNS1	65	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	MMP2	21	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	MMP3	47	45
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	HLA-DRB1	59	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	REN	20	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	CAPN1	75	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	MMP9	20	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	CAPN2	94	38
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	PLAU	43	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	MMP7	21	46
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	MMP1	40	46
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	FPR1	79	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618511	GH	On-Demand	Anodyne	NPR	64	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	FOLH1	45	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	MME	43	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	ANPEP	42	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	FCER2	63	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	PAPA1_CARPA	42	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	CTSK	41	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	CTSL	34	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	PGA	24	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	ADAM17	26	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	TIMP3	67	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	CAPNS1	65	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	MMP2	21	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	MMP3	47	45
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	HLA-DRB1	59	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	REN	20	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	CAPN1	75	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	MMP9	20	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	CAPN2	94	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	PLAU	43	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	MMP7	21	46
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	MMP1	40	46
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	FPR1	79	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1	ZINC000450618512	GH	On-Demand	Anodyne	NPR	64	42
O=[N+]([O-])c1cccc(OCc2nnc(C3CC3)s2)c1	ZINC000450618520	CF	On-Demand	Bother	ACR	20	47
COC(=O)[C@H]1CCCC[C@@]1(C)NC[C@H](O)Cc1ccccc1	ZINC000450618521	DE	On-Demand	Anodyne	TIMP3	61	36
COC(=O)[C@H]1CCCC[C@]1(C)NC[C@H](O)Cc1ccccc1	ZINC000450618522	DE	On-Demand	Anodyne	TIMP3	61	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@]1(O)CCN(C)C1	ZINC000450618528	CC	On-Demand	Anodyne	TIMP3	40	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@]1(O)CCN(C)C1	ZINC000450618530	CC	On-Demand	Anodyne	TIMP3	40	33
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450618531	FG	On-Demand	Anodyne	F10	0	41
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450618531	FG	On-Demand	Anodyne	KCNQ2	58	32
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450618531	FG	On-Demand	Anodyne	PRNP	35	40
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450618531	FG	On-Demand	Anodyne	HDAC1	30	45
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450618531	FG	On-Demand	Anodyne	FABH	0	45
CC(C)(C)OC(=O)c1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450618531	FG	On-Demand	Anodyne	HPGDS	19	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@]1(O)CCN(C)C1	ZINC000450618532	CC	On-Demand	Anodyne	TIMP3	40	33
Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)nn1-c1ccc(Cl)cc1Cl	ZINC000450618533	FD	On-Demand	Anodyne	CNR1	84	43
Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)nn1-c1ccc(Cl)cc1Cl	ZINC000450618533	FD	On-Demand	Anodyne	CNR2	35	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@@]1(O)CCN(C)C1	ZINC000450618534	CC	On-Demand	Anodyne	TIMP3	40	33
Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)nn1-c1ccc(Cl)cc1Cl	ZINC000450618536	FD	On-Demand	Anodyne	CNR1	84	43
Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)nn1-c1ccc(Cl)cc1Cl	ZINC000450618536	FD	On-Demand	Anodyne	CNR2	35	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1	ZINC000450618538	EF	On-Demand	Anodyne	ADAM17	25	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1	ZINC000450618540	EF	On-Demand	Anodyne	ADAM17	25	41
Cc1cc(F)c(CC(=O)N2CCn3c(O)nnc3C2)cc1F	ZINC000450618541	DD	On-Demand	Anodyne	DPP4	22	48
OCCCN1CCC[C@@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450618549	FF	On-Demand	Anodyne	EHMT2	41	30
OCCCN1CCC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450618550	FF	On-Demand	Anodyne	EHMT2	41	30
CC1=CCN(CCNC(=O)c2cccc(C#N)c2Br)CC1	ZINC000450618570	EF	On-Demand	Mild	DRD4	45	36
CC1=CCN(CCNC(=O)c2cccc(C#N)c2Br)CC1	ZINC000450618570	EF	On-Demand	Mild	DRD3	15	41
CS(=O)(=O)N1CC[C@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450618588	DC	On-Demand	Anodyne	ADRB3	0	42
Cc1[nH]c(C#N)cc1C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450618590	DF	On-Demand	Mild	FPR2	28	40
CS(=O)(=O)N1CC[C@@H](CN2C(=O)c3ccccc3C2=O)C1	ZINC000450618599	DC	On-Demand	Anodyne	ADRB3	0	42
COc1ccc(CC(=O)NC2Cc3ccccc3C2)c(Cl)c1OC	ZINC000450618604	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	DRD4	38	41
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	HRH1	25	44
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	DRD3	26	41
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	HTR4	51	35
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	SIGMAR1	41	46
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	SSTR5	76	44
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	CCR3	33	40
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	UTS2R	30	42
COc1cc(CN2CCC(OCCO)CC2)ccc1Cl	ZINC000450618605	CE	On-Demand	Anodyne	MCHR1	25	45
COC(=O)c1coc(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)n1	ZINC000450618606	FF	On-Demand	Anodyne	COLA	63	35
COC(=O)c1coc(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)n1	ZINC000450618606	FF	On-Demand	Anodyne	CPT1A	48	35
COC(=O)c1coc(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)n1	ZINC000450618607	FF	On-Demand	Anodyne	COLA	63	35
COC(=O)c1coc(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)n1	ZINC000450618607	FF	On-Demand	Anodyne	CPT1A	48	35
COC(=O)c1ccc(CN2CCCC[C@H]2[C@H](O)C(F)(F)F)cc1Cl	ZINC000450618616	FG	On-Demand	Anodyne	OPRK1	23	40
COC(=O)c1ccc(CN2CCCC[C@@H]2[C@H](O)C(F)(F)F)cc1Cl	ZINC000450618617	FG	On-Demand	Anodyne	OPRK1	23	40
COC(=O)c1ccc(CN2CCCC[C@H]2[C@@H](O)C(F)(F)F)cc1Cl	ZINC000450618618	FG	On-Demand	Anodyne	OPRK1	23	40
COC(=O)c1ccc(CN2CCCC[C@@H]2[C@@H](O)C(F)(F)F)cc1Cl	ZINC000450618619	FG	On-Demand	Anodyne	OPRK1	23	40
O=C(NC1Cc2ccccc2C1)[C@@H]1CCCCN1C1CCCC1	ZINC000450618650	DG	On-Demand	Anodyne	EPHX2	24	40
O=C(NC1Cc2ccccc2C1)[C@H]1CCCCN1C1CCCC1	ZINC000450618651	DG	On-Demand	Anodyne	EPHX2	24	40
CCCCN(CCCO)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450618652	FD	On-Demand	Anodyne	FKBP1A	44	48
CCCCN(CCCO)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450618652	FD	On-Demand	Anodyne	CCR4	0	45
CCCCN(CCCO)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450618652	FD	On-Demand	Anodyne	ITGA4	31	41
CCCCN(CCCO)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450618652	FD	On-Demand	Anodyne	CAPNS1	20	41
CCCCN(CCCO)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450618652	FD	On-Demand	Anodyne	MMP7	45	37
C=CCOc1ccc(CC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450618669	CC	On-Demand	Mild	TRAR	42	32
C=CCOc1ccc(CC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450618670	CC	On-Demand	Mild	TRAR	42	32
CN(C)S(=O)(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450618673	ED	On-Demand	Bother	BDKRB1	23	41
COC(=O)c1cccc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)c1Cl	ZINC000450618686	GE	On-Demand	Anodyne	BDKRB1	23	42
CC(C)N(C[C@H](O)COc1ccc(CC(N)=O)cc1)CC1(C#N)CCC1	ZINC000450618687	FD	On-Demand	Mild	ADRB1	15	51
CC(C)N(C[C@@H](O)COc1ccc(CC(N)=O)cc1)CC1(C#N)CCC1	ZINC000450618688	FD	On-Demand	Mild	ADRB1	15	51
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	HTR1A	19	45
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	DRD2	20	45
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	HRH2	17	41
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	HTR2A	19	45
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	HRH1	42	40
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	DRD3	20	40
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	HRH3	17	41
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	CCR3	39	43
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	CACNA1I	41	37
CCC(=O)CCCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450618696	CH	On-Demand	Anodyne	CYP2J2	47	33
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	HTR1A	19	45
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	DRD2	20	45
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	HRH2	17	41
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	HTR2A	19	45
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	HRH1	42	40
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	DRD3	20	40
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	HRH3	17	41
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	CCR3	39	43
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	CACNA1I	41	37
CCC(=O)CCCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450618697	CH	On-Demand	Anodyne	CYP2J2	47	33
Cc1ccc(-n2nc(C(=O)N[C@H]3CN(C)NC3=O)c3c2CCC3)c(C)c1	ZINC000450618707	FD	On-Demand	Anodyne	CNR1	41	35
Cc1ccc(-n2nc(C(=O)N[C@@H]3CN(C)NC3=O)c3c2CCC3)c(C)c1	ZINC000450618708	FD	On-Demand	Anodyne	CNR1	41	35
CC(C)(C)OC1CC(Sc2nc3ccccc3c(=O)n2CCCO)C1	ZINC000450618718	FG	On-Demand	Anodyne	SLC16A1	45	31
CCN(CCC1CC1)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450618721	EG	On-Demand	Anodyne	ACKR3	44	31
CCCC[C@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OC	ZINC000450618735	EG	On-Demand	Anodyne	PAM	0	43
CCCC[C@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OC	ZINC000450618735	EG	On-Demand	Anodyne	HDA106	0	48
CCCC[C@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OC	ZINC000450618735	EG	On-Demand	Anodyne	NOD1	75	34
CCCC[C@@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OC	ZINC000450618736	EG	On-Demand	Anodyne	PAM	0	43
CCCC[C@@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OC	ZINC000450618736	EG	On-Demand	Anodyne	HDA106	0	48
CCCC[C@@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OC	ZINC000450618736	EG	On-Demand	Anodyne	NOD1	75	34
CCC(=O)CCCN(C)Cc1cccc(OC(C)C)c1	ZINC000450618741	CH	On-Demand	Anodyne	ACHE	28	52
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)N[C@@H]3CN(C)NC3=O)C2)cc1	ZINC000450618745	GB	On-Demand	Anodyne	EPHX2	31	42
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)N[C@@H]3CN(C)NC3=O)C2)cc1	ZINC000450618745	GB	On-Demand	Anodyne	AKR1C3	28	44
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)N[C@H]3CN(C)NC3=O)C2)cc1	ZINC000450618749	GB	On-Demand	Anodyne	EPHX2	31	42
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)N[C@H]3CN(C)NC3=O)C2)cc1	ZINC000450618749	GB	On-Demand	Anodyne	AKR1C3	28	44
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)N[C@@H]3CN(C)NC3=O)C2)cc1	ZINC000450618752	GB	On-Demand	Anodyne	EPHX2	31	42
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)N[C@@H]3CN(C)NC3=O)C2)cc1	ZINC000450618752	GB	On-Demand	Anodyne	AKR1C3	28	44
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)N[C@H]3CN(C)NC3=O)C2)cc1	ZINC000450618753	GB	On-Demand	Anodyne	EPHX2	31	42
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)N[C@H]3CN(C)NC3=O)C2)cc1	ZINC000450618753	GB	On-Demand	Anodyne	AKR1C3	28	44
CC[C@@H](CC(F)(F)F)NC(=O)c1cnn2ccc(C)cc12	ZINC000450618772	CG	On-Demand	Anodyne	EPHB3	35	50
CC[C@H](CC(F)(F)F)NC(=O)c1cnn2ccc(C)cc12	ZINC000450618773	CG	On-Demand	Anodyne	EPHB3	35	50
COC(=O)c1cn([C@@H]2CCN(C(=O)c3cccc(SC)c3)C2)nn1	ZINC000450618775	ED	On-Demand	Anodyne	RHOA	0	41
COC(=O)c1cn([C@H]2CCN(C(=O)c3cccc(SC)c3)C2)nn1	ZINC000450618776	ED	On-Demand	Anodyne	RHOA	0	41
CC1(C(=O)NC[C@]2(C)CCCc3ccccc32)CCC(=O)CC1	ZINC000450618780	DH	On-Demand	Anodyne	NR3C1	0	40
CC1(C(=O)NC[C@@]2(C)CCCc3ccccc32)CCC(=O)CC1	ZINC000450618781	DH	On-Demand	Anodyne	NR3C1	0	40
Clc1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450618792	BG	On-Demand	Anodyne	CHRNA10	19	41
Clc1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450618794	BG	On-Demand	Anodyne	CHRNA10	19	41
CN1C[C@@H](NC(=O)CCc2cc(Br)cs2)C(=O)N1	ZINC000450618795	EC	On-Demand	Anodyne	LUXR	43	37
CN1C[C@H](NC(=O)CCc2cc(Br)cs2)C(=O)N1	ZINC000450618797	EC	On-Demand	Anodyne	LUXR	43	37
O=C(NCCO)c1ccc(NCCOc2ccc(F)c(Cl)c2)nn1	ZINC000450618805	FC	On-Demand	Anodyne	ALPL	43	38
NS(=O)(=O)[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450618820	CD	On-Demand	Anodyne	SLC6A1	42	35
NS(=O)(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450618822	CD	On-Demand	Anodyne	SLC6A1	42	35
NS(=O)(=O)[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450618823	CD	On-Demand	Anodyne	SLC6A1	42	35
NS(=O)(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450618824	CD	On-Demand	Anodyne	SLC6A1	42	35
COc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OCc1ccccc1Cl	ZINC000450618825	GE	On-Demand	Anodyne	CPT1A	44	31
COc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OCc1ccccc1Cl	ZINC000450618833	GE	On-Demand	Anodyne	CPT1A	44	31
N#CC1(COc2ccc(C(N)=O)cc2)CCC1	ZINC000450618835	BD	On-Demand	Mild	CHEK2	45	35
CN1C[C@@H](NC(=O)COc2cccc(NC(=O)C3CC3)c2)C(=O)N1	ZINC000450618852	EB	On-Demand	Anodyne	F10	0	45
CN1C[C@H](NC(=O)COc2cccc(NC(=O)C3CC3)c2)C(=O)N1	ZINC000450618860	EB	On-Demand	Anodyne	F10	0	45
Cc1nc(NCc2nc(C)c(Br)s2)ncc1[N+](=O)[O-]	ZINC000450618865	EF	On-Demand	Bother	PRKCQ	40	35
CCOC(=O)c1ccc(CN2CC=C(C)CC2)nc1	ZINC000450618866	CE	On-Demand	Anodyne	NOD2	17	40
COc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1OC(C)C	ZINC000450618896	EI	On-Demand	Anodyne	MTTP	62	38
COc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1OC(C)C	ZINC000450618896	EI	On-Demand	Anodyne	ENPP1	49	32
COc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1OC(C)C	ZINC000450618896	EI	On-Demand	Anodyne	KCNK3	56	43
COc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1OC(C)C	ZINC000450618896	EI	On-Demand	Anodyne	KCNK9	56	43
COc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1OC(C)C	ZINC000450618897	EI	On-Demand	Anodyne	MTTP	62	38
COc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1OC(C)C	ZINC000450618897	EI	On-Demand	Anodyne	ENPP1	49	32
COc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1OC(C)C	ZINC000450618897	EI	On-Demand	Anodyne	KCNK3	56	43
COc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1OC(C)C	ZINC000450618897	EI	On-Demand	Anodyne	KCNK9	56	43
O=[N+]([O-])c1cccc(OCC[C@@H]2CCOC2)c1	ZINC000450618933	BE	On-Demand	Bother	ACR	22	41
O=[N+]([O-])c1cccc(OCC[C@@H]2CCOC2)c1	ZINC000450618933	BE	On-Demand	Bother	ATSA	0	40
O=[N+]([O-])c1cccc(OCC[C@H]2CCOC2)c1	ZINC000450618934	BE	On-Demand	Bother	ACR	22	41
O=[N+]([O-])c1cccc(OCC[C@H]2CCOC2)c1	ZINC000450618934	BE	On-Demand	Bother	ATSA	0	40
CCOC(=O)c1sc2nc(CN(C)C)nc(NCc3ccnc(C)c3)c2c1C	ZINC000450618936	GH	On-Demand	Anodyne	CHRM4	24	49
COc1ccc([N+](=O)[O-])cc1OCc1cn(C)nc1C	ZINC000450618946	CE	On-Demand	Bother	CYP19A1	15	42
COc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1OC(C)C	ZINC000450618950	GH	On-Demand	Anodyne	ANPEP	31	42
COc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1OC(C)C	ZINC000450618950	GH	On-Demand	Anodyne	ADAM17	0	43
COc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1OC(C)C	ZINC000450618950	GH	On-Demand	Anodyne	ENPP1	71	34
CCOCc1nc(C)c(C(=O)Nc2ccc(OC)c(OC(C)C)c2)s1	ZINC000450618952	FI	On-Demand	Anodyne	ENPP1	74	36
CCOCc1nc(C)c(C(=O)Nc2ccc(OC)c(OC(C)C)c2)s1	ZINC000450618952	FI	On-Demand	Anodyne	DRTS_TRYCR	45	33
COc1ccc([N+](=O)[O-])cc1OC[C@H](Cc1ccccc1)OC	ZINC000450618956	DG	On-Demand	Bother	CYP19A1	15	42
COc1ccc([N+](=O)[O-])cc1OC[C@@H](Cc1ccccc1)OC	ZINC000450618957	DG	On-Demand	Bother	CYP19A1	15	42
COc1cc(CC(=O)N[C@@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618963	DG	On-Demand	Anodyne	TRPV1	18	53
COc1cc(CC(=O)N[C@@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618963	DG	On-Demand	Anodyne	TTR	0	48
COc1cc(CC(=O)N[C@@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618963	DG	On-Demand	Anodyne	NCE103	35	48
COc1cc(CC(=O)N[C@@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618963	DG	On-Demand	Anodyne	MTCA1	20	48
COc1cc(CC(=O)N[C@@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618963	DG	On-Demand	Anodyne	P96878_MYCTU	20	41
COc1cc(CC(=O)N[C@@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618963	DG	On-Demand	Anodyne	CAN2	0	48
COc1cc(CC(=O)N[C@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618964	DG	On-Demand	Anodyne	TRPV1	18	53
COc1cc(CC(=O)N[C@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618964	DG	On-Demand	Anodyne	TTR	0	48
COc1cc(CC(=O)N[C@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618964	DG	On-Demand	Anodyne	NCE103	35	48
COc1cc(CC(=O)N[C@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618964	DG	On-Demand	Anodyne	MTCA1	20	48
COc1cc(CC(=O)N[C@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618964	DG	On-Demand	Anodyne	P96878_MYCTU	20	41
COc1cc(CC(=O)N[C@H](C)c2c(C)cccc2C)ccc1O	ZINC000450618964	DG	On-Demand	Anodyne	CAN2	0	48
C[C@H](O)CCN1CCC[C@H](COc2ccccc2Cl)C1	ZINC000450618965	CG	On-Demand	Anodyne	SLC6A1	97	40
C[C@@H](O)CCN1CCC[C@H](COc2ccccc2Cl)C1	ZINC000450618966	CG	On-Demand	Anodyne	SLC6A1	97	40
C[C@H](O)CCN1CCC[C@@H](COc2ccccc2Cl)C1	ZINC000450618967	CG	On-Demand	Anodyne	SLC6A1	97	40
C[C@@H](O)CCN1CCC[C@@H](COc2ccccc2Cl)C1	ZINC000450618968	CG	On-Demand	Anodyne	SLC6A1	97	40
COC(=O)c1cn([C@@H]2CCCN(C(=O)Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450619007	GE	On-Demand	Anodyne	OPRK1	39	40
COC(=O)c1cn([C@H]2CCCN(C(=O)Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450619008	GE	On-Demand	Anodyne	OPRK1	39	40
CCOC(=O)c1cc(C(=O)NCC2(CC)CCCCC2)on1	ZINC000450619012	DF	On-Demand	Anodyne	HCN1	54	34
CCOC(=O)c1cc(C(=O)NCC2(CC)CCCCC2)on1	ZINC000450619012	DF	On-Demand	Anodyne	HCN4	52	34
COc1cc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)ccc1Cl	ZINC000450619024	FE	On-Demand	Anodyne	DRD2	15	43
COc1cc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)ccc1Cl	ZINC000450619024	FE	On-Demand	Anodyne	HRH3	15	42
COc1cc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)ccc1Cl	ZINC000450619024	FE	On-Demand	Anodyne	SSTR5	72	45
COc1cc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)ccc1Cl	ZINC000450619024	FE	On-Demand	Anodyne	BDKRB1	18	40
COc1cc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)ccc1Cl	ZINC000450619024	FE	On-Demand	Anodyne	MCHR1	15	42
COc1cc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)ccc1Cl	ZINC000450619024	FE	On-Demand	Anodyne	MGLL	0	40
COc1cc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)ccc1Cl	ZINC000450619024	FE	On-Demand	Anodyne	CCR8	43	43
COc1cc(CN2CCN(C(=O)c3ccc(O)nc3)CC2)ccc1Cl	ZINC000450619024	FE	On-Demand	Anodyne	ABHD6	0	40
Cc1cnc(NC[C@H]2CCCCN2CCO)c([N+](=O)[O-])c1	ZINC000450619031	CD	On-Demand	Bother	PRKCQ	41	35
Cc1cnc(NC[C@@H]2CCCCN2CCO)c([N+](=O)[O-])c1	ZINC000450619032	CD	On-Demand	Bother	PRKCQ	41	35
O=C(C[C@@H]1CC[C@H]2C[C@H]12)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450619052	FJ	On-Demand	Anodyne	ADAM10	31	40
CCc1cc(NC[C@H]2CCCCN2CCO)n2ncnc2n1	ZINC000450619058	DC	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@@H]2CCCCN2CCO)n2ncnc2n1	ZINC000450619059	DC	On-Demand	Anodyne	DHOD	0	44
COc1cc(C(=O)N2CCN(c3cccc(C#N)n3)CC2)c([N+](=O)[O-])cc1F	ZINC000450619061	GD	On-Demand	Mild	SLC6A9	37	41
CN(CC1=CCCCC1)Cc1cccnc1	ZINC000450619064	BG	On-Demand	Anodyne	NR1D1	41	36
COC(=O)c1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450619067	FG	On-Demand	Anodyne	PRSS1	18	43
COC(=O)c1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450619067	FG	On-Demand	Anodyne	F3	40	34
COC(=O)c1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450619067	FG	On-Demand	Anodyne	FLT4	15	40
COC(=O)c1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450619067	FG	On-Demand	Anodyne	ACR	50	43
COC(=O)c1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450619067	FG	On-Demand	Anodyne	ENPP1	67	39
COC(=O)c1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450619067	FG	On-Demand	Anodyne	IMDH_CRYPV	19	40
COC(=O)c1ccc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)cc1	ZINC000450619067	FG	On-Demand	Anodyne	DRTS_TRYCR	46	40
COc1ccc([N+](=O)[O-])cc1OCC(=O)CC(C)(C)C1CC1	ZINC000450619071	DG	On-Demand	Bother	SLC27A4	48	31
COc1ccc([N+](=O)[O-])cc1OCC(=O)CC(C)(C)C1CC1	ZINC000450619071	DG	On-Demand	Bother	ABHD6	0	43
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	ZINC000450619073	GG	On-Demand	Anodyne	ENPP2	42	33
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450619075	FJ	On-Demand	Anodyne	ADAM10	31	40
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450619076	FJ	On-Demand	Anodyne	ADAM10	31	40
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450619077	FJ	On-Demand	Anodyne	ADAM10	31	40
COC(=O)c1cn([C@@H]2CCCN(C(=O)c3cccc(SC)c3)C2)nn1	ZINC000450619083	FE	On-Demand	Anodyne	RHOA	0	45
COC(=O)c1cn([C@H]2CCCN(C(=O)c3cccc(SC)c3)C2)nn1	ZINC000450619084	FE	On-Demand	Anodyne	RHOA	0	45
O=C(C1CC1)C1(C(=O)N2CC=C(c3cccc(Br)c3)CC2)CC1	ZINC000450619085	FH	On-Demand	Anodyne	ADAM10	33	42
CC(C)OC(C)(C)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450619089	FI	On-Demand	Anodyne	QDPR	0	40
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	ZINC000450619090	GG	On-Demand	Anodyne	ENPP2	42	33
COCCOC[C@@H](O)CN1CCN(c2nc(C)c(C)s2)CC1	ZINC000450619091	EC	On-Demand	Anodyne	HSP90AB1	38	41
C[C@H](O)CCCN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619095	ED	On-Demand	Anodyne	GNAI1	0	49
C[C@H](O)CCCN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619095	ED	On-Demand	Anodyne	GNAI3	0	49
C[C@H](O)CCCN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619095	ED	On-Demand	Anodyne	GNAO1	0	49
C[C@@H](O)CCCN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619096	ED	On-Demand	Anodyne	GNAI1	0	49
C[C@@H](O)CCCN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619096	ED	On-Demand	Anodyne	GNAI3	0	49
C[C@@H](O)CCCN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619096	ED	On-Demand	Anodyne	GNAO1	0	49
COCCOC[C@H](O)CN1CCN(c2nc(C)c(C)s2)CC1	ZINC000450619122	EC	On-Demand	Anodyne	HSP90AB1	38	41
O=c1c2sccc2nc(SC[C@@H]2COCCO2)n1Cc1ccccc1	ZINC000450619127	FG	On-Demand	Anodyne	KIF11	16	41
CN1C[C@@H](NC(=O)CCCCC(=O)c2ccccc2)C(=O)N1	ZINC000450619152	DC	On-Demand	Anodyne	HDAC8	35	41
CN1C[C@@H](NC(=O)CCCCC(=O)c2ccccc2)C(=O)N1	ZINC000450619152	DC	On-Demand	Anodyne	HDAC11	44	36
CN1C[C@@H](NC(=O)CCCCC(=O)c2ccccc2)C(=O)N1	ZINC000450619152	DC	On-Demand	Anodyne	CYP2J2	49	34
CN1C[C@H](NC(=O)CCCCC(=O)c2ccccc2)C(=O)N1	ZINC000450619153	DC	On-Demand	Anodyne	HDAC8	35	41
CN1C[C@H](NC(=O)CCCCC(=O)c2ccccc2)C(=O)N1	ZINC000450619153	DC	On-Demand	Anodyne	HDAC11	44	36
CN1C[C@H](NC(=O)CCCCC(=O)c2ccccc2)C(=O)N1	ZINC000450619153	DC	On-Demand	Anodyne	CYP2J2	49	34
CCS(=O)(=O)c1ccc(CN(C)CCCC(=O)NC)cc1	ZINC000450619154	DD	On-Demand	Anodyne	RORC	60	42
Cc1ccc(-c2nnc(SCC[C@H]3CCOC3)n2C)cc1	ZINC000450619155	DG	On-Demand	Anodyne	DRD3	15	41
Cc1ccc(-c2nnc(SCC[C@@H]3CCOC3)n2C)cc1	ZINC000450619156	DG	On-Demand	Anodyne	DRD3	15	41
Cc1ccc2nc(COc3ccccc3C(=O)N[C@H]3CN(C)NC3=O)cn2c1	ZINC000450619157	GD	On-Demand	Anodyne	HCN1	42	31
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	HTR1A	16	44
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	DRD2	23	46
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	DRD4	54	52
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	HTR2A	23	46
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	HRH1	18	50
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	DRD3	18	42
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	SLC6A3	18	41
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	KCNQ2	34	46
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	SIGMAR1	36	46
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	CCR1	41	37
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	CCR3	20	40
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	ABCC1	40	32
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	CACNA1G	22	45
O=C(CN1CCN(CCc2ccc(Cl)cc2)CC1)Nc1ccccc1F	ZINC000450619158	GG	On-Demand	Anodyne	SLC27A1	40	35
CO[C@H](COc1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450619164	CG	On-Demand	Bother	CACNA1D	64	37
CO[C@H](COc1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450619164	CG	On-Demand	Bother	ATSA	0	41
CO[C@H](COc1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450619164	CG	On-Demand	Bother	PDS	83	60
CO[C@@H](COc1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450619165	CG	On-Demand	Bother	CACNA1D	64	37
CO[C@@H](COc1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450619165	CG	On-Demand	Bother	ATSA	0	41
CO[C@@H](COc1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450619165	CG	On-Demand	Bother	PDS	83	60
O=[N+]([O-])c1cccc(OCc2ccn(CC(F)(F)F)n2)c1	ZINC000450619167	DF	On-Demand	Bother	ACR	19	44
CCc1cc(CCCN2CCC(C(=O)NCCCN3CCCCC3)CC2)on1	ZINC000450619173	GF	On-Demand	Anodyne	CACNA1G	31	40
CCc1cc(CCCN2CCC(C(=O)NCCCN3CCCCC3)CC2)on1	ZINC000450619173	GF	On-Demand	Anodyne	GNAI1	0	45
CCc1cc(CCCN2CCC(C(=O)NCCCN3CCCCC3)CC2)on1	ZINC000450619173	GF	On-Demand	Anodyne	GNAI3	0	45
CCc1cc(CCCN2CCC(C(=O)NCCCN3CCCCC3)CC2)on1	ZINC000450619173	GF	On-Demand	Anodyne	GNAO1	0	45
CCc1cc(CCCN2CCC(C(=O)NCCCN3CCCCC3)CC2)on1	ZINC000450619173	GF	On-Demand	Anodyne	TBK1	78	38
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1	ZINC000450619176	FG	On-Demand	Anodyne	MLNR	25	44
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1	ZINC000450619176	FG	On-Demand	Anodyne	RORC	45	35
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1	ZINC000450619176	FG	On-Demand	Anodyne	NOD2	45	38
CCC(CC)Oc1ccc(C(=O)N2CCN(c3cccc(C#N)n3)CC2)cc1	ZINC000450619177	GG	On-Demand	Mild	SLC6A7	0	42
O=c1c2sccc2nc(SC[C@H]2COCCO2)n1Cc1ccccc1	ZINC000450619178	FG	On-Demand	Anodyne	KIF11	16	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450619182	FF	On-Demand	Anodyne	ENPP1	44	46
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450619186	FF	On-Demand	Anodyne	ENPP1	44	46
O=C(Cc1cc2ccccc2c(O)n1)N1CCCC[C@H]1c1ccccc1	ZINC000450619199	EI	On-Demand	Anodyne	CPT1A	120	39
O=C(Cc1cc2ccccc2c(O)n1)N1CCCC[C@H]1c1ccccc1	ZINC000450619199	EI	On-Demand	Anodyne	GRIN2D	69	32
N#CC1(COc2cccc([N+](=O)[O-])c2)CCC1	ZINC000450619204	BF	On-Demand	Mild	ACR	22	43
N#CC1(COc2cccc([N+](=O)[O-])c2)CCC1	ZINC000450619204	BF	On-Demand	Mild	ATSA	0	42
CC(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619210	EI	On-Demand	Anodyne	FABI	41	32
CC(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619210	EI	On-Demand	Anodyne	HRH1	40	42
CC(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619210	EI	On-Demand	Anodyne	PTAFR	30	43
CC(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619210	EI	On-Demand	Anodyne	PDE6D	55	43
CC(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619210	EI	On-Demand	Anodyne	CDPK1	0	41
CN1C[C@H](NC(=O)c2c3c(nc4ccccc24)CCC3)C(=O)N1	ZINC000450619212	DC	On-Demand	Anodyne	BCHE	75	37
Cc1ccc2nc(COc3ccccc3C(=O)N[C@@H]3CN(C)NC3=O)cn2c1	ZINC000450619214	GD	On-Demand	Anodyne	HCN1	42	31
COc1cccc(OCCC(=O)N(C)C[C@@H](O)C(F)(F)F)c1	ZINC000450619215	DD	On-Demand	Anodyne	MTNR1A	24	45
COc1cccc(OCCC(=O)N(C)C[C@@H](O)C(F)(F)F)c1	ZINC000450619215	DD	On-Demand	Anodyne	MTNR1B	27	41
CC(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619216	EI	On-Demand	Anodyne	FABI	41	32
CC(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619216	EI	On-Demand	Anodyne	HRH1	40	42
CC(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619216	EI	On-Demand	Anodyne	PTAFR	30	43
CC(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619216	EI	On-Demand	Anodyne	PDE6D	55	43
CC(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1	ZINC000450619216	EI	On-Demand	Anodyne	CDPK1	0	41
COc1cccc(OCCC(=O)N(C)C[C@H](O)C(F)(F)F)c1	ZINC000450619217	DD	On-Demand	Anodyne	MTNR1A	24	45
COc1cccc(OCCC(=O)N(C)C[C@H](O)C(F)(F)F)c1	ZINC000450619217	DD	On-Demand	Anodyne	MTNR1B	27	41
CC(=O)c1ccc2c(c1)CCN(Cc1ccn(CCc3ccccc3)n1)CC2	ZINC000450619219	FH	On-Demand	Anodyne	SIGMAR1	21	40
CC(=O)c1ccc2c(c1)CCN(Cc1ccn(CCc3ccccc3)n1)CC2	ZINC000450619219	FH	On-Demand	Anodyne	NOD2	40	33
O=C(NC1CC1)N[C@@H]1CCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450619222	FE	On-Demand	Anodyne	CCR3	16	40
O=C(NC1CC1)N[C@H]1CCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450619224	FE	On-Demand	Anodyne	CCR3	16	40
O=C(Cc1cc2ccccc2c(O)n1)N1CCCC[C@@H]1c1ccccc1	ZINC000450619225	EI	On-Demand	Anodyne	CPT1A	120	39
O=C(Cc1cc2ccccc2c(O)n1)N1CCCC[C@@H]1c1ccccc1	ZINC000450619225	EI	On-Demand	Anodyne	GRIN2D	69	32
CC[C@H](C)[C@@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450619232	EG	On-Demand	Anodyne	BDKRB1	0	40
CC[C@H](C)[C@@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450619232	EG	On-Demand	Anodyne	PTR1	46	33
CC[C@@H](C)[C@@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450619235	EG	On-Demand	Anodyne	BDKRB1	0	40
CC[C@@H](C)[C@@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450619235	EG	On-Demand	Anodyne	PTR1	46	33
CC[C@H](C)[C@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450619237	EG	On-Demand	Anodyne	BDKRB1	0	40
CC[C@H](C)[C@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450619237	EG	On-Demand	Anodyne	PTR1	46	33
CC[C@@H](C)[C@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450619239	EG	On-Demand	Anodyne	BDKRB1	0	40
CC[C@@H](C)[C@H](CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450619239	EG	On-Demand	Anodyne	PTR1	46	33
COc1cccc(OCCC(=O)NC[C@@H]2CCC[C@@H]2OC)c1	ZINC000450619252	DE	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1cccc(OCCC(=O)NC[C@@H]2CCC[C@@H]2OC)c1	ZINC000450619252	DE	On-Demand	Anodyne	MTNR1A	49	41
COc1cccc(OCCC(=O)NC[C@H]2CCC[C@@H]2OC)c1	ZINC000450619254	DE	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1cccc(OCCC(=O)NC[C@H]2CCC[C@@H]2OC)c1	ZINC000450619254	DE	On-Demand	Anodyne	MTNR1A	49	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	MME	83	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	LTA4H	24	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	ANPEP	90	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	FCER2	52	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	PAPA1_CARPA	59	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	CYSP_TRYCR	43	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	TIMP3	72	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	GUAB	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	CAPNS1	56	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	MMP2	29	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	MMP3	57	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	MMP8	15	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	SOAT1	0	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	NPY5R	24	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	CAPN1	52	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	CAPN2	62	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	ACE2	57	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	PLAU	52	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	LAP3	46	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	MMP1	30	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	NPR	52	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	AMP1_PLAFQ	43	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619256	FH	On-Demand	Anodyne	ERAP1	0	41
COc1cccc(OCCC(=O)NC[C@H]2CCC[C@H]2OC)c1	ZINC000450619257	DE	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1cccc(OCCC(=O)NC[C@H]2CCC[C@H]2OC)c1	ZINC000450619257	DE	On-Demand	Anodyne	MTNR1A	49	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	MME	83	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	LTA4H	24	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	ANPEP	90	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	FCER2	52	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	PAPA1_CARPA	59	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	CYSP_TRYCR	43	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	TIMP3	72	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	GUAB	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	CAPNS1	56	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	MMP2	29	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	MMP3	57	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	MMP8	15	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	SOAT1	0	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	NPY5R	24	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	CAPN1	52	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	CAPN2	62	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	ACE2	57	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	PLAU	52	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	LAP3	46	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	MMP1	30	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	NPR	52	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	AMP1_PLAFQ	43	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450619258	FH	On-Demand	Anodyne	ERAP1	0	41
COc1cccc(OCCC(=O)NC[C@@H]2CCC[C@H]2OC)c1	ZINC000450619260	DE	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1cccc(OCCC(=O)NC[C@@H]2CCC[C@H]2OC)c1	ZINC000450619260	DE	On-Demand	Anodyne	MTNR1A	49	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	MME	83	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	LTA4H	24	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	ANPEP	90	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	FCER2	52	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	PAPA1_CARPA	59	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	CYSP_TRYCR	43	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	TIMP3	72	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	GUAB	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	CAPNS1	56	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	MMP2	29	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	MMP3	57	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	MMP8	15	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	SOAT1	0	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	NPY5R	24	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	CAPN1	52	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	CAPN2	62	37
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	ACE2	57	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	PLAU	52	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	LAP3	46	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	MMP1	30	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	NPR	52	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	AMP1_PLAFQ	43	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619262	FH	On-Demand	Anodyne	ERAP1	0	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	MME	83	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	LTA4H	24	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	ANPEP	90	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	FCER2	52	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	PAPA1_CARPA	59	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	CYSP_TRYCR	43	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	TIMP3	72	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	GUAB	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	CAPNS1	56	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	MMP2	29	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	MMP3	57	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	MMP8	15	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	SOAT1	0	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	NPY5R	24	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	CAPN1	52	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	CAPN2	62	37
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	ACE2	57	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	PLAU	52	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	LAP3	46	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	MMP1	30	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	NPR	52	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	AMP1_PLAFQ	43	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450619266	FH	On-Demand	Anodyne	ERAP1	0	41
C[C@H](Sc1nc2ccccc2c(=O)n1CCCO)C(=O)C1CCCCC1	ZINC000450619268	FG	On-Demand	Anodyne	SLC16A1	47	36
CN1C[C@@H](NC(=O)c2c3c(nc4ccccc24)CCC3)C(=O)N1	ZINC000450619269	DC	On-Demand	Anodyne	BCHE	75	37
C[C@@H](Sc1nc2ccccc2c(=O)n1CCCO)C(=O)C1CCCCC1	ZINC000450619275	FG	On-Demand	Anodyne	SLC16A1	47	36
CC[C@H](CC#N)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450619277	EG	On-Demand	Mild	ACACA	30	40
CC[C@H](CC#N)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450619277	EG	On-Demand	Mild	ACACB	15	40
CC[C@H](CC#N)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450619277	EG	On-Demand	Mild	MTNR1A	20	40
CC[C@H](CC#N)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450619277	EG	On-Demand	Mild	MTNR1B	24	44
COC(=O)c1csc(CN(C)Cc2cccc(OC(C)C)c2)n1	ZINC000450619290	EG	On-Demand	Anodyne	ROCK1	23	41
CC[C@@H](CC#N)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450619293	EG	On-Demand	Mild	ACACA	30	40
CC[C@@H](CC#N)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450619293	EG	On-Demand	Mild	MTNR1B	24	44
CC(C)(CC(=O)COc1ccc(C#N)cc1)C1CC1	ZINC000450619295	CG	On-Demand	Mild	PLA2G4B	56	35
CC(C)(CC(=O)COc1ccc(C#N)cc1)C1CC1	ZINC000450619295	CG	On-Demand	Mild	MEN1	42	35
Cc1nc2ccnn2cc1C(=O)NCCC[C@H]1CCCCO1	ZINC000450619296	DE	On-Demand	Anodyne	KIT	15	44
Cc1nc2ccnn2cc1C(=O)NCCC[C@H]1CCCCO1	ZINC000450619296	DE	On-Demand	Anodyne	DDR1	56	44
Cc1nc2ccnn2cc1C(=O)NCCC[C@@H]1CCCCO1	ZINC000450619304	DE	On-Demand	Anodyne	KIT	15	44
Cc1nc2ccnn2cc1C(=O)NCCC[C@@H]1CCCCO1	ZINC000450619304	DE	On-Demand	Anodyne	DDR1	56	44
Cc1ccc(S(=O)(=O)NCCC(=O)N[C@@H]2CN(C)NC2=O)cc1C	ZINC000450619309	FB	On-Demand	Anodyne	LEF	46	32
Cc1ccc(S(=O)(=O)NCCC(=O)N[C@H]2CN(C)NC2=O)cc1C	ZINC000450619316	FB	On-Demand	Anodyne	LEF	46	32
COc1ccc2c(c1)CCC[C@@H]2CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619321	DC	On-Demand	Anodyne	MTR1B_CHICK	0	44
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC1=CCOCC1	ZINC000450619329	EC	On-Demand	Anodyne	CA2	32	47
CC(=O)N[C@H](C(=O)NC1Cc2ccccc2C1)C(C)(C)C	ZINC000450619336	CD	On-Demand	Anodyne	APOB	0	40
Cc1nc(C(C)C)oc1COc1cccc(Cl)c1	ZINC000450619339	CI	On-Demand	Anodyne	MAOB	28	40
COc1ccc2c(c1)CCC[C@@H]2CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619353	DC	On-Demand	Anodyne	MTR1B_CHICK	0	44
COc1ccc2c(c1)CCC[C@@H]2CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619353	DC	On-Demand	Anodyne	BDKRB1	41	41
COc1ccc2c(c1)CCC[C@@H]2CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619353	DC	On-Demand	Anodyne	PPARD	52	45
COc1ccc2c(c1)CCC[C@H]2CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619355	DC	On-Demand	Anodyne	MTR1B_CHICK	0	44
COc1ccc2c(c1)CCC[C@H]2CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619355	DC	On-Demand	Anodyne	BDKRB1	41	41
COc1ccc2c(c1)CCC[C@H]2CC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619355	DC	On-Demand	Anodyne	PPARD	52	45
COc1ccc2c(c1)CCC[C@H]2CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619358	DC	On-Demand	Anodyne	MTR1B_CHICK	0	44
COc1ccc2c(c1)CCC[C@H]2CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619358	DC	On-Demand	Anodyne	BDKRB1	41	41
COc1ccc2c(c1)CCC[C@H]2CC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619358	DC	On-Demand	Anodyne	PPARD	52	45
Cc1cc(CNc2ccc(S(=O)(=O)N3CCCCC3)cn2)ccn1	ZINC000450619371	ED	On-Demand	Anodyne	NAMPT	41	43
COc1ccc(C(C)=O)c(OC[C@H](Cc2ccccc2)OC)c1	ZINC000450619377	DH	On-Demand	Anodyne	ABCB1	52	46
CCCc1c(NC(=O)c2sc(COCC)nc2C)cnn1-c1cc(C)ccn1	ZINC000450619378	GI	On-Demand	Anodyne	GPR142	42	34
CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OC	ZINC000450619383	GB	On-Demand	Anodyne	COLA	54	33
CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OC	ZINC000450619383	GB	On-Demand	Anodyne	CPT1A	48	33
CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OC	ZINC000450619383	GB	On-Demand	Anodyne	CPT1B	49	33
COc1ccc(C(C)=O)c(OC[C@@H](Cc2ccccc2)OC)c1	ZINC000450619385	DH	On-Demand	Anodyne	ABCB1	52	46
COc1ccc(C(C)=O)c(OC[C@@H](Cc2ccccc2)OC)c1	ZINC000450619385	DH	On-Demand	Anodyne	AKR1C2	41	36
COc1ccc(C(C)=O)c(OC[C@@H](Cc2ccccc2)OC)c1	ZINC000450619385	DH	On-Demand	Anodyne	PDS	69	42
CCC1(CNC(=O)Cc2ccc(O)c(F)c2)CCCCC1	ZINC000450619390	CH	On-Demand	Anodyne	NCE103	25	40
CCC1(CNC(=O)Cc2ccc(O)c(F)c2)CCCCC1	ZINC000450619390	CH	On-Demand	Anodyne	CAN2	0	40
COC(=O)c1ccc(OCC(=O)CC(C)(C)C2CC2)cc1	ZINC000450619394	CG	On-Demand	Anodyne	PLA2G4B	71	39
CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OC	ZINC000450619398	GB	On-Demand	Anodyne	COLA	54	33
CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OC	ZINC000450619398	GB	On-Demand	Anodyne	CPT1A	48	33
CCN(CC)S(=O)(=O)c1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OC	ZINC000450619398	GB	On-Demand	Anodyne	CPT1B	49	33
Cc1cc(CNc2nc(-c3ccccn3)nc3c2CCC3)ccn1	ZINC000450619406	DF	On-Demand	Anodyne	METAP1	33	41
CCS(=O)(=O)c1ccc(CN(C)CCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450619407	GE	On-Demand	Anodyne	RORC	24	40
Cc1cc(-c2nc(C(=O)NCCC[C@@H]3CCCCO3)co2)ccn1	ZINC000450619409	EG	On-Demand	Anodyne	TBXA2R	25	47
Cc1cc(-c2nc(C(=O)NCCC[C@H]3CCCCO3)co2)ccn1	ZINC000450619419	EG	On-Demand	Anodyne	TBXA2R	25	47
CCOc1ccc2nc(SC[C@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450619431	DH	On-Demand	Anodyne	CYP2C19	35	43
O=c1c2ccccc2nc(SCn2cccn2)n1CCCO	ZINC000450619437	DD	On-Demand	Anodyne	SLC16A1	46	32
COCCOC[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450619440	DD	On-Demand	Anodyne	DRD5	19	44
COCCOC[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450619440	DD	On-Demand	Anodyne	HTR5A	20	52
COCCOC[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450619442	DD	On-Demand	Anodyne	DRD5	19	44
COCCOC[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450619442	DD	On-Demand	Anodyne	HTR5A	20	52
CN1C[C@@H](NC(=O)CN2C(=O)CCc3ccccc32)C(=O)N1	ZINC000450619446	DB	On-Demand	Anodyne	ACE	19	41
CN1C[C@H](NC(=O)CN2C(=O)CCc3ccccc32)C(=O)N1	ZINC000450619448	DB	On-Demand	Anodyne	ACE	19	41
CCOc1ccc2nc(SC[C@@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450619450	DH	On-Demand	Anodyne	CYP2C19	35	43
CC[C@H](CC#N)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450619453	CE	On-Demand	Mild	MMP13	17	42
CC(=O)CCc1ccc(OCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450619464	EC	On-Demand	Anodyne	CYSLTR2	41	31
CC[C@@H](CC#N)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450619467	CE	On-Demand	Mild	MMP13	17	42
CC(=O)c1ccc(CN(C)Cc2cccc(OC(C)C)c2)cc1	ZINC000450619472	DI	On-Demand	Anodyne	ACHE	26	48
CC(=O)c1ccc(CN(C)Cc2cccc(OC(C)C)c2)cc1	ZINC000450619472	DI	On-Demand	Anodyne	HSD17B2	25	43
CC(=O)c1ccc(CN(C)Cc2cccc(OC(C)C)c2)cc1	ZINC000450619472	DI	On-Demand	Anodyne	PTGES	0	43
COC(=O)c1ccc(CN(C)C[C@@H]2CCN(C(C)=O)C2)cc1Cl	ZINC000450619474	EE	On-Demand	Anodyne	CACNA1I	40	31
CC(=O)CCc1ccc(OCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450619475	EC	On-Demand	Anodyne	CYSLTR2	41	31
COC(=O)c1ccc(CN(C)C[C@H]2CCN(C(C)=O)C2)cc1Cl	ZINC000450619480	EE	On-Demand	Anodyne	CACNA1I	40	31
O=C1c2ccccc2C(=O)N1C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000450619481	FF	On-Demand	Anodyne	DRD3	0	44
O=C1c2ccccc2C(=O)N1C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000450619487	FF	On-Demand	Anodyne	DRD3	0	44
O=C(CCCN1CCCC[C@@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619491	EH	On-Demand	Anodyne	DRD2	27	40
O=C(CCCN1CCCC[C@@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619491	EH	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCCC[C@@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619491	EH	On-Demand	Anodyne	HTR2A	19	45
O=C(CCCN1CCCC[C@@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619491	EH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCCC[C@@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619491	EH	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCCC[C@@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619491	EH	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCCC[C@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619493	EH	On-Demand	Anodyne	DRD2	27	40
O=C(CCCN1CCCC[C@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619493	EH	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCCC[C@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619493	EH	On-Demand	Anodyne	HTR2A	19	45
O=C(CCCN1CCCC[C@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619493	EH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCCC[C@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619493	EH	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCCC[C@H]1[C@@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619493	EH	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCCC[C@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619496	EH	On-Demand	Anodyne	DRD2	27	40
O=C(CCCN1CCCC[C@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619496	EH	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCCC[C@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619496	EH	On-Demand	Anodyne	HTR2A	19	45
O=C(CCCN1CCCC[C@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619496	EH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCCC[C@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619496	EH	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCCC[C@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619496	EH	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCCC[C@@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619498	EH	On-Demand	Anodyne	DRD2	27	40
O=C(CCCN1CCCC[C@@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619498	EH	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCCC[C@@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619498	EH	On-Demand	Anodyne	HTR2A	19	45
O=C(CCCN1CCCC[C@@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619498	EH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCCC[C@@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619498	EH	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCCC[C@@H]1[C@H](O)C(F)(F)F)c1ccc(F)cc1	ZINC000450619498	EH	On-Demand	Anodyne	CYP2J2	49	35
CCN(CCC1CC1)C(=O)c1cccc(SC)c1	ZINC000450619514	CH	On-Demand	Anodyne	OPRD1	31	49
CCN(CCC1CC1)C(=O)c1cccc(SC)c1	ZINC000450619514	CH	On-Demand	Anodyne	ACKR3	44	31
CC(C)c1nnc(COc2ccc(C(F)(F)F)cc2)s1	ZINC000450619516	DI	On-Demand	Anodyne	PPARD	29	43
CN1C[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619521	GB	On-Demand	Bother	FKBP1A	17	46
CN1C[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619521	GB	On-Demand	Bother	CASP3	28	40
CN1C[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619521	GB	On-Demand	Bother	CCR4	0	42
CN1C[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619521	GB	On-Demand	Bother	MMP1	23	40
Cc1nc(NCCOc2ccc(F)c(Cl)c2)c2cnn(C)c2n1	ZINC000450619528	EF	On-Demand	Anodyne	Q9M629_MAIZE	56	35
CN1C[C@@H](NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619531	GB	On-Demand	Bother	FKBP1A	17	46
CN1C[C@@H](NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619531	GB	On-Demand	Bother	CASP3	28	40
CN1C[C@@H](NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619531	GB	On-Demand	Bother	CCR4	0	42
CN1C[C@@H](NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619531	GB	On-Demand	Bother	MMP1	23	40
CN1C[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619533	GB	On-Demand	Bother	FKBP1A	17	46
CN1C[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619533	GB	On-Demand	Bother	CASP3	28	40
CN1C[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619533	GB	On-Demand	Bother	CCR4	0	42
CN1C[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619533	GB	On-Demand	Bother	MMP1	23	40
CN1C[C@H](NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619534	GB	On-Demand	Bother	FKBP1A	17	46
CN1C[C@H](NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619534	GB	On-Demand	Bother	CASP3	28	40
CN1C[C@H](NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619534	GB	On-Demand	Bother	CCR4	0	42
CN1C[C@H](NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450619534	GB	On-Demand	Bother	MMP1	23	40
CC[C@H](CC#N)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450619548	CF	On-Demand	Mild	P2RX7	0	42
CC[C@H](CC#N)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450619548	CF	On-Demand	Mild	NCE103	19	40
CC[C@H](CC#N)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450619548	CF	On-Demand	Mild	CAN2	0	40
Cc1sc2ncnc(N3CCC(C(=O)N[C@@H]4CN(C)NC4=O)CC3)c2c1C	ZINC000450619551	GC	On-Demand	Anodyne	SIRT3	42	31
Cc1sc2ncnc(N3CCC(C(=O)N[C@@H]4CN(C)NC4=O)CC3)c2c1C	ZINC000450619551	GC	On-Demand	Anodyne	LIMK2	20	40
CC[C@@H](CC#N)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450619553	CF	On-Demand	Mild	P2RX7	0	42
CC[C@@H](CC#N)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450619553	CF	On-Demand	Mild	NCE103	19	40
CC[C@@H](CC#N)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450619553	CF	On-Demand	Mild	CAN2	0	40
COC(=O)c1csc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)n1	ZINC000450619554	FG	On-Demand	Anodyne	CCR3	33	41
COC(=O)c1csc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)n1	ZINC000450619554	FG	On-Demand	Anodyne	MCHR1	20	41
COC(=O)c1csc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)n1	ZINC000450619555	FG	On-Demand	Anodyne	CCR3	33	41
COC(=O)c1csc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)n1	ZINC000450619555	FG	On-Demand	Anodyne	MCHR1	20	41
CC1=CCN(CCNC(=O)c2cc(C)cs2)CC1	ZINC000450619557	CE	On-Demand	Anodyne	DRD4	42	34
COC(=O)c1csc(CN2CCc3c(F)cccc3C2)n1	ZINC000450619558	DF	On-Demand	Anodyne	NOD2	44	39
Cc1sc2ncnc(N3CCC(C(=O)N[C@H]4CN(C)NC4=O)CC3)c2c1C	ZINC000450619559	GC	On-Demand	Anodyne	SIRT3	42	31
Cc1sc2ncnc(N3CCC(C(=O)N[C@H]4CN(C)NC4=O)CC3)c2c1C	ZINC000450619559	GC	On-Demand	Anodyne	LIMK2	20	40
CN1C[C@@H](NC(=O)CC2(CC(=O)Nc3nccs3)CCCCC2)C(=O)N1	ZINC000450619560	GD	On-Demand	Anodyne	MAP1	67	36
CN1C[C@H](NC(=O)CC2(CC(=O)Nc3nccs3)CCCCC2)C(=O)N1	ZINC000450619562	GD	On-Demand	Anodyne	MAP1	67	36
CCc1cc2c(NCc3nc(C)c(Br)s3)ncnc2s1	ZINC000450619564	FI	On-Demand	Anodyne	CLK4	42	34
CCS(=O)(=O)c1ccc(COc2cc([N+](=O)[O-])ccc2OC)cc1	ZINC000450619568	FF	On-Demand	Bother	CYP19A1	0	57
CN1C[C@@H](NC(=O)CCOc2ccc(F)cc2)C(=O)N1	ZINC000450619573	CC	On-Demand	Anodyne	CVIR	0	40
CN1C[C@H](NC(=O)CCOc2ccc(F)cc2)C(=O)N1	ZINC000450619575	CC	On-Demand	Anodyne	CVIR	0	40
C[C@@H]1COCCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450619587	CE	On-Demand	Anodyne	CASR	44	35
C[C@@H]1COCCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450619588	CE	On-Demand	Anodyne	CASR	44	35
C[C@@H]1COCCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450619589	CE	On-Demand	Anodyne	CASR	44	35
C[C@@H]1COCCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450619590	CE	On-Demand	Anodyne	CASR	44	35
CN1C[C@@H](NC(=O)Cc2csc(NC(=O)c3ccccc3)n2)C(=O)N1	ZINC000450619596	FC	On-Demand	Anodyne	PDE5A	0	60
CN1C[C@@H](NC(=O)Cc2csc(NC(=O)c3ccccc3)n2)C(=O)N1	ZINC000450619596	FC	On-Demand	Anodyne	GMPS	0	47
CN1C[C@H](NC(=O)Cc2csc(NC(=O)c3ccccc3)n2)C(=O)N1	ZINC000450619597	FC	On-Demand	Anodyne	PDE5A	0	60
CN1C[C@H](NC(=O)Cc2csc(NC(=O)c3ccccc3)n2)C(=O)N1	ZINC000450619597	FC	On-Demand	Anodyne	GMPS	0	47
O=C(CCCN1CCO[C@H](c2cccc(OC(F)F)c2)C1)c1ccccc1	ZINC000450619608	GI	On-Demand	Anodyne	HTR2A	16	41
O=C(CCCN1CCO[C@H](c2cccc(OC(F)F)c2)C1)c1ccccc1	ZINC000450619608	GI	On-Demand	Anodyne	HTR2C	15	40
O=C(CCCN1CCO[C@H](c2cccc(OC(F)F)c2)C1)c1ccccc1	ZINC000450619608	GI	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCO[C@@H](c2cccc(OC(F)F)c2)C1)c1ccccc1	ZINC000450619609	GI	On-Demand	Anodyne	HTR2A	16	41
O=C(CCCN1CCO[C@@H](c2cccc(OC(F)F)c2)C1)c1ccccc1	ZINC000450619609	GI	On-Demand	Anodyne	HTR2C	15	40
O=C(CCCN1CCO[C@@H](c2cccc(OC(F)F)c2)C1)c1ccccc1	ZINC000450619609	GI	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCC(=O)N1CCCC[C@H]1c1ccccc1)C1CC1	ZINC000450619610	CH	On-Demand	Anodyne	FKBP1A	47	42
O=C(CCCC(=O)N1CCCC[C@H]1c1ccccc1)C1CC1	ZINC000450619610	CH	On-Demand	Anodyne	CPT1A	119	42
O=C(CCCC(=O)N1CCCC[C@H]1c1ccccc1)C1CC1	ZINC000450619610	CH	On-Demand	Anodyne	CPT2	46	35
O=C(CCCC(=O)N1CCCC[C@H]1c1ccccc1)C1CC1	ZINC000450619610	CH	On-Demand	Anodyne	PREP	89	41
O=C(CCCC(=O)N1CCCC[C@@H]1c1ccccc1)C1CC1	ZINC000450619614	CH	On-Demand	Anodyne	FKBP1A	47	42
O=C(CCCC(=O)N1CCCC[C@@H]1c1ccccc1)C1CC1	ZINC000450619614	CH	On-Demand	Anodyne	CPT1A	119	42
O=C(CCCC(=O)N1CCCC[C@@H]1c1ccccc1)C1CC1	ZINC000450619614	CH	On-Demand	Anodyne	CPT2	46	35
O=C(CCCC(=O)N1CCCC[C@@H]1c1ccccc1)C1CC1	ZINC000450619614	CH	On-Demand	Anodyne	PREP	89	41
COc1ccc(NC(=O)[C@@H]2CC23CCSCC3)cc1OC(C)C	ZINC000450619615	EH	On-Demand	Anodyne	ENPP1	60	31
COc1ccc(NC(=O)[C@H]2CC23CCSCC3)cc1OC(C)C	ZINC000450619620	EH	On-Demand	Anodyne	ENPP1	60	31
COc1ccc(NC(=O)C2(CF)CCOCC2)cc1OC(C)C	ZINC000450619625	EG	On-Demand	Anodyne	ENPP1	56	32
CCSc1cccnc1C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450619626	EI	On-Demand	Anodyne	GRM4	27	44
CCSc1cccnc1C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450619626	EI	On-Demand	Anodyne	ENPP1	86	48
CCSc1cccnc1C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450619626	EI	On-Demand	Anodyne	KCNK3	48	37
COc1ccc(-c2nnn(CC3(C#N)CCC3)n2)cc1OC	ZINC000450619637	CE	On-Demand	Mild	SCARB1	19	41
FC1(F)CC(CN2CCC(Oc3ccccc3Cl)CC2)C1	ZINC000450619646	DI	On-Demand	Anodyne	HRH1	25	42
FC1(F)CC(CN2CCC(Oc3ccccc3Cl)CC2)C1	ZINC000450619646	DI	On-Demand	Anodyne	CCR3	20	40
FC1(F)CC(CN2CCC(Oc3ccccc3Cl)CC2)C1	ZINC000450619646	DI	On-Demand	Anodyne	SCD1	43	44
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619654	FD	On-Demand	Anodyne	ACE	21	41
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619654	FD	On-Demand	Anodyne	BIRC3	41	35
CN1C[C@@H](NC(=O)[C@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619654	FD	On-Demand	Anodyne	BIRC8	46	33
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619657	FD	On-Demand	Anodyne	ACE	21	41
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619657	FD	On-Demand	Anodyne	BIRC3	41	35
CN1C[C@H](NC(=O)[C@@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619657	FD	On-Demand	Anodyne	BIRC8	46	33
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619658	FD	On-Demand	Anodyne	ACE	21	41
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619658	FD	On-Demand	Anodyne	BIRC3	41	35
CN1C[C@@H](NC(=O)[C@@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619658	FD	On-Demand	Anodyne	BIRC8	46	33
C=CC(C)(C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450619659	CD	On-Demand	Mild	EPHX2	25	45
CN1C[C@H](NC(=O)[C@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619660	FD	On-Demand	Anodyne	ACE	21	41
CN1C[C@H](NC(=O)[C@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619660	FD	On-Demand	Anodyne	BIRC3	41	35
CN1C[C@H](NC(=O)[C@H](c2ccccc2)N2CCc3ccccc32)C(=O)N1	ZINC000450619660	FD	On-Demand	Anodyne	BIRC8	46	33
C=CC(C)(C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450619661	CD	On-Demand	Mild	EPHX2	25	45
CO[C@H]1CCC[C@@H]1CNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450619670	EI	On-Demand	Anodyne	CACNA1I	62	36
CC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2CCCO)cc1	ZINC000450619671	FG	On-Demand	Anodyne	PTGDR2	18	47
CO[C@@H]1CCC[C@@H]1CNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450619674	EI	On-Demand	Anodyne	CACNA1I	62	36
CO[C@@H]1CCC[C@H]1CNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450619675	EI	On-Demand	Anodyne	CACNA1I	62	36
CO[C@H]1CCC[C@H]1CNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450619677	EI	On-Demand	Anodyne	CACNA1I	62	36
C/C=C\COc1cccc(CC(=O)N[C@@H](CC)CC#N)c1	ZINC000450619688	CF	On-Demand	Mild	PDS	75	38
CCN(CC)[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450619692	DC	On-Demand	Anodyne	BIRC8	42	32
CCN(CC)[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450619698	DC	On-Demand	Anodyne	BIRC8	42	32
CCN(CC)[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450619701	DC	On-Demand	Anodyne	BIRC8	42	32
CCN(CC)[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450619704	DC	On-Demand	Anodyne	BIRC8	42	32
C/C=C/COc1cccc(CC(=O)N[C@H](CC)CC#N)c1	ZINC000450619705	CF	On-Demand	Mild	PDS	75	38
C/C=C/COc1cccc(CC(=O)N[C@@H](CC)CC#N)c1	ZINC000450619707	CF	On-Demand	Mild	PDS	75	38
C/C=C\COc1cccc(CC(=O)N[C@H](CC)CC#N)c1	ZINC000450619709	CF	On-Demand	Mild	PDS	75	38
CO[C@@H](Cc1ccccc1)CN1CCC(OCCO)CC1	ZINC000450619712	CD	On-Demand	Anodyne	SIGMAR1	32	51
CO[C@H](Cc1ccccc1)CN1CCC(OCCO)CC1	ZINC000450619713	CD	On-Demand	Anodyne	SIGMAR1	32	51
COc1cccc(-n2cc(C(=O)Nc3ccc(OC)c(OC(C)C)c3)nn2)c1	ZINC000450619716	GG	On-Demand	Anodyne	ESRRA	23	41
COc1cccc(-n2cc(C(=O)Nc3ccc(OC)c(OC(C)C)c3)nn2)c1	ZINC000450619716	GG	On-Demand	Anodyne	CCKAR	0	41
COc1cccc(-n2cc(C(=O)Nc3ccc(OC)c(OC(C)C)c3)nn2)c1	ZINC000450619716	GG	On-Demand	Anodyne	GRM4	20	43
COc1cccc(-n2cc(C(=O)Nc3ccc(OC)c(OC(C)C)c3)nn2)c1	ZINC000450619716	GG	On-Demand	Anodyne	TAAR1	31	41
COc1cccc(-n2cc(C(=O)Nc3ccc(OC)c(OC(C)C)c3)nn2)c1	ZINC000450619716	GG	On-Demand	Anodyne	ENPP1	76	37
Clc1ccc(OC[C@H]2COCCO2)cc1Cl	ZINC000450619725	CF	On-Demand	Anodyne	CHRNA10	17	47
Clc1ccc(OC[C@@H]2COCCO2)cc1Cl	ZINC000450619729	CF	On-Demand	Anodyne	CHRNA10	17	47
CCOC(=O)CN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)c1ccccc1	ZINC000450619731	GH	On-Demand	Anodyne	RORC	35	40
CCOC(=O)CN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H](C)c1ccccc1	ZINC000450619735	GH	On-Demand	Anodyne	RORC	35	40
c1ccc(COc2ccc(OCc3cn(CC4CC4)nn3)cc2)cc1	ZINC000450619742	EH	On-Demand	Anodyne	MAOB	16	40
c1ccc(COc2ccc(OCc3cn(CC4CC4)nn3)cc2)cc1	ZINC000450619742	EH	On-Demand	Anodyne	LTA4H	26	40
c1ccc(COc2ccc(OCc3cn(CC4CC4)nn3)cc2)cc1	ZINC000450619742	EH	On-Demand	Anodyne	GRM5	23	44
c1ccc(COc2ccc(OCc3cn(CC4CC4)nn3)cc2)cc1	ZINC000450619742	EH	On-Demand	Anodyne	MAL12	0	46
c1ccc(COc2ccc(OCc3cn(CC4CC4)nn3)cc2)cc1	ZINC000450619742	EH	On-Demand	Anodyne	FIMH	16	51
CC[C@H](C)n1ncc2c(C(=O)N[C@H]3CN(C)NC3=O)cc(C)nc21	ZINC000450619763	EC	On-Demand	Anodyne	EZH2	18	40
CC(F)(F)c1ccc(C(=O)NC2Cc3ccccc3C2)cn1	ZINC000450619766	DG	On-Demand	Anodyne	CA7	15	40
CC(F)(F)c1ccc(C(=O)NC2Cc3ccccc3C2)cn1	ZINC000450619766	DG	On-Demand	Anodyne	HPGDS	36	45
CC[C@H](C)n1ncc2c(C(=O)N[C@@H]3CN(C)NC3=O)cc(C)nc21	ZINC000450619774	EC	On-Demand	Anodyne	EZH2	18	40
CCC[C@@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCO1	ZINC000450619779	DG	On-Demand	Anodyne	DRD4	25	48
CC[C@@H](C)n1ncc2c(C(=O)N[C@H]3CN(C)NC3=O)cc(C)nc21	ZINC000450619780	EC	On-Demand	Anodyne	EZH2	18	40
CCC[C@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCO1	ZINC000450619782	DG	On-Demand	Anodyne	DRD4	25	48
Cc1cc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)ccn1	ZINC000450619784	ED	On-Demand	Anodyne	NPY1R	40	34
Cc1cc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)ccn1	ZINC000450619784	ED	On-Demand	Anodyne	NPY2R	62	43
Cc1cc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)ccn1	ZINC000450619784	ED	On-Demand	Anodyne	NPY5R	19	43
CC[C@@H](C)n1ncc2c(C(=O)N[C@@H]3CN(C)NC3=O)cc(C)nc21	ZINC000450619785	EC	On-Demand	Anodyne	EZH2	18	40
COc1ccc(CNC(=O)CCN2CCN(C)C[C@H]2c2ccccc2)c(OC)c1	ZINC000450619789	GF	On-Demand	Anodyne	HTR7	28	41
COc1ccc(CNC(=O)CCN2CCN(C)C[C@H]2c2ccccc2)c(OC)c1	ZINC000450619789	GF	On-Demand	Anodyne	MTNR1A	58	37
COc1ccc(CNC(=O)CCN2CCN(C)C[C@H]2c2ccccc2)c(OC)c1	ZINC000450619789	GF	On-Demand	Anodyne	MTNR1B	51	35
COc1ccc(CNC(=O)CCN2CCN(C)C[C@@H]2c2ccccc2)c(OC)c1	ZINC000450619793	GF	On-Demand	Anodyne	HTR7	28	41
COc1ccc(CNC(=O)CCN2CCN(C)C[C@@H]2c2ccccc2)c(OC)c1	ZINC000450619793	GF	On-Demand	Anodyne	MTNR1A	58	37
COc1ccc(CNC(=O)CCN2CCN(C)C[C@@H]2c2ccccc2)c(OC)c1	ZINC000450619793	GF	On-Demand	Anodyne	MTNR1B	51	35
CC(C)c1n[nH]c(CNc2ncccc2OCc2ccccc2)n1	ZINC000450619797	DH	On-Demand	Anodyne	PPIA	45	40
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450619803	GC	On-Demand	Anodyne	AKR1C3	58	39
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450619804	GC	On-Demand	Anodyne	AKR1C3	58	39
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1	ZINC000450619805	GC	On-Demand	Anodyne	AKR1C3	58	39
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1	ZINC000450619807	GC	On-Demand	Anodyne	AKR1C3	58	39
CN1C[C@@H](NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450619814	FB	On-Demand	Anodyne	EPHX2	23	43
CN1C[C@@H](NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450619814	FB	On-Demand	Anodyne	TGM2	43	41
CN1C[C@@H](NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450619814	FB	On-Demand	Anodyne	NAMPT	29	40
CC(=O)c1cccc(CN2CCNC(=O)[C@H]2c2ccc(C(F)(F)F)cc2)c1	ZINC000450619819	GH	On-Demand	Anodyne	TRPM8	42	36
CC(=O)c1cccc(CN2CCNC(=O)[C@@H]2c2ccc(C(F)(F)F)cc2)c1	ZINC000450619823	GH	On-Demand	Anodyne	TRPM8	42	36
CN1C[C@H](NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450619825	FB	On-Demand	Anodyne	EPHX2	23	43
CN1C[C@H](NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450619825	FB	On-Demand	Anodyne	TGM2	43	41
CN1C[C@H](NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450619825	FB	On-Demand	Anodyne	NAMPT	29	40
CC1=CCN(CCNC(=O)Cc2cc(C)ccc2F)CC1	ZINC000450619831	CE	On-Demand	Anodyne	PLD2	47	34
COc1ccc(CNC(=O)CCn2cc([N+](=O)[O-])ccc2=O)c(OC)c1	ZINC000450619835	FD	On-Demand	Bother	ABHD6	0	43
C[C@@H](Sc1nc2ccccc2c(=O)n1CCCO)C(=O)Nc1nccs1	ZINC000450619838	GE	On-Demand	Anodyne	MAP1	84	35
C[C@@H](Sc1nc2ccccc2c(=O)n1CCCO)C(=O)Nc1nccs1	ZINC000450619838	GE	On-Demand	Anodyne	SLC16A1	47	35
COc1ccc(CNC(=O)CCN(C)C2(C(N)=O)CCCC2)c(OC)c1	ZINC000450619842	FD	On-Demand	Anodyne	MTNR1A	45	39
CCS(=O)(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1	ZINC000450619846	GE	On-Demand	Anodyne	HRH3	15	41
FC1(F)CCC[C@H]1CSc1nnnn1-c1ccccc1	ZINC000450619861	CG	On-Demand	Anodyne	CELA2A	29	42
FC1(F)CCC[C@@H]1CSc1nnnn1-c1ccccc1	ZINC000450619865	CG	On-Demand	Anodyne	CELA2A	29	42
Cc1cc(CNc2cc(N3CCSCC3)ncn2)ccn1	ZINC000450619870	DE	On-Demand	Anodyne	HRH4	16	56
C[C@H](Sc1nc2ccccc2c(=O)n1CCCO)C(=O)Nc1nccs1	ZINC000450619872	GE	On-Demand	Anodyne	MAP1	84	35
C[C@H](Sc1nc2ccccc2c(=O)n1CCCO)C(=O)Nc1nccs1	ZINC000450619872	GE	On-Demand	Anodyne	SLC16A1	47	35
COc1cccc(OCCC(=O)N2CCN(C(C)=O)CC2(C)C)c1	ZINC000450619879	ED	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)N2CCN(C(C)=O)CC2(C)C)c1	ZINC000450619879	ED	On-Demand	Anodyne	MTNR1A	23	44
CCC[C@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450619882	CG	On-Demand	Anodyne	SLC6A1	71	35
CCC[C@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450619882	CG	On-Demand	Anodyne	CYP2J2	66	47
CCC[C@@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450619886	CG	On-Demand	Anodyne	SLC6A1	71	35
CCC[C@@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450619886	CG	On-Demand	Anodyne	CYP2J2	66	47
CCOc1ccccc1C(=O)NCCCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619906	EC	On-Demand	Anodyne	KCNA3	25	41
CCOc1ccccc1C(=O)NCCCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619906	EC	On-Demand	Anodyne	HCN1	60	41
CCOc1ccccc1C(=O)NCCCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619906	EC	On-Demand	Anodyne	HCN2	0	40
CCOc1ccccc1C(=O)NCCCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619906	EC	On-Demand	Anodyne	HCN4	51	39
CCOc1ccccc1C(=O)NCCCC(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619906	EC	On-Demand	Anodyne	HCN3	0	40
CCOc1ccccc1C(=O)NCCCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619911	EC	On-Demand	Anodyne	KCNA3	25	41
CCOc1ccccc1C(=O)NCCCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619911	EC	On-Demand	Anodyne	HCN1	60	41
CCOc1ccccc1C(=O)NCCCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619911	EC	On-Demand	Anodyne	HCN2	0	40
CCOc1ccccc1C(=O)NCCCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619911	EC	On-Demand	Anodyne	HCN4	51	39
CCOc1ccccc1C(=O)NCCCC(=O)N[C@H]1CN(C)NC1=O	ZINC000450619911	EC	On-Demand	Anodyne	HCN3	0	40
Cc1nc(Cc2nnc(SCCc3ccc(Cl)cc3)o2)cs1	ZINC000450619922	FI	On-Demand	Anodyne	CPB	0	45
CCc1cccc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)n1	ZINC000450619926	DH	On-Demand	Anodyne	PDE5A	29	52
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	ACE	34	41
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	MME	22	42
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	TACR1	19	45
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	TACR2	15	45
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	TACR3	17	43
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	PAM	0	44
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	FURIN	43	43
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	HDAC11	43	36
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619930	FB	On-Demand	Anodyne	GAG-PRO	41	35
COC(=O)C1(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450619931	EF	On-Demand	Anodyne	COLA	87	36
COC(=O)C1(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450619931	EF	On-Demand	Anodyne	CPT1A	60	35
COC(=O)C1(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450619932	EF	On-Demand	Anodyne	COLA	87	36
COC(=O)C1(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000450619932	EF	On-Demand	Anodyne	CPT1A	60	35
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	ACE	34	41
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	MME	22	42
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	TACR1	19	45
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	TACR2	15	45
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	TACR3	17	43
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	PAM	0	44
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	FURIN	43	43
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	HDAC11	43	36
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619934	FB	On-Demand	Anodyne	GAG-PRO	41	35
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	ACE	34	41
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	MME	22	42
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	TACR1	19	45
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	TACR2	15	45
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	TACR3	17	43
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	PAM	0	44
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	FURIN	43	43
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	HDAC11	43	36
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619936	FB	On-Demand	Anodyne	GAG-PRO	41	35
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	ACE	34	41
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	MME	22	42
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	TACR1	19	45
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	TACR2	15	45
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	TACR3	17	43
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	PAM	0	44
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	FURIN	43	43
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	HDAC11	43	36
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619938	FB	On-Demand	Anodyne	GAG-PRO	41	35
Cc1nn(C)cc1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619948	FD	On-Demand	Anodyne	GNAI1	0	42
Cc1nn(C)cc1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619948	FD	On-Demand	Anodyne	GNAI3	0	42
Cc1nn(C)cc1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619948	FD	On-Demand	Anodyne	GNAO1	0	42
Cc1nn(C)cc1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450619948	FD	On-Demand	Anodyne	TBK1	60	37
CCOCCOc1ccccc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619951	DC	On-Demand	Anodyne	HCN1	44	34
CCOCCOc1ccccc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450619951	DC	On-Demand	Anodyne	HCN4	44	34
CCOCCOc1ccccc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619954	DC	On-Demand	Anodyne	HCN1	44	34
CCOCCOc1ccccc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450619954	DC	On-Demand	Anodyne	HCN4	44	34
CC(=O)NC[C@H](CC(=O)N1CCCC[C@@H]1c1ccccc1)CC(C)C	ZINC000450619959	EH	On-Demand	Anodyne	ADAM17	35	43
CC(=O)NC[C@H](CC(=O)N1CCCC[C@@H]1c1ccccc1)CC(C)C	ZINC000450619959	EH	On-Demand	Anodyne	COLA	95	41
CC(=O)NC[C@H](CC(=O)N1CCCC[C@@H]1c1ccccc1)CC(C)C	ZINC000450619959	EH	On-Demand	Anodyne	CPT1A	91	41
CC(=O)NC[C@H](CC(=O)N1CCCC[C@H]1c1ccccc1)CC(C)C	ZINC000450619961	EH	On-Demand	Anodyne	ADAM17	35	43
CC(=O)NC[C@H](CC(=O)N1CCCC[C@H]1c1ccccc1)CC(C)C	ZINC000450619961	EH	On-Demand	Anodyne	COLA	95	41
CC(=O)NC[C@H](CC(=O)N1CCCC[C@H]1c1ccccc1)CC(C)C	ZINC000450619961	EH	On-Demand	Anodyne	CPT1A	91	41
CN(CCc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1)C1CC1	ZINC000450619964	FG	On-Demand	Anodyne	HDAC1	33	40
CN(CCc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1)C1CC1	ZINC000450619964	FG	On-Demand	Anodyne	DGAT1	41	42
CN(CCc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1)C1CC1	ZINC000450619964	FG	On-Demand	Anodyne	HPGDS	22	40
CCS(=O)(=O)c1ccc(CN(C)CCc2ccccn2)cc1	ZINC000450619965	DF	On-Demand	Anodyne	RORC	16	40
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	EGFR	43	41
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	PDE3A	43	33
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	PDGFRB	58	37
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	AURKB	42	40
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	FLT1	26	47
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	PDE3B	63	32
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	AURKA	42	39
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	EPHA2	40	35
COc1cc2c(N[C@@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619966	EE	On-Demand	Anodyne	EHMT2	82	39
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	EGFR	43	41
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	PDE3A	43	33
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	PDGFRB	58	37
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	AURKB	42	40
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	FLT1	26	47
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	PDE3B	63	32
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	AURKA	42	39
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	EPHA2	40	35
COc1cc2c(N[C@H]3CCCN(CCCO)C3)ncnc2cc1F	ZINC000450619971	EE	On-Demand	Anodyne	EHMT2	82	39
O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1CCCCN1CCO	ZINC000450619984	DD	On-Demand	Bother	PRKCQ	42	37
O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1CCCCN1CCO	ZINC000450619985	DD	On-Demand	Bother	PRKCQ	42	37
C=CCNC(=O)c1ccc(NCC(C)(C)c2ccccn2)nc1	ZINC000450619986	DF	On-Demand	Mild	HCAR3	15	50
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	ESR1	66	37
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	DRD4	40	31
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	ESR2	46	36
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	LTA4H	57	44
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	HRH3	55	49
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	FLT3	20	42
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	TNK2	20	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	PSMB2	52	41
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	PSMB5	17	41
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	PSMB1	45	41
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1c[nH]c2nccc-2c1	ZINC000450619987	GF	On-Demand	Anodyne	TBK1	25	45
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450619988	FG	On-Demand	Anodyne	GNAI1	0	42
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450619988	FG	On-Demand	Anodyne	GNAI3	0	42
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450619988	FG	On-Demand	Anodyne	GNAO1	0	42
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450619989	FG	On-Demand	Anodyne	GNAI1	0	42
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450619989	FG	On-Demand	Anodyne	GNAI3	0	42
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450619989	FG	On-Demand	Anodyne	GNAO1	0	42
CCCC[C@H](NC(=O)c1ccnc(OC(F)F)c1)C(=O)OC	ZINC000450620024	DE	On-Demand	Anodyne	ERAP2	39	40
O=C(Cc1sccc1Br)N1CCN(c2ccc(F)cn2)CC1	ZINC000450620032	GF	On-Demand	Anodyne	NPBWR1	48	36
O=C(Cc1sccc1Br)N1CCN(c2ccc(F)cn2)CC1	ZINC000450620032	GF	On-Demand	Anodyne	SLC27A1	42	40
CCCC[C@@H](NC(=O)c1ccnc(OC(F)F)c1)C(=O)OC	ZINC000450620034	DE	On-Demand	Anodyne	ERAP2	39	40
C/C=C\COc1cccc(CC(=O)N2CCN(c3cccc(C#N)n3)CC2)c1	ZINC000450620048	GF	On-Demand	Mild	GPR183	0	42
C/C=C/COc1cccc(CC(=O)N2CCN(c3cccc(C#N)n3)CC2)c1	ZINC000450620054	GF	On-Demand	Mild	GPR183	0	42
COc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2ccncc2)cc1	ZINC000450620060	GI	On-Demand	Anodyne	WNT3A	24	52
COc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2ccncc2)cc1	ZINC000450620060	GI	On-Demand	Anodyne	TNKS2	15	52
COc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2ccncc2)cc1	ZINC000450620060	GI	On-Demand	Anodyne	AXIN2	0	41
O=C(NCC(=O)N1CCN(c2ccc(F)cn2)CC1)Nc1cccc(Cl)c1	ZINC000450620066	GE	On-Demand	Anodyne	EPHX2	18	44
O=C(NCC(=O)N1CCN(c2ccc(F)cn2)CC1)Nc1cccc(Cl)c1	ZINC000450620066	GE	On-Demand	Anodyne	DGAT1	31	43
Cc1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450620072	EF	On-Demand	Anodyne	METAP1	33	42
Cc1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450620072	EF	On-Demand	Anodyne	PIK3CA	26	40
Cc1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450620072	EF	On-Demand	Anodyne	EPHB4	77	38
Cc1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450620072	EF	On-Demand	Anodyne	STAT6	54	37
Cc1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450620072	EF	On-Demand	Anodyne	SMG1	40	35
O=C(NC1Cc2ccccc2C1)c1cc2c([nH]1)CCCC2	ZINC000450620082	CF	On-Demand	Anodyne	PYGL	52	35
CCCC[C@@H](NC(=O)c1ccc(C(C)(F)F)nc1)C(=O)OC	ZINC000450620084	DF	On-Demand	Anodyne	CTRB_BOVIN	46	33
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620086	EH	On-Demand	Anodyne	ADAM17	25	40
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620086	EH	On-Demand	Anodyne	COLA	127	49
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620086	EH	On-Demand	Anodyne	CPT1A	119	49
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620086	EH	On-Demand	Anodyne	CPT2	42	32
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620086	EH	On-Demand	Anodyne	PREP	66	37
CCCC[C@H](NC(=O)c1ccc(C(C)(F)F)nc1)C(=O)OC	ZINC000450620087	DF	On-Demand	Anodyne	CTRB_BOVIN	46	33
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620099	EH	On-Demand	Anodyne	ADAM17	25	40
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620099	EH	On-Demand	Anodyne	COLA	127	49
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620099	EH	On-Demand	Anodyne	CPT1A	119	49
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620099	EH	On-Demand	Anodyne	CPT2	42	32
O=C(C[C@@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620099	EH	On-Demand	Anodyne	PREP	66	37
OCCCN1CCC[C@@H](Nc2ncnc3cc(F)c(F)cc23)C1	ZINC000450620100	DE	On-Demand	Anodyne	ERBB4	43	35
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620101	EH	On-Demand	Anodyne	ADAM17	25	40
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620101	EH	On-Demand	Anodyne	COLA	127	49
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620101	EH	On-Demand	Anodyne	CPT1A	119	49
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620101	EH	On-Demand	Anodyne	CPT2	42	32
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@H]1c1ccccc1	ZINC000450620101	EH	On-Demand	Anodyne	PREP	66	37
OCCCN1CCC[C@H](Nc2ncnc3cc(F)c(F)cc23)C1	ZINC000450620102	DE	On-Demand	Anodyne	ERBB4	43	35
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620103	EH	On-Demand	Anodyne	ADAM17	25	40
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620103	EH	On-Demand	Anodyne	COLA	127	49
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620103	EH	On-Demand	Anodyne	CPT1A	119	49
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620103	EH	On-Demand	Anodyne	CPT2	42	32
O=C(C[C@H]1COc2ccccc2O1)N1CCCC[C@@H]1c1ccccc1	ZINC000450620103	EH	On-Demand	Anodyne	PREP	66	37
O=C1NCCN(C[C@H](O)Cc2ccccc2)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000450620108	GF	On-Demand	Anodyne	TRPM8	40	36
O=C(NCCCN1CCCCC1)C1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450620116	FE	On-Demand	Anodyne	GNAI1	0	43
O=C(NCCCN1CCCCC1)C1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450620116	FE	On-Demand	Anodyne	GNAI3	0	43
O=C(NCCCN1CCCCC1)C1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450620116	FE	On-Demand	Anodyne	GNAO1	0	43
CN1[C@H]2CC[C@H]1CC(N1CCN(CC/C=C/c3ccccc3)CC1)C2	ZINC000450620117	EG	On-Demand	Anodyne	SLC6A3	25	42
CN1[C@H]2CC[C@H]1CC(N1CCN(CC/C=C/c3ccccc3)CC1)C2	ZINC000450620117	EG	On-Demand	Anodyne	SIGMAR1	15	63
O=C(NCCCN1CCCCC1)C1CCN(CC[C@H]2CCOC2)CC1	ZINC000450620118	FE	On-Demand	Anodyne	GNAI1	0	43
O=C(NCCCN1CCCCC1)C1CCN(CC[C@H]2CCOC2)CC1	ZINC000450620118	FE	On-Demand	Anodyne	GNAI3	0	43
O=C(NCCCN1CCCCC1)C1CCN(CC[C@H]2CCOC2)CC1	ZINC000450620118	FE	On-Demand	Anodyne	GNAO1	0	43
CCC[C@H](OC)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450620120	DF	On-Demand	Anodyne	FPR2	29	41
CCC[C@@H](OC)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450620122	DF	On-Demand	Anodyne	FPR2	29	41
CS(=O)(=O)c1ccc(N[C@@H]2CCCN(CCCO)C2)nc1	ZINC000450620127	DC	On-Demand	Anodyne	BIRC2	41	32
CS(=O)(=O)c1ccc(N[C@H]2CCCN(CCCO)C2)nc1	ZINC000450620128	DC	On-Demand	Anodyne	BIRC2	41	32
CN1[C@H]2CC[C@H]1CC(N1CCN(CC/C=C\c3ccccc3)CC1)C2	ZINC000450620132	EG	On-Demand	Anodyne	SLC6A3	25	42
CN1[C@H]2CC[C@H]1CC(N1CCN(CC/C=C\c3ccccc3)CC1)C2	ZINC000450620132	EG	On-Demand	Anodyne	SIGMAR1	15	63
COc1ccc(-n2c(SCCCCCC(C)=O)nnc2-c2ccncc2)cc1	ZINC000450620139	GJ	On-Demand	Anodyne	WNT3A	22	49
CCc1cc(NCC2=CCOCC2)n2ncnc2n1	ZINC000450620140	CD	On-Demand	Anodyne	DHOD	0	47
CC1=CCN(CCNC(=O)c2ccc(I)cc2F)CC1	ZINC000450620147	GF	On-Demand	Anodyne	DRD4	40	31
CC1=CCN(CCNC(=O)c2ccc(I)cc2F)CC1	ZINC000450620147	GF	On-Demand	Anodyne	MAP2K1	43	40
CC1=CCN(CCNC(=O)c2ccc(I)cc2F)CC1	ZINC000450620147	GF	On-Demand	Anodyne	PLD2	50	33
O=C(NCCCN1CCCCC1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450620152	FH	On-Demand	Anodyne	GNAI1	0	44
O=C(NCCCN1CCCCC1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450620152	FH	On-Demand	Anodyne	GNAI3	0	44
O=C(NCCCN1CCCCC1)C1CCN(CCC2=CCCCC2)CC1	ZINC000450620152	FH	On-Demand	Anodyne	GNAO1	0	44
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1ccco1	ZINC000450620156	CF	On-Demand	Anodyne	DRD3	45	34
Cn1c(SCC[C@H]2CCOC2)nnc1-c1ccco1	ZINC000450620159	CF	On-Demand	Anodyne	DRD3	45	34
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccccc3)nn2C)[C@H]1OC	ZINC000450620160	EE	On-Demand	Anodyne	INHA	81	35
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccccc3)nn2C)[C@@H]1OC	ZINC000450620163	EE	On-Demand	Anodyne	INHA	81	35
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccccc3)nn2C)[C@@H]1OC	ZINC000450620164	EE	On-Demand	Anodyne	INHA	81	35
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccccc3)nn2C)[C@H]1OC	ZINC000450620165	EE	On-Demand	Anodyne	INHA	81	35
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCCN1CCO	ZINC000450620176	FD	On-Demand	Bother	TBXA2R	25	40
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCCN1CCO	ZINC000450620177	FD	On-Demand	Bother	TBXA2R	25	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620184	GH	On-Demand	Anodyne	AGTR1	20	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620184	GH	On-Demand	Anodyne	ANPEP	57	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620184	GH	On-Demand	Anodyne	PLAU	42	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620184	GH	On-Demand	Anodyne	SMO	18	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620184	GH	On-Demand	Anodyne	FAS	27	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620185	GH	On-Demand	Anodyne	AGTR1	20	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620185	GH	On-Demand	Anodyne	ANPEP	57	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620185	GH	On-Demand	Anodyne	PLAU	42	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620185	GH	On-Demand	Anodyne	SMO	18	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)cc1	ZINC000450620185	GH	On-Demand	Anodyne	FAS	27	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CC23CCSCC3)cc1	ZINC000450620187	EH	On-Demand	Anodyne	TIMP3	55	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CC23CCSCC3)cc1	ZINC000450620188	EH	On-Demand	Anodyne	TIMP3	55	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CC23CCSCC3)cc1	ZINC000450620189	EH	On-Demand	Anodyne	TIMP3	55	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CC23CCSCC3)cc1	ZINC000450620190	EH	On-Demand	Anodyne	TIMP3	55	32
c1ccc([C@@H]2CCC[C@@H]2CNc2ncccn2)cc1	ZINC000450620198	CG	On-Demand	Anodyne	GRIN2B	15	43
c1ccc([C@@H]2CCC[C@H]2CNc2ncccn2)cc1	ZINC000450620199	CG	On-Demand	Anodyne	GRIN2B	15	43
c1ccc([C@H]2CCC[C@@H]2CNc2ncccn2)cc1	ZINC000450620200	CG	On-Demand	Anodyne	GRIN2B	15	43
c1ccc([C@H]2CCC[C@H]2CNc2ncccn2)cc1	ZINC000450620201	CG	On-Demand	Anodyne	GRIN2B	15	43
CO[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)Cc1ccccc1	ZINC000450620214	GH	On-Demand	Anodyne	AVPR2	43	39
CO[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)Cc1ccccc1	ZINC000450620215	GH	On-Demand	Anodyne	AVPR2	43	39
CN1C[C@H](NC(=O)CCCc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450620226	DD	On-Demand	Anodyne	LUXR	47	34
CN1C[C@@H](NC(=O)CCCc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450620227	DD	On-Demand	Anodyne	LUXR	47	34
CNS(=O)(=O)c1ccc(NC[C@H](Cc2ccccc2)OC)c(F)c1	ZINC000450620229	FE	On-Demand	Anodyne	CA5B	16	40
CNS(=O)(=O)c1ccc(NC[C@H](Cc2ccccc2)OC)c(F)c1	ZINC000450620229	FE	On-Demand	Anodyne	CA5A	18	40
CNS(=O)(=O)c1ccc(NC[C@@H](Cc2ccccc2)OC)c(F)c1	ZINC000450620230	FE	On-Demand	Anodyne	CA5B	16	40
CNS(=O)(=O)c1ccc(NC[C@@H](Cc2ccccc2)OC)c(F)c1	ZINC000450620230	FE	On-Demand	Anodyne	CA5A	18	40
CN1C[C@@H](NC(=O)[C@@H](OC2CCCC2)c2ccccc2)C(=O)N1	ZINC000450620235	DD	On-Demand	Anodyne	BIRC8	45	37
CN1C[C@H](NC(=O)[C@@H](OC2CCCC2)c2ccccc2)C(=O)N1	ZINC000450620237	DD	On-Demand	Anodyne	BIRC8	45	37
CN1C[C@@H](NC(=O)[C@H](OC2CCCC2)c2ccccc2)C(=O)N1	ZINC000450620238	DD	On-Demand	Anodyne	BIRC8	45	37
CN1C[C@H](NC(=O)[C@H](OC2CCCC2)c2ccccc2)C(=O)N1	ZINC000450620239	DD	On-Demand	Anodyne	BIRC8	45	37
CCC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620240	DB	On-Demand	Anodyne	AMP1_PLAFQ	23	41
CCC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620240	DB	On-Demand	Anodyne	GAG-PRO	44	31
CCC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620240	DB	On-Demand	Anodyne	XIAP	67	39
CCC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620240	DB	On-Demand	Anodyne	BIRC2	52	36
CCC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620240	DB	On-Demand	Anodyne	Q82323_9DELA	67	33
CCC(=O)N[C@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620240	DB	On-Demand	Anodyne	BIRC8	46	36
CCC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620242	DB	On-Demand	Anodyne	AMP1_PLAFQ	23	41
CCC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620242	DB	On-Demand	Anodyne	GAG-PRO	44	31
CCC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620242	DB	On-Demand	Anodyne	XIAP	67	39
CCC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620242	DB	On-Demand	Anodyne	BIRC2	52	36
CCC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620242	DB	On-Demand	Anodyne	Q82323_9DELA	67	33
CCC(=O)N[C@@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620242	DB	On-Demand	Anodyne	BIRC8	46	36
CCC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620243	DB	On-Demand	Anodyne	AMP1_PLAFQ	23	41
CCC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620243	DB	On-Demand	Anodyne	GAG-PRO	44	31
CCC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620243	DB	On-Demand	Anodyne	XIAP	67	39
CCC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620243	DB	On-Demand	Anodyne	BIRC2	52	36
CCC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620243	DB	On-Demand	Anodyne	Q82323_9DELA	67	33
CCC(=O)N[C@@H](C(=O)N[C@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620243	DB	On-Demand	Anodyne	BIRC8	46	36
CN1C[C@@H](NC(=O)c2ccccc2S(=O)(=O)N2CCCCC2)C(=O)N1	ZINC000450620244	FB	On-Demand	Anodyne	EPHX2	29	44
CCC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620245	DB	On-Demand	Anodyne	AMP1_PLAFQ	23	41
CCC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620245	DB	On-Demand	Anodyne	GAG-PRO	44	31
CCC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620245	DB	On-Demand	Anodyne	XIAP	67	39
CCC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620245	DB	On-Demand	Anodyne	BIRC2	52	36
CCC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620245	DB	On-Demand	Anodyne	Q82323_9DELA	67	33
CCC(=O)N[C@H](C(=O)N[C@@H]1CN(C)NC1=O)c1ccccc1	ZINC000450620245	DB	On-Demand	Anodyne	BIRC8	46	36
CN1C[C@H](NC(=O)c2ccccc2S(=O)(=O)N2CCCCC2)C(=O)N1	ZINC000450620246	FB	On-Demand	Anodyne	EPHX2	29	44
C[C@@H](O)CCCn1cnc2cc(-c3ccc(Cl)cc3)sc2c1=O	ZINC000450620254	EH	On-Demand	Anodyne	MCHR1	42	49
C[C@H](O)CCCn1cnc2cc(-c3ccc(Cl)cc3)sc2c1=O	ZINC000450620255	EH	On-Demand	Anodyne	MCHR1	42	49
CC[C@@H](C)[C@@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450620256	FF	On-Demand	Bother	BCL2L1	50	34
CC[C@@H](C)[C@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450620257	FF	On-Demand	Bother	BCL2L1	50	34
CC[C@H](C)[C@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450620259	FF	On-Demand	Bother	BCL2L1	50	34
CC[C@H](C)[C@@H](CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450620260	FF	On-Demand	Bother	BCL2L1	50	34
C[C@H](O)CCn1cnc2cc(-c3ccc(Cl)cc3)sc2c1=O	ZINC000450620263	EH	On-Demand	Anodyne	MCHR1	43	52
C[C@@H](O)CCn1cnc2cc(-c3ccc(Cl)cc3)sc2c1=O	ZINC000450620266	EH	On-Demand	Anodyne	MCHR1	43	52
CN1C[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620271	FB	On-Demand	Anodyne	CTSK	23	40
CN1C[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620271	FB	On-Demand	Anodyne	CTSL	41	43
CN1C[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620271	FB	On-Demand	Anodyne	CTSS	24	48
CN1C[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620271	FB	On-Demand	Anodyne	MMP9	19	44
CN1C[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620271	FB	On-Demand	Anodyne	MMP1	18	44
CN1C[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620271	FB	On-Demand	Anodyne	PSMB5	48	37
CN1C[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620271	FB	On-Demand	Anodyne	KISS1R	55	33
CN1C[C@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620271	FB	On-Demand	Anodyne	DERP1	0	40
CN1C[C@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620273	FB	On-Demand	Anodyne	CTSK	23	40
CN1C[C@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620273	FB	On-Demand	Anodyne	CTSL	41	43
CN1C[C@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620273	FB	On-Demand	Anodyne	CTSS	24	48
CN1C[C@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620273	FB	On-Demand	Anodyne	MMP9	19	44
CN1C[C@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620273	FB	On-Demand	Anodyne	MMP1	18	44
CN1C[C@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620273	FB	On-Demand	Anodyne	PSMB5	48	37
CN1C[C@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620273	FB	On-Demand	Anodyne	KISS1R	55	33
CN1C[C@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620273	FB	On-Demand	Anodyne	DERP1	0	40
CN1C[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620276	FB	On-Demand	Anodyne	CTSK	23	40
CN1C[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620276	FB	On-Demand	Anodyne	CTSL	41	43
CN1C[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620276	FB	On-Demand	Anodyne	CTSS	24	48
CN1C[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620276	FB	On-Demand	Anodyne	MMP9	19	44
CN1C[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620276	FB	On-Demand	Anodyne	MMP1	18	44
CN1C[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620276	FB	On-Demand	Anodyne	PSMB5	48	37
CN1C[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620276	FB	On-Demand	Anodyne	KISS1R	55	33
CN1C[C@@H](NC(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620276	FB	On-Demand	Anodyne	DERP1	0	40
CN1C[C@@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620278	FB	On-Demand	Anodyne	CTSK	23	40
CN1C[C@@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620278	FB	On-Demand	Anodyne	CTSL	41	43
CN1C[C@@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620278	FB	On-Demand	Anodyne	CTSS	24	48
CN1C[C@@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620278	FB	On-Demand	Anodyne	MMP9	19	44
CN1C[C@@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620278	FB	On-Demand	Anodyne	MMP1	18	44
CN1C[C@@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620278	FB	On-Demand	Anodyne	PSMB5	48	37
CN1C[C@@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620278	FB	On-Demand	Anodyne	KISS1R	55	33
CN1C[C@@H](NC(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)C(=O)N1	ZINC000450620278	FB	On-Demand	Anodyne	DERP1	0	40
COc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1OC(C)C	ZINC000450620280	EH	On-Demand	Anodyne	TRPV1	26	42
COc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1OC(C)C	ZINC000450620280	EH	On-Demand	Anodyne	ENPP1	80	38
COc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1OC(C)C	ZINC000450620280	EH	On-Demand	Anodyne	DRTS_TRYCR	44	30
COc1ccc(NC(=O)Cc2ccc(O)c(F)c2)cc1OC(C)C	ZINC000450620280	EH	On-Demand	Anodyne	CAN2	0	41
CN(CCSc1nc2ccccc2c(=O)n1CCCO)Cc1ccccc1	ZINC000450620281	GG	On-Demand	Anodyne	SLC16A1	46	33
CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)C(=O)OC	ZINC000450620293	DF	On-Demand	Anodyne	GPR88	0	47
Cc1oc(-c2ccccc2)nc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620303	DC	On-Demand	Anodyne	PPARA	46	38
Cc1oc(-c2ccccc2)nc1C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620303	DC	On-Demand	Anodyne	PDE8B	67	39
Cc1oc(-c2ccccc2)nc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620305	DC	On-Demand	Anodyne	PPARA	46	38
Cc1oc(-c2ccccc2)nc1C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620305	DC	On-Demand	Anodyne	PDE8B	67	39
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N[C@H]3CN(C)NC3=O)CC2)cc1C	ZINC000450620306	GC	On-Demand	Anodyne	EPHX2	46	48
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N[C@@H]3CN(C)NC3=O)CC2)cc1C	ZINC000450620307	GC	On-Demand	Anodyne	EPHX2	46	48
CC(C)(CC(=O)COc1ccc(C(N)=O)cc1)C1CC1	ZINC000450620308	CF	On-Demand	Anodyne	PLA2G4B	72	40
Cc1nc(C)n(CCCC(=O)NC(c2ccccc2C)c2ccccc2C)n1	ZINC000450620309	GI	On-Demand	Anodyne	CTSA	42	32
CCCC[C@H](NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1)C(=O)OC	ZINC000450620312	GF	On-Demand	Anodyne	PDEC	0	41
CCCC[C@@H](NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1)C(=O)OC	ZINC000450620313	GF	On-Demand	Anodyne	PDEC	0	41
CN1C[C@H](NC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)C(=O)N1	ZINC000450620317	FD	On-Demand	Anodyne	HDAC8	18	42
CN1C[C@H](NC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)C(=O)N1	ZINC000450620317	FD	On-Demand	Anodyne	CYP2J2	45	33
CN1C[C@@H](NC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)C(=O)N1	ZINC000450620318	FD	On-Demand	Anodyne	HDAC8	18	42
CN1C[C@@H](NC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)C(=O)N1	ZINC000450620318	FD	On-Demand	Anodyne	CYP2J2	45	33
CCOc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OCCOc1ccccc1	ZINC000450620319	GD	On-Demand	Anodyne	CYSLTR2	47	38
CCOc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1OCCOc1ccccc1	ZINC000450620319	GD	On-Demand	Anodyne	SSTR5	45	36
CCOc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OCCOc1ccccc1	ZINC000450620320	GD	On-Demand	Anodyne	CYSLTR2	47	38
CCOc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1OCCOc1ccccc1	ZINC000450620320	GD	On-Demand	Anodyne	SSTR5	45	36
CCCS(=O)(=O)Nc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450620323	EB	On-Demand	Anodyne	PANK3	0	44
CCCS(=O)(=O)Nc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450620324	EB	On-Demand	Anodyne	PANK3	0	44
C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620337	CB	On-Demand	Anodyne	BIRC3	43	37
C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620337	CB	On-Demand	Anodyne	BIRC8	48	37
C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620338	CB	On-Demand	Anodyne	BIRC3	43	37
C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620338	CB	On-Demand	Anodyne	BIRC8	48	37
COc1ccc(-c2nnn(CC[C@@H](C)O)n2)cc1OC	ZINC000450620339	CD	On-Demand	Anodyne	PRKDC	20	40
COc1ccc(-c2nnn(CC[C@@H](C)O)n2)cc1OC	ZINC000450620339	CD	On-Demand	Anodyne	SCARB1	45	47
C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620340	CB	On-Demand	Anodyne	BIRC3	43	37
C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620340	CB	On-Demand	Anodyne	BIRC8	48	37
C[C@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620341	CB	On-Demand	Anodyne	BIRC3	43	37
C[C@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620341	CB	On-Demand	Anodyne	BIRC8	48	37
COc1ccc(-c2nnn(CC[C@H](C)O)n2)cc1OC	ZINC000450620345	CD	On-Demand	Anodyne	PRKDC	20	40
COc1ccc(-c2nnn(CC[C@H](C)O)n2)cc1OC	ZINC000450620345	CD	On-Demand	Anodyne	SCARB1	45	47
CN1C[C@@H](NC(=O)CCCOc2cccc(Br)c2)C(=O)N1	ZINC000450620362	FD	On-Demand	Anodyne	P2RY12	22	40
CN(CCCC(=O)c1ccc(Br)cc1)[C@@H]1CCNC1=O	ZINC000450620366	EE	On-Demand	Anodyne	SHC	49	37
CN(CCCC(=O)c1ccc(Br)cc1)[C@H]1CCNC1=O	ZINC000450620368	EE	On-Demand	Anodyne	SHC	49	37
CN1C[C@H](NC(=O)CCCOc2cccc(Br)c2)C(=O)N1	ZINC000450620369	FD	On-Demand	Anodyne	P2RY12	22	40
CC(C)[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620383	EC	On-Demand	Anodyne	ELANE	27	44
CC(C)[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620384	EC	On-Demand	Anodyne	ELANE	27	44
CC(C)[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620385	EC	On-Demand	Anodyne	ELANE	27	44
CC(C)[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620386	EC	On-Demand	Anodyne	ELANE	27	44
CCC1(CNC(=O)c2cnc(C3CC3)nc2)CCCCC1	ZINC000450620401	CG	On-Demand	Anodyne	HCN4	41	32
O=C(c1ccccc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450620415	EG	On-Demand	Anodyne	SRD5A2	0	43
O=C(c1ccccc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450620415	EG	On-Demand	Anodyne	GRM5	0	43
O=C(c1ccccc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450620415	EG	On-Demand	Anodyne	MAL12	0	42
O=C(c1ccccc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450620415	EG	On-Demand	Anodyne	FIMH	24	49
O=C(c1ccccc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450620415	EG	On-Demand	Anodyne	ADIPOR1	0	41
O=C(c1ccccc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450620415	EG	On-Demand	Anodyne	ADIPOR2	0	41
Cn1cc(-c2ccc(C(=O)N3CCCC[C@H]3c3ccccc3)o2)cn1	ZINC000450620416	EI	On-Demand	Anodyne	CPT1A	69	36
Cn1cc(-c2ccc(C(=O)N3CCCC[C@H]3c3ccccc3)o2)cn1	ZINC000450620416	EI	On-Demand	Anodyne	ABHD6	0	40
Cn1cc(-c2ccc(C(=O)N3CCCC[C@@H]3c3ccccc3)o2)cn1	ZINC000450620417	EI	On-Demand	Anodyne	CPT1A	69	36
Cn1cc(-c2ccc(C(=O)N3CCCC[C@@H]3c3ccccc3)o2)cn1	ZINC000450620417	EI	On-Demand	Anodyne	ABHD6	0	40
CN1C[C@H](NC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450620422	GB	On-Demand	Anodyne	BDKRB1	49	36
CN1C[C@H](NC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450620422	GB	On-Demand	Anodyne	TGM2	42	35
CN1C[C@H](NC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450620422	GB	On-Demand	Anodyne	F13A1	47	36
CN1C[C@@H](NC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450620427	GB	On-Demand	Anodyne	BDKRB1	49	36
CN1C[C@@H](NC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450620427	GB	On-Demand	Anodyne	TGM2	42	35
CN1C[C@@H](NC(=O)CCc2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N1	ZINC000450620427	GB	On-Demand	Anodyne	F13A1	47	36
COCCOC[C@@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450620434	EE	On-Demand	Anodyne	HRH1	36	41
COCCOC[C@@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450620434	EE	On-Demand	Anodyne	CCR3	37	41
COCCOC[C@@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450620434	EE	On-Demand	Anodyne	ABCB1	44	39
COCCOC[C@@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450620434	EE	On-Demand	Anodyne	SCD1	40	43
COCCOC[C@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450620435	EE	On-Demand	Anodyne	HRH1	36	41
COCCOC[C@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450620435	EE	On-Demand	Anodyne	CCR3	37	41
COCCOC[C@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450620435	EE	On-Demand	Anodyne	ABCB1	44	39
COCCOC[C@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000450620435	EE	On-Demand	Anodyne	SCD1	40	43
CCC1(CNC(=O)c2cc3n(n2)CCCC3)CCCCC1	ZINC000450620437	CG	On-Demand	Anodyne	HCN1	55	34
CCC1(CNC(=O)c2cc3n(n2)CCCC3)CCCCC1	ZINC000450620437	CG	On-Demand	Anodyne	HCN4	52	34
COc1cc2c(NCc3nc(C(C)C)n[nH]3)ncnc2cc1F	ZINC000450620456	DE	On-Demand	Anodyne	EGFR	30	54
CC[C@@H](C)[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450620476	FH	On-Demand	Anodyne	AVPR2	73	40
CC[C@@H](C)[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450620476	FH	On-Demand	Anodyne	AVPR1A	50	43
CC[C@@H](C)[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450620477	FH	On-Demand	Anodyne	AVPR2	73	40
CC[C@@H](C)[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450620477	FH	On-Demand	Anodyne	AVPR1A	50	43
CC[C@H](C)[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450620478	FH	On-Demand	Anodyne	AVPR2	73	40
CC[C@H](C)[C@@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450620478	FH	On-Demand	Anodyne	AVPR1A	50	43
CC[C@H](C)[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450620480	FH	On-Demand	Anodyne	AVPR2	73	40
CC[C@H](C)[C@H](CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450620480	FH	On-Demand	Anodyne	AVPR1A	50	43
COC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450620483	CE	On-Demand	Anodyne	CA14	16	42
COC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450620483	CE	On-Demand	Anodyne	FIMH	19	42
CCc1cc(CCCN(C)Cc2cccc(OC(C)C)c2)on1	ZINC000450620488	DI	On-Demand	Anodyne	ACHE	0	41
CCS(=O)(=O)c1ccc(COc2cc(OC)ccc2C(C)=O)cc1	ZINC000450620489	EG	On-Demand	Anodyne	KCNA3	22	42
CCS(=O)(=O)c1ccc(COc2cc(OC)ccc2C(C)=O)cc1	ZINC000450620489	EG	On-Demand	Anodyne	MTNR1A	29	42
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	THRA	51	48
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	P2RY12	22	43
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	THRB	29	48
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	KCNQ1	0	43
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	HRH3	15	47
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	PLA2G4A	19	48
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	SAT1	0	49
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	PLA2G4B	98	48
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	ESRRG	42	33
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	ACR	52	49
CC(=O)CCCCCOc1ccc(C(C)=O)cc1	ZINC000450620502	BG	On-Demand	Anodyne	SLC47A1	21	49
CCCc1nc(C)c(Cn2cnc3ccccc32)o1	ZINC000450620509	CG	On-Demand	Anodyne	PKM	22	42
Cn1cnc([N+](=O)[O-])c1NCCOc1ccc(Cl)c(Cl)c1	ZINC000450620532	EG	On-Demand	Bother	S1PR4	0	41
CC[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450620538	FJ	On-Demand	Anodyne	GPR88	0	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450620539	FJ	On-Demand	Anodyne	GPR88	0	42
CSc1cccc(C(=O)NC[C@@]2(O)CCN(C)C2)c1	ZINC000450620542	CD	On-Demand	Anodyne	DRD4	42	32
CSc1cccc(C(=O)NC[C@]2(O)CCN(C)C2)c1	ZINC000450620544	CD	On-Demand	Anodyne	DRD4	42	32
Cc1cc(CNc2ncc(C(=O)N(C)C)cc2Cl)ccn1	ZINC000450620545	DF	On-Demand	Anodyne	PDE6A	42	34
C=CC[C@@H](CO)CNC(=O)CCOc1cccc(OC)c1	ZINC000450620554	CD	On-Demand	Mild	MTNR1A	41	48
C=CC[C@@H](CO)CNC(=O)CCOc1cccc(OC)c1	ZINC000450620554	CD	On-Demand	Mild	MTNR1B	39	48
C=CC[C@H](CO)CNC(=O)CCOc1cccc(OC)c1	ZINC000450620555	CD	On-Demand	Mild	MTNR1A	41	48
C=CC[C@H](CO)CNC(=O)CCOc1cccc(OC)c1	ZINC000450620555	CD	On-Demand	Mild	MTNR1B	39	48
Cc1cc(CNc2ncccc2C(=O)OC(C)C)ccn1	ZINC000450620558	CF	On-Demand	Anodyne	BDKRB1	26	42
CCOc1ccc2nc(SCc3ccn(CC(F)(F)F)n3)[nH]c2c1	ZINC000450620561	FI	On-Demand	Anodyne	CYP2C8	29	42
CCOc1ccc2nc(SCc3ccn(CC(F)(F)F)n3)[nH]c2c1	ZINC000450620561	FI	On-Demand	Anodyne	CYP1A2	19	45
CCOc1ccc2nc(SCc3ccn(CC(F)(F)F)n3)[nH]c2c1	ZINC000450620561	FI	On-Demand	Anodyne	CYP2C19	39	45
CC(C)(CC(=O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000450620562	CG	On-Demand	Bother	CACNA1C	52	37
CC(C)(CC(=O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000450620562	CG	On-Demand	Bother	MGLL	0	40
CC(C)(CC(=O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000450620562	CG	On-Demand	Bother	ABHD6	0	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450620566	FI	On-Demand	Anodyne	PRCP	16	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450620567	FI	On-Demand	Anodyne	PRCP	16	42
CC(=O)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450620569	CE	On-Demand	Anodyne	HCN4	40	31
COC(=O)Cn1cc(COc2ccc(F)cc2)nn1	ZINC000450620578	CD	On-Demand	Anodyne	FIMH	26	40
CC(=O)c1cccc(CN2CCCC[C@H]2C(=O)OC(C)(C)C)c1	ZINC000450620606	DH	On-Demand	Anodyne	FKBP1A	62	38
CC(=O)c1cccc(CN2CCCC[C@H]2C(=O)OC(C)(C)C)c1	ZINC000450620606	DH	On-Demand	Anodyne	PREP	34	42
CC(=O)c1cccc(CN2CCCC[C@@H]2C(=O)OC(C)(C)C)c1	ZINC000450620607	DH	On-Demand	Anodyne	FKBP1A	62	38
CC(=O)c1cccc(CN2CCCC[C@@H]2C(=O)OC(C)(C)C)c1	ZINC000450620607	DH	On-Demand	Anodyne	PREP	34	42
COC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1Cl	ZINC000450620609	FH	On-Demand	Anodyne	MCHR1	19	40
COC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1Cl	ZINC000450620609	FH	On-Demand	Anodyne	ABCG2	30	43
COC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1Cl	ZINC000450620609	FH	On-Demand	Anodyne	NOD1	31	41
COC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1Cl	ZINC000450620609	FH	On-Demand	Anodyne	NOD2	47	41
COC(=O)c1cccc(CN2CC[C@H](S(N)(=O)=O)C2)c1Cl	ZINC000450620635	EC	On-Demand	Anodyne	HTR4	40	35
COC(=O)c1cccc(CN2CC[C@@H](S(N)(=O)=O)C2)c1Cl	ZINC000450620638	EC	On-Demand	Anodyne	HTR4	40	35
COc1ccc(CNC(=O)CCN2CCc3c(F)cccc3C2)c(OC)c1	ZINC000450620647	FF	On-Demand	Anodyne	DRD3	0	42
O=C(CN1CCN(CC2=CCCCC2)CC1)Nc1ccc(Cl)cc1	ZINC000450620651	EG	On-Demand	Anodyne	NOD1	25	40
CC(=O)N1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C(C)(C)C1	ZINC000450620691	FF	On-Demand	Anodyne	CHRM5	23	41
C[C@H](OCCc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450620699	FH	On-Demand	Anodyne	ANPEP	15	43
C[C@@H](OCCc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450620700	FH	On-Demand	Anodyne	ANPEP	15	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1	ZINC000450620701	EF	On-Demand	Anodyne	ITGA4	46	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1	ZINC000450620702	EF	On-Demand	Anodyne	ITGA4	46	36
CC(C)(CNc1ncc(Cl)cc1F)c1ccccn1	ZINC000450620704	CH	On-Demand	Anodyne	F2	15	41
COc1ccc(-n2c(SCC[C@@H](C)O)nnc2-c2ccncc2)cc1	ZINC000450620708	FG	On-Demand	Anodyne	WNT3A	24	52
COc1ccc(-n2c(SCC[C@@H](C)O)nnc2-c2ccncc2)cc1	ZINC000450620708	FG	On-Demand	Anodyne	AXIN2	0	41
COc1ccc(-n2c(SCC[C@H](C)O)nnc2-c2ccncc2)cc1	ZINC000450620709	FG	On-Demand	Anodyne	WNT3A	24	52
COc1ccc(-n2c(SCC[C@H](C)O)nnc2-c2ccncc2)cc1	ZINC000450620709	FG	On-Demand	Anodyne	AXIN2	0	41
CCCc1nc(C)c(CSc2nnc(-c3cc(OC)cc(OC)c3)o2)o1	ZINC000450620717	GI	On-Demand	Anodyne	GSK3A	28	42
O=C(CCCN1CC=C(C(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450620720	DH	On-Demand	Anodyne	DRD2	31	47
O=C(CCCN1CC=C(C(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450620720	DH	On-Demand	Anodyne	DRD4	15	50
O=C(CCCN1CC=C(C(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450620720	DH	On-Demand	Anodyne	HTR2A	23	56
O=C(CCCN1CC=C(C(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450620720	DH	On-Demand	Anodyne	ERG2	24	50
O=C(CCCN1CC=C(C(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450620720	DH	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CC=C(C(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450620720	DH	On-Demand	Anodyne	CYP2J2	53	38
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450620727	GH	On-Demand	Anodyne	GNAI1	0	43
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450620727	GH	On-Demand	Anodyne	GNAI3	0	43
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450620727	GH	On-Demand	Anodyne	GNAO1	0	43
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450620728	GH	On-Demand	Anodyne	GNAI1	0	43
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450620728	GH	On-Demand	Anodyne	GNAI3	0	43
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450620728	GH	On-Demand	Anodyne	GNAO1	0	43
CN1C[C@@H](NC(=O)[C@@H]2COCCN2CC2CCC2)C(=O)N1	ZINC000450620729	CA	On-Demand	Anodyne	HSD11B1	21	40
CN1C[C@H](NC(=O)[C@H]2COCCN2CC2CCC2)C(=O)N1	ZINC000450620730	CA	On-Demand	Anodyne	HSD11B1	21	40
CN1C[C@H](NC(=O)[C@@H]2COCCN2CC2CCC2)C(=O)N1	ZINC000450620731	CA	On-Demand	Anodyne	HSD11B1	21	40
CN1C[C@@H](NC(=O)[C@H]2COCCN2CC2CCC2)C(=O)N1	ZINC000450620732	CA	On-Demand	Anodyne	HSD11B1	21	40
COCc1cc(NCC(C)(C)c2ccccn2)n2ncnc2n1	ZINC000450620734	DE	On-Demand	Anodyne	DHOD	0	44
CC(C)(CNc1cnn(Cc2ccccc2)c(=O)c1Cl)c1ccccn1	ZINC000450620746	FH	On-Demand	Anodyne	NPBWR1	35	41
CN(Cc1cccc(C(F)(F)F)c1)C1CCN(CCc2cscn2)CC1	ZINC000450620765	GI	On-Demand	Anodyne	SCN5A	41	34
COC(=O)c1ccc(CC(=O)NCc2nc3ccccc3n2C2CC2)cc1	ZINC000450620766	FG	On-Demand	Anodyne	NS5B	0	40
Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)nn1-c1ccc(F)cc1	ZINC000450620767	DC	On-Demand	Anodyne	NPY5R	15	43
Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)nn1-c1ccc(F)cc1	ZINC000450620768	DC	On-Demand	Anodyne	NPY5R	15	43
COc1ccc2c(NC[C@H]3CCCCN3CCO)ncnc2c1F	ZINC000450620769	ED	On-Demand	Anodyne	PDE6A	43	36
COc1ccc2c(NC[C@@H]3CCCCN3CCO)ncnc2c1F	ZINC000450620770	ED	On-Demand	Anodyne	PDE6A	43	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@]23CC[C@@H](CC2=O)C3(C)C)cc1	ZINC000450620771	FG	On-Demand	Anodyne	TIMP3	44	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@]23CC[C@@H](CC2=O)C3(C)C)cc1	ZINC000450620772	FG	On-Demand	Anodyne	TIMP3	44	35
O=C(CCCN1C[C@H](O)C[C@H]1c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000450620773	GI	On-Demand	Anodyne	CCR2	44	41
O=C(CCCN1C[C@H](O)C[C@H]1c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000450620773	GI	On-Demand	Anodyne	CYP2J2	53	37
O=C(CCCN1C[C@@H](O)C[C@H]1c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000450620774	GI	On-Demand	Anodyne	CCR2	44	41
O=C(CCCN1C[C@@H](O)C[C@H]1c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000450620774	GI	On-Demand	Anodyne	CYP2J2	53	37
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000450620775	GI	On-Demand	Anodyne	CCR2	44	41
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000450620775	GI	On-Demand	Anodyne	CYP2J2	53	37
O=C(CCCN1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000450620776	GI	On-Demand	Anodyne	CCR2	44	41
O=C(CCCN1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000450620776	GI	On-Demand	Anodyne	CYP2J2	53	37
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450620779	EH	On-Demand	Anodyne	NPY2R	28	41
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450620779	EH	On-Demand	Anodyne	TIMP3	42	32
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450620780	EH	On-Demand	Anodyne	NPY2R	28	41
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450620780	EH	On-Demand	Anodyne	TIMP3	42	32
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450620781	EH	On-Demand	Anodyne	NPY2R	28	41
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450620781	EH	On-Demand	Anodyne	TIMP3	42	32
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450620782	EH	On-Demand	Anodyne	NPY2R	28	41
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450620782	EH	On-Demand	Anodyne	TIMP3	42	32
CCC[C@@H](O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450620783	ED	On-Demand	Anodyne	GNAI1	0	51
CCC[C@@H](O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450620783	ED	On-Demand	Anodyne	GNAI3	0	51
CCC[C@@H](O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450620783	ED	On-Demand	Anodyne	GNAO1	0	51
CCC[C@H](O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450620784	ED	On-Demand	Anodyne	GNAI1	0	51
CCC[C@H](O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450620784	ED	On-Demand	Anodyne	GNAI3	0	51
CCC[C@H](O)CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450620784	ED	On-Demand	Anodyne	GNAO1	0	51
O=C(c1ccc(O)nc1)N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450620786	ED	On-Demand	Anodyne	BDKRB1	18	40
O=C(c1ccc(O)nc1)N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450620787	ED	On-Demand	Anodyne	BDKRB1	18	40
COC[C@]1(C)CCN(c2c(C)cnc3c(C)cccc23)C1	ZINC000450620788	CH	On-Demand	Anodyne	ATP4A	18	40
COC[C@@]1(C)CCN(c2c(C)cnc3c(C)cccc23)C1	ZINC000450620789	CH	On-Demand	Anodyne	ATP4A	18	40
COCCOC[C@H](O)CN1CCC[C@H](Oc2ccccc2Cl)C1	ZINC000450620820	EE	On-Demand	Anodyne	SLC6A1	42	36
COCCOC[C@H](O)CN1CCC[C@H](Oc2ccccc2Cl)C1	ZINC000450620820	EE	On-Demand	Anodyne	ABCB1	47	39
COCCOC[C@@H](O)CN1CCC[C@H](Oc2ccccc2Cl)C1	ZINC000450620821	EE	On-Demand	Anodyne	SLC6A1	42	36
COCCOC[C@@H](O)CN1CCC[C@H](Oc2ccccc2Cl)C1	ZINC000450620821	EE	On-Demand	Anodyne	ABCB1	47	39
COCCOC[C@H](O)CN1CCC[C@@H](Oc2ccccc2Cl)C1	ZINC000450620822	EE	On-Demand	Anodyne	SLC6A1	42	36
COCCOC[C@H](O)CN1CCC[C@@H](Oc2ccccc2Cl)C1	ZINC000450620822	EE	On-Demand	Anodyne	ABCB1	47	39
COCCOC[C@@H](O)CN1CCC[C@@H](Oc2ccccc2Cl)C1	ZINC000450620823	EE	On-Demand	Anodyne	SLC6A1	42	36
COCCOC[C@@H](O)CN1CCC[C@@H](Oc2ccccc2Cl)C1	ZINC000450620823	EE	On-Demand	Anodyne	ABCB1	47	39
CCN(CCC1CC1)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450620828	DF	On-Demand	Anodyne	OPRM1	0	41
CCN(CCC1CC1)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450620828	DF	On-Demand	Anodyne	OPRD1	26	41
CN1C[C@@H](NC(=O)CN2C(=O)CCCc3ccccc32)C(=O)N1	ZINC000450620829	DB	On-Demand	Anodyne	ACE	18	41
CN1C[C@H](NC(=O)CN2C(=O)CCCc3ccccc32)C(=O)N1	ZINC000450620830	DB	On-Demand	Anodyne	ACE	18	41
COc1ccc(-c2nnn(C[C@H](Cc3ccccc3)OC)n2)cc1OC	ZINC000450620843	FF	On-Demand	Anodyne	PDEB1	0	41
COc1ccc(-c2nnn(C[C@@H](Cc3ccccc3)OC)n2)cc1OC	ZINC000450620844	FF	On-Demand	Anodyne	PDEB1	0	41
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620856	FC	On-Demand	Anodyne	BIRC8	42	32
CC[C@H](C)[C@H](CNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])OC	ZINC000450620858	ED	On-Demand	Bother	BDKRB1	22	43
CC[C@H](C)[C@@H](CNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])OC	ZINC000450620859	ED	On-Demand	Bother	BDKRB1	22	43
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620860	FC	On-Demand	Anodyne	BIRC8	42	32
CC[C@@H](C)[C@@H](CNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])OC	ZINC000450620861	ED	On-Demand	Bother	BDKRB1	22	43
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620862	FC	On-Demand	Anodyne	BIRC8	42	32
CC[C@@H](C)[C@H](CNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])OC	ZINC000450620863	ED	On-Demand	Bother	BDKRB1	22	43
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620864	FC	On-Demand	Anodyne	BIRC8	42	32
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620866	FD	On-Demand	Anodyne	DRD2	32	40
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620866	FD	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620866	FD	On-Demand	Anodyne	MTNR1A	59	37
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620866	FD	On-Demand	Anodyne	MTNR1B	53	37
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620866	FD	On-Demand	Anodyne	ACKR3	72	36
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450620869	FD	On-Demand	Anodyne	DRD2	32	40
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450620869	FD	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450620869	FD	On-Demand	Anodyne	MTNR1A	59	37
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450620869	FD	On-Demand	Anodyne	MTNR1B	53	37
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450620869	FD	On-Demand	Anodyne	ACKR3	72	36
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450620871	FD	On-Demand	Anodyne	DRD2	32	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450620871	FD	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450620871	FD	On-Demand	Anodyne	MTNR1A	59	37
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450620871	FD	On-Demand	Anodyne	MTNR1B	53	37
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450620871	FD	On-Demand	Anodyne	ACKR3	72	36
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620873	FD	On-Demand	Anodyne	DRD2	32	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620873	FD	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620873	FD	On-Demand	Anodyne	MTNR1A	59	37
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620873	FD	On-Demand	Anodyne	MTNR1B	53	37
COc1ccc(CNC(=O)CCN2CCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450620873	FD	On-Demand	Anodyne	ACKR3	72	36
CCN(CCC1CC1)C(=O)c1cncc(Cl)c1	ZINC000450620877	CF	On-Demand	Anodyne	CACNA1I	44	37
CCN(CCC1CC1)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450620881	EI	On-Demand	Anodyne	MTNR1A	25	40
CCN(CCC1CC1)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450620881	EI	On-Demand	Anodyne	MTNR1B	26	40
CCN(CCC1CC1)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450620881	EI	On-Demand	Anodyne	GPBAR1	44	35
CCCC[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OC	ZINC000450620890	EE	On-Demand	Anodyne	P2RY12	51	39
CCCC[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OC	ZINC000450620891	EE	On-Demand	Anodyne	P2RY12	51	39
CCCC[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OC	ZINC000450620893	EE	On-Demand	Anodyne	P2RY12	51	39
CCCC[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OC	ZINC000450620894	EE	On-Demand	Anodyne	P2RY12	51	39
C[C@H](Sc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620899	CC	On-Demand	Anodyne	BIRC8	41	32
C[C@@H](Sc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620903	CC	On-Demand	Anodyne	BIRC8	41	32
C[C@@H](Sc1ccccc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620904	CC	On-Demand	Anodyne	BIRC8	41	32
C[C@H](Sc1ccccc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620906	CC	On-Demand	Anodyne	BIRC8	41	32
CN1C[C@@H](NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccco2)C(=O)N1	ZINC000450620918	FC	On-Demand	Anodyne	CFTR	57	37
CN1C[C@@H](NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccco2)C(=O)N1	ZINC000450620918	FC	On-Demand	Anodyne	ADAM9	46	32
CN1C[C@H](NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccco2)C(=O)N1	ZINC000450620926	FC	On-Demand	Anodyne	CFTR	57	37
CN1C[C@H](NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccco2)C(=O)N1	ZINC000450620926	FC	On-Demand	Anodyne	ADAM9	46	32
CN1C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)c2ccco2)C(=O)N1	ZINC000450620927	FC	On-Demand	Anodyne	CFTR	57	37
CN1C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)c2ccco2)C(=O)N1	ZINC000450620927	FC	On-Demand	Anodyne	ADAM9	46	32
CN1C[C@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)c2ccco2)C(=O)N1	ZINC000450620928	FC	On-Demand	Anodyne	CFTR	57	37
CN1C[C@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)c2ccco2)C(=O)N1	ZINC000450620928	FC	On-Demand	Anodyne	ADAM9	46	32
C[C@H](c1ccc(CSc2nnc(CN3CCCC3=O)o2)cc1)C(F)(F)F	ZINC000450620943	GI	On-Demand	Anodyne	PTK2	24	42
C[C@@H](c1ccc(CSc2nnc(CN3CCCC3=O)o2)cc1)C(F)(F)F	ZINC000450620944	GI	On-Demand	Anodyne	PTK2	24	42
CN1C[C@@H](NC(=O)c2ccc(Cn3cccn3)cc2)C(=O)N1	ZINC000450620945	CC	On-Demand	Anodyne	NAAA	17	40
CN1C[C@H](NC(=O)c2ccc(Cn3cccn3)cc2)C(=O)N1	ZINC000450620946	CC	On-Demand	Anodyne	NAAA	17	40
CCC[C@H](CC(C)C)C(=O)NCCC[C@@H]1CCCCO1	ZINC000450620951	CH	On-Demand	Anodyne	PFDN6	0	42
CCC[C@@H](CC(C)C)C(=O)NCCC[C@@H]1CCCCO1	ZINC000450620952	CH	On-Demand	Anodyne	PFDN6	0	42
CCC[C@H](CC(C)C)C(=O)NCCC[C@H]1CCCCO1	ZINC000450620953	CH	On-Demand	Anodyne	PFDN6	0	42
CCC[C@@H](CC(C)C)C(=O)NCCC[C@H]1CCCCO1	ZINC000450620954	CH	On-Demand	Anodyne	PFDN6	0	42
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620957	FC	On-Demand	Anodyne	ANPEP	17	47
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	HTR1A	19	50
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	DRD2	20	49
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	DRD4	42	33
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	DRD3	23	43
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	DRD5	26	49
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	HTR7	37	40
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	SSTR4	49	36
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	HTR5A	23	51
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	ABCB1B	41	34
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	MTNR1A	46	39
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	MTNR1B	44	39
COc1ccc(CNC(=O)CCN2CCc3c([nH]c4ccccc34)C2)c(OC)c1	ZINC000450620958	GG	On-Demand	Anodyne	SSTR1	18	42
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450620959	FC	On-Demand	Anodyne	ANPEP	17	47
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620960	FC	On-Demand	Anodyne	ANPEP	17	47
CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450620962	FC	On-Demand	Anodyne	ANPEP	17	47
FC(F)(F)Cn1ccc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450620966	FI	On-Demand	Anodyne	SCN5A	74	37
FC(F)(F)Cn1ccc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450620966	FI	On-Demand	Anodyne	SCD1	49	43
FC(F)(F)Cn1ccc(CN2CCC(Oc3ccccc3Cl)CC2)n1	ZINC000450620966	FI	On-Demand	Anodyne	SCD	26	40
COc1cc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)ccc1Cl	ZINC000450620967	FI	On-Demand	Anodyne	GRM4	17	48
COc1cc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)ccc1Cl	ZINC000450620967	FI	On-Demand	Anodyne	NCE103	22	45
COc1cc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)ccc1Cl	ZINC000450620967	FI	On-Demand	Anodyne	PFK	0	42
COc1cc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)ccc1Cl	ZINC000450620967	FI	On-Demand	Anodyne	ENPP1	82	41
COc1cc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)ccc1Cl	ZINC000450620967	FI	On-Demand	Anodyne	IMDH_CRYPV	32	53
COc1cc(CC(=O)Nc2ccc(OC)c(OC(C)C)c2)ccc1Cl	ZINC000450620967	FI	On-Demand	Anodyne	CAN2	0	45
CSc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1C	ZINC000450620968	DH	On-Demand	Anodyne	PRNP	31	41
CSc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1C	ZINC000450620968	DH	On-Demand	Anodyne	HDAC1	42	48
C[C@H]1COCCN(CCc2ccc(Cl)cc2)C1	ZINC000450620969	CF	On-Demand	Anodyne	SIGMAR1	19	48
C[C@@H]1COCCN(CCc2ccc(Cl)cc2)C1	ZINC000450620970	CF	On-Demand	Anodyne	SIGMAR1	19	48
c1ccc2c3c([nH]c2c1)CN(C[C@H]1C[C@H]2CC[C@H]1O2)CC3	ZINC000450620973	CG	On-Demand	Anodyne	DRD5	20	47
c1ccc2c3c([nH]c2c1)CN(C[C@@H]1C[C@H]2CC[C@H]1O2)CC3	ZINC000450620976	CG	On-Demand	Anodyne	DRD5	20	47
CCc1cc(NCc2nc(C(C)C)n[nH]2)n2ncnc2n1	ZINC000450620979	CD	On-Demand	Anodyne	DHOD	0	51
CN1C[C@@H](NC(=O)COc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450620984	DC	On-Demand	Anodyne	ADORA2B	34	40
CN1C[C@@H](NC(=O)COc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450620984	DC	On-Demand	Anodyne	TRAR	45	42
CN1C[C@@H](NC(=O)COc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450620984	DC	On-Demand	Anodyne	LUXN	0	46
CN1C[C@H](NC(=O)COc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450620990	DC	On-Demand	Anodyne	ADORA2B	34	40
CN1C[C@H](NC(=O)COc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450620990	DC	On-Demand	Anodyne	TRAR	45	42
CN1C[C@H](NC(=O)COc2ccc(C(C)(C)C)cc2)C(=O)N1	ZINC000450620990	DC	On-Demand	Anodyne	LUXN	0	46
COC(=O)C1(CN2CCNC(=O)[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450620992	FE	On-Demand	Anodyne	TRPM8	49	37
COC(=O)C1(CN2CCNC(=O)[C@@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450620993	FE	On-Demand	Anodyne	TRPM8	49	37
O=C(CS(=O)(=O)C1CC1)NCCSCc1ccc(Cl)cc1Cl	ZINC000450621000	GF	On-Demand	Anodyne	P2RX7	28	40
COC(=O)C1(CN2CCc3c([nH]c4ccccc34)C2)CC1	ZINC000450621013	CE	On-Demand	Anodyne	HTR5A	23	53
COc1ccc([N+](=O)[O-])cc1OCC1CC(F)(F)C1	ZINC000450621021	CG	On-Demand	Bother	CYP19A1	15	44
COc1ccc(NC(=O)[C@@]2(OC(C)C)CCOC2)cc1OC(C)C	ZINC000450621023	EG	On-Demand	Anodyne	ENPP1	47	31
COc1ccc(NC(=O)[C@]2(OC(C)C)CCOC2)cc1OC(C)C	ZINC000450621024	EG	On-Demand	Anodyne	ENPP1	47	31
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	HTR1A	104	52
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	DRD2	76	47
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	DRD1	30	44
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	DRD4	53	51
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	HTR2A	66	47
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	HTR2C	43	44
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	SLC6A4	22	47
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	HRH1	19	47
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	DRD3	73	47
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	HTR7	106	52
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	SIGMAR1	19	47
Cc1nc(N2CCN(CCCC(=O)c3ccccc3)CC2)sc1C	ZINC000450621030	EH	On-Demand	Anodyne	CYP2J2	60	44
CC(C)OC(C)(C)C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1	ZINC000450621042	EF	On-Demand	Anodyne	NOD2	40	35
CC1(C)CN(CC(F)(F)F)CCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450621068	GH	On-Demand	Anodyne	CHRM5	33	40
CC(=O)N1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000450621072	FE	On-Demand	Bother	MGLL	0	45
COc1cc(CN2CC[C@H](C(N)=O)c3ccccc32)ccc1Cl	ZINC000450621073	EG	On-Demand	Anodyne	PYGM	30	44
COc1cc(CN2CC[C@@H](C(N)=O)c3ccccc32)ccc1Cl	ZINC000450621074	EG	On-Demand	Anodyne	PYGM	30	44
NC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621093	EG	On-Demand	Anodyne	DRD2	30	40
NC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621093	EG	On-Demand	Anodyne	DRD4	0	48
NC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621093	EG	On-Demand	Anodyne	HTR2A	24	48
NC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621093	EG	On-Demand	Anodyne	HTR2C	23	50
NC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621093	EG	On-Demand	Anodyne	SLC18A3	0	47
NC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621093	EG	On-Demand	Anodyne	HTR3B	0	48
NC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621093	EG	On-Demand	Anodyne	CYP2J2	52	36
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621094	EG	On-Demand	Anodyne	DRD2	30	40
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621094	EG	On-Demand	Anodyne	DRD4	0	48
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621094	EG	On-Demand	Anodyne	HTR2A	24	48
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621094	EG	On-Demand	Anodyne	HTR2C	23	50
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621094	EG	On-Demand	Anodyne	SLC18A3	0	47
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621094	EG	On-Demand	Anodyne	HTR3B	0	48
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)c2ccccc21	ZINC000450621094	EG	On-Demand	Anodyne	CYP2J2	52	36
COc1cc(CC(=O)N2CCN(c3cccc(C#N)n3)CC2)ccc1Cl	ZINC000450621100	FF	On-Demand	Mild	CCR1	23	45
CC(=O)[C@@](C)(O)CN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450621103	FD	On-Demand	Anodyne	IMDH_CRYPV	21	40
CC(=O)[C@](C)(O)CN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450621104	FD	On-Demand	Anodyne	IMDH_CRYPV	21	40
CO[C@@H](Cc1ccccc1)CN(C)C[C@H]1CCN(C(C)=O)C1	ZINC000450621131	DE	On-Demand	Anodyne	GRIN2B	40	34
CO[C@H](Cc1ccccc1)CN(C)C[C@H]1CCN(C(C)=O)C1	ZINC000450621132	DE	On-Demand	Anodyne	GRIN2B	40	34
CO[C@@H](Cc1ccccc1)CN(C)C[C@@H]1CCN(C(C)=O)C1	ZINC000450621134	DE	On-Demand	Anodyne	GRIN2B	40	34
CO[C@H](Cc1ccccc1)CN(C)C[C@@H]1CCN(C(C)=O)C1	ZINC000450621137	DE	On-Demand	Anodyne	GRIN2B	40	34
COC(=O)c1ccc(CN2CC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621146	EC	On-Demand	Anodyne	DRD4	33	44
COC(=O)c1ccc(CN2CC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621146	EC	On-Demand	Anodyne	DRD3	0	44
COC(=O)c1ccc(CN2CC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621146	EC	On-Demand	Anodyne	OPRK1	27	40
COC(=O)c1ccc(CN2CC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621146	EC	On-Demand	Anodyne	HTR4	73	36
COC(=O)c1ccc(CN2CC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621146	EC	On-Demand	Anodyne	CCR3	39	40
COC(=O)c1ccc(CN2CC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621146	EC	On-Demand	Anodyne	UTS2R	23	41
COC(=O)c1ccc(CN2CC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621146	EC	On-Demand	Anodyne	MCHR1	30	45
COC(=O)c1ccc(CN2CC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621148	EC	On-Demand	Anodyne	DRD4	33	44
COC(=O)c1ccc(CN2CC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621148	EC	On-Demand	Anodyne	DRD3	0	44
COC(=O)c1ccc(CN2CC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621148	EC	On-Demand	Anodyne	OPRK1	27	40
COC(=O)c1ccc(CN2CC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621148	EC	On-Demand	Anodyne	HTR4	73	36
COC(=O)c1ccc(CN2CC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621148	EC	On-Demand	Anodyne	CCR3	39	40
COC(=O)c1ccc(CN2CC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621148	EC	On-Demand	Anodyne	UTS2R	23	41
COC(=O)c1ccc(CN2CC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450621148	EC	On-Demand	Anodyne	MCHR1	30	45
CC[C@@H](CC#N)NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450621149	CF	On-Demand	Mild	GPR88	0	44
CN1C[C@H](NC(=O)COc2cccc(F)c2)C(=O)N1	ZINC000450621172	CB	On-Demand	Anodyne	CHRNA10	28	40
CCCC[C@@H](NC(=O)c1ccc2nccnc2n1)C(=O)OC	ZINC000450621176	DD	On-Demand	Anodyne	P2RY12	93	34
CCCC[C@H](NC(=O)c1ccc2nccnc2n1)C(=O)OC	ZINC000450621177	DD	On-Demand	Anodyne	P2RY12	93	34
CN1C[C@@H](NC(=O)COc2cccc(F)c2)C(=O)N1	ZINC000450621179	CB	On-Demand	Anodyne	CHRNA10	28	40
CCCC[C@H](NC(=O)COc1ccc(C#N)c(Br)c1)C(=O)OC	ZINC000450621181	GF	On-Demand	Mild	PLA2G4B	40	34
CO[C@@H](Cc1ccccc1)C(=O)NCCN1CC=C(C)CC1	ZINC000450621184	DE	On-Demand	Anodyne	DRD4	40	31
CO[C@@H](Cc1ccccc1)C(=O)NCCN1CC=C(C)CC1	ZINC000450621184	DE	On-Demand	Anodyne	MME	50	38
CO[C@@H](Cc1ccccc1)C(=O)NCCN1CC=C(C)CC1	ZINC000450621184	DE	On-Demand	Anodyne	AMP1_PLAFQ	51	35
CO[C@H](Cc1ccccc1)C(=O)NCCN1CC=C(C)CC1	ZINC000450621185	DE	On-Demand	Anodyne	DRD4	40	31
CO[C@H](Cc1ccccc1)C(=O)NCCN1CC=C(C)CC1	ZINC000450621185	DE	On-Demand	Anodyne	MME	50	38
CO[C@H](Cc1ccccc1)C(=O)NCCN1CC=C(C)CC1	ZINC000450621185	DE	On-Demand	Anodyne	AMP1_PLAFQ	51	35
CCCC[C@@H](NC(=O)COc1ccc(C#N)c(Br)c1)C(=O)OC	ZINC000450621191	GF	On-Demand	Mild	PLA2G4B	40	34
CN1C[C@H](NC(=O)COc2ccc(O)cc2)C(=O)N1	ZINC000450621192	CB	On-Demand	Anodyne	TRAR	35	43
C[C@@H](C#N)CN(CCCC(=O)c1ccccc1)C1CC1	ZINC000450621197	CG	On-Demand	Mild	CYP2J2	46	35
CC1(CO)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450621203	FG	On-Demand	Anodyne	PDE6D	72	38
CC1(CO)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450621203	FG	On-Demand	Anodyne	HDAC8	30	40
CC1(CO)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450621203	FG	On-Demand	Anodyne	HDAC6	21	40
CC1(CO)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450621203	FG	On-Demand	Anodyne	IMDH_CRYPV	31	49
CC[C@@H](C)[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450621204	EE	On-Demand	Anodyne	NPY1R	43	34
CC[C@@H](C)[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450621204	EE	On-Demand	Anodyne	NPY2R	70	36
CN1C[C@@H](NC(=O)COc2ccc(O)cc2)C(=O)N1	ZINC000450621205	CB	On-Demand	Anodyne	TRAR	35	43
CC[C@@H](C)[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450621207	EE	On-Demand	Anodyne	NPY1R	43	34
CC[C@@H](C)[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450621207	EE	On-Demand	Anodyne	NPY2R	70	36
C[C@H](C#N)CN(CCCC(=O)c1ccccc1)C1CC1	ZINC000450621209	CG	On-Demand	Mild	CYP2J2	46	35
CC[C@H](C)[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450621210	EE	On-Demand	Anodyne	NPY1R	43	34
CC[C@H](C)[C@@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450621210	EE	On-Demand	Anodyne	NPY2R	70	36
C[C@@H]1CCCN(c2cc(NCc3cccc(C(F)(F)F)n3)ncn2)C1	ZINC000450621211	FH	On-Demand	Anodyne	PRCP	33	41
CC[C@H](C)[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450621212	EE	On-Demand	Anodyne	NPY1R	43	34
CC[C@H](C)[C@H](CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450621212	EE	On-Demand	Anodyne	NPY2R	70	36
C[C@H]1CCCN(c2cc(NCc3cccc(C(F)(F)F)n3)ncn2)C1	ZINC000450621213	FH	On-Demand	Anodyne	PRCP	33	41
Cn1c(NCCOc2ccc(F)c(Cl)c2)c(C#N)c(=O)n(C)c1=O	ZINC000450621215	FD	On-Demand	Mild	TRPV4	42	33
CCS(=O)(=O)c1ccc(CN(C)C[C@H]2CCC[C@H]2O)cc1	ZINC000450621228	DE	On-Demand	Anodyne	RORC	17	44
CCS(=O)(=O)c1ccc(CN(C)C[C@@H]2CCC[C@H]2O)cc1	ZINC000450621231	DE	On-Demand	Anodyne	RORC	17	44
CCS(=O)(=O)c1ccc(CN(C)C[C@@H]2CCC[C@@H]2O)cc1	ZINC000450621234	DE	On-Demand	Anodyne	RORC	17	44
CCS(=O)(=O)c1ccc(CN(C)C[C@H]2CCC[C@@H]2O)cc1	ZINC000450621235	DE	On-Demand	Anodyne	RORC	17	44
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1ccnc(C)c1	ZINC000450621236	EG	On-Demand	Bother	CACNA1D	61	34
Fc1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450621252	BE	On-Demand	Anodyne	MAL12	0	40
Fc1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450621252	BE	On-Demand	Anodyne	FIMH	23	45
COc1ccc(C(=O)NCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450621260	EB	On-Demand	Anodyne	DRD4	41	32
COc1ccc(C(=O)NCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450621260	EB	On-Demand	Anodyne	PLD1	23	41
COc1ccc(C(=O)NCCCC(=O)N[C@@H]2CN(C)NC2=O)cc1	ZINC000450621260	EB	On-Demand	Anodyne	HDA106	0	52
Cc1cc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)ccn1	ZINC000450621266	GD	On-Demand	Bother	MET	15	41
COc1ccc(C(=O)NCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450621268	EB	On-Demand	Anodyne	DRD4	41	32
COc1ccc(C(=O)NCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450621268	EB	On-Demand	Anodyne	PLD1	23	41
COc1ccc(C(=O)NCCCC(=O)N[C@H]2CN(C)NC2=O)cc1	ZINC000450621268	EB	On-Demand	Anodyne	HDA106	0	52
CN1C[C@@H](NC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)C(=O)N1	ZINC000450621270	FB	On-Demand	Anodyne	MMP7	15	40
CCOc1ccc2nc(S[C@@H]3CC[C@H](C#N)C3)[nH]c2c1	ZINC000450621275	CH	On-Demand	Mild	CYP2C19	27	40
CC[C@H](CC(F)(F)F)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450621280	EG	On-Demand	Bother	CACNA1D	41	35
CC[C@@H](CC(F)(F)F)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450621281	EG	On-Demand	Bother	CACNA1D	41	35
CCOc1ccc2nc(S[C@H]3CC[C@H](C#N)C3)[nH]c2c1	ZINC000450621283	CH	On-Demand	Mild	CYP2C19	27	40
CCOc1ccc2nc(S[C@H]3CC[C@@H](C#N)C3)[nH]c2c1	ZINC000450621284	CH	On-Demand	Mild	CYP2C19	27	40
CCOc1ccc2nc(S[C@@H]3CC[C@@H](C#N)C3)[nH]c2c1	ZINC000450621285	CH	On-Demand	Mild	CYP2C19	27	40
CN1C[C@@H](NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)C(=O)N1	ZINC000450621290	FB	On-Demand	Anodyne	MMP7	15	40
CN1C[C@H](NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)C(=O)N1	ZINC000450621294	FB	On-Demand	Anodyne	MMP7	15	40
CN1C[C@H](NC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)C(=O)N1	ZINC000450621296	FB	On-Demand	Anodyne	MMP7	15	40
CC1=CCN(CCNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450621301	DG	On-Demand	Anodyne	PLD1	17	43
CC1=CCN(CCNC(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450621308	DG	On-Demand	Anodyne	PLD1	17	43
C[C@H](Sc1ccc2c(c1)OCCCO2)C(=O)Nc1nccs1	ZINC000450621309	EG	On-Demand	Anodyne	MAP1	104	35
CC1=CCN(CCNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450621312	DG	On-Demand	Anodyne	PLD1	17	43
C[C@@H](Sc1ccc2c(c1)OCCCO2)C(=O)Nc1nccs1	ZINC000450621314	EG	On-Demand	Anodyne	MAP1	104	35
CC1=CCN(CCNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450621315	DG	On-Demand	Anodyne	PLD1	17	43
CN1C[C@@H](NC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)C(=O)N1	ZINC000450621338	FC	On-Demand	Anodyne	MST1R	50	39
CN1C[C@H](NC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)C(=O)N1	ZINC000450621340	FC	On-Demand	Anodyne	MST1R	50	39
COc1nccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450621366	GF	On-Demand	Anodyne	P2RY12	20	42
COc1nccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450621366	GF	On-Demand	Anodyne	PDGFRB	49	36
COc1nccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450621366	GF	On-Demand	Anodyne	PYGL	0	41
COc1nccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450621366	GF	On-Demand	Anodyne	FAAH	21	46
CC1(CO)CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450621373	GE	On-Demand	Mild	NR3C2	25	40
CC1(CO)CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450621373	GE	On-Demand	Mild	AR	25	40
CC1(CO)CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450621374	GE	On-Demand	Mild	NR3C2	25	40
CC1(CO)CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC1	ZINC000450621374	GE	On-Demand	Mild	AR	25	40
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	CHRM2	20	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	HTR1A	40	50
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	CHRM1	24	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	DRD2	36	50
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	DRD4	26	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	HTR2A	33	49
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	HTR2C	22	52
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	SLC6A1	52	34
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	SLC6A4	23	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	HRH1	15	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	DRD3	27	49
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	SLC6A3	42	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	CHRM3	17	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	HTR7	54	49
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	HRH3	15	40
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	SIGMAR1	36	49
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	SLC18A3	0	41
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	HTR3B	0	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	GLRA1	46	36
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccccc3)CC1)C2	ZINC000450621376	FF	On-Demand	Anodyne	CYP2J2	69	49
CN1CCC[C@H](C(=O)N2CC=C(c3cccc(Br)c3)CC2)C1=O	ZINC000450621378	GF	On-Demand	Anodyne	ADAM10	32	40
CN1CCC[C@@H](C(=O)N2CC=C(c3cccc(Br)c3)CC2)C1=O	ZINC000450621379	GF	On-Demand	Anodyne	ADAM10	32	40
CSc1ccc2ncnc(N[C@@H]3CCCN(CCCO)C3)c2c1	ZINC000450621384	EF	On-Demand	Anodyne	CD38	46	36
CSc1ccc2ncnc(N[C@@H]3CCCN(CCCO)C3)c2c1	ZINC000450621384	EF	On-Demand	Anodyne	EHMT2	49	31
CSc1ccc2ncnc(N[C@H]3CCCN(CCCO)C3)c2c1	ZINC000450621385	EF	On-Demand	Anodyne	CD38	46	36
CSc1ccc2ncnc(N[C@H]3CCCN(CCCO)C3)c2c1	ZINC000450621385	EF	On-Demand	Anodyne	EHMT2	49	31
CCOc1nc2ccc(C(=O)N3CCn4c(O)nnc4C3)cc2[nH]1	ZINC000450621396	EC	On-Demand	Anodyne	P2RX7	22	41
CCn1nnc(C)c1COc1cccc([N+](=O)[O-])c1	ZINC000450621402	CE	On-Demand	Bother	ACR	20	47
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	HTR1A	32	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	DRD2	20	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	ADRA1D	18	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	ADRA1A	17	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	ADRA1B	15	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	PDGFRB	19	44
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	ACACA	36	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	ACACB	28	42
COc1ccccc1-n1cnc2cc(C(=O)N3CCC(C)(CO)CC3)ccc21	ZINC000450621407	GG	On-Demand	Anodyne	HPGD	64	74
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCCC(=O)C2CC2)cc1	ZINC000450621418	EG	On-Demand	Anodyne	HDA106	0	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCCC(=O)C2CC2)cc1	ZINC000450621419	EG	On-Demand	Anodyne	HDA106	0	41
CC(C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccccn1	ZINC000450621420	FG	On-Demand	Bother	MAPK13	49	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450621435	EF	On-Demand	Anodyne	CCR3	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450621435	EF	On-Demand	Anodyne	GUAB	0	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450621436	EF	On-Demand	Anodyne	CCR3	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450621436	EF	On-Demand	Anodyne	GUAB	0	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450621437	EF	On-Demand	Anodyne	CCR3	0	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450621437	EF	On-Demand	Anodyne	GUAB	0	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450621438	EF	On-Demand	Anodyne	CCR3	0	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450621438	EF	On-Demand	Anodyne	GUAB	0	41
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450621446	FE	On-Demand	Anodyne	GNAI1	0	41
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450621446	FE	On-Demand	Anodyne	GNAI3	0	41
O=C(NCCCN1CCCCC1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450621446	FE	On-Demand	Anodyne	GNAO1	0	41
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450621447	FE	On-Demand	Anodyne	GNAI1	0	41
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450621447	FE	On-Demand	Anodyne	GNAI3	0	41
O=C(NCCCN1CCCCC1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450621447	FE	On-Demand	Anodyne	GNAO1	0	41
CC(=O)CCCCCSc1nnc(-c2ccco2)n1C	ZINC000450621448	CG	On-Demand	Anodyne	DRD3	56	34
Cc1cccc(-c2noc(SCC(=O)N[C@@H]3CN(C)NC3=O)n2)c1	ZINC000450621455	EC	On-Demand	Anodyne	GRM5	23	44
Cc1cccc(-c2noc(SCC(=O)N[C@H]3CN(C)NC3=O)n2)c1	ZINC000450621456	EC	On-Demand	Anodyne	GRM5	23	44
N#Cc1ccc(OCC(=O)N2CCn3c(O)nnc3C2)cc1Br	ZINC000450621457	GD	On-Demand	Mild	HTR1B	16	40
COc1cc(OC)cc(-c2nnc(SCc3cn(CC4CC4)nn3)o2)c1	ZINC000450621458	FG	On-Demand	Anodyne	GSK3A	27	41
Cc1ccccc1-c1nnc(SC2CC(OC(C)(C)C)C2)o1	ZINC000450621474	DI	On-Demand	Anodyne	CYP73A16	25	45
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H]2CCCCC2(F)F)cc1	ZINC000450621475	EH	On-Demand	Anodyne	TIMP3	67	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H]2CCCCC2(F)F)cc1	ZINC000450621476	EH	On-Demand	Anodyne	TIMP3	67	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H]2CCCCC2(F)F)cc1	ZINC000450621477	EH	On-Demand	Anodyne	TIMP3	67	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CCCCC2(F)F)cc1	ZINC000450621478	EH	On-Demand	Anodyne	TIMP3	67	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ccccc1	ZINC000450621504	CI	On-Demand	Anodyne	COLA	123	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ccccc1	ZINC000450621504	CI	On-Demand	Anodyne	CPT1A	116	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ccccc1	ZINC000450621504	CI	On-Demand	Anodyne	CPT2	44	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ccccc1	ZINC000450621504	CI	On-Demand	Anodyne	PREP	79	39
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ccccc1	ZINC000450621505	CI	On-Demand	Anodyne	COLA	123	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ccccc1	ZINC000450621505	CI	On-Demand	Anodyne	CPT1A	107	42
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ccccc1	ZINC000450621505	CI	On-Demand	Anodyne	CPT2	44	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ccccc1	ZINC000450621505	CI	On-Demand	Anodyne	PREP	61	39
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ccccc1	ZINC000450621506	CI	On-Demand	Anodyne	COLA	123	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ccccc1	ZINC000450621506	CI	On-Demand	Anodyne	CPT1A	116	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ccccc1	ZINC000450621506	CI	On-Demand	Anodyne	CPT2	44	34
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ccccc1	ZINC000450621506	CI	On-Demand	Anodyne	PREP	79	39
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ccccc1	ZINC000450621507	CI	On-Demand	Anodyne	COLA	123	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ccccc1	ZINC000450621507	CI	On-Demand	Anodyne	CPT1A	116	42
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ccccc1	ZINC000450621507	CI	On-Demand	Anodyne	CPT2	44	34
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ccccc1	ZINC000450621507	CI	On-Demand	Anodyne	PREP	79	39
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621508	FH	On-Demand	Anodyne	DRD2	26	41
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621508	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621508	FH	On-Demand	Anodyne	ADRA1B	15	42
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621508	FH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621509	FH	On-Demand	Anodyne	DRD2	26	41
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621509	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621509	FH	On-Demand	Anodyne	ADRA1B	15	42
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621509	FH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621510	FH	On-Demand	Anodyne	DRD2	26	41
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621510	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621510	FH	On-Demand	Anodyne	ADRA1B	15	42
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621510	FH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621511	FH	On-Demand	Anodyne	DRD2	26	41
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621511	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621511	FH	On-Demand	Anodyne	ADRA1B	15	42
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000450621511	FH	On-Demand	Anodyne	ERG2	19	41
CC(=O)c1cn(CC(=O)N2CCCC[C@H]2c2ccccc2)nn1	ZINC000450621515	DE	On-Demand	Anodyne	CPT1A	103	41
CC(=O)c1cn(CC(=O)N2CCCC[C@H]2c2ccccc2)nn1	ZINC000450621515	DE	On-Demand	Anodyne	ABHD6	0	46
CC(=O)c1cn(CC(=O)N2CCCC[C@@H]2c2ccccc2)nn1	ZINC000450621516	DE	On-Demand	Anodyne	CPT1A	103	41
CC(=O)c1cn(CC(=O)N2CCCC[C@@H]2c2ccccc2)nn1	ZINC000450621516	DE	On-Demand	Anodyne	ABHD6	0	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	F2	33	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	ACE	92	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	FKBP1A	67	38
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	OPRM1	28	49
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	OPRD1	17	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	SLC6A3	16	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	MME	55	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	TACR1	15	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	AGTR2	47	35
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	CTRA_BOVIN	49	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	TRY1_BOVIN	44	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	ADAM17	48	47
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	COLA	106	39
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	CPT1A	99	36
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	DPP4	16	45
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	PREP	69	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	MMP14	0	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621517	DH	On-Demand	Anodyne	BRCA1	53	33
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	F2	33	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	ACE	92	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	FKBP1A	67	38
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	OPRM1	28	49
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	OPRD1	17	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	SLC6A3	16	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	MME	55	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	TACR1	15	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	AGTR2	47	35
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	CTRA_BOVIN	49	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	TRY1_BOVIN	44	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	ADAM17	48	47
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	COLA	106	39
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	CPT1A	99	36
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	DPP4	16	45
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	PREP	69	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	MMP14	0	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621518	DH	On-Demand	Anodyne	BRCA1	53	33
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621519	DH	On-Demand	Anodyne	AGTR2	47	35
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621519	DH	On-Demand	Anodyne	CTRA_BOVIN	49	31
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621519	DH	On-Demand	Anodyne	ADAM17	48	47
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621519	DH	On-Demand	Anodyne	COLA	106	39
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450621519	DH	On-Demand	Anodyne	MMP14	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621520	DH	On-Demand	Anodyne	AGTR2	47	35
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621520	DH	On-Demand	Anodyne	CTRA_BOVIN	49	31
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621520	DH	On-Demand	Anodyne	ADAM17	48	47
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621520	DH	On-Demand	Anodyne	COLA	106	39
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450621520	DH	On-Demand	Anodyne	MMP14	0	40
O=C(CC[C@@H]1CCCCO1)COc1ccccc1C(=O)Nc1ccccc1	ZINC000450621521	FI	On-Demand	Anodyne	HCN1	47	33
O=C(CC[C@@H]1CCCCO1)COc1ccccc1C(=O)Nc1ccccc1	ZINC000450621521	FI	On-Demand	Anodyne	HCN4	41	33
O=C(CC[C@@H]1CCCCO1)COc1ccccc1C(=O)Nc1ccccc1	ZINC000450621521	FI	On-Demand	Anodyne	KCNK3	65	40
O=C(CC[C@@H]1CCCCO1)COc1ccccc1C(=O)Nc1ccccc1	ZINC000450621521	FI	On-Demand	Anodyne	KCNK9	54	40
O=C(CC[C@H]1CCCCO1)COc1ccccc1C(=O)Nc1ccccc1	ZINC000450621522	FI	On-Demand	Anodyne	HCN1	47	33
O=C(CC[C@H]1CCCCO1)COc1ccccc1C(=O)Nc1ccccc1	ZINC000450621522	FI	On-Demand	Anodyne	HCN4	41	33
O=C(CC[C@H]1CCCCO1)COc1ccccc1C(=O)Nc1ccccc1	ZINC000450621522	FI	On-Demand	Anodyne	KCNK3	65	40
O=C(CC[C@H]1CCCCO1)COc1ccccc1C(=O)Nc1ccccc1	ZINC000450621522	FI	On-Demand	Anodyne	KCNK9	54	40
CCC1(CNC(=O)Cc2ccc(O)c(OC)c2)CCCCC1	ZINC000450621528	DG	On-Demand	Anodyne	TRPV1	17	48
CCC1(CNC(=O)Cc2ccc(O)c(OC)c2)CCCCC1	ZINC000450621528	DG	On-Demand	Anodyne	SHBG	18	40
CCC1(CNC(=O)Cc2ccc(O)c(OC)c2)CCCCC1	ZINC000450621528	DG	On-Demand	Anodyne	NCE103	39	46
CCC1(CNC(=O)Cc2ccc(O)c(OC)c2)CCCCC1	ZINC000450621528	DG	On-Demand	Anodyne	P96878_MYCTU	24	46
CCC1(CNC(=O)Cc2ccc(O)c(OC)c2)CCCCC1	ZINC000450621528	DG	On-Demand	Anodyne	HCN1	52	35
CCC1(CNC(=O)Cc2ccc(O)c(OC)c2)CCCCC1	ZINC000450621528	DG	On-Demand	Anodyne	HCN4	49	35
CCC1(CNC(=O)Cc2ccc(O)c(OC)c2)CCCCC1	ZINC000450621528	DG	On-Demand	Anodyne	CAN2	0	46
COC(=O)c1csc(CN2CCNC(=O)[C@@H]2c2ccc(C(F)(F)F)cc2)n1	ZINC000450621535	GF	On-Demand	Anodyne	TRPM8	42	38
COC(=O)c1csc(CN2CCNC(=O)[C@H]2c2ccc(C(F)(F)F)cc2)n1	ZINC000450621536	GF	On-Demand	Anodyne	TRPM8	42	38
CN(CCCC(=O)c1ccc(F)cc1)[C@@H]1CCNC1=O	ZINC000450621539	CD	On-Demand	Anodyne	DRD4	15	40
CN(CCCC(=O)c1ccc(F)cc1)[C@H]1CCNC1=O	ZINC000450621540	CD	On-Demand	Anodyne	DRD4	15	40
FC(F)(F)c1cccc(OC[C@H]2COCCO2)c1	ZINC000450621549	CE	On-Demand	Anodyne	CHRNA10	27	52
FC(F)(F)c1cccc(OC[C@@H]2COCCO2)c1	ZINC000450621550	CE	On-Demand	Anodyne	CHRNA10	27	52
CC(C)c1n[nH]c(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)n1	ZINC000450621551	FE	On-Demand	Anodyne	LRRK2	30	40
CCOC(=O)c1c(NCc2nc(C(C)C)n[nH]2)nc2ccccc2c1C	ZINC000450621563	FF	On-Demand	Anodyne	GABRA1	21	42
c1ccc(COc2ccc(OCc3nnc(C4CC4)s3)cc2)cc1	ZINC000450621564	EJ	On-Demand	Anodyne	MAOB	17	42
c1ccc(COc2ccc(OCc3nnc(C4CC4)s3)cc2)cc1	ZINC000450621564	EJ	On-Demand	Anodyne	LTA4H	23	40
Cc1ccc2nc(SCc3cn(C)nc3C)[nH]c2c1	ZINC000450621565	CG	On-Demand	Anodyne	CYP2C8	28	41
Cc1ccc2nc(SCc3cn(C)nc3C)[nH]c2c1	ZINC000450621565	CG	On-Demand	Anodyne	CYP2C19	36	43
CCC(=O)CCCN1CCc2c([nH]c3ccccc23)C1	ZINC000450621567	CG	On-Demand	Anodyne	DRD5	22	52
CCC(=O)CCCN1CCc2c([nH]c3ccccc23)C1	ZINC000450621567	CG	On-Demand	Anodyne	SSTR4	47	34
CCC(=O)CCCN1CCc2c([nH]c3ccccc23)C1	ZINC000450621567	CG	On-Demand	Anodyne	HTR5A	46	74
Cc1cccc(Cl)c1CN1CCN(Cc2ccncc2)CC1	ZINC000450621572	DG	On-Demand	Anodyne	DRD4	22	47
Cc1cccc(Cl)c1CN1CCN(Cc2ccncc2)CC1	ZINC000450621572	DG	On-Demand	Anodyne	SIGMAR1	17	42
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2nc(C(C)C)n[nH]2)c([N+](=O)[O-])c1	ZINC000450621617	GD	On-Demand	Bother	DRTS_TOXGO	17	43
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2nc(C(C)C)n[nH]2)c([N+](=O)[O-])c1	ZINC000450621617	GD	On-Demand	Bother	TAAR1	16	43
COC(=O)CNC(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450621622	ED	On-Demand	Bother	TAAR1	16	40
CC[C@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450621635	EH	On-Demand	Anodyne	CTSV	48	33
CC[C@@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450621636	EH	On-Demand	Anodyne	CTSV	48	33
CCOC(=O)c1ccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)nc1	ZINC000450621652	GH	On-Demand	Anodyne	PTAFR	20	43
CCOC(=O)c1ccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)nc1	ZINC000450621653	GH	On-Demand	Anodyne	PTAFR	20	43
COc1ccc(CNC(=O)CCN2CC[C@@H](C3CCOCC3)C2)c(OC)c1	ZINC000450621654	GE	On-Demand	Anodyne	MTNR1A	45	35
COc1ccc(CNC(=O)CCN2CC[C@H](C3CCOCC3)C2)c(OC)c1	ZINC000450621655	GE	On-Demand	Anodyne	MTNR1A	45	35
CN1CC[C@@](O)(CNC(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000450621665	FE	On-Demand	Anodyne	SLC6A9	47	34
CN1CC[C@](O)(CNC(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000450621667	FE	On-Demand	Anodyne	SLC6A9	47	34
CC(=O)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C(C)(C)C1	ZINC000450621668	FG	On-Demand	Anodyne	PRCP	49	36
CC(=O)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C(C)(C)C1	ZINC000450621669	FG	On-Demand	Anodyne	PRCP	49	36
CC(=O)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C(C)(C)C1	ZINC000450621670	FG	On-Demand	Anodyne	PRCP	49	36
CC(=O)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C(C)(C)C1	ZINC000450621671	FG	On-Demand	Anodyne	PRCP	49	36
C[C@@H]1CCC(=O)[C@H](Oc2cccc([N+](=O)[O-])c2)C1	ZINC000450621673	BF	On-Demand	Bother	ATSA	0	44
C[C@@H]1CCC(=O)[C@@H](Oc2cccc([N+](=O)[O-])c2)C1	ZINC000450621675	BF	On-Demand	Bother	ATSA	0	44
C[C@H]1CCC(=O)[C@H](Oc2cccc([N+](=O)[O-])c2)C1	ZINC000450621676	BF	On-Demand	Bother	ATSA	0	44
C[C@H]1CCC(=O)[C@@H](Oc2cccc([N+](=O)[O-])c2)C1	ZINC000450621677	BF	On-Demand	Bother	ATSA	0	44
O=C(CN1CCN(C[C@@H]2CCCCC2(F)F)CC1)Nc1ccc(Cl)cc1	ZINC000450621681	GH	On-Demand	Anodyne	MCHR1	26	41
O=C(CN1CCN(C[C@H]2CCCCC2(F)F)CC1)Nc1ccc(Cl)cc1	ZINC000450621686	GH	On-Demand	Anodyne	MCHR1	26	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cc3Cl)CC2)cc1	ZINC000450621719	GH	On-Demand	Anodyne	HTR1A	18	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cc3Cl)CC2)cc1	ZINC000450621719	GH	On-Demand	Anodyne	DRD2	27	43
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cc3Cl)CC2)cc1	ZINC000450621719	GH	On-Demand	Anodyne	DRD1	0	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cc3Cl)CC2)cc1	ZINC000450621719	GH	On-Demand	Anodyne	DRD4	41	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cc3Cl)CC2)cc1	ZINC000450621719	GH	On-Demand	Anodyne	DRD3	19	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cc3Cl)CC2)cc1	ZINC000450621719	GH	On-Demand	Anodyne	ADORA2B	41	38
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cc3Cl)CC2)cc1	ZINC000450621719	GH	On-Demand	Anodyne	HSD11B1	15	46
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cc3Cl)CC2)cc1	ZINC000450621719	GH	On-Demand	Anodyne	CASP7	15	40
COC(=O)c1cn([C@H]2CCCN(C(=O)c3cc(-c4ccccc4)nn3C)C2)nn1	ZINC000450621732	GD	On-Demand	Anodyne	PREP	26	40
COC(=O)c1cn([C@@H]2CCCN(C(=O)c3cc(-c4ccccc4)nn3C)C2)nn1	ZINC000450621733	GD	On-Demand	Anodyne	PREP	26	40
C[C@H](c1ccc(CN2CCC(OCCO)CC2)cc1)C(F)(F)F	ZINC000450621738	EG	On-Demand	Anodyne	SIGMAR1	34	48
C[C@@H](c1ccc(CN2CCC(OCCO)CC2)cc1)C(F)(F)F	ZINC000450621739	EG	On-Demand	Anodyne	SIGMAR1	34	48
Cc1ccc(C(=O)Nc2cccc(CCN(C)C3CC3)c2)c(C(C)C)n1	ZINC000450621756	FI	On-Demand	Anodyne	HTR1D	29	41
Cc1ccc(C(=O)Nc2cccc(CCN(C)C3CC3)c2)c(C(C)C)n1	ZINC000450621756	FI	On-Demand	Anodyne	HTR1B	22	41
Cc1ccc(C(=O)Nc2cccc(CCN(C)C3CC3)c2)c(C(C)C)n1	ZINC000450621756	FI	On-Demand	Anodyne	KCNK3	52	33
Cc1ccc(C(=O)Nc2cccc(CCN(C)C3CC3)c2)c(C(C)C)n1	ZINC000450621756	FI	On-Demand	Anodyne	KCNK9	47	33
CN1CC[C@@](O)(CNC(=O)c2ccc(I)cc2F)C1	ZINC000450621762	GD	On-Demand	Anodyne	SLC6A9	41	34
CN1CC[C@@](O)(CNC(=O)c2ccc(I)cc2F)C1	ZINC000450621762	GD	On-Demand	Anodyne	HCN1	40	35
CN1CC[C@](O)(CNC(=O)c2ccc(I)cc2F)C1	ZINC000450621763	GD	On-Demand	Anodyne	SLC6A9	41	34
CN1CC[C@](O)(CNC(=O)c2ccc(I)cc2F)C1	ZINC000450621763	GD	On-Demand	Anodyne	HCN1	40	35
COc1cc(CC(=O)NC[C@@]2(O)CCN(C)C2)ccc1Cl	ZINC000450621770	DD	On-Demand	Anodyne	NCE103	25	44
COc1cc(CC(=O)NC[C@]2(O)CCN(C)C2)ccc1Cl	ZINC000450621771	DD	On-Demand	Anodyne	NCE103	25	44
C[C@@H]1Cc2cccc(C(=O)NC[C@]3(O)CCN(C)C3)c2O1	ZINC000450621775	CC	On-Demand	Anodyne	HCN1	57	35
C[C@@H]1Cc2cccc(C(=O)NC[C@]3(O)CCN(C)C3)c2O1	ZINC000450621775	CC	On-Demand	Anodyne	HCN4	54	35
C[C@@H]1Cc2cccc(C(=O)NC[C@@]3(O)CCN(C)C3)c2O1	ZINC000450621776	CC	On-Demand	Anodyne	HCN1	57	35
C[C@@H]1Cc2cccc(C(=O)NC[C@@]3(O)CCN(C)C3)c2O1	ZINC000450621776	CC	On-Demand	Anodyne	HCN4	54	35
C[C@H]1Cc2cccc(C(=O)NC[C@]3(O)CCN(C)C3)c2O1	ZINC000450621777	CC	On-Demand	Anodyne	HCN1	57	35
C[C@H]1Cc2cccc(C(=O)NC[C@]3(O)CCN(C)C3)c2O1	ZINC000450621777	CC	On-Demand	Anodyne	HCN4	54	35
C[C@H]1Cc2cccc(C(=O)NC[C@@]3(O)CCN(C)C3)c2O1	ZINC000450621778	CC	On-Demand	Anodyne	HCN1	57	35
C[C@H]1Cc2cccc(C(=O)NC[C@@]3(O)CCN(C)C3)c2O1	ZINC000450621778	CC	On-Demand	Anodyne	HCN4	54	35
COCCOC[C@@H](O)CN1CC=C(C(C)(C)C)CC1	ZINC000450621790	CD	On-Demand	Anodyne	HSP90AB1	38	44
CC[C@H](CC(C)C)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450621791	BC	On-Demand	Anodyne	MMP1	23	42
CC[C@@H](CC(C)C)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450621792	BC	On-Demand	Anodyne	MMP1	23	42
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450621793	BC	On-Demand	Anodyne	MMP1	23	42
CC[C@H](CC(C)C)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450621794	BC	On-Demand	Anodyne	MMP1	23	42
COc1cc(OC)cc(-c2nnc(SCC[C@H]3CCOC3)o2)c1	ZINC000450621807	EG	On-Demand	Anodyne	GSK3A	18	42
COc1cc(OC)cc(-c2nnc(SCC[C@@H]3CCOC3)o2)c1	ZINC000450621808	EG	On-Demand	Anodyne	GSK3A	18	42
O=[N+]([O-])c1ccc(N[C@H]2CCCN(CCCO)C2)nc1OCc1ccccc1	ZINC000450621809	GE	On-Demand	Bother	SLC6A1	51	34
O=[N+]([O-])c1ccc(N[C@@H]2CCCN(CCCO)C2)nc1OCc1ccccc1	ZINC000450621810	GE	On-Demand	Bother	SLC6A1	51	34
COC[C@]1(C)CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C1	ZINC000450621821	FI	On-Demand	Anodyne	SMO	22	52
COC[C@@]1(C)CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C1	ZINC000450621822	FI	On-Demand	Anodyne	SMO	22	52
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@]2(C#N)C[C@@H]2C)cc1	ZINC000450621841	DF	On-Demand	Mild	TIMP3	51	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@]2(C#N)C[C@@H]2C)cc1	ZINC000450621842	DF	On-Demand	Mild	TIMP3	51	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@]2(C#N)C[C@H]2C)cc1	ZINC000450621843	DF	On-Demand	Mild	TIMP3	51	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@]2(C#N)C[C@H]2C)cc1	ZINC000450621844	DF	On-Demand	Mild	TIMP3	51	34
OCCCN1CCC[C@@H](Nc2nc(C(F)F)nc3ccccc23)C1	ZINC000450621854	EE	On-Demand	Anodyne	HNMT	66	34
OCCCN1CCC[C@@H](Nc2nc(C(F)F)nc3ccccc23)C1	ZINC000450621854	EE	On-Demand	Anodyne	EHMT2	47	35
OCCCN1CCC[C@H](Nc2nc(C(F)F)nc3ccccc23)C1	ZINC000450621855	EE	On-Demand	Anodyne	HNMT	66	34
OCCCN1CCC[C@H](Nc2nc(C(F)F)nc3ccccc23)C1	ZINC000450621855	EE	On-Demand	Anodyne	EHMT2	47	35
O=C(NCCCN1CCCCC1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450621856	FF	On-Demand	Anodyne	GNAI1	0	44
O=C(NCCCN1CCCCC1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450621856	FF	On-Demand	Anodyne	GNAI3	0	44
O=C(NCCCN1CCCCC1)C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450621856	FF	On-Demand	Anodyne	GNAO1	0	44
CN1C[C@@H](NC(=O)[C@@H](C#N)CCc2ccccc2)C(=O)N1	ZINC000450621857	CC	On-Demand	Mild	ACE	57	36
CN1C[C@@H](NC(=O)[C@@H](C#N)CCc2ccccc2)C(=O)N1	ZINC000450621857	CC	On-Demand	Mild	CTSC	46	42
CN1C[C@H](NC(=O)[C@@H](C#N)CCc2ccccc2)C(=O)N1	ZINC000450621858	CC	On-Demand	Mild	ACE	57	36
CN1C[C@H](NC(=O)[C@@H](C#N)CCc2ccccc2)C(=O)N1	ZINC000450621858	CC	On-Demand	Mild	CTSC	46	42
CN1C[C@@H](NC(=O)[C@H](C#N)CCc2ccccc2)C(=O)N1	ZINC000450621859	CC	On-Demand	Mild	ACE	57	36
CN1C[C@@H](NC(=O)[C@H](C#N)CCc2ccccc2)C(=O)N1	ZINC000450621859	CC	On-Demand	Mild	CTSC	46	42
CN1C[C@H](NC(=O)[C@H](C#N)CCc2ccccc2)C(=O)N1	ZINC000450621860	CC	On-Demand	Mild	ACE	57	36
CN1C[C@H](NC(=O)[C@H](C#N)CCc2ccccc2)C(=O)N1	ZINC000450621860	CC	On-Demand	Mild	CTSC	46	42
CC(C)(CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)c1ccccn1	ZINC000450621870	FG	On-Demand	Anodyne	NAMPT	26	41
Cn1cc(-c2ccc(C(=O)NCc3nc4ccccc4n3C3CC3)o2)cn1	ZINC000450621871	FG	On-Demand	Anodyne	MMP13	0	42
O=[N+]([O-])c1ccc(N[C@@H]2CCCN(CCCO)C2)cc1C(F)(F)F	ZINC000450621880	EF	On-Demand	Bother	AADAC	0	42
O=[N+]([O-])c1ccc(N[C@H]2CCCN(CCCO)C2)cc1C(F)(F)F	ZINC000450621881	EF	On-Demand	Bother	AADAC	0	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)CC[C@H]2CCC(=O)N2)cc1	ZINC000450621884	EE	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@H](C)Cc1ccc(NC(=O)CC[C@@H]2CCC(=O)N2)cc1	ZINC000450621885	EE	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CC[C@@H]2CCC(=O)N2)cc1	ZINC000450621886	EE	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CC[C@H]2CCC(=O)N2)cc1	ZINC000450621887	EE	On-Demand	Anodyne	TIMP3	40	31
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2nc(C(C)C)n[nH]2)c([N+](=O)[O-])c1	ZINC000450621891	GD	On-Demand	Bother	DRTS_TOXGO	17	43
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2nc(C(C)C)n[nH]2)c([N+](=O)[O-])c1	ZINC000450621891	GD	On-Demand	Bother	TAAR1	16	43
CCOC(=O)c1cc(NCc2nc(C(C)C)n[nH]2)ncc1Cl	ZINC000450621896	DF	On-Demand	Anodyne	CACNA1C	43	35
CC(C)c1n[nH]c(CNc2nc3ccccc3nc2N2CCN(C)CC2)n1	ZINC000450621898	FE	On-Demand	Anodyne	HTR3A	26	44
CC(C)c1n[nH]c(CNc2nc3ccccc3nc2N2CCN(C)CC2)n1	ZINC000450621898	FE	On-Demand	Anodyne	HRH4	28	44
CC(=O)N1CCN(C(=O)[C@H](C)OCCc2ccccc2)C(C)(C)C1	ZINC000450621912	EE	On-Demand	Anodyne	SLC12A5	45	35
CC(=O)N1CCN(C(=O)[C@@H](C)OCCc2ccccc2)C(C)(C)C1	ZINC000450621913	EE	On-Demand	Anodyne	SLC12A5	45	35
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	DRD4	15	47
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	FABI	57	36
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	DRD5	22	47
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	SSTR4	54	37
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	SSTR5	43	37
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	HTR5A	21	56
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	HDAC6	19	43
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	MCHR2	40	37
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	NOD1	31	40
CC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450621916	DH	On-Demand	Anodyne	NOD2	47	40
N#CC1(COc2ccc(F)c(Cl)c2)CCC1	ZINC000450621922	BH	On-Demand	Mild	TRPV4	47	38
CCC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450621923	EG	On-Demand	Anodyne	HCN1	52	32
CCC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450621923	EG	On-Demand	Anodyne	HCN4	50	32
CCc1nc(C)c(COc2cccc(C(F)(F)F)c2)o1	ZINC000450621925	CI	On-Demand	Anodyne	PDS	41	36
Cc1ccnc(-c2noc(CN3CCc4c([nH]c5ccccc45)C3)n2)c1	ZINC000450621928	EG	On-Demand	Anodyne	DRD5	17	40
CCC1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450621933	CG	On-Demand	Mild	HCN1	52	32
CCC1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450621933	CG	On-Demand	Mild	HCN4	50	32
Cc1ccc(NC(=O)c2ccc(NCc3nc(C(C)C)n[nH]3)nc2)cc1	ZINC000450621938	FG	On-Demand	Anodyne	PRNP	43	31
Cc1ccc(NC(=O)c2ccc(NCc3nc(C(C)C)n[nH]3)nc2)cc1	ZINC000450621938	FG	On-Demand	Anodyne	P4HTM	0	46
CC(=O)N1CCN(C(=O)c2ccc(C)c(Cl)c2Cl)C(C)(C)C1	ZINC000450621943	EG	On-Demand	Anodyne	P2RX7	0	42
CCC1(CNC(=O)c2ccsn2)CCCCC1	ZINC000450621955	CG	On-Demand	Anodyne	HCN1	56	35
CCC1(CNC(=O)c2ccsn2)CCCCC1	ZINC000450621955	CG	On-Demand	Anodyne	HCN4	54	35
O=C(CCC(=O)N1CCCC[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621959	FI	On-Demand	Bother	CACNA1C	61	36
O=C(CCC(=O)N1CCCC[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621959	FI	On-Demand	Bother	CACNA1D	87	36
O=C(CCC(=O)N1CCCC[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621959	FI	On-Demand	Bother	COLA	127	51
O=C(CCC(=O)N1CCCC[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621959	FI	On-Demand	Bother	CPT1A	119	51
O=C(CCC(=O)N1CCCC[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621959	FI	On-Demand	Bother	PREP	40	46
O=C(CCC(=O)N1CCCC[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621959	FI	On-Demand	Bother	ABHD6	0	40
O=C(CCC(=O)N1CCCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621960	FI	On-Demand	Bother	CACNA1C	61	36
O=C(CCC(=O)N1CCCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621960	FI	On-Demand	Bother	CACNA1D	87	36
O=C(CCC(=O)N1CCCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621960	FI	On-Demand	Bother	COLA	127	51
O=C(CCC(=O)N1CCCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621960	FI	On-Demand	Bother	CPT1A	119	51
O=C(CCC(=O)N1CCCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621960	FI	On-Demand	Bother	PREP	40	46
O=C(CCC(=O)N1CCCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450621960	FI	On-Demand	Bother	ABHD6	0	40
CC(=O)c1ccc(CN2CCNC(=O)[C@H]2c2ccc(C(F)(F)F)cc2)cc1	ZINC000450621966	GH	On-Demand	Anodyne	TRPM8	44	38
CC(=O)c1ccc(CN2CCNC(=O)[C@@H]2c2ccc(C(F)(F)F)cc2)cc1	ZINC000450621967	GH	On-Demand	Anodyne	TRPM8	44	38
c1ccc(CCn2ccc(CN3CCN(Cc4ccncc4)CC3)n2)cc1	ZINC000450621977	FF	On-Demand	Anodyne	DRD2	0	41
c1ccc(CCn2ccc(CN3CCN(Cc4ccncc4)CC3)n2)cc1	ZINC000450621977	FF	On-Demand	Anodyne	DRD3	0	43
c1ccc(CCn2ccc(CN3CCN(Cc4ccncc4)CC3)n2)cc1	ZINC000450621977	FF	On-Demand	Anodyne	SIGMAR1	50	47
Cc1cccc(Cl)c1C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1	ZINC000450621990	FJ	On-Demand	Anodyne	CCR1	21	44
C/C=C\COc1cccc(CC(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1	ZINC000450622000	FE	On-Demand	Anodyne	HRH2	22	43
C/C=C\COc1cccc(CC(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1	ZINC000450622000	FE	On-Demand	Anodyne	C3AR1	41	35
C/C=C\COc1cccc(CC(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1	ZINC000450622001	FE	On-Demand	Anodyne	HRH2	22	43
C/C=C\COc1cccc(CC(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1	ZINC000450622001	FE	On-Demand	Anodyne	C3AR1	41	35
Cc1cc(CNc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])ccn1	ZINC000450622011	GD	On-Demand	Bother	BDKRB1	0	46
Cc1cc(CNc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])ccn1	ZINC000450622011	GD	On-Demand	Bother	CHUK	16	42
Cc1ccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c(Cl)c1Cl	ZINC000450622018	FF	On-Demand	Anodyne	EPHX2	31	40
Cc1ccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c(Cl)c1Cl	ZINC000450622019	FF	On-Demand	Anodyne	EPHX2	31	40
O=[N+]([O-])c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450622022	BE	On-Demand	Bother	TRAR	28	48
O=[N+]([O-])c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450622023	BE	On-Demand	Bother	TRAR	28	48
COCCOC[C@H](O)CN1CC=C(C(C)(C)C)CC1	ZINC000450622027	CD	On-Demand	Anodyne	HSP90AB1	38	44
CO[C@H](COc1ccccc1C(C)=O)Cc1ccccc1	ZINC000450622040	CH	On-Demand	Anodyne	ABCB1	53	48
CO[C@H](COc1ccccc1C(C)=O)Cc1ccccc1	ZINC000450622040	CH	On-Demand	Anodyne	KCNK3	40	35
CO[C@H](COc1ccccc1C(C)=O)Cc1ccccc1	ZINC000450622040	CH	On-Demand	Anodyne	PDS	48	38
CO[C@@H](COc1ccccc1C(C)=O)Cc1ccccc1	ZINC000450622041	CH	On-Demand	Anodyne	ABCB1	53	48
CO[C@@H](COc1ccccc1C(C)=O)Cc1ccccc1	ZINC000450622041	CH	On-Demand	Anodyne	KCNK3	40	35
CO[C@@H](COc1ccccc1C(C)=O)Cc1ccccc1	ZINC000450622041	CH	On-Demand	Anodyne	PDS	48	38
Ic1ccc2ncnc(NCC3=CCOCC3)c2c1	ZINC000450622043	FE	On-Demand	Anodyne	CLK4	72	41
Ic1ccc2ncnc(NCC3=CCOCC3)c2c1	ZINC000450622043	FE	On-Demand	Anodyne	CD38	60	36
CN1CC[C@@](O)(CNC(=O)c2ccsc2Br)C1	ZINC000450622046	DD	On-Demand	Anodyne	HCN1	50	30
CN1CC[C@@](O)(CNC(=O)c2ccsc2Br)C1	ZINC000450622046	DD	On-Demand	Anodyne	HCN4	47	30
CN1CC[C@](O)(CNC(=O)c2ccsc2Br)C1	ZINC000450622050	DD	On-Demand	Anodyne	HCN1	50	30
CN1CC[C@](O)(CNC(=O)c2ccsc2Br)C1	ZINC000450622050	DD	On-Demand	Anodyne	HCN4	47	30
Cn1cc(-c2ccc(C(=O)N3CC[C@@H](NC(=O)NC4CC4)C3)o2)cn1	ZINC000450622070	ED	On-Demand	Anodyne	MAP3K7	46	33
Cn1cc(-c2ccc(C(=O)N3CC[C@H](NC(=O)NC4CC4)C3)o2)cn1	ZINC000450622071	ED	On-Demand	Anodyne	MAP3K7	46	33
CC(C)NC(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450622076	DE	On-Demand	Bother	TAAR1	16	40
CCc1cc(CCCN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)on1	ZINC000450622077	GH	On-Demand	Anodyne	PLA2G2A	30	46
CCc1cc(CCCN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)on1	ZINC000450622077	GH	On-Demand	Anodyne	POLC	58	38
CCc1cc(CCCN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)on1	ZINC000450622077	GH	On-Demand	Anodyne	PYGL	0	49
c1ccc2[nH]c(SCC[C@@H]3CCOC3)nc2c1	ZINC000450622081	BG	On-Demand	Anodyne	CYP2C19	22	44
c1ccc2[nH]c(SCC[C@@H]3CCOC3)nc2c1	ZINC000450622081	BG	On-Demand	Anodyne	TXN	17	42
c1ccc2[nH]c(SCC[C@H]3CCOC3)nc2c1	ZINC000450622082	BG	On-Demand	Anodyne	CYP2C19	22	44
c1ccc2[nH]c(SCC[C@H]3CCOC3)nc2c1	ZINC000450622082	BG	On-Demand	Anodyne	TXN	17	42
Cc1ccc(C(=O)N2CCN(c3cccc(C#N)n3)CC2)c(Cl)c1Cl	ZINC000450622093	GH	On-Demand	Mild	P2RX7	45	39
CC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1	ZINC000450622102	EF	On-Demand	Anodyne	DRD2	16	43
CC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1	ZINC000450622102	EF	On-Demand	Anodyne	ACHE	17	42
CC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1	ZINC000450622102	EF	On-Demand	Anodyne	SLC6A3	22	41
CC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1	ZINC000450622102	EF	On-Demand	Anodyne	CHRM3	21	43
CC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1	ZINC000450622102	EF	On-Demand	Anodyne	SIGMAR1	35	42
CC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1	ZINC000450622102	EF	On-Demand	Anodyne	TRY2_BOVIN	52	32
CC(=O)c1cccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c1	ZINC000450622102	EF	On-Demand	Anodyne	GLRA1	46	36
CCCCN(CCCO)C(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450622103	CD	On-Demand	Anodyne	PDF	51	37
CC[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450622107	DF	On-Demand	Anodyne	TRPV1	51	51
CC[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450622107	DF	On-Demand	Anodyne	NCE103	33	44
CC[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450622107	DF	On-Demand	Anodyne	CAN2	0	44
CC[C@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450622108	DF	On-Demand	Anodyne	TRPV1	51	51
CC[C@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450622108	DF	On-Demand	Anodyne	NCE103	33	44
CC[C@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450622108	DF	On-Demand	Anodyne	CAN2	0	44
CN1CC[C@](O)(CNC(=O)c2cccc(C#N)c2Br)C1	ZINC000450622113	ED	On-Demand	Mild	HCN1	52	32
CN1CC[C@](O)(CNC(=O)c2cccc(C#N)c2Br)C1	ZINC000450622113	ED	On-Demand	Mild	HCN4	50	32
CN1CC[C@@](O)(CNC(=O)c2cccc(C#N)c2Br)C1	ZINC000450622114	ED	On-Demand	Mild	HCN1	52	32
CN1CC[C@@](O)(CNC(=O)c2cccc(C#N)c2Br)C1	ZINC000450622114	ED	On-Demand	Mild	HCN4	50	32
O=C1c2ccccc2C(=O)N1CCOC1CCCCCC1	ZINC000450622115	CG	On-Demand	Anodyne	17HSDCL	0	42
O=C1c2ccccc2C(=O)N1CCOC1CCCCCC1	ZINC000450622115	CG	On-Demand	Anodyne	FBPC	0	42
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCC[C@H]2O)c(OC)c1	ZINC000450622116	FD	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCC[C@H]2O)c(OC)c1	ZINC000450622116	FD	On-Demand	Anodyne	MTR1B_CHICK	0	42
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCC[C@H]2O)c(OC)c1	ZINC000450622116	FD	On-Demand	Anodyne	MTNR1A	73	39
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCC[C@H]2O)c(OC)c1	ZINC000450622116	FD	On-Demand	Anodyne	MTNR1B	63	37
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCC[C@H]2O)c(OC)c1	ZINC000450622117	FD	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCC[C@H]2O)c(OC)c1	ZINC000450622117	FD	On-Demand	Anodyne	MTR1B_CHICK	0	42
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCC[C@H]2O)c(OC)c1	ZINC000450622117	FD	On-Demand	Anodyne	MTNR1A	73	39
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCC[C@H]2O)c(OC)c1	ZINC000450622117	FD	On-Demand	Anodyne	MTNR1B	63	37
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCC[C@@H]2O)c(OC)c1	ZINC000450622118	FD	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCC[C@@H]2O)c(OC)c1	ZINC000450622118	FD	On-Demand	Anodyne	MTR1B_CHICK	0	42
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCC[C@@H]2O)c(OC)c1	ZINC000450622118	FD	On-Demand	Anodyne	MTNR1A	73	39
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCC[C@@H]2O)c(OC)c1	ZINC000450622118	FD	On-Demand	Anodyne	MTNR1B	63	37
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCC[C@@H]2O)c(OC)c1	ZINC000450622119	FD	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCC[C@@H]2O)c(OC)c1	ZINC000450622119	FD	On-Demand	Anodyne	MTR1B_CHICK	0	42
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCC[C@@H]2O)c(OC)c1	ZINC000450622119	FD	On-Demand	Anodyne	MTNR1A	73	39
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCC[C@@H]2O)c(OC)c1	ZINC000450622119	FD	On-Demand	Anodyne	MTNR1B	63	37
Cc1nc2ccccc2n1C[C@H]1CCCN1CC[C@H](C)O	ZINC000450622133	CF	On-Demand	Anodyne	HRH1	23	41
Cc1nc2ccccc2n1C[C@@H]1CCCN1CC[C@@H](C)O	ZINC000450622135	CF	On-Demand	Anodyne	HRH1	23	41
Cc1nc2ccccc2n1C[C@H]1CCCN1CC[C@@H](C)O	ZINC000450622136	CF	On-Demand	Anodyne	HRH1	23	41
Cc1nc2ccccc2n1C[C@@H]1CCCN1CC[C@H](C)O	ZINC000450622137	CF	On-Demand	Anodyne	HRH1	23	41
Clc1ccc(OCC[C@H]2CCOC2)c(Cl)c1	ZINC000450622138	CH	On-Demand	Anodyne	S1PR4	28	42
Clc1ccc(OCC[C@@H]2CCOC2)c(Cl)c1	ZINC000450622140	CH	On-Demand	Anodyne	S1PR4	28	42
CC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1	ZINC000450622141	DH	On-Demand	Anodyne	ACHE	21	45
CC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1	ZINC000450622141	DH	On-Demand	Anodyne	HDAC6	0	40
CC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1	ZINC000450622141	DH	On-Demand	Anodyne	MCHR1	22	40
CC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1	ZINC000450622141	DH	On-Demand	Anodyne	NOD1	19	43
CC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)cc1	ZINC000450622141	DH	On-Demand	Anodyne	NOD2	51	43
CC(F)(F)C(C)(C)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450622181	FJ	On-Demand	Anodyne	QDPR	0	40
N#CC1(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)CCC1	ZINC000450622185	EE	On-Demand	Mild	GNAI1	0	45
N#CC1(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)CCC1	ZINC000450622185	EE	On-Demand	Mild	GNAI3	0	45
N#CC1(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)CCC1	ZINC000450622185	EE	On-Demand	Mild	GNAO1	0	45
CO[C@@H](Cc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450622188	EG	On-Demand	Anodyne	MME	41	39
CO[C@@H](Cc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450622188	EG	On-Demand	Anodyne	TIMP3	46	31
CO[C@@H](Cc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450622188	EG	On-Demand	Anodyne	FPR2	27	41
CO[C@H](Cc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450622189	EG	On-Demand	Anodyne	MME	41	39
CO[C@H](Cc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450622189	EG	On-Demand	Anodyne	TIMP3	46	31
CO[C@H](Cc1ccccc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450622189	EG	On-Demand	Anodyne	FPR2	27	41
C1=C(CNc2ncccc2OCc2ccccc2)CCOC1	ZINC000450622201	CG	On-Demand	Anodyne	PPIA	37	45
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622205	GF	On-Demand	Anodyne	GNAI1	0	44
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622205	GF	On-Demand	Anodyne	GNAI3	0	44
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622205	GF	On-Demand	Anodyne	GNAO1	0	44
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1	ZINC000450622206	FJ	On-Demand	Anodyne	CCR1	21	44
Cc1cccc(Cl)c1C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1	ZINC000450622207	FJ	On-Demand	Anodyne	CCR1	21	44
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1	ZINC000450622208	FJ	On-Demand	Anodyne	CCR1	21	44
O=C(Nc1ccccc1)c1ccccc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450622209	DH	On-Demand	Anodyne	HCN1	51	32
O=C(Nc1ccccc1)c1ccccc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450622209	DH	On-Demand	Anodyne	HCN4	40	32
O=C(Nc1ccccc1)c1ccccc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450622209	DH	On-Demand	Anodyne	KCNK3	55	41
O=C(Nc1ccccc1)c1ccccc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450622209	DH	On-Demand	Anodyne	KCNK9	52	41
O=C(Nc1ccccc1)c1ccccc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450622210	DH	On-Demand	Anodyne	HCN1	51	32
O=C(Nc1ccccc1)c1ccccc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450622210	DH	On-Demand	Anodyne	HCN4	40	32
O=C(Nc1ccccc1)c1ccccc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450622210	DH	On-Demand	Anodyne	KCNK3	55	41
O=C(Nc1ccccc1)c1ccccc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450622210	DH	On-Demand	Anodyne	KCNK9	52	41
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622213	GF	On-Demand	Anodyne	GNAI1	0	44
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622213	GF	On-Demand	Anodyne	GNAI3	0	44
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622213	GF	On-Demand	Anodyne	GNAO1	0	44
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCCC[C@H]1c1ccccc1	ZINC000450622224	EI	On-Demand	Anodyne	CPT1A	75	35
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCCC[C@H]1c1ccccc1	ZINC000450622224	EI	On-Demand	Anodyne	PREP	73	38
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCCC[C@H]1c1ccccc1	ZINC000450622224	EI	On-Demand	Anodyne	ABHD6	0	40
O=C([C@H]1CCN(c2ccccc2)C1)N1CCCC[C@H]1c1ccccc1	ZINC000450622226	EI	On-Demand	Anodyne	CPT1A	75	35
O=C([C@H]1CCN(c2ccccc2)C1)N1CCCC[C@H]1c1ccccc1	ZINC000450622226	EI	On-Demand	Anodyne	PREP	73	38
O=C([C@H]1CCN(c2ccccc2)C1)N1CCCC[C@H]1c1ccccc1	ZINC000450622226	EI	On-Demand	Anodyne	ABHD6	0	40
O=C([C@H]1CCN(c2ccccc2)C1)N1CCCC[C@@H]1c1ccccc1	ZINC000450622228	EI	On-Demand	Anodyne	CPT1A	75	35
O=C([C@H]1CCN(c2ccccc2)C1)N1CCCC[C@@H]1c1ccccc1	ZINC000450622228	EI	On-Demand	Anodyne	PREP	73	38
O=C([C@H]1CCN(c2ccccc2)C1)N1CCCC[C@@H]1c1ccccc1	ZINC000450622228	EI	On-Demand	Anodyne	ABHD6	0	40
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCCC[C@@H]1c1ccccc1	ZINC000450622231	EI	On-Demand	Anodyne	CPT1A	75	35
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCCC[C@@H]1c1ccccc1	ZINC000450622231	EI	On-Demand	Anodyne	PREP	73	38
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCCC[C@@H]1c1ccccc1	ZINC000450622231	EI	On-Demand	Anodyne	ABHD6	0	40
CC(F)(F)CCOc1ccc(F)cc1Cl	ZINC000450622236	BH	On-Demand	Anodyne	S1PR4	27	47
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622237	DJ	On-Demand	Anodyne	FKBP1A	57	43
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622237	DJ	On-Demand	Anodyne	ADAM17	26	41
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622237	DJ	On-Demand	Anodyne	COLA	134	41
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622237	DJ	On-Demand	Anodyne	CPT1A	116	41
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622237	DJ	On-Demand	Anodyne	CPT2	47	36
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622237	DJ	On-Demand	Anodyne	PREP	74	42
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622237	DJ	On-Demand	Anodyne	AMY2	46	32
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622237	DJ	On-Demand	Anodyne	FKBP12.6	0	42
C[C@H](CC(=O)N[C@H]1CN(C)NC1=O)Cc1ccc(Cl)cc1	ZINC000450622240	DD	On-Demand	Anodyne	AVPR1A	26	40
C[C@H](CC(=O)N[C@@H]1CN(C)NC1=O)Cc1ccc(Cl)cc1	ZINC000450622241	DD	On-Demand	Anodyne	AVPR1A	26	40
C[C@@H](CC(=O)N[C@H]1CN(C)NC1=O)Cc1ccc(Cl)cc1	ZINC000450622242	DD	On-Demand	Anodyne	AVPR1A	26	40
C[C@@H](CC(=O)N[C@@H]1CN(C)NC1=O)Cc1ccc(Cl)cc1	ZINC000450622243	DD	On-Demand	Anodyne	AVPR1A	26	40
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	FKBP1A	63	43
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	PRCP	15	41
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	ADAM17	26	41
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	COLA	134	41
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	CPT1A	125	41
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	CPT2	47	36
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	PREP	94	42
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	AMY2	46	32
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622244	DJ	On-Demand	Anodyne	FKBP12.6	0	42
CN1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450622245	DC	On-Demand	Bother	CACNA1C	43	34
CN1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450622245	DC	On-Demand	Bother	CACNA1D	73	34
CC(C)c1n[nH]c(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])n1	ZINC000450622249	DD	On-Demand	Bother	DRTS_TOXGO	19	51
CN1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450622254	DC	On-Demand	Bother	CACNA1C	43	34
CN1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1	ZINC000450622254	DC	On-Demand	Bother	CACNA1D	73	34
COc1cccc(OCCC(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1	ZINC000450622257	GH	On-Demand	Anodyne	MTNR1A	22	41
COc1cccc(OCCC(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1	ZINC000450622257	GH	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc(OCCC(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1	ZINC000450622257	GH	On-Demand	Anodyne	CVIR	0	42
COc1cccc(OCCC(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c1	ZINC000450622259	GH	On-Demand	Anodyne	MTNR1A	22	41
COc1cccc(OCCC(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c1	ZINC000450622259	GH	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc(OCCC(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c1	ZINC000450622259	GH	On-Demand	Anodyne	CVIR	0	42
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c1	ZINC000450622261	GH	On-Demand	Anodyne	MTNR1A	22	41
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c1	ZINC000450622261	GH	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c1	ZINC000450622261	GH	On-Demand	Anodyne	CVIR	0	42
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1	ZINC000450622263	GH	On-Demand	Anodyne	MTNR1A	22	41
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1	ZINC000450622263	GH	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1	ZINC000450622263	GH	On-Demand	Anodyne	CVIR	0	42
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	HTR1A	23	44
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	DRD2	31	48
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	DRD4	25	43
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	HTR2A	44	43
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	HTR2C	36	43
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	SLC6A1	43	35
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	SLC6A4	19	43
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	DRD3	49	48
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	OPRL1	19	49
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	HRP1_PLAFA	22	43
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	HRH3	30	51
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	SIGMAR1	25	52
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	P2RX7	19	44
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	CCR5	15	42
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	CHRNA7	25	40
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	HNMT	49	35
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	EPHX2	35	43
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	CACNA1G	50	39
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	GNAI1	0	41
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	GNAI3	0	41
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	GNAO1	0	41
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	TBK1	44	36
Cc1cccc(Cl)c1CN1CCC(C(=O)NCCCN2CCCCC2)CC1	ZINC000450622264	GH	On-Demand	Anodyne	MTNR1C	0	40
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	THRA	29	42
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	PPARA	15	49
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	P2RY12	0	40
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	THRB	0	42
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	DRTS_LEIMA	15	46
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	MTNR1A	22	42
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	MTNR1B	22	42
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	PLA2G4B	88	42
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	ACR	19	40
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	GALR3	73	40
CC(=O)CCCCCOc1cccc(C(F)(F)F)c1	ZINC000450622265	CI	On-Demand	Anodyne	PDS	56	50
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450622269	CC	On-Demand	Anodyne	MMP1	23	41
CCC[C@H](CC(C)C)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450622271	CC	On-Demand	Anodyne	MMP1	23	41
CCC[C@@H](CC(C)C)C(=O)N[C@H]1CN(C)NC1=O	ZINC000450622273	CC	On-Demand	Anodyne	MMP1	23	41
CCC[C@@H](CC(C)C)C(=O)N[C@@H]1CN(C)NC1=O	ZINC000450622275	CC	On-Demand	Anodyne	MMP1	23	41
CCCOc1cccc(CN2CC[C@@H](C(N)=O)c3ccccc32)c1	ZINC000450622285	DG	On-Demand	Anodyne	HRH2	50	40
CN1CCN(S(=O)(=O)c2ccc(NCC(C)(C)c3ccccn3)nc2)CC1	ZINC000450622286	GD	On-Demand	Anodyne	TGM2	20	41
CN1CCN(S(=O)(=O)c2ccc(NCC(C)(C)c3ccccn3)nc2)CC1	ZINC000450622286	GD	On-Demand	Anodyne	GCK	48	32
CCCOc1cccc(CN2CC[C@H](C(N)=O)c3ccccc32)c1	ZINC000450622287	DG	On-Demand	Anodyne	HRH2	50	40
O=C(NCc1nc2ccccc2n1C1CC1)[C@H]1CCCCC1(F)F	ZINC000450622295	EH	On-Demand	Anodyne	OPRL1	17	41
O=C(NCc1nc2ccccc2n1C1CC1)[C@H]1CCCCC1(F)F	ZINC000450622295	EH	On-Demand	Anodyne	CCR5	18	40
O=C(NCc1nc2ccccc2n1C1CC1)[C@@H]1CCCCC1(F)F	ZINC000450622296	EH	On-Demand	Anodyne	OPRL1	17	41
O=C(NCc1nc2ccccc2n1C1CC1)[C@@H]1CCCCC1(F)F	ZINC000450622296	EH	On-Demand	Anodyne	CCR5	18	40
OCCN1CCCC[C@H]1CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450622306	GE	On-Demand	Anodyne	ROS1	46	35
OCCN1CCCC[C@@H]1CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450622308	GE	On-Demand	Anodyne	ROS1	46	35
COc1cccc(OCCC(=O)Nc2cccc(SC)c2C)c1	ZINC000450622318	EI	On-Demand	Anodyne	MTNR1A	34	46
COc1cccc(OCCC(=O)Nc2cccc(SC)c2C)c1	ZINC000450622318	EI	On-Demand	Anodyne	MTNR1B	35	48
COC(=O)c1csc(CSc2nnc(-c3cc(OC)cc(OC)c3)o2)n1	ZINC000450622325	GG	On-Demand	Anodyne	GSK3A	28	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	FKBP1A	53	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	SLC6A1	26	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	SLC6A3	15	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	ADAM17	24	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	COLA	128	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	CPT1A	120	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	CPT2	46	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	PREP	52	45
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	GPBAR1	0	46
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2)c1	ZINC000450622352	EJ	On-Demand	Anodyne	GPR88	0	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	FKBP1A	53	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	SLC6A1	26	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	SLC6A3	15	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	ADAM17	24	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	COLA	128	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	CPT1A	120	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	CPT2	46	39
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	PREP	52	45
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	GPBAR1	0	46
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2)c1	ZINC000450622353	EJ	On-Demand	Anodyne	GPR88	0	44
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@@H]1CCNC1=O	ZINC000450622354	CC	On-Demand	Anodyne	GALR1	46	33
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H]1CCNC1=O	ZINC000450622355	CC	On-Demand	Anodyne	GALR1	46	33
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@@H]1CCNC1=O	ZINC000450622356	CC	On-Demand	Anodyne	GALR1	46	33
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H]1CCNC1=O	ZINC000450622357	CC	On-Demand	Anodyne	GALR1	46	33
c1ccc2c3c([nH]c2c1)CN(Cc1cnn[nH]1)CC3	ZINC000450622358	CD	On-Demand	Anodyne	DRD5	19	46
CN1C[C@H](NC(=O)CCCc2ccc3ccccc3c2)C(=O)N1	ZINC000450622370	DD	On-Demand	Anodyne	CXCR4	50	38
CN1C[C@H](NC(=O)CCCc2ccc3ccccc3c2)C(=O)N1	ZINC000450622370	DD	On-Demand	Anodyne	LUXR	61	45
CN1C[C@@H](NC(=O)CCCc2ccc3ccccc3c2)C(=O)N1	ZINC000450622371	DD	On-Demand	Anodyne	CXCR4	50	38
CN1C[C@@H](NC(=O)CCCc2ccc3ccccc3c2)C(=O)N1	ZINC000450622371	DD	On-Demand	Anodyne	LUXR	61	45
CCSc1cccnc1C(=O)Nc1cccc(SC)c1C	ZINC000450622374	DI	On-Demand	Anodyne	G2YM83_BOTF4	66	34
Cc1ccccc1-c1nnc(SCCC(C)(F)F)o1	ZINC000450622378	CI	On-Demand	Anodyne	TYMS	0	42
Cc1ccccc1-c1nnc(SCCC(C)(F)F)o1	ZINC000450622378	CI	On-Demand	Anodyne	ALOX15	58	35
Cc1ccccc1-c1nnc(SCCC(C)(F)F)o1	ZINC000450622378	CI	On-Demand	Anodyne	CYP73A16	15	45
OCCN1CCCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450622379	FE	On-Demand	Anodyne	EGFR	43	39
OCCN1CCCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450622380	FE	On-Demand	Anodyne	EGFR	43	39
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	HTR1A	18	55
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	DRD2	36	49
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	DRD1	23	58
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	DRD4	25	49
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	HTR2A	33	55
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	HTR2C	23	55
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	DRD3	18	58
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	DRD5	20	49
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	ERG2	23	49
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	HTR7	21	49
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	SIGMAR1	17	56
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	CCR3	27	40
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	HTR5A	16	51
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	SLC18A3	23	56
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	HTR3B	0	49
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	MCHR1	17	66
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450622393	FI	On-Demand	Anodyne	CYP2J2	54	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	ANPEP	42	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	CASP3	33	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	SCN9A	22	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	CAPNS1	45	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	CAPN1	62	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	CASP1	27	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	CAPN2	73	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	FPR1	58	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC1Cc2ccccc2C1	ZINC000450622394	EF	On-Demand	Anodyne	POL	0	44
C[C@@H]1CC[C@@H](C(=O)N2CCN(c3cccc(C#N)n3)CC2)C[C@H]1C	ZINC000450622414	EF	On-Demand	Mild	SSTR2	51	35
C[C@@H]1CC[C@H](C(=O)N2CCN(c3cccc(C#N)n3)CC2)C[C@H]1C	ZINC000450622415	EF	On-Demand	Mild	SSTR2	51	35
C[C@H]1C[C@H](C(=O)N2CCN(c3cccc(C#N)n3)CC2)CC[C@H]1C	ZINC000450622416	EF	On-Demand	Mild	SSTR2	51	35
C[C@H]1C[C@@H](C(=O)N2CCN(c3cccc(C#N)n3)CC2)CC[C@H]1C	ZINC000450622417	EF	On-Demand	Mild	SSTR2	51	35
O=C(CN1CCN(C[C@H]2CCC(F)(F)C2)CC1)Nc1ccccc1F	ZINC000450622420	FF	On-Demand	Anodyne	DRD4	0	51
O=C(CN1CCN(C[C@@H]2CCC(F)(F)C2)CC1)Nc1ccccc1F	ZINC000450622421	FF	On-Demand	Anodyne	DRD4	0	51
CC(=O)c1cccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)c1	ZINC000450622461	EI	On-Demand	Anodyne	PDE6D	50	41
CC(=O)c1cccc(CN2CCC[C@H]2Cn2c(C)nc3ccccc32)c1	ZINC000450622461	EI	On-Demand	Anodyne	CDPK1	0	42
CC(=O)c1cccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)c1	ZINC000450622462	EI	On-Demand	Anodyne	PDE6D	50	41
CC(=O)c1cccc(CN2CCC[C@@H]2Cn2c(C)nc3ccccc32)c1	ZINC000450622462	EI	On-Demand	Anodyne	CDPK1	0	42
C[C@@H](O)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450622466	ED	On-Demand	Anodyne	DRD4	22	41
C[C@@H](O)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450622466	ED	On-Demand	Anodyne	SLC6A1	26	40
C[C@@H](O)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450622466	ED	On-Demand	Anodyne	KCNA5	0	62
C[C@@H](O)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450622466	ED	On-Demand	Anodyne	IMDH_CRYPV	27	41
C[C@H](O)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450622467	ED	On-Demand	Anodyne	DRD4	22	41
C[C@H](O)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450622467	ED	On-Demand	Anodyne	SLC6A1	26	40
C[C@H](O)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450622467	ED	On-Demand	Anodyne	KCNA5	0	62
C[C@H](O)CCN1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000450622467	ED	On-Demand	Anodyne	IMDH_CRYPV	27	41
CCn1nnc(C)c1COc1ccc([N+](=O)[O-])cc1	ZINC000450622479	CE	On-Demand	Bother	ACR	20	40
CC[C@@H](C)[C@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450622481	FE	On-Demand	Bother	COLA	61	34
CC[C@@H](C)[C@@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450622482	FE	On-Demand	Bother	COLA	61	34
CC[C@H](C)[C@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450622483	FE	On-Demand	Bother	COLA	61	34
CC[C@H](C)[C@@H](CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450622484	FE	On-Demand	Bother	COLA	61	34
Nc1ncccc1CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450622496	DF	On-Demand	Anodyne	HRH1	0	41
Nc1ncccc1CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450622497	DF	On-Demand	Anodyne	HRH1	0	41
O=C(C1=C(c2ccccc2)CCC1)N1CCN(c2ccc(F)cn2)CC1	ZINC000450622514	FH	On-Demand	Anodyne	SLC27A1	43	42
O=C(C1=C(c2ccccc2)CCC1)N1CCN(c2ccc(F)cn2)CC1	ZINC000450622514	FH	On-Demand	Anodyne	SLC6A7	0	45
O=C1c2ccccc2C(=O)N1C[C@@H]1CCCCC1(F)F	ZINC000450622515	CG	On-Demand	Anodyne	KEAP1	0	40
O=C1c2ccccc2C(=O)N1C[C@H]1CCCCC1(F)F	ZINC000450622516	CG	On-Demand	Anodyne	KEAP1	0	40
Clc1cccc(O[C@H]2CCN(CCc3cscn3)C2)c1	ZINC000450622517	DG	On-Demand	Anodyne	SCN5A	48	40
Clc1cccc(O[C@@H]2CCN(CCc3cscn3)C2)c1	ZINC000450622518	DG	On-Demand	Anodyne	SCN5A	48	40
CCOCc1nc(C)c(C(=O)NC2Cc3ccccc3C2)s1	ZINC000450622539	DF	On-Demand	Anodyne	ADAM9	58	34
CC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1	ZINC000450622545	EF	On-Demand	Anodyne	SLC6A1	44	38
CC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1	ZINC000450622545	EF	On-Demand	Anodyne	L3MBTL1	0	47
CC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1	ZINC000450622545	EF	On-Demand	Anodyne	MBTD1	0	47
COc1cc(-c2noc(CN3CC[C@H](Oc4cccc(Cl)c4)C3)n2)ncn1	ZINC000450622547	GF	On-Demand	Anodyne	PDE3A	41	34
COc1cc(-c2noc(CN3CC[C@H](Oc4cccc(Cl)c4)C3)n2)ncn1	ZINC000450622547	GF	On-Demand	Anodyne	DCK	22	40
COc1cc(-c2noc(CN3CC[C@H](Oc4cccc(Cl)c4)C3)n2)ncn1	ZINC000450622547	GF	On-Demand	Anodyne	PDE3B	65	34
COc1cc(-c2noc(CN3CC[C@@H](Oc4cccc(Cl)c4)C3)n2)ncn1	ZINC000450622548	GF	On-Demand	Anodyne	PDE3A	41	34
COc1cc(-c2noc(CN3CC[C@@H](Oc4cccc(Cl)c4)C3)n2)ncn1	ZINC000450622548	GF	On-Demand	Anodyne	DCK	22	40
COc1cc(-c2noc(CN3CC[C@@H](Oc4cccc(Cl)c4)C3)n2)ncn1	ZINC000450622548	GF	On-Demand	Anodyne	PDE3B	65	34
N#CC1(COc2ccc(Cl)c(Cl)c2)CCC1	ZINC000450622557	CI	On-Demand	Mild	TRPV4	43	34
CS(=O)(=O)c1cccc(CN2CC[C@H](C(N)=O)c3ccccc32)c1	ZINC000450622559	EE	On-Demand	Anodyne	TRY2_BOVIN	40	35
O=C([C@@H]1CC12CCSCC2)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450622561	GJ	On-Demand	Anodyne	ADAM10	38	44
CS(=O)(=O)c1cccc(CN2CC[C@@H](C(N)=O)c3ccccc32)c1	ZINC000450622562	EE	On-Demand	Anodyne	TRY2_BOVIN	40	35
FC(F)(F)Cn1ccc(COc2cccc(C(F)(F)F)c2)n1	ZINC000450622563	DI	On-Demand	Anodyne	GALR3	50	32
FC(F)(F)Cn1ccc(COc2cccc(C(F)(F)F)c2)n1	ZINC000450622563	DI	On-Demand	Anodyne	PDS	41	37
O=C([C@H]1CC12CCSCC2)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450622566	GJ	On-Demand	Anodyne	ADAM10	38	44
CN(CCc1cccc(NC(=O)c2c(Cl)cc(Cl)cc2Cl)c1)C1CC1	ZINC000450622568	GK	On-Demand	Anodyne	TYK2	72	40
CN(CCc1cccc(NC(=O)c2c(Cl)cc(Cl)cc2Cl)c1)C1CC1	ZINC000450622568	GK	On-Demand	Anodyne	PSBA	0	40
CN(CCc1cccc(NC(=O)c2c(Cl)cc(Cl)cc2Cl)c1)C1CC1	ZINC000450622568	GK	On-Demand	Anodyne	KCNK3	54	34
Cc1nn(C)c(C)c1CCCNC(=O)Cc1sccc1Br	ZINC000450622574	FG	On-Demand	Anodyne	P2RX7	15	41
CO[C@@H](Cc1ccccc1)CN(C)[C@H]1CCNC1=O	ZINC000450622582	CD	On-Demand	Anodyne	GHRL	50	31
CO[C@H](Cc1ccccc1)CN(C)[C@H]1CCNC1=O	ZINC000450622583	CD	On-Demand	Anodyne	GHRL	50	31
CO[C@@H](Cc1ccccc1)CN(C)[C@@H]1CCNC1=O	ZINC000450622584	CD	On-Demand	Anodyne	GHRL	50	31
CO[C@H](Cc1ccccc1)CN(C)[C@@H]1CCNC1=O	ZINC000450622585	CD	On-Demand	Anodyne	GHRL	50	31
CCOc1ccc2nc(SCc3cn(C)nc3C)[nH]c2c1	ZINC000450622586	DG	On-Demand	Anodyne	CYP2C8	31	47
CCOc1ccc2nc(SCc3cn(C)nc3C)[nH]c2c1	ZINC000450622586	DG	On-Demand	Anodyne	CYP1A2	20	46
CCOc1ccc2nc(SCc3cn(C)nc3C)[nH]c2c1	ZINC000450622586	DG	On-Demand	Anodyne	CYP2C19	41	47
Cc1ccn(-c2ccccc2C(=O)N2CCC(C)(CO)CC2)n1	ZINC000450622589	DE	On-Demand	Anodyne	AVPR2	23	40
COC(=O)c1coc(CN2CCc3c(F)cccc3C2)n1	ZINC000450622590	CE	On-Demand	Anodyne	NOD2	42	37
CSc1cccc(C(=O)NCCN2CC=C(C)CC2)c1	ZINC000450622601	CF	On-Demand	Anodyne	DRD4	55	44
CSc1cccc(C(=O)NCCN2CC=C(C)CC2)c1	ZINC000450622601	CF	On-Demand	Anodyne	PLD2	73	38
CSc1cccc(C(=O)NCCN2CC=C(C)CC2)c1	ZINC000450622601	CF	On-Demand	Anodyne	SIRT2	22	41
COc1cc(CN2CCN(Cc3ccncc3)CC2)ccc1Cl	ZINC000450622615	EG	On-Demand	Anodyne	DRD1	0	45
COc1cc(CN2CCN(Cc3ccncc3)CC2)ccc1Cl	ZINC000450622615	EG	On-Demand	Anodyne	DRD4	41	42
COc1cc(CN2CCN(Cc3ccncc3)CC2)ccc1Cl	ZINC000450622615	EG	On-Demand	Anodyne	DRD3	23	41
COc1cc(CN2CCN(Cc3ccncc3)CC2)ccc1Cl	ZINC000450622615	EG	On-Demand	Anodyne	SIGMAR1	29	51
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@H](O)C3CCC3)cc2)C[C@H]1C	ZINC000450622619	FE	On-Demand	Anodyne	ADRB1	34	40
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@H](O)C3CCC3)cc2)C[C@H]1C	ZINC000450622619	FE	On-Demand	Anodyne	LTA4H	50	44
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@H](O)C3CCC3)cc2)C[C@H]1C	ZINC000450622619	FE	On-Demand	Anodyne	HRH3	30	43
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@H](O)C3CCC3)cc2)C[C@H]1C	ZINC000450622619	FE	On-Demand	Anodyne	BIRC2	48	38
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@@H](O)C3CCC3)cc2)C[C@@H]1C	ZINC000450622620	FE	On-Demand	Anodyne	ADRB1	34	40
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@@H](O)C3CCC3)cc2)C[C@@H]1C	ZINC000450622620	FE	On-Demand	Anodyne	LTA4H	50	44
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@@H](O)C3CCC3)cc2)C[C@@H]1C	ZINC000450622620	FE	On-Demand	Anodyne	HRH3	30	43
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@@H](O)C3CCC3)cc2)C[C@@H]1C	ZINC000450622620	FE	On-Demand	Anodyne	BIRC2	48	38
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@H](O)C3CCC3)cc2)C[C@@H]1C	ZINC000450622621	FE	On-Demand	Anodyne	ADRB1	34	40
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@H](O)C3CCC3)cc2)C[C@@H]1C	ZINC000450622621	FE	On-Demand	Anodyne	LTA4H	50	44
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@H](O)C3CCC3)cc2)C[C@@H]1C	ZINC000450622621	FE	On-Demand	Anodyne	HRH3	30	43
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@H](O)C3CCC3)cc2)C[C@@H]1C	ZINC000450622621	FE	On-Demand	Anodyne	BIRC2	48	38
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@@H](O)C3CCC3)cc2)C[C@H]1C	ZINC000450622622	FE	On-Demand	Anodyne	ADRB1	34	40
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@@H](O)C3CCC3)cc2)C[C@H]1C	ZINC000450622622	FE	On-Demand	Anodyne	LTA4H	50	44
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@@H](O)C3CCC3)cc2)C[C@H]1C	ZINC000450622622	FE	On-Demand	Anodyne	HRH3	30	43
C[C@@H]1CN(CCOc2ccc(CCNC(=O)[C@@H](O)C3CCC3)cc2)C[C@H]1C	ZINC000450622622	FE	On-Demand	Anodyne	BIRC2	48	38
CC(=O)CCCCCOc1ccc(F)cc1Cl	ZINC000450622632	CI	On-Demand	Anodyne	PPARA	23	43
CC(=O)CCCCCOc1ccc(F)cc1Cl	ZINC000450622632	CI	On-Demand	Anodyne	S1PR4	26	46
C[C@H](OCc1ccc(F)cc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450622635	FH	On-Demand	Anodyne	USP1	0	40
C[C@@H](OCc1ccc(F)cc1)C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450622636	FH	On-Demand	Anodyne	USP1	0	40
CCc1nc(C)c(CSc2nnc(-c3cc(OC)cc(OC)c3)o2)o1	ZINC000450622653	FH	On-Demand	Anodyne	GSK3B	0	45
CCc1nc(C)c(CSc2nnc(-c3cc(OC)cc(OC)c3)o2)o1	ZINC000450622653	FH	On-Demand	Anodyne	GSK3A	32	44
CCOc1nc2ccc(C(=O)N3CCC(N(C)CCO)CC3)cc2[nH]1	ZINC000450622654	ED	On-Demand	Anodyne	L3MBTL3	44	35
CC(C)c1n[nH]c(CNc2nccc3ccc(F)cc23)n1	ZINC000450622655	CG	On-Demand	Anodyne	USP10	0	43
CC(C)c1n[nH]c(CNc2nccc3ccc(F)cc23)n1	ZINC000450622655	CG	On-Demand	Anodyne	USP13	0	43
Cc1cc(C(=O)N2CCCC[C@H]2c2ccccc2)ncc1C(N)=O	ZINC000450622664	DF	On-Demand	Anodyne	COLA	100	37
Cc1cc(C(=O)N2CCCC[C@H]2c2ccccc2)ncc1C(N)=O	ZINC000450622664	DF	On-Demand	Anodyne	CPT1A	94	37
Cc1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)ncc1C(N)=O	ZINC000450622669	DF	On-Demand	Anodyne	COLA	100	37
Cc1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)ncc1C(N)=O	ZINC000450622669	DF	On-Demand	Anodyne	CPT1A	94	37
COC(=O)c1coc(CSc2nnc(-c3cc(OC)cc(OC)c3)o2)n1	ZINC000450622683	GF	On-Demand	Anodyne	GSK3A	27	43
CCCc1cc(C(=O)N2CCCC[C@H]2c2ccccc2)no1	ZINC000450622686	CH	On-Demand	Anodyne	CPT1A	110	38
CCCc1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)no1	ZINC000450622687	CH	On-Demand	Anodyne	CPT1A	99	38
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622694	DJ	On-Demand	Anodyne	ADAM17	46	46
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622694	DJ	On-Demand	Anodyne	COLA	72	35
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622694	DJ	On-Demand	Anodyne	CPT1A	69	35
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622697	DJ	On-Demand	Anodyne	ADAM17	46	46
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622697	DJ	On-Demand	Anodyne	COLA	72	35
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622697	DJ	On-Demand	Anodyne	CPT1A	69	35
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622699	DJ	On-Demand	Anodyne	ADAM17	46	46
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622699	DJ	On-Demand	Anodyne	COLA	72	35
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450622699	DJ	On-Demand	Anodyne	CPT1A	69	35
CCc1cccc(C(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)n1	ZINC000450622700	EG	On-Demand	Anodyne	PDE5A	28	41
CCc1cccc(C(=O)Nc2ccc(C[C@@H](C)C(=O)OC)cc2)n1	ZINC000450622700	EG	On-Demand	Anodyne	PLAU	50	34
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622701	DJ	On-Demand	Anodyne	ADAM17	46	46
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622701	DJ	On-Demand	Anodyne	COLA	72	35
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450622701	DJ	On-Demand	Anodyne	CPT1A	69	35
COc1cccc(OCCC(=O)NCCc2cnccn2)c1	ZINC000450622702	DD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCC(=O)NCCc2cnccn2)c1	ZINC000450622702	DD	On-Demand	Anodyne	MTNR1A	90	45
COc1cccc(OCCC(=O)NCCc2cnccn2)c1	ZINC000450622702	DD	On-Demand	Anodyne	MTNR1B	70	43
CCc1cccc(C(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)n1	ZINC000450622708	EG	On-Demand	Anodyne	PDE5A	28	41
CCc1cccc(C(=O)Nc2ccc(C[C@H](C)C(=O)OC)cc2)n1	ZINC000450622708	EG	On-Demand	Anodyne	PLAU	50	34
Cc1ccc2nc(SCC3(C#N)CCC3)[nH]c2c1	ZINC000450622711	CH	On-Demand	Mild	CYP2C19	18	43
CN(C)S(=O)(=O)c1ccc(NCC(C)(C)c2ccccn2)c([N+](=O)[O-])c1	ZINC000450622731	GF	On-Demand	Bother	COLA	61	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H]2CC[C@H](C)O2)cc1	ZINC000450622736	DF	On-Demand	Anodyne	TIMP3	41	32
COc1cc(OC)cc(-c2nnc(SCC3(OC)CCC3)o2)c1	ZINC000450622737	EG	On-Demand	Anodyne	GSK3A	26	42
COC[C@@]1(C)CCN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450622750	DF	On-Demand	Anodyne	PDE3B	56	34
COC[C@]1(C)CCN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450622751	DF	On-Demand	Anodyne	PDE3B	56	34
CCCOc1cccc(CN2CCCC[C@H]2c2n[nH]c(C)n2)c1	ZINC000450622752	DH	On-Demand	Anodyne	COLA	57	36
CCCOc1cccc(CN2CCCC[C@H]2c2n[nH]c(C)n2)c1	ZINC000450622752	DH	On-Demand	Anodyne	CPT1A	57	36
CCCOc1cccc(CN2CCCC[C@@H]2c2n[nH]c(C)n2)c1	ZINC000450622753	DH	On-Demand	Anodyne	COLA	57	36
CCCOc1cccc(CN2CCCC[C@@H]2c2n[nH]c(C)n2)c1	ZINC000450622753	DH	On-Demand	Anodyne	CPT1A	57	36
COc1ccc(-n2c(S[C@@H]3CC[C@H](C#N)C3)nnc2-c2ccncc2)cc1	ZINC000450622754	GI	On-Demand	Mild	WNT3A	19	43
COc1ccc(-n2c(S[C@@H]3CC[C@H](C#N)C3)nnc2-c2ccncc2)cc1	ZINC000450622754	GI	On-Demand	Mild	VCP	55	39
COc1ccc(-n2c(S[C@H]3CC[C@@H](C#N)C3)nnc2-c2ccncc2)cc1	ZINC000450622755	GI	On-Demand	Mild	WNT3A	19	43
COc1ccc(-n2c(S[C@H]3CC[C@@H](C#N)C3)nnc2-c2ccncc2)cc1	ZINC000450622755	GI	On-Demand	Mild	VCP	55	39
COc1ccc(-n2c(S[C@H]3CC[C@H](C#N)C3)nnc2-c2ccncc2)cc1	ZINC000450622756	GI	On-Demand	Mild	WNT3A	19	43
COc1ccc(-n2c(S[C@H]3CC[C@H](C#N)C3)nnc2-c2ccncc2)cc1	ZINC000450622756	GI	On-Demand	Mild	VCP	55	39
COc1ccc(-n2c(S[C@@H]3CC[C@@H](C#N)C3)nnc2-c2ccncc2)cc1	ZINC000450622757	GI	On-Demand	Mild	WNT3A	19	43
COc1ccc(-n2c(S[C@@H]3CC[C@@H](C#N)C3)nnc2-c2ccncc2)cc1	ZINC000450622757	GI	On-Demand	Mild	VCP	55	39
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1	ZINC000450622780	FG	On-Demand	Anodyne	KDM5C	0	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1	ZINC000450622780	FG	On-Demand	Anodyne	KCNK3	17	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1	ZINC000450622781	FG	On-Demand	Anodyne	KDM5C	0	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1	ZINC000450622781	FG	On-Demand	Anodyne	KCNK3	17	43
CCN(CC)S(=O)(=O)c1ccc(NCc2ccnc(C)c2)c([N+](=O)[O-])c1	ZINC000450622791	GF	On-Demand	Bother	BDKRB1	23	43
CO[C@@H]1CC[C@@H]2OCCN(CCCC(=O)c3ccc(F)cc3)[C@H]2C1	ZINC000450622801	EG	On-Demand	Anodyne	DRD4	0	43
CO[C@@H]1CC[C@@H]2OCCN(CCCC(=O)c3ccc(F)cc3)[C@H]2C1	ZINC000450622801	EG	On-Demand	Anodyne	CYP2J2	49	35
CO[C@@H]1CC[C@@H]2OCCN(CCCC(=O)c3ccc(F)cc3)[C@@H]2C1	ZINC000450622802	EG	On-Demand	Anodyne	DRD4	0	43
CO[C@@H]1CC[C@@H]2OCCN(CCCC(=O)c3ccc(F)cc3)[C@@H]2C1	ZINC000450622802	EG	On-Demand	Anodyne	CYP2J2	49	35
CO[C@@H]1CC[C@H]2OCCN(CCCC(=O)c3ccc(F)cc3)[C@@H]2C1	ZINC000450622803	EG	On-Demand	Anodyne	DRD4	0	43
CO[C@@H]1CC[C@H]2OCCN(CCCC(=O)c3ccc(F)cc3)[C@@H]2C1	ZINC000450622803	EG	On-Demand	Anodyne	CYP2J2	49	35
CO[C@@H]1CC[C@H]2OCCN(CCCC(=O)c3ccc(F)cc3)[C@H]2C1	ZINC000450622804	EG	On-Demand	Anodyne	DRD4	0	43
CO[C@@H]1CC[C@H]2OCCN(CCCC(=O)c3ccc(F)cc3)[C@H]2C1	ZINC000450622804	EG	On-Demand	Anodyne	CYP2J2	49	35
CC[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450622815	FJ	On-Demand	Anodyne	RBP4	77	41
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450622816	FJ	On-Demand	Anodyne	RBP4	77	41
O=C(CN1CCN(Cc2cn(CC3CC3)nn2)CC1)Nc1ccc(Cl)cc1	ZINC000450622828	GE	On-Demand	Anodyne	MCHR1	15	41
O=C(CC[C@@H]1CCCCO1)CSc1ccc2ccccc2n1	ZINC000450622854	DI	On-Demand	Anodyne	ALOX5	22	40
O=C(CC[C@@H]1CCCCO1)CSc1ccc2ccccc2n1	ZINC000450622854	DI	On-Demand	Anodyne	SMO	51	39
O=C(CC[C@H]1CCCCO1)CSc1ccc2ccccc2n1	ZINC000450622855	DI	On-Demand	Anodyne	ALOX5	22	40
O=C(CC[C@H]1CCCCO1)CSc1ccc2ccccc2n1	ZINC000450622855	DI	On-Demand	Anodyne	SMO	51	39
Cc1cc(CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)ccn1	ZINC000450622856	DI	On-Demand	Bother	DRTS_TRYCR	43	30
N#CC1(COc2ccc(Cl)cc2Cl)CCC1	ZINC000450622857	CI	On-Demand	Mild	S1PR4	23	40
CCCc1c(NC(=O)c2cccc3c2O[C@@H](C)C3)cnn1-c1cc(C)ccn1	ZINC000450622865	GI	On-Demand	Anodyne	G2YM83_BOTF4	59	36
CCCc1c(NC(=O)c2cccc3c2O[C@H](C)C3)cnn1-c1cc(C)ccn1	ZINC000450622866	GI	On-Demand	Anodyne	G2YM83_BOTF4	59	36
CC[C@H](C)[C@@H](CNc1ccc(C(=O)Nc2nncs2)cn1)OC	ZINC000450622871	EF	On-Demand	Anodyne	MAP1	45	38
CC[C@H](C)[C@H](CNc1ccc(C(=O)Nc2nncs2)cn1)OC	ZINC000450622872	EF	On-Demand	Anodyne	MAP1	45	38
CC[C@@H](C)[C@H](CNc1ccc(C(=O)Nc2nncs2)cn1)OC	ZINC000450622873	EF	On-Demand	Anodyne	MAP1	45	38
CC[C@@H](C)[C@@H](CNc1ccc(C(=O)Nc2nncs2)cn1)OC	ZINC000450622874	EF	On-Demand	Anodyne	MAP1	45	38
CC(C)(C)OC(=O)c1ccccc1NC(=O)CSC1CC1	ZINC000450622892	DG	On-Demand	Anodyne	FAS	50	50
CC[S@](=O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450622907	DE	On-Demand	Anodyne	KCNA3	39	41
CC[S@](=O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450622907	DE	On-Demand	Anodyne	ACAT	0	53
CC[S@@](=O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450622908	DE	On-Demand	Anodyne	KCNA3	39	41
CC[S@@](=O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450622908	DE	On-Demand	Anodyne	ACAT	0	53
COc1ccc(-c2csc3ncnc(N[C@H]4CCCN(CCCO)C4)c23)cc1	ZINC000450622917	GH	On-Demand	Anodyne	ADRB3	26	48
COc1ccc(-c2csc3ncnc(N[C@@H]4CCCN(CCCO)C4)c23)cc1	ZINC000450622918	GH	On-Demand	Anodyne	ADRB3	26	48
Brc1ccc2c(NCC3=CCOCC3)ncnc2c1	ZINC000450622931	DF	On-Demand	Anodyne	CLK4	65	36
CC1=CCN(CCNC(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC000450622935	CE	On-Demand	Anodyne	PLD2	42	35
CC(=O)c1ccc(CN2CCC[C@H]2Cn2cnc3ccccc32)cc1	ZINC000450622940	EH	On-Demand	Anodyne	CHEK2	24	40
CC(=O)c1ccc(CN2CCC[C@@H]2Cn2cnc3ccccc32)cc1	ZINC000450622941	EH	On-Demand	Anodyne	CHEK2	24	40
Cc1ccc(NC(=O)N2CCN(CC3(C#N)CCC3)CC2)cc1Cl	ZINC000450622946	EG	On-Demand	Mild	PYGL	0	41
CC1=CCN(CCNC(=O)c2ccsc2C)CC1	ZINC000450622953	CE	On-Demand	Anodyne	DRD4	40	33
CCC[C@H](OC)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450622956	FH	On-Demand	Anodyne	QDPR	0	40
CCC[C@@H](OC)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450622957	FH	On-Demand	Anodyne	QDPR	0	40
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	ESR1	92	41
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	ACHE	15	40
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	HRH2	51	36
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	ESR2	63	43
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	LTA4H	76	49
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	HRH3	74	46
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	MMP13	16	42
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	HNMT	35	40
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	MMP1	15	42
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	TNK2	21	40
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	PSMB2	56	46
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	PSMB5	19	46
O=C(CS(=O)(=O)C1CC1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450622970	GD	On-Demand	Anodyne	PSMB1	50	46
N#CC1(CN2CCN(c3ccc(F)cc3Cl)CC2)CCC1	ZINC000450622985	DG	On-Demand	Mild	ADRA1D	15	42
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	DRD2	18	42
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	ACHE	29	43
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	HRH1	19	43
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	CHRM3	25	44
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	PRSS2	45	32
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	SIGMAR1	43	48
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	SSTR5	44	38
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	CCR3	39	46
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	CXCR3	23	41
CC(=O)c1cccc(CN2CCC(OCCO)CC2)c1	ZINC000450623011	CD	On-Demand	Anodyne	MCHR1	32	40
CS(=O)(=O)c1cccc(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)c1	ZINC000450623012	GG	On-Demand	Anodyne	COLA	0	41
CS(=O)(=O)c1cccc(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)c1	ZINC000450623012	GG	On-Demand	Anodyne	CPT1A	17	41
CS(=O)(=O)c1cccc(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)c1	ZINC000450623013	GG	On-Demand	Anodyne	COLA	0	41
CS(=O)(=O)c1cccc(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)c1	ZINC000450623013	GG	On-Demand	Anodyne	CPT1A	17	41
Cc1cc(-c2nc(C(=O)N(CC(C)(C)C)CC(C)(C)C)co2)ccn1	ZINC000450623014	EJ	On-Demand	Anodyne	IRAK4	20	41
CC1=CCN(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450623015	FH	On-Demand	Anodyne	RBP4	68	38
CC1(CO)CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450623018	DG	On-Demand	Anodyne	PREP	27	40
CC1(CO)CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450623018	DG	On-Demand	Anodyne	ADAM10	48	37
CC1(CO)CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450623019	DG	On-Demand	Anodyne	PREP	27	40
CC1(CO)CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450623019	DG	On-Demand	Anodyne	ADAM10	48	37
CC1(CO)CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450623020	DG	On-Demand	Anodyne	PREP	27	40
CC1(CO)CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450623020	DG	On-Demand	Anodyne	ADAM10	48	37
CC1(CO)CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450623021	DG	On-Demand	Anodyne	PREP	27	40
CC1(CO)CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450623021	DG	On-Demand	Anodyne	ADAM10	48	37
FC1(F)CC[C@@H](CN2CCc3c([nH]c4ccccc34)C2)C1	ZINC000450623039	CH	On-Demand	Anodyne	DRD5	20	54
FC1(F)CC[C@H](CN2CCc3c([nH]c4ccccc34)C2)C1	ZINC000450623040	CH	On-Demand	Anodyne	DRD5	20	54
CN(Cc1cc(CN(C)[C@H]2CCNC2=O)cc(C(F)(F)F)c1)[C@H]1CCNC1=O	ZINC000450623044	GD	On-Demand	Anodyne	TACR1	39	43
CN(Cc1cc(CN(C)[C@@H]2CCNC2=O)cc(C(F)(F)F)c1)[C@@H]1CCNC1=O	ZINC000450623045	GD	On-Demand	Anodyne	TACR1	39	43
CN(Cc1cc(CN(C)[C@@H]2CCNC2=O)cc(C(F)(F)F)c1)[C@H]1CCNC1=O	ZINC000450623046	GD	On-Demand	Anodyne	TACR1	39	43
COc1cc(CN2CCC3(CC2)NC(=O)NC3=O)ccc1Cl	ZINC000450623047	DD	On-Demand	Anodyne	PDE7A	29	42
CCC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CCO1	ZINC000450623064	FE	On-Demand	Anodyne	MTNR1A	43	38
CCC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CCO1	ZINC000450623065	FE	On-Demand	Anodyne	MTNR1A	43	38
CC(=O)c1cccc(CN2CCc3c([nH]c4ccccc34)C2)c1	ZINC000450623076	DH	On-Demand	Anodyne	FABI	52	36
CC(=O)c1cccc(CN2CCc3c([nH]c4ccccc34)C2)c1	ZINC000450623076	DH	On-Demand	Anodyne	DRD5	22	45
CC(=O)c1cccc(CN2CCc3c([nH]c4ccccc34)C2)c1	ZINC000450623076	DH	On-Demand	Anodyne	SSTR4	55	38
CC(=O)c1cccc(CN2CCc3c([nH]c4ccccc34)C2)c1	ZINC000450623076	DH	On-Demand	Anodyne	SSTR5	44	38
CC(=O)c1cccc(CN2CCc3c([nH]c4ccccc34)C2)c1	ZINC000450623076	DH	On-Demand	Anodyne	HTR5A	21	56
CC(=O)c1cccc(CN2CCc3c([nH]c4ccccc34)C2)c1	ZINC000450623076	DH	On-Demand	Anodyne	PARP1	15	44
CC(=O)c1cccc(CN2CCc3c([nH]c4ccccc34)C2)c1	ZINC000450623076	DH	On-Demand	Anodyne	MCHR2	43	38
CCS(=O)(=O)c1ccc(CN2CCN(Cc3ccncc3)CC2)cc1	ZINC000450623081	FE	On-Demand	Anodyne	ADORA2B	41	35
CCS(=O)(=O)c1ccc(CN2CCN(Cc3ccncc3)CC2)cc1	ZINC000450623081	FE	On-Demand	Anodyne	LSS	15	54
CCS(=O)(=O)c1ccc(CN2CCN(Cc3ccncc3)CC2)cc1	ZINC000450623081	FE	On-Demand	Anodyne	RORC	29	41
O=C1CC[C@H](CCC(=O)N2CCCC[C@H]2c2ccccc2)N1	ZINC000450623082	DF	On-Demand	Anodyne	COLA	131	41
O=C1CC[C@H](CCC(=O)N2CCCC[C@H]2c2ccccc2)N1	ZINC000450623082	DF	On-Demand	Anodyne	CPT1A	115	41
O=C1CC[C@H](CCC(=O)N2CCCC[C@H]2c2ccccc2)N1	ZINC000450623082	DF	On-Demand	Anodyne	PREP	59	39
O=C1CC[C@@H](CCC(=O)N2CCCC[C@H]2c2ccccc2)N1	ZINC000450623083	DF	On-Demand	Anodyne	CPT1A	115	41
O=C1CC[C@@H](CCC(=O)N2CCCC[C@H]2c2ccccc2)N1	ZINC000450623083	DF	On-Demand	Anodyne	PREP	59	39
O=C1CC[C@H](CCC(=O)N2CCCC[C@@H]2c2ccccc2)N1	ZINC000450623084	DF	On-Demand	Anodyne	COLA	131	41
O=C1CC[C@H](CCC(=O)N2CCCC[C@@H]2c2ccccc2)N1	ZINC000450623084	DF	On-Demand	Anodyne	CPT1A	115	41
O=C1CC[C@H](CCC(=O)N2CCCC[C@@H]2c2ccccc2)N1	ZINC000450623084	DF	On-Demand	Anodyne	PREP	59	39
O=C1CC[C@@H](CCC(=O)N2CCCC[C@@H]2c2ccccc2)N1	ZINC000450623085	DF	On-Demand	Anodyne	COLA	131	41
O=C1CC[C@@H](CCC(=O)N2CCCC[C@@H]2c2ccccc2)N1	ZINC000450623085	DF	On-Demand	Anodyne	CPT1A	115	41
O=C1CC[C@@H](CCC(=O)N2CCCC[C@@H]2c2ccccc2)N1	ZINC000450623085	DF	On-Demand	Anodyne	PREP	59	39
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450623090	DI	On-Demand	Anodyne	ADAM17	28	41
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450623090	DI	On-Demand	Anodyne	COLA	73	35
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450623090	DI	On-Demand	Anodyne	CPT1A	67	35
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450623090	DI	On-Demand	Anodyne	PREP	52	36
O=C([C@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450623091	DI	On-Demand	Anodyne	ADAM17	28	41
O=C([C@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450623091	DI	On-Demand	Anodyne	COLA	73	35
O=C([C@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450623091	DI	On-Demand	Anodyne	CPT1A	65	35
O=C([C@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450623091	DI	On-Demand	Anodyne	PREP	41	36
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450623092	DI	On-Demand	Anodyne	ADAM17	28	41
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450623092	DI	On-Demand	Anodyne	COLA	73	35
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450623092	DI	On-Demand	Anodyne	CPT1A	65	35
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450623092	DI	On-Demand	Anodyne	PREP	41	36
O=C([C@H]1CC12CCSCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450623093	DI	On-Demand	Anodyne	ADAM17	28	41
O=C([C@H]1CC12CCSCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450623093	DI	On-Demand	Anodyne	COLA	73	35
O=C([C@H]1CC12CCSCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450623093	DI	On-Demand	Anodyne	CPT1A	65	35
O=C([C@H]1CC12CCSCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450623093	DI	On-Demand	Anodyne	PREP	41	36
CCC(=O)CCCN1Cc2ccccc2C(C)(C)C1	ZINC000450623099	CH	On-Demand	Anodyne	HTR7	16	41
Clc1ccc(OCc2cn(CC3CC3)nn2)cc1Cl	ZINC000450623101	CH	On-Demand	Anodyne	FIMH	15	41
O=C(c1cccc(C(F)(F)F)n1)N1CCCC[C@H]1c1ccccc1	ZINC000450623106	EI	On-Demand	Anodyne	CPT1A	94	41
O=C(c1cccc(C(F)(F)F)n1)N1CCCC[C@H]1c1ccccc1	ZINC000450623106	EI	On-Demand	Anodyne	SFRP1	82	34
O=C(c1cccc(C(F)(F)F)n1)N1CCCC[C@H]1c1ccccc1	ZINC000450623106	EI	On-Demand	Anodyne	WNT3	59	33
O=C(c1cccc(C(F)(F)F)n1)N1CCCC[C@@H]1c1ccccc1	ZINC000450623107	EI	On-Demand	Anodyne	CPT1A	94	41
O=C(c1cccc(C(F)(F)F)n1)N1CCCC[C@@H]1c1ccccc1	ZINC000450623107	EI	On-Demand	Anodyne	SFRP1	82	34
O=C(c1cccc(C(F)(F)F)n1)N1CCCC[C@@H]1c1ccccc1	ZINC000450623107	EI	On-Demand	Anodyne	WNT3	59	33
Cc1cc(C)cc(OCc2cn(CC3CC3)nn2)c1	ZINC000450623111	CF	On-Demand	Anodyne	MAL12	0	43
Cc1cc(C)cc(OCc2cccc(S(C)(=O)=O)c2)c1	ZINC000450623123	CG	On-Demand	Anodyne	MAOB	43	41
Cc1cc(C)cc(OCc2cccc(S(C)(=O)=O)c2)c1	ZINC000450623123	CG	On-Demand	Anodyne	FFAR1	41	40
Cc1cc(C)cc(OCc2cccc(S(C)(=O)=O)c2)c1	ZINC000450623123	CG	On-Demand	Anodyne	PIR	0	40
CN(CCc1ccccn1)Cc1ccc(F)c(CN(C)CCc2ccccn2)c1	ZINC000450623124	GH	On-Demand	Anodyne	GNRHR	32	41
CC[C@H](CC(F)(F)F)NC(=O)c1ccc(I)cc1F	ZINC000450623134	GH	On-Demand	Anodyne	MAP2K1	40	33
CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(I)cc1F	ZINC000450623135	GH	On-Demand	Anodyne	MAP2K1	40	33
CC(=O)CCCCCSc1ccccc1	ZINC000450623136	BH	On-Demand	Anodyne	THRB	22	42
O=C(NC1CC1)N[C@@H]1CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450623137	DD	On-Demand	Anodyne	EPHX2	23	47
O=C(NC1CC1)N[C@H]1CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450623138	DD	On-Demand	Anodyne	EPHX2	23	47
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2ccnc(C)c2)c([N+](=O)[O-])c1	ZINC000450623147	FE	On-Demand	Bother	TAAR1	18	46
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2ccnc(C)c2)c([N+](=O)[O-])c1	ZINC000450623148	FE	On-Demand	Bother	TAAR1	18	46
c1ccc2[nH]c(SC[C@H]3C[C@H]4CC[C@H]3O4)nc2c1	ZINC000450623157	CG	On-Demand	Anodyne	TXN	17	40
c1ccc2[nH]c(SC[C@@H]3C[C@H]4CC[C@H]3O4)nc2c1	ZINC000450623158	CG	On-Demand	Anodyne	TXN	17	40
CC(=O)CCCCCOc1ccccc1[N+](=O)[O-]	ZINC000450623166	CG	On-Demand	Bother	COLA	60	31
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623167	DG	On-Demand	Anodyne	DRD4	15	44
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623167	DG	On-Demand	Anodyne	HTR2A	21	49
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623167	DG	On-Demand	Anodyne	HTR2C	22	52
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623167	DG	On-Demand	Anodyne	SLC6A1	76	38
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623167	DG	On-Demand	Anodyne	HTR7	15	46
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623167	DG	On-Demand	Anodyne	TACR2	21	44
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623167	DG	On-Demand	Anodyne	SIGMAR1	17	52
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623167	DG	On-Demand	Anodyne	CYP2J2	70	49
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623168	DG	On-Demand	Anodyne	DRD4	15	44
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623168	DG	On-Demand	Anodyne	HTR2A	21	49
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623168	DG	On-Demand	Anodyne	HTR2C	22	52
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623168	DG	On-Demand	Anodyne	SLC6A1	76	38
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623168	DG	On-Demand	Anodyne	HTR7	15	46
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623168	DG	On-Demand	Anodyne	TACR2	21	44
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623168	DG	On-Demand	Anodyne	SIGMAR1	17	52
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccccc1	ZINC000450623168	DG	On-Demand	Anodyne	CYP2J2	70	49
CC(=O)c1ccccc1OCC1(C#N)CCC1	ZINC000450623187	BF	On-Demand	Mild	ABCB1	0	41
CC(=O)c1ccccc1OCC1(C#N)CCC1	ZINC000450623187	BF	On-Demand	Mild	HCN1	53	34
CC(=O)c1ccccc1OCC1(C#N)CCC1	ZINC000450623187	BF	On-Demand	Mild	HCN4	51	34
COC1(CSc2nc3ccccc3[nH]2)CCC1	ZINC000450623197	BG	On-Demand	Anodyne	CYP2C8	28	41
COC1(CSc2nc3ccccc3[nH]2)CCC1	ZINC000450623197	BG	On-Demand	Anodyne	CYP1A2	18	43
COC1(CSc2nc3ccccc3[nH]2)CCC1	ZINC000450623197	BG	On-Demand	Anodyne	CYP2C19	37	45
COC1(CSc2nc3ccccc3[nH]2)CCC1	ZINC000450623197	BG	On-Demand	Anodyne	TXN	18	46
CC(=O)N1CC[C@@H](CN(C)CCCC(=O)c2ccccc2)C1	ZINC000450623211	DE	On-Demand	Anodyne	CYP2J2	50	35
CC(=O)N1CC[C@H](CN(C)CCCC(=O)c2ccccc2)C1	ZINC000450623212	DE	On-Demand	Anodyne	CYP2J2	50	35
CCCCN(CCCO)C(=O)c1c[nH]c2nccc-2c1	ZINC000450623223	CE	On-Demand	Anodyne	TSPO	17	42
CCCCN(CCCO)C(=O)c1c[nH]c2nccc-2c1	ZINC000450623223	CE	On-Demand	Anodyne	PLM2_PLAFA	46	37
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NC2Cc3ccccc3C2)cc1OC	ZINC000450623224	GE	On-Demand	Anodyne	HCRTR1	17	51
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC(C)(CO)CC2)c1	ZINC000450623253	EF	On-Demand	Anodyne	AKR1C2	46	34
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(OCCO)CC1	ZINC000450623255	CD	On-Demand	Anodyne	OPRL1	17	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(OCCO)CC1	ZINC000450623255	CD	On-Demand	Anodyne	SLC6A3	23	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(OCCO)CC1	ZINC000450623256	CD	On-Demand	Anodyne	OPRL1	17	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(OCCO)CC1	ZINC000450623256	CD	On-Demand	Anodyne	SLC6A3	23	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(OCCO)CC1	ZINC000450623257	CD	On-Demand	Anodyne	OPRL1	17	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(OCCO)CC1	ZINC000450623257	CD	On-Demand	Anodyne	SLC6A3	23	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(OCCO)CC1	ZINC000450623258	CD	On-Demand	Anodyne	OPRL1	17	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(OCCO)CC1	ZINC000450623258	CD	On-Demand	Anodyne	SLC6A3	23	43
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	HTR1A	21	60
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	CHRM1	17	50
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	DRD2	40	57
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	DRD1	30	56
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	DRD4	29	55
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	HTR2A	42	54
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	HTR2C	25	60
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	SLC6A1	0	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	SLC6A4	21	44
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	HRH1	16	54
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	ADRA1B	17	46
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	DRD3	20	55
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	SLC6A3	41	44
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	ERG2	22	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	HTR7	28	48
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	HRH3	17	40
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	SIGMAR1	30	56
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	SLC18A3	19	52
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	HTR3B	0	56
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	CYP2J2	60	43
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	NET	0	50
CN1[C@H]2CC[C@H]1CC(N1CCN(CCCC(=O)c3ccc(F)cc3)CC1)C2	ZINC000450623260	FG	On-Demand	Anodyne	AP2S1	0	48
O=C1CCC(CN2CC[C@H](Oc3cccc(Cl)c3)C2)CC1	ZINC000450623261	DH	On-Demand	Anodyne	HRH1	28	48
O=C1CCC(CN2CC[C@H](Oc3cccc(Cl)c3)C2)CC1	ZINC000450623261	DH	On-Demand	Anodyne	CCR3	33	48
O=C1CCC(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)CC1	ZINC000450623262	DH	On-Demand	Anodyne	HRH1	28	48
O=C1CCC(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)CC1	ZINC000450623262	DH	On-Demand	Anodyne	CCR3	33	48
CC1=CCN(CCNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450623295	EE	On-Demand	Anodyne	CTSL	21	42
CC1=CCN(CCNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450623295	EE	On-Demand	Anodyne	CTSS	18	42
CCc1nc(C)c(COc2ccc([N+](=O)[O-])cc2Cl)o1	ZINC000450623296	CH	On-Demand	Bother	ENR	0	41
COc1ccc(C(C)=O)c(OCc2cc(C(C)(C)C)on2)c1	ZINC000450623312	DH	On-Demand	Anodyne	FLT3	43	36
COc1ccc(C(C)=O)c(OCc2cc(C(C)(C)C)on2)c1	ZINC000450623312	DH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
N#C[C@@H]1CSCCN1C(=O)Cc1sccc1Br	ZINC000450623314	EF	On-Demand	Mild	FAP	0	40
N#C[C@H]1CSCCN1C(=O)Cc1sccc1Br	ZINC000450623316	EF	On-Demand	Mild	FAP	0	40
FC1(F)CC(CN2CC[C@H](Oc3cccc(Cl)c3)C2)C1	ZINC000450623317	DH	On-Demand	Anodyne	HRH1	20	41
FC1(F)CC(CN2CC[C@H](Oc3cccc(Cl)c3)C2)C1	ZINC000450623317	DH	On-Demand	Anodyne	CCR3	24	41
FC1(F)CC(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)C1	ZINC000450623318	DH	On-Demand	Anodyne	HRH1	20	41
FC1(F)CC(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)C1	ZINC000450623318	DH	On-Demand	Anodyne	CCR3	24	41
Cc1ccc(C(=O)N2CCC(C)(CO)CC2)c(Cl)c1Cl	ZINC000450623326	DH	On-Demand	Anodyne	P2RX7	24	42
O=C(Cc1cc2ccccc2s1)N1CCN(c2ccc(F)cn2)CC1	ZINC000450623330	FG	On-Demand	Anodyne	DGAT1	26	42
O=C(Cc1cc2ccccc2s1)N1CCN(c2ccc(F)cn2)CC1	ZINC000450623330	FG	On-Demand	Anodyne	SLC27A1	43	42
Cc1nn(C)cc1COc1cccc([N+](=O)[O-])c1	ZINC000450623334	BE	On-Demand	Bother	CACNA1D	59	33
Cc1nn(C)cc1COc1cccc([N+](=O)[O-])c1	ZINC000450623334	BE	On-Demand	Bother	ACR	19	47
Cc1nn(C)cc1COc1cccc([N+](=O)[O-])c1	ZINC000450623334	BE	On-Demand	Bother	ATSA	0	41
C=CC(C)(C)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450623350	EI	On-Demand	Mild	QDPR	0	40
Cc1ccc2nc(SC[C@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450623351	CH	On-Demand	Anodyne	CYP2C19	15	46
Cc1ccc2nc(SC[C@@H]3C[C@H]4CC[C@H]3O4)[nH]c2c1	ZINC000450623352	CH	On-Demand	Anodyne	CYP2C19	15	46
CCCCN(CCCO)C(=O)c1nc2ccccc2nc1C1CC1	ZINC000450623362	EG	On-Demand	Anodyne	TSPO	22	40
C=CCC1(C(=O)NC2Cc3ccccc3C2)CCCC1	ZINC000450623376	CG	On-Demand	Mild	MME	16	41
CC(=O)CCCCCSc1nc2ccc(C)cc2[nH]1	ZINC000450623387	CI	On-Demand	Anodyne	CYP1A2	18	50
CC(=O)CCCCCSc1nc2ccc(C)cc2[nH]1	ZINC000450623387	CI	On-Demand	Anodyne	CYP2C19	36	50
CC(=O)CCCCCSc1nc2ccc(C)cc2[nH]1	ZINC000450623387	CI	On-Demand	Anodyne	HDA106	0	47
CC[C@H](CC#N)NC(=O)CCCC(C)C	ZINC000450623389	BF	On-Demand	Mild	Q6UB75_PIG	0	43
CC[C@H](CC#N)NC(=O)CCCC(C)C	ZINC000450623389	BF	On-Demand	Mild	NOD1	42	35
CC[C@@H](CC#N)NC(=O)CCCC(C)C	ZINC000450623390	BF	On-Demand	Mild	Q6UB75_PIG	0	43
CC[C@@H](CC#N)NC(=O)CCCC(C)C	ZINC000450623390	BF	On-Demand	Mild	NOD1	42	35
Cc1cc(C)c(C(=O)N2CCC(C)(CO)CC2)cc1Br	ZINC000450623392	EG	On-Demand	Anodyne	RXRG	49	37
Cc1cc(C)c(C(=O)N2CCC(C)(CO)CC2)cc1Br	ZINC000450623392	EG	On-Demand	Anodyne	RXRB	42	37
CCCCN(CCCO)C(=O)Cc1cc2ccccc2s1	ZINC000450623394	DG	On-Demand	Anodyne	TSPO	40	46
COCC1(O)CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450623411	CD	On-Demand	Anodyne	OPRK1	17	40
COCC1(O)CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450623411	CD	On-Demand	Anodyne	OPRL1	16	40
COCC1(O)CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450623412	CD	On-Demand	Anodyne	OPRK1	17	40
COCC1(O)CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450623412	CD	On-Demand	Anodyne	OPRL1	16	40
COCC1(O)CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450623413	CD	On-Demand	Anodyne	OPRK1	17	40
COCC1(O)CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450623413	CD	On-Demand	Anodyne	OPRL1	16	40
COCC1(O)CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450623414	CD	On-Demand	Anodyne	OPRK1	17	40
COCC1(O)CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450623414	CD	On-Demand	Anodyne	OPRL1	16	40
C=C[C@@H]1OCC[C@H]1C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450623420	CG	On-Demand	Mild	COLA	58	33
C=C[C@@H]1OCC[C@H]1C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450623420	CG	On-Demand	Mild	CPT1A	49	33
C=C[C@@H]1OCC[C@H]1C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450623421	CG	On-Demand	Mild	COLA	58	33
C=C[C@@H]1OCC[C@H]1C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450623421	CG	On-Demand	Mild	CPT1A	49	33
CCn1cnc2c(NCc3ccnc(C)c3)ncnc21	ZINC000450623430	CE	On-Demand	Anodyne	ADORA3	44	39
COC(=O)Cn1cc(COc2ccccc2OC)nn1	ZINC000450623432	CD	On-Demand	Anodyne	HSP90AB1	22	40
N#Cc1cccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)CC2)n1	ZINC000450623448	GD	On-Demand	Mild	COLA	0	47
N#Cc1cccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)CC2)n1	ZINC000450623448	GD	On-Demand	Mild	CPT1A	18	47
N#Cc1cccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)CC2)n1	ZINC000450623448	GD	On-Demand	Mild	CPT2	40	42
N#Cc1cccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)CC2)n1	ZINC000450623448	GD	On-Demand	Mild	DPP4	16	40
N#Cc1cccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)CC2)n1	ZINC000450623448	GD	On-Demand	Mild	PREP	108	60
N#Cc1cccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)CC2)n1	ZINC000450623448	GD	On-Demand	Mild	SFRP1	42	40
N#Cc1cccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)c3ccccc3)CC2)n1	ZINC000450623448	GD	On-Demand	Mild	WNT3	49	40
Cc1cc(CNc2cc(N3CCC[C@@H](C)C3)ncn2)ccn1	ZINC000450623451	CG	On-Demand	Anodyne	PRCP	15	44
Cc1cc(CNc2cc(N3CCC[C@@H](C)C3)ncn2)ccn1	ZINC000450623451	CG	On-Demand	Anodyne	HRH4	17	49
Cc1cc(CNc2cc(N3CCC[C@H](C)C3)ncn2)ccn1	ZINC000450623452	CG	On-Demand	Anodyne	PRCP	15	44
Cc1cc(CNc2cc(N3CCC[C@H](C)C3)ncn2)ccn1	ZINC000450623452	CG	On-Demand	Anodyne	HRH4	17	49
Cc1cc(CNc2cc(N3CCN(C)C(=O)C3)ncn2)ccn1	ZINC000450623453	DD	On-Demand	Anodyne	HRH4	16	54
CC(C)CCCC(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450623457	CD	On-Demand	Anodyne	EPHX2	23	47
CC(C)CCCC(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450623458	CD	On-Demand	Anodyne	EPHX2	23	47
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	DRD2	15	45
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	DRD4	53	48
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	F10	15	44
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	LTA4H	27	56
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	SIGMAR1	21	47
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	GUAB	0	42
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	PRNP	42	38
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	LSS	23	47
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	FAAH	18	52
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	MCHR1	31	44
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	CACNA1G	15	60
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	IMDH_CRYPV	20	40
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	NOD1	32	49
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	NOD2	46	39
CC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000450623465	GG	On-Demand	Anodyne	BRD2	20	41
CC[C@@H](O)CC(=O)NC[C@]1(C)CCCc2ccccc21	ZINC000450623468	CF	On-Demand	Anodyne	NR3C1	22	41
CC[C@@H](O)CC(=O)NC[C@]1(C)CCCc2ccccc21	ZINC000450623468	CF	On-Demand	Anodyne	ACAT	0	45
CC[C@@H](O)CC(=O)NC[C@@]1(C)CCCc2ccccc21	ZINC000450623469	CF	On-Demand	Anodyne	NR3C1	22	41
CC[C@@H](O)CC(=O)NC[C@@]1(C)CCCc2ccccc21	ZINC000450623469	CF	On-Demand	Anodyne	ACAT	0	45
CC[C@H](O)CC(=O)NC[C@@]1(C)CCCc2ccccc21	ZINC000450623470	CF	On-Demand	Anodyne	NR3C1	22	41
CC[C@H](O)CC(=O)NC[C@@]1(C)CCCc2ccccc21	ZINC000450623470	CF	On-Demand	Anodyne	ACAT	0	45
CC[C@H](O)CC(=O)NC[C@]1(C)CCCc2ccccc21	ZINC000450623471	CF	On-Demand	Anodyne	NR3C1	22	41
CC[C@H](O)CC(=O)NC[C@]1(C)CCCc2ccccc21	ZINC000450623471	CF	On-Demand	Anodyne	ACAT	0	45
N#CC1(CSc2nnnn2-c2ccccc2)CCC1	ZINC000450623482	CE	On-Demand	Mild	CELA2A	29	43
CCOC(=O)c1cc(C(=O)N2CCN(c3cccc(C#N)n3)CC2)on1	ZINC000450623500	FD	On-Demand	Mild	GYRB	0	42
CCOC(=O)c1cc(C(=O)N2CCN(c3cccc(C#N)n3)CC2)on1	ZINC000450623500	FD	On-Demand	Mild	P2RY12	50	40
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623526	EH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623526	EH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623526	EH	On-Demand	Anodyne	HTR2A	16	43
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623526	EH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623526	EH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623526	EH	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623529	EH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623529	EH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623529	EH	On-Demand	Anodyne	HTR2A	16	43
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623529	EH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623529	EH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623529	EH	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623531	EH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623531	EH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623531	EH	On-Demand	Anodyne	HTR2A	16	43
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623531	EH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623531	EH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623531	EH	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623532	EH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623532	EH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623532	EH	On-Demand	Anodyne	HTR2A	16	43
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623532	EH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623532	EH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450623532	EH	On-Demand	Anodyne	CYP2J2	44	31
COc1ccc(C(C)=O)c(OCCC(C)(F)F)c1	ZINC000450623540	CG	On-Demand	Anodyne	MTNR1A	31	40
COc1ccc(C(C)=O)c(OCCC(C)(F)F)c1	ZINC000450623540	CG	On-Demand	Anodyne	MTNR1B	36	40
COc1ccc(C(C)=O)c(OCCC(C)(F)F)c1	ZINC000450623540	CG	On-Demand	Anodyne	AKR1C2	40	36
Cc1ccc(NC(=O)N2CCN(Cc3cn(C)nc3C)CC2)cc1Cl	ZINC000450623541	FG	On-Demand	Anodyne	PYGL	0	46
CN1CC[C@@](O)(CNC(=O)c2cc(Cl)c(F)cc2Br)C1	ZINC000450623556	FE	On-Demand	Anodyne	SLC6A9	48	37
CN1CC[C@](O)(CNC(=O)c2cc(Cl)c(F)cc2Br)C1	ZINC000450623558	FE	On-Demand	Anodyne	SLC6A9	48	37
O=C(Nc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450623559	DH	On-Demand	Anodyne	HCN1	52	33
O=C(Nc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450623559	DH	On-Demand	Anodyne	HCN4	41	32
O=C(Nc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450623559	DH	On-Demand	Anodyne	KCNK3	56	42
O=C(Nc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450623559	DH	On-Demand	Anodyne	KCNK9	52	42
O=C(Nc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450623562	DH	On-Demand	Anodyne	HCN1	41	32
O=C(Nc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450623562	DH	On-Demand	Anodyne	HCN4	41	32
O=C(Nc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450623562	DH	On-Demand	Anodyne	KCNK3	56	42
CC(F)(F)CCSc1nnnn1-c1ccccc1	ZINC000450623565	CF	On-Demand	Anodyne	CELA2A	32	44
Cc1cccc(Cl)c1CN(C)CCc1ccccn1	ZINC000450623566	CH	On-Demand	Anodyne	GNRHR	22	41
CC[C@@H]1CCCC[C@@H]1CNc1cc(COC)nc2ncnn12	ZINC000450623573	DF	On-Demand	Anodyne	DHOD	0	40
c1ccc2c(c1)ncn2Cc1cn(CC2CC2)nn1	ZINC000450623574	CE	On-Demand	Anodyne	PKM	22	42
CC[C@@H]1CCCC[C@H]1CNc1cc(COC)nc2ncnn12	ZINC000450623575	DF	On-Demand	Anodyne	DHOD	0	40
COC1(CSc2nc3ccc(C)cc3[nH]2)CCC1	ZINC000450623576	CH	On-Demand	Anodyne	CYP2C8	28	42
COC1(CSc2nc3ccc(C)cc3[nH]2)CCC1	ZINC000450623576	CH	On-Demand	Anodyne	CYP2C19	39	46
CC[C@H]1CCCC[C@@H]1CNc1cc(COC)nc2ncnn12	ZINC000450623577	DF	On-Demand	Anodyne	DHOD	0	40
CC[C@H]1CCCC[C@H]1CNc1cc(COC)nc2ncnn12	ZINC000450623579	DF	On-Demand	Anodyne	DHOD	0	40
C[C@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623597	CG	On-Demand	Anodyne	FOLH1	23	40
C[C@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623597	CG	On-Demand	Anodyne	SMO	22	40
C[C@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623597	CG	On-Demand	Anodyne	HCN1	64	35
C[C@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623597	CG	On-Demand	Anodyne	HCN4	51	35
C[C@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623597	CG	On-Demand	Anodyne	KCNK3	68	50
C[C@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623597	CG	On-Demand	Anodyne	KCNK9	73	50
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623598	CG	On-Demand	Anodyne	FOLH1	23	40
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623598	CG	On-Demand	Anodyne	SMO	22	40
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623598	CG	On-Demand	Anodyne	HCN1	64	35
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623598	CG	On-Demand	Anodyne	HCN4	51	35
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623598	CG	On-Demand	Anodyne	KCNK3	68	50
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450623598	CG	On-Demand	Anodyne	KCNK9	73	50
COC(=O)c1cn([C@@H]2CCCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)nn1	ZINC000450623599	GD	On-Demand	Anodyne	HRH3	31	40
COC(=O)c1cn([C@@H]2CCCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)nn1	ZINC000450623600	GD	On-Demand	Anodyne	HRH3	31	40
COC(=O)c1cn([C@H]2CCCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C2)nn1	ZINC000450623601	GD	On-Demand	Anodyne	HRH3	31	40
COC(=O)c1cn([C@H]2CCCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C2)nn1	ZINC000450623602	GD	On-Demand	Anodyne	HRH3	31	40
Cc1nn(C)cc1COc1cccc(C(F)(F)F)c1	ZINC000450623607	CG	On-Demand	Anodyne	GALR3	45	32
Cc1nn(C)cc1COc1cccc(C(F)(F)F)c1	ZINC000450623607	CG	On-Demand	Anodyne	PDS	41	35
COc1ccc(C(C)=O)c(OCc2cn(C)nc2C)c1	ZINC000450623609	CF	On-Demand	Anodyne	PDGFRB	15	43
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	DRD2	42	62
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	DRD1	32	56
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	HRH2	0	62
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	HTR2A	25	63
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	HTR2C	22	58
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	ADRA1A	24	42
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	DRD5	23	44
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	ERG2	28	62
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	HTR7	25	44
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	HTR3B	0	45
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	CYP2J2	58	42
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	NET	0	62
COCC1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450623617	DE	On-Demand	Anodyne	AP2S1	0	62
CC1(C(=O)NCCSCc2ccc(Cl)cc2Cl)CCC(=O)CC1	ZINC000450623635	FI	On-Demand	Anodyne	P2RX7	28	44
O=[N+]([O-])c1cccc(OC[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450623646	BF	On-Demand	Bother	ACR	17	40
O=[N+]([O-])c1cccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450623647	BF	On-Demand	Bother	ACR	17	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(C)(CO)CC1	ZINC000450623651	DG	On-Demand	Anodyne	RXRG	61	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(C)(CO)CC1	ZINC000450623651	DG	On-Demand	Anodyne	RXRA	46	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(C)(CO)CC1	ZINC000450623651	DG	On-Demand	Anodyne	RXRB	60	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(C)(CO)CC1	ZINC000450623651	DG	On-Demand	Anodyne	CACNA1B	40	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(C)(CO)CC1	ZINC000450623651	DG	On-Demand	Anodyne	CCR5	25	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(C)(CO)CC1	ZINC000450623651	DG	On-Demand	Anodyne	LIPG	47	36
N#CC1(CN2CC[C@H](Oc3cccc(Cl)c3)C2)CCC1	ZINC000450623657	CG	On-Demand	Mild	HRH1	20	40
N#CC1(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)CCC1	ZINC000450623658	CG	On-Demand	Mild	HRH1	20	40
COC(=O)c1ccc(CN2CC[C@H](C(N)=O)c3ccccc32)cc1Cl	ZINC000450623715	FG	On-Demand	Anodyne	PYGL	18	41
COC(=O)c1ccc(CN2CC[C@H](C(N)=O)c3ccccc32)cc1Cl	ZINC000450623715	FG	On-Demand	Anodyne	PYGM	34	41
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)[C@@H](C)C1	ZINC000450623718	FD	On-Demand	Anodyne	DRD4	47	36
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)[C@@H](C)C1	ZINC000450623718	FD	On-Demand	Anodyne	HRH3	17	46
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)[C@@H](C)C1	ZINC000450623718	FD	On-Demand	Anodyne	MTNR1A	23	42
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)[C@@H](C)C1	ZINC000450623718	FD	On-Demand	Anodyne	MTNR1B	28	42
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)[C@H](C)C1	ZINC000450623719	FD	On-Demand	Anodyne	DRD4	47	36
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)[C@H](C)C1	ZINC000450623719	FD	On-Demand	Anodyne	HRH3	17	46
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)[C@H](C)C1	ZINC000450623719	FD	On-Demand	Anodyne	MTNR1A	23	42
COC(=O)CCN1CCN(C(=O)CCOc2cccc(OC)c2)[C@H](C)C1	ZINC000450623719	FD	On-Demand	Anodyne	MTNR1B	28	42
CC1(CO)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623724	EH	On-Demand	Anodyne	MC4R	59	43
CC1(CO)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623724	EH	On-Demand	Anodyne	PRCP	59	41
CC1(CO)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623724	EH	On-Demand	Anodyne	MC3R	49	43
CC1(CO)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623724	EH	On-Demand	Anodyne	MC5R	35	43
CC1(CO)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623725	EH	On-Demand	Anodyne	MC4R	59	43
CC1(CO)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623725	EH	On-Demand	Anodyne	PRCP	59	41
CC1(CO)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623725	EH	On-Demand	Anodyne	MC3R	49	43
CC1(CO)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623725	EH	On-Demand	Anodyne	MC5R	35	43
CC1(CO)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623726	EH	On-Demand	Anodyne	MC4R	59	43
CC1(CO)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623726	EH	On-Demand	Anodyne	PRCP	59	41
CC1(CO)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623726	EH	On-Demand	Anodyne	MC3R	49	43
CC1(CO)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623726	EH	On-Demand	Anodyne	MC5R	35	43
CC1(CO)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623727	EH	On-Demand	Anodyne	MC4R	59	43
CC1(CO)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623727	EH	On-Demand	Anodyne	PRCP	59	41
CC1(CO)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623727	EH	On-Demand	Anodyne	MC3R	49	43
CC1(CO)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450623727	EH	On-Demand	Anodyne	MC5R	35	43
COC(=O)c1ccc(CN2CC[C@@H](C(N)=O)c3ccccc32)cc1Cl	ZINC000450623730	FG	On-Demand	Anodyne	PYGL	18	41
COC(=O)c1ccc(CN2CC[C@@H](C(N)=O)c3ccccc32)cc1Cl	ZINC000450623730	FG	On-Demand	Anodyne	PYGM	34	41
CC(C)c1n[nH]c(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])n1	ZINC000450623744	FD	On-Demand	Bother	BDKRB1	0	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623746	DH	On-Demand	Anodyne	DRD5	23	48
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623746	DH	On-Demand	Anodyne	SSTR4	45	36
C[C@@H](c1ccccc1)[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623746	DH	On-Demand	Anodyne	HTR5A	25	55
C[C@H](c1ccccc1)[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623747	DH	On-Demand	Anodyne	DRD5	23	48
C[C@H](c1ccccc1)[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623747	DH	On-Demand	Anodyne	SSTR4	45	36
C[C@H](c1ccccc1)[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623747	DH	On-Demand	Anodyne	HTR5A	25	55
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623748	DH	On-Demand	Anodyne	DRD5	23	48
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623748	DH	On-Demand	Anodyne	SSTR4	45	36
C[C@H](c1ccccc1)[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623748	DH	On-Demand	Anodyne	HTR5A	25	55
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623749	DH	On-Demand	Anodyne	DRD5	23	48
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623749	DH	On-Demand	Anodyne	SSTR4	45	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450623749	DH	On-Demand	Anodyne	HTR5A	25	55
Cc1nn(C)cc1COc1ccc(Cl)cc1Cl	ZINC000450623762	CH	On-Demand	Anodyne	S1PR4	32	48
CC(C)(C)C(=O)CCCC(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450623782	DD	On-Demand	Anodyne	EPHX2	25	45
CC(C)(C)C(=O)CCCC(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450623783	DD	On-Demand	Anodyne	EPHX2	25	45
Cc1ccc2nc(SCCC(C)(F)F)[nH]c2c1	ZINC000450623787	CI	On-Demand	Anodyne	CYP1A2	17	47
Cc1ccc2nc(SCCC(C)(F)F)[nH]c2c1	ZINC000450623787	CI	On-Demand	Anodyne	CYP2C19	36	44
CN(CCN(C)[C@H]1CCNC1=O)Cc1ccccc1	ZINC000450623791	CC	On-Demand	Anodyne	GHRL	52	32
CN(CCN(C)[C@@H]1CCNC1=O)Cc1ccccc1	ZINC000450623792	CC	On-Demand	Anodyne	GHRL	52	32
O=C(NC1CC1)N[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450623795	ED	On-Demand	Anodyne	EPHX2	39	42
O=C(NC1CC1)N[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450623796	ED	On-Demand	Anodyne	EPHX2	39	42
FC1(F)CC(CSc2nc3ccccc3[nH]2)C1	ZINC000450623800	CH	On-Demand	Anodyne	CYP2C19	30	47
CC(=O)CCCCCSc1ncccn1	ZINC000450623810	BF	On-Demand	Anodyne	FAAH	18	40
O=C(NC1CC1)N[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450623828	GE	On-Demand	Bother	EPHX2	38	47
O=C(NC1CC1)N[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450623828	GE	On-Demand	Bother	LIPG	50	35
O=C(NC1CC1)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450623830	GE	On-Demand	Bother	EPHX2	38	47
O=C(NC1CC1)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450623830	GE	On-Demand	Bother	LIPG	50	35
CC(C)N1CCCC[C@@H]1CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450623841	GF	On-Demand	Anodyne	DRD4	0	48
CC(C)N1CCCC[C@@H]1CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450623841	GF	On-Demand	Anodyne	KCNQ2	48	35
CC(C)N1CCCC[C@@H]1CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450623841	GF	On-Demand	Anodyne	SLC27A1	40	36
CC(C)N1CCCC[C@H]1CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450623843	GF	On-Demand	Anodyne	DRD4	0	48
CC(C)N1CCCC[C@H]1CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450623843	GF	On-Demand	Anodyne	KCNQ2	48	35
CC(C)N1CCCC[C@H]1CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450623843	GF	On-Demand	Anodyne	SLC27A1	40	36
O=C(Nc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450623844	DI	On-Demand	Anodyne	KCNA3	42	40
O=C(Nc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450623844	DI	On-Demand	Anodyne	HCN1	80	37
O=C(Nc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450623844	DI	On-Demand	Anodyne	HCN4	56	36
O=C(Nc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450623844	DI	On-Demand	Anodyne	KCNK3	71	48
O=C(Nc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450623844	DI	On-Demand	Anodyne	KCNK9	64	48
c1ccc2c3c([nH]c2c1)CN(Cc1cn(CC2CC2)nn1)CC3	ZINC000450623847	DF	On-Demand	Anodyne	DRD5	17	41
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450623852	CH	On-Demand	Anodyne	CPT1A	81	36
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450623852	CH	On-Demand	Anodyne	PREP	67	44
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450623852	CH	On-Demand	Anodyne	SFRP1	62	35
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450623852	CH	On-Demand	Anodyne	ABHD6	0	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450623852	CH	On-Demand	Anodyne	WNT3	59	35
CN1CC[C@](O)(CNC(=O)c2ccccc2-n2cc(Br)cn2)C1	ZINC000450623854	GD	On-Demand	Anodyne	HCN1	68	39
CN1CC[C@](O)(CNC(=O)c2ccccc2-n2cc(Br)cn2)C1	ZINC000450623854	GD	On-Demand	Anodyne	HCN4	53	34
CN1CC[C@@](O)(CNC(=O)c2ccccc2-n2cc(Br)cn2)C1	ZINC000450623857	GD	On-Demand	Anodyne	HCN1	68	39
CN1CC[C@@](O)(CNC(=O)c2ccccc2-n2cc(Br)cn2)C1	ZINC000450623857	GD	On-Demand	Anodyne	HCN4	53	34
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450623861	CH	On-Demand	Anodyne	CPT1A	81	36
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450623861	CH	On-Demand	Anodyne	PREP	67	44
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450623861	CH	On-Demand	Anodyne	SFRP1	62	35
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450623861	CH	On-Demand	Anodyne	ABHD6	0	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450623861	CH	On-Demand	Anodyne	WNT3	59	35
CCC[C@H]1CN(CCN(C)Cc2ccccc2)CCO1	ZINC000450623865	CF	On-Demand	Anodyne	SIGMAR1	20	43
CCC[C@@H]1CN(CCN(C)Cc2ccccc2)CCO1	ZINC000450623867	CF	On-Demand	Anodyne	SIGMAR1	20	43
Cc1cc(C)c(C(=O)N2CCN(c3cccc(C#N)n3)CC2)cc1Br	ZINC000450623881	GG	On-Demand	Mild	FASN	41	39
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450623889	FF	On-Demand	Anodyne	EPHX2	54	45
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450623889	FF	On-Demand	Anodyne	L3MBTL3	53	36
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450623891	FF	On-Demand	Anodyne	EPHX2	54	45
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450623891	FF	On-Demand	Anodyne	L3MBTL3	53	36
COCCOC[C@H](O)CN1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000450623896	ED	On-Demand	Anodyne	COLA	44	33
COCCOC[C@@H](O)CN1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000450623897	ED	On-Demand	Anodyne	COLA	44	33
COCCOC[C@H](O)CN1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000450623898	ED	On-Demand	Anodyne	COLA	44	33
COCCOC[C@@H](O)CN1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000450623899	ED	On-Demand	Anodyne	COLA	44	33
COc1cccc(OCCC(=O)N2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450623902	FE	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)N2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450623902	FE	On-Demand	Anodyne	CCKAR	27	40
COc1cccc(OCCC(=O)N2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450623902	FE	On-Demand	Anodyne	MTNR1B	18	40
COc1cccc(OCCC(=O)N2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450623902	FE	On-Demand	Anodyne	DGAT1	27	40
COc1cccc(OCCC(=O)N2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450623902	FE	On-Demand	Anodyne	SLC27A1	40	42
Cc1cc(Br)cc2c1CN(C(=O)c1ccc(N3CCC3)nc1)CC2	ZINC000450623906	GH	On-Demand	Anodyne	FASN	21	40
CC(C)c1nnc(COc2cccc(C(F)(F)F)c2)s1	ZINC000450623908	DI	On-Demand	Anodyne	PDS	43	39
CN(Cc1ccccc1OC1CC1)[C@@H]1CCNC1=O	ZINC000450623909	CD	On-Demand	Anodyne	ADRA2A	15	41
CN(Cc1ccccc1OC1CC1)[C@H]1CCNC1=O	ZINC000450623910	CD	On-Demand	Anodyne	ADRA2A	15	41
CCOc1ccc2nc(SCc3nnc(C(C)C)s3)[nH]c2c1	ZINC000450623915	EI	On-Demand	Anodyne	CYP2C8	31	47
CCOc1ccc2nc(SCc3nnc(C(C)C)s3)[nH]c2c1	ZINC000450623915	EI	On-Demand	Anodyne	CYP2C19	41	52
COC(=O)c1csc(CN2CCN(c3ccc(F)cc3Cl)CC2)n1	ZINC000450623940	FG	On-Demand	Anodyne	NPY2R	36	48
CCc1cccc(C(=O)N[C@H](CC)CC#N)n1	ZINC000450623949	BE	On-Demand	Mild	PDE5A	24	40
CCc1cccc(C(=O)N[C@@H](CC)CC#N)n1	ZINC000450623951	BE	On-Demand	Mild	PDE5A	24	40
CCOc1ccc2nc(S[C@H](C)c3csnn3)[nH]c2c1	ZINC000450623960	DH	On-Demand	Anodyne	CYP2C19	28	46
CCOc1ccc2nc(S[C@@H](C)c3csnn3)[nH]c2c1	ZINC000450623966	DH	On-Demand	Anodyne	CYP2C19	28	46
CC1=CCN(CCNC(=O)c2ccc(C#N)n2C)CC1	ZINC000450623970	CD	On-Demand	Mild	DRD4	41	32
Clc1ccc(OCCNc2ccnc(N3CCOCC3)n2)cc1Cl	ZINC000450623991	FF	On-Demand	Anodyne	EPHB4	43	38
CC1=CCN(CCNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450623993	FE	On-Demand	Anodyne	DRD4	45	36
CC1=CCN(CCNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450623993	FE	On-Demand	Anodyne	PLD2	56	34
CC1=CCN(CCNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450623993	FE	On-Demand	Anodyne	HPGDS	23	41
CC[C@@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624008	EG	On-Demand	Mild	CTSB	32	40
CC[C@@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624008	EG	On-Demand	Mild	CTSL	28	40
CC[C@@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624008	EG	On-Demand	Mild	CTSS	27	44
CC[C@@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624008	EG	On-Demand	Mild	CTSV	44	44
CC[C@@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624008	EG	On-Demand	Mild	PIN1	20	41
CC[C@@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624008	EG	On-Demand	Mild	CTRB_BOVIN	45	32
CC[C@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624009	EG	On-Demand	Mild	CTSB	32	40
CC[C@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624009	EG	On-Demand	Mild	CTSL	28	40
CC[C@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624009	EG	On-Demand	Mild	CTSS	27	44
CC[C@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624009	EG	On-Demand	Mild	CTSV	44	44
CC[C@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624009	EG	On-Demand	Mild	PIN1	20	41
CC[C@H](CC#N)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450624009	EG	On-Demand	Mild	CTRB_BOVIN	45	32
Cc1ccc(Br)cc1CC(=O)N1CCC(C)(CO)CC1	ZINC000450624016	EF	On-Demand	Anodyne	GPR183	0	41
CC[C@@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624018	EH	On-Demand	Mild	AVPR1B	44	41
CC[C@@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624018	EH	On-Demand	Mild	PDE6D	87	41
CC[C@@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624018	EH	On-Demand	Mild	HDAC8	26	41
CC[C@@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624018	EH	On-Demand	Mild	TACR3	45	36
CC[C@@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624018	EH	On-Demand	Mild	HDAC6	19	41
CC[C@@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624018	EH	On-Demand	Mild	IMDH_CRYPV	39	55
CC[C@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624019	EH	On-Demand	Mild	AVPR1B	44	41
CC[C@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624019	EH	On-Demand	Mild	PDE6D	87	41
CC[C@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624019	EH	On-Demand	Mild	HDAC8	26	41
CC[C@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624019	EH	On-Demand	Mild	TACR3	45	36
CC[C@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624019	EH	On-Demand	Mild	HDAC6	19	41
CC[C@H](CC#N)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450624019	EH	On-Demand	Mild	IMDH_CRYPV	39	55
CC1(O)CC(C(=O)N2CC=C(c3cccc(Br)c3)CC2)C1	ZINC000450624020	FG	On-Demand	Anodyne	ADAM10	40	46
CC1(O)CC(C(=O)N2CC=C(c3cccc(Br)c3)CC2)C1	ZINC000450624020	FG	On-Demand	Anodyne	ADAM33	0	41
CC1(O)CC(C(=O)N2CC=C(c3cccc(Br)c3)CC2)C1	ZINC000450624020	FG	On-Demand	Anodyne	ADAM8	0	41
C[C@H](CCCO)CNc1nn2cc(-c3cccnc3)nc2s1	ZINC000450624035	DE	On-Demand	Anodyne	ROS1	44	37
C[C@@H](CCCO)CNc1nn2cc(-c3cccnc3)nc2s1	ZINC000450624036	DE	On-Demand	Anodyne	ROS1	44	37
CNS(=O)(=O)c1ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000450624041	ED	On-Demand	Bother	BDKRB1	22	40
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450624053	FI	On-Demand	Anodyne	CCKAR	49	36
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ocnc1-c1ccccc1	ZINC000450624054	FI	On-Demand	Anodyne	CCKAR	49	36
C[C@@H](c1cccnc1)N(C)Cc1ccn(CCc2ccccc2)n1	ZINC000450624071	DH	On-Demand	Anodyne	KCNA5	43	35
C[C@H](c1cccnc1)N(C)Cc1ccn(CCc2ccccc2)n1	ZINC000450624072	DH	On-Demand	Anodyne	KCNA5	43	35
CCS(=O)(=O)c1ccc(CN(Cc2ccc(O)c(OC)c2)C2CC2)cc1	ZINC000450624075	GG	On-Demand	Anodyne	SHBG	18	42
CCS(=O)(=O)c1ccc(CN(Cc2ccc(O)c(OC)c2)C2CC2)cc1	ZINC000450624075	GG	On-Demand	Anodyne	CAN2	0	40
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450624081	FG	On-Demand	Anodyne	SLC6A1	50	31
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450624081	FG	On-Demand	Anodyne	FABP4	44	37
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450624081	FG	On-Demand	Anodyne	CCKAR	46	36
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450624082	FG	On-Demand	Anodyne	SLC6A1	50	31
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450624082	FG	On-Demand	Anodyne	FABP4	44	37
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450624082	FG	On-Demand	Anodyne	CCKAR	46	36
CCC(CC)(CNC(=O)CC1(O)CCC1)c1ccc(OC)c(OC)c1	ZINC000450624087	EG	On-Demand	Anodyne	ENPP1	56	32
CC(C)(CO)CCNc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl	ZINC000450624108	GI	On-Demand	Anodyne	CNR1	44	40
CC(C)(CO)CCNc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl	ZINC000450624108	GI	On-Demand	Anodyne	CNR2	20	40
c1ccc2[nH]c(CN3CCN(CC[C@H]4CCOC4)CC3)nc2c1	ZINC000450624116	DE	On-Demand	Anodyne	DRD4	15	52
c1ccc2[nH]c(CN3CCN(CC[C@@H]4CCOC4)CC3)nc2c1	ZINC000450624117	DE	On-Demand	Anodyne	DRD4	15	52
C[C@H](CCCO)CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450624119	ED	On-Demand	Anodyne	NPY1R	41	33
C[C@H](CCCO)CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450624119	ED	On-Demand	Anodyne	NPY2R	47	35
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450624120	ED	On-Demand	Anodyne	NPY1R	41	33
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450624120	ED	On-Demand	Anodyne	NPY2R	47	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](S(C)(=O)=O)C1	ZINC000450624127	EF	On-Demand	Anodyne	CACNA1B	22	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](S(C)(=O)=O)C1	ZINC000450624127	EF	On-Demand	Anodyne	SLC6A9	23	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](S(C)(=O)=O)C1	ZINC000450624128	EF	On-Demand	Anodyne	CACNA1B	22	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](S(C)(=O)=O)C1	ZINC000450624128	EF	On-Demand	Anodyne	SLC6A9	23	42
CCC1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450624132	DF	On-Demand	Anodyne	HCN1	52	32
CCC1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450624132	DF	On-Demand	Anodyne	HCN4	49	32
CCC[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450624135	CF	On-Demand	Anodyne	DRD5	20	52
CCC[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450624135	CF	On-Demand	Anodyne	SSTR4	42	35
CCC[C@@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450624135	CF	On-Demand	Anodyne	HTR5A	19	53
CCC[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450624136	CF	On-Demand	Anodyne	DRD5	20	52
CCC[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450624136	CF	On-Demand	Anodyne	SSTR4	42	35
CCC[C@H](O)CN1CCc2c([nH]c3ccccc23)C1	ZINC000450624136	CF	On-Demand	Anodyne	HTR5A	19	53
c1ccc2c3c([nH]c2c1)CN(Cc1cnns1)CC3	ZINC000450624151	CF	On-Demand	Anodyne	DRD5	18	45
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450624172	DH	On-Demand	Anodyne	OPRK1	38	44
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450624172	DH	On-Demand	Anodyne	COLA	122	42
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450624173	DH	On-Demand	Anodyne	OPRK1	38	44
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450624173	DH	On-Demand	Anodyne	COLA	122	42
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450624173	DH	On-Demand	Anodyne	CPT1A	115	42
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450624173	DH	On-Demand	Anodyne	GRIN2D	46	31
CC[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450624179	DH	On-Demand	Anodyne	NCE103	19	40
CC[C@H](CC(F)(F)F)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450624180	DH	On-Demand	Anodyne	NCE103	19	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	ACE	37	42
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	PPARA	17	41
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	MME	83	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	ANPEP	70	37
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	CTSB	40	37
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	PAPA1_CARPA	62	38
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	CYSP_TRYCR	62	37
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	CTSF	52	37
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	CPA1	28	42
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	SLC15A1	0	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	TIMP3	50	32
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	CAPNS1	47	33
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	CAPN1	46	36
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	CAPN2	63	34
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	ACE2	71	42
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	CTSC	28	44
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	POL	0	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	NPR	28	41
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624183	DG	On-Demand	Anodyne	PDS	40	32
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	ACE	37	42
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	PPARA	17	41
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	MME	83	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	ANPEP	70	37
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	CTSB	40	37
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	PAPA1_CARPA	62	38
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	CYSP_TRYCR	62	37
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	CTSF	52	37
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	CPA1	28	42
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	SLC15A1	0	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	TIMP3	50	32
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	CAPNS1	47	33
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	CAPN1	46	36
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	CAPN2	63	34
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	ACE2	71	42
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	CTSC	28	44
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	POL	0	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	NPR	28	41
CC[C@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624185	DG	On-Demand	Anodyne	PDS	40	32
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	ACE	37	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	PPARA	17	41
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	MME	83	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	ANPEP	70	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	CTSB	40	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	PAPA1_CARPA	62	38
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	CYSP_TRYCR	62	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	CTSF	52	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	CPA1	28	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	SLC15A1	0	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	TIMP3	50	32
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	CAPNS1	47	33
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	CAPN1	46	36
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	CAPN2	63	34
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	ACE2	71	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	CTSC	28	44
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	POL	0	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	NPR	28	41
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450624186	DG	On-Demand	Anodyne	PDS	40	32
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	ACE	37	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	PPARA	17	41
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	MME	83	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	ANPEP	70	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	CTSB	40	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	PAPA1_CARPA	62	38
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	CYSP_TRYCR	62	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	CTSF	52	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	CPA1	28	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	SLC15A1	0	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	TIMP3	50	32
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	CAPNS1	47	33
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	CAPN1	46	36
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	CAPN2	63	34
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	ACE2	71	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	CTSC	28	44
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	POL	0	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	NPR	28	41
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450624188	DG	On-Demand	Anodyne	PDS	40	32
Cc1cccc(Cl)c1C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000450624193	EG	On-Demand	Anodyne	P2RX7	23	44
Cc1cccc(Cl)c1C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000450624193	EG	On-Demand	Anodyne	REN	23	40
Cc1cccc(Cl)c1C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000450624193	EG	On-Demand	Anodyne	SLC27A1	40	40
O=C1CC[C@H](COc2ccc(OCc3ccccc3)cc2)CCN1	ZINC000450624196	EH	On-Demand	Anodyne	MAOB	32	51
O=C1CC[C@H](COc2ccc(OCc3ccccc3)cc2)CCN1	ZINC000450624196	EH	On-Demand	Anodyne	LTA4H	30	41
O=C1CC[C@H](COc2ccc(OCc3ccccc3)cc2)CCN1	ZINC000450624196	EH	On-Demand	Anodyne	GRM1	0	46
CCOc1nc2ccc(C(=O)NC[C@@]3(O)CCN(C)C3)cc2[nH]1	ZINC000450624198	DC	On-Demand	Anodyne	HCN1	53	38
CCOc1nc2ccc(C(=O)NC[C@@]3(O)CCN(C)C3)cc2[nH]1	ZINC000450624198	DC	On-Demand	Anodyne	HCN4	43	33
O=C1CC[C@@H](COc2ccc(OCc3ccccc3)cc2)CCN1	ZINC000450624200	EH	On-Demand	Anodyne	MAOB	32	51
O=C1CC[C@@H](COc2ccc(OCc3ccccc3)cc2)CCN1	ZINC000450624200	EH	On-Demand	Anodyne	LTA4H	30	41
O=C1CC[C@@H](COc2ccc(OCc3ccccc3)cc2)CCN1	ZINC000450624200	EH	On-Demand	Anodyne	GRM1	0	46
COc1cc(CN(C)CCc2ccccn2)ccc1Cl	ZINC000450624202	CG	On-Demand	Anodyne	GRIN1	17	40
CCOc1nc2ccc(C(=O)NC[C@]3(O)CCN(C)C3)cc2[nH]1	ZINC000450624203	DC	On-Demand	Anodyne	HCN1	53	38
CCOc1nc2ccc(C(=O)NC[C@]3(O)CCN(C)C3)cc2[nH]1	ZINC000450624203	DC	On-Demand	Anodyne	HCN4	43	33
CCCc1c(NC(=O)[C@H](Cc2ccccc2)OC)cnn1-c1cc(C)ccn1	ZINC000450624219	GH	On-Demand	Anodyne	GPR142	58	34
CCCc1c(NC(=O)[C@@H](Cc2ccccc2)OC)cnn1-c1cc(C)ccn1	ZINC000450624220	GH	On-Demand	Anodyne	GPR142	58	34
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	DRD2	32	46
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	DRD1	15	51
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	DRD4	24	52
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	HTR2A	37	53
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	HTR2C	20	60
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	ERG2	21	46
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	SIGMAR1	16	56
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	CYP2J2	61	43
O=C(CCCN1CC[C@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624224	DH	On-Demand	Anodyne	WNT3A	45	32
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	DRD2	32	46
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	DRD1	15	51
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	DRD4	24	52
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	HTR2A	37	53
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	HTR2C	20	60
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	ERG2	21	46
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	SIGMAR1	16	56
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	CYP2J2	61	43
O=C(CCCN1CC[C@@H](C2CCOCC2)C1)c1ccc(F)cc1	ZINC000450624225	DH	On-Demand	Anodyne	WNT3A	45	32
CCn1nnc(C)c1COc1ccc(Cl)cc1Cl	ZINC000450624226	CG	On-Demand	Anodyne	S1PR4	26	46
N#Cc1ccc(N2C[C@@H](C(=O)NC3Cc4ccccc4C3)CC2=O)cc1Cl	ZINC000450624230	GF	On-Demand	Mild	AR	15	43
N#Cc1ccc(N2C[C@H](C(=O)NC3Cc4ccccc4C3)CC2=O)cc1Cl	ZINC000450624235	GF	On-Demand	Mild	AR	15	43
O=C(c1cc2ccncc2s1)N1CCCC[C@H]1c1ccccc1	ZINC000450624248	DJ	On-Demand	Anodyne	COLA	115	41
O=C(c1cc2ccncc2s1)N1CCCC[C@H]1c1ccccc1	ZINC000450624248	DJ	On-Demand	Anodyne	CPT1A	109	41
O=C(c1cc2ccncc2s1)N1CCCC[C@H]1c1ccccc1	ZINC000450624248	DJ	On-Demand	Anodyne	GPBAR1	0	40
O=C(c1cc2ccncc2s1)N1CCCC[C@@H]1c1ccccc1	ZINC000450624257	DJ	On-Demand	Anodyne	COLA	115	41
O=C(c1cc2ccncc2s1)N1CCCC[C@@H]1c1ccccc1	ZINC000450624257	DJ	On-Demand	Anodyne	CPT1A	102	41
O=C(c1cc2ccncc2s1)N1CCCC[C@@H]1c1ccccc1	ZINC000450624257	DJ	On-Demand	Anodyne	GPBAR1	0	40
CN(CCc1ccccn1)CCc1c(Cl)cccc1Cl	ZINC000450624263	DI	On-Demand	Anodyne	GNRHR	17	42
CCC1(CNC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CCCCC1	ZINC000450624264	FG	On-Demand	Anodyne	COLA	55	34
CCC1(CNC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CCCCC1	ZINC000450624264	FG	On-Demand	Anodyne	CPT1A	49	33
CCC1(CNC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CCCCC1	ZINC000450624264	FG	On-Demand	Anodyne	CPT1B	41	32
CCC1(CNC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CCCCC1	ZINC000450624264	FG	On-Demand	Anodyne	HCN1	54	35
CCC1(CNC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CCCCC1	ZINC000450624264	FG	On-Demand	Anodyne	HCN4	52	35
Cc1ccn2ncc(C(=O)N3CCN(c4cccc(C#N)n4)CC3)c2c1	ZINC000450624276	ED	On-Demand	Mild	EPHB3	24	41
CC[C@H](CC(F)(F)F)NC(=O)c1ocnc1-c1ccccc1	ZINC000450624278	DH	On-Demand	Anodyne	TACR3	48	34
CC[C@@H](CC(F)(F)F)NC(=O)c1ocnc1-c1ccccc1	ZINC000450624279	DH	On-Demand	Anodyne	TACR3	48	34
N#Cc1cccc(N2CCN(C(=O)c3ccnc(OC(F)F)c3)CC2)n1	ZINC000450624293	FD	On-Demand	Mild	SLC6A7	0	41
FC(F)(F)c1cccc(OCc2nnc(C3CC3)s2)c1	ZINC000450624297	DI	On-Demand	Anodyne	CHRNA10	15	44
FC(F)(F)c1cccc(OCc2nnc(C3CC3)s2)c1	ZINC000450624297	DI	On-Demand	Anodyne	PDS	40	36
CC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450624300	DE	On-Demand	Mild	CTSK	16	40
CC[C@H]1CCC[C@H]1C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450624302	DE	On-Demand	Mild	CTSK	16	40
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3ccc(Cl)cc3)CC1)C2	ZINC000450624304	EG	On-Demand	Anodyne	DRD4	19	41
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3ccc(Cl)cc3)CC1)C2	ZINC000450624304	EG	On-Demand	Anodyne	SLC6A1	59	43
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3ccc(Cl)cc3)CC1)C2	ZINC000450624304	EG	On-Demand	Anodyne	SLC6A3	42	46
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3ccc(Cl)cc3)CC1)C2	ZINC000450624304	EG	On-Demand	Anodyne	CHRNA9	0	42
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3ccc(Cl)cc3)CC1)C2	ZINC000450624304	EG	On-Demand	Anodyne	SIGMAR1	37	46
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3ccc(Cl)cc3)CC1)C2	ZINC000450624304	EG	On-Demand	Anodyne	CACNA1D	44	41
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3ccc(Cl)cc3)CC1)C2	ZINC000450624304	EG	On-Demand	Anodyne	L3MBTL3	38	44
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3ccc(Cl)cc3)CC1)C2	ZINC000450624304	EG	On-Demand	Anodyne	KCNJ1	36	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(Cc2ccncc2)CC1	ZINC000450624305	EE	On-Demand	Anodyne	SLC6A3	19	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(Cc2ccncc2)CC1	ZINC000450624305	EE	On-Demand	Anodyne	SIGMAR1	25	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2ccncc2)CC1	ZINC000450624307	EE	On-Demand	Anodyne	SLC6A3	19	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2ccncc2)CC1	ZINC000450624307	EE	On-Demand	Anodyne	SIGMAR1	25	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2ccncc2)CC1	ZINC000450624308	EE	On-Demand	Anodyne	SLC6A3	19	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2ccncc2)CC1	ZINC000450624308	EE	On-Demand	Anodyne	SIGMAR1	25	44
C[C@H](c1ccccc1)[C@H](O)CN1CCN(Cc2ccncc2)CC1	ZINC000450624309	EE	On-Demand	Anodyne	SLC6A3	19	44
C[C@H](c1ccccc1)[C@H](O)CN1CCN(Cc2ccncc2)CC1	ZINC000450624309	EE	On-Demand	Anodyne	SIGMAR1	25	44
CC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450624310	DE	On-Demand	Mild	CTSK	16	40
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450624312	DE	On-Demand	Mild	CTSK	16	40
COc1cccc(-n2cc(C(=O)NC[C@@]3(O)CCN(C)C3)nn2)c1	ZINC000450624340	EC	On-Demand	Anodyne	DRD4	47	37
COc1cccc(-n2cc(C(=O)NC[C@]3(O)CCN(C)C3)nn2)c1	ZINC000450624344	EC	On-Demand	Anodyne	DRD4	47	37
CC[C@@H](CC#N)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450624349	DH	On-Demand	Mild	GPR88	0	41
Cc1cc(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)ccn1	ZINC000450624350	DF	On-Demand	Anodyne	BDKRB1	26	41
Cc1cc(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)ccn1	ZINC000450624350	DF	On-Demand	Anodyne	L3MBTL3	46	32
CCc1cccc(C(=O)NC[C@@]2(O)CCN(C)C2)n1	ZINC000450624351	CC	On-Demand	Anodyne	HCN1	51	31
CCc1cccc(C(=O)NC[C@@]2(O)CCN(C)C2)n1	ZINC000450624351	CC	On-Demand	Anodyne	HCN4	48	31
CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450624352	EI	On-Demand	Anodyne	SORT1	16	42
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ccccc2)o1	ZINC000450624357	DI	On-Demand	Anodyne	FKBP1A	48	36
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ccccc2)o1	ZINC000450624357	DI	On-Demand	Anodyne	PRCP	16	42
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ccccc2)o1	ZINC000450624357	DI	On-Demand	Anodyne	ADAM17	28	41
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ccccc2)o1	ZINC000450624357	DI	On-Demand	Anodyne	COLA	143	43
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ccccc2)o1	ZINC000450624357	DI	On-Demand	Anodyne	CPT1A	133	43
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ccccc2)o1	ZINC000450624357	DI	On-Demand	Anodyne	CPT2	48	38
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ccccc2)o1	ZINC000450624357	DI	On-Demand	Anodyne	PREP	104	44
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000450624358	FH	On-Demand	Bother	COLA	60	34
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)o1	ZINC000450624359	DI	On-Demand	Anodyne	FKBP1A	48	36
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)o1	ZINC000450624359	DI	On-Demand	Anodyne	PRCP	16	42
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)o1	ZINC000450624359	DI	On-Demand	Anodyne	ADAM17	28	41
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)o1	ZINC000450624359	DI	On-Demand	Anodyne	COLA	143	43
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)o1	ZINC000450624359	DI	On-Demand	Anodyne	CPT1A	133	43
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)o1	ZINC000450624359	DI	On-Demand	Anodyne	CPT2	48	38
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)o1	ZINC000450624359	DI	On-Demand	Anodyne	PREP	104	44
COC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624360	CG	On-Demand	Anodyne	KCNQ1	0	43
COC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624360	CG	On-Demand	Anodyne	SAT1	0	45
COC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624360	CG	On-Demand	Anodyne	MTNR1B	25	46
COC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624360	CG	On-Demand	Anodyne	PLA2G4B	92	44
COC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624360	CG	On-Demand	Anodyne	ACR	50	39
COC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624360	CG	On-Demand	Anodyne	SLC47A1	22	45
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000450624361	FH	On-Demand	Bother	COLA	60	34
CC[C@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450624362	EI	On-Demand	Anodyne	SORT1	16	42
CCc1cccc(C(=O)NC[C@]2(O)CCN(C)C2)n1	ZINC000450624363	CC	On-Demand	Anodyne	HCN1	51	31
CCc1cccc(C(=O)NC[C@]2(O)CCN(C)C2)n1	ZINC000450624363	CC	On-Demand	Anodyne	HCN4	48	31
CC1=CCN(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC000450624366	DF	On-Demand	Anodyne	PLD1	27	44
CC1=CCN(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC000450624366	DF	On-Demand	Anodyne	PLD2	44	44
COc1ccc(CNC(=O)CCN(C)[C@H]2CCSC2)c(OC)c1	ZINC000450624369	EE	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc(CNC(=O)CCN(C)[C@@H]2CCSC2)c(OC)c1	ZINC000450624380	EE	On-Demand	Anodyne	MTNR1A	42	36
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)c1ccccc1[N+](=O)[O-]	ZINC000450624424	CH	On-Demand	Bother	COLA	56	30
O=[N+]([O-])c1ccc(OCC[C@H]2CCOC2)c(Cl)c1	ZINC000450624425	CG	On-Demand	Bother	ENR	0	40
O=[N+]([O-])c1ccc(OCC[C@@H]2CCOC2)c(Cl)c1	ZINC000450624426	CG	On-Demand	Bother	ENR	0	40
N#C[C@@H]1CSCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450624427	EF	On-Demand	Mild	DPP4	22	42
C[C@H](NC(=O)[C@@]1(C)CCC[C@@H]1C)c1ccccc1[N+](=O)[O-]	ZINC000450624428	CH	On-Demand	Bother	COLA	56	30
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)c1ccccc1[N+](=O)[O-]	ZINC000450624429	CH	On-Demand	Bother	COLA	56	30
C[C@H](NC(=O)[C@@]1(C)CCC[C@H]1C)c1ccccc1[N+](=O)[O-]	ZINC000450624430	CH	On-Demand	Bother	COLA	56	30
CCC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450624431	CF	On-Demand	Anodyne	FIMH	16	42
N#C[C@H]1CSCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450624433	EF	On-Demand	Mild	DPP4	22	42
CC[S@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624439	GG	On-Demand	Anodyne	COLA	117	53
CC[S@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624439	GG	On-Demand	Anodyne	CPT1A	113	53
CC[S@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624439	GG	On-Demand	Anodyne	GRM5	0	42
CC[S@@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624440	GG	On-Demand	Anodyne	COLA	117	53
CC[S@@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624440	GG	On-Demand	Anodyne	CPT1A	113	53
CC[S@@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624440	GG	On-Demand	Anodyne	GRM5	0	42
CC[S@@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624441	GG	On-Demand	Anodyne	COLA	117	53
CC[S@@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624441	GG	On-Demand	Anodyne	CPT1A	113	53
CC[S@@](=O)CC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624441	GG	On-Demand	Anodyne	GRM5	0	42
CC[S@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624442	GG	On-Demand	Anodyne	COLA	117	53
CC[S@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624442	GG	On-Demand	Anodyne	CPT1A	113	53
CC[S@](=O)CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450624442	GG	On-Demand	Anodyne	GRM5	0	42
CCC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624447	CH	On-Demand	Anodyne	KCNQ1	0	43
CCC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624447	CH	On-Demand	Anodyne	SAT1	0	45
CCC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624447	CH	On-Demand	Anodyne	PLA2G4B	98	48
CCC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450624447	CH	On-Demand	Anodyne	ACR	34	45
CCOc1ccc2nc(SC[C@H]3COCCO3)[nH]c2c1	ZINC000450624471	CE	On-Demand	Anodyne	CYP2C19	37	45
CCOc1ccc2nc(SC[C@@H]3COCCO3)[nH]c2c1	ZINC000450624473	CE	On-Demand	Anodyne	CYP2C19	37	45
c1cncc([C@H]2CCCN2Cc2ccccc2OC2CC2)c1	ZINC000450624498	CH	On-Demand	Anodyne	CHRNA2	48	49
c1cncc([C@H]2CCCN2Cc2ccccc2OC2CC2)c1	ZINC000450624498	CH	On-Demand	Anodyne	CRTY	0	49
c1cncc([C@@H]2CCCN2Cc2ccccc2OC2CC2)c1	ZINC000450624500	CH	On-Demand	Anodyne	CHRNA2	48	49
c1cncc([C@@H]2CCCN2Cc2ccccc2OC2CC2)c1	ZINC000450624500	CH	On-Demand	Anodyne	CRTY	0	49
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450624501	GG	On-Demand	Anodyne	RBP4	73	39
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450624502	GG	On-Demand	Anodyne	RBP4	73	39
COC(=O)C1(CN2CCC[C@@H]2c2cccnc2)CC1	ZINC000450624508	CE	On-Demand	Anodyne	CHRNA2	49	50
COC(=O)C1(CN2CCC[C@@H]2c2cccnc2)CC1	ZINC000450624508	CE	On-Demand	Anodyne	ACHP_LYMST	22	50
COC(=O)C1(CN2CCC[C@H]2c2cccnc2)CC1	ZINC000450624509	CE	On-Demand	Anodyne	CHRNA2	49	50
COC(=O)C1(CN2CCC[C@H]2c2cccnc2)CC1	ZINC000450624509	CE	On-Demand	Anodyne	ACHP_LYMST	22	50
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450624522	ED	On-Demand	Anodyne	TRPV1	22	57
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450624524	ED	On-Demand	Anodyne	TRPV1	22	57
CC(C)(CO)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450624539	CB	On-Demand	Anodyne	CA2	53	38
CC(C)(CO)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450624539	CB	On-Demand	Anodyne	CYNT	54	37
CNS(=O)(=O)NCC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450624541	DB	On-Demand	Bother	COLA	98	39
CNS(=O)(=O)NCC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450624543	DB	On-Demand	Bother	COLA	98	39
CCC(CC)(CNC(=O)c1cc(C)c(C(N)=O)cn1)c1ccc(OC)c(OC)c1	ZINC000450624552	GF	On-Demand	Anodyne	CSF1R	40	40
O=C(N[C@@H](CCO)C1CCOCC1)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450624557	GF	On-Demand	Anodyne	PRCP	22	48
O=C(N[C@H](CCO)C1CCOCC1)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450624558	GF	On-Demand	Anodyne	PRCP	22	48
C[C@@H](CCCO)CNc1ncccc1OCc1ccccc1	ZINC000450624571	DG	On-Demand	Anodyne	PPIA	54	44
C[C@H](CCCO)CNc1ncccc1OCc1ccccc1	ZINC000450624572	DG	On-Demand	Anodyne	PPIA	54	44
CCc1cccc(C(=O)N2CCN(c3ccccc3)C[C@@H]2CC)n1	ZINC000450624577	DG	On-Demand	Anodyne	CCKAR	72	42
CCc1cccc(C(=O)N2CCN(c3ccccc3)C[C@H]2CC)n1	ZINC000450624578	DG	On-Demand	Anodyne	CCKAR	72	42
CCC(CC)(CNC(=O)C1CC(C)(O)C1)c1ccc(OC)c(OC)c1	ZINC000450624597	EG	On-Demand	Anodyne	CACNA1G	37	43
COC(=O)c1ccc(CN(Cc2ccc(O)c(OC)c2)C2CC2)cc1Cl	ZINC000450624600	GI	On-Demand	Anodyne	NCE103	28	40
COC(=O)c1ccc(CN(Cc2ccc(O)c(OC)c2)C2CC2)cc1Cl	ZINC000450624600	GI	On-Demand	Anodyne	P96878_MYCTU	16	40
COC(=O)c1ccc(CN(Cc2ccc(O)c(OC)c2)C2CC2)cc1Cl	ZINC000450624600	GI	On-Demand	Anodyne	CAN2	0	40
N#CC1(Cn2nnc(-c3cccc(C(F)(F)F)c3)n2)CCC1	ZINC000450624616	DG	On-Demand	Mild	CTSK	0	40
COCCO[C@@H]1CCCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450624622	DE	On-Demand	Anodyne	SLC6A1	42	41
COCCO[C@@H]1CCCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450624623	DE	On-Demand	Anodyne	SLC6A1	42	41
COCCO[C@@H]1CCCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450624624	DE	On-Demand	Anodyne	SLC6A1	42	41
COCCO[C@@H]1CCCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450624625	DE	On-Demand	Anodyne	SLC6A1	42	41
C(=C/c1ccccc1)\CCN1CCN(Cc2ccncc2)CC1	ZINC000450624661	DG	On-Demand	Anodyne	SIGMAR1	37	49
C(=C\c1ccccc1)\CCN1CCN(Cc2ccncc2)CC1	ZINC000450624662	DG	On-Demand	Anodyne	SIGMAR1	37	49
CC(F)(F)CCOc1cccc(C(F)(F)F)c1	ZINC000450624669	CI	On-Demand	Anodyne	CHRNA10	15	48
CC(F)(F)CCOc1cccc(C(F)(F)F)c1	ZINC000450624669	CI	On-Demand	Anodyne	GALR3	70	37
CC(F)(F)CCOc1cccc(C(F)(F)F)c1	ZINC000450624669	CI	On-Demand	Anodyne	PDS	48	47
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450624670	EG	On-Demand	Anodyne	COLA	142	44
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450624670	EG	On-Demand	Anodyne	CPT1A	124	44
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450624670	EG	On-Demand	Anodyne	CPT2	44	36
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450624670	EG	On-Demand	Anodyne	PREP	45	38
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450624671	EG	On-Demand	Anodyne	COLA	142	44
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450624671	EG	On-Demand	Anodyne	CPT1A	124	44
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450624671	EG	On-Demand	Anodyne	CPT2	44	36
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450624671	EG	On-Demand	Anodyne	PREP	45	38
COC(=O)c1csc(CN2CCc3c([nH]c4ccccc34)C2)n1	ZINC000450624686	EF	On-Demand	Anodyne	DRD5	17	40
COC(=O)c1coc(CN2CCc3c([nH]c4ccccc34)C2)n1	ZINC000450624691	DF	On-Demand	Anodyne	DRD5	17	40
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	HTR1A	30	50
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	DRD2	30	50
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	DRD4	44	34
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	ACHE	17	41
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	DRD3	40	38
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	HTR4	18	41
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	PDGFRB	49	40
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	HTR7	38	47
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	SIGMAR1	19	46
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	MTNR1A	45	36
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	SLC9A1	50	31
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	FAAH	15	40
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	CSF1R	21	40
COc1ccc(CNC(=O)CCN2CCN(Cc3ccncc3)CC2)c(OC)c1	ZINC000450624692	GD	On-Demand	Anodyne	ABHD6	0	40
CC(C)c1n[nH]c(CNc2ccc(C(=O)N3CCc4ccccc43)cn2)n1	ZINC000450624705	FG	On-Demand	Anodyne	AVPR2	52	38
FC(F)(F)c1cccc(OC[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450624706	CH	On-Demand	Anodyne	CHRNA10	46	51
FC(F)(F)c1cccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450624707	CH	On-Demand	Anodyne	CHRNA10	46	51
CN(CCCC(=O)c1ccccc1)[C@@H]1CCNC1=O	ZINC000450624717	CD	On-Demand	Anodyne	CYP2J2	49	34
CN(CCCC(=O)c1ccccc1)[C@H]1CCNC1=O	ZINC000450624718	CD	On-Demand	Anodyne	CYP2J2	49	34
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cn1	ZINC000450624720	EJ	On-Demand	Anodyne	COLA	98	40
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cn1	ZINC000450624720	EJ	On-Demand	Anodyne	CPT1A	94	40
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cn1	ZINC000450624720	EJ	On-Demand	Anodyne	SFRP1	118	43
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cn1	ZINC000450624720	EJ	On-Demand	Anodyne	WNT3	84	37
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cn1	ZINC000450624721	EJ	On-Demand	Anodyne	COLA	98	40
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cn1	ZINC000450624721	EJ	On-Demand	Anodyne	CPT1A	94	40
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cn1	ZINC000450624721	EJ	On-Demand	Anodyne	SFRP1	118	43
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cn1	ZINC000450624721	EJ	On-Demand	Anodyne	WNT3	84	37
CC(C)c1n[nH]c(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)n1	ZINC000450624723	FD	On-Demand	Anodyne	NPY1R	42	34
CC(=O)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C(C)(C)C1	ZINC000450624730	FD	On-Demand	Anodyne	EPHX2	24	46
NC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450624733	DG	On-Demand	Anodyne	HTR2A	15	46
NC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450624733	DG	On-Demand	Anodyne	HTR2C	17	43
NC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450624733	DG	On-Demand	Anodyne	CYP2J2	55	39
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450624734	DG	On-Demand	Anodyne	HTR2A	15	46
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450624734	DG	On-Demand	Anodyne	HTR2C	17	43
NC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)c2ccccc21	ZINC000450624734	DG	On-Demand	Anodyne	CYP2J2	55	39
O=C(c1cc2n(n1)CCCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450624736	DH	On-Demand	Anodyne	COLA	84	37
O=C(c1cc2n(n1)CCCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450624736	DH	On-Demand	Anodyne	CPT1A	80	37
O=C(c1cc2n(n1)CCCC2)N1CCCC[C@@H]1c1ccccc1	ZINC000450624736	DH	On-Demand	Anodyne	GRM5	0	46
CCC[C@@H](OC)C(=O)N[C@H](CC)CC#N	ZINC000450624742	BD	On-Demand	Mild	PAPA1_CARPA	20	42
CCC[C@H](OC)C(=O)N[C@@H](CC)CC#N	ZINC000450624743	BD	On-Demand	Mild	PAPA1_CARPA	20	42
CCC[C@@H](OC)C(=O)N[C@@H](CC)CC#N	ZINC000450624744	BD	On-Demand	Mild	PAPA1_CARPA	20	42
CCC[C@H](OC)C(=O)N[C@H](CC)CC#N	ZINC000450624745	BD	On-Demand	Mild	PAPA1_CARPA	20	42
CN1[C@H]2CC[C@H]1CC(N1CCN(CCc3c(Cl)cccc3Cl)CC1)C2	ZINC000450624758	GH	On-Demand	Anodyne	SIGMAR1	23	41
COC(=O)c1ccc(CC(=O)NC[C@@]2(O)CCN(C)C2)cc1	ZINC000450624763	DC	On-Demand	Anodyne	NPFFR1	46	45
COC(=O)c1ccc(CC(=O)NC[C@]2(O)CCN(C)C2)cc1	ZINC000450624764	DC	On-Demand	Anodyne	NPFFR1	46	45
CCSc1cccnc1C(=O)NC[C@@]1(O)CCN(C)C1	ZINC000450624772	CC	On-Demand	Anodyne	HCN1	49	31
CCSc1cccnc1C(=O)NC[C@@]1(O)CCN(C)C1	ZINC000450624772	CC	On-Demand	Anodyne	HCN4	47	31
CCSc1cccnc1C(=O)NC[C@]1(O)CCN(C)C1	ZINC000450624773	CC	On-Demand	Anodyne	HCN1	49	31
CCSc1cccnc1C(=O)NC[C@]1(O)CCN(C)C1	ZINC000450624773	CC	On-Demand	Anodyne	HCN4	47	31
COC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1Cl	ZINC000450624785	EE	On-Demand	Anodyne	DRD4	30	40
COC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1Cl	ZINC000450624785	EE	On-Demand	Anodyne	HTR4	51	34
COC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1Cl	ZINC000450624785	EE	On-Demand	Anodyne	SIGMAR1	32	43
COC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1Cl	ZINC000450624785	EE	On-Demand	Anodyne	SSTR5	62	37
COC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1Cl	ZINC000450624785	EE	On-Demand	Anodyne	CCR3	43	39
COC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1Cl	ZINC000450624785	EE	On-Demand	Anodyne	MCHR1	39	46
CC(C)N(C[C@H]1CCC(F)(F)C1)C[C@@H](O)COc1ccc(CC(N)=O)cc1	ZINC000450624787	GF	On-Demand	Anodyne	GRIN1	27	40
CC(C)N(C[C@@H](O)COc1ccc(CC(N)=O)cc1)C[C@@H]1CCC(F)(F)C1	ZINC000450624788	GF	On-Demand	Anodyne	GRIN1	27	40
CC(C)N(C[C@H](O)COc1ccc(CC(N)=O)cc1)C[C@H]1CCC(F)(F)C1	ZINC000450624789	GF	On-Demand	Anodyne	GRIN1	27	40
CC(C)N(C[C@H](O)COc1ccc(CC(N)=O)cc1)C[C@@H]1CCC(F)(F)C1	ZINC000450624790	GF	On-Demand	Anodyne	GRIN1	27	40
Brc1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450624793	CG	On-Demand	Anodyne	SHC	24	42
Brc1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450624794	CG	On-Demand	Anodyne	SHC	24	42
O=C(NC1Cc2ccccc2C1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450624803	FF	On-Demand	Anodyne	MAPK13	58	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(C)(CO)CC1	ZINC000450624804	EE	On-Demand	Anodyne	GHRHR	70	34
CC(=O)c1ccc2c(c1)CCN(Cc1cnn[nH]1)CC2	ZINC000450624805	CD	On-Demand	Anodyne	NOD2	40	35
O=C1CC[C@H](CN2CC[C@H](Oc3cccc(Cl)c3)C2)CCN1	ZINC000450624807	DF	On-Demand	Anodyne	HRH1	28	41
O=C1CC[C@H](CN2CC[C@H](Oc3cccc(Cl)c3)C2)CCN1	ZINC000450624807	DF	On-Demand	Anodyne	CCR3	22	41
O=C1CC[C@@H](CN2CC[C@H](Oc3cccc(Cl)c3)C2)CCN1	ZINC000450624808	DF	On-Demand	Anodyne	HRH1	28	41
O=C1CC[C@@H](CN2CC[C@H](Oc3cccc(Cl)c3)C2)CCN1	ZINC000450624808	DF	On-Demand	Anodyne	CCR3	22	41
O=C1CC[C@@H](CN2CC[C@@H](Oc3cccc(Cl)c3)C2)CCN1	ZINC000450624809	DF	On-Demand	Anodyne	HRH1	28	41
O=C1CC[C@@H](CN2CC[C@@H](Oc3cccc(Cl)c3)C2)CCN1	ZINC000450624809	DF	On-Demand	Anodyne	CCR3	22	41
O=C1CC[C@H](CN2CC[C@@H](Oc3cccc(Cl)c3)C2)CCN1	ZINC000450624810	DF	On-Demand	Anodyne	HRH1	28	41
O=C1CC[C@H](CN2CC[C@@H](Oc3cccc(Cl)c3)C2)CCN1	ZINC000450624810	DF	On-Demand	Anodyne	CCR3	22	41
CC[C@H](CC#N)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450624826	CF	On-Demand	Mild	CTSL	21	45
CC[C@H](CC#N)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450624826	CF	On-Demand	Mild	CTSS	23	45
CC[C@H](CC#N)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450624826	CF	On-Demand	Mild	CTSV	56	38
CC[C@@H](CC#N)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450624836	CF	On-Demand	Mild	CTSL	21	45
CC[C@@H](CC#N)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450624836	CF	On-Demand	Mild	CTSS	23	45
CC[C@@H](CC#N)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450624836	CF	On-Demand	Mild	CTSV	56	38
CO[C@@H]1CC[C@@H]2OCCN(CCCC(=O)c3ccccc3)[C@H]2C1	ZINC000450624853	DF	On-Demand	Anodyne	CYP2J2	56	40
CO[C@@H]1CC[C@@H]2OCCN(CCCC(=O)c3ccccc3)[C@@H]2C1	ZINC000450624855	DF	On-Demand	Anodyne	CYP2J2	56	40
CO[C@@H]1CC[C@H]2OCCN(CCCC(=O)c3ccccc3)[C@@H]2C1	ZINC000450624856	DF	On-Demand	Anodyne	CYP2J2	56	40
CO[C@@H]1CC[C@H]2OCCN(CCCC(=O)c3ccccc3)[C@H]2C1	ZINC000450624857	DF	On-Demand	Anodyne	CYP2J2	56	40
CC[C@@H](CC#N)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450624865	DH	On-Demand	Mild	RBP4	63	40
CC(=O)CCCCCOc1cccc([N+](=O)[O-])c1	ZINC000450624866	CG	On-Demand	Bother	CACNA1C	51	39
CC(=O)CCCCCOc1cccc([N+](=O)[O-])c1	ZINC000450624866	CG	On-Demand	Bother	CACNA1D	86	43
CC(=O)CCCCCOc1cccc([N+](=O)[O-])c1	ZINC000450624866	CG	On-Demand	Bother	MTNR1B	22	41
CC(=O)CCCCCOc1cccc([N+](=O)[O-])c1	ZINC000450624866	CG	On-Demand	Bother	PLA2G4B	63	40
CC(=O)CCCCCOc1cccc([N+](=O)[O-])c1	ZINC000450624866	CG	On-Demand	Bother	ACR	37	54
CC(=O)CCCCCOc1cccc([N+](=O)[O-])c1	ZINC000450624866	CG	On-Demand	Bother	ATSA	0	43
CC(=O)c1ccc(OCC(=O)CC(C)(C)C2CC2)cc1	ZINC000450624872	CH	On-Demand	Anodyne	PLA2G4B	83	41
CN1CC[C@](O)(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450624883	FD	On-Demand	Anodyne	PYGL	43	34
CN1CC[C@](O)(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450624883	FD	On-Demand	Anodyne	PLD2	42	36
CN1CC[C@@](O)(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450624884	FD	On-Demand	Anodyne	PYGL	43	34
CN1CC[C@@](O)(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450624884	FD	On-Demand	Anodyne	PLD2	42	36
O=C(N1CCN(c2ccc(F)cn2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450624885	GF	On-Demand	Anodyne	SLC27A1	41	41
CN(CCN1CCC(OCCO)CC1)Cc1ccccc1	ZINC000450624889	CD	On-Demand	Anodyne	DRD2	15	48
CN(CCN1CCC(OCCO)CC1)Cc1ccccc1	ZINC000450624889	CD	On-Demand	Anodyne	ACHE	35	44
CN(CCN1CCC(OCCO)CC1)Cc1ccccc1	ZINC000450624889	CD	On-Demand	Anodyne	SLC6A3	18	40
CN(CCN1CCC(OCCO)CC1)Cc1ccccc1	ZINC000450624889	CD	On-Demand	Anodyne	HRH3	19	41
CN(CCN1CCC(OCCO)CC1)Cc1ccccc1	ZINC000450624889	CD	On-Demand	Anodyne	SIGMAR1	74	48
COC(=O)[C@@H](C)NC(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450624898	FD	On-Demand	Bother	TAAR1	19	41
COC(=O)[C@H](C)NC(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450624899	FD	On-Demand	Bother	TAAR1	19	41
Cc1ccc(NC(=O)c2ccc(NCC3=CCOCC3)c([N+](=O)[O-])c2)cc1	ZINC000450624901	FH	On-Demand	Bother	TAAR1	18	44
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	DRD2	39	43
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	DRD1	0	40
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	DRD4	77	43
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	ACHE	21	51
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	HRH1	19	44
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	DRD3	42	41
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	HTR4	22	40
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	SIGMAR1	29	42
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	SSTR5	56	37
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	CCR1	38	41
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	CCR3	33	41
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	FAAH	19	41
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	MCHR1	28	41
COc1cc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)ccc1Cl	ZINC000450624910	GG	On-Demand	Anodyne	CACNA1G	34	48
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	DRD2	34	49
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	DRD1	22	58
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	HTR2A	23	54
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	HTR2C	23	58
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	ERG2	23	49
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	HTR3B	0	49
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	CYP2J2	55	41
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	NET	0	49
CC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450624916	CG	On-Demand	Anodyne	AP2S1	0	49
CC(F)(F)CCOc1cccc(Cl)c1	ZINC000450624921	BH	On-Demand	Anodyne	PDS	43	36
O=C(CN1CCN(C[C@H]2CCC(F)(F)C2)CC1)Nc1ccc(Cl)cc1	ZINC000450624934	FG	On-Demand	Anodyne	ENV	41	31
O=C(CN1CCN(C[C@H]2CCC(F)(F)C2)CC1)Nc1ccc(Cl)cc1	ZINC000450624934	FG	On-Demand	Anodyne	MCHR1	24	40
O=C(CN1CCN(C[C@@H]2CCC(F)(F)C2)CC1)Nc1ccc(Cl)cc1	ZINC000450624936	FG	On-Demand	Anodyne	ENV	41	31
O=C(CN1CCN(C[C@@H]2CCC(F)(F)C2)CC1)Nc1ccc(Cl)cc1	ZINC000450624936	FG	On-Demand	Anodyne	MCHR1	24	40
C[C@@H](c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1)C(F)(F)F	ZINC000450624946	EK	On-Demand	Anodyne	CHRNA2	48	49
C[C@@H](c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1)C(F)(F)F	ZINC000450624946	EK	On-Demand	Anodyne	CRTY	0	49
C[C@H](c1ccc(CN2CCC[C@H]2c2cccnc2)cc1)C(F)(F)F	ZINC000450624947	EK	On-Demand	Anodyne	CHRNA2	48	49
C[C@H](c1ccc(CN2CCC[C@H]2c2cccnc2)cc1)C(F)(F)F	ZINC000450624947	EK	On-Demand	Anodyne	CRTY	0	49
C[C@@H](c1ccc(CN2CCC[C@H]2c2cccnc2)cc1)C(F)(F)F	ZINC000450624948	EK	On-Demand	Anodyne	CHRNA2	48	49
C[C@@H](c1ccc(CN2CCC[C@H]2c2cccnc2)cc1)C(F)(F)F	ZINC000450624948	EK	On-Demand	Anodyne	CRTY	0	49
C[C@H](c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1)C(F)(F)F	ZINC000450624949	EK	On-Demand	Anodyne	CHRNA2	48	49
C[C@H](c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1)C(F)(F)F	ZINC000450624949	EK	On-Demand	Anodyne	CRTY	0	49
CCS(=O)(=O)c1ccc(CN(Cc2cccnc2)C2CC2)cc1	ZINC000450624952	EG	On-Demand	Anodyne	NR1D1	42	37
COc1ccc2c(c1)CCN(Cc1cnn[nH]1)CC2	ZINC000450624963	CD	On-Demand	Anodyne	DRD5	17	47
COc1ccc2c(c1)CCN(Cc1cnn[nH]1)CC2	ZINC000450624963	CD	On-Demand	Anodyne	ABCB1	18	43
CC[C@H]1CN(c2ccccc2)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450624979	FG	On-Demand	Anodyne	OPRK1	29	44
CC[C@H]1CN(c2ccccc2)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450624979	FG	On-Demand	Anodyne	TRPV1	0	42
CC[C@H]1CN(c2ccccc2)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450624979	FG	On-Demand	Anodyne	ITGA4	25	40
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450624980	FG	On-Demand	Anodyne	OPRK1	29	44
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450624980	FG	On-Demand	Anodyne	TRPV1	0	42
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450624980	FG	On-Demand	Anodyne	ITGA4	25	40
C[C@@H](c1cccnc1)N(C)CC1CC(F)(F)C1	ZINC000450625008	BG	On-Demand	Anodyne	KCNA5	53	39
C[C@H](c1cccnc1)N(C)CC1CC(F)(F)C1	ZINC000450625009	BG	On-Demand	Anodyne	KCNA5	53	39
C[C@H](CCCO)CNc1ccnc2cc(Br)ccc12	ZINC000450625013	DH	On-Demand	Anodyne	HRP1_PLAFA	58	37
C[C@H](CCCO)CNc1ccnc2cc(Br)ccc12	ZINC000450625013	DH	On-Demand	Anodyne	HNMT	43	33
C[C@@H](CCCO)CNc1ccnc2cc(Br)ccc12	ZINC000450625015	DH	On-Demand	Anodyne	HRP1_PLAFA	58	37
C[C@@H](CCCO)CNc1ccnc2cc(Br)ccc12	ZINC000450625015	DH	On-Demand	Anodyne	HNMT	43	33
Cc1ccc2c(n1)OCCN2C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450625032	EH	On-Demand	Anodyne	LIPG	50	33
CCC[C@@H](OC)C(=O)Nc1csc(-c2ccncc2)n1	ZINC000450625038	CF	On-Demand	Anodyne	GPR142	32	47
CCC[C@H](OC)C(=O)Nc1csc(-c2ccncc2)n1	ZINC000450625039	CF	On-Demand	Anodyne	GPR142	32	47
CC(C)(CO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450625049	GG	On-Demand	Bother	MTNN	41	34
CC(C)(CO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450625049	GG	On-Demand	Bother	BCL2L1	43	41
CC(C)(CO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450625049	GG	On-Demand	Bother	BCL2	38	41
CC(C)(CO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450625049	GG	On-Demand	Bother	MCL1	0	45
CC(C)(CO)CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450625049	GG	On-Demand	Bother	LIMK2	49	37
CC1CCN(C(=O)c2ccc(NC[C@@H](C)CCCO)nc2)CC1	ZINC000450625071	DE	On-Demand	Anodyne	L3MBTL3	41	31
CC1CCN(C(=O)c2ccc(NC[C@H](C)CCCO)nc2)CC1	ZINC000450625073	DE	On-Demand	Anodyne	L3MBTL3	41	31
C[C@@H](CCCO)CNc1ncnc2ccc(I)cc12	ZINC000450625079	FE	On-Demand	Anodyne	CLK4	55	35
C[C@@H](CCCO)CNc1ncnc2ccc(I)cc12	ZINC000450625079	FE	On-Demand	Anodyne	CD38	28	41
C[C@H](CCCO)CNc1ncnc2ccc(I)cc12	ZINC000450625080	FE	On-Demand	Anodyne	CLK4	55	35
C[C@H](CCCO)CNc1ncnc2ccc(I)cc12	ZINC000450625080	FE	On-Demand	Anodyne	CD38	28	41
C(=C/c1ccccc1)\CCN1CCN(Cc2cccnc2)CC1	ZINC000450625102	DG	On-Demand	Anodyne	DRD4	20	48
C(=C/c1ccccc1)\CCN1CCN(Cc2cccnc2)CC1	ZINC000450625102	DG	On-Demand	Anodyne	SIGMAR1	30	41
C(=C\c1ccccc1)\CCN1CCN(Cc2cccnc2)CC1	ZINC000450625103	DG	On-Demand	Anodyne	DRD4	20	48
C(=C\c1ccccc1)\CCN1CCN(Cc2cccnc2)CC1	ZINC000450625103	DG	On-Demand	Anodyne	SIGMAR1	30	41
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450625105	FF	On-Demand	Anodyne	ACACB	24	41
O=C(c1ccc(F)cc1)c1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450625106	EI	On-Demand	Anodyne	SHC	31	43
O=C(c1ccc(F)cc1)c1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450625106	EI	On-Demand	Anodyne	LSS	18	43
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450625107	FF	On-Demand	Anodyne	ACACB	24	41
O=C(c1ccc(F)cc1)c1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450625115	EI	On-Demand	Anodyne	SHC	31	43
O=C(c1ccc(F)cc1)c1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450625115	EI	On-Demand	Anodyne	LSS	18	43
O=C(c1cc2n(n1)CCCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450625130	DH	On-Demand	Anodyne	COLA	84	37
O=C(c1cc2n(n1)CCCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450625130	DH	On-Demand	Anodyne	CPT1A	80	37
O=C(c1cc2n(n1)CCCC2)N1CCCC[C@H]1c1ccccc1	ZINC000450625130	DH	On-Demand	Anodyne	GRM5	0	46
COCC1(O)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450625132	CE	On-Demand	Anodyne	SIGMAR1	26	40
O=C(c1ccccc1)c1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450625143	DH	On-Demand	Anodyne	SRD5A2	24	41
O=C(c1ccccc1)c1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450625143	DH	On-Demand	Anodyne	SHC	25	44
O=C(c1ccccc1)c1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450625144	DH	On-Demand	Anodyne	SRD5A2	24	41
O=C(c1ccccc1)c1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450625144	DH	On-Demand	Anodyne	SHC	25	44
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@H](C)O)cc2)cc1	ZINC000450625166	GF	On-Demand	Anodyne	CA7	16	45
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@H](C)O)cc2)cc1	ZINC000450625166	GF	On-Demand	Anodyne	MMP13	37	40
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@H](C)O)cc2)cc1	ZINC000450625166	GF	On-Demand	Anodyne	ADAM17	20	40
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@H](C)O)cc2)cc1	ZINC000450625166	GF	On-Demand	Anodyne	MMP3	19	46
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@H](C)O)cc2)cc1	ZINC000450625166	GF	On-Demand	Anodyne	O69638_MYCTO	0	40
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625167	GF	On-Demand	Anodyne	CA7	16	45
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625167	GF	On-Demand	Anodyne	MMP13	37	40
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625167	GF	On-Demand	Anodyne	ADAM17	20	40
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625167	GF	On-Demand	Anodyne	MMP3	19	46
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625167	GF	On-Demand	Anodyne	O69638_MYCTO	0	40
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625168	GF	On-Demand	Anodyne	CA7	16	45
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625168	GF	On-Demand	Anodyne	MMP13	37	40
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625168	GF	On-Demand	Anodyne	ADAM17	20	40
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625168	GF	On-Demand	Anodyne	MMP3	19	46
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccc(OCC[C@@H](C)O)cc2)cc1	ZINC000450625168	GF	On-Demand	Anodyne	O69638_MYCTO	0	40
COc1ccc(C(C)=O)c(OCCC[C@H](C)O)c1	ZINC000450625170	CE	On-Demand	Anodyne	GRM2	23	41
COc1ccc(C(C)=O)c(OCCC[C@H](C)O)c1	ZINC000450625170	CE	On-Demand	Anodyne	MTNR1A	31	43
COc1ccc(C(C)=O)c(OCCC[C@H](C)O)c1	ZINC000450625170	CE	On-Demand	Anodyne	MTNR1B	34	43
COc1ccc(C(C)=O)c(OCCC[C@@H](C)O)c1	ZINC000450625171	CE	On-Demand	Anodyne	GRM2	23	41
COc1ccc(C(C)=O)c(OCCC[C@@H](C)O)c1	ZINC000450625171	CE	On-Demand	Anodyne	MTNR1A	31	43
COc1ccc(C(C)=O)c(OCCC[C@@H](C)O)c1	ZINC000450625171	CE	On-Demand	Anodyne	MTNR1B	34	43
CC(C)(C)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450625182	CH	On-Demand	Anodyne	MAL12	0	41
COC(=O)c1cn([C@@H]2CCCN(C(=O)[C@H](C)OCCc3ccccc3)C2)nn1	ZINC000450625183	GD	On-Demand	Anodyne	PREP	35	40
COC(=O)c1cn([C@@H]2CCCN(C(=O)[C@@H](C)OCCc3ccccc3)C2)nn1	ZINC000450625184	GD	On-Demand	Anodyne	PREP	35	40
COC(=O)c1cn([C@H]2CCCN(C(=O)[C@H](C)OCCc3ccccc3)C2)nn1	ZINC000450625185	GD	On-Demand	Anodyne	PREP	28	40
COC(=O)c1cn([C@H]2CCCN(C(=O)[C@@H](C)OCCc3ccccc3)C2)nn1	ZINC000450625186	GD	On-Demand	Anodyne	PREP	35	40
CC(C)c1n[nH]c(CNc2c(C#N)cnc3c(F)cc(F)cc23)n1	ZINC000450625218	EG	On-Demand	Mild	MAP3K8	58	43
O=C(CCSCc1ccc(Cl)cc1)NC(=O)NCCC(F)(F)F	ZINC000450625223	FH	On-Demand	Anodyne	CACNA2D1	15	42
COc1cc(OC)c2ncnc(NCc3nc(C(C)C)n[nH]3)c2c1	ZINC000450625224	ED	On-Demand	Anodyne	PDE6A	44	33
CC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1	ZINC000450625236	CD	On-Demand	Anodyne	DRD2	15	44
CC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1	ZINC000450625236	CD	On-Demand	Anodyne	ACHE	24	48
CC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1	ZINC000450625236	CD	On-Demand	Anodyne	LTA4H	20	43
CC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1	ZINC000450625236	CD	On-Demand	Anodyne	HRH3	20	44
CC(=O)c1ccc(CN2CCC(OCCO)CC2)cc1	ZINC000450625236	CD	On-Demand	Anodyne	SIGMAR1	47	49
C[C@H](CN1CC[C@@H](Oc2cccc(Cl)c2)C1)S(C)(=O)=O	ZINC000450625247	DE	On-Demand	Anodyne	HRH1	43	39
C[C@@H](CN1CC[C@H](Oc2cccc(Cl)c2)C1)S(C)(=O)=O	ZINC000450625248	DE	On-Demand	Anodyne	HRH1	43	39
C[C@H](CN1CC[C@H](Oc2cccc(Cl)c2)C1)S(C)(=O)=O	ZINC000450625249	DE	On-Demand	Anodyne	HRH1	43	39
C[C@@H](CN1CC[C@@H](Oc2cccc(Cl)c2)C1)S(C)(=O)=O	ZINC000450625250	DE	On-Demand	Anodyne	HRH1	43	39
Fc1ccc(N2CCN(Cc3cn(CC4CC4)nn3)CC2)c(Cl)c1	ZINC000450625252	EF	On-Demand	Anodyne	ADRB1	18	42
Cc1cccc(Cl)c1C(=O)NCCCc1c(C)nn(C)c1C	ZINC000450625254	DG	On-Demand	Anodyne	HTR2A	26	41
Cc1cccc(Cl)c1C(=O)NCCCc1c(C)nn(C)c1C	ZINC000450625254	DG	On-Demand	Anodyne	HTR2C	26	41
Cc1cccc(Cl)c1C(=O)NCCCc1c(C)nn(C)c1C	ZINC000450625254	DG	On-Demand	Anodyne	P2RX7	38	44
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)cc1	ZINC000450625275	GH	On-Demand	Anodyne	HRH3	0	43
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)cc1	ZINC000450625275	GH	On-Demand	Anodyne	AKT2	41	35
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)cc1	ZINC000450625276	GH	On-Demand	Anodyne	HRH3	0	43
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)cc1	ZINC000450625276	GH	On-Demand	Anodyne	AKT2	41	35
Cc1nn(C)cc1COc1ccc([N+](=O)[O-])cc1Cl	ZINC000450625277	CF	On-Demand	Bother	S1PR4	23	41
Cc1nn(C)cc1COc1ccc([N+](=O)[O-])cc1Cl	ZINC000450625277	CF	On-Demand	Bother	ENR	0	41
CCOC(=O)c1cc(C(=O)NCCN2CC=C(C)CC2)[nH]c1C	ZINC000450625278	DD	On-Demand	Anodyne	PLD2	42	36
C/C=C\COc1cccc(CC(=O)N2CCC(C)(CO)CC2)c1	ZINC000450625283	DF	On-Demand	Anodyne	GPR183	0	47
O=[N+]([O-])c1ccc(-c2csc(NCC3=CCOCC3)n2)cc1	ZINC000450625290	DF	On-Demand	Bother	MAOB	18	52
CCOc1ccc2nc(SCCc3cscn3)[nH]c2c1	ZINC000450625294	DH	On-Demand	Anodyne	CYP2C8	28	42
CCOc1ccc2nc(SCCc3cscn3)[nH]c2c1	ZINC000450625294	DH	On-Demand	Anodyne	CYP1A2	15	53
CCOc1ccc2nc(SCCc3cscn3)[nH]c2c1	ZINC000450625294	DH	On-Demand	Anodyne	CYP2C19	39	50
CC1=CCN(CCNC(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450625295	GE	On-Demand	Mild	DRD4	42	33
COC(=O)[C@H]1CCN(CC[C@H](C)O)c2ccccc21	ZINC000450625319	CD	On-Demand	Anodyne	SLC6A1	32	41
COC(=O)[C@@H]1CCN(CC[C@@H](C)O)c2ccccc21	ZINC000450625320	CD	On-Demand	Anodyne	SLC6A1	32	41
COC(=O)[C@@H]1CCN(CC[C@H](C)O)c2ccccc21	ZINC000450625321	CD	On-Demand	Anodyne	SLC6A1	32	41
COC(=O)[C@H]1CCN(CC[C@@H](C)O)c2ccccc21	ZINC000450625322	CD	On-Demand	Anodyne	SLC6A1	32	41
CCS(=O)(=O)c1ccc(CNC2(C(=O)OC)CCCC2)cc1	ZINC000450625324	EE	On-Demand	Anodyne	MMP1	15	42
C[C@@H]1Cc2cccc(C(=O)NC3Cc4ccccc4C3)c2O1	ZINC000450625336	CF	On-Demand	Anodyne	MTTP	40	34
C[C@@H]1Cc2cccc(C(=O)NC3Cc4ccccc4C3)c2O1	ZINC000450625336	CF	On-Demand	Anodyne	NR1H2	0	44
C[C@H]1Cc2cccc(C(=O)NC3Cc4ccccc4C3)c2O1	ZINC000450625337	CF	On-Demand	Anodyne	MTTP	40	34
C[C@H]1Cc2cccc(C(=O)NC3Cc4ccccc4C3)c2O1	ZINC000450625337	CF	On-Demand	Anodyne	NR1H2	0	44
COC(=O)c1csc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)n1	ZINC000450625338	GD	On-Demand	Anodyne	ACOX1	45	35
COC(=O)c1csc(CN2CCN(CC(=O)Nc3ccccc3F)CC2)n1	ZINC000450625338	GD	On-Demand	Anodyne	SLC27A1	40	36
CCOC(=O)c1ccc(CN2CCc3ccc(C(C)=O)cc3CC2)nc1	ZINC000450625340	FG	On-Demand	Anodyne	NOD2	25	42
CC(=O)NC[C@H](CC(=O)N1CC[C@@H](NC(=O)NC2CC2)C1)CC(C)C	ZINC000450625341	FD	On-Demand	Anodyne	EPHX2	20	40
CC(=O)NC[C@H](CC(=O)N1CC[C@H](NC(=O)NC2CC2)C1)CC(C)C	ZINC000450625342	FD	On-Demand	Anodyne	EPHX2	20	40
CC(=O)c1ccc(CN2CC[C@@H](C3CCOCC3)C2)cc1	ZINC000450625377	CG	On-Demand	Anodyne	SIGMAR1	29	40
CC(=O)c1ccc(CN2CC[C@H](C3CCOCC3)C2)cc1	ZINC000450625378	CG	On-Demand	Anodyne	SIGMAR1	29	40
O=C(CC[C@@H]1CCCCO1)COc1cccc([N+](=O)[O-])c1	ZINC000450625401	CF	On-Demand	Bother	COLA	48	44
O=C(CC[C@@H]1CCCCO1)COc1cccc([N+](=O)[O-])c1	ZINC000450625401	CF	On-Demand	Bother	CPT1A	45	44
O=C(CC[C@@H]1CCCCO1)COc1cccc([N+](=O)[O-])c1	ZINC000450625401	CF	On-Demand	Bother	ACR	22	43
O=C(CC[C@H]1CCCCO1)COc1cccc([N+](=O)[O-])c1	ZINC000450625402	CF	On-Demand	Bother	COLA	48	44
O=C(CC[C@H]1CCCCO1)COc1cccc([N+](=O)[O-])c1	ZINC000450625402	CF	On-Demand	Bother	CPT1A	45	44
O=C(CC[C@H]1CCCCO1)COc1cccc([N+](=O)[O-])c1	ZINC000450625402	CF	On-Demand	Bother	ACR	22	43
COc1ccc(CNC(=O)CCN(C)CCc2ncc(C)s2)c(OC)c1	ZINC000450625413	GF	On-Demand	Anodyne	PDGFRB	37	47
COc1ccc(CNC(=O)CCN(C)CCc2ncc(C)s2)c(OC)c1	ZINC000450625413	GF	On-Demand	Anodyne	MTNR1A	40	37
COc1ccc(CNC(=O)CCN(C)CCc2ncc(C)s2)c(OC)c1	ZINC000450625413	GF	On-Demand	Anodyne	CSF1R	15	47
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450625414	GF	On-Demand	Anodyne	KCNQ2	55	35
C[C@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450625414	GF	On-Demand	Anodyne	ACOX1	51	38
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450625415	GF	On-Demand	Anodyne	KCNQ2	55	35
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450625415	GF	On-Demand	Anodyne	ACOX1	51	38
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450625416	GF	On-Demand	Anodyne	KCNQ2	55	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450625416	GF	On-Demand	Anodyne	ACOX1	51	38
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450625417	GF	On-Demand	Anodyne	KCNQ2	55	35
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000450625417	GF	On-Demand	Anodyne	ACOX1	51	38
O=C(CN1CCN(Cc2cn(CC3CC3)nn2)CC1)Nc1ccccc1F	ZINC000450625418	FD	On-Demand	Anodyne	DRD4	19	47
COc1ccc2c(c1)CCN([C@H](C)c1csnn1)CC2	ZINC000450625436	CF	On-Demand	Anodyne	DRD5	17	45
COc1ccc2c(c1)CCN([C@@H](C)c1csnn1)CC2	ZINC000450625437	CF	On-Demand	Anodyne	DRD5	17	45
CC[C@H](CC(F)(F)F)C(=O)Nc1csc(-c2ccncc2)n1	ZINC000450625439	EI	On-Demand	Anodyne	GPR142	20	46
CC[C@@H](CC(F)(F)F)C(=O)Nc1csc(-c2ccncc2)n1	ZINC000450625440	EI	On-Demand	Anodyne	GPR142	20	46
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)c1ccccc1[N+](=O)[O-]	ZINC000450625442	DF	On-Demand	Bother	SDH1	0	42
C[C@H](NC(=O)C1(C)CCC(=O)CC1)c1ccccc1[N+](=O)[O-]	ZINC000450625443	DF	On-Demand	Bother	SDH1	0	42
COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCc1nc(C2CC2)n[nH]1	ZINC000450625453	FF	On-Demand	Bother	CACNA1D	62	35
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2ccccc2)on1	ZINC000450625457	EG	On-Demand	Anodyne	COLA	131	48
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2ccccc2)on1	ZINC000450625457	EG	On-Demand	Anodyne	CPT1A	111	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2ccccc2)on1	ZINC000450625457	EG	On-Demand	Anodyne	PREP	28	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2ccccc2)on1	ZINC000450625457	EG	On-Demand	Anodyne	GRM5	0	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2ccccc2)on1	ZINC000450625457	EG	On-Demand	Anodyne	ABHD6	0	43
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)on1	ZINC000450625458	EG	On-Demand	Anodyne	COLA	131	48
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)on1	ZINC000450625458	EG	On-Demand	Anodyne	CPT1A	111	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)on1	ZINC000450625458	EG	On-Demand	Anodyne	PREP	28	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)on1	ZINC000450625458	EG	On-Demand	Anodyne	GRM5	0	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)on1	ZINC000450625458	EG	On-Demand	Anodyne	ABHD6	0	43
C[C@@H](c1csnn1)N1CCc2c([nH]c3ccccc23)C1	ZINC000450625461	CG	On-Demand	Anodyne	DRD5	18	40
C[C@H](c1csnn1)N1CCc2c([nH]c3ccccc23)C1	ZINC000450625462	CG	On-Demand	Anodyne	DRD5	18	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	F2	66	49
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	PRSS1	19	41
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	ACE	35	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	FKBP1A	43	43
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	OPRM1	20	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	CELA1	32	42
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	ELANE	59	44
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	CMA1	43	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	CTRA_BOVIN	25	42
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	TRY1_BOVIN	58	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	COLA	29	42
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	DPP4	24	44
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	PREP	110	43
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	CFTR	43	33
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	XIAP	40	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	RHODESAIN	0	46
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	FAP	0	43
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	SFRP1	87	41
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	WNT3	69	41
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	BRCA1	51	31
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625465	GD	On-Demand	Anodyne	TMPRSS11D	69	43
O=C(c1ccccc1)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450625466	CH	On-Demand	Anodyne	GRIN2B	17	46
O=C(c1ccccc1)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450625466	CH	On-Demand	Anodyne	LSS	23	40
O=C(c1ccccc1)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450625466	CH	On-Demand	Anodyne	ADIPOR1	0	42
O=C(c1ccccc1)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450625466	CH	On-Demand	Anodyne	ADIPOR2	0	42
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	F2	66	49
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	PRSS1	19	41
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	ACE	35	40
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	FKBP1A	43	43
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	OPRM1	20	40
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	CELA1	32	42
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	ELANE	59	44
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	CMA1	43	40
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	CTRA_BOVIN	25	42
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	TRY1_BOVIN	58	40
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	COLA	29	42
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	DPP4	24	44
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	PREP	110	43
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	CFTR	43	33
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	XIAP	40	40
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	RHODESAIN	0	46
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	FAP	0	43
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	SFRP1	87	41
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	WNT3	69	41
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	BRCA1	51	31
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450625467	GD	On-Demand	Anodyne	TMPRSS11D	69	43
O=C(c1ccccc1)c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450625472	CH	On-Demand	Anodyne	LSS	22	40
O=C(c1ccccc1)c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450625472	CH	On-Demand	Anodyne	ADIPOR1	0	42
O=C(c1ccccc1)c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450625472	CH	On-Demand	Anodyne	ADIPOR2	0	42
Cc1c(C(=O)N2CCCC[C@H]2c2ccccc2)nn2c1OCCC2	ZINC000450625475	EG	On-Demand	Anodyne	COLA	52	34
Cc1c(C(=O)N2CCCC[C@H]2c2ccccc2)nn2c1OCCC2	ZINC000450625475	EG	On-Demand	Anodyne	CPT1A	48	34
Cc1c(C(=O)N2CCCC[C@@H]2c2ccccc2)nn2c1OCCC2	ZINC000450625476	EG	On-Demand	Anodyne	COLA	52	34
Cc1c(C(=O)N2CCCC[C@@H]2c2ccccc2)nn2c1OCCC2	ZINC000450625476	EG	On-Demand	Anodyne	CPT1A	48	34
COc1ccc2c(c1)CCN(C[C@](C)(O)C(C)=O)CC2	ZINC000450625486	CD	On-Demand	Anodyne	DRD4	40	30
Cc1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)nn1C(C)C	ZINC000450625488	DI	On-Demand	Anodyne	ADAM17	33	40
Cc1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)nn1C(C)C	ZINC000450625488	DI	On-Demand	Anodyne	COLA	110	37
Cc1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)nn1C(C)C	ZINC000450625488	DI	On-Demand	Anodyne	CPT1A	96	37
COc1ccc2c(c1)CCN(C[C@@](C)(O)C(C)=O)CC2	ZINC000450625489	CD	On-Demand	Anodyne	DRD4	40	30
Cc1cc(C(=O)N2CCCC[C@H]2c2ccccc2)nn1C(C)C	ZINC000450625493	DI	On-Demand	Anodyne	ADAM17	33	40
Cc1cc(C(=O)N2CCCC[C@H]2c2ccccc2)nn1C(C)C	ZINC000450625493	DI	On-Demand	Anodyne	COLA	110	37
Cc1cc(C(=O)N2CCCC[C@H]2c2ccccc2)nn1C(C)C	ZINC000450625493	DI	On-Demand	Anodyne	CPT1A	96	37
Cc1ccnc(-c2noc(CN3CCCC[C@H]3C(=O)OC(C)(C)C)n2)c1	ZINC000450625496	FG	On-Demand	Anodyne	COLA	54	41
Cc1ccnc(-c2noc(CN3CCCC[C@H]3C(=O)OC(C)(C)C)n2)c1	ZINC000450625496	FG	On-Demand	Anodyne	CPT1A	46	41
Cc1ccnc(-c2noc(CN3CCCC[C@@H]3C(=O)OC(C)(C)C)n2)c1	ZINC000450625499	FG	On-Demand	Anodyne	COLA	54	41
Cc1ccnc(-c2noc(CN3CCCC[C@@H]3C(=O)OC(C)(C)C)n2)c1	ZINC000450625499	FG	On-Demand	Anodyne	CPT1A	46	41
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	FKBP1A	56	39
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	OPRM1	0	42
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	OPRK1	28	44
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	SLC6A3	15	42
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	SIGMAR1	19	44
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	CCR5	20	47
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	ADAM17	36	41
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	COLA	133	53
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	CPT1A	125	53
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	CPT2	42	34
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	PREP	65	37
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2ccccc2)cc1	ZINC000450625500	EH	On-Demand	Anodyne	TMPRSS11D	53	33
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450625501	EH	On-Demand	Anodyne	CCKAR	60	39
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450625502	EH	On-Demand	Anodyne	CCKAR	60	39
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	FKBP1A	56	39
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	OPRM1	0	42
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	OPRK1	28	44
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	SLC6A3	15	42
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	SIGMAR1	19	44
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	CCR5	20	47
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	ADAM17	36	41
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	COLA	133	53
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	CPT1A	125	53
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	CPT2	42	34
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	PREP	65	37
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450625505	EH	On-Demand	Anodyne	TMPRSS11D	53	33
CCOC(=O)c1cc(C(=O)N2CCN(c3ccccc3)C[C@@H]2CC)on1	ZINC000450625508	FF	On-Demand	Anodyne	P2RY12	58	34
CCOC(=O)c1cc(C(=O)N2CCN(c3ccccc3)C[C@@H]2CC)on1	ZINC000450625508	FF	On-Demand	Anodyne	CCKAR	69	40
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	FOLH1	23	40
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	KCNA3	41	39
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	HDAC1	18	43
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	HDAC3	15	41
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	HDAC5	16	41
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	HDAC6	15	41
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	ABCB1	22	40
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	HDAC11	15	41
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	HCN1	72	34
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	HCN4	49	32
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	PFHDAC1	0	41
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	KCNK3	89	50
CC(=O)CCCCCOc1ccccc1C(=O)Nc1ccccc1	ZINC000450625510	EI	On-Demand	Anodyne	KCNK9	77	50
CCOC(=O)c1cc(C(=O)N2CCN(c3ccccc3)C[C@H]2CC)on1	ZINC000450625512	FF	On-Demand	Anodyne	P2RY12	58	34
CCOC(=O)c1cc(C(=O)N2CCN(c3ccccc3)C[C@H]2CC)on1	ZINC000450625512	FF	On-Demand	Anodyne	CCKAR	69	40
CCCc1cc(O)nc(SCc2ccc(C(=O)OCC)cn2)n1	ZINC000450625515	EF	On-Demand	Anodyne	CA7	19	49
CCCc1cc(O)nc(SCc2ccc(C(=O)OCC)cn2)n1	ZINC000450625515	EF	On-Demand	Anodyne	CA13	25	51
O=C(N[C@@H](CCO)C1CCOCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450625517	GE	On-Demand	Anodyne	TRPC6	54	34
O=C(N[C@@H](CCO)C1CCOCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450625517	GE	On-Demand	Anodyne	TRPC3	48	34
O=C(N[C@H](CCO)C1CCOCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450625518	GE	On-Demand	Anodyne	TRPC6	54	34
O=C(N[C@H](CCO)C1CCOCC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450625518	GE	On-Demand	Anodyne	TRPC3	48	34
C[C@@H](O)CCCOc1ccc(C(=O)c2ccc(F)cc2)cc1	ZINC000450625530	DH	On-Demand	Anodyne	PLA2G4B	58	37
COc1ccc(CNC(=O)CCN(Cc2cccnc2)C(C)C)c(OC)c1	ZINC000450625532	FG	On-Demand	Anodyne	BMP1	29	45
COc1ccc(CNC(=O)CCN(Cc2cccnc2)C(C)C)c(OC)c1	ZINC000450625532	FG	On-Demand	Anodyne	MMP13	18	43
COc1ccc(CNC(=O)CCN(Cc2cccnc2)C(C)C)c(OC)c1	ZINC000450625532	FG	On-Demand	Anodyne	MTNR1A	32	42
COc1ccc(CNC(=O)CCN(Cc2cccnc2)C(C)C)c(OC)c1	ZINC000450625532	FG	On-Demand	Anodyne	MMP9	15	43
C[C@H](O)CCCOc1ccc(C(=O)c2ccc(F)cc2)cc1	ZINC000450625534	DH	On-Demand	Anodyne	PLA2G4B	58	37
CCOC(=O)c1cc(NCc2nc(C3CC3)n[nH]2)ncc1Cl	ZINC000450625540	DF	On-Demand	Anodyne	CACNA1C	65	35
CCC(CC)(CNC(=O)C[C@@H]1CCOC[C@@H]1OC)c1ccc(OC)c(OC)c1	ZINC000450625571	GG	On-Demand	Anodyne	PDEC	0	41
CCn1nnc(C)c1COc1cccc(C(F)(F)F)c1	ZINC000450625578	CG	On-Demand	Anodyne	PDS	45	36
CCC(CC)(CNC(=O)C[C@@H]1CCOC[C@H]1OC)c1ccc(OC)c(OC)c1	ZINC000450625579	GG	On-Demand	Anodyne	PDEC	0	41
CCC(CC)(CNC(=O)C[C@H]1CCOC[C@H]1OC)c1ccc(OC)c(OC)c1	ZINC000450625582	GG	On-Demand	Anodyne	PDEC	0	41
CCC(CC)(CNC(=O)C[C@H]1CCOC[C@@H]1OC)c1ccc(OC)c(OC)c1	ZINC000450625586	GG	On-Demand	Anodyne	PDEC	0	41
O=C(CCSc1ccccn1)NC(=O)NCCC(F)(F)F	ZINC000450625590	DE	On-Demand	Anodyne	FAS	19	43
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450625616	GG	On-Demand	Anodyne	CCKAR	50	37
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450625616	GG	On-Demand	Anodyne	THYX_PBCV1	0	42
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450625619	GG	On-Demand	Anodyne	CCKAR	50	37
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450625619	GG	On-Demand	Anodyne	THYX_PBCV1	0	42
CC1=C(C(=O)Nc2cnn(CC(=O)NCCO)c2)CCC(C)(C)C1	ZINC000450625620	ED	On-Demand	Anodyne	PANC	49	31
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC[C@H](C)O	ZINC000450625628	GJ	On-Demand	Anodyne	PYGL	37	40
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC[C@H](C)O	ZINC000450625628	GJ	On-Demand	Anodyne	PYGM	20	40
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC[C@H](C)O	ZINC000450625628	GJ	On-Demand	Anodyne	KCNMA1	19	45
CC(C)(CO)CCNc1ccnc2cc(Br)ccc12	ZINC000450625631	DH	On-Demand	Anodyne	HRP1_PLAFA	95	35
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC[C@@H](C)O	ZINC000450625636	GJ	On-Demand	Anodyne	PYGL	37	40
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC[C@@H](C)O	ZINC000450625636	GJ	On-Demand	Anodyne	PYGM	20	40
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC[C@@H](C)O	ZINC000450625636	GJ	On-Demand	Anodyne	KCNMA1	19	45
CCS(=O)(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450625638	FH	On-Demand	Anodyne	DRD5	19	48
CCS(=O)(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)cc1	ZINC000450625638	FH	On-Demand	Anodyne	HTR5A	15	49
CCc1cc(CCCN2CCc3c([nH]c4ccccc34)C2)on1	ZINC000450625640	DH	On-Demand	Anodyne	DRD5	21	44
CCc1cc(CCCN2CCc3c([nH]c4ccccc34)C2)on1	ZINC000450625640	DH	On-Demand	Anodyne	HTR5A	35	54
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450625643	CH	On-Demand	Anodyne	CCR5	28	42
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450625643	CH	On-Demand	Anodyne	CPT1A	102	36
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450625643	CH	On-Demand	Anodyne	PREP	93	40
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450625643	CH	On-Demand	Anodyne	ABHD11	0	40
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450625644	CH	On-Demand	Anodyne	CCR5	28	42
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450625644	CH	On-Demand	Anodyne	CPT1A	102	36
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450625644	CH	On-Demand	Anodyne	PREP	93	40
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450625644	CH	On-Demand	Anodyne	ABHD11	0	40
CCC(CC)(CNC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(OC)c1	ZINC000450625656	GH	On-Demand	Anodyne	TRPV1	45	54
CCC(CC)(CNC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(OC)c1	ZINC000450625656	GH	On-Demand	Anodyne	MT-ND1	25	40
CCC(CC)(CNC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(OC)c1	ZINC000450625656	GH	On-Demand	Anodyne	NCE103	28	47
CCC(CC)(CNC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(OC)c1	ZINC000450625656	GH	On-Demand	Anodyne	P96878_MYCTU	17	47
CCC(CC)(CNC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(OC)c1	ZINC000450625656	GH	On-Demand	Anodyne	CAN2	0	47
c1ccc2c3c([nH]c2c1)CN(Cc1nnc(C2CC2)s1)CC3	ZINC000450625658	DG	On-Demand	Anodyne	DRD5	17	42
COc1cccc(-n2cc(C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)nn2)c1	ZINC000450625663	GD	On-Demand	Anodyne	DRD4	43	32
COc1cccc(-n2cc(C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)nn2)c1	ZINC000450625663	GD	On-Demand	Anodyne	ESRRA	20	42
COc1cccc(-n2cc(C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)nn2)c1	ZINC000450625665	GD	On-Demand	Anodyne	DRD4	43	32
COc1cccc(-n2cc(C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)nn2)c1	ZINC000450625665	GD	On-Demand	Anodyne	ESRRA	20	42
C[C@@H](c1ccc(CN(C)CCc2ccccn2)cc1)C(F)(F)F	ZINC000450625674	DI	On-Demand	Anodyne	GNRHR	24	42
C[C@H](c1ccc(CN(C)CCc2ccccn2)cc1)C(F)(F)F	ZINC000450625676	DI	On-Demand	Anodyne	GNRHR	24	42
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cn(C)nc1COC	ZINC000450625687	EE	On-Demand	Anodyne	CCKAR	49	36
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cn(C)nc1COC	ZINC000450625689	EE	On-Demand	Anodyne	CCKAR	49	36
O=C(N[C@H](CCO)C1CCOCC1)c1cc2ccncc2s1	ZINC000450625697	DE	On-Demand	Anodyne	NAMPT	19	46
O=C(N[C@@H](CCO)C1CCOCC1)c1cc2ccncc2s1	ZINC000450625698	DE	On-Demand	Anodyne	NAMPT	19	46
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450625718	DC	On-Demand	Anodyne	PANC	40	30
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450625719	DC	On-Demand	Anodyne	PANC	40	30
C[C@H]1CCC[C@]1(C)C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450625720	DC	On-Demand	Anodyne	PANC	40	30
C[C@H]1CCC[C@@]1(C)C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450625721	DC	On-Demand	Anodyne	PANC	40	30
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450625725	GF	On-Demand	Anodyne	CCKAR	54	36
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450625726	GF	On-Demand	Anodyne	CCKAR	54	36
CC(F)(F)CCOc1ccc([N+](=O)[O-])cc1Cl	ZINC000450625730	CH	On-Demand	Bother	ENR	0	45
O=C([C@@H](O)C1CCC1)N1CCN(c2ccc(F)cn2)CC1	ZINC000450625731	CD	On-Demand	Anodyne	NPBWR1	50	38
O=C([C@@H](O)C1CCC1)N1CCN(c2ccc(F)cn2)CC1	ZINC000450625731	CD	On-Demand	Anodyne	SLC27A1	43	42
O=C([C@H](O)C1CCC1)N1CCN(c2ccc(F)cn2)CC1	ZINC000450625732	CD	On-Demand	Anodyne	NPBWR1	50	38
O=C([C@H](O)C1CCC1)N1CCN(c2ccc(F)cn2)CC1	ZINC000450625732	CD	On-Demand	Anodyne	SLC27A1	43	42
CN1CC[C@@](O)(CNC(=O)c2cncc(Cl)c2)C1	ZINC000450625751	CC	On-Demand	Anodyne	CACNA1H	20	48
CN1CC[C@@](O)(CNC(=O)c2cncc(Cl)c2)C1	ZINC000450625751	CC	On-Demand	Anodyne	CACNA1I	50	33
CN1CC[C@](O)(CNC(=O)c2cncc(Cl)c2)C1	ZINC000450625752	CC	On-Demand	Anodyne	CACNA1H	20	48
CN1CC[C@](O)(CNC(=O)c2cncc(Cl)c2)C1	ZINC000450625752	CC	On-Demand	Anodyne	CACNA1I	50	33
CC(C)N(C[C@H](O)COc1ccc(CC(N)=O)cc1)C[C@H]1CCCCC1(F)F	ZINC000450625753	GF	On-Demand	Anodyne	ADRB1	15	49
CC(C)N(C[C@@H](O)COc1ccc(CC(N)=O)cc1)C[C@H]1CCCCC1(F)F	ZINC000450625754	GF	On-Demand	Anodyne	ADRB1	15	49
CC(C)N(C[C@H](O)COc1ccc(CC(N)=O)cc1)C[C@@H]1CCCCC1(F)F	ZINC000450625755	GF	On-Demand	Anodyne	ADRB1	15	49
CC(C)N(C[C@@H]1CCCCC1(F)F)C[C@@H](O)COc1ccc(CC(N)=O)cc1	ZINC000450625756	GF	On-Demand	Anodyne	ADRB1	15	49
CCOc1ccc2nc(SCC3(C#N)CCC3)[nH]c2c1	ZINC000450625758	CH	On-Demand	Mild	CYP2C8	27	40
CCOc1ccc2nc(SCC3(C#N)CCC3)[nH]c2c1	ZINC000450625758	CH	On-Demand	Mild	CYP2C19	37	46
CCOc1ccc2nc(S[C@H](C)C(=O)Nc3nccs3)[nH]c2c1	ZINC000450625761	EH	On-Demand	Anodyne	MAP1	80	35
CCOc1ccc2nc(S[C@H](C)C(=O)Nc3nccs3)[nH]c2c1	ZINC000450625761	EH	On-Demand	Anodyne	CYP2C19	25	41
CCOc1ccc2nc(S[C@@H](C)C(=O)Nc3nccs3)[nH]c2c1	ZINC000450625762	EH	On-Demand	Anodyne	MAP1	80	35
CCOc1ccc2nc(S[C@@H](C)C(=O)Nc3nccs3)[nH]c2c1	ZINC000450625762	EH	On-Demand	Anodyne	CYP2C19	25	41
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1O	ZINC000450625763	DD	On-Demand	Anodyne	DRD4	43	34
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1O	ZINC000450625763	DD	On-Demand	Anodyne	DRD3	25	42
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1O	ZINC000450625763	DD	On-Demand	Anodyne	TRPV1	37	55
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1O	ZINC000450625763	DD	On-Demand	Anodyne	NCE103	33	47
O=[N+]([O-])c1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450625764	CE	On-Demand	Bother	ACR	19	45
O=[N+]([O-])c1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450625764	CE	On-Demand	Bother	FIMH	16	41
CC[C@@H](CC#N)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450625770	EE	On-Demand	Mild	RORC	46	34
CC[C@H](CC#N)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450625771	EE	On-Demand	Mild	RORC	46	34
O=C(NC1Cc2ccccc2C1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450625780	DH	On-Demand	Anodyne	CHRNA7	0	41
O=C(NC1Cc2ccccc2C1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450625781	DH	On-Demand	Anodyne	CHRNA7	0	41
O=C(NC1Cc2ccccc2C1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450625782	DH	On-Demand	Anodyne	CHRNA7	0	41
O=C(NC1Cc2ccccc2C1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450625783	DH	On-Demand	Anodyne	CHRNA7	0	41
Cc1ccc(NC(=O)N2CCN(CC3CC(F)(F)C3)CC2)cc1Cl	ZINC000450625797	FH	On-Demand	Anodyne	CACNA1H	40	41
Cc1ccc(NC(=O)N2CCN(CC3CC(F)(F)C3)CC2)cc1Cl	ZINC000450625797	FH	On-Demand	Anodyne	PYGL	0	43
Cc1ccc(NC(=O)N2CCN(CC3CC(F)(F)C3)CC2)cc1Cl	ZINC000450625797	FH	On-Demand	Anodyne	CCR2	16	64
Cc1ccc(NC(=O)N2CCN(CC3CC(F)(F)C3)CC2)cc1Cl	ZINC000450625797	FH	On-Demand	Anodyne	EPHX2	28	40
Cc1ccc(NC(=O)N2CCN(CC3CC(F)(F)C3)CC2)cc1Cl	ZINC000450625797	FH	On-Demand	Anodyne	ENV	44	35
CCOC(=O)c1cc(C(=O)NC2Cc3ccccc3C2)[nH]c1C	ZINC000450625800	DE	On-Demand	Anodyne	PYGL	49	34
CCOC(=O)c1cc(C(=O)NC2Cc3ccccc3C2)[nH]c1C	ZINC000450625800	DE	On-Demand	Anodyne	ADAM9	67	36
C=C[C@@H]1OCC[C@H]1C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450625809	FH	On-Demand	Mild	ADAM10	33	40
COC(=O)c1ccc(CC(=O)NCCN2CC=C(C)CC2)cc1	ZINC000450625813	DD	On-Demand	Anodyne	DRD4	43	34
COC(=O)c1ccc(CC(=O)NCCN2CC=C(C)CC2)cc1	ZINC000450625813	DD	On-Demand	Anodyne	NOD2	41	38
COC(=O)[C@@H]1CCCC[C@]1(C)NC[C@@H](Cc1ccccc1)OC	ZINC000450625815	DF	On-Demand	Anodyne	TIMP3	57	37
COC(=O)[C@@H]1CCCC[C@@]1(C)NC[C@H](Cc1ccccc1)OC	ZINC000450625816	DF	On-Demand	Anodyne	TIMP3	57	37
COC(=O)[C@@H]1CCCC[C@]1(C)NC[C@H](Cc1ccccc1)OC	ZINC000450625817	DF	On-Demand	Anodyne	TIMP3	57	37
COC(=O)[C@@H]1CCCC[C@@]1(C)NC[C@@H](Cc1ccccc1)OC	ZINC000450625818	DF	On-Demand	Anodyne	TIMP3	57	37
COc1ccc(CNC(=O)CCN2CCC(OCCO)CC2)c(OC)c1	ZINC000450625827	FD	On-Demand	Anodyne	HTR1A	19	40
COc1ccc(CNC(=O)CCN2CCC(OCCO)CC2)c(OC)c1	ZINC000450625827	FD	On-Demand	Anodyne	DRD2	18	40
COc1ccc(CNC(=O)CCN2CCC(OCCO)CC2)c(OC)c1	ZINC000450625827	FD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC(OCCO)CC2)c(OC)c1	ZINC000450625827	FD	On-Demand	Anodyne	HTR4	40	37
COc1ccc(CNC(=O)CCN2CCC(OCCO)CC2)c(OC)c1	ZINC000450625827	FD	On-Demand	Anodyne	HTR7	32	43
COc1ccc(CNC(=O)CCN2CCC(OCCO)CC2)c(OC)c1	ZINC000450625827	FD	On-Demand	Anodyne	SIGMAR1	16	43
COc1ccc(CNC(=O)CCN2CCC(OCCO)CC2)c(OC)c1	ZINC000450625827	FD	On-Demand	Anodyne	MTNR1A	53	36
COc1ccc(CNC(=O)CCN2CCC(OCCO)CC2)c(OC)c1	ZINC000450625827	FD	On-Demand	Anodyne	MTNR1B	43	36
CCCCN(CCCO)C(=O)c1c(C)cccc1Cl	ZINC000450625828	CG	On-Demand	Anodyne	TSPO	35	42
CC(=O)CCCCCSc1nnnn1-c1ccccc1	ZINC000450625831	CF	On-Demand	Anodyne	CELA2A	33	46
CSc1cccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1	ZINC000450625834	DE	On-Demand	Anodyne	MTNR1B	0	41
CSc1cccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1	ZINC000450625834	DE	On-Demand	Anodyne	RHOA	0	44
CSc1cccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1	ZINC000450625834	DE	On-Demand	Anodyne	L3MBTL1	0	40
CSc1cccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1	ZINC000450625834	DE	On-Demand	Anodyne	L3MBTL3	34	40
CSc1cccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1	ZINC000450625835	DE	On-Demand	Anodyne	MTNR1B	0	41
CSc1cccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1	ZINC000450625835	DE	On-Demand	Anodyne	RHOA	0	44
CSc1cccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1	ZINC000450625835	DE	On-Demand	Anodyne	L3MBTL1	0	40
CSc1cccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1	ZINC000450625835	DE	On-Demand	Anodyne	L3MBTL3	34	40
CCC[C@H](O)CN(C)Cc1cccc(OC(C)C)c1	ZINC000450625851	CG	On-Demand	Anodyne	CETP	0	47
CCC[C@@H](O)CN(C)Cc1cccc(OC(C)C)c1	ZINC000450625852	CG	On-Demand	Anodyne	CETP	0	47
CC1=CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450625862	BF	On-Demand	Anodyne	SIGMAR1	35	48
COc1ccc(CNC(=O)CCSc2nnnn2-c2ccccc2)c(OC)c1	ZINC000450625864	GE	On-Demand	Anodyne	MTNR1A	46	35
COc1ccc(CNC(=O)CCSc2nnnn2-c2ccccc2)c(OC)c1	ZINC000450625864	GE	On-Demand	Anodyne	CELA2A	30	49
Cc1ccc2nc(SCc3ccn(CC(F)(F)F)n3)[nH]c2c1	ZINC000450625872	EH	On-Demand	Anodyne	CYP2C19	34	44
CCn1nnc(C)c1COc1ccc(OCc2ccccc2)cc1	ZINC000450625882	DH	On-Demand	Anodyne	MAOB	17	45
Cc1cc(C)c(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)cc1Br	ZINC000450625887	GF	On-Demand	Anodyne	EPHX2	31	40
COc1cccc(-n2cc(C(=O)N3CCN(C(C)=O)CC3(C)C)nn2)c1	ZINC000450625888	FD	On-Demand	Anodyne	DRD4	41	32
Cc1cc(C)c(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)cc1Br	ZINC000450625892	GF	On-Demand	Anodyne	EPHX2	31	40
CNS(=O)(=O)c1ccc(NCc2nc(C(C)C)n[nH]2)c(F)c1	ZINC000450625917	ED	On-Demand	Anodyne	TRPV1	52	32
COc1cc(CN(Cc2cccnc2)C(C)C)ccc1Cl	ZINC000450625934	DI	On-Demand	Anodyne	NR1D1	41	39
CC[C@@H](CC(F)(F)F)NC(=O)CCCC(C)C	ZINC000450625945	CH	On-Demand	Anodyne	Q6UB75_PIG	0	43
CC[C@@H](CC(F)(F)F)NC(=O)CCCC(C)C	ZINC000450625945	CH	On-Demand	Anodyne	NOD1	64	35
CC[C@H](CC(F)(F)F)NC(=O)CCCC(C)C	ZINC000450625946	CH	On-Demand	Anodyne	Q6UB75_PIG	0	43
CC[C@H](CC(F)(F)F)NC(=O)CCCC(C)C	ZINC000450625946	CH	On-Demand	Anodyne	NOD1	64	35
C[C@@H](c1ccc(CN2CCN(Cc3ccncc3)CC2)cc1)C(F)(F)F	ZINC000450625950	FI	On-Demand	Anodyne	SIGMAR1	17	42
C[C@H](c1ccc(CN2CCN(Cc3ccncc3)CC2)cc1)C(F)(F)F	ZINC000450625951	FI	On-Demand	Anodyne	SIGMAR1	17	42
CC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450625973	CE	On-Demand	Anodyne	FIMH	22	43
c1ccc(COc2cccnc2NCc2nc(C3CC3)n[nH]2)cc1	ZINC000450625996	DG	On-Demand	Anodyne	PPIA	51	40
COc1cccc(-n2cc(C(=O)N3CCN(c4cccc(C#N)n4)CC3)nn2)c1	ZINC000450626012	GD	On-Demand	Mild	DRD4	42	32
COc1cccc(-n2cc(C(=O)N3CCN(c4cccc(C#N)n4)CC3)nn2)c1	ZINC000450626012	GD	On-Demand	Mild	CCKAR	33	48
Cn1c(C(=O)N2CCCC[C@H]2c2ccccc2)c2n(c1=O)CCCC2	ZINC000450626038	EF	On-Demand	Anodyne	UTS2R	45	32
Cn1c(C(=O)N2CCCC[C@@H]2c2ccccc2)c2n(c1=O)CCCC2	ZINC000450626040	EF	On-Demand	Anodyne	UTS2R	45	32
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450626045	CG	On-Demand	Anodyne	DRD2	32	44
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450626045	CG	On-Demand	Anodyne	HTR2A	24	48
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450626045	CG	On-Demand	Anodyne	CYP2J2	57	41
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450626046	CG	On-Demand	Anodyne	DRD2	32	44
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450626046	CG	On-Demand	Anodyne	HTR2A	24	48
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450626046	CG	On-Demand	Anodyne	CYP2J2	57	41
Cc1ccn2ncc(C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)c2c1	ZINC000450626050	ED	On-Demand	Anodyne	EPHB3	34	48
Cc1ccn2ncc(C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)c2c1	ZINC000450626051	ED	On-Demand	Anodyne	EPHB3	34	48
CCC[C@@H]1CN(Cc2cccc(C(=O)OC)c2Cl)CCO1	ZINC000450626067	DG	On-Demand	Anodyne	DRD4	16	46
CCC[C@H]1CN(Cc2cccc(C(=O)OC)c2Cl)CCO1	ZINC000450626069	DG	On-Demand	Anodyne	DRD4	16	46
c1cncc([C@@H]2CCCN2Cc2cn(CC3CC3)nn2)c1	ZINC000450626091	CE	On-Demand	Anodyne	CHRNA2	46	47
c1cncc([C@H]2CCCN2Cc2cn(CC3CC3)nn2)c1	ZINC000450626092	CE	On-Demand	Anodyne	CHRNA2	46	47
CCc1cccc(C(=O)N[C@H](C(=O)OC)c2ccc(OC(F)F)cc2)n1	ZINC000450626101	FF	On-Demand	Anodyne	PDE5A	27	41
CCc1cccc(C(=O)N[C@@H](C(=O)OC)c2ccc(OC(F)F)cc2)n1	ZINC000450626102	FF	On-Demand	Anodyne	PDE5A	27	41
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626104	FI	On-Demand	Anodyne	COLA	95	50
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626104	FI	On-Demand	Anodyne	CPT1A	93	50
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626104	FI	On-Demand	Anodyne	GRM5	0	45
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626105	FI	On-Demand	Anodyne	COLA	95	50
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626105	FI	On-Demand	Anodyne	CPT1A	93	50
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626105	FI	On-Demand	Anodyne	GRM5	0	45
COc1ccc(CNC(=O)CCN(C)Cc2nccn2C)c(OC)c1	ZINC000450626106	ED	On-Demand	Anodyne	PDGFRB	36	41
COc1ccc(CNC(=O)CCN(C)Cc2nccn2C)c(OC)c1	ZINC000450626106	ED	On-Demand	Anodyne	MTNR1A	40	38
FC(F)(F)Cn1ccc(CN2CCC[C@H]2c2cccnc2)n1	ZINC000450626115	DG	On-Demand	Anodyne	CHRNA2	45	46
FC(F)(F)Cn1ccc(CN2CCC[C@H]2c2cccnc2)n1	ZINC000450626115	DG	On-Demand	Anodyne	CRTY	0	46
FC(F)(F)Cn1ccc(CN2CCC[C@@H]2c2cccnc2)n1	ZINC000450626116	DG	On-Demand	Anodyne	CHRNA2	45	46
FC(F)(F)Cn1ccc(CN2CCC[C@@H]2c2cccnc2)n1	ZINC000450626116	DG	On-Demand	Anodyne	CRTY	0	46
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626126	DD	On-Demand	Anodyne	MME	58	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626126	DD	On-Demand	Anodyne	TIMP3	46	31
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626126	DD	On-Demand	Anodyne	ACE2	44	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626126	DD	On-Demand	Anodyne	PGA5	45	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626126	DD	On-Demand	Anodyne	PSMB8	40	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626127	DD	On-Demand	Anodyne	MME	58	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626127	DD	On-Demand	Anodyne	TIMP3	46	31
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626127	DD	On-Demand	Anodyne	ACE2	44	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626127	DD	On-Demand	Anodyne	PGA5	45	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626127	DD	On-Demand	Anodyne	PSMB8	40	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626128	DD	On-Demand	Anodyne	MME	58	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626128	DD	On-Demand	Anodyne	TIMP3	46	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626128	DD	On-Demand	Anodyne	ACE2	44	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626128	DD	On-Demand	Anodyne	PGA5	45	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450626128	DD	On-Demand	Anodyne	PSMB8	40	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626129	DD	On-Demand	Anodyne	MME	58	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626129	DD	On-Demand	Anodyne	TIMP3	46	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626129	DD	On-Demand	Anodyne	ACE2	44	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626129	DD	On-Demand	Anodyne	PGA5	45	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450626129	DD	On-Demand	Anodyne	PSMB8	40	33
Cn1c(C#N)ccc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626133	GH	On-Demand	Mild	COLA	51	51
Cn1c(C#N)ccc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626133	GH	On-Demand	Mild	CPT1A	50	51
Cn1c(C#N)ccc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626134	GH	On-Demand	Mild	COLA	51	51
Cn1c(C#N)ccc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626134	GH	On-Demand	Mild	CPT1A	50	51
CCC(CC)Oc1ccc(C(=O)Nc2cnn(CC(=O)NCCO)c2)cc1	ZINC000450626140	FD	On-Demand	Anodyne	PANC	52	33
CN(CCN1CC=C(C(F)(F)F)CC1)Cc1ccccc1	ZINC000450626150	CG	On-Demand	Anodyne	SIGMAR1	25	43
C[C@H](CCCO)CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450626154	ED	On-Demand	Anodyne	GCKR	41	29
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450626155	ED	On-Demand	Anodyne	GCKR	41	29
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450626167	FC	On-Demand	Anodyne	TGM2	15	40
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450626167	FC	On-Demand	Anodyne	GCKR	53	30
C[C@H](CCCO)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450626168	FC	On-Demand	Anodyne	TGM2	15	40
C[C@H](CCCO)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450626168	FC	On-Demand	Anodyne	GCKR	53	30
CCn1nnc(C)c1COc1ccc([N+](=O)[O-])cc1Cl	ZINC000450626183	CF	On-Demand	Bother	ENR	0	41
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)c2cccnc2)cc1	ZINC000450626184	DG	On-Demand	Anodyne	ADRB3	47	40
O=[N+]([O-])c1ccc(OCC2CC(F)(F)C2)c(Cl)c1	ZINC000450626185	CH	On-Demand	Bother	SNCA	44	34
O=[N+]([O-])c1ccc(OCC2CC(F)(F)C2)c(Cl)c1	ZINC000450626185	CH	On-Demand	Bother	ENR	0	43
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)c2cccnc2)cc1	ZINC000450626186	DG	On-Demand	Anodyne	ADRB3	47	40
COc1cc(CN(C[C@H](Cc2ccccc2)OC)C2CC2)ccc1O	ZINC000450626189	EH	On-Demand	Anodyne	TTR	0	43
COc1cc(CN(C[C@@H](Cc2ccccc2)OC)C2CC2)ccc1O	ZINC000450626190	EH	On-Demand	Anodyne	TTR	0	43
CCOc1ccc2nc(SCc3nc(C(=O)OC)cs3)[nH]c2c1	ZINC000450626207	EG	On-Demand	Anodyne	CYP2C8	29	43
CCOc1ccc2nc(SCc3nc(C(=O)OC)cs3)[nH]c2c1	ZINC000450626207	EG	On-Demand	Anodyne	CYP2C19	39	46
CC(=O)CCCCCSc1ccc(C)cc1	ZINC000450626212	BI	On-Demand	Anodyne	THRB	22	44
CC(=O)[C@@](C)(O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450626233	CE	On-Demand	Anodyne	HRH1	43	41
CC(=O)[C@@](C)(O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450626233	CE	On-Demand	Anodyne	CCR3	32	41
CC(=O)[C@@](C)(O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450626233	CE	On-Demand	Anodyne	CACNA1I	44	40
CC(=O)[C@@](C)(O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450626235	CE	On-Demand	Anodyne	HRH1	43	41
CC(=O)[C@@](C)(O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450626235	CE	On-Demand	Anodyne	CCR3	32	41
CC(=O)[C@@](C)(O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450626235	CE	On-Demand	Anodyne	CACNA1I	44	40
CC(=O)[C@](C)(O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450626236	CE	On-Demand	Anodyne	HRH1	43	41
CC(=O)[C@](C)(O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450626236	CE	On-Demand	Anodyne	CCR3	32	41
CC(=O)[C@](C)(O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450626236	CE	On-Demand	Anodyne	CACNA1I	44	40
CC(=O)[C@](C)(O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450626237	CE	On-Demand	Anodyne	HRH1	43	41
CC(=O)[C@](C)(O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450626237	CE	On-Demand	Anodyne	CCR3	32	41
CC(=O)[C@](C)(O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450626237	CE	On-Demand	Anodyne	CACNA1I	44	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450626238	FI	On-Demand	Anodyne	ADAM10	38	42
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@]1(O)CCN(C)C1	ZINC000450626253	DC	On-Demand	Anodyne	HCN1	43	33
C[C@@H](OCCc1ccccc1)C(=O)NC[C@]1(O)CCN(C)C1	ZINC000450626258	DC	On-Demand	Anodyne	HCN1	43	33
C[C@H](OCCc1ccccc1)C(=O)NC[C@]1(O)CCN(C)C1	ZINC000450626259	DC	On-Demand	Anodyne	HCN1	43	33
C[C@H](OCCc1ccccc1)C(=O)NC[C@@]1(O)CCN(C)C1	ZINC000450626260	DC	On-Demand	Anodyne	HCN1	43	33
CC(=O)Nc1ccccc1OCc1cccc2c1OC(C)(C)C2	ZINC000450626269	DH	On-Demand	Anodyne	CCR1	36	41
COC(=O)c1ccc(CN2CCN(C(=O)CO)CC2)cc1Cl	ZINC000450626274	EC	On-Demand	Anodyne	LSS	16	40
COC(=O)c1ccc(CN2CCN(C(=O)CO)CC2)cc1Cl	ZINC000450626274	EC	On-Demand	Anodyne	MCHR1	19	41
CCC(CC)(CNC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1ccc(OC)c(OC)c1	ZINC000450626279	FI	On-Demand	Anodyne	CACNA1G	35	41
C[C@@H](CCCO)CNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450626281	GI	On-Demand	Anodyne	NPBWR1	42	37
C[C@H](CCCO)CNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450626282	GI	On-Demand	Anodyne	NPBWR1	42	37
C[C@H](c1ccccc1)[C@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450626283	FF	On-Demand	Anodyne	DRD4	16	56
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450626284	FF	On-Demand	Anodyne	DRD4	16	56
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450626286	FF	On-Demand	Anodyne	DRD4	16	56
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450626288	FF	On-Demand	Anodyne	DRD4	16	56
Cc1ccc(C(=O)N2CCN(c3ccc(F)cn3)CC2)c(C(C)C)n1	ZINC000450626297	EG	On-Demand	Anodyne	SLC6A9	0	41
Cc1ccc(C(=O)N2CCN(c3ccc(F)cn3)CC2)c(C(C)C)n1	ZINC000450626297	EG	On-Demand	Anodyne	SCD1	22	40
Cc1ccc(C(=O)N2CCN(c3ccc(F)cn3)CC2)c(C(C)C)n1	ZINC000450626297	EG	On-Demand	Anodyne	SLC27A1	42	40
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626323	EH	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626323	EH	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626323	EH	On-Demand	Anodyne	HTR2A	15	47
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626323	EH	On-Demand	Anodyne	SLC18A3	15	52
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626323	EH	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626324	EH	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626324	EH	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626324	EH	On-Demand	Anodyne	HTR2A	15	47
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626324	EH	On-Demand	Anodyne	SLC18A3	15	52
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626324	EH	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626325	EH	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626325	EH	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626325	EH	On-Demand	Anodyne	HTR2A	15	47
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626325	EH	On-Demand	Anodyne	SLC18A3	15	52
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626325	EH	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626326	EH	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626326	EH	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626326	EH	On-Demand	Anodyne	HTR2A	15	47
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626326	EH	On-Demand	Anodyne	SLC18A3	15	52
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000450626326	EH	On-Demand	Anodyne	CYP2J2	48	34
c1ccc2c3c([nH]c2c1)CN(CCc1cscn1)CC3	ZINC000450626343	CG	On-Demand	Anodyne	DRD5	18	43
c1ccc2c3c([nH]c2c1)CN(CCc1cscn1)CC3	ZINC000450626343	CG	On-Demand	Anodyne	HTR5A	21	56
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450626349	DJ	On-Demand	Anodyne	COLA	108	36
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450626349	DJ	On-Demand	Anodyne	CPT1A	99	35
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450626349	DJ	On-Demand	Anodyne	PREP	45	37
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450626350	DJ	On-Demand	Anodyne	COLA	108	36
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450626350	DJ	On-Demand	Anodyne	CPT1A	99	35
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ccccc1	ZINC000450626350	DJ	On-Demand	Anodyne	PREP	45	37
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450626351	DJ	On-Demand	Anodyne	COLA	108	36
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450626351	DJ	On-Demand	Anodyne	CPT1A	99	35
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450626351	DJ	On-Demand	Anodyne	PREP	45	37
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450626352	DJ	On-Demand	Anodyne	COLA	108	36
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450626352	DJ	On-Demand	Anodyne	CPT1A	101	36
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ccccc1	ZINC000450626352	DJ	On-Demand	Anodyne	PREP	56	37
Clc1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1Cl	ZINC000450626353	CH	On-Demand	Anodyne	CHRNA10	15	45
Clc1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1Cl	ZINC000450626354	CH	On-Demand	Anodyne	CHRNA10	15	45
C[C@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626360	CG	On-Demand	Anodyne	SRD5A2	29	44
C[C@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626360	CG	On-Demand	Anodyne	PPARG	31	42
C[C@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626360	CG	On-Demand	Anodyne	PPARA	32	57
C[C@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626360	CG	On-Demand	Anodyne	LTA4H	36	40
C[C@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626360	CG	On-Demand	Anodyne	CYSLTR2	41	31
C[C@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626360	CG	On-Demand	Anodyne	PLA2G4B	87	41
C[C@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626360	CG	On-Demand	Anodyne	ESRRG	51	38
C[C@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626360	CG	On-Demand	Anodyne	ACR	31	43
C[C@@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626361	CG	On-Demand	Anodyne	SRD5A2	29	44
C[C@@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626361	CG	On-Demand	Anodyne	PPARG	31	42
C[C@@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626361	CG	On-Demand	Anodyne	PPARA	32	57
C[C@@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626361	CG	On-Demand	Anodyne	LTA4H	36	40
C[C@@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626361	CG	On-Demand	Anodyne	CYSLTR2	41	31
C[C@@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626361	CG	On-Demand	Anodyne	PLA2G4B	87	41
C[C@@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626361	CG	On-Demand	Anodyne	ESRRG	51	38
C[C@@H](O)CCCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000450626361	CG	On-Demand	Anodyne	ACR	31	43
CN1CC(=O)N(CCCCc2ccc(Cl)c(Cl)c2)C1=O	ZINC000450626378	DG	On-Demand	Anodyne	SIGMAR1	17	47
CN1CC(=O)N(CCCCc2ccc(Cl)c(Cl)c2)C1=O	ZINC000450626378	DG	On-Demand	Anodyne	DNAE	53	30
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450626385	DH	On-Demand	Anodyne	ADAM17	45	46
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450626385	DH	On-Demand	Anodyne	COLA	109	41
C[C@@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450626386	DH	On-Demand	Anodyne	ADAM17	45	46
C[C@@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450626386	DH	On-Demand	Anodyne	COLA	109	41
C[C@@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450626386	DH	On-Demand	Anodyne	CPT1A	103	41
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450626387	DH	On-Demand	Anodyne	ADAM17	45	46
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450626387	DH	On-Demand	Anodyne	COLA	109	41
C[C@@H](Oc1ccccn1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450626388	DH	On-Demand	Anodyne	ADAM17	45	46
C[C@@H](Oc1ccccn1)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450626388	DH	On-Demand	Anodyne	COLA	109	41
O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450626389	GI	On-Demand	Anodyne	PA	27	41
O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450626390	GI	On-Demand	Anodyne	PA	27	41
O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450626391	GI	On-Demand	Anodyne	PA	27	41
O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450626392	GI	On-Demand	Anodyne	PA	27	41
N#CC1(COc2ccccc2C(=O)Nc2ccccc2)CCC1	ZINC000450626397	DI	On-Demand	Mild	HCN1	67	38
N#CC1(COc2ccccc2C(=O)Nc2ccccc2)CCC1	ZINC000450626397	DI	On-Demand	Mild	HCN4	56	36
N#CC1(COc2ccccc2C(=O)Nc2ccccc2)CCC1	ZINC000450626397	DI	On-Demand	Mild	KCNK3	57	44
N#CC1(COc2ccccc2C(=O)Nc2ccccc2)CCC1	ZINC000450626397	DI	On-Demand	Mild	KCNK9	58	44
N#CC1(COc2ccc(C(=O)c3ccccc3)cc2)CCC1	ZINC000450626398	CH	On-Demand	Mild	SRD5A2	27	43
FC(F)(F)c1cccc(OCC[C@@H]2CCOC2)c1	ZINC000450626415	CH	On-Demand	Anodyne	CHRNA10	17	46
FC(F)(F)c1cccc(OCC[C@@H]2CCOC2)c1	ZINC000450626415	CH	On-Demand	Anodyne	PDS	39	40
FC(F)(F)c1cccc(OCC[C@H]2CCOC2)c1	ZINC000450626422	CH	On-Demand	Anodyne	CHRNA10	17	46
FC(F)(F)c1cccc(OCC[C@H]2CCOC2)c1	ZINC000450626422	CH	On-Demand	Anodyne	PDS	39	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450626436	FG	On-Demand	Mild	SLC6A9	35	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450626436	FG	On-Demand	Mild	SLC6A7	0	41
CCC(=O)c1ccc(NCc2ccnc(C)c2)c([N+](=O)[O-])c1	ZINC000450626449	CH	On-Demand	Bother	DRTS_TOXGO	15	42
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450626450	DD	On-Demand	Anodyne	EPHX2	42	46
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450626451	DD	On-Demand	Anodyne	EPHX2	42	46
CC(C)(C)CN(CC(C)(C)C)C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450626486	EJ	On-Demand	Anodyne	MLYCD	16	53
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450626490	DH	On-Demand	Anodyne	MME	16	43
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450626490	DH	On-Demand	Anodyne	ACE2	41	43
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450626491	DH	On-Demand	Anodyne	ACE2	40	43
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450626492	DH	On-Demand	Anodyne	ACE2	40	43
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450626493	DH	On-Demand	Anodyne	MME	16	43
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450626493	DH	On-Demand	Anodyne	ACE2	41	43
Cc1ccc(F)c(CC(=O)NC2Cc3ccccc3C2)c1	ZINC000450626507	CF	On-Demand	Anodyne	CA7	15	40
CO[C@H](COc1ccc([N+](=O)[O-])cc1)Cc1ccccc1	ZINC000450626511	CG	On-Demand	Bother	PDS	40	44
CO[C@@H](COc1ccc([N+](=O)[O-])cc1)Cc1ccccc1	ZINC000450626512	CG	On-Demand	Bother	PDS	40	44
CC[C@H](CC(F)(F)F)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450626513	EH	On-Demand	Anodyne	IRAK4	22	44
CC[C@@H](CC(F)(F)F)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450626514	EH	On-Demand	Anodyne	IRAK4	22	44
CCCc1nc(C)c(COc2cccc([N+](=O)[O-])c2)o1	ZINC000450626519	CG	On-Demand	Bother	CACNA1D	68	34
C[C@@]1(CNC(=O)[C@H](O)C2CCC2)CCCc2ccccc21	ZINC000450626520	CF	On-Demand	Anodyne	ACAT	0	44
C[C@]1(CNC(=O)[C@@H](O)C2CCC2)CCCc2ccccc21	ZINC000450626521	CF	On-Demand	Anodyne	ACAT	0	44
C[C@]1(CNC(=O)[C@H](O)C2CCC2)CCCc2ccccc21	ZINC000450626522	CF	On-Demand	Anodyne	ACAT	0	44
C[C@@]1(CNC(=O)[C@@H](O)C2CCC2)CCCc2ccccc21	ZINC000450626523	CF	On-Demand	Anodyne	ACAT	0	44
CCC[C@@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626539	EH	On-Demand	Anodyne	CAPN1	46	36
CCC[C@@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626539	EH	On-Demand	Anodyne	CAPN2	80	35
CCC[C@@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626539	EH	On-Demand	Anodyne	NPR	59	36
CCC[C@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626541	EH	On-Demand	Anodyne	CAPN1	46	36
CCC[C@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626541	EH	On-Demand	Anodyne	CAPN2	80	35
CCC[C@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626541	EH	On-Demand	Anodyne	NPR	59	36
CCOC(=O)c1ccc(CSCc2ccccc2)nc1	ZINC000450626550	CH	On-Demand	Anodyne	F2RL3	19	41
COc1cc(C(=O)NCCN2CC=C(C)CC2)c([N+](=O)[O-])cc1F	ZINC000450626551	EE	On-Demand	Bother	DRD4	40	32
CCC[C@H](O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450626560	CF	On-Demand	Anodyne	HRH1	41	48
CCC[C@@H](O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450626562	CF	On-Demand	Anodyne	HRH1	41	48
CCC[C@@H](O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450626564	CF	On-Demand	Anodyne	HRH1	41	48
CCC[C@H](O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450626566	CF	On-Demand	Anodyne	HRH1	41	48
CC1=CCN(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450626572	CE	On-Demand	Anodyne	DRD4	48	37
CC1=CCN(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450626572	CE	On-Demand	Anodyne	PLD2	55	38
CC1=CCN(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450626572	CE	On-Demand	Anodyne	CACNA1I	51	34
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	ESR1	59	37
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	DRD2	17	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	DRD4	41	32
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	DRD3	33	42
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	ESR2	42	36
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	LTA4H	58	46
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	HRH3	55	48
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	PSMB2	57	44
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	PSMB5	19	44
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	PSMB1	50	44
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	TBK1	17	41
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	HPGDS	22	45
O=C(NCCc1ccc(OCCN2CCCC2)cc1)c1ccc(N2CCC2)nc1	ZINC000450626582	GF	On-Demand	Anodyne	AP2S1	0	40
c1cncc([C@H]2CCCN2Cc2nnc(C3CC3)s2)c1	ZINC000450626583	CG	On-Demand	Anodyne	CHRNA2	48	49
c1cncc([C@H]2CCCN2Cc2nnc(C3CC3)s2)c1	ZINC000450626583	CG	On-Demand	Anodyne	CRTY	0	49
c1cncc([C@@H]2CCCN2Cc2nnc(C3CC3)s2)c1	ZINC000450626585	CG	On-Demand	Anodyne	CHRNA2	48	49
c1cncc([C@@H]2CCCN2Cc2nnc(C3CC3)s2)c1	ZINC000450626585	CG	On-Demand	Anodyne	CRTY	0	49
CCc1cc(CCCN2CCC[C@H]2c2cccnc2)on1	ZINC000450626586	CG	On-Demand	Anodyne	CHRNA2	49	50
CCc1cc(CCCN2CCC[C@H]2c2cccnc2)on1	ZINC000450626586	CG	On-Demand	Anodyne	CRTY	0	50
CCc1cc(CCCN2CCC[C@@H]2c2cccnc2)on1	ZINC000450626587	CG	On-Demand	Anodyne	CHRNA2	49	50
CCc1cc(CCCN2CCC[C@@H]2c2cccnc2)on1	ZINC000450626587	CG	On-Demand	Anodyne	CRTY	0	50
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450626588	EF	On-Demand	Anodyne	SCN9A	0	43
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450626590	EF	On-Demand	Anodyne	SCN9A	0	43
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450626592	EF	On-Demand	Anodyne	SCN9A	0	43
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450626594	EF	On-Demand	Anodyne	SCN9A	0	43
COC(=O)c1csc(CN(C)[C@@H](C)c2cccnc2)n1	ZINC000450626602	CF	On-Demand	Anodyne	KCNA5	23	44
COC(=O)c1csc(CN(C)[C@H](C)c2cccnc2)n1	ZINC000450626604	CF	On-Demand	Anodyne	KCNA5	23	44
CCC(CC)(CCSc1ccccn1)C(=O)OC	ZINC000450626606	CH	On-Demand	Anodyne	FAS	21	44
c1ccc2[nH]c(CN3CCN(Cc4cnns4)CC3)nc2c1	ZINC000450626610	DD	On-Demand	Anodyne	DRD4	17	57
C1=C(CCN2CCC[C@H]2c2cccnc2)CCCC1	ZINC000450626611	CI	On-Demand	Anodyne	CHRNA2	52	53
C1=C(CCN2CCC[C@H]2c2cccnc2)CCCC1	ZINC000450626611	CI	On-Demand	Anodyne	CHRNB4	0	53
C1=C(CCN2CCC[C@H]2c2cccnc2)CCCC1	ZINC000450626611	CI	On-Demand	Anodyne	Q8WSF8_APLCA	15	53
C1=C(CCN2CCC[C@H]2c2cccnc2)CCCC1	ZINC000450626611	CI	On-Demand	Anodyne	CRTY	0	53
C1=C(CCN2CCC[C@@H]2c2cccnc2)CCCC1	ZINC000450626614	CI	On-Demand	Anodyne	CHRNA2	52	53
C1=C(CCN2CCC[C@@H]2c2cccnc2)CCCC1	ZINC000450626614	CI	On-Demand	Anodyne	CHRNB4	0	53
C1=C(CCN2CCC[C@@H]2c2cccnc2)CCCC1	ZINC000450626614	CI	On-Demand	Anodyne	Q8WSF8_APLCA	15	53
C1=C(CCN2CCC[C@@H]2c2cccnc2)CCCC1	ZINC000450626614	CI	On-Demand	Anodyne	CRTY	0	53
C[C@H](CCCO)CN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450626620	EG	On-Demand	Anodyne	KCNK3	40	39
C[C@@H](CCCO)CN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450626623	EG	On-Demand	Anodyne	KCNK3	40	39
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1Cl	ZINC000450626639	CH	On-Demand	Bother	ENR	0	46
O=C(NCCc1nc(-c2ccccc2)n[nH]1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450626650	GE	On-Demand	Anodyne	CA2	19	43
COc1cc(CC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)ccc1O	ZINC000450626652	ED	On-Demand	Anodyne	TRPV1	28	60
COc1cc(CC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)ccc1O	ZINC000450626652	ED	On-Demand	Anodyne	NCE103	38	46
COc1cc(CC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)ccc1O	ZINC000450626652	ED	On-Demand	Anodyne	P96878_MYCTU	24	46
COc1cc(CC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)ccc1O	ZINC000450626652	ED	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)ccc1O	ZINC000450626654	ED	On-Demand	Anodyne	TRPV1	28	60
COc1cc(CC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)ccc1O	ZINC000450626654	ED	On-Demand	Anodyne	NCE103	38	46
COc1cc(CC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)ccc1O	ZINC000450626654	ED	On-Demand	Anodyne	P96878_MYCTU	24	46
COc1cc(CC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)ccc1O	ZINC000450626654	ED	On-Demand	Anodyne	CAN2	0	46
COc1ccc2c(c1)CCN(CCc1cscn1)CC2	ZINC000450626657	CF	On-Demand	Anodyne	ABCB1	22	41
CS(=O)(=O)c1cccc(CN(CC(F)(F)F)C2CC2)c1	ZINC000450626668	DF	On-Demand	Anodyne	CACNA1B	44	37
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)CCCn1nc(C)nc1C	ZINC000450626679	FF	On-Demand	Anodyne	CCKAR	42	32
CC[C@H]1CN(c2ccccc2)CCN1C(=O)CCCn1nc(C)nc1C	ZINC000450626691	FF	On-Demand	Anodyne	CCKAR	42	32
COc1ccc2c(c1)CCN(Cc1nnc(C(C)C)s1)CC2	ZINC000450626694	DG	On-Demand	Anodyne	DRD5	16	44
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626695	GJ	On-Demand	Anodyne	CPT1A	74	50
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450626704	FH	On-Demand	Anodyne	CCKAR	44	33
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450626705	FH	On-Demand	Anodyne	CCKAR	44	33
C[C@@H]1CCO[C@@H]1C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450626709	FG	On-Demand	Anodyne	ADAM10	31	41
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450626713	GJ	On-Demand	Anodyne	CPT1A	74	50
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450626715	FG	On-Demand	Anodyne	KCNJ11	42	33
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450626718	FG	On-Demand	Anodyne	KCNJ11	42	33
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1c1cccnc1	ZINC000450626720	CG	On-Demand	Anodyne	CHRNA2	49	50
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1c1cccnc1	ZINC000450626720	CG	On-Demand	Anodyne	CRTY	0	50
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1c1cccnc1	ZINC000450626722	CG	On-Demand	Anodyne	CHRNA2	49	50
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1c1cccnc1	ZINC000450626722	CG	On-Demand	Anodyne	CRTY	0	50
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1c1cccnc1	ZINC000450626724	CG	On-Demand	Anodyne	CHRNA2	49	50
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1c1cccnc1	ZINC000450626724	CG	On-Demand	Anodyne	CRTY	0	50
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1c1cccnc1	ZINC000450626725	CG	On-Demand	Anodyne	CHRNA2	49	50
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1c1cccnc1	ZINC000450626725	CG	On-Demand	Anodyne	CRTY	0	50
CCOc1ccc2nc(SCc3cn(CC4CC4)nn3)[nH]c2c1	ZINC000450626729	EG	On-Demand	Anodyne	CYP2C8	31	44
CCOc1ccc2nc(SCc3cn(CC4CC4)nn3)[nH]c2c1	ZINC000450626729	EG	On-Demand	Anodyne	CYP2C19	40	47
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1c(Br)cnn1C	ZINC000450626738	GF	On-Demand	Anodyne	CCKAR	44	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450626740	FD	On-Demand	Anodyne	PAPA1_CARPA	42	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450626740	FD	On-Demand	Anodyne	CTSK	21	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450626740	FD	On-Demand	Anodyne	CTSS	25	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450626740	FD	On-Demand	Anodyne	CAPN1	19	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450626740	FD	On-Demand	Anodyne	FPR1	44	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450626745	FD	On-Demand	Anodyne	PAPA1_CARPA	42	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450626745	FD	On-Demand	Anodyne	CTSK	21	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450626745	FD	On-Demand	Anodyne	CTSS	25	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450626745	FD	On-Demand	Anodyne	CAPN1	19	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450626745	FD	On-Demand	Anodyne	FPR1	44	37
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1c(Br)cnn1C	ZINC000450626754	GF	On-Demand	Anodyne	CCKAR	44	34
CS(=O)(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450626757	GF	On-Demand	Anodyne	SLC6A1	0	40
CS(=O)(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450626757	GF	On-Demand	Anodyne	PRCP	17	40
CC[C@H](CC#N)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450626765	DE	On-Demand	Mild	PDE4D	15	40
CC[C@@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626766	DG	On-Demand	Anodyne	CAPN1	44	36
CC[C@@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626766	DG	On-Demand	Anodyne	CAPN2	76	36
CC[C@@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626766	DG	On-Demand	Anodyne	NPR	54	37
CS(=O)(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450626767	GF	On-Demand	Anodyne	SLC6A1	0	40
CS(=O)(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450626767	GF	On-Demand	Anodyne	PRCP	17	40
CC[C@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626768	DG	On-Demand	Anodyne	CAPN1	44	36
CC[C@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626768	DG	On-Demand	Anodyne	CAPN2	76	36
CC[C@H](CC(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450626768	DG	On-Demand	Anodyne	NPR	54	37
COc1ccc(CNC(=O)CCN2CCC(O)(C(F)(F)F)CC2)c(OC)c1	ZINC000450626773	GE	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCC(O)(C(F)(F)F)CC2)c(OC)c1	ZINC000450626773	GE	On-Demand	Anodyne	HTR7	26	42
COc1ccc(CNC(=O)CCN2CCC(O)(C(F)(F)F)CC2)c(OC)c1	ZINC000450626773	GE	On-Demand	Anodyne	MTNR1A	41	40
COc1ccc(CNC(=O)CCN2CCC(O)(C(F)(F)F)CC2)c(OC)c1	ZINC000450626773	GE	On-Demand	Anodyne	MTNR1B	32	40
COCCOC[C@@H](O)CN1CCc2ccc(OC)cc2CC1	ZINC000450626779	DD	On-Demand	Anodyne	ACOX1	40	36
COCCOC[C@@H](O)CN1CCc2ccc(OC)cc2CC1	ZINC000450626779	DD	On-Demand	Anodyne	ABCB1	46	41
COCCOC[C@@H](O)CN1CCc2ccc(OC)cc2CC1	ZINC000450626779	DD	On-Demand	Anodyne	HSP90AB1	41	46
COCCOC[C@H](O)CN1CCc2ccc(OC)cc2CC1	ZINC000450626781	DD	On-Demand	Anodyne	ACOX1	40	36
COCCOC[C@H](O)CN1CCc2ccc(OC)cc2CC1	ZINC000450626781	DD	On-Demand	Anodyne	ABCB1	46	41
COCCOC[C@H](O)CN1CCc2ccc(OC)cc2CC1	ZINC000450626781	DD	On-Demand	Anodyne	HSP90AB1	41	46
CCc1cc(CCCN2CCc3ccc(OC)cc3CC2)on1	ZINC000450626782	DG	On-Demand	Anodyne	DRD3	17	44
CCc1cc(CCCN2CCc3ccc(OC)cc3CC2)on1	ZINC000450626782	DG	On-Demand	Anodyne	DRD5	16	44
CCc1cc(CCCN2CCc3ccc(OC)cc3CC2)on1	ZINC000450626782	DG	On-Demand	Anodyne	HRH3	15	46
O=C(CC[C@@H]1CCCCO1)Cn1nnc(-c2cccc(C(F)(F)F)c2)n1	ZINC000450626784	FG	On-Demand	Anodyne	SCARB1	49	41
O=C(CC[C@H]1CCCCO1)Cn1nnc(-c2cccc(C(F)(F)F)c2)n1	ZINC000450626785	FG	On-Demand	Anodyne	SCARB1	49	41
COCCO[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450626795	CG	On-Demand	Anodyne	SLC6A1	52	33
COCCO[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450626795	CG	On-Demand	Anodyne	SIGMAR1	24	44
COCCO[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450626795	CG	On-Demand	Anodyne	BIRC2	42	44
COCCO[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450626796	CG	On-Demand	Anodyne	SLC6A1	52	33
COCCO[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450626796	CG	On-Demand	Anodyne	SIGMAR1	24	44
COCCO[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450626796	CG	On-Demand	Anodyne	BIRC2	42	44
COc1ccc(-c2csc3ncnc(NCCC(C)(C)CO)c23)cc1	ZINC000450626805	FI	On-Demand	Anodyne	FGFR1	16	59
CC(=O)CCCCCn1nnc(-c2cccc(C(F)(F)F)c2)n1	ZINC000450626806	EH	On-Demand	Anodyne	SOAT1	18	40
Cc1ccc(NC(=O)c2ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c2)cc1	ZINC000450626807	FH	On-Demand	Bother	TAAR1	20	48
Cc1ccc(NC(=O)c2ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c2)cc1	ZINC000450626807	FH	On-Demand	Bother	MCL1	0	44
Cc1cc(C)c(C(=O)N2CCC[C@@H](S(C)(=O)=O)C2)cc1Br	ZINC000450626812	FF	On-Demand	Anodyne	L3MBTL1	0	41
Cc1cc(C)c(C(=O)N2CCC[C@H](S(C)(=O)=O)C2)cc1Br	ZINC000450626813	FF	On-Demand	Anodyne	L3MBTL1	0	41
C[C@H](CCCO)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450626815	DD	On-Demand	Bother	CA2	35	53
C[C@H](CCCO)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450626815	DD	On-Demand	Bother	CA1	31	41
C[C@H](CCCO)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450626815	DD	On-Demand	Bother	CA4	36	41
C[C@@H](CCCO)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450626816	DD	On-Demand	Bother	CA2	35	53
C[C@@H](CCCO)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450626816	DD	On-Demand	Bother	CA1	31	41
C[C@@H](CCCO)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450626816	DD	On-Demand	Bother	CA4	36	41
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cncc(Cl)c1	ZINC000450626822	EG	On-Demand	Anodyne	CCKAR	45	36
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cncc(Cl)c1	ZINC000450626822	EG	On-Demand	Anodyne	SLC6A7	0	41
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cncc(Cl)c1	ZINC000450626823	EG	On-Demand	Anodyne	CCKAR	45	36
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cncc(Cl)c1	ZINC000450626823	EG	On-Demand	Anodyne	SLC6A7	0	41
CC(C)(CO)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450626826	ED	On-Demand	Anodyne	NPY1R	42	35
CC(C)(CO)CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450626826	ED	On-Demand	Anodyne	NPY2R	57	37
COCC1(O)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450626837	EE	On-Demand	Anodyne	SIGMAR1	43	38
CCS(=O)(=O)c1ccc(COc2cccc(C(F)(F)F)c2)cc1	ZINC000450626844	EI	On-Demand	Anodyne	MAOB	32	44
CCS(=O)(=O)c1ccc(COc2cccc(C(F)(F)F)c2)cc1	ZINC000450626844	EI	On-Demand	Anodyne	PPARD	15	40
CCS(=O)(=O)c1ccc(COc2cccc(C(F)(F)F)c2)cc1	ZINC000450626844	EI	On-Demand	Anodyne	ADAMTS4	41	45
CCS(=O)(=O)c1ccc(COc2cccc(C(F)(F)F)c2)cc1	ZINC000450626844	EI	On-Demand	Anodyne	GALR3	41	35
CCS(=O)(=O)c1ccc(COc2cccc(C(F)(F)F)c2)cc1	ZINC000450626844	EI	On-Demand	Anodyne	RORC	34	41
CCS(=O)(=O)c1ccc(COc2cccc(C(F)(F)F)c2)cc1	ZINC000450626844	EI	On-Demand	Anodyne	PDS	48	43
COCC1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450626849	CE	On-Demand	Anodyne	DRD4	0	47
COCC1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450626849	CE	On-Demand	Anodyne	SIGMAR1	23	41
COCC1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450626849	CE	On-Demand	Anodyne	CCR1	49	38
O=C(c1cc2cccnc2s1)N1CCCC[C@H]1c1ccccc1	ZINC000450626851	DJ	On-Demand	Anodyne	COLA	118	41
O=C(c1cc2cccnc2s1)N1CCCC[C@H]1c1ccccc1	ZINC000450626851	DJ	On-Demand	Anodyne	CPT1A	104	39
O=C(c1cc2cccnc2s1)N1CCCC[C@H]1c1ccccc1	ZINC000450626851	DJ	On-Demand	Anodyne	GRM5	0	40
O=C(c1cc2cccnc2s1)N1CCCC[C@@H]1c1ccccc1	ZINC000450626852	DJ	On-Demand	Anodyne	COLA	118	41
O=C(c1cc2cccnc2s1)N1CCCC[C@@H]1c1ccccc1	ZINC000450626852	DJ	On-Demand	Anodyne	CPT1A	104	39
O=C(c1cc2cccnc2s1)N1CCCC[C@@H]1c1ccccc1	ZINC000450626852	DJ	On-Demand	Anodyne	GRM5	0	40
O=C(CC[C@@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626857	DI	On-Demand	Anodyne	PTGFR	19	41
O=C(CC[C@@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626857	DI	On-Demand	Anodyne	COLA	59	39
O=C(CC[C@@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626857	DI	On-Demand	Anodyne	CPT1A	57	39
O=C(CC[C@@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626857	DI	On-Demand	Anodyne	CHRNA10	20	42
O=C(CC[C@@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626857	DI	On-Demand	Anodyne	PDS	41	37
O=C(CC[C@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626858	DI	On-Demand	Anodyne	PTGFR	19	41
O=C(CC[C@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626858	DI	On-Demand	Anodyne	COLA	59	39
O=C(CC[C@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626858	DI	On-Demand	Anodyne	CPT1A	54	37
O=C(CC[C@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626858	DI	On-Demand	Anodyne	CHRNA10	19	42
O=C(CC[C@H]1CCCCO1)COc1cccc(C(F)(F)F)c1	ZINC000450626858	DI	On-Demand	Anodyne	PDS	41	37
COc1ccc(C(C)=O)c(OCC[C@@H](C)O)c1	ZINC000450626867	BE	On-Demand	Anodyne	MTNR1B	37	41
COc1ccc(C(C)=O)c(OCC[C@@H](C)O)c1	ZINC000450626867	BE	On-Demand	Anodyne	AKR1C2	43	37
COc1ccc(C(C)=O)c(OCC[C@H](C)O)c1	ZINC000450626868	BE	On-Demand	Anodyne	MTNR1B	37	41
COc1ccc(C(C)=O)c(OCC[C@H](C)O)c1	ZINC000450626868	BE	On-Demand	Anodyne	AKR1C2	43	37
CC(=O)c1cccc(CN2CC[C@H](C(N)=O)c3ccccc32)c1	ZINC000450626879	DF	On-Demand	Anodyne	F10	24	41
CC(=O)c1cccc(CN2CC[C@H](C(N)=O)c3ccccc32)c1	ZINC000450626879	DF	On-Demand	Anodyne	TRY2_BOVIN	51	36
CC(=O)c1cccc(CN2CC[C@@H](C(N)=O)c3ccccc32)c1	ZINC000450626880	DF	On-Demand	Anodyne	F10	24	41
CC(=O)c1cccc(CN2CC[C@@H](C(N)=O)c3ccccc32)c1	ZINC000450626880	DF	On-Demand	Anodyne	TRY2_BOVIN	51	36
COCC1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450626900	FD	On-Demand	Anodyne	HTR1A	17	40
COCC1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450626900	FD	On-Demand	Anodyne	DRD4	42	32
COCC1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450626900	FD	On-Demand	Anodyne	HTR7	30	43
COCC1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450626900	FD	On-Demand	Anodyne	MTNR1A	64	42
COCC1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450626900	FD	On-Demand	Anodyne	MTNR1B	52	42
O=C(Nc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450626908	EH	On-Demand	Anodyne	HCN1	55	35
O=C(Nc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450626908	EH	On-Demand	Anodyne	HCN4	43	34
O=C(Nc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450626908	EH	On-Demand	Anodyne	KCNK3	53	42
O=C(Nc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450626908	EH	On-Demand	Anodyne	KCNK9	49	42
CC1(C)CN(CC(F)(F)F)CCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450626909	FE	On-Demand	Anodyne	HPGDS	34	52
N#CC1(COc2cccc(C(F)(F)F)c2)CCC1	ZINC000450626910	CH	On-Demand	Mild	PDS	40	36
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)CC1(C)C	ZINC000450626927	DD	On-Demand	Anodyne	SLC12A5	59	34
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)CC1(C)C	ZINC000450626928	DD	On-Demand	Anodyne	SLC12A5	59	34
CC(=O)N1CC[C@H](CN(C)CC/C=C\c2ccccc2)C1	ZINC000450626935	CF	On-Demand	Anodyne	GRIN2B	22	40
CC(=O)N1CC[C@@H](CN(C)CC/C=C/c2ccccc2)C1	ZINC000450626936	CF	On-Demand	Anodyne	GRIN2B	22	40
CC(=O)N1CC[C@@H](CN(C)CC/C=C\c2ccccc2)C1	ZINC000450626937	CF	On-Demand	Anodyne	GRIN2B	22	40
CC(=O)N1CC[C@H](CN(C)CC/C=C/c2ccccc2)C1	ZINC000450626938	CF	On-Demand	Anodyne	GRIN2B	22	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450626948	FD	On-Demand	Anodyne	EPHX2	20	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450626948	FD	On-Demand	Anodyne	RHODESAIN	0	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450626949	FD	On-Demand	Anodyne	EPHX2	20	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450626949	FD	On-Demand	Anodyne	RHODESAIN	0	41
CC(=O)N1CC[C@H](CN(C)CCN(C)Cc2ccccc2)C1	ZINC000450626960	DD	On-Demand	Anodyne	GRIN2B	50	38
CC(=O)N1CC[C@H](CN(C)CCN(C)Cc2ccccc2)C1	ZINC000450626960	DD	On-Demand	Anodyne	SIGMAR1	29	43
CC(=O)N1CC[C@@H](CN(C)CCN(C)Cc2ccccc2)C1	ZINC000450626961	DD	On-Demand	Anodyne	GRIN2B	50	38
CC(=O)N1CC[C@@H](CN(C)CCN(C)Cc2ccccc2)C1	ZINC000450626961	DD	On-Demand	Anodyne	SIGMAR1	29	43
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	CTSG	25	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	CTSK	20	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	CTRB1	33	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	CELA2A	25	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	CAPN1	40	34
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	CAPN2	63	34
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	ACE2	56	38
CC[C@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626967	DG	On-Demand	Anodyne	CTSC	16	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	CTSG	25	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	CTSK	20	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	CTRB1	33	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	CELA2A	25	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	CAPN1	40	34
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	CAPN2	63	34
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	ACE2	56	38
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450626968	DG	On-Demand	Anodyne	CTSC	16	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	CTSG	25	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	CTSK	20	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	CTRB1	33	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	CELA2A	25	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	CAPN1	40	34
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	CAPN2	63	34
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	ACE2	56	38
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626969	DG	On-Demand	Anodyne	CTSC	16	42
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	CTSG	25	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	CTSK	20	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	CTRB1	33	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	CELA2A	25	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	CAPN1	40	34
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	CAPN2	63	34
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	ACE2	56	38
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450626970	DG	On-Demand	Anodyne	CTSC	16	42
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](S(N)(=O)=O)C1	ZINC000450626973	CC	On-Demand	Anodyne	OPRK1	21	42
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](S(N)(=O)=O)C1	ZINC000450626973	CC	On-Demand	Anodyne	CCR5	47	39
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](S(N)(=O)=O)C1	ZINC000450626974	CC	On-Demand	Anodyne	OPRK1	21	42
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](S(N)(=O)=O)C1	ZINC000450626974	CC	On-Demand	Anodyne	CCR5	47	39
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](S(N)(=O)=O)C1	ZINC000450626975	CC	On-Demand	Anodyne	OPRK1	21	42
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](S(N)(=O)=O)C1	ZINC000450626975	CC	On-Demand	Anodyne	CCR5	47	39
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](S(N)(=O)=O)C1	ZINC000450626976	CC	On-Demand	Anodyne	OPRK1	21	42
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](S(N)(=O)=O)C1	ZINC000450626976	CC	On-Demand	Anodyne	CCR5	47	39
COC(=O)c1ccc(CN2CC[C@H](C3CCOCC3)C2)cc1Cl	ZINC000450626977	EG	On-Demand	Anodyne	DRD4	32	40
COC(=O)c1ccc(CN2CC[C@H](C3CCOCC3)C2)cc1Cl	ZINC000450626977	EG	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CC[C@H](C3CCOCC3)C2)cc1Cl	ZINC000450626977	EG	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)c1ccc(CN2CC[C@H](C3CCOCC3)C2)cc1Cl	ZINC000450626977	EG	On-Demand	Anodyne	MCHR1	31	43
COC(=O)c1ccc(CN2CC[C@@H](C3CCOCC3)C2)cc1Cl	ZINC000450626978	EG	On-Demand	Anodyne	DRD4	32	40
COC(=O)c1ccc(CN2CC[C@@H](C3CCOCC3)C2)cc1Cl	ZINC000450626978	EG	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CC[C@@H](C3CCOCC3)C2)cc1Cl	ZINC000450626978	EG	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)c1ccc(CN2CC[C@@H](C3CCOCC3)C2)cc1Cl	ZINC000450626978	EG	On-Demand	Anodyne	MCHR1	31	43
CC[C@@H](CC#N)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450626981	DE	On-Demand	Mild	PDE4D	15	40
CC[C@H](CC#N)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450626982	DE	On-Demand	Mild	PDE4D	15	40
CC[C@@H](CC#N)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450626983	DE	On-Demand	Mild	PDE4D	15	40
CC(=O)N1CCN(C(=O)c2cc3c([nH]2)CCCC3)C(C)(C)C1	ZINC000450626984	DD	On-Demand	Anodyne	HRH4	20	60
CC(C)(C)CN(CC(C)(C)C)C(=O)c1ccc(N2CCC2)nc1	ZINC000450626989	DH	On-Demand	Anodyne	HPGDS	16	45
COc1cc(CN2CCN(Cc3cccnc3)CC2)ccc1Cl	ZINC000450626991	EG	On-Demand	Anodyne	DRD1	0	42
COc1cc(CN2CCN(Cc3cccnc3)CC2)ccc1Cl	ZINC000450626991	EG	On-Demand	Anodyne	DRD4	34	50
COc1cc(CN2CCN(Cc3cccnc3)CC2)ccc1Cl	ZINC000450626991	EG	On-Demand	Anodyne	DRD3	29	42
COc1cc(CN2CCN(Cc3cccnc3)CC2)ccc1Cl	ZINC000450626991	EG	On-Demand	Anodyne	SIGMAR1	31	52
COc1cc(CN2CCN(Cc3cccnc3)CC2)ccc1Cl	ZINC000450626991	EG	On-Demand	Anodyne	P2RX7	0	41
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)CO)CC2)cc1	ZINC000450626994	EC	On-Demand	Anodyne	LSS	17	40
O=C(Cn1cc(NC(=O)C2(Cc3cccc(Cl)c3)CC2)cn1)NCCO	ZINC000450626999	GD	On-Demand	Anodyne	ITK	26	42
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	ESR1	77	40
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	HTR1A	17	40
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	DRD4	50	40
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	DRD3	48	39
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	ESR2	54	40
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	LTA4H	66	50
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	KCNA5	0	42
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	FGFR1	16	40
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	HRH3	73	53
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	SIGMAR1	20	40
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	SRC	24	45
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	HNMT	38	41
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	YES1	28	44
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	MCHR1	17	42
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	PSMB2	56	44
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	PSMB5	19	44
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	PSMB1	49	44
Cc1cccc(Cl)c1C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627003	GI	On-Demand	Anodyne	HT1	0	44
CCCCN(CCCO)C(=O)c1ccc(N2CCC2)nc1	ZINC000450627004	CD	On-Demand	Anodyne	PLM2_PLAFA	58	41
C[C@]1(C(=O)N2CCN(c3ccc(F)cn3)CC2)CC=CCC1	ZINC000450627008	DF	On-Demand	Anodyne	SLC27A1	40	40
C[C@@]1(C(=O)N2CCN(c3ccc(F)cn3)CC2)CC=CCC1	ZINC000450627009	DF	On-Demand	Anodyne	SLC27A1	40	40
Cc1ccc(NC(=O)N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1Cl	ZINC000450627010	FG	On-Demand	Anodyne	PYGL	0	40
Cc1ccc(NC(=O)N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1Cl	ZINC000450627010	FG	On-Demand	Anodyne	CCR2	15	58
COC(=O)C1(CN2CCc3ccc(OC)cc3CC2)CC1	ZINC000450627014	CE	On-Demand	Anodyne	DRD4	42	32
COC1(C)CCN(C(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450627027	EG	On-Demand	Anodyne	SLC12A5	53	36
CN(CCN1CC[C@H](C2CCOCC2)C1)Cc1ccccc1	ZINC000450627031	DF	On-Demand	Anodyne	SIGMAR1	45	42
CN(CCN1CC[C@@H](C2CCOCC2)C1)Cc1ccccc1	ZINC000450627032	DF	On-Demand	Anodyne	SIGMAR1	45	42
CC(=O)N1CC[C@@H](CN(C)CCCC(=O)c2ccc(F)cc2)C1	ZINC000450627040	DF	On-Demand	Anodyne	DRD4	0	40
CC(=O)N1CC[C@H](CN(C)CCCC(=O)c2ccc(F)cc2)C1	ZINC000450627042	DF	On-Demand	Anodyne	DRD4	0	40
CC(C)N(Cc1cccnc1)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450627049	CG	On-Demand	Anodyne	KCNA5	52	39
CC(C)N(Cc1cccnc1)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450627051	CG	On-Demand	Anodyne	KCNA5	52	39
CC(C)N(Cc1cccnc1)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450627053	CG	On-Demand	Anodyne	KCNA5	52	39
CC(C)N(Cc1cccnc1)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450627055	CG	On-Demand	Anodyne	KCNA5	52	39
Cc1ccc(NC(=O)N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1Cl	ZINC000450627059	FG	On-Demand	Anodyne	PYGL	0	40
Cc1ccc(NC(=O)N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1Cl	ZINC000450627059	FG	On-Demand	Anodyne	CCR2	15	58
CC[C@H](CC#N)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450627063	EE	On-Demand	Mild	AR	15	40
CC[C@@H](CC#N)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450627070	EE	On-Demand	Mild	AR	15	40
CC[C@H](CC#N)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450627072	EE	On-Demand	Mild	AR	15	40
CC[C@@H](CC#N)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450627073	EE	On-Demand	Mild	AR	15	40
COc1cc(CC(=O)N2CCN(C(C)=O)CC2(C)C)ccc1Cl	ZINC000450627075	EE	On-Demand	Anodyne	F10	40	31
CC1=CCN(CCNC(=O)c2ccc(C(F)(F)F)[nH]2)CC1	ZINC000450627085	DE	On-Demand	Anodyne	PLD2	43	37
Cc1cccc(CN2CCN(Cc3cccnc3)CC2)n1	ZINC000450627087	CE	On-Demand	Anodyne	DRD4	16	51
CC(C)(CO)CCNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450627089	DF	On-Demand	Bother	MAOB	22	50
CC(C)(CO)CCNc1ncnc2cc(Br)ccc12	ZINC000450627100	DF	On-Demand	Anodyne	EGFR	73	42
CC(C)(CO)CCNc1ncnc2cc(Br)ccc12	ZINC000450627100	DF	On-Demand	Anodyne	CD38	22	40
COc1ccc(CC(=O)NCCN2CC=C(C)CC2)c(Cl)c1OC	ZINC000450627111	FF	On-Demand	Anodyne	DRD4	44	36
COc1ccc(CC(=O)NCCN2CC=C(C)CC2)c(Cl)c1OC	ZINC000450627111	FF	On-Demand	Anodyne	SLC9A1	44	31
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1Cl	ZINC000450627121	DF	On-Demand	Anodyne	DRD2	23	41
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1Cl	ZINC000450627121	DF	On-Demand	Anodyne	DRD4	48	37
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1Cl	ZINC000450627121	DF	On-Demand	Anodyne	DRD3	0	41
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1Cl	ZINC000450627121	DF	On-Demand	Anodyne	HTR4	46	34
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1Cl	ZINC000450627121	DF	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1Cl	ZINC000450627121	DF	On-Demand	Anodyne	NCE103	24	46
COc1cc(CC(=O)NCCN2CC=C(C)CC2)ccc1Cl	ZINC000450627121	DF	On-Demand	Anodyne	CAN2	0	46
COC(=O)C1(NCc2ccc(Cl)c(OC)c2)CCCC1	ZINC000450627124	CF	On-Demand	Anodyne	PDE6A	41	31
CCOc1ccc2nc(S[C@H](C)c3ncc(Br)cn3)[nH]c2c1	ZINC000450627127	GI	On-Demand	Anodyne	CYP1A2	19	45
CCOc1ccc2nc(S[C@H](C)c3ncc(Br)cn3)[nH]c2c1	ZINC000450627127	GI	On-Demand	Anodyne	CYP2C19	32	47
CCOc1ccc2nc(S[C@@H](C)c3ncc(Br)cn3)[nH]c2c1	ZINC000450627129	GI	On-Demand	Anodyne	CYP1A2	19	45
CCOc1ccc2nc(S[C@@H](C)c3ncc(Br)cn3)[nH]c2c1	ZINC000450627129	GI	On-Demand	Anodyne	CYP2C19	32	47
CC[C@@H](CC#N)NC(=O)c1cc2ccncc2s1	ZINC000450627131	CF	On-Demand	Mild	SELE	43	35
CC[C@@H](CC#N)NC(=O)c1cc2ccncc2s1	ZINC000450627131	CF	On-Demand	Mild	ICAM1	40	35
CC[C@H](CC#N)NC(=O)c1cc2ccncc2s1	ZINC000450627134	CF	On-Demand	Mild	SELE	43	35
CC[C@H](CC#N)NC(=O)c1cc2ccncc2s1	ZINC000450627134	CF	On-Demand	Mild	ICAM1	40	35
N#Cc1cccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1Br	ZINC000450627145	GD	On-Demand	Mild	MTNR1A	0	40
N#Cc1cccc(C(=O)N2CC[C@@H](NC(=O)NC3CC3)C2)c1Br	ZINC000450627145	GD	On-Demand	Mild	MTNR1B	0	40
COc1ccc2c(c1)CCN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450627152	EG	On-Demand	Anodyne	DRD5	31	45
COc1ccc2c(c1)CCN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450627152	EG	On-Demand	Anodyne	MTNR1B	24	47
COc1ccc2c(c1)CCN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450627152	EG	On-Demand	Anodyne	CYP2D6	0	40
COc1ccc2c(c1)CCN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450627154	EG	On-Demand	Anodyne	DRD5	31	45
COc1ccc2c(c1)CCN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450627154	EG	On-Demand	Anodyne	MTNR1B	24	47
COc1ccc2c(c1)CCN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450627154	EG	On-Demand	Anodyne	CYP2D6	0	40
COc1ccc2c(c1)CCN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450627155	EG	On-Demand	Anodyne	DRD5	31	45
COc1ccc2c(c1)CCN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450627155	EG	On-Demand	Anodyne	MTNR1B	24	47
COc1ccc2c(c1)CCN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450627155	EG	On-Demand	Anodyne	CYP2D6	0	40
N#Cc1cccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1Br	ZINC000450627156	GD	On-Demand	Mild	MTNR1A	0	40
N#Cc1cccc(C(=O)N2CC[C@H](NC(=O)NC3CC3)C2)c1Br	ZINC000450627156	GD	On-Demand	Mild	MTNR1B	0	40
COc1ccc2c(c1)CCN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450627158	EG	On-Demand	Anodyne	DRD5	31	45
COc1ccc2c(c1)CCN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450627158	EG	On-Demand	Anodyne	MTNR1B	24	47
COc1ccc2c(c1)CCN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450627158	EG	On-Demand	Anodyne	CYP2D6	0	40
CN(C)C(=O)[C@@H]1CC[C@@H](CNC(=O)CNC(=O)Nc2cccc(Cl)c2)O1	ZINC000450627162	GD	On-Demand	Anodyne	PSBA	0	43
COc1cc(CN2CCC(O)(C(F)(F)F)CC2)ccc1Cl	ZINC000450627172	DG	On-Demand	Anodyne	SSTR5	43	35
c1ccc2[nH]c(CN3CCN(CCc4cscn4)CC3)nc2c1	ZINC000450627177	EE	On-Demand	Anodyne	DRD4	15	56
Clc1ccc(CCN2CCC[C@H]2c2ccncc2)cc1	ZINC000450627178	CI	On-Demand	Anodyne	HRH3	39	44
COc1cc(CN(C[C@@H](O)[C@H](C)c2ccccc2)C2CC2)ccc1O	ZINC000450627179	EH	On-Demand	Anodyne	TTR	0	42
Clc1ccc(CCN2CCC[C@@H]2c2ccncc2)cc1	ZINC000450627180	CI	On-Demand	Anodyne	HRH3	39	44
Cc1cc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)ccn1	ZINC000450627186	EF	On-Demand	Anodyne	PDE6A	41	31
COc1cc(CN(C[C@@H](O)[C@@H](C)c2ccccc2)C2CC2)ccc1O	ZINC000450627187	EH	On-Demand	Anodyne	TTR	0	42
COc1cc(CN(C[C@H](O)[C@H](C)c2ccccc2)C2CC2)ccc1O	ZINC000450627188	EH	On-Demand	Anodyne	TTR	0	42
COc1cc(CN(C[C@H](O)[C@@H](C)c2ccccc2)C2CC2)ccc1O	ZINC000450627190	EH	On-Demand	Anodyne	TTR	0	42
CN(C)C(=O)[C@@H]1CC[C@H](CNC(=O)CNC(=O)Nc2cccc(Cl)c2)O1	ZINC000450627192	GD	On-Demand	Anodyne	PSBA	0	43
CN(C)C(=O)[C@H]1CC[C@@H](CNC(=O)CNC(=O)Nc2cccc(Cl)c2)O1	ZINC000450627198	GD	On-Demand	Anodyne	PSBA	0	43
CN(C)C(=O)[C@H]1CC[C@H](CNC(=O)CNC(=O)Nc2cccc(Cl)c2)O1	ZINC000450627200	GD	On-Demand	Anodyne	PSBA	0	43
COC(=O)CCN1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H](C)C1	ZINC000450627212	GD	On-Demand	Anodyne	CCR1	23	42
COC(=O)CCN1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@H](C)C1	ZINC000450627212	GD	On-Demand	Anodyne	EPHX2	17	44
COC(=O)CCN1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H](C)C1	ZINC000450627217	GD	On-Demand	Anodyne	CCR1	23	42
COC(=O)CCN1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)[C@@H](C)C1	ZINC000450627217	GD	On-Demand	Anodyne	EPHX2	17	44
CC1(CO)CCN(C(=O)c2cc3c(Br)cccc3cn2)CC1	ZINC000450627222	FG	On-Demand	Anodyne	CCR5	47	35
COc1ccc(-c2noc(CN3CCC[C@H]3c3cccnc3)n2)nn1	ZINC000450627230	EE	On-Demand	Anodyne	CHRNA2	41	42
COc1ccc(-c2noc(CN3CCC[C@@H]3c3cccnc3)n2)nn1	ZINC000450627234	EE	On-Demand	Anodyne	CHRNA2	41	42
Clc1cccc(O[C@H]2CCN(Cc3cn(CC4CC4)nn3)C2)c1	ZINC000450627238	EF	On-Demand	Anodyne	HRH1	0	43
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450627241	GE	On-Demand	Bother	SLC6A9	37	42
Clc1cccc(O[C@@H]2CCN(Cc3cn(CC4CC4)nn3)C2)c1	ZINC000450627242	EF	On-Demand	Anodyne	HRH1	0	43
Cc1ccn(-c2ccccc2C(=O)NC[C@@]2(O)CCN(C)C2)n1	ZINC000450627247	DC	On-Demand	Anodyne	HCN1	54	33
Cc1ccn(-c2ccccc2C(=O)NC[C@@]2(O)CCN(C)C2)n1	ZINC000450627247	DC	On-Demand	Anodyne	HCN4	51	33
CCC1(CNC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])CCCCC1	ZINC000450627259	EH	On-Demand	Bother	HCN1	54	37
CCC1(CNC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])CCCCC1	ZINC000450627259	EH	On-Demand	Bother	HCN4	50	35
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450627260	GH	On-Demand	Anodyne	CCKAR	44	34
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450627263	GH	On-Demand	Anodyne	CCKAR	44	34
c1cncc([C@H]2CCCN2C[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450627264	CF	On-Demand	Anodyne	CHRNA2	51	52
c1cncc([C@H]2CCCN2C[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450627264	CF	On-Demand	Anodyne	CRTY	0	52
c1cncc([C@@H]2CCCN2C[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450627268	CF	On-Demand	Anodyne	CHRNA2	51	52
c1cncc([C@@H]2CCCN2C[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450627268	CF	On-Demand	Anodyne	CRTY	0	52
c1cncc([C@@H]2CCCN2C[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450627271	CF	On-Demand	Anodyne	CHRNA2	51	52
c1cncc([C@@H]2CCCN2C[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450627271	CF	On-Demand	Anodyne	CRTY	0	52
c1cncc([C@H]2CCCN2C[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450627274	CF	On-Demand	Anodyne	CHRNA2	51	52
c1cncc([C@H]2CCCN2C[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450627274	CF	On-Demand	Anodyne	CRTY	0	52
COC(=O)c1csc(CN2CCc3ccc(OC)cc3CC2)n1	ZINC000450627276	EF	On-Demand	Anodyne	ABCB1	24	42
CSc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1C	ZINC000450627281	FI	On-Demand	Anodyne	ANPEP	35	43
CSc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1C	ZINC000450627281	FI	On-Demand	Anodyne	CAPN1	31	42
CSc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1C	ZINC000450627281	FI	On-Demand	Anodyne	FPR1	65	36
CCC[C@H](O)CN1CCc2ccc(OC)cc2CC1	ZINC000450627282	CE	On-Demand	Anodyne	MTNR1B	23	40
CCC[C@@H](O)CN1CCc2ccc(OC)cc2CC1	ZINC000450627283	CE	On-Demand	Anodyne	MTNR1B	23	40
COC1(CSc2nnnn2-c2ccccc2)CCC1	ZINC000450627287	CE	On-Demand	Anodyne	CELA2A	31	43
CCOC(=O)c1cc(C(=O)N2CCN(c3cccc(C#N)n3)CC2)[nH]c1C	ZINC000450627288	FD	On-Demand	Mild	P2RY12	55	42
CC(C)c1n[nH]c(CNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)n1	ZINC000450627289	GC	On-Demand	Anodyne	PDE5A	20	40
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cnc(C2CC2)nc1	ZINC000450627310	EG	On-Demand	Anodyne	CCKAR	48	36
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cnc(C2CC2)nc1	ZINC000450627312	EG	On-Demand	Anodyne	CCKAR	48	36
Cc1ccn(-c2ccccc2C(=O)NC[C@]2(O)CCN(C)C2)n1	ZINC000450627315	DC	On-Demand	Anodyne	HCN1	54	33
Cc1ccn(-c2ccccc2C(=O)NC[C@]2(O)CCN(C)C2)n1	ZINC000450627315	DC	On-Demand	Anodyne	HCN4	51	33
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCCC[C@H](C)O	ZINC000450627318	GJ	On-Demand	Anodyne	KCNMA1	19	44
COc1ccc2c(c1)CCN(Cc1ccn(CC(F)(F)F)n1)CC2	ZINC000450627322	EG	On-Demand	Anodyne	DRD5	16	41
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCCC[C@@H](C)O	ZINC000450627329	GJ	On-Demand	Anodyne	KCNMA1	19	44
CC(C)(CO)CCN=c1ccc(C(=O)N2CCc3ccccc32)c[nH]1	ZINC000450627336	EF	On-Demand	Anodyne	AVPR2	37	41
CN1CC[C@](O)(CNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450627348	GC	On-Demand	Mild	TRPV4	42	33
CN1CC[C@@](O)(CNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450627354	GC	On-Demand	Mild	TRPV4	42	33
CN1CC[C@@](O)(CNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450627356	GC	On-Demand	Mild	TRPV4	42	33
CN1CC[C@](O)(CNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450627358	GC	On-Demand	Mild	TRPV4	42	33
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	ESR1	80	39
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	HRH2	49	40
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	ESR2	55	40
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	LTA4H	75	50
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	HRH3	73	49
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	MMP13	22	45
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	ADAM17	17	44
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	MMP1	16	45
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	PSMB2	58	50
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	PSMB5	20	50
CNS(=O)(=O)NCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000450627360	GB	On-Demand	Anodyne	PSMB1	50	50
CCC[C@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450627366	BE	On-Demand	Anodyne	CHRNA2	53	54
CCC[C@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450627366	BE	On-Demand	Anodyne	CHRNA3	15	54
CCC[C@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450627366	BE	On-Demand	Anodyne	Q8WSF8_APLCA	16	54
CCC[C@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450627366	BE	On-Demand	Anodyne	CRTY	0	54
CCC[C@@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450627368	BE	On-Demand	Anodyne	CHRNA2	53	54
CCC[C@@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450627368	BE	On-Demand	Anodyne	CHRNA3	15	54
CCC[C@@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450627368	BE	On-Demand	Anodyne	Q8WSF8_APLCA	16	54
CCC[C@@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450627368	BE	On-Demand	Anodyne	CRTY	0	54
CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450627373	EH	On-Demand	Anodyne	CA7	19	44
CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450627373	EH	On-Demand	Anodyne	MMP13	35	44
CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450627373	EH	On-Demand	Anodyne	ADAM17	36	42
CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450627373	EH	On-Demand	Anodyne	MMP2	25	44
CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450627373	EH	On-Demand	Anodyne	MMP14	23	44
CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450627373	EH	On-Demand	Anodyne	MMP9	22	40
CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450627373	EH	On-Demand	Anodyne	ADAMTS4	55	45
COCCOC[C@@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450627379	EC	On-Demand	Anodyne	ACOX1	64	32
COCCOC[C@@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450627379	EC	On-Demand	Anodyne	ABCB1	46	34
COCCOC[C@@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450627379	EC	On-Demand	Anodyne	HSP90AB1	41	44
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1ccc2cnccc2c1	ZINC000450627381	EE	On-Demand	Anodyne	AKT1	17	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1ccc2cnccc2c1	ZINC000450627381	EE	On-Demand	Anodyne	CYP17A1	21	40
COCCOC[C@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450627383	EC	On-Demand	Anodyne	ACOX1	64	32
COCCOC[C@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450627383	EC	On-Demand	Anodyne	ABCB1	46	34
COCCOC[C@H](O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450627383	EC	On-Demand	Anodyne	HSP90AB1	41	44
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1ccc2cnccc2c1	ZINC000450627384	EE	On-Demand	Anodyne	AKT1	17	40
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1ccc2cnccc2c1	ZINC000450627384	EE	On-Demand	Anodyne	CYP17A1	21	40
Cn1nc(C(=O)N2CCCC[C@H]2c2ccccc2)c2c1CCCC2	ZINC000450627393	DH	On-Demand	Anodyne	COLA	85	39
Cn1nc(C(=O)N2CCCC[C@@H]2c2ccccc2)c2c1CCCC2	ZINC000450627394	DH	On-Demand	Anodyne	COLA	85	39
Cn1nc(C(=O)N2CCCC[C@@H]2c2ccccc2)c2c1CCCC2	ZINC000450627394	DH	On-Demand	Anodyne	CPT1A	81	39
COC(=O)c1cn([C@H]2CCCN(C(=O)[C@H](C)OCc3ccc(F)cc3)C2)nn1	ZINC000450627399	GD	On-Demand	Anodyne	CCR3	104	35
COC(=O)c1cn([C@H]2CCCN(C(=O)[C@@H](C)OCc3ccc(F)cc3)C2)nn1	ZINC000450627400	GD	On-Demand	Anodyne	CCR3	104	35
COC(=O)c1cn([C@@H]2CCCN(C(=O)[C@@H](C)OCc3ccc(F)cc3)C2)nn1	ZINC000450627401	GD	On-Demand	Anodyne	CCR3	104	35
COC(=O)c1cn([C@@H]2CCCN(C(=O)[C@H](C)OCc3ccc(F)cc3)C2)nn1	ZINC000450627402	GD	On-Demand	Anodyne	CCR3	104	35
CN(CCc1ccccn1)Cc1ccn(CCc2ccccc2)n1	ZINC000450627407	DG	On-Demand	Anodyne	GNRHR	26	43
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC(F)F)cc1	ZINC000450627408	GF	On-Demand	Anodyne	FOLH1	41	42
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC(F)F)cc1	ZINC000450627408	GF	On-Demand	Anodyne	TRPV1	34	45
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC(F)F)cc1	ZINC000450627408	GF	On-Demand	Anodyne	NCE103	24	40
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC(F)F)cc1	ZINC000450627408	GF	On-Demand	Anodyne	CAN2	0	40
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC(F)F)cc1	ZINC000450627409	GF	On-Demand	Anodyne	FOLH1	41	42
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC(F)F)cc1	ZINC000450627409	GF	On-Demand	Anodyne	TRPV1	34	45
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC(F)F)cc1	ZINC000450627409	GF	On-Demand	Anodyne	NCE103	24	40
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC(F)F)cc1	ZINC000450627409	GF	On-Demand	Anodyne	CAN2	0	40
CSc1cccc(NC(=O)[C@@]2(C)CC=CCC2)c1C	ZINC000450627425	CI	On-Demand	Anodyne	CETP	0	45
CSc1cccc(NC(=O)[C@]2(C)CC=CCC2)c1C	ZINC000450627426	CI	On-Demand	Anodyne	CETP	0	45
CC[C@@H](CC(F)(F)F)NC(=O)CCc1ccc2ccccc2c1O	ZINC000450627433	EI	On-Demand	Anodyne	KCNJ11	42	38
CC[C@H](CC(F)(F)F)NC(=O)CCc1ccc2ccccc2c1O	ZINC000450627434	EI	On-Demand	Anodyne	KCNJ11	42	38
COc1cc(CN2CCO[C@@H]3CC[C@H](OC)C[C@@H]32)ccc1Cl	ZINC000450627435	EG	On-Demand	Anodyne	SSTR5	42	36
COc1cc(CN2CCO[C@@H]3CC[C@@H](OC)C[C@H]32)ccc1Cl	ZINC000450627436	EG	On-Demand	Anodyne	SSTR5	42	36
COc1cc(CN2CCO[C@@H]3CC[C@H](OC)C[C@H]32)ccc1Cl	ZINC000450627437	EG	On-Demand	Anodyne	SSTR5	42	36
COc1cc(CN2CCO[C@@H]3CC[C@@H](OC)C[C@@H]32)ccc1Cl	ZINC000450627438	EG	On-Demand	Anodyne	SSTR5	42	36
COC1(C)CCN(C(=O)C2=C(c3ccccc3)CCCC2)CC1	ZINC000450627439	DI	On-Demand	Anodyne	CHRM5	36	41
CCC[C@H](OC)C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450627440	DD	On-Demand	Mild	P2RY12	70	33
CCC[C@@H](OC)C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000450627441	DD	On-Demand	Mild	P2RY12	70	33
CC(=O)c1ccccc1OCCC[C@H](C)O	ZINC000450627453	BE	On-Demand	Anodyne	GRM2	16	43
CC(=O)c1ccccc1OCCC[C@H](C)O	ZINC000450627453	BE	On-Demand	Anodyne	ABCB1	37	44
CC(=O)c1ccccc1OCCC[C@@H](C)O	ZINC000450627454	BE	On-Demand	Anodyne	GRM2	16	43
CC(=O)c1ccccc1OCCC[C@@H](C)O	ZINC000450627454	BE	On-Demand	Anodyne	ABCB1	37	44
CC(=O)CCCCCOc1ccccc1Cl	ZINC000450627457	BH	On-Demand	Anodyne	CXCL8	23	41
COC(=O)c1csc(CN2CCc3ccc(C(C)=O)cc3CC2)n1	ZINC000450627458	EF	On-Demand	Anodyne	NOD2	40	36
Clc1cccc2c(NCC3=CCOCC3)ccnc12	ZINC000450627477	CH	On-Demand	Anodyne	HNMT	41	34
CC(F)(F)CCSc1nc2ccccc2[nH]1	ZINC000450627482	BH	On-Demand	Anodyne	CYP1A2	17	41
CC(F)(F)CCSc1nc2ccccc2[nH]1	ZINC000450627482	BH	On-Demand	Anodyne	CYP2C19	34	49
CCC[C@H](O)CN1CCc2ccc(C(C)=O)cc2CC1	ZINC000450627483	CE	On-Demand	Anodyne	ABCB1	22	43
CCC[C@@H](O)CN1CCc2ccc(C(C)=O)cc2CC1	ZINC000450627484	CE	On-Demand	Anodyne	ABCB1	22	43
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1	ZINC000450627485	CG	On-Demand	Bother	PLA2G4B	80	41
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1	ZINC000450627485	CG	On-Demand	Bother	ACR	45	61
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1	ZINC000450627485	CG	On-Demand	Bother	MGLL	0	40
CC1=CCN(CCNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)CC1	ZINC000450627494	FE	On-Demand	Bother	DRD4	41	31
CC1=CCN(CCNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)CC1	ZINC000450627494	FE	On-Demand	Bother	PLD2	42	31
CC(=O)N1CCN(C(=O)c2cn(CCc3ccccc3)nn2)C(C)(C)C1	ZINC000450627525	FD	On-Demand	Anodyne	THYX_PBCV1	0	42
CC[C@@H](CC#N)NC(=O)c1ccc2cnccc2c1	ZINC000450627526	CF	On-Demand	Mild	AKT1	26	48
CC[C@H](CC#N)NC(=O)c1ccc2cnccc2c1	ZINC000450627540	CF	On-Demand	Mild	AKT1	26	48
COCCOCCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1	ZINC000450627542	FF	On-Demand	Anodyne	CHRM5	0	42
COc1ccc(CNC(=O)CCN(C)CCc2ccccn2)c(OC)c1	ZINC000450627547	FE	On-Demand	Anodyne	GNRHR	25	41
COc1ccc(CNC(=O)CCN(C)CCc2ccccn2)c(OC)c1	ZINC000450627547	FE	On-Demand	Anodyne	MTNR1A	61	40
COc1ccc(CNC(=O)CCN(C)CCc2ccccn2)c(OC)c1	ZINC000450627547	FE	On-Demand	Anodyne	MTNR1B	57	48
CCOC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)nc1	ZINC000450627548	EG	On-Demand	Anodyne	NR1H4	0	44
CCOC(=O)c1ccc(CN2CCc3c([nH]c4ccccc34)C2)nc1	ZINC000450627548	EG	On-Demand	Anodyne	NOD2	25	41
CCOCc1nc(C)c(C(=O)N2CCCC[C@H]2c2ccccc2)s1	ZINC000450627549	EI	On-Demand	Anodyne	CPT1A	104	37
CCOCc1nc(C)c(C(=O)N2CCCC[C@@H]2c2ccccc2)s1	ZINC000450627550	EI	On-Demand	Anodyne	CPT1A	104	37
FC(F)(F)Cn1ccc(CN2CCc3c([nH]c4ccccc34)C2)n1	ZINC000450627551	EG	On-Demand	Anodyne	DRD5	17	41
CN(C)CCNS(=O)(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450627558	GD	On-Demand	Bother	BDKRB1	0	47
CN(C)CCNS(=O)(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450627558	GD	On-Demand	Bother	BCL2L1	83	34
CN(C)CCNS(=O)(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450627558	GD	On-Demand	Bother	BCL2	78	34
COC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1Cl	ZINC000450627565	GF	On-Demand	Anodyne	SLC6A1	57	36
COC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1Cl	ZINC000450627565	GF	On-Demand	Anodyne	SLC6A3	41	39
COC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1Cl	ZINC000450627565	GF	On-Demand	Anodyne	HTR4	48	38
COC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1Cl	ZINC000450627565	GF	On-Demand	Anodyne	CCR3	36	40
COC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1Cl	ZINC000450627565	GF	On-Demand	Anodyne	GLRA1	44	33
COC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1Cl	ZINC000450627565	GF	On-Demand	Anodyne	CXCR3	24	40
COC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cc1Cl	ZINC000450627565	GF	On-Demand	Anodyne	MCHR1	32	42
COC(=O)C1(NCCC(=O)NCc2ccc(OC)cc2OC)CCCC1	ZINC000450627567	FD	On-Demand	Anodyne	MTNR1A	66	41
COC(=O)C1(NCCC(=O)NCc2ccc(OC)cc2OC)CCCC1	ZINC000450627567	FD	On-Demand	Anodyne	MTNR1B	53	41
CC(=O)CCCCCOc1cccc(Cl)c1	ZINC000450627573	BH	On-Demand	Anodyne	THRA	33	44
CC(=O)CCCCCOc1cccc(Cl)c1	ZINC000450627573	BH	On-Demand	Anodyne	MAOB	29	43
CC(=O)CCCCCOc1cccc(Cl)c1	ZINC000450627573	BH	On-Demand	Anodyne	P2RY12	23	42
CC(=O)CCCCCOc1cccc(Cl)c1	ZINC000450627573	BH	On-Demand	Anodyne	THRB	24	44
CC(=O)CCCCCOc1cccc(Cl)c1	ZINC000450627573	BH	On-Demand	Anodyne	MTNR1A	22	44
CC(=O)CCCCCOc1cccc(Cl)c1	ZINC000450627573	BH	On-Demand	Anodyne	MTNR1B	23	44
CC(=O)CCCCCOc1cccc(Cl)c1	ZINC000450627573	BH	On-Demand	Anodyne	PLA2G4B	68	43
CC(=O)CCCCCOc1cccc(Cl)c1	ZINC000450627573	BH	On-Demand	Anodyne	PDS	46	41
COc1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627591	FG	On-Demand	Anodyne	FKBP1A	56	36
COc1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627591	FG	On-Demand	Anodyne	COLA	103	36
COc1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627591	FG	On-Demand	Anodyne	CPT1A	95	36
COc1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627591	FG	On-Demand	Anodyne	CPT2	40	34
COc1ccc(C(=O)N2CCCC[C@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627591	FG	On-Demand	Anodyne	L3MBTL3	53	39
O=C(NC1Cc2ccccc2C1)[C@H]1CCN(c2ccccc2)C1	ZINC000450627592	DF	On-Demand	Anodyne	MTNR1B	0	40
O=C(NC1Cc2ccccc2C1)[C@H]1CCN(c2ccccc2)C1	ZINC000450627592	DF	On-Demand	Anodyne	EPHX2	27	44
O=C(NC1Cc2ccccc2C1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450627593	DF	On-Demand	Anodyne	MTNR1B	0	40
O=C(NC1Cc2ccccc2C1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450627593	DF	On-Demand	Anodyne	EPHX2	27	44
COc1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627595	FG	On-Demand	Anodyne	FKBP1A	56	36
COc1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627595	FG	On-Demand	Anodyne	COLA	103	36
COc1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627595	FG	On-Demand	Anodyne	CPT1A	95	36
COc1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627595	FG	On-Demand	Anodyne	CPT2	40	34
COc1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2)cc1S(C)(=O)=O	ZINC000450627595	FG	On-Demand	Anodyne	L3MBTL3	53	39
CCS(=O)(=O)c1ccc(CN2CCc3c(F)cccc3C2)cc1	ZINC000450627597	EG	On-Demand	Anodyne	NOD1	31	40
CCS(=O)(=O)c1ccc(CN2CCc3c(F)cccc3C2)cc1	ZINC000450627597	EG	On-Demand	Anodyne	NOD2	47	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627615	FG	On-Demand	Anodyne	MMP13	43	39
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627615	FG	On-Demand	Anodyne	APP	40	35
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627615	FG	On-Demand	Anodyne	MMP2	22	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627615	FG	On-Demand	Anodyne	MMP7	46	35
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627615	FG	On-Demand	Anodyne	MMP1	44	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627616	FG	On-Demand	Anodyne	MMP13	43	39
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627616	FG	On-Demand	Anodyne	APP	40	35
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627616	FG	On-Demand	Anodyne	MMP2	22	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627616	FG	On-Demand	Anodyne	MMP7	46	35
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)c3ccccc32)cc1	ZINC000450627616	FG	On-Demand	Anodyne	MMP1	44	40
CCOC(=O)CN(CCc1cscn1)[C@@H](C)c1ccccc1	ZINC000450627617	DG	On-Demand	Anodyne	BMP1	42	36
CCOC(=O)CN(CCc1cscn1)[C@H](C)c1ccccc1	ZINC000450627618	DG	On-Demand	Anodyne	BMP1	42	36
FC(F)(F)c1ccc2c(NCC3=CCOCC3)ccnc2c1	ZINC000450627622	DI	On-Demand	Anodyne	HRP1_PLAFA	69	32
FC(F)(F)c1ccc2c(NCC3=CCOCC3)ccnc2c1	ZINC000450627622	DI	On-Demand	Anodyne	HNMT	47	33
COc1cc(CN2CCN(C(=O)CO)CC2)ccc1Cl	ZINC000450627624	CC	On-Demand	Anodyne	DRD3	0	41
COc1cc(CN2CCN(C(=O)CO)CC2)ccc1Cl	ZINC000450627624	CC	On-Demand	Anodyne	OPRK1	29	43
COc1cc(CN2CCN(C(=O)CO)CC2)ccc1Cl	ZINC000450627624	CC	On-Demand	Anodyne	CCR1	57	44
COc1cc(CN2CCN(C(=O)CO)CC2)ccc1Cl	ZINC000450627624	CC	On-Demand	Anodyne	MGLL	0	43
COc1cc(CN2CCN(C(=O)CO)CC2)ccc1Cl	ZINC000450627624	CC	On-Demand	Anodyne	ABHD6	0	43
Cc1cccc(Cl)c1CN(C)[C@H](C)c1cccnc1	ZINC000450627628	CI	On-Demand	Anodyne	KCNA5	41	36
Cc1cccc(Cl)c1CN(C)[C@@H](C)c1cccnc1	ZINC000450627631	CI	On-Demand	Anodyne	KCNA5	41	36
CC(=O)N[C@H](C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1)C(C)(C)C	ZINC000450627661	DC	On-Demand	Anodyne	EPHX2	23	45
Fc1cc2nccc(NCC3=CCOCC3)c2cc1Cl	ZINC000450627662	CH	On-Demand	Anodyne	HRP1_PLAFA	101	36
Fc1cc2nccc(NCC3=CCOCC3)c2cc1Cl	ZINC000450627662	CH	On-Demand	Anodyne	HNMT	54	35
CC(=O)c1cccc(CSCC(C)C)c1	ZINC000450627663	BH	On-Demand	Anodyne	CACNA2D1	24	41
CC(=O)N[C@H](C(=O)N1CC[C@H](NC(=O)NC2CC2)C1)C(C)(C)C	ZINC000450627665	DC	On-Demand	Anodyne	EPHX2	23	45
Cc1cc(CNc2ccc(S(C)(=O)=O)cc2C(F)(F)F)ccn1	ZINC000450627667	EG	On-Demand	Anodyne	PTGS2	20	42
COC(=O)c1cn([C@@H]2CCCN(C(=O)c3ccc(C(F)(F)F)cc3C)C2)nn1	ZINC000450627669	GF	On-Demand	Anodyne	LIPG	44	32
COC(=O)c1cn([C@H]2CCCN(C(=O)c3ccc(C(F)(F)F)cc3C)C2)nn1	ZINC000450627670	GF	On-Demand	Anodyne	LIPG	44	32
CCc1cc(CCCN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)on1	ZINC000450627673	GG	On-Demand	Anodyne	CETP	0	43
CCc1cc(CCCN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)on1	ZINC000450627673	GG	On-Demand	Anodyne	CHRNA7	29	41
CCC(CC)(CCSc1nnnn1-c1ccccc1)C(=O)OC	ZINC000450627675	EG	On-Demand	Anodyne	CELA2A	32	43
CC1(CO)CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450627677	DH	On-Demand	Anodyne	ERBB2	27	43
CC1(CO)CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450627677	DH	On-Demand	Anodyne	MMP2	0	43
CC1(CO)CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450627677	DH	On-Demand	Anodyne	ADAM10	48	37
C1=C(CNc2cnc(-c3ccccc3)cn2)CCOC1	ZINC000450627685	CF	On-Demand	Anodyne	TPH1	30	46
C[C@H](CCCO)CNc1ccnc2cc(F)ccc12	ZINC000450627693	CG	On-Demand	Anodyne	HNMT	43	33
C[C@@H](CCCO)CNc1ccnc2cc(F)ccc12	ZINC000450627695	CG	On-Demand	Anodyne	HNMT	43	33
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@]2(O)CCN(C)C2)c1	ZINC000450627703	ED	On-Demand	Anodyne	HCN1	57	39
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@]2(O)CCN(C)C2)c1	ZINC000450627703	ED	On-Demand	Anodyne	HCN4	48	34
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@]2(O)CCN(C)C2)c1	ZINC000450627704	ED	On-Demand	Anodyne	HCN1	57	39
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@]2(O)CCN(C)C2)c1	ZINC000450627704	ED	On-Demand	Anodyne	HCN4	48	34
Clc1cccc(O[C@@H]2CCN(C[C@H]3COCCO3)C2)c1	ZINC000450627708	CE	On-Demand	Anodyne	HRH1	21	46
Clc1cccc(O[C@@H]2CCN(C[C@H]3COCCO3)C2)c1	ZINC000450627708	CE	On-Demand	Anodyne	CCR3	18	46
Clc1cccc(O[C@H]2CCN(C[C@H]3COCCO3)C2)c1	ZINC000450627709	CE	On-Demand	Anodyne	HRH1	21	46
Clc1cccc(O[C@H]2CCN(C[C@H]3COCCO3)C2)c1	ZINC000450627709	CE	On-Demand	Anodyne	CCR3	18	46
Clc1cccc(O[C@@H]2CCN(C[C@@H]3COCCO3)C2)c1	ZINC000450627711	CE	On-Demand	Anodyne	HRH1	21	46
Clc1cccc(O[C@@H]2CCN(C[C@@H]3COCCO3)C2)c1	ZINC000450627711	CE	On-Demand	Anodyne	CCR3	18	46
Clc1cccc(O[C@H]2CCN(C[C@@H]3COCCO3)C2)c1	ZINC000450627712	CE	On-Demand	Anodyne	HRH1	21	46
Clc1cccc(O[C@H]2CCN(C[C@@H]3COCCO3)C2)c1	ZINC000450627712	CE	On-Demand	Anodyne	CCR3	18	46
CCS(=O)(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1	ZINC000450627727	GF	On-Demand	Anodyne	DRD4	37	57
CCS(=O)(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1	ZINC000450627727	GF	On-Demand	Anodyne	ADORA2B	45	36
CC(C)c1nnc(CN2CCc3c([nH]c4ccccc34)C2)s1	ZINC000450627733	DH	On-Demand	Anodyne	DRD5	18	46
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450627734	DI	On-Demand	Anodyne	SCN2A	18	40
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450627734	DI	On-Demand	Anodyne	COLA	112	41
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450627734	DI	On-Demand	Anodyne	CPT1A	102	41
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450627734	DI	On-Demand	Anodyne	PREP	42	36
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450627734	DI	On-Demand	Anodyne	GRM5	20	44
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450627734	DI	On-Demand	Anodyne	SCN10A	24	40
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ccccc1	ZINC000450627734	DI	On-Demand	Anodyne	ABHD6	0	42
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627736	DI	On-Demand	Anodyne	SCN2A	18	40
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627736	DI	On-Demand	Anodyne	COLA	112	41
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627736	DI	On-Demand	Anodyne	CPT1A	102	41
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627736	DI	On-Demand	Anodyne	PREP	42	36
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627736	DI	On-Demand	Anodyne	GRM5	20	44
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627736	DI	On-Demand	Anodyne	SCN10A	24	40
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627736	DI	On-Demand	Anodyne	ABHD6	0	42
Cc1ccc(NC(=O)c2ccc(NCc3nc(C(C)C)n[nH]3)c([N+](=O)[O-])c2)cc1	ZINC000450627747	GI	On-Demand	Bother	DRTS_TOXGO	15	41
Cc1ccc(NC(=O)c2ccc(NCc3nc(C(C)C)n[nH]3)c([N+](=O)[O-])c2)cc1	ZINC000450627747	GI	On-Demand	Bother	TAAR1	20	47
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627754	ED	On-Demand	Anodyne	MME	56	35
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627754	ED	On-Demand	Anodyne	PAPA1_CARPA	56	47
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627754	ED	On-Demand	Anodyne	PAM	0	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627754	ED	On-Demand	Anodyne	FPR1	44	39
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627754	ED	On-Demand	Anodyne	POL	0	44
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627754	ED	On-Demand	Anodyne	AMP1_PLAFQ	48	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627756	ED	On-Demand	Anodyne	MME	56	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627756	ED	On-Demand	Anodyne	PAPA1_CARPA	56	47
CO[C@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627756	ED	On-Demand	Anodyne	PAM	0	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627756	ED	On-Demand	Anodyne	FPR1	44	39
CO[C@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627756	ED	On-Demand	Anodyne	POL	0	44
CO[C@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627756	ED	On-Demand	Anodyne	AMP1_PLAFQ	48	35
CO[C@@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627757	ED	On-Demand	Anodyne	MME	56	35
CO[C@@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627757	ED	On-Demand	Anodyne	PAPA1_CARPA	56	47
CO[C@@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627757	ED	On-Demand	Anodyne	PAM	0	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627757	ED	On-Demand	Anodyne	FPR1	44	39
CO[C@@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627757	ED	On-Demand	Anodyne	POL	0	44
CO[C@@H](Cc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450627757	ED	On-Demand	Anodyne	AMP1_PLAFQ	48	35
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450627758	GF	On-Demand	Bother	BDKRB1	22	41
C[C@H](CCCO)CNc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450627760	GF	On-Demand	Bother	BDKRB1	22	41
CO[C@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627761	ED	On-Demand	Anodyne	MME	56	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627761	ED	On-Demand	Anodyne	PAPA1_CARPA	56	47
CO[C@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627761	ED	On-Demand	Anodyne	PAM	0	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627761	ED	On-Demand	Anodyne	FPR1	44	39
CO[C@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627761	ED	On-Demand	Anodyne	POL	0	44
CO[C@H](Cc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450627761	ED	On-Demand	Anodyne	AMP1_PLAFQ	48	35
COc1cccc(-n2cc(C(=O)N3CCN(CC(F)(F)F)CC3(C)C)nn2)c1	ZINC000450627777	GE	On-Demand	Anodyne	DRD4	42	32
CC[C@H]1CN(c2ccccc2)CCN1C(=O)CCCc1ncc(C)o1	ZINC000450627797	EG	On-Demand	Anodyne	CCKAR	44	34
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)CCCc1ncc(C)o1	ZINC000450627799	EG	On-Demand	Anodyne	CCKAR	44	34
CCn1cc(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)c2ccccc21	ZINC000450627811	FG	On-Demand	Bother	CNR1	15	40
CCn1cc(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)c2ccccc21	ZINC000450627811	FG	On-Demand	Bother	FABI	52	33
CCn1cc(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)c2ccccc21	ZINC000450627811	FG	On-Demand	Bother	TPSAB1	26	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(O)(C(F)(F)F)CC1	ZINC000450627815	DF	On-Demand	Anodyne	OPRK1	0	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(O)(C(F)(F)F)CC1	ZINC000450627817	DF	On-Demand	Anodyne	OPRK1	0	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(O)(C(F)(F)F)CC1	ZINC000450627819	DF	On-Demand	Anodyne	OPRK1	0	43
COc1ccc(C(C)=O)c(OCc2ccnc(OC)n2)c1	ZINC000450627820	CE	On-Demand	Anodyne	MTNR1B	16	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(O)(C(F)(F)F)CC1	ZINC000450627821	DF	On-Demand	Anodyne	OPRK1	0	43
CCOC(=O)CSCC/C=C\c1ccccc1	ZINC000450627831	CG	On-Demand	Anodyne	CYSP_TRYCR	19	40
CCOC(=O)CSCC/C=C\c1ccccc1	ZINC000450627831	CG	On-Demand	Anodyne	CACNA1B	44	36
CO[C@@H]1CCC[C@H]1CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450627835	EF	On-Demand	Bother	SLC27A4	48	31
CO[C@H]1CCC[C@H]1CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450627836	EF	On-Demand	Bother	SLC27A4	48	31
CO[C@@H]1CCC[C@@H]1CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450627837	EF	On-Demand	Bother	SLC27A4	48	31
CO[C@H]1CCC[C@@H]1CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450627838	EF	On-Demand	Bother	SLC27A4	48	31
CCOC(=O)CSCC/C=C/c1ccccc1	ZINC000450627841	CG	On-Demand	Anodyne	CYSP_TRYCR	19	40
CCOC(=O)CSCC/C=C/c1ccccc1	ZINC000450627841	CG	On-Demand	Anodyne	CACNA1B	44	36
O=S(=O)(NCC1CC1)c1ccc(NCc2nc(C3CC3)n[nH]2)nc1	ZINC000450627842	ED	On-Demand	Anodyne	NPY1R	42	34
COc1cc(CC(=O)Nc2cnn(CC(=O)NCCO)c2)ccc1Cl	ZINC000450627855	FC	On-Demand	Anodyne	PDGFRB	32	45
COc1cc(CC(=O)Nc2cnn(CC(=O)NCCO)c2)ccc1Cl	ZINC000450627855	FC	On-Demand	Anodyne	FLT4	27	45
COc1cc(CC(=O)Nc2cnn(CC(=O)NCCO)c2)ccc1Cl	ZINC000450627855	FC	On-Demand	Anodyne	CAN2	0	42
COC(=O)c1ccc(C(=O)CSc2nnnn2C)o1	ZINC000450627857	CC	On-Demand	Anodyne	CMA1	24	41
COC(=O)C1(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)CC1	ZINC000450627860	ED	On-Demand	Anodyne	PIN1	23	40
COC(=O)C1(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)CC1	ZINC000450627860	ED	On-Demand	Anodyne	FABK	0	40
Cc1ccc(Br)cc1CN(C)[C@H](C)c1cccnc1	ZINC000450627861	DI	On-Demand	Anodyne	KCNA5	21	43
Cc1ccc(Br)cc1CN(C)[C@@H](C)c1cccnc1	ZINC000450627862	DI	On-Demand	Anodyne	KCNA5	21	43
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450627891	EE	On-Demand	Anodyne	ICAM1	41	35
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450627891	EE	On-Demand	Anodyne	VCAM1	40	33
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450627892	EE	On-Demand	Anodyne	ICAM1	41	35
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1cc2ccncc2s1	ZINC000450627892	EE	On-Demand	Anodyne	VCAM1	40	33
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1	ZINC000450627911	EG	On-Demand	Anodyne	CHRNA2	50	51
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1	ZINC000450627911	EG	On-Demand	Anodyne	NAMPT	43	37
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1	ZINC000450627911	EG	On-Demand	Anodyne	CRTY	0	51
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1	ZINC000450627912	EG	On-Demand	Anodyne	CHRNA2	50	51
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1	ZINC000450627912	EG	On-Demand	Anodyne	NAMPT	43	37
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1	ZINC000450627912	EG	On-Demand	Anodyne	CRTY	0	51
Cc1cncc(-c2nc(CN3CCC[C@H]3c3cccnc3)no2)c1	ZINC000450627914	DG	On-Demand	Anodyne	CHRNA2	43	44
Cc1cncc(-c2nc(CN3CCC[C@H]3c3cccnc3)no2)c1	ZINC000450627914	DG	On-Demand	Anodyne	CRTY	0	44
Cc1cncc(-c2nc(CN3CCC[C@@H]3c3cccnc3)no2)c1	ZINC000450627915	DG	On-Demand	Anodyne	CHRNA2	43	44
Cc1cncc(-c2nc(CN3CCC[C@@H]3c3cccnc3)no2)c1	ZINC000450627915	DG	On-Demand	Anodyne	CRTY	0	44
O=C(CCCN1C[C@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccccc1	ZINC000450627935	EH	On-Demand	Anodyne	CYP2J2	46	32
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccc(F)c(F)c1)c1ccccc1	ZINC000450627937	EH	On-Demand	Anodyne	CYP2J2	46	32
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccccc1	ZINC000450627938	EH	On-Demand	Anodyne	CYP2J2	46	32
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccc(F)c(F)c1)c1ccccc1	ZINC000450627939	EH	On-Demand	Anodyne	CYP2J2	46	32
CCc1cccc(C(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450627940	CI	On-Demand	Anodyne	ADAM17	36	40
CCc1cccc(C(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450627940	CI	On-Demand	Anodyne	COLA	119	39
CCc1cccc(C(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450627940	CI	On-Demand	Anodyne	CPT1A	115	39
CCc1cccc(C(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450627940	CI	On-Demand	Anodyne	PREP	55	36
CCc1cccc(C(=O)N2CCCC[C@@H]2c2ccccc2)n1	ZINC000450627940	CI	On-Demand	Anodyne	ABHD6	0	41
CCc1cccc(C(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450627941	CI	On-Demand	Anodyne	ADAM17	36	40
CCc1cccc(C(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450627941	CI	On-Demand	Anodyne	COLA	119	39
CCc1cccc(C(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450627941	CI	On-Demand	Anodyne	CPT1A	115	39
CCc1cccc(C(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450627941	CI	On-Demand	Anodyne	PREP	55	36
CCc1cccc(C(=O)N2CCCC[C@H]2c2ccccc2)n1	ZINC000450627941	CI	On-Demand	Anodyne	ABHD6	0	41
Cc1ccc2nc(SCC[C@H]3CCOC3)[nH]c2c1	ZINC000450627946	CG	On-Demand	Anodyne	CYP2C19	31	40
Cc1ccc2nc(SCC[C@@H]3CCOC3)[nH]c2c1	ZINC000450627947	CG	On-Demand	Anodyne	CYP2C19	31	40
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627948	FI	On-Demand	Anodyne	ADAM17	27	41
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627948	FI	On-Demand	Anodyne	COLA	121	44
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627948	FI	On-Demand	Anodyne	CPT1A	114	44
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627948	FI	On-Demand	Anodyne	CPT2	39	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627949	FI	On-Demand	Anodyne	ADAM17	27	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627949	FI	On-Demand	Anodyne	COLA	121	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627949	FI	On-Demand	Anodyne	CPT1A	114	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450627949	FI	On-Demand	Anodyne	CPT2	39	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCCC[C@H]1c1ccccc1	ZINC000450627950	FI	On-Demand	Anodyne	ADAM17	27	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCCC[C@H]1c1ccccc1	ZINC000450627950	FI	On-Demand	Anodyne	COLA	121	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCCC[C@H]1c1ccccc1	ZINC000450627950	FI	On-Demand	Anodyne	CPT1A	114	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCCC[C@H]1c1ccccc1	ZINC000450627950	FI	On-Demand	Anodyne	CPT2	39	44
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCCC[C@H]1c1ccccc1	ZINC000450627951	FI	On-Demand	Anodyne	ADAM17	27	41
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCCC[C@H]1c1ccccc1	ZINC000450627951	FI	On-Demand	Anodyne	COLA	121	44
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCCC[C@H]1c1ccccc1	ZINC000450627951	FI	On-Demand	Anodyne	CPT1A	114	44
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCCC[C@H]1c1ccccc1	ZINC000450627951	FI	On-Demand	Anodyne	CPT2	39	44
CCOC(=O)c1cc(C(=O)NC[C@@]2(O)CCN(C)C2)[nH]c1C	ZINC000450627961	DC	On-Demand	Anodyne	HCN1	40	35
CCOC(=O)c1cc(C(=O)NC[C@]2(O)CCN(C)C2)[nH]c1C	ZINC000450627962	DC	On-Demand	Anodyne	HCN1	40	35
CCCc1nc(C)c(COc2ccc([N+](=O)[O-])cc2Cl)o1	ZINC000450627983	DI	On-Demand	Bother	S1PR4	25	41
CCCc1nc(C)c(COc2ccc([N+](=O)[O-])cc2Cl)o1	ZINC000450627983	DI	On-Demand	Bother	ENR	0	47
CC[C@@H](C)[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450628007	FH	On-Demand	Anodyne	AVPR2	42	35
CC[C@@H](C)[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450628008	FH	On-Demand	Anodyne	AVPR2	42	35
CC[C@H](C)[C@@H](CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450628009	FH	On-Demand	Anodyne	AVPR2	42	35
CC[C@H](C)[C@H](CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450628012	FH	On-Demand	Anodyne	AVPR2	42	35
O=C(CN1CCN(Cc2ccccc2OC2CC2)CC1)Nc1ccccc1F	ZINC000450628014	GG	On-Demand	Anodyne	DRD4	21	50
O=C(CN1CCN(Cc2ccccc2OC2CC2)CC1)Nc1ccccc1F	ZINC000450628014	GG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(CN1CCN(Cc2ccccc2OC2CC2)CC1)Nc1ccccc1F	ZINC000450628014	GG	On-Demand	Anodyne	CCR3	30	41
CC1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CCC(=O)CC1	ZINC000450628017	FF	On-Demand	Anodyne	ESR1	74	40
CC1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CCC(=O)CC1	ZINC000450628017	FF	On-Demand	Anodyne	ESR2	44	39
CC1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CCC(=O)CC1	ZINC000450628017	FF	On-Demand	Anodyne	LTA4H	55	45
CC1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CCC(=O)CC1	ZINC000450628017	FF	On-Demand	Anodyne	HRH3	62	45
CC1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CCC(=O)CC1	ZINC000450628017	FF	On-Demand	Anodyne	PSMB2	57	46
CC1(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CCC(=O)CC1	ZINC000450628017	FF	On-Demand	Anodyne	PSMB1	49	46
C=CC[C@@H](CO)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450628019	CD	On-Demand	Mild	HPGDS	15	42
C=CC[C@H](CO)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450628023	CD	On-Demand	Mild	HPGDS	15	42
CC(C)Oc1cccc(CN(C)C[C@@H](C)S(C)(=O)=O)c1	ZINC000450628026	CE	On-Demand	Anodyne	ACHE	0	42
CC(C)Oc1cccc(CN(C)C[C@H](C)S(C)(=O)=O)c1	ZINC000450628028	CE	On-Demand	Anodyne	ACHE	0	42
CC(F)(F)CCOc1cccc([N+](=O)[O-])c1	ZINC000450628038	BG	On-Demand	Bother	CACNA1D	61	38
CC(F)(F)CCOc1cccc([N+](=O)[O-])c1	ZINC000450628038	BG	On-Demand	Bother	ACR	24	46
CC(F)(F)CCOc1cccc([N+](=O)[O-])c1	ZINC000450628038	BG	On-Demand	Bother	ATSA	0	45
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628060	GH	On-Demand	Anodyne	HRH1	39	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628060	GH	On-Demand	Anodyne	CCR3	40	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628060	GH	On-Demand	Anodyne	UTS2R	17	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628060	GH	On-Demand	Anodyne	MLNR	26	44
CCS(=O)(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628060	GH	On-Demand	Anodyne	MCHR1	18	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628061	GH	On-Demand	Anodyne	HRH1	39	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628061	GH	On-Demand	Anodyne	CCR3	40	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628061	GH	On-Demand	Anodyne	UTS2R	17	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628061	GH	On-Demand	Anodyne	MLNR	26	44
CCS(=O)(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)cc1	ZINC000450628061	GH	On-Demand	Anodyne	MCHR1	18	40
COC(=O)C1(NCc2nc(-c3ccc(OC)nn3)no2)CCCC1	ZINC000450628062	ED	On-Demand	Anodyne	NPPA	30	42
O=C(CCCN1CCCC[C@@H]1[C@@H](O)C(F)(F)F)c1ccccc1	ZINC000450628086	EG	On-Demand	Anodyne	SLC6A1	55	44
O=C(CCCN1CCCC[C@@H]1[C@@H](O)C(F)(F)F)c1ccccc1	ZINC000450628086	EG	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CCCC[C@H]1[C@@H](O)C(F)(F)F)c1ccccc1	ZINC000450628087	EG	On-Demand	Anodyne	SLC6A1	55	44
O=C(CCCN1CCCC[C@H]1[C@@H](O)C(F)(F)F)c1ccccc1	ZINC000450628087	EG	On-Demand	Anodyne	CYP2J2	56	40
CO[C@@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628088	CH	On-Demand	Anodyne	PPARG	30	47
CO[C@@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628088	CH	On-Demand	Anodyne	PPARA	33	47
CO[C@@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628088	CH	On-Demand	Anodyne	LTA4H	32	45
CO[C@@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628088	CH	On-Demand	Anodyne	SLC15A1	0	40
CO[C@@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628088	CH	On-Demand	Anodyne	PLA2G4B	44	36
CO[C@@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628088	CH	On-Demand	Anodyne	PDS	83	44
O=C(CCCN1CCCC[C@H]1[C@H](O)C(F)(F)F)c1ccccc1	ZINC000450628089	EG	On-Demand	Anodyne	SLC6A1	55	44
O=C(CCCN1CCCC[C@H]1[C@H](O)C(F)(F)F)c1ccccc1	ZINC000450628089	EG	On-Demand	Anodyne	CYP2J2	56	40
CO[C@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628090	CH	On-Demand	Anodyne	PPARG	30	47
CO[C@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628090	CH	On-Demand	Anodyne	PPARA	33	47
CO[C@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628090	CH	On-Demand	Anodyne	LTA4H	32	45
CO[C@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628090	CH	On-Demand	Anodyne	SLC15A1	0	40
CO[C@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628090	CH	On-Demand	Anodyne	PLA2G4B	44	36
CO[C@H](COc1ccc(C(C)=O)cc1)Cc1ccccc1	ZINC000450628090	CH	On-Demand	Anodyne	PDS	83	44
O=C(CCCN1CCCC[C@@H]1[C@H](O)C(F)(F)F)c1ccccc1	ZINC000450628091	EG	On-Demand	Anodyne	SLC6A1	55	44
O=C(CCCN1CCCC[C@@H]1[C@H](O)C(F)(F)F)c1ccccc1	ZINC000450628091	EG	On-Demand	Anodyne	CYP2J2	56	40
Cc1cc(CNc2cc(N3CCOCC3)ncn2)ccn1	ZINC000450628099	CD	On-Demand	Anodyne	HRH4	17	56
Cc1cc(CNc2cc(N3CCOCC3)ncn2)ccn1	ZINC000450628099	CD	On-Demand	Anodyne	EPHB4	71	36
Cc1cc(CNc2cc(N3CCOCC3)ncn2)ccn1	ZINC000450628099	CD	On-Demand	Anodyne	SMG1	45	38
COc1ccc(CNC(=O)CCN2CC=C(C)CC2)c(OC)c1	ZINC000450628100	DE	On-Demand	Anodyne	DRD4	42	33
COc1ccc(CNC(=O)CCN2CC=C(C)CC2)c(OC)c1	ZINC000450628100	DE	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CC=C(C)CC2)c(OC)c1	ZINC000450628100	DE	On-Demand	Anodyne	MTNR1A	52	37
C[C@@H]1CCC[C@@]1(C)C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000450628105	DF	On-Demand	Anodyne	SLC27A1	42	42
C[C@@H]1CCC[C@]1(C)C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000450628106	DF	On-Demand	Anodyne	SLC27A1	42	42
C[C@H]1CCC[C@]1(C)C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000450628107	DF	On-Demand	Anodyne	SLC27A1	42	42
C[C@H]1CCC[C@@]1(C)C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000450628108	DF	On-Demand	Anodyne	SLC27A1	42	42
NC(=O)c1cc([N+](=O)[O-])cnc1NCC1=CCOCC1	ZINC000450628125	CC	On-Demand	Bother	STAT6	42	30
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628152	FE	On-Demand	Anodyne	CHRM1	20	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628152	FE	On-Demand	Anodyne	SLC6A3	44	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628152	FE	On-Demand	Anodyne	CHRM4	20	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628152	FE	On-Demand	Anodyne	CHRM5	20	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628152	FE	On-Demand	Anodyne	GLRA1	41	32
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628153	FE	On-Demand	Anodyne	CHRM1	20	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628153	FE	On-Demand	Anodyne	SLC6A3	44	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628153	FE	On-Demand	Anodyne	CHRM4	20	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628153	FE	On-Demand	Anodyne	CHRM5	20	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628153	FE	On-Demand	Anodyne	GLRA1	41	32
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628154	FE	On-Demand	Anodyne	CHRM1	20	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628154	FE	On-Demand	Anodyne	SLC6A3	44	46
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628154	FE	On-Demand	Anodyne	CHRM4	20	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628154	FE	On-Demand	Anodyne	CHRM5	20	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628154	FE	On-Demand	Anodyne	GLRA1	41	32
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628155	FE	On-Demand	Anodyne	CHRM1	20	46
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628155	FE	On-Demand	Anodyne	SLC6A3	44	46
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628155	FE	On-Demand	Anodyne	CHRM4	20	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628155	FE	On-Demand	Anodyne	CHRM5	20	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450628155	FE	On-Demand	Anodyne	GLRA1	41	32
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cn2nccc2nc1C	ZINC000450628156	EF	On-Demand	Anodyne	CCKAR	53	37
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cn2nccc2nc1C	ZINC000450628157	EF	On-Demand	Anodyne	CCKAR	53	37
CCC(CC)Oc1ccc(C(=O)N2CCC[C@H](S(C)(=O)=O)C2)cc1	ZINC000450628158	FF	On-Demand	Anodyne	L3MBTL3	49	36
CCC(CC)Oc1ccc(C(=O)N2CCC[C@@H](S(C)(=O)=O)C2)cc1	ZINC000450628159	FF	On-Demand	Anodyne	L3MBTL3	49	36
Cc1nn(C)cc1COc1ccc(Br)cc1Cl	ZINC000450628174	DH	On-Demand	Anodyne	PTGER1	15	41
CCC(CC)(CNC(=O)[C@H]1CC1(F)F)c1ccc(OC)c(OC)c1	ZINC000450628176	EH	On-Demand	Anodyne	CACNA1G	37	43
CCC(CC)(CNC(=O)[C@@H]1CC1(F)F)c1ccc(OC)c(OC)c1	ZINC000450628177	EH	On-Demand	Anodyne	CACNA1G	37	43
Cc1ccc2c(n1)OCCN2C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450628189	FI	On-Demand	Anodyne	PRCP	54	40
Cc1ccc2c(n1)OCCN2C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450628191	FI	On-Demand	Anodyne	PRCP	54	40
Cc1ccc2c(n1)OCCN2C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450628192	FI	On-Demand	Anodyne	PRCP	54	40
Cc1ccc2c(n1)OCCN2C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450628193	FI	On-Demand	Anodyne	PRCP	54	40
O=C(CCSc1ccc(Br)cc1)NC(=O)NCCC(F)(F)F	ZINC000450628196	GH	On-Demand	Anodyne	FAS	29	41
C[C@@H](c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1)C(F)(F)F	ZINC000450628202	FI	On-Demand	Anodyne	DRD4	16	49
C[C@H](c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1)C(F)(F)F	ZINC000450628203	FI	On-Demand	Anodyne	DRD4	16	49
COCCO[C@H]1CCCN(Cc2c(C)cccc2Cl)C1	ZINC000450628207	CG	On-Demand	Anodyne	SLC6A1	75	40
COCCO[C@@H]1CCCN(Cc2c(C)cccc2Cl)C1	ZINC000450628208	CG	On-Demand	Anodyne	SLC6A1	75	40
O=C(Cn1cc(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cn1)NCCO	ZINC000450628213	GD	On-Demand	Anodyne	NAMPT	23	41
CC[C@H]1CN(c2ccccc2)CCN1C(=O)[C@@H]1CCCN(C)C1=O	ZINC000450628217	ED	On-Demand	Anodyne	HTR1A	25	41
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)[C@@H]1CCCN(C)C1=O	ZINC000450628218	ED	On-Demand	Anodyne	HTR1A	25	41
CC[C@H]1CN(c2ccccc2)CCN1C(=O)[C@H]1CCCN(C)C1=O	ZINC000450628220	ED	On-Demand	Anodyne	HTR1A	25	41
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)[C@H]1CCCN(C)C1=O	ZINC000450628222	ED	On-Demand	Anodyne	HTR1A	25	41
COC(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1Cl	ZINC000450628226	EH	On-Demand	Anodyne	OPRK1	24	56
COC(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1Cl	ZINC000450628226	EH	On-Demand	Anodyne	PTAFR	40	35
COC(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1Cl	ZINC000450628226	EH	On-Demand	Anodyne	CHRNA2	43	44
COC(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1Cl	ZINC000450628226	EH	On-Demand	Anodyne	CHRNA7	33	44
COC(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1Cl	ZINC000450628226	EH	On-Demand	Anodyne	GPBAR1	21	40
COC(=O)c1ccc(CN2CCC[C@H]2c2cccnc2)cc1Cl	ZINC000450628226	EH	On-Demand	Anodyne	CRTY	0	44
COC(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1Cl	ZINC000450628228	EH	On-Demand	Anodyne	OPRK1	24	56
COC(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1Cl	ZINC000450628228	EH	On-Demand	Anodyne	PTAFR	40	35
COC(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1Cl	ZINC000450628228	EH	On-Demand	Anodyne	CHRNA2	43	44
COC(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1Cl	ZINC000450628228	EH	On-Demand	Anodyne	CHRNA7	33	44
COC(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1Cl	ZINC000450628228	EH	On-Demand	Anodyne	GPBAR1	21	40
COC(=O)c1ccc(CN2CCC[C@@H]2c2cccnc2)cc1Cl	ZINC000450628228	EH	On-Demand	Anodyne	CRTY	0	44
CC[C@H](CSC)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450628234	DH	On-Demand	Anodyne	PDS	57	38
CC[C@@H](CSC)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450628235	DH	On-Demand	Anodyne	PDS	47	33
c1ccc(CCn2ccc(CN3CCCSCC3)n2)cc1	ZINC000450628241	DG	On-Demand	Anodyne	SIGMAR1	23	40
CSc1cccc(C(=O)N2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000450628243	DE	On-Demand	Anodyne	RHOA	0	48
CSc1cccc(C(=O)N2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000450628243	DE	On-Demand	Anodyne	L3MBTL1	0	40
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1cncc(Cl)c1	ZINC000450628244	DD	On-Demand	Anodyne	CACNA1I	45	35
CSc1cccc(C(=O)N2CCC[C@H](S(C)(=O)=O)C2)c1	ZINC000450628245	DE	On-Demand	Anodyne	RHOA	0	48
CSc1cccc(C(=O)N2CCC[C@H](S(C)(=O)=O)C2)c1	ZINC000450628245	DE	On-Demand	Anodyne	L3MBTL1	0	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1cncc(Cl)c1	ZINC000450628249	DD	On-Demand	Anodyne	CACNA1I	45	35
O=c1c(Cl)c(Cl)cnn1Cc1ccn(CC(F)(F)F)n1	ZINC000450628252	EE	On-Demand	Anodyne	NPBWR1	40	36
CC(=O)c1ccc(CSC2CCCC2)cc1	ZINC000450628262	BI	On-Demand	Anodyne	QRFPR	44	38
COc1cc(CN2CCC[C@H]2c2cccnc2)ccc1Cl	ZINC000450628274	DI	On-Demand	Anodyne	CHRNA2	47	48
COc1cc(CN2CCC[C@H]2c2cccnc2)ccc1Cl	ZINC000450628274	DI	On-Demand	Anodyne	CRTY	0	48
COc1cc(CN2CCC[C@@H]2c2cccnc2)ccc1Cl	ZINC000450628283	DI	On-Demand	Anodyne	CHRNA2	47	48
COc1cc(CN2CCC[C@@H]2c2cccnc2)ccc1Cl	ZINC000450628283	DI	On-Demand	Anodyne	CRTY	0	48
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2cccnc2)c(OC)c1	ZINC000450628287	FF	On-Demand	Anodyne	KCNA5	22	42
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2cccnc2)c(OC)c1	ZINC000450628287	FF	On-Demand	Anodyne	MTNR1B	25	40
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2cccnc2)c(OC)c1	ZINC000450628289	FF	On-Demand	Anodyne	KCNA5	22	42
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2cccnc2)c(OC)c1	ZINC000450628289	FF	On-Demand	Anodyne	MTNR1B	25	40
CC(C)N1CCCC[C@@H]1CN1CCC[C@H]1c1cccnc1	ZINC000450628294	CG	On-Demand	Anodyne	CHRNA2	54	55
CC(C)N1CCCC[C@@H]1CN1CCC[C@H]1c1cccnc1	ZINC000450628294	CG	On-Demand	Anodyne	CRTY	0	55
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H]1c1cccnc1	ZINC000450628295	CG	On-Demand	Anodyne	CHRNA2	54	55
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H]1c1cccnc1	ZINC000450628295	CG	On-Demand	Anodyne	CRTY	0	55
CC(C)N1CCCC[C@H]1CN1CCC[C@H]1c1cccnc1	ZINC000450628296	CG	On-Demand	Anodyne	CHRNA2	54	55
CC(C)N1CCCC[C@H]1CN1CCC[C@H]1c1cccnc1	ZINC000450628296	CG	On-Demand	Anodyne	CRTY	0	55
CC(C)N1CCCC[C@H]1CN1CCC[C@@H]1c1cccnc1	ZINC000450628297	CG	On-Demand	Anodyne	CHRNA2	54	55
CC(C)N1CCCC[C@H]1CN1CCC[C@@H]1c1cccnc1	ZINC000450628297	CG	On-Demand	Anodyne	CRTY	0	55
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cc2cccnc2s1	ZINC000450628304	FI	On-Demand	Anodyne	CCKAR	55	38
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cc2cccnc2s1	ZINC000450628305	FI	On-Demand	Anodyne	CCKAR	55	38
O=C(Cn1cc(NC(=O)C2=C(c3ccccc3)CCCC2)cn1)NCCO	ZINC000450628308	FD	On-Demand	Anodyne	ITK	42	35
O=C(Cn1cc(NC(=O)C2=C(c3ccccc3)CCCC2)cn1)NCCO	ZINC000450628308	FD	On-Demand	Anodyne	PANC	53	35
CC(C)(CO)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000450628317	CF	On-Demand	Anodyne	UTS2R	24	47
C1=C(CN2CCC[C@H]2c2cccnc2)CCCC1	ZINC000450628330	BH	On-Demand	Anodyne	CHRNA2	51	52
C1=C(CN2CCC[C@H]2c2cccnc2)CCCC1	ZINC000450628330	BH	On-Demand	Anodyne	CHRNB4	0	52
C1=C(CN2CCC[C@H]2c2cccnc2)CCCC1	ZINC000450628330	BH	On-Demand	Anodyne	Q8WSF8_APLCA	15	52
C1=C(CN2CCC[C@H]2c2cccnc2)CCCC1	ZINC000450628330	BH	On-Demand	Anodyne	CRTY	0	52
C1=C(CN2CCC[C@@H]2c2cccnc2)CCCC1	ZINC000450628331	BH	On-Demand	Anodyne	CHRNA2	51	52
C1=C(CN2CCC[C@@H]2c2cccnc2)CCCC1	ZINC000450628331	BH	On-Demand	Anodyne	CHRNB4	0	52
C1=C(CN2CCC[C@@H]2c2cccnc2)CCCC1	ZINC000450628331	BH	On-Demand	Anodyne	Q8WSF8_APLCA	15	52
C1=C(CN2CCC[C@@H]2c2cccnc2)CCCC1	ZINC000450628331	BH	On-Demand	Anodyne	CRTY	0	52
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628332	FF	On-Demand	Anodyne	PPARD	25	43
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628333	FF	On-Demand	Anodyne	PPARD	25	43
CCS(=O)(=O)c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628355	FE	On-Demand	Anodyne	DRD4	25	53
CCS(=O)(=O)c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628355	FE	On-Demand	Anodyne	ADORA2B	44	35
CCS(=O)(=O)c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628355	FE	On-Demand	Anodyne	SIGMAR1	24	43
CCS(=O)(=O)c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628355	FE	On-Demand	Anodyne	NAMPT	53	42
O=C1c2ccccc2C(=O)N1CCCOCCc1ccccc1	ZINC000450628359	DF	On-Demand	Anodyne	ALDH1A1	53	50
O=C1c2ccccc2C(=O)N1CCCOCCc1ccccc1	ZINC000450628359	DF	On-Demand	Anodyne	ALDH3A1	27	50
O=C1c2ccccc2C(=O)N1CCCOCCc1ccccc1	ZINC000450628359	DF	On-Demand	Anodyne	17HSDCL	0	42
COc1ccc(OC(F)(F)F)c(C(=O)NCCN2CC=C(C)CC2)c1	ZINC000450628363	FF	On-Demand	Anodyne	DRD4	50	39
COc1ccc(OC(F)(F)F)c(C(=O)NCCN2CC=C(C)CC2)c1	ZINC000450628363	FF	On-Demand	Anodyne	DRD3	23	42
CC1=CCN(CCNC(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450628365	DF	On-Demand	Anodyne	DRD4	40	32
CC1=CCN(CCNC(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450628365	DF	On-Demand	Anodyne	PLD2	51	32
CC1=CCN(CCNC(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450628365	DF	On-Demand	Anodyne	HPGDS	40	34
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450628368	EH	On-Demand	Mild	ADAM10	36	41
C[C@H]1C[C@@]1(C#N)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450628369	EH	On-Demand	Mild	ADAM10	36	41
C[C@@H]1C[C@]1(C#N)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450628370	EH	On-Demand	Mild	ADAM10	36	41
C[C@H]1C[C@]1(C#N)C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450628371	EH	On-Demand	Mild	ADAM10	36	41
COc1cc2c(NCC3=CCOCC3)ccnc2cc1F	ZINC000450628382	CG	On-Demand	Anodyne	FLT1	15	41
CC1=CCN(CCNC(=O)c2ccc(C)c(Cl)c2Cl)CC1	ZINC000450628384	EH	On-Demand	Anodyne	DRD4	44	34
CC1=CCN(CCNC(=O)c2ccc(C)c(Cl)c2Cl)CC1	ZINC000450628384	EH	On-Demand	Anodyne	DRD3	17	41
C[C@@H](O)CCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628385	CF	On-Demand	Anodyne	HRH1	38	45
C[C@@H](O)CCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628385	CF	On-Demand	Anodyne	CHRNA10	28	44
C[C@H](O)CCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628386	CF	On-Demand	Anodyne	HRH1	38	45
C[C@H](O)CCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628386	CF	On-Demand	Anodyne	CHRNA10	28	44
C[C@@H](O)CCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628387	CF	On-Demand	Anodyne	HRH1	38	45
C[C@@H](O)CCN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628387	CF	On-Demand	Anodyne	CHRNA10	28	44
C[C@H](O)CCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628388	CF	On-Demand	Anodyne	HRH1	38	45
C[C@H](O)CCN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628388	CF	On-Demand	Anodyne	CHRNA10	28	44
COC(=O)C1(CN2CC[C@H](Oc3cccc(Cl)c3)C2)CC1	ZINC000450628390	DF	On-Demand	Anodyne	CCR3	33	43
COC(=O)C1(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)CC1	ZINC000450628391	DF	On-Demand	Anodyne	CCR3	33	43
CCc1ccc(NC(=O)CNS(=O)(=O)NC)cc1CC	ZINC000450628405	CC	On-Demand	Anodyne	CA4	17	41
O=[N+]([O-])c1ccc(OC[C@H]2CCCC2(F)F)cc1	ZINC000450628407	CG	On-Demand	Bother	SLC27A4	51	35
O=[N+]([O-])c1ccc(OC[C@@H]2CCCC2(F)F)cc1	ZINC000450628408	CG	On-Demand	Bother	SLC27A4	51	35
CN1CC[C@](O)(CNC(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450628410	DD	On-Demand	Anodyne	HCN1	45	34
CN1CC[C@@](O)(CNC(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450628412	DD	On-Demand	Anodyne	HCN1	45	34
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCC1=CCOCC1	ZINC000450628416	GD	On-Demand	Bother	DDIT3	0	40
CC(=O)c1ccccc1OCc1cn(C)nc1C	ZINC000450628419	BF	On-Demand	Anodyne	ABCB1	0	42
CC(=O)c1ccccc1OCc1cn(C)nc1C	ZINC000450628419	BF	On-Demand	Anodyne	MT-CYB	49	37
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	HTR1A	39	46
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	DRD2	40	43
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	DRD1	0	47
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	DRD4	46	36
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	HTR2A	18	40
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	HTR2C	15	41
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	ADRA1A	20	47
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	DRD3	49	41
COc1ccccc1Oc1ccc(C(=O)NCCN2CC=C(C)CC2)nc1	ZINC000450628423	FG	On-Demand	Anodyne	AP2S1	0	40
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450628443	DE	On-Demand	Anodyne	EPHX2	23	48
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450628445	DE	On-Demand	Anodyne	EPHX2	23	48
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450628447	DE	On-Demand	Anodyne	EPHX2	23	48
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450628448	DE	On-Demand	Anodyne	EPHX2	23	48
Cc1cc(CNc2cc(N3CCC[C@H](CO)C3)ncn2)ccn1	ZINC000450628450	DE	On-Demand	Anodyne	PRCP	18	44
Cc1cc(CNc2cc(N3CCC[C@H](CO)C3)ncn2)ccn1	ZINC000450628450	DE	On-Demand	Anodyne	HRH4	17	49
Cc1cc(CNc2cc(N3CCC[C@@H](CO)C3)ncn2)ccn1	ZINC000450628452	DE	On-Demand	Anodyne	PRCP	18	44
Cc1cc(CNc2cc(N3CCC[C@@H](CO)C3)ncn2)ccn1	ZINC000450628452	DE	On-Demand	Anodyne	HRH4	17	49
CCOC(=O)c1ccc(CN2CCc3ccc(C#N)cc32)nc1	ZINC000450628463	DF	On-Demand	Mild	P2RY12	45	40
Cc1cccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450628475	FH	On-Demand	Anodyne	HTR1B	24	40
Cc1cccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450628475	FH	On-Demand	Anodyne	P2RY12	21	41
Cc1cccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450628475	FH	On-Demand	Anodyne	NPY2R	33	40
Cc1cccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450628475	FH	On-Demand	Anodyne	PYGL	0	44
Cc1cccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450628475	FH	On-Demand	Anodyne	FAAH	23	50
Cc1cccc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450628475	FH	On-Demand	Anodyne	P2RY14	40	34
CC1=CCN(CCNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450628476	FG	On-Demand	Anodyne	SLC6A1	0	40
CC[C@@H]1C[C@H]1C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450628481	EI	On-Demand	Anodyne	ADAM10	43	46
CC[C@@H]1C[C@H]1C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450628481	EI	On-Demand	Anodyne	ADAM33	0	41
CC[C@@H]1C[C@H]1C(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450628481	EI	On-Demand	Anodyne	ADAM8	0	41
CC(C)(C(=O)NC1Cc2ccccc2C1)C1CCC1	ZINC000450628486	CG	On-Demand	Anodyne	AMY2	43	29
O=[N+]([O-])c1cccc(OC[C@H]2CCCC2(F)F)c1	ZINC000450628494	CG	On-Demand	Bother	CACNA1C	47	36
O=[N+]([O-])c1cccc(OC[C@H]2CCCC2(F)F)c1	ZINC000450628494	CG	On-Demand	Bother	CACNA1D	77	36
O=[N+]([O-])c1cccc(OC[C@H]2CCCC2(F)F)c1	ZINC000450628494	CG	On-Demand	Bother	CHRNA10	42	34
O=[N+]([O-])c1cccc(OC[C@H]2CCCC2(F)F)c1	ZINC000450628494	CG	On-Demand	Bother	ATSA	0	40
O=[N+]([O-])c1cccc(OC[C@@H]2CCCC2(F)F)c1	ZINC000450628495	CG	On-Demand	Bother	CACNA1C	47	36
O=[N+]([O-])c1cccc(OC[C@@H]2CCCC2(F)F)c1	ZINC000450628495	CG	On-Demand	Bother	CACNA1D	77	36
O=[N+]([O-])c1cccc(OC[C@@H]2CCCC2(F)F)c1	ZINC000450628495	CG	On-Demand	Bother	CHRNA10	42	34
O=[N+]([O-])c1cccc(OC[C@@H]2CCCC2(F)F)c1	ZINC000450628495	CG	On-Demand	Bother	ATSA	0	40
CC[C@H](CC(F)(F)F)NC(=O)c1ccc2cnccc2c1	ZINC000450628496	CH	On-Demand	Anodyne	AKT1	24	45
CC[C@@H](CC(F)(F)F)NC(=O)c1ccc2cnccc2c1	ZINC000450628497	CH	On-Demand	Anodyne	AKT1	24	45
CC(C)(CC(=O)CSc1nnnn1-c1ccccc1)C1CC1	ZINC000450628498	DG	On-Demand	Anodyne	CELA2A	31	43
CC1(CO)CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450628500	FE	On-Demand	Mild	HTR1D	15	44
CC1(CO)CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450628500	FE	On-Demand	Mild	HTR1B	17	44
CC1(CO)CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450628500	FE	On-Demand	Mild	GPR183	0	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(C)(CO)CC3)cc2)c1	ZINC000450628509	GG	On-Demand	Anodyne	CHRM3	18	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCC(C)(CO)CC3)cc2)c1	ZINC000450628509	GG	On-Demand	Anodyne	MMP13	15	45
CC1(CO)CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450628521	DE	On-Demand	Anodyne	ADAM10	45	40
CC1(CO)CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450628524	DE	On-Demand	Anodyne	ADAM10	45	40
CC(=O)[C@@](C)(O)CN(C)Cc1cccc(OC(C)C)c1	ZINC000450628540	CE	On-Demand	Anodyne	ACHE	0	43
CC(=O)[C@@](C)(O)CN(C)Cc1cccc(OC(C)C)c1	ZINC000450628540	CE	On-Demand	Anodyne	PTGES	0	40
CC(=O)[C@](C)(O)CN(C)Cc1cccc(OC(C)C)c1	ZINC000450628541	CE	On-Demand	Anodyne	ACHE	0	43
CC(=O)[C@](C)(O)CN(C)Cc1cccc(OC(C)C)c1	ZINC000450628541	CE	On-Demand	Anodyne	PTGES	0	40
CC(C)(CO)CCNc1ccnc2cc(F)ccc12	ZINC000450628550	CG	On-Demand	Anodyne	HRP1_PLAFA	95	35
CC(C)(CO)CCNc1ccnc2cc(F)ccc12	ZINC000450628550	CG	On-Demand	Anodyne	HNMT	53	37
CC(C)(CO)CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450628551	EE	On-Demand	Anodyne	LRRK2	28	42
CCN(CC)S(=O)(=O)c1ccc(NCC2=CCOCC2)c([N+](=O)[O-])c1	ZINC000450628564	FE	On-Demand	Bother	BDKRB1	23	42
C[C@@H](CCCO)CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450628573	EH	On-Demand	Bother	BDKRB1	0	41
C[C@@H](CCCO)CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450628573	EH	On-Demand	Bother	COLA	49	34
C[C@H](CCCO)CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450628574	EH	On-Demand	Bother	BDKRB1	0	41
C[C@H](CCCO)CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450628574	EH	On-Demand	Bother	COLA	49	34
CCc1cc(NCCC(C)(C)CO)n2ncnc2n1	ZINC000450628575	CD	On-Demand	Anodyne	DHOD	0	54
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450628576	EG	On-Demand	Anodyne	CCKAR	54	36
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450628576	EG	On-Demand	Anodyne	EPHB3	26	42
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450628577	EG	On-Demand	Anodyne	CCKAR	54	36
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450628577	EG	On-Demand	Anodyne	EPHB3	26	42
COc1nccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)n1	ZINC000450628584	ED	On-Demand	Anodyne	DRD4	21	53
C[C@H](c1ccc(Cn2ncc(Cl)c(Cl)c2=O)cc1)C(F)(F)F	ZINC000450628587	FI	On-Demand	Anodyne	NPBWR1	62	46
C[C@@H](c1ccc(Cn2ncc(Cl)c(Cl)c2=O)cc1)C(F)(F)F	ZINC000450628588	FI	On-Demand	Anodyne	NPBWR1	62	46
CC(F)(F)CCn1nnc(-c2cccc(C(F)(F)F)c2)n1	ZINC000450628592	DG	On-Demand	Anodyne	MVFR	0	40
CC(C)(CO)CCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450628617	FE	On-Demand	Anodyne	CA4	15	43
COCCO[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450628621	EF	On-Demand	Anodyne	SLC6A1	53	33
COCCO[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450628622	EF	On-Demand	Anodyne	SLC6A1	53	33
CCS(=O)(=O)c1ccc(CSCC(C)C)cc1	ZINC000450628624	CG	On-Demand	Anodyne	LTA4H	32	41
CC(F)(F)CCSCc1ccccc1	ZINC000450628640	BH	On-Demand	Anodyne	CACNA2D1	23	41
CO[C@@H](Cc1ccccc1)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450628644	FF	On-Demand	Anodyne	DRD4	19	54
CO[C@H](Cc1ccccc1)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450628645	FF	On-Demand	Anodyne	DRD4	19	54
C[C@H](Cn1nnc(-c2cccc(C(F)(F)F)c2)n1)S(C)(=O)=O	ZINC000450628646	ED	On-Demand	Anodyne	SCARB1	40	37
C[C@@H](Cn1nnc(-c2cccc(C(F)(F)F)c2)n1)S(C)(=O)=O	ZINC000450628647	ED	On-Demand	Anodyne	SCARB1	40	37
Cc1nn(C)cc1CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450628652	DD	On-Demand	Anodyne	DRD4	15	57
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	DRD2	27	54
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	DRD4	49	54
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	SLC6A3	19	43
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	HRH3	16	43
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	SIGMAR1	46	55
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	ABCC1	40	39
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	LSS	15	43
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	FAAH	20	40
Clc1ccc(CCN2CCN(Cc3cccnc3)CC2)cc1	ZINC000450628654	DG	On-Demand	Anodyne	NR1D1	18	40
CCC(CC)(CNC(=O)CSC1CC1)c1ccc(OC)c(OC)c1	ZINC000450628657	FH	On-Demand	Anodyne	QRFPR	40	33
CCC(CC)(CNC(=O)CSC1CC1)c1ccc(OC)c(OC)c1	ZINC000450628657	FH	On-Demand	Anodyne	ENPP1	48	29
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628661	FD	On-Demand	Anodyne	PAPA1_CARPA	44	38
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628661	FD	On-Demand	Anodyne	CTSG	26	41
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628661	FD	On-Demand	Anodyne	CTRB1	34	41
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628661	FD	On-Demand	Anodyne	CELA2A	27	41
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628661	FD	On-Demand	Anodyne	POL	0	40
C[C@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628662	FD	On-Demand	Anodyne	PAPA1_CARPA	44	38
C[C@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628662	FD	On-Demand	Anodyne	CTSG	26	41
C[C@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628662	FD	On-Demand	Anodyne	CTRB1	34	41
C[C@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628662	FD	On-Demand	Anodyne	CELA2A	27	41
C[C@H](OCCc1ccccc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450628662	FD	On-Demand	Anodyne	POL	0	40
C[C@@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628663	FD	On-Demand	Anodyne	PAPA1_CARPA	44	38
C[C@@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628663	FD	On-Demand	Anodyne	CTSG	26	41
C[C@@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628663	FD	On-Demand	Anodyne	CTRB1	34	41
C[C@@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628663	FD	On-Demand	Anodyne	CELA2A	27	41
C[C@@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628663	FD	On-Demand	Anodyne	POL	0	40
C[C@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628664	FD	On-Demand	Anodyne	PAPA1_CARPA	44	38
C[C@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628664	FD	On-Demand	Anodyne	CTSG	26	41
C[C@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628664	FD	On-Demand	Anodyne	CTRB1	34	41
C[C@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628664	FD	On-Demand	Anodyne	CELA2A	27	41
C[C@H](OCCc1ccccc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450628664	FD	On-Demand	Anodyne	POL	0	40
CCc1cc(NCc2nc(C3CC3)n[nH]2)n2ncnc2n1	ZINC000450628716	CD	On-Demand	Anodyne	DHOD	0	48
COc1ccc2c(c1)CCN(Cc1nnc(C3CC3)s1)CC2	ZINC000450628730	DG	On-Demand	Anodyne	DRD5	15	42
CCC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450628735	BF	On-Demand	Anodyne	THRA	42	45
CCC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450628735	BF	On-Demand	Anodyne	THRB	0	45
CCC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450628735	BF	On-Demand	Anodyne	HRH3	16	51
CCC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450628735	BF	On-Demand	Anodyne	PLA2G4B	79	41
CCC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450628736	BF	On-Demand	Anodyne	THRA	42	45
CCC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450628736	BF	On-Demand	Anodyne	THRB	0	45
CCC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450628736	BF	On-Demand	Anodyne	HRH3	16	51
CCC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450628736	BF	On-Demand	Anodyne	PLA2G4B	79	41
c1cncc([C@@H]2CCCN2CCc2cscn2)c1	ZINC000450628739	CF	On-Demand	Anodyne	CHRNA2	52	53
c1cncc([C@@H]2CCCN2CCc2cscn2)c1	ZINC000450628739	CF	On-Demand	Anodyne	CRTY	0	53
c1cncc([C@H]2CCCN2CCc2cscn2)c1	ZINC000450628740	CF	On-Demand	Anodyne	CHRNA2	52	53
c1cncc([C@H]2CCCN2CCc2cscn2)c1	ZINC000450628740	CF	On-Demand	Anodyne	CRTY	0	53
O=[N+]([O-])c1cccc2c(NCc3nc(C4CC4)n[nH]3)ccnc12	ZINC000450628741	DF	On-Demand	Bother	PRKCQ	42	34
CCOC(=O)c1c(NCc2nc(C3CC3)n[nH]2)nc2ccccc2c1C	ZINC000450628749	FF	On-Demand	Anodyne	GABRA1	20	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(Cc2cccnc2)CC1	ZINC000450628750	EE	On-Demand	Anodyne	DRD4	15	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(Cc2cccnc2)CC1	ZINC000450628750	EE	On-Demand	Anodyne	SLC6A3	16	52
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2cccnc2)CC1	ZINC000450628751	EE	On-Demand	Anodyne	DRD4	15	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2cccnc2)CC1	ZINC000450628751	EE	On-Demand	Anodyne	SLC6A3	16	52
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2cccnc2)CC1	ZINC000450628752	EE	On-Demand	Anodyne	DRD4	15	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(Cc2cccnc2)CC1	ZINC000450628752	EE	On-Demand	Anodyne	SLC6A3	16	52
C[C@H](c1ccccc1)[C@H](O)CN1CCN(Cc2cccnc2)CC1	ZINC000450628753	EE	On-Demand	Anodyne	DRD4	15	44
C[C@H](c1ccccc1)[C@H](O)CN1CCN(Cc2cccnc2)CC1	ZINC000450628753	EE	On-Demand	Anodyne	SLC6A3	16	52
CC[C@@H](CSC)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450628754	DG	On-Demand	Anodyne	TIMP3	65	33
CC[C@H](CSC)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450628755	DG	On-Demand	Anodyne	TIMP3	65	33
CC(=O)N1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C(C)(C)C1	ZINC000450628759	GE	On-Demand	Mild	HTR1B	16	40
C[C@@H]1CCC(=O)[C@H](Oc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000450628768	CG	On-Demand	Bother	ENR	0	41
C[C@H]1CCC(=O)[C@H](Oc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000450628769	CG	On-Demand	Bother	ENR	0	41
C[C@@H]1CCC(=O)[C@@H](Oc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000450628770	CG	On-Demand	Bother	ENR	0	41
C[C@H]1CCC(=O)[C@@H](Oc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000450628771	CG	On-Demand	Bother	ENR	0	41
CN(CCN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1)Cc1ccccc1	ZINC000450628774	FE	On-Demand	Anodyne	CHRM1	22	45
CN(CCN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1)Cc1ccccc1	ZINC000450628774	FE	On-Demand	Anodyne	SLC6A3	43	38
CN(CCN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1)Cc1ccccc1	ZINC000450628774	FE	On-Demand	Anodyne	SIGMAR1	58	46
CN(CCN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1)Cc1ccccc1	ZINC000450628774	FE	On-Demand	Anodyne	GLRA1	41	33
Cc1nn(C)c(C)c1CCCNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450628785	GF	On-Demand	Anodyne	HRH2	21	41
Cc1nn(C)c(C)c1CCCNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450628785	GF	On-Demand	Anodyne	P2RX7	34	44
COCCOC[C@H](O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628790	ED	On-Demand	Anodyne	HRH1	36	46
COCCOC[C@H](O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628790	ED	On-Demand	Anodyne	CCR3	36	40
COCCOC[C@H](O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628790	ED	On-Demand	Anodyne	HSP90AB1	36	49
COCCOC[C@@H](O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628791	ED	On-Demand	Anodyne	HRH1	36	46
COCCOC[C@@H](O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628791	ED	On-Demand	Anodyne	CCR3	36	40
COCCOC[C@@H](O)CN1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000450628791	ED	On-Demand	Anodyne	HSP90AB1	36	49
COCCOC[C@@H](O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628792	ED	On-Demand	Anodyne	HRH1	36	46
COCCOC[C@@H](O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628792	ED	On-Demand	Anodyne	CCR3	36	40
COCCOC[C@@H](O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628792	ED	On-Demand	Anodyne	HSP90AB1	36	49
COCCOC[C@H](O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628793	ED	On-Demand	Anodyne	HRH1	36	46
COCCOC[C@H](O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628793	ED	On-Demand	Anodyne	CCR3	36	40
COCCOC[C@H](O)CN1CC[C@H](Oc2cccc(Cl)c2)C1	ZINC000450628793	ED	On-Demand	Anodyne	HSP90AB1	36	49
CN1CC[C@](O)(CNC(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450628808	DC	On-Demand	Anodyne	CTSV	44	30
CN1CC[C@](O)(CNC(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450628808	DC	On-Demand	Anodyne	HCN1	44	34
CN1CC[C@@](O)(CNC(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450628809	DC	On-Demand	Anodyne	CTSV	44	30
CN1CC[C@@](O)(CNC(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450628809	DC	On-Demand	Anodyne	HCN1	44	34
N#C[C@@H]1CSCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450628813	DF	On-Demand	Mild	PREP	32	59
N#C[C@H]1CSCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450628814	DF	On-Demand	Mild	PREP	32	59
CC[C@@H](CC#N)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450628848	EG	On-Demand	Mild	CPT1A	43	30
CC[C@@H](CC#N)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450628848	EG	On-Demand	Mild	HPGD	42	54
CC[C@H](CC#N)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450628849	EG	On-Demand	Mild	CPT1A	43	30
CC[C@H](CC#N)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450628849	EG	On-Demand	Mild	HPGD	42	54
CCCOc1ccc(C(=O)N2CCN(c3cccc(C#N)n3)CC2)c(OC)c1	ZINC000450628859	GF	On-Demand	Mild	OXTR	15	40
CC[C@@H](C)[C@H](CNc1nn2c(C)nnc2c2ccccc12)OC	ZINC000450628864	DE	On-Demand	Anodyne	CREBBP	40	31
CC[C@@H](C)[C@H](CNc1nn2c(C)nnc2c2ccccc12)OC	ZINC000450628864	DE	On-Demand	Anodyne	BRD9	53	37
CC[C@@H](C)[C@@H](CNc1nn2c(C)nnc2c2ccccc12)OC	ZINC000450628865	DE	On-Demand	Anodyne	CREBBP	40	31
CC[C@@H](C)[C@@H](CNc1nn2c(C)nnc2c2ccccc12)OC	ZINC000450628865	DE	On-Demand	Anodyne	BRD9	53	37
CC[C@H](C)[C@H](CNc1nn2c(C)nnc2c2ccccc12)OC	ZINC000450628866	DE	On-Demand	Anodyne	CREBBP	40	31
CC[C@H](C)[C@H](CNc1nn2c(C)nnc2c2ccccc12)OC	ZINC000450628866	DE	On-Demand	Anodyne	BRD9	53	37
CC[C@H](C)[C@@H](CNc1nn2c(C)nnc2c2ccccc12)OC	ZINC000450628867	DE	On-Demand	Anodyne	CREBBP	40	31
CC[C@H](C)[C@@H](CNc1nn2c(C)nnc2c2ccccc12)OC	ZINC000450628867	DE	On-Demand	Anodyne	BRD9	53	37
CO[C@@H]1CC[C@@H]2OCCN(CCCC(=O)c3ccc(Br)cc3)[C@H]2C1	ZINC000450628878	GH	On-Demand	Anodyne	CYP2J2	49	35
CO[C@@H]1CC[C@@H]2OCCN(CCCC(=O)c3ccc(Br)cc3)[C@@H]2C1	ZINC000450628879	GH	On-Demand	Anodyne	CYP2J2	49	35
CO[C@@H]1CC[C@H]2OCCN(CCCC(=O)c3ccc(Br)cc3)[C@@H]2C1	ZINC000450628880	GH	On-Demand	Anodyne	CYP2J2	49	35
CO[C@@H]1CC[C@H]2OCCN(CCCC(=O)c3ccc(Br)cc3)[C@H]2C1	ZINC000450628881	GH	On-Demand	Anodyne	CYP2J2	49	35
CC(=O)c1cccc(CN2CCc3ccc(C(C)=O)cc3CC2)c1	ZINC000450628894	DH	On-Demand	Anodyne	DRD2	18	51
CC(=O)c1cccc(CN2CCc3ccc(C(C)=O)cc3CC2)c1	ZINC000450628894	DH	On-Demand	Anodyne	ACHE	24	45
CC(=O)c1cccc(CN2CCc3ccc(C(C)=O)cc3CC2)c1	ZINC000450628894	DH	On-Demand	Anodyne	CHRM3	19	47
CC(=O)c1cccc(CN2CCc3ccc(C(C)=O)cc3CC2)c1	ZINC000450628894	DH	On-Demand	Anodyne	SIGMAR1	36	41
CC(=O)c1cccc(CN2CCc3ccc(C(C)=O)cc3CC2)c1	ZINC000450628894	DH	On-Demand	Anodyne	AKR1C3	41	34
CC(=O)c1cccc(CN2CCc3ccc(C(C)=O)cc3CC2)c1	ZINC000450628894	DH	On-Demand	Anodyne	NOD2	45	38
CN(CCCC(=O)c1ccc(Br)cc1)C[C@H]1CCC[C@@H]1O	ZINC000450628896	FH	On-Demand	Anodyne	SHC	48	36
CN(CCCC(=O)c1ccc(Br)cc1)C[C@H]1CCC[C@H]1O	ZINC000450628897	FH	On-Demand	Anodyne	SHC	48	36
CN(CCCC(=O)c1ccc(Br)cc1)C[C@@H]1CCC[C@H]1O	ZINC000450628898	FH	On-Demand	Anodyne	SHC	48	36
CN(CCCC(=O)c1ccc(Br)cc1)C[C@@H]1CCC[C@@H]1O	ZINC000450628899	FH	On-Demand	Anodyne	SHC	48	36
COC(=O)c1cc(NC(=O)CCCC(=O)C(C)(C)C)ccc1Br	ZINC000450628902	GH	On-Demand	Anodyne	HDAC10	16	40
COC(=O)c1cc(NC(=O)CCCC(=O)C(C)(C)C)ccc1Br	ZINC000450628902	GH	On-Demand	Anodyne	HDAC3	18	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450628927	FF	On-Demand	Anodyne	CACNA1B	51	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450628927	FF	On-Demand	Anodyne	CCR2	59	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450628927	FF	On-Demand	Anodyne	EPHX2	48	49
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450628927	FF	On-Demand	Anodyne	MCHR1	26	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450628927	FF	On-Demand	Anodyne	LIPG	50	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450628928	FF	On-Demand	Anodyne	CACNA1B	51	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450628928	FF	On-Demand	Anodyne	CCR2	59	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450628928	FF	On-Demand	Anodyne	EPHX2	48	49
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450628928	FF	On-Demand	Anodyne	MCHR1	26	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450628928	FF	On-Demand	Anodyne	LIPG	50	36
CN1CCN(S(=O)(=O)c2ccc(NCCC(C)(C)CO)nc2)CC1	ZINC000450628937	FC	On-Demand	Anodyne	TGM2	24	44
CN1CCN(S(=O)(=O)c2ccc(NCCC(C)(C)CO)nc2)CC1	ZINC000450628937	FC	On-Demand	Anodyne	GCK	56	32
CN1CCN(S(=O)(=O)c2ccc(NCCC(C)(C)CO)nc2)CC1	ZINC000450628937	FC	On-Demand	Anodyne	GCKR	62	33
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](C2CCOCC2)C1	ZINC000450628949	DF	On-Demand	Anodyne	ABCB1	0	42
CO[C@@H](Cc1ccccc1)CN1CC[C@H](C2CCOCC2)C1	ZINC000450628950	DF	On-Demand	Anodyne	ABCB1	0	42
CO[C@H](Cc1ccccc1)CN1CC[C@H](C2CCOCC2)C1	ZINC000450628951	DF	On-Demand	Anodyne	ABCB1	0	42
CO[C@H](Cc1ccccc1)CN1CC[C@@H](C2CCOCC2)C1	ZINC000450628952	DF	On-Demand	Anodyne	ABCB1	0	42
Brc1ccc2c(NCC3=CCOCC3)ccnc2c1	ZINC000450628953	DH	On-Demand	Anodyne	HRP1_PLAFA	83	34
COC[C@H](Cn1ncc(Cl)c(Cl)c1=O)c1ccc(Br)cc1	ZINC000450628959	GH	On-Demand	Anodyne	NPBWR1	82	38
COC[C@@H](Cn1ncc(Cl)c(Cl)c1=O)c1ccc(Br)cc1	ZINC000450628960	GH	On-Demand	Anodyne	NPBWR1	82	38
CC(C)(CO)CCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450628974	DG	On-Demand	Mild	MAP3K8	77	36
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450628975	FG	On-Demand	Anodyne	CCKAR	44	35
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450628976	FG	On-Demand	Anodyne	CCKAR	44	35
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450628983	EF	On-Demand	Anodyne	CCKAR	51	37
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450628984	EF	On-Demand	Anodyne	CCKAR	51	37
CCCc1cc(C(=O)N2CCN(c3ccccc3)C[C@@H]2CC)no1	ZINC000450628991	EG	On-Demand	Anodyne	CCKAR	50	36
CCCc1cc(C(=O)N2CCN(c3ccccc3)C[C@H]2CC)no1	ZINC000450628992	EG	On-Demand	Anodyne	CCKAR	50	36
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1nn2c(c1C)OCCC2	ZINC000450628993	FF	On-Demand	Anodyne	CCKAR	41	34
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1nn2c(c1C)OCCC2	ZINC000450628994	FF	On-Demand	Anodyne	CCKAR	41	34
CCN(CC)S(=O)(=O)c1ccc(NC[C@H](C)CCCO)c([N+](=O)[O-])c1	ZINC000450629007	FE	On-Demand	Bother	COLA	75	35
CCN(CC)S(=O)(=O)c1ccc(NC[C@@H](C)CCCO)c([N+](=O)[O-])c1	ZINC000450629008	FE	On-Demand	Bother	COLA	75	35
C[C@@H](c1cccnc1)N(C)Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450629044	DJ	On-Demand	Anodyne	KCNA5	45	36
C[C@@H](c1cccnc1)N(C)Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450629045	DJ	On-Demand	Anodyne	KCNA5	45	36
C[C@@H](c1ccc(CN(C)[C@H](C)c2cccnc2)cc1)C(F)(F)F	ZINC000450629046	DJ	On-Demand	Anodyne	KCNA5	45	36
C[C@H](c1cccnc1)N(C)Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450629047	DJ	On-Demand	Anodyne	KCNA5	45	36
CN(CCN1CCc2n[nH]cc2C1)Cc1ccccc1	ZINC000450629058	CD	On-Demand	Anodyne	SIGMAR1	23	50
C[C@@H](NC(=O)c1nc2ccccc2nc1C1CC1)c1ccccc1[N+](=O)[O-]	ZINC000450629069	FH	On-Demand	Bother	COLA	75	33
C[C@H](NC(=O)c1nc2ccccc2nc1C1CC1)c1ccccc1[N+](=O)[O-]	ZINC000450629070	FH	On-Demand	Bother	COLA	75	33
CCS(=O)(=O)c1ccc(CSCc2ccccc2)cc1	ZINC000450629071	DH	On-Demand	Anodyne	RORC	29	43
C[C@H](c1ccccc1)[C@@H](O)CN(Cc1cccnc1)C1CC1	ZINC000450629075	CG	On-Demand	Anodyne	KCNA5	44	34
C[C@H](c1ccccc1)[C@H](O)CN(Cc1cccnc1)C1CC1	ZINC000450629076	CG	On-Demand	Anodyne	KCNA5	44	34
C[C@@H](c1ccccc1)[C@H](O)CN(Cc1cccnc1)C1CC1	ZINC000450629077	CG	On-Demand	Anodyne	KCNA5	44	34
C[C@@H](c1ccccc1)[C@@H](O)CN(Cc1cccnc1)C1CC1	ZINC000450629078	CG	On-Demand	Anodyne	KCNA5	44	34
COc1cc(CC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)ccc1Cl	ZINC000450629081	FE	On-Demand	Anodyne	TRPV1	20	47
COc1cc(CC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)ccc1Cl	ZINC000450629081	FE	On-Demand	Anodyne	NCE103	24	45
COc1cc(CC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)ccc1Cl	ZINC000450629081	FE	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)ccc1Cl	ZINC000450629082	FE	On-Demand	Anodyne	TRPV1	20	47
COc1cc(CC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)ccc1Cl	ZINC000450629082	FE	On-Demand	Anodyne	NCE103	24	45
COc1cc(CC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)ccc1Cl	ZINC000450629082	FE	On-Demand	Anodyne	CAN2	0	45
c1ccc(CCn2ccc(CN3CCN(Cc4cccnc4)CC3)n2)cc1	ZINC000450629083	FF	On-Demand	Anodyne	SIGMAR1	22	42
CCC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450629089	BH	On-Demand	Anodyne	THRA	30	42
CCC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450629089	BH	On-Demand	Anodyne	THRB	0	42
CCC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450629089	BH	On-Demand	Anodyne	KCNQ1	0	43
CCC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450629089	BH	On-Demand	Anodyne	PLA2G4B	77	41
Cc1cccc(Cl)c1CN1CCN(Cc2cccnc2)CC1	ZINC000450629103	DG	On-Demand	Anodyne	DRD4	22	65
Cc1cccc(Cl)c1CN1CCN(Cc2cccnc2)CC1	ZINC000450629103	DG	On-Demand	Anodyne	SIGMAR1	16	41
Cc1cccc(Cl)c1CN1CCN(Cc2cccnc2)CC1	ZINC000450629103	DG	On-Demand	Anodyne	P2RX7	0	43
COC(=O)c1coc(CN2CCc3ccc(OC)cc3CC2)n1	ZINC000450629104	DE	On-Demand	Anodyne	DRD5	15	40
COC(=O)c1coc(CN2CCc3ccc(OC)cc3CC2)n1	ZINC000450629104	DE	On-Demand	Anodyne	ABCB1	18	41
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2ccncc2)c(OC)c1	ZINC000450629113	FF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2ccncc2)c(OC)c1	ZINC000450629114	FF	On-Demand	Anodyne	HTR7	27	40
c1ccc(COc2ccnc(NCc3nc(C4CC4)n[nH]3)n2)cc1	ZINC000450629136	DF	On-Demand	Anodyne	PKNB	22	47
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]1c1cccnc1	ZINC000450629143	CG	On-Demand	Anodyne	CHRNA2	50	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]1c1cccnc1	ZINC000450629143	CG	On-Demand	Anodyne	CRTY	0	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450629144	CG	On-Demand	Anodyne	CHRNA2	50	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450629144	CG	On-Demand	Anodyne	CRTY	0	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H]1c1cccnc1	ZINC000450629145	CG	On-Demand	Anodyne	CHRNA2	50	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H]1c1cccnc1	ZINC000450629145	CG	On-Demand	Anodyne	CRTY	0	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450629146	CG	On-Demand	Anodyne	CHRNA2	50	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000450629146	CG	On-Demand	Anodyne	CRTY	0	51
N#CC1(COc2ccc([N+](=O)[O-])cc2Cl)CCC1	ZINC000450629163	CG	On-Demand	Mild	SNCA	44	33
CN(CCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1)Cc1ccccc1	ZINC000450629164	EG	On-Demand	Anodyne	SIGMAR1	16	40
CN(CCN1C[C@H](O)C[C@H]1c1ccc(F)cc1)Cc1ccccc1	ZINC000450629165	EG	On-Demand	Anodyne	SIGMAR1	16	40
CN(CCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1)Cc1ccccc1	ZINC000450629166	EG	On-Demand	Anodyne	SIGMAR1	16	40
CN(CCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1)Cc1ccccc1	ZINC000450629167	EG	On-Demand	Anodyne	SIGMAR1	16	40
COC(=O)c1coc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450629184	GF	On-Demand	Anodyne	P2RY12	20	40
COC(=O)c1coc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450629184	GF	On-Demand	Anodyne	PYGL	0	42
COC(=O)c1coc(CN2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)n1	ZINC000450629184	GF	On-Demand	Anodyne	FAAH	17	43
CN1CC[C@](O)(CNC(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450629187	FC	On-Demand	Mild	TRPV4	48	36
CN1CC[C@@](O)(CNC(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450629188	FC	On-Demand	Mild	TRPV4	48	36
CC1=CCN(CCNC(=O)c2ccc(-c3cnn(C)c3)o2)CC1	ZINC000450629200	DE	On-Demand	Anodyne	DRD4	40	32
C[C@@H]1CC[C@H](C(=O)N2CC=C(c3cccc(Br)c3)CC2)O1	ZINC000450629201	FH	On-Demand	Anodyne	ADAM10	36	41
COc1cc(CC(=O)N2CCC(C)(CO)CC2)ccc1Cl	ZINC000450629206	DF	On-Demand	Anodyne	TACR1	0	42
COc1cc(CC(=O)N2CCC(C)(CO)CC2)ccc1Cl	ZINC000450629206	DF	On-Demand	Anodyne	CCR1	24	45
COc1cc(CC(=O)N2CCC(C)(CO)CC2)ccc1Cl	ZINC000450629206	DF	On-Demand	Anodyne	GPR183	0	41
CCCc1c(NC(=O)c2cc(C)cs2)cnn1-c1cc(C)ccn1	ZINC000450629219	EI	On-Demand	Anodyne	GPR142	42	36
CC(=O)CCCCCOc1ccc(Cl)cc1	ZINC000450629240	BH	On-Demand	Anodyne	THRA	33	41
CC(=O)CCCCCOc1ccc(Cl)cc1	ZINC000450629240	BH	On-Demand	Anodyne	P2RY12	22	43
CC(=O)CCCCCOc1ccc(Cl)cc1	ZINC000450629240	BH	On-Demand	Anodyne	THRB	28	41
CC(=O)CCCCCOc1ccc(Cl)cc1	ZINC000450629240	BH	On-Demand	Anodyne	SAT1	0	41
CC(=O)CCCCCOc1ccc(Cl)cc1	ZINC000450629240	BH	On-Demand	Anodyne	PLA2G4B	85	43
CC(=O)CCCCCOc1ccc(Cl)cc1	ZINC000450629240	BH	On-Demand	Anodyne	ACR	32	41
CC(=O)CCCCCOc1ccc(Cl)cc1	ZINC000450629240	BH	On-Demand	Anodyne	CVIR	0	42
COc1cc(CC(=O)NC2Cc3ccccc3C2)ccc1Cl	ZINC000450629243	DG	On-Demand	Anodyne	HCRTR1	16	52
COc1cc(CC(=O)NC2Cc3ccccc3C2)ccc1Cl	ZINC000450629243	DG	On-Demand	Anodyne	CA7	15	40
COc1cc(CC(=O)NC2Cc3ccccc3C2)ccc1Cl	ZINC000450629243	DG	On-Demand	Anodyne	SIGMAR1	15	45
COc1cc(CC(=O)NC2Cc3ccccc3C2)ccc1Cl	ZINC000450629243	DG	On-Demand	Anodyne	HCRTR2	20	40
COc1cc(CC(=O)NC2Cc3ccccc3C2)ccc1Cl	ZINC000450629243	DG	On-Demand	Anodyne	NCE103	26	42
COc1cc(CC(=O)NC2Cc3ccccc3C2)ccc1Cl	ZINC000450629243	DG	On-Demand	Anodyne	CAN2	0	42
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	DRD2	24	44
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	DRD4	64	44
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	ACHE	20	45
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	HRH2	25	45
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	F10	16	41
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	CHRM3	21	44
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	NPY2R	16	44
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	GUAB	0	57
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	PRNP	40	36
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	FAAH	28	49
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	EPHX2	15	41
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	MCHR1	62	42
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	CACNA1G	21	52
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	MGLL	0	40
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	IMDH_CRYPV	41	45
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	NOD1	32	43
CC(=O)c1cccc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)c1	ZINC000450629247	GG	On-Demand	Anodyne	NOD2	40	34
CC(=O)c1cccc(CN2CCc3c(F)cccc3C2)c1	ZINC000450629252	CH	On-Demand	Anodyne	CHRM3	16	41
CC(=O)c1cccc(CN2CCc3c(F)cccc3C2)c1	ZINC000450629252	CH	On-Demand	Anodyne	NOD1	30	40
CC(=O)c1cccc(CN2CCc3c(F)cccc3C2)c1	ZINC000450629252	CH	On-Demand	Anodyne	NOD2	45	40
Cc1nn(C)c(C)c1CCCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450629254	EE	On-Demand	Anodyne	HPGDS	20	42
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2C)ccc1Cl	ZINC000450629256	FF	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2C)ccc1Cl	ZINC000450629257	FF	On-Demand	Anodyne	OPRM1	0	40
Cc1cc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)ccn1	ZINC000450629258	ED	On-Demand	Anodyne	NAMPT	41	41
CO[C@H](Cc1ccccc1)CN1CCc2ccc(C(C)=O)cc2CC1	ZINC000450629265	EH	On-Demand	Anodyne	NOD2	41	36
CO[C@@H](Cc1ccccc1)CN1CCc2ccc(C(C)=O)cc2CC1	ZINC000450629266	EH	On-Demand	Anodyne	NOD2	41	36
CC(C)OC(C)(C)C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450629269	CD	On-Demand	Anodyne	EPHX2	27	43
CC(C)OC(C)(C)C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450629277	CD	On-Demand	Anodyne	EPHX2	27	43
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2Cn2cnc3ccccc32)cc1	ZINC000450629290	GG	On-Demand	Anodyne	NR1I2	44	39
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2Cn2cnc3ccccc32)cc1	ZINC000450629291	GG	On-Demand	Anodyne	NR1I2	44	39
CC1=CCN(CCNC(=O)c2cc(Cl)c(F)cc2Br)CC1	ZINC000450629301	GH	On-Demand	Anodyne	DRD4	41	32
CC1=CCN(CCNC(=O)c2cc(Cl)c(F)cc2Br)CC1	ZINC000450629301	GH	On-Demand	Anodyne	DRD3	15	43
CC1=CCN(CCNC(=O)c2cc(Cl)c(F)cc2Br)CC1	ZINC000450629301	GH	On-Demand	Anodyne	PLD2	40	32
CC1=CCN(CCNC(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450629304	EG	On-Demand	Anodyne	PLD2	45	32
O=C(CC1CC(F)(F)C1)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450629309	FJ	On-Demand	Anodyne	ADAM10	37	42
CCC(CC)(CNC(=O)[C@@H]1OCC[C@@H]1C)c1ccc(OC)c(OC)c1	ZINC000450629334	EG	On-Demand	Anodyne	CACNA1G	34	41
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cnn(CC(=O)NCCO)c2)c1	ZINC000450629335	FC	On-Demand	Anodyne	PDGFRB	25	41
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cnn(CC(=O)NCCO)c2)c1	ZINC000450629335	FC	On-Demand	Anodyne	FLT4	22	41
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cnn(CC(=O)NCCO)c2)c1	ZINC000450629335	FC	On-Demand	Anodyne	NAMPT	25	42
O=C(N[C@H](CCO)C1CCOCC1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450629336	GF	On-Demand	Anodyne	PYGL	44	41
O=C(N[C@@H](CCO)C1CCOCC1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450629337	GF	On-Demand	Anodyne	PYGL	44	41
O=C(c1ccc(F)cc1)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450629341	DH	On-Demand	Anodyne	LSS	25	41
O=C(c1ccc(F)cc1)c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450629342	DH	On-Demand	Anodyne	LSS	25	41
Cc1cc(F)c(CC(=O)N[C@@H](CCO)C2CCOCC2)cc1F	ZINC000450629362	EE	On-Demand	Anodyne	LEF	19	41
Cc1cc(F)c(CC(=O)N[C@H](CCO)C2CCOCC2)cc1F	ZINC000450629363	EE	On-Demand	Anodyne	LEF	19	41
CCc1cc(NC[C@@H](C)CCCO)n2ncnc2n1	ZINC000450629369	CD	On-Demand	Anodyne	DHOD	0	50
CCc1cc(NC[C@H](C)CCCO)n2ncnc2n1	ZINC000450629370	CD	On-Demand	Anodyne	DHOD	0	50
CC(C)(CO)CCNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450629375	DI	On-Demand	Anodyne	HRP1_PLAFA	92	34
CC(C)(CO)CCNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450629375	DI	On-Demand	Anodyne	HNMT	51	36
CCCc1cc(O)nc(SCCCCCC(C)=O)n1	ZINC000450629388	CG	On-Demand	Anodyne	HDA106	0	46
CC[C@@H](O)CC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450629407	CD	On-Demand	Bother	PQSD	0	43
CC[C@H](O)CC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450629408	CD	On-Demand	Bother	PQSD	0	43
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450629409	CD	On-Demand	Bother	PQSD	0	43
CC[C@H](O)CC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450629410	CD	On-Demand	Bother	PQSD	0	43
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450629411	FD	On-Demand	Anodyne	CTSV	47	33
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450629413	FD	On-Demand	Anodyne	CTSV	47	33
CC(C)(C(=O)Nc1cnn(CC(=O)NCCO)c1)C1CCC1	ZINC000450629423	DC	On-Demand	Anodyne	PANC	53	34
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	AVPR1B	42	34
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	DRD5	17	46
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	SIGMAR1	20	47
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	MMP13	31	46
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	HTR6	0	40
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	ADAM17	28	46
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	MLNR	26	43
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	ABCB1	15	50
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	MMP9	25	43
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	MMP1	25	46
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	NOD1	27	43
CCS(=O)(=O)c1ccc(CN2CCc3ccc(OC)cc3CC2)cc1	ZINC000450629425	FG	On-Demand	Anodyne	NOD2	43	43
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629429	GI	On-Demand	Anodyne	COLA	94	49
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629429	GI	On-Demand	Anodyne	CPT1A	92	49
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629436	GI	On-Demand	Anodyne	COLA	94	49
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629436	GI	On-Demand	Anodyne	CPT1A	92	49
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629437	GI	On-Demand	Anodyne	COLA	94	49
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629437	GI	On-Demand	Anodyne	CPT1A	92	49
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629438	GI	On-Demand	Anodyne	COLA	94	49
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629438	GI	On-Demand	Anodyne	CPT1A	92	49
O=C([C@@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629449	FH	On-Demand	Anodyne	COLA	83	48
O=C([C@@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629449	FH	On-Demand	Anodyne	CPT1A	66	47
O=C([C@@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629449	FH	On-Demand	Anodyne	GRM5	0	48
O=C([C@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629450	FH	On-Demand	Anodyne	COLA	83	48
O=C([C@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629450	FH	On-Demand	Anodyne	CPT1A	66	47
O=C([C@H]1CC1(F)F)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629450	FH	On-Demand	Anodyne	GRM5	0	48
O=C([C@@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629451	FH	On-Demand	Anodyne	COLA	83	48
O=C([C@@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629451	FH	On-Demand	Anodyne	CPT1A	66	47
O=C([C@@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629451	FH	On-Demand	Anodyne	GRM5	0	48
O=C([C@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629452	FH	On-Demand	Anodyne	COLA	83	48
O=C([C@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629452	FH	On-Demand	Anodyne	CPT1A	66	47
O=C([C@H]1CC1(F)F)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450629452	FH	On-Demand	Anodyne	GRM5	0	48
COc1cc(OC)c2ncnc(NCc3nc(C4CC4)n[nH]3)c2c1	ZINC000450629468	ED	On-Demand	Anodyne	PDE6A	45	34
CCCOc1ccc(C(=O)NCCc2nc(-c3ccccc3)n[nH]2)c(OC)c1	ZINC000450629470	GG	On-Demand	Anodyne	CNR2	34	45
CCCOc1ccc(C(=O)NCCc2nc(-c3ccccc3)n[nH]2)c(OC)c1	ZINC000450629470	GG	On-Demand	Anodyne	CASR	17	41
CCCOc1ccc(C(=O)NCCc2nc(-c3ccccc3)n[nH]2)c(OC)c1	ZINC000450629470	GG	On-Demand	Anodyne	MTNR1A	41	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	PPARG	17	44
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	PPARA	22	49
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	MME	60	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	ANPEP	46	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	CYSP_TRYCR	43	32
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	CAPNS1	47	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	SOAT1	0	43
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	CAPN1	57	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	CAPN2	59	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	ACE2	42	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629487	GF	On-Demand	Anodyne	POL	0	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	PPARG	17	44
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	PPARA	22	49
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	MME	60	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	ANPEP	46	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	CYSP_TRYCR	43	32
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	CAPNS1	47	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	SOAT1	0	43
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	CAPN1	57	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	CAPN2	59	38
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	ACE2	42	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629488	GF	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	PPARG	17	44
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	PPARA	22	49
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	MME	60	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	ANPEP	46	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	CYSP_TRYCR	43	32
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	CAPNS1	47	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	SOAT1	0	43
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	CAPN1	57	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	CAPN2	59	38
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	ACE2	42	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629489	GF	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	PPARG	17	44
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	PPARA	22	49
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	MME	60	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	ANPEP	46	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	CYSP_TRYCR	43	32
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	CAPNS1	47	33
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	SOAT1	0	43
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	CAPN1	57	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	CAPN2	59	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	ACE2	42	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC(F)F)cc1	ZINC000450629490	GF	On-Demand	Anodyne	POL	0	41
CC(C)c1nnc(CN(Cc2cccnc2)C(C)C)s1	ZINC000450629495	CG	On-Demand	Anodyne	NR1D1	43	34
Cc1ccc(NC(=O)N2CCN(CCC[C@H](C)O)CC2)cc1Cl	ZINC000450629522	EF	On-Demand	Anodyne	PYGL	22	52
Cc1ccc(NC(=O)N2CCN(CCC[C@@H](C)O)CC2)cc1Cl	ZINC000450629523	EF	On-Demand	Anodyne	PYGL	22	52
C/C=C\COc1cccc(CC(=O)NCCN2CC=C(C)CC2)c1	ZINC000450629536	EF	On-Demand	Anodyne	DRD4	44	35
C/C=C/COc1cccc(CC(=O)NCCN2CC=C(C)CC2)c1	ZINC000450629537	EF	On-Demand	Anodyne	DRD4	44	35
CC(=O)N1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C(C)(C)C1	ZINC000450629560	GG	On-Demand	Anodyne	HRH4	21	48
CCOC(=O)c1ccc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)nc1	ZINC000450629568	FE	On-Demand	Anodyne	GLRA1	45	38
COc1cc(CC(=O)N2CCN(C(C)=O)CC2(C)C)ccc1O	ZINC000450629591	DD	On-Demand	Anodyne	TRPV1	0	44
CC(=O)N1CCN(C(=O)c2cnn3ccc(C)cc23)C(C)(C)C1	ZINC000450629593	DD	On-Demand	Anodyne	EPHB3	25	42
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629600	FH	On-Demand	Anodyne	HRH1	31	43
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629600	FH	On-Demand	Anodyne	P2RY12	28	43
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629600	FH	On-Demand	Anodyne	PRSS2	43	31
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629600	FH	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629600	FH	On-Demand	Anodyne	MLNR	42	34
CCOC(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629601	FH	On-Demand	Anodyne	HRH1	31	43
CCOC(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629601	FH	On-Demand	Anodyne	P2RY12	28	43
CCOC(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629601	FH	On-Demand	Anodyne	PRSS2	43	31
CCOC(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629601	FH	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1ccc(CN2CC[C@H](Oc3cccc(Cl)c3)C2)nc1	ZINC000450629601	FH	On-Demand	Anodyne	MLNR	42	34
CCOc1ccc2nc(SCc3nc(C(=O)OC)co3)[nH]c2c1	ZINC000450629603	EG	On-Demand	Anodyne	CYP2C8	29	43
CCOc1ccc2nc(SCc3nc(C(=O)OC)co3)[nH]c2c1	ZINC000450629603	EG	On-Demand	Anodyne	CYP2C19	39	46
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450629620	GF	On-Demand	Bother	BDKRB1	22	41
C[C@H](CCCO)CNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450629621	GF	On-Demand	Bother	BDKRB1	22	41
Cc1cc(OCc2nnc(C(C)C)s2)ccc1Cl	ZINC000450629625	CI	On-Demand	Anodyne	MAOA	31	42
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450629626	FH	On-Demand	Anodyne	CCKAR	48	34
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450629627	FH	On-Demand	Anodyne	CCKAR	48	34
COc1cccc2c(NCCC(C)(C)CO)c(C)cnc12	ZINC000450629629	CG	On-Demand	Anodyne	ATP4A	18	44
CCCc1nc(C)c(Cn2ncc(Cl)c(Cl)c2=O)o1	ZINC000450629631	DF	On-Demand	Anodyne	NPBWR1	45	34
COc1cccc(OCCC(=O)N2CCOc3nc(C)ccc32)c1	ZINC000450629639	EF	On-Demand	Anodyne	DRD4	40	31
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ccccc2)C[C@H]1CC	ZINC000450629642	CG	On-Demand	Anodyne	ERBB2	19	40
CC[C@H]1CN(c2ccccc2)CCN1C(=O)[C@@H]1C[C@H]1CC	ZINC000450629643	CG	On-Demand	Anodyne	ERBB2	19	40
C[C@H](CCCO)CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450629644	EE	On-Demand	Anodyne	LRRK2	23	40
C[C@@H](CCCO)CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450629645	EE	On-Demand	Anodyne	LRRK2	23	40
CC(C)(CO)CCNc1c(C#N)cnc2c(Br)cccc12	ZINC000450629647	EH	On-Demand	Mild	MAP3K8	34	40
C[C@@H](c1cccnc1)N(C)Cc1cc(CN(C)[C@H](C)c2cccnc2)ccc1F	ZINC000450629648	GK	On-Demand	Anodyne	KCNA5	44	37
C[C@@H](c1cccnc1)N(C)Cc1ccc(F)c(CN(C)[C@@H](C)c2cccnc2)c1	ZINC000450629649	GK	On-Demand	Anodyne	KCNA5	44	37
C[C@@H](c1cccnc1)N(C)Cc1ccc(F)c(CN(C)[C@H](C)c2cccnc2)c1	ZINC000450629650	GK	On-Demand	Anodyne	KCNA5	44	37
C[C@H](c1cccnc1)N(C)Cc1ccc(F)c(CN(C)[C@H](C)c2cccnc2)c1	ZINC000450629651	GK	On-Demand	Anodyne	KCNA5	44	37
COc1ccc2c(c1)CCN(C[C@@H]1CCNC(=O)CC1)CC2	ZINC000450629661	DE	On-Demand	Anodyne	DRD5	15	42
COc1ccc2c(c1)CCN(C[C@@H]1CCNC(=O)CC1)CC2	ZINC000450629661	DE	On-Demand	Anodyne	HRH3	16	47
COc1ccc2c(c1)CCN(C[C@H]1CCNC(=O)CC1)CC2	ZINC000450629663	DE	On-Demand	Anodyne	DRD5	15	42
COc1ccc2c(c1)CCN(C[C@H]1CCNC(=O)CC1)CC2	ZINC000450629663	DE	On-Demand	Anodyne	HRH3	16	47
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450629668	FG	On-Demand	Anodyne	SCN9A	0	41
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450629668	FG	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450629669	FG	On-Demand	Anodyne	SCN9A	0	41
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450629669	FG	On-Demand	Anodyne	AMY2	44	30
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450629676	GG	On-Demand	Anodyne	DRD4	44	35
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450629676	GG	On-Demand	Anodyne	ESRRA	21	40
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450629676	GG	On-Demand	Anodyne	CCKAR	76	43
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450629677	GG	On-Demand	Anodyne	DRD4	44	35
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450629677	GG	On-Demand	Anodyne	ESRRA	21	40
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450629677	GG	On-Demand	Anodyne	CCKAR	76	43
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629680	GG	On-Demand	Bother	COLA	83	36
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629680	GG	On-Demand	Bother	MTNN	78	38
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629680	GG	On-Demand	Bother	BCL2L1	70	35
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629680	GG	On-Demand	Bother	BCL2	56	36
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629680	GG	On-Demand	Bother	LIMK2	43	34
C[C@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629682	GG	On-Demand	Bother	COLA	83	36
C[C@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629682	GG	On-Demand	Bother	MTNN	78	38
C[C@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629682	GG	On-Demand	Bother	BCL2L1	70	35
C[C@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629682	GG	On-Demand	Bother	BCL2	56	36
C[C@H](CCCO)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450629682	GG	On-Demand	Bother	LIMK2	43	34
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450629690	FH	On-Demand	Anodyne	CCKAR	59	38
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450629697	FH	On-Demand	Anodyne	CCKAR	59	38
COc1cc(-c2noc(CN3CCC[C@H]3c3cccnc3)n2)ncn1	ZINC000450629700	EE	On-Demand	Anodyne	CHRNA2	39	40
COc1cc(-c2noc(CN3CCC[C@@H]3c3cccnc3)n2)ncn1	ZINC000450629701	EE	On-Demand	Anodyne	CHRNA2	39	40
CCS(=O)(=O)c1ccc(CSc2ccc(C)cc2)cc1	ZINC000450629703	DI	On-Demand	Anodyne	RORC	15	40
CCn1nnc(C)c1CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450629720	ED	On-Demand	Anodyne	DRD4	15	57
CC[C@@H](CSC)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450629721	DH	On-Demand	Anodyne	TIMP3	50	33
CC[C@@H](CSC)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450629721	DH	On-Demand	Anodyne	PDS	73	40
CC[C@H](CSC)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450629722	DH	On-Demand	Anodyne	TIMP3	50	33
CC[C@H](CSC)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450629722	DH	On-Demand	Anodyne	PDS	73	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450629725	GF	On-Demand	Anodyne	CTSK	46	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450629725	GF	On-Demand	Anodyne	CTSL	37	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450629725	GF	On-Demand	Anodyne	CTSS	33	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450629725	GF	On-Demand	Anodyne	CAPN1	55	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450629725	GF	On-Demand	Anodyne	CAPN2	78	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450629725	GF	On-Demand	Anodyne	FPR1	56	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1	ZINC000450629725	GF	On-Demand	Anodyne	NPR	65	36
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000450629752	GE	On-Demand	Anodyne	SLC6A9	34	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC[C@H](S(C)(=O)=O)C2)c1	ZINC000450629753	GE	On-Demand	Anodyne	SLC6A9	34	42
COc1ccc(-c2ccnc(NCCC(C)(C)CO)n2)cc1	ZINC000450629765	DF	On-Demand	Anodyne	CLK4	25	56
C(=C\c1ccccc1)\CCN1CCC[C@H]1c1cccnc1	ZINC000450629771	CI	On-Demand	Anodyne	CHRNA2	52	53
C(=C\c1ccccc1)\CCN1CCC[C@H]1c1cccnc1	ZINC000450629771	CI	On-Demand	Anodyne	Q8WSF8_APLCA	15	53
C(=C\c1ccccc1)\CCN1CCC[C@H]1c1cccnc1	ZINC000450629771	CI	On-Demand	Anodyne	CRTY	0	53
C(=C/c1ccccc1)\CCN1CCC[C@H]1c1cccnc1	ZINC000450629772	CI	On-Demand	Anodyne	CHRNA2	52	53
C(=C/c1ccccc1)\CCN1CCC[C@H]1c1cccnc1	ZINC000450629772	CI	On-Demand	Anodyne	Q8WSF8_APLCA	15	53
C(=C/c1ccccc1)\CCN1CCC[C@H]1c1cccnc1	ZINC000450629772	CI	On-Demand	Anodyne	CRTY	0	53
C(=C\c1ccccc1)\CCN1CCC[C@@H]1c1cccnc1	ZINC000450629773	CI	On-Demand	Anodyne	CHRNA2	52	53
C(=C\c1ccccc1)\CCN1CCC[C@@H]1c1cccnc1	ZINC000450629773	CI	On-Demand	Anodyne	Q8WSF8_APLCA	15	53
C(=C\c1ccccc1)\CCN1CCC[C@@H]1c1cccnc1	ZINC000450629773	CI	On-Demand	Anodyne	CRTY	0	53
C(=C/c1ccccc1)\CCN1CCC[C@@H]1c1cccnc1	ZINC000450629774	CI	On-Demand	Anodyne	CHRNA2	52	53
C(=C/c1ccccc1)\CCN1CCC[C@@H]1c1cccnc1	ZINC000450629774	CI	On-Demand	Anodyne	Q8WSF8_APLCA	15	53
C(=C/c1ccccc1)\CCN1CCC[C@@H]1c1cccnc1	ZINC000450629774	CI	On-Demand	Anodyne	CRTY	0	53
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	HTR1A	26	40
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	DRD2	24	49
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	DRD1	19	45
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	DRD4	45	34
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	DRD3	32	45
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	DRD5	25	45
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	HTR7	42	44
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	NQO2	31	40
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	MTNR1A	73	40
COc1ccc2c(c1)CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC2	ZINC000450629778	GF	On-Demand	Anodyne	MTNR1B	65	40
Cc1c([N+](=O)[O-])cnc(NCc2nc(C3CC3)n[nH]2)c1Br	ZINC000450629790	FF	On-Demand	Bother	PRKCQ	44	36
CN1[C@H]2CC[C@H]1CC(N1CCN(Cc3ccccc3OC3CC3)CC1)C2	ZINC000450629815	FF	On-Demand	Anodyne	CHRM1	18	46
CN1[C@H]2CC[C@H]1CC(N1CCN(Cc3ccccc3OC3CC3)CC1)C2	ZINC000450629815	FF	On-Demand	Anodyne	SLC6A3	21	43
CN1[C@H]2CC[C@H]1CC(N1CCN(Cc3ccccc3OC3CC3)CC1)C2	ZINC000450629815	FF	On-Demand	Anodyne	GLRA1	43	33
CC[C@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629825	CE	On-Demand	Mild	RIR1_HHV11	49	38
CC[C@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629825	CE	On-Demand	Mild	CTSK	26	41
CC[C@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629825	CE	On-Demand	Mild	CTSL	22	40
CC[C@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629825	CE	On-Demand	Mild	CTSS	30	47
CC[C@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629825	CE	On-Demand	Mild	CAPN2	50	34
CC[C@@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629826	CE	On-Demand	Mild	RIR1_HHV11	49	38
CC[C@@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629826	CE	On-Demand	Mild	CTSK	26	41
CC[C@@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629826	CE	On-Demand	Mild	CTSL	22	40
CC[C@@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629826	CE	On-Demand	Mild	CTSS	30	47
CC[C@@H](CC#N)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450629826	CE	On-Demand	Mild	CAPN2	50	34
COc1cc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)ccc1Cl	ZINC000450629828	FG	On-Demand	Anodyne	SIGMAR1	26	40
COc1cc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)ccc1Cl	ZINC000450629828	FG	On-Demand	Anodyne	SSTR5	50	38
COc1cc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)ccc1Cl	ZINC000450629828	FG	On-Demand	Anodyne	UTS2R	24	42
CCOc1ccc2nc(SCc3ccc(S(=O)(=O)CC)cc3)[nH]c2c1	ZINC000450629829	GI	On-Demand	Anodyne	CYP2C8	35	54
CCOc1ccc2nc(SCc3ccc(S(=O)(=O)CC)cc3)[nH]c2c1	ZINC000450629829	GI	On-Demand	Anodyne	NPY5R	0	51
CCOc1ccc2nc(SCc3ccc(S(=O)(=O)CC)cc3)[nH]c2c1	ZINC000450629829	GI	On-Demand	Anodyne	CYP1A2	27	56
CCOc1ccc2nc(SCc3ccc(S(=O)(=O)CC)cc3)[nH]c2c1	ZINC000450629829	GI	On-Demand	Anodyne	CYP2C9	0	57
CCOc1ccc2nc(SCc3ccc(S(=O)(=O)CC)cc3)[nH]c2c1	ZINC000450629829	GI	On-Demand	Anodyne	CYP2C19	45	56
COC(=O)[C@H]1CCCC[C@@]1(C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450629830	GE	On-Demand	Anodyne	MTNR1A	52	37
COC(=O)[C@@H]1CCCC[C@@]1(C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450629831	GE	On-Demand	Anodyne	MTNR1A	52	37
COC(=O)[C@H]1CCCC[C@]1(C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450629832	GE	On-Demand	Anodyne	MTNR1A	52	37
COC(=O)[C@@H]1CCCC[C@]1(C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450629833	GE	On-Demand	Anodyne	MTNR1A	52	37
CO[C@H](Cc1ccccc1)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450629835	FE	On-Demand	Anodyne	SLC6A3	41	52
CO[C@@H](Cc1ccccc1)CN1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450629836	FE	On-Demand	Anodyne	SLC6A3	41	52
CCOC(=O)c1ccc(CN2CCc3c(F)cccc3C2)nc1	ZINC000450629838	DF	On-Demand	Anodyne	NOD1	29	46
CCOC(=O)c1ccc(CN2CCc3c(F)cccc3C2)nc1	ZINC000450629838	DF	On-Demand	Anodyne	NOD2	45	46
COc1cccc(OCCC(=O)NC[C@H]2CC[C@@H](C(=O)N(C)C)O2)c1	ZINC000450629839	FD	On-Demand	Anodyne	MTNR1A	34	44
COc1cccc(OCCC(=O)NC[C@@H]2CC[C@@H](C(=O)N(C)C)O2)c1	ZINC000450629840	FD	On-Demand	Anodyne	MTNR1A	34	44
COc1cccc(OCCC(=O)NC[C@H]2CC[C@H](C(=O)N(C)C)O2)c1	ZINC000450629841	FD	On-Demand	Anodyne	MTNR1A	34	44
COc1cccc(OCCC(=O)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)c1	ZINC000450629842	FD	On-Demand	Anodyne	MTNR1A	34	44
CC1=CCN(CCNC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450629849	EG	On-Demand	Anodyne	DRD4	44	34
CC1=CCN(CCNC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450629849	EG	On-Demand	Anodyne	MAPK14	26	40
CC1=CCN(CCNC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450629849	EG	On-Demand	Anodyne	PLD1	40	34
CC1=CCN(CCNC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450629849	EG	On-Demand	Anodyne	PLD2	63	38
CC1=CCN(CCNC(=O)c2ccc3cnccc3c2)CC1	ZINC000450629865	CF	On-Demand	Anodyne	DRD4	51	40
CC1=CCN(CCNC(=O)c2ccc3cnccc3c2)CC1	ZINC000450629865	CF	On-Demand	Anodyne	PLD1	38	40
CC1=CCN(CCNC(=O)c2ccc3cnccc3c2)CC1	ZINC000450629865	CF	On-Demand	Anodyne	PLD2	72	39
CC1=CCN(CCNC(=O)c2ccc3cnccc3c2)CC1	ZINC000450629865	CF	On-Demand	Anodyne	AKT1	0	41
COc1cccc(OCCC(=O)NCCCc2c(C)nn(C)c2C)c1	ZINC000450629868	EF	On-Demand	Anodyne	DRD4	41	33
COc1cccc(OCCC(=O)NCCCc2c(C)nn(C)c2C)c1	ZINC000450629868	EF	On-Demand	Anodyne	PANK1	0	41
COc1cccc(OCCC(=O)NCCCc2c(C)nn(C)c2C)c1	ZINC000450629868	EF	On-Demand	Anodyne	PANK3	0	41
Cc1nn(C)c(C)c1CCCNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450629869	FI	On-Demand	Anodyne	P2RX7	34	47
CCOC(=O)c1cc(C(=O)NCCN2CC=C(C)CC2)on1	ZINC000450629872	DD	On-Demand	Anodyne	DRD4	40	32
CC1=CCN(CCNC(=O)c2cccc3c2O[C@@H](C)C3)CC1	ZINC000450629879	DE	On-Demand	Anodyne	DRD4	41	33
CC1=CCN(CCNC(=O)c2cccc3c2O[C@H](C)C3)CC1	ZINC000450629880	DE	On-Demand	Anodyne	DRD4	41	33
COC(=O)c1coc(CN2CCN(c3ccc(F)cc3Cl)CC2)n1	ZINC000450629881	FF	On-Demand	Anodyne	DRD3	41	36
COC(=O)c1coc(CN2CCN(c3ccc(F)cc3Cl)CC2)n1	ZINC000450629881	FF	On-Demand	Anodyne	NPY2R	30	45
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	ESR1	74	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	ADRB1	31	41
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	HRH2	44	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	ESR2	42	42
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	LTA4H	74	53
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	HRH3	81	46
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	ABCB1	0	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	PSMB2	58	50
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	PSMB1	51	50
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@@H](O)C1CCC1	ZINC000450629882	ED	On-Demand	Anodyne	BIRC2	60	41
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	ESR1	74	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	ADRB1	31	41
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	HRH2	44	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	ESR2	42	42
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	LTA4H	74	53
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	HRH3	81	46
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	ABCB1	0	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	PSMB2	58	50
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	PSMB1	51	50
O=C(NCCc1ccc(OCCN2CCCC2)cc1)[C@H](O)C1CCC1	ZINC000450629883	ED	On-Demand	Anodyne	BIRC2	60	41
Cn1c(NCCOc2ccc(Cl)c(Cl)c2)nc2c1c(O)nc(=O)n2C	ZINC000450629896	GD	On-Demand	Anodyne	PROKR1	62	38
CC1(CO)CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450629910	FG	On-Demand	Anodyne	HRH4	31	53
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN(C)C2CC2)c1	ZINC000450629924	EJ	On-Demand	Anodyne	JAK1	0	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN(C)C2CC2)c1	ZINC000450629924	EJ	On-Demand	Anodyne	TYK2	67	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(CCN(C)C2CC2)c1	ZINC000450629924	EJ	On-Demand	Anodyne	KCNK3	55	36
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	ACE	68	41
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	MME	103	39
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	ANPEP	45	34
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	PAPA1_CARPA	51	36
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	CPA1	43	36
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	TIMP3	69	38
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	CAPNS1	50	32
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	CAPN1	50	36
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	CAPN2	45	32
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	ACE2	55	36
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	ADAM9	43	33
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	POL	0	51
CO[C@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629935	CF	On-Demand	Anodyne	AMP1_PLAFQ	68	36
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	ACE	68	41
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	MME	103	39
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	ANPEP	45	34
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	PAPA1_CARPA	51	36
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	CPA1	43	36
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	TIMP3	69	38
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	CAPNS1	50	32
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	CAPN1	50	36
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	CAPN2	45	32
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	ACE2	55	36
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	ADAM9	43	33
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	POL	0	51
CO[C@@H](Cc1ccccc1)C(=O)NC1Cc2ccccc2C1	ZINC000450629936	CF	On-Demand	Anodyne	AMP1_PLAFQ	68	36
C[C@@H](O)CCn1nnc(-c2cccc(C(F)(F)F)c2)n1	ZINC000450629950	CE	On-Demand	Anodyne	SCARB1	40	37
C[C@H](O)CCn1nnc(-c2cccc(C(F)(F)F)c2)n1	ZINC000450629951	CE	On-Demand	Anodyne	SCARB1	40	37
CC(=O)CCCCCSc1ccccn1	ZINC000450629965	BG	On-Demand	Anodyne	FAAH	47	43
CC(=O)CCCCCSc1ccccn1	ZINC000450629965	BG	On-Demand	Anodyne	FAS	20	43
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450629969	FG	On-Demand	Anodyne	CCKAR	50	35
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450629970	FG	On-Demand	Anodyne	CCKAR	50	35
CC(C)(CO)CCNc1nc2cc(C(F)(F)F)ccc2s1	ZINC000450629971	DH	On-Demand	Anodyne	CSNK1D	34	41
Cc1cc(Cl)c2ncc(C#N)c(NCCC(C)(C)CO)c2c1	ZINC000450629973	DH	On-Demand	Mild	MAP3K8	100	40
O=C(Cn1cc(NC(=O)C2=C(c3ccccc3)CCC2)cn1)NCCO	ZINC000450629975	FD	On-Demand	Anodyne	ITK	42	35
O=C(Cn1cc(NC(=O)C2=C(c3ccccc3)CCC2)cn1)NCCO	ZINC000450629975	FD	On-Demand	Anodyne	PANC	51	35
O=C(N[C@@H](CCO)C1CCOCC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450629981	FG	On-Demand	Anodyne	RBP4	58	40
O=C(N[C@H](CCO)C1CCOCC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450629982	FG	On-Demand	Anodyne	RBP4	58	40
C[C@H](CCCO)CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450629990	ED	On-Demand	Bother	COLA	66	36
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450629992	ED	On-Demand	Bother	COLA	66	36
Cc1cccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)n1	ZINC000450630012	DF	On-Demand	Anodyne	DRD4	17	59
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630013	GI	On-Demand	Anodyne	ACE	45	39
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630013	GI	On-Demand	Anodyne	XIAP	40	38
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630013	GI	On-Demand	Anodyne	BIRC3	49	37
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630013	GI	On-Demand	Anodyne	BIRC2	69	38
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630015	GI	On-Demand	Anodyne	ACE	45	39
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630015	GI	On-Demand	Anodyne	XIAP	40	38
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630015	GI	On-Demand	Anodyne	BIRC3	49	37
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630015	GI	On-Demand	Anodyne	BIRC2	69	38
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630016	GI	On-Demand	Anodyne	ACE	45	39
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630016	GI	On-Demand	Anodyne	XIAP	40	38
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630016	GI	On-Demand	Anodyne	BIRC3	49	37
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630016	GI	On-Demand	Anodyne	BIRC2	69	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630017	GI	On-Demand	Anodyne	ACE	45	39
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630017	GI	On-Demand	Anodyne	XIAP	40	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630017	GI	On-Demand	Anodyne	BIRC3	49	37
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21	ZINC000450630017	GI	On-Demand	Anodyne	BIRC2	69	38
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450630030	FD	On-Demand	Anodyne	PAPA1_CARPA	24	41
CC(C)(CO)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450630036	EG	On-Demand	Anodyne	KCNK3	56	38
CC(C)(CO)CCN=c1ccc(C(=O)Nc2cccc(Cl)c2)c[nH]1	ZINC000450630036	EG	On-Demand	Anodyne	KCNK9	23	41
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000450630037	FD	On-Demand	Anodyne	PAPA1_CARPA	24	41
C[C@@H](CCCO)CNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450630038	DG	On-Demand	Mild	MAP3K8	61	35
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450630039	FD	On-Demand	Anodyne	PAPA1_CARPA	24	41
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C	ZINC000450630040	FD	On-Demand	Anodyne	PAPA1_CARPA	24	41
C[C@H](CCCO)CNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450630041	DG	On-Demand	Mild	MAP3K8	61	35
CC[C@H](CSC)NC(=O)Cc1cc2ccccc2s1	ZINC000450630046	CH	On-Demand	Anodyne	PDS	50	33
CC[C@@H](CSC)NC(=O)Cc1cc2ccccc2s1	ZINC000450630048	CH	On-Demand	Anodyne	PDS	40	32
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2nc(C3CC3)n[nH]2)c([N+](=O)[O-])c1	ZINC000450630049	GD	On-Demand	Bother	TAAR1	17	41
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2nc(C3CC3)n[nH]2)c([N+](=O)[O-])c1	ZINC000450630050	GD	On-Demand	Bother	TAAR1	17	41
COCCO[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450630068	DF	On-Demand	Anodyne	DRD3	0	44
COCCO[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450630068	DF	On-Demand	Anodyne	AVPR1B	40	34
COCCO[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450630068	DF	On-Demand	Anodyne	SSTR5	46	41
COCCO[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450630069	DF	On-Demand	Anodyne	DRD3	0	44
COCCO[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450630069	DF	On-Demand	Anodyne	AVPR1B	40	34
COCCO[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450630069	DF	On-Demand	Anodyne	SSTR5	46	41
CC(F)(F)CCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000450630090	CE	On-Demand	Bother	F2RL3	46	33
COC(=O)c1csc(CN(Cc2cccnc2)C(C)C)n1	ZINC000450630094	DF	On-Demand	Anodyne	MMP9	15	42
CC(=O)N[C@H](C(=O)Nc1csc(-c2ccncc2)n1)C(C)(C)C	ZINC000450630100	EF	On-Demand	Anodyne	GPR142	15	45
COc1ccc(-c2ccnc(NCc3nc(C(C)C)n[nH]3)n2)cc1	ZINC000450630116	DG	On-Demand	Anodyne	CLK4	24	55
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)c1ccccc1[N+](=O)[O-]	ZINC000450630122	DD	On-Demand	Bother	COLA	95	38
C[C@H](NC(=O)CS(=O)(=O)C1CC1)c1ccccc1[N+](=O)[O-]	ZINC000450630123	DD	On-Demand	Bother	COLA	95	38
C[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630129	CD	On-Demand	Bother	PQSD	0	43
C[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630130	CD	On-Demand	Bother	PQSD	0	43
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630131	CD	On-Demand	Bother	PQSD	0	43
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630132	CD	On-Demand	Bother	PQSD	0	43
COC(=O)c1ccc(CN(C[C@@H]2CCCO2)[C@@H]2CCSC2)cc1Cl	ZINC000450630137	FH	On-Demand	Anodyne	OXTR	24	41
COC(=O)c1ccc(CN(C[C@@H]2CCCO2)[C@@H]2CCSC2)cc1Cl	ZINC000450630137	FH	On-Demand	Anodyne	AVPR1A	0	41
COC(=O)c1ccc(CN(C[C@@H]2CCCO2)[C@H]2CCSC2)cc1Cl	ZINC000450630138	FH	On-Demand	Anodyne	OXTR	24	41
COC(=O)c1ccc(CN(C[C@@H]2CCCO2)[C@H]2CCSC2)cc1Cl	ZINC000450630138	FH	On-Demand	Anodyne	AVPR1A	0	41
COC(=O)c1ccc(CN(C[C@H]2CCCO2)[C@@H]2CCSC2)cc1Cl	ZINC000450630139	FH	On-Demand	Anodyne	OXTR	24	41
COC(=O)c1ccc(CN(C[C@H]2CCCO2)[C@@H]2CCSC2)cc1Cl	ZINC000450630139	FH	On-Demand	Anodyne	AVPR1A	0	41
COC(=O)c1ccc(CN(C[C@H]2CCCO2)[C@H]2CCSC2)cc1Cl	ZINC000450630140	FH	On-Demand	Anodyne	OXTR	24	41
COC(=O)c1ccc(CN(C[C@H]2CCCO2)[C@H]2CCSC2)cc1Cl	ZINC000450630140	FH	On-Demand	Anodyne	AVPR1A	0	41
CS(=O)(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450630145	GF	On-Demand	Anodyne	RBP4	94	44
CS(=O)(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450630145	GF	On-Demand	Anodyne	SFRP1	101	33
CS(=O)(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450630145	GF	On-Demand	Anodyne	WNT3	74	33
CS(=O)(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450630146	GF	On-Demand	Anodyne	RBP4	94	44
CS(=O)(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450630146	GF	On-Demand	Anodyne	SFRP1	101	33
CS(=O)(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450630146	GF	On-Demand	Anodyne	WNT3	74	33
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cccnc2)c(OC)c1	ZINC000450630149	FF	On-Demand	Anodyne	PTAFR	29	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cccnc2)c(OC)c1	ZINC000450630149	FF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cccnc2)c(OC)c1	ZINC000450630149	FF	On-Demand	Anodyne	CHRNA2	41	43
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cccnc2)c(OC)c1	ZINC000450630149	FF	On-Demand	Anodyne	CRTY	0	43
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cccnc2)c(OC)c1	ZINC000450630150	FF	On-Demand	Anodyne	PTAFR	29	40
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cccnc2)c(OC)c1	ZINC000450630150	FF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cccnc2)c(OC)c1	ZINC000450630150	FF	On-Demand	Anodyne	CHRNA2	41	43
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cccnc2)c(OC)c1	ZINC000450630150	FF	On-Demand	Anodyne	CRTY	0	43
Cc1ccc(NC(=O)c2ccc(NCc3nc(C4CC4)n[nH]3)c([N+](=O)[O-])c2)cc1	ZINC000450630166	GH	On-Demand	Bother	TAAR1	20	45
COc1cc(CN(C)CCN(C)C2CCN(C)CC2)ccc1Cl	ZINC000450630188	EF	On-Demand	Anodyne	UTS2R	21	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@H](S(C)(=O)=O)C1	ZINC000450630190	FD	On-Demand	Anodyne	RHODESAIN	0	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@H](S(C)(=O)=O)C1	ZINC000450630198	FD	On-Demand	Anodyne	RHODESAIN	0	46
CCS(=O)(=O)c1ccc(CN2CCc3n[nH]cc3C2)cc1	ZINC000450630201	DD	On-Demand	Anodyne	NOD2	40	34
Clc1ccc(CCN(Cc2cccnc2)C2CC2)cc1	ZINC000450630203	CH	On-Demand	Anodyne	NR1D1	35	43
O=C(N[C@@H](CCO)C1CCOCC1)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450630217	GE	On-Demand	Anodyne	MAPK1	40	33
O=C(N[C@H](CCO)C1CCOCC1)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450630218	GE	On-Demand	Anodyne	MAPK1	40	33
O=C(c1ccc(F)cc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450630239	FH	On-Demand	Anodyne	FIMH	19	41
FC1(F)CC(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)C1	ZINC000450630246	DF	On-Demand	Anodyne	DRD4	16	58
CC(C)(CO)CCNc1ncccc1OCc1ccccc1	ZINC000450630247	DG	On-Demand	Anodyne	PPIA	56	47
Cc1ccc2c(n1)OCCN2C(=O)c1cccc2c1CCCC2	ZINC000450630263	DG	On-Demand	Anodyne	AVPR2	43	38
C[C@@H]1Cc2cccc(C(=O)Nc3cnn(CC(=O)NCCO)c3)c2O1	ZINC000450630281	EC	On-Demand	Anodyne	PANC	56	37
C[C@H]1Cc2cccc(C(=O)Nc3cnn(CC(=O)NCCO)c3)c2O1	ZINC000450630282	EC	On-Demand	Anodyne	PANC	56	37
CCCc1cc(O)nc(SCC(=O)c2ccc(C(=O)OC)o2)n1	ZINC000450630289	EE	On-Demand	Anodyne	CA7	20	52
CCCc1cc(O)nc(SCC(=O)c2ccc(C(=O)OC)o2)n1	ZINC000450630289	EE	On-Demand	Anodyne	CA13	31	54
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	HTR1A	34	51
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	DRD2	33	43
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	DRD4	45	34
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	ACHE	19	44
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	DRD3	42	39
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	AVPR1B	18	41
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	PDGFRB	48	40
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	PTAFR	31	41
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	HTR7	41	51
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	SIGMAR1	21	46
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	CHRNA7	43	45
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	MTNR1A	49	40
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	MTNR1B	45	40
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	SLC9A1	43	29
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	FAAH	24	42
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	CSF1R	19	40
COc1ccc(CNC(=O)CCN2CCN(Cc3cccnc3)CC2)c(OC)c1	ZINC000450630305	GD	On-Demand	Anodyne	ABHD6	0	42
COC(=O)c1cccc(CN2CCC[C@H]2c2cccnc2)c1Cl	ZINC000450630314	EH	On-Demand	Anodyne	CHRNA2	43	45
COC(=O)c1cccc(CN2CCC[C@H]2c2cccnc2)c1Cl	ZINC000450630314	EH	On-Demand	Anodyne	CHRNA7	17	45
COC(=O)c1cccc(CN2CCC[C@H]2c2cccnc2)c1Cl	ZINC000450630314	EH	On-Demand	Anodyne	CRTY	0	45
COC(=O)c1cccc(CN2CCC[C@@H]2c2cccnc2)c1Cl	ZINC000450630315	EH	On-Demand	Anodyne	CHRNA2	43	45
COC(=O)c1cccc(CN2CCC[C@@H]2c2cccnc2)c1Cl	ZINC000450630315	EH	On-Demand	Anodyne	CHRNA7	17	45
COC(=O)c1cccc(CN2CCC[C@@H]2c2cccnc2)c1Cl	ZINC000450630315	EH	On-Demand	Anodyne	CRTY	0	45
CC[C@H](CSC)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450630318	CE	On-Demand	Anodyne	HPGDS	16	44
CC[C@@H](CSC)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450630319	CE	On-Demand	Anodyne	HPGDS	16	44
CN1CCN(c2nc3ccccc3nc2NCc2nc(C3CC3)n[nH]2)CC1	ZINC000450630348	FD	On-Demand	Anodyne	HTR3A	19	43
C[C@H](c1cccnc1)N(C)CC1=CCCCC1	ZINC000450630350	BH	On-Demand	Anodyne	KCNA5	40	36
C[C@@H](c1cccnc1)N(C)CC1=CCCCC1	ZINC000450630351	BH	On-Demand	Anodyne	KCNA5	40	36
CC(C)N(Cc1cccnc1)CC1CC(F)(F)C1	ZINC000450630354	CG	On-Demand	Anodyne	NR1D1	42	33
COc1cc(CC(=O)N2CCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450630366	ED	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450630366	ED	On-Demand	Anodyne	OPRK1	43	41
COc1cc(CC(=O)N2CCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450630367	ED	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450630367	ED	On-Demand	Anodyne	OPRK1	43	41
COc1ccc2c(c1)CCN(C[C@@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000450630384	CF	On-Demand	Anodyne	DRD5	18	43
COc1ccc2c(c1)CCN(C[C@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000450630385	CF	On-Demand	Anodyne	DRD5	18	43
Clc1ccc(CCN2CCC[C@H]2c2cccnc2)cc1	ZINC000450630391	CI	On-Demand	Anodyne	CHRNA2	54	56
Clc1ccc(CCN2CCC[C@H]2c2cccnc2)cc1	ZINC000450630391	CI	On-Demand	Anodyne	HRH3	37	43
Clc1ccc(CCN2CCC[C@H]2c2cccnc2)cc1	ZINC000450630391	CI	On-Demand	Anodyne	CHRNA7	15	56
Clc1ccc(CCN2CCC[C@H]2c2cccnc2)cc1	ZINC000450630391	CI	On-Demand	Anodyne	Q8WSF8_APLCA	16	56
Clc1ccc(CCN2CCC[C@H]2c2cccnc2)cc1	ZINC000450630391	CI	On-Demand	Anodyne	CRTY	0	56
Clc1ccc(CCN2CCC[C@@H]2c2cccnc2)cc1	ZINC000450630393	CI	On-Demand	Anodyne	CHRNA2	54	56
Clc1ccc(CCN2CCC[C@@H]2c2cccnc2)cc1	ZINC000450630393	CI	On-Demand	Anodyne	HRH3	37	43
Clc1ccc(CCN2CCC[C@@H]2c2cccnc2)cc1	ZINC000450630393	CI	On-Demand	Anodyne	CHRNA7	15	56
Clc1ccc(CCN2CCC[C@@H]2c2cccnc2)cc1	ZINC000450630393	CI	On-Demand	Anodyne	Q8WSF8_APLCA	16	56
Clc1ccc(CCN2CCC[C@@H]2c2cccnc2)cc1	ZINC000450630393	CI	On-Demand	Anodyne	CRTY	0	56
CSc1ccc2ncnc(NCc3nc(C(C)C)n[nH]3)c2c1	ZINC000450630394	DF	On-Demand	Anodyne	CLK4	62	39
c1ccc2[nH]c(CN3CCN(Cc4cc[nH]n4)CC3)nc2c1	ZINC000450630395	CD	On-Demand	Anodyne	DRD4	18	60
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450630397	GD	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450630400	GD	On-Demand	Anodyne	CACNA1I	45	32
COc1ccc2c(c1)CCN(C[C@@H]1CCCCN1C(C)C)CC2	ZINC000450630406	DG	On-Demand	Anodyne	DRD5	17	43
COc1ccc2c(c1)CCN(C[C@@H]1CCCCN1C(C)C)CC2	ZINC000450630406	DG	On-Demand	Anodyne	HRH3	23	47
COc1ccc2c(c1)CCN(C[C@H]1CCCCN1C(C)C)CC2	ZINC000450630409	DG	On-Demand	Anodyne	DRD5	17	43
COc1ccc2c(c1)CCN(C[C@H]1CCCCN1C(C)C)CC2	ZINC000450630409	DG	On-Demand	Anodyne	HRH3	23	47
Cc1cc(OCc2nnc(C3CC3)s2)ccc1Cl	ZINC000450630422	CH	On-Demand	Anodyne	MAOA	30	40
CN1CCC(N(C)CCN(C)CCc2ccc(Cl)cc2)CC1	ZINC000450630425	DF	On-Demand	Anodyne	SIGMAR1	21	61
CN1CCC(N(C)CCN(C)CCc2ccc(Cl)cc2)CC1	ZINC000450630425	DF	On-Demand	Anodyne	NOS3	16	48
COCCO[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450630431	DE	On-Demand	Anodyne	SLC6A1	119	40
COCCO[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450630431	DE	On-Demand	Anodyne	SIGMAR1	39	45
COCCO[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450630432	DE	On-Demand	Anodyne	SLC6A1	119	40
COCCO[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450630432	DE	On-Demand	Anodyne	SIGMAR1	39	45
O=C(N[C@@H](CCO)C1CCOCC1)c1cc(Cl)c2ccccc2n1	ZINC000450630434	EF	On-Demand	Anodyne	CCR1	23	41
O=C(N[C@H](CCO)C1CCOCC1)c1cc(Cl)c2ccccc2n1	ZINC000450630436	EF	On-Demand	Anodyne	CCR1	23	41
C[C@H](NC(=O)[C@]1(C)CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630458	CH	On-Demand	Bother	SDH1	0	43
C[C@H](NC(=O)[C@]1(C)CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630458	CH	On-Demand	Bother	COLA	56	31
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630459	CH	On-Demand	Bother	SDH1	0	43
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630459	CH	On-Demand	Bother	COLA	56	31
C[C@@H](NC(=O)[C@]1(C)CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630460	CH	On-Demand	Bother	SDH1	0	43
C[C@@H](NC(=O)[C@]1(C)CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630460	CH	On-Demand	Bother	COLA	56	31
C[C@@H](NC(=O)[C@@]1(C)CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630461	CH	On-Demand	Bother	SDH1	0	43
C[C@@H](NC(=O)[C@@]1(C)CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000450630461	CH	On-Demand	Bother	COLA	56	31
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccccc1[N+](=O)[O-]	ZINC000450630472	EF	On-Demand	Bother	HPGDS	22	41
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccccc1[N+](=O)[O-]	ZINC000450630473	EF	On-Demand	Bother	HPGDS	22	41
COc1ccc2c(c1)CCN(Cc1cn(CC3CC3)nn1)CC2	ZINC000450630474	DE	On-Demand	Anodyne	DRD5	15	41
CCC(=O)c1ccc(OCC(=O)CC(C)(C)C2CC2)cc1	ZINC000450630475	CI	On-Demand	Anodyne	PLA2G4B	85	42
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N[C@@H](CCO)C1CCOCC1	ZINC000450630476	GF	On-Demand	Anodyne	AVPR1B	48	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N[C@@H](CCO)C1CCOCC1	ZINC000450630476	GF	On-Demand	Anodyne	PDE6D	90	38
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N[C@@H](CCO)C1CCOCC1	ZINC000450630476	GF	On-Demand	Anodyne	NR1H4	0	43
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N[C@@H](CCO)C1CCOCC1	ZINC000450630476	GF	On-Demand	Anodyne	IMDH_CRYPV	33	48
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N[C@H](CCO)C1CCOCC1	ZINC000450630477	GF	On-Demand	Anodyne	AVPR1B	48	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N[C@H](CCO)C1CCOCC1	ZINC000450630477	GF	On-Demand	Anodyne	PDE6D	90	38
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N[C@H](CCO)C1CCOCC1	ZINC000450630477	GF	On-Demand	Anodyne	NR1H4	0	43
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N[C@H](CCO)C1CCOCC1	ZINC000450630477	GF	On-Demand	Anodyne	IMDH_CRYPV	33	48
CS(=O)(=O)[C@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630485	GF	On-Demand	Anodyne	HRH1	19	41
CS(=O)(=O)[C@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630485	GF	On-Demand	Anodyne	PDE6D	92	41
CS(=O)(=O)[C@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630485	GF	On-Demand	Anodyne	HDAC8	36	40
CS(=O)(=O)[C@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630485	GF	On-Demand	Anodyne	HDAC6	25	40
CS(=O)(=O)[C@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630485	GF	On-Demand	Anodyne	IMDH_CRYPV	30	44
CC[C@H](CC(C)C)C(=O)Nc1csc(-c2ccncc2)n1	ZINC000450630486	DI	On-Demand	Anodyne	GPR142	24	48
CS(=O)(=O)[C@@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630487	GF	On-Demand	Anodyne	HRH1	19	41
CS(=O)(=O)[C@@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630487	GF	On-Demand	Anodyne	PDE6D	92	41
CS(=O)(=O)[C@@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630487	GF	On-Demand	Anodyne	HDAC8	36	40
CS(=O)(=O)[C@@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630487	GF	On-Demand	Anodyne	HDAC6	25	40
CS(=O)(=O)[C@@H]1CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450630487	GF	On-Demand	Anodyne	IMDH_CRYPV	30	44
CC[C@@H](CC(C)C)C(=O)Nc1csc(-c2ccncc2)n1	ZINC000450630488	DI	On-Demand	Anodyne	GPR142	23	48
CC(=O)CCCCCn1cnc2ccccc2c1=O	ZINC000450630490	CF	On-Demand	Anodyne	HTR7	23	58
CCS(=O)(=O)c1ccc(CN(Cc2cccnc2)C(C)C)cc1	ZINC000450630499	EG	On-Demand	Anodyne	NR1D1	46	39
C[C@H](CCCO)CNc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1	ZINC000450630500	GE	On-Demand	Anodyne	MTNN	63	33
CC(C)c1nnc(CN2CCC[C@@H]2c2cccnc2)s1	ZINC000450630501	CG	On-Demand	Anodyne	CHRNA2	50	51
CC(C)c1nnc(CN2CCC[C@@H]2c2cccnc2)s1	ZINC000450630501	CG	On-Demand	Anodyne	CRTY	0	51
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1	ZINC000450630502	GE	On-Demand	Anodyne	MTNN	63	33
CCS(=O)(=O)c1ccc(CN2CCC[C@H](OCCOC)C2)cc1	ZINC000450630504	EE	On-Demand	Anodyne	HRH3	15	41
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](OCCOC)C2)cc1	ZINC000450630505	EE	On-Demand	Anodyne	HRH3	15	41
CSc1cccc(C(=O)Nc2cnn(CC(=O)NCCO)c2)c1	ZINC000450630506	EC	On-Demand	Anodyne	DDR1	43	34
CSc1cccc(C(=O)Nc2cnn(CC(=O)NCCO)c2)c1	ZINC000450630506	EC	On-Demand	Anodyne	PANC	44	31
CSc1cccc(C(=O)Nc2cnn(CC(=O)NCCO)c2)c1	ZINC000450630506	EC	On-Demand	Anodyne	KCNK3	49	31
CC(C)c1nnc(CN2CCC[C@H]2c2cccnc2)s1	ZINC000450630507	CG	On-Demand	Anodyne	CHRNA2	50	51
CC(C)c1nnc(CN2CCC[C@H]2c2cccnc2)s1	ZINC000450630507	CG	On-Demand	Anodyne	CRTY	0	51
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1csc(-c2ccncc2)n1	ZINC000450630509	FH	On-Demand	Anodyne	GPR142	49	49
COCCO[C@H]1CCCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450630526	EF	On-Demand	Anodyne	SLC6A1	75	37
COCCO[C@@H]1CCCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450630527	EF	On-Demand	Anodyne	SLC6A1	75	37
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000450630546	FD	On-Demand	Bother	TAAR1	17	43
COC(=O)[C@H](C)NC(=O)c1ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000450630547	FD	On-Demand	Bother	TAAR1	17	43
COc1cccc2c(NCc3nc(C(C)C)n[nH]3)nccc12	ZINC000450630555	CG	On-Demand	Anodyne	EIF2AK1	46	33
C[C@H](CCCO)CNc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450630584	GH	On-Demand	Anodyne	PDS	18	63
C[C@@H](CCCO)CNc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450630586	GH	On-Demand	Anodyne	PDS	18	63
CC(=O)c1cccc(CSC2CCCC2)c1	ZINC000450630588	BI	On-Demand	Anodyne	QRFPR	44	42
CC(C)(CC(=O)CSc1ccccn1)C1CC1	ZINC000450630589	BH	On-Demand	Anodyne	FAS	18	42
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450630595	DF	On-Demand	Anodyne	CCKAR	40	33
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cnn2c1CCC2	ZINC000450630596	DF	On-Demand	Anodyne	CCKAR	40	33
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2ccccn2)c(OC)c1	ZINC000450630598	FF	On-Demand	Anodyne	MTNR1A	44	39
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2ccccn2)c(OC)c1	ZINC000450630600	FF	On-Demand	Anodyne	MTNR1A	44	39
CCOC(=O)CSCc1ccc(S(=O)(=O)CC)cc1	ZINC000450630601	DE	On-Demand	Anodyne	RORC	55	32
c1cncc(CN(Cc2nnc(C3CC3)s2)C2CC2)c1	ZINC000450630614	CF	On-Demand	Anodyne	NR1D1	41	33
Cc1cc(-c2nc(C(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)co2)ccn1	ZINC000450630628	FD	On-Demand	Anodyne	IRAK4	21	42
CC(C)(CO)CCNc1ccnc2c(Cl)cccc12	ZINC000450630630	CH	On-Demand	Anodyne	HNMT	41	35
CC(=O)c1ccc(CSCC(C)C)cc1	ZINC000450630635	BH	On-Demand	Anodyne	ACE	18	40
CC(=O)c1ccc(CSCC(C)C)cc1	ZINC000450630635	BH	On-Demand	Anodyne	LTA4H	37	40
Cc1cc(-c2nc(C(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)co2)ccn1	ZINC000450630637	FD	On-Demand	Anodyne	IRAK4	21	42
CC(C)c1n[nH]c(CNc2ccnc3cc(F)c(Cl)cc23)n1	ZINC000450630674	DH	On-Demand	Anodyne	HRP1_PLAFA	51	32
O=C(CCSCc1ccccc1)NC(=O)NCCC(F)(F)F	ZINC000450630679	EG	On-Demand	Anodyne	CACNA2D1	29	41
COc1ccc2c(c1)CCN(CC1CC(F)(F)C1)CC2	ZINC000450630684	CG	On-Demand	Anodyne	DRD5	17	48
CC(C)(CO)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450630704	FD	On-Demand	Bother	BCL2	18	40
COC(=O)c1csc(CN2CCC[C@@H]2c2cccnc2)n1	ZINC000450630705	DF	On-Demand	Anodyne	CHRNA2	44	45
COC(=O)c1csc(CN2CCC[C@@H]2c2cccnc2)n1	ZINC000450630705	DF	On-Demand	Anodyne	CRTY	0	45
COC(=O)c1csc(CN2CCC[C@H]2c2cccnc2)n1	ZINC000450630706	DF	On-Demand	Anodyne	CHRNA2	44	45
COC(=O)c1csc(CN2CCC[C@H]2c2cccnc2)n1	ZINC000450630706	DF	On-Demand	Anodyne	CRTY	0	45
O=[N+]([O-])c1cc(Br)cnc1NCc1nc(C2CC2)n[nH]1	ZINC000450630707	EE	On-Demand	Bother	PRKCQ	40	37
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630709	GI	On-Demand	Mild	COLA	49	49
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630709	GI	On-Demand	Mild	CPT1A	48	49
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630709	GI	On-Demand	Mild	GRM5	0	45
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630710	GI	On-Demand	Mild	COLA	49	49
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630710	GI	On-Demand	Mild	CPT1A	48	49
Cc1[nH]c(C#N)cc1C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630710	GI	On-Demand	Mild	GRM5	0	45
CC(C)N(CCN(C)Cc1ccccc1)Cc1cccnc1	ZINC000450630725	CG	On-Demand	Anodyne	NR1D1	43	35
Cc1nn(C)cc1CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630726	GH	On-Demand	Anodyne	COLA	108	51
Cc1nn(C)cc1CC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630726	GH	On-Demand	Anodyne	CPT1A	105	51
Cc1nn(C)cc1CC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630727	GH	On-Demand	Anodyne	COLA	108	51
Cc1nn(C)cc1CC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450630727	GH	On-Demand	Anodyne	CPT1A	105	51
COc1nccc(CN2CC(Cc3ccc(F)c(F)c3)C2)n1	ZINC000450630728	DE	On-Demand	Anodyne	ABCC1	40	34
Cc1nn(C)cc1COc1cccc(Cl)c1Cl	ZINC000450630753	CH	On-Demand	Anodyne	BDKRB2	36	43
Cc1ccc(C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])c(C(C)C)n1	ZINC000450630754	EH	On-Demand	Bother	COLA	66	31
Cc1ccc(C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])c(C(C)C)n1	ZINC000450630755	EH	On-Demand	Bother	COLA	66	31
COc1ccc(CNC(=O)CCN2CCc3n[nH]cc3C2)c(OC)c1	ZINC000450630763	ED	On-Demand	Anodyne	HTR1A	33	42
COc1ccc(CNC(=O)CCN2CCc3n[nH]cc3C2)c(OC)c1	ZINC000450630763	ED	On-Demand	Anodyne	DRD4	40	32
COc1ccc(CNC(=O)CCN2CCc3n[nH]cc3C2)c(OC)c1	ZINC000450630763	ED	On-Demand	Anodyne	HTR7	53	45
COc1ccc(CNC(=O)CCN2CCc3n[nH]cc3C2)c(OC)c1	ZINC000450630763	ED	On-Demand	Anodyne	ABCB1B	46	34
CCOCc1nc(C)c(C(=O)NCCc2nc(-c3ccccc3)n[nH]2)s1	ZINC000450630782	FF	On-Demand	Anodyne	SCD1	24	48
COc1ccc2c(c1)CCN(Cc1cccnc1N)CC2	ZINC000450630794	CE	On-Demand	Anodyne	DRD5	17	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]1c1ccncc1	ZINC000450630806	CG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]1c1ccncc1	ZINC000450630807	CG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H]1c1ccncc1	ZINC000450630809	CG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]1c1ccncc1	ZINC000450630811	CG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
CN(CCN1CCC[C@H]1c1cccnc1)Cc1ccccc1	ZINC000450630817	CG	On-Demand	Anodyne	CHRNA2	53	54
CN(CCN1CCC[C@H]1c1cccnc1)Cc1ccccc1	ZINC000450630817	CG	On-Demand	Anodyne	CRTY	0	54
CN(CCN1CCC[C@@H]1c1cccnc1)Cc1ccccc1	ZINC000450630819	CG	On-Demand	Anodyne	CHRNA2	53	54
CN(CCN1CCC[C@@H]1c1cccnc1)Cc1ccccc1	ZINC000450630819	CG	On-Demand	Anodyne	CRTY	0	54
O=C(c1ccccc1)c1ccc(NC[C@]2(O)CCS(=O)(=O)C2)c([N+](=O)[O-])c1	ZINC000450630820	GD	On-Demand	Bother	TAAR1	15	42
O=C(c1ccccc1)c1ccc(NC[C@@]2(O)CCS(=O)(=O)C2)c([N+](=O)[O-])c1	ZINC000450630822	GD	On-Demand	Bother	TAAR1	15	42
CCC(CC)(CCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)C(=O)OC	ZINC000450630824	EF	On-Demand	Bother	F2RL3	44	32
COc1cccc(-n2cc(C(=O)N3CCN(c4cc(OC)ncn4)CC3)nn2)c1	ZINC000450630829	GD	On-Demand	Anodyne	DRD4	43	36
COc1cccc(-n2cc(C(=O)N3CCN(c4cc(OC)ncn4)CC3)nn2)c1	ZINC000450630829	GD	On-Demand	Anodyne	CCKAR	61	50
COc1cccc(-n2cc(C(=O)N3CCN(c4cc(OC)ncn4)CC3)nn2)c1	ZINC000450630829	GD	On-Demand	Anodyne	CCKBR	0	40
COc1cccc(-n2cc(C(=O)N3CCN(c4cc(OC)ncn4)CC3)nn2)c1	ZINC000450630829	GD	On-Demand	Anodyne	HPGD	20	42
NS(=O)(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450630840	DD	On-Demand	Anodyne	SIGMAR1	37	53
C[C@@H](c1cccnc1)N(C)CC/C=C\c1ccccc1	ZINC000450630876	CI	On-Demand	Anodyne	KCNA5	50	39
C[C@H](c1cccnc1)N(C)CC/C=C\c1ccccc1	ZINC000450630877	CI	On-Demand	Anodyne	KCNA5	50	39
C[C@H](c1cccnc1)N(C)CC/C=C/c1ccccc1	ZINC000450630878	CI	On-Demand	Anodyne	KCNA5	50	39
C[C@@H](c1cccnc1)N(C)CC/C=C/c1ccccc1	ZINC000450630879	CI	On-Demand	Anodyne	KCNA5	50	39
C[C@@H](CCCO)CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450630880	EE	On-Demand	Anodyne	HTR3A	22	52
C[C@H](CCCO)CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450630882	EE	On-Demand	Anodyne	HTR3A	22	52
O=C(CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1)C1CC1	ZINC000450630888	GI	On-Demand	Anodyne	COLA	126	54
O=C(CCCC(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1)C1CC1	ZINC000450630888	GI	On-Demand	Anodyne	CPT1A	121	54
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	MME	47	39
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	ANPEP	49	40
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	CTSL	18	43
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	CAPNS1	46	34
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	CAPN1	65	38
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	CAPN2	99	38
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	ACE2	49	37
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	NPR	60	35
CC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630889	DH	On-Demand	Anodyne	AMP1_PLAFQ	29	40
CCOCc1nc(C)c(C(=O)N2CCN(c3ccccc3)C[C@@H]2CC)s1	ZINC000450630890	FH	On-Demand	Anodyne	CCKAR	58	38
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	MME	47	39
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	ANPEP	49	40
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	CTSL	18	43
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	CAPNS1	46	34
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	CAPN1	65	38
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	CAPN2	99	38
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	ACE2	49	37
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	NPR	60	35
CC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450630891	DH	On-Demand	Anodyne	AMP1_PLAFQ	29	40
CCOCc1nc(C)c(C(=O)N2CCN(c3ccccc3)C[C@H]2CC)s1	ZINC000450630892	FH	On-Demand	Anodyne	CCKAR	58	38
O=C(CCCC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1)C1CC1	ZINC000450630897	GI	On-Demand	Anodyne	COLA	126	54
O=C(CCCC(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1)C1CC1	ZINC000450630897	GI	On-Demand	Anodyne	CPT1A	121	54
C[C@H](c1cccnc1)N(C)CC1(C#N)CCC1	ZINC000450630901	BF	On-Demand	Mild	KCNA5	40	36
C[C@@H](c1cccnc1)N(C)CC1(C#N)CCC1	ZINC000450630902	BF	On-Demand	Mild	KCNA5	40	36
COc1cc(CN2CCCSCC2)ccc1Cl	ZINC000450630904	CG	On-Demand	Anodyne	SSTR5	45	37
CCC(CC)(CNC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(OC)c(OC)c1	ZINC000450630926	GF	On-Demand	Anodyne	CACNA1G	36	43
CCC(CC)(CNC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(OC)c(OC)c1	ZINC000450630926	GF	On-Demand	Anodyne	ACKR3	40	33
CCC(CC)(CNC(=O)[C@H]1CCCN(C)C1=O)c1ccc(OC)c(OC)c1	ZINC000450630927	GF	On-Demand	Anodyne	CACNA1G	36	43
CCC(CC)(CNC(=O)[C@H]1CCCN(C)C1=O)c1ccc(OC)c(OC)c1	ZINC000450630927	GF	On-Demand	Anodyne	ACKR3	40	33
COc1ccc(CNC(=O)CCN2CCCSCC2)c(OC)c1	ZINC000450630928	EE	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCCSCC2)c(OC)c1	ZINC000450630928	EE	On-Demand	Anodyne	HTR7	30	43
COc1ccc(CNC(=O)CCN2CCCSCC2)c(OC)c1	ZINC000450630928	EE	On-Demand	Anodyne	MTNR1A	52	37
COc1cc(CC(=O)N2CC(CCO)C2)ccc1Cl	ZINC000450630932	CD	On-Demand	Anodyne	OPRK1	38	41
COc1cc(CC(=O)N2CC(CCO)C2)ccc1Cl	ZINC000450630932	CD	On-Demand	Anodyne	CCR1	32	40
Cc1nc(N(Cc2cccc(C(N)=O)c2)C2CC2)c2cc[nH]c2n1	ZINC000450630933	DF	On-Demand	Anodyne	IGF1R	46	31
CCOC(=O)C1([S@@](C)=O)CCN(c2ccnc(C(C)C)n2)CC1	ZINC000450630935	ED	On-Demand	Anodyne	SORD	69	39
CCOC(=O)C1([S@](C)=O)CCN(c2ccnc(C(C)C)n2)CC1	ZINC000450630937	ED	On-Demand	Anodyne	SORD	69	39
COCCO[C@H]1CCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450630967	EF	On-Demand	Anodyne	DRD3	0	44
COCCO[C@H]1CCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450630967	EF	On-Demand	Anodyne	OPRK1	37	41
COCCO[C@@H]1CCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450630968	EF	On-Demand	Anodyne	DRD3	0	44
COCCO[C@@H]1CCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450630968	EF	On-Demand	Anodyne	OPRK1	37	41
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H](C)c1cccnc1	ZINC000450630972	CG	On-Demand	Anodyne	KCNA5	30	44
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H](C)c1cccnc1	ZINC000450630973	CG	On-Demand	Anodyne	KCNA5	30	44
C[C@@H](c1cccnc1)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450630974	CG	On-Demand	Anodyne	KCNA5	30	44
C[C@@H](c1cccnc1)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450630975	CG	On-Demand	Anodyne	KCNA5	30	44
COc1cc(N2CCN(C(=O)c3ccnc(OC(F)F)c3)CC2)ncn1	ZINC000450631005	FD	On-Demand	Anodyne	SLC6A7	0	42
COc1cc(CN(C)CCCN2CCN(C)CC2)ccc1Cl	ZINC000450631020	EE	On-Demand	Anodyne	DRD2	28	40
COc1cc(CN(C)CCCN2CCN(C)CC2)ccc1Cl	ZINC000450631020	EE	On-Demand	Anodyne	DRD1	21	40
COc1cc(CN(C)CCCN2CCN(C)CC2)ccc1Cl	ZINC000450631020	EE	On-Demand	Anodyne	ACHE	19	41
COc1cc(CN(C)CCCN2CCN(C)CC2)ccc1Cl	ZINC000450631020	EE	On-Demand	Anodyne	CACNA1C	24	43
COc1cc(CN(C)CCCN2CCN(C)CC2)ccc1Cl	ZINC000450631020	EE	On-Demand	Anodyne	SIGMAR1	33	56
COc1cc(CN(C)CCCN2CCN(C)CC2)ccc1Cl	ZINC000450631020	EE	On-Demand	Anodyne	UTS2R	19	40
COc1cc(CN(C)CCCN2CCN(C)CC2)ccc1Cl	ZINC000450631020	EE	On-Demand	Anodyne	EBP	25	43
c1ccc(CCn2ccc(CN3CCC[C@H]3c3cccnc3)n2)cc1	ZINC000450631038	EH	On-Demand	Anodyne	CHRNA2	46	47
c1ccc(CCn2ccc(CN3CCC[C@H]3c3cccnc3)n2)cc1	ZINC000450631038	EH	On-Demand	Anodyne	CRTY	0	47
c1ccc(CCn2ccc(CN3CCC[C@@H]3c3cccnc3)n2)cc1	ZINC000450631039	EH	On-Demand	Anodyne	CHRNA2	46	47
c1ccc(CCn2ccc(CN3CCC[C@@H]3c3cccnc3)n2)cc1	ZINC000450631039	EH	On-Demand	Anodyne	CRTY	0	47
COc1ccc2c(c1)CCN(Cc1cccc(C)n1)CC2	ZINC000450631063	CF	On-Demand	Anodyne	ABCB1	0	44
COc1ccc2c(c1)CCN(C[C@@H]1CCC(F)(F)C1)CC2	ZINC000450631065	CH	On-Demand	Anodyne	DRD5	18	44
COc1ccc2c(c1)CCN(C[C@@H]1CCC(F)(F)C1)CC2	ZINC000450631065	CH	On-Demand	Anodyne	SIGMAR1	16	47
COc1ccc2c(c1)CCN(C[C@H]1CCC(F)(F)C1)CC2	ZINC000450631066	CH	On-Demand	Anodyne	DRD5	18	44
COc1ccc2c(c1)CCN(C[C@H]1CCC(F)(F)C1)CC2	ZINC000450631066	CH	On-Demand	Anodyne	SIGMAR1	16	47
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450631080	GD	On-Demand	Bother	CACNA1D	43	32
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450631081	GD	On-Demand	Bother	CACNA1D	43	32
CCn1nnc(C)c1COc1cccc(Cl)c1Cl	ZINC000450631085	CG	On-Demand	Anodyne	BDKRB2	26	41
CC(=O)CCCCCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000450631109	DE	On-Demand	Bother	F2RL3	45	34
Cc1ccc(NC(=O)c2ccc(NC[C@@H](C)CCCO)c([N+](=O)[O-])c2)cc1	ZINC000450631113	FH	On-Demand	Bother	TAAR1	18	47
Cc1ccc(NC(=O)c2ccc(NC[C@H](C)CCCO)c([N+](=O)[O-])c2)cc1	ZINC000450631114	FH	On-Demand	Bother	TAAR1	18	47
CCCc1cc(O)nc(SCc2ccc(S(=O)(=O)CC)cc2)n1	ZINC000450631120	FG	On-Demand	Anodyne	CA13	21	56
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450631126	ED	On-Demand	Anodyne	P2RY12	40	34
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450631126	ED	On-Demand	Anodyne	MAPK1	41	33
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H](CCO)C1CCOCC1	ZINC000450631126	ED	On-Demand	Anodyne	CTSV	44	31
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450631127	ED	On-Demand	Anodyne	P2RY12	40	34
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450631127	ED	On-Demand	Anodyne	MAPK1	41	33
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H](CCO)C1CCOCC1	ZINC000450631127	ED	On-Demand	Anodyne	CTSV	44	31
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cc2n(n1)CCC2	ZINC000450631131	DF	On-Demand	Anodyne	CCKAR	52	37
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cc2n(n1)CCC2	ZINC000450631132	DF	On-Demand	Anodyne	CCKAR	52	37
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccsn1	ZINC000450631148	DF	On-Demand	Anodyne	CCKAR	55	38
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccsn1	ZINC000450631149	DF	On-Demand	Anodyne	CCKAR	55	38
CCC(CC)(CCn1ncc(Cl)c(Cl)c1=O)C(=O)OC	ZINC000450631161	DF	On-Demand	Anodyne	NPBWR1	66	35
CCS(=O)(=O)c1ccc(CN(C)CCCN2CCN(C)CC2)cc1	ZINC000450631176	FD	On-Demand	Anodyne	SIGMAR1	15	45
CN(C)S(=O)(=O)c1ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000450631191	ED	On-Demand	Bother	BDKRB1	25	46
CN(C)S(=O)(=O)c1ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000450631191	ED	On-Demand	Bother	COLA	45	32
C[C@H](CCCO)CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450631193	GD	On-Demand	Bother	BDKRB1	0	40
C[C@H](CCCO)CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450631193	GD	On-Demand	Bother	BCL2L1	55	34
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450631194	GD	On-Demand	Bother	BDKRB1	0	40
C[C@@H](CCCO)CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450631194	GD	On-Demand	Bother	BCL2L1	55	34
Cc1ccc(-n2ncc(NCCC(C)(C)CO)c(Cl)c2=O)cc1Cl	ZINC000450631199	FH	On-Demand	Anodyne	NPBWR1	42	39
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450631206	GE	On-Demand	Anodyne	PDGFRB	55	44
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450631206	GE	On-Demand	Anodyne	SIRT3	61	32
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450631206	GE	On-Demand	Anodyne	SIRT2	49	30
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450631209	GE	On-Demand	Anodyne	PDGFRB	55	44
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450631209	GE	On-Demand	Anodyne	SIRT3	61	32
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450631209	GE	On-Demand	Anodyne	SIRT2	49	30
CC1(O)CC(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)C1	ZINC000450631210	CD	On-Demand	Bother	CCR2	23	46
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631212	DF	On-Demand	Anodyne	MC4R	29	43
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631212	DF	On-Demand	Anodyne	MC3R	45	43
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631212	DF	On-Demand	Anodyne	MC5R	31	43
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631213	DF	On-Demand	Anodyne	MC4R	29	43
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631213	DF	On-Demand	Anodyne	MC3R	45	43
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631213	DF	On-Demand	Anodyne	MC5R	31	43
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631214	DF	On-Demand	Anodyne	MC4R	29	43
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631214	DF	On-Demand	Anodyne	MC3R	45	43
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631214	DF	On-Demand	Anodyne	MC5R	31	43
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631215	DF	On-Demand	Anodyne	MC4R	29	43
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631215	DF	On-Demand	Anodyne	MC3R	45	43
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(CCO)C1	ZINC000450631215	DF	On-Demand	Anodyne	MC5R	31	43
O=C(N1CCc2ncc([N+](=O)[O-])cc2C1)C1(C(F)(F)F)CCC1	ZINC000450631216	EF	On-Demand	Bother	CCR2	23	45
CC(C)(C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)C1CCC1	ZINC000450631217	DF	On-Demand	Bother	CCR2	0	46
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cc2ccncc2s1	ZINC000450631224	FI	On-Demand	Anodyne	CCKAR	49	35
COc1cc(N2CCN(C(=O)c3cc(C)n(C(C)C)n3)CC2)ncn1	ZINC000450631225	ED	On-Demand	Anodyne	TACR3	16	40
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cc2ccncc2s1	ZINC000450631226	FI	On-Demand	Anodyne	CCKAR	49	35
COc1cc(N2CCN(C(=O)c3cn(CCc4ccccc4)nn3)CC2)ncn1	ZINC000450631227	GD	On-Demand	Anodyne	CCKAR	33	43
CN(CCN1CCC[C@@H](Cc2nccn2C)C1)Cc1ccccc1	ZINC000450631234	EF	On-Demand	Anodyne	SLC6A1	40	32
CN(CCN1CCC[C@@H](Cc2nccn2C)C1)Cc1ccccc1	ZINC000450631234	EF	On-Demand	Anodyne	SIGMAR1	21	44
CN(CCN1CCC[C@@H](Cc2nccn2C)C1)Cc1ccccc1	ZINC000450631234	EF	On-Demand	Anodyne	CCR3	57	38
CN(CCN1CCC[C@H](Cc2nccn2C)C1)Cc1ccccc1	ZINC000450631235	EF	On-Demand	Anodyne	SLC6A1	40	32
CN(CCN1CCC[C@H](Cc2nccn2C)C1)Cc1ccccc1	ZINC000450631235	EF	On-Demand	Anodyne	SIGMAR1	21	44
CN(CCN1CCC[C@H](Cc2nccn2C)C1)Cc1ccccc1	ZINC000450631235	EF	On-Demand	Anodyne	CCR3	57	38
COc1cc(N2CCN(C(=O)c3ccc(C)c(Cl)c3Cl)CC2)ncn1	ZINC000450631237	GG	On-Demand	Anodyne	P2RX7	36	40
Cc1nn(C)cc1CN1CCN(c2cncc(F)c2)CC1	ZINC000450631248	CD	On-Demand	Anodyne	DRD1	16	46
Cc1nn(C)cc1CN1CCN(c2cncc(F)c2)CC1	ZINC000450631248	CD	On-Demand	Anodyne	DRD4	18	41
C[C@@H](c1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1)C(F)(F)F	ZINC000450631253	FJ	On-Demand	Anodyne	CCR3	64	38
C[C@H](c1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1)C(F)(F)F	ZINC000450631254	FJ	On-Demand	Anodyne	CCR3	64	38
C[C@@H](c1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1)C(F)(F)F	ZINC000450631255	FJ	On-Demand	Anodyne	CCR3	64	38
C[C@H](c1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1)C(F)(F)F	ZINC000450631256	FJ	On-Demand	Anodyne	CCR3	64	38
Cc1ccc(NC(=O)c2ccc(NC[C@]3(O)CCS(=O)(=O)C3)nc2)cc1	ZINC000450631257	GD	On-Demand	Anodyne	PRNP	43	32
Cc1ccc(NC(=O)c2ccc(NC[C@]3(O)CCS(=O)(=O)C3)nc2)cc1	ZINC000450631257	GD	On-Demand	Anodyne	P4HTM	0	47
Cc1ccc(NC(=O)c2ccc(NC[C@@]3(O)CCS(=O)(=O)C3)nc2)cc1	ZINC000450631258	GD	On-Demand	Anodyne	PRNP	43	32
Cc1ccc(NC(=O)c2ccc(NC[C@@]3(O)CCS(=O)(=O)C3)nc2)cc1	ZINC000450631258	GD	On-Demand	Anodyne	P4HTM	0	47
O=C(c1ccc(I)cc1F)N1CC(CCO)C1	ZINC000450631267	ED	On-Demand	Anodyne	MAP2K1	53	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)c1	ZINC000450631272	FF	On-Demand	Bother	CCR2	0	43
COc1ccc(-c2ccnc(NC[C@@]3(O)CCS(=O)(=O)C3)n2)cc1	ZINC000450631276	ED	On-Demand	Anodyne	SMG1	54	29
COc1ccc(-c2ccnc(NC[C@]3(O)CCS(=O)(=O)C3)n2)cc1	ZINC000450631277	ED	On-Demand	Anodyne	SMG1	54	29
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	MME	51	39
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	ANPEP	44	39
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	CTSK	32	42
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	CTSL	17	42
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	CAPNS1	58	36
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	CAPN1	70	39
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	MMP9	15	41
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	CAPN2	111	38
CCC[C@@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631287	EI	On-Demand	Anodyne	NPR	66	37
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	MME	51	39
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	ANPEP	44	39
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	CTSK	32	42
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	CTSL	17	42
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	CAPNS1	58	36
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	CAPN1	70	39
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	MMP9	15	41
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	CAPN2	111	38
CCC[C@H](CC(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450631288	EI	On-Demand	Anodyne	NPR	66	37
CCOC(=O)C1([S@](C)=O)CCN(c2nc(C)nc3[nH]ccc23)CC1	ZINC000450631313	FD	On-Demand	Anodyne	AKT2	43	39
CCOC(=O)C1([S@@](C)=O)CCN(c2nc(C)nc3[nH]ccc23)CC1	ZINC000450631320	FD	On-Demand	Anodyne	AKT2	43	39
CCN(CC)S(=O)(=O)c1ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000450631329	FE	On-Demand	Bother	BDKRB1	25	48
CCN(CC)S(=O)(=O)c1ccc(NCCC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000450631329	FE	On-Demand	Bother	COLA	44	32
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450631351	GD	On-Demand	Anodyne	CDK2	15	48
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450631351	GD	On-Demand	Anodyne	CDK1	27	50
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450631351	GD	On-Demand	Anodyne	CDK4	27	50
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450631351	GD	On-Demand	Anodyne	CALCA	0	44
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450631351	GD	On-Demand	Anodyne	NCE103	15	41
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450631351	GD	On-Demand	Anodyne	CAN2	0	41
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cc(C#N)[nH]c1C	ZINC000450631358	DF	On-Demand	Mild	CCKAR	42	35
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cc(C#N)[nH]c1C	ZINC000450631359	DF	On-Demand	Mild	CCKAR	42	35
CC(C)(CO)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450631364	CH	On-Demand	Anodyne	HRP1_PLAFA	99	35
CC(C)(CO)CCNc1ccnc2cc(F)c(Cl)cc12	ZINC000450631364	CH	On-Demand	Anodyne	HNMT	53	38
CN1CCN(CCCN(C)Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450631368	FE	On-Demand	Anodyne	SIGMAR1	59	51
CCS(=O)(=O)c1ccc(CN2CCC(O)(C(F)(F)F)CC2)cc1	ZINC000450631387	FE	On-Demand	Anodyne	MMP13	17	42
CCS(=O)(=O)c1ccc(CN2CCC(O)(C(F)(F)F)CC2)cc1	ZINC000450631387	FE	On-Demand	Anodyne	ADAM17	23	42
O=C([C@H](O)C1CCC1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631395	CD	On-Demand	Bother	CCR2	16	46
O=C([C@@H](O)C1CCC1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631397	CD	On-Demand	Bother	CCR2	16	46
COc1cc(N2CCN(C(=O)C[C@H]3COc4ccccc4O3)CC2)ncn1	ZINC000450631399	FD	On-Demand	Anodyne	ADRA1B	19	41
COc1cc(N2CCN(C(=O)C[C@H]3COc4ccccc4O3)CC2)ncn1	ZINC000450631399	FD	On-Demand	Anodyne	ADRA2B	20	44
COc1cc(N2CCN(C(=O)C[C@@H]3COc4ccccc4O3)CC2)ncn1	ZINC000450631402	FD	On-Demand	Anodyne	ADRA1B	19	41
COc1cc(N2CCN(C(=O)C[C@@H]3COc4ccccc4O3)CC2)ncn1	ZINC000450631402	FD	On-Demand	Anodyne	ADRA2B	20	44
CCOc1cc(C(=O)N2CCN(c3ccccc3)C[C@@H]2CC)on1	ZINC000450631412	EF	On-Demand	Anodyne	CCKAR	67	40
CCOc1cc(C(=O)N2CCN(c3ccccc3)C[C@H]2CC)on1	ZINC000450631414	EF	On-Demand	Anodyne	CCKAR	67	40
CC(C)(CO)CCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450631416	DF	On-Demand	Anodyne	DHOD	0	41
O=S1(=O)CC[C@](O)(CNc2ncccc2OCc2ccccc2)C1	ZINC000450631427	ED	On-Demand	Anodyne	PPIA	56	46
Cc1ccn2ncc(C(=O)N[C@@H](CCO)C3CCOCC3)c2c1	ZINC000450631428	DD	On-Demand	Anodyne	EPHB3	33	45
O=S1(=O)CC[C@@](O)(CNc2ncccc2OCc2ccccc2)C1	ZINC000450631429	ED	On-Demand	Anodyne	PPIA	56	46
Cc1ccn2ncc(C(=O)N[C@H](CCO)C3CCOCC3)c2c1	ZINC000450631430	DD	On-Demand	Anodyne	EPHB3	33	45
CC(=O)[C@@](C)(O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450631434	DD	On-Demand	Anodyne	DRD4	15	54
CC(=O)[C@](C)(O)CN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450631435	DD	On-Demand	Anodyne	DRD4	15	54
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc2cnccc2c1	ZINC000450631439	EH	On-Demand	Anodyne	CCKAR	58	38
CCc1cccc(C(=O)N2CCN(c3cc(OC)ncn3)CC2)n1	ZINC000450631441	ED	On-Demand	Anodyne	CCKAR	25	46
CCc1cccc(C(=O)N2CCN(c3cc(OC)ncn3)CC2)n1	ZINC000450631441	ED	On-Demand	Anodyne	ALS	52	33
CCc1cccc(C(=O)N2CCN(c3cc(OC)ncn3)CC2)n1	ZINC000450631441	ED	On-Demand	Anodyne	SLC6A7	0	42
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631443	GH	On-Demand	Bother	RBP4	81	38
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc2cnccc2c1	ZINC000450631444	EH	On-Demand	Anodyne	CCKAR	58	38
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450631445	FE	On-Demand	Anodyne	CCKAR	67	40
O=C(c1cc2c(Br)cccc2cn1)N1CC(CCO)C1	ZINC000450631448	EE	On-Demand	Anodyne	AKR1C3	15	49
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450631450	FE	On-Demand	Anodyne	CCKAR	67	40
CCCN(CCN(CC)CC)C(=O)c1ccnc(OC(F)F)c1	ZINC000450631462	EF	On-Demand	Anodyne	PLM2_PLAFA	23	40
COc1cc(N2CCN(C(=O)c3ccccc3-n3ccc(C)n3)CC2)ncn1	ZINC000450631473	GD	On-Demand	Anodyne	TACR3	22	41
CCOC(=O)C1([S@@](C)=O)CCN(c2cc(C)nc3c(OC)cccc23)CC1	ZINC000450631480	GF	On-Demand	Anodyne	BDKRB2	44	34
CCOC(=O)C1([S@](C)=O)CCN(c2cc(C)nc3c(OC)cccc23)CC1	ZINC000450631484	GF	On-Demand	Anodyne	BDKRB2	44	34
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631500	GH	On-Demand	Bother	PRCP	47	34
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631501	GH	On-Demand	Bother	PRCP	47	34
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631502	GH	On-Demand	Bother	PRCP	47	34
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631503	GH	On-Demand	Bother	PRCP	47	34
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@@]1(O)CCS(=O)(=O)C1	ZINC000450631525	FD	On-Demand	Mild	MAP3K8	52	37
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@]1(O)CCS(=O)(=O)C1	ZINC000450631530	FD	On-Demand	Mild	MAP3K8	52	37
Cc1ccc(F)c(CN(CC(F)(F)F)C2CC2)c1	ZINC000450631538	CH	On-Demand	Anodyne	SLC6A2	17	40
COc1cc(CN(C)[C@H](C)c2cccnc2)ccc1Cl	ZINC000450631543	CH	On-Demand	Anodyne	KCNA5	40	40
COc1cc(CN(C)[C@H](C)c2cccnc2)ccc1Cl	ZINC000450631543	CH	On-Demand	Anodyne	CYP51A1	15	40
COc1cc(CN(C)[C@@H](C)c2cccnc2)ccc1Cl	ZINC000450631544	CH	On-Demand	Anodyne	KCNA5	40	40
COc1cc(CN(C)[C@@H](C)c2cccnc2)ccc1Cl	ZINC000450631544	CH	On-Demand	Anodyne	CYP51A1	15	40
C/C=C\COc1cccc(CC(=O)Nc2cnn(CC(=O)NCCO)c2)c1	ZINC000450631545	FD	On-Demand	Anodyne	HRH2	41	34
CN1CCN(c2nc3ccccc3nc2NCCC(C)(C)CO)CC1	ZINC000450631550	EE	On-Demand	Anodyne	HRH4	34	52
CCc1cc(CCCN2CCN(Cc3nc4ccccc4[nH]3)CC2)on1	ZINC000450631559	FF	On-Demand	Anodyne	DRD4	21	48
CC(C)(CO)CCNc1ncnc2ccc(I)cc12	ZINC000450631561	FE	On-Demand	Anodyne	CLK4	61	37
CC(C)(CO)CCNc1ncnc2ccc(I)cc12	ZINC000450631561	FE	On-Demand	Anodyne	CD38	90	38
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450631562	FD	On-Demand	Anodyne	KIT	0	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450631562	FD	On-Demand	Anodyne	ATF1	57	36
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450631562	FD	On-Demand	Anodyne	MTTP	53	34
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450631562	FD	On-Demand	Anodyne	NFKB1	52	36
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000450631562	FD	On-Demand	Anodyne	PANC	41	33
COC(=O)c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1Cl	ZINC000450631566	ED	On-Demand	Anodyne	DRD4	39	42
COC(=O)c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1Cl	ZINC000450631566	ED	On-Demand	Anodyne	DRD3	0	42
COC(=O)c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1Cl	ZINC000450631566	ED	On-Demand	Anodyne	OPRK1	30	40
COC(=O)c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1Cl	ZINC000450631566	ED	On-Demand	Anodyne	HTR4	69	34
COC(=O)c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1Cl	ZINC000450631566	ED	On-Demand	Anodyne	SIGMAR1	31	43
COC(=O)c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1Cl	ZINC000450631566	ED	On-Demand	Anodyne	SSTR5	53	39
COC(=O)c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1Cl	ZINC000450631566	ED	On-Demand	Anodyne	CCR3	38	42
COC(=O)c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1Cl	ZINC000450631566	ED	On-Demand	Anodyne	MCHR1	40	46
N#Cc1ccc(OC2CN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000450631575	GF	On-Demand	Mild	PYGL	0	44
CC[C@H]1CN(c2ccccc2)CCN1C(=O)Cc1cn(C)nc1C	ZINC000450631578	EE	On-Demand	Anodyne	CCKAR	43	33
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)Cc1cn(C)nc1C	ZINC000450631581	EE	On-Demand	Anodyne	CCKAR	43	33
COc1ccc(CNC(=O)CCN2C[C@@H](C)[C@@H](N(C)C)C2)c(OC)c1	ZINC000450631583	ED	On-Demand	Anodyne	MTNR1A	42	34
COc1ccc(CNC(=O)CCN2C[C@@H](N(C)C)[C@H](C)C2)c(OC)c1	ZINC000450631584	ED	On-Demand	Anodyne	MTNR1A	42	34
COc1ccc(CNC(=O)CCN2C[C@H](C)[C@H](N(C)C)C2)c(OC)c1	ZINC000450631585	ED	On-Demand	Anodyne	MTNR1A	42	34
COc1ccc(CNC(=O)CCN2C[C@H](C)[C@@H](N(C)C)C2)c(OC)c1	ZINC000450631586	ED	On-Demand	Anodyne	MTNR1A	42	34
COc1cc(N2CCN(C(=O)[C@H](C)OCc3ccc(F)cc3)CC2)ncn1	ZINC000450631587	FD	On-Demand	Anodyne	AKT1	37	41
COc1cc(N2CCN(C(=O)[C@H](C)OCc3ccc(F)cc3)CC2)ncn1	ZINC000450631587	FD	On-Demand	Anodyne	AKT1S1	0	41
COc1cc(N2CCN(C(=O)[C@@H](C)OCc3ccc(F)cc3)CC2)ncn1	ZINC000450631588	FD	On-Demand	Anodyne	AKT1	37	41
COc1cc(N2CCN(C(=O)[C@@H](C)OCc3ccc(F)cc3)CC2)ncn1	ZINC000450631588	FD	On-Demand	Anodyne	AKT1S1	0	41
COCCO[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450631594	CG	On-Demand	Anodyne	SLC6A1	114	38
COCCO[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450631595	CG	On-Demand	Anodyne	SLC6A1	114	38
COCCO[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450631596	CG	On-Demand	Anodyne	SLC6A1	114	38
COCCO[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450631597	CG	On-Demand	Anodyne	SLC6A1	114	38
CCC(CC)(CNC(=O)c1cnc(C2CC2)nc1)c1ccc(OC)c(OC)c1	ZINC000450631599	GH	On-Demand	Anodyne	MT-ND1	19	40
C[C@@H](CCCO)CNc1cc(N2CCC[C@H](C)C2)ncn1	ZINC000450631613	CF	On-Demand	Anodyne	PRCP	0	48
C[C@H]1CCCN(c2cc(NC[C@H](C)CCCO)ncn2)C1	ZINC000450631614	CF	On-Demand	Anodyne	PRCP	0	48
C[C@@H](CCCO)CNc1cc(N2CCC[C@@H](C)C2)ncn1	ZINC000450631615	CF	On-Demand	Anodyne	PRCP	0	48
C[C@H](CCCO)CNc1cc(N2CCC[C@@H](C)C2)ncn1	ZINC000450631616	CF	On-Demand	Anodyne	PRCP	0	48
CC(C)(CO)CCNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450631622	GI	On-Demand	Anodyne	NPBWR1	44	38
C[C@H](O)CCCN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450631647	DD	On-Demand	Anodyne	DRD4	18	57
C[C@H](O)CCCN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450631647	DD	On-Demand	Anodyne	HTR7	19	43
C[C@@H](O)CCCN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450631649	DD	On-Demand	Anodyne	DRD4	18	57
C[C@@H](O)CCCN1CCN(Cc2nc3ccccc3[nH]2)CC1	ZINC000450631649	DD	On-Demand	Anodyne	HTR7	19	43
CS(=O)(=O)c1cccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)c1	ZINC000450631654	GE	On-Demand	Anodyne	DRD4	31	55
CS(=O)(=O)c1cccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)c1	ZINC000450631654	GE	On-Demand	Anodyne	GRIN2B	20	51
CS(=O)(=O)c1cccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)c1	ZINC000450631654	GE	On-Demand	Anodyne	ALKBH3	48	35
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2ccncc2)c(OC)c1	ZINC000450631655	FF	On-Demand	Anodyne	CYP26A1	40	33
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2ccncc2)c(OC)c1	ZINC000450631656	FF	On-Demand	Anodyne	CYP26A1	40	33
COc1cc(N2CCN(C(=O)c3cc(-c4ccccc4)nn3C)CC2)ncn1	ZINC000450631676	GD	On-Demand	Anodyne	CCKAR	35	41
COc1cc(N2CCN(C(=O)c3cc(-c4ccccc4)nn3C)CC2)ncn1	ZINC000450631676	GD	On-Demand	Anodyne	TACR3	25	61
COc1cc(N2CCN(C(=O)c3cc(-c4ccccc4)nn3C)CC2)ncn1	ZINC000450631676	GD	On-Demand	Anodyne	SLC6A7	0	42
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450631690	EE	On-Demand	Anodyne	NPBWR1	43	32
CCC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450631691	EE	On-Demand	Anodyne	NPBWR1	43	32
CCC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450631692	EE	On-Demand	Anodyne	NPBWR1	43	32
CCC[C@H]1CCC[C@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450631693	EE	On-Demand	Anodyne	NPBWR1	43	32
COc1cc(N2CCN(C(=O)c3cccc(C(F)(F)F)n3)CC2)ncn1	ZINC000450631694	FD	On-Demand	Anodyne	SLC6A7	0	42
O=C(Cn1cc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cn1)NCCO	ZINC000450631709	FC	On-Demand	Anodyne	KIT	24	42
O=C(Cn1cc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cn1)NCCO	ZINC000450631709	FC	On-Demand	Anodyne	BRAF	30	42
COC(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1Cl	ZINC000450631715	GG	On-Demand	Anodyne	DRD2	25	45
COC(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1Cl	ZINC000450631715	GG	On-Demand	Anodyne	DRD4	59	54
COC(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1Cl	ZINC000450631715	GG	On-Demand	Anodyne	SIGMAR1	21	42
COC(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1Cl	ZINC000450631715	GG	On-Demand	Anodyne	SSTR5	50	37
COC(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1Cl	ZINC000450631715	GG	On-Demand	Anodyne	FAAH	20	40
COC(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1Cl	ZINC000450631715	GG	On-Demand	Anodyne	CACNA1G	26	41
COC(=O)c1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1Cl	ZINC000450631715	GG	On-Demand	Anodyne	ALKBH3	40	34
CC[C@H]1CN(c2ccccc2)CCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450631730	EG	On-Demand	Anodyne	OPRK1	27	45
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450631731	EG	On-Demand	Anodyne	OPRK1	27	45
O=C(Cc1cc2ccccc2s1)N1CC(CCO)C1	ZINC000450631736	CE	On-Demand	Anodyne	AROQ	22	40
COc1cc(N2CCN(C(=O)[C@@H]3C[C@H]3CC(C)C)CC2)ncn1	ZINC000450631739	DD	On-Demand	Anodyne	NPBWR1	45	35
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)CSC1CC1	ZINC000450631750	EG	On-Demand	Anodyne	MTR1B_CHICK	0	41
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)CSC1CC1	ZINC000450631751	EG	On-Demand	Anodyne	MTR1B_CHICK	0	41
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)CSC1CC1	ZINC000450631752	EG	On-Demand	Anodyne	MTR1B_CHICK	0	41
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)CSC1CC1	ZINC000450631753	EG	On-Demand	Anodyne	MTR1B_CHICK	0	41
CC[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450631754	DD	On-Demand	Anodyne	CDK4	22	40
O=S1(=O)CC[C@@](O)(CNc2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450631781	FD	On-Demand	Anodyne	CSNK1D	31	40
O=S1(=O)CC[C@](O)(CNc2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450631782	FD	On-Demand	Anodyne	CSNK1D	31	40
COC(=O)c1ccc(CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)cc1	ZINC000450631784	FD	On-Demand	Bother	CCR2	0	43
Cc1ccc(F)c(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	ZINC000450631798	GF	On-Demand	Anodyne	P2RX7	24	40
Cc1ccc(F)c(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	ZINC000450631798	GF	On-Demand	Anodyne	CDK2	15	52
Cc1ccc(F)c(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	ZINC000450631798	GF	On-Demand	Anodyne	CDK1	27	52
Cc1ccc(F)c(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	ZINC000450631798	GF	On-Demand	Anodyne	CDK4	27	52
Cc1ccc(F)c(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	ZINC000450631798	GF	On-Demand	Anodyne	CALCA	0	41
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CCO)C1	ZINC000450631806	EF	On-Demand	Anodyne	PDE6D	70	40
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CCO)C1	ZINC000450631806	EF	On-Demand	Anodyne	HDAC8	25	40
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CCO)C1	ZINC000450631806	EF	On-Demand	Anodyne	HDAC6	19	40
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CC(CCO)C1	ZINC000450631806	EF	On-Demand	Anodyne	IMDH_CRYPV	31	49
Cc1cc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)nn1C(C)C	ZINC000450631811	GE	On-Demand	Anodyne	CDK1	20	42
Cc1cc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)nn1C(C)C	ZINC000450631811	GE	On-Demand	Anodyne	CDK4	22	42
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	DRD4	38	41
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	ACHE	30	42
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	HRH1	0	46
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	DRD3	26	41
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	AVPR1B	44	36
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	HTR4	55	37
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	CHAT	25	41
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	SIGMAR1	37	41
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	CCR3	35	47
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	UTS2R	25	45
COc1cc(CN2CCC(CS(N)(=O)=O)CC2)ccc1Cl	ZINC000450631834	ED	On-Demand	Anodyne	MCHR1	25	43
CC(C)(C(=O)N1CC(CCO)C1)c1cccc2ccccc12	ZINC000450631836	CF	On-Demand	Anodyne	AKR1C3	18	45
COc1ccc(CC(=O)N2CCc3c(F)cccc32)c(Cl)c1OC	ZINC000450631849	EH	On-Demand	Anodyne	EIF2AK3	51	37
CC[C@@]1(C)COCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450631852	FE	On-Demand	Anodyne	MTNR1A	52	38
CC[C@@]1(C)COCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450631852	FE	On-Demand	Anodyne	MTNR1B	45	38
CC[C@]1(C)COCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450631853	FE	On-Demand	Anodyne	MTNR1A	52	38
CC[C@]1(C)COCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450631853	FE	On-Demand	Anodyne	MTNR1B	45	38
COc1cc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)ncn1	ZINC000450631856	GF	On-Demand	Anodyne	SLC6A9	32	42
COc1cc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)ncn1	ZINC000450631856	GF	On-Demand	Anodyne	LIPG	51	36
COc1cc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)ncn1	ZINC000450631856	GF	On-Demand	Anodyne	SLC6A7	0	44
N#Cc1ccc(OC2CN(C(=O)c3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1	ZINC000450631861	GF	On-Demand	Mild	SLC6A9	17	42
COc1cc(N2CCN(C(=O)[C@@H](C)Oc3ccccn3)CC2)ncn1	ZINC000450631872	EC	On-Demand	Anodyne	PDGFRB	40	37
COc1cc(N2CCN(C(=O)[C@@H](C)Oc3ccccn3)CC2)ncn1	ZINC000450631872	EC	On-Demand	Anodyne	SLC6A7	0	40
COc1cc(N2CCN(C(=O)[C@H](C)Oc3ccccn3)CC2)ncn1	ZINC000450631873	EC	On-Demand	Anodyne	PDGFRB	40	37
COc1cc(N2CCN(C(=O)[C@H](C)Oc3ccccn3)CC2)ncn1	ZINC000450631873	EC	On-Demand	Anodyne	SLC6A7	0	40
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450631874	GH	On-Demand	Anodyne	P2RY12	87	35
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450631874	GH	On-Demand	Anodyne	BIRC2	43	31
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450631875	GH	On-Demand	Anodyne	P2RY12	87	35
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450631875	GH	On-Demand	Anodyne	BIRC2	43	31
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450631876	GH	On-Demand	Anodyne	P2RY12	87	35
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450631876	GH	On-Demand	Anodyne	BIRC2	43	31
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450631877	GH	On-Demand	Anodyne	P2RY12	87	35
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450631877	GH	On-Demand	Anodyne	BIRC2	43	31
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631883	FH	On-Demand	Bother	SLC6A9	24	40
CSc1cccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	ZINC000450631884	GF	On-Demand	Anodyne	CDK1	21	47
CSc1cccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	ZINC000450631884	GF	On-Demand	Anodyne	CDK4	23	47
CSc1cccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c1	ZINC000450631884	GF	On-Demand	Anodyne	CALCA	0	41
COC(=O)c1ccc(CN2CCN(c3cncc(F)c3)CC2)cc1Cl	ZINC000450631885	FF	On-Demand	Anodyne	DRD1	0	40
COC(=O)c1ccc(CN2CCN(c3cncc(F)c3)CC2)cc1Cl	ZINC000450631885	FF	On-Demand	Anodyne	SSTR5	41	38
CC(=O)[C@](C)(O)CN1CCC[C@@H](Cc2nccn2C)C1	ZINC000450631886	CD	On-Demand	Anodyne	CCR3	47	34
CC(=O)[C@@](C)(O)CN1CCC[C@H](Cc2nccn2C)C1	ZINC000450631887	CD	On-Demand	Anodyne	CCR3	47	34
CC(=O)[C@](C)(O)CN1CCC[C@H](Cc2nccn2C)C1	ZINC000450631888	CD	On-Demand	Anodyne	CCR3	47	34
CC(=O)[C@@](C)(O)CN1CCC[C@@H](Cc2nccn2C)C1	ZINC000450631889	CD	On-Demand	Anodyne	CCR3	47	34
NC(=O)c1cccc(CN(c2ncnc3sc4c(c23)CCC4)C2CC2)c1	ZINC000450631893	FG	On-Demand	Anodyne	RBP4	17	42
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)[C@H]1CCCN(C)C1=O	ZINC000450631894	FE	On-Demand	Anodyne	TRHR	49	35
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)[C@@H]1CCCN(C)C1=O	ZINC000450631895	FE	On-Demand	Anodyne	TRHR	49	35
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)[C@H]1CCCN(C)C1=O	ZINC000450631896	FE	On-Demand	Anodyne	TRHR	49	35
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)[C@@H]1CCCN(C)C1=O	ZINC000450631897	FE	On-Demand	Anodyne	TRHR	49	35
O=S1(=O)CC[C@](O)(CNc2nc(-c3ccccc3C(F)(F)F)cs2)C1	ZINC000450631907	GE	On-Demand	Anodyne	MPL	40	36
O=S1(=O)CC[C@@](O)(CNc2nc(-c3ccccc3C(F)(F)F)cs2)C1	ZINC000450631908	GE	On-Demand	Anodyne	MPL	40	36
CC(C)(C)CCC1(O)CC(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)C1	ZINC000450631909	FF	On-Demand	Bother	CCR2	0	41
COc1cccc2c(NC[C@H](C)CCCO)c(C)cnc12	ZINC000450631910	CG	On-Demand	Anodyne	ATP4A	18	42
COc1cccc2c(NC[C@@H](C)CCCO)c(C)cnc12	ZINC000450631911	CG	On-Demand	Anodyne	ATP4A	18	42
O=C(c1ccc2c(c1)OC(F)(F)O2)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631931	FF	On-Demand	Bother	CCR2	0	40
CCCc1cc(N2CCC(C(=O)OCC)([S@@](C)=O)CC2)c2ccccc2n1	ZINC000450631937	GG	On-Demand	Anodyne	METAP1	36	44
CCCc1cc(N2CCC(C(=O)OCC)([S@](C)=O)CC2)c2ccccc2n1	ZINC000450631938	GG	On-Demand	Anodyne	METAP1	36	44
Cn1ccnc1C[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450631939	DH	On-Demand	Anodyne	SLC6A1	57	36
Cn1ccnc1C[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450631940	DH	On-Demand	Anodyne	SLC6A1	57	36
Cn1ccnc1C[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450631941	DH	On-Demand	Anodyne	SLC6A1	57	36
Cn1ccnc1C[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450631942	DH	On-Demand	Anodyne	SLC6A1	57	36
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631948	EF	On-Demand	Bother	CCR2	23	47
CCSc1cccnc1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450631949	FD	On-Demand	Anodyne	SLC6A7	0	40
COc1cc(N2CCN(C(=O)[C@H](Cc3ccccc3)OC)CC2)ncn1	ZINC000450631950	FD	On-Demand	Anodyne	AKT3	22	45
COc1cc(N2CCN(C(=O)[C@H](Cc3ccccc3)OC)CC2)ncn1	ZINC000450631950	FD	On-Demand	Anodyne	AKT1	40	45
COc1cc(N2CCN(C(=O)[C@@H](Cc3ccccc3)OC)CC2)ncn1	ZINC000450631951	FD	On-Demand	Anodyne	AKT3	22	45
COc1cc(N2CCN(C(=O)[C@@H](Cc3ccccc3)OC)CC2)ncn1	ZINC000450631951	FD	On-Demand	Anodyne	AKT1	40	45
CCCN(CCN(CC)CC)C(=O)c1ccc2cnccc2c1	ZINC000450631955	DG	On-Demand	Anodyne	PLM2_PLAFA	64	40
COc1cc(N2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)ncn1	ZINC000450631962	FD	On-Demand	Anodyne	SLC6A7	0	41
CC[C@@H](c1ccncc1)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450631969	FG	On-Demand	Anodyne	MTNR1A	40	38
CC[C@H](c1ccncc1)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450631970	FG	On-Demand	Anodyne	MTNR1A	40	38
C[C@@H]1CCO[C@@H]1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450631981	CD	On-Demand	Bother	CCR2	24	47
COc1cc(N2CCN(C(=O)c3coc(-c4ccnc(C)c4)n3)CC2)ncn1	ZINC000450631995	GD	On-Demand	Anodyne	CCKAR	33	40
CN(C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)c1nc2ccccc2n1C	ZINC000450632005	GF	On-Demand	Anodyne	PIK3CD	41	39
CN(C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)c1nc2ccccc2n1C	ZINC000450632005	GF	On-Demand	Anodyne	PIK3CB	56	43
CN(C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)c1nc2ccccc2n1C	ZINC000450632005	GF	On-Demand	Anodyne	DGAT1	30	40
Fc1cncc(N2CCN(Cc3cc[nH]n3)CC2)c1	ZINC000450632011	CD	On-Demand	Anodyne	DRD1	19	45
Fc1cncc(N2CCN(Cc3cc[nH]n3)CC2)c1	ZINC000450632011	CD	On-Demand	Anodyne	DRD4	28	46
O=S1(=O)CC[C@](O)(CNc2ccnc3cc(F)ccc23)C1	ZINC000450632016	DD	On-Demand	Anodyne	HNMT	40	31
O=S1(=O)CC[C@@](O)(CNc2ccnc3cc(F)ccc23)C1	ZINC000450632017	DD	On-Demand	Anodyne	HNMT	40	31
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(CCO)C2)cc1	ZINC000450632018	FD	On-Demand	Anodyne	F2	26	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(CCO)C2)cc1	ZINC000450632018	FD	On-Demand	Anodyne	TRY2_BOVIN	44	31
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(CCO)C2)cc1	ZINC000450632018	FD	On-Demand	Anodyne	MMP2	22	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(CCO)C2)cc1	ZINC000450632018	FD	On-Demand	Anodyne	ST14	58	33
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(CCO)C2)cc1	ZINC000450632018	FD	On-Demand	Anodyne	LEF	41	36
CC(F)(F)c1ccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cn1	ZINC000450632030	GF	On-Demand	Anodyne	CALCA	0	43
CC(F)(F)c1ccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)cn1	ZINC000450632030	GF	On-Demand	Anodyne	NAMPT	52	39
COC(=O)c1ccc(CC(=O)N2CC(Oc3ccc(C#N)cc3)C2)cc1	ZINC000450632041	FE	On-Demand	Mild	MLNR	22	54
COc1cc(CN2CCC[C@@H](Cc3nccn3C)C2)ccc1Cl	ZINC000450632042	EH	On-Demand	Anodyne	DRD4	20	42
COc1cc(CN2CCC[C@@H](Cc3nccn3C)C2)ccc1Cl	ZINC000450632042	EH	On-Demand	Anodyne	SSTR5	48	40
COc1cc(CN2CCC[C@@H](Cc3nccn3C)C2)ccc1Cl	ZINC000450632042	EH	On-Demand	Anodyne	CCR3	26	40
COc1cc(CN2CCC[C@H](Cc3nccn3C)C2)ccc1Cl	ZINC000450632043	EH	On-Demand	Anodyne	DRD4	20	42
COc1cc(CN2CCC[C@H](Cc3nccn3C)C2)ccc1Cl	ZINC000450632043	EH	On-Demand	Anodyne	SSTR5	48	40
COc1cc(CN2CCC[C@H](Cc3nccn3C)C2)ccc1Cl	ZINC000450632043	EH	On-Demand	Anodyne	CCR3	26	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC(Oc2ccc(C#N)cc2)C1	ZINC000450632050	EE	On-Demand	Mild	CTRB_BOVIN	51	35
CO[C@H](Cc1ccccc1)C(=O)N1CC(Oc2ccc(C#N)cc2)C1	ZINC000450632051	EE	On-Demand	Mild	CTRB_BOVIN	51	35
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CC(CCO)C1	ZINC000450632052	CE	On-Demand	Anodyne	CCR5	15	43
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CC(CCO)C1	ZINC000450632053	CE	On-Demand	Anodyne	CCR5	15	43
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CC(CCO)C1	ZINC000450632054	CE	On-Demand	Anodyne	CCR5	15	43
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CC(CCO)C1	ZINC000450632055	CE	On-Demand	Anodyne	CCR5	15	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	ANPEP	44	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	FCER2	41	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	CTSB	43	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	CTSK	54	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	CTSL	40	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	CAPNS1	60	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	CTSS	43	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	CAPN1	83	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	MMP9	15	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	CAPN2	110	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	FPR1	67	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	NPR	71	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000450632060	GG	On-Demand	Anodyne	PSMB5	47	34
NS(=O)(=O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450632061	CD	On-Demand	Anodyne	SIGMAR1	16	43
NS(=O)(=O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450632062	CD	On-Demand	Anodyne	SIGMAR1	16	43
COc1cc(CN2CCN(c3cncc(F)c3)CC2)ccc1Cl	ZINC000450632085	EG	On-Demand	Anodyne	DRD1	33	52
COc1cc(CN2CCN(c3cncc(F)c3)CC2)ccc1Cl	ZINC000450632085	EG	On-Demand	Anodyne	DRD4	46	45
COc1cc(CN2CCN(c3cncc(F)c3)CC2)ccc1Cl	ZINC000450632085	EG	On-Demand	Anodyne	DRD3	29	45
COc1cc(CN2CCN(c3cncc(F)c3)CC2)ccc1Cl	ZINC000450632085	EG	On-Demand	Anodyne	SSTR5	43	38
COc1cc(CN2CCN(c3cncc(F)c3)CC2)ccc1Cl	ZINC000450632085	EG	On-Demand	Anodyne	CCR1	36	40
C/C=C\COc1cccc(CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)c1	ZINC000450632089	FG	On-Demand	Bother	BRS3	15	40
C/C=C/COc1cccc(CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)c1	ZINC000450632090	FG	On-Demand	Bother	BRS3	15	40
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450632096	FE	On-Demand	Anodyne	CDK1	21	40
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450632096	FE	On-Demand	Anodyne	CDK4	22	40
CC(C)c1ncsc1C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450632102	GF	On-Demand	Anodyne	CALCA	0	42
CC(C)c1ncsc1C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450632102	GF	On-Demand	Anodyne	VHL	48	31
Cc1cc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ncc1C(N)=O	ZINC000450632105	GC	On-Demand	Anodyne	CDK1	20	41
Cc1cc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ncc1C(N)=O	ZINC000450632105	GC	On-Demand	Anodyne	CDK4	22	41
Fc1cncc(N2CCN(Cc3ccccc3OC3CC3)CC2)c1	ZINC000450632110	EG	On-Demand	Anodyne	DRD4	39	44
Fc1cncc(N2CCN(Cc3ccccc3OC3CC3)CC2)c1	ZINC000450632110	EG	On-Demand	Anodyne	DRD3	24	41
CCCN(CCN(CC)CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450632116	FF	On-Demand	Anodyne	OPRD1	16	40
CCCN(CCN(CC)CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450632116	FF	On-Demand	Anodyne	PLM2_PLAFA	65	39
Cc1ccc(F)c(CN2CCN(c3cncc(F)c3)CC2)c1	ZINC000450632120	DF	On-Demand	Anodyne	DRD1	26	43
Cc1ccc(F)c(CN2CCN(c3cncc(F)c3)CC2)c1	ZINC000450632120	DF	On-Demand	Anodyne	DRD4	35	43
Cn1ccnc1C[C@H]1CCCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450632121	DH	On-Demand	Anodyne	CCR3	58	38
Cn1ccnc1C[C@@H]1CCCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450632122	DH	On-Demand	Anodyne	CCR3	58	38
Cn1ccnc1C[C@H]1CCCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450632123	DH	On-Demand	Anodyne	CCR3	58	38
Cn1ccnc1C[C@@H]1CCCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450632124	DH	On-Demand	Anodyne	CCR3	58	38
CN(CCN1CCC(CS(N)(=O)=O)CC1)Cc1ccccc1	ZINC000450632129	ED	On-Demand	Anodyne	DRD2	0	47
CN(CCN1CCC(CS(N)(=O)=O)CC1)Cc1ccccc1	ZINC000450632129	ED	On-Demand	Anodyne	ACHE	25	42
CN(CCN1CCC(CS(N)(=O)=O)CC1)Cc1ccccc1	ZINC000450632129	ED	On-Demand	Anodyne	GRIN2B	49	41
CN(CCN1CCC(CS(N)(=O)=O)CC1)Cc1ccccc1	ZINC000450632129	ED	On-Demand	Anodyne	SIGMAR1	64	48
CN(CCN1CCC(CS(N)(=O)=O)CC1)Cc1ccccc1	ZINC000450632129	ED	On-Demand	Anodyne	CCR3	35	40
CN(CCN1CCC(CS(N)(=O)=O)CC1)Cc1ccccc1	ZINC000450632129	ED	On-Demand	Anodyne	CCR5	46	42
CC(C)c1ccc(-n2c(SC[C@H](O)CC#N)nc3ccccc3c2=O)cc1	ZINC000450632132	GH	On-Demand	Mild	CCKBR	18	42
CC(C)c1ccc(-n2c(SC[C@H](O)CC#N)nc3ccccc3c2=O)cc1	ZINC000450632132	GH	On-Demand	Mild	CXCR3	22	41
C[C@@H](OCCc1ccccc1)C(=O)N1CC(CCO)C1	ZINC000450632150	CD	On-Demand	Anodyne	ACE	41	35
C[C@H](OCCc1ccccc1)C(=O)N1CC(CCO)C1	ZINC000450632151	CD	On-Demand	Anodyne	ACE	41	35
COc1cc(N2CCN(C(=O)Cn3ccc(C)n3)CC2)ncn1	ZINC000450632155	DC	On-Demand	Anodyne	CCR1	42	39
COc1cc(N2CCN(C(=O)c3ccc4c(c3)OC(F)(F)O4)CC2)ncn1	ZINC000450632161	GD	On-Demand	Anodyne	SLC6A7	0	41
O=C(N1CCc2ncc([N+](=O)[O-])cc2C1)C1(Cc2ccccc2)CCOCC1	ZINC000450632187	GF	On-Demand	Bother	CCR2	24	46
COC(=O)c1csc(CSc2nnc(Nc3ccc(C)c(C)c3)s2)n1	ZINC000450632192	GI	On-Demand	Anodyne	DHODH	20	42
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3c(C)cccc23)CC1	ZINC000450632205	FE	On-Demand	Anodyne	AKT2	40	36
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3c(C)cccc23)CC1	ZINC000450632205	FE	On-Demand	Anodyne	AKT1	41	35
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3c(C)cccc23)CC1	ZINC000450632206	FE	On-Demand	Anodyne	AKT2	40	36
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3c(C)cccc23)CC1	ZINC000450632206	FE	On-Demand	Anodyne	AKT1	41	35
COC(=O)c1cccc(CN2CCN(c3cncc(F)c3)CC2)c1Cl	ZINC000450632209	FF	On-Demand	Anodyne	DRD4	43	34
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)[C@H]1CC1(F)F	ZINC000450632219	ED	On-Demand	Anodyne	CDK4	22	41
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)[C@@H]1CC1(F)F	ZINC000450632220	ED	On-Demand	Anodyne	CDK4	22	41
NC(=O)c1cccc(CN(c2ncc(C(F)(F)F)cc2Cl)C2CC2)c1	ZINC000450632229	FI	On-Demand	Anodyne	TRPM8	56	56
O=C(c1cc(F)c(N2CCOCC2)c(F)c1)N1CCc2c(F)cccc21	ZINC000450632235	FG	On-Demand	Anodyne	PIK3CB	22	49
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450632248	CD	On-Demand	Anodyne	NPBWR1	49	33
CCC(=O)C1(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)CC1	ZINC000450632249	FD	On-Demand	Anodyne	CDK4	22	40
CCOC(=O)C1([S@@](C)=O)CCN(c2cc(CC)nc3ccccc23)CC1	ZINC000450632262	FG	On-Demand	Anodyne	METAP1	36	43
CCOC(=O)C1([S@@](C)=O)CCN(c2cc(CC)nc3ccccc23)CC1	ZINC000450632262	FG	On-Demand	Anodyne	ADAM17	18	40
CCOC(=O)C1([S@](C)=O)CCN(c2cc(CC)nc3ccccc23)CC1	ZINC000450632263	FG	On-Demand	Anodyne	METAP1	36	43
CCOC(=O)C1([S@](C)=O)CCN(c2cc(CC)nc3ccccc23)CC1	ZINC000450632263	FG	On-Demand	Anodyne	ADAM17	18	40
Cc1ccc(C(=O)N2CC(CCO)C2)c(C(C)C)n1	ZINC000450632264	CD	On-Demand	Anodyne	AKR1C3	16	43
COc1ccc(C(=O)N2CC(Oc3ccc(C#N)cc3)C2)cc1S(C)(=O)=O	ZINC000450632266	GD	On-Demand	Mild	HRH3	20	43
COc1cc(CN2CCC(S(N)(=O)=O)CC2)ccc1Cl	ZINC000450632272	DD	On-Demand	Anodyne	DRD4	48	42
COc1cc(CN2CCC(S(N)(=O)=O)CC2)ccc1Cl	ZINC000450632272	DD	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCC(S(N)(=O)=O)CC2)ccc1Cl	ZINC000450632272	DD	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC(S(N)(=O)=O)CC2)ccc1Cl	ZINC000450632272	DD	On-Demand	Anodyne	HTR4	58	36
COc1cc(CN2CCC(S(N)(=O)=O)CC2)ccc1Cl	ZINC000450632272	DD	On-Demand	Anodyne	UTS2R	27	44
COc1cc(CN2CCC(S(N)(=O)=O)CC2)ccc1Cl	ZINC000450632272	DD	On-Demand	Anodyne	MCHR1	25	44
CCOCc1nc(C)c(C(=O)NCc2ncc(-c3ccccc3)cn2)s1	ZINC000450632274	FG	On-Demand	Anodyne	SCD1	42	40
CCOCc1nc(C)c(C(=O)NCc2ncc(-c3ccccc3)cn2)s1	ZINC000450632274	FG	On-Demand	Anodyne	SCD	35	40
CCS(=O)(=O)c1ccc(CN2CCN(c3cncc(F)c3)CC2)cc1	ZINC000450632282	FE	On-Demand	Anodyne	DRD4	31	45
CCS(=O)(=O)c1ccc(CN2CCN(c3cncc(F)c3)CC2)cc1	ZINC000450632282	FE	On-Demand	Anodyne	ADORA2B	44	36
Cc1cnc(CCCC(=O)NCc2ncc(-c3ccccc3)cn2)o1	ZINC000450632289	EG	On-Demand	Anodyne	SUCNR1	38	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(CCO)C1	ZINC000450632319	CE	On-Demand	Anodyne	LIPG	51	39
CC(F)(F)C(C)(C)C(=O)N1CC(Oc2ccc(C#N)cc2)C1	ZINC000450632328	DF	On-Demand	Mild	EPHX2	17	40
COc1cc(N2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)CC2)ncn1	ZINC000450632333	GD	On-Demand	Anodyne	NPY2R	24	42
COc1cc(N2CCN(C(=O)c3ccc(NC(=O)C(C)(C)C)nc3)CC2)ncn1	ZINC000450632333	GD	On-Demand	Anodyne	BDKRB1	18	42
Cc1nc(C2CC2)ccc1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632339	EF	On-Demand	Bother	CCR2	0	43
Cc1cc(C)c(C(=O)N2CC(CCO)C2)cc1Br	ZINC000450632341	DF	On-Demand	Anodyne	AKR1C3	0	42
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632373	GH	On-Demand	Bother	CCR2	24	41
Cc1[nH]c(C#N)cc1C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450632376	FD	On-Demand	Mild	CDK4	22	41
NS(=O)(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450632377	DD	On-Demand	Anodyne	SIGMAR1	34	49
CC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450632378	DD	On-Demand	Anodyne	NPBWR1	43	32
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450632379	DD	On-Demand	Anodyne	NPBWR1	43	32
CC[C@H]1CCC[C@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450632380	DD	On-Demand	Anodyne	NPBWR1	43	32
CC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2cc(OC)ncn2)CC1	ZINC000450632381	DD	On-Demand	Anodyne	NPBWR1	43	32
CN1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1=O	ZINC000450632387	DC	On-Demand	Anodyne	PTGER3	27	44
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450632415	GG	On-Demand	Anodyne	TRPV1	33	43
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450632415	GG	On-Demand	Anodyne	MTR1B_CHICK	0	42
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450632416	GG	On-Demand	Anodyne	TRPV1	33	43
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450632416	GG	On-Demand	Anodyne	MTR1B_CHICK	0	42
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450632417	GG	On-Demand	Anodyne	TRPV1	33	43
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450632417	GG	On-Demand	Anodyne	MTR1B_CHICK	0	42
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450632418	GG	On-Demand	Anodyne	TRPV1	33	43
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450632418	GG	On-Demand	Anodyne	MTR1B_CHICK	0	42
C[C@H](c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1)C(F)(F)F	ZINC000450632421	FF	On-Demand	Anodyne	SIGMAR1	34	40
C[C@@H](c1ccc(CN2CCC(S(N)(=O)=O)CC2)cc1)C(F)(F)F	ZINC000450632422	FF	On-Demand	Anodyne	SIGMAR1	34	40
COc1cc(N2CCN(C(=O)c3ccsc3C)CC2)ncn1	ZINC000450632435	DD	On-Demand	Anodyne	CCKAR	27	42
COc1cc(N2CCN(C(=O)c3cn(-c4cccnc4)nn3)CC2)ncn1	ZINC000450632437	FC	On-Demand	Anodyne	CCKAR	31	42
COc1cc(N2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)ncn1	ZINC000450632460	EE	On-Demand	Anodyne	SSTR1	43	35
COc1cc(N2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)ncn1	ZINC000450632460	EE	On-Demand	Anodyne	NPBWR1	55	33
COc1cc(N2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)ncn1	ZINC000450632461	EE	On-Demand	Anodyne	SSTR1	43	35
COc1cc(N2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)ncn1	ZINC000450632461	EE	On-Demand	Anodyne	NPBWR1	55	33
COc1cc(N2CCN(C(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)CC2)ncn1	ZINC000450632462	EE	On-Demand	Anodyne	SSTR1	43	35
COc1cc(N2CCN(C(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)CC2)ncn1	ZINC000450632462	EE	On-Demand	Anodyne	NPBWR1	55	33
COc1cc(N2CCN(C(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)ncn1	ZINC000450632463	EE	On-Demand	Anodyne	SSTR1	43	35
COc1cc(N2CCN(C(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)ncn1	ZINC000450632463	EE	On-Demand	Anodyne	NPBWR1	55	33
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCCN1CCN(C)CC1	ZINC000450632494	DD	On-Demand	Anodyne	MC4R	34	40
C[C@H](c1ccccc1)[C@H](O)CN(C)CCCN1CCN(C)CC1	ZINC000450632495	DD	On-Demand	Anodyne	MC4R	34	40
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCCN1CCN(C)CC1	ZINC000450632496	DD	On-Demand	Anodyne	MC4R	34	40
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCCN1CCN(C)CC1	ZINC000450632497	DD	On-Demand	Anodyne	MC4R	34	40
CC(F)(F)C(C)(C)C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632498	DF	On-Demand	Bother	CCR2	0	42
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc2n(n1)CCC2	ZINC000450632501	FF	On-Demand	Anodyne	P2RY12	70	33
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc2n(n1)CCC2	ZINC000450632502	FF	On-Demand	Anodyne	P2RY12	70	33
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc2n(n1)CCC2	ZINC000450632503	FF	On-Demand	Anodyne	P2RY12	70	33
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc2n(n1)CCC2	ZINC000450632504	FF	On-Demand	Anodyne	P2RY12	70	33
Fc1cncc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450632505	FF	On-Demand	Anodyne	DRD2	0	47
Fc1cncc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450632505	FF	On-Demand	Anodyne	DRD1	0	40
Fc1cncc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450632505	FF	On-Demand	Anodyne	DRD4	36	47
COC(=O)C1(CN2CCC[C@H](Cc3nccn3C)C2)CC1	ZINC000450632526	CD	On-Demand	Anodyne	CCR3	41	34
COC(=O)C1(CN2CCC[C@@H](Cc3nccn3C)C2)CC1	ZINC000450632527	CD	On-Demand	Anodyne	CCR3	41	34
CCOC(=O)c1cc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)on1	ZINC000450632528	GD	On-Demand	Anodyne	GYRB	0	41
CCOC(=O)c1cc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)on1	ZINC000450632528	GD	On-Demand	Anodyne	CDK1	20	41
CCOC(=O)c1cc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)on1	ZINC000450632528	GD	On-Demand	Anodyne	CDK4	22	41
CCOC(=O)c1cc(C(=O)N2CCN(c3cc(OC)ncn3)CC2)on1	ZINC000450632534	FC	On-Demand	Anodyne	GYRB	0	41
CCCN(CCN(CC)CC)C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450632539	EG	On-Demand	Anodyne	TSPO	44	40
CCCN(CCN(CC)CC)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450632545	EG	On-Demand	Anodyne	AGER	0	46
CC(C)OC(C)(C)C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632547	DE	On-Demand	Bother	CCR2	21	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2cncc(F)c2)CC1	ZINC000450632549	EF	On-Demand	Anodyne	MC4R	0	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2cncc(F)c2)CC1	ZINC000450632550	EF	On-Demand	Anodyne	MC4R	0	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2cncc(F)c2)CC1	ZINC000450632551	EF	On-Demand	Anodyne	MC4R	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2cncc(F)c2)CC1	ZINC000450632552	EF	On-Demand	Anodyne	MC4R	0	40
COc1cc(N2CCN(C(=O)[C@@H]3Cc4cccc(C)c4O3)CC2)ncn1	ZINC000450632557	FD	On-Demand	Anodyne	SSTR2	53	41
COc1cc(N2CCN(C(=O)[C@@H]3Cc4cccc(C)c4O3)CC2)ncn1	ZINC000450632557	FD	On-Demand	Anodyne	SSTR1	60	38
COc1cc(N2CCN(C(=O)[C@H]3Cc4cccc(C)c4O3)CC2)ncn1	ZINC000450632558	FD	On-Demand	Anodyne	SSTR2	53	41
COc1cc(N2CCN(C(=O)[C@H]3Cc4cccc(C)c4O3)CC2)ncn1	ZINC000450632558	FD	On-Demand	Anodyne	SSTR1	60	38
COC(=O)c1csc(CN2CCC[C@H](Cc3nccn3C)C2)n1	ZINC000450632567	EE	On-Demand	Anodyne	CCR3	49	36
COC(=O)c1csc(CN2CCC[C@@H](Cc3nccn3C)C2)n1	ZINC000450632568	EE	On-Demand	Anodyne	CCR3	49	36
COc1cc(OC)c2ncc(C#N)c(NC[C@@]3(O)CCS(=O)(=O)C3)c2c1	ZINC000450632600	GD	On-Demand	Mild	SRC	65	34
COc1cc(OC)c2ncc(C#N)c(NC[C@]3(O)CCS(=O)(=O)C3)c2c1	ZINC000450632601	GD	On-Demand	Mild	SRC	65	34
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CCc3ncc([N+](=O)[O-])cc3C1)C(=O)C2	ZINC000450632602	EE	On-Demand	Bother	CCR2	21	47
COc1cccc(OCCC(=O)N2CC(=O)N(C)C2)c1	ZINC000450632610	CC	On-Demand	Anodyne	DRD4	41	31
CCCN(CCN(CC)CC)C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450632614	EG	On-Demand	Anodyne	PLM2_PLAFA	56	34
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450632618	GG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450632619	GG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450632620	GG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450632621	GG	On-Demand	Anodyne	MTR1B_CHICK	0	40
O=C(Nc1cccc(Cl)c1)c1ccc(NC[C@@]2(O)CCS(=O)(=O)C2)nc1	ZINC000450632630	GD	On-Demand	Anodyne	KCNK3	50	40
O=C(Nc1cccc(Cl)c1)c1ccc(NC[C@]2(O)CCS(=O)(=O)C2)nc1	ZINC000450632631	GD	On-Demand	Anodyne	KCNK3	50	40
O=C(CCCC(=O)C1CC1)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450632638	FD	On-Demand	Anodyne	CDK4	24	42
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CC(CCO)C1	ZINC000450632639	EF	On-Demand	Anodyne	AKR1C3	0	48
CC(F)(F)C(C)(C)C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450632644	FF	On-Demand	Anodyne	CDK4	23	41
C[C@@H]1CC[C@H](C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)O1	ZINC000450632646	CD	On-Demand	Bother	CCR2	21	46
O=S1(=O)CC[C@](O)(CNc2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450632649	FE	On-Demand	Anodyne	HRP1_PLAFA	43	30
O=S1(=O)CC[C@@](O)(CNc2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450632650	FE	On-Demand	Anodyne	HRP1_PLAFA	43	30
CC(C)(C)C(=O)CCCC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632652	EF	On-Demand	Bother	CCR2	0	43
COc1cc(N2CCN(C(=O)Cc3ccc(O)c(OC)c3)CC2)ncn1	ZINC000450632655	FD	On-Demand	Anodyne	TRPV1	0	40
C[C@H](CCCO)CNc1ncnc2[nH]c3ccccc3c12	ZINC000450632687	CF	On-Demand	Anodyne	UTS2R	22	45
C[C@@H](CCCO)CNc1ncnc2[nH]c3ccccc3c12	ZINC000450632688	CF	On-Demand	Anodyne	UTS2R	22	45
CC(=O)N[C@H](C(=O)NCc1ncc(-c2ccccc2)cn1)C(C)(C)C	ZINC000450632703	EE	On-Demand	Anodyne	GAG-PRO	41	31
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450632708	GF	On-Demand	Anodyne	HTR4	43	33
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450632709	GF	On-Demand	Anodyne	HTR4	43	33
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450632710	GF	On-Demand	Anodyne	HTR4	43	33
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450632711	GF	On-Demand	Anodyne	HTR4	43	33
COc1cc(N2CCN(C(=O)c3cn(CC4CC4)nn3)CC2)ncn1	ZINC000450632715	EC	On-Demand	Anodyne	CCKAR	26	40
COC(=O)c1cccc(CN2CCC[C@@H](Cc3nccn3C)C2)c1Cl	ZINC000450632718	FG	On-Demand	Anodyne	SLC6A1	53	34
COC(=O)c1cccc(CN2CCC[C@@H](Cc3nccn3C)C2)c1Cl	ZINC000450632718	FG	On-Demand	Anodyne	CCR3	47	36
COC(=O)c1cccc(CN2CCC[C@H](Cc3nccn3C)C2)c1Cl	ZINC000450632719	FG	On-Demand	Anodyne	SLC6A1	53	34
COC(=O)c1cccc(CN2CCC[C@H](Cc3nccn3C)C2)c1Cl	ZINC000450632719	FG	On-Demand	Anodyne	CCR3	47	36
COc1ccccc1-n1cnc2cc(C(=O)N3CC(CCO)C3)ccc21	ZINC000450632734	FE	On-Demand	Anodyne	HPGD	60	69
C[C@H]1C[C@H](C(=O)N(C)c2nc3ccccc3n2C)CC[C@H]1C	ZINC000450632754	CH	On-Demand	Anodyne	FASN	45	50
C[C@@H]1CC[C@H](C(=O)N(C)c2nc3ccccc3n2C)C[C@H]1C	ZINC000450632755	CH	On-Demand	Anodyne	FASN	45	50
C[C@@H]1CC[C@@H](C(=O)N(C)c2nc3ccccc3n2C)C[C@H]1C	ZINC000450632756	CH	On-Demand	Anodyne	FASN	45	50
C[C@H]1C[C@@H](C(=O)N(C)c2nc3ccccc3n2C)CC[C@H]1C	ZINC000450632757	CH	On-Demand	Anodyne	FASN	45	50
COc1cc(N2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)CC2)ncn1	ZINC000450632780	ED	On-Demand	Anodyne	NPBWR1	55	33
COc1cc(CC(=O)N2CC(Oc3ccc(C#N)cc3)C2)ccc1Cl	ZINC000450632781	FG	On-Demand	Mild	HRH1	17	42
COc1cc(CC(=O)N2CC(Oc3ccc(C#N)cc3)C2)ccc1Cl	ZINC000450632781	FG	On-Demand	Mild	MLNR	18	51
CCCN(CCN(CC)CC)C(=O)c1ocnc1-c1ccccc1	ZINC000450632790	EH	On-Demand	Anodyne	TSPO	44	46
Cc1ccccc1-n1c(SCC[C@H](C)O)nc2ccccc2c1=O	ZINC000450632793	EH	On-Demand	Anodyne	PDE7A	0	52
Cc1ccccc1-n1c(SCC[C@H](C)O)nc2ccccc2c1=O	ZINC000450632793	EH	On-Demand	Anodyne	IDO1	15	41
Cc1ccccc1-n1c(SCC[C@@H](C)O)nc2ccccc2c1=O	ZINC000450632794	EH	On-Demand	Anodyne	PDE7A	0	52
Cc1ccccc1-n1c(SCC[C@@H](C)O)nc2ccccc2c1=O	ZINC000450632794	EH	On-Demand	Anodyne	IDO1	15	41
COc1cc(CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)ccc1O	ZINC000450632800	ED	On-Demand	Bother	CCR2	0	42
N#Cc1ccc(OC2CN(C(=O)CCc3ccc(C(N)=O)cc3)C2)cc1	ZINC000450632807	ED	On-Demand	Mild	MLNR	16	43
COc1cc(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ccc1O	ZINC000450632808	GD	On-Demand	Anodyne	TRPV1	45	59
COc1cc(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ccc1O	ZINC000450632808	GD	On-Demand	Anodyne	CDK2	15	46
COc1cc(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ccc1O	ZINC000450632808	GD	On-Demand	Anodyne	CDK1	26	46
COc1cc(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ccc1O	ZINC000450632808	GD	On-Demand	Anodyne	CDK4	26	46
COc1cc(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ccc1O	ZINC000450632808	GD	On-Demand	Anodyne	NCE103	28	41
COc1cc(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ccc1O	ZINC000450632808	GD	On-Demand	Anodyne	P96878_MYCTU	17	41
COc1cc(CC(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)ccc1O	ZINC000450632808	GD	On-Demand	Anodyne	CAN2	0	41
CCCN(CCN(CC)CC)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450632818	FE	On-Demand	Anodyne	DRD4	40	31
CCCN(CCN(CC)CC)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450632818	FE	On-Demand	Anodyne	ESRRA	23	42
COc1cc(N2CCN(C(=O)Cc3ccccc3O[C@H]3CCOC3)CC2)ncn1	ZINC000450632822	GD	On-Demand	Anodyne	DCK	28	41
COc1cc(N2CCN(C(=O)Cc3ccccc3O[C@H]3CCOC3)CC2)ncn1	ZINC000450632822	GD	On-Demand	Anodyne	PDE4D	15	41
COc1cc(N2CCN(C(=O)Cc3ccccc3O[C@H]3CCOC3)CC2)ncn1	ZINC000450632822	GD	On-Demand	Anodyne	PDEC	0	42
COc1cc(N2CCN(C(=O)Cc3ccccc3O[C@@H]3CCOC3)CC2)ncn1	ZINC000450632823	GD	On-Demand	Anodyne	DCK	28	41
COc1cc(N2CCN(C(=O)Cc3ccccc3O[C@@H]3CCOC3)CC2)ncn1	ZINC000450632823	GD	On-Demand	Anodyne	PDE4D	15	41
COc1cc(N2CCN(C(=O)Cc3ccccc3O[C@@H]3CCOC3)CC2)ncn1	ZINC000450632823	GD	On-Demand	Anodyne	PDEC	0	42
COc1cc(CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)ccc1Cl	ZINC000450632835	FF	On-Demand	Bother	CCR2	0	42
NS(=O)(=O)CC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450632838	DE	On-Demand	Anodyne	SIGMAR1	20	46
NS(=O)(=O)CC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450632839	DE	On-Demand	Anodyne	SIGMAR1	20	46
O=C(Cc1ccccc1O[C@H]1CCOC1)NCc1ncc(-c2ccccc2)cn1	ZINC000450632845	GG	On-Demand	Anodyne	PDE4D	15	41
O=C(Cc1ccccc1O[C@H]1CCOC1)NCc1ncc(-c2ccccc2)cn1	ZINC000450632845	GG	On-Demand	Anodyne	PDEC	0	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCc1ncc(-c2ccccc2)cn1	ZINC000450632846	GG	On-Demand	Anodyne	PDE4D	15	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCc1ncc(-c2ccccc2)cn1	ZINC000450632846	GG	On-Demand	Anodyne	PDEC	0	41
Cc1sccc1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632847	DF	On-Demand	Bother	CCR2	0	45
CC[S@](=O)CC(=O)N[C@@H](C[C@H]1CCCc2ccccc21)C(=O)OC	ZINC000450632858	FD	On-Demand	Anodyne	MTR1B_CHICK	0	42
CC[S@](=O)CC(=O)N[C@H](C[C@@H]1CCCc2ccccc21)C(=O)OC	ZINC000450632859	FD	On-Demand	Anodyne	MTR1B_CHICK	0	42
CC[S@](=O)CC(=O)N[C@H](C[C@H]1CCCc2ccccc21)C(=O)OC	ZINC000450632860	FD	On-Demand	Anodyne	MTR1B_CHICK	0	42
CC[S@](=O)CC(=O)N[C@@H](C[C@@H]1CCCc2ccccc21)C(=O)OC	ZINC000450632861	FD	On-Demand	Anodyne	MTR1B_CHICK	0	42
Cn1ccnc1C[C@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450632864	CF	On-Demand	Anodyne	CCR3	46	33
Cn1ccnc1C[C@@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450632865	CF	On-Demand	Anodyne	CCR3	46	33
CN1CCN(c2nc3ccccc3nc2NC[C@]2(O)CCS(=O)(=O)C2)CC1	ZINC000450632876	GC	On-Demand	Anodyne	HTR3A	28	50
CN1CCN(c2nc3ccccc3nc2NC[C@]2(O)CCS(=O)(=O)C2)CC1	ZINC000450632876	GC	On-Demand	Anodyne	HRH4	21	50
CN1CCN(c2nc3ccccc3nc2NC[C@@]2(O)CCS(=O)(=O)C2)CC1	ZINC000450632877	GC	On-Demand	Anodyne	HTR3A	28	50
CN1CCN(c2nc3ccccc3nc2NC[C@@]2(O)CCS(=O)(=O)C2)CC1	ZINC000450632877	GC	On-Demand	Anodyne	HRH4	21	50
COc1cc(N2CCN(C(=O)C[C@@H]3CCOC[C@@H]3OC)CC2)ncn1	ZINC000450632882	FC	On-Demand	Anodyne	CCR2	26	46
COc1cc(N2CCN(C(=O)C[C@H]3CCOC[C@@H]3OC)CC2)ncn1	ZINC000450632883	FC	On-Demand	Anodyne	CCR2	26	46
COc1cc(N2CCN(C(=O)C[C@@H]3CCOC[C@H]3OC)CC2)ncn1	ZINC000450632884	FC	On-Demand	Anodyne	CCR2	26	46
COc1cc(N2CCN(C(=O)C[C@H]3CCOC[C@H]3OC)CC2)ncn1	ZINC000450632885	FC	On-Demand	Anodyne	CCR2	26	46
Cc1nc2ccnn2cc1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632889	ED	On-Demand	Bother	DDR1	48	34
COc1cc(N2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)ncn1	ZINC000450632901	FC	On-Demand	Anodyne	EGLN2	0	40
COc1cc(N2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)ncn1	ZINC000450632901	FC	On-Demand	Anodyne	EGLN1	0	40
COc1cc(N2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)ncn1	ZINC000450632901	FC	On-Demand	Anodyne	EGLN3	0	40
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632922	GE	On-Demand	Bother	COLA	0	56
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632922	GE	On-Demand	Bother	CPT1A	19	56
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632922	GE	On-Demand	Bother	CPT2	46	42
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632922	GE	On-Demand	Bother	PREP	95	55
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632922	GE	On-Demand	Bother	SFRP1	45	41
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450632922	GE	On-Demand	Bother	WNT3	48	41
O=S1(=O)CC[C@@](O)(CNc2ncnc3cc(Br)ccc23)C1	ZINC000450632928	FC	On-Demand	Anodyne	EGFR	71	37
O=S1(=O)CC[C@](O)(CNc2ncnc3cc(Br)ccc23)C1	ZINC000450632929	FC	On-Demand	Anodyne	EGFR	71	37
COC(=O)c1coc(CSc2nnc(Nc3ccc(C)c(C)c3)s2)n1	ZINC000450632934	GH	On-Demand	Anodyne	DHODH	24	43
CN(C(=O)[C@H]1CCN(c2ccccc2)C1)c1nc2ccccc2n1C	ZINC000450632952	EG	On-Demand	Anodyne	FASN	25	41
CN(C(=O)[C@@H]1CCN(c2ccccc2)C1)c1nc2ccccc2n1C	ZINC000450632953	EG	On-Demand	Anodyne	FASN	25	41
CCOc1nc2ccc(C(=O)N3CCN(c4cc(OC)ncn4)CC3)cc2[nH]1	ZINC000450632955	GD	On-Demand	Anodyne	SLC6A7	0	42
C=CCOc1ccc(CC(=O)N2CCN(c3cc(OC)ncn3)CC2)cc1	ZINC000450632962	FD	On-Demand	Mild	GPR183	0	42
CCCN(CCN(CC)CC)C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450632965	FG	On-Demand	Anodyne	PLM2_PLAFA	48	34
C/C=C\COc1cccc(CC(=O)N2CC(CCO)C2)c1	ZINC000450632966	CE	On-Demand	Anodyne	UPP1	48	32
C/C=C/COc1cccc(CC(=O)N2CC(CCO)C2)c1	ZINC000450632967	CE	On-Demand	Anodyne	UPP1	48	32
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC(Oc2ccc(C#N)cc2)C1	ZINC000450632971	FF	On-Demand	Mild	MLNR	17	43
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC(Oc2ccc(C#N)cc2)C1	ZINC000450632972	FF	On-Demand	Mild	MLNR	17	43
COC(=O)c1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1Cl	ZINC000450632994	FG	On-Demand	Anodyne	HTR4	43	33
COC(=O)c1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1Cl	ZINC000450632994	FG	On-Demand	Anodyne	CCR3	91	38
COC(=O)c1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1Cl	ZINC000450632994	FG	On-Demand	Anodyne	UTS2R	15	40
COC(=O)c1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1Cl	ZINC000450632994	FG	On-Demand	Anodyne	MCHR1	17	40
COC(=O)c1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1Cl	ZINC000450632995	FG	On-Demand	Anodyne	HTR4	43	33
COC(=O)c1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1Cl	ZINC000450632995	FG	On-Demand	Anodyne	CCR3	91	38
COC(=O)c1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1Cl	ZINC000450632995	FG	On-Demand	Anodyne	UTS2R	15	40
COC(=O)c1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1Cl	ZINC000450632995	FG	On-Demand	Anodyne	MCHR1	17	40
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)CCCC(=O)C1CC1	ZINC000450632997	FG	On-Demand	Anodyne	MTR1B_CHICK	0	42
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)CCCC(=O)C1CC1	ZINC000450632997	FG	On-Demand	Anodyne	HDA106	0	43
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)CCCC(=O)C1CC1	ZINC000450632998	FG	On-Demand	Anodyne	MTR1B_CHICK	0	42
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)CCCC(=O)C1CC1	ZINC000450632998	FG	On-Demand	Anodyne	HDA106	0	43
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)CCCC(=O)C1CC1	ZINC000450632999	FG	On-Demand	Anodyne	MTR1B_CHICK	0	42
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)CCCC(=O)C1CC1	ZINC000450632999	FG	On-Demand	Anodyne	HDA106	0	43
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)CCCC(=O)C1CC1	ZINC000450633000	FG	On-Demand	Anodyne	MTR1B_CHICK	0	42
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)CCCC(=O)C1CC1	ZINC000450633000	FG	On-Demand	Anodyne	HDA106	0	43
CCSc1cccnc1C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450633001	GF	On-Demand	Anodyne	CALCA	0	49
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(C(F)(F)F)[nH]1	ZINC000450633007	GF	On-Demand	Anodyne	CDK1	21	42
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(C(F)(F)F)[nH]1	ZINC000450633007	GF	On-Demand	Anodyne	CDK4	23	42
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(C(F)(F)F)[nH]1	ZINC000450633007	GF	On-Demand	Anodyne	CALCA	0	41
CC1=C(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)CCC(C)(C)C1	ZINC000450633013	EG	On-Demand	Bother	CCR2	0	45
O=C(C[C@@H]1COc2ccccc2O1)N1CCc2c(F)cccc21	ZINC000450633016	DF	On-Demand	Anodyne	ADRA2B	19	43
O=C(C[C@H]1COc2ccccc2O1)N1CCc2c(F)cccc21	ZINC000450633017	DF	On-Demand	Anodyne	ADRA2B	19	43
CCCN(CCN(CC)CC)C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450633018	FF	On-Demand	Bother	PLM2_PLAFA	48	36
CCCN(CCN(CC)CC)C(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450633027	EG	On-Demand	Anodyne	TSPO	18	50
COc1ccc(-c2ccnc(NC[C@H](C)CCCO)n2)cc1	ZINC000450633037	DF	On-Demand	Anodyne	CLK4	22	52
COc1ccc(-c2ccnc(NC[C@@H](C)CCCO)n2)cc1	ZINC000450633038	DF	On-Demand	Anodyne	CLK4	22	52
CCc1cccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)n1	ZINC000450633048	FE	On-Demand	Anodyne	CDK1	17	42
CCc1cccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)n1	ZINC000450633048	FE	On-Demand	Anodyne	CALCA	0	44
CCCN(CCN(CC)CC)C(=O)c1cccc(CC)n1	ZINC000450633052	CF	On-Demand	Anodyne	PLM2_PLAFA	41	33
CCCN(CCN(CC)CC)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450633053	DF	On-Demand	Anodyne	TRPV1	0	49
CCCN(CCN(CC)CC)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450633053	DF	On-Demand	Anodyne	NCE103	27	42
CCCN(CCN(CC)CC)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450633053	DF	On-Demand	Anodyne	CAN2	0	42
CN(CCN1CCN(c2cncc(F)c2)CC1)Cc1ccccc1	ZINC000450633069	EE	On-Demand	Anodyne	HTR1A	49	43
CN(CCN1CCN(c2cncc(F)c2)CC1)Cc1ccccc1	ZINC000450633069	EE	On-Demand	Anodyne	DRD2	45	45
CN(CCN1CCN(c2cncc(F)c2)CC1)Cc1ccccc1	ZINC000450633069	EE	On-Demand	Anodyne	HTR2A	44	45
CN(CCN1CCN(c2cncc(F)c2)CC1)Cc1ccccc1	ZINC000450633069	EE	On-Demand	Anodyne	SLC6A4	18	45
CN(CCN1CCN(c2cncc(F)c2)CC1)Cc1ccccc1	ZINC000450633069	EE	On-Demand	Anodyne	DRD3	43	38
CN(CCN1CCN(c2cncc(F)c2)CC1)Cc1ccccc1	ZINC000450633069	EE	On-Demand	Anodyne	SLC6A3	20	45
CN(CCN1CCN(c2cncc(F)c2)CC1)Cc1ccccc1	ZINC000450633069	EE	On-Demand	Anodyne	HTR7	65	47
CN(CCN1CCN(c2cncc(F)c2)CC1)Cc1ccccc1	ZINC000450633069	EE	On-Demand	Anodyne	SIGMAR1	32	45
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3sc(CC)cc23)CC1	ZINC000450633081	GF	On-Demand	Anodyne	P2RY12	17	51
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3sc(CC)cc23)CC1	ZINC000450633081	GF	On-Demand	Anodyne	SIRT3	57	31
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3sc(CC)cc23)CC1	ZINC000450633081	GF	On-Demand	Anodyne	SIRT2	44	29
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3sc(CC)cc23)CC1	ZINC000450633082	GF	On-Demand	Anodyne	P2RY12	17	51
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3sc(CC)cc23)CC1	ZINC000450633082	GF	On-Demand	Anodyne	SIRT3	57	31
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3sc(CC)cc23)CC1	ZINC000450633082	GF	On-Demand	Anodyne	SIRT2	44	29
COc1cc(OC)c2ncnc(NC[C@@]3(O)CCS(=O)(=O)C3)c2c1	ZINC000450633088	FC	On-Demand	Anodyne	PDE6A	42	33
COc1cc(OC)c2ncnc(NC[C@]3(O)CCS(=O)(=O)C3)c2c1	ZINC000450633089	FC	On-Demand	Anodyne	PDE6A	42	33
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1	ZINC000450633095	FF	On-Demand	Anodyne	CCR3	43	34
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1	ZINC000450633096	FF	On-Demand	Anodyne	CCR3	43	34
O=S1(=O)CC[C@](O)(CNc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450633134	ED	On-Demand	Anodyne	HRP1_PLAFA	40	32
O=S1(=O)CC[C@@](O)(CNc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450633135	ED	On-Demand	Anodyne	HRP1_PLAFA	40	32
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)CC1CC(F)(F)C1	ZINC000450633137	FH	On-Demand	Anodyne	CCL2	0	41
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)CC1CC(F)(F)C1	ZINC000450633138	FH	On-Demand	Anodyne	CCL2	0	41
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)CC1CC(F)(F)C1	ZINC000450633139	FH	On-Demand	Anodyne	CCL2	0	41
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)CC1CC(F)(F)C1	ZINC000450633140	FH	On-Demand	Anodyne	CCL2	0	41
C[C@@H](CCCO)CNc1ncnc2cc(Br)ccc12	ZINC000450633160	DF	On-Demand	Anodyne	EGFR	61	38
C[C@H](CCCO)CNc1ncnc2cc(Br)ccc12	ZINC000450633161	DF	On-Demand	Anodyne	EGFR	61	38
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC(CCO)C1	ZINC000450633183	DE	On-Demand	Bother	LIPG	48	38
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC(CCO)C1	ZINC000450633183	DE	On-Demand	Bother	PPXII	0	40
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633190	GE	On-Demand	Bother	CPT2	26	41
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633190	GE	On-Demand	Bother	CCR2	31	51
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633191	GE	On-Demand	Bother	CPT2	26	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633191	GE	On-Demand	Bother	CCR2	31	51
CCCOc1ccc(C(=O)N2CC(CCO)C2)c(OC)c1	ZINC000450633198	CD	On-Demand	Anodyne	OXTR	23	41
Cc1cccc(CN2CCN(c3cncc(F)c3)CC2)n1	ZINC000450633205	CE	On-Demand	Anodyne	DRD1	24	43
Cc1cccc(CN2CCN(c3cncc(F)c3)CC2)n1	ZINC000450633205	CE	On-Demand	Anodyne	DRD4	33	43
COc1cc(N2CCN(C(=O)Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450633206	GE	On-Demand	Anodyne	IGF1R	16	40
COc1cc(N2CCN(C(=O)Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450633206	GE	On-Demand	Anodyne	CCR1	26	49
COc1cc(N2CCN(C(=O)Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450633206	GE	On-Demand	Anodyne	PDE6A	40	30
CCCN(CCN(CC)CC)C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450633208	EF	On-Demand	Anodyne	PLM2_PLAFA	51	38
COc1cc2c(N(Cc3cccc(C(N)=O)c3)C3CC3)ncnc2cc1F	ZINC000450633233	FG	On-Demand	Anodyne	PDE3B	53	32
C=CCOc1ccc(CC(=O)N2CC(CCO)C2)cc1	ZINC000450633236	CD	On-Demand	Mild	GPR183	0	40
COC(=O)c1ccc(CC(=O)N2CCN(c3cc(OC)ncn3)CC2)cc1	ZINC000450633239	FD	On-Demand	Anodyne	PDGFRB	41	38
COC(=O)c1ccc(CC(=O)N2CCN(c3cc(OC)ncn3)CC2)cc1	ZINC000450633239	FD	On-Demand	Anodyne	HRH3	0	40
NS(=O)(=O)CC1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450633248	GG	On-Demand	Anodyne	HRH1	21	46
NS(=O)(=O)CC1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450633248	GG	On-Demand	Anodyne	SIGMAR1	44	52
NS(=O)(=O)CC1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450633248	GG	On-Demand	Anodyne	CCR3	51	39
C[C@H](CCCO)CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450633258	DF	On-Demand	Bother	MAOB	18	49
C[C@@H](CCCO)CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450633259	DF	On-Demand	Bother	MAOB	18	49
COc1cc(N2CCN(C(=O)CCc3ccc4ccccc4c3O)CC2)ncn1	ZINC000450633269	GF	On-Demand	Anodyne	PDGFRB	42	38
Fc1cncc(N2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)c1	ZINC000450633270	EE	On-Demand	Anodyne	DRD4	15	42
CN(C)c1nc(NC[C@@]2(O)CCS(=O)(=O)C2)nc2ccccc12	ZINC000450633275	EC	On-Demand	Anodyne	ADRA2A	16	47
CN(C)c1nc(NC[C@]2(O)CCS(=O)(=O)C2)nc2ccccc12	ZINC000450633276	EC	On-Demand	Anodyne	ADRA2A	16	47
C[C@@H]1CCC[C@@]1(C)C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633278	DF	On-Demand	Bother	CCR2	23	51
C[C@@H]1CCC[C@]1(C)C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633279	DF	On-Demand	Bother	CCR2	23	51
C[C@H]1CCC[C@@]1(C)C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633280	DF	On-Demand	Bother	CCR2	23	51
C[C@H]1CCC[C@]1(C)C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633281	DF	On-Demand	Bother	CCR2	23	51
COc1cc(CC(=O)N2CC(Oc3ccc(C#N)cc3)C2)ccc1O	ZINC000450633294	EE	On-Demand	Mild	TRPV1	15	40
COc1cc(CC(=O)N2CC(Oc3ccc(C#N)cc3)C2)ccc1O	ZINC000450633294	EE	On-Demand	Mild	MLNR	21	49
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc2n(n1)CCCC2	ZINC000450633297	GG	On-Demand	Anodyne	P2RY12	84	35
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc2n(n1)CCCC2	ZINC000450633298	GG	On-Demand	Anodyne	P2RY12	84	35
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc2n(n1)CCCC2	ZINC000450633299	GG	On-Demand	Anodyne	P2RY12	84	35
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc2n(n1)CCCC2	ZINC000450633300	GG	On-Demand	Anodyne	P2RY12	84	35
CCOC(=O)C1([S@@](C)=O)CCN(c2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000450633313	GF	On-Demand	Mild	LIPG	43	35
CCOC(=O)C1([S@](C)=O)CCN(c2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000450633314	GF	On-Demand	Mild	LIPG	43	35
CCOC(=O)C1([S@@](C)=O)CCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450633315	GD	On-Demand	Anodyne	SORD	49	39
CCOC(=O)C1([S@](C)=O)CCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450633316	GD	On-Demand	Anodyne	SORD	49	39
COc1cc(N2CCN(C(=O)c3cn4nccc4nc3C)CC2)ncn1	ZINC000450633319	FC	On-Demand	Anodyne	CCKAR	35	40
C[C@H](CCCO)CNc1cnc(-c2ccccc2)cn1	ZINC000450633323	CF	On-Demand	Anodyne	TPH1	30	44
C[C@@H](CCCO)CNc1cnc(-c2ccccc2)cn1	ZINC000450633324	CF	On-Demand	Anodyne	TPH1	30	44
CC1CC(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)(c2cccc(Cl)c2)C1	ZINC000450633325	GH	On-Demand	Bother	CCR2	0	43
N#Cc1ccc(OC2CN(C(=O)Cc3ccc(OC(F)F)c(F)c3)C2)cc1	ZINC000450633327	GG	On-Demand	Mild	MLNR	16	46
CC(C)CC(CC(C)C)C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450633328	GH	On-Demand	Anodyne	CDK1	20	40
CC(C)CC(CC(C)C)C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450633328	GH	On-Demand	Anodyne	CDK4	23	40
COc1cc(N2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)ncn1	ZINC000450633337	GF	On-Demand	Anodyne	HTR3A	15	41
COc1cc(N2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)ncn1	ZINC000450633337	GF	On-Demand	Anodyne	TACR1	0	40
COc1cc(N2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)ncn1	ZINC000450633337	GF	On-Demand	Anodyne	CCKAR	60	43
COc1cc(N2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)ncn1	ZINC000450633337	GF	On-Demand	Anodyne	TACR3	24	40
COc1cc(N2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)ncn1	ZINC000450633337	GF	On-Demand	Anodyne	SMO	15	40
CCOC(=O)C1([S@@](C)=O)CCN(c2ncncc2-c2ccccc2)CC1	ZINC000450633338	FE	On-Demand	Anodyne	SLC9A1	15	44
Cc1c(Cl)ccc2ccc(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)nc12	ZINC000450633339	FH	On-Demand	Anodyne	CHRNA4	29	46
CCOC(=O)C1([S@](C)=O)CCN(c2ncncc2-c2ccccc2)CC1	ZINC000450633341	FE	On-Demand	Anodyne	SLC9A1	15	44
c1ccc(CC[C@H]2CCCCN2C[C@H]2COCCO2)cc1	ZINC000450633357	CF	On-Demand	Anodyne	SLC18A2	36	44
c1ccc(CC[C@H]2CCCCN2C[C@@H]2COCCO2)cc1	ZINC000450633358	CF	On-Demand	Anodyne	SLC18A2	36	44
c1ccc(CC[C@@H]2CCCCN2C[C@H]2COCCO2)cc1	ZINC000450633359	CF	On-Demand	Anodyne	SLC18A2	36	44
c1ccc(CC[C@@H]2CCCCN2C[C@@H]2COCCO2)cc1	ZINC000450633360	CF	On-Demand	Anodyne	SLC18A2	36	44
CC(C)CC(CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633361	GH	On-Demand	Anodyne	CDK1	21	43
CC(C)CC(CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633361	GH	On-Demand	Anodyne	CDK4	23	43
CC(C)CC(CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633361	GH	On-Demand	Anodyne	CALCA	0	40
CC(C)CC(CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633361	GH	On-Demand	Anodyne	CARM1	49	37
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc3cc(Cl)cc(Cl)c3o2)C1	ZINC000450633369	GH	On-Demand	Anodyne	CHRNA4	28	47
COc1cc(N2CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC2)ncn1	ZINC000450633387	GD	On-Demand	Anodyne	MC4R	36	41
CCc1c(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)oc2ccccc12	ZINC000450633392	GG	On-Demand	Anodyne	CDK1	20	41
CCc1c(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)oc2ccccc12	ZINC000450633392	GG	On-Demand	Anodyne	CDK4	22	41
CCc1c(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)oc2ccccc12	ZINC000450633392	GG	On-Demand	Anodyne	CALCA	0	40
CC(=O)c1ccc(C#N)c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1	ZINC000450633405	EF	On-Demand	Mild	CHRNA4	38	52
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1	ZINC000450633408	GH	On-Demand	Bother	CHRNA4	28	46
COc1cc(N2CCN(C(=O)c3cccc(SC)c3)CC2)ncn1	ZINC000450633419	EE	On-Demand	Anodyne	ALS	63	35
COc1cc(N2CCN(C(=O)c3cccc(SC)c3)CC2)ncn1	ZINC000450633419	EE	On-Demand	Anodyne	HPGD	42	38
CC(=O)N[C@H](C(=O)N1CC(Oc2ccc(C#N)cc2)C1)C(C)(C)C	ZINC000450633421	ED	On-Demand	Mild	CTRB_BOVIN	43	32
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3c([N+](=O)[O-])cccc23)C1	ZINC000450633422	FF	On-Demand	Bother	CHRNA4	27	45
COc1cc(N2CCN(C(=O)c3cnn(-c4ccncc4)c3)CC2)ncn1	ZINC000450633425	FD	On-Demand	Anodyne	SLC6A7	0	40
CCCN(CCN(CC)CC)C(=O)c1cnc(C2CC2)nc1	ZINC000450633429	DF	On-Demand	Anodyne	PLM2_PLAFA	48	36
NS(=O)(=O)CC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450633436	FD	On-Demand	Anodyne	DRD2	0	41
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccnc(C(N)=O)c2)CC1	ZINC000450633440	GE	On-Demand	Anodyne	CHEK1	41	33
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccnc(C(N)=O)c2)CC1	ZINC000450633440	GE	On-Demand	Anodyne	SLC12A5	45	32
O=C([C@H]1CCN(c2ccccc2)C1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633447	FE	On-Demand	Bother	SSTR3	15	42
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000450633448	FE	On-Demand	Bother	SSTR3	15	42
CCCOc1ccc(C(=O)N2CCN(c3cc(OC)ncn3)CC2)c(OC)c1	ZINC000450633450	GE	On-Demand	Anodyne	OXTR	26	43
CCCOc1ccc(C(=O)N2CCN(c3cc(OC)ncn3)CC2)c(OC)c1	ZINC000450633450	GE	On-Demand	Anodyne	PDGFRB	47	41
CCCOc1ccc(C(=O)N2CCN(c3cc(OC)ncn3)CC2)c(OC)c1	ZINC000450633450	GE	On-Demand	Anodyne	CCKAR	30	40
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)C1(C(F)(F)F)CCC1	ZINC000450633457	GF	On-Demand	Anodyne	CDK1	23	43
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)C1(C(F)(F)F)CCC1	ZINC000450633457	GF	On-Demand	Anodyne	CDK4	24	43
CSc1ccc2ncnc(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1	ZINC000450633462	FG	On-Demand	Anodyne	CHRNA4	27	42
Cc1cc(C(F)(F)F)nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450633463	FF	On-Demand	Anodyne	CHRNA4	30	47
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccnc3cccnc23)CC1	ZINC000450633474	GH	On-Demand	Anodyne	METAP1	21	42
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccnc(N(C)C)n2)CC1	ZINC000450633477	GF	On-Demand	Anodyne	SORD	60	34
COC(=O)c1csc(CN2CCN(c3ncccc3F)CC2)n1	ZINC000450633482	ED	On-Demand	Anodyne	DRD4	18	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]3C(C)C)cc2)c1	ZINC000450633486	FH	On-Demand	Anodyne	CHRM3	17	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]3C(C)C)cc2)c1	ZINC000450633486	FH	On-Demand	Anodyne	MMP13	19	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]3C(C)C)cc2)c1	ZINC000450633487	FH	On-Demand	Anodyne	CHRM3	17	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]3C(C)C)cc2)c1	ZINC000450633487	FH	On-Demand	Anodyne	MMP13	19	45
COc1ccc2c(c1OC)CCN(CCc1cscn1)C2	ZINC000450633489	DF	On-Demand	Anodyne	ABCB1B	47	32
CCOC(=O)c1cnn(C2CCN(c3cc(C#N)ccc3C(F)(F)F)CC2)c1	ZINC000450633496	GH	On-Demand	Mild	P2RY12	54	41
CC(C)(C[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633497	GH	On-Demand	Anodyne	PDE3A	44	35
CC(C)(C[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633497	GH	On-Demand	Anodyne	PDE3B	65	34
CC(C)(C[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633497	GH	On-Demand	Anodyne	SIRT3	87	36
CC(C)(C[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633497	GH	On-Demand	Anodyne	SIRT2	72	36
CC(C)(C[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633497	GH	On-Demand	Anodyne	SIRT1	63	36
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633498	GH	On-Demand	Anodyne	PDE3A	44	35
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633498	GH	On-Demand	Anodyne	PDE3B	65	34
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633498	GH	On-Demand	Anodyne	SIRT3	87	36
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633498	GH	On-Demand	Anodyne	SIRT2	72	36
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1)C(N)=O	ZINC000450633498	GH	On-Demand	Anodyne	SIRT1	63	36
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450633499	GF	On-Demand	Anodyne	PDE3A	55	44
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450633499	GF	On-Demand	Anodyne	PDGFRB	82	53
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450633499	GF	On-Demand	Anodyne	PDE3B	81	44
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450633499	GF	On-Demand	Anodyne	SIRT3	53	34
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450633499	GF	On-Demand	Anodyne	SIRT2	45	32
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450633499	GF	On-Demand	Anodyne	SIRT1	41	32
CCOC(=O)c1cnn(C2CCN(c3ncc(-c4ccccc4)s3)CC2)c1	ZINC000450633500	GI	On-Demand	Anodyne	P2RY12	46	38
CCOC(=O)c1cnn(C2CCN(c3ncc(-c4ccccc4)s3)CC2)c1	ZINC000450633500	GI	On-Demand	Anodyne	LUCI_LUCLA	20	49
CCOC(=O)c1cnn(C2CCN(c3ncc(-c4ccccc4)s3)CC2)c1	ZINC000450633500	GI	On-Demand	Anodyne	MLYCD	45	37
CCOC(=O)c1cnn(C2CCN(c3ncc(-c4ccccc4)s3)CC2)c1	ZINC000450633500	GI	On-Demand	Anodyne	MAP3K7	43	36
CO[C@]1(CNC(=O)COc2ccc(C#N)c(Br)c2)CCOC1	ZINC000450633509	FD	On-Demand	Mild	TRPV4	40	30
CO[C@@]1(CNC(=O)COc2ccc(C#N)c(Br)c2)CCOC1	ZINC000450633510	FD	On-Demand	Mild	TRPV4	40	30
Cc1cc(C(=O)N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)ncc1C(N)=O	ZINC000450633516	FG	On-Demand	Anodyne	GRIN2B	32	40
Cc1cc(C(=O)N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)ncc1C(N)=O	ZINC000450633517	FG	On-Demand	Anodyne	GRIN2B	32	40
CCC[C@H](NC(=O)C[S@](=O)CC)C(=O)OC(C)(C)C	ZINC000450633520	CD	On-Demand	Anodyne	CTSK	15	40
CCC[C@@H](NC(=O)C[S@@](=O)CC)C(=O)OC(C)(C)C	ZINC000450633521	CD	On-Demand	Anodyne	CTSK	15	40
CCC[C@@H](NC(=O)C[S@](=O)CC)C(=O)OC(C)(C)C	ZINC000450633522	CD	On-Demand	Anodyne	CTSK	15	40
CCC[C@H](NC(=O)C[S@@](=O)CC)C(=O)OC(C)(C)C	ZINC000450633523	CD	On-Demand	Anodyne	CTSK	15	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	CTSK	51	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	CTSL	45	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	CAPNS1	57	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	HLA-DRB1	46	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	CAPN1	75	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	CAPN2	113	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	CTSV	46	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	FPR1	58	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	NPR	60	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450633524	GF	On-Demand	Anodyne	PSMB5	40	34
CN(CCN1CCN2C(=O)NC(=O)[C@@H]2C1)Cc1ccccc1	ZINC000450633526	DC	On-Demand	Anodyne	SIGMAR1	31	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450633527	FF	On-Demand	Anodyne	DRD3	0	50
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450633528	FF	On-Demand	Anodyne	DRD3	0	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450633529	FF	On-Demand	Anodyne	DRD3	0	50
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450633530	FF	On-Demand	Anodyne	DRD3	0	50
CSc1cccc(C(=O)NCCCC(=O)OC(C)C)c1	ZINC000450633531	CF	On-Demand	Anodyne	DRD4	41	31
CN(CCN1CCN2C(=O)NC(=O)[C@H]2C1)Cc1ccccc1	ZINC000450633534	DC	On-Demand	Anodyne	SIGMAR1	31	46
Cc1nccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1Cl	ZINC000450633539	DF	On-Demand	Anodyne	CHRNA4	31	51
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cc(CC)nc(C)n2)CC1	ZINC000450633542	GG	On-Demand	Anodyne	P2RY12	56	37
CC(C)N1CCN(C2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450633544	EG	On-Demand	Anodyne	SIGMAR1	24	44
CC(C)N1CCN(C2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450633544	EG	On-Demand	Anodyne	EBP	23	40
CC(C)N1CCN(C2CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450633544	EG	On-Demand	Anodyne	L3MBTL3	41	47
CCOC(=O)c1cnn(C2CCN(c3nc4ccccc4[nH]3)CC2)c1	ZINC000450633586	EF	On-Demand	Anodyne	NPY5R	0	47
N#Cc1cccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1[N+](=O)[O-]	ZINC000450633594	EE	On-Demand	Mild	CHRNA4	35	44
CCCC[C@H](NC(=O)[C@@H]1OCC[C@@H]1C)C(=O)OC(C)(C)C	ZINC000450633595	CE	On-Demand	Anodyne	CTSK	0	46
CCCC[C@H](NC(=O)[C@@H]1OCC[C@@H]1C)C(=O)OC(C)(C)C	ZINC000450633595	CE	On-Demand	Anodyne	PGA5	40	37
CCCC[C@@H](NC(=O)[C@@H]1OCC[C@@H]1C)C(=O)OC(C)(C)C	ZINC000450633596	CE	On-Demand	Anodyne	CTSK	0	46
CCCC[C@@H](NC(=O)[C@@H]1OCC[C@@H]1C)C(=O)OC(C)(C)C	ZINC000450633596	CE	On-Demand	Anodyne	PGA5	40	37
CN(C)c1nc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nc2ccccc12	ZINC000450633597	FF	On-Demand	Anodyne	ADRA2A	0	41
CN(C)c1nc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nc2ccccc12	ZINC000450633598	FF	On-Demand	Anodyne	ADRA2A	0	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000450633600	EF	On-Demand	Bother	CHRNA4	37	52
CC[C@H](c1ccc(Cl)cc1Cl)n1cnc2c1c(=O)n(C)c(=O)n2C	ZINC000450633608	FF	On-Demand	Anodyne	MAOB	0	43
CC[C@@H](c1ccc(Cl)cc1Cl)n1cnc2c1c(=O)n(C)c(=O)n2C	ZINC000450633611	FF	On-Demand	Anodyne	MAOB	0	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nnc(C3CC3)s2)C1	ZINC000450633617	DE	On-Demand	Anodyne	CHRNA4	31	50
CCc1cccc(C(=O)NCCc2nnc(-c3ccccc3)n2C)n1	ZINC000450633627	EE	On-Demand	Anodyne	HTR2A	25	41
CC(C)N1CCN(C2CCN(CC/C=C\c3ccccc3)CC2)CC1	ZINC000450633632	EH	On-Demand	Anodyne	SIGMAR1	15	40
CC(C)N1CCN(C2CCN(CC/C=C/c3ccccc3)CC2)CC1	ZINC000450633633	EH	On-Demand	Anodyne	SIGMAR1	15	40
Fc1cccnc1N1CCN(CC2=CCCCC2)CC1	ZINC000450633634	CF	On-Demand	Anodyne	DRD4	18	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccncc2Cl)CC1	ZINC000450633641	FH	On-Demand	Anodyne	SLC12A5	42	33
C[C@@H]1C[C@]1(C#N)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450633642	DD	On-Demand	Mild	P2RX7	15	41
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450633643	DD	On-Demand	Mild	P2RX7	15	41
C[C@H]1C[C@]1(C#N)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450633644	DD	On-Demand	Mild	P2RX7	15	41
C[C@H]1C[C@@]1(C#N)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450633645	DD	On-Demand	Mild	P2RX7	15	41
CC(C)(C[C@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1)C(N)=O	ZINC000450633647	GE	On-Demand	Anodyne	HDAC1	29	43
CC(C)(C[C@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1)C(N)=O	ZINC000450633647	GE	On-Demand	Anodyne	HPGDS	15	41
CC(C)(C[C@@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1)C(N)=O	ZINC000450633649	GE	On-Demand	Anodyne	HDAC1	29	43
CC(C)(C[C@@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1)C(N)=O	ZINC000450633649	GE	On-Demand	Anodyne	HPGDS	15	41
C[C@H](O)CCN1CCCC[C@@H]1CCc1ccccc1	ZINC000450633652	CG	On-Demand	Anodyne	SLC18A2	110	54
C[C@H](O)CCN1CCCC[C@@H]1CCc1ccccc1	ZINC000450633652	CG	On-Demand	Anodyne	SIGMAR1	22	41
C[C@@H](O)CCN1CCCC[C@@H]1CCc1ccccc1	ZINC000450633653	CG	On-Demand	Anodyne	SLC18A2	110	54
C[C@@H](O)CCN1CCCC[C@@H]1CCc1ccccc1	ZINC000450633653	CG	On-Demand	Anodyne	SIGMAR1	22	41
C[C@H](O)CCN1CCCC[C@H]1CCc1ccccc1	ZINC000450633654	CG	On-Demand	Anodyne	SLC18A2	110	54
C[C@H](O)CCN1CCCC[C@H]1CCc1ccccc1	ZINC000450633654	CG	On-Demand	Anodyne	SIGMAR1	22	41
C[C@@H](O)CCN1CCCC[C@H]1CCc1ccccc1	ZINC000450633655	CG	On-Demand	Anodyne	SLC18A2	110	54
C[C@@H](O)CCN1CCCC[C@H]1CCc1ccccc1	ZINC000450633655	CG	On-Demand	Anodyne	SIGMAR1	22	41
CC(C)c1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc(C(C)(C)C)n1	ZINC000450633666	FH	On-Demand	Anodyne	CHRNA4	28	43
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCCn1ccnc1	ZINC000450633667	CE	On-Demand	Anodyne	CYP17A1	0	45
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCCn1ccnc1	ZINC000450633667	CE	On-Demand	Anodyne	HMOX2	47	38
C[C@H](c1ccccc1)[C@H](O)CN(C)CCCn1ccnc1	ZINC000450633668	CE	On-Demand	Anodyne	CYP17A1	0	45
C[C@H](c1ccccc1)[C@H](O)CN(C)CCCn1ccnc1	ZINC000450633668	CE	On-Demand	Anodyne	HMOX2	47	38
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCCn1ccnc1	ZINC000450633670	CE	On-Demand	Anodyne	CYP17A1	0	45
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCCn1ccnc1	ZINC000450633670	CE	On-Demand	Anodyne	HMOX2	47	38
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCCn1ccnc1	ZINC000450633671	CE	On-Demand	Anodyne	CYP17A1	0	45
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCCn1ccnc1	ZINC000450633671	CE	On-Demand	Anodyne	HMOX2	47	38
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633684	GH	On-Demand	Anodyne	PRNP	48	38
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633684	GH	On-Demand	Anodyne	HDAC1	30	44
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633684	GH	On-Demand	Anodyne	P4HTM	0	44
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633684	GH	On-Demand	Anodyne	DGAT1	50	39
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633684	GH	On-Demand	Anodyne	HPGDS	19	40
COc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1OC	ZINC000450633686	EG	On-Demand	Anodyne	TYMS	0	41
COc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1OC	ZINC000450633686	EG	On-Demand	Anodyne	GSK3B	23	51
COc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1OC	ZINC000450633686	EG	On-Demand	Anodyne	GSK3A	42	44
COc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1OC	ZINC000450633686	EG	On-Demand	Anodyne	PIK3CG	0	56
COc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1OC	ZINC000450633686	EG	On-Demand	Anodyne	TERT	27	45
Cc1nn(C)cc1CC(=O)N1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450633698	FH	On-Demand	Anodyne	GRIN2B	32	40
Cc1nn(C)cc1CC(=O)N1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450633698	FH	On-Demand	Anodyne	CCR3	27	48
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633699	FG	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633699	FG	On-Demand	Anodyne	SLC6A1	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633699	FG	On-Demand	Anodyne	DRD3	24	52
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633699	FG	On-Demand	Anodyne	SIGMAR1	23	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633699	FG	On-Demand	Anodyne	MCHR1	23	44
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633699	FG	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633700	FG	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633700	FG	On-Demand	Anodyne	SLC6A1	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633700	FG	On-Demand	Anodyne	DRD3	24	52
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633700	FG	On-Demand	Anodyne	SIGMAR1	23	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633700	FG	On-Demand	Anodyne	MCHR1	23	44
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633700	FG	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633701	FG	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633701	FG	On-Demand	Anodyne	SLC6A1	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633701	FG	On-Demand	Anodyne	DRD3	24	52
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633701	FG	On-Demand	Anodyne	SIGMAR1	23	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633701	FG	On-Demand	Anodyne	MCHR1	23	44
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000450633701	FG	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633702	FG	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633702	FG	On-Demand	Anodyne	SLC6A1	0	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633702	FG	On-Demand	Anodyne	DRD3	24	52
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633702	FG	On-Demand	Anodyne	SIGMAR1	23	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633702	FG	On-Demand	Anodyne	MCHR1	23	44
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000450633702	FG	On-Demand	Anodyne	GPR88	0	42
COCc1nn(C)cc1C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450633703	ED	On-Demand	Anodyne	P2RX7	26	45
CC[C@@H]1C[C@H]1C(=O)NCCCC(=O)OC(C)C	ZINC000450633704	BD	On-Demand	Anodyne	EPHX2	30	47
CC(C)OC(=O)CCCNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450633710	FE	On-Demand	Anodyne	CA2	17	45
CC(C)[C@@H]1CCN1C(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450633711	DG	On-Demand	Anodyne	SLC12A5	46	33
CC(C)[C@H]1CCN1C(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450633712	DG	On-Demand	Anodyne	SLC12A5	46	33
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nnc(-c3ccccc3Cl)s2)C1	ZINC000450633715	GH	On-Demand	Anodyne	CHRNA4	30	52
CCc1nc(C)c(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)o1	ZINC000450633716	FH	On-Demand	Anodyne	GSK3B	22	46
CCc1nc(C)c(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)o1	ZINC000450633716	FH	On-Demand	Anodyne	GSK3A	40	44
CCc1nc(C)c(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)o1	ZINC000450633716	FH	On-Demand	Anodyne	PIK3CG	0	53
CCc1nc(C)c(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)o1	ZINC000450633716	FH	On-Demand	Anodyne	TERT	22	41
COC(=O)C1(CN2CCc3ccc(Cl)cc3C2)CC1	ZINC000450633721	CF	On-Demand	Anodyne	NOD2	40	35
CC(C)OC(=O)CCCNC(=O)c1ccc2cnccc2c1	ZINC000450633722	DF	On-Demand	Anodyne	AKT1	0	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450633723	GG	On-Demand	Anodyne	DRD4	19	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450633723	GG	On-Demand	Anodyne	DRD3	0	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450633723	GG	On-Demand	Anodyne	SIGMAR1	22	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450633724	GG	On-Demand	Anodyne	DRD4	19	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450633724	GG	On-Demand	Anodyne	DRD3	0	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450633724	GG	On-Demand	Anodyne	SIGMAR1	22	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450633725	GG	On-Demand	Anodyne	DRD4	19	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450633725	GG	On-Demand	Anodyne	DRD3	0	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450633725	GG	On-Demand	Anodyne	SIGMAR1	22	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450633726	GG	On-Demand	Anodyne	DRD4	19	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450633726	GG	On-Demand	Anodyne	DRD3	0	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450633726	GG	On-Demand	Anodyne	SIGMAR1	22	48
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncc(C(C)C)s2)CC1	ZINC000450633731	GI	On-Demand	Anodyne	MLYCD	49	38
CCSc1cccnc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633738	GF	On-Demand	Anodyne	CDK1	20	40
CCSc1cccnc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633738	GF	On-Demand	Anodyne	CDK4	22	40
CCSc1cccnc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633738	GF	On-Demand	Anodyne	CALCA	0	49
CC[C@H](O)CC(=O)N(Cc1ccccc1)CC(C)(C)O	ZINC000450633739	CD	On-Demand	Anodyne	MLYCD	17	41
CC[C@@H](O)CC(=O)N(Cc1ccccc1)CC(C)(C)O	ZINC000450633740	CD	On-Demand	Anodyne	MLYCD	17	41
COc1cc(CN2CC[C@@H](N3CCCC3=O)C2)ccc1Cl	ZINC000450633749	DF	On-Demand	Anodyne	TACR2	30	41
COc1cc(CN2CC[C@@H](N3CCCC3=O)C2)ccc1Cl	ZINC000450633749	DF	On-Demand	Anodyne	SSTR5	45	36
COc1cc(CN2CC[C@@H](N3CCCC3=O)C2)ccc1Cl	ZINC000450633749	DF	On-Demand	Anodyne	TACR3	41	39
COc1cc(CN2CC[C@H](N3CCCC3=O)C2)ccc1Cl	ZINC000450633750	DF	On-Demand	Anodyne	TACR2	30	41
COc1cc(CN2CC[C@H](N3CCCC3=O)C2)ccc1Cl	ZINC000450633750	DF	On-Demand	Anodyne	SSTR5	45	36
COc1cc(CN2CC[C@H](N3CCCC3=O)C2)ccc1Cl	ZINC000450633750	DF	On-Demand	Anodyne	TACR3	41	39
CC(C)c1ncsc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633751	GF	On-Demand	Anodyne	CDK1	20	40
CC(C)c1ncsc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633751	GF	On-Demand	Anodyne	CDK4	22	40
CC(C)c1ncsc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633751	GF	On-Demand	Anodyne	CALCA	0	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)ccc1F	ZINC000450633754	EF	For-Sale	Anodyne	DRD3	0	59
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)ccc1F	ZINC000450633755	EF	For-Sale	Anodyne	DRD3	0	59
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)ccc1F	ZINC000450633756	EF	For-Sale	Anodyne	DRD3	0	59
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)ccc1F	ZINC000450633757	EF	For-Sale	Anodyne	DRD3	0	59
C=CC(C)(C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633764	DE	On-Demand	Mild	CDK1	21	42
C=CC(C)(C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450633764	DE	On-Demand	Mild	CDK4	22	42
CCCn1c(SCc2cccc(C(C)=O)c2)nc2ccccc2c1=O	ZINC000450633774	FI	On-Demand	Anodyne	PTGDR2	19	64
CC[C@@H](CC(F)(F)F)C(=O)NCCCC(=O)OC(C)C	ZINC000450633783	CF	On-Demand	Anodyne	TLR2	0	41
CC[C@H](CC(F)(F)F)C(=O)NCCCC(=O)OC(C)C	ZINC000450633784	CF	On-Demand	Anodyne	TLR2	0	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccncc2[N+](=O)[O-])C1	ZINC000450633785	DD	On-Demand	Bother	CHRNA4	29	53
CC(C)c1ccc(CC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)cc1	ZINC000450633793	GI	On-Demand	Anodyne	CHRM2	15	41
CC(C)c1ccc(CC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)cc1	ZINC000450633793	GI	On-Demand	Anodyne	FKBP1A	0	58
CC(C)c1ccc(CC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)cc1	ZINC000450633793	GI	On-Demand	Anodyne	GRIN2B	47	44
CC(C)c1ccc(CC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)cc1	ZINC000450633793	GI	On-Demand	Anodyne	HRH3	0	40
CC(C)c1ccc(CC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)cc1	ZINC000450633793	GI	On-Demand	Anodyne	CCR3	31	41
CC(C)c1ccc(CC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)cc1	ZINC000450633793	GI	On-Demand	Anodyne	C3AR1	42	38
CC(C)c1ccc(CC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)cc1	ZINC000450633793	GI	On-Demand	Anodyne	GPBAR1	19	47
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633794	GH	On-Demand	Anodyne	PRNP	48	38
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633794	GH	On-Demand	Anodyne	HDAC1	30	44
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633794	GH	On-Demand	Anodyne	P4HTM	0	44
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633794	GH	On-Demand	Anodyne	DGAT1	50	39
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)nc2)cc1	ZINC000450633794	GH	On-Demand	Anodyne	HPGDS	19	40
CCOC(=O)c1cnn(C2CCN(c3cc(C#N)c4ccccc4n3)CC2)c1	ZINC000450633799	GG	On-Demand	Mild	P2RY12	64	48
CCCC[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C(=O)OC(C)(C)C	ZINC000450633800	FG	On-Demand	Anodyne	P2RY12	63	34
CCCC[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C(=O)OC(C)(C)C	ZINC000450633800	FG	On-Demand	Anodyne	C3AR1	29	42
CCCC[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C(=O)OC(C)(C)C	ZINC000450633801	FG	On-Demand	Anodyne	P2RY12	63	34
CCCC[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C(=O)OC(C)(C)C	ZINC000450633801	FG	On-Demand	Anodyne	C3AR1	29	42
Cn1c(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nc2cccc(F)c21	ZINC000450633805	EF	On-Demand	Anodyne	DPP4	25	41
Cn1c(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nc2cccc(F)c21	ZINC000450633806	EF	On-Demand	Anodyne	DPP4	25	41
CCCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633835	EG	On-Demand	Anodyne	SSTR2	40	34
CCCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633835	EG	On-Demand	Anodyne	TRPV1	0	47
CCCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633835	EG	On-Demand	Anodyne	GRIA1	51	33
CCCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633835	EG	On-Demand	Anodyne	PSENEN	0	43
CCCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633835	EG	On-Demand	Anodyne	POLG_WNV	42	34
CCCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633835	EG	On-Demand	Anodyne	NOD1	48	31
CCCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633836	EG	On-Demand	Anodyne	SSTR2	40	34
CCCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633836	EG	On-Demand	Anodyne	TRPV1	0	47
CCCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633836	EG	On-Demand	Anodyne	GRIA1	51	33
CCCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633836	EG	On-Demand	Anodyne	PSENEN	0	43
CCCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633836	EG	On-Demand	Anodyne	POLG_WNV	42	34
CCCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450633836	EG	On-Demand	Anodyne	NOD1	48	31
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc(CC)cc34)CC2)c1	ZINC000450633839	GG	On-Demand	Anodyne	P2RY12	36	49
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc(CC)cc34)CC2)c1	ZINC000450633839	GG	On-Demand	Anodyne	SIRT3	71	35
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc(CC)cc34)CC2)c1	ZINC000450633839	GG	On-Demand	Anodyne	SIRT2	61	34
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc(CC)cc34)CC2)c1	ZINC000450633839	GG	On-Demand	Anodyne	SIRT1	54	34
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc(CC)cc34)CC2)c1	ZINC000450633839	GG	On-Demand	Anodyne	MAP3K7	46	33
CC(C)(C[C@@H]1CCCN(c2nccc(OCc3ccccc3)n2)C1)C(N)=O	ZINC000450633843	FG	On-Demand	Anodyne	PREP	45	34
CC(C)(C[C@H]1CCCN(c2nccc(OCc3ccccc3)n2)C1)C(N)=O	ZINC000450633844	FG	On-Demand	Anodyne	PREP	45	34
N#CC1(CSc2nnc(-c3c[nH]c4ccccc34)o2)CCC1	ZINC000450633845	DI	On-Demand	Mild	ALOX15	49	35
CC(C)(C[C@H]1CCCN(c2ccnc(C(=O)NCc3ccccc3)c2)C1)C(N)=O	ZINC000450633846	GG	On-Demand	Anodyne	PPARA	0	40
CC(C)(C[C@@H]1CCCN(c2ccnc(C(=O)NCc3ccccc3)c2)C1)C(N)=O	ZINC000450633847	GG	On-Demand	Anodyne	PPARA	0	40
CC(C)(C[C@H]1CCCN(c2ccc(C(F)(F)F)cc2C#N)C1)C(N)=O	ZINC000450633851	FH	On-Demand	Mild	LIPG	60	41
CC(C)(C[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2C#N)C1)C(N)=O	ZINC000450633852	FH	On-Demand	Mild	LIPG	60	41
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccnc(OC(F)F)c1	ZINC000450633853	GD	On-Demand	Anodyne	SCN10A	20	43
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccnc(OC(F)F)c1	ZINC000450633853	GD	On-Demand	Anodyne	STAT6	43	32
CO[C@@]1(CNC(=O)c2ccc(I)cc2F)CCOC1	ZINC000450633856	GD	On-Demand	Anodyne	MAP2K1	46	32
CO[C@]1(CNC(=O)c2ccc(I)cc2F)CCOC1	ZINC000450633857	GD	On-Demand	Anodyne	MAP2K1	46	32
CCOC(=O)c1cnn(C2CCN(c3cccc(C)c3[N+](=O)[O-])CC2)c1	ZINC000450633865	FG	On-Demand	Bother	P2RY12	43	36
CCOC(=O)c1cnn(C2CCN(c3cccc(C)c3[N+](=O)[O-])CC2)c1	ZINC000450633865	FG	On-Demand	Bother	MAP3K7	47	39
Cc1cc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)ncn1	ZINC000450633879	CD	On-Demand	Anodyne	SIRT3	43	32
Cc1cc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)ncn1	ZINC000450633880	CD	On-Demand	Anodyne	SIRT3	43	32
COc1ccc2nc(C)nc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450633888	FG	On-Demand	Anodyne	PDE3B	51	36
COc1ccc2nc(C)nc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450633889	FG	On-Demand	Anodyne	PDE3B	51	36
CN1CCN(c2cc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncn2)CC1=O	ZINC000450633890	FC	On-Demand	Anodyne	SIRT3	48	32
CN1CCN(c2cc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncn2)CC1=O	ZINC000450633891	FC	On-Demand	Anodyne	SIRT3	48	32
c1ccc(CC[C@@H]2CCCCN2Cc2cn(CC3CC3)nn2)cc1	ZINC000450633896	DH	On-Demand	Anodyne	SLC18A2	48	40
c1ccc(CC[C@H]2CCCCN2Cc2cn(CC3CC3)nn2)cc1	ZINC000450633897	DH	On-Demand	Anodyne	SLC18A2	48	40
Cn1ncc(Br)c1C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450633899	GD	On-Demand	Anodyne	P2RX7	20	44
CCCc1nc(C)c(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)o1	ZINC000450633906	GI	On-Demand	Anodyne	GSK3B	19	45
CCCc1nc(C)c(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)o1	ZINC000450633906	GI	On-Demand	Anodyne	GSK3A	48	43
CCCc1nc(C)c(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)o1	ZINC000450633906	GI	On-Demand	Anodyne	PIK3CG	0	52
CCCc1nc(C)c(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)o1	ZINC000450633906	GI	On-Demand	Anodyne	TERT	0	40
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450633908	FE	On-Demand	Anodyne	CDK1	18	42
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450633908	FE	On-Demand	Anodyne	CALCA	0	41
COc1cc(CC(=O)N2CC[C@@H]2C(C)C)ccc1O	ZINC000450633918	CE	On-Demand	Anodyne	OPRK1	35	44
COc1cc(CC(=O)N2CC[C@@H]2C(C)C)ccc1O	ZINC000450633918	CE	On-Demand	Anodyne	TRPV1	24	46
COc1cc(CC(=O)N2CC[C@@H]2C(C)C)ccc1O	ZINC000450633918	CE	On-Demand	Anodyne	NCE103	25	48
COc1cc(CC(=O)N2CC[C@@H]2C(C)C)ccc1O	ZINC000450633918	CE	On-Demand	Anodyne	RORC	43	33
COc1cc(CC(=O)N2CC[C@H]2C(C)C)ccc1O	ZINC000450633919	CE	On-Demand	Anodyne	OPRK1	35	44
COc1cc(CC(=O)N2CC[C@H]2C(C)C)ccc1O	ZINC000450633919	CE	On-Demand	Anodyne	TRPV1	24	46
COc1cc(CC(=O)N2CC[C@H]2C(C)C)ccc1O	ZINC000450633919	CE	On-Demand	Anodyne	NCE103	25	48
COc1cc(CC(=O)N2CC[C@H]2C(C)C)ccc1O	ZINC000450633919	CE	On-Demand	Anodyne	RORC	43	33
O=C1CC[C@@H](CN2CCCC[C@H]2CCc2ccccc2)CCN1	ZINC000450633920	DG	On-Demand	Anodyne	SLC18A2	47	39
O=C1CC[C@H](CN2CCCC[C@H]2CCc2ccccc2)CCN1	ZINC000450633921	DG	On-Demand	Anodyne	SLC18A2	47	39
O=C1CC[C@H](CN2CCCC[C@@H]2CCc2ccccc2)CCN1	ZINC000450633922	DG	On-Demand	Anodyne	SLC18A2	47	39
O=C1CC[C@@H](CN2CCCC[C@@H]2CCc2ccccc2)CCN1	ZINC000450633923	DG	On-Demand	Anodyne	SLC18A2	47	39
CCCOc1cccc2c(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ccnc12	ZINC000450633924	GH	On-Demand	Anodyne	CHRNA4	28	46
COC(=O)c1ccc(CN2CCc3ccsc3C2)cc1Cl	ZINC000450633925	DH	On-Demand	Anodyne	ABCG2	28	43
COC(=O)c1ccc(CN2CCc3ccsc3C2)cc1Cl	ZINC000450633925	DH	On-Demand	Anodyne	NOD2	45	39
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633938	GG	On-Demand	Anodyne	DRD4	24	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633938	GG	On-Demand	Anodyne	SSTR5	32	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633938	GG	On-Demand	Anodyne	ADAM17	20	42
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633939	GG	On-Demand	Anodyne	DRD4	24	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633939	GG	On-Demand	Anodyne	SSTR5	32	42
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633939	GG	On-Demand	Anodyne	ADAM17	20	42
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633940	GG	On-Demand	Anodyne	DRD4	24	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633940	GG	On-Demand	Anodyne	SSTR5	32	42
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633940	GG	On-Demand	Anodyne	ADAM17	20	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633941	GG	On-Demand	Anodyne	DRD4	24	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633941	GG	On-Demand	Anodyne	SSTR5	32	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450633941	GG	On-Demand	Anodyne	ADAM17	20	42
Cc1nc(C)c(F)c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450633944	DE	On-Demand	Anodyne	CHRNA4	30	48
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cccc(F)c2C#N)CC1	ZINC000450633946	GH	On-Demand	Mild	KCNA3	16	40
CSc1cncc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450633947	DD	On-Demand	Anodyne	CHRNA4	30	47
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncncc2Cl)C1	ZINC000450633948	DD	On-Demand	Anodyne	CHRNA4	30	52
CC(C)[C@@H]1CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450633959	DH	On-Demand	Anodyne	COLA	40	36
CC(C)[C@H]1CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450633960	DH	On-Demand	Anodyne	COLA	40	36
COc1ccc(C[C@@H](C)CN(C)CC2CC(F)(F)C2)cc1	ZINC000450633961	CH	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(C[C@H](C)CN(C)CC2CC(F)(F)C2)cc1	ZINC000450633962	CH	On-Demand	Anodyne	PSMB8	44	31
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc(C3CC3)ns2)C1	ZINC000450633963	DE	On-Demand	Anodyne	CHRNA4	30	47
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncccc2OCc2ccccc2)C1	ZINC000450633964	FG	On-Demand	Anodyne	CHRNA4	31	54
Cc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2cc(OC(F)F)ccc2n1	ZINC000450633971	GH	On-Demand	Anodyne	CHRNA4	26	40
CC(C)(O)CN(Cc1ccccc1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450633993	GG	On-Demand	Anodyne	PPIA	25	41
CC(C)(O)CN(Cc1ccccc1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450633993	GG	On-Demand	Anodyne	LIMK2	24	45
CC(C)(C[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1)C(N)=O	ZINC000450633994	EI	On-Demand	Anodyne	HRP1_PLAFA	113	40
CC(C)(C[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1)C(N)=O	ZINC000450633994	EI	On-Demand	Anodyne	HNMT	53	37
CC(C)(C[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1)C(N)=O	ZINC000450633995	EI	On-Demand	Anodyne	HRP1_PLAFA	113	40
CC(C)(C[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1)C(N)=O	ZINC000450633995	EI	On-Demand	Anodyne	HNMT	53	37
CC(C)(C[C@H]1CCCN(c2c(Cl)cccc2C#N)C1)C(N)=O	ZINC000450633996	DG	On-Demand	Mild	DPP4	28	42
CC(C)(C[C@@H]1CCCN(c2c(Cl)cccc2C#N)C1)C(N)=O	ZINC000450633997	DG	On-Demand	Mild	DPP4	28	42
C[C@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccccc1	ZINC000450633998	EG	On-Demand	Anodyne	PTGDR2	22	43
C[C@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccccc1	ZINC000450633998	EG	On-Demand	Anodyne	TLR7	41	36
C[C@@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccccc1	ZINC000450633999	EG	On-Demand	Anodyne	PTGDR2	22	43
C[C@@H](O)CCSc1nc2ccccc2c(=O)n1Cc1ccccc1	ZINC000450633999	EG	On-Demand	Anodyne	TLR7	41	36
CCC[C@@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634001	CF	On-Demand	Anodyne	CTSK	0	41
CCC[C@@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634001	CF	On-Demand	Anodyne	NOD1	40	31
CCC[C@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634002	CF	On-Demand	Anodyne	CTSK	0	41
CCC[C@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634002	CF	On-Demand	Anodyne	NOD1	40	31
CCC[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)C(=O)OC(C)(C)C	ZINC000450634003	EG	On-Demand	Anodyne	GPR88	0	45
CC(C)(C[C@H]1CCCN(c2cc(C#N)ccc2C(F)(F)F)C1)C(N)=O	ZINC000450634005	FH	On-Demand	Mild	GPBAR1	22	41
CC(C)(C[C@H]1CCCN(c2cc(C#N)ccc2C(F)(F)F)C1)C(N)=O	ZINC000450634005	FH	On-Demand	Mild	ERG	0	41
CC(C)(C[C@@H]1CCCN(c2cc(C#N)ccc2C(F)(F)F)C1)C(N)=O	ZINC000450634006	FH	On-Demand	Mild	GPBAR1	22	41
CC(C)(C[C@@H]1CCCN(c2cc(C#N)ccc2C(F)(F)F)C1)C(N)=O	ZINC000450634006	FH	On-Demand	Mild	ERG	0	41
CCC[C@@H](NC(=O)c1ccc(C(C)(F)F)nc1)C(=O)OC(C)(C)C	ZINC000450634008	EG	On-Demand	Anodyne	CTRB_BOVIN	44	31
CCC[C@H](NC(=O)c1ccc(C(C)(F)F)nc1)C(=O)OC(C)(C)C	ZINC000450634009	EG	On-Demand	Anodyne	CTRB_BOVIN	44	31
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(OC)CCOC2)nc1	ZINC000450634010	FE	On-Demand	Anodyne	KCNA3	42	36
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(OC)CCOC2)nc1	ZINC000450634010	FE	On-Demand	Anodyne	HCN1	56	35
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(OC)CCOC2)nc1	ZINC000450634010	FE	On-Demand	Anodyne	HCN4	47	33
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(OC)CCOC2)nc1	ZINC000450634011	FE	On-Demand	Anodyne	KCNA3	42	36
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(OC)CCOC2)nc1	ZINC000450634011	FE	On-Demand	Anodyne	HCN1	56	35
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(OC)CCOC2)nc1	ZINC000450634011	FE	On-Demand	Anodyne	HCN4	47	33
COC(=O)c1ccc(CN2CCN3C(=O)NC(=O)[C@H]3C2)cc1Cl	ZINC000450634014	EC	On-Demand	Anodyne	DRD4	44	38
COC(=O)c1ccc(CN2CCN3C(=O)NC(=O)[C@H]3C2)cc1Cl	ZINC000450634014	EC	On-Demand	Anodyne	MLNR	44	34
COC(=O)c1ccc(CN2CCN3C(=O)NC(=O)[C@@H]3C2)cc1Cl	ZINC000450634015	EC	On-Demand	Anodyne	DRD4	44	38
COC(=O)c1ccc(CN2CCN3C(=O)NC(=O)[C@@H]3C2)cc1Cl	ZINC000450634015	EC	On-Demand	Anodyne	MLNR	44	34
Cc1cc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c2cc(F)ccc2n1	ZINC000450634018	EH	On-Demand	Anodyne	DHODH	52	37
Cc1cc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c2cc(F)ccc2n1	ZINC000450634018	EH	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	35
Cc1cc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)c2cc(F)ccc2n1	ZINC000450634019	EH	On-Demand	Anodyne	DHODH	52	37
Cc1cc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)c2cc(F)ccc2n1	ZINC000450634019	EH	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	35
CCOC(=O)c1cnn(C2CCN(c3ccnc4cc(F)ccc34)CC2)c1	ZINC000450634026	FH	On-Demand	Anodyne	SSTR5	40	35
CCOC(=O)c1cnn(C2CCN(c3ccnc4c([N+](=O)[O-])cccc34)CC2)c1	ZINC000450634027	GG	On-Demand	Bother	MAP3K7	40	36
C[C@@H](C(=O)C1CCCCC1)n1cnc2c1c(=O)n(C)c(=O)n2C	ZINC000450634034	DD	On-Demand	Anodyne	ADORA2A	0	48
C[C@H](C(=O)C1CCCCC1)n1cnc2c1c(=O)n(C)c(=O)n2C	ZINC000450634035	DD	On-Demand	Anodyne	ADORA2A	0	48
Cc1cc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c2cccc([N+](=O)[O-])c2n1	ZINC000450634036	FH	On-Demand	Bother	PRKCQ	44	36
Cc1cc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)c2cccc([N+](=O)[O-])c2n1	ZINC000450634037	FH	On-Demand	Bother	PRKCQ	44	36
CC(=O)N[C@H](C(=O)NCCc1nnc(-c2ccccc2)n1C)C(C)(C)C	ZINC000450634038	FD	On-Demand	Anodyne	CTSV	45	32
CC(=O)N[C@H](C(=O)NCCc1nnc(-c2ccccc2)n1C)C(C)(C)C	ZINC000450634038	FD	On-Demand	Anodyne	GAG-PRO	46	34
CC(=O)CCCCCSc1nnc(-c2c[nH]c3ccccc23)o1	ZINC000450634039	EI	On-Demand	Anodyne	ALOX15	62	37
CC(C)c1nccc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450634042	DF	On-Demand	Anodyne	SORD	108	43
CC(C)c1nccc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450634043	DF	On-Demand	Anodyne	SORD	108	43
CCS(=O)(=O)c1ccc(CN(C)CCCn2ccnc2)cc1	ZINC000450634046	DE	On-Demand	Anodyne	TBXAS1	39	41
COc1cc(CN(C)CCCn2ccnc2)ccc1Cl	ZINC000450634065	CG	On-Demand	Anodyne	CYP19A1	25	42
COc1cc(CN(C)CCCn2ccnc2)ccc1Cl	ZINC000450634065	CG	On-Demand	Anodyne	HMOX2	47	34
COc1cc(CN(C)CCCn2ccnc2)ccc1Cl	ZINC000450634065	CG	On-Demand	Anodyne	QPCT	39	48
CC(C)(C[C@H]1CCCN(c2c(C#N)cnc3ccc(Cl)cc23)C1)C(N)=O	ZINC000450634069	FH	On-Demand	Mild	DPP4	22	41
CC(C)(C[C@@H]1CCCN(c2c(C#N)cnc3ccc(Cl)cc23)C1)C(N)=O	ZINC000450634070	FH	On-Demand	Mild	DPP4	22	41
CCOC(=O)c1cnn(C2CCN(c3nc(C)cc(C(F)(F)F)n3)CC2)c1	ZINC000450634071	GG	On-Demand	Anodyne	P2RY12	46	35
CCOC(=O)c1cnn(C2CCN(c3nc4ccccc4c(C)c3C#N)CC2)c1	ZINC000450634072	GH	On-Demand	Mild	P2RY12	61	42
Cc1cc(Cl)c2ncc(C#N)c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634073	GI	On-Demand	Mild	MAP3K8	40	33
Cc1cc(Cl)c2ncc(C#N)c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634074	GI	On-Demand	Mild	MAP3K8	40	33
CCCC[C@@H](NC(=O)Cn1ccc(C)n1)C(=O)OC(C)(C)C	ZINC000450634076	DE	On-Demand	Anodyne	NOD1	47	34
CCCC[C@H](NC(=O)Cn1ccc(C)n1)C(=O)OC(C)(C)C	ZINC000450634077	DE	On-Demand	Anodyne	NOD1	47	34
CCOC(=O)c1cnn(C2CCN(c3ccnc(C)c3)CC2)c1	ZINC000450634079	DF	On-Demand	Anodyne	MAP3K7	46	33
CCCC[C@@H](NC(=O)c1ccc(C#N)n1C)C(=O)OC(C)(C)C	ZINC000450634080	DF	On-Demand	Mild	PAPA1_CARPA	42	34
CCCC[C@@H](NC(=O)c1ccc(C#N)n1C)C(=O)OC(C)(C)C	ZINC000450634080	DF	On-Demand	Mild	CTRB_BOVIN	48	33
CCCC[C@H](NC(=O)c1ccc(C#N)n1C)C(=O)OC(C)(C)C	ZINC000450634081	DF	On-Demand	Mild	PAPA1_CARPA	42	34
CCCC[C@H](NC(=O)c1ccc(C#N)n1C)C(=O)OC(C)(C)C	ZINC000450634081	DF	On-Demand	Mild	CTRB_BOVIN	48	33
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(C)cccc34)CC2)c1	ZINC000450634086	FG	On-Demand	Anodyne	P2RY12	41	38
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(C)cccc34)CC2)c1	ZINC000450634086	FG	On-Demand	Anodyne	SIRT3	40	33
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(C)cccc34)CC2)c1	ZINC000450634086	FG	On-Demand	Anodyne	SIRT1	40	33
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(C)cccc34)CC2)c1	ZINC000450634086	FG	On-Demand	Anodyne	MAP3K7	41	33
CCCC[C@H](NC(=O)c1nn(C)c2c1CCCC2)C(=O)OC(C)(C)C	ZINC000450634087	EF	On-Demand	Anodyne	CTSK	0	40
CCCC[C@@H](NC(=O)c1nn(C)c2c1CCCC2)C(=O)OC(C)(C)C	ZINC000450634088	EF	On-Demand	Anodyne	CTSK	0	40
CSc1ccc2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634089	FG	On-Demand	Anodyne	PDE3A	44	34
CSc1ccc2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634089	FG	On-Demand	Anodyne	PDE3B	65	34
CSc1ccc2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634089	FG	On-Demand	Anodyne	SIRT3	74	37
CSc1ccc2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634089	FG	On-Demand	Anodyne	SIRT2	72	37
CSc1ccc2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634089	FG	On-Demand	Anodyne	SIRT1	58	36
CSc1ccc2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634090	FG	On-Demand	Anodyne	PDE3A	44	34
CSc1ccc2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634090	FG	On-Demand	Anodyne	PDE3B	65	34
CSc1ccc2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634090	FG	On-Demand	Anodyne	SIRT3	74	37
CSc1ccc2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634090	FG	On-Demand	Anodyne	SIRT2	72	37
CSc1ccc2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450634090	FG	On-Demand	Anodyne	SIRT1	58	36
CCCCn1c(SCc2nc(C(=O)OC)co2)nc2ccccc2c1=O	ZINC000450634098	FG	On-Demand	Anodyne	PTGDR2	15	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450634099	FG	On-Demand	Anodyne	DRD4	19	51
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450634100	FG	On-Demand	Anodyne	DRD4	19	51
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450634101	FG	On-Demand	Anodyne	DRD4	19	51
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450634102	FG	On-Demand	Anodyne	DRD4	19	51
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000450634116	FF	On-Demand	Bother	CHRNA4	27	48
COC(=O)c1cc(Cl)cc(Cl)c1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000450634119	GH	On-Demand	Anodyne	CHRNA4	28	46
CC(C)OC(=O)CCCNC(=O)[C@H]1CC1(F)F	ZINC000450634133	BD	On-Demand	Anodyne	EPHX2	36	51
CC(C)OC(=O)CCCNC(=O)[C@@H]1CC1(F)F	ZINC000450634134	BD	On-Demand	Anodyne	EPHX2	36	51
COCCOC[C@@H](O)CN1CCCC[C@@H]1CCc1ccccc1	ZINC000450634136	DE	On-Demand	Anodyne	FKBP1A	41	35
COCCOC[C@@H](O)CN1CCCC[C@@H]1CCc1ccccc1	ZINC000450634136	DE	On-Demand	Anodyne	SLC18A2	100	47
COCCOC[C@@H](O)CN1CCCC[C@@H]1CCc1ccccc1	ZINC000450634136	DE	On-Demand	Anodyne	ABCB1	39	41
COCCOC[C@@H](O)CN1CCCC[C@H]1CCc1ccccc1	ZINC000450634137	DE	On-Demand	Anodyne	FKBP1A	41	35
COCCOC[C@@H](O)CN1CCCC[C@H]1CCc1ccccc1	ZINC000450634137	DE	On-Demand	Anodyne	SLC18A2	100	47
COCCOC[C@@H](O)CN1CCCC[C@H]1CCc1ccccc1	ZINC000450634137	DE	On-Demand	Anodyne	ABCB1	39	41
COCCOC[C@H](O)CN1CCCC[C@H]1CCc1ccccc1	ZINC000450634138	DE	On-Demand	Anodyne	FKBP1A	41	35
COCCOC[C@H](O)CN1CCCC[C@H]1CCc1ccccc1	ZINC000450634138	DE	On-Demand	Anodyne	SLC18A2	100	47
COCCOC[C@H](O)CN1CCCC[C@H]1CCc1ccccc1	ZINC000450634138	DE	On-Demand	Anodyne	ABCB1	39	41
COCCOC[C@H](O)CN1CCCC[C@@H]1CCc1ccccc1	ZINC000450634139	DE	On-Demand	Anodyne	FKBP1A	41	35
COCCOC[C@H](O)CN1CCCC[C@@H]1CCc1ccccc1	ZINC000450634139	DE	On-Demand	Anodyne	SLC18A2	100	47
COCCOC[C@H](O)CN1CCCC[C@@H]1CCc1ccccc1	ZINC000450634139	DE	On-Demand	Anodyne	ABCB1	39	41
CCOCc1nc(C)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)s1	ZINC000450634141	FG	On-Demand	Anodyne	DRD4	16	48
CCOCc1nc(C)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)s1	ZINC000450634142	FG	On-Demand	Anodyne	DRD4	16	48
CCOCc1nc(C)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)s1	ZINC000450634143	FG	On-Demand	Anodyne	DRD4	16	48
CCOCc1nc(C)c(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)s1	ZINC000450634144	FG	On-Demand	Anodyne	DRD4	16	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634145	GG	On-Demand	Bother	DRD4	18	46
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634145	GG	On-Demand	Bother	ACHE	19	50
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634145	GG	On-Demand	Bother	SIGMAR1	21	52
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634145	GG	On-Demand	Bother	CACNA1D	48	35
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634145	GG	On-Demand	Bother	LUXR	16	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634146	GG	On-Demand	Bother	DRD4	18	46
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634146	GG	On-Demand	Bother	ACHE	19	50
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634146	GG	On-Demand	Bother	SIGMAR1	21	52
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634146	GG	On-Demand	Bother	CACNA1D	48	35
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634146	GG	On-Demand	Bother	LUXR	16	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634147	GG	On-Demand	Bother	DRD4	18	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634147	GG	On-Demand	Bother	ACHE	19	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634147	GG	On-Demand	Bother	SIGMAR1	21	52
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634147	GG	On-Demand	Bother	CACNA1D	48	35
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634147	GG	On-Demand	Bother	LUXR	16	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634148	GG	On-Demand	Bother	DRD4	18	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634148	GG	On-Demand	Bother	ACHE	19	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634148	GG	On-Demand	Bother	SIGMAR1	21	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634148	GG	On-Demand	Bother	CACNA1D	48	35
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450634148	GG	On-Demand	Bother	LUXR	16	40
CC(C)[C@H]1CCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450634151	DG	On-Demand	Anodyne	OPRK1	25	42
CC(C)[C@@H]1CCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450634152	DG	On-Demand	Anodyne	OPRK1	25	42
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1cncc(Cl)c1	ZINC000450634153	FE	On-Demand	Anodyne	SCN2A	20	42
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1cncc(Cl)c1	ZINC000450634153	FE	On-Demand	Anodyne	CDK1	18	46
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1cncc(Cl)c1	ZINC000450634153	FE	On-Demand	Anodyne	SCN10A	36	42
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1cncc(Cl)c1	ZINC000450634153	FE	On-Demand	Anodyne	CALCA	0	42
CCS(=O)(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1	ZINC000450634157	GG	On-Demand	Anodyne	ABCB1	0	43
CCS(=O)(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1	ZINC000450634157	GG	On-Demand	Anodyne	NOD2	42	38
CSc1ccc(C)c(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450634158	DH	On-Demand	Anodyne	HDAC1	36	43
CCc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc2n1	ZINC000450634171	EH	On-Demand	Anodyne	CHRNA4	29	49
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450634174	GI	On-Demand	Anodyne	CHRNA4	27	43
COc1cccc(OCCC(=O)Nc2ccc3c(c2)N(C)CC3)c1	ZINC000450634177	EG	On-Demand	Anodyne	DRD4	45	35
COc1cccc(OCCC(=O)Nc2ccc3c(c2)N(C)CC3)c1	ZINC000450634177	EG	On-Demand	Anodyne	HRH2	33	42
COc1cccc(OCCC(=O)Nc2ccc3c(c2)N(C)CC3)c1	ZINC000450634177	EG	On-Demand	Anodyne	MTNR1A	38	46
COc1cccc(OCCC(=O)Nc2ccc3c(c2)N(C)CC3)c1	ZINC000450634177	EG	On-Demand	Anodyne	MTNR1B	37	42
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cncc(C)n2)CC1	ZINC000450634178	FF	On-Demand	Anodyne	KCNA3	21	41
CC(C)(C[C@H]1CCCN(c2ccc(C(F)(F)F)c(C#N)n2)C1)C(N)=O	ZINC000450634219	FG	On-Demand	Mild	GPBAR1	23	40
CC(C)(C[C@H]1CCCN(c2ccc(C(F)(F)F)c(C#N)n2)C1)C(N)=O	ZINC000450634219	FG	On-Demand	Mild	ERG	0	40
CC(C)(C[C@@H]1CCCN(c2ccc(C(F)(F)F)c(C#N)n2)C1)C(N)=O	ZINC000450634220	FG	On-Demand	Mild	GPBAR1	23	40
CC(C)(C[C@@H]1CCCN(c2ccc(C(F)(F)F)c(C#N)n2)C1)C(N)=O	ZINC000450634220	FG	On-Demand	Mild	ERG	0	40
CCC(=O)C1(C(=O)N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)CC1	ZINC000450634230	EH	On-Demand	Anodyne	GRIN2B	25	41
CCC(=O)C1(C(=O)N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)CC1	ZINC000450634231	EH	On-Demand	Anodyne	GRIN2B	25	41
COC(=O)c1ccc(CN2CC(c3nc4ccccc4s3)C2)cc1Cl	ZINC000450634237	FI	On-Demand	Anodyne	DRD4	25	40
COC(=O)c1ccc(CN2CC(c3nc4ccccc4s3)C2)cc1Cl	ZINC000450634237	FI	On-Demand	Anodyne	LTA4H	24	43
COC(=O)c1ccc(CN2CC(c3nc4ccccc4s3)C2)cc1Cl	ZINC000450634237	FI	On-Demand	Anodyne	SSTR5	32	41
COC(=O)c1ccc(CN2CC(c3nc4ccccc4s3)C2)cc1Cl	ZINC000450634237	FI	On-Demand	Anodyne	CCR3	23	47
COC(=O)c1ccc(CN2CC(c3nc4ccccc4s3)C2)cc1Cl	ZINC000450634237	FI	On-Demand	Anodyne	S1PR3	25	40
COC(=O)c1ccc(CN2CC(c3nc4ccccc4s3)C2)cc1Cl	ZINC000450634237	FI	On-Demand	Anodyne	S1PR1	20	40
CC(C)(C[C@@H]1CCCN(c2cc(-c3ccccc3)nc3ncnn23)C1)C(N)=O	ZINC000450634242	GF	On-Demand	Anodyne	VCP	55	36
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cc(C)ncn2)CC1	ZINC000450634244	FF	On-Demand	Anodyne	KCNA3	16	40
CC(C)(C[C@H]1CCCN(c2cc(-c3ccccc3)nc3ncnn23)C1)C(N)=O	ZINC000450634245	GF	On-Demand	Anodyne	VCP	55	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]1C(C)C	ZINC000450634250	CH	On-Demand	Anodyne	CACNA1B	44	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]1C(C)C	ZINC000450634250	CH	On-Demand	Anodyne	LIPG	52	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]1C(C)C	ZINC000450634256	CH	On-Demand	Anodyne	CACNA1B	44	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]1C(C)C	ZINC000450634256	CH	On-Demand	Anodyne	LIPG	52	37
CCOC(=O)c1cnn(C2CCN(c3nc(C)nc4[nH]ccc34)CC2)c1	ZINC000450634265	FE	On-Demand	Anodyne	P2RY12	44	37
CCOC(=O)c1cnn(C2CCN(c3nc(C)nc4[nH]ccc34)CC2)c1	ZINC000450634265	FE	On-Demand	Anodyne	JAK1	65	37
CCOC(=O)c1cnn(C2CCN(c3nc(C)nc4[nH]ccc34)CC2)c1	ZINC000450634265	FE	On-Demand	Anodyne	MTOR	41	38
CCc1cc2c(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ncnc2s1	ZINC000450634269	FG	On-Demand	Anodyne	CHRNA4	28	45
CC(F)(F)C(C)(C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450634274	FF	On-Demand	Anodyne	BACE2	22	40
CC(F)(F)C(C)(C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450634274	FF	On-Demand	Anodyne	CDK1	22	42
CC(F)(F)C(C)(C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450634274	FF	On-Demand	Anodyne	CDK4	23	42
CC(F)(F)C(C)(C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450634274	FF	On-Demand	Anodyne	CALCA	0	40
COc1ccc(C[C@@H](C)CN(C)C[C@@](C)(O)C(C)=O)cc1	ZINC000450634275	CE	On-Demand	Anodyne	PSMB8	48	34
COc1ccc(C[C@@H](C)CN(C)C[C@](C)(O)C(C)=O)cc1	ZINC000450634276	CE	On-Demand	Anodyne	PSMB8	48	34
COc1ccc(C[C@H](C)CN(C)C[C@](C)(O)C(C)=O)cc1	ZINC000450634277	CE	On-Demand	Anodyne	PSMB8	48	34
COc1ccc(C[C@H](C)CN(C)C[C@@](C)(O)C(C)=O)cc1	ZINC000450634278	CE	On-Demand	Anodyne	PSMB8	48	34
CO[C@]1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CCOC1	ZINC000450634282	GE	On-Demand	Anodyne	HCN1	71	36
CO[C@]1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CCOC1	ZINC000450634282	GE	On-Demand	Anodyne	HCN4	49	32
CO[C@@]1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CCOC1	ZINC000450634296	GE	On-Demand	Anodyne	HCN1	71	36
CO[C@@]1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CCOC1	ZINC000450634296	GE	On-Demand	Anodyne	HCN4	49	32
Cc1cc(C#N)cc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450634299	DE	On-Demand	Mild	ERG	0	42
Cc1cc(C#N)cc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450634300	DE	On-Demand	Mild	ERG	0	42
CC(C)c1ccc(CC2CCN(C(=O)C3(CF)CCOCC3)CC2)cc1	ZINC000450634310	FI	On-Demand	Anodyne	FKBP1A	16	45
CCC[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C(=O)OC(C)(C)C	ZINC000450634312	EF	On-Demand	Anodyne	MMP13	0	40
CCC[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C(=O)OC(C)(C)C	ZINC000450634313	EF	On-Demand	Anodyne	MMP13	0	40
CC(C)(C[C@H]1CCCN(c2ccnc3c([N+](=O)[O-])cccc23)C1)C(N)=O	ZINC000450634317	FG	On-Demand	Bother	PRKCQ	48	35
CC(C)(C[C@@H]1CCCN(c2ccnc3c([N+](=O)[O-])cccc23)C1)C(N)=O	ZINC000450634318	FG	On-Demand	Bother	PRKCQ	48	35
Cc1cccc(Cl)c1C(=O)NCC1([C@@H](O)C(C)C)CC1	ZINC000450634321	CG	On-Demand	Anodyne	P2RX7	15	41
Cc1cccc(Cl)c1C(=O)NCC1([C@H](O)C(C)C)CC1	ZINC000450634322	CG	On-Demand	Anodyne	P2RX7	15	41
CCCC[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634323	GH	On-Demand	Mild	PAPA1_CARPA	40	35
CCCC[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634323	GH	On-Demand	Mild	CTSK	22	40
CCCC[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634323	GH	On-Demand	Mild	CTRB_BOVIN	63	38
CCCC[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634324	GH	On-Demand	Mild	PAPA1_CARPA	40	35
CCCC[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634324	GH	On-Demand	Mild	CTSK	22	40
CCCC[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634324	GH	On-Demand	Mild	CTRB_BOVIN	63	38
CC[S@](=O)CC(=O)N1CC[C@@H](Cc2ccc(C(C)C)cc2)C1	ZINC000450634325	DF	On-Demand	Anodyne	GRIN2B	20	42
CC[S@@](=O)CC(=O)N1CC[C@@H](Cc2ccc(C(C)C)cc2)C1	ZINC000450634326	DF	On-Demand	Anodyne	GRIN2B	20	42
CC[S@@](=O)CC(=O)N1CC[C@H](Cc2ccc(C(C)C)cc2)C1	ZINC000450634327	DF	On-Demand	Anodyne	GRIN2B	20	42
CC[S@](=O)CC(=O)N1CC[C@H](Cc2ccc(C(C)C)cc2)C1	ZINC000450634328	DF	On-Demand	Anodyne	GRIN2B	20	42
CCCC[C@@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634329	DF	On-Demand	Anodyne	SSTR2	43	32
CCCC[C@@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634329	DF	On-Demand	Anodyne	CTSK	34	44
CCCC[C@@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634329	DF	On-Demand	Anodyne	NOD1	86	36
CC(C)OC(=O)CCCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450634330	EG	On-Demand	Anodyne	ROCK2	31	40
Cc1ccccc1-n1c(SCC[C@H](C)O)nnc1-c1ccncc1	ZINC000450634331	EH	On-Demand	Anodyne	SLC6A9	0	41
Cc1ccccc1-n1c(SCC[C@H](C)O)nnc1-c1ccncc1	ZINC000450634331	EH	On-Demand	Anodyne	SLC6A5	23	41
Cc1ccccc1-n1c(SCC[C@@H](C)O)nnc1-c1ccncc1	ZINC000450634332	EH	On-Demand	Anodyne	SLC6A9	0	41
Cc1ccccc1-n1c(SCC[C@@H](C)O)nnc1-c1ccncc1	ZINC000450634332	EH	On-Demand	Anodyne	SLC6A5	23	41
CCCC[C@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634355	DF	On-Demand	Anodyne	SSTR2	43	32
CCCC[C@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634355	DF	On-Demand	Anodyne	CTSK	34	44
CCCC[C@H](NC(=O)CSC1CC1)C(=O)OC(C)(C)C	ZINC000450634355	DF	On-Demand	Anodyne	NOD1	86	36
Cc1ccc(F)c(Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1	ZINC000450634356	DC	On-Demand	Anodyne	MAOB	0	40
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450634357	FF	On-Demand	Anodyne	P2RX7	23	50
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(SC)cc34)CC2)c1	ZINC000450634361	GH	On-Demand	Anodyne	PDE3A	44	36
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(SC)cc34)CC2)c1	ZINC000450634361	GH	On-Demand	Anodyne	PDGFRB	32	44
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(SC)cc34)CC2)c1	ZINC000450634361	GH	On-Demand	Anodyne	PDE3B	66	36
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(SC)cc34)CC2)c1	ZINC000450634361	GH	On-Demand	Anodyne	SIRT3	82	36
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(SC)cc34)CC2)c1	ZINC000450634361	GH	On-Demand	Anodyne	SIRT2	71	36
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(SC)cc34)CC2)c1	ZINC000450634361	GH	On-Demand	Anodyne	SIRT1	63	36
Cc1cnc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nc1-c1ccccc1F	ZINC000450634365	FH	On-Demand	Anodyne	GPBAR1	0	41
Cc1cnc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nc1-c1ccccc1F	ZINC000450634366	FH	On-Demand	Anodyne	GPBAR1	0	41
CCOc1nc2ccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)cc2[nH]1	ZINC000450634370	GE	On-Demand	Anodyne	SCN10A	20	40
CCOc1nc2ccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)cc2[nH]1	ZINC000450634370	GE	On-Demand	Anodyne	STAT6	48	32
Cc1sccc1C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450634387	DF	On-Demand	Anodyne	P2RX7	0	50
CC(C)OC(=O)CCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450634388	EF	On-Demand	Anodyne	CTSV	44	31
CCOC(=O)C1([S@@](C)=O)CCN(c2nc(NC)c3ccccc3n2)CC1	ZINC000450634393	GD	On-Demand	Anodyne	HTR3A	15	51
CCOC(=O)C1([S@](C)=O)CCN(c2nc(NC)c3ccccc3n2)CC1	ZINC000450634394	GD	On-Demand	Anodyne	HTR3A	15	51
CC(C)CC(CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450634395	FH	On-Demand	Anodyne	ANPEP	44	41
CC(C)CC(CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450634395	FH	On-Demand	Anodyne	CAPN1	58	38
CC(C)CC(CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450634395	FH	On-Demand	Anodyne	CAPN2	90	38
CC(C)CC(CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450634395	FH	On-Demand	Anodyne	NPR	58	36
CC(C)CC(CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450634395	FH	On-Demand	Anodyne	AMP1_PLAFQ	26	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCCC(=O)C1CC1	ZINC000450634405	EF	On-Demand	Anodyne	DRD3	0	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCCC(=O)C1CC1	ZINC000450634407	EF	On-Demand	Anodyne	DRD3	0	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCCC(=O)C1CC1	ZINC000450634408	EF	On-Demand	Anodyne	DRD3	0	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCCC(=O)C1CC1	ZINC000450634409	EF	On-Demand	Anodyne	DRD3	0	49
COc1cccc(OCCC(=O)N(Cc2ccccc2)CC(C)(C)O)c1	ZINC000450634411	FG	On-Demand	Anodyne	ACHE	0	42
COc1cccc(OCCC(=O)N(Cc2ccccc2)CC(C)(C)O)c1	ZINC000450634411	FG	On-Demand	Anodyne	MTNR1A	27	43
COc1cccc(OCCC(=O)N(Cc2ccccc2)CC(C)(C)O)c1	ZINC000450634411	FG	On-Demand	Anodyne	HSD17B2	19	44
COc1cccc(OCCC(=O)N(Cc2ccccc2)CC(C)(C)O)c1	ZINC000450634411	FG	On-Demand	Anodyne	TSPAN17	0	40
COc1cccc(OCCC(=O)N(Cc2ccccc2)CC(C)(C)O)c1	ZINC000450634411	FG	On-Demand	Anodyne	CRTM	44	35
COc1cccc(OCCC(=O)N(Cc2ccccc2)CC(C)(C)O)c1	ZINC000450634411	FG	On-Demand	Anodyne	PTGES	23	42
COc1cccc(OCCC(=O)N(Cc2ccccc2)CC(C)(C)O)c1	ZINC000450634411	FG	On-Demand	Anodyne	PDS	42	40
CCCC[C@@H](NC(=O)c1cc(C)c(C(N)=O)cn1)C(=O)OC(C)(C)C	ZINC000450634416	EE	On-Demand	Anodyne	CTSK	24	43
CCCC[C@H](NC(=O)c1cc(C)c(C(N)=O)cn1)C(=O)OC(C)(C)C	ZINC000450634418	EE	On-Demand	Anodyne	CTSK	24	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450634429	FH	On-Demand	Anodyne	HRP1_PLAFA	95	34
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450634429	FH	On-Demand	Anodyne	CHRNA4	28	48
CN(CCN1CC[C@H](N2CCCC2=O)C1)Cc1ccccc1	ZINC000450634432	DD	On-Demand	Anodyne	SIGMAR1	40	44
CN(CCN1CC[C@H](N2CCCC2=O)C1)Cc1ccccc1	ZINC000450634432	DD	On-Demand	Anodyne	PDE11A	54	34
CN(CCN1CC[C@@H](N2CCCC2=O)C1)Cc1ccccc1	ZINC000450634434	DD	On-Demand	Anodyne	SIGMAR1	40	44
CN(CCN1CC[C@@H](N2CCCC2=O)C1)Cc1ccccc1	ZINC000450634434	DD	On-Demand	Anodyne	PDE11A	54	34
CCc1ncnc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)c1F	ZINC000450634437	DE	On-Demand	Anodyne	SIRT3	49	32
CCc1ncnc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c1F	ZINC000450634438	DE	On-Demand	Anodyne	SIRT3	49	32
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634440	FF	On-Demand	Anodyne	PDE3A	57	44
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634440	FF	On-Demand	Anodyne	PDGFRB	74	42
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634440	FF	On-Demand	Anodyne	PDE3B	83	44
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634440	FF	On-Demand	Anodyne	SIRT3	57	34
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634440	FF	On-Demand	Anodyne	SIRT2	53	34
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634440	FF	On-Demand	Anodyne	SIRT1	51	33
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634441	FF	On-Demand	Anodyne	PDE3A	57	44
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634441	FF	On-Demand	Anodyne	PDGFRB	74	42
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634441	FF	On-Demand	Anodyne	PDE3B	83	44
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634441	FF	On-Demand	Anodyne	SIRT3	57	34
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634441	FF	On-Demand	Anodyne	SIRT2	53	34
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2cc1F	ZINC000450634441	FF	On-Demand	Anodyne	SIRT1	51	33
CCOC(=O)c1cnn(C2CCN(c3ncnc4c3oc3ccccc34)CC2)c1	ZINC000450634442	GH	On-Demand	Anodyne	MAP3K7	50	35
CC(C)(C[C@@H]1CCCN(c2ccnc(Cc3ccccc3)n2)C1)C(N)=O	ZINC000450634450	FG	On-Demand	Anodyne	PREP	40	34
CC(C)(C[C@@H]1CCCN(c2ccnc(Cc3ccccc3)n2)C1)C(N)=O	ZINC000450634450	FG	On-Demand	Anodyne	SORD	45	37
CC(C)(C[C@H]1CCCN(c2ccnc(Cc3ccccc3)n2)C1)C(N)=O	ZINC000450634451	FG	On-Demand	Anodyne	PREP	40	34
CC(C)(C[C@H]1CCCN(c2ccnc(Cc3ccccc3)n2)C1)C(N)=O	ZINC000450634451	FG	On-Demand	Anodyne	SORD	45	37
CC(C)(C[C@H]1CCCN(c2nc(-c3cccc(Cl)c3)no2)C1)C(N)=O	ZINC000450634452	FH	On-Demand	Anodyne	GRM5	32	51
CC(C)(C[C@@H]1CCCN(c2nc(-c3cccc(Cl)c3)no2)C1)C(N)=O	ZINC000450634453	FH	On-Demand	Anodyne	GRM5	32	51
CC(C)(C[C@H]1CCCN(c2nc3cc(C(F)(F)F)ccc3s2)C1)C(N)=O	ZINC000450634454	GI	On-Demand	Anodyne	LIPG	40	32
CC(C)(C[C@@H]1CCCN(c2nc3cc(C(F)(F)F)ccc3s2)C1)C(N)=O	ZINC000450634455	GI	On-Demand	Anodyne	LIPG	40	32
CC(C)c1ccc(C[C@@H]2CCN(C(=O)CC3CC(F)(F)C3)C2)cc1	ZINC000450634463	EJ	On-Demand	Anodyne	GRIN2B	28	40
CC(C)c1ccc(C[C@H]2CCN(C(=O)CC3CC(F)(F)C3)C2)cc1	ZINC000450634464	EJ	On-Demand	Anodyne	GRIN2B	28	40
CCSc1cccnc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450634469	GE	On-Demand	Anodyne	SCN10A	21	43
CCSc1cccnc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450634469	GE	On-Demand	Anodyne	STAT6	49	33
CCOC(=O)c1cnn(C2CCN(c3ccc(C#N)c(Cl)c3)CC2)c1	ZINC000450634472	FG	On-Demand	Mild	PGR	20	40
CCOC(=O)c1cnn(C2CCN(c3ccc(C#N)c(Cl)c3)CC2)c1	ZINC000450634472	FG	On-Demand	Mild	P2RY12	63	42
CC1=C(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)CCC(C)(C)C1	ZINC000450634473	FG	On-Demand	Anodyne	STAT6	49	33
CCOC(=O)c1cnn(C2CCN(c3cc(Cl)ccc3C#N)CC2)c1	ZINC000450634474	FG	On-Demand	Mild	P2RY12	62	46
Cc1cccc2c1O[C@H](C(=O)NCc1cnc(N3CCOCC3)c(F)c1)C2	ZINC000450634475	FD	On-Demand	Anodyne	STAT6	43	33
Cc1cccc2c1O[C@@H](C(=O)NCc1cnc(N3CCOCC3)c(F)c1)C2	ZINC000450634476	FD	On-Demand	Anodyne	STAT6	43	33
CCOC(=O)c1cnn(C2CCN(c3ncncc3Cl)CC2)c1	ZINC000450634479	EE	On-Demand	Anodyne	P2RY12	34	44
CCCC[C@H](NC(=O)c1ccc2nccnc2n1)C(=O)OC(C)(C)C	ZINC000450634483	EF	On-Demand	Anodyne	CTSK	33	43
CCCC[C@@H](NC(=O)c1ccc2nccnc2n1)C(=O)OC(C)(C)C	ZINC000450634484	EF	On-Demand	Anodyne	CTSK	33	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nccc3c([N+](=O)[O-])cccc23)C1	ZINC000450634496	FF	On-Demand	Bother	CHRNA4	27	44
CC(C)Cc1nsc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450634499	EF	On-Demand	Anodyne	CHRNA4	37	46
CCOC(=O)c1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)ncc1Cl	ZINC000450634528	FF	On-Demand	Anodyne	CHRNA4	28	46
CC(C)(C)Oc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)ccc1[N+](=O)[O-]	ZINC000450634531	GH	On-Demand	Bother	CHRNA4	26	42
CC(C)(C)c1nsc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450634535	EF	On-Demand	Anodyne	CHRNA4	36	46
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncnc3sc4ccccc4c23)C1	ZINC000450634536	FH	On-Demand	Anodyne	CHRNA4	27	44
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc(C(F)(F)F)ns2)C1	ZINC000450634537	EE	On-Demand	Anodyne	CHRNA4	36	45
Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450634540	EE	On-Demand	Bother	CHRNA4	27	43
CC(C)C[C@@H]1C[C@H]1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450634541	FF	On-Demand	Anodyne	CDK4	22	40
COC(=O)c1csc(CN2CCc3ccc(Cl)cc3C2)n1	ZINC000450634542	DG	On-Demand	Anodyne	ABCB1B	40	31
COC(=O)c1csc(CN2CCc3ccc(Cl)cc3C2)n1	ZINC000450634542	DG	On-Demand	Anodyne	NOD1	30	40
COC(=O)c1csc(CN2CCc3ccc(Cl)cc3C2)n1	ZINC000450634542	DG	On-Demand	Anodyne	NOD2	44	40
COC(=O)c1csc(CN2CCc3ccc(Cl)cc3C2)n1	ZINC000450634542	DG	On-Demand	Anodyne	TRPC6	40	38
COc1cc(-c2nnc(SCC3=CCCCC3)o2)cc(OC)c1OC	ZINC000450634547	FI	On-Demand	Anodyne	GSK3B	16	43
COc1cc(-c2nnc(SCC3=CCCCC3)o2)cc(OC)c1OC	ZINC000450634547	FI	On-Demand	Anodyne	GSK3A	43	41
CC(C)[C@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634551	DF	On-Demand	Anodyne	CCKAR	25	40
CC(C)[C@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634551	DF	On-Demand	Anodyne	CCKBR	22	40
CC(C)[C@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634551	DF	On-Demand	Anodyne	EPHX2	26	46
CC(C)[C@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634551	DF	On-Demand	Anodyne	MCHR1	23	41
CC(C)[C@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634551	DF	On-Demand	Anodyne	CACNA1I	27	43
CC(C)[C@@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634552	DF	On-Demand	Anodyne	CCKAR	25	40
CC(C)[C@@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634552	DF	On-Demand	Anodyne	CCKBR	22	40
CC(C)[C@@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634552	DF	On-Demand	Anodyne	EPHX2	26	46
CC(C)[C@@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634552	DF	On-Demand	Anodyne	MCHR1	23	41
CC(C)[C@@H]1CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450634552	DF	On-Demand	Anodyne	CACNA1I	27	43
COc1ccc(-c2noc(CN3CCCC[C@H]3CCc3ccccc3)n2)nn1	ZINC000450634554	GH	On-Demand	Anodyne	SLC18A2	58	37
COc1ccc(-c2noc(CN3CCCC[C@@H]3CCc3ccccc3)n2)nn1	ZINC000450634555	GH	On-Demand	Anodyne	SLC18A2	58	37
COC(=O)c1coc(CN(C)C[C@H](C)Cc2ccc(OC)cc2)n1	ZINC000450634558	EF	On-Demand	Anodyne	PSMB8	46	33
COC(=O)c1coc(CN(C)C[C@@H](C)Cc2ccc(OC)cc2)n1	ZINC000450634559	EF	On-Demand	Anodyne	PSMB8	46	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450634562	FF	On-Demand	Anodyne	ACE	44	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450634562	FF	On-Demand	Anodyne	DRD3	0	54
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450634562	FF	On-Demand	Anodyne	MME	56	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450634563	FF	On-Demand	Anodyne	ACE	44	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450634563	FF	On-Demand	Anodyne	DRD3	0	54
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450634563	FF	On-Demand	Anodyne	MME	56	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450634564	FF	On-Demand	Anodyne	ACE	44	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450634564	FF	On-Demand	Anodyne	DRD3	0	54
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450634564	FF	On-Demand	Anodyne	MME	56	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450634565	FF	On-Demand	Anodyne	ACE	44	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450634565	FF	On-Demand	Anodyne	DRD3	0	54
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450634565	FF	On-Demand	Anodyne	MME	56	35
CCS(=O)(=O)c1ccc(CN(C)C[C@@H](C)Cc2ccc(OC)cc2)cc1	ZINC000450634566	GH	On-Demand	Anodyne	BMP1	64	41
CCS(=O)(=O)c1ccc(CN(C)C[C@@H](C)Cc2ccc(OC)cc2)cc1	ZINC000450634566	GH	On-Demand	Anodyne	MMP13	22	46
CCS(=O)(=O)c1ccc(CN(C)C[C@@H](C)Cc2ccc(OC)cc2)cc1	ZINC000450634566	GH	On-Demand	Anodyne	MMP3	22	42
CCS(=O)(=O)c1ccc(CN(C)C[C@H](C)Cc2ccc(OC)cc2)cc1	ZINC000450634567	GH	On-Demand	Anodyne	BMP1	64	41
CCS(=O)(=O)c1ccc(CN(C)C[C@H](C)Cc2ccc(OC)cc2)cc1	ZINC000450634567	GH	On-Demand	Anodyne	MMP13	22	46
CCS(=O)(=O)c1ccc(CN(C)C[C@H](C)Cc2ccc(OC)cc2)cc1	ZINC000450634567	GH	On-Demand	Anodyne	MMP3	22	42
CC[C@H]1CN(Cc2cc(Cl)cc(CN3C[C@H](O)[C@H](CC)C3)c2)C[C@@H]1O	ZINC000450634570	FF	On-Demand	Anodyne	MTAP	0	40
CC[C@@H]1CN(Cc2cc(Cl)cc(CN3C[C@H](O)[C@H](CC)C3)c2)C[C@@H]1O	ZINC000450634571	FF	On-Demand	Anodyne	MTAP	0	40
CC[C@@H]1CN(Cc2cc(Cl)cc(CN3C[C@H](O)[C@H](CC)C3)c2)C[C@H]1O	ZINC000450634572	FF	On-Demand	Anodyne	MTAP	0	40
CC[C@H]1CN(Cc2cc(Cl)cc(CN3C[C@@H](O)[C@H](CC)C3)c2)C[C@@H]1O	ZINC000450634573	FF	On-Demand	Anodyne	MTAP	0	40
CCC(=O)CCCN1CCc2ccc(Cl)cc2C1	ZINC000450634575	CG	On-Demand	Anodyne	CHRNA6	0	45
CCC(=O)CCCN1CCc2ccc(Cl)cc2C1	ZINC000450634575	CG	On-Demand	Anodyne	HSD17B3	41	38
CC(C)N1CCN(C2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)CC1	ZINC000450634576	FF	On-Demand	Anodyne	SLC18A3	15	41
CC(C)N1CCN(C2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)CC1	ZINC000450634577	FF	On-Demand	Anodyne	SLC18A3	15	41
CC(C)N1CCN(C2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)CC1	ZINC000450634578	FF	On-Demand	Anodyne	SLC18A3	15	41
CC(C)N1CCN(C2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)CC1	ZINC000450634579	FF	On-Demand	Anodyne	SLC18A3	15	41
CC(C)OC(=O)CCCNC(=O)C1(C(=O)C2CC2)CC1	ZINC000450634580	CD	On-Demand	Anodyne	EPHX2	20	45
CCOC(=O)c1cnn(C2CCN(c3ccc(S(=O)(=O)NC)cn3)CC2)c1	ZINC000450634596	GD	On-Demand	Anodyne	P2RY12	36	43
CC(F)(F)C(C)(C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450634601	EE	On-Demand	Anodyne	STAT6	57	36
CCC[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC(C)(C)C	ZINC000450634602	DG	On-Demand	Anodyne	P2RY12	42	33
CCC[C@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC(C)(C)C	ZINC000450634603	DG	On-Demand	Anodyne	P2RY12	42	33
CCOc1cc(C(=O)N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)on1	ZINC000450634610	EH	On-Demand	Anodyne	GRIN2B	36	41
CCOc1cc(C(=O)N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)on1	ZINC000450634611	EH	On-Demand	Anodyne	GRIN2B	36	41
CCOC(=O)c1cnn(C2CCN(c3c(C#N)cccc3C#N)CC2)c1	ZINC000450634622	EF	On-Demand	Mild	P2RY12	58	42
CCOC(=O)c1cnn(C2CCN(c3nccc4c(OC)cccc34)CC2)c1	ZINC000450634631	GG	On-Demand	Anodyne	PDE3B	58	34
CCOC(=O)c1cnn(C2CCN(c3nccc4c(OC)cccc34)CC2)c1	ZINC000450634631	GG	On-Demand	Anodyne	MAP3K7	46	32
CO[C@@]1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCOC1	ZINC000450634632	CD	On-Demand	Anodyne	HCN1	60	36
CO[C@@]1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCOC1	ZINC000450634632	CD	On-Demand	Anodyne	HCN4	48	32
CO[C@]1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCOC1	ZINC000450634633	CD	On-Demand	Anodyne	HCN1	60	36
CO[C@]1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCOC1	ZINC000450634633	CD	On-Demand	Anodyne	HCN4	48	32
CO[C@@]1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCOC1	ZINC000450634634	CD	On-Demand	Anodyne	HCN1	60	36
CO[C@@]1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCOC1	ZINC000450634634	CD	On-Demand	Anodyne	HCN4	48	32
CO[C@]1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCOC1	ZINC000450634635	CD	On-Demand	Anodyne	HCN1	60	36
CO[C@]1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCOC1	ZINC000450634635	CD	On-Demand	Anodyne	HCN4	48	32
Cc1[nH]c(C#N)cc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450634641	ED	On-Demand	Mild	STAT6	43	32
CCOC(=O)c1cnn(C2CCN(c3ncccc3S(C)(=O)=O)CC2)c1	ZINC000450634644	GD	On-Demand	Anodyne	P2RY12	35	41
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3c(C)csc23)CC1	ZINC000450634648	FE	On-Demand	Anodyne	SIRT3	48	34
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3c(C)csc23)CC1	ZINC000450634649	FE	On-Demand	Anodyne	SIRT3	48	34
CCOC(=O)c1cnn(C2CCN(c3ncnc4nc(N)ccc34)CC2)c1	ZINC000450634661	FD	On-Demand	Anodyne	MTOR	26	40
CCOC(=O)c1cnn(C2CCN(c3ncnc4nc(N)ccc34)CC2)c1	ZINC000450634661	FD	On-Demand	Anodyne	SIRT3	41	31
CCOC(=O)c1cnn(C2CCN(c3ncnc4nc(N)ccc34)CC2)c1	ZINC000450634661	FD	On-Demand	Anodyne	SIRT1	41	31
CCOC(=O)c1cnn(C2CCN(c3ncnc4nc(N)ccc34)CC2)c1	ZINC000450634661	FD	On-Demand	Anodyne	MAP3K7	42	33
CC(C)(C[C@H]1CCCN(c2ccc3c(Cl)cccc3n2)C1)C(N)=O	ZINC000450634665	EI	On-Demand	Anodyne	GPBAR1	21	41
CC(C)(C[C@@H]1CCCN(c2ccc3c(Cl)cccc3n2)C1)C(N)=O	ZINC000450634666	EI	On-Demand	Anodyne	GPBAR1	21	41
CCCC[C@H](NC(=O)[C@H]1CCCN(C)C1=O)C(=O)OC(C)(C)C	ZINC000450634680	ED	On-Demand	Anodyne	SSTR2	57	38
CCCC[C@H](NC(=O)[C@H]1CCCN(C)C1=O)C(=O)OC(C)(C)C	ZINC000450634680	ED	On-Demand	Anodyne	CTSK	0	42
CCCC[C@H](NC(=O)[C@@H]1CCCN(C)C1=O)C(=O)OC(C)(C)C	ZINC000450634682	ED	On-Demand	Anodyne	SSTR2	57	38
CCCC[C@H](NC(=O)[C@@H]1CCCN(C)C1=O)C(=O)OC(C)(C)C	ZINC000450634682	ED	On-Demand	Anodyne	CTSK	0	42
CCOC(=O)c1cnn(C2CCN(c3nc(C)nc4c3cnn4C)CC2)c1	ZINC000450634689	FD	On-Demand	Anodyne	PIK3CA	23	40
CCOC(=O)c1cnn(C2CCN(c3nc(C)nc4c3cnn4C)CC2)c1	ZINC000450634689	FD	On-Demand	Anodyne	MTOR	58	40
CC(C)(C[C@H]1CCCN(c2ncnc3c(F)cccc23)C1)C(N)=O	ZINC000450634690	EF	On-Demand	Anodyne	ABCC1	53	37
CC(C)(C[C@H]1CCCN(c2ncnc3c(F)cccc23)C1)C(N)=O	ZINC000450634690	EF	On-Demand	Anodyne	SIRT3	51	32
CC(C)(C[C@H]1CCCN(c2ncnc3c(F)cccc23)C1)C(N)=O	ZINC000450634690	EF	On-Demand	Anodyne	SIRT2	51	32
CC(C)(C[C@H]1CCCN(c2ncnc3c(F)cccc23)C1)C(N)=O	ZINC000450634690	EF	On-Demand	Anodyne	SIRT1	51	32
CC(C)(C[C@@H]1CCCN(c2ncnc3c(F)cccc23)C1)C(N)=O	ZINC000450634691	EF	On-Demand	Anodyne	ABCC1	53	37
CC(C)(C[C@@H]1CCCN(c2ncnc3c(F)cccc23)C1)C(N)=O	ZINC000450634691	EF	On-Demand	Anodyne	SIRT3	51	32
CC(C)(C[C@@H]1CCCN(c2ncnc3c(F)cccc23)C1)C(N)=O	ZINC000450634691	EF	On-Demand	Anodyne	SIRT2	51	32
CC(C)(C[C@@H]1CCCN(c2ncnc3c(F)cccc23)C1)C(N)=O	ZINC000450634691	EF	On-Demand	Anodyne	SIRT1	51	32
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	OPRM1	31	45
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	OPRD1	30	45
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	TACR1	0	43
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	BMP1	54	32
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	PFDN6	0	41
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	MMP14	43	33
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	PAM	0	48
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	PROTEASE	0	51
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	PSENEN	0	49
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	POL	0	46
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	RHODESAIN	0	41
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	SLC15A2	0	41
CCC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634692	EF	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	OPRM1	31	45
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	OPRD1	30	45
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	TACR1	0	43
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	BMP1	54	32
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	PFDN6	0	41
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	MMP14	43	33
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	PAM	0	48
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	PROTEASE	0	51
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	PSENEN	0	49
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	POL	0	46
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	RHODESAIN	0	41
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	SLC15A2	0	41
CCC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634693	EF	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450634702	GG	On-Demand	Bother	CHRNA4	27	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ncccc2F)CC1	ZINC000450634705	EF	On-Demand	Anodyne	DRD4	24	47
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ncccc2F)CC1	ZINC000450634705	EF	On-Demand	Anodyne	SORD	43	39
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ncccc2F)CC1	ZINC000450634706	EF	On-Demand	Anodyne	DRD4	24	47
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ncccc2F)CC1	ZINC000450634706	EF	On-Demand	Anodyne	SORD	43	39
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncccc2F)CC1	ZINC000450634707	EF	On-Demand	Anodyne	DRD4	24	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncccc2F)CC1	ZINC000450634707	EF	On-Demand	Anodyne	SORD	43	39
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncccc2F)CC1	ZINC000450634708	EF	On-Demand	Anodyne	DRD4	24	47
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncccc2F)CC1	ZINC000450634708	EF	On-Demand	Anodyne	SORD	43	39
Cc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2cccc([N+](=O)[O-])c2n1	ZINC000450634710	GG	On-Demand	Bother	CHRNA4	26	41
CCN=c1nc(NC(C)(C)C)[nH]c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450634719	GD	On-Demand	Anodyne	CHRNA4	26	41
CC(C)Oc1ccc2nccc(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1	ZINC000450634722	GH	On-Demand	Anodyne	CHRNA4	26	41
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc3cc(F)ccc3o2)CC1	ZINC000450634723	GH	On-Demand	Anodyne	NPBWR1	40	38
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450634726	FF	On-Demand	Bother	CHRNA4	27	42
CC(C)CCCC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450634729	EF	On-Demand	Anodyne	BACE2	0	40
CC(C)CCCC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450634729	EF	On-Demand	Anodyne	CDK4	24	45
O=C(CCCN1CCc2ccsc2C1)c1ccc(F)cc1	ZINC000450634730	DH	On-Demand	Anodyne	DRD2	32	47
O=C(CCCN1CCc2ccsc2C1)c1ccc(F)cc1	ZINC000450634730	DH	On-Demand	Anodyne	DRD4	15	52
O=C(CCCN1CCc2ccsc2C1)c1ccc(F)cc1	ZINC000450634730	DH	On-Demand	Anodyne	HTR2A	25	54
O=C(CCCN1CCc2ccsc2C1)c1ccc(F)cc1	ZINC000450634730	DH	On-Demand	Anodyne	ERG2	21	47
O=C(CCCN1CCc2ccsc2C1)c1ccc(F)cc1	ZINC000450634730	DH	On-Demand	Anodyne	HTR5A	19	54
O=C(CCCN1CCc2ccsc2C1)c1ccc(F)cc1	ZINC000450634730	DH	On-Demand	Anodyne	SLC18A3	0	51
O=C(CCCN1CCc2ccsc2C1)c1ccc(F)cc1	ZINC000450634730	DH	On-Demand	Anodyne	CYP2J2	49	34
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634732	FG	On-Demand	Anodyne	DRD4	19	51
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634732	FG	On-Demand	Anodyne	ADAM17	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634732	FG	On-Demand	Anodyne	SLC6A5	19	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634733	FG	On-Demand	Anodyne	DRD4	19	51
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634733	FG	On-Demand	Anodyne	ADAM17	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634733	FG	On-Demand	Anodyne	SLC6A5	19	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634734	FG	On-Demand	Anodyne	DRD4	19	51
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634734	FG	On-Demand	Anodyne	ADAM17	22	43
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634734	FG	On-Demand	Anodyne	SLC6A5	19	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634735	FG	On-Demand	Anodyne	DRD4	19	51
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634735	FG	On-Demand	Anodyne	ADAM17	22	43
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450634735	FG	On-Demand	Anodyne	SLC6A5	19	40
Cn1c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc2c(F)cccc21	ZINC000450634736	EE	On-Demand	Anodyne	CHRNA4	42	52
CC[C@@H]1CN(Cc2ccccc2OC2CC2)C[C@@H]1O	ZINC000450634737	CE	On-Demand	Anodyne	SLC5A4	62	36
CC[C@@H]1CN(Cc2ccccc2OC2CC2)C[C@H]1O	ZINC000450634738	CE	On-Demand	Anodyne	SLC5A4	62	36
CC[C@H]1CN(Cc2ccccc2OC2CC2)C[C@H]1O	ZINC000450634739	CE	On-Demand	Anodyne	SLC5A4	62	36
CC[C@H]1CN(Cc2ccccc2OC2CC2)C[C@@H]1O	ZINC000450634740	CE	On-Demand	Anodyne	SLC5A4	62	36
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncnc3c2CCCCC3)C1	ZINC000450634741	EF	On-Demand	Anodyne	CHRNA4	38	46
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncnc3c(F)cccc23)C1	ZINC000450634743	EF	On-Demand	Anodyne	CHRNA4	37	48
Cc1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2c3c(sc2n1)CCC3	ZINC000450634745	GG	On-Demand	Anodyne	CHRNA4	26	41
CC(C)[C@@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450634746	DI	On-Demand	Anodyne	RBP4	90	43
CC(C)[C@@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450634746	DI	On-Demand	Anodyne	WNT3	49	32
CC(C)[C@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450634747	DI	On-Demand	Anodyne	RBP4	90	43
CC(C)[C@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450634747	DI	On-Demand	Anodyne	WNT3	49	32
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3ccsc23)CC1	ZINC000450634751	GH	On-Demand	Anodyne	SIRT3	85	37
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3ccsc23)CC1	ZINC000450634751	GH	On-Demand	Anodyne	SIRT2	71	37
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3ccsc23)CC1	ZINC000450634751	GH	On-Demand	Anodyne	SIRT1	63	37
COc1ccc(-c2nnc(SCc3nnc(C4CC4)s3)o2)cc1OC	ZINC000450634755	GH	On-Demand	Anodyne	GSK3B	19	47
COc1ccc(-c2nnc(SCc3nnc(C4CC4)s3)o2)cc1OC	ZINC000450634755	GH	On-Demand	Anodyne	GSK3A	50	43
COc1ccc(-c2nnc(SCc3nnc(C4CC4)s3)o2)cc1OC	ZINC000450634755	GH	On-Demand	Anodyne	TERT	22	40
Cc1ccc(C(=O)N2CC[C@H]2C(C)C)c2c1CCC2	ZINC000450634760	CG	On-Demand	Anodyne	L3MBTL3	41	32
Cc1ccc(C(=O)N2CC[C@@H]2C(C)C)c2c1CCC2	ZINC000450634761	CG	On-Demand	Anodyne	L3MBTL3	41	32
CCS(=O)(=O)c1ccc(CN2CCc3ccc(Cl)cc3C2)cc1	ZINC000450634766	EH	On-Demand	Anodyne	MLNR	22	42
CCS(=O)(=O)c1ccc(CN2CCc3ccc(Cl)cc3C2)cc1	ZINC000450634766	EH	On-Demand	Anodyne	AKR1C3	15	41
CCS(=O)(=O)c1ccc(CN2CCc3ccc(Cl)cc3C2)cc1	ZINC000450634766	EH	On-Demand	Anodyne	NOD1	30	44
CCS(=O)(=O)c1ccc(CN2CCc3ccc(Cl)cc3C2)cc1	ZINC000450634766	EH	On-Demand	Anodyne	NOD2	44	38
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C)nc3[nH]ccc23)CC1	ZINC000450634768	GG	On-Demand	Anodyne	P2RY12	40	36
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C)nc3[nH]ccc23)CC1	ZINC000450634768	GG	On-Demand	Anodyne	AKT2	45	43
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C)nc3[nH]ccc23)CC1	ZINC000450634768	GG	On-Demand	Anodyne	AKT3	31	43
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C)nc3[nH]ccc23)CC1	ZINC000450634768	GG	On-Demand	Anodyne	ROCK2	38	43
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C)nc3[nH]ccc23)CC1	ZINC000450634768	GG	On-Demand	Anodyne	AKT1	35	43
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncccn2)CC1	ZINC000450634777	EF	On-Demand	Anodyne	SLC6A7	0	44
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C)cc(OC)n2)CC1	ZINC000450634778	GF	On-Demand	Anodyne	ALS	67	34
COC(=O)c1csc(CN2CCc3ccsc3C2)n1	ZINC000450634779	CF	On-Demand	Anodyne	NOD2	40	36
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)cc2F)CC1	ZINC000450634780	GH	On-Demand	Mild	NPY2R	70	36
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cncc(Cl)c1	ZINC000450634781	EF	On-Demand	Anodyne	DRD3	0	54
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cncc(Cl)c1	ZINC000450634782	EF	On-Demand	Anodyne	DRD3	0	54
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cncc(Cl)c1	ZINC000450634783	EF	On-Demand	Anodyne	DRD3	0	54
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cncc(Cl)c1	ZINC000450634784	EF	On-Demand	Anodyne	DRD3	0	54
C=CCOc1ccc(CC(=O)N2CC[C@H]2C(C)C)cc1	ZINC000450634791	CG	On-Demand	Mild	OPRK1	0	40
C=CCOc1ccc(CC(=O)N2CC[C@@H]2C(C)C)cc1	ZINC000450634792	CG	On-Demand	Mild	OPRK1	0	40
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	OPRM1	31	45
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	OPRD1	30	45
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	TACR1	0	43
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	BMP1	54	32
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	PFDN6	0	41
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	MMP14	43	33
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	PAM	0	48
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	PROTEASE	0	51
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	PSENEN	0	49
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	POL	0	46
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	RHODESAIN	0	41
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	SLC15A2	0	41
CCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634794	EF	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	OPRM1	31	45
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	OPRD1	30	45
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	TACR1	0	43
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	BMP1	54	32
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	PFDN6	0	41
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	MMP14	43	33
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	PAM	0	48
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	PROTEASE	0	51
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	PSENEN	0	49
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	POL	0	46
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	RHODESAIN	0	41
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	SLC15A2	0	41
CCC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OC(C)(C)C	ZINC000450634795	EF	On-Demand	Anodyne	Q9JN24_ECOLX	0	42
CCOC(=O)c1cnn(C2CCN(c3nc4c(cc3C#N)COCC4)CC2)c1	ZINC000450634800	GE	On-Demand	Mild	P2RY12	58	45
CCOC(=O)c1cnn(C2CCN(c3ncc(Br)cc3C)CC2)c1	ZINC000450634801	GG	On-Demand	Anodyne	P2RY12	30	40
CC(C)(C[C@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1)C(N)=O	ZINC000450634802	GI	On-Demand	Anodyne	LIPG	46	32
CC(C)(C[C@@H]1CCCN(c2nccc3cc(C(F)(F)F)ccc23)C1)C(N)=O	ZINC000450634803	GI	On-Demand	Anodyne	LIPG	46	32
CCOC(=O)c1cnn(C2CCN(c3ccc(C#N)cc3C(F)(F)F)CC2)c1	ZINC000450634805	GH	On-Demand	Mild	P2RY12	54	41
CCOC(=O)c1cnn(C2CCN(c3ccc(C#N)cc3C(F)(F)F)CC2)c1	ZINC000450634805	GH	On-Demand	Mild	LIPG	43	34
COc1ccc(CNC(=O)CCN2CCN3C(=O)NC(=O)[C@@H]3C2)c(OC)c1	ZINC000450634811	GB	On-Demand	Anodyne	HTR7	25	40
COc1ccc(CNC(=O)CCN2CCN3C(=O)NC(=O)[C@H]3C2)c(OC)c1	ZINC000450634812	GB	On-Demand	Anodyne	HTR7	25	40
CCOC(=O)c1cnn(C2CCN(c3nccc4c([N+](=O)[O-])cccc34)CC2)c1	ZINC000450634817	GG	On-Demand	Bother	MAP3K7	42	36
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	CA2	35	47
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	SSTR2	43	40
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	CA1	19	40
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	CTSG	23	41
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	CTSK	26	40
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	CTRB1	27	41
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	CA4	17	40
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	CELA2A	23	41
CCCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634831	GG	On-Demand	Anodyne	CTRB_BOVIN	47	33
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	CA2	35	47
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	SSTR2	43	40
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	CA1	19	40
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	CTSG	23	41
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	CTSK	26	40
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	CTRB1	27	41
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	CA4	17	40
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	CELA2A	23	41
CCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450634832	GG	On-Demand	Anodyne	CTRB_BOVIN	47	33
CN(C)c1nccc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450634834	FD	On-Demand	Anodyne	TRPV1	0	46
CN(C)c1nccc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450634834	FD	On-Demand	Anodyne	PSBA	0	43
CO[C@]1(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)CCOC1	ZINC000450634835	DE	On-Demand	Anodyne	SCN9A	21	40
CO[C@]1(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CCOC1	ZINC000450634836	DE	On-Demand	Anodyne	SCN9A	21	40
CO[C@]1(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CCOC1	ZINC000450634837	DE	On-Demand	Anodyne	SCN9A	21	40
CO[C@]1(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CCOC1	ZINC000450634838	DE	On-Demand	Anodyne	SCN9A	21	40
COCCOC[C@H](O)CN1CC(c2nc3ccccc3s2)C1	ZINC000450634842	DD	On-Demand	Anodyne	ACOX1	51	34
COCCOC[C@@H](O)CN1CC(c2nc3ccccc3s2)C1	ZINC000450634843	DD	On-Demand	Anodyne	ACOX1	51	34
CCC[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634857	GH	On-Demand	Mild	PAPA1_CARPA	45	39
CCC[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634857	GH	On-Demand	Mild	CCR3	0	47
CCC[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634857	GH	On-Demand	Mild	CTRB_BOVIN	60	36
CCC[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634858	GH	On-Demand	Mild	PAPA1_CARPA	45	39
CCC[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634858	GH	On-Demand	Mild	CCR3	0	47
CCC[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OC(C)(C)C	ZINC000450634858	GH	On-Demand	Mild	CTRB_BOVIN	60	36
CC(F)(F)CCSc1nnc(-c2c[nH]c3ccccc23)o1	ZINC000450634859	DI	On-Demand	Anodyne	ALOX15	57	35
FC1(F)CCC[C@H]1CSc1nnc(-c2c[nH]c3ccccc23)o1	ZINC000450634861	EJ	On-Demand	Anodyne	ALOX15	40	36
FC1(F)CCC[C@@H]1CSc1nnc(-c2c[nH]c3ccccc23)o1	ZINC000450634862	EJ	On-Demand	Anodyne	ALOX15	40	36
CCOC(=O)c1cnn(C2CCN(c3ccnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450634865	GH	On-Demand	Anodyne	PDE3A	44	36
CCOC(=O)c1cnn(C2CCN(c3ccnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450634865	GH	On-Demand	Anodyne	PDE3B	65	36
CCOC(=O)c1cnn(C2CCN(c3ccnc4cc(F)c(OC)cc34)CC2)c1	ZINC000450634865	GH	On-Demand	Anodyne	MET	40	35
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4c(F)cccc34)CC2)c1	ZINC000450634868	GH	On-Demand	Anodyne	P2RY12	45	34
C[C@H]1C[C@@H](O)CN1CCN(C)Cc1ccccc1	ZINC000450634875	BD	On-Demand	Anodyne	SIGMAR1	17	42
C[C@@H]1C[C@H](O)CN1CCN(C)Cc1ccccc1	ZINC000450634876	BD	On-Demand	Anodyne	SIGMAR1	17	42
C[C@@H]1C[C@@H](O)CN1CCN(C)Cc1ccccc1	ZINC000450634877	BD	On-Demand	Anodyne	SIGMAR1	17	42
C[C@H]1C[C@H](O)CN1CCN(C)Cc1ccccc1	ZINC000450634878	BD	On-Demand	Anodyne	SIGMAR1	17	42
CNS(=O)(=O)c1ccc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)c(F)c1	ZINC000450634881	FD	On-Demand	Anodyne	SLC6A9	22	41
CNS(=O)(=O)c1ccc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c(F)c1	ZINC000450634882	FD	On-Demand	Anodyne	SLC6A9	22	41
CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)C(=O)OC(C)(C)C	ZINC000450634883	DG	On-Demand	Anodyne	CTSK	23	46
CCCC[C@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)C(=O)OC(C)(C)C	ZINC000450634884	DG	On-Demand	Anodyne	CTSK	23	46
COc1ccc(OC(F)(F)F)c(C(=O)Nc2nncn2C)c1	ZINC000450634885	DD	On-Demand	Anodyne	KCNK3	26	43
COc1ccc(OC(F)(F)F)c(C(=O)Nc2nncn2C)c1	ZINC000450634885	DD	On-Demand	Anodyne	KCNK9	31	43
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cnc3ccccc3n2)CC1	ZINC000450634914	GH	On-Demand	Anodyne	HTR3A	24	49
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cnc3ccccc3n2)CC1	ZINC000450634914	GH	On-Demand	Anodyne	P2RY12	53	37
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cnc3ccccc3n2)CC1	ZINC000450634914	GH	On-Demand	Anodyne	SORD	26	46
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3c(Br)cccc23)C1	ZINC000450634917	GH	On-Demand	Anodyne	CHRNA4	29	48
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450634920	CH	On-Demand	Anodyne	UTS2R	46	33
CC(C)[C@@H]1CCN1C(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450634921	CH	On-Demand	Anodyne	UTS2R	46	33
CC(C)[C@@H]1CCN1C(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450634922	CH	On-Demand	Anodyne	UTS2R	46	33
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450634923	CH	On-Demand	Anodyne	UTS2R	46	33
Cc1ccc(F)c(CC(=O)N2CC[C@H]2C(C)C)c1	ZINC000450634931	BF	On-Demand	Anodyne	DPP4	15	41
Cc1ccc(F)c(CC(=O)N2CC[C@@H]2C(C)C)c1	ZINC000450634932	BF	On-Demand	Anodyne	DPP4	15	41
CC(=O)N[C@H](C(=O)N1CCN(c2cccc(F)c2)C(=O)C1)C(C)(C)C	ZINC000450634945	ED	On-Demand	Anodyne	P2RX7	15	41
CC(C)[C@H]1CCN1C(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450634950	EH	On-Demand	Anodyne	HRH4	21	46
CC(C)[C@@H]1CCN1C(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450634951	EH	On-Demand	Anodyne	HRH4	21	46
COC(=O)c1csc(CN2CCc3c(ccc(OC)c3OC)C2)n1	ZINC000450634957	EF	On-Demand	Anodyne	ABCB1B	46	32
CC(=O)N[C@H](C(=O)NCc1cccc(N2CCCS2(=O)=O)c1)C(C)(C)C	ZINC000450634958	GD	On-Demand	Anodyne	BACE2	23	40
CC(=O)N[C@H](C(=O)NCc1cccc(N2CCCS2(=O)=O)c1)C(C)(C)C	ZINC000450634958	GD	On-Demand	Anodyne	CDK1	20	41
CC(=O)N[C@H](C(=O)NCc1cccc(N2CCCS2(=O)=O)c1)C(C)(C)C	ZINC000450634958	GD	On-Demand	Anodyne	CDK4	22	41
CC[C@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634959	EH	On-Demand	Anodyne	SLC1A1	16	40
CC[C@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634959	EH	On-Demand	Anodyne	SLC1A3	19	40
CC[C@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634959	EH	On-Demand	Anodyne	SLC1A2	28	40
CC[C@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634959	EH	On-Demand	Anodyne	PHES	0	45
CC[C@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634959	EH	On-Demand	Anodyne	PDS	46	38
CC[C@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634960	EH	On-Demand	Anodyne	SLC1A1	16	40
CC[C@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634960	EH	On-Demand	Anodyne	SLC1A3	19	40
CC[C@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634960	EH	On-Demand	Anodyne	SLC1A2	28	40
CC[C@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634960	EH	On-Demand	Anodyne	PHES	0	45
CC[C@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634960	EH	On-Demand	Anodyne	PDS	46	38
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634961	EH	On-Demand	Anodyne	SLC1A1	16	40
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634961	EH	On-Demand	Anodyne	SLC1A3	19	40
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634961	EH	On-Demand	Anodyne	SLC1A2	28	40
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634961	EH	On-Demand	Anodyne	PHES	0	45
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634961	EH	On-Demand	Anodyne	PDS	46	38
CC[C@@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634962	EH	On-Demand	Anodyne	SLC1A1	16	40
CC[C@@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634962	EH	On-Demand	Anodyne	SLC1A3	19	40
CC[C@@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634962	EH	On-Demand	Anodyne	SLC1A2	28	40
CC[C@@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634962	EH	On-Demand	Anodyne	PHES	0	45
CC[C@@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450634962	EH	On-Demand	Anodyne	PDS	46	38
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2c(C#N)cccc2C#N)CC1	ZINC000450634965	GG	On-Demand	Mild	SLC12A5	45	36
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cc(C#N)cc(C)n2)CC1	ZINC000450634966	GG	On-Demand	Mild	P2RY12	64	37
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1ccsn1	ZINC000450634972	ED	On-Demand	Anodyne	CDK1	22	44
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1ccsn1	ZINC000450634972	ED	On-Demand	Anodyne	CDK4	24	44
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1ccsn1	ZINC000450634972	ED	On-Demand	Anodyne	CALCA	0	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nnc(Cc3ccc(Cl)cc3)s2)C1	ZINC000450634984	GH	On-Demand	Anodyne	CHRNA4	31	51
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc3cccc(F)c3s2)C1	ZINC000450634990	EG	On-Demand	Anodyne	CHRNA4	30	47
Cc1cc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)nn1C(C)C	ZINC000450634992	EE	On-Demand	Anodyne	P2RX7	23	46
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450634999	DC	On-Demand	Anodyne	AGTR2	0	42
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450635002	DC	On-Demand	Anodyne	AGTR2	0	42
COc1ccc2c(c1OC)CCN(C[C@H](O)[C@H](C)c1ccccc1)C2	ZINC000450635019	EG	On-Demand	Anodyne	AGTR2	54	39
COc1ccc2c(c1OC)CCN(C[C@@H](O)[C@H](C)c1ccccc1)C2	ZINC000450635020	EG	On-Demand	Anodyne	AGTR2	54	39
COc1ccc2c(c1OC)CCN(C[C@@H](O)[C@@H](C)c1ccccc1)C2	ZINC000450635021	EG	On-Demand	Anodyne	AGTR2	54	39
COc1ccc2c(c1OC)CCN(C[C@H](O)[C@@H](C)c1ccccc1)C2	ZINC000450635022	EG	On-Demand	Anodyne	AGTR2	54	39
CC(C)[C@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635023	CF	On-Demand	Anodyne	ACE	56	39
CC(C)[C@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635023	CF	On-Demand	Anodyne	SLC18A2	42	39
CC(C)[C@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635023	CF	On-Demand	Anodyne	PREP	53	38
CC(C)[C@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635023	CF	On-Demand	Anodyne	AMY2	45	31
CC(C)[C@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635023	CF	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
CC(=O)c1cccc(CN(C)CC2CCN(c3ccncc3)CC2)c1	ZINC000450635027	EH	On-Demand	Anodyne	F10	17	41
CC[C@H]1CN(CCc2ccc(Cl)cc2)CCN1CC(F)F	ZINC000450635062	DH	On-Demand	Anodyne	SIGMAR1	23	41
CC[C@@H]1CN(CCc2ccc(Cl)cc2)CCN1CC(F)F	ZINC000450635063	DH	On-Demand	Anodyne	SIGMAR1	23	41
CC[C@@H](O)CC(=O)Nc1c(C)cccc1F	ZINC000450635068	BE	On-Demand	Anodyne	ACAT	0	42
CC[C@H](O)CC(=O)Nc1c(C)cccc1F	ZINC000450635069	BE	On-Demand	Anodyne	ACAT	0	42
CCCn1ncc(Nc2cc(CC)nc3ncnn23)c1C1CC1	ZINC000450635070	DF	On-Demand	Anodyne	DHOD	0	48
CC(=O)N1CCN(Cc2ccccc2OC2CC2)CC12CCCCC2	ZINC000450635082	EH	On-Demand	Anodyne	HCN1	43	33
CC(=O)N1CCN(Cc2ccccc2OC2CC2)CC12CCCCC2	ZINC000450635082	EH	On-Demand	Anodyne	HCN4	43	33
CC[C@@H](C)[C@@H](O)C(=O)NCc1ccccc1-c1cc(C(=O)OC)n[nH]1	ZINC000450635088	ED	On-Demand	Anodyne	BDKRB1	0	45
CC[C@@H](C)[C@H](O)C(=O)NCc1ccccc1-c1cc(C(=O)OC)n[nH]1	ZINC000450635089	ED	On-Demand	Anodyne	BDKRB1	0	45
CC[C@H](C)[C@@H](O)C(=O)NCc1ccccc1-c1cc(C(=O)OC)n[nH]1	ZINC000450635090	ED	On-Demand	Anodyne	BDKRB1	0	45
CC[C@H](C)[C@H](O)C(=O)NCc1ccccc1-c1cc(C(=O)OC)n[nH]1	ZINC000450635091	ED	On-Demand	Anodyne	BDKRB1	0	45
CN(C)c1nccc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450635104	DD	On-Demand	Anodyne	SORD	40	34
CN(C)c1nccc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450635105	DD	On-Demand	Anodyne	SORD	40	34
Cn1c(=O)c2c(ncn2CCc2c(Cl)cccc2Cl)n(C)c1=O	ZINC000450635106	FD	On-Demand	Anodyne	MAOB	22	42
Cn1c(=O)c2c(ncn2CCc2c(Cl)cccc2Cl)n(C)c1=O	ZINC000450635106	FD	On-Demand	Anodyne	ADORA2A	23	63
CC(C)(C[C@H]1CCCN(c2ncnc3nc(N)ccc23)C1)C(N)=O	ZINC000450635133	ED	On-Demand	Anodyne	SIRT3	42	31
CC(C)(C[C@H]1CCCN(c2ncnc3nc(N)ccc23)C1)C(N)=O	ZINC000450635133	ED	On-Demand	Anodyne	SIRT1	40	32
CC(C)(C[C@@H]1CCCN(c2ncnc3nc(N)ccc23)C1)C(N)=O	ZINC000450635134	ED	On-Demand	Anodyne	SIRT3	42	31
CC(C)(C[C@@H]1CCCN(c2ncnc3nc(N)ccc23)C1)C(N)=O	ZINC000450635134	ED	On-Demand	Anodyne	SIRT1	40	32
CCOC(=O)c1cnn(C2CCN(c3ncnc4n[nH]cc34)CC2)c1	ZINC000450635135	ED	On-Demand	Anodyne	SIRT3	43	32
CCOC(=O)c1cnn(C2CCN(c3ncnc4n[nH]cc34)CC2)c1	ZINC000450635135	ED	On-Demand	Anodyne	SIRT1	42	32
CCOC(=O)c1cnn(C2CCN(c3nc4c(cc3C#N)CCCC4)CC2)c1	ZINC000450635136	GG	On-Demand	Mild	P2RY12	58	43
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(F)cccc34)CC2)c1	ZINC000450635137	FF	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(F)cccc34)CC2)c1	ZINC000450635137	FF	On-Demand	Anodyne	SIRT1	50	33
CN1CC=C(CNC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450635138	CD	On-Demand	Anodyne	HPGDS	19	42
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccc2c(c1)OC(F)(F)O2	ZINC000450635150	GE	On-Demand	Anodyne	SCN10A	15	42
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccc2c(c1)OC(F)(F)O2	ZINC000450635150	GE	On-Demand	Anodyne	STAT6	44	33
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccc2c(c1)OC(F)(F)O2	ZINC000450635150	GE	On-Demand	Anodyne	NAMPT	20	40
CCOC(=O)c1cnn(C2CCN(c3c(Cl)cccc3C#N)CC2)c1	ZINC000450635161	FG	On-Demand	Mild	P2RY12	60	41
CCCC[C@@H](NC(=O)c1ccsc1Br)C(=O)OC(C)(C)C	ZINC000450635162	GI	On-Demand	Anodyne	CTSK	31	44
CCCC[C@H](NC(=O)c1ccsc1Br)C(=O)OC(C)(C)C	ZINC000450635163	GI	On-Demand	Anodyne	CTSK	31	44
CC(C)(C[C@@H]1CCCN(c2nc3ccccc3nc2N2CCCC2)C1)C(N)=O	ZINC000450635167	GG	On-Demand	Anodyne	SIRT3	44	31
CC(C)(C[C@H]1CCCN(c2nc3ccccc3nc2N2CCCC2)C1)C(N)=O	ZINC000450635168	GG	On-Demand	Anodyne	SIRT3	44	31
CC[C@H](CO)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450635169	CF	On-Demand	Anodyne	CHRM5	34	42
CC(C)c1ccc(C[C@@H]2CCN(C(=O)[C@H]3CCCN(C)C3=O)C2)cc1	ZINC000450635173	EG	On-Demand	Anodyne	CCR3	49	35
CC(C)c1ccc(C[C@H]2CCN(C(=O)[C@@H]3CCCN(C)C3=O)C2)cc1	ZINC000450635174	EG	On-Demand	Anodyne	CCR3	49	35
CC(C)c1ccc(C[C@H]2CCN(C(=O)[C@H]3CCCN(C)C3=O)C2)cc1	ZINC000450635175	EG	On-Demand	Anodyne	CCR3	49	35
CC(C)c1ccc(C[C@@H]2CCN(C(=O)[C@@H]3CCCN(C)C3=O)C2)cc1	ZINC000450635176	EG	On-Demand	Anodyne	CCR3	49	35
COc1cc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)ccc1Cl	ZINC000450635182	GF	On-Demand	Anodyne	PDE5A	39	44
COc1cc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)ccc1Cl	ZINC000450635182	GF	On-Demand	Anodyne	P2RY12	15	40
COc1cc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)ccc1Cl	ZINC000450635182	GF	On-Demand	Anodyne	F10	49	34
COc1cc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)ccc1Cl	ZINC000450635182	GF	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)ccc1Cl	ZINC000450635182	GF	On-Demand	Anodyne	P2RX7	50	40
COc1cc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)ccc1Cl	ZINC000450635182	GF	On-Demand	Anodyne	SCN10A	20	42
COc1cc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)ccc1Cl	ZINC000450635182	GF	On-Demand	Anodyne	CXCR3	23	40
COc1cc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)ccc1Cl	ZINC000450635182	GF	On-Demand	Anodyne	STAT6	55	35
CC(C)(C[C@@H]1CCCN(c2ncnc3c2CCCCC3)C1)C(N)=O	ZINC000450635183	EF	On-Demand	Anodyne	SIRT3	49	33
CC(C)(C[C@@H]1CCCN(c2ncnc3c2CCCCC3)C1)C(N)=O	ZINC000450635183	EF	On-Demand	Anodyne	SIRT2	43	33
CC(C)(C[C@H]1CCCN(c2ncnc3c2CCCCC3)C1)C(N)=O	ZINC000450635184	EF	On-Demand	Anodyne	SIRT3	49	33
CC(C)(C[C@H]1CCCN(c2ncnc3c2CCCCC3)C1)C(N)=O	ZINC000450635184	EF	On-Demand	Anodyne	SIRT2	43	33
Cc1ccc(Br)cc1Cn1cnc2c1c(=O)n(C)c(=O)n2C	ZINC000450635188	FD	On-Demand	Anodyne	MAOB	0	43
CCCC[C@@H](NC(=O)c1ccc(C(C)(F)F)nc1)C(=O)OC(C)(C)C	ZINC000450635193	FH	On-Demand	Anodyne	CTRB_BOVIN	47	33
CC(C)[C@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635194	CF	On-Demand	Anodyne	ACE	56	39
CC(C)[C@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635194	CF	On-Demand	Anodyne	SLC18A2	42	39
CC(C)[C@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635194	CF	On-Demand	Anodyne	PREP	53	38
CC(C)[C@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635194	CF	On-Demand	Anodyne	AMY2	45	31
CC(C)[C@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635194	CF	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
CC(C)[C@@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635195	CF	On-Demand	Anodyne	ACE	56	39
CC(C)[C@@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635195	CF	On-Demand	Anodyne	SLC18A2	42	39
CC(C)[C@@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635195	CF	On-Demand	Anodyne	PREP	53	38
CC(C)[C@@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635195	CF	On-Demand	Anodyne	AMY2	45	31
CC(C)[C@@H]1CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450635195	CF	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
CC(C)[C@@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635196	CF	On-Demand	Anodyne	ACE	56	39
CC(C)[C@@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635196	CF	On-Demand	Anodyne	SLC18A2	42	39
CC(C)[C@@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635196	CF	On-Demand	Anodyne	PREP	53	38
CC(C)[C@@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635196	CF	On-Demand	Anodyne	AMY2	45	31
CC(C)[C@@H]1CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450635196	CF	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
Cn1c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc2ccc(F)cc21	ZINC000450635200	EE	On-Demand	Anodyne	CHRNA4	39	52
CCOC(=O)c1ccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc1	ZINC000450635203	EE	On-Demand	Anodyne	CHRNA4	39	51
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450635204	FH	On-Demand	Anodyne	CHRNA4	28	48
CC(C)OC(=O)CCCNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450635205	DF	On-Demand	Anodyne	EPHX2	0	40
Cn1c(C#N)ccc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450635210	FD	On-Demand	Mild	CALCA	0	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc(Br)cc2[N+](=O)[O-])C1	ZINC000450635213	GG	On-Demand	Bother	CHRNA4	28	46
Cc1cc(C(=O)N2CCC(Cc3ccc(C(C)C)cc3)CC2)ncc1C(N)=O	ZINC000450635214	GH	On-Demand	Anodyne	CHRM2	18	46
Cc1cc(C(=O)N2CCC(Cc3ccc(C(C)C)cc3)CC2)ncc1C(N)=O	ZINC000450635214	GH	On-Demand	Anodyne	GRIN2B	56	41
Cc1cc(C(=O)N2CCC(Cc3ccc(C(C)C)cc3)CC2)ncc1C(N)=O	ZINC000450635214	GH	On-Demand	Anodyne	CCR3	17	42
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450635227	DD	On-Demand	Bother	CHRNA4	33	48
Cc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)nn1C(C)C	ZINC000450635234	EG	On-Demand	Anodyne	DRD4	25	52
Cc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)nn1C(C)C	ZINC000450635235	EG	On-Demand	Anodyne	DRD4	25	52
Cc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)nn1C(C)C	ZINC000450635236	EG	On-Demand	Anodyne	DRD4	25	52
Cc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)nn1C(C)C	ZINC000450635237	EG	On-Demand	Anodyne	DRD4	25	52
Clc1ccc(CCN2CCOC[C@H]2C2CC2)cc1	ZINC000450635253	CF	On-Demand	Anodyne	HRH3	0	40
Clc1ccc(CCN2CCOC[C@H]2C2CC2)cc1	ZINC000450635253	CF	On-Demand	Anodyne	CACNA1D	42	40
Clc1ccc(CCN2CCOC[C@@H]2C2CC2)cc1	ZINC000450635254	CF	On-Demand	Anodyne	HRH3	0	40
Clc1ccc(CCN2CCOC[C@@H]2C2CC2)cc1	ZINC000450635254	CF	On-Demand	Anodyne	CACNA1D	42	40
CCCn1c(SCc2cn(C)nc2C)nc2ccccc2c1=O	ZINC000450635259	EG	On-Demand	Anodyne	PTGDR2	15	40
CC(C)(C)C(=O)CCCC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450635264	GF	On-Demand	Anodyne	CDK1	22	44
CC(C)(C)C(=O)CCCC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450635264	GF	On-Demand	Anodyne	CDK4	24	44
COC(=O)c1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)sc1C	ZINC000450635267	EE	On-Demand	Anodyne	CHRNA4	35	47
O=C(CCCN1CCOC[C@H]1C1CC1)c1ccc(F)cc1	ZINC000450635272	CF	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1CCOC[C@H]1C1CC1)c1ccc(F)cc1	ZINC000450635272	CF	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCOC[C@H]1C1CC1)c1ccc(F)cc1	ZINC000450635272	CF	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCOC[C@H]1C1CC1)c1ccc(F)cc1	ZINC000450635272	CF	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1CCOC[C@@H]1C1CC1)c1ccc(F)cc1	ZINC000450635273	CF	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1CCOC[C@@H]1C1CC1)c1ccc(F)cc1	ZINC000450635273	CF	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCOC[C@@H]1C1CC1)c1ccc(F)cc1	ZINC000450635273	CF	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCOC[C@@H]1C1CC1)c1ccc(F)cc1	ZINC000450635273	CF	On-Demand	Anodyne	CYP2J2	51	36
CCOc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)ccc1[N+](=O)[O-]	ZINC000450635281	FF	On-Demand	Bother	CHRNA4	27	42
COc1cc(-c2nnc(SCc3cn(C)nc3C)o2)cc(OC)c1OC	ZINC000450635282	GG	On-Demand	Anodyne	GSK3B	15	42
COc1cc(-c2nnc(SCc3cn(C)nc3C)o2)cc(OC)c1OC	ZINC000450635282	GG	On-Demand	Anodyne	GSK3A	38	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncccc2Cl)CC1	ZINC000450635283	FH	On-Demand	Anodyne	P2RY12	41	46
CN1CCc2ccc(NC(=O)c3ccc(N4CCC4)nc3)cc21	ZINC000450635285	DF	On-Demand	Anodyne	PRNP	47	41
CN1CCc2ccc(NC(=O)c3ccc(N4CCC4)nc3)cc21	ZINC000450635285	DF	On-Demand	Anodyne	HDAC1	0	40
CN1CCc2ccc(NC(=O)c3ccc(N4CCC4)nc3)cc21	ZINC000450635285	DF	On-Demand	Anodyne	DGAT1	41	37
C=CCOc1ccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450635302	FG	On-Demand	Mild	COLA	27	43
C=CCOc1ccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450635302	FG	On-Demand	Mild	CPT1A	24	43
C=CCOc1ccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450635302	FG	On-Demand	Mild	SMO	49	37
C=CCOc1ccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450635302	FG	On-Demand	Mild	ETHR	78	49
COc1ccc([C@H](CO)N(C)C(=O)[C@H]2CC2(F)F)cc1	ZINC000450635313	CD	On-Demand	Anodyne	DXR	24	40
COc1ccc([C@@H](CO)N(C)C(=O)[C@@H]2CC2(F)F)cc1	ZINC000450635314	CD	On-Demand	Anodyne	DXR	24	40
COc1ccc([C@H](CO)N(C)C(=O)[C@@H]2CC2(F)F)cc1	ZINC000450635315	CD	On-Demand	Anodyne	DXR	24	40
COc1ccc([C@@H](CO)N(C)C(=O)[C@H]2CC2(F)F)cc1	ZINC000450635316	CD	On-Demand	Anodyne	DXR	24	40
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	DRD2	32	41
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	DRD1	22	45
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	DRD4	17	48
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	HTR2A	21	44
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	HTR2C	19	47
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	ERG2	19	41
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	SLC18A3	0	42
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	HTR3B	0	41
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	CYP2J2	50	36
CCC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635322	FG	On-Demand	Anodyne	AP2S1	0	41
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	DRD2	32	41
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	DRD1	22	45
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	DRD4	17	48
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	HTR2A	21	44
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	HTR2C	19	47
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	ERG2	19	41
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	SLC18A3	0	42
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	HTR3B	0	41
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	CYP2J2	50	36
CCC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCOC	ZINC000450635323	FG	On-Demand	Anodyne	AP2S1	0	41
Cc1cccc(F)c1NC(=O)CC1(O)CCC1	ZINC000450635335	BE	On-Demand	Anodyne	ACAT	0	40
C(=C\c1ccccc1)\CCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1	ZINC000450635362	DH	On-Demand	Anodyne	SLC6A1	49	36
C(=C/c1ccccc1)\CCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1	ZINC000450635363	DH	On-Demand	Anodyne	SLC6A1	49	36
C(=C/c1ccccc1)\CCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1	ZINC000450635364	DH	On-Demand	Anodyne	SLC6A1	49	36
C(=C\c1ccccc1)\CCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1	ZINC000450635365	DH	On-Demand	Anodyne	SLC6A1	49	36
CCC[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450635377	DE	On-Demand	Anodyne	DRD2	30	42
CCC[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450635377	DE	On-Demand	Anodyne	CYP2J2	49	35
CCC[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450635378	DE	On-Demand	Anodyne	DRD2	30	42
CCC[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450635378	DE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)c1cc(-c2ccccc2CNC(=O)[C@@H]2CCC(=O)N2C)[nH]n1	ZINC000450635389	FD	On-Demand	Anodyne	P2RX7	77	56
COC(=O)c1cc(-c2ccccc2CNC(=O)[C@H]2CCC(=O)N2C)[nH]n1	ZINC000450635390	FD	On-Demand	Anodyne	P2RX7	77	56
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3n[nH]cc23)CC1	ZINC000450635397	GE	On-Demand	Anodyne	PDGFRB	18	47
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3n[nH]cc23)CC1	ZINC000450635397	GE	On-Demand	Anodyne	AKT2	43	39
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3n[nH]cc23)CC1	ZINC000450635397	GE	On-Demand	Anodyne	AKT1	32	41
CC(C)[C@H]1CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450635409	DG	On-Demand	Bother	LIPG	51	36
CC(C)[C@H]1CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450635409	DG	On-Demand	Bother	PPXII	0	42
CC(C)[C@H]1CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450635409	DG	On-Demand	Bother	AADAC	0	40
CC(C)[C@@H]1CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450635410	DG	On-Demand	Bother	LIPG	51	36
CC(C)[C@@H]1CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450635410	DG	On-Demand	Bother	PPXII	0	42
CC(C)[C@@H]1CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450635410	DG	On-Demand	Bother	AADAC	0	40
N#Cc1c(Cl)cccc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000450635411	EF	On-Demand	Mild	CHRNA4	37	49
CC(C)c1ccc(CC2CCN(C(=O)c3ccnn3CC(F)(F)F)CC2)cc1	ZINC000450635414	GJ	On-Demand	Anodyne	CHRM2	15	44
CC(C)c1ccc(CC2CCN(C(=O)c3ccnn3CC(F)(F)F)CC2)cc1	ZINC000450635414	GJ	On-Demand	Anodyne	GRIN2B	43	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450635417	DG	On-Demand	Anodyne	DRD4	22	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450635417	DG	On-Demand	Anodyne	SIGMAR1	31	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450635418	DG	On-Demand	Anodyne	DRD4	22	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450635418	DG	On-Demand	Anodyne	SIGMAR1	31	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450635419	DG	On-Demand	Anodyne	DRD4	22	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450635419	DG	On-Demand	Anodyne	SIGMAR1	31	41
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450635420	DG	On-Demand	Anodyne	DRD4	22	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450635420	DG	On-Demand	Anodyne	SIGMAR1	31	41
O=C(CCCN1CCOC[C@H]1C1CC1)c1ccc(Br)cc1	ZINC000450635421	FH	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1CCOC[C@@H]1C1CC1)c1ccc(Br)cc1	ZINC000450635422	FH	On-Demand	Anodyne	CYP2J2	51	36
CCCC[C@H](NC(=O)c1ccc(C(C)(F)F)nc1)C(=O)OC(C)(C)C	ZINC000450635428	FH	On-Demand	Anodyne	CTRB_BOVIN	47	33
CC(C)[C@H]1CCN1C(=O)CCCC(=O)C1CC1	ZINC000450635434	BE	On-Demand	Anodyne	PREP	16	40
CC(C)[C@@H]1CCN1C(=O)CCCC(=O)C1CC1	ZINC000450635435	BE	On-Demand	Anodyne	PREP	16	40
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1	ZINC000450635440	GH	On-Demand	Bother	CHRNA4	26	40
CCOC(=O)c1cnc2ccccc2c1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000450635441	GG	On-Demand	Anodyne	CHRNA4	27	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450635442	GG	On-Demand	Anodyne	CHRNA4	28	44
CCC[C@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450635445	FG	On-Demand	Anodyne	SSTR2	51	35
CCC[C@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450635445	FG	On-Demand	Anodyne	PSENEN	0	41
CCC[C@@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450635446	FG	On-Demand	Anodyne	SSTR2	51	35
CCC[C@@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450635446	FG	On-Demand	Anodyne	PSENEN	0	41
CCCC[C@@H](NC(=O)c1cn(C)nc1COC)C(=O)OC(C)(C)C	ZINC000450635447	EE	On-Demand	Anodyne	CTSK	28	41
CCCC[C@H](NC(=O)c1cn(C)nc1COC)C(=O)OC(C)(C)C	ZINC000450635448	EE	On-Demand	Anodyne	CTSK	28	41
CS(=O)(=O)c1cccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1[N+](=O)[O-]	ZINC000450635452	GD	On-Demand	Bother	CHRNA4	28	47
CC(=O)c1ccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc1	ZINC000450635462	DE	On-Demand	Anodyne	CHRNA4	32	53
COc1ccc(-c2noc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)n2)cc1	ZINC000450635473	FF	On-Demand	Anodyne	COLA	32	42
COc1ccc(-c2noc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)n2)cc1	ZINC000450635473	FF	On-Demand	Anodyne	CPT1A	22	40
Cc1ccn2ncc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)c2c1	ZINC000450635476	EF	On-Demand	Anodyne	DRD3	0	54
Cc1ccn2ncc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)c2c1	ZINC000450635477	EF	On-Demand	Anodyne	DRD3	0	54
Cc1ccn2ncc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)c2c1	ZINC000450635478	EF	On-Demand	Anodyne	DRD3	0	54
COc1ccc(-c2noc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)n2)cc1	ZINC000450635479	FF	On-Demand	Anodyne	COLA	32	42
COc1ccc(-c2noc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)n2)cc1	ZINC000450635479	FF	On-Demand	Anodyne	CPT1A	22	40
Cc1ccn2ncc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)c2c1	ZINC000450635480	EF	On-Demand	Anodyne	DRD3	0	54
COC(=O)c1cccc(CN2CCc3c(ccc(OC)c3OC)C2)c1Cl	ZINC000450635482	GH	On-Demand	Anodyne	DRD3	0	42
COC(=O)c1cccc(CN2CCc3c(ccc(OC)c3OC)C2)c1Cl	ZINC000450635482	GH	On-Demand	Anodyne	AGTR2	49	37
COC(=O)c1cccc(CN2CCc3c(ccc(OC)c3OC)C2)c1Cl	ZINC000450635482	GH	On-Demand	Anodyne	SLC9A1	40	32
COC(=O)c1cccc(CN2CCc3c(ccc(OC)c3OC)C2)c1Cl	ZINC000450635482	GH	On-Demand	Anodyne	NOD2	40	37
CCOC(=O)c1cnn(C2CCN(c3ccc(Cl)cc3C#N)CC2)c1	ZINC000450635485	FG	On-Demand	Mild	P2RY12	62	46
Cc1csc2c(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ncnc12	ZINC000450635492	EF	On-Demand	Anodyne	CHRNA4	34	46
Cc1[nH]c(C#N)cc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450635501	DE	On-Demand	Mild	DRD4	18	55
Cc1[nH]c(C#N)cc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450635501	DE	On-Demand	Mild	DRD3	17	55
Cc1[nH]c(C#N)cc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450635502	DE	On-Demand	Mild	DRD4	18	55
Cc1[nH]c(C#N)cc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450635502	DE	On-Demand	Mild	DRD3	17	55
Cc1[nH]c(C#N)cc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450635503	DE	On-Demand	Mild	DRD4	18	55
Cc1[nH]c(C#N)cc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450635503	DE	On-Demand	Mild	DRD3	17	55
Cc1[nH]c(C#N)cc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450635505	DE	On-Demand	Mild	DRD4	18	55
Cc1[nH]c(C#N)cc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450635505	DE	On-Demand	Mild	DRD3	17	55
CC(C)OC(=O)CCCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450635507	DE	On-Demand	Anodyne	EPHX2	18	43
CN(CCCn1ccnc1)Cc1cn(CC2CC2)nn1	ZINC000450635508	CD	On-Demand	Anodyne	CAMC	0	42
CC(C)OC(=O)CCCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450635510	DE	On-Demand	Anodyne	EPHX2	18	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3ccc(Br)cc23)C1	ZINC000450635515	GH	On-Demand	Anodyne	CHRNA4	28	45
CCc1ccc2nccc(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1	ZINC000450635516	EH	On-Demand	Anodyne	CHRNA4	29	48
CC(C)OC(=O)CCCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450635517	FE	On-Demand	Bother	PTAFR	15	40
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	PDE3A	46	37
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	P2RY12	34	42
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	PDGFRB	40	46
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	AKT2	17	40
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	AKT3	16	40
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	PDE3B	68	37
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	SIRT3	62	35
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	SIRT2	69	36
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	SIRT1	56	36
CCOC(=O)c1cnn(C2CCN(c3ncnc4ccc(C)cc34)CC2)c1	ZINC000450635535	FG	On-Demand	Anodyne	MAP3K7	45	33
Cn1c(CCNC(=O)c2ccc(C(C)(F)F)nc2)nnc1-c1ccccc1	ZINC000450635543	FF	On-Demand	Anodyne	EPHX2	0	42
CCc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n2ncnc2n1	ZINC000450635546	ED	On-Demand	Anodyne	CHRNA4	27	44
CCOC(=O)c1cc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)on1	ZINC000450635550	GD	On-Demand	Anodyne	P2RY12	40	42
CCOC(=O)c1cc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)on1	ZINC000450635550	GD	On-Demand	Anodyne	STAT6	48	32
CC(C)(C[C@H]1CCCN(c2ccnc3cc(C(F)(F)F)ccc23)C1)C(N)=O	ZINC000450635557	GI	On-Demand	Anodyne	LIPG	56	36
CC(C)(C[C@@H]1CCCN(c2ccnc3cc(C(F)(F)F)ccc23)C1)C(N)=O	ZINC000450635558	GI	On-Demand	Anodyne	LIPG	56	36
O=C(NCc1cnc(N2CCOCC2)c(F)c1)C1(C(F)(F)F)CCC1	ZINC000450635559	FE	On-Demand	Anodyne	STAT6	60	38
Cn1c(C#N)ccc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450635573	ED	On-Demand	Mild	STAT6	48	33
C/C=C\COc1cccc(CC(=O)NCCc2nnc(-c3ccccc3)n2C)c1	ZINC000450635576	GG	On-Demand	Anodyne	CRTM	42	37
CC(C)OC(C)(C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450635580	ED	On-Demand	Anodyne	STAT6	51	35
COc1cc(CC(=O)Nc2nncn2C)ccc1Cl	ZINC000450635581	CD	On-Demand	Anodyne	CAN2	0	42
CC(=O)N[C@H](C(=O)NCc1cnc(N2CCOCC2)c(F)c1)C(C)(C)C	ZINC000450635583	FD	On-Demand	Anodyne	STAT6	54	33
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H](CCCC)C(=O)OC(C)(C)C	ZINC000450635584	DF	On-Demand	Mild	CTSK	0	41
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](CCCC)C(=O)OC(C)(C)C	ZINC000450635585	DF	On-Demand	Mild	CTSK	0	41
CN1C(=O)NC2(CCN(CCc3ccc(Cl)cc3)CC2)C1=O	ZINC000450635591	DD	On-Demand	Anodyne	DRD4	15	43
CN1C(=O)NC2(CCN(CCc3ccc(Cl)cc3)CC2)C1=O	ZINC000450635591	DD	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)c1cc(-c2ccccc2CNC(=O)C2(C(F)(F)F)CCC2)[nH]n1	ZINC000450635608	GG	On-Demand	Anodyne	BDKRB1	22	41
CCN1C[C@H](C)N(CCc2ccc(Cl)cc2)C[C@@H]1C	ZINC000450635609	CG	On-Demand	Anodyne	HRH3	23	42
CCN1C[C@H](C)N(CCc2ccc(Cl)cc2)C[C@H]1C	ZINC000450635610	CG	On-Demand	Anodyne	HRH3	23	42
CCN1C[C@@H](C)N(CCc2ccc(Cl)cc2)C[C@@H]1C	ZINC000450635611	CG	On-Demand	Anodyne	HRH3	23	42
CCN1C[C@@H](C)N(CCc2ccc(Cl)cc2)C[C@H]1C	ZINC000450635612	CG	On-Demand	Anodyne	HRH3	23	42
CCOC(=O)c1sc(Sc2ccnc(C(C)C)n2)nc1C	ZINC000450635624	DH	On-Demand	Anodyne	DHODH	21	43
CCOC(=O)c1sc(Sc2nnc(C)c(C)n2)nc1C	ZINC000450635629	DF	On-Demand	Anodyne	DHODH	22	44
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	OPRD1	0	40
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	P2RY12	161	38
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	MME	49	39
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	MC4R	78	40
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	TRY2_BOVIN	73	41
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	CYSP_TRYCR	24	43
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	CCKAR	36	41
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	CCR1	22	42
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	NPFFR2	41	31
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	CYP51A1	23	45
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	TIMP3	44	31
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	MC3R	41	36
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	MC5R	62	38
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	REN	48	39
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	CCKBR	26	42
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	CAPN1	45	41
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	ACE2	48	35
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	PGA5	50	36
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	ST14	81	35
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	HDA106	0	49
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	BRCA1	45	36
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	TMPRSS6	40	33
O=C(CCCC(=O)C1CC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635637	FD	On-Demand	Anodyne	DERP1	0	45
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	OPRD1	0	40
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	P2RY12	161	38
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	MME	49	39
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	MC4R	78	40
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	TRY2_BOVIN	73	41
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	CYSP_TRYCR	24	43
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	CCKAR	36	41
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	CCR1	22	42
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	NPFFR2	41	31
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	CYP51A1	23	45
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	TIMP3	44	31
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	MC3R	41	36
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	MC5R	62	38
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	REN	48	39
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	CCKBR	26	42
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	CAPN1	45	41
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	ACE2	48	35
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	PGA5	50	36
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	ST14	81	35
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	HDA106	0	49
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	BRCA1	45	36
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	TMPRSS6	40	33
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450635638	FD	On-Demand	Anodyne	DERP1	0	45
COc1ccc([C@H](CO)N(C)C(=O)CCCC(C)C)cc1	ZINC000450635641	CG	On-Demand	Anodyne	DXR	32	43
COc1ccc([C@@H](CO)N(C)C(=O)CCCC(C)C)cc1	ZINC000450635642	CG	On-Demand	Anodyne	DXR	32	43
CC[C@H]1CCC[C@H]1C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635644	CI	On-Demand	Anodyne	SCN9A	0	40
CC[C@H]1CCC[C@@H]1C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635645	CI	On-Demand	Anodyne	SCN9A	0	40
CC[C@@H]1CCC[C@@H]1C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635646	CI	On-Demand	Anodyne	SCN9A	0	40
CC[C@@H]1CCC[C@H]1C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635647	CI	On-Demand	Anodyne	SCN9A	0	40
CCN1C[C@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450635648	FE	On-Demand	Anodyne	MTR1B_CHICK	0	40
CCN1C[C@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450635648	FE	On-Demand	Anodyne	MTNR1A	66	40
CCN1C[C@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450635648	FE	On-Demand	Anodyne	MTNR1B	53	40
CCN1C[C@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450635648	FE	On-Demand	Anodyne	SLC29A2	0	40
CCN1C[C@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450635649	FE	On-Demand	Anodyne	MTR1B_CHICK	0	40
CCN1C[C@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450635649	FE	On-Demand	Anodyne	MTNR1A	66	40
CCN1C[C@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450635649	FE	On-Demand	Anodyne	MTNR1B	53	40
CCN1C[C@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450635649	FE	On-Demand	Anodyne	SLC29A2	0	40
CCN1C[C@@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450635650	FE	On-Demand	Anodyne	MTR1B_CHICK	0	40
CCN1C[C@@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450635650	FE	On-Demand	Anodyne	MTNR1A	66	40
CCN1C[C@@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450635650	FE	On-Demand	Anodyne	MTNR1B	53	40
CCN1C[C@@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450635650	FE	On-Demand	Anodyne	SLC29A2	0	40
CCN1C[C@@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450635651	FE	On-Demand	Anodyne	MTR1B_CHICK	0	40
CCN1C[C@@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450635651	FE	On-Demand	Anodyne	MTNR1A	66	40
CCN1C[C@@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450635651	FE	On-Demand	Anodyne	MTNR1B	53	40
CCN1C[C@@H](C)N(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450635651	FE	On-Demand	Anodyne	SLC29A2	0	40
FC(F)CN1CCCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450635654	EF	On-Demand	Anodyne	SIGMAR1	23	41
COc1cc(CN2CCN(C(=O)[C@@H](C)O)CC2)ccc1Cl	ZINC000450635655	DD	On-Demand	Anodyne	SSTR5	48	37
COc1cc(CN2CCN(C(=O)[C@@H](C)O)CC2)ccc1Cl	ZINC000450635655	DD	On-Demand	Anodyne	CCR1	36	40
COc1cc(CN2CCN(C(=O)[C@H](C)O)CC2)ccc1Cl	ZINC000450635656	DD	On-Demand	Anodyne	SSTR5	48	37
COc1cc(CN2CCN(C(=O)[C@H](C)O)CC2)ccc1Cl	ZINC000450635656	DD	On-Demand	Anodyne	CCR1	36	40
CCOC(=O)c1sc(Sc2cc(C)ncn2)nc1C	ZINC000450635657	CF	On-Demand	Anodyne	DHODH	23	43
CC(=O)N1CCN(Cc2ccn(CCc3ccccc3)n2)CC12CCCCC2	ZINC000450635661	GG	On-Demand	Anodyne	SLC12A5	64	38
CCc1c(C(=O)N(C)[C@H](CO)c2ccc(OC)cc2)oc2ccccc12	ZINC000450635670	FH	On-Demand	Anodyne	NQO1	17	42
CCc1c(C(=O)N(C)[C@@H](CO)c2ccc(OC)cc2)oc2ccccc12	ZINC000450635671	FH	On-Demand	Anodyne	NQO1	17	42
CCOC(=O)c1sc(Sc2ccc3nnc(C(F)(F)F)n3n2)nc1C	ZINC000450635678	GG	On-Demand	Anodyne	LRRK2	42	35
CC[C@H](CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450635679	DH	On-Demand	Anodyne	SMO	47	33
CC[C@H](CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450635679	DH	On-Demand	Anodyne	ETHR	64	47
CC[C@@H](CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450635680	DH	On-Demand	Anodyne	SMO	47	33
CC[C@@H](CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450635680	DH	On-Demand	Anodyne	ETHR	64	47
Cc1nc(N(C)CC(C)(C)CO)c2c3c(sc2n1)CCC3	ZINC000450635685	DF	On-Demand	Anodyne	CEL	19	40
COC(=O)c1cc(-c2ccccc2CNC(=O)Cc2cn(C)nc2C)[nH]n1	ZINC000450635691	FD	On-Demand	Anodyne	MT-CYB	41	33
Cn1c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc2cccc(F)c21	ZINC000450635696	EE	On-Demand	Anodyne	CHRNA4	40	50
CCCn1c(SCc2nc(C(=O)OC)cs2)nc2ccccc2c1=O	ZINC000450635697	GG	On-Demand	Anodyne	PTGDR2	16	41
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450635698	EE	On-Demand	Anodyne	P2RX7	20	46
CCOC(=O)c1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc(C(C)(C)C)n1	ZINC000450635707	GF	On-Demand	Anodyne	CHRNA4	28	46
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450635718	FF	On-Demand	Anodyne	CHRNA4	29	48
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450635718	FF	On-Demand	Anodyne	PDE3B	48	31
CC(C)N1CCN(C2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)CC2)CC1	ZINC000450635719	GI	On-Demand	Anodyne	HRH3	17	44
CC(C)N1CCN(C2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)CC2)CC1	ZINC000450635719	GI	On-Demand	Anodyne	L3MBTL3	21	40
CC(C)N1CCN(C2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)CC2)CC1	ZINC000450635720	GI	On-Demand	Anodyne	HRH3	17	44
CC(C)N1CCN(C2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)CC2)CC1	ZINC000450635720	GI	On-Demand	Anodyne	L3MBTL3	21	40
COc1ccc(-c2nnc(SCC3(OC)CCC3)o2)cc1OC	ZINC000450635721	EG	On-Demand	Anodyne	GSK3B	0	47
COc1ccc(-c2nnc(SCC3(OC)CCC3)o2)cc1OC	ZINC000450635721	EG	On-Demand	Anodyne	GSK3A	37	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc(-c3ccccc3Cl)cs2)C1	ZINC000450635726	GI	On-Demand	Anodyne	CHRNA4	31	50
CCCn1c(SCCCCCC(C)=O)nc2ccccc2c1=O	ZINC000450635727	EI	On-Demand	Anodyne	PTGDR2	15	49
COC(=O)c1csc(CN(C)C[C@H](C)Cc2ccc(OC)cc2)n1	ZINC000450635732	EG	On-Demand	Anodyne	PSMB8	45	31
COC(=O)c1csc(CN(C)C[C@@H](C)Cc2ccc(OC)cc2)n1	ZINC000450635733	EG	On-Demand	Anodyne	PSMB8	45	31
COc1cc(-c2nnc(SCCC(C)(F)F)o2)cc(OC)c1OC	ZINC000450635734	FH	On-Demand	Anodyne	TYMS	0	52
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1	ZINC000450635741	GG	On-Demand	Bother	CHRNA4	28	46
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2cnc3cc(Cl)c(Cl)cc3n2)C1	ZINC000450635744	GH	On-Demand	Anodyne	CHRNA4	30	47
COc1ccc(-c2nnc(SC[C@H]3CCCCC3(F)F)o2)cc1OC	ZINC000450635759	FJ	On-Demand	Anodyne	GSK3B	15	44
COc1ccc(-c2nnc(SC[C@H]3CCCCC3(F)F)o2)cc1OC	ZINC000450635759	FJ	On-Demand	Anodyne	GSK3A	40	38
COc1ccc(-c2nnc(SC[C@@H]3CCCCC3(F)F)o2)cc1OC	ZINC000450635760	FJ	On-Demand	Anodyne	GSK3B	15	44
COc1ccc(-c2nnc(SC[C@@H]3CCCCC3(F)F)o2)cc1OC	ZINC000450635760	FJ	On-Demand	Anodyne	GSK3A	40	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCCC(=O)C(C)(C)C	ZINC000450635761	EG	On-Demand	Anodyne	SIGMAR1	27	41
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCCC(=O)C(C)(C)C	ZINC000450635762	EG	On-Demand	Anodyne	SIGMAR1	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCCC(=O)C(C)(C)C	ZINC000450635763	EG	On-Demand	Anodyne	SIGMAR1	27	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCCC(=O)C(C)(C)C	ZINC000450635764	EG	On-Demand	Anodyne	SIGMAR1	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2cccnc2s1	ZINC000450635769	FH	On-Demand	Anodyne	DRD4	20	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2cccnc2s1	ZINC000450635769	FH	On-Demand	Anodyne	DRD3	0	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2cccnc2s1	ZINC000450635770	FH	On-Demand	Anodyne	DRD4	20	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2cccnc2s1	ZINC000450635770	FH	On-Demand	Anodyne	DRD3	0	50
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2cccnc2s1	ZINC000450635771	FH	On-Demand	Anodyne	DRD4	20	50
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2cccnc2s1	ZINC000450635771	FH	On-Demand	Anodyne	DRD3	0	50
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2cccnc2s1	ZINC000450635772	FH	On-Demand	Anodyne	DRD4	20	50
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2cccnc2s1	ZINC000450635772	FH	On-Demand	Anodyne	DRD3	0	50
Cc1[nH]c(C#N)cc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450635777	FD	On-Demand	Mild	CDK4	22	42
Cc1[nH]c(C#N)cc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450635777	FD	On-Demand	Mild	CALCA	0	40
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450635782	DI	On-Demand	Anodyne	MC4R	31	41
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450635782	DI	On-Demand	Anodyne	PRCP	49	38
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450635782	DI	On-Demand	Anodyne	MC3R	36	41
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450635782	DI	On-Demand	Anodyne	MC5R	30	41
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450635783	DI	On-Demand	Anodyne	MC4R	39	41
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450635783	DI	On-Demand	Anodyne	PRCP	51	38
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450635783	DI	On-Demand	Anodyne	MC3R	36	41
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450635783	DI	On-Demand	Anodyne	MC5R	30	41
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450635784	DI	On-Demand	Anodyne	MC4R	39	41
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450635784	DI	On-Demand	Anodyne	PRCP	51	38
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450635784	DI	On-Demand	Anodyne	MC3R	36	41
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450635784	DI	On-Demand	Anodyne	MC5R	30	41
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450635785	DI	On-Demand	Anodyne	MC4R	39	41
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450635785	DI	On-Demand	Anodyne	PRCP	51	38
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450635785	DI	On-Demand	Anodyne	MC3R	36	41
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450635785	DI	On-Demand	Anodyne	MC5R	30	41
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cccc(Cl)c2C#N)CC1	ZINC000450635788	GI	On-Demand	Mild	KCNA3	0	40
CCC(=O)C1(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CC1	ZINC000450635790	FD	On-Demand	Anodyne	CDK4	23	41
CC[C@H](CO)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450635795	CF	On-Demand	Anodyne	TIMP3	51	34
CCOC(=O)c1cnn(C2CCN(c3nc(C)nc4ccc(OC)cc34)CC2)c1	ZINC000450635796	GG	On-Demand	Anodyne	P2RY12	48	41
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc(C#N)c3)CC2)c1	ZINC000450635801	EE	On-Demand	Mild	P2RY12	51	40
CCOC(=O)c1cnn(C2CCN(c3ccnc(C(C)C)n3)CC2)c1	ZINC000450635805	EF	On-Demand	Anodyne	SORD	64	36
CCOC(=O)c1cnn(C2CCN(c3nccc(C#N)n3)CC2)c1	ZINC000450635808	ED	On-Demand	Mild	P2RY12	54	41
Cc1ccc(F)c(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)c1	ZINC000450635810	FE	On-Demand	Anodyne	P2RX7	43	40
Cc1ccc(F)c(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)c1	ZINC000450635810	FE	On-Demand	Anodyne	SCN10A	19	42
Cc1ccc(F)c(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)c1	ZINC000450635810	FE	On-Demand	Anodyne	STAT6	57	38
CCOC(=O)c1cnn(C2CCN(c3c(C)cnc4c(OC)cccc34)CC2)c1	ZINC000450635811	GH	On-Demand	Anodyne	ATP4A	19	43
CC[C@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450635815	CE	On-Demand	Anodyne	PIN1	27	43
CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1CC)C(=O)OC(C)(C)C	ZINC000450635817	CG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1CC)C(=O)OC(C)(C)C	ZINC000450635817	CG	On-Demand	Anodyne	PGA5	40	38
CCCC[C@H](NC(=O)[C@@H]1C[C@H]1CC)C(=O)OC(C)(C)C	ZINC000450635818	CG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@H](NC(=O)[C@@H]1C[C@H]1CC)C(=O)OC(C)(C)C	ZINC000450635818	CG	On-Demand	Anodyne	PGA5	40	38
CCOC(=O)c1cnn(C2CCN(c3cc(C#N)cc(C)n3)CC2)c1	ZINC000450635820	EE	On-Demand	Mild	P2RY12	55	38
CCOC(=O)c1cc(C(=O)N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)on1	ZINC000450635822	FH	On-Demand	Anodyne	GRIN2B	29	40
CCOC(=O)c1cc(C(=O)N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)on1	ZINC000450635822	FH	On-Demand	Anodyne	CCR3	50	34
CCOC(=O)c1cc(C(=O)N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)on1	ZINC000450635823	FH	On-Demand	Anodyne	GRIN2B	29	40
CCOC(=O)c1cc(C(=O)N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)on1	ZINC000450635823	FH	On-Demand	Anodyne	CCR3	50	34
CC(C)(C[C@H]1CCCN(c2nc3cccc(F)c3s2)C1)C(N)=O	ZINC000450635833	EH	On-Demand	Anodyne	SIRT3	48	30
CC(C)(C[C@H]1CCCN(c2nc3cccc(F)c3s2)C1)C(N)=O	ZINC000450635833	EH	On-Demand	Anodyne	SIRT1	48	30
CC(C)(C[C@@H]1CCCN(c2nc3cccc(F)c3s2)C1)C(N)=O	ZINC000450635834	EH	On-Demand	Anodyne	SIRT3	48	30
CC(C)(C[C@@H]1CCCN(c2nc3cccc(F)c3s2)C1)C(N)=O	ZINC000450635834	EH	On-Demand	Anodyne	SIRT1	48	30
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@H](CC(C)(C)C(N)=O)C2)c1	ZINC000450635837	FE	On-Demand	Bother	PRKCQ	40	32
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c1	ZINC000450635838	FE	On-Demand	Bother	PRKCQ	40	32
CCC(CC)(CCSc1nnc(-c2c[nH]c3ccccc23)o1)C(=O)OC	ZINC000450635847	FJ	On-Demand	Anodyne	ALOX15	64	38
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)cc(OC)c1Br	ZINC000450635848	GJ	On-Demand	Anodyne	KCNK3	40	42
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)cc(OC)c1Br	ZINC000450635848	GJ	On-Demand	Anodyne	KCNK9	35	42
Cn1nc(-c2ccccc2)cc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450635849	GE	On-Demand	Anodyne	MTOR	40	35
Cn1nc(-c2ccccc2)cc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450635849	GE	On-Demand	Anodyne	SCN10A	25	42
Cn1nc(-c2ccccc2)cc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450635849	GE	On-Demand	Anodyne	STAT6	59	35
CCC[C@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)C(=O)OC(C)(C)C	ZINC000450635859	DF	On-Demand	Anodyne	NS3	0	40
CCC[C@@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)C(=O)OC(C)(C)C	ZINC000450635860	DF	On-Demand	Anodyne	NS3	0	40
CCOC(=O)c1cnn(C2CCN(c3ccc(C(F)(F)F)cc3C#N)CC2)c1	ZINC000450635865	GH	On-Demand	Mild	P2RY12	61	44
CCOC(=O)c1cnn(C2CCN(c3ccc(C(F)(F)F)cc3C#N)CC2)c1	ZINC000450635865	GH	On-Demand	Mild	LIPG	60	41
CCOC(=O)c1cnn(C2CCN(c3ncc(Cl)cc3Cl)CC2)c1	ZINC000450635870	FH	On-Demand	Anodyne	P2RY12	56	50
CCC[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC(C)(C)C	ZINC000450635877	EG	On-Demand	Anodyne	CCKAR	0	40
CCC[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC(C)(C)C	ZINC000450635877	EG	On-Demand	Anodyne	AKT1	22	45
CCC[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC(C)(C)C	ZINC000450635878	EG	On-Demand	Anodyne	CCKAR	0	40
CCC[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OC(C)(C)C	ZINC000450635878	EG	On-Demand	Anodyne	AKT1	22	45
CCOC(=O)c1cnn(C2CCN(c3nc4ccc(F)cc4n3C)CC2)c1	ZINC000450635883	FF	On-Demand	Anodyne	P2RY12	40	38
CC(C)(C[C@@H]1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)C(N)=O	ZINC000450635884	GI	On-Demand	Anodyne	SIRT3	78	34
CC(C)(C[C@@H]1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)C(N)=O	ZINC000450635884	GI	On-Demand	Anodyne	SIRT2	66	34
CC(C)(C[C@@H]1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)C(N)=O	ZINC000450635884	GI	On-Demand	Anodyne	SIRT1	62	34
CC(C)(C[C@H]1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)C(N)=O	ZINC000450635885	GI	On-Demand	Anodyne	SIRT3	78	34
CC(C)(C[C@H]1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)C(N)=O	ZINC000450635885	GI	On-Demand	Anodyne	SIRT2	66	34
CC(C)(C[C@H]1CCCN(c2ncnc3sc(-c4ccccc4)cc23)C1)C(N)=O	ZINC000450635885	GI	On-Demand	Anodyne	SIRT1	62	34
CCOC(=O)c1cnn(C2CCN(c3ccc(C)c(C#N)n3)CC2)c1	ZINC000450635893	EE	On-Demand	Mild	P2RY12	57	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450635897	CF	On-Demand	Anodyne	HRH3	15	45
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450635898	CF	On-Demand	Anodyne	HRH3	15	45
CCS(=O)(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450635899	CF	On-Demand	Anodyne	HRH3	15	45
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450635900	CF	On-Demand	Anodyne	HRH3	15	45
COc1ccc(CNC(=O)CCN2[C@@H](c3ccccc3)COC[C@H]2C)c(OC)c1	ZINC000450635908	GG	On-Demand	Anodyne	MTNR1A	58	38
COc1ccc(CNC(=O)CCN2[C@@H](c3ccccc3)COC[C@H]2C)c(OC)c1	ZINC000450635908	GG	On-Demand	Anodyne	MTNR1B	52	38
COc1ccc(CNC(=O)CCN2[C@@H](C)COC[C@@H]2c2ccccc2)c(OC)c1	ZINC000450635909	GG	On-Demand	Anodyne	MTNR1A	58	38
COc1ccc(CNC(=O)CCN2[C@@H](C)COC[C@@H]2c2ccccc2)c(OC)c1	ZINC000450635909	GG	On-Demand	Anodyne	MTNR1B	52	38
COc1ccc(CNC(=O)CCN2[C@H](C)COC[C@H]2c2ccccc2)c(OC)c1	ZINC000450635910	GG	On-Demand	Anodyne	MTNR1A	58	38
COc1ccc(CNC(=O)CCN2[C@H](C)COC[C@H]2c2ccccc2)c(OC)c1	ZINC000450635910	GG	On-Demand	Anodyne	MTNR1B	52	38
COc1ccc(CNC(=O)CCN2[C@@H](C)COC[C@H]2c2ccccc2)c(OC)c1	ZINC000450635911	GG	On-Demand	Anodyne	MTNR1A	58	38
COc1ccc(CNC(=O)CCN2[C@@H](C)COC[C@H]2c2ccccc2)c(OC)c1	ZINC000450635911	GG	On-Demand	Anodyne	MTNR1B	52	38
COc1ccc([C@H](CO)N(C)C(=O)CCCC(=O)C2CC2)cc1	ZINC000450635912	DE	On-Demand	Anodyne	DXR	28	40
COc1ccc([C@@H](CO)N(C)C(=O)CCCC(=O)C2CC2)cc1	ZINC000450635913	DE	On-Demand	Anodyne	DXR	28	40
C[C@H](OCCc1ccccc1)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635916	EH	On-Demand	Anodyne	ANPEP	30	42
C[C@H](OCCc1ccccc1)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635916	EH	On-Demand	Anodyne	FURIN	41	32
C[C@H](OCCc1ccccc1)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635916	EH	On-Demand	Anodyne	AMP1_PLAFQ	59	42
C[C@H](OCCc1ccccc1)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635916	EH	On-Demand	Anodyne	PDS	55	35
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635917	EH	On-Demand	Anodyne	ANPEP	30	42
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635917	EH	On-Demand	Anodyne	FURIN	41	32
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635917	EH	On-Demand	Anodyne	AMP1_PLAFQ	59	42
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450635917	EH	On-Demand	Anodyne	PDS	55	35
Clc1ccc(CCN2CCN(Cc3cnns3)CC2)cc1Cl	ZINC000450635918	FG	On-Demand	Anodyne	SIGMAR1	28	57
Clc1ccc(CCN2CCN(Cc3cnns3)CC2)cc1Cl	ZINC000450635918	FG	On-Demand	Anodyne	KCNJ1	42	37
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450635919	EH	On-Demand	Anodyne	EPHX2	19	45
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450635919	EH	On-Demand	Anodyne	CACNA1G	42	38
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450635919	EH	On-Demand	Anodyne	TMPRSS11D	56	33
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450635920	EH	On-Demand	Anodyne	EPHX2	19	45
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450635920	EH	On-Demand	Anodyne	CACNA1G	42	38
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450635920	EH	On-Demand	Anodyne	TMPRSS11D	56	33
COc1ccc([C@H](CO)N(C)C(=O)c2ccc(C#N)n2C)cc1	ZINC000450635944	DD	On-Demand	Mild	DXR	19	40
COc1ccc([C@@H](CO)N(C)C(=O)c2ccc(C#N)n2C)cc1	ZINC000450635945	DD	On-Demand	Mild	DXR	19	40
CCOC(=O)c1sc(Sc2ccc(C(=O)NC)cc2[N+](=O)[O-])nc1C	ZINC000450635946	GG	On-Demand	Bother	DHODH	22	41
CCOC(=O)c1sc(Sc2ccc(C(=O)NC)cc2[N+](=O)[O-])nc1C	ZINC000450635946	GG	On-Demand	Bother	GSTM2	64	42
COc1ccc(CNC(=O)CCN2CCSC[C@@H]2CO)c(OC)c1	ZINC000450635949	FD	On-Demand	Anodyne	MTNR1A	40	35
COc1ccc(CNC(=O)CCN2CCSC[C@H]2CO)c(OC)c1	ZINC000450635950	FD	On-Demand	Anodyne	MTNR1A	40	35
CC(C)(C)[C@H]1CCN(C(=O)Cc2sccc2Br)C[C@H]1O	ZINC000450635957	FG	On-Demand	Anodyne	ETHR	40	32
CC(C)(C)[C@H]1CCN(C(=O)Cc2sccc2Br)C[C@@H]1O	ZINC000450635958	FG	On-Demand	Anodyne	ETHR	40	32
CC(C)(C)[C@@H]1CCN(C(=O)Cc2sccc2Br)C[C@@H]1O	ZINC000450635959	FG	On-Demand	Anodyne	ETHR	40	32
CC(C)(C)[C@@H]1CCN(C(=O)Cc2sccc2Br)C[C@H]1O	ZINC000450635960	FG	On-Demand	Anodyne	ETHR	40	32
CCOC(=O)c1sc(Sc2cc(C)c([N+](=O)[O-])cn2)nc1C	ZINC000450635961	EG	On-Demand	Bother	DHODH	17	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450635972	GG	On-Demand	Anodyne	GPR88	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450635973	GG	On-Demand	Anodyne	GPR88	0	41
CCC[C@H]1C(=O)NCCN1CCN(C)Cc1ccccc1	ZINC000450635974	CD	On-Demand	Anodyne	GHRL	45	35
CCC[C@@H]1C(=O)NCCN1CCN(C)Cc1ccccc1	ZINC000450635975	CD	On-Demand	Anodyne	GHRL	45	35
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1cc(C)ccc1F	ZINC000450635980	DE	On-Demand	Anodyne	CCR2	20	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1cc(C)ccc1F	ZINC000450635981	DE	On-Demand	Anodyne	CCR2	20	41
Cc1nn(C)cc1CC(=O)NCc1ccc(C(F)F)cc1	ZINC000450635982	CF	On-Demand	Anodyne	P2RX7	51	40
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450635988	ED	On-Demand	Anodyne	VHL	65	37
CC(C)c1nccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450635994	DE	On-Demand	Anodyne	CHRNA4	31	48
CC(C)c1nccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450635994	DE	On-Demand	Anodyne	SORD	47	34
Cc1cc(C)c2oc(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)nc2c1	ZINC000450635997	EG	On-Demand	Anodyne	CHRNA4	29	48
COCCOC[C@@H](O)CN1CCc2ccc(Cl)cc2C1	ZINC000450635998	CD	On-Demand	Anodyne	HSP90AB1	36	42
COCCOC[C@H](O)CN1CCc2ccc(Cl)cc2C1	ZINC000450635999	CD	On-Demand	Anodyne	HSP90AB1	36	42
Cc1cccc2c(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ncnc12	ZINC000450636011	EF	On-Demand	Anodyne	CHRNA4	37	47
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3ccc(Cl)c(Cl)c3n2)C1	ZINC000450636020	GI	On-Demand	Anodyne	CHRNA4	30	47
Cc1nc(C)c(C)c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450636028	DE	On-Demand	Anodyne	CHRNA4	30	48
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@@H]1CCCCC1(F)F	ZINC000450636033	FF	On-Demand	Anodyne	CDK4	0	40
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@H]1CCCCC1(F)F	ZINC000450636034	FF	On-Demand	Anodyne	CDK4	0	40
COc1ccc(-c2nnc(SCCCCCC(C)=O)o2)cc1OC	ZINC000450636039	FH	On-Demand	Anodyne	TYMS	0	40
COc1ccc(-c2nnc(SCCCCCC(C)=O)o2)cc1OC	ZINC000450636039	FH	On-Demand	Anodyne	GSK3B	16	43
COc1ccc(-c2nnc(SCCCCCC(C)=O)o2)cc1OC	ZINC000450636039	FH	On-Demand	Anodyne	PIK3CG	0	50
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nccc(C(F)F)n2)C1	ZINC000450636040	DE	On-Demand	Anodyne	CHRNA4	30	48
Cc1sccc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450636048	FF	On-Demand	Anodyne	CDK4	22	42
Cc1sccc1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450636048	FF	On-Demand	Anodyne	CALCA	0	40
O=C(CCCN1CCc2ccsc2C1)c1ccccc1	ZINC000450636053	CH	On-Demand	Anodyne	DRD2	28	40
O=C(CCCN1CCc2ccsc2C1)c1ccccc1	ZINC000450636053	CH	On-Demand	Anodyne	HTR2A	18	54
O=C(CCCN1CCc2ccsc2C1)c1ccccc1	ZINC000450636053	CH	On-Demand	Anodyne	HTR7	24	42
O=C(CCCN1CCc2ccsc2C1)c1ccccc1	ZINC000450636053	CH	On-Demand	Anodyne	SIGMAR1	20	44
O=C(CCCN1CCc2ccsc2C1)c1ccccc1	ZINC000450636053	CH	On-Demand	Anodyne	HTR5A	27	54
O=C(CCCN1CCc2ccsc2C1)c1ccccc1	ZINC000450636053	CH	On-Demand	Anodyne	CHRNA6	0	45
O=C(CCCN1CCc2ccsc2C1)c1ccccc1	ZINC000450636053	CH	On-Demand	Anodyne	CYP2J2	56	40
CC(C)[C@@H]1CCN1C(=O)c1cccc2c1CCCC2	ZINC000450636075	CG	On-Demand	Anodyne	FABP4	44	35
CC(C)[C@H]1CCN1C(=O)c1cccc2c1CCCC2	ZINC000450636076	CG	On-Demand	Anodyne	FABP4	44	35
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@H]1CC1(F)F	ZINC000450636077	ED	On-Demand	Anodyne	CDK4	23	42
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@H]1CC1(F)F	ZINC000450636077	ED	On-Demand	Anodyne	CALCA	0	40
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@@H]1CC1(F)F	ZINC000450636078	ED	On-Demand	Anodyne	CDK4	23	42
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@@H]1CC1(F)F	ZINC000450636078	ED	On-Demand	Anodyne	CALCA	0	40
CCS(=O)(=O)c1ccc(CN2CCC(N3CCN(C(C)C)CC3)CC2)cc1	ZINC000450636081	GE	On-Demand	Anodyne	CHRM2	24	41
CCS(=O)(=O)c1ccc(CN2CCC(N3CCN(C(C)C)CC3)CC2)cc1	ZINC000450636081	GE	On-Demand	Anodyne	HRH3	21	43
CCS(=O)(=O)c1ccc(CN2CCC(N3CCN(C(C)C)CC3)CC2)cc1	ZINC000450636081	GE	On-Demand	Anodyne	L3MBTL3	27	43
CC(C)(C)c1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc(C(C)(C)C)n1	ZINC000450636091	GH	On-Demand	Anodyne	CHRNA4	29	45
CCC[C@@H](NC(=O)CCCc1ncc(C)o1)C(=O)OC(C)(C)C	ZINC000450636100	DF	On-Demand	Anodyne	NOD1	42	33
CCC[C@H](NC(=O)CCCc1ncc(C)o1)C(=O)OC(C)(C)C	ZINC000450636101	DF	On-Demand	Anodyne	NOD1	42	33
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3c(F)cccc23)CC1	ZINC000450636104	FE	On-Demand	Anodyne	AKT2	42	37
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3c(F)cccc23)CC1	ZINC000450636105	FE	On-Demand	Anodyne	AKT2	42	37
CCC[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OC(C)(C)C	ZINC000450636113	EH	On-Demand	Anodyne	SELE	58	36
CCC[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OC(C)(C)C	ZINC000450636113	EH	On-Demand	Anodyne	ICAM1	56	36
CCC[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OC(C)(C)C	ZINC000450636113	EH	On-Demand	Anodyne	VCAM1	42	32
CCC[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OC(C)(C)C	ZINC000450636114	EH	On-Demand	Anodyne	SELE	58	36
CCC[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OC(C)(C)C	ZINC000450636114	EH	On-Demand	Anodyne	ICAM1	56	36
CCC[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OC(C)(C)C	ZINC000450636114	EH	On-Demand	Anodyne	VCAM1	42	32
CCOC(=O)c1cnn(C2CCN(c3nc(-c4ccccc4)cs3)CC2)c1	ZINC000450636115	GI	On-Demand	Anodyne	P2RY12	50	36
CCOC(=O)c1cnn(C2CCN(c3nc(-c4ccccc4)cs3)CC2)c1	ZINC000450636115	GI	On-Demand	Anodyne	MAP3K7	43	34
CC(C)(C[C@@H]1CCCN(c2ccnc(N3CCCCC3)n2)C1)C(N)=O	ZINC000450636118	EF	On-Demand	Anodyne	GPBAR1	25	41
CC(C)(C[C@H]1CCCN(c2ccnc(N3CCCCC3)n2)C1)C(N)=O	ZINC000450636119	EF	On-Demand	Anodyne	GPBAR1	25	41
CCOC(=O)c1cnn(C2CCN(c3noc(-c4ccccc4)n3)CC2)c1	ZINC000450636124	FF	On-Demand	Anodyne	COLA	39	40
CCOC(=O)c1cnn(C2CCN(c3noc(-c4ccccc4)n3)CC2)c1	ZINC000450636124	FF	On-Demand	Anodyne	CPT1A	30	40
CCOC(=O)c1cnn(C2CCN(c3noc(-c4ccccc4)n3)CC2)c1	ZINC000450636124	FF	On-Demand	Anodyne	S1PR4	27	40
CCOC(=O)c1cnn(C2CCN(c3noc(-c4ccccc4)n3)CC2)c1	ZINC000450636124	FF	On-Demand	Anodyne	SOAT1	0	40
CCOC(=O)c1cnn(C2CCN(c3noc(-c4ccccc4)n3)CC2)c1	ZINC000450636124	FF	On-Demand	Anodyne	S1PR1	37	40
CCOC(=O)c1cnn(C2CCN(c3noc(-c4ccccc4)n3)CC2)c1	ZINC000450636124	FF	On-Demand	Anodyne	MAP3K7	41	35
CCOC(=O)c1cnn(C2CCN(c3ccc(C(F)(F)F)c(C#N)n3)CC2)c1	ZINC000450636125	GG	On-Demand	Mild	P2RY12	47	39
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450636127	GE	On-Demand	Anodyne	PDE3A	47	39
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450636127	GE	On-Demand	Anodyne	PDGFRB	89	47
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450636127	GE	On-Demand	Anodyne	PDE3B	70	39
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450636127	GE	On-Demand	Anodyne	PDGFRA	18	41
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450636128	GE	On-Demand	Anodyne	PDE3A	47	39
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450636128	GE	On-Demand	Anodyne	PDGFRB	89	47
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450636128	GE	On-Demand	Anodyne	PDE3B	70	39
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450636128	GE	On-Demand	Anodyne	PDGFRA	18	41
CC(C)(C[C@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)C1)C(N)=O	ZINC000450636133	FH	On-Demand	Mild	HSD11B1	15	45
CC(C)(C[C@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)C1)C(N)=O	ZINC000450636133	FH	On-Demand	Mild	GPBAR1	22	41
CC(C)(C[C@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)C1)C(N)=O	ZINC000450636133	FH	On-Demand	Mild	ERG	0	41
CC(C)(C[C@@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)C1)C(N)=O	ZINC000450636134	FH	On-Demand	Mild	HSD11B1	15	45
CC(C)(C[C@@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)C1)C(N)=O	ZINC000450636134	FH	On-Demand	Mild	GPBAR1	22	41
CC(C)(C[C@@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)C1)C(N)=O	ZINC000450636134	FH	On-Demand	Mild	ERG	0	41
CCOC(=O)c1cnn(C2CCN(c3nc4ccc(OC)cc4nc3C)CC2)c1	ZINC000450636135	GG	On-Demand	Anodyne	P2RY12	23	41
CCOC(=O)c1cnn(C2CCN(c3ncc(C(N)=O)cc3Cl)CC2)c1	ZINC000450636140	GE	On-Demand	Anodyne	P2RY12	55	55
CCOC(=O)c1cnn(C2CCN(c3ncc(C(N)=O)cc3Cl)CC2)c1	ZINC000450636140	GE	On-Demand	Anodyne	CXCR3	33	47
CCNC(=O)c1ccc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nn1	ZINC000450636156	ED	On-Demand	Anodyne	SCD1	47	41
CCNC(=O)c1ccc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nn1	ZINC000450636156	ED	On-Demand	Anodyne	SCD	23	47
CCNC(=O)c1ccc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nn1	ZINC000450636157	ED	On-Demand	Anodyne	SCD1	47	41
CCNC(=O)c1ccc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nn1	ZINC000450636157	ED	On-Demand	Anodyne	SCD	23	47
CC(C)c1ccc(C[C@H]2CCN(C(=O)C3(CF)CCOCC3)C2)cc1	ZINC000450636158	EH	On-Demand	Anodyne	FKBP1A	0	43
CC(C)c1ccc(C[C@@H]2CCN(C(=O)C3(CF)CCOCC3)C2)cc1	ZINC000450636159	EH	On-Demand	Anodyne	FKBP1A	0	43
CC(C)CC(CC(C)C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450636160	FG	On-Demand	Anodyne	SCN10A	19	42
CC(C)CC(CC(C)C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450636160	FG	On-Demand	Anodyne	STAT6	54	33
CCOCc1nc(C)c(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)s1	ZINC000450636166	GE	On-Demand	Anodyne	SCD1	42	42
CCOCc1nc(C)c(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)s1	ZINC000450636166	GE	On-Demand	Anodyne	SCD	33	42
CCC[C@@H](NC(=O)CC1(O)CCC1)C(=O)OC(C)(C)C	ZINC000450636167	CD	On-Demand	Anodyne	CTSK	21	40
CCC[C@H](NC(=O)CC1(O)CCC1)C(=O)OC(C)(C)C	ZINC000450636168	CD	On-Demand	Anodyne	CTSK	21	40
CC(C)(C[C@@H]1CCCN(c2ccc(S(=O)(=O)NCC3CC3)cn2)C1)C(N)=O	ZINC000450636169	GD	On-Demand	Anodyne	GCKR	15	41
CC(C)(C[C@H]1CCCN(c2ccc(S(=O)(=O)NCC3CC3)cn2)C1)C(N)=O	ZINC000450636170	GD	On-Demand	Anodyne	GCKR	15	41
CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)CC1(O)CCC1	ZINC000450636171	DG	On-Demand	Anodyne	BIRC2	45	33
CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)CC1(O)CCC1	ZINC000450636172	DG	On-Demand	Anodyne	BIRC2	45	33
CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)CC1(O)CCC1	ZINC000450636173	DG	On-Demand	Anodyne	BIRC2	45	33
CC(C)[C@@H]1CCc2ccccc2[C@H]1NC(=O)CC1(O)CCC1	ZINC000450636174	DG	On-Demand	Anodyne	BIRC2	45	33
CCS(=O)(=O)c1ccc(CN2CC(c3nc4ccccc4s3)C2)cc1	ZINC000450636180	FH	On-Demand	Anodyne	LTA4H	20	41
CCOC(=O)c1cnn(C2CCN(c3ccc(C(F)(F)F)c(C#N)c3)CC2)c1	ZINC000450636182	GH	On-Demand	Mild	P2RY12	56	41
CN(CCCn1ccnc1)CCc1c(Cl)cccc1Cl	ZINC000450636188	DH	On-Demand	Anodyne	TBXAS1	41	46
CN(CCCn1ccnc1)CCc1c(Cl)cccc1Cl	ZINC000450636188	DH	On-Demand	Anodyne	CYP17A1	0	47
CN(CCCn1ccnc1)CCc1c(Cl)cccc1Cl	ZINC000450636188	DH	On-Demand	Anodyne	HMOX2	50	38
CC(C)(C[C@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)C1)C(N)=O	ZINC000450636190	FH	On-Demand	Mild	PGR	15	42
CC(C)(C[C@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)C1)C(N)=O	ZINC000450636190	FH	On-Demand	Mild	AR	55	42
CC(C)(C[C@@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)C1)C(N)=O	ZINC000450636191	FH	On-Demand	Mild	PGR	15	42
CC(C)(C[C@@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)C1)C(N)=O	ZINC000450636191	FH	On-Demand	Mild	AR	55	42
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccc(F)cc34)CC2)c1	ZINC000450636192	GH	On-Demand	Anodyne	GYRB	22	53
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccc(F)cc34)CC2)c1	ZINC000450636192	GH	On-Demand	Anodyne	DHODH	52	36
CC(=O)N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC12CCCCC2	ZINC000450636195	EG	On-Demand	Anodyne	SLC12A5	42	33
CC(=O)N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC12CCCCC2	ZINC000450636196	EG	On-Demand	Anodyne	SLC12A5	42	33
CC(=O)N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC12CCCCC2	ZINC000450636197	EG	On-Demand	Anodyne	SLC12A5	42	33
CC(=O)N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC12CCCCC2	ZINC000450636198	EG	On-Demand	Anodyne	SLC12A5	42	33
CCOC(=O)c1sc(Sc2cc(C)nc(OC)n2)nc1C	ZINC000450636219	EF	On-Demand	Anodyne	DHODH	22	42
FC(F)CN1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450636231	DG	On-Demand	Anodyne	DRD4	17	47
FC(F)CN1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450636231	DG	On-Demand	Anodyne	SLC6A3	19	40
FC(F)CN1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450636231	DG	On-Demand	Anodyne	SIGMAR1	32	49
FC(F)CN1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450636231	DG	On-Demand	Anodyne	ABCC1	40	33
FC(F)CN1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450636231	DG	On-Demand	Anodyne	O19067_PIG	0	40
FC(F)CN1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450636231	DG	On-Demand	Anodyne	L3MBTL3	29	40
FC(F)CN1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450636231	DG	On-Demand	Anodyne	KCNJ1	28	40
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@@H](C)O	ZINC000450636248	DC	On-Demand	Anodyne	TRPV1	37	40
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@@H](C)O	ZINC000450636248	DC	On-Demand	Anodyne	PDE6A	40	32
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@@H](C)O	ZINC000450636248	DC	On-Demand	Anodyne	NCE103	29	45
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@@H](C)O	ZINC000450636248	DC	On-Demand	Anodyne	CAN2	0	45
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@H](C)O	ZINC000450636249	DC	On-Demand	Anodyne	TRPV1	37	40
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@H](C)O	ZINC000450636249	DC	On-Demand	Anodyne	PDE6A	40	32
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@H](C)O	ZINC000450636249	DC	On-Demand	Anodyne	NCE103	29	45
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@H](C)O	ZINC000450636249	DC	On-Demand	Anodyne	CAN2	0	45
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@@H](C)O	ZINC000450636250	DC	On-Demand	Anodyne	TRPV1	37	40
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@@H](C)O	ZINC000450636250	DC	On-Demand	Anodyne	PDE6A	40	32
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@@H](C)O	ZINC000450636250	DC	On-Demand	Anodyne	NCE103	29	45
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@@H](C)O	ZINC000450636250	DC	On-Demand	Anodyne	CAN2	0	45
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@H](C)O	ZINC000450636251	DC	On-Demand	Anodyne	TRPV1	37	40
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@H](C)O	ZINC000450636251	DC	On-Demand	Anodyne	PDE6A	40	32
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@H](C)O	ZINC000450636251	DC	On-Demand	Anodyne	NCE103	29	45
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)[C@H](C)O	ZINC000450636251	DC	On-Demand	Anodyne	CAN2	0	45
CCOC(=O)c1sc(Sc2ccc(CC(=O)OC)cc2[N+](=O)[O-])nc1C	ZINC000450636255	GG	On-Demand	Bother	GSTM2	48	40
CCOC(=O)c1sc(Sc2ccc(CC(=O)OC)cc2[N+](=O)[O-])nc1C	ZINC000450636255	GG	On-Demand	Bother	GSTP1	36	40
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	F2	24	40
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	PRSS1	15	41
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	ACE	38	43
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	P2RY12	72	39
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	ITGAL	41	33
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	MME	66	38
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CASR	23	41
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	MC4R	64	42
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CTRA_BOVIN	38	46
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	FCER2	41	33
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	TACR2	29	40
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CTSB	32	50
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	TRY2_BOVIN	108	46
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	PAPA1_CARPA	19	44
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CYSP_TRYCR	48	47
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CCKAR	57	40
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CTSK	16	40
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CTSL	42	39
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CCR1	20	43
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CCR3	0	46
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CYP51A1	21	42
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CCKBR	27	42
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CTSS	40	44
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CAPN1	42	38
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	ACE2	72	35
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	CTSV	41	42
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	ST14	99	38
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	BLA1_STEMA	44	35
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	PSMB8	47	38
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	BRCA1	45	38
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	TMPRSS6	48	30
CSc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636256	GF	On-Demand	Anodyne	DERP1	0	50
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	F2	24	40
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	PRSS1	15	41
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	ACE	38	43
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	P2RY12	72	39
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	ITGAL	41	33
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	MME	66	38
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CASR	23	41
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	MC4R	64	42
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CTRA_BOVIN	38	46
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	FCER2	41	33
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	TACR2	29	40
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CTSB	32	50
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	TRY2_BOVIN	108	46
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	PAPA1_CARPA	19	44
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CYSP_TRYCR	48	47
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CCKAR	57	40
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CTSK	16	40
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CTSL	42	39
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CCR1	20	43
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CCR3	0	46
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CYP51A1	21	42
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CCKBR	27	42
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CTSS	40	44
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CAPN1	42	38
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	ACE2	72	35
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	CTSV	41	42
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	ST14	99	38
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	BLA1_STEMA	44	35
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	PSMB8	47	38
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	BRCA1	45	38
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	TMPRSS6	48	30
CSc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)c1	ZINC000450636257	GF	On-Demand	Anodyne	DERP1	0	50
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636260	EC	On-Demand	Anodyne	PAPA1_CARPA	47	35
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636260	EC	On-Demand	Anodyne	HLA-A	52	39
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636260	EC	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636260	EC	On-Demand	Anodyne	CAPN1	42	36
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636260	EC	On-Demand	Anodyne	CAPN2	58	33
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636261	EC	On-Demand	Anodyne	PAPA1_CARPA	47	35
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636261	EC	On-Demand	Anodyne	HLA-A	52	39
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636261	EC	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636261	EC	On-Demand	Anodyne	CAPN1	42	36
COC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636261	EC	On-Demand	Anodyne	CAPN2	58	33
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636262	EC	On-Demand	Anodyne	PAPA1_CARPA	47	35
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636262	EC	On-Demand	Anodyne	HLA-A	52	39
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636262	EC	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636262	EC	On-Demand	Anodyne	CAPN1	42	36
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@H](C)O	ZINC000450636262	EC	On-Demand	Anodyne	CAPN2	58	33
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636263	EC	On-Demand	Anodyne	PAPA1_CARPA	47	35
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636263	EC	On-Demand	Anodyne	HLA-A	52	39
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636263	EC	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636263	EC	On-Demand	Anodyne	CAPN1	42	36
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)[C@@H](C)O	ZINC000450636263	EC	On-Demand	Anodyne	CAPN2	58	33
N#CC1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CCC1	ZINC000450636264	FH	On-Demand	Mild	SIGMAR1	25	63
N#CC1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CCC1	ZINC000450636264	FH	On-Demand	Mild	KCNJ1	45	41
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	GHRHR	40	32
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	P2RY12	152	41
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	MC4R	68	40
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	CMA1	44	33
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	CTRA_BOVIN	50	32
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	CTSB	21	41
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	TRY2_BOVIN	82	39
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	CYSP_TRYCR	30	42
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	PREP	21	40
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	CCKBR	50	39
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	CAPN1	40	35
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	PGA5	44	32
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	ST14	51	34
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	HDA106	0	42
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	PSMB8	52	37
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	CES1D	44	30
Cc1cnc(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636267	GD	On-Demand	Anodyne	DERP1	0	41
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	GHRHR	40	32
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	P2RY12	152	41
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	MC4R	68	40
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	CMA1	44	33
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	CTRA_BOVIN	50	32
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	CTSB	21	41
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	TRY2_BOVIN	82	39
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	CYSP_TRYCR	30	42
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	PREP	21	40
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	CCKBR	50	39
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	CAPN1	40	35
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	PGA5	44	32
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	ST14	51	34
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	HDA106	0	42
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	PSMB8	52	37
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	CES1D	44	30
Cc1cnc(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)o1	ZINC000450636268	GD	On-Demand	Anodyne	DERP1	0	41
C[C@H](O)CCN1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000450636271	CE	On-Demand	Anodyne	CACNA1C	15	41
C[C@H](O)CCN1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000450636271	CE	On-Demand	Anodyne	SIGMAR1	19	55
C[C@H](O)CCN1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000450636271	CE	On-Demand	Anodyne	CACNA1B	23	41
C[C@H](O)CCN1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000450636272	CE	On-Demand	Anodyne	CACNA1C	15	41
C[C@H](O)CCN1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000450636272	CE	On-Demand	Anodyne	SIGMAR1	19	55
C[C@H](O)CCN1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000450636272	CE	On-Demand	Anodyne	CACNA1B	23	41
C[C@H](O)CCN1C[C@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000450636273	CE	On-Demand	Anodyne	CACNA1C	15	41
C[C@H](O)CCN1C[C@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000450636273	CE	On-Demand	Anodyne	SIGMAR1	19	55
C[C@H](O)CCN1C[C@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000450636273	CE	On-Demand	Anodyne	CACNA1B	23	41
C[C@H](O)CCN1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000450636274	CE	On-Demand	Anodyne	CACNA1C	15	41
C[C@H](O)CCN1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000450636274	CE	On-Demand	Anodyne	SIGMAR1	19	55
C[C@H](O)CCN1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000450636274	CE	On-Demand	Anodyne	CACNA1B	23	41
COC(=O)[C@H](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)[C@@H](C)O	ZINC000450636275	FD	On-Demand	Anodyne	ACACA	43	40
COC(=O)[C@H](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)[C@@H](C)O	ZINC000450636275	FD	On-Demand	Anodyne	MTNR1B	28	43
COC(=O)[C@@H](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)[C@@H](C)O	ZINC000450636276	FD	On-Demand	Anodyne	ACACA	43	40
COC(=O)[C@@H](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)[C@@H](C)O	ZINC000450636276	FD	On-Demand	Anodyne	MTNR1B	28	43
COC(=O)[C@H](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)[C@H](C)O	ZINC000450636277	FD	On-Demand	Anodyne	ACACA	43	40
COC(=O)[C@H](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)[C@H](C)O	ZINC000450636277	FD	On-Demand	Anodyne	MTNR1B	28	43
COC(=O)[C@@H](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)[C@H](C)O	ZINC000450636278	FD	On-Demand	Anodyne	ACACA	43	40
COC(=O)[C@@H](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)[C@H](C)O	ZINC000450636278	FD	On-Demand	Anodyne	MTNR1B	28	43
COc1ccc([C@@H](CO)N(C)C(=O)Cc2cc3ccccc3s2)cc1	ZINC000450636290	FH	On-Demand	Anodyne	DXR	24	40
COc1ccc([C@H](CO)N(C)C(=O)Cc2cc3ccccc3s2)cc1	ZINC000450636291	FH	On-Demand	Anodyne	DXR	24	40
CCOC(=O)c1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)on1	ZINC000450636304	GD	On-Demand	Anodyne	CDK1	19	41
CCOC(=O)c1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)on1	ZINC000450636304	GD	On-Demand	Anodyne	CDK4	0	41
CCCCn1c(SCc2nc(C(=O)OC)cs2)nc2ccccc2c1=O	ZINC000450636307	GH	On-Demand	Anodyne	PTGDR2	15	40
Cc1ccc2c(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ccnc2n1	ZINC000450636311	EF	On-Demand	Anodyne	CHRNA4	28	45
CCC[C@@H](OC)C(=O)NCCCC(=O)OC(C)C	ZINC000450636312	CD	On-Demand	Anodyne	TLR2	0	40
CCC[C@H](OC)C(=O)NCCCC(=O)OC(C)C	ZINC000450636313	CD	On-Demand	Anodyne	TLR2	0	40
c1ccc(CC[C@@H]2CCCCN2Cc2nnc(C3CC3)s2)cc1	ZINC000450636332	EI	On-Demand	Anodyne	SLC18A2	50	42
c1ccc(CC[C@H]2CCCCN2Cc2nnc(C3CC3)s2)cc1	ZINC000450636333	EI	On-Demand	Anodyne	SLC18A2	50	42
c1ccc(CC[C@@H]2CCCCN2C[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450636336	CI	On-Demand	Anodyne	SLC18A2	49	43
c1ccc(CC[C@H]2CCCCN2C[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450636337	CI	On-Demand	Anodyne	SLC18A2	49	43
c1ccc(CC[C@H]2CCCCN2C[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450636338	CI	On-Demand	Anodyne	SLC18A2	49	43
c1ccc(CC[C@@H]2CCCCN2C[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450636339	CI	On-Demand	Anodyne	SLC18A2	49	43
CC(C)c1cnc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1	ZINC000450636344	DG	On-Demand	Anodyne	CHRNA4	29	45
COc1cccc2c(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)nccc12	ZINC000450636345	EG	On-Demand	Anodyne	CHRNA4	28	45
COc1ccc(-c2nnc(S[C@H](C)C(=O)C3CCCCC3)o2)cc1OC	ZINC000450636356	GI	On-Demand	Anodyne	STK17B	49	45
COc1ccc(-c2nnc(S[C@H](C)C(=O)C3CCCCC3)o2)cc1OC	ZINC000450636356	GI	On-Demand	Anodyne	STK17A	15	41
COc1ccc(-c2nnc(S[C@H](C)C(=O)C3CCCCC3)o2)cc1OC	ZINC000450636356	GI	On-Demand	Anodyne	SCARB1	22	43
COc1ccc(-c2nnc(S[C@@H](C)C(=O)C3CCCCC3)o2)cc1OC	ZINC000450636357	GI	On-Demand	Anodyne	STK17B	49	45
COc1ccc(-c2nnc(S[C@@H](C)C(=O)C3CCCCC3)o2)cc1OC	ZINC000450636357	GI	On-Demand	Anodyne	STK17A	15	41
COc1ccc(-c2nnc(S[C@@H](C)C(=O)C3CCCCC3)o2)cc1OC	ZINC000450636357	GI	On-Demand	Anodyne	SCARB1	22	43
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450636361	GF	On-Demand	Anodyne	P2RX7	24	40
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450636361	GF	On-Demand	Anodyne	CDK2	15	52
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450636361	GF	On-Demand	Anodyne	CDK1	26	52
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450636361	GF	On-Demand	Anodyne	CDK4	26	52
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450636361	GF	On-Demand	Anodyne	CALCA	0	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2cncc(SCc3ccccc3)n2)C1	ZINC000450636377	GH	On-Demand	Anodyne	CHRNA4	30	53
O=C(CS(=O)(=O)C1CC1)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450636379	GG	On-Demand	Anodyne	CCR2	59	38
O=C(CS(=O)(=O)C1CC1)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450636379	GG	On-Demand	Anodyne	PHES	0	42
O=C(CS(=O)(=O)C1CC1)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450636380	GG	On-Demand	Anodyne	CCR2	59	38
O=C(CS(=O)(=O)C1CC1)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450636380	GG	On-Demand	Anodyne	PHES	0	42
CC[C@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450636399	CF	On-Demand	Anodyne	CHRM5	36	42
CC[C@H](CO)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450636399	CF	On-Demand	Anodyne	ACE2	51	35
CC(C)(C[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)C1)C(N)=O	ZINC000450636408	FF	On-Demand	Bother	SIRT3	54	32
CC(C)(C[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)C1)C(N)=O	ZINC000450636408	FF	On-Demand	Bother	SIRT1	51	31
CC(C)(C[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)C1)C(N)=O	ZINC000450636409	FF	On-Demand	Bother	SIRT3	54	32
CC(C)(C[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)C1)C(N)=O	ZINC000450636409	FF	On-Demand	Bother	SIRT1	51	31
C=CCC1(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)CCCCC1	ZINC000450636414	FG	On-Demand	Mild	STAT6	50	34
Cc1cc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)nn1C(C)C	ZINC000450636422	FE	On-Demand	Anodyne	STAT6	48	33
CCOC(=O)c1cnn(C2CCN(c3ncccn3)CC2)c1	ZINC000450636423	DD	On-Demand	Anodyne	MAP3K7	43	32
COC(=O)c1ccc(CN2CCC3(CC2)NC(=O)N(C)C3=O)cc1Cl	ZINC000450636432	FD	On-Demand	Anodyne	ADAM17	15	41
CCOC(=O)c1cc(C(=O)NCCc2nnc(-c3ccccc3)n2C)on1	ZINC000450636449	FD	On-Demand	Anodyne	DGAT1	25	40
CCOC(=O)c1cnn(C2CCN(c3nc(-c4ccc(C)cc4)no3)CC2)c1	ZINC000450636452	GG	On-Demand	Anodyne	MTOR	54	38
COc1cccc(OCCC(=O)NCc2ccnc(N(C)C)n2)c1	ZINC000450636453	ED	On-Demand	Anodyne	ROCK1	27	40
COc1cccc(OCCC(=O)NCc2ccnc(N(C)C)n2)c1	ZINC000450636453	ED	On-Demand	Anodyne	MTNR1A	62	43
COc1cccc(OCCC(=O)NCc2ccnc(N(C)C)n2)c1	ZINC000450636453	ED	On-Demand	Anodyne	MTNR1B	49	43
COc1cccc(OCCC(=O)NCc2ccnc(N(C)C)n2)c1	ZINC000450636453	ED	On-Demand	Anodyne	SUCNR1	33	44
CCOC(=O)C1([S@@](C)=O)CCN(c2noc(-c3ccccc3)n2)CC1	ZINC000450636454	FE	On-Demand	Anodyne	DGAT1	19	40
CCOC(=O)C1([S@](C)=O)CCN(c2noc(-c3ccccc3)n2)CC1	ZINC000450636455	FE	On-Demand	Anodyne	DGAT1	19	40
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1cc2cccnc2s1	ZINC000450636456	FF	On-Demand	Anodyne	SCN10A	22	44
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1cc2cccnc2s1	ZINC000450636456	FF	On-Demand	Anodyne	STAT6	57	35
CCOC(=O)c1cnn(C2CCN(c3ccnc(C(N)=O)c3)CC2)c1	ZINC000450636469	ED	On-Demand	Anodyne	MAP3K7	46	33
CC[C@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450636476	BC	On-Demand	Anodyne	ENPP2	19	40
CC[C@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450636476	BC	On-Demand	Anodyne	HPGDS	16	45
CO[C@]1(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CCOC1	ZINC000450636486	ED	On-Demand	Anodyne	CTSS	22	41
CO[C@@]1(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CCOC1	ZINC000450636487	ED	On-Demand	Anodyne	CTSS	22	41
CCC[C@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450636488	EH	On-Demand	Anodyne	P2RY12	86	38
CCC[C@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450636488	EH	On-Demand	Anodyne	PAPA1_CARPA	42	37
CCC[C@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450636488	EH	On-Demand	Anodyne	CTSK	19	40
CCC[C@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450636488	EH	On-Demand	Anodyne	CTRB_BOVIN	46	37
CCC[C@@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450636489	EH	On-Demand	Anodyne	P2RY12	86	38
CCC[C@@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450636489	EH	On-Demand	Anodyne	PAPA1_CARPA	42	37
CCC[C@@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450636489	EH	On-Demand	Anodyne	CTSK	19	40
CCC[C@@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450636489	EH	On-Demand	Anodyne	CTRB_BOVIN	46	37
CSc1cccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c1	ZINC000450636493	FF	On-Demand	Anodyne	DRD4	41	33
CSc1cccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c1	ZINC000450636493	FF	On-Demand	Anodyne	SCN10A	25	45
CSc1cccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c1	ZINC000450636493	FF	On-Demand	Anodyne	STAT6	51	35
CCC[C@H](NC(=O)CCCn1nc(C)nc1C)C(=O)OC(C)(C)C	ZINC000450636494	EE	On-Demand	Anodyne	NOD1	61	35
C=CC(C)(C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450636495	CF	On-Demand	Mild	SMO	41	33
C=CC(C)(C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450636495	CF	On-Demand	Mild	ETHR	66	51
CCC[C@@H](NC(=O)CCCn1nc(C)nc1C)C(=O)OC(C)(C)C	ZINC000450636496	EE	On-Demand	Anodyne	NOD1	61	35
CC(C)(C[C@H]1CCCN(c2ccccn2)C1)C(N)=O	ZINC000450636497	CE	On-Demand	Anodyne	GRM1	0	51
CC(C)(C[C@H]1CCCN(c2ccccn2)C1)C(N)=O	ZINC000450636497	CE	On-Demand	Anodyne	PRKCQ	0	40
CC(C)(C[C@H]1CCCN(c2ccccn2)C1)C(N)=O	ZINC000450636497	CE	On-Demand	Anodyne	GPBAR1	0	47
CC(C)(C[C@@H]1CCCN(c2ccccn2)C1)C(N)=O	ZINC000450636498	CE	On-Demand	Anodyne	GRM1	0	51
CC(C)(C[C@@H]1CCCN(c2ccccn2)C1)C(N)=O	ZINC000450636498	CE	On-Demand	Anodyne	PRKCQ	0	40
CC(C)(C[C@@H]1CCCN(c2ccccn2)C1)C(N)=O	ZINC000450636498	CE	On-Demand	Anodyne	GPBAR1	0	47
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1cn(-c2cccnc2)nn1	ZINC000450636499	GC	On-Demand	Anodyne	SCN10A	22	44
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1cn(-c2cccnc2)nn1	ZINC000450636499	GC	On-Demand	Anodyne	STAT6	61	35
CCCc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)no1	ZINC000450636507	FE	On-Demand	Anodyne	BACE2	15	40
CCCc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)no1	ZINC000450636507	FE	On-Demand	Anodyne	CDK1	20	40
CCCc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)no1	ZINC000450636507	FE	On-Demand	Anodyne	CDK4	22	40
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(COc2ccccc2OC)o1	ZINC000450636531	GD	On-Demand	Anodyne	AGTR2	51	34
CCCOc1ccc(C(=O)NC[C@@]2(OC)CCOC2)c(OC)c1	ZINC000450636540	DE	On-Demand	Anodyne	HCN1	50	32
CCCOc1ccc(C(=O)NC[C@@]2(OC)CCOC2)c(OC)c1	ZINC000450636540	DE	On-Demand	Anodyne	HCN4	48	32
CCCOc1ccc(C(=O)NC[C@]2(OC)CCOC2)c(OC)c1	ZINC000450636541	DE	On-Demand	Anodyne	HCN1	50	32
CCCOc1ccc(C(=O)NC[C@]2(OC)CCOC2)c(OC)c1	ZINC000450636541	DE	On-Demand	Anodyne	HCN4	48	32
CCOC(=O)c1cnn(C2CCN(c3ccnc(N4CCOCC4)n3)CC2)c1	ZINC000450636550	GD	On-Demand	Anodyne	PIK3CA	44	40
CCOC(=O)c1cnn(C2CCN(c3ccnc(N4CCOCC4)n3)CC2)c1	ZINC000450636550	GD	On-Demand	Anodyne	MTOR	76	40
CCOC(=O)c1cnn(C2CCN(c3ncc(S(N)(=O)=O)s3)CC2)c1	ZINC000450636552	GD	On-Demand	Anodyne	P2RY12	24	41
CC(C)OC(=O)CCCNC(=O)CC1CC(F)(F)C1	ZINC000450636556	CE	On-Demand	Anodyne	EPHX2	31	49
CCOC(=O)c1sc(Sc2ncc([N+](=O)[O-])cc2C)nc1C	ZINC000450636567	EG	On-Demand	Bother	DHODH	18	40
CC[C@H]1CCC[C@H]1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450636576	FF	On-Demand	Anodyne	CDK4	22	40
CC[C@@H]1CCC[C@H]1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450636577	FF	On-Demand	Anodyne	CDK4	22	40
CC[C@H]1CCC[C@@H]1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450636578	FF	On-Demand	Anodyne	CDK4	22	40
CC[C@@H]1CCC[C@@H]1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450636580	FF	On-Demand	Anodyne	CDK4	22	40
CN(Cc1ccccc1OC1CC1)CC1CCN(c2ccncc2)CC1	ZINC000450636588	FH	On-Demand	Anodyne	SCD1	27	42
CC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@H](C)O	ZINC000450636590	CD	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@H](C)O	ZINC000450636590	CD	On-Demand	Anodyne	PGA	40	31
CC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@H](C)O	ZINC000450636590	CD	On-Demand	Anodyne	NPR	0	45
CC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@@H](C)O	ZINC000450636591	CD	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@@H](C)O	ZINC000450636591	CD	On-Demand	Anodyne	PGA	40	31
CC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@@H](C)O	ZINC000450636591	CD	On-Demand	Anodyne	NPR	0	45
CC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@H](C)O	ZINC000450636592	CD	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@H](C)O	ZINC000450636592	CD	On-Demand	Anodyne	PGA	40	31
CC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@H](C)O	ZINC000450636592	CD	On-Demand	Anodyne	NPR	0	45
CC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@@H](C)O	ZINC000450636593	CD	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@@H](C)O	ZINC000450636593	CD	On-Demand	Anodyne	PGA	40	31
CC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@@H](C)O	ZINC000450636593	CD	On-Demand	Anodyne	NPR	0	45
CC(C)OC(=O)CCCNC(=O)C1CC(C)(O)C1	ZINC000450636604	CC	On-Demand	Anodyne	EPHX2	31	50
CCc1cccc(C(=O)N[C@@H](CC(F)(F)F)C(=O)OC)n1	ZINC000450636608	DD	On-Demand	Anodyne	PDE5A	27	44
CCc1cccc(C(=O)N[C@H](CC(F)(F)F)C(=O)OC)n1	ZINC000450636610	DD	On-Demand	Anodyne	PDE5A	27	44
CC(F)(F)C(C)(C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450636612	CH	On-Demand	Anodyne	TRPV1	20	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C)[C@@H](C)C1	ZINC000450636614	CG	On-Demand	Anodyne	OPRM1	15	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C)[C@@H](C)C1	ZINC000450636614	CG	On-Demand	Anodyne	OPRK1	28	46
C[C@@H]1CN(C[C@H](O)[C@@H](C)c2ccccc2)CC[C@H]1C	ZINC000450636616	CG	On-Demand	Anodyne	OPRM1	15	46
C[C@@H]1CN(C[C@H](O)[C@@H](C)c2ccccc2)CC[C@H]1C	ZINC000450636616	CG	On-Demand	Anodyne	OPRK1	28	46
Cc1ccccc1-n1c(SCCC(C)(F)F)nnc1-c1ccncc1	ZINC000450636620	FJ	On-Demand	Anodyne	SLC6A9	20	41
Cc1ccccc1-n1c(SCCC(C)(F)F)nnc1-c1ccncc1	ZINC000450636620	FJ	On-Demand	Anodyne	SLC6A5	28	41
C[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)CC[C@H]1C	ZINC000450636621	CG	On-Demand	Anodyne	OPRM1	15	46
C[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)CC[C@H]1C	ZINC000450636621	CG	On-Demand	Anodyne	OPRK1	28	46
CCOC(=O)c1ccc(CN2C[C@@H](O)[C@H](CC)C2)nc1	ZINC000450636622	CD	On-Demand	Anodyne	MTAP	0	40
C[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C[C@@H]1C	ZINC000450636623	CG	On-Demand	Anodyne	OPRM1	15	46
C[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C[C@@H]1C	ZINC000450636623	CG	On-Demand	Anodyne	OPRK1	28	46
CCOC(=O)c1ccc(CN2C[C@H](CC)[C@@H](O)C2)nc1	ZINC000450636626	CD	On-Demand	Anodyne	MTAP	0	40
CCOC(=O)c1ccc(CN2C[C@H](O)[C@H](CC)C2)nc1	ZINC000450636628	CD	On-Demand	Anodyne	MTAP	0	40
CCOC(=O)c1ccc(CN2C[C@@H](O)[C@@H](CC)C2)nc1	ZINC000450636630	CD	On-Demand	Anodyne	MTAP	0	40
CC(C)(C(=O)NCc1ccc(C(F)F)cc1)C1CCC1	ZINC000450636631	CI	On-Demand	Anodyne	F2R	0	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636632	CF	On-Demand	Anodyne	ACE	76	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636632	CF	On-Demand	Anodyne	MME	55	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636632	CF	On-Demand	Anodyne	AGTR2	46	33
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636632	CF	On-Demand	Anodyne	ACE2	59	36
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636632	CF	On-Demand	Anodyne	BRCA1	53	32
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636634	CF	On-Demand	Anodyne	ACE	76	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636634	CF	On-Demand	Anodyne	MME	55	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636634	CF	On-Demand	Anodyne	AGTR2	46	33
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636634	CF	On-Demand	Anodyne	ACE2	59	36
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636634	CF	On-Demand	Anodyne	BRCA1	53	32
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636635	CF	On-Demand	Anodyne	ACE	76	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636635	CF	On-Demand	Anodyne	MME	55	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636635	CF	On-Demand	Anodyne	AGTR2	46	33
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636635	CF	On-Demand	Anodyne	ACE2	59	36
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]1C(C)C	ZINC000450636635	CF	On-Demand	Anodyne	BRCA1	53	32
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636636	CF	On-Demand	Anodyne	ACE	76	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636636	CF	On-Demand	Anodyne	MME	55	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636636	CF	On-Demand	Anodyne	AGTR2	46	33
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636636	CF	On-Demand	Anodyne	ACE2	59	36
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]1C(C)C	ZINC000450636636	CF	On-Demand	Anodyne	BRCA1	53	32
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	HTR1A	82	64
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	DRD2	83	64
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	DRD1	40	52
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	DRD4	70	52
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	ADRA1D	30	47
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	HTR2A	69	64
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	HTR2C	45	54
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	ADRA1A	28	47
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	HRH1	22	64
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	DRD3	67	63
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	DRD5	27	43
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	HTR7	96	51
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	SIGMAR1	29	52
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	HTR6	0	48
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	ABCB1	0	41
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	CYP2J2	62	43
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	NET	0	48
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccccc1	ZINC000450636641	EG	On-Demand	Anodyne	AP2S1	0	47
CC[C@H](CC(C)C)C(=O)NCCCC(=O)OC(C)C	ZINC000450636647	CF	On-Demand	Anodyne	TLR2	0	41
CC[C@@H](CC(C)C)C(=O)NCCCC(=O)OC(C)C	ZINC000450636648	CF	On-Demand	Anodyne	TLR2	0	41
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450636649	GF	On-Demand	Anodyne	DRD4	20	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450636650	GF	On-Demand	Anodyne	DRD4	20	50
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450636651	GF	On-Demand	Anodyne	DRD4	20	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450636652	GF	On-Demand	Anodyne	DRD4	20	50
CCOC(=O)c1sc(Sc2cc(C(C)C)ncn2)nc1C	ZINC000450636656	DH	On-Demand	Anodyne	DHODH	20	43
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	ACE	29	40
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	GHRHR	62	33
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	P2RY12	54	38
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	MME	53	41
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	MC4R	84	44
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	CTSB	25	42
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	TRY2_BOVIN	83	42
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	CYSP_TRYCR	26	45
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	CCKAR	43	37
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	MC3R	46	39
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	MC5R	71	39
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	CCKBR	31	46
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	CTSS	22	45
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	CAPN1	46	36
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	ACE2	70	35
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	PGA5	45	32
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	ST14	52	33
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	PSMB8	43	40
O=C(CC1(O)CCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636663	EC	On-Demand	Anodyne	DERP1	0	42
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	ACE	29	40
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	GHRHR	62	33
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	P2RY12	54	38
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	MME	53	41
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	MC4R	84	44
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	CTSB	25	42
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	TRY2_BOVIN	83	42
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	CYSP_TRYCR	26	45
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	CCKAR	43	37
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	MC3R	46	39
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	MC5R	71	39
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	CCKBR	31	46
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	CTSS	22	45
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	CAPN1	46	36
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	ACE2	70	35
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	PGA5	45	32
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	ST14	52	33
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	PSMB8	43	40
O=C(CC1(O)CCC1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450636667	EC	On-Demand	Anodyne	DERP1	0	42
COc1ccc([C@H](CO)N(C)C(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450636668	FH	On-Demand	Anodyne	PPARD	43	38
COc1ccc([C@@H](CO)N(C)C(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450636669	FH	On-Demand	Anodyne	PPARD	43	38
CCn1nnc(C)c1CSc1nnc(-c2ccc(OC)c(OC)c2)o1	ZINC000450636677	FF	On-Demand	Anodyne	GSK3B	0	45
CCn1nnc(C)c1CSc1nnc(-c2ccc(OC)c(OC)c2)o1	ZINC000450636677	FF	On-Demand	Anodyne	GSK3A	39	42
CCn1nnc(C)c1CSc1nnc(-c2ccc(OC)c(OC)c2)o1	ZINC000450636677	FF	On-Demand	Anodyne	TERT	23	40
CCc1c(C)nc2ccccc2c1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000450636682	FH	On-Demand	Anodyne	CHRNA4	29	49
COc1cc(CC(=O)N2CC[C@@H]2C(C)C)ccc1Cl	ZINC000450636683	CG	On-Demand	Anodyne	OPRK1	24	49
COc1cc(CC(=O)N2CC[C@H]2C(C)C)ccc1Cl	ZINC000450636684	CG	On-Demand	Anodyne	OPRK1	24	49
COC(=O)c1coc(CN2CCN(c3ncccc3F)CC2)n1	ZINC000450636685	DD	On-Demand	Anodyne	DRD4	23	44
COC(=O)c1coc(CN2CCCC[C@H]2CCc2ccccc2)n1	ZINC000450636686	EG	On-Demand	Anodyne	SLC18A2	52	46
COC(=O)c1coc(CN2CCCC[C@@H]2CCc2ccccc2)n1	ZINC000450636687	EG	On-Demand	Anodyne	SLC18A2	52	46
COCc1nn(C)cc1C(=O)N1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450636697	FH	On-Demand	Anodyne	GRIN2B	43	33
O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450636699	DF	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@@H]1CCO[C@H](C2CC2)C1)[C@H]1CCN(c2ccccc2)C1	ZINC000450636700	DF	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)[C@H]1CCN(c2ccccc2)C1	ZINC000450636701	DF	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@@H]1CCO[C@H](C2CC2)C1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450636702	DF	On-Demand	Anodyne	EPHX2	20	41
CCCn1c(SCc2cccc(S(C)(=O)=O)c2)nc2ccccc2c1=O	ZINC000450636704	GH	On-Demand	Anodyne	PTGDR2	16	43
Cc1ccc(Cl)c2ccc(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)nc12	ZINC000450636711	FH	On-Demand	Anodyne	CHRNA4	28	44
Cc1ccnc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1Cl	ZINC000450636712	DF	On-Demand	Anodyne	CHRNA4	30	51
COC(=O)c1cccc(CN2CCc3ccsc3C2)c1Cl	ZINC000450636725	DH	On-Demand	Anodyne	NOD2	40	35
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3cc(Br)ccc23)C1	ZINC000450636736	GH	On-Demand	Anodyne	CHRNA4	28	45
C=CCC1(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CCCC1	ZINC000450636739	FF	On-Demand	Mild	CDK1	20	41
C=CCC1(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CCCC1	ZINC000450636739	FF	On-Demand	Mild	CDK4	22	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000450636740	FD	On-Demand	Bother	CHRNA4	27	43
Cc1nn(C)cc1CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450636743	ED	On-Demand	Anodyne	DRD3	0	48
Cc1nn(C)cc1CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450636743	ED	On-Demand	Anodyne	SIGMAR1	24	42
Cc1nn(C)cc1CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450636744	ED	On-Demand	Anodyne	DRD3	0	48
Cc1nn(C)cc1CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450636744	ED	On-Demand	Anodyne	SIGMAR1	24	42
Cc1nn(C)cc1CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450636745	ED	On-Demand	Anodyne	DRD3	0	48
Cc1nn(C)cc1CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450636745	ED	On-Demand	Anodyne	SIGMAR1	24	42
Cc1nn(C)cc1CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450636746	ED	On-Demand	Anodyne	DRD3	0	48
Cc1nn(C)cc1CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450636746	ED	On-Demand	Anodyne	SIGMAR1	24	42
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nnc(Cc3ccccc3)s2)C1	ZINC000450636756	FF	On-Demand	Anodyne	CHRNA4	32	59
CCS(=O)(=O)c1ccc(CN(Cc2cccs2)CC(F)(F)F)cc1	ZINC000450636761	GI	On-Demand	Anodyne	RORC	16	42
CO[C@]1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCOC1	ZINC000450636769	DD	On-Demand	Anodyne	CTSV	48	34
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	DRD2	74	77
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	DRD1	44	63
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	DRD4	64	63
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	ADRA1D	30	56
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	HTR2A	61	55
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	HTR2C	42	57
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	ADRA1A	24	56
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	HRH1	22	77
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	DRD3	51	72
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	DRD5	36	49
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	ERG2	25	56
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	SIGMAR1	24	62
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	SLC18A3	0	50
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	CYP2J2	57	40
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	NET	0	58
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	AP2S1	0	56
O=C(CCCN1CCN(c2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450636771	EG	On-Demand	Anodyne	SLC6A7	0	41
CO[C@@]1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCOC1	ZINC000450636772	DD	On-Demand	Anodyne	CTSV	48	34
CC(C)[C@@H]1CCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450636774	DF	On-Demand	Anodyne	PDEC	0	40
CCC[C@@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450636782	EH	On-Demand	Anodyne	CAPNS1	40	35
CCC[C@@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450636782	EH	On-Demand	Anodyne	CAPN1	65	39
CCC[C@@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450636782	EH	On-Demand	Anodyne	CAPN2	111	39
CCC[C@@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450636782	EH	On-Demand	Anodyne	NPR	55	35
CCC[C@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450636783	EH	On-Demand	Anodyne	CAPNS1	40	35
CCC[C@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450636783	EH	On-Demand	Anodyne	CAPN1	65	39
CCC[C@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450636783	EH	On-Demand	Anodyne	CAPN2	111	39
CCC[C@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450636783	EH	On-Demand	Anodyne	NPR	55	35
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc(C)c(C)c34)CC2)c1	ZINC000450636785	GH	On-Demand	Anodyne	SIRT3	49	34
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc(C)c(C)c34)CC2)c1	ZINC000450636785	GH	On-Demand	Anodyne	SIRT1	40	31
CC(C)[C@@H]1CCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450636789	DF	On-Demand	Anodyne	PDEC	0	40
CC(C)[C@H]1CCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450636791	DF	On-Demand	Anodyne	PDEC	0	40
CC(C)[C@H]1CCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450636793	DF	On-Demand	Anodyne	PDEC	0	40
N#Cc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc2ccc([N+](=O)[O-])cc12	ZINC000450636798	GF	On-Demand	Mild	CHRNA4	26	42
Cn1c(=O)c2c(ncn2CCc2ccc(Cl)cc2)n(C)c1=O	ZINC000450636802	DD	On-Demand	Anodyne	MAOB	0	60
Cn1c(=O)c2c(ncn2CCc2ccc(Cl)cc2)n(C)c1=O	ZINC000450636802	DD	On-Demand	Anodyne	ADORA2A	0	65
Cn1c(=O)c2c(ncn2CCc2ccc(Cl)cc2)n(C)c1=O	ZINC000450636802	DD	On-Demand	Anodyne	DNAE	47	30
Cc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccc(F)c(F)c2n1	ZINC000450636804	FH	On-Demand	Anodyne	CHRNA4	27	43
C=CCC1(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)CCCC1	ZINC000450636806	EF	On-Demand	Mild	STAT6	51	35
CCOC(=O)c1cnn(C2CCN(c3ccc(S(C)(=O)=O)cn3)CC2)c1	ZINC000450636811	GD	On-Demand	Anodyne	GPR119	44	44
CC[C@@H](C)n1nc(NC(=O)c2c(C)cccc2Cl)cc1C	ZINC000450636818	DH	On-Demand	Anodyne	TYK2	38	41
CC[C@H](C)n1nc(NC(=O)c2c(C)cccc2Cl)cc1C	ZINC000450636819	DH	On-Demand	Anodyne	TYK2	38	41
COc1cc(CC(=O)N[C@H]2c3ccccc3CCC[C@@H]2C)ccc1O	ZINC000450636821	EH	On-Demand	Anodyne	HCRTR1	28	41
COc1cc(CC(=O)N[C@H]2c3ccccc3CCC[C@@H]2C)ccc1O	ZINC000450636821	EH	On-Demand	Anodyne	TRPV1	30	44
COc1cc(CC(=O)N[C@H]2c3ccccc3CCC[C@@H]2C)ccc1O	ZINC000450636821	EH	On-Demand	Anodyne	HCRTR2	18	41
COc1cc(CC(=O)N[C@H]2c3ccccc3CCC[C@@H]2C)ccc1O	ZINC000450636821	EH	On-Demand	Anodyne	MBTPS1	52	35
COc1cc(CC(=O)N[C@@H]2c3ccccc3CCC[C@@H]2C)ccc1O	ZINC000450636823	EH	On-Demand	Anodyne	HCRTR1	28	41
COc1cc(CC(=O)N[C@@H]2c3ccccc3CCC[C@@H]2C)ccc1O	ZINC000450636823	EH	On-Demand	Anodyne	TRPV1	30	44
COc1cc(CC(=O)N[C@@H]2c3ccccc3CCC[C@@H]2C)ccc1O	ZINC000450636823	EH	On-Demand	Anodyne	HCRTR2	18	41
COc1cc(CC(=O)N[C@@H]2c3ccccc3CCC[C@@H]2C)ccc1O	ZINC000450636823	EH	On-Demand	Anodyne	MBTPS1	52	35
COc1cccc(OCCC(=O)Nc2cccc(N(C)C)c2C)c1	ZINC000450636824	EG	On-Demand	Anodyne	MTNR1A	36	47
COc1cc(CC(=O)N[C@H]2c3ccccc3CCC[C@H]2C)ccc1O	ZINC000450636825	EH	On-Demand	Anodyne	HCRTR1	28	41
COc1cc(CC(=O)N[C@H]2c3ccccc3CCC[C@H]2C)ccc1O	ZINC000450636825	EH	On-Demand	Anodyne	TRPV1	30	44
COc1cc(CC(=O)N[C@H]2c3ccccc3CCC[C@H]2C)ccc1O	ZINC000450636825	EH	On-Demand	Anodyne	HCRTR2	18	41
COc1cc(CC(=O)N[C@H]2c3ccccc3CCC[C@H]2C)ccc1O	ZINC000450636825	EH	On-Demand	Anodyne	MBTPS1	52	35
COc1cc(CC(=O)N[C@@H]2c3ccccc3CCC[C@H]2C)ccc1O	ZINC000450636827	EH	On-Demand	Anodyne	HCRTR1	28	41
COc1cc(CC(=O)N[C@@H]2c3ccccc3CCC[C@H]2C)ccc1O	ZINC000450636827	EH	On-Demand	Anodyne	TRPV1	30	44
COc1cc(CC(=O)N[C@@H]2c3ccccc3CCC[C@H]2C)ccc1O	ZINC000450636827	EH	On-Demand	Anodyne	HCRTR2	18	41
COc1cc(CC(=O)N[C@@H]2c3ccccc3CCC[C@H]2C)ccc1O	ZINC000450636827	EH	On-Demand	Anodyne	MBTPS1	52	35
COc1cccc2c(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)cc(C)nc12	ZINC000450636832	FG	On-Demand	Anodyne	CHRNA4	27	42
CC(C)(C(=O)NCc1cnc(N2CCOCC2)c(F)c1)C1CCC1	ZINC000450636841	EE	On-Demand	Anodyne	STAT6	50	34
CCC[C@@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)C(=O)OC(C)(C)C	ZINC000450636851	GH	On-Demand	Anodyne	PSENEN	0	42
CCC[C@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)C(=O)OC(C)(C)C	ZINC000450636852	GH	On-Demand	Anodyne	PSENEN	0	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450636855	GG	On-Demand	Anodyne	PPARA	17	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450636855	GG	On-Demand	Anodyne	PPARD	28	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450636855	GG	On-Demand	Anodyne	SLC6A9	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450636855	GG	On-Demand	Anodyne	MTTP	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450636855	GG	On-Demand	Anodyne	STAT6	51	34
CCOC(=O)c1cnn(C2CCN(c3cc(C#N)ccc3C(C)=O)CC2)c1	ZINC000450636856	FF	On-Demand	Mild	P2RY12	57	39
Cc1nc(C)n(CCCC(=O)N2CCC(Cc3ccc(C(C)C)cc3)CC2)n1	ZINC000450636861	GI	On-Demand	Anodyne	GRIN2B	44	38
COc1ccc(C[C@H](C)CN(C)CC2(C#N)CCC2)cc1	ZINC000450636864	CG	On-Demand	Mild	PSMB8	45	32
COc1ccc(C[C@@H](C)CN(C)CC2(C#N)CCC2)cc1	ZINC000450636867	CG	On-Demand	Mild	PSMB8	45	32
COc1cc(CN2CCC[C@H]2c2c(C)n[nH]c2C)ccc1Cl	ZINC000450636869	DI	On-Demand	Anodyne	HCRTR1	17	40
COc1cc(CN2CCC[C@H]2c2c(C)n[nH]c2C)ccc1Cl	ZINC000450636869	DI	On-Demand	Anodyne	HCRTR2	17	40
COc1cc(CN2CCC[C@@H]2c2c(C)n[nH]c2C)ccc1Cl	ZINC000450636871	DI	On-Demand	Anodyne	HCRTR1	17	40
COc1cc(CN2CCC[C@@H]2c2c(C)n[nH]c2C)ccc1Cl	ZINC000450636871	DI	On-Demand	Anodyne	HCRTR2	17	40
COc1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)o2)cc1OC	ZINC000450636873	FG	On-Demand	Anodyne	GSK3B	17	45
COc1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)o2)cc1OC	ZINC000450636873	FG	On-Demand	Anodyne	GSK3A	38	43
CCC[C@H](NC(=O)c1cnn2ccc(C)cc12)C(=O)OC(C)(C)C	ZINC000450636874	EF	On-Demand	Anodyne	EPHB3	33	46
CCC[C@@H](NC(=O)c1cnn2ccc(C)cc12)C(=O)OC(C)(C)C	ZINC000450636875	EF	On-Demand	Anodyne	EPHB3	33	46
Cc1ccc(Br)cc1CN(C)CCCn1ccnc1	ZINC000450636886	DG	On-Demand	Anodyne	CYP19A1	17	44
Cc1ccc(Br)cc1CN(C)CCCn1ccnc1	ZINC000450636886	DG	On-Demand	Anodyne	TBXAS1	43	44
Cc1ccc(Br)cc1CN(C)CCCn1ccnc1	ZINC000450636886	DG	On-Demand	Anodyne	HMOX2	50	44
CCCC[C@H](NC(=O)C[C@H]1CCOC[C@@H]1OC)C(=O)OC(C)(C)C	ZINC000450636887	EE	On-Demand	Anodyne	CTSK	16	40
CCCC[C@H](NC(=O)C[C@@H]1CCOC[C@@H]1OC)C(=O)OC(C)(C)C	ZINC000450636888	EE	On-Demand	Anodyne	CTSK	16	40
CCCC[C@H](NC(=O)C[C@H]1CCOC[C@H]1OC)C(=O)OC(C)(C)C	ZINC000450636889	EE	On-Demand	Anodyne	CTSK	16	40
CCCC[C@H](NC(=O)C[C@@H]1CCOC[C@H]1OC)C(=O)OC(C)(C)C	ZINC000450636890	EE	On-Demand	Anodyne	CTSK	16	40
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@H](C)O)CC2)c(OC)c1	ZINC000450636895	GC	On-Demand	Anodyne	HTR1A	26	41
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@H](C)O)CC2)c(OC)c1	ZINC000450636895	GC	On-Demand	Anodyne	DRD2	22	40
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@H](C)O)CC2)c(OC)c1	ZINC000450636895	GC	On-Demand	Anodyne	DRD4	44	33
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@H](C)O)CC2)c(OC)c1	ZINC000450636895	GC	On-Demand	Anodyne	HTR7	38	45
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@H](C)O)CC2)c(OC)c1	ZINC000450636895	GC	On-Demand	Anodyne	MTNR1A	56	39
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@H](C)O)CC2)c(OC)c1	ZINC000450636895	GC	On-Demand	Anodyne	MTNR1B	45	46
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@@H](C)O)CC2)c(OC)c1	ZINC000450636896	GC	On-Demand	Anodyne	HTR1A	26	41
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@@H](C)O)CC2)c(OC)c1	ZINC000450636896	GC	On-Demand	Anodyne	DRD2	22	40
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@@H](C)O)CC2)c(OC)c1	ZINC000450636896	GC	On-Demand	Anodyne	DRD4	44	33
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@@H](C)O)CC2)c(OC)c1	ZINC000450636896	GC	On-Demand	Anodyne	HTR7	38	45
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@@H](C)O)CC2)c(OC)c1	ZINC000450636896	GC	On-Demand	Anodyne	MTNR1A	56	39
COc1ccc(CNC(=O)CCN2CCN(C(=O)[C@@H](C)O)CC2)c(OC)c1	ZINC000450636896	GC	On-Demand	Anodyne	MTNR1B	45	46
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@H](C)O	ZINC000450636905	ED	On-Demand	Anodyne	RBP4	64	43
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@@H](C)O	ZINC000450636906	ED	On-Demand	Anodyne	RBP4	64	43
CCn1cc(C(=O)N(C)[C@@H](CO)c2ccc(OC)cc2)c2ccccc21	ZINC000450636910	FG	On-Demand	Anodyne	CNR1	26	47
CCn1cc(C(=O)N(C)[C@@H](CO)c2ccc(OC)cc2)c2ccccc21	ZINC000450636910	FG	On-Demand	Anodyne	CNR2	19	44
CCn1cc(C(=O)N(C)[C@H](CO)c2ccc(OC)cc2)c2ccccc21	ZINC000450636911	FG	On-Demand	Anodyne	CNR1	26	47
CCn1cc(C(=O)N(C)[C@H](CO)c2ccc(OC)cc2)c2ccccc21	ZINC000450636911	FG	On-Demand	Anodyne	CNR2	19	44
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450636931	FF	On-Demand	Anodyne	CCR3	42	38
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450636931	FF	On-Demand	Anodyne	CCKBR	40	38
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450636931	FF	On-Demand	Anodyne	EPHX2	30	53
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450636931	FF	On-Demand	Anodyne	CACNA1I	33	45
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450636932	FF	On-Demand	Anodyne	CCR3	42	38
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450636932	FF	On-Demand	Anodyne	CCKBR	40	38
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450636932	FF	On-Demand	Anodyne	EPHX2	30	53
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1O	ZINC000450636932	FF	On-Demand	Anodyne	CACNA1I	33	45
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450636933	FF	On-Demand	Anodyne	CCR3	42	38
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450636933	FF	On-Demand	Anodyne	CCKBR	40	38
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450636933	FF	On-Demand	Anodyne	EPHX2	30	53
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450636933	FF	On-Demand	Anodyne	CACNA1I	33	45
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450636934	FF	On-Demand	Anodyne	CCR3	42	38
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450636934	FF	On-Demand	Anodyne	CCKBR	40	38
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450636934	FF	On-Demand	Anodyne	EPHX2	30	53
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1O	ZINC000450636934	FF	On-Demand	Anodyne	CACNA1I	33	45
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450636938	ED	On-Demand	Anodyne	MMP13	0	42
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450636939	ED	On-Demand	Anodyne	MMP13	0	42
Cc1ccc(C(=O)Nc2c(C)cccc2F)c2c1CCC2	ZINC000450636940	CI	On-Demand	Anodyne	S1PR4	29	41
O=C(Cc1ccc(O)c(F)c1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450636949	EF	On-Demand	Anodyne	SMO	46	36
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450636951	CB	On-Demand	Anodyne	VHL	45	36
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450636952	CB	On-Demand	Anodyne	VHL	45	36
O[C@H](Cc1ccccc1)CN1CCO[C@@H](c2ccc(OC(F)F)cc2)C1	ZINC000450636956	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
O[C@H](Cc1ccccc1)CN1CCO[C@H](c2ccc(OC(F)F)cc2)C1	ZINC000450636957	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
COc1ccc([C@@H](CO)N(C)C(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450636965	FF	On-Demand	Anodyne	OPRK1	22	47
COc1ccc([C@H](CO)N(C)C(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450636966	FF	On-Demand	Anodyne	OPRK1	22	47
COc1ccc([C@H](CO)N(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450636967	FF	On-Demand	Anodyne	OPRK1	22	47
COc1ccc([C@@H](CO)N(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450636968	FF	On-Demand	Anodyne	OPRK1	22	47
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc3ccccc3n2C)CC1	ZINC000450636994	GH	On-Demand	Anodyne	HRH1	31	41
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc3ccccc3n2C)CC1	ZINC000450636994	GH	On-Demand	Anodyne	PDE6D	69	45
COC(=O)C1(CN(C)C[C@@H](C)Cc2ccc(OC)cc2)CC1	ZINC000450636995	DF	On-Demand	Anodyne	MMP1	28	44
COC(=O)C1(CN(C)C[C@@H](C)Cc2ccc(OC)cc2)CC1	ZINC000450636995	DF	On-Demand	Anodyne	PSMB8	54	38
COC(=O)C1(CN(C)C[C@H](C)Cc2ccc(OC)cc2)CC1	ZINC000450636996	DF	On-Demand	Anodyne	MMP1	28	44
COC(=O)C1(CN(C)C[C@H](C)Cc2ccc(OC)cc2)CC1	ZINC000450636996	DF	On-Demand	Anodyne	PSMB8	54	38
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636997	GF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636997	GF	On-Demand	Anodyne	DRD3	16	53
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636997	GF	On-Demand	Anodyne	ESRRA	20	40
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636997	GF	On-Demand	Anodyne	SIGMAR1	15	45
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636997	GF	On-Demand	Anodyne	MCHR1	18	43
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636998	GF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636998	GF	On-Demand	Anodyne	DRD3	16	53
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636998	GF	On-Demand	Anodyne	ESRRA	20	40
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636998	GF	On-Demand	Anodyne	SIGMAR1	15	45
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)nn2)c1	ZINC000450636998	GF	On-Demand	Anodyne	MCHR1	18	43
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450636999	GF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450636999	GF	On-Demand	Anodyne	DRD3	16	53
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450636999	GF	On-Demand	Anodyne	ESRRA	20	40
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450636999	GF	On-Demand	Anodyne	SIGMAR1	15	45
COc1cccc(-n2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450636999	GF	On-Demand	Anodyne	MCHR1	18	43
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450637000	GF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450637000	GF	On-Demand	Anodyne	DRD3	16	53
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450637000	GF	On-Demand	Anodyne	ESRRA	20	40
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450637000	GF	On-Demand	Anodyne	SIGMAR1	15	45
COc1cccc(-n2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C[C@H]3C)nn2)c1	ZINC000450637000	GF	On-Demand	Anodyne	MCHR1	18	43
CC(C)[C@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450637010	DH	On-Demand	Anodyne	SLC6A1	39	40
CC(C)[C@@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450637011	DH	On-Demand	Anodyne	SLC6A1	39	40
CC(C)[C@@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450637011	DH	On-Demand	Anodyne	SLC6A3	22	40
CC(C)[C@@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450637011	DH	On-Demand	Anodyne	PRCP	19	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000450637014	GE	On-Demand	Bother	CHRNA4	27	42
Cc1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2c(C)c(C)sc2n1	ZINC000450637021	FG	On-Demand	Anodyne	CHRNA4	28	44
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(OC)cc(OC)n2)CC1	ZINC000450637025	GF	On-Demand	Anodyne	ALS	92	38
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2cncc(-c3cccs3)n2)C1	ZINC000450637026	FF	On-Demand	Anodyne	CHRNA4	28	47
CC[C@H](CC(F)(F)F)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450637027	EF	On-Demand	Anodyne	P2RX7	15	40
CC[C@@H](CC(F)(F)F)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450637028	EF	On-Demand	Anodyne	P2RX7	15	40
CC(C)OC(=O)CCCNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450637029	CF	On-Demand	Anodyne	EPHX2	0	45
CC(C)OC(=O)CCCNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450637030	CF	On-Demand	Anodyne	EPHX2	0	45
CC(C)OC(=O)CCCNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450637031	CF	On-Demand	Anodyne	EPHX2	0	45
CC(C)OC(=O)CCCNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450637032	CF	On-Demand	Anodyne	EPHX2	0	45
COc1cccc(OCCC(=O)Nc2cc(SC)ccc2C)c1	ZINC000450637035	EI	On-Demand	Anodyne	MTNR1A	41	48
COc1cccc(OCCC(=O)Nc2cc(SC)ccc2C)c1	ZINC000450637035	EI	On-Demand	Anodyne	MTNR1B	42	48
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450637051	GF	On-Demand	Anodyne	CDK1	21	43
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450637051	GF	On-Demand	Anodyne	CDK4	23	43
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450637051	GF	On-Demand	Anodyne	CALCA	0	41
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637060	EH	On-Demand	Anodyne	DRD4	18	47
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637061	EH	On-Demand	Anodyne	DRD4	18	47
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637062	EH	On-Demand	Anodyne	DRD4	18	47
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637063	EH	On-Demand	Anodyne	DRD4	18	47
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncc(C(=O)OC)cn2)CC1	ZINC000450637068	GE	On-Demand	Anodyne	P2RY12	31	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(Cl)cn2)CC1	ZINC000450637069	FH	On-Demand	Anodyne	NPBWR1	45	34
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nccc3ccc(F)cc23)C1	ZINC000450637070	EG	On-Demand	Anodyne	CHRNA4	31	53
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637086	DG	On-Demand	Anodyne	DRD2	21	43
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637086	DG	On-Demand	Anodyne	DRD4	27	58
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637086	DG	On-Demand	Anodyne	ACHE	17	42
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637086	DG	On-Demand	Anodyne	DRD3	15	43
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637086	DG	On-Demand	Anodyne	SIGMAR1	32	42
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637087	DG	On-Demand	Anodyne	DRD2	21	43
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637087	DG	On-Demand	Anodyne	DRD4	27	58
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637087	DG	On-Demand	Anodyne	ACHE	17	42
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637087	DG	On-Demand	Anodyne	DRD3	15	43
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637087	DG	On-Demand	Anodyne	SIGMAR1	32	42
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637088	DG	On-Demand	Anodyne	DRD2	21	43
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637088	DG	On-Demand	Anodyne	DRD4	27	58
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637088	DG	On-Demand	Anodyne	ACHE	17	42
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637088	DG	On-Demand	Anodyne	DRD3	15	43
Cc1sccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637088	DG	On-Demand	Anodyne	SIGMAR1	32	42
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637089	DG	On-Demand	Anodyne	DRD2	21	43
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637089	DG	On-Demand	Anodyne	DRD4	27	58
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637089	DG	On-Demand	Anodyne	ACHE	17	42
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637089	DG	On-Demand	Anodyne	DRD3	15	43
Cc1sccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637089	DG	On-Demand	Anodyne	SIGMAR1	32	42
Cc1nsc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450637090	CD	On-Demand	Anodyne	CHRNA4	38	48
CCOC(=O)c1cnn(C2CCN(c3nccc(C)c3Cl)CC2)c1	ZINC000450637095	EG	On-Demand	Anodyne	P2RY12	36	42
CCOC(=O)c1cnn(C2CCN(c3nnc(C)c(C)c3C#N)CC2)c1	ZINC000450637102	FE	On-Demand	Mild	P2RY12	53	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@]1(OC)CCOC1	ZINC000450637105	CD	On-Demand	Anodyne	TIMP3	58	34
CO[C@@H](Cc1ccccc1)C(=O)NC[C@]1(OC)CCOC1	ZINC000450637106	CD	On-Demand	Anodyne	TIMP3	58	34
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@]1(OC)CCOC1	ZINC000450637107	CD	On-Demand	Anodyne	TIMP3	58	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@@]1(OC)CCOC1	ZINC000450637108	CD	On-Demand	Anodyne	TIMP3	58	34
C[C@@H](CCO)C1(CNC(=O)c2ccc(N3CCC3)nc2)CCC1	ZINC000450637109	DE	On-Demand	Anodyne	HPGDS	15	40
C[C@H](CCO)C1(CNC(=O)c2ccc(N3CCC3)nc2)CCC1	ZINC000450637110	DE	On-Demand	Anodyne	HPGDS	15	40
CCOC(=O)c1cnn(C2CCN(c3nccc4ccc(F)cc34)CC2)c1	ZINC000450637113	FH	On-Demand	Anodyne	P2RY12	44	40
CC(C)(C[C@H]1CCCN(c2c(C#N)cnc3c(F)ccc(Cl)c23)C1)C(N)=O	ZINC000450637121	GI	On-Demand	Mild	MAP3K8	55	34
CC(C)(C[C@@H]1CCCN(c2c(C#N)cnc3c(F)ccc(Cl)c23)C1)C(N)=O	ZINC000450637122	GI	On-Demand	Mild	MAP3K8	55	34
CO[C@]1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCOC1	ZINC000450637124	DD	On-Demand	Anodyne	HCN1	49	32
CO[C@]1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCOC1	ZINC000450637124	DD	On-Demand	Anodyne	HCN4	47	32
CO[C@@]1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCOC1	ZINC000450637125	DD	On-Demand	Anodyne	HCN1	49	32
CO[C@@]1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCOC1	ZINC000450637125	DD	On-Demand	Anodyne	HCN4	47	32
CO[C@@]1(CNC(=O)c2cncc(Cl)c2)CCOC1	ZINC000450637126	CD	On-Demand	Anodyne	CACNA1I	40	29
CO[C@]1(CNC(=O)c2cncc(Cl)c2)CCOC1	ZINC000450637127	CD	On-Demand	Anodyne	CACNA1I	40	29
CC(C)(C[C@@H]1CCCN(c2cc(Br)cnc2C(N)=O)C1)C(N)=O	ZINC000450637128	GE	On-Demand	Anodyne	SIRT3	41	31
CC(C)(C[C@H]1CCCN(c2cc(Br)cnc2C(N)=O)C1)C(N)=O	ZINC000450637129	GE	On-Demand	Anodyne	SIRT3	41	31
Cn1cc(-c2ccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)o2)cn1	ZINC000450637138	GD	On-Demand	Anodyne	SCN10A	22	40
Cn1cc(-c2ccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)o2)cn1	ZINC000450637138	GD	On-Demand	Anodyne	STAT6	51	34
Cn1cc(-c2ccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)o2)cn1	ZINC000450637138	GD	On-Demand	Anodyne	NAMPT	30	41
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@]3(OC)CCOC3)ccc21	ZINC000450637147	GF	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@]3(OC)CCOC3)ccc21	ZINC000450637147	GF	On-Demand	Anodyne	DRD3	25	41
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@]3(OC)CCOC3)ccc21	ZINC000450637147	GF	On-Demand	Anodyne	CPT1A	44	32
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@]3(OC)CCOC3)ccc21	ZINC000450637147	GF	On-Demand	Anodyne	HPGD	43	54
COc1ccccc1-n1cnc2cc(C(=O)NC[C@]3(OC)CCOC3)ccc21	ZINC000450637148	GF	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1-n1cnc2cc(C(=O)NC[C@]3(OC)CCOC3)ccc21	ZINC000450637148	GF	On-Demand	Anodyne	DRD3	25	41
COc1ccccc1-n1cnc2cc(C(=O)NC[C@]3(OC)CCOC3)ccc21	ZINC000450637148	GF	On-Demand	Anodyne	CPT1A	44	32
COc1ccccc1-n1cnc2cc(C(=O)NC[C@]3(OC)CCOC3)ccc21	ZINC000450637148	GF	On-Demand	Anodyne	HPGD	43	54
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccccc34)CC2)c1	ZINC000450637149	FH	On-Demand	Anodyne	GYRB	0	45
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccccc34)CC2)c1	ZINC000450637149	FH	On-Demand	Anodyne	HTR1D	48	39
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccccc34)CC2)c1	ZINC000450637149	FH	On-Demand	Anodyne	HTR1B	45	39
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccccc34)CC2)c1	ZINC000450637149	FH	On-Demand	Anodyne	P2RY12	52	37
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccccc34)CC2)c1	ZINC000450637149	FH	On-Demand	Anodyne	METAP1	35	49
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccccc34)CC2)c1	ZINC000450637149	FH	On-Demand	Anodyne	ADAM17	58	36
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc4ccccc34)CC2)c1	ZINC000450637149	FH	On-Demand	Anodyne	MAP3K7	40	34
CCCC[C@@H](NC(=O)c1nn2c(c1C)OCCC2)C(=O)OC(C)(C)C	ZINC000450637150	FF	On-Demand	Anodyne	SSTR2	41	31
CCCC[C@H](NC(=O)c1nn2c(c1C)OCCC2)C(=O)OC(C)(C)C	ZINC000450637151	FF	On-Demand	Anodyne	SSTR2	41	31
CN(CCCn1ccnc1)CC1=CCCCC1	ZINC000450637152	BF	On-Demand	Anodyne	TBXAS1	26	40
CCOC(=O)c1cnn(C2CCN(c3ccc(C#N)c(C(F)(F)F)c3)CC2)c1	ZINC000450637163	GH	On-Demand	Mild	AR	67	45
CCOC(=O)c1cnn(C2CCN(c3ccc(C#N)c(C(F)(F)F)c3)CC2)c1	ZINC000450637163	GH	On-Demand	Mild	P2RY12	57	43
CCOC(=O)c1sc(Sc2cc(C)nc(C3CC3)n2)nc1C	ZINC000450637164	EH	On-Demand	Anodyne	DHODH	21	42
Cc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C)n3)c(Cl)c2)c(C(C)C)n1	ZINC000450637165	FJ	On-Demand	Anodyne	NR2E3	61	36
Cc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C)n3)c(Cl)c2)c(C(C)C)n1	ZINC000450637165	FJ	On-Demand	Anodyne	SHH	54	43
CCCC[C@H](NC(=O)[C@@H]1CC12CCSCC2)C(=O)OC(C)(C)C	ZINC000450637201	EH	On-Demand	Anodyne	CTSK	0	43
CCCC[C@H](NC(=O)[C@H]1CC12CCSCC2)C(=O)OC(C)(C)C	ZINC000450637203	EH	On-Demand	Anodyne	CTSK	0	43
CCCC[C@@H](NC(=O)[C@@H]1CC12CCSCC2)C(=O)OC(C)(C)C	ZINC000450637205	EH	On-Demand	Anodyne	CTSK	0	43
CCCC[C@@H](NC(=O)[C@H]1CC12CCSCC2)C(=O)OC(C)(C)C	ZINC000450637207	EH	On-Demand	Anodyne	CTSK	0	43
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)[C@H](C)O	ZINC000450637216	ED	On-Demand	Anodyne	GPR88	0	41
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)[C@@H](C)O	ZINC000450637218	ED	On-Demand	Anodyne	GPR88	0	41
COc1cc(CC(=O)Nc2ccccc2CN2CCNC2=O)ccc1Cl	ZINC000450637219	FG	On-Demand	Anodyne	PTGER3	28	41
COc1ccc(CNC(=O)CCN2C[C@H](O)C[C@@H]2C)c(OC)c1	ZINC000450637220	DD	On-Demand	Anodyne	MTNR1A	45	35
COc1ccc(CC(=O)NCc2ccc(C(F)F)cc2)c(Cl)c1OC	ZINC000450637226	FI	On-Demand	Anodyne	TRPV1	34	45
COc1ccc(CC(=O)NCc2ccc(C(F)F)cc2)c(Cl)c1OC	ZINC000450637226	FI	On-Demand	Anodyne	U38	0	40
COc1ccc(CNC(=O)CCN2C[C@@H](O)C[C@@H]2C)c(OC)c1	ZINC000450637227	DD	On-Demand	Anodyne	MTNR1A	45	35
COc1ccc(CNC(=O)CCN2C[C@@H](O)C[C@H]2C)c(OC)c1	ZINC000450637228	DD	On-Demand	Anodyne	MTNR1A	45	35
COc1ccc(CNC(=O)CCN2C[C@H](O)C[C@H]2C)c(OC)c1	ZINC000450637229	DD	On-Demand	Anodyne	MTNR1A	45	35
COc1ccc(C(=O)N[C@H]2c3ccccc3CCC[C@H]2C)cc1S(C)(=O)=O	ZINC000450637232	GH	On-Demand	Anodyne	CPT1A	43	30
COc1ccc(C(=O)N[C@H]2c3ccccc3CCC[C@@H]2C)cc1S(C)(=O)=O	ZINC000450637234	GH	On-Demand	Anodyne	CPT1A	43	30
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450637235	DC	On-Demand	Anodyne	AGTR2	24	42
COc1ccc(C(=O)N[C@@H]2c3ccccc3CCC[C@H]2C)cc1S(C)(=O)=O	ZINC000450637236	GH	On-Demand	Anodyne	CPT1A	43	30
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450637237	DC	On-Demand	Anodyne	AGTR2	24	42
COc1ccc(C(=O)N[C@@H]2c3ccccc3CCC[C@@H]2C)cc1S(C)(=O)=O	ZINC000450637238	GH	On-Demand	Anodyne	CPT1A	43	30
Clc1ccc(N2CCCN(CC[C@H]3CCOC3)CC2)cc1Cl	ZINC000450637240	EH	On-Demand	Anodyne	DRD4	15	44
Clc1ccc(N2CCCN(CC[C@H]3CCOC3)CC2)cc1Cl	ZINC000450637240	EH	On-Demand	Anodyne	DRD3	16	53
Clc1ccc(N2CCCN(CC[C@H]3CCOC3)CC2)cc1Cl	ZINC000450637240	EH	On-Demand	Anodyne	SIGMAR1	19	40
Clc1ccc(N2CCCN(CC[C@H]3CCOC3)CC2)cc1Cl	ZINC000450637240	EH	On-Demand	Anodyne	L3MBTL3	24	41
CC(C)(C[C@H]1CCCN(c2ncccc2OCc2ccccc2)C1)C(N)=O	ZINC000450637241	FH	On-Demand	Anodyne	PREP	46	35
CC(C)(C[C@@H]1CCCN(c2ncccc2OCc2ccccc2)C1)C(N)=O	ZINC000450637242	FH	On-Demand	Anodyne	PREP	46	35
Clc1ccc(N2CCCN(CC[C@@H]3CCOC3)CC2)cc1Cl	ZINC000450637244	EH	On-Demand	Anodyne	DRD4	15	44
Clc1ccc(N2CCCN(CC[C@@H]3CCOC3)CC2)cc1Cl	ZINC000450637244	EH	On-Demand	Anodyne	DRD3	16	53
Clc1ccc(N2CCCN(CC[C@@H]3CCOC3)CC2)cc1Cl	ZINC000450637244	EH	On-Demand	Anodyne	SIGMAR1	19	40
Clc1ccc(N2CCCN(CC[C@@H]3CCOC3)CC2)cc1Cl	ZINC000450637244	EH	On-Demand	Anodyne	L3MBTL3	24	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450637246	GG	On-Demand	Anodyne	RBP4	75	40
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450637247	GG	On-Demand	Anodyne	RBP4	75	40
CC1(C)OCC[C@H]1Nc1ncnc2cc(F)c(F)cc12	ZINC000450637260	CF	On-Demand	Anodyne	CD38	62	38
CC1(C)OCC[C@@H]1Nc1ncnc2cc(F)c(F)cc12	ZINC000450637261	CF	On-Demand	Anodyne	CD38	62	38
FC(F)CN1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450637262	EH	On-Demand	Anodyne	MC4R	26	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)CCCC(=O)C1CC1	ZINC000450637264	DD	On-Demand	Anodyne	NOD1	51	33
COC(=O)[C@H](CC(F)(F)F)NC(=O)CCCC(=O)C1CC1	ZINC000450637265	DD	On-Demand	Anodyne	NOD1	51	33
COc1ccc([C@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637270	GE	On-Demand	Anodyne	BMP1	61	37
COc1ccc([C@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637270	GE	On-Demand	Anodyne	MMP13	46	46
COc1ccc([C@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637270	GE	On-Demand	Anodyne	MMP3	49	37
COc1ccc([C@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637270	GE	On-Demand	Anodyne	MMP8	34	42
COc1ccc([C@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637270	GE	On-Demand	Anodyne	MMP7	40	38
COc1ccc([C@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637270	GE	On-Demand	Anodyne	MMP1	41	42
COc1ccc([C@@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637271	GE	On-Demand	Anodyne	BMP1	61	37
COc1ccc([C@@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637271	GE	On-Demand	Anodyne	MMP13	46	46
COc1ccc([C@@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637271	GE	On-Demand	Anodyne	MMP3	49	37
COc1ccc([C@@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637271	GE	On-Demand	Anodyne	MMP8	34	42
COc1ccc([C@@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637271	GE	On-Demand	Anodyne	MMP7	40	38
COc1ccc([C@@H](CO)N(C)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1	ZINC000450637271	GE	On-Demand	Anodyne	MMP1	41	42
CCOC(=O)c1sc(Sc2ccc([N+](=O)[O-])c(C)n2)nc1C	ZINC000450637273	EG	On-Demand	Bother	DHODH	22	40
CCOC(=O)c1sc(Sc2ccc([N+](=O)[O-])c(C)n2)nc1C	ZINC000450637273	EG	On-Demand	Bother	GSTM2	31	41
CCc1cccc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)n1	ZINC000450637274	EF	On-Demand	Anodyne	SMO	57	39
CCc1cccc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)n1	ZINC000450637274	EF	On-Demand	Anodyne	ETHR	72	45
CC(C)C[C@@H]1C[C@H]1C(=O)NCCCC(=O)OC(C)C	ZINC000450637299	CF	On-Demand	Anodyne	EPHX2	24	46
COc1cc(CC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450637301	DF	On-Demand	Anodyne	HTR4	45	35
COc1cc(CC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450637301	DF	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450637302	DF	On-Demand	Anodyne	HTR4	45	35
COc1cc(CC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450637302	DF	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450637303	DF	On-Demand	Anodyne	HTR4	45	35
COc1cc(CC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450637303	DF	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@H]2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450637304	DF	On-Demand	Anodyne	HTR4	45	35
COc1cc(CC(=O)N[C@H]2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450637304	DF	On-Demand	Anodyne	CAN2	0	40
COc1ccc2c(c1OC)CCN(C[C@@H](Cc1ccccc1)OC)C2	ZINC000450637309	EG	On-Demand	Anodyne	AGTR2	47	37
COc1ccc2c(c1OC)CCN(C[C@H](Cc1ccccc1)OC)C2	ZINC000450637310	EG	On-Demand	Anodyne	AGTR2	47	37
CCOC(=O)c1ccc(CN2CCc3ccsc3C2)nc1	ZINC000450637311	DF	On-Demand	Anodyne	NOD1	26	43
CCOC(=O)c1ccc(CN2CCc3ccsc3C2)nc1	ZINC000450637311	DF	On-Demand	Anodyne	NOD2	41	43
O=C1CCCN1[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450637312	CF	On-Demand	Anodyne	CACNA1C	24	44
O=C1CCCN1[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450637312	CF	On-Demand	Anodyne	CACNA1D	79	44
O=C1CCCN1[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450637312	CF	On-Demand	Anodyne	BIRC2	45	42
O=C1CCCN1[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450637314	CF	On-Demand	Anodyne	CACNA1C	24	44
O=C1CCCN1[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450637314	CF	On-Demand	Anodyne	CACNA1D	79	44
O=C1CCCN1[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450637314	CF	On-Demand	Anodyne	BIRC2	45	42
FC(F)(F)Cn1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450637321	GH	On-Demand	Anodyne	SIGMAR1	39	42
CC(F)(F)c1ccc(C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)cn1	ZINC000450637322	GH	On-Demand	Anodyne	P4HTM	0	42
O=C1C[C@H]([C@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)CN1	ZINC000450637333	GG	On-Demand	Anodyne	CYP2J2	45	31
O=C1C[C@@H]([C@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)CN1	ZINC000450637335	GG	On-Demand	Anodyne	CYP2J2	45	31
O=C1C[C@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)CN1	ZINC000450637338	GG	On-Demand	Anodyne	CYP2J2	45	31
O=C1C[C@@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)CN1	ZINC000450637340	GG	On-Demand	Anodyne	CYP2J2	45	31
CCC(=O)C1(C(=O)NCCCC(=O)OC(C)C)CC1	ZINC000450637347	CD	On-Demand	Anodyne	EPHX2	19	44
CS(=O)(=O)c1ccc(NC(=O)c2cccc3c2CCCC3)cc1C(F)F	ZINC000450637357	GI	On-Demand	Anodyne	MTTP	54	37
CS(=O)(=O)c1ccc(NC(=O)c2cccc3c2CCCC3)cc1C(F)F	ZINC000450637357	GI	On-Demand	Anodyne	KCNK3	64	36
CS(=O)(=O)c1ccc(NC(=O)c2cccc3c2CCCC3)cc1C(F)F	ZINC000450637357	GI	On-Demand	Anodyne	KCNK9	63	34
CCS(=O)(=O)c1ccc(CN2CCc3ccsc3C2)cc1	ZINC000450637363	DG	On-Demand	Anodyne	NOD2	40	34
CCS(=O)(=O)c1ccc(CN(CC(F)F)CC2CCC2)cc1	ZINC000450637364	EG	On-Demand	Anodyne	RORC	15	44
CC(C)OC(=O)CCCNC(=O)[C@H]1CCCCC1(F)F	ZINC000450637370	CF	On-Demand	Anodyne	EPHX2	0	43
CC(C)OC(=O)CCCNC(=O)[C@@H]1CCCCC1(F)F	ZINC000450637371	CF	On-Demand	Anodyne	EPHX2	0	43
COc1cc(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ccc1O	ZINC000450637372	GD	On-Demand	Anodyne	TRPV1	32	53
COc1cc(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ccc1O	ZINC000450637372	GD	On-Demand	Anodyne	BCHE	16	41
COc1cc(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ccc1O	ZINC000450637372	GD	On-Demand	Anodyne	CDK2	15	47
COc1cc(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ccc1O	ZINC000450637372	GD	On-Demand	Anodyne	CDK1	26	47
COc1cc(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ccc1O	ZINC000450637372	GD	On-Demand	Anodyne	CDK4	27	47
COc1cc(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ccc1O	ZINC000450637372	GD	On-Demand	Anodyne	CALCA	0	41
CC(C)N1CCN(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)CC1	ZINC000450637388	GG	On-Demand	Anodyne	DRD4	25	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)c(Cl)c2)CC1	ZINC000450637394	GI	On-Demand	Mild	PGR	23	42
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)c(Cl)c2)CC1	ZINC000450637394	GI	On-Demand	Mild	AR	21	43
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)c(Cl)c2)CC1	ZINC000450637394	GI	On-Demand	Mild	DRD4	41	32
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)c(Cl)c2)CC1	ZINC000450637394	GI	On-Demand	Mild	P2RY12	48	36
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)c(Cl)c2)CC1	ZINC000450637394	GI	On-Demand	Mild	KCNA3	0	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccnc3ccccc23)CC1	ZINC000450637395	GI	On-Demand	Anodyne	METAP1	44	47
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccnc3ccccc23)CC1	ZINC000450637395	GI	On-Demand	Anodyne	SLC12A5	41	31
OC[C@H]1C[C@@H](O)CN1CCC1=CCCCC1	ZINC000450637406	BD	On-Demand	Anodyne	SPHK2	50	37
CC(=O)c1ccc(CN2CC(=O)N(Cc3ccccc3)C2)cc1	ZINC000450637407	DF	On-Demand	Anodyne	NOD2	41	34
COc1cc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450637412	FF	On-Demand	Anodyne	DRD4	29	42
COc1cc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450637412	FF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450637412	FF	On-Demand	Anodyne	SSTR5	47	38
COc1cc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450637412	FF	On-Demand	Anodyne	UTS2R	28	40
COc1cc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450637413	FF	On-Demand	Anodyne	DRD4	29	42
COc1cc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450637413	FF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450637413	FF	On-Demand	Anodyne	SSTR5	47	38
COc1cc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450637413	FF	On-Demand	Anodyne	UTS2R	28	40
COc1cc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450637414	FF	On-Demand	Anodyne	DRD4	29	42
COc1cc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450637414	FF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450637414	FF	On-Demand	Anodyne	SSTR5	47	38
COc1cc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450637414	FF	On-Demand	Anodyne	UTS2R	28	40
COc1cc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450637415	FF	On-Demand	Anodyne	DRD4	29	42
COc1cc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450637415	FF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450637415	FF	On-Demand	Anodyne	SSTR5	47	38
COc1cc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450637415	FF	On-Demand	Anodyne	UTS2R	28	40
OC[C@H]1C[C@H](O)CN1CCC1=CCCCC1	ZINC000450637416	BD	On-Demand	Anodyne	SPHK2	50	37
OC[C@@H]1C[C@@H](O)CN1CCC1=CCCCC1	ZINC000450637418	BD	On-Demand	Anodyne	SPHK2	50	37
OC[C@@H]1C[C@H](O)CN1CCC1=CCCCC1	ZINC000450637420	BD	On-Demand	Anodyne	SPHK2	50	37
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc3ccccc3[nH]2)CC1	ZINC000450637421	GH	On-Demand	Anodyne	HTR3A	15	45
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc3ccccc3[nH]2)CC1	ZINC000450637421	GH	On-Demand	Anodyne	NPY5R	22	51
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc3ccccc3[nH]2)CC1	ZINC000450637421	GH	On-Demand	Anodyne	ALKBH3	56	37
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1	ZINC000450637424	FE	On-Demand	Bother	CHRNA4	27	43
CN(CCN1CCCC[C@H]1[C@H]1CNC(=O)C1)Cc1ccccc1	ZINC000450637429	DE	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1CCCC[C@H]1[C@H]1CNC(=O)C1)Cc1ccccc1	ZINC000450637429	DE	On-Demand	Anodyne	GHRL	43	31
CN(CCN1CCCC[C@@H]1[C@H]1CNC(=O)C1)Cc1ccccc1	ZINC000450637430	DE	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1CCCC[C@@H]1[C@H]1CNC(=O)C1)Cc1ccccc1	ZINC000450637430	DE	On-Demand	Anodyne	GHRL	43	31
CN(CCN1CCCC[C@H]1[C@@H]1CNC(=O)C1)Cc1ccccc1	ZINC000450637431	DE	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1CCCC[C@H]1[C@@H]1CNC(=O)C1)Cc1ccccc1	ZINC000450637431	DE	On-Demand	Anodyne	GHRL	43	31
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637432	CF	On-Demand	Anodyne	DRD3	0	52
CN(CCN1CCCC[C@@H]1[C@@H]1CNC(=O)C1)Cc1ccccc1	ZINC000450637433	DE	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1CCCC[C@@H]1[C@@H]1CNC(=O)C1)Cc1ccccc1	ZINC000450637433	DE	On-Demand	Anodyne	GHRL	43	31
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450637434	CF	On-Demand	Anodyne	DRD3	0	52
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637436	CF	On-Demand	Anodyne	DRD3	0	52
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450637437	CF	On-Demand	Anodyne	DRD3	0	52
CC[C@@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450637449	FF	On-Demand	Anodyne	CAPN2	52	33
CC[C@@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450637449	FF	On-Demand	Anodyne	CDK4	22	42
CC[C@@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450637449	FF	On-Demand	Anodyne	CARM1	42	36
CC[C@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450637450	FF	On-Demand	Anodyne	CAPN2	52	33
CC[C@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450637450	FF	On-Demand	Anodyne	CDK4	22	42
CC[C@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450637450	FF	On-Demand	Anodyne	CARM1	42	36
CS(=O)(=O)c1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C(F)F	ZINC000450637469	GF	On-Demand	Anodyne	PRNP	48	41
CS(=O)(=O)c1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C(F)F	ZINC000450637469	GF	On-Demand	Anodyne	DGAT1	40	37
CS(=O)(=O)c1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1C(F)F	ZINC000450637469	GF	On-Demand	Anodyne	HPGDS	20	41
CN(CCN1CCN(S(C)(=O)=O)c2ccccc2C1)Cc1ccccc1	ZINC000450637474	FE	On-Demand	Anodyne	SIGMAR1	22	42
CC(C)CCCC(=O)Nc1ccc(S(C)(=O)=O)c(C(F)F)c1	ZINC000450637477	EH	On-Demand	Anodyne	MSR1	0	45
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](C2CC2)C1	ZINC000450637478	CF	On-Demand	Anodyne	OPRK1	25	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C2CC2)C1	ZINC000450637479	CF	On-Demand	Anodyne	OPRK1	25	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C2CC2)C1	ZINC000450637480	CF	On-Demand	Anodyne	OPRK1	25	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C2CC2)C1	ZINC000450637481	CF	On-Demand	Anodyne	OPRK1	25	40
CC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450637482	EE	On-Demand	Anodyne	ACHE	15	42
CC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450637482	EE	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450637482	EE	On-Demand	Anodyne	SLC18A3	25	42
CC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450637482	EE	On-Demand	Anodyne	MLNR	45	35
CC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450637483	EE	On-Demand	Anodyne	ACHE	15	42
CC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450637483	EE	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450637483	EE	On-Demand	Anodyne	SLC18A3	25	42
CC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450637483	EE	On-Demand	Anodyne	MLNR	45	35
CC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450637484	EE	On-Demand	Anodyne	ACHE	15	42
CC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450637484	EE	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450637484	EE	On-Demand	Anodyne	SLC18A3	25	42
CC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450637484	EE	On-Demand	Anodyne	MLNR	45	35
CC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450637485	EE	On-Demand	Anodyne	ACHE	15	42
CC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450637485	EE	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450637485	EE	On-Demand	Anodyne	SLC18A3	25	42
CC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450637485	EE	On-Demand	Anodyne	MLNR	45	35
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450637488	FE	On-Demand	Bother	PIK3CA	21	40
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450637488	FE	On-Demand	Bother	MTOR	43	40
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450637488	FE	On-Demand	Bother	TAAR1	37	56
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450637489	FE	On-Demand	Bother	PIK3CA	21	40
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450637489	FE	On-Demand	Bother	MTOR	43	40
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450637489	FE	On-Demand	Bother	TAAR1	37	56
CCCC[C@H](NC(=O)c1coc(-c2ccnc(C)c2)n1)C(=O)OC(C)(C)C	ZINC000450637501	FH	On-Demand	Anodyne	P2RY12	74	34
CCCC[C@@H](NC(=O)c1coc(-c2ccnc(C)c2)n1)C(=O)OC(C)(C)C	ZINC000450637502	FH	On-Demand	Anodyne	P2RY12	74	34
CN(CCCn1ccnc1)Cc1ccn(CCc2ccccc2)n1	ZINC000450637508	DF	On-Demand	Anodyne	CYP19A1	0	44
CN(CCCn1ccnc1)Cc1ccn(CCc2ccccc2)n1	ZINC000450637508	DF	On-Demand	Anodyne	CYP11B1	23	41
CN(CCCn1ccnc1)Cc1ccn(CCc2ccccc2)n1	ZINC000450637508	DF	On-Demand	Anodyne	TBXAS1	44	41
CN(CCCn1ccnc1)Cc1ccn(CCc2ccccc2)n1	ZINC000450637508	DF	On-Demand	Anodyne	CYP11B2	25	41
CN(CCCn1ccnc1)Cc1ccn(CCc2ccccc2)n1	ZINC000450637508	DF	On-Demand	Anodyne	HMOX1	40	37
CCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450637518	EF	On-Demand	Anodyne	TRPV1	0	49
CCC[C@@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450637518	EF	On-Demand	Anodyne	PSENEN	0	44
CCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450637519	EF	On-Demand	Anodyne	TRPV1	0	49
CCC[C@H](NC(=O)Cc1ccc(O)c(F)c1)C(=O)OC(C)(C)C	ZINC000450637519	EF	On-Demand	Anodyne	PSENEN	0	44
O=C(Cc1ccc(O)c(F)c1)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450637520	FD	On-Demand	Anodyne	STAT6	57	35
O=C(Cc1ccc(O)c(F)c1)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450637520	FD	On-Demand	Anodyne	CAN2	0	40
CC[C@@H](CC(C)C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450637529	EF	On-Demand	Anodyne	SCN10A	19	40
CC[C@@H](CC(C)C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450637529	EF	On-Demand	Anodyne	STAT6	48	32
CC[C@H](CC(C)C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450637530	EF	On-Demand	Anodyne	SCN10A	19	40
CC[C@H](CC(C)C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450637530	EF	On-Demand	Anodyne	STAT6	48	32
C[C@H]1C[C@H](O)CN1Cc1ccccc1OC1CC1	ZINC000450637534	BE	On-Demand	Anodyne	SLC5A4	54	34
C[C@@H]1C[C@@H](O)CN1Cc1ccccc1OC1CC1	ZINC000450637535	BE	On-Demand	Anodyne	SLC5A4	54	34
C[C@H]1C[C@@H](O)CN1Cc1ccccc1OC1CC1	ZINC000450637536	BE	On-Demand	Anodyne	SLC5A4	54	34
C[C@@H]1C[C@H](O)CN1Cc1ccccc1OC1CC1	ZINC000450637537	BE	On-Demand	Anodyne	SLC5A4	54	34
Cc1nnc2c3ccccc3c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)nn12	ZINC000450637540	FF	On-Demand	Anodyne	CREBBP	42	32
Cc1nnc2c3ccccc3c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)nn12	ZINC000450637540	FF	On-Demand	Anodyne	BRD9	53	32
Cc1nnc2c3ccccc3c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)nn12	ZINC000450637541	FF	On-Demand	Anodyne	CREBBP	42	32
Cc1nnc2c3ccccc3c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)nn12	ZINC000450637541	FF	On-Demand	Anodyne	BRD9	53	32
CC(C)(C[C@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)C1)C(N)=O	ZINC000450637554	FH	On-Demand	Anodyne	RBP4	19	49
CC(C)(C[C@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)C1)C(N)=O	ZINC000450637554	FH	On-Demand	Anodyne	SIRT3	58	33
CC(C)(C[C@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)C1)C(N)=O	ZINC000450637554	FH	On-Demand	Anodyne	SIRT2	50	34
CC(C)(C[C@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)C1)C(N)=O	ZINC000450637554	FH	On-Demand	Anodyne	SIRT1	40	34
CC(C)(C[C@@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)C1)C(N)=O	ZINC000450637555	FH	On-Demand	Anodyne	RBP4	19	49
CC(C)(C[C@@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)C1)C(N)=O	ZINC000450637555	FH	On-Demand	Anodyne	SIRT3	58	33
CC(C)(C[C@@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)C1)C(N)=O	ZINC000450637555	FH	On-Demand	Anodyne	SIRT2	50	34
CC(C)(C[C@@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)C1)C(N)=O	ZINC000450637555	FH	On-Demand	Anodyne	SIRT1	40	34
COc1cc(CC(=O)NC[C@@]2(OC)CCOC2)ccc1Cl	ZINC000450637562	DD	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)NC[C@@]2(OC)CCOC2)ccc1Cl	ZINC000450637562	DD	On-Demand	Anodyne	NCE103	26	44
COc1cc(CC(=O)NC[C@]2(OC)CCOC2)ccc1Cl	ZINC000450637563	DD	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)NC[C@]2(OC)CCOC2)ccc1Cl	ZINC000450637563	DD	On-Demand	Anodyne	NCE103	26	44
CC1(C)OCC[C@H]1Nc1ncnc2sc3ccccc3c12	ZINC000450637579	CH	On-Demand	Anodyne	IRAK4	15	58
CC1(C)OCC[C@@H]1Nc1ncnc2sc3ccccc3c12	ZINC000450637585	CH	On-Demand	Anodyne	IRAK4	15	58
CN(CCCn1ccnc1)C[C@H]1CCCCC1(F)F	ZINC000450637599	CG	On-Demand	Anodyne	TBXAS1	19	40
CN(CCCn1ccnc1)C[C@@H]1CCCCC1(F)F	ZINC000450637601	CG	On-Demand	Anodyne	TBXAS1	19	40
O=C(NCc1ccc(C(F)F)cc1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450637606	GH	On-Demand	Anodyne	NAMPT	30	41
COC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1)[C@H](C)O	ZINC000450637613	FD	On-Demand	Anodyne	DERP1	0	47
COC(=O)[C@H](NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1)[C@H](C)O	ZINC000450637617	FD	On-Demand	Anodyne	DERP1	0	47
COC(=O)[C@H](NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1)[C@@H](C)O	ZINC000450637618	FD	On-Demand	Anodyne	DERP1	0	47
COC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1)[C@@H](C)O	ZINC000450637620	FD	On-Demand	Anodyne	DERP1	0	47
CCOC(=O)c1cc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)[nH]c1C	ZINC000450637627	FF	On-Demand	Anodyne	ETHR	59	41
COc1ccc(CNC(=O)CCN2CCN3C(=O)CC[C@H]3C2)c(OC)c1	ZINC000450637629	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCN3C(=O)CC[C@H]3C2)c(OC)c1	ZINC000450637629	FD	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CCN3C(=O)CC[C@@H]3C2)c(OC)c1	ZINC000450637630	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCN3C(=O)CC[C@@H]3C2)c(OC)c1	ZINC000450637630	FD	On-Demand	Anodyne	HTR7	29	40
CCOC(=O)c1sc(Sc2ccc(C#N)c(C)n2)nc1C	ZINC000450637635	DG	On-Demand	Mild	DHODH	21	41
CCOC(=O)c1sc(Sc2cc(OCC)ncn2)nc1C	ZINC000450637652	EF	On-Demand	Anodyne	DHODH	21	42
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637662	GD	On-Demand	Anodyne	CA2	16	41
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637662	GD	On-Demand	Anodyne	PRSS1	19	42
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637662	GD	On-Demand	Anodyne	F10	18	41
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637662	GD	On-Demand	Anodyne	ANPEP	18	46
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637662	GD	On-Demand	Anodyne	CTSB	26	41
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637662	GD	On-Demand	Anodyne	ROCK2	16	41
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637663	GD	On-Demand	Anodyne	CA2	16	41
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637663	GD	On-Demand	Anodyne	PRSS1	19	42
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637663	GD	On-Demand	Anodyne	F10	18	41
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637663	GD	On-Demand	Anodyne	ANPEP	18	46
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637663	GD	On-Demand	Anodyne	CTSB	26	41
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637663	GD	On-Demand	Anodyne	ROCK2	16	41
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637664	GD	On-Demand	Anodyne	CA2	16	41
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637664	GD	On-Demand	Anodyne	PRSS1	19	42
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637664	GD	On-Demand	Anodyne	F10	18	41
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637664	GD	On-Demand	Anodyne	ANPEP	18	46
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637664	GD	On-Demand	Anodyne	CTSB	26	41
COC(=O)[C@@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@H](C)O	ZINC000450637664	GD	On-Demand	Anodyne	ROCK2	16	41
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637665	GD	On-Demand	Anodyne	CA2	16	41
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637665	GD	On-Demand	Anodyne	PRSS1	19	42
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637665	GD	On-Demand	Anodyne	F10	18	41
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637665	GD	On-Demand	Anodyne	ANPEP	18	46
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637665	GD	On-Demand	Anodyne	CTSB	26	41
COC(=O)[C@H](NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1)[C@@H](C)O	ZINC000450637665	GD	On-Demand	Anodyne	ROCK2	16	41
COC(=O)[C@H](NC(=O)c1ccc2cnccc2c1)[C@@H](C)O	ZINC000450637666	CC	On-Demand	Anodyne	AKT1	25	48
COC(=O)[C@H](NC(=O)c1ccc2cnccc2c1)[C@@H](C)O	ZINC000450637666	CC	On-Demand	Anodyne	CYP17A1	26	42
COC(=O)[C@@H](NC(=O)c1ccc2cnccc2c1)[C@@H](C)O	ZINC000450637667	CC	On-Demand	Anodyne	AKT1	25	48
COC(=O)[C@@H](NC(=O)c1ccc2cnccc2c1)[C@@H](C)O	ZINC000450637667	CC	On-Demand	Anodyne	CYP17A1	26	42
COC(=O)[C@H](NC(=O)c1ccc2cnccc2c1)[C@H](C)O	ZINC000450637668	CC	On-Demand	Anodyne	AKT1	25	48
COC(=O)[C@H](NC(=O)c1ccc2cnccc2c1)[C@H](C)O	ZINC000450637668	CC	On-Demand	Anodyne	CYP17A1	26	42
COC(=O)[C@@H](NC(=O)c1ccc2cnccc2c1)[C@H](C)O	ZINC000450637669	CC	On-Demand	Anodyne	AKT1	25	48
COC(=O)[C@@H](NC(=O)c1ccc2cnccc2c1)[C@H](C)O	ZINC000450637669	CC	On-Demand	Anodyne	CYP17A1	26	42
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc2ccncc2s1	ZINC000450637670	EF	On-Demand	Anodyne	SELE	45	36
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc2ccncc2s1	ZINC000450637670	EF	On-Demand	Anodyne	VCAM1	57	33
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc2ccncc2s1	ZINC000450637671	EF	On-Demand	Anodyne	SELE	45	36
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc2ccncc2s1	ZINC000450637671	EF	On-Demand	Anodyne	VCAM1	57	33
CC[C@H](O)CC(=O)N(C)[C@H](CO)c1ccc(OC)cc1	ZINC000450637674	CD	On-Demand	Anodyne	DXR	30	44
CC[C@H](O)CC(=O)N(C)[C@@H](CO)c1ccc(OC)cc1	ZINC000450637675	CD	On-Demand	Anodyne	DXR	30	44
CC[C@@H](O)CC(=O)N(C)[C@@H](CO)c1ccc(OC)cc1	ZINC000450637676	CD	On-Demand	Anodyne	DXR	30	44
CC[C@@H](O)CC(=O)N(C)[C@H](CO)c1ccc(OC)cc1	ZINC000450637677	CD	On-Demand	Anodyne	DXR	30	44
COc1cccc(OCCC(=O)Nc2ccnc(C(=O)N3CCN(C)CC3)c2)c1	ZINC000450637683	GD	On-Demand	Anodyne	HTR1D	15	44
COc1cccc(OCCC(=O)Nc2ccnc(C(=O)N3CCN(C)CC3)c2)c1	ZINC000450637683	GD	On-Demand	Anodyne	HTR1B	23	44
COc1cccc(OCCC(=O)Nc2ccnc(C(=O)N3CCN(C)CC3)c2)c1	ZINC000450637683	GD	On-Demand	Anodyne	MTNR1A	21	41
COc1cccc(OCCC(=O)Nc2ccnc(C(=O)N3CCN(C)CC3)c2)c1	ZINC000450637683	GD	On-Demand	Anodyne	MTNR1B	28	44
CO[C@@H](Cc1ccccc1)CN1CCN(C(C)=O)C2(CCCCC2)C1	ZINC000450637690	EG	On-Demand	Anodyne	SLC12A5	69	39
CO[C@H](Cc1ccccc1)CN1CCN(C(C)=O)C2(CCCCC2)C1	ZINC000450637692	EG	On-Demand	Anodyne	SLC12A5	69	39
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450637693	EF	On-Demand	Anodyne	DRD3	0	51
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450637693	EF	On-Demand	Anodyne	S1PR3	28	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450637695	EF	On-Demand	Anodyne	DRD3	0	51
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450637695	EF	On-Demand	Anodyne	S1PR3	28	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450637696	EF	On-Demand	Anodyne	DRD3	0	51
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450637696	EF	On-Demand	Anodyne	S1PR3	28	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450637697	EF	On-Demand	Anodyne	DRD3	0	51
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(O)c(F)c1	ZINC000450637697	EF	On-Demand	Anodyne	S1PR3	28	40
COC(=O)c1cc(-c2ccccc2CNC(=O)c2cc(C3CC3)[nH]n2)[nH]n1	ZINC000450637700	FE	On-Demand	Anodyne	CDK2	16	44
COC(=O)c1cc(-c2ccccc2CNC(=O)c2cc(C3CC3)[nH]n2)[nH]n1	ZINC000450637700	FE	On-Demand	Anodyne	PKNB	51	34
CC(C)[C@@H]1CCN1C(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450637704	EI	On-Demand	Anodyne	EBP	19	40
CC(C)[C@H]1CCN1C(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450637705	EI	On-Demand	Anodyne	EBP	19	40
CC(C)(O)CN(Cc1ccccc1)C(=O)[C@@H](O)C1CCC1	ZINC000450637706	CD	On-Demand	Anodyne	AMY2	44	30
CC(C)(O)CN(Cc1ccccc1)C(=O)[C@H](O)C1CCC1	ZINC000450637707	CD	On-Demand	Anodyne	AMY2	44	30
COC(=O)C1(CN2CCc3c(ccc(OC)c3OC)C2)CC1	ZINC000450637712	DE	On-Demand	Anodyne	AGTR2	45	35
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C)nc(C)c2C)CC1	ZINC000450637713	GG	On-Demand	Anodyne	SLC12A5	49	33
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cc(C)nc(C3CC3)n2)CC1	ZINC000450637714	GH	On-Demand	Anodyne	P2RY12	43	31
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)c(C)n2)CC1	ZINC000450637722	GG	On-Demand	Mild	P2RY12	42	39
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1cccc(C(F)(F)F)n1	ZINC000450637731	GF	On-Demand	Anodyne	CDK1	21	44
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1cccc(C(F)(F)F)n1	ZINC000450637731	GF	On-Demand	Anodyne	CDK4	23	44
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1cccc(C(F)(F)F)n1	ZINC000450637731	GF	On-Demand	Anodyne	CALCA	0	45
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)c1cccc(C(F)(F)F)n1	ZINC000450637731	GF	On-Demand	Anodyne	CARM1	65	39
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637741	GH	On-Demand	Anodyne	DRD4	24	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637741	GH	On-Demand	Anodyne	SIGMAR1	22	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637741	GH	On-Demand	Anodyne	MLNR	45	33
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637742	GH	On-Demand	Anodyne	DRD4	24	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637742	GH	On-Demand	Anodyne	SIGMAR1	22	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637742	GH	On-Demand	Anodyne	MLNR	45	33
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637743	GH	On-Demand	Anodyne	DRD4	24	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637743	GH	On-Demand	Anodyne	SIGMAR1	22	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637743	GH	On-Demand	Anodyne	MLNR	45	33
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637744	GH	On-Demand	Anodyne	DRD4	24	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637744	GH	On-Demand	Anodyne	SIGMAR1	22	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450637744	GH	On-Demand	Anodyne	MLNR	45	33
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3c(Cl)ccc(Cl)c3n2)C1	ZINC000450637747	GI	On-Demand	Anodyne	CHRNA4	30	47
CC(F)(F)C(C)(C)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450637748	EF	On-Demand	Anodyne	P2RX7	0	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450637749	DG	On-Demand	Anodyne	DRD4	24	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450637749	DG	On-Demand	Anodyne	SIGMAR1	28	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450637750	DG	On-Demand	Anodyne	DRD4	21	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450637750	DG	On-Demand	Anodyne	SIGMAR1	26	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450637751	DG	On-Demand	Anodyne	DRD4	24	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450637751	DG	On-Demand	Anodyne	SIGMAR1	28	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450637752	DG	On-Demand	Anodyne	DRD4	21	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450637752	DG	On-Demand	Anodyne	SIGMAR1	26	42
CC(C)OC(=O)CCCNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450637758	DG	On-Demand	Anodyne	SCN9A	18	42
CC(C)OC(=O)CCCNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450637759	DG	On-Demand	Anodyne	SCN9A	18	42
CC(C)OC(=O)CCCNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450637760	DG	On-Demand	Anodyne	SCN9A	18	42
CC(C)OC(=O)CCCNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450637761	DG	On-Demand	Anodyne	SCN9A	18	42
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cncc(C(=O)OC)n2)CC1	ZINC000450637767	GE	On-Demand	Anodyne	P2RY12	43	36
CC(C)OC(=O)CCCNC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450637768	DF	On-Demand	Anodyne	EPHX2	25	43
CC(C)OC(=O)CCCNC(=O)[C@H]1CC12CCSCC2	ZINC000450637769	CE	On-Demand	Anodyne	EPHX2	43	51
CC(C)OC(=O)CCCNC(=O)[C@@H]1CC12CCSCC2	ZINC000450637770	CE	On-Demand	Anodyne	EPHX2	43	51
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C)c(C#N)n2)CC1	ZINC000450637771	GG	On-Demand	Mild	P2RY12	40	35
Cc1nc2ccnn2cc1C(=O)NCCCC(=O)OC(C)C	ZINC000450637773	DD	On-Demand	Anodyne	DDR1	53	39
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000450637793	GH	On-Demand	Bother	SLC12A5	45	32
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncc(C(F)F)cn2)C1	ZINC000450637805	DE	On-Demand	Anodyne	CHRNA4	31	48
O=C1CC[C@H](CN2CCC3(CC2)CCN(Cc2ccccc2)C3)CCN1	ZINC000450637867	FF	On-Demand	Anodyne	SIGMAR1	61	46
O=C1CC[C@@H](CN2CCC3(CC2)CCN(Cc2ccccc2)C3)CCN1	ZINC000450637868	FF	On-Demand	Anodyne	SIGMAR1	61	46
C[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450637871	EF	On-Demand	Anodyne	SLC6A1	0	42
C[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450637871	EF	On-Demand	Anodyne	CACNA1D	32	40
C[C@H]1CN(CCc2ccc(Cl)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450637872	EF	On-Demand	Anodyne	SLC6A1	0	42
C[C@H]1CN(CCc2ccc(Cl)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450637872	EF	On-Demand	Anodyne	CACNA1D	32	40
C[C@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450637873	EF	On-Demand	Anodyne	SLC6A1	0	42
C[C@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450637873	EF	On-Demand	Anodyne	CACNA1D	32	40
C[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450637874	EF	On-Demand	Anodyne	SLC6A1	0	42
C[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450637874	EF	On-Demand	Anodyne	CACNA1D	32	40
CCOC(=O)c1cnn(C2CCN(c3ccc4ccc(F)cc4n3)CC2)c1	ZINC000450637900	FH	On-Demand	Anodyne	P2RY12	40	37
CCOC(=O)c1cnn(C2CCN(c3ccc4ccc(F)cc4n3)CC2)c1	ZINC000450637900	FH	On-Demand	Anodyne	SCD1	26	40
CCOC(=O)c1cnn(C2CCN(c3ccnc4ccc(C)cc34)CC2)c1	ZINC000450637903	FH	On-Demand	Anodyne	HCRTR1	40	37
CCCC[C@@H](NC(=O)[C@H]1CC1(F)F)C(=O)OC(C)(C)C	ZINC000450637904	CF	On-Demand	Anodyne	CTSK	0	48
CCCC[C@H](NC(=O)[C@@H]1CC1(F)F)C(=O)OC(C)(C)C	ZINC000450637905	CF	On-Demand	Anodyne	CTSK	0	48
CCCC[C@@H](NC(=O)[C@@H]1CC1(F)F)C(=O)OC(C)(C)C	ZINC000450637906	CF	On-Demand	Anodyne	CTSK	0	48
CCCC[C@H](NC(=O)[C@H]1CC1(F)F)C(=O)OC(C)(C)C	ZINC000450637907	CF	On-Demand	Anodyne	CTSK	0	48
CCOC(=O)c1cnn(C2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450637908	FG	On-Demand	Anodyne	HTR3A	35	43
CCOC(=O)c1cnn(C2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450637908	FG	On-Demand	Anodyne	P2RY12	41	37
CCOC(=O)c1cnn(C2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450637908	FG	On-Demand	Anodyne	PDE1B	0	41
CCOC(=O)c1cnn(C2CCN(c3ccc4ccccc4n3)CC2)c1	ZINC000450637908	FG	On-Demand	Anodyne	SMO	47	33
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccccc2CN2CCNC2=O)cn1	ZINC000450637912	GF	On-Demand	Anodyne	KLKB1	23	42
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccccc2CN2CCNC2=O)cn1	ZINC000450637912	GF	On-Demand	Anodyne	F10	23	42
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccccc2CN2CCNC2=O)cn1	ZINC000450637912	GF	On-Demand	Anodyne	HDAC1	33	40
CC(C)(C[C@@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc23)C1)C(N)=O	ZINC000450637920	FF	On-Demand	Bother	SIRT3	58	35
CC(C)(C[C@@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc23)C1)C(N)=O	ZINC000450637920	FF	On-Demand	Bother	SIRT2	50	34
CC(C)(C[C@@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc23)C1)C(N)=O	ZINC000450637920	FF	On-Demand	Bother	SIRT1	51	34
CC(C)(C[C@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc23)C1)C(N)=O	ZINC000450637921	FF	On-Demand	Bother	SIRT3	58	35
CC(C)(C[C@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc23)C1)C(N)=O	ZINC000450637921	FF	On-Demand	Bother	SIRT2	50	34
CC(C)(C[C@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc23)C1)C(N)=O	ZINC000450637921	FF	On-Demand	Bother	SIRT1	51	34
CC(C)(C[C@@H]1CCCN(c2ccnc3ccccc23)C1)C(N)=O	ZINC000450637922	DG	On-Demand	Anodyne	HNMT	40	33
CC(C)(C[C@@H]1CCCN(c2ccnc3ccccc23)C1)C(N)=O	ZINC000450637922	DG	On-Demand	Anodyne	FAP	0	40
CC(C)(C[C@H]1CCCN(c2ccnc3ccccc23)C1)C(N)=O	ZINC000450637923	DG	On-Demand	Anodyne	HNMT	40	33
CC(C)(C[C@H]1CCCN(c2ccnc3ccccc23)C1)C(N)=O	ZINC000450637923	DG	On-Demand	Anodyne	FAP	0	40
CC(C)(CC(=O)CSc1nnc(-c2c[nH]c3ccccc23)o1)C1CC1	ZINC000450637924	FJ	On-Demand	Anodyne	ALOX15	51	36
CN(CC/C=C/c1ccccc1)CCCn1ccnc1	ZINC000450637925	CG	On-Demand	Anodyne	CYP11B1	22	41
CN(CC/C=C/c1ccccc1)CCCn1ccnc1	ZINC000450637925	CG	On-Demand	Anodyne	TBXAS1	44	42
CN(CC/C=C/c1ccccc1)CCCn1ccnc1	ZINC000450637925	CG	On-Demand	Anodyne	CYP11B2	30	42
CN(CC/C=C/c1ccccc1)CCCn1ccnc1	ZINC000450637925	CG	On-Demand	Anodyne	HMOX2	47	35
CN(CC/C=C/c1ccccc1)CCCn1ccnc1	ZINC000450637925	CG	On-Demand	Anodyne	CYP24A1	40	48
CN(CC/C=C/c1ccccc1)CCCn1ccnc1	ZINC000450637925	CG	On-Demand	Anodyne	QPCT	36	40
CN(CC/C=C/c1ccccc1)CCCn1ccnc1	ZINC000450637925	CG	On-Demand	Anodyne	CYP27B1	53	48
CN(CC/C=C\c1ccccc1)CCCn1ccnc1	ZINC000450637926	CG	On-Demand	Anodyne	CYP11B1	22	41
CN(CC/C=C\c1ccccc1)CCCn1ccnc1	ZINC000450637926	CG	On-Demand	Anodyne	TBXAS1	44	42
CN(CC/C=C\c1ccccc1)CCCn1ccnc1	ZINC000450637926	CG	On-Demand	Anodyne	CYP11B2	30	42
CN(CC/C=C\c1ccccc1)CCCn1ccnc1	ZINC000450637926	CG	On-Demand	Anodyne	HMOX2	47	35
CN(CC/C=C\c1ccccc1)CCCn1ccnc1	ZINC000450637926	CG	On-Demand	Anodyne	CYP24A1	40	48
CN(CC/C=C\c1ccccc1)CCCn1ccnc1	ZINC000450637926	CG	On-Demand	Anodyne	QPCT	36	40
CN(CC/C=C\c1ccccc1)CCCn1ccnc1	ZINC000450637926	CG	On-Demand	Anodyne	CYP27B1	53	48
CO[C@]1(CNC(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CCOC1	ZINC000450637927	FE	On-Demand	Anodyne	TRPC6	59	32
CO[C@]1(CNC(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CCOC1	ZINC000450637927	FE	On-Demand	Anodyne	TRPC3	40	32
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450637928	EH	On-Demand	Anodyne	SMO	47	34
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450637928	EH	On-Demand	Anodyne	ETHR	78	56
CO[C@@]1(CNC(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CCOC1	ZINC000450637929	FE	On-Demand	Anodyne	TRPC6	59	32
CO[C@@]1(CNC(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CCOC1	ZINC000450637929	FE	On-Demand	Anodyne	TRPC3	40	32
CC[C@H](CC(F)(F)F)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450637930	EH	On-Demand	Anodyne	SMO	47	34
CC[C@H](CC(F)(F)F)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450637930	EH	On-Demand	Anodyne	ETHR	78	56
CCNC(=O)c1ccc(N2CCC(n3cc(C(=O)OCC)cn3)CC2)nn1	ZINC000450637933	FD	On-Demand	Anodyne	SCD1	56	42
CCNC(=O)c1ccc(N2CCC(n3cc(C(=O)OCC)cn3)CC2)nn1	ZINC000450637933	FD	On-Demand	Anodyne	SCD	47	39
CCC[C@@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC(C)(C)C	ZINC000450637935	DD	On-Demand	Anodyne	SSTR2	45	32
CCC[C@@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC(C)(C)C	ZINC000450637935	DD	On-Demand	Anodyne	P2RY12	42	33
CCC[C@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC(C)(C)C	ZINC000450637937	DD	On-Demand	Anodyne	SSTR2	45	32
CCC[C@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC(C)(C)C	ZINC000450637937	DD	On-Demand	Anodyne	P2RY12	42	33
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450637954	GE	On-Demand	Anodyne	AKT2	44	37
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450637954	GE	On-Demand	Anodyne	AKT1	49	38
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450637955	GE	On-Demand	Anodyne	AKT2	44	37
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450637955	GE	On-Demand	Anodyne	AKT1	49	38
CCCC[C@H](NC(=O)c1cn(-c2cccnc2)nn1)C(=O)OC(C)(C)C	ZINC000450637959	FE	On-Demand	Anodyne	SSTR2	44	36
CCCC[C@H](NC(=O)c1cn(-c2cccnc2)nn1)C(=O)OC(C)(C)C	ZINC000450637959	FE	On-Demand	Anodyne	P2RY12	46	35
CCCC[C@@H](NC(=O)c1cn(-c2cccnc2)nn1)C(=O)OC(C)(C)C	ZINC000450637960	FE	On-Demand	Anodyne	SSTR2	44	36
CCCC[C@@H](NC(=O)c1cn(-c2cccnc2)nn1)C(=O)OC(C)(C)C	ZINC000450637960	FE	On-Demand	Anodyne	P2RY12	46	35
COc1cc(OC)c2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450637971	FF	On-Demand	Anodyne	PDE3A	48	39
COc1cc(OC)c2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450637971	FF	On-Demand	Anodyne	PDE3B	70	39
COc1cc(OC)c2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450637971	FF	On-Demand	Anodyne	SIRT3	43	32
COc1cc(OC)c2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450637973	FF	On-Demand	Anodyne	PDE3A	48	39
COc1cc(OC)c2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450637973	FF	On-Demand	Anodyne	PDE3B	70	39
COc1cc(OC)c2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1	ZINC000450637973	FF	On-Demand	Anodyne	SIRT3	43	32
C[C@@H]1Cc2cccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)c2O1	ZINC000450637976	FE	On-Demand	Anodyne	SCN10A	18	41
C[C@@H]1Cc2cccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)c2O1	ZINC000450637976	FE	On-Demand	Anodyne	STAT6	50	34
C[C@H]1Cc2cccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)c2O1	ZINC000450637978	FE	On-Demand	Anodyne	SCN10A	18	41
C[C@H]1Cc2cccc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)c2O1	ZINC000450637978	FE	On-Demand	Anodyne	STAT6	50	34
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	MME	38	40
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	MC4R	50	37
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	CTSB	41	43
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	TRY2_BOVIN	52	38
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	CYSP_TRYCR	43	44
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	CTSS	39	42
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	ACE2	57	34
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	CTSV	49	34
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	CTRB_BOVIN	47	33
Cn1c(C#N)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637983	FD	On-Demand	Mild	DERP1	0	43
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	MME	38	40
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	MC4R	50	37
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	CTSB	41	43
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	TRY2_BOVIN	52	38
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	CYSP_TRYCR	43	44
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	CTSS	39	42
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	ACE2	57	34
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	CTSV	49	34
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	CTRB_BOVIN	47	33
Cn1c(C#N)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450637991	FD	On-Demand	Mild	DERP1	0	43
CCOC(=O)c1cnn(C2CCN(c3nccc(C#N)c3Cl)CC2)c1	ZINC000450637992	FF	On-Demand	Mild	P2RY12	23	41
COc1ccc([C@H](CO)N(C)C(=O)C[C@@H](CNC(C)=O)CC(C)C)cc1	ZINC000450638000	FE	On-Demand	Anodyne	MTNR1A	20	41
COc1ccc([C@H](CO)N(C)C(=O)C[C@@H](CNC(C)=O)CC(C)C)cc1	ZINC000450638000	FE	On-Demand	Anodyne	MTNR1B	17	41
COc1ccc([C@@H](CO)N(C)C(=O)C[C@@H](CNC(C)=O)CC(C)C)cc1	ZINC000450638002	FE	On-Demand	Anodyne	MTNR1A	20	41
COc1ccc([C@@H](CO)N(C)C(=O)C[C@@H](CNC(C)=O)CC(C)C)cc1	ZINC000450638002	FE	On-Demand	Anodyne	MTNR1B	17	41
CCC[C@@H](NC(=O)c1ccc(C#N)n1C)C(=O)OC(C)(C)C	ZINC000450638007	DE	On-Demand	Mild	PAPA1_CARPA	44	40
CCC[C@@H](NC(=O)c1ccc(C#N)n1C)C(=O)OC(C)(C)C	ZINC000450638007	DE	On-Demand	Mild	CTRB_BOVIN	54	32
CCC[C@H](NC(=O)c1ccc(C#N)n1C)C(=O)OC(C)(C)C	ZINC000450638008	DE	On-Demand	Mild	PAPA1_CARPA	44	40
CCC[C@H](NC(=O)c1ccc(C#N)n1C)C(=O)OC(C)(C)C	ZINC000450638008	DE	On-Demand	Mild	CTRB_BOVIN	54	32
CC(C)c1cc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)ncn1	ZINC000450638016	DF	On-Demand	Anodyne	SIRT3	42	30
CC(C)c1cc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)ncn1	ZINC000450638018	DF	On-Demand	Anodyne	SIRT3	42	30
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450638019	EC	On-Demand	Anodyne	INHA	62	34
CCOC(=O)c1cnn(C2CCN(c3nc(-c4ccc(OC)cc4)no3)CC2)c1	ZINC000450638022	GF	On-Demand	Anodyne	COLA	0	40
CCOC(=O)c1cnn(C2CCN(c3nc(-c4ccc(OC)cc4)no3)CC2)c1	ZINC000450638022	GF	On-Demand	Anodyne	CPT1A	15	40
CCOC(=O)c1cnn(C2CCN(c3nc(-c4ccc(OC)cc4)no3)CC2)c1	ZINC000450638022	GF	On-Demand	Anodyne	MTOR	44	36
CCC[C@@H](O)CN(C)CCCn1ccnc1	ZINC000450638041	BD	On-Demand	Anodyne	TBXAS1	23	49
CCC[C@H](O)CN(C)CCCn1ccnc1	ZINC000450638047	BD	On-Demand	Anodyne	TBXAS1	23	49
CC(C)(C[C@@H]1CCCN(c2nccc(C(F)F)n2)C1)C(N)=O	ZINC000450638049	DF	On-Demand	Anodyne	GPBAR1	0	41
CC(C)(C[C@H]1CCCN(c2nccc(C(F)F)n2)C1)C(N)=O	ZINC000450638050	DF	On-Demand	Anodyne	GPBAR1	0	41
CNC(=O)c1ccc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450638052	FE	On-Demand	Bother	TAAR1	16	42
CNC(=O)c1ccc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450638053	FE	On-Demand	Bother	TAAR1	16	42
Cc1cncc(-c2nc(CN3CCN(C(=O)[C@@H](C)O)CC3)no2)c1	ZINC000450638054	EC	On-Demand	Anodyne	ACOX1	34	40
Cc1cncc(-c2nc(CN3CCN(C(=O)[C@H](C)O)CC3)no2)c1	ZINC000450638056	EC	On-Demand	Anodyne	ACOX1	34	40
CCCC[C@@H](NC(=O)c1cc(OCC)no1)C(=O)OC(C)(C)C	ZINC000450638064	EF	On-Demand	Anodyne	CTSK	29	41
CCCC[C@H](NC(=O)c1cc(OCC)no1)C(=O)OC(C)(C)C	ZINC000450638065	EF	On-Demand	Anodyne	CTSK	29	41
CCCC[C@@H](NC(=O)C[S@](=O)CC)C(=O)OC(C)(C)C	ZINC000450638067	DD	On-Demand	Anodyne	CTSK	26	50
CCCC[C@@H](NC(=O)C[S@](=O)CC)C(=O)OC(C)(C)C	ZINC000450638067	DD	On-Demand	Anodyne	NOD1	77	35
CCCC[C@@H](NC(=O)C[S@@](=O)CC)C(=O)OC(C)(C)C	ZINC000450638068	DD	On-Demand	Anodyne	CTSK	26	50
CCCC[C@@H](NC(=O)C[S@@](=O)CC)C(=O)OC(C)(C)C	ZINC000450638068	DD	On-Demand	Anodyne	NOD1	77	35
CCCC[C@H](NC(=O)C[S@](=O)CC)C(=O)OC(C)(C)C	ZINC000450638070	DD	On-Demand	Anodyne	CTSK	26	50
CCCC[C@H](NC(=O)C[S@](=O)CC)C(=O)OC(C)(C)C	ZINC000450638070	DD	On-Demand	Anodyne	NOD1	77	35
CCCC[C@H](NC(=O)C[S@@](=O)CC)C(=O)OC(C)(C)C	ZINC000450638071	DD	On-Demand	Anodyne	CTSK	26	50
CCCC[C@H](NC(=O)C[S@@](=O)CC)C(=O)OC(C)(C)C	ZINC000450638071	DD	On-Demand	Anodyne	NOD1	77	35
O=C1CC[C@H](CN2CCCN(c3ccc(Cl)c(Cl)c3)CC2)CCN1	ZINC000450638083	FG	On-Demand	Anodyne	BCL2A1	45	37
O=C1CC[C@@H](CN2CCCN(c3ccc(Cl)c(Cl)c3)CC2)CCN1	ZINC000450638084	FG	On-Demand	Anodyne	BCL2A1	45	37
Clc1ccc(N2CCCN(Cc3cnn[nH]3)CC2)cc1Cl	ZINC000450638088	EF	On-Demand	Anodyne	DRD1	22	49
Clc1ccc(N2CCCN(Cc3cnn[nH]3)CC2)cc1Cl	ZINC000450638088	EF	On-Demand	Anodyne	BCL2A1	43	36
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nccc(C)c2Cl)CC1	ZINC000450638094	GI	On-Demand	Anodyne	P2RY12	26	40
CC(=O)c1ccc(C#N)cc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000450638097	EF	On-Demand	Mild	CHRNA4	36	51
COC(=O)c1cccc(CN2CCN(c3ncccc3F)CC2)c1Cl	ZINC000450638098	FF	On-Demand	Anodyne	DRD4	34	42
CCc1nc(C)c(CSc2nnc(-c3cc(OC)c(OC)c(OC)c3)o2)o1	ZINC000450638100	GH	On-Demand	Anodyne	TYMS	22	49
CCOc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)on1	ZINC000450638105	FD	On-Demand	Anodyne	BACE2	0	41
CCOc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)on1	ZINC000450638105	FD	On-Demand	Anodyne	CDK4	0	40
CCOc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)on1	ZINC000450638105	FD	On-Demand	Anodyne	CALCA	0	41
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2c(F)cc(C#N)cc2F)CC1	ZINC000450638108	GH	On-Demand	Mild	KCNA3	16	41
COc1cc(CN2CCC(N3CCN(C(C)C)CC3)CC2)ccc1Cl	ZINC000450638109	FG	On-Demand	Anodyne	HRH3	16	43
COc1cc(CN2CCC(N3CCN(C(C)C)CC3)CC2)ccc1Cl	ZINC000450638109	FG	On-Demand	Anodyne	SSTR5	56	39
COc1cc(CN2CCC(N3CCN(C(C)C)CC3)CC2)ccc1Cl	ZINC000450638109	FG	On-Demand	Anodyne	CCR3	24	44
COc1cc(CN2CCC(N3CCN(C(C)C)CC3)CC2)ccc1Cl	ZINC000450638109	FG	On-Demand	Anodyne	MCHR1	15	40
COc1nc(N2CCCCCC2)nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450638114	GE	On-Demand	Anodyne	CHRNA4	28	44
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncc(Cl)cc2F)CC1	ZINC000450638115	GH	On-Demand	Anodyne	P2RY12	54	44
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450638117	GG	On-Demand	Bother	CHRNA4	27	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2cnc(-c3ccccc3)cn2)C1	ZINC000450638118	EF	On-Demand	Anodyne	CHRNA4	39	51
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(F)c1	ZINC000450638119	GE	On-Demand	Anodyne	DRD4	18	50
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(F)c1	ZINC000450638120	GE	On-Demand	Anodyne	DRD4	18	50
Cc1nnnn1-c1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(F)c1	ZINC000450638121	GE	On-Demand	Anodyne	DRD4	18	50
Cc1nnnn1-c1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(F)c1	ZINC000450638122	GE	On-Demand	Anodyne	DRD4	18	50
O=C(CCCC(=O)C1CC1)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638123	FD	On-Demand	Anodyne	CDK1	22	43
O=C(CCCC(=O)C1CC1)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638123	FD	On-Demand	Anodyne	CDK4	24	43
O=C(CCCC(=O)C1CC1)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638123	FD	On-Demand	Anodyne	CALCA	0	40
Cc1cnc(CCCC(=O)N2CCC(Cc3ccc(C(C)C)cc3)CC2)o1	ZINC000450638126	FJ	On-Demand	Anodyne	GRIN2B	35	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3cc(F)ccc23)C1	ZINC000450638127	EG	On-Demand	Anodyne	CHRNA4	30	50
CCOC(=O)c1ccc(CN2CCc3ccc(Cl)cc3C2)nc1	ZINC000450638136	EG	On-Demand	Anodyne	P2RY12	32	42
CCOC(=O)c1ccc(CN2CCc3ccc(Cl)cc3C2)nc1	ZINC000450638136	EG	On-Demand	Anodyne	NOD1	31	48
CCOC(=O)c1ccc(CN2CCc3ccc(Cl)cc3C2)nc1	ZINC000450638136	EG	On-Demand	Anodyne	NOD2	47	48
Cc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c([N+](=O)[O-])cc1C(F)(F)F	ZINC000450638137	GH	On-Demand	Bother	CHRNA4	26	42
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc3ccccc3n2)CC1	ZINC000450638141	GI	On-Demand	Anodyne	HTR3A	45	51
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc3ccccc3n2)CC1	ZINC000450638141	GI	On-Demand	Anodyne	P2RY12	51	36
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc3ccccc3n2)CC1	ZINC000450638141	GI	On-Demand	Anodyne	PDE1B	0	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc3ccccc3n2)CC1	ZINC000450638141	GI	On-Demand	Anodyne	SORD	26	45
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(CC)cc(CC)n2)CC1	ZINC000450638148	GH	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(CC)cc(CC)n2)CC1	ZINC000450638148	GH	On-Demand	Anodyne	SLC12A5	52	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@@H](C2CC2)C1	ZINC000450638169	EF	On-Demand	Anodyne	CAPN2	15	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@H](C2CC2)C1	ZINC000450638170	EF	On-Demand	Anodyne	CAPN2	15	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1	ZINC000450638171	EF	On-Demand	Anodyne	CAPN2	15	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@H](C2CC2)C1	ZINC000450638172	EF	On-Demand	Anodyne	CAPN2	15	40
CC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1O	ZINC000450638177	CF	On-Demand	Anodyne	DRD3	0	40
CC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1O	ZINC000450638177	CF	On-Demand	Anodyne	SSTR5	43	36
CC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@H]1O	ZINC000450638178	CF	On-Demand	Anodyne	DRD3	0	40
CC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@H]1O	ZINC000450638178	CF	On-Demand	Anodyne	SSTR5	43	36
CC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@H]1O	ZINC000450638179	CF	On-Demand	Anodyne	DRD3	0	40
CC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@H]1O	ZINC000450638179	CF	On-Demand	Anodyne	SSTR5	43	36
CC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1O	ZINC000450638180	CF	On-Demand	Anodyne	DRD3	0	40
CC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1O	ZINC000450638180	CF	On-Demand	Anodyne	SSTR5	43	36
CC(C)N1CCN(C2CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450638187	GI	On-Demand	Anodyne	MC4R	23	41
CC(C)N1CCN(C2CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450638187	GI	On-Demand	Anodyne	L3MBTL3	50	43
Cc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)ncn1	ZINC000450638188	CD	On-Demand	Anodyne	CHRNA4	39	52
NS(=O)(=O)c1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc([N+](=O)[O-])c1	ZINC000450638189	GD	On-Demand	Bother	CHRNA4	27	50
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncncc2Cl)CC1	ZINC000450638193	FG	On-Demand	Anodyne	P2RY12	35	45
c1ccc(CN2CCC3(CCN(C[C@H]4C[C@H]5CC[C@H]4O5)CC3)C2)cc1	ZINC000450638206	EH	On-Demand	Anodyne	SIGMAR1	47	40
c1ccc(CN2CCC3(CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)CC3)C2)cc1	ZINC000450638207	EH	On-Demand	Anodyne	SIGMAR1	47	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450638233	GE	On-Demand	Bother	CACNA1C	56	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450638233	GE	On-Demand	Bother	CACNA1D	86	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450638234	GE	On-Demand	Bother	CACNA1C	56	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450638234	GE	On-Demand	Bother	CACNA1D	86	41
CCOC(=O)c1cc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)on1	ZINC000450638253	FD	On-Demand	Anodyne	P2RX7	22	42
C[C@@H](O)[C@H]1CCCCN1C(=O)CN1C(=O)NC(C)(C)C1=O	ZINC000450638255	CC	On-Demand	Anodyne	NAT	0	40
C[C@H](O)[C@@H]1CCCCN1C(=O)CN1C(=O)NC(C)(C)C1=O	ZINC000450638256	CC	On-Demand	Anodyne	NAT	0	40
C[C@H](O)[C@H]1CCCCN1C(=O)CN1C(=O)NC(C)(C)C1=O	ZINC000450638257	CC	On-Demand	Anodyne	NAT	0	40
C[C@@H](O)[C@@H]1CCCCN1C(=O)CN1C(=O)NC(C)(C)C1=O	ZINC000450638258	CC	On-Demand	Anodyne	NAT	0	40
CCOC(=O)CC(C)(C)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450638260	DF	On-Demand	Anodyne	AMY2	53	33
CCOC(=O)CC(C)(C)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450638261	DF	On-Demand	Anodyne	AMY2	53	33
CCOC(=O)CC(C)(C)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450638262	DF	On-Demand	Anodyne	AMY2	53	33
CCOC(=O)CC(C)(C)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450638263	DF	On-Demand	Anodyne	AMY2	53	33
C[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1N1CCN(C)CC1	ZINC000450638268	GF	On-Demand	Anodyne	SLC18A3	22	41
C[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1N1CCN(C)CC1	ZINC000450638269	GF	On-Demand	Anodyne	SLC18A3	22	41
C[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1N1CCN(C)CC1	ZINC000450638270	GF	On-Demand	Anodyne	SLC18A3	22	41
C[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1N1CCN(C)CC1	ZINC000450638271	GF	On-Demand	Anodyne	SLC18A3	22	41
NC(=O)c1ccc(CCC(=O)N2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450638272	FD	On-Demand	Anodyne	PTGER4	40	33
COc1cc(CC(=O)N2CC[C@H](C)C3(CCCCC3)C2)ccc1O	ZINC000450638276	EH	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)N2CC[C@H](C)C3(CCCCC3)C2)ccc1O	ZINC000450638276	EH	On-Demand	Anodyne	MLNR	20	40
COc1cc(CC(=O)N2CC[C@H](C)C3(CCCCC3)C2)ccc1O	ZINC000450638276	EH	On-Demand	Anodyne	RORC	45	35
COc1cc(CC(=O)N2CC[C@@H](C)C3(CCCCC3)C2)ccc1O	ZINC000450638277	EH	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)N2CC[C@@H](C)C3(CCCCC3)C2)ccc1O	ZINC000450638277	EH	On-Demand	Anodyne	MLNR	20	40
COc1cc(CC(=O)N2CC[C@@H](C)C3(CCCCC3)C2)ccc1O	ZINC000450638277	EH	On-Demand	Anodyne	RORC	45	35
COc1ccc(CC(=O)N2CCCC[C@H]2[C@H](C)O)c(Cl)c1OC	ZINC000450638278	EF	On-Demand	Anodyne	OPRK1	0	44
COc1ccc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)c(Cl)c1OC	ZINC000450638279	EF	On-Demand	Anodyne	OPRK1	0	44
COc1ccc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)c(Cl)c1OC	ZINC000450638280	EF	On-Demand	Anodyne	OPRK1	0	44
COc1ccc(CC(=O)N2CCCC[C@H]2[C@@H](C)O)c(Cl)c1OC	ZINC000450638281	EF	On-Demand	Anodyne	OPRK1	0	44
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450638284	DG	On-Demand	Anodyne	CPT1A	88	36
C[C@@H](O)[C@H]1CCCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450638285	DG	On-Demand	Anodyne	CPT1A	88	36
C[C@H](O)[C@H]1CCCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450638286	DG	On-Demand	Anodyne	CPT1A	88	36
C[C@H](O)[C@@H]1CCCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450638287	DG	On-Demand	Anodyne	CPT1A	88	36
CCC1(Nc2cc(-c3ccccc3)nc3ncnn23)CC1	ZINC000450638290	CG	On-Demand	Anodyne	DHOD	0	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(C(F)F)cc1	ZINC000450638299	GH	On-Demand	Anodyne	CA5B	26	46
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(C(F)F)cc1	ZINC000450638299	GH	On-Demand	Anodyne	CA5A	26	46
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(C(F)F)cc1	ZINC000450638299	GH	On-Demand	Anodyne	CA9	17	45
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(C(F)F)cc1	ZINC000450638299	GH	On-Demand	Anodyne	E1	0	47
CCC(CC)Oc1ccc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450638306	GJ	On-Demand	Anodyne	SMO	59	41
CCC(CC)Oc1ccc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450638306	GJ	On-Demand	Anodyne	L3MBTL3	40	33
CCC(CC)Oc1ccc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450638306	GJ	On-Demand	Anodyne	ETHR	67	43
C[C@@H](O)C(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450638308	CD	On-Demand	Anodyne	DPP7	36	42
C[C@H](O)C(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450638309	CD	On-Demand	Anodyne	DPP7	36	42
CC[C@@H]1C[C@H]1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450638311	DD	On-Demand	Anodyne	STAT6	44	33
CCOC(=O)c1cnn(C2CCN(c3nc(NC)c4ccccc4n3)CC2)c1	ZINC000450638314	GE	On-Demand	Anodyne	P2RY12	44	38
CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@H]1CCCN(C)C1=O	ZINC000450638321	EF	On-Demand	Anodyne	BIRC2	50	36
CC(C)[C@@H]1CCc2ccccc2[C@H]1NC(=O)[C@H]1CCCN(C)C1=O	ZINC000450638323	EF	On-Demand	Anodyne	BIRC2	50	36
CCOC(=O)c1sc(Sc2ncccn2)nc1C	ZINC000450638324	CF	On-Demand	Anodyne	DHODH	24	46
CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@@H]1CCCN(C)C1=O	ZINC000450638325	EF	On-Demand	Anodyne	BIRC2	50	36
CC(C)[C@@H]1CCc2ccccc2[C@H]1NC(=O)[C@@H]1CCCN(C)C1=O	ZINC000450638326	EF	On-Demand	Anodyne	BIRC2	50	36
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccc2nccnc2n1	ZINC000450638329	FD	On-Demand	Anodyne	SCN10A	22	43
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccc2nccnc2n1	ZINC000450638329	FD	On-Demand	Anodyne	STAT6	50	34
CC(F)(F)c1ccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)cn1	ZINC000450638332	GE	On-Demand	Anodyne	SCN10A	20	44
CC(F)(F)c1ccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)cn1	ZINC000450638332	GE	On-Demand	Anodyne	CXCR3	20	41
CC(F)(F)c1ccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)cn1	ZINC000450638332	GE	On-Demand	Anodyne	STAT6	51	34
CC(F)(F)c1ccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)cn1	ZINC000450638332	GE	On-Demand	Anodyne	NAMPT	42	42
CC[C@@H](O)CC(=O)Nc1cc(OC)c(Br)c(OC)c1	ZINC000450638342	EF	On-Demand	Anodyne	ENPP1	52	32
CC[C@H](O)CC(=O)Nc1cc(OC)c(Br)c(OC)c1	ZINC000450638344	EF	On-Demand	Anodyne	ENPP1	52	32
CCCC[C@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OC(C)(C)C	ZINC000450638345	EF	On-Demand	Anodyne	P2RY12	70	34
CCCC[C@@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OC(C)(C)C	ZINC000450638346	EF	On-Demand	Anodyne	P2RY12	70	34
CO[C@@]1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCOC1	ZINC000450638348	ED	On-Demand	Anodyne	HCN1	55	35
CO[C@@]1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCOC1	ZINC000450638348	ED	On-Demand	Anodyne	HCN4	47	31
CO[C@]1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCOC1	ZINC000450638355	ED	On-Demand	Anodyne	HCN1	55	35
CO[C@]1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCOC1	ZINC000450638355	ED	On-Demand	Anodyne	HCN4	47	31
CC(C)c1ccc(C[C@@H]2CCN(C(=O)c3ccsn3)C2)cc1	ZINC000450638357	DH	On-Demand	Anodyne	GRIN2B	30	40
CC(C)c1ccc(C[C@H]2CCN(C(=O)c3ccsn3)C2)cc1	ZINC000450638358	DH	On-Demand	Anodyne	GRIN2B	35	40
CCOC(=O)C1([S@@](C)=O)CCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450638367	GD	On-Demand	Bother	CACNA1D	47	33
CCOC(=O)C1([S@](C)=O)CCN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000450638379	GD	On-Demand	Bother	CACNA1D	47	33
CCC[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638381	GG	On-Demand	Anodyne	SSTR2	61	35
CCC[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638381	GG	On-Demand	Anodyne	PDE4D	15	41
CCC[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638381	GG	On-Demand	Anodyne	PDEC	0	41
CCC[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638384	GG	On-Demand	Anodyne	SSTR2	61	35
CCC[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638384	GG	On-Demand	Anodyne	PDE4D	15	41
CCC[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638384	GG	On-Demand	Anodyne	PDEC	0	41
CCC[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638386	GG	On-Demand	Anodyne	SSTR2	61	35
CCC[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638386	GG	On-Demand	Anodyne	PDE4D	15	41
CCC[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638386	GG	On-Demand	Anodyne	PDEC	0	41
CCC[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638387	GG	On-Demand	Anodyne	SSTR2	61	35
CCC[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638387	GG	On-Demand	Anodyne	PDE4D	15	41
CCC[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000450638387	GG	On-Demand	Anodyne	PDEC	0	41
CCc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2s1	ZINC000450638395	EG	On-Demand	Anodyne	SIRT3	71	36
CCc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2s1	ZINC000450638395	EG	On-Demand	Anodyne	SIRT2	52	35
CCc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc2s1	ZINC000450638395	EG	On-Demand	Anodyne	SIRT1	54	35
CCc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2s1	ZINC000450638396	EG	On-Demand	Anodyne	SIRT3	71	36
CCc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2s1	ZINC000450638396	EG	On-Demand	Anodyne	SIRT2	52	35
CCc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc2s1	ZINC000450638396	EG	On-Demand	Anodyne	SIRT1	54	35
CCCC[C@H](NC(=O)Cc1cn(C)nc1C)C(=O)OC(C)(C)C	ZINC000450638397	DE	On-Demand	Anodyne	NOD1	51	34
CCCC[C@@H](NC(=O)Cc1cn(C)nc1C)C(=O)OC(C)(C)C	ZINC000450638399	DE	On-Demand	Anodyne	NOD1	51	34
O=C(CC1CC(F)(F)C1)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450638401	EE	On-Demand	Anodyne	STAT6	44	33
CCC[C@H](NC(=O)c1coc(-c2ccnc(C)c2)n1)C(=O)OC(C)(C)C	ZINC000450638403	FG	On-Demand	Anodyne	IRAK4	21	42
CCC[C@@H](NC(=O)c1coc(-c2ccnc(C)c2)n1)C(=O)OC(C)(C)C	ZINC000450638406	FG	On-Demand	Anodyne	IRAK4	21	42
Cn1c(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nc2c(F)cccc21	ZINC000450638426	EF	On-Demand	Anodyne	DPP4	0	40
Cn1c(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nc2c(F)cccc21	ZINC000450638427	EF	On-Demand	Anodyne	DPP4	0	40
CC(C)c1ccc(C[C@H]2CCN(C(=O)[C@H]3CC3(F)F)C2)cc1	ZINC000450638434	DH	On-Demand	Anodyne	GRIN2B	28	40
CC(C)c1ccc(C[C@@H]2CCN(C(=O)[C@@H]3CC3(F)F)C2)cc1	ZINC000450638438	DH	On-Demand	Anodyne	GRIN2B	28	40
CC(=O)c1ccc(CN(C)CC2CCN(c3ccncc3)CC2)cc1	ZINC000450638439	EH	On-Demand	Anodyne	F10	17	43
CC(C)c1ccc(C[C@H]2CCN(C(=O)[C@@H]3CC3(F)F)C2)cc1	ZINC000450638441	DH	On-Demand	Anodyne	GRIN2B	28	40
CN(CCCC(=O)c1ccccc1)CC1CCN(c2ccncc2)CC1	ZINC000450638443	FH	On-Demand	Anodyne	ACHE	15	43
CN(CCCC(=O)c1ccccc1)CC1CCN(c2ccncc2)CC1	ZINC000450638443	FH	On-Demand	Anodyne	SSTR1	33	47
CN(CCCC(=O)c1ccccc1)CC1CCN(c2ccncc2)CC1	ZINC000450638443	FH	On-Demand	Anodyne	CYP2J2	48	34
CCOC(=O)c1cnn(C2CCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)c1	ZINC000450638444	FF	On-Demand	Bother	P2RY12	47	37
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C3CCC3)no2)CC1	ZINC000450638447	GG	On-Demand	Anodyne	COLA	41	36
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C3CCC3)no2)CC1	ZINC000450638447	GG	On-Demand	Anodyne	CPT1A	40	36
CCCCn1c(S[C@H](C)C(=O)Nc2nccs2)nc2ccccc2c1=O	ZINC000450638449	GH	On-Demand	Anodyne	MAP1	98	38
CCCCn1c(S[C@@H](C)C(=O)Nc2nccs2)nc2ccccc2c1=O	ZINC000450638451	GH	On-Demand	Anodyne	MAP1	98	38
Cc1cccc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450638457	EG	On-Demand	Anodyne	SIRT3	50	31
Cc1cccc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450638457	EG	On-Demand	Anodyne	SIRT1	50	31
Cc1cccc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450638460	EG	On-Demand	Anodyne	SIRT3	50	31
Cc1cccc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450638460	EG	On-Demand	Anodyne	SIRT1	50	31
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638471	FD	On-Demand	Anodyne	AVPR1B	49	40
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638471	FD	On-Demand	Anodyne	ELANE	67	40
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638471	FD	On-Demand	Anodyne	CTRA_BOVIN	52	35
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638471	FD	On-Demand	Anodyne	HDAC8	26	40
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638471	FD	On-Demand	Anodyne	TACR3	49	33
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638471	FD	On-Demand	Anodyne	PLM2_PLAFA	0	42
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638471	FD	On-Demand	Anodyne	IMDH_CRYPV	35	53
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nccc(C(C)(C)C)n2)CC1	ZINC000450638480	GH	On-Demand	Anodyne	SLC6A7	0	40
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638483	FD	On-Demand	Anodyne	AVPR1B	49	40
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638483	FD	On-Demand	Anodyne	ELANE	67	40
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638483	FD	On-Demand	Anodyne	CTRA_BOVIN	52	35
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638483	FD	On-Demand	Anodyne	HDAC8	26	40
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638483	FD	On-Demand	Anodyne	TACR3	49	33
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638483	FD	On-Demand	Anodyne	PLM2_PLAFA	0	42
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@@H](C)O	ZINC000450638483	FD	On-Demand	Anodyne	IMDH_CRYPV	35	53
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638484	FD	On-Demand	Anodyne	AVPR1B	49	40
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638484	FD	On-Demand	Anodyne	ELANE	67	40
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638484	FD	On-Demand	Anodyne	CTRA_BOVIN	52	35
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638484	FD	On-Demand	Anodyne	HDAC8	26	40
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638484	FD	On-Demand	Anodyne	TACR3	49	33
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638484	FD	On-Demand	Anodyne	PLM2_PLAFA	0	42
COC(=O)[C@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638484	FD	On-Demand	Anodyne	IMDH_CRYPV	35	53
CC(C)[C@H]1CCN1C(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450638485	EG	On-Demand	Anodyne	LMCPB	0	45
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638486	FD	On-Demand	Anodyne	AVPR1B	49	40
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638486	FD	On-Demand	Anodyne	ELANE	67	40
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638486	FD	On-Demand	Anodyne	CTRA_BOVIN	52	35
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638486	FD	On-Demand	Anodyne	HDAC8	26	40
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638486	FD	On-Demand	Anodyne	TACR3	49	33
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638486	FD	On-Demand	Anodyne	PLM2_PLAFA	0	42
COC(=O)[C@@H](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)[C@H](C)O	ZINC000450638486	FD	On-Demand	Anodyne	IMDH_CRYPV	35	53
CC(C)[C@@H]1CCN1C(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450638487	EG	On-Demand	Anodyne	LMCPB	0	45
CC(C)OC(C)(C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450638496	CG	On-Demand	Anodyne	TRPV1	18	40
Cn1nc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)c2c1CCCC2	ZINC000450638507	FD	On-Demand	Anodyne	P2RX7	18	42
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450638509	CI	On-Demand	Anodyne	SLC6A1	24	40
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450638509	CI	On-Demand	Anodyne	SLC6A3	15	41
CC(C)[C@H]1CCN1C(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450638513	CI	On-Demand	Anodyne	SLC6A1	24	40
CC(C)[C@H]1CCN1C(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450638513	CI	On-Demand	Anodyne	SLC6A3	15	41
COc1cccc2c(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c(C)cnc12	ZINC000450638514	FG	On-Demand	Anodyne	CHRNA4	27	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3c(Cl)cccc3n2)C1	ZINC000450638517	FH	On-Demand	Anodyne	CHRNA4	30	50
COc1ccc(-c2nnc(SC[C@H]3CCCC3(F)F)o2)cc1OC	ZINC000450638527	FI	On-Demand	Anodyne	GSK3B	17	45
COc1ccc(-c2nnc(SC[C@H]3CCCC3(F)F)o2)cc1OC	ZINC000450638527	FI	On-Demand	Anodyne	GSK3A	44	39
COc1ccc(-c2nnc(SC[C@@H]3CCCC3(F)F)o2)cc1OC	ZINC000450638528	FI	On-Demand	Anodyne	GSK3B	17	45
COc1ccc(-c2nnc(SC[C@@H]3CCCC3(F)F)o2)cc1OC	ZINC000450638528	FI	On-Demand	Anodyne	GSK3A	44	39
COc1ccc(CNC(=O)CCN2CC[C@H](N3CCCC3=O)C2)c(OC)c1	ZINC000450638542	GD	On-Demand	Anodyne	OXTR	16	40
COc1ccc(CNC(=O)CCN2CC[C@@H](N3CCCC3=O)C2)c(OC)c1	ZINC000450638543	GD	On-Demand	Anodyne	OXTR	16	40
C=CCC1(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CCCCC1	ZINC000450638555	GG	On-Demand	Mild	CDK1	20	40
C=CCC1(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CCCCC1	ZINC000450638555	GG	On-Demand	Mild	CDK4	22	40
Cc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)ncc1C(N)=O	ZINC000450638556	FD	On-Demand	Anodyne	DRD3	0	52
Cc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)ncc1C(N)=O	ZINC000450638557	FD	On-Demand	Anodyne	DRD3	0	52
Cc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)ncc1C(N)=O	ZINC000450638558	FD	On-Demand	Anodyne	DRD3	0	52
Cc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)ncc1C(N)=O	ZINC000450638559	FD	On-Demand	Anodyne	DRD3	0	52
COC(=O)c1csc(CN2CCCC[C@H]2CCc2ccccc2)n1	ZINC000450638564	EH	On-Demand	Anodyne	FKBP1A	41	36
COC(=O)c1csc(CN2CCCC[C@H]2CCc2ccccc2)n1	ZINC000450638564	EH	On-Demand	Anodyne	SLC18A2	52	46
COC(=O)c1csc(CN2CCCC[C@H]2CCc2ccccc2)n1	ZINC000450638564	EH	On-Demand	Anodyne	PREP	43	33
COC(=O)c1csc(CN2CCCC[C@@H]2CCc2ccccc2)n1	ZINC000450638565	EH	On-Demand	Anodyne	FKBP1A	41	36
COC(=O)c1csc(CN2CCCC[C@@H]2CCc2ccccc2)n1	ZINC000450638565	EH	On-Demand	Anodyne	SLC18A2	52	46
COC(=O)c1csc(CN2CCCC[C@@H]2CCc2ccccc2)n1	ZINC000450638565	EH	On-Demand	Anodyne	PREP	43	33
Cc1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2c3c(sc2n1)CCCC3	ZINC000450638566	GH	On-Demand	Anodyne	CHRNA4	26	42
CCC[C@@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638569	FG	On-Demand	Anodyne	CDK1	19	40
CCC[C@@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638569	FG	On-Demand	Anodyne	CDK4	0	40
CCC[C@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638570	FG	On-Demand	Anodyne	CDK1	19	40
CCC[C@H](CC(C)C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638570	FG	On-Demand	Anodyne	CDK4	0	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450638572	GE	On-Demand	Anodyne	AKT2	50	46
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450638572	GE	On-Demand	Anodyne	AKT3	36	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450638572	GE	On-Demand	Anodyne	ROCK2	35	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450638572	GE	On-Demand	Anodyne	AKT1	33	44
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450638572	GE	On-Demand	Anodyne	LIMK2	40	36
N#Cc1ccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1[N+](=O)[O-]	ZINC000450638582	EE	On-Demand	Mild	CHRNA4	34	43
CCc1cccc(C(=O)NCCCC(=O)OC(C)C)n1	ZINC000450638586	CE	On-Demand	Anodyne	PDE5A	28	46
COc1cc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)ccc1O	ZINC000450638608	FF	On-Demand	Anodyne	SMO	48	39
COc1cc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)ccc1O	ZINC000450638608	FF	On-Demand	Anodyne	ETHR	73	48
CC(C)CC(CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450638614	EI	On-Demand	Anodyne	SMO	50	35
CC(C)CC(CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450638614	EI	On-Demand	Anodyne	ETHR	67	50
Cc1ccc(-n2c(SC[C@H](O)CC#N)nc3sc4c(c3c2=O)CCC4)cc1	ZINC000450638617	GH	On-Demand	Mild	TGM2	15	46
CC(C)OC(C)(C)C(=O)Nc1n[nH]c(-c2cc(Cl)ccc2Cl)n1	ZINC000450638648	FH	On-Demand	Anodyne	AGPAT2	41	42
CCC1(Nc2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450638660	CG	On-Demand	Anodyne	EGFR	22	41
CCC1(Nc2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450638660	CG	On-Demand	Anodyne	FLT1	26	46
CCC1(Nc2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450638660	CG	On-Demand	Anodyne	EPHA2	47	37
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCCC[C@@H]1[C@@H](C)O	ZINC000450638663	DE	On-Demand	Anodyne	LGMN	52	33
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCCC[C@@H]1[C@H](C)O	ZINC000450638665	DE	On-Demand	Anodyne	LGMN	52	33
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCCC[C@H]1[C@@H](C)O	ZINC000450638667	DE	On-Demand	Anodyne	LGMN	52	33
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCCC[C@H]1[C@H](C)O	ZINC000450638669	DE	On-Demand	Anodyne	LGMN	52	33
CC(=O)[C@@](C)(O)CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450638670	EF	On-Demand	Anodyne	OPRK1	22	46
CC(=O)[C@](C)(O)CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450638673	EF	On-Demand	Anodyne	OPRK1	22	46
CC(=O)c1cccc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)c1	ZINC000450638696	FF	On-Demand	Anodyne	TRY2_BOVIN	45	33
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	ACE	58	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	OPRM1	40	39
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	GHRHR	56	32
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	MME	122	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	ANPEP	62	39
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	TACR1	15	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CTSD	33	40
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	MC4R	65	46
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	FCER2	67	36
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	TACR2	37	44
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CTSB	49	46
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	TRY2_BOVIN	61	38
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	PAPA1_CARPA	46	37
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CYSP_TRYCR	78	52
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CTSF	56	46
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CTSK	16	45
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CTSL	39	45
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CPA1	27	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	NPFFR2	46	32
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	TIMP3	49	32
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CAPNS1	52	33
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	MMP2	18	44
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	MMP3	25	50
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	MMP8	22	44
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	REN	54	40
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CTSS	40	47
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CAPN1	68	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	MMP9	20	44
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CAPN2	54	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	CTSE	44	38
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	ACE2	104	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	PGA5	58	38
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	FPR1	68	34
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	POL	0	49
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	BLA1_STEMA	55	34
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	PSMB8	56	40
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	Q9N6S8_PLAFA	17	43
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638714	GF	On-Demand	Anodyne	DERP1	0	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	ACE	58	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	OPRM1	40	39
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	GHRHR	56	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	MME	122	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	ANPEP	62	39
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	TACR1	15	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CTSD	33	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	MC4R	65	46
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	FCER2	67	36
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	TACR2	37	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CTSB	49	46
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	TRY2_BOVIN	61	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	PAPA1_CARPA	46	37
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CYSP_TRYCR	78	52
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CTSF	56	46
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CTSK	16	45
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CTSL	39	45
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CPA1	27	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	NPFFR2	46	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	TIMP3	49	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CAPNS1	52	33
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	MMP2	18	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	MMP3	25	50
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	MMP8	22	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	REN	54	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CTSS	40	47
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CAPN1	68	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	MMP9	20	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CAPN2	54	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	CTSE	44	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	ACE2	104	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	PGA5	58	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	FPR1	68	34
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	POL	0	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	BLA1_STEMA	55	34
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	PSMB8	56	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	Q9N6S8_PLAFA	17	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638716	GF	On-Demand	Anodyne	DERP1	0	44
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	ACE	58	42
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	OPRM1	40	39
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	GHRHR	56	32
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	MME	122	42
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	ANPEP	62	39
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	TACR1	15	41
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CTSD	33	40
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	MC4R	65	46
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	FCER2	67	36
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	TACR2	37	44
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CTSB	49	46
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	TRY2_BOVIN	61	38
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	PAPA1_CARPA	46	37
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CYSP_TRYCR	78	52
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CTSF	56	46
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CTSK	16	45
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CTSL	39	45
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CPA1	27	42
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	NPFFR2	46	32
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	TIMP3	49	32
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CAPNS1	52	33
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	MMP2	18	44
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	MMP3	25	50
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	MMP8	22	44
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	REN	54	40
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CTSS	40	47
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CAPN1	68	41
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	MMP9	20	44
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CAPN2	54	41
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	CTSE	44	38
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	ACE2	104	42
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	PGA5	58	38
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	FPR1	68	34
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	POL	0	49
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	BLA1_STEMA	55	34
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	PSMB8	56	40
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	Q9N6S8_PLAFA	17	43
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638717	GF	On-Demand	Anodyne	DERP1	0	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	ACE	58	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	OPRM1	40	39
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	GHRHR	56	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	MME	122	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	ANPEP	62	39
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	TACR1	15	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CTSD	33	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	MC4R	65	46
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	FCER2	67	36
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	TACR2	37	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CTSB	49	46
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	TRY2_BOVIN	61	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	PAPA1_CARPA	46	37
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CYSP_TRYCR	78	52
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CTSF	56	46
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CTSK	16	45
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CTSL	39	45
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CPA1	27	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	NPFFR2	46	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	TIMP3	49	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CAPNS1	52	33
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	MMP2	18	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	MMP3	25	50
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	MMP8	22	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	REN	54	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CTSS	40	47
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CAPN1	68	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	MMP9	20	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CAPN2	54	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	CTSE	44	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	ACE2	104	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	PGA5	58	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	FPR1	68	34
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	POL	0	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	BLA1_STEMA	55	34
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	PSMB8	56	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	Q9N6S8_PLAFA	17	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450638718	GF	On-Demand	Anodyne	DERP1	0	44
COC(=O)[C@@H](NC(=O)c1cc2ccncc2s1)[C@H](C)O	ZINC000450638724	CC	On-Demand	Anodyne	ICAM1	67	33
COC(=O)[C@@H](NC(=O)c1cc2ccncc2s1)[C@H](C)O	ZINC000450638724	CC	On-Demand	Anodyne	VCAM1	53	31
COC(=O)[C@@H](NC(=O)c1cc2ccncc2s1)[C@@H](C)O	ZINC000450638725	CC	On-Demand	Anodyne	ICAM1	67	33
COC(=O)[C@@H](NC(=O)c1cc2ccncc2s1)[C@@H](C)O	ZINC000450638725	CC	On-Demand	Anodyne	VCAM1	53	31
COC(=O)[C@H](NC(=O)c1cc2ccncc2s1)[C@@H](C)O	ZINC000450638726	CC	On-Demand	Anodyne	ICAM1	67	33
COC(=O)[C@H](NC(=O)c1cc2ccncc2s1)[C@@H](C)O	ZINC000450638726	CC	On-Demand	Anodyne	VCAM1	53	31
COC(=O)[C@H](NC(=O)c1cc2ccncc2s1)[C@H](C)O	ZINC000450638727	CC	On-Demand	Anodyne	ICAM1	67	33
COC(=O)[C@H](NC(=O)c1cc2ccncc2s1)[C@H](C)O	ZINC000450638727	CC	On-Demand	Anodyne	VCAM1	53	31
CCC(CC)(CCSc1nnc(-c2ccccc2)o1)C(=O)OC	ZINC000450638740	EI	On-Demand	Anodyne	GSK3A	27	41
CCC(CC)(CCSc1nnc(-c2ccccc2)o1)C(=O)OC	ZINC000450638740	EI	On-Demand	Anodyne	ALOX15	62	40
O=C(CC1CC(F)(F)C1)Nc1n[nH]c(-c2cc(Cl)ccc2Cl)n1	ZINC000450638745	FI	On-Demand	Anodyne	ENV	42	32
C[C@H](c1csnn1)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450638747	FH	On-Demand	Anodyne	SIGMAR1	19	57
C[C@@H](c1csnn1)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450638748	FH	On-Demand	Anodyne	SIGMAR1	19	57
CO[C@@H](Cc1ccccc1)C(=O)Nc1ccc(S(C)(=O)=O)c(C(F)F)c1	ZINC000450638757	GG	On-Demand	Anodyne	CAPN2	46	32
CO[C@H](Cc1ccccc1)C(=O)Nc1ccc(S(C)(=O)=O)c(C(F)F)c1	ZINC000450638758	GG	On-Demand	Anodyne	CAPN2	46	32
CCCc1nc(C)c(CSc2nnc(-c3ccccc3)o2)o1	ZINC000450638759	DI	On-Demand	Anodyne	GSK3B	15	47
CCCc1nc(C)c(CSc2nnc(-c3ccccc3)o2)o1	ZINC000450638759	DI	On-Demand	Anodyne	GSK3A	43	47
CCCc1nc(C)c(CSc2nnc(-c3ccccc3)o2)o1	ZINC000450638759	DI	On-Demand	Anodyne	TERT	24	40
CCOC(=O)CC(C)(C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450638772	DF	On-Demand	Anodyne	CTSB	26	43
CCOC(=O)CC(C)(C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450638773	DF	On-Demand	Anodyne	CTSB	26	43
COC(=O)c1csc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450638776	GG	On-Demand	Anodyne	SIGMAR1	66	46
COC(=O)c1csc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450638776	GG	On-Demand	Anodyne	NPFFR2	40	37
COC(=O)c1csc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450638776	GG	On-Demand	Anodyne	ADAM17	15	41
COC(=O)c1csc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450638776	GG	On-Demand	Anodyne	CCR8	43	37
COC(=O)c1csc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450638776	GG	On-Demand	Anodyne	NPFFR1	62	40
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450638782	DC	On-Demand	Anodyne	MMP2	0	49
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450638783	DC	On-Demand	Anodyne	MMP2	0	49
CC1(C)CN(c2ccc(C#N)cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450638786	FI	On-Demand	Mild	ACHE	27	41
CC1(C)CN(c2ccc(C#N)cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450638786	FI	On-Demand	Mild	SIGMAR1	40	39
CC1(C)CN(c2ccc(C#N)cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450638786	FI	On-Demand	Mild	SGPL1	0	44
CC1(C)CN(c2ccc(C#N)cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450638786	FI	On-Demand	Mild	SMO	0	45
CC1(C)CN(c2ccc(C#N)cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450638787	FI	On-Demand	Mild	ACHE	27	41
CC1(C)CN(c2ccc(C#N)cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450638787	FI	On-Demand	Mild	SIGMAR1	40	39
CC1(C)CN(c2ccc(C#N)cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450638787	FI	On-Demand	Mild	SGPL1	0	44
CC1(C)CN(c2ccc(C#N)cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450638787	FI	On-Demand	Mild	SMO	0	45
O=C1CCCN1[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450638797	CF	On-Demand	Anodyne	SLC6A1	41	36
O=C1CCCN1[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450638799	CF	On-Demand	Anodyne	SLC6A1	41	36
O=C1CCCN1[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450638800	CF	On-Demand	Anodyne	SLC6A1	41	36
O=C1CCCN1[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450638802	CF	On-Demand	Anodyne	SLC6A1	41	36
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc(-c4ccncc4)n3)CC2)c1	ZINC000450638812	GG	On-Demand	Anodyne	P2RY12	40	31
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc(-c4ccncc4)n3)CC2)c1	ZINC000450638812	GG	On-Demand	Anodyne	PIK3CA	24	40
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc(-c4ccncc4)n3)CC2)c1	ZINC000450638812	GG	On-Demand	Anodyne	MTOR	73	40
CCOC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)nc1	ZINC000450638827	EE	On-Demand	Anodyne	DRD4	19	44
CCOC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)nc1	ZINC000450638827	EE	On-Demand	Anodyne	P2RY12	50	43
CCOC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)nc1	ZINC000450638827	EE	On-Demand	Anodyne	SSTR5	44	38
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncc(C)s2)CC1	ZINC000450638828	FG	On-Demand	Anodyne	MLYCD	47	39
CCC[C@H](OC)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638844	ED	On-Demand	Anodyne	CDK4	22	41
CCC[C@@H](OC)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638849	ED	On-Demand	Anodyne	CDK4	22	41
CCOc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000450638850	EE	On-Demand	Anodyne	DRD4	24	53
CCOc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000450638850	EE	On-Demand	Anodyne	DRD3	21	53
CCOc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)on1	ZINC000450638851	EE	On-Demand	Anodyne	DRD4	24	53
CCOc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)on1	ZINC000450638851	EE	On-Demand	Anodyne	DRD3	21	53
CCOc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)on1	ZINC000450638852	EE	On-Demand	Anodyne	DRD4	24	53
CCOc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)on1	ZINC000450638852	EE	On-Demand	Anodyne	DRD3	21	53
CCOc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000450638854	EE	On-Demand	Anodyne	DRD4	24	53
CCOc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000450638854	EE	On-Demand	Anodyne	DRD3	21	53
Cc1nc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)c2cc[nH]c2n1	ZINC000450638860	DE	On-Demand	Anodyne	JAK1	64	34
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](N2CCCC2=O)C1	ZINC000450638865	DD	On-Demand	Anodyne	OPRM1	0	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](N2CCCC2=O)C1	ZINC000450638865	DD	On-Demand	Anodyne	OPRK1	28	40
Cc1nc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c2cc[nH]c2n1	ZINC000450638866	DE	On-Demand	Anodyne	JAK1	64	34
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](N2CCCC2=O)C1	ZINC000450638870	DD	On-Demand	Anodyne	OPRM1	0	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](N2CCCC2=O)C1	ZINC000450638870	DD	On-Demand	Anodyne	OPRK1	28	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](N2CCCC2=O)C1	ZINC000450638871	DD	On-Demand	Anodyne	OPRM1	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](N2CCCC2=O)C1	ZINC000450638871	DD	On-Demand	Anodyne	OPRK1	28	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](N2CCCC2=O)C1	ZINC000450638872	DD	On-Demand	Anodyne	OPRM1	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](N2CCCC2=O)C1	ZINC000450638872	DD	On-Demand	Anodyne	OPRK1	28	40
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1O	ZINC000450638875	ED	On-Demand	Anodyne	MTR1B_CHICK	0	40
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1O	ZINC000450638875	ED	On-Demand	Anodyne	MTNR1A	58	37
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1O	ZINC000450638875	ED	On-Demand	Anodyne	MTNR1B	44	40
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1O	ZINC000450638876	ED	On-Demand	Anodyne	MTR1B_CHICK	0	40
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1O	ZINC000450638876	ED	On-Demand	Anodyne	MTNR1A	58	37
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1O	ZINC000450638876	ED	On-Demand	Anodyne	MTNR1B	44	40
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1O	ZINC000450638878	ED	On-Demand	Anodyne	MTR1B_CHICK	0	40
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1O	ZINC000450638878	ED	On-Demand	Anodyne	MTNR1A	58	37
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1O	ZINC000450638878	ED	On-Demand	Anodyne	MTNR1B	44	40
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1O	ZINC000450638879	ED	On-Demand	Anodyne	MTR1B_CHICK	0	40
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1O	ZINC000450638879	ED	On-Demand	Anodyne	MTNR1A	58	37
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1O	ZINC000450638879	ED	On-Demand	Anodyne	MTNR1B	44	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638881	GH	On-Demand	Mild	DRD4	26	59
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638881	GH	On-Demand	Mild	DRD3	0	59
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638881	GH	On-Demand	Mild	SIGMAR1	17	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638883	GH	On-Demand	Mild	DRD4	26	59
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638883	GH	On-Demand	Mild	DRD3	0	59
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638883	GH	On-Demand	Mild	SIGMAR1	17	40
CCOC(=O)c1cnn(C2CCN(c3ncccc3Br)CC2)c1	ZINC000450638884	GG	On-Demand	Anodyne	MAP3K7	42	31
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638885	GH	On-Demand	Mild	DRD4	26	59
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638885	GH	On-Demand	Mild	DRD3	0	59
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638885	GH	On-Demand	Mild	SIGMAR1	17	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638887	GH	On-Demand	Mild	DRD4	26	59
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638887	GH	On-Demand	Mild	DRD3	0	59
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450638887	GH	On-Demand	Mild	SIGMAR1	17	40
CC(C)(C[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638890	EG	On-Demand	Anodyne	PDE3A	46	36
CC(C)(C[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638890	EG	On-Demand	Anodyne	PDGFRB	35	40
CC(C)(C[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638890	EG	On-Demand	Anodyne	PDE3B	67	35
CC(C)(C[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638890	EG	On-Demand	Anodyne	SIRT3	67	36
CC(C)(C[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638890	EG	On-Demand	Anodyne	SIRT2	62	36
CC(C)(C[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638890	EG	On-Demand	Anodyne	SIRT1	54	36
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638891	EG	On-Demand	Anodyne	PDE3A	46	36
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638891	EG	On-Demand	Anodyne	PDGFRB	35	40
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638891	EG	On-Demand	Anodyne	PDE3B	67	35
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638891	EG	On-Demand	Anodyne	SIRT3	67	36
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638891	EG	On-Demand	Anodyne	SIRT2	62	36
CC(C)(C[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1)C(N)=O	ZINC000450638891	EG	On-Demand	Anodyne	SIRT1	54	36
COc1cc(Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1Cl	ZINC000450638892	ED	On-Demand	Anodyne	MAOB	0	45
COc1cc(Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1Cl	ZINC000450638892	ED	On-Demand	Anodyne	ADORA2A	0	51
CCOC(=O)c1cnn(C2CCN(c3cc(C(F)(F)F)ccn3)CC2)c1	ZINC000450638893	FG	On-Demand	Anodyne	P2RY12	47	38
CCOC(=O)c1cnn(C2CCN(c3cc(C(F)(F)F)ccn3)CC2)c1	ZINC000450638893	FG	On-Demand	Anodyne	CCR2	30	41
CCOC(=O)c1cnn(C2CCN(c3cc(C(F)(F)F)ccn3)CC2)c1	ZINC000450638893	FG	On-Demand	Anodyne	LIPG	52	36
Cc1cnc(CCCC(=O)N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)o1	ZINC000450638895	FJ	On-Demand	Anodyne	GRIN2B	16	40
CC1(O)CC(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)C1	ZINC000450638899	ED	On-Demand	Anodyne	CDK4	22	41
CC1(O)CC(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)C1	ZINC000450638899	ED	On-Demand	Anodyne	CALCA	0	41
CC[C@@H]1CCC[C@H]1C(=O)NCCCC(=O)OC(C)C	ZINC000450638901	CF	On-Demand	Anodyne	EPHX2	0	42
CC[C@@H]1CCC[C@@H]1C(=O)NCCCC(=O)OC(C)C	ZINC000450638902	CF	On-Demand	Anodyne	EPHX2	0	42
CC[C@H]1CCC[C@H]1C(=O)NCCCC(=O)OC(C)C	ZINC000450638903	CF	On-Demand	Anodyne	EPHX2	0	42
CC[C@H]1CCC[C@@H]1C(=O)NCCCC(=O)OC(C)C	ZINC000450638904	CF	On-Demand	Anodyne	EPHX2	0	42
O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450638909	FH	On-Demand	Anodyne	RBP4	68	37
O=C(N[C@H]1CCO[C@H](C2CC2)C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450638910	FH	On-Demand	Anodyne	RBP4	68	37
O=C(N[C@H]1CCO[C@@H](C2CC2)C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450638911	FH	On-Demand	Anodyne	RBP4	68	37
CSc1cccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450638912	GF	On-Demand	Anodyne	CHRM3	15	41
CSc1cccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450638912	GF	On-Demand	Anodyne	CDK1	20	44
CSc1cccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450638912	GF	On-Demand	Anodyne	CDK4	22	44
Cc1cccc(Cl)c1C(=O)Nc1ccnc(C(=O)N2CCN(C)CC2)c1	ZINC000450638913	FF	On-Demand	Anodyne	ABL1	22	41
Cc1cccc(Cl)c1C(=O)Nc1ccnc(C(=O)N2CCN(C)CC2)c1	ZINC000450638913	FF	On-Demand	Anodyne	HRH4	24	40
Cc1cccc(Cl)c1C(=O)Nc1ccnc(C(=O)N2CCN(C)CC2)c1	ZINC000450638913	FF	On-Demand	Anodyne	JAK1	24	49
Cc1cccc(Cl)c1C(=O)Nc1ccnc(C(=O)N2CCN(C)CC2)c1	ZINC000450638913	FF	On-Demand	Anodyne	GRM4	55	40
Cc1cccc(Cl)c1C(=O)Nc1ccnc(C(=O)N2CCN(C)CC2)c1	ZINC000450638913	FF	On-Demand	Anodyne	TYK2	84	47
COc1ccc2c(c1OC)CCN(CCN(C)Cc1ccccc1)C2	ZINC000450638914	EG	On-Demand	Anodyne	AGTR2	55	41
COc1ccc2c(c1OC)CCN(CCN(C)Cc1ccccc1)C2	ZINC000450638914	EG	On-Demand	Anodyne	SIGMAR1	25	50
COc1ccc2c(c1OC)CCN(CCN(C)Cc1ccccc1)C2	ZINC000450638914	EG	On-Demand	Anodyne	ABCB1B	64	39
Cc1cnc(CCCC(=O)N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)o1	ZINC000450638915	FJ	On-Demand	Anodyne	GRIN2B	16	40
COc1cccc(Oc2ccc(C(=O)NCCCC(=O)OC(C)C)nc2)c1	ZINC000450638924	FG	On-Demand	Anodyne	DRD4	43	32
COc1cccc(Oc2ccc(C(=O)NCCCC(=O)OC(C)C)nc2)c1	ZINC000450638924	FG	On-Demand	Anodyne	MTNR1A	35	41
COc1cccc(Oc2ccc(C(=O)NCCCC(=O)OC(C)C)nc2)c1	ZINC000450638924	FG	On-Demand	Anodyne	MTNR1B	37	41
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	HTR1A	15	61
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	DRD2	35	47
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	DRD1	23	52
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	DRD4	26	50
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	HTR2A	37	53
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	HTR2C	22	61
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	HRH1	15	49
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	ADRA1B	17	46
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	ERG2	22	47
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	HTR7	15	47
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	MC4R	50	40
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	HRH3	21	43
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	SIGMAR1	25	56
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	CCR3	32	40
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	PLD1	50	37
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	SLC18A3	15	48
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	HTR3B	0	52
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	CYP2J2	61	44
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	NET	0	47
CC(C)N1CCN(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450638925	GG	On-Demand	Anodyne	L3MBTL3	61	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C#N)n1C	ZINC000450638926	DE	On-Demand	Mild	DRD4	16	51
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C#N)n1C	ZINC000450638939	DE	On-Demand	Mild	DRD4	16	51
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C#N)n1C	ZINC000450638940	DE	On-Demand	Mild	DRD4	16	51
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C#N)n1C	ZINC000450638941	DE	On-Demand	Mild	DRD4	16	51
c1ccc(CC[C@@H]2CCCCN2Cc2cnns2)cc1	ZINC000450638942	CH	On-Demand	Anodyne	SLC18A2	51	44
c1ccc(CC[C@H]2CCCCN2Cc2cnns2)cc1	ZINC000450638943	CH	On-Demand	Anodyne	SLC18A2	51	44
CCC[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450638949	DE	On-Demand	Anodyne	SSTR2	56	35
CCC[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450638949	DE	On-Demand	Anodyne	CAPN2	44	36
CCC[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450638950	DE	On-Demand	Anodyne	SSTR2	56	35
CCC[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450638950	DE	On-Demand	Anodyne	CAPN2	44	36
CCC[C@@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450638951	DE	On-Demand	Anodyne	SSTR2	56	35
CCC[C@@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450638951	DE	On-Demand	Anodyne	CAPN2	44	36
CCC[C@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450638952	DE	On-Demand	Anodyne	SSTR2	56	35
CCC[C@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450638952	DE	On-Demand	Anodyne	CAPN2	44	36
CC(C)c1ccc(C[C@@H]2CCN(C(=O)c3cnc(C4CC4)nc3)C2)cc1	ZINC000450638953	EI	On-Demand	Anodyne	GRIN2B	38	42
CC(C)c1ccc(C[C@@H]2CCN(C(=O)c3cnc(C4CC4)nc3)C2)cc1	ZINC000450638953	EI	On-Demand	Anodyne	CCR3	18	41
CC(C)c1ccc(C[C@H]2CCN(C(=O)c3cnc(C4CC4)nc3)C2)cc1	ZINC000450638957	EI	On-Demand	Anodyne	GRIN2B	38	42
CC(C)c1ccc(C[C@H]2CCN(C(=O)c3cnc(C4CC4)nc3)C2)cc1	ZINC000450638957	EI	On-Demand	Anodyne	CCR3	18	41
CCCC[C@H](NC(=O)c1cc(C#N)[nH]c1C)C(=O)OC(C)(C)C	ZINC000450638959	DF	On-Demand	Mild	CTSK	0	40
CCCC[C@H](NC(=O)c1cc(C#N)[nH]c1C)C(=O)OC(C)(C)C	ZINC000450638959	DF	On-Demand	Mild	CTRB_BOVIN	46	33
Cc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ncc1C(N)=O	ZINC000450638960	GC	On-Demand	Anodyne	CDK1	19	41
Cc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ncc1C(N)=O	ZINC000450638960	GC	On-Demand	Anodyne	CDK4	0	41
Cc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)ncc1C(N)=O	ZINC000450638960	GC	On-Demand	Anodyne	CALCA	0	41
CCCC[C@@H](NC(=O)c1cc(C#N)[nH]c1C)C(=O)OC(C)(C)C	ZINC000450638961	DF	On-Demand	Mild	CTSK	0	40
CCCC[C@@H](NC(=O)c1cc(C#N)[nH]c1C)C(=O)OC(C)(C)C	ZINC000450638961	DF	On-Demand	Mild	CTRB_BOVIN	46	33
C[C@@H]1CCCN(c2cc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncn2)C1	ZINC000450638967	FF	On-Demand	Anodyne	SIRT3	43	31
C[C@H]1CCCN(c2cc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncn2)C1	ZINC000450638970	FF	On-Demand	Anodyne	SIRT3	43	31
O=C(Cc1ccc(O)c(F)c1)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638971	GD	On-Demand	Anodyne	CDK2	15	51
O=C(Cc1ccc(O)c(F)c1)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638971	GD	On-Demand	Anodyne	CDK1	27	51
O=C(Cc1ccc(O)c(F)c1)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638971	GD	On-Demand	Anodyne	CDK4	27	51
O=C(Cc1ccc(O)c(F)c1)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638971	GD	On-Demand	Anodyne	CALCA	0	46
O=C(Cc1ccc(O)c(F)c1)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450638971	GD	On-Demand	Anodyne	CAN2	0	41
C[C@@H]1CCCN(c2cc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncn2)C1	ZINC000450638973	FF	On-Demand	Anodyne	SIRT3	43	31
C[C@H]1CCCN(c2cc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncn2)C1	ZINC000450638975	FF	On-Demand	Anodyne	SIRT3	43	31
COc1cccc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)nccc12	ZINC000450638976	EG	On-Demand	Anodyne	PDE3B	56	32
COc1cccc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)nccc12	ZINC000450638977	EG	On-Demand	Anodyne	PDE3B	56	32
CCCC[C@@H](NC(=O)Cn1cc(C(C)=O)nn1)C(=O)OC(C)(C)C	ZINC000450638983	ED	On-Demand	Anodyne	SSTR2	40	31
CCCC[C@@H](NC(=O)Cn1cc(C(C)=O)nn1)C(=O)OC(C)(C)C	ZINC000450638983	ED	On-Demand	Anodyne	CTSK	30	43
CCCC[C@H](NC(=O)Cn1cc(C(C)=O)nn1)C(=O)OC(C)(C)C	ZINC000450638984	ED	On-Demand	Anodyne	SSTR2	40	31
CCCC[C@H](NC(=O)Cn1cc(C(C)=O)nn1)C(=O)OC(C)(C)C	ZINC000450638984	ED	On-Demand	Anodyne	CTSK	30	43
CC(C)c1ccc(C[C@@H]2CCN(C(=O)Cc3cc4ccccc4c(O)n3)C2)cc1	ZINC000450638993	GJ	On-Demand	Anodyne	CHRM2	15	41
CC(C)c1ccc(C[C@@H]2CCN(C(=O)Cc3cc4ccccc4c(O)n3)C2)cc1	ZINC000450638993	GJ	On-Demand	Anodyne	GRIN2B	47	38
CCc1cccc(C(=O)N[C@@H](C(=O)OC)[C@H](C)O)n1	ZINC000450639006	CC	On-Demand	Anodyne	PDE5A	29	63
CCc1cccc(C(=O)N[C@H](C(=O)OC)[C@@H](C)O)n1	ZINC000450639007	CC	On-Demand	Anodyne	PDE5A	29	63
CCc1cccc(C(=O)N[C@H](C(=O)OC)[C@H](C)O)n1	ZINC000450639008	CC	On-Demand	Anodyne	PDE5A	29	63
CCc1cccc(C(=O)N[C@@H](C(=O)OC)[C@@H](C)O)n1	ZINC000450639009	CC	On-Demand	Anodyne	PDE5A	29	63
COc1ccc([C@@H](CO)N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1	ZINC000450639016	GI	On-Demand	Anodyne	RBP4	43	36
COC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H](C)O	ZINC000450639019	DC	On-Demand	Anodyne	P2RY12	58	31
COC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H](C)O	ZINC000450639019	DC	On-Demand	Anodyne	CTSV	47	33
COC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H](C)O	ZINC000450639020	DC	On-Demand	Anodyne	P2RY12	58	31
COC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H](C)O	ZINC000450639020	DC	On-Demand	Anodyne	CTSV	47	33
COC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H](C)O	ZINC000450639021	DC	On-Demand	Anodyne	P2RY12	58	31
COC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H](C)O	ZINC000450639021	DC	On-Demand	Anodyne	CTSV	47	33
COC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H](C)O	ZINC000450639022	DC	On-Demand	Anodyne	P2RY12	58	31
COC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H](C)O	ZINC000450639022	DC	On-Demand	Anodyne	CTSV	47	33
COC(=O)Cn1cc(CN2CCCN(c3ccc(Cl)c(Cl)c3)CC2)nn1	ZINC000450639026	GE	On-Demand	Anodyne	DRD4	43	35
CCC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@@H](C)O	ZINC000450639038	CD	On-Demand	Anodyne	PGA	46	30
CCC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@@H](C)O	ZINC000450639038	CD	On-Demand	Anodyne	NPR	23	47
CCC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@H](C)O	ZINC000450639039	CD	On-Demand	Anodyne	PGA	46	30
CCC[C@H](CC(C)C)C(=O)N[C@@H](C(=O)OC)[C@H](C)O	ZINC000450639039	CD	On-Demand	Anodyne	NPR	23	47
CCC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@H](C)O	ZINC000450639040	CD	On-Demand	Anodyne	PGA	46	30
CCC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@H](C)O	ZINC000450639040	CD	On-Demand	Anodyne	NPR	23	47
CCC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@@H](C)O	ZINC000450639041	CD	On-Demand	Anodyne	PGA	46	30
CCC[C@H](CC(C)C)C(=O)N[C@H](C(=O)OC)[C@@H](C)O	ZINC000450639041	CD	On-Demand	Anodyne	NPR	23	47
COC(=O)[C@@H](NC(=O)c1cc2c(Br)c(F)ccc2[nH]1)[C@@H](C)O	ZINC000450639049	FD	On-Demand	Anodyne	PYGL	26	42
COC(=O)[C@H](NC(=O)c1cc2c(Br)c(F)ccc2[nH]1)[C@H](C)O	ZINC000450639050	FD	On-Demand	Anodyne	PYGL	26	42
COC(=O)[C@@H](NC(=O)c1cc2c(Br)c(F)ccc2[nH]1)[C@H](C)O	ZINC000450639051	FD	On-Demand	Anodyne	PYGL	26	42
COC(=O)[C@H](NC(=O)c1cc2c(Br)c(F)ccc2[nH]1)[C@@H](C)O	ZINC000450639052	FD	On-Demand	Anodyne	PYGL	26	42
CN(CCN1CCN2C(=O)CC[C@H]2C1)Cc1ccccc1	ZINC000450639060	CD	On-Demand	Anodyne	DRD5	15	41
CN(CCN1CCN2C(=O)CC[C@H]2C1)Cc1ccccc1	ZINC000450639060	CD	On-Demand	Anodyne	SIGMAR1	37	46
CN(CCN1CCN2C(=O)CC[C@H]2C1)Cc1ccccc1	ZINC000450639060	CD	On-Demand	Anodyne	MCHR1	17	45
CN(CCN1CCN2C(=O)CC[C@@H]2C1)Cc1ccccc1	ZINC000450639061	CD	On-Demand	Anodyne	DRD5	15	41
CN(CCN1CCN2C(=O)CC[C@@H]2C1)Cc1ccccc1	ZINC000450639061	CD	On-Demand	Anodyne	SIGMAR1	37	46
CN(CCN1CCN2C(=O)CC[C@@H]2C1)Cc1ccccc1	ZINC000450639061	CD	On-Demand	Anodyne	MCHR1	17	45
CC(=O)N1CCN(CCCC(=O)c2ccccc2)CC12CCCCC2	ZINC000450639063	EH	On-Demand	Anodyne	DRD2	29	41
CC(=O)N1CCN(CCCC(=O)c2ccccc2)CC12CCCCC2	ZINC000450639063	EH	On-Demand	Anodyne	HTR2A	15	45
CC(=O)N1CCN(CCCC(=O)c2ccccc2)CC12CCCCC2	ZINC000450639063	EH	On-Demand	Anodyne	SIGMAR1	15	44
CC(=O)N1CCN(CCCC(=O)c2ccccc2)CC12CCCCC2	ZINC000450639063	EH	On-Demand	Anodyne	SLC18A3	0	44
CC(=O)N1CCN(CCCC(=O)c2ccccc2)CC12CCCCC2	ZINC000450639063	EH	On-Demand	Anodyne	CYP2J2	56	40
CC(=O)N1CCN(CCCC(=O)c2ccccc2)CC12CCCCC2	ZINC000450639063	EH	On-Demand	Anodyne	SLC12A5	64	38
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	ACHE	42	44
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	AVPR1B	40	32
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	HTR4	66	38
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	SIGMAR1	36	42
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	SSTR5	51	35
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	CCR3	43	41
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	UTS2R	18	47
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	MCHR1	44	43
COC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1Cl	ZINC000450639064	FH	On-Demand	Anodyne	CACNA1I	55	38
C[C@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450639065	GF	On-Demand	Anodyne	OPRK1	28	43
C[C@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450639065	GF	On-Demand	Anodyne	SIGMAR1	30	64
C[C@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450639065	GF	On-Demand	Anodyne	KCNJ1	44	40
C[C@@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450639066	GF	On-Demand	Anodyne	OPRK1	28	43
C[C@@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450639066	GF	On-Demand	Anodyne	SIGMAR1	30	64
C[C@@H](CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)S(C)(=O)=O	ZINC000450639066	GF	On-Demand	Anodyne	KCNJ1	44	40
CC(F)(F)C(C)(C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450639071	EG	On-Demand	Anodyne	SMO	43	35
CC(F)(F)C(C)(C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450639071	EG	On-Demand	Anodyne	ETHR	72	57
CCOC(=O)c1sc(Sc2nc(C)cc(C(F)(F)F)n2)nc1C	ZINC000450639073	FH	On-Demand	Anodyne	DHODH	24	40
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450639074	GH	On-Demand	Anodyne	PDE8B	47	31
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450639074	GH	On-Demand	Anodyne	TMPRSS11D	60	33
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450639075	GH	On-Demand	Anodyne	PDE8B	47	31
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450639075	GH	On-Demand	Anodyne	TMPRSS11D	60	33
C/C=C\COc1cccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450639078	GH	On-Demand	Anodyne	COLA	49	41
C/C=C\COc1cccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450639078	GH	On-Demand	Anodyne	CPT1A	47	41
C/C=C\COc1cccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450639078	GH	On-Demand	Anodyne	SMO	48	37
C/C=C\COc1cccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450639078	GH	On-Demand	Anodyne	ETHR	78	46
C/C=C/COc1cccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450639079	GH	On-Demand	Anodyne	COLA	49	41
C/C=C/COc1cccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450639079	GH	On-Demand	Anodyne	CPT1A	47	41
C/C=C/COc1cccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450639079	GH	On-Demand	Anodyne	SMO	48	37
C/C=C/COc1cccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450639079	GH	On-Demand	Anodyne	ETHR	78	46
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	ACE	53	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	OPRM1	34	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	OPRD1	26	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	GHRHR	47	30
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	P2RY12	85	36
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	MME	49	39
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	TRHR	39	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	MC4R	73	38
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	CTRA_BOVIN	43	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	TRY2_BOVIN	87	39
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	TRY1_BOVIN	51	35
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	NPFFR2	43	34
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	TIMP3	41	32
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	ITGA4	43	37
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	MC3R	46	37
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	MC5R	61	35
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	CELA2A	43	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	REN	46	39
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	CTSS	23	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	CAPN1	45	43
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	MC1R	33	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	PGA5	48	35
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	ST14	68	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	MARS	41	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	POL	0	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	XIAP	34	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	BRCA1	59	32
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639081	FF	On-Demand	Anodyne	DERP1	0	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	ACE	53	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	OPRM1	34	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	OPRD1	26	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	GHRHR	47	30
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	P2RY12	85	36
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	MME	49	39
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	TRHR	39	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	MC4R	73	38
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	CTRA_BOVIN	43	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	TRY2_BOVIN	87	39
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	TRY1_BOVIN	51	35
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	NPFFR2	43	34
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	TIMP3	41	32
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	ITGA4	43	37
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	MC3R	46	37
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	MC5R	61	35
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	CELA2A	43	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	REN	46	39
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	CTSS	23	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	CAPN1	45	43
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	MC1R	33	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	PGA5	48	35
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	ST14	68	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	MARS	41	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	POL	0	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	XIAP	34	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	BRCA1	59	32
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639082	FF	On-Demand	Anodyne	DERP1	0	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	ACE	53	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	OPRM1	34	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	OPRD1	26	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	GHRHR	47	30
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	P2RY12	85	36
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	MME	49	39
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	TRHR	39	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	MC4R	73	38
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	CTRA_BOVIN	43	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	TRY2_BOVIN	87	39
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	TRY1_BOVIN	51	35
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	NPFFR2	43	34
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	TIMP3	41	32
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	ITGA4	43	37
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	MC3R	46	37
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	MC5R	61	35
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	CELA2A	43	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	REN	46	39
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	CTSS	23	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	CAPN1	45	43
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	MC1R	33	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	PGA5	48	35
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	ST14	68	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	MARS	41	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	POL	0	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	XIAP	34	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	BRCA1	59	32
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639083	FF	On-Demand	Anodyne	DERP1	0	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	ACE	53	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	OPRM1	34	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	OPRD1	26	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	GHRHR	47	30
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	P2RY12	85	36
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	MME	49	39
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	TRHR	39	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	MC4R	73	38
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	CTRA_BOVIN	43	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	TRY2_BOVIN	87	39
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	TRY1_BOVIN	51	35
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	NPFFR2	43	34
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	TIMP3	41	32
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	ITGA4	43	37
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	MC3R	46	37
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	MC5R	61	35
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	CELA2A	43	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	REN	46	39
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	CTSS	23	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	CAPN1	45	43
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	MC1R	33	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	PGA5	48	35
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	ST14	68	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	MARS	41	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	POL	0	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	XIAP	34	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	BRCA1	59	32
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639084	FF	On-Demand	Anodyne	DERP1	0	41
C=CCn1c(SCC2(OC)CCC2)nc2ccccc2c1=O	ZINC000450639104	DG	On-Demand	Mild	SKA	0	42
O=C(Nc1ccccc1)c1ccc(N2CCOC[C@H](O)C2)nn1	ZINC000450639121	DC	On-Demand	Anodyne	SCD1	42	48
O=C(Nc1ccccc1)c1ccc(N2CCOC[C@H](O)C2)nn1	ZINC000450639121	DC	On-Demand	Anodyne	DGAT1	30	45
O=C(Nc1ccccc1)c1ccc(N2CCOC[C@@H](O)C2)nn1	ZINC000450639122	DC	On-Demand	Anodyne	SCD1	42	48
O=C(Nc1ccccc1)c1ccc(N2CCOC[C@@H](O)C2)nn1	ZINC000450639122	DC	On-Demand	Anodyne	DGAT1	30	45
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)c1	ZINC000450639127	GH	On-Demand	Anodyne	TAAR1	26	42
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)c1	ZINC000450639127	GH	On-Demand	Anodyne	NAMPT	22	44
Cc1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc(C)c1CC(C)C	ZINC000450639166	FG	On-Demand	Anodyne	CHRNA4	30	48
C=CCn1c(SCCC(C)(F)F)nc2ccccc2c1=O	ZINC000450639172	DH	On-Demand	Mild	SKA	0	41
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nccc(CO)n2)CC1	ZINC000450639177	FE	On-Demand	Anodyne	SORD	52	32
CC(C)OC(=O)CCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450639180	CD	On-Demand	Anodyne	CAN2	0	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639188	FH	On-Demand	Anodyne	DRD4	15	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639188	FH	On-Demand	Anodyne	DRD3	0	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639188	FH	On-Demand	Anodyne	TACR2	44	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639188	FH	On-Demand	Anodyne	NAMPT	15	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639189	FH	On-Demand	Anodyne	DRD4	15	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639189	FH	On-Demand	Anodyne	DRD3	0	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639189	FH	On-Demand	Anodyne	TACR2	44	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639189	FH	On-Demand	Anodyne	NAMPT	15	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639190	FH	On-Demand	Anodyne	DRD4	15	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639190	FH	On-Demand	Anodyne	DRD3	0	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639190	FH	On-Demand	Anodyne	TACR2	44	41
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639190	FH	On-Demand	Anodyne	NAMPT	15	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639191	FH	On-Demand	Anodyne	DRD4	15	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639191	FH	On-Demand	Anodyne	DRD3	0	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639191	FH	On-Demand	Anodyne	TACR2	44	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cc2ccncc2s1	ZINC000450639191	FH	On-Demand	Anodyne	NAMPT	15	49
CC(C)[C@@H]1CCN1C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450639198	EH	On-Demand	Anodyne	HCRTR1	52	37
CC(C)[C@@H]1CCN1C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450639198	EH	On-Demand	Anodyne	HCRTR2	55	37
CC(C)[C@H]1CCN1C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450639200	EH	On-Demand	Anodyne	HCRTR1	52	37
CC(C)[C@H]1CCN1C(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450639200	EH	On-Demand	Anodyne	HCRTR2	55	37
CC(C)OC(=O)CCCNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450639232	EE	On-Demand	Anodyne	PDE4D	15	40
CC(C)OC(=O)CCCNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450639233	EE	On-Demand	Anodyne	PDE4D	15	40
Cc1cncc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450639234	CD	On-Demand	Anodyne	CHRNA4	40	54
Cc1c(C(=O)N2CCC(Cc3ccc(C(C)C)cc3)CC2)nn2c1OCCC2	ZINC000450639253	GI	On-Demand	Anodyne	CHRM2	16	41
COc1ccccc1-n1c(SCC[C@@H](C)O)nc2ccccc2c1=O	ZINC000450639254	FG	On-Demand	Anodyne	HTR7	21	47
COc1ccccc1-n1c(SCC[C@H](C)O)nc2ccccc2c1=O	ZINC000450639255	FG	On-Demand	Anodyne	HTR7	21	47
CCCOc1ccc(C(=O)N2CC[C@H]2C(C)C)c(OC)c1	ZINC000450639256	CG	On-Demand	Anodyne	PLA2G4B	44	37
CCCOc1ccc(C(=O)N2CC[C@@H]2C(C)C)c(OC)c1	ZINC000450639257	CG	On-Demand	Anodyne	PLA2G4B	44	37
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccsc1Br	ZINC000450639262	GH	On-Demand	Anodyne	DRD4	27	63
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccsc1Br	ZINC000450639262	GH	On-Demand	Anodyne	DRD3	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccsc1Br	ZINC000450639262	GH	On-Demand	Anodyne	SIGMAR1	26	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccsc1Br	ZINC000450639263	GH	On-Demand	Anodyne	DRD4	27	63
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccsc1Br	ZINC000450639263	GH	On-Demand	Anodyne	DRD3	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccsc1Br	ZINC000450639263	GH	On-Demand	Anodyne	SIGMAR1	26	43
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccsc1Br	ZINC000450639264	GH	On-Demand	Anodyne	DRD4	27	63
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccsc1Br	ZINC000450639264	GH	On-Demand	Anodyne	DRD3	15	41
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccsc1Br	ZINC000450639264	GH	On-Demand	Anodyne	SIGMAR1	26	43
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccsc1Br	ZINC000450639265	GH	On-Demand	Anodyne	DRD4	27	63
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccsc1Br	ZINC000450639265	GH	On-Demand	Anodyne	DRD3	15	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccsc1Br	ZINC000450639265	GH	On-Demand	Anodyne	SIGMAR1	26	43
CCn1nnc(C)c1CSc1nnc(-c2cc(OC)c(OC)c(OC)c2)o1	ZINC000450639267	GF	On-Demand	Anodyne	TYMS	23	51
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450639273	GI	On-Demand	Anodyne	CHRNA4	26	41
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccncc2C)CC1	ZINC000450639274	FG	On-Demand	Anodyne	SLC12A5	48	32
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639277	EG	On-Demand	Anodyne	DRD4	24	52
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639277	EG	On-Demand	Anodyne	DRD3	0	52
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639277	EG	On-Demand	Anodyne	ADAM17	29	47
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639277	EG	On-Demand	Anodyne	AKT1	0	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639279	EG	On-Demand	Anodyne	DRD4	24	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639279	EG	On-Demand	Anodyne	DRD3	0	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639279	EG	On-Demand	Anodyne	ADAM17	29	47
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639279	EG	On-Demand	Anodyne	AKT1	0	52
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639280	EG	On-Demand	Anodyne	DRD4	24	52
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639280	EG	On-Demand	Anodyne	DRD3	0	52
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639280	EG	On-Demand	Anodyne	ADAM17	29	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639280	EG	On-Demand	Anodyne	AKT1	0	52
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639281	EG	On-Demand	Anodyne	DRD4	24	52
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639281	EG	On-Demand	Anodyne	DRD3	0	52
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639281	EG	On-Demand	Anodyne	ADAM17	29	47
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc2cnccc2c1	ZINC000450639281	EG	On-Demand	Anodyne	AKT1	0	52
CCCCc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450639282	GH	On-Demand	Anodyne	MAP	0	40
CCCCc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450639282	GH	On-Demand	Anodyne	MAP1	69	40
CCCCc1ccc(-n2nnnc2S[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450639291	GH	On-Demand	Anodyne	MAP	0	40
CCCCc1ccc(-n2nnnc2S[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450639291	GH	On-Demand	Anodyne	MAP1	69	40
Cc1c(NC(=O)c2ccc(N3CCC3)nc2)cccc1N(C)C	ZINC000450639292	DF	On-Demand	Anodyne	HDAC1	27	44
Cc1c(NC(=O)c2ccc(N3CCC3)nc2)cccc1N(C)C	ZINC000450639292	DF	On-Demand	Anodyne	MAPKAPK3	0	41
COc1cc(CN2C[C@H](O)C[C@@H]2CO)ccc1Cl	ZINC000450639298	CD	On-Demand	Anodyne	SPHK2	34	41
COc1cc(CN2C[C@@H](O)C[C@@H]2CO)ccc1Cl	ZINC000450639299	CD	On-Demand	Anodyne	SPHK2	34	41
COc1cc(CN2C[C@@H](O)C[C@H]2CO)ccc1Cl	ZINC000450639300	CD	On-Demand	Anodyne	SPHK2	34	41
COc1cc(CN2C[C@H](O)C[C@H]2CO)ccc1Cl	ZINC000450639301	CD	On-Demand	Anodyne	SPHK2	34	41
COc1cc(NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)ccc1OC(C)C	ZINC000450639304	DH	On-Demand	Anodyne	ENPP1	78	37
COc1cc(NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)ccc1OC(C)C	ZINC000450639305	DH	On-Demand	Anodyne	ENPP1	78	37
COc1cc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)ccc1OC(C)C	ZINC000450639306	DH	On-Demand	Anodyne	ENPP1	78	37
COc1cc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)ccc1OC(C)C	ZINC000450639307	DH	On-Demand	Anodyne	ENPP1	78	37
C[C@H](O)CCCN(Cc1cccnc1)Cc1ccco1	ZINC000450639308	CF	On-Demand	Anodyne	NR1D1	42	33
C[C@@H](O)CCCN(Cc1cccnc1)Cc1ccco1	ZINC000450639309	CF	On-Demand	Anodyne	NR1D1	42	33
COc1cc(NC(=O)CCCn2nc(C)nc2C)ccc1OC(C)C	ZINC000450639311	EG	On-Demand	Anodyne	ENPP1	69	40
CC(=O)c1cccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639323	FH	On-Demand	Anodyne	DRD4	15	43
CC(=O)c1cccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639323	FH	On-Demand	Anodyne	SIGMAR1	15	42
CC(=O)c1cccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639323	FH	On-Demand	Anodyne	LIPE	20	41
CC(=O)c1cccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639323	FH	On-Demand	Anodyne	CCR2	48	43
CC(=O)c1cccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639323	FH	On-Demand	Anodyne	MCHR1	32	40
CC(=O)c1cccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639323	FH	On-Demand	Anodyne	LIPG	54	52
CC(=O)c1cccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639324	FH	On-Demand	Anodyne	DRD4	15	43
CC(=O)c1cccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639324	FH	On-Demand	Anodyne	SIGMAR1	15	42
CC(=O)c1cccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639324	FH	On-Demand	Anodyne	LIPE	20	41
CC(=O)c1cccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639324	FH	On-Demand	Anodyne	CCR2	48	43
CC(=O)c1cccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639324	FH	On-Demand	Anodyne	MCHR1	32	40
CC(=O)c1cccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c1	ZINC000450639324	FH	On-Demand	Anodyne	LIPG	54	52
Cc1nn(C)cc1CN(Cc1cccnc1)Cc1ccco1	ZINC000450639331	CF	On-Demand	Anodyne	NR1D1	45	38
CCc1nc2ccccc2n1C1CCN(Cc2cnns2)CC1	ZINC000450639332	EG	On-Demand	Anodyne	GRM2	0	42
CCc1nc2ccccc2n1C1CCN(Cc2cnns2)CC1	ZINC000450639332	EG	On-Demand	Anodyne	FPR2	30	43
COc1cc(NC(=O)Cc2ccc(OC(F)F)c(F)c2)ccc1OC(C)C	ZINC000450639333	GI	On-Demand	Anodyne	ENPP1	78	37
COc1cc(NC(=O)C2(CF)CCOCC2)ccc1OC(C)C	ZINC000450639336	EG	On-Demand	Anodyne	ENPP1	53	32
O=C(CCCC(=O)C1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450639337	FI	On-Demand	Anodyne	ADAM17	34	42
O=C(CCCC(=O)C1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450639337	FI	On-Demand	Anodyne	CDC25B	23	41
O=C(CCCC(=O)C1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450639337	FI	On-Demand	Anodyne	GYS1	47	33
CC(C)c1ccc(C[C@H]2CCN(C(=O)Cc3cc4ccccc4c(O)n3)C2)cc1	ZINC000450639350	GJ	On-Demand	Anodyne	CHRM2	15	41
CC(C)c1ccc(C[C@H]2CCN(C(=O)Cc3cc4ccccc4c(O)n3)C2)cc1	ZINC000450639350	GJ	On-Demand	Anodyne	GRIN2B	47	38
O=C1NCCN(C[C@H](O)Cc2ccccc2)[C@H]1c1cccc(Br)c1	ZINC000450639354	GF	On-Demand	Anodyne	VACHT_TETCF	0	51
O=C1NCCN(C[C@H](O)Cc2ccccc2)[C@@H]1c1cccc(Br)c1	ZINC000450639355	GF	On-Demand	Anodyne	VACHT_TETCF	0	51
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	P2RY12	40	37
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	MC4R	59	38
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	CTSB	32	44
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	TRY2_BOVIN	61	38
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	CCKAR	51	39
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	CTSL	27	41
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	CYP51A1	22	44
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	CCKBR	47	38
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	ACE2	44	35
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	CTSV	44	38
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	CTRB_BOVIN	46	33
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	BLA1_STEMA	40	31
Cc1[nH]c(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639358	FD	On-Demand	Mild	DERP1	0	44
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	P2RY12	40	37
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	MC4R	59	38
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	CTSB	32	44
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	TRY2_BOVIN	61	38
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	CCKAR	51	39
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	CTSL	27	41
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	CYP51A1	22	44
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	CCKBR	47	38
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	ACE2	44	35
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	CTSV	44	38
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	CTRB_BOVIN	46	33
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	BLA1_STEMA	40	31
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450639359	FD	On-Demand	Mild	DERP1	0	44
Cc1c(C#N)c(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nc2ccccc12	ZINC000450639376	FH	On-Demand	Mild	DPP4	27	40
Cc1c(C#N)c(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nc2ccccc12	ZINC000450639376	FH	On-Demand	Mild	FAP	0	40
Cc1c(C#N)c(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nc2ccccc12	ZINC000450639377	FH	On-Demand	Mild	DPP4	27	40
Cc1c(C#N)c(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nc2ccccc12	ZINC000450639377	FH	On-Demand	Mild	FAP	0	40
CCOC(=O)c1cnn(C2CCN(c3nc4cc(Cl)ccn4c3C#N)CC2)c1	ZINC000450639378	GG	On-Demand	Mild	P2RY12	58	42
C=CCN(CCCC(=O)c1ccc(F)cc1)C1CC1	ZINC000450639400	CG	On-Demand	Mild	DRD4	0	43
C=CCN(CCCC(=O)c1ccc(F)cc1)C1CC1	ZINC000450639400	CG	On-Demand	Mild	LSS	26	40
COc1ccc(CNC(=O)CCN2CCOC3(CCC3)C2)c(OC)c1	ZINC000450639405	ED	On-Demand	Anodyne	MTNR1A	44	36
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1CC(F)(F)C1	ZINC000450639408	GK	On-Demand	Anodyne	LDLR	0	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1CC(F)(F)C1	ZINC000450639408	GK	On-Demand	Anodyne	CSF1R	17	42
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1CC(F)(F)C1	ZINC000450639408	GK	On-Demand	Anodyne	KCNK3	86	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1CC(F)(F)C1	ZINC000450639408	GK	On-Demand	Anodyne	KCNK9	45	47
Cc1csc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450639418	EG	On-Demand	Anodyne	SIRT3	62	42
Cc1csc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450639418	EG	On-Demand	Anodyne	SIRT2	55	36
Cc1csc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450639418	EG	On-Demand	Anodyne	SIRT1	43	36
Cc1csc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450639419	EG	On-Demand	Anodyne	SIRT3	62	42
Cc1csc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450639419	EG	On-Demand	Anodyne	SIRT2	55	36
Cc1csc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ncnc12	ZINC000450639419	EG	On-Demand	Anodyne	SIRT1	43	36
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc(-c4ccccn4)n3)CC2)c1	ZINC000450639424	GG	On-Demand	Anodyne	P2RY12	40	37
CCOC(=O)c1cnn(C2CCN(c3cc(C)nc(-c4ccccn4)n3)CC2)c1	ZINC000450639424	GG	On-Demand	Anodyne	METAP1	15	43
COc1cccc(OCCC(=O)N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000450639427	GG	On-Demand	Anodyne	MTNR1A	19	40
COc1cccc(OCCC(=O)N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000450639427	GG	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc(OCCC(=O)N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1	ZINC000450639434	GG	On-Demand	Anodyne	MTNR1A	19	40
COc1cccc(OCCC(=O)N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1	ZINC000450639434	GG	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1	ZINC000450639437	GG	On-Demand	Anodyne	MTNR1A	19	40
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1	ZINC000450639437	GG	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000450639441	GG	On-Demand	Anodyne	MTNR1A	19	40
COc1cccc(OCCC(=O)N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000450639441	GG	On-Demand	Anodyne	MTNR1B	22	40
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncncc2-c2ccccc2)C1	ZINC000450639446	EF	On-Demand	Anodyne	CHRNA4	38	50
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H]1C(C)C	ZINC000450639452	CF	On-Demand	Anodyne	RHODESAIN	0	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H]1C(C)C	ZINC000450639455	CF	On-Demand	Anodyne	RHODESAIN	0	43
FC(F)(F)c1cc(N2CC[C@@H]2C2CC2)nc(-c2cccnc2)n1	ZINC000450639457	DH	On-Demand	Anodyne	CYP11B2	45	39
CC(C)c1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)ncn1	ZINC000450639458	DE	On-Demand	Anodyne	CHRNA4	30	46
FC(F)(F)c1cc(N2CC[C@H]2C2CC2)nc(-c2cccnc2)n1	ZINC000450639460	DH	On-Demand	Anodyne	CYP11B2	45	39
Cc1ccc(NC(=O)N2CCN(CCc3cscn3)CC2)cc1	ZINC000450639468	EF	On-Demand	Anodyne	PDGFRB	44	37
CC1(C)OCC[C@H]1Nc1ncnc2ccc(I)cc12	ZINC000450639475	FG	On-Demand	Anodyne	CD38	109	45
CC1(C)OCC[C@@H]1Nc1ncnc2ccc(I)cc12	ZINC000450639477	FG	On-Demand	Anodyne	CD38	109	45
CCOC(=O)c1cnn(C2CCN(c3nc4ccccc4cc3CO)CC2)c1	ZINC000450639487	GF	On-Demand	Anodyne	P2RY12	54	37
CCC(=O)C1(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000450639489	FH	On-Demand	Anodyne	ADAM17	41	37
CCC(=O)C1(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000450639489	FH	On-Demand	Anodyne	CDC25B	23	40
CCC(=O)C1(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000450639489	FH	On-Demand	Anodyne	GYS1	60	33
COc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1OC	ZINC000450639491	EH	On-Demand	Anodyne	TYMS	0	40
COc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1OC	ZINC000450639491	EH	On-Demand	Anodyne	GSK3B	22	49
COc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1OC	ZINC000450639491	EH	On-Demand	Anodyne	GSK3A	47	42
COc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1OC	ZINC000450639491	EH	On-Demand	Anodyne	PIK3CG	0	54
CCCc1cc(Nc2cnn(CCC)c2C2CC2)n2ncnc2n1	ZINC000450639513	EG	On-Demand	Anodyne	DHOD	0	41
Cc1cccc(F)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450639515	FH	On-Demand	Anodyne	LCK	37	41
Cc1cccc(F)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450639515	FH	On-Demand	Anodyne	PDE4B	25	41
Cc1cccc(F)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450639515	FH	On-Demand	Anodyne	PDE4D	24	41
Cc1cccc(F)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450639515	FH	On-Demand	Anodyne	TNK2	16	41
Cc1cccc(F)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450639515	FH	On-Demand	Anodyne	SHH	43	36
COc1cccc(OCCC(=O)N2CC[C@H]2C(C)C)c1	ZINC000450639523	CF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)N2CC[C@H]2C(C)C)c1	ZINC000450639523	CF	On-Demand	Anodyne	COLA	48	34
COc1cccc(OCCC(=O)N2CC[C@H]2C(C)C)c1	ZINC000450639523	CF	On-Demand	Anodyne	CPT1A	44	34
COc1cccc(OCCC(=O)N2CC[C@H]2C(C)C)c1	ZINC000450639523	CF	On-Demand	Anodyne	MTNR1A	32	46
COc1cccc(OCCC(=O)N2CC[C@H]2C(C)C)c1	ZINC000450639523	CF	On-Demand	Anodyne	MTNR1B	49	44
COc1cccc(OCCC(=O)N2CC[C@@H]2C(C)C)c1	ZINC000450639525	CF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)N2CC[C@@H]2C(C)C)c1	ZINC000450639525	CF	On-Demand	Anodyne	COLA	48	34
COc1cccc(OCCC(=O)N2CC[C@@H]2C(C)C)c1	ZINC000450639525	CF	On-Demand	Anodyne	CPT1A	44	34
COc1cccc(OCCC(=O)N2CC[C@@H]2C(C)C)c1	ZINC000450639525	CF	On-Demand	Anodyne	MTNR1A	32	46
COc1cccc(OCCC(=O)N2CC[C@@H]2C(C)C)c1	ZINC000450639525	CF	On-Demand	Anodyne	MTNR1B	49	44
CCCn1c(SCc2nc(C(=O)OC)co2)nc2ccccc2c1=O	ZINC000450639556	FF	On-Demand	Anodyne	PTGDR2	15	41
COc1ccc(-c2ccnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)n2)cc1	ZINC000450639561	FG	On-Demand	Anodyne	DKK1	0	42
COc1ccc(-c2ccnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)n2)cc1	ZINC000450639564	FG	On-Demand	Anodyne	DKK1	0	42
CC(C)OC(=O)CCCNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450639565	CE	On-Demand	Anodyne	EPHX2	24	46
Cc1cc(OCc2ccccc2)nc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450639576	GG	On-Demand	Anodyne	GPBAR1	0	42
CC(C)OC(=O)CCCNC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450639577	CD	On-Demand	Mild	EPHX2	29	47
CC(C)OC(=O)CCCNC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450639578	CD	On-Demand	Mild	EPHX2	29	47
CC(C)OC(=O)CCCNC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450639579	CD	On-Demand	Mild	EPHX2	29	47
CC(C)OC(=O)CCCNC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450639580	CD	On-Demand	Mild	EPHX2	29	47
Cc1cc(OCc2ccccc2)nc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450639581	GG	On-Demand	Anodyne	GPBAR1	0	42
CCCC[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639584	FF	On-Demand	Anodyne	INHA	40	32
CCCC[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639584	FF	On-Demand	Anodyne	TRPV1	24	56
CCCC[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639584	FF	On-Demand	Anodyne	NCE103	28	40
CCCC[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639584	FF	On-Demand	Anodyne	NOD1	40	30
CCCC[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639584	FF	On-Demand	Anodyne	CAN2	0	40
COc1cc(CN2CCCN(CC(F)F)CC2)ccc1Cl	ZINC000450639587	DG	On-Demand	Anodyne	SIGMAR1	26	43
COc1cc(CN2CCCN(CC(F)F)CC2)ccc1Cl	ZINC000450639587	DG	On-Demand	Anodyne	SSTR5	47	36
COc1cc(CN2CCCN(CC(F)F)CC2)ccc1Cl	ZINC000450639587	DG	On-Demand	Anodyne	NOX5	41	35
CCCC[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639588	FF	On-Demand	Anodyne	INHA	40	32
CCCC[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639588	FF	On-Demand	Anodyne	TRPV1	24	56
CCCC[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639588	FF	On-Demand	Anodyne	NCE103	28	40
CCCC[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639588	FF	On-Demand	Anodyne	NOD1	40	30
CCCC[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OC(C)(C)C	ZINC000450639588	FF	On-Demand	Anodyne	CAN2	0	40
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450639591	FE	On-Demand	Anodyne	STAT6	45	33
O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450639591	FE	On-Demand	Anodyne	NAMPT	22	41
CCCC[C@@H](NC(=O)CC1(O)CCC1)C(=O)OC(C)(C)C	ZINC000450639605	CE	On-Demand	Anodyne	CTSK	37	42
CCCC[C@@H](NC(=O)CC1(O)CCC1)C(=O)OC(C)(C)C	ZINC000450639605	CE	On-Demand	Anodyne	NOD1	64	33
Cc1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2c(CC(C)C)csc2n1	ZINC000450639607	GH	On-Demand	Anodyne	CHRNA4	26	41
CCCC[C@H](NC(=O)CC1(O)CCC1)C(=O)OC(C)(C)C	ZINC000450639609	CE	On-Demand	Anodyne	CTSK	37	42
CCCC[C@H](NC(=O)CC1(O)CCC1)C(=O)OC(C)(C)C	ZINC000450639609	CE	On-Demand	Anodyne	NOD1	64	33
COc1nccc(CN2CCCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000450639612	FH	On-Demand	Anodyne	DRD1	22	48
COc1nccc(CN2CCCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000450639612	FH	On-Demand	Anodyne	DRD4	31	47
COc1nccc(CN2CCCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000450639612	FH	On-Demand	Anodyne	DRD3	19	48
Cc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450639621	GH	On-Demand	Bother	CHRNA4	26	42
CC(C)(C[C@@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(N)=O	ZINC000450639628	GI	On-Demand	Anodyne	ADRB2	18	49
CC(C)(C[C@@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(N)=O	ZINC000450639628	GI	On-Demand	Anodyne	ADRB3	18	52
CC(C)(C[C@@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(N)=O	ZINC000450639628	GI	On-Demand	Anodyne	SIRT3	54	30
CC(C)(C[C@@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(N)=O	ZINC000450639628	GI	On-Demand	Anodyne	SIRT2	45	30
CC(C)(C[C@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(N)=O	ZINC000450639629	GI	On-Demand	Anodyne	ADRB2	18	49
CC(C)(C[C@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(N)=O	ZINC000450639629	GI	On-Demand	Anodyne	ADRB3	18	52
CC(C)(C[C@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(N)=O	ZINC000450639629	GI	On-Demand	Anodyne	SIRT3	54	30
CC(C)(C[C@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(N)=O	ZINC000450639629	GI	On-Demand	Anodyne	SIRT2	45	30
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(OC)c1Br	ZINC000450639634	GG	On-Demand	Anodyne	COLA	47	37
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(OC)c1Br	ZINC000450639634	GG	On-Demand	Anodyne	CPT1A	45	34
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(OC)c1Br	ZINC000450639634	GG	On-Demand	Anodyne	PRNP	49	40
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(OC)c1Br	ZINC000450639634	GG	On-Demand	Anodyne	IMPDH2	0	41
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(OC)c1Br	ZINC000450639634	GG	On-Demand	Anodyne	ENPP1	50	33
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(OC)c1Br	ZINC000450639634	GG	On-Demand	Anodyne	DGAT1	40	38
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(OC)c1Br	ZINC000450639634	GG	On-Demand	Anodyne	HPGDS	19	40
COCCOC[C@@H](O)CN1CCc2c(ccc(OC)c2OC)C1	ZINC000450639645	ED	On-Demand	Anodyne	HSP90AB1	35	42
COCCOC[C@H](O)CN1CCc2c(ccc(OC)c2OC)C1	ZINC000450639648	ED	On-Demand	Anodyne	HSP90AB1	35	42
COC(=O)[C@@H](CC(F)(F)F)NC(=O)C(CC(C)C)CC(C)C	ZINC000450639663	EG	On-Demand	Anodyne	NPR	27	55
COC(=O)[C@H](CC(F)(F)F)NC(=O)C(CC(C)C)CC(C)C	ZINC000450639665	EG	On-Demand	Anodyne	NPR	27	55
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCC(=O)OC(C)C	ZINC000450639675	EG	On-Demand	Anodyne	PPARD	28	42
CCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450639676	EG	On-Demand	Anodyne	SSTR2	65	41
CCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450639676	EG	On-Demand	Anodyne	GHRHR	53	32
CCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450639676	EG	On-Demand	Anodyne	P2RY12	96	37
CCC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450639676	EG	On-Demand	Anodyne	CACNA1B	25	42
COc1cc(-c2nnc(SCc3cc(C)ccc3F)o2)cc(OC)c1OC	ZINC000450639677	GJ	On-Demand	Anodyne	TYMS	0	47
COc1cc(-c2nnc(SCc3cc(C)ccc3F)o2)cc(OC)c1OC	ZINC000450639677	GJ	On-Demand	Anodyne	GSK3B	17	48
COc1cc(-c2nnc(SCc3cc(C)ccc3F)o2)cc(OC)c1OC	ZINC000450639677	GJ	On-Demand	Anodyne	GSK3A	41	40
CS[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@@H]1N(C)C	ZINC000450639678	DE	On-Demand	Anodyne	SIGMAR1	18	42
CS[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1N(C)C	ZINC000450639679	DE	On-Demand	Anodyne	SIGMAR1	18	42
CS[C@H]1CN(CCN(C)Cc2ccccc2)C[C@@H]1N(C)C	ZINC000450639680	DE	On-Demand	Anodyne	SIGMAR1	18	42
CS[C@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1N(C)C	ZINC000450639681	DE	On-Demand	Anodyne	SIGMAR1	18	42
COc1ccc(C[C@H](C)CN(C)CC2CCC(=O)CC2)cc1	ZINC000450639686	DH	On-Demand	Anodyne	PSMB8	40	32
COc1ccc(C[C@@H](C)CN(C)CC2CCC(=O)CC2)cc1	ZINC000450639687	DH	On-Demand	Anodyne	PSMB8	40	32
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cc(C)nc(C(C)C)n2)CC1	ZINC000450639688	GH	On-Demand	Anodyne	P2RY12	48	36
CC[C@@H]1C[C@H]1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450639689	DD	On-Demand	Anodyne	CDK4	23	42
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	DRD4	30	55
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	DRD3	0	55
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	LTA4H	23	40
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	SIGMAR1	38	47
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	MLNR	41	35
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	MBTPS1	42	34
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	NPFFR1	45	44
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	NOD2	43	38
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	ADIPOR1	0	40
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639690	FF	On-Demand	Anodyne	ADIPOR2	0	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	DRD4	30	55
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	DRD3	0	55
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	LTA4H	23	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	SIGMAR1	38	47
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	MLNR	41	35
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	MBTPS1	42	34
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	NPFFR1	45	44
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	NOD2	43	38
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	ADIPOR1	0	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1	ZINC000450639691	FF	On-Demand	Anodyne	ADIPOR2	0	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	DRD4	30	55
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	DRD3	0	55
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	LTA4H	23	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	SIGMAR1	38	47
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	MLNR	41	35
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	MBTPS1	42	34
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	NPFFR1	45	44
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	NOD2	43	38
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	ADIPOR1	0	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639692	FF	On-Demand	Anodyne	ADIPOR2	0	40
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	DRD4	30	55
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	DRD3	0	55
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	LTA4H	23	40
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	SIGMAR1	38	47
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	MLNR	41	35
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	MBTPS1	42	34
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	NPFFR1	45	44
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	NOD2	43	38
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	ADIPOR1	0	40
COC(=O)c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1	ZINC000450639693	FF	On-Demand	Anodyne	ADIPOR2	0	40
Cc1ccc(Br)cc1CN1CC[C@@H](NC(N)=O)C1	ZINC000450639697	DE	On-Demand	Anodyne	DRD4	22	45
Cc1ccc(Br)cc1CN1CC[C@@H](NC(N)=O)C1	ZINC000450639697	DE	On-Demand	Anodyne	MCHR1	24	41
Cc1ccc(Br)cc1CN1CC[C@H](NC(N)=O)C1	ZINC000450639698	DE	On-Demand	Anodyne	DRD4	22	45
Cc1ccc(Br)cc1CN1CC[C@H](NC(N)=O)C1	ZINC000450639698	DE	On-Demand	Anodyne	MCHR1	24	41
CCS(=O)(=O)c1ccc(CN2CC(=O)N(Cc3ccccc3)C2)cc1	ZINC000450639704	FE	On-Demand	Anodyne	SIGMAR1	20	43
COCc1nc(C)cc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)n1	ZINC000450639717	GI	On-Demand	Anodyne	SIGMAR1	45	42
COCc1nc(C)cc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)n1	ZINC000450639718	GI	On-Demand	Anodyne	SIGMAR1	45	42
COC(=O)c1ccc(CN2CCO[C@H](c3cccc(C#N)c3)C2)cc1Cl	ZINC000450639721	FH	On-Demand	Mild	DRD4	21	42
COC(=O)c1ccc(CN2CCO[C@H](c3cccc(C#N)c3)C2)cc1Cl	ZINC000450639721	FH	On-Demand	Mild	MLNR	20	40
COC(=O)c1ccc(CN2CCO[C@@H](c3cccc(C#N)c3)C2)cc1Cl	ZINC000450639722	FH	On-Demand	Mild	DRD4	21	42
COC(=O)c1ccc(CN2CCO[C@@H](c3cccc(C#N)c3)C2)cc1Cl	ZINC000450639722	FH	On-Demand	Mild	MLNR	20	40
C[C@H]1Cc2cccc(C(=O)Nc3ccc(S(C)(=O)=O)c(C(F)F)c3)c2O1	ZINC000450639724	GH	On-Demand	Anodyne	MTTP	66	38
C[C@H]1Cc2cccc(C(=O)Nc3ccc(S(C)(=O)=O)c(C(F)F)c3)c2O1	ZINC000450639724	GH	On-Demand	Anodyne	KCNK3	44	31
C[C@H]1Cc2cccc(C(=O)Nc3ccc(S(C)(=O)=O)c(C(F)F)c3)c2O1	ZINC000450639724	GH	On-Demand	Anodyne	KCNK9	46	32
C[C@@H]1Cc2cccc(C(=O)Nc3ccc(S(C)(=O)=O)c(C(F)F)c3)c2O1	ZINC000450639725	GH	On-Demand	Anodyne	MTTP	66	38
C[C@@H]1Cc2cccc(C(=O)Nc3ccc(S(C)(=O)=O)c(C(F)F)c3)c2O1	ZINC000450639725	GH	On-Demand	Anodyne	KCNK3	44	31
C[C@@H]1Cc2cccc(C(=O)Nc3ccc(S(C)(=O)=O)c(C(F)F)c3)c2O1	ZINC000450639725	GH	On-Demand	Anodyne	KCNK9	46	32
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@H]1[C@@H](C)O	ZINC000450639740	CD	On-Demand	Anodyne	COLA	62	38
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@H]1[C@@H](C)O	ZINC000450639740	CD	On-Demand	Anodyne	CPT1A	63	36
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@H]1[C@H](C)O	ZINC000450639741	CD	On-Demand	Anodyne	COLA	62	38
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@H]1[C@H](C)O	ZINC000450639741	CD	On-Demand	Anodyne	CPT1A	63	36
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1[C@@H](C)O	ZINC000450639742	CD	On-Demand	Anodyne	COLA	62	38
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1[C@@H](C)O	ZINC000450639742	CD	On-Demand	Anodyne	CPT1A	63	36
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1[C@H](C)O	ZINC000450639743	CD	On-Demand	Anodyne	COLA	62	38
C[C@H](Oc1ccccn1)C(=O)N1CCCC[C@@H]1[C@H](C)O	ZINC000450639743	CD	On-Demand	Anodyne	CPT1A	63	36
Cc1cc(C(=O)N2CCN(c3ccccc3)C(=O)C2)nn1C(C)C	ZINC000450639748	EE	On-Demand	Anodyne	P2RX7	16	41
Cc1cc(C(=O)N2CCN(c3ccccc3)C(=O)C2)nn1C(C)C	ZINC000450639748	EE	On-Demand	Anodyne	BCL2	19	44
O=C(CCSc1nnc(-c2ccccc2)o1)NC(=O)NCCC(F)(F)F	ZINC000450639754	GF	On-Demand	Anodyne	ALOX15	41	35
COc1cc(CN2CC[C@H](NC(N)=O)C2)ccc1Cl	ZINC000450639759	CD	On-Demand	Anodyne	CYP3A43	0	47
COc1cc(CN2CC[C@@H](NC(N)=O)C2)ccc1Cl	ZINC000450639760	CD	On-Demand	Anodyne	CYP3A43	0	47
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(N)=O)C1	ZINC000450639765	CC	On-Demand	Anodyne	OPRK1	26	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(N)=O)C1	ZINC000450639766	CC	On-Demand	Anodyne	OPRK1	26	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(N)=O)C1	ZINC000450639767	CC	On-Demand	Anodyne	OPRK1	26	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(N)=O)C1	ZINC000450639768	CC	On-Demand	Anodyne	OPRK1	26	40
CS(=O)(=O)N1CCN(CCCC(=O)c2ccccc2)Cc2ccccc21	ZINC000450639769	FF	On-Demand	Anodyne	HTR1A	25	44
CS(=O)(=O)N1CCN(CCCC(=O)c2ccccc2)Cc2ccccc21	ZINC000450639769	FF	On-Demand	Anodyne	DRD3	23	44
CS(=O)(=O)N1CCN(CCCC(=O)c2ccccc2)Cc2ccccc21	ZINC000450639769	FF	On-Demand	Anodyne	HTR7	49	50
CS(=O)(=O)N1CCN(CCCC(=O)c2ccccc2)Cc2ccccc21	ZINC000450639769	FF	On-Demand	Anodyne	SLC18A3	0	42
CS(=O)(=O)N1CCN(CCCC(=O)c2ccccc2)Cc2ccccc21	ZINC000450639769	FF	On-Demand	Anodyne	CYP2J2	57	40
CC(F)(F)CCSc1nnc(-c2ccccc2)o1	ZINC000450639785	CH	On-Demand	Anodyne	GSK3A	40	49
COc1cc(NC(=O)c2cn3nccc3nc2C)ccc1OC(C)C	ZINC000450639794	EG	On-Demand	Anodyne	DDR1	46	42
COc1cc(NC(=O)c2cn3nccc3nc2C)ccc1OC(C)C	ZINC000450639794	EG	On-Demand	Anodyne	ENPP1	63	39
COc1cc(NC(=O)c2cn3nccc3nc2C)ccc1OC(C)C	ZINC000450639794	EG	On-Demand	Anodyne	KCNK3	40	39
CCc1cc(CCCN2CCC(n3c(CC)nc4ccccc43)CC2)on1	ZINC000450639797	FI	On-Demand	Anodyne	FPR2	29	42
CCc1cc(CCCN2CCC(n3c(CC)nc4ccccc43)CC2)on1	ZINC000450639797	FI	On-Demand	Anodyne	USP1	0	41
COc1cc(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)ccc1OC(C)C	ZINC000450639807	GG	On-Demand	Anodyne	COLA	91	42
COc1cc(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)ccc1OC(C)C	ZINC000450639807	GG	On-Demand	Anodyne	CPT1A	89	42
COc1cc(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)ccc1OC(C)C	ZINC000450639807	GG	On-Demand	Anodyne	CPT2	53	41
COc1cc(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)ccc1OC(C)C	ZINC000450639807	GG	On-Demand	Anodyne	CPT1B	72	41
COc1cc(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)ccc1OC(C)C	ZINC000450639807	GG	On-Demand	Anodyne	ENPP1	69	33
COc1cc(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)ccc1OC(C)C	ZINC000450639807	GG	On-Demand	Anodyne	KCNK3	71	41
COc1cc(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)ccc1OC(C)C	ZINC000450639807	GG	On-Demand	Anodyne	KCNK9	64	37
CSc1ccc2ncnc(N3CC[C@H]3C3CC3)c2c1	ZINC000450639820	CG	On-Demand	Anodyne	PDE3B	57	31
CSc1ccc2ncnc(N3CC[C@@H]3C3CC3)c2c1	ZINC000450639821	CG	On-Demand	Anodyne	PDE3B	57	31
CCc1cccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)n1	ZINC000450639829	FE	On-Demand	Anodyne	CDK1	21	42
CCc1cccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)n1	ZINC000450639829	FE	On-Demand	Anodyne	CDK4	23	42
COC(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1Cl	ZINC000450639830	GH	On-Demand	Anodyne	DRD4	30	44
COC(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1Cl	ZINC000450639830	GH	On-Demand	Anodyne	DRD3	0	44
COC(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1Cl	ZINC000450639830	GH	On-Demand	Anodyne	AGTR2	48	37
COC(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1Cl	ZINC000450639830	GH	On-Demand	Anodyne	ABCB1	16	43
COC(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1Cl	ZINC000450639830	GH	On-Demand	Anodyne	ABCG2	38	44
COC(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1Cl	ZINC000450639830	GH	On-Demand	Anodyne	NOD1	30	41
COC(=O)c1ccc(CN2CCc3c(ccc(OC)c3OC)C2)cc1Cl	ZINC000450639830	GH	On-Demand	Anodyne	NOD2	45	41
CSc1ccc(C)c(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1	ZINC000450639840	FI	On-Demand	Anodyne	ANPEP	32	43
CSc1ccc(C)c(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1	ZINC000450639840	FI	On-Demand	Anodyne	FPR1	46	33
CCS(=O)(=O)c1ccc(CN(Cc2cccnc2)Cc2ccco2)cc1	ZINC000450639853	FH	On-Demand	Anodyne	NR1D1	52	44
Cc1ccc2oc(N3CC[C@@H]3C3CC3)nc2c1	ZINC000450639855	BG	On-Demand	Anodyne	HTR3A	23	64
Cc1ccc2oc(N3CC[C@@H]3C3CC3)nc2c1	ZINC000450639855	BG	On-Demand	Anodyne	CHRNA7	16	47
Cc1ccc2oc(N3CC[C@H]3C3CC3)nc2c1	ZINC000450639856	BG	On-Demand	Anodyne	HTR3A	23	64
Cc1ccc2oc(N3CC[C@H]3C3CC3)nc2c1	ZINC000450639856	BG	On-Demand	Anodyne	CHRNA7	16	47
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3cccc(Br)c3n2)C1	ZINC000450639858	GH	On-Demand	Anodyne	CHRNA4	30	50
COc1ccc2c(c1OC)CCN(C[C@](C)(O)C(C)=O)C2	ZINC000450639859	CD	On-Demand	Anodyne	AGTR2	45	36
COc1ccc2c(c1OC)CCN(C[C@@](C)(O)C(C)=O)C2	ZINC000450639860	CD	On-Demand	Anodyne	AGTR2	45	36
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450639877	EF	On-Demand	Anodyne	DRD3	0	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450639880	EF	On-Demand	Anodyne	DRD3	0	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450639883	EF	On-Demand	Anodyne	DRD3	0	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450639885	EF	On-Demand	Anodyne	DRD3	0	49
CCc1cccc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)n1	ZINC000450639895	EE	On-Demand	Anodyne	P2RX7	21	44
CCc1cccc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)n1	ZINC000450639895	EE	On-Demand	Anodyne	CCKAR	18	40
CCCn1c(SCc2ccc(C(C)=O)cc2)nc2ccccc2c1=O	ZINC000450639901	FI	On-Demand	Anodyne	PTGDR2	19	48
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450639902	FH	On-Demand	Anodyne	CHRNA4	28	45
Cc1ccc(NC(=O)N2CCN(Cc3cnns3)CC2)cc1	ZINC000450639907	DE	On-Demand	Anodyne	FAAH	17	46
COC(=O)c1ccc(CC(=O)N2CC[C@H]2C(C)C)cc1	ZINC000450639917	CE	On-Demand	Anodyne	OPRK1	24	43
COC(=O)c1ccc(CC(=O)N2CC[C@@H]2C(C)C)cc1	ZINC000450639920	CE	On-Demand	Anodyne	OPRK1	24	43
CCc1cc(CCCN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)on1	ZINC000450639923	GI	On-Demand	Anodyne	SIGMAR1	35	64
C[C@@H](CCCCO)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450639928	EH	On-Demand	Bother	BDKRB1	0	40
C[C@@H](CCCCO)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450639928	EH	On-Demand	Bother	COLA	41	34
C[C@@H](CCCCO)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450639928	EH	On-Demand	Bother	BCL2L1	74	34
C[C@@H](CCCCO)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450639928	EH	On-Demand	Bother	BCL2	48	31
C[C@H](CCCCO)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450639930	EH	On-Demand	Bother	BDKRB1	0	40
C[C@H](CCCCO)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450639930	EH	On-Demand	Bother	COLA	41	34
C[C@H](CCCCO)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450639930	EH	On-Demand	Bother	BCL2L1	74	34
C[C@H](CCCCO)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450639930	EH	On-Demand	Bother	BCL2	48	31
CC(C)OC(C)(C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450639932	FE	On-Demand	Anodyne	CDK1	20	41
CC(C)OC(C)(C)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450639932	FE	On-Demand	Anodyne	CDK4	22	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3cccnc23)C1	ZINC000450639934	DE	On-Demand	Anodyne	CHRNA4	30	53
COC(=O)c1cccc(CN2CCC(CCCN(C)C)CC2)c1Cl	ZINC000450639952	FH	On-Demand	Anodyne	ACHE	30	48
COC(=O)c1cccc(CN2CCC(CCCN(C)C)CC2)c1Cl	ZINC000450639952	FH	On-Demand	Anodyne	HTR4	48	34
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3cc(Br)ccc3n2)C1	ZINC000450639957	GH	On-Demand	Anodyne	CHRNA4	29	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639958	FG	On-Demand	Anodyne	DRD4	35	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639958	FG	On-Demand	Anodyne	ACHE	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639958	FG	On-Demand	Anodyne	DRD3	23	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639958	FG	On-Demand	Anodyne	SIGMAR1	41	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639958	FG	On-Demand	Anodyne	SLC18A3	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639958	FG	On-Demand	Anodyne	CACNA1G	21	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639959	FG	On-Demand	Anodyne	DRD4	35	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639959	FG	On-Demand	Anodyne	ACHE	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639959	FG	On-Demand	Anodyne	DRD3	23	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639959	FG	On-Demand	Anodyne	SIGMAR1	41	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639959	FG	On-Demand	Anodyne	SLC18A3	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450639959	FG	On-Demand	Anodyne	CACNA1G	21	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639960	FG	On-Demand	Anodyne	DRD4	35	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639960	FG	On-Demand	Anodyne	ACHE	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639960	FG	On-Demand	Anodyne	DRD3	23	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639960	FG	On-Demand	Anodyne	SIGMAR1	41	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639960	FG	On-Demand	Anodyne	SLC18A3	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639960	FG	On-Demand	Anodyne	CACNA1G	21	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639961	FG	On-Demand	Anodyne	DRD4	35	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639961	FG	On-Demand	Anodyne	ACHE	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639961	FG	On-Demand	Anodyne	DRD3	23	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639961	FG	On-Demand	Anodyne	SIGMAR1	41	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639961	FG	On-Demand	Anodyne	SLC18A3	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450639961	FG	On-Demand	Anodyne	CACNA1G	21	42
CCCc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)no1	ZINC000450639963	EF	On-Demand	Anodyne	DRD3	0	52
CCCc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)no1	ZINC000450639965	EF	On-Demand	Anodyne	DRD3	0	52
CCCc1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)no1	ZINC000450639967	EF	On-Demand	Anodyne	DRD3	0	52
CCCc1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)no1	ZINC000450639968	EF	On-Demand	Anodyne	DRD3	0	52
CC(=O)c1ccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639971	FH	On-Demand	Anodyne	UTS2R	15	41
CC(=O)c1ccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639971	FH	On-Demand	Anodyne	MLNR	40	38
CC(=O)c1ccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639971	FH	On-Demand	Anodyne	LIPE	21	41
CC(=O)c1ccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639971	FH	On-Demand	Anodyne	CCR2	29	42
CC(=O)c1ccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639971	FH	On-Demand	Anodyne	SLC6A5	32	42
CC(=O)c1ccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639971	FH	On-Demand	Anodyne	MCHR1	32	40
CC(=O)c1ccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639971	FH	On-Demand	Anodyne	LIPG	54	53
CC(=O)c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639973	FH	On-Demand	Anodyne	UTS2R	15	41
CC(=O)c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639973	FH	On-Demand	Anodyne	MLNR	40	38
CC(=O)c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639973	FH	On-Demand	Anodyne	LIPE	21	41
CC(=O)c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639973	FH	On-Demand	Anodyne	CCR2	29	42
CC(=O)c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639973	FH	On-Demand	Anodyne	SLC6A5	32	42
CC(=O)c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639973	FH	On-Demand	Anodyne	MCHR1	32	40
CC(=O)c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1	ZINC000450639973	FH	On-Demand	Anodyne	LIPG	54	53
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccncc2[N+](=O)[O-])CC1	ZINC000450639979	GG	On-Demand	Bother	SLC12A5	41	31
CC(C)[C@@H]1CCc2ccccc2N1C(=O)c1cc2c(=O)n(C)c(=O)n(C)c2s1	ZINC000450639980	GF	On-Demand	Anodyne	SLC16A1	43	31
CC(C)[C@H]1CCc2ccccc2N1C(=O)c1cc2c(=O)n(C)c(=O)n(C)c2s1	ZINC000450639984	GF	On-Demand	Anodyne	SLC16A1	43	31
COC(=O)[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)[C@@H](C)O	ZINC000450639985	DC	On-Demand	Anodyne	P2RY12	51	35
COC(=O)[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)[C@H](C)O	ZINC000450639986	DC	On-Demand	Anodyne	P2RY12	51	35
COC(=O)[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)[C@H](C)O	ZINC000450639987	DC	On-Demand	Anodyne	P2RY12	51	35
COC(=O)[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)[C@@H](C)O	ZINC000450639988	DC	On-Demand	Anodyne	P2RY12	51	35
COC(=O)C1(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450640000	EF	On-Demand	Anodyne	LIPE	20	40
COC(=O)C1(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450640000	EF	On-Demand	Anodyne	CCR2	49	40
COC(=O)C1(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450640000	EF	On-Demand	Anodyne	LIPG	55	52
COC(=O)C1(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450640001	EF	On-Demand	Anodyne	LIPE	20	40
COC(=O)C1(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450640001	EF	On-Demand	Anodyne	CCR2	49	40
COC(=O)C1(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450640001	EF	On-Demand	Anodyne	LIPG	55	52
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccnc(C)c2Cl)CC1	ZINC000450640004	GI	On-Demand	Anodyne	SLC12A5	47	32
CC(C)[C@@H]1CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450640005	DF	On-Demand	Bother	CACNA1D	75	34
CC(C)[C@@H]1CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450640005	DF	On-Demand	Bother	MGLL	0	40
CC(C)[C@H]1CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450640006	DF	On-Demand	Bother	CACNA1D	75	34
CC(C)[C@H]1CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450640006	DF	On-Demand	Bother	MGLL	0	40
COc1cc(OC)c2ncnc(N3CC[C@@H]3C3CC3)c2c1	ZINC000450640010	CF	On-Demand	Anodyne	PDE3B	67	37
COc1cc(OC)c2ncnc(N3CC[C@H]3C3CC3)c2c1	ZINC000450640011	CF	On-Demand	Anodyne	PDE3B	67	37
COc1cc(NC(=O)CC2CC(F)(F)C2)ccc1OC(C)C	ZINC000450640012	DH	On-Demand	Anodyne	ENPP1	81	38
COc1ccc(CNC(=O)CCN2CCCN(CC(F)F)CC2)c(OC)c1	ZINC000450640042	GD	On-Demand	Anodyne	HTR1A	25	40
COc1ccc(CNC(=O)CCN2CCCN(CC(F)F)CC2)c(OC)c1	ZINC000450640042	GD	On-Demand	Anodyne	DRD4	43	32
COc1ccc(CNC(=O)CCN2CCCN(CC(F)F)CC2)c(OC)c1	ZINC000450640042	GD	On-Demand	Anodyne	HTR7	40	43
COc1ccc(CNC(=O)CCN2CCCN(CC(F)F)CC2)c(OC)c1	ZINC000450640042	GD	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN2CCCN(CC(F)F)CC2)c(OC)c1	ZINC000450640042	GD	On-Demand	Anodyne	MTNR1B	45	44
COc1ccc(CNC(=O)CCN2CCCN(CC(F)F)CC2)c(OC)c1	ZINC000450640042	GD	On-Demand	Anodyne	EBP	24	40
O=C(CC1(O)CCC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450640047	EG	On-Demand	Anodyne	ADAM17	44	37
O=C(CC1(O)CCC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450640047	EG	On-Demand	Anodyne	CDC25B	23	42
O=C(CC1(O)CCC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450640047	EG	On-Demand	Anodyne	GYS1	45	34
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1Cl	ZINC000450640049	FI	On-Demand	Anodyne	GRM4	17	48
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1Cl	ZINC000450640049	FI	On-Demand	Anodyne	PTGDR2	15	45
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1Cl	ZINC000450640049	FI	On-Demand	Anodyne	NCE103	19	45
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1Cl	ZINC000450640049	FI	On-Demand	Anodyne	PFK	0	42
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1Cl	ZINC000450640049	FI	On-Demand	Anodyne	ENPP1	82	41
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1Cl	ZINC000450640049	FI	On-Demand	Anodyne	IMDH_CRYPV	32	53
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1Cl	ZINC000450640049	FI	On-Demand	Anodyne	CAN2	0	45
CCCOc1ccc(C(=O)Nc2ccccc2CN2CCNC2=O)c(OC)c1	ZINC000450640055	GG	On-Demand	Anodyne	KCNK3	41	36
CC(F)(F)c1ccc(C(=O)NCc2ccc(C(F)F)cc2)cn1	ZINC000450640056	EI	On-Demand	Anodyne	NAMPT	55	39
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	CPT1A	59	36
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	CPT2	44	34
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	GRM4	19	40
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	ROCK2	15	44
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	CPT1B	42	34
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	IMPDH2	0	41
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	TAAR1	36	41
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	ENPP1	75	36
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	SMO	15	40
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	KCNK3	123	47
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	KCNK9	84	44
COc1cc(NC(=O)c2cccc(SC)c2)ccc1OC(C)C	ZINC000450640058	EI	On-Demand	Anodyne	BRPF1	0	41
FC(F)(F)c1ccc(O[C@@H]2CCN(C[C@@H]3COCCO3)C2)nc1	ZINC000450640060	ED	On-Demand	Anodyne	LIPE	15	40
Cc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)nn1C(C)C	ZINC000450640061	GE	On-Demand	Anodyne	CDK1	20	42
Cc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)nn1C(C)C	ZINC000450640061	GE	On-Demand	Anodyne	CDK4	22	42
Cc1cc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)nn1C(C)C	ZINC000450640061	GE	On-Demand	Anodyne	CARM1	57	33
COC(=O)c1csc(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)n1	ZINC000450640062	GG	On-Demand	Anodyne	GSK3B	22	49
COC(=O)c1csc(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)n1	ZINC000450640062	GG	On-Demand	Anodyne	GSK3A	49	49
COC(=O)c1csc(CSc2nnc(-c3ccc(OC)c(OC)c3)o2)n1	ZINC000450640062	GG	On-Demand	Anodyne	ENPP1	50	31
FC(F)(F)c1ccc(O[C@@H]2CCN(C[C@H]3COCCO3)C2)nc1	ZINC000450640076	ED	On-Demand	Anodyne	LIPE	15	40
FC(F)(F)c1ccc(O[C@H]2CCN(C[C@@H]3COCCO3)C2)nc1	ZINC000450640077	ED	On-Demand	Anodyne	LIPE	15	40
FC(F)(F)c1ccc(O[C@H]2CCN(C[C@H]3COCCO3)C2)nc1	ZINC000450640078	ED	On-Demand	Anodyne	LIPE	15	40
O=C(CSC1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450640080	EH	On-Demand	Anodyne	ADAM17	66	45
O=C(CSC1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450640080	EH	On-Demand	Anodyne	CDC25B	23	42
O=C(CSC1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450640080	EH	On-Demand	Anodyne	GYS1	68	36
CCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640094	EG	On-Demand	Anodyne	SSTR2	65	41
CCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640094	EG	On-Demand	Anodyne	GHRHR	53	32
CCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640094	EG	On-Demand	Anodyne	P2RY12	96	37
CCC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640094	EG	On-Demand	Anodyne	CACNA1B	25	42
CCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640095	EG	On-Demand	Anodyne	SSTR2	65	41
CCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640095	EG	On-Demand	Anodyne	GHRHR	53	32
CCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640095	EG	On-Demand	Anodyne	P2RY12	96	37
CCC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640095	EG	On-Demand	Anodyne	CACNA1B	25	42
CCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640096	EG	On-Demand	Anodyne	SSTR2	65	41
CCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640096	EG	On-Demand	Anodyne	GHRHR	53	32
CCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640096	EG	On-Demand	Anodyne	P2RY12	96	37
CCC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000450640096	EG	On-Demand	Anodyne	CACNA1B	25	42
CCCC[C@@H](NC(=O)c1ccsc1C)C(=O)OC(C)(C)C	ZINC000450640100	DH	On-Demand	Anodyne	CTSK	35	44
CCCC[C@H](NC(=O)c1ccsc1C)C(=O)OC(C)(C)C	ZINC000450640101	DH	On-Demand	Anodyne	CTSK	35	44
CC(C)(C[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1)C(N)=O	ZINC000450640104	ED	On-Demand	Anodyne	P2RY12	28	41
CC(C)(C[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1)C(N)=O	ZINC000450640104	ED	On-Demand	Anodyne	CXCR3	36	51
CC(C)(C[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1)C(N)=O	ZINC000450640104	ED	On-Demand	Anodyne	SIRT3	41	30
CC(C)(C[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1)C(N)=O	ZINC000450640105	ED	On-Demand	Anodyne	P2RY12	28	41
CC(C)(C[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1)C(N)=O	ZINC000450640105	ED	On-Demand	Anodyne	CXCR3	36	51
CC(C)(C[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1)C(N)=O	ZINC000450640105	ED	On-Demand	Anodyne	SIRT3	41	30
Cc1cc(C(F)(F)F)nc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450640110	EF	On-Demand	Anodyne	GPBAR1	0	41
Cc1cc(C(F)(F)F)nc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450640110	EF	On-Demand	Anodyne	ERG	0	41
Cc1cc(C(F)(F)F)nc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450640111	EF	On-Demand	Anodyne	GPBAR1	0	41
Cc1cc(C(F)(F)F)nc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)n1	ZINC000450640111	EF	On-Demand	Anodyne	ERG	0	41
CCCC[C@@H](NC(=O)CC[C@H]1CCC(=O)N1)C(=O)OC(C)(C)C	ZINC000450640114	EE	On-Demand	Anodyne	NOD1	75	34
CCCC[C@H](NC(=O)CC[C@H]1CCC(=O)N1)C(=O)OC(C)(C)C	ZINC000450640115	EE	On-Demand	Anodyne	NOD1	75	34
CCCC[C@@H](NC(=O)CC[C@@H]1CCC(=O)N1)C(=O)OC(C)(C)C	ZINC000450640116	EE	On-Demand	Anodyne	NOD1	75	34
CCCC[C@H](NC(=O)CC[C@@H]1CCC(=O)N1)C(=O)OC(C)(C)C	ZINC000450640117	EE	On-Demand	Anodyne	NOD1	75	34
CCOC(=O)c1cnn(C2CCN(c3nc(C)nc4sc(C)c(C)c34)CC2)c1	ZINC000450640124	GH	On-Demand	Anodyne	P2RY12	29	40
CCOC(=O)c1cnn(C2CCN(c3nccc(C)c3[N+](=O)[O-])CC2)c1	ZINC000450640125	FF	On-Demand	Bother	MAP3K7	46	36
Cc1sc2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1C	ZINC000450640128	EG	On-Demand	Anodyne	SIRT3	58	34
Cc1sc2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1C	ZINC000450640128	EG	On-Demand	Anodyne	SIRT2	44	34
Cc1sc2ncnc(N3CCC[C@H](CC(C)(C)C(N)=O)C3)c2c1C	ZINC000450640128	EG	On-Demand	Anodyne	SIRT1	51	34
Cc1sc2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1C	ZINC000450640129	EG	On-Demand	Anodyne	SIRT3	58	34
Cc1sc2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1C	ZINC000450640129	EG	On-Demand	Anodyne	SIRT2	44	34
Cc1sc2ncnc(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)c2c1C	ZINC000450640129	EG	On-Demand	Anodyne	SIRT1	51	34
CC(C)(C[C@@H]1CCCN(c2ncncc2Cl)C1)C(N)=O	ZINC000450640130	CE	On-Demand	Anodyne	SIRT3	50	33
CC(C)(C[C@@H]1CCCN(c2ncncc2Cl)C1)C(N)=O	ZINC000450640130	CE	On-Demand	Anodyne	SIRT2	43	32
CC(C)(C[C@H]1CCCN(c2ncncc2Cl)C1)C(N)=O	ZINC000450640131	CE	On-Demand	Anodyne	SIRT3	50	33
CC(C)(C[C@H]1CCCN(c2ncncc2Cl)C1)C(N)=O	ZINC000450640131	CE	On-Demand	Anodyne	SIRT2	43	32
CCCC[C@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC(C)(C)C	ZINC000450640138	EG	On-Demand	Anodyne	P2RY12	101	35
CCCC[C@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC(C)(C)C	ZINC000450640138	EG	On-Demand	Anodyne	CTSK	34	42
CCCC[C@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC(C)(C)C	ZINC000450640138	EG	On-Demand	Anodyne	NOD1	47	34
CCCC[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC(C)(C)C	ZINC000450640139	EG	On-Demand	Anodyne	P2RY12	101	35
CCCC[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC(C)(C)C	ZINC000450640139	EG	On-Demand	Anodyne	CTSK	34	42
CCCC[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OC(C)(C)C	ZINC000450640139	EG	On-Demand	Anodyne	NOD1	47	34
CC(C)(C[C@@H]1CCCN(c2ncnc3n[nH]cc23)C1)C(N)=O	ZINC000450640140	DD	On-Demand	Anodyne	SIRT3	56	33
CC(C)(C[C@@H]1CCCN(c2ncnc3n[nH]cc23)C1)C(N)=O	ZINC000450640140	DD	On-Demand	Anodyne	SIRT1	41	32
CC(C)(C[C@H]1CCCN(c2ncnc3n[nH]cc23)C1)C(N)=O	ZINC000450640141	DD	On-Demand	Anodyne	SIRT3	56	33
CC(C)(C[C@H]1CCCN(c2ncnc3n[nH]cc23)C1)C(N)=O	ZINC000450640141	DD	On-Demand	Anodyne	SIRT1	41	32
CCCC[C@@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC(C)(C)C	ZINC000450640144	EE	On-Demand	Anodyne	SSTR2	53	34
CCCC[C@@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC(C)(C)C	ZINC000450640144	EE	On-Demand	Anodyne	P2RY12	40	32
CCCC[C@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC(C)(C)C	ZINC000450640145	EE	On-Demand	Anodyne	SSTR2	53	34
CCCC[C@H](NC(=O)c1cn(CC2CC2)nn1)C(=O)OC(C)(C)C	ZINC000450640145	EE	On-Demand	Anodyne	P2RY12	40	32
CO[C@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCOC1	ZINC000450640146	CC	On-Demand	Anodyne	NCE103	25	40
CO[C@@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCOC1	ZINC000450640147	CC	On-Demand	Anodyne	NCE103	25	40
CO[C@@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCOC1	ZINC000450640147	CC	On-Demand	Anodyne	CAN2	0	40
CCC[C@H](OC)C(=O)N[C@H](CCC)C(=O)OC(C)(C)C	ZINC000450640156	CE	On-Demand	Anodyne	PAPA1_CARPA	32	48
CCC[C@H](OC)C(=O)N[C@H](CCC)C(=O)OC(C)(C)C	ZINC000450640156	CE	On-Demand	Anodyne	CTSK	0	41
CCC[C@H](NC(=O)[C@@H](CCC)OC)C(=O)OC(C)(C)C	ZINC000450640157	CE	On-Demand	Anodyne	PAPA1_CARPA	32	48
CCC[C@H](NC(=O)[C@@H](CCC)OC)C(=O)OC(C)(C)C	ZINC000450640157	CE	On-Demand	Anodyne	CTSK	0	41
CCC[C@H](NC(=O)[C@H](CCC)OC)C(=O)OC(C)(C)C	ZINC000450640158	CE	On-Demand	Anodyne	PAPA1_CARPA	32	48
CCC[C@H](NC(=O)[C@H](CCC)OC)C(=O)OC(C)(C)C	ZINC000450640158	CE	On-Demand	Anodyne	CTSK	0	41
CCC[C@@H](NC(=O)[C@@H](CCC)OC)C(=O)OC(C)(C)C	ZINC000450640159	CE	On-Demand	Anodyne	PAPA1_CARPA	32	48
CCC[C@@H](NC(=O)[C@@H](CCC)OC)C(=O)OC(C)(C)C	ZINC000450640159	CE	On-Demand	Anodyne	CTSK	0	41
CC(C)c1ccc(C[C@@H]2CCN(C(=O)CCc3ccc(C(N)=O)cc3)C2)cc1	ZINC000450640164	GH	On-Demand	Anodyne	GRIN2B	29	40
CC(C)c1ccc(C[C@@H]2CCN(C(=O)CCc3ccc(C(N)=O)cc3)C2)cc1	ZINC000450640164	GH	On-Demand	Anodyne	GPBAR1	19	46
CC(C)c1ccc(C[C@H]2CCN(C(=O)CCc3ccc(C(N)=O)cc3)C2)cc1	ZINC000450640165	GH	On-Demand	Anodyne	GRIN2B	29	40
CC(C)c1ccc(C[C@H]2CCN(C(=O)CCc3ccc(C(N)=O)cc3)C2)cc1	ZINC000450640165	GH	On-Demand	Anodyne	GPBAR1	19	46
Cn1c(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nc2ccc(F)cc21	ZINC000450640166	EF	On-Demand	Anodyne	DPP4	0	40
Cn1c(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nc2ccc(F)cc21	ZINC000450640167	EF	On-Demand	Anodyne	DPP4	0	40
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640170	GF	On-Demand	Anodyne	PDGFRB	45	41
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640170	GF	On-Demand	Anodyne	AKT2	40	35
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640170	GF	On-Demand	Anodyne	AKT1	38	40
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640170	GF	On-Demand	Anodyne	SIRT3	77	32
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640170	GF	On-Demand	Anodyne	SIRT2	66	32
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640170	GF	On-Demand	Anodyne	SIRT1	59	32
CCOC(=O)C1([S@@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640170	GF	On-Demand	Anodyne	HTT	0	43
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640171	GF	On-Demand	Anodyne	PDGFRB	45	41
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640171	GF	On-Demand	Anodyne	AKT2	40	35
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640171	GF	On-Demand	Anodyne	AKT1	38	40
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640171	GF	On-Demand	Anodyne	SIRT3	77	32
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640171	GF	On-Demand	Anodyne	SIRT2	66	32
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640171	GF	On-Demand	Anodyne	SIRT1	59	32
CCOC(=O)C1([S@](C)=O)CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450640171	GF	On-Demand	Anodyne	HTT	0	43
CCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450640172	GF	On-Demand	Anodyne	CA2	37	42
CCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450640172	GF	On-Demand	Anodyne	CA1	19	42
CCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450640172	GF	On-Demand	Anodyne	CA4	20	42
CCC[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450640172	GF	On-Demand	Anodyne	CTRB_BOVIN	45	31
CCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450640173	GF	On-Demand	Anodyne	CA2	37	42
CCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450640173	GF	On-Demand	Anodyne	CA1	19	42
CCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450640173	GF	On-Demand	Anodyne	CA4	20	42
CCC[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OC(C)(C)C	ZINC000450640173	GF	On-Demand	Anodyne	CTRB_BOVIN	45	31
CN(CCCn1ccnc1)Cc1ccn(CC(F)(F)F)n1	ZINC000450640182	DE	On-Demand	Anodyne	TBXAS1	32	40
CCCC[C@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450640187	FG	On-Demand	Anodyne	SSTR2	55	34
CCCC[C@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450640187	FG	On-Demand	Anodyne	P2RY12	41	33
CCCC[C@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450640187	FG	On-Demand	Anodyne	PSENEN	0	40
CCCC[C@@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450640188	FG	On-Demand	Anodyne	SSTR2	55	34
CCCC[C@@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450640188	FG	On-Demand	Anodyne	P2RY12	41	33
CCCC[C@@H](NC(=O)Cc1cc2ccccc2c(O)n1)C(=O)OC(C)(C)C	ZINC000450640188	FG	On-Demand	Anodyne	PSENEN	0	40
O=C1CCCc2occ(C(=O)N3CCN(c4cccc(F)c4)C(=O)C3)c21	ZINC000450640197	FE	On-Demand	Anodyne	P2RX7	23	45
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)C1CCC1	ZINC000450640245	CD	On-Demand	Anodyne	CAPN2	18	40
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)C1CCC1	ZINC000450640246	CD	On-Demand	Anodyne	CAPN2	18	40
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)C1CCC1	ZINC000450640247	CD	On-Demand	Anodyne	CAPN2	18	40
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)C1CCC1	ZINC000450640248	CD	On-Demand	Anodyne	CAPN2	18	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)CCCC(C)C	ZINC000450640250	CE	On-Demand	Anodyne	FOLH1	0	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)CCCC(C)C	ZINC000450640250	CE	On-Demand	Anodyne	NOD1	89	38
COC(=O)[C@H](CC(F)(F)F)NC(=O)CCCC(C)C	ZINC000450640251	CE	On-Demand	Anodyne	FOLH1	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)CCCC(C)C	ZINC000450640251	CE	On-Demand	Anodyne	NOD1	89	38
CC(C)c1nccc(N2CC(C)(C)[C@H]2c2nccn2C)n1	ZINC000450640261	CF	On-Demand	Anodyne	SORD	54	32
CC(C)c1nccc(N2CC(C)(C)[C@@H]2c2nccn2C)n1	ZINC000450640262	CF	On-Demand	Anodyne	SORD	54	32
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450640266	EJ	On-Demand	Anodyne	CAPN1	24	44
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450640266	EJ	On-Demand	Anodyne	CAPN2	20	44
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450640267	EJ	On-Demand	Anodyne	CAPN1	24	44
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450640267	EJ	On-Demand	Anodyne	CAPN2	20	44
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450640268	EJ	On-Demand	Anodyne	CAPN1	24	44
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450640268	EJ	On-Demand	Anodyne	CAPN2	20	44
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450640269	EJ	On-Demand	Anodyne	CAPN1	24	44
CC(C)CC(CC(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450640269	EJ	On-Demand	Anodyne	CAPN2	20	44
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640270	GF	On-Demand	Anodyne	DRD4	40	43
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640270	GF	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640270	GF	On-Demand	Anodyne	HTR4	57	35
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640270	GF	On-Demand	Anodyne	SIGMAR1	19	41
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640270	GF	On-Demand	Anodyne	CCR3	30	43
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640270	GF	On-Demand	Anodyne	UTS2R	19	42
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640270	GF	On-Demand	Anodyne	CXCR3	25	52
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640270	GF	On-Demand	Anodyne	MCHR1	22	42
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640271	GF	On-Demand	Anodyne	DRD4	40	43
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640271	GF	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640271	GF	On-Demand	Anodyne	HTR4	57	35
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640271	GF	On-Demand	Anodyne	SIGMAR1	19	41
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640271	GF	On-Demand	Anodyne	CCR3	30	43
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640271	GF	On-Demand	Anodyne	UTS2R	19	42
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640271	GF	On-Demand	Anodyne	CXCR3	25	52
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450640271	GF	On-Demand	Anodyne	MCHR1	22	42
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640272	GF	On-Demand	Anodyne	DRD4	40	43
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640272	GF	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640272	GF	On-Demand	Anodyne	HTR4	57	35
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640272	GF	On-Demand	Anodyne	SIGMAR1	19	41
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640272	GF	On-Demand	Anodyne	CCR3	30	43
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640272	GF	On-Demand	Anodyne	UTS2R	19	42
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640272	GF	On-Demand	Anodyne	CXCR3	25	52
COC(=O)c1ccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640272	GF	On-Demand	Anodyne	MCHR1	22	42
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640273	GF	On-Demand	Anodyne	DRD4	40	43
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640273	GF	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640273	GF	On-Demand	Anodyne	HTR4	57	35
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640273	GF	On-Demand	Anodyne	SIGMAR1	19	41
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640273	GF	On-Demand	Anodyne	CCR3	30	43
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640273	GF	On-Demand	Anodyne	UTS2R	19	42
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640273	GF	On-Demand	Anodyne	CXCR3	25	52
COC(=O)c1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450640273	GF	On-Demand	Anodyne	MCHR1	22	42
CC(=O)c1cccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450640276	EE	On-Demand	Anodyne	DRD4	32	41
CC(=O)c1cccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450640276	EE	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)c1cccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450640277	EE	On-Demand	Anodyne	DRD4	32	41
CC(=O)c1cccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450640277	EE	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)c1cccc(CN2CC[C@@H](N3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450640277	EE	On-Demand	Anodyne	SLC18A3	34	42
CC(=O)c1cccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450640278	EE	On-Demand	Anodyne	DRD4	32	41
CC(=O)c1cccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450640278	EE	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)c1cccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450640278	EE	On-Demand	Anodyne	SLC18A3	34	42
CC(=O)c1cccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450640279	EE	On-Demand	Anodyne	DRD4	32	41
CC(=O)c1cccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450640279	EE	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)c1cccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450640279	EE	On-Demand	Anodyne	SLC18A3	34	42
NC(=O)c1ccc(CCC(=O)N2CCN(c3cccc(F)c3)C(=O)C2)cc1	ZINC000450640289	FD	On-Demand	Anodyne	MLNR	15	41
Cc1cc(F)c(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1F	ZINC000450640299	GF	On-Demand	Anodyne	CDK1	23	48
Cc1cc(F)c(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1F	ZINC000450640299	GF	On-Demand	Anodyne	CDK4	26	48
Cc1cc(F)c(CC(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cc1F	ZINC000450640299	GF	On-Demand	Anodyne	CALCA	0	43
CN(CCN1CCc2ccsc2C1)Cc1ccccc1	ZINC000450640300	CG	On-Demand	Anodyne	SIGMAR1	27	49
Cc1cc(N2CC[C@H]2C2CC2)nc(-c2cccnc2)n1	ZINC000450640305	CF	On-Demand	Anodyne	CYP11B2	44	37
Cc1cc(N2CC[C@H]2C2CC2)nc(-c2cccnc2)n1	ZINC000450640305	CF	On-Demand	Anodyne	ROS1	42	38
Cc1cc(N2CC[C@@H]2C2CC2)nc(-c2cccnc2)n1	ZINC000450640310	CF	On-Demand	Anodyne	CYP11B2	44	37
Cc1cc(N2CC[C@@H]2C2CC2)nc(-c2cccnc2)n1	ZINC000450640310	CF	On-Demand	Anodyne	ROS1	42	38
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450640311	FH	On-Demand	Anodyne	CCR2	41	38
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450640311	FH	On-Demand	Anodyne	PHES	0	43
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450640313	FH	On-Demand	Anodyne	CCR2	41	38
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450640313	FH	On-Demand	Anodyne	PHES	0	43
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450640314	FH	On-Demand	Anodyne	CCR2	41	38
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450640314	FH	On-Demand	Anodyne	PHES	0	43
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450640315	FH	On-Demand	Anodyne	CCR2	41	38
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450640315	FH	On-Demand	Anodyne	PHES	0	43
CC(C)[C@@H]1CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450640320	EF	On-Demand	Mild	COLA	97	42
CC(C)[C@H]1CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450640321	EF	On-Demand	Mild	COLA	97	42
CC(C)(C)OC(=O)c1cnc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cn1	ZINC000450640328	FE	On-Demand	Anodyne	CHRNA4	28	47
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1O	ZINC000450640333	EG	On-Demand	Anodyne	GCGR	0	40
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1O	ZINC000450640333	EG	On-Demand	Anodyne	TRPV1	35	48
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1O	ZINC000450640333	EG	On-Demand	Anodyne	ALOX15	25	44
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1O	ZINC000450640333	EG	On-Demand	Anodyne	TTR	0	47
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1O	ZINC000450640333	EG	On-Demand	Anodyne	NCE103	34	47
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1O	ZINC000450640333	EG	On-Demand	Anodyne	ENPP1	67	39
COc1cc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)ccc1O	ZINC000450640333	EG	On-Demand	Anodyne	CAN2	0	47
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450640339	FE	On-Demand	Bother	CHRNA4	26	42
O[C@H](Cc1ccccc1)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450640340	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
O[C@H](Cc1ccccc1)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450640340	FG	On-Demand	Anodyne	LIPE	17	44
O[C@H](Cc1ccccc1)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450640340	FG	On-Demand	Anodyne	LIPG	47	50
COc1cc(NC(=O)CCc2ccc(C(N)=O)cc2)ccc1OC(C)C	ZINC000450640341	FG	On-Demand	Anodyne	S1PR5	17	42
COc1cc(NC(=O)CCc2ccc(C(N)=O)cc2)ccc1OC(C)C	ZINC000450640341	FG	On-Demand	Anodyne	ENPP1	68	39
COc1cc(NC(=O)CCc2ccc(C(N)=O)cc2)ccc1OC(C)C	ZINC000450640341	FG	On-Demand	Anodyne	DRTS_TRYCR	46	32
O=C1CC[C@H](CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CCN1	ZINC000450640342	FE	On-Demand	Anodyne	LIPG	29	46
CCSc1cccnc1C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450640343	FF	On-Demand	Anodyne	P2RX7	0	42
O=C1CC[C@H](CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CCN1	ZINC000450640344	FE	On-Demand	Anodyne	LIPG	29	46
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000450640345	GH	On-Demand	Bother	SLC12A5	48	32
O=C1CC[C@@H](CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CCN1	ZINC000450640346	FE	On-Demand	Anodyne	LIPG	29	46
O=C1CC[C@@H](CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CCN1	ZINC000450640347	FE	On-Demand	Anodyne	LIPG	29	46
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccnc3c(Cl)cccc23)C1	ZINC000450640352	FH	On-Demand	Anodyne	CHRNA4	29	49
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	DRD4	63	42
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	DRD3	30	40
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	SIGMAR1	24	40
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	SSTR5	45	35
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	CCR3	41	40
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	BDKRB1	32	40
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	ABCC1	68	37
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	CXCR3	32	42
COC(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1Cl	ZINC000450640355	FF	On-Demand	Anodyne	MCHR1	29	41
COc1ccc(C[C@@H](C)CN(C)C[C@H]2COCCO2)cc1	ZINC000450640356	CE	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(C[C@@H](C)CN(C)C[C@@H]2COCCO2)cc1	ZINC000450640357	CE	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(C[C@H](C)CN(C)C[C@@H]2COCCO2)cc1	ZINC000450640358	CE	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(C[C@H](C)CN(C)C[C@H]2COCCO2)cc1	ZINC000450640359	CE	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(CNC(=O)CCN2CCc3ccsc3C2)c(OC)c1	ZINC000450640360	FF	On-Demand	Anodyne	MTNR1A	44	39
CC(C)[C@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450640370	DI	On-Demand	Anodyne	TRPM8	40	39
CC(C)[C@@H]1CCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450640371	DI	On-Demand	Anodyne	TRPM8	40	39
COc1ccc(-c2nnc(SCC(=O)CC(C)(C)C3CC3)o2)cc1OC	ZINC000450640372	GI	On-Demand	Anodyne	GSK3B	15	42
COc1ccc(-c2nnc(SCC(=O)CC(C)(C)C3CC3)o2)cc1OC	ZINC000450640372	GI	On-Demand	Anodyne	PIK3CG	0	45
CCC(=O)CCCN(C)C[C@@H](C)Cc1ccc(OC)cc1	ZINC000450640378	CH	On-Demand	Anodyne	ACE2	40	35
CCC(=O)CCCN(C)C[C@@H](C)Cc1ccc(OC)cc1	ZINC000450640378	CH	On-Demand	Anodyne	PSMB8	47	34
CCC(=O)CCCN(C)C[C@H](C)Cc1ccc(OC)cc1	ZINC000450640379	CH	On-Demand	Anodyne	ACE2	40	35
CCC(=O)CCCN(C)C[C@H](C)Cc1ccc(OC)cc1	ZINC000450640379	CH	On-Demand	Anodyne	PSMB8	47	34
CCn1nnc(C)c1C(=O)N1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450640384	FH	On-Demand	Anodyne	GRIN2B	39	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450640386	GI	On-Demand	Anodyne	CHRNA4	27	43
CC(C)OC(=O)CCCNC(=O)c1ccc(I)cc1F	ZINC000450640389	GF	On-Demand	Anodyne	MAP2K1	40	34
COc1cc(NC(=O)[C@@]2(OC(C)C)CCOC2)ccc1OC(C)C	ZINC000450640391	EG	On-Demand	Anodyne	ENPP1	47	31
COc1cc(NC(=O)[C@]2(OC(C)C)CCOC2)ccc1OC(C)C	ZINC000450640392	EG	On-Demand	Anodyne	ENPP1	47	31
COc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1OC(C)C	ZINC000450640393	FH	On-Demand	Anodyne	ALK	15	44
COc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1OC(C)C	ZINC000450640393	FH	On-Demand	Anodyne	ENPP1	54	32
COc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1OC(C)C	ZINC000450640393	FH	On-Demand	Anodyne	LIMK2	15	40
COc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1OC(C)C	ZINC000450640394	FH	On-Demand	Anodyne	ALK	15	44
COc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1OC(C)C	ZINC000450640394	FH	On-Demand	Anodyne	ENPP1	54	32
COc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1OC(C)C	ZINC000450640394	FH	On-Demand	Anodyne	LIMK2	15	40
Fc1cccnc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450640397	FF	On-Demand	Anodyne	DRD4	37	43
Fc1cccnc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450640397	FF	On-Demand	Anodyne	ABCC1	56	36
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc3c(F)cccc3o2)C1	ZINC000450640403	EF	On-Demand	Anodyne	CHRNA4	39	49
CC(C)(C)C(=O)Nc1ccc(C(=O)NCc2ccc(C(F)F)cc2)cn1	ZINC000450640413	FH	On-Demand	Anodyne	EPHX2	0	44
COC(=O)[C@H](NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@@H](C)O	ZINC000450640416	GC	On-Demand	Mild	AR	15	40
COC(=O)[C@H](NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@H](C)O	ZINC000450640418	GC	On-Demand	Mild	AR	15	40
COC(=O)[C@H](NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@@H](C)O	ZINC000450640419	GC	On-Demand	Mild	AR	15	40
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3ccc(Cl)cc3n2)C1	ZINC000450640420	FH	On-Demand	Anodyne	CHRNA4	29	47
COC(=O)[C@H](NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@H](C)O	ZINC000450640422	GC	On-Demand	Mild	AR	15	40
CCc1cc(N[C@H]2CC[C@@H](CO)C2)n2ncnc2n1	ZINC000450640434	CD	On-Demand	Anodyne	DHOD	0	46
CCCOc1ccc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)c(OC)c1	ZINC000450640442	GH	On-Demand	Anodyne	OXTR	23	46
CCCOc1ccc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)c(OC)c1	ZINC000450640442	GH	On-Demand	Anodyne	SMO	33	41
CCCOc1ccc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)c(OC)c1	ZINC000450640442	GH	On-Demand	Anodyne	ETHR	61	39
CC(C)[C@@H]1CCc2ccccc2N1C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450640452	FH	On-Demand	Anodyne	ACE	22	45
CC(C)[C@H]1CCc2ccccc2N1C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450640453	FH	On-Demand	Anodyne	ACE	22	45
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	HTR1A	22	57
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	DRD2	35	51
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	DRD1	32	57
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	DRD4	26	51
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	HTR2A	31	54
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	HTR2C	24	57
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	ERG2	23	51
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	HTR7	30	51
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	MC4R	45	37
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	HRH3	26	47
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	SLC18A3	0	52
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640463	DD	On-Demand	Anodyne	CYP2J2	57	42
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	HTR1A	22	57
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	DRD2	35	51
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	DRD1	32	57
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	DRD4	26	51
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	HTR2A	31	54
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	HTR2C	24	57
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	ERG2	23	51
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	HTR7	30	51
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	MC4R	45	37
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	HRH3	26	47
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	SLC18A3	0	52
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450640465	DD	On-Demand	Anodyne	CYP2J2	57	42
c1cncc(CN(Cc2ccco2)Cc2nnc(C3CC3)s2)c1	ZINC000450640483	EH	On-Demand	Anodyne	NR1D1	47	38
CCc1csc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1	ZINC000450640484	DE	On-Demand	Anodyne	CHRNA4	31	48
CC(=O)NC[C@H](CC(=O)N1CCC(c2noc(C3CC3)n2)CC1)CC(C)C	ZINC000450640488	GF	On-Demand	Anodyne	SMO	46	35
CC(=O)NC[C@H](CC(=O)N1CCC(c2noc(C3CC3)n2)CC1)CC(C)C	ZINC000450640488	GF	On-Demand	Anodyne	ETHR	65	49
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450640493	DE	On-Demand	Mild	DRD4	17	45
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450640495	DE	On-Demand	Mild	DRD4	17	45
COc1cc(NC(=O)c2ccsn2)ccc1OC(C)C	ZINC000450640499	CG	On-Demand	Anodyne	GRM4	25	44
COc1cc(NC(=O)c2ccsn2)ccc1OC(C)C	ZINC000450640499	CG	On-Demand	Anodyne	ENPP1	61	36
c1ccc(-c2nsc(N3CC[C@@H]3C3CC3)n2)cc1	ZINC000450640502	CG	On-Demand	Anodyne	FAAH	15	44
c1ccc(-c2nsc(N3CC[C@H]3C3CC3)n2)cc1	ZINC000450640503	CG	On-Demand	Anodyne	FAAH	15	44
OC[C@@H]1CC[C@H](Nc2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450640511	EH	On-Demand	Anodyne	ADRB3	29	50
C[C@@H](CCCCO)Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl	ZINC000450640513	GI	On-Demand	Anodyne	CNR1	27	42
C[C@H](CCCCO)Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl	ZINC000450640515	GI	On-Demand	Anodyne	CNR1	27	42
CCOC(=O)c1sc(Sc2ncncc2Cl)nc1C	ZINC000450640516	DG	On-Demand	Anodyne	DHODH	21	45
COc1ccc(-n2nnnc2SCCCCCC(C)=O)cc1	ZINC000450640524	DF	On-Demand	Anodyne	CELA2A	26	40
COc1ccc(-n2nnnc2SC[C@H](Cc2ccccc2)OC)cc1	ZINC000450640533	FG	On-Demand	Anodyne	CELA2A	28	41
COc1ccc(-n2nnnc2SC[C@@H](Cc2ccccc2)OC)cc1	ZINC000450640534	FG	On-Demand	Anodyne	CELA2A	28	41
COc1cc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)ccc1OC(C)C	ZINC000450640549	EF	On-Demand	Anodyne	ENPP1	53	32
c1nc(N2CC[C@@H]2C2CC2)c2c3c(sc2n1)CCCC3	ZINC000450640562	CH	On-Demand	Anodyne	RBP4	17	41
c1nc(N2CC[C@H]2C2CC2)c2c3c(sc2n1)CCCC3	ZINC000450640565	CH	On-Demand	Anodyne	RBP4	17	41
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450640568	GD	On-Demand	Anodyne	PDE6D	96	42
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450640568	GD	On-Demand	Anodyne	HDAC8	36	41
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450640568	GD	On-Demand	Anodyne	HDAC6	26	41
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450640568	GD	On-Demand	Anodyne	IMDH_CRYPV	31	45
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	F2	42	36
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	FKBP1A	49	48
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	CELA1	41	37
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	ELANE	78	42
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	HLA-DRB3	46	35
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	MMP13	56	48
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	TRY1_BOVIN	53	36
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	CCR4	0	43
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	ADAM17	44	40
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	HLA-A	45	34
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	ITGA4	47	48
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	CAPNS1	21	52
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	MMP2	32	41
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	MMP3	61	47
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	MMP8	40	43
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	CAPN1	24	56
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	MMP9	34	46
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	MMP12	18	40
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	MMP7	77	48
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	MMP1	57	52
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	XIAP	54	38
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	SFRP1	56	34
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	WNT3	54	33
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H](C)O	ZINC000450640572	FB	On-Demand	Anodyne	BRCA1	64	39
COc1cc(NC(=O)c2cc3n(n2)CCC3)ccc1OC(C)C	ZINC000450640575	DF	On-Demand	Anodyne	COLA	44	36
COc1cc(NC(=O)c2cc3n(n2)CCC3)ccc1OC(C)C	ZINC000450640575	DF	On-Demand	Anodyne	CPT1A	42	36
COc1cc(NC(=O)c2cc3n(n2)CCC3)ccc1OC(C)C	ZINC000450640575	DF	On-Demand	Anodyne	CPT2	46	35
COc1cc(NC(=O)c2cc3n(n2)CCC3)ccc1OC(C)C	ZINC000450640575	DF	On-Demand	Anodyne	ENPP1	60	35
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	F2	42	36
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	FKBP1A	49	48
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	CELA1	41	37
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	ELANE	78	42
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	HLA-DRB3	46	35
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	MMP13	56	48
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	TRY1_BOVIN	53	36
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	CCR4	0	43
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	ADAM17	44	40
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	HLA-A	45	34
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	ITGA4	47	48
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	CAPNS1	21	52
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	MMP2	32	41
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	MMP3	61	47
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	MMP8	40	43
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	CAPN1	24	56
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	MMP9	34	46
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	MMP12	18	40
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	MMP7	77	48
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	MMP1	57	52
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	XIAP	54	38
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	SFRP1	56	34
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	WNT3	54	33
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@H](C)O	ZINC000450640576	FB	On-Demand	Anodyne	BRCA1	64	39
c1cncc(CN(Cc2ccco2)C[C@H]2COCCO2)c1	ZINC000450640579	CE	On-Demand	Anodyne	NR1D1	41	32
Cc1n[nH]c(C)c1[C@@H]1COCCN1CCCC(=O)c1ccccc1	ZINC000450640583	EG	On-Demand	Anodyne	CYP2J2	51	38
Cc1n[nH]c(C)c1[C@H]1COCCN1CCCC(=O)c1ccccc1	ZINC000450640584	EG	On-Demand	Anodyne	CYP2J2	51	38
COC(=O)c1ccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450640585	FF	On-Demand	Anodyne	SMO	56	38
COC(=O)c1ccc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450640585	FF	On-Demand	Anodyne	ETHR	83	51
COCCOC[C@@H](O)CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450640586	GF	On-Demand	Anodyne	ABCB1	49	40
COCCOC[C@@H](O)CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450640586	GF	On-Demand	Anodyne	HSP90AB1	41	44
COCCOC[C@H](O)CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450640587	GF	On-Demand	Anodyne	ABCB1	49	40
COCCOC[C@H](O)CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450640587	GF	On-Demand	Anodyne	HSP90AB1	41	44
CCOC(=O)c1cnn(C2CCN(c3ccc4ccc(Cl)cc4n3)CC2)c1	ZINC000450640599	GI	On-Demand	Anodyne	P2RY12	39	40
Cc1cccc2c1C[C@H](C(=O)NCc1cnc(N3CCOCC3)c(F)c1)O2	ZINC000450640602	FD	On-Demand	Anodyne	STAT6	48	33
Cc1cccc2c1C[C@@H](C(=O)NCc1cnc(N3CCOCC3)c(F)c1)O2	ZINC000450640603	FD	On-Demand	Anodyne	STAT6	48	33
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(F)cc34)CC2)c1	ZINC000450640606	GG	On-Demand	Anodyne	PDE3A	46	37
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(F)cc34)CC2)c1	ZINC000450640606	GG	On-Demand	Anodyne	PDGFRB	40	46
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(F)cc34)CC2)c1	ZINC000450640606	GG	On-Demand	Anodyne	PDE3B	68	37
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(F)cc34)CC2)c1	ZINC000450640606	GG	On-Demand	Anodyne	SIRT3	67	36
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(F)cc34)CC2)c1	ZINC000450640606	GG	On-Demand	Anodyne	SIRT2	57	34
CCOC(=O)c1cnn(C2CCN(c3ncnc4cc(F)c(F)cc34)CC2)c1	ZINC000450640606	GG	On-Demand	Anodyne	SIRT1	54	34
CCOC(=O)c1cnn(C2CCN(c3ccnc4cc(Cl)ccc34)CC2)c1	ZINC000450640619	GI	On-Demand	Anodyne	HRP1_PLAFA	74	38
CCOC(=O)c1cnn(C2CCN(c3ccnc4cc(Cl)ccc34)CC2)c1	ZINC000450640619	GI	On-Demand	Anodyne	HNMT	41	32
CCOC(=O)c1cnn(C2CCN(c3ncncc3-c3ccccc3)CC2)c1	ZINC000450640620	GG	On-Demand	Anodyne	P2RY12	41	39
CCOC(=O)c1cnn(C2CCN(c3ncncc3-c3ccccc3)CC2)c1	ZINC000450640620	GG	On-Demand	Anodyne	SLC9A1	15	48
CCOC(=O)c1cnn(C2CCN(c3ncncc3-c3ccccc3)CC2)c1	ZINC000450640620	GG	On-Demand	Anodyne	MAP3K7	49	38
CO[C@@]1(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCOC1	ZINC000450640621	EF	On-Demand	Anodyne	RBP4	55	38
CC[C@H](CC(F)(F)F)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450640639	FF	On-Demand	Anodyne	STAT6	48	32
CC[C@@H](CC(F)(F)F)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450640640	FF	On-Demand	Anodyne	STAT6	48	32
CC(C)(C[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1)C(N)=O	ZINC000450640643	FH	On-Demand	Bother	SERPINE1	24	40
CC(C)(C[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1)C(N)=O	ZINC000450640643	FH	On-Demand	Bother	LIPG	58	38
CC(C)(C[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1)C(N)=O	ZINC000450640644	FH	On-Demand	Bother	SERPINE1	24	40
CC(C)(C[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1)C(N)=O	ZINC000450640644	FH	On-Demand	Bother	LIPG	58	38
CC(C)(C[C@H]1CCCN(c2nc(-c3ccc(F)cc3)cs2)C1)C(N)=O	ZINC000450640647	FI	On-Demand	Anodyne	CCR3	68	31
CC(C)(C[C@@H]1CCCN(c2nc(-c3ccc(F)cc3)cs2)C1)C(N)=O	ZINC000450640648	FI	On-Demand	Anodyne	CCR3	68	31
CC[C@H](CO)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450640669	CD	On-Demand	Anodyne	TIMP3	63	33
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ccnc2cc1F	ZINC000450640670	FH	On-Demand	Anodyne	PDE3A	44	34
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ccnc2cc1F	ZINC000450640670	FH	On-Demand	Anodyne	PDE3B	64	33
COc1cc2c(N3CCC[C@H](CC(C)(C)C(N)=O)C3)ccnc2cc1F	ZINC000450640670	FH	On-Demand	Anodyne	MET	46	32
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ccnc2cc1F	ZINC000450640671	FH	On-Demand	Anodyne	PDE3A	44	34
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ccnc2cc1F	ZINC000450640671	FH	On-Demand	Anodyne	PDE3B	64	33
COc1cc2c(N3CCC[C@@H](CC(C)(C)C(N)=O)C3)ccnc2cc1F	ZINC000450640671	FH	On-Demand	Anodyne	MET	46	32
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccn(CCn2cccn2)n1	ZINC000450640694	GF	On-Demand	Anodyne	MTR1B_CHICK	0	50
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccn(CCn2cccn2)n1	ZINC000450640694	GF	On-Demand	Anodyne	HTR6	42	38
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccn(CCn2cccn2)n1	ZINC000450640694	GF	On-Demand	Anodyne	MTNR1A	25	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccn(CCn2cccn2)n1	ZINC000450640694	GF	On-Demand	Anodyne	EBP	18	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccn(CCn2cccn2)n1	ZINC000450640695	GF	On-Demand	Anodyne	MTR1B_CHICK	0	50
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccn(CCn2cccn2)n1	ZINC000450640695	GF	On-Demand	Anodyne	HTR6	42	38
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccn(CCn2cccn2)n1	ZINC000450640695	GF	On-Demand	Anodyne	MTNR1A	25	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccn(CCn2cccn2)n1	ZINC000450640695	GF	On-Demand	Anodyne	EBP	18	45
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CC2CC(F)(F)C2)C1	ZINC000450640696	DG	On-Demand	Anodyne	PREP	16	40
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CC2CC(F)(F)C2)C1	ZINC000450640697	DG	On-Demand	Anodyne	PREP	16	40
CC(C)(C)OC1CC(Sc2nnc(-c3ccncc3)n2-c2ccccc2)C1	ZINC000450640698	GJ	On-Demand	Anodyne	VCP	64	37
C[C@@H](CN1CCC2(CC1)CCN(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450640705	FE	On-Demand	Anodyne	SIGMAR1	48	43
C[C@@H](CN1CCC2(CC1)CCN(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450640705	FE	On-Demand	Anodyne	NPFFR1	42	32
C(=C\c1ccccc1)\CCN1CCCC[C@@H]1c1nc[nH]n1	ZINC000450640706	CG	On-Demand	Anodyne	CPT1A	43	33
C(=C\c1ccccc1)\CCN1CCCC[C@H]1c1nc[nH]n1	ZINC000450640707	CG	On-Demand	Anodyne	CPT1A	43	33
C[C@H](CN1CCC2(CC1)CCN(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450640708	FE	On-Demand	Anodyne	SIGMAR1	48	43
C[C@H](CN1CCC2(CC1)CCN(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450640708	FE	On-Demand	Anodyne	NPFFR1	42	32
C(=C/c1ccccc1)\CCN1CCCC[C@@H]1c1nc[nH]n1	ZINC000450640709	CG	On-Demand	Anodyne	CPT1A	43	33
C(=C/c1ccccc1)\CCN1CCCC[C@H]1c1nc[nH]n1	ZINC000450640711	CG	On-Demand	Anodyne	CPT1A	43	33
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450640713	DE	On-Demand	Mild	DRD4	17	45
COc1ccccc1COC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450640714	GH	On-Demand	Anodyne	SCN5A	42	32
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450640715	DE	On-Demand	Mild	DRD4	17	45
COC(=O)c1coc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450640722	FF	On-Demand	Anodyne	SIGMAR1	34	42
COC(=O)c1coc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450640722	FF	On-Demand	Anodyne	CCR8	45	37
COC(=O)c1coc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)n1	ZINC000450640722	FF	On-Demand	Anodyne	NPFFR1	56	38
CCC1(CO)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450640754	FE	On-Demand	Anodyne	DRD4	40	31
CCC1(CO)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450640754	FE	On-Demand	Anodyne	HTR7	30	43
CCC1(CO)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450640754	FE	On-Demand	Anodyne	MTNR1A	56	42
CCC1(CO)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450640754	FE	On-Demand	Anodyne	MTNR1B	47	42
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1	ZINC000450640759	FE	On-Demand	Anodyne	DRD2	15	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1	ZINC000450640759	FE	On-Demand	Anodyne	DRD4	40	47
CCS(=O)(=O)c1ccc(CN2CCN(c3ncccc3F)CC2)cc1	ZINC000450640759	FE	On-Demand	Anodyne	ABCC1	62	35
CC(F)(F)c1ccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cn1	ZINC000450640765	GF	On-Demand	Anodyne	BACE2	0	42
CC(F)(F)c1ccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cn1	ZINC000450640765	GF	On-Demand	Anodyne	CALCA	0	44
CC(F)(F)c1ccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)cn1	ZINC000450640765	GF	On-Demand	Anodyne	CARM1	55	34
CC(C)OC(=O)CCCNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450640766	FE	On-Demand	Anodyne	PIK3CD	20	41
CC(C)OC(=O)CCCNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450640766	FE	On-Demand	Anodyne	PIK3CB	34	41
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]3C(C)C)ccc21	ZINC000450640767	EH	On-Demand	Anodyne	PDGFRB	0	44
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]3C(C)C)ccc21	ZINC000450640767	EH	On-Demand	Anodyne	PLK1	61	33
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]3C(C)C)ccc21	ZINC000450640767	EH	On-Demand	Anodyne	HPGD	58	68
Cn1c(C#N)ccc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450640772	FD	On-Demand	Mild	RHOA	0	40
Cn1c(C#N)ccc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450640772	FD	On-Demand	Mild	KCNK3	49	32
CC(C)(C)C(=O)CCCC(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450640776	EF	On-Demand	Anodyne	P2RX7	15	40
c1ccc(CCn2ccc(CN3CC[C@@H](C4CC4)C3)n2)cc1	ZINC000450640779	CG	On-Demand	Anodyne	SIGMAR1	43	40
c1ccc(CCn2ccc(CN3CC[C@H](C4CC4)C3)n2)cc1	ZINC000450640780	CG	On-Demand	Anodyne	SIGMAR1	43	40
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]3C(C)C)ccc21	ZINC000450640781	EH	On-Demand	Anodyne	PDGFRB	0	44
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]3C(C)C)ccc21	ZINC000450640781	EH	On-Demand	Anodyne	PLK1	61	33
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]3C(C)C)ccc21	ZINC000450640781	EH	On-Demand	Anodyne	HPGD	58	68
C[C@H]1CN(C[C@H](O)Cc2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640782	ED	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@H]1CN(C[C@H](O)Cc2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640782	ED	On-Demand	Anodyne	SLC18A3	41	40
C[C@H]1CN(C[C@H](O)Cc2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640784	ED	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@H]1CN(C[C@H](O)Cc2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640784	ED	On-Demand	Anodyne	SLC18A3	41	40
C=CCCC[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450640785	CF	On-Demand	Mild	ENPP2	19	40
C=CCCC[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450640785	CF	On-Demand	Mild	HPGDS	15	42
C=CCCC[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450640788	CF	On-Demand	Mild	ENPP2	19	40
C=CCCC[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450640788	CF	On-Demand	Mild	HPGDS	15	42
Cn1c(C#N)ccc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450640792	FD	On-Demand	Mild	RHOA	0	40
Cn1c(C#N)ccc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450640792	FD	On-Demand	Mild	KCNK3	49	32
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450640793	GF	On-Demand	Anodyne	MTR1B_CHICK	0	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450640793	GF	On-Demand	Anodyne	HTR6	23	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450640793	GF	On-Demand	Anodyne	EBP	16	40
COc1cc(CN2CCN(c3ncccc3F)CC2)ccc1Cl	ZINC000450640794	EG	On-Demand	Anodyne	DRD2	33	46
COc1cc(CN2CCN(c3ncccc3F)CC2)ccc1Cl	ZINC000450640794	EG	On-Demand	Anodyne	DRD1	31	50
COc1cc(CN2CCN(c3ncccc3F)CC2)ccc1Cl	ZINC000450640794	EG	On-Demand	Anodyne	DRD3	37	46
COc1cc(CN2CCN(c3ncccc3F)CC2)ccc1Cl	ZINC000450640794	EG	On-Demand	Anodyne	SSTR5	65	41
COc1cc(CN2CCN(c3ncccc3F)CC2)ccc1Cl	ZINC000450640794	EG	On-Demand	Anodyne	UTS2R	23	44
COc1cc(CN2CCN(c3ncccc3F)CC2)ccc1Cl	ZINC000450640794	EG	On-Demand	Anodyne	ABCC1	59	35
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc(-c3ccccc3F)cs2)C1	ZINC000450640795	FH	On-Demand	Anodyne	CHRNA4	28	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450640796	GF	On-Demand	Anodyne	MTR1B_CHICK	0	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450640796	GF	On-Demand	Anodyne	HTR6	23	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450640796	GF	On-Demand	Anodyne	EBP	16	40
C[C@@H](Sc1ncnc2sc3c(c12)CCC3)C(=O)Nc1nccs1	ZINC000450640797	FH	On-Demand	Anodyne	MAP1	47	33
O[C@H](Cc1ccccc1)CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450640801	FH	On-Demand	Anodyne	VACHT_TETCF	0	47
O[C@H](Cc1ccccc1)CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450640801	FH	On-Demand	Anodyne	SIGMAR1	49	47
O[C@H](Cc1ccccc1)CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450640801	FH	On-Demand	Anodyne	SLC18A3	46	47
O[C@H](Cc1ccccc1)CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450640801	FH	On-Demand	Anodyne	NPFFR1	43	33
C[C@H](Sc1ncnc2sc3c(c12)CCC3)C(=O)Nc1nccs1	ZINC000450640802	FH	On-Demand	Anodyne	MAP1	47	33
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450640813	GF	On-Demand	Anodyne	SSTR2	44	34
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450640813	GF	On-Demand	Anodyne	GHRHR	53	34
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450640813	GF	On-Demand	Anodyne	P2RY12	116	37
Cc1csc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450640815	FF	On-Demand	Anodyne	CDK4	22	44
Cc1csc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c1	ZINC000450640815	FF	On-Demand	Anodyne	CALCA	0	40
COc1cc(CC(=O)NCCCC(=O)OC(C)C)ccc1Cl	ZINC000450640817	EF	On-Demand	Anodyne	TRPV1	35	49
COc1cc(CC(=O)NCCCC(=O)OC(C)C)ccc1Cl	ZINC000450640817	EF	On-Demand	Anodyne	CAN2	0	49
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@]1(C)CC=CCC1	ZINC000450640818	DG	On-Demand	Anodyne	SDH1	0	42
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@]1(C)CC=CCC1	ZINC000450640818	DG	On-Demand	Anodyne	TIMP3	44	32
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@]1(C)CC=CCC1	ZINC000450640820	DG	On-Demand	Anodyne	SDH1	0	42
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@]1(C)CC=CCC1	ZINC000450640820	DG	On-Demand	Anodyne	TIMP3	44	32
CCOC(=O)c1ccc(CN2CCC(N3CCN(C(C)C)CC3)CC2)nc1	ZINC000450640821	FE	On-Demand	Anodyne	HRH3	24	53
CCOC(=O)c1ccc(CN2CCC(N3CCN(C(C)C)CC3)CC2)nc1	ZINC000450640821	FE	On-Demand	Anodyne	SSTR5	42	35
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@]1(C)CC=CCC1	ZINC000450640822	DG	On-Demand	Anodyne	SDH1	0	42
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@]1(C)CC=CCC1	ZINC000450640822	DG	On-Demand	Anodyne	TIMP3	44	32
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@]1(C)CC=CCC1	ZINC000450640824	DG	On-Demand	Anodyne	SDH1	0	42
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@]1(C)CC=CCC1	ZINC000450640824	DG	On-Demand	Anodyne	TIMP3	44	32
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450640828	GF	On-Demand	Anodyne	SSTR2	44	34
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450640828	GF	On-Demand	Anodyne	GHRHR	53	34
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450640828	GF	On-Demand	Anodyne	P2RY12	116	37
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450640830	GF	On-Demand	Anodyne	SSTR2	44	34
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450640830	GF	On-Demand	Anodyne	GHRHR	53	34
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450640830	GF	On-Demand	Anodyne	P2RY12	116	37
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450640832	GF	On-Demand	Anodyne	SSTR2	44	34
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450640832	GF	On-Demand	Anodyne	GHRHR	53	34
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450640832	GF	On-Demand	Anodyne	P2RY12	116	37
Cc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc(C(C)C)n1	ZINC000450640835	DF	On-Demand	Anodyne	CHRNA4	29	45
COc1cccc(-n2cc(C(=O)N3CCN([C@@H](C)c4ccsc4)CC3)nn2)c1	ZINC000450640837	GF	On-Demand	Anodyne	CCKAR	17	40
Cc1nc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)sc1C	ZINC000450640839	DF	On-Demand	Anodyne	CHRNA4	30	48
COc1cccc(-n2cc(C(=O)N3CCN([C@H](C)c4ccsc4)CC3)nn2)c1	ZINC000450640840	GF	On-Demand	Anodyne	CCKAR	17	40
COc1ccc(CNC(=O)CCN2CCC[C@@]2(C)CCCO)c(OC)c1	ZINC000450640848	FE	On-Demand	Anodyne	HTR7	21	40
COc1ccc(CNC(=O)CCN2CCC[C@]2(C)CCCO)c(OC)c1	ZINC000450640850	FE	On-Demand	Anodyne	HTR7	21	40
Cc1nc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)ncc1[N+](=O)[O-]	ZINC000450640851	GH	On-Demand	Bother	SIGMAR1	26	41
Cc1nc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)ncc1[N+](=O)[O-]	ZINC000450640857	GH	On-Demand	Bother	SIGMAR1	26	41
CCOC(=O)c1cc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)[nH]c1C	ZINC000450640859	FE	On-Demand	Anodyne	P2RX7	24	43
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	DRD2	31	41
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	DRD1	16	45
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	DRD4	0	49
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	HTR2A	22	46
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	HTR2C	21	49
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	ERG2	20	43
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	SLC18A3	0	40
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	MCHR1	19	42
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640864	FH	On-Demand	Mild	CYP2J2	49	34
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	DRD2	31	41
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	DRD1	16	45
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	DRD4	0	49
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	HTR2A	22	46
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	HTR2C	21	49
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	ERG2	20	43
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	SLC18A3	0	40
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	MCHR1	19	42
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)c1	ZINC000450640866	FH	On-Demand	Mild	CYP2J2	49	34
c1cncc(CN(Cc2ccco2)C[C@@H]2COCCO2)c1	ZINC000450640871	CE	On-Demand	Anodyne	NR1D1	41	32
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)on1	ZINC000450640899	GD	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)on1	ZINC000450640899	GD	On-Demand	Anodyne	RHOA	0	41
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)on1	ZINC000450640899	GD	On-Demand	Anodyne	KCNK3	55	33
COC(=O)c1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450640902	FG	On-Demand	Anodyne	PDGFRB	22	42
COC(=O)c1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450640902	FG	On-Demand	Anodyne	ACR	27	40
COC(=O)c1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450640902	FG	On-Demand	Anodyne	CPT1B	40	37
COC(=O)c1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450640902	FG	On-Demand	Anodyne	ENPP1	67	39
COC(=O)c1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450640902	FG	On-Demand	Anodyne	IMDH_CRYPV	19	40
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)on1	ZINC000450640903	GD	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)on1	ZINC000450640903	GD	On-Demand	Anodyne	RHOA	0	41
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)on1	ZINC000450640903	GD	On-Demand	Anodyne	KCNK3	55	33
Cc1cccc2c1O[C@H](C(=O)Nc1cccc(C(=O)N3CCC[C@H](CO)C3)c1)C2	ZINC000450640941	GF	On-Demand	Anodyne	RHOA	0	40
CC(C)OC(C)(C)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450640944	DE	On-Demand	Anodyne	P2RX7	15	43
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640953	FF	On-Demand	Anodyne	DRD2	32	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640953	FF	On-Demand	Anodyne	DRD4	24	55
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640953	FF	On-Demand	Anodyne	HTR2A	33	56
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640953	FF	On-Demand	Anodyne	HTR2C	29	57
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640953	FF	On-Demand	Anodyne	SLC18A3	27	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640953	FF	On-Demand	Anodyne	HTR3B	0	51
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640953	FF	On-Demand	Anodyne	CYP2J2	57	41
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640955	FF	On-Demand	Anodyne	DRD2	32	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640955	FF	On-Demand	Anodyne	DRD4	24	55
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640955	FF	On-Demand	Anodyne	HTR2A	33	56
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640955	FF	On-Demand	Anodyne	HTR2C	29	57
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640955	FF	On-Demand	Anodyne	SLC18A3	27	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640955	FF	On-Demand	Anodyne	HTR3B	0	51
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640955	FF	On-Demand	Anodyne	CYP2J2	57	41
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640957	FF	On-Demand	Anodyne	DRD2	32	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640957	FF	On-Demand	Anodyne	DRD4	24	55
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640957	FF	On-Demand	Anodyne	HTR2A	33	56
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640957	FF	On-Demand	Anodyne	HTR2C	29	57
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640957	FF	On-Demand	Anodyne	SLC18A3	27	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640957	FF	On-Demand	Anodyne	HTR3B	0	51
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450640957	FF	On-Demand	Anodyne	CYP2J2	57	41
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640959	FF	On-Demand	Anodyne	DRD2	32	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640959	FF	On-Demand	Anodyne	DRD4	24	55
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640959	FF	On-Demand	Anodyne	HTR2A	33	56
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640959	FF	On-Demand	Anodyne	HTR2C	29	57
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640959	FF	On-Demand	Anodyne	SLC18A3	27	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640959	FF	On-Demand	Anodyne	HTR3B	0	51
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[C@H]1N1CCN(C)CC1	ZINC000450640959	FF	On-Demand	Anodyne	CYP2J2	57	41
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450640960	GH	On-Demand	Anodyne	SMO	42	35
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450640960	GH	On-Demand	Anodyne	ETHR	77	48
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCN(c2ccccc2)C(=O)C1	ZINC000450640961	EF	On-Demand	Anodyne	P2RX7	22	49
Clc1ccc(CCN(Cc2ccccn2)C2CC2)cc1	ZINC000450640967	CH	On-Demand	Anodyne	C5AR1	23	41
O=C(NCc1ccc(OCc2ccccc2F)cc1)C1(CF)CCOCC1	ZINC000450640978	GH	On-Demand	Anodyne	ADAM17	35	46
O=C(c1ccc(N[C@H]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450640982	ED	On-Demand	Bother	L3MBTL1	0	41
COc1cc(NC(=O)c2cccc3c2O[C@H](C)C3)ccc1OC(C)C	ZINC000450640987	EI	On-Demand	Anodyne	MTTP	62	38
COc1cc(NC(=O)c2cccc3c2O[C@H](C)C3)ccc1OC(C)C	ZINC000450640987	EI	On-Demand	Anodyne	ENPP1	49	32
COc1cc(NC(=O)c2cccc3c2O[C@H](C)C3)ccc1OC(C)C	ZINC000450640987	EI	On-Demand	Anodyne	KCNK3	56	43
COc1cc(NC(=O)c2cccc3c2O[C@H](C)C3)ccc1OC(C)C	ZINC000450640987	EI	On-Demand	Anodyne	KCNK9	56	43
COc1cc(NC(=O)c2cccc3c2O[C@@H](C)C3)ccc1OC(C)C	ZINC000450640989	EI	On-Demand	Anodyne	MTTP	62	38
COc1cc(NC(=O)c2cccc3c2O[C@@H](C)C3)ccc1OC(C)C	ZINC000450640989	EI	On-Demand	Anodyne	ENPP1	49	32
COc1cc(NC(=O)c2cccc3c2O[C@@H](C)C3)ccc1OC(C)C	ZINC000450640989	EI	On-Demand	Anodyne	KCNK3	56	43
COc1cc(NC(=O)c2cccc3c2O[C@@H](C)C3)ccc1OC(C)C	ZINC000450640989	EI	On-Demand	Anodyne	KCNK9	56	43
CC(C)[C@@H]1CCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450640994	EF	On-Demand	Mild	PGR	22	41
Cc1cccc2c1O[C@@H](C(=O)Nc1cccc(C(=O)N3CCC[C@H](CO)C3)c1)C2	ZINC000450640995	GF	On-Demand	Anodyne	RHOA	0	40
CC(C)[C@@H]1CCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450640997	EF	On-Demand	Mild	PGR	22	41
Cc1cccc2c1O[C@@H](C(=O)Nc1cccc(C(=O)N3CCC[C@@H](CO)C3)c1)C2	ZINC000450640998	GF	On-Demand	Anodyne	RHOA	0	40
CC(C)[C@H]1CCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450640999	EF	On-Demand	Mild	PGR	22	41
Cc1cccc2c1O[C@H](C(=O)Nc1cccc(C(=O)N3CCC[C@@H](CO)C3)c1)C2	ZINC000450641000	GF	On-Demand	Anodyne	RHOA	0	40
CC(C)[C@H]1CCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450641002	EF	On-Demand	Mild	PGR	22	41
CC(C)OC(=O)CCCNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450641005	CE	On-Demand	Anodyne	EPHX2	0	44
CC(C)OC(=O)CCCNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450641008	CE	On-Demand	Anodyne	EPHX2	0	44
CC(C)OC(=O)CCCNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450641011	CE	On-Demand	Anodyne	EPHX2	0	44
CC(C)OC(=O)CCCNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450641013	CE	On-Demand	Anodyne	EPHX2	0	44
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nnc(C(C)C)o2)CC1	ZINC000450641016	FG	On-Demand	Anodyne	KCNA3	16	40
COc1ccc(C[C@H](C)CN(C)CC[C@H](C)O)cc1	ZINC000450641045	CF	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(C[C@@H](C)CN(C)CC[C@H](C)O)cc1	ZINC000450641047	CF	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(C[C@H](C)CN(C)CC[C@@H](C)O)cc1	ZINC000450641048	CF	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(C[C@@H](C)CN(C)CC[C@@H](C)O)cc1	ZINC000450641050	CF	On-Demand	Anodyne	PSMB8	44	31
COc1cccc(OCCC(=O)N[C@H](C)c2cncc(F)c2)c1	ZINC000450641057	DF	On-Demand	Anodyne	ACACA	44	39
COc1cccc(OCCC(=O)N[C@H](C)c2cncc(F)c2)c1	ZINC000450641057	DF	On-Demand	Anodyne	ACACB	23	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncccc2C(=O)NC)CC1	ZINC000450641065	GE	On-Demand	Anodyne	P2RY12	37	41
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncccc2C(=O)NC)CC1	ZINC000450641065	GE	On-Demand	Anodyne	HCN1	52	32
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ncccc2C(=O)NC)CC1	ZINC000450641065	GE	On-Demand	Anodyne	HCN4	41	32
COc1cccc(OCCC(=O)N[C@@H](C)c2cncc(F)c2)c1	ZINC000450641073	DF	On-Demand	Anodyne	ACACA	44	39
COc1cccc(OCCC(=O)N[C@@H](C)c2cncc(F)c2)c1	ZINC000450641073	DF	On-Demand	Anodyne	ACACB	23	40
COc1cc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)ccc1OC(C)C	ZINC000450641086	DH	On-Demand	Anodyne	ENPP1	69	33
COc1cc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)ccc1OC(C)C	ZINC000450641086	DH	On-Demand	Anodyne	KCNK3	45	41
COc1cc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)ccc1OC(C)C	ZINC000450641086	DH	On-Demand	Anodyne	KCNK9	43	41
COc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)ccc1OC(C)C	ZINC000450641102	GI	On-Demand	Anodyne	COLA	51	36
COc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)ccc1OC(C)C	ZINC000450641102	GI	On-Demand	Anodyne	CPT1A	49	36
COc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)ccc1OC(C)C	ZINC000450641102	GI	On-Demand	Anodyne	CPT2	45	35
COc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)ccc1OC(C)C	ZINC000450641102	GI	On-Demand	Anodyne	GCK	28	43
COc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)ccc1OC(C)C	ZINC000450641102	GI	On-Demand	Anodyne	ENPP1	72	36
COc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)ccc1OC(C)C	ZINC000450641102	GI	On-Demand	Anodyne	KCNK3	44	35
COc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)ccc1OC(C)C	ZINC000450641102	GI	On-Demand	Anodyne	KCNK9	42	35
COc1ccc([C@H](CO)N(C)C(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450641111	EE	On-Demand	Anodyne	DXR	23	41
COc1ccc([C@@H](CO)N(C)C(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450641112	EE	On-Demand	Anodyne	DXR	23	41
C[C@@H](O)CCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450641116	EF	On-Demand	Anodyne	OPRK1	35	43
C[C@@H](O)CCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450641116	EF	On-Demand	Anodyne	SIGMAR1	0	47
CCc1ccc(C2=CCN(CC[C@H](C)O)CC2)cc1	ZINC000450641120	CG	On-Demand	Anodyne	QDPR	0	42
C[C@H](O)CCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450641121	EF	On-Demand	Anodyne	OPRK1	35	43
C[C@H](O)CCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450641121	EF	On-Demand	Anodyne	SIGMAR1	0	47
CCc1ccc(C2=CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450641122	CG	On-Demand	Anodyne	QDPR	0	42
CCc1nc2ccccc2n1C1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450641125	EF	On-Demand	Anodyne	OPRL1	40	38
CCc1nc2ccccc2n1C1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450641126	EF	On-Demand	Anodyne	OPRL1	40	38
COCCOC[C@@H](O)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450641129	FD	On-Demand	Anodyne	PDGFRB	43	38
COCCOC[C@@H](O)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450641129	FD	On-Demand	Anodyne	ACOX1	53	38
COCCOC[C@@H](O)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450641129	FD	On-Demand	Anodyne	HSP90AB1	37	44
Cc1ccc(F)c(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450641137	EG	On-Demand	Anodyne	SMO	49	36
Cc1ccc(F)c(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450641137	EG	On-Demand	Anodyne	ETHR	80	51
CCCOc1cccc(CN2CCSC[C@@H]2CO)c1	ZINC000450641139	CE	On-Demand	Anodyne	HRH2	22	41
CCCOc1cccc(CN2CCSC[C@H]2CO)c1	ZINC000450641140	CE	On-Demand	Anodyne	HRH2	22	41
COCCOC[C@H](O)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450641148	FD	On-Demand	Anodyne	PDGFRB	43	38
COCCOC[C@H](O)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450641148	FD	On-Demand	Anodyne	ACOX1	53	38
COCCOC[C@H](O)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450641148	FD	On-Demand	Anodyne	HSP90AB1	37	44
COc1nccc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450641149	EE	On-Demand	Anodyne	P2RY12	16	42
COc1nccc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450641149	EE	On-Demand	Anodyne	PDGFRB	50	38
COc1nccc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450641149	EE	On-Demand	Anodyne	FAAH	18	50
COc1cc(NC(=O)[C@H](C)OCCc2ccccc2)ccc1OC(C)C	ZINC000450641151	FI	On-Demand	Anodyne	TSHR	53	33
COc1cc(NC(=O)[C@H](C)OCCc2ccccc2)ccc1OC(C)C	ZINC000450641151	FI	On-Demand	Anodyne	ENPP1	71	34
COc1cc(NC(=O)[C@@H](C)OCCc2ccccc2)ccc1OC(C)C	ZINC000450641153	FI	On-Demand	Anodyne	TSHR	53	33
COc1cc(NC(=O)[C@@H](C)OCCc2ccccc2)ccc1OC(C)C	ZINC000450641153	FI	On-Demand	Anodyne	ENPP1	71	34
CCc1nc2ccccc2n1C1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450641171	FG	On-Demand	Anodyne	PLD1	41	30
CCc1nc2ccccc2n1C1CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450641171	FG	On-Demand	Anodyne	FPR2	32	47
c1ccc2sc(N3CC[C@@H]3C3CC3)nc2c1	ZINC000450641172	BG	On-Demand	Anodyne	SLC11A2	20	40
c1ccc2sc(N3CC[C@H]3C3CC3)nc2c1	ZINC000450641177	BG	On-Demand	Anodyne	SLC11A2	20	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1(O)CCC1	ZINC000450641186	FI	On-Demand	Anodyne	LDLR	0	43
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1(O)CCC1	ZINC000450641186	FI	On-Demand	Anodyne	BTK	19	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1(O)CCC1	ZINC000450641186	FI	On-Demand	Anodyne	TAAR1	23	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1(O)CCC1	ZINC000450641186	FI	On-Demand	Anodyne	KCNK3	93	49
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CC1(O)CCC1	ZINC000450641186	FI	On-Demand	Anodyne	KCNK9	50	49
CCCc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)no1	ZINC000450641188	DH	On-Demand	Anodyne	GRM4	17	42
CCCc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)no1	ZINC000450641188	DH	On-Demand	Anodyne	ENPP1	61	37
CCCOc1cccc(CN2CCC(c3cc(C)[nH]n3)CC2)c1	ZINC000450641190	DH	On-Demand	Anodyne	DRD2	15	48
CCCOc1cccc(CN2CCC(c3cc(C)[nH]n3)CC2)c1	ZINC000450641190	DH	On-Demand	Anodyne	DRD4	25	48
CCCOc1cccc(CN2CCC(c3cc(C)[nH]n3)CC2)c1	ZINC000450641190	DH	On-Demand	Anodyne	HRH2	35	43
CCCOc1cccc(CN2CCC(c3cc(C)[nH]n3)CC2)c1	ZINC000450641190	DH	On-Demand	Anodyne	SIGMAR1	17	43
CNS(=O)(=O)c1ccc(N2CCC[C@H](CC(C)(C)C(N)=O)C2)nc1	ZINC000450641196	FD	On-Demand	Anodyne	GCKR	21	41
CNS(=O)(=O)c1ccc(N2CCC[C@@H](CC(C)(C)C(N)=O)C2)nc1	ZINC000450641197	FD	On-Demand	Anodyne	GCKR	21	41
CCOC(=O)c1cnn(C2CCN(c3c(C#N)cnc4ccc(C)cc34)CC2)c1	ZINC000450641209	GH	On-Demand	Mild	P2RY12	53	38
CC(C)c1ccc(C[C@@H]2CCN(C(=O)c3ccn(CCn4cccn4)n3)C2)cc1	ZINC000450641210	GH	On-Demand	Anodyne	GRIN2B	33	42
CC(C)c1ccc(C[C@H]2CCN(C(=O)c3ccn(CCn4cccn4)n3)C2)cc1	ZINC000450641211	GH	On-Demand	Anodyne	GRIN2B	33	42
C/C=C\COc1cccc(CC(=O)NCc2cnc(N3CCOCC3)c(F)c2)c1	ZINC000450641216	GF	On-Demand	Anodyne	STAT6	55	35
CN(CCCn1ccnc1)C1CC(OC(C)(C)C)C1	ZINC000450641223	CF	On-Demand	Anodyne	TBXAS1	30	42
CC(C)(C[C@@H]1CCCN(c2ncnc3c2cnn3-c2ccccc2)C1)C(N)=O	ZINC000450641224	GF	On-Demand	Anodyne	GPR119	18	41
CC(C)(C[C@H]1CCCN(c2ncnc3c2cnn3-c2ccccc2)C1)C(N)=O	ZINC000450641225	GF	On-Demand	Anodyne	GPR119	18	41
CCC[C@@H](NC(=O)c1cc(C#N)[nH]c1C)C(=O)OC(C)(C)C	ZINC000450641226	DE	On-Demand	Mild	PAPA1_CARPA	41	40
CCC[C@H](NC(=O)c1cc(C#N)[nH]c1C)C(=O)OC(C)(C)C	ZINC000450641227	DE	On-Demand	Mild	PAPA1_CARPA	41	40
CCOC(=O)c1cnn(C2CCN(c3ccc4c(Cl)cccc4n3)CC2)c1	ZINC000450641228	GI	On-Demand	Anodyne	P2RY12	41	40
COc1cccc(OCCC(=O)NCC2([C@@H](C)CCO)CCC2)c1	ZINC000450641229	EF	On-Demand	Anodyne	MTNR1A	34	40
COc1cccc(OCCC(=O)NCC2([C@@H](C)CCO)CCC2)c1	ZINC000450641229	EF	On-Demand	Anodyne	MTNR1B	34	40
COc1cccc(OCCC(=O)NCC2([C@H](C)CCO)CCC2)c1	ZINC000450641230	EF	On-Demand	Anodyne	MTNR1A	34	40
COc1cccc(OCCC(=O)NCC2([C@H](C)CCO)CCC2)c1	ZINC000450641230	EF	On-Demand	Anodyne	MTNR1B	34	40
CCCC[C@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450641239	EF	On-Demand	Anodyne	CTSK	52	40
CCCC[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450641240	EF	On-Demand	Anodyne	CTSK	52	40
CCCC[C@@H](NC(=O)[C@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450641241	EF	On-Demand	Anodyne	CTSK	52	40
CCCC[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)C(=O)OC(C)(C)C	ZINC000450641242	EF	On-Demand	Anodyne	CTSK	52	40
COC1(CSc2nnc(-c3c[nH]c4ccccc34)o2)CCC1	ZINC000450641244	DH	On-Demand	Anodyne	ALOX15	49	36
CCC[C@@H](CC(C)C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450641251	FG	On-Demand	Anodyne	STAT6	43	31
CCC[C@H](CC(C)C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450641252	FG	On-Demand	Anodyne	STAT6	43	31
CO[C@@]1(CNC(=O)c2cc(Cl)c(F)cc2Br)CCOC1	ZINC000450641255	FF	On-Demand	Anodyne	SLC6A9	38	40
CO[C@]1(CNC(=O)c2cc(Cl)c(F)cc2Br)CCOC1	ZINC000450641256	FF	On-Demand	Anodyne	SLC6A9	38	40
CC[C@@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450641257	EG	On-Demand	Anodyne	CAPN1	64	40
CC[C@@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450641257	EG	On-Demand	Anodyne	CAPN2	100	40
CC[C@@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450641257	EG	On-Demand	Anodyne	NPR	50	35
CC[C@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450641258	EG	On-Demand	Anodyne	CAPN1	64	40
CC[C@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450641258	EG	On-Demand	Anodyne	CAPN2	100	40
CC[C@H](CC(C)C)C(=O)NCCc1nnc(-c2ccccc2)n1C	ZINC000450641258	EG	On-Demand	Anodyne	NPR	50	35
COc1cc(CC(=O)NCCc2nnc(-c3ccccc3)n2C)ccc1Cl	ZINC000450641261	GG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)NCCc2nnc(-c3ccccc3)n2C)ccc1Cl	ZINC000450641261	GG	On-Demand	Anodyne	P2RX7	24	41
COc1cc(CC(=O)NCCc2nnc(-c3ccccc3)n2C)ccc1Cl	ZINC000450641261	GG	On-Demand	Anodyne	NCE103	25	50
COc1cc(CC(=O)NCCc2nnc(-c3ccccc3)n2C)ccc1Cl	ZINC000450641261	GG	On-Demand	Anodyne	P96878_MYCTU	20	50
COc1cc(CC(=O)NCCc2nnc(-c3ccccc3)n2C)ccc1Cl	ZINC000450641261	GG	On-Demand	Anodyne	CAN2	0	50
COc1cc(CC(=O)NCCc2nnc(-c3ccccc3)n2C)ccc1Cl	ZINC000450641261	GG	On-Demand	Anodyne	RPA1	41	32
CC(C)(C[C@H]1CCCN(c2nccc(N[C@H]3CCCOC3)n2)C1)C(N)=O	ZINC000450641262	FD	On-Demand	Anodyne	PRKD1	48	35
CC(C)(C[C@@H]1CCCN(c2nccc(N[C@H]3CCCOC3)n2)C1)C(N)=O	ZINC000450641263	FD	On-Demand	Anodyne	PRKD1	48	35
CC(C)(C[C@H]1CCCN(c2nccc(N[C@@H]3CCCOC3)n2)C1)C(N)=O	ZINC000450641264	FD	On-Demand	Anodyne	PRKD1	48	35
CC(C)(C[C@@H]1CCCN(c2nccc(N[C@@H]3CCCOC3)n2)C1)C(N)=O	ZINC000450641265	FD	On-Demand	Anodyne	PRKD1	48	35
CCc1cccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)n1	ZINC000450641266	ED	On-Demand	Anodyne	PIK3CA	43	38
CCc1cccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)n1	ZINC000450641266	ED	On-Demand	Anodyne	SCN10A	22	44
CCc1cccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)n1	ZINC000450641266	ED	On-Demand	Anodyne	STAT6	58	37
CC[S@](=O)CC(=O)N[C@@H]1c2ccccc2CCC[C@@H]1C	ZINC000450641277	CF	On-Demand	Anodyne	BIRC2	40	35
CC[S@](=O)CC(=O)N[C@H]1c2ccccc2CCC[C@@H]1C	ZINC000450641278	CF	On-Demand	Anodyne	BIRC2	40	35
CC[S@](=O)CC(=O)N[C@@H]1c2ccccc2CCC[C@H]1C	ZINC000450641279	CF	On-Demand	Anodyne	BIRC2	40	35
CC[S@](=O)CC(=O)N[C@H]1c2ccccc2CCC[C@H]1C	ZINC000450641280	CF	On-Demand	Anodyne	BIRC2	40	35
CCCC[C@H](NC(=O)C1CC(C)(O)C1)C(=O)OC(C)(C)C	ZINC000450641285	CE	On-Demand	Anodyne	CTSK	0	47
CCCC[C@@H](NC(=O)C1CC(C)(O)C1)C(=O)OC(C)(C)C	ZINC000450641286	CE	On-Demand	Anodyne	CTSK	0	47
O=C(NCc1cnc(N2CCOCC2)c(F)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450641292	ED	On-Demand	Anodyne	STAT6	45	33
C[C@@H]1CC[C@@H](C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)C[C@H]1C	ZINC000450641300	FF	On-Demand	Anodyne	CDK4	22	43
C[C@H]1C[C@H](C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CC[C@H]1C	ZINC000450641301	FF	On-Demand	Anodyne	CDK4	22	43
C[C@@H]1CC[C@H](C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)C[C@H]1C	ZINC000450641302	FF	On-Demand	Anodyne	CDK4	22	43
C[C@H]1C[C@@H](C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CC[C@H]1C	ZINC000450641303	FF	On-Demand	Anodyne	CDK4	22	43
CC(C)c1ccc(CC2CCN(C(=O)c3cc4n(n3)CCC4)CC2)cc1	ZINC000450641315	FI	On-Demand	Anodyne	CHRM2	16	43
CC(C)c1ccc(CC2CCN(C(=O)c3cc4n(n3)CCC4)CC2)cc1	ZINC000450641315	FI	On-Demand	Anodyne	GRIN2B	54	40
CC(C)c1ccc(CC2CCN(C(=O)c3cc4n(n3)CCC4)CC2)cc1	ZINC000450641315	FI	On-Demand	Anodyne	CCR3	17	42
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)cc2)CC1	ZINC000450641317	FH	On-Demand	Mild	KCNA3	0	43
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)cc2)CC1	ZINC000450641317	FH	On-Demand	Mild	CTRB_BOVIN	50	37
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(C#N)cc2)CC1	ZINC000450641317	FH	On-Demand	Mild	SLC12A5	37	42
COc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1OC	ZINC000450641319	EG	On-Demand	Anodyne	GSK3B	0	45
COc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1OC	ZINC000450641319	EG	On-Demand	Anodyne	GSK3A	35	41
COc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1OC	ZINC000450641320	EG	On-Demand	Anodyne	GSK3B	0	45
COc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1OC	ZINC000450641320	EG	On-Demand	Anodyne	GSK3A	35	41
COc1ccc(CNC(=O)CCN2C[C@H](SC)[C@H](N(C)C)C2)c(OC)c1	ZINC000450641321	GD	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(CNC(=O)CCN2C[C@H](N(C)C)[C@H](SC)C2)c(OC)c1	ZINC000450641322	GD	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(CNC(=O)CCN2C[C@@H](SC)[C@H](N(C)C)C2)c(OC)c1	ZINC000450641323	GD	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(CNC(=O)CCN2C[C@H](SC)[C@@H](N(C)C)C2)c(OC)c1	ZINC000450641324	GD	On-Demand	Anodyne	MTNR1A	41	35
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000450641325	FF	On-Demand	Bother	CHRNA4	28	48
COC(=O)c1coc(CN2CCc3ccc(Cl)cc3C2)n1	ZINC000450641328	DF	On-Demand	Anodyne	NOD2	41	38
COc1ccc(OC(F)(F)F)c(C(=O)NCCCC(=O)OC(C)C)c1	ZINC000450641331	FG	On-Demand	Anodyne	TRPV1	0	40
Cc1n[nH]c(C)c1[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450641340	DI	On-Demand	Anodyne	KCNH2	0	46
Cc1n[nH]c(C)c1[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450641340	DI	On-Demand	Anodyne	HRH3	38	46
Cc1n[nH]c(C)c1[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450641341	DI	On-Demand	Anodyne	KCNH2	0	46
Cc1n[nH]c(C)c1[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450641341	DI	On-Demand	Anodyne	HRH3	38	46
Cc1nccnc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000450641346	CD	On-Demand	Anodyne	CHRNA4	40	52
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nccc(C#N)c2Cl)CC1	ZINC000450641347	GH	On-Demand	Mild	P2RY12	53	40
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641348	GF	On-Demand	Anodyne	BACE2	29	43
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641348	GF	On-Demand	Anodyne	CDK1	20	40
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641348	GF	On-Demand	Anodyne	CDK4	0	40
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641348	GF	On-Demand	Anodyne	CARM1	61	38
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641349	GF	On-Demand	Anodyne	BACE2	29	43
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641349	GF	On-Demand	Anodyne	CDK1	20	40
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641349	GF	On-Demand	Anodyne	CDK4	0	40
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641349	GF	On-Demand	Anodyne	CARM1	61	38
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccnc(C(C)C)n2)CC1	ZINC000450641351	GH	On-Demand	Anodyne	SORD	128	45
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2nc(C)cc(C)c2C#N)CC1	ZINC000450641354	GH	On-Demand	Mild	P2RY12	54	40
CCOC(=O)C1(C(=O)c2ccccc2)CCN(c2ccc(F)cc2C#N)CC1	ZINC000450641356	GH	On-Demand	Mild	KCNA3	16	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2nc(C(F)F)nc3ccccc23)C1	ZINC000450641359	FG	On-Demand	Anodyne	CHRNA4	28	47
CC(C)c1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc(C(C)C)n1	ZINC000450641362	FH	On-Demand	Anodyne	CHRNA4	29	45
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641366	GE	On-Demand	Anodyne	MME	21	40
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641366	GE	On-Demand	Anodyne	BACE2	35	43
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641366	GE	On-Demand	Anodyne	CDK1	20	43
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641366	GE	On-Demand	Anodyne	BACE1	18	43
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641366	GE	On-Demand	Anodyne	CDK4	22	43
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641366	GE	On-Demand	Anodyne	AMP1_PLAFQ	45	35
CO[C@@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641366	GE	On-Demand	Anodyne	CARM1	42	35
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641367	GE	On-Demand	Anodyne	MME	21	40
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641367	GE	On-Demand	Anodyne	BACE2	35	43
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641367	GE	On-Demand	Anodyne	CDK1	20	43
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641367	GE	On-Demand	Anodyne	BACE1	18	43
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641367	GE	On-Demand	Anodyne	CDK4	22	43
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641367	GE	On-Demand	Anodyne	AMP1_PLAFQ	45	35
CO[C@H](Cc1ccccc1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450641367	GE	On-Demand	Anodyne	CARM1	42	35
Cc1ccc2nccc(N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1	ZINC000450641368	EG	On-Demand	Anodyne	CHRNA4	29	48
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncc(Cl)cn2)C1	ZINC000450641369	DD	On-Demand	Anodyne	CHRNA4	32	56
COC(=O)c1csc(CN2CCc3cccc(F)c3C2)n1	ZINC000450641380	DF	On-Demand	Anodyne	NOD1	29	40
COC(=O)c1csc(CN2CCc3cccc(F)c3C2)n1	ZINC000450641380	DF	On-Demand	Anodyne	NOD2	45	40
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cccc2c1CCCC2	ZINC000450641398	FG	On-Demand	Anodyne	CCR3	0	42
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cccc2c1CCCC2	ZINC000450641399	FG	On-Demand	Anodyne	CCR3	0	42
CSCC1CCC(Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1	ZINC000450641404	FH	On-Demand	Bother	MAPK14	30	40
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641412	EI	On-Demand	Anodyne	NQO2	41	49
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641412	EI	On-Demand	Anodyne	MTR1B_CHICK	0	54
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641412	EI	On-Demand	Anodyne	HTR6	37	40
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641412	EI	On-Demand	Anodyne	MTNR1A	34	45
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641412	EI	On-Demand	Anodyne	EBP	17	46
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641415	EI	On-Demand	Anodyne	NQO2	41	49
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641415	EI	On-Demand	Anodyne	MTR1B_CHICK	0	54
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641415	EI	On-Demand	Anodyne	HTR6	37	40
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641415	EI	On-Demand	Anodyne	MTNR1A	34	45
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641415	EI	On-Demand	Anodyne	EBP	17	46
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641416	EI	On-Demand	Anodyne	NQO2	41	49
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641416	EI	On-Demand	Anodyne	MTR1B_CHICK	0	54
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641416	EI	On-Demand	Anodyne	HTR6	37	40
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641416	EI	On-Demand	Anodyne	MTNR1A	34	45
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450641416	EI	On-Demand	Anodyne	EBP	17	46
CC[C@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641417	EI	On-Demand	Anodyne	NQO2	41	49
CC[C@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641417	EI	On-Demand	Anodyne	MTR1B_CHICK	0	54
CC[C@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641417	EI	On-Demand	Anodyne	HTR6	37	40
CC[C@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641417	EI	On-Demand	Anodyne	MTNR1A	34	45
CC[C@H](CC(F)(F)F)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450641417	EI	On-Demand	Anodyne	EBP	17	46
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	CHRM2	15	49
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	HTR1A	28	40
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	DRD4	65	44
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	ACHE	47	47
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	HRH1	0	46
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	DRD3	31	42
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	CHRM3	17	48
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	LTA4H	19	41
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	TACR1	19	42
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	HTR7	20	40
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	SIGMAR1	54	54
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	SSTR5	60	38
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	CCR3	41	41
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	MCHR1	39	44
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	CCR8	40	42
COc1ccccc1COC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450641432	FI	On-Demand	Anodyne	MBTPS1	65	46
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)[C@@H](C)O	ZINC000450641440	DC	On-Demand	Anodyne	GPR88	0	45
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)[C@H](C)O	ZINC000450641444	DC	On-Demand	Anodyne	GPR88	0	45
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450641458	GE	On-Demand	Anodyne	PDE4D	16	42
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450641460	GE	On-Demand	Anodyne	PDE4D	16	42
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450641461	GE	On-Demand	Anodyne	PDE4D	16	42
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450641462	GE	On-Demand	Anodyne	PDE4D	16	42
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450641470	CG	On-Demand	Anodyne	ENPP1	60	34
COc1cc(CN2CCC(c3cc(C)[nH]n3)CC2)ccc1Cl	ZINC000450641485	DH	On-Demand	Anodyne	DRD2	17	52
COc1cc(CN2CCC(c3cc(C)[nH]n3)CC2)ccc1Cl	ZINC000450641485	DH	On-Demand	Anodyne	DRD4	40	52
COc1cc(CN2CCC(c3cc(C)[nH]n3)CC2)ccc1Cl	ZINC000450641485	DH	On-Demand	Anodyne	DRD3	22	52
COc1cc(CN2CCC(c3cc(C)[nH]n3)CC2)ccc1Cl	ZINC000450641485	DH	On-Demand	Anodyne	SIGMAR1	20	41
COc1cc(CN2CCC(c3cc(C)[nH]n3)CC2)ccc1Cl	ZINC000450641485	DH	On-Demand	Anodyne	SSTR5	65	41
COc1cc(CN2CCC(c3cc(C)[nH]n3)CC2)ccc1Cl	ZINC000450641485	DH	On-Demand	Anodyne	AKT2	22	40
CN(CCCC(=O)c1ccc(F)cc1)CC1CCN(c2ccncc2)CC1	ZINC000450641487	FI	On-Demand	Anodyne	DRD4	0	43
CN(CCCC(=O)c1ccc(F)cc1)CC1CCN(c2ccncc2)CC1	ZINC000450641487	FI	On-Demand	Anodyne	HTR2A	19	42
CN(CCCC(=O)c1ccc(F)cc1)CC1CCN(c2ccncc2)CC1	ZINC000450641487	FI	On-Demand	Anodyne	F10	16	44
CN(CCCC(=O)c1ccc(F)cc1)CC1CCN(c2ccncc2)CC1	ZINC000450641487	FI	On-Demand	Anodyne	SSTR1	17	42
O=C1CCC(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450641493	EG	On-Demand	Anodyne	LIPG	47	51
O=C1CCC(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450641494	EG	On-Demand	Anodyne	LIPG	47	51
Cc1ccc(NC(=O)N2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450641497	DD	On-Demand	Anodyne	PDGFRB	41	36
Cc1ccc(NC(=O)N2CCN(Cc3cnn[nH]3)CC2)cc1	ZINC000450641497	DD	On-Demand	Anodyne	FAAH	15	48
O=[N+]([O-])c1ccc(N2CC[C@@H]2C2CC2)cc1C(F)(F)F	ZINC000450641498	CH	On-Demand	Bother	AADAC	0	41
O=[N+]([O-])c1ccc(N2CC[C@H]2C2CC2)cc1C(F)(F)F	ZINC000450641502	CH	On-Demand	Bother	AADAC	0	41
CCc1cc(N[C@@H](C)CCCCO)n2ncnc2n1	ZINC000450641504	CD	On-Demand	Anodyne	DHOD	0	48
CCCN(CCc1cccs1)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450641508	GH	On-Demand	Anodyne	PLM2_PLAFA	43	34
CCC(=O)C1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CC1	ZINC000450641511	GI	On-Demand	Anodyne	PRNP	16	40
CCC(=O)C1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CC1	ZINC000450641511	GI	On-Demand	Anodyne	KCNK3	54	43
CCC(=O)C1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CC1	ZINC000450641511	GI	On-Demand	Anodyne	KCNK9	28	43
CCc1cc(N[C@H](C)CCCCO)n2ncnc2n1	ZINC000450641515	CD	On-Demand	Anodyne	DHOD	0	48
C[C@@H](Sc1n[nH]c(=NC2CCCCC2)s1)C(=O)Nc1nccs1	ZINC000450641516	FG	On-Demand	Anodyne	MAP1	74	37
C[C@H](Sc1n[nH]c(=NC2CCCCC2)s1)C(=O)Nc1nccs1	ZINC000450641526	FG	On-Demand	Anodyne	MAP1	74	37
COC(=O)c1ccc(C(=O)CSc2n[nH]c(=NC3CCCCC3)s2)o1	ZINC000450641538	GG	On-Demand	Anodyne	PDE7A	15	40
COCCOC[C@@H](O)CN1CCc2cc(F)ccc2C1	ZINC000450641548	CD	On-Demand	Anodyne	ABCB1	45	38
COCCOC[C@@H](O)CN1CCc2cc(F)ccc2C1	ZINC000450641548	CD	On-Demand	Anodyne	HSP90AB1	36	42
COCCOC[C@H](O)CN1CCc2cc(F)ccc2C1	ZINC000450641551	CD	On-Demand	Anodyne	ABCB1	45	38
COCCOC[C@H](O)CN1CCc2cc(F)ccc2C1	ZINC000450641551	CD	On-Demand	Anodyne	HSP90AB1	36	42
Cc1cc(C2CCN(CCc3ccc(Cl)cc3)CC2)n[nH]1	ZINC000450641583	DH	On-Demand	Anodyne	DRD2	18	66
Cc1cc(C2CCN(CCc3ccc(Cl)cc3)CC2)n[nH]1	ZINC000450641583	DH	On-Demand	Anodyne	DRD4	30	66
Cc1cc(C2CCN(CCc3ccc(Cl)cc3)CC2)n[nH]1	ZINC000450641583	DH	On-Demand	Anodyne	SIGMAR1	31	46
Cc1cc(C2CCN(CCc3ccc(Cl)cc3)CC2)n[nH]1	ZINC000450641583	DH	On-Demand	Anodyne	PRCP	27	48
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	DRD2	34	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	DRD1	0	53
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	DRD4	23	50
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	HTR2A	25	52
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	HTR2C	22	52
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	ERG2	22	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	SLC18A3	0	48
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	HTR3B	0	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	CYP2J2	55	40
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641605	EG	On-Demand	Anodyne	AP2S1	0	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	DRD2	34	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	DRD1	0	53
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	DRD4	23	50
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	HTR2A	25	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	HTR2C	22	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	ERG2	22	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	SLC18A3	0	48
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	HTR3B	0	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	CYP2J2	55	40
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)(F)F	ZINC000450641608	EG	On-Demand	Anodyne	AP2S1	0	44
CCOC(=O)c1ccc(CN2CCN(C(=O)[C@@H](C)O)CC2)nc1	ZINC000450641609	DC	On-Demand	Anodyne	P2RY12	42	41
C[C@@H](O)[C@H]1CCCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450641611	FE	On-Demand	Mild	CPT1A	113	43
C[C@@H](O)[C@H]1CCCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450641611	FE	On-Demand	Mild	CPT2	45	38
CCOC(=O)c1ccc(CN2CCN(C(=O)[C@H](C)O)CC2)nc1	ZINC000450641612	DC	On-Demand	Anodyne	P2RY12	42	41
COC(=O)[C@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)[C@@H](C)O	ZINC000450641613	DD	On-Demand	Anodyne	AMY2	43	30
COC(=O)[C@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)[C@H](C)O	ZINC000450641614	DD	On-Demand	Anodyne	AMY2	43	30
C[C@H](O)[C@@H]1CCCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450641615	FE	On-Demand	Mild	CPT1A	113	43
C[C@H](O)[C@@H]1CCCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450641615	FE	On-Demand	Mild	CPT2	45	38
COC(=O)[C@@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)[C@@H](C)O	ZINC000450641616	DD	On-Demand	Anodyne	AMY2	43	30
C[C@@H](O)[C@@H]1CCCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450641617	FE	On-Demand	Mild	CPT1A	113	43
C[C@@H](O)[C@@H]1CCCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450641617	FE	On-Demand	Mild	CPT2	45	38
COc1cc(NC(=O)c2cn(CC(C)C)nc2C(F)F)ccc1OC(C)C	ZINC000450641618	GJ	On-Demand	Anodyne	MET	42	35
COc1cc(NC(=O)c2cn(CC(C)C)nc2C(F)F)ccc1OC(C)C	ZINC000450641618	GJ	On-Demand	Anodyne	ENPP1	74	35
COC(=O)[C@@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)[C@H](C)O	ZINC000450641619	DD	On-Demand	Anodyne	AMY2	43	30
C[C@H](O)[C@H]1CCCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450641620	FE	On-Demand	Mild	CPT1A	113	43
C[C@H](O)[C@H]1CCCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450641620	FE	On-Demand	Mild	CPT2	45	38
Cc1csc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)c1	ZINC000450641635	DF	On-Demand	Anodyne	P2RX7	27	48
C[C@H](O)[C@H]1CCCCN1C(=O)C[C@@H]1CSc2ccccc2O1	ZINC000450641642	DF	On-Demand	Anodyne	COLA	43	34
C[C@H](O)[C@@H]1CCCCN1C(=O)C[C@H]1CSc2ccccc2O1	ZINC000450641643	DF	On-Demand	Anodyne	COLA	43	34
C[C@H](O)[C@H]1CCCCN1C(=O)C[C@H]1CSc2ccccc2O1	ZINC000450641645	DF	On-Demand	Anodyne	COLA	43	34
C[C@H](O)[C@@H]1CCCCN1C(=O)C[C@@H]1CSc2ccccc2O1	ZINC000450641647	DF	On-Demand	Anodyne	COLA	43	34
COc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)c([N+](=O)[O-])cc1F	ZINC000450641666	GH	On-Demand	Bother	GRM4	17	42
COc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)c([N+](=O)[O-])cc1F	ZINC000450641666	GH	On-Demand	Bother	TAAR1	25	43
COc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)c([N+](=O)[O-])cc1F	ZINC000450641666	GH	On-Demand	Bother	ENPP1	60	31
COc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)c([N+](=O)[O-])cc1F	ZINC000450641666	GH	On-Demand	Bother	KCNK3	40	38
COc1cc(CN2CC(=O)N(Cc3ccccc3)C2)ccc1Cl	ZINC000450641675	EG	On-Demand	Anodyne	DRD4	25	40
COc1cc(CN2CC(=O)N(Cc3ccccc3)C2)ccc1Cl	ZINC000450641675	EG	On-Demand	Anodyne	DRD3	24	40
COc1cc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)ccc1Cl	ZINC000450641688	GH	On-Demand	Anodyne	SMO	45	39
COc1cc(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)ccc1Cl	ZINC000450641688	GH	On-Demand	Anodyne	ETHR	72	48
O=C1CN(C(=O)C2(C(F)(F)F)CCC2)CCN1c1cccc(F)c1	ZINC000450641693	EF	On-Demand	Anodyne	P2RX7	15	44
Cc1nsc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)n1	ZINC000450641695	FH	On-Demand	Anodyne	SIGMAR1	45	39
Cc1nsc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)n1	ZINC000450641698	FH	On-Demand	Anodyne	SIGMAR1	45	39
CN(Cc1ncon1)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450641699	EF	On-Demand	Anodyne	RBP4	53	34
CCc1cccc(C(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)n1	ZINC000450641726	FG	On-Demand	Anodyne	PDE5A	25	41
CC[C@@H]1CC[C@@H](C)N1Cc1nc(C(=O)OC)cs1	ZINC000450641732	CF	On-Demand	Anodyne	TRPC6	46	36
CC[C@H]1CC[C@H](C)N1Cc1nc(C(=O)OC)cs1	ZINC000450641733	CF	On-Demand	Anodyne	TRPC6	46	36
CC[C@@H]1CC[C@H](C)N1Cc1nc(C(=O)OC)cs1	ZINC000450641734	CF	On-Demand	Anodyne	TRPC6	46	36
CC[C@H]1CC[C@@H](C)N1Cc1nc(C(=O)OC)cs1	ZINC000450641735	CF	On-Demand	Anodyne	TRPC6	46	36
CCOC(=O)c1cnn(C2CCN(c3cccc(C#N)c3[N+](=O)[O-])CC2)c1	ZINC000450641774	FF	On-Demand	Mild	P2RY12	57	39
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc5c(c34)CCC5)CC2)c1	ZINC000450641776	GG	On-Demand	Anodyne	RBP4	18	45
CCOC(=O)c1cnn(C2CCN(c3ncnc4sc5c(c34)CCC5)CC2)c1	ZINC000450641776	GG	On-Demand	Anodyne	SIRT3	51	32
COc1cccc(-n2cc(C(=O)NC[C@@]3(OC)CCOC3)nn2)c1	ZINC000450641782	EC	On-Demand	Anodyne	DRD4	42	32
COc1cccc(-n2cc(C(=O)NC[C@]3(OC)CCOC3)nn2)c1	ZINC000450641783	EC	On-Demand	Anodyne	DRD4	42	32
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(C)csc34)CC2)c1	ZINC000450641784	FG	On-Demand	Anodyne	SIRT3	52	33
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(C)csc34)CC2)c1	ZINC000450641784	FG	On-Demand	Anodyne	SIRT2	52	33
CCOC(=O)c1cnn(C2CCN(c3ncnc4c(C)csc34)CC2)c1	ZINC000450641784	FG	On-Demand	Anodyne	SIRT1	52	33
CO[C@]1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CCOC1	ZINC000450641790	GD	On-Demand	Anodyne	MMP13	18	41
CO[C@]1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CCOC1	ZINC000450641790	GD	On-Demand	Anodyne	MMP2	19	48
CO[C@]1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CCOC1	ZINC000450641790	GD	On-Demand	Anodyne	CAPN1	15	40
CO[C@@]1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CCOC1	ZINC000450641791	GD	On-Demand	Anodyne	MMP13	18	41
CO[C@@]1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CCOC1	ZINC000450641791	GD	On-Demand	Anodyne	MMP2	19	48
CO[C@@]1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CCOC1	ZINC000450641791	GD	On-Demand	Anodyne	CAPN1	15	40
CCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641792	GG	On-Demand	Anodyne	SSTR2	71	40
CCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641792	GG	On-Demand	Anodyne	P2RY12	107	34
CCC[C@@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641792	GG	On-Demand	Anodyne	TRY1_BOVIN	43	36
CCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641793	GG	On-Demand	Anodyne	SSTR2	71	40
CCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641793	GG	On-Demand	Anodyne	P2RY12	107	34
CCC[C@@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641793	GG	On-Demand	Anodyne	TRY1_BOVIN	43	36
CCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641794	GG	On-Demand	Anodyne	SSTR2	71	40
CCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641794	GG	On-Demand	Anodyne	P2RY12	107	34
CCC[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641794	GG	On-Demand	Anodyne	TRY1_BOVIN	43	36
CCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641795	GG	On-Demand	Anodyne	SSTR2	71	40
CCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641795	GG	On-Demand	Anodyne	P2RY12	107	34
CCC[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OC(C)(C)C	ZINC000450641795	GG	On-Demand	Anodyne	TRY1_BOVIN	43	36
CO[C@]1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000450641796	ED	On-Demand	Bother	CACNA1D	72	33
CO[C@@]1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000450641797	ED	On-Demand	Bother	CACNA1D	72	33
CCC[C@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)C(=O)OC(C)(C)C	ZINC000450641808	GG	On-Demand	Anodyne	CTRB_BOVIN	45	32
CCC[C@@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)C(=O)OC(C)(C)C	ZINC000450641809	GG	On-Demand	Anodyne	CTRB_BOVIN	45	32
CCOC(=O)c1cnn(C2CCN(c3ncccc3C(=O)NC)CC2)c1	ZINC000450641817	FD	On-Demand	Anodyne	P2RY12	49	40
CCOC(=O)c1cnn(C2CCN(c3cc([N+](=O)[O-])ccc3C(C)=O)CC2)c1	ZINC000450641824	GG	On-Demand	Bother	P2RY12	43	37
CCOC(=O)c1cnn(C2CCN(c3cc([N+](=O)[O-])ccc3C(C)=O)CC2)c1	ZINC000450641824	GG	On-Demand	Bother	MAP3K7	42	40
CCOC(=O)c1cnn(C2CCN(c3ncnc4[nH]c5ccccc5c34)CC2)c1	ZINC000450641829	GG	On-Demand	Anodyne	P2RY12	52	38
CCOC(=O)c1cnn(C2CCN(c3ncnc4[nH]c5ccccc5c34)CC2)c1	ZINC000450641829	GG	On-Demand	Anodyne	MAP3K7	41	33
CC(C)[C@H](O)C1(CNC(=O)c2cccnc2-n2cc(Br)cn2)CC1	ZINC000450641842	GF	On-Demand	Anodyne	HCN1	70	33
CC(C)[C@H](O)C1(CNC(=O)c2cccnc2-n2cc(Br)cn2)CC1	ZINC000450641842	GF	On-Demand	Anodyne	HCN4	49	33
CC(C)[C@@H](O)C1(CNC(=O)c2cccnc2-n2cc(Br)cn2)CC1	ZINC000450641843	GF	On-Demand	Anodyne	HCN1	70	33
CC(C)[C@@H](O)C1(CNC(=O)c2cccnc2-n2cc(Br)cn2)CC1	ZINC000450641843	GF	On-Demand	Anodyne	HCN4	49	33
CCOC(=O)c1cnn(C2CCN(c3ccncc3Cl)CC2)c1	ZINC000450641844	EF	On-Demand	Anodyne	P2RY12	32	40
CCOC(=O)c1cnn(C2CCN(c3ccnc4ccccc34)CC2)c1	ZINC000450641847	FG	On-Demand	Anodyne	METAP1	15	46
CCOC(=O)c1cnn(C2CCN(c3ccnc4ccccc34)CC2)c1	ZINC000450641847	FG	On-Demand	Anodyne	BMP4	43	30
CCOC(=O)c1cnn(C2CCN(c3ccnc4ccccc34)CC2)c1	ZINC000450641847	FG	On-Demand	Anodyne	MAP3K7	44	33
CCOC(=O)c1cnn(C2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)c1	ZINC000450641852	GG	On-Demand	Bother	P2RY12	31	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000450641855	GD	On-Demand	Anodyne	CA7	21	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000450641855	GD	On-Demand	Anodyne	CASP7	41	34
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000450641856	GD	On-Demand	Anodyne	CA7	21	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000450641856	GD	On-Demand	Anodyne	CASP7	41	34
CCC[C@@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OC(C)(C)C	ZINC000450641861	DE	On-Demand	Anodyne	SSTR2	52	35
CCC[C@@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OC(C)(C)C	ZINC000450641861	DE	On-Demand	Anodyne	P2RY12	63	32
CCC[C@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OC(C)(C)C	ZINC000450641862	DE	On-Demand	Anodyne	SSTR2	52	35
CCC[C@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OC(C)(C)C	ZINC000450641862	DE	On-Demand	Anodyne	P2RY12	63	32
CCOC(=O)c1cnn(C2CCN(c3ncccc3C#N)CC2)c1	ZINC000450641863	EE	On-Demand	Mild	P2RY12	22	40
CCOC(=O)c1cnn(C2CCN(c3ncccc3C#N)CC2)c1	ZINC000450641863	EE	On-Demand	Mild	MAP3K7	40	34
O=C(CCCC(=O)C1CC1)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450641864	ED	On-Demand	Anodyne	STAT6	44	33
CCC[C@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)C(=O)OC(C)(C)C	ZINC000450641865	FF	On-Demand	Anodyne	P2RY12	40	33
CCC[C@@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)C(=O)OC(C)(C)C	ZINC000450641866	FF	On-Demand	Anodyne	P2RY12	40	33
CCOC(=O)c1sc(Sc2ncc(Br)cn2)nc1C	ZINC000450641880	FG	On-Demand	Anodyne	DHODH	21	41
C[C@@H](Sc1nnc(-c2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450641899	EI	On-Demand	Anodyne	DGAT1	19	42
C[C@H](Sc1nnc(-c2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450641901	EI	On-Demand	Anodyne	DGAT1	19	42
COC(=O)[C@H](NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1)[C@@H](C)O	ZINC000450641923	FD	On-Demand	Anodyne	ACACA	65	37
COC(=O)[C@@H](NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1)[C@@H](C)O	ZINC000450641924	FD	On-Demand	Anodyne	ACACA	65	37
COC(=O)[C@H](NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1)[C@H](C)O	ZINC000450641925	FD	On-Demand	Anodyne	ACACA	65	37
COC(=O)[C@@H](NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1)[C@H](C)O	ZINC000450641926	FD	On-Demand	Anodyne	ACACA	65	37
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	GHRHR	72	33
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	P2RY12	56	36
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	MME	62	39
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	MC4R	104	44
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	CTSB	16	43
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	TRY2_BOVIN	78	41
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	CYSP_TRYCR	29	43
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	CYP51A1	22	43
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	MC3R	49	36
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	MC5R	71	36
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	REN	44	39
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	CCKBR	25	42
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	CTSS	30	43
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	CAPN1	46	38
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	ACE2	63	33
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	PGA5	48	34
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	ST14	61	33
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	PSMB8	55	40
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
O=C(CC1CC(F)(F)C1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641930	FE	On-Demand	Anodyne	BRCA1	43	30
Cc1sc2ncnc(S[C@H](C)C(=O)Nc3nccs3)c2c1C	ZINC000450641932	FH	On-Demand	Anodyne	MAP1	63	36
Cc1sc2ncnc(S[C@H](C)C(=O)Nc3nccs3)c2c1C	ZINC000450641932	FH	On-Demand	Anodyne	FFAR2	15	40
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	GHRHR	72	33
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	P2RY12	56	36
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	MME	62	39
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	MC4R	104	44
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	CTSB	16	43
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	TRY2_BOVIN	78	41
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	CYSP_TRYCR	29	43
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	CYP51A1	22	43
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	MC3R	49	36
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	MC5R	71	36
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	REN	44	39
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	CCKBR	25	42
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	CTSS	30	43
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	CAPN1	46	38
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	ACE2	63	33
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	PGA5	48	34
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	ST14	61	33
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	PSMB8	55	40
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
O=C(CC1CC(F)(F)C1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450641933	FE	On-Demand	Anodyne	BRCA1	43	30
Clc1ccc(CCN2CCN(CCc3cscn3)CC2)cc1Cl	ZINC000450641936	FH	On-Demand	Anodyne	SIGMAR1	28	68
Clc1ccc(CCN2CCN(CCc3cscn3)CC2)cc1Cl	ZINC000450641936	FH	On-Demand	Anodyne	ABCC1	62	35
Cc1sc2ncnc(S[C@@H](C)C(=O)Nc3nccs3)c2c1C	ZINC000450641939	FH	On-Demand	Anodyne	MAP1	63	36
Cc1sc2ncnc(S[C@@H](C)C(=O)Nc3nccs3)c2c1C	ZINC000450641939	FH	On-Demand	Anodyne	FFAR2	15	40
CCOC(=O)c1sc(Sc2nc(C)ccc2C#N)nc1C	ZINC000450641956	DG	On-Demand	Mild	DHODH	21	40
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450641961	GG	On-Demand	Anodyne	MTNR1A	22	42
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450641961	GG	On-Demand	Anodyne	MTNR1B	22	42
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450641962	GG	On-Demand	Anodyne	MTNR1A	22	42
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450641962	GG	On-Demand	Anodyne	MTNR1B	22	42
COCCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450641969	GC	On-Demand	Anodyne	DRD4	42	32
COCCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450641969	GC	On-Demand	Anodyne	HTR7	27	41
COCCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450641969	GC	On-Demand	Anodyne	MTNR1A	42	37
CC(C)C(=O)NCCN(C)CC/C=C\c1ccccc1	ZINC000450641970	CF	On-Demand	Anodyne	SLC6A5	31	40
CC(C)C(=O)NCCN(C)CC/C=C/c1ccccc1	ZINC000450641971	CF	On-Demand	Anodyne	SLC6A5	31	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450641975	GI	On-Demand	Anodyne	SSTR2	43	37
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450641975	GI	On-Demand	Anodyne	RHODESAIN	0	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450641977	GI	On-Demand	Anodyne	SSTR2	43	37
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450641977	GI	On-Demand	Anodyne	RHODESAIN	0	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cn1ccc(C)n1	ZINC000450641996	DE	On-Demand	Anodyne	NQO2	39	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cn1ccc(C)n1	ZINC000450641996	DE	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cn1ccc(C)n1	ZINC000450641996	DE	On-Demand	Anodyne	HTR6	37	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cn1ccc(C)n1	ZINC000450641996	DE	On-Demand	Anodyne	PPARD	40	38
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cn1ccc(C)n1	ZINC000450641997	DE	On-Demand	Anodyne	NQO2	39	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cn1ccc(C)n1	ZINC000450641997	DE	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cn1ccc(C)n1	ZINC000450641997	DE	On-Demand	Anodyne	HTR6	37	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cn1ccc(C)n1	ZINC000450641997	DE	On-Demand	Anodyne	PPARD	40	38
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)CCC(C)(C)C1	ZINC000450642020	FH	On-Demand	Anodyne	RHOA	0	42
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)CCC(C)(C)C1	ZINC000450642020	FH	On-Demand	Anodyne	KCNK3	72	33
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)CCC(C)(C)C1	ZINC000450642021	FH	On-Demand	Anodyne	RHOA	0	42
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)CCC(C)(C)C1	ZINC000450642021	FH	On-Demand	Anodyne	KCNK3	72	33
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	PPARA	17	40
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	NQO2	41	44
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	TRPV1	0	49
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	MTR1B_CHICK	0	60
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	HTR6	44	44
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	PPARD	42	41
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	MTNR1A	48	40
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	MTNR1B	41	40
COC(=O)c1ccc(CC(=O)NC[C@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642034	FG	On-Demand	Anodyne	EBP	21	46
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	PPARA	17	40
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	NQO2	41	44
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	TRPV1	0	49
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	MTR1B_CHICK	0	60
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	HTR6	44	44
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	PPARD	42	41
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	MTNR1A	48	40
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	MTNR1B	41	40
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCCc3cc(OC)ccc32)cc1	ZINC000450642035	FG	On-Demand	Anodyne	EBP	21	46
CC(=O)N[C@H](C(=O)NCc1cccc(-c2cccnc2)c1)C(C)(C)C	ZINC000450642045	EF	On-Demand	Anodyne	CYP11B1	20	41
CC(=O)N[C@H](C(=O)NCc1cccc(-c2cccnc2)c1)C(C)(C)C	ZINC000450642045	EF	On-Demand	Anodyne	MMP13	15	42
COc1ccc(CNC(=O)CCN2C[C@@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450642046	DD	On-Demand	Anodyne	HTR7	24	42
COc1ccc(CNC(=O)CCN2C[C@@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450642046	DD	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2C[C@@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450642046	DD	On-Demand	Anodyne	MTNR1B	41	40
COc1ccc(CNC(=O)CCN2C[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450642047	DD	On-Demand	Anodyne	HTR7	24	42
COc1ccc(CNC(=O)CCN2C[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450642047	DD	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2C[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450642047	DD	On-Demand	Anodyne	MTNR1B	41	40
COc1ccc(CNC(=O)CCN2C[C@H](C)[C@H](O)C2)c(OC)c1	ZINC000450642048	DD	On-Demand	Anodyne	HTR7	24	42
COc1ccc(CNC(=O)CCN2C[C@H](C)[C@H](O)C2)c(OC)c1	ZINC000450642048	DD	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2C[C@H](C)[C@H](O)C2)c(OC)c1	ZINC000450642048	DD	On-Demand	Anodyne	MTNR1B	41	40
COc1ccc(CNC(=O)CCN2C[C@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450642049	DD	On-Demand	Anodyne	HTR7	24	42
COc1ccc(CNC(=O)CCN2C[C@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450642049	DD	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2C[C@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450642049	DD	On-Demand	Anodyne	MTNR1B	41	40
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450642070	GJ	On-Demand	Anodyne	RBP4	71	41
CCc1nc2ccccc2n1C1CCN(C[C@H]2COCCO2)CC1	ZINC000450642071	EF	On-Demand	Anodyne	FPR2	28	41
CCc1nc2ccccc2n1C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450642075	EF	On-Demand	Anodyne	FPR2	28	41
FC(F)(F)Cn1ccc(CN(Cc2cccnc2)Cc2ccco2)n1	ZINC000450642095	FH	On-Demand	Anodyne	NR1D1	43	36
CC(C)(C[C@H]1CCCN(c2cc(C(F)F)nc3ccc(Cl)cc23)C1)C(N)=O	ZINC000450642117	GJ	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	34
COc1cc(NC(=O)[C@@H]2Cc3c(C)cccc3O2)ccc1OC(C)C	ZINC000450642123	EH	On-Demand	Anodyne	MT-ND4	50	31
COc1cc(NC(=O)[C@H]2Cc3c(C)cccc3O2)ccc1OC(C)C	ZINC000450642124	EH	On-Demand	Anodyne	MT-ND4	50	31
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]1C1CC1	ZINC000450642126	CH	On-Demand	Bother	LIPG	45	32
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]1C1CC1	ZINC000450642127	CH	On-Demand	Bother	LIPG	45	32
CC(C)(C[C@@H]1CCCN(c2cc(C(F)F)nc3ccc(Cl)cc23)C1)C(N)=O	ZINC000450642128	GJ	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	34
CCCC[C@H](NC(=O)CCc1nc2cnccc2[nH]1)C(=O)OC(C)(C)C	ZINC000450642132	FF	On-Demand	Anodyne	NOD1	61	33
CCCC[C@@H](NC(=O)CCc1nc2cnccc2[nH]1)C(=O)OC(C)(C)C	ZINC000450642133	FF	On-Demand	Anodyne	NOD1	61	33
CCCC[C@@H](NC(=O)CC1CC(F)(F)C1)C(=O)OC(C)(C)C	ZINC000450642138	DG	On-Demand	Anodyne	CTSK	27	40
CCCC[C@@H](NC(=O)CC1CC(F)(F)C1)C(=O)OC(C)(C)C	ZINC000450642138	DG	On-Demand	Anodyne	NOD1	74	34
CCCC[C@H](NC(=O)CC1CC(F)(F)C1)C(=O)OC(C)(C)C	ZINC000450642140	DG	On-Demand	Anodyne	CTSK	27	40
CCCC[C@H](NC(=O)CC1CC(F)(F)C1)C(=O)OC(C)(C)C	ZINC000450642140	DG	On-Demand	Anodyne	NOD1	74	34
Cc1ccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c(Cl)c1Cl	ZINC000450642145	GH	On-Demand	Anodyne	SCN10A	21	43
Cc1ccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c(Cl)c1Cl	ZINC000450642145	GH	On-Demand	Anodyne	STAT6	56	35
COc1cc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(C)C	ZINC000450642153	GH	On-Demand	Bother	CACNA1D	54	36
COc1cc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(C)C	ZINC000450642153	GH	On-Demand	Bother	PYGL	0	41
COc1cc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(C)C	ZINC000450642153	GH	On-Demand	Bother	ENPP1	76	37
COc1cc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)ccc1OC(C)C	ZINC000450642153	GH	On-Demand	Bother	SENP1	0	41
CNC(=O)c1cccnc1N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000450642154	DD	On-Demand	Anodyne	SIRT3	48	29
CNC(=O)c1cccnc1N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000450642154	DD	On-Demand	Anodyne	SIRT2	42	29
CNC(=O)c1cccnc1N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000450642154	DD	On-Demand	Anodyne	SIRT1	48	29
CNC(=O)c1cccnc1N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000450642156	DD	On-Demand	Anodyne	SIRT3	48	29
CNC(=O)c1cccnc1N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000450642156	DD	On-Demand	Anodyne	SIRT2	42	29
CNC(=O)c1cccnc1N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000450642156	DD	On-Demand	Anodyne	SIRT1	48	29
Cc1ccc(NC(=O)c2ccc(N[C@H]3CC[C@@H](CO)C3)c([N+](=O)[O-])c2)cc1	ZINC000450642159	FH	On-Demand	Bother	MAPK14	15	41
Cc1ccc(NC(=O)c2ccc(N[C@H]3CC[C@@H](CO)C3)c([N+](=O)[O-])c2)cc1	ZINC000450642159	FH	On-Demand	Bother	TAAR1	18	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@H]1C1CC1	ZINC000450642160	FD	On-Demand	Bother	PMM2	0	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@H]1C1CC1	ZINC000450642160	FD	On-Demand	Bother	DDIT3	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@@H]1C1CC1	ZINC000450642161	FD	On-Demand	Bother	PMM2	0	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CC[C@@H]1C1CC1	ZINC000450642161	FD	On-Demand	Bother	DDIT3	0	40
CCS(=O)(=O)c1ccc(CN2CCC(c3cc(C)[nH]n3)CC2)cc1	ZINC000450642169	EF	On-Demand	Anodyne	AKT2	40	41
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H]1CC1(F)F	ZINC000450642172	EH	On-Demand	Anodyne	ADAM17	58	44
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H]1CC1(F)F	ZINC000450642172	EH	On-Demand	Anodyne	CDC25B	23	41
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H]1CC1(F)F	ZINC000450642172	EH	On-Demand	Anodyne	GYS1	40	33
CO[C@]1(CNC(=O)c2cccc3c2CCCC3)CCOC1	ZINC000450642173	CE	On-Demand	Anodyne	HCN1	51	34
CO[C@]1(CNC(=O)c2cccc3c2CCCC3)CCOC1	ZINC000450642173	CE	On-Demand	Anodyne	HCN4	48	34
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@H]1CC1(F)F	ZINC000450642174	EH	On-Demand	Anodyne	ADAM17	58	44
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@H]1CC1(F)F	ZINC000450642174	EH	On-Demand	Anodyne	CDC25B	23	41
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@H]1CC1(F)F	ZINC000450642174	EH	On-Demand	Anodyne	GYS1	40	33
CO[C@@]1(CNC(=O)c2cccc3c2CCCC3)CCOC1	ZINC000450642175	CE	On-Demand	Anodyne	HCN1	51	34
CO[C@@]1(CNC(=O)c2cccc3c2CCCC3)CCOC1	ZINC000450642175	CE	On-Demand	Anodyne	HCN4	48	34
COc1cc(NC(=O)C[C@@H](CNC(C)=O)CC(C)C)ccc1OC(C)C	ZINC000450642176	FH	On-Demand	Anodyne	ENPP1	66	39
CCC[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OC(C)(C)C	ZINC000450642190	FF	On-Demand	Anodyne	SSTR2	57	37
CCC[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OC(C)(C)C	ZINC000450642190	FF	On-Demand	Anodyne	P2RY12	81	35
CCC[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OC(C)(C)C	ZINC000450642190	FF	On-Demand	Anodyne	CAPN2	52	38
CCC[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OC(C)(C)C	ZINC000450642190	FF	On-Demand	Anodyne	CTRB_BOVIN	57	37
CCC[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OC(C)(C)C	ZINC000450642192	FF	On-Demand	Anodyne	SSTR2	57	37
CCC[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OC(C)(C)C	ZINC000450642192	FF	On-Demand	Anodyne	P2RY12	81	35
CCC[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OC(C)(C)C	ZINC000450642192	FF	On-Demand	Anodyne	CAPN2	52	38
CCC[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OC(C)(C)C	ZINC000450642192	FF	On-Demand	Anodyne	CTRB_BOVIN	57	37
CCOC(=O)c1cnn(C2CCN(c3cccc(Cl)c3C#N)CC2)c1	ZINC000450642194	FG	On-Demand	Mild	P2RY12	58	39
COc1cc(CN2CCN3C(=O)NC(=O)[C@H]3C2)ccc1Cl	ZINC000450642201	DD	On-Demand	Anodyne	DRD4	51	38
COc1cc(CN2CCN3C(=O)NC(=O)[C@@H]3C2)ccc1Cl	ZINC000450642203	DD	On-Demand	Anodyne	DRD4	51	38
Cc1nnc(SC2CC(OC(C)(C)C)C2)n1-c1ccccc1	ZINC000450642204	DI	On-Demand	Anodyne	VCP	36	40
CCc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450642225	DG	On-Demand	Anodyne	TACR2	26	41
CCc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450642225	DG	On-Demand	Anodyne	CCR5	24	42
CCc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450642225	DG	On-Demand	Anodyne	PLD1	63	32
CCc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450642225	DG	On-Demand	Anodyne	PLD2	49	32
CCc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450642225	DG	On-Demand	Anodyne	FPR2	33	47
CCc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450642225	DG	On-Demand	Anodyne	USP1	0	48
CCc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450642226	DG	On-Demand	Anodyne	TACR2	26	41
CCc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450642226	DG	On-Demand	Anodyne	CCR5	24	42
CCc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450642226	DG	On-Demand	Anodyne	PLD1	63	32
CCc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450642226	DG	On-Demand	Anodyne	PLD2	49	32
CCc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450642226	DG	On-Demand	Anodyne	FPR2	33	47
CCc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450642226	DG	On-Demand	Anodyne	USP1	0	48
CS(=O)(=O)c1ccc(Nc2ccc3c(c2)CCCC3)nc1	ZINC000450642247	DG	On-Demand	Anodyne	MLNR	28	54
COCc1nn(C)cc1C(=O)N1CCN(c2ccccc2)C(=O)C1	ZINC000450642248	ED	On-Demand	Anodyne	P2RX7	23	43
CC(=O)CCCCCSc1nnc(-c2cccs2)n1C[C@@H]1CCCO1	ZINC000450642251	GI	On-Demand	Anodyne	PDE8B	16	41
CC(=O)CCCCCSc1nnc(-c2cccs2)n1C[C@H]1CCCO1	ZINC000450642252	GI	On-Demand	Anodyne	PDE8B	16	41
CCOC(=O)c1ccc(CN2CCO[C@H](c3cccc(C#N)c3)C2)nc1	ZINC000450642265	FF	On-Demand	Mild	P2RY12	40	38
CCOC(=O)c1ccc(CN2CCO[C@@H](c3cccc(C#N)c3)C2)nc1	ZINC000450642266	FF	On-Demand	Mild	P2RY12	40	38
C[C@@H](O)[C@@H]1CCCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450642272	FE	On-Demand	Mild	CPT1A	128	47
C[C@@H](O)[C@@H]1CCCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450642272	FE	On-Demand	Mild	CPT2	51	42
C[C@@H](O)[C@H]1CCCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450642273	FE	On-Demand	Mild	CPT1A	128	47
C[C@@H](O)[C@H]1CCCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450642273	FE	On-Demand	Mild	CPT2	51	42
C[C@H](O)[C@@H]1CCCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450642274	FE	On-Demand	Mild	CPT1A	128	47
C[C@H](O)[C@@H]1CCCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450642274	FE	On-Demand	Mild	CPT2	51	42
C[C@H](O)[C@H]1CCCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450642275	FE	On-Demand	Mild	CPT1A	128	47
C[C@H](O)[C@H]1CCCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450642275	FE	On-Demand	Mild	CPT2	51	42
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	CHRM2	22	49
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	DRD2	25	45
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	DRD4	47	39
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	ACHE	35	44
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	DRD3	24	45
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	OPRK1	18	45
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	CHRM3	32	58
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	SIGMAR1	81	45
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	NPFFR2	41	38
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	FAAH	26	42
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	MCHR1	17	41
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	MCHR2	78	39
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	MGLL	0	41
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	CCR8	57	49
CC(=O)c1cccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)c1	ZINC000450642311	FI	On-Demand	Anodyne	NPFFR1	62	38
C[C@@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642314	GG	On-Demand	Anodyne	PPIA	23	40
C[C@@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642314	GG	On-Demand	Anodyne	F7	29	43
C[C@@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642314	GG	On-Demand	Anodyne	PTGES	16	41
C[C@@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642314	GG	On-Demand	Anodyne	LIMK2	21	44
C[C@@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642314	GG	On-Demand	Anodyne	PSBA	0	43
C[C@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642315	GG	On-Demand	Anodyne	PPIA	23	40
C[C@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642315	GG	On-Demand	Anodyne	F7	29	43
C[C@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642315	GG	On-Demand	Anodyne	PTGES	16	41
C[C@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642315	GG	On-Demand	Anodyne	LIMK2	21	44
C[C@H](CN(C)Cc1ccccc1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450642315	GG	On-Demand	Anodyne	PSBA	0	43
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ccccc2)C(=O)C1	ZINC000450642322	CD	On-Demand	Anodyne	ERBB2	18	40
CCOC(=O)c1ccc(CN(C)Cc2ccc(Cl)c(F)c2)nc1	ZINC000450642323	EH	On-Demand	Anodyne	P2RY12	24	41
C1=C(CSc2nnc(-c3ccccc3)o2)CCCC1	ZINC000450642330	CI	On-Demand	Anodyne	GSK3B	17	54
C1=C(CSc2nnc(-c3ccccc3)o2)CCCC1	ZINC000450642330	CI	On-Demand	Anodyne	GSK3A	45	54
C1=C(CSc2nnc(-c3ccccc3)o2)CCCC1	ZINC000450642330	CI	On-Demand	Anodyne	TERT	28	45
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(F)(F)F	ZINC000450642331	EG	On-Demand	Anodyne	DRD4	0	46
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(F)(F)F	ZINC000450642331	EG	On-Demand	Anodyne	SLC6A1	76	37
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(F)(F)F	ZINC000450642331	EG	On-Demand	Anodyne	SLC18A3	0	41
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(F)(F)F	ZINC000450642331	EG	On-Demand	Anodyne	CYP2J2	63	45
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450642373	GD	On-Demand	Anodyne	DRD1	17	43
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450642373	GD	On-Demand	Anodyne	DRD4	0	42
C[C@@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450642373	GD	On-Demand	Anodyne	CYP2J2	57	42
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450642374	GD	On-Demand	Anodyne	DRD1	17	43
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450642374	GD	On-Demand	Anodyne	DRD4	0	42
C[C@H](O)C(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450642374	GD	On-Demand	Anodyne	CYP2J2	57	42
CC(=O)N[C@H](C(=O)N1CCC(c2noc(C3CC3)n2)CC1)C(C)(C)C	ZINC000450642383	EE	On-Demand	Anodyne	SMO	51	35
CCC(=O)CCCN(C)CC1CCN(c2ccncc2)CC1	ZINC000450642388	DF	On-Demand	Anodyne	SSTR1	21	44
COc1ccc([C@H](CO)N(C)C(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450642416	FG	On-Demand	Anodyne	OPRK1	29	60
COc1ccc([C@H](CO)N(C)C(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450642416	FG	On-Demand	Anodyne	DXR	28	41
COc1ccc([C@@H](CO)N(C)C(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450642417	FG	On-Demand	Anodyne	OPRK1	29	60
COc1ccc([C@@H](CO)N(C)C(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450642417	FG	On-Demand	Anodyne	DXR	28	41
O=C(c1cc(Cl)c2ccccc2n1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450642421	GI	On-Demand	Anodyne	SMO	60	42
O=C(c1cc(Cl)c2ccccc2n1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450642421	GI	On-Demand	Anodyne	ETHR	63	41
CCOC(=O)c1sc(Sc2ccc(S(C)(=O)=O)cn2)nc1C	ZINC000450642423	FF	On-Demand	Anodyne	DHODH	20	40
CNS(=O)(=O)NCC(=O)N(C)[C@H](CO)c1ccc(OC)cc1	ZINC000450642433	EB	On-Demand	Anodyne	DXR	28	41
CCS(=O)(=O)c1ccc(CN2CCOC[C@@H]2c2c(C)nn(C)c2C)cc1	ZINC000450642440	GE	On-Demand	Anodyne	NMT1	43	36
CCS(=O)(=O)c1ccc(CN2CCOC[C@H]2c2c(C)nn(C)c2C)cc1	ZINC000450642441	GE	On-Demand	Anodyne	NMT1	43	36
CNC(=O)c1ccc(N2CC[C@@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450642455	CD	On-Demand	Bother	TAAR1	17	42
CNC(=O)c1ccc(N2CC[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450642456	CD	On-Demand	Bother	TAAR1	17	42
COCc1nn(C)cc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450642460	EF	On-Demand	Anodyne	QPCT	15	40
COCc1nn(C)cc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450642460	EF	On-Demand	Anodyne	ENPP1	64	39
COCc1nn(C)cc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450642460	EF	On-Demand	Anodyne	IMDH_CRYPV	15	40
COCc1nn(C)cc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450642460	EF	On-Demand	Anodyne	KCNK3	41	41
COCc1nn(C)cc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450642460	EF	On-Demand	Anodyne	KCNK9	36	41
CN(CCN1CCC2(CCCN2C)CC1)Cc1ccccc1	ZINC000450642461	DF	On-Demand	Anodyne	SIGMAR1	44	51
OC[C@@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450642465	DF	On-Demand	Anodyne	EGFR	42	39
OC[C@@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450642465	DF	On-Demand	Anodyne	CD38	41	40
COc1cc(NC(=O)Cn2ccc(C)n2)ccc1OC(C)C	ZINC000450642474	DF	On-Demand	Anodyne	ENPP1	71	41
COc1cc(NC(=O)Cn2ccc(C)n2)ccc1OC(C)C	ZINC000450642474	DF	On-Demand	Anodyne	IMDH_CRYPV	22	40
COc1cc(NC(=O)CC2(O)CCC2)ccc1OC(C)C	ZINC000450642491	CF	On-Demand	Anodyne	ENPP1	72	42
COc1ccc(C(=O)N[C@H](C)c2cn(C(C)(C)C)nc2C)cc1S(C)(=O)=O	ZINC000450642506	GF	On-Demand	Anodyne	COLA	40	34
COc1ccc(C(=O)N[C@H](C)c2cn(C(C)(C)C)nc2C)cc1S(C)(=O)=O	ZINC000450642506	GF	On-Demand	Anodyne	CPT1A	44	32
COc1ccc(C(=O)N[C@@H](C)c2cn(C(C)(C)C)nc2C)cc1S(C)(=O)=O	ZINC000450642507	GF	On-Demand	Anodyne	COLA	40	34
COc1ccc(C(=O)N[C@@H](C)c2cn(C(C)(C)C)nc2C)cc1S(C)(=O)=O	ZINC000450642507	GF	On-Demand	Anodyne	CPT1A	44	32
N#CC1(CN(Cc2cccnc2)Cc2ccco2)CCC1	ZINC000450642510	CG	On-Demand	Mild	NR1D1	40	37
CCOCCN(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450642517	CD	On-Demand	Anodyne	RORC	15	40
CCS(=O)(=O)c1ccc(CN2CCc3cccc(F)c3C2)cc1	ZINC000450642536	EG	On-Demand	Anodyne	NOD1	31	40
CCS(=O)(=O)c1ccc(CN2CCc3cccc(F)c3C2)cc1	ZINC000450642536	EG	On-Demand	Anodyne	NOD2	47	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450642538	FG	On-Demand	Anodyne	SFRP1	77	44
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450642538	FG	On-Demand	Anodyne	WNT3	60	35
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450642538	FG	On-Demand	Anodyne	HPGD	41	39
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450642539	FG	On-Demand	Anodyne	SFRP1	77	44
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450642539	FG	On-Demand	Anodyne	WNT3	60	35
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450642539	FG	On-Demand	Anodyne	HPGD	41	39
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450642542	FG	On-Demand	Anodyne	RHOA	0	45
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450642543	FG	On-Demand	Anodyne	RHOA	0	45
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450642544	FG	On-Demand	Anodyne	RHOA	0	45
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450642545	FG	On-Demand	Anodyne	RHOA	0	45
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450642548	DF	On-Demand	Anodyne	PREP	30	44
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450642549	DF	On-Demand	Anodyne	PREP	30	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(CF)CCOCC1	ZINC000450642555	EF	On-Demand	Anodyne	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(CF)CCOCC1	ZINC000450642556	EF	On-Demand	Anodyne	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450642557	DH	On-Demand	Anodyne	NQO2	40	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450642557	DH	On-Demand	Anodyne	HTR6	43	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450642557	DH	On-Demand	Anodyne	PPARD	43	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450642557	DH	On-Demand	Anodyne	MTNR1A	31	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450642557	DH	On-Demand	Anodyne	EBP	19	47
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450642558	DH	On-Demand	Anodyne	NQO2	40	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450642558	DH	On-Demand	Anodyne	HTR6	43	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450642558	DH	On-Demand	Anodyne	PPARD	43	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450642558	DH	On-Demand	Anodyne	EBP	19	47
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450642559	DH	On-Demand	Anodyne	NQO2	40	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450642559	DH	On-Demand	Anodyne	HTR6	43	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450642559	DH	On-Demand	Anodyne	PPARD	43	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450642559	DH	On-Demand	Anodyne	MTNR1A	31	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450642559	DH	On-Demand	Anodyne	EBP	19	47
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450642560	DH	On-Demand	Anodyne	NQO2	40	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450642560	DH	On-Demand	Anodyne	HTR6	43	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450642560	DH	On-Demand	Anodyne	PPARD	43	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450642560	DH	On-Demand	Anodyne	MTNR1A	31	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450642560	DH	On-Demand	Anodyne	EBP	19	47
COc1ccc(-c2noc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)n2)cc1	ZINC000450642567	FG	On-Demand	Anodyne	COLA	0	41
COc1ccc(-c2noc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)n2)cc1	ZINC000450642567	FG	On-Demand	Anodyne	LUCI_PHOPE	21	40
COc1ccc(-c2noc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)n2)cc1	ZINC000450642568	FG	On-Demand	Anodyne	COLA	0	41
COc1ccc(-c2noc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)n2)cc1	ZINC000450642568	FG	On-Demand	Anodyne	LUCI_PHOPE	21	40
COc1ccc(-c2noc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)n2)cc1	ZINC000450642569	FG	On-Demand	Anodyne	COLA	0	41
COc1ccc(-c2noc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)n2)cc1	ZINC000450642569	FG	On-Demand	Anodyne	LUCI_PHOPE	21	40
COc1ccc(-c2noc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)n2)cc1	ZINC000450642570	FG	On-Demand	Anodyne	COLA	0	41
COc1ccc(-c2noc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)n2)cc1	ZINC000450642570	FG	On-Demand	Anodyne	LUCI_PHOPE	21	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CCC(N)=O)CC1	ZINC000450642585	DE	On-Demand	Anodyne	ACHE	25	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CCC(N)=O)CC1	ZINC000450642585	DE	On-Demand	Anodyne	CYP2J2	46	32
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CCC(N)=O)CC1	ZINC000450642586	DE	On-Demand	Anodyne	ACHE	25	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CCC(N)=O)CC1	ZINC000450642586	DE	On-Demand	Anodyne	CYP2J2	46	32
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CCC(N)=O)CC1	ZINC000450642587	DE	On-Demand	Anodyne	ACHE	25	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CCC(N)=O)CC1	ZINC000450642587	DE	On-Demand	Anodyne	CYP2J2	46	32
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CCC(N)=O)CC1	ZINC000450642588	DE	On-Demand	Anodyne	ACHE	25	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CCC(N)=O)CC1	ZINC000450642588	DE	On-Demand	Anodyne	CYP2J2	46	32
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450642604	CF	On-Demand	Anodyne	RHODESAIN	0	40
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450642605	CF	On-Demand	Anodyne	RHODESAIN	0	40
CN(CCN1CCC(CCC(N)=O)CC1)Cc1ccccc1	ZINC000450642616	DE	On-Demand	Anodyne	DRD2	22	40
CN(CCN1CCC(CCC(N)=O)CC1)Cc1ccccc1	ZINC000450642616	DE	On-Demand	Anodyne	ACHE	48	47
CN(CCN1CCC(CCC(N)=O)CC1)Cc1ccccc1	ZINC000450642616	DE	On-Demand	Anodyne	HTR4	41	34
CN(CCN1CCC(CCC(N)=O)CC1)Cc1ccccc1	ZINC000450642616	DE	On-Demand	Anodyne	GRIN2B	58	39
CN(CCN1CCC(CCC(N)=O)CC1)Cc1ccccc1	ZINC000450642616	DE	On-Demand	Anodyne	SIGMAR1	70	44
CN(CCN1CCC(CCC(N)=O)CC1)Cc1ccccc1	ZINC000450642616	DE	On-Demand	Anodyne	CCR3	44	40
CN(CCN1CCC(CCC(N)=O)CC1)Cc1ccccc1	ZINC000450642616	DE	On-Demand	Anodyne	CCR5	46	41
CN(CCN1CCC(CCC(N)=O)CC1)Cc1ccccc1	ZINC000450642616	DE	On-Demand	Anodyne	CYP2J2	54	38
CCC(=O)C1(C(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)CC1	ZINC000450642618	DE	On-Demand	Anodyne	RHODESAIN	0	40
CCC(=O)C1(C(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)CC1	ZINC000450642619	DE	On-Demand	Anodyne	RHODESAIN	0	40
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(F)(F)F	ZINC000450642632	EG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(F)(F)F	ZINC000450642632	EG	On-Demand	Anodyne	SLC6A1	76	37
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(F)(F)F	ZINC000450642632	EG	On-Demand	Anodyne	SLC18A3	0	41
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(F)(F)F	ZINC000450642632	EG	On-Demand	Anodyne	CYP2J2	63	45
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450642639	EE	On-Demand	Anodyne	SIGMAR1	37	43
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450642640	EE	On-Demand	Anodyne	SIGMAR1	37	43
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450642641	EE	On-Demand	Anodyne	SIGMAR1	37	43
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450642642	EE	On-Demand	Anodyne	SIGMAR1	37	43
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	CHRM2	15	44
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	P2RY12	27	40
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	CHRM3	15	44
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	SIGMAR1	45	43
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	SSTR5	40	37
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	FAAH	20	40
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	MCHR2	49	32
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	CCR8	51	41
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	NPFFR1	53	38
CCOC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)nc1	ZINC000450642647	GH	On-Demand	Anodyne	NOD2	17	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450642652	EE	On-Demand	Anodyne	NOD1	54	33
COC(=O)[C@H](CC(F)(F)F)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450642653	EE	On-Demand	Anodyne	NOD1	54	33
CC1(C)OCC[C@H]1Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450642665	GI	On-Demand	Anodyne	NPBWR1	41	37
CC1(C)OCC[C@@H]1Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450642666	GI	On-Demand	Anodyne	NPBWR1	41	37
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)c1	ZINC000450642683	DF	On-Demand	Anodyne	OPRK1	22	45
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)c1	ZINC000450642683	DF	On-Demand	Anodyne	COLA	110	38
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)c1	ZINC000450642683	DF	On-Demand	Anodyne	CPT1A	96	36
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)c1	ZINC000450642683	DF	On-Demand	Anodyne	CPT2	44	35
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)c1	ZINC000450642684	DF	On-Demand	Anodyne	OPRK1	22	45
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)c1	ZINC000450642684	DF	On-Demand	Anodyne	COLA	110	38
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)c1	ZINC000450642684	DF	On-Demand	Anodyne	CPT1A	96	36
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)c1	ZINC000450642684	DF	On-Demand	Anodyne	CPT2	44	35
CCC[C@H]1CN(C(=O)CS(=O)(=O)C2CC2)CCN1Cc1ccccc1	ZINC000450642703	FE	On-Demand	Anodyne	SIGMAR1	21	45
CCC[C@@H]1CN(C(=O)CS(=O)(=O)C2CC2)CCN1Cc1ccccc1	ZINC000450642704	FE	On-Demand	Anodyne	SIGMAR1	21	45
CNS(=O)(=O)NCC(=O)N(C)[C@@H](CO)c1ccc(OC)cc1	ZINC000450642709	EB	On-Demand	Anodyne	DXR	28	41
Clc1ccc(CCN2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)cc1Cl	ZINC000450642711	FH	On-Demand	Anodyne	SIGMAR1	20	58
O=C(N[C@H]1CCCOc2c(Cl)cccc21)[C@@H](O)C1CCC1	ZINC000450642712	DF	On-Demand	Anodyne	CNR1	30	41
Clc1ccc(CCN2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)cc1Cl	ZINC000450642713	FH	On-Demand	Anodyne	SIGMAR1	20	58
O=C(N[C@@H]1CCCOc2c(Cl)cccc21)[C@@H](O)C1CCC1	ZINC000450642714	DF	On-Demand	Anodyne	CNR1	30	41
O=C(N[C@H]1CCCOc2c(Cl)cccc21)[C@H](O)C1CCC1	ZINC000450642715	DF	On-Demand	Anodyne	CNR1	30	41
O=C(N[C@@H]1CCCOc2c(Cl)cccc21)[C@H](O)C1CCC1	ZINC000450642717	DF	On-Demand	Anodyne	CNR1	30	41
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	DRD4	37	40
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	ACHE	20	48
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	CHRM3	17	40
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	LTA4H	20	41
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	SIGMAR1	42	44
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	CCR3	21	40
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	SLC18A3	19	43
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	MLNR	51	37
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	S1PR5	20	40
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	CXCR3	20	40
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	MBTD1	0	43
CC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450642718	BG	On-Demand	Anodyne	NOD2	40	34
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	DRD4	37	40
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	ACHE	20	48
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	CHRM3	17	40
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	LTA4H	20	41
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	SIGMAR1	42	44
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	CCR3	21	40
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	SLC18A3	19	43
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	MLNR	51	37
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	S1PR5	20	40
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	CXCR3	20	40
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	MBTD1	0	43
CC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450642719	BG	On-Demand	Anodyne	NOD2	40	34
COC(=O)c1csc(CN2CC[C@H](C3CC3)C2)n1	ZINC000450642720	CE	On-Demand	Anodyne	TRPC6	45	34
COC(=O)c1csc(CN2CC[C@@H](C3CC3)C2)n1	ZINC000450642721	CE	On-Demand	Anodyne	TRPC6	45	34
CC[C@@H]1CCC[C@H]1C(=O)N1CCN([C@H](C)c2ccsc2)CC1	ZINC000450642723	DH	On-Demand	Anodyne	NPBWR1	53	37
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN([C@H](C)c2ccsc2)CC1	ZINC000450642725	DH	On-Demand	Anodyne	NPBWR1	53	37
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN([C@@H](C)c2ccsc2)CC1	ZINC000450642726	DH	On-Demand	Anodyne	NPBWR1	53	37
CC[C@@H]1CCC[C@H]1C(=O)N1CCN([C@@H](C)c2ccsc2)CC1	ZINC000450642728	DH	On-Demand	Anodyne	NPBWR1	53	37
Cc1cccc(F)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450642743	FH	On-Demand	Anodyne	MAPK8	0	40
Cc1cccc(F)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450642743	FH	On-Demand	Anodyne	DGAT1	27	45
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)C[C@H]1C	ZINC000450642749	BF	On-Demand	Anodyne	OPRK1	0	42
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)C[C@H]1C	ZINC000450642749	BF	On-Demand	Anodyne	VACHT_TETCF	0	53
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)C[C@H]1C	ZINC000450642749	BF	On-Demand	Anodyne	SIGMAR1	36	41
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)C[C@H]1C	ZINC000450642749	BF	On-Demand	Anodyne	SLC18A3	23	52
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)C[C@H]1C	ZINC000450642749	BF	On-Demand	Anodyne	ABCB1	34	41
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450642755	GD	On-Demand	Anodyne	HPGD	52	61
COC(=O)[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)[C@@H](C)O	ZINC000450642756	DD	On-Demand	Anodyne	SCN9A	0	41
COC(=O)[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)[C@@H](C)O	ZINC000450642757	DD	On-Demand	Anodyne	SCN9A	0	41
COC(=O)[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)[C@H](C)O	ZINC000450642758	DD	On-Demand	Anodyne	SCN9A	0	41
COC(=O)[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)[C@H](C)O	ZINC000450642759	DD	On-Demand	Anodyne	SCN9A	0	41
Cc1cccc(F)c1NC(=O)C1CCN(S(=O)(=O)c2c(C)n[nH]c2C)CC1	ZINC000450642760	GF	On-Demand	Anodyne	EPHX2	43	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	ACE	39	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	GHRHR	56	31
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	P2RY12	45	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	MME	37	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	TRHR	21	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	MC4R	89	49
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	CTRA_BOVIN	56	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	TACR2	43	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	TRY1_BOVIN	48	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	CYSP_TRYCR	23	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	CTSG	45	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	CYP51A1	21	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	TIMP3	55	34
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	ITGA4	50	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	MC3R	42	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	MC5R	65	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	CELA2A	54	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	REN	53	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	CCKBR	27	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	CTSS	35	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	CAPN1	41	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	ACE2	42	37
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	MC1R	26	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	PGA5	50	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642775	GE	On-Demand	Anodyne	PSMB8	49	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	ACE	39	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	GHRHR	56	31
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	P2RY12	45	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	MME	37	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	TRHR	21	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	MC4R	89	49
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	CTRA_BOVIN	56	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	TACR2	43	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	TRY1_BOVIN	48	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	CYSP_TRYCR	23	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	CTSG	45	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	CYP51A1	21	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	TIMP3	55	34
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	ITGA4	50	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	MC3R	42	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	MC5R	65	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	CELA2A	54	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	REN	53	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	CCKBR	27	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	CTSS	35	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	CAPN1	41	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	ACE2	42	37
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	MC1R	26	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	PGA5	50	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642776	GE	On-Demand	Anodyne	PSMB8	49	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	ACE	39	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	GHRHR	56	31
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	P2RY12	45	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	MME	37	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	TRHR	21	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	MC4R	89	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	CTRA_BOVIN	56	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	TACR2	43	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	TRY1_BOVIN	48	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	CYSP_TRYCR	23	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	CTSG	45	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	CYP51A1	21	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	TIMP3	55	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	ITGA4	50	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	MC3R	42	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	MC5R	65	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	CELA2A	54	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	REN	53	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	CCKBR	27	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	CTSS	35	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	CAPN1	41	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	ACE2	42	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	MC1R	26	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	PGA5	50	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H]1CCCCC1(F)F	ZINC000450642777	GE	On-Demand	Anodyne	PSMB8	49	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	ACE	39	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	GHRHR	56	31
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	P2RY12	45	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	MME	37	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	TRHR	21	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	MC4R	89	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	CTRA_BOVIN	56	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	TACR2	43	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	TRY1_BOVIN	48	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	CYSP_TRYCR	23	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	CTSG	45	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	CYP51A1	21	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	TIMP3	55	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	ITGA4	50	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	MC3R	42	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	MC5R	65	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	CELA2A	54	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	REN	53	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	CCKBR	27	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	CTSS	35	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	CAPN1	41	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	ACE2	42	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	MC1R	26	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	PGA5	50	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H]1CCCCC1(F)F	ZINC000450642778	GE	On-Demand	Anodyne	PSMB8	49	35
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642792	DG	On-Demand	Anodyne	DRD2	30	43
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642792	DG	On-Demand	Anodyne	DRD1	15	45
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642792	DG	On-Demand	Anodyne	HTR2A	18	47
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642792	DG	On-Demand	Anodyne	HTR2C	16	51
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642792	DG	On-Demand	Anodyne	ERG2	20	43
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642792	DG	On-Demand	Anodyne	CYP2J2	51	38
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642794	DG	On-Demand	Anodyne	DRD2	30	43
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642794	DG	On-Demand	Anodyne	DRD1	15	45
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642794	DG	On-Demand	Anodyne	HTR2A	18	47
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642794	DG	On-Demand	Anodyne	HTR2C	16	51
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642794	DG	On-Demand	Anodyne	ERG2	20	43
CCN1C[C@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642794	DG	On-Demand	Anodyne	CYP2J2	51	38
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642795	DG	On-Demand	Anodyne	DRD2	30	43
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642795	DG	On-Demand	Anodyne	DRD1	15	45
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642795	DG	On-Demand	Anodyne	HTR2A	18	47
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642795	DG	On-Demand	Anodyne	HTR2C	16	51
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642795	DG	On-Demand	Anodyne	ERG2	20	43
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450642795	DG	On-Demand	Anodyne	CYP2J2	51	38
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642797	DG	On-Demand	Anodyne	DRD2	30	43
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642797	DG	On-Demand	Anodyne	DRD1	15	45
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642797	DG	On-Demand	Anodyne	HTR2A	18	47
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642797	DG	On-Demand	Anodyne	HTR2C	16	51
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642797	DG	On-Demand	Anodyne	ERG2	20	43
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450642797	DG	On-Demand	Anodyne	CYP2J2	51	38
Nc1ncccc1CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450642810	EF	On-Demand	Anodyne	LIPG	15	46
Nc1ncccc1CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450642812	EF	On-Demand	Anodyne	LIPG	15	46
CCOC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)nc1	ZINC000450642818	CF	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)nc1	ZINC000450642819	CF	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)nc1	ZINC000450642820	CF	On-Demand	Anodyne	SSTR5	43	36
CCNC(=O)c1ccc(N[C@H]2CCCC[C@H]2CC(F)(F)F)nc1	ZINC000450642822	EH	On-Demand	Anodyne	PTK2	0	41
CCOC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)nc1	ZINC000450642823	CF	On-Demand	Anodyne	SSTR5	43	36
COc1cc(NC(=O)[C@H](C)OCc2ccc(F)cc2)ccc1OC(C)C	ZINC000450642838	FI	On-Demand	Anodyne	ENPP1	74	35
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	ANPEP	30	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	MMP13	22	49
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	CTSB	22	58
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	CTSF	42	39
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	CTSK	37	48
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	CTSL	24	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	CAPNS1	61	58
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	MMP2	30	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	MMP3	22	49
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	CTSS	25	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	CAPN1	58	66
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	MMP9	19	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	CAPN2	46	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	MMP7	22	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	FPR1	51	34
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	GSP	0	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	PSMB5	32	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(F)(F)F)cc1	ZINC000450642839	GG	On-Demand	Anodyne	LEF	56	40
COc1cc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)ccc1OC(C)C	ZINC000450642840	FI	On-Demand	Anodyne	ENPP1	74	35
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	ANPEP	30	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	MMP13	22	49
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	CTSB	22	58
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	CTSF	42	39
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	CTSK	37	48
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	CTSL	24	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	CAPNS1	61	58
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	MMP2	30	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	MMP3	22	49
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	CTSS	25	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	CAPN1	58	66
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	MMP9	19	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	CAPN2	46	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	MMP7	22	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	FPR1	51	34
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	GSP	0	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	PSMB5	32	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(F)(F)F)cc1	ZINC000450642846	GG	On-Demand	Anodyne	LEF	56	40
CC(=O)NC[C@H](CC(=O)NCCc1c(C)oc2ccccc12)CC(C)C	ZINC000450642851	FH	On-Demand	Anodyne	MTNR1A	26	47
CC(=O)NC[C@H](CC(=O)NCCc1c(C)oc2ccccc12)CC(C)C	ZINC000450642851	FH	On-Demand	Anodyne	MTNR1B	20	47
CSc1ccc2ncnc(N[C@H]3CC[C@@H](CO)C3)c2c1	ZINC000450642854	CF	On-Demand	Anodyne	CD38	59	44
O[C@@H]1C[C@@H]([C@@H]2CCCOC2)N(c2nc3ccccc3[nH]2)C1	ZINC000450642862	CD	On-Demand	Anodyne	KCNN3	24	42
COc1cc(NC(=O)c2cc(C)c(C(N)=O)cn2)ccc1OC(C)C	ZINC000450642863	EF	On-Demand	Anodyne	SYK	26	40
COc1cc(NC(=O)c2cc(C)c(C(N)=O)cn2)ccc1OC(C)C	ZINC000450642863	EF	On-Demand	Anodyne	GRM4	23	47
COc1cc(NC(=O)c2cc(C)c(C(N)=O)cn2)ccc1OC(C)C	ZINC000450642863	EF	On-Demand	Anodyne	CSF1R	60	44
COc1cc(NC(=O)c2cc(C)c(C(N)=O)cn2)ccc1OC(C)C	ZINC000450642863	EF	On-Demand	Anodyne	ENPP1	69	41
CO[C@@H]1COCC[C@@H]1CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450642865	GG	On-Demand	Anodyne	GYS1	40	32
CO[C@@H]1COCC[C@H]1CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450642866	GG	On-Demand	Anodyne	GYS1	40	32
CO[C@H]1COCC[C@@H]1CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450642868	GG	On-Demand	Anodyne	GYS1	40	32
CO[C@H]1COCC[C@H]1CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450642870	GG	On-Demand	Anodyne	GYS1	40	32
CCOC(=O)c1ccc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)nc1	ZINC000450642871	GG	On-Demand	Anodyne	LIPG	50	50
CCOC(=O)c1ccc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)nc1	ZINC000450642873	GG	On-Demand	Anodyne	LIPG	50	50
CCn1nnc(C)c1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450642875	DF	On-Demand	Anodyne	ENPP1	67	39
O[C@@H]1C[C@H]([C@@H]2CCCOC2)N(c2nc3ccccc3[nH]2)C1	ZINC000450642880	CD	On-Demand	Anodyne	KCNN3	24	42
O[C@@H]1C[C@H]([C@H]2CCCOC2)N(c2nc3ccccc3[nH]2)C1	ZINC000450642882	CD	On-Demand	Anodyne	KCNN3	24	42
O[C@@H]1C[C@@H]([C@H]2CCCOC2)N(c2nc3ccccc3[nH]2)C1	ZINC000450642884	CD	On-Demand	Anodyne	KCNN3	24	42
CC[C@H](CC(F)(F)F)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450642887	EI	On-Demand	Anodyne	MTNR1A	25	42
CC[C@H](CC(F)(F)F)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450642887	EI	On-Demand	Anodyne	MTNR1B	26	42
CC[C@@H](CC(F)(F)F)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450642889	EI	On-Demand	Anodyne	MTNR1A	25	42
CC[C@@H](CC(F)(F)F)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450642889	EI	On-Demand	Anodyne	MTNR1B	26	42
CC(C)CCCC(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450642908	DG	On-Demand	Anodyne	SMO	48	38
CC(C)CCCC(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450642908	DG	On-Demand	Anodyne	ETHR	86	59
CC[C@H](CC(F)(F)F)C(=O)Nc1ccccc1CN1CCNC1=O	ZINC000450642912	EG	On-Demand	Anodyne	KCNQ2	52	36
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccccc1CN1CCNC1=O	ZINC000450642913	EG	On-Demand	Anodyne	KCNQ2	52	36
C[C@H](CCCCO)Nc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450642914	DI	On-Demand	Anodyne	RBP_CHICK	0	49
CC[C@H](CC(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450642915	CI	On-Demand	Anodyne	ANPEP	42	44
CC[C@H](CC(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450642915	CI	On-Demand	Anodyne	CAPN2	47	36
CC[C@H](CC(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450642915	CI	On-Demand	Anodyne	AMP1_PLAFQ	27	45
CC[C@@H](CC(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450642916	CI	On-Demand	Anodyne	ANPEP	42	44
CC[C@@H](CC(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450642916	CI	On-Demand	Anodyne	CAPN2	47	36
CC[C@@H](CC(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450642916	CI	On-Demand	Anodyne	AMP1_PLAFQ	27	45
C[C@@H](CCCCO)Nc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450642917	DI	On-Demand	Anodyne	RBP_CHICK	0	49
COc1cc(NC(=O)C2CC(C)(O)C2)ccc1OC(C)C	ZINC000450642925	CF	On-Demand	Anodyne	ENPP1	53	32
CCCOc1cccc(CN2CCC3(CCCN3C)CC2)c1	ZINC000450642947	DH	On-Demand	Anodyne	HRH2	42	48
CCCOc1cccc(CN2CCC3(CCCN3C)CC2)c1	ZINC000450642947	DH	On-Demand	Anodyne	SIGMAR1	18	43
O=C(c1ccc(N[C@H]2CC[C@@H](CO)C2)nc1)N1CCc2ccccc21	ZINC000450642949	EF	On-Demand	Anodyne	AVPR1A	44	40
Cc1nn(C)c(C)c1[C@H]1COCCN1CCCC(=O)c1ccccc1	ZINC000450642959	EG	On-Demand	Anodyne	CYP2J2	51	38
CC[S@](=O)CC(=O)NCCc1c(C)oc2ccccc12	ZINC000450642960	CE	On-Demand	Anodyne	MTNR1A	28	40
CC[S@@](=O)CC(=O)NCCc1c(C)oc2ccccc12	ZINC000450642961	CE	On-Demand	Anodyne	MTNR1A	28	40
CC(=O)CCCCCSc1nnc(-c2cccnc2)n1C	ZINC000450642962	DG	On-Demand	Anodyne	DRD3	44	49
Cc1nn(C)c(C)c1[C@@H]1COCCN1CCCC(=O)c1ccccc1	ZINC000450642963	EG	On-Demand	Anodyne	CYP2J2	51	38
CCOC(=O)c1cc(C(=O)NCCc2c(C)oc3ccccc23)on1	ZINC000450642972	EF	On-Demand	Anodyne	MTNR1A	19	40
COC[C@@]1(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CCOC1	ZINC000450642986	FG	On-Demand	Anodyne	ADAM17	33	41
COC[C@]1(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CCOC1	ZINC000450642987	FG	On-Demand	Anodyne	ADAM17	33	41
Cc1nnc(SCc2ccn(CC(F)(F)F)n2)n1-c1ccccc1	ZINC000450643000	FH	On-Demand	Anodyne	TNKS2	15	42
C[C@@H](CCCCO)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450643010	EE	On-Demand	Anodyne	HTR3A	22	52
C[C@@H](CCCCO)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450643010	EE	On-Demand	Anodyne	HRH4	22	52
C[C@H](CCCCO)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450643011	EE	On-Demand	Anodyne	HTR3A	22	52
C[C@H](CCCCO)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450643011	EE	On-Demand	Anodyne	HRH4	22	52
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643032	FG	On-Demand	Anodyne	ACE	43	40
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643032	FG	On-Demand	Anodyne	FKBP1A	50	40
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643032	FG	On-Demand	Anodyne	SLC6A1	54	37
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643032	FG	On-Demand	Anodyne	SSTR2	43	34
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643032	FG	On-Demand	Anodyne	GHRHR	41	32
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643032	FG	On-Demand	Anodyne	AMY2	46	31
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643032	FG	On-Demand	Anodyne	RHODESAIN	0	50
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643033	FG	On-Demand	Anodyne	ACE	43	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643033	FG	On-Demand	Anodyne	FKBP1A	50	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643033	FG	On-Demand	Anodyne	SLC6A1	54	37
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643033	FG	On-Demand	Anodyne	SSTR2	43	34
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643033	FG	On-Demand	Anodyne	GHRHR	41	32
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643033	FG	On-Demand	Anodyne	AMY2	46	31
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643033	FG	On-Demand	Anodyne	RHODESAIN	0	50
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643034	FG	On-Demand	Anodyne	ACE	43	40
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643034	FG	On-Demand	Anodyne	FKBP1A	50	40
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643034	FG	On-Demand	Anodyne	SLC6A1	54	37
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643034	FG	On-Demand	Anodyne	SSTR2	43	34
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643034	FG	On-Demand	Anodyne	GHRHR	41	32
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643034	FG	On-Demand	Anodyne	AMY2	46	31
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450643034	FG	On-Demand	Anodyne	RHODESAIN	0	50
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643035	FG	On-Demand	Anodyne	ACE	43	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643035	FG	On-Demand	Anodyne	FKBP1A	50	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643035	FG	On-Demand	Anodyne	SLC6A1	54	37
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643035	FG	On-Demand	Anodyne	SSTR2	43	34
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643035	FG	On-Demand	Anodyne	GHRHR	41	32
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643035	FG	On-Demand	Anodyne	AMY2	46	31
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450643035	FG	On-Demand	Anodyne	RHODESAIN	0	50
O=C(NCc1cccc(-c2cccnc2)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450643041	DH	On-Demand	Anodyne	CMA1	17	42
O=C(NCc1cccc(-c2cccnc2)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450643041	DH	On-Demand	Anodyne	CTRC	28	42
O=C(NCc1cccc(-c2cccnc2)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450643041	DH	On-Demand	Anodyne	NAMPT	61	36
Cc1ccc(Br)cc1CN1CCC(CCC(N)=O)CC1	ZINC000450643060	EG	On-Demand	Anodyne	ACHE	25	40
O=C(CC1CC(F)(F)C1)NCc1cccc(-c2cccnc2)c1	ZINC000450643075	DH	On-Demand	Anodyne	NAMPT	44	36
COCCOC[C@@H](O)CN1CCC(C)(c2cccc(Br)c2)CC1	ZINC000450643076	GF	On-Demand	Anodyne	ABCB1	25	41
COCCOC[C@@H](O)CN1CCC(C)(c2cccc(Br)c2)CC1	ZINC000450643076	GF	On-Demand	Anodyne	HSP90AB1	39	43
COCCOC[C@H](O)CN1CCC(C)(c2cccc(Br)c2)CC1	ZINC000450643077	GF	On-Demand	Anodyne	ABCB1	25	41
COCCOC[C@H](O)CN1CCC(C)(c2cccc(Br)c2)CC1	ZINC000450643077	GF	On-Demand	Anodyne	HSP90AB1	39	43
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450643079	GI	On-Demand	Anodyne	RHOA	0	40
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450643080	GI	On-Demand	Anodyne	RHOA	0	40
O=C(CC1CC(F)(F)C1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450643105	GK	On-Demand	Anodyne	PRNP	16	40
O=C(CC1CC(F)(F)C1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450643105	GK	On-Demand	Anodyne	ENV	42	33
O=C(CC1CC(F)(F)C1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450643105	GK	On-Demand	Anodyne	KCNK3	37	43
O=C(CC1CC(F)(F)C1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450643105	GK	On-Demand	Anodyne	KCNK9	19	41
COc1ccc(CNC(=O)CCN(C)CCNC(=O)N(C)C)c(OC)c1	ZINC000450643107	FC	On-Demand	Anodyne	MTNR1A	62	42
COc1ccc(CNC(=O)CCN(C)CCNC(=O)N(C)C)c(OC)c1	ZINC000450643107	FC	On-Demand	Anodyne	MTNR1B	51	42
CSCC1CCC(Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450643108	GG	On-Demand	Bother	L3MBTL1	0	42
CSCC1CCC(Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450643108	GG	On-Demand	Bother	L3MBTL3	15	42
COC(=O)c1coc(CN2CCc3cccc(F)c3C2)n1	ZINC000450643111	CE	On-Demand	Anodyne	NOD2	42	38
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)cn1	ZINC000450643113	GG	On-Demand	Anodyne	PRNP	48	32
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)cn1	ZINC000450643113	GG	On-Demand	Anodyne	TAAR1	39	41
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)cn1	ZINC000450643113	GG	On-Demand	Anodyne	SFRP1	48	38
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)cn1	ZINC000450643113	GG	On-Demand	Anodyne	RHOA	0	43
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)cn1	ZINC000450643113	GG	On-Demand	Anodyne	HPGD	43	41
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)cn1	ZINC000450643113	GG	On-Demand	Anodyne	MAP3K12	29	40
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)cn1	ZINC000450643113	GG	On-Demand	Anodyne	KCNK3	76	38
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)cn1	ZINC000450643114	GG	On-Demand	Anodyne	PRNP	48	32
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)cn1	ZINC000450643114	GG	On-Demand	Anodyne	TAAR1	39	41
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)cn1	ZINC000450643114	GG	On-Demand	Anodyne	SFRP1	48	38
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)cn1	ZINC000450643114	GG	On-Demand	Anodyne	RHOA	0	43
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)cn1	ZINC000450643114	GG	On-Demand	Anodyne	HPGD	43	41
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)cn1	ZINC000450643114	GG	On-Demand	Anodyne	MAP3K12	29	40
CC(F)(F)c1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)cn1	ZINC000450643114	GG	On-Demand	Anodyne	KCNK3	76	38
CC[S@](=O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450643119	DE	On-Demand	Anodyne	GYRB	0	40
CC[S@](=O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450643119	DE	On-Demand	Anodyne	CYP11B2	44	39
CC[S@@](=O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450643120	DE	On-Demand	Anodyne	GYRB	0	40
CC[S@@](=O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450643120	DE	On-Demand	Anodyne	CYP11B2	44	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643125	EG	On-Demand	Anodyne	NQO2	40	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643125	EG	On-Demand	Anodyne	TRPV1	22	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643125	EG	On-Demand	Anodyne	MTR1B_CHICK	0	57
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643125	EG	On-Demand	Anodyne	HTR6	40	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643125	EG	On-Demand	Anodyne	CAN2	0	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643126	EG	On-Demand	Anodyne	NQO2	40	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643126	EG	On-Demand	Anodyne	TRPV1	22	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643126	EG	On-Demand	Anodyne	MTR1B_CHICK	0	57
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643126	EG	On-Demand	Anodyne	HTR6	40	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450643126	EG	On-Demand	Anodyne	CAN2	0	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	ACE	15	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	MME	26	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	NQO2	36	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	TRPV1	0	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	NPY2R	43	37
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	HTR6	44	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	PPARD	41	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643127	FG	On-Demand	Anodyne	EBP	18	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	ACE	15	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	MME	26	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	NQO2	36	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	TRPV1	0	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	NPY2R	43	37
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	HTR6	44	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	PPARD	41	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643128	FG	On-Demand	Anodyne	EBP	18	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	ACE	15	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	MME	26	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	NQO2	36	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	TRPV1	0	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	NPY2R	43	37
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	HTR6	44	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	PPARD	41	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450643129	FG	On-Demand	Anodyne	EBP	18	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	ACE	15	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	MME	26	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	NQO2	36	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	TRPV1	0	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	NPY2R	43	37
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	HTR6	44	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	PPARD	41	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450643130	FG	On-Demand	Anodyne	EBP	18	46
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	DRD2	33	48
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	DRD1	19	48
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	DRD4	0	52
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	HTR2A	18	48
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	HTR2C	15	51
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	ERG2	22	48
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	SLC18A3	0	52
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	EBP	22	48
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	HTR3B	0	44
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	CYP2J2	48	34
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC12CCCCC2	ZINC000450643143	FH	On-Demand	Anodyne	SLC12A5	16	40
CN(CCN(C)CC1CCN(c2ccncc2)CC1)Cc1ccccc1	ZINC000450643156	FG	On-Demand	Anodyne	SSTR1	21	44
C[C@H]1COC[C@@H](c2ccccc2)N1C[C@H](O)Cc1ccccc1	ZINC000450643190	DG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@H]1COC[C@H](c2ccccc2)N1C[C@H](O)Cc1ccccc1	ZINC000450643191	DG	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1ccc(NC(=O)c2ccc(N[C@@H](C)CCCCO)c([N+](=O)[O-])c2)cc1	ZINC000450643217	FI	On-Demand	Bother	TAAR1	21	49
Cc1ccc(NC(=O)c2ccc(N[C@H](C)CCCCO)c([N+](=O)[O-])c2)cc1	ZINC000450643218	FI	On-Demand	Bother	TAAR1	21	49
Cc1cccc(F)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450643223	CF	On-Demand	Anodyne	PRNP	50	38
Cc1cccc(F)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450643223	CF	On-Demand	Anodyne	HDAC1	23	40
Cc1cccc(F)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450643223	CF	On-Demand	Anodyne	SHH	50	39
Cc1cccc(F)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450643223	CF	On-Demand	Anodyne	DGAT1	45	41
OC[C@@H]1CSCCN1Cc1ccccc1OC1CC1	ZINC000450643236	CE	On-Demand	Anodyne	SLC5A4	51	32
OC[C@H]1CSCCN1Cc1ccccc1OC1CC1	ZINC000450643237	CE	On-Demand	Anodyne	SLC5A4	51	32
O=C(CCC(=O)N1CCC(c2noc(C3CC3)n2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000450643253	GG	On-Demand	Bother	SMO	48	37
O=C(CCC(=O)N1CCC(c2noc(C3CC3)n2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000450643253	GG	On-Demand	Bother	ETHR	82	48
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)CC(F)(F)F)ccc21	ZINC000450643257	GI	On-Demand	Anodyne	CYSLTR1	41	35
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)CC(F)(F)F)ccc21	ZINC000450643257	GI	On-Demand	Anodyne	PDGFRB	15	44
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)CC(F)(F)F)ccc21	ZINC000450643257	GI	On-Demand	Anodyne	CPT1A	44	30
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)CC(F)(F)F)ccc21	ZINC000450643257	GI	On-Demand	Anodyne	PLK1	60	38
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](C)CC(F)(F)F)ccc21	ZINC000450643257	GI	On-Demand	Anodyne	HPGD	47	55
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)CC(F)(F)F)ccc21	ZINC000450643258	GI	On-Demand	Anodyne	CYSLTR1	41	35
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)CC(F)(F)F)ccc21	ZINC000450643258	GI	On-Demand	Anodyne	PDGFRB	15	44
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)CC(F)(F)F)ccc21	ZINC000450643258	GI	On-Demand	Anodyne	CPT1A	44	30
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)CC(F)(F)F)ccc21	ZINC000450643258	GI	On-Demand	Anodyne	PLK1	60	38
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H](C)CC(F)(F)F)ccc21	ZINC000450643258	GI	On-Demand	Anodyne	HPGD	47	55
Cn1c(SCCC(C)(F)F)nnc1-c1cccnc1	ZINC000450643259	CG	On-Demand	Anodyne	DRD3	24	45
Cc1cccc(Cl)c1CN1CCC[C@@H](S(N)(=O)=O)C1	ZINC000450643277	DD	On-Demand	Anodyne	SLC6A1	50	38
Cc1cccc(Cl)c1CN1CCC[C@H](S(N)(=O)=O)C1	ZINC000450643280	DD	On-Demand	Anodyne	SLC6A1	50	38
COc1cc2nc(N3C[C@H](O)C[C@H]3[C@@H]3CCCOC3)nc(N)c2cc1OC	ZINC000450643296	FD	On-Demand	Anodyne	ADRA1D	16	48
COc1cc2nc(N3C[C@H](O)C[C@H]3[C@@H]3CCCOC3)nc(N)c2cc1OC	ZINC000450643296	FD	On-Demand	Anodyne	ADRA1B	48	48
COc1cc2nc(N3C[C@H](O)C[C@@H]3[C@@H]3CCCOC3)nc(N)c2cc1OC	ZINC000450643299	FD	On-Demand	Anodyne	ADRA1D	16	48
COc1cc2nc(N3C[C@H](O)C[C@@H]3[C@@H]3CCCOC3)nc(N)c2cc1OC	ZINC000450643299	FD	On-Demand	Anodyne	ADRA1B	48	48
COc1cc2nc(N3C[C@H](O)C[C@@H]3[C@H]3CCCOC3)nc(N)c2cc1OC	ZINC000450643300	FD	On-Demand	Anodyne	ADRA1D	16	48
COc1cc2nc(N3C[C@H](O)C[C@@H]3[C@H]3CCCOC3)nc(N)c2cc1OC	ZINC000450643300	FD	On-Demand	Anodyne	ADRA1B	48	48
COc1cc2nc(N3C[C@H](O)C[C@H]3[C@H]3CCCOC3)nc(N)c2cc1OC	ZINC000450643301	FD	On-Demand	Anodyne	ADRA1D	16	48
COc1cc2nc(N3C[C@H](O)C[C@H]3[C@H]3CCCOC3)nc(N)c2cc1OC	ZINC000450643301	FD	On-Demand	Anodyne	ADRA1B	48	48
OC[C@@H]1CC[C@H](Nc2ncnc3cc(F)c(F)cc23)C1	ZINC000450643319	CE	On-Demand	Anodyne	CD38	40	39
C=CCOc1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450643324	FI	On-Demand	Mild	TSHR	54	32
C=CCOc1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450643324	FI	On-Demand	Mild	PDGFRB	40	41
C=CCOc1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450643324	FI	On-Demand	Mild	FLT4	21	41
C=CCOc1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450643324	FI	On-Demand	Mild	CSF1R	16	41
C=CCOc1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450643324	FI	On-Demand	Mild	CA9	15	41
C=CCOc1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450643324	FI	On-Demand	Mild	ENPP1	79	38
C=CCOc1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1	ZINC000450643324	FI	On-Demand	Mild	DRTS_TRYCR	43	29
COc1cc(NC(=O)C2(C(=O)C3CC3)CC2)ccc1OC(C)C	ZINC000450643328	DG	On-Demand	Anodyne	ENPP1	55	32
CCN1C(=O)C[C@H](C(=O)Nc2ccc(OC(C)C)c(OC)c2)[C@H]1c1cccnc1	ZINC000450643344	GG	On-Demand	Anodyne	ENPP1	69	36
C[C@@H](CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1)S(C)(=O)=O	ZINC000450643365	FD	On-Demand	Anodyne	LIPG	41	49
C[C@@H](CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1)S(C)(=O)=O	ZINC000450643367	FD	On-Demand	Anodyne	LIPG	41	49
C[C@H](CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1)S(C)(=O)=O	ZINC000450643368	FD	On-Demand	Anodyne	LIPG	41	49
C[C@H](CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1)S(C)(=O)=O	ZINC000450643369	FD	On-Demand	Anodyne	LIPG	41	49
COc1cc(NC(=O)Cc2ccc(O)c(F)c2)ccc1OC(C)C	ZINC000450643371	EH	On-Demand	Anodyne	TRPV1	26	42
COc1cc(NC(=O)Cc2ccc(O)c(F)c2)ccc1OC(C)C	ZINC000450643371	EH	On-Demand	Anodyne	ENPP1	80	38
COc1cc(NC(=O)Cc2ccc(O)c(F)c2)ccc1OC(C)C	ZINC000450643371	EH	On-Demand	Anodyne	CAN2	0	41
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2)[C@@H](C)CCO)cc1	ZINC000450643378	FG	On-Demand	Anodyne	RORC	37	46
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2)[C@H](C)CCO)cc1	ZINC000450643379	FG	On-Demand	Anodyne	RORC	37	46
COc1cc(NC(=O)Cc2cc(C)ccc2F)ccc1OC(C)C	ZINC000450643391	EI	On-Demand	Anodyne	ENPP1	81	38
CCOC(=O)c1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)[nH]c1C	ZINC000450643394	FH	On-Demand	Anodyne	ENPP1	68	39
CCOC(=O)c1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)[nH]c1C	ZINC000450643394	FH	On-Demand	Anodyne	KCNK3	49	37
C=CC(C)(C)C(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450643399	CE	On-Demand	Mild	P2RX7	16	42
COC(=O)C1(CN(C)Cc2ccc(Cl)c(F)c2)CC1	ZINC000450643404	CF	On-Demand	Anodyne	ENV	41	31
COc1cc(NC(=O)c2cc(C)cs2)ccc1OC(C)C	ZINC000450643408	DI	On-Demand	Anodyne	GRM4	18	44
COc1cc(NC(=O)c2cc(C)cs2)ccc1OC(C)C	ZINC000450643408	DI	On-Demand	Anodyne	QRFPR	15	43
COc1cc(NC(=O)c2cc(C)cs2)ccc1OC(C)C	ZINC000450643408	DI	On-Demand	Anodyne	ENPP1	70	34
COc1cc(NC(=O)c2cc(C)cs2)ccc1OC(C)C	ZINC000450643408	DI	On-Demand	Anodyne	KCNK3	48	39
COc1cc(NC(=O)c2cc(C)cs2)ccc1OC(C)C	ZINC000450643408	DI	On-Demand	Anodyne	KCNK9	52	38
CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450643412	GG	On-Demand	Anodyne	F7	28	40
CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450643413	GG	On-Demand	Anodyne	F7	28	40
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450643415	GG	On-Demand	Anodyne	F7	28	40
CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450643417	GG	On-Demand	Anodyne	F7	28	40
COc1cc(NC(=O)[C@@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643418	EG	On-Demand	Anodyne	PDGFRB	24	40
COc1cc(NC(=O)[C@@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643418	EG	On-Demand	Anodyne	GUAB	0	41
COc1cc(NC(=O)[C@@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643418	EG	On-Demand	Anodyne	GRM4	45	49
COc1cc(NC(=O)[C@@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643418	EG	On-Demand	Anodyne	ENPP1	63	40
COc1cc(NC(=O)[C@@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643418	EG	On-Demand	Anodyne	IMDH_CRYPV	37	43
COc1cc(NC(=O)[C@@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643418	EG	On-Demand	Anodyne	GLMU	0	42
COc1cc(NC(=O)[C@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643420	EG	On-Demand	Anodyne	PDGFRB	24	40
COc1cc(NC(=O)[C@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643420	EG	On-Demand	Anodyne	GUAB	0	41
COc1cc(NC(=O)[C@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643420	EG	On-Demand	Anodyne	GRM4	45	49
COc1cc(NC(=O)[C@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643420	EG	On-Demand	Anodyne	ENPP1	63	40
COc1cc(NC(=O)[C@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643420	EG	On-Demand	Anodyne	IMDH_CRYPV	37	43
COc1cc(NC(=O)[C@H](C)Oc2ccccn2)ccc1OC(C)C	ZINC000450643420	EG	On-Demand	Anodyne	GLMU	0	42
CC1(C)CN(c2ncc([N+](=O)[O-])c(=N)[nH]2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450643425	GF	On-Demand	Bother	SIGMAR1	25	41
CC1(C)CN(c2ncc([N+](=O)[O-])c(=N)[nH]2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450643426	GF	On-Demand	Bother	SIGMAR1	25	41
O=C1CCC(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)CC1	ZINC000450643446	EH	On-Demand	Anodyne	DRD2	0	42
O=C1CCC(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)CC1	ZINC000450643446	EH	On-Demand	Anodyne	ACHE	33	40
O=C1CCC(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)CC1	ZINC000450643446	EH	On-Demand	Anodyne	OPRL1	15	47
O=C1CCC(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)CC1	ZINC000450643446	EH	On-Demand	Anodyne	SIGMAR1	84	49
COc1ccc2nc(C)nc(N[C@H]3CC[C@@H](CO)C3)c2c1	ZINC000450643472	CF	On-Demand	Anodyne	CCR4	17	44
C[C@H](O)[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643473	EG	On-Demand	Anodyne	COLA	123	42
C[C@H](O)[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643473	EG	On-Demand	Anodyne	CPT1A	106	42
C[C@H](O)[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643473	EG	On-Demand	Anodyne	CPT2	44	34
C[C@H](O)[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643473	EG	On-Demand	Anodyne	PREP	41	34
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643477	EG	On-Demand	Anodyne	COLA	123	42
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643477	EG	On-Demand	Anodyne	CPT1A	106	42
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643477	EG	On-Demand	Anodyne	CPT2	44	34
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643477	EG	On-Demand	Anodyne	PREP	41	34
C[C@@H](O)[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643478	EG	On-Demand	Anodyne	COLA	123	42
C[C@@H](O)[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643478	EG	On-Demand	Anodyne	CPT1A	106	42
C[C@@H](O)[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643478	EG	On-Demand	Anodyne	CPT2	44	34
C[C@@H](O)[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643478	EG	On-Demand	Anodyne	PREP	41	34
C[C@H](O)[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643479	EG	On-Demand	Anodyne	COLA	123	42
C[C@H](O)[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643479	EG	On-Demand	Anodyne	CPT1A	106	42
C[C@H](O)[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643479	EG	On-Demand	Anodyne	CPT2	44	34
C[C@H](O)[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450643479	EG	On-Demand	Anodyne	PREP	41	34
Cc1ccc(NC(=O)N2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450643487	EH	On-Demand	Anodyne	EPHX2	40	37
Cc1ccc(NC(=O)N2CCN(C[C@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450643487	EH	On-Demand	Anodyne	TRPM8	24	41
Cc1ccc(NC(=O)N2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450643488	EH	On-Demand	Anodyne	EPHX2	40	37
Cc1ccc(NC(=O)N2CCN(C[C@@H]3CCC(F)(F)C3)CC2)cc1	ZINC000450643488	EH	On-Demand	Anodyne	TRPM8	24	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CC[C@H]1C1CC1	ZINC000450643489	GG	On-Demand	Bother	CASP3	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CC[C@@H]1C1CC1	ZINC000450643490	GG	On-Demand	Bother	CASP3	0	40
CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450643499	GI	On-Demand	Anodyne	TIMP3	53	33
CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450643500	GI	On-Demand	Anodyne	TIMP3	53	33
CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450643501	GI	On-Demand	Anodyne	TIMP3	53	33
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450643502	GI	On-Demand	Anodyne	TIMP3	53	33
C[C@H](c1ccccc1)[C@H](O)CN(C)CCc1ccncc1	ZINC000450643542	CF	On-Demand	Anodyne	AOC3	25	40
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCc1ccncc1	ZINC000450643543	CF	On-Demand	Anodyne	AOC3	25	40
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCc1ccncc1	ZINC000450643544	CF	On-Demand	Anodyne	AOC3	25	40
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCc1ccncc1	ZINC000450643545	CF	On-Demand	Anodyne	AOC3	25	40
CCCN(CCc1cccs1)C(=O)CCc1nc2cnccc2[nH]1	ZINC000450643546	EG	On-Demand	Anodyne	WNT3A	39	43
Cc1nn(C)cc1CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450643552	FH	On-Demand	Anodyne	DRD1	0	50
Cc1nn(C)cc1CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450643552	FH	On-Demand	Anodyne	DRD4	25	50
CC(C)C[C@@H]1C[C@H]1C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450643553	DI	On-Demand	Anodyne	NAMPT	51	34
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CC2(F)F)C1	ZINC000450643579	CE	On-Demand	Anodyne	PREP	17	49
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2CC2(F)F)C1	ZINC000450643584	CE	On-Demand	Anodyne	PREP	17	49
COC(=O)c1cc(-c2ccccc2CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)[nH]n1	ZINC000450643585	FF	On-Demand	Anodyne	MT-CYB	44	31
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CC2(F)F)C1	ZINC000450643591	CE	On-Demand	Anodyne	PREP	17	49
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2CC2(F)F)C1	ZINC000450643597	CE	On-Demand	Anodyne	PREP	17	49
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450643603	DF	On-Demand	Mild	NQO2	40	45
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450643603	DF	On-Demand	Mild	MTR1B_CHICK	0	52
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450643603	DF	On-Demand	Mild	MTNR1A	24	44
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450643603	DF	On-Demand	Mild	EBP	17	43
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450643604	DF	On-Demand	Mild	NQO2	40	45
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450643604	DF	On-Demand	Mild	MTR1B_CHICK	0	52
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450643604	DF	On-Demand	Mild	MTNR1A	24	44
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450643604	DF	On-Demand	Mild	EBP	17	43
Cc1cc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)n2ncnc2n1	ZINC000450643611	GH	On-Demand	Anodyne	DHOD	0	41
Cc1cc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)n2ncnc2n1	ZINC000450643617	GH	On-Demand	Anodyne	DHOD	0	41
Cc1ccc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1NC(=O)CCN(C)C	ZINC000450643650	GG	On-Demand	Anodyne	SCN10A	17	40
COC(=O)[C@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@H](C)O	ZINC000450643651	GD	On-Demand	Anodyne	PDGFRB	0	46
COC(=O)[C@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@H](C)O	ZINC000450643651	GD	On-Demand	Anodyne	CPT1A	45	31
COC(=O)[C@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@H](C)O	ZINC000450643651	GD	On-Demand	Anodyne	PLK1	61	35
COC(=O)[C@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@H](C)O	ZINC000450643651	GD	On-Demand	Anodyne	HPGD	44	57
COC(=O)[C@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@@H](C)O	ZINC000450643652	GD	On-Demand	Anodyne	PDGFRB	0	46
COC(=O)[C@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@@H](C)O	ZINC000450643652	GD	On-Demand	Anodyne	CPT1A	45	31
COC(=O)[C@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@@H](C)O	ZINC000450643652	GD	On-Demand	Anodyne	PLK1	61	35
COC(=O)[C@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@@H](C)O	ZINC000450643652	GD	On-Demand	Anodyne	HPGD	44	57
COC(=O)[C@@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@H](C)O	ZINC000450643653	GD	On-Demand	Anodyne	PDGFRB	0	46
COC(=O)[C@@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@H](C)O	ZINC000450643653	GD	On-Demand	Anodyne	CPT1A	45	31
COC(=O)[C@@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@H](C)O	ZINC000450643653	GD	On-Demand	Anodyne	PLK1	61	35
COC(=O)[C@@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@H](C)O	ZINC000450643653	GD	On-Demand	Anodyne	HPGD	44	57
COC(=O)[C@@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@@H](C)O	ZINC000450643655	GD	On-Demand	Anodyne	PDGFRB	0	46
COC(=O)[C@@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@@H](C)O	ZINC000450643655	GD	On-Demand	Anodyne	CPT1A	45	31
COC(=O)[C@@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@@H](C)O	ZINC000450643655	GD	On-Demand	Anodyne	PLK1	61	35
COC(=O)[C@@H](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)[C@@H](C)O	ZINC000450643655	GD	On-Demand	Anodyne	HPGD	44	57
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	CHRM2	15	47
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	HTR1A	29	47
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	DRD2	42	47
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	TSHR	54	32
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	DRD4	55	43
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	ACHE	45	45
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	HRH1	15	41
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	DRD3	29	40
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	CHRM3	24	47
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	TACR1	15	40
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	SIGMAR1	47	52
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	SSTR5	64	41
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	CCR3	54	43
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	MCHR1	34	44
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	CCR8	44	48
COc1ccccc1COC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450643656	FI	On-Demand	Anodyne	MBTPS1	47	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450643691	EG	On-Demand	Anodyne	CASR	0	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450643691	EG	On-Demand	Anodyne	NQO2	23	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450643691	EG	On-Demand	Anodyne	MTNR1A	73	43
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450643691	EG	On-Demand	Anodyne	MTNR1B	67	39
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2)c(OC)c1	ZINC000450643693	EG	On-Demand	Anodyne	CASR	0	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2)c(OC)c1	ZINC000450643693	EG	On-Demand	Anodyne	NQO2	23	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2)c(OC)c1	ZINC000450643693	EG	On-Demand	Anodyne	MTNR1A	73	43
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2)c(OC)c1	ZINC000450643693	EG	On-Demand	Anodyne	MTNR1B	67	39
COC(=O)c1ccc(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450643695	FF	On-Demand	Anodyne	RHODESAIN	0	46
COC(=O)c1ccc(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450643695	FF	On-Demand	Anodyne	SFRP1	56	33
COC(=O)c1ccc(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450643695	FF	On-Demand	Anodyne	WNT3	50	32
COC(=O)c1ccc(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450643697	FF	On-Demand	Anodyne	RHODESAIN	0	46
COC(=O)c1ccc(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450643697	FF	On-Demand	Anodyne	SFRP1	56	33
COC(=O)c1ccc(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450643697	FF	On-Demand	Anodyne	WNT3	50	32
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450643698	FF	On-Demand	Anodyne	P2RY12	55	33
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450643702	FF	On-Demand	Anodyne	P2RY12	55	33
O=C(NCC(=O)N1CCOCC1)c1cccnc1-n1cc(Br)cn1	ZINC000450643704	GC	On-Demand	Anodyne	FAP	0	40
COCc1nn(C)cc1C(=O)NCc1ccccc1-c1cc(C(=O)OC)n[nH]1	ZINC000450643705	GD	On-Demand	Anodyne	MT-CYB	54	36
Cc1cnc(CCCC(=O)NCc2cccc(-c3cccnc3)c2)o1	ZINC000450643714	EH	On-Demand	Anodyne	PTAFR	23	40
Cc1cnc(CCCC(=O)NCc2cccc(-c3cccnc3)c2)o1	ZINC000450643714	EH	On-Demand	Anodyne	SUCNR1	69	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643728	EI	On-Demand	Anodyne	NQO2	37	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643728	EI	On-Demand	Anodyne	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643728	EI	On-Demand	Anodyne	PPARD	47	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643728	EI	On-Demand	Anodyne	MTNR1A	21	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643728	EI	On-Demand	Anodyne	EBP	15	43
C[C@@H](CCCCO)Nc1ncnc2ccc(I)cc12	ZINC000450643734	FG	On-Demand	Anodyne	CD38	31	40
C[C@H](CCCCO)Nc1ncnc2ccc(I)cc12	ZINC000450643735	FG	On-Demand	Anodyne	CD38	31	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643737	EI	On-Demand	Anodyne	NQO2	37	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643737	EI	On-Demand	Anodyne	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643737	EI	On-Demand	Anodyne	PPARD	47	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643737	EI	On-Demand	Anodyne	MTNR1A	21	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1scnc1C(C)C	ZINC000450643737	EI	On-Demand	Anodyne	EBP	15	43
Cc1ccc(NC(=O)c2cc3ccncc3s2)cc1NC(=O)CCN(C)C	ZINC000450643774	GH	On-Demand	Anodyne	LDLR	0	41
CC[C@@H]1C[C@H]1C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450643780	CG	On-Demand	Anodyne	NAMPT	52	34
CCOC(=O)c1ccc(CN(C)CC2CCN(c3ccncc3)CC2)nc1	ZINC000450643786	FG	On-Demand	Anodyne	F10	17	45
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@@H]1O	ZINC000450643790	DE	On-Demand	Anodyne	FASN	25	41
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@@H]1O	ZINC000450643790	DE	On-Demand	Anodyne	L3MBTL1	0	41
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@@H]1O	ZINC000450643790	DE	On-Demand	Anodyne	L3MBTL3	53	37
CC(C)(C)[C@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@@H]1O	ZINC000450643791	DE	On-Demand	Anodyne	FASN	25	41
CC(C)(C)[C@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@@H]1O	ZINC000450643791	DE	On-Demand	Anodyne	L3MBTL1	0	41
CC(C)(C)[C@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@@H]1O	ZINC000450643791	DE	On-Demand	Anodyne	L3MBTL3	53	37
C[C@@H](CC(F)(F)F)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450643792	EH	On-Demand	Anodyne	ROCK2	33	40
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@H]1O	ZINC000450643793	DE	On-Demand	Anodyne	FASN	25	41
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@H]1O	ZINC000450643793	DE	On-Demand	Anodyne	L3MBTL1	0	41
CC(C)(C)[C@@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@H]1O	ZINC000450643793	DE	On-Demand	Anodyne	L3MBTL3	53	37
C[C@H](CC(F)(F)F)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450643794	EH	On-Demand	Anodyne	ROCK2	33	40
CC(C)(C)[C@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@H]1O	ZINC000450643795	DE	On-Demand	Anodyne	FASN	25	41
CC(C)(C)[C@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@H]1O	ZINC000450643795	DE	On-Demand	Anodyne	L3MBTL1	0	41
CC(C)(C)[C@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)C[C@H]1O	ZINC000450643795	DE	On-Demand	Anodyne	L3MBTL3	53	37
CC1(C)OCC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450643804	DG	On-Demand	Anodyne	EGFR	45	40
CC1(C)OCC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450643804	DG	On-Demand	Anodyne	CD38	61	39
CC1(C)OCC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450643805	DG	On-Demand	Anodyne	EGFR	45	40
CC1(C)OCC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450643805	DG	On-Demand	Anodyne	CD38	61	39
Clc1ccc(N2CCCN(Cc3cc[nH]n3)CC2)cc1Cl	ZINC000450643806	EG	On-Demand	Anodyne	DRD1	0	50
Clc1ccc(N2CCCN(Cc3cc[nH]n3)CC2)cc1Cl	ZINC000450643806	EG	On-Demand	Anodyne	DRD4	27	50
Clc1ccc(N2CCCN(Cc3cc[nH]n3)CC2)cc1Cl	ZINC000450643806	EG	On-Demand	Anodyne	BCL2A1	47	39
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	HTR2A	18	43
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	PDE4B	17	44
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	COLA	78	40
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	CPT1A	73	40
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	CPT2	47	36
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	GRM4	22	43
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	CPT1B	63	37
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	SCN10A	40	42
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	CSF1R	28	42
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	ENPP1	81	45
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	USP7	42	35
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	USP47	52	35
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	KCNK3	60	38
COc1cc(NC(=O)c2cncc(Cl)c2)ccc1OC(C)C	ZINC000450643839	DH	On-Demand	Anodyne	KCNK9	46	36
CN(CCN1CCC=C(F)C1)Cc1ccccc1	ZINC000450643846	BF	On-Demand	Anodyne	SIGMAR1	34	47
OC[C@@H]1CC[C@H](Nc2cc(N[C@H]3CC[C@@H](CO)C3)nc(-c3ccccc3)n2)C1	ZINC000450643852	GF	On-Demand	Anodyne	VCP	62	40
OC[C@@H]1CC[C@H](Nc2cc(N[C@H]3CC[C@@H](CO)C3)nc(-c3ccccc3)n2)C1	ZINC000450643852	GF	On-Demand	Anodyne	PKNB	32	42
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ncnc2cc1F	ZINC000450643855	CE	On-Demand	Anodyne	EGFR	40	46
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ncnc2cc1F	ZINC000450643855	CE	On-Demand	Anodyne	PDE3A	41	32
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ncnc2cc1F	ZINC000450643855	CE	On-Demand	Anodyne	FGFR1	22	44
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ncnc2cc1F	ZINC000450643855	CE	On-Demand	Anodyne	FLT1	25	44
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ncnc2cc1F	ZINC000450643855	CE	On-Demand	Anodyne	PDE3B	61	32
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ncnc2cc1F	ZINC000450643855	CE	On-Demand	Anodyne	EPHA2	46	36
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ncnc2cc1F	ZINC000450643855	CE	On-Demand	Anodyne	EHMT2	40	33
c1nc(N2CC[C@@H]2C2CC2)c2c3c(sc2n1)CCC3	ZINC000450643857	CG	On-Demand	Anodyne	RBP4	18	43
c1nc(N2CC[C@H]2C2CC2)c2c3c(sc2n1)CCC3	ZINC000450643858	CG	On-Demand	Anodyne	RBP4	18	43
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@H]2CC[C@@H](CO)C2)nc1	ZINC000450643864	EH	On-Demand	Anodyne	GRM5	18	41
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@H]2CC[C@@H](CO)C2)nc1	ZINC000450643864	EH	On-Demand	Anodyne	TYK2	53	35
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@H]2CC[C@@H](CO)C2)nc1	ZINC000450643864	EH	On-Demand	Anodyne	BTK	16	40
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@H]2CC[C@@H](CO)C2)nc1	ZINC000450643864	EH	On-Demand	Anodyne	LUCI_LUCLA	23	40
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@H]2CC[C@@H](CO)C2)nc1	ZINC000450643864	EH	On-Demand	Anodyne	KCNK3	55	40
FC(F)(F)c1ccc(O[C@H]2CCN(Cc3cnns3)C2)nc1	ZINC000450643868	EF	On-Demand	Anodyne	LIPG	29	48
FC(F)(F)c1ccc(O[C@@H]2CCN(Cc3cnns3)C2)nc1	ZINC000450643869	EF	On-Demand	Anodyne	LIPG	29	48
COc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OC(C)C	ZINC000450643873	GH	On-Demand	Anodyne	TSHR	56	34
COc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OC(C)C	ZINC000450643873	GH	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OC(C)C	ZINC000450643873	GH	On-Demand	Anodyne	GRM4	21	41
COc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OC(C)C	ZINC000450643873	GH	On-Demand	Anodyne	ABCB1	15	41
COc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OC(C)C	ZINC000450643873	GH	On-Demand	Anodyne	ABCG2	41	38
COc1cc(NC(=O)c2cn(CCc3ccccc3)nn2)ccc1OC(C)C	ZINC000450643873	GH	On-Demand	Anodyne	ENPP1	77	37
COc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OC(C)C	ZINC000450643876	GH	On-Demand	Anodyne	COLA	69	36
COc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OC(C)C	ZINC000450643876	GH	On-Demand	Anodyne	CPT1A	67	36
COc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OC(C)C	ZINC000450643876	GH	On-Demand	Anodyne	CPT2	47	36
COc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OC(C)C	ZINC000450643876	GH	On-Demand	Anodyne	CPT1B	50	35
COc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OC(C)C	ZINC000450643876	GH	On-Demand	Anodyne	ENPP1	61	32
COc1cc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccc1OC(C)C	ZINC000450643876	GH	On-Demand	Anodyne	KCNK3	70	40
OC[C@@H]1CC[C@H](Nc2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450643879	EI	On-Demand	Anodyne	ADRB3	25	55
c1ccc(-c2nc3c(c(N4CC[C@H]4C4CC4)n2)CCC3)nc1	ZINC000450643885	CG	On-Demand	Anodyne	METAP1	15	42
c1ccc(-c2nc3c(c(N4CC[C@@H]4C4CC4)n2)CCC3)nc1	ZINC000450643886	CG	On-Demand	Anodyne	METAP1	15	42
COc1ccc(-c2ccnc(N[C@H]3CC[C@@H](CO)C3)n2)cc1	ZINC000450643899	CF	On-Demand	Anodyne	MAPK1	60	44
COc1ccc(-c2ccnc(N[C@H]3CC[C@@H](CO)C3)n2)cc1	ZINC000450643899	CF	On-Demand	Anodyne	MAPK8	0	43
COc1ccc(-c2ccnc(N[C@H]3CC[C@@H](CO)C3)n2)cc1	ZINC000450643899	CF	On-Demand	Anodyne	VCP	32	44
COc1ccc(CNC(=O)CCN2CCC(c3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000450643901	GF	On-Demand	Anodyne	DRD2	19	40
COc1ccc(CNC(=O)CCN2CCC(c3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000450643901	GF	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCC(c3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000450643901	GF	On-Demand	Anodyne	PDGFRB	31	40
COc1ccc(CNC(=O)CCN2CCC(c3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000450643901	GF	On-Demand	Anodyne	HTR7	33	41
COc1ccc(CNC(=O)CCN2CCC(c3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000450643901	GF	On-Demand	Anodyne	CARM1	56	34
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	DRD4	38	41
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	ACHE	25	44
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	OPRL1	17	41
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	LTA4H	22	41
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	HRH3	18	43
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	SSTR5	42	34
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	CCR5	18	44
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	AKT2	31	45
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	PLD1	68	35
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	PLD2	55	34
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	AKT1	15	45
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	MCHR1	25	53
CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450643905	FJ	On-Demand	Anodyne	FPR2	33	50
Cc1c([N+](=O)[O-])cnc(N[C@H]2CC[C@@H](CO)C2)c1Br	ZINC000450643907	EF	On-Demand	Bother	PRKCQ	45	36
CCc1nc2ccccc2n1C1CCN(CC2(C#N)CCC2)CC1	ZINC000450643915	DH	On-Demand	Mild	FPR2	28	41
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)CCCCO)c([N+](=O)[O-])c1	ZINC000450643927	FF	On-Demand	Bother	COLA	58	33
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)CCCCO)c([N+](=O)[O-])c1	ZINC000450643927	FF	On-Demand	Bother	BCL2L1	73	33
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)CCCCO)c([N+](=O)[O-])c1	ZINC000450643927	FF	On-Demand	Bother	BCL2	41	31
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)CCCCO)c([N+](=O)[O-])c1	ZINC000450643928	FF	On-Demand	Bother	COLA	58	33
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)CCCCO)c([N+](=O)[O-])c1	ZINC000450643928	FF	On-Demand	Bother	BCL2L1	73	33
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)CCCCO)c([N+](=O)[O-])c1	ZINC000450643928	FF	On-Demand	Bother	BCL2	41	31
CCC[C@@H](O)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450643929	DF	On-Demand	Anodyne	LIPG	47	50
CCC[C@@H](O)CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450643930	DF	On-Demand	Anodyne	LIPG	47	50
CCC[C@H](O)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450643931	DF	On-Demand	Anodyne	LIPG	47	50
Cc1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1NC(=O)CCN(C)C	ZINC000450643972	FG	On-Demand	Anodyne	LDLR	0	42
C[C@@H](CCCCO)Nc1cc(C(F)F)nc2ccc(Cl)cc12	ZINC000450644007	EJ	On-Demand	Anodyne	RBP_CHICK	0	40
C[C@H](CCCCO)Nc1cc(C(F)F)nc2ccc(Cl)cc12	ZINC000450644008	EJ	On-Demand	Anodyne	RBP_CHICK	0	40
Cc1ccc(NC(=O)CCCC(=O)C2CC2)cc1NC(=O)CCN(C)C	ZINC000450644016	FF	On-Demand	Anodyne	LDLR	0	47
Cc1ccc(NC(=O)CCCC(=O)C2CC2)cc1NC(=O)CCN(C)C	ZINC000450644016	FF	On-Demand	Anodyne	MSR1	0	41
C[C@H]1CCN(Cc2cc(CN3CC[C@@H](C)[C@H](O)C3)ccc2F)C[C@H]1O	ZINC000450644022	FE	On-Demand	Anodyne	SIGMAR1	24	42
C[C@H]1CCN(Cc2cc(CN3CC[C@@H](C)[C@H](O)C3)ccc2F)C[C@H]1O	ZINC000450644022	FE	On-Demand	Anodyne	MLNR	58	40
C[C@H]1CCN(Cc2cc(CN3CC[C@@H](C)[C@H](O)C3)ccc2F)C[C@@H]1O	ZINC000450644023	FE	On-Demand	Anodyne	SIGMAR1	24	42
C[C@H]1CCN(Cc2cc(CN3CC[C@@H](C)[C@H](O)C3)ccc2F)C[C@@H]1O	ZINC000450644023	FE	On-Demand	Anodyne	MLNR	58	40
C[C@H]1CCN(Cc2cc(CN3CC[C@@H](C)[C@@H](O)C3)ccc2F)C[C@@H]1O	ZINC000450644024	FE	On-Demand	Anodyne	SIGMAR1	24	42
C[C@H]1CCN(Cc2cc(CN3CC[C@@H](C)[C@@H](O)C3)ccc2F)C[C@@H]1O	ZINC000450644024	FE	On-Demand	Anodyne	MLNR	58	40
C[C@H]1CCN(Cc2cc(CN3CC[C@@H](C)[C@@H](O)C3)ccc2F)C[C@H]1O	ZINC000450644025	FE	On-Demand	Anodyne	SIGMAR1	24	42
C[C@H]1CCN(Cc2cc(CN3CC[C@@H](C)[C@@H](O)C3)ccc2F)C[C@H]1O	ZINC000450644025	FE	On-Demand	Anodyne	MLNR	58	40
COCCOC[C@@H](O)CN1CCCCc2cc(Br)ccc21	ZINC000450644030	FF	On-Demand	Anodyne	HSP90AB1	35	43
COCCOC[C@H](O)CN1CCCCc2cc(Br)ccc21	ZINC000450644031	FF	On-Demand	Anodyne	HSP90AB1	35	43
COc1cc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450644032	FF	On-Demand	Anodyne	CCR1	25	42
COc1cc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450644032	FF	On-Demand	Anodyne	UTS2R	33	44
COc1cc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)ccc1Cl	ZINC000450644032	FF	On-Demand	Anodyne	CXCR3	22	43
COc1cc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450644033	FF	On-Demand	Anodyne	CCR1	25	42
COc1cc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450644033	FF	On-Demand	Anodyne	UTS2R	33	44
COc1cc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)ccc1Cl	ZINC000450644033	FF	On-Demand	Anodyne	CXCR3	22	43
COc1ccc(CNC(=O)CCN(C(C)C)C(C)C)c(OC)c1	ZINC000450644044	DF	On-Demand	Anodyne	MTNR1A	65	44
COc1ccc(CNC(=O)CCN(C(C)C)C(C)C)c(OC)c1	ZINC000450644044	DF	On-Demand	Anodyne	MTNR1B	52	39
CC(=O)CCCCCSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000450644049	DJ	On-Demand	Anodyne	ALOX15	28	45
CC(=O)CCCCCSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000450644049	DJ	On-Demand	Anodyne	TERT	22	42
CC(=O)CCCCCSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000450644049	DJ	On-Demand	Anodyne	CPB	0	42
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)[nH]c1C	ZINC000450644054	GE	On-Demand	Anodyne	NPY2R	15	44
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)[nH]c1C	ZINC000450644054	GE	On-Demand	Anodyne	KCNK3	81	35
CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)[nH]c1C	ZINC000450644054	GE	On-Demand	Anodyne	KCNK9	48	35
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450644067	FG	On-Demand	Anodyne	RHOA	0	49
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450644067	FG	On-Demand	Anodyne	L3MBTL1	0	41
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450644067	FG	On-Demand	Anodyne	L3MBTL3	57	41
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450644067	FG	On-Demand	Anodyne	KCNK3	86	38
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450644067	FG	On-Demand	Anodyne	KCNK9	55	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644070	DH	On-Demand	Anodyne	ADRB3	0	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644070	DH	On-Demand	Anodyne	ABCB1	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	ACHE	15	52
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	SLC6A3	20	50
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	GRIN2B	61	51
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	ADRB3	0	51
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	SIGMAR1	22	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	CCR3	17	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	CHRNA7	45	38
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	C3AR1	38	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	ABCB1	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	GRIN2C	25	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644071	DH	On-Demand	Anodyne	ACHP_LYMST	25	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	ACHE	15	52
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	SLC6A3	20	50
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	GRIN2B	61	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	ADRB3	0	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	SIGMAR1	22	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	CCR3	17	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	CHRNA7	45	38
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	C3AR1	38	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	ABCB1	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	GRIN2C	25	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644072	DH	On-Demand	Anodyne	ACHP_LYMST	25	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644073	DH	On-Demand	Anodyne	ADRB3	0	51
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644073	DH	On-Demand	Anodyne	ABCB1	0	42
CCOC(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)nc1	ZINC000450644077	FF	On-Demand	Anodyne	SRD5A1	0	40
CCOC(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)nc1	ZINC000450644077	FF	On-Demand	Anodyne	SRD5A2	0	40
CCOC(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)nc1	ZINC000450644077	FF	On-Demand	Anodyne	NOD1	30	48
CCOC(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)nc1	ZINC000450644077	FF	On-Demand	Anodyne	NOD2	47	48
COC(=O)c1csc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450644082	EF	On-Demand	Anodyne	ACHE	22	44
COC(=O)c1csc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450644082	EF	On-Demand	Anodyne	SIGMAR1	26	41
COC(=O)c1csc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450644082	EF	On-Demand	Anodyne	CCR3	42	42
COC(=O)c1csc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450644082	EF	On-Demand	Anodyne	CHRNA7	41	42
COC(=O)c1csc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450644082	EF	On-Demand	Anodyne	C3AR1	40	38
COC(=O)c1csc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450644082	EF	On-Demand	Anodyne	ACHP_LYMST	22	40
COC(=O)C1(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644087	CE	On-Demand	Anodyne	GRIN2B	61	40
COC(=O)C1(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644087	CE	On-Demand	Anodyne	SIGMAR1	24	49
COC(=O)C1(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644087	CE	On-Demand	Anodyne	NPY2R	51	36
COC(=O)C1(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644087	CE	On-Demand	Anodyne	CCR3	41	39
COC(=O)C1(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644087	CE	On-Demand	Anodyne	CHRNA7	45	44
COC(=O)C1(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644087	CE	On-Demand	Anodyne	C3AR1	46	42
COC(=O)C1(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644087	CE	On-Demand	Anodyne	ACHP_LYMST	24	43
CCC(CC)Oc1ccc(C(=O)N2CCN([C@@H](C)c3nccs3)CC2)cc1	ZINC000450644098	GI	On-Demand	Anodyne	SLC6A7	0	40
CCC(CC)Oc1ccc(C(=O)N2CCN([C@H](C)c3nccs3)CC2)cc1	ZINC000450644099	GI	On-Demand	Anodyne	SLC6A7	0	40
CC(=O)[C@](C)(O)CN(C)CCC1CCN(c2ccncc2)CC1	ZINC000450644104	DD	On-Demand	Anodyne	SSTR1	25	47
CCOC(=O)c1sc(Sc2nc(CC)ns2)nc1C	ZINC000450644105	DG	On-Demand	Anodyne	DHODH	21	41
CC(=O)[C@@](C)(O)CN(C)CCC1CCN(c2ccncc2)CC1	ZINC000450644106	DD	On-Demand	Anodyne	SSTR1	25	47
Cc1[nH]c(C#N)cc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450644108	FE	On-Demand	Mild	KCNK3	75	35
Cc1[nH]c(C#N)cc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450644108	FE	On-Demand	Mild	KCNK9	40	32
Cc1[nH]c(C#N)cc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450644109	FE	On-Demand	Mild	KCNK3	75	35
Cc1[nH]c(C#N)cc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450644109	FE	On-Demand	Mild	KCNK9	40	32
COC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1C)[C@H](C)O	ZINC000450644114	DD	On-Demand	Anodyne	SORT1	15	41
COC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1C)[C@@H](C)O	ZINC000450644115	DD	On-Demand	Anodyne	SORT1	15	41
COC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1C)[C@H](C)O	ZINC000450644116	DD	On-Demand	Anodyne	SORT1	15	41
COC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1C)[C@@H](C)O	ZINC000450644117	DD	On-Demand	Anodyne	SORT1	15	41
CN(CCN(C)c1nc(C(C)(C)C)ns1)c1ccc(S(N)(=O)=O)cc1	ZINC000450644118	GE	On-Demand	Anodyne	CA2	15	40
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644122	EG	On-Demand	Anodyne	CCKAR	0	42
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644122	EG	On-Demand	Anodyne	NPY2R	41	36
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644122	EG	On-Demand	Anodyne	L3MBTL1	0	41
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644122	EG	On-Demand	Anodyne	L3MBTL3	50	39
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644122	EG	On-Demand	Anodyne	MBTD1	0	40
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644123	EG	On-Demand	Anodyne	CCKAR	0	42
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644123	EG	On-Demand	Anodyne	NPY2R	41	36
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644123	EG	On-Demand	Anodyne	L3MBTL1	0	41
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644123	EG	On-Demand	Anodyne	L3MBTL3	50	39
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644123	EG	On-Demand	Anodyne	MBTD1	0	40
CCOC(=O)c1sc(Sc2nc(C3CC3)ns2)nc1C	ZINC000450644140	EH	On-Demand	Anodyne	DHODH	17	40
Cc1cccc(F)c1NC(=O)CCCC(=O)C1CC1	ZINC000450644142	CG	On-Demand	Anodyne	ACAT	0	48
COC[C@H](C)n1c(SCc2cccc(C(C)=O)c2)nc2ccccc2c1=O	ZINC000450644154	GI	On-Demand	Anodyne	PTGDR2	15	54
COC[C@@H](C)n1c(SCc2cccc(C(C)=O)c2)nc2ccccc2c1=O	ZINC000450644156	GI	On-Demand	Anodyne	PTGDR2	15	54
CC1(C)OCC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450644167	DH	On-Demand	Bother	MAOA	0	54
CC1(C)OCC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450644167	DH	On-Demand	Bother	MAOB	22	54
CC1(C)OCC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450644168	DH	On-Demand	Bother	MAOA	0	54
CC1(C)OCC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450644168	DH	On-Demand	Bother	MAOB	22	54
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	OPRK1	35	41
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	KCNH2	15	40
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	TACR2	46	34
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	SIGMAR1	28	58
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	ABCC1	45	33
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	TACR3	43	35
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	DNAE	53	32
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	CACNA1G	16	40
COC(=O)C1(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)CC1	ZINC000450644171	FG	On-Demand	Anodyne	KCNJ1	47	35
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc2cnccc2c1	ZINC000450644178	EE	On-Demand	Anodyne	AKT1	24	46
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc2cnccc2c1	ZINC000450644179	EE	On-Demand	Anodyne	AKT1	24	46
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450644180	GD	On-Demand	Anodyne	CA2	26	41
COc1cc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644183	GH	On-Demand	Anodyne	ACHE	16	46
COc1cc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644183	GH	On-Demand	Anodyne	AVPR1B	40	34
COc1cc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644183	GH	On-Demand	Anodyne	HRH3	17	53
COc1cc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644183	GH	On-Demand	Anodyne	SSTR5	48	39
COc1cc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644183	GH	On-Demand	Anodyne	MCHR2	47	33
COc1cc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644183	GH	On-Demand	Anodyne	CACNA1G	15	41
COc1cc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644183	GH	On-Demand	Anodyne	CCR8	40	39
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450644184	GD	On-Demand	Anodyne	CA2	26	41
COc1cc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644185	GH	On-Demand	Anodyne	ACHE	16	46
COc1cc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644185	GH	On-Demand	Anodyne	AVPR1B	40	34
COc1cc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644185	GH	On-Demand	Anodyne	HRH3	17	53
COc1cc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644185	GH	On-Demand	Anodyne	SSTR5	48	39
COc1cc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644185	GH	On-Demand	Anodyne	MCHR2	47	33
COc1cc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644185	GH	On-Demand	Anodyne	CACNA1G	15	41
COc1cc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)ccc1Cl	ZINC000450644185	GH	On-Demand	Anodyne	CCR8	40	39
CCC[C@H](O)CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450644190	DF	On-Demand	Anodyne	LIPG	47	50
OC[C@@H]1CC[C@H](Nc2cc(C(F)(F)F)ccn2)C1	ZINC000450644193	CF	On-Demand	Anodyne	PRKD1	30	40
OC[C@@H]1CC[C@H](Nc2cc(C(F)(F)F)ccn2)C1	ZINC000450644193	CF	On-Demand	Anodyne	PKD2	0	40
CC[C@H]1CC[C@H](C)N1C[C@H](O)Cc1ccccc1	ZINC000450644194	BF	On-Demand	Anodyne	SLC18A2	78	47
CC[C@H]1CC[C@H](C)N1C[C@H](O)Cc1ccccc1	ZINC000450644194	BF	On-Demand	Anodyne	VACHT_TETCF	0	40
CC[C@H]1CC[C@H](C)N1C[C@H](O)Cc1ccccc1	ZINC000450644194	BF	On-Demand	Anodyne	SLC18A3	15	40
Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1NC(=O)CCN(C)C	ZINC000450644201	GG	On-Demand	Anodyne	LCK	17	44
Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1NC(=O)CCN(C)C	ZINC000450644201	GG	On-Demand	Anodyne	MAPK14	31	44
Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1NC(=O)CCN(C)C	ZINC000450644201	GG	On-Demand	Anodyne	TEK	42	37
Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1NC(=O)CCN(C)C	ZINC000450644201	GG	On-Demand	Anodyne	BTK	24	44
Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1NC(=O)CCN(C)C	ZINC000450644201	GG	On-Demand	Anodyne	BRAF	21	41
Cc1ccc(NC(=O)c2ccnc(OC(F)F)c2)cc1NC(=O)CCN(C)C	ZINC000450644201	GG	On-Demand	Anodyne	KCNK3	43	44
CC[C@H]1CC[C@@H](C)N1C[C@H](O)Cc1ccccc1	ZINC000450644202	BF	On-Demand	Anodyne	SLC18A2	78	47
CC[C@H]1CC[C@@H](C)N1C[C@H](O)Cc1ccccc1	ZINC000450644202	BF	On-Demand	Anodyne	VACHT_TETCF	0	40
CC[C@H]1CC[C@@H](C)N1C[C@H](O)Cc1ccccc1	ZINC000450644202	BF	On-Demand	Anodyne	SLC18A3	15	40
COc1cc(NC(=O)c2cnc(C3CC3)nc2)ccc1OC(C)C	ZINC000450644221	EG	On-Demand	Anodyne	COLA	46	35
COc1cc(NC(=O)c2cnc(C3CC3)nc2)ccc1OC(C)C	ZINC000450644221	EG	On-Demand	Anodyne	CPT1A	40	34
COc1cc(NC(=O)c2cnc(C3CC3)nc2)ccc1OC(C)C	ZINC000450644221	EG	On-Demand	Anodyne	IMPDH2	0	40
COc1cc(NC(=O)c2cnc(C3CC3)nc2)ccc1OC(C)C	ZINC000450644221	EG	On-Demand	Anodyne	ENPP1	62	36
C[C@H](O)CCN1CCC(OCCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000450644223	DD	On-Demand	Anodyne	ERG2	17	40
C[C@H](O)CCN1CCC(OCCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000450644223	DD	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
C[C@H](O)CCN1CCC(OCCN2C[C@H](C)O[C@H](C)C2)CC1	ZINC000450644226	DD	On-Demand	Anodyne	ERG2	17	40
C[C@H](O)CCN1CCC(OCCN2C[C@H](C)O[C@H](C)C2)CC1	ZINC000450644226	DD	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
C[C@H](O)CCN1CCC(OCCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000450644227	DD	On-Demand	Anodyne	ERG2	17	40
C[C@H](O)CCN1CCC(OCCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000450644227	DD	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
CCS(=O)(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450644228	FH	On-Demand	Bother	COLA	22	40
CCS(=O)(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450644228	FH	On-Demand	Bother	MMP2	17	42
CCS(=O)(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450644228	FH	On-Demand	Bother	MMP8	35	42
CCS(=O)(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450644228	FH	On-Demand	Bother	MMP9	17	42
CCS(=O)(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450644228	FH	On-Demand	Bother	MMP1	32	42
CCS(=O)(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450644228	FH	On-Demand	Bother	SLC27A4	42	31
C[C@H]1CN(CCOC2CCN(CC[C@@H](C)O)CC2)C[C@@H](C)O1	ZINC000450644229	DD	On-Demand	Anodyne	ERG2	17	40
C[C@H]1CN(CCOC2CCN(CC[C@@H](C)O)CC2)C[C@@H](C)O1	ZINC000450644229	DD	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450644240	EC	On-Demand	Anodyne	PDE4D	15	41
Cc1nnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1C	ZINC000450644244	FH	On-Demand	Anodyne	DRD3	0	42
Cc1nnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1C	ZINC000450644244	FH	On-Demand	Anodyne	SIGMAR1	42	38
CC1(O)CC(C(=O)NCc2ccc(OCc3ccccc3F)cc2)C1	ZINC000450644252	EG	On-Demand	Anodyne	GYS1	40	32
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450644253	EC	On-Demand	Anodyne	PDE4D	15	41
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	PTPN2	0	40
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	ACACA	31	40
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	SLC15A1	0	40
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	ACACB	18	40
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	CDC25B	27	43
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	MMP3	19	42
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	GYS1	50	32
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	POL	0	42
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	FFAR4	41	35
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	PDS	45	34
CC(=O)N[C@H](C(=O)NCc1ccc(OCc2ccccc2F)cc1)C(C)(C)C	ZINC000450644255	GH	On-Demand	Anodyne	VHL	43	35
Cc1nnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1C	ZINC000450644270	FH	On-Demand	Anodyne	DRD3	0	42
Cc1nnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1C	ZINC000450644270	FH	On-Demand	Anodyne	SIGMAR1	42	38
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450644274	FF	On-Demand	Anodyne	TRPV1	38	40
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450644274	FF	On-Demand	Anodyne	NCE103	27	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450644274	FF	On-Demand	Anodyne	CAN2	0	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450644276	FF	On-Demand	Anodyne	TRPV1	38	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450644276	FF	On-Demand	Anodyne	NCE103	27	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450644276	FF	On-Demand	Anodyne	CAN2	0	41
CSc1ccc2ncnc(N[C@@H]3CCOC3(C)C)c2c1	ZINC000450644279	CG	On-Demand	Anodyne	CD38	107	44
CSc1ccc2ncnc(N[C@H]3CCOC3(C)C)c2c1	ZINC000450644281	CG	On-Demand	Anodyne	CD38	107	44
CCOCc1nc(C)c(C(=O)NCc2ccc(C(F)F)cc2)s1	ZINC000450644283	EH	On-Demand	Anodyne	SCD1	46	45
CCOCc1nc(C)c(C(=O)NCc2ccc(C(F)F)cc2)s1	ZINC000450644283	EH	On-Demand	Anodyne	SCD	39	40
COc1cc(NC(=O)C(C)(C)C(C)(F)F)ccc1OC(C)C	ZINC000450644284	DI	On-Demand	Anodyne	ENPP1	73	35
COc1cc(NC(=O)C(C)(C)C(C)(F)F)ccc1OC(C)C	ZINC000450644284	DI	On-Demand	Anodyne	KCNK3	46	44
COc1cc(NC(=O)C(C)(C)C(C)(F)F)ccc1OC(C)C	ZINC000450644284	DI	On-Demand	Anodyne	KCNK9	45	44
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644293	FG	On-Demand	Anodyne	PDE6D	83	46
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644293	FG	On-Demand	Anodyne	COLA	115	39
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644293	FG	On-Demand	Anodyne	CPT1A	101	39
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644293	FG	On-Demand	Anodyne	HDAC8	26	40
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644293	FG	On-Demand	Anodyne	HDAC6	23	40
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644293	FG	On-Demand	Anodyne	NS5B	0	40
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644293	FG	On-Demand	Anodyne	IMDH_CRYPV	28	44
C[C@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644296	FG	On-Demand	Anodyne	PDE6D	83	46
C[C@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644296	FG	On-Demand	Anodyne	COLA	115	39
C[C@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644296	FG	On-Demand	Anodyne	CPT1A	101	39
C[C@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644296	FG	On-Demand	Anodyne	HDAC8	26	40
C[C@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644296	FG	On-Demand	Anodyne	HDAC6	23	40
C[C@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644296	FG	On-Demand	Anodyne	NS5B	0	40
C[C@H](O)[C@@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644296	FG	On-Demand	Anodyne	IMDH_CRYPV	28	44
C[C@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644298	FG	On-Demand	Anodyne	PDE6D	83	46
C[C@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644298	FG	On-Demand	Anodyne	COLA	115	39
C[C@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644298	FG	On-Demand	Anodyne	CPT1A	101	39
C[C@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644298	FG	On-Demand	Anodyne	HDAC8	26	40
C[C@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644298	FG	On-Demand	Anodyne	HDAC6	23	40
C[C@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644298	FG	On-Demand	Anodyne	NS5B	0	40
C[C@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644298	FG	On-Demand	Anodyne	IMDH_CRYPV	28	44
C[C@@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644300	FG	On-Demand	Anodyne	PDE6D	83	46
C[C@@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644300	FG	On-Demand	Anodyne	COLA	115	39
C[C@@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644300	FG	On-Demand	Anodyne	CPT1A	101	39
C[C@@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644300	FG	On-Demand	Anodyne	HDAC8	26	40
C[C@@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644300	FG	On-Demand	Anodyne	HDAC6	23	40
C[C@@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644300	FG	On-Demand	Anodyne	NS5B	0	40
C[C@@H](O)[C@H]1CCCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450644300	FG	On-Demand	Anodyne	IMDH_CRYPV	28	44
C[C@@H](CCCCO)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450644302	GI	On-Demand	Anodyne	NPBWR1	41	37
C[C@H](CCCCO)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450644304	GI	On-Demand	Anodyne	NPBWR1	41	37
C=CCn1c(SCc2nc(C(=O)OC)cs2)nnc1-c1ccoc1C	ZINC000450644324	GH	On-Demand	Mild	HCRTR2	20	42
CC(=O)[C@@](C)(O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450644328	FE	On-Demand	Anodyne	OPRK1	21	40
CC(=O)[C@@](C)(O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450644328	FE	On-Demand	Anodyne	SIGMAR1	33	63
CC(=O)[C@@](C)(O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450644328	FE	On-Demand	Anodyne	ABCC1	40	32
CC(=O)[C@@](C)(O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450644328	FE	On-Demand	Anodyne	KCNJ1	65	37
CC(=O)[C@](C)(O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450644330	FE	On-Demand	Anodyne	OPRK1	21	40
CC(=O)[C@](C)(O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450644330	FE	On-Demand	Anodyne	SIGMAR1	33	63
CC(=O)[C@](C)(O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450644330	FE	On-Demand	Anodyne	ABCC1	40	32
CC(=O)[C@](C)(O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450644330	FE	On-Demand	Anodyne	KCNJ1	65	37
C[C@H](CCCCO)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450644340	DG	On-Demand	Bother	MAOB	17	48
C[C@@H](CCCCO)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450644343	DG	On-Demand	Bother	MAOB	17	48
COc1cc(NC(=O)c2nn(C)c3c2CCCC3)ccc1OC(C)C	ZINC000450644349	EG	On-Demand	Anodyne	ENPP1	54	33
COc1cc2c(cc1NC(=O)[C@H]1Cc3c(C)cccc3O1)NC(=O)CC2	ZINC000450644350	FF	On-Demand	Anodyne	MT-ND4	43	33
CCOCc1nc(C)c(C(=O)N2c3ccccc3CC[C@H]2C(C)C)s1	ZINC000450644358	FJ	On-Demand	Anodyne	TPP2	56	32
COc1cc2c(cc1NC(=O)[C@@H]1Cc3c(C)cccc3O1)NC(=O)CC2	ZINC000450644364	FF	On-Demand	Anodyne	MT-ND4	43	33
CCOCc1nc(C)c(C(=O)N2c3ccccc3CC[C@@H]2C(C)C)s1	ZINC000450644370	FJ	On-Demand	Anodyne	TPP2	56	32
O[C@H]1COCCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450644389	EF	On-Demand	Anodyne	ADRB3	32	54
O[C@@H]1COCCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450644394	EF	On-Demand	Anodyne	ADRB3	32	54
CCOC(=O)c1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)on1	ZINC000450644405	EF	On-Demand	Anodyne	ENPP1	61	36
CCOC(=O)c1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)on1	ZINC000450644405	EF	On-Demand	Anodyne	KCNK3	49	37
Cc1nc(C)n(CCCC(=O)N2c3ccccc3CC[C@@H]2C(C)C)n1	ZINC000450644408	EH	On-Demand	Anodyne	ACE	20	40
Cc1oc2ccccc2c1CCNC(=O)CCCC(=O)C1CC1	ZINC000450644414	DH	On-Demand	Anodyne	MTNR1A	53	42
Cc1oc2ccccc2c1CCNC(=O)CCCC(=O)C1CC1	ZINC000450644414	DH	On-Demand	Anodyne	MTNR1B	53	42
Cc1nc(C)n(CCCC(=O)N2c3ccccc3CC[C@H]2C(C)C)n1	ZINC000450644416	EH	On-Demand	Anodyne	ACE	20	40
C=CCn1c(SCC(=O)CC(C)(C)C2CC2)nnc1-c1ccoc1C	ZINC000450644426	FJ	On-Demand	Mild	HCRTR2	21	42
CCC1(CO)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644430	CG	On-Demand	Anodyne	SIGMAR1	25	44
CCC1(CO)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644430	CG	On-Demand	Anodyne	CCR1	42	38
COC(=O)C1(CN2CC(=O)N(Cc3ccccc3)C2)CC1	ZINC000450644450	CD	On-Demand	Anodyne	NPFFR1	43	33
O=C1CCCc2occ(C(=O)N3CCN(c4ccccc4)C(=O)C3)c21	ZINC000450644484	EE	On-Demand	Anodyne	P2RX7	16	43
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@H](O)C1CCC1	ZINC000450644487	DD	On-Demand	Anodyne	METAP2	22	41
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@@H](O)C1CCC1	ZINC000450644489	DD	On-Demand	Anodyne	METAP2	22	41
Fc1ccccc1OCc1nnc(SCC[C@@H]2CCOC2)n1-c1ccccc1	ZINC000450644490	GJ	On-Demand	Anodyne	VCP	55	42
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@H](O)C1CCC1	ZINC000450644491	DD	On-Demand	Anodyne	METAP2	22	41
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@@H](O)C1CCC1	ZINC000450644492	DD	On-Demand	Anodyne	METAP2	22	41
CCCN(CCc1cccs1)C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450644494	FI	On-Demand	Anodyne	TSPO	41	44
Fc1ccccc1OCc1nnc(SCC[C@H]2CCOC2)n1-c1ccccc1	ZINC000450644496	GJ	On-Demand	Anodyne	VCP	55	42
COc1cccc2c(N[C@H]3CC[C@@H](CO)C3)c(C)cnc12	ZINC000450644497	CG	On-Demand	Anodyne	ATP4A	18	42
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450644502	EI	On-Demand	Anodyne	ENPP1	72	34
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450644504	EI	On-Demand	Anodyne	ENPP1	72	34
c1ccc(-c2nnc3ccc(N4CC[C@H]4C4CC4)nn23)cc1	ZINC000450644510	CF	On-Demand	Anodyne	LRRK2	22	40
c1ccc(-c2nnc3ccc(N4CC[C@@H]4C4CC4)nn23)cc1	ZINC000450644514	CF	On-Demand	Anodyne	LRRK2	22	40
C[C@@H](CC(F)(F)F)NC(=O)c1cc(O)ccc1F	ZINC000450644536	CF	For-Sale	Anodyne	HSD17B1	19	40
C[C@H](CC(F)(F)F)NC(=O)c1cc(O)ccc1F	ZINC000450644538	CF	For-Sale	Anodyne	HSD17B1	19	40
Cc1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1NC(=O)CCN(C)C	ZINC000450644549	GG	On-Demand	Anodyne	LDLR	0	43
CCC(=O)CCCN1CCc2cccc(F)c2C1	ZINC000450644574	BF	On-Demand	Anodyne	HTR5A	33	42
CCC(=O)CCCN1CCc2cccc(F)c2C1	ZINC000450644574	BF	On-Demand	Anodyne	CHRNA6	0	44
N#Cc1cnc2c(F)cc(F)cc2c1N[C@H]1CC[C@@H](CO)C1	ZINC000450644583	DF	On-Demand	Mild	MAP3K8	50	32
CCOCc1nc(C)c(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)s1	ZINC000450644587	FH	On-Demand	Anodyne	MTR1B_CHICK	0	50
CCOCc1nc(C)c(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)s1	ZINC000450644587	FH	On-Demand	Anodyne	PPARD	47	38
CCOCc1nc(C)c(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)s1	ZINC000450644587	FH	On-Demand	Anodyne	EBP	17	41
CCOCc1nc(C)c(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)s1	ZINC000450644588	FH	On-Demand	Anodyne	MTR1B_CHICK	0	50
CCOCc1nc(C)c(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)s1	ZINC000450644588	FH	On-Demand	Anodyne	PPARD	47	38
CCOCc1nc(C)c(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)s1	ZINC000450644588	FH	On-Demand	Anodyne	EBP	17	41
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450644594	FJ	On-Demand	Anodyne	F10	26	43
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450644594	FJ	On-Demand	Anodyne	PRNP	16	40
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450644594	FJ	On-Demand	Anodyne	GRM5	19	46
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450644594	FJ	On-Demand	Anodyne	CXCR3	15	40
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450644594	FJ	On-Demand	Anodyne	KCNK3	65	43
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450644594	FJ	On-Demand	Anodyne	KCNK9	32	43
COc1ccccc1COC1CCN(CC[C@H](C)O)CC1	ZINC000450644607	CE	On-Demand	Anodyne	HTR1A	30	43
COc1ccccc1COC1CCN(CC[C@H](C)O)CC1	ZINC000450644607	CE	On-Demand	Anodyne	DRD2	22	42
COc1ccccc1COC1CCN(CC[C@H](C)O)CC1	ZINC000450644607	CE	On-Demand	Anodyne	CCR5	33	40
COc1ccccc1COC1CCN(CC[C@@H](C)O)CC1	ZINC000450644608	CE	On-Demand	Anodyne	HTR1A	30	43
COc1ccccc1COC1CCN(CC[C@@H](C)O)CC1	ZINC000450644608	CE	On-Demand	Anodyne	DRD2	22	42
COc1ccccc1COC1CCN(CC[C@@H](C)O)CC1	ZINC000450644608	CE	On-Demand	Anodyne	CCR5	33	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644613	GF	On-Demand	Anodyne	ACE	26	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644613	GF	On-Demand	Anodyne	FKBP1A	53	38
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644613	GF	On-Demand	Anodyne	SLC6A1	54	35
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644613	GF	On-Demand	Anodyne	CPT2	43	36
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644613	GF	On-Demand	Anodyne	PREP	136	67
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644613	GF	On-Demand	Anodyne	RHODESAIN	0	44
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644613	GF	On-Demand	Anodyne	SFRP1	108	50
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644613	GF	On-Demand	Anodyne	WNT3	89	50
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644614	GF	On-Demand	Anodyne	ACE	26	40
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644614	GF	On-Demand	Anodyne	FKBP1A	53	38
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644614	GF	On-Demand	Anodyne	SLC6A1	54	35
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644614	GF	On-Demand	Anodyne	CPT2	43	36
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644614	GF	On-Demand	Anodyne	PREP	136	67
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644614	GF	On-Demand	Anodyne	RHODESAIN	0	44
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644614	GF	On-Demand	Anodyne	SFRP1	108	50
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450644614	GF	On-Demand	Anodyne	WNT3	89	50
CCCc1cnc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)s1	ZINC000450644617	FH	On-Demand	Anodyne	TEK	24	41
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450644622	DE	On-Demand	Anodyne	RHOA	0	48
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450644622	DE	On-Demand	Anodyne	L3MBTL1	0	40
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450644623	DE	On-Demand	Anodyne	RHOA	0	48
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450644623	DE	On-Demand	Anodyne	L3MBTL1	0	40
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1)C1CCC1	ZINC000450644625	FG	On-Demand	Anodyne	RHOA	0	42
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1)C1CCC1	ZINC000450644626	FG	On-Demand	Anodyne	RHOA	0	42
CCN(c1nc(-c2cccnc2)nc2sc3c(c12)CCC3)C1COC1	ZINC000450644641	FG	On-Demand	Anodyne	CEL	18	41
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	DRD2	38	53
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	DRD1	18	51
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	DRD4	24	53
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	HTR2A	29	59
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	HTR2C	18	59
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	ERG2	24	53
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	SLC18A3	22	53
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	EBP	16	53
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644657	GH	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	DRD2	38	53
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	DRD1	18	51
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	DRD4	24	53
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	HTR2A	29	59
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	HTR2C	18	59
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	ERG2	24	53
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	SLC18A3	22	53
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	EBP	16	53
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccc(F)cc1	ZINC000450644658	GH	On-Demand	Anodyne	CYP2J2	54	38
C[C@@H](O)CCCn1cnc2scc(-c3ccccc3)c2c1=O	ZINC000450644663	DG	On-Demand	Anodyne	TGM2	15	40
C[C@H](O)CCCn1cnc2scc(-c3ccccc3)c2c1=O	ZINC000450644664	DG	On-Demand	Anodyne	TGM2	15	40
COC(=O)c1ccc2c(c1)CN(Cc1nc(C(=O)OC)co1)CC2	ZINC000450644665	ED	On-Demand	Anodyne	NOD1	29	40
COC(=O)c1ccc2c(c1)CN(Cc1nc(C(=O)OC)co1)CC2	ZINC000450644665	ED	On-Demand	Anodyne	NOD2	44	40
Cc1ccnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)c1Cl	ZINC000450644669	FE	On-Demand	Anodyne	CA2	18	41
Cc1ccnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)c1Cl	ZINC000450644669	FE	On-Demand	Anodyne	CA12	17	41
CN(CCN(C)c1ccnc(C(N)=O)c1)c1ccc(S(N)(=O)=O)cc1	ZINC000450644670	FC	On-Demand	Anodyne	CA2	63	38
CN(CCN(C)c1ccnc(C(N)=O)c1)c1ccc(S(N)(=O)=O)cc1	ZINC000450644670	FC	On-Demand	Anodyne	CA1	54	36
CN(CCN(C)c1ccnc(C(N)=O)c1)c1ccc(S(N)(=O)=O)cc1	ZINC000450644670	FC	On-Demand	Anodyne	CA4	58	37
CN(CCN(C)c1ccnc(C(N)=O)c1)c1ccc(S(N)(=O)=O)cc1	ZINC000450644670	FC	On-Demand	Anodyne	CA12	30	42
CN(CCN(C)c1ccnc(C(N)=O)c1)c1ccc(S(N)(=O)=O)cc1	ZINC000450644670	FC	On-Demand	Anodyne	DKK1	0	42
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1	ZINC000450644671	FG	On-Demand	Anodyne	RHOA	0	54
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1	ZINC000450644671	FG	On-Demand	Anodyne	KCNK3	85	38
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1	ZINC000450644671	FG	On-Demand	Anodyne	KCNK9	48	39
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1	ZINC000450644672	FG	On-Demand	Anodyne	RHOA	0	54
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1	ZINC000450644672	FG	On-Demand	Anodyne	KCNK3	85	38
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1	ZINC000450644672	FG	On-Demand	Anodyne	KCNK9	48	39
CCOC(=O)c1ccc(CN(C)[C@H](C)C2CCC2)nc1	ZINC000450644676	CF	On-Demand	Anodyne	SCARB1	42	34
CCOC(=O)c1ccc(CN(C)[C@@H](C)C2CCC2)nc1	ZINC000450644677	CF	On-Demand	Anodyne	SCARB1	42	34
CC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450644697	GD	On-Demand	Anodyne	CA2	32	40
CC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450644697	GD	On-Demand	Anodyne	CA12	22	40
CC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450644697	GD	On-Demand	Anodyne	CA9	27	40
CC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450644697	GD	On-Demand	Anodyne	DKK1	0	42
Cn1c(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)nc2ccc(F)cc21	ZINC000450644702	GG	On-Demand	Anodyne	MTOR	15	43
O=C1CCC(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644703	CG	On-Demand	Anodyne	GRIN2B	44	37
O=C1CCC(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644703	CG	On-Demand	Anodyne	SIGMAR1	25	49
O=C1CCC(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644703	CG	On-Demand	Anodyne	CHRNA7	37	40
O=C1CCC(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644703	CG	On-Demand	Anodyne	C3AR1	40	37
O=C1CCC(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644703	CG	On-Demand	Anodyne	GRIN3A	0	40
O=C1CCC(CN2CCC(Cc3cccnc3)CC2)CC1	ZINC000450644703	CG	On-Demand	Anodyne	ACHP_LYMST	23	43
COC(=O)c1ccc2c(c1)CN(Cc1nc(C(=O)OC)cs1)CC2	ZINC000450644704	EE	On-Demand	Anodyne	NOD1	31	42
COC(=O)c1ccc2c(c1)CN(Cc1nc(C(=O)OC)cs1)CC2	ZINC000450644704	EE	On-Demand	Anodyne	NOD2	47	42
CCC[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644705	CE	On-Demand	Anodyne	ADRB3	0	55
CCC[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644705	CE	On-Demand	Anodyne	C3AR1	41	37
CCC[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644705	CE	On-Demand	Anodyne	ABCB1	0	44
CCC[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644706	CE	On-Demand	Anodyne	ADRB3	0	55
CCC[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644706	CE	On-Demand	Anodyne	C3AR1	41	37
CCC[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450644706	CE	On-Demand	Anodyne	ABCB1	0	44
FC1(F)CCCC[C@H]1CN1CCC(Cc2cccnc2)CC1	ZINC000450644709	DI	On-Demand	Anodyne	CHRNA7	45	35
FC1(F)CCCC[C@H]1CN1CCC(Cc2cccnc2)CC1	ZINC000450644709	DI	On-Demand	Anodyne	C3AR1	42	38
FC1(F)CCCC[C@H]1CN1CCC(Cc2cccnc2)CC1	ZINC000450644709	DI	On-Demand	Anodyne	ACHP_LYMST	25	42
FC1(F)CCCC[C@@H]1CN1CCC(Cc2cccnc2)CC1	ZINC000450644710	DI	On-Demand	Anodyne	C3AR1	42	38
FC1(F)CCCC[C@@H]1CN1CCC(Cc2cccnc2)CC1	ZINC000450644710	DI	On-Demand	Anodyne	ACHP_LYMST	21	42
C=CC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644713	DE	On-Demand	Mild	NPY2R	32	42
C=CC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644713	DE	On-Demand	Mild	L3MBTL1	0	41
C=CC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450644713	DE	On-Demand	Mild	L3MBTL3	48	41
COC(=O)c1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1	ZINC000450644719	GC	On-Demand	Anodyne	CA2	84	42
COC(=O)c1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1	ZINC000450644719	GC	On-Demand	Anodyne	CA1	70	40
COC(=O)c1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1	ZINC000450644719	GC	On-Demand	Anodyne	CA7	45	37
COC(=O)c1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1	ZINC000450644719	GC	On-Demand	Anodyne	CA4	57	35
COC(=O)c1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1	ZINC000450644719	GC	On-Demand	Anodyne	CA12	48	42
COC(=O)c1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1	ZINC000450644719	GC	On-Demand	Anodyne	CA9	52	42
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	DRD2	15	43
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	DRD4	26	47
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	SLC6A1	24	47
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	ADRA1B	20	40
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	DRD3	15	47
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	DRD5	15	47
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	SIGMAR1	32	43
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	CCR1	75	43
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	ADAM17	21	43
COC(=O)C1(O)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450644721	CD	On-Demand	Anodyne	KCNJ1	34	40
CC(C)(O)C(C)(C)NCc1ccccc1OC1CC1	ZINC000450644722	CF	On-Demand	Anodyne	SLC5A4	50	31
Cc1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1NC(=O)CCN(C)C	ZINC000450644723	GG	On-Demand	Anodyne	LDLR	0	43
C[C@@H]1CN(CCOC2CCN(CCN(C)Cc3ccccc3)CC2)C[C@@H](C)O1	ZINC000450644724	GF	On-Demand	Anodyne	SIGMAR1	29	40
C[C@H]1CN(CCOC2CCN(CCN(C)Cc3ccccc3)CC2)C[C@@H](C)O1	ZINC000450644725	GF	On-Demand	Anodyne	SIGMAR1	29	40
C[C@H]1CN(CCOC2CCN(CCN(C)Cc3ccccc3)CC2)C[C@H](C)O1	ZINC000450644726	GF	On-Demand	Anodyne	SIGMAR1	29	40
CN(C)CCOCCNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450644733	ED	On-Demand	Anodyne	PSBA	0	46
Cn1c(SCCC(C)(F)F)nnc1-c1ccc(F)cc1	ZINC000450644742	DH	On-Demand	Anodyne	DRD2	0	42
Cn1c(SCCC(C)(F)F)nnc1-c1ccc(F)cc1	ZINC000450644742	DH	On-Demand	Anodyne	DRD3	42	42
Cn1c(SCCC(C)(F)F)nnc1-c1ccc(F)cc1	ZINC000450644742	DH	On-Demand	Anodyne	KCNH2	23	41
COc1cc(CC(=O)N[C@H](C)CC(F)(F)F)ccc1Cl	ZINC000450644756	DG	On-Demand	Anodyne	NCE103	25	41
COc1cc(CC(=O)N[C@H](C)CC(F)(F)F)ccc1Cl	ZINC000450644756	DG	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@@H](C)CC(F)(F)F)ccc1Cl	ZINC000450644757	DG	On-Demand	Anodyne	NCE103	25	41
COc1cc(CC(=O)N[C@@H](C)CC(F)(F)F)ccc1Cl	ZINC000450644757	DG	On-Demand	Anodyne	CAN2	0	41
Cc1ccn2ncc(C(=O)N[C@H](C)CC(F)(F)F)c2c1	ZINC000450644769	CF	On-Demand	Anodyne	EPHB3	35	51
Cc1ccn2ncc(C(=O)N[C@@H](C)CC(F)(F)F)c2c1	ZINC000450644770	CF	On-Demand	Anodyne	EPHB3	35	51
Cc1ccc(NC(=O)c2cc3cccnc3s2)cc1NC(=O)CCN(C)C	ZINC000450644778	GH	On-Demand	Anodyne	LCK	17	41
Cc1ccc(NC(=O)c2cc3cccnc3s2)cc1NC(=O)CCN(C)C	ZINC000450644778	GH	On-Demand	Anodyne	LDLR	0	40
COc1cc(NC(=O)c2c(Br)cnn2C)ccc1OC(C)C	ZINC000450644779	FG	On-Demand	Anodyne	HTR2A	34	53
COc1cc(NC(=O)c2c(Br)cnn2C)ccc1OC(C)C	ZINC000450644779	FG	On-Demand	Anodyne	ENPP1	63	39
C[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@@H]1O	ZINC000450644780	DH	On-Demand	Anodyne	SIGMAR1	27	40
C[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@@H]1O	ZINC000450644780	DH	On-Demand	Anodyne	MLNR	41	36
C[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@H]1O	ZINC000450644781	DH	On-Demand	Anodyne	SIGMAR1	27	40
C[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@H]1O	ZINC000450644781	DH	On-Demand	Anodyne	MLNR	41	36
C[C@@H](c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1)C(F)(F)F	ZINC000450644782	DH	On-Demand	Anodyne	SIGMAR1	27	40
C[C@@H](c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1)C(F)(F)F	ZINC000450644782	DH	On-Demand	Anodyne	MLNR	41	36
C[C@@H](c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1)C(F)(F)F	ZINC000450644783	DH	On-Demand	Anodyne	SIGMAR1	27	40
C[C@@H](c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1)C(F)(F)F	ZINC000450644783	DH	On-Demand	Anodyne	MLNR	41	36
CCC(CC)(CCSc1nnc(-c2cccnc2)n1C)C(=O)OC	ZINC000450644812	EG	On-Demand	Anodyne	DRD3	40	42
C=C[C@@H]1OCC[C@H]1C(=O)Nc1ccc(C)c(NC(=O)CCN(C)C)c1	ZINC000450644826	EE	On-Demand	Mild	LDLR	0	40
Cn1c(SC[C@H]2CCCC2(F)F)nnc1-c1cccnc1	ZINC000450644832	DG	On-Demand	Anodyne	DRD3	31	41
Cn1c(SC[C@@H]2CCCC2(F)F)nnc1-c1cccnc1	ZINC000450644833	DG	On-Demand	Anodyne	DRD3	31	41
Clc1ccc(CCN2CCN(C[C@H]3COCCO3)CC2)cc1Cl	ZINC000450644852	FF	On-Demand	Anodyne	SIGMAR1	25	63
Clc1ccc(CCN2CCN(C[C@H]3COCCO3)CC2)cc1Cl	ZINC000450644852	FF	On-Demand	Anodyne	KCNB1	0	40
Clc1ccc(CCN2CCN(C[C@@H]3COCCO3)CC2)cc1Cl	ZINC000450644853	FF	On-Demand	Anodyne	SIGMAR1	25	63
Clc1ccc(CCN2CCN(C[C@@H]3COCCO3)CC2)cc1Cl	ZINC000450644853	FF	On-Demand	Anodyne	KCNB1	0	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cccc(C#N)c1Br	ZINC000450644860	GF	On-Demand	Mild	CTRB_BOVIN	43	30
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cccc(C#N)c1Br	ZINC000450644861	GF	On-Demand	Mild	CTRB_BOVIN	43	30
CC[C@@H]1C[C@H]1C(=O)N(C)[C@@H](CO)c1ccc(OC)cc1	ZINC000450644868	CE	On-Demand	Anodyne	DXR	25	40
CC[C@@H]1C[C@H]1C(=O)N(C)[C@H](CO)c1ccc(OC)cc1	ZINC000450644869	CE	On-Demand	Anodyne	DXR	25	40
Cc1ccn(CC(=O)N2c3ccccc3CC[C@H]2C(C)C)n1	ZINC000450644870	CG	On-Demand	Anodyne	TPP2	45	33
Cc1ccn(CC(=O)N2c3ccccc3CC[C@@H]2C(C)C)n1	ZINC000450644871	CG	On-Demand	Anodyne	TPP2	45	33
COc1ccc([C@H](CO)N(C)C(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450644872	EE	On-Demand	Anodyne	DXR	28	42
COc1ccc([C@@H](CO)N(C)C(=O)Cc2ccc(O)c(OC)c2)cc1	ZINC000450644873	EE	On-Demand	Anodyne	DXR	28	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450644878	GG	On-Demand	Anodyne	SMO	49	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450644878	GG	On-Demand	Anodyne	ETHR	63	45
COc1cc(NC(=O)[C@H]2CCCN(C)C2=O)ccc1OC(C)C	ZINC000450644895	DE	On-Demand	Anodyne	ENPP1	55	32
COc1cc(NC(=O)[C@@H]2CCCN(C)C2=O)ccc1OC(C)C	ZINC000450644897	DE	On-Demand	Anodyne	ENPP1	55	32
COC(=O)[C@H](c1cccc(Br)c1)N(C)CCc1cscn1	ZINC000450644900	FG	On-Demand	Anodyne	BMP1	43	32
COC(=O)[C@@H](c1cccc(Br)c1)N(C)CCc1cscn1	ZINC000450644901	FG	On-Demand	Anodyne	BMP1	43	32
COc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)ccc1OC(C)C	ZINC000450644915	FH	On-Demand	Anodyne	SCN10A	20	41
COc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)ccc1OC(C)C	ZINC000450644915	FH	On-Demand	Anodyne	IMPDH2	0	43
COc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)ccc1OC(C)C	ZINC000450644915	FH	On-Demand	Anodyne	ENPP1	59	35
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450644917	GG	On-Demand	Bother	BCL2L1	99	36
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450644917	GG	On-Demand	Bother	BCL2	85	38
C[C@H](O)C(=O)N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450644918	DC	On-Demand	Anodyne	ABCB1	22	40
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450644919	GG	On-Demand	Bother	BCL2L1	99	36
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450644919	GG	On-Demand	Bother	BCL2	85	38
Cc1ccc(NC(=O)c2ccc(N[C@H]3CC[C@@H](CO)C3)nc2)cc1	ZINC000450644926	EG	On-Demand	Anodyne	P4HTM	0	49
C[C@H](O)C(=O)N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450644928	DC	On-Demand	Anodyne	ABCB1	22	40
C[C@H](O)C(=O)N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450644929	DC	On-Demand	Anodyne	ABCB1	22	40
C[C@H](O)C(=O)N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450644931	DC	On-Demand	Anodyne	ABCB1	22	40
CCSc1cccnc1C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450644932	FG	On-Demand	Anodyne	SMO	52	37
CCSc1cccnc1C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450644932	FG	On-Demand	Anodyne	ETHR	66	42
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	AVPR1B	15	41
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	P2RY12	188	41
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	MME	43	35
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	MC4R	65	40
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	TRY2_BOVIN	91	41
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	CYSP_TRYCR	38	44
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	CYP51A1	21	41
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	REN	43	36
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	ACE2	52	32
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	PGA5	46	33
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	ST14	54	35
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	HDA106	0	42
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	BLA1_STEMA	54	38
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644937	GD	On-Demand	Anodyne	PSMB8	56	37
COc1cc(NC(=O)C(C)(C)C2CCC2)ccc1OC(C)C	ZINC000450644940	DI	On-Demand	Anodyne	ENPP1	69	33
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	AVPR1B	15	41
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	P2RY12	188	41
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	MME	43	35
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	MC4R	65	40
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	TRY2_BOVIN	91	41
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	CYSP_TRYCR	38	44
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	CYP51A1	21	41
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	REN	43	36
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	ACE2	52	32
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	PGA5	46	33
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	ST14	54	35
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	HDA106	0	42
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	BLA1_STEMA	54	38
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)n1	ZINC000450644942	GD	On-Demand	Anodyne	PSMB8	56	37
CCC(=O)C1(C(=O)Nc2ccc(OC(C)C)c(OC)c2)CC1	ZINC000450644949	DG	On-Demand	Anodyne	ENPP1	59	34
COC(=O)c1ccc(CN2CCC3(CCCN3C)CC2)cc1Cl	ZINC000450644950	EG	On-Demand	Anodyne	MCHR2	40	32
OC[C@@H]1CC[C@H](Nc2ncnc3ccc(I)cc23)C1	ZINC000450644961	FF	On-Demand	Anodyne	CD38	61	44
COc1cc(NC(=O)[C@@]2(C#N)CC23CCCC3)ccc1OC(C)C	ZINC000450644962	EH	On-Demand	Mild	ENPP1	55	31
COC(=O)[C@@H](NC(=O)C(CC(C)C)CC(C)C)[C@H](C)O	ZINC000450644963	CD	On-Demand	Anodyne	PGA	42	33
COC(=O)[C@@H](NC(=O)C(CC(C)C)CC(C)C)[C@H](C)O	ZINC000450644963	CD	On-Demand	Anodyne	NPR	24	50
COC(=O)[C@H](NC(=O)C(CC(C)C)CC(C)C)[C@@H](C)O	ZINC000450644964	CD	On-Demand	Anodyne	PGA	42	33
COC(=O)[C@H](NC(=O)C(CC(C)C)CC(C)C)[C@@H](C)O	ZINC000450644964	CD	On-Demand	Anodyne	NPR	24	50
COC(=O)[C@H](NC(=O)C(CC(C)C)CC(C)C)[C@H](C)O	ZINC000450644965	CD	On-Demand	Anodyne	PGA	42	33
COC(=O)[C@H](NC(=O)C(CC(C)C)CC(C)C)[C@H](C)O	ZINC000450644965	CD	On-Demand	Anodyne	NPR	24	50
COC(=O)[C@@H](NC(=O)C(CC(C)C)CC(C)C)[C@@H](C)O	ZINC000450644966	CD	On-Demand	Anodyne	PGA	42	33
COC(=O)[C@@H](NC(=O)C(CC(C)C)CC(C)C)[C@@H](C)O	ZINC000450644966	CD	On-Demand	Anodyne	NPR	24	50
COc1cc(NC(=O)[C@]2(C#N)CC23CCCC3)ccc1OC(C)C	ZINC000450644972	EH	On-Demand	Mild	ENPP1	55	31
COc1cc(NC(=O)c2coc3c2C(=O)CCC3)ccc1OC(C)C	ZINC000450644981	EH	On-Demand	Anodyne	ENPP1	53	29
OC[C@@H]1CC[C@H](Nc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450644999	DE	On-Demand	Anodyne	DHOD	0	45
COc1cc2c(N3CC[C@@H]3C3CC3)ncnc2cc1F	ZINC000450645000	CF	On-Demand	Anodyne	EGFR	24	46
COc1cc2c(N3CC[C@@H]3C3CC3)ncnc2cc1F	ZINC000450645000	CF	On-Demand	Anodyne	PDE3A	56	42
COc1cc2c(N3CC[C@@H]3C3CC3)ncnc2cc1F	ZINC000450645000	CF	On-Demand	Anodyne	PDGFRB	56	38
COc1cc2c(N3CC[C@@H]3C3CC3)ncnc2cc1F	ZINC000450645000	CF	On-Demand	Anodyne	PDE3B	82	42
COc1cc2c(N3CC[C@H]3C3CC3)ncnc2cc1F	ZINC000450645001	CF	On-Demand	Anodyne	PDE3A	56	42
COc1cc2c(N3CC[C@H]3C3CC3)ncnc2cc1F	ZINC000450645001	CF	On-Demand	Anodyne	PDGFRB	53	38
COc1cc2c(N3CC[C@H]3C3CC3)ncnc2cc1F	ZINC000450645001	CF	On-Demand	Anodyne	PDE3B	82	42
COc1cc(NC(=O)[C@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645003	EH	On-Demand	Anodyne	PPARA	17	41
COc1cc(NC(=O)[C@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645003	EH	On-Demand	Anodyne	MME	56	38
COc1cc(NC(=O)[C@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645003	EH	On-Demand	Anodyne	SOAT1	22	42
COc1cc(NC(=O)[C@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645003	EH	On-Demand	Anodyne	ACE2	40	33
COc1cc(NC(=O)[C@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645003	EH	On-Demand	Anodyne	ENPP1	73	35
COc1cc(NC(=O)[C@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645003	EH	On-Demand	Anodyne	METAP2	0	43
COc1cc(NC(=O)[C@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645003	EH	On-Demand	Anodyne	GPR142	43	41
COc1cc(NC(=O)[C@@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645004	EH	On-Demand	Anodyne	PPARA	17	41
COc1cc(NC(=O)[C@@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645004	EH	On-Demand	Anodyne	MME	56	38
COc1cc(NC(=O)[C@@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645004	EH	On-Demand	Anodyne	SOAT1	22	42
COc1cc(NC(=O)[C@@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645004	EH	On-Demand	Anodyne	ACE2	40	33
COc1cc(NC(=O)[C@@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645004	EH	On-Demand	Anodyne	ENPP1	73	35
COc1cc(NC(=O)[C@@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645004	EH	On-Demand	Anodyne	METAP2	0	43
COc1cc(NC(=O)[C@@H](Cc2ccccc2)OC)ccc1OC(C)C	ZINC000450645004	EH	On-Demand	Anodyne	GPR142	43	41
Cc1ccc(NC(=O)N2CCN(Cc3cccnc3N)CC2)cc1	ZINC000450645006	EE	On-Demand	Anodyne	P2RY12	19	45
Cc1ccc(NC(=O)N2CCN(Cc3cccnc3N)CC2)cc1	ZINC000450645006	EE	On-Demand	Anodyne	PDGFRB	48	41
Cc1ccc(NC(=O)N2CCN(Cc3cccnc3N)CC2)cc1	ZINC000450645006	EE	On-Demand	Anodyne	TRPV1	22	53
Cc1ccc(NC(=O)N2CCN(Cc3cccnc3N)CC2)cc1	ZINC000450645006	EE	On-Demand	Anodyne	FAAH	20	48
C[C@H](CCCCO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450645007	FE	On-Demand	Bother	BCL2L1	87	40
C[C@H](CCCCO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450645007	FE	On-Demand	Bother	BCL2	67	35
C[C@@H](CCCCO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450645008	FE	On-Demand	Bother	BCL2L1	87	40
C[C@@H](CCCCO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450645008	FE	On-Demand	Bother	BCL2	67	35
COc1cc(NC(=O)c2ccsc2Br)ccc1OC(C)C	ZINC000450645012	FJ	On-Demand	Anodyne	GRM4	17	42
COc1cc(NC(=O)c2ccsc2Br)ccc1OC(C)C	ZINC000450645012	FJ	On-Demand	Anodyne	ENPP1	70	35
COc1cc(NC(=O)c2ccsc2Br)ccc1OC(C)C	ZINC000450645012	FJ	On-Demand	Anodyne	KCNK3	43	42
COc1cc(NC(=O)c2ccsc2Br)ccc1OC(C)C	ZINC000450645012	FJ	On-Demand	Anodyne	KCNK9	37	42
CC[C@@H]1CC[C@@H](C)N1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450645013	EF	On-Demand	Anodyne	MTR1B_CHICK	0	44
CC[C@@H]1CC[C@H](C)N1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450645014	EF	On-Demand	Anodyne	MTR1B_CHICK	0	44
CC[C@H]1CC[C@H](C)N1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450645015	EF	On-Demand	Anodyne	MTR1B_CHICK	0	44
CC[C@H]1CC[C@@H](C)N1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450645016	EF	On-Demand	Anodyne	MTR1B_CHICK	0	44
CCC[C@H](O)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450645021	DE	On-Demand	Anodyne	ABCB1	20	60
CCC[C@@H](O)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450645022	DE	On-Demand	Anodyne	ABCB1	20	60
CCc1cc(N[C@H]2CCOC2(C)C)n2ncnc2n1	ZINC000450645040	CD	On-Demand	Anodyne	DHOD	0	48
CCc1cc(N[C@@H]2CCOC2(C)C)n2ncnc2n1	ZINC000450645041	CD	On-Demand	Anodyne	DHOD	0	48
COCCOC[C@@H](O)CN1CC(=O)N(Cc2ccccc2)C1	ZINC000450645047	DC	On-Demand	Anodyne	ABCB1	44	38
COCCOC[C@H](O)CN1CC(=O)N(Cc2ccccc2)C1	ZINC000450645048	DC	On-Demand	Anodyne	ABCB1	44	38
CC1(C)OCC[C@H]1Nc1ncnc2cc(Cl)ccc12	ZINC000450645050	CG	On-Demand	Anodyne	CD38	58	37
CC1(C)OCC[C@@H]1Nc1ncnc2cc(Cl)ccc12	ZINC000450645051	CG	On-Demand	Anodyne	CD38	58	37
O=C1C[C@H]([C@H]2CCCCN2CCCC(=O)c2ccccc2)CN1	ZINC000450645067	DF	On-Demand	Anodyne	CYP2J2	51	36
O=C1C[C@@H]([C@H]2CCCCN2CCCC(=O)c2ccccc2)CN1	ZINC000450645068	DF	On-Demand	Anodyne	CYP2J2	51	36
O=C1C[C@H]([C@@H]2CCCCN2CCCC(=O)c2ccccc2)CN1	ZINC000450645069	DF	On-Demand	Anodyne	CYP2J2	51	36
O=C1C[C@@H]([C@@H]2CCCCN2CCCC(=O)c2ccccc2)CN1	ZINC000450645070	DF	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450645072	FD	On-Demand	Anodyne	AGTR2	40	37
C[C@@H](O)CCN1CC(=O)N(Cc2ccccc2)C1	ZINC000450645075	BD	On-Demand	Anodyne	HSD17B2	56	39
C[C@H](O)CCN1CC(=O)N(Cc2ccccc2)C1	ZINC000450645078	BD	On-Demand	Anodyne	HSD17B2	56	39
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450645083	FG	On-Demand	Anodyne	P2RY12	60	34
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450645083	FG	On-Demand	Anodyne	TACR2	0	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450645083	FG	On-Demand	Anodyne	TACR3	56	35
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450645090	FG	On-Demand	Anodyne	P2RY12	60	34
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450645090	FG	On-Demand	Anodyne	TACR2	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450645090	FG	On-Demand	Anodyne	TACR3	56	35
N#Cc1cc(Br)ccc1C(=O)N1CCC(F)(F)C1	ZINC000450645109	DF	On-Demand	Mild	DPP7	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	ACE	41	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	OPRM1	28	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	MME	88	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	ANPEP	69	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	FCER2	48	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	SDH1	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	BMP1	46	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CTSB	61	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	PAPA1_CARPA	67	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CYSP_TRYCR	82	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CTSF	53	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CTSK	28	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CTSL	43	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CPA1	41	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	SLC15A1	0	44
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CTRB1	32	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CAPNS1	62	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	HLA-DRB1	48	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CTSS	29	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CAPN1	84	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	CAPN2	95	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	ACE2	66	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	PROTEASE	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	MMP1	25	45
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	FPR1	59	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	POL	0	44
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	NPR	53	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	SLC15A2	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	BLA1_STEMA	53	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	PSMB8	50	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645111	CF	On-Demand	Anodyne	VM1B1_BOTAS	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	ACE	41	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	OPRM1	28	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	MME	88	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	ANPEP	69	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	FCER2	48	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	SDH1	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	BMP1	46	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CTSB	61	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	PAPA1_CARPA	67	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CYSP_TRYCR	82	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CTSF	53	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CTSK	28	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CTSL	43	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CPA1	41	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	SLC15A1	0	44
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	TIMP3	41	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CTRB1	32	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CAPNS1	62	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	HLA-DRB1	48	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CTSS	29	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CAPN1	84	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	CAPN2	95	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	ACE2	66	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	PROTEASE	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	MMP1	25	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	FPR1	59	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	POL	0	44
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	NPR	53	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	SLC15A2	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	BLA1_STEMA	53	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	PSMB8	50	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645113	CF	On-Demand	Anodyne	VM1B1_BOTAS	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	ACE	41	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	OPRM1	28	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	MME	88	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	ANPEP	69	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	FCER2	48	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	SDH1	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	BMP1	46	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CTSB	61	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	PAPA1_CARPA	67	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CYSP_TRYCR	82	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CTSF	53	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CTSK	28	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CTSL	43	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CPA1	41	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	SLC15A1	0	44
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	TIMP3	41	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CTRB1	32	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CAPNS1	62	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	HLA-DRB1	48	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CTSS	29	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CAPN1	84	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	CAPN2	95	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	ACE2	66	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	PROTEASE	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	MMP1	25	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	FPR1	59	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	POL	0	44
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	NPR	53	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	SLC15A2	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	BLA1_STEMA	53	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	PSMB8	50	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645114	CF	On-Demand	Anodyne	VM1B1_BOTAS	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	ACE	47	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	OPRM1	28	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	PPARA	15	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	MME	123	44
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	ANPEP	69	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	TACR1	15	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	FCER2	48	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	SDH1	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	BMP1	46	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CTSB	75	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	PAPA1_CARPA	79	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CYSP_TRYCR	82	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CTSF	59	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CTSK	37	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CTSL	58	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CPA1	41	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	SLC15A1	0	44
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	TIMP3	41	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CTRB1	36	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CAPNS1	72	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	HLA-DRB1	58	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CTSS	29	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CAPN1	105	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	CAPN2	117	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	ACE2	66	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	PROTEASE	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	MMP1	33	45
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	FPR1	77	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	POL	0	44
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	NPR	71	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	SLC15A2	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	BLA1_STEMA	59	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	PSMB8	55	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450645116	CF	On-Demand	Anodyne	VM1B1_BOTAS	0	41
CC(=O)c1cccc(CN2CCc3cc(F)ccc3C2)c1	ZINC000450645117	CH	On-Demand	Anodyne	DRD2	17	42
CC(=O)c1cccc(CN2CCc3cc(F)ccc3C2)c1	ZINC000450645117	CH	On-Demand	Anodyne	DRD4	16	40
CC(=O)c1cccc(CN2CCc3cc(F)ccc3C2)c1	ZINC000450645117	CH	On-Demand	Anodyne	SIGMAR1	27	41
CC(=O)c1cccc(CN2CCc3cc(F)ccc3C2)c1	ZINC000450645117	CH	On-Demand	Anodyne	CCR3	46	43
CC(=O)c1cccc(CN2CCc3cc(F)ccc3C2)c1	ZINC000450645117	CH	On-Demand	Anodyne	AKR1C3	35	42
CC(=O)c1cccc(CN2CCc3cc(F)ccc3C2)c1	ZINC000450645117	CH	On-Demand	Anodyne	NOD1	31	41
CC(=O)c1cccc(CN2CCc3cc(F)ccc3C2)c1	ZINC000450645117	CH	On-Demand	Anodyne	NOD2	47	41
C=CCn1c(SCC[C@@H](C)O)nc2scc(-c3ccccc3)c2c1=O	ZINC000450645119	FI	On-Demand	Mild	TGM2	22	46
C=CCn1c(SCC[C@H](C)O)nc2scc(-c3ccccc3)c2c1=O	ZINC000450645120	FI	On-Demand	Mild	TGM2	22	46
COCc1cc(NC2CCC(CSC)CC2)n2ncnc2n1	ZINC000450645121	DF	On-Demand	Anodyne	DHOD	0	43
CCn1nc(C)c(CC(=O)Nc2n[nH]c(-c3cc(Cl)ccc3Cl)n2)c1C	ZINC000450645129	GH	On-Demand	Anodyne	P2RX7	38	47
COCCN1CCN(CCN(C)Cc2ccccc2)CC1=O	ZINC000450645132	DC	On-Demand	Anodyne	SIGMAR1	22	43
C[C@H]1Cc2cccc(C(=O)N3CCN(c4ccccc4)C(=O)C3)c2O1	ZINC000450645135	EE	On-Demand	Anodyne	P2RX7	23	47
C[C@@H]1Cc2cccc(C(=O)N3CCN(c4ccccc4)C(=O)C3)c2O1	ZINC000450645136	EE	On-Demand	Anodyne	P2RX7	23	47
CC1(C)CN(c2ncccc2C#N)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450645139	FI	On-Demand	Mild	SIGMAR1	38	40
CC1(C)CN(c2ncccc2C#N)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450645141	FI	On-Demand	Mild	SIGMAR1	38	40
CCCN(CCc1cccs1)C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450645160	EH	On-Demand	Anodyne	BMP1	18	43
CCCN(CCc1cccs1)C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450645160	EH	On-Demand	Anodyne	TSPO	22	44
CCS(=O)(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450645172	EG	On-Demand	Anodyne	MLNR	23	42
CCS(=O)(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450645172	EG	On-Demand	Anodyne	NOD2	45	38
O=C(CCCC(=O)C1CC1)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450645174	DG	On-Demand	Anodyne	FASN	39	40
O=C(CCCC(=O)C1CC1)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450645176	DG	On-Demand	Anodyne	FASN	39	40
O=C(CCCC(=O)C1CC1)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450645178	DG	On-Demand	Anodyne	FASN	39	40
O=C(CCCC(=O)C1CC1)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450645180	DG	On-Demand	Anodyne	FASN	39	40
CCCOc1cccc(CN2CCOC[C@H]2C(N)=O)c1	ZINC000450645181	CD	On-Demand	Anodyne	HRH2	27	42
CCOC(=O)c1ccc(CN2CC(=O)N(Cc3ccccc3)C2)nc1	ZINC000450645182	EE	On-Demand	Anodyne	F2RL3	20	42
CCCOc1cccc(CN2CCOC[C@@H]2C(N)=O)c1	ZINC000450645183	CD	On-Demand	Anodyne	HRH2	27	42
C[C@@H](CC(F)(F)F)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450645184	FG	On-Demand	Mild	AR	21	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450645186	FG	On-Demand	Mild	AR	21	40
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450645188	FG	On-Demand	Mild	AR	21	40
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450645189	FG	On-Demand	Mild	AR	21	40
CC(C)(C)c1n[nH]cc1C(=O)Nc1n[nH]c(-c2cc(Cl)ccc2Cl)n1	ZINC000450645196	GI	On-Demand	Anodyne	SHH	45	38
Cc1oc2ccccc2c1CCNC(=O)CC1CC(F)(F)C1	ZINC000450645207	DH	On-Demand	Anodyne	MTNR1A	24	44
Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1NC(=O)CCN(C)C	ZINC000450645223	GH	On-Demand	Anodyne	ABL1	43	35
Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1NC(=O)CCN(C)C	ZINC000450645223	GH	On-Demand	Anodyne	LCK	40	51
Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1NC(=O)CCN(C)C	ZINC000450645223	GH	On-Demand	Anodyne	MAPK14	33	42
Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1NC(=O)CCN(C)C	ZINC000450645223	GH	On-Demand	Anodyne	LDLR	0	42
Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1NC(=O)CCN(C)C	ZINC000450645223	GH	On-Demand	Anodyne	LYN	41	39
Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1NC(=O)CCN(C)C	ZINC000450645223	GH	On-Demand	Anodyne	BTK	30	51
Cc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1NC(=O)CCN(C)C	ZINC000450645223	GH	On-Demand	Anodyne	BRAF	18	40
COC(=O)c1coc(CN2CCC(OCc3ccccc3OC)CC2)n1	ZINC000450645246	FF	On-Demand	Anodyne	SSTR5	45	35
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)C1	ZINC000450645264	DF	On-Demand	Anodyne	PREP	24	44
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)C1	ZINC000450645266	DF	On-Demand	Anodyne	PREP	24	44
CCC[C@H](OC)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450645281	CG	On-Demand	Anodyne	MTNR1B	25	40
CCC[C@@H](OC)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450645282	CG	On-Demand	Anodyne	MTNR1B	25	40
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	ADRB2	42	37
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	GCGR	0	42
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	NPR1	41	32
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	TRPV1	24	57
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	ALOX15	0	40
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	TTR	0	42
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	U38	0	41
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	NCE103	30	44
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	P96878_MYCTU	21	44
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	N1L	0	42
COc1cc(CC(=O)NCc2c(OC(C)C)ccc3ccccc23)ccc1O	ZINC000450645283	GI	On-Demand	Anodyne	CAN2	0	44
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	HTR1A	71	62
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	DRD2	76	62
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	DRD1	36	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	DRD4	48	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	ACHE	19	44
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	ADRA1D	32	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	HTR2A	52	54
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	HTR2C	33	57
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	SLC6A4	15	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	ADRA1A	38	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	HRH1	24	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	ADRA1B	33	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	DRD3	60	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	ADRA2C	19	44
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	DRD5	15	46
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	HTR2B	16	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	ERG2	20	43
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	HTR7	63	53
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	SIGMAR1	42	54
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	CCR3	45	42
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	SLC18A3	26	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	EBP	26	43
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	HTR3B	0	48
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	ABCB1	21	43
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	MCHR1	16	46
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	CYP2J2	63	45
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	NET	0	43
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	MBTPS1	51	35
COc1ccccc1COC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450645287	GI	On-Demand	Anodyne	AP2S1	0	43
COc1cccc2c(N[C@H](C)CCCCO)c(C)cnc12	ZINC000450645290	CH	On-Demand	Anodyne	ATP4A	23	43
COc1cccc2c(N[C@@H](C)CCCCO)c(C)cnc12	ZINC000450645291	CH	On-Demand	Anodyne	ATP4A	23	43
CCSc1cccnc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450645293	EI	On-Demand	Anodyne	GRM4	27	44
CCSc1cccnc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450645293	EI	On-Demand	Anodyne	MET	46	33
CCSc1cccnc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450645293	EI	On-Demand	Anodyne	ENPP1	86	48
CCSc1cccnc1C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450645293	EI	On-Demand	Anodyne	KCNK3	48	37
Cc1ccc(NC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cc1NC(=O)CCN(C)C	ZINC000450645299	GH	On-Demand	Anodyne	LDLR	0	43
COCC1(C)CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450645300	CG	On-Demand	Anodyne	NPFFR1	45	41
COc1cc(CC(=O)NCCc2c(C)oc3ccccc23)ccc1O	ZINC000450645307	EG	On-Demand	Anodyne	THRB	0	40
COc1cc(CC(=O)NCCc2c(C)oc3ccccc23)ccc1O	ZINC000450645307	EG	On-Demand	Anodyne	TRPV1	40	59
COc1cc(CC(=O)NCCc2c(C)oc3ccccc23)ccc1O	ZINC000450645307	EG	On-Demand	Anodyne	MTNR1A	52	44
COc1cc(CC(=O)NCCc2c(C)oc3ccccc23)ccc1O	ZINC000450645307	EG	On-Demand	Anodyne	MTNR1B	38	44
COc1cc(CC(=O)NCCc2c(C)oc3ccccc23)ccc1O	ZINC000450645307	EG	On-Demand	Anodyne	NCE103	33	53
COc1cc(CC(=O)NCCc2c(C)oc3ccccc23)ccc1O	ZINC000450645307	EG	On-Demand	Anodyne	CAN2	0	53
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450645309	FG	On-Demand	Anodyne	GHRHR	41	33
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450645310	FG	On-Demand	Anodyne	GHRHR	41	33
CCCN(CCc1cccs1)C(=O)c1ocnc1-c1ccccc1	ZINC000450645311	EI	On-Demand	Anodyne	TSPO	31	42
CCn1cnc2c(N[C@H]3CCCC[C@H]3CC(F)(F)F)ncnc21	ZINC000450645320	EH	On-Demand	Anodyne	ADORA1	28	46
CCn1cnc2c(N[C@H]3CCCC[C@H]3CC(F)(F)F)ncnc21	ZINC000450645320	EH	On-Demand	Anodyne	CDK1	17	45
N#Cc1ccc(N2C[C@H](O)C[C@H]2[C@H]2CCCOC2)cc1Cl	ZINC000450645322	DF	On-Demand	Mild	NR3C2	29	40
N#Cc1ccc(N2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)cc1Cl	ZINC000450645323	DF	On-Demand	Mild	NR3C2	29	40
N#Cc1ccc(N2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)cc1Cl	ZINC000450645324	DF	On-Demand	Mild	NR3C2	29	40
N#Cc1ccc(N2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)cc1Cl	ZINC000450645325	DF	On-Demand	Mild	NR3C2	29	40
C[C@@H](c1nccs1)N1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450645339	GI	On-Demand	Anodyne	MC4R	21	41
C[C@@H](c1nccs1)N1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450645339	GI	On-Demand	Anodyne	NPBWR1	56	41
C[C@H](c1nccs1)N1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450645340	GI	On-Demand	Anodyne	MC4R	21	41
C[C@H](c1nccs1)N1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450645340	GI	On-Demand	Anodyne	NPBWR1	56	41
CC(F)(F)CCSc1nnc(-c2ccncc2)o1	ZINC000450645347	CG	On-Demand	Anodyne	GSK3A	33	51
CC(=O)c1ccc(CN2CC[C@H](C)C3(CCC3)C2)cc1	ZINC000450645351	CH	On-Demand	Anodyne	SIGMAR1	25	42
CC(=O)c1ccc(CN2CC[C@@H](C)C3(CCC3)C2)cc1	ZINC000450645352	CH	On-Demand	Anodyne	SIGMAR1	25	42
Cc1cnc(CCCC(=O)N2c3ccccc3CC[C@H]2C(C)C)o1	ZINC000450645355	EI	On-Demand	Anodyne	ACE	18	40
Cc1cnc(CCCC(=O)N2c3ccccc3CC[C@H]2C(C)C)o1	ZINC000450645355	EI	On-Demand	Anodyne	TPP2	44	32
Cc1cnc(CCCC(=O)N2c3ccccc3CC[C@@H]2C(C)C)o1	ZINC000450645356	EI	On-Demand	Anodyne	ACE	18	40
Cc1cnc(CCCC(=O)N2c3ccccc3CC[C@@H]2C(C)C)o1	ZINC000450645356	EI	On-Demand	Anodyne	TPP2	44	32
O=C(Cc1ccccc1O[C@H]1CCOC1)NCc1ccc(C(F)F)cc1	ZINC000450645357	FH	On-Demand	Anodyne	PDE4D	15	42
O=C(Cc1ccccc1O[C@H]1CCOC1)NCc1ccc(C(F)F)cc1	ZINC000450645357	FH	On-Demand	Anodyne	PDEC	0	42
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCc1ccc(C(F)F)cc1	ZINC000450645358	FH	On-Demand	Anodyne	PDE4D	15	42
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCc1ccc(C(F)F)cc1	ZINC000450645358	FH	On-Demand	Anodyne	PDEC	0	42
CC(=O)c1cccc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)c1	ZINC000450645362	FH	On-Demand	Anodyne	CHRM3	15	40
CC(=O)c1cccc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)c1	ZINC000450645362	FH	On-Demand	Anodyne	MCHR2	40	30
CC(=O)c1cccc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)c1	ZINC000450645364	FH	On-Demand	Anodyne	CHRM3	15	40
CC(=O)c1cccc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)c1	ZINC000450645364	FH	On-Demand	Anodyne	MCHR2	40	30
CC(C)CC(CC(C)C)C(=O)Nc1ccccc1CN1CCNC1=O	ZINC000450645376	EH	On-Demand	Anodyne	KCNQ2	62	36
Nc1ncccc1CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450645385	FG	On-Demand	Anodyne	SIGMAR1	29	61
Nc1ncccc1CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450645385	FG	On-Demand	Anodyne	ABCC1	54	35
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450645386	GD	On-Demand	Anodyne	VHL	41	33
COC(=O)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H](C)O	ZINC000450645393	DC	On-Demand	Anodyne	PGA	55	40
COC(=O)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H](C)O	ZINC000450645395	DC	On-Demand	Anodyne	PGA	55	40
COC(=O)[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H](C)O	ZINC000450645396	DC	On-Demand	Anodyne	PGA	55	40
COC(=O)[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H](C)O	ZINC000450645398	DC	On-Demand	Anodyne	PGA	55	40
CCOC(=O)c1sc(Sc2nccc(C)n2)nc1C	ZINC000450645400	CF	On-Demand	Anodyne	DHODH	23	43
CCC(=O)CCCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450645404	FH	On-Demand	Anodyne	DRD2	22	48
CCC(=O)CCCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450645404	FH	On-Demand	Anodyne	OPRK1	41	44
CCC(=O)CCCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450645404	FH	On-Demand	Anodyne	SIGMAR1	42	71
CCC(=O)CCCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450645404	FH	On-Demand	Anodyne	CACNA1D	31	43
CCC(=O)CCCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450645404	FH	On-Demand	Anodyne	CACNA1G	22	49
CCC(=O)CCCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450645404	FH	On-Demand	Anodyne	KCNJ1	59	37
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	THRA	0	40
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	DRD2	35	53
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	DRD1	29	64
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	DRD4	27	53
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	HRH2	0	53
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	HTR2A	28	52
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	HTR2C	25	60
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	DRD3	22	64
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	ERG2	24	53
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	HTR7	24	53
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	MC4R	51	37
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	SLC18A3	0	52
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	HTR3B	0	53
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	ABCB1	0	40
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	CYP2J2	55	39
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	NET	0	64
O=C(CCCN1CCCN(CC(F)F)CC1)c1ccc(F)cc1	ZINC000450645410	EG	On-Demand	Anodyne	AP2S1	0	53
CCN1C[C@@H](C)N(CCN(C)Cc2ccccc2)C[C@@H]1C	ZINC000450645411	CF	On-Demand	Anodyne	SIGMAR1	19	51
CCN1C[C@@H](C)N(CCN(C)Cc2ccccc2)C[C@H]1C	ZINC000450645412	CF	On-Demand	Anodyne	SIGMAR1	19	51
CCN1C[C@H](C)N(CCN(C)Cc2ccccc2)C[C@@H]1C	ZINC000450645414	CF	On-Demand	Anodyne	SIGMAR1	19	51
CCN1C[C@H](C)N(CCN(C)Cc2ccccc2)C[C@H]1C	ZINC000450645415	CF	On-Demand	Anodyne	SIGMAR1	19	51
COC(=O)c1cc(-c2ccccc2CNC(=O)[C@@H]2CCCN2C)[nH]n1	ZINC000450645416	ED	On-Demand	Anodyne	P2RX7	64	38
COC(=O)c1cc(-c2ccccc2CNC(=O)[C@H]2CCCN2C)[nH]n1	ZINC000450645417	ED	On-Demand	Anodyne	P2RX7	64	38
CCOC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)nc1	ZINC000450645423	EG	On-Demand	Anodyne	ACHE	22	42
CCOC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)nc1	ZINC000450645423	EG	On-Demand	Anodyne	GRIN2B	47	37
CCOC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)nc1	ZINC000450645423	EG	On-Demand	Anodyne	SIGMAR1	23	43
CCOC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)nc1	ZINC000450645423	EG	On-Demand	Anodyne	SSTR5	48	39
CN(CCN1CCSC[C@@H]1CO)Cc1ccccc1	ZINC000450645425	CD	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1CCSC[C@H]1CO)Cc1ccccc1	ZINC000450645426	CD	On-Demand	Anodyne	SIGMAR1	15	40
CO[C@@H](Cc1ccccc1)CN1CCC(O)(CN2CCOCC2)CC1	ZINC000450645429	ED	On-Demand	Anodyne	ABCB1	0	43
CO[C@H](Cc1ccccc1)CN1CCC(O)(CN2CCOCC2)CC1	ZINC000450645435	ED	On-Demand	Anodyne	ABCB1	0	43
COc1cc2c(N[C@@H]3CCOC3(C)C)ncnc2cc1F	ZINC000450645436	CF	On-Demand	Anodyne	EGFR	33	44
COc1cc2c(N[C@@H]3CCOC3(C)C)ncnc2cc1F	ZINC000450645436	CF	On-Demand	Anodyne	FGFR1	0	42
COc1cc2c(N[C@@H]3CCOC3(C)C)ncnc2cc1F	ZINC000450645436	CF	On-Demand	Anodyne	FLT1	24	43
COc1cc2c(N[C@@H]3CCOC3(C)C)ncnc2cc1F	ZINC000450645436	CF	On-Demand	Anodyne	EPHA2	49	38
COc1cc2c(N[C@H]3CCOC3(C)C)ncnc2cc1F	ZINC000450645438	CF	On-Demand	Anodyne	EGFR	33	44
COc1cc2c(N[C@H]3CCOC3(C)C)ncnc2cc1F	ZINC000450645438	CF	On-Demand	Anodyne	FGFR1	0	42
COc1cc2c(N[C@H]3CCOC3(C)C)ncnc2cc1F	ZINC000450645438	CF	On-Demand	Anodyne	FLT1	24	43
COc1cc2c(N[C@H]3CCOC3(C)C)ncnc2cc1F	ZINC000450645438	CF	On-Demand	Anodyne	EPHA2	49	38
COC(=O)c1csc(CN2CC[C@@H](C)[C@H](C)C2)n1	ZINC000450645446	CE	On-Demand	Anodyne	TRPC6	54	36
COC(=O)c1csc(CN2CC[C@H](C)[C@@H](C)C2)n1	ZINC000450645447	CE	On-Demand	Anodyne	TRPC6	54	36
COC(=O)c1csc(CN2CC[C@H](C)[C@H](C)C2)n1	ZINC000450645449	CE	On-Demand	Anodyne	TRPC6	54	36
COC(=O)c1csc(CN2CC[C@@H](C)[C@@H](C)C2)n1	ZINC000450645453	CE	On-Demand	Anodyne	TRPC6	54	36
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450645461	DD	On-Demand	Anodyne	FOLH1	29	44
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450645461	DD	On-Demand	Anodyne	TRPV1	0	49
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450645461	DD	On-Demand	Anodyne	GRIA1	43	30
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450645462	DD	On-Demand	Anodyne	FOLH1	29	44
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450645462	DD	On-Demand	Anodyne	TRPV1	0	49
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450645462	DD	On-Demand	Anodyne	GRIA1	43	30
Cc1cccc(F)c1NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450645463	CI	On-Demand	Anodyne	ACAT	0	40
CCNS(=O)(=O)[C@H]1CCN(Cc2ccc(C(=O)OCC)cn2)C1	ZINC000450645464	EC	On-Demand	Anodyne	SSTR5	33	41
CCNS(=O)(=O)[C@@H]1CCN(Cc2ccc(C(=O)OCC)cn2)C1	ZINC000450645465	EC	On-Demand	Anodyne	SSTR5	33	41
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	CNR1	29	43
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	CNR2	34	46
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	TPSAB1	39	51
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	L3MBTL1	0	42
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	L3MBTL3	51	42
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	MBTD1	0	42
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	KCNK3	91	35
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	KCNK9	71	34
CCn1cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c2ccccc21	ZINC000450645482	GH	On-Demand	Anodyne	TP53BP1	0	42
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)cc1	ZINC000450645486	FF	On-Demand	Anodyne	HDAC6	44	34
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)cc1	ZINC000450645486	FF	On-Demand	Anodyne	ABCB1	0	43
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)cc1	ZINC000450645486	FF	On-Demand	Anodyne	ABCG2	35	43
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)cc1	ZINC000450645486	FF	On-Demand	Anodyne	NOD1	36	48
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)cc1	ZINC000450645486	FF	On-Demand	Anodyne	RORC	42	33
CCS(=O)(=O)c1ccc(CN2CCc3ccc(C(=O)OC)cc3C2)cc1	ZINC000450645486	FF	On-Demand	Anodyne	NOD2	56	48
Cc1ccn2ncc(C(=O)Nc3cccc(C(=O)N4CCC(O)CC4)c3)c2c1	ZINC000450645487	GE	On-Demand	Anodyne	EPHB3	39	51
Cc1ccn2ncc(C(=O)Nc3cccc(C(=O)N4CCC(O)CC4)c3)c2c1	ZINC000450645487	GE	On-Demand	Anodyne	L3MBTL3	44	38
Cc1ccn2ncc(C(=O)Nc3cccc(C(=O)N4CCC(O)CC4)c3)c2c1	ZINC000450645487	GE	On-Demand	Anodyne	KCNK3	86	39
Cc1ccn2ncc(C(=O)Nc3cccc(C(=O)N4CCC(O)CC4)c3)c2c1	ZINC000450645487	GE	On-Demand	Anodyne	KCNK9	49	38
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)[C@@H]1CCCCC1(F)F	ZINC000450645493	FG	On-Demand	Anodyne	L3MBTL1	0	41
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)[C@@H]1CCCCC1(F)F	ZINC000450645493	FG	On-Demand	Anodyne	L3MBTL3	53	41
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)[C@@H]1CCCCC1(F)F	ZINC000450645493	FG	On-Demand	Anodyne	KCNK3	18	41
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)[C@H]1CCCCC1(F)F	ZINC000450645494	FG	On-Demand	Anodyne	L3MBTL1	0	41
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)[C@H]1CCCCC1(F)F	ZINC000450645494	FG	On-Demand	Anodyne	L3MBTL3	53	41
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)[C@H]1CCCCC1(F)F	ZINC000450645494	FG	On-Demand	Anodyne	KCNK3	18	41
COC(=O)C1(O)CCN([C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000450645497	FH	On-Demand	Anodyne	OPRK1	0	48
COC(=O)C1(O)CCN([C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000450645497	FH	On-Demand	Anodyne	ACACA	45	42
CC(C)OC(C)(C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450645498	DF	On-Demand	Anodyne	SMO	46	36
CC(C)OC(C)(C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450645498	DF	On-Demand	Anodyne	ETHR	64	48
COC(=O)C1(O)CCN([C@H](C)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000450645499	FH	On-Demand	Anodyne	OPRK1	0	48
COC(=O)C1(O)CCN([C@H](C)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000450645499	FH	On-Demand	Anodyne	ACACA	45	42
C[C@H]1CN(CC2CCC(=O)CC2)[C@H](C)CN1Cc1ccccc1	ZINC000450645500	DG	On-Demand	Anodyne	SIGMAR1	24	43
C[C@@H]1CN(CC2CCC(=O)CC2)[C@H](C)CN1Cc1ccccc1	ZINC000450645502	DG	On-Demand	Anodyne	SIGMAR1	24	43
C[C@H]1CN(CC2CCC(=O)CC2)[C@@H](C)CN1Cc1ccccc1	ZINC000450645505	DG	On-Demand	Anodyne	SIGMAR1	24	43
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1CC1CCC(=O)CC1	ZINC000450645507	DG	On-Demand	Anodyne	SIGMAR1	24	43
Cc1cccc(Cl)c1C(=O)N1CC[C@H](C(C)(C)C)[C@H](O)C1	ZINC000450645508	DH	On-Demand	Anodyne	CCR5	45	39
Cc1cccc(Cl)c1C(=O)N1CC[C@H](C(C)(C)C)[C@@H](O)C1	ZINC000450645509	DH	On-Demand	Anodyne	CCR5	45	39
Cc1cccc(Cl)c1C(=O)N1CC[C@H](C(C)(C)C)[C@@H](O)C1	ZINC000450645509	DH	On-Demand	Anodyne	L3MBTL3	48	34
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](C(C)(C)C)[C@@H](O)C1	ZINC000450645510	DH	On-Demand	Anodyne	CCR5	45	39
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](C(C)(C)C)[C@@H](O)C1	ZINC000450645510	DH	On-Demand	Anodyne	L3MBTL3	48	34
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](C(C)(C)C)[C@H](O)C1	ZINC000450645511	DH	On-Demand	Anodyne	CCR5	45	39
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](C(C)(C)C)[C@H](O)C1	ZINC000450645511	DH	On-Demand	Anodyne	L3MBTL3	48	34
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450645528	EG	On-Demand	Anodyne	RHOA	0	41
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450645529	EG	On-Demand	Anodyne	RHOA	0	41
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450645530	EG	On-Demand	Anodyne	RHOA	0	41
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450645531	EG	On-Demand	Anodyne	RHOA	0	41
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645537	FJ	On-Demand	Anodyne	CPT1A	49	33
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645537	FJ	On-Demand	Anodyne	CSF1R	21	43
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645537	FJ	On-Demand	Anodyne	TAAR1	24	40
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645537	FJ	On-Demand	Anodyne	KCNK3	100	51
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645537	FJ	On-Demand	Anodyne	KCNK9	62	51
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645537	FJ	On-Demand	Anodyne	PARP10	0	40
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645538	FJ	On-Demand	Anodyne	CPT1A	49	33
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645538	FJ	On-Demand	Anodyne	CSF1R	21	43
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645538	FJ	On-Demand	Anodyne	TAAR1	24	40
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645538	FJ	On-Demand	Anodyne	KCNK3	100	51
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645538	FJ	On-Demand	Anodyne	KCNK9	62	51
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450645538	FJ	On-Demand	Anodyne	PARP10	0	40
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450645539	FG	On-Demand	Anodyne	PDGFRB	42	40
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450645539	FG	On-Demand	Anodyne	FAAH	18	54
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450645539	FG	On-Demand	Anodyne	ABCB1	26	54
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450645540	FG	On-Demand	Anodyne	PDGFRB	42	40
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450645540	FG	On-Demand	Anodyne	FAAH	18	54
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)Nc2ccc(C)cc2)CC1	ZINC000450645540	FG	On-Demand	Anodyne	ABCB1	26	54
COC(=O)c1coc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)n1	ZINC000450645550	FF	On-Demand	Anodyne	LIPG	43	47
COC(=O)c1coc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)n1	ZINC000450645551	FF	On-Demand	Anodyne	LIPG	43	47
CCc1nc2ccccc2n1C1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450645554	FI	On-Demand	Anodyne	FPR2	28	41
C=CCN(CCC(=O)NCc1ccc(OC)cc1OC)C1CC1	ZINC000450645555	DE	On-Demand	Mild	MTNR1A	41	36
COc1cc(CN2CCC3(CCCN3C)CC2)ccc1Cl	ZINC000450645556	DG	On-Demand	Anodyne	SSTR5	40	35
COCCOC[C@@H](O)CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450645560	FD	On-Demand	Anodyne	LIPG	45	48
FC(F)(F)c1ccc(C2CCN(CCc3cscn3)CC2)cc1	ZINC000450645572	EJ	On-Demand	Anodyne	SCN5A	40	36
COCCOC[C@H](O)CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450645573	FD	On-Demand	Anodyne	LIPG	45	48
COCCOC[C@@H](O)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450645574	FD	On-Demand	Anodyne	LIPG	45	48
COCCOC[C@H](O)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450645576	FD	On-Demand	Anodyne	LIPG	45	48
COc1cc(NC(=O)[C@@H]2CC23CCSCC3)ccc1OC(C)C	ZINC000450645577	EH	On-Demand	Anodyne	ENPP1	60	31
COc1cc(NC(=O)[C@H]2CC23CCSCC3)ccc1OC(C)C	ZINC000450645578	EH	On-Demand	Anodyne	ENPP1	60	31
COCC1(C)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450645587	CG	On-Demand	Anodyne	MCHR2	58	34
COCC1(C)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450645587	CG	On-Demand	Anodyne	CCR8	43	41
COCC1(C)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450645587	CG	On-Demand	Anodyne	NPFFR1	45	38
Cc1ccc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cc1NC(=O)CCN(C)C	ZINC000450645589	GG	On-Demand	Anodyne	LDLR	0	40
Cc1ccc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cc1NC(=O)CCN(C)C	ZINC000450645589	GG	On-Demand	Anodyne	BTK	15	43
Cc1nc(-c2ccccn2)nc(N[C@H](C)CCCCO)c1C	ZINC000450645592	DF	On-Demand	Anodyne	METAP1	68	42
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ccnc2cc1F	ZINC000450645593	CF	On-Demand	Anodyne	FGFR2	45	37
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ccnc2cc1F	ZINC000450645593	CF	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ccnc2cc1F	ZINC000450645593	CF	On-Demand	Anodyne	FLT1	0	40
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ccnc2cc1F	ZINC000450645593	CF	On-Demand	Anodyne	PDE3B	58	32
COc1cc2c(N[C@H]3CC[C@@H](CO)C3)ccnc2cc1F	ZINC000450645593	CF	On-Demand	Anodyne	PDGFRA	51	36
CCc1cc(CCCN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)on1	ZINC000450645596	FH	On-Demand	Anodyne	LIPG	20	44
CCc1cc(CCCN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)on1	ZINC000450645597	FH	On-Demand	Anodyne	LIPG	20	44
Cc1nc(-c2ccccn2)nc(N[C@@H](C)CCCCO)c1C	ZINC000450645600	DF	On-Demand	Anodyne	METAP1	68	42
Cc1cc(-c2nc(C(=O)N[C@H](C)CC(F)(F)F)co2)ccn1	ZINC000450645601	DG	On-Demand	Anodyne	IRAK4	22	45
Cc1cc(-c2nc(C(=O)N[C@@H](C)CC(F)(F)F)co2)ccn1	ZINC000450645602	DG	On-Demand	Anodyne	IRAK4	22	45
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CC[C@H]1C1CC1	ZINC000450645616	FF	On-Demand	Bother	CASP3	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CC[C@@H]1C1CC1	ZINC000450645617	FF	On-Demand	Bother	CASP3	0	40
CNC(=O)c1cccnc1N[C@@H](C)CCCCO	ZINC000450645627	CD	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	41
CNC(=O)c1cccnc1N[C@H](C)CCCCO	ZINC000450645628	CD	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	41
FC(F)(F)c1ccc(O[C@@H]2CCN(CCc3cscn3)C2)nc1	ZINC000450645636	EG	On-Demand	Anodyne	SCN5A	43	37
FC(F)(F)c1ccc(O[C@H]2CCN(CCc3cscn3)C2)nc1	ZINC000450645637	EG	On-Demand	Anodyne	SCN5A	43	37
CC(C)CCCC(=O)N[C@H](C)CC(F)(F)F	ZINC000450645660	BG	On-Demand	Anodyne	Q6UB75_PIG	0	40
CC(C)CCCC(=O)N[C@H](C)CC(F)(F)F	ZINC000450645660	BG	On-Demand	Anodyne	NOD1	47	34
CC(C)CCCC(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645661	BG	On-Demand	Anodyne	Q6UB75_PIG	0	40
CC(C)CCCC(=O)N[C@@H](C)CC(F)(F)F	ZINC000450645661	BG	On-Demand	Anodyne	NOD1	47	34
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1	ZINC000450645680	CD	On-Demand	Anodyne	MLNR	40	36
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1	ZINC000450645681	CD	On-Demand	Anodyne	MLNR	40	36
CCS(=O)(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1	ZINC000450645682	CD	On-Demand	Anodyne	MLNR	40	36
CCS(=O)(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1	ZINC000450645683	CD	On-Demand	Anodyne	MLNR	40	36
C=CCn1c(SCCCCCC(C)=O)nnc1-c1ccoc1C	ZINC000450645704	EI	On-Demand	Mild	HCRTR2	21	42
Cc1cnc(CCCC(=O)NCc2ccc(OCc3ccccc3F)cc2)o1	ZINC000450645720	GI	On-Demand	Anodyne	FAAH	17	42
Cc1cnc(CCCC(=O)NCc2ccc(OCc3ccccc3F)cc2)o1	ZINC000450645720	GI	On-Demand	Anodyne	FFAR4	43	37
Cc1cnc(CCCC(=O)NCc2ccc(OCc3ccccc3F)cc2)o1	ZINC000450645720	GI	On-Demand	Anodyne	SUCNR1	45	36
CC(C)Cn1cnc2c1c(=O)n(CC[C@H](C)O)c(=O)n2Cc1ccccc1	ZINC000450645730	FD	On-Demand	Anodyne	SLC16A1	44	34
CC(C)Cn1cnc2c1c(=O)n(CC[C@@H](C)O)c(=O)n2Cc1ccccc1	ZINC000450645731	FD	On-Demand	Anodyne	SLC16A1	44	34
c1ccc(CN2CCC3(CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450645737	FH	On-Demand	Anodyne	SIGMAR1	55	39
CCOC(=O)c1sc(Sc2cc(C)nc(C)n2)nc1C	ZINC000450645781	DG	On-Demand	Anodyne	DHODH	23	44
COc1cc(C(=O)N2CCC(c3noc(C4CC4)n3)CC2)c([N+](=O)[O-])cc1F	ZINC000450645785	GG	On-Demand	Bother	ETHR	60	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2[C@H](C)O)on1	ZINC000450645789	CD	On-Demand	Anodyne	CPT1A	43	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2[C@@H](C)O)on1	ZINC000450645790	CD	On-Demand	Anodyne	CPT1A	43	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2[C@@H](C)O)on1	ZINC000450645791	CD	On-Demand	Anodyne	CPT1A	43	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2[C@H](C)O)on1	ZINC000450645792	CD	On-Demand	Anodyne	CPT1A	43	40
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450645809	FG	On-Demand	Anodyne	SMO	50	39
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450645809	FG	On-Demand	Anodyne	ETHR	79	50
Cc1cc(C(=O)N2c3ccccc3CC[C@@H]2C(C)C)nn1C(C)C	ZINC000450645811	EI	On-Demand	Anodyne	ACE	17	42
Cc1cc(C(=O)N2c3ccccc3CC[C@@H]2C(C)C)nn1C(C)C	ZINC000450645811	EI	On-Demand	Anodyne	TPP2	56	35
C[C@@H](NC(=O)C1(C(=O)C2CC2)CC1)c1ccc(Cl)c2ccccc12	ZINC000450645814	EI	On-Demand	Anodyne	SDH1	0	41
C[C@H](NC(=O)C1(C(=O)C2CC2)CC1)c1ccc(Cl)c2ccccc12	ZINC000450645815	EI	On-Demand	Anodyne	SDH1	0	41
Cc1cc(C(=O)N2c3ccccc3CC[C@H]2C(C)C)nn1C(C)C	ZINC000450645821	EI	On-Demand	Anodyne	ACE	17	42
Cc1cc(C(=O)N2c3ccccc3CC[C@H]2C(C)C)nn1C(C)C	ZINC000450645821	EI	On-Demand	Anodyne	TPP2	56	35
Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCc2ccc(C(F)F)cc2)CC3)c1	ZINC000450645828	GI	On-Demand	Anodyne	EPHX2	15	40
COc1ccc(CNC(=O)CCN2CCOCC23CCCC3)c(OC)c1	ZINC000450645833	FE	On-Demand	Anodyne	HTR7	18	40
COc1ccc(CNC(=O)CCN2CCOCC23CCCC3)c(OC)c1	ZINC000450645833	FE	On-Demand	Anodyne	MTNR1A	46	41
COc1ccc(CNC(=O)CCN2CCOCC23CCCC3)c(OC)c1	ZINC000450645833	FE	On-Demand	Anodyne	MTNR1B	37	41
CCOCc1nc(C)c(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)s1	ZINC000450645834	GF	On-Demand	Anodyne	P2RX7	17	40
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCc2ccc(C(F)F)cc2)CC3)c1	ZINC000450645835	GI	On-Demand	Anodyne	EPHX2	15	40
CCOC(=O)c1sc(Sc2cnn(C)c(=O)c2Cl)nc1C	ZINC000450645836	EF	On-Demand	Anodyne	DHODH	18	43
CC(=O)c1ccc(CN2CCO[C@H](c3cccc(C#N)c3)C2)cc1	ZINC000450645840	DG	On-Demand	Mild	DRD4	18	44
CC(=O)c1ccc(CN2CCO[C@H](c3cccc(C#N)c3)C2)cc1	ZINC000450645840	DG	On-Demand	Mild	MLNR	27	41
CC(=O)c1ccc(CN2CCO[C@H](c3cccc(C#N)c3)C2)cc1	ZINC000450645840	DG	On-Demand	Mild	MCHR1	19	41
CC(=O)c1ccc(CN2CCO[C@@H](c3cccc(C#N)c3)C2)cc1	ZINC000450645844	DG	On-Demand	Mild	DRD4	18	44
CC(=O)c1ccc(CN2CCO[C@@H](c3cccc(C#N)c3)C2)cc1	ZINC000450645844	DG	On-Demand	Mild	MLNR	27	41
CC(=O)c1ccc(CN2CCO[C@@H](c3cccc(C#N)c3)C2)cc1	ZINC000450645844	DG	On-Demand	Mild	MCHR1	19	41
CCc1cc(N2CCOC[C@@H](O)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450645845	ED	On-Demand	Bother	MTOR	44	36
CCOC(=O)c1sc(Sc2ccc3nnnn3n2)nc1C	ZINC000450645846	DD	On-Demand	Anodyne	DHODH	22	42
CCc1cc(N2CCOC[C@H](O)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450645847	ED	On-Demand	Bother	MTOR	44	36
C[C@@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645863	EH	On-Demand	Anodyne	HTR1A	45	48
C[C@@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645863	EH	On-Demand	Anodyne	DRD2	23	48
C[C@@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645863	EH	On-Demand	Anodyne	DRD4	26	45
C[C@@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645863	EH	On-Demand	Anodyne	HTR2A	37	44
C[C@@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645863	EH	On-Demand	Anodyne	DRD3	24	43
C[C@@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645863	EH	On-Demand	Anodyne	HTR7	48	48
C[C@@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645863	EH	On-Demand	Anodyne	SIGMAR1	26	43
C[C@@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645863	EH	On-Demand	Anodyne	BCL2A1	47	41
C[C@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645864	EH	On-Demand	Anodyne	HTR1A	45	48
C[C@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645864	EH	On-Demand	Anodyne	DRD2	23	48
C[C@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645864	EH	On-Demand	Anodyne	DRD4	26	45
C[C@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645864	EH	On-Demand	Anodyne	HTR2A	37	44
C[C@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645864	EH	On-Demand	Anodyne	DRD3	24	43
C[C@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645864	EH	On-Demand	Anodyne	HTR7	48	48
C[C@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645864	EH	On-Demand	Anodyne	SIGMAR1	26	43
C[C@H](O)CCCN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450645864	EH	On-Demand	Anodyne	BCL2A1	47	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(C)cc1Br	ZINC000450645865	GF	On-Demand	Anodyne	CCR2	26	43
COC(=O)[C@H](CC(F)(F)F)NC(=O)Cc1ccc(C)cc1Br	ZINC000450645871	GF	On-Demand	Anodyne	CCR2	26	43
CC(=O)N[C@H](C(=O)NCc1ccc(C(F)F)cc1)C(C)(C)C	ZINC000450645878	DF	On-Demand	Anodyne	TRPV1	15	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450645881	FH	On-Demand	Anodyne	ANPEP	46	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450645881	FH	On-Demand	Anodyne	CAPN1	50	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450645881	FH	On-Demand	Anodyne	CAPN2	62	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450645881	FH	On-Demand	Anodyne	FPR1	49	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450645881	FH	On-Demand	Anodyne	NPR	55	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000450645881	FH	On-Demand	Anodyne	AMP1_PLAFQ	29	42
Clc1ccc(CCN2CCN(Cc3cnn[nH]3)CC2)cc1Cl	ZINC000450645900	EE	On-Demand	Anodyne	SIGMAR1	28	66
CCC[C@@H](CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450645912	EI	On-Demand	Anodyne	SMO	45	32
CCC[C@@H](CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450645912	EI	On-Demand	Anodyne	ETHR	63	46
CCC[C@H](CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450645913	EI	On-Demand	Anodyne	SMO	45	32
CCC[C@H](CC(C)C)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450645913	EI	On-Demand	Anodyne	ETHR	63	46
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cccc(SC)c1	ZINC000450645930	CD	On-Demand	Anodyne	PREP	15	45
CC(=O)c1cccc(CN2CCCN(CC(F)F)CC2)c1	ZINC000450645931	CF	On-Demand	Anodyne	MGLL	0	41
CCc1c(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)oc2ccccc12	ZINC000450645942	GH	On-Demand	Anodyne	KCNK3	50	33
CN(CCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)Cc1ccccc1	ZINC000450645947	FG	On-Demand	Anodyne	HRH3	0	45
CN(CCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)Cc1ccccc1	ZINC000450645947	FG	On-Demand	Anodyne	SIGMAR1	37	45
CN(CCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)Cc1ccccc1	ZINC000450645947	FG	On-Demand	Anodyne	PREP	42	34
CN(CCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)Cc1ccccc1	ZINC000450645948	FG	On-Demand	Anodyne	HRH3	0	45
CN(CCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)Cc1ccccc1	ZINC000450645948	FG	On-Demand	Anodyne	SIGMAR1	37	45
CN(CCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)Cc1ccccc1	ZINC000450645948	FG	On-Demand	Anodyne	PREP	42	34
C[C@@H](c1nccs1)N1CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450645949	FG	On-Demand	Anodyne	SLC6A7	0	40
C[C@H](c1nccs1)N1CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450645950	FG	On-Demand	Anodyne	SLC6A7	0	40
CCCc1nc(C)c(CSc2nnc(-c3ccc(Cl)cc3)o2)o1	ZINC000450645961	EJ	On-Demand	Anodyne	GSK3B	17	42
CCCc1nc(C)c(CSc2nnc(-c3ccc(Cl)cc3)o2)o1	ZINC000450645961	EJ	On-Demand	Anodyne	GSK3A	43	38
CCCc1nc(C)c(CSc2nnc(-c3ccc(Cl)cc3)o2)o1	ZINC000450645961	EJ	On-Demand	Anodyne	TERT	23	44
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450645983	EI	On-Demand	Anodyne	GPR88	0	41
C[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450645984	EI	On-Demand	Anodyne	GPR88	0	41
CN(C)CCOCCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450645987	CC	On-Demand	Anodyne	HPGDS	20	44
COC(=O)c1ccc(CN2CCC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450645990	ED	On-Demand	Anodyne	DRD4	24	42
COC(=O)c1ccc(CN2CCC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450645990	ED	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CCC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450645990	ED	On-Demand	Anodyne	OPRK1	34	40
COC(=O)c1ccc(CN2CCC[C@@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450645990	ED	On-Demand	Anodyne	HTR4	58	35
COC(=O)c1ccc(CN2CCC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450645991	ED	On-Demand	Anodyne	DRD4	24	42
COC(=O)c1ccc(CN2CCC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450645991	ED	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CCC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450645991	ED	On-Demand	Anodyne	OPRK1	34	40
COC(=O)c1ccc(CN2CCC[C@H](S(N)(=O)=O)C2)cc1Cl	ZINC000450645991	ED	On-Demand	Anodyne	HTR4	58	35
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450645993	FF	On-Demand	Anodyne	KCNK9	41	36
CCOC(=O)c1ccc(CN(C)CCC2CCN(c3ccncc3)CC2)nc1	ZINC000450645998	GG	On-Demand	Anodyne	F10	17	44
CCOC(=O)c1ccc(CN(C)CCC2CCN(c3ccncc3)CC2)nc1	ZINC000450645998	GG	On-Demand	Anodyne	SSTR1	21	41
c1cncc(CC2CCN(C[C@H]3COCCO3)CC2)c1	ZINC000450646011	CD	On-Demand	Anodyne	ACHP_LYMST	20	40
c1cncc(CC2CCN(C[C@@H]3COCCO3)CC2)c1	ZINC000450646012	CD	On-Demand	Anodyne	ACHP_LYMST	20	40
FC1(F)CC(CN2CCC(Cc3cccnc3)CC2)C1	ZINC000450646014	CG	On-Demand	Anodyne	ACHP_LYMST	22	43
Cc1nccc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)c1Cl	ZINC000450646033	FE	On-Demand	Anodyne	CA2	18	42
Cc1nccc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)c1Cl	ZINC000450646033	FE	On-Demand	Anodyne	CA12	17	42
COC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450646048	FG	On-Demand	Anodyne	HTR2A	17	43
COC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450646048	FG	On-Demand	Anodyne	OPRK1	37	41
COC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450646048	FG	On-Demand	Anodyne	TACR2	69	36
COC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450646048	FG	On-Demand	Anodyne	SIGMAR1	38	50
COC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450646048	FG	On-Demand	Anodyne	CCR1	48	37
COC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450646048	FG	On-Demand	Anodyne	ADAM17	17	42
COC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450646048	FG	On-Demand	Anodyne	DNAE	53	34
COC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450646048	FG	On-Demand	Anodyne	CACNA1G	17	42
CSc1cccc(C(=O)Nc2ccc(Cc3nnc4n3CCCCC4)cc2)c1	ZINC000450646049	GJ	On-Demand	Anodyne	NOD1	26	41
CSc1cccc(C(=O)Nc2ccc(Cc3nnc4n3CCCCC4)cc2)c1	ZINC000450646049	GJ	On-Demand	Anodyne	NOD2	40	41
Clc1ccc(CCSc2nnc3n2CCCCC3)cc1	ZINC000450646056	DH	On-Demand	Anodyne	HSD11B2	21	48
Cc1ccc(NC(=O)c2ccc(N[C@@H](C)CCCCO)nc2)cc1	ZINC000450646059	EH	On-Demand	Anodyne	PRNP	51	33
Cc1ccc(NC(=O)c2ccc(N[C@@H](C)CCCCO)nc2)cc1	ZINC000450646059	EH	On-Demand	Anodyne	P4HTM	0	50
Cc1ccc(NC(=O)c2ccc(N[C@H](C)CCCCO)nc2)cc1	ZINC000450646060	EH	On-Demand	Anodyne	PRNP	51	33
Cc1ccc(NC(=O)c2ccc(N[C@H](C)CCCCO)nc2)cc1	ZINC000450646060	EH	On-Demand	Anodyne	P4HTM	0	50
C[C@@H](CCCCO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450646065	CH	On-Demand	Anodyne	HRP1_PLAFA	22	52
C[C@@H](CCCCO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450646065	CH	On-Demand	Anodyne	RBP_CHICK	0	52
C[C@H](CCCCO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450646067	CH	On-Demand	Anodyne	HRP1_PLAFA	22	52
C[C@H](CCCCO)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450646067	CH	On-Demand	Anodyne	RBP_CHICK	0	52
CC(=O)N[C@H](C(=O)NCCc1c(C)oc2ccccc12)C(C)(C)C	ZINC000450646083	EF	On-Demand	Anodyne	MTNR1A	33	48
CC(=O)N[C@H](C(=O)NCCc1c(C)oc2ccccc12)C(C)(C)C	ZINC000450646083	EF	On-Demand	Anodyne	MTNR1B	23	48
COC(=O)c1coc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450646084	FE	On-Demand	Anodyne	P2RY12	16	41
COC(=O)c1coc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450646084	FE	On-Demand	Anodyne	PDGFRB	40	38
COC(=O)c1coc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450646084	FE	On-Demand	Anodyne	FAAH	15	47
CCOC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)nc1	ZINC000450646096	CD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)nc1	ZINC000450646097	CD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)nc1	ZINC000450646098	CD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)nc1	ZINC000450646099	CD	On-Demand	Anodyne	SSTR5	42	35
C[C@@H](O)CCSc1nc2scc(-c3ccccc3)c2c(=O)n1C	ZINC000450646133	EH	On-Demand	Anodyne	TGM2	24	50
C[C@H](O)CCSc1nc2scc(-c3ccccc3)c2c(=O)n1C	ZINC000450646134	EH	On-Demand	Anodyne	TGM2	24	50
Cc1ccc(NC(=O)[C@@H]2Cc3cccc(C)c3O2)cc1NC(=O)CCN(C)C	ZINC000450646135	GG	On-Demand	Anodyne	PTPRF	43	33
Cc1ccc(NC(=O)[C@H]2Cc3cccc(C)c3O2)cc1NC(=O)CCN(C)C	ZINC000450646136	GG	On-Demand	Anodyne	PTPRF	43	33
Cc1cc(C2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)CC2)n[nH]1	ZINC000450646137	FJ	On-Demand	Anodyne	DRD4	21	49
Cc1cc(C2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)CC2)n[nH]1	ZINC000450646137	FJ	On-Demand	Anodyne	AKT1	20	42
Cc1cc(C2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)CC2)n[nH]1	ZINC000450646140	FJ	On-Demand	Anodyne	DRD4	21	49
Cc1cc(C2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)CC2)n[nH]1	ZINC000450646140	FJ	On-Demand	Anodyne	AKT1	20	42
CCc1nc2ccccc2n1C1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450646144	FI	On-Demand	Anodyne	FPR2	28	41
CCc1nc2ccccc2n1C1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450646145	FI	On-Demand	Anodyne	FPR2	28	41
CC(=O)CCCCCn1cnc2scc(-c3ccccc3)c2c1=O	ZINC000450646151	EI	On-Demand	Anodyne	FAAH	40	34
CC(=O)CCCCCn1cnc2scc(-c3ccccc3)c2c1=O	ZINC000450646151	EI	On-Demand	Anodyne	TGM2	19	42
C[C@@H](Sc1nc(C2CC2)n(-c2ccccc2)n1)C(=O)Nc1nccs1	ZINC000450646181	FH	On-Demand	Anodyne	MAP1	83	34
C[C@H](Sc1nc(C2CC2)n(-c2ccccc2)n1)C(=O)Nc1nccs1	ZINC000450646182	FH	On-Demand	Anodyne	MAP1	83	34
COc1cnc(N[C@H]2CC[C@@H](CO)C2)nc1N[C@H]1CC[C@@H](CO)C1	ZINC000450646193	ED	On-Demand	Anodyne	TYRO3	40	38
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CCCC(=O)C1CC1	ZINC000450646201	GJ	On-Demand	Anodyne	LDLR	0	44
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CCCC(=O)C1CC1	ZINC000450646201	GJ	On-Demand	Anodyne	BTK	21	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CCCC(=O)C1CC1	ZINC000450646201	GJ	On-Demand	Anodyne	KCNK3	83	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CCCC(=O)C1CC1	ZINC000450646201	GJ	On-Demand	Anodyne	KCNK9	44	47
COc1cc2c(cc1NC(=O)Cc1cc(C)ccc1F)NC(=O)CC2	ZINC000450646202	EG	On-Demand	Anodyne	PKM	40	41
COc1cc(NC(=O)c2ccc(-n3nnnc3C)cc2F)ccc1OC(C)C	ZINC000450646203	GG	On-Demand	Anodyne	MET	41	36
COc1cc(NC(=O)c2ccc(-n3nnnc3C)cc2F)ccc1OC(C)C	ZINC000450646203	GG	On-Demand	Anodyne	ENPP1	71	34
CCn1nnc(C)c1CN(Cc1cccnc1)Cc1ccco1	ZINC000450646204	DF	On-Demand	Anodyne	NR1D1	43	35
COc1cc(NC(=O)c2ccc(C(F)(F)F)[nH]2)ccc1OC(C)C	ZINC000450646207	EI	On-Demand	Anodyne	ENPP1	75	36
COc1cc(NC(=O)c2ccc(C(F)(F)F)[nH]2)ccc1OC(C)C	ZINC000450646207	EI	On-Demand	Anodyne	KCNK3	50	40
COc1cc(NC(=O)c2ccc(C(F)(F)F)[nH]2)ccc1OC(C)C	ZINC000450646207	EI	On-Demand	Anodyne	KCNK9	39	40
COc1cc(NC(=O)c2cc(C#N)[nH]c2C)ccc1OC(C)C	ZINC000450646210	DG	On-Demand	Mild	ENPP1	60	35
COc1cc(NC(=O)c2cc(C#N)[nH]c2C)ccc1OC(C)C	ZINC000450646210	DG	On-Demand	Mild	KCNK3	48	41
COc1cc(NC(=O)c2cc(C#N)[nH]c2C)ccc1OC(C)C	ZINC000450646210	DG	On-Demand	Mild	KCNK9	46	41
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	CPT1A	71	37
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	CPT2	45	37
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	PRNP	18	43
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	GRM4	28	41
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	NR1H4	15	43
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	CPT1B	41	36
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	CSF1R	19	40
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	TAAR1	47	44
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	KCNK3	106	46
CC(C)OC(C)(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450646213	GJ	On-Demand	Anodyne	KCNK9	72	46
C[C@H](CCCCO)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450646218	EE	On-Demand	Anodyne	LRRK2	28	41
C[C@@H](CCCCO)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450646220	EE	On-Demand	Anodyne	LRRK2	28	41
COc1cc(NC(=O)CCc2nc3cnccc3[nH]2)ccc1OC(C)C	ZINC000450646222	FG	On-Demand	Anodyne	IMPDH2	0	40
COc1cc(NC(=O)CCc2nc3cnccc3[nH]2)ccc1OC(C)C	ZINC000450646222	FG	On-Demand	Anodyne	ENPP1	76	46
COc1cc(NC(=O)c2cn(CC3CC3)nn2)ccc1OC(C)C	ZINC000450646223	EF	On-Demand	Anodyne	ENPP1	65	38
COc1cc(NC(=O)Cc2cn(C)nc2C)ccc1OC(C)C	ZINC000450646228	DF	On-Demand	Anodyne	PDGFRB	32	42
COc1cc(NC(=O)Cc2cn(C)nc2C)ccc1OC(C)C	ZINC000450646228	DF	On-Demand	Anodyne	ENPP1	70	41
COc1cc(NC(=O)Cc2cn(C)nc2C)ccc1OC(C)C	ZINC000450646228	DF	On-Demand	Anodyne	IMDH_CRYPV	31	45
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646233	FG	On-Demand	Anodyne	SLC6A1	65	34
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646233	FG	On-Demand	Anodyne	PREP	42	38
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646233	FG	On-Demand	Anodyne	RHODESAIN	0	47
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646233	FG	On-Demand	Anodyne	SFRP1	59	43
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646233	FG	On-Demand	Anodyne	WNT3	53	34
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646235	FG	On-Demand	Anodyne	SLC6A1	65	34
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646235	FG	On-Demand	Anodyne	PREP	42	38
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646235	FG	On-Demand	Anodyne	RHODESAIN	0	47
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646235	FG	On-Demand	Anodyne	SFRP1	59	43
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646235	FG	On-Demand	Anodyne	WNT3	53	34
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646237	FG	On-Demand	Anodyne	SLC6A1	65	34
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646237	FG	On-Demand	Anodyne	PREP	42	38
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646237	FG	On-Demand	Anodyne	RHODESAIN	0	47
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646237	FG	On-Demand	Anodyne	SFRP1	59	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450646237	FG	On-Demand	Anodyne	WNT3	53	34
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646239	FG	On-Demand	Anodyne	SLC6A1	65	34
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646239	FG	On-Demand	Anodyne	PREP	42	38
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646239	FG	On-Demand	Anodyne	RHODESAIN	0	47
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646239	FG	On-Demand	Anodyne	SFRP1	59	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450646239	FG	On-Demand	Anodyne	WNT3	53	34
CCOC(=O)c1ccc(CN2CCc3cccc(F)c3C2)nc1	ZINC000450646249	DF	On-Demand	Anodyne	NOD1	29	46
CCOC(=O)c1ccc(CN2CCc3cccc(F)c3C2)nc1	ZINC000450646249	DF	On-Demand	Anodyne	NOD2	45	46
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450646254	GG	On-Demand	Anodyne	NPY2R	50	35
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450646254	GG	On-Demand	Anodyne	RHOA	0	45
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450646255	GG	On-Demand	Anodyne	NPY2R	50	35
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450646255	GG	On-Demand	Anodyne	RHOA	0	45
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450646256	GG	On-Demand	Anodyne	NPY2R	50	35
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450646256	GG	On-Demand	Anodyne	RHOA	0	45
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450646257	GG	On-Demand	Anodyne	NPY2R	50	35
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450646257	GG	On-Demand	Anodyne	RHOA	0	45
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450646258	GF	On-Demand	Anodyne	SFRP1	101	39
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450646258	GF	On-Demand	Anodyne	WNT3	67	35
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450646258	GF	On-Demand	Anodyne	L3MBTL3	52	38
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450646259	GF	On-Demand	Anodyne	SFRP1	101	39
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450646259	GF	On-Demand	Anodyne	WNT3	67	35
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450646259	GF	On-Demand	Anodyne	L3MBTL3	52	38
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@H](Cc2ccccc2)C1	ZINC000450646269	EE	On-Demand	Anodyne	SMO	28	43
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@@H](Cc2ccccc2)C1	ZINC000450646270	EE	On-Demand	Anodyne	SMO	28	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccsc1C	ZINC000450646303	DH	On-Demand	Anodyne	HTR6	37	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1C	ZINC000450646304	DH	On-Demand	Anodyne	NQO2	27	47
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1C	ZINC000450646304	DH	On-Demand	Anodyne	HTR6	37	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1C	ZINC000450646304	DH	On-Demand	Anodyne	PPARD	45	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1C	ZINC000450646304	DH	On-Demand	Anodyne	MTNR1A	32	47
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1C	ZINC000450646304	DH	On-Demand	Anodyne	EBP	19	46
CCOc1ccc(C2=CCN(CC[C@H](C)O)CC2)cc1	ZINC000450646313	CF	On-Demand	Anodyne	QDPR	0	41
CCOc1ccc(C2=CCN(CC[C@@H](C)O)CC2)cc1	ZINC000450646314	CF	On-Demand	Anodyne	QDPR	0	41
CCc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)n1	ZINC000450646322	FF	On-Demand	Anodyne	RHOA	0	42
CCc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)n1	ZINC000450646323	FF	On-Demand	Anodyne	RHOA	0	42
CC(=O)c1ccc(CN2CCc3cccc(F)c3C2)cc1	ZINC000450646324	CH	On-Demand	Anodyne	DRD4	32	42
CC(=O)c1ccc(CN2CCc3cccc(F)c3C2)cc1	ZINC000450646324	CH	On-Demand	Anodyne	NOD1	37	49
CC(=O)c1ccc(CN2CCc3cccc(F)c3C2)cc1	ZINC000450646324	CH	On-Demand	Anodyne	NOD2	55	48
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	ACE	55	41
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	OPRM1	42	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	OPRD1	39	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	P2RY12	59	37
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	MME	100	41
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	ANPEP	57	35
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	TACR1	15	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CTSD	36	41
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	MC4R	67	39
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	FCER2	74	34
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	TACR2	40	39
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	METAP1	16	50
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CTSB	39	45
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	TRY2_BOVIN	58	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	PAPA1_CARPA	45	36
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CYSP_TRYCR	65	48
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CTSL	43	38
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CACNA1B	35	42
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	TIMP3	62	37
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CAPNS1	56	36
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	MMP3	22	51
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	MMP8	18	41
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	HLA-DRB1	47	32
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	REN	77	44
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CTSS	36	45
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CAPN1	72	41
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	MMP9	22	41
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CAPN2	64	41
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	CTSE	40	34
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	ACE2	102	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	PGA5	54	34
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	FPR1	72	35
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	POL	0	45
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	GAG-PRO	48	34
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	PSMB5	42	37
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	SLC15A2	0	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	BLA1_STEMA	51	35
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	PSMB8	65	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	Q9N6S8_PLAFA	23	45
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	BRCA1	61	34
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	PSMB9	0	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	GPR142	45	32
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	PSMB10	0	40
C[C@@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646338	GD	On-Demand	Anodyne	DERP1	0	45
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	ACE	55	41
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	OPRM1	42	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	OPRD1	39	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	P2RY12	59	37
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	MME	100	41
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	ANPEP	57	35
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	TACR1	15	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CTSD	36	41
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	MC4R	67	39
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	FCER2	74	34
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	TACR2	40	39
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	METAP1	16	50
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CTSB	39	45
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	TRY2_BOVIN	58	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	PAPA1_CARPA	45	36
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CYSP_TRYCR	65	48
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CTSL	43	38
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CACNA1B	35	42
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	TIMP3	62	37
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CAPNS1	56	36
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	MMP3	22	51
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	MMP8	18	41
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	HLA-DRB1	47	32
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	REN	77	44
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CTSS	36	45
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CAPN1	72	41
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	MMP9	22	41
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CAPN2	64	41
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	CTSE	40	34
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	ACE2	102	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	PGA5	54	34
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	FPR1	72	35
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	POL	0	45
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	GAG-PRO	48	34
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	PSMB5	42	37
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	SLC15A2	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	BLA1_STEMA	51	35
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	PSMB8	65	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	Q9N6S8_PLAFA	23	45
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	BRCA1	61	34
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	PSMB9	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	GPR142	45	32
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	PSMB10	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646339	GD	On-Demand	Anodyne	DERP1	0	45
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	ACE	55	41
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	OPRM1	42	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	OPRD1	39	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	P2RY12	59	37
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	MME	100	41
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	ANPEP	57	35
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	TACR1	15	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CTSD	36	41
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	MC4R	67	39
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	FCER2	74	34
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	TACR2	40	39
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	METAP1	16	50
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CTSB	39	45
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	TRY2_BOVIN	58	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	PAPA1_CARPA	45	36
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CYSP_TRYCR	65	48
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CTSL	43	38
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CACNA1B	35	42
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	TIMP3	62	37
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CAPNS1	56	36
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	MMP3	22	51
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	MMP8	18	41
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	HLA-DRB1	47	32
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	REN	77	44
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CTSS	36	45
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CAPN1	72	41
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	MMP9	22	41
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CAPN2	64	41
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	CTSE	40	34
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	ACE2	102	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	PGA5	54	34
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	FPR1	72	35
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	POL	0	45
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	GAG-PRO	48	34
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	PSMB5	42	37
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	SLC15A2	0	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	BLA1_STEMA	51	35
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	PSMB8	65	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	Q9N6S8_PLAFA	23	45
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	BRCA1	61	34
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	PSMB9	0	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	GPR142	45	32
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	PSMB10	0	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646340	GD	On-Demand	Anodyne	DERP1	0	45
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	ACE	55	41
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	OPRM1	42	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	OPRD1	39	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	P2RY12	59	37
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	MME	100	41
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	ANPEP	57	35
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	TACR1	15	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CTSD	36	41
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	MC4R	67	39
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	FCER2	74	34
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	TACR2	40	39
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	METAP1	16	50
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CTSB	39	45
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	TRY2_BOVIN	58	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	PAPA1_CARPA	45	36
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CYSP_TRYCR	65	48
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CTSL	43	38
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CACNA1B	35	42
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	TIMP3	62	37
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CAPNS1	56	36
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	MMP3	22	51
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	MMP8	18	41
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	HLA-DRB1	47	32
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	REN	77	44
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CTSS	36	45
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CAPN1	72	41
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	MMP9	22	41
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CAPN2	64	41
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	CTSE	40	34
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	ACE2	102	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	PGA5	54	34
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	FPR1	72	35
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	POL	0	45
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	GAG-PRO	48	34
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	PSMB5	42	37
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	SLC15A2	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	BLA1_STEMA	51	35
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	PSMB8	65	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	Q9N6S8_PLAFA	23	45
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	BRCA1	61	34
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	PSMB9	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	GPR142	45	32
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	PSMB10	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450646341	GD	On-Demand	Anodyne	DERP1	0	45
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	ACE	46	40
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	GHRHR	43	30
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	P2RY12	42	35
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	MME	58	41
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	MC4R	77	40
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	CTRA_BOVIN	53	34
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	CTSB	24	45
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	TRY2_BOVIN	77	39
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	TRY1_BOVIN	48	37
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	CYSP_TRYCR	30	45
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	CTSG	43	34
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	NPFFR2	40	32
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	CYP51A1	22	43
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	TIMP3	44	32
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	ITGA4	67	37
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	MC3R	41	35
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	MC5R	63	35
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	CELA2A	51	34
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	REN	46	39
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	F11	47	38
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	CAPN1	53	46
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	ACE2	67	39
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	PGA5	47	34
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	POL	0	42
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	PSMB8	40	35
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	BRCA1	52	32
C[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646342	FF	On-Demand	Anodyne	DERP1	0	45
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	ACE	46	40
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	GHRHR	43	30
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	P2RY12	42	35
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	MME	58	41
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	MC4R	77	40
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	CTRA_BOVIN	53	34
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	CTSB	24	45
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	TRY2_BOVIN	77	39
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	TRY1_BOVIN	48	37
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	CYSP_TRYCR	30	45
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	CTSG	43	34
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	NPFFR2	40	32
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	CYP51A1	22	43
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	TIMP3	44	32
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	ITGA4	67	37
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	MC3R	41	35
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	MC5R	63	35
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	CELA2A	51	34
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	REN	46	39
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	F11	47	38
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	CAPN1	53	46
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	ACE2	67	39
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	PGA5	47	34
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	POL	0	42
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	PSMB8	40	35
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	BRCA1	52	32
C[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)C[C@H]1C	ZINC000450646343	FF	On-Demand	Anodyne	DERP1	0	45
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	ACE	46	40
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	GHRHR	43	30
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	P2RY12	42	35
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	MME	58	41
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	MC4R	77	40
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	CTRA_BOVIN	53	34
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	CTSB	24	45
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	TRY2_BOVIN	77	39
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	TRY1_BOVIN	48	37
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	CYSP_TRYCR	30	45
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	CTSG	43	34
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	NPFFR2	40	32
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	CYP51A1	22	43
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	TIMP3	44	32
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	ITGA4	67	37
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	MC3R	41	35
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	MC5R	63	35
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	CELA2A	51	34
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	REN	46	39
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	F11	47	38
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	CAPN1	53	46
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	ACE2	67	39
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	PGA5	47	34
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	POL	0	42
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	PSMB8	40	35
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	BRCA1	52	32
C[C@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646344	FF	On-Demand	Anodyne	DERP1	0	45
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	ACE	46	40
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	GHRHR	43	30
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	P2RY12	42	35
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	MME	58	41
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	MC4R	77	40
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	CTRA_BOVIN	53	34
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	CTSB	24	45
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	TRY2_BOVIN	77	39
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	TRY1_BOVIN	48	37
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	CYSP_TRYCR	30	45
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	CTSG	43	34
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	NPFFR2	40	32
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	CYP51A1	22	43
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	TIMP3	44	32
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	ITGA4	67	37
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	MC3R	41	35
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	MC5R	63	35
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	CELA2A	51	34
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	REN	46	39
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	F11	47	38
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	CAPN1	53	46
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	ACE2	67	39
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	PGA5	47	34
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	POL	0	42
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	PSMB8	40	35
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	BRCA1	52	32
C[C@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCOCC2)CC[C@H]1C	ZINC000450646345	FF	On-Demand	Anodyne	DERP1	0	45
COc1ccc([C@@H](CO)N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cc1	ZINC000450646364	GI	On-Demand	Anodyne	CACNA1S	41	37
COc1ccc([C@@H](CO)N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cc1	ZINC000450646364	GI	On-Demand	Anodyne	GPR88	0	42
COc1ccc([C@H](CO)N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cc1	ZINC000450646365	GI	On-Demand	Anodyne	CACNA1S	41	37
COc1ccc([C@H](CO)N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cc1	ZINC000450646365	GI	On-Demand	Anodyne	GPR88	0	42
Clc1ccc(N2CCCN(Cc3cnns3)CC2)cc1Cl	ZINC000450646366	EH	On-Demand	Anodyne	DRD1	0	57
Clc1ccc(N2CCCN(Cc3cnns3)CC2)cc1Cl	ZINC000450646366	EH	On-Demand	Anodyne	DRD4	22	57
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccccc1CN1CCNC1=O	ZINC000450646371	GH	On-Demand	Anodyne	NR1H4	22	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccccc1CN1CCNC1=O	ZINC000450646371	GH	On-Demand	Anodyne	MTTP	46	37
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	CHRM2	16	40
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	DRD2	16	49
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	DRD4	40	45
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	ACHE	24	45
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	CHRM3	22	44
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	VACHT_TETCF	0	41
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	CCR3	42	40
CC(=O)c1cccc(CN2CC[C@@H](C)[C@H](C)C2)c1	ZINC000450646373	BG	On-Demand	Anodyne	MCHR1	27	43
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	CHRM2	16	40
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	DRD2	16	49
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	DRD4	40	45
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	ACHE	24	45
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	CHRM3	22	44
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	VACHT_TETCF	0	41
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	CCR3	42	40
CC(=O)c1cccc(CN2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000450646374	BG	On-Demand	Anodyne	MCHR1	27	43
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	CHRM2	16	40
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	DRD2	16	49
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	DRD4	40	45
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	ACHE	24	45
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	CHRM3	22	44
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	VACHT_TETCF	0	41
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	CCR3	42	40
CC(=O)c1cccc(CN2CC[C@H](C)[C@H](C)C2)c1	ZINC000450646375	BG	On-Demand	Anodyne	MCHR1	27	43
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	CHRM2	16	40
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	DRD2	16	49
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	DRD4	40	45
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	ACHE	24	45
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	CHRM3	22	44
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	VACHT_TETCF	0	41
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	CCR3	42	40
CC(=O)c1cccc(CN2CC[C@H](C)[C@@H](C)C2)c1	ZINC000450646376	BG	On-Demand	Anodyne	MCHR1	27	43
Cc1cccc(F)c1NC(=O)[C@H](O)C1CCC1	ZINC000450646378	BE	On-Demand	Anodyne	PYGL	29	44
Cc1cccc(F)c1NC(=O)[C@@H](O)C1CCC1	ZINC000450646379	BE	On-Demand	Anodyne	PYGL	29	44
O=C(CCCN1CCO[C@H](c2ccc(OC(F)F)cc2)C1)c1ccccc1	ZINC000450646384	GI	On-Demand	Anodyne	HTR2A	15	40
O=C(CCCN1CCO[C@H](c2ccc(OC(F)F)cc2)C1)c1ccccc1	ZINC000450646384	GI	On-Demand	Anodyne	CYP2J2	53	38
O=C(CCCN1CCO[C@@H](c2ccc(OC(F)F)cc2)C1)c1ccccc1	ZINC000450646385	GI	On-Demand	Anodyne	HTR2A	15	40
O=C(CCCN1CCO[C@@H](c2ccc(OC(F)F)cc2)C1)c1ccccc1	ZINC000450646385	GI	On-Demand	Anodyne	CYP2J2	53	38
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)[C@@H](C)O)CC1	ZINC000450646394	DC	On-Demand	Anodyne	MME	32	42
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)[C@@H](C)O)CC1	ZINC000450646394	DC	On-Demand	Anodyne	ABCB1	49	36
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)[C@H](C)O)CC1	ZINC000450646395	DC	On-Demand	Anodyne	MME	32	42
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)[C@H](C)O)CC1	ZINC000450646395	DC	On-Demand	Anodyne	ABCB1	49	36
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)[C@H](C)O)CC1	ZINC000450646396	DC	On-Demand	Anodyne	MME	32	42
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)[C@H](C)O)CC1	ZINC000450646396	DC	On-Demand	Anodyne	ABCB1	49	36
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)[C@@H](C)O)CC1	ZINC000450646397	DC	On-Demand	Anodyne	MME	32	42
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)[C@@H](C)O)CC1	ZINC000450646397	DC	On-Demand	Anodyne	ABCB1	49	36
Cc1cc(F)c(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1F	ZINC000450646401	FG	On-Demand	Anodyne	SMO	43	35
Cc1cc(F)c(CC(=O)N2CCC(c3noc(C4CC4)n3)CC2)cc1F	ZINC000450646401	FG	On-Demand	Anodyne	ETHR	74	52
FC1(F)CC(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000450646406	FI	On-Demand	Anodyne	OPRK1	0	40
FC1(F)CC(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000450646406	FI	On-Demand	Anodyne	SIGMAR1	29	66
COC(=O)c1coc(CN2CCCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000450646413	GG	On-Demand	Anodyne	DRD3	15	43
CCOC(=O)c1sc(Sc2nc(C)nc(C)c2C)nc1C	ZINC000450646418	DG	On-Demand	Anodyne	DHODH	22	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450646421	FG	On-Demand	Anodyne	SMO	45	37
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450646421	FG	On-Demand	Anodyne	ETHR	70	50
Nc1ncccc1CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450646424	FH	On-Demand	Anodyne	DRD1	0	49
Nc1ncccc1CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450646424	FH	On-Demand	Anodyne	DRD4	36	44
Nc1ncccc1CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450646424	FH	On-Demand	Anodyne	DRD3	20	52
CCOC(=O)c1ccc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)nc1	ZINC000450646439	GE	On-Demand	Anodyne	NOD2	25	41
CS(=O)(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1C(F)F	ZINC000450646444	GG	On-Demand	Anodyne	MAPK1	30	42
CS(=O)(=O)c1ccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1C(F)F	ZINC000450646444	GG	On-Demand	Anodyne	EPHX2	26	44
CS(=O)(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1C(F)F	ZINC000450646445	GG	On-Demand	Anodyne	MAPK1	30	42
CS(=O)(=O)c1ccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1C(F)F	ZINC000450646445	GG	On-Demand	Anodyne	EPHX2	26	44
CC[S@](=O)CC(=O)Nc1n[nH]c(-c2cc(Cl)ccc2Cl)n1	ZINC000450646468	EE	On-Demand	Anodyne	ALPL	41	34
CC[S@@](=O)CC(=O)Nc1n[nH]c(-c2cc(Cl)ccc2Cl)n1	ZINC000450646471	EE	On-Demand	Anodyne	ALPL	41	34
Cc1ccc(NC(=O)CCc2ccc(C(N)=O)cc2)cc1NC(=O)CCN(C)C	ZINC000450646486	GF	On-Demand	Anodyne	LDLR	0	44
NC(=O)N[C@@H]1CCN(CCC2=CCCCC2)C1	ZINC000450646489	BD	On-Demand	Anodyne	BIRC2	56	33
NC(=O)N[C@H]1CCN(CCC2=CCCCC2)C1	ZINC000450646493	BD	On-Demand	Anodyne	BIRC2	56	33
C[C@@H](CC(F)(F)F)NC(=O)c1cccc2c1CCCC2	ZINC000450646507	CH	On-Demand	Anodyne	PTGER4	16	40
C[C@H](CC(F)(F)F)NC(=O)c1cccc2c1CCCC2	ZINC000450646509	CH	On-Demand	Anodyne	PTGER4	16	40
Cc1ccc(NC(=O)c2cc(C)c(C(N)=O)cn2)cc1NC(=O)CCN(C)C	ZINC000450646510	GD	On-Demand	Anodyne	BTK	22	42
CCC(=O)C1(C(=O)NCCc2c(C)oc3ccccc23)CC1	ZINC000450646522	CG	On-Demand	Anodyne	MTNR1A	20	43
CCC(=O)C1(C(=O)NCCc2c(C)oc3ccccc23)CC1	ZINC000450646522	CG	On-Demand	Anodyne	MTNR1B	19	43
Cc1cncc(-c2nc(CN3CCN(CC(F)(F)F)[C@H](C)C3)no2)c1	ZINC000450646533	FF	On-Demand	Anodyne	ACOX1	28	45
Cc1cncc(-c2nc(CN3CCN(CC(F)(F)F)[C@@H](C)C3)no2)c1	ZINC000450646534	FF	On-Demand	Anodyne	ACOX1	28	45
C[C@H](O)[C@H]1CCCCN1C(=O)CCc1ccc2c(c1)OCCO2	ZINC000450646540	DE	On-Demand	Anodyne	OPRK1	19	47
C[C@H](O)[C@H]1CCCCN1C(=O)CCc1ccc2c(c1)OCCO2	ZINC000450646540	DE	On-Demand	Anodyne	SSTR3	108	38
C[C@@H](O)[C@@H]1CCCCN1C(=O)CCc1ccc2c(c1)OCCO2	ZINC000450646541	DE	On-Demand	Anodyne	OPRK1	19	47
C[C@@H](O)[C@@H]1CCCCN1C(=O)CCc1ccc2c(c1)OCCO2	ZINC000450646541	DE	On-Demand	Anodyne	SSTR3	108	38
C[C@@H](O)[C@H]1CCCCN1C(=O)CCc1ccc2c(c1)OCCO2	ZINC000450646542	DE	On-Demand	Anodyne	OPRK1	19	47
C[C@@H](O)[C@H]1CCCCN1C(=O)CCc1ccc2c(c1)OCCO2	ZINC000450646542	DE	On-Demand	Anodyne	SSTR3	108	38
C[C@H](O)[C@@H]1CCCCN1C(=O)CCc1ccc2c(c1)OCCO2	ZINC000450646543	DE	On-Demand	Anodyne	OPRK1	19	47
C[C@H](O)[C@@H]1CCCCN1C(=O)CCc1ccc2c(c1)OCCO2	ZINC000450646543	DE	On-Demand	Anodyne	SSTR3	108	38
CC1(C)CN(c2ncc(F)cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450646544	FH	On-Demand	Anodyne	DRD2	0	42
CC1(C)CN(c2ncc(F)cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450646544	FH	On-Demand	Anodyne	SIGMAR1	59	42
CC1(C)CN(c2ncc(F)cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450646548	FH	On-Demand	Anodyne	DRD2	0	42
CC1(C)CN(c2ncc(F)cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450646548	FH	On-Demand	Anodyne	SIGMAR1	59	42
COc1cc(CN2CCO[C@H](c3cccc(C#N)c3)C2)ccc1Cl	ZINC000450646559	EH	On-Demand	Mild	DRD4	22	52
COc1cc(CN2CCO[C@@H](c3cccc(C#N)c3)C2)ccc1Cl	ZINC000450646562	EH	On-Demand	Mild	DRD4	22	52
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450646566	EF	On-Demand	Anodyne	HDAC1	28	42
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450646566	EF	On-Demand	Anodyne	SMO	0	40
C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450646568	EF	On-Demand	Anodyne	HDAC1	28	42
C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450646568	EF	On-Demand	Anodyne	SMO	0	40
CC[S@](=O)CC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450646576	CE	On-Demand	Anodyne	ENPP1	72	42
CC[S@@](=O)CC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450646577	CE	On-Demand	Anodyne	ENPP1	72	42
C[C@H](CCCCO)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450646578	CC	On-Demand	Anodyne	CA2	31	41
C[C@@H](CCCCO)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450646579	CC	On-Demand	Anodyne	CA2	31	41
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(Cl)c1	ZINC000450646588	CE	On-Demand	Anodyne	ADRB3	26	44
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(Cl)c1	ZINC000450646589	CE	On-Demand	Anodyne	ADRB3	26	44
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(Cl)c1	ZINC000450646590	CE	On-Demand	Anodyne	ADRB3	26	44
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(Cl)c1	ZINC000450646591	CE	On-Demand	Anodyne	ADRB3	26	44
Cc1oc2ccccc2c1CCNC(=O)C(C)(C)OC(C)C	ZINC000450646601	DH	On-Demand	Anodyne	THRB	0	41
CCOc1ccc(CN(CCCn2ccnc2)C[C@H]2COCCO2)cc1	ZINC000450646605	FF	On-Demand	Anodyne	QPCT	15	42
CCOc1ccc(CN(CCCn2ccnc2)C[C@@H]2COCCO2)cc1	ZINC000450646607	FF	On-Demand	Anodyne	QPCT	15	42
CN(CCN1CCOCC12CCCC2)Cc1ccccc1	ZINC000450646616	CF	On-Demand	Anodyne	SIGMAR1	17	42
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	F2	40	36
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	FKBP1A	45	51
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	CELA1	42	38
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	ELANE	79	42
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	CTRA_BOVIN	25	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	MMP13	52	44
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	TRY1_BOVIN	53	33
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	ADAM17	44	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	ITGA4	57	55
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	CAPNS1	27	55
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	MMP2	26	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	MMP3	59	44
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	MMP8	32	43
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	CAPN1	25	60
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	MMP9	31	43
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	MMP7	64	44
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	MMP1	59	47
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	XIAP	66	39
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	SFRP1	133	39
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	WNT3	94	39
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646623	FE	On-Demand	Anodyne	BRCA1	58	31
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	F2	40	36
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	FKBP1A	45	51
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	CELA1	42	38
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	ELANE	79	42
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	CTRA_BOVIN	25	40
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	MMP13	52	44
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	TRY1_BOVIN	53	33
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	ADAM17	44	40
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	ITGA4	57	55
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	CAPNS1	27	55
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	MMP2	26	40
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	MMP3	59	44
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	MMP8	32	43
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	CAPN1	25	60
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	MMP9	31	43
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	MMP7	64	44
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	MMP1	59	47
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	XIAP	66	39
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	SFRP1	133	39
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	WNT3	94	39
C[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450646625	FE	On-Demand	Anodyne	BRCA1	58	31
O=c1cc(N[C@H]2CC[C@@H](CO)C2)nc2ccccn12	ZINC000450646631	CD	On-Demand	Anodyne	IRAK4	17	41
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1C	ZINC000450646635	DG	On-Demand	Anodyne	HTR3A	17	41
C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1C)C(=O)C1CCCCC1	ZINC000450646636	EI	On-Demand	Anodyne	DGAT1	19	43
C[C@H](Sc1nnc(-c2ccc(F)cc2)n1C)C(=O)C1CCCCC1	ZINC000450646637	EI	On-Demand	Anodyne	DGAT1	19	43
COc1cc(NC(=O)c2ccnn2CC(F)(F)F)ccc1OC(C)C	ZINC000450646638	FG	On-Demand	Anodyne	FLT1	23	44
COc1cc(NC(=O)c2ccnn2CC(F)(F)F)ccc1OC(C)C	ZINC000450646638	FG	On-Demand	Anodyne	MET	42	36
COc1cc(NC(=O)c2ccnn2CC(F)(F)F)ccc1OC(C)C	ZINC000450646638	FG	On-Demand	Anodyne	ENPP1	62	38
CCS(=O)(=O)c1ccc(CN2CCC3(CCCN3C)CC2)cc1	ZINC000450646654	EF	On-Demand	Anodyne	ADAM17	22	40
FC(F)(F)c1ccc(O[C@H]2CCN(Cc3cn(CC4CC4)nn3)C2)nc1	ZINC000450646656	FF	On-Demand	Anodyne	LIPG	20	44
FC(F)(F)c1ccc(O[C@@H]2CCN(Cc3cn(CC4CC4)nn3)C2)nc1	ZINC000450646657	FF	On-Demand	Anodyne	LIPG	20	44
Cc1nn(C)cc1CSc1nnc(C)n1-c1ccccc1	ZINC000450646660	CF	On-Demand	Anodyne	AXIN2	0	41
Cc1cc(C2CCN(Cc3ccccc3OC3CC3)CC2)n[nH]1	ZINC000450646661	DH	On-Demand	Anodyne	DRD4	19	47
COc1ccc(CNC(=O)CCN2CCC=C(F)C2)c(OC)c1	ZINC000450646674	DE	On-Demand	Anodyne	HTR7	26	40
COc1ccc(CNC(=O)CCN2CCC=C(F)C2)c(OC)c1	ZINC000450646674	DE	On-Demand	Anodyne	MTNR1A	47	38
c1cncc(CN(Cc2ccco2)C[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450646688	CG	On-Demand	Anodyne	NR1D1	40	33
c1cncc(CN(Cc2ccco2)C[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450646689	CG	On-Demand	Anodyne	NR1D1	40	33
Cc1nc(C)n(CCCC(=O)NCc2ccc(OCc3ccccc3F)cc2)n1	ZINC000450646694	GH	On-Demand	Anodyne	ADAM17	64	39
Cc1nc(C)n(CCCC(=O)NCc2ccc(OCc3ccccc3F)cc2)n1	ZINC000450646694	GH	On-Demand	Anodyne	GYS1	42	34
Cc1nc(C)n(CCCC(=O)NCc2ccc(OCc3ccccc3F)cc2)n1	ZINC000450646694	GH	On-Demand	Anodyne	MT-CYB	47	32
Cc1cc(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n[nH]1	ZINC000450646719	EH	On-Demand	Anodyne	DRD2	0	52
Cc1cc(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n[nH]1	ZINC000450646719	EH	On-Demand	Anodyne	DRD4	28	52
Cc1cc(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n[nH]1	ZINC000450646719	EH	On-Demand	Anodyne	DRD3	0	52
CCc1cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)ccn1	ZINC000450646720	ED	On-Demand	Anodyne	CA2	28	40
CCc1cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)ccn1	ZINC000450646720	ED	On-Demand	Anodyne	DKK1	0	40
COc1cc(-c2noc(CSc3nnc4nc(C)cc(C)n34)n2)ncn1	ZINC000450646727	FD	On-Demand	Anodyne	AXIN2	0	42
CC(C)(CC(=O)CSc1nnc(-c2ccncc2)o1)C1CC1	ZINC000450646729	DH	On-Demand	Anodyne	GSK3A	20	42
COC(=O)c1csc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450646754	FF	On-Demand	Anodyne	PDGFRB	47	38
COC(=O)c1csc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450646754	FF	On-Demand	Anodyne	FAAH	0	43
COC(=O)c1csc(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)n1	ZINC000450646754	FF	On-Demand	Anodyne	TRPC6	41	38
CCN(c1cc(C)nc2ncnn12)C1COC1	ZINC000450646770	BC	On-Demand	Anodyne	DHOD	0	44
c1cncc(CC2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450646778	CF	On-Demand	Anodyne	CHRNA7	42	34
c1cncc(CC2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450646780	CF	On-Demand	Anodyne	CHRNA7	42	34
COc1ccc(CNC(=O)CCSc2nnc3n2CCCCC3)c(OC)c1	ZINC000450646784	GF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN(C)CCc2cnccn2)c(OC)c1	ZINC000450646789	FD	On-Demand	Anodyne	MTNR1A	42	40
CCC(=O)CCCN1CC=C(c2cccc(C)c2)CC1	ZINC000450646790	CH	On-Demand	Anodyne	DRD2	15	45
CN(CCN(C)c1ncc(C(N)=O)cc1Cl)c1ccc(S(N)(=O)=O)cc1	ZINC000450646794	GD	On-Demand	Anodyne	CA2	41	41
CN(CCN(C)c1ncc(C(N)=O)cc1Cl)c1ccc(S(N)(=O)=O)cc1	ZINC000450646794	GD	On-Demand	Anodyne	TRPM8	41	39
CCCOc1cccc(CSc2nnc3n2CCCCC3)c1	ZINC000450646798	DI	On-Demand	Anodyne	HRH2	29	42
COC(=O)c1ccc2c(c1)CN(CC1(C(=O)OC)CC1)CC2	ZINC000450646799	DD	On-Demand	Anodyne	NOD2	43	37
CCN(c1cc(C(F)(F)F)nc2ncnn12)C1COC1	ZINC000450646808	CD	On-Demand	Anodyne	DHOD	0	43
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646809	GF	On-Demand	Anodyne	EPHX2	26	48
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646809	GF	On-Demand	Anodyne	RBP4	20	41
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646809	GF	On-Demand	Anodyne	L3MBTL3	45	39
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646809	GF	On-Demand	Anodyne	KCNK3	71	40
CO[C@@H](Cc1ccccc1)CN(C(C)C)C(C)C	ZINC000450646817	BG	On-Demand	Anodyne	CAPNS1	45	32
CO[C@H](Cc1ccccc1)CN(C(C)C)C(C)C	ZINC000450646818	BG	On-Demand	Anodyne	CAPNS1	45	32
O[C@H](Cc1ccccc1)CN1CC=C(c2ccc3c(c2)OCCO3)CC1	ZINC000450646819	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
COC(=O)C1(CN2CC=C(c3cccc(C)c3)CC2)CC1	ZINC000450646820	CG	On-Demand	Anodyne	ADAM10	26	42
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1cccc(C(F)(F)F)n1	ZINC000450646822	GF	On-Demand	Anodyne	NPY2R	25	41
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1cccc(C(F)(F)F)n1	ZINC000450646822	GF	On-Demand	Anodyne	EPHX2	28	45
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1cccc(C(F)(F)F)n1	ZINC000450646822	GF	On-Demand	Anodyne	RBP4	20	42
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1cccc(C(F)(F)F)n1	ZINC000450646822	GF	On-Demand	Anodyne	SFRP1	41	39
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1cccc(C(F)(F)F)n1	ZINC000450646822	GF	On-Demand	Anodyne	KCNK3	67	39
CCS(=O)(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)cc1	ZINC000450646849	FG	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](c1ccccc1)[C@H](O)CNC(C)(C)C(=O)NCC1CCCC1	ZINC000450646851	EF	On-Demand	Anodyne	NMBR	15	40
C[C@H](c1ccccc1)[C@H](O)CNC(C)(C)C(=O)NCC1CCCC1	ZINC000450646851	EF	On-Demand	Anodyne	AMY2	46	32
C[C@@H](c1ccccc1)[C@H](O)CNC(C)(C)C(=O)NCC1CCCC1	ZINC000450646852	EF	On-Demand	Anodyne	NMBR	15	40
C[C@@H](c1ccccc1)[C@H](O)CNC(C)(C)C(=O)NCC1CCCC1	ZINC000450646852	EF	On-Demand	Anodyne	AMY2	46	32
C[C@H](c1ccccc1)[C@@H](O)CNC(C)(C)C(=O)NCC1CCCC1	ZINC000450646853	EF	On-Demand	Anodyne	NMBR	15	40
C[C@H](c1ccccc1)[C@@H](O)CNC(C)(C)C(=O)NCC1CCCC1	ZINC000450646853	EF	On-Demand	Anodyne	AMY2	46	32
C[C@@H](c1ccccc1)[C@@H](O)CNC(C)(C)C(=O)NCC1CCCC1	ZINC000450646854	EF	On-Demand	Anodyne	NMBR	15	40
C[C@@H](c1ccccc1)[C@@H](O)CNC(C)(C)C(=O)NCC1CCCC1	ZINC000450646854	EF	On-Demand	Anodyne	AMY2	46	32
OC[C@]1(F)CN(c2ncnc3sc4c(c23)CCC4)C[C@@H]1c1ccccc1	ZINC000450646885	FG	On-Demand	Anodyne	RBP4	20	48
OC[C@]1(F)CN(c2ncnc3sc4c(c23)CCC4)C[C@H]1c1ccccc1	ZINC000450646886	FG	On-Demand	Anodyne	RBP4	20	48
OC[C@@]1(F)CN(c2ncnc3sc4c(c23)CCC4)C[C@@H]1c1ccccc1	ZINC000450646887	FG	On-Demand	Anodyne	RBP4	20	48
OC[C@@]1(F)CN(c2ncnc3sc4c(c23)CCC4)C[C@H]1c1ccccc1	ZINC000450646888	FG	On-Demand	Anodyne	RBP4	20	48
COC(=O)[C@H](CC(C)C)N(C)c1cnc2ccccc2n1	ZINC000450646893	CF	On-Demand	Anodyne	CCR1	37	41
COC(=O)[C@@H](CC(C)C)N(C)c1cnc2ccccc2n1	ZINC000450646894	CF	On-Demand	Anodyne	CCR1	37	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@]1(OC(C)C)CCOC1	ZINC000450646900	EF	On-Demand	Anodyne	MTR1B_CHICK	0	50
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@]1(OC(C)C)CCOC1	ZINC000450646900	EF	On-Demand	Anodyne	CCL2	0	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000450646901	EF	On-Demand	Anodyne	MTR1B_CHICK	0	50
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000450646901	EF	On-Demand	Anodyne	CCL2	0	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000450646902	EF	On-Demand	Anodyne	MTR1B_CHICK	0	50
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000450646902	EF	On-Demand	Anodyne	CCL2	0	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(OC(C)C)CCOC1	ZINC000450646903	EF	On-Demand	Anodyne	MTR1B_CHICK	0	50
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(OC(C)C)CCOC1	ZINC000450646903	EF	On-Demand	Anodyne	CCL2	0	40
O=C(CCCN1CCOC2(CCC2)C1)c1ccc(F)cc1	ZINC000450646938	CG	On-Demand	Anodyne	DRD2	33	51
O=C(CCCN1CCOC2(CCC2)C1)c1ccc(F)cc1	ZINC000450646938	CG	On-Demand	Anodyne	ERG2	24	51
O=C(CCCN1CCOC2(CCC2)C1)c1ccc(F)cc1	ZINC000450646938	CG	On-Demand	Anodyne	EBP	22	51
O=C(CCCN1CCOC2(CCC2)C1)c1ccc(F)cc1	ZINC000450646938	CG	On-Demand	Anodyne	CYP2J2	51	36
COc1cccc(OCCC(=O)N2CCC(F)(F)C2)c1	ZINC000450646954	CE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CCC(F)(F)C2)c1	ZINC000450646954	CE	On-Demand	Anodyne	MTNR1A	26	44
COc1cccc(OCCC(=O)N2CCC(F)(F)C2)c1	ZINC000450646954	CE	On-Demand	Anodyne	MTNR1B	34	40
CC(C)OC(C)(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450646955	DH	On-Demand	Anodyne	MMP13	17	40
CC(C)OC(C)(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450646955	DH	On-Demand	Anodyne	CYP11B2	37	40
CC(C)OC(C)(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450646955	DH	On-Demand	Anodyne	HAO2	17	44
CCOC(=O)c1sc(Sc2nc(C)cc(OC)n2)nc1C	ZINC000450646961	EF	On-Demand	Anodyne	DHODH	22	42
CCOC(=O)c1sc(Sc2nc(C)cc(OC)n2)nc1C	ZINC000450646961	EF	On-Demand	Anodyne	ALS	44	36
Cc1cccc(F)c1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450646963	CH	On-Demand	Anodyne	SLC6A1	65	39
Cc1cccc(F)c1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450646963	CH	On-Demand	Anodyne	EPHX2	23	43
Cc1cccc(F)c1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450646964	CH	On-Demand	Anodyne	SLC6A1	62	39
COC(=O)c1cc(-c2ccccc2CNC(=O)C2CCN(C(C)C)CC2)[nH]n1	ZINC000450646965	GF	On-Demand	Anodyne	EPHX2	17	40
CCOC(=O)c1sc(Sc2nccc(C)c2[N+](=O)[O-])nc1C	ZINC000450646966	EG	On-Demand	Bother	DHODH	18	41
Clc1ccc(N2CCCN(Cc3cn(CC4CC4)nn3)CC2)cc1Cl	ZINC000450646972	GH	On-Demand	Anodyne	DRD1	0	47
Clc1ccc(N2CCCN(Cc3cn(CC4CC4)nn3)CC2)cc1Cl	ZINC000450646972	GH	On-Demand	Anodyne	DRD4	21	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	MC4R	56	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	TACR2	26	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	CYSP_TRYCR	26	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	CCKAR	38	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	CYP51A1	26	51
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	PYGL	18	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	CTSS	21	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	ACE2	45	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	PGA5	44	32
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646980	GE	On-Demand	Anodyne	BLA1_STEMA	45	36
COc1ccc(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c(Cl)c1OC	ZINC000450646981	GG	On-Demand	Anodyne	FDFT1	31	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	MC4R	56	38
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	TACR2	26	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	CYSP_TRYCR	26	45
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	CCKAR	38	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	CYP51A1	26	51
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	PYGL	18	47
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	CTSS	21	43
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	ACE2	45	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	PGA5	44	32
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450646983	GE	On-Demand	Anodyne	BLA1_STEMA	45	36
COc1ccc(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c(Cl)c1OC	ZINC000450646990	GG	On-Demand	Anodyne	FDFT1	31	42
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450646994	DG	On-Demand	Anodyne	RHODESAIN	0	43
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450646996	DG	On-Demand	Anodyne	RHODESAIN	0	43
COC(=O)c1ccc(CN(C)CC2CCN(c3ccncc3)CC2)cc1Cl	ZINC000450646997	GH	On-Demand	Anodyne	F10	20	45
COC(=O)C1(CN(C)CC2CCN(c3ccncc3)CC2)CC1	ZINC000450647009	DE	On-Demand	Anodyne	F10	17	40
Cc1ccc(NC(=O)CCc2nc3cnccc3[nH]2)cc1NC(=O)CCN(C)C	ZINC000450647021	GF	On-Demand	Anodyne	ENPP1	22	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1cn(C)nc1C	ZINC000450647024	EF	On-Demand	Anodyne	MTR1B_CHICK	0	55
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1cn(C)nc1C	ZINC000450647026	EF	On-Demand	Anodyne	MTR1B_CHICK	0	55
Cc1ccc(NC(=O)[C@@H]2C[C@H]2CC(C)C)cc1NC(=O)CCN(C)C	ZINC000450647036	EH	On-Demand	Anodyne	LDLR	0	41
CCC[C@@H](OC)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450647041	DE	On-Demand	Anodyne	SMO	47	36
CCC[C@@H](OC)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450647041	DE	On-Demand	Anodyne	ETHR	64	47
CCC[C@H](OC)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450647042	DE	On-Demand	Anodyne	SMO	47	36
CCC[C@H](OC)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450647042	DE	On-Demand	Anodyne	ETHR	64	47
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450647045	FI	On-Demand	Anodyne	PRCP	19	43
C[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450647046	FI	On-Demand	Anodyne	PRCP	19	43
CCC[C@@H](O)CN(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450647056	DF	On-Demand	Anodyne	GRIN1	28	48
COC(=O)[C@H](NC(=O)CCCC(C)C)[C@H](C)O	ZINC000450647066	BC	On-Demand	Anodyne	NMT1	16	40
COC(=O)[C@H](NC(=O)CCCC(C)C)[C@H](C)O	ZINC000450647066	BC	On-Demand	Anodyne	NOD1	61	35
COC(=O)[C@@H](NC(=O)CCCC(C)C)[C@@H](C)O	ZINC000450647067	BC	On-Demand	Anodyne	NMT1	16	40
COC(=O)[C@@H](NC(=O)CCCC(C)C)[C@@H](C)O	ZINC000450647067	BC	On-Demand	Anodyne	NOD1	61	35
COC(=O)[C@H](NC(=O)CCCC(C)C)[C@@H](C)O	ZINC000450647068	BC	On-Demand	Anodyne	NMT1	16	40
COC(=O)[C@H](NC(=O)CCCC(C)C)[C@@H](C)O	ZINC000450647068	BC	On-Demand	Anodyne	NOD1	61	35
COC(=O)[C@@H](NC(=O)CCCC(C)C)[C@H](C)O	ZINC000450647069	BC	On-Demand	Anodyne	NMT1	16	40
COC(=O)[C@@H](NC(=O)CCCC(C)C)[C@H](C)O	ZINC000450647069	BC	On-Demand	Anodyne	NOD1	61	35
CCOC(=O)c1sc(Sc2ccc(C(C)=O)cc2[N+](=O)[O-])nc1C	ZINC000450647070	FH	On-Demand	Bother	GSTM2	56	44
CCOC(=O)c1sc(Sc2ccc(C(C)=O)cc2[N+](=O)[O-])nc1C	ZINC000450647070	FH	On-Demand	Bother	GSTP1	24	41
CCC[C@H](O)CN(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450647072	DF	On-Demand	Anodyne	GRIN1	28	48
OC[C@@H]1CSCCN1CCc1ccc(Cl)cc1	ZINC000450647074	CE	On-Demand	Anodyne	SPHK2	68	44
OC[C@@H]1CSCCN1CCc1ccc(Cl)cc1	ZINC000450647074	CE	On-Demand	Anodyne	SPHK1	45	38
OC[C@H]1CSCCN1CCc1ccc(Cl)cc1	ZINC000450647075	CE	On-Demand	Anodyne	SPHK2	68	44
OC[C@H]1CSCCN1CCc1ccc(Cl)cc1	ZINC000450647075	CE	On-Demand	Anodyne	SPHK1	45	38
COC(=O)c1cc(-c2ccccc2CNC(=O)c2nn(C)c3c2CCCC3)[nH]n1	ZINC000450647101	GE	On-Demand	Anodyne	MT-CYB	49	34
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450647102	FE	On-Demand	Anodyne	P2RY12	112	37
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450647102	FE	On-Demand	Anodyne	CTSV	53	36
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450647104	FE	On-Demand	Anodyne	P2RY12	112	37
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450647104	FE	On-Demand	Anodyne	CTSV	53	36
CC1(O)CC(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)C1	ZINC000450647112	GH	On-Demand	Anodyne	PRNP	16	40
CC1(O)CC(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)C1	ZINC000450647112	GH	On-Demand	Anodyne	GRM4	25	41
CC1(O)CC(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)C1	ZINC000450647112	GH	On-Demand	Anodyne	ENV	46	36
CC1(O)CC(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)C1	ZINC000450647112	GH	On-Demand	Anodyne	TAAR1	32	40
CC1(O)CC(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)C1	ZINC000450647112	GH	On-Demand	Anodyne	KCNK3	71	44
CC1(O)CC(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)C1	ZINC000450647112	GH	On-Demand	Anodyne	KCNK9	33	44
Cc1nc(C2CC2)ccc1C(=O)N(C)c1ccc(F)c(Cl)c1	ZINC000450647130	DI	On-Demand	Anodyne	MLNR	26	41
O=C(CCCC(=O)N1CCC(c2noc(C3CC3)n2)CC1)C1CC1	ZINC000450647136	EF	On-Demand	Anodyne	SMO	41	36
C[C@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450647142	BD	On-Demand	Anodyne	SIGMAR1	29	44
COc1cc(CN2CCC(OCCN3C[C@H](C)O[C@H](C)C3)CC2)ccc1Cl	ZINC000450647146	GG	On-Demand	Anodyne	DRD4	20	40
COc1cc(CN2CCC(OCCN3C[C@H](C)O[C@H](C)C3)CC2)ccc1Cl	ZINC000450647146	GG	On-Demand	Anodyne	HTR4	27	45
COc1cc(CN2CCC(OCCN3C[C@H](C)O[C@H](C)C3)CC2)ccc1Cl	ZINC000450647146	GG	On-Demand	Anodyne	SSTR5	65	41
COc1cc(CN2CCC(OCCN3C[C@H](C)O[C@H](C)C3)CC2)ccc1Cl	ZINC000450647146	GG	On-Demand	Anodyne	UTS2R	26	43
C[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450647148	BD	On-Demand	Anodyne	SIGMAR1	29	44
C[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450647150	BD	On-Demand	Anodyne	SIGMAR1	29	44
C[C@H]1CN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450647151	BD	On-Demand	Anodyne	SIGMAR1	29	44
C[C@@H]1CN(Cc2ccccc2OC2CC2)C[C@H]1O	ZINC000450647153	BE	On-Demand	Anodyne	SLC5A4	52	32
COc1cc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1Cl	ZINC000450647154	GG	On-Demand	Anodyne	DRD4	20	40
COc1cc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1Cl	ZINC000450647154	GG	On-Demand	Anodyne	HTR4	27	45
COc1cc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1Cl	ZINC000450647154	GG	On-Demand	Anodyne	SSTR5	65	41
COc1cc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1Cl	ZINC000450647154	GG	On-Demand	Anodyne	UTS2R	26	43
C[C@H]1CN(Cc2ccccc2OC2CC2)C[C@@H]1O	ZINC000450647156	BE	On-Demand	Anodyne	SLC5A4	52	32
C[C@@H]1CN(Cc2ccccc2OC2CC2)C[C@@H]1O	ZINC000450647158	BE	On-Demand	Anodyne	SLC5A4	52	32
COc1cc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1Cl	ZINC000450647159	GG	On-Demand	Anodyne	DRD4	20	40
COc1cc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1Cl	ZINC000450647159	GG	On-Demand	Anodyne	HTR4	27	45
COc1cc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1Cl	ZINC000450647159	GG	On-Demand	Anodyne	SSTR5	65	41
COc1cc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1Cl	ZINC000450647159	GG	On-Demand	Anodyne	UTS2R	26	43
C[C@H]1CN(Cc2ccccc2OC2CC2)C[C@H]1O	ZINC000450647161	BE	On-Demand	Anodyne	SLC5A4	52	32
COc1ccccc1COC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450647166	FH	On-Demand	Anodyne	DRD2	26	41
COc1ccccc1COC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450647166	FH	On-Demand	Anodyne	GRIN2B	20	43
COc1ccccc1COC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450647166	FH	On-Demand	Anodyne	SIGMAR1	50	45
COc1ccccc1COC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450647166	FH	On-Demand	Anodyne	ABCB1	22	40
COc1ccccc1COC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450647166	FH	On-Demand	Anodyne	MBTPS1	41	34
Cc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1NC(=O)CCN(C)C	ZINC000450647170	GG	On-Demand	Anodyne	F2R	0	42
Cc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1NC(=O)CCN(C)C	ZINC000450647170	GG	On-Demand	Anodyne	LDLR	0	40
Cc1ccc(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1NC(=O)CCN(C)C	ZINC000450647170	GG	On-Demand	Anodyne	MTTP	56	36
Cc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1NC(=O)CCN(C)C	ZINC000450647172	GG	On-Demand	Anodyne	F2R	0	42
Cc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1NC(=O)CCN(C)C	ZINC000450647172	GG	On-Demand	Anodyne	LDLR	0	40
Cc1ccc(NC(=O)c2cccc3c2O[C@H](C)C3)cc1NC(=O)CCN(C)C	ZINC000450647172	GG	On-Demand	Anodyne	MTTP	56	36
Cc1nc2ccccc2nc1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450647210	GE	On-Demand	Anodyne	CA2	30	42
Cc1nc2ccccc2nc1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450647210	GE	On-Demand	Anodyne	CA12	21	42
C=CCn1c(COc2ccc(Cl)cc2)nnc1SCC1(OC)CCC1	ZINC000450647214	GI	On-Demand	Mild	VCP	45	38
C[C@H](CC(F)(F)F)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450647215	FF	On-Demand	Anodyne	CACNA1I	17	42
C[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450647216	FF	On-Demand	Anodyne	CACNA1I	17	42
Cc1cc(Cl)c2ncc(C#N)c(N[C@H](C)CCCCO)c2c1	ZINC000450647220	DI	On-Demand	Mild	MAP3K8	80	37
Cc1cc(Cl)c2ncc(C#N)c(N[C@@H](C)CCCCO)c2c1	ZINC000450647221	DI	On-Demand	Mild	MAP3K8	80	37
CC(C)Oc1ccc2ccccc2c1CNC(=O)CCc1nc2cnccc2[nH]1	ZINC000450647224	GI	On-Demand	Anodyne	CYSP_TRYCR	0	44
CC(C)Oc1ccc2ccccc2c1CNC(=O)CCc1nc2cnccc2[nH]1	ZINC000450647224	GI	On-Demand	Anodyne	PARP3	22	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CSC2CC2)C1	ZINC000450647225	CE	On-Demand	Anodyne	PREP	17	41
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CSC2CC2)C1	ZINC000450647226	CE	On-Demand	Anodyne	PREP	17	41
COc1cc(NC(=O)c2ccc(C#N)n2C)ccc1OC(C)C	ZINC000450647244	DF	On-Demand	Mild	ENPP1	58	34
O=C(CC1CC(F)(F)C1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450647249	FI	On-Demand	Anodyne	ADAM17	54	40
O=C(CC1CC(F)(F)C1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450647249	FI	On-Demand	Anodyne	CDC25B	22	41
O=C(CC1CC(F)(F)C1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450647249	FI	On-Demand	Anodyne	GYS1	44	33
O=C(CC[C@H]1CCC(=O)N1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450647254	FG	On-Demand	Anodyne	GYS1	53	35
O=C(CC[C@@H]1CCC(=O)N1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450647255	FG	On-Demand	Anodyne	GYS1	53	35
Cc1ccc(NC(=O)N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)cc1	ZINC000450647261	GF	On-Demand	Anodyne	HRH2	23	45
Cc1ccc(NC(=O)N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)cc1	ZINC000450647261	GF	On-Demand	Anodyne	PDGFRB	40	38
Cc1ccc(NC(=O)N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)cc1	ZINC000450647261	GF	On-Demand	Anodyne	CHRM3	15	45
Cc1ccc(NC(=O)N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)cc1	ZINC000450647261	GF	On-Demand	Anodyne	FAAH	36	63
Cc1ccc(NC(=O)N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)cc1	ZINC000450647261	GF	On-Demand	Anodyne	EPHX2	17	41
Cc1ccc(NC(=O)N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)cc1	ZINC000450647261	GF	On-Demand	Anodyne	F13A1	48	34
Cc1ccc(NC(=O)N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)cc1	ZINC000450647261	GF	On-Demand	Anodyne	MGLL	0	41
Cc1ccc(NC(=O)N2CCN(Cc3cccc(S(C)(=O)=O)c3)CC2)cc1	ZINC000450647261	GF	On-Demand	Anodyne	ABHD6	0	41
COc1cc(NC(=O)C2(C(F)(F)F)CCC2)ccc1OC(C)C	ZINC000450647262	EI	On-Demand	Anodyne	ENPP1	68	32
COc1cc(NC(=O)c2ccn(CCn3cccn3)n2)ccc1OC(C)C	ZINC000450647263	FF	On-Demand	Anodyne	GRM4	24	42
COc1cc(NC(=O)c2ccn(CCn3cccn3)n2)ccc1OC(C)C	ZINC000450647263	FF	On-Demand	Anodyne	ENPP1	56	35
COc1cc(NC(=O)c2ccn(CCn3cccn3)n2)ccc1OC(C)C	ZINC000450647263	FF	On-Demand	Anodyne	IMDH_CRYPV	34	41
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	DRD2	16	40
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	DRD4	33	40
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	ACHE	28	41
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	HRH1	15	42
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	DRD3	15	40
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	HRH3	16	41
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	SSTR5	46	34
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	AKT2	27	41
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	PLD1	56	37
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	PLD2	46	34
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	MCHR1	31	51
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	MGLL	0	43
CCc1nc2ccccc2n1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450647269	FJ	On-Demand	Anodyne	FPR2	33	48
COC1(CSc2nnc(C)n2-c2ccccc2)CCC1	ZINC000450647274	CG	On-Demand	Anodyne	AXIN2	0	41
CC(C)(C)OC1CC(Sc2nnc(C3CC3)n2-c2ccccc2)C1	ZINC000450647275	EJ	On-Demand	Anodyne	VCP	51	42
O=S(=O)(NCC1CC1)c1ccc(N[C@H]2CC[C@@H](CO)C2)nc1	ZINC000450647294	ED	On-Demand	Anodyne	NPY2R	67	38
C[C@@H]1CCN(C(=O)c2cncc(Cl)c2)CC12CCCCC2	ZINC000450647312	DI	On-Demand	Anodyne	L3MBTL1	0	40
C[C@H]1CCN(C(=O)c2cncc(Cl)c2)CC12CCCCC2	ZINC000450647315	DI	On-Demand	Anodyne	L3MBTL1	0	40
CCc1cc(=O)c2cc(NC(=O)c3ccc(C)nc3C(C)C)ccc2[nH]1	ZINC000450647342	EI	On-Demand	Anodyne	NR2E3	53	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647346	FH	On-Demand	Anodyne	CTSK	23	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647346	FH	On-Demand	Anodyne	CAPN1	44	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647346	FH	On-Demand	Anodyne	CAPN2	50	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647346	FH	On-Demand	Anodyne	FPR1	43	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647348	FH	On-Demand	Anodyne	CTSK	23	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647348	FH	On-Demand	Anodyne	CAPN1	44	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647348	FH	On-Demand	Anodyne	CAPN2	50	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647348	FH	On-Demand	Anodyne	FPR1	43	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647349	FH	On-Demand	Anodyne	CTSK	23	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647349	FH	On-Demand	Anodyne	CAPN1	44	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647349	FH	On-Demand	Anodyne	CAPN2	50	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647349	FH	On-Demand	Anodyne	FPR1	43	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647350	FH	On-Demand	Anodyne	CTSK	23	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647350	FH	On-Demand	Anodyne	CAPN1	44	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647350	FH	On-Demand	Anodyne	CAPN2	50	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647350	FH	On-Demand	Anodyne	FPR1	43	34
c1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)o2)cc1	ZINC000450647356	CG	On-Demand	Anodyne	GSK3A	36	43
c1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)o2)cc1	ZINC000450647357	CG	On-Demand	Anodyne	GSK3A	36	43
CC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647358	DI	On-Demand	Anodyne	CAPN1	29	44
CC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647358	DI	On-Demand	Anodyne	CAPN2	38	44
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647359	DI	On-Demand	Anodyne	CAPN1	29	44
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647359	DI	On-Demand	Anodyne	CAPN2	38	44
CC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647360	DI	On-Demand	Anodyne	CAPN1	29	44
CC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647360	DI	On-Demand	Anodyne	CAPN2	38	44
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647361	DI	On-Demand	Anodyne	CAPN1	29	44
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647361	DI	On-Demand	Anodyne	CAPN2	38	44
Cc1nc(N[C@H]2CC[C@@H](CO)C2)c2cc[nH]c2n1	ZINC000450647364	BD	On-Demand	Anodyne	JAK1	46	33
COc1cc(NC(=O)Cn2cc(C(C)=O)nn2)ccc1OC(C)C	ZINC000450647372	ED	On-Demand	Anodyne	ENPP1	72	41
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450647379	GD	On-Demand	Anodyne	VHL	48	31
COc1cc(NC(=O)CCCc2ncc(C)o2)ccc1OC(C)C	ZINC000450647384	EH	On-Demand	Anodyne	IMPDH2	0	41
COc1cc(NC(=O)CCCc2ncc(C)o2)ccc1OC(C)C	ZINC000450647384	EH	On-Demand	Anodyne	ENPP1	82	40
Cc1onc(C2CC2)c1C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450647385	GJ	On-Demand	Anodyne	ADAM17	51	38
Cc1onc(C2CC2)c1C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450647385	GJ	On-Demand	Anodyne	GYS1	41	34
CCN(CC)S(=O)(=O)c1ccc(N[C@H]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000450647389	FE	On-Demand	Bother	BDKRB1	22	41
C[C@H](O)[C@@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450647393	DE	On-Demand	Anodyne	CPT1A	94	39
C[C@@H](O)[C@@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450647394	DE	On-Demand	Anodyne	CPT1A	94	39
C[C@@H](O)[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450647395	DE	On-Demand	Anodyne	CPT1A	94	39
C[C@H](O)[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450647396	DE	On-Demand	Anodyne	CPT1A	94	39
c1ccc(CN2CCC3(CCN(CCc4cscn4)CC3)C2)cc1	ZINC000450647405	EH	On-Demand	Anodyne	SIGMAR1	49	43
CC(F)(F)C(C)(C)C(=O)N1CCN(c2ccccc2)C(=O)C1	ZINC000450647409	DF	On-Demand	Anodyne	P2RX7	0	43
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccccc1	ZINC000450647415	DF	On-Demand	Anodyne	DRD2	29	40
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccccc1	ZINC000450647415	DF	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccccc1	ZINC000450647415	DF	On-Demand	Anodyne	CYP2J2	56	39
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647417	DI	On-Demand	Anodyne	CAPN1	29	40
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647417	DI	On-Demand	Anodyne	CAPN2	35	40
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647418	DI	On-Demand	Anodyne	CAPN1	29	40
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450647418	DI	On-Demand	Anodyne	CAPN2	35	40
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647420	DI	On-Demand	Anodyne	CAPN1	29	40
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647420	DI	On-Demand	Anodyne	CAPN2	35	40
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647421	DI	On-Demand	Anodyne	CAPN1	29	40
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450647421	DI	On-Demand	Anodyne	CAPN2	34	40
CSc1ccc2ncnc(N3CCOC[C@@H](O)C3)c2c1	ZINC000450647430	CD	On-Demand	Anodyne	PDE3A	45	34
CSc1ccc2ncnc(N3CCOC[C@H](O)C3)c2c1	ZINC000450647431	CD	On-Demand	Anodyne	PDE3A	45	34
COc1cc(CNC(C)(C)C(C)(C)O)ccc1Cl	ZINC000450647434	CF	On-Demand	Anodyne	TRPV1	0	42
COC(=O)c1csc(CN(C)CCC2CCN(c3ccncc3)CC2)n1	ZINC000450647439	FG	On-Demand	Anodyne	SSTR1	21	43
CCOC(=O)c1sc(Sc2ccc(C(F)(F)F)nn2)nc1C	ZINC000450647460	EH	On-Demand	Anodyne	DHODH	25	43
CCOC(=O)c1sc(Sc2ncc(C(=O)OC)cn2)nc1C	ZINC000450647461	EE	On-Demand	Anodyne	DHODH	23	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1Br	ZINC000450647484	GI	On-Demand	Anodyne	NQO2	41	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1Br	ZINC000450647484	GI	On-Demand	Anodyne	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1Br	ZINC000450647484	GI	On-Demand	Anodyne	MTNR1A	23	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccsc1Br	ZINC000450647484	GI	On-Demand	Anodyne	EBP	19	47
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccsc1Br	ZINC000450647486	GI	On-Demand	Anodyne	NQO2	41	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccsc1Br	ZINC000450647486	GI	On-Demand	Anodyne	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccsc1Br	ZINC000450647486	GI	On-Demand	Anodyne	MTNR1A	23	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccsc1Br	ZINC000450647486	GI	On-Demand	Anodyne	EBP	19	47
N#CC[C@@H](O)CSc1nc2scc(C3CC3)c2c(=O)n1-c1ccccc1	ZINC000450647492	GH	On-Demand	Mild	TGM2	31	45
COC(=O)c1cc(-c2ccccc2CNC(=O)c2cc(C)n(C(C)C)n2)[nH]n1	ZINC000450647520	GF	On-Demand	Anodyne	MT-CYB	41	31
CC[C@H]1[C@H](CO)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450647531	EE	On-Demand	Anodyne	SCD1	39	43
CC[C@H]1[C@@H](CO)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450647532	EE	On-Demand	Anodyne	SCD1	39	43
CC[C@@H]1[C@@H](CO)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450647533	EE	On-Demand	Anodyne	SCD1	39	43
CC[C@@H]1[C@H](CO)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450647534	EE	On-Demand	Anodyne	SCD1	39	43
CCC[C@H](O)CN1CCC(OCCN2C[C@H](C)O[C@H](C)C2)CC1	ZINC000450647574	ED	On-Demand	Anodyne	ZM.86993	0	42
CCC[C@@H](O)CN1CCC(OCCN2C[C@H](C)O[C@H](C)C2)CC1	ZINC000450647576	ED	On-Demand	Anodyne	ZM.86993	0	42
CCC[C@H](O)CN1CCC(OCCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000450647577	ED	On-Demand	Anodyne	ZM.86993	0	42
CCC[C@H](O)CN1CCC(OCCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000450647579	ED	On-Demand	Anodyne	ZM.86993	0	42
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C)c(NC(=O)CCN(C)C)c1	ZINC000450647598	DF	On-Demand	Anodyne	LDLR	0	42
Cn1c(SCC[C@H]2CCOC2)nc2scc(-c3ccccc3)c2c1=O	ZINC000450647601	FI	On-Demand	Anodyne	TGM2	21	44
Cn1c(SCC[C@@H]2CCOC2)nc2scc(-c3ccccc3)c2c1=O	ZINC000450647608	FI	On-Demand	Anodyne	TGM2	21	44
Cc1cccc(F)c1NC(=O)c1cccc2c1CCCC2	ZINC000450647664	CI	On-Demand	Anodyne	AVPR2	32	43
Cc1cccc(F)c1NC(=O)c1cccc2c1CCCC2	ZINC000450647664	CI	On-Demand	Anodyne	AVPR1A	19	43
Cc1cccc(F)c1NC(=O)c1cccc2c1CCCC2	ZINC000450647664	CI	On-Demand	Anodyne	S1PR4	28	40
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647712	EG	On-Demand	Anodyne	DRD2	31	44
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647712	EG	On-Demand	Anodyne	DRD4	0	49
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647712	EG	On-Demand	Anodyne	HTR2A	23	46
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647712	EG	On-Demand	Anodyne	SLC18A3	0	44
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647712	EG	On-Demand	Anodyne	HTR3B	0	44
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647712	EG	On-Demand	Anodyne	CYP2J2	52	37
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647712	EG	On-Demand	Anodyne	NET	0	48
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647715	EG	On-Demand	Anodyne	DRD2	31	44
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647715	EG	On-Demand	Anodyne	DRD4	0	49
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647715	EG	On-Demand	Anodyne	HTR2A	23	46
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647715	EG	On-Demand	Anodyne	SLC18A3	0	44
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647715	EG	On-Demand	Anodyne	HTR3B	0	44
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647715	EG	On-Demand	Anodyne	CYP2J2	52	37
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(F)F	ZINC000450647715	EG	On-Demand	Anodyne	NET	0	48
COc1ccc([C@H](CO)N(C)C(=O)CC2CC(F)(F)C2)cc1	ZINC000450647717	DF	On-Demand	Anodyne	DXR	24	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2ncc[nH]2)c(OC)c1	ZINC000450647723	FE	On-Demand	Anodyne	ACKR3	65	33
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2ncc[nH]2)c(OC)c1	ZINC000450647725	FE	On-Demand	Anodyne	ACKR3	65	33
COc1ccc([C@@H](CO)N(C)C(=O)CC2CC(F)(F)C2)cc1	ZINC000450647727	DF	On-Demand	Anodyne	DXR	24	40
CCNS(=O)(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450647729	ED	On-Demand	Anodyne	CCR5	42	38
CCNS(=O)(=O)[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450647733	ED	On-Demand	Anodyne	CCR5	42	38
CCNS(=O)(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450647735	ED	On-Demand	Anodyne	CCR5	42	38
CCNS(=O)(=O)[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450647738	ED	On-Demand	Anodyne	CCR5	42	38
O=C(NCc1ccc(C(F)F)cc1)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450647741	GI	On-Demand	Anodyne	CXCR3	20	40
O=C(NCc1ccc(C(F)F)cc1)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450647741	GI	On-Demand	Anodyne	NAMPT	46	42
COC(=O)c1ccc2c(c1)CN(Cc1nnc(C3CC3)s1)CC2	ZINC000450647749	EF	On-Demand	Anodyne	NOD2	42	37
Cc1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450647751	FD	On-Demand	Anodyne	CA2	25	40
Cc1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450647751	FD	On-Demand	Anodyne	CA1	23	40
Cc1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450647751	FD	On-Demand	Anodyne	DKK1	0	45
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	THRA	0	40
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	DRD2	31	47
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	DRD1	19	43
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	DRD4	15	47
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	ADRA1A	18	47
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	DRD3	20	47
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	ERG2	21	47
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	HDAC8	18	40
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	SLC18A3	25	45
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450647766	GE	On-Demand	Anodyne	CYP2J2	54	39
CN(C(=O)[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)c(Cl)c1	ZINC000450647801	EH	On-Demand	Anodyne	OPRK1	0	46
CN(C(=O)[C@H]1CCN(c2ccccc2)C1)c1ccc(F)c(Cl)c1	ZINC000450647804	EH	On-Demand	Anodyne	OPRK1	0	46
CC(=O)c1ccc(C#N)cc1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450647809	GD	On-Demand	Mild	CA2	15	41
CC(C)(C)C(=O)CCCC(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450647826	EG	On-Demand	Anodyne	SMO	41	37
CC(C)(C)C(=O)CCCC(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450647826	EG	On-Demand	Anodyne	ETHR	86	61
COc1ccc([C@@H](CO)N(C)C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450647833	FF	On-Demand	Anodyne	GPR88	0	48
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCC(C)(C)C1	ZINC000450647837	FH	On-Demand	Anodyne	CCR5	43	38
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCC(C)(C)C1	ZINC000450647837	FH	On-Demand	Anodyne	EPHX2	17	40
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCC(C)(C)C1	ZINC000450647837	FH	On-Demand	Anodyne	KCNK3	77	36
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCC(C)(C)C1	ZINC000450647837	FH	On-Demand	Anodyne	KCNK9	50	36
Cn1c(SCC[C@H]2CCOC2)nnc1-c1ccccc1	ZINC000450647847	CG	On-Demand	Anodyne	DRD2	18	42
Cn1c(SCC[C@H]2CCOC2)nnc1-c1ccccc1	ZINC000450647847	CG	On-Demand	Anodyne	DRD3	45	42
Cn1c(SCC[C@H]2CCOC2)nnc1-c1ccccc1	ZINC000450647847	CG	On-Demand	Anodyne	KCNH2	27	41
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1ccccc1	ZINC000450647848	CG	On-Demand	Anodyne	DRD2	18	42
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1ccccc1	ZINC000450647848	CG	On-Demand	Anodyne	DRD3	45	42
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1ccccc1	ZINC000450647848	CG	On-Demand	Anodyne	KCNH2	27	41
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CCCC(=O)C(C)(C)C)C1	ZINC000450647851	EG	On-Demand	Anodyne	PREP	28	44
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CCCC(=O)C(C)(C)C)C1	ZINC000450647852	EG	On-Demand	Anodyne	PREP	28	44
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)c1	ZINC000450647853	GG	On-Demand	Anodyne	RHOA	0	40
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)c1	ZINC000450647854	GG	On-Demand	Anodyne	RHOA	0	40
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	HTR1A	21	76
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	DRD2	41	58
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	DRD1	25	48
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	DRD4	31	55
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	ACHE	23	47
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	HTR2A	47	55
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	HTR2C	28	58
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	HRH1	24	55
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	DRD3	19	55
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	SLC6A3	17	47
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	GRIN2B	63	45
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	PTAFR	16	40
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	ERG2	21	45
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	HTR7	21	46
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	HRH3	15	41
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	SIGMAR1	44	57
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	CCR3	80	54
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	CHRNA7	52	50
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	C3AR1	42	44
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	SLC18A3	25	48
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	GRIN3A	0	46
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	MCHR1	15	46
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	CYP2J2	63	44
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1	ZINC000450647855	EI	On-Demand	Anodyne	AP2S1	0	45
CCOC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2CC)nc1	ZINC000450647857	FG	On-Demand	Anodyne	SLC27A1	28	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647858	EH	On-Demand	Anodyne	NQO2	42	51
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647858	EH	On-Demand	Anodyne	MTR1B_CHICK	0	55
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647858	EH	On-Demand	Anodyne	HTR6	39	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647858	EH	On-Demand	Anodyne	PPARD	48	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647858	EH	On-Demand	Anodyne	MTNR1A	33	47
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647858	EH	On-Demand	Anodyne	EBP	24	50
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647858	EH	On-Demand	Anodyne	CCL2	0	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647859	EH	On-Demand	Anodyne	NQO2	42	51
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647859	EH	On-Demand	Anodyne	MTR1B_CHICK	0	55
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647859	EH	On-Demand	Anodyne	HTR6	39	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647859	EH	On-Demand	Anodyne	PPARD	48	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647859	EH	On-Demand	Anodyne	MTNR1A	33	47
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647859	EH	On-Demand	Anodyne	EBP	24	50
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450647859	EH	On-Demand	Anodyne	CCL2	0	41
CCC1(CC)CN(C(=O)c2cnn3ccc(C)cc23)CCS1	ZINC000450647860	DG	On-Demand	Anodyne	EPHB3	24	41
CSCC1CCC(Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450647873	GH	On-Demand	Anodyne	EPHX2	16	41
CSCC1CCC(Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450647873	GH	On-Demand	Anodyne	TGM2	32	41
CSCC1CCC(Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450647873	GH	On-Demand	Anodyne	NAMPT	32	40
COc1ccc(CNC(=O)CCN2CCC(CCC(N)=O)CC2)c(OC)c1	ZINC000450647874	GD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC(CCC(N)=O)CC2)c(OC)c1	ZINC000450647874	GD	On-Demand	Anodyne	ACHE	16	40
COc1ccc(CNC(=O)CCN2CCC(CCC(N)=O)CC2)c(OC)c1	ZINC000450647874	GD	On-Demand	Anodyne	HTR4	71	43
COc1ccc(CNC(=O)CCN2CCC(CCC(N)=O)CC2)c(OC)c1	ZINC000450647874	GD	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CCC(CCC(N)=O)CC2)c(OC)c1	ZINC000450647874	GD	On-Demand	Anodyne	MTNR1A	52	38
COc1ccc(CNC(=O)CCN2CCC(CCC(N)=O)CC2)c(OC)c1	ZINC000450647874	GD	On-Demand	Anodyne	MTNR1B	40	37
COc1ccc(CNC(=O)CCN2CCC(CCC(N)=O)CC2)c(OC)c1	ZINC000450647874	GD	On-Demand	Anodyne	CACNA1I	49	37
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647889	GF	On-Demand	Anodyne	ACE	42	37
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647889	GF	On-Demand	Anodyne	CCKAR	0	43
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647889	GF	On-Demand	Anodyne	CCR3	28	41
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647889	GF	On-Demand	Anodyne	TIMP3	52	32
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647889	GF	On-Demand	Anodyne	CCKBR	24	43
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647889	GF	On-Demand	Anodyne	ST14	42	34
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647889	GF	On-Demand	Anodyne	RHOA	0	42
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647890	GF	On-Demand	Anodyne	ACE	42	37
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647890	GF	On-Demand	Anodyne	CCKAR	0	43
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647890	GF	On-Demand	Anodyne	CCR3	28	41
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647890	GF	On-Demand	Anodyne	TIMP3	52	32
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647890	GF	On-Demand	Anodyne	CCKBR	24	43
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647890	GF	On-Demand	Anodyne	ST14	42	34
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450647890	GF	On-Demand	Anodyne	RHOA	0	42
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647891	GF	On-Demand	Anodyne	ACE	42	37
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647891	GF	On-Demand	Anodyne	CCKAR	0	43
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647891	GF	On-Demand	Anodyne	CCR3	28	41
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647891	GF	On-Demand	Anodyne	TIMP3	52	32
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647891	GF	On-Demand	Anodyne	CCKBR	24	43
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647891	GF	On-Demand	Anodyne	ST14	42	34
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647891	GF	On-Demand	Anodyne	RHOA	0	42
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647892	GF	On-Demand	Anodyne	ACE	42	37
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647892	GF	On-Demand	Anodyne	CCKAR	0	43
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647892	GF	On-Demand	Anodyne	CCR3	28	41
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647892	GF	On-Demand	Anodyne	TIMP3	52	32
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647892	GF	On-Demand	Anodyne	CCKBR	24	43
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647892	GF	On-Demand	Anodyne	ST14	42	34
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450647892	GF	On-Demand	Anodyne	RHOA	0	42
CC(C)C(=O)NCCN(C)CCc1c(Cl)cccc1Cl	ZINC000450647894	DG	On-Demand	Anodyne	CXCL8	50	31
CC(C)C(=O)NCCN(C)CCc1c(Cl)cccc1Cl	ZINC000450647894	DG	On-Demand	Anodyne	NQO2	19	40
CC(C)C(=O)NCCN(C)CCc1c(Cl)cccc1Cl	ZINC000450647894	DG	On-Demand	Anodyne	MTNR1A	23	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450647895	FG	On-Demand	Anodyne	RHODESAIN	0	46
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450647896	FG	On-Demand	Anodyne	RHODESAIN	0	46
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450647897	FG	On-Demand	Anodyne	RHODESAIN	0	46
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450647898	FG	On-Demand	Anodyne	RHODESAIN	0	46
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cnn2ccc(C)cc12	ZINC000450647899	FF	On-Demand	Anodyne	EPHB3	32	45
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cnn2ccc(C)cc12	ZINC000450647900	FF	On-Demand	Anodyne	EPHB3	32	45
O=C(CSC1CC1)NCc1cccc(-c2cccnc2)c1	ZINC000450647901	CG	On-Demand	Anodyne	NAMPT	45	37
Clc1ccc(CCN2CCCC[C@H]2c2nc[nH]n2)cc1	ZINC000450647915	CG	On-Demand	Anodyne	HRH3	24	40
Clc1ccc(CCN2CCCC[C@@H]2c2nc[nH]n2)cc1	ZINC000450647916	CG	On-Demand	Anodyne	HRH3	24	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450647919	GH	On-Demand	Bother	MTR1B_CHICK	0	55
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450647919	GH	On-Demand	Bother	HTR6	37	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450647919	GH	On-Demand	Bother	MTNR1A	29	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450647919	GH	On-Demand	Bother	EBP	19	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450647920	GH	On-Demand	Bother	MTR1B_CHICK	0	55
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450647920	GH	On-Demand	Bother	HTR6	37	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450647920	GH	On-Demand	Bother	MTNR1A	29	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450647920	GH	On-Demand	Bother	EBP	19	41
CO[C@@H](Cc1ccccc1)CN(C)CCNC(=O)N(C)C	ZINC000450647922	CD	On-Demand	Anodyne	AMP1_PLAFQ	41	36
CO[C@H](Cc1ccccc1)CN(C)CCNC(=O)N(C)C	ZINC000450647924	CD	On-Demand	Anodyne	AMP1_PLAFQ	41	36
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CC[C@H]2CCC(=O)N2)C1	ZINC000450647925	DD	On-Demand	Anodyne	F2R	27	42
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CC[C@@H]2CCC(=O)N2)C1	ZINC000450647927	DD	On-Demand	Anodyne	F2R	27	42
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CC[C@H]2CCC(=O)N2)C1	ZINC000450647929	DD	On-Demand	Anodyne	F2R	27	42
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CC[C@@H]2CCC(=O)N2)C1	ZINC000450647931	DD	On-Demand	Anodyne	F2R	27	42
Cn1c(SC[C@H]2CCCC2(F)F)nnc1-c1ccccc1	ZINC000450647935	DI	On-Demand	Anodyne	DRD3	25	42
Cn1c(SC[C@@H]2CCCC2(F)F)nnc1-c1ccccc1	ZINC000450647936	DI	On-Demand	Anodyne	DRD3	25	42
COc1cc(NC(=O)c2nn3c(c2C)OCCC3)ccc1OC(C)C	ZINC000450647954	EG	On-Demand	Anodyne	ENPP1	51	31
COC(=O)c1ccc(CC(=O)N[C@H](C)c2cn(C(C)(C)C)nc2C)cc1	ZINC000450647955	FG	On-Demand	Anodyne	CACNA1I	17	42
COC(=O)c1ccc(CC(=O)N[C@@H](C)c2cn(C(C)(C)C)nc2C)cc1	ZINC000450647956	FG	On-Demand	Anodyne	CACNA1I	17	42
CCc1nc2ccccc2n1C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450647957	GI	On-Demand	Anodyne	GRM2	17	41
COc1cc(NC(=O)C(C)(C)OC(C)C)ccc1OC(C)C	ZINC000450647963	DH	On-Demand	Anodyne	ENPP1	76	36
COc1cc(NC(=O)C(C)(C)OC(C)C)ccc1OC(C)C	ZINC000450647963	DH	On-Demand	Anodyne	KCNK3	41	41
COc1cc(NC(=O)C(C)(C)OC(C)C)ccc1OC(C)C	ZINC000450647963	DH	On-Demand	Anodyne	KCNK9	36	41
CCOCc1nc(C)c(C(=O)Nc2ccc(OC(C)C)c(OC)c2)s1	ZINC000450647964	FI	On-Demand	Anodyne	ENPP1	74	36
COc1cc(NC(=O)[C@@H]2CC2(F)F)ccc1OC(C)C	ZINC000450647966	CG	On-Demand	Anodyne	ENPP1	57	33
COc1cc(NC(=O)[C@H]2CC2(F)F)ccc1OC(C)C	ZINC000450647967	CG	On-Demand	Anodyne	ENPP1	57	33
COc1cc(NC(=O)c2ccnc(OC(F)F)c2)ccc1OC(C)C	ZINC000450647969	FH	On-Demand	Anodyne	GRM4	17	42
COc1cc(NC(=O)c2ccnc(OC(F)F)c2)ccc1OC(C)C	ZINC000450647969	FH	On-Demand	Anodyne	PDGFRA	44	35
COc1cc(NC(=O)c2ccnc(OC(F)F)c2)ccc1OC(C)C	ZINC000450647969	FH	On-Demand	Anodyne	ENPP1	61	37
COc1cc(NC(=O)c2ccnc(OC(F)F)c2)ccc1OC(C)C	ZINC000450647969	FH	On-Demand	Anodyne	GLMU	0	41
COc1cc(NC(=O)c2ccnc(OC(F)F)c2)ccc1OC(C)C	ZINC000450647969	FH	On-Demand	Anodyne	KCNK3	48	35
COc1cc(NC(=O)c2ccnc(OC(F)F)c2)ccc1OC(C)C	ZINC000450647969	FH	On-Demand	Anodyne	KCNK9	54	35
COc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OC(C)C	ZINC000450647980	FI	On-Demand	Anodyne	GRM4	38	47
COc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OC(C)C	ZINC000450647980	FI	On-Demand	Anodyne	SHH	36	41
COc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OC(C)C	ZINC000450647980	FI	On-Demand	Anodyne	ENPP1	78	37
COc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OC(C)C	ZINC000450647980	FI	On-Demand	Anodyne	KCNK3	55	43
COc1cc(NC(=O)c2cccc(C(F)(F)F)n2)ccc1OC(C)C	ZINC000450647980	FI	On-Demand	Anodyne	KCNK9	51	43
Cc1cc(C2CCN(Cc3c(C)cccc3Cl)CC2)n[nH]1	ZINC000450647990	DI	On-Demand	Anodyne	DRD4	19	49
Cc1cc(C2CCN(Cc3c(C)cccc3Cl)CC2)n[nH]1	ZINC000450647990	DI	On-Demand	Anodyne	EIF2AK1	40	34
COc1cccc(-n2cc(C(=O)Nc3ccc(OC(C)C)c(OC)c3)nn2)c1	ZINC000450647994	GG	On-Demand	Anodyne	ESRRA	23	40
COc1cccc(-n2cc(C(=O)Nc3ccc(OC(C)C)c(OC)c3)nn2)c1	ZINC000450647994	GG	On-Demand	Anodyne	CCKAR	0	40
COc1cccc(-n2cc(C(=O)Nc3ccc(OC(C)C)c(OC)c3)nn2)c1	ZINC000450647994	GG	On-Demand	Anodyne	GRM4	19	42
COc1cccc(-n2cc(C(=O)Nc3ccc(OC(C)C)c(OC)c3)nn2)c1	ZINC000450647994	GG	On-Demand	Anodyne	TAAR1	31	40
COc1cccc(-n2cc(C(=O)Nc3ccc(OC(C)C)c(OC)c3)nn2)c1	ZINC000450647994	GG	On-Demand	Anodyne	ENPP1	78	38
COc1cc(NC(=O)Cc2ccc(OC)c(OC)c2Cl)ccc1OC(C)C	ZINC000450647998	GI	On-Demand	Anodyne	ENPP1	81	40
COc1cc(NC(=O)Cc2ccc(OC)c(OC)c2Cl)ccc1OC(C)C	ZINC000450647998	GI	On-Demand	Anodyne	IMDH_CRYPV	35	45
Cc1cc(C2CCN(CCN(C)Cc3ccccc3)CC2)n[nH]1	ZINC000450648006	DG	On-Demand	Anodyne	DRD2	25	48
Cc1cc(C2CCN(CCN(C)Cc3ccccc3)CC2)n[nH]1	ZINC000450648006	DG	On-Demand	Anodyne	HTR1D	23	40
Cc1cc(C2CCN(CCN(C)Cc3ccccc3)CC2)n[nH]1	ZINC000450648006	DG	On-Demand	Anodyne	HTR1B	22	40
Cc1cc(C2CCN(CCN(C)Cc3ccccc3)CC2)n[nH]1	ZINC000450648006	DG	On-Demand	Anodyne	DRD3	19	46
Cc1cc(C2CCN(CCN(C)Cc3ccccc3)CC2)n[nH]1	ZINC000450648006	DG	On-Demand	Anodyne	GRIN2B	27	40
Cc1cc(C2CCN(CCN(C)Cc3ccccc3)CC2)n[nH]1	ZINC000450648006	DG	On-Demand	Anodyne	SIGMAR1	43	44
C=CC(C)(C)C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450648007	CH	On-Demand	Mild	ENPP1	55	33
COc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OC(C)C	ZINC000450648023	FI	On-Demand	Anodyne	COLA	53	38
COc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OC(C)C	ZINC000450648023	FI	On-Demand	Anodyne	CPT1A	51	38
COc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OC(C)C	ZINC000450648023	FI	On-Demand	Anodyne	CPT2	44	34
COc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OC(C)C	ZINC000450648023	FI	On-Demand	Anodyne	P4HTM	0	41
COc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OC(C)C	ZINC000450648023	FI	On-Demand	Anodyne	ENPP1	72	35
COc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OC(C)C	ZINC000450648023	FI	On-Demand	Anodyne	KCNK3	49	38
COc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)ccc1OC(C)C	ZINC000450648023	FI	On-Demand	Anodyne	KCNK9	42	38
CCOC(=O)c1ccc(CN2CCC(n3c(CC)nc4ccccc43)CC2)nc1	ZINC000450648031	GI	On-Demand	Anodyne	SSTR5	37	40
CCOC(=O)c1ccc(CN2CCC(n3c(CC)nc4ccccc43)CC2)nc1	ZINC000450648031	GI	On-Demand	Anodyne	PLD1	43	34
CCOC(=O)c1ccc(CN2CCC(n3c(CC)nc4ccccc43)CC2)nc1	ZINC000450648031	GI	On-Demand	Anodyne	FPR2	30	44
C[C@H]1CN(CCOC2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648035	GF	On-Demand	Anodyne	SLC6A3	15	41
C[C@H]1CN(CCOC2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648036	GF	On-Demand	Anodyne	SLC6A3	15	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(OCCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000450648037	GF	On-Demand	Anodyne	SLC6A3	15	41
C[C@@H]1CN(CCOC2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648038	GF	On-Demand	Anodyne	SLC6A3	15	41
COc1cc(OC)c2ncnc(N[C@H](C)CCCCO)c2c1	ZINC000450648041	DF	On-Demand	Anodyne	PDE6A	43	32
COc1cc(OC)c2ncnc(N[C@@H](C)CCCCO)c2c1	ZINC000450648042	DF	On-Demand	Anodyne	PDE6A	43	32
Cn1c(S[C@@H]2CC[C@H](C#N)C2)nc2scc(-c3ccccc3)c2c1=O	ZINC000450648050	FI	On-Demand	Mild	TGM2	18	43
Cn1c(S[C@H]2CC[C@H](C#N)C2)nc2scc(-c3ccccc3)c2c1=O	ZINC000450648051	FI	On-Demand	Mild	TGM2	18	43
Cn1c(S[C@H]2CC[C@@H](C#N)C2)nc2scc(-c3ccccc3)c2c1=O	ZINC000450648052	FI	On-Demand	Mild	TGM2	18	43
Cn1c(S[C@@H]2CC[C@@H](C#N)C2)nc2scc(-c3ccccc3)c2c1=O	ZINC000450648053	FI	On-Demand	Mild	TGM2	18	43
COCC1(C)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450648075	CH	On-Demand	Anodyne	SIGMAR1	24	40
O[C@@H]1C[C@@H]([C@@H]2CCCOC2)N(c2ccnc3cc(Cl)ccc23)C1	ZINC000450648084	EG	On-Demand	Anodyne	HRP1_PLAFA	70	32
O[C@@H]1C[C@@H]([C@@H]2CCCOC2)N(c2ccnc3cc(Cl)ccc23)C1	ZINC000450648084	EG	On-Demand	Anodyne	HNMT	50	35
O[C@@H]1C[C@H]([C@@H]2CCCOC2)N(c2ccnc3cc(Cl)ccc23)C1	ZINC000450648085	EG	On-Demand	Anodyne	HRP1_PLAFA	70	32
O[C@@H]1C[C@H]([C@@H]2CCCOC2)N(c2ccnc3cc(Cl)ccc23)C1	ZINC000450648085	EG	On-Demand	Anodyne	HNMT	50	35
O[C@@H]1C[C@H]([C@H]2CCCOC2)N(c2ccnc3cc(Cl)ccc23)C1	ZINC000450648086	EG	On-Demand	Anodyne	HRP1_PLAFA	70	32
O[C@@H]1C[C@H]([C@H]2CCCOC2)N(c2ccnc3cc(Cl)ccc23)C1	ZINC000450648086	EG	On-Demand	Anodyne	HNMT	50	35
O[C@@H]1C[C@@H]([C@H]2CCCOC2)N(c2ccnc3cc(Cl)ccc23)C1	ZINC000450648087	EG	On-Demand	Anodyne	HRP1_PLAFA	70	32
O[C@@H]1C[C@@H]([C@H]2CCCOC2)N(c2ccnc3cc(Cl)ccc23)C1	ZINC000450648087	EG	On-Demand	Anodyne	HNMT	50	35
CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)c1c(C)cccc1Cl	ZINC000450648142	EI	On-Demand	Anodyne	CTSA	43	36
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)c1c(C)cccc1Cl	ZINC000450648143	EI	On-Demand	Anodyne	CTSA	43	36
CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)c1c(C)cccc1Cl	ZINC000450648144	EI	On-Demand	Anodyne	CTSA	43	36
CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)c1c(C)cccc1Cl	ZINC000450648145	EI	On-Demand	Anodyne	CTSA	43	36
C[C@@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648161	DG	On-Demand	Anodyne	P2RX3	20	47
C[C@@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648161	DG	On-Demand	Anodyne	CTSV	49	34
COC(=O)C1(CN2CCC3(CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000450648163	EF	On-Demand	Anodyne	SIGMAR1	65	38
COC(=O)C1(CN2CCC3(CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000450648163	EF	On-Demand	Anodyne	NPFFR2	39	40
COC(=O)C1(CN2CCC3(CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000450648163	EF	On-Demand	Anodyne	ADAM17	20	42
COC(=O)C1(CN2CCC3(CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000450648163	EF	On-Demand	Anodyne	CCR8	44	38
COC(=O)C1(CN2CCC3(CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000450648163	EF	On-Demand	Anodyne	NPFFR1	61	40
COC(=O)C1(CN2CCC3(CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000450648163	EF	On-Demand	Anodyne	SLC12A5	52	37
c1ccc(CN2CCC3(CCN(Cc4cnns4)CC3)C2)cc1	ZINC000450648168	EG	On-Demand	Anodyne	SIGMAR1	26	44
c1ccc(CN2CCC3(CCN(Cc4cnns4)CC3)C2)cc1	ZINC000450648168	EG	On-Demand	Anodyne	NPFFR1	45	34
C[C@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648169	DG	On-Demand	Anodyne	P2RX3	20	47
C[C@H](CC(F)(F)F)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648169	DG	On-Demand	Anodyne	CTSV	49	34
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450648190	FE	On-Demand	Anodyne	PRCP	46	35
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450648191	FE	On-Demand	Anodyne	PRCP	46	35
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450648192	FE	On-Demand	Anodyne	PRCP	46	35
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450648193	FE	On-Demand	Anodyne	PRCP	46	35
CC1(C)OCC[C@@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450648197	GG	On-Demand	Bother	BCL2L1	97	36
CC1(C)OCC[C@@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450648197	GG	On-Demand	Bother	BCL2	77	34
CC1(C)OCC[C@@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450648197	GG	On-Demand	Bother	BCL2L2	43	35
CC1(C)OCC[C@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450648198	GG	On-Demand	Bother	BCL2L1	97	36
CC1(C)OCC[C@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450648198	GG	On-Demand	Bother	BCL2	77	34
CC1(C)OCC[C@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450648198	GG	On-Demand	Bother	BCL2L2	43	35
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2ccccc2)C(=O)C1	ZINC000450648201	GE	On-Demand	Anodyne	ACE	20	40
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2ccccc2)C(=O)C1	ZINC000450648201	GE	On-Demand	Anodyne	CPT2	44	38
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2ccccc2)C(=O)C1	ZINC000450648201	GE	On-Demand	Anodyne	PREP	105	65
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2ccccc2)C(=O)C1	ZINC000450648201	GE	On-Demand	Anodyne	SFRP1	43	42
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2ccccc2)C(=O)C1	ZINC000450648201	GE	On-Demand	Anodyne	WNT3	48	42
NC(=O)N[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450648202	CD	On-Demand	Anodyne	SIGMAR1	26	40
NC(=O)N[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450648203	CD	On-Demand	Anodyne	SIGMAR1	26	40
NC(=O)N[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450648204	CD	On-Demand	Anodyne	SIGMAR1	26	40
NC(=O)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450648205	CD	On-Demand	Anodyne	SIGMAR1	26	40
COc1ccc([C@H](CO)N(C)C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450648207	FF	On-Demand	Anodyne	GPR88	0	48
Cc1sccc1C(=O)N1CCN(c2ccccc2)C(=O)C1	ZINC000450648214	DF	On-Demand	Anodyne	P2RX7	0	48
COc1cc2c(N3CCOC[C@H](O)C3)ncnc2cc1F	ZINC000450648219	CC	On-Demand	Anodyne	PDE3A	59	45
COc1cc2c(N3CCOC[C@H](O)C3)ncnc2cc1F	ZINC000450648219	CC	On-Demand	Anodyne	PDGFRB	66	41
COc1cc2c(N3CCOC[C@H](O)C3)ncnc2cc1F	ZINC000450648219	CC	On-Demand	Anodyne	PDE3B	87	45
Clc1ccc(N2CCCN(CCc3cscn3)CC2)cc1Cl	ZINC000450648226	FI	On-Demand	Anodyne	SIGMAR1	17	42
Clc1ccc(N2CCCN(CCc3cscn3)CC2)cc1Cl	ZINC000450648226	FI	On-Demand	Anodyne	L3MBTL3	20	41
N#Cc1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nc1	ZINC000450648227	CE	On-Demand	Mild	ITGAL	27	43
N#Cc1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nc1	ZINC000450648227	CE	On-Demand	Mild	SMO	0	41
N#Cc1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nc1	ZINC000450648228	CE	On-Demand	Mild	ITGAL	27	43
N#Cc1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nc1	ZINC000450648228	CE	On-Demand	Mild	SMO	0	41
N#Cc1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nc1	ZINC000450648229	CE	On-Demand	Mild	ITGAL	27	43
N#Cc1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nc1	ZINC000450648229	CE	On-Demand	Mild	SMO	0	41
N#Cc1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nc1	ZINC000450648230	CE	On-Demand	Mild	ITGAL	27	43
N#Cc1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nc1	ZINC000450648230	CE	On-Demand	Mild	SMO	0	41
N#CC[C@@H](O)CSc1nc2ccccc2n1CCc1ccccc1	ZINC000450648234	EH	On-Demand	Mild	PTGDR2	18	50
COc1cc2c(N3CCOC[C@@H](O)C3)ncnc2cc1F	ZINC000450648245	CC	On-Demand	Anodyne	PDE3A	59	45
COc1cc2c(N3CCOC[C@@H](O)C3)ncnc2cc1F	ZINC000450648245	CC	On-Demand	Anodyne	PDGFRB	66	41
COc1cc2c(N3CCOC[C@@H](O)C3)ncnc2cc1F	ZINC000450648245	CC	On-Demand	Anodyne	PDE3B	87	45
CCCc1cc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)no1	ZINC000450648248	EE	On-Demand	Anodyne	P2RX7	20	42
COc1ccc(-c2csc3ncnc(N4CCOC[C@H](O)C4)c23)cc1	ZINC000450648276	FF	On-Demand	Anodyne	ADRB3	31	47
COc1ccc(-c2csc3ncnc(N4CCOC[C@@H](O)C4)c23)cc1	ZINC000450648278	FF	On-Demand	Anodyne	ADRB3	31	47
CC(=O)c1ccc(CN2CCO[C@H](c3ccc(F)c(C)c3)C2)cc1	ZINC000450648279	EH	On-Demand	Anodyne	DRD4	22	44
CN(CC(C)(C)CO)c1ncc(C(F)(F)F)cc1Cl	ZINC000450648280	CG	On-Demand	Anodyne	TRPM8	39	41
CC(=O)c1ccc(CN2CCO[C@@H](c3ccc(F)c(C)c3)C2)cc1	ZINC000450648304	EH	On-Demand	Anodyne	DRD4	22	44
COc1ccc([C@@H](CO)N(C)C(=O)CCc2ccc3c(c2)OCCO3)cc1	ZINC000450648307	FF	On-Demand	Anodyne	BMP1	56	40
COc1ccc([C@H](CO)N(C)C(=O)CCc2ccc3c(c2)OCCO3)cc1	ZINC000450648310	FF	On-Demand	Anodyne	BMP1	56	40
COC[C@@]1(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)CCOC1	ZINC000450648311	EE	On-Demand	Anodyne	HTR6	30	40
COC[C@]1(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)CCOC1	ZINC000450648314	EE	On-Demand	Anodyne	HTR6	30	40
COC[C@]1(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)CCOC1	ZINC000450648318	EE	On-Demand	Anodyne	HTR6	30	40
COC[C@@]1(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)CCOC1	ZINC000450648320	EE	On-Demand	Anodyne	HTR6	30	40
CC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450648333	BG	On-Demand	Anodyne	DRD4	41	42
CC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450648333	BG	On-Demand	Anodyne	ACHE	19	51
CC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450648333	BG	On-Demand	Anodyne	SIGMAR1	42	47
CC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450648333	BG	On-Demand	Anodyne	SLC18A3	19	43
CC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450648333	BG	On-Demand	Anodyne	MLNR	56	39
CC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450648333	BG	On-Demand	Anodyne	S1PR5	20	40
CC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450648333	BG	On-Demand	Anodyne	CXCR3	19	42
CC(=O)c1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450648333	BG	On-Demand	Anodyne	MCHR1	28	41
CC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450648334	BG	On-Demand	Anodyne	DRD4	41	42
CC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450648334	BG	On-Demand	Anodyne	ACHE	19	51
CC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450648334	BG	On-Demand	Anodyne	SIGMAR1	42	47
CC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450648334	BG	On-Demand	Anodyne	SLC18A3	19	43
CC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450648334	BG	On-Demand	Anodyne	MLNR	56	39
CC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450648334	BG	On-Demand	Anodyne	S1PR5	20	40
CC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450648334	BG	On-Demand	Anodyne	CXCR3	19	42
CC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450648334	BG	On-Demand	Anodyne	MCHR1	28	41
CC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450648335	BG	On-Demand	Anodyne	DRD4	41	42
CC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450648335	BG	On-Demand	Anodyne	ACHE	19	51
CC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450648335	BG	On-Demand	Anodyne	SIGMAR1	42	47
CC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450648335	BG	On-Demand	Anodyne	SLC18A3	19	43
CC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450648335	BG	On-Demand	Anodyne	MLNR	56	39
CC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450648335	BG	On-Demand	Anodyne	S1PR5	20	40
CC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450648335	BG	On-Demand	Anodyne	CXCR3	19	42
CC(=O)c1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450648335	BG	On-Demand	Anodyne	MCHR1	28	41
CC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450648336	BG	On-Demand	Anodyne	DRD4	41	42
CC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450648336	BG	On-Demand	Anodyne	ACHE	19	51
CC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450648336	BG	On-Demand	Anodyne	SIGMAR1	42	47
CC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450648336	BG	On-Demand	Anodyne	SLC18A3	19	43
CC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450648336	BG	On-Demand	Anodyne	MLNR	56	39
CC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450648336	BG	On-Demand	Anodyne	S1PR5	20	40
CC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450648336	BG	On-Demand	Anodyne	CXCR3	19	42
CC(=O)c1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450648336	BG	On-Demand	Anodyne	MCHR1	28	41
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@H](C)O	ZINC000450648337	FD	On-Demand	Anodyne	SLC6A1	32	41
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@@H](C)O	ZINC000450648338	FD	On-Demand	Anodyne	SLC6A1	32	41
OC[C@]1(F)CN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1c1ccccc1	ZINC000450648371	FG	On-Demand	Anodyne	SORD	39	40
OC[C@@]1(F)CN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1c1ccccc1	ZINC000450648372	FG	On-Demand	Anodyne	SORD	39	40
OC[C@]1(F)CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccccc1	ZINC000450648373	FG	On-Demand	Anodyne	SORD	39	40
OC[C@@]1(F)CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccccc1	ZINC000450648374	FG	On-Demand	Anodyne	SORD	39	40
Cc1cccc(F)c1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450648376	CG	On-Demand	Anodyne	CTSA	52	38
COC(=O)c1coc(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000450648377	GG	On-Demand	Anodyne	SIGMAR1	27	51
COC(=O)c1coc(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000450648377	GG	On-Demand	Anodyne	CACNA1G	16	47
CCN1C[C@H](C)N(CCCC(=O)c2ccccc2)C[C@H]1C	ZINC000450648383	CG	On-Demand	Anodyne	SLC6A1	41	34
CCN1C[C@H](C)N(CCCC(=O)c2ccccc2)C[C@H]1C	ZINC000450648383	CG	On-Demand	Anodyne	CYP2J2	60	45
CCN1C[C@H](C)N(CCCC(=O)c2ccccc2)C[C@H]1C	ZINC000450648383	CG	On-Demand	Anodyne	SLC29A2	0	40
CCN1C[C@H](C)N(CCCC(=O)c2ccccc2)C[C@@H]1C	ZINC000450648384	CG	On-Demand	Anodyne	SLC6A1	41	34
CCN1C[C@H](C)N(CCCC(=O)c2ccccc2)C[C@@H]1C	ZINC000450648384	CG	On-Demand	Anodyne	CYP2J2	60	45
CCN1C[C@H](C)N(CCCC(=O)c2ccccc2)C[C@@H]1C	ZINC000450648384	CG	On-Demand	Anodyne	SLC29A2	0	40
CCN1C[C@@H](C)N(CCCC(=O)c2ccccc2)C[C@H]1C	ZINC000450648385	CG	On-Demand	Anodyne	SLC6A1	41	34
CCN1C[C@@H](C)N(CCCC(=O)c2ccccc2)C[C@H]1C	ZINC000450648385	CG	On-Demand	Anodyne	CYP2J2	60	45
CCN1C[C@@H](C)N(CCCC(=O)c2ccccc2)C[C@H]1C	ZINC000450648385	CG	On-Demand	Anodyne	SLC29A2	0	40
CCN1C[C@@H](C)N(CCCC(=O)c2ccccc2)C[C@@H]1C	ZINC000450648386	CG	On-Demand	Anodyne	SLC6A1	41	34
CCN1C[C@@H](C)N(CCCC(=O)c2ccccc2)C[C@@H]1C	ZINC000450648386	CG	On-Demand	Anodyne	CYP2J2	60	45
CCN1C[C@@H](C)N(CCCC(=O)c2ccccc2)C[C@@H]1C	ZINC000450648386	CG	On-Demand	Anodyne	SLC29A2	0	40
COc1ccc([C@@H](CO)N(C)C(=O)Cc2cc(Br)ccc2C)cc1	ZINC000450648416	GH	On-Demand	Anodyne	DXR	28	42
COc1ccc([C@H](CO)N(C)C(=O)Cc2cc(Br)ccc2C)cc1	ZINC000450648418	GH	On-Demand	Anodyne	DXR	28	42
COC(=O)[C@@H](CC(C)C)N(C)c1ccc2nnc(-c3ccsc3)n2n1	ZINC000450648424	FF	On-Demand	Anodyne	LRRK2	0	43
COC(=O)[C@H](CC(C)C)N(C)c1ccc2nnc(-c3ccsc3)n2n1	ZINC000450648425	FF	On-Demand	Anodyne	LRRK2	0	43
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@H]3C3CC3)c([N+](=O)[O-])c2)CC1	ZINC000450648435	GD	On-Demand	Bother	NOD2	17	40
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]3C3CC3)c([N+](=O)[O-])c2)CC1	ZINC000450648436	GD	On-Demand	Bother	NOD2	17	40
COc1cc(NC(=O)c2ccsc2C)ccc1OC(C)C	ZINC000450648456	DI	On-Demand	Anodyne	GRM4	17	43
COc1cc(NC(=O)c2ccsc2C)ccc1OC(C)C	ZINC000450648456	DI	On-Demand	Anodyne	ENPP1	58	34
COc1cc(NC(=O)c2ccsc2C)ccc1OC(C)C	ZINC000450648456	DI	On-Demand	Anodyne	KCNK3	58	45
COc1cc(NC(=O)c2ccsc2C)ccc1OC(C)C	ZINC000450648456	DI	On-Demand	Anodyne	KCNK9	61	45
COc1cc(NC(=O)c2ccsc2C)ccc1OC(C)C	ZINC000450648456	DI	On-Demand	Anodyne	BRPF1	0	40
COc1cc(NC(=O)[C@@H]2OCC[C@@H]2C)ccc1OC(C)C	ZINC000450648457	CF	On-Demand	Anodyne	ENPP1	54	31
COc1cc2c(cc1NC(=O)[C@@H]1C[C@H]1CC(C)C)NC(=O)CC2	ZINC000450648468	DG	On-Demand	Anodyne	SLC18A2	40	35
Cc1ccc(NC(=O)N2CCN(CCC[C@H](C)O)CC2)cc1	ZINC000450648475	DE	On-Demand	Anodyne	PDGFRB	42	35
C/C=C/COc1cccc(CC(=O)N[C@H](C)CC(F)(F)F)c1	ZINC000450648476	DH	On-Demand	Anodyne	PDS	57	36
Cc1ccc(NC(=O)N2CCN(CCC[C@@H](C)O)CC2)cc1	ZINC000450648477	DE	On-Demand	Anodyne	PDGFRB	42	35
C/C=C\COc1cccc(CC(=O)N[C@@H](C)CC(F)(F)F)c1	ZINC000450648478	DH	On-Demand	Anodyne	PDS	57	36
C/C=C/COc1cccc(CC(=O)N[C@@H](C)CC(F)(F)F)c1	ZINC000450648480	DH	On-Demand	Anodyne	PDS	57	36
C/C=C\COc1cccc(CC(=O)N[C@H](C)CC(F)(F)F)c1	ZINC000450648482	DH	On-Demand	Anodyne	PDS	57	36
C[C@@H](CCCCO)Nc1ncnc2cc(Br)ccc12	ZINC000450648487	DG	On-Demand	Anodyne	EGFR	62	37
C[C@@H](CCCCO)Nc1ncnc2cc(Br)ccc12	ZINC000450648487	DG	On-Demand	Anodyne	HTT	0	40
C[C@H](CCCCO)Nc1ncnc2cc(Br)ccc12	ZINC000450648488	DG	On-Demand	Anodyne	EGFR	62	37
C[C@H](CCCCO)Nc1ncnc2cc(Br)ccc12	ZINC000450648488	DG	On-Demand	Anodyne	HTT	0	40
CCc1nc2ccccc2n1C1CCN(Cc2nc(C(=O)OC)cs2)CC1	ZINC000450648503	GH	On-Demand	Anodyne	FPR2	32	47
FC1(F)CC(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)C1	ZINC000450648505	EH	On-Demand	Anodyne	LIPG	40	49
FC1(F)CC(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)C1	ZINC000450648506	EH	On-Demand	Anodyne	LIPG	40	49
COc1cc(NC(=O)C[C@H]2CCOC[C@H]2OC)ccc1OC(C)C	ZINC000450648507	EF	On-Demand	Anodyne	PDEC	0	40
COc1cc(NC(=O)C[C@H]2CCOC[C@@H]2OC)ccc1OC(C)C	ZINC000450648508	EF	On-Demand	Anodyne	PDEC	0	40
COc1cc(NC(=O)C[C@@H]2CCOC[C@@H]2OC)ccc1OC(C)C	ZINC000450648509	EF	On-Demand	Anodyne	PDEC	0	40
COc1cc(NC(=O)C[C@@H]2CCOC[C@H]2OC)ccc1OC(C)C	ZINC000450648510	EF	On-Demand	Anodyne	PDEC	0	40
c1ccc(-c2cc(N3CC[C@H]3C3CC3)n3ncnc3n2)cc1	ZINC000450648521	CF	On-Demand	Anodyne	DHOD	0	40
c1ccc(-c2cc(N3CC[C@@H]3C3CC3)n3ncnc3n2)cc1	ZINC000450648522	CF	On-Demand	Anodyne	DHOD	0	40
CCc1nc2ccccc2n1C1CCN([C@H](C)c2csnn2)CC1	ZINC000450648536	EH	On-Demand	Anodyne	FPR2	29	41
CCc1nc2ccccc2n1C1CCN([C@@H](C)c2csnn2)CC1	ZINC000450648537	EH	On-Demand	Anodyne	FPR2	29	41
CCN(c1ncnc2[nH]ccc12)C1COC1	ZINC000450648541	BD	On-Demand	Anodyne	JAK3	24	53
COc1ccc([N+](=O)[O-])c(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)c1	ZINC000450648544	GD	On-Demand	Bother	CA2	17	44
CN(CCN(C)c1ccc(Cl)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450648553	FD	On-Demand	Anodyne	CA2	28	44
CSCC1CCC(Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CC1	ZINC000450648559	GI	On-Demand	Bother	L3MBTL1	0	42
CSCC1CCC(Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CC1	ZINC000450648559	GI	On-Demand	Bother	L3MBTL3	23	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C#N)n1C	ZINC000450648562	DF	On-Demand	Mild	DRD4	42	32
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C#N)n1C	ZINC000450648562	DF	On-Demand	Mild	NQO2	33	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C#N)n1C	ZINC000450648562	DF	On-Demand	Mild	MTR1B_CHICK	0	52
N#CC1(CSc2nnc(COc3ccccc3F)n2-c2ccccc2)CCC1	ZINC000450648571	GJ	On-Demand	Mild	VCP	63	42
COc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)ccc1OC(C)C	ZINC000450648572	GH	On-Demand	Anodyne	ANPEP	31	42
COc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)ccc1OC(C)C	ZINC000450648572	GH	On-Demand	Anodyne	ENPP1	71	34
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C#N)n1C	ZINC000450648574	DF	On-Demand	Mild	DRD4	42	32
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C#N)n1C	ZINC000450648574	DF	On-Demand	Mild	NQO2	33	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C#N)n1C	ZINC000450648574	DF	On-Demand	Mild	MTR1B_CHICK	0	52
C[C@@H](Sc1nnc(-c2ccncc2)n1C)C(=O)C1CCCCC1	ZINC000450648585	EH	On-Demand	Anodyne	DGAT1	0	40
C[C@H](Sc1nnc(-c2ccncc2)n1C)C(=O)C1CCCCC1	ZINC000450648587	EH	On-Demand	Anodyne	DGAT1	0	40
COC(=O)C1(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)CC1	ZINC000450648592	EE	On-Demand	Anodyne	PDGFRB	43	37
FC(F)(F)Cn1ccc(CSc2ncnc3sc4c(c23)CCC4)n1	ZINC000450648595	FI	On-Demand	Anodyne	RBP4	16	41
COC(=O)c1coc(CN2CCc3cc(F)ccc3C2)n1	ZINC000450648598	CE	On-Demand	Anodyne	ABCB1	0	45
COC(=O)c1coc(CN2CCc3cc(F)ccc3C2)n1	ZINC000450648598	CE	On-Demand	Anodyne	NOD2	40	36
C[C@H](O)CCN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450648613	DE	On-Demand	Anodyne	LIPG	51	52
CCc1cc(N[C@@H]2C[C@@H](C)Oc3ccccc32)n2ncnc2n1	ZINC000450648615	DG	On-Demand	Anodyne	DHOD	0	50
C[C@H](O)CCN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450648616	DE	On-Demand	Anodyne	LIPG	51	52
C[C@@H](O)CCN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450648619	DE	On-Demand	Anodyne	LIPG	51	52
Cc1oc2ccccc2c1CCNC(=O)[C@@H]1CC12CCSCC2	ZINC000450648620	EH	On-Demand	Anodyne	MTNR1A	24	41
Cc1oc2ccccc2c1CCNC(=O)[C@@H]1CC12CCSCC2	ZINC000450648620	EH	On-Demand	Anodyne	MTNR1B	23	41
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	MME	30	49
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	TRY2_BOVIN	49	34
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	CCKAR	23	41
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	CCR3	47	40
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	TIMP3	82	36
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	CCKBR	18	40
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	EPHX2	19	42
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	ST14	84	38
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	TMPRSS6	46	33
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648621	GE	On-Demand	Anodyne	KCNK3	51	34
C[C@@H](O)CCN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450648622	DE	On-Demand	Anodyne	LIPG	51	52
CCc1nc2ccccc2n1C1CCN(CCc2cscn2)CC1	ZINC000450648624	EH	On-Demand	Anodyne	FPR2	28	41
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	MME	30	49
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	TRY2_BOVIN	49	34
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	CCKAR	23	41
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	CCR3	47	40
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	TIMP3	82	36
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	CCKBR	18	40
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	EPHX2	19	42
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	ST14	84	38
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	TMPRSS6	46	33
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450648625	GE	On-Demand	Anodyne	KCNK3	51	34
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)CC1	ZINC000450648629	FE	On-Demand	Anodyne	PREP	23	40
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)CC1	ZINC000450648629	FE	On-Demand	Anodyne	EPHX2	18	49
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)CC1	ZINC000450648629	FE	On-Demand	Anodyne	KCNK3	22	44
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)CC1	ZINC000450648630	FE	On-Demand	Anodyne	PREP	23	40
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)CC1	ZINC000450648630	FE	On-Demand	Anodyne	EPHX2	18	49
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)CC1	ZINC000450648630	FE	On-Demand	Anodyne	KCNK3	22	44
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	TSHR	55	35
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	CPT1A	46	33
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	FLT1	15	41
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	ABCB1B	24	40
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	GRM4	24	41
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	ABCB1	0	42
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	ENPP1	74	35
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	IMDH_CRYPV	20	40
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	KCNK3	39	40
COc1cc(NC(=O)c2ccn(CCc3ccccc3)n2)ccc1OC(C)C	ZINC000450648633	GI	On-Demand	Anodyne	KCNK9	35	40
COC(=O)c1csc(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)n1	ZINC000450648636	GF	On-Demand	Anodyne	LIPG	48	49
COC(=O)c1csc(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)n1	ZINC000450648637	GF	On-Demand	Anodyne	LIPG	48	49
COc1cc(NC(=O)CSC2CC2)ccc1OC(C)C	ZINC000450648639	CG	On-Demand	Anodyne	QRFPR	52	43
COc1cc(NC(=O)CSC2CC2)ccc1OC(C)C	ZINC000450648639	CG	On-Demand	Anodyne	ENPP1	79	45
COC(=O)c1ccc(CN2CCN(C)[C@H](C)[C@@H]2C)cc1Cl	ZINC000450648645	DF	On-Demand	Anodyne	DRD2	24	41
COC(=O)c1ccc(CN2CCN(C)[C@@H](C)[C@H]2C)cc1Cl	ZINC000450648647	DF	On-Demand	Anodyne	DRD2	24	41
Cc1oc2ccccc2c1CCNC(=O)[C@H]1CC12CCSCC2	ZINC000450648648	EH	On-Demand	Anodyne	MTNR1A	24	41
Cc1oc2ccccc2c1CCNC(=O)[C@H]1CC12CCSCC2	ZINC000450648648	EH	On-Demand	Anodyne	MTNR1B	23	41
OC[C@@H]1CC[C@H](Nc2nccc(C(F)F)n2)C1	ZINC000450648649	BD	On-Demand	Anodyne	MAPK1	60	37
COCCN1CCN(CCCC(=O)c2ccc(Br)cc2)CC1=O	ZINC000450648650	GE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)c1ccc(CN2CCN(C)[C@@H](C)[C@@H]2C)cc1Cl	ZINC000450648652	DF	On-Demand	Anodyne	DRD2	24	41
COC(=O)c1ccc(CN2CCN(C)[C@H](C)[C@H]2C)cc1Cl	ZINC000450648655	DF	On-Demand	Anodyne	DRD2	24	41
Cc1ccc(NC(=O)CSC2CC2)cc1NC(=O)CCN(C)C	ZINC000450648657	EF	On-Demand	Anodyne	LDLR	0	44
CN(CCN1CCC(O)(CN2CCOCC2)CC1)Cc1ccccc1	ZINC000450648660	ED	On-Demand	Anodyne	CNR1	0	41
CN(CCN1CCC(O)(CN2CCOCC2)CC1)Cc1ccccc1	ZINC000450648660	ED	On-Demand	Anodyne	CASR	49	38
CN(CCN1CCC(O)(CN2CCOCC2)CC1)Cc1ccccc1	ZINC000450648660	ED	On-Demand	Anodyne	SIGMAR1	40	44
Cc1ccc(NC(=O)N2CCN(CC3CC(F)(F)C3)CC2)cc1	ZINC000450648669	DG	On-Demand	Anodyne	PDGFRB	43	39
CN1CCCC12CCN(CCc1ccc(Cl)cc1)CC2	ZINC000450648671	CG	On-Demand	Anodyne	SIGMAR1	30	47
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648676	GF	On-Demand	Anodyne	P2RY12	203	40
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648676	GF	On-Demand	Anodyne	CTSV	51	35
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648676	GF	On-Demand	Anodyne	AGER	0	40
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648677	GF	On-Demand	Anodyne	P2RY12	203	40
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648677	GF	On-Demand	Anodyne	CTSV	51	35
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450648677	GF	On-Demand	Anodyne	AGER	0	40
CCC(CC)Oc1ccc(C(=O)N[C@@H](C(N)=O)c2ccc(F)cc2)cc1	ZINC000450648688	FG	On-Demand	Anodyne	MTTP	47	36
CCC(CC)Oc1ccc(C(=O)N[C@@H](C(N)=O)c2ccc(F)cc2)cc1	ZINC000450648688	FG	On-Demand	Anodyne	UTS2	42	35
CCC(CC)Oc1ccc(C(=O)N[C@@H](C(N)=O)c2ccc(F)cc2)cc1	ZINC000450648688	FG	On-Demand	Anodyne	LAP	0	43
CCC(CC)Oc1ccc(C(=O)N[C@H](C(N)=O)c2ccc(F)cc2)cc1	ZINC000450648689	FG	On-Demand	Anodyne	MTTP	47	36
CCC(CC)Oc1ccc(C(=O)N[C@H](C(N)=O)c2ccc(F)cc2)cc1	ZINC000450648689	FG	On-Demand	Anodyne	UTS2	42	35
CCC(CC)Oc1ccc(C(=O)N[C@H](C(N)=O)c2ccc(F)cc2)cc1	ZINC000450648689	FG	On-Demand	Anodyne	LAP	0	43
CSCC1CCC(Nc2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450648699	GH	On-Demand	Anodyne	LRRK2	32	40
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450648700	FE	On-Demand	Anodyne	P2RY12	63	38
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450648700	FE	On-Demand	Anodyne	HPGDS	18	40
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450648701	FE	On-Demand	Anodyne	P2RY12	63	38
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450648701	FE	On-Demand	Anodyne	HPGDS	18	40
NC(=O)CCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450648704	EF	On-Demand	Anodyne	BCHE	0	51
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	HTR1A	16	47
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	THRA	0	40
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	DRD4	0	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	HTR2A	22	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	HTR2C	17	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	SLC6A1	83	38
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	HRH1	17	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	CHRM4	15	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	CHRM5	15	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	THRB	0	40
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	HTR7	29	45
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648713	GG	On-Demand	Anodyne	CYP2J2	68	48
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	HTR1A	16	47
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	THRA	0	40
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	DRD4	0	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	HTR2A	22	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	HTR2C	17	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	SLC6A1	83	38
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	HRH1	17	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	CHRM4	15	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	CHRM5	15	50
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	THRB	0	40
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	HTR7	29	45
C[C@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@H](C)O1	ZINC000450648714	GG	On-Demand	Anodyne	CYP2J2	68	48
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	HTR1A	16	47
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	THRA	0	40
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	DRD4	0	50
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	HTR2A	22	50
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	HTR2C	17	50
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	SLC6A1	83	38
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	HRH1	17	50
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	CHRM4	15	50
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	CHRM5	15	50
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	THRB	0	40
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	HTR7	29	45
C[C@@H]1CN(CCOC2CCN(CCCC(=O)c3ccccc3)CC2)C[C@@H](C)O1	ZINC000450648715	GG	On-Demand	Anodyne	CYP2J2	68	48
COc1ccc(C(=O)NCCc2c(C)oc3ccccc23)cc1S(C)(=O)=O	ZINC000450648718	GG	On-Demand	Anodyne	CPT1A	47	33
COc1ccc(C(=O)NCCc2c(C)oc3ccccc23)cc1S(C)(=O)=O	ZINC000450648718	GG	On-Demand	Anodyne	MTNR1A	35	40
COc1ccc(C(=O)NCCc2c(C)oc3ccccc23)cc1S(C)(=O)=O	ZINC000450648718	GG	On-Demand	Anodyne	MTNR1B	30	41
COc1ccc(C(=O)NCCc2c(C)oc3ccccc23)cc1S(C)(=O)=O	ZINC000450648718	GG	On-Demand	Anodyne	BCAT1	0	40
CN(CCN(C)c1c(F)cccc1[N+](=O)[O-])c1ccc(S(N)(=O)=O)cc1	ZINC000450648731	GD	On-Demand	Bother	CA2	15	41
CN(CCN(C)c1c(F)cccc1[N+](=O)[O-])c1ccc(S(N)(=O)=O)cc1	ZINC000450648731	GD	On-Demand	Bother	CA1	18	41
COc1ccccc1COC1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450648732	FF	On-Demand	Anodyne	ADRB1	19	46
FC(F)(F)C[C@@H]1CCCC[C@@H]1Nc1ncnc2[nH]ccc12	ZINC000450648735	CH	On-Demand	Anodyne	JAK1	34	42
C[C@@H](CCCCO)Nc1cncc(SCc2ccccc2)n1	ZINC000450648778	DH	On-Demand	Anodyne	CXCR2	22	45
C[C@@H](CCCCO)Nc1cncc(SCc2ccccc2)n1	ZINC000450648778	DH	On-Demand	Anodyne	CX3CR1	49	35
C[C@H](CCCCO)Nc1cncc(SCc2ccccc2)n1	ZINC000450648781	DH	On-Demand	Anodyne	CXCR2	22	45
C[C@H](CCCCO)Nc1cncc(SCc2ccccc2)n1	ZINC000450648781	DH	On-Demand	Anodyne	CX3CR1	49	35
CCOC(=O)c1sc(Sc2nc(C)nc3[nH]ccc23)nc1C	ZINC000450648782	EG	On-Demand	Anodyne	DHODH	21	41
C=CCn1c(COc2ccc(Cl)cc2)nnc1S[C@@H]1C[C@H](C)CCC1=O	ZINC000450648785	GJ	On-Demand	Mild	VCP	48	38
C=CCn1c(COc2ccc(Cl)cc2)nnc1S[C@H]1C[C@H](C)CCC1=O	ZINC000450648786	GJ	On-Demand	Mild	VCP	48	38
C=CCn1c(COc2ccc(Cl)cc2)nnc1S[C@H]1C[C@@H](C)CCC1=O	ZINC000450648787	GJ	On-Demand	Mild	VCP	48	38
C=CCn1c(COc2ccc(Cl)cc2)nnc1S[C@@H]1C[C@@H](C)CCC1=O	ZINC000450648788	GJ	On-Demand	Mild	VCP	48	38
C[C@@H](CC(F)(F)F)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450648799	EH	On-Demand	Bother	PPXII	0	44
C[C@@H](CC(F)(F)F)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450648799	EH	On-Demand	Bother	AADAC	0	42
C[C@H](CC(F)(F)F)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450648806	EH	On-Demand	Bother	PPXII	0	44
C[C@H](CC(F)(F)F)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450648806	EH	On-Demand	Bother	AADAC	0	42
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	ACE	60	43
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	GHRHR	48	31
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	MME	74	43
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	TACR1	25	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CTSD	34	42
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	MC4R	96	42
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CTRA_BOVIN	53	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	FCER2	45	32
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CTSB	31	44
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	TRY2_BOVIN	92	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	TRY1_BOVIN	48	35
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CYSP_TRYCR	37	46
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CTSG	42	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CACNA1B	37	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	NPFFR2	47	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	TIMP3	40	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	ITGA4	51	35
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	MC3R	46	36
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	MC5R	68	38
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CAPNS1	74	33
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	MMP3	15	50
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CELA2A	50	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	REN	74	51
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CTSS	37	46
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CAPN1	94	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CAPN2	39	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	CTSE	41	37
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	ACE2	76	36
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	PGA5	51	38
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	FPR1	62	36
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	XIAP	33	40
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	Q82323_9DELA	62	30
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	PSMB8	50	38
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	16	44
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648819	FE	On-Demand	Anodyne	BRCA1	64	35
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	ACE	60	43
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	GHRHR	48	31
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	MME	74	43
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	TACR1	25	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CTSD	34	42
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	MC4R	96	42
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CTRA_BOVIN	53	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	FCER2	45	32
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CTSB	31	44
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	TRY2_BOVIN	92	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	TRY1_BOVIN	48	35
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CYSP_TRYCR	37	46
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CTSG	42	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CACNA1B	37	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	NPFFR2	47	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	TIMP3	40	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	ITGA4	51	35
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	MC3R	46	36
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	MC5R	68	38
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CAPNS1	74	33
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	MMP3	15	50
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CELA2A	50	34
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	REN	74	51
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CTSS	37	46
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CAPN1	94	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CAPN2	39	41
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	CTSE	41	37
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	ACE2	76	36
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	PGA5	51	38
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	FPR1	62	36
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	XIAP	33	40
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	Q82323_9DELA	62	30
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	PSMB8	50	38
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	16	44
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450648820	FE	On-Demand	Anodyne	BRCA1	64	35
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCCC1=CCCCCC1	ZINC000450648828	GH	On-Demand	Anodyne	CA5B	22	41
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCCC1=CCCCCC1	ZINC000450648828	GH	On-Demand	Anodyne	CA5A	20	41
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCCC1=CCCCCC1	ZINC000450648828	GH	On-Demand	Anodyne	E1	0	41
CN(C)c1nccc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450648830	FC	On-Demand	Anodyne	CA2	30	44
CN(C)c1nccc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450648830	FC	On-Demand	Anodyne	DKK1	0	48
O=C(c1cccc(NC(=O)C2(C(F)(F)F)CCC2)c1)N1CCC(O)CC1	ZINC000450648836	FF	On-Demand	Anodyne	EPHX2	25	45
O=C(c1cccc(NC(=O)C2(C(F)(F)F)CCC2)c1)N1CCC(O)CC1	ZINC000450648836	FF	On-Demand	Anodyne	L3MBTL1	0	45
O=C(c1cccc(NC(=O)C2(C(F)(F)F)CCC2)c1)N1CCC(O)CC1	ZINC000450648836	FF	On-Demand	Anodyne	L3MBTL3	71	45
O=C(c1cccc(NC(=O)C2(C(F)(F)F)CCC2)c1)N1CCC(O)CC1	ZINC000450648836	FF	On-Demand	Anodyne	MBTD1	0	40
CCN1C[C@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450648837	FH	On-Demand	Anodyne	THRB	45	39
CCN1C[C@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450648837	FH	On-Demand	Anodyne	HDAC8	18	42
CCN1C[C@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450648837	FH	On-Demand	Anodyne	CYP2J2	51	38
CCN1C[C@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450648839	FH	On-Demand	Anodyne	THRB	45	39
CCN1C[C@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450648839	FH	On-Demand	Anodyne	HDAC8	18	42
CCN1C[C@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450648839	FH	On-Demand	Anodyne	CYP2J2	51	38
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450648840	FH	On-Demand	Anodyne	THRB	45	39
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450648840	FH	On-Demand	Anodyne	HDAC8	18	42
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450648840	FH	On-Demand	Anodyne	CYP2J2	51	38
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450648841	FH	On-Demand	Anodyne	THRB	45	39
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450648841	FH	On-Demand	Anodyne	HDAC8	18	42
CCN1C[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450648841	FH	On-Demand	Anodyne	CYP2J2	51	38
COC(=O)c1cc(-c2ccccc2CNC(=O)CCCn2nc(C)nc2C)[nH]n1	ZINC000450648842	GE	On-Demand	Anodyne	HTR7	17	40
COC(=O)c1cc(-c2ccccc2CNC(=O)CCCn2nc(C)nc2C)[nH]n1	ZINC000450648842	GE	On-Demand	Anodyne	MT-CYB	51	34
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450648845	ED	On-Demand	Anodyne	OPRK1	39	43
CCn1nnc(C)c1CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450648848	FH	On-Demand	Anodyne	DRD4	16	43
CCn1nnc(C)c1CN1CCCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450648848	FH	On-Demand	Anodyne	BCL2A1	30	40
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	DRD1	15	47
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	HTR2A	22	50
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	HTR2C	20	50
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	SLC6A1	63	35
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648859	FH	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	DRD1	15	47
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	HTR2A	22	50
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	HTR2C	20	50
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	SLC6A1	63	35
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000450648860	FH	On-Demand	Anodyne	CYP2J2	51	36
COCCOC[C@@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450648861	GE	On-Demand	Anodyne	OPRK1	27	40
COCCOC[C@@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450648861	GE	On-Demand	Anodyne	SIGMAR1	25	56
COCCOC[C@@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450648861	GE	On-Demand	Anodyne	ABCB1	49	46
COCCOC[C@@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450648861	GE	On-Demand	Anodyne	HSP90AB1	38	40
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450648864	FF	On-Demand	Anodyne	NPY2R	30	41
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450648864	FF	On-Demand	Anodyne	RHOA	0	46
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450648864	FF	On-Demand	Anodyne	KCNK3	42	33
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450648865	FF	On-Demand	Anodyne	NPY2R	30	41
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450648865	FF	On-Demand	Anodyne	RHOA	0	46
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450648865	FF	On-Demand	Anodyne	KCNK3	42	33
COCCOC[C@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450648872	GE	On-Demand	Anodyne	OPRK1	27	40
COCCOC[C@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450648872	GE	On-Demand	Anodyne	SIGMAR1	25	56
COCCOC[C@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450648872	GE	On-Demand	Anodyne	ABCB1	49	46
COCCOC[C@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450648872	GE	On-Demand	Anodyne	HSP90AB1	38	40
CCN(CCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1)CC1CC1	ZINC000450648879	GH	On-Demand	Anodyne	ACHE	34	53
CCN(CCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1)CC1CC1	ZINC000450648879	GH	On-Demand	Anodyne	SIGMAR1	16	44
c1cncc(CC2CCN(Cc3nnc(C4CC4)s3)CC2)c1	ZINC000450648881	DG	On-Demand	Anodyne	SIGMAR1	15	44
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC(O)(CN2CCOCC2)CC1	ZINC000450648882	GH	On-Demand	Anodyne	OPRL1	16	45
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC(O)(CN2CCOCC2)CC1	ZINC000450648883	GH	On-Demand	Anodyne	OPRL1	16	45
O=C1CCC(CN2CCN3CCOc4cccc2c43)CC1	ZINC000450648894	CE	On-Demand	Anodyne	HTR1B	0	40
COC(=O)c1cccc(CN(C)CC2CCN(c3ccncc3)CC2)c1Cl	ZINC000450648899	GH	On-Demand	Anodyne	F10	17	40
CCOC(=O)c1sc(Sc2nc(C)ccc2[N+](=O)[O-])nc1C	ZINC000450648915	EG	On-Demand	Bother	GSTM2	24	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	P2RY12	145	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	MC4R	66	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	CYSP_TRYCR	16	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	CYP51A1	22	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	MC5R	40	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	REN	46	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	PGA5	46	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	PSMB8	45	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648916	GC	On-Demand	Anodyne	DERP1	0	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	P2RY12	145	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	MC4R	66	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	CYSP_TRYCR	16	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	CYP51A1	22	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	MC5R	40	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	REN	46	38
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	PGA5	46	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	PSMB8	45	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cn(CC2CC2)nn1	ZINC000450648917	GC	On-Demand	Anodyne	DERP1	0	40
COc1cc(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)ccc1Cl	ZINC000450648919	EH	On-Demand	Anodyne	DRD4	20	40
COc1cc(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)ccc1Cl	ZINC000450648919	EH	On-Demand	Anodyne	SSTR5	50	37
COc1cc(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)ccc1Cl	ZINC000450648920	EH	On-Demand	Anodyne	DRD4	20	40
COc1cc(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)ccc1Cl	ZINC000450648920	EH	On-Demand	Anodyne	SSTR5	50	37
CCS(=O)(=O)c1ccc(CN(CC(=O)OC(C)(C)C)C(C)C)cc1	ZINC000450648926	FG	On-Demand	Anodyne	RORC	23	40
CCOc1nc2ccc(C(=O)Nc3nc4ccccc4n3CCOC)cc2[nH]1	ZINC000450648938	GG	On-Demand	Anodyne	ITK	44	42
CCOc1nc2ccc(C(=O)Nc3nc4ccccc4n3CCOC)cc2[nH]1	ZINC000450648938	GG	On-Demand	Anodyne	PDGFRA	0	43
CCOc1nc2ccc(C(=O)Nc3nc4ccccc4n3CCOC)cc2[nH]1	ZINC000450648938	GG	On-Demand	Anodyne	RPS6KA3	19	43
O[C@@H]1COCCN(c2nc(C3CC3)nc3scc(-c4ccccc4)c23)C1	ZINC000450648946	FG	On-Demand	Anodyne	ADRB3	26	40
O[C@H]1COCCN(c2nc(C3CC3)nc3scc(-c4ccccc4)c23)C1	ZINC000450648947	FG	On-Demand	Anodyne	ADRB3	26	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1	ZINC000450648964	FI	On-Demand	Anodyne	CACNA1B	44	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1	ZINC000450648964	FI	On-Demand	Anodyne	LIPG	52	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](CC(=O)OC(C)C)C1	ZINC000450648969	FI	On-Demand	Anodyne	CACNA1B	44	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](CC(=O)OC(C)C)C1	ZINC000450648969	FI	On-Demand	Anodyne	LIPG	52	39
CCc1cc(NC2(CC)CC2)n2ncnc2n1	ZINC000450648990	BE	On-Demand	Anodyne	DHOD	0	52
CC1(C)OCC[C@H]1Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450648991	GH	On-Demand	Anodyne	PDS	17	65
CC1(C)OCC[C@@H]1Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450648993	GH	On-Demand	Anodyne	PDS	17	65
C[C@@H](NC(=O)C1(CF)CCOCC1)c1ccc(Cl)c2ccccc12	ZINC000450648994	EI	On-Demand	Anodyne	SDH1	0	42
C[C@H](NC(=O)C1(CF)CCOCC1)c1ccc(Cl)c2ccccc12	ZINC000450648996	EI	On-Demand	Anodyne	SDH1	0	42
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@@H]3[C@@H](C)O)ccc21	ZINC000450648999	GG	On-Demand	Anodyne	HTR1A	19	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@@H]3[C@@H](C)O)ccc21	ZINC000450648999	GG	On-Demand	Anodyne	PLK1	45	33
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@@H]3[C@@H](C)O)ccc21	ZINC000450648999	GG	On-Demand	Anodyne	HPGD	59	68
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@@H]3[C@H](C)O)ccc21	ZINC000450649000	GG	On-Demand	Anodyne	HTR1A	19	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@@H]3[C@H](C)O)ccc21	ZINC000450649000	GG	On-Demand	Anodyne	PLK1	45	33
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@@H]3[C@H](C)O)ccc21	ZINC000450649000	GG	On-Demand	Anodyne	HPGD	59	68
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@H]3[C@@H](C)O)ccc21	ZINC000450649002	GG	On-Demand	Anodyne	HTR1A	19	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@H]3[C@@H](C)O)ccc21	ZINC000450649002	GG	On-Demand	Anodyne	PLK1	45	33
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@H]3[C@@H](C)O)ccc21	ZINC000450649002	GG	On-Demand	Anodyne	HPGD	59	68
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@H]3[C@H](C)O)ccc21	ZINC000450649004	GG	On-Demand	Anodyne	HTR1A	19	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@H]3[C@H](C)O)ccc21	ZINC000450649004	GG	On-Demand	Anodyne	PLK1	45	33
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC[C@H]3[C@H](C)O)ccc21	ZINC000450649004	GG	On-Demand	Anodyne	HPGD	59	68
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)O)o1	ZINC000450649032	FG	On-Demand	Anodyne	FKBP1A	48	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)O)o1	ZINC000450649032	FG	On-Demand	Anodyne	COLA	53	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)O)o1	ZINC000450649032	FG	On-Demand	Anodyne	CPT1A	50	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)O)o1	ZINC000450649032	FG	On-Demand	Anodyne	MBTPS1	41	35
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)O)o1	ZINC000450649039	FG	On-Demand	Anodyne	FKBP1A	48	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)O)o1	ZINC000450649039	FG	On-Demand	Anodyne	COLA	53	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)O)o1	ZINC000450649039	FG	On-Demand	Anodyne	CPT1A	50	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)O)o1	ZINC000450649039	FG	On-Demand	Anodyne	MBTPS1	41	35
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@H]2[C@H](C)O)o1	ZINC000450649040	FG	On-Demand	Anodyne	FKBP1A	48	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@H]2[C@H](C)O)o1	ZINC000450649040	FG	On-Demand	Anodyne	COLA	53	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@H]2[C@H](C)O)o1	ZINC000450649040	FG	On-Demand	Anodyne	CPT1A	50	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@H]2[C@H](C)O)o1	ZINC000450649040	FG	On-Demand	Anodyne	MBTPS1	41	35
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)O)o1	ZINC000450649042	FG	On-Demand	Anodyne	FKBP1A	48	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)O)o1	ZINC000450649042	FG	On-Demand	Anodyne	COLA	53	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)O)o1	ZINC000450649042	FG	On-Demand	Anodyne	CPT1A	50	36
COc1ccccc1OCc1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)O)o1	ZINC000450649042	FG	On-Demand	Anodyne	MBTPS1	41	35
CCOC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)nc1	ZINC000450649047	CE	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)nc1	ZINC000450649048	CE	On-Demand	Anodyne	SSTR5	43	36
COC(=O)c1ccc(CN2CC(=O)N(Cc3ccccc3)C2)cc1Cl	ZINC000450649057	FF	On-Demand	Anodyne	SIGMAR1	22	41
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450649066	GJ	On-Demand	Anodyne	MC4R	67	40
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450649066	GJ	On-Demand	Anodyne	PRCP	48	36
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450649067	GJ	On-Demand	Anodyne	MC4R	67	40
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450649067	GJ	On-Demand	Anodyne	PRCP	48	36
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450649068	GJ	On-Demand	Anodyne	MC4R	67	40
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450649068	GJ	On-Demand	Anodyne	PRCP	48	36
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450649069	GJ	On-Demand	Anodyne	MC4R	67	40
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450649069	GJ	On-Demand	Anodyne	PRCP	48	36
CC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450649080	DH	On-Demand	Bother	AR	0	40
CC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450649080	DH	On-Demand	Bother	MMP2	17	42
CC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450649080	DH	On-Demand	Bother	MMP8	34	42
CC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450649080	DH	On-Demand	Bother	MMP9	18	42
CC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450649080	DH	On-Demand	Bother	MMP1	26	42
CC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450649080	DH	On-Demand	Bother	SLC27A4	53	37
CC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000450649080	DH	On-Demand	Bother	LUXR	16	42
C[C@H]1CCN(C(=O)c2cc3n(n2)CCCC3)CC12CCCCC2	ZINC000450649086	DH	On-Demand	Anodyne	L3MBTL3	40	32
C[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)CC12CCCCC2	ZINC000450649088	DH	On-Demand	Anodyne	L3MBTL3	40	32
COC(=O)c1coc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n1	ZINC000450649092	EF	On-Demand	Bother	SLC27A4	49	32
FC1(F)CCC[C@@H]1CSc1nnc(-c2ccccc2)o1	ZINC000450649094	CI	On-Demand	Anodyne	GSK3A	43	43
FC1(F)CCC[C@H]1CSc1nnc(-c2ccccc2)o1	ZINC000450649096	CI	On-Demand	Anodyne	GSK3A	43	43
CC(=O)c1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1	ZINC000450649110	DH	On-Demand	Bother	AR	0	42
CC(=O)c1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1	ZINC000450649110	DH	On-Demand	Bother	COLA	16	41
CC(=O)c1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1	ZINC000450649110	DH	On-Demand	Bother	MMP2	15	40
CC(=O)c1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1	ZINC000450649110	DH	On-Demand	Bother	MMP8	33	40
CC(=O)c1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1	ZINC000450649110	DH	On-Demand	Bother	MMP9	17	40
CC(=O)c1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1	ZINC000450649110	DH	On-Demand	Bother	MMP1	26	40
CC(=O)c1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1	ZINC000450649110	DH	On-Demand	Bother	SLC27A4	42	32
C[C@@H]1CN(CC/C=C\c2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450649111	EG	On-Demand	Anodyne	SLC18A3	17	40
C[C@@H]1CN(CC/C=C\c2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450649112	EG	On-Demand	Anodyne	SLC18A3	17	40
C[C@@H]1CN(CC/C=C/c2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450649113	EG	On-Demand	Anodyne	SLC18A3	17	40
C[C@@H]1CN(CC/C=C/c2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450649114	EG	On-Demand	Anodyne	SLC18A3	17	40
Cc1ccn(CC(=O)NCC(Cc2ccccc2)Cc2ccccc2)n1	ZINC000450649125	EG	On-Demand	Anodyne	MME	40	35
Cc1ccn(CC(=O)NCC(Cc2ccccc2)Cc2ccccc2)n1	ZINC000450649125	EG	On-Demand	Anodyne	CTRC	44	32
CNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450649131	FE	On-Demand	Bother	TAAR1	20	42
CC(=O)N[C@H](C(=O)N[C@@H](C)CC(F)(F)F)C(C)(C)C	ZINC000450649142	CD	On-Demand	Anodyne	PROTEASE	0	50
CC(=O)N[C@H](C(=O)N[C@H](C)CC(F)(F)F)C(C)(C)C	ZINC000450649143	CD	On-Demand	Anodyne	PROTEASE	0	50
C[C@@H](CCCCO)Nc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450649154	DG	On-Demand	Mild	MAP3K8	53	33
C[C@H](CCCCO)Nc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450649155	DG	On-Demand	Mild	MAP3K8	53	33
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	AVPR1B	50	44
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	ELANE	63	46
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	CMA1	44	38
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	CTRA_BOVIN	42	33
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	PDE6D	91	40
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	HDAC8	29	40
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	TACR3	40	33
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	HDAC6	20	41
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	CTRC	52	38
C[C@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649189	FI	On-Demand	Anodyne	IMDH_CRYPV	39	54
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	AVPR1B	50	44
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	ELANE	63	46
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	CMA1	44	38
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	CTRA_BOVIN	42	33
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	PDE6D	91	40
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	HDAC8	29	40
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	TACR3	40	33
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	HDAC6	20	41
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	CTRC	52	38
C[C@@H](CC(F)(F)F)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450649190	FI	On-Demand	Anodyne	IMDH_CRYPV	39	54
CN(CCN(C)C[C@@H](O)C(F)(F)F)Cc1ccccc1	ZINC000450649201	CD	On-Demand	Anodyne	CETP	0	44
CN(CCN(C)C[C@H](O)C(F)(F)F)Cc1ccccc1	ZINC000450649202	CD	On-Demand	Anodyne	CETP	0	44
CCc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)n1	ZINC000450649203	FG	On-Demand	Anodyne	MAPK14	16	42
CCc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)n1	ZINC000450649203	FG	On-Demand	Anodyne	LDLR	0	40
CCc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)n1	ZINC000450649203	FG	On-Demand	Anodyne	BTK	28	45
CCc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)n1	ZINC000450649203	FG	On-Demand	Anodyne	KCNK3	50	35
N#Cc1ccc(N2C[C@H](O)C[C@H]2[C@H]2CCCOC2)cc1C(F)(F)F	ZINC000450649207	EF	On-Demand	Mild	AR	38	41
N#Cc1ccc(N2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)cc1C(F)(F)F	ZINC000450649208	EF	On-Demand	Mild	AR	38	41
N#Cc1ccc(N2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)cc1C(F)(F)F	ZINC000450649209	EF	On-Demand	Mild	AR	38	41
N#Cc1ccc(N2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)cc1C(F)(F)F	ZINC000450649210	EF	On-Demand	Mild	AR	38	41
Cn1c(SC[C@H]2C[C@H]3CC[C@H]2O3)nc2scc(-c3ccccc3)c2c1=O	ZINC000450649211	GI	On-Demand	Anodyne	TGM2	20	43
Cn1c(SC[C@@H]2C[C@H]3CC[C@H]2O3)nc2scc(-c3ccccc3)c2c1=O	ZINC000450649212	GI	On-Demand	Anodyne	TGM2	20	43
Cc1nc(C2CC2)ccc1C(=O)N[C@H](C)CC(F)(F)F	ZINC000450649214	CG	On-Demand	Anodyne	JAK3	15	42
Cc1nc(C2CC2)ccc1C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450649215	CG	On-Demand	Anodyne	JAK3	15	42
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649221	EI	On-Demand	Anodyne	RBP4	88	46
C[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649222	EI	On-Demand	Anodyne	RBP4	88	46
C=CCn1c(SCc2ccc(C(=O)OCC)cn2)nnc1-c1ccoc1C	ZINC000450649232	GH	On-Demand	Mild	HCRTR2	0	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450649238	FI	On-Demand	Anodyne	CSF1R	17	44
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450649238	FI	On-Demand	Anodyne	BTK	27	43
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450649238	FI	On-Demand	Anodyne	TAAR1	29	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450649238	FI	On-Demand	Anodyne	KCNK3	98	50
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C1CC(C)(O)C1	ZINC000450649238	FI	On-Demand	Anodyne	KCNK9	50	50
COc1cccc(OCCC(=O)NCc2nnc(C3CC3)n2C)c1	ZINC000450649240	ED	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)NCc2nnc(C3CC3)n2C)c1	ZINC000450649240	ED	On-Demand	Anodyne	MTNR1A	47	42
COc1cccc(OCCC(=O)NCc2nnc(C3CC3)n2C)c1	ZINC000450649240	ED	On-Demand	Anodyne	MTNR1B	43	42
O=C(NCc1ccc(OCc2ccccc2F)cc1)c1cn(CC2CC2)nn1	ZINC000450649244	GG	On-Demand	Anodyne	GYS1	43	33
CC(=O)[C@](C)(O)CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450649246	ED	On-Demand	Anodyne	LIPG	54	54
CC(=O)[C@@](C)(O)CN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450649247	ED	On-Demand	Anodyne	LIPG	54	54
CC(=O)[C@@](C)(O)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450649248	ED	On-Demand	Anodyne	LIPG	54	54
CC(=O)[C@](C)(O)CN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450649250	ED	On-Demand	Anodyne	LIPG	54	54
COc1cc(NC(=O)CCCC(=O)C2CC2)ccc1OC(C)C	ZINC000450649256	DH	On-Demand	Anodyne	HDAC3	15	41
COc1cc(NC(=O)CCCC(=O)C2CC2)ccc1OC(C)C	ZINC000450649256	DH	On-Demand	Anodyne	ENPP1	64	37
CO[C@@H](CSc1nnc(C)n1-c1ccccc1)Cc1ccccc1	ZINC000450649257	EH	On-Demand	Anodyne	TNKS2	15	44
CO[C@H](CSc1nnc(C)n1-c1ccccc1)Cc1ccccc1	ZINC000450649258	EH	On-Demand	Anodyne	TNKS2	15	44
CCC[C@H](OC)C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450649259	CG	On-Demand	Anodyne	ENPP1	58	37
CCC[C@@H](OC)C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450649260	CG	On-Demand	Anodyne	ENPP1	58	37
Clc1ccc2c(N3CC[C@@H]3C3CC3)ncnc2c1	ZINC000450649261	CG	On-Demand	Anodyne	HNMT	48	34
Clc1ccc2c(N3CC[C@@H]3C3CC3)ncnc2c1	ZINC000450649261	CG	On-Demand	Anodyne	HTT	0	40
Clc1ccc2c(N3CC[C@H]3C3CC3)ncnc2c1	ZINC000450649262	CG	On-Demand	Anodyne	HNMT	48	34
Clc1ccc2c(N3CC[C@H]3C3CC3)ncnc2c1	ZINC000450649262	CG	On-Demand	Anodyne	HTT	0	40
C[C@@H]1CCO[C@@H]1C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450649263	EG	On-Demand	Anodyne	CDC25B	24	41
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450649266	FI	On-Demand	Anodyne	ADAM17	43	38
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450649266	FI	On-Demand	Anodyne	SCN9A	0	43
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450649266	FI	On-Demand	Anodyne	CDC25B	22	40
CCC(=O)CCCN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450649269	EG	On-Demand	Anodyne	CYP2J2	47	34
CCC(=O)CCCN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450649269	EG	On-Demand	Anodyne	LIPG	50	52
CCC(=O)CCCN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450649270	EG	On-Demand	Anodyne	CYP2J2	47	34
CCC(=O)CCCN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000450649270	EG	On-Demand	Anodyne	LIPG	50	52
CCS(=O)(=O)c1ccc(CSc2nnc(C3CC3)n2-c2ccccc2)cc1	ZINC000450649274	GI	On-Demand	Anodyne	ECE1	0	44
CCc1nc2ccccc2n1C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450649291	FI	On-Demand	Anodyne	GRM2	0	48
CCc1nc2ccccc2n1C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450649291	FI	On-Demand	Anodyne	FPR2	28	41
C[C@@H]1C[C@]1(C#N)C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450649293	EH	On-Demand	Mild	ADAM17	60	40
C[C@H]1C[C@]1(C#N)C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450649294	EH	On-Demand	Mild	ADAM17	60	40
C[C@@H]1C[C@@]1(C#N)C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450649295	EH	On-Demand	Mild	ADAM17	60	40
C[C@H]1C[C@@]1(C#N)C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450649296	EH	On-Demand	Mild	ADAM17	60	40
O=C(NCc1ccc(OCc2ccccc2F)cc1)C1(C(=O)C2CC2)CC1	ZINC000450649307	FH	On-Demand	Anodyne	GYS1	62	32
O=[N+]([O-])c1ccc(-c2csc(N[C@H]3CC[C@@H](CO)C3)n2)cc1	ZINC000450649330	DF	On-Demand	Bother	MAOB	21	50
O=[N+]([O-])c1ccc(-c2csc(N[C@H]3CC[C@@H](CO)C3)n2)cc1	ZINC000450649330	DF	On-Demand	Bother	SPHK2	56	36
CC(F)(F)CCSc1ncnc2sc3c(c12)CCC3	ZINC000450649332	DI	On-Demand	Anodyne	RBP4	16	40
Cc1ccc(F)c(CSc2nnc3n2CCCCC3)c1	ZINC000450649339	CH	On-Demand	Anodyne	HSD11B2	21	42
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	DRD4	41	44
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	ACHE	51	57
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	HRH1	28	46
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	DRD3	25	44
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	AVPR1B	43	35
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	HTR4	77	49
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	SIGMAR1	43	41
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	SSTR5	67	41
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	BCHE	0	52
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	CCR3	49	43
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	MCHR1	42	46
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	CACNA1G	25	40
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	CACNA1I	46	42
COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1Cl	ZINC000450649341	DF	On-Demand	Anodyne	CCR8	26	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649344	GG	On-Demand	Anodyne	SIGMAR1	15	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649344	GG	On-Demand	Anodyne	MTR1B_CHICK	0	49
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649344	GG	On-Demand	Anodyne	NPY2R	45	37
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649344	GG	On-Demand	Anodyne	HTR6	42	38
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649344	GG	On-Demand	Anodyne	MTNR1A	38	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649344	GG	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649344	GG	On-Demand	Anodyne	EBP	22	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649345	GG	On-Demand	Anodyne	SIGMAR1	15	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649345	GG	On-Demand	Anodyne	MTR1B_CHICK	0	49
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649345	GG	On-Demand	Anodyne	NPY2R	45	37
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649345	GG	On-Demand	Anodyne	HTR6	42	38
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649345	GG	On-Demand	Anodyne	MTNR1A	38	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649345	GG	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450649345	GG	On-Demand	Anodyne	EBP	22	44
O=C(CC1(O)CCC1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450649352	GH	On-Demand	Anodyne	PRNP	16	41
O=C(CC1(O)CCC1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450649352	GH	On-Demand	Anodyne	LDLR	0	40
O=C(CC1(O)CCC1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450649352	GH	On-Demand	Anodyne	KCNK3	43	44
O=C(CC1(O)CCC1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450649352	GH	On-Demand	Anodyne	KCNK9	19	42
C[C@H](OCCc1ccccc1)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450649361	FG	On-Demand	Anodyne	SMO	56	39
C[C@H](OCCc1ccccc1)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450649361	FG	On-Demand	Anodyne	ETHR	65	42
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450649362	FG	On-Demand	Anodyne	SMO	56	39
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(c2noc(C3CC3)n2)CC1	ZINC000450649362	FG	On-Demand	Anodyne	ETHR	65	42
COC(=O)[C@@H](NC(=O)c1cc(OC)ccc1OC(F)(F)F)[C@H](C)O	ZINC000450649372	FD	On-Demand	Anodyne	KCNK9	26	40
COC(=O)[C@@H](NC(=O)c1cc(OC)ccc1OC(F)(F)F)[C@@H](C)O	ZINC000450649383	FD	On-Demand	Anodyne	KCNK9	26	40
COC(=O)[C@H](NC(=O)c1cc(OC)ccc1OC(F)(F)F)[C@@H](C)O	ZINC000450649385	FD	On-Demand	Anodyne	KCNK9	26	40
COC(=O)[C@H](NC(=O)c1cc(OC)ccc1OC(F)(F)F)[C@H](C)O	ZINC000450649386	FD	On-Demand	Anodyne	KCNK9	26	40
COc1ccc(CNC(=O)CCN(C)CCc2ccncc2)c(OC)c1	ZINC000450649390	FE	On-Demand	Anodyne	PDGFRB	36	40
COc1ccc(CNC(=O)CCN(C)CCc2ccncc2)c(OC)c1	ZINC000450649390	FE	On-Demand	Anodyne	MTNR1A	57	40
COc1ccc(CNC(=O)CCN(C)CCc2ccncc2)c(OC)c1	ZINC000450649390	FE	On-Demand	Anodyne	MTNR1B	48	40
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450649393	EI	On-Demand	Anodyne	F2	34	42
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450649393	EI	On-Demand	Anodyne	LGMN	42	32
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450649393	EI	On-Demand	Anodyne	XIAP	17	40
O=C(NCc1ccc(C(F)F)cc1)[C@@H]1CCCCN1C1CCCC1	ZINC000450649393	EI	On-Demand	Anodyne	TMPRSS11D	67	36
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCCCN1C1CCCC1	ZINC000450649395	EI	On-Demand	Anodyne	F2	34	42
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCCCN1C1CCCC1	ZINC000450649395	EI	On-Demand	Anodyne	LGMN	42	32
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCCCN1C1CCCC1	ZINC000450649395	EI	On-Demand	Anodyne	XIAP	17	40
O=C(NCc1ccc(C(F)F)cc1)[C@H]1CCCCN1C1CCCC1	ZINC000450649395	EI	On-Demand	Anodyne	TMPRSS11D	67	36
CCC(CC)(CCSc1nnc(-c2ccncc2)o1)C(=O)OC	ZINC000450649400	EH	On-Demand	Anodyne	GSK3A	19	43
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H](C)C2)c(OC)c1	ZINC000450649414	EF	On-Demand	Anodyne	HTR7	28	43
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H](C)C2)c(OC)c1	ZINC000450649414	EF	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H](C)C2)c(OC)c1	ZINC000450649414	EF	On-Demand	Anodyne	MTNR1B	44	37
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H](C)C2)c(OC)c1	ZINC000450649416	EF	On-Demand	Anodyne	HTR7	28	43
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H](C)C2)c(OC)c1	ZINC000450649416	EF	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H](C)C2)c(OC)c1	ZINC000450649416	EF	On-Demand	Anodyne	MTNR1B	44	37
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H](C)C2)c(OC)c1	ZINC000450649418	EF	On-Demand	Anodyne	HTR7	28	43
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H](C)C2)c(OC)c1	ZINC000450649418	EF	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H](C)C2)c(OC)c1	ZINC000450649418	EF	On-Demand	Anodyne	MTNR1B	44	37
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H](C)C2)c(OC)c1	ZINC000450649420	EF	On-Demand	Anodyne	HTR7	28	43
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H](C)C2)c(OC)c1	ZINC000450649420	EF	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H](C)C2)c(OC)c1	ZINC000450649420	EF	On-Demand	Anodyne	MTNR1B	44	37
CSCC1CCC(Nc2nccc(C(F)F)n2)CC1	ZINC000450649426	CH	On-Demand	Anodyne	MAPK1	51	33
CCCOc1cccc(CN2C[C@@H](C)[C@@H](O)C2)c1	ZINC000450649437	BE	On-Demand	Anodyne	HRH2	36	43
CCCOc1cccc(CN2C[C@@H](O)[C@H](C)C2)c1	ZINC000450649438	BE	On-Demand	Anodyne	HRH2	36	43
CCOC(=O)c1sc(Sc2nnc(CC)c(CC)n2)nc1C	ZINC000450649440	EG	On-Demand	Anodyne	DHODH	21	41
CCCOc1cccc(CN2C[C@H](C)[C@H](O)C2)c1	ZINC000450649441	BE	On-Demand	Anodyne	HRH2	36	43
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1Cc1ccn(CC(F)(F)F)n1	ZINC000450649442	FH	On-Demand	Anodyne	CACNA1C	0	40
CCCOc1cccc(CN2C[C@H](C)[C@@H](O)C2)c1	ZINC000450649443	BE	On-Demand	Anodyne	HRH2	36	43
C[C@H]1CN(Cc2ccn(CC(F)(F)F)n2)[C@@H](C)CN1Cc1ccccc1	ZINC000450649446	FH	On-Demand	Anodyne	CACNA1C	0	40
C[C@@H]1CN(Cc2ccn(CC(F)(F)F)n2)[C@H](C)CN1Cc1ccccc1	ZINC000450649448	FH	On-Demand	Anodyne	CACNA1C	0	40
C[C@H]1CN(Cc2ccn(CC(F)(F)F)n2)[C@H](C)CN1Cc1ccccc1	ZINC000450649450	FH	On-Demand	Anodyne	CACNA1C	0	40
CN(CC/C=C\c1ccccc1)CCc1ccncc1	ZINC000450649451	CH	On-Demand	Anodyne	NA	0	42
CN(CC/C=C/c1ccccc1)CCc1ccncc1	ZINC000450649453	CH	On-Demand	Anodyne	NA	0	42
COC(=O)C1(O)CCN(Cc2cc(Br)ccc2C)CC1	ZINC000450649455	EE	On-Demand	Anodyne	CCR5	16	43
COc1ccc([C@H](CO)N(C)C(=O)CC2(O)CCC2)cc1	ZINC000450649458	CD	On-Demand	Anodyne	DXR	24	42
COc1ccc([C@@H](CO)N(C)C(=O)CC2(O)CCC2)cc1	ZINC000450649459	CD	On-Demand	Anodyne	DXR	24	42
CC(C)c1nccc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450649465	FD	On-Demand	Anodyne	DKK1	0	43
CCn1c(SCCCCCC(C)=O)nc2ccccc2c1=O	ZINC000450649480	DH	On-Demand	Anodyne	PTGDR2	16	51
COC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450649481	GF	On-Demand	Anodyne	UTS2R	20	40
COC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450649481	GF	On-Demand	Anodyne	MLNR	41	32
COC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)cc1Cl	ZINC000450649481	GF	On-Demand	Anodyne	CXCR3	35	45
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450649483	FG	On-Demand	Anodyne	NPY2R	36	42
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450649483	FG	On-Demand	Anodyne	EPHX2	16	49
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450649483	FG	On-Demand	Anodyne	RHOA	0	46
COC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450649484	GF	On-Demand	Anodyne	UTS2R	20	40
COC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450649484	GF	On-Demand	Anodyne	MLNR	41	32
COC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)cc1Cl	ZINC000450649484	GF	On-Demand	Anodyne	CXCR3	35	45
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450649486	FG	On-Demand	Anodyne	NPY2R	36	42
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450649486	FG	On-Demand	Anodyne	EPHX2	16	49
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450649486	FG	On-Demand	Anodyne	RHOA	0	46
C/C=C\COc1cccc(CC(=O)N[C@@H](CC(F)(F)F)C(=O)OC)c1	ZINC000450649510	FF	On-Demand	Anodyne	PDS	48	33
C/C=C\COc1cccc(CC(=O)N[C@H](CC(F)(F)F)C(=O)OC)c1	ZINC000450649513	FF	On-Demand	Anodyne	PDS	48	33
Cc1cccc(F)c1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450649526	FG	On-Demand	Anodyne	CA5A	45	37
Cc1cccc(F)c1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450649526	FG	On-Demand	Anodyne	RORC	63	40
Cc1ccc(NC(=O)c2cn3nccc3nc2C)cc1NC(=O)CCN(C)C	ZINC000450649527	GE	On-Demand	Anodyne	MAPK14	32	41
Cc1ccc(NC(=O)c2cn3nccc3nc2C)cc1NC(=O)CCN(C)C	ZINC000450649527	GE	On-Demand	Anodyne	DDR1	59	38
COc1ccc([C@@H](CO)N(C)C(=O)Cc2ccc(C)cc2Br)cc1	ZINC000450649533	GH	On-Demand	Anodyne	DXR	32	42
COc1ccc([C@H](CO)N(C)C(=O)Cc2ccc(C)cc2Br)cc1	ZINC000450649534	GH	On-Demand	Anodyne	DXR	32	42
OC1(CN2CCOCC2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450649549	EE	On-Demand	Anodyne	SIGMAR1	19	53
OC1(CN2CCOCC2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450649549	EE	On-Demand	Anodyne	CCR1	40	36
COC(=O)c1ccc2c(c1)CN(Cc1nc(-c3ccc(OC)nn3)no1)CC2	ZINC000450649566	GD	On-Demand	Anodyne	NOD2	40	38
COC(=O)c1ccc2c(c1)CN(C[C@@H](C)S(C)(=O)=O)CC2	ZINC000450649570	DD	On-Demand	Anodyne	NOD2	42	36
COC(=O)c1ccc2c(c1)CN(C[C@H](C)S(C)(=O)=O)CC2	ZINC000450649573	DD	On-Demand	Anodyne	NOD2	42	36
CC(=O)N1CCN(CCN(C)Cc2ccccc2)CC12CCCCC2	ZINC000450649589	EF	On-Demand	Anodyne	SLC12A5	77	40
CCCN(CCc1cccs1)C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450649605	FI	On-Demand	Anodyne	GPR142	40	31
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450649660	FG	On-Demand	Anodyne	RHODESAIN	0	40
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450649660	FG	On-Demand	Anodyne	SFRP1	54	35
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450649660	FG	On-Demand	Anodyne	WNT3	50	33
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450649661	FG	On-Demand	Anodyne	RHODESAIN	0	40
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450649661	FG	On-Demand	Anodyne	SFRP1	54	35
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450649661	FG	On-Demand	Anodyne	WNT3	50	33
Cc1nn(C)cc1CC(=O)NCCc1c(C)oc2ccccc12	ZINC000450649677	DF	On-Demand	Anodyne	P2RX7	40	38
Cc1nn(C)cc1CC(=O)NCCc1c(C)oc2ccccc12	ZINC000450649677	DF	On-Demand	Anodyne	MTNR1B	24	41
Cc1oc2ccccc2c1CCNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450649684	DH	On-Demand	Anodyne	MTNR1A	27	42
Cc1oc2ccccc2c1CCNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450649684	DH	On-Demand	Anodyne	MTNR1B	23	42
CNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450649685	FE	On-Demand	Bother	TAAR1	20	42
CNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450649686	FE	On-Demand	Bother	TAAR1	20	42
CNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450649688	FE	On-Demand	Bother	TAAR1	20	42
C[C@@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649692	EH	On-Demand	Anodyne	RBP4	84	40
C[C@@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649692	EH	On-Demand	Anodyne	SFRP1	54	35
C[C@@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649692	EH	On-Demand	Anodyne	WNT3	61	35
C[C@@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649696	EH	On-Demand	Anodyne	RBP4	84	40
C[C@@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649696	EH	On-Demand	Anodyne	SFRP1	54	35
C[C@@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649696	EH	On-Demand	Anodyne	WNT3	61	35
C[C@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649698	EH	On-Demand	Anodyne	RBP4	84	40
C[C@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649698	EH	On-Demand	Anodyne	SFRP1	54	35
C[C@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450649698	EH	On-Demand	Anodyne	WNT3	61	35
O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450649700	GJ	On-Demand	Anodyne	TRPM8	41	35
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450649702	GJ	On-Demand	Anodyne	TRPM8	41	35
O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450649704	GJ	On-Demand	Anodyne	TRPM8	41	35
C[C@H](CC(F)(F)F)NC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450649735	DJ	On-Demand	Anodyne	KCNJ11	86	37
C[C@@H](CC(F)(F)F)NC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450649736	DJ	On-Demand	Anodyne	KCNJ11	86	37
C[C@H](CC(F)(F)F)NC(=O)c1ccc2cnccc2c1	ZINC000450649759	CG	On-Demand	Anodyne	AKT1	25	47
C[C@H](CC(F)(F)F)NC(=O)c1ccc2cnccc2c1	ZINC000450649759	CG	On-Demand	Anodyne	CYP17A1	21	40
C[C@@H](CC(F)(F)F)NC(=O)c1ccc2cnccc2c1	ZINC000450649761	CG	On-Demand	Anodyne	AKT1	25	47
C[C@@H](CC(F)(F)F)NC(=O)c1ccc2cnccc2c1	ZINC000450649761	CG	On-Demand	Anodyne	CYP17A1	21	40
COc1ccc([C@H](CO)N(C)C(=O)Cc2ccccc2O[C@H]2CCOC2)cc1	ZINC000450649767	GF	On-Demand	Anodyne	PDE4D	15	41
COc1ccc([C@H](CO)N(C)C(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000450649770	GF	On-Demand	Anodyne	PDE4D	15	41
COc1ccc([C@@H](CO)N(C)C(=O)Cc2ccccc2O[C@H]2CCOC2)cc1	ZINC000450649772	GF	On-Demand	Anodyne	PDE4D	15	41
COc1cccc(OCCC(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)c1	ZINC000450649773	GG	On-Demand	Anodyne	MTNR1A	28	45
COc1cccc(OCCC(=O)Nc2ccc(S(C)(=O)=O)c(C(F)F)c2)c1	ZINC000450649773	GG	On-Demand	Anodyne	MTNR1B	29	46
COc1ccc([C@@H](CO)N(C)C(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000450649774	GF	On-Demand	Anodyne	PDE4D	15	41
C[C@@H](O)[C@H]1CCCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450649775	CF	On-Demand	Anodyne	PREP	17	40
C[C@@H](O)[C@@H]1CCCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450649780	CF	On-Demand	Anodyne	PREP	17	40
C[C@H](O)[C@H]1CCCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450649781	CF	On-Demand	Anodyne	PREP	17	40
C[C@H](O)[C@@H]1CCCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450649782	CF	On-Demand	Anodyne	PREP	17	40
CC(C)CCCC(=O)N1CCCC[C@@H]1[C@@H](C)O	ZINC000450649790	BF	On-Demand	Anodyne	PREP	21	40
CNS(=O)(=O)c1ccc(N(C)[C@@H](CC(C)C)C(=O)OC)c([N+](=O)[O-])c1	ZINC000450649791	FD	On-Demand	Bother	COLA	64	35
CC(C)CCCC(=O)N1CCCC[C@H]1[C@@H](C)O	ZINC000450649792	BF	On-Demand	Anodyne	PREP	21	40
CC(C)CCCC(=O)N1CCCC[C@@H]1[C@H](C)O	ZINC000450649793	BF	On-Demand	Anodyne	PREP	21	40
CC(C)CCCC(=O)N1CCCC[C@H]1[C@H](C)O	ZINC000450649794	BF	On-Demand	Anodyne	PREP	21	40
CCC1(CO)CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450649795	EE	On-Demand	Anodyne	MMP13	15	43
CCC1(CO)CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450649795	EE	On-Demand	Anodyne	ADAM17	24	43
CCC1(CO)CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450649795	EE	On-Demand	Anodyne	MCHR2	40	32
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)cn1	ZINC000450649796	EH	On-Demand	Anodyne	HPGDS	35	41
CC(F)(F)c1ccc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)cn1	ZINC000450649798	EH	On-Demand	Anodyne	HPGDS	35	41
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)cn1	ZINC000450649800	EH	On-Demand	Anodyne	HPGDS	35	41
CC(F)(F)c1ccc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)cn1	ZINC000450649802	EH	On-Demand	Anodyne	HPGDS	35	41
COc1ccc(CNC(=O)CCSc2nnc(-c3ccccc3)o2)c(OC)c1	ZINC000450649804	GH	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCSc2nnc(-c3ccccc3)o2)c(OC)c1	ZINC000450649804	GH	On-Demand	Anodyne	MTNR1B	53	36
COc1ccc(CNC(=O)CCSc2nnc(-c3ccccc3)o2)c(OC)c1	ZINC000450649804	GH	On-Demand	Anodyne	ALOX15	40	37
CNS(=O)(=O)c1ccc(N(C)[C@H](CC(C)C)C(=O)OC)c([N+](=O)[O-])c1	ZINC000450649805	FD	On-Demand	Bother	COLA	64	35
COc1cc(NC(=O)[C@@]23CC[C@@H](CC2=O)C3(C)C)ccc1OC(C)C	ZINC000450649806	EH	On-Demand	Anodyne	ENPP1	66	31
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450649809	EF	On-Demand	Anodyne	MTR1B_CHICK	0	60
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccccc1	ZINC000450649810	CH	On-Demand	Anodyne	AOC3	21	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450649811	EF	On-Demand	Anodyne	MTR1B_CHICK	0	60
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccccc1	ZINC000450649812	CH	On-Demand	Anodyne	AOC3	21	40
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccccc1	ZINC000450649814	CH	On-Demand	Anodyne	AOC3	21	40
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccccc1	ZINC000450649815	CH	On-Demand	Anodyne	AOC3	21	40
COc1cc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)ccc1Cl	ZINC000450649833	GG	On-Demand	Anodyne	DRD2	36	40
COc1cc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)ccc1Cl	ZINC000450649833	GG	On-Demand	Anodyne	DRD1	0	40
COc1cc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)ccc1Cl	ZINC000450649833	GG	On-Demand	Anodyne	DRD4	51	41
COc1cc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)ccc1Cl	ZINC000450649833	GG	On-Demand	Anodyne	SIGMAR1	15	40
COc1cc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)ccc1Cl	ZINC000450649833	GG	On-Demand	Anodyne	UTS2R	15	43
COc1cc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)ccc1Cl	ZINC000450649833	GG	On-Demand	Anodyne	NOX1	61	37
COc1cc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)ccc1Cl	ZINC000450649833	GG	On-Demand	Anodyne	NOX5	58	37
COC(=O)c1csc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n1	ZINC000450649891	EG	On-Demand	Bother	SLC27A4	49	32
C[C@H]1CN(CCCC(=O)c2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450649892	EF	On-Demand	Anodyne	DRD4	0	45
C[C@H]1CN(CCCC(=O)c2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450649892	EF	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1CN(CCCC(=O)c2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450649894	EF	On-Demand	Anodyne	DRD4	0	45
C[C@H]1CN(CCCC(=O)c2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450649894	EF	On-Demand	Anodyne	HTR3B	0	43
C[C@@H]1CN(CCCC(=O)c2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450649896	EF	On-Demand	Anodyne	DRD4	0	45
C[C@@H]1CN(CCCC(=O)c2ccccc2)CC[C@@H]1N1CCN(C)CC1	ZINC000450649896	EF	On-Demand	Anodyne	HTR3B	0	43
C[C@@H]1CN(CCCC(=O)c2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450649897	EF	On-Demand	Anodyne	DRD4	0	45
C[C@@H]1CN(CCCC(=O)c2ccccc2)CC[C@H]1N1CCN(C)CC1	ZINC000450649897	EF	On-Demand	Anodyne	HTR3B	0	43
COC[C@@]1(C(=O)Nc2ccc(OC(C)C)c(OC)c2)CCOC1	ZINC000450649905	DE	On-Demand	Anodyne	ENPP1	58	34
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649906	GE	On-Demand	Anodyne	ADRA1D	20	45
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649906	GE	On-Demand	Anodyne	ADRA1A	16	51
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649906	GE	On-Demand	Anodyne	ADRA1B	47	48
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649906	GE	On-Demand	Anodyne	PDE3B	57	34
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649906	GE	On-Demand	Anodyne	EHMT2	48	39
COC[C@]1(C(=O)Nc2ccc(OC(C)C)c(OC)c2)CCOC1	ZINC000450649907	DE	On-Demand	Anodyne	ENPP1	58	34
COc1cc2nc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649909	GE	On-Demand	Anodyne	ADRA1D	20	45
COc1cc2nc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649909	GE	On-Demand	Anodyne	ADRA1A	16	51
COc1cc2nc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649909	GE	On-Demand	Anodyne	ADRA1B	47	48
COc1cc2nc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649909	GE	On-Demand	Anodyne	PDE3B	57	34
COc1cc2nc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649909	GE	On-Demand	Anodyne	EHMT2	48	39
COc1cc2nc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649910	GE	On-Demand	Anodyne	ADRA1D	20	45
COc1cc2nc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649910	GE	On-Demand	Anodyne	ADRA1A	16	51
COc1cc2nc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649910	GE	On-Demand	Anodyne	ADRA1B	47	48
COc1cc2nc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649910	GE	On-Demand	Anodyne	PDE3B	57	34
COc1cc2nc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649910	GE	On-Demand	Anodyne	EHMT2	48	39
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649912	GE	On-Demand	Anodyne	ADRA1D	20	45
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649912	GE	On-Demand	Anodyne	ADRA1A	16	51
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649912	GE	On-Demand	Anodyne	ADRA1B	47	48
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649912	GE	On-Demand	Anodyne	PDE3B	57	34
COc1cc2nc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)nc(N)c2cc1OC	ZINC000450649912	GE	On-Demand	Anodyne	EHMT2	48	39
COc1ccc(-c2csc3ncnc(N[C@H]4CC[C@@H](CO)C4)c23)cc1	ZINC000450649930	FH	On-Demand	Anodyne	ADRB3	25	47
CN(C)S(=O)(=O)c1ccc(N[C@H]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000450649950	ED	On-Demand	Bother	BCL2L1	70	34
COc1cc(NC(=O)CCCC(=O)C(C)(C)C)ccc1OC(C)C	ZINC000450649960	EI	On-Demand	Anodyne	ENPP1	81	38
COc1cc(NC(=O)CCCC(=O)C(C)(C)C)ccc1OC(C)C	ZINC000450649960	EI	On-Demand	Anodyne	ACAT	0	51
CCc1cc(CCCN2CCN(C(=O)Nc3ccc(C)cc3)CC2)on1	ZINC000450649966	FG	On-Demand	Anodyne	PLA2G2A	38	51
CCc1cccc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)n1	ZINC000450649975	DH	On-Demand	Anodyne	PDE5A	29	52
CCc1cccc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)n1	ZINC000450649975	DH	On-Demand	Anodyne	CPT1A	43	29
CCc1nc2ccccc2n1C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450649985	EH	On-Demand	Anodyne	FPR2	28	41
CCc1nc2ccccc2n1C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450649986	EH	On-Demand	Anodyne	FPR2	28	41
COc1cc(NC(=O)c2cc(C)n(C(C)C)n2)ccc1OC(C)C	ZINC000450649997	EH	On-Demand	Anodyne	COLA	41	32
COc1cc(NC(=O)c2cc(C)n(C(C)C)n2)ccc1OC(C)C	ZINC000450649997	EH	On-Demand	Anodyne	GRM4	28	45
COc1cc(NC(=O)c2cc(C)n(C(C)C)n2)ccc1OC(C)C	ZINC000450649997	EH	On-Demand	Anodyne	ENPP1	77	38
COc1cc(NC(=O)CC[C@H]2CCC(=O)N2)ccc1OC(C)C	ZINC000450650015	DE	On-Demand	Anodyne	ENPP1	65	38
COc1cc(NC(=O)CC[C@@H]2CCC(=O)N2)ccc1OC(C)C	ZINC000450650016	DE	On-Demand	Anodyne	ENPP1	65	38
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	LCK	32	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	MAPK14	15	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	HCK	16	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	LYN	22	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	CSF1R	19	43
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	BTK	31	42
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	TAAR1	33	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	KCNK3	111	49
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650017	GK	On-Demand	Anodyne	KCNK9	68	49
COc1cc(CC(=O)N(C)Cc2ncon2)ccc1Cl	ZINC000450650027	CD	On-Demand	Anodyne	OPRK1	15	43
CCOc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)on1	ZINC000450650041	DG	On-Demand	Anodyne	ENPP1	63	38
CCOc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)on1	ZINC000450650041	DG	On-Demand	Anodyne	KCNK3	49	40
CCOc1cc(C(=O)Nc2ccc(OC(C)C)c(OC)c2)on1	ZINC000450650041	DG	On-Demand	Anodyne	KCNK9	41	40
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450650042	GF	On-Demand	Bother	BCL2L1	99	36
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450650042	GF	On-Demand	Bother	BCL2	85	38
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450650043	GF	On-Demand	Bother	BCL2L1	99	36
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450650043	GF	On-Demand	Bother	BCL2	85	38
C=CCN(Cc1ccc(C(C)=O)cc1)C1CC1	ZINC000450650044	BG	On-Demand	Mild	SHC	29	42
C=CCN(Cc1ccc(C(C)=O)cc1)C1CC1	ZINC000450650044	BG	On-Demand	Mild	LSS	23	42
C=CCN(Cc1ccc(C(C)=O)cc1)C1CC1	ZINC000450650044	BG	On-Demand	Mild	ERG7	17	42
C=CCN(Cc1ccc(C(C)=O)cc1)C1CC1	ZINC000450650044	BG	On-Demand	Mild	CAS1	20	42
CCS(=O)(=O)c1ccc(CN2CCC(C)(COC)CC2)cc1	ZINC000450650057	EF	On-Demand	Anodyne	MMP13	16	45
CCS(=O)(=O)c1ccc(CN2CCC(C)(COC)CC2)cc1	ZINC000450650057	EF	On-Demand	Anodyne	ADAM17	25	45
Cc1ccc2c(N[C@H](C)CCCCO)ccnc2n1	ZINC000450650058	CF	On-Demand	Anodyne	RBP_CHICK	0	40
Cc1ccc2c(N[C@@H](C)CCCCO)ccnc2n1	ZINC000450650059	CF	On-Demand	Anodyne	RBP_CHICK	0	40
CCOc1cc(C(=O)NCCc2c(C)oc3ccccc23)on1	ZINC000450650097	DG	On-Demand	Anodyne	THRA	0	44
CCOc1cc(C(=O)NCCc2c(C)oc3ccccc23)on1	ZINC000450650097	DG	On-Demand	Anodyne	THRB	0	44
CCOc1cc(C(=O)NCCc2c(C)oc3ccccc23)on1	ZINC000450650097	DG	On-Demand	Anodyne	MTNR1A	26	40
COCC1(C)CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450650108	CF	On-Demand	Anodyne	SIGMAR1	41	40
COc1ccc(CNC(=O)CCN2CCC[C@H](S(N)(=O)=O)C2)c(OC)c1	ZINC000450650111	GC	On-Demand	Anodyne	HTR4	41	36
COc1ccc(CNC(=O)CCN2CCC[C@H](S(N)(=O)=O)C2)c(OC)c1	ZINC000450650111	GC	On-Demand	Anodyne	MTNR1A	40	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](S(N)(=O)=O)C2)c(OC)c1	ZINC000450650112	GC	On-Demand	Anodyne	HTR4	41	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](S(N)(=O)=O)C2)c(OC)c1	ZINC000450650112	GC	On-Demand	Anodyne	MTNR1A	40	36
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@H]1O	ZINC000450650113	CE	On-Demand	Anodyne	SIGMAR1	42	42
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@H]1O	ZINC000450650113	CE	On-Demand	Anodyne	SLC18A3	25	40
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@H]1O	ZINC000450650114	CE	On-Demand	Anodyne	SIGMAR1	42	42
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@H]1O	ZINC000450650114	CE	On-Demand	Anodyne	SLC18A3	25	40
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@@H]1O	ZINC000450650115	CE	On-Demand	Anodyne	SIGMAR1	42	42
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@@H]1O	ZINC000450650115	CE	On-Demand	Anodyne	SLC18A3	25	40
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@@H]1O	ZINC000450650116	CE	On-Demand	Anodyne	SIGMAR1	42	42
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@@H]1O	ZINC000450650116	CE	On-Demand	Anodyne	SLC18A3	25	40
Cn1c(SCCC2=CCCCC2)nnc1-c1cccnc1	ZINC000450650122	DH	On-Demand	Anodyne	DRD3	0	47
C[C@H](CCCCO)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450650138	CG	On-Demand	Anodyne	UTS2R	29	53
C[C@@H](CCCCO)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450650139	CG	On-Demand	Anodyne	UTS2R	29	53
Cc1oc2ccccc2c1CCNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450650145	EH	On-Demand	Anodyne	MTNR1A	17	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650148	EI	On-Demand	Anodyne	NQO2	43	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650148	EI	On-Demand	Anodyne	MTR1B_CHICK	0	62
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650148	EI	On-Demand	Anodyne	HTR6	44	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650148	EI	On-Demand	Anodyne	PPARD	44	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650148	EI	On-Demand	Anodyne	MTNR1A	50	47
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650148	EI	On-Demand	Anodyne	MTNR1B	46	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650148	EI	On-Demand	Anodyne	EBP	19	48
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650149	EI	On-Demand	Anodyne	NQO2	43	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650149	EI	On-Demand	Anodyne	MTR1B_CHICK	0	62
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650149	EI	On-Demand	Anodyne	HTR6	44	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650149	EI	On-Demand	Anodyne	PPARD	44	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650149	EI	On-Demand	Anodyne	MTNR1A	50	47
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650149	EI	On-Demand	Anodyne	MTNR1B	46	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450650149	EI	On-Demand	Anodyne	EBP	19	48
COC(=O)c1csc(CN2CCC(OCc3ccccc3OC)CC2)n1	ZINC000450650150	GG	On-Demand	Anodyne	SSTR5	43	35
CC(C)c1nnc(CN(Cc2cccnc2)Cc2ccco2)s1	ZINC000450650169	EH	On-Demand	Anodyne	NR1D1	49	38
COc1cc(NC(=O)[C@@]2(C#N)C[C@H]2C)ccc1OC(C)C	ZINC000450650170	CF	On-Demand	Mild	ENPP1	58	34
COc1cc(NC(=O)[C@]2(C#N)C[C@H]2C)ccc1OC(C)C	ZINC000450650171	CF	On-Demand	Mild	ENPP1	58	34
COc1cc(NC(=O)[C@@]2(C#N)C[C@@H]2C)ccc1OC(C)C	ZINC000450650172	CF	On-Demand	Mild	ENPP1	58	34
COc1cc(NC(=O)[C@]2(C#N)C[C@@H]2C)ccc1OC(C)C	ZINC000450650173	CF	On-Demand	Mild	ENPP1	58	34
COc1ccc(CNC(=O)CCN2CCC3(CCCN3C)CC2)c(OC)c1	ZINC000450650179	GE	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC3(CCCN3C)CC2)c(OC)c1	ZINC000450650179	GE	On-Demand	Anodyne	HTR7	26	42
COc1ccc(CNC(=O)CCN2CCC3(CCCN3C)CC2)c(OC)c1	ZINC000450650179	GE	On-Demand	Anodyne	MTNR1A	48	41
COc1ccc(CNC(=O)CCN2CCC3(CCCN3C)CC2)c(OC)c1	ZINC000450650179	GE	On-Demand	Anodyne	MTNR1B	38	41
COc1ccc(CNC(=O)CCN2CCC3(CCCN3C)CC2)c(OC)c1	ZINC000450650179	GE	On-Demand	Anodyne	EBP	27	40
COc1cc(NC(=O)C[C@H]2COc3ccccc3O2)ccc1OC(C)C	ZINC000450650182	FH	On-Demand	Anodyne	ADRA1D	24	42
COc1cc(NC(=O)C[C@H]2COc3ccccc3O2)ccc1OC(C)C	ZINC000450650182	FH	On-Demand	Anodyne	ADRA1A	20	42
COc1cc(NC(=O)C[C@H]2COc3ccccc3O2)ccc1OC(C)C	ZINC000450650182	FH	On-Demand	Anodyne	ADRA1B	18	42
COc1cc(NC(=O)C[C@H]2COc3ccccc3O2)ccc1OC(C)C	ZINC000450650182	FH	On-Demand	Anodyne	ENPP1	61	35
COc1cc(NC(=O)C[C@@H]2COc3ccccc3O2)ccc1OC(C)C	ZINC000450650183	FH	On-Demand	Anodyne	ADRA1D	24	42
COc1cc(NC(=O)C[C@@H]2COc3ccccc3O2)ccc1OC(C)C	ZINC000450650183	FH	On-Demand	Anodyne	ADRA1A	20	42
COc1cc(NC(=O)C[C@@H]2COc3ccccc3O2)ccc1OC(C)C	ZINC000450650183	FH	On-Demand	Anodyne	ADRA1B	18	42
COc1cc(NC(=O)C[C@@H]2COc3ccccc3O2)ccc1OC(C)C	ZINC000450650183	FH	On-Demand	Anodyne	ENPP1	61	35
COc1cc2c(cc1NC(=O)c1ccc(C(F)(F)F)cc1C)NC(=O)CC2	ZINC000450650198	GI	On-Demand	Anodyne	MTTP	51	36
c1ccc(CCn2ccc(CN3CCC(Cc4cccnc4)CC3)n2)cc1	ZINC000450650203	FH	On-Demand	Anodyne	DRD2	0	44
c1ccc(CCn2ccc(CN3CCC(Cc4cccnc4)CC3)n2)cc1	ZINC000450650203	FH	On-Demand	Anodyne	DRD4	15	41
c1ccc(CCn2ccc(CN3CCC(Cc4cccnc4)CC3)n2)cc1	ZINC000450650203	FH	On-Demand	Anodyne	ACHE	31	56
c1ccc(CCn2ccc(CN3CCC(Cc4cccnc4)CC3)n2)cc1	ZINC000450650203	FH	On-Demand	Anodyne	SIGMAR1	49	50
c1cncc(CC2CCN(Cc3cnns3)CC2)c1	ZINC000450650205	CE	On-Demand	Anodyne	SIGMAR1	21	47
c1cncc(CC2CCN(Cc3cnns3)CC2)c1	ZINC000450650205	CE	On-Demand	Anodyne	ACHP_LYMST	21	42
CCOc1ccc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c2ncccc12	ZINC000450650223	GH	On-Demand	Anodyne	PDEC	0	40
CCOc1ccc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c2ncccc12	ZINC000450650225	GH	On-Demand	Anodyne	PDEC	0	40
COc1cc(CC(=O)N2CCN([C@H](C)c3nccs3)CC2)ccc1Cl	ZINC000450650229	GG	On-Demand	Anodyne	OPRK1	33	41
COc1cc(CC(=O)N2CCN([C@H](C)c3nccs3)CC2)ccc1Cl	ZINC000450650229	GG	On-Demand	Anodyne	CCR1	23	44
COc1cc(CC(=O)N2CCN([C@@H](C)c3nccs3)CC2)ccc1Cl	ZINC000450650231	GG	On-Demand	Anodyne	OPRK1	33	41
COc1cc(CC(=O)N2CCN([C@@H](C)c3nccs3)CC2)ccc1Cl	ZINC000450650231	GG	On-Demand	Anodyne	CCR1	23	44
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650237	FG	On-Demand	Anodyne	NPY2R	30	40
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650237	FG	On-Demand	Anodyne	JAK1	0	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650237	FG	On-Demand	Anodyne	EPHX2	20	48
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650237	FG	On-Demand	Anodyne	TYK2	66	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650237	FG	On-Demand	Anodyne	L3MBTL1	0	44
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650237	FG	On-Demand	Anodyne	L3MBTL3	77	44
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650237	FG	On-Demand	Anodyne	KCNK3	82	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650237	FG	On-Demand	Anodyne	KCNK9	51	38
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450650247	FG	On-Demand	Anodyne	EPHX2	15	44
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450650247	FG	On-Demand	Anodyne	RHOA	0	46
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450650249	FG	On-Demand	Anodyne	EPHX2	15	44
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450650249	FG	On-Demand	Anodyne	RHOA	0	46
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450650252	FG	On-Demand	Anodyne	EPHX2	15	44
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450650252	FG	On-Demand	Anodyne	RHOA	0	46
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450650254	FG	On-Demand	Anodyne	EPHX2	15	44
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450650254	FG	On-Demand	Anodyne	RHOA	0	46
CN(CCN(C)c1cncc(C(N)=O)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450650255	FB	On-Demand	Anodyne	CA12	20	40
C1=C(CN(Cc2cccnc2)Cc2ccco2)CCCC1	ZINC000450650270	CI	On-Demand	Anodyne	NR1D1	47	38
CN(CCN(C)c1ccc([N+](=O)[O-])nc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450650276	FD	On-Demand	Bother	CA12	18	43
COc1ccc2c(N3CC[C@@H]3C3CC3)ncnc2c1F	ZINC000450650278	CF	On-Demand	Anodyne	PDE3A	42	33
CN(CCN(C)c1ncccc1S(C)(=O)=O)c1ccc(S(N)(=O)=O)cc1	ZINC000450650279	GC	On-Demand	Anodyne	CA2	22	42
CN(CCN(C)c1ncccc1S(C)(=O)=O)c1ccc(S(N)(=O)=O)cc1	ZINC000450650279	GC	On-Demand	Anodyne	CA12	17	42
COc1ccc2c(N3CC[C@H]3C3CC3)ncnc2c1F	ZINC000450650281	CF	On-Demand	Anodyne	PDE3A	42	33
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450650283	FC	On-Demand	Anodyne	GCK	53	33
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450650283	FC	On-Demand	Anodyne	GCKR	41	36
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450650285	FC	On-Demand	Anodyne	GCK	53	33
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450650285	FC	On-Demand	Anodyne	GCKR	41	36
COC(=O)c1ccc2c(c1)CN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450650303	EF	On-Demand	Anodyne	AGTR2	44	32
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450650304	FG	On-Demand	Anodyne	CTRB_BOVIN	46	34
COC(=O)c1ccc2c(c1)CN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450650306	EF	On-Demand	Anodyne	AGTR2	44	32
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450650307	FG	On-Demand	Anodyne	CTRB_BOVIN	46	34
COC(=O)c1ccc2c(c1)CN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450650309	EF	On-Demand	Anodyne	AGTR2	44	32
NC(=O)[C@@H](NC(=O)c1cccc2c1CCCC2)c1ccc(F)cc1	ZINC000450650310	EF	On-Demand	Anodyne	MTTP	48	32
COC(=O)c1ccc2c(c1)CN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450650311	EF	On-Demand	Anodyne	AGTR2	44	32
NC(=O)[C@H](NC(=O)c1cccc2c1CCCC2)c1ccc(F)cc1	ZINC000450650315	EF	On-Demand	Anodyne	MTTP	48	32
CCCc1cnc(NC(=O)CCOc2cccc(OC)c2)s1	ZINC000450650317	DH	On-Demand	Anodyne	SCD1	0	45
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccccc1	ZINC000450650319	CF	On-Demand	Anodyne	DRD4	0	42
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccccc1	ZINC000450650319	CF	On-Demand	Anodyne	CYP2J2	60	45
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450650320	FF	On-Demand	Anodyne	RHOA	0	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450650320	FF	On-Demand	Anodyne	HPGD	42	38
C[C@H]1[C@H](C)N(CCCC(=O)c2ccccc2)CCN1C	ZINC000450650321	CF	On-Demand	Anodyne	DRD4	0	42
C[C@H]1[C@H](C)N(CCCC(=O)c2ccccc2)CCN1C	ZINC000450650321	CF	On-Demand	Anodyne	CYP2J2	60	45
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450650323	FF	On-Demand	Anodyne	RHOA	0	40
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450650323	FF	On-Demand	Anodyne	HPGD	42	38
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccccc2)CCN1C	ZINC000450650324	CF	On-Demand	Anodyne	DRD4	0	42
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccccc2)CCN1C	ZINC000450650324	CF	On-Demand	Anodyne	CYP2J2	60	45
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccccc2)CCN1C	ZINC000450650327	CF	On-Demand	Anodyne	DRD4	0	42
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccccc2)CCN1C	ZINC000450650327	CF	On-Demand	Anodyne	CYP2J2	60	45
Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450650369	FH	On-Demand	Anodyne	CTSV	47	33
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450650378	FH	On-Demand	Anodyne	CTSV	47	33
COC(=O)c1cnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650380	GG	On-Demand	Anodyne	DRD2	18	50
COC(=O)c1cnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650380	GG	On-Demand	Anodyne	DRD4	45	42
COC(=O)c1cnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650380	GG	On-Demand	Anodyne	ACHE	44	40
COC(=O)c1cnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650380	GG	On-Demand	Anodyne	DRD3	27	42
COC(=O)c1cnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650380	GG	On-Demand	Anodyne	SIGMAR1	59	50
COC(=O)c1cnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650380	GG	On-Demand	Anodyne	SSTR5	52	38
COC(=O)c1cnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650380	GG	On-Demand	Anodyne	MCHR1	29	42
COC(=O)c1cnc(N2CC(C)(C)[C@@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650380	GG	On-Demand	Anodyne	NPFFR1	53	39
COC(=O)c1cnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650385	GG	On-Demand	Anodyne	DRD2	18	50
COC(=O)c1cnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650385	GG	On-Demand	Anodyne	DRD4	45	42
COC(=O)c1cnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650385	GG	On-Demand	Anodyne	ACHE	44	40
COC(=O)c1cnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650385	GG	On-Demand	Anodyne	DRD3	27	42
COC(=O)c1cnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650385	GG	On-Demand	Anodyne	SIGMAR1	59	50
COC(=O)c1cnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650385	GG	On-Demand	Anodyne	SSTR5	52	38
COC(=O)c1cnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650385	GG	On-Demand	Anodyne	MCHR1	29	42
COC(=O)c1cnc(N2CC(C)(C)[C@H]2C2CCN(Cc3ccccc3)CC2)nc1	ZINC000450650385	GG	On-Demand	Anodyne	NPFFR1	53	39
COc1cc(NC(=O)c2c(C3CC3)noc2C)ccc1OC(C)C	ZINC000450650394	EH	On-Demand	Anodyne	ENPP1	67	32
FC(F)(F)c1ccc(O[C@@H]2CCN(Cc3cnn[nH]3)C2)nc1	ZINC000450650418	DD	On-Demand	Anodyne	LIPG	19	48
FC(F)(F)c1ccc(O[C@H]2CCN(Cc3cnn[nH]3)C2)nc1	ZINC000450650420	DD	On-Demand	Anodyne	LIPG	19	48
CCOc1cc(C(=O)N2CCCC[C@@H]2[C@@H](C)O)on1	ZINC000450650425	CD	On-Demand	Anodyne	CPT1A	64	35
CC(C)CCCC(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	ZINC000450650435	FI	On-Demand	Anodyne	LTA4H	15	42
COc1cccc(OCCC(=O)N(C)Cc2noc(C)n2)c1	ZINC000450650443	DD	On-Demand	Anodyne	MTNR1A	25	43
CCOc1cc(C(=O)N2CCCC[C@H]2[C@H](C)O)on1	ZINC000450650450	CD	On-Demand	Anodyne	CPT1A	64	35
CCOc1cc(C(=O)N2CCCC[C@@H]2[C@H](C)O)on1	ZINC000450650454	CD	On-Demand	Anodyne	CPT1A	64	35
CCOc1cc(C(=O)N2CCCC[C@H]2[C@@H](C)O)on1	ZINC000450650460	CD	On-Demand	Anodyne	CPT1A	64	35
CCOCc1nc(C)c(C(=O)N2CCc3c(-c4ccccc4)cccc32)s1	ZINC000450650461	GJ	On-Demand	Anodyne	DHODH	17	40
CCOC(=O)c1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1	ZINC000450650464	FG	On-Demand	Bother	SLC27A4	55	36
Cc1nc(C)n(CCCC(=O)NCc2cccc(-c3cccnc3)c2)n1	ZINC000450650485	EG	On-Demand	Anodyne	SUCNR1	41	38
O=C([C@@H]1CC12CCN(CCc1ccc(Cl)cc1)CC2)N1CCCCC1	ZINC000450650508	FH	On-Demand	Anodyne	HRH3	15	63
O=C([C@@H]1CC12CCN(CCc1ccc(Cl)cc1)CC2)N1CCCCC1	ZINC000450650508	FH	On-Demand	Anodyne	SIGMAR1	20	42
O=C([C@H]1CC12CCN(CCc1ccc(Cl)cc1)CC2)N1CCCCC1	ZINC000450650519	FH	On-Demand	Anodyne	HRH3	15	63
O=C([C@H]1CC12CCN(CCc1ccc(Cl)cc1)CC2)N1CCCCC1	ZINC000450650519	FH	On-Demand	Anodyne	SIGMAR1	20	42
CC(F)(F)c1ccc(C(=O)N2CCN(c3ccccc3)C(=O)C2)cn1	ZINC000450650578	EF	On-Demand	Anodyne	P2RX7	25	42
COc1cc(CC(=O)N2CCN(c3cccc(F)c3)C(=O)C2)ccc1O	ZINC000450650590	FD	On-Demand	Anodyne	MLNR	22	46
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	HTR1A	23	67
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	DRD2	35	50
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	FKBP1A	21	43
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	DRD4	33	44
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	ACHE	40	61
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	HTR2A	32	54
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	HTR2C	16	52
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	HRH1	22	44
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	DRD3	17	44
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	GRIN2B	74	50
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	TBXAS1	75	43
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	PTAFR	28	43
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	HTR7	25	43
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	HRH3	19	47
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	SIGMAR1	63	54
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	NPY1R	17	42
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	NPY2R	43	39
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	CCR3	49	54
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	CCR5	20	42
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	CHRNA7	55	48
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	C3AR1	41	42
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	PREP	44	37
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	FAAH	79	44
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	ABCB1	0	44
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	CES1	61	38
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	CYP2J2	69	48
O=C(CCCN1CCC(Cc2cccnc2)CC1)c1ccccc1	ZINC000450650616	DH	On-Demand	Anodyne	ACHP_LYMST	35	48
CC(C)N(C[C@@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450650618	BG	On-Demand	Anodyne	AOC3	25	44
C[C@H]1CN(Cc2ccccc2OC2CC2)CC[C@H]1N1CCN(C)CC1	ZINC000450650630	EF	On-Demand	Anodyne	SLC18A3	22	41
C[C@H]1CN(Cc2ccccc2OC2CC2)CC[C@@H]1N1CCN(C)CC1	ZINC000450650631	EF	On-Demand	Anodyne	SLC18A3	22	41
C[C@@H]1CN(Cc2ccccc2OC2CC2)CC[C@@H]1N1CCN(C)CC1	ZINC000450650632	EF	On-Demand	Anodyne	SLC18A3	22	41
C[C@@H]1CN(Cc2ccccc2OC2CC2)CC[C@H]1N1CCN(C)CC1	ZINC000450650634	EF	On-Demand	Anodyne	SLC18A3	22	41
CCc1nc(C)c(CSc2nnc(-c3ccccc3)o2)o1	ZINC000450650635	DH	On-Demand	Anodyne	GSK3B	17	49
CCc1nc(C)c(CSc2nnc(-c3ccccc3)o2)o1	ZINC000450650635	DH	On-Demand	Anodyne	GSK3A	49	49
CCc1nc(C)c(CSc2nnc(-c3ccccc3)o2)o1	ZINC000450650635	DH	On-Demand	Anodyne	TERT	25	41
C[C@H](O)CCN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450650639	DF	On-Demand	Anodyne	SIGMAR1	74	42
C[C@H](O)CCN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450650639	DF	On-Demand	Anodyne	NPFFR1	47	34
C[C@@H](O)CCN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450650640	DF	On-Demand	Anodyne	SIGMAR1	74	42
C[C@@H](O)CCN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450650640	DF	On-Demand	Anodyne	NPFFR1	47	34
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450650642	FG	On-Demand	Anodyne	SORT1	15	43
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450650642	FG	On-Demand	Anodyne	MTTP	43	32
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450650642	FG	On-Demand	Anodyne	CCR2	29	43
CCOc1ccc(CN(CCCn2ccnc2)CC2CC(F)(F)C2)cc1	ZINC000450650656	FI	On-Demand	Anodyne	QPCT	18	44
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450650658	FG	On-Demand	Anodyne	SORT1	15	43
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450650658	FG	On-Demand	Anodyne	MTTP	43	32
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450650658	FG	On-Demand	Anodyne	CCR2	29	43
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450650659	EE	On-Demand	Anodyne	P2RY12	59	34
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450650660	EE	On-Demand	Anodyne	P2RY12	59	34
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450650661	EE	On-Demand	Anodyne	P2RY12	59	34
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450650662	EE	On-Demand	Anodyne	P2RY12	59	34
C[C@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450650686	CF	On-Demand	Anodyne	NCE103	24	42
C[C@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450650686	CF	On-Demand	Anodyne	CAN2	0	42
C[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450650687	CF	On-Demand	Anodyne	NCE103	24	42
C[C@@H](CC(F)(F)F)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450650687	CF	On-Demand	Anodyne	CAN2	0	42
CC(=O)c1cccc(CN2CCC(OCCN3C[C@H](C)O[C@H](C)C3)CC2)c1	ZINC000450650714	FF	On-Demand	Anodyne	PRSS2	43	30
CC(=O)c1cccc(CN2CCC(OCCN3C[C@H](C)O[C@H](C)C3)CC2)c1	ZINC000450650714	FF	On-Demand	Anodyne	SIGMAR1	26	41
CC(=O)c1cccc(CN2CCC(OCCN3C[C@H](C)O[C@H](C)C3)CC2)c1	ZINC000450650714	FF	On-Demand	Anodyne	CCR3	21	40
CC(=O)c1cccc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)c1	ZINC000450650715	FF	On-Demand	Anodyne	PRSS2	43	30
CC(=O)c1cccc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)c1	ZINC000450650715	FF	On-Demand	Anodyne	SIGMAR1	26	41
CC(=O)c1cccc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)c1	ZINC000450650715	FF	On-Demand	Anodyne	CCR3	21	40
CC(=O)c1cccc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)c1	ZINC000450650716	FF	On-Demand	Anodyne	PRSS2	43	30
CC(=O)c1cccc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)c1	ZINC000450650716	FF	On-Demand	Anodyne	SIGMAR1	26	41
CC(=O)c1cccc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)c1	ZINC000450650716	FF	On-Demand	Anodyne	CCR3	21	40
CCOc1ccc(CN(CCCn2ccnc2)Cc2cccc(C)n2)cc1	ZINC000450650723	FI	On-Demand	Anodyne	QPCT	15	44
COc1cc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])ccc1OC(C)C	ZINC000450650758	GJ	On-Demand	Bother	MTTP	44	38
COc1cc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])ccc1OC(C)C	ZINC000450650758	GJ	On-Demand	Bother	ENPP1	48	29
COc1cc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])ccc1OC(C)C	ZINC000450650758	GJ	On-Demand	Bother	PPXII	0	42
COc1cc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])ccc1OC(C)C	ZINC000450650758	GJ	On-Demand	Bother	KCNK3	52	41
COc1cc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])ccc1OC(C)C	ZINC000450650758	GJ	On-Demand	Bother	KCNK9	44	41
COc1cc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])ccc1OC(C)C	ZINC000450650758	GJ	On-Demand	Bother	AADAC	0	45
CCc1nc2ccccc2n1C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450650770	EJ	On-Demand	Anodyne	FPR2	29	41
CCc1nc2ccccc2n1C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450650771	EJ	On-Demand	Anodyne	FPR2	29	41
COc1cc2c(cc1NC(=O)c1ccc(C(C)(F)F)nc1)NC(=O)CC2	ZINC000450650772	FG	On-Demand	Anodyne	PKM	40	37
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650776	GG	On-Demand	Bother	COLA	81	34
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650776	GG	On-Demand	Bother	MTNN	64	35
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650776	GG	On-Demand	Bother	BCL2L1	122	40
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650776	GG	On-Demand	Bother	BCL2	105	39
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650776	GG	On-Demand	Bother	BCL2L2	50	35
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650776	GG	On-Demand	Bother	LIMK2	43	35
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650777	GG	On-Demand	Bother	COLA	81	34
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650777	GG	On-Demand	Bother	MTNN	64	35
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650777	GG	On-Demand	Bother	BCL2L1	122	40
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650777	GG	On-Demand	Bother	BCL2	105	39
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650777	GG	On-Demand	Bother	BCL2L2	50	35
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450650777	GG	On-Demand	Bother	LIMK2	43	35
COc1cc(NC(=O)c2scnc2C(C)C)ccc1OC(C)C	ZINC000450650783	EI	On-Demand	Anodyne	GRM4	19	40
COc1cc(NC(=O)c2scnc2C(C)C)ccc1OC(C)C	ZINC000450650783	EI	On-Demand	Anodyne	ENPP1	75	36
COc1cc(NC(=O)c2scnc2C(C)C)ccc1OC(C)C	ZINC000450650783	EI	On-Demand	Anodyne	KCNK3	40	40
COc1cc(NC(=O)c2scnc2C(C)C)ccc1OC(C)C	ZINC000450650783	EI	On-Demand	Anodyne	KCNK9	35	40
CSc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c1	ZINC000450650808	FH	On-Demand	Anodyne	MAPK14	25	47
CSc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c1	ZINC000450650808	FH	On-Demand	Anodyne	LDLR	0	46
CSc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c1	ZINC000450650808	FH	On-Demand	Anodyne	BTK	26	47
CSc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c1	ZINC000450650808	FH	On-Demand	Anodyne	KCNK3	86	42
CSc1cccc(C(=O)Nc2ccc(C)c(NC(=O)CCN(C)C)c2)c1	ZINC000450650808	FH	On-Demand	Anodyne	KCNK9	52	42
COc1cc(CN2CCC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650810	DD	On-Demand	Anodyne	DRD4	24	41
COc1cc(CN2CCC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650810	DD	On-Demand	Anodyne	DRD3	0	46
COc1cc(CN2CCC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650810	DD	On-Demand	Anodyne	AVPR1B	42	35
COc1cc(CN2CCC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650810	DD	On-Demand	Anodyne	HTR4	51	35
COc1cc(CN2CCC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650810	DD	On-Demand	Anodyne	SSTR5	49	41
COc1cc(CN2CCC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650810	DD	On-Demand	Anodyne	CCR1	26	41
COc1cc(CN2CCC[C@@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650810	DD	On-Demand	Anodyne	UTS2R	33	45
COc1cc(CN2CCC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650811	DD	On-Demand	Anodyne	DRD4	24	41
COc1cc(CN2CCC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650811	DD	On-Demand	Anodyne	DRD3	0	46
COc1cc(CN2CCC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650811	DD	On-Demand	Anodyne	AVPR1B	42	35
COc1cc(CN2CCC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650811	DD	On-Demand	Anodyne	HTR4	51	35
COc1cc(CN2CCC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650811	DD	On-Demand	Anodyne	SSTR5	49	41
COc1cc(CN2CCC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650811	DD	On-Demand	Anodyne	CCR1	26	41
COc1cc(CN2CCC[C@H](S(N)(=O)=O)C2)ccc1Cl	ZINC000450650811	DD	On-Demand	Anodyne	UTS2R	33	45
C=CCn1c(SC[C@H](Cc2ccccc2)OC)nnc1-c1ccoc1C	ZINC000450650822	FI	On-Demand	Mild	HCRTR2	19	40
C=CCn1c(SC[C@@H](Cc2ccccc2)OC)nnc1-c1ccoc1C	ZINC000450650823	FI	On-Demand	Mild	HCRTR2	19	40
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450650840	EI	On-Demand	Anodyne	MC4R	15	40
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450650840	EI	On-Demand	Anodyne	MC3R	30	40
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450650840	EI	On-Demand	Anodyne	MC5R	26	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450650841	EI	On-Demand	Anodyne	MC4R	15	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450650841	EI	On-Demand	Anodyne	MC3R	30	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450650841	EI	On-Demand	Anodyne	MC5R	26	40
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450650842	EI	On-Demand	Anodyne	MC4R	15	40
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450650842	EI	On-Demand	Anodyne	MC3R	30	40
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450650842	EI	On-Demand	Anodyne	MC5R	26	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450650843	EI	On-Demand	Anodyne	MC4R	15	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450650843	EI	On-Demand	Anodyne	MC3R	30	40
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450650843	EI	On-Demand	Anodyne	MC5R	26	40
Cc1ccc(NC(=O)[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1NC(=O)CCN(C)C	ZINC000450650854	FH	On-Demand	Anodyne	LDLR	0	41
Cc1ccc(NC(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)cc1NC(=O)CCN(C)C	ZINC000450650855	FH	On-Demand	Anodyne	LDLR	0	41
Cc1ccc(NC(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1NC(=O)CCN(C)C	ZINC000450650856	FH	On-Demand	Anodyne	LDLR	0	41
Cc1ccc(NC(=O)[C@@H]2CC[C@H](C)[C@H](C)C2)cc1NC(=O)CCN(C)C	ZINC000450650857	FH	On-Demand	Anodyne	LDLR	0	41
CCN(CCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1)CC(C)C	ZINC000450650863	GI	On-Demand	Anodyne	ACHE	27	54
CC[C@@H]1C[C@H]1C(=O)NCCc1c(C)oc2ccccc12	ZINC000450650868	CG	On-Demand	Anodyne	MTNR1A	34	43
CC[C@@H]1C[C@H]1C(=O)NCCc1c(C)oc2ccccc12	ZINC000450650868	CG	On-Demand	Anodyne	MTNR1B	29	43
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	MME	41	36
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	SDH1	0	44
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	KLK3	40	30
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	PAPA1_CARPA	43	33
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	CYSP_TRYCR	67	34
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	CAPNS1	48	33
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	CAPN1	58	37
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	CAPN2	86	36
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	ACE2	43	34
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450650869	DG	On-Demand	Anodyne	NPR	59	33
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	MME	41	36
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	SDH1	0	44
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	KLK3	40	30
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	PAPA1_CARPA	43	33
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	CYSP_TRYCR	67	34
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	CAPNS1	48	33
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	CAPN1	58	37
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	CAPN2	86	36
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	ACE2	43	34
C[C@@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650870	DG	On-Demand	Anodyne	NPR	59	33
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	MME	41	36
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	SDH1	0	44
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	KLK3	40	30
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	PAPA1_CARPA	43	33
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	CYSP_TRYCR	67	34
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	CAPNS1	48	33
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	CAPN1	58	37
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	CAPN2	86	36
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	ACE2	43	34
C[C@@H](CC(F)(F)F)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450650871	DG	On-Demand	Anodyne	NPR	59	33
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	MME	41	36
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	SDH1	0	44
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	KLK3	40	30
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	PAPA1_CARPA	43	33
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	CYSP_TRYCR	67	34
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	CAPNS1	48	33
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	CAPN1	58	37
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	CAPN2	86	36
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	ACE2	43	34
C[C@H](CC(F)(F)F)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450650872	DG	On-Demand	Anodyne	NPR	59	33
C[C@H](CC(F)(F)F)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450650873	EF	On-Demand	Anodyne	ELANE	29	40
C[C@@H](CC(F)(F)F)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450650874	EF	On-Demand	Anodyne	ELANE	29	40
COCC1(C)CCN(Cc2cccc(C(=O)OC)c2Cl)CC1	ZINC000450650879	EG	On-Demand	Anodyne	NPFFR1	42	37
COc1ccc(CNC(=O)CCN(C)C[C@H](O)C(F)(F)F)c(OC)c1	ZINC000450650881	FD	On-Demand	Anodyne	MTNR1A	51	37
COC[C@]1(C(=O)NCC(Cc2ccccc2)Cc2ccccc2)CCOC1	ZINC000450650896	FG	On-Demand	Anodyne	TIMP3	60	35
COC[C@@]1(C(=O)NCC(Cc2ccccc2)Cc2ccccc2)CCOC1	ZINC000450650897	FG	On-Demand	Anodyne	TIMP3	60	35
COc1ccc(CNC(=O)CCN(C)C[C@@H](O)C(F)(F)F)c(OC)c1	ZINC000450650904	FD	On-Demand	Anodyne	MTNR1A	51	37
COC1(CSc2nnc(-c3ccccc3)n2C)CCC1	ZINC000450650915	CG	On-Demand	Anodyne	DRD3	18	40
CC(C)(C(=O)NCc1cccc(-c2cccnc2)c1)C1CCC1	ZINC000450650949	DI	On-Demand	Anodyne	CYP11B2	48	36
CC(C)(C(=O)NCc1cccc(-c2cccnc2)c1)C1CCC1	ZINC000450650949	DI	On-Demand	Anodyne	NAMPT	43	36
C[C@H](c1ccccc1)[C@@H](O)CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000450650956	EG	On-Demand	Anodyne	AMY2	48	34
C[C@H](c1ccccc1)[C@@H](O)CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000450650956	EG	On-Demand	Anodyne	REN	46	37
C[C@@H](c1ccccc1)[C@@H](O)CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000450650957	EG	On-Demand	Anodyne	AMY2	48	34
C[C@@H](c1ccccc1)[C@@H](O)CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000450650957	EG	On-Demand	Anodyne	REN	46	37
C[C@@H](c1ccccc1)[C@H](O)CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000450650958	EG	On-Demand	Anodyne	AMY2	48	34
C[C@@H](c1ccccc1)[C@H](O)CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000450650958	EG	On-Demand	Anodyne	REN	46	37
C[C@H](c1ccccc1)[C@H](O)CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000450650959	EG	On-Demand	Anodyne	AMY2	48	34
C[C@H](c1ccccc1)[C@H](O)CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000450650959	EG	On-Demand	Anodyne	REN	46	37
CC(C)O[C@@H]1C[C@@H](NC(=O)Cc2ccccc2O[C@@H]2CCOC2)C1(C)C	ZINC000450650960	FG	On-Demand	Anodyne	PDE4D	15	42
CC(C)O[C@@H]1C[C@H](NC(=O)Cc2ccccc2O[C@@H]2CCOC2)C1(C)C	ZINC000450650961	FG	On-Demand	Anodyne	PDE4D	15	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650962	EG	On-Demand	Anodyne	NQO2	43	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650962	EG	On-Demand	Anodyne	MTR1B_CHICK	0	63
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650962	EG	On-Demand	Anodyne	HTR6	38	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650962	EG	On-Demand	Anodyne	PPARD	48	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650962	EG	On-Demand	Anodyne	MTNR1B	42	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650962	EG	On-Demand	Anodyne	EBP	22	51
CC(C)N(C[C@@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450650963	BG	On-Demand	Anodyne	AOC3	25	44
CC(C)N(C[C@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450650964	BG	On-Demand	Anodyne	AOC3	25	44
CC(C)N(C[C@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450650965	BG	On-Demand	Anodyne	AOC3	25	44
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650968	FE	On-Demand	Anodyne	EPHX2	16	45
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450650969	FE	On-Demand	Anodyne	EPHX2	16	45
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650970	EF	On-Demand	Anodyne	RHOA	0	40
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450650970	EF	On-Demand	Anodyne	L3MBTL1	0	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650976	EG	On-Demand	Anodyne	NQO2	43	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650976	EG	On-Demand	Anodyne	MTR1B_CHICK	0	63
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650976	EG	On-Demand	Anodyne	HTR6	38	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650976	EG	On-Demand	Anodyne	PPARD	48	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650976	EG	On-Demand	Anodyne	MTNR1B	42	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCC(=O)C1CC1	ZINC000450650976	EG	On-Demand	Anodyne	EBP	22	51
CC(C)O[C@@H]1C[C@@H](NC(=O)Cc2ccccc2O[C@H]2CCOC2)C1(C)C	ZINC000450650978	FG	On-Demand	Anodyne	PDE4D	15	42
CC(C)O[C@@H]1C[C@H](NC(=O)Cc2ccccc2O[C@H]2CCOC2)C1(C)C	ZINC000450650979	FG	On-Demand	Anodyne	PDE4D	15	42
OC[C@@]1(F)CN(c2nc(-c3ccccc3)ns2)C[C@@H]1c1ccccc1	ZINC000450650981	FH	On-Demand	Anodyne	FAAH	0	42
OC[C@@]1(F)CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccccc1	ZINC000450650982	FH	On-Demand	Anodyne	FAAH	0	42
OC[C@]1(F)CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccccc1	ZINC000450650983	FH	On-Demand	Anodyne	FAAH	0	42
OC[C@]1(F)CN(c2nc(-c3ccccc3)ns2)C[C@@H]1c1ccccc1	ZINC000450650984	FH	On-Demand	Anodyne	FAAH	0	42
CCOC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)nc1	ZINC000450650991	DF	On-Demand	Anodyne	NOD1	29	46
CCOC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)nc1	ZINC000450650991	DF	On-Demand	Anodyne	NOD2	45	46
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450650993	EI	On-Demand	Anodyne	CARM1	52	34
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450650993	EI	On-Demand	Anodyne	HAO2	16	40
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450650993	EI	On-Demand	Anodyne	PDS	56	35
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450650995	EI	On-Demand	Anodyne	CARM1	52	34
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450650995	EI	On-Demand	Anodyne	HAO2	16	40
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450650995	EI	On-Demand	Anodyne	PDS	56	35
CCCc1cnc(NC(=O)c2c(C)cccc2Cl)s1	ZINC000450651014	CI	On-Demand	Anodyne	LCK	37	44
CCCc1cnc(NC(=O)c2c(C)cccc2Cl)s1	ZINC000450651014	CI	On-Demand	Anodyne	FYN	36	41
CCCc1cnc(NC(=O)c2c(C)cccc2Cl)s1	ZINC000450651014	CI	On-Demand	Anodyne	CDK5	17	42
CCCc1cnc(NC(=O)c2c(C)cccc2Cl)s1	ZINC000450651014	CI	On-Demand	Anodyne	FGR	20	41
C=CCC1(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCCC1	ZINC000450651027	FG	On-Demand	Mild	L3MBTL1	0	40
C=CCC1(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCCC1	ZINC000450651027	FG	On-Demand	Mild	L3MBTL3	51	40
C=CCC1(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCCC1	ZINC000450651027	FG	On-Demand	Mild	MBTD1	0	41
CCc1cc(N2CCOC[C@H](O)C2)nc(-c2ccccn2)n1	ZINC000450651033	DD	On-Demand	Anodyne	METAP1	29	43
CCc1cc(N2CCOC[C@@H](O)C2)nc(-c2ccccn2)n1	ZINC000450651035	DD	On-Demand	Anodyne	METAP1	29	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@@H]1[C@@H](C)O	ZINC000450651064	DG	On-Demand	Anodyne	CACNA1B	47	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@@H]1[C@@H](C)O	ZINC000450651064	DG	On-Demand	Anodyne	LIPG	43	34
CC[C@@H](O)CC(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	ZINC000450651065	FC	On-Demand	Anodyne	PKM	29	46
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@H]1[C@H](C)O	ZINC000450651067	DG	On-Demand	Anodyne	CACNA1B	47	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@H]1[C@H](C)O	ZINC000450651067	DG	On-Demand	Anodyne	LIPG	43	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@H]1[C@@H](C)O	ZINC000450651068	DG	On-Demand	Anodyne	CACNA1B	47	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@H]1[C@@H](C)O	ZINC000450651068	DG	On-Demand	Anodyne	LIPG	43	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@@H]1[C@H](C)O	ZINC000450651071	DG	On-Demand	Anodyne	CACNA1B	47	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC[C@@H]1[C@H](C)O	ZINC000450651071	DG	On-Demand	Anodyne	LIPG	43	34
CC[C@H](O)CC(=O)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	ZINC000450651075	FC	On-Demand	Anodyne	PKM	29	46
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cccc(CC)n1	ZINC000450651081	EF	On-Demand	Anodyne	P2RY12	49	31
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cccc(CC)n1	ZINC000450651095	EF	On-Demand	Anodyne	P2RY12	49	31
C[C@@H](c1ccsc1)N1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC000450651101	EG	On-Demand	Anodyne	HRH4	25	62
C[C@H](c1ccsc1)N1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC000450651103	EG	On-Demand	Anodyne	HRH4	25	62
CC(=O)c1cccc(CN2CC[C@H](C3CC3)C2)c1	ZINC000450651111	BG	On-Demand	Anodyne	DRD2	15	40
CC(=O)c1cccc(CN2CC[C@H](C3CC3)C2)c1	ZINC000450651111	BG	On-Demand	Anodyne	DRD4	35	45
CC(=O)c1cccc(CN2CC[C@H](C3CC3)C2)c1	ZINC000450651111	BG	On-Demand	Anodyne	ACHE	25	43
CC(=O)c1cccc(CN2CC[C@H](C3CC3)C2)c1	ZINC000450651111	BG	On-Demand	Anodyne	CHRM3	26	44
CC(=O)c1cccc(CN2CC[C@H](C3CC3)C2)c1	ZINC000450651111	BG	On-Demand	Anodyne	SIGMAR1	41	40
CC(=O)c1cccc(CN2CC[C@H](C3CC3)C2)c1	ZINC000450651111	BG	On-Demand	Anodyne	CCR3	50	42
CC(=O)c1cccc(CN2CC[C@H](C3CC3)C2)c1	ZINC000450651111	BG	On-Demand	Anodyne	CXCR3	18	41
CC(=O)c1cccc(CN2CC[C@H](C3CC3)C2)c1	ZINC000450651111	BG	On-Demand	Anodyne	MCHR1	25	40
CC(=O)c1cccc(CN2CC[C@@H](C3CC3)C2)c1	ZINC000450651114	BG	On-Demand	Anodyne	DRD2	15	40
CC(=O)c1cccc(CN2CC[C@@H](C3CC3)C2)c1	ZINC000450651114	BG	On-Demand	Anodyne	DRD4	35	45
CC(=O)c1cccc(CN2CC[C@@H](C3CC3)C2)c1	ZINC000450651114	BG	On-Demand	Anodyne	ACHE	25	43
CC(=O)c1cccc(CN2CC[C@@H](C3CC3)C2)c1	ZINC000450651114	BG	On-Demand	Anodyne	CHRM3	26	44
CC(=O)c1cccc(CN2CC[C@@H](C3CC3)C2)c1	ZINC000450651114	BG	On-Demand	Anodyne	SIGMAR1	41	40
CC(=O)c1cccc(CN2CC[C@@H](C3CC3)C2)c1	ZINC000450651114	BG	On-Demand	Anodyne	CCR3	50	42
CC(=O)c1cccc(CN2CC[C@@H](C3CC3)C2)c1	ZINC000450651114	BG	On-Demand	Anodyne	CXCR3	18	41
CC(=O)c1cccc(CN2CC[C@@H](C3CC3)C2)c1	ZINC000450651114	BG	On-Demand	Anodyne	MCHR1	25	40
CCc1csc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450651120	FD	On-Demand	Anodyne	CA2	26	40
CCc1csc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450651120	FD	On-Demand	Anodyne	CA1	24	40
CCc1cccc(C(=O)N2CCN(c3ccccc3)C(=O)C2)n1	ZINC000450651122	DE	On-Demand	Anodyne	P2RX7	18	43
Cc1ccc(F)c(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450651134	EG	On-Demand	Anodyne	RHODESAIN	0	41
Cc1ccc(F)c(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450651135	EG	On-Demand	Anodyne	RHODESAIN	0	41
CCc1cc(NC2CCC(CSC)CC2)n2ncnc2n1	ZINC000450651149	DG	On-Demand	Anodyne	DHOD	0	46
Cn1c(SC[C@H]2CCC(F)(F)C2)nnc1-c1ccncc1	ZINC000450651157	DG	On-Demand	Anodyne	DRD3	20	40
Cn1c(SC[C@@H]2CCC(F)(F)C2)nnc1-c1ccncc1	ZINC000450651159	DG	On-Demand	Anodyne	DRD3	20	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCN(c2ccccc2)C(=O)C1	ZINC000450651169	DE	On-Demand	Anodyne	P2RX7	19	45
CCc1cc(CCCN2CCC3(CC2)CCN(Cc2ccccc2)C3)on1	ZINC000450651174	FI	On-Demand	Anodyne	SIGMAR1	55	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ocnc2-c2ccccc2)C1	ZINC000450651180	FH	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ocnc2-c2ccccc2)C1	ZINC000450651182	FH	On-Demand	Anodyne	RHODESAIN	0	42
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	HTR1A	78	59
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	DRD2	72	52
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	DRD1	34	51
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	DRD4	53	51
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	ACHE	25	43
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	HTR2A	42	51
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	HTR2C	26	52
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	SLC6A1	53	39
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	HRH1	31	44
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	ADRA1B	31	51
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	DRD3	64	51
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	HTR4	45	38
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	TACR1	17	44
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	HTR7	66	59
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	SIGMAR1	44	46
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	EBP	36	41
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	ABCB1	0	51
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	MCHR1	15	47
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	CYP2J2	66	47
COc1ccccc1COC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450651194	FI	On-Demand	Anodyne	MBTPS1	44	33
FC1(F)CC(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)C1	ZINC000450651197	EI	On-Demand	Anodyne	SIGMAR1	72	45
COC(=O)c1ccc(CN2C[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450651200	CD	On-Demand	Anodyne	DRD4	18	40
COC(=O)c1ccc(CN2C[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450651200	CD	On-Demand	Anodyne	MLNR	43	32
Cc1cccc2c1O[C@H](C(=O)Nc1cccc(C(=O)N3CCC[C@@H](O)C3)c1)C2	ZINC000450651202	GF	On-Demand	Anodyne	RHOA	0	42
Cc1cccc2c1O[C@H](C(=O)Nc1cccc(C(=O)N3CCC[C@H](O)C3)c1)C2	ZINC000450651205	GF	On-Demand	Anodyne	RHOA	0	42
COC(=O)c1ccc(CN2C[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450651206	CD	On-Demand	Anodyne	DRD4	18	40
COC(=O)c1ccc(CN2C[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450651206	CD	On-Demand	Anodyne	MLNR	43	32
Cc1cccc2c1O[C@@H](C(=O)Nc1cccc(C(=O)N3CCC[C@H](O)C3)c1)C2	ZINC000450651207	GF	On-Demand	Anodyne	RHOA	0	42
COC(=O)c1ccc(CN2C[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450651209	CD	On-Demand	Anodyne	DRD4	18	40
COC(=O)c1ccc(CN2C[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450651209	CD	On-Demand	Anodyne	MLNR	43	32
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccccc3)CCO2)c1	ZINC000450651210	EH	On-Demand	Mild	HTR2A	16	42
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccccc3)CCO2)c1	ZINC000450651210	EH	On-Demand	Mild	MCHR1	17	46
N#Cc1cccc([C@@H]2CN(CCCC(=O)c3ccccc3)CCO2)c1	ZINC000450651210	EH	On-Demand	Mild	CYP2J2	53	38
Cc1cccc2c1O[C@@H](C(=O)Nc1cccc(C(=O)N3CCC[C@@H](O)C3)c1)C2	ZINC000450651211	GF	On-Demand	Anodyne	RHOA	0	42
COC(=O)c1ccc(CN2C[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450651212	CD	On-Demand	Anodyne	DRD4	18	40
COC(=O)c1ccc(CN2C[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450651212	CD	On-Demand	Anodyne	MLNR	43	32
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccccc3)CCO2)c1	ZINC000450651214	EH	On-Demand	Mild	HTR2A	16	42
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccccc3)CCO2)c1	ZINC000450651214	EH	On-Demand	Mild	MCHR1	17	46
N#Cc1cccc([C@H]2CN(CCCC(=O)c3ccccc3)CCO2)c1	ZINC000450651214	EH	On-Demand	Mild	CYP2J2	53	38
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450651218	GF	On-Demand	Anodyne	P2RY12	56	33
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450651218	GF	On-Demand	Anodyne	IRAK4	20	41
Cc1nc(C(C)C)oc1C(=O)Nc1n[nH]c(-c2cc(Cl)ccc2Cl)n1	ZINC000450651221	GI	On-Demand	Anodyne	S1PR4	33	41
CC(F)(F)c1ccc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)cn1	ZINC000450651222	FF	On-Demand	Anodyne	P2RX7	25	43
C[C@@H]1CN(CCc2ccc(Cl)cc2)CCN1CC(F)(F)F	ZINC000450651232	DG	On-Demand	Anodyne	SIGMAR1	15	40
C[C@@H]1CN(CCc2ccc(Cl)cc2)CCN1CC(F)(F)F	ZINC000450651232	DG	On-Demand	Anodyne	KCNJ1	15	51
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450651236	GF	On-Demand	Anodyne	P2RY12	56	33
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450651236	GF	On-Demand	Anodyne	IRAK4	20	41
C[C@H]1CN(CCc2ccc(Cl)cc2)CCN1CC(F)(F)F	ZINC000450651241	DG	On-Demand	Anodyne	SIGMAR1	15	40
C[C@H]1CN(CCc2ccc(Cl)cc2)CCN1CC(F)(F)F	ZINC000450651241	DG	On-Demand	Anodyne	KCNJ1	15	51
COCc1cc(Nc2ccc3c(c2)CCCC3)n2ncnc2n1	ZINC000450651243	DF	On-Demand	Anodyne	DHOD	0	69
O[C@H]1COCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450651253	CD	On-Demand	Anodyne	PDE3A	45	34
O[C@@H]1COCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450651255	CD	On-Demand	Anodyne	PDE3A	45	34
COc1ccccc1COC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450651260	FH	On-Demand	Anodyne	TACR1	0	41
COc1ccccc1COC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450651260	FH	On-Demand	Anodyne	TACR3	0	41
COc1ccccc1COC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450651263	FH	On-Demand	Anodyne	TACR1	0	41
COc1ccccc1COC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450651263	FH	On-Demand	Anodyne	TACR3	0	41
COc1ccccc1COC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450651264	FH	On-Demand	Anodyne	TACR1	0	41
COc1ccccc1COC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450651264	FH	On-Demand	Anodyne	TACR3	0	41
COc1ccccc1COC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450651265	FH	On-Demand	Anodyne	TACR1	0	41
COc1ccccc1COC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450651265	FH	On-Demand	Anodyne	TACR3	0	41
Clc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450651293	DH	On-Demand	Anodyne	GSK3B	0	45
Clc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450651293	DH	On-Demand	Anodyne	GSK3A	40	36
Clc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450651293	DH	On-Demand	Anodyne	TERT	23	47
Clc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450651294	DH	On-Demand	Anodyne	GSK3B	0	45
Clc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450651294	DH	On-Demand	Anodyne	GSK3A	40	36
Clc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450651294	DH	On-Demand	Anodyne	TERT	23	47
COCC1(C)CCN(CC/C=C\c2ccccc2)CC1	ZINC000450651314	CH	On-Demand	Anodyne	SIGMAR1	15	61
COCC1(C)CCN(CC/C=C/c2ccccc2)CC1	ZINC000450651315	CH	On-Demand	Anodyne	SIGMAR1	15	61
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	THRA	0	40
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	DRD2	30	44
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	DRD1	18	43
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	DRD4	0	44
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	ERG2	20	44
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	HDAC8	18	40
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	SLC18A3	25	45
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	EBP	21	44
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	CYP2J2	55	40
COCC1(C)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450651316	FI	On-Demand	Anodyne	AP2S1	0	44
C[C@H](CCCCO)Nc1ccnc2cc(Br)ccc12	ZINC000450651321	DH	On-Demand	Anodyne	HRP1_PLAFA	22	52
C[C@@H](CCCCO)Nc1ccnc2cc(Br)ccc12	ZINC000450651322	DH	On-Demand	Anodyne	HRP1_PLAFA	22	52
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450651338	CI	On-Demand	Anodyne	SCN9A	0	41
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450651339	CI	On-Demand	Anodyne	SCN9A	0	41
C[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450651340	CI	On-Demand	Anodyne	SCN9A	0	41
C[C@H](CC(F)(F)F)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450651341	CI	On-Demand	Anodyne	SCN9A	0	41
COc1cc(NC(=O)c2cnn3ccc(C)cc23)ccc1OC(C)C	ZINC000450651344	EH	On-Demand	Anodyne	EPHB3	40	53
COc1cc(NC(=O)c2cnn3ccc(C)cc23)ccc1OC(C)C	ZINC000450651344	EH	On-Demand	Anodyne	ENPP1	73	35
COc1cc(NC(=O)c2cnn3ccc(C)cc23)ccc1OC(C)C	ZINC000450651344	EH	On-Demand	Anodyne	KCNK3	51	41
COc1cc(NC(=O)c2cnn3ccc(C)cc23)ccc1OC(C)C	ZINC000450651344	EH	On-Demand	Anodyne	KCNK9	52	38
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450651379	ED	On-Demand	Bother	BCL2L1	102	35
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450651379	ED	On-Demand	Bother	BCL2	72	34
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450651379	ED	On-Demand	Bother	BCL2L2	40	32
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450651380	ED	On-Demand	Bother	BCL2L1	102	35
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450651380	ED	On-Demand	Bother	BCL2	72	34
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450651380	ED	On-Demand	Bother	BCL2L2	40	32
COc1cc(CC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)ccc1Cl	ZINC000450651411	FH	On-Demand	Anodyne	SIGMAR1	15	45
COc1cc(CC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)ccc1Cl	ZINC000450651412	FH	On-Demand	Anodyne	SIGMAR1	15	45
COc1cc(CC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)ccc1Cl	ZINC000450651413	FH	On-Demand	Anodyne	SIGMAR1	15	45
COc1cc(CC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)ccc1Cl	ZINC000450651414	FH	On-Demand	Anodyne	SIGMAR1	15	45
COc1ccc(CNC(=O)CCN2CC(=O)N(Cc3ccccc3)C2)c(OC)c1	ZINC000450651415	GE	On-Demand	Anodyne	TSHR	54	32
COc1ccc(CNC(=O)CCN2CC(=O)N(Cc3ccccc3)C2)c(OC)c1	ZINC000450651415	GE	On-Demand	Anodyne	HTR7	28	40
COc1ccc(CNC(=O)CCN2CC(=O)N(Cc3ccccc3)C2)c(OC)c1	ZINC000450651415	GE	On-Demand	Anodyne	PLA2G2A	40	39
COc1ccc(CNC(=O)CCN2CC(=O)N(Cc3ccccc3)C2)c(OC)c1	ZINC000450651415	GE	On-Demand	Anodyne	MTNR1A	47	35
COc1ccc(CNC(=O)CCN2CC(=O)N(Cc3ccccc3)C2)c(OC)c1	ZINC000450651415	GE	On-Demand	Anodyne	MTNR1B	41	35
O[C@H]1COCCN(c2nc(C(F)F)nc3ccccc23)C1	ZINC000450651421	CD	On-Demand	Anodyne	METAP1	21	45
O[C@@H]1COCCN(c2nc(C(F)F)nc3ccccc23)C1	ZINC000450651423	CD	On-Demand	Anodyne	METAP1	21	45
COC(=O)c1cnc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450651428	GE	On-Demand	Bother	CACNA1C	48	35
COC(=O)c1cnc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450651428	GE	On-Demand	Bother	CACNA1D	71	35
COC(=O)c1cnc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450651432	GE	On-Demand	Bother	CACNA1C	48	35
COC(=O)c1cnc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450651432	GE	On-Demand	Bother	CACNA1D	71	35
COC(=O)c1cnc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450651435	GE	On-Demand	Bother	CACNA1C	48	35
COC(=O)c1cnc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450651435	GE	On-Demand	Bother	CACNA1D	71	35
COC(=O)c1cnc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450651437	GE	On-Demand	Bother	CACNA1C	48	35
COC(=O)c1cnc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450651437	GE	On-Demand	Bother	CACNA1D	71	35
Cn1c(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nc2ccccc21	ZINC000450651439	EF	On-Demand	Anodyne	HRH1	0	47
Cn1c(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nc2ccccc21	ZINC000450651442	EF	On-Demand	Anodyne	HRH1	0	47
Cn1c(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nc2ccccc21	ZINC000450651444	EF	On-Demand	Anodyne	HRH1	0	47
Cn1c(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nc2ccccc21	ZINC000450651447	EF	On-Demand	Anodyne	HRH1	0	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1	ZINC000450651450	GG	On-Demand	Anodyne	RHODESAIN	0	46
Cn1cnc([N+](=O)[O-])c1N1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651452	GG	On-Demand	Bother	ACHE	24	41
Cn1cnc([N+](=O)[O-])c1N1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651452	GG	On-Demand	Bother	SIGMAR1	34	43
Cn1cnc([N+](=O)[O-])c1N1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651453	GG	On-Demand	Bother	ACHE	24	41
Cn1cnc([N+](=O)[O-])c1N1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651453	GG	On-Demand	Bother	SIGMAR1	34	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@H](CC(=O)OC(C)C)C1	ZINC000450651455	GG	On-Demand	Anodyne	RHODESAIN	0	46
COc1cc(CC(=O)N2CCC[C@@H](CC(=O)OC(C)C)C2)ccc1Cl	ZINC000450651456	FG	On-Demand	Anodyne	OPRK1	40	40
COc1cc(CC(=O)N2CCC[C@H](CC(=O)OC(C)C)C2)ccc1Cl	ZINC000450651457	FG	On-Demand	Anodyne	OPRK1	40	40
CCOC(=O)c1ccnc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450651460	GE	On-Demand	Bother	CACNA1C	50	36
CCOC(=O)c1ccnc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450651460	GE	On-Demand	Bother	CACNA1D	76	36
CCOC(=O)c1ccnc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450651461	GE	On-Demand	Bother	CACNA1C	50	36
CCOC(=O)c1ccnc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450651461	GE	On-Demand	Bother	CACNA1D	76	36
CCOC(=O)c1ccnc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450651464	GE	On-Demand	Bother	CACNA1C	50	36
CCOC(=O)c1ccnc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450651464	GE	On-Demand	Bother	CACNA1D	76	36
CCOC(=O)c1ccnc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450651466	GE	On-Demand	Bother	CACNA1C	50	36
CCOC(=O)c1ccnc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450651466	GE	On-Demand	Bother	CACNA1D	76	36
CC(=O)CCCCCSc1nnc(-c2ccccc2)o1	ZINC000450651467	CH	On-Demand	Anodyne	GSK3A	35	45
CC(=O)CCCCCSc1nnc(-c2ccccc2)o1	ZINC000450651467	CH	On-Demand	Anodyne	FAAH	44	48
CC(=O)CCCCCSc1nnc(-c2ccccc2)o1	ZINC000450651467	CH	On-Demand	Anodyne	ALOX15	61	36
CC(=O)CCCCCSc1nnc(-c2ccccc2)o1	ZINC000450651467	CH	On-Demand	Anodyne	CES1	51	44
COC(=O)c1ccc(CN2CCN(CC(F)(F)F)[C@H](C)C2)cc1Cl	ZINC000450651481	FG	On-Demand	Anodyne	CCR1	43	41
COC(=O)c1ccc(CN2CCN(CC(F)(F)F)[C@@H](C)C2)cc1Cl	ZINC000450651483	FG	On-Demand	Anodyne	CCR1	43	41
CCC1(Nc2nc(-c3ccccn3)nc3c2CCC3)CC1	ZINC000450651492	CG	On-Demand	Anodyne	METAP2	27	40
CC(=O)c1ccc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)cc1	ZINC000450651503	FF	On-Demand	Anodyne	NOD1	31	40
CC(=O)c1ccc(CN2CCN(S(C)(=O)=O)c3ccccc3C2)cc1	ZINC000450651503	FF	On-Demand	Anodyne	NOD2	47	40
CC1(C)CN(c2ncc([N+](=O)[O-])cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651505	GH	On-Demand	Bother	DRD4	25	42
CC1(C)CN(c2ncc([N+](=O)[O-])cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651505	GH	On-Demand	Bother	ACHE	30	44
CC1(C)CN(c2ncc([N+](=O)[O-])cn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651505	GH	On-Demand	Bother	SIGMAR1	47	48
CC1(C)CN(c2ncc([N+](=O)[O-])cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651508	GH	On-Demand	Bother	DRD4	25	42
CC1(C)CN(c2ncc([N+](=O)[O-])cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651508	GH	On-Demand	Bother	ACHE	30	44
CC1(C)CN(c2ncc([N+](=O)[O-])cn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450651508	GH	On-Demand	Bother	SIGMAR1	47	48
CNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nn1	ZINC000450651513	ED	On-Demand	Anodyne	SCD1	44	40
CO[C@H](Cc1ccccc1)CN1CC[C@H](C2CC2)C1	ZINC000450651514	CF	On-Demand	Anodyne	SLC6A3	16	48
CNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nn1	ZINC000450651515	ED	On-Demand	Anodyne	SCD1	44	40
CO[C@H](Cc1ccccc1)CN1CC[C@@H](C2CC2)C1	ZINC000450651516	CF	On-Demand	Anodyne	SLC6A3	16	48
CNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nn1	ZINC000450651517	ED	On-Demand	Anodyne	SCD1	44	40
CO[C@@H](Cc1ccccc1)CN1CC[C@H](C2CC2)C1	ZINC000450651518	CF	On-Demand	Anodyne	SLC6A3	16	48
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](C2CC2)C1	ZINC000450651519	CF	On-Demand	Anodyne	SLC6A3	16	48
CNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nn1	ZINC000450651520	ED	On-Demand	Anodyne	SCD1	44	40
Cc1nccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450651543	CE	On-Demand	Anodyne	SORD	57	33
Cc1nccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450651545	CE	On-Demand	Anodyne	SORD	57	33
Cc1nccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450651547	CE	On-Demand	Anodyne	SORD	57	33
Cc1nccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450651550	CE	On-Demand	Anodyne	SORD	57	33
COC1(CSc2nnc(-c3ccccc3)o2)CCC1	ZINC000450651574	CG	On-Demand	Anodyne	GSK3A	37	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450651597	GH	On-Demand	Anodyne	MTR1B_CHICK	0	51
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450651597	GH	On-Demand	Anodyne	HTR6	42	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450651597	GH	On-Demand	Anodyne	MTNR1A	37	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450651605	FG	On-Demand	Anodyne	NQO2	38	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450651605	FG	On-Demand	Anodyne	MTR1B_CHICK	0	58
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450651605	FG	On-Demand	Anodyne	HTR6	26	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450651605	FG	On-Demand	Anodyne	EBP	17	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450651606	FG	On-Demand	Anodyne	NQO2	38	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450651606	FG	On-Demand	Anodyne	MTR1B_CHICK	0	58
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450651606	FG	On-Demand	Anodyne	HTR6	26	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450651606	FG	On-Demand	Anodyne	EBP	17	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450651607	GH	On-Demand	Anodyne	MTR1B_CHICK	0	51
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450651607	GH	On-Demand	Anodyne	HTR6	42	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450651607	GH	On-Demand	Anodyne	MTNR1A	37	42
CC(=O)c1cccc(CN2CCc3cccc(F)c3C2)c1	ZINC000450651608	CH	On-Demand	Anodyne	NOD1	30	40
CC(=O)c1cccc(CN2CCc3cccc(F)c3C2)c1	ZINC000450651608	CH	On-Demand	Anodyne	NOD2	45	40
CCC(=O)C1(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)CC1	ZINC000450651609	DF	On-Demand	Anodyne	NQO2	42	47
CCC(=O)C1(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)CC1	ZINC000450651609	DF	On-Demand	Anodyne	MTR1B_CHICK	0	60
CCC(=O)C1(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)CC1	ZINC000450651609	DF	On-Demand	Anodyne	HTR6	37	40
CCC(=O)C1(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)CC1	ZINC000450651609	DF	On-Demand	Anodyne	PPARD	42	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450651610	GH	On-Demand	Anodyne	MTR1B_CHICK	0	51
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450651610	GH	On-Demand	Anodyne	HTR6	42	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450651610	GH	On-Demand	Anodyne	MTNR1A	37	42
CCC(=O)C1(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)CC1	ZINC000450651611	DF	On-Demand	Anodyne	NQO2	42	47
CCC(=O)C1(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)CC1	ZINC000450651611	DF	On-Demand	Anodyne	MTR1B_CHICK	0	60
CCC(=O)C1(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)CC1	ZINC000450651611	DF	On-Demand	Anodyne	HTR6	37	40
CCC(=O)C1(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)CC1	ZINC000450651611	DF	On-Demand	Anodyne	PPARD	42	41
CO[C@H](Cc1ccccc1)CN1CC[C@@H](C)[C@@H](O)C1	ZINC000450651612	CD	On-Demand	Anodyne	OPRK1	19	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450651613	GH	On-Demand	Anodyne	MTR1B_CHICK	0	51
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450651613	GH	On-Demand	Anodyne	HTR6	42	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450651613	GH	On-Demand	Anodyne	MTNR1A	37	42
CO[C@H](Cc1ccccc1)CN1CC[C@@H](C)[C@H](O)C1	ZINC000450651618	CD	On-Demand	Anodyne	OPRK1	19	40
CO[C@H](Cc1ccccc1)CN1CC[C@H](C)[C@@H](O)C1	ZINC000450651619	CD	On-Demand	Anodyne	OPRK1	19	40
CO[C@H](Cc1ccccc1)CN1CC[C@H](C)[C@H](O)C1	ZINC000450651620	CD	On-Demand	Anodyne	OPRK1	19	40
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651660	FH	On-Demand	Anodyne	DRD2	32	45
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651660	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651660	FH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651660	FH	On-Demand	Anodyne	SIGMAR1	22	40
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651660	FH	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651660	FH	On-Demand	Anodyne	PREP	45	37
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651660	FH	On-Demand	Anodyne	EBP	17	40
O=C(CCCN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651660	FH	On-Demand	Anodyne	CYP2J2	62	44
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450651662	FH	On-Demand	Anodyne	RHOA	0	42
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651663	FH	On-Demand	Anodyne	DRD2	32	45
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651663	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651663	FH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651663	FH	On-Demand	Anodyne	SIGMAR1	22	40
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651663	FH	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651663	FH	On-Demand	Anodyne	PREP	45	37
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651663	FH	On-Demand	Anodyne	EBP	17	40
O=C(CCCN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)c1ccccc1	ZINC000450651663	FH	On-Demand	Anodyne	CYP2J2	62	44
Cc1sccc1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651668	EF	On-Demand	Anodyne	L3MBTL1	0	43
CCC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450651671	FH	On-Demand	Anodyne	RHOA	0	42
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450651674	FH	On-Demand	Anodyne	RHOA	0	42
CCC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450651676	FH	On-Demand	Anodyne	RHOA	0	42
CC(=O)NC[C@H](CC(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1)CC(C)C	ZINC000450651701	FF	On-Demand	Anodyne	F2R	23	41
CC(=O)NC[C@H](CC(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1)CC(C)C	ZINC000450651701	FF	On-Demand	Anodyne	RHODESAIN	0	43
CC(=O)NC[C@H](CC(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1)CC(C)C	ZINC000450651703	FF	On-Demand	Anodyne	F2R	23	41
CC(=O)NC[C@H](CC(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1)CC(C)C	ZINC000450651703	FF	On-Demand	Anodyne	RHODESAIN	0	43
CCCOc1cccc(CN2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000450651706	DG	On-Demand	Anodyne	CPT1A	40	33
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651709	FH	On-Demand	Anodyne	CCKAR	0	41
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651709	FH	On-Demand	Anodyne	CCKBR	0	41
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651709	FH	On-Demand	Anodyne	L3MBTL3	44	38
CCCOc1cccc(CN2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000450651711	DG	On-Demand	Anodyne	CPT1A	40	33
O=C(NCC(=O)N1CCO[C@H](Cc2ccccc2)C1)Nc1cccc(Cl)c1	ZINC000450651713	GF	On-Demand	Anodyne	CCR3	52	40
O=C(NCC(=O)N1CCO[C@H](Cc2ccccc2)C1)Nc1cccc(Cl)c1	ZINC000450651713	GF	On-Demand	Anodyne	EPHX2	28	44
O=C(NCC(=O)N1CCO[C@@H](Cc2ccccc2)C1)Nc1cccc(Cl)c1	ZINC000450651715	GF	On-Demand	Anodyne	CCR3	52	40
O=C(NCC(=O)N1CCO[C@@H](Cc2ccccc2)C1)Nc1cccc(Cl)c1	ZINC000450651715	GF	On-Demand	Anodyne	EPHX2	28	44
CCC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651728	FH	On-Demand	Anodyne	CCKAR	0	41
CCC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651728	FH	On-Demand	Anodyne	CCKBR	0	41
CCC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651728	FH	On-Demand	Anodyne	L3MBTL3	44	38
C[C@H](CCCCO)Nc1ccnc2c(Cl)cccc12	ZINC000450651751	CH	On-Demand	Anodyne	RBP_CHICK	0	42
CCc1cc(CCCSc2nnc(-c3ccncc3)n2C)on1	ZINC000450651754	EG	On-Demand	Anodyne	DRD2	0	51
CCc1cc(CCCSc2nnc(-c3ccncc3)n2C)on1	ZINC000450651754	EG	On-Demand	Anodyne	DRD3	47	43
CCc1cc(CCCSc2nnc(-c3ccncc3)n2C)on1	ZINC000450651754	EG	On-Demand	Anodyne	KCNH2	24	51
C[C@@H](CCCCO)Nc1ccnc2c(Cl)cccc12	ZINC000450651755	CH	On-Demand	Anodyne	RBP_CHICK	0	42
CCOC(=O)c1ccc(CN(CCO)Cc2ccc(Cl)c(Cl)c2)nc1	ZINC000450651763	GH	On-Demand	Anodyne	P2RY12	23	45
CCc1cccc(C(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)n1	ZINC000450651775	DF	On-Demand	Anodyne	RHOA	0	40
CCc1cccc(C(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)n1	ZINC000450651776	DF	On-Demand	Anodyne	RHOA	0	40
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651781	GF	On-Demand	Anodyne	CCKAR	0	43
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651781	GF	On-Demand	Anodyne	TIMP3	57	33
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651781	GF	On-Demand	Anodyne	CCKBR	15	41
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651781	GF	On-Demand	Anodyne	CFTR	46	36
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651781	GF	On-Demand	Anodyne	ST14	49	35
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651781	GF	On-Demand	Anodyne	PARP10	0	40
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651783	GF	On-Demand	Anodyne	CCKAR	0	43
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651783	GF	On-Demand	Anodyne	TIMP3	57	33
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651783	GF	On-Demand	Anodyne	CCKBR	15	41
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651783	GF	On-Demand	Anodyne	CFTR	46	36
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651783	GF	On-Demand	Anodyne	ST14	49	35
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450651783	GF	On-Demand	Anodyne	PARP10	0	40
COc1cccc(OCCC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450651799	GF	On-Demand	Anodyne	DRD4	43	34
COc1cccc(OCCC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450651799	GF	On-Demand	Anodyne	HRH2	22	41
COc1cccc(OCCC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450651799	GF	On-Demand	Anodyne	NPY2R	15	43
COc1cccc(OCCC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450651799	GF	On-Demand	Anodyne	CCR3	19	40
COc1cccc(OCCC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450651799	GF	On-Demand	Anodyne	MTNR1A	25	41
COc1cccc(OCCC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450651799	GF	On-Demand	Anodyne	MTNR1B	31	47
COc1cccc(OCCC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450651799	GF	On-Demand	Anodyne	EPHX2	30	41
COc1cccc(OCCC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450651799	GF	On-Demand	Anodyne	ST14	41	34
C[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CCN1C1CCN(C)CC1	ZINC000450651823	GF	On-Demand	Anodyne	SIGMAR1	15	40
C[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CCN1C1CCN(C)CC1	ZINC000450651824	GF	On-Demand	Anodyne	SIGMAR1	15	40
Cc1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)nn1C(C)C	ZINC000450651832	FF	On-Demand	Anodyne	HPGD	37	40
Cc1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)nn1C(C)C	ZINC000450651832	FF	On-Demand	Anodyne	KCNK3	55	34
Cc1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)nn1C(C)C	ZINC000450651835	FF	On-Demand	Anodyne	HPGD	37	40
Cc1cc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)nn1C(C)C	ZINC000450651835	FF	On-Demand	Anodyne	KCNK3	55	34
COC(=O)c1csc(CN2CCc3cc(F)ccc3C2)n1	ZINC000450651838	DF	On-Demand	Anodyne	ABCB1	22	46
COC(=O)c1csc(CN2CCc3cc(F)ccc3C2)n1	ZINC000450651838	DF	On-Demand	Anodyne	NOD2	42	38
COc1cc(CN(C)CCNC(=O)C(C)C)ccc1Cl	ZINC000450651840	CF	On-Demand	Anodyne	CAN2	0	41
CSCC1CCC(Nc2ccc(C(=O)N3CCC(C)CC3)cn2)CC1	ZINC000450651850	FI	On-Demand	Anodyne	L3MBTL3	56	38
CC1(CSc2nnc3n2CCCCC3)CCC1	ZINC000450651856	CG	On-Demand	Anodyne	HSD11B2	22	40
CC(C)CCCC(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450651859	CG	On-Demand	Anodyne	PREP	27	41
CC(C)CCCC(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450651859	CG	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)CCCC(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450651861	CG	On-Demand	Anodyne	PREP	27	41
CC(C)CCCC(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450651861	CG	On-Demand	Anodyne	RHODESAIN	0	42
FC1(F)CCC[C@H]1CSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000450651865	EJ	On-Demand	Anodyne	TERT	0	43
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450651866	EH	On-Demand	Anodyne	RHODESAIN	0	44
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450651866	EH	On-Demand	Anodyne	SFRP1	48	36
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450651866	EH	On-Demand	Anodyne	WNT3	48	33
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450651867	EH	On-Demand	Anodyne	RHODESAIN	0	44
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450651867	EH	On-Demand	Anodyne	SFRP1	48	36
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450651867	EH	On-Demand	Anodyne	WNT3	48	33
FC1(F)CCC[C@@H]1CSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000450651869	EJ	On-Demand	Anodyne	TERT	0	43
CCN(c1nc(C)nc2sc3c(c12)CCC3)C1COC1	ZINC000450651874	CF	On-Demand	Anodyne	CEL	21	45
C[C@H]1[C@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651891	CF	On-Demand	Anodyne	DRD2	32	45
C[C@H]1[C@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651891	CF	On-Demand	Anodyne	DRD4	0	48
C[C@H]1[C@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651891	CF	On-Demand	Anodyne	HTR2A	22	48
C[C@H]1[C@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651891	CF	On-Demand	Anodyne	SLC18A3	0	46
C[C@H]1[C@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651891	CF	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1[C@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651891	CF	On-Demand	Anodyne	CYP2J2	52	39
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450651892	CF	On-Demand	Anodyne	DRD2	32	45
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450651892	CF	On-Demand	Anodyne	DRD4	0	48
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450651892	CF	On-Demand	Anodyne	HTR2A	22	48
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450651892	CF	On-Demand	Anodyne	SLC18A3	0	46
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450651892	CF	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450651892	CF	On-Demand	Anodyne	CYP2J2	52	39
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651893	CF	On-Demand	Anodyne	DRD2	32	45
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651893	CF	On-Demand	Anodyne	DRD4	0	48
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651893	CF	On-Demand	Anodyne	HTR2A	22	48
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651893	CF	On-Demand	Anodyne	SLC18A3	0	46
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651893	CF	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651893	CF	On-Demand	Anodyne	CYP2J2	52	39
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651894	CF	On-Demand	Anodyne	DRD2	32	45
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651894	CF	On-Demand	Anodyne	DRD4	0	48
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651894	CF	On-Demand	Anodyne	HTR2A	22	48
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651894	CF	On-Demand	Anodyne	SLC18A3	0	46
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651894	CF	On-Demand	Anodyne	HTR3B	0	43
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450651894	CF	On-Demand	Anodyne	CYP2J2	52	39
Cc1oc2ccccc2c1CCNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450651906	GH	On-Demand	Anodyne	NMT_PLAF7	0	42
Cc1oc2ccccc2c1CCNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450651907	GH	On-Demand	Anodyne	NMT_PLAF7	0	42
Cc1ccc(NC(=O)c2cccc3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450651909	GI	On-Demand	Anodyne	AVPR2	57	42
Cc1ccc(NC(=O)c2cccc3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450651909	GI	On-Demand	Anodyne	AVPR1A	26	42
Cc1ccc(NC(=O)c2cccc3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450651909	GI	On-Demand	Anodyne	MAPK14	22	45
Cc1ccc(NC(=O)c2cccc3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450651909	GI	On-Demand	Anodyne	F2R	0	46
Cc1ccc(NC(=O)c2cccc3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450651909	GI	On-Demand	Anodyne	LDLR	0	43
Cc1ccc(NC(=O)c2cccc3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450651909	GI	On-Demand	Anodyne	BTK	26	44
Cc1ccc(NC(=O)c2cccc3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450651909	GI	On-Demand	Anodyne	KCNK3	77	41
Cc1ccc(NC(=O)c2cccc3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450651909	GI	On-Demand	Anodyne	KCNK9	68	39
COc1ccc(C(=O)N[C@H](C)CC(F)(F)F)cc1S(C)(=O)=O	ZINC000450651931	EE	On-Demand	Anodyne	COLA	63	36
COc1ccc(C(=O)N[C@H](C)CC(F)(F)F)cc1S(C)(=O)=O	ZINC000450651931	EE	On-Demand	Anodyne	CPT1A	54	36
COc1ccc(C(=O)N[C@H](C)CC(F)(F)F)cc1S(C)(=O)=O	ZINC000450651931	EE	On-Demand	Anodyne	CPT1B	51	33
COc1ccc(C(=O)N[C@@H](C)CC(F)(F)F)cc1S(C)(=O)=O	ZINC000450651932	EE	On-Demand	Anodyne	COLA	63	36
COc1ccc(C(=O)N[C@@H](C)CC(F)(F)F)cc1S(C)(=O)=O	ZINC000450651932	EE	On-Demand	Anodyne	CPT1A	54	36
COc1ccc(C(=O)N[C@@H](C)CC(F)(F)F)cc1S(C)(=O)=O	ZINC000450651932	EE	On-Demand	Anodyne	CPT1B	51	33
Cc1oc2ccccc2c1CCNC(=O)C(C)(C)C(C)(F)F	ZINC000450652013	DI	On-Demand	Anodyne	MTNR1A	28	48
Cc1oc2ccccc2c1CCNC(=O)C(C)(C)C(C)(F)F	ZINC000450652013	DI	On-Demand	Anodyne	MTNR1B	25	48
CC(=O)[C@@](C)(O)CN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450652022	EG	On-Demand	Anodyne	CCR2	32	42
CC(=O)[C@](C)(O)CN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450652024	EG	On-Demand	Anodyne	CCR2	32	42
COCCn1c(NC(=O)CCCC(=O)C2CC2)nc2ccccc21	ZINC000450652036	EF	On-Demand	Anodyne	HRH1	0	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cn1cc(C(C)=O)nn1	ZINC000450652044	ED	On-Demand	Anodyne	NQO2	38	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cn1cc(C(C)=O)nn1	ZINC000450652044	ED	On-Demand	Anodyne	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@H]2CNC(=O)Cn1cc(C(C)=O)nn1	ZINC000450652044	ED	On-Demand	Anodyne	HTR6	36	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cn1cc(C(C)=O)nn1	ZINC000450652045	ED	On-Demand	Anodyne	NQO2	38	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cn1cc(C(C)=O)nn1	ZINC000450652045	ED	On-Demand	Anodyne	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)Cn1cc(C(C)=O)nn1	ZINC000450652045	ED	On-Demand	Anodyne	HTR6	36	42
CC[C@@H](O)CC(=O)NCCOCc1ccc(Cl)cc1Cl	ZINC000450652049	DF	On-Demand	Anodyne	CAN2	0	40
CCOc1nc2ccc(C(=O)N[C@H](CC(F)(F)F)C(=O)OC)cc2[nH]1	ZINC000450652094	FE	On-Demand	Anodyne	FPGS	40	35
CCOc1nc2ccc(C(=O)N[C@H](CC(F)(F)F)C(=O)OC)cc2[nH]1	ZINC000450652094	FE	On-Demand	Anodyne	PIN1	35	41
CCOc1nc2ccc(C(=O)N[C@@H](CC(F)(F)F)C(=O)OC)cc2[nH]1	ZINC000450652096	FE	On-Demand	Anodyne	FPGS	40	35
CCOc1nc2ccc(C(=O)N[C@@H](CC(F)(F)F)C(=O)OC)cc2[nH]1	ZINC000450652096	FE	On-Demand	Anodyne	PIN1	35	41
COCCOC[C@@H](O)CN1CC[C@@](O)(Cc2cccc(Cl)c2)C1	ZINC000450652102	ED	On-Demand	Anodyne	HSP90AB1	34	42
c1ccc(CN2CCC3(CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450652104	FG	On-Demand	Anodyne	DRD2	0	40
c1ccc(CN2CCC3(CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450652104	FG	On-Demand	Anodyne	SIGMAR1	54	39
COCCOC[C@H](O)CN1CC[C@@](O)(Cc2cccc(Cl)c2)C1	ZINC000450652106	ED	On-Demand	Anodyne	HSP90AB1	34	42
COCCOC[C@@H](O)CN1CC[C@](O)(Cc2cccc(Cl)c2)C1	ZINC000450652107	ED	On-Demand	Anodyne	HSP90AB1	34	42
C=CCCC[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450652111	DG	On-Demand	Mild	F7	30	42
C=CCCC[C@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450652112	DG	On-Demand	Mild	F7	30	42
C[C@H](O)CCN1CCc2ccccc2[C@@H]1Cc1ccccc1	ZINC000450652113	CH	On-Demand	Anodyne	SIGMAR1	16	40
C[C@H](O)CCN1CCc2ccccc2[C@@H]1Cc1ccccc1	ZINC000450652113	CH	On-Demand	Anodyne	MTNR1B	27	45
C[C@H](O)CCN1CCc2ccccc2[C@H]1Cc1ccccc1	ZINC000450652114	CH	On-Demand	Anodyne	SIGMAR1	16	40
C[C@H](O)CCN1CCc2ccccc2[C@H]1Cc1ccccc1	ZINC000450652114	CH	On-Demand	Anodyne	MTNR1B	27	45
C[C@@H](O)CCN1CCc2ccccc2[C@H]1Cc1ccccc1	ZINC000450652115	CH	On-Demand	Anodyne	SIGMAR1	16	40
C[C@@H](O)CCN1CCc2ccccc2[C@H]1Cc1ccccc1	ZINC000450652115	CH	On-Demand	Anodyne	MTNR1B	27	45
C[C@@H](O)CCN1CCc2ccccc2[C@@H]1Cc1ccccc1	ZINC000450652116	CH	On-Demand	Anodyne	SIGMAR1	16	40
C[C@@H](O)CCN1CCc2ccccc2[C@@H]1Cc1ccccc1	ZINC000450652116	CH	On-Demand	Anodyne	MTNR1B	27	45
O=C(c1cnc(C2CC2)nc1)N1CCN(c2ccccc2)C(=O)C1	ZINC000450652117	DD	On-Demand	Anodyne	P2RX7	15	41
Cc1csc(C(=O)N2CCN(c3ccccc3)C(=O)C2)c1	ZINC000450652123	DF	On-Demand	Anodyne	P2RX7	0	47
CC(C)C[C@@H](C)Sc1nnc(-c2ccccc2)o1	ZINC000450652127	CI	On-Demand	Anodyne	GSK3A	16	44
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	HTR1A	35	57
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	DRD2	44	57
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	DRD1	25	50
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	DRD4	30	56
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	HTR2A	37	52
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	HTR2C	32	50
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	DRD3	34	56
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	DRD5	21	56
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	ERG2	20	43
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	HTR7	59	44
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	SIGMAR1	15	53
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	HTR5A	16	52
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	SLC18A3	22	53
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	HTR3B	0	50
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	CYP2J2	54	38
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	NET	0	44
CS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)Cc2ccccc21	ZINC000450652130	GG	On-Demand	Anodyne	AP2S1	0	43
COCCOC[C@@H](O)CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450652131	FD	On-Demand	Anodyne	ABCB1	52	42
COCCOC[C@@H](O)CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450652131	FD	On-Demand	Anodyne	HSP90AB1	39	41
COCCOC[C@H](O)CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450652132	FD	On-Demand	Anodyne	ABCB1	52	42
COCCOC[C@H](O)CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450652132	FD	On-Demand	Anodyne	HSP90AB1	39	41
C=CCCC[C@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450652133	CG	On-Demand	Mild	MTNR1A	36	41
C=CCCC[C@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450652133	CG	On-Demand	Mild	MTNR1B	41	41
C=CCCC[C@@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450652134	CG	On-Demand	Mild	MTNR1A	36	41
C=CCCC[C@@H](C)NC(=O)CCOc1cccc(OC)c1	ZINC000450652134	CG	On-Demand	Mild	MTNR1B	41	41
C[C@H](O)[C@H]1CCCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450652140	DE	On-Demand	Anodyne	CPT1A	57	34
C[C@H](O)[C@@H]1CCCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450652141	DE	On-Demand	Anodyne	CPT1A	57	34
C[C@@H](O)[C@H]1CCCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450652142	DE	On-Demand	Anodyne	CPT1A	57	34
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450652143	DE	On-Demand	Anodyne	CPT1A	57	34
CCOC(=O)c1cc(C(=O)N2CCN(c3ccccc3)C(=O)C2)[nH]c1C	ZINC000450652146	FD	On-Demand	Anodyne	P2RX7	15	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCCC[C@H]1[C@@H](C)O	ZINC000450652151	FF	On-Demand	Anodyne	ACE	25	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCCC[C@@H]1[C@@H](C)O	ZINC000450652152	FF	On-Demand	Anodyne	ACE	25	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCCC[C@H]1[C@H](C)O	ZINC000450652153	FF	On-Demand	Anodyne	ACE	25	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCCC[C@@H]1[C@H](C)O	ZINC000450652154	FF	On-Demand	Anodyne	ACE	25	41
C[C@@H](O)[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652163	EE	On-Demand	Bother	CACNA1C	41	32
C[C@@H](O)[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652163	EE	On-Demand	Bother	CACNA1D	59	32
C[C@@H](O)[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652163	EE	On-Demand	Bother	COLA	34	45
C[C@@H](O)[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652163	EE	On-Demand	Bother	CPT1A	32	45
C[C@@H](O)[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652164	EE	On-Demand	Bother	CACNA1C	41	32
C[C@@H](O)[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652164	EE	On-Demand	Bother	CACNA1D	59	32
C[C@@H](O)[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652164	EE	On-Demand	Bother	COLA	34	45
C[C@@H](O)[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652164	EE	On-Demand	Bother	CPT1A	32	45
C[C@H](O)[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652165	EE	On-Demand	Bother	CACNA1C	41	32
C[C@H](O)[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652165	EE	On-Demand	Bother	CACNA1D	59	32
C[C@H](O)[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652165	EE	On-Demand	Bother	COLA	34	45
C[C@H](O)[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652165	EE	On-Demand	Bother	CPT1A	32	45
C[C@H](O)[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652166	EE	On-Demand	Bother	CACNA1C	41	32
C[C@H](O)[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652166	EE	On-Demand	Bother	CACNA1D	59	32
C[C@H](O)[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652166	EE	On-Demand	Bother	COLA	34	45
C[C@H](O)[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450652166	EE	On-Demand	Bother	CPT1A	32	45
Cn1ccnc1[C@@H]1N(c2ncnc3scc(-c4ccccc4)c23)CC1(C)C	ZINC000450652177	GJ	On-Demand	Anodyne	ADRB3	0	41
Cn1ccnc1[C@H]1N(c2ncnc3scc(-c4ccccc4)c23)CC1(C)C	ZINC000450652178	GJ	On-Demand	Anodyne	ADRB3	0	41
c1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450652179	CG	On-Demand	Anodyne	GSK3A	27	41
c1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450652180	CG	On-Demand	Anodyne	GSK3A	27	41
CC[C@@H]1C[C@H]1C(=O)N1CCN([C@@H](C)c2ccsc2)CC1	ZINC000450652181	CF	On-Demand	Anodyne	NPBWR1	47	38
CC[C@@H]1C[C@H]1C(=O)N1CCN([C@H](C)c2ccsc2)CC1	ZINC000450652182	CF	On-Demand	Anodyne	NPBWR1	47	38
C[C@@H](c1ccsc1)N1CCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)CC1	ZINC000450652184	EG	On-Demand	Anodyne	NPBWR1	48	38
C[C@H](c1ccsc1)N1CCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)CC1	ZINC000450652185	EG	On-Demand	Anodyne	NPBWR1	48	38
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCN([C@H](C)c2ccsc2)CC1	ZINC000450652188	DH	On-Demand	Anodyne	NPBWR1	46	35
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCN([C@@H](C)c2ccsc2)CC1	ZINC000450652189	DH	On-Demand	Anodyne	NPBWR1	46	35
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)CN1C	ZINC000450652198	CF	On-Demand	Anodyne	DRD2	29	42
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)CN1C	ZINC000450652198	CF	On-Demand	Anodyne	DRD4	0	51
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)CN1C	ZINC000450652198	CF	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)CN1C	ZINC000450652198	CF	On-Demand	Anodyne	CYP2J2	49	35
C[C@H]1CN(C)[C@H](C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450652199	CF	On-Demand	Anodyne	DRD2	29	42
C[C@H]1CN(C)[C@H](C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450652199	CF	On-Demand	Anodyne	DRD4	0	51
C[C@H]1CN(C)[C@H](C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450652199	CF	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1CN(C)[C@H](C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450652199	CF	On-Demand	Anodyne	CYP2J2	49	35
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)CN1C	ZINC000450652200	CF	On-Demand	Anodyne	DRD2	29	42
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)CN1C	ZINC000450652200	CF	On-Demand	Anodyne	DRD4	0	51
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)CN1C	ZINC000450652200	CF	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)CN1C	ZINC000450652200	CF	On-Demand	Anodyne	CYP2J2	49	35
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)CN1C	ZINC000450652201	CF	On-Demand	Anodyne	DRD2	29	42
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)CN1C	ZINC000450652201	CF	On-Demand	Anodyne	DRD4	0	51
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)CN1C	ZINC000450652201	CF	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)CN1C	ZINC000450652201	CF	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCC(=O)C1CC1)NCc1cccc(-c2cccnc2)c1	ZINC000450652241	DH	On-Demand	Anodyne	CHRNA7	27	43
O=C(CCCC(=O)C1CC1)NCc1cccc(-c2cccnc2)c1	ZINC000450652241	DH	On-Demand	Anodyne	NAMPT	56	36
O=C(CCCC(=O)C1CC1)NCc1cccc(-c2cccnc2)c1	ZINC000450652241	DH	On-Demand	Anodyne	SUCNR1	42	41
CC[C@@H]1CCC[C@@H]1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450652242	DG	On-Demand	Anodyne	PREP	15	41
CC[C@@H]1CCC[C@@H]1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450652242	DG	On-Demand	Anodyne	RHODESAIN	0	40
CC[C@@H]1CCC[C@@H]1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450652243	DG	On-Demand	Anodyne	PREP	15	41
CC[C@@H]1CCC[C@@H]1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450652243	DG	On-Demand	Anodyne	RHODESAIN	0	40
CC[C@@H]1CCC[C@H]1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450652244	DG	On-Demand	Anodyne	PREP	15	41
CC[C@@H]1CCC[C@H]1C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450652244	DG	On-Demand	Anodyne	RHODESAIN	0	40
CC[C@@H]1CCC[C@H]1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450652245	DG	On-Demand	Anodyne	PREP	15	41
CC[C@@H]1CCC[C@H]1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450652245	DG	On-Demand	Anodyne	RHODESAIN	0	40
Cc1cccc(Cl)c1CN1CCC[C@H]1c1ncc[nH]1	ZINC000450652251	CH	On-Demand	Anodyne	ADRA1A	18	40
Cc1cccc(Cl)c1CN1CCC[C@@H]1c1ncc[nH]1	ZINC000450652252	CH	On-Demand	Anodyne	ADRA1A	18	40
CCS(=O)(=O)c1ccc(CN(C)CCNC(=O)N(C)C)cc1	ZINC000450652255	ED	On-Demand	Anodyne	RORC	40	41
Cc1cccc2c1C[C@@H](C(=O)Nc1cccc(C(=O)N3CCC(O)CC3)c1)O2	ZINC000450652257	GF	On-Demand	Anodyne	NPY2R	19	41
Cc1cccc2c1C[C@@H](C(=O)Nc1cccc(C(=O)N3CCC(O)CC3)c1)O2	ZINC000450652257	GF	On-Demand	Anodyne	EPHX2	17	44
Cc1cccc2c1C[C@@H](C(=O)Nc1cccc(C(=O)N3CCC(O)CC3)c1)O2	ZINC000450652257	GF	On-Demand	Anodyne	RHOA	0	40
Cc1cccc2c1C[C@H](C(=O)Nc1cccc(C(=O)N3CCC(O)CC3)c1)O2	ZINC000450652259	GF	On-Demand	Anodyne	NPY2R	19	41
Cc1cccc2c1C[C@H](C(=O)Nc1cccc(C(=O)N3CCC(O)CC3)c1)O2	ZINC000450652259	GF	On-Demand	Anodyne	EPHX2	17	44
Cc1cccc2c1C[C@H](C(=O)Nc1cccc(C(=O)N3CCC(O)CC3)c1)O2	ZINC000450652259	GF	On-Demand	Anodyne	RHOA	0	40
COc1cc(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)ccc1Cl	ZINC000450652273	FG	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)ccc1Cl	ZINC000450652273	FG	On-Demand	Anodyne	OPRK1	43	45
COc1cc(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)ccc1Cl	ZINC000450652273	FG	On-Demand	Anodyne	FDFT1	33	42
COc1cc(CC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)ccc1Cl	ZINC000450652273	FG	On-Demand	Anodyne	RHODESAIN	0	41
COc1cc(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)ccc1Cl	ZINC000450652275	FG	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)ccc1Cl	ZINC000450652275	FG	On-Demand	Anodyne	OPRK1	43	45
COc1cc(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)ccc1Cl	ZINC000450652275	FG	On-Demand	Anodyne	FDFT1	33	42
COc1cc(CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)ccc1Cl	ZINC000450652275	FG	On-Demand	Anodyne	RHODESAIN	0	41
CCn1c(SCc2nc(C(=O)OC)cs2)nc2ccccc2c1=O	ZINC000450652288	FF	On-Demand	Anodyne	SLC27A1	42	38
NC(=O)CCC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450652292	CF	On-Demand	Anodyne	SLC6A1	35	42
NC(=O)CCC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450652292	CF	On-Demand	Anodyne	PTGER4	40	32
NC(=O)CCC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450652292	CF	On-Demand	Anodyne	SIGMAR1	39	57
NC(=O)CCC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450652292	CF	On-Demand	Anodyne	CACNA1I	54	36
NC(=O)CCC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450652292	CF	On-Demand	Anodyne	CYP2J2	49	37
Cc1ccc(Br)cc1CN(C)CCNC(=O)N(C)C	ZINC000450652293	EE	On-Demand	Anodyne	PSBA	0	40
CSCC1CCC(Nc2nccc(CO)n2)CC1	ZINC000450652294	CE	On-Demand	Anodyne	MAPK1	50	33
COC[C@H](C)n1c(SCc2ccc(C(C)=O)cc2)nc2ccccc2c1=O	ZINC000450652304	GI	On-Demand	Anodyne	PTGDR2	15	42
COC[C@@H](C)n1c(SCc2ccc(C(C)=O)cc2)nc2ccccc2c1=O	ZINC000450652305	GI	On-Demand	Anodyne	PTGDR2	15	42
CC(C)C(=O)NCCN(C)Cc1cn(CC2CC2)nn1	ZINC000450652306	CC	On-Demand	Anodyne	SCARB1	40	31
CC(C)c1nnc(CN2CCC(Cc3cccnc3)CC2)s1	ZINC000450652312	DH	On-Demand	Anodyne	CHRNA7	45	37
CCS(=O)(=O)c1ccc(CN(C(C)C)C(C)C)cc1	ZINC000450652314	CG	On-Demand	Anodyne	RORC	23	42
Cc1cccc2c1C[C@H](C(=O)Nc1cccc(C(=O)N3CCC[C@H](CO)C3)c1)O2	ZINC000450652317	GF	On-Demand	Anodyne	RHOA	0	43
Cc1cccc2c1C[C@@H](C(=O)Nc1cccc(C(=O)N3CCC[C@@H](CO)C3)c1)O2	ZINC000450652318	GF	On-Demand	Anodyne	RHOA	0	43
Cc1cccc2c1C[C@H](C(=O)Nc1cccc(C(=O)N3CCC[C@@H](CO)C3)c1)O2	ZINC000450652319	GF	On-Demand	Anodyne	RHOA	0	43
Cc1cccc2c1C[C@@H](C(=O)Nc1cccc(C(=O)N3CCC[C@H](CO)C3)c1)O2	ZINC000450652320	GF	On-Demand	Anodyne	RHOA	0	43
CC(C)O[C@@]1(C(=O)NCc2cccc(-c3cccnc3)c2)CCOC1	ZINC000450652330	EF	On-Demand	Anodyne	NAMPT	43	39
CC(C)O[C@]1(C(=O)NCc2cccc(-c3cccnc3)c2)CCOC1	ZINC000450652331	EF	On-Demand	Anodyne	NAMPT	43	39
C[C@H](CN1CCC(Cc2cccnc2)CC1)S(C)(=O)=O	ZINC000450652335	CD	On-Demand	Anodyne	NPY2R	50	34
C[C@H](CN1CCC(Cc2cccnc2)CC1)S(C)(=O)=O	ZINC000450652335	CD	On-Demand	Anodyne	C3AR1	41	38
C[C@H](CN1CCC(Cc2cccnc2)CC1)S(C)(=O)=O	ZINC000450652335	CD	On-Demand	Anodyne	ACHP_LYMST	21	40
C[C@@H](CN1CCC(Cc2cccnc2)CC1)S(C)(=O)=O	ZINC000450652336	CD	On-Demand	Anodyne	NPY2R	50	34
C[C@@H](CN1CCC(Cc2cccnc2)CC1)S(C)(=O)=O	ZINC000450652336	CD	On-Demand	Anodyne	C3AR1	41	38
C[C@@H](CN1CCC(Cc2cccnc2)CC1)S(C)(=O)=O	ZINC000450652336	CD	On-Demand	Anodyne	ACHP_LYMST	21	40
CCNC(=O)c1ccc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nn1	ZINC000450652337	GC	On-Demand	Anodyne	CA2	59	39
CCNC(=O)c1ccc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nn1	ZINC000450652337	GC	On-Demand	Anodyne	CA1	43	39
CCNC(=O)c1ccc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nn1	ZINC000450652337	GC	On-Demand	Anodyne	CA4	42	37
COC(=O)C1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450652344	GC	On-Demand	Anodyne	DRD4	41	32
COC(=O)C1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450652344	GC	On-Demand	Anodyne	HTR7	28	43
COC(=O)C1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450652344	GC	On-Demand	Anodyne	MTNR1A	54	41
COC(=O)C1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450652344	GC	On-Demand	Anodyne	MTNR1B	41	41
Cc1cccc2nc(N(C)CCN(C)c3ccc(S(N)(=O)=O)cc3)sc12	ZINC000450652360	GF	On-Demand	Anodyne	DKK1	0	41
CC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450652388	DH	On-Demand	Anodyne	DRD2	0	45
CC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450652388	DH	On-Demand	Anodyne	ACHE	0	47
CC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450652388	DH	On-Demand	Anodyne	DRD3	0	40
CC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450652388	DH	On-Demand	Anodyne	TBXAS1	0	41
CC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450652388	DH	On-Demand	Anodyne	SSTR5	44	35
CC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450652388	DH	On-Demand	Anodyne	BCHE	0	48
COCC1(C)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450652398	CH	On-Demand	Anodyne	DRD4	16	42
COCC1(C)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450652398	CH	On-Demand	Anodyne	SIGMAR1	35	46
C[C@@H](CC(F)(F)F)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450652410	CG	On-Demand	Anodyne	SDH1	0	44
C[C@H](CC(F)(F)F)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450652411	CG	On-Demand	Anodyne	SDH1	0	44
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652420	FG	On-Demand	Anodyne	PTGS2	0	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652420	FG	On-Demand	Anodyne	NQO2	23	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652420	FG	On-Demand	Anodyne	MTNR1A	72	43
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652420	FG	On-Demand	Anodyne	MTNR1B	65	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652420	FG	On-Demand	Anodyne	ACAT	0	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652421	FG	On-Demand	Anodyne	PTGS2	0	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652421	FG	On-Demand	Anodyne	NQO2	23	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652421	FG	On-Demand	Anodyne	MTNR1A	72	43
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652421	FG	On-Demand	Anodyne	MTNR1B	65	39
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2OC)c(OC)c1	ZINC000450652421	FG	On-Demand	Anodyne	ACAT	0	40
Cc1oc2ccccc2c1CCNC(=O)C1(CF)CCOCC1	ZINC000450652427	DG	On-Demand	Anodyne	MTNR1A	16	42
NS(=O)(=O)[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450652448	CD	On-Demand	Anodyne	SLC6A1	96	42
NS(=O)(=O)[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450652449	CD	On-Demand	Anodyne	SLC6A1	96	42
NS(=O)(=O)[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450652450	CD	On-Demand	Anodyne	SLC6A1	96	42
NS(=O)(=O)[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450652451	CD	On-Demand	Anodyne	SLC6A1	96	42
NS(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450652452	DD	On-Demand	Anodyne	HRH3	26	40
NS(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450652452	DD	On-Demand	Anodyne	BIRC2	45	46
NS(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450652453	DD	On-Demand	Anodyne	HRH3	26	40
NS(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450652453	DD	On-Demand	Anodyne	BIRC2	45	46
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652459	GF	On-Demand	Anodyne	CA2	47	41
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652459	GF	On-Demand	Anodyne	CA1	43	41
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652459	GF	On-Demand	Anodyne	CA7	32	40
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652459	GF	On-Demand	Anodyne	CA13	21	40
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652459	GF	On-Demand	Anodyne	CA12	25	41
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652459	GF	On-Demand	Anodyne	CA9	38	41
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652460	GF	On-Demand	Anodyne	CA2	47	41
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652460	GF	On-Demand	Anodyne	CA1	43	41
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652460	GF	On-Demand	Anodyne	CA7	32	40
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652460	GF	On-Demand	Anodyne	CA13	21	40
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652460	GF	On-Demand	Anodyne	CA12	25	41
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652460	GF	On-Demand	Anodyne	CA9	38	41
COCC1(C)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450652461	EG	On-Demand	Anodyne	MCHR2	44	36
COCC1(C)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450652461	EG	On-Demand	Anodyne	NPFFR1	43	39
COc1cccc(-n2cc(C(=O)N[C@H](C)CC(F)(F)F)nn2)c1	ZINC000450652464	EE	On-Demand	Anodyne	DRD4	40	32
COc1cccc(-n2cc(C(=O)N[C@@H](C)CC(F)(F)F)nn2)c1	ZINC000450652465	EE	On-Demand	Anodyne	DRD4	40	32
Cc1cnc(CCCC(=O)NCc2c(OC(C)C)ccc3ccccc23)o1	ZINC000450652468	FJ	On-Demand	Anodyne	SUCNR1	46	36
C[C@H](CC(F)(F)F)NC(=O)CCc1ccc2ccccc2c1O	ZINC000450652470	EH	On-Demand	Anodyne	KCNJ11	61	39
C[C@@H](CC(F)(F)F)NC(=O)CCc1ccc2ccccc2c1O	ZINC000450652471	EH	On-Demand	Anodyne	KCNJ11	61	39
Nc1ncccc1CN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450652481	EI	On-Demand	Anodyne	GRM2	17	58
COC(=O)c1cccc(CN2CCC[C@@H](S(N)(=O)=O)C2)c1Cl	ZINC000450652488	ED	On-Demand	Anodyne	SLC6A1	61	35
COC(=O)c1cccc(CN2CCC[C@H](S(N)(=O)=O)C2)c1Cl	ZINC000450652489	ED	On-Demand	Anodyne	SLC6A1	61	35
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)CC(F)(F)F	ZINC000450652490	DI	On-Demand	Anodyne	SORT1	16	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450652491	DI	On-Demand	Anodyne	SORT1	16	43
COCCOC[C@H](O)CN1CC[C@](O)(Cc2cccc(Cl)c2)C1	ZINC000450652496	ED	On-Demand	Anodyne	HSP90AB1	34	42
OC[C@]1(F)CN(c2ccc3ccccc3n2)C[C@H]1c1ccccc1	ZINC000450652520	DH	On-Demand	Anodyne	HTR3A	18	44
OC[C@]1(F)CN(c2ccc3ccccc3n2)C[C@H]1c1ccccc1	ZINC000450652520	DH	On-Demand	Anodyne	SORD	18	47
OC[C@@]1(F)CN(c2ccc3ccccc3n2)C[C@H]1c1ccccc1	ZINC000450652521	DH	On-Demand	Anodyne	HTR3A	18	44
OC[C@@]1(F)CN(c2ccc3ccccc3n2)C[C@@H]1c1ccccc1	ZINC000450652522	DH	On-Demand	Anodyne	HTR3A	18	44
OC[C@@]1(F)CN(c2ccc3ccccc3n2)C[C@@H]1c1ccccc1	ZINC000450652522	DH	On-Demand	Anodyne	SORD	18	47
OC[C@]1(F)CN(c2ccc3ccccc3n2)C[C@@H]1c1ccccc1	ZINC000450652523	DH	On-Demand	Anodyne	HTR3A	18	44
OC[C@]1(F)CN(c2ccc3ccccc3n2)C[C@@H]1c1ccccc1	ZINC000450652523	DH	On-Demand	Anodyne	SORD	18	47
COCCn1c(NC(=O)Cc2ccc(Cl)c(OC)c2)nc2ccccc21	ZINC000450652524	FH	On-Demand	Anodyne	ITK	26	40
COCCn1c(NC(=O)Cc2ccc(Cl)c(OC)c2)nc2ccccc21	ZINC000450652524	FH	On-Demand	Anodyne	ALDH3A1	16	40
COCCn1c(NC(=O)Cc2ccc(Cl)c(OC)c2)nc2ccccc21	ZINC000450652524	FH	On-Demand	Anodyne	IMDH_CRYPV	42	42
CCOC(=O)c1ccc(CN2CCC(CCCN(C)C)CC2)nc1	ZINC000450652533	EF	On-Demand	Anodyne	SSTR5	45	37
Cc1ccc(C(=O)N2CCN(C(=O)C3CC3)CC2(C)C)c2c1CCC2	ZINC000450652534	EF	On-Demand	Anodyne	L3MBTL3	41	32
O=C(NC1CC1)c1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450652560	GF	On-Demand	Bother	TAAR1	18	40
O=C(NC1CC1)c1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450652561	GF	On-Demand	Bother	TAAR1	18	40
O=C(NC1CC1)c1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450652562	GF	On-Demand	Bother	TAAR1	18	40
O=C(NC1CC1)c1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC000450652563	GF	On-Demand	Bother	TAAR1	18	40
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(O)C2)c(OC)c1	ZINC000450652568	ED	On-Demand	Anodyne	HTR7	24	40
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(O)C2)c(OC)c1	ZINC000450652568	ED	On-Demand	Anodyne	MTNR1A	46	36
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(O)C2)c(OC)c1	ZINC000450652568	ED	On-Demand	Anodyne	MTNR1B	32	40
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(O)C2)c(OC)c1	ZINC000450652568	ED	On-Demand	Anodyne	EBP	33	43
COc1ccc(CNC(=O)CCN2CCC[C@](C)(O)C2)c(OC)c1	ZINC000450652569	ED	On-Demand	Anodyne	HTR7	24	40
COc1ccc(CNC(=O)CCN2CCC[C@](C)(O)C2)c(OC)c1	ZINC000450652569	ED	On-Demand	Anodyne	MTNR1A	46	36
COc1ccc(CNC(=O)CCN2CCC[C@](C)(O)C2)c(OC)c1	ZINC000450652569	ED	On-Demand	Anodyne	MTNR1B	32	40
COc1ccc(CNC(=O)CCN2CCC[C@](C)(O)C2)c(OC)c1	ZINC000450652569	ED	On-Demand	Anodyne	EBP	33	43
CCOC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)ccc1[N+](=O)[O-]	ZINC000450652594	GG	On-Demand	Bother	CACNA1C	61	41
CCOC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)ccc1[N+](=O)[O-]	ZINC000450652594	GG	On-Demand	Bother	CACNA1D	92	41
CCOC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)ccc1[N+](=O)[O-]	ZINC000450652595	GG	On-Demand	Bother	CACNA1C	61	41
CCOC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)ccc1[N+](=O)[O-]	ZINC000450652595	GG	On-Demand	Bother	CACNA1D	92	41
CCC1(CO)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450652610	CG	On-Demand	Anodyne	SIGMAR1	28	42
CCC1(CO)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450652610	CG	On-Demand	Anodyne	SSTR5	47	37
CCC1(CO)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450652610	CG	On-Demand	Anodyne	MCHR2	43	32
COC(=O)c1ccc(CC(=O)N2CCN([C@@H](C)c3ccsc3)CC2)cc1	ZINC000450652614	FF	On-Demand	Anodyne	HRH3	16	46
COC(=O)c1ccc(CC(=O)N2CCN([C@H](C)c3ccsc3)CC2)cc1	ZINC000450652615	FF	On-Demand	Anodyne	HRH3	16	46
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2[C@H](C)O)c1	ZINC000450652617	DF	On-Demand	Anodyne	SLC6A1	25	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2[C@H](C)O)c1	ZINC000450652617	DF	On-Demand	Anodyne	COLA	44	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2[C@H](C)O)c1	ZINC000450652617	DF	On-Demand	Anodyne	CPT2	41	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2[C@H](C)O)c1	ZINC000450652617	DF	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2[C@H](C)O)c1	ZINC000450652618	DF	On-Demand	Anodyne	SLC6A1	25	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2[C@H](C)O)c1	ZINC000450652618	DF	On-Demand	Anodyne	COLA	44	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2[C@H](C)O)c1	ZINC000450652618	DF	On-Demand	Anodyne	CPT2	41	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2[C@H](C)O)c1	ZINC000450652618	DF	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2[C@@H](C)O)c1	ZINC000450652619	DF	On-Demand	Anodyne	SLC6A1	25	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2[C@@H](C)O)c1	ZINC000450652619	DF	On-Demand	Anodyne	COLA	44	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2[C@@H](C)O)c1	ZINC000450652619	DF	On-Demand	Anodyne	CPT2	41	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2[C@@H](C)O)c1	ZINC000450652619	DF	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2[C@@H](C)O)c1	ZINC000450652620	DF	On-Demand	Anodyne	SLC6A1	25	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2[C@@H](C)O)c1	ZINC000450652620	DF	On-Demand	Anodyne	COLA	44	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2[C@@H](C)O)c1	ZINC000450652620	DF	On-Demand	Anodyne	CPT2	41	36
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2[C@@H](C)O)c1	ZINC000450652620	DF	On-Demand	Anodyne	GPR88	0	42
FC1(F)CCCC[C@@H]1CSc1nnc(-c2ccccc2)o1	ZINC000450652622	DJ	On-Demand	Anodyne	GSK3A	39	42
FC1(F)CCCC[C@H]1CSc1nnc(-c2ccccc2)o1	ZINC000450652623	DJ	On-Demand	Anodyne	GSK3A	39	42
C[C@@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450652648	FG	On-Demand	Anodyne	CHRNA9	0	40
C[C@@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450652648	FG	On-Demand	Anodyne	PRCP	15	40
C[C@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450652649	FG	On-Demand	Anodyne	CHRNA9	0	40
C[C@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450652649	FG	On-Demand	Anodyne	PRCP	15	40
C[C@@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450652650	FG	On-Demand	Anodyne	CHRNA9	0	40
C[C@@H](O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450652650	FG	On-Demand	Anodyne	PRCP	15	40
CSCC1CCC(Nc2ccc(C(=O)NCCO)nn2)CC1	ZINC000450652659	DC	On-Demand	Anodyne	SCD1	23	40
CC(=O)c1ccc(CN2C[C@H](C)[C@@H](O)C2)cc1	ZINC000450652660	BD	On-Demand	Anodyne	MLNR	55	38
CC(=O)c1ccc(CN2C[C@H](C)[C@H](O)C2)cc1	ZINC000450652661	BD	On-Demand	Anodyne	MLNR	55	38
CC(=O)c1ccc(CN2C[C@@H](O)[C@H](C)C2)cc1	ZINC000450652662	BD	On-Demand	Anodyne	MLNR	55	38
CC(=O)c1ccc(CN2C[C@@H](C)[C@@H](O)C2)cc1	ZINC000450652664	BD	On-Demand	Anodyne	MLNR	55	38
CC(C)(CC(=O)CSc1nnc(-c2ccccc2)o1)C1CC1	ZINC000450652673	DI	On-Demand	Anodyne	GSK3A	30	40
CC(C)(CC(=O)CSc1nnc(-c2ccccc2)o1)C1CC1	ZINC000450652673	DI	On-Demand	Anodyne	ALOX15	50	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCCC[C@@H]1c1nc[nH]n1	ZINC000450652679	DE	On-Demand	Anodyne	COLA	57	32
C[C@H](c1ccccc1)[C@@H](O)CN1CCCC[C@@H]1c1nc[nH]n1	ZINC000450652679	DE	On-Demand	Anodyne	CPT1A	57	32
C[C@H](c1ccccc1)[C@H](O)CN1CCCC[C@@H]1c1nc[nH]n1	ZINC000450652680	DE	On-Demand	Anodyne	COLA	57	32
C[C@H](c1ccccc1)[C@H](O)CN1CCCC[C@@H]1c1nc[nH]n1	ZINC000450652680	DE	On-Demand	Anodyne	CPT1A	57	32
C[C@H](c1ccccc1)[C@@H](O)CN1CCCC[C@H]1c1nc[nH]n1	ZINC000450652681	DE	On-Demand	Anodyne	COLA	57	32
C[C@H](c1ccccc1)[C@@H](O)CN1CCCC[C@H]1c1nc[nH]n1	ZINC000450652681	DE	On-Demand	Anodyne	CPT1A	57	32
C[C@H](c1ccccc1)[C@H](O)CN1CCCC[C@H]1c1nc[nH]n1	ZINC000450652682	DE	On-Demand	Anodyne	COLA	57	32
C[C@H](c1ccccc1)[C@H](O)CN1CCCC[C@H]1c1nc[nH]n1	ZINC000450652682	DE	On-Demand	Anodyne	CPT1A	57	32
C[C@H](c1ccsc1)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652704	FG	On-Demand	Anodyne	NMUR2	0	40
C[C@H](c1ccsc1)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652704	FG	On-Demand	Anodyne	NMUR1	0	40
C[C@H](c1ccsc1)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652704	FG	On-Demand	Anodyne	NPBWR1	40	35
C[C@H](c1ccsc1)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652706	FG	On-Demand	Anodyne	NMUR2	0	40
C[C@H](c1ccsc1)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652706	FG	On-Demand	Anodyne	NMUR1	0	40
C[C@H](c1ccsc1)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652706	FG	On-Demand	Anodyne	NPBWR1	40	35
C[C@@H](c1ccsc1)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652708	FG	On-Demand	Anodyne	NMUR2	0	40
C[C@@H](c1ccsc1)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652708	FG	On-Demand	Anodyne	NMUR1	0	40
C[C@@H](c1ccsc1)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652708	FG	On-Demand	Anodyne	NPBWR1	40	35
O=C(NCc1cccc(-c2cccnc2)c1)C1(C(F)(F)F)CCC1	ZINC000450652709	EI	On-Demand	Anodyne	CYP11B2	40	34
O=C(NCc1cccc(-c2cccnc2)c1)C1(C(F)(F)F)CCC1	ZINC000450652709	EI	On-Demand	Anodyne	NAMPT	59	38
C[C@@H](c1ccsc1)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652710	FG	On-Demand	Anodyne	NMUR2	0	40
C[C@@H](c1ccsc1)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652710	FG	On-Demand	Anodyne	NMUR1	0	40
C[C@@H](c1ccsc1)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450652710	FG	On-Demand	Anodyne	NPBWR1	40	35
COc1cc(OC)c2ncnc(N3CCOC[C@@H](O)C3)c2c1	ZINC000450652721	DC	On-Demand	Anodyne	PDE3A	50	39
COc1cc(OC)c2ncnc(N3CCOC[C@@H](O)C3)c2c1	ZINC000450652721	DC	On-Demand	Anodyne	PDE3B	73	39
COc1cc(OC)c2ncnc(N3CCOC[C@H](O)C3)c2c1	ZINC000450652726	DC	On-Demand	Anodyne	PDE3A	50	39
COc1cc(OC)c2ncnc(N3CCOC[C@H](O)C3)c2c1	ZINC000450652726	DC	On-Demand	Anodyne	PDE3B	73	39
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2cc3ccccc3c(O)n2)C1	ZINC000450652728	FG	On-Demand	Anodyne	RHODESAIN	0	44
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2cc3ccccc3c(O)n2)C1	ZINC000450652730	FG	On-Demand	Anodyne	RHODESAIN	0	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@@H]3[C@@H](C)O)cc2)c1	ZINC000450652743	GG	On-Demand	Anodyne	CHRM3	15	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@@H]3[C@@H](C)O)cc2)c1	ZINC000450652743	GG	On-Demand	Anodyne	MMP13	18	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@@H]3[C@@H](C)O)cc2)c1	ZINC000450652743	GG	On-Demand	Anodyne	TMPRSS11D	41	34
CCOC(=O)c1ccc(CN2CCC(CCC(N)=O)CC2)nc1	ZINC000450652750	DD	On-Demand	Anodyne	SSTR5	44	36
CCCN(CCc1cccs1)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450652751	FI	On-Demand	Anodyne	TSPO	28	43
CSCC1CCC(Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1	ZINC000450652770	GE	On-Demand	Anodyne	TGM2	35	42
CCCc1cnc(NC(=O)[C@@H](O)C2CCC2)s1	ZINC000450652771	CE	On-Demand	Anodyne	CDK5	46	36
CCCc1cnc(NC(=O)[C@H](O)C2CCC2)s1	ZINC000450652772	CE	On-Demand	Anodyne	CDK5	46	36
CCC(=O)CCCN1CCC(OCc2ccccc2OC)CC1	ZINC000450652777	DG	On-Demand	Anodyne	HTR1A	54	42
CCC(=O)CCCN1CCC(OCc2ccccc2OC)CC1	ZINC000450652777	DG	On-Demand	Anodyne	DRD2	49	41
CCC(=O)CCCN1CCC(OCc2ccccc2OC)CC1	ZINC000450652777	DG	On-Demand	Anodyne	HRH1	18	42
CCC(=O)CCCN1CCC(OCc2ccccc2OC)CC1	ZINC000450652777	DG	On-Demand	Anodyne	DRD3	40	35
CCC(=O)CCCN1CCC(OCc2ccccc2OC)CC1	ZINC000450652777	DG	On-Demand	Anodyne	HTR7	57	42
CCC(=O)CCCN1CCC(OCc2ccccc2OC)CC1	ZINC000450652777	DG	On-Demand	Anodyne	CACNA1G	15	40
CCC(=O)CCCN1CCC(OCc2ccccc2OC)CC1	ZINC000450652777	DG	On-Demand	Anodyne	CYP2J2	50	35
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652778	FI	On-Demand	Anodyne	NQO2	34	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652778	FI	On-Demand	Anodyne	TRPV1	0	50
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652778	FI	On-Demand	Anodyne	MTR1B_CHICK	0	50
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652778	FI	On-Demand	Anodyne	HTR6	46	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652778	FI	On-Demand	Anodyne	PPARD	44	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652778	FI	On-Demand	Anodyne	EBP	17	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652779	FI	On-Demand	Anodyne	NQO2	34	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652779	FI	On-Demand	Anodyne	TRPV1	0	50
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652779	FI	On-Demand	Anodyne	MTR1B_CHICK	0	50
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652779	FI	On-Demand	Anodyne	HTR6	46	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652779	FI	On-Demand	Anodyne	PPARD	44	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450652779	FI	On-Demand	Anodyne	EBP	17	41
O=C(c1cccnc1-n1cc(Br)cn1)N1CCC(F)(F)C1	ZINC000450652785	FF	On-Demand	Anodyne	DPP7	23	42
Cc1ccc(NC(=O)CC2CC(F)(F)C2)cc1NC(=O)CCN(C)C	ZINC000450652808	FG	On-Demand	Anodyne	LDLR	0	43
C[C@@H](CCCCO)Nc1ncccc1OCc1ccccc1	ZINC000450652809	DH	On-Demand	Anodyne	PPIA	54	43
C[C@H](CCCCO)Nc1ncccc1OCc1ccccc1	ZINC000450652810	DH	On-Demand	Anodyne	PPIA	54	43
C[C@H]1CN(CCOC2CCN(CCc3cscn3)CC2)C[C@H](C)O1	ZINC000450652831	FE	On-Demand	Anodyne	SCN5A	40	33
C[C@@H]1CN(CCOC2CCN(CCc3cscn3)CC2)C[C@@H](C)O1	ZINC000450652832	FE	On-Demand	Anodyne	SCN5A	40	33
C[C@H]1CN(CCOC2CCN(CCc3cscn3)CC2)C[C@@H](C)O1	ZINC000450652833	FE	On-Demand	Anodyne	SCN5A	40	33
COC(=O)c1ccc(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)cc1	ZINC000450652882	GE	On-Demand	Anodyne	NPY2R	22	40
COC(=O)c1ccc(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)cc1	ZINC000450652882	GE	On-Demand	Anodyne	CCR3	42	43
COC(=O)c1ccc(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)cc1	ZINC000450652882	GE	On-Demand	Anodyne	EPHX2	26	43
COC(=O)c1ccc(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)cc1	ZINC000450652882	GE	On-Demand	Anodyne	ST14	40	34
COC(=O)c1ccc(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)cc1	ZINC000450652882	GE	On-Demand	Anodyne	HIF1A	16	41
COC(=O)c1ccc(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)cc1	ZINC000450652882	GE	On-Demand	Anodyne	L3MBTL3	65	39
CC(C)c1nccc(N2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)n1	ZINC000450652886	CD	On-Demand	Anodyne	SORD	81	35
CC(C)c1nccc(N2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)n1	ZINC000450652887	CD	On-Demand	Anodyne	SORD	81	35
CC(C)c1nccc(N2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)n1	ZINC000450652888	CD	On-Demand	Anodyne	SORD	81	35
CC(C)c1nccc(N2C[C@H](O)C[C@H]2[C@H]2CCCOC2)n1	ZINC000450652889	CD	On-Demand	Anodyne	SORD	81	35
Cc1ccc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)cc1NC(=O)CCN(C)C	ZINC000450652890	EG	On-Demand	Anodyne	LDLR	0	42
Cc1ccc(NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)cc1NC(=O)CCN(C)C	ZINC000450652891	EG	On-Demand	Anodyne	LDLR	0	42
CC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)cc1	ZINC000450652892	EE	On-Demand	Anodyne	MLNR	42	34
Cc1ccc(NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)cc1NC(=O)CCN(C)C	ZINC000450652893	EG	On-Demand	Anodyne	LDLR	0	42
CC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)cc1	ZINC000450652894	EE	On-Demand	Anodyne	MLNR	42	34
Cc1ccc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)cc1NC(=O)CCN(C)C	ZINC000450652895	EG	On-Demand	Anodyne	LDLR	0	42
COC(=O)c1ccc2c(c1)CN(CC1(C#N)CCC1)CC2	ZINC000450652910	CF	On-Demand	Mild	NOD2	40	35
CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652914	EG	On-Demand	Anodyne	RHOA	0	41
CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652914	EG	On-Demand	Anodyne	L3MBTL1	0	46
CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652914	EG	On-Demand	Anodyne	L3MBTL3	71	42
CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652914	EG	On-Demand	Anodyne	MBTD1	0	44
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652916	EG	On-Demand	Anodyne	RHOA	0	41
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652916	EG	On-Demand	Anodyne	L3MBTL1	0	46
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652916	EG	On-Demand	Anodyne	L3MBTL3	71	42
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652916	EG	On-Demand	Anodyne	MBTD1	0	44
COCC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450652917	DH	On-Demand	Anodyne	THRA	0	40
COCC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450652917	DH	On-Demand	Anodyne	DRD1	25	57
COCC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450652917	DH	On-Demand	Anodyne	DRD4	28	57
COCC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450652917	DH	On-Demand	Anodyne	DRD3	0	57
COCC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450652917	DH	On-Demand	Anodyne	ADRA2B	0	57
COCC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450652917	DH	On-Demand	Anodyne	HTR7	25	43
COCC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450652917	DH	On-Demand	Anodyne	SLC18A3	24	58
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652918	EG	On-Demand	Anodyne	RHOA	0	41
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652918	EG	On-Demand	Anodyne	L3MBTL1	0	46
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652918	EG	On-Demand	Anodyne	L3MBTL3	71	42
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652918	EG	On-Demand	Anodyne	MBTD1	0	44
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652921	EG	On-Demand	Anodyne	RHOA	0	41
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652921	EG	On-Demand	Anodyne	L3MBTL1	0	46
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652921	EG	On-Demand	Anodyne	L3MBTL3	71	42
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450652921	EG	On-Demand	Anodyne	MBTD1	0	44
C[C@H]1CN(CCc2ccc(Cl)cc2)CCN1C1CCN(C)CC1	ZINC000450652931	EF	On-Demand	Anodyne	SIGMAR1	18	43
C[C@H]1CN(CCc2ccc(Cl)cc2)CCN1C1CCN(C)CC1	ZINC000450652931	EF	On-Demand	Anodyne	BIRC2	30	41
C[C@@H]1CN(CCc2ccc(Cl)cc2)CCN1C1CCN(C)CC1	ZINC000450652932	EF	On-Demand	Anodyne	SIGMAR1	18	43
C[C@@H]1CN(CCc2ccc(Cl)cc2)CCN1C1CCN(C)CC1	ZINC000450652932	EF	On-Demand	Anodyne	BIRC2	30	41
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)C1CCC1	ZINC000450652933	EG	On-Demand	Anodyne	RHOA	0	42
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)C1CCC1	ZINC000450652934	EG	On-Demand	Anodyne	RHOA	0	42
CN(CCN(C)c1ccc(S(N)(=O)=O)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652955	GB	On-Demand	Anodyne	CA2	41	39
CN(CCN(C)c1ccc(S(N)(=O)=O)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652955	GB	On-Demand	Anodyne	CA7	46	42
CN(CCN(C)c1ccc(S(N)(=O)=O)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652955	GB	On-Demand	Anodyne	CA12	29	47
CN(CCN(C)c1ccc(S(N)(=O)=O)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450652955	GB	On-Demand	Anodyne	CA9	34	42
Cc1cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)ccc1[N+](=O)[O-]	ZINC000450652958	GE	On-Demand	Bother	CA2	20	43
Cc1cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)ccc1[N+](=O)[O-]	ZINC000450652958	GE	On-Demand	Bother	CA7	16	40
Cc1cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)ccc1[N+](=O)[O-]	ZINC000450652958	GE	On-Demand	Bother	CA12	17	43
Cc1cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)ccc1[N+](=O)[O-]	ZINC000450652958	GE	On-Demand	Bother	CA9	18	40
Cc1cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)ccc1[N+](=O)[O-]	ZINC000450652958	GE	On-Demand	Bother	CYNT	17	40
Cc1cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)ccc1[N+](=O)[O-]	ZINC000450652958	GE	On-Demand	Bother	NCE103	15	40
CCC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450652959	FH	On-Demand	Anodyne	RHOA	0	43
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450652960	FH	On-Demand	Anodyne	RHOA	0	43
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450652961	FH	On-Demand	Anodyne	RHOA	0	43
CCC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450652962	FH	On-Demand	Anodyne	RHOA	0	43
Cc1cccc(Cl)c1CSc1nnc2n1CCCCC2	ZINC000450652968	DI	On-Demand	Anodyne	HSD11B2	20	42
CCOc1cc(-c2nnc(SCn3cccn3)o2)cc(OCC)c1OCC	ZINC000450652969	GH	On-Demand	Anodyne	TYMS	30	40
CCOC(=O)c1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)ccc1[N+](=O)[O-]	ZINC000450652996	GG	On-Demand	Bother	CACNA1C	61	41
CCOC(=O)c1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)ccc1[N+](=O)[O-]	ZINC000450652996	GG	On-Demand	Bother	CACNA1D	92	41
CCOC(=O)c1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)ccc1[N+](=O)[O-]	ZINC000450652997	GG	On-Demand	Bother	CACNA1C	61	41
CCOC(=O)c1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)ccc1[N+](=O)[O-]	ZINC000450652997	GG	On-Demand	Bother	CACNA1D	92	41
CC[C@@H]1[C@H](CO)CCN1c1ncnc2sc3c(c12)CCC3	ZINC000450653020	DF	On-Demand	Anodyne	RBP4	17	41
CC[C@H]1[C@H](CO)CCN1c1ncnc2sc3c(c12)CCC3	ZINC000450653021	DF	On-Demand	Anodyne	RBP4	17	41
CC[C@H]1[C@@H](CO)CCN1c1ncnc2sc3c(c12)CCC3	ZINC000450653022	DF	On-Demand	Anodyne	RBP4	17	41
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2sc3c(c12)CCC3	ZINC000450653023	DF	On-Demand	Anodyne	RBP4	17	41
COC(=O)[C@@H](CC(C)C)N(C)c1ccccc1[N+](=O)[O-]	ZINC000450653048	CF	On-Demand	Bother	COLA	99	39
COC(=O)[C@@H](CC(C)C)N(C)c1ccccc1[N+](=O)[O-]	ZINC000450653048	CF	On-Demand	Bother	NPR	32	41
COC(=O)[C@H](CC(C)C)N(C)c1ccccc1[N+](=O)[O-]	ZINC000450653049	CF	On-Demand	Bother	COLA	99	39
COC(=O)[C@H](CC(C)C)N(C)c1ccccc1[N+](=O)[O-]	ZINC000450653049	CF	On-Demand	Bother	NPR	32	41
COCCn1c(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)nc2ccccc21	ZINC000450653092	GF	On-Demand	Anodyne	INSR	29	42
COCCn1c(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)nc2ccccc21	ZINC000450653092	GF	On-Demand	Anodyne	HRH1	17	41
COCCn1c(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)nc2ccccc21	ZINC000450653092	GF	On-Demand	Anodyne	ITK	49	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@@H]3[C@H](C)O)cc2)c1	ZINC000450653101	GG	On-Demand	Anodyne	CHRM3	15	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@@H]3[C@H](C)O)cc2)c1	ZINC000450653101	GG	On-Demand	Anodyne	MMP13	18	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@@H]3[C@H](C)O)cc2)c1	ZINC000450653101	GG	On-Demand	Anodyne	TMPRSS11D	41	34
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@H]3[C@@H](C)O)cc2)c1	ZINC000450653102	GG	On-Demand	Anodyne	CHRM3	15	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@H]3[C@@H](C)O)cc2)c1	ZINC000450653102	GG	On-Demand	Anodyne	MMP13	18	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@H]3[C@@H](C)O)cc2)c1	ZINC000450653102	GG	On-Demand	Anodyne	TMPRSS11D	41	34
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@H]3[C@H](C)O)cc2)c1	ZINC000450653103	GG	On-Demand	Anodyne	CHRM3	15	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@H]3[C@H](C)O)cc2)c1	ZINC000450653103	GG	On-Demand	Anodyne	MMP13	18	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC[C@H]3[C@H](C)O)cc2)c1	ZINC000450653103	GG	On-Demand	Anodyne	TMPRSS11D	41	34
O=C(c1ccnn1CC(F)(F)F)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450653106	FE	On-Demand	Anodyne	P2RX7	27	44
N#Cc1cccc([C@@H]2CN(CCc3ccc(Cl)cc3)CCO2)c1	ZINC000450653109	EH	On-Demand	Mild	KCNJ1	39	41
N#Cc1cccc([C@H]2CN(CCc3ccc(Cl)cc3)CCO2)c1	ZINC000450653110	EH	On-Demand	Mild	KCNJ1	39	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H](OC)c2ccccc2F)c1	ZINC000450653112	FG	On-Demand	Anodyne	MTNR1B	30	44
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H](OC)c2ccccc2F)c1	ZINC000450653113	FG	On-Demand	Anodyne	MTNR1B	30	44
COc1cccc(OCCC(=O)N[C@H](C)[C@H](OC)c2ccccc2F)c1	ZINC000450653114	FG	On-Demand	Anodyne	MTNR1B	30	44
COc1cccc(OCCC(=O)N[C@@H](C)[C@H](OC)c2ccccc2F)c1	ZINC000450653115	FG	On-Demand	Anodyne	MTNR1B	30	44
C[C@H](O)[C@H]1CCCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450653116	CD	On-Demand	Anodyne	HPGDS	15	41
C[C@H](O)[C@@H]1CCCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450653117	CD	On-Demand	Anodyne	HPGDS	15	41
C[C@@H](O)[C@@H]1CCCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450653118	CD	On-Demand	Anodyne	HPGDS	15	41
Cc1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)O)c2c1CCC2	ZINC000450653127	CF	On-Demand	Anodyne	L3MBTL3	41	32
Cc1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)O)c2c1CCC2	ZINC000450653130	CF	On-Demand	Anodyne	L3MBTL3	41	32
Cc1ccc(C(=O)N2CCCC[C@H]2[C@H](C)O)c2c1CCC2	ZINC000450653131	CF	On-Demand	Anodyne	L3MBTL3	41	32
Cc1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)O)c2c1CCC2	ZINC000450653133	CF	On-Demand	Anodyne	L3MBTL3	41	32
COCCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450653143	DD	On-Demand	Anodyne	DRD2	35	45
COCCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450653143	DD	On-Demand	Anodyne	DRD1	26	49
COCCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450653143	DD	On-Demand	Anodyne	DRD4	0	45
COCCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450653143	DD	On-Demand	Anodyne	HTR2A	22	50
COCCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450653143	DD	On-Demand	Anodyne	SLC18A3	0	45
COCCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450653143	DD	On-Demand	Anodyne	CYP2J2	49	35
CO[C@@H](Cc1ccccc1)C(=O)NCc1cc(Br)cc2c1OCC2	ZINC000450653175	GG	On-Demand	Anodyne	AMP1_PLAFQ	58	37
CO[C@H](Cc1ccccc1)C(=O)NCc1cc(Br)cc2c1OCC2	ZINC000450653176	GG	On-Demand	Anodyne	AMP1_PLAFQ	58	37
CCn1nnc(C)c1CSc1nnc(-c2cccs2)n1C[C@H]1CCCO1	ZINC000450653184	GG	On-Demand	Anodyne	PDE8B	26	43
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(C)c(NC(=O)CCN(C)C)c1	ZINC000450653200	FI	On-Demand	Anodyne	LDLR	0	43
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc(C)c(NC(=O)CCN(C)C)c1	ZINC000450653201	FI	On-Demand	Anodyne	LDLR	0	43
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C)c(NC(=O)CCN(C)C)c1	ZINC000450653202	FI	On-Demand	Anodyne	LDLR	0	43
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(C)c(NC(=O)CCN(C)C)c1	ZINC000450653203	FI	On-Demand	Anodyne	LDLR	0	43
COc1cc(NC(=O)c2cc3n(n2)CCCC3)ccc1OC(C)C	ZINC000450653212	EG	On-Demand	Anodyne	COLA	46	37
COc1cc(NC(=O)c2cc3n(n2)CCCC3)ccc1OC(C)C	ZINC000450653212	EG	On-Demand	Anodyne	CPT2	41	35
COc1cc(NC(=O)c2cc3n(n2)CCCC3)ccc1OC(C)C	ZINC000450653212	EG	On-Demand	Anodyne	ENPP1	55	33
CCn1nnc(C)c1CSc1nnc(-c2cccs2)n1C[C@@H]1CCCO1	ZINC000450653216	GG	On-Demand	Anodyne	PDE8B	26	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450653233	GG	On-Demand	Anodyne	RIR1_HHV11	62	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450653233	GG	On-Demand	Anodyne	CACNA1B	20	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450653233	GG	On-Demand	Anodyne	RHODESAIN	0	61
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450653236	GG	On-Demand	Anodyne	RIR1_HHV11	62	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450653236	GG	On-Demand	Anodyne	CACNA1B	20	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450653236	GG	On-Demand	Anodyne	RHODESAIN	0	61
C[C@H](NC(=O)[C@@]1(C#N)C[C@H]1C)c1ccc(Cl)c2ccccc12	ZINC000450653238	DI	On-Demand	Mild	SDH1	0	41
Cc1ccc(NC(=O)c2ccc(C)c3c2CCC3)cc1NC(=O)CCN(C)C	ZINC000450653244	GH	On-Demand	Anodyne	MAPK14	19	40
Cc1ccc(NC(=O)c2ccc(C)c3c2CCC3)cc1NC(=O)CCN(C)C	ZINC000450653244	GH	On-Demand	Anodyne	F2R	0	41
Cc1ccc(NC(=O)c2ccc(C)c3c2CCC3)cc1NC(=O)CCN(C)C	ZINC000450653244	GH	On-Demand	Anodyne	LDLR	0	44
C[C@H](NC(=O)[C@@]1(C#N)C[C@@H]1C)c1ccc(Cl)c2ccccc12	ZINC000450653246	DI	On-Demand	Mild	SDH1	0	41
C[C@H](NC(=O)[C@]1(C#N)C[C@@H]1C)c1ccc(Cl)c2ccccc12	ZINC000450653248	DI	On-Demand	Mild	SDH1	0	41
C[C@H](NC(=O)[C@]1(C#N)C[C@H]1C)c1ccc(Cl)c2ccccc12	ZINC000450653250	DI	On-Demand	Mild	SDH1	0	41
C[C@H](c1ccccc1)[C@@H](O)CN(C)C[C@@H](O)C(F)(F)F	ZINC000450653251	CE	On-Demand	Anodyne	AOC3	21	40
CN(CCNC(=O)N(C)C)CCN(C)Cc1ccccc1	ZINC000450653255	CD	On-Demand	Anodyne	PSBA	0	42
C[C@H](c1ccccc1)[C@H](O)CN(C)C[C@@H](O)C(F)(F)F	ZINC000450653258	CE	On-Demand	Anodyne	AOC3	21	40
C[C@H](c1ccccc1)[C@H](O)CN(C)C[C@H](O)C(F)(F)F	ZINC000450653259	CE	On-Demand	Anodyne	AOC3	21	40
C[C@H](c1ccccc1)[C@@H](O)CN(C)C[C@H](O)C(F)(F)F	ZINC000450653260	CE	On-Demand	Anodyne	AOC3	21	40
CC(=O)[C@@](C)(O)CN1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000450653279	EE	On-Demand	Anodyne	SIGMAR1	39	43
CC(=O)[C@@](C)(O)CN1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000450653279	EE	On-Demand	Anodyne	MCHR2	40	33
CC(=O)[C@](C)(O)CN1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000450653283	EE	On-Demand	Anodyne	SIGMAR1	39	43
CC(=O)[C@](C)(O)CN1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000450653283	EE	On-Demand	Anodyne	MCHR2	40	33
C[C@@H](CN(C)Cc1ccccc1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450653300	GH	On-Demand	Anodyne	TIMP3	53	32
C[C@H](CN(C)Cc1ccccc1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450653302	GH	On-Demand	Anodyne	TIMP3	53	32
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)cn1	ZINC000450653311	GF	On-Demand	Anodyne	P2RX7	23	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)cn1	ZINC000450653311	GF	On-Demand	Anodyne	NPY2R	16	42
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)cn1	ZINC000450653311	GF	On-Demand	Anodyne	BDKRB1	0	40
C[C@H]1CN(CCOC2CCN(CCc3ccc(Cl)cc3)CC2)C[C@@H](C)O1	ZINC000450653314	GG	On-Demand	Anodyne	EBP	21	44
C[C@@H]1CN(CCOC2CCN(CCc3ccc(Cl)cc3)CC2)C[C@@H](C)O1	ZINC000450653315	GG	On-Demand	Anodyne	EBP	21	44
C[C@H]1CN(CCOC2CCN(CCc3ccc(Cl)cc3)CC2)C[C@H](C)O1	ZINC000450653316	GG	On-Demand	Anodyne	EBP	21	44
Cc1oc2ccccc2c1CCNC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450653325	CF	On-Demand	Mild	MTNR1A	21	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCn1nc(C)nc1C	ZINC000450653328	FF	On-Demand	Anodyne	NQO2	31	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCn1nc(C)nc1C	ZINC000450653328	FF	On-Demand	Anodyne	MTR1B_CHICK	0	55
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCn1nc(C)nc1C	ZINC000450653328	FF	On-Demand	Anodyne	HTR6	24	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCn1nc(C)nc1C	ZINC000450653328	FF	On-Demand	Anodyne	EBP	25	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCn1nc(C)nc1C	ZINC000450653335	FF	On-Demand	Anodyne	NQO2	31	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCn1nc(C)nc1C	ZINC000450653335	FF	On-Demand	Anodyne	MTR1B_CHICK	0	55
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCn1nc(C)nc1C	ZINC000450653335	FF	On-Demand	Anodyne	HTR6	24	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCn1nc(C)nc1C	ZINC000450653335	FF	On-Demand	Anodyne	EBP	25	46
CCC1(CC)CN(C(=O)c2cn(CCc3ccccc3)nn2)CCS1	ZINC000450653345	FG	On-Demand	Anodyne	THYX_PBCV1	0	45
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1	ZINC000450653352	CH	On-Demand	Anodyne	DRD3	26	52
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1	ZINC000450653352	CH	On-Demand	Anodyne	KCNH2	27	52
O=C(Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450653368	GG	On-Demand	Anodyne	RHOA	0	43
O=C1C[C@H]([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653369	EF	On-Demand	Anodyne	DRD2	27	42
O=C1C[C@H]([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653369	EF	On-Demand	Anodyne	DRD4	0	42
O=C1C[C@H]([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653369	EF	On-Demand	Anodyne	HTR3B	0	43
O=C1C[C@H]([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653369	EF	On-Demand	Anodyne	CYP2J2	45	32
O=C1C[C@@H]([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653370	EF	On-Demand	Anodyne	DRD2	27	42
O=C1C[C@@H]([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653370	EF	On-Demand	Anodyne	DRD4	0	42
O=C1C[C@@H]([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653370	EF	On-Demand	Anodyne	HTR3B	0	43
O=C1C[C@@H]([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653370	EF	On-Demand	Anodyne	CYP2J2	45	32
O=C1C[C@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653371	EF	On-Demand	Anodyne	DRD2	27	42
O=C1C[C@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653371	EF	On-Demand	Anodyne	DRD4	0	42
O=C1C[C@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653371	EF	On-Demand	Anodyne	HTR3B	0	43
O=C1C[C@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653371	EF	On-Demand	Anodyne	CYP2J2	45	32
O=C1C[C@@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653372	EF	On-Demand	Anodyne	DRD2	27	42
O=C1C[C@@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653372	EF	On-Demand	Anodyne	DRD4	0	42
O=C1C[C@@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653372	EF	On-Demand	Anodyne	HTR3B	0	43
O=C1C[C@@H]([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)CN1	ZINC000450653372	EF	On-Demand	Anodyne	CYP2J2	45	32
O=C(Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450653374	GG	On-Demand	Anodyne	RHOA	0	43
CCOC(=O)c1cc(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)on1	ZINC000450653375	FF	On-Demand	Anodyne	NQO2	38	43
CCOC(=O)c1cc(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)on1	ZINC000450653375	FF	On-Demand	Anodyne	MTR1B_CHICK	0	52
CCOC(=O)c1cc(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)on1	ZINC000450653375	FF	On-Demand	Anodyne	PPARD	41	37
CCOC(=O)c1cc(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)on1	ZINC000450653377	FF	On-Demand	Anodyne	NQO2	38	43
CCOC(=O)c1cc(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)on1	ZINC000450653377	FF	On-Demand	Anodyne	MTR1B_CHICK	0	52
CCOC(=O)c1cc(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)on1	ZINC000450653377	FF	On-Demand	Anodyne	PPARD	41	37
CCCc1cc(NC2CCC(CSC)CC2)n2ncnc2n1	ZINC000450653379	DG	On-Demand	Anodyne	DHOD	0	41
CC1(O)CC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)C1	ZINC000450653381	ED	On-Demand	Anodyne	RHOA	0	52
CC1(O)CC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)C1	ZINC000450653381	ED	On-Demand	Anodyne	L3MBTL1	0	40
CC1(O)CC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)C1	ZINC000450653381	ED	On-Demand	Anodyne	L3MBTL3	52	40
CC1(O)CC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)C1	ZINC000450653381	ED	On-Demand	Anodyne	KCNK3	27	42
CC1(O)CC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)C1	ZINC000450653383	ED	On-Demand	Anodyne	RHOA	0	52
CC1(O)CC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)C1	ZINC000450653383	ED	On-Demand	Anodyne	L3MBTL1	0	40
CC1(O)CC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)C1	ZINC000450653383	ED	On-Demand	Anodyne	L3MBTL3	52	40
CC1(O)CC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)C1	ZINC000450653383	ED	On-Demand	Anodyne	KCNK3	27	42
COC(=O)c1ccc2c(c1)CN(Cc1ccn(CC(F)(F)F)n1)CC2	ZINC000450653394	FF	On-Demand	Anodyne	NOD1	29	40
COC(=O)c1ccc2c(c1)CN(Cc1ccn(CC(F)(F)F)n1)CC2	ZINC000450653394	FF	On-Demand	Anodyne	NOD2	45	40
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653408	FG	On-Demand	Anodyne	CFTR	40	35
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653408	FG	On-Demand	Anodyne	RHOA	0	40
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653408	FG	On-Demand	Anodyne	L3MBTL1	0	42
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653408	FG	On-Demand	Anodyne	L3MBTL3	59	40
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653408	FG	On-Demand	Anodyne	MBTD1	0	41
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653409	FG	On-Demand	Anodyne	CFTR	40	35
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653409	FG	On-Demand	Anodyne	RHOA	0	40
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653409	FG	On-Demand	Anodyne	L3MBTL1	0	42
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653409	FG	On-Demand	Anodyne	L3MBTL3	59	40
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653409	FG	On-Demand	Anodyne	MBTD1	0	41
CCC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653410	FG	On-Demand	Anodyne	CFTR	40	35
CCC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653410	FG	On-Demand	Anodyne	RHOA	0	40
CCC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653410	FG	On-Demand	Anodyne	L3MBTL1	0	42
CCC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653410	FG	On-Demand	Anodyne	L3MBTL3	59	40
CCC[C@H]1CCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653410	FG	On-Demand	Anodyne	MBTD1	0	41
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653411	FG	On-Demand	Anodyne	CFTR	40	35
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653411	FG	On-Demand	Anodyne	RHOA	0	40
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653411	FG	On-Demand	Anodyne	L3MBTL1	0	42
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653411	FG	On-Demand	Anodyne	L3MBTL3	59	40
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653411	FG	On-Demand	Anodyne	MBTD1	0	41
C[C@H](c1ccccc1)[C@H](O)CN(C)CCC1CCN(c2ccncc2)CC1	ZINC000450653418	FH	On-Demand	Anodyne	SSTR1	24	44
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCC1CCN(c2ccncc2)CC1	ZINC000450653419	FH	On-Demand	Anodyne	SSTR1	24	44
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCC1CCN(c2ccncc2)CC1	ZINC000450653420	FH	On-Demand	Anodyne	SSTR1	24	44
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCC1CCN(c2ccncc2)CC1	ZINC000450653421	FH	On-Demand	Anodyne	SSTR1	24	44
CCOc1cc(-c2nnc(SCc3cc[nH]n3)o2)cc(OCC)c1OCC	ZINC000450653424	GH	On-Demand	Anodyne	GSK3A	42	35
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450653427	FF	On-Demand	Anodyne	RHODESAIN	0	46
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450653429	FF	On-Demand	Anodyne	RHODESAIN	0	46
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450653432	FF	On-Demand	Anodyne	RHODESAIN	0	46
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450653434	FF	On-Demand	Anodyne	RHODESAIN	0	46
COc1nc(C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)c1C	ZINC000450653444	GD	On-Demand	Anodyne	CA2	16	40
COc1ccc(-c2noc(CSc3nnc4nc(C)cc(C)n34)n2)nn1	ZINC000450653446	FD	On-Demand	Anodyne	WNT3A	22	43
COc1ccc(-c2noc(CSc3nnc4nc(C)cc(C)n34)n2)nn1	ZINC000450653446	FD	On-Demand	Anodyne	AXIN2	0	45
CCN(c1ncnc2cc(F)c(OC)cc12)C1COC1	ZINC000450653468	CE	On-Demand	Anodyne	EPHA2	44	35
CCOC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)nc1	ZINC000450653469	FD	On-Demand	Anodyne	CXCR3	30	40
CCOC(=O)c1ccc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)nc1	ZINC000450653470	FD	On-Demand	Anodyne	CXCR3	30	40
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1)C1CCC1	ZINC000450653473	EG	On-Demand	Anodyne	NPY2R	37	42
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1)C1CCC1	ZINC000450653473	EG	On-Demand	Anodyne	L3MBTL1	0	43
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1)C1CCC1	ZINC000450653473	EG	On-Demand	Anodyne	L3MBTL3	63	43
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1)C1CCC1	ZINC000450653473	EG	On-Demand	Anodyne	MBTD1	0	41
CC(C)(C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1)C1CCC1	ZINC000450653473	EG	On-Demand	Anodyne	KCNK3	48	33
CC(=O)c1ccc(CN(C)CCC2CCN(c3ccncc3)CC2)cc1	ZINC000450653483	FI	On-Demand	Anodyne	F10	17	43
CC(=O)c1ccc(CN(C)CCC2CCN(c3ccncc3)CC2)cc1	ZINC000450653483	FI	On-Demand	Anodyne	SSTR1	27	46
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450653492	FE	On-Demand	Anodyne	HDAC10	33	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450653492	FE	On-Demand	Anodyne	HDAC2	19	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450653492	FE	On-Demand	Anodyne	HDAC3	38	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450653492	FE	On-Demand	Anodyne	HDAC6	33	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450653493	FE	On-Demand	Anodyne	HDAC10	33	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450653493	FE	On-Demand	Anodyne	HDAC2	19	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450653493	FE	On-Demand	Anodyne	HDAC3	38	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450653493	FE	On-Demand	Anodyne	HDAC6	33	40
C[C@@]1(F)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450653509	BG	On-Demand	Anodyne	SIGMAR1	21	42
C[C@]1(F)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450653510	BG	On-Demand	Anodyne	SIGMAR1	21	42
COC(=O)c1ccc(CN2CC[C@](C)(F)C2)cc1Cl	ZINC000450653527	CG	On-Demand	Anodyne	ADAM17	15	42
COC(=O)c1ccc(CN2CC[C@@](C)(F)C2)cc1Cl	ZINC000450653528	CG	On-Demand	Anodyne	ADAM17	15	42
CC1(C)CN(C(=O)C2CC2)CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450653529	GH	On-Demand	Anodyne	PRCP	51	36
CC1(C)CN(C(=O)C2CC2)CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450653530	GH	On-Demand	Anodyne	PRCP	51	36
CC1(C)CN(C(=O)C2CC2)CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450653531	GH	On-Demand	Anodyne	PRCP	51	36
CC1(C)CN(C(=O)C2CC2)CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450653532	GH	On-Demand	Anodyne	PRCP	51	36
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1ccncc1	ZINC000450653541	FF	On-Demand	Anodyne	MTNR1A	43	39
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450653552	EG	On-Demand	Anodyne	AKT1	0	40
CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450653553	EG	On-Demand	Anodyne	AKT1	0	40
CCS(=O)(=O)c1ccc(CNC(C)(C)C(=O)NCC(C)(C)C)cc1	ZINC000450653580	FF	On-Demand	Anodyne	RORC	47	33
Cc1oc2ccccc2c1CCNC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450653582	CF	On-Demand	Mild	MTNR1A	21	42
Cc1oc2ccccc2c1CCNC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450653584	CF	On-Demand	Mild	MTNR1A	21	42
Cc1oc2ccccc2c1CCNC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450653586	CF	On-Demand	Mild	MTNR1A	21	42
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653627	CD	On-Demand	Anodyne	DRD2	17	40
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653627	CD	On-Demand	Anodyne	ACHE	21	41
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653627	CD	On-Demand	Anodyne	SLC6A1	48	33
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653627	CD	On-Demand	Anodyne	OPRM1	15	43
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653627	CD	On-Demand	Anodyne	OPRD1	15	43
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653627	CD	On-Demand	Anodyne	SIGMAR1	67	45
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653627	CD	On-Demand	Anodyne	CCR5	44	41
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653628	CD	On-Demand	Anodyne	DRD2	17	40
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653628	CD	On-Demand	Anodyne	ACHE	21	41
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653628	CD	On-Demand	Anodyne	SLC6A1	48	33
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653628	CD	On-Demand	Anodyne	OPRM1	15	43
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653628	CD	On-Demand	Anodyne	OPRD1	15	43
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653628	CD	On-Demand	Anodyne	SIGMAR1	67	45
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@H]1O	ZINC000450653628	CD	On-Demand	Anodyne	CCR5	44	41
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653629	CD	On-Demand	Anodyne	DRD2	17	40
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653629	CD	On-Demand	Anodyne	ACHE	21	41
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653629	CD	On-Demand	Anodyne	SLC6A1	48	33
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653629	CD	On-Demand	Anodyne	OPRM1	15	43
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653629	CD	On-Demand	Anodyne	OPRD1	15	43
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653629	CD	On-Demand	Anodyne	SIGMAR1	67	45
C[C@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653629	CD	On-Demand	Anodyne	CCR5	44	41
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653630	CD	On-Demand	Anodyne	DRD2	17	40
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653630	CD	On-Demand	Anodyne	ACHE	21	41
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653630	CD	On-Demand	Anodyne	SLC6A1	48	33
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653630	CD	On-Demand	Anodyne	OPRM1	15	43
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653630	CD	On-Demand	Anodyne	OPRD1	15	43
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653630	CD	On-Demand	Anodyne	SIGMAR1	67	45
C[C@@H]1CCN(CCN(C)Cc2ccccc2)C[C@@H]1O	ZINC000450653630	CD	On-Demand	Anodyne	CCR5	44	41
CCC(=O)CCCN1CCC(OCCN2C[C@H](C)O[C@H](C)C2)CC1	ZINC000450653648	EE	On-Demand	Anodyne	ZM.86993	0	47
CCC(=O)CCCN1CCC(OCCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000450653649	EE	On-Demand	Anodyne	ZM.86993	0	47
CCC(=O)CCCN1CCC(OCCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000450653650	EE	On-Demand	Anodyne	ZM.86993	0	47
Cn1c(SC[C@H]2CCCCC2(F)F)nnc1-c1cccnc1	ZINC000450653655	DH	On-Demand	Anodyne	DRD3	26	40
Cn1c(SC[C@H]2CCCCC2(F)F)nnc1-c1cccnc1	ZINC000450653655	DH	On-Demand	Anodyne	VCP	50	32
Cn1c(SC[C@@H]2CCCCC2(F)F)nnc1-c1cccnc1	ZINC000450653656	DH	On-Demand	Anodyne	DRD3	26	40
Cn1c(SC[C@@H]2CCCCC2(F)F)nnc1-c1cccnc1	ZINC000450653656	DH	On-Demand	Anodyne	VCP	47	32
C[C@@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450653668	EF	On-Demand	Anodyne	PDE4D	15	41
C[C@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450653669	EF	On-Demand	Anodyne	PDE4D	15	41
C[C@@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450653670	EF	On-Demand	Anodyne	PDE4D	15	41
C[C@H](CC(F)(F)F)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450653671	EF	On-Demand	Anodyne	PDE4D	15	41
Cc1ccc(NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)cc1NC(=O)CCN(C)C	ZINC000450653682	GI	On-Demand	Anodyne	LDLR	0	46
Cc1ccc(NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)cc1NC(=O)CCN(C)C	ZINC000450653683	GI	On-Demand	Anodyne	LDLR	0	46
Cc1ccc(NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)cc1NC(=O)CCN(C)C	ZINC000450653684	GI	On-Demand	Anodyne	LDLR	0	46
Cc1ccc(NC(=O)[C@H]2CCC[C@H]2c2ccccc2)cc1NC(=O)CCN(C)C	ZINC000450653685	GI	On-Demand	Anodyne	LDLR	0	46
O=C1C[C@@H]([C@H]2CCCCN2CCc2ccc(Cl)cc2)CN1	ZINC000450653719	DF	On-Demand	Anodyne	CACNA1D	41	45
O=C1C[C@H]([C@H]2CCCCN2CCc2ccc(Cl)cc2)CN1	ZINC000450653720	DF	On-Demand	Anodyne	CACNA1D	41	45
O=C1C[C@H]([C@@H]2CCCCN2CCc2ccc(Cl)cc2)CN1	ZINC000450653721	DF	On-Demand	Anodyne	CACNA1D	41	45
O=C1C[C@@H]([C@@H]2CCCCN2CCc2ccc(Cl)cc2)CN1	ZINC000450653722	DF	On-Demand	Anodyne	CACNA1D	41	45
C[C@H](O)[C@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000450653728	CD	On-Demand	Anodyne	CHRM2	16	41
C[C@H](O)[C@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000450653728	CD	On-Demand	Anodyne	SSTR3	60	31
C[C@H](O)[C@@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000450653730	CD	On-Demand	Anodyne	CHRM2	16	41
C[C@H](O)[C@@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000450653730	CD	On-Demand	Anodyne	SSTR3	60	31
C[C@@H](O)[C@@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000450653732	CD	On-Demand	Anodyne	CHRM2	16	41
C[C@@H](O)[C@@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000450653732	CD	On-Demand	Anodyne	SSTR3	60	31
C[C@@H](O)[C@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000450653734	CD	On-Demand	Anodyne	CHRM2	16	41
C[C@@H](O)[C@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000450653734	CD	On-Demand	Anodyne	SSTR3	60	31
O=C(CC1(O)CCC1)Nc1n[nH]c(-c2cc(Cl)ccc2Cl)n1	ZINC000450653736	EG	On-Demand	Anodyne	ALPL	40	33
CCc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)n1	ZINC000450653764	FE	On-Demand	Anodyne	KCNK3	62	38
CCc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)n1	ZINC000450653765	FE	On-Demand	Anodyne	KCNK3	62	38
CCS(=O)(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450653766	FG	On-Demand	Anodyne	DRD4	17	41
CCS(=O)(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450653766	FG	On-Demand	Anodyne	ACHE	36	47
CCS(=O)(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450653766	FG	On-Demand	Anodyne	HRH3	15	40
CCS(=O)(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450653766	FG	On-Demand	Anodyne	SIGMAR1	46	49
CCS(=O)(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450653766	FG	On-Demand	Anodyne	NPY2R	43	35
CCS(=O)(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1	ZINC000450653766	FG	On-Demand	Anodyne	NAMPT	45	40
COC(=O)c1ccc2c(c1)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450653770	DG	On-Demand	Anodyne	LEPB	0	40
COC(=O)c1ccc2c(c1)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450653770	DG	On-Demand	Anodyne	HDAC6	52	38
COC(=O)c1ccc2c(c1)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450653770	DG	On-Demand	Anodyne	ABCG2	36	43
COC(=O)c1ccc2c(c1)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450653770	DG	On-Demand	Anodyne	NOD1	35	46
COC(=O)c1ccc2c(c1)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450653770	DG	On-Demand	Anodyne	NOD2	53	46
CC(C)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653783	EG	On-Demand	Anodyne	CCKAR	0	40
CC(C)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653783	EG	On-Demand	Anodyne	HDAC3	40	37
CC(C)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653783	EG	On-Demand	Anodyne	CCKBR	0	40
CC(C)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653783	EG	On-Demand	Anodyne	ST14	46	38
CC(C)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653783	EG	On-Demand	Anodyne	L3MBTL3	59	39
CC(C)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450653783	EG	On-Demand	Anodyne	PARP10	0	43
CC(C)Cn1cc(C(=O)N2CCN(c3ccccc3)C(=O)C2)c(C(F)F)n1	ZINC000450653788	GF	On-Demand	Anodyne	P2RX7	19	41
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450653801	EF	On-Demand	Anodyne	RHOA	0	44
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450653802	EF	On-Demand	Anodyne	RHOA	0	44
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450653807	EG	On-Demand	Anodyne	RHOA	0	41
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450653808	EG	On-Demand	Anodyne	RHOA	0	41
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450653809	EG	On-Demand	Anodyne	RHOA	0	41
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450653811	EG	On-Demand	Anodyne	RHOA	0	41
CCNS(=O)(=O)[C@H]1CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450653820	DD	On-Demand	Anodyne	DRD4	23	44
CCNS(=O)(=O)[C@H]1CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450653820	DD	On-Demand	Anodyne	CHRM3	22	41
CCNS(=O)(=O)[C@H]1CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450653820	DD	On-Demand	Anodyne	TRY2_BOVIN	46	32
CCNS(=O)(=O)[C@@H]1CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450653821	DD	On-Demand	Anodyne	DRD4	23	44
CCNS(=O)(=O)[C@@H]1CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450653821	DD	On-Demand	Anodyne	CHRM3	22	41
CCNS(=O)(=O)[C@@H]1CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450653821	DD	On-Demand	Anodyne	TRY2_BOVIN	46	32
CC1(C)CN(c2ncccn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653831	EH	On-Demand	Anodyne	DRD2	16	43
CC1(C)CN(c2ncccn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653831	EH	On-Demand	Anodyne	DRD4	40	43
CC1(C)CN(c2ncccn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653831	EH	On-Demand	Anodyne	ACHE	40	47
CC1(C)CN(c2ncccn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653831	EH	On-Demand	Anodyne	DRD3	25	43
CC1(C)CN(c2ncccn2)[C@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653831	EH	On-Demand	Anodyne	SIGMAR1	68	42
CC1(C)CN(c2ncccn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653834	EH	On-Demand	Anodyne	DRD2	16	43
CC1(C)CN(c2ncccn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653834	EH	On-Demand	Anodyne	DRD4	40	43
CC1(C)CN(c2ncccn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653834	EH	On-Demand	Anodyne	ACHE	40	47
CC1(C)CN(c2ncccn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653834	EH	On-Demand	Anodyne	DRD3	25	43
CC1(C)CN(c2ncccn2)[C@@H]1C1CCN(Cc2ccccc2)CC1	ZINC000450653834	EH	On-Demand	Anodyne	SIGMAR1	68	42
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	CHRM2	22	58
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	DRD2	22	50
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	DRD4	53	50
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	ACHE	36	51
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	DRD3	24	50
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	OPRK1	15	42
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	OPRL1	18	41
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	CHRM3	23	58
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	SIGMAR1	94	48
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	NPFFR2	39	40
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	ADAM17	16	42
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	SLC18A3	41	37
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	TACR3	42	33
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	CXCR3	17	40
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	MCHR2	77	38
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	CCR8	52	46
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	NPFFR1	62	41
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	SLC12A5	50	34
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	PA	22	43
CC(=O)c1ccc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)cc1	ZINC000450653838	FI	On-Demand	Anodyne	NOD2	40	34
CCN(c1ccccc1[N+](=O)[O-])C1COC1	ZINC000450653851	BD	On-Demand	Bother	COLA	50	33
CCCN(CCc1cccs1)C(=O)c1cnn2ccc(C)cc12	ZINC000450653854	EH	On-Demand	Anodyne	EPHB3	24	42
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450653861	FF	On-Demand	Anodyne	RHOA	0	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450653861	FF	On-Demand	Anodyne	PARP10	0	42
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450653864	FF	On-Demand	Anodyne	RHOA	0	40
O=C(CCCC(=O)C1CC1)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450653864	FF	On-Demand	Anodyne	PARP10	0	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NC1CCC(CSC)CC1	ZINC000450653867	FE	On-Demand	Anodyne	CA2	39	46
COC(=O)c1cc(S(N)(=O)=O)ccc1NC1CCC(CSC)CC1	ZINC000450653867	FE	On-Demand	Anodyne	CA1	33	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NC1CCC(CSC)CC1	ZINC000450653867	FE	On-Demand	Anodyne	CA4	35	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC1CCC(CSC)CC1	ZINC000450653867	FE	On-Demand	Anodyne	CA9	21	42
O=C(c1cnc(C2CC2)nc1)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450653870	ED	On-Demand	Anodyne	P2RX7	21	44
CCOc1cc(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)on1	ZINC000450653875	EF	On-Demand	Anodyne	MTR1B_CHICK	0	52
CCOc1cc(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)on1	ZINC000450653877	EF	On-Demand	Anodyne	MTR1B_CHICK	0	52
CC(C)NC(=O)c1ccc(N[C@@H]2C[C@@H](C)Oc3ccccc32)c([N+](=O)[O-])c1	ZINC000450653880	FI	On-Demand	Bother	TAAR1	19	41
Cc1cccc2c1O[C@H](C(=O)Nc1cccc(C(=O)N3CCC(O)CC3)c1)C2	ZINC000450653882	GF	On-Demand	Anodyne	CFTR	46	34
Cc1cccc2c1O[C@@H](C(=O)Nc1cccc(C(=O)N3CCC(O)CC3)c1)C2	ZINC000450653885	GF	On-Demand	Anodyne	CFTR	46	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1cccc(-c2cccnc2)c1	ZINC000450653886	DH	On-Demand	Anodyne	HSD17B1	0	40
C[C@@H]1CC[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653889	FG	On-Demand	Anodyne	NPY2R	16	41
C[C@@H]1CC[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653889	FG	On-Demand	Anodyne	EPHX2	18	42
C[C@@H]1CC[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653889	FG	On-Demand	Anodyne	RHOA	0	42
C[C@@H]1CC[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653889	FG	On-Demand	Anodyne	L3MBTL1	0	43
C[C@@H]1CC[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653889	FG	On-Demand	Anodyne	L3MBTL3	62	43
C[C@@H]1CC[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653889	FG	On-Demand	Anodyne	KCNK3	22	40
C[C@@H]1CC[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653889	FG	On-Demand	Anodyne	PARP10	0	41
C[C@@H]1CC[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653891	FG	On-Demand	Anodyne	NPY2R	16	41
C[C@@H]1CC[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653891	FG	On-Demand	Anodyne	EPHX2	18	42
C[C@@H]1CC[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653891	FG	On-Demand	Anodyne	RHOA	0	42
C[C@@H]1CC[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653891	FG	On-Demand	Anodyne	L3MBTL1	0	43
C[C@@H]1CC[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653891	FG	On-Demand	Anodyne	L3MBTL3	62	43
C[C@@H]1CC[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653891	FG	On-Demand	Anodyne	KCNK3	22	40
C[C@@H]1CC[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)C[C@H]1C	ZINC000450653891	FG	On-Demand	Anodyne	PARP10	0	41
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCc1cccc(-c2cccnc2)c1	ZINC000450653893	DH	On-Demand	Anodyne	HSD17B1	0	40
C[C@H]1C[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653894	FG	On-Demand	Anodyne	NPY2R	16	41
C[C@H]1C[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653894	FG	On-Demand	Anodyne	EPHX2	18	42
C[C@H]1C[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653894	FG	On-Demand	Anodyne	RHOA	0	42
C[C@H]1C[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653894	FG	On-Demand	Anodyne	L3MBTL1	0	43
C[C@H]1C[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653894	FG	On-Demand	Anodyne	L3MBTL3	62	43
C[C@H]1C[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653894	FG	On-Demand	Anodyne	KCNK3	22	40
C[C@H]1C[C@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653894	FG	On-Demand	Anodyne	PARP10	0	41
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCc1cccc(-c2cccnc2)c1	ZINC000450653895	DH	On-Demand	Anodyne	HSD17B1	0	40
C[C@H]1C[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653897	FG	On-Demand	Anodyne	NPY2R	16	41
C[C@H]1C[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653897	FG	On-Demand	Anodyne	EPHX2	18	42
C[C@H]1C[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653897	FG	On-Demand	Anodyne	RHOA	0	42
C[C@H]1C[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653897	FG	On-Demand	Anodyne	L3MBTL1	0	43
C[C@H]1C[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653897	FG	On-Demand	Anodyne	L3MBTL3	62	43
C[C@H]1C[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653897	FG	On-Demand	Anodyne	KCNK3	22	40
C[C@H]1C[C@@H](C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CC[C@H]1C	ZINC000450653897	FG	On-Demand	Anodyne	PARP10	0	41
COc1ccc(C(=O)N2CCN(c3ccccc3)C(=O)C2)cc1S(C)(=O)=O	ZINC000450653898	GD	On-Demand	Anodyne	CMA1	18	43
COc1ccc(C(=O)N2CCN(c3ccccc3)C(=O)C2)cc1S(C)(=O)=O	ZINC000450653898	GD	On-Demand	Anodyne	P2RX7	15	41
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCc1cccc(-c2cccnc2)c1	ZINC000450653899	DH	On-Demand	Anodyne	HSD17B1	0	40
Cn1cc(-c2ccc(C(=O)Nc3cccc(C(=O)N4CCC[C@H](O)C4)c3)o2)cn1	ZINC000450653902	GF	On-Demand	Anodyne	MMP13	0	43
Cn1cc(-c2ccc(C(=O)Nc3cccc(C(=O)N4CCC[C@H](O)C4)c3)o2)cn1	ZINC000450653902	GF	On-Demand	Anodyne	RHOA	0	40
Cn1cc(-c2ccc(C(=O)Nc3cccc(C(=O)N4CCC[C@@H](O)C4)c3)o2)cn1	ZINC000450653904	GF	On-Demand	Anodyne	MMP13	0	43
Cn1cc(-c2ccc(C(=O)Nc3cccc(C(=O)N4CCC[C@@H](O)C4)c3)o2)cn1	ZINC000450653904	GF	On-Demand	Anodyne	RHOA	0	40
NC(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450653914	CG	On-Demand	Anodyne	ACHE	26	41
NC(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450653914	CG	On-Demand	Anodyne	SIGMAR1	25	45
NC(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450653914	CG	On-Demand	Anodyne	CYP2J2	50	36
NC(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450653915	CG	On-Demand	Anodyne	ACHE	26	41
NC(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450653915	CG	On-Demand	Anodyne	SIGMAR1	25	45
NC(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450653915	CG	On-Demand	Anodyne	CYP2J2	50	36
COC(=O)c1cncc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450653916	GC	On-Demand	Anodyne	CA2	55	42
COC(=O)c1cncc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450653916	GC	On-Demand	Anodyne	CA1	51	37
COC(=O)c1cncc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450653916	GC	On-Demand	Anodyne	CA12	40	42
COC(=O)c1cncc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450653916	GC	On-Demand	Anodyne	CA9	43	42
COC(=O)c1cncc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450653916	GC	On-Demand	Anodyne	P96878_MYCTU	40	33
CN(CCc1ccncc1)CCc1c(Cl)cccc1Cl	ZINC000450653918	DI	On-Demand	Anodyne	SIGMAR1	15	43
CN(CCN(C)c1ccncc1Cl)c1ccc(S(N)(=O)=O)cc1	ZINC000450653922	FD	On-Demand	Anodyne	CA2	22	42
CN(CCN(C)c1ccncc1Cl)c1ccc(S(N)(=O)=O)cc1	ZINC000450653922	FD	On-Demand	Anodyne	CA12	22	42
C[C@H](O)[C@H]1CCCCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653927	GE	On-Demand	Mild	PGR	23	43
C[C@H](O)[C@H]1CCCCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653927	GE	On-Demand	Mild	NR3C2	43	43
C[C@H](O)[C@H]1CCCCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653927	GE	On-Demand	Mild	AR	18	43
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653935	GE	On-Demand	Mild	PGR	23	43
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653935	GE	On-Demand	Mild	NR3C2	43	43
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653935	GE	On-Demand	Mild	AR	18	43
COC(=O)c1ccc2c(c1)CN(Cc1cn(CC3CC3)nn1)CC2	ZINC000450653936	EE	On-Demand	Anodyne	NOD1	29	40
COC(=O)c1ccc2c(c1)CN(Cc1cn(CC3CC3)nn1)CC2	ZINC000450653936	EE	On-Demand	Anodyne	NOD2	45	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653937	GE	On-Demand	Mild	PGR	23	43
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653937	GE	On-Demand	Mild	NR3C2	43	43
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653937	GE	On-Demand	Mild	AR	18	43
C[C@H](O)[C@H]1CCCCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653938	GE	On-Demand	Mild	PGR	23	43
C[C@H](O)[C@H]1CCCCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653938	GE	On-Demand	Mild	NR3C2	43	43
C[C@H](O)[C@H]1CCCCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450653938	GE	On-Demand	Mild	AR	18	43
COc1ccc(CC(=O)N2CCN(c3ccccc3)C(=O)C2)c(Cl)c1OC	ZINC000450653939	GF	On-Demand	Anodyne	P2RX7	18	41
Cc1nnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1C	ZINC000450653945	FC	On-Demand	Anodyne	CA2	30	44
Cc1nnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1C	ZINC000450653945	FC	On-Demand	Anodyne	CA1	27	44
Cc1nnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1C	ZINC000450653945	FC	On-Demand	Anodyne	CA9	22	43
Cc1nnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1C	ZINC000450653945	FC	On-Demand	Anodyne	DKK1	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cnn2ccc(C)cc12	ZINC000450653955	ED	On-Demand	Anodyne	EPHB3	34	48
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cnn2ccc(C)cc12	ZINC000450653963	ED	On-Demand	Anodyne	EPHB3	34	48
C[C@H](O)[C@@H]1CCCCN1C(=O)CCCC(=O)C1CC1	ZINC000450653988	CD	On-Demand	Anodyne	PREP	18	42
C[C@@H](O)[C@H]1CCCCN1C(=O)CCCC(=O)C1CC1	ZINC000450653989	CD	On-Demand	Anodyne	PREP	18	42
C[C@H](O)[C@H]1CCCCN1C(=O)CCCC(=O)C1CC1	ZINC000450653990	CD	On-Demand	Anodyne	PREP	18	42
Cc1ccc(NC(=O)C2(C(=O)C3CC3)CC2)cc1NC(=O)CCN(C)C	ZINC000450653991	FF	On-Demand	Anodyne	LDLR	0	41
C[C@@H](O)[C@@H]1CCCCN1C(=O)CCCC(=O)C1CC1	ZINC000450653993	CD	On-Demand	Anodyne	PREP	18	42
Cc1oc2ccccc2c1CCNC(=O)[C@H]1CC1(F)F	ZINC000450654002	CG	On-Demand	Anodyne	MTNR1A	36	44
Cc1oc2ccccc2c1CCNC(=O)[C@H]1CC1(F)F	ZINC000450654002	CG	On-Demand	Anodyne	MTNR1B	33	44
Cc1oc2ccccc2c1CCNC(=O)[C@@H]1CC1(F)F	ZINC000450654003	CG	On-Demand	Anodyne	MTNR1A	36	44
Cc1oc2ccccc2c1CCNC(=O)[C@@H]1CC1(F)F	ZINC000450654003	CG	On-Demand	Anodyne	MTNR1B	33	44
O[C@H]1COCCN(c2nc(-c3ccncc3)nc3c2CCC3)C1	ZINC000450654010	DD	On-Demand	Anodyne	MTOR	40	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](C)CC(F)(F)F)cc2)c1	ZINC000450654016	GH	On-Demand	Anodyne	ANPEP	17	46
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H](C)CC(F)(F)F)cc2)c1	ZINC000450654016	GH	On-Demand	Anodyne	MMP13	15	48
O[C@@H]1COCCN(c2nc(-c3ccncc3)nc3c2CCC3)C1	ZINC000450654017	DD	On-Demand	Anodyne	MTOR	40	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](C)CC(F)(F)F)cc2)c1	ZINC000450654019	GH	On-Demand	Anodyne	ANPEP	17	46
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](C)CC(F)(F)F)cc2)c1	ZINC000450654019	GH	On-Demand	Anodyne	MMP13	15	48
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](C)CC(F)(F)F)c1	ZINC000450654020	EH	On-Demand	Anodyne	KCNK3	20	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](C)CC(F)(F)F)c1	ZINC000450654020	EH	On-Demand	Anodyne	KCNK9	26	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H](C)CC(F)(F)F)c1	ZINC000450654021	EH	On-Demand	Anodyne	KCNK3	20	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H](C)CC(F)(F)F)c1	ZINC000450654021	EH	On-Demand	Anodyne	KCNK9	26	40
COCCOC[C@@H](O)CN1CCN(Cc2ccccc2)c2ccccc21	ZINC000450654028	FF	On-Demand	Anodyne	ABCB1	45	38
COCCOC[C@@H](O)CN1CCN(Cc2ccccc2)c2ccccc21	ZINC000450654028	FF	On-Demand	Anodyne	HSP90AB1	40	42
COCCOC[C@H](O)CN1CCN(Cc2ccccc2)c2ccccc21	ZINC000450654030	FF	On-Demand	Anodyne	ABCB1	45	38
COCCOC[C@H](O)CN1CCN(Cc2ccccc2)c2ccccc21	ZINC000450654030	FF	On-Demand	Anodyne	HSP90AB1	40	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450654045	DG	On-Demand	Anodyne	CAPNS1	43	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)CC(F)(F)F	ZINC000450654045	DG	On-Demand	Anodyne	CAPN1	41	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450654046	DG	On-Demand	Anodyne	CAPNS1	43	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)CC(F)(F)F	ZINC000450654046	DG	On-Demand	Anodyne	CAPN1	41	39
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C)[C@H](O)C1	ZINC000450654047	CD	On-Demand	Anodyne	OPRK1	25	44
C[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C[C@@H]1O	ZINC000450654048	CD	On-Demand	Anodyne	OPRK1	25	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C)[C@@H](O)C1	ZINC000450654049	CD	On-Demand	Anodyne	OPRK1	25	44
C[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C[C@H]1O	ZINC000450654050	CD	On-Demand	Anodyne	OPRK1	25	44
Cc1oc2ccccc2c1CCNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450654057	CH	On-Demand	Anodyne	MTNR1B	18	40
Cc1oc2ccccc2c1CCNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450654058	CH	On-Demand	Anodyne	MTNR1A	23	40
Cc1oc2ccccc2c1CCNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450654058	CH	On-Demand	Anodyne	MTNR1B	25	40
Cc1oc2ccccc2c1CCNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450654059	CH	On-Demand	Anodyne	MTNR1A	23	40
Cc1oc2ccccc2c1CCNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450654059	CH	On-Demand	Anodyne	MTNR1B	25	40
Cc1oc2ccccc2c1CCNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450654060	CH	On-Demand	Anodyne	MTNR1A	23	40
Cc1oc2ccccc2c1CCNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450654060	CH	On-Demand	Anodyne	MTNR1B	25	40
COC(=O)c1csc(CN2CCC(c3ccc(C(F)(F)F)cc3)CC2)n1	ZINC000450654061	GI	On-Demand	Anodyne	CCR2	31	40
COC(=O)c1csc(CN2CCC(c3ccc(C(F)(F)F)cc3)CC2)n1	ZINC000450654061	GI	On-Demand	Anodyne	MCHR1	35	40
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CC(F)(F)F)nc2)c1	ZINC000450654068	FH	On-Demand	Anodyne	ACACA	45	39
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CC(F)(F)F)nc2)c1	ZINC000450654068	FH	On-Demand	Anodyne	ACACB	22	43
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CC(F)(F)F)nc2)c1	ZINC000450654068	FH	On-Demand	Anodyne	MTNR1A	22	40
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CC(F)(F)F)nc2)c1	ZINC000450654068	FH	On-Demand	Anodyne	MTNR1B	25	43
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CC(F)(F)F)nc2)c1	ZINC000450654069	FH	On-Demand	Anodyne	ACACA	45	39
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CC(F)(F)F)nc2)c1	ZINC000450654069	FH	On-Demand	Anodyne	ACACB	22	43
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CC(F)(F)F)nc2)c1	ZINC000450654069	FH	On-Demand	Anodyne	MTNR1A	22	40
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CC(F)(F)F)nc2)c1	ZINC000450654069	FH	On-Demand	Anodyne	MTNR1B	25	43
COC(=O)[C@H](CC(C)C)N(C)c1ncnc2c1cnn2-c1ccccc1	ZINC000450654108	FF	On-Demand	Anodyne	GCK	42	34
COC(=O)[C@@H](CC(C)C)N(C)c1ncnc2c1cnn2-c1ccccc1	ZINC000450654109	FF	On-Demand	Anodyne	GCK	42	34
CCC(=O)C1(C(=O)Nc2nc3ccccc3n2CCOC)CC1	ZINC000450654130	DE	On-Demand	Anodyne	HRH1	15	44
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450654132	FG	On-Demand	Anodyne	P2RY12	65	35
CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450654133	FG	On-Demand	Anodyne	P2RY12	65	35
COC(=O)c1cc(C)nc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450654134	GE	On-Demand	Bother	CACNA1C	57	39
COC(=O)c1cc(C)nc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450654134	GE	On-Demand	Bother	CACNA1D	86	39
COC(=O)c1cc(C)nc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450654135	GE	On-Demand	Bother	CACNA1C	57	39
COC(=O)c1cc(C)nc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450654135	GE	On-Demand	Bother	CACNA1D	86	39
COC(=O)c1cc(C)nc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450654136	GE	On-Demand	Bother	CACNA1C	57	39
COC(=O)c1cc(C)nc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450654136	GE	On-Demand	Bother	CACNA1D	86	39
COC(=O)c1cc(C)nc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450654137	GE	On-Demand	Bother	CACNA1C	57	39
COC(=O)c1cc(C)nc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450654137	GE	On-Demand	Bother	CACNA1D	86	39
COC(=O)c1ccc(CNC(C)(C)C(=O)NCC2CCCC2)cc1Cl	ZINC000450654154	FG	On-Demand	Anodyne	CACNA1I	43	35
COCCn1c(NC(=O)[C@@H]2C[C@H]2CC(C)C)nc2ccccc21	ZINC000450654163	DG	On-Demand	Anodyne	HRH1	15	43
C[C@H](CC(F)(F)F)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450654200	DF	On-Demand	Anodyne	MMP13	0	43
C[C@@H](CC(F)(F)F)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450654201	DF	On-Demand	Anodyne	MMP13	0	43
CC[C@@H](O)CC(=O)N1CCO[C@@H](Cc2ccccc2)C1	ZINC000450654233	CD	On-Demand	Anodyne	LUCI_PHOPY	44	31
CC[C@H](O)CC(=O)N1CCO[C@@H](Cc2ccccc2)C1	ZINC000450654234	CD	On-Demand	Anodyne	LUCI_PHOPY	44	31
CC[C@@H](O)CC(=O)N1CCO[C@H](Cc2ccccc2)C1	ZINC000450654236	CD	On-Demand	Anodyne	LUCI_PHOPY	44	31
CC[C@H](O)CC(=O)N1CCO[C@H](Cc2ccccc2)C1	ZINC000450654238	CD	On-Demand	Anodyne	LUCI_PHOPY	44	31
C[C@@H]1CCN(Cc2ccccc2OC2CC2)C[C@@H]1O	ZINC000450654250	CE	On-Demand	Anodyne	SLC5A4	54	35
C[C@@H]1CCN(Cc2ccccc2OC2CC2)C[C@H]1O	ZINC000450654259	CE	On-Demand	Anodyne	SLC5A4	54	35
Cc1cnccc1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450654261	ED	On-Demand	Anodyne	CA12	22	43
CCS(=O)(=O)c1ccc(CN(C)CCNC(=O)C(C)C)cc1	ZINC000450654263	ED	On-Demand	Anodyne	COLA	53	33
CCS(=O)(=O)c1ccc(CN(C)CCNC(=O)C(C)C)cc1	ZINC000450654263	ED	On-Demand	Anodyne	RORC	62	42
C[C@H]1CCN(Cc2ccccc2OC2CC2)C[C@H]1O	ZINC000450654264	CE	On-Demand	Anodyne	SLC5A4	54	35
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450654270	GF	On-Demand	Anodyne	P2RY12	74	39
C[C@H]1CCN(Cc2ccccc2OC2CC2)C[C@@H]1O	ZINC000450654271	CE	On-Demand	Anodyne	SLC5A4	54	35
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450654272	GF	On-Demand	Anodyne	P2RY12	74	39
Cc1ccc(NC(=O)[C@@H]2Cc3c(C)cccc3O2)cc1NC(=O)CCN(C)C	ZINC000450654295	GG	On-Demand	Anodyne	LDLR	0	40
Cc1ccc(NC(=O)[C@@H]2Cc3c(C)cccc3O2)cc1NC(=O)CCN(C)C	ZINC000450654295	GG	On-Demand	Anodyne	PTPRF	41	31
Cc1ccc(NC(=O)[C@H]2Cc3c(C)cccc3O2)cc1NC(=O)CCN(C)C	ZINC000450654297	GG	On-Demand	Anodyne	LDLR	0	40
Cc1ccc(NC(=O)[C@H]2Cc3c(C)cccc3O2)cc1NC(=O)CCN(C)C	ZINC000450654297	GG	On-Demand	Anodyne	PTPRF	41	31
C[C@H]1CN(CCN(C)Cc2ccccc2)CCN1C1CCN(C)CC1	ZINC000450654326	EE	On-Demand	Anodyne	SIGMAR1	25	41
C[C@@H]1CN(CCN(C)Cc2ccccc2)CCN1C1CCN(C)CC1	ZINC000450654328	EE	On-Demand	Anodyne	SIGMAR1	25	41
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)[C@@H](O)C1CCC1	ZINC000450654330	ED	On-Demand	Anodyne	RHOA	0	41
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)[C@@H](O)C1CCC1	ZINC000450654330	ED	On-Demand	Anodyne	L3MBTL3	53	39
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)[C@@H](O)C1CCC1	ZINC000450654330	ED	On-Demand	Anodyne	KCNK3	49	34
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)[C@@H](O)C1CCC1	ZINC000450654333	ED	On-Demand	Anodyne	RHOA	0	41
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)[C@@H](O)C1CCC1	ZINC000450654333	ED	On-Demand	Anodyne	L3MBTL3	53	39
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)[C@@H](O)C1CCC1	ZINC000450654333	ED	On-Demand	Anodyne	KCNK3	49	34
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)[C@H](O)C1CCC1	ZINC000450654337	ED	On-Demand	Anodyne	RHOA	0	41
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)[C@H](O)C1CCC1	ZINC000450654337	ED	On-Demand	Anodyne	L3MBTL3	53	39
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)[C@H](O)C1CCC1	ZINC000450654337	ED	On-Demand	Anodyne	KCNK3	49	34
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)[C@H](O)C1CCC1	ZINC000450654339	ED	On-Demand	Anodyne	RHOA	0	41
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)[C@H](O)C1CCC1	ZINC000450654339	ED	On-Demand	Anodyne	L3MBTL3	53	39
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)[C@H](O)C1CCC1	ZINC000450654339	ED	On-Demand	Anodyne	KCNK3	49	34
FC1(F)CC(CN2CCN3CCOc4cccc2c43)C1	ZINC000450654341	CF	On-Demand	Anodyne	HTR1B	0	40
CC(C)(CC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)C1CC1	ZINC000450654344	FJ	On-Demand	Anodyne	ALOX15	15	43
CC(C)(CC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)C1CC1	ZINC000450654344	FJ	On-Demand	Anodyne	CPB	0	43
O=C(Cc1ccc(O)c(F)c1)NCCC1=CCCCCC1	ZINC000450654350	CG	On-Demand	Anodyne	NCE103	29	45
O=C(Cc1ccc(O)c(F)c1)NCCC1=CCCCCC1	ZINC000450654350	CG	On-Demand	Anodyne	CAN2	0	45
COc1cc(C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450654351	FD	On-Demand	Anodyne	CA2	20	43
COc1cc(C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450654351	FD	On-Demand	Anodyne	CA1	18	43
COc1cc(C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450654351	FD	On-Demand	Anodyne	CA12	15	42
COc1cc(C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450654351	FD	On-Demand	Anodyne	CA9	23	43
Cn1c(SCC2(C#N)CCC2)nnc1-c1ccc(F)cc1	ZINC000450654357	DG	On-Demand	Mild	HSD11B1	15	44
CCC[C@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654362	DG	On-Demand	Anodyne	NQO2	42	44
CCC[C@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654362	DG	On-Demand	Anodyne	MTR1B_CHICK	0	60
CCC[C@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654362	DG	On-Demand	Anodyne	HTR6	43	40
CCC[C@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654362	DG	On-Demand	Anodyne	PPARD	43	41
CCC[C@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654362	DG	On-Demand	Anodyne	MTNR1A	49	40
CCC[C@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654362	DG	On-Demand	Anodyne	MTNR1B	42	37
CCC[C@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654362	DG	On-Demand	Anodyne	EBP	19	48
CCC[C@@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654364	DG	On-Demand	Anodyne	NQO2	42	44
CCC[C@@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654364	DG	On-Demand	Anodyne	MTR1B_CHICK	0	60
CCC[C@@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654364	DG	On-Demand	Anodyne	HTR6	43	40
CCC[C@@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654364	DG	On-Demand	Anodyne	PPARD	43	41
CCC[C@@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654364	DG	On-Demand	Anodyne	MTNR1A	49	40
CCC[C@@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654364	DG	On-Demand	Anodyne	MTNR1B	42	37
CCC[C@@H](OC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450654364	DG	On-Demand	Anodyne	EBP	19	48
CCC[C@@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654366	DG	On-Demand	Anodyne	NQO2	42	44
CCC[C@@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654366	DG	On-Demand	Anodyne	MTR1B_CHICK	0	60
CCC[C@@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654366	DG	On-Demand	Anodyne	HTR6	43	40
CCC[C@@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654366	DG	On-Demand	Anodyne	PPARD	43	41
CCC[C@@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654366	DG	On-Demand	Anodyne	MTNR1A	49	40
CCC[C@@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654366	DG	On-Demand	Anodyne	MTNR1B	42	37
CCC[C@@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654366	DG	On-Demand	Anodyne	EBP	19	48
CCC[C@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654367	DG	On-Demand	Anodyne	NQO2	42	44
CCC[C@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654367	DG	On-Demand	Anodyne	MTR1B_CHICK	0	60
CCC[C@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654367	DG	On-Demand	Anodyne	HTR6	43	40
CCC[C@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654367	DG	On-Demand	Anodyne	PPARD	43	41
CCC[C@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654367	DG	On-Demand	Anodyne	MTNR1A	49	40
CCC[C@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654367	DG	On-Demand	Anodyne	MTNR1B	42	37
CCC[C@H](OC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450654367	DG	On-Demand	Anodyne	EBP	19	48
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450654369	EE	On-Demand	Anodyne	RHODESAIN	0	42
COc1cc2c(N3C[C@H](O)C[C@H]3[C@@H]3CCCOC3)ncnc2cc1F	ZINC000450654370	EE	On-Demand	Anodyne	PDE3A	47	35
COc1cc2c(N3C[C@H](O)C[C@H]3[C@@H]3CCCOC3)ncnc2cc1F	ZINC000450654370	EE	On-Demand	Anodyne	PDE3B	69	35
C[C@@H](Oc1ccccn1)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450654371	EE	On-Demand	Anodyne	RHODESAIN	0	42
COc1cc2c(N3C[C@H](O)C[C@@H]3[C@H]3CCCOC3)ncnc2cc1F	ZINC000450654373	EE	On-Demand	Anodyne	PDE3A	47	35
COc1cc2c(N3C[C@H](O)C[C@@H]3[C@H]3CCCOC3)ncnc2cc1F	ZINC000450654373	EE	On-Demand	Anodyne	PDE3B	69	35
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450654374	EE	On-Demand	Anodyne	RHODESAIN	0	42
C[C@@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450654375	EE	On-Demand	Anodyne	RHODESAIN	0	42
COc1cc2c(N3C[C@H](O)C[C@H]3[C@H]3CCCOC3)ncnc2cc1F	ZINC000450654376	EE	On-Demand	Anodyne	PDE3A	47	35
COc1cc2c(N3C[C@H](O)C[C@H]3[C@H]3CCCOC3)ncnc2cc1F	ZINC000450654376	EE	On-Demand	Anodyne	PDE3B	69	35
COc1cc2c(N3C[C@H](O)C[C@@H]3[C@@H]3CCCOC3)ncnc2cc1F	ZINC000450654378	EE	On-Demand	Anodyne	PDE3A	47	35
COc1cc2c(N3C[C@H](O)C[C@@H]3[C@@H]3CCCOC3)ncnc2cc1F	ZINC000450654378	EE	On-Demand	Anodyne	PDE3B	69	35
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450654398	FH	On-Demand	Anodyne	CCKAR	0	44
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450654398	FH	On-Demand	Anodyne	CCKBR	0	44
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450654398	FH	On-Demand	Anodyne	EPHX2	22	40
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450654398	FH	On-Demand	Anodyne	ST14	40	34
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450654398	FH	On-Demand	Anodyne	L3MBTL1	0	42
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450654398	FH	On-Demand	Anodyne	L3MBTL3	61	42
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450654398	FH	On-Demand	Anodyne	PARP10	0	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1(O)CCC1	ZINC000450654447	DF	On-Demand	Anodyne	NQO2	42	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1(O)CCC1	ZINC000450654447	DF	On-Demand	Anodyne	MTR1B_CHICK	0	61
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1(O)CCC1	ZINC000450654447	DF	On-Demand	Anodyne	HTR6	40	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1(O)CCC1	ZINC000450654447	DF	On-Demand	Anodyne	PPARD	46	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1(O)CCC1	ZINC000450654447	DF	On-Demand	Anodyne	MTNR1B	32	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1(O)CCC1	ZINC000450654453	DF	On-Demand	Anodyne	NQO2	42	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1(O)CCC1	ZINC000450654453	DF	On-Demand	Anodyne	MTR1B_CHICK	0	61
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1(O)CCC1	ZINC000450654453	DF	On-Demand	Anodyne	HTR6	40	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1(O)CCC1	ZINC000450654453	DF	On-Demand	Anodyne	PPARD	46	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1(O)CCC1	ZINC000450654453	DF	On-Demand	Anodyne	MTNR1B	32	41
CN(C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)c1ccc(F)c(Cl)c1	ZINC000450654459	GH	On-Demand	Anodyne	TACR3	46	32
CN(C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)c1ccc(F)c(Cl)c1	ZINC000450654461	GH	On-Demand	Anodyne	TACR3	46	32
O=C(CNC(=O)C1(Cc2cccc(Cl)c2)CC1)N1CCOCC1	ZINC000450654462	ED	On-Demand	Anodyne	AKR1C3	0	43
c1cncc(CC2CCN(CCc3cscn3)CC2)c1	ZINC000450654477	CG	On-Demand	Anodyne	GRIN2B	32	40
c1cncc(CC2CCN(CCc3cscn3)CC2)c1	ZINC000450654477	CG	On-Demand	Anodyne	SCN5A	42	35
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450654481	FH	On-Demand	Anodyne	RHOA	0	40
CC[C@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450654483	FH	On-Demand	Anodyne	RHOA	0	40
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450654484	FH	On-Demand	Anodyne	RHOA	0	40
CC[C@@H](CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450654485	FH	On-Demand	Anodyne	RHOA	0	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450654500	EF	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450654503	EF	On-Demand	Anodyne	RHODESAIN	0	42
CCC1(Nc2ncnc3ccc(C)cc23)CC1	ZINC000450654543	BG	On-Demand	Anodyne	CLK4	49	36
CCC1(Nc2ncnc3ccc(C)cc23)CC1	ZINC000450654543	BG	On-Demand	Anodyne	CD38	41	38
CCC1(Nc2ncnc3ccc(C)cc23)CC1	ZINC000450654543	BG	On-Demand	Anodyne	HTT	0	42
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450654546	EE	On-Demand	Anodyne	P2RY12	17	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450654547	EE	On-Demand	Anodyne	P2RY12	17	41
C[C@H](O)[C@@H]1CCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450654552	EF	On-Demand	Anodyne	OPRK1	30	50
C[C@H](O)[C@@H]1CCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450654552	EF	On-Demand	Anodyne	PDEC	0	41
C[C@H](O)[C@H]1CCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450654553	EF	On-Demand	Anodyne	OPRK1	30	50
C[C@H](O)[C@H]1CCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450654553	EF	On-Demand	Anodyne	PDEC	0	41
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450654554	EF	On-Demand	Anodyne	OPRK1	30	50
C[C@@H](O)[C@@H]1CCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450654554	EF	On-Demand	Anodyne	PDEC	0	41
C[C@@H](O)[C@H]1CCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450654555	EF	On-Demand	Anodyne	OPRK1	30	50
C[C@@H](O)[C@H]1CCCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450654555	EF	On-Demand	Anodyne	PDEC	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450654556	FE	On-Demand	Anodyne	IRAK4	22	45
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450654557	FE	On-Demand	Anodyne	IRAK4	22	45
CN1CCC[C@@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654559	FG	On-Demand	Anodyne	ACE	65	44
CN1CCC[C@@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654559	FG	On-Demand	Anodyne	MME	66	44
CN1CCC[C@@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654559	FG	On-Demand	Anodyne	TRY1_BOVIN	45	34
CN1CCC[C@@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654559	FG	On-Demand	Anodyne	CAPN1	24	40
CN1CCC[C@@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654559	FG	On-Demand	Anodyne	XIAP	40	37
CN1CCC[C@@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654559	FG	On-Demand	Anodyne	BRCA1	52	33
CN1CCC[C@@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654559	FG	On-Demand	Anodyne	TMPRSS11D	43	34
CN1CCC[C@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654561	FG	On-Demand	Anodyne	ACE	65	44
CN1CCC[C@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654561	FG	On-Demand	Anodyne	MME	66	44
CN1CCC[C@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654561	FG	On-Demand	Anodyne	TRY1_BOVIN	45	34
CN1CCC[C@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654561	FG	On-Demand	Anodyne	CAPN1	24	40
CN1CCC[C@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654561	FG	On-Demand	Anodyne	XIAP	40	37
CN1CCC[C@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654561	FG	On-Demand	Anodyne	BRCA1	52	33
CN1CCC[C@H](C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1=O	ZINC000450654561	FG	On-Demand	Anodyne	TMPRSS11D	43	34
CC[C@H]1[C@H](CO)CCN1c1nnc(-c2ccc(OC)cc2)c2ccccc12	ZINC000450654566	FH	On-Demand	Anodyne	SMO	46	42
CC[C@@H]1[C@H](CO)CCN1c1nnc(-c2ccc(OC)cc2)c2ccccc12	ZINC000450654567	FH	On-Demand	Anodyne	SMO	46	42
CC[C@@H]1[C@@H](CO)CCN1c1nnc(-c2ccc(OC)cc2)c2ccccc12	ZINC000450654569	FH	On-Demand	Anodyne	SMO	46	42
CC[C@H]1[C@@H](CO)CCN1c1nnc(-c2ccc(OC)cc2)c2ccccc12	ZINC000450654571	FH	On-Demand	Anodyne	SMO	46	42
COc1ccc(CNC(=O)CCN2CC[C@H](C3CC3)C2)c(OC)c1	ZINC000450654579	EE	On-Demand	Anodyne	HTR7	30	41
COc1ccc(CNC(=O)CCN2CC[C@H](C3CC3)C2)c(OC)c1	ZINC000450654579	EE	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN2CC[C@H](C3CC3)C2)c(OC)c1	ZINC000450654579	EE	On-Demand	Anodyne	MTNR1B	44	37
COc1ccc(CNC(=O)CCN2CC[C@@H](C3CC3)C2)c(OC)c1	ZINC000450654582	EE	On-Demand	Anodyne	HTR7	30	41
COc1ccc(CNC(=O)CCN2CC[C@@H](C3CC3)C2)c(OC)c1	ZINC000450654582	EE	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN2CC[C@@H](C3CC3)C2)c(OC)c1	ZINC000450654582	EE	On-Demand	Anodyne	MTNR1B	44	37
CC[C@@H]1[C@H](CO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450654600	CD	On-Demand	Anodyne	P2RY12	28	42
CC[C@@H]1[C@H](CO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450654600	CD	On-Demand	Anodyne	CXCR3	32	42
CC[C@H]1[C@@H](CO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450654602	CD	On-Demand	Anodyne	P2RY12	28	42
CC[C@H]1[C@@H](CO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450654602	CD	On-Demand	Anodyne	CXCR3	32	42
CC[C@H]1[C@H](CO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450654604	CD	On-Demand	Anodyne	P2RY12	28	42
CC[C@H]1[C@H](CO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450654604	CD	On-Demand	Anodyne	CXCR3	32	42
CC[C@@H]1[C@@H](CO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450654605	CD	On-Demand	Anodyne	P2RY12	28	42
CC[C@@H]1[C@@H](CO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450654605	CD	On-Demand	Anodyne	CXCR3	32	42
CC(C)c1nccc(N2CCOC[C@@H](O)C2)n1	ZINC000450654613	BC	On-Demand	Anodyne	SORD	77	44
CC(C)c1nccc(N2CCOC[C@H](O)C2)n1	ZINC000450654618	BC	On-Demand	Anodyne	SORD	77	44
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450654619	GC	On-Demand	Mild	AR	16	44
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450654620	GC	On-Demand	Mild	AR	16	44
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450654639	GE	On-Demand	Anodyne	CPT2	42	37
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450654639	GE	On-Demand	Anodyne	PREP	74	56
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450654639	GE	On-Demand	Anodyne	SFRP1	46	42
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450654639	GE	On-Demand	Anodyne	WNT3	48	42
COC1(CSc2nnc(-c3ccc(F)cc3)n2C)CCC1	ZINC000450654724	DG	On-Demand	Anodyne	HSD11B1	17	45
Cc1ccc(NC(=O)c2nn(C)c3c2CCCC3)cc1NC(=O)CCN(C)C	ZINC000450654731	GF	On-Demand	Anodyne	LDLR	0	40
COc1cc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654738	FF	On-Demand	Anodyne	CA2	54	52
COc1cc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654738	FF	On-Demand	Anodyne	PTGS2	24	42
COc1cc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654738	FF	On-Demand	Anodyne	CA1	46	52
COc1cc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654738	FF	On-Demand	Anodyne	CA14	35	42
COc1cc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654738	FF	On-Demand	Anodyne	CA12	40	39
COc1cc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654738	FF	On-Demand	Anodyne	CA9	44	39
COc1cc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654739	FF	On-Demand	Anodyne	CA2	54	52
COc1cc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654739	FF	On-Demand	Anodyne	PTGS2	24	42
COc1cc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654739	FF	On-Demand	Anodyne	CA1	46	52
COc1cc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654739	FF	On-Demand	Anodyne	CA14	35	42
COc1cc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654739	FF	On-Demand	Anodyne	CA12	40	39
COc1cc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)ccc1Cl	ZINC000450654739	FF	On-Demand	Anodyne	CA9	44	39
C[C@@H](CC(F)(F)F)NC(=O)c1ccc(I)cc1F	ZINC000450654760	GH	On-Demand	Anodyne	MAP2K1	41	34
C[C@H](CC(F)(F)F)NC(=O)c1ccc(I)cc1F	ZINC000450654761	GH	On-Demand	Anodyne	MAP2K1	41	34
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)C[C@H]1O	ZINC000450654762	BD	On-Demand	Anodyne	SIGMAR1	32	40
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)C[C@H]1O	ZINC000450654762	BD	On-Demand	Anodyne	ABCB1	48	41
COc1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1OC(C)C	ZINC000450654777	GH	On-Demand	Anodyne	PDE4D	20	48
COc1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1OC(C)C	ZINC000450654777	GH	On-Demand	Anodyne	ENPP1	71	36
COc1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1OC(C)C	ZINC000450654777	GH	On-Demand	Anodyne	PDEC	0	46
COc1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1OC(C)C	ZINC000450654778	GH	On-Demand	Anodyne	PDE4D	20	48
COc1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1OC(C)C	ZINC000450654778	GH	On-Demand	Anodyne	ENPP1	71	36
COc1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1OC(C)C	ZINC000450654778	GH	On-Demand	Anodyne	PDEC	0	46
CCC(CC)(CCSc1nnc(-c2ccccc2)n1C)C(=O)OC	ZINC000450654801	EH	On-Demand	Anodyne	DRD3	35	41
CCCN(CCc1cccs1)C(=O)c1cc(C)cs1	ZINC000450654812	CI	On-Demand	Anodyne	ADAM17	0	42
Cn1c(SCCC(C)(F)F)nnc1-c1ccncc1	ZINC000450654816	CG	On-Demand	Anodyne	DRD2	15	45
Cn1c(SCCC(C)(F)F)nnc1-c1ccncc1	ZINC000450654816	CG	On-Demand	Anodyne	DRD3	39	45
Cn1c(SCCC(C)(F)F)nnc1-c1ccncc1	ZINC000450654816	CG	On-Demand	Anodyne	KCNH2	20	45
CCCN(CCc1cccs1)C(=O)c1ccc2cnccc2c1	ZINC000450654823	DI	On-Demand	Anodyne	PLM2_PLAFA	45	36
CC(C)(C)C(=O)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450654839	EI	On-Demand	Anodyne	TBXAS1	56	36
CC(C)(C)C(=O)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450654839	EI	On-Demand	Anodyne	PTAFR	31	42
CC(C)(C)C(=O)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450654839	EI	On-Demand	Anodyne	SUCNR1	56	44
CCCN(CCc1cccs1)C(=O)Cc1ccc(O)c(F)c1	ZINC000450654853	DH	On-Demand	Anodyne	TSPO	27	41
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ocnc1-c1ccccc1	ZINC000450654855	FG	On-Demand	Anodyne	P2RY12	90	34
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ocnc1-c1ccccc1	ZINC000450654855	FG	On-Demand	Anodyne	CTRB_BOVIN	41	38
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ocnc1-c1ccccc1	ZINC000450654856	FG	On-Demand	Anodyne	P2RY12	90	34
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ocnc1-c1ccccc1	ZINC000450654856	FG	On-Demand	Anodyne	CTRB_BOVIN	41	38
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccn(CCc3ccccc3)n2)C1	ZINC000450654857	GG	On-Demand	Anodyne	SLC6A1	65	33
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccn(CCc3ccccc3)n2)C1	ZINC000450654857	GG	On-Demand	Anodyne	PREP	43	39
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccn(CCc3ccccc3)n2)C1	ZINC000450654857	GG	On-Demand	Anodyne	RHODESAIN	0	45
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccn(CCc3ccccc3)n2)C1	ZINC000450654858	GG	On-Demand	Anodyne	SLC6A1	65	33
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccn(CCc3ccccc3)n2)C1	ZINC000450654858	GG	On-Demand	Anodyne	PREP	43	39
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccn(CCc3ccccc3)n2)C1	ZINC000450654858	GG	On-Demand	Anodyne	RHODESAIN	0	45
CCCN(CCc1cccs1)C(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450654868	GI	On-Demand	Anodyne	TSPO	24	41
Cc1csc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1	ZINC000450654875	EF	On-Demand	Anodyne	RHOA	0	41
Cc1csc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1	ZINC000450654876	EF	On-Demand	Anodyne	RHOA	0	41
CCOCc1nc(C)c(C(=O)NCc2cccc(-c3cccnc3)c2)s1	ZINC000450654877	FH	On-Demand	Anodyne	CHRM4	31	43
CCOCc1nc(C)c(C(=O)NCc2cccc(-c3cccnc3)c2)s1	ZINC000450654877	FH	On-Demand	Anodyne	SCD1	45	47
CCOCc1nc(C)c(C(=O)NCc2cccc(-c3cccnc3)c2)s1	ZINC000450654877	FH	On-Demand	Anodyne	SCD	43	47
CC(=O)N[C@H](C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1)C(C)(C)C	ZINC000450654890	EE	On-Demand	Anodyne	RHODESAIN	0	44
CC(=O)N[C@H](C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1)C(C)(C)C	ZINC000450654892	EE	On-Demand	Anodyne	RHODESAIN	0	44
C[C@@H](c1nccs1)N1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)CC1	ZINC000450654902	FG	On-Demand	Anodyne	HRH4	18	41
C[C@H](c1nccs1)N1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)CC1	ZINC000450654904	FG	On-Demand	Anodyne	HRH4	18	41
CCn1c(SCc2cn(C)nc2C)nc2ccccc2c1=O	ZINC000450654905	DF	On-Demand	Anodyne	PTGDR2	15	41
COc1cc(-c2noc(CSc3nnc4n3CCCCC4)n2)ncn1	ZINC000450654911	FE	On-Demand	Anodyne	TNKS2	15	40
CCN(c1ccc2nnc(-c3ccccc3)n2n1)C1COC1	ZINC000450654918	CE	On-Demand	Anodyne	LRRK2	0	41
O=C(Cc1ccc(O)c(F)c1)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450654921	FE	On-Demand	Anodyne	CCR3	47	40
O=C(Cc1ccc(O)c(F)c1)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450654922	FE	On-Demand	Anodyne	CCR3	47	40
COc1cc(CN2CCC(O)(CN3CCOCC3)CC2)ccc1Cl	ZINC000450654936	FE	On-Demand	Anodyne	DRD4	18	42
COc1cc(CN2CCC(O)(CN3CCOCC3)CC2)ccc1Cl	ZINC000450654936	FE	On-Demand	Anodyne	SIGMAR1	22	40
COc1cc(CN2CCC(O)(CN3CCOCC3)CC2)ccc1Cl	ZINC000450654936	FE	On-Demand	Anodyne	SSTR5	40	35
COc1cc(CN2CCC(O)(CN3CCOCC3)CC2)ccc1Cl	ZINC000450654936	FE	On-Demand	Anodyne	SRC	32	40
C[C@@]1(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)CC=CCC1	ZINC000450654937	EF	On-Demand	Anodyne	RHOA	0	40
C[C@]1(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)CC=CCC1	ZINC000450654938	EF	On-Demand	Anodyne	RHOA	0	40
C[C@]1(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)CC=CCC1	ZINC000450654939	EF	On-Demand	Anodyne	RHOA	0	40
C[C@@]1(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)CC=CCC1	ZINC000450654940	EF	On-Demand	Anodyne	RHOA	0	40
C=CCC1(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)CCCCC1	ZINC000450654949	FH	On-Demand	Mild	RHOA	0	40
C=CCC1(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)CCCCC1	ZINC000450654950	FH	On-Demand	Mild	RHOA	0	40
Cc1cccc(C2=CCN(CC[C@H](C)O)CC2)c1	ZINC000450654951	BF	On-Demand	Anodyne	DRD2	0	43
Cc1cccc(C2=CCN(CC[C@@H](C)O)CC2)c1	ZINC000450654952	BF	On-Demand	Anodyne	DRD2	0	43
C=CCC1(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCCCC1	ZINC000450654963	FH	On-Demand	Mild	L3MBTL1	0	40
C=CCC1(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCCCC1	ZINC000450654963	FH	On-Demand	Mild	L3MBTL3	50	40
C=CCC1(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)CCCCC1	ZINC000450654963	FH	On-Demand	Mild	MBTD1	0	40
Clc1ccc(CCN2CCC[C@H]2c2ncc[nH]2)cc1	ZINC000450654964	CG	On-Demand	Anodyne	HRH3	41	41
Clc1ccc(CCN2CCC[C@@H]2c2ncc[nH]2)cc1	ZINC000450654965	CG	On-Demand	Anodyne	HRH3	41	41
Cn1ncc(Br)c1C(=O)N1CCN(c2ccccc2)C(=O)C1	ZINC000450654972	FD	On-Demand	Anodyne	P2RX7	16	40
CCN(CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1)CC1CC1	ZINC000450654973	EI	On-Demand	Anodyne	ACHE	45	55
CCN(CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1)CC1CC1	ZINC000450654973	EI	On-Demand	Anodyne	SIGMAR1	35	45
CCN(CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1)CC1CC1	ZINC000450654973	EI	On-Demand	Anodyne	LSS	15	41
CCN(CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1)CC1CC1	ZINC000450654973	EI	On-Demand	Anodyne	MCHR1	26	41
CCN(CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1)CC1CC1	ZINC000450654973	EI	On-Demand	Anodyne	CACNA1I	51	40
C[C@H]1[C@H](C)N(CCCC(=O)c2ccc(Br)cc2)CCN1C	ZINC000450654975	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@H]1[C@H](C)N(CCCC(=O)c2ccc(Br)cc2)CCN1C	ZINC000450654975	FG	On-Demand	Anodyne	CYP2J2	52	39
CCc1cc2c(N[C@@H]3CCOC3(C)C)ncnc2s1	ZINC000450654976	CG	On-Demand	Anodyne	CD38	44	35
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450654977	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@H]1[C@@H](C)N(C)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450654977	FG	On-Demand	Anodyne	CYP2J2	52	39
CCc1cc2c(N[C@H]3CCOC3(C)C)ncnc2s1	ZINC000450654978	CG	On-Demand	Anodyne	CD38	44	35
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)CCN1C	ZINC000450654979	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@H]1[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)CCN1C	ZINC000450654979	FG	On-Demand	Anodyne	CYP2J2	52	39
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)CCN1C	ZINC000450654981	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@@H]1[C@@H](C)N(CCCC(=O)c2ccc(Br)cc2)CCN1C	ZINC000450654981	FG	On-Demand	Anodyne	CYP2J2	52	39
Cc1cccc2c1C[C@H](C(=O)Nc1cccc(C(=O)N3CCC[C@H](O)C3)c1)O2	ZINC000450654986	GF	On-Demand	Anodyne	RHOA	0	45
Cc1cccc2c1C[C@@H](C(=O)Nc1cccc(C(=O)N3CCC[C@H](O)C3)c1)O2	ZINC000450654987	GF	On-Demand	Anodyne	RHOA	0	45
Cc1cccc2c1C[C@@H](C(=O)Nc1cccc(C(=O)N3CCC[C@@H](O)C3)c1)O2	ZINC000450654988	GF	On-Demand	Anodyne	RHOA	0	45
Cc1cccc2c1C[C@H](C(=O)Nc1cccc(C(=O)N3CCC[C@@H](O)C3)c1)O2	ZINC000450654990	GF	On-Demand	Anodyne	RHOA	0	45
O=C(c1ccnn1CC(F)(F)F)N1CCN(c2ccccc2)C(=O)C1	ZINC000450654995	FD	On-Demand	Anodyne	P2RX7	22	42
COCCn1c(SCc2ccc(Cl)c(OC)c2)nnc1-c1ccncc1	ZINC000450655004	GH	On-Demand	Anodyne	CASR	24	42
CC(=O)c1cccc(CN2CC[C@H](C)C3(CCC3)C2)c1	ZINC000450655009	CH	On-Demand	Anodyne	CHRM3	22	40
CC(=O)c1cccc(CN2CC[C@@H](C)C3(CCC3)C2)c1	ZINC000450655010	CH	On-Demand	Anodyne	CHRM3	22	40
COc1cc(CC(=O)N2CCN(c3ccccc3)C(=O)C2)ccc1O	ZINC000450655013	ED	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N2CCN(c3ccccc3)C(=O)C2)ccc1O	ZINC000450655013	ED	On-Demand	Anodyne	GPR183	0	41
Nc1ncccc1CN1CCC2(CC1)CCN(Cc1ccccc1)C2	ZINC000450655018	EG	On-Demand	Anodyne	NPFFR1	47	33
COCc1nc(N2CCOC[C@@H](O)C2)c2c(-c3ccccc3)csc2n1	ZINC000450655054	FF	On-Demand	Anodyne	ADRB3	27	41
COCc1nc(N2CCOC[C@H](O)C2)c2c(-c3ccccc3)csc2n1	ZINC000450655055	FF	On-Demand	Anodyne	ADRB3	27	41
CCC(=O)C1(C(=O)N[C@H](C)c2ccc(Cl)c3ccccc23)CC1	ZINC000450655058	EI	On-Demand	Anodyne	SDH1	0	47
CCC(=O)C1(C(=O)N[C@@H](C)c2ccc(Cl)c3ccccc23)CC1	ZINC000450655059	EI	On-Demand	Anodyne	SDH1	0	47
CCN(CC)S(=O)(=O)c1ccc(N[C@H]2CCOC2(C)C)c([N+](=O)[O-])c1	ZINC000450655072	FF	On-Demand	Bother	BDKRB1	17	40
CCN(CC)S(=O)(=O)c1ccc(N[C@@H]2CCOC2(C)C)c([N+](=O)[O-])c1	ZINC000450655073	FF	On-Demand	Bother	BDKRB1	17	40
CN(CCN1CC(=O)N(Cc2ccccc2)C1)Cc1ccccc1	ZINC000450655082	DE	On-Demand	Anodyne	SIGMAR1	27	44
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1	ZINC000450655104	EG	On-Demand	Anodyne	DRD2	37	50
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1	ZINC000450655104	EG	On-Demand	Anodyne	DRD4	22	51
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1	ZINC000450655104	EG	On-Demand	Anodyne	SLC18A3	0	47
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1	ZINC000450655104	EG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1	ZINC000450655104	EG	On-Demand	Anodyne	CYP2J2	55	38
O=C(CCCN1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1	ZINC000450655104	EG	On-Demand	Anodyne	NET	0	45
CC[S@](=O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450655107	EF	On-Demand	Anodyne	MME	53	38
CC[S@](=O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450655107	EF	On-Demand	Anodyne	PAPA1_CARPA	42	37
CC[S@](=O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450655107	EF	On-Demand	Anodyne	CPA1	43	34
CC[S@](=O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450655107	EF	On-Demand	Anodyne	ACE2	40	34
CC[S@@](=O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450655108	EF	On-Demand	Anodyne	MME	53	38
CC[S@@](=O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450655108	EF	On-Demand	Anodyne	PAPA1_CARPA	42	37
CC[S@@](=O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450655108	EF	On-Demand	Anodyne	CPA1	43	34
CC[S@@](=O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450655108	EF	On-Demand	Anodyne	ACE2	40	34
Cc1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)n2ncnc2n1	ZINC000450655112	ED	On-Demand	Anodyne	DHOD	0	40
Cc1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)n2ncnc2n1	ZINC000450655113	ED	On-Demand	Anodyne	DHOD	0	40
Cc1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)n2ncnc2n1	ZINC000450655114	ED	On-Demand	Anodyne	DHOD	0	40
Cc1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)n2ncnc2n1	ZINC000450655115	ED	On-Demand	Anodyne	DHOD	0	40
CC[C@H]1[C@@H](CO)CCN1c1cc(C)nc(-c2cccnc2)n1	ZINC000450655127	CE	On-Demand	Anodyne	ROS1	40	36
CC[C@H]1[C@H](CO)CCN1c1cc(C)nc(-c2cccnc2)n1	ZINC000450655128	CE	On-Demand	Anodyne	ROS1	40	36
CC[C@@H]1[C@@H](CO)CCN1c1cc(C)nc(-c2cccnc2)n1	ZINC000450655129	CE	On-Demand	Anodyne	ROS1	40	36
CC[C@@H]1[C@H](CO)CCN1c1cc(C)nc(-c2cccnc2)n1	ZINC000450655130	CE	On-Demand	Anodyne	ROS1	40	36
COC(=O)[C@@H](CC(C)C)N(C)c1ncnc2[nH]ccc12	ZINC000450655132	CD	On-Demand	Anodyne	JAK3	22	46
COC(=O)[C@H](CC(C)C)N(C)c1ncnc2[nH]ccc12	ZINC000450655133	CD	On-Demand	Anodyne	JAK3	22	46
CC[C@](C)(NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450655134	DD	On-Demand	Anodyne	PTPRB	61	36
CC[C@](C)(NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450655134	DD	On-Demand	Anodyne	RORC	52	34
CC[C@@](C)(NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450655135	DD	On-Demand	Anodyne	PTPRB	61	36
CC[C@@](C)(NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450655135	DD	On-Demand	Anodyne	RORC	52	34
CCN(Cc1ccncc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450655139	DF	On-Demand	Anodyne	RORC	24	43
NS(=O)(=O)[C@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450655179	EE	On-Demand	Anodyne	SLC6A1	43	35
NS(=O)(=O)[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450655180	EE	On-Demand	Anodyne	SLC6A1	43	35
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(CC(C)C)cc1	ZINC000450655193	CF	On-Demand	Anodyne	SLC22A20	0	46
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(CC(C)C)cc1	ZINC000450655195	CF	On-Demand	Anodyne	SLC22A20	0	46
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000450655197	CF	On-Demand	Anodyne	SLC22A20	0	46
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000450655198	CF	On-Demand	Anodyne	SLC22A20	0	46
O=S(=O)(c1ccc(N[C@H]2CCCC[C@H]2CC(F)(F)F)nc1)N1CCCC1	ZINC000450655248	GH	On-Demand	Anodyne	GCK	56	31
O=S(=O)(c1ccc(N[C@H]2CCCC[C@H]2CC(F)(F)F)nc1)N1CCCC1	ZINC000450655248	GH	On-Demand	Anodyne	GCKR	73	33
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450655269	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450655269	ED	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450655269	ED	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450655270	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450655270	ED	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H](O)C2)c(OC)c1	ZINC000450655270	ED	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H](O)C2)c(OC)c1	ZINC000450655271	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H](O)C2)c(OC)c1	ZINC000450655271	ED	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H](O)C2)c(OC)c1	ZINC000450655271	ED	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H](O)C2)c(OC)c1	ZINC000450655272	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H](O)C2)c(OC)c1	ZINC000450655272	ED	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H](O)C2)c(OC)c1	ZINC000450655272	ED	On-Demand	Anodyne	MTNR1A	47	36
C[C@H](CCCCO)Nc1ccnc2cc(F)ccc12	ZINC000450655285	CG	On-Demand	Anodyne	HRP1_PLAFA	22	52
C[C@H](CCCCO)Nc1ccnc2cc(F)ccc12	ZINC000450655285	CG	On-Demand	Anodyne	RBP_CHICK	0	52
C[C@@H](CCCCO)Nc1ccnc2cc(F)ccc12	ZINC000450655286	CG	On-Demand	Anodyne	HRP1_PLAFA	22	52
C[C@@H](CCCCO)Nc1ccnc2cc(F)ccc12	ZINC000450655286	CG	On-Demand	Anodyne	RBP_CHICK	0	52
CCc1cc(CCCN2CCC(CCC(N)=O)CC2)on1	ZINC000450655296	CE	On-Demand	Anodyne	HTR4	32	42
CCc1cc(CCCN2CCC(CCC(N)=O)CC2)on1	ZINC000450655296	CE	On-Demand	Anodyne	CYP2J2	49	36
CN(C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(F)c(Cl)c1	ZINC000450655307	GH	On-Demand	Anodyne	PIK3CD	18	47
CN(C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(F)c(Cl)c1	ZINC000450655307	GH	On-Demand	Anodyne	PIK3CB	34	47
CN(C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(F)c(Cl)c1	ZINC000450655307	GH	On-Demand	Anodyne	AKR1C3	25	40
Cn1c(SC[C@H]2CCCCC2(F)F)nnc1-c1ccccc1	ZINC000450655308	DI	On-Demand	Anodyne	DRD3	23	41
Cn1c(SC[C@@H]2CCCCC2(F)F)nnc1-c1ccccc1	ZINC000450655309	DI	On-Demand	Anodyne	DRD3	23	41
CC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450655312	CH	On-Demand	Anodyne	DRD4	24	45
CC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450655312	CH	On-Demand	Anodyne	SIGMAR1	31	42
CC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450655312	CH	On-Demand	Anodyne	CCR3	38	45
CC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450655312	CH	On-Demand	Anodyne	MLNR	42	35
CC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450655312	CH	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450655312	CH	On-Demand	Anodyne	MCHR1	16	45
CC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450655312	CH	On-Demand	Anodyne	NOD1	37	48
CC(=O)c1ccc(CN2CCc3cc(F)ccc3C2)cc1	ZINC000450655312	CH	On-Demand	Anodyne	NOD2	55	48
COc1cccc(OCCC(=O)N2CCO[C@@H](Cc3ccccc3)C2)c1	ZINC000450655314	FF	On-Demand	Anodyne	LUCI_PHOPY	22	40
COc1cccc(OCCC(=O)N2CCO[C@@H](Cc3ccccc3)C2)c1	ZINC000450655314	FF	On-Demand	Anodyne	RORC	40	36
COc1cccc(OCCC(=O)N2CCO[C@H](Cc3ccccc3)C2)c1	ZINC000450655315	FF	On-Demand	Anodyne	LUCI_PHOPY	22	40
COc1cccc(OCCC(=O)N2CCO[C@H](Cc3ccccc3)C2)c1	ZINC000450655315	FF	On-Demand	Anodyne	RORC	40	36
CC(=O)CCCCCSc1nnc(-c2ccccc2)n1C	ZINC000450655332	DH	On-Demand	Anodyne	DRD2	0	44
CC(=O)CCCCCSc1nnc(-c2ccccc2)n1C	ZINC000450655332	DH	On-Demand	Anodyne	DRD3	37	44
CC(=O)CCCCCSc1nnc(-c2ccccc2)n1C	ZINC000450655332	DH	On-Demand	Anodyne	KCNH2	19	44
CCOc1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)c2ncccc12	ZINC000450655340	GI	On-Demand	Anodyne	HDAC1	0	41
CC(C)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655347	CI	On-Demand	Anodyne	TBXAS1	49	39
CC(C)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655347	CI	On-Demand	Anodyne	PTAFR	30	42
CC(C)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655347	CI	On-Demand	Anodyne	FDFT1	0	45
CC(C)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655347	CI	On-Demand	Anodyne	CYP11B2	40	38
CC(C)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655347	CI	On-Demand	Anodyne	HAO2	17	44
CC(C)CCCC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655347	CI	On-Demand	Anodyne	SUCNR1	49	45
Cn1c(C(=O)N2CCc3c(-c4ccccc4)cccc32)c2n(c1=O)CCCC2	ZINC000450655351	FG	On-Demand	Anodyne	AVPR2	26	45
COc1cccc(-n2cc(C(=O)NC[C@@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655352	GG	On-Demand	Anodyne	DRD4	44	34
COc1cccc(-n2cc(C(=O)NC[C@@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655352	GG	On-Demand	Anodyne	NQO2	30	41
COc1cccc(-n2cc(C(=O)NC[C@@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655352	GG	On-Demand	Anodyne	MTR1B_CHICK	0	51
COc1cccc(-n2cc(C(=O)NC[C@@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655352	GG	On-Demand	Anodyne	HTR6	44	41
COc1cccc(-n2cc(C(=O)NC[C@@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655352	GG	On-Demand	Anodyne	MTNR1A	32	43
COc1cccc(-n2cc(C(=O)NC[C@@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655352	GG	On-Demand	Anodyne	EBP	18	44
COc1cccc(-n2cc(C(=O)NC[C@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655353	GG	On-Demand	Anodyne	DRD4	44	34
COc1cccc(-n2cc(C(=O)NC[C@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655353	GG	On-Demand	Anodyne	NQO2	30	41
COc1cccc(-n2cc(C(=O)NC[C@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655353	GG	On-Demand	Anodyne	MTR1B_CHICK	0	51
COc1cccc(-n2cc(C(=O)NC[C@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655353	GG	On-Demand	Anodyne	HTR6	44	41
COc1cccc(-n2cc(C(=O)NC[C@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655353	GG	On-Demand	Anodyne	MTNR1A	32	43
COc1cccc(-n2cc(C(=O)NC[C@H]3CCCc4cc(OC)ccc43)nn2)c1	ZINC000450655353	GG	On-Demand	Anodyne	EBP	18	44
Cc1cnc(CCCC(=O)NCCc2c(C)oc3ccccc23)o1	ZINC000450655381	EH	On-Demand	Anodyne	MTNR1A	36	40
Cc1cnc(CCCC(=O)NCCc2c(C)oc3ccccc23)o1	ZINC000450655381	EH	On-Demand	Anodyne	MTNR1B	35	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450655382	GH	On-Demand	Anodyne	SSTR2	29	41
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450655382	GH	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450655383	GH	On-Demand	Anodyne	SSTR2	29	41
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450655383	GH	On-Demand	Anodyne	RHODESAIN	0	42
COc1cc2c(N[C@@H](C)CCCCO)ncnc2cc1F	ZINC000450655385	CF	On-Demand	Anodyne	EGFR	39	41
COc1cc2c(N[C@@H](C)CCCCO)ncnc2cc1F	ZINC000450655385	CF	On-Demand	Anodyne	FGFR1	0	45
COc1cc2c(N[C@@H](C)CCCCO)ncnc2cc1F	ZINC000450655385	CF	On-Demand	Anodyne	FLT1	23	41
COc1cc2c(N[C@H](C)CCCCO)ncnc2cc1F	ZINC000450655386	CF	On-Demand	Anodyne	EGFR	39	41
COc1cc2c(N[C@H](C)CCCCO)ncnc2cc1F	ZINC000450655386	CF	On-Demand	Anodyne	FGFR1	0	45
COc1cc2c(N[C@H](C)CCCCO)ncnc2cc1F	ZINC000450655386	CF	On-Demand	Anodyne	FLT1	23	41
NC(=O)c1cnc(N[C@H]2CCCC[C@H]2CC(F)(F)F)c(Cl)c1	ZINC000450655387	EH	On-Demand	Anodyne	SYK	40	37
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	DRD4	37	41
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	OPRK1	31	44
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	HTR4	45	38
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	SIGMAR1	28	42
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	CCR3	45	40
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	MLNR	57	36
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	CXCR3	28	40
COC(=O)c1ccc(CN2CC[C@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655395	CE	On-Demand	Anodyne	MCHR1	36	45
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	DRD4	37	41
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	OPRK1	31	44
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	HTR4	45	38
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	SIGMAR1	28	42
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	CCR3	45	40
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	MLNR	57	36
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	CXCR3	28	40
COC(=O)c1ccc(CN2CC[C@H](C)[C@H](O)C2)cc1Cl	ZINC000450655396	CE	On-Demand	Anodyne	MCHR1	36	45
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	DRD4	37	41
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	OPRK1	31	44
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	HTR4	45	38
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	SIGMAR1	28	42
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	CCR3	45	40
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	MLNR	57	36
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	CXCR3	28	40
COC(=O)c1ccc(CN2CC[C@@H](C)[C@H](O)C2)cc1Cl	ZINC000450655397	CE	On-Demand	Anodyne	MCHR1	36	45
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	DRD4	37	41
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	OPRK1	31	44
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	HTR4	45	38
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	SIGMAR1	28	42
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	CCR3	45	40
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	MLNR	57	36
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	CXCR3	28	40
COC(=O)c1ccc(CN2CC[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000450655399	CE	On-Demand	Anodyne	MCHR1	36	45
CSCC1CCC(Nc2cc(N3CCC[C@H]3CO)ncn2)CC1	ZINC000450655400	EF	On-Demand	Anodyne	PRCP	0	42
CSCC1CCC(Nc2cc(N3CCC[C@@H]3CO)ncn2)CC1	ZINC000450655402	EF	On-Demand	Anodyne	PRCP	0	42
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450655408	FH	On-Demand	Anodyne	CCKAR	0	41
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450655408	FH	On-Demand	Anodyne	CCKBR	0	41
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450655408	FH	On-Demand	Anodyne	RHOA	0	41
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450655408	FH	On-Demand	Anodyne	L3MBTL3	47	38
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450655410	FH	On-Demand	Anodyne	CCKAR	0	41
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450655410	FH	On-Demand	Anodyne	CCKBR	0	41
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450655410	FH	On-Demand	Anodyne	RHOA	0	41
CC(C)CC(CC(C)C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450655410	FH	On-Demand	Anodyne	L3MBTL3	47	38
Cc1oc2ccccc2c1CCNC(=O)C1(C(F)(F)F)CCC1	ZINC000450655427	EI	On-Demand	Anodyne	MTNR1A	22	42
Cc1oc2ccccc2c1CCNC(=O)C1(C(F)(F)F)CCC1	ZINC000450655427	EI	On-Demand	Anodyne	MTNR1B	23	42
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	HTR1A	26	47
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	DRD2	34	48
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	DRD1	22	47
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	DRD4	24	44
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	ADRA1D	38	44
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	ADRA1A	36	47
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	ADRA1B	35	44
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	DRD3	26	44
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	ADRA2C	24	43
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	HTR7	42	53
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	SIGMAR1	32	43
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	CYP2J2	63	46
COCC1(C)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450655429	CG	On-Demand	Anodyne	AP2S1	0	43
FC(F)(F)C[C@@H]1CCCC[C@@H]1Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450655434	FI	On-Demand	Anodyne	DHOD	0	50
Cc1nc(N(C)C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655444	GC	On-Demand	Anodyne	CA2	33	51
Cc1nc(N(C)C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655444	GC	On-Demand	Anodyne	CA1	29	50
Cc1nc(N(C)C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655444	GC	On-Demand	Anodyne	CA12	27	49
Cc1nc(N(C)C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655444	GC	On-Demand	Anodyne	CA9	32	51
Cc1nc(N(C)C)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655444	GC	On-Demand	Anodyne	DKK1	0	41
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccnc(OC(F)F)c1	ZINC000450655447	GF	On-Demand	Anodyne	TAAR1	38	40
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccnc(OC(F)F)c1	ZINC000450655447	GF	On-Demand	Anodyne	KCNK3	92	47
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccnc(OC(F)F)c1	ZINC000450655447	GF	On-Demand	Anodyne	KCNK9	44	34
COCc1cc(N[C@H]2CCCC[C@H]2CC(F)(F)F)n2ncnc2n1	ZINC000450655449	EG	On-Demand	Anodyne	DHOD	0	40
Cc1ccc([N+](=O)[O-])c(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)c1	ZINC000450655456	GE	On-Demand	Bother	CA2	15	40
COC(=O)c1ccc2c(c1)CN(Cc1nc(-c3cc(C)ccn3)no1)CC2	ZINC000450655461	FF	On-Demand	Anodyne	ABCB1	0	40
COC(=O)c1ccc2c(c1)CN(Cc1nc(-c3cc(C)ccn3)no1)CC2	ZINC000450655461	FF	On-Demand	Anodyne	ABCG2	29	40
COC(=O)c1ccc2c(c1)CN(Cc1nc(-c3cc(C)ccn3)no1)CC2	ZINC000450655461	FF	On-Demand	Anodyne	NOD2	41	36
C[C@H]1[C@@H](C)N(C)CCN1CCN(C)Cc1ccccc1	ZINC000450655481	CE	On-Demand	Anodyne	SIGMAR1	24	43
C[C@H]1[C@H](C)N(CCN(C)Cc2ccccc2)CCN1C	ZINC000450655485	CE	On-Demand	Anodyne	SIGMAR1	24	43
C[C@@H]1[C@@H](C)N(CCN(C)Cc2ccccc2)CCN1C	ZINC000450655487	CE	On-Demand	Anodyne	SIGMAR1	24	43
C[C@H]1[C@@H](C)N(CCN(C)Cc2ccccc2)CCN1C	ZINC000450655489	CE	On-Demand	Anodyne	SIGMAR1	24	43
C[C@H]1OCCN(c2cc(-c3ccccc3)nc3ncnn23)[C@@H]1C(N)=O	ZINC000450655491	EC	In-Stock	Anodyne	COLA	44	35
COc1ccc(CNC(=O)CCNC(C)(C)C(C)(C)O)c(OC)c1	ZINC000450655510	ED	On-Demand	Anodyne	MTNR1A	84	42
COc1ccc(CNC(=O)CCNC(C)(C)C(C)(C)O)c(OC)c1	ZINC000450655510	ED	On-Demand	Anodyne	MTNR1B	46	38
CCc1nc(C)c(CSc2nnc(-c3ccc(Cl)cc3)o2)o1	ZINC000450655517	EJ	On-Demand	Anodyne	GSK3B	17	43
CCc1nc(C)c(CSc2nnc(-c3ccc(Cl)cc3)o2)o1	ZINC000450655517	EJ	On-Demand	Anodyne	GSK3A	44	39
CCc1nc(C)c(CSc2nnc(-c3ccc(Cl)cc3)o2)o1	ZINC000450655517	EJ	On-Demand	Anodyne	TERT	24	46
COCCn1c(SCc2c(C)cccc2Cl)nnc1-c1ccncc1	ZINC000450655545	FI	On-Demand	Anodyne	CASR	0	44
CCc1cc(CC)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655554	GD	On-Demand	Anodyne	CA2	39	50
CCc1cc(CC)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655554	GD	On-Demand	Anodyne	CA1	34	50
CCc1cc(CC)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655554	GD	On-Demand	Anodyne	CA12	25	46
CCc1cc(CC)nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655554	GD	On-Demand	Anodyne	CA9	39	50
CCN(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1COC1	ZINC000450655570	CF	On-Demand	Bother	AADAC	0	42
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450655572	EG	On-Demand	Anodyne	L3MBTL1	0	41
C[C@H]1CCC[C@@]1(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450655574	EG	On-Demand	Anodyne	L3MBTL1	0	41
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450655577	EG	On-Demand	Anodyne	L3MBTL1	0	41
C[C@H]1CCC[C@]1(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450655578	EG	On-Demand	Anodyne	L3MBTL1	0	41
CCOC(=O)c1cc(C(=O)N2CCN(c3ccccc3)C(=O)C2)on1	ZINC000450655588	ED	On-Demand	Anodyne	P2RY12	52	34
CCOC(=O)c1cc(C(=O)N2CCN(c3ccccc3)C(=O)C2)on1	ZINC000450655588	ED	On-Demand	Anodyne	P2RX7	0	41
CC(C)Cn1cc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)c(C(F)F)n1	ZINC000450655591	GG	On-Demand	Anodyne	P2RX7	25	43
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	HTR1A	15	40
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	DRD2	23	40
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	ACHE	51	52
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	CHRM3	20	42
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	GRIN2B	67	39
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	PTAFR	17	41
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	HRH3	18	52
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	SIGMAR1	49	46
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	SSTR5	46	36
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	NPY2R	53	41
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	CCR3	84	48
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	CHRNA7	51	43
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	SLC18A3	17	41
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	FAAH	25	43
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	MCHR1	34	40
CC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1	ZINC000450655592	DH	On-Demand	Anodyne	ACHP_LYMST	28	42
COC1(CSc2nnc(-c3ccc(Cl)cc3)o2)CCC1	ZINC000450655604	DI	On-Demand	Anodyne	GSK3B	0	42
COC1(CSc2nnc(-c3ccc(Cl)cc3)o2)CCC1	ZINC000450655604	DI	On-Demand	Anodyne	TERT	23	44
COc1cc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)ccc1Cl	ZINC000450655610	DF	On-Demand	Anodyne	FKBP1A	48	36
COc1cc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)ccc1Cl	ZINC000450655610	DF	On-Demand	Anodyne	OPRM1	26	63
COc1cc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)ccc1Cl	ZINC000450655610	DF	On-Demand	Anodyne	OPRK1	27	50
COc1cc(CC(=O)N2CCCC[C@@H]2[C@@H](C)O)ccc1Cl	ZINC000450655610	DF	On-Demand	Anodyne	MBTPS1	49	31
COc1cc(CC(=O)N2CCCC[C@H]2[C@H](C)O)ccc1Cl	ZINC000450655622	DF	On-Demand	Anodyne	OPRM1	26	63
COc1cc(CC(=O)N2CCCC[C@H]2[C@H](C)O)ccc1Cl	ZINC000450655622	DF	On-Demand	Anodyne	OPRK1	61	63
COc1cc(CC(=O)N2CCCC[C@H]2[C@H](C)O)ccc1Cl	ZINC000450655622	DF	On-Demand	Anodyne	MBTPS1	49	31
COc1cc(CC(=O)N2CCCC[C@H]2[C@@H](C)O)ccc1Cl	ZINC000450655623	DF	On-Demand	Anodyne	FKBP1A	48	36
COc1cc(CC(=O)N2CCCC[C@H]2[C@@H](C)O)ccc1Cl	ZINC000450655623	DF	On-Demand	Anodyne	OPRM1	26	63
COc1cc(CC(=O)N2CCCC[C@H]2[C@@H](C)O)ccc1Cl	ZINC000450655623	DF	On-Demand	Anodyne	OPRK1	27	50
COc1cc(CC(=O)N2CCCC[C@H]2[C@@H](C)O)ccc1Cl	ZINC000450655623	DF	On-Demand	Anodyne	MBTPS1	49	31
COc1cc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)ccc1Cl	ZINC000450655625	DF	On-Demand	Anodyne	FKBP1A	48	36
COc1cc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)ccc1Cl	ZINC000450655625	DF	On-Demand	Anodyne	OPRM1	26	63
COc1cc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)ccc1Cl	ZINC000450655625	DF	On-Demand	Anodyne	OPRK1	27	50
COc1cc(CC(=O)N2CCCC[C@@H]2[C@H](C)O)ccc1Cl	ZINC000450655625	DF	On-Demand	Anodyne	MBTPS1	49	31
NC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655645	CD	On-Demand	Anodyne	DRD2	35	46
NC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655645	CD	On-Demand	Anodyne	DRD4	25	49
NC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655645	CD	On-Demand	Anodyne	HTR2A	35	56
NC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655645	CD	On-Demand	Anodyne	HTR2C	29	60
NC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655645	CD	On-Demand	Anodyne	SLC6A1	41	35
NC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655645	CD	On-Demand	Anodyne	HTR3B	0	46
NC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655645	CD	On-Demand	Anodyne	CYP2J2	57	40
NC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655646	CD	On-Demand	Anodyne	DRD2	35	46
NC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655646	CD	On-Demand	Anodyne	DRD4	25	49
NC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655646	CD	On-Demand	Anodyne	HTR2A	35	56
NC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655646	CD	On-Demand	Anodyne	HTR2C	29	60
NC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655646	CD	On-Demand	Anodyne	SLC6A1	41	35
NC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655646	CD	On-Demand	Anodyne	HTR3B	0	46
NC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450655646	CD	On-Demand	Anodyne	CYP2J2	57	40
CC(=O)c1cccc(CN2CC(=O)N(Cc3ccccc3)C2)c1	ZINC000450655654	DF	On-Demand	Anodyne	ACHE	17	40
Cc1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)s1	ZINC000450655655	ED	On-Demand	Anodyne	DKK1	0	45
CN(CCCC(=O)c1ccccc1)CCC1CCN(c2ccncc2)CC1	ZINC000450655662	FI	On-Demand	Anodyne	ACHE	21	48
CN(CCCC(=O)c1ccccc1)CCC1CCN(c2ccncc2)CC1	ZINC000450655662	FI	On-Demand	Anodyne	SSTR1	44	53
CN(CCCC(=O)c1ccccc1)CCC1CCN(c2ccncc2)CC1	ZINC000450655662	FI	On-Demand	Anodyne	CYP2J2	50	35
COC(=O)c1ccc(CC(=O)N2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450655667	FD	On-Demand	Anodyne	GPR183	0	42
CCOc1cc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)on1	ZINC000450655669	ED	On-Demand	Anodyne	P2RX7	18	40
CO[C@@H](Cc1ccccc1)CN1CCC(CCCN(C)C)CC1	ZINC000450655743	DG	On-Demand	Anodyne	ACHE	30	41
CO[C@@H](Cc1ccccc1)CN1CCC(CCCN(C)C)CC1	ZINC000450655743	DG	On-Demand	Anodyne	SLC6A3	18	44
CO[C@H](Cc1ccccc1)CN1CCC(CCCN(C)C)CC1	ZINC000450655744	DG	On-Demand	Anodyne	ACHE	30	41
CO[C@H](Cc1ccccc1)CN1CCC(CCCN(C)C)CC1	ZINC000450655744	DG	On-Demand	Anodyne	SLC6A3	18	44
Cc1nc(C)c(C)c(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655753	FD	On-Demand	Anodyne	CA2	25	43
Cc1nc(C)c(C)c(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450655753	FD	On-Demand	Anodyne	CA12	21	43
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000450655763	FJ	On-Demand	Anodyne	CCR2	51	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450655764	FJ	On-Demand	Anodyne	CCR2	51	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000450655765	FJ	On-Demand	Anodyne	CCR2	51	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000450655767	FJ	On-Demand	Anodyne	CCR2	51	37
CO[C@@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655819	EH	On-Demand	Anodyne	THRA	0	43
CO[C@@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655819	EH	On-Demand	Anodyne	MME	50	38
CO[C@@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655819	EH	On-Demand	Anodyne	THRB	0	43
CO[C@@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655819	EH	On-Demand	Anodyne	MTNR1A	34	50
CO[C@@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655819	EH	On-Demand	Anodyne	MTNR1B	33	50
CO[C@@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655819	EH	On-Demand	Anodyne	PTPN1	16	42
CO[C@@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655819	EH	On-Demand	Anodyne	CAPN1	15	43
CO[C@@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655819	EH	On-Demand	Anodyne	AMP1_PLAFQ	51	40
CO[C@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655820	EH	On-Demand	Anodyne	THRA	0	43
CO[C@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655820	EH	On-Demand	Anodyne	MME	50	38
CO[C@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655820	EH	On-Demand	Anodyne	THRB	0	43
CO[C@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655820	EH	On-Demand	Anodyne	MTNR1A	34	50
CO[C@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655820	EH	On-Demand	Anodyne	MTNR1B	33	50
CO[C@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655820	EH	On-Demand	Anodyne	PTPN1	16	42
CO[C@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655820	EH	On-Demand	Anodyne	CAPN1	15	43
CO[C@H](Cc1ccccc1)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450655820	EH	On-Demand	Anodyne	AMP1_PLAFQ	51	40
Cc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1NC(=O)CCN(C)C	ZINC000450655844	FF	On-Demand	Anodyne	LDLR	0	40
C[C@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655848	EH	On-Demand	Anodyne	CSF1R	25	40
C[C@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655848	EH	On-Demand	Anodyne	LUCI_LUCLA	23	40
C[C@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655848	EH	On-Demand	Anodyne	TAAR1	23	47
C[C@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655848	EH	On-Demand	Anodyne	KCNK3	91	41
C[C@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655848	EH	On-Demand	Anodyne	KCNK9	62	41
C[C@@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655849	EH	On-Demand	Anodyne	CSF1R	25	40
C[C@@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655849	EH	On-Demand	Anodyne	LUCI_LUCLA	23	40
C[C@@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655849	EH	On-Demand	Anodyne	TAAR1	23	47
C[C@@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655849	EH	On-Demand	Anodyne	KCNK3	91	41
C[C@@H](CCCCO)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450655849	EH	On-Demand	Anodyne	KCNK9	62	41
COc1ccc(Oc2ccc(C(=O)N[C@H](C)CC(F)(F)F)nc2)cc1	ZINC000450655870	FH	On-Demand	Anodyne	ACACB	42	40
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)CC(F)(F)F)nc2)cc1	ZINC000450655872	FH	On-Demand	Anodyne	ACACB	42	40
Cc1cc(=N[C@H](C)CCCCO)c2cc(F)ccc2[nH]1	ZINC000450655876	CG	On-Demand	Anodyne	MPO	51	32
Cc1cc(=N[C@@H](C)CCCCO)c2cc(F)ccc2[nH]1	ZINC000450655877	CG	On-Demand	Anodyne	MPO	51	32
CCC[C@H](OC)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655893	CG	On-Demand	Anodyne	PTAFR	26	41
CCC[C@H](OC)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655893	CG	On-Demand	Anodyne	CYP11B2	29	41
CCC[C@@H](OC)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655896	CG	On-Demand	Anodyne	PTAFR	26	41
CCC[C@@H](OC)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450655896	CG	On-Demand	Anodyne	CYP11B2	29	41
Cc1ccc(NC(=O)C(C)(C)C2CCC2)cc1NC(=O)CCN(C)C	ZINC000450655906	EH	On-Demand	Anodyne	LDLR	0	48
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450655925	GF	On-Demand	Anodyne	RHODESAIN	0	41
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450655926	GF	On-Demand	Anodyne	RHODESAIN	0	41
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450655927	GF	On-Demand	Anodyne	RHODESAIN	0	41
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450655928	GF	On-Demand	Anodyne	RHODESAIN	0	41
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cc2n(n1)CCC2	ZINC000450655935	ED	On-Demand	Anodyne	P2RY12	68	34
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cc2n(n1)CCC2	ZINC000450655936	ED	On-Demand	Anodyne	P2RY12	68	34
CSCC1CCC(Nc2cc(C(C)=O)ccc2C#N)CC1	ZINC000450655944	DI	On-Demand	Mild	CSNK2A1	43	33
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450655968	EG	On-Demand	Anodyne	SFRP1	52	32
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450655969	EG	On-Demand	Anodyne	SFRP1	52	32
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655982	GI	On-Demand	Anodyne	NQO2	27	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655982	GI	On-Demand	Anodyne	MTR1B_CHICK	0	48
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655982	GI	On-Demand	Anodyne	HTR6	37	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655982	GI	On-Demand	Anodyne	MTNR1A	16	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655982	GI	On-Demand	Anodyne	EBP	17	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655983	GI	On-Demand	Anodyne	NQO2	27	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655983	GI	On-Demand	Anodyne	MTR1B_CHICK	0	48
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655983	GI	On-Demand	Anodyne	HTR6	37	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655983	GI	On-Demand	Anodyne	MTNR1A	16	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450655983	GI	On-Demand	Anodyne	EBP	17	41
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	HTR1A	15	58
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	DRD2	42	58
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	DRD1	26	56
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	DRD4	17	52
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	HTR2A	23	63
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	HTR2C	19	58
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	HRH1	16	58
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	DRD3	15	55
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	DRD5	15	44
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	ERG2	27	58
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	SIGMAR1	16	55
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	HTR3B	0	45
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	CYP2J2	60	43
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	NET	0	58
CCC1(CO)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656006	DG	On-Demand	Anodyne	AP2S1	0	58
CC(=O)c1cccc(CN2CCO[C@H](c3cccc(C#N)c3)C2)c1	ZINC000450656020	DG	On-Demand	Mild	CCR3	17	41
CC(=O)c1cccc(CN2CCO[C@@H](c3cccc(C#N)c3)C2)c1	ZINC000450656021	DG	On-Demand	Mild	CCR3	17	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1	ZINC000450656029	CF	On-Demand	Anodyne	SIGMAR1	22	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1	ZINC000450656030	CF	On-Demand	Anodyne	SIGMAR1	22	40
O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450656031	GJ	On-Demand	Anodyne	RBP4	79	39
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450656032	GJ	On-Demand	Anodyne	RBP4	79	39
O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450656033	GJ	On-Demand	Anodyne	RBP4	79	39
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450656034	EH	On-Demand	Anodyne	MC4R	26	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450656034	EH	On-Demand	Anodyne	PRCP	50	37
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450656034	EH	On-Demand	Anodyne	MC3R	34	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450656034	EH	On-Demand	Anodyne	MC5R	27	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450656035	EH	On-Demand	Anodyne	MC4R	26	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450656035	EH	On-Demand	Anodyne	PRCP	50	37
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450656035	EH	On-Demand	Anodyne	MC3R	34	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450656035	EH	On-Demand	Anodyne	MC5R	27	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450656036	EH	On-Demand	Anodyne	MC4R	26	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450656036	EH	On-Demand	Anodyne	PRCP	50	37
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450656036	EH	On-Demand	Anodyne	MC3R	34	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450656036	EH	On-Demand	Anodyne	MC5R	27	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450656037	EH	On-Demand	Anodyne	MC4R	26	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450656037	EH	On-Demand	Anodyne	PRCP	50	37
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450656037	EH	On-Demand	Anodyne	MC3R	34	40
C[C@H](O)[C@@H]1CCCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450656037	EH	On-Demand	Anodyne	MC5R	27	40
CC1(O)CC(C(=O)Nc2n[nH]c(-c3cc(Cl)ccc3Cl)n2)C1	ZINC000450656038	EF	On-Demand	Anodyne	ENV	44	35
CN(CCN1CC[C@H](C2CC2)C1)Cc1ccccc1	ZINC000450656039	CF	On-Demand	Anodyne	DRD2	0	40
CN(CCN1CC[C@H](C2CC2)C1)Cc1ccccc1	ZINC000450656039	CF	On-Demand	Anodyne	SLC6A1	41	33
CN(CCN1CC[C@H](C2CC2)C1)Cc1ccccc1	ZINC000450656039	CF	On-Demand	Anodyne	CCR5	40	40
CN(CCN1CC[C@@H](C2CC2)C1)Cc1ccccc1	ZINC000450656040	CF	On-Demand	Anodyne	DRD2	0	40
CN(CCN1CC[C@@H](C2CC2)C1)Cc1ccccc1	ZINC000450656040	CF	On-Demand	Anodyne	SLC6A1	41	33
CN(CCN1CC[C@@H](C2CC2)C1)Cc1ccccc1	ZINC000450656040	CF	On-Demand	Anodyne	CCR5	40	40
CC(C)c1nnc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)s1	ZINC000450656042	FI	On-Demand	Anodyne	SIGMAR1	48	43
CC(C)c1nnc(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)s1	ZINC000450656042	FI	On-Demand	Anodyne	NPFFR1	47	34
CC(F)(F)CCSc1nnc(-c2cccs2)n1C[C@H]1CCCO1	ZINC000450656047	FI	On-Demand	Anodyne	PDE8B	17	42
CC(F)(F)CCSc1nnc(-c2cccs2)n1C[C@@H]1CCCO1	ZINC000450656048	FI	On-Demand	Anodyne	PDE8B	17	42
COC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1Cl	ZINC000450656064	CG	On-Demand	Anodyne	DRD4	36	42
COC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1Cl	ZINC000450656064	CG	On-Demand	Anodyne	HTR4	52	33
COC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1Cl	ZINC000450656064	CG	On-Demand	Anodyne	SIGMAR1	32	42
COC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1Cl	ZINC000450656064	CG	On-Demand	Anodyne	CCR3	53	41
COC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1Cl	ZINC000450656064	CG	On-Demand	Anodyne	MLNR	44	37
COC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1Cl	ZINC000450656064	CG	On-Demand	Anodyne	MCHR1	38	46
COC(=O)c1ccc(CN2CC[C@@H](C3CC3)C2)cc1Cl	ZINC000450656064	CG	On-Demand	Anodyne	CACNA1I	41	33
COC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1Cl	ZINC000450656065	CG	On-Demand	Anodyne	DRD4	36	42
COC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1Cl	ZINC000450656065	CG	On-Demand	Anodyne	HTR4	52	33
COC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1Cl	ZINC000450656065	CG	On-Demand	Anodyne	SIGMAR1	32	42
COC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1Cl	ZINC000450656065	CG	On-Demand	Anodyne	CCR3	53	41
COC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1Cl	ZINC000450656065	CG	On-Demand	Anodyne	MLNR	44	37
COC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1Cl	ZINC000450656065	CG	On-Demand	Anodyne	MCHR1	38	46
COC(=O)c1ccc(CN2CC[C@H](C3CC3)C2)cc1Cl	ZINC000450656065	CG	On-Demand	Anodyne	CACNA1I	41	33
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	CACNA1H	25	42
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	DRD2	16	44
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	DRD4	35	50
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	HRH2	18	42
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	SLC6A1	38	50
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	DRD3	15	43
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	LTA4H	16	56
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	HRH3	17	42
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	SIGMAR1	39	50
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	UTS2R	23	47
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	CCR2	18	50
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	SLC6A5	26	41
NC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656068	CD	On-Demand	Anodyne	BIRC2	75	51
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	CACNA1H	25	42
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	DRD2	16	44
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	DRD4	35	50
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	HRH2	18	42
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	SLC6A1	38	50
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	DRD3	15	43
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	LTA4H	16	56
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	HRH3	17	42
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	SIGMAR1	39	50
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	UTS2R	23	47
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	CCR2	18	50
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	SLC6A5	26	41
NC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450656069	CD	On-Demand	Anodyne	BIRC2	75	51
COc1cccc(OCCC(=O)N2CCN(C(=O)C(C)(C)C)CC2(C)C)c1	ZINC000450656079	GF	On-Demand	Anodyne	MTNR1B	16	40
COCCOC[C@H](O)CN1CCN2CCOc3cccc1c32	ZINC000450656086	DC	On-Demand	Anodyne	HSP90AB1	40	42
COCCOC[C@@H](O)CN1CCN2CCOc3cccc1c32	ZINC000450656087	DC	On-Demand	Anodyne	HSP90AB1	40	42
c1cncc(CC2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450656089	DF	On-Demand	Anodyne	SIGMAR1	22	46
Cc1nc(C)c(F)c(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450656090	FD	On-Demand	Anodyne	CA2	24	41
Cc1nc(C)c(F)c(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450656090	FD	On-Demand	Anodyne	CA12	18	41
CCc1cccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)n1	ZINC000450656094	FE	On-Demand	Anodyne	EPHX2	21	43
CCc1cccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)n1	ZINC000450656094	FE	On-Demand	Anodyne	L3MBTL3	52	39
CCc1cccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)n1	ZINC000450656094	FE	On-Demand	Anodyne	KCNK3	78	38
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450656097	GE	On-Demand	Bother	CACNA1C	43	34
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450656097	GE	On-Demand	Bother	CACNA1D	69	34
CCn1c(SCc2nc(C(=O)OC)co2)nc2ccccc2c1=O	ZINC000450656098	EE	On-Demand	Anodyne	SLC27A1	43	38
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450656099	GE	On-Demand	Bother	CACNA1C	43	34
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450656099	GE	On-Demand	Bother	CACNA1D	69	34
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450656100	GE	On-Demand	Bother	CACNA1C	43	34
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450656100	GE	On-Demand	Bother	CACNA1D	69	34
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450656101	GE	On-Demand	Bother	CACNA1C	43	34
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450656101	GE	On-Demand	Bother	CACNA1D	69	34
CC(C)(NCc1cnns1)C(=O)NCC1CCCC1	ZINC000450656114	CD	On-Demand	Anodyne	CACNA1I	40	31
CCN(CCC1CCN(Cc2cccc(C(C)=O)c2)CC1)CC1CC1	ZINC000450656145	EI	On-Demand	Anodyne	ACHE	51	56
CCN(CCC1CCN(Cc2cccc(C(C)=O)c2)CC1)CC1CC1	ZINC000450656145	EI	On-Demand	Anodyne	CHRM3	18	42
CCN(CCC1CCN(Cc2cccc(C(C)=O)c2)CC1)CC1CC1	ZINC000450656145	EI	On-Demand	Anodyne	SIGMAR1	34	42
CCN(CCC1CCN(Cc2cccc(C(C)=O)c2)CC1)CC1CC1	ZINC000450656145	EI	On-Demand	Anodyne	CCR3	36	42
CCN(CCC1CCN(Cc2cccc(C(C)=O)c2)CC1)CC1CC1	ZINC000450656145	EI	On-Demand	Anodyne	CACNA1I	33	40
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	THRA	0	40
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	DRD2	41	60
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	DRD1	33	55
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	DRD4	0	60
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	ADRA1D	56	39
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	HTR2A	25	62
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	HTR2C	23	60
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	ADRA1B	37	40
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	DRD3	23	59
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	ADRA2B	0	60
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	DRD5	24	43
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	ERG2	28	60
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	HTR7	23	43
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	SLC18A3	24	58
COC(=O)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450656164	DD	On-Demand	Anodyne	CYP2J2	54	39
COC(=O)[C@@H](CC(C)C)N(C)c1ncc([N+](=O)[O-])s1	ZINC000450656173	CE	On-Demand	Bother	MAPK9	15	40
COCCOC[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450656174	DD	On-Demand	Anodyne	ADRB2	24	56
COCCOC[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450656174	DD	On-Demand	Anodyne	ADRB3	39	56
COCCOC[C@@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450656174	DD	On-Demand	Anodyne	ABCB1	40	38
COC(=O)[C@H](CC(C)C)N(C)c1ncc([N+](=O)[O-])s1	ZINC000450656175	CE	On-Demand	Bother	MAPK9	15	40
CN(C)CCCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450656207	FH	On-Demand	Anodyne	ACHE	37	43
CN(C)CCCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450656207	FH	On-Demand	Anodyne	SIGMAR1	36	41
COCCOC[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450656208	DD	On-Demand	Anodyne	ADRB2	24	56
COCCOC[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450656208	DD	On-Demand	Anodyne	ADRB3	39	56
COCCOC[C@H](O)CN1CCC(Cc2cccnc2)CC1	ZINC000450656208	DD	On-Demand	Anodyne	ABCB1	40	38
CCOC(=O)c1ccc(CN2CCC(OCc3ccccc3OC)CC2)nc1	ZINC000450656212	GG	On-Demand	Anodyne	SSTR5	70	39
CCOC(=O)c1ccc(CN2CCC(OCc3ccccc3OC)CC2)nc1	ZINC000450656212	GG	On-Demand	Anodyne	MBTPS1	53	38
CN(CCc1cscn1)CCC1CCN(c2ccncc2)CC1	ZINC000450656213	EG	On-Demand	Anodyne	SSTR1	21	43
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	HTR1A	25	48
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	DRD2	21	40
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	DRD4	41	31
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	ACHE	22	44
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	HRH1	15	49
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	HTR4	40	44
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	PDGFRB	42	39
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	GRIN2B	40	40
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	HTR7	34	48
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	BMP1	15	41
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	TRPV1	0	42
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	SIGMAR1	23	44
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	MMP13	19	40
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	NPY2R	57	41
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	CCR3	39	46
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	CHRNA7	55	51
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	C3AR1	41	44
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	MTNR1A	60	39
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	MTNR1B	51	39
COc1ccc(CNC(=O)CCN2CCC(Cc3cccnc3)CC2)c(OC)c1	ZINC000450656215	GG	On-Demand	Anodyne	NPY5R	20	41
CN(CCN(C)c1ccc(S(C)(=O)=O)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656218	GC	On-Demand	Anodyne	CA2	22	44
CN(CCN(C)c1ccc(S(C)(=O)=O)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656218	GC	On-Demand	Anodyne	CA12	17	44
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	DRD2	18	45
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	DRD4	36	41
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	ACHE	45	54
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	HRH1	26	41
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	DRD3	28	41
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	HTR4	66	34
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	SIGMAR1	53	45
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	SSTR5	47	39
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	NPY2R	48	37
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	BCHE	0	54
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	CCR3	89	44
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	CHRNA7	42	41
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	C3AR1	41	37
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	FAAH	24	41
COC(=O)c1ccc(CN2CCC(Cc3cccnc3)CC2)cc1Cl	ZINC000450656228	FH	On-Demand	Anodyne	MCHR1	43	43
COC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc(C)c1[N+](=O)[O-]	ZINC000450656229	GF	On-Demand	Bother	CACNA1C	63	38
COC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc(C)c1[N+](=O)[O-]	ZINC000450656229	GF	On-Demand	Bother	CACNA1D	96	38
COC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc(C)c1[N+](=O)[O-]	ZINC000450656231	GF	On-Demand	Bother	CACNA1C	63	38
COC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc(C)c1[N+](=O)[O-]	ZINC000450656231	GF	On-Demand	Bother	CACNA1D	96	38
CC(F)(F)CCSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000450656232	DJ	On-Demand	Anodyne	GSK3B	0	43
CC(F)(F)CCSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000450656232	DJ	On-Demand	Anodyne	TERT	23	45
COC(=O)c1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc(C)c1[N+](=O)[O-]	ZINC000450656233	GF	On-Demand	Bother	CACNA1C	63	38
COC(=O)c1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc(C)c1[N+](=O)[O-]	ZINC000450656233	GF	On-Demand	Bother	CACNA1D	96	38
COC(=O)c1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc(C)c1[N+](=O)[O-]	ZINC000450656234	GF	On-Demand	Bother	CACNA1C	63	38
COC(=O)c1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc(C)c1[N+](=O)[O-]	ZINC000450656234	GF	On-Demand	Bother	CACNA1D	96	38
CC(=O)c1ccc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)cc1	ZINC000450656236	FH	On-Demand	Anodyne	HRH3	21	45
CC(=O)c1ccc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)cc1	ZINC000450656236	FH	On-Demand	Anodyne	L3MBTL1	0	41
CC(=O)c1ccc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)cc1	ZINC000450656236	FH	On-Demand	Anodyne	L3MBTL3	15	41
CC(=O)c1ccc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)cc1	ZINC000450656237	FH	On-Demand	Anodyne	HRH3	21	45
CC(=O)c1ccc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)cc1	ZINC000450656237	FH	On-Demand	Anodyne	L3MBTL1	0	41
CC(=O)c1ccc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)cc1	ZINC000450656237	FH	On-Demand	Anodyne	L3MBTL3	15	41
O=C1CC[C@H](CN2CCC(Cc3cccnc3)CC2)CCN1	ZINC000450656251	DE	On-Demand	Anodyne	GRIN3A	0	42
O=C1CC[C@@H](CN2CCC(Cc3cccnc3)CC2)CCN1	ZINC000450656253	DE	On-Demand	Anodyne	GRIN3A	0	42
COC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450656259	GD	On-Demand	Anodyne	CA2	58	40
COC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450656259	GD	On-Demand	Anodyne	CA1	53	39
COC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450656259	GD	On-Demand	Anodyne	CA4	42	35
COC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450656259	GD	On-Demand	Anodyne	CA12	39	40
COC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450656259	GD	On-Demand	Anodyne	CA9	42	40
COC(=O)c1nc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)sc1C	ZINC000450656259	GD	On-Demand	Anodyne	DKK1	0	42
CCc1cc(N[C@H]2CCCC[C@H]2CC(F)(F)F)n2ncnc2n1	ZINC000450656315	EH	On-Demand	Anodyne	DHOD	0	52
Cc1oc2ccccc2c1CCNC(=O)C1CC(C)(O)C1	ZINC000450656318	CF	On-Demand	Anodyne	MTNR1A	38	46
Cc1oc2ccccc2c1CCNC(=O)C1CC(C)(O)C1	ZINC000450656318	CF	On-Demand	Anodyne	MTNR1B	35	46
CCc1cccc(C(=O)N[C@H](C)CC(F)(F)F)n1	ZINC000450656327	CF	On-Demand	Anodyne	PDE5A	25	40
CCc1cccc(C(=O)N[C@@H](C)CC(F)(F)F)n1	ZINC000450656328	CF	On-Demand	Anodyne	PDE5A	25	40
C=CCn1c(C)nnc1SCc1nc(-c2cc(OC)ncn2)no1	ZINC000450656329	ED	On-Demand	Mild	WNT3A	21	42
C=CCn1c(C)nnc1SCc1nc(-c2cc(OC)ncn2)no1	ZINC000450656329	ED	On-Demand	Mild	TNKS2	17	44
C=CCn1c(C)nnc1SCc1nc(-c2cc(OC)ncn2)no1	ZINC000450656329	ED	On-Demand	Mild	AXIN2	0	44
CC(=O)c1ccc(CN2CCC(OCCN3C[C@H](C)O[C@H](C)C3)CC2)cc1	ZINC000450656330	FF	On-Demand	Anodyne	SIGMAR1	23	41
CC(=O)c1ccc(CN2CCC(OCCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1	ZINC000450656331	FF	On-Demand	Anodyne	SIGMAR1	23	41
CC(=O)c1ccc(CN2CCC(OCCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1	ZINC000450656332	FF	On-Demand	Anodyne	SIGMAR1	23	41
Cc1oc2ccccc2c1CCNC(=O)c1scnc1C(C)C	ZINC000450656338	EI	On-Demand	Anodyne	MTNR1A	16	40
Cc1oc2ccccc2c1CCNC(=O)c1scnc1C(C)C	ZINC000450656338	EI	On-Demand	Anodyne	MTNR1B	18	40
C=CC(C)(C)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450656343	CH	On-Demand	Mild	MTNR1A	23	45
C=CC(C)(C)C(=O)NCCc1c(C)oc2ccccc12	ZINC000450656343	CH	On-Demand	Mild	MTNR1B	23	45
COc1ccccc1[C@@H](C)NCc1nc(-c2cc(C)ccn2)no1	ZINC000450656355	DG	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccccc1[C@H](C)NCc1nc(-c2cc(C)ccn2)no1	ZINC000450656356	DG	On-Demand	Anodyne	LUCI_PHOPE	21	41
COCC1(C)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450656374	FE	On-Demand	Anodyne	DRD4	41	32
COCC1(C)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450656374	FE	On-Demand	Anodyne	HTR7	28	43
COCC1(C)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450656374	FE	On-Demand	Anodyne	MTNR1A	56	41
COCC1(C)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450656374	FE	On-Demand	Anodyne	MTNR1B	44	41
C[C@@H](CCCCO)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450656376	EG	On-Demand	Anodyne	AVPR2	70	39
C[C@@H](CCCCO)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450656376	EG	On-Demand	Anodyne	AVPR1A	48	41
C[C@H](CCCCO)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450656377	EG	On-Demand	Anodyne	AVPR2	70	39
C[C@H](CCCCO)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450656377	EG	On-Demand	Anodyne	AVPR1A	48	41
CNS(=O)(=O)c1ccc(N[C@H]2CCCC[C@H]2CC(F)(F)F)nc1	ZINC000450656401	FF	On-Demand	Anodyne	PTK2	0	42
C=CCn1c(SCc2nc(C(=O)OC)co2)nnc1-c1ccoc1C	ZINC000450656402	FG	On-Demand	Mild	HCRTR2	21	45
CNS(=O)(=O)c1ccc(N[C@@H](C)CCCCO)c(F)c1	ZINC000450656411	DD	On-Demand	Anodyne	LEF	46	33
CNS(=O)(=O)c1ccc(N[C@H](C)CCCCO)c(F)c1	ZINC000450656412	DD	On-Demand	Anodyne	LEF	46	33
COC(=O)c1ccc2c(c1)CN(C[C@](C)(O)C(C)=O)CC2	ZINC000450656444	CD	On-Demand	Anodyne	NOD2	43	37
COC(=O)c1ccc2c(c1)CN(C[C@@](C)(O)C(C)=O)CC2	ZINC000450656445	CD	On-Demand	Anodyne	NOD2	43	37
Cc1csc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450656468	EF	On-Demand	Anodyne	L3MBTL3	50	39
Cc1csc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450656468	EF	On-Demand	Anodyne	KCNK3	83	40
Cc1csc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1	ZINC000450656468	EF	On-Demand	Anodyne	KCNK9	55	42
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)N(C)c2ccc(F)c(Cl)c2)CC3)c1	ZINC000450656474	GI	On-Demand	Anodyne	TACR3	44	33
Cc1oc2ccccc2c1CCNC(=O)CSC1CC1	ZINC000450656476	CG	On-Demand	Anodyne	MTNR1A	30	43
Cc1cccc(-c2nnc3n2C[C@H](C(=O)N(C)c2ccc(F)c(Cl)c2)CC3)c1	ZINC000450656503	GI	On-Demand	Anodyne	TACR3	44	33
CC(C)Oc1ccc2ccccc2c1CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450656507	FI	On-Demand	Anodyne	KCNJ11	41	33
C[C@@H](Sc1ncnc2sc3c(c12)CCCC3)C(=O)Nc1nccs1	ZINC000450656508	GI	On-Demand	Anodyne	MAP1	47	33
C[C@H](Sc1ncnc2sc3c(c12)CCCC3)C(=O)Nc1nccs1	ZINC000450656509	GI	On-Demand	Anodyne	MAP1	47	33
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450656510	EF	On-Demand	Anodyne	RHOA	0	46
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450656511	EF	On-Demand	Anodyne	RHOA	0	46
COC(=O)c1coc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450656520	DE	On-Demand	Anodyne	SIGMAR1	22	41
COC(=O)c1coc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450656520	DE	On-Demand	Anodyne	CCR3	37	40
COC(=O)c1coc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450656520	DE	On-Demand	Anodyne	CHRNA7	39	42
COC(=O)c1coc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450656520	DE	On-Demand	Anodyne	C3AR1	40	38
Cc1onc(C2CC2)c1C(=O)N(C)c1ccc(F)c(Cl)c1	ZINC000450656532	DH	On-Demand	Anodyne	GPBAR1	50	53
CCCOc1cccc(CN2CCC(O)(CN3CCOCC3)CC2)c1	ZINC000450656540	EE	On-Demand	Anodyne	HRH2	36	46
CCCOc1cccc(CN2CCC(O)(CN3CCOCC3)CC2)c1	ZINC000450656540	EE	On-Demand	Anodyne	PDE2A	17	43
CCNS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656541	ED	On-Demand	Anodyne	DRD2	34	45
CCNS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656541	ED	On-Demand	Anodyne	DRD1	0	47
CCNS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656541	ED	On-Demand	Anodyne	DRD4	25	51
CCNS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656541	ED	On-Demand	Anodyne	HTR2A	39	60
CCNS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656541	ED	On-Demand	Anodyne	HTR2C	30	56
CCNS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656541	ED	On-Demand	Anodyne	SLC18A3	0	46
CCNS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656541	ED	On-Demand	Anodyne	HTR3B	0	43
CCNS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656541	ED	On-Demand	Anodyne	CYP2J2	58	42
CCOC(=O)c1ccc(CN2CC[C@](O)(Cc3cccc(Cl)c3)C2)nc1	ZINC000450656542	FG	On-Demand	Anodyne	P2RY12	28	44
CCNS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656543	ED	On-Demand	Anodyne	DRD2	34	45
CCNS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656543	ED	On-Demand	Anodyne	DRD1	0	47
CCNS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656543	ED	On-Demand	Anodyne	DRD4	25	51
CCNS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656543	ED	On-Demand	Anodyne	HTR2A	39	60
CCNS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656543	ED	On-Demand	Anodyne	HTR2C	30	56
CCNS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656543	ED	On-Demand	Anodyne	SLC18A3	0	46
CCNS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656543	ED	On-Demand	Anodyne	HTR3B	0	43
CCNS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450656543	ED	On-Demand	Anodyne	CYP2J2	58	42
CCOC(=O)c1ccc(CN2CC[C@@](O)(Cc3cccc(Cl)c3)C2)nc1	ZINC000450656544	FG	On-Demand	Anodyne	P2RY12	28	44
Cc1cccc([N+](=O)[O-])c1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450656547	GE	On-Demand	Bother	CA2	15	41
Cc1cccc([N+](=O)[O-])c1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450656547	GE	On-Demand	Bother	CA12	15	41
OC[C@]1(F)CN(c2ncc(-c3ccccc3)s2)C[C@H]1c1ccccc1	ZINC000450656606	FI	On-Demand	Anodyne	MLYCD	50	37
OC[C@@]1(F)CN(c2ncc(-c3ccccc3)s2)C[C@H]1c1ccccc1	ZINC000450656607	FI	On-Demand	Anodyne	MLYCD	50	37
OC[C@@]1(F)CN(c2ncc(-c3ccccc3)s2)C[C@@H]1c1ccccc1	ZINC000450656608	FI	On-Demand	Anodyne	MLYCD	50	37
OC[C@]1(F)CN(c2ncc(-c3ccccc3)s2)C[C@@H]1c1ccccc1	ZINC000450656610	FI	On-Demand	Anodyne	MLYCD	50	37
COC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1Cl	ZINC000450656618	FH	On-Demand	Anodyne	ACHE	35	48
COC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1Cl	ZINC000450656618	FH	On-Demand	Anodyne	SIGMAR1	40	44
COC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1Cl	ZINC000450656618	FH	On-Demand	Anodyne	NPY2R	49	36
COC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1Cl	ZINC000450656618	FH	On-Demand	Anodyne	CCR3	56	47
COC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1Cl	ZINC000450656618	FH	On-Demand	Anodyne	CHRNA7	40	40
COC(=O)c1cccc(CN2CCC(Cc3cccnc3)CC2)c1Cl	ZINC000450656618	FH	On-Demand	Anodyne	C3AR1	41	38
CC(C)c1ncsc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450656644	FG	On-Demand	Anodyne	RHOA	0	40
CC(C)c1ncsc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450656644	FG	On-Demand	Anodyne	KCNK3	58	33
CC(C)c1ncsc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450656645	FG	On-Demand	Anodyne	RHOA	0	40
CC(C)c1ncsc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450656645	FG	On-Demand	Anodyne	KCNK3	58	33
CC[C@H](CC(F)(F)F)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450656649	EH	On-Demand	Anodyne	RHODESAIN	0	43
CC[C@@H](CC(F)(F)F)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450656656	EH	On-Demand	Anodyne	RHODESAIN	0	43
CC[C@@H](CC(F)(F)F)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450656657	EH	On-Demand	Anodyne	RHODESAIN	0	43
CC[C@H](CC(F)(F)F)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450656658	EH	On-Demand	Anodyne	RHODESAIN	0	43
C[C@@H]1CCO[C@@H]1C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450656659	CD	On-Demand	Anodyne	RHODESAIN	0	40
c1cncc(CC2CCN(Cc3cnn[nH]3)CC2)c1	ZINC000450656669	CD	On-Demand	Anodyne	SIGMAR1	24	46
c1cncc(CC2CCN(Cc3cnn[nH]3)CC2)c1	ZINC000450656669	CD	On-Demand	Anodyne	ACHP_LYMST	20	41
COCCn1c(NC(=O)c2ccc(C(F)(F)F)[nH]2)nc2ccccc21	ZINC000450656671	FG	On-Demand	Anodyne	SUV39H1	0	41
CCNS(=O)(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656687	ED	On-Demand	Anodyne	DRD4	26	42
CCNS(=O)(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656687	ED	On-Demand	Anodyne	DRD3	0	42
CCNS(=O)(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656687	ED	On-Demand	Anodyne	HTR4	45	36
CCNS(=O)(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656687	ED	On-Demand	Anodyne	CCR1	22	40
CCNS(=O)(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656687	ED	On-Demand	Anodyne	CCR3	25	40
CCNS(=O)(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656687	ED	On-Demand	Anodyne	UTS2R	31	40
CCNS(=O)(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656688	ED	On-Demand	Anodyne	DRD4	26	42
CCNS(=O)(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656688	ED	On-Demand	Anodyne	DRD3	0	42
CCNS(=O)(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656688	ED	On-Demand	Anodyne	HTR4	45	36
CCNS(=O)(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656688	ED	On-Demand	Anodyne	CCR1	22	40
CCNS(=O)(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656688	ED	On-Demand	Anodyne	CCR3	25	40
CCNS(=O)(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450656688	ED	On-Demand	Anodyne	UTS2R	31	40
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ccc(C#N)n1C	ZINC000450656696	ED	On-Demand	Mild	CTRB_BOVIN	48	36
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ccc(C#N)n1C	ZINC000450656697	ED	On-Demand	Mild	CTRB_BOVIN	48	36
COc1nc(C)cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450656714	FD	On-Demand	Anodyne	CA2	18	42
COc1nc(C)cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450656714	FD	On-Demand	Anodyne	CA1	17	43
COc1nc(C)cc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450656714	FD	On-Demand	Anodyne	CA9	22	43
CO[C@@H](Cc1ccccc1)CN1CCC(Cc2cccnc2)CC1	ZINC000450656728	DH	On-Demand	Anodyne	NPY2R	41	33
CO[C@H](Cc1ccccc1)CN1CCC(Cc2cccnc2)CC1	ZINC000450656730	DH	On-Demand	Anodyne	NPY2R	41	33
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	CA2	77	38
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	CA1	57	41
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	CA7	44	42
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	CA5B	41	38
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	CA4	70	40
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	CA5A	47	38
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	CA12	40	42
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	CA9	42	42
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656780	EE	On-Demand	Anodyne	P96878_MYCTU	33	41
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	CA2	77	38
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	CA1	57	41
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	CA7	44	42
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	CA5B	41	38
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	CA4	70	40
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	CA5A	47	38
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	CA12	40	42
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	CA9	42	42
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656781	EE	On-Demand	Anodyne	P96878_MYCTU	33	41
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	CA2	77	38
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	CA1	57	41
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	CA7	44	42
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	CA5B	41	38
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	CA4	70	40
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	CA5A	47	38
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	CA12	40	42
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	CA9	42	42
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656782	EE	On-Demand	Anodyne	P96878_MYCTU	33	41
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	CA2	77	38
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	CA1	57	41
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	CA7	44	42
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	CA5B	41	38
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	CA4	70	40
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	CA5A	47	38
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	CA12	40	42
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	CA9	42	42
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656783	EE	On-Demand	Anodyne	P96878_MYCTU	33	41
C[C@H](CC(F)(F)F)NC(=O)c1cc2ccncc2s1	ZINC000450656806	CG	On-Demand	Anodyne	SELE	64	37
C[C@@H](CC(F)(F)F)NC(=O)c1cc2ccncc2s1	ZINC000450656807	CG	On-Demand	Anodyne	SELE	64	37
C[C@H](CCCCO)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450656819	ED	On-Demand	Anodyne	NPY2R	45	36
C[C@@H](CCCCO)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450656820	ED	On-Demand	Anodyne	NPY2R	45	36
C[C@@H](O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450656830	DH	On-Demand	Anodyne	TACR1	53	37
C[C@@H](O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450656830	DH	On-Demand	Anodyne	CCR5	41	47
C[C@@H](O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450656830	DH	On-Demand	Anodyne	SLC18A3	16	45
C[C@@H](O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450656830	DH	On-Demand	Anodyne	CCR2	40	55
C[C@H](O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450656831	DH	On-Demand	Anodyne	TACR1	53	37
C[C@H](O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450656831	DH	On-Demand	Anodyne	CCR5	41	47
C[C@H](O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450656831	DH	On-Demand	Anodyne	SLC18A3	16	45
C[C@H](O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450656831	DH	On-Demand	Anodyne	CCR2	40	55
FC(F)(F)Cn1ccc(CN2CCC(Cc3cccnc3)CC2)n1	ZINC000450656842	EG	On-Demand	Anodyne	ACHE	22	45
COC(=O)c1ccc2c(c1)CN(CC[C@@H](C)O)CC2	ZINC000450656848	CD	On-Demand	Anodyne	SRD5A1	25	40
COC(=O)c1ccc2c(c1)CN(CC[C@@H](C)O)CC2	ZINC000450656848	CD	On-Demand	Anodyne	SRD5A2	29	40
COC(=O)c1ccc2c(c1)CN(CC[C@@H](C)O)CC2	ZINC000450656848	CD	On-Demand	Anodyne	ABCB1B	43	36
COC(=O)c1ccc2c(c1)CN(CC[C@@H](C)O)CC2	ZINC000450656848	CD	On-Demand	Anodyne	HDAC6	15	40
COC(=O)c1ccc2c(c1)CN(CC[C@@H](C)O)CC2	ZINC000450656848	CD	On-Demand	Anodyne	ABCB1	25	43
COC(=O)c1ccc2c(c1)CN(CC[C@@H](C)O)CC2	ZINC000450656848	CD	On-Demand	Anodyne	NOD2	44	38
COC(=O)c1ccc2c(c1)CN(CC[C@H](C)O)CC2	ZINC000450656849	CD	On-Demand	Anodyne	SRD5A1	25	40
COC(=O)c1ccc2c(c1)CN(CC[C@H](C)O)CC2	ZINC000450656849	CD	On-Demand	Anodyne	SRD5A2	29	40
COC(=O)c1ccc2c(c1)CN(CC[C@H](C)O)CC2	ZINC000450656849	CD	On-Demand	Anodyne	ABCB1B	43	36
COC(=O)c1ccc2c(c1)CN(CC[C@H](C)O)CC2	ZINC000450656849	CD	On-Demand	Anodyne	HDAC6	15	40
COC(=O)c1ccc2c(c1)CN(CC[C@H](C)O)CC2	ZINC000450656849	CD	On-Demand	Anodyne	ABCB1	25	43
COC(=O)c1ccc2c(c1)CN(CC[C@H](C)O)CC2	ZINC000450656849	CD	On-Demand	Anodyne	NOD2	44	38
CCc1cc(CCCN2CCC(Cc3cccnc3)CC2)on1	ZINC000450656852	DH	On-Demand	Anodyne	GRIN2B	27	41
CCc1cc(CCCN2CCC(Cc3cccnc3)CC2)on1	ZINC000450656852	DH	On-Demand	Anodyne	SIGMAR1	19	46
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c(C(C)C)n1	ZINC000450656854	GG	On-Demand	Anodyne	L3MBTL3	59	38
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c(C(C)C)n1	ZINC000450656854	GG	On-Demand	Anodyne	KCNK3	94	39
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c(C(C)C)n1	ZINC000450656854	GG	On-Demand	Anodyne	KCNK9	58	34
COC(=O)C1(O)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450656858	DD	On-Demand	Anodyne	SSTR5	48	39
COC(=O)C1(O)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450656858	DD	On-Demand	Anodyne	ADAM17	22	48
COC(=O)C1(O)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450656858	DD	On-Demand	Anodyne	CXCR3	22	41
COC(=O)C1(O)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450656858	DD	On-Demand	Anodyne	MCHR1	26	44
COC(=O)C1(O)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450656858	DD	On-Demand	Anodyne	MCHR2	42	36
COC(=O)C1(O)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450656858	DD	On-Demand	Anodyne	CCR8	43	41
COC(=O)C1(O)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450656858	DD	On-Demand	Anodyne	NPFFR1	42	36
CN(CCN(C)c1ncc(C(F)F)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656860	FD	On-Demand	Anodyne	CA2	20	40
CN(CCN(C)c1ncc(C(F)F)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656860	FD	On-Demand	Anodyne	CA1	17	40
CN(CCN(C)c1ncc(C(F)F)cn1)c1ccc(S(N)(=O)=O)cc1	ZINC000450656860	FD	On-Demand	Anodyne	CA9	15	40
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450656868	DE	On-Demand	Anodyne	EPHX2	24	41
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450656868	DE	On-Demand	Anodyne	RHOA	0	42
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450656868	DE	On-Demand	Anodyne	L3MBTL1	0	47
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450656868	DE	On-Demand	Anodyne	L3MBTL3	76	43
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450656868	DE	On-Demand	Anodyne	MBTD1	0	46
COC(=O)C1(O)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450656871	ED	On-Demand	Anodyne	SIGMAR1	57	37
COC(=O)C1(O)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450656871	ED	On-Demand	Anodyne	NPFFR1	48	36
COC(=O)C1(O)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450656871	ED	On-Demand	Anodyne	SLC12A5	59	37
CCN(c1ncnc2sc3c(c12)CCC3)C1COC1	ZINC000450656880	CE	On-Demand	Anodyne	CEL	18	40
C[C@H](O)CCN(C)CCC1CCN(c2ccncc2)CC1	ZINC000450656886	CE	On-Demand	Anodyne	SSTR1	25	47
C[C@@H](O)CCN(C)CCC1CCN(c2ccncc2)CC1	ZINC000450656887	CE	On-Demand	Anodyne	SSTR1	25	47
COC(=O)c1ccc2c(c1)CN(Cc1nc(-c3cc(OC)ncn3)no1)CC2	ZINC000450656893	GD	On-Demand	Anodyne	NOD2	40	37
FC1(F)CC[C@H](CN2CCC(Cc3cccnc3)CC2)C1	ZINC000450656898	CH	On-Demand	Anodyne	C3AR1	35	40
FC1(F)CC[C@@H](CN2CCC(Cc3cccnc3)CC2)C1	ZINC000450656899	CH	On-Demand	Anodyne	C3AR1	35	40
COC(=O)C1(O)CCN(CC/C=C\c2ccccc2)CC1	ZINC000450656900	CE	On-Demand	Anodyne	SIGMAR1	19	41
COC(=O)C1(O)CCN(CC/C=C\c2ccccc2)CC1	ZINC000450656900	CE	On-Demand	Anodyne	KCNA3	21	43
COC(=O)C1(O)CCN(CC/C=C/c2ccccc2)CC1	ZINC000450656901	CE	On-Demand	Anodyne	SIGMAR1	19	41
COC(=O)C1(O)CCN(CC/C=C/c2ccccc2)CC1	ZINC000450656901	CE	On-Demand	Anodyne	KCNA3	21	43
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C)[C@@H]2C)c(OC)c1	ZINC000450656904	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C)[C@@H]2C)c(OC)c1	ZINC000450656904	ED	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C)[C@@H]2C)c(OC)c1	ZINC000450656904	ED	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C)[C@@H]2C)c(OC)c1	ZINC000450656904	ED	On-Demand	Anodyne	MTNR1B	40	38
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C)[C@@H]2C)c(OC)c1	ZINC000450656905	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C)[C@@H]2C)c(OC)c1	ZINC000450656905	ED	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C)[C@@H]2C)c(OC)c1	ZINC000450656905	ED	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C)[C@@H]2C)c(OC)c1	ZINC000450656905	ED	On-Demand	Anodyne	MTNR1B	40	38
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C)[C@H]2C)c(OC)c1	ZINC000450656906	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C)[C@H]2C)c(OC)c1	ZINC000450656906	ED	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C)[C@H]2C)c(OC)c1	ZINC000450656906	ED	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C)[C@H]2C)c(OC)c1	ZINC000450656906	ED	On-Demand	Anodyne	MTNR1B	40	38
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C)[C@H]2C)c(OC)c1	ZINC000450656907	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C)[C@H]2C)c(OC)c1	ZINC000450656907	ED	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C)[C@H]2C)c(OC)c1	ZINC000450656907	ED	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C)[C@H]2C)c(OC)c1	ZINC000450656907	ED	On-Demand	Anodyne	MTNR1B	40	38
CCOc1cncc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450656930	FD	On-Demand	Anodyne	CA2	16	43
CCOc1cncc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450656930	FD	On-Demand	Anodyne	CA7	23	43
CCOc1cncc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)n1	ZINC000450656930	FD	On-Demand	Anodyne	CA9	17	43
COc1ccc(CNC(=O)CCN(C)[C@@H](C)C2CCC2)c(OC)c1	ZINC000450656931	EF	On-Demand	Anodyne	MTNR1A	53	38
COc1ccc(CNC(=O)CCN(C)[C@H](C)C2CCC2)c(OC)c1	ZINC000450656932	EF	On-Demand	Anodyne	MTNR1A	53	38
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c(C(C)C)n1	ZINC000450656933	GG	On-Demand	Anodyne	RHOA	0	40
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c(C(C)C)n1	ZINC000450656933	GG	On-Demand	Anodyne	KCNK3	86	37
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c(C(C)C)n1	ZINC000450656933	GG	On-Demand	Anodyne	KCNK9	47	32
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c(C(C)C)n1	ZINC000450656934	GG	On-Demand	Anodyne	RHOA	0	40
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c(C(C)C)n1	ZINC000450656934	GG	On-Demand	Anodyne	KCNK3	86	37
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c(C(C)C)n1	ZINC000450656934	GG	On-Demand	Anodyne	KCNK9	47	32
O=C(CC1CC(F)(F)C1)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450656938	FF	On-Demand	Anodyne	RHOA	0	41
O=C(CC1CC(F)(F)C1)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450656939	FF	On-Demand	Anodyne	RHOA	0	41
C[C@H]1CN(C[C@H](O)Cc2ccccc2)C[C@H]1O	ZINC000450656949	BC	On-Demand	Anodyne	VACHT_TETCF	0	46
C[C@H]1CN(C[C@H](O)Cc2ccccc2)C[C@@H]1O	ZINC000450656950	BC	On-Demand	Anodyne	VACHT_TETCF	0	46
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ccc2cnccc2c1	ZINC000450656954	FG	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ccc2cnccc2c1	ZINC000450656954	FG	On-Demand	Anodyne	AKT1	0	43
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ccc2cnccc2c1	ZINC000450656955	FG	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ccc2cnccc2c1	ZINC000450656955	FG	On-Demand	Anodyne	AKT1	0	43
CC(C)C(=O)NCCN(C)CCc1ccc(Cl)cc1	ZINC000450656957	CF	On-Demand	Anodyne	C5AR1	22	40
CC(C)C(=O)NCCN(C)CCc1ccc(Cl)cc1	ZINC000450656957	CF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
CC(C)C(=O)NCCN(C)CCc1ccc(Cl)cc1	ZINC000450656957	CF	On-Demand	Anodyne	UTS2	40	33
O=C(NCC(=O)N1CCC(F)(F)C1)Nc1cccc(Cl)c1	ZINC000450656958	DE	On-Demand	Anodyne	EPHX2	35	41
C[C@H]1CN(C)[C@H](C)CN1CCN(C)Cc1ccccc1	ZINC000450656961	CE	On-Demand	Anodyne	SIGMAR1	17	51
C[C@H]1CN(CCN(C)Cc2ccccc2)[C@@H](C)CN1C	ZINC000450656962	CE	On-Demand	Anodyne	SIGMAR1	17	51
C[C@@H]1CN(CCN(C)Cc2ccccc2)[C@H](C)CN1C	ZINC000450656963	CE	On-Demand	Anodyne	SIGMAR1	17	51
C[C@H]1CN(CCN(C)Cc2ccccc2)[C@H](C)CN1C	ZINC000450656964	CE	On-Demand	Anodyne	SIGMAR1	17	51
CCOC(=O)c1cc(C(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)[nH]c1C	ZINC000450656973	FF	On-Demand	Anodyne	RHODESAIN	0	40
CCOC(=O)c1cc(C(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)[nH]c1C	ZINC000450656975	FF	On-Demand	Anodyne	RHODESAIN	0	40
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1cc2n(n1)CCCC2	ZINC000450656984	FE	On-Demand	Anodyne	P2RY12	161	37
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1cc2n(n1)CCCC2	ZINC000450656986	FE	On-Demand	Anodyne	P2RY12	161	37
Cc1cccc2c1C[C@@H](C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1)O2	ZINC000450657002	EF	On-Demand	Anodyne	RHODESAIN	0	40
Cc1cccc2c1C[C@H](C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1)O2	ZINC000450657003	EF	On-Demand	Anodyne	RHODESAIN	0	40
Cc1cccc2c1C[C@H](C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1)O2	ZINC000450657004	EF	On-Demand	Anodyne	RHODESAIN	0	40
Cc1cccc2c1C[C@@H](C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1)O2	ZINC000450657005	EF	On-Demand	Anodyne	RHODESAIN	0	40
CCOc1ccc(C2=CCN(CCCC(=O)CC)CC2)cc1	ZINC000450657006	DH	On-Demand	Anodyne	HRH3	20	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657023	GI	On-Demand	Mild	DRD4	40	31
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657023	GI	On-Demand	Mild	NQO2	30	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657023	GI	On-Demand	Mild	MTR1B_CHICK	0	51
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657023	GI	On-Demand	Mild	MTNR1A	20	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657023	GI	On-Demand	Mild	EBP	17	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657027	GI	On-Demand	Mild	DRD4	40	31
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657027	GI	On-Demand	Mild	NQO2	30	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657027	GI	On-Demand	Mild	MTR1B_CHICK	0	51
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657027	GI	On-Demand	Mild	MTNR1A	20	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cccc(C#N)c1Br	ZINC000450657027	GI	On-Demand	Mild	EBP	17	42
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)[C@@H](C)CN1C	ZINC000450657031	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)[C@@H](C)CN1C	ZINC000450657031	FG	On-Demand	Anodyne	CYP2J2	49	35
C[C@H]1CN(C)[C@H](C)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450657032	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@H]1CN(C)[C@H](C)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450657032	FG	On-Demand	Anodyne	CYP2J2	49	35
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)[C@H](C)CN1C	ZINC000450657033	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)[C@H](C)CN1C	ZINC000450657033	FG	On-Demand	Anodyne	CYP2J2	49	35
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)[C@H](C)CN1C	ZINC000450657034	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)[C@H](C)CN1C	ZINC000450657034	FG	On-Demand	Anodyne	CYP2J2	49	35
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657038	FG	On-Demand	Anodyne	RHOA	0	43
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657039	FG	On-Demand	Anodyne	RHOA	0	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450657042	EG	On-Demand	Anodyne	L3MBTL1	0	40
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450657042	EG	On-Demand	Anodyne	L3MBTL3	38	40
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450657042	EG	On-Demand	Anodyne	HPGD	42	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450657044	EG	On-Demand	Anodyne	L3MBTL1	0	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450657044	EG	On-Demand	Anodyne	L3MBTL3	38	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450657044	EG	On-Demand	Anodyne	HPGD	42	40
CCn1nnc(C)c1C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450657053	FG	On-Demand	Anodyne	MME	45	36
CCn1nnc(C)c1C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450657053	FG	On-Demand	Anodyne	ANPEP	43	33
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450657082	GI	On-Demand	Anodyne	HPGD	40	37
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450657084	GI	On-Demand	Anodyne	HPGD	40	37
C[C@H](O)CCN(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450657101	CF	On-Demand	Anodyne	GRIN1	22	40
C[C@@H](O)CCN(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000450657106	CF	On-Demand	Anodyne	GRIN1	22	40
CCC1(CC)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCS1	ZINC000450657119	FG	On-Demand	Anodyne	CPT2	42	35
CCC1(CC)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCS1	ZINC000450657119	FG	On-Demand	Anodyne	PREP	109	49
CCC1(CC)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCS1	ZINC000450657119	FG	On-Demand	Anodyne	SFRP1	50	42
CCC1(CC)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCS1	ZINC000450657119	FG	On-Demand	Anodyne	WNT3	50	42
CCCNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nc1	ZINC000450657121	FF	On-Demand	Anodyne	HDAC1	22	40
CCCNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nc1	ZINC000450657123	FF	On-Demand	Anodyne	HDAC1	22	40
CCCNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nc1	ZINC000450657124	FF	On-Demand	Anodyne	HDAC1	22	40
CCCNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nc1	ZINC000450657125	FF	On-Demand	Anodyne	HDAC1	22	40
O=C(CS(=O)(=O)C1CC1)NCCOCc1ccc(Cl)cc1Cl	ZINC000450657126	FE	On-Demand	Anodyne	P2RX7	28	40
O=C(CS(=O)(=O)C1CC1)NCCOCc1ccc(Cl)cc1Cl	ZINC000450657126	FE	On-Demand	Anodyne	EPHX2	15	42
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	HTR4	49	34
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	GRIN2B	57	39
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	SIGMAR1	26	40
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	CCR3	44	44
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	CHRNA7	41	39
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	C3AR1	44	40
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	GRIN3A	0	44
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	CYP2J2	52	38
CCC(=O)CCCN1CCC(Cc2cccnc2)CC1	ZINC000450657144	CG	On-Demand	Anodyne	ACHP_LYMST	22	42
CN(CCN(C)c1nccc(C(F)F)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450657155	FD	On-Demand	Anodyne	CA2	15	41
CN(CCN(C)c1nccc(C(F)F)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450657155	FD	On-Demand	Anodyne	DKK1	0	43
Cc1cc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)cc1F	ZINC000450657158	GG	On-Demand	Anodyne	EPHX2	24	42
Cc1cc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)cc1F	ZINC000450657158	GG	On-Demand	Anodyne	ST14	45	36
O=C(CC1CC(F)(F)C1)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450657161	FF	On-Demand	Anodyne	RHOA	0	42
O=C(CC1CC(F)(F)C1)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450657162	FF	On-Demand	Anodyne	RHOA	0	42
CN(CCN(C)c1noc(C(C)(C)C)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450657163	FD	On-Demand	Anodyne	CA2	19	43
CN(CCN(C)c1noc(C(C)(C)C)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450657163	FD	On-Demand	Anodyne	CA1	16	43
CN(CCN(C)c1noc(C(C)(C)C)n1)c1ccc(S(N)(=O)=O)cc1	ZINC000450657163	FD	On-Demand	Anodyne	CA9	18	43
CC(=O)c1cccc(CN(C)CCC2CCN(c3ccncc3)CC2)c1	ZINC000450657164	FI	On-Demand	Anodyne	ACHE	19	48
CC(=O)c1cccc(CN(C)CCC2CCN(c3ccncc3)CC2)c1	ZINC000450657164	FI	On-Demand	Anodyne	F10	17	41
CC(=O)c1cccc(CN(C)CCC2CCN(c3ccncc3)CC2)c1	ZINC000450657164	FI	On-Demand	Anodyne	SSTR1	32	46
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657185	FF	On-Demand	Anodyne	NPY2R	40	46
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657185	FF	On-Demand	Anodyne	L3MBTL1	0	42
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657185	FF	On-Demand	Anodyne	L3MBTL3	51	42
CC(F)(F)C(C)(C)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657185	FF	On-Demand	Anodyne	KCNK3	44	32
CC(=O)CCCCCSc1nnc(-c2ccncc2)o1	ZINC000450657190	CG	On-Demand	Anodyne	GSK3A	26	47
C[C@H]1[C@H](C)N(C[C@H](O)Cc2ccccc2)CCN1C	ZINC000450657192	CD	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@H]1[C@@H](C)N(C[C@H](O)Cc2ccccc2)CCN1C	ZINC000450657193	CD	On-Demand	Anodyne	VACHT_TETCF	0	41
CC(=O)c1cccc(CN2CCN(C3CCN(C)CC3)[C@@H](C)C2)c1	ZINC000450657196	EE	On-Demand	Anodyne	CXCR3	20	42
CC(=O)c1cccc(CN2CCN(C3CCN(C)CC3)[C@H](C)C2)c1	ZINC000450657197	EE	On-Demand	Anodyne	CXCR3	20	42
CNC(=O)c1cccnc1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450657199	GC	On-Demand	Anodyne	CA2	48	43
CNC(=O)c1cccnc1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450657199	GC	On-Demand	Anodyne	CA4	45	35
CNC(=O)c1cccnc1N(C)CCN(C)c1ccc(S(N)(=O)=O)cc1	ZINC000450657199	GC	On-Demand	Anodyne	CA12	28	40
Clc1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)o2)cc1	ZINC000450657212	DI	On-Demand	Anodyne	TERT	0	42
Clc1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)o2)cc1	ZINC000450657213	DI	On-Demand	Anodyne	TERT	0	42
CC(C)OC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450657215	EE	On-Demand	Anodyne	RHOA	0	41
CC(C)OC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450657216	EE	On-Demand	Anodyne	RHOA	0	41
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657221	FG	On-Demand	Anodyne	CCKBR	26	41
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657221	FG	On-Demand	Anodyne	EPHX2	16	43
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657221	FG	On-Demand	Anodyne	L3MBTL3	41	39
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657221	FG	On-Demand	Anodyne	PARP10	0	45
CC1(C)CN(C(=O)C2CC2)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450657228	GH	On-Demand	Anodyne	RBP4	85	41
CCOC(=O)c1cc(C(=O)Nc2nc3ccccc3n2CCOC)on1	ZINC000450657229	FE	On-Demand	Anodyne	ITK	38	45
C[C@H](c1nccs1)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450657242	FH	On-Demand	Anodyne	MC4R	21	41
C[C@H](c1nccs1)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450657242	FH	On-Demand	Anodyne	NPBWR1	47	34
C[C@H](c1nccs1)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450657243	FH	On-Demand	Anodyne	MC4R	21	41
C[C@H](c1nccs1)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450657243	FH	On-Demand	Anodyne	NPBWR1	47	34
C[C@H](c1nccs1)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450657244	FH	On-Demand	Anodyne	MC4R	21	41
C[C@H](c1nccs1)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450657244	FH	On-Demand	Anodyne	NPBWR1	47	34
C[C@H](c1nccs1)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450657245	FH	On-Demand	Anodyne	MC4R	21	41
C[C@H](c1nccs1)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450657245	FH	On-Demand	Anodyne	NPBWR1	47	34
CN(CCNC(C)(C)C(=O)NCC1CCCC1)Cc1ccccc1	ZINC000450657253	EF	On-Demand	Anodyne	ACHE	0	48
COc1cc2c(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)ncnc2cc1F	ZINC000450657254	FG	On-Demand	Anodyne	PDE3A	55	44
COc1cc2c(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)ncnc2cc1F	ZINC000450657254	FG	On-Demand	Anodyne	PDGFRB	75	42
COc1cc2c(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)ncnc2cc1F	ZINC000450657254	FG	On-Demand	Anodyne	PDE3B	82	44
COc1cc2c(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)ncnc2cc1F	ZINC000450657255	FG	On-Demand	Anodyne	PDE3A	55	44
COc1cc2c(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)ncnc2cc1F	ZINC000450657255	FG	On-Demand	Anodyne	PDGFRB	75	42
COc1cc2c(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)ncnc2cc1F	ZINC000450657255	FG	On-Demand	Anodyne	PDE3B	82	44
COc1cc2c(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)ncnc2cc1F	ZINC000450657257	FG	On-Demand	Anodyne	PDE3A	55	44
COc1cc2c(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)ncnc2cc1F	ZINC000450657257	FG	On-Demand	Anodyne	PDGFRB	75	42
COc1cc2c(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)ncnc2cc1F	ZINC000450657257	FG	On-Demand	Anodyne	PDE3B	82	44
COc1cc2c(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)ncnc2cc1F	ZINC000450657260	FG	On-Demand	Anodyne	PDE3A	55	44
COc1cc2c(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)ncnc2cc1F	ZINC000450657260	FG	On-Demand	Anodyne	PDGFRB	75	42
COc1cc2c(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)ncnc2cc1F	ZINC000450657260	FG	On-Demand	Anodyne	PDE3B	82	44
O[C@H](Cc1ccccc1)CN1CC[C@](O)(Cc2cccc(Cl)c2)C1	ZINC000450657293	EF	On-Demand	Anodyne	VACHT_TETCF	0	41
O[C@H](Cc1ccccc1)CN1CC[C@@](O)(Cc2cccc(Cl)c2)C1	ZINC000450657296	EF	On-Demand	Anodyne	VACHT_TETCF	0	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450657312	FG	On-Demand	Anodyne	NPBWR1	53	31
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450657314	FG	On-Demand	Anodyne	NPBWR1	53	31
CC(C)CC(CC(C)C)C(=O)N[C@H](C(N)=O)c1ccc(F)cc1	ZINC000450657317	DG	On-Demand	Anodyne	ANPEP	30	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](C(N)=O)c1ccc(F)cc1	ZINC000450657318	DG	On-Demand	Anodyne	ANPEP	30	42
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657346	FG	On-Demand	Anodyne	RHOA	0	40
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657347	FG	On-Demand	Anodyne	RHOA	0	40
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657348	FG	On-Demand	Anodyne	RHOA	0	40
C[C@@H]1CCC[C@]1(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657349	FG	On-Demand	Anodyne	RHOA	0	40
CCS(=O)(=O)c1ccc(CN2CCC(CCC(N)=O)CC2)cc1	ZINC000450657350	ED	On-Demand	Anodyne	ACHE	39	48
CCS(=O)(=O)c1ccc(CN2CCC(CCC(N)=O)CC2)cc1	ZINC000450657350	ED	On-Demand	Anodyne	SIGMAR1	36	41
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CC2(O)CCC2)C1	ZINC000450657351	CD	On-Demand	Anodyne	RHODESAIN	0	40
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CC2(O)CCC2)C1	ZINC000450657352	CD	On-Demand	Anodyne	RHODESAIN	0	40
CN(C)CCCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450657357	DH	On-Demand	Anodyne	THRA	43	35
CN(C)CCCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450657357	DH	On-Demand	Anodyne	DRD4	0	50
CN(C)CCCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450657357	DH	On-Demand	Anodyne	HTR4	44	33
CN(C)CCCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450657357	DH	On-Demand	Anodyne	SLC18A3	0	40
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450657367	FI	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	32
CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450657370	FI	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	32
CC(C)OC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657372	FF	On-Demand	Anodyne	NPY2R	29	40
CC(C)OC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657372	FF	On-Demand	Anodyne	RHOA	0	40
CC(C)OC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657374	FF	On-Demand	Anodyne	NPY2R	29	40
CC(C)OC(C)(C)C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657374	FF	On-Demand	Anodyne	RHOA	0	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C#N)[nH]c1C	ZINC000450657376	DG	On-Demand	Mild	NQO2	37	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C#N)[nH]c1C	ZINC000450657376	DG	On-Demand	Mild	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C#N)[nH]c1C	ZINC000450657376	DG	On-Demand	Mild	HTR6	27	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C#N)[nH]c1C	ZINC000450657376	DG	On-Demand	Mild	EBP	17	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C#N)[nH]c1C	ZINC000450657379	DG	On-Demand	Mild	NQO2	37	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C#N)[nH]c1C	ZINC000450657379	DG	On-Demand	Mild	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C#N)[nH]c1C	ZINC000450657379	DG	On-Demand	Mild	HTR6	27	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C#N)[nH]c1C	ZINC000450657379	DG	On-Demand	Mild	EBP	17	42
CCc1cc(CCCN2CCC(OCc3ccccc3OC)CC2)on1	ZINC000450657380	FH	On-Demand	Anodyne	DRD2	18	43
CCc1cc(CCCN2CCC(OCc3ccccc3OC)CC2)on1	ZINC000450657380	FH	On-Demand	Anodyne	DRD3	22	42
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)c(C(C)C)n1	ZINC000450657384	GH	On-Demand	Anodyne	KCNK3	40	35
Cc1ccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)c(C(C)C)n1	ZINC000450657385	GH	On-Demand	Anodyne	KCNK3	40	35
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657386	EH	On-Demand	Anodyne	NQO2	33	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657386	EH	On-Demand	Anodyne	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657386	EH	On-Demand	Anodyne	MTNR1A	25	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657386	EH	On-Demand	Anodyne	MTNR1B	26	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657386	EH	On-Demand	Anodyne	EBP	16	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657387	EH	On-Demand	Anodyne	NQO2	33	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657387	EH	On-Demand	Anodyne	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657387	EH	On-Demand	Anodyne	MTNR1A	25	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657387	EH	On-Demand	Anodyne	MTNR1B	26	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450657387	EH	On-Demand	Anodyne	EBP	16	45
COc1ccc(CNC(=O)CCN2CCc3cc(F)ccc3C2)c(OC)c1	ZINC000450657392	FF	On-Demand	Anodyne	HTR7	39	44
COc1ccc(CNC(=O)CCN2CCc3cc(F)ccc3C2)c(OC)c1	ZINC000450657392	FF	On-Demand	Anodyne	P2RX7	47	40
COc1ccc(CNC(=O)CCN2CCc3cc(F)ccc3C2)c(OC)c1	ZINC000450657392	FF	On-Demand	Anodyne	ABCB1B	49	35
COc1ccc(CNC(=O)CCN2CCc3cc(F)ccc3C2)c(OC)c1	ZINC000450657392	FF	On-Demand	Anodyne	MTNR1A	42	38
COc1ccc(CNC(=O)CCN2CCc3cc(F)ccc3C2)c(OC)c1	ZINC000450657392	FF	On-Demand	Anodyne	ABCB1	24	43
O=C(c1cc2n(n1)CCCC2)N1CCc2c(-c3ccccc3)cccc21	ZINC000450657411	EI	On-Demand	Anodyne	AVPR2	48	42
CCC(=O)CCCN1CCC(CCC(N)=O)CC1	ZINC000450657412	CD	On-Demand	Anodyne	CYP2J2	50	36
C[C@H]1CN(C)[C@H](C)CN1CCCC(=O)c1ccccc1	ZINC000450657413	CF	On-Demand	Anodyne	CYP2J2	57	41
C[C@H]1CN(CCCC(=O)c2ccccc2)[C@@H](C)CN1C	ZINC000450657414	CF	On-Demand	Anodyne	CYP2J2	57	41
C[C@@H]1CN(CCCC(=O)c2ccccc2)[C@H](C)CN1C	ZINC000450657415	CF	On-Demand	Anodyne	CYP2J2	57	41
C[C@H]1CN(CCCC(=O)c2ccccc2)[C@H](C)CN1C	ZINC000450657416	CF	On-Demand	Anodyne	CYP2J2	57	41
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657417	GH	On-Demand	Anodyne	CCKBR	0	40
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657417	GH	On-Demand	Anodyne	TYK2	58	37
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657417	GH	On-Demand	Anodyne	RHOA	0	43
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657417	GH	On-Demand	Anodyne	L3MBTL3	44	37
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657417	GH	On-Demand	Anodyne	KCNK3	57	36
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657418	GH	On-Demand	Anodyne	CCKBR	0	40
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657418	GH	On-Demand	Anodyne	TYK2	58	37
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657418	GH	On-Demand	Anodyne	RHOA	0	43
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657418	GH	On-Demand	Anodyne	L3MBTL3	44	37
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657418	GH	On-Demand	Anodyne	KCNK3	57	36
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)CC1	ZINC000450657431	GF	On-Demand	Anodyne	HRH3	23	43
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)CC1	ZINC000450657431	GF	On-Demand	Anodyne	CCKAR	0	41
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)CC1	ZINC000450657431	GF	On-Demand	Anodyne	NPY2R	15	41
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)CC1	ZINC000450657431	GF	On-Demand	Anodyne	EPHX2	17	45
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)CC1	ZINC000450657431	GF	On-Demand	Anodyne	RHOA	0	47
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)CC1	ZINC000450657432	GF	On-Demand	Anodyne	HRH3	23	43
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)CC1	ZINC000450657432	GF	On-Demand	Anodyne	CCKAR	0	41
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)CC1	ZINC000450657432	GF	On-Demand	Anodyne	NPY2R	15	41
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)CC1	ZINC000450657432	GF	On-Demand	Anodyne	EPHX2	17	45
CC(C)N1CCC(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)CC1	ZINC000450657432	GF	On-Demand	Anodyne	RHOA	0	47
C[C@@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657439	BE	On-Demand	Anodyne	HTR1D	25	41
C[C@@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657439	BE	On-Demand	Anodyne	HTR1B	28	41
C[C@@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657439	BE	On-Demand	Anodyne	GRIN2B	49	40
C[C@@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657439	BE	On-Demand	Anodyne	SIGMAR1	22	43
C[C@@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657439	BE	On-Demand	Anodyne	CHRNA7	40	38
C[C@@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657439	BE	On-Demand	Anodyne	C3AR1	43	39
C[C@@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657439	BE	On-Demand	Anodyne	GRIN2C	20	40
C[C@@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657439	BE	On-Demand	Anodyne	ACHP_LYMST	23	46
C[C@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657440	BE	On-Demand	Anodyne	HTR1D	25	41
C[C@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657440	BE	On-Demand	Anodyne	HTR1B	28	41
C[C@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657440	BE	On-Demand	Anodyne	GRIN2B	49	40
C[C@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657440	BE	On-Demand	Anodyne	SIGMAR1	22	43
C[C@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657440	BE	On-Demand	Anodyne	CHRNA7	40	38
C[C@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657440	BE	On-Demand	Anodyne	C3AR1	43	39
C[C@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657440	BE	On-Demand	Anodyne	GRIN2C	20	40
C[C@H](O)CCN1CCC(Cc2cccnc2)CC1	ZINC000450657440	BE	On-Demand	Anodyne	ACHP_LYMST	23	46
Cc1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1C	ZINC000450657450	ED	On-Demand	Anodyne	CA2	22	43
Cc1cnc(N(C)CCN(C)c2ccc(S(N)(=O)=O)cc2)nc1C	ZINC000450657450	ED	On-Demand	Anodyne	DKK1	0	42
CCS(=O)(=O)c1ccc(CNC(C)(C)C(C)(C)O)cc1	ZINC000450657452	CE	On-Demand	Anodyne	CA2	16	41
CCS(=O)(=O)c1ccc(CNC(C)(C)C(C)(C)O)cc1	ZINC000450657452	CE	On-Demand	Anodyne	RORC	52	34
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1	ZINC000450657453	FF	On-Demand	Anodyne	CCKAR	24	40
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1	ZINC000450657453	FF	On-Demand	Anodyne	CCKBR	22	40
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1	ZINC000450657453	FF	On-Demand	Anodyne	RHOA	0	41
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1	ZINC000450657453	FF	On-Demand	Anodyne	KCNK3	48	34
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1	ZINC000450657454	FF	On-Demand	Anodyne	CCKAR	24	40
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1	ZINC000450657454	FF	On-Demand	Anodyne	CCKBR	22	40
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1	ZINC000450657454	FF	On-Demand	Anodyne	RHOA	0	41
Cc1ccc(F)c(CC(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1	ZINC000450657454	FF	On-Demand	Anodyne	KCNK3	48	34
CCn1c(SCc2ccc(S(=O)(=O)CC)cc2)nc2ccccc2c1=O	ZINC000450657458	GH	On-Demand	Anodyne	PTGDR2	17	44
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450657464	GF	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450657464	GF	On-Demand	Anodyne	RHOA	0	44
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450657464	GF	On-Demand	Anodyne	KCNK3	60	38
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450657465	GF	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450657465	GF	On-Demand	Anodyne	RHOA	0	44
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450657465	GF	On-Demand	Anodyne	KCNK3	60	38
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657480	FG	On-Demand	Anodyne	NPY2R	44	38
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657480	FG	On-Demand	Anodyne	EPHX2	22	45
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657481	FG	On-Demand	Anodyne	NPY2R	44	38
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000450657481	FG	On-Demand	Anodyne	EPHX2	22	45
CCN(CCC1CCN(C[C@H](O)Cc2ccccc2)CC1)CC1CC1	ZINC000450657494	EG	On-Demand	Anodyne	ACHE	22	42
CCN(CCC1CCN(C[C@H](O)Cc2ccccc2)CC1)CC1CC1	ZINC000450657494	EG	On-Demand	Anodyne	VACHT_TETCF	0	46
CCNS(=O)(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450657495	GC	On-Demand	Anodyne	MTNR1A	48	37
CCNS(=O)(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450657496	GC	On-Demand	Anodyne	MTNR1A	48	37
COC(=O)c1ccc(CN2CCC(O)(CN3CCOCC3)CC2)cc1Cl	ZINC000450657513	GD	On-Demand	Anodyne	DPOL_HHV11	0	40
COC(=O)c1ccc(CN2CCC(O)(CN3CCOCC3)CC2)cc1Cl	ZINC000450657513	GD	On-Demand	Anodyne	ADAM17	17	42
COC(=O)c1ccc(CN2CCC(O)(CN3CCOCC3)CC2)cc1Cl	ZINC000450657513	GD	On-Demand	Anodyne	MCHR2	44	33
COC(=O)c1ccc(CN2CCC(O)(CN3CCOCC3)CC2)cc1Cl	ZINC000450657513	GD	On-Demand	Anodyne	DPOL_VZVD	22	40
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)c1ccnc(OC(F)F)c1	ZINC000450657518	GF	On-Demand	Anodyne	TAAR1	32	42
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)c1ccnc(OC(F)F)c1	ZINC000450657518	GF	On-Demand	Anodyne	RHOA	0	42
O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)c1ccnc(OC(F)F)c1	ZINC000450657518	GF	On-Demand	Anodyne	KCNK3	82	44
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)c1ccnc(OC(F)F)c1	ZINC000450657520	GF	On-Demand	Anodyne	TAAR1	32	42
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)c1ccnc(OC(F)F)c1	ZINC000450657520	GF	On-Demand	Anodyne	RHOA	0	42
O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)c1ccnc(OC(F)F)c1	ZINC000450657520	GF	On-Demand	Anodyne	KCNK3	82	44
O[C@]1(Cc2cccc(Cl)c2)CCN(CCc2cscn2)C1	ZINC000450657539	DG	On-Demand	Anodyne	SCN5A	17	40
O[C@@]1(Cc2cccc(Cl)c2)CCN(CCc2cscn2)C1	ZINC000450657540	DG	On-Demand	Anodyne	SCN5A	17	40
COC(=O)[C@H](CC(C)C)N(C)c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450657553	FF	On-Demand	Anodyne	LRRK2	32	44
COC(=O)[C@@H](CC(C)C)N(C)c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450657555	FF	On-Demand	Anodyne	LRRK2	32	44
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	DRD2	35	50
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	DRD1	16	48
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	DRD4	15	43
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	HTR2A	15	46
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	SLC6A1	26	41
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	ADRA2B	0	48
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	ADRA2C	15	45
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	ERG2	21	45
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	SIGMAR1	23	45
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	SLC18A3	0	54
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	EBP	32	45
C[C@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657617	BG	On-Demand	Anodyne	CYP2J2	62	46
CSCC1CCC(Nc2cc(-n3cccn3)nc(N)n2)CC1	ZINC000450657618	DE	On-Demand	Anodyne	HRH4	21	44
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	DRD2	35	50
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	DRD1	16	48
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	DRD4	15	43
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	HTR2A	15	46
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	SLC6A1	26	41
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	ADRA2B	0	48
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	ADRA2C	15	45
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	ERG2	21	45
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	SIGMAR1	23	45
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	SLC18A3	0	54
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	EBP	32	45
C[C@@]1(F)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450657619	BG	On-Demand	Anodyne	CYP2J2	62	46
CCc1cccc(C(=O)Nc2nc3ccccc3n2CCOC)n1	ZINC000450657622	DF	On-Demand	Anodyne	ITK	37	40
COc1cc(CNC(C)(C)C(=O)NCC2CCCC2)ccc1Cl	ZINC000450657627	EH	On-Demand	Anodyne	HTR4	22	41
COc1cc(CNC(C)(C)C(=O)NCC2CCCC2)ccc1Cl	ZINC000450657627	EH	On-Demand	Anodyne	TRPV1	22	40
COc1cc(CNC(C)(C)C(=O)NCC2CCCC2)ccc1Cl	ZINC000450657627	EH	On-Demand	Anodyne	SSTR3	17	42
COc1cc(CNC(C)(C)C(=O)NCC2CCCC2)ccc1Cl	ZINC000450657627	EH	On-Demand	Anodyne	CACNA1I	50	36
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657636	GI	On-Demand	Anodyne	COLA	43	36
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657636	GI	On-Demand	Anodyne	CPT1A	45	36
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657636	GI	On-Demand	Anodyne	ROCK2	40	38
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657636	GI	On-Demand	Anodyne	TAAR1	27	41
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657636	GI	On-Demand	Anodyne	KCNK3	61	42
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657636	GI	On-Demand	Anodyne	KCNK9	37	42
CCC[C@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657636	GI	On-Demand	Anodyne	PARP10	0	41
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657648	GI	On-Demand	Anodyne	COLA	43	36
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657648	GI	On-Demand	Anodyne	CPT1A	45	36
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657648	GI	On-Demand	Anodyne	ROCK2	40	38
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657648	GI	On-Demand	Anodyne	TAAR1	27	41
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657648	GI	On-Demand	Anodyne	KCNK3	61	42
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657648	GI	On-Demand	Anodyne	KCNK9	37	42
CCC[C@@H](OC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1	ZINC000450657648	GI	On-Demand	Anodyne	PARP10	0	41
CCc1cc(CCCN2CCc3cc(F)ccc3C2)on1	ZINC000450657654	CG	On-Demand	Anodyne	CHRNA6	0	40
COc1ccc(CNC(=O)CCN2C[C@@H](C)N(C)C[C@@H]2C)c(OC)c1	ZINC000450657662	ED	On-Demand	Anodyne	PDGFRB	27	40
COc1ccc(CNC(=O)CCN2C[C@@H](C)N(C)C[C@@H]2C)c(OC)c1	ZINC000450657662	ED	On-Demand	Anodyne	MTNR1A	52	35
COc1ccc(CNC(=O)CCN2C[C@@H](C)N(C)C[C@@H]2C)c(OC)c1	ZINC000450657662	ED	On-Demand	Anodyne	SLC29A2	0	40
COc1ccc(CNC(=O)CCN2C[C@H](C)N(C)C[C@@H]2C)c(OC)c1	ZINC000450657664	ED	On-Demand	Anodyne	PDGFRB	27	40
COc1ccc(CNC(=O)CCN2C[C@H](C)N(C)C[C@@H]2C)c(OC)c1	ZINC000450657664	ED	On-Demand	Anodyne	MTNR1A	52	35
COc1ccc(CNC(=O)CCN2C[C@H](C)N(C)C[C@@H]2C)c(OC)c1	ZINC000450657664	ED	On-Demand	Anodyne	SLC29A2	0	40
COc1ccc(CNC(=O)CCN2C[C@@H](C)N(C)C[C@H]2C)c(OC)c1	ZINC000450657666	ED	On-Demand	Anodyne	PDGFRB	27	40
COc1ccc(CNC(=O)CCN2C[C@@H](C)N(C)C[C@H]2C)c(OC)c1	ZINC000450657666	ED	On-Demand	Anodyne	MTNR1A	52	35
COc1ccc(CNC(=O)CCN2C[C@@H](C)N(C)C[C@H]2C)c(OC)c1	ZINC000450657666	ED	On-Demand	Anodyne	SLC29A2	0	40
COc1ccc(CNC(=O)CCN2C[C@H](C)N(C)C[C@H]2C)c(OC)c1	ZINC000450657667	ED	On-Demand	Anodyne	PDGFRB	27	40
COc1ccc(CNC(=O)CCN2C[C@H](C)N(C)C[C@H]2C)c(OC)c1	ZINC000450657667	ED	On-Demand	Anodyne	MTNR1A	52	35
COc1ccc(CNC(=O)CCN2C[C@H](C)N(C)C[C@H]2C)c(OC)c1	ZINC000450657667	ED	On-Demand	Anodyne	SLC29A2	0	40
CN(C(=O)c1ccc(N2CCC2)nc1)c1ccc(F)c(Cl)c1	ZINC000450657702	DG	On-Demand	Anodyne	MLNR	38	42
CS(=O)(=O)c1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c(F)c1	ZINC000450657708	FF	On-Demand	Anodyne	SLC6A9	0	48
CS(=O)(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c(F)c1	ZINC000450657709	FF	On-Demand	Anodyne	SLC6A9	0	48
CS(=O)(=O)c1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c(F)c1	ZINC000450657710	FF	On-Demand	Anodyne	SLC6A9	0	48
CS(=O)(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c(F)c1	ZINC000450657711	FF	On-Demand	Anodyne	SLC6A9	0	48
CC(F)(F)C(C)(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450657712	DI	On-Demand	Anodyne	CYP11B2	41	36
CC(F)(F)C(C)(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450657712	DI	On-Demand	Anodyne	CTRC	25	41
CC(F)(F)C(C)(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450657712	DI	On-Demand	Anodyne	NR1H2	43	38
CC(F)(F)C(C)(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450657712	DI	On-Demand	Anodyne	NAMPT	47	36
CC(F)(F)C(C)(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450657712	DI	On-Demand	Anodyne	HAO2	32	43
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc(S(N)(=O)=O)c1	ZINC000450657725	EE	On-Demand	Anodyne	CA9	18	40
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc(S(N)(=O)=O)c1	ZINC000450657726	EE	On-Demand	Anodyne	CA9	18	40
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc(S(N)(=O)=O)c1	ZINC000450657727	EE	On-Demand	Anodyne	CA9	18	40
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc(S(N)(=O)=O)c1	ZINC000450657728	EE	On-Demand	Anodyne	CA9	18	40
C[C@@H](NCc1ccccc1OC1CC1)c1ccc2c(c1)OCO2	ZINC000450657744	DH	On-Demand	Anodyne	KCNQ2	20	40
C[C@H](NCc1ccccc1OC1CC1)c1ccc2c(c1)OCO2	ZINC000450657745	DH	On-Demand	Anodyne	KCNQ2	20	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450657781	FF	On-Demand	Anodyne	CAPN2	40	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450657782	FF	On-Demand	Anodyne	CAPN2	40	34
CC[C@@H]1CCC[C@@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450657791	DF	On-Demand	Bother	VCP	30	43
CC[C@@H]1CCC[C@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450657792	DF	On-Demand	Bother	VCP	30	43
CC[C@H]1CCC[C@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450657793	DF	On-Demand	Bother	VCP	30	43
CC[C@H]1CCC[C@@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450657794	DF	On-Demand	Bother	VCP	30	43
O=C(C[C@@H]1COc2ccccc2O1)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450657812	FG	On-Demand	Anodyne	FFAR1	20	45
O=C(C[C@H]1COc2ccccc2O1)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450657813	FG	On-Demand	Anodyne	FFAR1	20	45
COc1cc2c(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)ccnc2cc1F	ZINC000450657817	FH	On-Demand	Anodyne	PDE3B	43	33
COc1cc2c(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)ccnc2cc1F	ZINC000450657819	FH	On-Demand	Anodyne	PDE3B	43	33
COc1cc2c(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)ccnc2cc1F	ZINC000450657821	FH	On-Demand	Anodyne	PDE3B	43	33
COc1cc2c(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)ccnc2cc1F	ZINC000450657822	FH	On-Demand	Anodyne	PDE3B	43	33
CC1(C)CN(C(=O)C2CC2)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450657823	GE	On-Demand	Anodyne	EPHX2	31	50
COc1cc(CN(C)CCNC(=O)N(C)C)ccc1Cl	ZINC000450657826	CE	On-Demand	Anodyne	NCE103	22	42
CSc1cccc(C(=O)N2CCN(C(=O)C3CC3)CC2(C)C)c1	ZINC000450657835	EF	On-Demand	Anodyne	RHOA	0	41
CC[C@H]1CCC[C@@H]1C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450657848	DI	On-Demand	Anodyne	NAMPT	40	35
CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450657852	FE	On-Demand	Anodyne	GRIA1	45	31
CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450657853	FE	On-Demand	Anodyne	GRIA1	45	31
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450657854	FG	On-Demand	Anodyne	TYK2	60	38
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450657854	FG	On-Demand	Anodyne	RHOA	0	45
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450657854	FG	On-Demand	Anodyne	L3MBTL3	56	39
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1	ZINC000450657854	FG	On-Demand	Anodyne	KCNK3	76	39
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450657855	FG	On-Demand	Anodyne	TYK2	60	38
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450657855	FG	On-Demand	Anodyne	RHOA	0	45
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450657855	FG	On-Demand	Anodyne	L3MBTL3	56	39
Cc1cccc(Cl)c1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450657855	FG	On-Demand	Anodyne	KCNK3	76	39
CSc1cccc(C(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450657870	EH	On-Demand	Anodyne	PREP	29	41
CSc1cccc(C(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450657870	EH	On-Demand	Anodyne	RHOA	0	51
CSc1cccc(C(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450657870	EH	On-Demand	Anodyne	HPGD	41	37
CSc1cccc(C(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450657871	EH	On-Demand	Anodyne	PREP	29	41
CSc1cccc(C(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450657871	EH	On-Demand	Anodyne	RHOA	0	51
CSc1cccc(C(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450657871	EH	On-Demand	Anodyne	HPGD	41	37
CC(C)O[C@H]1C[C@@H](NC(=O)c2cn(CCc3ccccc3)nn2)C1(C)C	ZINC000450657872	FF	On-Demand	Anodyne	THYX_PBCV1	0	41
CC(C)O[C@@H]1C[C@@H](NC(=O)c2cn(CCc3ccccc3)nn2)C1(C)C	ZINC000450657876	FF	On-Demand	Anodyne	THYX_PBCV1	0	41
CC(C)O[C@H]1C[C@H](NC(=O)c2cn(CCc3ccccc3)nn2)C1(C)C	ZINC000450657877	FF	On-Demand	Anodyne	THYX_PBCV1	0	41
CC(C)O[C@@H]1C[C@H](NC(=O)c2cn(CCc3ccccc3)nn2)C1(C)C	ZINC000450657878	FF	On-Demand	Anodyne	THYX_PBCV1	0	41
CCC[C@H](O)CN1CCN([C@H](C#N)c2ccc(Br)cc2)CC1	ZINC000450657885	FF	On-Demand	Mild	IGF1R	0	44
CCC[C@@H](O)CN1CCN([C@H](C#N)c2ccc(Br)cc2)CC1	ZINC000450657886	FF	On-Demand	Mild	IGF1R	0	44
CCC[C@H](O)CN1CCN([C@@H](C#N)c2ccc(Br)cc2)CC1	ZINC000450657888	FF	On-Demand	Mild	IGF1R	0	44
CCC[C@@H](O)CN1CCN([C@@H](C#N)c2ccc(Br)cc2)CC1	ZINC000450657890	FF	On-Demand	Mild	IGF1R	0	44
CCCOc1ccc(C(=O)N2CCN(C(=O)C3CC3)CC2(C)C)c(OC)c1	ZINC000450657901	FF	On-Demand	Anodyne	OXTR	0	41
CC(C)O[C@@H]1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC000450657911	FG	On-Demand	Bother	CACNA1C	48	34
CC(C)O[C@@H]1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC000450657911	FG	On-Demand	Bother	CACNA1D	81	34
CC(C)O[C@@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC000450657912	FG	On-Demand	Bother	CACNA1C	48	34
CC(C)O[C@@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC000450657912	FG	On-Demand	Bother	CACNA1D	81	34
O=C(Cc1ccc(O)c(F)c1)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657913	GF	On-Demand	Anodyne	CCR3	56	41
O=C(Cc1ccc(O)c(F)c1)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1	ZINC000450657913	GF	On-Demand	Anodyne	RHOA	0	40
CC(C)O[C@H]1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC000450657914	FG	On-Demand	Bother	CACNA1C	48	34
CC(C)O[C@H]1C[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC000450657914	FG	On-Demand	Bother	CACNA1D	81	34
O=C(Cc1ccc(O)c(F)c1)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657915	GF	On-Demand	Anodyne	CCR3	56	41
O=C(Cc1ccc(O)c(F)c1)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1	ZINC000450657915	GF	On-Demand	Anodyne	RHOA	0	40
CC(C)O[C@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC000450657916	FG	On-Demand	Bother	CACNA1C	48	34
CC(C)O[C@H]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC000450657916	FG	On-Demand	Bother	CACNA1D	81	34
CC(C)C(=O)NCCN(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450657926	CD	On-Demand	Anodyne	MME	24	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450657932	EE	On-Demand	Anodyne	TIMP3	53	31
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450657933	EE	On-Demand	Anodyne	TIMP3	53	31
COCCn1c(NC(=O)Cc2ccc(OC(F)F)c(F)c2)nc2ccccc21	ZINC000450657934	GH	On-Demand	Anodyne	ITK	19	40
CC(C)C(=O)NCCN(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450657943	CD	On-Demand	Anodyne	MME	24	40
CC(C)C(=O)NCCN(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450657944	CD	On-Demand	Anodyne	MME	24	40
CC(C)C(=O)NCCN(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450657945	CD	On-Demand	Anodyne	MME	24	40
Cc1nn(C)cc1CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450657952	FG	On-Demand	Anodyne	P2RX7	26	40
OC[C@]1(F)CN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1c1ccccc1	ZINC000450657953	FG	On-Demand	Anodyne	PDGFRB	20	43
OC[C@]1(F)CN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1c1ccccc1	ZINC000450657953	FG	On-Demand	Anodyne	PDE3B	54	35
OC[C@]1(F)CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450657954	FG	On-Demand	Anodyne	PDGFRB	20	43
OC[C@]1(F)CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450657954	FG	On-Demand	Anodyne	PDE3B	54	35
OC[C@@]1(F)CN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1c1ccccc1	ZINC000450657955	FG	On-Demand	Anodyne	PDGFRB	20	43
OC[C@@]1(F)CN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1c1ccccc1	ZINC000450657955	FG	On-Demand	Anodyne	PDE3B	54	35
OC[C@@]1(F)CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450657956	FG	On-Demand	Anodyne	PDGFRB	20	43
OC[C@@]1(F)CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450657956	FG	On-Demand	Anodyne	PDE3B	54	35
O=C(NCc1cccc(-c2cccnc2)c1)[C@@H]1CC1(F)F	ZINC000450657969	CG	On-Demand	Anodyne	NAMPT	42	36
O=C(NCc1cccc(-c2cccnc2)c1)[C@H]1CC1(F)F	ZINC000450657970	CG	On-Demand	Anodyne	NAMPT	42	36
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)c1	ZINC000450657972	GH	On-Demand	Anodyne	RHOA	0	52
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)c1	ZINC000450657972	GH	On-Demand	Anodyne	KCNK3	88	36
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)c1	ZINC000450657972	GH	On-Demand	Anodyne	KCNK9	46	36
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)c1	ZINC000450657974	GH	On-Demand	Anodyne	RHOA	0	52
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)c1	ZINC000450657974	GH	On-Demand	Anodyne	KCNK3	88	36
CSc1cccc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)c1	ZINC000450657974	GH	On-Demand	Anodyne	KCNK9	46	36
CC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450657990	CG	On-Demand	Anodyne	NQO2	42	46
CC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450657990	CG	On-Demand	Anodyne	MTR1B_CHICK	0	59
CC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450657990	CG	On-Demand	Anodyne	HTR6	44	41
CC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450657990	CG	On-Demand	Anodyne	PPARD	45	42
CC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450657990	CG	On-Demand	Anodyne	MTNR1B	40	39
CC[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450657991	CG	On-Demand	Anodyne	NQO2	42	46
CC[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450657991	CG	On-Demand	Anodyne	MTR1B_CHICK	0	59
CC[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450657991	CG	On-Demand	Anodyne	HTR6	44	41
CC[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450657991	CG	On-Demand	Anodyne	PPARD	45	42
CC[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450657991	CG	On-Demand	Anodyne	MTNR1B	40	39
O=C(Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1)c1cc(C2CC2)[nH]n1	ZINC000450658002	FE	On-Demand	Anodyne	CDK2	15	41
O=C(Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1)c1cc(C2CC2)[nH]n1	ZINC000450658003	FE	On-Demand	Anodyne	CDK2	15	41
O=C(C[C@H]1COc2ccccc2O1)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450658014	FG	On-Demand	Anodyne	FFAR1	20	45
O=C(C[C@@H]1COc2ccccc2O1)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450658015	FG	On-Demand	Anodyne	FFAR1	20	45
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450658030	EG	On-Demand	Anodyne	NAAA	46	39
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450658031	EG	On-Demand	Anodyne	NAAA	46	39
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450658032	EG	On-Demand	Anodyne	NAAA	46	39
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450658033	EG	On-Demand	Anodyne	NAAA	46	39
COC(=O)c1csc(CN[C@@H](CN2CCOCC2)c2ccccc2)n1	ZINC000450658039	FE	On-Demand	Anodyne	CASR	54	45
COC(=O)c1csc(CN[C@H](CN2CCOCC2)c2ccccc2)n1	ZINC000450658040	FE	On-Demand	Anodyne	CASR	54	45
CC[C@H](CC(F)(F)F)C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450658054	EI	On-Demand	Anodyne	MDM2	47	36
CC[C@@H](CC(F)(F)F)C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450658055	EI	On-Demand	Anodyne	MDM2	47	36
CC[C@H](CC(F)(F)F)C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450658056	EI	On-Demand	Anodyne	MDM2	47	36
CC[C@@H](CC(F)(F)F)C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450658057	EI	On-Demand	Anodyne	MDM2	47	36
Cn1c(SCC2(C#N)CCC2)nnc1-c1ccccc1F	ZINC000450658058	DG	On-Demand	Mild	DRD3	40	36
Cn1c(SCC2(C#N)CCC2)nnc1-c1ccccc1F	ZINC000450658058	DG	On-Demand	Mild	HSD11B1	19	47
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(-c2ccccc2)cc1	ZINC000450658059	CG	On-Demand	Anodyne	ACACB	22	42
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(-c2ccccc2)cc1	ZINC000450658060	CG	On-Demand	Anodyne	ACACB	22	42
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(-c2ccccc2)cc1	ZINC000450658061	CG	On-Demand	Anodyne	ACACB	22	42
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(-c2ccccc2)cc1	ZINC000450658062	CG	On-Demand	Anodyne	ACACB	22	42
C[C@H](c1ccccc1)[C@H](O)CN[C@@H](CN1CCOCC1)c1ccccc1	ZINC000450658074	FF	On-Demand	Anodyne	CASR	43	35
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H](CN1CCOCC1)c1ccccc1	ZINC000450658075	FF	On-Demand	Anodyne	CASR	43	35
C[C@H](c1ccccc1)[C@@H](O)CN[C@H](CN1CCOCC1)c1ccccc1	ZINC000450658076	FF	On-Demand	Anodyne	CASR	43	35
C[C@H](c1ccccc1)[C@H](O)CN[C@H](CN1CCOCC1)c1ccccc1	ZINC000450658077	FF	On-Demand	Anodyne	CASR	43	35
Cn1c(COc2ccc(Cl)cc2)nnc1S[C@@H]1CC[C@@H](C#N)C1	ZINC000450658086	EH	On-Demand	Mild	VCP	74	46
Cn1c(COc2ccc(Cl)cc2)nnc1S[C@H]1CC[C@H](C#N)C1	ZINC000450658087	EH	On-Demand	Mild	VCP	74	46
Cn1c(COc2ccc(Cl)cc2)nnc1S[C@H]1CC[C@@H](C#N)C1	ZINC000450658088	EH	On-Demand	Mild	VCP	74	46
Cn1c(COc2ccc(Cl)cc2)nnc1S[C@@H]1CC[C@H](C#N)C1	ZINC000450658089	EH	On-Demand	Mild	VCP	74	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658122	DG	On-Demand	Anodyne	NQO2	42	52
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658122	DG	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658122	DG	On-Demand	Anodyne	HTR6	43	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658122	DG	On-Demand	Anodyne	PPARD	37	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658122	DG	On-Demand	Anodyne	EBP	19	48
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658123	DG	On-Demand	Anodyne	NQO2	42	52
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658123	DG	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658123	DG	On-Demand	Anodyne	HTR6	43	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658123	DG	On-Demand	Anodyne	PPARD	37	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)OC(C)C	ZINC000450658123	DG	On-Demand	Anodyne	EBP	19	48
CN(CCN(C)c1ncc(Cl)cc1Cl)c1ccc(S(N)(=O)=O)cc1	ZINC000450658126	GF	On-Demand	Anodyne	CA2	22	41
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450658138	FG	On-Demand	Bother	CACNA1C	50	34
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450658138	FG	On-Demand	Bother	CACNA1D	80	34
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450658139	FG	On-Demand	Bother	CACNA1C	50	34
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450658139	FG	On-Demand	Bother	CACNA1D	80	34
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450658140	FG	On-Demand	Bother	CACNA1C	50	34
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450658140	FG	On-Demand	Bother	CACNA1D	80	34
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450658141	FG	On-Demand	Bother	CACNA1C	50	34
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450658141	FG	On-Demand	Bother	CACNA1D	80	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	ANPEP	41	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	CTSB	31	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	CYSP_TRYCR	22	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	CTSK	43	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	MMP3	18	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	MMP8	21	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	CTSS	39	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	CAPN1	47	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	CAPN2	78	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	CTSV	43	29
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	FPR1	56	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	NPR	59	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450658144	GH	On-Demand	Anodyne	AMP1_PLAFQ	24	40
CSCC1CCC(Nc2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450658146	FG	On-Demand	Anodyne	TGM2	37	41
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)CCC(C)(C)C1	ZINC000450658164	GH	On-Demand	Anodyne	RHOA	0	40
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)CCC(C)(C)C1	ZINC000450658164	GH	On-Demand	Anodyne	KCNK3	43	32
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)CCC(C)(C)C1	ZINC000450658165	GH	On-Demand	Anodyne	RHOA	0	40
CC1=C(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)CCC(C)(C)C1	ZINC000450658165	GH	On-Demand	Anodyne	KCNK3	43	32
COc1ccc(CNC(=O)CCN2CCc3cccc(F)c3C2)c(OC)c1	ZINC000450658169	FF	On-Demand	Anodyne	DRD4	47	37
COc1ccc(CNC(=O)CCN2CCc3cccc(F)c3C2)c(OC)c1	ZINC000450658169	FF	On-Demand	Anodyne	HTR7	32	41
COc1ccc(CNC(=O)CCN2CCc3cccc(F)c3C2)c(OC)c1	ZINC000450658169	FF	On-Demand	Anodyne	ABCB1B	47	35
COc1ccc(CNC(=O)CCN2CCc3cccc(F)c3C2)c(OC)c1	ZINC000450658169	FF	On-Demand	Anodyne	MTNR1A	43	41
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	DRD2	35	50
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	DRD1	24	53
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	DRD4	30	51
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	HTR2A	35	57
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	HTR2C	29	66
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	ERG2	24	50
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	CCR3	43	40
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	SLC18A3	0	49
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	HTR3B	0	50
NC(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450658170	DF	On-Demand	Anodyne	CYP2J2	70	49
O=C(Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450658183	FF	On-Demand	Anodyne	RHOA	0	47
O=C(Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450658184	FF	On-Demand	Anodyne	RHOA	0	47
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450658204	GF	On-Demand	Anodyne	L3MBTL3	45	34
CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450658205	GF	On-Demand	Anodyne	L3MBTL3	45	34
COC(=O)[C@@H](CC(C)C)N(C)c1cc(C)nc2ncnn12	ZINC000450658221	CD	On-Demand	Anodyne	DHOD	0	45
COC(=O)[C@H](CC(C)C)N(C)c1cc(C)nc2ncnn12	ZINC000450658222	CD	On-Demand	Anodyne	DHOD	0	45
CCCOc1ccc(C(=O)Nc2nc3ccccc3n2CCOC)c(OC)c1	ZINC000450658223	GH	On-Demand	Anodyne	LUCI_LUCLA	16	42
COC[C@](C)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450658252	DE	On-Demand	Anodyne	PDE6A	41	33
COC[C@@](C)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450658253	DE	On-Demand	Anodyne	PDE6A	41	33
CN(CC(C)(C)CO)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450658258	DG	On-Demand	Bother	AADAC	0	43
CC[C@@H]1[C@H](CO)CCN1c1ncc(C#N)cc1Cl	ZINC000450658278	CE	On-Demand	Mild	CXCR3	15	41
CC[C@H]1[C@H](CO)CCN1c1ncc(C#N)cc1Cl	ZINC000450658279	CE	On-Demand	Mild	CXCR3	15	41
CC[C@H]1[C@@H](CO)CCN1c1ncc(C#N)cc1Cl	ZINC000450658280	CE	On-Demand	Mild	CXCR3	15	41
CC[C@@H]1[C@@H](CO)CCN1c1ncc(C#N)cc1Cl	ZINC000450658281	CE	On-Demand	Mild	CXCR3	15	41
COCc1cc(NCc2ccnc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450658296	EE	On-Demand	Anodyne	DHOD	0	48
FC(F)(F)c1cc(CNc2nccc(N[C@@H]3CCCOC3)n2)ccn1	ZINC000450658309	FF	On-Demand	Anodyne	MAPK1	42	31
FC(F)(F)c1cc(CNc2nccc(N[C@H]3CCCOC3)n2)ccn1	ZINC000450658310	FF	On-Demand	Anodyne	MAPK1	42	31
COC(=O)c1cccc(CN[C@@H](CN2CCOCC2)c2ccccc2)c1Cl	ZINC000450658335	GG	On-Demand	Anodyne	CASR	49	42
COC(=O)c1cccc(CN[C@H](CN2CCOCC2)c2ccccc2)c1Cl	ZINC000450658336	GG	On-Demand	Anodyne	CASR	49	42
COC1(CSc2nnc(COc3ccc(Cl)cc3)n2C)CCC1	ZINC000450658338	FH	On-Demand	Anodyne	VCP	49	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658360	GF	On-Demand	Anodyne	EDNRB	87	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658360	GF	On-Demand	Anodyne	EDNRA	82	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658360	GF	On-Demand	Anodyne	BMP1	66	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658360	GF	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658360	GF	On-Demand	Anodyne	RORC	31	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658361	GF	On-Demand	Anodyne	EDNRB	87	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658361	GF	On-Demand	Anodyne	EDNRA	82	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658361	GF	On-Demand	Anodyne	BMP1	66	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658361	GF	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000450658361	GF	On-Demand	Anodyne	RORC	31	40
O=C(CCCC(=O)C1CC1)NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2	ZINC000450658391	GI	On-Demand	Anodyne	GLS	0	40
O=C(CCCC(=O)C1CC1)NCc1nc2c(s1)C[C@H](c1ccccc1)CC2	ZINC000450658392	GI	On-Demand	Anodyne	GLS	0	40
CN1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450658412	CF	On-Demand	Anodyne	DRD2	32	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450658412	CF	On-Demand	Anodyne	DRD4	0	47
CN1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450658412	CF	On-Demand	Anodyne	SLC18A3	0	50
CN1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450658412	CF	On-Demand	Anodyne	CYP2J2	47	34
OC[C@@]1(F)CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450658493	DE	On-Demand	Anodyne	AKT2	48	47
OC[C@@]1(F)CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450658493	DE	On-Demand	Anodyne	AKT3	36	42
OC[C@@]1(F)CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450658493	DE	On-Demand	Anodyne	AKT1	23	41
CCOc1cc(NCc2ccnc(C(F)(F)F)c2)ccc1[N+](=O)[O-]	ZINC000450658505	EI	On-Demand	Bother	DRTS_TRYCR	46	33
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(Cl)c2)c(OC)c1	ZINC000450658550	GH	On-Demand	Anodyne	NQO2	18	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(Cl)c2)c(OC)c1	ZINC000450658550	GH	On-Demand	Anodyne	CSNK1D	20	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(Cl)c2)c(OC)c1	ZINC000450658550	GH	On-Demand	Anodyne	MTNR1A	69	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(Cl)c2)c(OC)c1	ZINC000450658550	GH	On-Demand	Anodyne	MTNR1B	63	42
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(Cl)c2)c(OC)c1	ZINC000450658551	GH	On-Demand	Anodyne	NQO2	18	42
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(Cl)c2)c(OC)c1	ZINC000450658551	GH	On-Demand	Anodyne	CSNK1D	20	40
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(Cl)c2)c(OC)c1	ZINC000450658551	GH	On-Demand	Anodyne	MTNR1A	69	42
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(Cl)c2)c(OC)c1	ZINC000450658551	GH	On-Demand	Anodyne	MTNR1B	63	42
C[C@H](NCc1cc(Cl)cc(CN[C@H](C)c2cccnc2)c1)c1cccnc1	ZINC000450658560	GJ	On-Demand	Anodyne	TBXAS1	16	40
C[C@@H](NCc1cc(Cl)cc(CN[C@H](C)c2cccnc2)c1)c1cccnc1	ZINC000450658561	GJ	On-Demand	Anodyne	TBXAS1	16	40
C[C@H](NCc1cc(Cl)cc(CN[C@@H](C)c2cccnc2)c1)c1cccnc1	ZINC000450658562	GJ	On-Demand	Anodyne	TBXAS1	16	40
Cc1occc1-c1nnc(SCCC(C)(F)F)n1C	ZINC000450658585	CH	On-Demand	Anodyne	DRD3	22	41
Cc1occc1-c1nnc(SCCC(C)(F)F)n1C	ZINC000450658585	CH	On-Demand	Anodyne	KCNH2	24	41
OC[C@]1(F)CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450658594	DE	On-Demand	Anodyne	AKT2	48	47
OC[C@]1(F)CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450658594	DE	On-Demand	Anodyne	AKT3	36	42
OC[C@]1(F)CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450658594	DE	On-Demand	Anodyne	AKT1	23	41
OC[C@]1(F)CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450658595	DE	On-Demand	Anodyne	AKT2	48	47
OC[C@]1(F)CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450658595	DE	On-Demand	Anodyne	AKT3	36	42
OC[C@]1(F)CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450658595	DE	On-Demand	Anodyne	AKT1	23	41
OC[C@@]1(F)CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450658596	DE	On-Demand	Anodyne	AKT2	48	47
OC[C@@]1(F)CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450658596	DE	On-Demand	Anodyne	AKT3	36	42
OC[C@@]1(F)CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450658596	DE	On-Demand	Anodyne	AKT1	23	41
COc1cc(OC)nc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450658602	ED	On-Demand	Anodyne	ALS	60	34
COc1cc(OC)nc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450658603	ED	On-Demand	Anodyne	ALS	60	34
COc1cc(OC)nc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450658604	ED	On-Demand	Anodyne	ALS	60	34
COc1cc(OC)nc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450658605	ED	On-Demand	Anodyne	ALS	60	34
CSc1cccc(C(=O)N2CCC[C@@H](CC(=O)OC(C)C)C2)c1	ZINC000450658621	EH	On-Demand	Anodyne	RHOA	0	43
CSc1cccc(C(=O)N2CCC[C@H](CC(=O)OC(C)C)C2)c1	ZINC000450658622	EH	On-Demand	Anodyne	RHOA	0	43
OC[C@@]1(F)CN(c2cnc3ccccc3n2)C[C@@H]1c1ccccc1	ZINC000450658623	DF	On-Demand	Anodyne	SORD	15	41
OC[C@]1(F)CN(c2cnc3ccccc3n2)C[C@@H]1c1ccccc1	ZINC000450658624	DF	On-Demand	Anodyne	SORD	15	41
OC[C@]1(F)CN(c2cnc3ccccc3n2)C[C@H]1c1ccccc1	ZINC000450658625	DF	On-Demand	Anodyne	SORD	15	41
OC[C@@]1(F)CN(c2cnc3ccccc3n2)C[C@H]1c1ccccc1	ZINC000450658626	DF	On-Demand	Anodyne	SORD	15	41
CC[C@H]1[C@@H](CO)CCN1c1ccnc(C(C)C)n1	ZINC000450658635	BE	On-Demand	Anodyne	SORD	102	42
CC[C@@H]1[C@H](CO)CCN1c1ccnc(C(C)C)n1	ZINC000450658636	BE	On-Demand	Anodyne	SORD	102	42
CC[C@H]1[C@H](CO)CCN1c1ccnc(C(C)C)n1	ZINC000450658637	BE	On-Demand	Anodyne	SORD	102	42
CC[C@@H]1[C@@H](CO)CCN1c1ccnc(C(C)C)n1	ZINC000450658638	BE	On-Demand	Anodyne	SORD	102	42
COc1cc(CN[C@H](C)c2cccc(S(N)(=O)=O)c2)ccc1Cl	ZINC000450658701	FF	On-Demand	Anodyne	CA2	17	44
COc1cc(CN[C@@H](C)c2cccc(S(N)(=O)=O)c2)ccc1Cl	ZINC000450658702	FF	On-Demand	Anodyne	CA2	17	44
Cc1nc(NCc2ccnc(C(F)(F)F)c2)sc1S(N)(=O)=O	ZINC000450658721	FD	On-Demand	Anodyne	PTGS2	25	43
C[C@@H]1CCCN(c2cc(NCc3ccnc(C(F)(F)F)c3)ncn2)C1	ZINC000450658725	FH	On-Demand	Anodyne	PRCP	23	42
C[C@H]1CCCN(c2cc(NCc3ccnc(C(F)(F)F)c3)ncn2)C1	ZINC000450658726	FH	On-Demand	Anodyne	PRCP	23	42
Cn1ncc(NCc2ccnc(C(F)(F)F)c2)c(Br)c1=O	ZINC000450658731	FF	On-Demand	Anodyne	FLT1	20	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450658738	DF	On-Demand	Anodyne	ACE	28	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450658738	DF	On-Demand	Anodyne	NAAA	41	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450658739	DF	On-Demand	Anodyne	ACE	28	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450658739	DF	On-Demand	Anodyne	NAAA	41	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450658740	DF	On-Demand	Anodyne	ACE	28	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450658740	DF	On-Demand	Anodyne	NAAA	41	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450658741	DF	On-Demand	Anodyne	ACE	28	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450658741	DF	On-Demand	Anodyne	NAAA	41	36
CC(=O)N1CCN(Cc2ccc(NC(=O)[C@H](O)C3CCC3)cc2)CC1	ZINC000450658745	ED	On-Demand	Anodyne	MLNR	45	44
CC(=O)N1CCN(Cc2ccc(NC(=O)[C@H](O)C3CCC3)cc2)CC1	ZINC000450658745	ED	On-Demand	Anodyne	EPHX2	23	41
CC(=O)N1CCN(Cc2ccc(NC(=O)[C@H](O)C3CCC3)cc2)CC1	ZINC000450658745	ED	On-Demand	Anodyne	NOD2	42	35
CC(=O)N1CCN(Cc2ccc(NC(=O)[C@@H](O)C3CCC3)cc2)CC1	ZINC000450658746	ED	On-Demand	Anodyne	MLNR	45	44
CC(=O)N1CCN(Cc2ccc(NC(=O)[C@@H](O)C3CCC3)cc2)CC1	ZINC000450658746	ED	On-Demand	Anodyne	EPHX2	23	41
CC(=O)N1CCN(Cc2ccc(NC(=O)[C@@H](O)C3CCC3)cc2)CC1	ZINC000450658746	ED	On-Demand	Anodyne	NOD2	42	35
Cn1c(COc2ccccc2Cl)nnc1SC1CC(OC(C)(C)C)C1	ZINC000450658753	GI	On-Demand	Anodyne	VCP	42	35
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658756	GG	On-Demand	Anodyne	PDGFRB	31	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658756	GG	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658756	GG	On-Demand	Anodyne	P2RX7	31	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658756	GG	On-Demand	Anodyne	MTNR1A	48	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658756	GG	On-Demand	Anodyne	CSF1R	15	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658757	GG	On-Demand	Anodyne	PDGFRB	31	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658757	GG	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658757	GG	On-Demand	Anodyne	P2RX7	31	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658757	GG	On-Demand	Anodyne	MTNR1A	48	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)cc2F)c(OC)c1	ZINC000450658757	GG	On-Demand	Anodyne	CSF1R	15	40
CC[C@@H]1CCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000450658775	CE	On-Demand	Bother	PRKCQ	41	35
CC[C@H]1CCC[C@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000450658776	CE	On-Demand	Bother	PRKCQ	41	35
CC[C@H]1CCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000450658777	CE	On-Demand	Bother	PRKCQ	41	35
CC[C@@H]1CCC[C@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000450658778	CE	On-Demand	Bother	PRKCQ	41	35
CC[C@H]1CCC[C@@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450658831	DG	On-Demand	Anodyne	ADAM17	29	43
CC[C@H]1CCC[C@@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450658831	DG	On-Demand	Anodyne	ITK	39	40
CC[C@@H]1CCC[C@@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450658832	DG	On-Demand	Anodyne	ADAM17	29	43
CC[C@@H]1CCC[C@@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450658832	DG	On-Demand	Anodyne	ITK	39	40
CC[C@H]1CCC[C@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450658833	DG	On-Demand	Anodyne	ADAM17	29	43
CC[C@H]1CCC[C@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450658833	DG	On-Demand	Anodyne	ITK	39	40
CC[C@@H]1CCC[C@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450658834	DG	On-Demand	Anodyne	ADAM17	29	43
CC[C@@H]1CCC[C@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450658834	DG	On-Demand	Anodyne	ITK	39	40
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1	ZINC000450658862	FF	On-Demand	Bother	CACNA1C	45	36
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1	ZINC000450658862	FF	On-Demand	Bother	CACNA1D	77	36
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1	ZINC000450658863	FF	On-Demand	Bother	CACNA1C	45	36
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1	ZINC000450658863	FF	On-Demand	Bother	CACNA1D	77	36
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1	ZINC000450658864	FF	On-Demand	Bother	CACNA1C	45	36
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1	ZINC000450658864	FF	On-Demand	Bother	CACNA1D	77	36
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1	ZINC000450658865	FF	On-Demand	Bother	CACNA1C	45	36
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1	ZINC000450658865	FF	On-Demand	Bother	CACNA1D	77	36
N#Cc1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1C(F)(F)F	ZINC000450658876	FH	On-Demand	Mild	AR	59	46
N#Cc1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1C(F)(F)F	ZINC000450658877	FH	On-Demand	Mild	AR	59	46
N#Cc1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1C(F)(F)F	ZINC000450658878	FH	On-Demand	Mild	AR	59	46
N#Cc1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1C(F)(F)F	ZINC000450658879	FH	On-Demand	Mild	AR	59	46
Cc1cnc(CCCC(=O)NCC(Cc2ccccc2)Cc2ccccc2)o1	ZINC000450658880	GJ	On-Demand	Anodyne	FAAH	48	35
Cc1cnc(CCCC(=O)NCC(Cc2ccccc2)Cc2ccccc2)o1	ZINC000450658880	GJ	On-Demand	Anodyne	CAPN2	42	29
Cc1cnc(CCCC(=O)NCC(Cc2ccccc2)Cc2ccccc2)o1	ZINC000450658880	GJ	On-Demand	Anodyne	CES1D	56	33
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450658887	GH	On-Demand	Bother	NQO2	32	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450658887	GH	On-Demand	Bother	MTR1B_CHICK	0	48
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450658887	GH	On-Demand	Bother	HTR6	38	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450658887	GH	On-Demand	Bother	EBP	19	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450658888	GH	On-Demand	Bother	NQO2	32	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450658888	GH	On-Demand	Bother	MTR1B_CHICK	0	48
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450658888	GH	On-Demand	Bother	HTR6	38	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000450658888	GH	On-Demand	Bother	EBP	19	42
CC[C@H](NCc1cccc(C(=O)OC)c1Cl)c1ccc(OC)cc1	ZINC000450658905	EI	On-Demand	Anodyne	GPR88	0	40
CC[C@@H](NCc1cccc(C(=O)OC)c1Cl)c1ccc(OC)cc1	ZINC000450658906	EI	On-Demand	Anodyne	GPR88	0	40
C[C@@H](NCC1(C#N)CCC1)c1cccnc1	ZINC000450658934	BE	On-Demand	Mild	PTAFR	16	47
C[C@H](NCC1(C#N)CCC1)c1cccnc1	ZINC000450658935	BE	On-Demand	Mild	PTAFR	16	47
CC[C@@H]1CCC[C@H]1CNc1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450658944	CG	On-Demand	Mild	PRKCQ	44	33
CC[C@H]1CCC[C@@H]1CNc1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450658945	CG	On-Demand	Mild	PRKCQ	44	33
CC[C@H]1CCC[C@H]1CNc1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450658946	CG	On-Demand	Mild	PRKCQ	44	33
CC[C@@H]1CCC[C@@H]1CNc1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450658947	CG	On-Demand	Mild	PRKCQ	44	33
Cn1c(COc2ccc(Cl)cc2)nnc1SC[C@H]1CCCC1(F)F	ZINC000450658950	FJ	On-Demand	Anodyne	VCP	66	41
Cn1c(COc2ccc(Cl)cc2)nnc1SC[C@@H]1CCCC1(F)F	ZINC000450658951	FJ	On-Demand	Anodyne	VCP	66	41
FC1(F)CCCC[C@@H]1CN[C@@H](CN1CCOCC1)c1ccccc1	ZINC000450658963	EG	On-Demand	Anodyne	SCN9A	0	42
FC1(F)CCCC[C@@H]1CN[C@H](CN1CCOCC1)c1ccccc1	ZINC000450658964	EG	On-Demand	Anodyne	SCN9A	0	42
FC1(F)CCCC[C@H]1CN[C@@H](CN1CCOCC1)c1ccccc1	ZINC000450658965	EG	On-Demand	Anodyne	SCN9A	0	42
FC1(F)CCCC[C@H]1CN[C@H](CN1CCOCC1)c1ccccc1	ZINC000450658966	EG	On-Demand	Anodyne	SCN9A	0	42
CCc1cc2c(NCc3ccnc(C(F)(F)F)c3)ncnc2s1	ZINC000450658971	EI	On-Demand	Anodyne	CLK4	52	35
CC(C)OC(=O)c1cccnc1NCc1ccnc(C(F)(F)F)c1	ZINC000450658974	EH	On-Demand	Anodyne	BDKRB1	0	41
COC(=O)[C@@H](CC(C)C)N(C)c1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450658991	DE	On-Demand	Bother	GRB7	0	40
COC(=O)[C@H](CC(C)C)N(C)c1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450658992	DE	On-Demand	Bother	GRB7	0	40
COC(=O)C1(NCCC(=O)NCc2ccc(OC)cc2OC)CCCCCC1	ZINC000450658996	GF	On-Demand	Anodyne	MTNR1A	60	41
COC(=O)C1(NCCC(=O)NCc2ccc(OC)cc2OC)CCCCCC1	ZINC000450658996	GF	On-Demand	Anodyne	MTNR1B	45	41
O=C(N[C@@H]1CCCOCC1)c1c(Cl)cc(Cl)cc1Cl	ZINC000450659018	DH	On-Demand	Anodyne	TYRO3	15	41
O=C(N[C@H]1CCCOCC1)c1c(Cl)cc(Cl)cc1Cl	ZINC000450659019	DH	On-Demand	Anodyne	TYRO3	15	41
CCS(=O)(=O)c1ccc(CN[C@@](C)(COC)C(=O)OC)cc1	ZINC000450659055	ED	On-Demand	Anodyne	PTPRB	56	35
CCS(=O)(=O)c1ccc(CN[C@@](C)(COC)C(=O)OC)cc1	ZINC000450659055	ED	On-Demand	Anodyne	RORC	42	33
CCS(=O)(=O)c1ccc(CN[C@](C)(COC)C(=O)OC)cc1	ZINC000450659056	ED	On-Demand	Anodyne	PTPRB	56	35
CCS(=O)(=O)c1ccc(CN[C@](C)(COC)C(=O)OC)cc1	ZINC000450659056	ED	On-Demand	Anodyne	RORC	42	33
CCNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nc1	ZINC000450659087	EE	On-Demand	Anodyne	HDAC1	23	41
CCNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nc1	ZINC000450659088	EE	On-Demand	Anodyne	HDAC1	23	41
CCNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nc1	ZINC000450659089	EE	On-Demand	Anodyne	HDAC1	23	41
CCNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nc1	ZINC000450659090	EE	On-Demand	Anodyne	HDAC1	23	41
COC(=O)c1csc(CSc2nnc(-c3ccoc3C)n2C)n1	ZINC000450659104	FF	On-Demand	Anodyne	HCRTR2	0	41
COC1(CSc2nnc(-c3ccoc3C)n2C)CCC1	ZINC000450659105	CG	On-Demand	Anodyne	DRD3	41	37
COc1ccnc(CN[C@@H](C)c2ccc3c(c2)OCO3)n1	ZINC000450659106	CE	On-Demand	Anodyne	CLK4	42	34
COc1ccnc(CN[C@H](C)c2ccc3c(c2)OCO3)n1	ZINC000450659107	CE	On-Demand	Anodyne	CLK4	42	34
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc2c(c1)OCO2	ZINC000450659127	CD	On-Demand	Anodyne	DYRK2	44	36
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc2c(c1)OCO2	ZINC000450659128	CD	On-Demand	Anodyne	DYRK2	44	36
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc2c(c1)OCO2	ZINC000450659129	CD	On-Demand	Anodyne	DYRK2	44	36
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc2c(c1)OCO2	ZINC000450659130	CD	On-Demand	Anodyne	DYRK2	44	36
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)Nc2cncnc2)cc1OC	ZINC000450659131	FD	On-Demand	Anodyne	ENPP1	50	32
Cn1c(SCC[C@H]2CCOC2)nnc1-c1ccccc1F	ZINC000450659138	DG	On-Demand	Anodyne	DRD3	53	35
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1ccccc1F	ZINC000450659139	DG	On-Demand	Anodyne	DRD3	53	35
CCOc1c(Cl)cc(NC(=O)c2ccnn2CC(F)(F)F)cc1Cl	ZINC000450659183	GI	On-Demand	Anodyne	ATF1	52	33
CCOc1c(Cl)cc(NC(=O)c2ccnn2CC(F)(F)F)cc1Cl	ZINC000450659183	GI	On-Demand	Anodyne	FLT1	24	47
CCOc1c(Cl)cc(NC(=O)c2ccnn2CC(F)(F)F)cc1Cl	ZINC000450659183	GI	On-Demand	Anodyne	NFKB1	48	33
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1F	ZINC000450659192	DH	On-Demand	Anodyne	DRD2	0	43
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1F	ZINC000450659192	DH	On-Demand	Anodyne	DRD3	56	43
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1F	ZINC000450659192	DH	On-Demand	Anodyne	KCNH2	26	43
Cn1c(SCCC(C)(F)F)nnc1-c1ccccc1F	ZINC000450659192	DH	On-Demand	Anodyne	HSD11B1	25	43
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@@H](CC(=O)OC(C)C)C2)c(F)c1	ZINC000450659201	GE	On-Demand	Anodyne	CCR3	45	39
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@H](CC(=O)OC(C)C)C2)c(F)c1	ZINC000450659202	GE	On-Demand	Anodyne	CCR3	45	39
C[C@]1(F)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450659222	CG	On-Demand	Anodyne	DRD2	39	58
C[C@]1(F)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450659222	CG	On-Demand	Anodyne	DRD1	22	53
C[C@]1(F)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450659222	CG	On-Demand	Anodyne	ERG2	27	58
C[C@]1(F)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450659222	CG	On-Demand	Anodyne	CYP2J2	54	41
C[C@@]1(F)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450659223	CG	On-Demand	Anodyne	DRD2	39	58
C[C@@]1(F)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450659223	CG	On-Demand	Anodyne	DRD1	22	53
C[C@@]1(F)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450659223	CG	On-Demand	Anodyne	ERG2	27	58
C[C@@]1(F)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450659223	CG	On-Demand	Anodyne	CYP2J2	54	41
CN(C)c1nccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450659225	DD	On-Demand	Anodyne	SORD	42	33
CN(C)c1nccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450659226	DD	On-Demand	Anodyne	SORD	42	33
CN(C)c1nccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450659227	DD	On-Demand	Anodyne	SORD	42	33
CN(C)c1nccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450659228	DD	On-Demand	Anodyne	SORD	42	33
CC[C@H]1[C@H](CO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450659241	CF	On-Demand	Anodyne	HTT	0	41
CC[C@@H]1[C@H](CO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450659242	CF	On-Demand	Anodyne	HTT	0	41
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450659243	CF	On-Demand	Anodyne	HTT	0	41
CC[C@H]1[C@@H](CO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450659244	CF	On-Demand	Anodyne	HTT	0	41
COCCOC[C@@H](O)CN[C@@H](c1cccs1)C1CC1	ZINC000450659310	CD	On-Demand	Anodyne	ADRB2	15	40
COCCOC[C@@H](O)CN[C@H](c1cccs1)C1CC1	ZINC000450659311	CD	On-Demand	Anodyne	ADRB2	15	40
COCCOC[C@H](O)CN[C@H](c1cccs1)C1CC1	ZINC000450659312	CD	On-Demand	Anodyne	ADRB2	15	40
COCCOC[C@H](O)CN[C@@H](c1cccs1)C1CC1	ZINC000450659313	CD	On-Demand	Anodyne	ADRB2	15	40
COC(=O)c1cccc(CN[C@H](C)c2ccc3c(c2)OCCO3)c1Cl	ZINC000450659314	FH	On-Demand	Anodyne	KCNQ2	20	41
COC(=O)c1cccc(CN[C@@H](C)c2ccc3c(c2)OCCO3)c1Cl	ZINC000450659315	FH	On-Demand	Anodyne	KCNQ2	20	41
CCc1cc(NCc2ccnc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450659326	DF	On-Demand	Anodyne	DHOD	0	60
COC(=O)c1csc(CN[C@H](C)c2cccc(Cl)c2)n1	ZINC000450659340	DG	On-Demand	Anodyne	CASR	0	40
COC(=O)c1csc(CN[C@@H](C)c2cccc(Cl)c2)n1	ZINC000450659341	DG	On-Demand	Anodyne	CASR	0	40
COCCn1c(NC(=O)C2(CF)CCOCC2)nc2ccccc21	ZINC000450659398	EE	On-Demand	Anodyne	ITK	26	40
COCCn1c(NC(=O)C(C)(C)C2CCC2)nc2ccccc21	ZINC000450659412	DG	On-Demand	Anodyne	ITK	41	41
CCNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nn1	ZINC000450659413	ED	On-Demand	Anodyne	SCD1	46	43
CCNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nn1	ZINC000450659413	ED	On-Demand	Anodyne	SCD	39	40
CCNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nn1	ZINC000450659414	ED	On-Demand	Anodyne	SCD1	46	43
CCNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nn1	ZINC000450659414	ED	On-Demand	Anodyne	SCD	39	40
CCNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nn1	ZINC000450659415	ED	On-Demand	Anodyne	SCD1	46	43
CCNC(=O)c1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nn1	ZINC000450659415	ED	On-Demand	Anodyne	SCD	39	40
CCNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nn1	ZINC000450659416	ED	On-Demand	Anodyne	SCD1	46	43
CCNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nn1	ZINC000450659416	ED	On-Demand	Anodyne	SCD	39	40
Cc1ccc2ncnc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)c2c1	ZINC000450659427	EG	On-Demand	Anodyne	PDGFRB	15	43
Cc1ccc2ncnc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)c2c1	ZINC000450659427	EG	On-Demand	Anodyne	PDE3B	50	34
Cc1ccc2ncnc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)c2c1	ZINC000450659428	EG	On-Demand	Anodyne	PDGFRB	15	43
Cc1ccc2ncnc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)c2c1	ZINC000450659428	EG	On-Demand	Anodyne	PDE3B	50	34
Cc1ccc2ncnc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)c2c1	ZINC000450659429	EG	On-Demand	Anodyne	PDGFRB	15	43
Cc1ccc2ncnc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)c2c1	ZINC000450659429	EG	On-Demand	Anodyne	PDE3B	50	34
Cc1ccc2ncnc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)c2c1	ZINC000450659430	EG	On-Demand	Anodyne	PDGFRB	15	43
Cc1ccc2ncnc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)c2c1	ZINC000450659430	EG	On-Demand	Anodyne	PDE3B	50	34
CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450659431	EG	On-Demand	Anodyne	AKR1C3	0	40
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450659432	EG	On-Demand	Anodyne	AKR1C3	0	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450659453	FH	On-Demand	Anodyne	PPARG	27	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450659453	FH	On-Demand	Anodyne	MMP13	0	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450659453	FH	On-Demand	Anodyne	MTR1B_CHICK	0	49
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450659453	FH	On-Demand	Anodyne	EBP	18	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450659454	FH	On-Demand	Anodyne	PPARG	27	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450659454	FH	On-Demand	Anodyne	MMP13	0	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450659454	FH	On-Demand	Anodyne	MTR1B_CHICK	0	49
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450659454	FH	On-Demand	Anodyne	EBP	18	45
Cc1cccc(CN2CCN([C@@H](C#N)c3ccc(Br)cc3)CC2)n1	ZINC000450659459	GH	On-Demand	Mild	PTAFR	23	40
Cc1cccc(CN2CCN([C@H](C#N)c3ccc(Br)cc3)CC2)n1	ZINC000450659460	GH	On-Demand	Mild	PTAFR	23	40
O=C(CC1(O)CCC1)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659461	EH	On-Demand	Anodyne	MME	71	39
O=C(CC1(O)CCC1)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659461	EH	On-Demand	Anodyne	CPA1	44	36
CCOC(=O)c1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)ncc1Cl	ZINC000450659491	GG	On-Demand	Anodyne	P2RY12	41	37
CCOC(=O)c1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)ncc1Cl	ZINC000450659492	GG	On-Demand	Anodyne	P2RY12	41	37
CCOC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)ncc1Cl	ZINC000450659493	GG	On-Demand	Anodyne	P2RY12	41	37
Cn1c(COc2ccc(Cl)cc2)nnc1SCc1cn(CC2CC2)nn1	ZINC000450659524	GG	On-Demand	Anodyne	VCP	40	39
COc1ccnc(CN[C@@H](C)c2cccc(Cl)c2)n1	ZINC000450659544	CF	On-Demand	Anodyne	CASR	25	42
COc1ccnc(CN[C@H](C)c2cccc(Cl)c2)n1	ZINC000450659545	CF	On-Demand	Anodyne	CASR	25	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(C)ccc2OC)c(OC)c1	ZINC000450659548	GG	On-Demand	Anodyne	MTNR1A	55	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(C)ccc2OC)c(OC)c1	ZINC000450659548	GG	On-Demand	Anodyne	MTNR1B	42	40
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(C)ccc2OC)c(OC)c1	ZINC000450659549	GG	On-Demand	Anodyne	MTNR1A	55	40
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(C)ccc2OC)c(OC)c1	ZINC000450659549	GG	On-Demand	Anodyne	MTNR1B	42	40
COC1(CSc2nnc(-c3ccccc3F)n2C)CCC1	ZINC000450659558	DG	On-Demand	Anodyne	HSD11B1	24	48
CCOC(=O)c1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)ncc1Cl	ZINC000450659586	GG	On-Demand	Anodyne	P2RY12	41	37
COc1cc(-c2noc(CSc3nnc(-c4ccoc4C)n3C)n2)ncn1	ZINC000450659604	GF	On-Demand	Anodyne	WNT3A	21	40
COc1cc(-c2noc(CSc3nnc(-c4ccoc4C)n3C)n2)ncn1	ZINC000450659604	GF	On-Demand	Anodyne	TNKS2	17	41
COc1cc(-c2noc(CSc3nnc(-c4ccoc4C)n3C)n2)ncn1	ZINC000450659604	GF	On-Demand	Anodyne	AXIN2	0	41
Cc1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659634	GH	On-Demand	Bother	CACNA1C	45	33
Cc1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659634	GH	On-Demand	Bother	CACNA1D	69	33
Cc1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659634	GH	On-Demand	Bother	F2RL3	45	34
Cc1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659635	GH	On-Demand	Bother	CACNA1C	45	33
Cc1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659635	GH	On-Demand	Bother	CACNA1D	69	33
Cc1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659635	GH	On-Demand	Bother	F2RL3	45	34
Cc1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659636	GH	On-Demand	Bother	CACNA1C	45	33
Cc1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659636	GH	On-Demand	Bother	CACNA1D	69	33
Cc1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659636	GH	On-Demand	Bother	F2RL3	45	34
Cc1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659637	GH	On-Demand	Bother	CACNA1C	45	33
Cc1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659637	GH	On-Demand	Bother	CACNA1D	69	33
Cc1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450659637	GH	On-Demand	Bother	F2RL3	45	34
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659646	EH	On-Demand	Anodyne	NQO2	33	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659646	EH	On-Demand	Anodyne	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659646	EH	On-Demand	Anodyne	HTR6	31	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659646	EH	On-Demand	Anodyne	MTNR1A	32	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659646	EH	On-Demand	Anodyne	EBP	17	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659647	EH	On-Demand	Anodyne	NQO2	33	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659647	EH	On-Demand	Anodyne	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659647	EH	On-Demand	Anodyne	HTR6	31	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659647	EH	On-Demand	Anodyne	MTNR1A	32	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H]1CC12CCSCC2	ZINC000450659647	EH	On-Demand	Anodyne	EBP	17	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659648	EH	On-Demand	Anodyne	NQO2	33	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659648	EH	On-Demand	Anodyne	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659648	EH	On-Demand	Anodyne	HTR6	31	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659648	EH	On-Demand	Anodyne	MTNR1A	32	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659648	EH	On-Demand	Anodyne	EBP	17	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659649	EH	On-Demand	Anodyne	NQO2	33	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659649	EH	On-Demand	Anodyne	MTR1B_CHICK	0	52
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659649	EH	On-Demand	Anodyne	HTR6	31	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659649	EH	On-Demand	Anodyne	MTNR1A	32	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450659649	EH	On-Demand	Anodyne	EBP	17	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450659650	EG	On-Demand	Anodyne	NQO2	42	52
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450659650	EG	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450659650	EG	On-Demand	Anodyne	HTR6	39	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450659650	EG	On-Demand	Anodyne	PPARD	38	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450659651	EG	On-Demand	Anodyne	NQO2	42	52
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450659651	EG	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450659651	EG	On-Demand	Anodyne	HTR6	39	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450659651	EG	On-Demand	Anodyne	PPARD	38	41
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	DRD4	29	43
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	SIGMAR1	17	41
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	NPY2R	19	40
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	CCR5	16	46
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	JAK1	0	41
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	FAAH	22	48
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	TYK2	43	34
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	CACNA1G	16	42
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	NOD1	31	41
CC(=O)N1CCN(Cc2ccc(NC(=O)c3c(C)cccc3Cl)cc2)CC1	ZINC000450659711	GH	On-Demand	Anodyne	NOD2	46	39
FC(F)(F)c1cc(CNc2ncnc3sc4c(c23)CCC4)ccn1	ZINC000450659724	FI	On-Demand	Anodyne	RBP4	18	46
C[C@@H](Sc1nnc(COc2ccc(Cl)cc2)n1C)C(=O)C1CCOCC1	ZINC000450659729	GH	On-Demand	Anodyne	VCP	50	38
C[C@H](Sc1nnc(COc2ccc(Cl)cc2)n1C)C(=O)C1CCOCC1	ZINC000450659730	GH	On-Demand	Anodyne	VCP	50	38
O=C(c1cc2c([nH]1)CCCC2)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450659764	EH	On-Demand	Anodyne	HRH4	15	47
O=C(c1cc2c([nH]1)CCCC2)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450659765	EH	On-Demand	Anodyne	HRH4	15	47
CCCc1cc(NCc2ccnc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450659773	EG	On-Demand	Anodyne	DHOD	0	51
CC(C)CCCC(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450659783	CG	On-Demand	Anodyne	LUXR	50	34
CC(C)CCCC(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450659784	CG	On-Demand	Anodyne	LUXR	50	34
O=C([C@H]1CCN(c2ccccc2)C1)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450659789	FH	On-Demand	Anodyne	AKR1C3	0	43
O=C([C@H]1CCN(c2ccccc2)C1)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450659790	FH	On-Demand	Anodyne	AKR1C3	0	43
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450659791	FH	On-Demand	Anodyne	AKR1C3	0	43
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450659792	FH	On-Demand	Anodyne	AKR1C3	0	43
Cc1occc1-c1nnc(SCC(=O)CC(C)(C)C2CC2)n1C	ZINC000450659793	EH	On-Demand	Anodyne	HCRTR2	0	41
COC(=O)[C@@]1(NCCC(=O)NCc2ccc(OC)cc2OC)CCOC1	ZINC000450659800	FC	On-Demand	Anodyne	MTNR1A	49	37
COC(=O)[C@]1(NCCC(=O)NCc2ccc(OC)cc2OC)CCOC1	ZINC000450659801	FC	On-Demand	Anodyne	MTNR1A	49	37
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450659810	GF	On-Demand	Bother	CACNA1C	63	37
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450659810	GF	On-Demand	Bother	CACNA1D	95	37
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450659811	GF	On-Demand	Bother	CACNA1C	63	37
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450659811	GF	On-Demand	Bother	CACNA1D	95	37
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450659812	GF	On-Demand	Bother	CACNA1C	63	37
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450659812	GF	On-Demand	Bother	CACNA1D	95	37
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450659813	GF	On-Demand	Bother	CACNA1C	63	37
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450659813	GF	On-Demand	Bother	CACNA1D	95	37
COc1ccc(CNC(=O)CCN2CCN(C)CC2(C)C)c(OC)c1	ZINC000450659814	ED	On-Demand	Anodyne	MTNR1A	55	39
COCCn1c(NC(=O)C2CC(C)(O)C2)nc2ccccc21	ZINC000450659817	DD	On-Demand	Anodyne	HRH1	20	45
O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450659819	GI	On-Demand	Anodyne	DRD4	24	43
O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450659819	GI	On-Demand	Anodyne	SIGMAR1	22	45
O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450659819	GI	On-Demand	Anodyne	PA	28	41
O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450659820	GI	On-Demand	Anodyne	DRD4	24	43
O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450659820	GI	On-Demand	Anodyne	SIGMAR1	22	45
O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450659820	GI	On-Demand	Anodyne	PA	28	41
COc1ccc2c(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)ncnc2c1F	ZINC000450659829	FG	On-Demand	Anodyne	PDE3B	53	34
COc1ccc2c(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)ncnc2c1F	ZINC000450659830	FG	On-Demand	Anodyne	PDE3B	53	34
COc1ccc2c(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)ncnc2c1F	ZINC000450659831	FG	On-Demand	Anodyne	PDE3B	53	34
COc1ccc2c(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)ncnc2c1F	ZINC000450659832	FG	On-Demand	Anodyne	PDE3B	53	34
OC[C@@]1(F)CN(c2nc(-c3cccc(Cl)c3)no2)C[C@@H]1c1ccccc1	ZINC000450659851	FH	On-Demand	Anodyne	GRM5	26	46
OC[C@@]1(F)CN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1c1ccccc1	ZINC000450659852	FH	On-Demand	Anodyne	GRM5	26	46
OC[C@]1(F)CN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1c1ccccc1	ZINC000450659853	FH	On-Demand	Anodyne	GRM5	26	46
OC[C@]1(F)CN(c2nc(-c3cccc(Cl)c3)no2)C[C@@H]1c1ccccc1	ZINC000450659854	FH	On-Demand	Anodyne	GRM5	26	46
COCCn1c(NC(=O)C2(C(=O)C3CC3)CC2)nc2ccccc21	ZINC000450659859	EE	On-Demand	Anodyne	HRH1	42	35
C[C@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659871	EH	On-Demand	Mild	MME	76	37
C[C@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659871	EH	On-Demand	Mild	PAPA1_CARPA	46	42
C[C@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659871	EH	On-Demand	Mild	CTSL	28	42
C[C@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659871	EH	On-Demand	Mild	CTSS	18	40
C[C@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659871	EH	On-Demand	Mild	CTSC	48	37
C[C@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659872	EH	On-Demand	Mild	MME	76	37
C[C@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659872	EH	On-Demand	Mild	PAPA1_CARPA	46	42
C[C@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659872	EH	On-Demand	Mild	CTSL	28	42
C[C@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659872	EH	On-Demand	Mild	CTSS	18	40
C[C@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659872	EH	On-Demand	Mild	CTSC	48	37
C[C@@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659873	EH	On-Demand	Mild	MME	76	37
C[C@@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659873	EH	On-Demand	Mild	PAPA1_CARPA	46	42
C[C@@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659873	EH	On-Demand	Mild	CTSL	28	42
C[C@@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659873	EH	On-Demand	Mild	CTSS	18	40
C[C@@H]1C[C@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659873	EH	On-Demand	Mild	CTSC	48	37
C[C@@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659874	EH	On-Demand	Mild	MME	76	37
C[C@@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659874	EH	On-Demand	Mild	PAPA1_CARPA	46	42
C[C@@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659874	EH	On-Demand	Mild	CTSL	28	42
C[C@@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659874	EH	On-Demand	Mild	CTSS	18	40
C[C@@H]1C[C@@]1(C#N)C(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450659874	EH	On-Demand	Mild	CTSC	48	37
CC(C)OC(=O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450659887	GI	On-Demand	Anodyne	MC4R	28	40
CCOc1c(Cl)cc(NC(=O)c2c(C3CC3)noc2C)cc1Cl	ZINC000450659975	FJ	On-Demand	Anodyne	TYK2	44	36
N#Cc1cc(C(F)(F)F)ccc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450660033	FH	On-Demand	Mild	LIPG	45	34
N#Cc1cc(C(F)(F)F)ccc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450660034	FH	On-Demand	Mild	LIPG	45	34
N#Cc1cc(C(F)(F)F)ccc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450660035	FH	On-Demand	Mild	LIPG	45	34
N#Cc1cc(C(F)(F)F)ccc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450660036	FH	On-Demand	Mild	LIPG	45	34
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450660037	EH	On-Demand	Anodyne	ADRB3	18	49
CC[C@@H]1[C@H](CO)CCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450660038	EH	On-Demand	Anodyne	ADRB3	18	49
CC[C@H]1[C@H](CO)CCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450660039	EH	On-Demand	Anodyne	ADRB3	18	49
CC[C@H]1[C@@H](CO)CCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450660040	EH	On-Demand	Anodyne	ADRB3	18	49
COc1cc(CNC(C)(C)C(=O)NCC(C)(C)C)ccc1Cl	ZINC000450660075	EG	On-Demand	Anodyne	TRPV1	39	46
COc1cc(CNC(C)(C)C(=O)NCC(C)(C)C)ccc1Cl	ZINC000450660075	EG	On-Demand	Anodyne	PDE6A	41	32
Cc1cccc(Cl)c1CSc1nnc(-c2ccoc2C)n1C	ZINC000450660106	EJ	On-Demand	Anodyne	HCRTR2	0	42
COc1ccc(CNC(=O)CCN[C@H](c2cccs2)C2CC2)c(OC)c1	ZINC000450660117	FH	On-Demand	Anodyne	MTNR1A	53	36
COc1ccc(CNC(=O)CCN[C@H](c2cccs2)C2CC2)c(OC)c1	ZINC000450660117	FH	On-Demand	Anodyne	MTNR1B	43	33
COc1ccc(CNC(=O)CCN[C@@H](c2cccs2)C2CC2)c(OC)c1	ZINC000450660118	FH	On-Demand	Anodyne	MTNR1A	53	36
COc1ccc(CNC(=O)CCN[C@@H](c2cccs2)C2CC2)c(OC)c1	ZINC000450660118	FH	On-Demand	Anodyne	MTNR1B	43	33
Cc1ccn2ncc(C(=O)N3CCO[C@@H](c4cccc(Cl)c4)C3)c2c1	ZINC000450660125	FH	On-Demand	Anodyne	EPHB3	26	43
Cc1ccn2ncc(C(=O)N3CCO[C@H](c4cccc(Cl)c4)C3)c2c1	ZINC000450660126	FH	On-Demand	Anodyne	EPHB3	26	43
CN(C)C(=O)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C(C)(C)C1	ZINC000450660141	GG	On-Demand	Anodyne	RBP4	81	38
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000450660160	CF	On-Demand	Anodyne	PHES	0	42
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000450660160	CF	On-Demand	Anodyne	PDS	40	35
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000450660161	CF	On-Demand	Anodyne	PHES	0	42
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000450660161	CF	On-Demand	Anodyne	PDS	40	35
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000450660162	CF	On-Demand	Anodyne	PHES	0	42
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000450660162	CF	On-Demand	Anodyne	PDS	40	35
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000450660163	CF	On-Demand	Anodyne	PHES	0	42
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000450660163	CF	On-Demand	Anodyne	PDS	40	35
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccnc1	ZINC000450660174	CF	On-Demand	Anodyne	TBXAS1	0	41
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccnc1	ZINC000450660174	CF	On-Demand	Anodyne	KCNA5	27	43
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccnc1	ZINC000450660175	CF	On-Demand	Anodyne	TBXAS1	0	41
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccnc1	ZINC000450660175	CF	On-Demand	Anodyne	KCNA5	27	43
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccnc1	ZINC000450660176	CF	On-Demand	Anodyne	TBXAS1	0	41
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccnc1	ZINC000450660176	CF	On-Demand	Anodyne	KCNA5	27	43
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccnc1	ZINC000450660177	CF	On-Demand	Anodyne	TBXAS1	0	41
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccnc1	ZINC000450660177	CF	On-Demand	Anodyne	KCNA5	27	43
COc1cc(CC(=O)N2CCN(C(=O)N(C)C)CC2(C)C)ccc1O	ZINC000450660192	ED	On-Demand	Anodyne	RORC	40	32
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CCCN(C)C)CC1	ZINC000450660248	DG	On-Demand	Anodyne	SLC6A3	17	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CCCN(C)C)CC1	ZINC000450660250	DG	On-Demand	Anodyne	SLC6A3	17	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CCCN(C)C)CC1	ZINC000450660252	DG	On-Demand	Anodyne	SLC6A3	17	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CCCN(C)C)CC1	ZINC000450660254	DG	On-Demand	Anodyne	SLC6A3	17	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@@H](OC(C)C)C1(C)C	ZINC000450660266	DF	On-Demand	Anodyne	MME	43	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@@H](OC(C)C)C1(C)C	ZINC000450660266	DF	On-Demand	Anodyne	AMP1_PLAFQ	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@@H](OC(C)C)C1(C)C	ZINC000450660266	DF	On-Demand	Anodyne	PSMB8	48	31
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1C[C@H](OC(C)C)C1(C)C	ZINC000450660267	DF	On-Demand	Anodyne	MME	43	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1C[C@H](OC(C)C)C1(C)C	ZINC000450660267	DF	On-Demand	Anodyne	AMP1_PLAFQ	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1C[C@H](OC(C)C)C1(C)C	ZINC000450660267	DF	On-Demand	Anodyne	PSMB8	48	31
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1C[C@@H](OC(C)C)C1(C)C	ZINC000450660268	DF	On-Demand	Anodyne	MME	43	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1C[C@@H](OC(C)C)C1(C)C	ZINC000450660268	DF	On-Demand	Anodyne	AMP1_PLAFQ	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1C[C@@H](OC(C)C)C1(C)C	ZINC000450660268	DF	On-Demand	Anodyne	PSMB8	48	31
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@H](OC(C)C)C1(C)C	ZINC000450660269	DF	On-Demand	Anodyne	MME	43	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@H](OC(C)C)C1(C)C	ZINC000450660269	DF	On-Demand	Anodyne	AMP1_PLAFQ	44	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1C[C@H](OC(C)C)C1(C)C	ZINC000450660269	DF	On-Demand	Anodyne	PSMB8	48	31
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660278	FE	On-Demand	Anodyne	NQO2	37	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660278	FE	On-Demand	Anodyne	HTR6	27	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660278	FE	On-Demand	Anodyne	PPARD	44	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660278	FE	On-Demand	Anodyne	MTNR1A	19	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660278	FE	On-Demand	Anodyne	EBP	15	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660282	FE	On-Demand	Anodyne	NQO2	37	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660282	FE	On-Demand	Anodyne	HTR6	27	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660282	FE	On-Demand	Anodyne	PPARD	44	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660282	FE	On-Demand	Anodyne	MTNR1A	19	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450660282	FE	On-Demand	Anodyne	EBP	15	42
COC(=O)[C@@H](CC(C)C)N(C)c1ncccc1[N+](=O)[O-]	ZINC000450660296	CE	On-Demand	Bother	COLA	79	36
COC(=O)[C@H](CC(C)C)N(C)c1ncccc1[N+](=O)[O-]	ZINC000450660297	CE	On-Demand	Bother	COLA	79	36
CC[C@@H]1[C@H](CO)CCN1c1ncnc2[nH]ccc12	ZINC000450660298	BD	On-Demand	Anodyne	JAK1	50	33
CC[C@@H]1[C@H](CO)CCN1c1ncnc2[nH]ccc12	ZINC000450660298	BD	On-Demand	Anodyne	AKT1	33	40
CC[C@H]1[C@@H](CO)CCN1c1ncnc2[nH]ccc12	ZINC000450660300	BD	On-Demand	Anodyne	JAK1	50	33
CC[C@H]1[C@@H](CO)CCN1c1ncnc2[nH]ccc12	ZINC000450660300	BD	On-Demand	Anodyne	AKT1	33	40
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2[nH]ccc12	ZINC000450660302	BD	On-Demand	Anodyne	JAK1	50	33
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2[nH]ccc12	ZINC000450660302	BD	On-Demand	Anodyne	AKT1	33	40
CC[C@H]1[C@H](CO)CCN1c1ncnc2[nH]ccc12	ZINC000450660304	BD	On-Demand	Anodyne	JAK1	50	33
CC[C@H]1[C@H](CO)CCN1c1ncnc2[nH]ccc12	ZINC000450660304	BD	On-Demand	Anodyne	AKT1	33	40
O=[N+]([O-])c1ccc2nc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)[nH]c2c1	ZINC000450660311	FF	On-Demand	Bother	CACNA1C	48	34
O=[N+]([O-])c1ccc2nc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)[nH]c2c1	ZINC000450660311	FF	On-Demand	Bother	CACNA1D	81	34
O=[N+]([O-])c1ccc2nc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)[nH]c2c1	ZINC000450660312	FF	On-Demand	Bother	CACNA1C	48	34
O=[N+]([O-])c1ccc2nc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)[nH]c2c1	ZINC000450660312	FF	On-Demand	Bother	CACNA1D	81	34
O=[N+]([O-])c1ccc2nc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)[nH]c2c1	ZINC000450660313	FF	On-Demand	Bother	CACNA1C	48	34
O=[N+]([O-])c1ccc2nc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)[nH]c2c1	ZINC000450660313	FF	On-Demand	Bother	CACNA1D	81	34
O=[N+]([O-])c1ccc2nc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)[nH]c2c1	ZINC000450660314	FF	On-Demand	Bother	CACNA1C	48	34
O=[N+]([O-])c1ccc2nc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)[nH]c2c1	ZINC000450660314	FF	On-Demand	Bother	CACNA1D	81	34
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)CCO2	ZINC000450660318	GH	On-Demand	Anodyne	LUXR	59	41
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)CCO2	ZINC000450660318	GH	On-Demand	Anodyne	TRAR	62	35
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)CCO2	ZINC000450660318	GH	On-Demand	Anodyne	PHZR	0	40
CC[C@H](C)Oc1cc(CNC(=O)c2ccc(N3CCC3)nc2)ccn1	ZINC000450660352	EF	On-Demand	Anodyne	HPGDS	17	41
CC[C@@H](C)Oc1cc(CNC(=O)c2ccc(N3CCC3)nc2)ccn1	ZINC000450660353	EF	On-Demand	Anodyne	HPGDS	17	41
CCc1cc(N[C@@H](CC)CNS(C)(=O)=O)n2ncnc2n1	ZINC000450660358	DC	On-Demand	Anodyne	DHOD	0	47
CCc1cc(N[C@H](CC)CNS(C)(=O)=O)n2ncnc2n1	ZINC000450660359	DC	On-Demand	Anodyne	DHOD	0	47
COc1cc([C@H](C)NCc2ccn(C)n2)ccc1OC1CCCC1	ZINC000450660363	EH	On-Demand	Anodyne	PDE4A	45	43
COc1cc([C@H](C)NCc2ccn(C)n2)ccc1OC1CCCC1	ZINC000450660363	EH	On-Demand	Anodyne	PDE4B	31	41
COc1cc([C@H](C)NCc2ccn(C)n2)ccc1OC1CCCC1	ZINC000450660363	EH	On-Demand	Anodyne	PDE4D	23	40
COc1cc([C@@H](C)NCc2ccn(C)n2)ccc1OC1CCCC1	ZINC000450660364	EH	On-Demand	Anodyne	PDE4A	45	43
COc1cc([C@@H](C)NCc2ccn(C)n2)ccc1OC1CCCC1	ZINC000450660364	EH	On-Demand	Anodyne	PDE4B	31	41
COc1cc([C@@H](C)NCc2ccn(C)n2)ccc1OC1CCCC1	ZINC000450660364	EH	On-Demand	Anodyne	PDE4D	23	40
Cc1cccc(Cl)c1CSc1nnc(C2CC2)n1Cc1ccco1	ZINC000450660375	FK	On-Demand	Anodyne	HCRTR2	17	42
CC[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450660382	FI	On-Demand	Anodyne	HCN1	44	34
CC[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450660382	FI	On-Demand	Anodyne	HCN4	44	35
CC[C@@H](NC[C@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450660383	FI	On-Demand	Anodyne	HCN1	44	34
CC[C@@H](NC[C@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450660383	FI	On-Demand	Anodyne	HCN4	44	35
CC[C@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450660384	FI	On-Demand	Anodyne	HCN1	44	34
CC[C@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450660384	FI	On-Demand	Anodyne	HCN4	44	35
CC[C@H](NC[C@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450660385	FI	On-Demand	Anodyne	HCN1	44	34
CC[C@H](NC[C@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450660385	FI	On-Demand	Anodyne	HCN4	44	35
C/C=C\COc1cccc(CC(=O)NCC(F)(F)CO)c1	ZINC000450660386	CD	On-Demand	Anodyne	PDS	49	34
C/C=C/COc1cccc(CC(=O)NCC(F)(F)CO)c1	ZINC000450660387	CD	On-Demand	Anodyne	PDS	49	34
CS(=O)(=O)c1ccc(N[C@H]2CCCC[C@H]2CC(F)(F)F)nc1	ZINC000450660425	EG	On-Demand	Anodyne	PTK2	0	41
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(COc3ccc(Cl)cc3)n2C)C1	ZINC000450660438	FH	On-Demand	Anodyne	VCP	53	41
C[C@@H]1CCC(=O)[C@H](Sc2nnc(COc3ccc(Cl)cc3)n2C)C1	ZINC000450660439	FH	On-Demand	Anodyne	VCP	53	41
C[C@H]1CCC(=O)[C@@H](Sc2nnc(COc3ccc(Cl)cc3)n2C)C1	ZINC000450660440	FH	On-Demand	Anodyne	VCP	53	41
C[C@H]1CCC(=O)[C@H](Sc2nnc(COc3ccc(Cl)cc3)n2C)C1	ZINC000450660441	FH	On-Demand	Anodyne	VCP	53	41
CC[C@@H](NCC1(C#N)CCC1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450660498	FG	On-Demand	Mild	HCN1	54	34
CC[C@@H](NCC1(C#N)CCC1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450660498	FG	On-Demand	Mild	HCN4	52	34
CC[C@H](NCC1(C#N)CCC1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450660499	FG	On-Demand	Mild	HCN1	54	34
CC[C@H](NCC1(C#N)CCC1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450660499	FG	On-Demand	Mild	HCN4	52	34
COc1cc([C@H](C)NCCc2cscn2)ccc1OCc1ccccc1	ZINC000450660506	FJ	On-Demand	Anodyne	GPR142	37	43
COc1cc([C@@H](C)NCCc2cscn2)ccc1OCc1ccccc1	ZINC000450660507	FJ	On-Demand	Anodyne	GPR142	37	43
COc1cc([C@@H](C)N[C@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660510	EI	On-Demand	Anodyne	PDE4A	43	43
COc1cc([C@@H](C)N[C@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660510	EI	On-Demand	Anodyne	PDE4B	23	45
COc1cc([C@@H](C)N[C@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660510	EI	On-Demand	Anodyne	PDE4D	18	42
COc1cc([C@@H](C)N[C@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660510	EI	On-Demand	Anodyne	PDE4C	15	42
COc1cc([C@@H](C)N[C@@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660511	EI	On-Demand	Anodyne	PDE4A	43	43
COc1cc([C@@H](C)N[C@@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660511	EI	On-Demand	Anodyne	PDE4B	23	45
COc1cc([C@@H](C)N[C@@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660511	EI	On-Demand	Anodyne	PDE4D	18	42
COc1cc([C@@H](C)N[C@@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660511	EI	On-Demand	Anodyne	PDE4C	15	42
COc1cc([C@H](C)N[C@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660512	EI	On-Demand	Anodyne	PDE4A	43	43
COc1cc([C@H](C)N[C@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660512	EI	On-Demand	Anodyne	PDE4B	23	45
COc1cc([C@H](C)N[C@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660512	EI	On-Demand	Anodyne	PDE4D	18	42
COc1cc([C@H](C)N[C@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660512	EI	On-Demand	Anodyne	PDE4C	15	42
COc1cc([C@H](C)N[C@@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660513	EI	On-Demand	Anodyne	PDE4A	43	43
COc1cc([C@H](C)N[C@@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660513	EI	On-Demand	Anodyne	PDE4B	23	45
COc1cc([C@H](C)N[C@@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660513	EI	On-Demand	Anodyne	PDE4D	18	42
COc1cc([C@H](C)N[C@@H](C)c2csnn2)ccc1OC1CCCC1	ZINC000450660513	EI	On-Demand	Anodyne	PDE4C	15	42
CCC[C@@H](O)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660544	DH	On-Demand	Anodyne	PDE4A	40	41
CCC[C@@H](O)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660544	DH	On-Demand	Anodyne	PDE4B	22	42
CCC[C@@H](O)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660544	DH	On-Demand	Anodyne	PDE4D	18	42
CCC[C@@H](O)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660544	DH	On-Demand	Anodyne	PDE4C	15	40
CCC[C@@H](O)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660545	DH	On-Demand	Anodyne	PDE4A	40	41
CCC[C@@H](O)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660545	DH	On-Demand	Anodyne	PDE4B	22	42
CCC[C@@H](O)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660545	DH	On-Demand	Anodyne	PDE4D	18	42
CCC[C@@H](O)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660545	DH	On-Demand	Anodyne	PDE4C	15	40
CCC[C@H](O)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660546	DH	On-Demand	Anodyne	PDE4A	40	41
CCC[C@H](O)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660546	DH	On-Demand	Anodyne	PDE4B	22	42
CCC[C@H](O)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660546	DH	On-Demand	Anodyne	PDE4D	18	42
CCC[C@H](O)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660546	DH	On-Demand	Anodyne	PDE4C	15	40
CCC[C@H](O)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660547	DH	On-Demand	Anodyne	PDE4A	40	41
CCC[C@H](O)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660547	DH	On-Demand	Anodyne	PDE4B	22	42
CCC[C@H](O)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660547	DH	On-Demand	Anodyne	PDE4D	18	42
CCC[C@H](O)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000450660547	DH	On-Demand	Anodyne	PDE4C	15	40
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)CCO2	ZINC000450660550	GH	On-Demand	Anodyne	MTNR1A	44	40
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)CCO2	ZINC000450660550	GH	On-Demand	Anodyne	MTNR1B	31	40
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)CCO2	ZINC000450660550	GH	On-Demand	Anodyne	LUXR	55	35
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)CCO2	ZINC000450660550	GH	On-Demand	Anodyne	TRAR	65	38
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(OC)c(OC)c1Cl)CCO2	ZINC000450660550	GH	On-Demand	Anodyne	LASR	45	33
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC(F)(F)CO)cc2)c1	ZINC000450660566	FE	On-Demand	Anodyne	PPARD	16	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC(F)(F)CO)cc2)c1	ZINC000450660566	FE	On-Demand	Anodyne	KCNK3	44	37
COc1cc(CC(=O)N2CCN(C(=O)C3CC3)CC2(C)C)ccc1Cl	ZINC000450660582	FF	On-Demand	Anodyne	OPRK1	41	39
CC[C@@H](C)Oc1cc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)ccn1	ZINC000450660592	GG	On-Demand	Anodyne	F7	18	40
CC[C@@H](C)Oc1cc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)ccn1	ZINC000450660592	GG	On-Demand	Anodyne	PDS	51	37
CC[C@H](C)Oc1cc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)ccn1	ZINC000450660593	GG	On-Demand	Anodyne	F7	18	40
CC[C@H](C)Oc1cc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)ccn1	ZINC000450660593	GG	On-Demand	Anodyne	PDS	51	37
COc1ccc2c(c1)[C@@H](NC(=O)C1(CF)CCOCC1)CCO2	ZINC000450660595	DE	On-Demand	Anodyne	TRAR	51	32
COC(=O)C1(NCc2nc(-c3ccc(OC)nn3)no2)CCCCCC1	ZINC000450660614	FD	On-Demand	Anodyne	NPPA	50	42
CC(C)(CC(=O)CSc1nnc(C2CC2)n1Cc1ccco1)C1CC1	ZINC000450660617	FI	On-Demand	Anodyne	HCRTR2	22	42
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2c(OC)cc(OC)cc12	ZINC000450660653	DE	On-Demand	Anodyne	PDE3B	55	33
CC[C@H]1[C@H](CO)CCN1c1ncnc2c(OC)cc(OC)cc12	ZINC000450660654	DE	On-Demand	Anodyne	PDE3B	55	33
CC[C@H]1[C@@H](CO)CCN1c1ncnc2c(OC)cc(OC)cc12	ZINC000450660655	DE	On-Demand	Anodyne	PDE3B	55	33
CC[C@@H]1[C@H](CO)CCN1c1ncnc2c(OC)cc(OC)cc12	ZINC000450660656	DE	On-Demand	Anodyne	PDE3B	55	33
OC[C@]1(F)CN(c2ncc(C(F)(F)F)s2)C[C@@H]1c1ccccc1	ZINC000450660685	EG	On-Demand	Anodyne	MLYCD	37	43
OC[C@@]1(F)CN(c2ncc(C(F)(F)F)s2)C[C@H]1c1ccccc1	ZINC000450660686	EG	On-Demand	Anodyne	MLYCD	37	43
OC[C@@]1(F)CN(c2ncc(C(F)(F)F)s2)C[C@@H]1c1ccccc1	ZINC000450660687	EG	On-Demand	Anodyne	MLYCD	37	43
OC[C@]1(F)CN(c2ncc(C(F)(F)F)s2)C[C@H]1c1ccccc1	ZINC000450660688	EG	On-Demand	Anodyne	MLYCD	37	43
CC(C)NC(=O)c1ccc(NCc2ccnc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450660695	GH	On-Demand	Bother	TAAR1	16	44
CC(C)OC(C)(C)C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450660702	EG	On-Demand	Anodyne	MDM2	67	33
CC(C)OC(C)(C)C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450660703	EG	On-Demand	Anodyne	MDM2	67	33
COC(=O)c1ccc(CN[C@@H](CN2CCOCC2)c2ccccc2)cc1Cl	ZINC000450660732	GG	On-Demand	Anodyne	CASR	48	38
COC(=O)c1ccc(CN[C@H](CN2CCOCC2)c2ccccc2)cc1Cl	ZINC000450660733	GG	On-Demand	Anodyne	CASR	48	38
Cc1occc1-c1nnc(SC[C@@H]2CCCC2(F)F)n1C	ZINC000450660737	DH	On-Demand	Anodyne	DRD3	46	35
Cc1occc1-c1nnc(SC[C@H]2CCCC2(F)F)n1C	ZINC000450660738	DH	On-Demand	Anodyne	DRD3	46	35
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc2ccccc12	ZINC000450660742	CF	On-Demand	Anodyne	KCNJ11	42	30
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc2ccccc12	ZINC000450660743	CF	On-Demand	Anodyne	KCNJ11	42	30
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc2ccccc12	ZINC000450660744	CF	On-Demand	Anodyne	KCNJ11	42	30
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc2ccccc12	ZINC000450660745	CF	On-Demand	Anodyne	KCNJ11	42	30
COC(=O)c1ccc(CN[C@H](C)c2ccc3c(c2)OCCO3)cc1Cl	ZINC000450660759	FH	On-Demand	Anodyne	PDE10A	23	41
COC(=O)c1ccc(CN[C@@H](C)c2ccc3c(c2)OCCO3)cc1Cl	ZINC000450660760	FH	On-Demand	Anodyne	PDE10A	23	41
CC[C@H]1CCC[C@H]1CNc1ccc(C(=O)NCCOC)cn1	ZINC000450660771	DE	On-Demand	Anodyne	IKBKB	22	43
CC[C@@H]1CCC[C@H]1CNc1ccc(C(=O)NCCOC)cn1	ZINC000450660772	DE	On-Demand	Anodyne	IKBKB	22	43
CC[C@H]1CCC[C@@H]1CNc1ccc(C(=O)NCCOC)cn1	ZINC000450660773	DE	On-Demand	Anodyne	IKBKB	22	43
CC[C@@H]1CCC[C@@H]1CNc1ccc(C(=O)NCCOC)cn1	ZINC000450660774	DE	On-Demand	Anodyne	IKBKB	22	43
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)CCO2	ZINC000450660803	EF	On-Demand	Anodyne	TRPV1	35	43
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)CCO2	ZINC000450660803	EF	On-Demand	Anodyne	PHZR	0	45
CC(=O)CCCCCSc1nnc(-c2ccoc2C)o1	ZINC000450660821	CH	On-Demand	Anodyne	ALOX15	46	31
Cc1cccc(Cl)c1CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450660824	EJ	On-Demand	Anodyne	EPHX2	16	44
Cc1cccc(Cl)c1CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450660825	EJ	On-Demand	Anodyne	EPHX2	16	44
CC[S@](=O)CC(=O)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450660834	EG	On-Demand	Anodyne	FFAR2	43	32
CC[S@@](=O)CC(=O)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450660835	EG	On-Demand	Anodyne	FFAR2	43	32
CC[S@](=O)CC(=O)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450660836	EG	On-Demand	Anodyne	FFAR2	43	32
CC[S@@](=O)CC(=O)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450660837	EG	On-Demand	Anodyne	FFAR2	43	32
CCCNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450660841	GI	On-Demand	Anodyne	MPL	20	42
CCCNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450660841	GI	On-Demand	Anodyne	SCD1	21	44
CCCNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450660841	GI	On-Demand	Anodyne	SCD	15	44
CCCNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450660841	GI	On-Demand	Anodyne	HPGDS	32	43
CC[C@H](NCc1cn(CC2CC2)nn1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450660847	GF	On-Demand	Anodyne	HCN1	40	31
CC[C@H](NCc1cn(CC2CC2)nn1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450660847	GF	On-Demand	Anodyne	HCN4	40	31
CC[C@@H](NCc1cn(CC2CC2)nn1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450660848	GF	On-Demand	Anodyne	HCN1	40	31
CC[C@@H](NCc1cn(CC2CC2)nn1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450660848	GF	On-Demand	Anodyne	HCN4	40	31
COc1ccc2c(c1)[C@@H](NC(=O)c1cccc(SC)c1)CCO2	ZINC000450660850	EH	On-Demand	Anodyne	NAAA	16	47
Cc1ccc2ncnc(N3CCC(c4nc(C(F)(F)F)cs4)CC3)c2c1	ZINC000450660863	GJ	On-Demand	Anodyne	PDE3A	45	35
Cc1ccc2ncnc(N3CCC(c4nc(C(F)(F)F)cs4)CC3)c2c1	ZINC000450660863	GJ	On-Demand	Anodyne	PDE3B	66	34
Cc1ccc2ncnc(N3CCC(c4nc(C(F)(F)F)cs4)CC3)c2c1	ZINC000450660863	GJ	On-Demand	Anodyne	SIRT3	51	32
Cc1ccc2ncnc(N3CCC(c4nc(C(F)(F)F)cs4)CC3)c2c1	ZINC000450660863	GJ	On-Demand	Anodyne	SIRT2	44	32
Cc1ccc2ncnc(N3CCC(c4nc(C(F)(F)F)cs4)CC3)c2c1	ZINC000450660863	GJ	On-Demand	Anodyne	SIRT1	40	32
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(Oc2ccccc2)c(F)c1	ZINC000450660865	EH	On-Demand	Anodyne	TSPO	51	34
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(Oc2ccccc2)c(F)c1	ZINC000450660866	EH	On-Demand	Anodyne	TSPO	51	34
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(Oc2ccccc2)c(F)c1	ZINC000450660867	EH	On-Demand	Anodyne	TSPO	51	34
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(Oc2ccccc2)c(F)c1	ZINC000450660868	EH	On-Demand	Anodyne	TSPO	51	34
OCC[C@@H](Nc1ccnc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1	ZINC000450660871	FJ	On-Demand	Anodyne	PHES	0	40
OCC[C@H](Nc1ccnc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1	ZINC000450660872	FJ	On-Demand	Anodyne	PHES	0	40
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450660923	EG	On-Demand	Anodyne	AKR1C3	0	40
CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450660924	EG	On-Demand	Anodyne	AKR1C3	0	40
COCCn1c(NC(=O)[C@H]2CCCCC2(F)F)nc2ccccc21	ZINC000450660942	EG	On-Demand	Anodyne	ITK	37	42
COCCn1c(NC(=O)[C@@H]2CCCCC2(F)F)nc2ccccc21	ZINC000450660943	EG	On-Demand	Anodyne	ITK	37	42
COc1ccc(CNC(=O)CCN(C)CC2CCOCC2)c(OC)c1	ZINC000450660962	FE	On-Demand	Anodyne	MTNR1A	62	39
COc1ccc(CNC(=O)CCN(C)CC2CCOCC2)c(OC)c1	ZINC000450660962	FE	On-Demand	Anodyne	MTNR1B	49	35
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450660969	CF	On-Demand	Mild	NQO2	36	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450660969	CF	On-Demand	Mild	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450660969	CF	On-Demand	Mild	HTR6	42	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450660969	CF	On-Demand	Mild	PPARD	43	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450660969	CF	On-Demand	Mild	EBP	19	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450660970	CF	On-Demand	Mild	NQO2	36	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450660970	CF	On-Demand	Mild	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450660970	CF	On-Demand	Mild	HTR6	42	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450660970	CF	On-Demand	Mild	PPARD	43	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450660970	CF	On-Demand	Mild	EBP	19	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450660971	CF	On-Demand	Mild	NQO2	36	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450660971	CF	On-Demand	Mild	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450660971	CF	On-Demand	Mild	HTR6	42	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450660971	CF	On-Demand	Mild	PPARD	43	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450660971	CF	On-Demand	Mild	EBP	19	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450660972	CF	On-Demand	Mild	NQO2	36	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450660972	CF	On-Demand	Mild	MTR1B_CHICK	0	54
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450660972	CF	On-Demand	Mild	HTR6	42	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450660972	CF	On-Demand	Mild	PPARD	43	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450660972	CF	On-Demand	Mild	EBP	19	45
CC[C@H]1[C@@H](CO)CCN1c1ncnc2scc(-c3ccc(OC)cc3)c12	ZINC000450660980	FH	On-Demand	Anodyne	ADRB2	17	46
CC[C@H]1[C@@H](CO)CCN1c1ncnc2scc(-c3ccc(OC)cc3)c12	ZINC000450660980	FH	On-Demand	Anodyne	ADRB3	15	52
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2scc(-c3ccc(OC)cc3)c12	ZINC000450660981	FH	On-Demand	Anodyne	ADRB2	17	46
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2scc(-c3ccc(OC)cc3)c12	ZINC000450660981	FH	On-Demand	Anodyne	ADRB3	15	52
CC[C@@H]1[C@H](CO)CCN1c1ncnc2scc(-c3ccc(OC)cc3)c12	ZINC000450660982	FH	On-Demand	Anodyne	ADRB2	17	46
CC[C@@H]1[C@H](CO)CCN1c1ncnc2scc(-c3ccc(OC)cc3)c12	ZINC000450660982	FH	On-Demand	Anodyne	ADRB3	15	52
CC[C@H]1[C@H](CO)CCN1c1ncnc2scc(-c3ccc(OC)cc3)c12	ZINC000450660983	FH	On-Demand	Anodyne	ADRB2	17	46
CC[C@H]1[C@H](CO)CCN1c1ncnc2scc(-c3ccc(OC)cc3)c12	ZINC000450660983	FH	On-Demand	Anodyne	ADRB3	15	52
CC[C@@H]1C[C@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450660987	CF	On-Demand	Anodyne	HRH1	0	45
CC[C@@H]1C[C@H]1C(=O)Nc1nc2ccccc2n1CCOC	ZINC000450660987	CF	On-Demand	Anodyne	ADAM17	23	41
CC[C@H]1[C@@H](CO)CCN1c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450660991	GH	On-Demand	Bother	TAAR1	27	45
CC[C@@H]1[C@H](CO)CCN1c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450660992	GH	On-Demand	Bother	TAAR1	27	45
CC[C@@H]1[C@@H](CO)CCN1c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450660993	GH	On-Demand	Bother	TAAR1	27	45
CC(=O)CCCCCSc1nnc(-c2ccoc2C)n1C	ZINC000450660996	DH	On-Demand	Anodyne	DRD3	49	35
C[C@@H](Sc1nnc(COc2ccccc2Cl)n1C)C(=O)C1CCCCC1	ZINC000450661012	GJ	On-Demand	Anodyne	VCP	48	36
C[C@H](Sc1nnc(COc2ccccc2Cl)n1C)C(=O)C1CCCCC1	ZINC000450661013	GJ	On-Demand	Anodyne	VCP	48	36
CCOc1c(Cl)cc(NC(=O)c2cc3n(n2)CCCC3)cc1Cl	ZINC000450661037	FI	On-Demand	Anodyne	TYK2	45	35
CCOc1c(Cl)cc(NC(=O)c2cc3n(n2)CCCC3)cc1Cl	ZINC000450661037	FI	On-Demand	Anodyne	NOD2	40	38
COC(=O)C1(CSc2nnc(COc3ccc(Cl)cc3)n2C)CCCC1	ZINC000450661053	GH	On-Demand	Anodyne	VCP	57	39
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)c(F)c2)c(OC)c1	ZINC000450661062	GG	On-Demand	Anodyne	TRPV1	67	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)c(F)c2)c(OC)c1	ZINC000450661062	GG	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)c(F)c2)c(OC)c1	ZINC000450661063	GG	On-Demand	Anodyne	TRPV1	67	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)c(F)c2)c(OC)c1	ZINC000450661063	GG	On-Demand	Anodyne	MTNR1A	51	38
N#CC1(CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)CCC1	ZINC000450661095	GK	On-Demand	Mild	HCRTR2	17	44
CCCOc1ccc(C(=O)N[C@H]2CCOc3ccc(OC)cc32)c(OC)c1	ZINC000450661098	FH	On-Demand	Anodyne	EDNRA	18	43
CS(=O)(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450661111	GG	On-Demand	Anodyne	GPR119	24	52
CC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450661121	GI	On-Demand	Bother	TAAR1	18	41
CC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450661121	GI	On-Demand	Bother	AKR1C4	0	43
CC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450661122	GI	On-Demand	Bother	TAAR1	18	41
CC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450661122	GI	On-Demand	Bother	AKR1C4	0	43
FC(F)(F)c1csc(C2CCN(c3nc4ccccc4[nH]3)CC2)n1	ZINC000450661127	FI	On-Demand	Anodyne	KCNN3	20	40
COc1ccc2c(c1)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)CCO2	ZINC000450661139	FG	On-Demand	Anodyne	NAAA	41	34
COc1ccc2c(c1)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)CCO2	ZINC000450661139	FG	On-Demand	Anodyne	TRAR	46	36
COc1ccc2c(c1)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)CCO2	ZINC000450661140	FG	On-Demand	Anodyne	NAAA	41	34
COc1ccc2c(c1)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)CCO2	ZINC000450661140	FG	On-Demand	Anodyne	TRAR	46	36
N#Cc1c(F)cccc1N1CCC(c2nc(C(F)(F)F)cs2)CC1	ZINC000450661143	FJ	On-Demand	Mild	GRM2	18	45
CCS(=O)(=O)c1ccc(CN[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1	ZINC000450661148	GH	On-Demand	Anodyne	RORC	43	38
CCS(=O)(=O)c1ccc(CN[C@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1	ZINC000450661149	GH	On-Demand	Anodyne	RORC	43	38
COc1cccc(Oc2ccc(C(=O)NCCc3cn4c(n3)SCC4)nc2)c1	ZINC000450661177	GG	On-Demand	Anodyne	DRD4	46	35
COc1cc([C@H](C)NCCC[C@@H](C)O)ccc1OC1CCCC1	ZINC000450661188	DH	On-Demand	Anodyne	PDE4A	36	44
COc1cc([C@H](C)NCCC[C@H](C)O)ccc1OC1CCCC1	ZINC000450661189	DH	On-Demand	Anodyne	PDE4A	46	44
COc1cc([C@H](C)NCCC[C@H](C)O)ccc1OC1CCCC1	ZINC000450661189	DH	On-Demand	Anodyne	PDE4B	28	43
COc1cc([C@H](C)NCCC[C@H](C)O)ccc1OC1CCCC1	ZINC000450661189	DH	On-Demand	Anodyne	PDE4D	22	43
COc1cc([C@H](C)NCCC[C@H](C)O)ccc1OC1CCCC1	ZINC000450661189	DH	On-Demand	Anodyne	PDE4C	16	43
COc1cc([C@@H](C)NCCC[C@@H](C)O)ccc1OC1CCCC1	ZINC000450661190	DH	On-Demand	Anodyne	PDE4A	46	44
COc1cc([C@@H](C)NCCC[C@@H](C)O)ccc1OC1CCCC1	ZINC000450661190	DH	On-Demand	Anodyne	PDE4B	28	43
COc1cc([C@@H](C)NCCC[C@@H](C)O)ccc1OC1CCCC1	ZINC000450661190	DH	On-Demand	Anodyne	PDE4D	22	43
COc1cc([C@@H](C)NCCC[C@@H](C)O)ccc1OC1CCCC1	ZINC000450661190	DH	On-Demand	Anodyne	PDE4C	16	43
COc1cc([C@@H](C)NCCC[C@H](C)O)ccc1OC1CCCC1	ZINC000450661191	DH	On-Demand	Anodyne	PDE4A	46	44
COc1cc([C@@H](C)NCCC[C@H](C)O)ccc1OC1CCCC1	ZINC000450661191	DH	On-Demand	Anodyne	PDE4B	28	43
COc1cc([C@@H](C)NCCC[C@H](C)O)ccc1OC1CCCC1	ZINC000450661191	DH	On-Demand	Anodyne	PDE4D	22	43
COc1cc([C@@H](C)NCCC[C@H](C)O)ccc1OC1CCCC1	ZINC000450661191	DH	On-Demand	Anodyne	PDE4C	16	43
CC[C@H]1[C@H](CO)CCN1c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450661194	GH	On-Demand	Bother	TAAR1	27	45
COCCn1c(NC(=O)c2ccc(C(C)(F)F)nc2)nc2ccccc21	ZINC000450661201	FG	On-Demand	Anodyne	ITK	39	43
COCCn1c(NC(=O)c2ccc(C(C)(F)F)nc2)nc2ccccc21	ZINC000450661201	FG	On-Demand	Anodyne	SUV39H1	0	44
COC(=O)[C@@H](CC(C)C)N(C)c1ncnc2c1ncn2C1CC1	ZINC000450661222	DE	On-Demand	Anodyne	ADCY5	28	41
COC(=O)[C@@H](CC(C)C)N(C)c1ncnc2c1ncn2C1CC1	ZINC000450661222	DE	On-Demand	Anodyne	OXGR1	91	39
COC(=O)[C@H](CC(C)C)N(C)c1ncnc2c1ncn2C1CC1	ZINC000450661223	DE	On-Demand	Anodyne	ADCY5	28	41
COC(=O)[C@H](CC(C)C)N(C)c1ncnc2c1ncn2C1CC1	ZINC000450661223	DE	On-Demand	Anodyne	OXGR1	91	39
O=C(NCC(Cc1ccccc1)Cc1ccccc1)C1(CF)CCOCC1	ZINC000450661241	FH	On-Demand	Anodyne	TIMP3	40	32
COc1cc(OC)c2ncnc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)c2c1	ZINC000450661269	GF	On-Demand	Anodyne	PDE3A	46	37
COc1cc(OC)c2ncnc(N3C[C@H](c4ccccc4)[C@](F)(CO)C3)c2c1	ZINC000450661269	GF	On-Demand	Anodyne	PDE3B	68	37
COc1cc(OC)c2ncnc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)c2c1	ZINC000450661270	GF	On-Demand	Anodyne	PDE3A	46	37
COc1cc(OC)c2ncnc(N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)c2c1	ZINC000450661270	GF	On-Demand	Anodyne	PDE3B	68	37
COc1cc(OC)c2ncnc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)c2c1	ZINC000450661271	GF	On-Demand	Anodyne	PDE3A	46	37
COc1cc(OC)c2ncnc(N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)c2c1	ZINC000450661271	GF	On-Demand	Anodyne	PDE3B	68	37
COc1cc(OC)c2ncnc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)c2c1	ZINC000450661272	GF	On-Demand	Anodyne	PDE3A	46	37
COc1cc(OC)c2ncnc(N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)c2c1	ZINC000450661272	GF	On-Demand	Anodyne	PDE3B	68	37
COc1ccc(-c2noc(CNC(C)(C)C(=O)NCC3CCCCC3)n2)nn1	ZINC000450661281	GE	On-Demand	Anodyne	BMP1	44	40
COc1cc([C@@H](C)NCC2CC(F)(F)C2)ccc1OC1CCCC1	ZINC000450661303	EJ	On-Demand	Anodyne	PDE4A	46	45
COc1cc([C@@H](C)NCC2CC(F)(F)C2)ccc1OC1CCCC1	ZINC000450661303	EJ	On-Demand	Anodyne	PDE4B	21	44
COc1cc([C@@H](C)NCC2CC(F)(F)C2)ccc1OC1CCCC1	ZINC000450661303	EJ	On-Demand	Anodyne	PDE4D	16	44
COc1cc([C@@H](C)NCC2CC(F)(F)C2)ccc1OC1CCCC1	ZINC000450661303	EJ	On-Demand	Anodyne	PDE4C	15	44
COc1cc([C@H](C)NCC2CC(F)(F)C2)ccc1OC1CCCC1	ZINC000450661304	EJ	On-Demand	Anodyne	PDE4A	46	45
COc1cc([C@H](C)NCC2CC(F)(F)C2)ccc1OC1CCCC1	ZINC000450661304	EJ	On-Demand	Anodyne	PDE4B	21	44
COc1cc([C@H](C)NCC2CC(F)(F)C2)ccc1OC1CCCC1	ZINC000450661304	EJ	On-Demand	Anodyne	PDE4D	16	44
COc1cc([C@H](C)NCC2CC(F)(F)C2)ccc1OC1CCCC1	ZINC000450661304	EJ	On-Demand	Anodyne	PDE4C	15	44
C[C@@H](NCC1CC(F)(F)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000450661305	DH	On-Demand	Anodyne	EPHX2	15	42
C[C@H](NCC1CC(F)(F)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000450661306	DH	On-Demand	Anodyne	EPHX2	15	42
CC(C)CC(CC(C)C)C(=O)Nc1cncnc1	ZINC000450661311	BG	On-Demand	Anodyne	MME	0	44
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661336	GG	On-Demand	Anodyne	PDGFRB	33	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661336	GG	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661336	GG	On-Demand	Anodyne	P2RX7	41	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661336	GG	On-Demand	Anodyne	MTNR1A	51	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661336	GG	On-Demand	Anodyne	MTNR1B	40	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661336	GG	On-Demand	Anodyne	CSF1R	15	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661338	GG	On-Demand	Anodyne	PDGFRB	33	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661338	GG	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661338	GG	On-Demand	Anodyne	P2RX7	41	39
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661338	GG	On-Demand	Anodyne	MTNR1A	51	39
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661338	GG	On-Demand	Anodyne	MTNR1B	40	39
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(F)ccc2OC)c(OC)c1	ZINC000450661338	GG	On-Demand	Anodyne	CSF1R	15	41
CSc1cccc(C(=O)NCCc2cn3c(n2)SCC3)c1	ZINC000450661341	DF	On-Demand	Anodyne	DRD4	43	32
Cc1cc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450661343	FF	On-Demand	Anodyne	DHOD	0	47
Cc1cc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450661347	FF	On-Demand	Anodyne	DHOD	0	47
CCNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nn1	ZINC000450661358	GG	On-Demand	Anodyne	SCD1	66	47
CCNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nn1	ZINC000450661358	GG	On-Demand	Anodyne	SCD	51	47
COc1cc([C@H](C)NCC2(C#N)CCC2)ccc1OC1CCCC1	ZINC000450661380	EI	On-Demand	Mild	PDE4A	31	40
COc1cc([C@H](C)NCC2(C#N)CCC2)ccc1OC1CCCC1	ZINC000450661380	EI	On-Demand	Mild	PDE4B	17	44
COc1cc([C@@H](C)NCC2(C#N)CCC2)ccc1OC1CCCC1	ZINC000450661381	EI	On-Demand	Mild	PDE4A	31	40
COc1cc([C@@H](C)NCC2(C#N)CCC2)ccc1OC1CCCC1	ZINC000450661381	EI	On-Demand	Mild	PDE4B	17	44
COc1cc(OC)nc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)n1	ZINC000450661404	FE	On-Demand	Anodyne	ALS	69	36
COc1cc(OC)nc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)n1	ZINC000450661405	FE	On-Demand	Anodyne	ALS	69	36
COc1cc(CC(=O)N[C@H]2CCCc3sccc32)ccc1Cl	ZINC000450661428	EI	On-Demand	Anodyne	OPRK1	20	41
COc1cc(CC(=O)N[C@@H]2CCCc3sccc32)ccc1Cl	ZINC000450661429	EI	On-Demand	Anodyne	OPRK1	20	41
FC(F)(F)c1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450661430	GG	On-Demand	Anodyne	PIK3CA	26	41
FC(F)(F)c1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450661430	GG	On-Demand	Anodyne	EPHB4	47	33
FC(F)(F)c1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450661430	GG	On-Demand	Anodyne	STAT6	53	36
FC(F)(F)c1cc(CNc2nc3ccccc3nc2N2CCOCC2)ccn1	ZINC000450661430	GG	On-Demand	Anodyne	SMG1	40	36
CCC[C@@H](O)CN[C@@H](C)c1ccc(OCC)c(OC)c1	ZINC000450661453	CF	On-Demand	Anodyne	ADRB2	0	42
CCC[C@@H](O)CN[C@@H](C)c1ccc(OCC)c(OC)c1	ZINC000450661453	CF	On-Demand	Anodyne	SLC22A3	0	40
CCC[C@H](O)CN[C@@H](C)c1ccc(OCC)c(OC)c1	ZINC000450661455	CF	On-Demand	Anodyne	ADRB2	0	42
CCC[C@H](O)CN[C@@H](C)c1ccc(OCC)c(OC)c1	ZINC000450661455	CF	On-Demand	Anodyne	SLC22A3	0	40
CCC[C@H](O)CN[C@H](C)c1ccc(OCC)c(OC)c1	ZINC000450661457	CF	On-Demand	Anodyne	ADRB2	0	42
CCC[C@H](O)CN[C@H](C)c1ccc(OCC)c(OC)c1	ZINC000450661457	CF	On-Demand	Anodyne	SLC22A3	0	40
CCC[C@@H](O)CN[C@H](C)c1ccc(OCC)c(OC)c1	ZINC000450661459	CF	On-Demand	Anodyne	ADRB2	0	42
CCC[C@@H](O)CN[C@H](C)c1ccc(OCC)c(OC)c1	ZINC000450661459	CF	On-Demand	Anodyne	SLC22A3	0	40
CCCc1cc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450661465	GH	On-Demand	Anodyne	DHOD	0	48
CCCc1cc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450661466	GH	On-Demand	Anodyne	DHOD	0	48
FC(F)(F)c1ccnc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)c1	ZINC000450661477	GJ	On-Demand	Anodyne	KARS	15	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC(F)(F)CO	ZINC000450661505	DD	On-Demand	Anodyne	CTSS	22	40
O=C(NCC(F)(F)CO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450661506	FE	On-Demand	Anodyne	PYGL	53	35
Cn1c(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc2ccccc21	ZINC000450661514	FI	On-Demand	Anodyne	HRH1	32	43
Cn1c(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc2ccccc21	ZINC000450661514	FI	On-Demand	Anodyne	PDE6D	60	35
Cn1c(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc2ccccc21	ZINC000450661514	FI	On-Demand	Anodyne	GRM2	17	44
CC(C)CS(=O)(=O)N1CCC(NC(=O)[C@@H](O)C2CCC2)CC1	ZINC000450661534	EC	On-Demand	Anodyne	EPHX2	16	61
CC(C)CS(=O)(=O)N1CCC(NC(=O)[C@H](O)C2CCC2)CC1	ZINC000450661535	EC	On-Demand	Anodyne	EPHX2	16	61
COc1cccc(OCCC(=O)N2CCN(C(=O)C3CC3)CC2(C)C)c1	ZINC000450661537	FE	On-Demand	Anodyne	MTNR1B	33	45
C[C@@H]1CCC[C@]1(C)C(=O)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450661545	GI	On-Demand	Anodyne	EPHX2	43	42
C[C@@H]1CCC[C@@]1(C)C(=O)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450661551	GI	On-Demand	Anodyne	EPHX2	43	42
C[C@H]1CCC[C@@]1(C)C(=O)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450661553	GI	On-Demand	Anodyne	EPHX2	43	42
C[C@H]1CCC[C@]1(C)C(=O)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450661555	GI	On-Demand	Anodyne	EPHX2	43	42
CC[C@@H]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000450661560	EE	On-Demand	Bother	TBXA2R	28	40
CC[C@@H]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000450661563	EE	On-Demand	Bother	TBXA2R	28	40
CC[C@H]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000450661566	EE	On-Demand	Bother	TBXA2R	28	40
CC[C@H]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000450661568	EE	On-Demand	Bother	TBXA2R	28	40
CC(=O)c1cccc(CN2CC[C@](O)(Cc3cccc(Cl)c3)C2)c1	ZINC000450661571	EH	On-Demand	Anodyne	CHRM3	15	52
CC(=O)c1cccc(CN2CC[C@](O)(Cc3cccc(Cl)c3)C2)c1	ZINC000450661571	EH	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)c1cccc(CN2CC[C@](O)(Cc3cccc(Cl)c3)C2)c1	ZINC000450661571	EH	On-Demand	Anodyne	NPFFR1	40	34
CC(=O)c1cccc(CN2CC[C@@](O)(Cc3cccc(Cl)c3)C2)c1	ZINC000450661572	EH	On-Demand	Anodyne	CHRM3	15	52
CC(=O)c1cccc(CN2CC[C@@](O)(Cc3cccc(Cl)c3)C2)c1	ZINC000450661572	EH	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)c1cccc(CN2CC[C@@](O)(Cc3cccc(Cl)c3)C2)c1	ZINC000450661572	EH	On-Demand	Anodyne	NPFFR1	40	34
N#CC[C@@H](O)CSc1nc2sc3c(c2c(=O)n1-c1ccccc1)CCC3	ZINC000450661573	GG	On-Demand	Mild	TGM2	30	51
COc1ccc(OC)c([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450661602	EH	On-Demand	Anodyne	CASR	16	40
COc1ccc(OC)c([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450661603	EH	On-Demand	Anodyne	CASR	16	40
COc1ccc(OC)c([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450661604	EH	On-Demand	Anodyne	CASR	16	40
COc1ccc(OC)c([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450661605	EH	On-Demand	Anodyne	CASR	16	40
COc1cc([C@@H](C)NC[C@@H]2CCCCC2(F)F)ccc1OCc1ccncc1	ZINC000450661621	GK	On-Demand	Anodyne	PDE4A	32	44
COc1cc([C@H](C)NC[C@@H]2CCCCC2(F)F)ccc1OCc1ccncc1	ZINC000450661622	GK	On-Demand	Anodyne	PDE4A	32	44
COc1cc([C@H](C)NC[C@H]2CCCCC2(F)F)ccc1OCc1ccncc1	ZINC000450661623	GK	On-Demand	Anodyne	PDE4A	32	44
COc1cc([C@@H](C)NC[C@H]2CCCCC2(F)F)ccc1OCc1ccncc1	ZINC000450661624	GK	On-Demand	Anodyne	PDE4A	32	44
CC(C)(NCc1ccn(CCc2ccccc2)n1)C(=O)NCC1CCCC1	ZINC000450661629	FG	On-Demand	Anodyne	HTR4	22	41
COC(=O)C1(CN2CCCC[C@H]2c2ncc(-c3cccc(F)c3)[nH]2)CC1	ZINC000450661644	FH	On-Demand	Anodyne	COLA	47	43
CO[C@H](CN[C@H](C)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000450661646	CG	On-Demand	Mild	CTRB_BOVIN	49	34
COC(=O)C1(CN2CCCC[C@@H]2c2ncc(-c3cccc(F)c3)[nH]2)CC1	ZINC000450661649	FH	On-Demand	Anodyne	COLA	47	43
CO[C@@H](CN[C@H](C)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000450661650	CG	On-Demand	Mild	CTRB_BOVIN	49	34
CO[C@@H](CN[C@@H](C)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000450661652	CG	On-Demand	Mild	CTRB_BOVIN	49	34
CO[C@H](CN[C@@H](C)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000450661655	CG	On-Demand	Mild	CTRB_BOVIN	49	34
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661670	EH	On-Demand	Anodyne	NQO2	45	59
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661670	EH	On-Demand	Anodyne	MTR1B_CHICK	0	58
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661670	EH	On-Demand	Anodyne	HTR6	46	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661670	EH	On-Demand	Anodyne	PPARD	41	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661670	EH	On-Demand	Anodyne	MTNR1A	47	49
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661670	EH	On-Demand	Anodyne	MTNR1B	41	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661670	EH	On-Demand	Anodyne	EBP	17	48
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661673	EH	On-Demand	Anodyne	NQO2	45	59
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661673	EH	On-Demand	Anodyne	MTR1B_CHICK	0	58
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661673	EH	On-Demand	Anodyne	HTR6	46	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661673	EH	On-Demand	Anodyne	PPARD	41	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661673	EH	On-Demand	Anodyne	MTNR1A	47	49
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661673	EH	On-Demand	Anodyne	MTNR1B	41	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C(C)(C)C(C)(F)F	ZINC000450661673	EH	On-Demand	Anodyne	EBP	17	48
CCC[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450661684	DH	On-Demand	Anodyne	MTNR1A	23	41
CCC[C@H]1CCC[C@@H]1C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450661684	DH	On-Demand	Anodyne	MTNR1B	17	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450661686	DH	On-Demand	Anodyne	MTNR1A	23	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450661686	DH	On-Demand	Anodyne	MTNR1B	17	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCN(C(=O)C3CC3)CC2(C)C)c1	ZINC000450661703	FF	On-Demand	Anodyne	NPBWR1	51	30
CC(=O)c1ccc(CN2CC[C@](O)(Cc3cccc(Cl)c3)C2)cc1	ZINC000450661705	EH	On-Demand	Anodyne	DRD4	20	42
CC(=O)c1ccc(CN2CC[C@](O)(Cc3cccc(Cl)c3)C2)cc1	ZINC000450661705	EH	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)c1ccc(CN2CC[C@](O)(Cc3cccc(Cl)c3)C2)cc1	ZINC000450661705	EH	On-Demand	Anodyne	NPFFR1	44	37
CC(=O)c1ccc(CN2CC[C@@](O)(Cc3cccc(Cl)c3)C2)cc1	ZINC000450661708	EH	On-Demand	Anodyne	DRD4	20	42
CC(=O)c1ccc(CN2CC[C@@](O)(Cc3cccc(Cl)c3)C2)cc1	ZINC000450661708	EH	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)c1ccc(CN2CC[C@@](O)(Cc3cccc(Cl)c3)C2)cc1	ZINC000450661708	EH	On-Demand	Anodyne	NPFFR1	44	37
O=C(CCCC(=O)C1CC1)N[C@@H]1COc2ccc(F)cc21	ZINC000450661717	CF	On-Demand	Anodyne	LUXR	67	37
O=C(CCCC(=O)C1CC1)N[C@H]1COc2ccc(F)cc21	ZINC000450661718	CF	On-Demand	Anodyne	LUXR	67	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cncnc1	ZINC000450661738	CD	On-Demand	Anodyne	ANPEP	34	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cncnc1	ZINC000450661738	CD	On-Demand	Anodyne	CAPN1	27	43
C=CCNC(=O)CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450661749	DD	On-Demand	Mild	NPFFR1	47	37
CC1(C)CN(C(=O)C2CC2)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450661751	GE	On-Demand	Bother	CACNA1D	44	32
CO[C@@H](CNC(C)(C)C(=O)NCC1CCCC1)Cc1ccccc1	ZINC000450661775	EF	On-Demand	Anodyne	PGC	44	32
CO[C@@H](CNC(C)(C)C(=O)NCC1CCCC1)Cc1ccccc1	ZINC000450661775	EF	On-Demand	Anodyne	AMY2	44	30
CO[C@@H](CNC(C)(C)C(=O)NCC1CCCC1)Cc1ccccc1	ZINC000450661775	EF	On-Demand	Anodyne	REN	57	38
CO[C@H](CNC(C)(C)C(=O)NCC1CCCC1)Cc1ccccc1	ZINC000450661777	EF	On-Demand	Anodyne	PGC	44	32
CO[C@H](CNC(C)(C)C(=O)NCC1CCCC1)Cc1ccccc1	ZINC000450661777	EF	On-Demand	Anodyne	AMY2	44	30
CO[C@H](CNC(C)(C)C(=O)NCC1CCCC1)Cc1ccccc1	ZINC000450661777	EF	On-Demand	Anodyne	REN	57	38
COc1cc(CC(=O)N2CCN(C(=O)N(C)C)CC2(C)C)ccc1Cl	ZINC000450661784	FE	On-Demand	Anodyne	OPRK1	35	40
OCC[C@@H](Nc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000450661801	FJ	On-Demand	Anodyne	PHES	0	40
OCC[C@H](Nc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000450661802	FJ	On-Demand	Anodyne	PHES	0	40
FC(F)(F)c1csc(C2CCN(c3ncc(C(F)(F)F)s3)CC2)n1	ZINC000450661809	GK	On-Demand	Anodyne	MLYCD	65	45
Cn1nc(-c2ccccc2)cc1C(=O)NCC(F)(F)CO	ZINC000450661820	CD	On-Demand	Anodyne	CTSV	47	33
Cc1cc(C(F)(F)F)ccc1C(=O)NCC(F)(F)CO	ZINC000450661825	CE	On-Demand	Anodyne	PPARD	24	42
OCC[C@H](Nc1cc(N2CCOCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450661836	GF	On-Demand	Anodyne	CASR	20	41
OCC[C@H](Nc1cc(N2CCOCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450661836	GF	On-Demand	Anodyne	PHES	0	44
OCC[C@H](Nc1cc(N2CCOCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450661836	GF	On-Demand	Anodyne	SMG1	24	42
OCC[C@@H](Nc1cc(N2CCOCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450661837	GF	On-Demand	Anodyne	CASR	20	41
OCC[C@@H](Nc1cc(N2CCOCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450661837	GF	On-Demand	Anodyne	PHES	0	44
OCC[C@@H](Nc1cc(N2CCOCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450661837	GF	On-Demand	Anodyne	SMG1	24	42
CC[C@H](NCC1(C(=O)OC)CC1)c1ccccc1OCC(=O)N(C)C	ZINC000450661853	EE	On-Demand	Anodyne	HCN1	41	32
CC[C@H](NCC1(C(=O)OC)CC1)c1ccccc1OCC(=O)N(C)C	ZINC000450661853	EE	On-Demand	Anodyne	HCN4	41	32
CC[C@@H](NCC1(C(=O)OC)CC1)c1ccccc1OCC(=O)N(C)C	ZINC000450661854	EE	On-Demand	Anodyne	HCN1	41	32
CC[C@@H](NCC1(C(=O)OC)CC1)c1ccccc1OCC(=O)N(C)C	ZINC000450661854	EE	On-Demand	Anodyne	HCN4	41	32
COc1cc([C@H](C)NCc2nnc(C(C)C)s2)ccc1OCc1ccccc1	ZINC000450661855	GK	On-Demand	Anodyne	PDEB1	0	41
COc1cc([C@@H](C)NCc2nnc(C(C)C)s2)ccc1OCc1ccccc1	ZINC000450661858	GK	On-Demand	Anodyne	PDEB1	0	41
CC[C@H](NCC1(C(=O)OC)CC1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450661863	FF	On-Demand	Anodyne	HCN1	55	35
CC[C@H](NCC1(C(=O)OC)CC1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450661863	FF	On-Demand	Anodyne	HCN4	53	35
CC[C@@H](NCC1(C(=O)OC)CC1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450661864	FF	On-Demand	Anodyne	HCN1	55	35
CC[C@@H](NCC1(C(=O)OC)CC1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450661864	FF	On-Demand	Anodyne	HCN4	53	35
O=C(CCCC(=O)C1CC1)Nc1cncnc1	ZINC000450661866	BD	On-Demand	Anodyne	HDAC3	18	43
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCCC[C@H]1CC(F)(F)F	ZINC000450661891	GH	On-Demand	Bother	TBXA2R	20	42
CC(=O)c1cccc(CSc2nc3ccccc3c(=O)n2C(C)C)c1	ZINC000450661892	FI	On-Demand	Anodyne	PTGDR2	16	59
CCc1cc(CCCN[C@H](C)c2ccc3c(c2)NC(=O)CO3)on1	ZINC000450661900	EF	On-Demand	Anodyne	NR3C2	29	40
CCc1cc(CCCN[C@@H](C)c2ccc3c(c2)NC(=O)CO3)on1	ZINC000450661904	EF	On-Demand	Anodyne	NR3C2	29	40
COc1ccnc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)n1	ZINC000450661948	DG	On-Demand	Anodyne	CASR	15	42
COc1ccnc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)n1	ZINC000450661948	DG	On-Demand	Anodyne	PHES	0	40
COc1ccnc(CN[C@H](C)c2cccc(C(F)(F)F)c2)n1	ZINC000450661949	DG	On-Demand	Anodyne	CASR	15	42
COc1ccnc(CN[C@H](C)c2cccc(C(F)(F)F)c2)n1	ZINC000450661949	DG	On-Demand	Anodyne	PHES	0	40
COC(=O)c1cccc(CN[C@H](C)c2ccc3c(c2)OCO3)c1Cl	ZINC000450661965	EH	On-Demand	Anodyne	EDNRB	50	36
COC(=O)c1cccc(CN[C@H](C)c2ccc3c(c2)OCO3)c1Cl	ZINC000450661965	EH	On-Demand	Anodyne	EDNRA	43	37
COC(=O)c1cccc(CN[C@@H](C)c2ccc3c(c2)OCO3)c1Cl	ZINC000450661966	EH	On-Demand	Anodyne	EDNRB	50	36
COC(=O)c1cccc(CN[C@@H](C)c2ccc3c(c2)OCO3)c1Cl	ZINC000450661966	EH	On-Demand	Anodyne	EDNRA	43	37
COc1ccc(CNC(=O)CCN2CC[C@](C)(F)C2)c(OC)c1	ZINC000450662006	DE	On-Demand	Anodyne	HTR7	25	40
COc1ccc(CNC(=O)CCN2CC[C@](C)(F)C2)c(OC)c1	ZINC000450662006	DE	On-Demand	Anodyne	MTNR1A	49	35
COc1ccc(CNC(=O)CCN2CC[C@](C)(F)C2)c(OC)c1	ZINC000450662006	DE	On-Demand	Anodyne	MTNR1B	32	41
COc1ccc(CNC(=O)CCN2CC[C@@](C)(F)C2)c(OC)c1	ZINC000450662008	DE	On-Demand	Anodyne	HTR7	25	40
COc1ccc(CNC(=O)CCN2CC[C@@](C)(F)C2)c(OC)c1	ZINC000450662008	DE	On-Demand	Anodyne	MTNR1A	49	35
COc1ccc(CNC(=O)CCN2CC[C@@](C)(F)C2)c(OC)c1	ZINC000450662008	DE	On-Demand	Anodyne	MTNR1B	32	41
CC[C@H]1[C@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662058	DE	On-Demand	Anodyne	PDE3A	51	40
CC[C@H]1[C@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662058	DE	On-Demand	Anodyne	PDGFRB	59	38
CC[C@H]1[C@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662058	DE	On-Demand	Anodyne	PDE3B	74	40
CC[C@@H]1[C@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662059	DE	On-Demand	Anodyne	PDE3A	51	40
CC[C@@H]1[C@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662059	DE	On-Demand	Anodyne	PDGFRB	59	38
CC[C@@H]1[C@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662059	DE	On-Demand	Anodyne	PDE3B	74	40
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662060	DE	On-Demand	Anodyne	PDE3A	51	40
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662060	DE	On-Demand	Anodyne	PDGFRB	59	38
CC[C@@H]1[C@@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662060	DE	On-Demand	Anodyne	PDE3B	74	40
CC[C@H]1[C@@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662061	DE	On-Demand	Anodyne	PDE3A	51	40
CC[C@H]1[C@@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662061	DE	On-Demand	Anodyne	PDGFRB	59	38
CC[C@H]1[C@@H](CO)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450662061	DE	On-Demand	Anodyne	PDE3B	74	40
O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(N2CCC2)nc1	ZINC000450662083	FF	On-Demand	Anodyne	HDAC1	29	44
O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(N2CCC2)nc1	ZINC000450662083	FF	On-Demand	Anodyne	HPGDS	34	54
O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(N2CCC2)nc1	ZINC000450662083	FF	On-Demand	Anodyne	NPBWR1	44	35
O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(N2CCC2)nc1	ZINC000450662084	FF	On-Demand	Anodyne	HDAC1	29	44
O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(N2CCC2)nc1	ZINC000450662084	FF	On-Demand	Anodyne	HPGDS	34	54
O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(N2CCC2)nc1	ZINC000450662084	FF	On-Demand	Anodyne	NPBWR1	44	35
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450662089	GD	On-Demand	Bother	CACNA1C	40	33
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450662089	GD	On-Demand	Bother	CACNA1D	59	33
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450662090	GD	On-Demand	Bother	CACNA1C	40	33
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450662090	GD	On-Demand	Bother	CACNA1D	59	33
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450662091	GD	On-Demand	Bother	CACNA1C	40	33
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450662091	GD	On-Demand	Bother	CACNA1D	59	33
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450662092	GD	On-Demand	Bother	CACNA1C	40	33
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450662092	GD	On-Demand	Bother	CACNA1D	59	33
COc1cc([C@@H](C)NCc2cnn[nH]2)ccc1OC1CCCC1	ZINC000450662102	DF	On-Demand	Anodyne	PDE4A	36	42
COc1cc([C@H](C)NCc2cnn[nH]2)ccc1OC1CCCC1	ZINC000450662103	DF	On-Demand	Anodyne	PDE4A	36	42
CC(=O)N[C@H](C(=O)NCC(F)(F)CO)C(C)(C)C	ZINC000450662104	CC	On-Demand	Anodyne	PROTEASE	0	40
COC(=O)c1ccc(C(=O)CSc2nnc(C3CC3)n2Cc2ccco2)o1	ZINC000450662111	GG	On-Demand	Anodyne	HCRTR2	21	42
Cc1occc1-c1nnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)o1	ZINC000450662128	FK	On-Demand	Anodyne	GSK3B	18	43
Cc1occc1-c1nnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)o1	ZINC000450662128	FK	On-Demand	Anodyne	GSK3A	51	40
Cc1occc1-c1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)o1	ZINC000450662129	FK	On-Demand	Anodyne	GSK3B	18	43
Cc1occc1-c1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)o1	ZINC000450662129	FK	On-Demand	Anodyne	GSK3A	51	40
CC[C@H](C)Oc1cc(CNC(=O)Cc2scnc2-c2ccccc2)ccn1	ZINC000450662130	GI	On-Demand	Anodyne	TACR3	40	33
CC[C@@H](C)Oc1cc(CNC(=O)Cc2scnc2-c2ccccc2)ccn1	ZINC000450662131	GI	On-Demand	Anodyne	TACR3	40	33
CCc1cc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450662138	FG	On-Demand	Anodyne	DHOD	0	56
CCc1cc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450662139	FG	On-Demand	Anodyne	DHOD	0	56
COC(=O)c1cnc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450662143	FF	On-Demand	Anodyne	PDS	40	34
COC(=O)c1cnc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450662144	FF	On-Demand	Anodyne	PDS	40	34
O=C(NCC(F)(F)CO)c1cc2ccncc2s1	ZINC000450662148	CD	On-Demand	Anodyne	ICAM1	41	35
O=C(NCC(F)(F)CO)c1cc2ccncc2s1	ZINC000450662148	CD	On-Demand	Anodyne	NAMPT	16	53
O=C(NCC(F)(F)CO)c1cc(O)ccc1F	ZINC000450662149	BC	For-Sale	Anodyne	HSD17B1	0	41
CC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450662163	EH	On-Demand	Anodyne	SCD1	28	40
CC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450662163	EH	On-Demand	Anodyne	PDS	41	32
CC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450662164	EH	On-Demand	Anodyne	SCD1	28	40
CC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450662164	EH	On-Demand	Anodyne	PDS	41	32
CCOc1ccc([C@H](C)NCc2ccccc2OC2CC2)cc1OC	ZINC000450662176	EI	On-Demand	Anodyne	PDE4A	32	41
CCOc1ccc([C@@H](C)NCc2ccccc2OC2CC2)cc1OC	ZINC000450662177	EI	On-Demand	Anodyne	PDE4A	32	41
COc1ccc2c(c1)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CCO2	ZINC000450662178	GG	On-Demand	Anodyne	CTSK	26	48
COc1ccc2c(c1)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CCO2	ZINC000450662178	GG	On-Demand	Anodyne	CAPN1	15	43
COc1ccc2c(c1)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CCO2	ZINC000450662178	GG	On-Demand	Anodyne	CAPN2	19	43
Cc1nc(C)n(CCCC(=O)N2CCC[C@H](Cc3csc4ccccc34)C2)n1	ZINC000450662190	GI	On-Demand	Anodyne	FFAR2	48	33
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H](Cc3csc4ccccc34)C2)n1	ZINC000450662191	GI	On-Demand	Anodyne	FFAR2	48	33
CCC(CC)(CCSc1nnc(-c2ccoc2C)n1C)C(=O)OC	ZINC000450662198	FH	On-Demand	Anodyne	DRD3	41	34
CCC(CC)(CCSc1nnc(-c2ccoc2C)n1C)C(=O)OC	ZINC000450662198	FH	On-Demand	Anodyne	HCRTR2	20	40
COCCOC[C@@H](O)CN[C@@H](C)c1ccc(OC)c(F)c1	ZINC000450662232	DD	On-Demand	Anodyne	ADRB2	26	41
COCCOC[C@H](O)CN[C@H](C)c1ccc(OC)c(F)c1	ZINC000450662233	DD	On-Demand	Anodyne	ADRB2	26	41
COCCOC[C@H](O)CN[C@@H](C)c1ccc(OC)c(F)c1	ZINC000450662234	DD	On-Demand	Anodyne	ADRB2	26	41
COCCOC[C@@H](O)CN[C@H](C)c1ccc(OC)c(F)c1	ZINC000450662235	DD	On-Demand	Anodyne	ADRB2	26	41
CCC(CC)Oc1ccc(C(=O)Nc2cncnc2)cc1	ZINC000450662238	CG	On-Demand	Anodyne	PRNP	50	33
CCC(CC)Oc1ccc(C(=O)Nc2cncnc2)cc1	ZINC000450662238	CG	On-Demand	Anodyne	P4HTM	0	43
CCC(CC)Oc1ccc(C(=O)Nc2cncnc2)cc1	ZINC000450662238	CG	On-Demand	Anodyne	KCNK3	42	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCc2sccc21	ZINC000450662243	FH	On-Demand	Anodyne	CTSK	18	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCc2sccc21	ZINC000450662244	FH	On-Demand	Anodyne	CTSK	18	44
CCOC(=O)c1cc(C(=O)N[C@@H]2COc3ccc(F)cc32)on1	ZINC000450662268	DD	On-Demand	Anodyne	NAAA	18	42
CCOC(=O)c1cc(C(=O)N[C@H]2COc3ccc(F)cc32)on1	ZINC000450662269	DD	On-Demand	Anodyne	NAAA	18	42
COC(=O)c1coc(CN[C@H](C)c2cccc(Cl)c2)n1	ZINC000450662282	CF	On-Demand	Anodyne	CASR	19	40
COC(=O)c1coc(CN[C@@H](C)c2cccc(Cl)c2)n1	ZINC000450662283	CF	On-Demand	Anodyne	CASR	19	40
Cc1ccn2ncc(C(=O)N[C@H]3CCCc4sccc43)c2c1	ZINC000450662292	DH	On-Demand	Anodyne	EPHB3	36	48
Cc1ccn2ncc(C(=O)N[C@@H]3CCCc4sccc43)c2c1	ZINC000450662293	DH	On-Demand	Anodyne	EPHB3	34	48
CCC(=O)CCCN1CC[C@@](C)(F)C1	ZINC000450662317	BE	On-Demand	Anodyne	EBP	19	41
CCC(=O)CCCN1CC[C@](C)(F)C1	ZINC000450662318	BE	On-Demand	Anodyne	EBP	19	41
CC(C)OC(=O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450662346	GI	On-Demand	Anodyne	RBP4	88	41
N#Cc1ccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1Cl	ZINC000450662347	EH	On-Demand	Mild	AR	20	52
N#Cc1ccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1Cl	ZINC000450662348	EH	On-Demand	Mild	AR	20	52
N#Cc1ccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1Cl	ZINC000450662349	EH	On-Demand	Mild	AR	20	52
N#Cc1ccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1Cl	ZINC000450662350	EH	On-Demand	Mild	AR	20	52
O=C(NCCOCc1ccc(Cl)cc1Cl)c1ccc(N2CCC2)nc1	ZINC000450662391	GH	On-Demand	Anodyne	F10	15	43
O=C(NCCOCc1ccc(Cl)cc1Cl)c1ccc(N2CCC2)nc1	ZINC000450662391	GH	On-Demand	Anodyne	EPHX2	16	49
O=C(NCCOCc1ccc(Cl)cc1Cl)c1ccc(N2CCC2)nc1	ZINC000450662391	GH	On-Demand	Anodyne	CXCR3	30	40
O=C(NCCOCc1ccc(Cl)cc1Cl)c1ccc(N2CCC2)nc1	ZINC000450662391	GH	On-Demand	Anodyne	HPGDS	15	40
COCc1cc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450662413	GF	On-Demand	Anodyne	DHOD	0	46
COCc1cc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)n2ncnc2n1	ZINC000450662414	GF	On-Demand	Anodyne	DHOD	0	46
CC[C@@H]1[C@@H](CO)CCN1c1nc(-c2ccccc2)ns1	ZINC000450662421	CF	On-Demand	Anodyne	FAAH	0	44
CC[C@H]1[C@@H](CO)CCN1c1nc(-c2ccccc2)ns1	ZINC000450662422	CF	On-Demand	Anodyne	FAAH	0	44
CC[C@@H]1[C@H](CO)CCN1c1nc(-c2ccccc2)ns1	ZINC000450662423	CF	On-Demand	Anodyne	FAAH	0	44
CC[C@H]1[C@H](CO)CCN1c1nc(-c2ccccc2)ns1	ZINC000450662424	CF	On-Demand	Anodyne	FAAH	0	44
FC(F)(F)c1csc(C2CCN(c3ncncc3-c3ccccc3)CC2)n1	ZINC000450662432	GK	On-Demand	Anodyne	SLC9A1	15	52
CCC[C@@H](O)CN[C@H](C)c1ccc(OCC(C)C)c(OC)c1	ZINC000450662440	DH	On-Demand	Anodyne	ADRB2	24	46
CCC[C@@H](O)CN[C@@H](C)c1ccc(OCC(C)C)c(OC)c1	ZINC000450662441	DH	On-Demand	Anodyne	ADRB2	24	46
CCC[C@H](O)CN[C@@H](C)c1ccc(OCC(C)C)c(OC)c1	ZINC000450662442	DH	On-Demand	Anodyne	ADRB2	24	46
CCC[C@H](O)CN[C@H](C)c1ccc(OCC(C)C)c(OC)c1	ZINC000450662443	DH	On-Demand	Anodyne	ADRB2	24	46
O=[N+]([O-])c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)cc1	ZINC000450662446	EI	On-Demand	Bother	PGR	25	53
O=[N+]([O-])c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)cc1	ZINC000450662446	EI	On-Demand	Bother	AR	20	53
O=[N+]([O-])c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)cc1	ZINC000450662447	EI	On-Demand	Bother	PGR	25	53
O=[N+]([O-])c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)cc1	ZINC000450662447	EI	On-Demand	Bother	AR	20	53
CC[C@H](NC[C@@H]1CCC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450662455	GI	On-Demand	Anodyne	HCN1	52	33
CC[C@H](NC[C@@H]1CCC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450662455	GI	On-Demand	Anodyne	HCN4	50	33
CC[C@@H](NC[C@H]1CCC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450662456	GI	On-Demand	Anodyne	HCN1	52	33
CC[C@@H](NC[C@H]1CCC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450662456	GI	On-Demand	Anodyne	HCN4	50	33
CC[C@@H](NC[C@@H]1CCC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450662457	GI	On-Demand	Anodyne	HCN1	52	33
CC[C@@H](NC[C@@H]1CCC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450662457	GI	On-Demand	Anodyne	HCN4	50	33
CC[C@H](NC[C@H]1CCC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450662458	GI	On-Demand	Anodyne	HCN1	52	33
CC[C@H](NC[C@H]1CCC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450662458	GI	On-Demand	Anodyne	HCN4	50	33
CC(C)OC(C)(C)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	ZINC000450662459	EI	On-Demand	Anodyne	GUAB	0	43
CC(C)OC(C)(C)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	ZINC000450662459	EI	On-Demand	Anodyne	AGPAT2	32	42
CC(C)OC(C)(C)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	ZINC000450662459	EI	On-Demand	Anodyne	IMDH_CRYPV	52	43
CCOc1ccc([C@@H](C)NCc2ccc(C(=O)OC)c(Cl)c2)cc1OC	ZINC000450662489	GI	On-Demand	Anodyne	PDE6A	44	33
CCOc1ccc([C@H](C)NCc2ccc(C(=O)OC)c(Cl)c2)cc1OC	ZINC000450662490	GI	On-Demand	Anodyne	PDE6A	44	33
COc1cc2c(cc1F)CN(C(=O)CNC(=O)Nc1cccc(Cl)c1)CC2	ZINC000450662491	GG	On-Demand	Anodyne	COLA	43	36
COc1cc2c(cc1F)CN(C(=O)CNC(=O)Nc1cccc(Cl)c1)CC2	ZINC000450662491	GG	On-Demand	Anodyne	CPT1A	44	31
COc1cc2c(cc1F)CN(C(=O)CNC(=O)Nc1cccc(Cl)c1)CC2	ZINC000450662491	GG	On-Demand	Anodyne	ABCB1	15	41
COc1cc2c(cc1F)CN(C(=O)CNC(=O)Nc1cccc(Cl)c1)CC2	ZINC000450662491	GG	On-Demand	Anodyne	HCRTR2	16	43
Cc1nc(N[C@H]2CCCC[C@H]2CC(F)(F)F)ncc1[N+](=O)[O-]	ZINC000450662533	DH	On-Demand	Bother	PRKCQ	45	37
Cc1ccc([C@@H](CN2CCOCC2)NC[C@H](O)Cc2ccccc2)cc1	ZINC000450662544	FF	On-Demand	Anodyne	ABCB1	25	43
Cc1ccc([C@H](CN2CCOCC2)NC[C@H](O)Cc2ccccc2)cc1	ZINC000450662545	FF	On-Demand	Anodyne	ABCB1	25	43
CC(F)(F)C(C)(C)C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450662558	EH	On-Demand	Anodyne	MDM2	57	34
CC(F)(F)C(C)(C)C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450662559	EH	On-Demand	Anodyne	MDM2	57	34
CC1(O)CC(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)C1	ZINC000450662585	DE	On-Demand	Anodyne	MDM2	62	33
CC1(O)CC(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)C1	ZINC000450662586	DE	On-Demand	Anodyne	MDM2	62	33
Cc1ccc([C@H](CN2CCOCC2)NCc2cccc(C)n2)cc1	ZINC000450662592	EF	On-Demand	Anodyne	NPY1R	30	41
Cc1ccc([C@@H](CN2CCOCC2)NCc2cccc(C)n2)cc1	ZINC000450662593	EF	On-Demand	Anodyne	NPY1R	30	41
C[C@H](NCC/C=C/c1ccccc1)c1ccc2c(c1)NC(=O)CO2	ZINC000450662658	DH	On-Demand	Anodyne	NR3C2	32	40
C[C@@H](NCC/C=C/c1ccccc1)c1ccc2c(c1)NC(=O)CO2	ZINC000450662659	DH	On-Demand	Anodyne	NR3C2	32	40
C[C@@H](NCC/C=C\c1ccccc1)c1ccc2c(c1)NC(=O)CO2	ZINC000450662660	DH	On-Demand	Anodyne	NR3C2	32	40
C[C@H](NCC/C=C\c1ccccc1)c1ccc2c(c1)NC(=O)CO2	ZINC000450662661	DH	On-Demand	Anodyne	NR3C2	32	40
COc1cc([C@H](C)NCc2cccc(C)n2)ccc1OC1CCCC1	ZINC000450662683	EJ	On-Demand	Anodyne	PDE4A	47	42
COc1cc([C@H](C)NCc2cccc(C)n2)ccc1OC1CCCC1	ZINC000450662683	EJ	On-Demand	Anodyne	PDE4B	25	41
COc1cc([C@H](C)NCc2cccc(C)n2)ccc1OC1CCCC1	ZINC000450662683	EJ	On-Demand	Anodyne	PDE4D	23	42
COc1cc([C@@H](C)NCc2cccc(C)n2)ccc1OC1CCCC1	ZINC000450662688	EJ	On-Demand	Anodyne	PDE4A	47	42
COc1cc([C@@H](C)NCc2cccc(C)n2)ccc1OC1CCCC1	ZINC000450662688	EJ	On-Demand	Anodyne	PDE4B	25	41
COc1cc([C@@H](C)NCc2cccc(C)n2)ccc1OC1CCCC1	ZINC000450662688	EJ	On-Demand	Anodyne	PDE4D	23	42
C[C@@H]1C[C@]1(C#N)C(=O)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450662690	EI	On-Demand	Mild	FFAR2	64	33
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450662694	EI	On-Demand	Mild	FFAR2	64	33
C[C@@H]1C[C@]1(C#N)C(=O)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450662695	EI	On-Demand	Mild	FFAR2	64	33
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450662696	EI	On-Demand	Mild	FFAR2	64	33
COC(=O)[C@H](CC(C)C)N(C)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450662703	FE	On-Demand	Bother	COLA	80	36
COC(=O)[C@@H](CC(C)C)N(C)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450662704	FE	On-Demand	Bother	COLA	80	36
CCCCNc1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)nc(N)n1	ZINC000450662707	FE	On-Demand	Anodyne	HRH4	27	46
CCCCNc1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)nc(N)n1	ZINC000450662708	FE	On-Demand	Anodyne	HRH4	27	46
CCCCNc1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)nc(N)n1	ZINC000450662709	FE	On-Demand	Anodyne	HRH4	27	46
CCCCNc1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)nc(N)n1	ZINC000450662710	FE	On-Demand	Anodyne	HRH4	27	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450662711	EG	On-Demand	Anodyne	NQO2	35	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450662711	EG	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450662711	EG	On-Demand	Anodyne	HTR6	43	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450662711	EG	On-Demand	Anodyne	PPARD	42	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450662712	EG	On-Demand	Anodyne	NQO2	35	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450662712	EG	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450662712	EG	On-Demand	Anodyne	HTR6	43	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450662712	EG	On-Demand	Anodyne	PPARD	42	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450662713	EG	On-Demand	Anodyne	NQO2	35	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450662713	EG	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450662713	EG	On-Demand	Anodyne	HTR6	43	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450662713	EG	On-Demand	Anodyne	PPARD	42	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450662714	EG	On-Demand	Anodyne	NQO2	35	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450662714	EG	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450662714	EG	On-Demand	Anodyne	HTR6	43	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450662714	EG	On-Demand	Anodyne	PPARD	42	39
COc1cc([C@@H](C)NCCC[C@H](C)O)ccc1OCc1ccccc1	ZINC000450662716	EI	On-Demand	Anodyne	DRTS_PLAFK	18	40
COc1cc([C@@H](C)NCCC[C@H](C)O)ccc1OCc1ccccc1	ZINC000450662716	EI	On-Demand	Anodyne	PHES	0	40
COc1cc([C@@H](C)NCCC[C@@H](C)O)ccc1OCc1ccccc1	ZINC000450662718	EI	On-Demand	Anodyne	DRTS_PLAFK	18	40
COc1cc([C@@H](C)NCCC[C@@H](C)O)ccc1OCc1ccccc1	ZINC000450662718	EI	On-Demand	Anodyne	PHES	0	40
COc1cc([C@H](C)NCCC[C@H](C)O)ccc1OCc1ccccc1	ZINC000450662720	EI	On-Demand	Anodyne	DRTS_PLAFK	18	40
COc1cc([C@H](C)NCCC[C@H](C)O)ccc1OCc1ccccc1	ZINC000450662720	EI	On-Demand	Anodyne	PHES	0	40
COc1cc([C@H](C)NCCC[C@@H](C)O)ccc1OCc1ccccc1	ZINC000450662722	EI	On-Demand	Anodyne	DRTS_PLAFK	18	40
COc1cc([C@H](C)NCCC[C@@H](C)O)ccc1OCc1ccccc1	ZINC000450662722	EI	On-Demand	Anodyne	PHES	0	40
COC(=O)c1csc(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)n1	ZINC000450662736	GI	On-Demand	Anodyne	PDE4A	38	40
COC(=O)c1csc(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)n1	ZINC000450662737	GI	On-Demand	Anodyne	PDE4A	38	40
COC(=O)c1csc(CSc2nnc(C3CC3)n2Cc2ccco2)n1	ZINC000450662739	GG	On-Demand	Anodyne	HCRTR2	19	40
C[C@@H](NC[C@@H]1CCC(F)(F)C1)c1ccc2c(c1)NC(=O)CO2	ZINC000450662757	DG	On-Demand	Anodyne	NR3C2	27	40
C[C@@H](NC[C@H]1CCC(F)(F)C1)c1ccc2c(c1)NC(=O)CO2	ZINC000450662758	DG	On-Demand	Anodyne	NR3C2	27	40
C[C@H](NC[C@H]1CCC(F)(F)C1)c1ccc2c(c1)NC(=O)CO2	ZINC000450662759	DG	On-Demand	Anodyne	NR3C2	27	40
C[C@H](NC[C@@H]1CCC(F)(F)C1)c1ccc2c(c1)NC(=O)CO2	ZINC000450662760	DG	On-Demand	Anodyne	NR3C2	27	40
CC[C@@H](C)Oc1cc(CNC(=O)c2c(C)cccc2Cl)ccn1	ZINC000450662767	EI	On-Demand	Anodyne	PDS	55	35
CC[C@H](C)Oc1cc(CNC(=O)c2c(C)cccc2Cl)ccn1	ZINC000450662768	EI	On-Demand	Anodyne	PDS	55	35
C[C@@H](NCC1(C#N)CCC1)c1ccc(NC(=O)C2CC2)cc1	ZINC000450662780	CG	On-Demand	Mild	DHODH	58	33
C[C@H](NCC1(C#N)CCC1)c1ccc(NC(=O)C2CC2)cc1	ZINC000450662781	CG	On-Demand	Mild	DHODH	58	33
COC(=O)c1cccc(CN[C@H](C)c2cc(OC)ccc2OC)c1Cl	ZINC000450662807	FH	On-Demand	Anodyne	CYSP_PLAFA	24	40
COC(=O)c1cccc(CN[C@@H](C)c2cc(OC)ccc2OC)c1Cl	ZINC000450662808	FH	On-Demand	Anodyne	CYSP_PLAFA	24	40
O=C(NCCO)c1ccc(NCc2ccnc(C(F)(F)F)c2)nn1	ZINC000450662811	EC	On-Demand	Anodyne	BRAF	18	40
CC(C)(C)C(=O)CCCC(=O)N[C@@H]1COc2ccc(F)cc21	ZINC000450662816	DG	On-Demand	Anodyne	LUXR	52	36
CC(C)(C)C(=O)CCCC(=O)N[C@H]1COc2ccc(F)cc21	ZINC000450662817	DG	On-Demand	Anodyne	LUXR	52	36
CCOc1c(Cl)cc(NC(=O)c2cc3n(n2)CCC3)cc1Cl	ZINC000450662828	EH	On-Demand	Anodyne	CACNA1I	41	32
CO[C@@H]1COC[C@@H]1N[C@@H](C)c1cccc2ccccc12	ZINC000450662852	CF	On-Demand	Anodyne	CASR	31	48
CO[C@@H]1COC[C@H]1N[C@H](C)c1cccc2ccccc12	ZINC000450662853	CF	On-Demand	Anodyne	CASR	31	48
CO[C@@H]1COC[C@H]1N[C@@H](C)c1cccc2ccccc12	ZINC000450662854	CF	On-Demand	Anodyne	CASR	31	48
CO[C@@H]1COC[C@@H]1N[C@H](C)c1cccc2ccccc12	ZINC000450662855	CF	On-Demand	Anodyne	CASR	31	48
CCOC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2C(C)C)nc1	ZINC000450662884	GH	On-Demand	Anodyne	CCKAR	0	43
CCOC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2C(C)C)nc1	ZINC000450662884	GH	On-Demand	Anodyne	CCKBR	0	43
O=C(NCCc1cn2c(n1)SCC2)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450662894	GG	On-Demand	Anodyne	RBP4	63	36
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	INSR	40	38
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	LCK	38	40
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	ITK	43	42
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	KDR	15	43
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	SORT1	15	40
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	MTTP	48	33
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	HCK	31	43
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	LYN	46	43
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	SHH	16	40
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	IMDH_CRYPV	27	41
COCCn1c(NC(=O)c2ccc(C(F)(F)F)cc2C)nc2ccccc21	ZINC000450662925	GI	On-Demand	Anodyne	SUV39H1	0	48
COc1cc(C)nc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450662962	DE	On-Demand	Anodyne	ALS	52	30
COc1cc(C)nc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450662963	DE	On-Demand	Anodyne	ALS	52	30
COc1cc(C)nc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450662964	DE	On-Demand	Anodyne	ALS	52	30
COc1cc(C)nc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450662965	DE	On-Demand	Anodyne	ALS	52	30
COc1cc(CC(=O)NCC(F)(F)CO)ccc1Cl	ZINC000450662968	CD	On-Demand	Anodyne	CAN2	0	47
C1=C(CCSc2nnc(-c3cccnc3)n2Cc2ccco2)CCCC1	ZINC000450662971	FJ	On-Demand	Anodyne	HCRTR2	16	43
COCCn1c(NC(=O)c2cn(CC3CC3)nn2)nc2ccccc21	ZINC000450662980	ED	On-Demand	Anodyne	ITK	38	40
C/C=C\COc1cccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450662985	FH	On-Demand	Anodyne	LUXR	67	40
C/C=C\COc1cccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450662985	FH	On-Demand	Anodyne	TRAR	72	40
C/C=C\COc1cccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450662985	FH	On-Demand	Anodyne	LASR	41	40
C/C=C\COc1cccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450662985	FH	On-Demand	Anodyne	PHZR	0	40
C/C=C/COc1cccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450662989	FH	On-Demand	Anodyne	LUXR	67	40
C/C=C/COc1cccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450662989	FH	On-Demand	Anodyne	TRAR	72	40
C/C=C/COc1cccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450662989	FH	On-Demand	Anodyne	LASR	41	40
C/C=C/COc1cccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450662989	FH	On-Demand	Anodyne	PHZR	0	40
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450663008	FG	On-Demand	Anodyne	ACE	40	37
CC(C)OC(=O)C[C@H]1CCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450663010	FG	On-Demand	Anodyne	ACE	40	37
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450663012	FG	On-Demand	Anodyne	ACE	40	37
CC(C)OC(=O)C[C@H]1CCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450663013	FG	On-Demand	Anodyne	ACE	40	37
COc1ccc(CNC(=O)CCN[C@@H](C)C2CCCCC2)c(OC)c1	ZINC000450663015	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@@H](C)C2CCCCC2)c(OC)c1	ZINC000450663015	EG	On-Demand	Anodyne	MTNR1A	46	36
COc1ccc(CNC(=O)CCN[C@H](C)C2CCCCC2)c(OC)c1	ZINC000450663019	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@H](C)C2CCCCC2)c(OC)c1	ZINC000450663019	EG	On-Demand	Anodyne	MTNR1A	46	36
CC[C@@H](NC[C@H]1CCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450663043	FH	On-Demand	Anodyne	HCN1	42	32
CC[C@@H](NC[C@H]1CCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450663043	FH	On-Demand	Anodyne	HCN4	42	32
CC[C@@H](NC[C@@H]1CCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450663045	FH	On-Demand	Anodyne	HCN1	42	32
CC[C@@H](NC[C@@H]1CCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450663045	FH	On-Demand	Anodyne	HCN4	42	32
CC[C@H](NC[C@@H]1CCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450663047	FH	On-Demand	Anodyne	HCN1	42	32
CC[C@H](NC[C@@H]1CCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450663047	FH	On-Demand	Anodyne	HCN4	42	32
CC[C@H](NC[C@H]1CCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450663052	FH	On-Demand	Anodyne	HCN1	42	32
CC[C@H](NC[C@H]1CCCC1(F)F)c1ccccc1OCC(=O)N(C)C	ZINC000450663052	FH	On-Demand	Anodyne	HCN4	42	32
CCOC(=O)c1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)[nH]c1C	ZINC000450663066	FF	On-Demand	Bother	CACNA1C	55	39
CC[C@](C)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450663071	CF	On-Demand	Anodyne	TRPV1	39	42
CC[C@](C)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450663071	CF	On-Demand	Anodyne	PDE6A	43	33
CC[C@](C)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450663071	CF	On-Demand	Anodyne	MT-ND1	23	40
CC[C@@](C)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450663072	CF	On-Demand	Anodyne	TRPV1	39	42
CC[C@@](C)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450663072	CF	On-Demand	Anodyne	PDE6A	43	33
CC[C@@](C)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450663072	CF	On-Demand	Anodyne	MT-ND1	23	40
COc1cccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450663075	EF	On-Demand	Bother	CACNA1D	45	32
COc1cccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450663076	EF	On-Demand	Bother	CACNA1D	45	32
COc1cccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450663077	EF	On-Demand	Bother	CACNA1D	45	32
COc1cccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1[N+](=O)[O-]	ZINC000450663078	EF	On-Demand	Bother	CACNA1D	45	32
Cc1nn(C)cc1CC(=O)NCc1cc2cc(Br)ccc2[nH]1	ZINC000450663086	FF	On-Demand	Anodyne	PYK	49	37
C=CCNC(=O)CNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450663089	DE	On-Demand	Mild	NPFFR1	40	35
COC(=O)COc1ccc([C@H](C)NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450663100	FF	On-Demand	Anodyne	ACACA	50	41
COC(=O)COc1ccc([C@H](C)NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450663100	FF	On-Demand	Anodyne	ACACB	25	40
COC(=O)COc1ccc([C@@H](C)NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450663101	FF	On-Demand	Anodyne	ACACA	50	41
COC(=O)COc1ccc([C@@H](C)NC(=O)CCCc2ncc(C)o2)cc1	ZINC000450663101	FF	On-Demand	Anodyne	ACACB	25	40
CC1(O)CC(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000450663106	CE	On-Demand	Bother	P2RX7	52	45
CC1(O)CC(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000450663106	CE	On-Demand	Bother	CACNA1D	51	34
CCc1nc(C)c(CSc2nnc(-c3ccoc3C)n2Cc2ccccc2)o1	ZINC000450663107	GK	On-Demand	Anodyne	HCRTR2	21	44
CCc1nc(C)c(CSc2nnc(-c3ccccc3)n2Cc2ccco2)o1	ZINC000450663109	GJ	On-Demand	Anodyne	HCRTR2	20	43
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@@H]1C1CCOCC1	ZINC000450663114	FF	On-Demand	Anodyne	SLC6A9	30	41
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@H]1C1CCOCC1	ZINC000450663115	FF	On-Demand	Anodyne	SLC6A9	30	41
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450663118	EH	On-Demand	Anodyne	ACE	15	42
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450663118	EH	On-Demand	Anodyne	AGTR2	42	37
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450663118	EH	On-Demand	Anodyne	PREP	32	40
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450663119	EH	On-Demand	Anodyne	ACE	15	42
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450663119	EH	On-Demand	Anodyne	AGTR2	42	37
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450663119	EH	On-Demand	Anodyne	PREP	32	40
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450663120	EH	On-Demand	Anodyne	ACE	15	42
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450663120	EH	On-Demand	Anodyne	AGTR2	42	37
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450663120	EH	On-Demand	Anodyne	PREP	32	40
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450663121	EH	On-Demand	Anodyne	ACE	15	42
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450663121	EH	On-Demand	Anodyne	AGTR2	42	37
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450663121	EH	On-Demand	Anodyne	PREP	32	40
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCCC2)cc1	ZINC000450663123	GI	On-Demand	Anodyne	CA2	18	42
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCCC2)cc1	ZINC000450663123	GI	On-Demand	Anodyne	CA5B	17	42
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCCC2)cc1	ZINC000450663123	GI	On-Demand	Anodyne	CA4	15	40
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCCC2)cc1	ZINC000450663123	GI	On-Demand	Anodyne	CA5A	19	42
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCCC2)cc1	ZINC000450663123	GI	On-Demand	Anodyne	E1	0	49
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCCC2)cc1	ZINC000450663123	GI	On-Demand	Anodyne	RORC	52	42
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCCC2)cc1	ZINC000450663123	GI	On-Demand	Anodyne	NAMPT	75	40
COc1ccc2c(c1)[C@@H](NC(=O)CCCC(=O)C1CC1)CCO2	ZINC000450663126	DF	On-Demand	Anodyne	LUXR	81	41
COc1ccc2c(c1)[C@@H](NC(=O)CCCC(=O)C1CC1)CCO2	ZINC000450663126	DF	On-Demand	Anodyne	TRAR	83	41
COc1ccc2c(c1)[C@@H](NC(=O)CCCC(=O)C1CC1)CCO2	ZINC000450663126	DF	On-Demand	Anodyne	LASR	53	41
COc1ccc2c(c1)[C@@H](NC(=O)CCCC(=O)C1CC1)CCO2	ZINC000450663126	DF	On-Demand	Anodyne	PHZR	0	41
COc1ccc2c(c1)[C@@H](NC(=O)CCCC(=O)C1CC1)CCO2	ZINC000450663126	DF	On-Demand	Anodyne	CVIR	0	43
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450663144	EI	On-Demand	Anodyne	CFTR	60	42
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450663144	EI	On-Demand	Anodyne	NR1D1	40	48
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450663144	EI	On-Demand	Anodyne	GPR88	0	42
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@H]1C1CCOCC1	ZINC000450663148	DE	On-Demand	Anodyne	HPGDS	15	42
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@@H]1C1CCOCC1	ZINC000450663149	DE	On-Demand	Anodyne	HPGDS	15	42
Cn1nc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c2c1CCCC2	ZINC000450663150	EF	On-Demand	Bother	P2RX7	52	40
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450663157	GF	On-Demand	Bother	COLA	40	32
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450663157	GF	On-Demand	Bother	BCL2L1	89	36
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450663157	GF	On-Demand	Bother	BCL2	72	32
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450663157	GF	On-Demand	Bother	BCL2L2	43	30
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450663158	GF	On-Demand	Bother	COLA	40	32
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450663158	GF	On-Demand	Bother	BCL2L1	89	36
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450663158	GF	On-Demand	Bother	BCL2	72	32
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450663158	GF	On-Demand	Bother	BCL2L2	43	30
COc1cc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1Cl	ZINC000450663166	GH	On-Demand	Anodyne	PDE6A	40	31
COc1cc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1Cl	ZINC000450663166	GH	On-Demand	Anodyne	ADIPOR1	0	40
COc1cc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1Cl	ZINC000450663166	GH	On-Demand	Anodyne	ADIPOR2	0	40
COc1cc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1Cl	ZINC000450663167	GH	On-Demand	Anodyne	PDE6A	40	31
COc1cc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1Cl	ZINC000450663167	GH	On-Demand	Anodyne	ADIPOR1	0	40
COc1cc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)ccc1Cl	ZINC000450663167	GH	On-Demand	Anodyne	ADIPOR2	0	40
N#C[C@]1(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC12CCCC2	ZINC000450663171	EG	On-Demand	Mild	P2RX7	22	40
N#C[C@@]1(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC12CCCC2	ZINC000450663172	EG	On-Demand	Mild	P2RX7	22	40
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450663178	GG	On-Demand	Anodyne	ACACA	52	38
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450663178	GG	On-Demand	Anodyne	P4HTM	0	40
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450663179	GG	On-Demand	Anodyne	ACACA	52	38
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450663179	GG	On-Demand	Anodyne	P4HTM	0	40
C[C@H](NCCC1=CCCCC1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663184	EH	On-Demand	Anodyne	LUXN	0	43
C[C@@H](NCCC1=CCCCC1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663185	EH	On-Demand	Anodyne	LUXN	0	43
CC[C@H]1Cc2ccccc2CN1C(=O)C1CC(C)(O)C1	ZINC000450663186	CF	On-Demand	Anodyne	PREP	24	40
CC[C@H]1Cc2ccccc2CN1C(=O)C1CC(C)(O)C1	ZINC000450663186	CF	On-Demand	Anodyne	CFTR	47	32
CC[C@H]1Cc2ccccc2CN1C(=O)C1CC(C)(O)C1	ZINC000450663186	CF	On-Demand	Anodyne	ADAM9	42	32
CC[C@@H]1Cc2ccccc2CN1C(=O)C1CC(C)(O)C1	ZINC000450663187	CF	On-Demand	Anodyne	PREP	24	40
CC[C@@H]1Cc2ccccc2CN1C(=O)C1CC(C)(O)C1	ZINC000450663187	CF	On-Demand	Anodyne	CFTR	47	32
CC[C@@H]1Cc2ccccc2CN1C(=O)C1CC(C)(O)C1	ZINC000450663187	CF	On-Demand	Anodyne	ADAM9	42	32
O=S(=O)(NCC1CC1)c1ccc(NCc2ccnc(C(F)(F)F)c2)nc1	ZINC000450663219	GE	On-Demand	Anodyne	NPY2R	50	41
O=S(=O)(NCC1CC1)c1ccc(NCc2ccnc(C(F)(F)F)c2)nc1	ZINC000450663219	GE	On-Demand	Anodyne	NPY5R	15	41
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc2ccccc2c1	ZINC000450663223	CF	On-Demand	Anodyne	TPH1	49	39
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc2ccccc2c1	ZINC000450663224	CF	On-Demand	Anodyne	TPH1	49	39
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc2ccccc2c1	ZINC000450663225	CF	On-Demand	Anodyne	TPH1	49	39
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc2ccccc2c1	ZINC000450663226	CF	On-Demand	Anodyne	TPH1	49	39
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(Br)cc1	ZINC000450663232	DE	On-Demand	Anodyne	SDH1	0	43
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(Br)cc1	ZINC000450663233	DE	On-Demand	Anodyne	SDH1	0	43
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cncnc1	ZINC000450663249	EF	On-Demand	Anodyne	TRPV1	15	44
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cncnc1	ZINC000450663249	EF	On-Demand	Anodyne	MAP3K5	47	37
CC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2C(C)C)cc1	ZINC000450663252	FI	On-Demand	Anodyne	PTGDR2	16	44
COC(=O)c1ccc(CN[C@H](C)c2cc(OC)ccc2OC)cc1Cl	ZINC000450663269	FH	On-Demand	Anodyne	AKR1C2	41	35
COC(=O)c1ccc(CN[C@@H](C)c2cc(OC)ccc2OC)cc1Cl	ZINC000450663270	FH	On-Demand	Anodyne	AKR1C2	41	35
Cn1c(COc2ccc(Cl)cc2)nnc1SC1CC(OC(C)(C)C)C1	ZINC000450663288	GI	On-Demand	Anodyne	VCP	70	45
COCCOC[C@H](O)CN[C@H](C)c1cccc2ccccc12	ZINC000450663289	DF	On-Demand	Anodyne	ADRB2	23	40
COCCOC[C@H](O)CN[C@H](C)c1cccc2ccccc12	ZINC000450663289	DF	On-Demand	Anodyne	CYP2D26	0	48
COCCOC[C@H](O)CN[C@@H](C)c1cccc2ccccc12	ZINC000450663290	DF	On-Demand	Anodyne	ADRB2	23	40
COCCOC[C@H](O)CN[C@@H](C)c1cccc2ccccc12	ZINC000450663290	DF	On-Demand	Anodyne	CYP2D26	0	48
COCCOC[C@@H](O)CN[C@@H](C)c1cccc2ccccc12	ZINC000450663291	DF	On-Demand	Anodyne	ADRB2	23	40
COCCOC[C@@H](O)CN[C@@H](C)c1cccc2ccccc12	ZINC000450663291	DF	On-Demand	Anodyne	CYP2D26	0	48
COCCOC[C@@H](O)CN[C@H](C)c1cccc2ccccc12	ZINC000450663292	DF	On-Demand	Anodyne	ADRB2	23	40
COCCOC[C@@H](O)CN[C@H](C)c1cccc2ccccc12	ZINC000450663292	DF	On-Demand	Anodyne	CYP2D26	0	48
CNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nn1	ZINC000450663302	FF	On-Demand	Anodyne	SCD1	45	42
CNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nn1	ZINC000450663302	FF	On-Demand	Anodyne	SCD	36	41
CCCOc1ccc([C@H](C)NCCC[C@H](C)O)cc1OC	ZINC000450663339	CG	On-Demand	Anodyne	CALM3	0	53
CCCOc1ccc([C@H](C)NCCC[C@@H](C)O)cc1OC	ZINC000450663340	CG	On-Demand	Anodyne	CALM3	0	53
CCCOc1ccc([C@@H](C)NCCC[C@H](C)O)cc1OC	ZINC000450663341	CG	On-Demand	Anodyne	CALM3	0	53
CCCOc1ccc([C@@H](C)NCCC[C@@H](C)O)cc1OC	ZINC000450663342	CG	On-Demand	Anodyne	CALM3	0	53
CC[C@H](C)Oc1cc(CNC(=O)CCOc2cccc(OC)c2)ccn1	ZINC000450663343	FG	On-Demand	Anodyne	MTNR1A	50	52
CC[C@H](C)Oc1cc(CNC(=O)CCOc2cccc(OC)c2)ccn1	ZINC000450663343	FG	On-Demand	Anodyne	MTNR1B	43	52
CC[C@H](C)Oc1cc(CNC(=O)CCOc2cccc(OC)c2)ccn1	ZINC000450663343	FG	On-Demand	Anodyne	PDS	47	34
CC[C@@H](C)Oc1cc(CNC(=O)CCOc2cccc(OC)c2)ccn1	ZINC000450663344	FG	On-Demand	Anodyne	MTNR1A	50	52
CC[C@@H](C)Oc1cc(CNC(=O)CCOc2cccc(OC)c2)ccn1	ZINC000450663344	FG	On-Demand	Anodyne	MTNR1B	43	52
CC[C@@H](C)Oc1cc(CNC(=O)CCOc2cccc(OC)c2)ccn1	ZINC000450663344	FG	On-Demand	Anodyne	PDS	47	34
CCOc1ccccc1[C@H](CC)NCC1(C#N)CCC1	ZINC000450663353	CH	On-Demand	Mild	HCN1	50	34
CCOc1ccccc1[C@H](CC)NCC1(C#N)CCC1	ZINC000450663353	CH	On-Demand	Mild	HCN4	43	34
CCOc1ccccc1[C@@H](CC)NCC1(C#N)CCC1	ZINC000450663354	CH	On-Demand	Mild	HCN1	50	34
CCOc1ccccc1[C@@H](CC)NCC1(C#N)CCC1	ZINC000450663354	CH	On-Demand	Mild	HCN4	43	34
CC(F)(F)CCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1	ZINC000450663390	GK	On-Demand	Anodyne	HCRTR2	20	41
COc1cc([C@@H](C)NCc2cccc(C)n2)ccc1OCc1ccccc1	ZINC000450663392	FJ	On-Demand	Anodyne	DRTS_PLAFK	20	42
COc1cc([C@H](C)NCc2cccc(C)n2)ccc1OCc1ccccc1	ZINC000450663393	FJ	On-Demand	Anodyne	DRTS_PLAFK	20	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663406	DH	On-Demand	Anodyne	NQO2	41	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663406	DH	On-Demand	Anodyne	HTR6	40	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663406	DH	On-Demand	Anodyne	PPARD	45	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663406	DH	On-Demand	Anodyne	MTNR1A	44	47
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663406	DH	On-Demand	Anodyne	MTNR1B	42	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663406	DH	On-Demand	Anodyne	EBP	19	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663407	DH	On-Demand	Anodyne	NQO2	41	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663407	DH	On-Demand	Anodyne	HTR6	40	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663407	DH	On-Demand	Anodyne	PPARD	45	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CC1CC(F)(F)C1	ZINC000450663407	DH	On-Demand	Anodyne	EBP	19	45
CC[C@](C)(NCc1c(C)cccc1Cl)C(=O)OC	ZINC000450663428	CG	On-Demand	Anodyne	EIF2AK1	41	37
CC[C@@](C)(NCc1c(C)cccc1Cl)C(=O)OC	ZINC000450663429	CG	On-Demand	Anodyne	EIF2AK1	41	37
Cc1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c2ccccc2n1	ZINC000450663430	EH	On-Demand	Anodyne	ADAM17	42	33
Cc1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c2ccccc2n1	ZINC000450663431	EH	On-Demand	Anodyne	ADAM17	42	33
Cc1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c2ccccc2n1	ZINC000450663432	EH	On-Demand	Anodyne	ADAM17	42	33
Cc1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c2ccccc2n1	ZINC000450663433	EH	On-Demand	Anodyne	ADAM17	42	33
CCOC(=O)c1cc(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)on1	ZINC000450663448	GD	On-Demand	Anodyne	ACACA	56	39
CCOC(=O)c1cc(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)on1	ZINC000450663449	GD	On-Demand	Anodyne	ACACA	56	39
CC[C@H]1Cc2ccccc2CN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450663455	DG	On-Demand	Anodyne	CFTR	41	34
CC[C@H]1Cc2ccccc2CN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450663455	DG	On-Demand	Anodyne	BCL2	22	40
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	HTR1A	16	63
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	THRA	45	36
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	DRD2	38	58
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	DRD1	24	52
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	DRD4	28	52
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	ACHE	22	47
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	HTR2A	44	56
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	HTR2C	28	62
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	ADRA1A	15	40
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	HRH1	20	51
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	ADRA1B	15	51
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	DRD3	17	52
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	SLC6A3	15	44
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	ERG2	23	50
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	HTR7	19	50
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	SIGMAR1	28	57
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	CCR3	48	44
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	SLC18A3	0	48
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	HTR3B	0	50
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	MCHR1	21	48
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	CYP2J2	65	47
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	NET	0	50
CN(C)CCCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450663473	EH	On-Demand	Anodyne	AP2S1	0	50
CC[C@@H]1Cc2ccccc2CN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450663488	DG	On-Demand	Anodyne	CFTR	41	34
CC[C@@H]1Cc2ccccc2CN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450663488	DG	On-Demand	Anodyne	BCL2	22	40
CC[C@H](NC[C@](C)(O)C(C)=O)c1ccc(Cl)cc1	ZINC000450663489	CF	On-Demand	Anodyne	UTS2	43	35
CC[C@@H](NC[C@](C)(O)C(C)=O)c1ccc(Cl)cc1	ZINC000450663499	CF	On-Demand	Anodyne	UTS2	43	35
CN(CCN1CCC[C@](C)(O)C1)Cc1ccccc1	ZINC000450663500	CD	On-Demand	Anodyne	SIGMAR1	33	43
CN(CCN1CCC[C@](C)(O)C1)Cc1ccccc1	ZINC000450663500	CD	On-Demand	Anodyne	SLC12A5	56	34
CN(CCN1CCC[C@@](C)(O)C1)Cc1ccccc1	ZINC000450663501	CD	On-Demand	Anodyne	SIGMAR1	33	43
CN(CCN1CCC[C@@](C)(O)C1)Cc1ccccc1	ZINC000450663501	CD	On-Demand	Anodyne	SLC12A5	56	34
CC[C@H](NC[C@@](C)(O)C(C)=O)c1ccc(Cl)cc1	ZINC000450663508	CF	On-Demand	Anodyne	UTS2	43	35
CC[C@@H](NC[C@@](C)(O)C(C)=O)c1ccc(Cl)cc1	ZINC000450663509	CF	On-Demand	Anodyne	UTS2	43	35
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cc(C#N)[nH]c2C)cc1	ZINC000450663512	EE	On-Demand	Mild	ACACA	50	36
COC(=O)COc1ccc([C@H](C)NC(=O)c2cc(C#N)[nH]c2C)cc1	ZINC000450663513	EE	On-Demand	Mild	ACACA	50	36
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450663516	CH	On-Demand	Anodyne	PREP	30	40
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450663516	CH	On-Demand	Anodyne	ADAM9	42	32
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450663517	CH	On-Demand	Anodyne	PREP	30	40
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450663517	CH	On-Demand	Anodyne	ADAM9	42	32
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450663518	CH	On-Demand	Anodyne	PREP	30	40
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450663518	CH	On-Demand	Anodyne	ADAM9	42	32
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450663519	CH	On-Demand	Anodyne	PREP	30	40
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450663519	CH	On-Demand	Anodyne	ADAM9	42	32
C[C@@H]1CCO[C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450663520	CE	On-Demand	Bother	SLC27A4	42	30
CC[C@@H](O)CC(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663536	FE	On-Demand	Anodyne	CACNA1B	24	40
CC[C@@H](O)CC(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663536	FE	On-Demand	Anodyne	BDKRB1	44	39
CC[C@@H](O)CC(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663536	FE	On-Demand	Anodyne	CCR2	89	38
CC[C@@H](O)CC(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663536	FE	On-Demand	Anodyne	LUXR	23	44
CC[C@H](O)CC(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663537	FE	On-Demand	Anodyne	CACNA1B	24	40
CC[C@H](O)CC(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663537	FE	On-Demand	Anodyne	BDKRB1	44	39
CC[C@H](O)CC(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663537	FE	On-Demand	Anodyne	CCR2	89	38
CC[C@H](O)CC(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663537	FE	On-Demand	Anodyne	LUXR	23	44
CC[C@@H](O)CC(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663538	FE	On-Demand	Anodyne	CACNA1B	24	40
CC[C@@H](O)CC(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663538	FE	On-Demand	Anodyne	BDKRB1	44	39
CC[C@@H](O)CC(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663538	FE	On-Demand	Anodyne	CCR2	89	38
CC[C@@H](O)CC(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663538	FE	On-Demand	Anodyne	LUXR	23	44
CC[C@H](O)CC(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663539	FE	On-Demand	Anodyne	CACNA1B	24	40
CC[C@H](O)CC(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663539	FE	On-Demand	Anodyne	BDKRB1	44	39
CC[C@H](O)CC(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663539	FE	On-Demand	Anodyne	CCR2	89	38
CC[C@H](O)CC(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450663539	FE	On-Demand	Anodyne	LUXR	23	44
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450663540	FF	On-Demand	Anodyne	TK	23	42
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450663541	FF	On-Demand	Anodyne	TK	23	42
CC[C@@H](CC(C)C)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663542	EG	On-Demand	Anodyne	ACACA	26	44
CC[C@@H](CC(C)C)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663542	EG	On-Demand	Anodyne	ACACB	34	45
CC[C@@H](CC(C)C)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663542	EG	On-Demand	Anodyne	CAPN2	41	32
CC[C@@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663543	EG	On-Demand	Anodyne	ACACA	26	44
CC[C@@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663543	EG	On-Demand	Anodyne	ACACB	34	45
CC[C@@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663543	EG	On-Demand	Anodyne	CAPN2	41	32
CC[C@H](CC(C)C)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663544	EG	On-Demand	Anodyne	ACACA	26	44
CC[C@H](CC(C)C)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663544	EG	On-Demand	Anodyne	ACACB	34	45
CC[C@H](CC(C)C)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663544	EG	On-Demand	Anodyne	CAPN2	41	32
CC[C@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663545	EG	On-Demand	Anodyne	ACACA	26	44
CC[C@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663545	EG	On-Demand	Anodyne	ACACB	34	45
CC[C@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663545	EG	On-Demand	Anodyne	CAPN2	41	32
CC(=O)CCCCCSc1nnc(-c2cccnc2)n1Cc1ccco1	ZINC000450663546	FI	On-Demand	Anodyne	HCRTR2	22	43
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCC2)cc1	ZINC000450663547	FH	On-Demand	Anodyne	CA2	15	42
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCC2)cc1	ZINC000450663547	FH	On-Demand	Anodyne	CA5A	15	42
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCC2)cc1	ZINC000450663547	FH	On-Demand	Anodyne	E1	0	48
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCC2)cc1	ZINC000450663547	FH	On-Demand	Anodyne	RORC	45	39
CCS(=O)(=O)c1ccc(CNC(=O)C2=C(c3ccccc3)CCC2)cc1	ZINC000450663547	FH	On-Demand	Anodyne	NAMPT	58	38
O=C(N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450663548	GG	On-Demand	Anodyne	RBP4	57	36
O=C(N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450663549	GG	On-Demand	Anodyne	RBP4	57	36
CC[C@@H]1C[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663551	DE	On-Demand	Anodyne	SDH1	0	42
CC[C@@H]1C[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663551	DE	On-Demand	Anodyne	ACACA	24	40
CC[C@@H]1C[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663551	DE	On-Demand	Anodyne	ACACB	32	46
CC[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663552	DE	On-Demand	Anodyne	SDH1	0	42
CC[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663552	DE	On-Demand	Anodyne	ACACA	24	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450663552	DE	On-Demand	Anodyne	ACACB	32	46
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450663559	DG	On-Demand	Anodyne	OPRD1	56	35
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450663559	DG	On-Demand	Anodyne	ADAM9	59	34
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450663559	DG	On-Demand	Anodyne	TPP2	44	30
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450663560	DG	On-Demand	Anodyne	OPRD1	56	35
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450663560	DG	On-Demand	Anodyne	ADAM9	59	34
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450663560	DG	On-Demand	Anodyne	TPP2	44	30
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450663561	DG	On-Demand	Anodyne	OPRD1	56	35
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450663561	DG	On-Demand	Anodyne	ADAM9	59	34
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450663561	DG	On-Demand	Anodyne	TPP2	44	30
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450663562	DG	On-Demand	Anodyne	OPRD1	56	35
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450663562	DG	On-Demand	Anodyne	ADAM9	59	34
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450663562	DG	On-Demand	Anodyne	TPP2	44	30
Cc1cccc(Cl)c1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663571	FI	On-Demand	Anodyne	LUXN	0	43
Cc1cccc(Cl)c1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663571	FI	On-Demand	Anodyne	ADIPOR1	0	43
Cc1cccc(Cl)c1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663571	FI	On-Demand	Anodyne	ADIPOR2	0	43
Cc1cccc(Cl)c1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663572	FI	On-Demand	Anodyne	LUXN	0	43
Cc1cccc(Cl)c1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663572	FI	On-Demand	Anodyne	ADIPOR1	0	43
Cc1cccc(Cl)c1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663572	FI	On-Demand	Anodyne	ADIPOR2	0	43
O=C(CCCC(=O)C1CC1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450663575	DG	On-Demand	Bother	P2RX7	43	35
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C1(CF)CCOCC1	ZINC000450663578	EF	On-Demand	Bother	P2RX7	15	41
C[C@@H](NC[C@H]1CCCCC1(F)F)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663588	FH	On-Demand	Anodyne	LUXN	0	46
C[C@H](NC[C@H]1CCCCC1(F)F)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663589	FH	On-Demand	Anodyne	LUXN	0	46
C[C@H](NC[C@@H]1CCCCC1(F)F)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663590	FH	On-Demand	Anodyne	LUXN	0	46
C[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663591	FH	On-Demand	Anodyne	LUXN	0	46
CC(C)(C)OC1CC(Sc2nnc(-c3cccnc3)n2Cc2ccco2)C1	ZINC000450663592	GI	On-Demand	Anodyne	HCRTR2	0	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(C)C2=O)cc1	ZINC000450663593	ED	On-Demand	Anodyne	ACACA	51	42
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(C)C2=O)cc1	ZINC000450663593	ED	On-Demand	Anodyne	ACACB	25	42
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CCCN(C)C2=O)cc1	ZINC000450663595	ED	On-Demand	Anodyne	ACACA	51	42
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CCCN(C)C2=O)cc1	ZINC000450663595	ED	On-Demand	Anodyne	ACACB	25	42
C[C@H](O)CCCN[C@H](CN1CCOCC1)c1ccccc1	ZINC000450663596	CD	On-Demand	Anodyne	CASR	57	36
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCCN(C)C2=O)cc1	ZINC000450663597	ED	On-Demand	Anodyne	ACACA	51	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCCN(C)C2=O)cc1	ZINC000450663597	ED	On-Demand	Anodyne	ACACB	25	42
C[C@@H](O)CCCN[C@H](CN1CCOCC1)c1ccccc1	ZINC000450663598	CD	On-Demand	Anodyne	CASR	57	36
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(C)C2=O)cc1	ZINC000450663599	ED	On-Demand	Anodyne	ACACA	51	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(C)C2=O)cc1	ZINC000450663599	ED	On-Demand	Anodyne	ACACB	25	42
C[C@H](O)CCCN[C@@H](CN1CCOCC1)c1ccccc1	ZINC000450663601	CD	On-Demand	Anodyne	CASR	57	36
C[C@@H](O)CCCN[C@@H](CN1CCOCC1)c1ccccc1	ZINC000450663602	CD	On-Demand	Anodyne	CASR	57	36
C[C@H](NCCC[C@@H](C)O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663611	DE	On-Demand	Anodyne	LUXN	0	45
C[C@H](NCCC[C@@H](C)O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663611	DE	On-Demand	Anodyne	ADIPOR1	0	41
C[C@H](NCCC[C@@H](C)O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663611	DE	On-Demand	Anodyne	ADIPOR2	0	41
C[C@H](NCc1ccn(CC(F)(F)F)n1)c1cccc(Cl)c1	ZINC000450663682	DH	On-Demand	Anodyne	CASR	0	43
C[C@@H](NCc1ccn(CC(F)(F)F)n1)c1cccc(Cl)c1	ZINC000450663683	DH	On-Demand	Anodyne	CASR	0	43
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc(Br)ccc1C)CCO2	ZINC000450663698	GH	On-Demand	Anodyne	LUXR	64	37
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc(Br)ccc1C)CCO2	ZINC000450663698	GH	On-Demand	Anodyne	TRAR	80	44
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc(Br)ccc1C)CCO2	ZINC000450663698	GH	On-Demand	Anodyne	LASR	48	38
COc1cc([C@H](C)NCc2cn(CC3CC3)nn2)ccc1OC1CCCC1	ZINC000450663708	FH	On-Demand	Anodyne	PDE4A	37	41
COc1cc([C@H](C)NCc2cn(CC3CC3)nn2)ccc1OC1CCCC1	ZINC000450663708	FH	On-Demand	Anodyne	PDE4B	25	42
COc1cc([C@@H](C)NCc2cn(CC3CC3)nn2)ccc1OC1CCCC1	ZINC000450663709	FH	On-Demand	Anodyne	PDE4A	37	41
COc1cc([C@@H](C)NCc2cn(CC3CC3)nn2)ccc1OC1CCCC1	ZINC000450663709	FH	On-Demand	Anodyne	PDE4B	25	42
COc1cc([C@@H](C)NCc2nnc(C3CC3)s2)ccc1OC1CCCC1	ZINC000450663728	FJ	On-Demand	Anodyne	PDE4A	42	42
COc1cc([C@@H](C)NCc2nnc(C3CC3)s2)ccc1OC1CCCC1	ZINC000450663728	FJ	On-Demand	Anodyne	PDE4B	20	41
COc1cc([C@@H](C)NCc2nnc(C3CC3)s2)ccc1OC1CCCC1	ZINC000450663728	FJ	On-Demand	Anodyne	PDE4D	15	41
COc1cc([C@@H](C)NCc2nnc(C3CC3)s2)ccc1OC1CCCC1	ZINC000450663728	FJ	On-Demand	Anodyne	PDE4C	15	41
COc1cc([C@H](C)NCc2nnc(C3CC3)s2)ccc1OC1CCCC1	ZINC000450663729	FJ	On-Demand	Anodyne	PDE4A	42	42
COc1cc([C@H](C)NCc2nnc(C3CC3)s2)ccc1OC1CCCC1	ZINC000450663729	FJ	On-Demand	Anodyne	PDE4B	20	41
COc1cc([C@H](C)NCc2nnc(C3CC3)s2)ccc1OC1CCCC1	ZINC000450663729	FJ	On-Demand	Anodyne	PDE4D	15	41
COc1cc([C@H](C)NCc2nnc(C3CC3)s2)ccc1OC1CCCC1	ZINC000450663729	FJ	On-Demand	Anodyne	PDE4C	15	41
CC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450663730	FI	On-Demand	Anodyne	MPL	16	41
COc1cc([C@H](C)NCCc2cscn2)ccc1OC1CCCC1	ZINC000450663731	EI	On-Demand	Anodyne	PDE4A	42	43
COc1cc([C@H](C)NCCc2cscn2)ccc1OC1CCCC1	ZINC000450663731	EI	On-Demand	Anodyne	PDE4B	18	41
COc1cc([C@H](C)NCCc2cscn2)ccc1OC1CCCC1	ZINC000450663731	EI	On-Demand	Anodyne	PDE4D	19	40
COc1cc([C@@H](C)NCCc2cscn2)ccc1OC1CCCC1	ZINC000450663732	EI	On-Demand	Anodyne	PDE4A	42	43
COc1cc([C@@H](C)NCCc2cscn2)ccc1OC1CCCC1	ZINC000450663732	EI	On-Demand	Anodyne	PDE4B	18	41
COc1cc([C@@H](C)NCCc2cscn2)ccc1OC1CCCC1	ZINC000450663732	EI	On-Demand	Anodyne	PDE4D	19	40
COc1cc(CC(=O)N2CC(C)(C)CC(C)(C)C2)ccc1O	ZINC000450663737	DG	On-Demand	Anodyne	SHBG	19	42
COc1cc(CC(=O)N2CC(C)(C)CC(C)(C)C2)ccc1O	ZINC000450663737	DG	On-Demand	Anodyne	NCE103	27	43
COc1cc(CC(=O)N2CC(C)(C)CC(C)(C)C2)ccc1O	ZINC000450663737	DG	On-Demand	Anodyne	CAN2	0	43
OCC[C@@H](Nc1ccccn1)c1cccc(C(F)(F)F)c1	ZINC000450663751	CH	On-Demand	Anodyne	PHES	0	41
OCC[C@H](Nc1ccccn1)c1cccc(C(F)(F)F)c1	ZINC000450663752	CH	On-Demand	Anodyne	PHES	0	41
FC(F)(F)c1csc(C2CCN(c3ncccc3C(F)(F)F)CC2)n1	ZINC000450663775	GJ	On-Demand	Anodyne	TRPV1	31	45
FC(F)(F)c1csc(C2CCN(c3ncccc3C(F)(F)F)CC2)n1	ZINC000450663775	GJ	On-Demand	Anodyne	RBP4	22	46
COCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663776	GG	On-Demand	Anodyne	GCGR	18	45
COCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663776	GG	On-Demand	Anodyne	MTTP	34	40
COCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663776	GG	On-Demand	Anodyne	EPHX2	0	45
COCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663776	GG	On-Demand	Anodyne	SCD1	30	43
COCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663776	GG	On-Demand	Anodyne	SCD	22	40
COCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663777	GG	On-Demand	Anodyne	GCGR	18	45
COCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663777	GG	On-Demand	Anodyne	MTTP	34	40
COCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663777	GG	On-Demand	Anodyne	EPHX2	0	45
COCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663777	GG	On-Demand	Anodyne	SCD1	30	43
COCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450663777	GG	On-Demand	Anodyne	SCD	22	40
CS(=O)(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)cc1	ZINC000450663790	FH	On-Demand	Anodyne	CACNA1B	41	33
CS(=O)(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)cc1	ZINC000450663791	FH	On-Demand	Anodyne	CACNA1B	41	33
COc1cc(CC(=O)N[C@@H]2C[C@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663802	DF	On-Demand	Anodyne	TRPV1	36	49
COc1cc(CC(=O)N[C@@H]2C[C@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663802	DF	On-Demand	Anodyne	NCE103	26	45
COc1cc(CC(=O)N[C@@H]2C[C@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663802	DF	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)N[C@H]2C[C@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663803	DF	On-Demand	Anodyne	TRPV1	36	49
COc1cc(CC(=O)N[C@H]2C[C@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663803	DF	On-Demand	Anodyne	NCE103	26	45
COc1cc(CC(=O)N[C@H]2C[C@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663803	DF	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)N[C@@H]2C[C@@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663804	DF	On-Demand	Anodyne	TRPV1	36	49
COc1cc(CC(=O)N[C@@H]2C[C@@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663804	DF	On-Demand	Anodyne	NCE103	26	45
COc1cc(CC(=O)N[C@@H]2C[C@@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663804	DF	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)N[C@H]2C[C@@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663805	DF	On-Demand	Anodyne	TRPV1	36	49
COc1cc(CC(=O)N[C@H]2C[C@@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663805	DF	On-Demand	Anodyne	NCE103	26	45
COc1cc(CC(=O)N[C@H]2C[C@@H](OC(C)C)C2(C)C)ccc1O	ZINC000450663805	DF	On-Demand	Anodyne	CAN2	0	45
CCC(=O)CCCN1CC[C@](O)(Cc2cccc(Cl)c2)C1	ZINC000450663814	DG	On-Demand	Anodyne	CCR1	40	38
CCC(=O)CCCN1CC[C@@](O)(Cc2cccc(Cl)c2)C1	ZINC000450663815	DG	On-Demand	Anodyne	CCR1	40	38
C[C@H](O)CCCN1CCCC[C@@H]1c1ncc(-c2cccc(F)c2)[nH]1	ZINC000450663816	EH	On-Demand	Anodyne	PRCP	0	51
C[C@@H](O)CCCN1CCCC[C@H]1c1ncc(-c2cccc(F)c2)[nH]1	ZINC000450663817	EH	On-Demand	Anodyne	PRCP	0	51
C[C@H](O)CCCN1CCCC[C@H]1c1ncc(-c2cccc(F)c2)[nH]1	ZINC000450663818	EH	On-Demand	Anodyne	PRCP	0	51
C[C@@H](O)CCCN1CCCC[C@@H]1c1ncc(-c2cccc(F)c2)[nH]1	ZINC000450663819	EH	On-Demand	Anodyne	PRCP	0	51
O=C(NCC(Cc1ccccc1)Cc1ccccc1)c1cn(CC2CC2)nn1	ZINC000450663830	FH	On-Demand	Anodyne	F11	42	32
Cc1cc([N+](=O)[O-])cnc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450663837	EF	On-Demand	Bother	CACNA1C	45	34
Cc1cc([N+](=O)[O-])cnc1N1C[C@@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450663837	EF	On-Demand	Bother	CACNA1D	60	33
Cc1cc([N+](=O)[O-])cnc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450663838	EF	On-Demand	Bother	CACNA1C	45	34
Cc1cc([N+](=O)[O-])cnc1N1C[C@H](c2ccccc2)[C@](F)(CO)C1	ZINC000450663838	EF	On-Demand	Bother	CACNA1D	60	33
Cc1cc([N+](=O)[O-])cnc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450663839	EF	On-Demand	Bother	CACNA1C	45	34
Cc1cc([N+](=O)[O-])cnc1N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450663839	EF	On-Demand	Bother	CACNA1D	60	33
Cc1cc([N+](=O)[O-])cnc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450663840	EF	On-Demand	Bother	CACNA1C	45	34
Cc1cc([N+](=O)[O-])cnc1N1C[C@H](c2ccccc2)[C@@](F)(CO)C1	ZINC000450663840	EF	On-Demand	Bother	CACNA1D	60	33
C[C@H](O)CCCN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663842	DE	On-Demand	Anodyne	LUXN	0	45
C[C@H](O)CCCN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663842	DE	On-Demand	Anodyne	ADIPOR1	0	41
C[C@H](O)CCCN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663842	DE	On-Demand	Anodyne	ADIPOR2	0	41
C[C@@H](O)CCCN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663843	DE	On-Demand	Anodyne	LUXN	0	45
C[C@@H](O)CCCN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663843	DE	On-Demand	Anodyne	ADIPOR1	0	41
C[C@@H](O)CCCN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450663843	DE	On-Demand	Anodyne	ADIPOR2	0	41
Cc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)nn1C(C)C	ZINC000450663845	EG	On-Demand	Bother	P2RX7	52	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	PPARG	40	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	PPARA	32	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	NQO2	39	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	HTR6	27	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	PPARD	53	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	MTNR1A	42	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	MTNR1B	40	38
COc1ccc2c(c1)CCC[C@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663846	EH	On-Demand	Anodyne	EBP	18	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	PPARG	40	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	PPARA	32	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	NQO2	39	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	HTR6	27	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	PPARD	53	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	MTNR1A	42	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	MTNR1B	40	38
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)CCCc1ncc(C)o1	ZINC000450663848	EH	On-Demand	Anodyne	EBP	18	43
CC(C)c1nccc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450663851	DF	On-Demand	Anodyne	SORD	74	41
CC(C)c1nccc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)n1	ZINC000450663853	DF	On-Demand	Anodyne	SORD	74	41
CC(C)c1nccc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450663855	DF	On-Demand	Anodyne	SORD	74	41
CC(C)c1nccc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)n1	ZINC000450663857	DF	On-Demand	Anodyne	SORD	74	41
CCS(=O)(=O)c1ccc(CNC(=O)[C@]2(C)CCC[C@H]2C)cc1	ZINC000450663867	DF	On-Demand	Anodyne	NAMPT	44	33
CCS(=O)(=O)c1ccc(CNC(=O)[C@@]2(C)CCC[C@H]2C)cc1	ZINC000450663869	DF	On-Demand	Anodyne	NAMPT	44	33
NC(=O)c1cnc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c(Cl)c1	ZINC000450663870	EE	On-Demand	Anodyne	P2RY12	28	43
NC(=O)c1cnc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c(Cl)c1	ZINC000450663870	EE	On-Demand	Anodyne	CXCR3	29	42
CCS(=O)(=O)c1ccc(CNC(=O)[C@@]2(C)CCC[C@@H]2C)cc1	ZINC000450663871	DF	On-Demand	Anodyne	NAMPT	44	33
NC(=O)c1cnc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c(Cl)c1	ZINC000450663872	EE	On-Demand	Anodyne	P2RY12	28	43
NC(=O)c1cnc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c(Cl)c1	ZINC000450663872	EE	On-Demand	Anodyne	CXCR3	29	42
CCS(=O)(=O)c1ccc(CNC(=O)[C@]2(C)CCC[C@@H]2C)cc1	ZINC000450663873	DF	On-Demand	Anodyne	NAMPT	44	33
NC(=O)c1cnc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c(Cl)c1	ZINC000450663874	EE	On-Demand	Anodyne	P2RY12	28	43
NC(=O)c1cnc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c(Cl)c1	ZINC000450663874	EE	On-Demand	Anodyne	CXCR3	29	42
NC(=O)c1cnc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c(Cl)c1	ZINC000450663876	EE	On-Demand	Anodyne	P2RY12	28	43
NC(=O)c1cnc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c(Cl)c1	ZINC000450663876	EE	On-Demand	Anodyne	CXCR3	29	42
COc1cc([C@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)cc(OC)c1OC	ZINC000450663889	GK	On-Demand	Anodyne	N1L	0	41
COc1cc([C@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)cc(OC)c1OC	ZINC000450663895	GK	On-Demand	Anodyne	N1L	0	41
COc1cc([C@@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)cc(OC)c1OC	ZINC000450663897	GK	On-Demand	Anodyne	N1L	0	41
COc1cc([C@@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)cc(OC)c1OC	ZINC000450663900	GK	On-Demand	Anodyne	N1L	0	41
N#CC1(CN[C@H](CO)c2ccccc2)CCC1	ZINC000450663902	BE	On-Demand	Mild	MAN1	0	41
N#CC1(CN[C@@H](CO)c2ccccc2)CCC1	ZINC000450663912	BE	On-Demand	Mild	MAN1	0	41
C[C@H](Sc1nnc(-c2cccnc2)n1Cc1ccco1)C(=O)C1CCCCC1	ZINC000450663914	GJ	On-Demand	Anodyne	VCP	44	32
C[C@@H](Sc1nnc(-c2cccnc2)n1Cc1ccco1)C(=O)C1CCCCC1	ZINC000450663916	GJ	On-Demand	Anodyne	VCP	44	32
Cc1cccc(Cl)c1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000450663930	EI	On-Demand	Anodyne	CNR1	29	41
Cc1cccc(Cl)c1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000450663930	EI	On-Demand	Anodyne	DRD4	42	37
Cc1cccc(Cl)c1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000450663930	EI	On-Demand	Anodyne	DRD3	17	40
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(C(F)(F)F)[nH]2)cc1	ZINC000450663934	FG	On-Demand	Anodyne	ACACA	49	38
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(C(F)(F)F)[nH]2)cc1	ZINC000450663935	FG	On-Demand	Anodyne	ACACA	49	38
CCC(=O)C1(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000450663946	DF	On-Demand	Bother	P2RX7	24	41
CC[C@@H](NCc1nc(C(=O)OC)cs1)c1cccc(Cl)c1	ZINC000450663947	DH	On-Demand	Anodyne	PDS	44	37
CC[C@H](NCc1nc(C(=O)OC)cs1)c1cccc(Cl)c1	ZINC000450663948	DH	On-Demand	Anodyne	PDS	44	37
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000450663952	EI	On-Demand	Anodyne	CNR1	29	41
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000450663952	EI	On-Demand	Anodyne	DRD4	42	37
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000450663952	EI	On-Demand	Anodyne	DRD3	17	40
CC(C)C[C@@H]1C[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450663954	DH	On-Demand	Bother	P2RX7	35	40
CCC[C@@H](OC)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450663955	DF	On-Demand	Bother	CACNA1D	41	33
CCC[C@H](OC)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450663956	DF	On-Demand	Bother	CACNA1D	41	33
O=C(CC[C@H]1CCC(=O)N1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450663972	ED	On-Demand	Bother	P2RX7	52	48
O=C(CC[C@@H]1CCC(=O)N1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450663973	ED	On-Demand	Bother	P2RX7	52	48
Cc1ccc(NC(=O)c2ccc(N[C@H]3CCCNC3=O)c([N+](=O)[O-])c2)cc1	ZINC000450663976	FF	On-Demand	Bother	TAAR1	18	45
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cc(C)c(C(N)=O)cn2)cc1	ZINC000450663978	FD	On-Demand	Anodyne	ACACA	57	37
COC(=O)COc1ccc([C@H](C)NC(=O)c2cc(C)c(C(N)=O)cn2)cc1	ZINC000450663979	FD	On-Demand	Anodyne	ACACA	57	37
FC1(F)CC(CSc2nnc(-c3ccccc3)n2Cc2ccco2)C1	ZINC000450663980	FJ	On-Demand	Anodyne	HCRTR2	21	44
CC[C@@H]1CCC[C@H]1CNc1cc(C)nc2ncnn12	ZINC000450664002	CF	On-Demand	Anodyne	DHOD	0	56
CC[C@H]1CCC[C@@H]1CNc1cc(C)nc2ncnn12	ZINC000450664003	CF	On-Demand	Anodyne	DHOD	0	56
CC[C@H]1CCC[C@H]1CNc1cc(C)nc2ncnn12	ZINC000450664004	CF	On-Demand	Anodyne	DHOD	0	56
CC[C@@H]1CCC[C@@H]1CNc1cc(C)nc2ncnn12	ZINC000450664005	CF	On-Demand	Anodyne	DHOD	0	56
COC(=O)C1(CN[C@@H](C)c2ccc3c(c2)OCO3)CC1	ZINC000450664016	CE	On-Demand	Anodyne	EDNRB	51	35
COC(=O)C1(CN[C@@H](C)c2ccc3c(c2)OCO3)CC1	ZINC000450664016	CE	On-Demand	Anodyne	EDNRA	41	34
OCC[C@H](Nc1cc(N2CCCCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450664017	GI	On-Demand	Anodyne	PRCP	0	40
COC(=O)C1(CN[C@H](C)c2ccc3c(c2)OCO3)CC1	ZINC000450664018	CE	On-Demand	Anodyne	EDNRB	51	35
COC(=O)C1(CN[C@H](C)c2ccc3c(c2)OCO3)CC1	ZINC000450664018	CE	On-Demand	Anodyne	EDNRA	41	34
OCC[C@@H](Nc1cc(N2CCCCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450664019	GI	On-Demand	Anodyne	PRCP	0	40
CC[C@H](NCC1(C#N)CCC1)c1ccccc1OCC(=O)N(C)C	ZINC000450664020	EF	On-Demand	Mild	HCN4	42	33
CC[C@@H](NCC1(C#N)CCC1)c1ccccc1OCC(=O)N(C)C	ZINC000450664021	EF	On-Demand	Mild	HCN4	42	33
COc1cc([C@H](C)NCc2cccnc2N)ccc1OC1CCCC1	ZINC000450664026	EH	On-Demand	Anodyne	PDE4A	55	43
COc1cc([C@H](C)NCc2cccnc2N)ccc1OC1CCCC1	ZINC000450664026	EH	On-Demand	Anodyne	PDE4B	29	42
COc1cc([C@H](C)NCc2cccnc2N)ccc1OC1CCCC1	ZINC000450664026	EH	On-Demand	Anodyne	PDE4D	33	43
COc1cc([C@@H](C)NCc2cccnc2N)ccc1OC1CCCC1	ZINC000450664028	EH	On-Demand	Anodyne	PDE4A	55	43
COc1cc([C@@H](C)NCc2cccnc2N)ccc1OC1CCCC1	ZINC000450664028	EH	On-Demand	Anodyne	PDE4B	29	42
COc1cc([C@@H](C)NCc2cccnc2N)ccc1OC1CCCC1	ZINC000450664028	EH	On-Demand	Anodyne	PDE4D	33	43
O=C(NCC(F)(F)CO)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450664066	FE	On-Demand	Anodyne	CYP2D6	15	43
O=C(NCC(F)(F)CO)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450664067	FE	On-Demand	Anodyne	CYP2D6	15	43
COc1ccccc1Oc1ccc(C(=O)NCCc2cn3c(n2)SCC3)nc1	ZINC000450664075	GG	On-Demand	Anodyne	DRD2	18	42
COc1ccccc1Oc1ccc(C(=O)NCCc2cn3c(n2)SCC3)nc1	ZINC000450664075	GG	On-Demand	Anodyne	DRD3	36	42
COCCOc1ccc([C@H](C)NCc2c(C)cccc2Cl)cc1OC	ZINC000450664080	FJ	On-Demand	Anodyne	EIF2AK1	48	39
COCCOc1ccc([C@@H](C)NCc2c(C)cccc2Cl)cc1OC	ZINC000450664084	FJ	On-Demand	Anodyne	EIF2AK1	48	39
COc1ccc(F)cc1[C@@H](C)NCc1noc(-c2cncc(C)c2)n1	ZINC000450664090	EG	On-Demand	Anodyne	GRIN2B	27	40
COc1ccc(F)cc1[C@H](C)NCc1noc(-c2cncc(C)c2)n1	ZINC000450664091	EG	On-Demand	Anodyne	GRIN2B	27	40
CC[C@H](O)CC(=O)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450664093	GF	On-Demand	Anodyne	CTSS	16	41
CC[C@H](O)CC(=O)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450664093	GF	On-Demand	Anodyne	EPHX2	41	46
CC[C@@H](O)CC(=O)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450664095	GF	On-Demand	Anodyne	CTSS	16	41
CC[C@@H](O)CC(=O)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450664095	GF	On-Demand	Anodyne	EPHX2	41	46
COc1cc([C@@H](C)NCc2cnns2)ccc1OC1CCCC1	ZINC000450664100	EH	On-Demand	Anodyne	PDE4A	42	42
COc1cc([C@@H](C)NCc2cnns2)ccc1OC1CCCC1	ZINC000450664100	EH	On-Demand	Anodyne	PDE4B	22	40
COc1cc([C@@H](C)NCc2cnns2)ccc1OC1CCCC1	ZINC000450664100	EH	On-Demand	Anodyne	PDE4C	15	40
COc1cc([C@H](C)NCc2cnns2)ccc1OC1CCCC1	ZINC000450664101	EH	On-Demand	Anodyne	PDE4A	42	42
COc1cc([C@H](C)NCc2cnns2)ccc1OC1CCCC1	ZINC000450664101	EH	On-Demand	Anodyne	PDE4B	22	40
COc1cc([C@H](C)NCc2cnns2)ccc1OC1CCCC1	ZINC000450664101	EH	On-Demand	Anodyne	PDE4C	15	40
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(O)c(F)c1)CCO2	ZINC000450664126	EF	On-Demand	Anodyne	PHZR	0	44
CCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664141	GH	On-Demand	Anodyne	GCGR	22	50
CCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664141	GH	On-Demand	Anodyne	MTTP	32	49
CCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664141	GH	On-Demand	Anodyne	CCR2	47	36
CCCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664141	GH	On-Demand	Anodyne	EPHX2	0	44
CCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664142	GH	On-Demand	Anodyne	GCGR	22	50
CCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664142	GH	On-Demand	Anodyne	MTTP	32	49
CCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664142	GH	On-Demand	Anodyne	CCR2	47	36
CCCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664142	GH	On-Demand	Anodyne	EPHX2	0	44
FC(F)(F)c1csc(C2CCN(c3ccc(Cl)cn3)CC2)n1	ZINC000450664144	EJ	On-Demand	Anodyne	NPBWR1	45	33
CN(C)C(=O)N1CCN(C(=O)c2cn(CCc3ccccc3)nn2)C(C)(C)C1	ZINC000450664181	GD	On-Demand	Anodyne	THYX_PBCV1	0	40
CCc1cccc(C(=O)NCC(F)(F)CO)n1	ZINC000450664191	BD	On-Demand	Anodyne	PDE5A	0	40
COCCn1c(NC(=O)[C@@]2(C#N)C[C@H]2C)nc2ccccc21	ZINC000450664213	CE	On-Demand	Mild	HRH1	18	45
COCCn1c(NC(=O)[C@@]2(C#N)C[C@H]2C)nc2ccccc21	ZINC000450664213	CE	On-Demand	Mild	ITK	40	42
COCCn1c(NC(=O)[C@]2(C#N)C[C@H]2C)nc2ccccc21	ZINC000450664214	CE	On-Demand	Mild	HRH1	18	45
COCCn1c(NC(=O)[C@]2(C#N)C[C@H]2C)nc2ccccc21	ZINC000450664214	CE	On-Demand	Mild	ITK	40	42
COCCn1c(NC(=O)[C@@]2(C#N)C[C@@H]2C)nc2ccccc21	ZINC000450664215	CE	On-Demand	Mild	HRH1	18	45
COCCn1c(NC(=O)[C@@]2(C#N)C[C@@H]2C)nc2ccccc21	ZINC000450664215	CE	On-Demand	Mild	ITK	40	42
COCCn1c(NC(=O)[C@]2(C#N)C[C@@H]2C)nc2ccccc21	ZINC000450664216	CE	On-Demand	Mild	HRH1	18	45
COCCn1c(NC(=O)[C@]2(C#N)C[C@@H]2C)nc2ccccc21	ZINC000450664216	CE	On-Demand	Mild	ITK	40	42
COCCn1c(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)nc2ccccc21	ZINC000450664221	EF	On-Demand	Anodyne	HRH1	0	47
COc1ccc(C[C@H](NCCC[C@@H](C)O)c2ccccc2)cc1OC	ZINC000450664238	EH	On-Demand	Anodyne	ADRB3	29	48
COc1ccc(C[C@H](NCCC[C@@H](C)O)c2ccccc2)cc1OC	ZINC000450664238	EH	On-Demand	Anodyne	SOAT1	0	57
COc1ccc(C[C@H](NCCC[C@H](C)O)c2ccccc2)cc1OC	ZINC000450664239	EH	On-Demand	Anodyne	ADRB3	29	48
COc1ccc(C[C@H](NCCC[C@H](C)O)c2ccccc2)cc1OC	ZINC000450664239	EH	On-Demand	Anodyne	SOAT1	0	57
COc1ccc(C[C@@H](NCCC[C@H](C)O)c2ccccc2)cc1OC	ZINC000450664240	EH	On-Demand	Anodyne	ADRB3	29	48
COc1ccc(C[C@@H](NCCC[C@H](C)O)c2ccccc2)cc1OC	ZINC000450664240	EH	On-Demand	Anodyne	SOAT1	0	57
COc1ccc(C[C@@H](NCCC[C@@H](C)O)c2ccccc2)cc1OC	ZINC000450664241	EH	On-Demand	Anodyne	ADRB3	29	48
COc1ccc(C[C@@H](NCCC[C@@H](C)O)c2ccccc2)cc1OC	ZINC000450664241	EH	On-Demand	Anodyne	SOAT1	0	57
CCCC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664260	GJ	On-Demand	Anodyne	MMP13	24	51
CCCC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664260	GJ	On-Demand	Anodyne	MMP2	15	44
CCCC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664260	GJ	On-Demand	Anodyne	MMP3	26	44
CCCC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664260	GJ	On-Demand	Anodyne	MMP9	22	45
CCCC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664260	GJ	On-Demand	Anodyne	MMP1	23	41
CCCC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664260	GJ	On-Demand	Anodyne	Q9JN24_ECOLX	0	44
CCCC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664261	GJ	On-Demand	Anodyne	MMP13	24	51
CCCC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664261	GJ	On-Demand	Anodyne	MMP2	15	44
CCCC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664261	GJ	On-Demand	Anodyne	MMP3	26	44
CCCC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664261	GJ	On-Demand	Anodyne	MMP9	22	45
CCCC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664261	GJ	On-Demand	Anodyne	MMP1	23	41
CCCC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1ccc(OC)cc1	ZINC000450664261	GJ	On-Demand	Anodyne	Q9JN24_ECOLX	0	44
CNC(=O)C1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450664262	DD	On-Demand	Anodyne	CACNA1B	48	36
CC(C)(C)C(=O)CCCC(=O)Nc1ccc(Oc2nncc3ccccc23)cc1	ZINC000450664274	GK	On-Demand	Anodyne	LTA4H	40	38
Cc1nn(C)cc1COc1ccc(Cl)cc1Br	ZINC000450664288	DH	On-Demand	Anodyne	S1PR4	0	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	DRD4	45	35
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	NQO2	36	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	TRPV1	0	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	NPY2R	40	37
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	HTR6	42	38
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	PPARD	42	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	MTNR1A	26	48
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	MTNR1B	25	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	EBP	16	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664289	EH	On-Demand	Anodyne	CACNA1I	58	34
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	DRD4	45	35
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	NQO2	36	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	TRPV1	0	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	MTR1B_CHICK	0	56
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	NPY2R	40	37
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	HTR6	42	38
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	PPARD	42	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	MTNR1A	26	48
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	MTNR1B	25	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	EBP	16	44
COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1cncc(Cl)c1	ZINC000450664291	EH	On-Demand	Anodyne	CACNA1I	58	34
COCCn1c(NC(=O)C(C)(C)C(C)(F)F)nc2ccccc21	ZINC000450664293	EG	On-Demand	Anodyne	ITK	25	42
O=C(NC1CC1)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450664304	GH	On-Demand	Bother	CASP3	54	39
O=C(NC1CC1)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450664304	GH	On-Demand	Bother	CHRNA10	64	42
O=C(NC1CC1)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450664304	GH	On-Demand	Bother	CASP7	49	39
O=C(NC1CC1)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450664304	GH	On-Demand	Bother	TAAR1	23	42
CCC(CC)(CCSc1nnc(C)n1Cc1ccccc1)C(=O)OC	ZINC000450664314	FI	On-Demand	Anodyne	AGTR1	22	41
CCC(CC)(CCSc1nnc(C)n1Cc1ccccc1)C(=O)OC	ZINC000450664314	FI	On-Demand	Anodyne	PLA2G2A	53	33
COC(=O)c1ccc(C(=O)CSc2nnc(C3CC3)n2Cc2ccccc2)o1	ZINC000450664323	GH	On-Demand	Anodyne	AGTR1	28	40
COC(=O)c1ccc(C(=O)CSc2nnc(C3CC3)n2Cc2ccccc2)o1	ZINC000450664323	GH	On-Demand	Anodyne	SIGMAR1	15	40
COC1(CSc2nnc(-c3ccoc3C)n2Cc2ccccc2)CCC1	ZINC000450664339	FJ	On-Demand	Anodyne	HCRTR2	22	45
C=CCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450664380	EG	On-Demand	Mild	GRIN2B	0	40
C=CCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450664380	EG	On-Demand	Mild	CHRNA10	61	44
C=CCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450664380	EG	On-Demand	Mild	ACKR3	59	36
Cc1occc1-c1nnc(SCCC(C)(F)F)n1Cc1ccccc1	ZINC000450664385	FK	On-Demand	Anodyne	HCRTR2	22	48
CS(=O)(=O)c1cccc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450664387	GG	On-Demand	Bother	CASP3	59	42
CS(=O)(=O)c1cccc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450664387	GG	On-Demand	Bother	CHRNA10	78	46
CS(=O)(=O)c1cccc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450664387	GG	On-Demand	Bother	CASP7	56	42
CCn1nnc(C)c1CSc1nnc(-c2ccccc2)n1Cc1ccco1	ZINC000450664391	GH	On-Demand	Anodyne	HCRTR2	21	44
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC1(F)F	ZINC000450664392	CF	On-Demand	Bother	P2RX7	43	41
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC1(F)F	ZINC000450664392	CF	On-Demand	Bother	CACNA1D	41	32
N#Cc1cc(Br)ccc1C(=O)N[C@H]1CNC(=O)C1	ZINC000450664394	DC	On-Demand	Mild	EZH2	40	35
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC1(F)F	ZINC000450664395	CF	On-Demand	Bother	P2RX7	43	41
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC1(F)F	ZINC000450664395	CF	On-Demand	Bother	CACNA1D	41	32
N#Cc1cc(Br)ccc1C(=O)N[C@@H]1CNC(=O)C1	ZINC000450664396	DC	On-Demand	Mild	EZH2	40	35
CCc1cccc(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)n1	ZINC000450664402	EF	On-Demand	Anodyne	PDE5A	27	42
CCc1cccc(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)n1	ZINC000450664402	EF	On-Demand	Anodyne	ACACA	23	42
CCc1cccc(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)n1	ZINC000450664402	EF	On-Demand	Anodyne	ACACB	29	42
CCc1cccc(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)n1	ZINC000450664403	EF	On-Demand	Anodyne	PDE5A	27	42
CCc1cccc(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)n1	ZINC000450664403	EF	On-Demand	Anodyne	ACACA	23	42
CCc1cccc(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)n1	ZINC000450664403	EF	On-Demand	Anodyne	ACACB	29	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC23CCSCC3)cc1	ZINC000450664409	FF	On-Demand	Anodyne	ACACA	50	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC23CCSCC3)cc1	ZINC000450664409	FF	On-Demand	Anodyne	ACACB	25	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CC23CCSCC3)cc1	ZINC000450664411	FF	On-Demand	Anodyne	ACACA	50	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CC23CCSCC3)cc1	ZINC000450664411	FF	On-Demand	Anodyne	ACACB	25	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CC23CCSCC3)cc1	ZINC000450664413	FF	On-Demand	Anodyne	ACACA	50	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CC23CCSCC3)cc1	ZINC000450664413	FF	On-Demand	Anodyne	ACACB	25	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CC23CCSCC3)cc1	ZINC000450664415	FF	On-Demand	Anodyne	ACACA	50	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CC23CCSCC3)cc1	ZINC000450664415	FF	On-Demand	Anodyne	ACACB	25	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2Cc3c(C)cccc3O2)cc1	ZINC000450664416	FF	On-Demand	Anodyne	ACACA	49	38
COC(=O)c1ccc(OC[C@H]2CCCC2(F)F)c(OC)c1	ZINC000450664418	DG	On-Demand	Anodyne	PDE4D	16	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2Cc3c(C)cccc3O2)cc1	ZINC000450664419	FF	On-Demand	Anodyne	ACACA	49	38
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2Cc3c(C)cccc3O2)cc1	ZINC000450664420	FF	On-Demand	Anodyne	ACACA	49	38
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2Cc3c(C)cccc3O2)cc1	ZINC000450664421	FF	On-Demand	Anodyne	ACACA	49	38
COC(=O)c1ccc(OC[C@@H]2CCCC2(F)F)c(OC)c1	ZINC000450664422	DG	On-Demand	Anodyne	PDE4D	16	40
COc1ccc([C@H](CCO)NCCC[C@@H](C)O)cc1	ZINC000450664432	CD	On-Demand	Anodyne	GPR88	0	40
COc1ccc([C@@H](CCO)NCCC[C@@H](C)O)cc1	ZINC000450664434	CD	On-Demand	Anodyne	GPR88	0	40
COc1ccc([C@@H](CCO)NCCC[C@H](C)O)cc1	ZINC000450664436	CD	On-Demand	Anodyne	GPR88	0	40
COc1ccc([C@H](CCO)NCCC[C@H](C)O)cc1	ZINC000450664438	CD	On-Demand	Anodyne	GPR88	0	40
C[C@@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450664440	GF	On-Demand	Anodyne	LUXN	0	40
C[C@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450664441	GF	On-Demand	Anodyne	LUXN	0	40
CC(=O)CCCCCSc1nnc(-c2ccoc2C)n1Cc1ccccc1	ZINC000450664442	GK	On-Demand	Anodyne	HCRTR2	24	51
COC(=O)COc1ccc([C@@H](C)NC(=O)C(C)(C)C(C)(F)F)cc1	ZINC000450664443	EG	On-Demand	Anodyne	SDH1	0	41
COC(=O)COc1ccc([C@@H](C)NC(=O)C(C)(C)C(C)(F)F)cc1	ZINC000450664443	EG	On-Demand	Anodyne	ACACB	32	41
COC(=O)COc1ccc([C@H](C)NC(=O)C(C)(C)C(C)(F)F)cc1	ZINC000450664444	EG	On-Demand	Anodyne	SDH1	0	41
COC(=O)COc1ccc([C@H](C)NC(=O)C(C)(C)C(C)(F)F)cc1	ZINC000450664444	EG	On-Demand	Anodyne	ACACB	32	41
COC(=O)COc1ccc([C@H](C)NC(=O)c2cccc3c2O[C@@H](C)C3)cc1	ZINC000450664445	FG	On-Demand	Anodyne	ACACA	53	36
COC(=O)COc1ccc([C@H](C)NC(=O)c2cccc3c2O[C@H](C)C3)cc1	ZINC000450664446	FG	On-Demand	Anodyne	ACACA	53	36
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cccc3c2O[C@@H](C)C3)cc1	ZINC000450664447	FG	On-Demand	Anodyne	ACACA	53	36
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cccc3c2O[C@H](C)C3)cc1	ZINC000450664448	FG	On-Demand	Anodyne	ACACA	53	36
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664452	EH	On-Demand	Anodyne	MAOB	30	42
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664452	EH	On-Demand	Anodyne	PTGER3	52	37
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664452	EH	On-Demand	Anodyne	ACACA	47	39
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664452	EH	On-Demand	Anodyne	FFAR1	50	50
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664454	EH	On-Demand	Anodyne	MAOB	30	42
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664454	EH	On-Demand	Anodyne	PTGER3	52	37
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664454	EH	On-Demand	Anodyne	ACACA	47	39
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664454	EH	On-Demand	Anodyne	FFAR1	50	50
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664456	EH	On-Demand	Anodyne	MAOB	30	42
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664456	EH	On-Demand	Anodyne	PTGER3	52	37
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664456	EH	On-Demand	Anodyne	ACACA	47	39
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664456	EH	On-Demand	Anodyne	FFAR1	50	50
CC[C@H](O)CC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	ZINC000450664457	ED	On-Demand	Anodyne	HDAC8	0	45
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664458	EH	On-Demand	Anodyne	MAOB	30	42
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664458	EH	On-Demand	Anodyne	PTGER3	52	37
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664458	EH	On-Demand	Anodyne	ACACA	47	39
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCc2cccc(C)c2)cc1	ZINC000450664458	EH	On-Demand	Anodyne	FFAR1	50	50
CC[C@H](O)CC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	ZINC000450664459	ED	On-Demand	Anodyne	HDAC8	0	45
CCOC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450664460	EG	On-Demand	Anodyne	CA7	22	46
CCOC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450664460	EG	On-Demand	Anodyne	MMP13	25	42
CCOC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450664460	EG	On-Demand	Anodyne	ACR	30	45
CCOC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450664460	EG	On-Demand	Anodyne	ADAMTS4	54	43
CCOC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450664460	EG	On-Demand	Anodyne	FFAR1	30	41
CC[C@@H](O)CC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	ZINC000450664461	ED	On-Demand	Anodyne	HDAC8	0	45
CC[C@@H](O)CC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	ZINC000450664463	ED	On-Demand	Anodyne	HDAC8	0	45
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc(OC(F)F)c1	ZINC000450664464	EI	On-Demand	Anodyne	CASR	15	40
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc(OC(F)F)c1	ZINC000450664465	EI	On-Demand	Anodyne	CASR	15	40
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc(OC(F)F)c1	ZINC000450664466	EI	On-Demand	Anodyne	CASR	15	40
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc(OC(F)F)c1	ZINC000450664467	EI	On-Demand	Anodyne	CASR	15	40
COC(=O)COc1ccc([C@@H](C)NC(=O)c2nn(C)c3c2CCCC3)cc1	ZINC000450664472	FE	On-Demand	Anodyne	ACACA	49	35
COC(=O)COc1ccc([C@H](C)NC(=O)c2nn(C)c3c2CCCC3)cc1	ZINC000450664474	FE	On-Demand	Anodyne	ACACA	49	35
CCOc1cc(NC2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)CC2)ncn1	ZINC000450664481	FE	On-Demand	Anodyne	SSTR5	43	33
CC[C@@](C)(CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450664482	CD	On-Demand	Anodyne	NCE103	22	46
CC[C@@](C)(CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450664482	CD	On-Demand	Anodyne	CAN2	0	46
CC[C@](C)(CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450664487	CD	On-Demand	Anodyne	NCE103	22	46
CC[C@](C)(CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450664487	CD	On-Demand	Anodyne	CAN2	0	46
CC(=O)Nc1cccc([C@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)c1	ZINC000450664488	FK	On-Demand	Anodyne	PTGIR	15	40
CC(=O)Nc1cccc([C@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)c1	ZINC000450664489	FK	On-Demand	Anodyne	PTGIR	15	40
CC(=O)Nc1cccc([C@@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)c1	ZINC000450664490	FK	On-Demand	Anodyne	PTGIR	15	40
CC(=O)Nc1cccc([C@@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)c1	ZINC000450664491	FK	On-Demand	Anodyne	PTGIR	15	40
COC1(CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)CCC1	ZINC000450664496	GJ	On-Demand	Anodyne	HCRTR2	20	41
COc1ccc2c(c1)[C@@H](NC(=O)CCCn1nc(C)nc1C)CCO2	ZINC000450664497	EE	On-Demand	Anodyne	LUXR	47	34
COc1ccc2c(c1)[C@@H](NC(=O)CCCn1nc(C)nc1C)CCO2	ZINC000450664497	EE	On-Demand	Anodyne	TRAR	64	34
COc1ccc2c(c1)[C@@H](NC(=O)CCCn1nc(C)nc1C)CCO2	ZINC000450664497	EE	On-Demand	Anodyne	LASR	45	34
O=C([C@@H]1CC1(F)F)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450664500	EI	On-Demand	Anodyne	FFAR2	54	33
O=C([C@H]1CC1(F)F)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450664501	EI	On-Demand	Anodyne	FFAR2	54	33
O=C([C@H]1CC1(F)F)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450664502	EI	On-Demand	Anodyne	FFAR2	54	33
O=C([C@@H]1CC1(F)F)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450664503	EI	On-Demand	Anodyne	FFAR2	54	33
FC(F)(F)c1csc(C2CCN(c3ccnc(N4CCCCC4)n3)CC2)n1	ZINC000450664506	GI	On-Demand	Anodyne	SORD	25	40
COc1cc([C@@H](C)NC[C@@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664507	FH	On-Demand	Anodyne	PDE4A	36	43
COc1cc([C@@H](C)NC[C@@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664507	FH	On-Demand	Anodyne	PDE4B	19	43
COc1cc([C@@H](C)NC[C@@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664507	FH	On-Demand	Anodyne	PDE4D	17	43
COc1cc([C@H](C)NC[C@@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664508	FH	On-Demand	Anodyne	PDE4A	36	43
COc1cc([C@H](C)NC[C@@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664508	FH	On-Demand	Anodyne	PDE4B	19	43
COc1cc([C@H](C)NC[C@@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664508	FH	On-Demand	Anodyne	PDE4D	17	43
COc1cc([C@@H](C)NC[C@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664509	FH	On-Demand	Anodyne	PDE4A	36	43
COc1cc([C@@H](C)NC[C@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664509	FH	On-Demand	Anodyne	PDE4B	19	43
COc1cc([C@@H](C)NC[C@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664509	FH	On-Demand	Anodyne	PDE4D	17	43
COc1cc([C@H](C)NC[C@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664510	FH	On-Demand	Anodyne	PDE4A	36	43
COc1cc([C@H](C)NC[C@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664510	FH	On-Demand	Anodyne	PDE4B	19	43
COc1cc([C@H](C)NC[C@H]2CCNC(=O)CC2)ccc1OC1CCCC1	ZINC000450664510	FH	On-Demand	Anodyne	PDE4D	17	43
O=C([C@@H](O)C1CCC1)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450664526	GF	On-Demand	Anodyne	EPHX2	48	43
O=C([C@H](O)C1CCC1)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450664527	GF	On-Demand	Anodyne	EPHX2	48	43
CC[C@H](NCC1CC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450664530	FH	On-Demand	Anodyne	HCN1	51	32
CC[C@H](NCC1CC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450664530	FH	On-Demand	Anodyne	HCN4	48	32
CC[C@@H](NCC1CC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450664531	FH	On-Demand	Anodyne	HCN1	51	32
CC[C@@H](NCC1CC(F)(F)C1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450664531	FH	On-Demand	Anodyne	HCN4	48	32
CCn1cnc2c(N[C@H](CCO)c3cccc(C(F)(F)F)c3)ncnc21	ZINC000450664575	FG	On-Demand	Anodyne	CDK1	19	42
CCn1cnc2c(N[C@@H](CCO)c3cccc(C(F)(F)F)c3)ncnc21	ZINC000450664584	FG	On-Demand	Anodyne	CDK1	19	42
COC(=O)c1coc(CSc2nc3ccccc3n2CCC(C)C)n1	ZINC000450664587	FI	On-Demand	Anodyne	PTGDR2	18	48
CCCOc1ccc([C@H](C)NC[C@H](O)CCC)cc1OC	ZINC000450664589	CG	On-Demand	Anodyne	SLC22A3	0	40
CCCOc1ccc([C@@H](C)NC[C@@H](O)CCC)cc1OC	ZINC000450664590	CG	On-Demand	Anodyne	SLC22A3	0	40
CCCOc1ccc([C@@H](C)NC[C@H](O)CCC)cc1OC	ZINC000450664591	CG	On-Demand	Anodyne	SLC22A3	0	40
CCCOc1ccc([C@H](C)NC[C@@H](O)CCC)cc1OC	ZINC000450664592	CG	On-Demand	Anodyne	SLC22A3	0	40
CN(C)C(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664595	FG	On-Demand	Anodyne	SCD1	25	41
CN(C)C(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664596	FG	On-Demand	Anodyne	SCD1	25	41
CC(C)c1nccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)n1	ZINC000450664597	FI	On-Demand	Anodyne	SORD	99	48
O=C(Nc1cncnc1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450664641	DD	On-Demand	Anodyne	DGAT1	27	41
Cn1c(SC[C@@H]2CCCC2(F)F)nnc1-c1ccccc1F	ZINC000450664647	EI	On-Demand	Anodyne	DRD3	41	35
Cn1c(SC[C@H]2CCCC2(F)F)nnc1-c1ccccc1F	ZINC000450664648	EI	On-Demand	Anodyne	DRD3	41	35
CC(=O)CCCCCSc1nnc(-c2ccccc2F)n1C	ZINC000450664664	DH	On-Demand	Anodyne	DRD3	52	38
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc2c(c1)OCO2	ZINC000450664665	EH	On-Demand	Anodyne	NOS2	44	32
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc2c(c1)OCO2	ZINC000450664666	EH	On-Demand	Anodyne	NOS2	44	32
CCOC(=O)c1cccnc1NCc1ccnc(C(F)(F)F)c1	ZINC000450664667	EG	On-Demand	Anodyne	BDKRB1	0	41
Cc1ccc(S[C@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450664695	CH	On-Demand	Anodyne	MAP	0	41
Cc1ccc(S[C@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450664695	CH	On-Demand	Anodyne	MAP1	116	39
Cc1ccc(S[C@@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450664696	CH	On-Demand	Anodyne	MAP	0	41
Cc1ccc(S[C@@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450664696	CH	On-Demand	Anodyne	MAP1	116	39
Cc1ccc(S[C@@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450664696	CH	On-Demand	Anodyne	GCK	24	41
Cc1nc(C)n(CCCC(=O)N2CCC[C@@]2(C)Cc2ccccc2)n1	ZINC000450664722	EG	On-Demand	Anodyne	SLC12A5	69	39
Cc1nc(C)n(CCCC(=O)N2CCC[C@]2(C)Cc2ccccc2)n1	ZINC000450664723	EG	On-Demand	Anodyne	SLC12A5	69	39
Cc1cc([N+](=O)[O-])cnc1N1CCC[C@H]1COc1ccccc1	ZINC000450664725	DG	On-Demand	Bother	CASP3	66	41
Cc1cc([N+](=O)[O-])cnc1N1CCC[C@H]1COc1ccccc1	ZINC000450664725	DG	On-Demand	Bother	CHRNA10	67	48
Cc1cc([N+](=O)[O-])cnc1N1CCC[C@H]1COc1ccccc1	ZINC000450664725	DG	On-Demand	Bother	CASP7	53	41
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450664732	EJ	On-Demand	Anodyne	SLC12A5	71	38
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450664736	EJ	On-Demand	Anodyne	SLC12A5	71	38
C[C@]1(Cc2ccccc2)CCCN1C(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450664738	CI	On-Demand	Anodyne	SLC12A5	76	39
C[C@]1(Cc2ccccc2)CCCN1C(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450664739	CI	On-Demand	Anodyne	SLC12A5	76	39
C[C@]1(Cc2ccccc2)CCCN1C(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450664740	CI	On-Demand	Anodyne	SLC12A5	76	39
C[C@]1(Cc2ccccc2)CCCN1C(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450664741	CI	On-Demand	Anodyne	SLC12A5	76	39
CN(CCN1CC[C@](C)(F)C1)Cc1ccccc1	ZINC000450664767	CF	On-Demand	Anodyne	SIGMAR1	23	40
CN(CCN1CC[C@@](C)(F)C1)Cc1ccccc1	ZINC000450664775	CF	On-Demand	Anodyne	SIGMAR1	23	40
COc1ccc(CN2CCCN(C(=O)c3ccc(C)c4c3CCC4)CC2=O)cc1	ZINC000450664780	GG	On-Demand	Anodyne	FABI	32	40
COCCn1c(NC(=O)CCc2ccc(C(N)=O)cc2)nc2ccccc21	ZINC000450664781	FE	On-Demand	Anodyne	ITK	43	44
COC(=O)c1coc(CN2CCCC[C@H]2c2ncc(-c3cccc(F)c3)[nH]2)n1	ZINC000450664790	GH	On-Demand	Anodyne	COLA	42	40
COC(=O)c1coc(CN2CCCC[C@H]2c2ncc(-c3cccc(F)c3)[nH]2)n1	ZINC000450664790	GH	On-Demand	Anodyne	CPT1A	41	40
COC(=O)c1coc(CN2CCCC[C@@H]2c2ncc(-c3cccc(F)c3)[nH]2)n1	ZINC000450664791	GH	On-Demand	Anodyne	COLA	42	40
COC(=O)c1coc(CN2CCCC[C@@H]2c2ncc(-c3cccc(F)c3)[nH]2)n1	ZINC000450664791	GH	On-Demand	Anodyne	CPT1A	41	40
C[C@@]1(Cc2ccccc2)CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450664816	DH	On-Demand	Anodyne	PREP	42	38
C[C@@]1(Cc2ccccc2)CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450664816	DH	On-Demand	Anodyne	SLC12A5	79	45
C[C@]1(Cc2ccccc2)CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450664817	DH	On-Demand	Anodyne	PREP	42	38
C[C@]1(Cc2ccccc2)CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450664817	DH	On-Demand	Anodyne	SLC12A5	79	45
CCN(C)C(=O)[C@@H](Nc1nc2ccccc2cc1[N+](=O)[O-])C(C)C	ZINC000450664826	EG	On-Demand	Bother	COLA	87	34
COC(=O)c1cccc(OCC[C@@H](C)O)c1	ZINC000450664829	BD	On-Demand	Anodyne	DRD4	40	30
COC(=O)c1cccc(OCC[C@H](C)O)c1	ZINC000450664830	BD	On-Demand	Anodyne	DRD4	40	30
O=C(Cc1ccc(O)c(F)c1)N1CCC[C@H]1c1cc(F)cc(Br)c1	ZINC000450664880	GI	On-Demand	Anodyne	OPRK1	27	43
O=C(Cc1ccc(O)c(F)c1)N1CCC[C@@H]1c1cc(F)cc(Br)c1	ZINC000450664881	GI	On-Demand	Anodyne	OPRK1	27	43
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664894	EF	On-Demand	Anodyne	NR1H4	0	45
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664894	EF	On-Demand	Anodyne	CSF1R	0	50
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664895	EF	On-Demand	Anodyne	NR1H4	0	45
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664895	EF	On-Demand	Anodyne	CSF1R	0	50
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664896	EF	On-Demand	Anodyne	NR1H4	0	45
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664896	EF	On-Demand	Anodyne	CSF1R	0	50
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664897	EF	On-Demand	Anodyne	NR1H4	0	45
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664897	EF	On-Demand	Anodyne	CSF1R	0	50
COC(=O)COc1ccc([C@@H](C)NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450664903	GE	On-Demand	Anodyne	ACACA	40	38
COC(=O)COc1ccc([C@@H](C)NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450664903	GE	On-Demand	Anodyne	PARP3	23	46
COC(=O)COc1ccc([C@H](C)NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450664904	GE	On-Demand	Anodyne	ACACA	40	38
COC(=O)COc1ccc([C@H](C)NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450664904	GE	On-Demand	Anodyne	PARP3	23	46
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cc2n(n1)CCCC2	ZINC000450664907	EF	On-Demand	Bother	P2RX7	46	37
CCS(=O)(=O)c1ccc(CNC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450664908	GG	On-Demand	Anodyne	E1	0	41
CCS(=O)(=O)c1ccc(CNC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450664908	GG	On-Demand	Anodyne	NAMPT	88	39
CC(=O)c1cn(CC(=O)N2CCC[C@]2(C)Cc2ccccc2)nn1	ZINC000450664910	EE	On-Demand	Anodyne	SLC12A5	74	40
CC(=O)c1cn(CC(=O)N2CCC[C@@]2(C)Cc2ccccc2)nn1	ZINC000450664911	EE	On-Demand	Anodyne	SLC12A5	74	40
N#Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450664914	DF	On-Demand	Mild	CASP3	46	38
N#Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450664914	DF	On-Demand	Mild	CHRNA10	62	44
C[C@H](NCc1nnc(C2CC2)s1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664916	GJ	On-Demand	Anodyne	DGAT1	24	43
C[C@H](NCc1nnc(C2CC2)s1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664916	GJ	On-Demand	Anodyne	KCNK3	101	40
C[C@H](NCc1nnc(C2CC2)s1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664916	GJ	On-Demand	Anodyne	KCNK9	59	38
Cc1ccn2ncc(C(=O)N3CCC[C@@]3(C)Cc3ccccc3)c2c1	ZINC000450664917	EH	On-Demand	Anodyne	EPHB3	29	43
Cc1ccn2ncc(C(=O)N3CCC[C@@]3(C)Cc3ccccc3)c2c1	ZINC000450664917	EH	On-Demand	Anodyne	SLC12A5	73	39
Cc1ccn2ncc(C(=O)N3CCC[C@]3(C)Cc3ccccc3)c2c1	ZINC000450664918	EH	On-Demand	Anodyne	EPHB3	29	43
Cc1ccn2ncc(C(=O)N3CCC[C@]3(C)Cc3ccccc3)c2c1	ZINC000450664918	EH	On-Demand	Anodyne	SLC12A5	73	39
CNC(=O)C1CN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450664919	FD	On-Demand	Anodyne	PDGFRB	0	45
CNC(=O)C1CN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450664919	FD	On-Demand	Anodyne	HPGD	64	75
C[C@@H](NCc1nnc(C2CC2)s1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664920	GJ	On-Demand	Anodyne	DGAT1	24	43
C[C@@H](NCc1nnc(C2CC2)s1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664920	GJ	On-Demand	Anodyne	KCNK3	101	40
C[C@@H](NCc1nnc(C2CC2)s1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450664920	GJ	On-Demand	Anodyne	KCNK9	59	38
COc1ccc(CNC(=O)CCSc2ccc(NC(C)=O)cc2)c(OC)c1	ZINC000450664923	GG	On-Demand	Anodyne	TSHR	71	38
COc1ccc(CNC(=O)CCSc2ccc(NC(C)=O)cc2)c(OC)c1	ZINC000450664923	GG	On-Demand	Anodyne	PTGS2	0	41
COc1ccc(CNC(=O)CCSc2ccc(NC(C)=O)cc2)c(OC)c1	ZINC000450664923	GG	On-Demand	Anodyne	MTNR1A	98	43
COc1ccc(CNC(=O)CCSc2ccc(NC(C)=O)cc2)c(OC)c1	ZINC000450664923	GG	On-Demand	Anodyne	MTNR1B	88	43
Cn1nc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)c2c1CCCC2	ZINC000450664926	EH	On-Demand	Anodyne	SLC12A5	76	40
CCS(=O)(=O)c1ccc(CN[C@H](CCO)c2ccccc2)cc1	ZINC000450664933	EF	On-Demand	Anodyne	RORC	24	40
CCS(=O)(=O)c1ccc(CN[C@@H](CCO)c2ccccc2)cc1	ZINC000450664934	EF	On-Demand	Anodyne	RORC	24	40
OCC[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450664940	CH	On-Demand	Anodyne	METAP1	36	41
OCC[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450664941	CH	On-Demand	Anodyne	METAP1	36	41
CC(C)N1CC[C@H](NC(=O)[C@@H](O)C2CCC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450664960	FG	On-Demand	Anodyne	ENV	45	35
CC(C)N1CC[C@H](NC(=O)[C@@H](O)C2CCC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450664961	FG	On-Demand	Anodyne	ENV	45	35
CC(C)N1CC[C@H](NC(=O)[C@H](O)C2CCC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450664962	FG	On-Demand	Anodyne	ENV	45	35
CC(C)N1CC[C@H](NC(=O)[C@H](O)C2CCC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450664963	FG	On-Demand	Anodyne	ENV	45	35
CCOC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664964	FH	On-Demand	Anodyne	SCD1	29	40
CC[C@H](CC(F)(F)F)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450664965	EH	On-Demand	Bother	P2RX7	45	36
CCOC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450664966	FH	On-Demand	Anodyne	SCD1	29	40
COc1cc([C@@H](C)NC[C@H]2COCCO2)ccc1OC1CCCC1	ZINC000450664967	EG	On-Demand	Anodyne	PDE4A	43	44
COc1cc([C@@H](C)NC[C@@H]2COCCO2)ccc1OC1CCCC1	ZINC000450664968	EG	On-Demand	Anodyne	PDE4A	43	44
COc1cc([C@H](C)NC[C@@H]2COCCO2)ccc1OC1CCCC1	ZINC000450664969	EG	On-Demand	Anodyne	PDE4A	43	44
COc1cc([C@H](C)NC[C@H]2COCCO2)ccc1OC1CCCC1	ZINC000450664970	EG	On-Demand	Anodyne	PDE4A	43	44
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450664972	EH	On-Demand	Bother	P2RX7	45	36
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(NC(C)=O)c2)c(OC)c1	ZINC000450664985	GG	On-Demand	Anodyne	PDGFRB	42	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(NC(C)=O)c2)c(OC)c1	ZINC000450664985	GG	On-Demand	Anodyne	MTNR1A	91	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(NC(C)=O)c2)c(OC)c1	ZINC000450664985	GG	On-Demand	Anodyne	MTNR1B	84	42
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(NC(C)=O)c2)c(OC)c1	ZINC000450664986	GG	On-Demand	Anodyne	PDGFRB	42	38
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(NC(C)=O)c2)c(OC)c1	ZINC000450664986	GG	On-Demand	Anodyne	MTNR1A	91	42
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(NC(C)=O)c2)c(OC)c1	ZINC000450664986	GG	On-Demand	Anodyne	MTNR1B	84	42
COC1(CSc2nnc(-c3ccccc3)n2Cc2ccco2)CCC1	ZINC000450664987	FI	On-Demand	Anodyne	HCRTR2	21	44
CC(F)(F)CCSc1nnc(-c2cccnc2)n1Cc1ccco1	ZINC000450664996	FI	On-Demand	Anodyne	HCRTR2	20	40
CC(F)(F)C(C)(C)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1	ZINC000450665033	EJ	On-Demand	Anodyne	IMDH_CRYPV	48	39
Cc1ccc(F)c(CC(=O)NCC(F)(F)CO)c1	ZINC000450665061	CD	On-Demand	Anodyne	P2RX7	24	40
O=C(NCC(F)(F)CO)[C@@H]1CCN(c2ccccc2)C1	ZINC000450665077	CD	On-Demand	Anodyne	CACNA1G	33	40
O=C(NCC(F)(F)CO)[C@@H]1CCN(c2ccccc2)C1	ZINC000450665077	CD	On-Demand	Anodyne	LIPG	44	35
O=C(NCC(F)(F)CO)[C@H]1CCN(c2ccccc2)C1	ZINC000450665078	CD	On-Demand	Anodyne	CACNA1G	33	40
O=C(NCC(F)(F)CO)[C@H]1CCN(c2ccccc2)C1	ZINC000450665078	CD	On-Demand	Anodyne	LIPG	44	35
Cc1cccc2c1O[C@@H](C(=O)N[C@@H]1COc3ccc(F)cc31)C2	ZINC000450665083	DF	On-Demand	Anodyne	ACAT	0	41
Cc1cccc2c1O[C@@H](C(=O)N[C@H]1COc3ccc(F)cc31)C2	ZINC000450665084	DF	On-Demand	Anodyne	ACAT	0	41
Cc1cccc2c1O[C@H](C(=O)N[C@H]1COc3ccc(F)cc31)C2	ZINC000450665085	DF	On-Demand	Anodyne	ACAT	0	41
Cc1cccc2c1O[C@H](C(=O)N[C@@H]1COc3ccc(F)cc31)C2	ZINC000450665086	DF	On-Demand	Anodyne	ACAT	0	41
CC(C)(C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1)C1CCC1	ZINC000450665113	DI	On-Demand	Anodyne	MDM2	85	35
CC(C)(C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1)C1CCC1	ZINC000450665114	DI	On-Demand	Anodyne	MDM2	85	35
COc1cc(CN[C@H](C)c2ccc3c(c2)OCCO3)ccc1Cl	ZINC000450665115	EH	On-Demand	Anodyne	PDE10A	23	49
COc1cc(CN[C@@H](C)c2ccc3c(c2)OCCO3)ccc1Cl	ZINC000450665116	EH	On-Demand	Anodyne	PDE10A	23	49
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCCc2sccc21	ZINC000450665117	FH	On-Demand	Bother	LUXR	25	44
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCCc2sccc21	ZINC000450665118	FH	On-Demand	Bother	LUXR	25	44
COC(=O)c1csc(CN[C@H](C)c2ccccc2C)n1	ZINC000450665130	CG	On-Demand	Anodyne	CTSA	42	32
COC(=O)c1csc(CN[C@@H](C)c2ccccc2C)n1	ZINC000450665131	CG	On-Demand	Anodyne	CTSA	42	32
CN(CCN[C@H](CN1CCOCC1)c1ccccc1)Cc1ccccc1	ZINC000450665148	FF	On-Demand	Anodyne	CASR	58	38
CN(CCN[C@@H](CN1CCOCC1)c1ccccc1)Cc1ccccc1	ZINC000450665149	FF	On-Demand	Anodyne	CASR	58	38
COc1ccc(OC)c([C@@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450665174	CD	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(OC)c([C@@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450665174	CD	On-Demand	Anodyne	MTNR1B	35	40
COc1ccc(OC)c([C@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450665175	CD	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(OC)c([C@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450665175	CD	On-Demand	Anodyne	MTNR1B	35	40
COc1ccc(OC)c([C@@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450665176	CD	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(OC)c([C@@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450665176	CD	On-Demand	Anodyne	MTNR1B	35	40
COc1ccc(OC)c([C@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450665177	CD	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(OC)c([C@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450665177	CD	On-Demand	Anodyne	MTNR1B	35	40
CCc1nc(C)c(CSc2nnc(-c3ccccc3F)n2C)o1	ZINC000450665181	EH	On-Demand	Anodyne	DRD3	22	41
CCc1nc(C)c(CSc2nnc(-c3ccccc3F)n2C)o1	ZINC000450665181	EH	On-Demand	Anodyne	KCNH2	0	41
Cn1nc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)c2c1CCCC2	ZINC000450665183	EH	On-Demand	Anodyne	SLC12A5	76	40
Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450665185	DG	On-Demand	Bother	CASP3	48	38
Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450665185	DG	On-Demand	Bother	CHRNA10	66	48
COc1ccc(CN2CCCN(C(=O)c3cc(C)n(C(C)C)n3)CC2=O)cc1	ZINC000450665190	GF	On-Demand	Anodyne	PROKR1	46	30
C[C@@]1(Cc2ccccc2)CCCN1C(=O)CC1CC(F)(F)C1	ZINC000450665192	DI	On-Demand	Anodyne	SLC12A5	81	42
C[C@]1(Cc2ccccc2)CCCN1C(=O)CC1CC(F)(F)C1	ZINC000450665193	DI	On-Demand	Anodyne	SLC12A5	81	42
O=C(N1CCN(c2c(Cl)cccc2Cl)CC1)C1(CF)CCOCC1	ZINC000450665203	GG	On-Demand	Anodyne	AKR1C3	28	43
Cn1ncc(N2CCC[C@H]2COc2ccccc2)c(Br)c1=O	ZINC000450665204	FF	On-Demand	Anodyne	CASP3	38	43
Cn1ncc(N2CCC[C@H]2COc2ccccc2)c(Br)c1=O	ZINC000450665204	FF	On-Demand	Anodyne	CHRNA10	72	53
Cn1ncc(N2CCC[C@H]2COc2ccccc2)c(Br)c1=O	ZINC000450665204	FF	On-Demand	Anodyne	CASP7	48	43
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450665206	EH	On-Demand	Anodyne	SLC12A5	71	37
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450665207	EH	On-Demand	Anodyne	SLC12A5	71	37
Cc1cc(C)nc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450665219	CG	On-Demand	Anodyne	CASP3	56	44
Cc1cc(C)nc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450665219	CG	On-Demand	Anodyne	CPT1A	76	36
Cc1cc(C)nc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450665219	CG	On-Demand	Anodyne	CHRNA10	86	60
Cc1cc(C)nc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450665219	CG	On-Demand	Anodyne	CASP7	50	44
CCC[C@@H](O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665220	EH	On-Demand	Anodyne	ADRB2	18	52
CCC[C@@H](O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665220	EH	On-Demand	Anodyne	ADRB3	29	52
CCC[C@@H](O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665220	EH	On-Demand	Anodyne	SOAT1	0	57
CCC[C@@H](O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665220	EH	On-Demand	Anodyne	AUR1	0	40
CCC[C@H](O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665221	EH	On-Demand	Anodyne	ADRB2	18	52
CCC[C@H](O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665221	EH	On-Demand	Anodyne	ADRB3	29	52
CCC[C@H](O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665221	EH	On-Demand	Anodyne	SOAT1	0	57
CCC[C@H](O)CN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665221	EH	On-Demand	Anodyne	AUR1	0	40
CCC[C@H](O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665222	EH	On-Demand	Anodyne	ADRB2	18	52
CCC[C@H](O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665222	EH	On-Demand	Anodyne	ADRB3	29	52
CCC[C@H](O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665222	EH	On-Demand	Anodyne	SOAT1	0	57
CCC[C@H](O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665222	EH	On-Demand	Anodyne	AUR1	0	40
CCC[C@@H](O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665223	EH	On-Demand	Anodyne	ADRB2	18	52
CCC[C@@H](O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665223	EH	On-Demand	Anodyne	ADRB3	29	52
CCC[C@@H](O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665223	EH	On-Demand	Anodyne	SOAT1	0	57
CCC[C@@H](O)CN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000450665223	EH	On-Demand	Anodyne	AUR1	0	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CA2	25	45
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CASP3	116	49
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CA7	34	45
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CA4	19	45
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CASP1	0	45
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CHRNA10	76	44
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CASP9	16	47
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CASP7	122	49
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CA12	19	45
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H]1COc1ccccc1	ZINC000450665227	GE	On-Demand	Anodyne	CA9	19	45
COc1ccc(C[C@@H](NC[C@@H]2CCNC(=O)CC2)c2ccccc2)cc1OC	ZINC000450665232	GG	On-Demand	Anodyne	SOAT1	0	52
COc1ccc(C[C@H](NC[C@@H]2CCNC(=O)CC2)c2ccccc2)cc1OC	ZINC000450665233	GG	On-Demand	Anodyne	SOAT1	0	52
COc1ccc(C[C@H](NC[C@H]2CCNC(=O)CC2)c2ccccc2)cc1OC	ZINC000450665234	GG	On-Demand	Anodyne	SOAT1	0	52
COc1ccc(C[C@@H](NC[C@H]2CCNC(=O)CC2)c2ccccc2)cc1OC	ZINC000450665235	GG	On-Demand	Anodyne	SOAT1	0	52
CNC(=O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450665236	DE	On-Demand	Anodyne	MC4R	53	42
CNC(=O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450665236	DE	On-Demand	Anodyne	PRCP	52	40
CNC(=O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450665236	DE	On-Demand	Anodyne	MC3R	47	43
CNC(=O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450665236	DE	On-Demand	Anodyne	MC5R	33	43
CNC(=O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450665237	DE	On-Demand	Anodyne	MC4R	53	42
CNC(=O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450665237	DE	On-Demand	Anodyne	PRCP	52	40
CNC(=O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450665237	DE	On-Demand	Anodyne	MC3R	47	43
CNC(=O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450665237	DE	On-Demand	Anodyne	MC5R	33	43
CNC(=O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450665238	DE	On-Demand	Anodyne	MC4R	53	42
CNC(=O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450665238	DE	On-Demand	Anodyne	PRCP	52	40
CNC(=O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450665238	DE	On-Demand	Anodyne	MC3R	47	43
CNC(=O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450665238	DE	On-Demand	Anodyne	MC5R	33	43
CNC(=O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450665239	DE	On-Demand	Anodyne	MC4R	53	42
CNC(=O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450665239	DE	On-Demand	Anodyne	PRCP	52	40
CNC(=O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450665239	DE	On-Demand	Anodyne	MC3R	47	43
CNC(=O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450665239	DE	On-Demand	Anodyne	MC5R	33	43
COc1ccc(C[C@H](NCCc2cscn2)c2ccccc2)cc1OC	ZINC000450665240	FI	On-Demand	Anodyne	BMP1	41	32
COc1ccc(C[C@H](NCCc2cscn2)c2ccccc2)cc1OC	ZINC000450665240	FI	On-Demand	Anodyne	GPR142	36	41
COc1ccc(C[C@@H](NCCc2cscn2)c2ccccc2)cc1OC	ZINC000450665241	FI	On-Demand	Anodyne	BMP1	41	32
COc1ccc(C[C@@H](NCCc2cscn2)c2ccccc2)cc1OC	ZINC000450665241	FI	On-Demand	Anodyne	GPR142	36	41
COC(=O)C1(CN[C@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)CC1	ZINC000450665242	FH	On-Demand	Anodyne	SOAT1	23	59
COC(=O)C1(CN[C@@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)CC1	ZINC000450665243	FH	On-Demand	Anodyne	SOAT1	23	59
COc1ccc(CN2CCCN(C(=O)[C@@H]3C[C@H]3CC(C)C)CC2=O)cc1	ZINC000450665244	FF	On-Demand	Anodyne	MMP3	21	40
COc1ccc(CN2CCCN(C(=O)[C@@H]3C[C@H]3CC(C)C)CC2=O)cc1	ZINC000450665244	FF	On-Demand	Anodyne	MMP8	16	40
O=C(c1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450665250	GH	On-Demand	Bother	CASP3	52	39
O=C(c1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450665250	GH	On-Demand	Bother	CPT2	41	34
O=C(c1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450665250	GH	On-Demand	Bother	CHRNA10	62	41
O=C(c1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450665250	GH	On-Demand	Bother	CASP7	45	39
CCOC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665252	EG	On-Demand	Anodyne	CASP3	43	36
CCOC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665252	EG	On-Demand	Anodyne	COLA	62	40
CCOC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665252	EG	On-Demand	Anodyne	CPT1A	59	33
CCOC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665252	EG	On-Demand	Anodyne	CHRNA10	71	47
CCOC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665252	EG	On-Demand	Anodyne	SGPL1	0	49
CCOC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665252	EG	On-Demand	Anodyne	ACKR3	41	34
N#Cc1ccc(N2CCC[C@H]2COc2ccccc2)cc1[N+](=O)[O-]	ZINC000450665272	DH	On-Demand	Mild	CASP3	38	42
N#Cc1ccc(N2CCC[C@H]2COc2ccccc2)cc1[N+](=O)[O-]	ZINC000450665272	DH	On-Demand	Mild	CASP7	47	42
CCCc1nc(C)c(CSc2nnc(C)n2Cc2ccccc2)o1	ZINC000450665286	EI	On-Demand	Anodyne	AGTR1	16	41
COc1cccc(OCCC(=O)N2CCc3cc(OC)c(F)cc3C2)c1	ZINC000450665296	FG	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)N2CCc3cc(OC)c(F)cc3C2)c1	ZINC000450665296	FG	On-Demand	Anodyne	ABCB1B	40	30
COc1cccc(OCCC(=O)N2CCc3cc(OC)c(F)cc3C2)c1	ZINC000450665296	FG	On-Demand	Anodyne	ABCB1	24	50
COc1cccc(OCCC(=O)N2CCc3cc(OC)c(F)cc3C2)c1	ZINC000450665296	FG	On-Demand	Anodyne	HCRTR2	16	42
COc1cc([C@@H](C)NC[C@@H](Cc2ccccc2)OC)cc(OC)c1OC	ZINC000450665305	FH	On-Demand	Anodyne	N1L	0	40
C[C@@H](NC[C@H]1CCC(F)(F)C1)c1cccc(OCc2ccccn2)c1	ZINC000450665318	EJ	On-Demand	Anodyne	ALOX5AP	40	39
COc1cc([C@H](C)NC[C@@H](Cc2ccccc2)OC)cc(OC)c1OC	ZINC000450665319	FH	On-Demand	Anodyne	N1L	0	40
COc1cc([C@@H](C)NC[C@H](Cc2ccccc2)OC)cc(OC)c1OC	ZINC000450665320	FH	On-Demand	Anodyne	N1L	0	40
COc1cc([C@H](C)NC[C@H](Cc2ccccc2)OC)cc(OC)c1OC	ZINC000450665321	FH	On-Demand	Anodyne	N1L	0	40
C[C@H](NC[C@H]1CCC(F)(F)C1)c1cccc(OCc2ccccn2)c1	ZINC000450665323	EJ	On-Demand	Anodyne	ALOX5AP	40	39
C[C@@H](NC[C@@H]1CCC(F)(F)C1)c1cccc(OCc2ccccn2)c1	ZINC000450665324	EJ	On-Demand	Anodyne	ALOX5AP	40	39
C[C@H](NC[C@@H]1CCC(F)(F)C1)c1cccc(OCc2ccccn2)c1	ZINC000450665325	EJ	On-Demand	Anodyne	ALOX5AP	40	39
CCOC(=O)c1cccnc1N1CCC(c2nc(C(F)(F)F)cs2)CC1	ZINC000450665344	GI	On-Demand	Anodyne	P2RY12	44	38
Cc1cnc(CCCC(=O)N2CCC[C@@H](Cc3csc4ccccc34)C2)o1	ZINC000450665349	GK	On-Demand	Anodyne	FFAR2	48	34
Cc1cnc(CCCC(=O)N2CCC[C@H](Cc3csc4ccccc34)C2)o1	ZINC000450665350	GK	On-Demand	Anodyne	FFAR2	48	34
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000450665356	CE	On-Demand	Anodyne	ACACA	43	38
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000450665364	EF	On-Demand	Anodyne	PTGS2	24	40
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000450665364	EF	On-Demand	Anodyne	CTSF	45	33
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000450665365	EF	On-Demand	Anodyne	PTGS2	24	40
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000450665365	EF	On-Demand	Anodyne	CTSF	45	33
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OC(F)F)cc1	ZINC000450665366	CE	On-Demand	Anodyne	ACACA	43	38
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000450665367	EF	On-Demand	Anodyne	PTGS2	24	40
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000450665367	EF	On-Demand	Anodyne	CTSF	45	33
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000450665368	EF	On-Demand	Anodyne	PTGS2	24	40
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000450665368	EF	On-Demand	Anodyne	CTSF	45	33
CC[C@H](O)CC(=O)Nc1ccc(CN2CCN(C(C)=O)CC2)cc1	ZINC000450665369	ED	On-Demand	Anodyne	NOD2	42	35
CC[C@@H](O)CC(=O)Nc1ccc(CN2CCN(C(C)=O)CC2)cc1	ZINC000450665370	ED	On-Demand	Anodyne	NOD2	42	35
CNC(=O)C1CN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450665372	FC	On-Demand	Mild	AR	18	43
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000450665374	CE	On-Demand	Anodyne	ACACA	43	38
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OC(F)F)cc1	ZINC000450665375	CE	On-Demand	Anodyne	ACACA	43	38
CNC(=O)C1CN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450665379	FC	On-Demand	Mild	AR	18	43
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccnc2)c(OC)c1	ZINC000450665390	EE	On-Demand	Anodyne	NQO2	17	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccnc2)c(OC)c1	ZINC000450665390	EE	On-Demand	Anodyne	KCNA5	45	37
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccnc2)c(OC)c1	ZINC000450665390	EE	On-Demand	Anodyne	MTNR1A	61	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccnc2)c(OC)c1	ZINC000450665390	EE	On-Demand	Anodyne	MTNR1B	44	42
COc1ccc(CNC(=O)CCN[C@H](C)c2cccnc2)c(OC)c1	ZINC000450665391	EE	On-Demand	Anodyne	NQO2	17	40
COc1ccc(CNC(=O)CCN[C@H](C)c2cccnc2)c(OC)c1	ZINC000450665391	EE	On-Demand	Anodyne	KCNA5	45	37
COc1ccc(CNC(=O)CCN[C@H](C)c2cccnc2)c(OC)c1	ZINC000450665391	EE	On-Demand	Anodyne	MTNR1A	61	42
COc1ccc(CNC(=O)CCN[C@H](C)c2cccnc2)c(OC)c1	ZINC000450665391	EE	On-Demand	Anodyne	MTNR1B	44	42
CC(=O)N[C@H](C(=O)NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)C(C)(C)C	ZINC000450665393	GH	On-Demand	Anodyne	GAG-PRO	42	33
CC(=O)N[C@H](C(=O)NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)C(C)(C)C	ZINC000450665395	GH	On-Demand	Anodyne	GAG-PRO	42	33
CC[S@](=O)CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450665429	DD	On-Demand	Bother	P2RX7	54	38
COc1cc([C@H](C)NCc2nnc(C(C)C)s2)ccc1OC1CCCC1	ZINC000450665433	GJ	On-Demand	Anodyne	PDE4A	44	44
COc1cc([C@H](C)NCc2nnc(C(C)C)s2)ccc1OC1CCCC1	ZINC000450665433	GJ	On-Demand	Anodyne	PDE4B	23	42
COc1cc([C@H](C)NCc2nnc(C(C)C)s2)ccc1OC1CCCC1	ZINC000450665433	GJ	On-Demand	Anodyne	PDE4D	20	42
COc1cc([C@H](C)NCc2nnc(C(C)C)s2)ccc1OC1CCCC1	ZINC000450665433	GJ	On-Demand	Anodyne	PDE4C	15	42
CC[S@@](=O)CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450665437	DD	On-Demand	Bother	P2RX7	54	38
O=C(NCCO)c1ccc(N2CCC[C@H]2COc2ccccc2)nn1	ZINC000450665442	ED	On-Demand	Anodyne	CHRNA10	70	46
O=C(NCCO)c1ccc(N2CCC[C@H]2COc2ccccc2)nn1	ZINC000450665442	ED	On-Demand	Anodyne	SCD1	45	49
COc1cc([C@@H](C)NCc2nnc(C(C)C)s2)ccc1OC1CCCC1	ZINC000450665444	GJ	On-Demand	Anodyne	PDE4A	44	44
COc1cc([C@@H](C)NCc2nnc(C(C)C)s2)ccc1OC1CCCC1	ZINC000450665444	GJ	On-Demand	Anodyne	PDE4B	23	42
COc1cc([C@@H](C)NCc2nnc(C(C)C)s2)ccc1OC1CCCC1	ZINC000450665444	GJ	On-Demand	Anodyne	PDE4D	20	42
COc1cc([C@@H](C)NCc2nnc(C(C)C)s2)ccc1OC1CCCC1	ZINC000450665444	GJ	On-Demand	Anodyne	PDE4C	15	42
CC[C@@H]1C[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450665457	CF	On-Demand	Bother	P2RX7	41	42
C[C@H](NCC1(C#N)CCC1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450665458	EF	On-Demand	Mild	LUXN	0	44
COc1cc([C@H](C)NCCC[C@H](C)O)ccc1OC(C)C	ZINC000450665469	CG	On-Demand	Anodyne	SLC22A3	0	41
COc1cc([C@H](C)NCCC[C@@H](C)O)ccc1OC(C)C	ZINC000450665470	CG	On-Demand	Anodyne	SLC22A3	0	41
COc1cc([C@@H](C)NCCC[C@H](C)O)ccc1OC(C)C	ZINC000450665471	CG	On-Demand	Anodyne	SLC22A3	0	41
COc1cc([C@@H](C)NCCC[C@@H](C)O)ccc1OC(C)C	ZINC000450665472	CG	On-Demand	Anodyne	SLC22A3	0	41
COc1ccc2c(N[C@@H](CCO)c3cccc(C(F)(F)F)c3)ncnc2c1F	ZINC000450665475	GI	On-Demand	Anodyne	EGFR	15	41
COc1ccc2c(N[C@@H](CCO)c3cccc(C(F)(F)F)c3)ncnc2c1F	ZINC000450665475	GI	On-Demand	Anodyne	SCD1	0	40
C[C@@H](NCC1(C#N)CCC1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450665485	EF	On-Demand	Mild	LUXN	0	44
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccsc2Br)cc1	ZINC000450665488	GH	On-Demand	Anodyne	ACACA	24	41
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccsc2Br)cc1	ZINC000450665488	GH	On-Demand	Anodyne	ACACB	32	41
CCC[C@H]1CCC[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450665505	FG	On-Demand	Anodyne	MMP1	18	40
CCC[C@H]1CCC[C@@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450665507	FG	On-Demand	Anodyne	MMP1	18	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450665510	FG	On-Demand	Anodyne	MMP1	18	40
COc1ccc2c(N[C@H](CCO)c3cccc(C(F)(F)F)c3)ncnc2c1F	ZINC000450665512	GI	On-Demand	Anodyne	EGFR	15	41
COc1ccc2c(N[C@H](CCO)c3cccc(C(F)(F)F)c3)ncnc2c1F	ZINC000450665512	GI	On-Demand	Anodyne	SCD1	0	40
CCC[C@@H]1CCC[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450665513	FG	On-Demand	Anodyne	MMP1	18	40
CCOC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450665516	CG	On-Demand	Anodyne	KCNQ1	0	41
CCOC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450665516	CG	On-Demand	Anodyne	SAT1	0	46
CCOC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450665516	CG	On-Demand	Anodyne	PLA2G4B	94	46
CCOC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450665516	CG	On-Demand	Anodyne	ACR	50	46
CCOC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450665516	CG	On-Demand	Anodyne	SLC47A1	26	50
c1ccc(OC[C@@H]2CCCN2c2ccnc3ccncc23)cc1	ZINC000450665530	DH	On-Demand	Anodyne	CASP3	51	40
c1ccc(OC[C@@H]2CCCN2c2ccnc3ccncc23)cc1	ZINC000450665530	DH	On-Demand	Anodyne	CHRNA10	81	50
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450665531	DG	On-Demand	Anodyne	SLC12A5	78	39
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450665532	DG	On-Demand	Anodyne	SLC12A5	78	39
COc1ccnc(CN[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450665534	FI	On-Demand	Anodyne	FFAR1	15	41
COc1ccnc(CN[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450665535	FI	On-Demand	Anodyne	FFAR1	15	41
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccsc2Br)cc1	ZINC000450665537	GH	On-Demand	Anodyne	ACACA	24	41
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccsc2Br)cc1	ZINC000450665537	GH	On-Demand	Anodyne	ACACB	32	41
COC(=O)c1ccc(OCCC[C@H](C)O)c(OC)c1	ZINC000450665545	CE	On-Demand	Anodyne	THRA	0	43
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccnc(OC(F)F)c2)cc1	ZINC000450665546	GF	On-Demand	Anodyne	ACACA	58	36
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccnc(OC(F)F)c2)cc1	ZINC000450665547	GF	On-Demand	Anodyne	ACACA	58	36
CC1(C)[C@H]2CC[C@@]1(C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)C2	ZINC000450665548	FG	On-Demand	Bother	P2RX7	31	45
CC1(C)[C@H]2CC[C@@]1(C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C(=O)C2	ZINC000450665548	FG	On-Demand	Bother	SLC27A4	42	30
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450665549	GF	On-Demand	Anodyne	ACACA	54	37
COC(=O)c1ccc(OCCC[C@@H](C)O)c(OC)c1	ZINC000450665550	CE	On-Demand	Anodyne	THRA	0	43
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450665552	GF	On-Demand	Anodyne	ACACA	54	37
CC(C)(C)OC1CC(Sc2nnc(-c3cccnc3)n2Cc2ccccc2)C1	ZINC000450665574	GJ	On-Demand	Anodyne	VCP	51	34
CCCc1nc(C)c(CSc2nnc(-c3ccccc3)n2Cc2ccco2)o1	ZINC000450665611	GK	On-Demand	Anodyne	HCRTR2	20	42
COC(=O)c1cccc(OC[C@H]2CCCC2(F)F)c1	ZINC000450665626	CG	On-Demand	Anodyne	CHRNA10	49	35
COC(=O)c1cccc(OC[C@@H]2CCCC2(F)F)c1	ZINC000450665627	CG	On-Demand	Anodyne	CHRNA10	49	35
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc2c(c1)NC(=O)CO2	ZINC000450665644	GG	On-Demand	Anodyne	NR3C2	26	40
C[C@H](NCc1ccn(CCc2ccccc2)n1)c1ccc2c(c1)NC(=O)CO2	ZINC000450665644	GG	On-Demand	Anodyne	HTR1B	19	40
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc2c(c1)NC(=O)CO2	ZINC000450665645	GG	On-Demand	Anodyne	NR3C2	26	40
C[C@@H](NCc1ccn(CCc2ccccc2)n1)c1ccc2c(c1)NC(=O)CO2	ZINC000450665645	GG	On-Demand	Anodyne	HTR1B	19	40
OCC[C@H](Nc1cc(N2CCCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450665647	FH	On-Demand	Anodyne	PRCP	0	40
OCC[C@@H](Nc1cc(N2CCCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450665648	FH	On-Demand	Anodyne	PRCP	0	40
CC[C@](C)(CCO)NC(=O)c1ccc(I)cc1F	ZINC000450665656	FF	On-Demand	Anodyne	MAP2K1	41	35
CC[C@@](C)(CCO)NC(=O)c1ccc(I)cc1F	ZINC000450665657	FF	On-Demand	Anodyne	MAP2K1	41	35
CCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665669	EG	On-Demand	Anodyne	GRIN2B	0	41
CCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665669	EG	On-Demand	Anodyne	CPT1A	42	34
CCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665669	EG	On-Demand	Anodyne	CHRNA10	65	47
CCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450665669	EG	On-Demand	Anodyne	ACKR3	52	35
Cc1ccc(F)c(CSc2nnc(C3CC3)n2Cc2ccco2)c1	ZINC000450665673	EJ	On-Demand	Anodyne	HCRTR2	19	40
CCc1cccc(C(=O)N[C@@](C)(CC)CCO)n1	ZINC000450665676	CD	On-Demand	Anodyne	PDE5A	16	41
CCc1cccc(C(=O)N[C@](C)(CC)CCO)n1	ZINC000450665679	CD	On-Demand	Anodyne	PDE5A	16	41
CCOC(=O)c1cc(C(=O)N2CCC[C@@H](Cc3csc4ccccc34)C2)on1	ZINC000450665722	GI	On-Demand	Anodyne	FFAR2	51	30
CCOC(=O)c1cc(C(=O)N2CCC[C@H](Cc3csc4ccccc34)C2)on1	ZINC000450665723	GI	On-Demand	Anodyne	FFAR2	51	30
COC1(CSc2nnc(-c3cccnc3)n2Cc2ccco2)CCC1	ZINC000450665733	FH	On-Demand	Anodyne	HCRTR2	20	41
COC(=O)C1(CSc2nnc(C)n2Cc2ccccc2)CCCC1	ZINC000450665743	EG	On-Demand	Anodyne	NPFFR1	40	32
COC(=O)C1(CSc2nnc(C)n2Cc2ccccc2)CCCC1	ZINC000450665743	EG	On-Demand	Anodyne	SLC12A5	42	35
CC[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450665744	EG	On-Demand	Anodyne	AGTR2	67	37
CC[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450665744	EG	On-Demand	Anodyne	CFTR	53	36
CC[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450665744	EG	On-Demand	Anodyne	ADAM9	64	35
CC[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450665744	EG	On-Demand	Anodyne	NOD2	44	39
CC[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450665745	EG	On-Demand	Anodyne	AGTR2	67	37
CC[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450665745	EG	On-Demand	Anodyne	CFTR	53	36
CC[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450665745	EG	On-Demand	Anodyne	ADAM9	64	35
CC[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450665745	EG	On-Demand	Anodyne	NOD2	44	39
CCS(=O)(=O)c1ccc(CN[C@@H](C)c2cccc(OC(C)C)c2)cc1	ZINC000450665746	FI	On-Demand	Anodyne	RORC	35	40
CCS(=O)(=O)c1ccc(CN[C@H](C)c2cccc(OC(C)C)c2)cc1	ZINC000450665747	FI	On-Demand	Anodyne	RORC	35	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450665752	FE	On-Demand	Anodyne	ACACA	80	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450665752	FE	On-Demand	Anodyne	ACACB	39	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450665753	FE	On-Demand	Anodyne	ACACA	80	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450665753	FE	On-Demand	Anodyne	ACACB	39	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450665755	FE	On-Demand	Anodyne	ACACA	80	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450665755	FE	On-Demand	Anodyne	ACACB	39	40
OCC[C@@H](Nc1ncccn1)c1cccc(C(F)(F)F)c1	ZINC000450665756	CG	On-Demand	Anodyne	PHES	0	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450665757	FE	On-Demand	Anodyne	ACACA	80	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450665757	FE	On-Demand	Anodyne	ACACB	39	40
OCC[C@H](Nc1ncccn1)c1cccc(C(F)(F)F)c1	ZINC000450665758	CG	On-Demand	Anodyne	PHES	0	40
CS(=O)(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)c(F)c1	ZINC000450665760	GH	On-Demand	Anodyne	TRPV1	76	33
CS(=O)(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)c(F)c1	ZINC000450665761	GH	On-Demand	Anodyne	TRPV1	76	33
COc1cc([C@@H](C)NC[C@H](Cc2ccccc2)OC)ccc1OC(F)F	ZINC000450665770	FI	On-Demand	Anodyne	PDE4A	64	41
COc1cc([C@@H](C)NC[C@@H](Cc2ccccc2)OC)ccc1OC(F)F	ZINC000450665771	FI	On-Demand	Anodyne	PDE4A	64	41
COc1cc([C@H](C)NC[C@@H](Cc2ccccc2)OC)ccc1OC(F)F	ZINC000450665772	FI	On-Demand	Anodyne	PDE4A	64	41
COc1cc([C@H](C)NC[C@H](Cc2ccccc2)OC)ccc1OC(F)F	ZINC000450665773	FI	On-Demand	Anodyne	PDE4A	64	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450665776	GG	On-Demand	Bother	ANPEP	37	47
O=C(NCC(F)(F)CO)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450665786	CE	On-Demand	Anodyne	SCN9A	26	44
O=C(NCC(F)(F)CO)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450665788	CE	On-Demand	Anodyne	SCN9A	26	44
O=C(NCC(F)(F)CO)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450665790	CE	On-Demand	Anodyne	SCN9A	26	44
O=C(NCC(F)(F)CO)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450665791	CE	On-Demand	Anodyne	SCN9A	26	44
COC(=O)COc1ccc([C@@H](C)NC(=O)C2(C(=O)C3CC3)CC2)cc1	ZINC000450665822	EE	On-Demand	Anodyne	ACACA	57	44
COC(=O)COc1ccc([C@@H](C)NC(=O)C2(C(=O)C3CC3)CC2)cc1	ZINC000450665822	EE	On-Demand	Anodyne	ACACB	30	44
COC(=O)COc1ccc([C@H](C)NC(=O)C2(C(=O)C3CC3)CC2)cc1	ZINC000450665826	EE	On-Demand	Anodyne	ACACA	57	44
COC(=O)COc1ccc([C@H](C)NC(=O)C2(C(=O)C3CC3)CC2)cc1	ZINC000450665826	EE	On-Demand	Anodyne	ACACB	30	44
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1	ZINC000450665846	FD	On-Demand	Anodyne	ACACA	34	45
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1	ZINC000450665846	FD	On-Demand	Anodyne	ACACB	41	47
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1	ZINC000450665847	FD	On-Demand	Anodyne	ACACA	34	45
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1	ZINC000450665847	FD	On-Demand	Anodyne	ACACB	41	47
CNS(=O)(=O)NCC(=O)N1CCc2cc(OC)c(F)cc2C1	ZINC000450665848	EB	On-Demand	Anodyne	HCRTR2	15	42
C=CCC1(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)CCCC1	ZINC000450665849	EH	On-Demand	Mild	ACACA	23	44
C=CCC1(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)CCCC1	ZINC000450665849	EH	On-Demand	Mild	ACACB	29	44
C=CCC1(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)CCCC1	ZINC000450665850	EH	On-Demand	Mild	ACACA	23	44
C=CCC1(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)CCCC1	ZINC000450665850	EH	On-Demand	Mild	ACACB	29	44
CC[C@H](NC[C@](C)(O)C(C)=O)c1cccc(Cl)c1	ZINC000450665854	CF	On-Demand	Anodyne	ADRB3	28	40
CC[C@@H](NC[C@](C)(O)C(C)=O)c1cccc(Cl)c1	ZINC000450665855	CF	On-Demand	Anodyne	ADRB3	28	40
CC[C@H](NC[C@@](C)(O)C(C)=O)c1cccc(Cl)c1	ZINC000450665856	CF	On-Demand	Anodyne	ADRB3	28	40
CC[C@@H](NC[C@@](C)(O)C(C)=O)c1cccc(Cl)c1	ZINC000450665857	CF	On-Demand	Anodyne	ADRB3	28	40
CCc1c(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)oc2ccccc12	ZINC000450665859	GI	On-Demand	Anodyne	ACACA	48	37
CCc1c(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)oc2ccccc12	ZINC000450665860	GI	On-Demand	Anodyne	ACACA	48	37
CCc1cc(CCCN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)on1	ZINC000450665864	GJ	On-Demand	Anodyne	KCNK3	96	40
CCc1cc(CCCN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)on1	ZINC000450665864	GJ	On-Demand	Anodyne	KCNK9	49	38
CCc1cc(CCCN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)on1	ZINC000450665865	GJ	On-Demand	Anodyne	KCNK3	96	40
CCc1cc(CCCN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)on1	ZINC000450665865	GJ	On-Demand	Anodyne	KCNK9	49	38
CC[C@H]1Cc2ccccc2CN1C(=O)c1cncc(Cl)c1	ZINC000450665866	DH	On-Demand	Anodyne	CFTR	59	43
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cncc(Cl)c1	ZINC000450665867	DH	On-Demand	Anodyne	CFTR	59	43
CC(F)(F)CCSc1nnc(-c2ccccc2)n1Cc1ccco1	ZINC000450665874	EJ	On-Demand	Anodyne	HCRTR2	22	46
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450665877	EG	On-Demand	Anodyne	SDH1	0	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450665877	EG	On-Demand	Anodyne	ACACA	54	52
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450665877	EG	On-Demand	Anodyne	ACACB	30	52
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450665878	EG	On-Demand	Anodyne	SDH1	0	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450665878	EG	On-Demand	Anodyne	ACACA	54	52
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450665878	EG	On-Demand	Anodyne	ACACB	30	52
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450665879	EG	On-Demand	Anodyne	SDH1	0	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450665879	EG	On-Demand	Anodyne	ACACA	54	52
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450665879	EG	On-Demand	Anodyne	ACACB	30	52
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450665880	EG	On-Demand	Anodyne	SDH1	0	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450665880	EG	On-Demand	Anodyne	ACACA	54	52
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450665880	EG	On-Demand	Anodyne	ACACB	30	52
COc1ccnc(CN[C@H](C)c2cc(OC)c(OC)c(OC)c2)n1	ZINC000450665881	EE	On-Demand	Anodyne	N1L	0	43
COc1ccnc(CN[C@@H](C)c2cc(OC)c(OC)c(OC)c2)n1	ZINC000450665882	EE	On-Demand	Anodyne	N1L	0	43
COC(=O)c1csc(CN[C@@H](CC2CCCCC2)c2ccccc2)n1	ZINC000450665883	FJ	On-Demand	Anodyne	METAP2	15	42
COC(=O)c1csc(CN[C@H](CC2CCCCC2)c2ccccc2)n1	ZINC000450665884	FJ	On-Demand	Anodyne	METAP2	15	42
CC1(O)CC(C(=O)N2CCC[C@]2(C)Cc2ccccc2)C1	ZINC000450665888	CF	On-Demand	Anodyne	SLC12A5	87	48
CC1(O)CC(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)C1	ZINC000450665889	CF	On-Demand	Anodyne	SLC12A5	87	48
COc1ccc(CN2CCCN(C(=O)[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665904	GF	On-Demand	Anodyne	MMP3	19	42
COc1ccc(CN2CCCN(C(=O)[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665904	GF	On-Demand	Anodyne	MMP9	21	42
COc1ccc(CN2CCCN(C(=O)[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665904	GF	On-Demand	Anodyne	DPP7	29	41
COc1ccc(CN2CCCN(C(=O)[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665904	GF	On-Demand	Anodyne	MMP7	15	42
COc1ccc(CN2CCCN(C(=O)[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665904	GF	On-Demand	Anodyne	MMP1	26	42
COc1ccc(CN2CCCN(C(=O)[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665905	GF	On-Demand	Anodyne	MMP3	19	42
COc1ccc(CN2CCCN(C(=O)[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665905	GF	On-Demand	Anodyne	MMP9	21	42
COc1ccc(CN2CCCN(C(=O)[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665905	GF	On-Demand	Anodyne	DPP7	29	41
COc1ccc(CN2CCCN(C(=O)[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665905	GF	On-Demand	Anodyne	MMP7	15	42
COc1ccc(CN2CCCN(C(=O)[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450665905	GF	On-Demand	Anodyne	MMP1	26	42
CCOc1cc(NC2CCN(C(=O)Cc3cc(F)c(C)cc3F)CC2)ncn1	ZINC000450665907	GG	On-Demand	Anodyne	GPR119	29	42
O=C(NCc1ccccc1)c1ccccc1OCc1nnc(C2CC2)s1	ZINC000450665908	FH	On-Demand	Anodyne	KCNA3	34	41
O=C(NCc1ccccc1)c1ccccc1OCc1nnc(C2CC2)s1	ZINC000450665908	FH	On-Demand	Anodyne	HCN1	56	41
O=C(NCc1ccccc1)c1ccccc1OCc1nnc(C2CC2)s1	ZINC000450665908	FH	On-Demand	Anodyne	HCN4	42	32
CCOc1cc(NC2CCN(C(=O)c3ccc(-c4cnn(C)c4)o3)CC2)ncn1	ZINC000450665922	GF	On-Demand	Anodyne	SSTR5	62	36
CCOc1cc(NC2CCN(C(=O)CCc3nc4cnccc4[nH]3)CC2)ncn1	ZINC000450665923	GE	On-Demand	Anodyne	C3AR1	40	36
CCOc1cc(NC2CCN(C(=O)CCc3nc4cnccc4[nH]3)CC2)ncn1	ZINC000450665923	GE	On-Demand	Anodyne	PRKD1	46	34
COC(=O)c1coc(CN[C@@H](C)c2ccc(OCCC(C)C)cc2)n1	ZINC000450665931	EH	On-Demand	Anodyne	ACACA	44	37
COC(=O)c1coc(CN[C@H](C)c2ccc(OCCC(C)C)cc2)n1	ZINC000450665932	EH	On-Demand	Anodyne	ACACA	44	37
CCOc1cc(NC2CCN(C(=O)[C@]3(OC(C)C)CCOC3)CC2)ncn1	ZINC000450665942	GD	On-Demand	Anodyne	GPR119	27	40
CCOc1cc(NC2CCN(C(=O)[C@@]3(OC(C)C)CCOC3)CC2)ncn1	ZINC000450665943	GD	On-Demand	Anodyne	GPR119	27	40
Cc1cnc(C)c(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450665946	CG	On-Demand	Anodyne	CASP3	44	37
Cc1cnc(C)c(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450665946	CG	On-Demand	Anodyne	CPT1A	48	34
Cc1cnc(C)c(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450665946	CG	On-Demand	Anodyne	CHRNA10	74	56
CCOCc1nc(C)c(C(=O)NCc2c(C)oc3ccccc23)s1	ZINC000450665947	EH	On-Demand	Anodyne	SCD1	28	40
COC(=O)c1ccc(OCC[C@H]2CCOC2)c(OC)c1	ZINC000450665955	CE	On-Demand	Anodyne	PDE4D	24	46
COC(=O)c1ccc(OCC[C@@H]2CCOC2)c(OC)c1	ZINC000450665957	CE	On-Demand	Anodyne	PDE4D	24	46
O=C(CC[C@@H]1CCCCO1)COc1cccc(I)c1	ZINC000450665958	FH	On-Demand	Anodyne	COLA	89	38
O=C(CC[C@@H]1CCCCO1)COc1cccc(I)c1	ZINC000450665958	FH	On-Demand	Anodyne	CPT1A	74	36
O=C(CC[C@H]1CCCCO1)COc1cccc(I)c1	ZINC000450665959	FH	On-Demand	Anodyne	COLA	89	38
O=C(CC[C@H]1CCCCO1)COc1cccc(I)c1	ZINC000450665959	FH	On-Demand	Anodyne	CPT1A	74	36
C[C@@]1(Cc2ccccc2)CCCN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450665963	DH	On-Demand	Anodyne	SLC12A5	82	42
C[C@]1(Cc2ccccc2)CCCN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450665968	DH	On-Demand	Anodyne	SLC12A5	82	42
C[C@@]1(Cc2ccccc2)CCCN1C(=O)CC[C@H]1CCC(=O)N1	ZINC000450665981	DF	On-Demand	Anodyne	SLC12A5	75	40
C[C@@]1(Cc2ccccc2)CCCN1C(=O)CC[C@@H]1CCC(=O)N1	ZINC000450665983	DF	On-Demand	Anodyne	SLC12A5	75	40
C[C@]1(Cc2ccccc2)CCCN1C(=O)CC[C@@H]1CCC(=O)N1	ZINC000450665985	DF	On-Demand	Anodyne	SLC12A5	75	40
C[C@]1(Cc2ccccc2)CCCN1C(=O)CC[C@H]1CCC(=O)N1	ZINC000450665988	DF	On-Demand	Anodyne	SLC12A5	75	40
CC[C@@H](NC[C@H](O)Cc1ccccc1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450666012	GG	On-Demand	Anodyne	ABCB1	49	39
CC[C@H](NC[C@H](O)Cc1ccccc1)c1ccccc1OCC(=O)N1CCCC1	ZINC000450666014	GG	On-Demand	Anodyne	ABCB1	49	39
COC(=O)C1(CN[C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1	ZINC000450666020	FH	On-Demand	Anodyne	PTGER2	27	42
COC(=O)C1(CN[C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1	ZINC000450666020	FH	On-Demand	Anodyne	PPIA	41	34
COC(=O)C1(CN[C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1	ZINC000450666020	FH	On-Demand	Anodyne	PTGER4	20	42
COC(=O)C1(CN[C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1	ZINC000450666020	FH	On-Demand	Anodyne	MTNR1B	18	43
COC(=O)C1(CN[C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1	ZINC000450666022	FH	On-Demand	Anodyne	PTGER2	27	42
COC(=O)C1(CN[C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1	ZINC000450666022	FH	On-Demand	Anodyne	PPIA	41	34
COC(=O)C1(CN[C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1	ZINC000450666022	FH	On-Demand	Anodyne	PTGER4	20	42
COC(=O)C1(CN[C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)CC1	ZINC000450666022	FH	On-Demand	Anodyne	MTNR1B	18	43
COC(=O)c1ccc(C(=O)CSc2nnc(-c3ccoc3C)n2C)o1	ZINC000450666042	FF	On-Demand	Anodyne	HCRTR2	0	41
CCC(=O)C1(C(=O)N[C@H]2CCOc3ccc(OC)cc32)CC1	ZINC000450666047	DE	On-Demand	Anodyne	LUXR	41	33
CCC(=O)C1(C(=O)N[C@H]2CCOc3ccc(OC)cc32)CC1	ZINC000450666047	DE	On-Demand	Anodyne	TRAR	60	32
O=C(c1cc2n(n1)CCC2)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450666078	FI	On-Demand	Anodyne	FFAR2	43	31
O=C(c1cc2n(n1)CCC2)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450666079	FI	On-Demand	Anodyne	FFAR2	43	31
OCC[C@H](Nc1ncc(C(F)(F)F)s1)c1cccc(C(F)(F)F)c1	ZINC000450666114	FJ	On-Demand	Anodyne	SCD1	21	41
OCC[C@@H](Nc1ncc(C(F)(F)F)s1)c1cccc(C(F)(F)F)c1	ZINC000450666115	FJ	On-Demand	Anodyne	SCD1	21	41
CCOC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450666120	GI	On-Demand	Anodyne	P2RY12	40	36
CCOC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450666120	GI	On-Demand	Anodyne	DGAT1	17	40
Cc1cccc(CN[C@@H](CN2CCOCC2)c2ccccc2)n1	ZINC000450666134	DF	On-Demand	Anodyne	CASR	43	37
Cc1cccc(CN[C@@H](CN2CCOCC2)c2ccccc2)n1	ZINC000450666134	DF	On-Demand	Anodyne	NPY1R	30	40
Cc1cccc(CN[C@H](CN2CCOCC2)c2ccccc2)n1	ZINC000450666136	DF	On-Demand	Anodyne	CASR	43	37
Cc1cccc(CN[C@H](CN2CCOCC2)c2ccccc2)n1	ZINC000450666136	DF	On-Demand	Anodyne	NPY1R	30	40
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666139	FH	On-Demand	Anodyne	TIMP3	43	33
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666139	FH	On-Demand	Anodyne	F11	41	37
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666139	FH	On-Demand	Anodyne	F7	15	42
CO[C@H](CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666140	FH	On-Demand	Anodyne	TIMP3	43	33
CO[C@H](CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666140	FH	On-Demand	Anodyne	F11	41	37
CO[C@H](CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666140	FH	On-Demand	Anodyne	F7	15	42
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666141	FH	On-Demand	Anodyne	TIMP3	43	33
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666141	FH	On-Demand	Anodyne	F11	41	37
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666141	FH	On-Demand	Anodyne	F7	15	42
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666142	FH	On-Demand	Anodyne	TIMP3	43	33
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666142	FH	On-Demand	Anodyne	F11	41	37
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)Cc1ccccc1	ZINC000450666142	FH	On-Demand	Anodyne	F7	15	42
CC[C@@H]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450666148	EG	On-Demand	Bother	TBXA2R	28	41
CC[C@H]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450666149	EG	On-Demand	Bother	TBXA2R	28	41
CC[C@H]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450666150	EG	On-Demand	Bother	TBXA2R	28	41
CC[C@@H]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450666151	EG	On-Demand	Bother	TBXA2R	28	41
C[C@@H](NCC1(C#N)CCC1)c1ccc(S(C)(=O)=O)cc1	ZINC000450666155	CE	On-Demand	Mild	CTSF	46	37
C[C@H](NCC1(C#N)CCC1)c1ccc(S(C)(=O)=O)cc1	ZINC000450666156	CE	On-Demand	Mild	CTSF	46	37
COc1cc(CN[C@H](C)c2ccc3c(c2)OCO3)ccc1Cl	ZINC000450666157	DH	On-Demand	Anodyne	PDE10A	0	43
COc1cc(CN[C@@H](C)c2ccc3c(c2)OCO3)ccc1Cl	ZINC000450666158	DH	On-Demand	Anodyne	PDE10A	0	43
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(OC)c(F)c2)c(OC)c1	ZINC000450666160	GG	On-Demand	Anodyne	TRPV1	66	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(OC)c(F)c2)c(OC)c1	ZINC000450666160	GG	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(OC)c(F)c2)c(OC)c1	ZINC000450666160	GG	On-Demand	Anodyne	MTNR1B	40	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(OC)c(F)c2)c(OC)c1	ZINC000450666161	GG	On-Demand	Anodyne	TRPV1	66	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(OC)c(F)c2)c(OC)c1	ZINC000450666161	GG	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(OC)c(F)c2)c(OC)c1	ZINC000450666161	GG	On-Demand	Anodyne	MTNR1B	40	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2C)c(OC)c1	ZINC000450666174	FG	On-Demand	Anodyne	MTNR1A	66	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2C)c(OC)c1	ZINC000450666174	FG	On-Demand	Anodyne	MTNR1B	54	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2C)c(OC)c1	ZINC000450666175	FG	On-Demand	Anodyne	MTNR1A	66	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2C)c(OC)c1	ZINC000450666175	FG	On-Demand	Anodyne	MTNR1B	54	38
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccc3)n2Cc2ccco2)C1	ZINC000450666196	FI	On-Demand	Anodyne	HCRTR2	19	42
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccc3)n2Cc2ccco2)C1	ZINC000450666197	FI	On-Demand	Anodyne	HCRTR2	19	42
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccc3)n2Cc2ccco2)C1	ZINC000450666198	FI	On-Demand	Anodyne	HCRTR2	19	42
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccc3)n2Cc2ccco2)C1	ZINC000450666199	FI	On-Demand	Anodyne	HCRTR2	19	42
CC(F)(F)C(C)(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450666204	DH	On-Demand	Bother	P2RX7	49	37
COC(=O)COc1ccc([C@@H](C)NC(=O)Cn2ccc(C)n2)cc1	ZINC000450666205	ED	On-Demand	Anodyne	ACACA	23	40
COC(=O)COc1ccc([C@@H](C)NC(=O)Cn2ccc(C)n2)cc1	ZINC000450666205	ED	On-Demand	Anodyne	ACACB	29	42
COC(=O)COc1ccc([C@H](C)NC(=O)Cn2ccc(C)n2)cc1	ZINC000450666206	ED	On-Demand	Anodyne	ACACA	23	40
COC(=O)COc1ccc([C@H](C)NC(=O)Cn2ccc(C)n2)cc1	ZINC000450666206	ED	On-Demand	Anodyne	ACACB	29	42
COc1ccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450666227	CH	On-Demand	Anodyne	CASR	27	45
COc1ccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450666227	CH	On-Demand	Anodyne	ACPP	0	49
COc1ccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450666227	CH	On-Demand	Anodyne	AOC3	24	44
COc1ccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450666227	CH	On-Demand	Anodyne	GPR88	0	44
COc1ccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450666228	CH	On-Demand	Anodyne	CASR	27	45
COc1ccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450666228	CH	On-Demand	Anodyne	ACPP	0	49
COc1ccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450666228	CH	On-Demand	Anodyne	AOC3	24	44
COc1ccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450666228	CH	On-Demand	Anodyne	GPR88	0	44
COc1ccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450666229	CH	On-Demand	Anodyne	CASR	27	45
COc1ccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450666229	CH	On-Demand	Anodyne	ACPP	0	49
COc1ccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450666229	CH	On-Demand	Anodyne	AOC3	24	44
COc1ccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450666229	CH	On-Demand	Anodyne	GPR88	0	44
COc1ccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450666230	CH	On-Demand	Anodyne	CASR	27	45
COc1ccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450666230	CH	On-Demand	Anodyne	ACPP	0	49
COc1ccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450666230	CH	On-Demand	Anodyne	AOC3	24	44
COc1ccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450666230	CH	On-Demand	Anodyne	GPR88	0	44
CCOC(=O)c1ccc(CSc2nnc(C)n2Cc2ccccc2)nc1	ZINC000450666235	FG	On-Demand	Anodyne	PLA2G2A	59	36
CCOC(=O)c1ccc(CSc2nnc(C)n2Cc2ccccc2)nc1	ZINC000450666235	FG	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CSc2nnc(C)n2Cc2ccccc2)nc1	ZINC000450666235	FG	On-Demand	Anodyne	SLC27A1	41	44
N#CC1(CSc2nnc(-c3ccccc3)n2Cc2ccco2)CCC1	ZINC000450666242	FI	On-Demand	Mild	HCRTR2	20	42
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450666243	DH	On-Demand	Anodyne	OPRM1	22	40
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450666243	DH	On-Demand	Anodyne	OPRD1	57	35
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450666243	DH	On-Demand	Anodyne	CFTR	43	36
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450666243	DH	On-Demand	Anodyne	BCL2	41	49
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450666244	DH	On-Demand	Anodyne	OPRM1	22	40
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450666244	DH	On-Demand	Anodyne	BCL2	41	49
CCS(=O)(=O)c1ccc(CNC(=O)C2(Cc3cccc(Cl)c3)CC2)cc1	ZINC000450666249	GH	On-Demand	Anodyne	FBP1	24	45
CCS(=O)(=O)c1ccc(CNC(=O)C2(Cc3cccc(Cl)c3)CC2)cc1	ZINC000450666249	GH	On-Demand	Anodyne	RORC	49	42
CCS(=O)(=O)c1ccc(CNC(=O)C2(Cc3cccc(Cl)c3)CC2)cc1	ZINC000450666249	GH	On-Demand	Anodyne	PDS	42	38
Cc1nn(C)cc1CSc1nnc(-c2ccoc2C)n1Cc1ccccc1	ZINC000450666258	GI	On-Demand	Anodyne	HCRTR2	21	46
CN1CCC[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1=O	ZINC000450666259	ED	On-Demand	Bother	SLC27A4	42	31
CN1CCC[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1=O	ZINC000450666260	ED	On-Demand	Bother	SLC27A4	42	31
FC1(F)CCCC[C@H]1CSc1nnc(-c2cccnc2)n1Cc1ccco1	ZINC000450666268	GJ	On-Demand	Anodyne	HCRTR2	17	42
FC1(F)CCCC[C@@H]1CSc1nnc(-c2cccnc2)n1Cc1ccco1	ZINC000450666269	GJ	On-Demand	Anodyne	HCRTR2	17	42
Cc1occc1-c1nnc(SCC[C@@H]2CCOC2)n1Cc1ccccc1	ZINC000450666272	FI	On-Demand	Anodyne	HCRTR2	21	44
Cc1occc1-c1nnc(SCC[C@H]2CCOC2)n1Cc1ccccc1	ZINC000450666273	FI	On-Demand	Anodyne	HCRTR2	21	44
COc1ccc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cc1	ZINC000450666276	FG	On-Demand	Anodyne	NQO2	21	42
COc1ccc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cc1	ZINC000450666276	FG	On-Demand	Anodyne	MTNR1A	76	42
COc1ccc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cc1	ZINC000450666276	FG	On-Demand	Anodyne	MTNR1B	60	41
COc1ccc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cc1	ZINC000450666277	FG	On-Demand	Anodyne	NQO2	21	42
COc1ccc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cc1	ZINC000450666277	FG	On-Demand	Anodyne	MTNR1A	76	42
COc1ccc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cc1	ZINC000450666277	FG	On-Demand	Anodyne	MTNR1B	60	41
CC(C)(C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C1CCC1	ZINC000450666280	DH	On-Demand	Bother	P2RX7	29	40
CC(C)(C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C1CCC1	ZINC000450666280	DH	On-Demand	Bother	NMBR	47	31
COC(=O)COc1ccc([C@H](C)NC(=O)C2CC(C)(O)C2)cc1	ZINC000450666281	DD	On-Demand	Anodyne	ACACB	31	48
COC(=O)COc1ccc([C@@H](C)NC(=O)C2CC(C)(O)C2)cc1	ZINC000450666282	DD	On-Demand	Anodyne	ACACB	31	48
C[C@@]1(Cc2ccccc2)CCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450666286	EH	On-Demand	Anodyne	SLC12A5	80	42
C[C@]1(Cc2ccccc2)CCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450666287	EH	On-Demand	Anodyne	SLC12A5	80	42
CCOc1cc(NC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)ncn1	ZINC000450666304	GG	On-Demand	Anodyne	SSTR5	55	36
CCOc1cc(NC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)ncn1	ZINC000450666304	GG	On-Demand	Anodyne	GPR119	31	40
CCOc1cc(NC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)ncn1	ZINC000450666304	GG	On-Demand	Anodyne	SFRP1	82	45
CCOc1cc(NC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)ncn1	ZINC000450666304	GG	On-Demand	Anodyne	WNT3	57	33
CC(=O)CCCCCSc1nc(N)cc(=N)[nH]1	ZINC000450666307	CD	On-Demand	Anodyne	HDA106	0	45
CCOc1cc(NC2CCN(C(=O)[C@H](C)Oc3ccccn3)CC2)ncn1	ZINC000450666315	FE	On-Demand	Anodyne	P2RY12	40	35
CCOc1cc(NC2CCN(C(=O)[C@H](C)Oc3ccccn3)CC2)ncn1	ZINC000450666315	FE	On-Demand	Anodyne	GPR119	24	40
CCOc1cc(NC2CCN(C(=O)[C@@H](C)Oc3ccccn3)CC2)ncn1	ZINC000450666319	FE	On-Demand	Anodyne	P2RY12	40	35
CCOc1cc(NC2CCN(C(=O)[C@@H](C)Oc3ccccn3)CC2)ncn1	ZINC000450666319	FE	On-Demand	Anodyne	GPR119	24	40
COc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000450666326	CF	On-Demand	Anodyne	CASP3	53	40
COc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000450666326	CF	On-Demand	Anodyne	CHRNA10	83	56
COc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000450666326	CF	On-Demand	Anodyne	CASP7	40	40
COc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000450666326	CF	On-Demand	Anodyne	ACKR3	40	32
COc1cc(CNC2(c3ccccc3)CC2)ccc1Cl	ZINC000450666337	CI	On-Demand	Anodyne	TACR3	47	39
CCN(C)C(=O)[C@@H](Nc1ncnc2[nH]c3ccccc3c12)C(C)C	ZINC000450666338	EG	On-Demand	Anodyne	UTS2R	24	41
COc1ccc(CNC(=O)CCSc2nc(N)cc(N)n2)c(OC)c1	ZINC000450666339	FD	On-Demand	Anodyne	DRTS_TOXGO	27	43
COc1ccc(CNC(=O)CCSc2nc(N)cc(N)n2)c(OC)c1	ZINC000450666339	FD	On-Demand	Anodyne	MTNR1A	53	38
COc1ccc(CNC(=O)CCSc2nc(N)cc(N)n2)c(OC)c1	ZINC000450666339	FD	On-Demand	Anodyne	TNKS	41	32
CCN(C)C(=O)[C@@H](Nc1ncc(C)s1)C(C)C	ZINC000450666349	CE	On-Demand	Anodyne	FDPS	15	46
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)CCO2	ZINC000450666361	FH	On-Demand	Anodyne	OPRK1	0	40
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)CCO2	ZINC000450666361	FH	On-Demand	Anodyne	LUXR	72	43
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)CCO2	ZINC000450666361	FH	On-Demand	Anodyne	TRAR	82	40
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)CCO2	ZINC000450666361	FH	On-Demand	Anodyne	LASR	50	40
COc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)CCO2	ZINC000450666361	FH	On-Demand	Anodyne	PHZR	0	44
Cc1oc2ccccc2c1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450666367	CI	On-Demand	Anodyne	THRB	0	40
COc1ccc(CN2CCCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2=O)cc1	ZINC000450666376	GG	On-Demand	Anodyne	NPY1R	15	43
COc1ccc(CN2CCCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2=O)cc1	ZINC000450666376	GG	On-Demand	Anodyne	MMP3	20	42
COc1ccc(CN2CCCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2=O)cc1	ZINC000450666376	GG	On-Demand	Anodyne	MMP9	27	42
COc1ccc(CN2CCCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2=O)cc1	ZINC000450666376	GG	On-Demand	Anodyne	MMP7	25	42
COc1ccc(CN2CCCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2=O)cc1	ZINC000450666376	GG	On-Demand	Anodyne	MMP1	24	42
CC(C)C[C@H](NC[C@H]1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000450666379	FI	On-Demand	Anodyne	TACR1	47	41
CC(C)C[C@@H](NC[C@H]1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000450666380	FI	On-Demand	Anodyne	TACR1	47	41
CC(C)C[C@@H](NC[C@@H]1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000450666381	FI	On-Demand	Anodyne	TACR1	47	41
CC(C)C[C@H](NC[C@@H]1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000450666382	FI	On-Demand	Anodyne	TACR1	47	41
COc1ccc(CN2CCCN(C(=O)c3cccc4c3CCCC4)CC2=O)cc1	ZINC000450666389	GG	On-Demand	Anodyne	FABP4	42	39
COc1ccc(CN2CCCN(C(=O)c3cccc4c3CCCC4)CC2=O)cc1	ZINC000450666389	GG	On-Demand	Anodyne	P2RX7	15	41
COc1ccc(CN2CCCN(C(=O)c3cccc4c3CCCC4)CC2=O)cc1	ZINC000450666389	GG	On-Demand	Anodyne	NOD1	15	41
COc1ccc(CN2CCCN(C(=O)c3cccc4c3CCCC4)CC2=O)cc1	ZINC000450666389	GG	On-Demand	Anodyne	NOD2	32	41
O=C(NCC(F)(F)CO)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450666401	CF	On-Demand	Anodyne	SCN9A	0	43
COc1ccc(CN2CCCN(C(=O)C(C)(C)C3CCC3)CC2=O)cc1	ZINC000450666410	FG	On-Demand	Anodyne	MMP1	18	42
COC(=O)c1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450666413	DE	On-Demand	Anodyne	CASP3	57	39
COC(=O)c1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450666413	DE	On-Demand	Anodyne	CPT1A	76	36
COC(=O)c1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450666413	DE	On-Demand	Anodyne	CHRNA10	65	47
COC(=O)c1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450666413	DE	On-Demand	Anodyne	CASP7	43	39
CCCOc1ccc(C(=O)N2CC(C(=O)NC)C2)c(OC)c1	ZINC000450666414	DD	On-Demand	Anodyne	OXTR	0	41
COc1cc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-]	ZINC000450666415	FI	On-Demand	Bother	PHES	0	42
COc1cc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-]	ZINC000450666421	FI	On-Demand	Bother	PHES	0	42
CC(C)c1nnc(COc2ccccc2C(=O)NCc2ccccc2)s1	ZINC000450666425	FI	On-Demand	Anodyne	HCN1	75	42
CC(C)c1nnc(COc2ccccc2C(=O)NCc2ccccc2)s1	ZINC000450666425	FI	On-Demand	Anodyne	HCN4	50	35
CC(C)c1nnc(COc2ccccc2C(=O)NCc2ccccc2)s1	ZINC000450666425	FI	On-Demand	Anodyne	PDS	46	36
CC(=O)N[C@H](C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)C(C)(C)C	ZINC000450666427	FG	On-Demand	Anodyne	GUAB	0	44
CC(=O)N[C@H](C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)C(C)(C)C	ZINC000450666427	FG	On-Demand	Anodyne	IMDH_CRYPV	48	44
CNC(=O)C1CN(C(=O)c2ccc(I)cc2F)C1	ZINC000450666429	FD	On-Demand	Anodyne	MAP2K1	32	49
CCOc1cc(NC2CCN(C(=O)c3cn4nccc4nc3C)CC2)ncn1	ZINC000450666436	GD	On-Demand	Anodyne	SSTR5	53	37
CC1(C)CN(C(=O)CCc2ccc(C(N)=O)cc2)CC(C)(C)C1	ZINC000450666445	DG	On-Demand	Anodyne	GPBAR1	19	40
C=CCOc1ccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)cc1	ZINC000450666464	FG	On-Demand	Mild	LUXR	77	40
C=CCOc1ccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)cc1	ZINC000450666464	FG	On-Demand	Mild	TRAR	85	40
C=CCOc1ccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)cc1	ZINC000450666464	FG	On-Demand	Mild	LASR	49	38
C=CCOc1ccc(CC(=O)N[C@H]2CCOc3ccc(OC)cc32)cc1	ZINC000450666464	FG	On-Demand	Mild	PHZR	0	51
Cn1c(COc2ccc(Cl)cc2)nnc1SCC(=O)CC(C)(C)C1CC1	ZINC000450666483	GJ	On-Demand	Anodyne	VCP	48	38
CC[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450666536	DH	On-Demand	Anodyne	ADRB3	15	41
CC[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450666536	DH	On-Demand	Anodyne	AOC3	17	41
CC[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450666537	DH	On-Demand	Anodyne	AOC3	17	41
CC[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450666538	DH	On-Demand	Anodyne	ADRB3	15	41
CC[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450666538	DH	On-Demand	Anodyne	AOC3	17	41
CC[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450666539	DH	On-Demand	Anodyne	ADRB3	15	41
CC[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)cc1	ZINC000450666539	DH	On-Demand	Anodyne	AOC3	17	41
CCSc1cccnc1C(=O)N[C@@H]1CCCc2sccc21	ZINC000450666552	DI	On-Demand	Anodyne	MAP1	41	36
CCSc1cccnc1C(=O)N[C@H]1CCCc2sccc21	ZINC000450666553	DI	On-Demand	Anodyne	MAP1	41	36
CO[C@@H]1COC[C@H]1N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000450666566	CF	On-Demand	Anodyne	CCR2	29	42
CO[C@@H]1COC[C@H]1N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000450666567	CF	On-Demand	Anodyne	CCR2	29	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2sccc21	ZINC000450666580	EH	On-Demand	Anodyne	ACE	48	37
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2sccc21	ZINC000450666581	EH	On-Demand	Anodyne	ACE	48	37
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCc2sccc21	ZINC000450666582	EH	On-Demand	Anodyne	ACE	48	37
Cc1nn(C)cc1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450666588	DE	On-Demand	Bother	P2RX7	40	45
OC[C@H](NCC1=CCCCC1)c1ccccc1	ZINC000450666589	BF	On-Demand	Anodyne	MAN1	0	42
OC[C@@H](NCC1=CCCCC1)c1ccccc1	ZINC000450666590	BF	On-Demand	Anodyne	MAN1	0	42
C[C@@H](NC[C@H]1COCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450666593	EG	On-Demand	Anodyne	KCNK3	46	32
C[C@@H](NC[C@H]1COCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450666593	EG	On-Demand	Anodyne	KCNK9	65	40
C[C@@H](NC[C@@H]1COCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450666594	EG	On-Demand	Anodyne	KCNK3	46	32
C[C@@H](NC[C@@H]1COCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450666594	EG	On-Demand	Anodyne	KCNK9	65	40
C[C@H](NC[C@@H]1COCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450666595	EG	On-Demand	Anodyne	KCNK3	46	32
C[C@H](NC[C@@H]1COCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450666595	EG	On-Demand	Anodyne	KCNK9	65	40
C[C@H](NC[C@H]1COCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450666596	EG	On-Demand	Anodyne	KCNK3	46	32
C[C@H](NC[C@H]1COCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450666596	EG	On-Demand	Anodyne	KCNK9	65	40
COC(=O)C1(CN[C@H](C)c2ccc(OC(C)C)cc2)CC1	ZINC000450666601	CG	On-Demand	Anodyne	ACACA	23	44
COC(=O)C1(CN[C@@H](C)c2ccc(OC(C)C)cc2)CC1	ZINC000450666602	CG	On-Demand	Anodyne	ACACA	23	44
CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1nc2ccccc2nc1C1CC1	ZINC000450666610	FI	On-Demand	Anodyne	TSPO	18	46
COC(=O)COc1ccc([C@@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450666611	FE	On-Demand	Anodyne	ACACA	22	40
COC(=O)COc1ccc([C@@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450666611	FE	On-Demand	Anodyne	ACACB	28	40
COC(=O)COc1ccc([C@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450666612	FE	On-Demand	Anodyne	ACACA	22	40
COC(=O)COc1ccc([C@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450666612	FE	On-Demand	Anodyne	ACACB	28	40
Cn1c(C#N)ccc1C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450666630	GE	On-Demand	Mild	P2RX7	30	40
Cn1c(C#N)ccc1C(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450666631	GE	On-Demand	Mild	P2RX7	30	40
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450666634	CH	On-Demand	Anodyne	PREP	22	41
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450666634	CH	On-Demand	Anodyne	CFTR	44	32
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450666634	CH	On-Demand	Anodyne	NR1D1	42	42
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450666635	CH	On-Demand	Anodyne	PREP	22	41
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450666635	CH	On-Demand	Anodyne	CFTR	44	32
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450666635	CH	On-Demand	Anodyne	NR1D1	39	42
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2CC(C)C)cc1	ZINC000450666636	EG	On-Demand	Anodyne	ACACA	52	43
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2CC(C)C)cc1	ZINC000450666636	EG	On-Demand	Anodyne	ACACB	28	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]2CC(C)C)cc1	ZINC000450666637	EG	On-Demand	Anodyne	ACACA	52	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]2CC(C)C)cc1	ZINC000450666637	EG	On-Demand	Anodyne	ACACB	28	43
C[C@@]1(C(=O)N[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC=CCC1	ZINC000450666643	GI	On-Demand	Anodyne	APP	15	43
C[C@@]1(C(=O)N[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC=CCC1	ZINC000450666643	GI	On-Demand	Anodyne	CCR2	55	36
C[C@]1(C(=O)N[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC=CCC1	ZINC000450666644	GI	On-Demand	Anodyne	APP	15	43
C[C@]1(C(=O)N[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC=CCC1	ZINC000450666644	GI	On-Demand	Anodyne	CCR2	55	36
C[C@]1(C(=O)N[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC=CCC1	ZINC000450666645	GI	On-Demand	Anodyne	APP	15	43
C[C@]1(C(=O)N[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC=CCC1	ZINC000450666645	GI	On-Demand	Anodyne	CCR2	55	36
C[C@@]1(C(=O)N[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC=CCC1	ZINC000450666646	GI	On-Demand	Anodyne	APP	15	43
C[C@@]1(C(=O)N[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC=CCC1	ZINC000450666646	GI	On-Demand	Anodyne	CCR2	55	36
CC[C@H]1Cc2ccccc2CN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450666654	EI	On-Demand	Anodyne	NR1D1	44	43
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450666655	EI	On-Demand	Anodyne	NR1D1	44	43
OCC[C@@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450666667	CE	On-Demand	Anodyne	MAN1B1	51	32
OCC[C@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450666668	CE	On-Demand	Anodyne	MAN1B1	51	32
OCC[C@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450666669	CE	On-Demand	Anodyne	MAN1B1	51	32
OCC[C@@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450666670	CE	On-Demand	Anodyne	MAN1B1	51	32
CC(=O)CCCCCSc1nnc(C)n1Cc1ccccc1	ZINC000450666672	DH	On-Demand	Anodyne	AGTR1	19	42
Cc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)nn2c1OCCC2	ZINC000450666681	FE	On-Demand	Bother	P2RX7	41	36
COC(=O)C1(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)CC1	ZINC000450666687	EH	On-Demand	Anodyne	PDE4A	42	45
COC(=O)C1(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)CC1	ZINC000450666687	EH	On-Demand	Anodyne	PDE4B	25	40
COC(=O)C1(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)CC1	ZINC000450666687	EH	On-Demand	Anodyne	PDE4D	23	42
COC(=O)C1(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)CC1	ZINC000450666687	EH	On-Demand	Anodyne	PDE4C	16	42
COC(=O)C1(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)CC1	ZINC000450666688	EH	On-Demand	Anodyne	PDE4A	42	45
COC(=O)C1(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)CC1	ZINC000450666688	EH	On-Demand	Anodyne	PDE4B	25	40
COC(=O)C1(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)CC1	ZINC000450666688	EH	On-Demand	Anodyne	PDE4D	23	42
COC(=O)C1(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)CC1	ZINC000450666688	EH	On-Demand	Anodyne	PDE4C	16	42
CCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450666702	FG	On-Demand	Anodyne	MTTP	38	44
CCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450666702	FG	On-Demand	Anodyne	CCR2	46	37
CCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450666702	FG	On-Demand	Anodyne	EPHX2	0	41
CCNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450666702	FG	On-Demand	Anodyne	SCD1	29	40
CCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450666703	FG	On-Demand	Anodyne	MTTP	38	44
CCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450666703	FG	On-Demand	Anodyne	CCR2	46	37
CCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450666703	FG	On-Demand	Anodyne	EPHX2	0	41
CCNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450666703	FG	On-Demand	Anodyne	SCD1	29	40
COc1cc([C@H](C)NCC2CC(F)(F)C2)ccc1OCc1ccncc1	ZINC000450666705	FI	On-Demand	Anodyne	PDE4A	26	41
COc1cc([C@@H](C)NCC2CC(F)(F)C2)ccc1OCc1ccncc1	ZINC000450666706	FI	On-Demand	Anodyne	PDE4A	26	41
COc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCC[C@H]1c1ccccc1)CCO2	ZINC000450666711	FI	On-Demand	Anodyne	MTNR1A	15	41
COc1ccc2c(c1)[C@@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)CCO2	ZINC000450666712	FI	On-Demand	Anodyne	MTNR1A	15	41
COc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCC[C@@H]1c1ccccc1)CCO2	ZINC000450666713	FI	On-Demand	Anodyne	MTNR1A	15	41
COc1ccc2c(c1)[C@@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)CCO2	ZINC000450666714	FI	On-Demand	Anodyne	MTNR1A	15	41
COC(=O)c1coc(CN[C@@H](C)c2ccc(OCc3ccccc3)c(OC)c2)n1	ZINC000450666719	GH	On-Demand	Anodyne	PTGER1	34	45
COC(=O)c1coc(CN[C@H](C)c2ccc(OCc3ccccc3)c(OC)c2)n1	ZINC000450666720	GH	On-Demand	Anodyne	PTGER1	34	45
COc1ccc2c(c1)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)CCO2	ZINC000450666722	GI	On-Demand	Anodyne	RBP4	67	35
COc1cc([C@H](C)NC[C@@H]2C[C@H]3CC[C@H]2O3)ccc1OC1CCCC1	ZINC000450666726	EI	On-Demand	Anodyne	PDE4A	38	41
COc1cc([C@@H](C)NC[C@@H]2C[C@H]3CC[C@H]2O3)ccc1OC1CCCC1	ZINC000450666727	EI	On-Demand	Anodyne	PDE4A	38	41
COc1cc([C@H](C)NC[C@H]2C[C@H]3CC[C@H]2O3)ccc1OC1CCCC1	ZINC000450666728	EI	On-Demand	Anodyne	PDE4A	38	41
COc1cc([C@@H](C)NC[C@H]2C[C@H]3CC[C@H]2O3)ccc1OC1CCCC1	ZINC000450666729	EI	On-Demand	Anodyne	PDE4A	38	41
C=CCNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450666730	GH	On-Demand	Mild	MPL	16	42
C=CCNC(=O)c1ccc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450666730	GH	On-Demand	Mild	HPGDS	30	41
Cc1ccc([N+](=O)[O-])c(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450666746	DG	On-Demand	Bother	CASP3	55	39
Cc1ccc([N+](=O)[O-])c(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450666746	DG	On-Demand	Bother	CHRNA10	67	48
Cc1ccc([N+](=O)[O-])c(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450666746	DG	On-Demand	Bother	CASP7	44	39
COC(=O)c1ccc(OC[C@H](Cc2ccccc2)OC)c(OC)c1	ZINC000450666749	EG	On-Demand	Anodyne	ABCB1	28	41
COC(=O)c1ccc(OC[C@H](Cc2ccccc2)OC)c(OC)c1	ZINC000450666749	EG	On-Demand	Anodyne	PDS	57	37
CCOC(=O)c1ccc(CSc2nnc(-c3ccoc3C)o2)nc1	ZINC000450666750	EH	On-Demand	Anodyne	ALOX15	62	36
COC(=O)c1ccc(OC[C@@H](Cc2ccccc2)OC)c(OC)c1	ZINC000450666757	EG	On-Demand	Anodyne	ABCB1	28	41
COC(=O)c1ccc(OC[C@@H](Cc2ccccc2)OC)c(OC)c1	ZINC000450666757	EG	On-Demand	Anodyne	PDS	57	37
Cn1c(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)c2n(c1=O)CCCC2	ZINC000450666770	FF	On-Demand	Anodyne	SLC12A5	74	38
COc1cc([C@H](C)NC[C@@H]2CCC(F)(F)C2)ccc1OCc1ccncc1	ZINC000450666771	GJ	On-Demand	Anodyne	PDE4A	26	40
Cn1c(C(=O)N2CCC[C@]2(C)Cc2ccccc2)c2n(c1=O)CCCC2	ZINC000450666772	FF	On-Demand	Anodyne	SLC12A5	74	38
COc1cc([C@@H](C)NC[C@@H]2CCC(F)(F)C2)ccc1OCc1ccncc1	ZINC000450666774	GJ	On-Demand	Anodyne	PDE4A	26	40
COc1cc([C@H](C)NC[C@H]2CCC(F)(F)C2)ccc1OCc1ccncc1	ZINC000450666775	GJ	On-Demand	Anodyne	PDE4A	26	40
COc1cc([C@@H](C)NC[C@H]2CCC(F)(F)C2)ccc1OCc1ccncc1	ZINC000450666776	GJ	On-Demand	Anodyne	PDE4A	26	40
COc1ccc2c(c1)[C@@H](NC(=O)C(C)(C)C(C)(F)F)CCO2	ZINC000450666796	DG	On-Demand	Anodyne	NQO2	28	40
COc1ccc2c(c1)[C@@H](NC(=O)C(C)(C)C(C)(F)F)CCO2	ZINC000450666796	DG	On-Demand	Anodyne	TRAR	42	37
COc1ccc(CN2CCCN(C(=O)c3cc(C)c(C(N)=O)cn3)CC2=O)cc1	ZINC000450666801	GD	On-Demand	Anodyne	PROKR1	58	31
CCN(C)C(=O)[C@@H](Nc1ncnc2c(F)c(OC)ccc12)C(C)C	ZINC000450666809	EF	On-Demand	Anodyne	PDE6A	41	33
FC(F)(F)c1csc(C2CCN(c3ncccc3Cl)CC2)n1	ZINC000450666813	EJ	On-Demand	Anodyne	TRPV1	18	41
Cc1cccc(Cl)c1C(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1	ZINC000450666825	FF	On-Demand	Anodyne	SLC6A9	41	40
Cc1cccc(Cl)c1C(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1	ZINC000450666825	FF	On-Demand	Anodyne	EPHX2	37	41
COC(=O)c1cccc(OCc2cn(C)nc2C)c1	ZINC000450666837	CE	On-Demand	Anodyne	DRD4	41	33
CC[C@@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450666842	CF	On-Demand	Anodyne	TRPV1	27	42
CC[C@@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450666842	CF	On-Demand	Anodyne	NCE103	23	43
CC[C@@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450666842	CF	On-Demand	Anodyne	CAN2	0	43
CC[C@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450666843	CF	On-Demand	Anodyne	TRPV1	27	42
CC[C@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450666843	CF	On-Demand	Anodyne	NCE103	23	43
CC[C@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450666843	CF	On-Demand	Anodyne	CAN2	0	43
O=C(Nc1ccc(Oc2nncc3ccccc23)cc1)[C@H](O)C1CCC1	ZINC000450666844	EH	On-Demand	Anodyne	GUAB	0	42
O=C(Nc1ccc(Oc2nncc3ccccc23)cc1)[C@@H](O)C1CCC1	ZINC000450666845	EH	On-Demand	Anodyne	GUAB	0	42
Cc1ccn(CC(=O)N2CCC[C@]2(C)Cc2ccccc2)n1	ZINC000450666849	CF	On-Demand	Anodyne	SLC12A5	77	42
Cc1ccn(CC(=O)N2CCC[C@@]2(C)Cc2ccccc2)n1	ZINC000450666850	CF	On-Demand	Anodyne	SLC12A5	77	42
Cc1nn(C)cc1CC(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450666851	DF	On-Demand	Anodyne	SLC12A5	72	39
Cc1nn(C)cc1CC(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450666852	DF	On-Demand	Anodyne	SLC12A5	72	39
COCc1nnc(N2CCC[C@H]2COc2ccccc2)s1	ZINC000450666853	DF	On-Demand	Anodyne	CHRNA10	76	52
Fc1cccnc1N1CCC[C@H]1COc1ccccc1	ZINC000450666855	CG	On-Demand	Anodyne	CASP3	51	36
Fc1cccnc1N1CCC[C@H]1COc1ccccc1	ZINC000450666855	CG	On-Demand	Anodyne	CHRNA10	83	53
Fc1cccnc1N1CCC[C@H]1COc1ccccc1	ZINC000450666855	CG	On-Demand	Anodyne	CASP7	42	37
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450666856	GI	On-Demand	Bother	SLC12A5	60	35
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450666857	GI	On-Demand	Bother	SLC12A5	60	35
CCOc1cc(NC2CCN(C(=O)c3ccc4nccnc4n3)CC2)ncn1	ZINC000450666862	GD	On-Demand	Anodyne	SSTR5	44	34
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(O)c2)c(OC)c1	ZINC000450666872	FF	On-Demand	Anodyne	NQO2	22	40
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(O)c2)c(OC)c1	ZINC000450666873	FF	On-Demand	Anodyne	NQO2	22	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCc2sccc21	ZINC000450666883	EH	On-Demand	Anodyne	ACE	48	37
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCCc2sccc21	ZINC000450666889	DG	On-Demand	Anodyne	LUXR	40	37
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCCc2sccc21	ZINC000450666890	DG	On-Demand	Anodyne	LUXR	40	37
CC[C@@H]1CCC[C@H]1CNc1cc(COC)nc2ncnn12	ZINC000450666921	CF	On-Demand	Anodyne	DHOD	0	40
CC[C@H]1CCC[C@@H]1CNc1cc(COC)nc2ncnn12	ZINC000450666922	CF	On-Demand	Anodyne	DHOD	0	40
CC[C@H]1CCC[C@H]1CNc1cc(COC)nc2ncnn12	ZINC000450666923	CF	On-Demand	Anodyne	DHOD	0	40
CC[C@@H]1CCC[C@@H]1CNc1cc(COC)nc2ncnn12	ZINC000450666924	CF	On-Demand	Anodyne	DHOD	0	40
CCNC(=O)c1ccc(NCc2ccnc(C(F)(F)F)c2)nn1	ZINC000450666957	ED	On-Demand	Anodyne	BRAF	18	40
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CCO[C@@H](c3cccc(Cl)c3)C1)C(=O)C2	ZINC000450666976	FH	On-Demand	Anodyne	MDM2	58	31
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CCO[C@H](c3cccc(Cl)c3)C1)C(=O)C2	ZINC000450666977	FH	On-Demand	Anodyne	MDM2	58	31
COc1ccc(CNC(=O)CCN[C@H](CO)c2ccccc2)c(OC)c1	ZINC000450666994	FE	On-Demand	Anodyne	MTNR1A	78	39
COc1ccc(CNC(=O)CCN[C@H](CO)c2ccccc2)c(OC)c1	ZINC000450666994	FE	On-Demand	Anodyne	MTNR1B	70	39
COc1ccc(CNC(=O)CCN[C@@H](CO)c2ccccc2)c(OC)c1	ZINC000450666995	FE	On-Demand	Anodyne	MTNR1A	78	39
COc1ccc(CNC(=O)CCN[C@@H](CO)c2ccccc2)c(OC)c1	ZINC000450666995	FE	On-Demand	Anodyne	MTNR1B	70	39
Cc1nnc(S[C@H](C)C(=O)Nc2nccs2)n1Cc1ccccc1	ZINC000450667002	FG	On-Demand	Anodyne	MAP	0	41
Cc1nnc(S[C@H](C)C(=O)Nc2nccs2)n1Cc1ccccc1	ZINC000450667002	FG	On-Demand	Anodyne	MAP1	110	41
Cc1nnc(S[C@@H](C)C(=O)Nc2nccs2)n1Cc1ccccc1	ZINC000450667003	FG	On-Demand	Anodyne	MAP	0	41
Cc1nnc(S[C@@H](C)C(=O)Nc2nccs2)n1Cc1ccccc1	ZINC000450667003	FG	On-Demand	Anodyne	MAP1	110	41
CNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450667009	GH	On-Demand	Bother	TAAR1	19	43
CNC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450667009	GH	On-Demand	Bother	AKR1C4	0	42
CNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450667011	GH	On-Demand	Bother	TAAR1	19	43
CNC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	ZINC000450667011	GH	On-Demand	Bother	AKR1C4	0	42
OCC[C@H](Nc1ncnc2c1ncn2C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450667014	GH	On-Demand	Anodyne	ADORA1	44	44
OCC[C@H](Nc1ncnc2c1ncn2C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450667014	GH	On-Demand	Anodyne	SLC29A1	18	41
OCC[C@H](Nc1ncnc2c1ncn2C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450667014	GH	On-Demand	Anodyne	ADORA3	44	40
OCC[C@@H](Nc1ncnc2c1ncn2C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450667015	GH	On-Demand	Anodyne	ADORA1	44	44
OCC[C@@H](Nc1ncnc2c1ncn2C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450667015	GH	On-Demand	Anodyne	SLC29A1	18	41
OCC[C@@H](Nc1ncnc2c1ncn2C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450667015	GH	On-Demand	Anodyne	ADORA3	44	40
COC(=O)COc1ccc([C@@H](C)NC(=O)c2c3n(c(=O)n2C)CCCC3)cc1	ZINC000450667021	GD	On-Demand	Anodyne	ACACA	41	34
COC(=O)COc1ccc([C@H](C)NC(=O)c2c3n(c(=O)n2C)CCCC3)cc1	ZINC000450667025	GD	On-Demand	Anodyne	ACACA	41	34
CC(C)N1CCCC[C@H]1CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450667035	EH	On-Demand	Anodyne	EPHX2	15	40
CC(C)N1CCCC[C@@H]1CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450667036	EH	On-Demand	Anodyne	EPHX2	15	40
CC(C)N1CCCC[C@@H]1CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450667037	EH	On-Demand	Anodyne	EPHX2	15	40
CC(C)N1CCCC[C@H]1CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450667038	EH	On-Demand	Anodyne	EPHX2	15	40
OCC[C@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450667043	GE	On-Demand	Anodyne	CASR	20	40
OCC[C@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450667043	GE	On-Demand	Anodyne	SMG1	24	42
OCC[C@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450667043	GE	On-Demand	Anodyne	MAP3K12	20	42
OCC[C@@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450667044	GE	On-Demand	Anodyne	CASR	20	40
OCC[C@@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450667044	GE	On-Demand	Anodyne	SMG1	24	42
OCC[C@@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450667044	GE	On-Demand	Anodyne	MAP3K12	20	42
O=C(NCC(=O)N1CCC[C@H]1C1CCOCC1)Nc1cccc(Cl)c1	ZINC000450667052	FF	On-Demand	Anodyne	EPHX2	27	45
O=C(NCC(=O)N1CCC[C@H]1C1CCOCC1)Nc1cccc(Cl)c1	ZINC000450667052	FF	On-Demand	Anodyne	FAP	0	40
O=C(NCC(=O)N1CCC[C@@H]1C1CCOCC1)Nc1cccc(Cl)c1	ZINC000450667056	FF	On-Demand	Anodyne	EPHX2	27	45
O=C(NCC(=O)N1CCC[C@@H]1C1CCOCC1)Nc1cccc(Cl)c1	ZINC000450667056	FF	On-Demand	Anodyne	FAP	0	40
COC(=O)c1csc(CN[C@@H](C)c2cccc(OCc3ccccn3)c2)n1	ZINC000450667066	GH	On-Demand	Anodyne	PDE5A	0	40
COC(=O)c1csc(CN[C@H](C)c2cccc(OCc3ccccn3)c2)n1	ZINC000450667068	GH	On-Demand	Anodyne	PDE5A	0	40
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc(C)ccc1F)CCO2	ZINC000450667078	EG	On-Demand	Anodyne	LUXR	61	39
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc(C)ccc1F)CCO2	ZINC000450667078	EG	On-Demand	Anodyne	TRAR	78	39
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc(C)ccc1F)CCO2	ZINC000450667078	EG	On-Demand	Anodyne	LASR	46	34
Clc1ccc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450667097	GJ	On-Demand	Anodyne	HCRTR2	17	43
Clc1ccc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450667100	GJ	On-Demand	Anodyne	HCRTR2	17	43
O=C(NCc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450667111	EG	On-Demand	Anodyne	KCNA3	35	41
O=C(NCc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450667111	EG	On-Demand	Anodyne	HCN1	42	33
O=C(NCc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450667111	EG	On-Demand	Anodyne	HCN4	42	33
O=C(NCc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450667113	EG	On-Demand	Anodyne	KCNA3	35	41
O=C(NCc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450667113	EG	On-Demand	Anodyne	HCN1	42	33
O=C(NCc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450667113	EG	On-Demand	Anodyne	HCN4	42	33
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667114	GG	On-Demand	Anodyne	TNKS	53	34
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667114	GG	On-Demand	Anodyne	LUXN	0	50
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667114	GG	On-Demand	Anodyne	ADIPOR1	0	45
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667114	GG	On-Demand	Anodyne	ADIPOR2	0	45
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667116	GG	On-Demand	Anodyne	TNKS	53	34
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667116	GG	On-Demand	Anodyne	LUXN	0	50
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667116	GG	On-Demand	Anodyne	ADIPOR1	0	45
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667116	GG	On-Demand	Anodyne	ADIPOR2	0	45
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667117	GG	On-Demand	Anodyne	TNKS	53	34
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667117	GG	On-Demand	Anodyne	LUXN	0	50
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667117	GG	On-Demand	Anodyne	ADIPOR1	0	45
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667117	GG	On-Demand	Anodyne	ADIPOR2	0	45
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667118	GG	On-Demand	Anodyne	TNKS	53	34
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667118	GG	On-Demand	Anodyne	LUXN	0	50
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667118	GG	On-Demand	Anodyne	ADIPOR1	0	45
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667118	GG	On-Demand	Anodyne	ADIPOR2	0	45
COC(=O)C1(CN[C@H](C)c2cccc(OC)c2)CC1	ZINC000450667121	CE	On-Demand	Anodyne	MTNR1A	34	43
COC(=O)C1(CN[C@H](C)c2cccc(OC)c2)CC1	ZINC000450667121	CE	On-Demand	Anodyne	MTNR1B	35	40
COC(=O)C1(CN[C@@H](C)c2cccc(OC)c2)CC1	ZINC000450667125	CE	On-Demand	Anodyne	MTNR1A	34	43
COC(=O)C1(CN[C@@H](C)c2cccc(OC)c2)CC1	ZINC000450667125	CE	On-Demand	Anodyne	MTNR1B	35	40
CC[C@@](C)(CCO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450667130	DE	On-Demand	Anodyne	CTSV	46	32
NC(=O)c1cnc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)c(Cl)c1	ZINC000450667137	GH	On-Demand	Anodyne	MPL	37	45
NC(=O)c1cnc(N2CCC(c3nc(C(F)(F)F)cs3)CC2)c(Cl)c1	ZINC000450667137	GH	On-Demand	Anodyne	SIRT3	41	32
CC[C@](C)(CCO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450667138	DE	On-Demand	Anodyne	CTSV	46	32
C[C@]1(Cc2ccccc2)CCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450667143	FI	On-Demand	Anodyne	SLC12A5	70	38
C[C@@]1(Cc2ccccc2)CCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450667145	FI	On-Demand	Anodyne	SLC12A5	70	38
CC[C@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450667154	DI	On-Demand	Anodyne	PREP	23	46
CC[C@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450667154	DI	On-Demand	Anodyne	CFTR	47	31
CC[C@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450667154	DI	On-Demand	Anodyne	ADAM9	57	35
CC[C@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450667154	DI	On-Demand	Anodyne	NR1D1	41	42
Cc1cccc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450667156	CG	On-Demand	Anodyne	CASP3	51	41
Cc1cccc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450667156	CG	On-Demand	Anodyne	CHRNA10	84	58
Cc1cccc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450667156	CG	On-Demand	Anodyne	CASP7	44	41
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450667157	DI	On-Demand	Anodyne	PREP	23	46
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450667157	DI	On-Demand	Anodyne	CFTR	45	31
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450667157	DI	On-Demand	Anodyne	ADAM9	57	35
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450667157	DI	On-Demand	Anodyne	NR1D1	38	42
CCC(=O)C1(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)CC1	ZINC000450667159	EE	On-Demand	Anodyne	SDH1	0	40
Cc1cc(C(F)(F)F)nc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)n1	ZINC000450667163	GI	On-Demand	Anodyne	PHES	0	41
CCC(=O)C1(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)CC1	ZINC000450667164	EE	On-Demand	Anodyne	SDH1	0	40
Cc1cc(C(F)(F)F)nc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)n1	ZINC000450667165	GI	On-Demand	Anodyne	PHES	0	41
COc1cc2c(N[C@@H](CCO)c3cccc(C(F)(F)F)c3)ncnc2cc1F	ZINC000450667171	GI	On-Demand	Anodyne	EGFR	64	52
COc1cc2c(N[C@@H](CCO)c3cccc(C(F)(F)F)c3)ncnc2cc1F	ZINC000450667171	GI	On-Demand	Anodyne	SCD1	0	40
COc1cc2c(N[C@H](CCO)c3cccc(C(F)(F)F)c3)ncnc2cc1F	ZINC000450667173	GI	On-Demand	Anodyne	EGFR	64	52
COc1cc2c(N[C@H](CCO)c3cccc(C(F)(F)F)c3)ncnc2cc1F	ZINC000450667173	GI	On-Demand	Anodyne	SCD1	0	40
COc1ccc2c(c1)[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)CCO2	ZINC000450667178	EE	On-Demand	Anodyne	MTNR1A	18	42
CCC(=O)c1ccc(N[C@H](C)C2CC2)c([N+](=O)[O-])c1	ZINC000450667180	CG	On-Demand	Bother	EEF1A1	0	40
CCC(=O)c1ccc(N[C@H](C)C2CC2)c([N+](=O)[O-])c1	ZINC000450667180	CG	On-Demand	Bother	EEF1A2	0	40
COC(=O)c1ccc(CN[C@H](C)c2cc(F)ccc2OC)cc1Cl	ZINC000450667188	FI	On-Demand	Anodyne	PYGL	0	40
COC(=O)c1ccc(CN[C@@H](C)c2cc(F)ccc2OC)cc1Cl	ZINC000450667189	FI	On-Demand	Anodyne	PYGL	0	40
O=C(CC[C@H]1CCCCO1)COc1c(Cl)cccc1Cl	ZINC000450667217	DI	On-Demand	Anodyne	OXTR	22	40
O=C(CC[C@@H]1CCCCO1)COc1c(Cl)cccc1Cl	ZINC000450667218	DI	On-Demand	Anodyne	OXTR	22	40
NC(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450667223	EF	On-Demand	Anodyne	SCD1	26	40
NC(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450667225	EF	On-Demand	Anodyne	SCD1	26	40
C[C@@H](O)CCCN[C@@H](c1cccc(C(F)(F)F)c1)C(C)(C)C	ZINC000450667236	DJ	On-Demand	Anodyne	PHES	0	41
C[C@@H](O)CCCN[C@H](c1cccc(C(F)(F)F)c1)C(C)(C)C	ZINC000450667237	DJ	On-Demand	Anodyne	PHES	0	41
C[C@H](O)CCCN[C@H](c1cccc(C(F)(F)F)c1)C(C)(C)C	ZINC000450667238	DJ	On-Demand	Anodyne	PHES	0	41
C[C@H](O)CCCN[C@@H](c1cccc(C(F)(F)F)c1)C(C)(C)C	ZINC000450667239	DJ	On-Demand	Anodyne	PHES	0	41
CC1CCN(C(=O)c2ccc(N3CCC[C@H]3COc3ccccc3)nc2)CC1	ZINC000450667245	GI	On-Demand	Anodyne	CASP3	46	36
CC1CCN(C(=O)c2ccc(N3CCC[C@H]3COc3ccccc3)nc2)CC1	ZINC000450667245	GI	On-Demand	Anodyne	HRH3	17	48
CC1CCN(C(=O)c2ccc(N3CCC[C@H]3COc3ccccc3)nc2)CC1	ZINC000450667245	GI	On-Demand	Anodyne	CHRNA10	74	45
CC1CCN(C(=O)c2ccc(N3CCC[C@H]3COc3ccccc3)nc2)CC1	ZINC000450667245	GI	On-Demand	Anodyne	L3MBTL3	51	38
COc1ccc(CNC(=O)CCNC2(c3ccccc3)CC2)c(OC)c1	ZINC000450667254	FF	On-Demand	Anodyne	TACR3	0	40
COc1ccc(CNC(=O)CCNC2(c3ccccc3)CC2)c(OC)c1	ZINC000450667254	FF	On-Demand	Anodyne	MTNR1A	67	38
COc1ccc(CNC(=O)CCNC2(c3ccccc3)CC2)c(OC)c1	ZINC000450667254	FF	On-Demand	Anodyne	MTNR1B	68	38
CC[C@@](C)(CCO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450667260	EG	On-Demand	Anodyne	RBP4	63	38
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450667271	CH	On-Demand	Anodyne	SLC12A5	80	42
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450667272	CH	On-Demand	Anodyne	SLC12A5	80	42
C[C@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667282	CF	On-Demand	Anodyne	FOLH1	24	42
C[C@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667282	CF	On-Demand	Anodyne	ANPEP	35	46
C[C@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667282	CF	On-Demand	Anodyne	KCNA3	36	43
C[C@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667282	CF	On-Demand	Anodyne	AMP1_PLAFQ	53	41
C[C@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667282	CF	On-Demand	Anodyne	HCN1	68	40
C[C@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667282	CF	On-Demand	Anodyne	HCN4	54	37
C[C@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667282	CF	On-Demand	Anodyne	KCNK3	49	36
C[C@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667282	CF	On-Demand	Anodyne	PDS	46	40
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	ADORA1	185	74
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	SLC29A1	138	60
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	P2RY12	53	41
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	ADORA2A	70	70
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	ADORA2B	31	59
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	GAPC	0	43
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	ADK	72	54
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	AK3	0	40
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	AHCY	52	40
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	CDA	41	32
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	P2RX4	34	40
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	P2RX1	45	39
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	P2RY1	34	40
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	P2RY11	0	40
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	AMD1	37	46
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	ITPR1	52	38
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	AK2	0	40
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	NS5B	0	45
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	ADORA3	151	67
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	OXGR1	125	44
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	MTAP	0	45
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	IMPDH2	51	34
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	AK	0	48
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	RNASE1	44	35
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	MBTA	0	47
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	DNMT3B	72	43
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	NADK	0	41
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	Q4VQ11_PIG	92	67
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	GPR17	58	47
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	SAE1	0	43
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	DOT1L	89	44
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	METJ	0	40
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	NAE1	0	43
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	UBA6	0	43
CC[C@@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667290	GC	On-Demand	Anodyne	UBA7	0	43
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	ADORA1	185	74
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	SLC29A1	138	60
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	P2RY12	53	41
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	ADORA2A	70	70
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	ADORA2B	31	59
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	GAPC	0	43
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	ADK	72	54
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	AK3	0	40
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	AHCY	52	40
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	CDA	41	32
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	P2RX4	34	40
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	P2RX1	45	39
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	P2RY1	34	40
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	P2RY11	0	40
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	AMD1	37	46
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	ITPR1	52	38
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	AK2	0	40
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	NS5B	0	45
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	ADORA3	151	67
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	OXGR1	125	44
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	MTAP	0	45
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	IMPDH2	51	34
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	AK	0	48
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	RNASE1	44	35
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	MBTA	0	47
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	DNMT3B	72	43
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	NADK	0	41
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	Q4VQ11_PIG	92	67
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	GPR17	58	47
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	SAE1	0	43
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	DOT1L	89	44
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	METJ	0	40
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	NAE1	0	43
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	UBA6	0	43
CC[C@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667291	GC	On-Demand	Anodyne	UBA7	0	43
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	ADORA1	185	74
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	SLC29A1	138	60
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	P2RY12	53	41
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	ADORA2A	70	70
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	ADORA2B	31	59
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	GAPC	0	43
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	ADK	72	54
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	AK3	0	40
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	AHCY	52	40
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	CDA	41	32
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	P2RX4	34	40
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	P2RX1	45	39
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	P2RY1	34	40
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	P2RY11	0	40
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	AMD1	37	46
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	ITPR1	52	38
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	AK2	0	40
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	NS5B	0	45
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	ADORA3	151	67
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	OXGR1	125	44
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	MTAP	0	45
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	IMPDH2	51	34
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	AK	0	48
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	RNASE1	44	35
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	MBTA	0	47
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	DNMT3B	72	43
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	NADK	0	41
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	Q4VQ11_PIG	92	67
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	GPR17	58	47
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	SAE1	0	43
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	DOT1L	89	44
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	METJ	0	40
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	NAE1	0	43
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	UBA6	0	43
CC[C@@H]1CCC[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667292	GC	On-Demand	Anodyne	UBA7	0	43
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	ADORA1	185	74
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	SLC29A1	138	60
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	P2RY12	53	41
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	ADORA2A	70	70
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	ADORA2B	31	59
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	GAPC	0	43
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	ADK	72	54
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	AK3	0	40
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	AHCY	52	40
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	CDA	41	32
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	P2RX4	34	40
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	P2RX1	45	39
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	P2RY1	34	40
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	P2RY11	0	40
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	AMD1	37	46
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	ITPR1	52	38
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	AK2	0	40
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	NS5B	0	45
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	ADORA3	151	67
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	OXGR1	125	44
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	MTAP	0	45
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	IMPDH2	51	34
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	AK	0	48
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	RNASE1	44	35
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	MBTA	0	47
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	DNMT3B	72	43
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	NADK	0	41
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	Q4VQ11_PIG	92	67
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	GPR17	58	47
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	SAE1	0	43
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	DOT1L	89	44
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	METJ	0	40
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	NAE1	0	43
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	UBA6	0	43
CC[C@H]1CCC[C@@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450667293	GC	On-Demand	Anodyne	UBA7	0	43
Fc1ccc2oc(N3CCC(c4nc(C(F)(F)F)cs4)CC3)nc2c1	ZINC000450667370	FJ	On-Demand	Anodyne	PTGES	33	41
Cc1nn(C)cc1CC(=O)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450667379	FH	On-Demand	Anodyne	FFAR2	48	32
Cc1nn(C)cc1CC(=O)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450667380	FH	On-Demand	Anodyne	FFAR2	48	32
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450667381	CF	On-Demand	Anodyne	TRAR	57	34
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3cccnc3)n2Cc2ccco2)C1	ZINC000450667384	FH	On-Demand	Anodyne	HCRTR2	0	40
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3cccnc3)n2Cc2ccco2)C1	ZINC000450667385	FH	On-Demand	Anodyne	HCRTR2	0	40
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3cccnc3)n2Cc2ccco2)C1	ZINC000450667386	FH	On-Demand	Anodyne	HCRTR2	0	40
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3cccnc3)n2Cc2ccco2)C1	ZINC000450667387	FH	On-Demand	Anodyne	HCRTR2	0	40
CCC[C@@H](O)CN[C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000450667388	CG	On-Demand	Anodyne	SLC22A3	0	43
CCC[C@H](O)CN[C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000450667389	CG	On-Demand	Anodyne	SLC22A3	0	43
CCC[C@@H](O)CN[C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000450667390	CG	On-Demand	Anodyne	SLC22A3	0	43
CCC[C@H](O)CN[C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000450667391	CG	On-Demand	Anodyne	SLC22A3	0	43
Cc1cccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)n1	ZINC000450667392	DH	On-Demand	Anodyne	SORT1	18	43
Cc1cccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)n1	ZINC000450667393	DH	On-Demand	Anodyne	SORT1	18	43
CC(=O)CCCCCSc1nnc(C2CC2)n1Cc1ccco1	ZINC000450667394	EI	On-Demand	Anodyne	HCRTR2	20	40
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@@H]3C[C@H]13)CCO2	ZINC000450667395	DG	On-Demand	Anodyne	LUXR	57	34
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@@H]3C[C@H]13)CCO2	ZINC000450667395	DG	On-Demand	Anodyne	TRAR	75	35
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@@H]3C[C@H]13)CCO2	ZINC000450667395	DG	On-Demand	Anodyne	LASR	45	32
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@H]3C[C@H]13)CCO2	ZINC000450667396	DG	On-Demand	Anodyne	LUXR	57	34
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@H]3C[C@H]13)CCO2	ZINC000450667396	DG	On-Demand	Anodyne	TRAR	75	35
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@H]3C[C@H]13)CCO2	ZINC000450667396	DG	On-Demand	Anodyne	LASR	45	32
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@@H]3C[C@@H]13)CCO2	ZINC000450667397	DG	On-Demand	Anodyne	LUXR	57	34
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@@H]3C[C@@H]13)CCO2	ZINC000450667397	DG	On-Demand	Anodyne	TRAR	75	35
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@@H]3C[C@@H]13)CCO2	ZINC000450667397	DG	On-Demand	Anodyne	LASR	45	32
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@H]3C[C@@H]13)CCO2	ZINC000450667398	DG	On-Demand	Anodyne	LUXR	57	34
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@H]3C[C@@H]13)CCO2	ZINC000450667398	DG	On-Demand	Anodyne	TRAR	75	35
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H]1CC[C@H]3C[C@@H]13)CCO2	ZINC000450667398	DG	On-Demand	Anodyne	LASR	45	32
CC1(C)CN(C(=O)c2cn(CCc3ccccc3)nn2)CC(C)(C)C1	ZINC000450667400	EG	On-Demand	Anodyne	THYX_PBCV1	0	44
C[C@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000450667414	FH	On-Demand	Anodyne	LTA4H	22	40
C[C@@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000450667415	FH	On-Demand	Anodyne	LTA4H	22	40
COc1ccc2c(c1)[C@@H](NC(=O)[C@@H]1CC[C@H](C)O1)CCO2	ZINC000450667416	CE	On-Demand	Anodyne	TRAR	42	33
Cc1ccc(Br)cc1CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450667417	GJ	On-Demand	Anodyne	SDH1	0	44
Cc1ccc(Br)cc1CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450667418	GJ	On-Demand	Anodyne	SDH1	0	44
COc1cc([C@H](C)NCc2ccn(CC(F)(F)F)n2)ccc1OC1CCCC1	ZINC000450667422	GJ	On-Demand	Anodyne	PDE4A	45	38
COc1cc([C@H](C)NCc2ccn(CC(F)(F)F)n2)ccc1OC1CCCC1	ZINC000450667422	GJ	On-Demand	Anodyne	PDE4B	29	43
COc1cc([C@@H](C)NCc2ccn(CC(F)(F)F)n2)ccc1OC1CCCC1	ZINC000450667423	GJ	On-Demand	Anodyne	PDE4A	45	38
COc1cc([C@@H](C)NCc2ccn(CC(F)(F)F)n2)ccc1OC1CCCC1	ZINC000450667423	GJ	On-Demand	Anodyne	PDE4B	29	43
CC[C@@H](C)Oc1cc(CNC(=O)C2(Cc3ccccc3)CCOCC2)ccn1	ZINC000450667424	GH	On-Demand	Anodyne	PDS	46	35
CC[C@H](C)Oc1cc(CNC(=O)C2(Cc3ccccc3)CCOCC2)ccn1	ZINC000450667425	GH	On-Demand	Anodyne	PDS	46	35
O=C(CC1CC(F)(F)C1)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450667428	FK	On-Demand	Anodyne	FFAR2	49	34
O=C(CC1CC(F)(F)C1)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450667429	FK	On-Demand	Anodyne	FFAR2	49	34
COc1ccc2c(c1)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)CCO2	ZINC000450667453	FF	On-Demand	Anodyne	TRAR	42	32
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450667454	DH	On-Demand	Anodyne	MTNR1A	31	40
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450667454	DH	On-Demand	Anodyne	MTNR1B	24	40
CC[C@H](CC(C)C)C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450667455	DH	On-Demand	Anodyne	MTNR1A	31	40
CC[C@H](CC(C)C)C(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450667455	DH	On-Demand	Anodyne	MTNR1B	24	40
COc1ccc2c(c1)[C@@H](NC(=O)CCCc1ncc(C)o1)CCO2	ZINC000450667460	EF	On-Demand	Anodyne	CVIR	0	41
C[C@@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667476	CF	On-Demand	Anodyne	FOLH1	24	42
C[C@@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667476	CF	On-Demand	Anodyne	ANPEP	35	46
C[C@@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667476	CF	On-Demand	Anodyne	KCNA3	36	43
C[C@@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667476	CF	On-Demand	Anodyne	AMP1_PLAFQ	53	41
C[C@@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667476	CF	On-Demand	Anodyne	HCN1	68	40
C[C@@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667476	CF	On-Demand	Anodyne	HCN4	54	37
C[C@@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667476	CF	On-Demand	Anodyne	KCNK3	49	36
C[C@@H](O)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450667476	CF	On-Demand	Anodyne	PDS	46	40
Cc1cnc(CCCC(=O)N2CCC[C@@]2(C)Cc2ccccc2)o1	ZINC000450667477	EH	On-Demand	Anodyne	FAAH	23	40
Cc1cnc(CCCC(=O)N2CCC[C@@]2(C)Cc2ccccc2)o1	ZINC000450667477	EH	On-Demand	Anodyne	SLC12A5	69	41
C[C@@H](NCC/C=C\c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667478	FI	On-Demand	Anodyne	TNKS	57	33
C[C@@H](NCC/C=C\c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667478	FI	On-Demand	Anodyne	LUXN	0	48
C[C@@H](NCC/C=C\c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667478	FI	On-Demand	Anodyne	ADIPOR1	0	43
C[C@@H](NCC/C=C\c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667478	FI	On-Demand	Anodyne	ADIPOR2	0	43
Cc1cnc(CCCC(=O)N2CCC[C@]2(C)Cc2ccccc2)o1	ZINC000450667479	EH	On-Demand	Anodyne	FAAH	23	40
Cc1cnc(CCCC(=O)N2CCC[C@]2(C)Cc2ccccc2)o1	ZINC000450667479	EH	On-Demand	Anodyne	SLC12A5	69	41
Ic1cccc(OC[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450667480	EG	On-Demand	Anodyne	CHRNA10	56	34
C[C@@H](NCC/C=C/c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667481	FI	On-Demand	Anodyne	TNKS	57	33
C[C@@H](NCC/C=C/c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667481	FI	On-Demand	Anodyne	LUXN	0	48
C[C@@H](NCC/C=C/c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667481	FI	On-Demand	Anodyne	ADIPOR1	0	43
C[C@@H](NCC/C=C/c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667481	FI	On-Demand	Anodyne	ADIPOR2	0	43
C[C@H](NCC/C=C/c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667482	FI	On-Demand	Anodyne	TNKS	57	33
C[C@H](NCC/C=C/c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667482	FI	On-Demand	Anodyne	LUXN	0	48
C[C@H](NCC/C=C/c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667482	FI	On-Demand	Anodyne	ADIPOR1	0	43
C[C@H](NCC/C=C/c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667482	FI	On-Demand	Anodyne	ADIPOR2	0	43
C[C@H](NCC/C=C\c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667483	FI	On-Demand	Anodyne	TNKS	57	33
C[C@H](NCC/C=C\c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667483	FI	On-Demand	Anodyne	LUXN	0	48
C[C@H](NCC/C=C\c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667483	FI	On-Demand	Anodyne	ADIPOR1	0	43
C[C@H](NCC/C=C\c1ccccc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667483	FI	On-Demand	Anodyne	ADIPOR2	0	43
Ic1cccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450667487	EG	On-Demand	Anodyne	CHRNA10	56	34
Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450667488	CG	On-Demand	Anodyne	CASP3	50	40
Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450667488	CG	On-Demand	Anodyne	CHRNA10	82	56
Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450667488	CG	On-Demand	Anodyne	CASP7	39	40
CCOc1cc(NC2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)ncn1	ZINC000450667515	GF	On-Demand	Anodyne	P2RY12	70	35
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@H]1C1CCOCC1	ZINC000450667516	GI	On-Demand	Anodyne	COLA	55	39
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@H]1C1CCOCC1	ZINC000450667516	GI	On-Demand	Anodyne	CPT1A	50	39
CCOc1cc(NC2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)ncn1	ZINC000450667517	GF	On-Demand	Anodyne	P2RY12	70	35
N#Cc1ccc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000450667518	CG	On-Demand	Mild	CASP3	49	37
N#Cc1ccc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000450667518	CG	On-Demand	Mild	CHRNA10	70	51
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@@H]1C1CCOCC1	ZINC000450667519	GI	On-Demand	Anodyne	COLA	55	39
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC[C@@H]1C1CCOCC1	ZINC000450667519	GI	On-Demand	Anodyne	CPT1A	50	39
C/C=C\COc1cccc(CC(=O)N2CC(C(=O)NC)C2)c1	ZINC000450667520	DD	On-Demand	Anodyne	UPP1	41	32
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCn1nc(C)nc1C	ZINC000450667523	EG	On-Demand	Anodyne	ADAM9	46	32
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCn1nc(C)nc1C	ZINC000450667523	EG	On-Demand	Anodyne	NR1D1	37	40
O=C(NCc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450667525	FG	On-Demand	Anodyne	SCD1	21	40
O=C(NCc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450667525	FG	On-Demand	Anodyne	SCD	26	40
O=C(NCc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450667525	FG	On-Demand	Anodyne	HCN1	53	39
O=C(NCc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450667525	FG	On-Demand	Anodyne	HCN4	45	35
CC[C@H]1Cc2ccccc2CN1C(=O)CCCn1nc(C)nc1C	ZINC000450667527	EG	On-Demand	Anodyne	ADAM9	46	32
CC[C@H]1Cc2ccccc2CN1C(=O)CCCn1nc(C)nc1C	ZINC000450667527	EG	On-Demand	Anodyne	NR1D1	37	40
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC)cc2OC)cc1	ZINC000450667531	FF	On-Demand	Anodyne	ADAMTS4	43	40
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC)cc2OC)cc1	ZINC000450667531	FF	On-Demand	Anodyne	KLK_PIG	42	35
CC[C@@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450667536	FG	On-Demand	Anodyne	PDGFRB	0	44
CC[C@@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450667536	FG	On-Demand	Anodyne	CPT1A	47	34
CC[C@@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450667536	FG	On-Demand	Anodyne	HPGD	46	55
CC[C@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450667539	FG	On-Demand	Anodyne	PDGFRB	0	44
CC[C@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450667539	FG	On-Demand	Anodyne	CPT1A	47	34
CC[C@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450667539	FG	On-Demand	Anodyne	HPGD	46	55
C[C@@]1(Cc2ccccc2)CCCN1C(=O)CSC1CC1	ZINC000450667563	CH	On-Demand	Anodyne	SLC12A5	82	43
COc1cc([C@H](C)NC[C@@H]2CCCCC2(F)F)ccc1OC(F)F	ZINC000450667564	EJ	On-Demand	Anodyne	PDE4A	62	37
COc1cc([C@@H](C)NC[C@H]2CCCCC2(F)F)ccc1OC(F)F	ZINC000450667565	EJ	On-Demand	Anodyne	PDE4A	62	37
COc1cc([C@H](C)NC[C@H]2CCCCC2(F)F)ccc1OC(F)F	ZINC000450667566	EJ	On-Demand	Anodyne	PDE4A	62	37
COc1cc([C@@H](C)NC[C@@H]2CCCCC2(F)F)ccc1OC(F)F	ZINC000450667567	EJ	On-Demand	Anodyne	PDE4A	62	37
C[C@]1(Cc2ccccc2)CCCN1C(=O)CSC1CC1	ZINC000450667569	CH	On-Demand	Anodyne	SLC12A5	82	43
CC[C@@H]1C[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450667579	EE	On-Demand	Anodyne	MMP2	17	42
CC[C@@H]1C[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450667579	EE	On-Demand	Anodyne	MMP3	35	42
CC[C@@H]1C[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450667579	EE	On-Demand	Anodyne	MMP8	19	42
CC[C@@H]1C[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450667579	EE	On-Demand	Anodyne	MMP7	42	37
CC[C@@H]1C[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450667579	EE	On-Demand	Anodyne	MMP1	35	43
COC(=O)c1ccc(OCCC(C)(F)F)c(OC)c1	ZINC000450667583	CF	On-Demand	Anodyne	THRA	0	41
CCN(C)C(=O)[C@@H](Nc1ccnc2c([N+](=O)[O-])cccc12)C(C)C	ZINC000450667585	EG	On-Demand	Bother	COLA	56	36
COc1cc2c(cc1F)CN(C(=O)Cc1sccc1Br)CC2	ZINC000450667589	GH	On-Demand	Anodyne	ABCB1	15	50
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc2n(n1)CCCC2	ZINC000450667592	DG	On-Demand	Anodyne	PREP	22	40
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc2n(n1)CCCC2	ZINC000450667592	DG	On-Demand	Anodyne	CFTR	54	37
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc2n(n1)CCCC2	ZINC000450667592	DG	On-Demand	Anodyne	BCL2	26	40
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc2n(n1)CCCC2	ZINC000450667594	DG	On-Demand	Anodyne	PREP	22	40
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc2n(n1)CCCC2	ZINC000450667594	DG	On-Demand	Anodyne	CFTR	54	37
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc2n(n1)CCCC2	ZINC000450667594	DG	On-Demand	Anodyne	BCL2	26	40
c1cncc(-c2nnc(SCc3nnc(C4CC4)s3)n2Cc2ccco2)c1	ZINC000450667595	GI	On-Demand	Anodyne	HCRTR2	0	40
N#CC1(COc2ccccc2C(=O)NCc2ccccc2)CCC1	ZINC000450667598	DH	On-Demand	Mild	KCNA3	44	42
N#CC1(COc2ccccc2C(=O)NCc2ccccc2)CCC1	ZINC000450667598	DH	On-Demand	Mild	HCN1	81	39
N#CC1(COc2ccccc2C(=O)NCc2ccccc2)CCC1	ZINC000450667598	DH	On-Demand	Mild	HCN4	57	37
O=[N+]([O-])c1ccc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000450667602	CG	On-Demand	Bother	CHRNA10	65	48
O=[N+]([O-])c1ccc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000450667602	CG	On-Demand	Bother	CASP7	49	40
CC[C@H]1Cc2ccccc2CN1C(=O)CCCc1ncc(C)o1	ZINC000450667616	DH	On-Demand	Anodyne	PREP	34	44
CC[C@H]1Cc2ccccc2CN1C(=O)CCCc1ncc(C)o1	ZINC000450667616	DH	On-Demand	Anodyne	CFTR	46	33
CC[C@H]1Cc2ccccc2CN1C(=O)CCCc1ncc(C)o1	ZINC000450667616	DH	On-Demand	Anodyne	ADAM9	57	33
CC[C@H]1Cc2ccccc2CN1C(=O)CCCc1ncc(C)o1	ZINC000450667616	DH	On-Demand	Anodyne	NR1D1	40	41
CC[C@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667622	CD	On-Demand	Anodyne	MME	54	37
CC[C@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667622	CD	On-Demand	Anodyne	PAPA1_CARPA	46	35
CC[C@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667622	CD	On-Demand	Anodyne	CAPNS1	46	32
CC[C@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667622	CD	On-Demand	Anodyne	CAPN2	44	32
CC[C@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667622	CD	On-Demand	Anodyne	ACE2	47	36
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCc1ncc(C)o1	ZINC000450667623	DH	On-Demand	Anodyne	PREP	34	44
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCc1ncc(C)o1	ZINC000450667623	DH	On-Demand	Anodyne	CFTR	46	33
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCc1ncc(C)o1	ZINC000450667623	DH	On-Demand	Anodyne	ADAM9	57	33
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCc1ncc(C)o1	ZINC000450667623	DH	On-Demand	Anodyne	NR1D1	40	41
CC[C@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667624	CD	On-Demand	Anodyne	MME	54	37
CC[C@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667624	CD	On-Demand	Anodyne	PAPA1_CARPA	46	35
CC[C@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667624	CD	On-Demand	Anodyne	CAPNS1	46	32
CC[C@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667624	CD	On-Demand	Anodyne	CAPN2	44	32
CC[C@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667624	CD	On-Demand	Anodyne	ACE2	47	36
CC[C@@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667625	CD	On-Demand	Anodyne	MME	54	37
CC[C@@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667625	CD	On-Demand	Anodyne	PAPA1_CARPA	46	35
CC[C@@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667625	CD	On-Demand	Anodyne	CAPNS1	46	32
CC[C@@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667625	CD	On-Demand	Anodyne	CAPN2	44	32
CC[C@@](C)(CCO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450667625	CD	On-Demand	Anodyne	ACE2	47	36
CC[C@@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667626	CD	On-Demand	Anodyne	MME	54	37
CC[C@@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667626	CD	On-Demand	Anodyne	PAPA1_CARPA	46	35
CC[C@@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667626	CD	On-Demand	Anodyne	CAPNS1	46	32
CC[C@@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667626	CD	On-Demand	Anodyne	CAPN2	44	32
CC[C@@](C)(CCO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450667626	CD	On-Demand	Anodyne	ACE2	47	36
Cc1nn(C)cc1CC(=O)NCc1c(C)oc2ccccc12	ZINC000450667638	CF	On-Demand	Anodyne	P2RX7	46	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(C)cc2)c(OC)c1	ZINC000450667646	FG	On-Demand	Anodyne	PTGS2	22	43
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(C)cc2)c(OC)c1	ZINC000450667646	FG	On-Demand	Anodyne	MTNR1A	56	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(C)cc2)c(OC)c1	ZINC000450667648	FG	On-Demand	Anodyne	PTGS2	22	43
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(C)cc2)c(OC)c1	ZINC000450667648	FG	On-Demand	Anodyne	MTNR1A	56	40
CCCc1cc(C(=O)N2Cc3ccccc3C[C@@H]2CC)no1	ZINC000450667656	CH	On-Demand	Anodyne	CFTR	55	38
CCCc1cc(C(=O)N2Cc3ccccc3C[C@@H]2CC)no1	ZINC000450667656	CH	On-Demand	Anodyne	ADAM9	49	31
CCCc1cc(C(=O)N2Cc3ccccc3C[C@@H]2CC)no1	ZINC000450667656	CH	On-Demand	Anodyne	BCL2	27	43
CCCc1cc(C(=O)N2Cc3ccccc3C[C@@H]2CC)no1	ZINC000450667656	CH	On-Demand	Anodyne	NR1D1	39	40
CCCc1cc(C(=O)N2Cc3ccccc3C[C@H]2CC)no1	ZINC000450667657	CH	On-Demand	Anodyne	CFTR	55	38
CCCc1cc(C(=O)N2Cc3ccccc3C[C@H]2CC)no1	ZINC000450667657	CH	On-Demand	Anodyne	ADAM9	49	31
CCCc1cc(C(=O)N2Cc3ccccc3C[C@H]2CC)no1	ZINC000450667657	CH	On-Demand	Anodyne	BCL2	27	43
CCCc1cc(C(=O)N2Cc3ccccc3C[C@H]2CC)no1	ZINC000450667657	CH	On-Demand	Anodyne	NR1D1	39	40
C[C@H](NCCC[C@@H](C)O)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667665	EH	On-Demand	Anodyne	PPIA	15	41
C[C@H](NCCC[C@@H](C)O)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667665	EH	On-Demand	Anodyne	CASR	23	40
C[C@H](NCCC[C@@H](C)O)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667665	EH	On-Demand	Anodyne	PRNP	52	42
C[C@H](NCCC[C@@H](C)O)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667665	EH	On-Demand	Anodyne	CSF1R	18	53
C[C@H](NCCC[C@@H](C)O)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667665	EH	On-Demand	Anodyne	DDR1	15	44
C[C@H](NCCC[C@@H](C)O)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667665	EH	On-Demand	Anodyne	KCNK3	131	48
C[C@H](NCCC[C@@H](C)O)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667665	EH	On-Demand	Anodyne	KCNK9	85	46
C[C@H](O)CCCN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667666	EH	On-Demand	Anodyne	PPIA	15	41
C[C@H](O)CCCN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667666	EH	On-Demand	Anodyne	CASR	23	40
C[C@H](O)CCCN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667666	EH	On-Demand	Anodyne	PRNP	52	42
C[C@H](O)CCCN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667666	EH	On-Demand	Anodyne	CSF1R	18	53
C[C@H](O)CCCN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667666	EH	On-Demand	Anodyne	DDR1	15	44
C[C@H](O)CCCN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667666	EH	On-Demand	Anodyne	KCNK3	131	48
C[C@H](O)CCCN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667666	EH	On-Demand	Anodyne	KCNK9	85	46
C[C@@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667667	EH	On-Demand	Anodyne	PPIA	15	41
C[C@@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667667	EH	On-Demand	Anodyne	CASR	23	40
C[C@@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667667	EH	On-Demand	Anodyne	PRNP	52	42
C[C@@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667667	EH	On-Demand	Anodyne	CSF1R	18	53
C[C@@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667667	EH	On-Demand	Anodyne	DDR1	15	44
C[C@@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667667	EH	On-Demand	Anodyne	KCNK3	131	48
C[C@@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667667	EH	On-Demand	Anodyne	KCNK9	85	46
C[C@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667668	EH	On-Demand	Anodyne	PPIA	15	41
C[C@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667668	EH	On-Demand	Anodyne	CASR	23	40
C[C@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667668	EH	On-Demand	Anodyne	PRNP	52	42
C[C@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667668	EH	On-Demand	Anodyne	CSF1R	18	53
C[C@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667668	EH	On-Demand	Anodyne	DDR1	15	44
C[C@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667668	EH	On-Demand	Anodyne	KCNK3	131	48
C[C@H](O)CCCN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450667668	EH	On-Demand	Anodyne	KCNK9	85	46
COc1cccc(-n2cc(C(=O)N3CC(C)(C)CC(C)(C)C3)nn2)c1	ZINC000450667681	EG	On-Demand	Anodyne	CCKAR	0	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(C#N)cc2)c(OC)c1	ZINC000450667687	FF	On-Demand	Mild	MTNR1A	50	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(C#N)cc2)c(OC)c1	ZINC000450667688	FF	On-Demand	Mild	MTNR1A	50	38
Cc1cnc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)s1	ZINC000450667691	DI	On-Demand	Anodyne	SCD1	23	42
Cc1cnc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)s1	ZINC000450667692	DI	On-Demand	Anodyne	SCD1	23	42
CCC(CC)(CCSc1nnc(-c2ccoc2C)o1)C(=O)OC	ZINC000450667694	EI	On-Demand	Anodyne	ALOX15	54	33
CNC(=O)C1CN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450667704	CD	On-Demand	Anodyne	OPRK1	41	43
CS(=O)(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450667705	FG	On-Demand	Anodyne	CACNA1B	41	34
CS(=O)(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)nc1	ZINC000450667706	FG	On-Demand	Anodyne	CACNA1B	41	34
COc1ccc(OC(F)(F)F)c(C(=O)NCC(F)(F)CO)c1	ZINC000450667707	ED	On-Demand	Anodyne	GRIN2B	0	43
COc1ccc(OC(F)(F)F)c(C(=O)NCC(F)(F)CO)c1	ZINC000450667707	ED	On-Demand	Anodyne	AKR1C2	40	34
CC(C)CCOc1ccc([C@H](C)N[C@@H](C)c2csnn2)cc1	ZINC000450667708	DI	On-Demand	Anodyne	O69638_MYCTO	0	40
CC(C)CCOc1ccc([C@@H](C)N[C@@H](C)c2csnn2)cc1	ZINC000450667709	DI	On-Demand	Anodyne	O69638_MYCTO	0	40
CC(C)CCOc1ccc([C@H](C)N[C@H](C)c2csnn2)cc1	ZINC000450667710	DI	On-Demand	Anodyne	O69638_MYCTO	0	40
CC(C)CCOc1ccc([C@@H](C)N[C@H](C)c2csnn2)cc1	ZINC000450667711	DI	On-Demand	Anodyne	O69638_MYCTO	0	40
Cc1cc(C)nc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)n1	ZINC000450667715	EH	On-Demand	Anodyne	PHES	0	41
Cc1cc(C)nc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)n1	ZINC000450667716	EH	On-Demand	Anodyne	PHES	0	41
N#Cc1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450667717	DH	On-Demand	Mild	CASP3	40	40
N#Cc1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450667717	DH	On-Demand	Mild	CHRNA10	80	45
N#Cc1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450667717	DH	On-Demand	Mild	CASP7	44	41
Cn1ncc(Br)c1C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450667731	FG	On-Demand	Anodyne	SLC12A5	79	41
Cn1ncc(Br)c1C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450667732	FG	On-Demand	Anodyne	SLC12A5	79	41
COC(=O)c1ccc(OCc2cn(C)nc2C)c(OC)c1	ZINC000450667736	CE	On-Demand	Anodyne	MT-CYB	45	34
C[C@]1(C(=O)N2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)CC=CCC1	ZINC000450667740	GI	On-Demand	Anodyne	EPHX2	40	42
C[C@@]1(C(=O)N2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)CC=CCC1	ZINC000450667741	GI	On-Demand	Anodyne	EPHX2	40	42
C[C@@H](c1ccccc1)[C@@H](O)CN[C@H](C)c1ccccc1	ZINC000450667743	CH	On-Demand	Anodyne	AOC3	21	40
C[C@@H](c1ccccc1)[C@H](O)CN[C@H](C)c1ccccc1	ZINC000450667744	CH	On-Demand	Anodyne	AOC3	21	40
C[C@@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccccc1	ZINC000450667746	CH	On-Demand	Anodyne	AOC3	21	40
C[C@@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccccc1	ZINC000450667748	CH	On-Demand	Anodyne	AOC3	21	40
CC(=O)c1c(F)cccc1N1CCC[C@H]1COc1ccccc1	ZINC000450667749	DI	On-Demand	Anodyne	CASP3	45	39
CC(=O)c1c(F)cccc1N1CCC[C@H]1COc1ccccc1	ZINC000450667749	DI	On-Demand	Anodyne	COLA	48	35
CC(=O)c1c(F)cccc1N1CCC[C@H]1COc1ccccc1	ZINC000450667749	DI	On-Demand	Anodyne	CPT1A	46	35
CC(=O)c1c(F)cccc1N1CCC[C@H]1COc1ccccc1	ZINC000450667749	DI	On-Demand	Anodyne	CHRNA10	97	50
CC(=O)c1c(F)cccc1N1CCC[C@H]1COc1ccccc1	ZINC000450667749	DI	On-Demand	Anodyne	CASP7	41	39
CC(=O)c1c(F)cccc1N1CCC[C@H]1COc1ccccc1	ZINC000450667749	DI	On-Demand	Anodyne	ACKR3	64	34
COc1cc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)ccc1OC(C)C	ZINC000450667756	FI	On-Demand	Anodyne	SLC22A3	0	42
COc1cc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)ccc1OC(C)C	ZINC000450667759	FI	On-Demand	Anodyne	SLC22A3	0	42
COc1cc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)ccc1OC(C)C	ZINC000450667760	FI	On-Demand	Anodyne	SLC22A3	0	42
COc1cc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)ccc1OC(C)C	ZINC000450667761	FI	On-Demand	Anodyne	SLC22A3	0	42
N#Cc1ccc(N2C[C@@H](C(=O)NCC(F)(F)CO)CC2=O)cc1Cl	ZINC000450667768	FD	On-Demand	Mild	AR	17	42
N#Cc1ccc(N2C[C@H](C(=O)NCC(F)(F)CO)CC2=O)cc1Cl	ZINC000450667771	FD	On-Demand	Mild	AR	17	42
CCCOc1ccc([C@H](C)NC[C@H](O)Cc2ccccc2)cc1OC	ZINC000450667778	EH	On-Demand	Anodyne	ADRB2	26	48
CCCOc1ccc([C@H](C)NC[C@H](O)Cc2ccccc2)cc1OC	ZINC000450667778	EH	On-Demand	Anodyne	ADRB1	16	48
CCCOc1ccc([C@H](C)NC[C@H](O)Cc2ccccc2)cc1OC	ZINC000450667778	EH	On-Demand	Anodyne	ADRB3	23	48
CCCOc1ccc([C@@H](C)NC[C@H](O)Cc2ccccc2)cc1OC	ZINC000450667779	EH	On-Demand	Anodyne	ADRB2	26	48
CCCOc1ccc([C@@H](C)NC[C@H](O)Cc2ccccc2)cc1OC	ZINC000450667779	EH	On-Demand	Anodyne	ADRB1	16	48
CCCOc1ccc([C@@H](C)NC[C@H](O)Cc2ccccc2)cc1OC	ZINC000450667779	EH	On-Demand	Anodyne	ADRB3	23	48
CC[C@H](CNS(C)(=O)=O)Nc1cc(C)nc2ncnn12	ZINC000450667785	CC	On-Demand	Anodyne	DHOD	0	47
CC[C@@H](CNS(C)(=O)=O)Nc1cc(C)nc2ncnn12	ZINC000450667788	CC	On-Demand	Anodyne	DHOD	0	47
CNS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450667834	GF	On-Demand	Bother	CASP3	103	49
CNS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450667834	GF	On-Demand	Bother	CASP1	0	43
CNS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450667834	GF	On-Demand	Bother	CHRNA10	72	44
CNS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450667834	GF	On-Demand	Bother	CASP9	15	45
CNS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450667834	GF	On-Demand	Bother	CASP7	109	49
CC[C@@H](CC(F)(F)F)C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450667841	GG	On-Demand	Anodyne	DPP7	20	42
CC[C@H](CC(F)(F)F)C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450667842	GG	On-Demand	Anodyne	DPP7	20	42
COc1ccc(CN2CCCN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CC2=O)cc1	ZINC000450667843	GD	On-Demand	Anodyne	DPP7	18	42
CCN(C)C(=O)[C@@H](Nc1cnc(-c2ccccc2)cn1)C(C)C	ZINC000450667844	DE	On-Demand	Anodyne	TPH1	25	41
CCN(C)C(=O)[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(C)C	ZINC000450667846	EF	On-Demand	Anodyne	FGFR1	0	42
CCN(C)C(=O)[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(C)C	ZINC000450667846	EF	On-Demand	Anodyne	FLT1	30	42
CCCc1cc(C(=O)NCc2c(C)oc3ccccc23)no1	ZINC000450667861	CH	On-Demand	Anodyne	THRA	0	40
CCCc1cc(C(=O)NCc2c(C)oc3ccccc23)no1	ZINC000450667861	CH	On-Demand	Anodyne	THRB	0	40
CC(=O)CCCCCSc1ccc(NC(C)=O)cc1	ZINC000450667864	CH	On-Demand	Anodyne	THRB	17	42
C[C@H](c1cnn(C)c1)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450667874	EE	On-Demand	Anodyne	HTR2A	16	42
C[C@@H](c1cnn(C)c1)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450667875	EE	On-Demand	Anodyne	HTR2A	16	42
COC(=O)c1coc(CN[C@H](C)c2ccc(OC(C)C)cc2)n1	ZINC000450667878	DG	On-Demand	Anodyne	ACACA	20	42
COC(=O)c1coc(CN[C@@H](C)c2ccc(OC(C)C)cc2)n1	ZINC000450667879	DG	On-Demand	Anodyne	ACACA	20	42
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667882	ED	On-Demand	Anodyne	LUXN	0	49
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667882	ED	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667882	ED	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667883	ED	On-Demand	Anodyne	LUXN	0	49
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667883	ED	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667883	ED	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667884	ED	On-Demand	Anodyne	LUXN	0	49
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667884	ED	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667884	ED	On-Demand	Anodyne	ADIPOR2	0	40
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667885	ED	On-Demand	Anodyne	LUXN	0	49
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667885	ED	On-Demand	Anodyne	ADIPOR1	0	40
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667885	ED	On-Demand	Anodyne	ADIPOR2	0	40
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cccc(C(F)(F)F)n2)cc1	ZINC000450667890	GG	On-Demand	Anodyne	ACACA	53	38
COC(=O)COc1ccc([C@H](C)NC(=O)c2cccc(C(F)(F)F)n2)cc1	ZINC000450667891	GG	On-Demand	Anodyne	ACACA	53	38
CCS(=O)(=O)c1ccc(CN[C@@H](CCO)c2ccc(OC)cc2)cc1	ZINC000450667897	FF	On-Demand	Anodyne	BMP1	66	38
CCS(=O)(=O)c1ccc(CN[C@@H](CCO)c2ccc(OC)cc2)cc1	ZINC000450667897	FF	On-Demand	Anodyne	MMP13	35	43
CCS(=O)(=O)c1ccc(CN[C@@H](CCO)c2ccc(OC)cc2)cc1	ZINC000450667897	FF	On-Demand	Anodyne	MMP1	41	37
CCS(=O)(=O)c1ccc(CN[C@H](CCO)c2ccc(OC)cc2)cc1	ZINC000450667898	FF	On-Demand	Anodyne	BMP1	66	38
CCS(=O)(=O)c1ccc(CN[C@H](CCO)c2ccc(OC)cc2)cc1	ZINC000450667898	FF	On-Demand	Anodyne	MMP13	35	43
CCS(=O)(=O)c1ccc(CN[C@H](CCO)c2ccc(OC)cc2)cc1	ZINC000450667898	FF	On-Demand	Anodyne	MMP1	41	37
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@]2(OC(C)C)CCOC2)cc1	ZINC000450667903	FD	On-Demand	Anodyne	ACACA	53	38
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(OC(C)C)CCOC2)cc1	ZINC000450667904	FD	On-Demand	Anodyne	ACACA	53	38
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@]2(OC(C)C)CCOC2)cc1	ZINC000450667905	FD	On-Demand	Anodyne	ACACA	53	38
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(OC(C)C)CCOC2)cc1	ZINC000450667906	FD	On-Demand	Anodyne	ACACA	53	38
C=CC(C)(C)C(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450667907	FH	On-Demand	Mild	APP	16	45
C=CC(C)(C)C(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450667907	FH	On-Demand	Mild	SCD1	0	40
C=CC(C)(C)C(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450667908	FH	On-Demand	Mild	APP	16	45
C=CC(C)(C)C(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000450667908	FH	On-Demand	Mild	SCD1	0	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450667909	GG	On-Demand	Anodyne	ACACB	29	45
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450667909	GG	On-Demand	Anodyne	GPR88	0	45
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450667910	GG	On-Demand	Anodyne	ACACB	29	45
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450667910	GG	On-Demand	Anodyne	GPR88	0	45
C=CCC1(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)CCCCC1	ZINC000450667911	FH	On-Demand	Mild	ACACB	29	43
C=CCC1(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)CCCCC1	ZINC000450667912	FH	On-Demand	Mild	ACACB	29	43
CC[C@@H](NCC1(C(=O)OC)CC1)c1cccc(Cl)c1	ZINC000450667917	CG	On-Demand	Anodyne	PDS	63	40
CC[C@H](NCC1(C(=O)OC)CC1)c1cccc(Cl)c1	ZINC000450667918	CG	On-Demand	Anodyne	PDS	63	40
COc1cccc(OCCC(=O)N(C)[C@H](C)c2cnn(C)c2)c1	ZINC000450667919	DE	On-Demand	Anodyne	MTNR1B	27	40
COc1cccc(OCCC(=O)N(C)[C@@H](C)c2cnn(C)c2)c1	ZINC000450667920	DE	On-Demand	Anodyne	MTNR1B	27	40
CC[C@H]1Cc2ccccc2CN1C(=O)c1cn2nccc2nc1C	ZINC000450667925	DG	On-Demand	Anodyne	BCL2	25	41
CC[C@H]1Cc2ccccc2CN1C(=O)c1cn2nccc2nc1C	ZINC000450667925	DG	On-Demand	Anodyne	NR1D1	40	42
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cn2nccc2nc1C	ZINC000450667926	DG	On-Demand	Anodyne	BCL2	25	41
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cn2nccc2nc1C	ZINC000450667926	DG	On-Demand	Anodyne	NR1D1	40	42
CC(C)(C)OC(=O)c1cnc(NC[C@H]2CCCO2)cn1	ZINC000450667932	CE	On-Demand	Anodyne	TNK2	41	37
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1	ZINC000450667942	EF	On-Demand	Anodyne	ACACA	51	43
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1	ZINC000450667942	EF	On-Demand	Anodyne	ACACB	28	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1	ZINC000450667943	EF	On-Demand	Anodyne	ACACA	51	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1	ZINC000450667943	EF	On-Demand	Anodyne	ACACB	28	43
CCn1nnc(C)c1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450667950	ED	On-Demand	Anodyne	ACACA	55	38
CCn1nnc(C)c1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450667951	ED	On-Demand	Anodyne	ACACA	55	38
COc1ccc([C@@H](C)NCc2ccc(Cl)c(OC)c2)cc1	ZINC000450667954	DI	On-Demand	Anodyne	CASR	15	56
COc1ccc([C@H](C)NCc2ccc(Cl)c(OC)c2)cc1	ZINC000450667955	DI	On-Demand	Anodyne	CASR	15	56
CC(C)N1CCCC[C@@H]1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667958	FG	On-Demand	Anodyne	LUXN	0	45
CC(C)N1CCCC[C@@H]1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667958	FG	On-Demand	Anodyne	ADIPOR1	0	41
CC(C)N1CCCC[C@@H]1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667958	FG	On-Demand	Anodyne	ADIPOR2	0	41
CC(C)N1CCCC[C@H]1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667959	FG	On-Demand	Anodyne	LUXN	0	45
CC(C)N1CCCC[C@H]1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667959	FG	On-Demand	Anodyne	ADIPOR1	0	41
CC(C)N1CCCC[C@H]1CN[C@@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667959	FG	On-Demand	Anodyne	ADIPOR2	0	41
CC(C)N1CCCC[C@H]1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667960	FG	On-Demand	Anodyne	LUXN	0	45
CC(C)N1CCCC[C@H]1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667960	FG	On-Demand	Anodyne	ADIPOR1	0	41
CC(C)N1CCCC[C@H]1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667960	FG	On-Demand	Anodyne	ADIPOR2	0	41
CC(C)N1CCCC[C@@H]1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667961	FG	On-Demand	Anodyne	LUXN	0	45
CC(C)N1CCCC[C@@H]1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667961	FG	On-Demand	Anodyne	ADIPOR1	0	41
CC(C)N1CCCC[C@@H]1CN[C@H](C)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450667961	FG	On-Demand	Anodyne	ADIPOR2	0	41
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C#N)[nH]c1C	ZINC000450667962	CG	On-Demand	Mild	BCL2	23	40
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C#N)[nH]c1C	ZINC000450667962	CG	On-Demand	Mild	NR1D1	41	43
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(C#N)[nH]c1C	ZINC000450667963	CG	On-Demand	Mild	BCL2	23	40
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(C#N)[nH]c1C	ZINC000450667963	CG	On-Demand	Mild	NR1D1	41	43
CC(C)OC(C)(C)C(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450667969	GG	On-Demand	Anodyne	SLC16A1	53	34
CC[C@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450667971	GC	On-Demand	Bother	BDKRB1	0	40
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450667972	GC	On-Demand	Bother	BDKRB1	0	40
CCS(=O)(=O)c1ccc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)cc1	ZINC000450667986	GI	On-Demand	Anodyne	RORC	30	41
CCS(=O)(=O)c1ccc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)cc1	ZINC000450667987	GI	On-Demand	Anodyne	RORC	30	41
FC(F)(F)c1csc(C2CCN(c3ncnc4ccsc34)CC2)n1	ZINC000450668005	FJ	On-Demand	Anodyne	SIRT3	60	36
FC(F)(F)c1csc(C2CCN(c3ncnc4ccsc34)CC2)n1	ZINC000450668005	FJ	On-Demand	Anodyne	SIRT2	55	36
FC(F)(F)c1csc(C2CCN(c3ncnc4ccsc34)CC2)n1	ZINC000450668005	FJ	On-Demand	Anodyne	SIRT1	54	36
COc1ccc2c(c1)[C@@H](NC(=O)CC1CC(F)(F)C1)CCO2	ZINC000450668006	DG	On-Demand	Anodyne	LUXR	63	34
COc1ccc2c(c1)[C@@H](NC(=O)CC1CC(F)(F)C1)CCO2	ZINC000450668006	DG	On-Demand	Anodyne	TRAR	78	36
COc1ccc2c(c1)[C@@H](NC(=O)CC1CC(F)(F)C1)CCO2	ZINC000450668006	DG	On-Demand	Anodyne	LASR	45	32
COc1cc([C@@H](C)NC[C@@](C)(O)C(C)=O)ccc1OC1CCCC1	ZINC000450668019	EG	On-Demand	Anodyne	PDE4A	37	41
COc1cc([C@@H](C)NC[C@@](C)(O)C(C)=O)ccc1OC1CCCC1	ZINC000450668019	EG	On-Demand	Anodyne	PDE4B	27	40
COc1cc([C@H](C)NC[C@](C)(O)C(C)=O)ccc1OC1CCCC1	ZINC000450668020	EG	On-Demand	Anodyne	PDE4A	37	41
COc1cc([C@H](C)NC[C@](C)(O)C(C)=O)ccc1OC1CCCC1	ZINC000450668020	EG	On-Demand	Anodyne	PDE4B	27	40
COc1cc([C@H](C)NC[C@@](C)(O)C(C)=O)ccc1OC1CCCC1	ZINC000450668021	EG	On-Demand	Anodyne	PDE4A	37	41
COc1cc([C@H](C)NC[C@@](C)(O)C(C)=O)ccc1OC1CCCC1	ZINC000450668021	EG	On-Demand	Anodyne	PDE4B	27	40
COc1cc([C@@H](C)NC[C@](C)(O)C(C)=O)ccc1OC1CCCC1	ZINC000450668022	EG	On-Demand	Anodyne	PDE4A	37	41
COc1cc([C@@H](C)NC[C@](C)(O)C(C)=O)ccc1OC1CCCC1	ZINC000450668022	EG	On-Demand	Anodyne	PDE4B	27	40
O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)[C@@H](O)C1CCC1	ZINC000450668023	DF	On-Demand	Anodyne	GUAB	0	41
O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)[C@@H](O)C1CCC1	ZINC000450668023	DF	On-Demand	Anodyne	IMDH_CRYPV	39	40
O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)[C@H](O)C1CCC1	ZINC000450668024	DF	On-Demand	Anodyne	GUAB	0	41
O=C(Nc1ccc2nc(-c3ccccn3)oc2c1)[C@H](O)C1CCC1	ZINC000450668024	DF	On-Demand	Anodyne	IMDH_CRYPV	39	40
Cn1ncc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)c(Cl)c1=O	ZINC000450668028	FF	On-Demand	Anodyne	PDS	16	46
Cn1ncc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)c(Cl)c1=O	ZINC000450668029	FF	On-Demand	Anodyne	PDS	16	46
Cc1nnc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)s1	ZINC000450668069	DF	On-Demand	Anodyne	SCD1	20	41
CNC(=O)C1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450668075	DE	On-Demand	Anodyne	SLC6A1	22	41
CNC(=O)C1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450668075	DE	On-Demand	Anodyne	ERBB2	24	41
CNC(=O)C1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450668075	DE	On-Demand	Anodyne	MMP2	15	41
CC[C@@](C)(CCO)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450668078	EG	On-Demand	Anodyne	GPR88	0	41
COC(=O)c1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450668084	CE	On-Demand	Anodyne	DRD4	40	32
COC(=O)c1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450668084	CE	On-Demand	Anodyne	FIMH	23	42
COC(=O)c1coc(CN[C@@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)n1	ZINC000450668085	GH	On-Demand	Anodyne	SOAT1	22	56
COC(=O)c1coc(CN[C@H](Cc2ccc(OC)c(OC)c2)c2ccccc2)n1	ZINC000450668086	GH	On-Demand	Anodyne	SOAT1	22	56
COC(=O)c1cccc(OC[C@H]2COCCO2)c1	ZINC000450668093	CD	On-Demand	Anodyne	DRD4	41	31
COC(=O)c1cccc(OC[C@@H]2COCCO2)c1	ZINC000450668094	CD	On-Demand	Anodyne	DRD4	41	31
O=c1cc(N2CCC[C@H]2COc2ccccc2)nc2ccccn12	ZINC000450668096	DF	On-Demand	Anodyne	CASP3	50	41
O=c1cc(N2CCC[C@H]2COc2ccccc2)nc2ccccn12	ZINC000450668096	DF	On-Demand	Anodyne	CHRNA10	67	46
O=c1cc(N2CCC[C@H]2COc2ccccc2)nc2ccccn12	ZINC000450668096	DF	On-Demand	Anodyne	CASP7	43	41
C[C@@]1(Cc2ccccc2)CCCN1C(=O)CC1(O)CCC1	ZINC000450668103	CF	On-Demand	Anodyne	SLC12A5	86	44
C[C@]1(Cc2ccccc2)CCCN1C(=O)CC1(O)CCC1	ZINC000450668104	CF	On-Demand	Anodyne	SLC12A5	86	44
CO[C@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668107	DH	On-Demand	Anodyne	TSHR	57	38
CO[C@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668107	DH	On-Demand	Anodyne	MME	48	37
CO[C@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668107	DH	On-Demand	Anodyne	FCER2	48	40
CO[C@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668107	DH	On-Demand	Anodyne	TIMP3	72	38
CO[C@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668107	DH	On-Demand	Anodyne	SOAT1	0	46
CO[C@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668107	DH	On-Demand	Anodyne	PDS	45	34
CO[C@@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668108	DH	On-Demand	Anodyne	TSHR	57	38
CO[C@@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668108	DH	On-Demand	Anodyne	MME	48	37
CO[C@@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668108	DH	On-Demand	Anodyne	FCER2	48	40
CO[C@@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668108	DH	On-Demand	Anodyne	TIMP3	72	38
CO[C@@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668108	DH	On-Demand	Anodyne	SOAT1	0	46
CO[C@@H](CSc1ccc(NC(C)=O)cc1)Cc1ccccc1	ZINC000450668108	DH	On-Demand	Anodyne	PDS	45	34
CC(=O)CCCCCOc1ccc(F)cc1Br	ZINC000450668109	DI	On-Demand	Anodyne	THRA	27	46
CC(=O)CCCCCOc1ccc(F)cc1Br	ZINC000450668109	DI	On-Demand	Anodyne	THRB	0	46
CCOCc1nc(C)c(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)s1	ZINC000450668117	FI	On-Demand	Anodyne	SLC12A5	71	39
CCOCc1nc(C)c(C(=O)N2CCC[C@]2(C)Cc2ccccc2)s1	ZINC000450668118	FI	On-Demand	Anodyne	SLC12A5	71	39
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450668119	DG	On-Demand	Anodyne	SLC12A5	77	40
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450668120	DG	On-Demand	Anodyne	SLC12A5	77	40
C[C@@H](Oc1ccccn1)C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450668121	DG	On-Demand	Anodyne	SLC12A5	77	40
C[C@@H](Oc1ccccn1)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450668122	DG	On-Demand	Anodyne	SLC12A5	77	40
Cc1[nH]c(C#N)cc1C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450668128	DG	On-Demand	Mild	SLC12A5	72	40
Cc1[nH]c(C#N)cc1C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450668129	DG	On-Demand	Mild	SLC12A5	72	40
CCCC[C@H](NCC1(C(=O)OC)CC1)c1ccc(OC)cc1	ZINC000450668141	DG	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
CCCC[C@@H](NCC1(C(=O)OC)CC1)c1ccc(OC)cc1	ZINC000450668142	DG	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc(N2CCCC2=O)c1	ZINC000450668149	FH	On-Demand	Anodyne	BACE2	0	40
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc(N2CCCC2=O)c1	ZINC000450668150	FH	On-Demand	Anodyne	BACE2	0	40
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc(N2CCCC2=O)c1	ZINC000450668151	FH	On-Demand	Anodyne	BACE2	0	40
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc(N2CCCC2=O)c1	ZINC000450668152	FH	On-Demand	Anodyne	BACE2	0	40
CCOc1cc(NC2CCN(C(=O)Cc3ccc(O)c(F)c3)CC2)ncn1	ZINC000450668160	FE	On-Demand	Anodyne	SSTR5	60	36
CCOc1cc(NC2CCN(C(=O)Cc3ccc(O)c(F)c3)CC2)ncn1	ZINC000450668160	FE	On-Demand	Anodyne	MLNR	39	40
CCOc1cc(NC2CCN(C(=O)Cc3ccc(O)c(F)c3)CC2)ncn1	ZINC000450668160	FE	On-Demand	Anodyne	GPR119	20	41
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450668161	EI	On-Demand	Anodyne	SLC12A5	77	42
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450668162	EI	On-Demand	Anodyne	SLC12A5	77	42
Cc1oc2ccccc2c1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450668163	GH	On-Demand	Anodyne	CA5B	26	43
Cc1oc2ccccc2c1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450668163	GH	On-Demand	Anodyne	CA5A	25	43
Cc1oc2ccccc2c1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450668163	GH	On-Demand	Anodyne	E1	0	44
CC(C)OC(C)(C)C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450668170	GG	On-Demand	Anodyne	SLC16A1	53	34
COc1cc2c(cc1F)CN(C(=O)C1(Cc3cccc(Cl)c3)CC1)CC2	ZINC000450668171	FI	On-Demand	Anodyne	ABCB1	17	41
COc1cc2c(cc1F)CN(C(=O)C1(Cc3cccc(Cl)c3)CC1)CC2	ZINC000450668171	FI	On-Demand	Anodyne	HCRTR2	16	45
Cc1nnc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)s1	ZINC000450668173	DF	On-Demand	Anodyne	SCD1	20	41
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C#N)C[C@H]2C)cc1	ZINC000450668178	DD	On-Demand	Mild	ACACA	50	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C#N)C[C@H]2C)cc1	ZINC000450668178	DD	On-Demand	Mild	ACACB	28	40
CC[C@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N1CCCC1	ZINC000450668180	GJ	On-Demand	Anodyne	HCN1	63	36
CC[C@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N1CCCC1	ZINC000450668180	GJ	On-Demand	Anodyne	HCN4	53	36
CC[C@@H](NC[C@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N1CCCC1	ZINC000450668181	GJ	On-Demand	Anodyne	HCN1	63	36
CC[C@@H](NC[C@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N1CCCC1	ZINC000450668181	GJ	On-Demand	Anodyne	HCN4	53	36
CC[C@H](NC[C@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N1CCCC1	ZINC000450668182	GJ	On-Demand	Anodyne	HCN1	63	36
CC[C@H](NC[C@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N1CCCC1	ZINC000450668182	GJ	On-Demand	Anodyne	HCN4	53	36
CC[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N1CCCC1	ZINC000450668183	GJ	On-Demand	Anodyne	HCN1	63	36
CC[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1OCC(=O)N1CCCC1	ZINC000450668183	GJ	On-Demand	Anodyne	HCN4	53	36
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C#N)C[C@@H]2C)cc1	ZINC000450668186	DD	On-Demand	Mild	ACACA	50	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C#N)C[C@@H]2C)cc1	ZINC000450668186	DD	On-Demand	Mild	ACACB	28	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C#N)C[C@H]2C)cc1	ZINC000450668188	DD	On-Demand	Mild	ACACA	50	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C#N)C[C@H]2C)cc1	ZINC000450668188	DD	On-Demand	Mild	ACACB	28	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C#N)C[C@@H]2C)cc1	ZINC000450668191	DD	On-Demand	Mild	ACACA	50	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C#N)C[C@@H]2C)cc1	ZINC000450668191	DD	On-Demand	Mild	ACACB	28	40
CC[C@H]1Cc2ccccc2CN1C(=O)c1cn(C)nc1COC	ZINC000450668204	DF	On-Demand	Anodyne	CFTR	44	31
CC[C@H]1Cc2ccccc2CN1C(=O)c1cn(C)nc1COC	ZINC000450668204	DF	On-Demand	Anodyne	BCL2	25	44
CC[C@H]1Cc2ccccc2CN1C(=O)c1cn(C)nc1COC	ZINC000450668204	DF	On-Demand	Anodyne	NR1D1	42	45
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cn(C)nc1COC	ZINC000450668207	DF	On-Demand	Anodyne	CFTR	44	31
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cn(C)nc1COC	ZINC000450668207	DF	On-Demand	Anodyne	BCL2	25	44
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cn(C)nc1COC	ZINC000450668207	DF	On-Demand	Anodyne	NR1D1	42	45
COc1cccc(Oc2ccc(C(=O)NCC(F)(F)CO)nc2)c1	ZINC000450668231	EE	On-Demand	Anodyne	DRD4	40	30
COc1cc([C@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668236	FG	On-Demand	Anodyne	PTGER2	29	45
COc1cc([C@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668236	FG	On-Demand	Anodyne	PTGER1	42	36
COc1cc([C@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668236	FG	On-Demand	Anodyne	PTGER4	25	45
COc1cc([C@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668236	FG	On-Demand	Anodyne	MTNR1B	22	44
COc1cc([C@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668236	FG	On-Demand	Anodyne	CAPN1	17	41
COc1cc([C@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668236	FG	On-Demand	Anodyne	CAPN2	24	40
COc1cc([C@@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668237	FG	On-Demand	Anodyne	PTGER2	29	45
COc1cc([C@@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668237	FG	On-Demand	Anodyne	PTGER1	42	36
COc1cc([C@@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668237	FG	On-Demand	Anodyne	PTGER4	25	45
COc1cc([C@@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668237	FG	On-Demand	Anodyne	MTNR1B	22	44
COc1cc([C@@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668237	FG	On-Demand	Anodyne	CAPN1	17	41
COc1cc([C@@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668237	FG	On-Demand	Anodyne	CAPN2	24	40
COc1cc([C@@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668238	FG	On-Demand	Anodyne	PTGER2	29	45
COc1cc([C@@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668238	FG	On-Demand	Anodyne	PTGER1	42	36
COc1cc([C@@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668238	FG	On-Demand	Anodyne	PTGER4	25	45
COc1cc([C@@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668238	FG	On-Demand	Anodyne	MTNR1B	22	44
COc1cc([C@@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668238	FG	On-Demand	Anodyne	CAPN1	17	41
COc1cc([C@@H](C)NC[C@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668238	FG	On-Demand	Anodyne	CAPN2	24	40
COc1cc([C@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668240	FG	On-Demand	Anodyne	PTGER2	29	45
COc1cc([C@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668240	FG	On-Demand	Anodyne	PTGER1	42	36
COc1cc([C@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668240	FG	On-Demand	Anodyne	PTGER4	25	45
COc1cc([C@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668240	FG	On-Demand	Anodyne	MTNR1B	22	44
COc1cc([C@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668240	FG	On-Demand	Anodyne	CAPN1	17	41
COc1cc([C@H](C)NC[C@@](C)(O)C(C)=O)ccc1OCc1ccccc1	ZINC000450668240	FG	On-Demand	Anodyne	CAPN2	24	40
CC[C@H](CNS(C)(=O)=O)Nc1ccnc2cc(Cl)ccc12	ZINC000450668248	EF	On-Demand	Anodyne	HRP1_PLAFA	97	49
CC[C@H](CNS(C)(=O)=O)Nc1ccnc2cc(Cl)ccc12	ZINC000450668248	EF	On-Demand	Anodyne	RBP_CHICK	0	49
CC[C@@H](CNS(C)(=O)=O)Nc1ccnc2cc(Cl)ccc12	ZINC000450668249	EF	On-Demand	Anodyne	HRP1_PLAFA	97	49
CC[C@@H](CNS(C)(=O)=O)Nc1ccnc2cc(Cl)ccc12	ZINC000450668249	EF	On-Demand	Anodyne	RBP_CHICK	0	49
CCS(=O)(=O)c1ccc(CNC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450668254	FE	On-Demand	Anodyne	HDAC1	15	41
CCS(=O)(=O)c1ccc(CNC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450668254	FE	On-Demand	Anodyne	HPGDS	15	42
CCS(=O)(=O)c1ccc(CNC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450668254	FE	On-Demand	Anodyne	NAMPT	105	51
CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450668279	EI	On-Demand	Anodyne	CFTR	58	36
CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450668279	EI	On-Demand	Anodyne	NR1D1	41	42
CC[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450668282	EI	On-Demand	Anodyne	CFTR	58	36
CC[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450668282	EI	On-Demand	Anodyne	NR1D1	41	42
Clc1ccc(CCSc2nnc(C3CC3)n2Cc2ccco2)cc1	ZINC000450668290	FJ	On-Demand	Anodyne	HCRTR2	15	41
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450668292	DE	On-Demand	Anodyne	OPRD1	57	37
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450668292	DE	On-Demand	Anodyne	CFTR	41	37
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450668292	DE	On-Demand	Anodyne	BCL2	28	43
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450668292	DE	On-Demand	Anodyne	NR1D1	38	41
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450668295	DE	On-Demand	Anodyne	OPRD1	57	37
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450668295	DE	On-Demand	Anodyne	CFTR	41	37
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450668295	DE	On-Demand	Anodyne	BCL2	28	43
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450668295	DE	On-Demand	Anodyne	NR1D1	38	41
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000450668304	ED	On-Demand	Bother	TNK2	26	44
C[C@@H](O)CCSc1nnc(-c2ccccc2)n1Cc1ccco1	ZINC000450668307	EG	On-Demand	Anodyne	HCRTR2	23	48
C[C@H](O)CCSc1nnc(-c2ccccc2)n1Cc1ccco1	ZINC000450668308	EG	On-Demand	Anodyne	HCRTR2	23	48
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(C#N)cc1	ZINC000450668316	BD	On-Demand	Mild	CTRB_BOVIN	47	34
c1cncc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)c1	ZINC000450668319	FH	On-Demand	Anodyne	HCRTR2	0	40
c1cncc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)c1	ZINC000450668320	FH	On-Demand	Anodyne	HCRTR2	0	40
CCC(=O)C1(C(=O)N[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC1	ZINC000450668321	GG	On-Demand	Anodyne	APP	16	45
CCC(=O)C1(C(=O)N[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC1	ZINC000450668321	GG	On-Demand	Anodyne	CCR2	83	38
CCC(=O)C1(C(=O)N[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC1	ZINC000450668322	GG	On-Demand	Anodyne	APP	16	45
CCC(=O)C1(C(=O)N[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)CC1	ZINC000450668322	GG	On-Demand	Anodyne	CCR2	83	38
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450668323	EE	On-Demand	Mild	ACACA	48	43
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450668323	EE	On-Demand	Mild	ACACB	25	43
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450668324	EE	On-Demand	Mild	ACACA	48	43
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450668324	EE	On-Demand	Mild	ACACB	25	43
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(C#N)cc1	ZINC000450668326	BD	On-Demand	Mild	CTRB_BOVIN	47	34
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(C#N)cc1	ZINC000450668327	BD	On-Demand	Mild	CTRB_BOVIN	47	34
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(C#N)cc1	ZINC000450668328	BD	On-Demand	Mild	CTRB_BOVIN	47	34
CCS(=O)(=O)c1ccc(CSc2nnc(-c3ccoc3C)o2)cc1	ZINC000450668348	FH	On-Demand	Anodyne	GSK3A	40	38
CCS(=O)(=O)c1ccc(CSc2nnc(-c3ccoc3C)o2)cc1	ZINC000450668348	FH	On-Demand	Anodyne	TERT	0	40
COC(=O)c1cccc(OCc2ccn(CC(F)(F)F)n2)c1	ZINC000450668374	DF	On-Demand	Anodyne	KDM5C	0	43
CCOc1cc(NC2CCN(C(=O)c3ccnc(OC(F)F)c3)CC2)ncn1	ZINC000450668384	GF	On-Demand	Anodyne	SSTR5	42	35
CC[C@@](C)(CCO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450668388	EG	On-Demand	Anodyne	MTNR1A	23	41
CC[C@@](C)(CCO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450668388	EG	On-Demand	Anodyne	MTNR1B	26	42
CC[C@](C)(CCO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450668389	EG	On-Demand	Anodyne	MTNR1A	23	41
CC[C@](C)(CCO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450668389	EG	On-Demand	Anodyne	MTNR1B	26	42
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450668405	EI	On-Demand	Anodyne	SLC12A5	76	42
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450668406	EI	On-Demand	Anodyne	SLC12A5	76	42
O=C(NCc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450668407	EI	On-Demand	Anodyne	KCNA3	43	43
O=C(NCc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450668407	EI	On-Demand	Anodyne	HCN1	82	40
O=C(NCc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450668407	EI	On-Demand	Anodyne	HCN4	58	37
O=C(NCc1ccccc1)c1ccccc1OCC1CC(F)(F)C1	ZINC000450668407	EI	On-Demand	Anodyne	PDS	44	34
CO[C@@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668408	DH	On-Demand	Anodyne	MME	49	38
CO[C@@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668408	DH	On-Demand	Anodyne	THRB	0	43
CO[C@@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668408	DH	On-Demand	Anodyne	MTNR1B	20	41
CO[C@@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668408	DH	On-Demand	Anodyne	PTPN1	19	43
CO[C@@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668408	DH	On-Demand	Anodyne	AMP1_PLAFQ	46	40
CO[C@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668409	DH	On-Demand	Anodyne	MME	49	38
CO[C@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668409	DH	On-Demand	Anodyne	THRB	0	43
CO[C@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668409	DH	On-Demand	Anodyne	MTNR1B	20	41
CO[C@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668409	DH	On-Demand	Anodyne	PTPN1	19	43
CO[C@H](Cc1ccccc1)C(=O)NCc1c(C)oc2ccccc12	ZINC000450668409	DH	On-Demand	Anodyne	AMP1_PLAFQ	46	40
CCOC(=O)c1cc(C(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)on1	ZINC000450668413	GG	On-Demand	Anodyne	GYRB	0	46
CCOC(=O)c1cc(C(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)on1	ZINC000450668413	GG	On-Demand	Anodyne	P2RY12	61	40
C=CCOc1ccc(CC(=O)N2CCC(Nc3cc(OCC)ncn3)CC2)cc1	ZINC000450668424	GG	On-Demand	Mild	SSTR5	40	33
CCN(C)C(=O)[C@@H](Nc1ccnc2cc(F)c(OC)cc12)C(C)C	ZINC000450668428	EG	On-Demand	Anodyne	MET	41	35
CCN(C)C(=O)[C@@H](Nc1ccnc2cc(F)c(OC)cc12)C(C)C	ZINC000450668428	EG	On-Demand	Anodyne	PDGFRA	49	36
CCCc1nc(C)c(COc2ccccc2C(=O)NCc2ccccc2)o1	ZINC000450668445	FI	On-Demand	Anodyne	HCN1	54	38
CCCc1nc(C)c(COc2ccccc2C(=O)NCc2ccccc2)o1	ZINC000450668445	FI	On-Demand	Anodyne	HCN4	41	31
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	F2	23	46
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	PLG	17	40
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	MMP13	18	46
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	TRY2_BOVIN	80	40
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	CAPNS1	25	45
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	MMP2	26	46
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	MMP3	17	46
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	MMP9	17	43
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	ST14	42	40
CNC(=O)C1CN(C(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)C1	ZINC000450668458	GC	On-Demand	Anodyne	LEF	44	34
Cc1cc(-c2nc(C(=O)NCC(F)(F)CO)co2)ccn1	ZINC000450668511	CD	On-Demand	Anodyne	IRAK4	23	46
COc1cc([C@@H](C)NC[C@@H]2COCCO2)ccc1OCc1ccncc1	ZINC000450668512	FF	On-Demand	Anodyne	PDE4A	26	40
COc1cc([C@H](C)NC[C@@H]2COCCO2)ccc1OCc1ccncc1	ZINC000450668513	FF	On-Demand	Anodyne	PDE4A	26	40
COc1cc([C@@H](C)NC[C@H]2COCCO2)ccc1OCc1ccncc1	ZINC000450668514	FF	On-Demand	Anodyne	PDE4A	26	40
COc1cc([C@H](C)NC[C@H]2COCCO2)ccc1OCc1ccncc1	ZINC000450668515	FF	On-Demand	Anodyne	PDE4A	26	40
CC[C@@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1OCC(=O)N(C)C	ZINC000450668518	GI	On-Demand	Anodyne	PDE6A	44	35
CC[C@H](NCc1ccc(Cl)c(OC)c1)c1ccccc1OCC(=O)N(C)C	ZINC000450668519	GI	On-Demand	Anodyne	PDE6A	44	35
CC[C@H](CC(F)(F)F)C(=O)NCc1cc2cc(Br)ccc2[nH]1	ZINC000450668524	GJ	On-Demand	Anodyne	PYK	51	37
CC[C@@H](CC(F)(F)F)C(=O)NCc1cc2cc(Br)ccc2[nH]1	ZINC000450668525	GJ	On-Demand	Anodyne	PYK	51	37
O=C(CC1(O)CCC1)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450668526	EH	On-Demand	Anodyne	FFAR2	56	36
O=C(CC1(O)CCC1)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450668527	EH	On-Demand	Anodyne	FFAR2	56	36
CC1(C)CN(C(=O)CCCC(=O)C2CC2)CC(C)(C)C1	ZINC000450668532	CG	On-Demand	Anodyne	GNAI1	0	42
CC1(C)CN(C(=O)CCCC(=O)C2CC2)CC(C)(C)C1	ZINC000450668532	CG	On-Demand	Anodyne	GNAI3	0	42
CC1(C)CN(C(=O)CCCC(=O)C2CC2)CC(C)(C)C1	ZINC000450668532	CG	On-Demand	Anodyne	GNAO1	0	42
OCC[C@@H](Nc1ncc(Cl)cn1)c1cccc(C(F)(F)F)c1	ZINC000450668535	EH	On-Demand	Anodyne	PDS	41	34
OCC[C@H](Nc1ncc(Cl)cn1)c1cccc(C(F)(F)F)c1	ZINC000450668536	EH	On-Demand	Anodyne	PDS	41	34
COC(=O)COc1ccc([C@@H](C)NC(=O)C(C)(C)C2CCC2)cc1	ZINC000450668549	EG	On-Demand	Anodyne	ACACB	31	40
COC(=O)COc1ccc([C@H](C)NC(=O)C(C)(C)C2CCC2)cc1	ZINC000450668550	EG	On-Demand	Anodyne	ACACB	31	40
COc1cccc([C@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)c1	ZINC000450668563	EK	On-Demand	Anodyne	CASR	17	62
COc1cccc([C@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)c1	ZINC000450668564	EK	On-Demand	Anodyne	CASR	17	62
COc1cccc([C@@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)c1	ZINC000450668565	EK	On-Demand	Anodyne	CASR	17	62
COc1cccc([C@@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)c1	ZINC000450668566	EK	On-Demand	Anodyne	CASR	17	62
CC[C@@H](O)CC(=O)N1CCc2cc(OC)c(F)cc2C1	ZINC000450668573	CD	On-Demand	Anodyne	DPP4	18	41
CC[C@@H](O)CC(=O)N1CCc2cc(OC)c(F)cc2C1	ZINC000450668573	CD	On-Demand	Anodyne	ABCB1	16	48
CC[C@@H](O)CC(=O)N1CCc2cc(OC)c(F)cc2C1	ZINC000450668573	CD	On-Demand	Anodyne	HCRTR2	15	44
CC[C@H](O)CC(=O)N1CCc2cc(OC)c(F)cc2C1	ZINC000450668574	CD	On-Demand	Anodyne	DPP4	18	41
CC[C@H](O)CC(=O)N1CCc2cc(OC)c(F)cc2C1	ZINC000450668574	CD	On-Demand	Anodyne	ABCB1	16	48
CC[C@H](O)CC(=O)N1CCc2cc(OC)c(F)cc2C1	ZINC000450668574	CD	On-Demand	Anodyne	HCRTR2	15	44
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450668579	DH	On-Demand	Anodyne	OPRM1	33	45
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450668579	DH	On-Demand	Anodyne	OPRD1	61	38
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450668579	DH	On-Demand	Anodyne	AGTR2	106	40
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450668579	DH	On-Demand	Anodyne	CFTR	42	32
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450668580	DH	On-Demand	Anodyne	OPRM1	33	45
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450668580	DH	On-Demand	Anodyne	OPRD1	61	38
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450668580	DH	On-Demand	Anodyne	AGTR2	106	40
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450668580	DH	On-Demand	Anodyne	CFTR	42	32
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450668581	DH	On-Demand	Anodyne	OPRM1	33	45
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450668581	DH	On-Demand	Anodyne	OPRD1	61	38
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450668581	DH	On-Demand	Anodyne	AGTR2	106	40
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450668581	DH	On-Demand	Anodyne	CFTR	42	32
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450668582	DH	On-Demand	Anodyne	OPRM1	33	45
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450668582	DH	On-Demand	Anodyne	OPRD1	61	38
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450668582	DH	On-Demand	Anodyne	AGTR2	106	40
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450668582	DH	On-Demand	Anodyne	CFTR	42	32
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2Cc3cccc(C)c3O2)cc1	ZINC000450668584	FF	On-Demand	Anodyne	ACACB	28	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2Cc3cccc(C)c3O2)cc1	ZINC000450668585	FF	On-Demand	Anodyne	ACACB	28	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2Cc3cccc(C)c3O2)cc1	ZINC000450668586	FF	On-Demand	Anodyne	ACACB	28	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2Cc3cccc(C)c3O2)cc1	ZINC000450668587	FF	On-Demand	Anodyne	ACACB	28	40
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cn3nccc3nc2C)cc1	ZINC000450668592	FE	On-Demand	Anodyne	ACACA	53	35
COC(=O)COc1ccc([C@H](C)NC(=O)c2cn3nccc3nc2C)cc1	ZINC000450668593	FE	On-Demand	Anodyne	ACACA	53	35
COc1cc([C@H](C)NC[C@H]2CCCC2(F)F)ccc1OC(F)F	ZINC000450668595	EI	On-Demand	Anodyne	PDE4A	48	34
COc1cc([C@H](C)NC[C@@H]2CCCC2(F)F)ccc1OC(F)F	ZINC000450668596	EI	On-Demand	Anodyne	PDE4A	48	34
COc1cc([C@@H](C)NC[C@@H]2CCCC2(F)F)ccc1OC(F)F	ZINC000450668597	EI	On-Demand	Anodyne	PDE4A	48	34
COc1cc([C@@H](C)NC[C@H]2CCCC2(F)F)ccc1OC(F)F	ZINC000450668598	EI	On-Demand	Anodyne	PDE4A	48	34
COC[C@@]1(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCOC1	ZINC000450668600	ED	On-Demand	Bother	CACNA1D	60	34
COC[C@]1(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCOC1	ZINC000450668601	ED	On-Demand	Bother	CACNA1D	60	34
c1ccc(-c2nnc(SC[C@@H]3COCCO3)n2Cc2ccco2)cc1	ZINC000450668616	FG	On-Demand	Anodyne	HCRTR2	20	43
c1ccc(-c2nnc(SC[C@H]3COCCO3)n2Cc2ccco2)cc1	ZINC000450668617	FG	On-Demand	Anodyne	HCRTR2	20	43
CC[C@H]1Cc2ccccc2CN1C(=O)CC[C@H]1CCC(=O)N1	ZINC000450668621	DE	On-Demand	Anodyne	ADAM9	47	32
CC[C@H]1Cc2ccccc2CN1C(=O)CC[C@@H]1CCC(=O)N1	ZINC000450668622	DE	On-Demand	Anodyne	ADAM9	47	32
CC[C@@H]1Cc2ccccc2CN1C(=O)CC[C@H]1CCC(=O)N1	ZINC000450668623	DE	On-Demand	Anodyne	ADAM9	47	32
CC[C@@H]1Cc2ccccc2CN1C(=O)CC[C@@H]1CCC(=O)N1	ZINC000450668624	DE	On-Demand	Anodyne	ADAM9	47	32
C[C@H](NC[C@H]1CCC(F)(F)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450668633	FG	On-Demand	Anodyne	LUXN	0	45
C[C@@H](NC[C@H]1CCC(F)(F)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450668634	FG	On-Demand	Anodyne	LUXN	0	45
C[C@H](NC[C@@H]1CCC(F)(F)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450668635	FG	On-Demand	Anodyne	LUXN	0	45
C[C@@H](NC[C@@H]1CCC(F)(F)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450668636	FG	On-Demand	Anodyne	LUXN	0	45
COC(=O)c1ccc(OCCCCCC(C)=O)c(OC)c1	ZINC000450668640	CG	On-Demand	Anodyne	PLA2G4B	31	45
Ic1cccc(OC[C@H]2COCCO2)c1	ZINC000450668652	DE	On-Demand	Anodyne	CHRNA10	41	33
Ic1cccc(OC[C@@H]2COCCO2)c1	ZINC000450668653	DE	On-Demand	Anodyne	CHRNA10	41	33
O=[N+]([O-])c1cnc2ccc(N3CCC[C@H]3COc3ccccc3)nn12	ZINC000450668656	EF	On-Demand	Bother	CHRNA10	60	43
O=C(CCCC(=O)C1CC1)Nc1ccc(Oc2nncc3ccccc23)cc1	ZINC000450668657	GJ	On-Demand	Anodyne	LTA4H	40	38
CC(=O)Nc1ccc(SCCC(C)(F)F)cc1	ZINC000450668658	CH	On-Demand	Anodyne	IDO1	25	40
CC[C@@H](CC(F)(F)F)C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450668664	EJ	On-Demand	Anodyne	SLC12A5	79	40
CC[C@H](CC(F)(F)F)C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450668665	EJ	On-Demand	Anodyne	SLC12A5	79	40
CC[C@@H](CC(F)(F)F)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450668666	EJ	On-Demand	Anodyne	SLC12A5	79	40
CC[C@H](CC(F)(F)F)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450668667	EJ	On-Demand	Anodyne	SLC12A5	79	40
CCN(C)C(=O)[C@@H](Nc1ncnc2cc(Br)ccc12)C(C)C	ZINC000450668668	FG	On-Demand	Anodyne	EGFR	68	38
Cc1oc2ccccc2c1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450668674	EH	On-Demand	Anodyne	PDE8B	56	34
Cc1oc2ccccc2c1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450668675	EH	On-Demand	Anodyne	EPHX2	16	42
Cc1oc2ccccc2c1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450668675	EH	On-Demand	Anodyne	PDE8B	56	34
CCCc1nc(C)c(COc2ccc(C(=O)OC)cc2OC)o1	ZINC000450668686	DG	On-Demand	Anodyne	DRTS_TRYCR	29	40
CC[C@H](CNS(C)(=O)=O)Nc1nccc(-c2ccc(OC)cc2)n1	ZINC000450668701	FD	On-Demand	Anodyne	IKBKB	0	48
CC[C@@H](CNS(C)(=O)=O)Nc1nccc(-c2ccc(OC)cc2)n1	ZINC000450668703	FD	On-Demand	Anodyne	IKBKB	0	48
CCN(C)C(=O)[C@@H](Nc1ncnc2c(C)csc12)C(C)C	ZINC000450668704	DF	On-Demand	Anodyne	LPAR2	23	45
Cc1ccc(S[C@H](C)C(=O)Nc2nccs2)cc1C	ZINC000450668708	CH	On-Demand	Anodyne	MAP	0	42
Cc1ccc(S[C@H](C)C(=O)Nc2nccs2)cc1C	ZINC000450668708	CH	On-Demand	Anodyne	MAP1	118	40
Cc1ccc(S[C@@H](C)C(=O)Nc2nccs2)cc1C	ZINC000450668709	CH	On-Demand	Anodyne	MAP	0	42
Cc1ccc(S[C@@H](C)C(=O)Nc2nccs2)cc1C	ZINC000450668709	CH	On-Demand	Anodyne	MAP1	118	40
CCn1ccnc(N2CCC[C@H]2COc2ccccc2)c1=O	ZINC000450668720	CE	On-Demand	Anodyne	CASP3	54	39
CCn1ccnc(N2CCC[C@H]2COc2ccccc2)c1=O	ZINC000450668720	CE	On-Demand	Anodyne	CHRNA10	69	50
CCn1ccnc(N2CCC[C@H]2COc2ccccc2)c1=O	ZINC000450668720	CE	On-Demand	Anodyne	CASP7	43	39
CC(C)Cn1cc(C(=O)N[C@H](CO)c2ccccc2)c(C(F)F)n1	ZINC000450668739	EF	On-Demand	Anodyne	GPR88	0	41
CC(=O)N[C@H](C(=O)Nc1ccc(Oc2nncc3ccccc23)cc1)C(C)(C)C	ZINC000450668741	GH	On-Demand	Anodyne	ACACA	45	35
Cc1nc(C(C)C)oc1COc1ccccc1C(=O)NCc1ccccc1	ZINC000450668750	FJ	On-Demand	Anodyne	SCD1	15	40
Cc1nc(C(C)C)oc1COc1ccccc1C(=O)NCc1ccccc1	ZINC000450668750	FJ	On-Demand	Anodyne	HCN1	57	38
Cc1nc(C(C)C)oc1COc1ccccc1C(=O)NCc1ccccc1	ZINC000450668750	FJ	On-Demand	Anodyne	PDS	41	33
CC[C@H](CNS(C)(=O)=O)Nc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450668766	FE	On-Demand	Mild	MAP3K8	56	35
CCN(C)C(=O)[C@@H](Nc1nc(C)nc2scc(C)c12)C(C)C	ZINC000450668767	DG	On-Demand	Anodyne	UL26	88	34
CCN(C)C(=O)[C@@H](Nc1nc(C)nc2scc(C)c12)C(C)C	ZINC000450668767	DG	On-Demand	Anodyne	SCAF_EBVB9	73	32
CC[C@@H](CNS(C)(=O)=O)Nc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450668770	FE	On-Demand	Mild	MAP3K8	56	35
CNC(=O)N[C@H]1CCN(C(=O)c2cccc(C#N)c2Br)C1	ZINC000450668787	FD	On-Demand	Mild	MTNR1A	26	42
CNC(=O)N[C@H]1CCN(C(=O)c2cccc(C#N)c2Br)C1	ZINC000450668787	FD	On-Demand	Mild	MTNR1B	0	42
CNC(=O)N[C@@H]1CCN(C(=O)c2cccc(C#N)c2Br)C1	ZINC000450668788	FD	On-Demand	Mild	MTNR1A	26	42
CNC(=O)N[C@@H]1CCN(C(=O)c2cccc(C#N)c2Br)C1	ZINC000450668788	FD	On-Demand	Mild	MTNR1B	0	42
CC[C@H](CNS(C)(=O)=O)Nc1ccc([N+](=O)[O-])cc1OC(F)F	ZINC000450668802	FD	On-Demand	Bother	CYP19A1	15	57
CC[C@@H](CNS(C)(=O)=O)Nc1ccc([N+](=O)[O-])cc1OC(F)F	ZINC000450668803	FD	On-Demand	Bother	CYP19A1	15	57
CCN(C)C(=O)[C@@H](Nc1ccc(C)cc1[N+](=O)[O-])C(C)C	ZINC000450668817	CF	On-Demand	Bother	COLA	44	32
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000450668822	GF	On-Demand	Bother	CACNA1C	41	35
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000450668822	GF	On-Demand	Bother	CACNA1D	62	35
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000450668822	GF	On-Demand	Bother	MTNR1A	51	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000450668822	GF	On-Demand	Bother	MTNR1B	45	39
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000450668823	GF	On-Demand	Bother	CACNA1C	41	35
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000450668823	GF	On-Demand	Bother	CACNA1D	62	35
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000450668823	GF	On-Demand	Bother	MTNR1A	51	39
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000450668823	GF	On-Demand	Bother	MTNR1B	45	39
C[C@H](O)CCCN[C@@H](c1ccc(Br)cc1)C1CCC1	ZINC000450668826	EI	On-Demand	Anodyne	SDH1	0	40
C[C@H](O)CCCN[C@H](c1ccc(Br)cc1)C1CCC1	ZINC000450668827	EI	On-Demand	Anodyne	SDH1	0	40
C[C@@H](O)CCCN[C@@H](c1ccc(Br)cc1)C1CCC1	ZINC000450668828	EI	On-Demand	Anodyne	SDH1	0	40
C[C@@H](O)CCCN[C@H](c1ccc(Br)cc1)C1CCC1	ZINC000450668829	EI	On-Demand	Anodyne	SDH1	0	40
CCc1c(C(=O)N2CC[C@@H](NC(=O)NC)C2)oc2ccccc12	ZINC000450668830	DE	On-Demand	Anodyne	MTNR1A	26	40
CCc1c(C(=O)N2CC[C@@H](NC(=O)NC)C2)oc2ccccc12	ZINC000450668830	DE	On-Demand	Anodyne	MTNR1B	18	40
CCc1c(C(=O)N2CC[C@H](NC(=O)NC)C2)oc2ccccc12	ZINC000450668831	DE	On-Demand	Anodyne	MTNR1A	26	40
CCc1c(C(=O)N2CC[C@H](NC(=O)NC)C2)oc2ccccc12	ZINC000450668831	DE	On-Demand	Anodyne	MTNR1B	18	40
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450668838	FE	On-Demand	Anodyne	MTNR1A	15	40
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450668838	FE	On-Demand	Anodyne	MTNR1B	22	40
C[C@H](NCc1cn(CC2CC2)nn1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450668843	GH	On-Demand	Anodyne	KCNK3	83	38
C[C@H](NCc1cn(CC2CC2)nn1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450668843	GH	On-Demand	Anodyne	KCNK9	40	37
C[C@@H](NCc1cn(CC2CC2)nn1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450668844	GH	On-Demand	Anodyne	KCNK3	83	38
C[C@@H](NCc1cn(CC2CC2)nn1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450668844	GH	On-Demand	Anodyne	KCNK9	40	37
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CCCCC2(F)F)cc1	ZINC000450668853	FG	On-Demand	Anodyne	SDH1	0	41
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CCCCC2(F)F)cc1	ZINC000450668853	FG	On-Demand	Anodyne	ACACB	32	45
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CCCCC2(F)F)cc1	ZINC000450668854	FG	On-Demand	Anodyne	SDH1	0	41
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CCCCC2(F)F)cc1	ZINC000450668854	FG	On-Demand	Anodyne	ACACB	32	45
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCCCC2(F)F)cc1	ZINC000450668855	FG	On-Demand	Anodyne	SDH1	0	41
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCCCC2(F)F)cc1	ZINC000450668855	FG	On-Demand	Anodyne	ACACB	32	45
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCCCC2(F)F)cc1	ZINC000450668856	FG	On-Demand	Anodyne	SDH1	0	41
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCCCC2(F)F)cc1	ZINC000450668856	FG	On-Demand	Anodyne	ACACB	32	45
COCCOC[C@@H](O)CN[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000450668861	DF	On-Demand	Anodyne	ADRB2	19	40
COCCOC[C@H](O)CN[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000450668862	DF	On-Demand	Anodyne	ADRB2	19	40
COCCOC[C@H](O)CN[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000450668863	DF	On-Demand	Anodyne	ADRB2	19	40
COCCOC[C@@H](O)CN[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000450668864	DF	On-Demand	Anodyne	ADRB2	19	40
COC(=O)COc1ccc([C@@H](C)NC(=O)C(C)(C)OC(C)C)cc1	ZINC000450668865	EF	On-Demand	Anodyne	ACACA	63	41
COC(=O)COc1ccc([C@H](C)NC(=O)C(C)(C)OC(C)C)cc1	ZINC000450668866	EF	On-Demand	Anodyne	ACACA	63	41
CC[C@H]1Cc2ccccc2CN1C(=O)c1cc2c(=O)n(C)c(=O)n(C)c2s1	ZINC000450668869	GE	On-Demand	Anodyne	NR1D1	40	40
CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc2c(=O)n(C)c(=O)n(C)c2s1	ZINC000450668870	GE	On-Demand	Anodyne	NR1D1	40	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450668873	GF	On-Demand	Anodyne	ACACA	49	45
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450668873	GF	On-Demand	Anodyne	ACACB	27	45
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450668874	GF	On-Demand	Anodyne	ACACA	49	45
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450668874	GF	On-Demand	Anodyne	ACACB	27	45
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450668875	GF	On-Demand	Anodyne	ACACA	49	45
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450668875	GF	On-Demand	Anodyne	ACACB	27	45
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450668876	GF	On-Demand	Anodyne	ACACA	49	45
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450668876	GF	On-Demand	Anodyne	ACACB	27	45
CCn1nnc(C)c1CSc1nnc(-c2cccnc2)n1Cc1ccco1	ZINC000450668877	GG	On-Demand	Anodyne	HCRTR2	0	43
COc1cc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc(OC)c1OC	ZINC000450668880	FH	On-Demand	Anodyne	N1L	0	41
COc1cc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc(OC)c1OC	ZINC000450668880	FH	On-Demand	Anodyne	SLC22A3	0	42
COc1cc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc(OC)c1OC	ZINC000450668881	FH	On-Demand	Anodyne	N1L	0	41
COc1cc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc(OC)c1OC	ZINC000450668881	FH	On-Demand	Anodyne	SLC22A3	0	42
COc1cc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc(OC)c1OC	ZINC000450668882	FH	On-Demand	Anodyne	N1L	0	41
COc1cc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc(OC)c1OC	ZINC000450668882	FH	On-Demand	Anodyne	SLC22A3	0	42
COc1cc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc(OC)c1OC	ZINC000450668883	FH	On-Demand	Anodyne	N1L	0	41
COc1cc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc(OC)c1OC	ZINC000450668883	FH	On-Demand	Anodyne	SLC22A3	0	42
CCn1nnc(C)c1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450668886	DE	On-Demand	Bother	P2RX7	55	44
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450668888	GH	On-Demand	Anodyne	ACACA	50	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450668888	GH	On-Demand	Anodyne	ACACB	27	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450668888	GH	On-Demand	Anodyne	SCN9A	0	49
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450668888	GH	On-Demand	Anodyne	GPR88	0	44
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450668889	GH	On-Demand	Anodyne	ACACA	50	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450668889	GH	On-Demand	Anodyne	ACACB	27	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450668889	GH	On-Demand	Anodyne	SCN9A	0	49
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450668889	GH	On-Demand	Anodyne	GPR88	0	44
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450668890	GH	On-Demand	Anodyne	ACACA	50	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450668890	GH	On-Demand	Anodyne	ACACB	27	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450668890	GH	On-Demand	Anodyne	SCN9A	0	49
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450668890	GH	On-Demand	Anodyne	GPR88	0	44
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450668891	GH	On-Demand	Anodyne	ACACA	50	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450668891	GH	On-Demand	Anodyne	ACACB	27	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450668891	GH	On-Demand	Anodyne	SCN9A	0	49
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450668891	GH	On-Demand	Anodyne	GPR88	0	44
COC[C@@]1(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)CCOC1	ZINC000450668892	FD	On-Demand	Anodyne	ACACA	54	45
COC[C@@]1(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)CCOC1	ZINC000450668892	FD	On-Demand	Anodyne	ACACB	27	45
COC[C@]1(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)CCOC1	ZINC000450668893	FD	On-Demand	Anodyne	ACACA	54	45
COC[C@]1(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)CCOC1	ZINC000450668893	FD	On-Demand	Anodyne	ACACB	27	45
COC[C@]1(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)CCOC1	ZINC000450668894	FD	On-Demand	Anodyne	ACACA	54	45
COC[C@]1(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)CCOC1	ZINC000450668894	FD	On-Demand	Anodyne	ACACB	27	45
COC[C@@]1(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)CCOC1	ZINC000450668895	FD	On-Demand	Anodyne	ACACA	54	45
COC[C@@]1(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)CCOC1	ZINC000450668895	FD	On-Demand	Anodyne	ACACB	27	45
CC(C)(C)OC1CC(Sc2nnc(-c3ccccc3)n2Cc2ccco2)C1	ZINC000450668905	GK	On-Demand	Anodyne	HCRTR2	20	41
COc1cccc(OCCC(=O)N2CCN(C(=O)N(C)C)CC2(C)C)c1	ZINC000450668908	FE	On-Demand	Anodyne	MTNR1A	20	40
COc1cccc(OCCC(=O)N2CCN(C(=O)N(C)C)CC2(C)C)c1	ZINC000450668908	FE	On-Demand	Anodyne	MTNR1B	25	40
CCc1nc(C)c(CSc2nnc(-c3cccnc3)n2Cc2ccco2)o1	ZINC000450668909	GI	On-Demand	Anodyne	HCRTR2	0	42
CCOCc1nc(C)c(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)s1	ZINC000450668914	GG	On-Demand	Anodyne	ACACA	47	40
CCOCc1nc(C)c(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)s1	ZINC000450668914	GG	On-Demand	Anodyne	ACACB	26	40
CCOCc1nc(C)c(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)s1	ZINC000450668915	GG	On-Demand	Anodyne	ACACA	47	40
CCOCc1nc(C)c(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)s1	ZINC000450668915	GG	On-Demand	Anodyne	ACACB	26	40
OCC[C@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450668917	CD	On-Demand	Anodyne	MAN1B1	60	33
OCC[C@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450668917	CD	On-Demand	Anodyne	MAN1	0	41
CCC(CC)(CCSc1nnc(-c2cccs2)o1)C(=O)OC	ZINC000450668923	EI	On-Demand	Anodyne	ALOX15	40	33
OCC[C@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450668924	CD	On-Demand	Anodyne	MAN1B1	60	33
OCC[C@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450668924	CD	On-Demand	Anodyne	MAN1	0	41
OCC[C@@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450668925	CD	On-Demand	Anodyne	MAN1B1	60	33
OCC[C@@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450668925	CD	On-Demand	Anodyne	MAN1	0	41
OCC[C@@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450668926	CD	On-Demand	Anodyne	MAN1B1	60	33
OCC[C@@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450668926	CD	On-Demand	Anodyne	MAN1	0	41
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2cn(C)nc2C)cc1	ZINC000450668932	ED	On-Demand	Anodyne	ACACA	0	42
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2cn(C)nc2C)cc1	ZINC000450668932	ED	On-Demand	Anodyne	ACACB	28	42
CC(=O)NC[C@H](CC(=O)N1CCC[C@]1(C)Cc1ccccc1)CC(C)C	ZINC000450668933	FH	On-Demand	Anodyne	SLC12A5	72	39
CC(=O)NC[C@H](CC(=O)N1CCC[C@@]1(C)Cc1ccccc1)CC(C)C	ZINC000450668934	FH	On-Demand	Anodyne	SLC12A5	72	39
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2cn(C)nc2C)cc1	ZINC000450668936	ED	On-Demand	Anodyne	ACACA	0	42
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2cn(C)nc2C)cc1	ZINC000450668936	ED	On-Demand	Anodyne	ACACB	28	42
c1ccc(OC[C@@H]2CCCN2c2cc(N3CCSCC3)ncn2)cc1	ZINC000450668963	FG	On-Demand	Anodyne	CHRNA10	68	48
CCOC(=O)c1cccnc1N1CCC[C@H]1COc1ccccc1	ZINC000450668966	EG	On-Demand	Anodyne	P2RY12	43	36
CCOC(=O)c1cccnc1N1CCC[C@H]1COc1ccccc1	ZINC000450668966	EG	On-Demand	Anodyne	CASP3	47	35
CCOC(=O)c1cccnc1N1CCC[C@H]1COc1ccccc1	ZINC000450668966	EG	On-Demand	Anodyne	COLA	40	35
CCOC(=O)c1cccnc1N1CCC[C@H]1COc1ccccc1	ZINC000450668966	EG	On-Demand	Anodyne	CHRNA10	64	47
Cc1cc(N2CCC[C@H]2COc2ccccc2)nc(C)n1	ZINC000450668988	CG	On-Demand	Anodyne	CASP3	50	41
Cc1cc(N2CCC[C@H]2COc2ccccc2)nc(C)n1	ZINC000450668988	CG	On-Demand	Anodyne	CHRNA10	83	57
Cc1cc(N2CCC[C@H]2COc2ccccc2)nc(C)n1	ZINC000450668988	CG	On-Demand	Anodyne	CASP7	41	41
COC(=O)c1cccc(OCCC[C@H](C)O)c1	ZINC000450668989	BE	On-Demand	Anodyne	MTNR1B	28	40
COC(=O)c1cccc(OCCC[C@H](C)O)c1	ZINC000450668989	BE	On-Demand	Anodyne	PLA2G4B	27	42
COC(=O)c1cccc(OCCC[C@@H](C)O)c1	ZINC000450668990	BE	On-Demand	Anodyne	MTNR1B	28	40
COC(=O)c1cccc(OCCC[C@@H](C)O)c1	ZINC000450668990	BE	On-Demand	Anodyne	PLA2G4B	27	42
CCN(C)C(=O)[C@@H](Nc1nccc(-c2ccc(OC)cc2)n1)C(C)C	ZINC000450668993	EG	On-Demand	Anodyne	SMG1	56	32
c1ccc(OC[C@@H]2CCCN2c2nccc3occc23)cc1	ZINC000450669012	CH	On-Demand	Anodyne	CASP3	40	35
c1ccc(OC[C@@H]2CCCN2c2nccc3occc23)cc1	ZINC000450669012	CH	On-Demand	Anodyne	CHRNA10	81	50
COc1cccc(OCCC(=O)N[C@@H]2CNC(=O)C2)c1	ZINC000450669021	CC	On-Demand	Anodyne	MTNR1A	24	44
COc1cccc(OCCC(=O)N[C@H]2CNC(=O)C2)c1	ZINC000450669022	CC	On-Demand	Anodyne	MTNR1A	24	44
CC(=O)CCCCCSc1nnc(-c2cccs2)o1	ZINC000450669036	CI	On-Demand	Anodyne	ALOX15	26	46
CN(CCNC1(c2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000450669039	DG	On-Demand	Mild	TACR3	40	46
CC[C@H](CC(F)(F)F)C(=O)NCc1ncc(-c2cccs2)[nH]1	ZINC000450669042	EH	On-Demand	Anodyne	GPR142	50	33
CC[C@@H](CC(F)(F)F)C(=O)NCc1ncc(-c2cccs2)[nH]1	ZINC000450669043	EH	On-Demand	Anodyne	GPR142	50	33
Cn1cc(-c2ccc(C(=O)N[C@H](CCO)c3ccco3)o2)cn1	ZINC000450669054	DE	On-Demand	Anodyne	MMP13	17	41
Cn1cc(-c2ccc(C(=O)N[C@@H](CCO)c3ccco3)o2)cn1	ZINC000450669055	DE	On-Demand	Anodyne	MMP13	17	41
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1cccc2c1CCCC2	ZINC000450669069	EE	On-Demand	Anodyne	PREP	20	44
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1cccc2c1CCCC2	ZINC000450669070	EE	On-Demand	Anodyne	PREP	20	44
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1cccc2c1CCCC2	ZINC000450669071	EE	On-Demand	Anodyne	PREP	20	44
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1cccc2c1CCCC2	ZINC000450669072	EE	On-Demand	Anodyne	PREP	20	44
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450669074	FE	On-Demand	Anodyne	MTNR1A	15	40
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450669074	FE	On-Demand	Anodyne	MTNR1B	22	40
Cc1ccccc1CNc1ccccc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450669075	FJ	On-Demand	Anodyne	KCNQ2	44	33
CO[C@@H]1COC[C@@H]1N[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450669097	CD	On-Demand	Bother	CACNA1D	41	36
CO[C@@H]1COC[C@H]1N[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450669098	CD	On-Demand	Bother	CACNA1D	41	36
CO[C@@H]1COC[C@@H]1N[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450669100	CD	On-Demand	Bother	CACNA1D	41	36
CO[C@@H]1COC[C@H]1N[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450669102	CD	On-Demand	Bother	CACNA1D	41	36
C[C@H](NCC1=CCCCC1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450669103	DI	On-Demand	Anodyne	EPHX2	41	38
C[C@@H](NCC1=CCCCC1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450669104	DI	On-Demand	Anodyne	EPHX2	41	38
N#CC1(NC(=O)CCCC(=O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000450669137	FF	On-Demand	Mild	SIGMAR1	57	47
N#CC1(NC(=O)CCCC(=O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000450669137	FF	On-Demand	Mild	NPFFR1	60	39
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450669140	GF	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)c([N+](=O)[O-])c1	ZINC000450669141	GF	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@@H](C)NC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450669143	GF	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450669144	GF	On-Demand	Bother	TAAR1	20	45
CCC(CC)Oc1ccc(C(=O)N[C@@H](CCO)c2ccco2)cc1	ZINC000450669152	EH	On-Demand	Anodyne	UTS2	50	36
CCC(CC)Oc1ccc(C(=O)N[C@H](CCO)c2ccco2)cc1	ZINC000450669153	EH	On-Demand	Anodyne	UTS2	50	36
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2CCc3nnc(-c4cccc(C)c4)n3C2)C1	ZINC000450669178	GD	On-Demand	Anodyne	EPHX2	18	42
CNC(=O)N[C@H]1CCN(C(=O)[C@H]2CCc3nnc(-c4cccc(C)c4)n3C2)C1	ZINC000450669187	GD	On-Demand	Anodyne	EPHX2	18	42
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2CCc3nnc(-c4cccc(C)c4)n3C2)C1	ZINC000450669188	GD	On-Demand	Anodyne	EPHX2	18	42
CNC(=O)N[C@@H]1CCN(C(=O)[C@H]2CCc3nnc(-c4cccc(C)c4)n3C2)C1	ZINC000450669189	GD	On-Demand	Anodyne	EPHX2	18	42
CC(C)c1nccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)n1	ZINC000450669217	CG	On-Demand	Anodyne	SORD	121	49
CC(C)c1nccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)n1	ZINC000450669218	CG	On-Demand	Anodyne	SORD	121	49
CC(C)c1nccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)n1	ZINC000450669219	CG	On-Demand	Anodyne	SORD	121	49
CN(C)c1nccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)n1	ZINC000450669227	CE	On-Demand	Anodyne	SORD	44	38
CN(C)c1nccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)n1	ZINC000450669228	CE	On-Demand	Anodyne	SORD	44	38
CN(C)c1nccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)n1	ZINC000450669229	CE	On-Demand	Anodyne	SORD	44	38
Cc1onc(C2CC2)c1C(=O)N[C@H](CO)c1ccccc1	ZINC000450669230	CE	On-Demand	Anodyne	TACR3	58	38
O=C(c1cccnc1N1CCC[C@H]1COc1ccccc1)N1CCCCC1	ZINC000450669245	FH	On-Demand	Anodyne	CASP3	49	37
O=C(c1cccnc1N1CCC[C@H]1COc1ccccc1)N1CCCCC1	ZINC000450669245	FH	On-Demand	Anodyne	COLA	67	39
O=C(c1cccnc1N1CCC[C@H]1COc1ccccc1)N1CCCCC1	ZINC000450669245	FH	On-Demand	Anodyne	CPT1A	68	39
O=C(c1cccnc1N1CCC[C@H]1COc1ccccc1)N1CCCCC1	ZINC000450669245	FH	On-Demand	Anodyne	CHRNA10	63	46
O=C(c1cccnc1N1CCC[C@H]1COc1ccccc1)N1CCCCC1	ZINC000450669245	FH	On-Demand	Anodyne	NR1D1	28	40
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669249	EG	On-Demand	Anodyne	ACACA	42	39
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669249	EG	On-Demand	Anodyne	FFAR1	26	49
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669250	EG	On-Demand	Anodyne	ACACA	42	39
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669250	EG	On-Demand	Anodyne	FFAR1	26	49
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669251	EG	On-Demand	Anodyne	ACACA	42	39
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669251	EG	On-Demand	Anodyne	FFAR1	26	49
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669252	EG	On-Demand	Anodyne	ACACA	42	39
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669252	EG	On-Demand	Anodyne	FFAR1	26	49
CCN(C)C(=O)[C@@H](Nc1ccc(S(N)(=O)=O)cn1)C(C)C	ZINC000450669253	DC	On-Demand	Anodyne	CA2	26	41
CCN(C)C(=O)[C@@H](Nc1ccc(S(N)(=O)=O)cn1)C(C)C	ZINC000450669253	DC	On-Demand	Anodyne	CA4	23	41
CC(C)(C)C(=O)CCCC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669271	EH	On-Demand	Bother	P2RX7	45	38
Ic1cccc(OCc2cn(CC3CC3)nn2)c1	ZINC000450669277	FF	On-Demand	Anodyne	MAL12	0	40
Cc1nc(C2CC2)ccc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669280	EH	On-Demand	Bother	P2RX7	58	37
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cc2n(n1)CCC2	ZINC000450669286	DE	On-Demand	Bother	P2RX7	49	36
Cc1occc1-c1nnc(SCC2CC(F)(F)C2)n1Cc1ccccc1	ZINC000450669291	GK	On-Demand	Anodyne	HCRTR2	23	49
COc1ccc([C@H](CCO)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450669292	EF	On-Demand	Anodyne	GPR88	0	48
C[C@@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)C1CC1	ZINC000450669293	FI	On-Demand	Anodyne	NPBWR1	44	37
COc1ccc([C@H](CCO)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450669294	EF	On-Demand	Anodyne	GPR88	0	48
COc1ccc([C@H](CCO)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450669295	EF	On-Demand	Anodyne	GPR88	0	48
COc1ccc([C@H](CCO)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450669296	EF	On-Demand	Anodyne	GPR88	0	48
CCN(C)C(=O)[C@@H](Nc1nn2c(C)nnc2c2ccccc12)C(C)C	ZINC000450669301	ED	On-Demand	Anodyne	BRD9	51	36
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(C)c(Cl)c2Cl)cc1	ZINC000450669306	GI	On-Demand	Anodyne	ACACA	58	39
Cc1cc(C(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)nn1C(C)C	ZINC000450669307	GI	On-Demand	Anodyne	TACR3	18	41
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(C)c(Cl)c2Cl)cc1	ZINC000450669310	GI	On-Demand	Anodyne	ACACA	58	39
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(C3CC3)nc2C)cc1	ZINC000450669312	FG	On-Demand	Anodyne	ACACA	49	37
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(C3CC3)nc2C)cc1	ZINC000450669314	FG	On-Demand	Anodyne	ACACA	49	37
Cc1cnc(CCCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)o1	ZINC000450669322	EG	On-Demand	Bother	P2RX7	39	40
CC(C)[C@@H](NC[C@H]1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000450669346	EH	On-Demand	Anodyne	TACR1	34	41
CC(C)[C@H](NC[C@H]1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000450669347	EH	On-Demand	Anodyne	TACR1	34	41
CC(C)[C@H](NC[C@@H]1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000450669348	EH	On-Demand	Anodyne	TACR1	34	41
CC(C)[C@@H](NC[C@@H]1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000450669349	EH	On-Demand	Anodyne	TACR1	34	41
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C1(C(F)(F)F)CCC1	ZINC000450669360	EH	On-Demand	Bother	P2RX7	36	43
Cc1nc(C)c(F)c(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450669361	DG	On-Demand	Anodyne	CHRNA10	74	53
FC1(F)CCC[C@H]1CSc1nnc(-c2cccnc2)n1Cc1ccco1	ZINC000450669362	GJ	On-Demand	Anodyne	HCRTR2	17	42
FC1(F)CCC[C@@H]1CSc1nnc(-c2cccnc2)n1Cc1ccco1	ZINC000450669363	GJ	On-Demand	Anodyne	HCRTR2	17	42
Cc1nc(C(C)C)oc1CSc1nnc(-c2ccccc2)n1Cc1ccco1	ZINC000450669364	GK	On-Demand	Anodyne	HCRTR2	20	42
CC[C@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450669365	CG	On-Demand	Anodyne	PREP	35	52
CC[C@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450669365	CG	On-Demand	Anodyne	CFTR	46	31
CC[C@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450669365	CG	On-Demand	Anodyne	ADAM9	57	35
CC[C@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450669365	CG	On-Demand	Anodyne	NR1D1	37	41
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450669366	CG	On-Demand	Anodyne	PREP	35	52
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450669366	CG	On-Demand	Anodyne	CFTR	46	31
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450669366	CG	On-Demand	Anodyne	ADAM9	57	35
CC[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)C1CC1	ZINC000450669366	CG	On-Demand	Anodyne	NR1D1	37	41
O=C(NCc1ccccc1)c1ccccc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450669370	EH	On-Demand	Anodyne	KCNA3	40	40
O=C(NCc1ccccc1)c1ccccc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450669370	EH	On-Demand	Anodyne	HCN1	53	35
O=C(NCc1ccccc1)c1ccccc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450669370	EH	On-Demand	Anodyne	HCN4	42	32
O=C(NCc1ccccc1)c1ccccc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450669373	EH	On-Demand	Anodyne	KCNA3	40	40
O=C(NCc1ccccc1)c1ccccc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450669373	EH	On-Demand	Anodyne	HCN1	53	35
O=C(NCc1ccccc1)c1ccccc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450669373	EH	On-Demand	Anodyne	HCN4	42	32
CCN(C)C(=O)[C@@H](Nc1ncnc2c(OC)cc(OC)cc12)C(C)C	ZINC000450669375	EF	On-Demand	Anodyne	PDE6A	44	35
COc1cc([C@@H](C)NCC/C=C\c2ccccc2)cc(OC)c1OC	ZINC000450669376	EI	On-Demand	Anodyne	N1L	0	40
COc1cc([C@H](C)NCC/C=C\c2ccccc2)cc(OC)c1OC	ZINC000450669378	EI	On-Demand	Anodyne	N1L	0	40
COc1cc([C@@H](C)NCC/C=C/c2ccccc2)cc(OC)c1OC	ZINC000450669379	EI	On-Demand	Anodyne	N1L	0	40
COc1cc([C@H](C)NCC/C=C/c2ccccc2)cc(OC)c1OC	ZINC000450669380	EI	On-Demand	Anodyne	N1L	0	40
C[C@H](N[C@@H](C)c1csnn1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669382	FJ	On-Demand	Anodyne	ACE2	15	41
C[C@H](N[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1)c1csnn1	ZINC000450669387	FJ	On-Demand	Anodyne	ACE2	15	41
COc1ccc([C@H](C)NC[C@](C)(O)C(C)=O)cc1	ZINC000450669388	CD	On-Demand	Anodyne	ACACA	49	38
COc1ccc([C@H](C)NC[C@](C)(O)C(C)=O)cc1	ZINC000450669388	CD	On-Demand	Anodyne	ACACB	25	40
C[C@H](N[C@H](C)c1csnn1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669389	FJ	On-Demand	Anodyne	ACE2	15	41
COc1ccc([C@H](C)NC[C@@](C)(O)C(C)=O)cc1	ZINC000450669390	CD	On-Demand	Anodyne	ACACA	49	38
COc1ccc([C@H](C)NC[C@@](C)(O)C(C)=O)cc1	ZINC000450669390	CD	On-Demand	Anodyne	ACACB	25	40
C[C@@H](N[C@H](C)c1csnn1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000450669391	FJ	On-Demand	Anodyne	ACE2	15	41
COc1ccc([C@@H](C)NC[C@@](C)(O)C(C)=O)cc1	ZINC000450669392	CD	On-Demand	Anodyne	ACACA	49	38
COc1ccc([C@@H](C)NC[C@@](C)(O)C(C)=O)cc1	ZINC000450669392	CD	On-Demand	Anodyne	ACACB	25	40
COc1ccc([C@@H](C)NC[C@](C)(O)C(C)=O)cc1	ZINC000450669393	CD	On-Demand	Anodyne	ACACA	49	38
COc1ccc([C@@H](C)NC[C@](C)(O)C(C)=O)cc1	ZINC000450669393	CD	On-Demand	Anodyne	ACACB	25	40
c1ccc(OC[C@@H]2CCCN2c2cc(N3CCCC3)ncn2)cc1	ZINC000450669394	DG	On-Demand	Anodyne	CASP3	46	42
c1ccc(OC[C@@H]2CCCN2c2cc(N3CCCC3)ncn2)cc1	ZINC000450669394	DG	On-Demand	Anodyne	PRCP	15	40
c1ccc(OC[C@@H]2CCCN2c2cc(N3CCCC3)ncn2)cc1	ZINC000450669394	DG	On-Demand	Anodyne	CHRNA10	78	52
c1ccc(OC[C@@H]2CCCN2c2cc(N3CCCC3)ncn2)cc1	ZINC000450669394	DG	On-Demand	Anodyne	CASP7	38	42
C[C@@H]1C[C@]1(C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669395	CE	On-Demand	Mild	P2RX7	35	41
C[C@@H]1C[C@]1(C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669395	CE	On-Demand	Mild	CACNA1D	55	33
C[C@H]1C[C@]1(C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669396	CE	On-Demand	Mild	P2RX7	35	41
C[C@H]1C[C@]1(C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669396	CE	On-Demand	Mild	CACNA1D	55	33
C[C@@H]1C[C@@]1(C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669397	CE	On-Demand	Mild	P2RX7	35	41
C[C@@H]1C[C@@]1(C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669397	CE	On-Demand	Mild	CACNA1D	55	33
C[C@H]1C[C@@]1(C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669398	CE	On-Demand	Mild	P2RX7	35	41
C[C@H]1C[C@@]1(C#N)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669398	CE	On-Demand	Mild	CACNA1D	55	33
Cc1nnc(S[C@@H](C)C(=O)C2CCCCC2)n1Cc1ccccc1	ZINC000450669402	EI	On-Demand	Anodyne	SIGMAR1	20	40
Cc1nnc(S[C@@H](C)C(=O)C2CCCCC2)n1Cc1ccccc1	ZINC000450669402	EI	On-Demand	Anodyne	CCR5	22	41
Cc1nnc(S[C@H](C)C(=O)C2CCCCC2)n1Cc1ccccc1	ZINC000450669408	EI	On-Demand	Anodyne	SIGMAR1	20	40
Cc1nnc(S[C@H](C)C(=O)C2CCCCC2)n1Cc1ccccc1	ZINC000450669408	EI	On-Demand	Anodyne	CCR5	22	41
N#Cc1cc2c(nc1N1CCC[C@H]1COc1ccccc1)CCC2	ZINC000450669430	DG	On-Demand	Mild	CHRNA10	63	44
Cc1c(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)nn2c1OCCC2	ZINC000450669431	EG	On-Demand	Anodyne	SLC12A5	69	37
Cc1c(C(=O)N2CCC[C@]2(C)Cc2ccccc2)nn2c1OCCC2	ZINC000450669432	EG	On-Demand	Anodyne	SLC12A5	69	37
Cc1cccc(CNC2(c3cccc(C#N)c3)CC2)n1	ZINC000450669444	CG	On-Demand	Mild	GRM5	28	43
Cc1nc(C)n(CCCC(=O)NCc2ncc(-c3cccs3)[nH]2)n1	ZINC000450669451	EE	On-Demand	Anodyne	GPR142	43	35
C=C(C)CN(C)C(=O)CCOc1cccc(OC)c1	ZINC000450669454	CE	On-Demand	Mild	MTNR1A	35	52
C=C(C)CN(C)C(=O)CCOc1cccc(OC)c1	ZINC000450669454	CE	On-Demand	Mild	MTNR1B	36	44
CCC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669460	FH	On-Demand	Mild	SIGMAR1	47	40
CCC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669460	FH	On-Demand	Mild	CTSB	37	40
CCC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669460	FH	On-Demand	Mild	CTSK	29	46
CCC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669460	FH	On-Demand	Mild	CTSS	21	40
CCC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669460	FH	On-Demand	Mild	NPFFR1	58	39
CCC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669461	FH	On-Demand	Mild	SIGMAR1	47	40
CCC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669461	FH	On-Demand	Mild	CTSB	37	40
CCC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669461	FH	On-Demand	Mild	CTSK	29	46
CCC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669461	FH	On-Demand	Mild	CTSS	21	40
CCC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669461	FH	On-Demand	Mild	NPFFR1	58	39
CCC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669462	FH	On-Demand	Mild	SIGMAR1	47	40
CCC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669462	FH	On-Demand	Mild	CTSB	37	40
CCC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669462	FH	On-Demand	Mild	CTSK	29	46
CCC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669462	FH	On-Demand	Mild	CTSS	21	40
CCC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669462	FH	On-Demand	Mild	NPFFR1	58	39
CCC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669463	FH	On-Demand	Mild	SIGMAR1	47	40
CCC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669463	FH	On-Demand	Mild	CTSB	37	40
CCC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669463	FH	On-Demand	Mild	CTSK	29	46
CCC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669463	FH	On-Demand	Mild	CTSS	21	40
CCC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669463	FH	On-Demand	Mild	NPFFR1	58	39
CC(C)(C)C(=O)CCCC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669464	FG	On-Demand	Mild	SIGMAR1	45	40
CC(C)(C)C(=O)CCCC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450669464	FG	On-Demand	Mild	NPFFR1	60	39
CNC(=O)[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)C	ZINC000450669485	FD	On-Demand	Anodyne	NQO2	24	41
CNC(=O)[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)C	ZINC000450669485	FD	On-Demand	Anodyne	MTNR1A	63	42
CNC(=O)[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)C	ZINC000450669485	FD	On-Demand	Anodyne	MTNR1B	49	39
CNC(=O)[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)C	ZINC000450669486	FD	On-Demand	Anodyne	NQO2	24	41
CNC(=O)[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)C	ZINC000450669486	FD	On-Demand	Anodyne	MTNR1A	63	42
CNC(=O)[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)C	ZINC000450669486	FD	On-Demand	Anodyne	MTNR1B	49	39
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450669498	FD	On-Demand	Anodyne	THYX_PBCV1	0	44
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450669499	FD	On-Demand	Anodyne	THYX_PBCV1	0	44
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450669500	FD	On-Demand	Anodyne	THYX_PBCV1	0	44
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450669501	FD	On-Demand	Anodyne	THYX_PBCV1	0	44
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669505	GI	On-Demand	Anodyne	PRNP	60	37
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669505	GI	On-Demand	Anodyne	ROCK2	0	48
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669505	GI	On-Demand	Anodyne	NAMPT	17	41
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669505	GI	On-Demand	Anodyne	KCNK3	57	46
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669506	GI	On-Demand	Anodyne	PRNP	60	37
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669506	GI	On-Demand	Anodyne	ROCK2	0	48
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669506	GI	On-Demand	Anodyne	NAMPT	17	41
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669506	GI	On-Demand	Anodyne	KCNK3	57	46
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669507	GI	On-Demand	Anodyne	PRNP	60	37
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669507	GI	On-Demand	Anodyne	ROCK2	0	48
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669507	GI	On-Demand	Anodyne	NAMPT	17	41
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669507	GI	On-Demand	Anodyne	KCNK3	57	46
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669508	GI	On-Demand	Anodyne	PRNP	60	37
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669508	GI	On-Demand	Anodyne	ROCK2	0	48
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669508	GI	On-Demand	Anodyne	NAMPT	17	41
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450669508	GI	On-Demand	Anodyne	KCNK3	57	46
CCOc1cccc([C@@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450669544	CE	On-Demand	Anodyne	ACACA	0	46
CCOc1cccc([C@@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450669544	CE	On-Demand	Anodyne	PDS	75	43
CCOc1cccc([C@@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450669545	CE	On-Demand	Anodyne	ACACA	0	46
CCOc1cccc([C@@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450669545	CE	On-Demand	Anodyne	PDS	75	43
CCOc1cccc([C@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450669546	CE	On-Demand	Anodyne	ACACA	0	46
CCOc1cccc([C@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450669546	CE	On-Demand	Anodyne	PDS	75	43
CCOc1cccc([C@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450669547	CE	On-Demand	Anodyne	ACACA	0	46
CCOc1cccc([C@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450669547	CE	On-Demand	Anodyne	PDS	75	43
CNC(=O)N[C@H]1CCN(C(=O)C(CC(C)C)CC(C)C)C1	ZINC000450669559	CE	On-Demand	Anodyne	EPHX2	18	43
CNC(=O)N[C@@H]1CCN(C(=O)C(CC(C)C)CC(C)C)C1	ZINC000450669560	CE	On-Demand	Anodyne	EPHX2	18	43
O=C(NC1CC1)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450669570	FG	On-Demand	Bother	TAAR1	15	42
O=C(NC1CC1)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)c([N+](=O)[O-])c1	ZINC000450669571	FG	On-Demand	Bother	TAAR1	15	42
O=C(NC1CC1)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450669572	FG	On-Demand	Bother	TAAR1	15	42
C[C@@H](NCC[C@H]1CCOC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450669606	FI	On-Demand	Anodyne	CXCR2	0	42
C[C@H](NCC[C@H]1CCOC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450669607	FI	On-Demand	Anodyne	CXCR2	0	42
C[C@@H](NCC[C@@H]1CCOC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450669608	FI	On-Demand	Anodyne	CXCR2	0	42
C[C@H](NCC[C@@H]1CCOC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450669609	FI	On-Demand	Anodyne	CXCR2	0	42
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000450669610	DD	On-Demand	Anodyne	EPHX2	27	44
CCN(C)C(=O)[C@@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450669611	FF	On-Demand	Bother	TAAR1	17	46
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450669618	ED	On-Demand	Anodyne	EPHX2	24	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450669619	ED	On-Demand	Anodyne	EPHX2	24	42
CCOC(=O)c1sc2ncn(C[C@H](Cc3ccccc3)OC)c(=O)c2c1C	ZINC000450669627	GG	On-Demand	Anodyne	CTRC	42	33
CCOC(=O)c1sc2ncn(C[C@@H](Cc3ccccc3)OC)c(=O)c2c1C	ZINC000450669628	GG	On-Demand	Anodyne	CTRC	42	33
C[C@@H](NC[C@@H]1CCNC(=O)CC1)c1ccccc1OCc1ccccc1	ZINC000450669646	FH	On-Demand	Anodyne	PPIA	40	30
C[C@@H](NC[C@H]1CCNC(=O)CC1)c1ccccc1OCc1ccccc1	ZINC000450669647	FH	On-Demand	Anodyne	PPIA	40	30
CCC[C@@H](OC)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450669655	CG	On-Demand	Anodyne	SLC12A5	85	44
CCC[C@H](OC)C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450669657	CG	On-Demand	Anodyne	SLC12A5	85	44
CCC[C@@H](OC)C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450669658	CG	On-Demand	Anodyne	SLC12A5	85	44
CCC[C@H](OC)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450669660	CG	On-Demand	Anodyne	SLC12A5	85	44
CCc1cccc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)n1	ZINC000450669673	DH	On-Demand	Anodyne	SLC12A5	75	41
CCc1cccc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)n1	ZINC000450669674	DH	On-Demand	Anodyne	SLC12A5	75	41
CCOC(=O)CSc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450669685	FG	On-Demand	Anodyne	COLA	63	37
CCOC(=O)CSc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450669685	FG	On-Demand	Anodyne	CPT1A	65	33
CCOC(=O)CSc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450669685	FG	On-Demand	Anodyne	CHRNA10	50	42
CCOc1cc(NC2CCN(C(=O)Cc3cc(C)ccc3F)CC2)ncn1	ZINC000450669689	FF	On-Demand	Anodyne	GPR119	23	41
Cn1c(C#N)ccc1C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450669700	DG	On-Demand	Mild	SLC12A5	75	42
Cn1c(C#N)ccc1C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450669701	DG	On-Demand	Mild	SLC12A5	75	42
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)cn1	ZINC000450669710	GI	On-Demand	Anodyne	SLC12A5	65	37
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)cn1	ZINC000450669711	GI	On-Demand	Anodyne	SLC12A5	65	37
Oc1nncc(N2CCC[C@H]2COc2ccccc2)c1Cl	ZINC000450669719	DF	On-Demand	Anodyne	CHRNA10	67	48
Oc1nncc(N2CCC[C@H]2COc2ccccc2)c1Cl	ZINC000450669719	DF	On-Demand	Anodyne	CASP7	52	41
CC[C@H]1CCC[C@@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450669731	FG	On-Demand	Anodyne	MMP8	22	41
CC[C@H]1CCC[C@@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450669731	FG	On-Demand	Anodyne	MMP1	30	44
CC[C@@H]1CCC[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450669732	FG	On-Demand	Anodyne	MMP8	22	41
CC[C@@H]1CCC[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450669732	FG	On-Demand	Anodyne	MMP1	30	44
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450669733	FG	On-Demand	Anodyne	MMP8	22	41
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450669733	FG	On-Demand	Anodyne	MMP1	30	44
CC[C@H]1CCC[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450669734	FG	On-Demand	Anodyne	MMP8	22	41
CC[C@H]1CCC[C@H]1C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450669734	FG	On-Demand	Anodyne	MMP1	30	44
COC(=O)c1csc(CN[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450669735	GJ	On-Demand	Anodyne	CYP26A1	24	43
COC(=O)c1csc(CN[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450669735	GJ	On-Demand	Anodyne	FFAR1	39	44
COC(=O)c1csc(CN[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450669736	GJ	On-Demand	Anodyne	CYP26A1	24	43
COC(=O)c1csc(CN[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450669736	GJ	On-Demand	Anodyne	FFAR1	39	44
C[C@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669744	FH	On-Demand	Anodyne	MCHR1	17	40
C[C@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669744	FH	On-Demand	Anodyne	TNKS	47	38
C[C@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669744	FH	On-Demand	Anodyne	TRAR	30	45
C[C@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669744	FH	On-Demand	Anodyne	LUXN	0	43
C[C@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669744	FH	On-Demand	Anodyne	ADIPOR1	0	43
C[C@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669744	FH	On-Demand	Anodyne	ADIPOR2	0	43
C[C@@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669745	FH	On-Demand	Anodyne	MCHR1	17	40
C[C@@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669745	FH	On-Demand	Anodyne	TNKS	47	38
C[C@@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669745	FH	On-Demand	Anodyne	TRAR	30	45
C[C@@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669745	FH	On-Demand	Anodyne	LUXN	0	43
C[C@@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669745	FH	On-Demand	Anodyne	ADIPOR1	0	43
C[C@@H](NCCc1ccc(Cl)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450669745	FH	On-Demand	Anodyne	ADIPOR2	0	43
CC(C)(CC(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1)C1CC1	ZINC000450669748	GI	On-Demand	Anodyne	HCRTR2	22	43
CCOCc1nc(C)c(C(=O)N2Cc3ccccc3C[C@@H]2CC)s1	ZINC000450669757	EH	On-Demand	Anodyne	OPRD1	54	35
CCOCc1nc(C)c(C(=O)N2Cc3ccccc3C[C@@H]2CC)s1	ZINC000450669757	EH	On-Demand	Anodyne	ADAM9	50	33
CCOCc1nc(C)c(C(=O)N2Cc3ccccc3C[C@@H]2CC)s1	ZINC000450669757	EH	On-Demand	Anodyne	NR1D1	41	44
CCOCc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2CC)s1	ZINC000450669758	EH	On-Demand	Anodyne	OPRD1	54	35
CCOCc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2CC)s1	ZINC000450669758	EH	On-Demand	Anodyne	ADAM9	50	33
CCOCc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2CC)s1	ZINC000450669758	EH	On-Demand	Anodyne	NR1D1	41	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2cccs2)[nH]1	ZINC000450669781	GG	On-Demand	Anodyne	ANPEP	25	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1ncc(-c2cccs2)[nH]1	ZINC000450669781	GG	On-Demand	Anodyne	HPN	54	30
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCCC1(F)F	ZINC000450669788	EH	On-Demand	Bother	P2RX7	52	41
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCCC1(F)F	ZINC000450669788	EH	On-Demand	Bother	CACNA1D	58	33
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCCC1(F)F	ZINC000450669790	EH	On-Demand	Bother	P2RX7	52	41
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCCC1(F)F	ZINC000450669790	EH	On-Demand	Bother	CACNA1D	58	33
Ic1cccc2ncnc(NC[C@H]3CCCO3)c12	ZINC000450669797	FE	On-Demand	Anodyne	TNK2	82	56
COc1cccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450669807	CH	On-Demand	Anodyne	CASR	25	56
COc1cccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450669807	CH	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450669807	CH	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450669807	CH	On-Demand	Anodyne	AOC3	17	51
COc1cccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450669807	CH	On-Demand	Anodyne	PHES	0	43
COc1cccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669808	CH	On-Demand	Anodyne	CASR	25	56
COc1cccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669808	CH	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669808	CH	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669808	CH	On-Demand	Anodyne	AOC3	17	51
COc1cccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669808	CH	On-Demand	Anodyne	PHES	0	43
COc1cccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450669809	CH	On-Demand	Anodyne	CASR	25	56
COc1cccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450669809	CH	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450669809	CH	On-Demand	Anodyne	PHES	0	43
COc1cccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669810	CH	On-Demand	Anodyne	CASR	25	56
COc1cccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669810	CH	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669810	CH	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669810	CH	On-Demand	Anodyne	AOC3	17	51
COc1cccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450669810	CH	On-Demand	Anodyne	PHES	0	43
C[C@@H](NCc1ccccc1OC1CC1)c1ccc(F)cc1F	ZINC000450669813	DI	On-Demand	Anodyne	SLC5A4	61	36
C[C@H](NCc1ccccc1OC1CC1)c1ccc(F)cc1F	ZINC000450669815	DI	On-Demand	Anodyne	SLC5A4	61	36
Cc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ncc1C(N)=O	ZINC000450669816	GD	On-Demand	Mild	SIGMAR1	34	42
Cc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ncc1C(N)=O	ZINC000450669816	GD	On-Demand	Mild	NPFFR2	41	38
Cc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ncc1C(N)=O	ZINC000450669816	GD	On-Demand	Mild	NPFFR1	62	38
c1ccc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450669821	FI	On-Demand	Anodyne	HCRTR2	19	41
c1ccc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450669823	FI	On-Demand	Anodyne	HCRTR2	19	41
CC(C)CCCC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669828	CH	On-Demand	Bother	P2RX7	51	41
CC[C@H]1CCC[C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669839	DH	On-Demand	Bother	P2RX7	40	41
O=C(N1CCO[C@@]2(CCOC2)C1)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450669840	GF	On-Demand	Anodyne	EPHX2	18	46
CC[C@H]1CCC[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669841	DH	On-Demand	Bother	P2RX7	40	41
CC[C@@H]1CCC[C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669842	DH	On-Demand	Bother	P2RX7	40	41
O=C(N1CCO[C@@]2(CCOC2)C1)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450669843	GF	On-Demand	Anodyne	EPHX2	18	46
CC[C@@H]1CCC[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450669844	DH	On-Demand	Bother	P2RX7	54	42
O=C(N1CCO[C@]2(CCOC2)C1)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450669845	GF	On-Demand	Anodyne	EPHX2	18	46
O=C(N1CCO[C@]2(CCOC2)C1)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450669847	GF	On-Demand	Anodyne	EPHX2	18	46
COc1cccc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669856	FG	On-Demand	Anodyne	CASR	17	51
COc1cccc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669856	FG	On-Demand	Anodyne	HTR7	15	40
COc1cccc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669856	FG	On-Demand	Anodyne	NQO2	22	42
COc1cccc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669856	FG	On-Demand	Anodyne	MTNR1A	78	47
COc1cccc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669856	FG	On-Demand	Anodyne	MTNR1B	67	39
COc1cccc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669857	FG	On-Demand	Anodyne	CASR	17	51
COc1cccc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669857	FG	On-Demand	Anodyne	HTR7	15	40
COc1cccc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669857	FG	On-Demand	Anodyne	NQO2	22	42
COc1cccc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669857	FG	On-Demand	Anodyne	MTNR1A	78	47
COc1cccc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450669857	FG	On-Demand	Anodyne	MTNR1B	67	39
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450669860	EH	On-Demand	Anodyne	OPRM1	0	41
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450669860	EH	On-Demand	Anodyne	OPRD1	35	41
CC[C@H]1Cc2ccccc2CN1C(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450669861	EH	On-Demand	Anodyne	OPRM1	0	41
CC[C@H]1Cc2ccccc2CN1C(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450669861	EH	On-Demand	Anodyne	OPRD1	35	41
CCOC(=O)c1ccc(CSc2nnc(C3CC3)n2Cc2ccccc2)nc1	ZINC000450669865	GI	On-Demand	Anodyne	PLA2G2A	45	35
N#CC[C@@H]1CC[C@H](Nc2nc(-c3ccc(F)cc3)cs2)C1	ZINC000450669866	DH	On-Demand	Mild	MAOB	32	44
N#CC[C@@H]1CC[C@H](Nc2nc(-c3ccc(F)cc3)cs2)C1	ZINC000450669866	DH	On-Demand	Mild	SPHK1	21	41
N#CC[C@@H]1CC[C@H](Nc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450669884	DG	On-Demand	Mild	DHOD	0	44
COc1cc2c(cc1F)CN(C(=O)C1(Cc3ccccc3)CCOCC1)CC2	ZINC000450669887	GH	On-Demand	Anodyne	ABCB1	23	43
COc1cc2c(cc1F)CN(C(=O)C1(Cc3ccccc3)CCOCC1)CC2	ZINC000450669887	GH	On-Demand	Anodyne	HCRTR2	17	47
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450669900	FD	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450669901	FD	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450669902	FD	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450669903	FD	On-Demand	Anodyne	PREP	17	42
N#CC[C@@H]1CC[C@H](Nc2ncnc3ccc(I)cc23)C1	ZINC000450669908	GH	On-Demand	Mild	CD38	53	44
COC(=O)C1(CN[C@@H](COCc2ccccc2)c2ccccc2)CC1	ZINC000450669921	EG	On-Demand	Anodyne	MAN2A1	0	40
COC(=O)C1(CN[C@@H](COCc2ccccc2)c2ccccc2)CC1	ZINC000450669921	EG	On-Demand	Anodyne	MAN1B1	53	47
COC(=O)C1(CN[C@@H](COCc2ccccc2)c2ccccc2)CC1	ZINC000450669921	EG	On-Demand	Anodyne	MAN1	0	40
COC(=O)C1(CN[C@@H](COCc2ccccc2)c2ccccc2)CC1	ZINC000450669921	EG	On-Demand	Anodyne	SLC12A5	51	36
COC(=O)C1(CN[C@H](COCc2ccccc2)c2ccccc2)CC1	ZINC000450669922	EG	On-Demand	Anodyne	MAN2A1	0	40
COC(=O)C1(CN[C@H](COCc2ccccc2)c2ccccc2)CC1	ZINC000450669922	EG	On-Demand	Anodyne	MAN1B1	53	47
COC(=O)C1(CN[C@H](COCc2ccccc2)c2ccccc2)CC1	ZINC000450669922	EG	On-Demand	Anodyne	MAN1	0	40
COC(=O)C1(CN[C@H](COCc2ccccc2)c2ccccc2)CC1	ZINC000450669922	EG	On-Demand	Anodyne	SLC12A5	51	36
N#CC[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450669924	FI	On-Demand	Mild	GRM5	20	41
N#CC[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450669924	FI	On-Demand	Mild	TYK2	67	36
CCOC(=O)c1cc(C(=O)N2CCC(Nc3cc(OCC)ncn3)CC2)on1	ZINC000450669944	GD	On-Demand	Anodyne	SSTR5	41	38
CCOc1cc(C(=O)NCc2c(C)oc3ccccc23)on1	ZINC000450669956	DG	On-Demand	Anodyne	THRA	0	45
CCOc1cc(C(=O)NCc2c(C)oc3ccccc23)on1	ZINC000450669956	DG	On-Demand	Anodyne	THRB	0	45
Cc1c([C@H](C)NC[C@H]2CCCC2(F)F)cnn1-c1ccc(F)cc1	ZINC000450669967	EI	On-Demand	Anodyne	NR3C1	42	38
Cc1c([C@H](C)NC[C@@H]2CCCC2(F)F)cnn1-c1ccc(F)cc1	ZINC000450669968	EI	On-Demand	Anodyne	NR3C1	42	38
Cc1c([C@@H](C)NC[C@@H]2CCCC2(F)F)cnn1-c1ccc(F)cc1	ZINC000450669969	EI	On-Demand	Anodyne	NR3C1	42	38
Cc1c([C@@H](C)NC[C@H]2CCCC2(F)F)cnn1-c1ccc(F)cc1	ZINC000450669970	EI	On-Demand	Anodyne	NR3C1	42	38
CCn1nnc(C)c1COc1ccc(C(=O)OC)cc1OC	ZINC000450669984	DD	On-Demand	Anodyne	ENPP1	47	31
CNC(=O)C1CN(C(=O)c2ccc(C)c(Cl)c2Cl)C1	ZINC000450669986	DE	On-Demand	Anodyne	P2RX7	17	40
Cn1cc(-c2ccc(C(=O)N3CCC[C@@]3(C)Cc3ccccc3)o2)cn1	ZINC000450669998	EH	On-Demand	Anodyne	SLC12A5	71	38
Cn1cc(-c2ccc(C(=O)N3CCC[C@]3(C)Cc3ccccc3)o2)cn1	ZINC000450670001	EH	On-Demand	Anodyne	SLC12A5	71	38
CCOC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450670008	DE	On-Demand	Anodyne	MAL12	0	40
CCOC(=O)c1ccc(OCc2c(C)nnn2CC)cc1	ZINC000450670020	CE	On-Demand	Anodyne	ACR	44	43
N#CC1(NC(=O)[C@@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670058	ED	On-Demand	Mild	DRD3	0	41
N#CC1(NC(=O)[C@@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670058	ED	On-Demand	Mild	SIGMAR1	67	47
N#CC1(NC(=O)[C@@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670058	ED	On-Demand	Mild	NPFFR2	40	38
N#CC1(NC(=O)[C@@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670058	ED	On-Demand	Mild	CTSS	47	38
N#CC1(NC(=O)[C@@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670058	ED	On-Demand	Mild	BIRC2	30	41
N#CC1(NC(=O)[C@@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670058	ED	On-Demand	Mild	NPFFR1	62	38
N#CC1(NC(=O)[C@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670064	ED	On-Demand	Mild	DRD3	0	41
N#CC1(NC(=O)[C@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670064	ED	On-Demand	Mild	SIGMAR1	67	47
N#CC1(NC(=O)[C@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670064	ED	On-Demand	Mild	NPFFR2	40	38
N#CC1(NC(=O)[C@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670064	ED	On-Demand	Mild	CTSS	47	38
N#CC1(NC(=O)[C@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670064	ED	On-Demand	Mild	BIRC2	30	41
N#CC1(NC(=O)[C@H](O)C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670064	ED	On-Demand	Mild	NPFFR1	62	38
CC[C@H](NC(=O)c1cccc2c1O[C@@H](C)C2)c1ncc[nH]1	ZINC000450670072	CF	On-Demand	Anodyne	G2YM83_BOTF4	46	36
CC[C@@H](NC(=O)c1cccc2c1O[C@@H](C)C2)c1ncc[nH]1	ZINC000450670075	CF	On-Demand	Anodyne	G2YM83_BOTF4	46	36
CC[C@H](NC(=O)c1cccc2c1O[C@H](C)C2)c1ncc[nH]1	ZINC000450670076	CF	On-Demand	Anodyne	G2YM83_BOTF4	46	36
CC[C@@H](NC(=O)c1cccc2c1O[C@H](C)C2)c1ncc[nH]1	ZINC000450670077	CF	On-Demand	Anodyne	G2YM83_BOTF4	46	36
Cc1ccn(CC(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)n1	ZINC000450670078	FF	On-Demand	Anodyne	CCR1	24	41
O=C(c1cnc(C2CC2)nc1)N1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450670079	GH	On-Demand	Anodyne	L3MBTL3	55	38
O=C(c1cnc(C2CC2)nc1)N1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450670079	GH	On-Demand	Anodyne	SLC6A7	0	41
CCn1nnc(C)c1COc1ccc(Cl)cc1Br	ZINC000450670089	EH	On-Demand	Anodyne	S1PR4	0	40
COCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450670094	FF	On-Demand	Anodyne	DRD4	40	31
COCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450670094	FF	On-Demand	Anodyne	GRIN2B	0	40
COCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450670094	FF	On-Demand	Anodyne	COLA	71	35
COCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450670094	FF	On-Demand	Anodyne	CPT1A	69	35
COCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450670094	FF	On-Demand	Anodyne	CHRNA10	64	46
COCCNC(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450670094	FF	On-Demand	Anodyne	ACKR3	60	36
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670097	DG	On-Demand	Anodyne	SDH1	0	45
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670097	DG	On-Demand	Anodyne	ACACA	31	54
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670097	DG	On-Demand	Anodyne	ACACB	36	48
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670098	DG	On-Demand	Anodyne	SDH1	0	45
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670098	DG	On-Demand	Anodyne	ACACA	31	54
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670098	DG	On-Demand	Anodyne	ACACB	36	48
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670101	DG	On-Demand	Anodyne	SDH1	0	45
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670101	DG	On-Demand	Anodyne	ACACA	31	54
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670101	DG	On-Demand	Anodyne	ACACB	36	48
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670102	DG	On-Demand	Anodyne	SDH1	0	45
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670102	DG	On-Demand	Anodyne	ACACA	31	54
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000450670102	DG	On-Demand	Anodyne	ACACB	36	48
N#CC1(NC(=O)c2cnn(-c3ccncc3)c2)CCN(Cc2ccccc2)CC1	ZINC000450670106	GF	On-Demand	Mild	SIGMAR1	30	40
N#CC1(NC(=O)c2cnn(-c3ccncc3)c2)CCN(Cc2ccccc2)CC1	ZINC000450670106	GF	On-Demand	Mild	NPFFR1	51	35
COc1cccc(-n2cc(C(=O)N3CCC[C@]3(C)Cc3ccccc3)nn2)c1	ZINC000450670108	GH	On-Demand	Anodyne	ESRRA	21	42
COc1cccc(-n2cc(C(=O)N3CCC[C@]3(C)Cc3ccccc3)nn2)c1	ZINC000450670108	GH	On-Demand	Anodyne	SLC12A5	68	40
COc1cccc(-n2cc(C(=O)N3CCC[C@@]3(C)Cc3ccccc3)nn2)c1	ZINC000450670109	GH	On-Demand	Anodyne	ESRRA	21	42
COc1cccc(-n2cc(C(=O)N3CCC[C@@]3(C)Cc3ccccc3)nn2)c1	ZINC000450670109	GH	On-Demand	Anodyne	SLC12A5	68	40
CC[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670120	DF	On-Demand	Anodyne	CAPN1	42	34
CC[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670120	DF	On-Demand	Anodyne	CAPN2	73	34
CC[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670120	DF	On-Demand	Anodyne	ACE2	45	34
CC[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670123	DF	On-Demand	Anodyne	CAPN1	42	34
CC[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670123	DF	On-Demand	Anodyne	CAPN2	73	34
CC[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670123	DF	On-Demand	Anodyne	ACE2	45	34
CC[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670127	DF	On-Demand	Anodyne	CAPN1	42	34
CC[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670127	DF	On-Demand	Anodyne	CAPN2	73	34
CC[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670127	DF	On-Demand	Anodyne	ACE2	45	34
CC[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670131	DF	On-Demand	Anodyne	CAPN1	42	34
CC[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670131	DF	On-Demand	Anodyne	CAPN2	73	34
CC[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ncc[nH]1	ZINC000450670131	DF	On-Demand	Anodyne	ACE2	45	34
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450670150	ED	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450670163	ED	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450670166	ED	On-Demand	Anodyne	AGTR2	0	40
COc1ccc([C@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)cc1OC	ZINC000450670167	FK	On-Demand	Anodyne	CASR	15	56
COc1ccc([C@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)cc1OC	ZINC000450670167	FK	On-Demand	Anodyne	MT-ND1	17	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450670168	ED	On-Demand	Anodyne	AGTR2	0	40
COc1ccc([C@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1OC	ZINC000450670169	FK	On-Demand	Anodyne	CASR	15	56
COc1ccc([C@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1OC	ZINC000450670169	FK	On-Demand	Anodyne	MT-ND1	17	40
COc1ccc([C@@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)cc1OC	ZINC000450670170	FK	On-Demand	Anodyne	CASR	15	56
COc1ccc([C@@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)cc1OC	ZINC000450670170	FK	On-Demand	Anodyne	MT-ND1	17	40
COc1ccc([C@@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1OC	ZINC000450670172	FK	On-Demand	Anodyne	CASR	15	56
COc1ccc([C@@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1OC	ZINC000450670172	FK	On-Demand	Anodyne	MT-ND1	17	40
CC[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ncc[nH]1	ZINC000450670192	EH	On-Demand	Anodyne	PRCP	16	40
CC[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ncc[nH]1	ZINC000450670192	EH	On-Demand	Anodyne	GPR88	0	40
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	DRD2	29	42
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	DRD4	43	42
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	ACHE	26	42
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	DRD3	28	41
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	SIGMAR1	62	48
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	NPFFR2	39	41
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	ADAM17	16	41
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	MCHR1	23	42
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	MCHR2	44	35
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	CCR8	44	42
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000450670193	GH	On-Demand	Mild	NPFFR1	61	42
N#CC1(NC(=O)c2ccsn2)CCN(Cc2ccccc2)CC1	ZINC000450670195	EE	On-Demand	Mild	SIGMAR1	45	39
N#CC1(NC(=O)c2ccsn2)CCN(Cc2ccccc2)CC1	ZINC000450670195	EE	On-Demand	Mild	NPFFR1	58	38
O=C(N[C@H](CO)c1ccccc1)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450670197	GH	On-Demand	Anodyne	MTTP	55	38
O=C(N[C@H](CO)c1ccccc1)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000450670198	GH	On-Demand	Anodyne	MTTP	55	38
CNC(=O)N[C@H]1CCN(C(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450670200	EE	On-Demand	Anodyne	EPHX2	23	42
CNC(=O)N[C@H]1CCN(C(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450670200	EE	On-Demand	Anodyne	CCR8	43	36
CNC(=O)N[C@@H]1CCN(C(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450670201	EE	On-Demand	Anodyne	EPHX2	23	42
CNC(=O)N[C@@H]1CCN(C(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450670201	EE	On-Demand	Anodyne	CCR8	43	36
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450670224	FG	On-Demand	Anodyne	ACACA	24	41
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450670224	FG	On-Demand	Anodyne	ACACB	30	43
CCCOc1ccc(C(=O)NCc2ncc(-c3cccs3)[nH]2)c(OC)c1	ZINC000450670227	FH	On-Demand	Anodyne	GPR142	42	33
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450670229	FG	On-Demand	Anodyne	ACACA	24	41
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450670229	FG	On-Demand	Anodyne	ACACB	30	43
C[C@@H](NC[C@@H]1COCCO1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450670237	ED	On-Demand	Anodyne	LUXN	0	41
C[C@@H](NC[C@H]1COCCO1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450670239	ED	On-Demand	Anodyne	LUXN	0	41
C[C@H](NC[C@H]1COCCO1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450670240	ED	On-Demand	Anodyne	LUXN	0	41
C[C@H](NC[C@@H]1COCCO1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450670241	ED	On-Demand	Anodyne	LUXN	0	41
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1	ZINC000450670254	GG	On-Demand	Anodyne	ACACA	45	44
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1	ZINC000450670254	GG	On-Demand	Anodyne	ACACB	26	44
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCCCN2C2CCCC2)cc1	ZINC000450670256	GG	On-Demand	Anodyne	ACACA	45	44
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H]2CCCCN2C2CCCC2)cc1	ZINC000450670256	GG	On-Demand	Anodyne	ACACB	26	44
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CCCCN2C2CCCC2)cc1	ZINC000450670258	GG	On-Demand	Anodyne	ACACA	45	44
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H]2CCCCN2C2CCCC2)cc1	ZINC000450670258	GG	On-Demand	Anodyne	ACACB	26	44
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1	ZINC000450670259	GG	On-Demand	Anodyne	ACACA	45	44
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1	ZINC000450670259	GG	On-Demand	Anodyne	ACACB	26	44
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cc3c([nH]2)CCCC3)cc1	ZINC000450670261	FF	On-Demand	Anodyne	ACACA	54	36
COC(=O)COc1ccc([C@H](C)NC(=O)c2cc3c([nH]2)CCCC3)cc1	ZINC000450670262	FF	On-Demand	Anodyne	ACACA	54	36
Cc1cc(NC(=O)[C@@H](O)C2CCC2)nn1-c1cccc(Cl)c1	ZINC000450670273	DE	On-Demand	Anodyne	NPY5R	15	45
Cc1cc(NC(=O)[C@H](O)C2CCC2)nn1-c1cccc(Cl)c1	ZINC000450670277	DE	On-Demand	Anodyne	NPY5R	15	45
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cn(CC3CC3)nn2)cc1	ZINC000450670285	FD	On-Demand	Anodyne	ACACA	49	36
COC(=O)COc1ccc([C@H](C)NC(=O)c2cn(CC3CC3)nn2)cc1	ZINC000450670287	FD	On-Demand	Anodyne	ACACA	49	36
O=C(Cc1sccc1Br)N[C@@H]1CCCOc2cc(F)ccc21	ZINC000450670292	GI	On-Demand	Anodyne	LUXR	47	33
O=C(Cc1sccc1Br)N[C@H]1CCCOc2cc(F)ccc21	ZINC000450670293	GI	On-Demand	Anodyne	LUXR	47	33
CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450670294	FG	On-Demand	Anodyne	BCL2	27	42
CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450670294	FG	On-Demand	Anodyne	NR1D1	39	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCO[C@@]2(CCOC2)C1	ZINC000450670296	EF	On-Demand	Anodyne	CACNA1B	35	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCO[C@@]2(CCOC2)C1	ZINC000450670296	EF	On-Demand	Anodyne	EPHX2	16	49
CC[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450670297	FG	On-Demand	Anodyne	BCL2	27	42
CC[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(-n2nnnc2C)cc1F	ZINC000450670297	FG	On-Demand	Anodyne	NR1D1	39	42
O=C(c1cc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450670298	FG	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450670298	FG	On-Demand	Bother	L3MBTL3	36	43
COC(=O)COc1ccc([C@H](C)NC(=O)c2cc(C)n(C(C)C)n2)cc1	ZINC000450670299	FF	On-Demand	Anodyne	ACACA	57	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCO[C@]2(CCOC2)C1	ZINC000450670300	EF	On-Demand	Anodyne	CACNA1B	35	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCO[C@]2(CCOC2)C1	ZINC000450670300	EF	On-Demand	Anodyne	EPHX2	16	49
O=C(c1cc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450670301	FG	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450670301	FG	On-Demand	Bother	L3MBTL3	36	43
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cc(C)n(C(C)C)n2)cc1	ZINC000450670302	FF	On-Demand	Anodyne	ACACA	57	39
FC(F)(F)c1ccc(I)c(NC[C@H]2CCCO2)n1	ZINC000450670303	FG	On-Demand	Anodyne	TNK2	61	40
O=C(c1cc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450670307	FG	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450670307	FG	On-Demand	Bother	L3MBTL3	36	43
O=C(N[C@H](CO)c1ccccc1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450670313	DH	On-Demand	Anodyne	SOAT1	33	41
Cc1cc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)nc(-c2cccnc2)n1	ZINC000450670318	DG	On-Demand	Anodyne	ROS1	44	43
Cc1cc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)nc(-c2cccnc2)n1	ZINC000450670322	DG	On-Demand	Anodyne	ROS1	44	43
Cc1cc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)nc(-c2cccnc2)n1	ZINC000450670326	DG	On-Demand	Anodyne	ROS1	44	43
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](CC)CC(F)(F)F	ZINC000450670331	DI	On-Demand	Anodyne	OPRM1	25	43
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](CC)CC(F)(F)F	ZINC000450670331	DI	On-Demand	Anodyne	OPRD1	50	44
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](CC)CC(F)(F)F	ZINC000450670331	DI	On-Demand	Anodyne	TPP2	52	32
CC[C@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450670333	DI	On-Demand	Anodyne	OPRM1	25	43
CC[C@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450670333	DI	On-Demand	Anodyne	OPRD1	49	37
CC[C@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450670333	DI	On-Demand	Anodyne	TPP2	52	32
CC[C@@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450670335	DI	On-Demand	Anodyne	OPRM1	25	43
CC[C@@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450670335	DI	On-Demand	Anodyne	OPRD1	50	44
CC[C@@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450670335	DI	On-Demand	Anodyne	TPP2	52	32
CC[C@@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450670336	DI	On-Demand	Anodyne	OPRM1	25	43
CC[C@@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450670336	DI	On-Demand	Anodyne	OPRD1	49	37
CC[C@@H](CC(F)(F)F)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450670336	DI	On-Demand	Anodyne	TPP2	52	32
CC[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450670338	FH	On-Demand	Bother	CACNA1D	53	36
CC[C@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450670339	FH	On-Demand	Bother	CACNA1D	53	36
C[C@@H](NCC1CC(F)(F)C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450670340	EI	On-Demand	Anodyne	PRNP	56	38
C[C@H](NCC1CC(F)(F)C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450670344	EI	On-Demand	Anodyne	PRNP	56	38
CCOCc1nc(C)c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)s1	ZINC000450670347	FG	On-Demand	Bother	CACNA1D	46	34
N#CC1(CSc2nnc(-c3cccnc3)n2Cc2ccco2)CCC1	ZINC000450670368	FH	On-Demand	Mild	HCRTR2	0	41
CC[C@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450670369	GC	On-Demand	Anodyne	NPY2R	41	35
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450670371	GC	On-Demand	Anodyne	NPY2R	41	35
CC(C)Cn1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(C(F)F)n1	ZINC000450670372	GH	On-Demand	Bother	P2RX7	49	43
C[C@H](Oc1ccccn1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450670374	FF	On-Demand	Mild	NPFFR1	59	37
C[C@@H](Oc1ccccn1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450670381	FF	On-Demand	Mild	NPFFR1	59	37
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450670395	DG	On-Demand	Bother	CACNA1D	46	38
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450670396	DG	On-Demand	Bother	CACNA1D	46	38
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450670397	DG	On-Demand	Bother	CACNA1D	46	38
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450670398	DG	On-Demand	Bother	CACNA1D	46	38
CC[C@H](NCc1ccc(Cl)c(OC)c1)c1ccc2c(c1)OCCO2	ZINC000450670399	EI	On-Demand	Anodyne	PDE10A	23	48
CC[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ncc[nH]1	ZINC000450670406	CE	On-Demand	Anodyne	MMP13	0	41
CC[C@@H](NCc1ccc(Cl)c(OC)c1)c1ccc2c(c1)OCCO2	ZINC000450670407	EI	On-Demand	Anodyne	PDE10A	23	48
CC[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ncc[nH]1	ZINC000450670409	CE	On-Demand	Anodyne	MMP13	0	41
C[C@@H](NCc1nnc(C2CC2)s1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450670413	GJ	On-Demand	Anodyne	DGAT1	22	44
C[C@H](NCc1nnc(C2CC2)s1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450670414	GJ	On-Demand	Anodyne	DGAT1	22	44
C[C@@]1(Cc2ccccc2)CCCN1C(=O)[C@@H]1CC12CCSCC2	ZINC000450670426	EI	On-Demand	Anodyne	SLC12A5	77	41
C[C@]1(Cc2ccccc2)CCCN1C(=O)[C@H]1CC12CCSCC2	ZINC000450670427	EI	On-Demand	Anodyne	SLC12A5	77	41
C[C@@]1(Cc2ccccc2)CCCN1C(=O)[C@H]1CC12CCSCC2	ZINC000450670428	EI	On-Demand	Anodyne	SLC12A5	77	41
C[C@]1(Cc2ccccc2)CCCN1C(=O)[C@@H]1CC12CCSCC2	ZINC000450670429	EI	On-Demand	Anodyne	SLC12A5	77	41
Cc1cccc(COc2ccc([C@@H](C)N[C@@H](C)c3csnn3)cc2)c1	ZINC000450670456	FJ	On-Demand	Anodyne	FFAR1	20	44
Cc1cccc(COc2ccc([C@H](C)N[C@@H](C)c3csnn3)cc2)c1	ZINC000450670457	FJ	On-Demand	Anodyne	FFAR1	20	44
Cc1cccc(COc2ccc([C@@H](C)N[C@H](C)c3csnn3)cc2)c1	ZINC000450670458	FJ	On-Demand	Anodyne	FFAR1	20	44
Cc1cccc(COc2ccc([C@H](C)N[C@H](C)c3csnn3)cc2)c1	ZINC000450670459	FJ	On-Demand	Anodyne	FFAR1	20	44
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)nc1	ZINC000450670462	GH	On-Demand	Anodyne	KCNA3	44	38
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)nc1	ZINC000450670462	GH	On-Demand	Anodyne	HCN1	47	32
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)nc1	ZINC000450670462	GH	On-Demand	Anodyne	HCN4	40	31
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)nc1	ZINC000450670463	GH	On-Demand	Anodyne	KCNA3	44	38
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)nc1	ZINC000450670463	GH	On-Demand	Anodyne	HCN1	47	32
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)nc1	ZINC000450670463	GH	On-Demand	Anodyne	HCN4	40	31
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)nc1	ZINC000450670464	GH	On-Demand	Anodyne	KCNA3	44	38
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)nc1	ZINC000450670464	GH	On-Demand	Anodyne	HCN1	47	32
COc1ccccc1Oc1ccc(C(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)nc1	ZINC000450670464	GH	On-Demand	Anodyne	HCN4	40	31
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(C)CCO[C@H]2C2CC2)nc1	ZINC000450670465	GH	On-Demand	Anodyne	KCNA3	44	38
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(C)CCO[C@H]2C2CC2)nc1	ZINC000450670465	GH	On-Demand	Anodyne	HCN1	47	32
COc1ccccc1Oc1ccc(C(=O)NC[C@]2(C)CCO[C@H]2C2CC2)nc1	ZINC000450670465	GH	On-Demand	Anodyne	HCN4	40	31
c1ccc(OC[C@@H]2CCCN2c2nnc(C3CC3)s2)cc1	ZINC000450670476	DG	On-Demand	Anodyne	CHRNA10	74	51
Cc1nc2ccnn2cc1C(=O)N1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450670501	GG	On-Demand	Anodyne	P2RX7	23	42
CCOC(=O)c1ccc(OCC2(C#N)CCC2)cc1	ZINC000450670516	CF	On-Demand	Mild	ACR	26	40
CCc1cc(CCCSc2nnc(-c3ccccc3)n2Cc2ccco2)on1	ZINC000450670529	GJ	On-Demand	Anodyne	HCRTR2	20	41
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450670530	DG	On-Demand	Bother	P2RX7	59	42
Cc1nc(C)n(CCCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000450670543	FF	On-Demand	Bother	P2RX7	56	42
O=C(CC1(O)CCC1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450670552	CE	On-Demand	Bother	P2RX7	41	39
COC(=O)c1csc(CSc2nnc(C)n2Cc2ccccc2)n1	ZINC000450670557	FG	On-Demand	Anodyne	PLA2G2A	40	34
COC(=O)c1csc(CSc2nnc(C)n2Cc2ccccc2)n1	ZINC000450670557	FG	On-Demand	Anodyne	SLC27A1	44	40
CC[C@H]1Cc2ccccc2CN1C(=O)CSC1CC1	ZINC000450670569	CG	On-Demand	Anodyne	ADAM9	43	32
CC[C@@H]1Cc2ccccc2CN1C(=O)CSC1CC1	ZINC000450670570	CG	On-Demand	Anodyne	ADAM9	43	32
Cc1occc1-c1nnc(SCC2(C#N)CCC2)n1Cc1ccccc1	ZINC000450670571	FJ	On-Demand	Mild	HCRTR2	21	44
COc1cccc(OCCC(=O)N2CCC[C@@H]2C2CCOCC2)c1	ZINC000450670594	EF	On-Demand	Anodyne	COLA	80	36
COc1cccc(OCCC(=O)N2CCC[C@H]2C2CCOCC2)c1	ZINC000450670595	EF	On-Demand	Anodyne	COLA	80	36
N#CC1(NC(=O)CC2CC(F)(F)C2)CCN(Cc2ccccc2)CC1	ZINC000450670607	EG	On-Demand	Mild	SIGMAR1	60	44
N#CC1(NC(=O)CC2CC(F)(F)C2)CCN(Cc2ccccc2)CC1	ZINC000450670607	EG	On-Demand	Mild	NPFFR2	39	40
N#CC1(NC(=O)CC2CC(F)(F)C2)CCN(Cc2ccccc2)CC1	ZINC000450670607	EG	On-Demand	Mild	NPFFR1	60	40
CCn1nnc(C)c1CSc1nnc(-c2ccoc2C)n1Cc1ccccc1	ZINC000450670617	GI	On-Demand	Anodyne	HCRTR2	21	45
N#CC1(NC(=O)CC2(O)CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670661	ED	On-Demand	Mild	SIGMAR1	53	43
N#CC1(NC(=O)CC2(O)CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670661	ED	On-Demand	Mild	NPFFR2	40	42
N#CC1(NC(=O)CC2(O)CCC2)CCN(Cc2ccccc2)CC1	ZINC000450670661	ED	On-Demand	Mild	NPFFR1	63	42
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450670683	ED	On-Demand	Anodyne	EPHB3	25	41
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450670684	ED	On-Demand	Anodyne	EPHB3	25	41
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450670685	ED	On-Demand	Anodyne	EPHB3	25	41
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450670686	ED	On-Demand	Anodyne	EPHB3	25	41
CNS(=O)(=O)NCC(=O)Nc1cc(C)cc(Br)c1O	ZINC000450670688	FC	On-Demand	Anodyne	CA4	17	41
N#CC1(NC(=O)c2ccc(C(F)(F)F)[nH]2)CCN(Cc2ccccc2)CC1	ZINC000450670700	GG	On-Demand	Mild	SIGMAR1	41	42
N#CC1(NC(=O)c2ccc(C(F)(F)F)[nH]2)CCN(Cc2ccccc2)CC1	ZINC000450670700	GG	On-Demand	Mild	NPFFR1	55	36
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	DRD2	27	41
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	DRD4	35	40
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	ACHE	26	52
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	DRD3	23	40
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	TRPV1	0	42
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	SIGMAR1	59	50
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	NPFFR2	39	41
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	ADAM17	16	41
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	MCHR1	23	42
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	MCHR2	44	35
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	CCR8	44	44
COc1cc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)ccc1O	ZINC000450670702	GF	On-Demand	Mild	NPFFR1	61	41
CNC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(C)C	ZINC000450670703	CD	On-Demand	Anodyne	POL	0	48
CNC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)C(C)C	ZINC000450670704	CD	On-Demand	Anodyne	POL	0	48
CNC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)C(C)C	ZINC000450670705	CD	On-Demand	Anodyne	POL	0	48
CNC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)C(C)C	ZINC000450670706	CD	On-Demand	Anodyne	POL	0	48
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450670709	ED	On-Demand	Anodyne	PREP	17	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450670710	ED	On-Demand	Anodyne	PREP	17	40
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450670711	ED	On-Demand	Anodyne	PREP	17	40
CCOc1cc(NC2CCN(C(=O)C(C)(C)OC(C)C)CC2)ncn1	ZINC000450670732	FE	On-Demand	Anodyne	GPR119	26	40
N#Cc1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670752	DH	On-Demand	Mild	CASP3	35	40
N#Cc1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670752	DH	On-Demand	Mild	CASP7	45	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCCC(C)C)cc1	ZINC000450670769	DG	On-Demand	Anodyne	ACACA	21	42
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCCC(C)C)cc1	ZINC000450670769	DG	On-Demand	Anodyne	O69638_MYCTO	0	43
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCCC(C)C)cc1	ZINC000450670770	DG	On-Demand	Anodyne	ACACA	21	42
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCCC(C)C)cc1	ZINC000450670770	DG	On-Demand	Anodyne	O69638_MYCTO	0	43
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCCC(C)C)cc1	ZINC000450670771	DG	On-Demand	Anodyne	ACACA	21	42
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCCC(C)C)cc1	ZINC000450670771	DG	On-Demand	Anodyne	O69638_MYCTO	0	43
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCCC(C)C)cc1	ZINC000450670772	DG	On-Demand	Anodyne	ACACA	21	42
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCCC(C)C)cc1	ZINC000450670772	DG	On-Demand	Anodyne	O69638_MYCTO	0	43
CCCc1cc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)no1	ZINC000450670786	DH	On-Demand	Anodyne	SLC12A5	72	41
CCCc1cc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)no1	ZINC000450670787	DH	On-Demand	Anodyne	SLC12A5	72	41
Cc1cc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)ncc1C(N)=O	ZINC000450670800	EF	On-Demand	Anodyne	SLC12A5	75	40
Cc1cc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)ncc1C(N)=O	ZINC000450670802	EF	On-Demand	Anodyne	SLC12A5	75	40
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450670831	EI	On-Demand	Anodyne	SLC12A5	71	38
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450670832	EI	On-Demand	Anodyne	SLC12A5	71	38
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cc2ccncc2s1	ZINC000450670841	EJ	On-Demand	Anodyne	TACR2	43	36
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cc2ccncc2s1	ZINC000450670841	EJ	On-Demand	Anodyne	SLC12A5	71	38
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1cc2ccncc2s1	ZINC000450670844	EJ	On-Demand	Anodyne	TACR2	43	36
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1cc2ccncc2s1	ZINC000450670844	EJ	On-Demand	Anodyne	SLC12A5	71	38
CN(C)C(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670857	FG	On-Demand	Anodyne	P2RY12	29	42
CN(C)C(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670857	FG	On-Demand	Anodyne	CASP3	51	37
CN(C)C(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670857	FG	On-Demand	Anodyne	COLA	75	36
CN(C)C(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670857	FG	On-Demand	Anodyne	CPT1A	71	36
CN(C)C(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670857	FG	On-Demand	Anodyne	CHRNA10	74	47
CN(C)C(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670857	FG	On-Demand	Anodyne	CASP7	43	37
CN(C)C(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670857	FG	On-Demand	Anodyne	CXCR3	31	43
CN(C)C(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c(Cl)c1	ZINC000450670857	FG	On-Demand	Anodyne	ACKR3	65	35
C[C@@]1(C(=O)N[C@H](CO)c2ccccc2)CC=CCC1	ZINC000450670877	CF	On-Demand	Anodyne	GPR88	0	41
C[C@]1(C(=O)N[C@H](CO)c2ccccc2)CC=CCC1	ZINC000450670878	CF	On-Demand	Anodyne	GPR88	0	41
CC[C@@H](CNS(C)(=O)=O)Nc1ncnc2cc(Br)ccc12	ZINC000450670885	FE	On-Demand	Anodyne	EGFR	53	37
CC[C@H](CNS(C)(=O)=O)Nc1ncnc2cc(Br)ccc12	ZINC000450670886	FE	On-Demand	Anodyne	EGFR	53	37
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450670912	FE	On-Demand	Anodyne	EPHX2	22	43
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450670912	FE	On-Demand	Anodyne	TRPC6	32	40
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450670912	FE	On-Demand	Anodyne	TRPC3	16	40
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450670913	FE	On-Demand	Anodyne	EPHX2	22	43
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450670913	FE	On-Demand	Anodyne	TRPC6	32	40
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450670913	FE	On-Demand	Anodyne	TRPC3	16	40
Cc1nccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)n1	ZINC000450670915	BE	On-Demand	Anodyne	SORD	58	37
Cc1nccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)n1	ZINC000450670916	BE	On-Demand	Anodyne	SORD	58	37
Cc1nccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)n1	ZINC000450670917	BE	On-Demand	Anodyne	SORD	58	37
CCN(C)C(=O)[C@@H](Nc1ccnc2cc(F)ccc12)C(C)C	ZINC000450670919	DG	On-Demand	Anodyne	RBP_CHICK	0	41
CCn1nnc(C)c1CN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450670932	GH	On-Demand	Anodyne	PRNP	44	32
CCn1nnc(C)c1CN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450670934	GH	On-Demand	Anodyne	PRNP	44	32
CN(C)C(=O)C[C@H](NC[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450670937	DH	On-Demand	Anodyne	AMY2	43	29
CN(C)C(=O)C[C@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450670938	DH	On-Demand	Anodyne	AMY2	43	29
CN(C)C(=O)C[C@@H](NC[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450670940	DH	On-Demand	Anodyne	AMY2	43	29
CN(C)C(=O)C[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450670942	DH	On-Demand	Anodyne	AMY2	43	29
CNC(=O)N[C@@H]1CCN(C(=O)[C@H]2Cc3c(C)cccc3O2)C1	ZINC000450670957	DC	On-Demand	Anodyne	MTNR1A	30	48
CNC(=O)N[C@@H]1CCN(C(=O)[C@H]2Cc3c(C)cccc3O2)C1	ZINC000450670957	DC	On-Demand	Anodyne	MTNR1B	0	48
Cc1cccc2c1C[C@@H](C(=O)NC1(C#N)CCN(Cc3ccccc3)CC1)O2	ZINC000450670960	GF	On-Demand	Mild	SIGMAR1	49	40
Cc1cccc2c1C[C@@H](C(=O)NC1(C#N)CCN(Cc3ccccc3)CC1)O2	ZINC000450670960	GF	On-Demand	Mild	NPFFR1	50	34
Cc1cccc2c1C[C@H](C(=O)NC1(C#N)CCN(Cc3ccccc3)CC1)O2	ZINC000450670961	GF	On-Demand	Mild	SIGMAR1	49	40
Cc1cccc2c1C[C@H](C(=O)NC1(C#N)CCN(Cc3ccccc3)CC1)O2	ZINC000450670961	GF	On-Demand	Mild	NPFFR1	50	34
CNC(=O)[C@H](NCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000450670964	CE	On-Demand	Anodyne	PDE6A	40	31
CNC(=O)[C@@H](NCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000450670965	CE	On-Demand	Anodyne	PDE6A	40	31
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2Cc3c(C)cccc3O2)C1	ZINC000450670967	DC	On-Demand	Anodyne	MTNR1A	30	48
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2Cc3c(C)cccc3O2)C1	ZINC000450670967	DC	On-Demand	Anodyne	MTNR1B	0	48
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2Cc3c(C)cccc3O2)C1	ZINC000450670968	DC	On-Demand	Anodyne	MTNR1A	30	48
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2Cc3c(C)cccc3O2)C1	ZINC000450670968	DC	On-Demand	Anodyne	MTNR1B	0	48
CNC(=O)N[C@H]1CCN(C(=O)[C@H]2Cc3c(C)cccc3O2)C1	ZINC000450670972	DC	On-Demand	Anodyne	MTNR1A	30	48
CNC(=O)N[C@H]1CCN(C(=O)[C@H]2Cc3c(C)cccc3O2)C1	ZINC000450670972	DC	On-Demand	Anodyne	MTNR1B	0	48
COc1ccccc1-n1cnnc1SCC(=O)CC(C)(C)C1CC1	ZINC000450670973	EH	On-Demand	Anodyne	HTR1A	42	36
N#CC[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450670987	EE	On-Demand	Mild	TGM2	40	41
N#CC[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450670987	EE	On-Demand	Mild	GCKR	50	30
Cc1ccc(C(=O)N[C@H](CO)c2ccccc2)c(C(C)C)n1	ZINC000450671005	CF	On-Demand	Anodyne	TACR2	0	41
Cc1ccc(C(=O)N[C@H](CO)c2ccccc2)c(C(C)C)n1	ZINC000450671005	CF	On-Demand	Anodyne	TACR3	50	38
Cc1ccc(C(=O)N[C@H](CO)c2ccccc2)c(C(C)C)n1	ZINC000450671005	CF	On-Demand	Anodyne	MAPK1	37	40
Cc1ccc(C(=O)N[C@H](CO)c2ccccc2)c(C(C)C)n1	ZINC000450671005	CF	On-Demand	Anodyne	SOAT1	30	43
Cc1ccc(C(=O)N[C@H](CO)c2ccccc2)c(C(C)C)n1	ZINC000450671005	CF	On-Demand	Anodyne	GPR88	0	45
CNC(=O)[C@H](NCCc1ccc(Cl)cc1)C(C)C	ZINC000450671007	CE	On-Demand	Anodyne	AVPR1A	0	42
CNC(=O)[C@H](NCCc1ccc(Cl)cc1)C(C)C	ZINC000450671007	CE	On-Demand	Anodyne	AMP1_PLAFQ	27	42
CNC(=O)[C@@H](NCCc1ccc(Cl)cc1)C(C)C	ZINC000450671008	CE	On-Demand	Anodyne	AVPR1A	0	42
CNC(=O)[C@@H](NCCc1ccc(Cl)cc1)C(C)C	ZINC000450671008	CE	On-Demand	Anodyne	AMP1_PLAFQ	27	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450671025	EH	On-Demand	Anodyne	ACACA	56	47
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450671025	EH	On-Demand	Anodyne	ACACB	29	47
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450671027	EH	On-Demand	Anodyne	ACACA	56	47
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450671027	EH	On-Demand	Anodyne	ACACB	29	47
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450671028	EH	On-Demand	Anodyne	ACACA	56	47
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450671028	EH	On-Demand	Anodyne	ACACB	29	47
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450671029	EH	On-Demand	Anodyne	ACACA	56	47
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450671029	EH	On-Demand	Anodyne	ACACB	29	47
c1cncc(-c2nnc(SCc3cn(CC4CC4)nn3)n2Cc2ccco2)c1	ZINC000450671034	GG	On-Demand	Anodyne	HCRTR2	0	43
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cc3n(n2)CCCC3)cc1	ZINC000450671037	FE	On-Demand	Anodyne	ACACA	48	36
COC(=O)COc1ccc([C@H](C)NC(=O)c2cc3n(n2)CCCC3)cc1	ZINC000450671038	FE	On-Demand	Anodyne	ACACA	48	36
c1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)n2Cc2ccco2)cc1	ZINC000450671043	GH	On-Demand	Anodyne	HCRTR2	20	42
Cc1[nH]c(C#N)cc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671050	EE	On-Demand	Mild	NPFFR1	53	36
CCCc1nc(C)c(CSc2nnc(-c3cccnc3)n2Cc2ccco2)o1	ZINC000450671061	GJ	On-Demand	Anodyne	HCRTR2	16	41
CCc1c(C(=O)N[C@H](CC)c2ncc[nH]2)oc2ccccc12	ZINC000450671062	CH	On-Demand	Anodyne	TACR3	48	39
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671063	GE	On-Demand	Anodyne	ACE	26	42
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671063	GE	On-Demand	Anodyne	MME	20	42
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671063	GE	On-Demand	Anodyne	CACNA1B	25	47
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671063	GE	On-Demand	Anodyne	APP	18	49
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671063	GE	On-Demand	Anodyne	BDKRB1	24	43
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671063	GE	On-Demand	Anodyne	CCR2	80	38
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671063	GE	On-Demand	Anodyne	SCD1	0	42
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671063	GE	On-Demand	Anodyne	BIRC2	54	36
CCc1c(C(=O)N[C@@H](CC)c2ncc[nH]2)oc2ccccc12	ZINC000450671064	CH	On-Demand	Anodyne	TACR3	48	39
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671066	GE	On-Demand	Anodyne	ACE	26	42
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671066	GE	On-Demand	Anodyne	MME	20	42
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671066	GE	On-Demand	Anodyne	CACNA1B	25	47
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671066	GE	On-Demand	Anodyne	APP	18	49
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671066	GE	On-Demand	Anodyne	BDKRB1	24	43
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671066	GE	On-Demand	Anodyne	CCR2	80	38
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671066	GE	On-Demand	Anodyne	SCD1	0	42
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450671066	GE	On-Demand	Anodyne	BIRC2	54	36
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671068	GE	On-Demand	Anodyne	ACE	26	42
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671068	GE	On-Demand	Anodyne	MME	20	42
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671068	GE	On-Demand	Anodyne	CACNA1B	25	47
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671068	GE	On-Demand	Anodyne	APP	18	49
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671068	GE	On-Demand	Anodyne	BDKRB1	24	43
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671068	GE	On-Demand	Anodyne	CCR2	80	38
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671068	GE	On-Demand	Anodyne	SCD1	0	42
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671068	GE	On-Demand	Anodyne	BIRC2	54	36
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671070	GE	On-Demand	Anodyne	ACE	26	42
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671070	GE	On-Demand	Anodyne	MME	20	42
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671070	GE	On-Demand	Anodyne	CACNA1B	25	47
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671070	GE	On-Demand	Anodyne	APP	18	49
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671070	GE	On-Demand	Anodyne	BDKRB1	24	43
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671070	GE	On-Demand	Anodyne	CCR2	80	38
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671070	GE	On-Demand	Anodyne	SCD1	0	42
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)[C@H](O)C1CCC1	ZINC000450671070	GE	On-Demand	Anodyne	BIRC2	54	36
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2F)c(OC)c1	ZINC000450671090	GG	On-Demand	Anodyne	NQO2	24	41
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2F)c(OC)c1	ZINC000450671090	GG	On-Demand	Anodyne	MTNR1A	82	43
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2F)c(OC)c1	ZINC000450671090	GG	On-Demand	Anodyne	MTNR1B	71	43
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2F)c(OC)c1	ZINC000450671091	GG	On-Demand	Anodyne	NQO2	24	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2F)c(OC)c1	ZINC000450671091	GG	On-Demand	Anodyne	MTNR1A	82	43
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2F)c(OC)c1	ZINC000450671091	GG	On-Demand	Anodyne	MTNR1B	71	43
COC(=O)COc1ccc([C@@H](C)NC(=O)CC2(O)CCC2)cc1	ZINC000450671092	DD	On-Demand	Anodyne	ACACA	22	42
COC(=O)COc1ccc([C@@H](C)NC(=O)CC2(O)CCC2)cc1	ZINC000450671092	DD	On-Demand	Anodyne	ACACB	31	44
COC(=O)COc1ccc([C@H](C)NC(=O)CC2(O)CCC2)cc1	ZINC000450671093	DD	On-Demand	Anodyne	ACACA	22	42
COC(=O)COc1ccc([C@H](C)NC(=O)CC2(O)CCC2)cc1	ZINC000450671093	DD	On-Demand	Anodyne	ACACB	31	44
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450671094	GC	On-Demand	Bother	BDKRB1	0	49
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450671094	GC	On-Demand	Bother	BCL2L1	68	33
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450671094	GC	On-Demand	Bother	BCL2	46	30
CC(=O)N[C@H](C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)C(C)(C)C	ZINC000450671096	DG	On-Demand	Anodyne	PROTEASE	20	43
CC(=O)N[C@H](C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)C(C)(C)C	ZINC000450671098	DG	On-Demand	Anodyne	PROTEASE	20	43
CCCc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)no1	ZINC000450671100	FF	On-Demand	Mild	NPFFR1	53	38
CC[C@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450671101	GC	On-Demand	Bother	BDKRB1	0	49
CC[C@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450671101	GC	On-Demand	Bother	BCL2L1	68	33
CC[C@H](CNS(C)(=O)=O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450671101	GC	On-Demand	Bother	BCL2	46	30
CCS(=O)(=O)c1ccc(CSc2nnc(C)n2Cc2ccccc2)cc1	ZINC000450671114	GH	On-Demand	Anodyne	AGTR1	20	43
COC(=O)COc1ccc([C@@H](C)NC(=O)c2scnc2C(C)C)cc1	ZINC000450671141	FG	On-Demand	Anodyne	ACACA	54	38
COC(=O)COc1ccc([C@H](C)NC(=O)c2scnc2C(C)C)cc1	ZINC000450671142	FG	On-Demand	Anodyne	ACACA	54	38
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671149	FH	On-Demand	Bother	CACNA1D	43	37
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671149	FH	On-Demand	Bother	COLA	40	32
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671149	FH	On-Demand	Bother	F2RL3	46	33
C[C@@H](OCCc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671149	FH	On-Demand	Bother	AMP1_PLAFQ	50	34
C[C@H](OCCc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671150	FH	On-Demand	Bother	CACNA1D	43	37
C[C@H](OCCc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671150	FH	On-Demand	Bother	COLA	40	32
C[C@H](OCCc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671150	FH	On-Demand	Bother	F2RL3	46	33
C[C@H](OCCc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671150	FH	On-Demand	Bother	AMP1_PLAFQ	50	34
COC(=O)C1(CSc2nnc(-c3ccccc3)n2Cc2ccco2)CCCC1	ZINC000450671159	GI	On-Demand	Anodyne	HCRTR2	23	49
COc1ccc(CN2CCCN(C(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)CC2=O)cc1	ZINC000450671178	FG	On-Demand	Anodyne	MMP1	21	41
COc1ccc(CN2CCCN(C(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)CC2=O)cc1	ZINC000450671179	FG	On-Demand	Anodyne	MMP1	21	41
COc1ccc(CN2CCCN(C(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)CC2=O)cc1	ZINC000450671180	FG	On-Demand	Anodyne	MMP1	21	41
COc1ccc(CN2CCCN(C(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2=O)cc1	ZINC000450671181	FG	On-Demand	Anodyne	MMP1	21	41
CC[C@@](C)(CCO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450671188	CD	On-Demand	Anodyne	HPGDS	17	45
CC[C@](C)(CCO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450671189	CD	On-Demand	Anodyne	HPGDS	17	45
O=C1C[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CN1	ZINC000450671196	DC	On-Demand	Anodyne	PTGER3	16	41
O=C1C[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CN1	ZINC000450671197	DC	On-Demand	Anodyne	PTGER3	16	41
COC(=O)c1csc(CN[C@@H](C)c2ccc(OCCC(C)C)cc2)n1	ZINC000450671199	FI	On-Demand	Anodyne	O69638_MYCTO	0	40
COC(=O)c1csc(CN[C@H](C)c2ccc(OCCC(C)C)cc2)n1	ZINC000450671200	FI	On-Demand	Anodyne	O69638_MYCTO	0	40
COC(=O)c1coc(CN[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450671201	GI	On-Demand	Anodyne	CYP26A1	24	43
COC(=O)c1coc(CN[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450671201	GI	On-Demand	Anodyne	FFAR1	33	44
COC(=O)c1coc(CN[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450671202	GI	On-Demand	Anodyne	CYP26A1	24	43
COC(=O)c1coc(CN[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)n1	ZINC000450671202	GI	On-Demand	Anodyne	FFAR1	33	44
CCN(C)C(=O)[C@@H](Nc1nc(N(C)C)c2ccccc2n1)C(C)C	ZINC000450671203	EF	On-Demand	Anodyne	ADRA2A	15	42
CC(C)c1nnc(N2CCC[C@H]2COc2ccccc2)s1	ZINC000450671204	DH	On-Demand	Anodyne	CHRNA10	77	53
CC(F)(F)c1ccc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)cn1	ZINC000450671210	EI	On-Demand	Anodyne	SLC12A5	72	38
CC(F)(F)c1ccc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)cn1	ZINC000450671211	EI	On-Demand	Anodyne	SLC12A5	72	38
CCOC(=O)c1cc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)on1	ZINC000450671224	EG	On-Demand	Anodyne	SLC12A5	79	41
CCOC(=O)c1cc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)on1	ZINC000450671225	EG	On-Demand	Anodyne	SLC12A5	79	41
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450671231	CG	On-Demand	Mild	SLC12A5	74	40
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450671232	CG	On-Demand	Mild	SLC12A5	74	40
CC[C@@](C)(CCO)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450671239	DE	On-Demand	Anodyne	IRAK4	21	42
CC[C@](C)(CCO)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450671240	DE	On-Demand	Anodyne	IRAK4	21	42
CC[C@H](CC(C)C)C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450671247	FG	On-Demand	Anodyne	DPP7	18	42
CC[C@@H](CC(C)C)C(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450671248	FG	On-Demand	Anodyne	DPP7	18	42
O=c1cc(N2CCC[C@H]2COc2ccccc2)cnn1Cc1ccccc1	ZINC000450671251	FG	On-Demand	Anodyne	CASP3	70	44
O=c1cc(N2CCC[C@H]2COc2ccccc2)cnn1Cc1ccccc1	ZINC000450671251	FG	On-Demand	Anodyne	CHRNA10	67	46
O=c1cc(N2CCC[C@H]2COc2ccccc2)cnn1Cc1ccccc1	ZINC000450671251	FG	On-Demand	Anodyne	CASP7	61	42
CCn1nnc(C)c1COc1ccccc1C(=O)NCc1ccccc1	ZINC000450671252	FG	On-Demand	Anodyne	PPIA	21	40
CCn1nnc(C)c1COc1ccccc1C(=O)NCc1ccccc1	ZINC000450671252	FG	On-Demand	Anodyne	HCN1	59	41
CCn1nnc(C)c1COc1ccccc1C(=O)NCc1ccccc1	ZINC000450671252	FG	On-Demand	Anodyne	HCN4	44	35
CCn1nnc(C)c1COc1ccccc1C(=O)NCc1ccccc1	ZINC000450671252	FG	On-Demand	Anodyne	PDS	41	33
Cc1oc2ccccc2c1CNC(=O)C(C)(C)OC(C)C	ZINC000450671258	CH	On-Demand	Anodyne	THRB	0	42
O=[N+]([O-])c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450671266	CG	On-Demand	Bother	CASP3	69	44
O=[N+]([O-])c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450671266	CG	On-Demand	Bother	CHRNA10	65	47
O=[N+]([O-])c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450671266	CG	On-Demand	Bother	CASP7	55	43
Cc1ccc(C)c(S[C@H](C)C(=O)Nc2nccs2)c1	ZINC000450671279	CH	On-Demand	Anodyne	MAP	0	41
Cc1ccc(C)c(S[C@H](C)C(=O)Nc2nccs2)c1	ZINC000450671279	CH	On-Demand	Anodyne	MAP1	117	39
Cc1ccc(C)c(S[C@@H](C)C(=O)Nc2nccs2)c1	ZINC000450671280	CH	On-Demand	Anodyne	MAP	0	41
Cc1ccc(C)c(S[C@@H](C)C(=O)Nc2nccs2)c1	ZINC000450671280	CH	On-Demand	Anodyne	MAP1	117	39
Cc1cccc(COc2ccc([C@@H](C)NC[C@@H]3CCNC(=O)CC3)cc2)c1	ZINC000450671284	FI	On-Demand	Anodyne	MAOB	32	42
Cc1cccc(COc2ccc([C@@H](C)NC[C@@H]3CCNC(=O)CC3)cc2)c1	ZINC000450671284	FI	On-Demand	Anodyne	FFAR1	20	42
Cc1cccc(COc2ccc([C@H](C)NC[C@@H]3CCNC(=O)CC3)cc2)c1	ZINC000450671293	FI	On-Demand	Anodyne	MAOB	32	42
Cc1cccc(COc2ccc([C@H](C)NC[C@@H]3CCNC(=O)CC3)cc2)c1	ZINC000450671293	FI	On-Demand	Anodyne	FFAR1	20	42
Cc1cccc(COc2ccc([C@H](C)NC[C@H]3CCNC(=O)CC3)cc2)c1	ZINC000450671295	FI	On-Demand	Anodyne	MAOB	31	42
Cc1cccc(COc2ccc([C@H](C)NC[C@H]3CCNC(=O)CC3)cc2)c1	ZINC000450671295	FI	On-Demand	Anodyne	FFAR1	17	42
Cc1cccc(COc2ccc([C@@H](C)NC[C@H]3CCNC(=O)CC3)cc2)c1	ZINC000450671297	FI	On-Demand	Anodyne	MAOB	32	42
Cc1cccc(COc2ccc([C@@H](C)NC[C@H]3CCNC(=O)CC3)cc2)c1	ZINC000450671297	FI	On-Demand	Anodyne	FFAR1	20	42
CC[C@@](C)(CCO)NC(=O)c1ccc2cnccc2c1	ZINC000450671307	CF	On-Demand	Anodyne	AKT1	0	41
CC[C@](C)(CCO)NC(=O)c1ccc2cnccc2c1	ZINC000450671308	CF	On-Demand	Anodyne	AKT1	0	41
CC[C@@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671318	FG	On-Demand	Anodyne	AVPR1B	28	42
CC[C@@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671318	FG	On-Demand	Anodyne	PDE6D	53	38
CC[C@@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671318	FG	On-Demand	Anodyne	HDAC8	26	41
CC[C@@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671318	FG	On-Demand	Anodyne	HDAC6	20	41
CC[C@@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671318	FG	On-Demand	Anodyne	IMDH_CRYPV	34	53
CC[C@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671320	FG	On-Demand	Anodyne	AVPR1B	28	42
CC[C@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671320	FG	On-Demand	Anodyne	PDE6D	53	38
CC[C@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671320	FG	On-Demand	Anodyne	HDAC8	26	41
CC[C@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671320	FG	On-Demand	Anodyne	HDAC6	20	41
CC[C@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450671320	FG	On-Demand	Anodyne	IMDH_CRYPV	34	53
C[C@@]1(Cc2ccccc2)CCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450671322	GI	On-Demand	Anodyne	SLC12A5	73	37
C[C@@]1(Cc2ccccc2)CCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450671323	GI	On-Demand	Anodyne	SLC12A5	73	37
C[C@]1(Cc2ccccc2)CCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450671324	GI	On-Demand	Anodyne	SLC12A5	73	37
C[C@]1(Cc2ccccc2)CCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450671326	GI	On-Demand	Anodyne	SLC12A5	73	37
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)c(F)c1	ZINC000450671328	GG	On-Demand	Anodyne	SLC12A5	63	34
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)c(F)c1	ZINC000450671339	GG	On-Demand	Anodyne	SLC12A5	63	34
Cc1cc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)nn1C(C)C	ZINC000450671341	EI	On-Demand	Anodyne	SLC12A5	75	39
Cc1cc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)nn1C(C)C	ZINC000450671342	EI	On-Demand	Anodyne	SLC12A5	75	39
Cc1cc(C(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)ncc1C(N)=O	ZINC000450671344	GF	On-Demand	Anodyne	CSF1R	25	40
CCN(C)C(=O)[C@@H](Nc1ncc(C(F)(F)F)s1)C(C)C	ZINC000450671351	DG	On-Demand	Anodyne	MLYCD	16	41
CC(F)(F)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671352	DI	On-Demand	Anodyne	KCNA3	35	42
CC(F)(F)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671352	DI	On-Demand	Anodyne	MTTP	35	42
CC(F)(F)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671352	DI	On-Demand	Anodyne	CARM1	43	35
CC(F)(F)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671352	DI	On-Demand	Anodyne	HCN1	64	39
CC(F)(F)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671352	DI	On-Demand	Anodyne	HCN4	51	33
CC(F)(F)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671352	DI	On-Demand	Anodyne	KCNK3	50	39
CC(F)(F)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671352	DI	On-Demand	Anodyne	KCNK9	43	39
CC(F)(F)CCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671352	DI	On-Demand	Anodyne	PDS	56	39
C[C@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671353	DG	On-Demand	Anodyne	FOLH1	25	43
C[C@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671353	DG	On-Demand	Anodyne	ANPEP	37	45
C[C@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671353	DG	On-Demand	Anodyne	KCNA3	36	43
C[C@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671353	DG	On-Demand	Anodyne	AMP1_PLAFQ	53	40
C[C@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671353	DG	On-Demand	Anodyne	HCN1	67	39
C[C@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671353	DG	On-Demand	Anodyne	HCN4	53	36
C[C@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671353	DG	On-Demand	Anodyne	KCNK3	43	35
C[C@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671353	DG	On-Demand	Anodyne	PDS	45	40
C[C@@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671354	DG	On-Demand	Anodyne	FOLH1	25	43
C[C@@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671354	DG	On-Demand	Anodyne	ANPEP	37	45
C[C@@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671354	DG	On-Demand	Anodyne	KCNA3	36	43
C[C@@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671354	DG	On-Demand	Anodyne	AMP1_PLAFQ	53	40
C[C@@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671354	DG	On-Demand	Anodyne	HCN1	67	39
C[C@@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671354	DG	On-Demand	Anodyne	HCN4	53	36
C[C@@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671354	DG	On-Demand	Anodyne	KCNK3	43	35
C[C@@H](O)CCCOc1ccccc1C(=O)NCc1ccccc1	ZINC000450671354	DG	On-Demand	Anodyne	PDS	45	40
COc1ccc(CC(=O)NCc2c(C)oc3ccccc23)c(Cl)c1OC	ZINC000450671355	FI	On-Demand	Anodyne	P2RX7	23	41
Cc1cnc(N2CCC[C@H]2COc2ccccc2)nc1C	ZINC000450671356	CG	On-Demand	Anodyne	CASP3	53	39
Cc1cnc(N2CCC[C@H]2COc2ccccc2)nc1C	ZINC000450671356	CG	On-Demand	Anodyne	CHRNA10	74	54
Cc1cnc(N2CCC[C@H]2COc2ccccc2)nc1C	ZINC000450671356	CG	On-Demand	Anodyne	CASP7	40	39
C[C@H](NC[C@H]1CCCCC1(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450671367	FI	On-Demand	Anodyne	EPHX2	48	41
C[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450671368	FI	On-Demand	Anodyne	EPHX2	48	41
C[C@@H](NC[C@H]1CCCCC1(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450671369	FI	On-Demand	Anodyne	EPHX2	48	41
C[C@H](NC[C@@H]1CCCCC1(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450671370	FI	On-Demand	Anodyne	EPHX2	48	41
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450671371	GE	On-Demand	Anodyne	AVPR2	80	42
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450671371	GE	On-Demand	Anodyne	AVPR1A	46	42
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450671372	GE	On-Demand	Anodyne	AVPR2	80	42
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450671372	GE	On-Demand	Anodyne	AVPR1A	46	42
COC(=O)COc1ccc([C@@H](C)NC(=O)c2c(C3CC3)noc2C)cc1	ZINC000450671375	FF	On-Demand	Anodyne	ACACA	47	36
COC(=O)COc1ccc([C@H](C)NC(=O)c2c(C3CC3)noc2C)cc1	ZINC000450671376	FF	On-Demand	Anodyne	ACACA	47	36
Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2CCCO2)n1	ZINC000450671397	CE	On-Demand	Bother	TNK2	54	36
CC(C)CCCC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671399	EG	On-Demand	Mild	SIGMAR1	57	41
CC(C)CCCC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671399	EG	On-Demand	Mild	NPFFR2	42	40
CC(C)CCCC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671399	EG	On-Demand	Mild	NPFFR1	64	40
c1cncc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)c1	ZINC000450671413	FH	On-Demand	Anodyne	HCRTR2	0	41
c1cncc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)c1	ZINC000450671415	FH	On-Demand	Anodyne	HCRTR2	0	41
CC[C@@H](O)CC(=O)Nc1cc(C)n(-c2cccc(Cl)c2)n1	ZINC000450671420	DE	On-Demand	Anodyne	NPY5R	17	49
CC[C@H](O)CC(=O)Nc1cc(C)n(-c2cccc(Cl)c2)n1	ZINC000450671421	DE	On-Demand	Anodyne	NPY5R	17	49
CC(C)=CCC[C@H](C)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450671422	FF	On-Demand	Anodyne	TGM2	29	41
CC(C)=CCC[C@H](C)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450671422	FF	On-Demand	Anodyne	GCK	43	33
CC(C)=CCC[C@H](C)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450671422	FF	On-Demand	Anodyne	GCKR	65	33
CC(C)=CCC[C@@H](C)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450671423	FF	On-Demand	Anodyne	TGM2	29	41
CC(C)=CCC[C@@H](C)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450671423	FF	On-Demand	Anodyne	GCK	43	33
CC(C)=CCC[C@@H](C)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450671423	FF	On-Demand	Anodyne	GCKR	65	33
CCN(C)C(=O)[C@@H](Nc1ncnc2c1cnn2-c1ccccc1)C(C)C	ZINC000450671440	FF	On-Demand	Anodyne	GCK	45	35
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C1(C(=O)C2CC2)CC1	ZINC000450671444	DF	On-Demand	Bother	P2RX7	20	42
N#CC1(NC(=O)[C@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671454	GG	On-Demand	Mild	DRD4	30	40
N#CC1(NC(=O)[C@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671454	GG	On-Demand	Mild	ACHE	31	42
N#CC1(NC(=O)[C@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671454	GG	On-Demand	Mild	SIGMAR1	60	43
N#CC1(NC(=O)[C@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671454	GG	On-Demand	Mild	CTSK	19	51
N#CC1(NC(=O)[C@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671454	GG	On-Demand	Mild	CACNA1G	26	41
N#CC1(NC(=O)[C@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671454	GG	On-Demand	Mild	NPFFR1	56	37
N#CC1(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671458	GG	On-Demand	Mild	DRD4	30	40
N#CC1(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671458	GG	On-Demand	Mild	ACHE	31	42
N#CC1(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671458	GG	On-Demand	Mild	SIGMAR1	60	43
N#CC1(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671458	GG	On-Demand	Mild	CTSK	19	51
N#CC1(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671458	GG	On-Demand	Mild	CACNA1G	26	41
N#CC1(NC(=O)[C@@H]2CCN(c3ccccc3)C2)CCN(Cc2ccccc2)CC1	ZINC000450671458	GG	On-Demand	Mild	NPFFR1	56	37
CCOC(=O)c1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)[nH]c1C	ZINC000450671463	GF	On-Demand	Mild	NPFFR2	38	40
CCOC(=O)c1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)[nH]c1C	ZINC000450671463	GF	On-Demand	Mild	NPFFR1	60	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450671468	ED	On-Demand	Anodyne	ACE	56	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450671468	ED	On-Demand	Anodyne	FKBP1A	52	37
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450671468	ED	On-Demand	Anodyne	AGTR2	54	37
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450671468	ED	On-Demand	Anodyne	BRCA1	52	32
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450671471	ED	On-Demand	Anodyne	ACE	56	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450671471	ED	On-Demand	Anodyne	FKBP1A	52	37
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450671471	ED	On-Demand	Anodyne	AGTR2	54	37
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450671471	ED	On-Demand	Anodyne	BRCA1	52	32
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450671477	ED	On-Demand	Anodyne	ACE	56	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450671477	ED	On-Demand	Anodyne	FKBP1A	52	37
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450671477	ED	On-Demand	Anodyne	AGTR2	54	37
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450671477	ED	On-Demand	Anodyne	BRCA1	52	32
O=C(Cc1ccccc1O[C@H]1CCOC1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671481	GG	On-Demand	Bother	P2RX7	40	36
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450671482	ED	On-Demand	Anodyne	ACE	56	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450671482	ED	On-Demand	Anodyne	FKBP1A	52	37
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450671482	ED	On-Demand	Anodyne	AGTR2	54	37
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450671482	ED	On-Demand	Anodyne	BRCA1	52	32
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671483	GG	On-Demand	Bother	P2RX7	40	36
C[C@@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450671508	EF	On-Demand	Anodyne	LUXN	0	41
C[C@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450671509	EF	On-Demand	Anodyne	LUXN	0	41
C[C@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450671510	EF	On-Demand	Anodyne	LUXN	0	41
C[C@@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450671511	EF	On-Demand	Anodyne	LUXN	0	41
C[C@H](NCC1(C#N)CCC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450671517	EI	On-Demand	Mild	PRNP	40	39
C[C@H](NCC1(C#N)CCC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450671517	EI	On-Demand	Mild	KCNK3	91	42
C[C@H](NCC1(C#N)CCC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450671517	EI	On-Demand	Mild	KCNK9	70	42
C[C@@H](NCC1(C#N)CCC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450671522	EI	On-Demand	Mild	PRNP	40	39
C[C@@H](NCC1(C#N)CCC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450671522	EI	On-Demand	Mild	KCNK3	91	42
C[C@@H](NCC1(C#N)CCC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450671522	EI	On-Demand	Mild	KCNK9	70	42
COc1ccc(CNC(=O)CCNC2[C@@H](C)CCC[C@@H]2C)c(OC)c1	ZINC000450671528	EG	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCNC2[C@@H](C)CCC[C@@H]2C)c(OC)c1	ZINC000450671528	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCNC2[C@@H](C)CCC[C@@H]2C)c(OC)c1	ZINC000450671528	EG	On-Demand	Anodyne	MTNR1A	63	38
COc1ccc(CNC(=O)CCNC2[C@@H](C)CCC[C@@H]2C)c(OC)c1	ZINC000450671528	EG	On-Demand	Anodyne	MTNR1B	47	37
COc1ccc(CNC(=O)CCNC2[C@H](C)CCC[C@H]2C)c(OC)c1	ZINC000450671529	EG	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCNC2[C@H](C)CCC[C@H]2C)c(OC)c1	ZINC000450671529	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCNC2[C@H](C)CCC[C@H]2C)c(OC)c1	ZINC000450671529	EG	On-Demand	Anodyne	MTNR1A	63	38
COc1ccc(CNC(=O)CCNC2[C@H](C)CCC[C@H]2C)c(OC)c1	ZINC000450671529	EG	On-Demand	Anodyne	MTNR1B	47	37
COc1ccc(CNC(=O)CCN[C@@H]2[C@@H](C)CCC[C@H]2C)c(OC)c1	ZINC000450671530	EG	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@@H]2[C@@H](C)CCC[C@H]2C)c(OC)c1	ZINC000450671530	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@@H]2[C@@H](C)CCC[C@H]2C)c(OC)c1	ZINC000450671530	EG	On-Demand	Anodyne	MTNR1A	63	38
COc1ccc(CNC(=O)CCN[C@@H]2[C@@H](C)CCC[C@H]2C)c(OC)c1	ZINC000450671530	EG	On-Demand	Anodyne	MTNR1B	47	37
CO[C@@H](CN[C@@H](CCO)c1ccccc1)Cc1ccccc1	ZINC000450671533	CF	On-Demand	Anodyne	SOAT1	22	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450671535	GD	On-Demand	Bother	CACNA1C	49	36
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450671535	GD	On-Demand	Bother	CACNA1D	73	35
CO[C@H](CN[C@@H](CCO)c1ccccc1)Cc1ccccc1	ZINC000450671536	CF	On-Demand	Anodyne	SOAT1	22	40
CO[C@H](CN[C@H](CCO)c1ccccc1)Cc1ccccc1	ZINC000450671537	CF	On-Demand	Anodyne	SOAT1	22	40
CO[C@@H](CN[C@H](CCO)c1ccccc1)Cc1ccccc1	ZINC000450671538	CF	On-Demand	Anodyne	SOAT1	22	40
COC(=O)COc1ccc([C@@H](C)NC(=O)CC2CC(F)(F)C2)cc1	ZINC000450671540	EF	On-Demand	Anodyne	ACACA	54	43
COC(=O)COc1ccc([C@H](C)NC(=O)CC2CC(F)(F)C2)cc1	ZINC000450671542	EF	On-Demand	Anodyne	ACACA	54	43
CCOc1cccc([C@@H](C)NCc2cccc(C(=O)OC)c2Cl)c1	ZINC000450671545	EI	On-Demand	Anodyne	PDS	65	42
CCOc1cccc([C@H](C)NCc2cccc(C(=O)OC)c2Cl)c1	ZINC000450671547	EI	On-Demand	Anodyne	PDS	65	42
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CCOC[C@H]1OC	ZINC000450671548	DF	On-Demand	Anodyne	ADAM9	46	31
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CCOC[C@@H]1OC	ZINC000450671550	DF	On-Demand	Anodyne	ADAM9	46	31
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@H]1CCOC[C@H]1OC	ZINC000450671552	DF	On-Demand	Anodyne	ADAM9	46	31
CC[C@@H]1Cc2ccccc2CN1C(=O)C[C@H]1CCOC[C@@H]1OC	ZINC000450671553	DF	On-Demand	Anodyne	ADAM9	46	31
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450671556	BC	On-Demand	Anodyne	EPHX2	21	40
CCOc1ccccc1[C@@H](C)NCC1(C#N)CCC1	ZINC000450671558	CG	On-Demand	Mild	HCN1	43	36
CCOc1ccccc1[C@@H](C)NCC1(C#N)CCC1	ZINC000450671558	CG	On-Demand	Mild	HCN4	42	36
CCOc1ccccc1[C@H](C)NCC1(C#N)CCC1	ZINC000450671559	CG	On-Demand	Mild	HCN1	43	36
CCOc1ccccc1[C@H](C)NCC1(C#N)CCC1	ZINC000450671559	CG	On-Demand	Mild	HCN4	42	36
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450671560	GD	On-Demand	Bother	CACNA1C	49	36
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450671560	GD	On-Demand	Bother	CACNA1D	73	35
COc1cc(CN[C@H](C)c2cc(OC)c(OC)c(OC)c2)ccc1Cl	ZINC000450671563	FI	On-Demand	Anodyne	N1L	0	42
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450671564	GD	On-Demand	Bother	CACNA1C	49	36
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450671564	GD	On-Demand	Bother	CACNA1D	73	35
COc1cc(CN[C@@H](C)c2cc(OC)c(OC)c(OC)c2)ccc1Cl	ZINC000450671565	FI	On-Demand	Anodyne	N1L	0	42
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450671566	GD	On-Demand	Bother	CACNA1C	49	36
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450671566	GD	On-Demand	Bother	CACNA1D	73	35
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450671567	BC	On-Demand	Anodyne	EPHX2	21	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000450671568	CE	On-Demand	Anodyne	ACACA	25	49
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000450671569	CE	On-Demand	Anodyne	ACACA	25	49
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OC(C)C)cc1	ZINC000450671571	CE	On-Demand	Anodyne	ACACA	25	49
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OC(C)C)cc1	ZINC000450671573	CE	On-Demand	Anodyne	ACACA	25	49
CCOC(=O)c1cc(N[C@H]2CC[C@@H](CC#N)C2)ncc1Cl	ZINC000450671622	DG	On-Demand	Mild	P2RY12	43	34
Cc1ccc(NC(=O)c2ccc(N[C@H]3CC[C@@H](CC#N)C3)c([N+](=O)[O-])c2)cc1	ZINC000450671623	GJ	On-Demand	Mild	TAAR1	20	40
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	DRD2	15	52
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	ACHE	27	40
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	DRD3	0	44
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	SIGMAR1	71	44
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	NPFFR2	45	42
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	ADAM17	17	42
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	MCHR2	44	35
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	CCR8	41	37
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	NPFFR1	70	55
COC(=O)c1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450671645	GF	On-Demand	Mild	NOD2	40	36
Cc1nc(N[C@H]2CC[C@@H](CC#N)C2)c2cc[nH]c2n1	ZINC000450671675	CF	On-Demand	Mild	JAK1	55	41
Cc1nc(N[C@H]2CC[C@@H](CC#N)C2)c2cc[nH]c2n1	ZINC000450671675	CF	On-Demand	Mild	JAK2	0	41
Cc1nc(N[C@H]2CC[C@@H](CC#N)C2)c2cc[nH]c2n1	ZINC000450671675	CF	On-Demand	Mild	TYK2	23	40
C[C@H](O)CCCN[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000450671678	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	32
C[C@H](NCCC[C@@H](C)O)c1cccc(-n2cccn2)c1	ZINC000450671679	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	32
C[C@H](O)CCCN[C@H](C)c1cccc(-n2cccn2)c1	ZINC000450671680	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	32
C[C@@H](O)CCCN[C@H](C)c1cccc(-n2cccn2)c1	ZINC000450671681	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	32
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(C)sc2C)c(OC)c1	ZINC000450671694	GH	On-Demand	Anodyne	PDGFRB	31	43
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(C)sc2C)c(OC)c1	ZINC000450671694	GH	On-Demand	Anodyne	MTNR1A	48	38
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(C)sc2C)c(OC)c1	ZINC000450671699	GH	On-Demand	Anodyne	PDGFRB	31	43
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(C)sc2C)c(OC)c1	ZINC000450671699	GH	On-Demand	Anodyne	MTNR1A	48	38
C[C@H]1CCC[C@@H](C)[C@@H]1NCc1cn(CC2CC2)nn1	ZINC000450671704	CF	On-Demand	Anodyne	GBA	19	42
C[C@H]1CCC[C@H](C)C1NCc1cn(CC2CC2)nn1	ZINC000450671705	CF	On-Demand	Anodyne	GBA	19	42
C[C@@H]1CCC[C@@H](C)C1NCc1cn(CC2CC2)nn1	ZINC000450671707	CF	On-Demand	Anodyne	GBA	19	42
Cn1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c2n(c1=O)CCCC2	ZINC000450671715	FE	On-Demand	Bother	P2RX7	51	41
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450671717	GG	On-Demand	Anodyne	ACACA	23	41
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450671717	GG	On-Demand	Anodyne	ACACB	31	43
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450671718	GG	On-Demand	Anodyne	ACACA	23	41
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450671718	GG	On-Demand	Anodyne	ACACB	31	43
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cccc(SC)c2)cc1	ZINC000450671724	FG	On-Demand	Anodyne	ACACA	24	42
COC(=O)COc1ccc([C@@H](C)NC(=O)c2cccc(SC)c2)cc1	ZINC000450671724	FG	On-Demand	Anodyne	ACACB	27	42
COC(=O)COc1ccc([C@H](C)NC(=O)c2cccc(SC)c2)cc1	ZINC000450671725	FG	On-Demand	Anodyne	ACACA	24	42
COC(=O)COc1ccc([C@H](C)NC(=O)c2cccc(SC)c2)cc1	ZINC000450671725	FG	On-Demand	Anodyne	ACACB	27	42
CC[C@H]1Cc2ccccc2CN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450671731	EH	On-Demand	Anodyne	OPRD1	53	34
CC[C@H]1Cc2ccccc2CN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450671731	EH	On-Demand	Anodyne	NR1D1	42	42
CC[C@@H]1Cc2ccccc2CN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450671734	EH	On-Demand	Anodyne	OPRD1	53	34
CC[C@@H]1Cc2ccccc2CN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450671734	EH	On-Demand	Anodyne	NR1D1	42	42
COCc1nn(C)cc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671743	EE	On-Demand	Bother	P2RX7	45	39
COCc1nn(C)cc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671743	EE	On-Demand	Bother	CACNA1D	51	34
O=C(CSC1CC1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450671744	DF	On-Demand	Bother	P2RX7	60	38
CCS(=O)(=O)c1ccc(CNC(C)(C)c2cccc(Cl)c2)cc1	ZINC000450671746	FI	On-Demand	Anodyne	FBP1	17	40
CCS(=O)(=O)c1ccc(CNC(C)(C)c2cccc(Cl)c2)cc1	ZINC000450671746	FI	On-Demand	Anodyne	RORC	58	44
CCS(=O)(=O)c1ccc(CNC(=O)c2ccc(C)nc2C(C)C)cc1	ZINC000450671756	FG	On-Demand	Anodyne	NAMPT	47	39
COc1cc2c(cc1F)CN(C(=O)Cc1cc3ccccc3s1)CC2	ZINC000450671757	FI	On-Demand	Anodyne	ABCB1B	52	34
COc1cc2c(cc1F)CN(C(=O)Cc1cc3ccccc3s1)CC2	ZINC000450671757	FI	On-Demand	Anodyne	ABCB1	24	51
COc1cc2c(cc1F)CN(C(=O)Cc1cc3ccccc3s1)CC2	ZINC000450671757	FI	On-Demand	Anodyne	HCRTR2	15	42
c1ccc(-c2nnc(SCc3nnc(C4CC4)s3)n2Cc2ccco2)cc1	ZINC000450671763	GJ	On-Demand	Anodyne	HCRTR2	19	41
COc1cccc(OCCC(=O)N(C)Cc2cc(F)c(F)c(F)c2)c1	ZINC000450671764	FH	On-Demand	Anodyne	MTNR1A	26	45
COc1cccc(OCCC(=O)N(C)Cc2cc(F)c(F)c(F)c2)c1	ZINC000450671764	FH	On-Demand	Anodyne	MTNR1B	30	41
COc1cccc(OCCC(=O)N(C)Cc2cc(F)c(F)c(F)c2)c1	ZINC000450671764	FH	On-Demand	Anodyne	HSD17B2	27	42
COC(=O)c1csc(CN[C@@H](C)c2cccc(OC)c2)n1	ZINC000450671765	DF	On-Demand	Anodyne	ROCK1	24	46
COC(=O)c1csc(CN[C@H](C)c2cccc(OC)c2)n1	ZINC000450671766	DF	On-Demand	Anodyne	ROCK1	24	46
CC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450671774	ED	On-Demand	Mild	DRD3	0	40
CC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450671774	ED	On-Demand	Mild	SIGMAR1	67	42
CC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450671774	ED	On-Demand	Mild	CTSB	27	40
CC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450671774	ED	On-Demand	Mild	CTSK	18	40
CC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450671774	ED	On-Demand	Mild	TACR3	56	33
CC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450671774	ED	On-Demand	Mild	CTSS	26	40
CC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450671774	ED	On-Demand	Mild	CACNA1G	25	40
CC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450671774	ED	On-Demand	Mild	NPFFR1	59	38
COC(=O)COc1ccc([C@H](C)NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)cc1	ZINC000450671776	EF	On-Demand	Anodyne	ACACA	50	41
COC(=O)COc1ccc([C@H](C)NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)cc1	ZINC000450671776	EF	On-Demand	Anodyne	ACACB	25	41
COC(=O)COc1ccc([C@H](C)NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)cc1	ZINC000450671777	EF	On-Demand	Anodyne	ACACA	50	41
COC(=O)COc1ccc([C@H](C)NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)cc1	ZINC000450671777	EF	On-Demand	Anodyne	ACACB	25	41
COC(=O)COc1ccc([C@H](C)NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)cc1	ZINC000450671779	EF	On-Demand	Anodyne	ACACA	50	41
COC(=O)COc1ccc([C@H](C)NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)cc1	ZINC000450671779	EF	On-Demand	Anodyne	ACACB	25	41
COC(=O)COc1ccc([C@H](C)NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)cc1	ZINC000450671780	EF	On-Demand	Anodyne	ACACA	50	41
COC(=O)COc1ccc([C@H](C)NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)cc1	ZINC000450671780	EF	On-Demand	Anodyne	ACACB	25	41
COc1cccc([C@@H](C)NCc2ccc(Cl)c(OC)c2)c1	ZINC000450671781	DI	On-Demand	Anodyne	CASR	16	70
COc1cccc([C@H](C)NCc2ccc(Cl)c(OC)c2)c1	ZINC000450671782	DI	On-Demand	Anodyne	CASR	18	70
C[C@H](NCC1=CCCCC1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450671805	EG	On-Demand	Anodyne	LUXN	0	44
C[C@@H](NCC1=CCCCC1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450671806	EG	On-Demand	Anodyne	LUXN	0	44
COC(=O)c1coc(CSc2nnc(C)n2Cc2ccccc2)n1	ZINC000450671811	EF	On-Demand	Anodyne	SLC27A1	44	39
CC(=O)Nc1cccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450671812	EG	On-Demand	Anodyne	KCNK3	49	31
CC(=O)Nc1cccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450671813	EG	On-Demand	Anodyne	KCNK3	49	31
CC(=O)Nc1cccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450671814	EG	On-Demand	Anodyne	KCNK3	49	31
CC(=O)Nc1cccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450671815	EG	On-Demand	Anodyne	KCNK3	49	31
CC(C)=CCC[C@@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450671817	EH	On-Demand	Bother	BCL2L1	63	34
CC(C)=CCC[C@@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450671817	EH	On-Demand	Bother	BCL2	48	33
CC(C)=CCC[C@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450671818	EH	On-Demand	Bother	BCL2L1	63	34
CC(C)=CCC[C@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450671818	EH	On-Demand	Bother	BCL2	48	33
CNC(=O)N[C@@H]1CCN(C(=O)CCCC(C)C)C1	ZINC000450671838	CD	On-Demand	Anodyne	EPHX2	20	40
CNC(=O)N[C@H]1CCN(C(=O)CCCC(C)C)C1	ZINC000450671839	CD	On-Demand	Anodyne	EPHX2	20	40
CNC(=O)N[C@@H]1CCN(C(=O)[C@H]2Cc3cccc(C)c3O2)C1	ZINC000450671871	DC	On-Demand	Anodyne	MTNR1A	0	41
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2Cc3cccc(C)c3O2)C1	ZINC000450671872	DC	On-Demand	Anodyne	MTNR1A	0	41
CNC(=O)N[C@H]1CCN(C(=O)[C@H]2Cc3cccc(C)c3O2)C1	ZINC000450671873	DC	On-Demand	Anodyne	MTNR1A	0	41
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2Cc3cccc(C)c3O2)C1	ZINC000450671874	DC	On-Demand	Anodyne	MTNR1A	0	41
O=C(c1cnc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c(Cl)c1)N1CCOCC1	ZINC000450671875	FF	On-Demand	Anodyne	CXCR3	28	45
O=C(c1cnc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)c(Cl)c1)N1CCOCC1	ZINC000450671876	FF	On-Demand	Anodyne	CXCR3	28	45
O=C(c1cnc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c(Cl)c1)N1CCOCC1	ZINC000450671877	FF	On-Demand	Anodyne	CXCR3	28	45
CCOc1cccc([C@H](C)NCc2ccc(Cl)c(OC)c2)c1	ZINC000450671885	DJ	On-Demand	Anodyne	CASR	15	57
CCOc1cccc([C@H](C)NCc2ccc(Cl)c(OC)c2)c1	ZINC000450671885	DJ	On-Demand	Anodyne	PDS	40	37
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1cc2cccnc2s1	ZINC000450671891	EE	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1cc2cccnc2s1	ZINC000450671894	EE	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1cc2cccnc2s1	ZINC000450671895	EE	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1cc2cccnc2s1	ZINC000450671897	EE	On-Demand	Anodyne	PREP	15	41
N#CC[C@@H]1CC[C@H](Nc2ccnc3cc(F)ccc23)C1	ZINC000450671898	CH	On-Demand	Mild	HNMT	42	32
CC(F)(F)CCOc1cccnc1[N+](=O)[O-]	ZINC000450671917	BE	On-Demand	Bother	S1PR4	0	54
CNC(=O)N[C@H]1CCN(C(=O)c2ccc3scc(Br)c3c2)C1	ZINC000450671925	GF	On-Demand	Anodyne	L3MBTL3	46	37
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc3scc(Br)c3c2)C1	ZINC000450671927	GF	On-Demand	Anodyne	L3MBTL3	46	37
C[C@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450671937	GI	On-Demand	Anodyne	LTA4H	19	41
C[C@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450671937	GI	On-Demand	Anodyne	PRNP	60	36
C[C@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450671937	GI	On-Demand	Anodyne	ROCK2	15	46
C[C@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450671937	GI	On-Demand	Anodyne	KCNK3	56	44
C[C@@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450671938	GI	On-Demand	Anodyne	LTA4H	19	41
C[C@@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450671938	GI	On-Demand	Anodyne	PRNP	60	36
C[C@@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450671938	GI	On-Demand	Anodyne	ROCK2	15	46
C[C@@H](NCCN(C)Cc1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450671938	GI	On-Demand	Anodyne	KCNK3	56	44
CC(C)Cn1cc(C(=O)NCc2ncc(-c3cccs3)[nH]2)c(C(F)F)n1	ZINC000450671942	GH	On-Demand	Anodyne	GPR142	41	33
Cc1cnc(CCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)o1	ZINC000450671949	FF	On-Demand	Mild	NPFFR1	52	37
CC(C)C[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671950	EG	On-Demand	Mild	SIGMAR1	48	39
CC(C)C[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671950	EG	On-Demand	Mild	CTSB	34	43
CC(C)C[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671950	EG	On-Demand	Mild	CTSK	25	44
CC(C)C[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671950	EG	On-Demand	Mild	CTSS	36	43
CC(C)C[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671950	EG	On-Demand	Mild	NPFFR1	56	36
N#CC1(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCN(Cc2ccccc2)CC1	ZINC000450671951	FF	On-Demand	Mild	SIGMAR1	58	42
N#CC1(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCN(Cc2ccccc2)CC1	ZINC000450671951	FF	On-Demand	Mild	CTSB	33	43
N#CC1(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCN(Cc2ccccc2)CC1	ZINC000450671951	FF	On-Demand	Mild	CTSK	21	43
N#CC1(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCN(Cc2ccccc2)CC1	ZINC000450671951	FF	On-Demand	Mild	CTSS	37	43
N#CC1(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCN(Cc2ccccc2)CC1	ZINC000450671951	FF	On-Demand	Mild	CACNA1G	25	40
N#CC1(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)CCN(Cc2ccccc2)CC1	ZINC000450671951	FF	On-Demand	Mild	NPFFR1	57	38
Cc1nnc2c3ccccc3c(N[C@H]3CC[C@@H](CC#N)C3)nn12	ZINC000450671955	DF	On-Demand	Mild	CREBBP	40	32
Cc1nnc2c3ccccc3c(N[C@H]3CC[C@@H](CC#N)C3)nn12	ZINC000450671955	DF	On-Demand	Mild	BRD9	52	35
CO[C@@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671964	GF	On-Demand	Mild	SIGMAR1	61	44
CO[C@@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671964	GF	On-Demand	Mild	PAPA1_CARPA	40	37
CO[C@@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671964	GF	On-Demand	Mild	NPFFR2	40	38
CO[C@@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671964	GF	On-Demand	Mild	ADAM17	15	40
CO[C@@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671964	GF	On-Demand	Mild	CTSC	42	38
CO[C@@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671964	GF	On-Demand	Mild	NPFFR1	62	40
CO[C@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671965	GF	On-Demand	Mild	SIGMAR1	61	44
CO[C@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671965	GF	On-Demand	Mild	PAPA1_CARPA	40	37
CO[C@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671965	GF	On-Demand	Mild	NPFFR2	40	38
CO[C@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671965	GF	On-Demand	Mild	ADAM17	15	40
CO[C@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671965	GF	On-Demand	Mild	CTSC	42	38
CO[C@H](Cc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450671965	GF	On-Demand	Mild	NPFFR1	62	40
CC[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1ncc[nH]1	ZINC000450671967	EF	On-Demand	Bother	CACNA1D	44	32
CC[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1ncc[nH]1	ZINC000450671968	EF	On-Demand	Bother	CACNA1D	44	32
O=C(CCCC(=O)C1CC1)Nc1ccccc1Nc1ccc(F)cc1	ZINC000450671977	EJ	On-Demand	Anodyne	HDAC1	15	46
O=C(CCCC(=O)C1CC1)Nc1ccccc1Nc1ccc(F)cc1	ZINC000450671977	EJ	On-Demand	Anodyne	HDAC2	18	46
O=C(CCCC(=O)C1CC1)Nc1ccccc1Nc1ccc(F)cc1	ZINC000450671977	EJ	On-Demand	Anodyne	HDAC3	25	46
c1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)cc1	ZINC000450671978	FI	On-Demand	Anodyne	HCRTR2	20	42
c1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)cc1	ZINC000450671979	FI	On-Demand	Anodyne	HCRTR2	20	42
CCOc1nc2ccc(C(=O)N[C@H](C)c3ccc(OCC(=O)OC)cc3)cc2[nH]1	ZINC000450671980	GG	On-Demand	Anodyne	ACACA	50	40
CCOc1nc2ccc(C(=O)N[C@H](C)c3ccc(OCC(=O)OC)cc3)cc2[nH]1	ZINC000450671980	GG	On-Demand	Anodyne	ACACB	27	40
CCOc1nc2ccc(C(=O)N[C@@H](C)c3ccc(OCC(=O)OC)cc3)cc2[nH]1	ZINC000450671981	GG	On-Demand	Anodyne	ACACA	50	40
CCOc1nc2ccc(C(=O)N[C@@H](C)c3ccc(OCC(=O)OC)cc3)cc2[nH]1	ZINC000450671981	GG	On-Demand	Anodyne	ACACB	27	40
COc1cccc([C@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450671989	CD	On-Demand	Anodyne	MTNR1A	34	47
COc1cccc([C@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450671989	CD	On-Demand	Anodyne	MTNR1B	39	47
COc1cccc([C@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450671990	CD	On-Demand	Anodyne	MTNR1A	34	47
COc1cccc([C@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450671990	CD	On-Demand	Anodyne	MTNR1B	39	47
COc1cccc([C@@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450671991	CD	On-Demand	Anodyne	MTNR1A	34	47
COc1cccc([C@@H](C)NC[C@@](C)(O)C(C)=O)c1	ZINC000450671991	CD	On-Demand	Anodyne	MTNR1B	39	47
COc1cccc([C@@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450671992	CD	On-Demand	Anodyne	MTNR1A	34	47
COc1cccc([C@@H](C)NC[C@](C)(O)C(C)=O)c1	ZINC000450671992	CD	On-Demand	Anodyne	MTNR1B	39	47
COc1cc2c(cc1F)CN(C(=O)c1ccc(C)nc1C(C)C)CC2	ZINC000450672013	EH	On-Demand	Anodyne	ABCB1	0	46
O=C(CC1CC(F)(F)C1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450672018	DG	On-Demand	Bother	P2RX7	53	36
O=C(Cc1scnc1-c1ccccc1)N1CCC[C@H]1C1CCOCC1	ZINC000450672019	FH	On-Demand	Anodyne	COLA	95	39
O=C(Cc1scnc1-c1ccccc1)N1CCC[C@H]1C1CCOCC1	ZINC000450672019	FH	On-Demand	Anodyne	CPT1A	73	39
O=C(Cc1scnc1-c1ccccc1)N1CCC[C@H]1C1CCOCC1	ZINC000450672019	FH	On-Demand	Anodyne	PREP	41	34
O=C(Cc1scnc1-c1ccccc1)N1CCC[C@@H]1C1CCOCC1	ZINC000450672020	FH	On-Demand	Anodyne	COLA	95	39
O=C(Cc1scnc1-c1ccccc1)N1CCC[C@@H]1C1CCOCC1	ZINC000450672020	FH	On-Demand	Anodyne	CPT1A	73	39
O=C(Cc1scnc1-c1ccccc1)N1CCC[C@@H]1C1CCOCC1	ZINC000450672020	FH	On-Demand	Anodyne	PREP	41	34
Cc1onc(C2CC2)c1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450672023	EG	On-Demand	Bother	P2RX7	50	35
CCC[C@H](OC)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450672039	CG	On-Demand	Anodyne	ADAM9	56	33
CCC[C@H](OC)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450672039	CG	On-Demand	Anodyne	TPP2	54	34
CCC[C@H](OC)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450672039	CG	On-Demand	Anodyne	NR1D1	36	40
CCC[C@H](OC)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450672040	CG	On-Demand	Anodyne	ADAM9	56	33
CCC[C@H](OC)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450672040	CG	On-Demand	Anodyne	TPP2	54	34
CCC[C@H](OC)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450672040	CG	On-Demand	Anodyne	NR1D1	36	40
CCC[C@@H](OC)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450672041	CG	On-Demand	Anodyne	ADAM9	56	33
CCC[C@@H](OC)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450672041	CG	On-Demand	Anodyne	TPP2	54	34
CCC[C@@H](OC)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450672041	CG	On-Demand	Anodyne	NR1D1	36	40
CCC[C@@H](OC)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450672042	CG	On-Demand	Anodyne	ADAM9	56	33
CCC[C@@H](OC)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450672042	CG	On-Demand	Anodyne	TPP2	54	34
CCC[C@@H](OC)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450672042	CG	On-Demand	Anodyne	NR1D1	36	40
C1=C(CSc2nnc(-c3cccnc3)n2Cc2ccco2)CCCC1	ZINC000450672053	FJ	On-Demand	Anodyne	HCRTR2	17	44
COc1ccc([C@@H](CCO)NCCc2ccc(Cl)cc2)cc1	ZINC000450672065	DH	On-Demand	Anodyne	ADRB2	15	41
COc1ccc([C@@H](CCO)NCCc2ccc(Cl)cc2)cc1	ZINC000450672065	DH	On-Demand	Anodyne	UTS2	42	42
COc1ccc([C@H](CCO)NCCc2ccc(Cl)cc2)cc1	ZINC000450672067	DH	On-Demand	Anodyne	UTS2	42	42
CC(C)N1CC[C@@H](NC(=O)C2(C)CCC(=O)CC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450672074	GI	On-Demand	Anodyne	ENV	46	35
CC(C)N1CC[C@H](NC(=O)C2(C)CCC(=O)CC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450672078	GI	On-Demand	Anodyne	ENV	46	35
CC(C)N1CC[C@H](NC(=O)C2(C)CCC(=O)CC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450672079	GI	On-Demand	Anodyne	ENV	46	35
CC(C)N1CC[C@@H](NC(=O)C2(C)CCC(=O)CC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450672080	GI	On-Demand	Anodyne	ENV	46	35
COC(=O)c1coc(CNC2(c3ccccc3)CCCC2)n1	ZINC000450672089	DG	On-Demand	Anodyne	NPPA	44	38
COC(=O)C1(CNC2(c3ccccc3)CCCC2)CC1	ZINC000450672099	CF	On-Demand	Anodyne	ACAT	0	43
Cc1ccn(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)n1	ZINC000450672118	ED	On-Demand	Mild	SIGMAR1	38	40
Cc1ccn(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)n1	ZINC000450672118	ED	On-Demand	Mild	NPFFR1	59	39
c1ccc(COC[C@H](NCCc2cscn2)c2ccccc2)cc1	ZINC000450672122	EI	On-Demand	Anodyne	MAN1B1	41	43
c1ccc(COC[C@@H](NCCc2cscn2)c2ccccc2)cc1	ZINC000450672123	EI	On-Demand	Anodyne	MAN1B1	41	43
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672131	EE	On-Demand	Anodyne	PRNP	45	37
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672132	EE	On-Demand	Anodyne	PRNP	45	37
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672133	EE	On-Demand	Anodyne	PRNP	45	37
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672134	EE	On-Demand	Anodyne	PRNP	45	37
N#CC1(NC(=O)Cc2ccc(O)c(F)c2)CCN(Cc2ccccc2)CC1	ZINC000450672144	FF	On-Demand	Mild	SIGMAR1	49	50
N#CC1(NC(=O)Cc2ccc(O)c(F)c2)CCN(Cc2ccccc2)CC1	ZINC000450672144	FF	On-Demand	Mild	CCR3	16	42
N#CC1(NC(=O)Cc2ccc(O)c(F)c2)CCN(Cc2ccccc2)CC1	ZINC000450672144	FF	On-Demand	Mild	NPFFR1	64	39
CC[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672145	DF	On-Demand	Mild	SIGMAR1	62	41
CC[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672145	DF	On-Demand	Mild	CTSB	36	45
CC[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672145	DF	On-Demand	Mild	CTSK	28	48
CC[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672145	DF	On-Demand	Mild	NPFFR2	40	39
CC[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672145	DF	On-Demand	Mild	CTSS	28	45
CC[C@@H]1C[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672145	DF	On-Demand	Mild	NPFFR1	59	40
C[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCCO1	ZINC000450672226	DH	On-Demand	Anodyne	TIMP3	42	34
C[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCCO1	ZINC000450672227	DH	On-Demand	Anodyne	TIMP3	42	34
C[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@H]1CCCCO1	ZINC000450672228	DH	On-Demand	Anodyne	TIMP3	42	34
C[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@H]1CCCCO1	ZINC000450672229	DH	On-Demand	Anodyne	TIMP3	42	34
Fc1ccccc1OC[C@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450672250	EF	On-Demand	Anodyne	MAN1B1	54	49
Fc1ccccc1OC[C@@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450672251	EF	On-Demand	Anodyne	MAN1B1	54	49
Fc1ccccc1OC[C@@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450672252	EF	On-Demand	Anodyne	MAN1B1	54	49
Fc1ccccc1OC[C@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450672253	EF	On-Demand	Anodyne	MAN1B1	54	49
C[C@@H](O)CCCN[C@H](COc1ccccc1F)c1ccccc1	ZINC000450672269	DH	On-Demand	Anodyne	MAN1B1	25	43
C[C@H](O)CCCN[C@H](COc1ccccc1F)c1ccccc1	ZINC000450672270	DH	On-Demand	Anodyne	MAN1B1	25	43
C[C@@H](O)CCCN[C@@H](COc1ccccc1F)c1ccccc1	ZINC000450672271	DH	On-Demand	Anodyne	MAN1B1	25	43
C[C@H](O)CCCN[C@@H](COc1ccccc1F)c1ccccc1	ZINC000450672272	DH	On-Demand	Anodyne	MAN1B1	25	43
O=C(N[C@H](CO)c1ccccc1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450672287	DG	On-Demand	Anodyne	CCR5	16	40
O=C(N[C@H](CO)c1ccccc1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450672287	DG	On-Demand	Anodyne	GPR88	0	57
O=C(N[C@H](CO)c1ccccc1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450672288	DG	On-Demand	Anodyne	CCR5	16	40
O=C(N[C@H](CO)c1ccccc1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450672288	DG	On-Demand	Anodyne	GPR88	0	57
O=C(N[C@H](CO)c1ccccc1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450672289	DG	On-Demand	Anodyne	CCR5	16	40
O=C(N[C@H](CO)c1ccccc1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450672289	DG	On-Demand	Anodyne	GPR88	0	57
O=C(N[C@H](CO)c1ccccc1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450672290	DG	On-Demand	Anodyne	CCR5	16	40
O=C(N[C@H](CO)c1ccccc1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450672290	DG	On-Demand	Anodyne	GPR88	0	57
CC(C)c1nnc(CN[C@H](C)c2ccccc2OCc2ccccc2)s1	ZINC000450672291	FK	On-Demand	Anodyne	PPIA	40	30
C[C@H](NCC1(C#N)CCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450672300	FI	On-Demand	Mild	PRNP	43	33
C[C@H](NCC1(C#N)CCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450672300	FI	On-Demand	Mild	F7	19	40
C[C@@H](NCC1(C#N)CCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450672301	FI	On-Demand	Mild	PRNP	43	33
C[C@@H](NCC1(C#N)CCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450672301	FI	On-Demand	Mild	F7	19	40
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672310	GE	On-Demand	Anodyne	DRD4	22	44
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672310	GE	On-Demand	Anodyne	CHRM3	17	41
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672310	GE	On-Demand	Anodyne	CCKAR	0	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672310	GE	On-Demand	Anodyne	CCR2	26	41
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672310	GE	On-Demand	Anodyne	EPHX2	26	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672310	GE	On-Demand	Anodyne	L3MBTL3	50	36
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672311	GE	On-Demand	Anodyne	DRD4	22	44
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672311	GE	On-Demand	Anodyne	CHRM3	17	41
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672311	GE	On-Demand	Anodyne	CCKAR	0	42
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672311	GE	On-Demand	Anodyne	CCR2	26	41
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672311	GE	On-Demand	Anodyne	EPHX2	26	42
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450672311	GE	On-Demand	Anodyne	L3MBTL3	50	36
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCN(c2ccccc2)C1	ZINC000450672314	FG	On-Demand	Bother	P2RX7	45	39
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCN(c2ccccc2)C1	ZINC000450672314	FG	On-Demand	Bother	EPHX2	28	49
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCN(c2ccccc2)C1	ZINC000450672315	FG	On-Demand	Bother	P2RX7	45	39
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCN(c2ccccc2)C1	ZINC000450672315	FG	On-Demand	Bother	EPHX2	28	49
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(C#N)n2C)cc1	ZINC000450672316	ED	On-Demand	Mild	ACACA	48	37
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(C#N)n2C)cc1	ZINC000450672317	ED	On-Demand	Mild	ACACA	48	37
CC[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450672320	DG	On-Demand	Anodyne	ADAM9	43	33
CC[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450672321	DG	On-Demand	Anodyne	ADAM9	43	33
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)cc1	ZINC000450672322	GH	On-Demand	Anodyne	ACACA	47	41
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)cc1	ZINC000450672322	GH	On-Demand	Anodyne	ACACB	26	41
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)cc1	ZINC000450672322	GH	On-Demand	Anodyne	GPR88	0	42
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc(-n2cccn2)c1	ZINC000450672323	EH	On-Demand	Anodyne	AMP1_PLAFQ	51	34
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc(-n2cccn2)c1	ZINC000450672326	EH	On-Demand	Anodyne	AMP1_PLAFQ	51	34
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc(-n2cccn2)c1	ZINC000450672328	EH	On-Demand	Anodyne	AMP1_PLAFQ	51	34
CCSc1cccnc1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672330	FG	On-Demand	Anodyne	ACACB	28	41
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc(-n2cccn2)c1	ZINC000450672331	EH	On-Demand	Anodyne	AMP1_PLAFQ	51	34
CCSc1cccnc1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672332	FG	On-Demand	Anodyne	ACACB	28	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672333	FG	On-Demand	Anodyne	ACACA	54	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672333	FG	On-Demand	Anodyne	ACACB	29	43
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672335	FG	On-Demand	Anodyne	ACACA	54	43
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672335	FG	On-Demand	Anodyne	ACACB	29	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672337	FG	On-Demand	Anodyne	ACACA	54	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672337	FG	On-Demand	Anodyne	ACACB	29	43
CNC(=O)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450672338	CD	On-Demand	Anodyne	POL	0	48
CC[C@H](CC(F)(F)F)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672339	FG	On-Demand	Anodyne	ACACA	54	43
CC[C@H](CC(F)(F)F)C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672339	FG	On-Demand	Anodyne	ACACB	29	43
CCOC(=O)c1cc(C(=O)N[C@H](C)c2ccc(OCC(=O)OC)cc2)[nH]c1C	ZINC000450672340	GF	On-Demand	Anodyne	ACACA	49	39
CNC(=O)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450672341	CD	On-Demand	Anodyne	POL	0	48
CCOC(=O)c1cc(C(=O)N[C@@H](C)c2ccc(OCC(=O)OC)cc2)[nH]c1C	ZINC000450672342	GF	On-Demand	Anodyne	ACACA	49	39
CNC(=O)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450672343	CD	On-Demand	Anodyne	POL	0	48
CNC(=O)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450672345	CD	On-Demand	Anodyne	POL	0	48
CC(=O)CCCCCSc1nnc(-c2cccnc2)n1Cc1ccccc1	ZINC000450672362	GJ	On-Demand	Anodyne	TBXAS1	23	42
CC(=O)CCCCCSc1nnc(-c2cccnc2)n1Cc1ccccc1	ZINC000450672362	GJ	On-Demand	Anodyne	FAAH	17	41
CC(=O)CCCCCSc1nnc(-c2cccnc2)n1Cc1ccccc1	ZINC000450672362	GJ	On-Demand	Anodyne	CES1	18	41
N#CC[C@@H]1CC[C@H](Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450672368	FF	On-Demand	Mild	L3MBTL1	0	41
N#CC[C@@H]1CC[C@H](Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450672368	FF	On-Demand	Mild	L3MBTL3	15	41
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450672376	GG	On-Demand	Anodyne	ACACA	22	40
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450672376	GG	On-Demand	Anodyne	ACACB	28	42
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450672378	GG	On-Demand	Anodyne	ACACA	22	40
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450672378	GG	On-Demand	Anodyne	ACACB	28	42
Cc1cc(Cl)c2ncc(C#N)c(N[C@H]3CC[C@@H](CC#N)C3)c2c1	ZINC000450672379	DJ	On-Demand	Mild	MAP3K8	69	34
CCCc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)no1	ZINC000450672380	DG	On-Demand	Bother	ENR	0	42
CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450672384	EH	On-Demand	Anodyne	CFTR	43	33
CC[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450672385	EH	On-Demand	Anodyne	CFTR	43	33
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cc1	ZINC000450672386	FG	On-Demand	Anodyne	ACACB	29	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cc1	ZINC000450672387	FG	On-Demand	Anodyne	ACACB	29	40
CCOC(=O)c1cc(C(=O)N2Cc3ccccc3C[C@@H]2CC)on1	ZINC000450672388	EF	On-Demand	Anodyne	BCL2	37	47
CCOC(=O)c1cc(C(=O)N2Cc3ccccc3C[C@H]2CC)on1	ZINC000450672389	EF	On-Demand	Anodyne	BCL2	37	47
Cc1c([N+](=O)[O-])cnc(N[C@H]2CC[C@@H](CC#N)C2)c1Br	ZINC000450672396	EH	On-Demand	Mild	PRKCQ	44	37
Cc1occc1-c1nnc(S[C@@H]2C[C@H](C)CCC2=O)n1Cc1ccccc1	ZINC000450672403	GJ	On-Demand	Anodyne	HCRTR2	20	43
Cc1occc1-c1nnc(S[C@@H]2C[C@@H](C)CCC2=O)n1Cc1ccccc1	ZINC000450672406	GJ	On-Demand	Anodyne	HCRTR2	20	43
Cc1occc1-c1nnc(S[C@H]2C[C@H](C)CCC2=O)n1Cc1ccccc1	ZINC000450672408	GJ	On-Demand	Anodyne	HCRTR2	20	43
CCOCc1nc(C)c(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)s1	ZINC000450672409	GG	On-Demand	Mild	SCD1	30	40
CCOCc1nc(C)c(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)s1	ZINC000450672409	GG	On-Demand	Mild	SCD	23	40
CCOCc1nc(C)c(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)s1	ZINC000450672409	GG	On-Demand	Mild	NPFFR1	48	35
Cc1occc1-c1nnc(S[C@H]2C[C@@H](C)CCC2=O)n1Cc1ccccc1	ZINC000450672410	GJ	On-Demand	Anodyne	HCRTR2	20	43
C[C@H](NCCC[C@@H](C)O)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672411	EG	On-Demand	Anodyne	PRNP	51	38
C[C@H](NCCC[C@@H](C)O)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672411	EG	On-Demand	Anodyne	FLT1	23	41
C[C@H](NCCC[C@@H](C)O)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672411	EG	On-Demand	Anodyne	KCNK3	22	40
C[C@H](O)CCCN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672413	EG	On-Demand	Anodyne	PRNP	51	38
C[C@H](O)CCCN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672413	EG	On-Demand	Anodyne	FLT1	23	41
C[C@H](O)CCCN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672413	EG	On-Demand	Anodyne	KCNK3	22	40
C[C@@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672415	EG	On-Demand	Anodyne	PRNP	51	38
C[C@@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672415	EG	On-Demand	Anodyne	FLT1	23	41
C[C@@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672415	EG	On-Demand	Anodyne	KCNK3	22	40
C[C@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672417	EG	On-Demand	Anodyne	PRNP	51	38
C[C@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672417	EG	On-Demand	Anodyne	FLT1	23	41
C[C@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450672417	EG	On-Demand	Anodyne	KCNK3	22	40
Cn1cc(-c2ccc(C(=O)NC3(C#N)CCN(Cc4ccccc4)CC3)o2)cn1	ZINC000450672419	GF	On-Demand	Mild	SIGMAR1	52	39
Cn1cc(-c2ccc(C(=O)NC3(C#N)CCN(Cc4ccccc4)CC3)o2)cn1	ZINC000450672419	GF	On-Demand	Mild	NPFFR1	52	36
N#Cc1ccc(OCC(=O)N2CCO[C@@]3(CCOC3)C2)cc1Br	ZINC000450672421	GD	On-Demand	Mild	TRPV4	41	31
N#Cc1ccc(OCC(=O)N2CCO[C@]3(CCOC3)C2)cc1Br	ZINC000450672423	GD	On-Demand	Mild	TRPV4	41	31
Cn1nc(-c2ccccc2)cc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672432	GG	On-Demand	Mild	TSPO	0	41
Cn1nc(-c2ccccc2)cc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672432	GG	On-Demand	Mild	SIGMAR1	47	41
Cn1nc(-c2ccccc2)cc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672432	GG	On-Demand	Mild	CTSL	22	40
Cn1nc(-c2ccccc2)cc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672432	GG	On-Demand	Mild	CTSV	49	35
Cn1nc(-c2ccccc2)cc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450672432	GG	On-Demand	Mild	NPFFR1	54	37
CC[C@@H]1CCC[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672439	EG	On-Demand	Anodyne	SDH1	0	44
CC[C@@H]1CCC[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672439	EG	On-Demand	Anodyne	ACACA	25	46
CC[C@@H]1CCC[C@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672439	EG	On-Demand	Anodyne	ACACB	34	46
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672440	EG	On-Demand	Anodyne	SDH1	0	44
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672440	EG	On-Demand	Anodyne	ACACA	25	46
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672440	EG	On-Demand	Anodyne	ACACB	34	46
CC[C@@H]1CCC[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672441	EG	On-Demand	Anodyne	SDH1	0	44
CC[C@@H]1CCC[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672441	EG	On-Demand	Anodyne	ACACA	25	46
CC[C@@H]1CCC[C@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672441	EG	On-Demand	Anodyne	ACACB	34	46
CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672442	EG	On-Demand	Anodyne	SDH1	0	44
CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672442	EG	On-Demand	Anodyne	ACACA	25	46
CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450672442	EG	On-Demand	Anodyne	ACACB	34	46
CC(C)(C)c1cc(CSc2nnc(-c3ccccc3)n2Cc2ccco2)no1	ZINC000450672448	GK	On-Demand	Anodyne	HCRTR2	21	44
CCS(=O)(=O)c1ccc(CNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450672449	DD	On-Demand	Anodyne	PROC	43	34
CCS(=O)(=O)c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450672451	DD	On-Demand	Anodyne	PROC	43	34
Cc1occc1-c1nnc(SC[C@@H]2C[C@H]3CC[C@H]2O3)n1Cc1ccccc1	ZINC000450672453	GJ	On-Demand	Anodyne	HCRTR2	22	46
Cc1occc1-c1nnc(SC[C@H]2C[C@H]3CC[C@H]2O3)n1Cc1ccccc1	ZINC000450672459	GJ	On-Demand	Anodyne	HCRTR2	22	46
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450672472	GF	On-Demand	Anodyne	RBP4	87	39
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450672472	GF	On-Demand	Anodyne	WNT3	49	31
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450672473	GF	On-Demand	Anodyne	RBP4	87	39
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450672473	GF	On-Demand	Anodyne	WNT3	49	31
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450672474	GF	On-Demand	Anodyne	RBP4	87	39
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450672474	GF	On-Demand	Anodyne	WNT3	49	31
Cc1csc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450672482	EG	On-Demand	Mild	ACHE	18	40
Cc1csc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450672482	EG	On-Demand	Mild	SIGMAR1	54	41
Cc1csc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450672482	EG	On-Demand	Mild	NPFFR2	40	37
Cc1csc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450672482	EG	On-Demand	Mild	NPFFR1	61	37
CC[C@H](O)CC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450672510	EE	On-Demand	Anodyne	BCL2A1	44	37
CC[C@H](O)CC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450672511	EE	On-Demand	Anodyne	BCL2A1	44	37
CC[C@@H](O)CC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450672512	EE	On-Demand	Anodyne	BCL2A1	44	37
COC(=O)COc1ccc([C@@H](C)NC(=O)CCCn2nc(C)nc2C)cc1	ZINC000450672514	FE	On-Demand	Anodyne	ACACA	44	41
COC(=O)COc1ccc([C@H](C)NC(=O)CCCn2nc(C)nc2C)cc1	ZINC000450672515	FE	On-Demand	Anodyne	ACACA	44	41
CC[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450672520	CG	On-Demand	Anodyne	CFTR	48	33
CC[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450672520	CG	On-Demand	Anodyne	ADAM9	58	35
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1CC	ZINC000450672521	CG	On-Demand	Anodyne	CFTR	48	33
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1CC	ZINC000450672521	CG	On-Demand	Anodyne	ADAM9	58	35
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450672526	FF	On-Demand	Anodyne	ACACA	24	41
COC(=O)COc1ccc([C@@H](C)NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450672526	FF	On-Demand	Anodyne	ACACB	30	43
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450672527	FF	On-Demand	Anodyne	ACACA	24	41
COC(=O)COc1ccc([C@H](C)NC(=O)Cc2ccc(O)c(F)c2)cc1	ZINC000450672527	FF	On-Demand	Anodyne	ACACB	30	43
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CC[C@H](C)O2)cc1	ZINC000450672530	DD	On-Demand	Anodyne	ACACA	54	44
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H]2CC[C@H](C)O2)cc1	ZINC000450672530	DD	On-Demand	Anodyne	ACACB	29	44
CC(=O)CCCCCSc1nnc(-c2ccccc2)n1Cc1ccco1	ZINC000450672540	FJ	On-Demand	Anodyne	HCRTR2	23	50
Cc1cccc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450672548	EF	On-Demand	Anodyne	TNKS	46	32
Cc1cccc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450672548	EF	On-Demand	Anodyne	LUXN	0	44
Cc1cccc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450672548	EF	On-Demand	Anodyne	ADIPOR1	0	40
Cc1cccc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450672548	EF	On-Demand	Anodyne	ADIPOR2	0	40
Cc1cccc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450672549	EF	On-Demand	Anodyne	TNKS	46	32
Cc1cccc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450672549	EF	On-Demand	Anodyne	LUXN	0	44
Cc1cccc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450672549	EF	On-Demand	Anodyne	ADIPOR1	0	40
Cc1cccc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450672549	EF	On-Demand	Anodyne	ADIPOR2	0	40
CCS(=O)(=O)c1ccc(CN[C@@H](CC(F)(F)F)c2ccccc2)cc1	ZINC000450672557	FI	On-Demand	Anodyne	RORC	47	37
CCS(=O)(=O)c1ccc(CN[C@H](CC(F)(F)F)c2ccccc2)cc1	ZINC000450672558	FI	On-Demand	Anodyne	RORC	47	37
CCCn1c(O)nnc1SCc1nc(-c2cc(OC)ncn2)no1	ZINC000450672559	ED	On-Demand	Anodyne	AXIN2	0	41
CS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)cc1	ZINC000450672568	DF	On-Demand	Anodyne	GPR119	17	46
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)cc1	ZINC000450672569	DF	On-Demand	Anodyne	GPR119	17	46
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)cc1	ZINC000450672570	DF	On-Demand	Anodyne	GPR119	17	46
COC[C@@]1(C(=O)N[C@H](CO)c2ccccc2)CCOC1	ZINC000450672573	CC	On-Demand	Anodyne	SOAT1	22	40
COC[C@@]1(C(=O)N[C@H](CO)c2ccccc2)CCOC1	ZINC000450672573	CC	On-Demand	Anodyne	GPR88	0	45
COC[C@]1(C(=O)N[C@H](CO)c2ccccc2)CCOC1	ZINC000450672574	CC	On-Demand	Anodyne	SOAT1	22	40
COC[C@]1(C(=O)N[C@H](CO)c2ccccc2)CCOC1	ZINC000450672574	CC	On-Demand	Anodyne	GPR88	0	45
COC(=O)CNC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450672583	GE	On-Demand	Bother	TAAR1	20	45
COC(=O)CNC(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)c([N+](=O)[O-])c1	ZINC000450672584	GE	On-Demand	Bother	TAAR1	20	45
COC(=O)CNC(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450672585	GE	On-Demand	Bother	TAAR1	20	45
CO[C@H](CN[C@@H](CC(=O)N(C)C)c1ccccc1)Cc1ccccc1	ZINC000450672595	EG	On-Demand	Anodyne	SOAT1	23	42
CO[C@@H](CN[C@@H](CC(=O)N(C)C)c1ccccc1)Cc1ccccc1	ZINC000450672596	EG	On-Demand	Anodyne	SOAT1	23	42
CO[C@H](CN[C@H](CC(=O)N(C)C)c1ccccc1)Cc1ccccc1	ZINC000450672597	EG	On-Demand	Anodyne	SOAT1	23	42
CO[C@@H](CN[C@H](CC(=O)N(C)C)c1ccccc1)Cc1ccccc1	ZINC000450672598	EG	On-Demand	Anodyne	SOAT1	23	42
CCCn1c(O)nnc1SCc1nc(-c2ccc(OC)nn2)no1	ZINC000450672599	ED	On-Demand	Anodyne	AXIN2	0	45
C[C@H](NCc1cn(CC2CC2)nn1)c1ccc(F)c(Cl)c1	ZINC000450672603	DG	On-Demand	Anodyne	MAP3K8	51	33
C[C@@H](NCc1cn(CC2CC2)nn1)c1ccc(F)c(Cl)c1	ZINC000450672604	DG	On-Demand	Anodyne	MAP3K8	51	33
CN(C)C(=O)C[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450672628	EH	On-Demand	Anodyne	METAP1	43	42
CN(C)C(=O)C[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450672628	EH	On-Demand	Anodyne	UTS2	49	41
CN(C)C(=O)C[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450672629	EH	On-Demand	Anodyne	METAP1	43	42
CN(C)C(=O)C[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450672629	EH	On-Demand	Anodyne	UTS2	49	41
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H](C)Oc2ccccn2)C1	ZINC000450672641	CC	On-Demand	Anodyne	EPHX2	21	43
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H](C)Oc2ccccn2)C1	ZINC000450672641	CC	On-Demand	Anodyne	BIRC2	44	38
CNC(=O)N[C@H]1CCN(C(=O)[C@@H](C)Oc2ccccn2)C1	ZINC000450672642	CC	On-Demand	Anodyne	EPHX2	21	43
CNC(=O)N[C@H]1CCN(C(=O)[C@@H](C)Oc2ccccn2)C1	ZINC000450672642	CC	On-Demand	Anodyne	BIRC2	44	38
CNC(=O)N[C@H]1CCN(C(=O)[C@H](C)Oc2ccccn2)C1	ZINC000450672643	CC	On-Demand	Anodyne	EPHX2	21	43
CNC(=O)N[C@H]1CCN(C(=O)[C@H](C)Oc2ccccn2)C1	ZINC000450672643	CC	On-Demand	Anodyne	BIRC2	44	38
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](C)Oc2ccccn2)C1	ZINC000450672644	CC	On-Demand	Anodyne	EPHX2	21	43
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](C)Oc2ccccn2)C1	ZINC000450672644	CC	On-Demand	Anodyne	BIRC2	44	38
CC[C@@H](O)CC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450672744	EE	On-Demand	Anodyne	BCL2A1	44	37
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1ccc(F)cc1F	ZINC000450672749	GH	On-Demand	Anodyne	MTNR1A	48	36
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1ccc(F)cc1F	ZINC000450672750	GH	On-Demand	Anodyne	MTNR1A	48	36
C=C(C)CN(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450672751	CE	On-Demand	Mild	PSBA	0	49
Cc1ccc(NC(=O)c2ccc(N[C@H]3CC[C@@H](CC#N)C3)nc2)cc1	ZINC000450672754	EI	On-Demand	Mild	P4HTM	0	46
Cc1cccc2c1O[C@H](C(=O)NC1(C#N)CCN(Cc3ccccc3)CC1)C2	ZINC000450672759	GF	On-Demand	Mild	SIGMAR1	55	44
Cc1cccc2c1O[C@H](C(=O)NC1(C#N)CCN(Cc3ccccc3)CC1)C2	ZINC000450672759	GF	On-Demand	Mild	NPFFR1	50	34
Cc1cccc2c1O[C@@H](C(=O)NC1(C#N)CCN(Cc3ccccc3)CC1)C2	ZINC000450672760	GF	On-Demand	Mild	SIGMAR1	55	44
Cc1cccc2c1O[C@@H](C(=O)NC1(C#N)CCN(Cc3ccccc3)CC1)C2	ZINC000450672760	GF	On-Demand	Mild	NPFFR1	50	34
CC[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ncc[nH]1	ZINC000450672768	EH	On-Demand	Anodyne	RBP4	71	39
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672806	FD	On-Demand	Anodyne	FKBP1A	25	41
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672806	FD	On-Demand	Anodyne	DRD4	42	32
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672806	FD	On-Demand	Anodyne	MTNR1A	29	43
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672806	FD	On-Demand	Anodyne	MTNR1B	38	43
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672807	FD	On-Demand	Anodyne	FKBP1A	25	41
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672807	FD	On-Demand	Anodyne	DRD4	42	32
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672807	FD	On-Demand	Anodyne	MTNR1A	29	43
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672807	FD	On-Demand	Anodyne	MTNR1B	38	43
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672808	FD	On-Demand	Anodyne	FKBP1A	25	41
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672808	FD	On-Demand	Anodyne	DRD4	42	32
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672808	FD	On-Demand	Anodyne	MTNR1A	29	43
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672808	FD	On-Demand	Anodyne	MTNR1B	38	43
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672809	FD	On-Demand	Anodyne	FKBP1A	25	41
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672809	FD	On-Demand	Anodyne	DRD4	42	32
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672809	FD	On-Demand	Anodyne	MTNR1A	29	43
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)CCOc1cccc(OC)c1	ZINC000450672809	FD	On-Demand	Anodyne	MTNR1B	38	43
CNC(=O)[C@H](NCC/C=C\c1ccccc1)C(C)C	ZINC000450672815	CE	On-Demand	Anodyne	ADAM17	0	41
CNC(=O)[C@H](NCC/C=C\c1ccccc1)C(C)C	ZINC000450672815	CE	On-Demand	Anodyne	SLC6A5	31	40
CNC(=O)[C@@H](NCC/C=C\c1ccccc1)C(C)C	ZINC000450672816	CE	On-Demand	Anodyne	ADAM17	0	41
CNC(=O)[C@@H](NCC/C=C\c1ccccc1)C(C)C	ZINC000450672816	CE	On-Demand	Anodyne	SLC6A5	31	40
CNC(=O)[C@@H](NCC/C=C/c1ccccc1)C(C)C	ZINC000450672817	CE	On-Demand	Anodyne	ADAM17	0	41
CNC(=O)[C@@H](NCC/C=C/c1ccccc1)C(C)C	ZINC000450672817	CE	On-Demand	Anodyne	SLC6A5	31	40
CNC(=O)[C@H](NCC/C=C/c1ccccc1)C(C)C	ZINC000450672818	CE	On-Demand	Anodyne	ADAM17	0	41
CNC(=O)[C@H](NCC/C=C/c1ccccc1)C(C)C	ZINC000450672818	CE	On-Demand	Anodyne	SLC6A5	31	40
C[C@H]1Cc2cccc(C(=O)NC3(C#N)CCN(Cc4ccccc4)CC3)c2O1	ZINC000450672833	GG	On-Demand	Mild	SIGMAR1	54	41
C[C@H]1Cc2cccc(C(=O)NC3(C#N)CCN(Cc4ccccc4)CC3)c2O1	ZINC000450672833	GG	On-Demand	Mild	NPFFR1	53	34
C[C@@H]1Cc2cccc(C(=O)NC3(C#N)CCN(Cc4ccccc4)CC3)c2O1	ZINC000450672834	GG	On-Demand	Mild	SIGMAR1	54	41
C[C@@H]1Cc2cccc(C(=O)NC3(C#N)CCN(Cc4ccccc4)CC3)c2O1	ZINC000450672834	GG	On-Demand	Mild	NPFFR1	53	34
COc1ccc([C@@H](C)NC[C@@H](Cc2ccccc2)OC)cc1OC	ZINC000450672869	EH	On-Demand	Anodyne	ADRB3	15	45
COc1ccc([C@H](C)NC[C@@H](Cc2ccccc2)OC)cc1OC	ZINC000450672870	EH	On-Demand	Anodyne	ADRB3	15	45
COc1ccc([C@@H](C)NC[C@H](Cc2ccccc2)OC)cc1OC	ZINC000450672871	EH	On-Demand	Anodyne	ADRB3	15	45
COc1ccc([C@H](C)NC[C@H](Cc2ccccc2)OC)cc1OC	ZINC000450672872	EH	On-Demand	Anodyne	ADRB3	15	45
Cc1nn(C)cc1COc1cccnc1[N+](=O)[O-]	ZINC000450672883	BD	On-Demand	Bother	S1PR4	0	44
CCc1cc(N[C@H](C)CCC=C(C)C)n2ncnc2n1	ZINC000450672884	CG	On-Demand	Anodyne	DHOD	0	47
CCc1cc(N[C@@H](C)CCC=C(C)C)n2ncnc2n1	ZINC000450672885	CG	On-Demand	Anodyne	DHOD	0	47
CCC[C@@H](OC)C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450672888	CC	On-Demand	Anodyne	EPHX2	18	40
CCC[C@H](OC)C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450672889	CC	On-Demand	Anodyne	EPHX2	18	40
CCC[C@@H](OC)C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450672890	CC	On-Demand	Anodyne	EPHX2	18	40
CCC[C@H](OC)C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450672891	CC	On-Demand	Anodyne	EPHX2	18	40
COC(=O)c1csc(CN[C@@H](C)c2ccc(OC)c(OC)c2)n1	ZINC000450672903	EF	On-Demand	Anodyne	ENPP1	50	32
COC(=O)c1csc(CN[C@H](C)c2ccc(OC)c(OC)c2)n1	ZINC000450672904	EF	On-Demand	Anodyne	ENPP1	50	32
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450672927	FE	On-Demand	Anodyne	EPHX2	15	42
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450672927	FE	On-Demand	Anodyne	CCR8	23	40
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450672928	FE	On-Demand	Anodyne	EPHX2	15	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450672928	FE	On-Demand	Anodyne	CCR8	23	40
CCOc1nc2ccc(C(=O)N[C@H](CC)c3ncc[nH]3)cc2[nH]1	ZINC000450672954	DF	On-Demand	Anodyne	UTS2	40	32
CCOc1nc2ccc(C(=O)N[C@@H](CC)c3ncc[nH]3)cc2[nH]1	ZINC000450672955	DF	On-Demand	Anodyne	UTS2	40	32
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672976	ED	On-Demand	Anodyne	ACE	70	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672976	ED	On-Demand	Anodyne	MME	42	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672976	ED	On-Demand	Anodyne	AGTR2	63	38
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672976	ED	On-Demand	Anodyne	CTRA_BOVIN	41	33
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672976	ED	On-Demand	Anodyne	TRY1_BOVIN	47	35
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672976	ED	On-Demand	Anodyne	CELA2A	41	33
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672976	ED	On-Demand	Anodyne	BRCA1	61	33
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672976	ED	On-Demand	Anodyne	TMPRSS11D	51	33
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672977	ED	On-Demand	Anodyne	ACE	70	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672977	ED	On-Demand	Anodyne	MME	42	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672977	ED	On-Demand	Anodyne	AGTR2	63	38
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672977	ED	On-Demand	Anodyne	CTRA_BOVIN	41	33
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672977	ED	On-Demand	Anodyne	TRY1_BOVIN	47	35
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672977	ED	On-Demand	Anodyne	CELA2A	41	33
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672977	ED	On-Demand	Anodyne	BRCA1	61	33
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672977	ED	On-Demand	Anodyne	TMPRSS11D	51	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672978	ED	On-Demand	Anodyne	ACE	70	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672978	ED	On-Demand	Anodyne	MME	42	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672978	ED	On-Demand	Anodyne	AGTR2	63	38
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672978	ED	On-Demand	Anodyne	CTRA_BOVIN	41	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672978	ED	On-Demand	Anodyne	TRY1_BOVIN	47	35
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672978	ED	On-Demand	Anodyne	CELA2A	41	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672978	ED	On-Demand	Anodyne	BRCA1	61	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](Cc1ccccc1)OC	ZINC000450672978	ED	On-Demand	Anodyne	TMPRSS11D	51	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672979	ED	On-Demand	Anodyne	ACE	70	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672979	ED	On-Demand	Anodyne	MME	42	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672979	ED	On-Demand	Anodyne	AGTR2	63	38
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672979	ED	On-Demand	Anodyne	CTRA_BOVIN	41	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672979	ED	On-Demand	Anodyne	TRY1_BOVIN	47	35
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672979	ED	On-Demand	Anodyne	CELA2A	41	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672979	ED	On-Demand	Anodyne	BRCA1	61	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](Cc1ccccc1)OC	ZINC000450672979	ED	On-Demand	Anodyne	TMPRSS11D	51	33
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1cccc(SC)c1	ZINC000450672980	DE	On-Demand	Anodyne	PREP	20	50
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1cccc(SC)c1	ZINC000450672981	DE	On-Demand	Anodyne	PREP	20	50
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1cccc(SC)c1	ZINC000450672982	DE	On-Demand	Anodyne	PREP	20	50
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1cccc(SC)c1	ZINC000450672983	DE	On-Demand	Anodyne	PREP	20	50
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1cccc(C#N)c1Br	ZINC000450672993	GE	On-Demand	Mild	PREP	17	41
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1cccc(C#N)c1Br	ZINC000450672994	GE	On-Demand	Mild	PREP	17	41
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1cccc(C#N)c1Br	ZINC000450672995	GE	On-Demand	Mild	PREP	17	41
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1cccc(C#N)c1Br	ZINC000450672996	GE	On-Demand	Mild	PREP	17	41
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673010	FE	On-Demand	Anodyne	OPRM1	15	44
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673010	FE	On-Demand	Anodyne	OPRK1	41	42
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673010	FE	On-Demand	Anodyne	HTR4	40	33
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673011	FE	On-Demand	Anodyne	OPRM1	15	44
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673011	FE	On-Demand	Anodyne	OPRK1	41	42
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673011	FE	On-Demand	Anodyne	HTR4	40	33
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673012	FE	On-Demand	Anodyne	OPRM1	15	44
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673012	FE	On-Demand	Anodyne	OPRK1	41	42
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673012	FE	On-Demand	Anodyne	HTR4	40	33
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673013	FE	On-Demand	Anodyne	OPRM1	15	44
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673013	FE	On-Demand	Anodyne	OPRK1	41	42
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450673013	FE	On-Demand	Anodyne	HTR4	40	33
CC[C@@H](NC(=O)c1cccc(C(F)(F)F)n1)c1ncc[nH]1	ZINC000450673018	CF	On-Demand	Anodyne	TACR3	44	36
CC[C@H](NC(=O)c1cccc(C(F)(F)F)n1)c1ncc[nH]1	ZINC000450673019	CF	On-Demand	Anodyne	TACR3	44	36
COc1cccc(OCCC(=O)N[C@H]2CC(C)(C)OC2(C)C)c1	ZINC000450673029	DF	On-Demand	Anodyne	MTNR1A	33	45
COc1cccc(OCCC(=O)N[C@@H]2CC(C)(C)OC2(C)C)c1	ZINC000450673030	DF	On-Demand	Anodyne	MTNR1A	33	45
CC(=O)NC[C@H](CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1)CC(C)C	ZINC000450673031	GF	On-Demand	Mild	NPFFR1	59	38
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)NC)C(C)C)cc1	ZINC000450673038	DD	On-Demand	Anodyne	ADAMTS4	38	47
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)NC)C(C)C)cc1	ZINC000450673038	DD	On-Demand	Anodyne	RORC	48	36
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)NC)C(C)C)cc1	ZINC000450673039	DD	On-Demand	Anodyne	ADAMTS4	38	47
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)NC)C(C)C)cc1	ZINC000450673039	DD	On-Demand	Anodyne	RORC	48	36
N#CC1(NC(=O)c2cccc(C(F)(F)F)n2)CCN(Cc2ccccc2)CC1	ZINC000450673040	GG	On-Demand	Mild	SIGMAR1	40	44
N#CC1(NC(=O)c2cccc(C(F)(F)F)n2)CCN(Cc2ccccc2)CC1	ZINC000450673040	GG	On-Demand	Mild	NPFFR1	56	36
CC1(C)C[C@H](NC(=O)Cc2cc3ccccc3s2)C(C)(C)O1	ZINC000450673062	DH	On-Demand	Anodyne	AROQ	29	43
CC1(C)C[C@@H](NC(=O)Cc2cc3ccccc3s2)C(C)(C)O1	ZINC000450673067	DH	On-Demand	Anodyne	AROQ	29	43
N#CC[C@@H]1CC[C@H](Nc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450673068	DJ	On-Demand	Mild	HRP1_PLAFA	67	32
N#CC[C@@H]1CC[C@H](Nc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450673068	DJ	On-Demand	Mild	HNMT	47	33
Cc1nc(C(C)C)oc1COc1cccnc1[N+](=O)[O-]	ZINC000450673077	CF	On-Demand	Bother	S1PR4	0	41
N#CC1(NC(=O)c2cncc(Cl)c2)CCN(Cc2ccccc2)CC1	ZINC000450673078	FG	On-Demand	Mild	ACHE	19	40
N#CC1(NC(=O)c2cncc(Cl)c2)CCN(Cc2ccccc2)CC1	ZINC000450673078	FG	On-Demand	Mild	DRD3	17	41
N#CC1(NC(=O)c2cncc(Cl)c2)CCN(Cc2ccccc2)CC1	ZINC000450673078	FG	On-Demand	Mild	SIGMAR1	49	39
N#CC1(NC(=O)c2cncc(Cl)c2)CCN(Cc2ccccc2)CC1	ZINC000450673078	FG	On-Demand	Mild	FAAH	18	41
N#CC1(NC(=O)c2cncc(Cl)c2)CCN(Cc2ccccc2)CC1	ZINC000450673078	FG	On-Demand	Mild	NPFFR1	58	39
CNC(=O)N[C@H]1CCN(C(=O)C(C)(C)c2cccc3ccccc23)C1	ZINC000450673088	EF	On-Demand	Anodyne	MTNR1A	25	40
CNC(=O)N[C@H]1CCN(C(=O)C(C)(C)c2cccc3ccccc23)C1	ZINC000450673088	EF	On-Demand	Anodyne	MTNR1B	0	40
CNC(=O)N[C@@H]1CCN(C(=O)C(C)(C)c2cccc3ccccc23)C1	ZINC000450673089	EF	On-Demand	Anodyne	MTNR1A	25	40
CNC(=O)N[C@@H]1CCN(C(=O)C(C)(C)c2cccc3ccccc23)C1	ZINC000450673089	EF	On-Demand	Anodyne	MTNR1B	0	40
Cc1ccn2ncc(C(=O)NC3(C#N)CCN(Cc4ccccc4)CC3)c2c1	ZINC000450673093	FF	On-Demand	Mild	EPHB3	36	49
Cc1ccn2ncc(C(=O)NC3(C#N)CCN(Cc4ccccc4)CC3)c2c1	ZINC000450673093	FF	On-Demand	Mild	NPFFR1	51	35
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	ADORA1	167	75
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	SLC29A1	134	55
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	P2RY12	52	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	ADORA2A	60	68
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	ADORA2B	27	55
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	DNMT1	22	41
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	GAPC	0	40
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	ADK	73	54
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	AK3	0	40
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	AHCY	55	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	P2RX4	34	40
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	P2RX1	45	39
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	P2RY1	34	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	P2RY11	0	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	AMD1	25	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	ITPR1	49	36
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	AK2	0	40
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	NS5B	0	47
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	ADORA3	134	68
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	OXGR1	120	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	MTAP	0	43
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	QARS	0	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	IMPDH2	43	35
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	AK	0	48
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	SETD7	0	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	PRMT1	0	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	MBTA	0	43
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	DNMT3B	79	43
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	Q4VQ11_PIG	82	59
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	GPR17	55	42
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	KMT2A	0	41
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	DOT1L	93	48
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	SUV39H1	0	41
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	METJ	0	43
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	SMYD2	0	41
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	EZH1	0	41
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	KMT5C	0	41
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	SETDB1	0	41
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673160	GC	On-Demand	Anodyne	SETD2	0	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	ADORA1	167	75
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	SLC29A1	134	55
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	P2RY12	52	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	ADORA2A	60	68
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	ADORA2B	27	55
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	DNMT1	22	41
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	GAPC	0	40
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	ADK	73	54
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	AK3	0	40
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	AHCY	55	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	P2RX4	34	40
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	P2RX1	45	39
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	P2RY1	34	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	P2RY11	0	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	AMD1	25	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	ITPR1	49	36
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	AK2	0	40
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	NS5B	0	47
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	ADORA3	134	68
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	OXGR1	120	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	MTAP	0	43
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	QARS	0	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	IMPDH2	43	35
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	AK	0	48
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	SETD7	0	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	PRMT1	0	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	MBTA	0	43
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	DNMT3B	79	43
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	Q4VQ11_PIG	82	59
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	GPR17	55	42
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	KMT2A	0	41
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	DOT1L	93	48
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	SUV39H1	0	41
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	METJ	0	43
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	SMYD2	0	41
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	EZH1	0	41
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	KMT5C	0	41
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	SETDB1	0	41
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450673161	GC	On-Demand	Anodyne	SETD2	0	42
CCCn1c(O)nnc1SCc1nc(-c2cc(C)ccn2)no1	ZINC000450673162	EE	On-Demand	Anodyne	AXIN2	0	41
COc1cc([C@H](C)NCCc2ccc(Cl)cc2)ccc1OCCO	ZINC000450673164	EH	On-Demand	Anodyne	ADRB3	15	40
COc1cc([C@@H](C)NCCc2ccc(Cl)cc2)ccc1OCCO	ZINC000450673167	EH	On-Demand	Anodyne	ADRB3	15	40
CC[C@@H](CNS(C)(=O)=O)Nc1ncc([N+](=O)[O-])s1	ZINC000450673169	CC	On-Demand	Bother	MAPK9	15	43
CC[C@H](CNS(C)(=O)=O)Nc1ncc([N+](=O)[O-])s1	ZINC000450673170	CC	On-Demand	Bother	MAPK9	15	43
Cc1ccccc1CNc1ccccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450673171	DH	On-Demand	Anodyne	CCR8	75	36
Cc1ccccc1CNc1ccccc1NC(=O)[C@H](O)C1CCC1	ZINC000450673172	DH	On-Demand	Anodyne	CCR8	75	36
CNC(=O)N[C@@H]1CCN(C(=O)c2ccccc2-n2ccc(C)n2)C1	ZINC000450673181	ED	On-Demand	Anodyne	MTNR1A	0	40
CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2-n2ccc(C)n2)C1	ZINC000450673182	ED	On-Demand	Anodyne	MTNR1A	0	40
COc1ccc(OC(F)(F)F)c(C(=O)N2CCO[C@@]3(CCOC3)C2)c1	ZINC000450673198	FE	On-Demand	Anodyne	EPHX2	29	43
COc1ccc(OC(F)(F)F)c(C(=O)N2CCO[C@]3(CCOC3)C2)c1	ZINC000450673199	FE	On-Demand	Anodyne	EPHX2	29	43
CC[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ncc[nH]1	ZINC000450673201	CF	On-Demand	Anodyne	GPR88	0	45
N#CC[C@@H]1CC[C@H](Nc2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450673222	EH	On-Demand	Mild	AVPR2	82	43
N#CC[C@@H]1CC[C@H](Nc2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450673222	EH	On-Demand	Mild	AVPR1A	50	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1nc2cccnc2n1C	ZINC000450673226	EE	On-Demand	Anodyne	SCN9A	17	45
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2)[C@@H]2CCOC2)c(OC)c1	ZINC000450673238	GG	On-Demand	Anodyne	MTNR1A	63	37
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2)[C@@H]2CCOC2)c(OC)c1	ZINC000450673238	GG	On-Demand	Anodyne	MTNR1B	54	37
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2)[C@H]2CCOC2)c(OC)c1	ZINC000450673239	GG	On-Demand	Anodyne	MTNR1A	63	37
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2)[C@H]2CCOC2)c(OC)c1	ZINC000450673239	GG	On-Demand	Anodyne	MTNR1B	54	37
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2)[C@H]2CCOC2)c(OC)c1	ZINC000450673240	GG	On-Demand	Anodyne	MTNR1A	63	37
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2)[C@H]2CCOC2)c(OC)c1	ZINC000450673240	GG	On-Demand	Anodyne	MTNR1B	54	37
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2)[C@@H]2CCOC2)c(OC)c1	ZINC000450673241	GG	On-Demand	Anodyne	MTNR1A	63	37
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2)[C@@H]2CCOC2)c(OC)c1	ZINC000450673241	GG	On-Demand	Anodyne	MTNR1B	54	37
N#CC1(NC(=O)c2ccc3c(c2)OC(F)(F)O3)CCN(Cc2ccccc2)CC1	ZINC000450673307	GG	On-Demand	Mild	ACHE	18	44
N#CC1(NC(=O)c2ccc3c(c2)OC(F)(F)O3)CCN(Cc2ccccc2)CC1	ZINC000450673307	GG	On-Demand	Mild	SIGMAR1	48	41
N#CC1(NC(=O)c2ccc3c(c2)OC(F)(F)O3)CCN(Cc2ccccc2)CC1	ZINC000450673307	GG	On-Demand	Mild	NPFFR1	53	36
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450673308	FF	On-Demand	Anodyne	COLA	40	35
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450673309	FF	On-Demand	Anodyne	COLA	40	35
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450673310	FF	On-Demand	Anodyne	COLA	40	35
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450673311	FF	On-Demand	Anodyne	COLA	40	35
N#CC[C@@H]1CC[C@H](Nc2ccnc3cc(Br)ccc23)C1	ZINC000450673334	EI	On-Demand	Mild	HNMT	42	32
Cc1nc(C)n(CCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)n1	ZINC000450673342	GE	On-Demand	Mild	NPFFR1	56	38
CNC(=O)[C@@H](NCCN(C)Cc1ccccc1)C(C)C	ZINC000450673361	CD	On-Demand	Anodyne	POL	0	50
CNC(=O)[C@H](NCCN(C)Cc1ccccc1)C(C)C	ZINC000450673363	CD	On-Demand	Anodyne	POL	0	50
CC[C@H](CNS(C)(=O)=O)Nc1ncnc2c(C)csc12	ZINC000450673373	DD	On-Demand	Anodyne	LPAR2	23	45
CC[C@@H](CNS(C)(=O)=O)Nc1ncnc2c(C)csc12	ZINC000450673377	DD	On-Demand	Anodyne	LPAR2	23	45
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673403	FG	On-Demand	Anodyne	CXCR2	0	42
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673403	FG	On-Demand	Anodyne	PRNP	44	36
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673406	FG	On-Demand	Anodyne	CXCR2	0	42
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673406	FG	On-Demand	Anodyne	PRNP	44	36
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673407	FG	On-Demand	Anodyne	CXCR2	0	42
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673407	FG	On-Demand	Anodyne	PRNP	44	36
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673409	FG	On-Demand	Anodyne	CXCR2	0	42
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673409	FG	On-Demand	Anodyne	PRNP	44	36
C=CCOc1ccc(CC(=O)N2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450673410	DD	On-Demand	Mild	BIRC2	15	43
C=CCOc1ccc(CC(=O)N2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450673412	DD	On-Demand	Mild	BIRC2	15	43
COC(=O)c1csc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)n1	ZINC000450673423	DF	On-Demand	Bother	CACNA1C	58	39
COC(=O)c1csc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)n1	ZINC000450673423	DF	On-Demand	Bother	CACNA1D	89	40
COC(=O)c1csc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)n1	ZINC000450673424	DF	On-Demand	Bother	CACNA1C	58	39
COC(=O)c1csc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)n1	ZINC000450673424	DF	On-Demand	Bother	CACNA1D	89	40
Cc1ccccc1CNc1ccccc1NC(=O)CS(=O)(=O)C1CC1	ZINC000450673425	FG	On-Demand	Anodyne	CCR8	59	37
C/C=C\COc1cccc(CC(=O)N2CC[C@@H](NC(=O)NC)C2)c1	ZINC000450673428	ED	On-Demand	Anodyne	BIRC2	20	41
C/C=C/COc1cccc(CC(=O)N2CC[C@H](NC(=O)NC)C2)c1	ZINC000450673429	ED	On-Demand	Anodyne	BIRC2	20	41
C/C=C\COc1cccc(CC(=O)N2CC[C@H](NC(=O)NC)C2)c1	ZINC000450673430	ED	On-Demand	Anodyne	BIRC2	20	41
C/C=C/COc1cccc(CC(=O)N2CC[C@@H](NC(=O)NC)C2)c1	ZINC000450673432	ED	On-Demand	Anodyne	BIRC2	20	41
O=[N+]([O-])c1ncccc1OCCC1=CCCCC1	ZINC000450673449	BG	On-Demand	Bother	S1PR4	0	50
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450673450	FE	On-Demand	Anodyne	PRCP	19	40
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450673450	FE	On-Demand	Anodyne	EPHX2	27	43
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450673451	FE	On-Demand	Anodyne	PRCP	19	40
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450673451	FE	On-Demand	Anodyne	EPHX2	27	43
C[C@@H](NCC1CC(F)(F)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673455	FJ	On-Demand	Anodyne	HTR1F	37	40
C[C@@H](NCC1CC(F)(F)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673455	FJ	On-Demand	Anodyne	PRNP	55	35
C[C@H](NCC1CC(F)(F)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673456	FJ	On-Demand	Anodyne	HTR1F	37	40
C[C@H](NCC1CC(F)(F)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450673456	FJ	On-Demand	Anodyne	PRNP	55	35
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	MME	68	39
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	TIMP3	40	32
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	CAPNS1	46	32
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	SOAT1	25	40
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	F11	45	36
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	CAPN1	52	37
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	CAPN2	74	34
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	ACE2	65	39
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	FPR1	40	33
CC[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673460	CE	On-Demand	Anodyne	PDS	41	34
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	MME	68	39
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	TIMP3	40	32
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	CAPNS1	46	32
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	SOAT1	25	40
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	F11	45	36
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	CAPN1	52	37
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	CAPN2	74	34
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	ACE2	65	39
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	FPR1	40	33
CC[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673468	CE	On-Demand	Anodyne	PDS	41	34
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	MME	68	39
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	TIMP3	40	32
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	CAPNS1	46	32
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	SOAT1	25	40
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	F11	45	36
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	CAPN1	52	37
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	CAPN2	74	34
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	ACE2	65	39
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	FPR1	40	33
CC[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673471	CE	On-Demand	Anodyne	PDS	41	34
CNC(=O)N[C@@H]1CCN(C(=O)c2cnn3ccc(C)cc23)C1	ZINC000450673488	DC	On-Demand	Anodyne	EPHB3	25	42
CNC(=O)N[C@H]1CCN(C(=O)c2cnn3ccc(C)cc23)C1	ZINC000450673489	DC	On-Demand	Anodyne	EPHB3	25	42
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	MME	68	39
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	TIMP3	40	32
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	CAPNS1	46	32
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	SOAT1	25	40
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	F11	45	36
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	CAPN1	52	37
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	CAPN2	74	34
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	ACE2	65	39
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	FPR1	40	33
CC[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ncc[nH]1	ZINC000450673495	CE	On-Demand	Anodyne	PDS	41	34
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1ccc2cnccc2c1	ZINC000450673502	EE	On-Demand	Anodyne	PREP	18	45
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1ccc2cnccc2c1	ZINC000450673503	EE	On-Demand	Anodyne	PREP	18	45
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1ccc2cnccc2c1	ZINC000450673504	EE	On-Demand	Anodyne	PREP	18	45
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1ccc2cnccc2c1	ZINC000450673505	EE	On-Demand	Anodyne	PREP	18	45
N#CC1(NC(=O)c2ccnn2CC(F)(F)F)CCN(Cc2ccccc2)CC1	ZINC000450673510	GF	On-Demand	Mild	SIGMAR1	36	40
N#CC1(NC(=O)c2ccnn2CC(F)(F)F)CCN(Cc2ccccc2)CC1	ZINC000450673510	GF	On-Demand	Mild	NPFFR1	51	35
CCS(=O)(=O)c1ccc(CNC(C)(C)c2cccc(C)c2)cc1	ZINC000450673525	EH	On-Demand	Anodyne	FBP1	18	40
CCS(=O)(=O)c1ccc(CNC(C)(C)c2cccc(C)c2)cc1	ZINC000450673525	EH	On-Demand	Anodyne	RORC	42	34
CNC(=O)[C@H](NCc1c(C)cccc1Cl)C(C)C	ZINC000450673533	CF	On-Demand	Anodyne	P2RX7	16	44
CNC(=O)[C@@H](NCc1c(C)cccc1Cl)C(C)C	ZINC000450673534	CF	On-Demand	Anodyne	P2RX7	16	44
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1nc2cccnc2n1C	ZINC000450673547	GG	On-Demand	Anodyne	TRPV1	18	43
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1nc2cccnc2n1C	ZINC000450673547	GG	On-Demand	Anodyne	MAP3K5	46	34
N#CC[C@@H]1CC[C@H](Nc2cc(=O)n3ccccc3n2)C1	ZINC000450673548	CE	On-Demand	Mild	IRAK4	19	42
COc1ccc(CNC(=O)CCNC(C)(C)c2cccc(F)c2)c(OC)c1	ZINC000450673594	FG	On-Demand	Anodyne	MTNR1A	54	38
COc1ccc(CNC(=O)CCNC(C)(C)c2cccc(F)c2)c(OC)c1	ZINC000450673594	FG	On-Demand	Anodyne	MTNR1B	47	36
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450673610	GD	On-Demand	Anodyne	EPHX2	28	48
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450673611	GD	On-Demand	Anodyne	EPHX2	28	48
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450673613	GD	On-Demand	Anodyne	EPHX2	28	48
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450673614	GD	On-Demand	Anodyne	EPHX2	28	48
COC(=O)C1(CN[C@@H](COc2ccccc2F)c2ccccc2)CC1	ZINC000450673633	EG	On-Demand	Anodyne	SDH1	0	42
COC(=O)C1(CN[C@@H](COc2ccccc2F)c2ccccc2)CC1	ZINC000450673633	EG	On-Demand	Anodyne	MAN1B1	41	45
COC(=O)C1(CN[C@H](COc2ccccc2F)c2ccccc2)CC1	ZINC000450673634	EG	On-Demand	Anodyne	SDH1	0	42
COC(=O)C1(CN[C@H](COc2ccccc2F)c2ccccc2)CC1	ZINC000450673634	EG	On-Demand	Anodyne	MAN1B1	41	45
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450673668	GF	On-Demand	Anodyne	CPT1A	44	31
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450673668	GF	On-Demand	Anodyne	CSF1R	19	41
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450673668	GF	On-Demand	Anodyne	TAAR1	16	45
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450673668	GF	On-Demand	Anodyne	KCNK3	57	39
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450673669	GF	On-Demand	Anodyne	CPT1A	44	31
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450673669	GF	On-Demand	Anodyne	CSF1R	19	41
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450673669	GF	On-Demand	Anodyne	TAAR1	16	45
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450673669	GF	On-Demand	Anodyne	KCNK3	57	39
COC(=O)c1ccc(CN[C@H](C)c2ccc(OCCO)c(OC)c2)cc1Cl	ZINC000450673672	GG	On-Demand	Anodyne	PDE6A	44	33
COC(=O)c1ccc(CN[C@@H](C)c2ccc(OCCO)c(OC)c2)cc1Cl	ZINC000450673673	GG	On-Demand	Anodyne	PDE6A	44	33
CC[C@H](CNS(C)(=O)=O)Nc1nc2ccc(OC)cc2nc1C	ZINC000450673680	ED	On-Demand	Anodyne	CRHR1	15	40
CC[C@@H](CNS(C)(=O)=O)Nc1nc2ccc(OC)cc2nc1C	ZINC000450673681	ED	On-Demand	Anodyne	CRHR1	15	40
O=C(c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450673691	GF	On-Demand	Bother	L3MBTL1	0	44
O=C(c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450673691	GF	On-Demand	Bother	L3MBTL3	25	44
O=C(c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450673692	GF	On-Demand	Bother	L3MBTL1	0	44
O=C(c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450673692	GF	On-Demand	Bother	L3MBTL3	25	44
O=C(c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450673693	GF	On-Demand	Bother	L3MBTL1	0	44
O=C(c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450673693	GF	On-Demand	Bother	L3MBTL3	25	44
COC(=O)c1ccc(C(=O)CSc2ccc(C)c(C)c2)o1	ZINC000450673706	DH	On-Demand	Anodyne	FAS	44	34
N#Cc1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1Cl	ZINC000450673712	DH	On-Demand	Mild	PGR	0	41
N#Cc1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1Cl	ZINC000450673712	DH	On-Demand	Mild	NR3C2	31	44
N#Cc1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1Cl	ZINC000450673713	DH	On-Demand	Mild	PGR	0	41
N#Cc1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1Cl	ZINC000450673713	DH	On-Demand	Mild	NR3C2	31	44
N#Cc1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1Cl	ZINC000450673714	DH	On-Demand	Mild	PGR	0	41
N#Cc1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1Cl	ZINC000450673714	DH	On-Demand	Mild	NR3C2	31	44
N#Cc1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1Cl	ZINC000450673715	DH	On-Demand	Mild	PGR	0	41
N#Cc1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1Cl	ZINC000450673715	DH	On-Demand	Mild	NR3C2	31	44
CCN(CCO)CCNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450673732	GE	On-Demand	Anodyne	HTR1A	19	43
CCN(CCO)CCNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450673732	GE	On-Demand	Anodyne	DRD2	22	45
CCN(CCO)CCNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450673732	GE	On-Demand	Anodyne	DRD1	0	40
CCN(CCO)CCNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450673732	GE	On-Demand	Anodyne	DRD4	41	33
CCN(CCO)CCNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450673732	GE	On-Demand	Anodyne	DRD3	40	45
CCN(CCO)CCNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450673732	GE	On-Demand	Anodyne	PDE2A	23	40
CCN(CCO)CCNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450673732	GE	On-Demand	Anodyne	CPT1A	44	31
CCN(CCO)CCNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450673732	GE	On-Demand	Anodyne	HPGD	42	54
COC(=O)C1(CN[C@@H](CC(C)C)c2ccccc2OC)CC1	ZINC000450673747	DG	On-Demand	Anodyne	ANPEP	16	40
COC(=O)C1(CN[C@H](CC(C)C)c2ccccc2OC)CC1	ZINC000450673748	DG	On-Demand	Anodyne	ANPEP	16	40
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(OC(F)(F)F)c1	ZINC000450673757	DF	On-Demand	Anodyne	PDS	40	34
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(OC(F)(F)F)c1	ZINC000450673758	DF	On-Demand	Anodyne	PDS	40	34
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(OC(F)(F)F)c1	ZINC000450673759	DF	On-Demand	Anodyne	PDS	40	34
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(OC(F)(F)F)c1	ZINC000450673760	DF	On-Demand	Anodyne	PDS	40	34
CCC(CC)(CCSc1nnc(-c2ccccc2OC)o1)C(=O)OC	ZINC000450673764	FI	On-Demand	Anodyne	ALOX15	66	40
CS(=O)(=O)c1ccc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)cc1	ZINC000450673788	FI	On-Demand	Anodyne	PTGS2	36	48
CS(=O)(=O)c1ccc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)cc1	ZINC000450673789	FI	On-Demand	Anodyne	PTGS2	36	48
CCS(=O)(=O)c1ccc(CNC(C)(C)c2cccc(F)c2)cc1	ZINC000450673812	EH	On-Demand	Anodyne	RORC	44	43
N#CC1(NC(=O)[C@@H]2CCCCC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450673832	FG	On-Demand	Mild	SIGMAR1	58	42
N#CC1(NC(=O)[C@@H]2CCCCC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450673832	FG	On-Demand	Mild	CTSK	22	44
N#CC1(NC(=O)[C@@H]2CCCCC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450673832	FG	On-Demand	Mild	NPFFR1	57	39
N#CC1(NC(=O)[C@H]2CCCCC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450673833	FG	On-Demand	Mild	SIGMAR1	58	42
N#CC1(NC(=O)[C@H]2CCCCC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450673833	FG	On-Demand	Mild	CTSK	22	44
N#CC1(NC(=O)[C@H]2CCCCC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450673833	FG	On-Demand	Mild	NPFFR1	57	39
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673843	GF	On-Demand	Anodyne	SLC6A1	84	44
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673843	GF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673843	GF	On-Demand	Anodyne	SLC6A3	42	45
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673844	GF	On-Demand	Anodyne	SLC6A1	84	44
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673844	GF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673844	GF	On-Demand	Anodyne	SLC6A3	42	45
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673845	GF	On-Demand	Anodyne	SLC6A1	84	44
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673845	GF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450673845	GF	On-Demand	Anodyne	SLC6A3	42	45
CO[C@H]1COCC[C@@H]1CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673846	FE	On-Demand	Mild	SIGMAR1	58	40
CO[C@H]1COCC[C@@H]1CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673846	FE	On-Demand	Mild	NPFFR1	55	36
CO[C@H]1COCC[C@H]1CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673847	FE	On-Demand	Mild	SIGMAR1	58	40
CO[C@H]1COCC[C@H]1CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673847	FE	On-Demand	Mild	NPFFR1	55	36
CO[C@@H]1COCC[C@H]1CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673848	FE	On-Demand	Mild	SIGMAR1	58	40
CO[C@@H]1COCC[C@H]1CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673848	FE	On-Demand	Mild	NPFFR1	55	36
CO[C@@H]1COCC[C@@H]1CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673849	FE	On-Demand	Mild	SIGMAR1	58	40
CO[C@@H]1COCC[C@@H]1CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673849	FE	On-Demand	Mild	NPFFR1	55	36
CCC(CC)Oc1ccc(C(=O)N[C@@H](CC)c2ncc[nH]2)cc1	ZINC000450673896	DH	On-Demand	Anodyne	UTS2	48	36
CCC(CC)Oc1ccc(C(=O)N[C@H](CC)c2ncc[nH]2)cc1	ZINC000450673897	DH	On-Demand	Anodyne	UTS2	48	36
C[C@H](OCCc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673907	GG	On-Demand	Mild	SIGMAR1	54	43
C[C@H](OCCc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673907	GG	On-Demand	Mild	NPFFR2	39	40
C[C@H](OCCc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673907	GG	On-Demand	Mild	NPFFR1	60	40
C[C@@H](OCCc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673908	GG	On-Demand	Mild	SIGMAR1	54	43
C[C@@H](OCCc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673908	GG	On-Demand	Mild	NPFFR2	39	40
C[C@@H](OCCc1ccccc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450673908	GG	On-Demand	Mild	NPFFR1	60	40
CS[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450673912	DI	On-Demand	Anodyne	LIPG	52	37
CS[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450673913	DI	On-Demand	Anodyne	LIPG	52	37
N#CC[C@@H]1CC[C@H](Nc2ncnc3sc4c(c23)CCCC4)C1	ZINC000450673914	DI	On-Demand	Mild	IRAK4	15	58
COC[C@H]1CCCCN(C(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)C1	ZINC000450673924	ED	On-Demand	Anodyne	CHRNA2	40	41
COC[C@H]1CCCCN(C(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)C1	ZINC000450673924	ED	On-Demand	Anodyne	CRTY	0	41
COC[C@H]1CCCCN(C(=O)c2ocnc2-c2ccccc2)C1	ZINC000450673925	DG	On-Demand	Anodyne	CPT1A	83	36
COC[C@H]1CCCCN(C(=O)c2ocnc2-c2ccccc2)C1	ZINC000450673925	DG	On-Demand	Anodyne	SMO	40	37
COC[C@@H]1CCCCN(C(=O)c2ocnc2-c2ccccc2)C1	ZINC000450673926	DG	On-Demand	Anodyne	CPT1A	83	36
COC[C@@H]1CCCCN(C(=O)c2ocnc2-c2ccccc2)C1	ZINC000450673926	DG	On-Demand	Anodyne	SMO	40	37
COC(=O)c1csc(CNC2(c3ccc(OC)cc3)CC2)n1	ZINC000450673927	DF	On-Demand	Anodyne	NPBWR1	43	30
COC[C@](C)(CCO)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450673928	DD	On-Demand	Anodyne	IRAK4	20	40
COC[C@@](C)(CCO)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450673929	DD	On-Demand	Anodyne	IRAK4	20	40
COC[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673936	DF	On-Demand	Anodyne	SLC6A1	43	33
COC[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673936	DF	On-Demand	Anodyne	ERBB2	24	40
COC[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673936	DF	On-Demand	Anodyne	PREP	48	39
COC[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673936	DF	On-Demand	Anodyne	MMP2	0	40
COC[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673936	DF	On-Demand	Anodyne	ADAM10	38	40
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673937	DF	On-Demand	Anodyne	SLC6A1	43	33
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673937	DF	On-Demand	Anodyne	ERBB2	24	40
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673937	DF	On-Demand	Anodyne	PREP	48	39
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673937	DF	On-Demand	Anodyne	MMP2	0	40
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450673937	DF	On-Demand	Anodyne	ADAM10	38	40
COC[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673938	DF	On-Demand	Anodyne	SLC6A1	43	33
COC[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673938	DF	On-Demand	Anodyne	ERBB2	24	40
COC[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673938	DF	On-Demand	Anodyne	PREP	48	39
COC[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673938	DF	On-Demand	Anodyne	MMP2	0	40
COC[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673938	DF	On-Demand	Anodyne	ADAM10	38	40
COC[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673939	DF	On-Demand	Anodyne	SLC6A1	43	33
COC[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673939	DF	On-Demand	Anodyne	ERBB2	24	40
COC[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673939	DF	On-Demand	Anodyne	PREP	48	39
COC[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673939	DF	On-Demand	Anodyne	MMP2	0	40
COC[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450673939	DF	On-Demand	Anodyne	ADAM10	38	40
CS[C@@H]1CCN(c2c(C)cnc3c(C)cccc23)C1	ZINC000450673942	CH	On-Demand	Anodyne	ATP4A	23	43
CS[C@H]1CCN(c2c(C)cnc3c(C)cccc23)C1	ZINC000450673943	CH	On-Demand	Anodyne	ATP4A	23	43
CC(=O)c1ccc(CSc2nnc(C[C@H](C)c3ccccc3)o2)cc1	ZINC000450673946	FJ	On-Demand	Anodyne	GSK3A	33	41
CC(=O)c1ccc(CSc2nnc(C[C@@H](C)c3ccccc3)o2)cc1	ZINC000450673947	FJ	On-Demand	Anodyne	GSK3A	33	41
COCC[C@@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450673950	GG	On-Demand	Mild	COLA	42	38
COCC[C@@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450673950	GG	On-Demand	Mild	CPT1A	44	38
COCC[C@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450673951	GG	On-Demand	Mild	COLA	42	38
COCC[C@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450673951	GG	On-Demand	Mild	CPT1A	44	38
COCc1ccc([C@H]2CCCN2C(=O)c2ccnc(OC(F)F)c2)o1	ZINC000450673966	FG	On-Demand	Anodyne	COLA	40	32
COCc1ccc([C@@H]2CCCN2C(=O)c2ccnc(OC(F)F)c2)o1	ZINC000450673967	FG	On-Demand	Anodyne	COLA	40	32
COC[C@H]1CCCCN(C(=O)Cc2ccc(O)c(OC)c2)C1	ZINC000450673972	DE	On-Demand	Anodyne	SHBG	18	40
COC[C@H]1CCCCN(C(=O)Cc2ccc(O)c(OC)c2)C1	ZINC000450673972	DE	On-Demand	Anodyne	RORC	54	39
COC[C@@H]1CCCCN(C(=O)Cc2ccc(O)c(OC)c2)C1	ZINC000450673973	DE	On-Demand	Anodyne	SHBG	18	40
COC[C@@H]1CCCCN(C(=O)Cc2ccc(O)c(OC)c2)C1	ZINC000450673973	DE	On-Demand	Anodyne	RORC	54	39
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673979	GF	On-Demand	Mild	PGR	19	40
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673979	GF	On-Demand	Mild	NR3C2	40	41
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673979	GF	On-Demand	Mild	AR	19	41
COC[C@H]1CCCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673980	GF	On-Demand	Mild	PGR	19	40
COC[C@H]1CCCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673980	GF	On-Demand	Mild	NR3C2	40	41
COC[C@H]1CCCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673980	GF	On-Demand	Mild	AR	19	41
COC[C@H]1CCCCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673981	GF	On-Demand	Mild	PGR	19	40
COC[C@H]1CCCCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673981	GF	On-Demand	Mild	NR3C2	40	41
COC[C@H]1CCCCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673981	GF	On-Demand	Mild	AR	19	41
COC[C@@H]1CCCCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673982	GF	On-Demand	Mild	PGR	19	40
COC[C@@H]1CCCCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673982	GF	On-Demand	Mild	NR3C2	40	41
COC[C@@H]1CCCCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450673982	GF	On-Demand	Mild	AR	19	41
NC(=O)c1cccc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450673986	EF	On-Demand	Bother	CASP3	47	38
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(C(=O)OC)cc2)o1	ZINC000450673994	FG	On-Demand	Anodyne	COLA	69	45
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(C(=O)OC)cc2)o1	ZINC000450673994	FG	On-Demand	Anodyne	CPT1A	61	45
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(C(=O)OC)cc2)o1	ZINC000450673995	FG	On-Demand	Anodyne	COLA	69	45
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(C(=O)OC)cc2)o1	ZINC000450673995	FG	On-Demand	Anodyne	CPT1A	61	45
COCc1ccc([C@H]2CCCN2C(=O)c2c(Br)cnn2C)o1	ZINC000450674003	FF	On-Demand	Anodyne	COLA	54	34
COCc1ccc([C@@H]2CCCN2C(=O)c2c(Br)cnn2C)o1	ZINC000450674004	FF	On-Demand	Anodyne	COLA	54	34
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450674035	DD	On-Demand	Anodyne	MTNR1A	25	42
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450674035	DD	On-Demand	Anodyne	MTNR1B	0	42
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450674035	DD	On-Demand	Anodyne	L3MBTL3	62	38
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450674036	DD	On-Demand	Anodyne	MTNR1A	25	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450674036	DD	On-Demand	Anodyne	MTNR1B	0	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450674036	DD	On-Demand	Anodyne	L3MBTL3	62	38
CC(C)c1ncsc1C(=O)N[C@H](CO)c1ccccc1	ZINC000450674037	CF	On-Demand	Anodyne	SOAT1	27	42
CC(C)c1ncsc1C(=O)N[C@H](CO)c1ccccc1	ZINC000450674037	CF	On-Demand	Anodyne	GPR88	0	45
C[C@H]1CCC[C@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674052	CF	On-Demand	Anodyne	MAN1B1	52	33
C[C@H]1CCC[C@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674052	CF	On-Demand	Anodyne	MAN1	0	42
C[C@H]1CCC[C@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674052	CF	On-Demand	Anodyne	GPR88	0	43
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674053	CF	On-Demand	Anodyne	MAN1B1	52	33
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674053	CF	On-Demand	Anodyne	MAN1	0	42
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674053	CF	On-Demand	Anodyne	GPR88	0	43
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674054	CF	On-Demand	Anodyne	MAN1B1	52	33
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674054	CF	On-Demand	Anodyne	MAN1	0	42
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674054	CF	On-Demand	Anodyne	GPR88	0	43
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674055	CF	On-Demand	Anodyne	MAN1B1	52	33
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674055	CF	On-Demand	Anodyne	MAN1	0	42
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450674055	CF	On-Demand	Anodyne	GPR88	0	43
COc1cc(CN[C@@H](CC(=O)N(C)C)c2ccccc2)ccc1Cl	ZINC000450674056	EH	On-Demand	Anodyne	PDE6A	43	34
COc1cc(CN[C@H](CC(=O)N(C)C)c2ccccc2)ccc1Cl	ZINC000450674057	EH	On-Demand	Anodyne	PDE6A	43	34
CCCCOc1ccc([C@@H](C)NCCC(C)(F)F)cc1OC	ZINC000450674075	DJ	On-Demand	Anodyne	CALM3	0	52
CCCCOc1ccc([C@H](C)NCCC(C)(F)F)cc1OC	ZINC000450674076	DJ	On-Demand	Anodyne	CALM3	0	52
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000450674077	DF	On-Demand	Anodyne	ACACA	47	38
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000450674078	DF	On-Demand	Anodyne	ACACA	47	38
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000450674079	DF	On-Demand	Anodyne	ACACA	47	38
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000450674080	DF	On-Demand	Anodyne	ACACA	47	38
CC[C@H](CNS(C)(=O)=O)Nc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450674085	FF	On-Demand	Mild	MAP3K8	44	37
CC[C@@H](CNS(C)(=O)=O)Nc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450674086	FF	On-Demand	Mild	MAP3K8	44	37
CC[C@H](CNS(C)(=O)=O)Nc1cnc2cc(Cl)c(Cl)cc2n1	ZINC000450674115	FF	On-Demand	Anodyne	GLP1R	59	43
CC[C@@H](CNS(C)(=O)=O)Nc1cnc2cc(Cl)c(Cl)cc2n1	ZINC000450674117	FF	On-Demand	Anodyne	GLP1R	59	43
Cc1ccc2c(c1)nc(CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1)n2C	ZINC000450674127	EI	On-Demand	Anodyne	SCN9A	21	40
Cc1ccc2c(c1)nc(CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)n2C	ZINC000450674128	EI	On-Demand	Anodyne	SCN9A	21	40
Cc1ccc2c(c1)nc(CNC(=O)[C@H]1CCC[C@H]1c1ccccc1)n2C	ZINC000450674130	EI	On-Demand	Anodyne	SCN9A	21	40
Cc1ccc2c(c1)nc(CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1)n2C	ZINC000450674132	EI	On-Demand	Anodyne	SCN9A	21	40
CCc1nc(C)c(CSc2nnc(-c3ccccc3OC)o2)o1	ZINC000450674152	EH	On-Demand	Anodyne	ALOX15	48	35
COC[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(F)cc1	ZINC000450674153	DG	On-Demand	Anodyne	ADRB3	15	42
COC[C@H](NC[C@H](Cc1ccccc1)OC)c1ccc(F)cc1	ZINC000450674154	DG	On-Demand	Anodyne	ADRB3	15	42
COC[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccc(F)cc1	ZINC000450674155	DG	On-Demand	Anodyne	ADRB3	15	42
COC[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(F)cc1	ZINC000450674156	DG	On-Demand	Anodyne	ADRB3	15	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)c1c(C)nn(CC(F)(F)F)c1C	ZINC000450674174	FJ	On-Demand	Anodyne	P2RX7	18	44
Cc1cccc(Cl)c1C(=O)N[C@H](C)c1c(C)nn(CC(F)(F)F)c1C	ZINC000450674175	FJ	On-Demand	Anodyne	P2RX7	18	44
CC[C@H](NC[C@](C)(O)C(C)=O)c1cccc([N+](=O)[O-])c1	ZINC000450674190	CD	On-Demand	Bother	CACNA1D	59	34
CC[C@@H](NC[C@](C)(O)C(C)=O)c1cccc([N+](=O)[O-])c1	ZINC000450674191	CD	On-Demand	Bother	CACNA1D	59	34
CC[C@H](NC[C@@](C)(O)C(C)=O)c1cccc([N+](=O)[O-])c1	ZINC000450674192	CD	On-Demand	Bother	CACNA1D	59	34
CC[C@@H](NC[C@@](C)(O)C(C)=O)c1cccc([N+](=O)[O-])c1	ZINC000450674193	CD	On-Demand	Bother	CACNA1D	59	34
CCc1cc(NC(=O)CS(=O)(=O)C2CC2)ccc1C	ZINC000450674194	CE	On-Demand	Anodyne	POLC	52	38
Cn1nc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c2c1CCCC2	ZINC000450674246	GF	On-Demand	Mild	FABP4	50	37
Cn1nc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c2c1CCCC2	ZINC000450674246	GF	On-Demand	Mild	TSPO	0	41
Cn1nc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c2c1CCCC2	ZINC000450674246	GF	On-Demand	Mild	NPFFR1	57	36
Cc1sccc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450674247	EG	On-Demand	Mild	ACHE	18	40
Cc1sccc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450674247	EG	On-Demand	Mild	SIGMAR1	58	42
Cc1sccc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450674247	EG	On-Demand	Mild	NPFFR1	57	37
C=CCOc1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450674261	GG	On-Demand	Mild	SIGMAR1	56	42
C=CCOc1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450674261	GG	On-Demand	Mild	ADAM17	24	44
C=CCOc1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450674261	GG	On-Demand	Mild	FAAH	15	40
C=CCOc1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450674261	GG	On-Demand	Mild	NPFFR1	60	39
C=CCOc1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450674261	GG	On-Demand	Mild	ADIPOR1	0	40
C=CCOc1ccc(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1	ZINC000450674261	GG	On-Demand	Mild	ADIPOR2	0	40
C[C@H](NCC1=CCCCC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450674263	EI	On-Demand	Anodyne	PRNP	40	36
C[C@@H](NCC1=CCCCC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450674264	EI	On-Demand	Anodyne	PRNP	40	36
CCc1cc(N[C@H]2CC[C@@H](CC#N)C2)n2ncnc2n1	ZINC000450674275	CE	On-Demand	Mild	DHOD	0	44
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	DRD4	43	34
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	ACHE	27	42
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	HRH2	49	43
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	SIGMAR1	56	49
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	MMP13	19	44
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	PLA2G2A	41	36
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	NPFFR2	39	50
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	ADAM17	22	44
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	FAAH	24	40
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	MCHR1	22	45
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	CCR8	34	41
COc1cccc(OCCC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450674280	GG	On-Demand	Mild	NPFFR1	60	50
C[C@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)C1CC1	ZINC000450674300	FI	On-Demand	Anodyne	NPBWR1	44	37
Cc1cc(F)c(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1F	ZINC000450674307	GG	On-Demand	Mild	SIGMAR1	55	45
Cc1cc(F)c(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cc1F	ZINC000450674307	GG	On-Demand	Mild	NPFFR1	60	38
COC[C@](C)(CCO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450674346	CC	On-Demand	Anodyne	HPGDS	16	44
COc1ccc(-c2csc3ncnc(N[C@H]4CC[C@@H](CC#N)C4)c23)cc1	ZINC000450674347	FJ	On-Demand	Mild	ADRB3	0	43
COC[C@@](C)(CCO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450674348	CC	On-Demand	Anodyne	HPGDS	16	44
COC[C@](C)(CCO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450674349	DD	On-Demand	Anodyne	CTSV	48	34
COC[C@@](C)(CCO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450674350	DD	On-Demand	Anodyne	CTSV	48	34
O=c1c(N2CCC[C@H]2COc2ccccc2)nccn1C1CC1	ZINC000450674360	DF	On-Demand	Anodyne	CASP3	52	38
O=c1c(N2CCC[C@H]2COc2ccccc2)nccn1C1CC1	ZINC000450674360	DF	On-Demand	Anodyne	CHRNA10	66	48
O=c1c(N2CCC[C@H]2COc2ccccc2)nccn1C1CC1	ZINC000450674360	DF	On-Demand	Anodyne	CASP7	41	38
C[C@]1(CNC(=O)c2cc(Cl)c(F)cc2Br)CCO[C@@H]1C1CC1	ZINC000450674362	GI	On-Demand	Anodyne	SLC6A9	43	37
C[C@]1(CNC(=O)c2cc(Cl)c(F)cc2Br)CCO[C@H]1C1CC1	ZINC000450674363	GI	On-Demand	Anodyne	SLC6A9	43	37
C[C@@]1(CNC(=O)c2cc(Cl)c(F)cc2Br)CCO[C@H]1C1CC1	ZINC000450674364	GI	On-Demand	Anodyne	SLC6A9	43	37
C[C@@]1(CNC(=O)c2cc(Cl)c(F)cc2Br)CCO[C@@H]1C1CC1	ZINC000450674365	GI	On-Demand	Anodyne	SLC6A9	43	37
C[C@H]1C[C@@H](C(=O)N[C@H](c2ccccc2)c2nc[nH]n2)CC[C@H]1C	ZINC000450674370	DG	On-Demand	Anodyne	BIRC8	41	33
C[C@@H]1CC[C@H](C(=O)N[C@H](c2ccccc2)c2nc[nH]n2)C[C@H]1C	ZINC000450674371	DG	On-Demand	Anodyne	BIRC8	41	33
C[C@@H]1CC[C@H](C(=O)N[C@@H](c2ccccc2)c2nc[nH]n2)C[C@H]1C	ZINC000450674372	DG	On-Demand	Anodyne	BIRC8	41	33
C[C@H]1C[C@@H](C(=O)N[C@@H](c2ccccc2)c2nc[nH]n2)CC[C@H]1C	ZINC000450674373	DG	On-Demand	Anodyne	BIRC8	41	33
CC(C)(CC(=O)CSc1nnc(-c2ccccc2Br)o1)C1CC1	ZINC000450674374	GJ	On-Demand	Anodyne	ALOX15	52	36
COCc1ccc([C@@H]2CCCN2C(=O)CCCC(=O)C2CC2)o1	ZINC000450674375	DG	On-Demand	Anodyne	CPT1A	88	36
COCc1ccc([C@H]2CCCN2C(=O)CCCC(=O)C2CC2)o1	ZINC000450674376	DG	On-Demand	Anodyne	CPT1A	88	36
CC[C@H](C)[C@H](NC[C@@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674377	GF	On-Demand	Anodyne	GRIN2B	59	38
CC[C@H](C)[C@H](NC[C@@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674377	GF	On-Demand	Anodyne	CCR1	37	46
CC[C@H](C)[C@H](NC[C@@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674377	GF	On-Demand	Anodyne	F2RL1	29	43
CC[C@H](C)[C@H](NC[C@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674378	GF	On-Demand	Anodyne	GRIN2B	59	38
CC[C@H](C)[C@H](NC[C@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674378	GF	On-Demand	Anodyne	CCR1	37	46
CC[C@H](C)[C@H](NC[C@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674378	GF	On-Demand	Anodyne	F2RL1	29	43
CC[C@H](C)[C@@H](NC[C@@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674379	GF	On-Demand	Anodyne	GRIN2B	59	38
CC[C@H](C)[C@@H](NC[C@@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674379	GF	On-Demand	Anodyne	CCR1	37	46
CC[C@H](C)[C@@H](NC[C@@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674379	GF	On-Demand	Anodyne	F2RL1	29	43
CC[C@H](C)[C@@H](NC[C@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674380	GF	On-Demand	Anodyne	GRIN2B	59	38
CC[C@H](C)[C@@H](NC[C@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674380	GF	On-Demand	Anodyne	CCR1	37	46
CC[C@H](C)[C@@H](NC[C@H]1COCCO1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450674380	GF	On-Demand	Anodyne	F2RL1	29	43
CCn1nnc(C)c1COc1ccc(C(C)=O)cc1OC	ZINC000450674381	CE	On-Demand	Anodyne	ENPP1	47	31
COc1cccc2c(N3CC[C@@H](SC)C3)nccc12	ZINC000450674395	CG	On-Demand	Anodyne	PDE3A	29	42
COc1cccc2c(N3CC[C@@H](SC)C3)nccc12	ZINC000450674395	CG	On-Demand	Anodyne	PDE3B	75	41
COc1cccc2c(N3CC[C@H](SC)C3)nccc12	ZINC000450674396	CG	On-Demand	Anodyne	PDE3A	29	42
COc1cccc2c(N3CC[C@H](SC)C3)nccc12	ZINC000450674396	CG	On-Demand	Anodyne	PDE3B	75	41
COC[C@H]1CCCCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450674403	FH	On-Demand	Anodyne	COLA	46	36
COC[C@H]1CCCCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450674403	FH	On-Demand	Anodyne	CPT1A	45	36
COC[C@@H]1CCCCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450674404	FH	On-Demand	Anodyne	COLA	46	36
COC[C@@H]1CCCCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450674404	FH	On-Demand	Anodyne	CPT1A	45	36
C[C@]1(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CCO[C@@H]1C1CC1	ZINC000450674407	EH	On-Demand	Anodyne	SCN9A	0	41
C[C@]1(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CCO[C@@H]1C1CC1	ZINC000450674408	EH	On-Demand	Anodyne	SCN9A	0	41
C[C@]1(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CCO[C@H]1C1CC1	ZINC000450674409	EH	On-Demand	Anodyne	SCN9A	0	41
C[C@]1(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CCO[C@H]1C1CC1	ZINC000450674410	EH	On-Demand	Anodyne	SCN9A	0	41
COC[C@@H]1CCCCN(C(=O)c2cncc(Cl)c2)C1	ZINC000450674420	CF	On-Demand	Anodyne	CACNA1I	43	32
COC[C@@H]1CCCCN(C(=O)c2cncc(Cl)c2)C1	ZINC000450674420	CF	On-Demand	Anodyne	L3MBTL1	0	40
COC[C@H]1CCCCN(C(=O)c2cncc(Cl)c2)C1	ZINC000450674421	CF	On-Demand	Anodyne	CACNA1I	43	32
COC[C@H]1CCCCN(C(=O)c2cncc(Cl)c2)C1	ZINC000450674421	CF	On-Demand	Anodyne	L3MBTL1	0	40
Brc1ccccc1-c1nnc(SCC[C@@H]2CCOC2)o1	ZINC000450674426	FI	On-Demand	Anodyne	TERT	0	40
Brc1ccccc1-c1nnc(SCC[C@H]2CCOC2)o1	ZINC000450674427	FI	On-Demand	Anodyne	TERT	0	40
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccccc2O[C@@H]2CCOC2)o1	ZINC000450674434	GG	On-Demand	Anodyne	COLA	67	38
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccccc2O[C@@H]2CCOC2)o1	ZINC000450674434	GG	On-Demand	Anodyne	CPT1A	63	38
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccccc2O[C@H]2CCOC2)o1	ZINC000450674435	GG	On-Demand	Anodyne	COLA	67	38
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccccc2O[C@H]2CCOC2)o1	ZINC000450674435	GG	On-Demand	Anodyne	CPT1A	63	38
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccccc2O[C@H]2CCOC2)o1	ZINC000450674436	GG	On-Demand	Anodyne	COLA	67	38
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccccc2O[C@H]2CCOC2)o1	ZINC000450674436	GG	On-Demand	Anodyne	CPT1A	63	38
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccccc2O[C@@H]2CCOC2)o1	ZINC000450674437	GG	On-Demand	Anodyne	COLA	67	38
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccccc2O[C@@H]2CCOC2)o1	ZINC000450674437	GG	On-Demand	Anodyne	CPT1A	63	38
CC[C@@H](CNS(C)(=O)=O)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450674447	GD	On-Demand	Anodyne	HTR3A	24	43
CC[C@@H](CNS(C)(=O)=O)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450674447	GD	On-Demand	Anodyne	HRH4	28	43
CC[C@H](CNS(C)(=O)=O)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450674448	GD	On-Demand	Anodyne	HTR3A	24	43
CC[C@H](CNS(C)(=O)=O)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450674448	GD	On-Demand	Anodyne	HRH4	28	43
CCN(C)C(=O)[C@@H](Nc1ccc(C#N)c(Cl)c1)C(C)C	ZINC000450674449	CG	On-Demand	Mild	PGR	24	44
CCCNC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)nc1	ZINC000450674454	DF	On-Demand	Anodyne	HDAC1	0	41
CCCNC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)nc1	ZINC000450674454	DF	On-Demand	Anodyne	HPGDS	27	40
CCCNC(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)nc1	ZINC000450674455	DF	On-Demand	Anodyne	HDAC1	0	41
CCCNC(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)nc1	ZINC000450674455	DF	On-Demand	Anodyne	HPGDS	27	40
CCCNC(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)nc1	ZINC000450674456	DF	On-Demand	Anodyne	HDAC1	0	41
CCCNC(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)nc1	ZINC000450674456	DF	On-Demand	Anodyne	HPGDS	27	40
CNC(=O)N[C@H]1CCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450674458	FD	On-Demand	Anodyne	SLC6A5	31	42
CNC(=O)N[C@H]1CCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450674458	FD	On-Demand	Anodyne	EPHX2	30	48
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450674459	FD	On-Demand	Anodyne	SLC6A5	31	42
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450674459	FD	On-Demand	Anodyne	EPHX2	30	48
N#CC1(CN[C@H](COc2ccccc2F)c2ccccc2)CCC1	ZINC000450674481	DI	On-Demand	Mild	MAN1B1	18	41
N#CC1(CN[C@@H](COc2ccccc2F)c2ccccc2)CCC1	ZINC000450674482	DI	On-Demand	Mild	MAN1B1	18	41
Cc1nnc2c3ccccc3c(N3C[C@H]4[C@H]5C=C[C@@H](CC5)[C@H]4C3)nn12	ZINC000450674496	EG	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3C[C@H]4[C@H]5C=C[C@@H](CC5)[C@H]4C3)nn12	ZINC000450674496	EG	On-Demand	Anodyne	BRD9	55	36
Cc1nnc2c3ccccc3c(N3C[C@@H]4[C@H]5C=C[C@@H](CC5)[C@H]4C3)nn12	ZINC000450674497	EG	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3C[C@@H]4[C@H]5C=C[C@@H](CC5)[C@H]4C3)nn12	ZINC000450674497	EG	On-Demand	Anodyne	BRD9	55	36
Cc1nnc2c3ccccc3c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4CC3)nn12	ZINC000450674498	EG	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4CC3)nn12	ZINC000450674498	EG	On-Demand	Anodyne	BRD9	55	36
C[C@H](NC[C@H]1CCCC1(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450674507	EI	On-Demand	Anodyne	EPHX2	48	40
C[C@H](NC[C@@H]1CCCC1(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450674508	EI	On-Demand	Anodyne	EPHX2	48	40
C[C@@H](NC[C@@H]1CCCC1(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450674510	EI	On-Demand	Anodyne	EPHX2	48	40
C[C@@H](NC[C@H]1CCCC1(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450674512	EI	On-Demand	Anodyne	EPHX2	48	40
COCCOc1ccc(Br)cc1NC(=O)[C@H]1CCCN(C)C1=O	ZINC000450674513	GE	On-Demand	Anodyne	SLC9A1	55	31
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3)cn2)C1	ZINC000450674514	FF	On-Demand	Anodyne	SLC6A5	18	42
COCCOc1ccc(Br)cc1NC(=O)[C@@H]1CCCN(C)C1=O	ZINC000450674515	GE	On-Demand	Anodyne	SLC9A1	55	31
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3)cn2)C1	ZINC000450674516	FF	On-Demand	Anodyne	SLC6A5	18	42
CC[C@H](NCc1ccc(C(=O)OC)c(Cl)c1)c1ccc2c(c1)OCCO2	ZINC000450674522	GI	On-Demand	Anodyne	PDE10A	22	40
CC[C@@H](NCc1ccc(C(=O)OC)c(Cl)c1)c1ccc2c(c1)OCCO2	ZINC000450674524	GI	On-Demand	Anodyne	PDE10A	22	40
COC[C@@H](NCCC[C@@H](C)O)c1ccc(F)cc1	ZINC000450674547	CE	On-Demand	Anodyne	LEF	41	43
COC[C@H](NCCC[C@H](C)O)c1ccc(F)cc1	ZINC000450674548	CE	On-Demand	Anodyne	LEF	41	43
COC[C@H](NCCC[C@@H](C)O)c1ccc(F)cc1	ZINC000450674549	CE	On-Demand	Anodyne	LEF	41	43
COC[C@@H](NCCC[C@H](C)O)c1ccc(F)cc1	ZINC000450674550	CE	On-Demand	Anodyne	LEF	41	43
CC[C@H](CC(C)C)C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450674579	CD	On-Demand	Anodyne	EPHX2	19	46
CC[C@@H](CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450674584	CD	On-Demand	Anodyne	EPHX2	19	46
CC[C@@H](CC(C)C)C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450674590	CD	On-Demand	Anodyne	EPHX2	19	46
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450674591	CD	On-Demand	Anodyne	EPHX2	19	46
CC[C@H](NCc1ccc(Cl)c(OC)c1)c1cccc([N+](=O)[O-])c1	ZINC000450674632	EI	On-Demand	Bother	CACNA1C	40	36
CC[C@H](NCc1ccc(Cl)c(OC)c1)c1cccc([N+](=O)[O-])c1	ZINC000450674632	EI	On-Demand	Bother	CACNA1D	78	36
CC[C@@H](NCc1ccc(Cl)c(OC)c1)c1cccc([N+](=O)[O-])c1	ZINC000450674633	EI	On-Demand	Bother	CACNA1C	40	36
CC[C@@H](NCc1ccc(Cl)c(OC)c1)c1cccc([N+](=O)[O-])c1	ZINC000450674633	EI	On-Demand	Bother	CACNA1D	78	36
COC[C@]1(C(=O)OC)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450674688	GE	On-Demand	Anodyne	EGFR	40	34
COC[C@]1(C(=O)OC)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450674688	GE	On-Demand	Anodyne	PDGFRB	57	43
COC[C@@]1(C(=O)OC)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450674689	GE	On-Demand	Anodyne	EGFR	40	34
COC[C@@]1(C(=O)OC)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450674689	GE	On-Demand	Anodyne	PDGFRB	57	43
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)O1	ZINC000450674712	EI	On-Demand	Anodyne	CACNA1B	44	31
C[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)O1	ZINC000450674713	EI	On-Demand	Anodyne	CACNA1B	44	31
CC1(C)C[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(C)(C)O1	ZINC000450674755	FF	On-Demand	Anodyne	EPHX2	15	47
CC1(C)C[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)C(C)(C)O1	ZINC000450674756	FF	On-Demand	Anodyne	EPHX2	15	47
N#CC1(NC(=O)c2cnc(C3CC3)nc2)CCN(Cc2ccccc2)CC1	ZINC000450674759	FF	On-Demand	Mild	CHRM2	15	40
N#CC1(NC(=O)c2cnc(C3CC3)nc2)CCN(Cc2ccccc2)CC1	ZINC000450674759	FF	On-Demand	Mild	DRD4	23	43
N#CC1(NC(=O)c2cnc(C3CC3)nc2)CCN(Cc2ccccc2)CC1	ZINC000450674759	FF	On-Demand	Mild	ACHE	26	40
N#CC1(NC(=O)c2cnc(C3CC3)nc2)CCN(Cc2ccccc2)CC1	ZINC000450674759	FF	On-Demand	Mild	SIGMAR1	55	42
N#CC1(NC(=O)c2cnc(C3CC3)nc2)CCN(Cc2ccccc2)CC1	ZINC000450674759	FF	On-Demand	Mild	NPFFR1	56	37
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450674763	GG	On-Demand	Anodyne	PRCP	44	34
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450674764	GG	On-Demand	Anodyne	PRCP	44	34
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450674765	GG	On-Demand	Anodyne	PRCP	44	34
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450674766	GG	On-Demand	Anodyne	PRCP	44	34
O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450674770	FE	On-Demand	Anodyne	HDAC8	16	53
O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@@H](O)C1CCC1	ZINC000450674771	FE	On-Demand	Anodyne	HDAC8	16	53
O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@H](O)C1CCC1	ZINC000450674772	FE	On-Demand	Anodyne	HDAC8	16	53
O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@H](O)C1CCC1	ZINC000450674773	FE	On-Demand	Anodyne	HDAC8	16	53
CC[C@@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)c1ncc[nH]1	ZINC000450674788	DF	On-Demand	Anodyne	ACE2	20	40
CC[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)c1ncc[nH]1	ZINC000450674789	DF	On-Demand	Anodyne	ACE2	20	40
CC[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)c1ncc[nH]1	ZINC000450674790	DF	On-Demand	Anodyne	ACE2	20	40
CC[C@@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)c1ncc[nH]1	ZINC000450674791	DF	On-Demand	Anodyne	ACE2	20	40
N#CC1(NC(=O)c2ccnc(OC(F)F)c2)CCN(Cc2ccccc2)CC1	ZINC000450674797	GF	On-Demand	Mild	NPFFR1	51	36
N#CC[C@@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450674832	EH	On-Demand	Mild	EGFR	40	38
N#CC[C@@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450674832	EH	On-Demand	Mild	CD38	40	36
COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(F)(F)F)cc2C)o1	ZINC000450674865	FJ	On-Demand	Anodyne	LIPG	46	35
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(N2CCCC2)c1	ZINC000450674869	CE	On-Demand	Anodyne	KCNQ2	56	43
COCc1ccc([C@H]2CCCN2C(=O)c2ccc(C(F)(F)F)cc2C)o1	ZINC000450674870	FJ	On-Demand	Anodyne	LIPG	46	35
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(N2CCCC2)c1	ZINC000450674871	CE	On-Demand	Anodyne	KCNQ2	56	43
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000450674874	CE	On-Demand	Anodyne	KCNQ2	56	43
COCc1ccc([C@@H]2CCCN2C(=O)Cc2cn(C)nc2C)o1	ZINC000450674875	DE	On-Demand	Anodyne	CPT1A	58	37
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000450674876	CE	On-Demand	Anodyne	KCNQ2	56	43
COCc1ccc([C@H]2CCCN2C(=O)Cc2cn(C)nc2C)o1	ZINC000450674882	DE	On-Demand	Anodyne	CPT1A	58	37
CCn1ccnc1CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450674891	EG	On-Demand	Anodyne	AVPR2	28	40
COCc1ccc([C@H]2CCCN2C(=O)c2cccc3c2O[C@H](C)C3)o1	ZINC000450674892	EH	On-Demand	Anodyne	COLA	49	34
COCc1ccc([C@H]2CCCN2C(=O)c2cccc3c2O[C@H](C)C3)o1	ZINC000450674892	EH	On-Demand	Anodyne	CPT1A	47	34
COCc1ccc([C@@H]2CCCN2C(=O)c2cccc3c2O[C@H](C)C3)o1	ZINC000450674902	EH	On-Demand	Anodyne	COLA	49	34
COCc1ccc([C@@H]2CCCN2C(=O)c2cccc3c2O[C@H](C)C3)o1	ZINC000450674902	EH	On-Demand	Anodyne	CPT1A	47	34
COCc1ccc([C@@H]2CCCN2C(=O)c2cccc3c2O[C@@H](C)C3)o1	ZINC000450674904	EH	On-Demand	Anodyne	COLA	49	34
COCc1ccc([C@@H]2CCCN2C(=O)c2cccc3c2O[C@@H](C)C3)o1	ZINC000450674904	EH	On-Demand	Anodyne	CPT1A	47	34
COCc1ccc([C@H]2CCCN2C(=O)c2cccc3c2O[C@@H](C)C3)o1	ZINC000450674906	EH	On-Demand	Anodyne	COLA	49	34
COCc1ccc([C@H]2CCCN2C(=O)c2cccc3c2O[C@@H](C)C3)o1	ZINC000450674906	EH	On-Demand	Anodyne	CPT1A	47	34
CCS(=O)(=O)c1ccc(CNC2(c3ccc(OC)cc3)CC2)cc1	ZINC000450674944	EG	On-Demand	Anodyne	CA9	21	42
Cc1nn(C)cc1COc1ccc(Br)cc1F	ZINC000450674947	CG	On-Demand	Anodyne	PTGER1	16	41
COC[C@H]1CCCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450674973	GH	On-Demand	Anodyne	CHRM3	15	41
COC[C@H]1CCCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450674973	GH	On-Demand	Anodyne	MMP13	18	40
COC[C@H]1CCCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450674973	GH	On-Demand	Anodyne	L3MBTL3	45	35
COC[C@@H]1CCCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450674988	GH	On-Demand	Anodyne	CHRM3	15	41
COC[C@@H]1CCCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450674988	GH	On-Demand	Anodyne	MMP13	18	40
COC[C@@H]1CCCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450674988	GH	On-Demand	Anodyne	L3MBTL3	45	35
COCC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450675006	FJ	On-Demand	Anodyne	MC4R	42	41
COCC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450675006	FJ	On-Demand	Anodyne	PRCP	53	39
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450675007	FJ	On-Demand	Anodyne	MC4R	42	41
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450675007	FJ	On-Demand	Anodyne	PRCP	53	39
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450675008	FJ	On-Demand	Anodyne	MC4R	42	41
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450675008	FJ	On-Demand	Anodyne	PRCP	53	39
COCC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450675009	FJ	On-Demand	Anodyne	MC4R	42	41
COCC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450675009	FJ	On-Demand	Anodyne	PRCP	53	39
COc1ccc(OCCCCCC(C)=O)c([N+](=O)[O-])c1	ZINC000450675014	CG	On-Demand	Bother	MTNR1B	35	42
COc1ccc(OCCCCCC(C)=O)c([N+](=O)[O-])c1	ZINC000450675014	CG	On-Demand	Bother	PLA2G4B	41	48
COc1ccc(OCCCCCC(C)=O)c([N+](=O)[O-])c1	ZINC000450675014	CG	On-Demand	Bother	TPPP	0	45
CCOc1nc2ccc(C(=O)N3CCCC[C@@H](CCOC)C3)cc2[nH]1	ZINC000450675017	EG	On-Demand	Anodyne	AKR1C3	0	43
CCOc1nc2ccc(C(=O)N3CCCC[C@@H](CCOC)C3)cc2[nH]1	ZINC000450675017	EG	On-Demand	Anodyne	HPGD	41	35
CC[C@H](CNS(C)(=O)=O)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450675018	ED	On-Demand	Anodyne	EGFR	32	41
CC[C@H](CNS(C)(=O)=O)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450675018	ED	On-Demand	Anodyne	FGFR1	0	41
CCOc1nc2ccc(C(=O)N3CCCC[C@H](CCOC)C3)cc2[nH]1	ZINC000450675019	EG	On-Demand	Anodyne	AKR1C3	0	43
CCOc1nc2ccc(C(=O)N3CCCC[C@H](CCOC)C3)cc2[nH]1	ZINC000450675019	EG	On-Demand	Anodyne	HPGD	41	35
CC[C@@H](CNS(C)(=O)=O)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450675020	ED	On-Demand	Anodyne	EGFR	32	41
CC[C@@H](CNS(C)(=O)=O)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450675020	ED	On-Demand	Anodyne	FGFR1	0	41
CC1(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)CCC(=O)CC1	ZINC000450675029	FG	On-Demand	Anodyne	ENV	41	31
CC1(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)CCC(=O)CC1	ZINC000450675031	FG	On-Demand	Anodyne	ENV	41	31
COC[C@@H]1CCCCN(C(=O)c2ccc(I)cc2F)C1	ZINC000450675033	GG	On-Demand	Anodyne	MAP2K1	24	40
COC[C@H]1CCCCN(C(=O)c2ccc(I)cc2F)C1	ZINC000450675035	GG	On-Demand	Anodyne	MAP2K1	24	40
COC[C@@H]1CCCCN(C(=O)c2cccc(SC)c2)C1	ZINC000450675036	CG	On-Demand	Anodyne	PREP	24	40
COC[C@@H]1CCCCN(C(=O)c2cccc(SC)c2)C1	ZINC000450675036	CG	On-Demand	Anodyne	RHOA	0	46
COC[C@@H]1CCCCN(C(=O)c2cccc(SC)c2)C1	ZINC000450675036	CG	On-Demand	Anodyne	L3MBTL1	0	41
COC[C@H]1CCCCN(C(=O)c2cccc(SC)c2)C1	ZINC000450675037	CG	On-Demand	Anodyne	PREP	24	40
COC[C@H]1CCCCN(C(=O)c2cccc(SC)c2)C1	ZINC000450675037	CG	On-Demand	Anodyne	RHOA	0	46
COC[C@H]1CCCCN(C(=O)c2cccc(SC)c2)C1	ZINC000450675037	CG	On-Demand	Anodyne	L3MBTL1	0	41
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450675053	FI	On-Demand	Anodyne	RBP4	93	40
N#Cc1cc(Br)cnc1N1CCC[C@H]1COc1ccccc1	ZINC000450675060	FH	On-Demand	Mild	CASP3	49	38
N#Cc1cc(Br)cnc1N1CCC[C@H]1COc1ccccc1	ZINC000450675060	FH	On-Demand	Mild	CHRNA10	66	47
COCc1ccc([C@H]2CCCN2C(=O)c2ccc3cnccc3c2)o1	ZINC000450675068	EH	On-Demand	Anodyne	COLA	105	38
COCc1ccc([C@H]2CCCN2C(=O)c2ccc3cnccc3c2)o1	ZINC000450675068	EH	On-Demand	Anodyne	CPT1A	101	38
COCc1ccc([C@@H]2CCCN2C(=O)c2ccc3cnccc3c2)o1	ZINC000450675070	EH	On-Demand	Anodyne	COLA	105	38
COCc1ccc([C@@H]2CCCN2C(=O)c2ccc3cnccc3c2)o1	ZINC000450675070	EH	On-Demand	Anodyne	CPT1A	101	38
CCOCCOC1CN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450675080	EE	On-Demand	Anodyne	TIMP3	45	32
CCSc1cccnc1C(=O)N[C@H](CO)c1ccccc1	ZINC000450675085	DF	On-Demand	Anodyne	TACR3	50	40
CCSc1cccnc1C(=O)N[C@H](CO)c1ccccc1	ZINC000450675085	DF	On-Demand	Anodyne	GPR88	0	47
CCN(C)C(=O)[C@@H](Nc1ccnc(N2CCOCC2)n1)C(C)C	ZINC000450675104	DC	On-Demand	Anodyne	EPHB4	82	33
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450675119	CD	On-Demand	Anodyne	EPHX2	19	41
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450675120	CD	On-Demand	Anodyne	EPHX2	19	41
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450675121	CD	On-Demand	Anodyne	EPHX2	19	41
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450675122	CD	On-Demand	Anodyne	EPHX2	19	41
CCS(=O)(=O)c1ccc(CNC2(c3cccc(Cl)c3)CC2)cc1	ZINC000450675157	EH	On-Demand	Anodyne	RORC	43	40
C[C@H](NCc1cn(CC2CC2)nn1)c1ccc(-n2cccn2)cc1	ZINC000450675160	DF	On-Demand	Anodyne	AMP1_PLAFQ	40	32
C[C@@H](NCc1cn(CC2CC2)nn1)c1ccc(-n2cccn2)cc1	ZINC000450675161	DF	On-Demand	Anodyne	AMP1_PLAFQ	40	32
COCC1(O)CN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450675162	FE	On-Demand	Bother	TAAR1	36	51
COC[C@]1(C(=O)OC)CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450675175	FF	On-Demand	Anodyne	PPIA	48	39
COC[C@]1(C(=O)OC)CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450675175	FF	On-Demand	Anodyne	SLC12A5	60	37
COC[C@@]1(C(=O)OC)CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450675176	FF	On-Demand	Anodyne	PPIA	48	39
COC[C@@]1(C(=O)OC)CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450675176	FF	On-Demand	Anodyne	SLC12A5	60	37
CCC1(CC)CN(C(=O)c2cccc3c2CCCC3)CC[S@]1=O	ZINC000450675185	EG	On-Demand	Anodyne	FABP4	44	36
CCC1(CC)CN(C(=O)c2cccc3c2CCCC3)CC[S@@]1=O	ZINC000450675186	EG	On-Demand	Anodyne	FABP4	44	36
O=C(Cc1ccc(O)c(F)c1)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450675199	FI	On-Demand	Anodyne	SRD5A2	20	41
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CC1(O)CCC1	ZINC000450675205	DF	On-Demand	Anodyne	CAPN2	0	43
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CC1(O)CCC1	ZINC000450675206	DF	On-Demand	Anodyne	CAPN2	0	43
CCC1(CC)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[S@]1=O	ZINC000450675209	GI	On-Demand	Anodyne	MC4R	38	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[S@]1=O	ZINC000450675209	GI	On-Demand	Anodyne	PRCP	53	37
CCC1(CC)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[S@]1=O	ZINC000450675209	GI	On-Demand	Anodyne	MC3R	46	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[S@]1=O	ZINC000450675209	GI	On-Demand	Anodyne	MC5R	33	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[S@@]1=O	ZINC000450675210	GI	On-Demand	Anodyne	MC4R	38	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[S@@]1=O	ZINC000450675210	GI	On-Demand	Anodyne	PRCP	53	37
CCC1(CC)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[S@@]1=O	ZINC000450675210	GI	On-Demand	Anodyne	MC3R	46	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[S@@]1=O	ZINC000450675210	GI	On-Demand	Anodyne	MC5R	33	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[S@]1=O	ZINC000450675211	GI	On-Demand	Anodyne	MC4R	38	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[S@]1=O	ZINC000450675211	GI	On-Demand	Anodyne	PRCP	53	37
CCC1(CC)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[S@]1=O	ZINC000450675211	GI	On-Demand	Anodyne	MC3R	46	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[S@]1=O	ZINC000450675211	GI	On-Demand	Anodyne	MC5R	33	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[S@@]1=O	ZINC000450675212	GI	On-Demand	Anodyne	MC4R	38	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[S@@]1=O	ZINC000450675212	GI	On-Demand	Anodyne	PRCP	53	37
CCC1(CC)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[S@@]1=O	ZINC000450675212	GI	On-Demand	Anodyne	MC3R	46	41
CCC1(CC)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[S@@]1=O	ZINC000450675212	GI	On-Demand	Anodyne	MC5R	33	41
N#CC[C@@H]1CC[C@H](Nc2nccc(C(F)F)n2)C1	ZINC000450675255	CF	On-Demand	Mild	MAPK1	58	36
CSc1ccc2ncnc(N[C@H]3CC[C@@H](CC#N)C3)c2c1	ZINC000450675262	CH	On-Demand	Mild	CD38	50	41
CCc1cccc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)n1	ZINC000450675266	EF	On-Demand	Mild	SIGMAR1	42	37
CCc1cccc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)n1	ZINC000450675266	EF	On-Demand	Mild	NPFFR1	58	38
N#CC1(NC(=O)[C@@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675267	DE	On-Demand	Mild	CHRM2	15	42
N#CC1(NC(=O)[C@@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675267	DE	On-Demand	Mild	CHRM3	17	42
N#CC1(NC(=O)[C@@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675267	DE	On-Demand	Mild	SIGMAR1	69	43
N#CC1(NC(=O)[C@@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675267	DE	On-Demand	Mild	NPFFR2	36	40
N#CC1(NC(=O)[C@@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675267	DE	On-Demand	Mild	CTSC	26	41
N#CC1(NC(=O)[C@@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675267	DE	On-Demand	Mild	NPFFR1	60	40
N#CC1(NC(=O)[C@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675268	DE	On-Demand	Mild	CHRM2	15	42
N#CC1(NC(=O)[C@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675268	DE	On-Demand	Mild	CHRM3	17	42
N#CC1(NC(=O)[C@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675268	DE	On-Demand	Mild	SIGMAR1	69	43
N#CC1(NC(=O)[C@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675268	DE	On-Demand	Mild	NPFFR2	36	40
N#CC1(NC(=O)[C@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675268	DE	On-Demand	Mild	CTSC	26	41
N#CC1(NC(=O)[C@H]2CC2(F)F)CCN(Cc2ccccc2)CC1	ZINC000450675268	DE	On-Demand	Mild	NPFFR1	60	40
Cn1c(C#N)ccc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675281	EE	On-Demand	Mild	SIGMAR1	48	39
Cn1c(C#N)ccc1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675281	EE	On-Demand	Mild	NPFFR1	58	38
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450675282	FF	On-Demand	Anodyne	LIPG	54	37
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450675283	FF	On-Demand	Anodyne	LIPG	54	37
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450675284	FF	On-Demand	Anodyne	LIPG	54	37
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450675285	FF	On-Demand	Anodyne	LIPG	54	37
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450675293	ED	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450675294	ED	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450675296	ED	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450675299	ED	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450675315	ED	On-Demand	Anodyne	MMP2	0	42
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450675316	ED	On-Demand	Anodyne	MMP2	0	42
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450675317	ED	On-Demand	Anodyne	MMP2	0	42
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450675318	ED	On-Demand	Anodyne	MMP2	0	42
CN(C)C(=O)c1ccc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450675334	EI	On-Demand	Anodyne	AKT1	21	40
CN(C)C(=O)c1ccc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450675335	EI	On-Demand	Anodyne	AKT1	21	40
COCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1ccc(C)o1	ZINC000450675342	FH	On-Demand	Anodyne	TIMP3	40	33
COCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1ccc(C)o1	ZINC000450675342	FH	On-Demand	Anodyne	NPPA	45	36
COCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1ccc(C)o1	ZINC000450675344	FH	On-Demand	Anodyne	TIMP3	40	33
COCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)c1ccc(C)o1	ZINC000450675344	FH	On-Demand	Anodyne	NPPA	45	36
CC[C@@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675345	FH	On-Demand	Mild	SIGMAR1	41	38
CC[C@@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675345	FH	On-Demand	Mild	CTSF	43	34
CC[C@@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675345	FH	On-Demand	Mild	CTSK	22	40
CC[C@@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675345	FH	On-Demand	Mild	CTSS	36	40
CC[C@@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675345	FH	On-Demand	Mild	NPFFR1	60	38
COc1ccccc1-c1nnc(SCC(=O)CC(C)(C)C2CC2)o1	ZINC000450675352	EI	On-Demand	Anodyne	ALOX15	63	39
CC[C@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675378	FH	On-Demand	Mild	SIGMAR1	41	38
CC[C@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675378	FH	On-Demand	Mild	CTSF	43	34
CC[C@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675378	FH	On-Demand	Mild	CTSK	22	40
CC[C@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675378	FH	On-Demand	Mild	CTSS	36	40
CC[C@H](CC(F)(F)F)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675378	FH	On-Demand	Mild	NPFFR1	60	38
COc1ccc(-c2ccnc(N[C@H]3CC[C@@H](CC#N)C3)n2)cc1	ZINC000450675384	DH	On-Demand	Mild	MAPK1	58	43
COc1ccc(-c2ccnc(N[C@H]3CC[C@@H](CC#N)C3)n2)cc1	ZINC000450675384	DH	On-Demand	Mild	VCP	23	42
O=C(CNC(=O)COc1c(Cl)cc(Cl)cc1Cl)NCC1CC1	ZINC000450675391	FF	On-Demand	Anodyne	CACNA1I	46	38
COc1ccccc1-c1nnc(S[C@H](C)C(=O)C2CCCCC2)o1	ZINC000450675428	EI	On-Demand	Anodyne	ALOX15	27	43
Cc1cccc(CNC(C)(C)c2cccc(Cl)c2)n1	ZINC000450675429	CI	On-Demand	Anodyne	PETD	0	42
N#CC[C@@H]1CC[C@H](Nc2c(C#N)cnc3c(F)cc(F)cc23)C1	ZINC000450675433	DH	On-Demand	Mild	MAP3K8	48	33
Cc1ccc(N2CCC[C@H]2COc2ccccc2)nc1C#N	ZINC000450675438	CG	On-Demand	Mild	CHRNA10	71	52
C[C@H](NCc1ccccc1OC1CC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450675453	GJ	On-Demand	Anodyne	GUAB	0	41
C[C@H](NCc1ccccc1OC1CC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450675453	GJ	On-Demand	Anodyne	PRNP	61	36
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CSc3ccccc3O2)o1	ZINC000450675457	FI	On-Demand	Anodyne	COLA	89	36
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CSc3ccccc3O2)o1	ZINC000450675457	FI	On-Demand	Anodyne	CPT1A	83	36
C[C@@H](NCc1ccccc1OC1CC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450675458	GJ	On-Demand	Anodyne	GUAB	0	41
C[C@@H](NCc1ccccc1OC1CC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450675458	GJ	On-Demand	Anodyne	PRNP	61	36
COCc1ccc([C@@H]2CCCN2C(=O)C[C@H]2CSc3ccccc3O2)o1	ZINC000450675459	FI	On-Demand	Anodyne	COLA	89	36
COCc1ccc([C@@H]2CCCN2C(=O)C[C@H]2CSc3ccccc3O2)o1	ZINC000450675459	FI	On-Demand	Anodyne	CPT1A	83	36
COCc1ccc([C@H]2CCCN2C(=O)C[C@@H]2CSc3ccccc3O2)o1	ZINC000450675460	FI	On-Demand	Anodyne	COLA	89	36
COCc1ccc([C@H]2CCCN2C(=O)C[C@@H]2CSc3ccccc3O2)o1	ZINC000450675460	FI	On-Demand	Anodyne	CPT1A	83	36
COCc1ccc([C@H]2CCCN2C(=O)C[C@H]2CSc3ccccc3O2)o1	ZINC000450675461	FI	On-Demand	Anodyne	COLA	89	36
COCc1ccc([C@H]2CCCN2C(=O)C[C@H]2CSc3ccccc3O2)o1	ZINC000450675461	FI	On-Demand	Anodyne	CPT1A	83	36
Cc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450675467	CF	On-Demand	Anodyne	CASP3	54	39
Cc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450675467	CF	On-Demand	Anodyne	CHRNA10	73	54
Cc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450675467	CF	On-Demand	Anodyne	CASP7	41	39
CC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675472	EG	On-Demand	Mild	SIGMAR1	57	41
CC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675472	EG	On-Demand	Mild	CTSB	36	41
CC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675472	EG	On-Demand	Mild	CTSK	32	48
CC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675472	EG	On-Demand	Mild	CTSS	26	41
CC[C@@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675472	EG	On-Demand	Mild	NPFFR1	60	40
Cc1cc(N2CCC[C@H]2COc2ccccc2)cc(C#N)n1	ZINC000450675473	CG	On-Demand	Mild	CHRNA10	77	50
CC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675474	EG	On-Demand	Mild	SIGMAR1	57	41
CC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675474	EG	On-Demand	Mild	CTSB	36	41
CC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675474	EG	On-Demand	Mild	CTSK	32	48
CC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675474	EG	On-Demand	Mild	CTSS	26	41
CC[C@H]1CCC[C@@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675474	EG	On-Demand	Mild	NPFFR1	60	40
CC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675480	EG	On-Demand	Mild	SIGMAR1	57	41
CC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675480	EG	On-Demand	Mild	CTSB	36	41
CC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675480	EG	On-Demand	Mild	CTSK	32	48
CC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675480	EG	On-Demand	Mild	CTSS	26	41
CC[C@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675480	EG	On-Demand	Mild	NPFFR1	60	40
CCCOc1ccc(C(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)c(OC)c1	ZINC000450675483	EG	On-Demand	Anodyne	HCN1	50	31
CCCOc1ccc(C(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)c(OC)c1	ZINC000450675483	EG	On-Demand	Anodyne	HCN4	48	31
CC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675484	EG	On-Demand	Mild	SIGMAR1	57	41
CC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675484	EG	On-Demand	Mild	CTSB	36	41
CC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675484	EG	On-Demand	Mild	CTSK	32	48
CC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675484	EG	On-Demand	Mild	CTSS	26	41
CC[C@@H]1CCC[C@H]1C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450675484	EG	On-Demand	Mild	NPFFR1	60	40
CCCOc1ccc(C(=O)NC[C@]2(C)CCO[C@H]2C2CC2)c(OC)c1	ZINC000450675486	EG	On-Demand	Anodyne	HCN1	50	31
CCCOc1ccc(C(=O)NC[C@]2(C)CCO[C@H]2C2CC2)c(OC)c1	ZINC000450675486	EG	On-Demand	Anodyne	HCN4	48	31
CCCOc1ccc(C(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450675487	EG	On-Demand	Anodyne	HCN1	50	31
CCCOc1ccc(C(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450675487	EG	On-Demand	Anodyne	HCN4	48	31
CCCOc1ccc(C(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450675489	EG	On-Demand	Anodyne	HCN1	50	31
CCCOc1ccc(C(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450675489	EG	On-Demand	Anodyne	HCN4	48	31
C[C@@H]1CC[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675511	FH	On-Demand	Mild	SIGMAR1	64	43
C[C@@H]1CC[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675511	FH	On-Demand	Mild	CTSB	31	41
C[C@@H]1CC[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675511	FH	On-Demand	Mild	CTSK	20	45
C[C@@H]1CC[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675511	FH	On-Demand	Mild	CTSS	22	42
C[C@@H]1CC[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675511	FH	On-Demand	Mild	NPFFR1	57	37
C[C@H]1C[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675514	FH	On-Demand	Mild	SIGMAR1	64	43
C[C@H]1C[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675514	FH	On-Demand	Mild	CTSB	31	41
C[C@H]1C[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675514	FH	On-Demand	Mild	CTSK	20	45
C[C@H]1C[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675514	FH	On-Demand	Mild	CTSS	22	42
C[C@H]1C[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675514	FH	On-Demand	Mild	NPFFR1	57	37
C[C@@H]1CC[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675517	FH	On-Demand	Mild	SIGMAR1	64	43
C[C@@H]1CC[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675517	FH	On-Demand	Mild	CTSB	31	41
C[C@@H]1CC[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675517	FH	On-Demand	Mild	CTSK	20	45
C[C@@H]1CC[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675517	FH	On-Demand	Mild	CTSS	22	42
C[C@@H]1CC[C@@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C[C@H]1C	ZINC000450675517	FH	On-Demand	Mild	NPFFR1	57	37
C[C@H]1C[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675518	FH	On-Demand	Mild	SIGMAR1	64	43
C[C@H]1C[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675518	FH	On-Demand	Mild	CTSB	31	41
C[C@H]1C[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675518	FH	On-Demand	Mild	CTSK	20	45
C[C@H]1C[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675518	FH	On-Demand	Mild	CTSS	22	42
C[C@H]1C[C@H](C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CC[C@H]1C	ZINC000450675518	FH	On-Demand	Mild	NPFFR1	57	37
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450675535	EE	On-Demand	Anodyne	MAPK13	54	33
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450675535	EE	On-Demand	Anodyne	EPHX2	17	44
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450675539	EE	On-Demand	Anodyne	MAPK13	54	33
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450675539	EE	On-Demand	Anodyne	EPHX2	17	44
C[C@@H]1C[C@]1(C#N)C(=O)N[C@H](CO)c1ccccc1	ZINC000450675543	BD	On-Demand	Mild	GPR88	0	44
C[C@@H]1C[C@@]1(C#N)C(=O)N[C@H](CO)c1ccccc1	ZINC000450675544	BD	On-Demand	Mild	GPR88	0	44
C[C@H]1C[C@@]1(C#N)C(=O)N[C@H](CO)c1ccccc1	ZINC000450675546	BD	On-Demand	Mild	GPR88	0	44
C[C@H]1C[C@]1(C#N)C(=O)N[C@H](CO)c1ccccc1	ZINC000450675547	BD	On-Demand	Mild	GPR88	0	44
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450675552	DD	On-Demand	Anodyne	MLNR	33	41
c1ccc(OC[C@@H](NCc2nnc(C3CC3)s2)c2ccccc2)cc1	ZINC000450675558	FI	On-Demand	Anodyne	MAN1B1	40	34
CNC(=O)N[C@H]1CCN(C(=O)[C@H](C)OCc2ccc(F)cc2)C1	ZINC000450675559	DD	On-Demand	Anodyne	MLNR	33	41
CNC(=O)N[C@H]1CCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450675560	DD	On-Demand	Anodyne	MLNR	33	41
c1ccc(OC[C@H](NCc2nnc(C3CC3)s2)c2ccccc2)cc1	ZINC000450675561	FI	On-Demand	Anodyne	MAN1B1	40	34
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](C)OCc2ccc(F)cc2)C1	ZINC000450675562	DD	On-Demand	Anodyne	MLNR	33	41
COCC[C@@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450675580	DH	On-Demand	Anodyne	COLA	40	35
CCOc1cc(N[C@H](C(=O)N(C)CC)C(C)C)ccc1[N+](=O)[O-]	ZINC000450675586	DF	On-Demand	Bother	COLA	40	31
CNC(=O)N[C@@H]1CCN(C(=O)C2(c3cccc(Cl)c3)CC(C)C2)C1	ZINC000450675592	EF	On-Demand	Anodyne	MTNR1A	0	40
CNC(=O)N[C@H]1CCN(C(=O)C2(c3cccc(Cl)c3)CC(C)C2)C1	ZINC000450675593	EF	On-Demand	Anodyne	MTNR1A	0	40
CNC(=O)N[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675598	ED	On-Demand	Anodyne	DRD3	0	41
CNC(=O)N[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675598	ED	On-Demand	Anodyne	OPRK1	37	42
CNC(=O)N[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675598	ED	On-Demand	Anodyne	HTR4	56	38
CNC(=O)N[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675598	ED	On-Demand	Anodyne	MLNR	27	41
CNC(=O)N[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675598	ED	On-Demand	Anodyne	EPHX2	27	42
CNC(=O)N[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675599	ED	On-Demand	Anodyne	DRD3	0	41
CNC(=O)N[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675599	ED	On-Demand	Anodyne	OPRK1	37	42
CNC(=O)N[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675599	ED	On-Demand	Anodyne	HTR4	56	38
CNC(=O)N[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675599	ED	On-Demand	Anodyne	MLNR	27	41
CNC(=O)N[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450675599	ED	On-Demand	Anodyne	EPHX2	27	42
CNC(=O)N[C@@H]1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450675600	GE	On-Demand	Anodyne	HRH4	26	45
CNC(=O)N[C@H]1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450675601	GE	On-Demand	Anodyne	HRH4	26	45
CCN(C)C(=O)[C@@H](Nc1nc(N)c2cc(OC)c(OC)cc2n1)C(C)C	ZINC000450675602	FD	On-Demand	Anodyne	ADRA1D	19	42
CCN(C)C(=O)[C@@H](Nc1nc(N)c2cc(OC)c(OC)cc2n1)C(C)C	ZINC000450675602	FD	On-Demand	Anodyne	ADRA1B	41	41
CCN(C)C(=O)[C@@H](Nc1nc(N)c2cc(OC)c(OC)cc2n1)C(C)C	ZINC000450675602	FD	On-Demand	Anodyne	DRTS_TRYCR	46	32
COC(=O)C1(CN[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000450675609	FH	On-Demand	Anodyne	CXCR2	0	42
COC(=O)C1(CN[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000450675609	FH	On-Demand	Anodyne	PRNP	49	34
COC(=O)C1(CN[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000450675610	FH	On-Demand	Anodyne	CXCR2	0	42
COC(=O)C1(CN[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000450675610	FH	On-Demand	Anodyne	PRNP	49	34
CCn1cnc2c(N[C@H](C)CCC=C(C)C)ncnc21	ZINC000450675611	CG	On-Demand	Anodyne	AHCY	24	44
CCn1cnc2c(N[C@@H](C)CCC=C(C)C)ncnc21	ZINC000450675612	CG	On-Demand	Anodyne	AHCY	24	44
CCCn1c(O)nnc1S[C@H](C)C(=O)Nc1nccs1	ZINC000450675613	DD	On-Demand	Anodyne	MAP1	103	38
CCCn1c(O)nnc1S[C@@H](C)C(=O)Nc1nccs1	ZINC000450675614	DD	On-Demand	Anodyne	MAP1	103	38
CCOC(=O)c1cccnc1N1C[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C1	ZINC000450675616	CF	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)c1cccnc1N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2CC1	ZINC000450675617	CF	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)c1cccnc1N1C[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C1	ZINC000450675618	CF	On-Demand	Anodyne	P2RY12	43	35
CCN(C)C(=O)[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])C(C)C	ZINC000450675632	CF	On-Demand	Bother	COLA	69	41
CC[C@H](O)CC(=O)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450675644	EE	On-Demand	Anodyne	AKT2	41	33
CC[C@H](O)CC(=O)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450675645	EE	On-Demand	Anodyne	AKT2	41	33
CC[C@@H](O)CC(=O)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450675646	EE	On-Demand	Anodyne	AKT2	41	33
CC[C@@H](O)CC(=O)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450675647	EE	On-Demand	Anodyne	AKT2	41	33
CC(C)[C@H](NCCc1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000450675669	DE	On-Demand	Anodyne	CCR1	65	44
CC(C)[C@H](NCCc1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000450675669	DE	On-Demand	Anodyne	DPP7	47	43
CC(C)[C@@H](NCCc1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000450675670	DE	On-Demand	Anodyne	CCR1	65	44
CC(C)[C@@H](NCCc1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000450675670	DE	On-Demand	Anodyne	DPP7	47	43
COCC1(O)CN(c2ncc(C#N)cc2Cl)C1	ZINC000450675673	CC	On-Demand	Mild	TRPV4	46	41
COCC1(O)CN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450675674	FF	On-Demand	Anodyne	ADRB3	29	46
CCOc1cc(C(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)on1	ZINC000450675685	FG	On-Demand	Anodyne	PDS	40	35
CCOc1cc(C(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)on1	ZINC000450675686	FG	On-Demand	Anodyne	PDS	40	35
Cc1cc(C(=O)NCC(C)(C)c2cccc(Cl)c2F)ncc1C(N)=O	ZINC000450675690	FF	On-Demand	Anodyne	CSF1R	31	41
c1ccc(COC[C@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450675711	EF	On-Demand	Anodyne	MAN2A1	0	47
c1ccc(COC[C@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450675711	EF	On-Demand	Anodyne	MAN1B1	60	56
c1ccc(COC[C@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450675711	EF	On-Demand	Anodyne	MAN1	0	47
c1ccc(COC[C@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450675712	EF	On-Demand	Anodyne	MAN2A1	0	47
c1ccc(COC[C@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450675712	EF	On-Demand	Anodyne	MAN1B1	60	56
c1ccc(COC[C@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450675712	EF	On-Demand	Anodyne	MAN1	0	47
c1ccc(COC[C@@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450675713	EF	On-Demand	Anodyne	MAN2A1	0	47
c1ccc(COC[C@@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450675713	EF	On-Demand	Anodyne	MAN1B1	60	56
c1ccc(COC[C@@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450675713	EF	On-Demand	Anodyne	MAN1	0	47
c1ccc(COC[C@@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450675714	EF	On-Demand	Anodyne	MAN2A1	0	47
c1ccc(COC[C@@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450675714	EF	On-Demand	Anodyne	MAN1B1	60	56
c1ccc(COC[C@@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450675714	EF	On-Demand	Anodyne	MAN1	0	47
CN(C)[C@H](CNC(=O)C1(C(F)(F)F)CCC1)c1cccc(C(F)(F)F)c1	ZINC000450675715	GI	On-Demand	Anodyne	CCR2	44	35
CN(C)[C@H](CNC(=O)C1(C(F)(F)F)CCC1)c1cccc(C(F)(F)F)c1	ZINC000450675715	GI	On-Demand	Anodyne	PAK4	21	41
COc1ccccc1-c1nnc(S[C@@H](C)C(=O)C2CCCCC2)o1	ZINC000450675716	EI	On-Demand	Anodyne	ALOX15	27	43
CN(C)[C@@H](CNC(=O)C1(C(F)(F)F)CCC1)c1cccc(C(F)(F)F)c1	ZINC000450675722	GI	On-Demand	Anodyne	CCR2	44	35
CN(C)[C@@H](CNC(=O)C1(C(F)(F)F)CCC1)c1cccc(C(F)(F)F)c1	ZINC000450675722	GI	On-Demand	Anodyne	PAK4	21	41
COc1ccccc1-c1nnc(SCCC2=CCCCC2)o1	ZINC000450675734	DJ	On-Demand	Anodyne	ALOX15	24	43
CC(C)[C@H]1CCC[C@H](NC(=O)c2cc3n(n2)CCC3)CC1	ZINC000450675747	CG	On-Demand	Anodyne	MAPK13	68	35
CC(C)[C@@H]1CCC[C@H](NC(=O)c2cc3n(n2)CCC3)CC1	ZINC000450675749	CG	On-Demand	Anodyne	MAPK13	68	35
CC(C)[C@H]1CCC[C@@H](NC(=O)c2cc3n(n2)CCC3)CC1	ZINC000450675751	CG	On-Demand	Anodyne	MAPK13	68	35
CC(C)[C@@H]1CCC[C@@H](NC(=O)c2cc3n(n2)CCC3)CC1	ZINC000450675753	CG	On-Demand	Anodyne	MAPK13	68	35
c1ccc(COC[C@@H](NCc2cn(CC3CC3)nn2)c2ccccc2)cc1	ZINC000450675763	FH	On-Demand	Anodyne	MAN1B1	49	44
c1ccc(COC[C@H](NCc2cn(CC3CC3)nn2)c2ccccc2)cc1	ZINC000450675764	FH	On-Demand	Anodyne	MAN1B1	49	44
CC[C@@H](O)CC(=O)NCC(=O)Nc1cccc(Br)c1	ZINC000450675779	ED	On-Demand	Anodyne	EGFR	34	46
CC[C@@H](O)CC(=O)NCC(=O)Nc1cccc(Br)c1	ZINC000450675779	ED	On-Demand	Anodyne	F2R	0	40
CC[C@@H](O)CC(=O)NCC(=O)Nc1cccc(Br)c1	ZINC000450675779	ED	On-Demand	Anodyne	NADD	0	40
CC[C@H](O)CC(=O)NCC(=O)Nc1cccc(Br)c1	ZINC000450675784	ED	On-Demand	Anodyne	EGFR	34	46
CC[C@H](O)CC(=O)NCC(=O)Nc1cccc(Br)c1	ZINC000450675784	ED	On-Demand	Anodyne	F2R	0	40
CC[C@H](O)CC(=O)NCC(=O)Nc1cccc(Br)c1	ZINC000450675784	ED	On-Demand	Anodyne	NADD	0	40
CCOc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)on1	ZINC000450675811	FE	On-Demand	Mild	SIGMAR1	48	42
CCOc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)on1	ZINC000450675811	FE	On-Demand	Mild	SSTR5	40	35
CCOc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)on1	ZINC000450675811	FE	On-Demand	Mild	NPFFR1	53	36
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675822	GD	On-Demand	Bother	BDKRB1	0	50
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675822	GD	On-Demand	Bother	COLA	50	30
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675822	GD	On-Demand	Bother	BCL2L1	115	37
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675822	GD	On-Demand	Bother	BCL2	99	35
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675822	GD	On-Demand	Bother	BCL2L2	53	37
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675825	GD	On-Demand	Bother	BDKRB1	0	50
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675825	GD	On-Demand	Bother	COLA	50	30
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675825	GD	On-Demand	Bother	BCL2L1	115	37
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675825	GD	On-Demand	Bother	BCL2	99	35
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450675825	GD	On-Demand	Bother	BCL2L2	53	37
NS(=O)(=O)c1ccc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450675828	FG	On-Demand	Anodyne	PTGS2	32	42
NS(=O)(=O)c1ccc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450675829	FG	On-Demand	Anodyne	PTGS2	32	42
O=C(CNC(=O)C1(Cc2ccccc2)CCOCC1)NCC1CC1	ZINC000450675833	ED	On-Demand	Anodyne	NPFFR1	48	36
CSc1cccc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450675845	FH	On-Demand	Mild	CHRM3	15	43
CSc1cccc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450675845	FH	On-Demand	Mild	SIGMAR1	50	43
CSc1cccc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450675845	FH	On-Demand	Mild	NPFFR1	58	37
CCOC(=O)c1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)on1	ZINC000450675852	GE	On-Demand	Mild	P2RY12	41	35
CCOC(=O)c1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)on1	ZINC000450675852	GE	On-Demand	Mild	SIGMAR1	40	42
CCOC(=O)c1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)on1	ZINC000450675852	GE	On-Demand	Mild	NPFFR1	58	38
CC(C)(C)C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(F)(F)F	ZINC000450675870	FJ	On-Demand	Anodyne	TIMP3	40	33
CC(C)(C)C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(F)(F)F	ZINC000450675871	FJ	On-Demand	Anodyne	TIMP3	40	33
CNC(=O)[C@@H](NCc1ccccc1OC1CC1)C(C)C	ZINC000450675885	CE	On-Demand	Anodyne	SLC5A4	60	35
CNC(=O)[C@H](NCc1ccccc1OC1CC1)C(C)C	ZINC000450675887	CE	On-Demand	Anodyne	SLC5A4	60	35
N#CC1(NC(=O)c2c[nH]c3nccc-3c2)CCN(Cc2ccccc2)CC1	ZINC000450675889	FF	On-Demand	Mild	NPFFR1	57	39
Cc1cc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)n2ncnc2n1	ZINC000450675900	EH	On-Demand	Anodyne	DHOD	0	52
N#CC[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)NCC3CC3)cn2)C1	ZINC000450675903	EE	On-Demand	Mild	NPY2R	49	37
Cc1cc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)n2ncnc2n1	ZINC000450675904	EH	On-Demand	Anodyne	DHOD	0	52
COc1cc2c(N[C@H]3CC[C@@H](CC#N)C3)ncnc2cc1F	ZINC000450675926	DG	On-Demand	Mild	EGFR	36	43
COc1cc2c(N[C@H]3CC[C@@H](CC#N)C3)ncnc2cc1F	ZINC000450675926	DG	On-Demand	Mild	FGFR1	0	41
COc1cc2c(N[C@H]3CC[C@@H](CC#N)C3)ncnc2cc1F	ZINC000450675926	DG	On-Demand	Mild	FLT1	26	41
COc1cc2c(N[C@H]3CC[C@@H](CC#N)C3)ncnc2cc1F	ZINC000450675926	DG	On-Demand	Mild	EPHA2	45	35
COc1cc2c(N[C@H]3CC[C@@H](CC#N)C3)ncnc2cc1F	ZINC000450675926	DG	On-Demand	Mild	EHMT2	44	30
CC(C)c1nnc(CN[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)s1	ZINC000450675940	GI	On-Demand	Anodyne	PRNP	40	37
CC(C)c1nnc(CN[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)s1	ZINC000450675940	GI	On-Demand	Anodyne	FLT1	20	41
CC(C)c1nnc(CN[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)s1	ZINC000450675941	GI	On-Demand	Anodyne	PRNP	40	37
CC(C)c1nnc(CN[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)s1	ZINC000450675941	GI	On-Demand	Anodyne	FLT1	20	41
COCC[C@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450675951	DH	On-Demand	Anodyne	COLA	40	35
COCC[C@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450675951	DH	On-Demand	Anodyne	L3MBTL3	56	40
COCC[C@H]1CCCCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450675957	GI	On-Demand	Anodyne	HRH4	19	43
COCC[C@H]1CCCCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450675957	GI	On-Demand	Anodyne	AKR1C3	0	46
COCC[C@@H]1CCCCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450675958	GI	On-Demand	Anodyne	HRH4	19	43
COCC[C@@H]1CCCCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450675958	GI	On-Demand	Anodyne	AKR1C3	0	46
CS[C@H]1CCN(c2cc(C3CC3)nc(N3CC[C@H](SC)C3)n2)C1	ZINC000450675973	FG	On-Demand	Anodyne	HRH4	32	42
CS[C@H]1CCN(c2nc(C3CC3)cc(N3CC[C@@H](SC)C3)n2)C1	ZINC000450675974	FG	On-Demand	Anodyne	HRH4	32	42
CS[C@H]1CCN(c2cc(C3CC3)nc(N3CC[C@@H](SC)C3)n2)C1	ZINC000450675975	FG	On-Demand	Anodyne	HRH4	32	42
CS[C@@H]1CCN(c2cc(C3CC3)nc(N3CC[C@@H](SC)C3)n2)C1	ZINC000450675976	FG	On-Demand	Anodyne	HRH4	32	42
O=[N+]([O-])c1cccc2ncnc(N3CCC[C@H]3COc3ccccc3)c12	ZINC000450675986	FH	On-Demand	Bother	CASP3	41	36
O=[N+]([O-])c1cccc2ncnc(N3CCC[C@H]3COc3ccccc3)c12	ZINC000450675986	FH	On-Demand	Bother	CHRNA10	61	43
COCc1ccc([C@@H]2CCCN2C(=O)c2cccc(SC)c2)o1	ZINC000450675996	EI	On-Demand	Anodyne	COLA	56	34
COCc1ccc([C@@H]2CCCN2C(=O)c2cccc(SC)c2)o1	ZINC000450675996	EI	On-Demand	Anodyne	CPT1A	54	34
COCc1ccc([C@H]2CCCN2C(=O)c2cccc(SC)c2)o1	ZINC000450675997	EI	On-Demand	Anodyne	COLA	56	34
COCc1ccc([C@H]2CCCN2C(=O)c2cccc(SC)c2)o1	ZINC000450675997	EI	On-Demand	Anodyne	CPT1A	54	34
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450676011	FC	On-Demand	Anodyne	MTNR1A	26	42
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450676011	FC	On-Demand	Anodyne	MTNR1B	0	42
CNC(=O)N[C@H]1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450676012	FC	On-Demand	Anodyne	MTNR1A	26	42
CNC(=O)N[C@H]1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450676012	FC	On-Demand	Anodyne	MTNR1B	0	42
C[C@H](O)CCCOc1ccc(-n2cnnn2)cc1	ZINC000450676014	BD	On-Demand	Anodyne	CYP2C19	15	42
C[C@@H](O)CCCOc1ccc(-n2cnnn2)cc1	ZINC000450676016	BD	On-Demand	Anodyne	CYP2C19	15	42
CCCc1nc(C)c(CSc2nnc(-c3ccccc3Br)o2)o1	ZINC000450676028	GK	On-Demand	Anodyne	TERT	15	40
COc1cccc(Oc2ccc(C(=O)NC3(CCO)CCN(C)CC3)nc2)c1	ZINC000450676037	GE	On-Demand	Anodyne	DRD4	43	32
CC[C@H](NCCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450676057	FG	On-Demand	Anodyne	CA2	44	43
CC[C@H](NCCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450676057	FG	On-Demand	Anodyne	CA1	38	43
CC[C@H](NCCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450676057	FG	On-Demand	Anodyne	CA12	26	44
CC[C@H](NCCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450676057	FG	On-Demand	Anodyne	CA9	31	44
CC[C@@H](NCCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450676058	FG	On-Demand	Anodyne	CA2	44	43
CC[C@@H](NCCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450676058	FG	On-Demand	Anodyne	CA1	38	43
CC[C@@H](NCCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450676058	FG	On-Demand	Anodyne	CA12	26	44
CC[C@@H](NCCc1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450676058	FG	On-Demand	Anodyne	CA9	31	44
COc1cc(CC(=O)N2CCc3ccncc32)ccc1Cl	ZINC000450676063	DF	On-Demand	Anodyne	EIF2AK3	59	37
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450676068	FH	On-Demand	Anodyne	SLC6A1	34	43
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccc(COC)o2)on1	ZINC000450676094	EF	On-Demand	Anodyne	COLA	68	41
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccc(COC)o2)on1	ZINC000450676094	EF	On-Demand	Anodyne	CPT1A	50	41
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2c2ccc(COC)o2)on1	ZINC000450676095	EF	On-Demand	Anodyne	COLA	68	41
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2c2ccc(COC)o2)on1	ZINC000450676095	EF	On-Demand	Anodyne	CPT1A	50	41
CCOc1cccc([C@@H](C)NCc2ccc(C(=O)OC)c(Cl)c2)c1	ZINC000450676107	EI	On-Demand	Anodyne	PDS	74	41
CCOc1cccc([C@H](C)NCc2ccc(C(=O)OC)c(Cl)c2)c1	ZINC000450676108	EI	On-Demand	Anodyne	PDS	74	41
O=C(N[C@H](CO)c1ccccc1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450676118	EH	On-Demand	Anodyne	TIMP3	48	34
O=C(N[C@H](CO)c1ccccc1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450676118	EH	On-Demand	Anodyne	MAPK1	33	40
CNC(=O)N[C@@H]1CCN(C(=O)Cc2ccc(C)cc2Br)C1	ZINC000450676119	FD	On-Demand	Anodyne	EPHX2	29	45
CNC(=O)N[C@H]1CCN(C(=O)Cc2ccc(C)cc2Br)C1	ZINC000450676120	FD	On-Demand	Anodyne	EPHX2	29	45
Fc1ccccc1OC[C@H](NCc1nnc(C2CC2)s1)c1ccccc1	ZINC000450676125	FI	On-Demand	Anodyne	MAN1B1	18	43
Fc1ccccc1OC[C@@H](NCc1nnc(C2CC2)s1)c1ccccc1	ZINC000450676126	FI	On-Demand	Anodyne	MAN1B1	18	43
CCCn1c(O)nnc1SCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450676136	EG	On-Demand	Anodyne	AGTR1	19	41
CNC(=O)N[C@H]1CCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450676139	EE	On-Demand	Anodyne	EPHX2	22	40
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450676140	EE	On-Demand	Anodyne	EPHX2	22	40
CCC[C@H](CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450676149	CD	On-Demand	Anodyne	EPHX2	18	42
CCC[C@H](CC(C)C)C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450676150	CD	On-Demand	Anodyne	EPHX2	18	42
CCC[C@@H](CC(C)C)C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450676151	CD	On-Demand	Anodyne	EPHX2	18	42
CCC[C@@H](CC(C)C)C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450676152	CD	On-Demand	Anodyne	EPHX2	18	42
CCN(C)C(=O)[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(C)C	ZINC000450676162	FG	On-Demand	Anodyne	TNKS	55	31
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450676171	FD	On-Demand	Bother	CCR2	37	40
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450676171	FD	On-Demand	Bother	EPHX2	30	45
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450676171	FD	On-Demand	Bother	LIPG	49	34
CNC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450676172	FD	On-Demand	Bother	CCR2	37	40
CNC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450676172	FD	On-Demand	Bother	EPHX2	30	45
CNC(=O)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450676172	FD	On-Demand	Bother	LIPG	49	34
CC1=C(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CCC(C)(C)C1	ZINC000450676185	FI	On-Demand	Mild	SIGMAR1	54	43
CC1=C(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)CCC(C)(C)C1	ZINC000450676185	FI	On-Demand	Mild	NPFFR1	57	37
CC[C@H](O)CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676186	DD	On-Demand	Mild	SIGMAR1	55	42
CC[C@H](O)CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676186	DD	On-Demand	Mild	NPFFR2	40	42
CC[C@H](O)CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676186	DD	On-Demand	Mild	NPFFR1	63	43
CC[C@@H](O)CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676187	DD	On-Demand	Mild	SIGMAR1	55	42
CC[C@@H](O)CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676187	DD	On-Demand	Mild	NPFFR2	40	42
CC[C@@H](O)CC(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676187	DD	On-Demand	Mild	NPFFR1	63	43
COc1ccc(CNC(=O)CCNC2(c3cccc(C#N)c3)CC2)c(OC)c1	ZINC000450676190	GF	On-Demand	Mild	MTNR1A	57	38
COc1ccc(CNC(=O)CCNC2(c3cccc(C#N)c3)CC2)c(OC)c1	ZINC000450676190	GF	On-Demand	Mild	MTNR1B	47	38
COC[C@@H](NCCC(C)(F)F)c1cccc(C(F)(F)F)c1	ZINC000450676205	DI	On-Demand	Anodyne	PDS	40	35
COC[C@H](NCCC(C)(F)F)c1cccc(C(F)(F)F)c1	ZINC000450676206	DI	On-Demand	Anodyne	PDS	40	35
CC(C)(C)CCC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450676232	GH	On-Demand	Mild	SIGMAR1	43	40
CC(C)(C)CCC1(O)CC(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)C1	ZINC000450676232	GH	On-Demand	Mild	NPFFR1	51	36
C[C@@H](NCCC(C)(F)F)c1cccc(OC(F)(F)F)c1	ZINC000450676238	CI	On-Demand	Anodyne	CASR	16	42
Cc1cc(C(=O)NCc2ncc(-c3cccs3)[nH]2)nn1C(C)C	ZINC000450676239	EG	On-Demand	Anodyne	GPR142	42	33
C[C@H](NCCC(C)(F)F)c1cccc(OC(F)(F)F)c1	ZINC000450676240	CI	On-Demand	Anodyne	CASR	16	42
CN(C[C@H]1CCCC[C@@H]1O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450676241	FE	On-Demand	Anodyne	PYGL	37	40
CN(C[C@H]1CCCC[C@@H]1O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450676241	FE	On-Demand	Anodyne	PRMT3	40	37
CN(C[C@H]1CCCC[C@H]1O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450676242	FE	On-Demand	Anodyne	PYGL	37	40
CN(C[C@H]1CCCC[C@H]1O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450676242	FE	On-Demand	Anodyne	PRMT3	40	37
CN(C[C@@H]1CCCC[C@H]1O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450676243	FE	On-Demand	Anodyne	PYGL	37	40
CN(C[C@@H]1CCCC[C@H]1O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450676243	FE	On-Demand	Anodyne	PRMT3	40	37
CN(C[C@@H]1CCCC[C@@H]1O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450676244	FE	On-Demand	Anodyne	PYGL	37	40
CN(C[C@@H]1CCCC[C@@H]1O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450676244	FE	On-Demand	Anodyne	PRMT3	40	37
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	TRY1_BOVIN	0	40
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	CTSG	25	43
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	CTRB1	34	43
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	CELA2A	26	43
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	HDAC1	22	43
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	CTRB_BOVIN	22	40
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	ENPP2	18	41
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	SCD1	15	51
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	SMO	0	43
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676259	FH	On-Demand	Anodyne	HPGDS	31	45
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	TRY1_BOVIN	0	40
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	CTSG	25	43
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	CTRB1	34	43
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	CELA2A	26	43
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	HDAC1	22	43
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	CTRB_BOVIN	22	40
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	ENPP2	18	41
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	SCD1	15	51
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	SMO	0	43
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450676261	FH	On-Demand	Anodyne	HPGDS	31	45
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1C[C@@H]1CCCO1	ZINC000450676271	FH	On-Demand	Anodyne	TNKS	40	31
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1C[C@H]1CCCO1	ZINC000450676272	FH	On-Demand	Anodyne	TNKS	40	31
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450676293	FD	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450676297	FD	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450676299	FD	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450676301	FD	On-Demand	Anodyne	DRD4	40	31
C[C@H](O)CCCN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450676302	DH	On-Demand	Anodyne	MAN2A1	0	40
C[C@H](O)CCCN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450676303	DH	On-Demand	Anodyne	MAN2A1	0	40
C[C@H](O)CCCN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450676303	DH	On-Demand	Anodyne	MAN1B1	51	48
C[C@@H](O)CCCN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450676304	DH	On-Demand	Anodyne	MAN2A1	0	40
C[C@@H](O)CCCN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450676304	DH	On-Demand	Anodyne	MAN1B1	51	48
C[C@@H](O)CCCN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450676306	DH	On-Demand	Anodyne	MAN2A1	0	40
C[C@@H](O)CCCN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450676306	DH	On-Demand	Anodyne	MAN1B1	51	48
Cn1ccc(CN[C@@H](COCc2ccccc2)c2ccccc2)n1	ZINC000450676318	DG	On-Demand	Anodyne	MAN1B1	50	46
Cn1ccc(CN[C@H](COCc2ccccc2)c2ccccc2)n1	ZINC000450676321	DG	On-Demand	Anodyne	MAN1B1	50	46
CC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ncc[nH]1	ZINC000450676323	CF	On-Demand	Anodyne	P2RY12	44	33
CC[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ncc[nH]1	ZINC000450676323	CF	On-Demand	Anodyne	F11	46	35
CC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ncc[nH]1	ZINC000450676324	CF	On-Demand	Anodyne	P2RY12	44	33
CC[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ncc[nH]1	ZINC000450676324	CF	On-Demand	Anodyne	F11	46	35
CC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ncc[nH]1	ZINC000450676326	CF	On-Demand	Anodyne	P2RY12	44	33
CC[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ncc[nH]1	ZINC000450676326	CF	On-Demand	Anodyne	F11	46	35
CC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ncc[nH]1	ZINC000450676329	CF	On-Demand	Anodyne	P2RY12	44	33
CC[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ncc[nH]1	ZINC000450676329	CF	On-Demand	Anodyne	F11	46	35
COCc1nn(C)cc1C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450676341	GH	On-Demand	Anodyne	CACNA1B	46	32
COCc1nn(C)cc1C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450676341	GH	On-Demand	Anodyne	COLA	58	41
COCc1nn(C)cc1C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450676341	GH	On-Demand	Anodyne	CPT1A	56	41
COCc1nn(C)cc1C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450676341	GH	On-Demand	Anodyne	LIPG	41	32
COCc1nn(C)cc1C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450676343	GH	On-Demand	Anodyne	CACNA1B	46	32
COCc1nn(C)cc1C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450676343	GH	On-Demand	Anodyne	COLA	58	41
COCc1nn(C)cc1C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450676343	GH	On-Demand	Anodyne	CPT1A	56	41
COCc1nn(C)cc1C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450676343	GH	On-Demand	Anodyne	LIPG	41	32
COc1ccc(CNC(=O)CCN[C@@H](C)C2CCOCC2)c(OC)c1	ZINC000450676358	FE	On-Demand	Anodyne	MTNR1A	72	38
COc1ccc(CNC(=O)CCN[C@@H](C)C2CCOCC2)c(OC)c1	ZINC000450676358	FE	On-Demand	Anodyne	MTNR1B	57	38
COc1ccc(CNC(=O)CCN[C@H](C)C2CCOCC2)c(OC)c1	ZINC000450676360	FE	On-Demand	Anodyne	MTNR1A	72	38
COc1ccc(CNC(=O)CCN[C@H](C)C2CCOCC2)c(OC)c1	ZINC000450676360	FE	On-Demand	Anodyne	MTNR1B	57	38
COCC[C@H](NC(=O)Cc1scnc1-c1ccccc1)c1ccc(C)o1	ZINC000450676377	FI	On-Demand	Anodyne	NPPA	41	33
COCC[C@@H](NC(=O)Cc1scnc1-c1ccccc1)c1ccc(C)o1	ZINC000450676378	FI	On-Demand	Anodyne	NPPA	41	33
COC(=O)C1(CNC2(c3ccc4c(c3)OCO4)CC2)CC1	ZINC000450676409	CD	On-Demand	Anodyne	SCN9A	18	43
CCC1(CC)CN(C(=O)Cc2ccc(O)c(OC)c2)CC[S@]1=O	ZINC000450676417	EE	On-Demand	Anodyne	TRPV1	16	45
CCC1(CC)CN(C(=O)Cc2ccc(O)c(OC)c2)CC[S@@]1=O	ZINC000450676421	EE	On-Demand	Anodyne	TRPV1	16	45
Cc1[nH]c(C#N)cc1C(=O)NCC(C)(C)c1cccc(Cl)c1F	ZINC000450676441	EH	On-Demand	Mild	ECR	52	39
Cc1[nH]c(C#N)cc1C(=O)NCC(C)(C)c1cccc(Cl)c1F	ZINC000450676441	EH	On-Demand	Mild	E3UJZ5_SPOLI	41	35
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450676447	GH	On-Demand	Anodyne	MMP13	0	40
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450676447	GH	On-Demand	Anodyne	UL54	41	29
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450676448	GH	On-Demand	Anodyne	MMP13	0	40
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450676448	GH	On-Demand	Anodyne	UL54	41	29
COC[C@]1(C(=O)OC)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450676453	EE	On-Demand	Anodyne	PDGFRB	54	44
COC[C@@]1(C(=O)OC)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450676454	EE	On-Demand	Anodyne	PDGFRB	54	44
COc1ccc(CNC(=O)CCNC2(c3cccc(F)c3)CC2)c(OC)c1	ZINC000450676459	FG	On-Demand	Anodyne	P2RX7	27	41
COc1ccc(CNC(=O)CCNC2(c3cccc(F)c3)CC2)c(OC)c1	ZINC000450676459	FG	On-Demand	Anodyne	MTNR1A	57	36
COc1ccc(CNC(=O)CCNC2(c3cccc(F)c3)CC2)c(OC)c1	ZINC000450676459	FG	On-Demand	Anodyne	MTNR1B	51	36
COC(=O)c1csc(CN[C@@H](CC(C)C)c2ccc(Cl)cc2)n1	ZINC000450676460	FI	On-Demand	Anodyne	FFAR2	16	40
COC(=O)c1csc(CN[C@H](CC(C)C)c2ccc(Cl)cc2)n1	ZINC000450676461	FI	On-Demand	Anodyne	FFAR2	16	40
CCC(=O)C1(C(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000450676473	EH	On-Demand	Anodyne	SRD5A2	0	44
COCCOC[C@@H](O)CNC(C)(C)c1ccc(C(C)(C)C)cc1	ZINC000450676474	DF	On-Demand	Anodyne	ADRB2	44	40
COCCOC[C@@H](O)CNC(C)(C)c1ccc(C(C)(C)C)cc1	ZINC000450676474	DF	On-Demand	Anodyne	ADRB1	27	40
COCCOC[C@H](O)CNC(C)(C)c1ccc(C(C)(C)C)cc1	ZINC000450676475	DF	On-Demand	Anodyne	ADRB2	44	40
COCCOC[C@H](O)CNC(C)(C)c1ccc(C(C)(C)C)cc1	ZINC000450676475	DF	On-Demand	Anodyne	ADRB1	27	40
N#CC[C@@H](O)CSc1nnc(-c2ccccc2Br)o1	ZINC000450676499	EF	On-Demand	Mild	ALOX15	51	36
CC(=O)CCCCCSc1nnc(-c2ccccc2Br)o1	ZINC000450676504	FJ	On-Demand	Anodyne	ALOX15	62	39
CC(F)(F)CCSc1nnc(-c2ccccc2Br)o1	ZINC000450676505	EJ	On-Demand	Anodyne	ALOX15	58	35
CC(F)(F)CCSc1nnc(-c2ccccc2Br)o1	ZINC000450676505	EJ	On-Demand	Anodyne	CYP73A16	20	44
COc1cc(C(C)=O)ccc1OCc1cn(C)nc1C	ZINC000450676519	CF	On-Demand	Anodyne	PDGFRB	15	41
COC(=O)c1coc(COc2ccc(C(C)=O)cc2OC)n1	ZINC000450676524	DE	On-Demand	Anodyne	ENPP1	40	30
COCC[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450676529	DG	On-Demand	Anodyne	AKR1C3	0	44
COCC[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450676530	DG	On-Demand	Anodyne	AKR1C3	0	44
COC[C@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450676533	CG	On-Demand	Anodyne	CPT1A	55	36
COC[C@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450676533	CG	On-Demand	Anodyne	L3MBTL1	0	42
COC[C@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450676533	CG	On-Demand	Anodyne	L3MBTL3	49	42
COC[C@@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450676534	CG	On-Demand	Anodyne	CPT1A	55	36
COC[C@@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450676534	CG	On-Demand	Anodyne	L3MBTL1	0	42
COC[C@@H]1CCCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450676534	CG	On-Demand	Anodyne	L3MBTL3	49	42
COCc1ccc([C@@H]2CCCN2C(=O)c2cc(C)c(C(N)=O)cn2)o1	ZINC000450676549	EE	On-Demand	Anodyne	COLA	43	34
COCc1ccc([C@H]2CCCN2C(=O)c2cc(C)c(C(N)=O)cn2)o1	ZINC000450676550	EE	On-Demand	Anodyne	COLA	43	34
COC[C@@H]1CCCCN(C(=O)c2ccc3scc(Br)c3c2)C1	ZINC000450676561	GJ	On-Demand	Anodyne	L3MBTL3	46	37
COC[C@H]1CCCCN(C(=O)c2ccc3scc(Br)c3c2)C1	ZINC000450676562	GJ	On-Demand	Anodyne	L3MBTL3	46	37
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450676626	DD	On-Demand	Anodyne	ACE	44	36
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450676626	DD	On-Demand	Anodyne	BIRC2	57	46
CNC(=O)N[C@H]1CCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450676627	DD	On-Demand	Anodyne	ACE	44	36
CNC(=O)N[C@H]1CCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450676627	DD	On-Demand	Anodyne	BIRC2	57	46
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450676628	DD	On-Demand	Anodyne	ACE	44	36
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450676628	DD	On-Demand	Anodyne	BIRC2	57	46
CNC(=O)N[C@H]1CCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450676629	DD	On-Demand	Anodyne	ACE	44	36
CNC(=O)N[C@H]1CCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450676629	DD	On-Demand	Anodyne	BIRC2	57	46
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)cc2Cl)c(OC)c1	ZINC000450676666	GH	On-Demand	Anodyne	PTGS2	0	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)cc2Cl)c(OC)c1	ZINC000450676666	GH	On-Demand	Anodyne	P2RX7	60	46
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)cc2Cl)c(OC)c1	ZINC000450676666	GH	On-Demand	Anodyne	MTNR1A	42	36
COc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000450676667	DI	On-Demand	Bother	CACNA1C	45	39
COc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000450676667	DI	On-Demand	Bother	CACNA1D	71	39
COc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000450676668	DI	On-Demand	Bother	CACNA1C	45	39
COc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000450676668	DI	On-Demand	Bother	CACNA1D	71	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)cc2Cl)c(OC)c1	ZINC000450676670	GH	On-Demand	Anodyne	PTGS2	0	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)cc2Cl)c(OC)c1	ZINC000450676670	GH	On-Demand	Anodyne	P2RX7	60	46
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)cc2Cl)c(OC)c1	ZINC000450676670	GH	On-Demand	Anodyne	MTNR1A	42	36
CC[C@H](NC(=O)C(CC(C)C)CC(C)C)c1ncc[nH]1	ZINC000450676674	CH	On-Demand	Anodyne	MMP7	31	40
CC[C@H](NC(=O)C(CC(C)C)CC(C)C)c1ncc[nH]1	ZINC000450676674	CH	On-Demand	Anodyne	MMP1	18	69
CC[C@@H](NC(=O)C(CC(C)C)CC(C)C)c1ncc[nH]1	ZINC000450676675	CH	On-Demand	Anodyne	MMP7	31	40
CCC(=O)C1(C(=O)N[C@H](CO)c2ccccc2)CC1	ZINC000450676688	CD	On-Demand	Anodyne	GPR88	0	43
CCC[C@@H](O)CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450676695	EG	On-Demand	Anodyne	PRNP	57	41
CCC[C@H](O)CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450676696	EG	On-Demand	Anodyne	PRNP	57	41
CCC[C@H](O)CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450676697	EG	On-Demand	Anodyne	PRNP	57	41
CCC[C@@H](O)CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450676698	EG	On-Demand	Anodyne	PRNP	57	41
CC(F)(F)c1ccc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cn1	ZINC000450676703	GG	On-Demand	Mild	SIGMAR1	38	40
CC(F)(F)c1ccc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)cn1	ZINC000450676703	GG	On-Demand	Mild	NPFFR1	51	35
CCCc1nc(C)c(CSc2nnc(-c3ccccc3OC)o2)o1	ZINC000450676746	EI	On-Demand	Anodyne	ALOX15	44	34
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676757	FF	On-Demand	Anodyne	ADRA1D	19	58
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676757	FF	On-Demand	Anodyne	ADRA1B	54	58
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676757	FF	On-Demand	Anodyne	PDE3A	42	32
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676757	FF	On-Demand	Anodyne	CCR4	49	41
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676757	FF	On-Demand	Anodyne	PDE3B	63	32
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676757	FF	On-Demand	Anodyne	EHMT2	66	33
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676759	FF	On-Demand	Anodyne	ADRA1D	19	58
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676759	FF	On-Demand	Anodyne	ADRA1B	54	58
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676759	FF	On-Demand	Anodyne	PDE3A	42	32
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676759	FF	On-Demand	Anodyne	CCR4	49	41
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676759	FF	On-Demand	Anodyne	PDE3B	63	32
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450676759	FF	On-Demand	Anodyne	EHMT2	66	33
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676762	FF	On-Demand	Anodyne	ADRA1D	19	58
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676762	FF	On-Demand	Anodyne	ADRA1B	54	58
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676762	FF	On-Demand	Anodyne	PDE3A	42	32
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676762	FF	On-Demand	Anodyne	CCR4	49	41
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676762	FF	On-Demand	Anodyne	PDE3B	63	32
COc1cc2nc(N3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676762	FF	On-Demand	Anodyne	EHMT2	66	33
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676765	FF	On-Demand	Anodyne	ADRA1D	19	58
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676765	FF	On-Demand	Anodyne	ADRA1B	54	58
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676765	FF	On-Demand	Anodyne	PDE3A	42	32
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676765	FF	On-Demand	Anodyne	CCR4	49	41
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676765	FF	On-Demand	Anodyne	PDE3B	63	32
COc1cc2nc(N3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450676765	FF	On-Demand	Anodyne	EHMT2	66	33
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450676766	GG	On-Demand	Bother	BCL2L1	85	33
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450676766	GG	On-Demand	Bother	BCL2	60	37
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450676766	GG	On-Demand	Bother	BCL2L2	43	31
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450676767	GG	On-Demand	Bother	BCL2L1	85	33
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450676767	GG	On-Demand	Bother	BCL2	60	37
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450676767	GG	On-Demand	Bother	BCL2L2	43	31
Cc1ccc(F)c(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450676777	FG	On-Demand	Mild	SIGMAR1	54	50
Cc1ccc(F)c(CC(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000450676777	FG	On-Demand	Mild	NPFFR1	60	38
COCCOc1ccc(Br)cc1NC(=O)c1cn(CC2CC2)nn1	ZINC000450676780	GF	On-Demand	Anodyne	GPR35	44	31
CC[C@@H](CNS(C)(=O)=O)Nc1ncccc1OCc1ccccc1	ZINC000450676784	EE	On-Demand	Anodyne	PPIA	39	46
CC(C)(C)C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(F)(F)F	ZINC000450676787	EG	On-Demand	Anodyne	HPGDS	32	51
CC[C@H](CNS(C)(=O)=O)Nc1ncccc1OCc1ccccc1	ZINC000450676788	EE	On-Demand	Anodyne	PPIA	39	46
CC(C)(C)C[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(F)(F)F	ZINC000450676789	EG	On-Demand	Anodyne	HPGDS	32	51
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450676790	GF	On-Demand	Anodyne	SLC6A1	63	37
COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450676790	GF	On-Demand	Anodyne	SLC6A3	31	47
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450676792	GF	On-Demand	Anodyne	SLC6A1	63	37
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450676792	GF	On-Demand	Anodyne	SLC6A3	31	47
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450676793	GF	On-Demand	Anodyne	SLC6A1	63	37
COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450676793	GF	On-Demand	Anodyne	SLC6A3	31	47
CO[C@@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450676830	DH	On-Demand	Bother	CACNA1D	56	38
CO[C@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450676834	DH	On-Demand	Bother	CACNA1D	56	38
CO[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450676841	DH	On-Demand	Bother	CACNA1D	56	38
CO[C@@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000450676845	DH	On-Demand	Bother	CACNA1D	56	38
CCc1c(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)oc2ccccc12	ZINC000450676849	GI	On-Demand	Mild	SIGMAR1	42	41
CCc1c(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)oc2ccccc12	ZINC000450676849	GI	On-Demand	Mild	NPFFR1	56	37
N#CC[C@@H]1CC[C@H](Nc2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450676851	EJ	On-Demand	Mild	ADRB3	27	46
CCN(CCO)CCNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450676857	CC	On-Demand	Anodyne	MME	57	38
CCN(CCO)CCNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450676857	CC	On-Demand	Anodyne	NPR	44	35
CCN(CCO)CCNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450676857	CC	On-Demand	Anodyne	AMP1_PLAFQ	46	38
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676859	GG	On-Demand	Mild	SIGMAR1	57	44
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676859	GG	On-Demand	Mild	CTSL	19	44
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676859	GG	On-Demand	Mild	CTSS	38	44
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676859	GG	On-Demand	Mild	CACNA1G	41	40
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676859	GG	On-Demand	Mild	NPFFR1	59	35
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676861	GG	On-Demand	Mild	SIGMAR1	57	44
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676861	GG	On-Demand	Mild	CTSL	19	44
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676861	GG	On-Demand	Mild	CTSS	38	44
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676861	GG	On-Demand	Mild	CACNA1G	41	40
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450676861	GG	On-Demand	Mild	NPFFR1	59	35
CCN(CCO)CCNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450676864	CC	On-Demand	Anodyne	MME	57	38
CCN(CCO)CCNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450676864	CC	On-Demand	Anodyne	NPR	44	35
CCN(CCO)CCNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450676864	CC	On-Demand	Anodyne	AMP1_PLAFQ	46	38
COC[C@@H](NCc1ccccc1OC1CC1)c1ccc(F)cc1	ZINC000450676875	DH	On-Demand	Anodyne	SLC6A3	20	42
COC[C@H](NCc1ccccc1OC1CC1)c1ccc(F)cc1	ZINC000450676876	DH	On-Demand	Anodyne	SLC6A3	20	42
CCS(=O)(=O)c1ccc(CN[C@@H](c2cccc(F)c2)C(C)(C)C)cc1	ZINC000450676891	FI	On-Demand	Anodyne	RORC	46	38
CCS(=O)(=O)c1ccc(CN[C@H](c2cccc(F)c2)C(C)(C)C)cc1	ZINC000450676893	FI	On-Demand	Anodyne	RORC	46	38
CCS(=O)(=O)c1ccc(CN[C@@H](c2ccccc2C)C(C)(C)C)cc1	ZINC000450676934	FJ	On-Demand	Anodyne	RORC	40	39
CCS(=O)(=O)c1ccc(CN[C@H](c2ccccc2C)C(C)(C)C)cc1	ZINC000450676935	FJ	On-Demand	Anodyne	RORC	40	39
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	HTR1A	20	40
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	DRD2	33	43
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	DRD4	35	40
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	HTR2A	35	41
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	HTR2C	34	41
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	AVPR2	43	36
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	SLC6A4	19	41
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	DRD3	55	38
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	KCNQ2	86	49
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	P2RX7	55	38
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	SCN2A	23	53
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	EPHX2	20	41
Cc1cccc(Cl)c1C(=O)NCc1ccccc1N1CCCCC1	ZINC000450676939	EJ	On-Demand	Anodyne	SCN10A	35	53
COC[C@]1(C(=O)OC)CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450676940	FG	On-Demand	Anodyne	CCR2	20	40
COC[C@@]1(C(=O)OC)CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450676941	FG	On-Demand	Anodyne	CCR2	20	40
COC[C@]1(C(=O)OC)CCN(c2ccnc(C(C)C)n2)C1	ZINC000450676956	CD	On-Demand	Anodyne	SORD	52	35
COC[C@@]1(C(=O)OC)CCN(c2ccnc(C(C)C)n2)C1	ZINC000450676957	CD	On-Demand	Anodyne	SORD	52	35
Cc1ccn(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)n1	ZINC000450676958	FH	On-Demand	Anodyne	COLA	86	44
Cc1ccn(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)n1	ZINC000450676958	FH	On-Demand	Anodyne	CPT1A	75	44
Cc1ccn(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)n1	ZINC000450676959	FH	On-Demand	Anodyne	COLA	86	44
Cc1ccn(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)n1	ZINC000450676959	FH	On-Demand	Anodyne	CPT1A	75	44
COc1cccc(C2(NC[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450676994	DG	On-Demand	Anodyne	CTSD	16	41
COc1cccc(C2(NC[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450676995	DG	On-Demand	Anodyne	CTSD	16	41
COc1cccc(C2(NC[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450676996	DG	On-Demand	Anodyne	CTSD	16	41
COc1cccc(C2(NC[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450676997	DG	On-Demand	Anodyne	CTSD	16	41
CN(C)[C@@H](CNC(=O)CC1(O)CCC1)c1cccc(C(F)(F)F)c1	ZINC000450677008	EF	On-Demand	Anodyne	CCR2	48	38
CN(C)[C@H](CNC(=O)CC1(O)CCC1)c1cccc(C(F)(F)F)c1	ZINC000450677009	EF	On-Demand	Anodyne	CCR2	48	38
COC[C@@H]1CCCCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450677031	DF	On-Demand	Anodyne	SFRP1	41	32
COC[C@H]1CCCCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450677032	DF	On-Demand	Anodyne	SFRP1	41	32
CCC(CC)Oc1ccc(C(=O)N2CCCC[C@H](COC)C2)cc1	ZINC000450677041	EI	On-Demand	Anodyne	GRM3	16	51
CCC(CC)Oc1ccc(C(=O)N2CCCC[C@H](COC)C2)cc1	ZINC000450677041	EI	On-Demand	Anodyne	L3MBTL3	63	38
CCC(CC)Oc1ccc(C(=O)N2CCCC[C@@H](COC)C2)cc1	ZINC000450677042	EI	On-Demand	Anodyne	GRM3	16	51
CCC(CC)Oc1ccc(C(=O)N2CCCC[C@@H](COC)C2)cc1	ZINC000450677042	EI	On-Demand	Anodyne	L3MBTL3	63	38
COCC[C@H]1CCCCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450677043	FF	On-Demand	Anodyne	THYX_PBCV1	0	40
COCC[C@@H]1CCCCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450677044	FF	On-Demand	Anodyne	THYX_PBCV1	0	40
CS[C@@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450677045	CD	On-Demand	Anodyne	GPR119	21	50
CS[C@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450677046	CD	On-Demand	Anodyne	GPR119	21	50
CC(C)(C)C(=O)Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2nc[nH]n2)cn1	ZINC000450677059	GF	On-Demand	Anodyne	MTTP	41	40
CC(C)(C)C(=O)Nc1ccc(C(=O)N[C@H](c2ccccc2)c2nc[nH]n2)cn1	ZINC000450677060	GF	On-Demand	Anodyne	MTTP	41	40
COCc1ccc([C@@H]2CCCN2C(=O)c2cc(C)n(C(C)C)n2)o1	ZINC000450677067	EG	On-Demand	Anodyne	KCNA5	15	40
Cc1cc(Br)c(O)c(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450677082	FG	On-Demand	Anodyne	HDAC1	25	41
Cc1cc(Br)c(O)c(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450677082	FG	On-Demand	Anodyne	HPGDS	15	42
COCc1ccc([C@H]2CCCN2C(=O)c2cc(C)n(C(C)C)n2)o1	ZINC000450677099	EG	On-Demand	Anodyne	KCNA5	15	40
CC(C)CCCC(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450677100	CF	On-Demand	Anodyne	ACER2	0	42
CC(C)CCCC(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450677101	CF	On-Demand	Anodyne	ACER2	0	42
COC[C@H]1CCCCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450677104	EE	On-Demand	Anodyne	THYX_PBCV1	0	41
COC[C@@H]1CCCCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450677105	EE	On-Demand	Anodyne	THYX_PBCV1	0	41
COCC[C@@H]1CCCCN(C(=O)c2ccc(OC)c(S(C)(=O)=O)c2)C1	ZINC000450677114	FE	On-Demand	Anodyne	L3MBTL3	76	39
COCC[C@H]1CCCCN(C(=O)c2ccc(OC)c(S(C)(=O)=O)c2)C1	ZINC000450677115	FE	On-Demand	Anodyne	L3MBTL3	76	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCc2ccncc21	ZINC000450677139	DH	On-Demand	Anodyne	LIPG	41	31
CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	ZINC000450677154	GC	On-Demand	Anodyne	HRH4	47	37
CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	ZINC000450677154	GC	On-Demand	Anodyne	NPY2R	0	48
CC(C)[C@@H]1CCC[C@@H](NC(=O)c2ccnn2CC(F)(F)F)CC1	ZINC000450677176	EH	On-Demand	Anodyne	MAPK13	49	31
CC(C)[C@@H]1CCC[C@@H](NC(=O)c2ccnn2CC(F)(F)F)CC1	ZINC000450677176	EH	On-Demand	Anodyne	SCARB1	44	34
CC(C)[C@@H]1CCC[C@H](NC(=O)c2ccnn2CC(F)(F)F)CC1	ZINC000450677178	EH	On-Demand	Anodyne	MAPK13	49	31
CC(C)[C@@H]1CCC[C@H](NC(=O)c2ccnn2CC(F)(F)F)CC1	ZINC000450677178	EH	On-Demand	Anodyne	SCARB1	44	34
CC(C)[C@H]1CCC[C@@H](NC(=O)c2ccnn2CC(F)(F)F)CC1	ZINC000450677179	EH	On-Demand	Anodyne	MAPK13	49	31
CC(C)[C@H]1CCC[C@@H](NC(=O)c2ccnn2CC(F)(F)F)CC1	ZINC000450677179	EH	On-Demand	Anodyne	SCARB1	44	34
CC(C)[C@H]1CCC[C@H](NC(=O)c2ccnn2CC(F)(F)F)CC1	ZINC000450677181	EH	On-Demand	Anodyne	MAPK13	49	31
CC(C)[C@H]1CCC[C@H](NC(=O)c2ccnn2CC(F)(F)F)CC1	ZINC000450677181	EH	On-Demand	Anodyne	SCARB1	44	34
CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	ZINC000450677197	GC	On-Demand	Anodyne	HRH4	47	37
CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	ZINC000450677197	GC	On-Demand	Anodyne	NPY2R	0	48
CCOC(=O)c1ccc(CSc2nnc(C[C@H](C)c3ccccc3)o2)nc1	ZINC000450677200	GI	On-Demand	Anodyne	P2RY12	17	41
CC(C)(C)c1cc(CSc2n[nH]c(-c3ccccc3)n2)no1	ZINC000450677204	DI	On-Demand	Anodyne	METAP2	0	43
CCOC(=O)c1ccc(CSc2nnc(C[C@@H](C)c3ccccc3)o2)nc1	ZINC000450677225	GI	On-Demand	Anodyne	P2RY12	17	41
COC[C@@]1(C(=O)OC)CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450677266	GD	On-Demand	Bother	TAAR1	19	43
COC[C@]1(C(=O)OC)CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450677268	GD	On-Demand	Bother	TAAR1	19	43
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677287	GG	On-Demand	Bother	COLA	101	35
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677287	GG	On-Demand	Bother	MTNN	75	36
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677287	GG	On-Demand	Bother	BCL2L1	114	36
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677287	GG	On-Demand	Bother	BCL2	100	36
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677287	GG	On-Demand	Bother	BCL2L2	46	32
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677287	GG	On-Demand	Bother	LIMK2	44	35
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677288	GG	On-Demand	Bother	COLA	101	35
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677288	GG	On-Demand	Bother	MTNN	75	36
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677288	GG	On-Demand	Bother	BCL2L1	114	36
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677288	GG	On-Demand	Bother	BCL2	100	36
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677288	GG	On-Demand	Bother	BCL2L2	46	32
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450677288	GG	On-Demand	Bother	LIMK2	44	35
CC(C)NC(=O)c1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450677290	GG	On-Demand	Bother	TAAR1	22	43
CC(C)NC(=O)c1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450677296	GG	On-Demand	Bother	TAAR1	22	43
CC(C)NC(=O)c1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450677298	GG	On-Demand	Bother	TAAR1	22	43
CC(C)NC(=O)c1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450677300	GG	On-Demand	Bother	TAAR1	22	43
N#CC[C@@H]1CC[C@H](Nc2nc(-c3ccccc3Cl)cs2)C1	ZINC000450677316	DI	On-Demand	Mild	SPHK2	23	42
N#CC[C@@H]1CC[C@H](Nc2nc(-c3ccccc3Cl)cs2)C1	ZINC000450677316	DI	On-Demand	Mild	SPHK1	22	42
Cc1ccc2c(c1)nc(CNC(=O)[C@H]1CCN(c3ccccc3)C1)n2C	ZINC000450677326	EG	On-Demand	Anodyne	HTR7	25	43
Cc1ccc2c(c1)nc(CNC(=O)[C@H]1CCN(c3ccccc3)C1)n2C	ZINC000450677326	EG	On-Demand	Anodyne	EPHX2	25	40
Cc1ccc2c(c1)nc(CNC(=O)[C@@H]1CCN(c3ccccc3)C1)n2C	ZINC000450677332	EG	On-Demand	Anodyne	HTR7	25	43
Cc1ccc2c(c1)nc(CNC(=O)[C@@H]1CCN(c3ccccc3)C1)n2C	ZINC000450677332	EG	On-Demand	Anodyne	EPHX2	25	40
COc1cc(CN[C@H](C(=O)N2CCOCC2)C(C)C)ccc1Cl	ZINC000450677341	EE	On-Demand	Anodyne	CCR1	51	36
COc1cc(CN[C@H](C(=O)N2CCOCC2)C(C)C)ccc1Cl	ZINC000450677341	EE	On-Demand	Anodyne	PDE6A	41	31
COc1cc(CN[C@@H](C(=O)N2CCOCC2)C(C)C)ccc1Cl	ZINC000450677343	EE	On-Demand	Anodyne	CCR1	51	36
COc1cc(CN[C@@H](C(=O)N2CCOCC2)C(C)C)ccc1Cl	ZINC000450677343	EE	On-Demand	Anodyne	PDE6A	41	31
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@]2(CCOC2)C1	ZINC000450677350	FF	On-Demand	Anodyne	PRCP	47	35
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@]2(CCOC2)C1	ZINC000450677351	FF	On-Demand	Anodyne	PRCP	47	35
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@]2(CCOC2)C1	ZINC000450677353	FF	On-Demand	Anodyne	PRCP	47	35
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@]2(CCOC2)C1	ZINC000450677354	FF	On-Demand	Anodyne	PRCP	47	35
O=C(N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450677363	FH	On-Demand	Anodyne	SSTR5	29	40
O=C(N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450677363	FH	On-Demand	Anodyne	HPGDS	33	52
O=C(N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450677366	FH	On-Demand	Anodyne	SSTR5	29	40
O=C(N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450677366	FH	On-Demand	Anodyne	HPGDS	33	52
CCN(CCO)CCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450677370	DC	On-Demand	Anodyne	EPHX2	17	40
N#CC1(NC(=O)CCc2ccc(C(N)=O)cc2)CCN(Cc2ccccc2)CC1	ZINC000450677382	GE	On-Demand	Mild	SIGMAR1	45	43
N#CC1(NC(=O)CCc2ccc(C(N)=O)cc2)CCN(Cc2ccccc2)CC1	ZINC000450677382	GE	On-Demand	Mild	NPFFR2	50	48
N#CC1(NC(=O)CCc2ccc(C(N)=O)cc2)CCN(Cc2ccccc2)CC1	ZINC000450677382	GE	On-Demand	Mild	NPFFR1	74	48
CCN(CCO)CCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450677389	DC	On-Demand	Anodyne	EPHX2	17	40
CCOc1cc2nccc(N3CC[C@](COC)(C(=O)OC)C3)c2cc1OCC	ZINC000450677393	GG	On-Demand	Anodyne	PDGFRB	42	39
CCOc1cc2nccc(N3CC[C@@](COC)(C(=O)OC)C3)c2cc1OCC	ZINC000450677395	GG	On-Demand	Anodyne	PDGFRB	42	39
COC[C@]1(C(=O)OC)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450677414	ED	On-Demand	Anodyne	SLC6A9	29	44
COC[C@]1(C(=O)OC)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450677414	ED	On-Demand	Anodyne	GPR119	32	41
COC[C@@]1(C(=O)OC)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450677416	ED	On-Demand	Anodyne	SLC6A9	29	44
COC[C@@]1(C(=O)OC)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450677416	ED	On-Demand	Anodyne	GPR119	32	41
Cc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)nn1C(C)C	ZINC000450677417	FG	On-Demand	Mild	TSPO	0	41
Cc1cc(C(=O)NC2(C#N)CCN(Cc3ccccc3)CC2)nn1C(C)C	ZINC000450677417	FG	On-Demand	Mild	NPFFR1	52	37
COCCOC[C@H](O)CN[C@H](C)c1cccc(F)c1F	ZINC000450677425	CD	On-Demand	Anodyne	ADRB2	16	41
COCCOC[C@@H](O)CN[C@H](C)c1cccc(F)c1F	ZINC000450677427	CD	On-Demand	Anodyne	ADRB2	16	41
COCCOC[C@@H](O)CN[C@@H](C)c1cccc(F)c1F	ZINC000450677429	CD	On-Demand	Anodyne	ADRB2	16	41
COCCOC[C@H](O)CN[C@@H](C)c1cccc(F)c1F	ZINC000450677431	CD	On-Demand	Anodyne	ADRB2	16	41
COCC[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)c1ccc(C)o1	ZINC000450677448	CH	On-Demand	Anodyne	NPPA	43	33
COCC[C@H](NC(=O)[C@@]1(C)CCC[C@H]1C)c1ccc(C)o1	ZINC000450677450	CH	On-Demand	Anodyne	NPPA	43	33
COCC[C@H](NC(=O)[C@@]1(C)CCC[C@@H]1C)c1ccc(C)o1	ZINC000450677453	CH	On-Demand	Anodyne	NPPA	43	33
COCC[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)c1ccc(C)o1	ZINC000450677454	CH	On-Demand	Anodyne	NPPA	43	33
CCC[C@H](OC)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450677461	EE	On-Demand	Mild	SIGMAR1	53	37
CCC[C@H](OC)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450677461	EE	On-Demand	Mild	NPFFR2	40	40
CCC[C@H](OC)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450677461	EE	On-Demand	Mild	NPFFR1	63	41
CCC[C@@H](OC)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450677464	EE	On-Demand	Mild	SIGMAR1	53	37
CCC[C@@H](OC)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450677464	EE	On-Demand	Mild	NPFFR2	40	40
CCC[C@@H](OC)C(=O)NC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000450677464	EE	On-Demand	Mild	NPFFR1	63	41
Cc1ccccc1CNc1ccccc1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450677469	EI	On-Demand	Anodyne	CCR8	53	33
Cc1ccc2c(c1)nc(CNC(=O)CCCC(=O)C1CC1)n2C	ZINC000450677488	DF	On-Demand	Anodyne	HTR7	26	42
C[C@@H]1CCC(=O)[C@H](Sc2nc(-c3ccc(Cl)cc3)n[nH]2)C1	ZINC000450677495	DH	On-Demand	Anodyne	GCN5	0	51
C[C@@H]1CCC(=O)[C@@H](Sc2nc(-c3ccc(Cl)cc3)n[nH]2)C1	ZINC000450677497	DH	On-Demand	Anodyne	GCN5	0	51
C[C@H]1CCC(=O)[C@H](Sc2nc(-c3ccc(Cl)cc3)n[nH]2)C1	ZINC000450677498	DH	On-Demand	Anodyne	GCN5	0	51
C[C@H](c1ccccc1)[C@H](O)CN[C@H](CS(C)(=O)=O)c1ccccc1	ZINC000450677499	EF	On-Demand	Anodyne	ADRB3	19	40
C[C@H]1CCC(=O)[C@@H](Sc2nc(-c3ccc(Cl)cc3)n[nH]2)C1	ZINC000450677501	DH	On-Demand	Anodyne	GCN5	0	51
C[C@H](c1ccccc1)[C@H](O)CN[C@@H](CS(C)(=O)=O)c1ccccc1	ZINC000450677502	EF	On-Demand	Anodyne	ADRB3	19	40
C[C@H](c1ccccc1)[C@@H](O)CN[C@H](CS(C)(=O)=O)c1ccccc1	ZINC000450677504	EF	On-Demand	Anodyne	ADRB3	19	40
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H](CS(C)(=O)=O)c1ccccc1	ZINC000450677505	EF	On-Demand	Anodyne	ADRB3	19	40
Fc1ccccc1OC[C@@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450677512	EI	On-Demand	Anodyne	MAN1B1	53	48
Fc1ccccc1OC[C@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450677514	EI	On-Demand	Anodyne	MAN1B1	53	48
Fc1ccccc1OC[C@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450677515	EI	On-Demand	Anodyne	MAN1B1	53	48
Fc1ccccc1OC[C@@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450677516	EI	On-Demand	Anodyne	MAN1B1	53	48
CCCOc1ccc(C(=O)N2CC[C@@H](NC(=O)NC)C2)c(OC)c1	ZINC000450677538	ED	On-Demand	Anodyne	OXTR	27	45
CCCOc1ccc(C(=O)N2CC[C@H](NC(=O)NC)C2)c(OC)c1	ZINC000450677539	ED	On-Demand	Anodyne	OXTR	27	45
CCOCCOC1CN(C(=O)c2c(C)cccc2Cl)C1	ZINC000450677545	CF	On-Demand	Anodyne	CCR5	40	38
CNC(=O)N[C@H]1CCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450677546	DC	On-Demand	Anodyne	ACE	48	36
CNC(=O)N[C@H]1CCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450677546	DC	On-Demand	Anodyne	BIRC2	52	45
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450677547	DC	On-Demand	Anodyne	ACE	48	36
CNC(=O)N[C@@H]1CCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450677547	DC	On-Demand	Anodyne	BIRC2	52	45
CNC(=O)N[C@H]1CCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450677548	DC	On-Demand	Anodyne	ACE	48	36
CNC(=O)N[C@H]1CCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450677548	DC	On-Demand	Anodyne	BIRC2	52	45
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450677549	DC	On-Demand	Anodyne	ACE	48	36
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450677549	DC	On-Demand	Anodyne	BIRC2	52	45
CC[C@@H](CNS(C)(=O)=O)N=c1cc[nH]c(C(=O)NCc2ccccc2)c1	ZINC000450677553	GD	On-Demand	Anodyne	PDS	44	34
CC[C@H](CNS(C)(=O)=O)N=c1cc[nH]c(C(=O)NCc2ccccc2)c1	ZINC000450677554	GD	On-Demand	Anodyne	PDS	44	34
CCOc1cccc([C@@H](C)NCCC(C)(F)F)c1	ZINC000450677560	CH	On-Demand	Anodyne	CASR	15	41
CCOc1cccc([C@@H](C)NCCC(C)(F)F)c1	ZINC000450677560	CH	On-Demand	Anodyne	PDS	55	38
CCOc1cccc([C@H](C)NCCC(C)(F)F)c1	ZINC000450677561	CH	On-Demand	Anodyne	CASR	15	41
CCOc1cccc([C@H](C)NCCC(C)(F)F)c1	ZINC000450677561	CH	On-Demand	Anodyne	PDS	55	38
CNC(=O)N[C@@H]1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450677590	GD	On-Demand	Anodyne	TRPC6	88	48
CNC(=O)N[C@@H]1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450677590	GD	On-Demand	Anodyne	TRPC3	65	48
CNC(=O)N[C@H]1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450677591	GD	On-Demand	Anodyne	TRPC6	88	48
CNC(=O)N[C@H]1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450677591	GD	On-Demand	Anodyne	TRPC3	65	48
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(Br)cc1	ZINC000450677597	DE	On-Demand	Anodyne	SDH1	0	43
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(Br)cc1	ZINC000450677598	DE	On-Demand	Anodyne	SDH1	0	43
COc1ccnc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)n1	ZINC000450677599	CE	On-Demand	Bother	CACNA1D	50	34
COc1ccnc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)n1	ZINC000450677600	CE	On-Demand	Bother	CACNA1D	50	34
CCOCc1nc(C)c(C(=O)NCc2ncc(-c3cccs3)[nH]2)s1	ZINC000450677647	FG	On-Demand	Anodyne	GPR142	54	41
C/C=C\COc1cccc(CC(=O)N[C@@H](CC)c2ncc[nH]2)c1	ZINC000450677656	DG	On-Demand	Anodyne	PDS	56	33
C/C=C/COc1cccc(CC(=O)N[C@H](CC)c2ncc[nH]2)c1	ZINC000450677657	DG	On-Demand	Anodyne	PDS	56	33
C/C=C\COc1cccc(CC(=O)N[C@H](CC)c2ncc[nH]2)c1	ZINC000450677658	DG	On-Demand	Anodyne	PDS	56	33
C/C=C/COc1cccc(CC(=O)N[C@@H](CC)c2ncc[nH]2)c1	ZINC000450677659	DG	On-Demand	Anodyne	PDS	56	33
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677662	GI	On-Demand	Anodyne	ADRB3	15	40
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677662	GI	On-Demand	Anodyne	PRNP	61	34
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677662	GI	On-Demand	Anodyne	F7	15	40
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677662	GI	On-Demand	Anodyne	GPR142	54	35
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677662	GI	On-Demand	Anodyne	KCNK3	52	43
CO[C@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677663	GI	On-Demand	Anodyne	ADRB3	15	40
CO[C@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677663	GI	On-Demand	Anodyne	PRNP	61	34
CO[C@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677663	GI	On-Demand	Anodyne	F7	15	40
CO[C@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677663	GI	On-Demand	Anodyne	GPR142	54	35
CO[C@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677663	GI	On-Demand	Anodyne	KCNK3	52	43
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677664	GI	On-Demand	Anodyne	ADRB3	15	40
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677664	GI	On-Demand	Anodyne	PRNP	61	34
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677664	GI	On-Demand	Anodyne	F7	15	40
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677664	GI	On-Demand	Anodyne	GPR142	54	35
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677664	GI	On-Demand	Anodyne	KCNK3	52	43
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677665	GI	On-Demand	Anodyne	ADRB3	15	40
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677665	GI	On-Demand	Anodyne	PRNP	61	34
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677665	GI	On-Demand	Anodyne	F7	15	40
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677665	GI	On-Demand	Anodyne	GPR142	54	35
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)Cc1ccccc1	ZINC000450677665	GI	On-Demand	Anodyne	KCNK3	52	43
COCCOC[C@@H](O)CN[C@H](c1ccccc1Cl)C(C)C	ZINC000450677688	DF	On-Demand	Anodyne	ADRB2	30	44
COCCOC[C@H](O)CN[C@H](c1ccccc1Cl)C(C)C	ZINC000450677689	DF	On-Demand	Anodyne	ADRB2	30	44
COCCOC[C@H](O)CN[C@@H](c1ccccc1Cl)C(C)C	ZINC000450677690	DF	On-Demand	Anodyne	ADRB2	30	44
COCCOC[C@@H](O)CN[C@@H](c1ccccc1Cl)C(C)C	ZINC000450677691	DF	On-Demand	Anodyne	ADRB2	30	44
C[C@@H](NCc1nnc(C2CC2)s1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450677701	GH	On-Demand	Anodyne	DGAT1	15	42
C[C@H](NCc1nnc(C2CC2)s1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450677704	GH	On-Demand	Anodyne	DGAT1	15	42
FC1(F)CC(CSc2nnc(-c3ccccc3Br)o2)C1	ZINC000450677711	FJ	On-Demand	Anodyne	CYP73A16	20	43
CCc1nc(C)c(CSc2nnc(-c3ccccc3Br)o2)o1	ZINC000450677734	GJ	On-Demand	Anodyne	ALOX15	40	33
CCn1cc(C(=O)NC2(CCO)CCN(C)CC2)c2ccccc21	ZINC000450677751	EE	On-Demand	Anodyne	CNR1	38	46
CCn1cc(C(=O)NC2(CCO)CCN(C)CC2)c2ccccc21	ZINC000450677751	EE	On-Demand	Anodyne	CNR2	35	44
CCOc1nc2ccc(C(=O)N3CCCC[C@@H](COC)C3)cc2[nH]1	ZINC000450677756	EF	On-Demand	Anodyne	HPGD	45	36
CCOc1nc2ccc(C(=O)N3CCCC[C@H](COC)C3)cc2[nH]1	ZINC000450677758	EF	On-Demand	Anodyne	HPGD	45	36
COC[C@H]1CCCCN(C(=O)c2cccc3c2CCCC3)C1	ZINC000450677775	DG	On-Demand	Anodyne	FABP4	43	34
COC[C@@H]1CCCCN(C(=O)c2cccc3c2CCCC3)C1	ZINC000450677776	DG	On-Demand	Anodyne	FABP4	43	34
COCC[C@@H]1CCCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450677777	FI	On-Demand	Anodyne	HRH3	18	40
COCC[C@H]1CCCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450677779	FI	On-Demand	Anodyne	HRH3	18	40
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677796	EG	On-Demand	Anodyne	OPRM1	23	41
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677796	EG	On-Demand	Anodyne	CTRA_BOVIN	53	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677796	EG	On-Demand	Anodyne	DEF	0	40
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677796	EG	On-Demand	Anodyne	CTSG	42	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677796	EG	On-Demand	Anodyne	COLA	76	35
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677796	EG	On-Demand	Anodyne	CPT1A	66	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677796	EG	On-Demand	Anodyne	PREP	48	38
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677796	EG	On-Demand	Anodyne	CELA2A	51	33
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677798	EG	On-Demand	Anodyne	OPRM1	23	41
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677798	EG	On-Demand	Anodyne	CTRA_BOVIN	53	33
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677798	EG	On-Demand	Anodyne	DEF	0	40
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677798	EG	On-Demand	Anodyne	CTSG	42	33
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677798	EG	On-Demand	Anodyne	COLA	76	35
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677798	EG	On-Demand	Anodyne	CPT1A	66	33
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677798	EG	On-Demand	Anodyne	PREP	48	38
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677798	EG	On-Demand	Anodyne	CELA2A	51	33
COCc1ccc([C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677801	EG	On-Demand	Anodyne	OPRM1	23	41
COCc1ccc([C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677801	EG	On-Demand	Anodyne	CTRA_BOVIN	53	33
COCc1ccc([C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677801	EG	On-Demand	Anodyne	DEF	0	40
COCc1ccc([C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677801	EG	On-Demand	Anodyne	CTSG	42	33
COCc1ccc([C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677801	EG	On-Demand	Anodyne	COLA	76	35
COCc1ccc([C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677801	EG	On-Demand	Anodyne	CPT1A	66	33
COCc1ccc([C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677801	EG	On-Demand	Anodyne	PREP	48	38
COCc1ccc([C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450677801	EG	On-Demand	Anodyne	CELA2A	51	33
COc1ccccc1-c1nnc(SCCC(C)(F)F)o1	ZINC000450677802	DH	On-Demand	Anodyne	ALOX15	63	38
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677803	EG	On-Demand	Anodyne	OPRM1	23	41
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677803	EG	On-Demand	Anodyne	CTRA_BOVIN	53	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677803	EG	On-Demand	Anodyne	DEF	0	40
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677803	EG	On-Demand	Anodyne	CTSG	42	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677803	EG	On-Demand	Anodyne	COLA	76	35
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677803	EG	On-Demand	Anodyne	CPT1A	66	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677803	EG	On-Demand	Anodyne	PREP	48	38
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450677803	EG	On-Demand	Anodyne	CELA2A	51	33
COc1cc(C(C)=O)ccc1OCCC(C)(F)F	ZINC000450677807	CG	On-Demand	Anodyne	THRA	15	42
COc1cc(C(C)=O)ccc1OCCC(C)(F)F	ZINC000450677807	CG	On-Demand	Anodyne	GRM3	16	44
COCC[C@@H]1CCCCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450677818	FG	On-Demand	Anodyne	GCK	34	45
COCC[C@H]1CCCCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450677820	FG	On-Demand	Anodyne	GCK	34	45
COc1cc(CNC2(c3ccc4c(c3)OCO4)CC2)ccc1Cl	ZINC000450677823	EH	On-Demand	Anodyne	Q9XSW7_PIG	0	44
CC(=O)c1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450677839	EH	On-Demand	Bother	CASP3	55	40
CC(=O)c1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450677839	EH	On-Demand	Bother	CHRNA10	77	45
CC(=O)c1cc(N2CCC[C@H]2COc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450677839	EH	On-Demand	Bother	CASP7	50	41
CS[C@@H]1CCN(c2ccnc(N3CCCCC3)n2)C1	ZINC000450677849	CE	On-Demand	Anodyne	SORD	42	38
CS[C@H]1CCN(c2ccnc(N3CCCCC3)n2)C1	ZINC000450677851	CE	On-Demand	Anodyne	SORD	42	38
CC(=O)CCCCCSc1nnc(-c2ccc(OC(F)F)cc2)o1	ZINC000450677873	FJ	On-Demand	Anodyne	ALOX15	30	42
C[C@]1(C(=O)NCc2ccccc2N2CCCCC2)CC=CCC1	ZINC000450677907	DI	On-Demand	Anodyne	KCNQ2	81	40
C[C@]1(C(=O)NCc2ccccc2N2CCCCC2)CC=CCC1	ZINC000450677907	DI	On-Demand	Anodyne	SCN2A	18	42
O=C(N[C@H](CO)c1ccccc1)c1c(F)ccc(SCC2CC2)c1F	ZINC000450677909	FH	On-Demand	Anodyne	TACR3	45	35
C[C@@]1(C(=O)NCc2ccccc2N2CCCCC2)CC=CCC1	ZINC000450677913	DI	On-Demand	Anodyne	KCNQ2	81	40
C[C@@]1(C(=O)NCc2ccccc2N2CCCCC2)CC=CCC1	ZINC000450677913	DI	On-Demand	Anodyne	SCN2A	18	42
CCc1nc(C)c(COc2cccnc2[N+](=O)[O-])o1	ZINC000450677925	CE	On-Demand	Bother	S1PR4	0	42
COC[C@@]1(C(=O)OC)CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450677929	FD	On-Demand	Anodyne	CREBBP	44	34
COC[C@@]1(C(=O)OC)CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450677929	FD	On-Demand	Anodyne	BRD9	55	34
COC[C@]1(C(=O)OC)CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450677931	FD	On-Demand	Anodyne	CREBBP	44	34
COC[C@]1(C(=O)OC)CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450677931	FD	On-Demand	Anodyne	BRD9	55	34
N#CC1(CN[C@@H](COCc2ccccc2)c2ccccc2)CCC1	ZINC000450677940	DI	On-Demand	Mild	MAN1B1	42	46
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450677942	EE	On-Demand	Anodyne	EPHX2	32	42
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450677944	EE	On-Demand	Anodyne	EPHX2	32	42
CC(C)c1nnc(CN[C@@H](COc2ccccc2F)c2ccccc2)s1	ZINC000450677946	FJ	On-Demand	Anodyne	MAN1B1	17	40
N#CC1(CN[C@H](COCc2ccccc2)c2ccccc2)CCC1	ZINC000450677947	DI	On-Demand	Mild	MAN1B1	42	46
CN(C)[C@@H](CNC(=O)c1cnc(C2CC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000450677949	GG	On-Demand	Anodyne	CCR2	83	43
CN(C)[C@H](CNC(=O)c1cnc(C2CC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000450677953	GG	On-Demand	Anodyne	CCR2	83	43
CC(C)c1nnc(CN[C@H](COc2ccccc2F)c2ccccc2)s1	ZINC000450677954	FJ	On-Demand	Anodyne	MAN1B1	17	40
CN(C)[C@H](CNC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000450677970	FH	On-Demand	Anodyne	CCR2	45	35
CN(C)[C@H](CNC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000450677970	FH	On-Demand	Anodyne	PDS	40	32
CN(C)[C@@H](CNC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000450677984	FH	On-Demand	Anodyne	CCR2	45	35
CN(C)[C@@H](CNC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000450677984	FH	On-Demand	Anodyne	PDS	40	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450677999	EE	On-Demand	Anodyne	VM1B1_BOTAS	0	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)c1ccccc1	ZINC000450677999	EE	On-Demand	Anodyne	GPR88	0	53
CC(=O)CCCCCOc1ccc(-c2nnco2)cc1	ZINC000450678003	CG	On-Demand	Anodyne	ALDH2	44	37
CC(=O)CCCCCOc1ccc(-c2nnco2)cc1	ZINC000450678003	CG	On-Demand	Anodyne	PLA2G4B	51	34
CC[C@H](CNS(C)(=O)=O)Nc1nc(N(C)C)c2ccccc2n1	ZINC000450678026	EC	On-Demand	Anodyne	ADRA2A	16	57
CC[C@@H](CNS(C)(=O)=O)Nc1nc(N(C)C)c2ccccc2n1	ZINC000450678027	EC	On-Demand	Anodyne	ADRA2A	16	57
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2nccnc2n1	ZINC000450678037	FF	On-Demand	Anodyne	CCR1	43	38
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2nccnc2n1	ZINC000450678037	FF	On-Demand	Anodyne	POL	0	45
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2nccnc2n1	ZINC000450678038	FF	On-Demand	Anodyne	CCR1	43	38
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc2nccnc2n1	ZINC000450678038	FF	On-Demand	Anodyne	POL	0	45
O=C(CC[C@@H]1CCCCO1)CSc1n[nH]c(-c2ccccc2)n1	ZINC000450678039	EG	On-Demand	Anodyne	COLA	46	35
CCN(C)C(=O)[C@@H](Nc1nccc(OCc2ccccc2)n1)C(C)C	ZINC000450678045	EF	On-Demand	Anodyne	PAPA1_CARPA	48	31
CCN(C)C(=O)[C@@H](Nc1nccc(OCc2ccccc2)n1)C(C)C	ZINC000450678045	EF	On-Demand	Anodyne	ADAMTS4	42	39
O=C(CC[C@H]1CCCCO1)CSc1n[nH]c(-c2ccccc2)n1	ZINC000450678051	EG	On-Demand	Anodyne	COLA	46	35
O=C(N1CCC(=Cc2ccc(F)c(F)c2)CC1)C1(C(F)(F)F)CCC1	ZINC000450678053	FJ	On-Demand	Anodyne	SRD5A2	0	45
CCN(C)C(=O)[C@@H](Nc1cc(C)ccc1[N+](=O)[O-])C(C)C	ZINC000450678055	CF	On-Demand	Bother	COLA	55	36
CC1CCN(C(=O)c2ccc(N3C[C@H]4[C@H]5C=C[C@@H](CC5)[C@H]4C3)nc2)CC1	ZINC000450678074	FH	On-Demand	Anodyne	L3MBTL3	52	37
CC1CCN(C(=O)c2ccc(N3C[C@@H]4[C@H]5C=C[C@@H](CC5)[C@H]4C3)nc2)CC1	ZINC000450678077	FH	On-Demand	Anodyne	L3MBTL3	52	37
CC1CCN(C(=O)c2ccc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4CC3)nc2)CC1	ZINC000450678078	FH	On-Demand	Anodyne	L3MBTL3	52	37
CC(=O)N[C@H](C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C)C(C)(C)C	ZINC000450678091	GF	On-Demand	Anodyne	PHES	0	40
CC(=O)N[C@H](C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C)C(C)(C)C	ZINC000450678092	GF	On-Demand	Anodyne	PHES	0	40
COCC1(O)CN(c2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])C1	ZINC000450678108	GD	On-Demand	Bother	CASP7	46	37
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450678110	GD	On-Demand	Mild	AR	16	44
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450678111	GD	On-Demand	Mild	AR	16	44
CNC(=O)N[C@@H]1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450678112	GD	On-Demand	Mild	AR	16	44
CNC(=O)N[C@H]1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450678113	GD	On-Demand	Mild	AR	16	44
CCc1cc2c(N3CC[C@H](SC)C3)ncnc2s1	ZINC000450678122	CG	On-Demand	Anodyne	PDE3A	40	33
CCc1cc2c(N3CC[C@H](SC)C3)ncnc2s1	ZINC000450678122	CG	On-Demand	Anodyne	PDE3B	60	33
CCc1cc2c(N3CC[C@@H](SC)C3)ncnc2s1	ZINC000450678123	CG	On-Demand	Anodyne	PDE3A	40	33
CCc1cc2c(N3CC[C@@H](SC)C3)ncnc2s1	ZINC000450678123	CG	On-Demand	Anodyne	PDE3B	60	33
N#Cc1cccc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450678143	DH	On-Demand	Mild	CHRNA10	84	46
CC(=O)c1cccc(CSc2nnc(C[C@H](C)c3ccccc3)o2)c1	ZINC000450678147	FJ	On-Demand	Anodyne	GSK3A	29	41
CC(=O)c1cccc(CSc2nnc(C[C@@H](C)c3ccccc3)o2)c1	ZINC000450678148	FJ	On-Demand	Anodyne	GSK3A	29	41
CC(C)N1CCCC[C@H]1CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450678158	GI	On-Demand	Anodyne	PRNP	53	39
CC(C)N1CCCC[C@H]1CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450678159	GI	On-Demand	Anodyne	PRNP	53	39
CC(C)N1CCCC[C@@H]1CN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450678160	GI	On-Demand	Anodyne	PRNP	53	39
CC(C)N1CCCC[C@@H]1CN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000450678161	GI	On-Demand	Anodyne	PRNP	53	39
COC[C@H]1CCCCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450678164	FH	On-Demand	Anodyne	CCR8	28	41
COC[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450678165	FH	On-Demand	Anodyne	CCR8	28	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H](COC)C2)[nH]c1C	ZINC000450678174	DE	On-Demand	Anodyne	AKR1C3	24	42
CCOC(=O)c1cc(C(=O)N2CCCC[C@H](COC)C2)[nH]c1C	ZINC000450678175	DE	On-Demand	Anodyne	AKR1C3	24	42
COC[C@](C)(CCO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450678176	FE	On-Demand	Anodyne	MTNR1A	17	40
COC[C@](C)(CCO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450678176	FE	On-Demand	Anodyne	MTNR1B	19	42
COC[C@@](C)(CCO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450678177	FE	On-Demand	Anodyne	MTNR1A	17	40
COC[C@@](C)(CCO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450678177	FE	On-Demand	Anodyne	MTNR1B	19	42
CCc1cccc(C(=O)N2CCC[C@H]2c2ccc(COC)o2)n1	ZINC000450678178	DG	On-Demand	Anodyne	CPT1A	77	35
CCc1cccc(C(=O)N2CCC[C@@H]2c2ccc(COC)o2)n1	ZINC000450678179	DG	On-Demand	Anodyne	CPT1A	77	35
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	MME	35	40
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	CAPNS1	46	30
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	MMP2	23	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	MMP3	25	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	MMP8	41	38
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	MMP14	0	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	CAPN1	49	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	MMP9	19	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	CAPN2	52	36
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	MMP7	45	38
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	MMP1	33	40
CC(C)CC(CC(C)C)C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450678196	EH	On-Demand	Anodyne	NPR	51	37
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	MME	35	40
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	CAPNS1	46	30
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	MMP2	23	42
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	MMP3	25	42
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	MMP8	41	38
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	MMP14	0	42
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	CAPN1	49	42
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	MMP9	19	42
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	CAPN2	52	36
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	MMP7	45	38
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	MMP1	33	40
CC(C)CC(CC(C)C)C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450678197	EH	On-Demand	Anodyne	NPR	51	37
CCc1cccc(C(=O)N[C@@](C)(CCO)COC)n1	ZINC000450678198	CD	On-Demand	Anodyne	PDE5A	19	41
CCc1cccc(C(=O)N[C@](C)(CCO)COC)n1	ZINC000450678199	CD	On-Demand	Anodyne	PDE5A	0	41
COCC[C@@H]1CCCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450678201	FG	On-Demand	Anodyne	PDEC	0	42
COCC[C@H]1CCCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450678202	FG	On-Demand	Anodyne	PDEC	0	42
COCC[C@H]1CCCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450678203	FG	On-Demand	Anodyne	PDEC	0	42
COCC[C@@H]1CCCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450678204	FG	On-Demand	Anodyne	PDEC	0	42
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)o1	ZINC000450678205	EI	On-Demand	Anodyne	CPT1A	83	35
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)o1	ZINC000450678205	EI	On-Demand	Anodyne	PREP	58	37
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)o1	ZINC000450678206	EI	On-Demand	Anodyne	CPT1A	83	35
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)o1	ZINC000450678206	EI	On-Demand	Anodyne	PREP	58	37
COC[C@@H]1CCCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450678207	CE	On-Demand	Anodyne	PREP	25	41
COC[C@H]1CCCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450678208	CE	On-Demand	Anodyne	PREP	25	41
COC[C@H]1CCCCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450678209	EF	On-Demand	Anodyne	GCK	31	43
COC[C@@H]1CCCCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450678210	EF	On-Demand	Anodyne	GCK	31	43
CC(C)(C)c1cc(CSc2n[nH]c(-c3ccccc3Br)n2)no1	ZINC000450678217	GJ	On-Demand	Anodyne	METAP2	17	40
CCc1cc(NC(=O)[C@@H](O)C2CCC2)ccc1C	ZINC000450678223	BF	On-Demand	Anodyne	POLC	79	38
CCc1cc(NC(=O)[C@H](O)C2CCC2)ccc1C	ZINC000450678224	BF	On-Demand	Anodyne	POLC	79	38
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1ccnc2ccccc12	ZINC000450678227	CH	On-Demand	Anodyne	HNMT	47	34
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1ccnc2ccccc12	ZINC000450678228	CH	On-Demand	Anodyne	HNMT	47	34
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1ccnc2ccccc12	ZINC000450678229	CH	On-Demand	Anodyne	HNMT	47	34
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1ccnc2ccccc12	ZINC000450678230	CH	On-Demand	Anodyne	HNMT	47	34
CC(=O)N[C@H](C(=O)N[C@H](CO)c1ccccc1)C(C)(C)C	ZINC000450678263	CD	On-Demand	Anodyne	Q82323_9DELA	40	29
CC(=O)N[C@H](C(=O)N[C@H](CO)c1ccccc1)C(C)(C)C	ZINC000450678263	CD	On-Demand	Anodyne	DERP1	0	40
CC(=O)N[C@H](C(=O)N[C@H](CO)c1ccccc1)C(C)(C)C	ZINC000450678263	CD	On-Demand	Anodyne	GPR88	0	50
CCN(C)C(=O)[C@@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)C(C)C	ZINC000450678265	GG	On-Demand	Anodyne	AVPR2	79	41
CCN(C)C(=O)[C@@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)C(C)C	ZINC000450678265	GG	On-Demand	Anodyne	AVPR1A	45	41
CCN(C)C(=O)[C@@H](Nc1ccc([N+](=O)[O-])c(C)c1)C(C)C	ZINC000450678296	CF	On-Demand	Bother	COLA	44	33
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450678312	ED	On-Demand	Anodyne	MTNR1A	26	42
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450678312	ED	On-Demand	Anodyne	MTNR1B	0	42
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450678312	ED	On-Demand	Anodyne	EPHX2	25	42
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450678312	ED	On-Demand	Anodyne	L3MBTL3	43	34
CNC(=O)N[C@H]1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450678316	ED	On-Demand	Anodyne	MTNR1A	26	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450678316	ED	On-Demand	Anodyne	MTNR1B	0	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450678316	ED	On-Demand	Anodyne	EPHX2	25	42
CNC(=O)N[C@H]1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450678316	ED	On-Demand	Anodyne	L3MBTL3	43	34
Fc1ccc([C@H](Nc2ncccn2)C2CC2)cc1Cl	ZINC000450678344	CH	On-Demand	Anodyne	MAPK1	47	39
Fc1ccc([C@@H](Nc2ncccn2)C2CC2)cc1Cl	ZINC000450678345	CH	On-Demand	Anodyne	MAPK1	46	34
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)c(Cl)c2)c(OC)c1	ZINC000450678381	GH	On-Demand	Anodyne	MTNR1A	44	36
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)c(Cl)c2)c(OC)c1	ZINC000450678383	GH	On-Demand	Anodyne	MTNR1A	44	36
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450678384	GF	On-Demand	Anodyne	PAM	0	42
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450678384	GF	On-Demand	Anodyne	CASP1	15	41
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450678384	GF	On-Demand	Anodyne	CAPN2	0	41
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450678387	GF	On-Demand	Anodyne	PAM	0	42
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450678387	GF	On-Demand	Anodyne	CASP1	15	41
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450678387	GF	On-Demand	Anodyne	CAPN2	0	41
CC[C@@H](CNS(C)(=O)=O)Nc1cncc(SCc2ccccc2)n1	ZINC000450678388	FF	On-Demand	Anodyne	CXCR2	0	49
CC[C@H](CNS(C)(=O)=O)Nc1cncc(SCc2ccccc2)n1	ZINC000450678391	FF	On-Demand	Anodyne	CXCR2	0	49
Cc1cccc(C)c1OC[C@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450678398	EG	On-Demand	Anodyne	MAN1B1	49	34
CNC(=O)C1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450678430	FD	On-Demand	Anodyne	HRH4	29	48
CC[S@](=O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450678462	EH	On-Demand	Anodyne	TACR1	16	42
CC[S@](=O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450678462	EH	On-Demand	Anodyne	COLA	61	42
CC[S@](=O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450678462	EH	On-Demand	Anodyne	CPT1A	59	42
CC[S@@](=O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450678464	EH	On-Demand	Anodyne	TACR1	16	42
CC[S@@](=O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450678464	EH	On-Demand	Anodyne	COLA	61	42
CC[S@@](=O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450678464	EH	On-Demand	Anodyne	CPT1A	59	42
CC[S@](=O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450678466	EH	On-Demand	Anodyne	TACR1	16	42
CC[S@](=O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450678466	EH	On-Demand	Anodyne	COLA	61	42
CC[S@](=O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450678466	EH	On-Demand	Anodyne	CPT1A	59	42
CC[S@@](=O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450678468	EH	On-Demand	Anodyne	TACR1	16	42
CC[S@@](=O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450678468	EH	On-Demand	Anodyne	COLA	61	42
CC[S@@](=O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450678468	EH	On-Demand	Anodyne	CPT1A	59	42
O=C(C1CC1)C1(C(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000450678507	EH	On-Demand	Anodyne	SRD5A2	0	47
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CCc2ccncc21	ZINC000450678523	EH	On-Demand	Anodyne	TRPM8	40	45
COC[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450678524	GF	On-Demand	Mild	HTR1B	17	41
COC[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450678524	GF	On-Demand	Mild	COLA	100	43
COC[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450678524	GF	On-Demand	Mild	CPT1A	92	43
COC[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450678524	GF	On-Demand	Mild	CPT2	44	40
COC[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450678525	GF	On-Demand	Mild	HTR1B	17	41
COC[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450678525	GF	On-Demand	Mild	COLA	100	43
COC[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450678525	GF	On-Demand	Mild	CPT1A	92	43
COC[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450678525	GF	On-Demand	Mild	CPT2	44	40
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2Cc3c(C)cccc3O2)o1	ZINC000450678528	EG	On-Demand	Anodyne	COLA	42	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2Cc3c(C)cccc3O2)o1	ZINC000450678529	EG	On-Demand	Anodyne	COLA	42	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2Cc3c(C)cccc3O2)o1	ZINC000450678530	EG	On-Demand	Anodyne	COLA	42	33
COCc1ccc([C@H]2CCCN2C(=O)[C@H]2Cc3c(C)cccc3O2)o1	ZINC000450678531	EG	On-Demand	Anodyne	COLA	42	33
COC[C@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678532	GH	On-Demand	Anodyne	HTR1A	41	43
COC[C@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678532	GH	On-Demand	Anodyne	DRD2	26	43
COC[C@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678532	GH	On-Demand	Anodyne	PDGFRB	18	40
COC[C@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678532	GH	On-Demand	Anodyne	PLK1	25	40
COC[C@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678532	GH	On-Demand	Anodyne	HPGD	67	75
COC[C@@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678533	GH	On-Demand	Anodyne	HTR1A	41	43
COC[C@@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678533	GH	On-Demand	Anodyne	DRD2	26	43
COC[C@@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678533	GH	On-Demand	Anodyne	PDGFRB	18	40
COC[C@@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678533	GH	On-Demand	Anodyne	PLK1	25	40
COC[C@@H]1CCCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678533	GH	On-Demand	Anodyne	HPGD	67	75
N#CC[C@@H]1CC[C@H](Nc2ccnc3cc(Cl)ccc23)C1	ZINC000450678534	CI	On-Demand	Mild	HRP1_PLAFA	133	46
N#CC[C@@H]1CC[C@H](Nc2ccnc3cc(Cl)ccc23)C1	ZINC000450678534	CI	On-Demand	Mild	HNMT	62	44
N#CC[C@@H]1CC[C@H](Nc2ccnc3cc(Cl)ccc23)C1	ZINC000450678534	CI	On-Demand	Mild	BOTA	37	45
COC[C@@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450678547	FH	On-Demand	Bother	LIPG	54	40
COC[C@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450678548	FH	On-Demand	Bother	LIPG	54	40
O=[N+]([O-])c1cc2c(N3CCC[C@H]3COc3ccccc3)ncnc2s1	ZINC000450678557	FH	On-Demand	Bother	CASP3	46	36
O=[N+]([O-])c1cc2c(N3CCC[C@H]3COc3ccccc3)ncnc2s1	ZINC000450678557	FH	On-Demand	Bother	CHRNA10	61	42
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCc2ccncc21	ZINC000450678563	EH	On-Demand	Anodyne	PRCP	52	36
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCc2ccncc21	ZINC000450678564	EH	On-Demand	Anodyne	PRCP	52	36
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCc2ccncc21	ZINC000450678565	EH	On-Demand	Anodyne	PRCP	52	36
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCc2ccncc21	ZINC000450678566	EH	On-Demand	Anodyne	PRCP	52	36
COCc1ccc([C@H]2CCCN2C(=O)c2cc(-c3ccccc3)nn2C)o1	ZINC000450678574	FH	On-Demand	Anodyne	COLA	122	42
COCc1ccc([C@H]2CCCN2C(=O)c2cc(-c3ccccc3)nn2C)o1	ZINC000450678574	FH	On-Demand	Anodyne	CPT1A	105	42
COCc1ccc([C@@H]2CCCN2C(=O)c2cc(-c3ccccc3)nn2C)o1	ZINC000450678575	FH	On-Demand	Anodyne	COLA	122	42
COCc1ccc([C@@H]2CCCN2C(=O)c2cc(-c3ccccc3)nn2C)o1	ZINC000450678575	FH	On-Demand	Anodyne	CPT1A	105	42
CS[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450678580	DE	On-Demand	Anodyne	HDAC1	28	42
CS[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450678581	DE	On-Demand	Anodyne	HDAC1	28	42
CS[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450678597	CE	On-Demand	Bother	PDE3B	49	32
CS[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450678598	CE	On-Demand	Bother	PDE3B	49	32
CS[C@@H]1CCN(c2cnn(-c3cccc(C(F)(F)F)c3)c(=O)c2Cl)C1	ZINC000450678599	GH	On-Demand	Anodyne	LIPG	42	35
CS[C@H]1CCN(c2cnn(-c3cccc(C(F)(F)F)c3)c(=O)c2Cl)C1	ZINC000450678600	GH	On-Demand	Anodyne	LIPG	42	35
CC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678601	GE	On-Demand	Anodyne	CA2	53	42
CC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678601	GE	On-Demand	Anodyne	CA1	45	42
CC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678601	GE	On-Demand	Anodyne	CA7	41	42
CC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678601	GE	On-Demand	Anodyne	CA4	38	40
CC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678601	GE	On-Demand	Anodyne	CA14	28	42
CC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678601	GE	On-Demand	Anodyne	CA12	29	40
CC[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678601	GE	On-Demand	Anodyne	CA9	40	40
CC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678602	GE	On-Demand	Anodyne	CA2	53	42
CC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678602	GE	On-Demand	Anodyne	CA1	45	42
CC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678602	GE	On-Demand	Anodyne	CA7	41	42
CC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678602	GE	On-Demand	Anodyne	CA4	38	40
CC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678602	GE	On-Demand	Anodyne	CA14	28	42
CC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678602	GE	On-Demand	Anodyne	CA12	29	40
CC[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450678602	GE	On-Demand	Anodyne	CA9	40	40
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(C)cc2Br)o1	ZINC000450678619	GI	On-Demand	Anodyne	COLA	58	34
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(C)cc2Br)o1	ZINC000450678619	GI	On-Demand	Anodyne	CPT1A	54	34
Cc1cccc(C)c1OC[C@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450678620	EG	On-Demand	Anodyne	MAN1B1	49	34
Cc1cccc(C)c1OC[C@@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450678621	EG	On-Demand	Anodyne	MAN1B1	49	34
Cc1cccc(C)c1OC[C@@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450678622	EG	On-Demand	Anodyne	MAN1B1	49	34
Fc1cnc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450678647	CH	On-Demand	Anodyne	MAPK1	45	35
Fc1cnc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450678648	CH	On-Demand	Anodyne	MAPK1	46	36
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc(N2CCCC2)c1	ZINC000450678660	EI	On-Demand	Anodyne	KCNQ2	39	42
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc(N2CCCC2)c1	ZINC000450678661	EI	On-Demand	Anodyne	KCNQ2	39	42
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc(N2CCCC2)c1	ZINC000450678662	EI	On-Demand	Anodyne	KCNQ2	39	42
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc(N2CCCC2)c1	ZINC000450678663	EI	On-Demand	Anodyne	KCNQ2	39	42
CC[C@@H](NCc1nccc(OC)n1)c1cccc([N+](=O)[O-])c1	ZINC000450678674	DF	On-Demand	Bother	CACNA1D	50	32
CC[C@H](NCc1nccc(OC)n1)c1cccc([N+](=O)[O-])c1	ZINC000450678675	DF	On-Demand	Bother	CACNA1D	50	32
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2Cl)c(OC)c1	ZINC000450678685	GH	On-Demand	Anodyne	P2RX7	40	40
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2Cl)c(OC)c1	ZINC000450678685	GH	On-Demand	Anodyne	MTNR1A	61	42
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2Cl)c(OC)c1	ZINC000450678685	GH	On-Demand	Anodyne	MTNR1B	51	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2Cl)c(OC)c1	ZINC000450678686	GH	On-Demand	Anodyne	P2RX7	40	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2Cl)c(OC)c1	ZINC000450678686	GH	On-Demand	Anodyne	MTNR1A	61	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2Cl)c(OC)c1	ZINC000450678686	GH	On-Demand	Anodyne	MTNR1B	51	42
CNC(=O)N[C@@H]1CCN(C(=O)Cc2ccc(C(=O)OC)cc2)C1	ZINC000450678738	DC	On-Demand	Anodyne	EPHX2	32	48
CNC(=O)N[C@H]1CCN(C(=O)Cc2ccc(C(=O)OC)cc2)C1	ZINC000450678739	DC	On-Demand	Anodyne	EPHX2	32	48
CNC(=O)N[C@H]1CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678741	GE	On-Demand	Anodyne	HPGD	59	66
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450678742	GE	On-Demand	Anodyne	HPGD	59	66
COc1ccnc(CN[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)n1	ZINC000450678745	EF	On-Demand	Anodyne	EPHX2	42	36
COc1ccnc(CN[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)n1	ZINC000450678746	EF	On-Demand	Anodyne	EPHX2	42	36
CCOc1nc2ccc(C(=O)N3CC[C@@H](NC(=O)NC)C3)cc2[nH]1	ZINC000450678751	ED	On-Demand	Anodyne	SSTR5	40	34
CCOc1nc2ccc(C(=O)N3CC[C@@H](NC(=O)NC)C3)cc2[nH]1	ZINC000450678751	ED	On-Demand	Anodyne	EPHX2	22	41
CCOc1nc2ccc(C(=O)N3CC[C@H](NC(=O)NC)C3)cc2[nH]1	ZINC000450678752	ED	On-Demand	Anodyne	SSTR5	40	34
CCOc1nc2ccc(C(=O)N3CC[C@H](NC(=O)NC)C3)cc2[nH]1	ZINC000450678752	ED	On-Demand	Anodyne	EPHX2	22	41
CNC(=O)C1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450678762	ED	On-Demand	Anodyne	PDE6D	70	39
CNC(=O)C1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450678762	ED	On-Demand	Anodyne	HDAC8	41	42
CNC(=O)C1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450678762	ED	On-Demand	Anodyne	HDAC6	28	42
CNC(=O)C1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450678762	ED	On-Demand	Anodyne	IMDH_CRYPV	32	50
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450678767	FE	On-Demand	Anodyne	EPHX2	45	48
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450678767	FE	On-Demand	Anodyne	MCHR1	16	42
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450678768	FE	On-Demand	Anodyne	EPHX2	45	48
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450678768	FE	On-Demand	Anodyne	MCHR1	16	42
CCOCCOC1CN(C(=O)C2=C(c3ccccc3)CCC2)C1	ZINC000450678769	DF	On-Demand	Anodyne	CHRM5	47	38
CCc1ccc(C(C)(C)NCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450678777	EI	On-Demand	Anodyne	RORC	23	40
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678779	EH	On-Demand	Anodyne	ADAM17	26	42
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678779	EH	On-Demand	Anodyne	AMP1_PLAFQ	62	43
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678779	EH	On-Demand	Anodyne	LAP	0	43
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678780	EH	On-Demand	Anodyne	ADAM17	26	42
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678780	EH	On-Demand	Anodyne	AMP1_PLAFQ	62	43
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678780	EH	On-Demand	Anodyne	LAP	0	43
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678781	EH	On-Demand	Anodyne	ADAM17	26	42
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678781	EH	On-Demand	Anodyne	AMP1_PLAFQ	62	43
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678781	EH	On-Demand	Anodyne	LAP	0	43
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678783	EH	On-Demand	Anodyne	ADAM17	26	42
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678783	EH	On-Demand	Anodyne	AMP1_PLAFQ	62	43
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(-n2cccn2)cc1	ZINC000450678783	EH	On-Demand	Anodyne	LAP	0	43
CC[C@H](CNS(C)(=O)=O)Nc1nn2c(C)nnc2c2ccccc12	ZINC000450678785	EC	On-Demand	Anodyne	CREBBP	45	39
CC[C@H](CNS(C)(=O)=O)Nc1nn2c(C)nnc2c2ccccc12	ZINC000450678785	EC	On-Demand	Anodyne	BRD9	61	46
C[C@@H](NC[C@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678788	DI	On-Demand	Anodyne	ADAM17	29	42
C[C@@H](NC[C@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678788	DI	On-Demand	Anodyne	AMP1_PLAFQ	56	41
C[C@@H](NC[C@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678788	DI	On-Demand	Anodyne	LAP	0	41
C[C@H](NC[C@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678789	DI	On-Demand	Anodyne	ADAM17	29	42
C[C@H](NC[C@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678789	DI	On-Demand	Anodyne	AMP1_PLAFQ	53	35
C[C@H](NC[C@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678789	DI	On-Demand	Anodyne	LAP	0	41
C[C@H](NC[C@@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678790	DI	On-Demand	Anodyne	ADAM17	29	42
C[C@H](NC[C@@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678790	DI	On-Demand	Anodyne	AMP1_PLAFQ	56	41
C[C@H](NC[C@@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678790	DI	On-Demand	Anodyne	LAP	0	41
CC[C@@H](CNS(C)(=O)=O)Nc1nn2c(C)nnc2c2ccccc12	ZINC000450678791	EC	On-Demand	Anodyne	CREBBP	45	39
CC[C@@H](CNS(C)(=O)=O)Nc1nn2c(C)nnc2c2ccccc12	ZINC000450678791	EC	On-Demand	Anodyne	BRD9	61	46
C[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678792	DI	On-Demand	Anodyne	ADAM17	29	42
C[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678792	DI	On-Demand	Anodyne	AMP1_PLAFQ	56	41
C[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450678792	DI	On-Demand	Anodyne	LAP	0	41
C[C@H](Oc1ccccn1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450678794	GG	On-Demand	Anodyne	PDS	40	36
C[C@@H](Oc1ccccn1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450678795	GG	On-Demand	Anodyne	PDS	40	36
C[C@@H](Oc1ccccn1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450678796	GG	On-Demand	Anodyne	PDS	40	36
C[C@H](Oc1ccccn1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450678798	GG	On-Demand	Anodyne	PDS	40	36
CC[C@@H](CNS(C)(=O)=O)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450678799	ED	On-Demand	Anodyne	UTS2R	29	42
CC[C@H](CNS(C)(=O)=O)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450678801	ED	On-Demand	Anodyne	UTS2R	29	42
COc1ccc(CNC(=O)CCNC(C)(C)c2ccc(F)c(F)c2)c(OC)c1	ZINC000450678817	GH	On-Demand	Anodyne	TRPV1	32	42
COc1ccc(CNC(=O)CCNC(C)(C)c2ccc(F)c(F)c2)c(OC)c1	ZINC000450678817	GH	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCNC(C)(C)c2ccc(F)c(F)c2)c(OC)c1	ZINC000450678817	GH	On-Demand	Anodyne	MT-ND1	24	42
COc1ccc([C@@H](C)NC[C@](C)(O)C(C)=O)cc1OC	ZINC000450678832	CD	On-Demand	Anodyne	TRPV1	15	41
COc1ccc([C@H](C)NC[C@](C)(O)C(C)=O)cc1OC	ZINC000450678834	CD	On-Demand	Anodyne	TRPV1	15	41
COc1ccc([C@@H](C)NC[C@@](C)(O)C(C)=O)cc1OC	ZINC000450678836	CD	On-Demand	Anodyne	TRPV1	15	41
COc1ccc([C@H](C)NC[C@@](C)(O)C(C)=O)cc1OC	ZINC000450678837	CD	On-Demand	Anodyne	TRPV1	15	41
COC[C@@]1(C(=O)OC)CCN(c2nc(C)nc3ccc(OC)cc23)C1	ZINC000450678853	ED	On-Demand	Anodyne	MCHR1	16	40
COC[C@]1(C(=O)OC)CCN(c2nc(C)nc3ccc(OC)cc23)C1	ZINC000450678854	ED	On-Demand	Anodyne	MCHR1	16	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000450678862	CD	On-Demand	Anodyne	AMP1_PLAFQ	48	49
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000450678862	CD	On-Demand	Anodyne	LAP	0	49
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000450678863	CD	On-Demand	Anodyne	AMP1_PLAFQ	48	49
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000450678863	CD	On-Demand	Anodyne	LAP	0	49
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000450678864	CD	On-Demand	Anodyne	AMP1_PLAFQ	48	49
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000450678864	CD	On-Demand	Anodyne	LAP	0	49
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000450678865	CD	On-Demand	Anodyne	AMP1_PLAFQ	48	49
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000450678865	CD	On-Demand	Anodyne	LAP	0	49
COC[C@]1(C(=O)OC)CCN(c2cc(C)nc3c(OC)cccc23)C1	ZINC000450678880	EF	On-Demand	Anodyne	BDKRB2	76	33
COC[C@@]1(C(=O)OC)CCN(c2cc(C)nc3c(OC)cccc23)C1	ZINC000450678881	EF	On-Demand	Anodyne	BDKRB2	76	33
COC[C@]1(C(=O)OC)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450678882	ED	On-Demand	Anodyne	PDE3A	48	38
COC[C@]1(C(=O)OC)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450678882	ED	On-Demand	Anodyne	PDGFRB	78	43
COC[C@]1(C(=O)OC)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450678882	ED	On-Demand	Anodyne	PDE3B	71	38
COC[C@@]1(C(=O)OC)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450678883	ED	On-Demand	Anodyne	PDE3A	48	38
COC[C@@]1(C(=O)OC)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450678883	ED	On-Demand	Anodyne	PDGFRB	78	43
COC[C@@]1(C(=O)OC)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450678883	ED	On-Demand	Anodyne	PDE3B	71	38
COC[C@@]1(C(=O)OC)CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450678908	GD	On-Demand	Anodyne	LRRK2	30	41
COC[C@]1(C(=O)OC)CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450678911	GD	On-Demand	Anodyne	LRRK2	30	41
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(C)cc2Br)o1	ZINC000450678920	GI	On-Demand	Anodyne	COLA	58	34
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(C)cc2Br)o1	ZINC000450678920	GI	On-Demand	Anodyne	CPT1A	54	34
COc1cccc2c(N3CC[C@@H](SC)C3)c(C)cnc12	ZINC000450678932	CG	On-Demand	Anodyne	PDE3B	57	34
COc1cccc2c(N3CC[C@H](SC)C3)c(C)cnc12	ZINC000450678933	CG	On-Demand	Anodyne	PDE3B	57	34
COc1ccc(CC(=O)N2CCc3ccncc32)c(Cl)c1OC	ZINC000450678936	EF	On-Demand	Anodyne	EIF2AK3	46	36
COCC[C@@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450678953	FI	On-Demand	Anodyne	RBP4	85	38
COCC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450678954	FI	On-Demand	Anodyne	RBP4	85	38
COC[C@](C)(CCO)NC(=O)c1ccc2cnccc2c1	ZINC000450678958	CD	On-Demand	Anodyne	AKT1	20	40
COC[C@@](C)(CCO)NC(=O)c1ccc2cnccc2c1	ZINC000450678959	CD	On-Demand	Anodyne	AKT1	20	40
COC[C@H]1CCCCN(C(=O)Cc2cc3ccccc3c(O)n2)C1	ZINC000450678967	EF	On-Demand	Anodyne	COLA	40	35
COC[C@@H]1CCCCN(C(=O)Cc2cc3ccccc3c(O)n2)C1	ZINC000450678968	EF	On-Demand	Anodyne	COLA	40	35
COCc1ccc([C@@H]2CCCN2C(=O)c2cc3ccncc3s2)o1	ZINC000450678971	EI	On-Demand	Anodyne	CPT1A	64	36
COCc1ccc([C@H]2CCCN2C(=O)c2cc3ccncc3s2)o1	ZINC000450678972	EI	On-Demand	Anodyne	CPT1A	64	36
CCNC(=O)c1ccc(N2CC[C@@H](SC)C2)nn1	ZINC000450678973	CD	On-Demand	Anodyne	SCD	24	43
CCNC(=O)c1ccc(N2CC[C@H](SC)C2)nn1	ZINC000450678974	CD	On-Demand	Anodyne	SCD	24	43
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](SC)C1	ZINC000450678983	EG	On-Demand	Anodyne	ATP4A	19	49
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](SC)C1	ZINC000450678984	EG	On-Demand	Anodyne	ATP4A	19	49
COC[C@@](C)(CCO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450678989	GE	On-Demand	Anodyne	MT-ND1	15	40
COC[C@](C)(CCO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450678990	GE	On-Demand	Anodyne	MT-ND1	15	40
CN1CCC(CCO)(NC(=O)c2cc3ccc(Br)cc3s2)CC1	ZINC000450678994	GG	On-Demand	Anodyne	TACR2	45	35
COC[C@@H]1CCCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450679001	DE	On-Demand	Anodyne	ADRA2B	19	42
COC[C@@H]1CCCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450679001	DE	On-Demand	Anodyne	COLA	15	40
COC[C@@H]1CCCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450679001	DE	On-Demand	Anodyne	CPT1A	17	40
COC[C@H]1CCCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450679002	DE	On-Demand	Anodyne	ADRA2B	19	42
COC[C@H]1CCCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450679002	DE	On-Demand	Anodyne	COLA	15	40
COC[C@H]1CCCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450679002	DE	On-Demand	Anodyne	CPT1A	17	40
COC[C@@H]1CCCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450679003	DE	On-Demand	Anodyne	ADRA2B	19	42
COC[C@@H]1CCCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450679003	DE	On-Demand	Anodyne	COLA	15	40
COC[C@@H]1CCCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450679003	DE	On-Demand	Anodyne	CPT1A	17	40
COC[C@H]1CCCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450679004	DE	On-Demand	Anodyne	ADRA2B	19	42
COC[C@H]1CCCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450679004	DE	On-Demand	Anodyne	COLA	15	40
COC[C@H]1CCCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450679004	DE	On-Demand	Anodyne	CPT1A	17	40
CCS(=O)(=O)c1ccccc1N1CCC[C@H]1COc1ccccc1	ZINC000450679005	EH	On-Demand	Anodyne	CASP3	70	45
CCS(=O)(=O)c1ccccc1N1CCC[C@H]1COc1ccccc1	ZINC000450679005	EH	On-Demand	Anodyne	CHRNA10	87	54
CCS(=O)(=O)c1ccccc1N1CCC[C@H]1COc1ccccc1	ZINC000450679005	EH	On-Demand	Anodyne	CASP7	59	45
O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679011	GH	On-Demand	Anodyne	DRD4	15	41
O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679011	GH	On-Demand	Anodyne	HRH4	0	43
O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679011	GH	On-Demand	Anodyne	UTS2R	25	42
O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679011	GH	On-Demand	Anodyne	SLC6A5	19	41
O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679011	GH	On-Demand	Anodyne	HPGDS	36	52
O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679012	GH	On-Demand	Anodyne	DRD4	15	41
O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679012	GH	On-Demand	Anodyne	HRH4	0	43
O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679012	GH	On-Demand	Anodyne	UTS2R	25	42
O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679012	GH	On-Demand	Anodyne	SLC6A5	19	41
O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450679012	GH	On-Demand	Anodyne	HPGDS	36	52
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)o1	ZINC000450679014	FH	On-Demand	Anodyne	COLA	114	37
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)o1	ZINC000450679014	FH	On-Demand	Anodyne	CPT1A	99	36
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)o1	ZINC000450679014	FH	On-Demand	Anodyne	PREP	52	35
COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)o1	ZINC000450679015	FH	On-Demand	Anodyne	COLA	114	37
COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)o1	ZINC000450679015	FH	On-Demand	Anodyne	CPT1A	99	36
COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)o1	ZINC000450679015	FH	On-Demand	Anodyne	PREP	52	35
COCc1ccc([C@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)o1	ZINC000450679016	FH	On-Demand	Anodyne	COLA	114	37
COCc1ccc([C@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)o1	ZINC000450679016	FH	On-Demand	Anodyne	CPT1A	99	36
COCc1ccc([C@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)o1	ZINC000450679016	FH	On-Demand	Anodyne	PREP	52	35
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)o1	ZINC000450679017	FH	On-Demand	Anodyne	COLA	114	37
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)o1	ZINC000450679017	FH	On-Demand	Anodyne	CPT1A	99	36
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)o1	ZINC000450679017	FH	On-Demand	Anodyne	PREP	52	35
COc1ccccc1-c1nnc(SCCCCCC(C)=O)o1	ZINC000450679027	DH	On-Demand	Anodyne	ALOX15	67	41
COc1cccc(OCCC(=O)N[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)c1	ZINC000450679032	GH	On-Demand	Anodyne	MTNR1A	18	41
COc1cccc(OCCC(=O)N[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)c1	ZINC000450679032	GH	On-Demand	Anodyne	MTNR1B	22	41
COc1cccc(OCCC(=O)N[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)c1	ZINC000450679033	GH	On-Demand	Anodyne	MTNR1A	18	41
COc1cccc(OCCC(=O)N[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)c1	ZINC000450679033	GH	On-Demand	Anodyne	MTNR1B	22	41
CCN(C)C(=O)[C@@H](Nc1nc2ccccc2s1)C(C)C	ZINC000450679129	CG	On-Demand	Anodyne	CSNK1D	25	44
COc1cc([C@H](C)NCc2c(C)cccc2Cl)ccc1OCCO	ZINC000450679144	EH	On-Demand	Anodyne	EIF2AK1	48	38
COc1cc([C@@H](C)NCc2c(C)cccc2Cl)ccc1OCCO	ZINC000450679147	EH	On-Demand	Anodyne	EIF2AK1	48	38
O=C(N[C@H](CO)c1ccccc1)C1=C(c2ccccc2)CCC1	ZINC000450679165	DG	On-Demand	Anodyne	TACR3	46	36
O=C(N[C@H](CO)c1ccccc1)C1=C(c2ccccc2)CCC1	ZINC000450679165	DG	On-Demand	Anodyne	GPR88	0	40
CNC(=O)N[C@@H]1CCN(C(=O)CCc2cccc(F)c2Br)C1	ZINC000450679187	FE	On-Demand	Anodyne	C3AR1	37	40
CNC(=O)N[C@H]1CCN(C(=O)CCc2cccc(F)c2Br)C1	ZINC000450679188	FE	On-Demand	Anodyne	C3AR1	37	40
CC(=O)CCCCCOc1cccnc1[N+](=O)[O-]	ZINC000450679193	CF	On-Demand	Bother	S1PR4	0	53
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679210	EE	On-Demand	Anodyne	CACNA1B	50	39
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679210	EE	On-Demand	Anodyne	CCR2	57	41
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679210	EE	On-Demand	Anodyne	EPHX2	38	46
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679210	EE	On-Demand	Anodyne	MCHR1	22	44
CNC(=O)N[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679210	EE	On-Demand	Anodyne	LIPG	50	35
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679211	EE	On-Demand	Anodyne	CACNA1B	50	39
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679211	EE	On-Demand	Anodyne	CCR2	57	41
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679211	EE	On-Demand	Anodyne	EPHX2	38	46
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679211	EE	On-Demand	Anodyne	MCHR1	22	44
CNC(=O)N[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450679211	EE	On-Demand	Anodyne	LIPG	50	35
O=C(NCc1ccccc1N1CCCCC1)c1ccc(N2CCC2)nc1	ZINC000450679253	FG	On-Demand	Anodyne	DRD2	20	40
O=C(NCc1ccccc1N1CCCCC1)c1ccc(N2CCC2)nc1	ZINC000450679253	FG	On-Demand	Anodyne	KCNQ2	73	40
O=C(NCc1ccccc1N1CCCCC1)c1ccc(N2CCC2)nc1	ZINC000450679253	FG	On-Demand	Anodyne	SCN2A	26	58
O=C(NCc1ccccc1N1CCCCC1)c1ccc(N2CCC2)nc1	ZINC000450679253	FG	On-Demand	Anodyne	SCN10A	39	58
O=C(NCc1ccccc1N1CCCCC1)c1ccc(N2CCC2)nc1	ZINC000450679253	FG	On-Demand	Anodyne	HPGDS	20	45
COCC1(O)CN(c2ccnc(C(C)C)n2)C1	ZINC000450679282	BC	On-Demand	Anodyne	SORD	71	40
CCC(=O)c1ccc(N[C@@H](C)C2CC2)c([N+](=O)[O-])c1	ZINC000450679291	CG	On-Demand	Bother	EEF1A1	0	40
CCC(=O)c1ccc(N[C@@H](C)C2CC2)c([N+](=O)[O-])c1	ZINC000450679291	CG	On-Demand	Bother	EEF1A2	0	40
CC(C)(CNC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1cccc(Cl)c1F	ZINC000450679316	EI	On-Demand	Anodyne	P2RX7	41	36
Cc1nc(N2CCC[C@H]2COc2ccccc2)ccc1C#N	ZINC000450679344	CG	On-Demand	Mild	CHRNA10	71	52
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](SC)C3)c2c1	ZINC000450679349	EH	On-Demand	Anodyne	PDE3A	47	40
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](SC)C3)c2c1	ZINC000450679349	EH	On-Demand	Anodyne	PDE3B	69	40
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](SC)C3)c2c1	ZINC000450679350	EH	On-Demand	Anodyne	PDE3A	47	40
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](SC)C3)c2c1	ZINC000450679350	EH	On-Demand	Anodyne	PDE3B	69	40
COCC[C@@H]1CCCCN(C(=O)c2cnn3ccc(C)cc23)C1	ZINC000450679355	DF	On-Demand	Anodyne	EPHB3	25	42
COCC[C@H]1CCCCN(C(=O)c2cnn3ccc(C)cc23)C1	ZINC000450679356	DF	On-Demand	Anodyne	EPHB3	25	42
COCC[C@@H]1CCCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450679363	DG	On-Demand	Anodyne	AKR1C3	0	44
COCC[C@H]1CCCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450679364	DG	On-Demand	Anodyne	AKR1C3	0	44
CS[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450679365	EE	On-Demand	Anodyne	LRRK2	26	40
CS[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450679366	EE	On-Demand	Anodyne	LRRK2	26	40
COc1cc(C(C)=O)ccc1OCc1nnc(C2CC2)s1	ZINC000450679374	DG	On-Demand	Anodyne	SLC5A7	21	40
COc1cc(CC(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)ccc1Cl	ZINC000450679375	EG	On-Demand	Anodyne	NCE103	22	42
COc1cc(CC(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)ccc1Cl	ZINC000450679375	EG	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)ccc1Cl	ZINC000450679376	EG	On-Demand	Anodyne	NCE103	22	42
COc1cc(CC(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)ccc1Cl	ZINC000450679376	EG	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)NC[C@]2(C)CCO[C@H]2C2CC2)ccc1Cl	ZINC000450679377	EG	On-Demand	Anodyne	NCE103	22	42
COc1cc(CC(=O)NC[C@]2(C)CCO[C@H]2C2CC2)ccc1Cl	ZINC000450679377	EG	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)ccc1Cl	ZINC000450679378	EG	On-Demand	Anodyne	NCE103	22	42
COc1cc(CC(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)ccc1Cl	ZINC000450679378	EG	On-Demand	Anodyne	CAN2	0	42
COCC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450679379	GI	On-Demand	Anodyne	SLC6A1	28	41
COCC[C@@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450679380	GI	On-Demand	Anodyne	SLC6A1	28	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450679390	DG	On-Demand	Anodyne	XIAP	57	36
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450679391	DG	On-Demand	Anodyne	XIAP	57	36
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450679392	DG	On-Demand	Anodyne	XIAP	57	36
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450679393	DG	On-Demand	Anodyne	XIAP	57	36
CS[C@@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450679398	FH	On-Demand	Anodyne	SCD	0	41
CS[C@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450679399	FH	On-Demand	Anodyne	SCD	0	41
CS[C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450679410	DI	On-Demand	Anodyne	LIPG	41	32
CS[C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450679411	DI	On-Demand	Anodyne	LIPG	41	32
Cc1ccc(CC(=O)N2CCc3ccncc32)c(Br)c1	ZINC000450679416	EG	On-Demand	Anodyne	EIF2AK3	42	34
COc1ccc([C@@H](C)NCc2c(C)cccc2Cl)cc1OC	ZINC000450679425	DJ	On-Demand	Anodyne	EIF2AK1	53	43
COc1ccc([C@H](C)NCc2c(C)cccc2Cl)cc1OC	ZINC000450679426	DJ	On-Demand	Anodyne	EIF2AK1	61	43
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1nc2ccccc2o1	ZINC000450679432	CG	On-Demand	Anodyne	HTR3A	20	53
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1nc2ccccc2o1	ZINC000450679434	CG	On-Demand	Anodyne	HTR3A	20	53
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1nc2ccccc2o1	ZINC000450679435	CG	On-Demand	Anodyne	HTR3A	20	53
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1nc2ccccc2o1	ZINC000450679436	CG	On-Demand	Anodyne	HTR3A	20	53
CC[C@@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450679444	GE	On-Demand	Anodyne	P4HTM	0	47
CC[C@H](CNS(C)(=O)=O)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450679447	GE	On-Demand	Anodyne	P4HTM	0	47
CCSc1cccnc1C(=O)N1CC[C@H](NC(=O)NC)C1	ZINC000450679451	DD	On-Demand	Anodyne	EPHX2	25	41
CCSc1cccnc1C(=O)N1CC[C@@H](NC(=O)NC)C1	ZINC000450679455	DD	On-Demand	Anodyne	EPHX2	25	41
CC(C)=CCC[C@H](C)Nc1ncnc2[nH]cnc12	ZINC000450679462	BF	On-Demand	Anodyne	AHK4	0	53
CC(C)=CCC[C@H](C)Nc1ncnc2[nH]cnc12	ZINC000450679462	BF	On-Demand	Anodyne	AHK3	0	53
COC(=O)c1cccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl	ZINC000450679464	FI	On-Demand	Bother	CACNA1D	57	34
COC(=O)c1cccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl	ZINC000450679464	FI	On-Demand	Bother	COLA	55	32
CC(C)=CCC[C@@H](C)Nc1ncnc2[nH]cnc12	ZINC000450679465	BF	On-Demand	Anodyne	AHK4	0	53
CC(C)=CCC[C@@H](C)Nc1ncnc2[nH]cnc12	ZINC000450679465	BF	On-Demand	Anodyne	AHK3	0	53
COC(=O)c1cccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl	ZINC000450679468	FI	On-Demand	Bother	CACNA1D	57	34
COC(=O)c1cccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl	ZINC000450679468	FI	On-Demand	Bother	COLA	55	32
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@H](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000450679473	FD	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000450679475	FD	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000450679476	FD	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000450679477	FD	On-Demand	Bother	TAAR1	20	47
Cc1ccccc1CNc1ccccc1NC(=O)c1cn(CC2CC2)nn1	ZINC000450679509	FH	On-Demand	Anodyne	CCR8	61	36
Cc1ccc2oc(N3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)nc2c1	ZINC000450679530	DH	On-Demand	Anodyne	HTR3A	0	56
Cc1ccc2oc(N3CCCC[C@@H]3[C@H]3CCC[C@H]3O)nc2c1	ZINC000450679535	DH	On-Demand	Anodyne	HTR3A	0	56
Cc1ccc2oc(N3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc2c1	ZINC000450679537	DH	On-Demand	Anodyne	HTR3A	0	56
Cc1ccc2oc(N3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)nc2c1	ZINC000450679538	DH	On-Demand	Anodyne	HTR3A	0	56
CC(C)=CCC[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450679577	FH	On-Demand	Bother	BCL2L1	92	40
CC(C)=CCC[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450679577	FH	On-Demand	Bother	BCL2	64	35
CC(C)=CCC[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450679577	FH	On-Demand	Bother	BCL2L2	40	31
CC(C)=CCC[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450679578	FH	On-Demand	Bother	BCL2L1	92	40
CC(C)=CCC[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450679578	FH	On-Demand	Bother	BCL2	64	35
CC(C)=CCC[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450679578	FH	On-Demand	Bother	BCL2L2	40	31
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450679579	CD	On-Demand	Bother	CACNA1D	50	34
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450679580	CD	On-Demand	Bother	CACNA1D	50	34
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450679581	CD	On-Demand	Bother	CACNA1D	50	34
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450679582	CD	On-Demand	Bother	CACNA1D	50	34
CCCc1nc(C)c(COc2cccnc2[N+](=O)[O-])o1	ZINC000450679611	CF	On-Demand	Bother	S1PR4	0	41
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450679622	GI	On-Demand	Anodyne	COLA	58	39
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450679622	GI	On-Demand	Anodyne	CPT1A	54	39
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450679622	GI	On-Demand	Anodyne	CCR2	45	41
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450679623	GI	On-Demand	Anodyne	COLA	58	39
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450679623	GI	On-Demand	Anodyne	CPT1A	54	39
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450679623	GI	On-Demand	Anodyne	CCR2	45	41
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450679625	GI	On-Demand	Anodyne	COLA	58	39
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450679625	GI	On-Demand	Anodyne	CPT1A	54	39
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450679625	GI	On-Demand	Anodyne	CCR2	45	41
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450679626	GI	On-Demand	Anodyne	COLA	58	39
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450679626	GI	On-Demand	Anodyne	CPT1A	54	39
CO[C@@H]1COCC[C@H]1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450679626	GI	On-Demand	Anodyne	CCR2	45	41
CNS(=O)(=O)c1ccc(N2CC[C@](COC)(C(=O)OC)C2)c(F)c1	ZINC000450679658	FC	On-Demand	Anodyne	SLC6A9	0	41
CNS(=O)(=O)c1ccc(N2CC[C@@](COC)(C(=O)OC)C2)c(F)c1	ZINC000450679659	FC	On-Demand	Anodyne	SLC6A9	0	41
COC[C@@]1(C(=O)OC)CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450679666	EE	On-Demand	Anodyne	AKT1	38	41
COC[C@]1(C(=O)OC)CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450679667	EE	On-Demand	Anodyne	AKT1	38	41
Cc1cc(C(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)ncc1C(N)=O	ZINC000450679671	GF	On-Demand	Anodyne	SCD1	23	40
Cc1cc(C(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)ncc1C(N)=O	ZINC000450679672	GF	On-Demand	Anodyne	SCD1	23	40
FC(F)(F)Cn1ccc(CN[C@@H](COCc2ccccc2)c2ccccc2)n1	ZINC000450679694	GI	On-Demand	Anodyne	MAN1B1	32	40
FC(F)(F)Cn1ccc(CN[C@H](COCc2ccccc2)c2ccccc2)n1	ZINC000450679695	GI	On-Demand	Anodyne	MAN1B1	32	40
COc1ccccc1Oc1ccc(C(=O)NC2(CCO)CCN(C)CC2)nc1	ZINC000450679729	GE	On-Demand	Anodyne	HCN1	58	38
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H](COC)C2)c1	ZINC000450679736	EG	On-Demand	Anodyne	CPT1A	41	36
C/C=C\COc1cccc(CC(=O)N2CCCC[C@H](COC)C2)c1	ZINC000450679737	EG	On-Demand	Anodyne	CPT1A	41	36
C/C=C/COc1cccc(CC(=O)N2CCCC[C@@H](COC)C2)c1	ZINC000450679738	EG	On-Demand	Anodyne	CPT1A	41	36
C/C=C/COc1cccc(CC(=O)N2CCCC[C@H](COC)C2)c1	ZINC000450679739	EG	On-Demand	Anodyne	CPT1A	41	36
COCC[C@H]1CCCCN(C(=O)c2cncc(Cl)c2)C1	ZINC000450679744	CG	On-Demand	Anodyne	CACNA1I	50	34
COCC[C@@H]1CCCCN(C(=O)c2cncc(Cl)c2)C1	ZINC000450679745	CG	On-Demand	Anodyne	CACNA1I	50	34
COc1cccc2c(N3CC[C@@H](SC)C3)cc(C)nc12	ZINC000450679750	CG	On-Demand	Anodyne	PDE3B	45	32
COc1cccc2c(N3CC[C@H](SC)C3)cc(C)nc12	ZINC000450679751	CG	On-Demand	Anodyne	PDE3B	45	32
COCc1ccc([C@H]2CCCN2C(=O)Cc2cc3ccccc3c(O)n2)o1	ZINC000450679761	FH	On-Demand	Anodyne	COLA	111	38
COCc1ccc([C@H]2CCCN2C(=O)Cc2cc3ccccc3c(O)n2)o1	ZINC000450679761	FH	On-Demand	Anodyne	CPT1A	95	38
COCc1ccc([C@@H]2CCCN2C(=O)Cc2cc3ccccc3c(O)n2)o1	ZINC000450679762	FH	On-Demand	Anodyne	COLA	111	38
COCc1ccc([C@@H]2CCCN2C(=O)Cc2cc3ccccc3c(O)n2)o1	ZINC000450679762	FH	On-Demand	Anodyne	CPT1A	95	38
CC[C@@H]1CCC[C@H]1C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450679769	CF	On-Demand	Anodyne	XIAP	50	35
CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450679770	CF	On-Demand	Anodyne	XIAP	50	35
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450679771	CF	On-Demand	Anodyne	XIAP	50	35
CC[C@@H]1CCC[C@H]1C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450679772	CF	On-Demand	Anodyne	XIAP	50	35
COCC[C@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450679812	DF	On-Demand	Anodyne	REN	49	43
COCC[C@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450679813	DF	On-Demand	Anodyne	REN	49	43
COCC[C@@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450679814	DF	On-Demand	Anodyne	REN	49	43
COCC[C@@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450679815	DF	On-Demand	Anodyne	REN	49	43
COC(=O)c1ccc(OCc2nc(C(=O)OC)cs2)c(OC)c1	ZINC000450679817	EE	On-Demand	Anodyne	DRTS_TRYCR	20	41
CO[C@H](CSc1nnc(-c2ccc(OC(F)F)cc2)o1)Cc1ccccc1	ZINC000450679843	GJ	On-Demand	Anodyne	GSK3B	16	43
CO[C@H](CSc1nnc(-c2ccc(OC(F)F)cc2)o1)Cc1ccccc1	ZINC000450679843	GJ	On-Demand	Anodyne	GSK3A	41	41
CO[C@@H](CSc1nnc(-c2ccc(OC(F)F)cc2)o1)Cc1ccccc1	ZINC000450679844	GJ	On-Demand	Anodyne	GSK3B	16	43
CO[C@@H](CSc1nnc(-c2ccc(OC(F)F)cc2)o1)Cc1ccccc1	ZINC000450679844	GJ	On-Demand	Anodyne	GSK3A	41	41
N#Cc1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1C(F)(F)F	ZINC000450679877	EI	On-Demand	Mild	AR	52	53
N#Cc1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1C(F)(F)F	ZINC000450679884	EI	On-Demand	Mild	AR	52	53
N#Cc1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1C(F)(F)F	ZINC000450679886	EI	On-Demand	Mild	AR	52	53
N#Cc1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1C(F)(F)F	ZINC000450679887	EI	On-Demand	Mild	AR	52	53
CC[C@@H](NCc1nc(C(=O)OC)cs1)c1cccc([N+](=O)[O-])c1	ZINC000450679893	EG	On-Demand	Bother	CACNA1D	88	38
CC[C@H](NCc1nc(C(=O)OC)cs1)c1cccc([N+](=O)[O-])c1	ZINC000450679895	EG	On-Demand	Bother	CACNA1D	88	38
COCC[C@@H](NC(=O)[C@@]1(C)CC=CCC1)c1ccc(C)o1	ZINC000450679945	CH	On-Demand	Anodyne	NPPA	41	32
COCC[C@@H](NC(=O)[C@]1(C)CC=CCC1)c1ccc(C)o1	ZINC000450679947	CH	On-Demand	Anodyne	NPPA	41	32
COCC[C@H](NC(=O)[C@]1(C)CC=CCC1)c1ccc(C)o1	ZINC000450679948	CH	On-Demand	Anodyne	NPPA	41	32
COCC[C@H](NC(=O)[C@@]1(C)CC=CCC1)c1ccc(C)o1	ZINC000450679949	CH	On-Demand	Anodyne	NPPA	41	32
CCN(CCO)CCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450679950	CC	On-Demand	Anodyne	CAN2	0	44
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450679961	CH	On-Demand	Anodyne	ADORA1	65	48
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450679961	CH	On-Demand	Anodyne	AHCY	44	34
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450679961	CH	On-Demand	Anodyne	ADORA3	72	43
CC(C)=CCC[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450679961	CH	On-Demand	Anodyne	OXGR1	49	34
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450679962	CH	On-Demand	Anodyne	ADORA1	65	48
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450679962	CH	On-Demand	Anodyne	AHCY	44	34
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450679962	CH	On-Demand	Anodyne	ADORA3	72	43
CC(C)=CCC[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450679962	CH	On-Demand	Anodyne	OXGR1	49	34
COC[C@]1(C(=O)OC)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450679972	ED	On-Demand	Anodyne	COLA	26	42
COC[C@@]1(C(=O)OC)CCN(c2nc(-c3ccc(OC)cc3)no2)C1	ZINC000450679973	ED	On-Demand	Anodyne	COLA	26	42
Cc1ccc(C(=O)NCC(=O)Nc2cccc(Br)c2)c(C(C)C)n1	ZINC000450679981	GH	On-Demand	Anodyne	EGFR	30	41
Cc1ccc(C(=O)NCC(=O)Nc2cccc(Br)c2)c(C(C)C)n1	ZINC000450679981	GH	On-Demand	Anodyne	F2R	0	40
Cc1ccc(C(=O)NCC(=O)Nc2cccc(Br)c2)c(C(C)C)n1	ZINC000450679981	GH	On-Demand	Anodyne	SORT1	18	40
C[S@@](=O)C[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450679986	DH	On-Demand	Anodyne	METAP1	44	44
C[S@@](=O)C[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450679987	DH	On-Demand	Anodyne	METAP1	44	44
C[S@](=O)C[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450679988	DH	On-Demand	Anodyne	METAP1	44	44
C[S@](=O)C[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450679989	DH	On-Demand	Anodyne	METAP1	44	44
CO[C@@H](CN[C@H](C)c1ccc(-n2cccn2)cc1)Cc1ccccc1	ZINC000450679992	EH	On-Demand	Anodyne	AMP1_PLAFQ	55	38
CO[C@@H](CN[C@@H](C)c1ccc(-n2cccn2)cc1)Cc1ccccc1	ZINC000450679993	EH	On-Demand	Anodyne	AMP1_PLAFQ	55	38
CO[C@H](CN[C@H](C)c1ccc(-n2cccn2)cc1)Cc1ccccc1	ZINC000450679994	EH	On-Demand	Anodyne	AMP1_PLAFQ	55	38
CO[C@H](CN[C@@H](C)c1ccc(-n2cccn2)cc1)Cc1ccccc1	ZINC000450679996	EH	On-Demand	Anodyne	AMP1_PLAFQ	55	38
COCC1(O)CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450679999	FG	On-Demand	Anodyne	SIRT3	57	31
COCC1(O)CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450679999	FG	On-Demand	Anodyne	SIRT2	55	30
COCC1(O)CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450679999	FG	On-Demand	Anodyne	SIRT1	48	30
COCC1(O)CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450680052	CD	On-Demand	Anodyne	PDE3A	44	33
CN(C)[C@@H](CNC(=O)C1(CF)CCOCC1)c1cccc(C(F)(F)F)c1	ZINC000450680063	GG	On-Demand	Anodyne	PHES	0	41
CN(C)[C@H](CNC(=O)C1(CF)CCOCC1)c1cccc(C(F)(F)F)c1	ZINC000450680065	GG	On-Demand	Anodyne	PHES	0	41
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450680074	FJ	On-Demand	Anodyne	SFRP1	40	32
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450680074	FJ	On-Demand	Anodyne	WNT3	46	32
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450680075	FJ	On-Demand	Anodyne	SFRP1	40	32
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450680075	FJ	On-Demand	Anodyne	WNT3	46	32
COc1cc([C@H](C)NCc2ccccc2OC2CC2)ccc1OCCO	ZINC000450680099	FG	On-Demand	Anodyne	SLC5A4	45	36
COc1cc([C@@H](C)NCc2ccccc2OC2CC2)ccc1OCCO	ZINC000450680100	FG	On-Demand	Anodyne	SLC5A4	45	36
CCOc1cccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450680110	DH	On-Demand	Anodyne	PDS	38	40
CCOc1cccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450680111	DH	On-Demand	Anodyne	PDS	62	42
CCOc1cccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450680112	DH	On-Demand	Anodyne	PDS	62	42
CCOc1cccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450680113	DH	On-Demand	Anodyne	PDS	38	40
CC(=O)[C@](C)(O)CN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000450680114	EG	On-Demand	Anodyne	PTGER2	34	41
CC(=O)[C@](C)(O)CN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000450680114	EG	On-Demand	Anodyne	PPIA	47	36
CC(=O)[C@](C)(O)CN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000450680114	EG	On-Demand	Anodyne	PTGER4	0	41
CC(=O)[C@](C)(O)CN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000450680114	EG	On-Demand	Anodyne	CAPN2	41	35
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000450680115	EG	On-Demand	Anodyne	PTGER2	34	41
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000450680115	EG	On-Demand	Anodyne	PPIA	47	36
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000450680115	EG	On-Demand	Anodyne	PTGER4	0	41
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000450680115	EG	On-Demand	Anodyne	CAPN2	41	35
C[C@H](NCCC[C@@H](C)O)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680130	EH	On-Demand	Anodyne	TRPV1	15	40
C[C@H](NCCC[C@@H](C)O)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680130	EH	On-Demand	Anodyne	CXCR2	0	42
C[C@H](NCCC[C@@H](C)O)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680130	EH	On-Demand	Anodyne	PRNP	55	34
C[C@H](NCCC[C@@H](C)O)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680130	EH	On-Demand	Anodyne	F7	15	40
C[C@H](NCCC[C@@H](C)O)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680130	EH	On-Demand	Anodyne	LEF	45	43
C[C@H](O)CCCN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680131	EH	On-Demand	Anodyne	TRPV1	15	40
C[C@H](O)CCCN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680131	EH	On-Demand	Anodyne	CXCR2	0	42
C[C@H](O)CCCN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680131	EH	On-Demand	Anodyne	PRNP	55	34
C[C@H](O)CCCN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680131	EH	On-Demand	Anodyne	F7	15	40
C[C@H](O)CCCN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680131	EH	On-Demand	Anodyne	LEF	45	43
C[C@@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680132	EH	On-Demand	Anodyne	TRPV1	15	40
C[C@@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680132	EH	On-Demand	Anodyne	CXCR2	0	42
C[C@@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680132	EH	On-Demand	Anodyne	PRNP	55	34
C[C@@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680132	EH	On-Demand	Anodyne	F7	15	40
C[C@@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680132	EH	On-Demand	Anodyne	LEF	45	43
C[C@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680133	EH	On-Demand	Anodyne	TRPV1	15	40
C[C@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680133	EH	On-Demand	Anodyne	CXCR2	0	42
C[C@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680133	EH	On-Demand	Anodyne	PRNP	55	34
C[C@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680133	EH	On-Demand	Anodyne	F7	15	40
C[C@H](O)CCCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450680133	EH	On-Demand	Anodyne	LEF	45	43
CCN(C)C(=O)[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)C(C)C	ZINC000450680134	EG	On-Demand	Mild	AR	52	43
COc1ccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc1OC	ZINC000450680140	EH	On-Demand	Anodyne	SLC22A3	0	42
COc1ccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1OC	ZINC000450680141	EH	On-Demand	Anodyne	SLC22A3	0	42
COc1ccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc1OC	ZINC000450680142	EH	On-Demand	Anodyne	SLC22A3	0	42
COc1ccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc1OC	ZINC000450680143	EH	On-Demand	Anodyne	SLC22A3	0	42
CC(C)=CCC[C@H](C)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450680147	FH	On-Demand	Anodyne	LRRK2	30	43
CC(C)=CCC[C@@H](C)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450680148	FH	On-Demand	Anodyne	LRRK2	30	43
Cc1cccc(Cl)c1CN[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450680149	DI	On-Demand	Bother	CACNA1D	63	36
Cc1cccc(Cl)c1CN[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000450680150	DI	On-Demand	Bother	CACNA1D	64	36
CNC(=O)N[C@@H]1CCN(C(=O)Cc2cc(Br)ccc2C)C1	ZINC000450680151	FD	On-Demand	Anodyne	EPHX2	28	45
COCC[C@@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450680156	EH	On-Demand	Anodyne	OPRM1	0	41
COCC[C@@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450680156	EH	On-Demand	Anodyne	OPRK1	29	44
COCC[C@@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450680156	EH	On-Demand	Anodyne	HTR4	49	38
COCC[C@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450680157	EH	On-Demand	Anodyne	OPRM1	0	41
COCC[C@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450680157	EH	On-Demand	Anodyne	OPRK1	29	44
COCC[C@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450680157	EH	On-Demand	Anodyne	HTR4	49	38
COC(=O)c1cc(C)nc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450680164	FG	On-Demand	Bother	CASP3	41	36
COC(=O)c1cc(C)nc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450680164	FG	On-Demand	Bother	CACNA1D	46	36
COC(=O)c1cc(C)nc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450680164	FG	On-Demand	Bother	COLA	67	37
COC(=O)c1cc(C)nc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450680164	FG	On-Demand	Bother	CPT1A	63	37
COC(=O)c1cc(C)nc(N2CCC[C@H]2COc2ccccc2)c1[N+](=O)[O-]	ZINC000450680164	FG	On-Demand	Bother	CHRNA10	51	42
C[C@@]1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCO[C@@H]1C1CC1	ZINC000450680169	FF	On-Demand	Bother	CACNA1D	45	32
C[C@@]1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCO[C@H]1C1CC1	ZINC000450680170	FF	On-Demand	Bother	CACNA1D	45	32
C[C@]1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCO[C@H]1C1CC1	ZINC000450680171	FF	On-Demand	Bother	CACNA1D	45	32
C[C@]1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCO[C@@H]1C1CC1	ZINC000450680172	FF	On-Demand	Bother	CACNA1D	45	32
N#Cc1cc(N2CCC[C@H]2COc2ccccc2)cc(N)c1[N+](=O)[O-]	ZINC000450680177	EG	On-Demand	Mild	CHRNA10	66	43
COC[C@H]1CCCCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C1	ZINC000450680182	EE	On-Demand	Anodyne	DRD4	42	32
COC[C@@H]1CCCCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C1	ZINC000450680183	EE	On-Demand	Anodyne	DRD4	42	32
CO[C@H](Cc1ccccc1)C(=O)NC[C@]1(C)CCO[C@H]1C1CC1	ZINC000450680220	DF	On-Demand	Anodyne	TIMP3	56	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@]1(C)CCO[C@@H]1C1CC1	ZINC000450680221	DF	On-Demand	Anodyne	TIMP3	56	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@@]1(C)CCO[C@@H]1C1CC1	ZINC000450680222	DF	On-Demand	Anodyne	TIMP3	56	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@@]1(C)CCO[C@H]1C1CC1	ZINC000450680223	DF	On-Demand	Anodyne	TIMP3	56	35
CS[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450680228	CH	On-Demand	Anodyne	LUCI_LUCLA	19	45
CS[C@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450680229	CH	On-Demand	Anodyne	LUCI_LUCLA	19	45
COCC[C@@H]1CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450680236	FG	On-Demand	Bother	CACNA1C	49	38
COCC[C@@H]1CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450680236	FG	On-Demand	Bother	CACNA1D	82	38
COCC[C@H]1CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450680237	FG	On-Demand	Bother	CACNA1C	49	38
COCC[C@H]1CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450680237	FG	On-Demand	Bother	CACNA1D	82	38
COCc1ccc([C@@H]2CCCN2C(=O)Cc2cc(Br)ccc2C)o1	ZINC000450680238	GI	On-Demand	Anodyne	COLA	67	34
COCc1ccc([C@@H]2CCCN2C(=O)Cc2cc(Br)ccc2C)o1	ZINC000450680238	GI	On-Demand	Anodyne	CPT1A	63	34
COCc1ccc([C@H]2CCCN2C(=O)Cc2cc(Br)ccc2C)o1	ZINC000450680239	GI	On-Demand	Anodyne	COLA	67	34
COCc1ccc([C@H]2CCCN2C(=O)Cc2cc(Br)ccc2C)o1	ZINC000450680239	GI	On-Demand	Anodyne	CPT1A	63	34
COC[C@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450680240	EI	On-Demand	Anodyne	SLC6A3	21	47
COC[C@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450680240	EI	On-Demand	Anodyne	CCR5	33	46
COC[C@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450680240	EI	On-Demand	Anodyne	PREP	45	40
COC[C@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450680240	EI	On-Demand	Anodyne	ADAM10	43	39
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450680241	EI	On-Demand	Anodyne	SLC6A3	21	47
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450680241	EI	On-Demand	Anodyne	CCR5	33	46
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450680241	EI	On-Demand	Anodyne	PREP	45	40
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450680241	EI	On-Demand	Anodyne	ADAM10	43	39
CS[C@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450680251	CG	On-Demand	Anodyne	PDE3A	43	33
CS[C@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450680251	CG	On-Demand	Anodyne	PDE3B	64	36
CNC(=O)N[C@H]1CCN(C(=O)Cc2cc(Br)ccc2C)C1	ZINC000450680258	FD	On-Demand	Anodyne	EPHX2	28	45
C[C@@H](N[C@H](C)c1csnn1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450680266	EG	On-Demand	Anodyne	EPHX2	25	53
C[C@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1csnn1	ZINC000450680267	EG	On-Demand	Anodyne	EPHX2	25	53
C[C@H](N[C@@H](C)c1csnn1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450680268	EG	On-Demand	Anodyne	EPHX2	25	53
C[C@H](N[C@H](C)c1csnn1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000450680269	EG	On-Demand	Anodyne	EPHX2	25	53
CCOc1cccc([C@@H](C)NCc2ccn(CCc3ccccc3)n2)c1	ZINC000450680270	EI	On-Demand	Anodyne	PDS	62	40
CCOc1cccc([C@H](C)NCc2ccn(CCc3ccccc3)n2)c1	ZINC000450680271	EI	On-Demand	Anodyne	PDS	62	40
CCN(C)C(=O)[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450680292	GD	On-Demand	Bother	BCL2L1	86	38
CCN(C)C(=O)[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450680292	GD	On-Demand	Bother	BCL2	64	34
CCN(C)C(=O)[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450680292	GD	On-Demand	Bother	BCL2L2	42	30
O=C([C@H]1CC1(F)F)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450680294	EI	On-Demand	Anodyne	CACNA1B	44	31
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(Br)c(C)cc2C)C1	ZINC000450680301	FE	On-Demand	Anodyne	L3MBTL3	19	43
CCC(CC)[C@H]1C[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)CCO1	ZINC000450680305	FI	On-Demand	Anodyne	TIMP3	68	34
CCC(CC)[C@H]1C[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)CCO1	ZINC000450680306	FI	On-Demand	Anodyne	TIMP3	68	34
CCC(CC)[C@@H]1C[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)CCO1	ZINC000450680307	FI	On-Demand	Anodyne	TIMP3	68	34
CCC(CC)[C@@H]1C[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)CCO1	ZINC000450680308	FI	On-Demand	Anodyne	TIMP3	68	34
CNC(=O)N[C@H]1CCN(C(=O)c2cc(Br)c(C)cc2C)C1	ZINC000450680309	FE	On-Demand	Anodyne	L3MBTL3	19	43
CC(C)=CCC[C@@H](C)Nc1ncc([N+](=O)[O-])s1	ZINC000450680311	CH	On-Demand	Bother	MAPK9	0	46
CCN(CCO)CCNC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450680314	FF	On-Demand	Anodyne	AGER	0	40
CS[C@@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450680315	CG	On-Demand	Anodyne	PDE3A	43	33
CS[C@@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450680315	CG	On-Demand	Anodyne	PDE3B	64	36
CC(C)=CCC[C@H](C)Nc1ncc([N+](=O)[O-])s1	ZINC000450680322	CH	On-Demand	Bother	MAPK9	0	46
COC[C@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450680337	GF	On-Demand	Anodyne	PDGFRB	0	44
COC[C@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450680337	GF	On-Demand	Anodyne	CPT1A	47	34
COC[C@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450680337	GF	On-Demand	Anodyne	HPGD	43	55
COC[C@@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450680338	GF	On-Demand	Anodyne	PDGFRB	0	44
COC[C@@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450680338	GF	On-Demand	Anodyne	CPT1A	47	34
COC[C@@](C)(CCO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450680338	GF	On-Demand	Anodyne	HPGD	43	55
COC[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450680342	DF	On-Demand	Anodyne	AKR1C3	0	41
COC[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450680343	DF	On-Demand	Anodyne	AKR1C3	0	41
CCCOc1ccc(C(=O)N2CCCC[C@@H](CCOC)C2)c(OC)c1	ZINC000450680351	EH	On-Demand	Anodyne	OXTR	22	41
CCCOc1ccc(C(=O)N2CCCC[C@H](CCOC)C2)c(OC)c1	ZINC000450680352	EH	On-Demand	Anodyne	OXTR	22	41
COC[C@@H]1CCCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450680353	EG	On-Demand	Anodyne	PDEC	0	40
COC[C@H]1CCCCN(C(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450680354	EG	On-Demand	Anodyne	PDEC	0	40
N#Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1Cl	ZINC000450680359	DH	On-Demand	Mild	CASP3	43	37
N#Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1Cl	ZINC000450680359	DH	On-Demand	Mild	CHRNA10	83	48
CN1CCC(CCO)(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)CC1	ZINC000450680362	GD	On-Demand	Anodyne	TYRO3	29	40
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450680363	FI	On-Demand	Anodyne	SLC6A1	0	41
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450680363	FI	On-Demand	Anodyne	MC4R	17	40
CNC(=O)N[C@@H]1CCN(C(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC000450680368	DD	On-Demand	Anodyne	MTNR1A	27	43
CNC(=O)N[C@@H]1CCN(C(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC000450680368	DD	On-Demand	Anodyne	MTNR1B	0	43
CNC(=O)N[C@H]1CCN(C(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC000450680369	DD	On-Demand	Anodyne	MTNR1A	27	43
CNC(=O)N[C@H]1CCN(C(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC000450680369	DD	On-Demand	Anodyne	MTNR1B	0	43
CNC(=O)N[C@H]1CCN(C(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC000450680370	DD	On-Demand	Anodyne	MTNR1A	27	43
CNC(=O)N[C@H]1CCN(C(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC000450680370	DD	On-Demand	Anodyne	MTNR1B	0	43
CNC(=O)N[C@@H]1CCN(C(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC000450680371	DD	On-Demand	Anodyne	MTNR1A	27	43
CNC(=O)N[C@@H]1CCN(C(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC000450680371	DD	On-Demand	Anodyne	MTNR1B	0	43
O=C([C@H]1CC1(F)F)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450680379	EI	On-Demand	Anodyne	CACNA1B	44	31
O=C([C@@H]1CC1(F)F)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450680380	EI	On-Demand	Anodyne	CACNA1B	44	31
O=C([C@@H]1CC1(F)F)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450680382	EI	On-Demand	Anodyne	CACNA1B	44	31
COc1ccccc1-c1nnc(SCC2=CCCCC2)o1	ZINC000450680443	DI	On-Demand	Anodyne	GSK3A	43	36
COc1ccccc1-c1nnc(SCC2=CCCCC2)o1	ZINC000450680443	DI	On-Demand	Anodyne	TERT	23	40
COC(=O)c1cccc(CN[C@H](C(=O)N2CCOCC2)C(C)C)c1Cl	ZINC000450680455	FE	On-Demand	Anodyne	CCR1	40	38
COC(=O)c1cccc(CN[C@@H](C(=O)N2CCOCC2)C(C)C)c1Cl	ZINC000450680458	FE	On-Demand	Anodyne	CCR1	40	38
CN(C)[C@@H](CNC(=O)CC1CC(F)(F)C1)c1cccc(C(F)(F)F)c1	ZINC000450680467	FH	On-Demand	Anodyne	CCR2	57	38
CN(C)[C@H](CNC(=O)CC1CC(F)(F)C1)c1cccc(C(F)(F)F)c1	ZINC000450680469	FH	On-Demand	Anodyne	CCR2	57	38
N#Cc1cc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1C(F)(F)F	ZINC000450680507	EI	On-Demand	Mild	AR	18	44
N#Cc1cc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1C(F)(F)F	ZINC000450680510	EI	On-Demand	Mild	AR	18	44
N#Cc1cc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1C(F)(F)F	ZINC000450680514	EI	On-Demand	Mild	AR	18	44
COc1ccccc1-c1ccc([C@H](C)NCCC(C)(F)F)cc1	ZINC000450680516	DK	On-Demand	Anodyne	CASR	20	50
N#Cc1cc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1C(F)(F)F	ZINC000450680517	EI	On-Demand	Mild	AR	18	44
COc1ccccc1-c1ccc([C@@H](C)NCCC(C)(F)F)cc1	ZINC000450680519	DK	On-Demand	Anodyne	CASR	20	50
COC[C@@H]1CCCCN(C(=O)c2cc(O)ccc2F)C1	ZINC000450680536	CE	For-Sale	Anodyne	PARP1	42	36
COCc1cc(N[C@H](C)CC(C)(C)O)n2ncnc2n1	ZINC000450680537	CD	On-Demand	Anodyne	DHOD	0	42
COC[C@H]1CCCCN(C(=O)c2cc(O)ccc2F)C1	ZINC000450680547	CE	For-Sale	Anodyne	PARP1	42	36
COCc1cc(N[C@@H](C)CC(C)(C)O)n2ncnc2n1	ZINC000450680556	CD	On-Demand	Anodyne	DHOD	0	42
CCc1cccc(C(=O)Nc2cc(Br)ccc2OCCOC)n1	ZINC000450680573	GH	On-Demand	Anodyne	PDE5A	27	43
CC(=O)c1cn(CC(=O)N[C@H]2CCC[C@H](C(C)C)CC2)nn1	ZINC000450680577	DE	On-Demand	Anodyne	SCARB1	41	34
CC(=O)c1cn(CC(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)nn1	ZINC000450680578	DE	On-Demand	Anodyne	SCARB1	41	34
CC(=O)c1cn(CC(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)nn1	ZINC000450680579	DE	On-Demand	Anodyne	SCARB1	41	34
CC(=O)c1cn(CC(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)nn1	ZINC000450680580	DE	On-Demand	Anodyne	SCARB1	41	34
CNC(=O)N[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450680591	GE	On-Demand	Anodyne	PDE6D	92	40
CNC(=O)N[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450680591	GE	On-Demand	Anodyne	HDAC6	26	41
CNC(=O)N[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450680591	GE	On-Demand	Anodyne	SMO	24	40
CNC(=O)N[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450680591	GE	On-Demand	Anodyne	IMDH_CRYPV	30	45
CNC(=O)N[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450680594	GE	On-Demand	Anodyne	PDE6D	92	40
CNC(=O)N[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450680594	GE	On-Demand	Anodyne	HDAC6	26	41
CNC(=O)N[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450680594	GE	On-Demand	Anodyne	SMO	24	40
CNC(=O)N[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450680594	GE	On-Demand	Anodyne	IMDH_CRYPV	30	45
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C(C)[C@H]2C(=O)N2CC[C@@H](NC(=O)NC)C2)C1	ZINC000450680601	GA	On-Demand	Anodyne	MTNR1A	0	41
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C(C)[C@H]2C(=O)N2CC[C@@H](NC(=O)NC)C2)C1	ZINC000450680601	GA	On-Demand	Anodyne	EPHX2	25	46
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C(C)[C@H]2C(=O)N2CC[C@H](NC(=O)NC)C2)C1	ZINC000450680608	GA	On-Demand	Anodyne	MTNR1A	0	41
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C(C)[C@H]2C(=O)N2CC[C@H](NC(=O)NC)C2)C1	ZINC000450680608	GA	On-Demand	Anodyne	EPHX2	25	46
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2[C@H](C)[C@H]2C(=O)N2CC[C@@H](NC(=O)NC)C2)C1	ZINC000450680609	GA	On-Demand	Anodyne	MTNR1A	0	41
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2[C@H](C)[C@H]2C(=O)N2CC[C@@H](NC(=O)NC)C2)C1	ZINC000450680609	GA	On-Demand	Anodyne	EPHX2	25	46
COc1ccc(CNC(=O)CCN[C@@H](c2cnn(C)c2)C(C)(C)C)c(OC)c1	ZINC000450680622	GF	On-Demand	Anodyne	PDGFRB	35	45
COc1ccc(CNC(=O)CCN[C@@H](c2cnn(C)c2)C(C)(C)C)c(OC)c1	ZINC000450680622	GF	On-Demand	Anodyne	CSF1R	15	45
COc1ccc(CNC(=O)CCN[C@H](c2cnn(C)c2)C(C)(C)C)c(OC)c1	ZINC000450680624	GF	On-Demand	Anodyne	PDGFRB	35	45
COc1ccc(CNC(=O)CCN[C@H](c2cnn(C)c2)C(C)(C)C)c(OC)c1	ZINC000450680624	GF	On-Demand	Anodyne	CSF1R	15	45
Cc1c(C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)nn2c1OCCC2	ZINC000450680648	GI	On-Demand	Anodyne	CACNA1B	42	34
Cc1c(C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)nn2c1OCCC2	ZINC000450680649	GI	On-Demand	Anodyne	CACNA1B	42	34
CN(C)[C@@H](CNC(=O)c1nn(C)c2c1CCCC2)c1cccc(C(F)(F)F)c1	ZINC000450680650	GG	On-Demand	Anodyne	CCR2	49	35
CN(C)[C@H](CNC(=O)c1nn(C)c2c1CCCC2)c1cccc(C(F)(F)F)c1	ZINC000450680651	GG	On-Demand	Anodyne	CCR2	49	35
CS(=O)(=O)c1ccc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450680665	FH	On-Demand	Anodyne	PTGS2	21	42
CS(=O)(=O)c1ccc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450680667	FH	On-Demand	Anodyne	PTGS2	21	42
O=c1c2ccccc2nc(SCC2CC(F)(F)C2)n1C[C@H]1CCCO1	ZINC000450680675	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	30
O=c1c2ccccc2nc(SCC2CC(F)(F)C2)n1C[C@@H]1CCCO1	ZINC000450680677	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	30
CCC(CC)Oc1ccc(C(=O)N[C@@H](c2ccccc2)c2nc[nH]n2)cc1	ZINC000450680685	FH	On-Demand	Anodyne	SOAT1	17	46
CCC(CC)Oc1ccc(C(=O)N[C@@H](c2ccccc2)c2nc[nH]n2)cc1	ZINC000450680685	FH	On-Demand	Anodyne	PDS	45	34
CCC(CC)Oc1ccc(C(=O)N[C@H](c2ccccc2)c2nc[nH]n2)cc1	ZINC000450680688	FH	On-Demand	Anodyne	SOAT1	17	46
CCC(CC)Oc1ccc(C(=O)N[C@H](c2ccccc2)c2nc[nH]n2)cc1	ZINC000450680688	FH	On-Demand	Anodyne	PDS	45	34
COc1ccc(OCC2(C#N)CCC2)c([N+](=O)[O-])c1	ZINC000450680706	CF	On-Demand	Mild	TPPP	0	43
CS[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450680724	DH	On-Demand	Anodyne	RBP4	17	43
CS[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450680726	DH	On-Demand	Anodyne	RBP4	17	43
COCC[C@@H]1CCCCN(C(=O)c2cccc(SC)c2)C1	ZINC000450680737	DH	On-Demand	Anodyne	RHOA	0	45
COCC[C@H]1CCCCN(C(=O)c2cccc(SC)c2)C1	ZINC000450680740	DH	On-Demand	Anodyne	RHOA	0	45
Fc1ccc([C@H](Nc2ncc(C(F)F)cn2)C2CC2)cc1Cl	ZINC000450680748	EJ	On-Demand	Anodyne	MAPK1	42	36
Fc1ccc([C@@H](Nc2ncc(C(F)F)cn2)C2CC2)cc1Cl	ZINC000450680752	EJ	On-Demand	Anodyne	MAPK1	42	36
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450680761	EH	On-Demand	Anodyne	HNMT	42	32
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450680762	EH	On-Demand	Anodyne	HNMT	42	32
COc1cccc(-n2cc(C(=O)NC3(CCO)CCN(C)CC3)nn2)c1	ZINC000450680763	FC	On-Demand	Anodyne	DRD4	44	35
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450680764	EH	On-Demand	Anodyne	HNMT	42	32
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450680767	EH	On-Demand	Anodyne	HNMT	42	32
CCCC[C@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(OC)cc1	ZINC000450680772	FI	On-Demand	Anodyne	CYP51	0	40
CCc1cc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)n2ncnc2n1	ZINC000450680774	DE	On-Demand	Anodyne	DHOD	0	40
CCCC[C@@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(OC)cc1	ZINC000450680775	FI	On-Demand	Anodyne	CYP51	0	40
CS[C@H]1CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450680776	CG	On-Demand	Anodyne	SORD	43	40
CS[C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450680777	CG	On-Demand	Anodyne	SORD	43	40
CCc1cc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)n2ncnc2n1	ZINC000450680781	DE	On-Demand	Anodyne	DHOD	0	40
CCc1cc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)n2ncnc2n1	ZINC000450680783	DE	On-Demand	Anodyne	DHOD	0	40
CCc1cc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)n2ncnc2n1	ZINC000450680784	DE	On-Demand	Anodyne	DHOD	0	40
CC(C)(C)c1cc(CSc2nnc(-c3ccccc3Br)o2)no1	ZINC000450680785	GK	On-Demand	Anodyne	TERT	25	41
CC[C@H](NCc1cccc(C(=O)OC)c1Cl)c1cccc([N+](=O)[O-])c1	ZINC000450680793	FI	On-Demand	Bother	CACNA1C	64	40
CC[C@H](NCc1cccc(C(=O)OC)c1Cl)c1cccc([N+](=O)[O-])c1	ZINC000450680793	FI	On-Demand	Bother	CACNA1D	98	39
CC[C@H](NCc1cccc(C(=O)OC)c1Cl)c1cccc([N+](=O)[O-])c1	ZINC000450680793	FI	On-Demand	Bother	PDS	17	40
CC[C@@H](NCc1cccc(C(=O)OC)c1Cl)c1cccc([N+](=O)[O-])c1	ZINC000450680801	FI	On-Demand	Bother	CACNA1C	64	40
CC[C@@H](NCc1cccc(C(=O)OC)c1Cl)c1cccc([N+](=O)[O-])c1	ZINC000450680801	FI	On-Demand	Bother	CACNA1D	98	39
CC[C@@H](NCc1cccc(C(=O)OC)c1Cl)c1cccc([N+](=O)[O-])c1	ZINC000450680801	FI	On-Demand	Bother	PDS	17	40
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450680806	DH	On-Demand	Anodyne	SLC6A1	33	44
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450680806	DH	On-Demand	Anodyne	SLC6A3	19	46
COC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450680809	DH	On-Demand	Anodyne	SLC6A1	33	44
COC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450680809	DH	On-Demand	Anodyne	SLC6A3	20	46
COC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450680809	DH	On-Demand	Anodyne	CCR5	35	46
COC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450680809	DH	On-Demand	Anodyne	ADAM10	40	38
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450680811	DH	On-Demand	Anodyne	SLC6A1	33	44
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450680811	DH	On-Demand	Anodyne	SLC6A3	19	46
COC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450680813	DH	On-Demand	Anodyne	SLC6A1	33	44
COC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450680813	DH	On-Demand	Anodyne	SLC6A3	20	46
COC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450680813	DH	On-Demand	Anodyne	CCR5	35	46
COC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450680813	DH	On-Demand	Anodyne	ADAM10	40	38
C[C@]1(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO[C@@H]1C1CC1	ZINC000450680815	FI	On-Demand	Anodyne	RBP4	71	37
COc1ccc(CC(=O)NCc2nc3cc(C)ccc3n2C)c(Cl)c1OC	ZINC000450680816	GG	On-Demand	Anodyne	CPT1A	43	30
C[C@@]1(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO[C@H]1C1CC1	ZINC000450680817	FI	On-Demand	Anodyne	RBP4	71	37
NC(=O)c1csc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1	ZINC000450680819	EH	On-Demand	Anodyne	TRPC6	48	39
C[C@]1(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO[C@H]1C1CC1	ZINC000450680820	FI	On-Demand	Anodyne	RBP4	71	37
NC(=O)c1csc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)n1	ZINC000450680821	EH	On-Demand	Anodyne	TRPC6	48	39
C[C@@]1(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO[C@@H]1C1CC1	ZINC000450680822	FI	On-Demand	Anodyne	RBP4	71	37
C[C@@H](O)CCCN[C@@H](COc1ccccc1)c1ccccc1	ZINC000450680824	CH	On-Demand	Anodyne	ADRB2	19	48
C[C@@H](O)CCCN[C@@H](COc1ccccc1)c1ccccc1	ZINC000450680824	CH	On-Demand	Anodyne	GPR88	0	41
C[C@H](O)CCCN[C@@H](COc1ccccc1)c1ccccc1	ZINC000450680825	CH	On-Demand	Anodyne	GPR88	0	41
C[C@H](O)CCCN[C@H](COc1ccccc1)c1ccccc1	ZINC000450680826	CH	On-Demand	Anodyne	GPR88	0	41
C[C@@H](O)CCCN[C@H](COc1ccccc1)c1ccccc1	ZINC000450680827	CH	On-Demand	Anodyne	ADRB2	19	48
C[C@@H](O)CCCN[C@H](COc1ccccc1)c1ccccc1	ZINC000450680827	CH	On-Demand	Anodyne	GPR88	0	41
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450680866	FF	On-Demand	Bother	CASP3	57	39
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450680866	FF	On-Demand	Bother	CHRNA10	51	42
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1	ZINC000450680866	FF	On-Demand	Bother	CASP7	51	39
COC[C@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450680867	EF	On-Demand	Anodyne	COLA	115	39
COC[C@@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450680868	EF	On-Demand	Anodyne	COLA	115	39
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCCO1	ZINC000450680880	EG	On-Demand	Anodyne	TIMP3	62	37
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCCO1	ZINC000450680880	EG	On-Demand	Anodyne	SLC12A5	46	33
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCCO1	ZINC000450680881	EG	On-Demand	Anodyne	TIMP3	62	37
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCCO1	ZINC000450680881	EG	On-Demand	Anodyne	SLC12A5	46	33
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCCO1	ZINC000450680882	EG	On-Demand	Anodyne	TIMP3	62	37
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCCO1	ZINC000450680882	EG	On-Demand	Anodyne	SLC12A5	46	33
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCCO1	ZINC000450680883	EG	On-Demand	Anodyne	TIMP3	62	37
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCCO1	ZINC000450680883	EG	On-Demand	Anodyne	SLC12A5	46	33
COC1(CSc2nnc(-c3ccccc3Br)o2)CCC1	ZINC000450680894	FI	On-Demand	Anodyne	ALOX15	50	37
Fc1ccccc1OC[C@H](NCc1cn(CC2CC2)nn1)c1ccccc1	ZINC000450680911	FH	On-Demand	Anodyne	MAN1B1	25	41
Fc1ccccc1OC[C@@H](NCc1cn(CC2CC2)nn1)c1ccccc1	ZINC000450680912	FH	On-Demand	Anodyne	MAN1B1	25	41
COC[C@]1(C(=O)OC)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450680919	GD	On-Demand	Anodyne	HTR3A	31	46
COC[C@@]1(C(=O)OC)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450680922	GD	On-Demand	Anodyne	HTR3A	31	46
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(OC)ccc2OC(F)(F)F)C1	ZINC000450680971	FD	On-Demand	Anodyne	EPHX2	50	44
CNC(=O)N[C@H]1CCN(C(=O)c2cc(OC)ccc2OC(F)(F)F)C1	ZINC000450680979	FD	On-Demand	Anodyne	EPHX2	50	44
COCC1(O)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450681001	DD	On-Demand	Anodyne	PDE3A	42	32
COCC1(O)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450681001	DD	On-Demand	Anodyne	PDGFRB	36	41
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1nc2cnccc2[nH]1	ZINC000450681014	GG	On-Demand	Anodyne	PARP3	24	41
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1nc2cnccc2[nH]1	ZINC000450681016	GG	On-Demand	Anodyne	PARP3	24	41
CN(C)[C@H](CNC(=O)C(C)(C)C(C)(F)F)c1cccc(C(F)(F)F)c1	ZINC000450681032	FI	On-Demand	Anodyne	PHES	0	40
CN(C)[C@@H](CNC(=O)C(C)(C)C(C)(F)F)c1cccc(C(F)(F)F)c1	ZINC000450681035	FI	On-Demand	Anodyne	PHES	0	40
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450681050	FE	On-Demand	Anodyne	RBP4	96	43
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450681050	FE	On-Demand	Anodyne	SFRP1	102	34
CNC(=O)N[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450681050	FE	On-Demand	Anodyne	WNT3	79	34
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450681051	FE	On-Demand	Anodyne	RBP4	96	43
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450681051	FE	On-Demand	Anodyne	SFRP1	102	34
CNC(=O)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450681051	FE	On-Demand	Anodyne	WNT3	79	34
C[C@@H](O)CCCNC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000450681057	DH	On-Demand	Anodyne	CTSD	15	42
C[C@@H](O)CCCNC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000450681057	DH	On-Demand	Anodyne	BACE1	16	42
C[C@H](O)CCCNC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000450681058	DH	On-Demand	Anodyne	CTSD	15	42
C[C@H](O)CCCNC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000450681058	DH	On-Demand	Anodyne	BACE1	16	42
CN1CCC[C@@H](C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)C1=O	ZINC000450681065	FH	On-Demand	Anodyne	TACR1	20	42
CN1CCC[C@H](C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)C1=O	ZINC000450681066	FH	On-Demand	Anodyne	TACR1	20	42
CN1CCC[C@@H](C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)C1=O	ZINC000450681067	FH	On-Demand	Anodyne	TACR1	20	42
CN1CCC[C@H](C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)C1=O	ZINC000450681069	FH	On-Demand	Anodyne	TACR1	20	42
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)n1	ZINC000450681070	GI	On-Demand	Anodyne	COLA	108	43
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)n1	ZINC000450681070	GI	On-Demand	Anodyne	CPT1A	104	43
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)n1	ZINC000450681072	GI	On-Demand	Anodyne	COLA	108	43
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)n1	ZINC000450681072	GI	On-Demand	Anodyne	CPT1A	104	43
CN(C)[C@H](CNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12)c1cccc(C(F)(F)F)c1	ZINC000450681076	FH	On-Demand	Anodyne	CCR2	43	36
CN(C)[C@H](CNC(=O)C[C@@H]1CC[C@H]2C[C@H]12)c1cccc(C(F)(F)F)c1	ZINC000450681077	FH	On-Demand	Anodyne	CCR2	43	36
CN(C)[C@H](CNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12)c1cccc(C(F)(F)F)c1	ZINC000450681078	FH	On-Demand	Anodyne	CCR2	43	36
CN(C)[C@H](CNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12)c1cccc(C(F)(F)F)c1	ZINC000450681079	FH	On-Demand	Anodyne	CCR2	43	36
CC(C)O[C@]1(C(=O)N[C@H](CO)c2ccccc2)CCOC1	ZINC000450681081	CD	On-Demand	Anodyne	GPR88	0	43
CC(C)O[C@@]1(C(=O)N[C@H](CO)c2ccccc2)CCOC1	ZINC000450681082	CD	On-Demand	Anodyne	GPR88	0	43
CCN(C)C(=O)[C@@H](Nc1ccc2ccc(F)cc2n1)C(C)C	ZINC000450681083	DG	On-Demand	Anodyne	MTTP	41	35
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)Cc1ccccc1	ZINC000450681084	FH	On-Demand	Anodyne	TIMP3	49	33
CO[C@@H](CN[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)Cc1ccccc1	ZINC000450681084	FH	On-Demand	Anodyne	EPHX2	46	41
CO[C@H](CN[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)Cc1ccccc1	ZINC000450681085	FH	On-Demand	Anodyne	TIMP3	49	33
CO[C@H](CN[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)Cc1ccccc1	ZINC000450681085	FH	On-Demand	Anodyne	EPHX2	46	41
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)Cc1ccccc1	ZINC000450681086	FH	On-Demand	Anodyne	TIMP3	49	33
CO[C@@H](CN[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)Cc1ccccc1	ZINC000450681086	FH	On-Demand	Anodyne	EPHX2	46	41
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)Cc1ccccc1	ZINC000450681087	FH	On-Demand	Anodyne	TIMP3	49	33
CO[C@H](CN[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)Cc1ccccc1	ZINC000450681087	FH	On-Demand	Anodyne	EPHX2	46	41
COc1cc(CN[C@H](C)c2ccc(OC)c(OC)c2)ccc1Cl	ZINC000450681088	EI	On-Demand	Anodyne	MT-ND1	18	41
COc1cc(CN[C@@H](C)c2ccc(OC)c(OC)c2)ccc1Cl	ZINC000450681089	EI	On-Demand	Anodyne	MT-ND1	18	41
CN(C)C(=O)C[C@H](NCC1CC(F)(F)C1)c1ccccc1	ZINC000450681096	CF	On-Demand	Anodyne	MAN1B1	44	31
CN(C)C(=O)C[C@@H](NCC1CC(F)(F)C1)c1ccccc1	ZINC000450681097	CF	On-Demand	Anodyne	MAN1B1	44	31
CO[C@H](CSc1nnc(-c2ccc(C)cc2)o1)Cc1ccccc1	ZINC000450681101	EI	On-Demand	Anodyne	GSK3B	20	47
CO[C@H](CSc1nnc(-c2ccc(C)cc2)o1)Cc1ccccc1	ZINC000450681101	EI	On-Demand	Anodyne	GSK3A	46	44
CO[C@H](CSc1nnc(-c2ccc(C)cc2)o1)Cc1ccccc1	ZINC000450681101	EI	On-Demand	Anodyne	TERT	23	42
CO[C@@H](CSc1nnc(-c2ccc(C)cc2)o1)Cc1ccccc1	ZINC000450681102	EI	On-Demand	Anodyne	GSK3B	20	47
CO[C@@H](CSc1nnc(-c2ccc(C)cc2)o1)Cc1ccccc1	ZINC000450681102	EI	On-Demand	Anodyne	GSK3A	46	44
CO[C@@H](CSc1nnc(-c2ccc(C)cc2)o1)Cc1ccccc1	ZINC000450681102	EI	On-Demand	Anodyne	TERT	23	42
CC#CCCNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450681107	CD	On-Demand	Mild	PTGER3	18	41
O=S(=O)(NCC1CC1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450681108	ED	On-Demand	Anodyne	NPY2R	45	37
CCC[C@@](C)(CO)NC(=O)c1cnn2ccc(C)cc12	ZINC000450681109	CD	On-Demand	Anodyne	EPHB3	35	50
CCC[C@](C)(CO)NC(=O)c1cnn2ccc(C)cc12	ZINC000450681110	CD	On-Demand	Anodyne	EPHB3	35	50
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	MAPK14	15	42
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	TRPV1	17	44
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	PRNP	62	43
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	HDAC1	24	43
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	P4HTM	0	52
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	MCHR1	23	49
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	DGAT2	0	41
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	DGAT1	56	48
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	HSPB1	0	41
Cc1ccc(NC(=O)c2ccc(N3CCC(CF)CC3)nc2)cc1	ZINC000450681121	EH	On-Demand	Anodyne	HPGDS	33	44
Cc1[nH]c(C#N)cc1C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450681141	EG	On-Demand	Mild	HCN1	50	31
Cc1[nH]c(C#N)cc1C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450681141	EG	On-Demand	Mild	HCN4	48	31
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450681144	EG	On-Demand	Anodyne	AVPR1A	0	47
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450681145	EG	On-Demand	Anodyne	AVPR1A	0	47
COC(=O)c1ccc(CN[C@H](c2ccccc2)C2CC2)cc1Cl	ZINC000450681169	EI	On-Demand	Anodyne	ADRB3	42	35
COC(=O)c1ccc(CN[C@@H](c2ccccc2)C2CC2)cc1Cl	ZINC000450681170	EI	On-Demand	Anodyne	ADRB3	42	35
Cc1ccccc1CNc1ccccc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450681174	EG	On-Demand	Anodyne	P2RX7	40	52
Cc1ccccc1CNc1ccccc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450681174	EG	On-Demand	Anodyne	CCR8	49	33
Cc1ccccc1CNc1ccccc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450681175	EG	On-Demand	Anodyne	P2RX7	40	52
Cc1ccccc1CNc1ccccc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450681175	EG	On-Demand	Anodyne	CCR8	49	33
CCN(C)C(=O)[C@@H](Nc1ncnc2cc(Cl)ccc12)C(C)C	ZINC000450681200	DG	On-Demand	Anodyne	RBP_CHICK	0	41
C[C@@H](NC[C@@H]1COCCO1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450681202	FG	On-Demand	Anodyne	CXCR2	0	45
C[C@H](NC[C@@H]1COCCO1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450681203	FG	On-Demand	Anodyne	CXCR2	0	45
C[C@@H](NC[C@H]1COCCO1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450681204	FG	On-Demand	Anodyne	CXCR2	0	45
C[C@H](NC[C@H]1COCCO1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000450681205	FG	On-Demand	Anodyne	CXCR2	0	45
CNC(=O)N[C@@H]1CCN(C(=O)c2cc(OC)c(OC)cc2Br)C1	ZINC000450681206	GD	On-Demand	Anodyne	HTR4	41	37
CNC(=O)N[C@H]1CCN(C(=O)c2cc(OC)c(OC)cc2Br)C1	ZINC000450681208	GD	On-Demand	Anodyne	HTR4	41	37
O=C1CC[C@H](CN[C@H](CC(F)(F)F)c2ccccc2)CCN1	ZINC000450681217	DG	On-Demand	Anodyne	MAN1B1	50	31
O=C1CC[C@H](CN[C@@H](CC(F)(F)F)c2ccccc2)CCN1	ZINC000450681218	DG	On-Demand	Anodyne	MAN1B1	50	31
CCC[C@@](C)(CO)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450681219	CD	On-Demand	Anodyne	CAN2	0	44
CCC[C@](C)(CO)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450681220	CD	On-Demand	Anodyne	CAN2	0	44
O=C1CC[C@@H](CN[C@@H](CC(F)(F)F)c2ccccc2)CCN1	ZINC000450681221	DG	On-Demand	Anodyne	MAN1B1	50	31
O=C1CC[C@@H](CN[C@H](CC(F)(F)F)c2ccccc2)CCN1	ZINC000450681223	DG	On-Demand	Anodyne	MAN1B1	50	31
Cc1ccccc1CNc1ccccc1NC(=O)CCCC(=O)C1CC1	ZINC000450681231	FJ	On-Demand	Anodyne	CCR8	41	32
c1ccc(OC2CC2)c(CNC2(c3ccc4c(c3)OCO4)CC2)c1	ZINC000450681239	DH	On-Demand	Anodyne	SCN9A	0	41
CC(=O)CCCCCSc1n[nH]c(-c2ccccc2Br)n1	ZINC000450681246	FI	On-Demand	Anodyne	HDA106	0	40
Cc1cc(N2CCC[C@H]2COc2ccccc2)ccn1	ZINC000450681256	CG	On-Demand	Anodyne	CASP3	50	39
Cc1cc(N2CCC[C@H]2COc2ccccc2)ccn1	ZINC000450681256	CG	On-Demand	Anodyne	CHRNA10	81	56
COC[C@H]1CCCCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)C1	ZINC000450681261	EE	On-Demand	Anodyne	RIR1_HHV11	47	33
COC[C@@H]1CCCCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)C1	ZINC000450681262	EE	On-Demand	Anodyne	RIR1_HHV11	47	33
CSc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450681263	DG	On-Demand	Anodyne	CASP3	49	38
CSc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450681263	DG	On-Demand	Anodyne	CHRNA10	70	51
CSc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450681263	DG	On-Demand	Anodyne	CASP7	40	38
COCC[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450681270	EI	On-Demand	Anodyne	CACNA1B	42	35
COCC[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450681270	EI	On-Demand	Anodyne	LIPG	54	42
COCC[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450681272	EI	On-Demand	Anodyne	CACNA1B	42	35
COCC[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450681272	EI	On-Demand	Anodyne	LIPG	54	42
COc1ccccc1-c1nnc(SCc2cn(C)nc2C)o1	ZINC000450681308	DG	On-Demand	Anodyne	ALOX15	48	35
CC(=O)c1nc(N2CCC[C@H]2COc2ccccc2)sc1C	ZINC000450681311	DH	On-Demand	Anodyne	COLA	69	36
CC(=O)c1nc(N2CCC[C@H]2COc2ccccc2)sc1C	ZINC000450681311	DH	On-Demand	Anodyne	CPT1A	66	34
CC(=O)c1nc(N2CCC[C@H]2COc2ccccc2)sc1C	ZINC000450681311	DH	On-Demand	Anodyne	CHRNA10	68	48
Cc1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450681316	CG	On-Demand	Anodyne	CASP3	59	41
Cc1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450681316	CG	On-Demand	Anodyne	CHRNA10	74	56
Cc1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450681316	CG	On-Demand	Anodyne	CASP7	43	40
COCC[C@@H]1CCCCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450681334	GH	On-Demand	Anodyne	HRH3	20	40
COCC[C@H]1CCCCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450681336	GH	On-Demand	Anodyne	HRH3	20	40
COc1cc(C(C)=O)ccc1OCCC[C@H](C)O	ZINC000450681341	CE	On-Demand	Anodyne	THRA	0	44
COc1cc(C(C)=O)ccc1OCCC[C@H](C)O	ZINC000450681341	CE	On-Demand	Anodyne	GRM2	0	50
COc1cc(C(C)=O)ccc1OCCC[C@@H](C)O	ZINC000450681343	CE	On-Demand	Anodyne	THRA	0	44
COc1cc(C(C)=O)ccc1OCCC[C@@H](C)O	ZINC000450681343	CE	On-Demand	Anodyne	GRM2	0	50
COC[C@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450681347	FF	On-Demand	Anodyne	HDAC8	24	40
COC[C@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450681347	FF	On-Demand	Anodyne	IMDH_CRYPV	34	52
COC[C@@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450681349	FF	On-Demand	Anodyne	HDAC8	24	40
COC[C@@](C)(CCO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450681349	FF	On-Demand	Anodyne	IMDH_CRYPV	34	52
COC[C@@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681357	GH	On-Demand	Anodyne	HRH1	44	41
COC[C@@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681357	GH	On-Demand	Anodyne	PDE6D	105	44
COC[C@@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681357	GH	On-Demand	Anodyne	COLA	103	38
COC[C@@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681357	GH	On-Demand	Anodyne	CPT1A	98	38
COC[C@@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681357	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	54	33
COC[C@@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681357	GH	On-Demand	Anodyne	IMDH_CRYPV	29	43
OCCC[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450681359	DH	On-Demand	Anodyne	METAP1	46	40
OCCC[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450681360	DH	On-Demand	Anodyne	METAP1	46	40
CCN(CCO)CCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450681366	FE	On-Demand	Anodyne	AVPR1B	38	45
CCN(CCO)CCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450681366	FE	On-Demand	Anodyne	PDE6D	64	37
CCN(CCO)CCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450681366	FE	On-Demand	Anodyne	HDAC8	16	46
CCN(CCO)CCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450681366	FE	On-Demand	Anodyne	IMDH_CRYPV	36	52
COC[C@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681371	GH	On-Demand	Anodyne	HRH1	44	41
COC[C@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681371	GH	On-Demand	Anodyne	PDE6D	105	44
COC[C@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681371	GH	On-Demand	Anodyne	COLA	103	38
COC[C@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681371	GH	On-Demand	Anodyne	CPT1A	98	38
COC[C@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681371	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	54	33
COC[C@H]1CCCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450681371	GH	On-Demand	Anodyne	IMDH_CRYPV	29	43
CO[C@@H]1COC[C@H]1N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000450681376	CD	On-Demand	Anodyne	AMP1_PLAFQ	52	36
CO[C@@H]1COC[C@H]1N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000450681377	CD	On-Demand	Anodyne	AMP1_PLAFQ	52	36
COC[C@@H]1CCCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450681386	EF	On-Demand	Anodyne	PDEC	0	44
COC[C@H]1CCCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450681387	EF	On-Demand	Anodyne	PDEC	0	44
COC[C@@H]1CCCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450681388	EF	On-Demand	Anodyne	PDEC	0	44
COC[C@H]1CCCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450681390	EF	On-Demand	Anodyne	PDEC	0	44
COC[C@@]1(C(=O)OC)CCN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450681425	FD	On-Demand	Anodyne	PDGFRB	49	35
COC[C@]1(C(=O)OC)CCN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450681427	FD	On-Demand	Anodyne	PDGFRB	49	35
COC(=O)c1csc(COc2ccc(C(C)=O)cc2OC)n1	ZINC000450681438	DF	On-Demand	Anodyne	ENPP1	40	30
COc1ccccc1OCc1ccc(C(=O)NC2(CCO)CCN(C)CC2)o1	ZINC000450681441	GE	On-Demand	Anodyne	HCN1	40	37
C[C@@H]1CCO[C@@H]1C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450681458	EI	On-Demand	Anodyne	CACNA1B	43	30
COC[C@H]1CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450681461	EF	On-Demand	Bother	CACNA1C	52	40
COC[C@H]1CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450681461	EF	On-Demand	Bother	CACNA1D	85	40
COC[C@@H]1CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450681462	EF	On-Demand	Bother	CACNA1C	52	40
COC[C@@H]1CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450681462	EF	On-Demand	Bother	CACNA1D	85	40
COCc1ccc([C@H]2CCCN2C(=O)c2cn(-c3cccc(OC)c3)nn2)o1	ZINC000450681467	GF	On-Demand	Anodyne	COLA	90	37
COCc1ccc([C@H]2CCCN2C(=O)c2cn(-c3cccc(OC)c3)nn2)o1	ZINC000450681467	GF	On-Demand	Anodyne	CPT1A	85	37
COCc1ccc([C@@H]2CCCN2C(=O)c2cn(-c3cccc(OC)c3)nn2)o1	ZINC000450681468	GF	On-Demand	Anodyne	COLA	90	37
COCc1ccc([C@@H]2CCCN2C(=O)c2cn(-c3cccc(OC)c3)nn2)o1	ZINC000450681468	GF	On-Demand	Anodyne	CPT1A	85	37
C[C@@H]1CCO[C@@H]1C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450681469	EI	On-Demand	Anodyne	CACNA1B	43	30
COC(=O)C1(CN[C@@H](C)c2ccc(-c3ccncc3)cc2)CC1	ZINC000450681490	DG	On-Demand	Anodyne	ACACA	51	37
COC(=O)C1(CN[C@H](C)c2ccc(-c3ccncc3)cc2)CC1	ZINC000450681492	DG	On-Demand	Anodyne	ACACA	51	37
Cc1nn(C)cc1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450681495	FI	On-Demand	Anodyne	COLA	66	41
Cc1nn(C)cc1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450681495	FI	On-Demand	Anodyne	CPT1A	64	41
Cc1nn(C)cc1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450681496	FI	On-Demand	Anodyne	COLA	66	41
Cc1nn(C)cc1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450681496	FI	On-Demand	Anodyne	CPT1A	64	41
C[C@H]1C[C@]1(C#N)C(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450681497	DH	On-Demand	Mild	SRD5A2	19	43
C[C@@H]1C[C@]1(C#N)C(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450681498	DH	On-Demand	Mild	SRD5A2	19	43
C[C@H]1C[C@@]1(C#N)C(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450681499	DH	On-Demand	Mild	SRD5A2	19	43
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450681500	DH	On-Demand	Mild	SRD5A2	19	43
COCC1(O)CN(c2c(C#N)cccc2C#N)C1	ZINC000450681510	BC	On-Demand	Mild	TRPV4	41	31
O=C(CC1CC(F)(F)C1)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450681531	FK	On-Demand	Anodyne	CPT1A	56	43
O=C(CC1CC(F)(F)C1)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450681534	FK	On-Demand	Anodyne	CPT1A	56	43
CCC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450681535	DH	On-Demand	Anodyne	SIGMAR1	17	48
Cc1cc(C(=O)N[C@H]2CCC[C@H](C(C)C)CC2)ncc1C(N)=O	ZINC000450681536	DF	On-Demand	Anodyne	MAPK13	55	37
Cc1cc(C(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)ncc1C(N)=O	ZINC000450681537	DF	On-Demand	Anodyne	MAPK13	55	37
Cc1cc(C(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)ncc1C(N)=O	ZINC000450681539	DF	On-Demand	Anodyne	MAPK13	55	37
CCC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450681540	DH	On-Demand	Anodyne	SIGMAR1	17	48
Cc1cc(C(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)ncc1C(N)=O	ZINC000450681541	DF	On-Demand	Anodyne	MAPK13	55	37
CCC[C@@H]1CCC[C@H]1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450681543	DH	On-Demand	Anodyne	SIGMAR1	17	48
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450681555	DE	On-Demand	Mild	AVPR1A	23	49
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450681556	DE	On-Demand	Mild	AVPR1A	23	49
CNS(=O)(=O)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450681561	CD	On-Demand	Anodyne	GCKR	25	43
COc1ccccc1[C@H](CNC(=O)c1cc2ccncc2s1)OC(C)C	ZINC000450681562	FI	On-Demand	Anodyne	SELE	44	34
COc1ccccc1[C@H](CNC(=O)c1cc2ccncc2s1)OC(C)C	ZINC000450681562	FI	On-Demand	Anodyne	ICAM1	42	34
COc1ccccc1[C@H](CNC(=O)c1cc2ccncc2s1)OC(C)C	ZINC000450681562	FI	On-Demand	Anodyne	VCAM1	45	32
COc1ccccc1[C@@H](CNC(=O)c1cc2ccncc2s1)OC(C)C	ZINC000450681563	FI	On-Demand	Anodyne	SELE	44	34
COc1ccccc1[C@@H](CNC(=O)c1cc2ccncc2s1)OC(C)C	ZINC000450681563	FI	On-Demand	Anodyne	ICAM1	42	34
COc1ccccc1[C@@H](CNC(=O)c1cc2ccncc2s1)OC(C)C	ZINC000450681563	FI	On-Demand	Anodyne	VCAM1	45	32
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CC=C(c2c(F)cccc2F)CC1	ZINC000450681564	GH	On-Demand	Anodyne	PREP	87	59
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CC=C(c2c(F)cccc2F)CC1	ZINC000450681564	GH	On-Demand	Anodyne	SFRP1	42	41
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CC=C(c2c(F)cccc2F)CC1	ZINC000450681564	GH	On-Demand	Anodyne	WNT3	47	41
O=C(NCC1(CCOCc2ccccc2)CC1)c1cc2ccncc2s1	ZINC000450681572	FI	On-Demand	Anodyne	NAMPT	16	52
COc1ccc(Nc2cc(N3CCC(CF)CC3)ncn2)c(OC)c1	ZINC000450681576	EG	On-Demand	Anodyne	PDE3B	67	38
COc1ccc(Nc2cc(N3CCC(CF)CC3)ncn2)c(OC)c1	ZINC000450681576	EG	On-Demand	Anodyne	GALR2	44	37
CCC[C@@](C)(CO)NC(=O)c1cccc(CC)n1	ZINC000450681619	CD	On-Demand	Anodyne	PDE5A	18	43
CCC[C@](C)(CO)NC(=O)c1cccc(CC)n1	ZINC000450681620	CD	On-Demand	Anodyne	PDE5A	18	43
COc1ccccc1-n1cnc2cc(C(=O)NC3(CO)CCOCC3)ccc21	ZINC000450681633	GE	On-Demand	Anodyne	PDGFRB	16	45
COc1ccccc1-n1cnc2cc(C(=O)NC3(CO)CCOCC3)ccc21	ZINC000450681633	GE	On-Demand	Anodyne	CPT1A	46	33
COc1ccccc1-n1cnc2cc(C(=O)NC3(CO)CCOCC3)ccc21	ZINC000450681633	GE	On-Demand	Anodyne	HPGD	46	56
OCc1ccnc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)n1	ZINC000450681640	DG	On-Demand	Anodyne	MAPK1	66	39
OCc1ccnc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1	ZINC000450681641	DG	On-Demand	Anodyne	MAPK1	66	39
O=C(CNC(=O)c1c(Cl)cc(F)cc1Br)NCC1CC1	ZINC000450681643	FE	On-Demand	Anodyne	CACNA1I	62	36
COc1cc(CC(=O)NCc2nc3cc(C)ccc3n2C)ccc1Cl	ZINC000450681655	FG	On-Demand	Anodyne	PTGS2	0	40
COc1cc(CC(=O)NCc2nc3cc(C)ccc3n2C)ccc1Cl	ZINC000450681655	FG	On-Demand	Anodyne	TRPV1	25	43
COc1cc(CC(=O)NCc2nc3cc(C)ccc3n2C)ccc1Cl	ZINC000450681655	FG	On-Demand	Anodyne	PTGES	15	41
CS[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450681687	CH	On-Demand	Anodyne	HRP1_PLAFA	100	37
CS[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450681687	CH	On-Demand	Anodyne	HNMT	51	36
CS[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450681689	CH	On-Demand	Anodyne	HRP1_PLAFA	100	37
CS[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450681689	CH	On-Demand	Anodyne	HNMT	51	36
Cc1ccnc(N2CCC[C@H]2COc2ccccc2)c1C#N	ZINC000450681706	CG	On-Demand	Mild	CHRNA10	69	51
CS[C@@H]1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450681708	FE	On-Demand	Bother	SLC6A9	15	42
CS[C@@H]1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450681708	FE	On-Demand	Bother	L3MBTL3	17	42
CS[C@H]1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450681709	FE	On-Demand	Bother	SLC6A9	15	42
CS[C@H]1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450681709	FE	On-Demand	Bother	L3MBTL3	17	42
COC[C@@H]1CCCCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450681710	DG	On-Demand	Anodyne	CCR3	52	33
COC[C@@H]1CCCCN(C(=O)[C@H](C)OCc2ccc(F)cc2)C1	ZINC000450681711	DG	On-Demand	Anodyne	CCR3	52	33
COC[C@H]1CCCCN(C(=O)[C@H](C)OCc2ccc(F)cc2)C1	ZINC000450681712	DG	On-Demand	Anodyne	CCR3	52	33
COC[C@H]1CCCCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450681713	DG	On-Demand	Anodyne	CCR3	52	33
FC(F)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450681720	DG	On-Demand	Anodyne	CASP3	49	37
FC(F)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450681720	DG	On-Demand	Anodyne	CHRNA10	71	52
FC(F)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450681720	DG	On-Demand	Anodyne	CASP7	44	37
N#Cc1cnc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)cn1	ZINC000450681782	DH	On-Demand	Mild	CHEK1	15	40
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)o1	ZINC000450681783	GJ	On-Demand	Anodyne	RBP4	76	36
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)o1	ZINC000450681783	GJ	On-Demand	Anodyne	WNT3	40	31
CC(C)c1nnc(CSc2nnc(-c3ccccc3Br)o2)s1	ZINC000450681784	GJ	On-Demand	Anodyne	TERT	17	40
N#Cc1cnc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)cn1	ZINC000450681785	DH	On-Demand	Mild	CHEK1	15	40
CCN(CCO)CCNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450681786	FD	On-Demand	Anodyne	DRD4	45	34
CCN(CCO)CCNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450681786	FD	On-Demand	Anodyne	MTNR1A	49	42
CCN(CCO)CCNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450681786	FD	On-Demand	Anodyne	MTNR1B	47	43
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450681795	CF	On-Demand	Anodyne	BIRC8	40	31
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450681796	CF	On-Demand	Anodyne	BIRC8	40	31
C[C@H](O)CCSc1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450681805	EI	On-Demand	Anodyne	ADRB3	21	42
C[C@@H](O)CCSc1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450681806	EI	On-Demand	Anodyne	ADRB3	21	42
CNS(=O)(=O)c1ccc(N2CC[C@@H](SC)C2)c(F)c1	ZINC000450681815	DD	On-Demand	Anodyne	SLC6A9	17	44
CNS(=O)(=O)c1ccc(N2CC[C@H](SC)C2)c(F)c1	ZINC000450681816	DD	On-Demand	Anodyne	SLC6A9	17	44
COc1cccc([C@H]2[C@@H](NC(=O)CS(=O)(=O)C3CC3)CCN2C2CC2)c1	ZINC000450681837	GD	On-Demand	Anodyne	DRD4	41	32
C[C@@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(-n2cccn2)cc1	ZINC000450681870	EG	On-Demand	Anodyne	AMP1_PLAFQ	52	36
C[C@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(-n2cccn2)cc1	ZINC000450681871	EG	On-Demand	Anodyne	AMP1_PLAFQ	52	36
Cc1onc(C2CC2)c1C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450681872	GH	On-Demand	Anodyne	CCR2	49	37
Cc1onc(C2CC2)c1C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450681873	GH	On-Demand	Anodyne	CCR2	49	37
CNS(=O)(=O)NCC(=O)NCC(=O)Nc1cccc(Br)c1	ZINC000450681874	GB	On-Demand	Anodyne	EGFR	26	43
CNS(=O)(=O)NCC(=O)NCC(=O)Nc1cccc(Br)c1	ZINC000450681874	GB	On-Demand	Anodyne	RCE1	0	42
COC[C@]1(C(=O)OC)CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450681896	GF	On-Demand	Bother	TAAR1	19	41
COC[C@@]1(C(=O)OC)CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450681897	GF	On-Demand	Bother	TAAR1	19	41
Cc1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c2c1CCC2	ZINC000450681927	EH	On-Demand	Anodyne	AVPR1A	0	50
Cc1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c2c1CCC2	ZINC000450681939	EH	On-Demand	Anodyne	AVPR1A	0	50
FCC1CCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450681956	CH	On-Demand	Anodyne	LUCI_LUCLA	20	47
FCC1CCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450681956	CH	On-Demand	Anodyne	MLYCD	58	40
FCC1CCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450681956	CH	On-Demand	Anodyne	SCD1	17	42
O=C(c1cnn2c1CCC2)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450681961	FI	On-Demand	Anodyne	CACNA1B	46	32
O=C(c1cnn2c1CCC2)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450681962	FI	On-Demand	Anodyne	CACNA1B	46	32
COc1ccc2nc(N3CCC(CF)CC3)c(C)nc2c1	ZINC000450681963	CG	On-Demand	Anodyne	PDE3B	48	36
CC1=C(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)CCC(C)(C)C1	ZINC000450681968	EI	On-Demand	Anodyne	AVPR1A	17	46
CC1=C(C(=O)N2CC[C@]3(C2)OCc2ccccc23)CCC(C)(C)C1	ZINC000450681969	EI	On-Demand	Anodyne	AVPR1A	17	46
CO[C@@H](Cc1ccccc1)CN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450681970	FE	On-Demand	Anodyne	CTSG	17	51
CO[C@H](Cc1ccccc1)CN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450681971	FE	On-Demand	Anodyne	CTSG	17	51
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450681994	GH	On-Demand	Anodyne	OXTR	0	43
COc1ccc(OC(F)(F)F)c(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450681995	GH	On-Demand	Anodyne	OXTR	0	43
CCCOc1ccc(C(=O)NC2(CCO)CCCCC2)c(OC)c1	ZINC000450681997	EG	On-Demand	Anodyne	HCN4	49	33
O=C1C(=O)N(C[C@@H]2CCC(F)(F)C2)C(=O)N1Cc1ccccc1	ZINC000450682002	DE	On-Demand	Anodyne	CTSG	15	45
O=C1C(=O)N(C[C@H]2CCC(F)(F)C2)C(=O)N1Cc1ccccc1	ZINC000450682003	DE	On-Demand	Anodyne	CTSG	15	45
COC(=O)c1csc(CN[C@@H]2C[C@H](C)CC[C@H]2C(C)C)n1	ZINC000450682013	DG	On-Demand	Anodyne	TRPM8	15	40
COC(=O)c1csc(CN[C@@H]2C[C@H](C)CC[C@@H]2C(C)C)n1	ZINC000450682014	DG	On-Demand	Anodyne	TRPM8	15	40
COC(=O)c1csc(CN[C@@H]2C[C@@H](C)CC[C@H]2C(C)C)n1	ZINC000450682015	DG	On-Demand	Anodyne	TRPM8	15	40
COC(=O)c1csc(CN[C@@H]2C[C@@H](C)CC[C@@H]2C(C)C)n1	ZINC000450682016	DG	On-Demand	Anodyne	TRPM8	15	40
Cc1sc2ncnc(N3CCC(CF)CC3)c2c1C	ZINC000450682031	CG	On-Demand	Anodyne	SIRT3	45	33
COC[C@@](C)(CCO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450682038	EF	On-Demand	Anodyne	RBP4	56	37
COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)o1	ZINC000450682051	GK	On-Demand	Anodyne	PRCP	41	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)o1	ZINC000450682052	GK	On-Demand	Anodyne	PRCP	41	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)o1	ZINC000450682053	GK	On-Demand	Anodyne	PRCP	41	33
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)o1	ZINC000450682054	GK	On-Demand	Anodyne	PRCP	41	33
c1ccc(OC[C@H](NC[C@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450682056	DH	On-Demand	Anodyne	MAN1B1	54	39
c1ccc(OC[C@@H](NC[C@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450682057	DH	On-Demand	Anodyne	MAN1B1	54	39
c1ccc(OC[C@H](NC[C@@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450682058	DH	On-Demand	Anodyne	MAN1B1	54	39
c1ccc(OC[C@@H](NC[C@@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450682059	DH	On-Demand	Anodyne	MAN1B1	54	39
Cc1cnc(N2CCC[C@H]2COc2ccccc2)s1	ZINC000450682064	CG	On-Demand	Anodyne	CASP3	42	37
Cc1cnc(N2CCC[C@H]2COc2ccccc2)s1	ZINC000450682064	CG	On-Demand	Anodyne	CHRNA10	74	56
COc1cc2c(N3CC[C@@H](SC)C3)ncnc2cc1F	ZINC000450682065	CF	On-Demand	Anodyne	PDE3A	69	52
COc1cc2c(N3CC[C@@H](SC)C3)ncnc2cc1F	ZINC000450682065	CF	On-Demand	Anodyne	PDGFRB	61	44
COc1cc2c(N3CC[C@@H](SC)C3)ncnc2cc1F	ZINC000450682065	CF	On-Demand	Anodyne	PDE3B	101	52
COc1cc2c(N3CC[C@H](SC)C3)ncnc2cc1F	ZINC000450682066	CF	On-Demand	Anodyne	PDE3A	69	52
COc1cc2c(N3CC[C@H](SC)C3)ncnc2cc1F	ZINC000450682066	CF	On-Demand	Anodyne	PDGFRB	61	44
COc1cc2c(N3CC[C@H](SC)C3)ncnc2cc1F	ZINC000450682066	CF	On-Demand	Anodyne	PDE3B	101	52
COC[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450682071	EH	On-Demand	Anodyne	CACNA1B	55	37
COC[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450682071	EH	On-Demand	Anodyne	SLC6A9	18	40
COC[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450682071	EH	On-Demand	Anodyne	LIPG	55	40
COC[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450682072	EH	On-Demand	Anodyne	CACNA1B	55	37
COC[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450682072	EH	On-Demand	Anodyne	SLC6A9	18	40
COC[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450682072	EH	On-Demand	Anodyne	LIPG	55	40
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@@H](SC)C2)c([N+](=O)[O-])c1	ZINC000450682089	FD	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@H](SC)C2)c([N+](=O)[O-])c1	ZINC000450682090	FD	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@H](SC)C2)c([N+](=O)[O-])c1	ZINC000450682092	FD	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@@H](SC)C2)c([N+](=O)[O-])c1	ZINC000450682094	FD	On-Demand	Bother	TAAR1	20	47
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450682095	DH	On-Demand	Anodyne	SLC6A1	0	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H](CCOC)C2)[nH]c1C	ZINC000450682100	EF	On-Demand	Anodyne	AKR1C3	0	46
CCOC(=O)c1cc(C(=O)N2CCCC[C@H](CCOC)C2)[nH]c1C	ZINC000450682101	EF	On-Demand	Anodyne	AKR1C3	0	46
CS[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450682112	FC	On-Demand	Anodyne	GCK	19	40
CS[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450682112	FC	On-Demand	Anodyne	GCKR	56	37
COC1(CSc2nnc(-c3ccccc3C)n2C)CCC1	ZINC000450682118	DG	On-Demand	Anodyne	DRD3	42	38
CS[C@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450682120	FC	On-Demand	Anodyne	GCK	19	40
CS[C@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450682120	FC	On-Demand	Anodyne	GCKR	56	37
CCC(CC)Oc1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450682133	FJ	On-Demand	Anodyne	AVPR1A	16	48
CN1CCC(CCO)(NC(=O)CCc2ccc3c(c2)OCCO3)CC1	ZINC000450682135	ED	On-Demand	Anodyne	LUXR	22	41
O=C1CCCc2nc(N3CCC[C@H]3COc3ccccc3)ccc21	ZINC000450682136	DH	On-Demand	Anodyne	CASP3	51	41
O=C1CCCc2nc(N3CCC[C@H]3COc3ccccc3)ccc21	ZINC000450682136	DH	On-Demand	Anodyne	GRM5	0	46
O=C1CCCc2nc(N3CCC[C@H]3COc3ccccc3)ccc21	ZINC000450682136	DH	On-Demand	Anodyne	CHRNA10	77	47
O=C1CCCc2nc(N3CCC[C@H]3COc3ccccc3)ccc21	ZINC000450682136	DH	On-Demand	Anodyne	CASP7	43	41
CCC(CC)Oc1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450682138	FJ	On-Demand	Anodyne	AVPR1A	16	48
Cc1ccc(-c2nnc(SCC(=O)CC(C)(C)C3CC3)o2)cc1	ZINC000450682153	EJ	On-Demand	Anodyne	TERT	0	40
COc1cc(CN[C@@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450682158	CG	On-Demand	Anodyne	PDE6A	41	32
COc1cc(CN[C@H](CCO)C(C)(C)C)ccc1Cl	ZINC000450682159	CG	On-Demand	Anodyne	PDE6A	41	32
O=C(CC1CC(F)(F)C1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682173	DG	On-Demand	Anodyne	SIGMAR1	15	44
COc1cccc([C@@H]2[C@H](NC(=O)CS(=O)(=O)C3CC3)CCN2C2CC2)c1	ZINC000450682174	GD	On-Demand	Anodyne	DRD4	41	32
O=C(CC1CC(F)(F)C1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682175	DG	On-Demand	Anodyne	SIGMAR1	15	44
COc1cccc([C@H]2[C@H](NC(=O)CS(=O)(=O)C3CC3)CCN2C2CC2)c1	ZINC000450682176	GD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2[C@@H](NC(=O)CS(=O)(=O)C3CC3)CCN2C2CC2)c1	ZINC000450682178	GD	On-Demand	Anodyne	DRD4	41	32
COC(=O)c1cccc(CN[C@H](C)c2ccc(F)c(C)c2)c1Cl	ZINC000450682181	EI	On-Demand	Anodyne	LEF	47	38
COC(=O)c1cccc(CN[C@@H](C)c2ccc(F)c(C)c2)c1Cl	ZINC000450682189	EI	On-Demand	Anodyne	LEF	47	38
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)o1	ZINC000450682190	DH	On-Demand	Anodyne	COLA	56	34
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)o1	ZINC000450682190	DH	On-Demand	Anodyne	CPT1A	53	34
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CC[C@H]3C[C@H]23)o1	ZINC000450682192	DH	On-Demand	Anodyne	COLA	56	34
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CC[C@H]3C[C@H]23)o1	ZINC000450682192	DH	On-Demand	Anodyne	CPT1A	53	34
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CC[C@H]3C[C@@H]23)o1	ZINC000450682196	DH	On-Demand	Anodyne	COLA	56	34
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CC[C@@H]3C[C@H]23)o1	ZINC000450682199	DH	On-Demand	Anodyne	COLA	56	34
COCc1ccc([C@@H]2CCCN2C(=O)C[C@@H]2CC[C@@H]3C[C@H]23)o1	ZINC000450682199	DH	On-Demand	Anodyne	CPT1A	53	34
O=C(Nc1ccccc1)c1ccc(N2CCC(CF)CC2)nn1	ZINC000450682201	DF	On-Demand	Anodyne	SCD1	65	48
O=C(Nc1ccccc1)c1ccc(N2CCC(CF)CC2)nn1	ZINC000450682201	DF	On-Demand	Anodyne	SCD	43	46
O=C(Nc1ccccc1)c1ccc(N2CCC(CF)CC2)nn1	ZINC000450682201	DF	On-Demand	Anodyne	DGAT1	45	42
Cc1ccc([C@H](Cc2ccccc2)NCc2nnc(C3CC3)s2)cc1C	ZINC000450682212	FK	On-Demand	Anodyne	ADRB3	15	42
CC(C)(C)[C@H](COc1ccccc1F)NCC1(C#N)CCC1	ZINC000450682216	DH	On-Demand	Mild	SDH1	0	44
Cc1ccc([C@@H](Cc2ccccc2)NCc2nnc(C3CC3)s2)cc1C	ZINC000450682218	FK	On-Demand	Anodyne	ADRB3	15	42
CC(C)(C)[C@@H](COc1ccccc1F)NCC1(C#N)CCC1	ZINC000450682221	DH	On-Demand	Mild	SDH1	0	44
O=C(NCC1(CCOCc2ccccc2)CC1)c1ccc2cnccc2c1	ZINC000450682250	FI	On-Demand	Anodyne	AKT1	0	42
CCn1ccnc1CNc1ncnc2cc(F)c(OC)cc12	ZINC000450682260	DE	On-Demand	Anodyne	EGFR	41	41
CCn1ccnc1CNc1ncnc2cc(F)c(OC)cc12	ZINC000450682260	DE	On-Demand	Anodyne	FGFR1	21	40
CCn1ccnc1CNc1ncnc2cc(F)c(OC)cc12	ZINC000450682260	DE	On-Demand	Anodyne	FLT1	30	40
FCC1CCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450682263	CF	On-Demand	Anodyne	DKK1	0	42
CC(=O)N[C@H](C(=O)Nc1ncc(-c2ccc(C)cc2C)s1)C(C)(C)C	ZINC000450682277	FH	On-Demand	Anodyne	FFAR2	27	41
CC(=O)c1cccc(CSc2nc3ccccc3c(=O)n2C[C@H]2CCCO2)c1	ZINC000450682281	GI	On-Demand	Anodyne	PTGDR2	15	56
CC(=O)c1cccc(CSc2nc3ccccc3c(=O)n2C[C@H]2CCCO2)c1	ZINC000450682281	GI	On-Demand	Anodyne	Q8MHZ5_SHEEP	46	30
CC(=O)c1cccc(CSc2nc3ccccc3c(=O)n2C[C@@H]2CCCO2)c1	ZINC000450682284	GI	On-Demand	Anodyne	PTGDR2	15	56
CC(=O)c1cccc(CSc2nc3ccccc3c(=O)n2C[C@@H]2CCCO2)c1	ZINC000450682284	GI	On-Demand	Anodyne	Q8MHZ5_SHEEP	46	30
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450682287	FE	On-Demand	Bother	BCL2L1	89	39
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450682287	FE	On-Demand	Bother	BCL2	65	34
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450682287	FE	On-Demand	Bother	BCL2L2	44	31
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450682288	FE	On-Demand	Bother	BCL2L1	89	39
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450682288	FE	On-Demand	Bother	BCL2	65	34
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450682288	FE	On-Demand	Bother	BCL2L2	44	31
COC(=O)c1ccc(CN[C@H](C)c2ccc(C)c(F)c2)cc1Cl	ZINC000450682298	EI	On-Demand	Anodyne	LEF	42	35
COC(=O)c1ccc(CN[C@@H](C)c2ccc(C)c(F)c2)cc1Cl	ZINC000450682299	EI	On-Demand	Anodyne	LEF	42	35
Cc1nc2ccnn2cc1C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450682303	GG	On-Demand	Anodyne	DDR1	28	41
Cc1nc2ccnn2cc1C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450682303	GG	On-Demand	Anodyne	DDR2	15	41
Cc1nc2ccnn2cc1C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450682305	GG	On-Demand	Anodyne	DDR1	28	41
Cc1nc2ccnn2cc1C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450682305	GG	On-Demand	Anodyne	DDR2	15	41
COc1ccc(C(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682307	FG	On-Demand	Anodyne	MAPK14	38	40
COc1ccc(C(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682307	FG	On-Demand	Anodyne	COLA	53	34
COc1ccc(C(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682307	FG	On-Demand	Anodyne	CPT1A	46	34
COc1ccc(C(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682307	FG	On-Demand	Anodyne	MAPK13	55	38
COc1ccc(C(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682309	FG	On-Demand	Anodyne	MAPK14	38	40
COc1ccc(C(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682309	FG	On-Demand	Anodyne	COLA	53	34
COc1ccc(C(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682309	FG	On-Demand	Anodyne	CPT1A	46	34
COc1ccc(C(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682309	FG	On-Demand	Anodyne	MAPK13	55	38
COc1ccc(C(=O)N[C@H]2CCC[C@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682311	FG	On-Demand	Anodyne	MAPK14	38	40
COc1ccc(C(=O)N[C@H]2CCC[C@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682311	FG	On-Demand	Anodyne	COLA	53	34
COc1ccc(C(=O)N[C@H]2CCC[C@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682311	FG	On-Demand	Anodyne	CPT1A	46	34
COc1ccc(C(=O)N[C@H]2CCC[C@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682311	FG	On-Demand	Anodyne	MAPK13	55	38
COc1ccc(C(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682313	FG	On-Demand	Anodyne	MAPK14	38	40
COc1ccc(C(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682313	FG	On-Demand	Anodyne	COLA	53	34
COc1ccc(C(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682313	FG	On-Demand	Anodyne	CPT1A	46	34
COc1ccc(C(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)cc1S(C)(=O)=O	ZINC000450682313	FG	On-Demand	Anodyne	MAPK13	55	38
OCCC[C@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450682333	CD	On-Demand	Anodyne	MAN1B1	51	32
OCCC[C@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450682333	CD	On-Demand	Anodyne	MAN1	0	40
OCCC[C@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450682339	CD	On-Demand	Anodyne	MAN1B1	51	32
OCCC[C@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450682339	CD	On-Demand	Anodyne	MAN1	0	40
OCCC[C@@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450682340	CD	On-Demand	Anodyne	MAN1B1	51	32
OCCC[C@@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450682340	CD	On-Demand	Anodyne	MAN1	0	40
OCCC[C@@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450682341	CD	On-Demand	Anodyne	MAN1B1	51	32
OCCC[C@@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450682341	CD	On-Demand	Anodyne	MAN1	0	40
CCN(CCO)CCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450682349	DD	On-Demand	Anodyne	CTSV	43	30
CN(C)[C@@H](CNC(=O)C1(C(=O)C2CC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000450682370	FG	On-Demand	Anodyne	CCR2	62	38
CN(C)[C@H](CNC(=O)C1(C(=O)C2CC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000450682371	FG	On-Demand	Anodyne	CCR2	62	38
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450682378	EI	On-Demand	Anodyne	SRD5A2	21	42
CC(C)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(=O)N1CCOCC1	ZINC000450682388	ED	On-Demand	Anodyne	DERP1	0	40
CC(C)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)C(=O)N1CCOCC1	ZINC000450682389	ED	On-Demand	Anodyne	DERP1	0	40
CC(C)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(=O)N1CCOCC1	ZINC000450682390	ED	On-Demand	Anodyne	DERP1	0	40
CC(C)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(=O)N1CCOCC1	ZINC000450682391	ED	On-Demand	Anodyne	DERP1	0	40
CN(C)[C@H](CNC(=O)C1CC(C)(O)C1)c1cccc(C(F)(F)F)c1	ZINC000450682406	EF	On-Demand	Anodyne	CCR2	43	35
CN(C)[C@@H](CNC(=O)C1CC(C)(O)C1)c1cccc(C(F)(F)F)c1	ZINC000450682407	EF	On-Demand	Anodyne	CCR2	43	35
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCO[C@]2(CCOC2)C1	ZINC000450682408	DD	On-Demand	Anodyne	AKR1C3	0	40
O=C([C@H]1CCN(c2ccccc2)C1)N1CCO[C@]2(CCOC2)C1	ZINC000450682409	DD	On-Demand	Anodyne	AKR1C3	0	40
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCO[C@@]2(CCOC2)C1	ZINC000450682410	DD	On-Demand	Anodyne	AKR1C3	0	40
O=C([C@H]1CCN(c2ccccc2)C1)N1CCO[C@@]2(CCOC2)C1	ZINC000450682411	DD	On-Demand	Anodyne	AKR1C3	0	40
Cc1cc([C@@H](C)NCCC(C)(F)F)cc(C)c1F	ZINC000450682414	CI	On-Demand	Anodyne	LEF	27	41
Cc1cc([C@H](C)NCCC(C)(F)F)cc(C)c1F	ZINC000450682415	CI	On-Demand	Anodyne	LEF	27	41
CC(C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450682424	ED	On-Demand	Anodyne	CCR1	35	40
CC(C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450682424	ED	On-Demand	Anodyne	MLYCD	25	40
CC(C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450682424	ED	On-Demand	Anodyne	DERP1	0	43
CC(C)[C@H](NCCN(C)Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450682425	ED	On-Demand	Anodyne	CCR1	35	40
CC(C)[C@H](NCCN(C)Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450682425	ED	On-Demand	Anodyne	MLYCD	25	40
CC(C)[C@H](NCCN(C)Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450682425	ED	On-Demand	Anodyne	DERP1	0	43
O=C(Cc1scnc1-c1ccccc1)NCc1ccccc1N1CCCCC1	ZINC000450682428	GJ	On-Demand	Anodyne	KCNQ2	63	40
O=C(Cc1scnc1-c1ccccc1)NCc1ccccc1N1CCCCC1	ZINC000450682428	GJ	On-Demand	Anodyne	SCN2A	20	47
O=C(Cc1scnc1-c1ccccc1)NCc1ccccc1N1CCCCC1	ZINC000450682428	GJ	On-Demand	Anodyne	SCN10A	20	47
CC1(C(=O)NCc2ccccc2N2CCCCC2)CCC(=O)CC1	ZINC000450682429	EG	On-Demand	Anodyne	KCNQ2	84	41
C[C@H](NCc1ccccc1OC1CC1)c1ccc(-n2cccn2)cc1	ZINC000450682430	EI	On-Demand	Anodyne	AMP1_PLAFQ	57	43
C[C@H](NCc1ccccc1OC1CC1)c1ccc(-n2cccn2)cc1	ZINC000450682430	EI	On-Demand	Anodyne	LAP	0	43
C[C@@H](NCc1ccccc1OC1CC1)c1ccc(-n2cccn2)cc1	ZINC000450682431	EI	On-Demand	Anodyne	AMP1_PLAFQ	57	43
C[C@@H](NCc1ccccc1OC1CC1)c1ccc(-n2cccn2)cc1	ZINC000450682431	EI	On-Demand	Anodyne	LAP	0	43
COC[C@]1(C(=O)OC)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450682435	ED	On-Demand	Anodyne	PDGFRB	58	43
COC[C@@]1(C(=O)OC)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450682436	ED	On-Demand	Anodyne	PDGFRB	58	43
Cc1ccccc1-c1nnc(SCCC(C)(F)F)n1C	ZINC000450682438	CH	On-Demand	Anodyne	DRD3	22	43
Cc1ccccc1-c1nnc(SCCC(C)(F)F)n1C	ZINC000450682438	CH	On-Demand	Anodyne	KCNH2	25	43
COc1ccc(CC(=O)NC2(CCO)CCCCC2)c(Cl)c1OC	ZINC000450682445	FG	On-Demand	Anodyne	PDE6A	40	30
CC(C)CC(CC(C)C)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682483	EI	On-Demand	Anodyne	SIGMAR1	16	47
CC(C)CC(CC(C)C)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682484	EI	On-Demand	Anodyne	SIGMAR1	16	47
Cc1nc(C(C)C)oc1CN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450682494	EF	On-Demand	Anodyne	CTSG	15	45
Cc1c(C(=O)NCC2(CCOCc3ccccc3)CC2)nnn1-c1cnn(C)c1	ZINC000450682497	GE	On-Demand	Anodyne	HCN1	55	34
Cc1c(C(=O)NCC2(CCOCc3ccccc3)CC2)nnn1-c1cnn(C)c1	ZINC000450682497	GE	On-Demand	Anodyne	HCN4	46	30
CCCc1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)no1	ZINC000450682500	DF	On-Demand	Anodyne	AVPR1A	0	46
CCCc1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)no1	ZINC000450682501	DF	On-Demand	Anodyne	AVPR1A	0	46
FCC1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450682512	EF	On-Demand	Anodyne	PDE1B	0	41
O=C(c1cc2c([nH]1)CCCC2)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682513	DG	On-Demand	Anodyne	AVPR1A	0	47
O=C(c1cc2c([nH]1)CCCC2)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682514	DG	On-Demand	Anodyne	AVPR1A	0	47
CCSc1cccnc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682515	EG	On-Demand	Anodyne	AVPR1A	0	43
CCSc1cccnc1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682516	EG	On-Demand	Anodyne	AVPR1A	0	43
COc1ccccc1[C@@H](CNC(=O)c1cn(CC2CC2)nn1)OC(C)C	ZINC000450682522	FF	On-Demand	Anodyne	HCN1	40	31
COc1ccccc1[C@@H](CNC(=O)c1cn(CC2CC2)nn1)OC(C)C	ZINC000450682522	FF	On-Demand	Anodyne	HCN4	40	31
COc1ccccc1[C@H](CNC(=O)c1cn(CC2CC2)nn1)OC(C)C	ZINC000450682523	FF	On-Demand	Anodyne	HCN1	40	31
COc1ccccc1[C@H](CNC(=O)c1cn(CC2CC2)nn1)OC(C)C	ZINC000450682523	FF	On-Demand	Anodyne	HCN4	40	31
CCC(CC)Oc1ccc(C(=O)NC2(CO)CCOCC2)cc1	ZINC000450682537	DF	On-Demand	Anodyne	MMP7	0	41
CCC(CC)Oc1ccc(C(=O)NC2(CO)CCOCC2)cc1	ZINC000450682537	DF	On-Demand	Anodyne	ADAMTS1	0	41
CC(=O)c1ccc(C#N)cc1N1CCC[C@H]1COc1ccccc1	ZINC000450682547	DH	On-Demand	Mild	CASP3	58	40
CC(=O)c1ccc(C#N)cc1N1CCC[C@H]1COc1ccccc1	ZINC000450682547	DH	On-Demand	Mild	COLA	37	41
CC(=O)c1ccc(C#N)cc1N1CCC[C@H]1COc1ccccc1	ZINC000450682547	DH	On-Demand	Mild	CPT1A	38	41
CC(=O)c1ccc(C#N)cc1N1CCC[C@H]1COc1ccccc1	ZINC000450682547	DH	On-Demand	Mild	CHRNA10	94	53
CC(=O)c1ccc(C#N)cc1N1CCC[C@H]1COc1ccccc1	ZINC000450682547	DH	On-Demand	Mild	CASP7	52	43
CC(=O)c1ccc(C#N)cc1N1CCC[C@H]1COc1ccccc1	ZINC000450682547	DH	On-Demand	Mild	ACKR3	43	36
CC[C@H](C)[C@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682554	GH	On-Demand	Anodyne	GRIN2B	71	38
CC[C@H](C)[C@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682554	GH	On-Demand	Anodyne	CCR1	37	46
CC[C@H](C)[C@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682554	GH	On-Demand	Anodyne	F2RL1	29	43
CC[C@H](C)[C@@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682555	GH	On-Demand	Anodyne	GRIN2B	71	38
CC[C@H](C)[C@@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682555	GH	On-Demand	Anodyne	CCR1	37	46
CC[C@H](C)[C@@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682555	GH	On-Demand	Anodyne	F2RL1	29	43
CC[C@@H](C)[C@@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682556	GH	On-Demand	Anodyne	GRIN2B	71	38
CC[C@@H](C)[C@@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682556	GH	On-Demand	Anodyne	CCR1	37	46
CC[C@@H](C)[C@@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682556	GH	On-Demand	Anodyne	F2RL1	29	43
CC[C@@H](C)[C@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682557	GH	On-Demand	Anodyne	GRIN2B	71	38
CC[C@@H](C)[C@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682557	GH	On-Demand	Anodyne	CCR1	37	46
CC[C@@H](C)[C@H](NCc1cnns1)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450682557	GH	On-Demand	Anodyne	F2RL1	29	43
COCc1ccc([C@H]2CCCN2C(=O)CC2(O)CCC2)o1	ZINC000450682568	CE	On-Demand	Anodyne	COLA	65	35
COCc1ccc([C@H]2CCCN2C(=O)CC2(O)CCC2)o1	ZINC000450682568	CE	On-Demand	Anodyne	CPT1A	41	35
COCc1ccc([C@@H]2CCCN2C(=O)CC2(O)CCC2)o1	ZINC000450682569	CE	On-Demand	Anodyne	COLA	65	35
COCc1ccc([C@@H]2CCCN2C(=O)CC2(O)CCC2)o1	ZINC000450682569	CE	On-Demand	Anodyne	CPT1A	41	35
CS[C@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450682570	EG	On-Demand	Anodyne	AVPR2	46	42
CS[C@@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450682571	EG	On-Demand	Anodyne	AVPR2	46	42
COC(=O)C1(CSc2nnc(-c3ccccc3Br)o2)CCCC1	ZINC000450682576	GI	On-Demand	Anodyne	ALOX15	59	37
COc1ccc2nc(C)nc(N3CC[C@@H](SC)C3)c2c1	ZINC000450682595	CF	On-Demand	Anodyne	PDE3A	49	42
COc1ccc2nc(C)nc(N3CC[C@@H](SC)C3)c2c1	ZINC000450682595	CF	On-Demand	Anodyne	PDE3B	72	42
COc1ccc2nc(C)nc(N3CC[C@H](SC)C3)c2c1	ZINC000450682596	CF	On-Demand	Anodyne	PDE3A	49	42
COc1ccc2nc(C)nc(N3CC[C@H](SC)C3)c2c1	ZINC000450682596	CF	On-Demand	Anodyne	PDE3B	72	42
O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450682605	FG	On-Demand	Anodyne	HPGDS	33	52
O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(N2CCC2)nc1	ZINC000450682606	FG	On-Demand	Anodyne	HPGDS	33	52
CCCc1cc(C(=O)N[C@@H](c2ccccc2)c2nc[nH]n2)no1	ZINC000450682613	DE	On-Demand	Anodyne	P2RY12	42	33
CCCc1cc(C(=O)N[C@H](c2ccccc2)c2nc[nH]n2)no1	ZINC000450682615	DE	On-Demand	Anodyne	P2RY12	42	33
CCCC[C@H](NCc1nc(C(=O)OC)co1)c1ccc(OC)cc1	ZINC000450682633	EG	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
CCCC[C@@H](NCc1nc(C(=O)OC)co1)c1ccc(OC)cc1	ZINC000450682634	EG	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
CS[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450682638	CD	On-Demand	Anodyne	PDE3A	42	32
CS[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450682638	CD	On-Demand	Anodyne	AKT2	15	42
CS[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450682638	CD	On-Demand	Anodyne	PDE3B	62	32
CS[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450682639	CD	On-Demand	Anodyne	PDE3A	42	32
CS[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450682639	CD	On-Demand	Anodyne	AKT2	15	42
CS[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450682639	CD	On-Demand	Anodyne	PDE3B	62	32
O=C1CC[C@H](CN[C@H](COc2ccccc2)c2ccccc2)CCN1	ZINC000450682662	EG	On-Demand	Anodyne	MAN1B1	60	40
O=C1CC[C@H](CN[C@@H](COc2ccccc2)c2ccccc2)CCN1	ZINC000450682663	EG	On-Demand	Anodyne	MAN1B1	60	40
O=C1CC[C@@H](CN[C@@H](COc2ccccc2)c2ccccc2)CCN1	ZINC000450682664	EG	On-Demand	Anodyne	MAN1B1	60	40
O=C1CC[C@@H](CN[C@H](COc2ccccc2)c2ccccc2)CCN1	ZINC000450682665	EG	On-Demand	Anodyne	MAN1B1	60	40
COC[C@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450682666	EG	On-Demand	Anodyne	OPRM1	0	43
COC[C@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450682666	EG	On-Demand	Anodyne	OPRK1	24	43
COC[C@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450682666	EG	On-Demand	Anodyne	CCR1	34	41
COC[C@@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450682667	EG	On-Demand	Anodyne	OPRM1	0	43
COC[C@@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450682667	EG	On-Demand	Anodyne	OPRK1	24	43
COC[C@@H]1CCCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450682667	EG	On-Demand	Anodyne	CCR1	34	41
CC[C@@H](O)CC(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000450682697	CG	On-Demand	Anodyne	TACR3	40	32
CC[C@H](O)CC(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000450682698	CG	On-Demand	Anodyne	TACR3	40	32
CC[C@@H](O)CC(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000450682699	CG	On-Demand	Anodyne	TACR3	40	32
CC[C@H](O)CC(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000450682700	CG	On-Demand	Anodyne	TACR3	40	32
O=C(CC1(O)CCC1)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450682702	EI	On-Demand	Anodyne	CPT1A	56	43
O=C(CC1(O)CCC1)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450682702	EI	On-Demand	Anodyne	CCR2	42	36
O=C(CC1(O)CCC1)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450682703	EI	On-Demand	Anodyne	CPT1A	56	43
O=C(CC1(O)CCC1)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450682703	EI	On-Demand	Anodyne	CCR2	42	36
Cc1cccc(C)c1OC[C@H](NC[C@H]1CCNC(=O)CC1)c1ccccc1	ZINC000450682706	FH	On-Demand	Anodyne	MAN1B1	47	33
COC[C@@]1(C(=O)OC)CCN(c2nc(-c3ccccc3)c3ccccc3n2)C1	ZINC000450682709	GG	On-Demand	Anodyne	TACR3	67	38
Cc1cccc(C)c1OC[C@H](NC[C@@H]1CCNC(=O)CC1)c1ccccc1	ZINC000450682710	FH	On-Demand	Anodyne	MAN1B1	47	33
Cc1cccc(C)c1OC[C@@H](NC[C@@H]1CCNC(=O)CC1)c1ccccc1	ZINC000450682711	FH	On-Demand	Anodyne	MAN1B1	47	33
COC[C@]1(C(=O)OC)CCN(c2nc(-c3ccccc3)c3ccccc3n2)C1	ZINC000450682712	GG	On-Demand	Anodyne	TACR3	67	38
Cc1cccc(C)c1OC[C@@H](NC[C@H]1CCNC(=O)CC1)c1ccccc1	ZINC000450682713	FH	On-Demand	Anodyne	MAN1B1	47	33
CCc1cc(NC(=O)C[C@H](O)CC)ccc1C	ZINC000450682728	BF	On-Demand	Anodyne	POLC	76	38
CCc1cc(NC(=O)C[C@H](O)CC)ccc1C	ZINC000450682728	BF	On-Demand	Anodyne	SLC1A1	64	40
CCc1cc(NC(=O)C[C@H](O)CC)ccc1C	ZINC000450682728	BF	On-Demand	Anodyne	SLC1A3	69	39
CCc1cc(NC(=O)C[C@H](O)CC)ccc1C	ZINC000450682728	BF	On-Demand	Anodyne	SLC1A2	78	41
CCc1cc(NC(=O)C[C@@H](O)CC)ccc1C	ZINC000450682730	BF	On-Demand	Anodyne	POLC	76	38
CCc1cc(NC(=O)C[C@@H](O)CC)ccc1C	ZINC000450682730	BF	On-Demand	Anodyne	SLC1A1	64	40
CCc1cc(NC(=O)C[C@@H](O)CC)ccc1C	ZINC000450682730	BF	On-Demand	Anodyne	SLC1A3	69	39
CCc1cc(NC(=O)C[C@@H](O)CC)ccc1C	ZINC000450682730	BF	On-Demand	Anodyne	SLC1A2	78	41
O=C(c1cc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450682747	GG	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450682747	GG	On-Demand	Bother	L3MBTL3	26	43
O=C(c1cc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450682748	GG	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450682748	GG	On-Demand	Bother	L3MBTL3	26	43
O=C(c1cc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450682749	GG	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450682749	GG	On-Demand	Bother	L3MBTL3	26	43
O=C(c1cc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450682750	GG	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450682750	GG	On-Demand	Bother	L3MBTL3	26	43
CC(C)c1nnc(CN[C@@H](COCc2ccccc2)c2ccccc2)s1	ZINC000450682766	FJ	On-Demand	Anodyne	MAN1B1	40	42
CC(C)c1nnc(CN[C@H](COCc2ccccc2)c2ccccc2)s1	ZINC000450682769	FJ	On-Demand	Anodyne	MAN1B1	40	42
CN1CCC[C@H](C(=O)NCC(C)(C)c2cccc(Cl)c2F)C1=O	ZINC000450682773	EF	On-Demand	Anodyne	P2RX7	58	42
CN1CCC[C@@H](C(=O)NCC(C)(C)c2cccc(Cl)c2F)C1=O	ZINC000450682775	EF	On-Demand	Anodyne	P2RX7	58	42
COc1cccc(OCCC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000450682778	GG	On-Demand	Bother	NQO2	30	40
COc1cccc(OCCC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000450682778	GG	On-Demand	Bother	MTNR1A	95	46
COc1cccc(OCCC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000450682778	GG	On-Demand	Bother	MTNR1B	78	46
COc1cccc(OCCC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000450682778	GG	On-Demand	Bother	TAAR1	25	40
COc1cccc(OCCC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000450682778	GG	On-Demand	Bother	CAN2	0	42
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682783	DF	On-Demand	Anodyne	ACE	69	38
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682783	DF	On-Demand	Anodyne	SLC18A2	48	41
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682783	DF	On-Demand	Anodyne	MME	55	41
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682783	DF	On-Demand	Anodyne	SDH1	0	43
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682783	DF	On-Demand	Anodyne	MMP3	30	41
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682783	DF	On-Demand	Anodyne	ACE2	45	44
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682783	DF	On-Demand	Anodyne	LAP3	43	33
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682783	DF	On-Demand	Anodyne	BIRC2	50	40
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682784	DF	On-Demand	Anodyne	ACE	69	38
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682784	DF	On-Demand	Anodyne	SLC18A2	48	41
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682784	DF	On-Demand	Anodyne	MME	55	41
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682784	DF	On-Demand	Anodyne	SDH1	0	43
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682784	DF	On-Demand	Anodyne	MMP3	30	41
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682784	DF	On-Demand	Anodyne	ACE2	45	44
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682784	DF	On-Demand	Anodyne	LAP3	43	33
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450682784	DF	On-Demand	Anodyne	BIRC2	50	40
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682785	DF	On-Demand	Anodyne	ACE	69	38
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682785	DF	On-Demand	Anodyne	SLC18A2	48	41
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682785	DF	On-Demand	Anodyne	MME	55	41
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682785	DF	On-Demand	Anodyne	SDH1	0	43
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682785	DF	On-Demand	Anodyne	MMP3	30	41
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682785	DF	On-Demand	Anodyne	ACE2	45	44
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682785	DF	On-Demand	Anodyne	LAP3	43	33
O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682785	DF	On-Demand	Anodyne	BIRC2	50	40
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682786	DF	On-Demand	Anodyne	ACE	69	38
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682786	DF	On-Demand	Anodyne	SLC18A2	48	41
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682786	DF	On-Demand	Anodyne	MME	55	41
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682786	DF	On-Demand	Anodyne	SDH1	0	43
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682786	DF	On-Demand	Anodyne	MMP3	30	41
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682786	DF	On-Demand	Anodyne	ACE2	45	44
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682786	DF	On-Demand	Anodyne	LAP3	43	33
O=C(N[C@H](CCc1ccccc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450682786	DF	On-Demand	Anodyne	BIRC2	50	40
CC(C)[C@@H](NCc1ccccc1OC1CC1)C(=O)N1CCOCC1	ZINC000450682799	EE	On-Demand	Anodyne	CCR1	40	41
CC(C)[C@H](NCc1ccccc1OC1CC1)C(=O)N1CCOCC1	ZINC000450682800	EE	On-Demand	Anodyne	CCR1	40	41
Cc1sccc1C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450682810	FI	On-Demand	Anodyne	CCR2	49	39
Cc1sccc1C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450682810	FI	On-Demand	Anodyne	PHES	0	43
Cc1sccc1C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450682811	FI	On-Demand	Anodyne	CCR2	49	39
Cc1sccc1C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450682811	FI	On-Demand	Anodyne	PHES	0	43
COCC1(O)CN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450682812	DC	On-Demand	Anodyne	PDE3B	56	34
Cc1nn(C)cc1CC(=O)NCC(C)(C)c1cccc(Cl)c1F	ZINC000450682815	EG	On-Demand	Anodyne	P2RX7	42	38
CC(C)c1nnc(CN[C@@H](COc2ccccc2F)C(C)(C)C)s1	ZINC000450682842	FI	On-Demand	Anodyne	SDH1	0	40
CC(C)c1nnc(CN[C@H](COc2ccccc2F)C(C)(C)C)s1	ZINC000450682843	FI	On-Demand	Anodyne	SDH1	0	40
COc1cc(CN[C@H](c2ccccc2)C2CC2)ccc1Cl	ZINC000450682844	DJ	On-Demand	Anodyne	SLC6A1	0	40
COc1cc(CN[C@@H](c2ccccc2)C2CC2)ccc1Cl	ZINC000450682845	DJ	On-Demand	Anodyne	SLC6A1	0	40
Cc1ccn(-c2ccccc2C(=O)N2CC[C@]3(C2)OCc2ccccc23)n1	ZINC000450682846	FG	On-Demand	Anodyne	AVPR1A	20	47
Cc1ccn(-c2ccccc2C(=O)N2CC[C@]3(C2)OCc2ccccc23)n1	ZINC000450682846	FG	On-Demand	Anodyne	BCL2	0	40
Cc1ccn(-c2ccccc2C(=O)N2CC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450682847	FG	On-Demand	Anodyne	AVPR1A	20	47
Cc1ccn(-c2ccccc2C(=O)N2CC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450682847	FG	On-Demand	Anodyne	BCL2	0	40
CCC[C@](C)(CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450682855	CD	On-Demand	Anodyne	POL	0	40
CCC[C@](C)(CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450682856	CD	On-Demand	Anodyne	POL	0	40
CCC[C@@](C)(CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450682857	CD	On-Demand	Anodyne	POL	0	40
CCC[C@@](C)(CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450682858	CD	On-Demand	Anodyne	POL	0	40
COC[C@H](NCc1c(C)cccc1Cl)C1CC1	ZINC000450682864	CG	On-Demand	Anodyne	EIF2AK1	41	37
COC[C@@H](NCc1c(C)cccc1Cl)C1CC1	ZINC000450682865	CG	On-Demand	Anodyne	EIF2AK1	41	37
C[C@@H]1Cc2cccc(C(=O)NC3(CCO)CCCCC3)c2O1	ZINC000450682881	DF	On-Demand	Anodyne	HCN1	40	31
C[C@H]1Cc2cccc(C(=O)NC3(CCO)CCCCC3)c2O1	ZINC000450682882	DF	On-Demand	Anodyne	HCN1	40	31
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C12CCOCC2	ZINC000450682883	EE	On-Demand	Anodyne	TIMP3	69	36
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C12CCOCC2	ZINC000450682884	EE	On-Demand	Anodyne	TIMP3	69	36
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)OC)C12CCOCC2	ZINC000450682885	EE	On-Demand	Anodyne	TIMP3	69	36
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C12CCOCC2	ZINC000450682886	EE	On-Demand	Anodyne	TIMP3	69	36
CN(C)Cc1nc(N2CCC(CF)CC2)c2c(-c3ccccc3)csc2n1	ZINC000450682900	GJ	On-Demand	Anodyne	ADRB3	0	45
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682901	FG	On-Demand	Anodyne	GHRHR	48	36
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682901	FG	On-Demand	Anodyne	SIGMAR1	19	50
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682901	FG	On-Demand	Anodyne	SLC18A3	0	41
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682902	FG	On-Demand	Anodyne	GHRHR	48	36
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682902	FG	On-Demand	Anodyne	SIGMAR1	19	50
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682902	FG	On-Demand	Anodyne	SLC18A3	0	41
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682903	FG	On-Demand	Anodyne	GHRHR	48	36
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682903	FG	On-Demand	Anodyne	SIGMAR1	19	50
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682903	FG	On-Demand	Anodyne	SLC18A3	0	41
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682904	FG	On-Demand	Anodyne	GHRHR	48	36
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682904	FG	On-Demand	Anodyne	SIGMAR1	19	50
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682904	FG	On-Demand	Anodyne	SLC18A3	0	41
CCOC(=O)c1cnc2ccccc2c1N1CCC(CF)CC1	ZINC000450682905	DH	On-Demand	Anodyne	ADORA1	0	46
CCOC(=O)c1cnc2ccccc2c1N1CCC(CF)CC1	ZINC000450682905	DH	On-Demand	Anodyne	P2RY12	40	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682906	FG	On-Demand	Anodyne	GHRHR	81	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682906	FG	On-Demand	Anodyne	GHSR	20	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682907	FG	On-Demand	Anodyne	GHRHR	81	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682907	FG	On-Demand	Anodyne	GHSR	20	40
COc1ccc(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)c(Cl)c1OC	ZINC000450682910	GH	On-Demand	Anodyne	AVPR1A	20	41
COc1ccc(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)c(Cl)c1OC	ZINC000450682911	GH	On-Demand	Anodyne	AVPR1A	20	41
O=C(c1ccc2c(c1)OC(F)(F)O2)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450682927	FG	On-Demand	Anodyne	AVPR1A	20	45
O=C(c1ccc2c(c1)OC(F)(F)O2)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450682928	FG	On-Demand	Anodyne	AVPR1A	20	45
CC(C)OC(C)(C)C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450682929	EH	On-Demand	Anodyne	NPR	47	32
CCN(CCO)CCNC(=O)c1cccc(SC)c1	ZINC000450682941	CD	On-Demand	Anodyne	DRD4	41	31
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(F)c2F)c(OC)c1	ZINC000450682942	GG	On-Demand	Anodyne	MTNR1A	61	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cccc(F)c2F)c(OC)c1	ZINC000450682942	GG	On-Demand	Anodyne	MTNR1B	54	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(F)c2F)c(OC)c1	ZINC000450682943	GG	On-Demand	Anodyne	MTNR1A	61	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccc(F)c2F)c(OC)c1	ZINC000450682943	GG	On-Demand	Anodyne	MTNR1B	54	41
CCn1ccnc1CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450682948	ED	On-Demand	Anodyne	NPY2R	49	35
CC(=O)c1ccc(C#N)c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450682975	DH	On-Demand	Mild	CASP3	50	39
CC(=O)c1ccc(C#N)c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450682975	DH	On-Demand	Mild	COLA	49	38
CC(=O)c1ccc(C#N)c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450682975	DH	On-Demand	Mild	CPT1A	44	38
CC(=O)c1ccc(C#N)c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450682975	DH	On-Demand	Mild	ITGA4	42	31
CC(=O)c1ccc(C#N)c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450682975	DH	On-Demand	Mild	CHRNA10	72	48
CC(=O)c1ccc(C#N)c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450682975	DH	On-Demand	Mild	CASP7	41	39
N#Cc1ccnc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)n1	ZINC000450682981	DH	On-Demand	Mild	MAPK1	40	33
N#Cc1ccnc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1	ZINC000450682983	DH	On-Demand	Mild	MAPK1	40	33
CCN(CCO)CCNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450682985	DD	On-Demand	Anodyne	TRPV1	0	46
CCN(CCO)CCNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450682985	DD	On-Demand	Anodyne	NCE103	26	49
CC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2C[C@H]2CCCO2)cc1	ZINC000450682994	GI	On-Demand	Anodyne	PTGDR2	15	43
CC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2C[C@@H]2CCCO2)cc1	ZINC000450682996	GI	On-Demand	Anodyne	PTGDR2	15	43
COCC[C@@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450683002	EG	On-Demand	Anodyne	P2RY12	146	37
COCC[C@@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450683002	EG	On-Demand	Anodyne	COLA	101	38
COCC[C@@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450683002	EG	On-Demand	Anodyne	CPT1A	90	38
COCC[C@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450683010	EG	On-Demand	Anodyne	P2RY12	146	37
COCC[C@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450683010	EG	On-Demand	Anodyne	COLA	101	38
COCC[C@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450683010	EG	On-Demand	Anodyne	CPT1A	90	38
COc1ccc(CNC(=O)CCSc2nncs2)c(OC)c1	ZINC000450683014	EE	On-Demand	Anodyne	MTNR1A	40	37
CC[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450683044	EH	On-Demand	Bother	CACNA1D	43	36
CN(C)[C@@H](CNC(=O)Cc1ccc(O)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000450683045	GH	On-Demand	Anodyne	CCR2	46	36
CC[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450683046	EH	On-Demand	Bother	CACNA1D	43	36
CC[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450683047	EH	On-Demand	Bother	CACNA1D	43	36
CC[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000450683049	EH	On-Demand	Bother	CACNA1D	43	36
CN(C)[C@H](CNC(=O)Cc1ccc(O)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000450683053	GH	On-Demand	Anodyne	CCR2	46	36
CCCOc1ccc(C(=O)N2CC[S@@](=O)C(CC)(CC)C2)c(OC)c1	ZINC000450683055	FG	On-Demand	Anodyne	OXTR	23	43
CCCOc1ccc(C(=O)N2CC[S@](=O)C(CC)(CC)C2)c(OC)c1	ZINC000450683057	FG	On-Demand	Anodyne	OXTR	23	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683060	GH	On-Demand	Anodyne	PPARA	18	41
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683060	GH	On-Demand	Anodyne	TACR1	26	41
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683060	GH	On-Demand	Anodyne	CCR2	35	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683060	GH	On-Demand	Anodyne	PDS	44	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683062	GH	On-Demand	Anodyne	PPARA	18	41
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683062	GH	On-Demand	Anodyne	TACR1	26	41
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683062	GH	On-Demand	Anodyne	CCR2	35	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683062	GH	On-Demand	Anodyne	PDS	44	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683064	GH	On-Demand	Anodyne	PPARA	18	41
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683064	GH	On-Demand	Anodyne	TACR1	26	41
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683064	GH	On-Demand	Anodyne	CCR2	35	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683064	GH	On-Demand	Anodyne	PDS	44	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683066	GH	On-Demand	Anodyne	PPARA	18	41
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683066	GH	On-Demand	Anodyne	TACR1	26	41
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683066	GH	On-Demand	Anodyne	CCR2	35	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683066	GH	On-Demand	Anodyne	PDS	44	40
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450683068	CF	On-Demand	Anodyne	ACACA	47	36
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450683070	CF	On-Demand	Anodyne	ACACA	47	36
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450683072	CF	On-Demand	Anodyne	ACACA	47	36
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450683074	CF	On-Demand	Anodyne	ACACA	47	36
COC(=O)C1(CN[C@@H](C)c2ccc(-c3ccccc3OC)cc2)CC1	ZINC000450683095	EH	On-Demand	Anodyne	KCNA3	40	36
COC(=O)C1(CN[C@H](C)c2ccc(-c3ccccc3OC)cc2)CC1	ZINC000450683097	EH	On-Demand	Anodyne	KCNA3	40	36
COC[C@]1(C(=O)OC)CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450683111	FF	On-Demand	Bother	LIPG	42	35
COC[C@@]1(C(=O)OC)CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450683113	FF	On-Demand	Bother	LIPG	42	35
COC[C@](C)(CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450683116	CC	On-Demand	Anodyne	NCE103	22	44
COC[C@](C)(CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450683116	CC	On-Demand	Anodyne	CAN2	0	44
COCCOC[C@@H](O)CN[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450683118	EE	On-Demand	Anodyne	ACACA	42	38
COCCOC[C@H](O)CN[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450683120	EE	On-Demand	Anodyne	ACACA	42	38
COCCOC[C@H](O)CN[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450683122	EE	On-Demand	Anodyne	ACACA	42	38
COCCOC[C@@H](O)CN[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450683123	EE	On-Demand	Anodyne	ACACA	42	38
O=C(CCCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450683128	FJ	On-Demand	Anodyne	CPT1A	92	45
O=C(CCCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450683128	FJ	On-Demand	Anodyne	CCR2	55	36
O=C(CCCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450683128	FJ	On-Demand	Anodyne	LIPG	48	32
COC[C@@](C)(CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450683129	CC	On-Demand	Anodyne	NCE103	22	44
COC[C@@](C)(CCO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450683129	CC	On-Demand	Anodyne	CAN2	0	44
O=C(CCCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450683132	FJ	On-Demand	Anodyne	CPT1A	92	45
O=C(CCCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450683132	FJ	On-Demand	Anodyne	CCR2	55	36
O=C(CCCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450683132	FJ	On-Demand	Anodyne	LIPG	48	32
CCC1(CC)CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[S@]1=O	ZINC000450683137	GG	On-Demand	Bother	PPXII	0	41
CCC1(CC)CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[S@@]1=O	ZINC000450683138	GG	On-Demand	Bother	PPXII	0	41
O=C(c1cc2n(n1)CCC2)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450683139	FI	On-Demand	Anodyne	CACNA1B	46	33
O=C(c1cc2n(n1)CCC2)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450683140	FI	On-Demand	Anodyne	CACNA1B	46	33
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683145	EF	On-Demand	Mild	CCR2	65	37
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683147	EF	On-Demand	Mild	CCR2	65	37
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683149	EF	On-Demand	Mild	CCR2	65	37
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683151	EF	On-Demand	Mild	CCR2	65	37
COCC[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450683159	GI	On-Demand	Anodyne	GRM3	15	44
COCC[C@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450683162	GI	On-Demand	Anodyne	GRM3	15	44
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2Cc3cccc(C)c3O2)o1	ZINC000450683165	EG	On-Demand	Anodyne	COLA	44	34
COCc1ccc([C@@H]2CCCN2C(=O)[C@H]2Cc3cccc(C)c3O2)o1	ZINC000450683168	EG	On-Demand	Anodyne	COLA	44	34
COCc1ccc([C@H]2CCCN2C(=O)[C@H]2Cc3cccc(C)c3O2)o1	ZINC000450683171	EG	On-Demand	Anodyne	COLA	44	34
COC[C@]1(C(=O)OC)CCN(c2nccc(OCc3ccccc3)n2)C1	ZINC000450683172	FE	On-Demand	Anodyne	SLC12A5	56	37
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H]2Cc3cccc(C)c3O2)o1	ZINC000450683173	EG	On-Demand	Anodyne	COLA	44	34
COC[C@@]1(C(=O)OC)CCN(c2nccc(OCc3ccccc3)n2)C1	ZINC000450683174	FE	On-Demand	Anodyne	SLC12A5	56	37
COC[C@@H]1CCCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450683187	EF	On-Demand	Anodyne	RIR1_HHV11	56	33
COC[C@@H]1CCCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450683187	EF	On-Demand	Anodyne	RHODESAIN	0	46
COC[C@H]1CCCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450683190	EF	On-Demand	Anodyne	RIR1_HHV11	56	33
COC[C@H]1CCCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450683190	EF	On-Demand	Anodyne	RHODESAIN	0	46
CS[C@H]1CCN(c2cc(N3CC[C@@H](SC)C3)nc(-c3ccccc3)n2)C1	ZINC000450683193	GI	On-Demand	Anodyne	P2RY12	45	33
CS[C@H]1CCN(c2cc(N3CC[C@@H](SC)C3)nc(-c3ccccc3)n2)C1	ZINC000450683193	GI	On-Demand	Anodyne	PKNB	22	44
CCn1ccnc1CNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450683198	EG	On-Demand	Anodyne	AVPR2	43	41
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000450683199	CF	On-Demand	Anodyne	ACACB	28	40
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000450683199	CF	On-Demand	Anodyne	GPR88	0	42
CS[C@@H]1CCN(c2cc(N3CC[C@@H](SC)C3)nc(-c3ccccc3)n2)C1	ZINC000450683200	GI	On-Demand	Anodyne	P2RY12	45	33
CS[C@@H]1CCN(c2cc(N3CC[C@@H](SC)C3)nc(-c3ccccc3)n2)C1	ZINC000450683200	GI	On-Demand	Anodyne	PKNB	22	44
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000450683201	CF	On-Demand	Anodyne	ACACB	28	40
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000450683201	CF	On-Demand	Anodyne	GPR88	0	42
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000450683202	CF	On-Demand	Anodyne	ACACB	28	40
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000450683202	CF	On-Demand	Anodyne	GPR88	0	42
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000450683203	CF	On-Demand	Anodyne	ACACB	28	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000450683203	CF	On-Demand	Anodyne	GPR88	0	42
CS[C@H]1CCN(c2cc(N3CC[C@H](SC)C3)nc(-c3ccccc3)n2)C1	ZINC000450683204	GI	On-Demand	Anodyne	P2RY12	45	33
CS[C@H]1CCN(c2cc(N3CC[C@H](SC)C3)nc(-c3ccccc3)n2)C1	ZINC000450683204	GI	On-Demand	Anodyne	PKNB	22	44
CC1(C(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683216	EH	On-Demand	Anodyne	ACE	45	40
CC1(C(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683216	EH	On-Demand	Anodyne	MME	60	40
CC1(C(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683216	EH	On-Demand	Anodyne	SDH1	0	47
CC1(C(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683216	EH	On-Demand	Anodyne	CTRB1	19	40
CC1(C(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683216	EH	On-Demand	Anodyne	ACE2	41	40
CC1(C(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683216	EH	On-Demand	Anodyne	NPPA	42	37
CC1(C(=O)N[C@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683218	EH	On-Demand	Anodyne	ACE	45	40
CC1(C(=O)N[C@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683218	EH	On-Demand	Anodyne	MME	60	40
CC1(C(=O)N[C@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683218	EH	On-Demand	Anodyne	SDH1	0	47
CC1(C(=O)N[C@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683218	EH	On-Demand	Anodyne	CTRB1	19	40
CC1(C(=O)N[C@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683218	EH	On-Demand	Anodyne	ACE2	41	40
CC1(C(=O)N[C@H](CCc2ccccc2)C(F)(F)F)CCC(=O)CC1	ZINC000450683218	EH	On-Demand	Anodyne	NPPA	42	37
CCOCc1nc(C)c(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)s1	ZINC000450683246	FG	On-Demand	Anodyne	AVPR1A	21	42
CCOCc1nc(C)c(C(=O)N2CC[C@]3(C2)OCc2ccccc23)s1	ZINC000450683247	FG	On-Demand	Anodyne	AVPR1A	21	42
O=S(=O)(Nc1ccc(F)c(F)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450683252	GG	On-Demand	Anodyne	MLNR	0	48
CC(C)(C(=O)NCC1(CCOCc2ccccc2)CC1)C1CCC1	ZINC000450683262	EI	On-Demand	Anodyne	AMY2	48	35
CCC[C@@](C)(CO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450683263	EG	On-Demand	Anodyne	RBP4	60	41
COC1(CSc2nnc(-c3ccc(C)cc3)o2)CCC1	ZINC000450683264	CH	On-Demand	Anodyne	GSK3B	17	44
COC1(CSc2nnc(-c3ccc(C)cc3)o2)CCC1	ZINC000450683264	CH	On-Demand	Anodyne	GSK3A	44	40
N#Cc1ccc(N2CCC(CF)CC2)cc1C(F)(F)F	ZINC000450683270	CH	On-Demand	Mild	AR	70	53
Cc1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450683290	FI	On-Demand	Anodyne	GSK3A	45	39
Cc1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450683290	FI	On-Demand	Anodyne	TERT	22	46
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000450683291	DG	On-Demand	Bother	COLA	87	34
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000450683291	DG	On-Demand	Bother	PQSD	0	53
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000450683292	DG	On-Demand	Bother	COLA	87	34
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000450683292	DG	On-Demand	Bother	PQSD	0	53
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000450683293	DG	On-Demand	Bother	COLA	87	34
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000450683293	DG	On-Demand	Bother	PQSD	0	53
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000450683294	DG	On-Demand	Bother	COLA	87	34
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000450683294	DG	On-Demand	Bother	PQSD	0	53
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450683312	FI	On-Demand	Anodyne	AVPR1A	22	48
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450683312	FI	On-Demand	Anodyne	CACNA1B	36	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450683313	FI	On-Demand	Anodyne	AVPR1A	22	48
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450683313	FI	On-Demand	Anodyne	CACNA1B	36	41
CCc1cccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450683327	DF	On-Demand	Anodyne	AVPR1A	0	47
CCc1cccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)n1	ZINC000450683328	DF	On-Demand	Anodyne	AVPR1A	0	47
CCC[C@H](OC)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683350	EG	On-Demand	Anodyne	PHES	0	41
CCC[C@H](OC)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683350	EG	On-Demand	Anodyne	PDS	40	34
CCC[C@H](OC)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683351	EG	On-Demand	Anodyne	PHES	0	41
CCC[C@H](OC)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683351	EG	On-Demand	Anodyne	PDS	40	34
CCC[C@@H](OC)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683353	EG	On-Demand	Anodyne	PHES	0	41
CCC[C@@H](OC)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683353	EG	On-Demand	Anodyne	PDS	40	34
CCC[C@@H](OC)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683355	EG	On-Demand	Anodyne	PHES	0	41
CCC[C@@H](OC)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450683355	EG	On-Demand	Anodyne	PDS	40	34
Cc1cccc(Cl)c1CN[C@H](C(=O)N1CCOCC1)C(C)C	ZINC000450683387	DF	On-Demand	Anodyne	CCR1	48	42
Cc1cccc(Cl)c1CN[C@@H](C(=O)N1CCOCC1)C(C)C	ZINC000450683391	DF	On-Demand	Anodyne	CCR1	48	42
COC(=O)c1coc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1	ZINC000450683404	DF	On-Demand	Bother	APLNR	0	40
COC(=O)c1coc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1	ZINC000450683409	DF	On-Demand	Bother	APLNR	0	40
COc1ccccc1-c1nnc(SC[C@@H]2CCCC2(F)F)o1	ZINC000450683411	EI	On-Demand	Anodyne	ALOX15	55	36
COc1ccccc1-c1nnc(SC[C@H]2CCCC2(F)F)o1	ZINC000450683413	EI	On-Demand	Anodyne	ALOX15	55	36
CN(C)[C@@H](CNC(=O)CC[C@@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1	ZINC000450683419	FE	On-Demand	Anodyne	TACR1	22	40
CN(C)[C@@H](CNC(=O)CC[C@@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1	ZINC000450683419	FE	On-Demand	Anodyne	CCR2	43	37
CN(C)[C@@H](CNC(=O)CC[C@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1	ZINC000450683420	FE	On-Demand	Anodyne	TACR1	22	40
CN(C)[C@@H](CNC(=O)CC[C@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1	ZINC000450683420	FE	On-Demand	Anodyne	CCR2	43	37
CN(C)[C@H](CNC(=O)CC[C@@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1	ZINC000450683421	FE	On-Demand	Anodyne	TACR1	22	40
CN(C)[C@H](CNC(=O)CC[C@@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1	ZINC000450683421	FE	On-Demand	Anodyne	CCR2	43	37
CN(C)[C@H](CNC(=O)CC[C@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1	ZINC000450683422	FE	On-Demand	Anodyne	TACR1	22	40
CN(C)[C@H](CNC(=O)CC[C@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1	ZINC000450683422	FE	On-Demand	Anodyne	CCR2	43	37
CC(=O)CCCCCSc1n[nH]c(-c2ccccc2)n1	ZINC000450683425	CH	On-Demand	Anodyne	HDA106	0	42
CC(=O)CCCCCSc1n[nH]c(-c2ccccc2)n1	ZINC000450683425	CH	On-Demand	Anodyne	HD1B	0	42
COC(=O)C1(CN[C@@H](C)c2ccc(OCC(C)C)cc2)CC1	ZINC000450683432	DG	On-Demand	Anodyne	GPR88	0	41
COC(=O)C1(CN[C@H](C)c2ccc(OCC(C)C)cc2)CC1	ZINC000450683433	DG	On-Demand	Anodyne	GPR88	0	41
FCC1CCN(c2ncnc3sc4c(c23)CCCC4)CC1	ZINC000450683434	DH	On-Demand	Anodyne	RBP4	21	51
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	EGFR	24	44
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	PDE3A	66	49
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	PDGFRB	79	44
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	FGFR1	0	45
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	FLT1	23	45
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	PDE3B	97	50
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	SIRT3	50	32
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	SIRT2	52	33
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	SIRT1	50	32
COc1cc2c(N3CCC(CF)CC3)ncnc2cc1F	ZINC000450683441	CF	On-Demand	Anodyne	HTT	0	44
CCC[C@@](C)(CO)NC(=O)c1ccc2cnccc2c1	ZINC000450683445	CF	On-Demand	Anodyne	AKT1	0	41
CCC[C@](C)(CO)NC(=O)c1ccc2cnccc2c1	ZINC000450683446	CF	On-Demand	Anodyne	AKT1	0	41
COC(=O)c1coc(CN[C@H](C)c2ccc(OCC(C)C)cc2)n1	ZINC000450683449	EG	On-Demand	Anodyne	ACACA	47	34
COC(=O)c1coc(CN[C@@H](C)c2ccc(OCC(C)C)cc2)n1	ZINC000450683452	EG	On-Demand	Anodyne	ACACA	47	34
COC(=O)c1ccc(CN[C@@H](C)c2cccc(N3CCCC3)c2)cc1Cl	ZINC000450683454	FJ	On-Demand	Anodyne	KCNQ2	42	40
COC(=O)c1ccc(CN[C@H](C)c2cccc(N3CCCC3)c2)cc1Cl	ZINC000450683464	FJ	On-Demand	Anodyne	KCNQ2	42	40
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450683466	GF	On-Demand	Bother	BCL2L1	85	33
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450683466	GF	On-Demand	Bother	BCL2	60	37
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450683466	GF	On-Demand	Bother	BCL2L2	43	31
CS[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450683476	DH	On-Demand	Bother	AADAC	0	40
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450683477	GF	On-Demand	Bother	BCL2L1	85	33
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450683477	GF	On-Demand	Bother	BCL2	60	37
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450683477	GF	On-Demand	Bother	BCL2L2	43	31
CS[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450683479	DH	On-Demand	Bother	AADAC	0	40
FC(F)c1ccnc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450683488	DG	On-Demand	Anodyne	CASP3	48	36
FC(F)c1ccnc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450683488	DG	On-Demand	Anodyne	CHRNA10	67	49
FC(F)c1ccnc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450683488	DG	On-Demand	Anodyne	CASP7	41	37
O=C(NCc1ccccc1N1CCCCC1)[C@@H](O)C1CCC1	ZINC000450683506	DE	On-Demand	Anodyne	KCNQ2	85	43
O=C(NCc1ccccc1N1CCCCC1)[C@H](O)C1CCC1	ZINC000450683508	DE	On-Demand	Anodyne	KCNQ2	85	43
O=C([C@H]1CC1(F)F)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450683517	DH	On-Demand	Anodyne	SRD5A2	0	42
O=C([C@@H]1CC1(F)F)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450683520	DH	On-Demand	Anodyne	SRD5A2	0	42
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450683542	CF	On-Demand	Anodyne	SIGMAR1	15	48
CCC1(CC)CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CC[S@@]1=O	ZINC000450683545	ED	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
CC[C@@H]1C[C@H]1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450683546	CF	On-Demand	Anodyne	SIGMAR1	15	48
CCC1(CC)CN(C(=O)[C@@H](NC(C)=O)C(C)(C)C)CC[S@]1=O	ZINC000450683549	ED	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
O=C(NCc1ccccc1N1CCCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450683552	GI	On-Demand	Anodyne	KCNQ2	74	43
O=C(NCc1ccccc1N1CCCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450683552	GI	On-Demand	Anodyne	SCN2A	18	41
O=C(NCc1ccccc1N1CCCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450683552	GI	On-Demand	Anodyne	SCN10A	20	41
O=C(NCc1ccccc1N1CCCCC1)C1(Cc2ccccc2)CCOCC1	ZINC000450683552	GI	On-Demand	Anodyne	SLC12A5	43	32
CCC[C@H](O)CN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450683566	DH	On-Demand	Anodyne	MAN2A1	0	40
CCC[C@H](O)CN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450683566	DH	On-Demand	Anodyne	MAN1B1	51	48
CCC[C@H](O)CN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450683566	DH	On-Demand	Anodyne	MAN1	0	40
CCC[C@@H](O)CN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450683568	DH	On-Demand	Anodyne	MAN2A1	0	40
CCC[C@@H](O)CN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450683568	DH	On-Demand	Anodyne	MAN1B1	51	48
CCC[C@@H](O)CN[C@@H](COCc1ccccc1)c1ccccc1	ZINC000450683568	DH	On-Demand	Anodyne	MAN1	0	40
COCc1ccc([C@@H]2CCCN2C(=O)Cc2cc(C)ccc2F)o1	ZINC000450683569	EH	On-Demand	Anodyne	COLA	58	35
COCc1ccc([C@@H]2CCCN2C(=O)Cc2cc(C)ccc2F)o1	ZINC000450683569	EH	On-Demand	Anodyne	CPT1A	54	35
CCC[C@H](O)CN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450683570	DH	On-Demand	Anodyne	MAN2A1	0	40
CCC[C@H](O)CN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450683570	DH	On-Demand	Anodyne	MAN1B1	51	48
CCC[C@H](O)CN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450683570	DH	On-Demand	Anodyne	MAN1	0	40
CCC[C@@H](O)CN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450683571	DH	On-Demand	Anodyne	MAN2A1	0	40
CCC[C@@H](O)CN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450683571	DH	On-Demand	Anodyne	MAN1B1	51	48
CCC[C@@H](O)CN[C@H](COCc1ccccc1)c1ccccc1	ZINC000450683571	DH	On-Demand	Anodyne	MAN1	0	40
COCc1ccc([C@H]2CCCN2C(=O)Cc2cc(C)ccc2F)o1	ZINC000450683578	EH	On-Demand	Anodyne	COLA	58	35
COCc1ccc([C@H]2CCCN2C(=O)Cc2cc(C)ccc2F)o1	ZINC000450683578	EH	On-Demand	Anodyne	CPT1A	54	35
Cc1ccc(F)c(CC(=O)NCc2nc3cc(C)ccc3n2C)c1	ZINC000450683605	EG	On-Demand	Anodyne	P2RX7	23	40
O=C(c1cnc(C2CC2)nc1)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450683608	GJ	On-Demand	Anodyne	CPT1A	41	40
O=C(c1cnc(C2CC2)nc1)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450683609	GJ	On-Demand	Anodyne	CPT1A	41	40
CC[C@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683615	DF	On-Demand	Anodyne	NQO2	22	40
CC[C@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683615	DF	On-Demand	Anodyne	TRPV1	23	40
CC[C@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683615	DF	On-Demand	Anodyne	MTNR1A	75	45
CC[C@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683615	DF	On-Demand	Anodyne	MTNR1B	62	45
CC[C@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683615	DF	On-Demand	Anodyne	ACAT	0	40
CC[C@@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683617	DF	On-Demand	Anodyne	NQO2	22	40
CC[C@@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683617	DF	On-Demand	Anodyne	TRPV1	23	40
CC[C@@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683617	DF	On-Demand	Anodyne	MTNR1A	75	45
CC[C@@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683617	DF	On-Demand	Anodyne	MTNR1B	62	45
CC[C@@H](C)[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683617	DF	On-Demand	Anodyne	ACAT	0	40
CC[C@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683618	DF	On-Demand	Anodyne	NQO2	22	40
CC[C@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683618	DF	On-Demand	Anodyne	TRPV1	23	40
CC[C@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683618	DF	On-Demand	Anodyne	MTNR1A	75	45
CC[C@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683618	DF	On-Demand	Anodyne	MTNR1B	62	45
CC[C@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683618	DF	On-Demand	Anodyne	ACAT	0	40
CC[C@@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683619	DF	On-Demand	Anodyne	NQO2	22	40
CC[C@@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683619	DF	On-Demand	Anodyne	TRPV1	23	40
CC[C@@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683619	DF	On-Demand	Anodyne	MTNR1A	75	45
CC[C@@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683619	DF	On-Demand	Anodyne	MTNR1B	62	45
CC[C@@H](C)[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450683619	DF	On-Demand	Anodyne	ACAT	0	40
Cc1cc(C#N)cc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450683626	CG	On-Demand	Mild	CHRNA10	78	51
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccc3Br)o2)C1	ZINC000450683640	FI	On-Demand	Anodyne	RTT109	0	42
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccc3Br)o2)C1	ZINC000450683641	FI	On-Demand	Anodyne	RTT109	0	42
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccc3Br)o2)C1	ZINC000450683642	FI	On-Demand	Anodyne	RTT109	0	42
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccc3Br)o2)C1	ZINC000450683644	FI	On-Demand	Anodyne	RTT109	0	42
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450683646	EJ	On-Demand	Anodyne	SLC6A1	31	42
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450683646	EJ	On-Demand	Anodyne	SLC6A3	18	45
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450683646	EJ	On-Demand	Anodyne	CCR5	23	44
N#Cc1cc(C(F)(F)F)ccc1N1CCC(CF)CC1	ZINC000450683649	CH	On-Demand	Mild	LIPG	58	41
COCC[C@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450683659	EJ	On-Demand	Anodyne	SLC6A1	31	42
COCC[C@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450683659	EJ	On-Demand	Anodyne	SLC6A3	18	45
COCC[C@H]1CCCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450683659	EJ	On-Demand	Anodyne	CCR5	23	44
COC[C@](C)(CCO)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450683662	GD	On-Demand	Mild	AR	15	41
COC[C@@](C)(CCO)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450683663	GD	On-Demand	Mild	AR	15	41
COC[C@@](C)(CCO)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450683664	GD	On-Demand	Mild	AR	15	41
COC[C@](C)(CCO)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450683665	GD	On-Demand	Mild	AR	15	41
CCC[C@H](O)CN[C@H](CC)c1cccc(S(N)(=O)=O)c1	ZINC000450683677	DD	On-Demand	Anodyne	CA2	22	47
CCC[C@H](O)CN[C@H](CC)c1cccc(S(N)(=O)=O)c1	ZINC000450683677	DD	On-Demand	Anodyne	CA4	22	47
CCC[C@H](O)CN[C@@H](CC)c1cccc(S(N)(=O)=O)c1	ZINC000450683680	DD	On-Demand	Anodyne	CA2	22	47
CCC[C@H](O)CN[C@@H](CC)c1cccc(S(N)(=O)=O)c1	ZINC000450683680	DD	On-Demand	Anodyne	CA4	22	47
CCC[C@@H](O)CN[C@@H](CC)c1cccc(S(N)(=O)=O)c1	ZINC000450683681	DD	On-Demand	Anodyne	CA2	22	47
CCC[C@@H](O)CN[C@@H](CC)c1cccc(S(N)(=O)=O)c1	ZINC000450683681	DD	On-Demand	Anodyne	CA4	22	47
CCC[C@@H](O)CN[C@H](CC)c1cccc(S(N)(=O)=O)c1	ZINC000450683683	DD	On-Demand	Anodyne	CA2	22	47
CCC[C@@H](O)CN[C@H](CC)c1cccc(S(N)(=O)=O)c1	ZINC000450683683	DD	On-Demand	Anodyne	CA4	22	47
O=C(c1cc2cccnc2s1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450683691	EH	On-Demand	Anodyne	AVPR1A	0	43
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	ACE	54	41
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	GRIN2B	61	43
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	MME	28	41
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	NTSR1	72	32
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	NTSR2	71	31
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	CCR1	37	49
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	CCR3	40	44
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	CTRB1	40	33
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	PCSK5	24	43
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	FURIN	25	43
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	SORT1	42	31
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	CAPN2	63	34
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	ACE2	41	34
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	AMP1_PLAFQ	25	51
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	GAG-PRO	48	33
CC[C@H](C)[C@@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683692	FH	On-Demand	Anodyne	F2RL1	32	40
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	ACE	54	41
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	GRIN2B	61	43
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	MME	28	41
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	NTSR1	72	32
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	NTSR2	71	31
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	CCR1	37	49
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	CCR3	40	44
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	CTRB1	40	33
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	PCSK5	24	43
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	FURIN	25	43
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	SORT1	42	31
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	CAPN2	63	34
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	ACE2	41	34
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	AMP1_PLAFQ	25	51
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	GAG-PRO	48	33
CC[C@H](C)[C@H](NCCC[C@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683693	FH	On-Demand	Anodyne	F2RL1	32	40
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	ACE	54	41
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	GRIN2B	61	43
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	MME	28	41
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	NTSR1	72	32
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	NTSR2	71	31
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	CCR1	37	49
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	CCR3	40	44
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	CTRB1	40	33
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	PCSK5	24	43
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	FURIN	25	43
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	SORT1	42	31
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	CAPN2	63	34
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	ACE2	41	34
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	AMP1_PLAFQ	25	51
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	GAG-PRO	48	33
CC[C@H](C)[C@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683694	FH	On-Demand	Anodyne	F2RL1	32	40
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	ACE	54	41
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	GRIN2B	61	43
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	MME	28	41
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	NTSR1	72	32
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	NTSR2	71	31
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	CCR1	37	49
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	CCR3	40	44
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	CTRB1	40	33
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	PCSK5	24	43
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	FURIN	25	43
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	SORT1	42	31
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	CAPN2	63	34
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	ACE2	41	34
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	AMP1_PLAFQ	25	51
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	GAG-PRO	48	33
CC[C@H](C)[C@@H](NCCC[C@@H](C)O)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683695	FH	On-Demand	Anodyne	F2RL1	32	40
CS[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450683696	EE	On-Demand	Anodyne	HTR3A	22	43
CS[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450683696	EE	On-Demand	Anodyne	HRH4	32	43
O=C(c1cc2cccnc2s1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450683697	EH	On-Demand	Anodyne	AVPR1A	0	43
CS[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450683698	EE	On-Demand	Anodyne	HTR3A	22	43
CS[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450683698	EE	On-Demand	Anodyne	HRH4	32	43
COC[C@@H]1CCCCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450683700	FG	On-Demand	Anodyne	HRH3	18	40
COC[C@H]1CCCCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450683701	FG	On-Demand	Anodyne	HRH3	18	40
CCS(=O)(=O)c1ccc(COc2ccc(C(C)=O)cc2OC)cc1	ZINC000450683703	EG	On-Demand	Anodyne	KCNA3	31	40
CCS(=O)(=O)c1ccc(COc2ccc(C(C)=O)cc2OC)cc1	ZINC000450683703	EG	On-Demand	Anodyne	ADAMTS4	29	42
CCS(=O)(=O)c1ccc(COc2ccc(C(C)=O)cc2OC)cc1	ZINC000450683703	EG	On-Demand	Anodyne	KLK_PIG	43	35
Cc1ccc(Br)cc1CC(=O)N1CCc2ccncc21	ZINC000450683704	EG	On-Demand	Anodyne	EIF2AK3	49	36
CN1CCC(CCO)(NC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450683706	FD	On-Demand	Anodyne	EPHX2	27	43
CN1CCC(CCO)(NC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450683706	FD	On-Demand	Anodyne	MCHR1	17	52
FCC1CCN(c2ncnc3cccc(I)c23)CC1	ZINC000450683708	FG	On-Demand	Anodyne	AKT2	20	40
FCC1CCN(c2ncnc3cccc(I)c23)CC1	ZINC000450683708	FG	On-Demand	Anodyne	PDE3B	45	32
FCC1CCN(c2ncnc3cccc(I)c23)CC1	ZINC000450683708	FG	On-Demand	Anodyne	SIRT3	52	34
FCC1CCN(c2ncnc3cccc(I)c23)CC1	ZINC000450683708	FG	On-Demand	Anodyne	SIRT2	52	34
FCC1CCN(c2ncnc3cccc(I)c23)CC1	ZINC000450683708	FG	On-Demand	Anodyne	SIRT1	52	34
C/C=C\COc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(COC)o2)c1	ZINC000450683709	FI	On-Demand	Anodyne	COLA	113	38
C/C=C\COc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(COC)o2)c1	ZINC000450683709	FI	On-Demand	Anodyne	CPT1A	107	38
C/C=C/COc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(COC)o2)c1	ZINC000450683710	FI	On-Demand	Anodyne	COLA	113	38
C/C=C/COc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(COC)o2)c1	ZINC000450683710	FI	On-Demand	Anodyne	CPT1A	107	38
C/C=C\COc1cccc(CC(=O)N2CCC[C@H]2c2ccc(COC)o2)c1	ZINC000450683711	FI	On-Demand	Anodyne	COLA	113	38
C/C=C\COc1cccc(CC(=O)N2CCC[C@H]2c2ccc(COC)o2)c1	ZINC000450683711	FI	On-Demand	Anodyne	CPT1A	107	38
C/C=C/COc1cccc(CC(=O)N2CCC[C@H]2c2ccc(COC)o2)c1	ZINC000450683712	FI	On-Demand	Anodyne	COLA	113	38
C/C=C/COc1cccc(CC(=O)N2CCC[C@H]2c2ccc(COC)o2)c1	ZINC000450683712	FI	On-Demand	Anodyne	CPT1A	107	38
CCC[C@@](C)(CO)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450683750	EE	On-Demand	Anodyne	PSBA	0	40
CCC[C@](C)(CO)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450683751	EE	On-Demand	Anodyne	PSBA	0	40
CCC[C@@](C)(CO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450683765	CD	On-Demand	Anodyne	NCE103	22	46
CCC[C@@](C)(CO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450683765	CD	On-Demand	Anodyne	CAN2	0	46
CCC[C@](C)(CO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450683767	CD	On-Demand	Anodyne	NCE103	22	46
CCC[C@](C)(CO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450683767	CD	On-Demand	Anodyne	CAN2	0	46
COc1cnc(N2CCC(CF)CC2)nc1N1CCC(CF)CC1	ZINC000450683773	EF	On-Demand	Anodyne	PDE3A	45	34
COc1cnc(N2CCC(CF)CC2)nc1N1CCC(CF)CC1	ZINC000450683773	EF	On-Demand	Anodyne	PDE3B	67	34
COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(-c3ccncc3)c(F)c2)o1	ZINC000450683786	GJ	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
COCc1ccc([C@H]2CCCN2C(=O)c2ccc(-c3ccncc3)c(F)c2)o1	ZINC000450683788	GJ	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
CS[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450683795	EI	On-Demand	Anodyne	ADRB2	19	50
CS[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450683795	EI	On-Demand	Anodyne	ADRB3	34	54
CS[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450683801	EI	On-Demand	Anodyne	ADRB2	19	50
CS[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450683801	EI	On-Demand	Anodyne	ADRB3	34	54
CS[C@@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450683803	CG	On-Demand	Bother	SLC6A4	15	51
CS[C@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450683804	CG	On-Demand	Bother	SLC6A4	15	51
Cc1cc(C(=O)NCC2(CCOCc3ccccc3)CC2)ncc1C(N)=O	ZINC000450683806	FF	On-Demand	Anodyne	HCN1	43	34
Cc1cc(C(=O)NCC2(CCOCc3ccccc3)CC2)ncc1C(N)=O	ZINC000450683806	FF	On-Demand	Anodyne	HCN4	40	31
COCC[C@H]1CCCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450683820	EF	On-Demand	Anodyne	ADRA2B	19	40
COCC[C@@H]1CCCCN(C(=O)C[C@H]2COc3ccccc3O2)C1	ZINC000450683821	EF	On-Demand	Anodyne	ADRA2B	19	40
COCC[C@H]1CCCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450683822	EF	On-Demand	Anodyne	ADRA2B	19	40
COCC[C@@H]1CCCCN(C(=O)C[C@@H]2COc3ccccc3O2)C1	ZINC000450683825	EF	On-Demand	Anodyne	ADRA2B	19	40
COCC[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450683857	EG	On-Demand	Anodyne	SLC6A1	40	34
COCC[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450683858	EG	On-Demand	Anodyne	SLC6A1	40	34
COCC[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450683859	EG	On-Demand	Anodyne	SLC6A1	40	34
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450683861	EG	On-Demand	Anodyne	SLC6A1	40	34
O=C(Cc1ccc(O)c(F)c1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450683873	EF	On-Demand	Anodyne	AVPR1A	17	42
O=C(Cc1ccc(O)c(F)c1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450683873	EF	On-Demand	Anodyne	MCHR1	19	41
O=C(Cc1ccc(O)c(F)c1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450683878	EF	On-Demand	Anodyne	AVPR1A	17	42
O=C(Cc1ccc(O)c(F)c1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450683878	EF	On-Demand	Anodyne	MCHR1	19	41
COc1ccc(CNC(=O)CCNC2(c3ccc4c(c3)OCO4)CC2)c(OC)c1	ZINC000450683902	GF	On-Demand	Anodyne	EDNRB	73	39
COc1ccc(CNC(=O)CCNC2(c3ccc4c(c3)OCO4)CC2)c(OC)c1	ZINC000450683902	GF	On-Demand	Anodyne	EDNRA	73	39
COc1ccc(CNC(=O)CCNC2(c3ccc4c(c3)OCO4)CC2)c(OC)c1	ZINC000450683902	GF	On-Demand	Anodyne	BMP1	57	37
COc1ccc(CNC(=O)CCNC2(c3ccc4c(c3)OCO4)CC2)c(OC)c1	ZINC000450683902	GF	On-Demand	Anodyne	SCN9A	0	40
COc1ccc(CNC(=O)CCNC2(c3ccc4c(c3)OCO4)CC2)c(OC)c1	ZINC000450683902	GF	On-Demand	Anodyne	MTNR1A	46	41
Cc1nn(C)cc1CN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450683905	DD	On-Demand	Anodyne	CTSG	16	50
COc1ccc(-c2csc3ncnc(N4CC[C@H](SC)C4)c23)cc1	ZINC000450683909	FI	On-Demand	Anodyne	PDE3A	41	36
COc1ccc(-c2csc3ncnc(N4CC[C@H](SC)C4)c23)cc1	ZINC000450683909	FI	On-Demand	Anodyne	ADRB3	30	47
COc1ccc(-c2csc3ncnc(N4CC[C@@H](SC)C4)c23)cc1	ZINC000450683920	FI	On-Demand	Anodyne	PDE3A	41	36
COc1ccc(-c2csc3ncnc(N4CC[C@@H](SC)C4)c23)cc1	ZINC000450683920	FI	On-Demand	Anodyne	ADRB3	30	47
Cn1c(SC[C@H]2C[C@H]3CC[C@H]2O3)nnc1-c1ccc(C(C)(C)C)cc1	ZINC000450683928	FI	On-Demand	Anodyne	DRD3	0	40
Cc1cccc(Cl)c1CN[C@@H](c1cnn(C)c1)C(C)(C)C	ZINC000450683943	DI	On-Demand	Anodyne	EIF2AK1	41	36
Cn1c(SC[C@@H]2C[C@H]3CC[C@H]2O3)nnc1-c1ccc(C(C)(C)C)cc1	ZINC000450683944	FI	On-Demand	Anodyne	DRD3	0	40
FCC1CCN(c2ncnc3sc4ccccc4c23)CC1	ZINC000450683948	DI	On-Demand	Anodyne	SIRT3	48	32
Cc1cccc(Cl)c1CN[C@H](c1cnn(C)c1)C(C)(C)C	ZINC000450683950	DI	On-Demand	Anodyne	EIF2AK1	41	36
Cc1cccc(Cl)c1C(=O)NCC(=O)NCC1CC1	ZINC000450683968	CD	On-Demand	Anodyne	P2RX7	17	40
Cc1cccc(Cl)c1C(=O)NCC(=O)NCC1CC1	ZINC000450683968	CD	On-Demand	Anodyne	CACNA1I	49	38
Cc1cc(C(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)nn1C(C)C	ZINC000450683989	GH	On-Demand	Anodyne	NPY5R	15	41
FCC1CCN(c2nc(N3CCOCC3)nc(N3CCC(CF)CC3)n2)CC1	ZINC000450683991	GE	On-Demand	Anodyne	PIK3CA	23	43
FCC1CCN(c2nc(N3CCOCC3)nc(N3CCC(CF)CC3)n2)CC1	ZINC000450683991	GE	On-Demand	Anodyne	PIK3CG	15	41
FCC1CCN(c2nc(N3CCOCC3)nc(N3CCC(CF)CC3)n2)CC1	ZINC000450683991	GE	On-Demand	Anodyne	PIK3CB	20	43
Cc1nsc(N2CCC[C@H]2COc2ccccc2)c1C#N	ZINC000450683995	CG	On-Demand	Mild	CHRNA10	69	50
CC[C@H](C)[C@@H](NC[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683997	GI	On-Demand	Anodyne	GRIN2B	63	38
CC[C@H](C)[C@@H](NC[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450683997	GI	On-Demand	Anodyne	CCR1	26	43
Cc1cc(C(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)nn1C(C)C	ZINC000450683999	GH	On-Demand	Anodyne	NPY5R	15	41
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1cc(F)ccc1F	ZINC000450684011	GH	On-Demand	Anodyne	MTNR1A	47	36
CC[C@H](C)[C@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450684013	GI	On-Demand	Anodyne	GRIN2B	63	38
CC[C@H](C)[C@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450684013	GI	On-Demand	Anodyne	CCR1	26	43
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1cc(F)ccc1F	ZINC000450684015	GH	On-Demand	Anodyne	MTNR1A	47	36
CC[C@H](C)[C@H](NC[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450684017	GI	On-Demand	Anodyne	GRIN2B	63	38
CC[C@H](C)[C@H](NC[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450684017	GI	On-Demand	Anodyne	CCR1	26	43
CC[C@H](C)[C@@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450684019	GI	On-Demand	Anodyne	GRIN2B	63	38
CC[C@H](C)[C@@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450684019	GI	On-Demand	Anodyne	CCR1	26	43
COC[C@@H]1CCCCN(C(=O)c2ccc(-n3nnnc3C)cc2F)C1	ZINC000450684024	ED	On-Demand	Anodyne	CCR3	18	40
COC[C@H]1CCCCN(C(=O)c2ccc(-n3nnnc3C)cc2F)C1	ZINC000450684027	ED	On-Demand	Anodyne	CCR3	18	40
CC(=O)c1cn(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)nn1	ZINC000450684038	GG	On-Demand	Anodyne	COLA	56	43
CC(=O)c1cn(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)nn1	ZINC000450684038	GG	On-Demand	Anodyne	CPT1A	54	43
CC(=O)c1cn(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)nn1	ZINC000450684040	GG	On-Demand	Anodyne	COLA	56	43
CC(=O)c1cn(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)nn1	ZINC000450684040	GG	On-Demand	Anodyne	CPT1A	54	43
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	HTR1A	28	43
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	DRD1	15	40
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	DRD4	50	43
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	HRH2	50	42
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	HTR2A	15	43
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	DRD3	41	39
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	HTR7	45	51
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	KCNQ2	75	47
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	SCN2A	19	44
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	MTNR1A	71	41
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	MTNR1B	61	41
COc1cccc(OCCC(=O)NCc2ccccc2N2CCCCC2)c1	ZINC000450684044	FH	On-Demand	Anodyne	SCN10A	15	44
COCc1ccc([C@@H]2CCCN2C(=O)c2cc3n(n2)CCCC3)o1	ZINC000450684046	EF	On-Demand	Anodyne	COLA	47	32
COCc1ccc([C@H]2CCCN2C(=O)c2cc3n(n2)CCCC3)o1	ZINC000450684050	EF	On-Demand	Anodyne	COLA	47	32
CN(C)[C@@H](CNC(=O)c1cncc(Cl)c1)c1cccc(C(F)(F)F)c1	ZINC000450684066	FH	On-Demand	Anodyne	CCR2	46	37
CN(C)[C@@H](CNC(=O)c1cncc(Cl)c1)c1cccc(C(F)(F)F)c1	ZINC000450684066	FH	On-Demand	Anodyne	PDS	42	34
CN(C)[C@H](CNC(=O)c1cncc(Cl)c1)c1cccc(C(F)(F)F)c1	ZINC000450684067	FH	On-Demand	Anodyne	CCR2	46	37
CN(C)[C@H](CNC(=O)c1cncc(Cl)c1)c1cccc(C(F)(F)F)c1	ZINC000450684067	FH	On-Demand	Anodyne	PDS	42	34
CC[C@H](CC(F)(F)F)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684070	GI	On-Demand	Anodyne	PHES	0	40
CC[C@H](CC(F)(F)F)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684070	GI	On-Demand	Anodyne	PDS	40	35
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684071	GI	On-Demand	Anodyne	PHES	0	40
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684071	GI	On-Demand	Anodyne	PDS	40	35
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684072	GI	On-Demand	Anodyne	PHES	0	40
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684072	GI	On-Demand	Anodyne	PDS	40	35
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684073	GI	On-Demand	Anodyne	PHES	0	40
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684073	GI	On-Demand	Anodyne	PDS	40	35
CC(C)[C@@H](NCC/C=C\c1ccccc1)C(=O)N1CCOCC1	ZINC000450684085	DF	On-Demand	Anodyne	DERP1	0	41
CC(C)[C@H](NCC/C=C/c1ccccc1)C(=O)N1CCOCC1	ZINC000450684086	DF	On-Demand	Anodyne	DERP1	0	41
CC(C)[C@H](NCC/C=C\c1ccccc1)C(=O)N1CCOCC1	ZINC000450684087	DF	On-Demand	Anodyne	DERP1	0	41
CC(C)[C@@H](NCC/C=C/c1ccccc1)C(=O)N1CCOCC1	ZINC000450684088	DF	On-Demand	Anodyne	DERP1	0	41
COc1ccc(CNC(=O)CCNC2(c3cccc(Cl)c3)CC2)c(OC)c1	ZINC000450684091	GH	On-Demand	Anodyne	MTNR1A	73	37
COc1ccc(CNC(=O)CCNC2(c3cccc(Cl)c3)CC2)c(OC)c1	ZINC000450684091	GH	On-Demand	Anodyne	MTNR1B	62	37
Cc1nn(C)cc1CC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684095	FF	On-Demand	Anodyne	CCR2	47	38
Cc1nn(C)cc1CC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684095	FF	On-Demand	Anodyne	PHES	0	40
Cc1nn(C)cc1CC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684096	FF	On-Demand	Anodyne	CCR2	47	38
Cc1nn(C)cc1CC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684096	FF	On-Demand	Anodyne	PHES	0	40
c1ccc(COC[C@H](NCc2nnc(C3CC3)s2)c2ccccc2)cc1	ZINC000450684098	FI	On-Demand	Anodyne	MAN1B1	50	45
c1ccc(COC[C@@H](NCc2nnc(C3CC3)s2)c2ccccc2)cc1	ZINC000450684099	FI	On-Demand	Anodyne	MAN1B1	50	45
COC[C@@]1(C(=O)OC)CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450684100	FF	On-Demand	Anodyne	RBP4	17	43
COC[C@]1(C(=O)OC)CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450684101	FF	On-Demand	Anodyne	RBP4	17	43
O=C([C@@H]1CC12CCSCC2)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450684107	FJ	On-Demand	Anodyne	SRD5A2	0	40
O=C([C@H]1CC12CCSCC2)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450684108	FJ	On-Demand	Anodyne	SRD5A2	0	40
CC[C@H](N[C@@H](C[S@](C)=O)c1ccccc1)c1ccc(Cl)cc1Cl	ZINC000450684121	FK	On-Demand	Anodyne	TACR3	15	40
CC[C@H](N[C@@H](C[S@@](C)=O)c1ccccc1)c1ccc(Cl)cc1Cl	ZINC000450684122	FK	On-Demand	Anodyne	TACR3	15	40
CC[C@H](N[C@H](C[S@](C)=O)c1ccccc1)c1ccc(Cl)cc1Cl	ZINC000450684123	FK	On-Demand	Anodyne	TACR3	15	40
CC[C@H](N[C@H](C[S@@](C)=O)c1ccccc1)c1ccc(Cl)cc1Cl	ZINC000450684124	FK	On-Demand	Anodyne	TACR3	15	40
O=C(CNC(=O)Nc1cccc(Cl)c1)NC1(CCO)CCCCC1	ZINC000450684143	FF	On-Demand	Anodyne	ACAT	0	43
FCC1CCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450684153	DI	On-Demand	Anodyne	LIPG	49	35
O=C(NC1(CCO)CCCCC1)c1ccn(CCn2cccn2)n1	ZINC000450684158	ED	On-Demand	Anodyne	HCN1	49	30
O=C(NC1(CCO)CCCCC1)c1ccn(CCn2cccn2)n1	ZINC000450684158	ED	On-Demand	Anodyne	HCN4	47	30
Cn1ccc(CN[C@@H](COc2ccccc2F)C(C)(C)C)n1	ZINC000450684168	DG	On-Demand	Anodyne	SDH1	0	40
Cn1ccc(CN[C@H](COc2ccccc2F)C(C)(C)C)n1	ZINC000450684169	DG	On-Demand	Anodyne	SDH1	0	40
O=C(NC1(CCO)CCCCC1)c1ccn(CCc2ccccc2)n1	ZINC000450684182	EF	On-Demand	Anodyne	HCN1	49	30
O=C(NC1(CCO)CCCCC1)c1ccn(CCc2ccccc2)n1	ZINC000450684182	EF	On-Demand	Anodyne	HCN4	47	30
CC#CCCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450684196	BD	On-Demand	Mild	HPGDS	22	47
CC(C)(C)OC(=O)c1cnc(N2CCC(CF)CC2)cn1	ZINC000450684197	CF	On-Demand	Anodyne	GPR119	23	43
CC(=O)CCCCCN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450684198	DE	On-Demand	Anodyne	ALDH1A1	45	38
COc1ccccc1[C@H](CNC(=O)c1ccnc(OC(F)F)c1)OC(C)C	ZINC000450684209	GH	On-Demand	Anodyne	KCNK3	41	35
COc1ccccc1[C@@H](CNC(=O)c1ccnc(OC(F)F)c1)OC(C)C	ZINC000450684210	GH	On-Demand	Anodyne	KCNK3	41	35
O=C(c1cccc2c1CCCC2)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450684211	EH	On-Demand	Anodyne	AVPR1A	15	47
O=C(c1cccc2c1CCCC2)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450684212	EH	On-Demand	Anodyne	AVPR1A	15	47
CCC[C@](C)(CO)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450684229	DE	On-Demand	Anodyne	PDEC	0	41
CCC[C@](C)(CO)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450684230	DE	On-Demand	Anodyne	PDEC	0	41
CCC[C@@](C)(CO)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450684231	DE	On-Demand	Anodyne	PDEC	0	41
CCC[C@@](C)(CO)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450684232	DE	On-Demand	Anodyne	PDEC	0	41
FCC1CCN(c2nnc(-c3ccccc3Cl)s2)CC1	ZINC000450684233	DI	On-Demand	Anodyne	HRH3	16	68
COc1cccc([C@H]2[C@H](NC(=O)c3c(C)cccc3Cl)CCN2C2CC2)c1	ZINC000450684276	GI	On-Demand	Anodyne	DRD4	46	36
COc1cccc([C@H]2[C@@H](NC(=O)c3c(C)cccc3Cl)CCN2C2CC2)c1	ZINC000450684280	GI	On-Demand	Anodyne	DRD4	46	36
COc1cccc([C@@H]2[C@@H](NC(=O)c3c(C)cccc3Cl)CCN2C2CC2)c1	ZINC000450684282	GI	On-Demand	Anodyne	DRD4	46	36
COc1cccc([C@@H]2[C@H](NC(=O)c3c(C)cccc3Cl)CCN2C2CC2)c1	ZINC000450684284	GI	On-Demand	Anodyne	DRD4	46	36
CS[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684295	EH	On-Demand	Anodyne	PRNP	46	43
CS[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684295	EH	On-Demand	Anodyne	HDAC1	32	43
CS[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684295	EH	On-Demand	Anodyne	TYK2	41	35
CS[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684295	EH	On-Demand	Anodyne	MCHR1	15	47
CS[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684295	EH	On-Demand	Anodyne	TAAR1	40	46
CS[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684295	EH	On-Demand	Anodyne	DGAT1	31	40
CS[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684295	EH	On-Demand	Anodyne	KCNK3	49	39
CS[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684297	EH	On-Demand	Anodyne	PRNP	46	43
CS[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684297	EH	On-Demand	Anodyne	HDAC1	32	43
CS[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684297	EH	On-Demand	Anodyne	TYK2	41	35
CS[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684297	EH	On-Demand	Anodyne	MCHR1	15	47
CS[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684297	EH	On-Demand	Anodyne	TAAR1	40	46
CS[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684297	EH	On-Demand	Anodyne	DGAT1	31	40
CS[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450684297	EH	On-Demand	Anodyne	KCNK3	49	39
COCc1ccc([C@@H]2CCCN2C(=O)Cn2ccc(C)n2)o1	ZINC000450684307	DE	On-Demand	Anodyne	CPT1A	55	36
COCc1ccc([C@H]2CCCN2C(=O)Cn2ccc(C)n2)o1	ZINC000450684309	DE	On-Demand	Anodyne	CPT1A	55	36
COCCOC[C@H](O)CN[C@H](C)c1cc(C)cc(C)c1	ZINC000450684312	CD	On-Demand	Anodyne	ADRB2	28	41
COCCOC[C@H](O)CN[C@@H](C)c1cc(C)cc(C)c1	ZINC000450684313	CD	On-Demand	Anodyne	ADRB2	28	41
COCCOC[C@@H](O)CN[C@@H](C)c1cc(C)cc(C)c1	ZINC000450684314	CD	On-Demand	Anodyne	ADRB2	28	41
COCCOC[C@@H](O)CN[C@H](C)c1cc(C)cc(C)c1	ZINC000450684315	CD	On-Demand	Anodyne	ADRB2	28	41
CC(C)(C)OC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000450684320	FG	On-Demand	Anodyne	CASP3	33	42
CC(C)(C)OC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000450684320	FG	On-Demand	Anodyne	COLA	58	32
CC(C)(C)OC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000450684320	FG	On-Demand	Anodyne	CPT1A	59	32
CC(C)(C)OC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000450684320	FG	On-Demand	Anodyne	CHRNA10	64	46
COc1ccc(-c2ccnc(N3CC[C@H](SC)C3)n2)cc1	ZINC000450684330	DG	On-Demand	Anodyne	DKK1	0	45
COc1ccc(-c2ccnc(N3CC[C@@H](SC)C3)n2)cc1	ZINC000450684331	DG	On-Demand	Anodyne	DKK1	0	45
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)o1	ZINC000450684363	FH	On-Demand	Anodyne	COLA	83	36
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)o1	ZINC000450684363	FH	On-Demand	Anodyne	CPT1A	72	36
CCc1cc(NCc2nccn2CC)n2ncnc2n1	ZINC000450684365	CD	On-Demand	Anodyne	DHOD	0	52
CCN(CCO)CCNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450684369	FE	On-Demand	Anodyne	PYGL	57	42
COc1cc(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684396	GJ	On-Demand	Anodyne	FKBP1A	48	34
COc1cc(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684396	GJ	On-Demand	Anodyne	OPRK1	20	52
COc1cc(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684396	GJ	On-Demand	Anodyne	TACR1	30	44
COc1cc(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684396	GJ	On-Demand	Anodyne	CPT1A	50	42
COc1cc(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684396	GJ	On-Demand	Anodyne	CCR2	27	46
COc1cc(CC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684396	GJ	On-Demand	Anodyne	LIPG	42	32
COc1cc(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684397	GJ	On-Demand	Anodyne	FKBP1A	48	34
COc1cc(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684397	GJ	On-Demand	Anodyne	OPRK1	20	52
COc1cc(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684397	GJ	On-Demand	Anodyne	TACR1	30	44
COc1cc(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684397	GJ	On-Demand	Anodyne	CPT1A	50	42
COc1cc(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684397	GJ	On-Demand	Anodyne	CCR2	27	46
COc1cc(CC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)ccc1O	ZINC000450684397	GJ	On-Demand	Anodyne	LIPG	42	32
CC1(O)CC(C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000450684423	EH	On-Demand	Anodyne	TACR1	22	44
CC1(O)CC(C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000450684423	EH	On-Demand	Anodyne	CACNA1B	55	36
CC1(O)CC(C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000450684423	EH	On-Demand	Anodyne	CCR2	52	38
CC1(O)CC(C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000450684423	EH	On-Demand	Anodyne	WNT3	41	32
CC1(O)CC(C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000450684424	EH	On-Demand	Anodyne	TACR1	22	44
CC1(O)CC(C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000450684424	EH	On-Demand	Anodyne	CACNA1B	55	36
CC1(O)CC(C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000450684424	EH	On-Demand	Anodyne	CCR2	52	38
CC1(O)CC(C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000450684424	EH	On-Demand	Anodyne	WNT3	41	32
CCOC(=O)c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450684450	EG	On-Demand	Anodyne	CASP3	59	40
CCOC(=O)c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450684450	EG	On-Demand	Anodyne	CHRNA7	22	41
CCOC(=O)c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450684450	EG	On-Demand	Anodyne	COLA	51	37
CCOC(=O)c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450684450	EG	On-Demand	Anodyne	CPT1A	51	33
CCOC(=O)c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450684450	EG	On-Demand	Anodyne	CHRNA10	64	46
CCOC(=O)c1cnccc1N1CCC[C@H]1COc1ccccc1	ZINC000450684450	EG	On-Demand	Anodyne	CASP7	43	39
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)o1	ZINC000450684455	GK	On-Demand	Anodyne	CPT1A	109	43
COCC[C@@H]1CCCCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450684458	DH	On-Demand	Anodyne	L3MBTL3	44	33
COCC[C@H]1CCCCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450684459	DH	On-Demand	Anodyne	L3MBTL3	44	33
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)o1	ZINC000450684460	GK	On-Demand	Anodyne	CPT1A	109	43
COc1cccc(OCCC(=O)NC2(CCO)CCN(C)CC2)c1	ZINC000450684466	ED	On-Demand	Anodyne	DRD4	43	32
COc1cccc(OCCC(=O)NC2(CCO)CCN(C)CC2)c1	ZINC000450684466	ED	On-Demand	Anodyne	MTNR1A	31	44
CS[C@H]1CCN(c2ncccc2C(=O)Nc2ccc(Br)cc2)C1	ZINC000450684478	GI	On-Demand	Anodyne	TRPV1	19	46
CS[C@@H]1CCN(c2ncccc2C(=O)Nc2ccc(Br)cc2)C1	ZINC000450684480	GI	On-Demand	Anodyne	TRPV1	19	46
COc1cc(CC(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)ccc1O	ZINC000450684487	DH	On-Demand	Anodyne	TRPV1	32	48
COc1cc(CC(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)ccc1O	ZINC000450684487	DH	On-Demand	Anodyne	NCE103	28	46
COc1cc(CC(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)ccc1O	ZINC000450684487	DH	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)N[C@H]2CCC[C@H](C(C)C)CC2)ccc1O	ZINC000450684488	DH	On-Demand	Anodyne	TRPV1	32	48
COc1cc(CC(=O)N[C@H]2CCC[C@H](C(C)C)CC2)ccc1O	ZINC000450684488	DH	On-Demand	Anodyne	NCE103	28	46
COc1cc(CC(=O)N[C@H]2CCC[C@H](C(C)C)CC2)ccc1O	ZINC000450684488	DH	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)ccc1O	ZINC000450684489	DH	On-Demand	Anodyne	TRPV1	32	48
COc1cc(CC(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)ccc1O	ZINC000450684489	DH	On-Demand	Anodyne	NCE103	28	46
COc1cc(CC(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)ccc1O	ZINC000450684489	DH	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)ccc1O	ZINC000450684490	DH	On-Demand	Anodyne	TRPV1	32	48
COc1cc(CC(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)ccc1O	ZINC000450684490	DH	On-Demand	Anodyne	NCE103	28	46
COc1cc(CC(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)ccc1O	ZINC000450684490	DH	On-Demand	Anodyne	CAN2	0	46
OCCOc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450684491	DD	On-Demand	Anodyne	CASP3	44	37
OCCOc1cncc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450684491	DD	On-Demand	Anodyne	CHRNA10	63	46
COC[C@]1(C(=O)OC)CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450684507	EF	On-Demand	Anodyne	LUCI_LUCLA	30	41
COC[C@@]1(C(=O)OC)CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450684508	EF	On-Demand	Anodyne	LUCI_LUCLA	30	41
COC[C@]1(C(=O)OC)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450684511	GG	On-Demand	Anodyne	ADRB2	18	48
COC[C@]1(C(=O)OC)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450684511	GG	On-Demand	Anodyne	ADRB3	33	51
COC[C@@]1(C(=O)OC)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450684512	GG	On-Demand	Anodyne	ADRB2	18	48
COC[C@@]1(C(=O)OC)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450684512	GG	On-Demand	Anodyne	ADRB3	33	51
CCC1(CC)CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[S@]1=O	ZINC000450684513	GF	On-Demand	Bother	CACNA1D	49	32
CCC1(CC)CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[S@@]1=O	ZINC000450684514	GF	On-Demand	Bother	CACNA1D	49	32
CC(=O)[C@](C)(O)CN[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450684546	CD	On-Demand	Bother	PQSD	0	40
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450684547	CD	On-Demand	Bother	PQSD	0	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450684548	CD	On-Demand	Bother	PQSD	0	40
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450684549	CD	On-Demand	Bother	PQSD	0	40
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2)C2CC2)c(OC)c1	ZINC000450684550	FG	On-Demand	Anodyne	MTNR1A	63	38
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2)C2CC2)c(OC)c1	ZINC000450684550	FG	On-Demand	Anodyne	MTNR1B	53	35
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2)C2CC2)c(OC)c1	ZINC000450684551	FG	On-Demand	Anodyne	MTNR1A	63	38
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2)C2CC2)c(OC)c1	ZINC000450684551	FG	On-Demand	Anodyne	MTNR1B	53	35
COCc1nn(C)cc1C(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450684566	FG	On-Demand	Anodyne	SLC12A5	53	38
COCc1nn(C)cc1C(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450684566	FG	On-Demand	Anodyne	HCN1	70	42
COCc1nn(C)cc1C(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450684566	FG	On-Demand	Anodyne	HCN4	59	38
CCOC(=O)c1cc(C(=O)NC[C@H](OC(C)C)c2ccccc2OC)[nH]c1C	ZINC000450684569	GG	On-Demand	Anodyne	KCNK3	42	38
CCOC(=O)c1cc(C(=O)NC[C@@H](OC(C)C)c2ccccc2OC)[nH]c1C	ZINC000450684570	GG	On-Demand	Anodyne	KCNK3	42	38
CC(=O)c1cn(CC(=O)NCC2(Cc3ccccc3)CCCCC2)nn1	ZINC000450684580	FF	On-Demand	Anodyne	NPFFR2	34	43
CC(=O)c1cn(CC(=O)NCC2(Cc3ccccc3)CCCCC2)nn1	ZINC000450684580	FF	On-Demand	Anodyne	NPFFR1	52	46
CC(=O)c1cn(CC(=O)NCC2(Cc3ccccc3)CCCCC2)nn1	ZINC000450684580	FF	On-Demand	Anodyne	HCN4	47	31
CCc1nc(C)c(CSc2nnc(-c3ccc(C)cc3)o2)o1	ZINC000450684581	DI	On-Demand	Anodyne	GSK3B	15	42
CCc1nc(C)c(CSc2nnc(-c3ccc(C)cc3)o2)o1	ZINC000450684581	DI	On-Demand	Anodyne	GSK3A	40	42
CCc1nc(C)c(CSc2nnc(-c3ccc(C)cc3)o2)o1	ZINC000450684581	DI	On-Demand	Anodyne	TERT	26	46
COc1ccccc1[C@H](CNC(=O)Cc1cc(C)ccc1F)OC(C)C	ZINC000450684584	FH	On-Demand	Anodyne	KCNK3	51	40
COc1ccccc1[C@H](CNC(=O)Cc1cc(C)ccc1F)OC(C)C	ZINC000450684584	FH	On-Demand	Anodyne	KCNK9	43	40
COc1ccccc1[C@@H](CNC(=O)Cc1cc(C)ccc1F)OC(C)C	ZINC000450684585	FH	On-Demand	Anodyne	KCNK3	51	40
COc1ccccc1[C@@H](CNC(=O)Cc1cc(C)ccc1F)OC(C)C	ZINC000450684585	FH	On-Demand	Anodyne	KCNK9	43	40
CCNC(=O)c1ccc(N2CCC(CF)CC2)nn1	ZINC000450684594	CD	On-Demand	Anodyne	SCD1	65	49
CCNC(=O)c1ccc(N2CCC(CF)CC2)nn1	ZINC000450684594	CD	On-Demand	Anodyne	SCD	52	46
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CCC(CF)CC1	ZINC000450684595	GG	On-Demand	Bother	CASP3	23	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CCC(CF)CC1	ZINC000450684595	GG	On-Demand	Bother	CASP7	34	41
O=C(c1cc2n(n1)CCCC2)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450684596	DE	On-Demand	Anodyne	AVPR1A	21	46
O=C(c1cc2n(n1)CCCC2)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450684597	DE	On-Demand	Anodyne	AVPR1A	21	46
CO[C@@H](Cc1ccccc1)C(=O)NC1(CCO)CCCCC1	ZINC000450684598	DE	On-Demand	Anodyne	TIMP3	42	35
CO[C@@H](Cc1ccccc1)C(=O)NC1(CCO)CCCCC1	ZINC000450684598	DE	On-Demand	Anodyne	ECE1	37	41
CO[C@H](Cc1ccccc1)C(=O)NC1(CCO)CCCCC1	ZINC000450684599	DE	On-Demand	Anodyne	TIMP3	42	35
CO[C@H](Cc1ccccc1)C(=O)NC1(CCO)CCCCC1	ZINC000450684599	DE	On-Demand	Anodyne	ECE1	37	41
CC(F)(F)CCN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450684607	CE	On-Demand	Anodyne	ALDH1A1	38	40
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450684618	EG	On-Demand	Anodyne	AVPR1A	0	48
O=C(c1ccc(C(F)(F)F)[nH]1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450684619	EG	On-Demand	Anodyne	AVPR1A	0	48
COc1ccccc1[C@H](CNC(=O)Cc1ccc(O)c(F)c1)OC(C)C	ZINC000450684629	FG	On-Demand	Anodyne	TRPV1	35	46
COc1ccccc1[C@@H](CNC(=O)Cc1ccc(O)c(F)c1)OC(C)C	ZINC000450684630	FG	On-Demand	Anodyne	TRPV1	35	46
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	HTR1A	40	57
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	DRD2	47	75
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	DRD1	37	62
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	DRD4	48	62
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	HTR2A	41	69
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	HTR2C	27	56
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	DRD3	28	46
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	DRD5	24	46
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	ERG2	24	53
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	HTR7	45	53
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	SLC18A3	0	51
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	CYP2J2	53	37
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	NET	0	57
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	AP2S1	0	53
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccc(F)cc1	ZINC000450684646	EG	On-Demand	Anodyne	SLC27A1	65	49
O=C1CC[C@@H](CCC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)N1	ZINC000450684650	FF	On-Demand	Anodyne	CCR3	27	41
O=C1CC[C@H](CCC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)N1	ZINC000450684651	FF	On-Demand	Anodyne	CCR3	27	41
O=C(c1cncc(Cl)c1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450684659	DH	On-Demand	Anodyne	HSD11B1	0	45
O=C(c1cncc(Cl)c1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450684659	DH	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1cncc(Cl)c1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450684659	DH	On-Demand	Anodyne	L3MBTL3	44	33
O=C(c1cncc(Cl)c1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450684660	DH	On-Demand	Anodyne	HSD11B1	0	45
O=C(c1cncc(Cl)c1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450684660	DH	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1cncc(Cl)c1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450684660	DH	On-Demand	Anodyne	L3MBTL3	44	33
COc1cc(CC(=O)N(C)CCN(C)CC(F)F)ccc1Cl	ZINC000450684663	EF	On-Demand	Anodyne	OPRK1	0	48
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(C)c(F)c2)c(OC)c1	ZINC000450684665	FH	On-Demand	Anodyne	TRPV1	59	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(C)c(F)c2)c(OC)c1	ZINC000450684665	FH	On-Demand	Anodyne	MTNR1A	48	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(C)c(F)c2)c(OC)c1	ZINC000450684666	FH	On-Demand	Anodyne	TRPV1	59	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(C)c(F)c2)c(OC)c1	ZINC000450684666	FH	On-Demand	Anodyne	MTNR1A	48	38
CCOC(=O)c1cnc2c(OC)cccc2c1NCc1nccn1CC	ZINC000450684667	FG	On-Demand	Anodyne	ATP4A	15	58
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450684710	FJ	On-Demand	Anodyne	CCR3	26	40
CC[C@H](CC(F)(F)F)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450684711	FJ	On-Demand	Anodyne	CCR3	26	40
COC[C@@H]1CCCCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684724	FF	On-Demand	Anodyne	COLA	60	36
COC[C@@H]1CCCCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684724	FF	On-Demand	Anodyne	CPT1A	57	36
COC[C@@H]1CCCCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684724	FF	On-Demand	Anodyne	PREP	41	35
COC[C@H]1CCCCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684725	FF	On-Demand	Anodyne	COLA	60	36
COC[C@H]1CCCCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684725	FF	On-Demand	Anodyne	CPT1A	57	36
COC[C@H]1CCCCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684725	FF	On-Demand	Anodyne	PREP	41	35
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684726	FF	On-Demand	Anodyne	COLA	60	36
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684726	FF	On-Demand	Anodyne	CPT1A	57	36
COC[C@@H]1CCCCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684726	FF	On-Demand	Anodyne	PREP	41	35
COC[C@H]1CCCCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684727	FF	On-Demand	Anodyne	COLA	60	36
COC[C@H]1CCCCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684727	FF	On-Demand	Anodyne	CPT1A	57	36
COC[C@H]1CCCCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)C1	ZINC000450684727	FF	On-Demand	Anodyne	PREP	41	35
COC[C@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450684738	DF	On-Demand	Anodyne	ACE	46	38
COC[C@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450684738	DF	On-Demand	Anodyne	FKBP1A	40	39
COC[C@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450684738	DF	On-Demand	Anodyne	MME	31	41
COC[C@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450684738	DF	On-Demand	Anodyne	REN	52	46
COC[C@@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450684739	DF	On-Demand	Anodyne	ACE	46	38
COC[C@@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450684739	DF	On-Demand	Anodyne	FKBP1A	40	39
COC[C@@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450684739	DF	On-Demand	Anodyne	MME	31	41
COC[C@@H]1CCCCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450684739	DF	On-Demand	Anodyne	REN	52	46
COC[C@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450684740	DF	On-Demand	Anodyne	ACE	46	38
COC[C@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450684740	DF	On-Demand	Anodyne	FKBP1A	40	39
COC[C@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450684740	DF	On-Demand	Anodyne	MME	31	41
COC[C@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450684740	DF	On-Demand	Anodyne	REN	52	46
COC[C@@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450684741	DF	On-Demand	Anodyne	ACE	46	38
COC[C@@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450684741	DF	On-Demand	Anodyne	FKBP1A	40	39
COC[C@@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450684741	DF	On-Demand	Anodyne	MME	31	41
COC[C@@H]1CCCCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450684741	DF	On-Demand	Anodyne	REN	52	46
Cc1c(C(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)nn2c1OCCC2	ZINC000450684751	DG	On-Demand	Anodyne	MAPK13	43	32
Cc1c(C(=O)N[C@H]2CCC[C@H](C(C)C)CC2)nn2c1OCCC2	ZINC000450684755	DG	On-Demand	Anodyne	MAPK13	43	32
Cc1c(C(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)nn2c1OCCC2	ZINC000450684757	DG	On-Demand	Anodyne	MAPK13	43	32
Cc1c(C(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)nn2c1OCCC2	ZINC000450684758	DG	On-Demand	Anodyne	MAPK13	43	32
CCN(CCO)CCNC(=O)c1cc2ccncc2s1	ZINC000450684759	CD	On-Demand	Anodyne	SELE	28	42
C[C@H](NC[C@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684765	DH	On-Demand	Anodyne	ADAM17	29	41
C[C@H](NC[C@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684765	DH	On-Demand	Anodyne	AMP1_PLAFQ	40	42
C[C@H](NC[C@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684765	DH	On-Demand	Anodyne	LAP	0	42
C[C@@H](NC[C@@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684769	DH	On-Demand	Anodyne	ADAM17	29	41
C[C@@H](NC[C@@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684769	DH	On-Demand	Anodyne	AMP1_PLAFQ	40	42
C[C@@H](NC[C@@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684769	DH	On-Demand	Anodyne	LAP	0	42
C[C@@H](NC[C@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684771	DH	On-Demand	Anodyne	ADAM17	29	41
C[C@@H](NC[C@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684771	DH	On-Demand	Anodyne	AMP1_PLAFQ	40	42
C[C@@H](NC[C@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684771	DH	On-Demand	Anodyne	LAP	0	42
C[C@H](NC[C@@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684773	DH	On-Demand	Anodyne	ADAM17	29	41
C[C@H](NC[C@@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684773	DH	On-Demand	Anodyne	AMP1_PLAFQ	40	42
C[C@H](NC[C@@H]1CCCC1(F)F)c1ccc(-n2cccn2)cc1	ZINC000450684773	DH	On-Demand	Anodyne	LAP	0	42
CS[C@@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450684778	FG	On-Demand	Anodyne	PDE3A	44	33
CS[C@@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450684778	FG	On-Demand	Anodyne	PDE3B	65	35
O=C1CC[C@H](CCC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)N1	ZINC000450684779	FH	On-Demand	Anodyne	COLA	80	44
O=C1CC[C@H](CCC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)N1	ZINC000450684779	FH	On-Demand	Anodyne	CPT1A	67	44
O=C1CC[C@@H](CCC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)N1	ZINC000450684780	FH	On-Demand	Anodyne	COLA	80	44
O=C1CC[C@@H](CCC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)N1	ZINC000450684780	FH	On-Demand	Anodyne	CPT1A	67	44
O=C1CC[C@H](CCC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)N1	ZINC000450684782	FH	On-Demand	Anodyne	COLA	80	44
O=C1CC[C@H](CCC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)N1	ZINC000450684782	FH	On-Demand	Anodyne	CPT1A	67	44
O=C1CC[C@@H](CCC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)N1	ZINC000450684784	FH	On-Demand	Anodyne	COLA	80	44
O=C1CC[C@@H](CCC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)N1	ZINC000450684784	FH	On-Demand	Anodyne	CPT1A	67	44
CS[C@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450684793	FG	On-Demand	Anodyne	PDE3A	44	33
CS[C@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450684793	FG	On-Demand	Anodyne	PDE3B	65	35
O=C(c1cc2n(n1)CCCC2)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450684795	EG	On-Demand	Anodyne	L3MBTL3	45	33
O=C(c1cc2n(n1)CCCC2)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450684798	EG	On-Demand	Anodyne	L3MBTL3	45	33
O=C(Cc1ccc(O)c(F)c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450684801	FH	On-Demand	Anodyne	GRIN2B	39	40
O=C(Cc1ccc(O)c(F)c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450684801	FH	On-Demand	Anodyne	CCR3	35	50
O=C(Cc1ccc(O)c(F)c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450684801	FH	On-Demand	Anodyne	MLNR	28	42
CC(F)(F)CCSc1nc2ccccc2c(=O)n1C[C@H]1CCCO1	ZINC000450684815	FH	On-Demand	Anodyne	PDE8B	46	36
CC(F)(F)CCSc1nc2ccccc2c(=O)n1C[C@@H]1CCCO1	ZINC000450684817	FH	On-Demand	Anodyne	PDE8B	46	36
OCCC[C@@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450684841	CF	On-Demand	Anodyne	MAN1B1	50	31
OCCC[C@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450684842	CF	On-Demand	Anodyne	MAN1B1	50	31
OCCC[C@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450684843	CF	On-Demand	Anodyne	MAN1B1	50	31
OCCC[C@@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1	ZINC000450684844	CF	On-Demand	Anodyne	MAN1B1	50	31
COC(=O)c1ccc(CNC2(c3cccc(F)c3)CC2)cc1Cl	ZINC000450684845	EI	On-Demand	Anodyne	ALOX5AP	16	40
C[C@@H](O)CCSc1nnc(-c2ccccc2Br)o1	ZINC000450684854	EG	On-Demand	Anodyne	ALOX15	49	35
CCSc1cccnc1C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684856	GI	On-Demand	Anodyne	PDS	40	35
CO[C@H](Cc1ccccc1)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450684858	EF	On-Demand	Anodyne	DRD4	22	42
CO[C@H](Cc1ccccc1)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450684858	EF	On-Demand	Anodyne	ABCB1	30	41
C[C@H](O)CCSc1nnc(-c2ccccc2Br)o1	ZINC000450684859	EG	On-Demand	Anodyne	ALOX15	49	35
COCc1ccc([C@@H]2CCCN2C(=O)c2cc3cccnc3s2)o1	ZINC000450684860	EI	On-Demand	Anodyne	CPT1A	88	37
COCc1ccc([C@H]2CCCN2C(=O)c2cc3cccnc3s2)o1	ZINC000450684861	EI	On-Demand	Anodyne	CPT1A	88	37
COC[C@@H]1CCCCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450684862	EF	On-Demand	Anodyne	L3MBTL3	43	34
CCSc1cccnc1C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450684863	GI	On-Demand	Anodyne	PDS	40	35
COC[C@H]1CCCCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450684865	EF	On-Demand	Anodyne	L3MBTL3	43	34
CO[C@@H](Cc1ccccc1)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450684870	EF	On-Demand	Anodyne	DRD4	22	42
CO[C@@H](Cc1ccccc1)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450684870	EF	On-Demand	Anodyne	ABCB1	30	41
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450684876	EG	On-Demand	Anodyne	DPP4	18	42
C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450684878	EG	On-Demand	Anodyne	DPP4	18	42
C[C@H](Oc1ccccn1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450684880	EG	On-Demand	Anodyne	DPP4	18	42
C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450684882	EG	On-Demand	Anodyne	DPP4	18	42
CS[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450684908	DG	On-Demand	Anodyne	PDE3A	53	40
CS[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450684908	DG	On-Demand	Anodyne	PDE3B	79	41
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450684915	FE	On-Demand	Anodyne	DRD2	31	41
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450684915	FE	On-Demand	Anodyne	DRD4	20	48
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450684915	FE	On-Demand	Anodyne	HTR2A	23	46
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450684915	FE	On-Demand	Anodyne	ERG2	19	41
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450684915	FE	On-Demand	Anodyne	CYP2J2	48	35
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450684917	FE	On-Demand	Anodyne	DRD2	31	41
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450684917	FE	On-Demand	Anodyne	DRD4	20	48
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450684917	FE	On-Demand	Anodyne	HTR2A	23	46
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450684917	FE	On-Demand	Anodyne	ERG2	19	41
COC(=O)CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450684917	FE	On-Demand	Anodyne	CYP2J2	48	35
CS[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450684922	DG	On-Demand	Anodyne	PDE3A	53	40
CS[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450684922	DG	On-Demand	Anodyne	PDE3B	79	41
COC[C@@]1(C(=O)OC)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450684945	GE	On-Demand	Anodyne	AVPR2	54	38
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1ncc(-c2ccccc2)s1	ZINC000450684946	EI	On-Demand	Anodyne	SLC18A3	21	40
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1ncc(-c2ccccc2)s1	ZINC000450684946	EI	On-Demand	Anodyne	LUCI_LUCLA	17	41
COC[C@]1(C(=O)OC)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450684948	GE	On-Demand	Anodyne	AVPR2	54	38
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1ncc(-c2ccccc2)s1	ZINC000450684949	EI	On-Demand	Anodyne	SLC18A3	21	40
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1ncc(-c2ccccc2)s1	ZINC000450684949	EI	On-Demand	Anodyne	LUCI_LUCLA	17	41
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1ncc(-c2ccccc2)s1	ZINC000450684952	EI	On-Demand	Anodyne	SLC18A3	21	40
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1ncc(-c2ccccc2)s1	ZINC000450684952	EI	On-Demand	Anodyne	LUCI_LUCLA	17	41
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1ncc(-c2ccccc2)s1	ZINC000450684954	EI	On-Demand	Anodyne	SLC18A3	21	40
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1ncc(-c2ccccc2)s1	ZINC000450684954	EI	On-Demand	Anodyne	LUCI_LUCLA	17	41
COCC1(O)CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450684980	CC	On-Demand	Anodyne	PDE3A	52	39
COCC1(O)CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450684980	CC	On-Demand	Anodyne	PDGFRB	71	42
COCC1(O)CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450684980	CC	On-Demand	Anodyne	PDE3B	77	39
C[C@@H](CC(C)(C)O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450684997	DG	On-Demand	Bother	MAOB	22	51
C[C@H](CC(C)(C)O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450685006	DG	On-Demand	Bother	MAOB	22	51
O=C(c1cc2c([nH]1)CCCC2)N1CC=C(c2c(F)cccc2F)CC1	ZINC000450685013	EI	On-Demand	Anodyne	HRH4	23	52
CO[C@@H](CN[C@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685016	ED	On-Demand	Anodyne	MME	28	40
CO[C@@H](CN[C@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685016	ED	On-Demand	Anodyne	CTSS	23	42
CO[C@@H](CN[C@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685016	ED	On-Demand	Anodyne	POL	0	51
CO[C@@H](CN[C@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685016	ED	On-Demand	Anodyne	DERP1	0	44
CO[C@@H](CN[C@@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685018	ED	On-Demand	Anodyne	MME	28	40
CO[C@@H](CN[C@@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685018	ED	On-Demand	Anodyne	CTSS	23	42
CO[C@@H](CN[C@@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685018	ED	On-Demand	Anodyne	POL	0	51
CO[C@@H](CN[C@@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685018	ED	On-Demand	Anodyne	DERP1	0	44
CO[C@H](CN[C@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685020	ED	On-Demand	Anodyne	MME	28	40
CO[C@H](CN[C@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685020	ED	On-Demand	Anodyne	CTSS	23	42
CO[C@H](CN[C@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685020	ED	On-Demand	Anodyne	POL	0	51
CO[C@H](CN[C@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685020	ED	On-Demand	Anodyne	DERP1	0	44
COC(=O)C1(CN[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)CC1	ZINC000450685041	FF	On-Demand	Anodyne	PRNP	50	37
COC(=O)C1(CN[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)CC1	ZINC000450685042	FF	On-Demand	Anodyne	PRNP	50	37
Cn1nc(C(=O)NCC2(CCOCc3ccccc3)CC2)c2c1CCCC2	ZINC000450685043	FG	On-Demand	Anodyne	HCN1	48	30
Cn1nc(C(=O)NCC2(CCOCc3ccccc3)CC2)c2c1CCCC2	ZINC000450685043	FG	On-Demand	Anodyne	HCN4	46	30
CS[C@H]1CCN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450685054	GG	On-Demand	Bother	BCL2L1	47	34
CS[C@@H]1CCN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450685055	GG	On-Demand	Bother	BCL2L1	47	34
COCC[C@@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450685062	EG	On-Demand	Anodyne	FKBP1A	46	36
COCC[C@@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450685062	EG	On-Demand	Anodyne	REN	41	38
COCC[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450685063	EG	On-Demand	Anodyne	FKBP1A	46	36
COCC[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450685063	EG	On-Demand	Anodyne	REN	41	38
COCC[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450685064	EG	On-Demand	Anodyne	FKBP1A	46	36
COCC[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450685064	EG	On-Demand	Anodyne	REN	41	38
COCC[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450685066	EG	On-Demand	Anodyne	FKBP1A	46	36
COCC[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450685066	EG	On-Demand	Anodyne	REN	41	38
CC#CCCNC(=O)CCOc1cccc(OC)c1	ZINC000450685089	CD	On-Demand	Mild	DRD4	41	31
CC#CCCNC(=O)CCOc1cccc(OC)c1	ZINC000450685089	CD	On-Demand	Mild	MTNR1A	74	44
CC#CCCNC(=O)CCOc1cccc(OC)c1	ZINC000450685089	CD	On-Demand	Mild	MTNR1B	58	44
Cc1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450685102	CH	On-Demand	Anodyne	TERT	21	46
Cc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450685103	CH	On-Demand	Anodyne	GSK3A	44	36
Cc1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450685103	CH	On-Demand	Anodyne	TERT	21	46
C[C@H]1CN(c2nc3ccccc3nc2N2CCC(CF)CC2)C[C@@H](C)O1	ZINC000450685112	FG	On-Demand	Anodyne	PDE1B	0	43
C[C@H]1CN(c2nc3ccccc3nc2N2CCC(CF)CC2)C[C@H](C)O1	ZINC000450685113	FG	On-Demand	Anodyne	PDE1B	0	43
C[C@@H]1CN(c2nc3ccccc3nc2N2CCC(CF)CC2)C[C@@H](C)O1	ZINC000450685114	FG	On-Demand	Anodyne	PDE1B	0	43
COc1ccccc1[C@@H](CNC(=O)C(C)(C)C1CCC1)OC(C)C	ZINC000450685115	EI	On-Demand	Anodyne	AMY2	46	31
COc1ccccc1[C@H](CNC(=O)C(C)(C)C1CCC1)OC(C)C	ZINC000450685116	EI	On-Demand	Anodyne	AMY2	46	31
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1	ZINC000450685117	GF	On-Demand	Bother	COLA	56	37
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1	ZINC000450685117	GF	On-Demand	Bother	MTNR1A	51	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1	ZINC000450685117	GF	On-Demand	Bother	MTNR1B	41	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1	ZINC000450685118	GF	On-Demand	Bother	COLA	56	37
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1	ZINC000450685118	GF	On-Demand	Bother	MTNR1A	51	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1	ZINC000450685118	GF	On-Demand	Bother	MTNR1B	41	38
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N1CCC(CF)CC1	ZINC000450685132	GH	On-Demand	Bother	CASP3	27	41
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N1CCC(CF)CC1	ZINC000450685132	GH	On-Demand	Bother	CASP7	35	41
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N1CCC(CF)CC1	ZINC000450685132	GH	On-Demand	Bother	BCL2L1	45	34
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N1CCC(CF)CC1	ZINC000450685132	GH	On-Demand	Bother	LIMK2	20	40
FCC1CCN(c2nccc(OCc3ccccc3)n2)CC1	ZINC000450685144	DG	On-Demand	Anodyne	DKK1	0	41
CO[C@H](CN[C@@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685182	ED	On-Demand	Anodyne	MME	28	40
CO[C@H](CN[C@@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685182	ED	On-Demand	Anodyne	CTSS	23	42
CO[C@H](CN[C@@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685182	ED	On-Demand	Anodyne	POL	0	51
CO[C@H](CN[C@@H](C(=O)N1CCOCC1)C(C)C)Cc1ccccc1	ZINC000450685182	ED	On-Demand	Anodyne	DERP1	0	44
CC[C@@H]1C[C@H]1C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450685184	EG	On-Demand	Anodyne	CCR2	40	36
CC[C@@H]1C[C@H]1C(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450685184	EG	On-Demand	Anodyne	PDS	41	33
CC[C@@H]1C[C@H]1C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450685185	EG	On-Demand	Anodyne	CCR2	40	36
CC[C@@H]1C[C@H]1C(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450685185	EG	On-Demand	Anodyne	PDS	41	33
O=C(CC1CC(F)(F)C1)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450685205	EI	On-Demand	Anodyne	SRD5A2	21	43
COc1ccccc1-c1nnc(SCC2(OC)CCC2)n1C	ZINC000450685218	DG	On-Demand	Anodyne	DRD3	33	41
COc1ccccc1-c1nnc(SCC2(OC)CCC2)n1C	ZINC000450685218	DG	On-Demand	Anodyne	KCNH2	18	44
Cc1[nH]c(C#N)cc1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450685228	EH	On-Demand	Mild	CHRM2	15	40
Cc1[nH]c(C#N)cc1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450685228	EH	On-Demand	Mild	GRIN2B	45	42
Cc1[nH]c(C#N)cc1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450685228	EH	On-Demand	Mild	CCR3	40	40
Cc1[nH]c(C#N)cc1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450685228	EH	On-Demand	Mild	PARP1	46	35
CN(C)[C@@H](CNC(=O)CCCC(=O)C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450685229	FH	On-Demand	Anodyne	CCR2	65	39
CN(C)[C@H](CNC(=O)CCCC(=O)C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450685231	FH	On-Demand	Anodyne	CCR2	65	39
CC[C@H](O)CC(=O)NCc1ccccc1N1CCCCC1	ZINC000450685236	CE	On-Demand	Anodyne	KCNQ2	96	45
CC[C@@H](O)CC(=O)NCc1ccccc1N1CCCCC1	ZINC000450685237	CE	On-Demand	Anodyne	KCNQ2	96	45
C[C@H](NCC1(C#N)CCC1)c1ccc(-n2cccn2)cc1	ZINC000450685239	CG	On-Demand	Mild	AMP1_PLAFQ	51	35
C[C@@H](NCC1(C#N)CCC1)c1ccc(-n2cccn2)cc1	ZINC000450685240	CG	On-Demand	Mild	AMP1_PLAFQ	51	35
COC(=O)c1ccc(CC(=O)NC[C@H](OC(C)C)c2ccccc2OC)cc1	ZINC000450685260	GG	On-Demand	Anodyne	ACR	24	42
COC(=O)c1ccc(CC(=O)NC[C@@H](OC(C)C)c2ccccc2OC)cc1	ZINC000450685267	GG	On-Demand	Anodyne	ACR	24	42
O=[N+]([O-])c1ccc(N2CCC(CF)CC2)cc1C(F)(F)F	ZINC000450685298	DH	On-Demand	Bother	SERPINE1	19	44
O=[N+]([O-])c1ccc(N2CCC(CF)CC2)cc1C(F)(F)F	ZINC000450685298	DH	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCC(CF)CC1	ZINC000450685322	GF	On-Demand	Bother	CASP3	23	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCC(CF)CC1	ZINC000450685322	GF	On-Demand	Bother	CASP7	34	41
COCC1(O)CN(c2ncnc3ccc(SC)cc23)C1	ZINC000450685324	CD	On-Demand	Anodyne	PDE3A	42	32
COCC1(O)CN(c2ncnc3ccc(SC)cc23)C1	ZINC000450685324	CD	On-Demand	Anodyne	HTT	0	41
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](OC(C)C)c1ccccc1OC	ZINC000450685326	FI	On-Demand	Anodyne	KCNK3	43	37
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](OC(C)C)c1ccccc1OC	ZINC000450685326	FI	On-Demand	Anodyne	KCNK9	42	37
C[C@H](CCC1CC1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450685337	DG	On-Demand	Bother	CACNA1D	59	37
C[C@@H](CCC1CC1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450685339	DG	On-Demand	Bother	CACNA1D	59	37
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450685345	DE	On-Demand	Anodyne	CASP3	53	39
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450685345	DE	On-Demand	Anodyne	CPT1A	80	40
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450685345	DE	On-Demand	Anodyne	ITGA4	42	32
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450685345	DE	On-Demand	Anodyne	CHRNA10	74	51
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450685345	DE	On-Demand	Anodyne	CASP7	44	39
COC(=O)c1cnc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450685345	DE	On-Demand	Anodyne	ACKR3	51	33
CC[C@H](CC(F)(F)F)C(=O)NC[C@H](OC(C)C)c1ccccc1OC	ZINC000450685360	FI	On-Demand	Anodyne	KCNK3	43	37
CC[C@H](CC(F)(F)F)C(=O)NC[C@H](OC(C)C)c1ccccc1OC	ZINC000450685360	FI	On-Demand	Anodyne	KCNK9	42	37
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](OC(C)C)c1ccccc1OC	ZINC000450685362	FI	On-Demand	Anodyne	KCNK3	43	37
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](OC(C)C)c1ccccc1OC	ZINC000450685362	FI	On-Demand	Anodyne	KCNK9	42	37
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](OC(C)C)c1ccccc1OC	ZINC000450685363	FI	On-Demand	Anodyne	KCNK3	43	37
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](OC(C)C)c1ccccc1OC	ZINC000450685363	FI	On-Demand	Anodyne	KCNK9	42	37
O=C(c1c[nH]c2nccc-2c1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450685371	EI	On-Demand	Anodyne	FASN	37	42
O=C(c1c[nH]c2nccc-2c1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450685371	EI	On-Demand	Anodyne	L3MBTL3	67	37
CS[C@H]1CCN(c2nc(CN(C)C)nc3scc(-c4ccccc4)c23)C1	ZINC000450685372	GI	On-Demand	Anodyne	ADRB3	0	41
O=C(c1c[nH]c2nccc-2c1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450685373	EI	On-Demand	Anodyne	FASN	37	42
O=C(c1c[nH]c2nccc-2c1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450685373	EI	On-Demand	Anodyne	L3MBTL3	67	37
CS[C@@H]1CCN(c2nc(CN(C)C)nc3scc(-c4ccccc4)c23)C1	ZINC000450685379	GI	On-Demand	Anodyne	ADRB3	0	41
C[C@H](CC(C)(C)O)Nc1ncnc2c1ncn2C1CC1	ZINC000450685390	CE	On-Demand	Anodyne	ADORA1	45	48
C[C@H](CC(C)(C)O)Nc1ncnc2c1ncn2C1CC1	ZINC000450685390	CE	On-Demand	Anodyne	ADORA2A	25	46
C[C@H](CC(C)(C)O)Nc1ncnc2c1ncn2C1CC1	ZINC000450685390	CE	On-Demand	Anodyne	P2RY1	42	42
C[C@H](CC(C)(C)O)Nc1ncnc2c1ncn2C1CC1	ZINC000450685390	CE	On-Demand	Anodyne	ADORA3	69	44
COCC[C@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450685391	FH	On-Demand	Bother	LIPG	54	43
COCC[C@@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450685393	FH	On-Demand	Bother	LIPG	54	43
C[C@@H](CC(C)(C)O)Nc1ncnc2c1ncn2C1CC1	ZINC000450685399	CE	On-Demand	Anodyne	ADORA1	45	48
C[C@@H](CC(C)(C)O)Nc1ncnc2c1ncn2C1CC1	ZINC000450685399	CE	On-Demand	Anodyne	ADORA2A	25	46
C[C@@H](CC(C)(C)O)Nc1ncnc2c1ncn2C1CC1	ZINC000450685399	CE	On-Demand	Anodyne	P2RY1	42	42
C[C@@H](CC(C)(C)O)Nc1ncnc2c1ncn2C1CC1	ZINC000450685399	CE	On-Demand	Anodyne	ADORA3	69	44
COC(=O)C1(CN[C@H](COc2ccccc2)c2ccccc2)CC1	ZINC000450685421	EG	On-Demand	Anodyne	MAN1B1	41	36
COC(=O)C1(CN[C@H](COc2ccccc2)c2ccccc2)CC1	ZINC000450685421	EG	On-Demand	Anodyne	PDS	42	35
COC(=O)C1(CN[C@H](COc2ccccc2)c2ccccc2)CC1	ZINC000450685421	EG	On-Demand	Anodyne	GPR88	0	41
COC(=O)C1(CN[C@@H](COc2ccccc2)c2ccccc2)CC1	ZINC000450685424	EG	On-Demand	Anodyne	MAN1B1	41	36
COC(=O)C1(CN[C@@H](COc2ccccc2)c2ccccc2)CC1	ZINC000450685424	EG	On-Demand	Anodyne	PDS	42	35
COC(=O)C1(CN[C@@H](COc2ccccc2)c2ccccc2)CC1	ZINC000450685424	EG	On-Demand	Anodyne	GPR88	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	ACE	56	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	SDH1	0	45
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	CYSP_TRYCR	40	35
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	CTSG	27	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	CTSK	33	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	TIMP3	47	35
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	CTRB1	39	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	AMY2	43	30
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	CAPNS1	50	31
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	MMP3	44	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	CELA2A	27	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	REN	44	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	CAPN1	43	36
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	CAPN2	59	35
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	ACE2	45	33
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	NPR	57	31
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	AMP1_PLAFQ	42	34
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685430	CG	On-Demand	Anodyne	PSMB5	23	40
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	ACE	56	38
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	SDH1	0	45
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	CYSP_TRYCR	40	35
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	CTSG	27	42
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	CTSK	33	40
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	TIMP3	47	35
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	CTRB1	39	42
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	AMY2	43	30
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	CAPNS1	50	31
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	MMP3	44	38
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	CELA2A	27	42
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	REN	44	38
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	CAPN1	43	36
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	CAPN2	59	35
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	ACE2	45	33
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	NPR	57	31
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	AMP1_PLAFQ	42	34
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450685433	CG	On-Demand	Anodyne	PSMB5	23	40
C[C@H](N[C@H](C)c1ccc(-n2cccn2)cc1)c1csnn1	ZINC000450685435	CG	On-Demand	Anodyne	AMP1_PLAFQ	41	41
C[C@H](N[C@H](C)c1ccc(-n2cccn2)cc1)c1csnn1	ZINC000450685435	CG	On-Demand	Anodyne	LAP	0	41
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	ACE	56	38
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	SDH1	0	45
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	CYSP_TRYCR	40	35
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	CTSG	27	42
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	CTSK	33	40
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	TIMP3	47	35
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	CTRB1	39	42
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	AMY2	43	30
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	CAPNS1	50	31
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	MMP3	44	38
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	CELA2A	27	42
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	REN	44	38
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	CAPN1	43	36
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	CAPN2	59	35
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	ACE2	45	33
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	NPR	57	31
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	AMP1_PLAFQ	42	34
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685438	CG	On-Demand	Anodyne	PSMB5	23	40
CS[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450685440	FG	On-Demand	Anodyne	PDE3A	53	40
CS[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450685440	FG	On-Demand	Anodyne	PDE3B	79	41
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	ACE	56	38
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	SDH1	0	45
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	CYSP_TRYCR	40	35
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	CTSG	27	42
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	CTSK	33	40
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	TIMP3	47	35
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	CTRB1	39	42
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	AMY2	43	30
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	CAPNS1	50	31
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	MMP3	44	38
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	CELA2A	27	42
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	REN	44	38
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	CAPN1	43	36
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	CAPN2	59	35
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	ACE2	45	33
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	NPR	57	31
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	AMP1_PLAFQ	42	34
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450685441	CG	On-Demand	Anodyne	PSMB5	23	40
C[C@H](N[C@H](C)c1csnn1)c1ccc(-n2cccn2)cc1	ZINC000450685443	CG	On-Demand	Anodyne	AMP1_PLAFQ	41	41
C[C@H](N[C@H](C)c1csnn1)c1ccc(-n2cccn2)cc1	ZINC000450685443	CG	On-Demand	Anodyne	LAP	0	41
CS[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450685446	FG	On-Demand	Anodyne	PDE3A	53	40
CS[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450685446	FG	On-Demand	Anodyne	PDE3B	79	41
C[C@H](N[C@@H](C)c1csnn1)c1ccc(-n2cccn2)cc1	ZINC000450685448	CG	On-Demand	Anodyne	AMP1_PLAFQ	41	41
C[C@H](N[C@@H](C)c1csnn1)c1ccc(-n2cccn2)cc1	ZINC000450685448	CG	On-Demand	Anodyne	LAP	0	41
COC(=O)c1csc(CN[C@@H](CC(C)C)c2ccccc2C)n1	ZINC000450685449	EI	On-Demand	Anodyne	CTSA	42	32
C[C@@H](N[C@H](C)c1csnn1)c1ccc(-n2cccn2)cc1	ZINC000450685451	CG	On-Demand	Anodyne	AMP1_PLAFQ	41	41
C[C@@H](N[C@H](C)c1csnn1)c1ccc(-n2cccn2)cc1	ZINC000450685451	CG	On-Demand	Anodyne	LAP	0	41
COC(=O)c1csc(CN[C@H](CC(C)C)c2ccccc2C)n1	ZINC000450685453	EI	On-Demand	Anodyne	CTSA	42	32
Cc1nnnn1-c1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c(F)c1	ZINC000450685462	GG	On-Demand	Anodyne	PRCP	44	34
Cc1nnnn1-c1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c(F)c1	ZINC000450685464	GG	On-Demand	Anodyne	PRCP	44	34
COC1(C)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450685491	CG	On-Demand	Anodyne	SIGMAR1	29	43
COC1(C)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450685491	CG	On-Demand	Anodyne	KCNJ1	22	40
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450685494	EH	On-Demand	Anodyne	RBP4	16	40
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450685496	EH	On-Demand	Anodyne	RBP4	16	40
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450685499	EH	On-Demand	Anodyne	RBP4	16	40
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450685500	EH	On-Demand	Anodyne	RBP4	16	40
COC(=O)c1ccc(CN[C@H](C)c2ccc(F)c(C)c2)cc1Cl	ZINC000450685523	EI	On-Demand	Anodyne	LEF	50	40
COC(=O)c1ccc(CN[C@@H](C)c2ccc(F)c(C)c2)cc1Cl	ZINC000450685524	EI	On-Demand	Anodyne	LEF	50	40
COc1ccc(CNC(=O)CCNC2(c3ccc(Cl)cc3)CC2)c(OC)c1	ZINC000450685532	GH	On-Demand	Anodyne	MTNR1A	53	38
Cc1nc(C(C)C)oc1CSc1nnc(-c2ccccc2Br)o1	ZINC000450685533	GK	On-Demand	Anodyne	TERT	16	40
COC[C@H]1CCCCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450685540	DG	On-Demand	Anodyne	L3MBTL3	48	35
COC[C@@H]1CCCCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450685541	DG	On-Demand	Anodyne	L3MBTL3	48	35
COCc1ccc([C@@H]2CCCN2C(=O)c2cn(-c3cccnc3)nn2)o1	ZINC000450685542	FE	On-Demand	Anodyne	CPT1A	43	36
COCc1ccc([C@H]2CCCN2C(=O)c2cn(-c3cccnc3)nn2)o1	ZINC000450685543	FE	On-Demand	Anodyne	CPT1A	43	36
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@]1(C)CCO[C@H]1C1CC1	ZINC000450685545	EH	On-Demand	Anodyne	CCR2	42	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@]1(C)CCO[C@@H]1C1CC1	ZINC000450685547	EH	On-Demand	Anodyne	CCR2	42	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@]1(C)CCO[C@H]1C1CC1	ZINC000450685549	EH	On-Demand	Anodyne	CCR2	42	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@]1(C)CCO[C@@H]1C1CC1	ZINC000450685550	EH	On-Demand	Anodyne	CCR2	42	35
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(O)c(F)c2)o1	ZINC000450685553	EG	On-Demand	Anodyne	COLA	55	34
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(O)c(F)c2)o1	ZINC000450685553	EG	On-Demand	Anodyne	CPT1A	47	33
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(O)c(F)c2)o1	ZINC000450685555	EG	On-Demand	Anodyne	COLA	55	34
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(O)c(F)c2)o1	ZINC000450685555	EG	On-Demand	Anodyne	CPT1A	47	33
COc1ccc(OCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450685582	CG	On-Demand	Bother	TPPP	0	48
CCN(CCO)CCNC(=O)c1cn2nccc2nc1C	ZINC000450685597	CC	On-Demand	Anodyne	POLR1A	35	40
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCc2ccncc21	ZINC000450685599	DF	On-Demand	Anodyne	EIF2AK3	45	32
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(F)c(C)c1	ZINC000450685602	CE	On-Demand	Anodyne	LEF	54	33
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(F)c(C)c1	ZINC000450685603	CE	On-Demand	Anodyne	LEF	54	33
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(F)c(C)c1	ZINC000450685604	CE	On-Demand	Anodyne	LEF	54	33
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(F)c(C)c1	ZINC000450685605	CE	On-Demand	Anodyne	LEF	54	33
CS[C@@H]1CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450685635	BD	On-Demand	Bother	CHRNA3	20	62
CS[C@@H]1CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450685635	BD	On-Demand	Bother	CHRNA4	19	62
Cc1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c(Cl)c1Cl	ZINC000450685659	FJ	On-Demand	Anodyne	AVPR1A	15	51
Cc1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c(Cl)c1Cl	ZINC000450685660	FJ	On-Demand	Anodyne	AVPR1A	15	51
CCC[C@@](C)(CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450685663	CF	On-Demand	Anodyne	TRPV1	31	42
CCC[C@@](C)(CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450685663	CF	On-Demand	Anodyne	NCE103	23	43
CCC[C@@](C)(CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450685663	CF	On-Demand	Anodyne	CAN2	0	43
CCC[C@](C)(CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450685664	CF	On-Demand	Anodyne	TRPV1	31	42
CCC[C@](C)(CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450685664	CF	On-Demand	Anodyne	NCE103	23	43
CCC[C@](C)(CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450685664	CF	On-Demand	Anodyne	CAN2	0	43
COc1ccccc1[C@H](CNC(=O)c1cnn2ccc(C)cc12)OC(C)C	ZINC000450685668	FH	On-Demand	Anodyne	EPHB3	35	48
COc1ccccc1[C@@H](CNC(=O)c1cnn2ccc(C)cc12)OC(C)C	ZINC000450685669	FH	On-Demand	Anodyne	EPHB3	35	48
O=[N+]([O-])c1cccc2ncnc(N3CCC(CF)CC3)c12	ZINC000450685676	CF	On-Demand	Bother	SIRT3	43	32
O=[N+]([O-])c1cccc2ncnc(N3CCC(CF)CC3)c12	ZINC000450685676	CF	On-Demand	Bother	SIRT2	45	32
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450685695	EH	On-Demand	Anodyne	SIGMAR1	16	42
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450685696	EH	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1(CCO)CCCCC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450685714	FI	On-Demand	Anodyne	RBP4	66	38
CC(=O)N[C@H](C(=O)NCC1(CCOCc2ccccc2)CC1)C(C)(C)C	ZINC000450685715	FG	On-Demand	Anodyne	TIMP3	58	32
CC(=O)N[C@H](C(=O)NCC1(CCOCc2ccccc2)CC1)C(C)(C)C	ZINC000450685715	FG	On-Demand	Anodyne	MMP3	17	44
CC(=O)N[C@H](C(=O)NCC1(CCOCc2ccccc2)CC1)C(C)(C)C	ZINC000450685715	FG	On-Demand	Anodyne	CAPN2	62	31
CC(=O)N[C@H](C(=O)NCC1(CCOCc2ccccc2)CC1)C(C)(C)C	ZINC000450685715	FG	On-Demand	Anodyne	GAG-PRO	50	34
N#Cc1cc(N2CCC(CF)CC2)ccc1C(F)(F)F	ZINC000450685717	CH	On-Demand	Mild	AR	32	42
COc1ccccc1[C@H](CNC(=O)c1cc(C)cs1)OC(C)C	ZINC000450685723	EH	On-Demand	Anodyne	KCNK3	43	39
COc1ccccc1[C@@H](CNC(=O)c1cc(C)cs1)OC(C)C	ZINC000450685730	EH	On-Demand	Anodyne	KCNK3	43	39
C[C@H](Oc1ccccn1)C(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450685733	FH	On-Demand	Anodyne	SRD5A2	0	40
C[C@@H](Oc1ccccn1)C(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450685735	FH	On-Demand	Anodyne	SRD5A2	0	40
FCC1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450685737	CG	On-Demand	Anodyne	AKT2	29	46
FCC1CCN(c2ncnc3[nH]c4ccccc4c23)CC1	ZINC000450685737	CG	On-Demand	Anodyne	SIRT1	40	31
c1ccc(COC[C@@H](NC[C@@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685742	EI	On-Demand	Anodyne	MAN2A1	0	45
c1ccc(COC[C@@H](NC[C@@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685742	EI	On-Demand	Anodyne	MAN1B1	58	54
c1ccc(COC[C@@H](NC[C@@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685742	EI	On-Demand	Anodyne	MAN1	0	45
c1ccc(COC[C@@H](NC[C@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685744	EI	On-Demand	Anodyne	MAN2A1	0	45
c1ccc(COC[C@@H](NC[C@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685744	EI	On-Demand	Anodyne	MAN1B1	58	54
c1ccc(COC[C@@H](NC[C@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685744	EI	On-Demand	Anodyne	MAN1	0	45
c1ccc(COC[C@H](NC[C@@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685746	EI	On-Demand	Anodyne	MAN2A1	0	45
c1ccc(COC[C@H](NC[C@@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685746	EI	On-Demand	Anodyne	MAN1B1	58	54
c1ccc(COC[C@H](NC[C@@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685746	EI	On-Demand	Anodyne	MAN1	0	45
c1ccc(COC[C@H](NC[C@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685748	EI	On-Demand	Anodyne	MAN2A1	0	45
c1ccc(COC[C@H](NC[C@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685748	EI	On-Demand	Anodyne	MAN1B1	58	54
c1ccc(COC[C@H](NC[C@H]2C[C@H]3CC[C@H]2O3)c2ccccc2)cc1	ZINC000450685748	EI	On-Demand	Anodyne	MAN1	0	45
C=CCOc1ccc(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450685752	EG	On-Demand	Mild	AVPR1A	0	43
C=CCOc1ccc(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450685753	EG	On-Demand	Mild	AVPR1A	0	43
C[C@@H](c1ccccc1)[C@H](O)CNC1(c2cccc(F)c2)CC1	ZINC000450685782	CH	On-Demand	Anodyne	CTSD	25	45
C[C@@H](c1ccccc1)[C@H](O)CNC1(c2cccc(F)c2)CC1	ZINC000450685782	CH	On-Demand	Anodyne	BACE1	27	45
C[C@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(F)c2)CC1	ZINC000450685783	CH	On-Demand	Anodyne	CTSD	28	45
C[C@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(F)c2)CC1	ZINC000450685783	CH	On-Demand	Anodyne	BACE1	27	45
C[C@@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(F)c2)CC1	ZINC000450685784	CH	On-Demand	Anodyne	CTSD	25	45
C[C@@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(F)c2)CC1	ZINC000450685784	CH	On-Demand	Anodyne	BACE1	27	45
C[C@H](c1ccccc1)[C@H](O)CNC1(c2cccc(F)c2)CC1	ZINC000450685785	CH	On-Demand	Anodyne	CTSD	28	45
C[C@H](c1ccccc1)[C@H](O)CNC1(c2cccc(F)c2)CC1	ZINC000450685785	CH	On-Demand	Anodyne	BACE1	27	45
COc1cccc(C2(NC[C@H](Cc3ccccc3)OC)CC2)c1	ZINC000450685800	DH	On-Demand	Anodyne	CTSD	15	43
COc1cccc(C2(NC[C@@H](Cc3ccccc3)OC)CC2)c1	ZINC000450685801	DH	On-Demand	Anodyne	CTSD	15	43
COC[C@]1(C(=O)OC)CCN(c2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000450685803	FE	On-Demand	Anodyne	SLC12A5	55	36
COC[C@@]1(C(=O)OC)CCN(c2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000450685804	FE	On-Demand	Anodyne	SLC12A5	55	36
COc1ccc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450685814	GI	On-Demand	Anodyne	HCRTR2	19	46
COc1ccc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450685815	GI	On-Demand	Anodyne	HCRTR2	19	46
C[C@@H](CC(C)(C)O)Nc1ccnc2cc(F)ccc12	ZINC000450685816	CG	On-Demand	Anodyne	HRP1_PLAFA	25	43
C[C@@H](CC(C)(C)O)Nc1ccnc2cc(F)ccc12	ZINC000450685816	CG	On-Demand	Anodyne	RBP_CHICK	0	43
C[C@H](CC(C)(C)O)Nc1ccnc2cc(F)ccc12	ZINC000450685818	CG	On-Demand	Anodyne	HRP1_PLAFA	25	43
C[C@H](CC(C)(C)O)Nc1ccnc2cc(F)ccc12	ZINC000450685818	CG	On-Demand	Anodyne	RBP_CHICK	0	43
CN(C)[C@@H](CNC(=O)c1cn(CC2CC2)nn1)c1cccc(C(F)(F)F)c1	ZINC000450685827	GF	On-Demand	Anodyne	CCR2	50	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	ACE	74	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	MME	111	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	ANPEP	65	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	SDH1	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	CTSB	48	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	PAPA1_CARPA	61	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	CYSP_TRYCR	59	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	CTSL	43	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	TIMP3	68	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	CTRB1	41	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	CAPNS1	70	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	REN	65	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	F11	49	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	CAPN1	74	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	CAPN2	67	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	ACE2	83	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	FPR1	58	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	NPR	48	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	AMP1_PLAFQ	53	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	BLA1_STEMA	35	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	PSMB8	48	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685828	CF	On-Demand	Anodyne	NPFFR1	40	30
CN(C)[C@H](CNC(=O)c1cn(CC2CC2)nn1)c1cccc(C(F)(F)F)c1	ZINC000450685829	GF	On-Demand	Anodyne	CCR2	50	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	ACE	74	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	MME	111	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	ANPEP	65	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	SDH1	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	CTSB	48	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	PAPA1_CARPA	61	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	CYSP_TRYCR	59	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	CTSL	43	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	TIMP3	68	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	CTRB1	41	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	CAPNS1	70	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	REN	65	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	F11	49	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	CAPN1	74	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	CAPN2	67	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	ACE2	83	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	FPR1	58	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	NPR	48	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	AMP1_PLAFQ	53	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	BLA1_STEMA	35	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	PSMB8	48	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685830	CF	On-Demand	Anodyne	NPFFR1	40	30
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	ACE	74	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	MME	111	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	ANPEP	65	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	SDH1	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	CTSB	48	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	PAPA1_CARPA	61	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	CYSP_TRYCR	59	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	CTSL	43	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	TIMP3	68	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	CTRB1	41	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	CAPNS1	70	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	REN	65	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	F11	49	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	CAPN1	74	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	CAPN2	67	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	ACE2	83	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	FPR1	58	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	NPR	48	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	AMP1_PLAFQ	53	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	BLA1_STEMA	35	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	PSMB8	48	31
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450685832	CF	On-Demand	Anodyne	NPFFR1	40	30
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	ACE	74	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	MME	111	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	ANPEP	65	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	SDH1	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	CTSB	48	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	PAPA1_CARPA	61	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	CYSP_TRYCR	59	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	CTSL	43	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	TIMP3	68	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	CTRB1	41	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	CAPNS1	70	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	REN	65	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	F11	49	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	CAPN1	74	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	CAPN2	67	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	ACE2	83	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	FPR1	58	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	NPR	48	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	AMP1_PLAFQ	53	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	BLA1_STEMA	35	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	PSMB8	48	31
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CCC1CC1	ZINC000450685833	CF	On-Demand	Anodyne	NPFFR1	40	30
COC(=O)c1csc(CN2CCN(c3ccc(F)cn3)CC2)n1	ZINC000450685845	ED	On-Demand	Anodyne	SLC27A1	63	45
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2OC)c(OC)c1	ZINC000450685847	GG	On-Demand	Anodyne	NQO2	22	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2OC)c(OC)c1	ZINC000450685847	GG	On-Demand	Anodyne	MTNR1A	72	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cccc2OC)c(OC)c1	ZINC000450685847	GG	On-Demand	Anodyne	MTNR1B	63	42
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2OC)c(OC)c1	ZINC000450685848	GG	On-Demand	Anodyne	NQO2	22	40
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2OC)c(OC)c1	ZINC000450685848	GG	On-Demand	Anodyne	MTNR1A	72	42
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cccc2OC)c(OC)c1	ZINC000450685848	GG	On-Demand	Anodyne	MTNR1B	63	42
Cc1ccn2ncc(C(=O)N3CC[C@@H](c4c(F)cccc4F)C3)c2c1	ZINC000450685856	EH	On-Demand	Anodyne	EPHB3	28	42
Cc1ccn2ncc(C(=O)N3CC[C@H](c4c(F)cccc4F)C3)c2c1	ZINC000450685859	EH	On-Demand	Anodyne	EPHB3	28	42
COC[C@]1(C(=O)OC)CCN(c2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450685860	FD	On-Demand	Anodyne	COLA	63	34
COC[C@]1(C(=O)OC)CCN(c2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450685860	FD	On-Demand	Anodyne	CPT1A	60	34
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450685861	EH	On-Demand	Anodyne	GRIN2B	41	38
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450685861	EH	On-Demand	Anodyne	CCR3	36	41
COC[C@@]1(C(=O)OC)CCN(c2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450685862	FD	On-Demand	Anodyne	COLA	63	34
COC[C@@]1(C(=O)OC)CCN(c2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450685862	FD	On-Demand	Anodyne	CPT1A	60	34
CCNc1ccc(Cl)cc1NC(=O)c1ccc(C)nc1C	ZINC000450685863	DI	On-Demand	Anodyne	KCNMA1	25	41
CCNc1ccc(Cl)cc1NC(=O)c1ccc(C)nc1C	ZINC000450685863	DI	On-Demand	Anodyne	SHH	25	43
CCOCc1nc(C)c(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)s1	ZINC000450685881	GI	On-Demand	Anodyne	GRIN2B	43	40
CO[C@@H](Cc1ccccc1)CN1CCN(C(C)=O)CC1(C)C	ZINC000450685918	DE	On-Demand	Anodyne	PSMB8	46	35
CO[C@H](Cc1ccccc1)CN1CCN(C(C)=O)CC1(C)C	ZINC000450685919	DE	On-Demand	Anodyne	PSMB8	46	35
Cc1ccn(CC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450685925	EF	On-Demand	Anodyne	CCR3	25	46
CS[C@H]1CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450685932	BD	On-Demand	Bother	CHRNA3	20	62
CS[C@H]1CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450685932	BD	On-Demand	Bother	CHRNA4	19	62
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(F)c(C)c2)c(OC)c1	ZINC000450685940	FH	On-Demand	Anodyne	MTNR1A	45	37
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(F)c(C)c2)c(OC)c1	ZINC000450685941	FH	On-Demand	Anodyne	MTNR1A	45	37
COCc1ccc([C@@H]2CCCN2C(=O)c2coc(-c3ccnc(C)c3)n2)o1	ZINC000450685961	FH	On-Demand	Anodyne	COLA	63	36
COCc1ccc([C@@H]2CCCN2C(=O)c2coc(-c3ccnc(C)c3)n2)o1	ZINC000450685961	FH	On-Demand	Anodyne	CPT1A	51	35
COCc1ccc([C@H]2CCCN2C(=O)c2coc(-c3ccnc(C)c3)n2)o1	ZINC000450685964	FH	On-Demand	Anodyne	COLA	63	36
COCc1ccc([C@H]2CCCN2C(=O)c2coc(-c3ccnc(C)c3)n2)o1	ZINC000450685964	FH	On-Demand	Anodyne	CPT1A	51	35
CCN(CCO)CCNC(=O)c1ccc(Oc2ccccc2OC)cn1	ZINC000450685981	FD	On-Demand	Anodyne	DRD3	19	41
COCC[C@@H]1CCCCN(C(=O)Cc2ccc(O)c(OC)c2)C1	ZINC000450686001	DF	On-Demand	Anodyne	RORC	52	38
COCC[C@H]1CCCCN(C(=O)Cc2ccc(O)c(OC)c2)C1	ZINC000450686002	DF	On-Demand	Anodyne	RORC	52	38
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000450686003	DG	On-Demand	Anodyne	DRD4	40	31
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000450686003	DG	On-Demand	Anodyne	PREP	18	41
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000450686003	DG	On-Demand	Anodyne	NPBWR1	64	33
COC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000450686003	DG	On-Demand	Anodyne	GPR88	0	40
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450686047	GD	On-Demand	Bother	BCL2L1	99	36
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450686047	GD	On-Demand	Bother	BCL2	77	39
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450686047	GD	On-Demand	Bother	BCL2L2	46	33
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450686047	GD	On-Demand	Bother	DDIT3	0	40
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450686048	GD	On-Demand	Bother	BCL2L1	99	36
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450686048	GD	On-Demand	Bother	BCL2	77	39
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450686048	GD	On-Demand	Bother	BCL2L2	46	33
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450686048	GD	On-Demand	Bother	DDIT3	0	40
Cc1ccn2ncc(C(=O)NC3(CCO)CCN(C)CC3)c2c1	ZINC000450686058	DD	On-Demand	Anodyne	EPHB3	35	49
CCc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C	ZINC000450686095	CG	On-Demand	Anodyne	ABL1	43	36
CCc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C	ZINC000450686095	CG	On-Demand	Anodyne	MAPK14	33	48
CCc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C	ZINC000450686095	CG	On-Demand	Anodyne	POLC	69	35
CCc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C	ZINC000450686095	CG	On-Demand	Anodyne	PRNP	55	42
CCc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C	ZINC000450686095	CG	On-Demand	Anodyne	P4HTM	0	44
CCc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C	ZINC000450686095	CG	On-Demand	Anodyne	DDR1	42	33
CCc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C	ZINC000450686095	CG	On-Demand	Anodyne	DGAT1	50	40
CCc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C	ZINC000450686095	CG	On-Demand	Anodyne	HSPB1	0	47
Clc1cncnc1N1CCC[C@H]1COc1ccccc1	ZINC000450686100	CG	On-Demand	Anodyne	CASP3	47	36
Clc1cncnc1N1CCC[C@H]1COc1ccccc1	ZINC000450686100	CG	On-Demand	Anodyne	CHRNA10	75	54
COC[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686110	DF	On-Demand	Anodyne	ACE	42	37
COC[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686110	DF	On-Demand	Anodyne	FKBP1A	52	38
COC[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686110	DF	On-Demand	Anodyne	PREP	44	37
COC[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686110	DF	On-Demand	Anodyne	AMY2	42	29
COC[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686110	DF	On-Demand	Anodyne	REN	43	39
COC[C@@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686111	DF	On-Demand	Anodyne	ACE	42	37
COC[C@@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686111	DF	On-Demand	Anodyne	FKBP1A	52	38
COC[C@@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686111	DF	On-Demand	Anodyne	PREP	44	37
COC[C@@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686111	DF	On-Demand	Anodyne	AMY2	42	29
COC[C@@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686111	DF	On-Demand	Anodyne	REN	43	39
COC[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686112	DF	On-Demand	Anodyne	ACE	42	37
COC[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686112	DF	On-Demand	Anodyne	FKBP1A	52	38
COC[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686112	DF	On-Demand	Anodyne	PREP	44	37
COC[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686112	DF	On-Demand	Anodyne	AMY2	42	29
COC[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450686112	DF	On-Demand	Anodyne	REN	43	39
COC[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686113	DF	On-Demand	Anodyne	ACE	42	37
COC[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686113	DF	On-Demand	Anodyne	FKBP1A	52	38
COC[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686113	DF	On-Demand	Anodyne	PREP	44	37
COC[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686113	DF	On-Demand	Anodyne	AMY2	42	29
COC[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450686113	DF	On-Demand	Anodyne	REN	43	39
COC[C@@H]1CCCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450686133	CF	On-Demand	Anodyne	HRH4	16	56
COC[C@@H]1CCCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450686133	CF	On-Demand	Anodyne	AKR1C3	21	41
COC[C@H]1CCCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450686134	CF	On-Demand	Anodyne	HRH4	16	56
COC[C@H]1CCCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450686134	CF	On-Demand	Anodyne	AKR1C3	21	41
COC[C@H]1CCCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450686137	FF	On-Demand	Anodyne	L3MBTL1	0	40
COC[C@H]1CCCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450686137	FF	On-Demand	Anodyne	L3MBTL3	63	40
COC[C@H]1CCCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450686137	FF	On-Demand	Anodyne	MBTD1	0	40
CCc1cccc(C(=O)NC2(CO)CCOCC2)n1	ZINC000450686149	CC	On-Demand	Anodyne	PDE5A	0	43
Cc1cc(C)c(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1Br	ZINC000450686156	GI	On-Demand	Anodyne	AVPR1A	0	50
Cc1cc(C)c(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1Br	ZINC000450686157	GI	On-Demand	Anodyne	AVPR1A	0	50
COc1ccccc1[C@H](CNC(=O)c1cccc(SC)c1)OC(C)C	ZINC000450686166	FI	On-Demand	Anodyne	KCNK3	48	41
COc1ccccc1[C@H](CNC(=O)c1cccc(SC)c1)OC(C)C	ZINC000450686166	FI	On-Demand	Anodyne	KCNK9	48	41
COc1ccccc1[C@@H](CNC(=O)c1cccc(SC)c1)OC(C)C	ZINC000450686167	FI	On-Demand	Anodyne	KCNK3	48	41
COc1ccccc1[C@@H](CNC(=O)c1cccc(SC)c1)OC(C)C	ZINC000450686167	FI	On-Demand	Anodyne	KCNK9	48	41
CCC[C@@](C)(CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450686182	CD	On-Demand	Anodyne	HPGDS	17	45
CCC[C@](C)(CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450686183	CD	On-Demand	Anodyne	HPGDS	17	45
CCOC(=O)c1cc(C(=O)NC[C@H](OC(C)C)c2ccccc2OC)on1	ZINC000450686194	GF	On-Demand	Anodyne	KCNK3	48	38
CCOC(=O)c1cc(C(=O)NC[C@H](OC(C)C)c2ccccc2OC)on1	ZINC000450686194	GF	On-Demand	Anodyne	KCNK9	41	38
CCOC(=O)c1cc(C(=O)NC[C@@H](OC(C)C)c2ccccc2OC)on1	ZINC000450686195	GF	On-Demand	Anodyne	KCNK3	48	38
CCOC(=O)c1cc(C(=O)NC[C@@H](OC(C)C)c2ccccc2OC)on1	ZINC000450686195	GF	On-Demand	Anodyne	KCNK9	41	38
COc1ccc2nc(C(F)(F)F)nc(N3CCC(CF)CC3)c2c1	ZINC000450686218	EH	On-Demand	Anodyne	PDE3A	42	39
COc1ccc2nc(C(F)(F)F)nc(N3CCC(CF)CC3)c2c1	ZINC000450686218	EH	On-Demand	Anodyne	PDE3B	61	39
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(CF)CC1	ZINC000450686219	DH	On-Demand	Bother	SERPINE1	22	46
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(CF)CC1	ZINC000450686219	DH	On-Demand	Bother	LIPG	58	39
COc1ccc(-c2ccnc(N3CCC(CF)CC3)n2)cc1	ZINC000450686220	DG	On-Demand	Anodyne	DKK1	0	54
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450686221	FG	On-Demand	Anodyne	AVPR1A	17	43
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450686222	FG	On-Demand	Anodyne	AVPR1A	17	43
C[C@H](O)CCN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450686229	CC	On-Demand	Anodyne	CTSG	18	55
C[C@H](O)CCN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450686229	CC	On-Demand	Anodyne	ALDH1A1	39	40
C[C@@H](O)CCN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450686230	CC	On-Demand	Anodyne	CTSG	18	55
C[C@@H](O)CCN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450686230	CC	On-Demand	Anodyne	ALDH1A1	39	40
COc1cc(CC(=O)NCC2(CCOCc3ccccc3)CC2)ccc1Cl	ZINC000450686235	GI	On-Demand	Anodyne	TRPV1	0	41
COCCOC[C@H](O)CN[C@@H]1C[C@H](C)CC[C@@H]1C(C)C	ZINC000450686236	CE	On-Demand	Anodyne	TRPM8	0	44
COCCOC[C@H](O)CN[C@@H]1C[C@H](C)CC[C@H]1C(C)C	ZINC000450686237	CE	On-Demand	Anodyne	TRPM8	0	44
COC[C@@H]1CCCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450686239	FF	On-Demand	Anodyne	L3MBTL1	0	40
COC[C@@H]1CCCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450686239	FF	On-Demand	Anodyne	L3MBTL3	63	40
COC[C@@H]1CCCCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450686239	FF	On-Demand	Anodyne	MBTD1	0	40
CS[C@@H]1CCN(c2ccnc(N(C)C)n2)C1	ZINC000450686240	BD	On-Demand	Anodyne	SORD	41	34
CS[C@H]1CCN(c2ccnc(N(C)C)n2)C1	ZINC000450686241	BD	On-Demand	Anodyne	SORD	41	34
COCC[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000450686244	EG	On-Demand	Anodyne	DRD4	41	32
C[C@@H](Sc1nnc(-c2ccccc2Br)o1)C(=O)C1CCCCC1	ZINC000450686245	GK	On-Demand	Anodyne	ALOX15	15	40
O=C1CC[C@H](CN[C@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686248	FG	On-Demand	Anodyne	MAN2A1	0	45
O=C1CC[C@H](CN[C@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686248	FG	On-Demand	Anodyne	MAN1B1	58	53
O=C1CC[C@H](CN[C@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686248	FG	On-Demand	Anodyne	MAN1	0	45
O=C1CC[C@@H](CN[C@@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686249	FG	On-Demand	Anodyne	MAN2A1	0	45
O=C1CC[C@@H](CN[C@@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686249	FG	On-Demand	Anodyne	MAN1B1	58	53
O=C1CC[C@@H](CN[C@@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686249	FG	On-Demand	Anodyne	MAN1	0	45
O=C1CC[C@H](CN[C@@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686250	FG	On-Demand	Anodyne	MAN2A1	0	45
O=C1CC[C@H](CN[C@@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686250	FG	On-Demand	Anodyne	MAN1B1	58	53
O=C1CC[C@H](CN[C@@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686250	FG	On-Demand	Anodyne	MAN1	0	45
O=C1CC[C@@H](CN[C@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686251	FG	On-Demand	Anodyne	MAN2A1	0	45
O=C1CC[C@@H](CN[C@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686251	FG	On-Demand	Anodyne	MAN1B1	58	53
O=C1CC[C@@H](CN[C@H](COCc2ccccc2)c2ccccc2)CCN1	ZINC000450686251	FG	On-Demand	Anodyne	MAN1	0	45
C[C@H](Sc1nnc(-c2ccccc2Br)o1)C(=O)C1CCCCC1	ZINC000450686253	GK	On-Demand	Anodyne	ALOX15	15	40
COC[C@]1(C(=O)OC)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686273	GF	On-Demand	Anodyne	PRNP	47	37
COC[C@]1(C(=O)OC)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686273	GF	On-Demand	Anodyne	HDAC1	29	40
COC[C@]1(C(=O)OC)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686273	GF	On-Demand	Anodyne	P4HTM	0	46
COC[C@@]1(C(=O)OC)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686274	GF	On-Demand	Anodyne	PRNP	47	37
COC[C@@]1(C(=O)OC)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686274	GF	On-Demand	Anodyne	HDAC1	29	40
COC[C@@]1(C(=O)OC)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686274	GF	On-Demand	Anodyne	P4HTM	0	46
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1nc(-c2ccccc2)cs1	ZINC000450686296	EI	On-Demand	Anodyne	COLA	23	41
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1nc(-c2ccccc2)cs1	ZINC000450686296	EI	On-Demand	Anodyne	CPT1A	21	41
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1nc(-c2ccccc2)cs1	ZINC000450686297	EI	On-Demand	Anodyne	COLA	23	41
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1nc(-c2ccccc2)cs1	ZINC000450686297	EI	On-Demand	Anodyne	CPT1A	21	41
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1nc(-c2ccccc2)cs1	ZINC000450686298	EI	On-Demand	Anodyne	COLA	23	41
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1nc(-c2ccccc2)cs1	ZINC000450686298	EI	On-Demand	Anodyne	CPT1A	21	41
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1nc(-c2ccccc2)cs1	ZINC000450686302	EI	On-Demand	Anodyne	COLA	23	41
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1nc(-c2ccccc2)cs1	ZINC000450686302	EI	On-Demand	Anodyne	CPT1A	21	41
CCN(CCO)CCNC(=O)c1ccccc1-n1ccc(C)n1	ZINC000450686308	DD	On-Demand	Anodyne	POLR1A	37	43
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686324	FI	On-Demand	Anodyne	SLC6A1	22	42
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686324	FI	On-Demand	Anodyne	MC4R	53	43
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686324	FI	On-Demand	Anodyne	PRCP	54	40
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686324	FI	On-Demand	Anodyne	MC3R	45	43
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686324	FI	On-Demand	Anodyne	MC5R	33	43
COC[C@]1(C(=O)OC)CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450686327	EF	On-Demand	Anodyne	HRP1_PLAFA	40	34
COC[C@]1(C(=O)OC)CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450686327	EF	On-Demand	Anodyne	HNMT	45	32
COC[C@@]1(C(=O)OC)CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450686329	EF	On-Demand	Anodyne	HRP1_PLAFA	40	34
COC[C@@]1(C(=O)OC)CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450686329	EF	On-Demand	Anodyne	HNMT	45	32
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686332	FI	On-Demand	Anodyne	SLC6A1	22	42
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686332	FI	On-Demand	Anodyne	MC4R	53	43
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686332	FI	On-Demand	Anodyne	PRCP	54	40
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686332	FI	On-Demand	Anodyne	MC3R	45	43
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686332	FI	On-Demand	Anodyne	MC5R	33	43
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686334	FI	On-Demand	Anodyne	SLC6A1	22	42
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686334	FI	On-Demand	Anodyne	MC4R	53	43
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686334	FI	On-Demand	Anodyne	PRCP	54	40
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686334	FI	On-Demand	Anodyne	MC3R	45	43
COC[C@@H]1CCCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450686334	FI	On-Demand	Anodyne	MC5R	33	43
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686336	FI	On-Demand	Anodyne	SLC6A1	22	42
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686336	FI	On-Demand	Anodyne	MC4R	53	43
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686336	FI	On-Demand	Anodyne	PRCP	54	40
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686336	FI	On-Demand	Anodyne	MC3R	45	43
COC[C@@H]1CCCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450686336	FI	On-Demand	Anodyne	MC5R	33	43
COCc1nc(OC)cc(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450686341	EF	On-Demand	Anodyne	CHRNA10	76	50
c1ccc(OC[C@@H]2CCCN2c2nnc(C3CCOCC3)s2)cc1	ZINC000450686343	EG	On-Demand	Anodyne	CHRNA10	64	46
CC(C)c1nccc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)n1	ZINC000450686359	CG	On-Demand	Anodyne	SORD	52	35
CC(C)c1nccc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)n1	ZINC000450686362	CG	On-Demand	Anodyne	SORD	52	35
CC(C)c1nccc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)n1	ZINC000450686364	CG	On-Demand	Anodyne	SORD	52	35
CC(C)c1nccc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)n1	ZINC000450686366	CG	On-Demand	Anodyne	SORD	52	35
COC[C@@H]1CCCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450686367	DF	On-Demand	Anodyne	PDE4D	29	43
COC[C@H]1CCCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450686374	DF	On-Demand	Anodyne	PDE4D	29	43
CC(C)[C@H](NCc1ccn(CCc2ccccc2)n1)C(=O)N1CCOCC1	ZINC000450686379	FE	On-Demand	Anodyne	CCR1	34	40
CC(C)[C@@H](NCc1ccn(CCc2ccccc2)n1)C(=O)N1CCOCC1	ZINC000450686381	FE	On-Demand	Anodyne	CCR1	34	40
COCCOC[C@H](O)CN[C@@H]1C[C@@H](C)CC[C@H]1C(C)C	ZINC000450686410	CE	On-Demand	Anodyne	TRPM8	0	44
COCCOC[C@H](O)CN[C@@H]1C[C@@H](C)CC[C@@H]1C(C)C	ZINC000450686414	CE	On-Demand	Anodyne	TRPM8	0	44
COC[C@@H]1CCCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450686415	EH	On-Demand	Anodyne	COLA	52	35
COC[C@@H]1CCCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450686415	EH	On-Demand	Anodyne	CPT1A	49	35
COC[C@H]1CCCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450686419	EH	On-Demand	Anodyne	COLA	52	35
COC[C@H]1CCCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450686419	EH	On-Demand	Anodyne	CPT1A	49	35
Cc1ccn(CC(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)n1	ZINC000450686440	CF	On-Demand	Anodyne	SCARB1	42	37
CC(C)N=c1[nH]c(N2CCC[C@H]2COc2ccccc2)nc(=NCCO)[nH]1	ZINC000450686453	FC	On-Demand	Anodyne	CHRNA10	60	41
COCC[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450686455	GG	On-Demand	Mild	HTR1B	15	41
COCC[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450686455	GG	On-Demand	Mild	COLA	70	40
COCC[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450686455	GG	On-Demand	Mild	CPT1A	65	40
COCC[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450686455	GG	On-Demand	Mild	CPT2	42	38
COCC[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450686457	GG	On-Demand	Mild	HTR1B	15	41
COCC[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450686457	GG	On-Demand	Mild	COLA	70	40
COCC[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450686457	GG	On-Demand	Mild	CPT1A	65	40
COCC[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450686457	GG	On-Demand	Mild	CPT2	42	38
Cc1ccn(CC(=O)N[C@H]2CCC[C@H](C(C)C)CC2)n1	ZINC000450686458	CF	On-Demand	Anodyne	SCARB1	42	37
Cc1ccn(CC(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)n1	ZINC000450686460	CF	On-Demand	Anodyne	SCARB1	42	37
Cc1ccn(CC(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)n1	ZINC000450686462	CF	On-Demand	Anodyne	SCARB1	42	37
CC(C)[C@H](NCc1ccc([C@@H](C)C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000450686498	FG	On-Demand	Anodyne	FKBP1A	16	43
CC(C)[C@@H](NCc1ccc([C@@H](C)C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000450686500	FG	On-Demand	Anodyne	FKBP1A	16	43
CC(C)[C@@H](NCc1ccc([C@H](C)C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000450686502	FG	On-Demand	Anodyne	FKBP1A	16	43
COc1ccccc1-c1nnc(SCc2ccn(CC(F)(F)F)n2)o1	ZINC000450686506	FH	On-Demand	Anodyne	ALOX15	45	34
O=C(c1cnc(N2CCC(CF)CC2)c(Cl)c1)N1CCCCC1	ZINC000450686510	EH	On-Demand	Anodyne	P2RY12	28	43
O=C(c1cnc(N2CCC(CF)CC2)c(Cl)c1)N1CCCCC1	ZINC000450686510	EH	On-Demand	Anodyne	MPL	25	40
O=C(c1cnc(N2CCC(CF)CC2)c(Cl)c1)N1CCCCC1	ZINC000450686510	EH	On-Demand	Anodyne	CXCR3	30	50
O=C(c1cnc(N2CCC(CF)CC2)c(Cl)c1)N1CCCCC1	ZINC000450686510	EH	On-Demand	Anodyne	L3MBTL3	41	36
FCC1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450686522	CD	On-Demand	Anodyne	DKK1	0	40
FCC1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450686522	CD	On-Demand	Anodyne	SMG1	42	34
O=C(NCc1ccccc1)c1cc(N2CCC(CF)CC2)ccn1	ZINC000450686571	EG	On-Demand	Anodyne	MMP13	0	43
O=C(NCc1ccccc1)c1cc(N2CCC(CF)CC2)ccn1	ZINC000450686571	EG	On-Demand	Anodyne	NAMPT	43	35
CC[C@H](NCc1ccc(C(=O)OC)c(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000450686579	FI	On-Demand	Bother	CACNA1C	62	40
CC[C@H](NCc1ccc(C(=O)OC)c(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000450686579	FI	On-Demand	Bother	CACNA1D	99	40
CC[C@H](NCc1ccc(C(=O)OC)c(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000450686579	FI	On-Demand	Bother	PDS	31	41
CC[C@@H](NCc1ccc(C(=O)OC)c(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000450686581	FI	On-Demand	Bother	CACNA1C	62	40
CC[C@@H](NCc1ccc(C(=O)OC)c(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000450686581	FI	On-Demand	Bother	CACNA1D	99	40
CC[C@@H](NCc1ccc(C(=O)OC)c(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000450686581	FI	On-Demand	Bother	PDS	31	41
CC(C)c1nnc(CN2CCN(c3ccc(F)cn3)CC2)s1	ZINC000450686603	DF	On-Demand	Anodyne	SLC27A1	58	42
CCc1cc2c(N3CCC(CF)CC3)ncnc2s1	ZINC000450686626	CG	On-Demand	Anodyne	SIRT3	53	33
CCc1cc2c(N3CCC(CF)CC3)ncnc2s1	ZINC000450686626	CG	On-Demand	Anodyne	SIRT2	54	34
CCc1cc2c(N3CCC(CF)CC3)ncnc2s1	ZINC000450686626	CG	On-Demand	Anodyne	HTT	0	40
Cc1ccc(-c2nnc(SC[C@H]3CCCC3(F)F)o2)cc1	ZINC000450686634	DJ	On-Demand	Anodyne	TERT	0	42
Cc1ccc(-c2nnc(SC[C@@H]3CCCC3(F)F)o2)cc1	ZINC000450686635	DJ	On-Demand	Anodyne	TERT	0	42
Cc1ccn2ncc(C(=O)NCC3(CCOCc4ccccc4)CC3)c2c1	ZINC000450686636	FH	On-Demand	Anodyne	EPHB3	34	46
Cc1ccn2ncc(C(=O)NCC3(CCOCc4ccccc4)CC3)c2c1	ZINC000450686636	FH	On-Demand	Anodyne	HCN1	61	36
Cc1ccn2ncc(C(=O)NCC3(CCOCc4ccccc4)CC3)c2c1	ZINC000450686636	FH	On-Demand	Anodyne	HCN4	49	32
O=C(NC1(CCO)CCCCC1)c1cc(O)ccc1F	ZINC000450686637	CE	For-Sale	Anodyne	HSD17B1	28	40
CCc1cnc(CNC(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450686641	DF	On-Demand	Anodyne	TRPV1	0	44
CCc1cnc(CNC(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450686641	DF	On-Demand	Anodyne	P2RX7	32	40
CCc1cnc(CNC(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450686641	DF	On-Demand	Anodyne	PDE6A	43	34
CCc1cnc(CNC(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450686641	DF	On-Demand	Anodyne	NCE103	23	42
CCc1cnc(CNC(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450686641	DF	On-Demand	Anodyne	CAN2	0	42
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cn1	ZINC000450686643	FI	On-Demand	Anodyne	SLC9A1	45	38
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cn1	ZINC000450686643	FI	On-Demand	Anodyne	SFRP1	40	41
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cn1	ZINC000450686643	FI	On-Demand	Anodyne	L3MBTL3	58	38
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cn1	ZINC000450686643	FI	On-Demand	Anodyne	HPGD	30	40
CCCOc1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c(OC)c1	ZINC000450686644	FH	On-Demand	Anodyne	AVPR1A	0	44
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cn1	ZINC000450686645	FI	On-Demand	Anodyne	SLC9A1	45	38
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cn1	ZINC000450686645	FI	On-Demand	Anodyne	SFRP1	40	41
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cn1	ZINC000450686645	FI	On-Demand	Anodyne	L3MBTL3	58	38
CC(F)(F)c1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cn1	ZINC000450686645	FI	On-Demand	Anodyne	HPGD	30	40
CCCOc1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c(OC)c1	ZINC000450686646	FH	On-Demand	Anodyne	AVPR1A	0	44
COc1ccc(-c2ccnc(N[C@H](C)CC(C)(C)O)n2)cc1	ZINC000450686647	DG	On-Demand	Anodyne	CLK4	24	53
COc1ccc(-c2ccnc(N[C@@H](C)CC(C)(C)O)n2)cc1	ZINC000450686648	DG	On-Demand	Anodyne	CLK4	24	53
O=C(c1ccc(N2CCC(CF)CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450686652	FE	On-Demand	Bother	SLC6A9	17	43
O=C(c1ccc(N2CCC(CF)CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450686652	FE	On-Demand	Bother	L3MBTL3	25	44
COc1ccccc1[C@@H](CNC(=O)c1cc(C)c(C(N)=O)cn1)OC(C)C	ZINC000450686653	FE	On-Demand	Anodyne	CSF1R	37	41
COC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686661	EC	On-Demand	Anodyne	FOLH1	42	40
COC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686661	EC	On-Demand	Anodyne	CTSB	33	43
COC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686661	EC	On-Demand	Anodyne	CTSK	22	43
COC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686661	EC	On-Demand	Anodyne	CAPNS1	52	41
COC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686661	EC	On-Demand	Anodyne	HLA-DRB1	53	34
COC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686661	EC	On-Demand	Anodyne	CAPN1	76	41
COC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686661	EC	On-Demand	Anodyne	CAPN2	88	38
COC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686661	EC	On-Demand	Anodyne	NPR	48	48
COc1ccccc1[C@H](CNC(=O)c1cc(C)c(C(N)=O)cn1)OC(C)C	ZINC000450686662	FE	On-Demand	Anodyne	CSF1R	37	41
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686663	EC	On-Demand	Anodyne	FOLH1	42	40
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686663	EC	On-Demand	Anodyne	CTSB	33	43
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686663	EC	On-Demand	Anodyne	CTSK	22	43
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686663	EC	On-Demand	Anodyne	CAPNS1	52	41
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686663	EC	On-Demand	Anodyne	HLA-DRB1	53	34
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686663	EC	On-Demand	Anodyne	CAPN1	76	41
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686663	EC	On-Demand	Anodyne	CAPN2	88	38
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C(=O)OC	ZINC000450686663	EC	On-Demand	Anodyne	NPR	48	48
CN1CCN(S(=O)(=O)c2ccc(N3CCC(CF)CC3)nc2)CC1	ZINC000450686664	FD	On-Demand	Anodyne	GCK	57	33
CN1CCN(S(=O)(=O)c2ccc(N3CCC(CF)CC3)nc2)CC1	ZINC000450686664	FD	On-Demand	Anodyne	GCKR	77	36
O=C(c1cc(Br)c(F)cc1O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450686669	GH	On-Demand	Anodyne	AVPR1A	23	48
O=C(c1cc(Br)c(F)cc1O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450686680	GH	On-Demand	Anodyne	AVPR1A	23	48
O=C(Cc1cc2ccccc2c(O)n1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450686698	GI	On-Demand	Anodyne	GRIN2B	47	38
O=C(Cc1cc2ccccc2c(O)n1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450686698	GI	On-Demand	Anodyne	CCR3	34	47
COc1cc(OC)c2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450686699	DF	On-Demand	Anodyne	PDE3A	54	43
COc1cc(OC)c2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450686699	DF	On-Demand	Anodyne	PDE3B	79	43
O=C(c1ccc(N2CCC(CF)CC2)nc1)N1CCc2ccccc21	ZINC000450686702	EG	On-Demand	Anodyne	AVPR2	46	42
O=C(c1ccc(N2CCC(CF)CC2)nc1)N1CCc2ccccc21	ZINC000450686702	EG	On-Demand	Anodyne	HDAC1	0	43
N#Cc1cnc2c(F)ccc(Cl)c2c1N1CCC(CF)CC1	ZINC000450686712	DI	On-Demand	Mild	MAP3K8	51	33
COC1(C)CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450686717	CF	On-Demand	Anodyne	NPFFR1	47	43
Cc1cccc(-c2nnc(SCCC(C)(F)F)n2C)c1	ZINC000450686718	CH	On-Demand	Anodyne	DRD3	26	45
Cc1cccc(-c2nnc(SCCC(C)(F)F)n2C)c1	ZINC000450686718	CH	On-Demand	Anodyne	KCNH2	31	45
COc1cc2c(N[C@H](C)CC(C)(C)O)ncnc2cc1F	ZINC000450686719	CF	On-Demand	Anodyne	FGFR1	22	44
COc1cc2c(N[C@H](C)CC(C)(C)O)ncnc2cc1F	ZINC000450686719	CF	On-Demand	Anodyne	FLT1	25	42
COc1cc2c(N[C@H](C)CC(C)(C)O)ncnc2cc1F	ZINC000450686719	CF	On-Demand	Anodyne	EPHA2	43	35
COc1cc2c(N[C@@H](C)CC(C)(C)O)ncnc2cc1F	ZINC000450686720	CF	On-Demand	Anodyne	FGFR1	22	44
COc1cc2c(N[C@@H](C)CC(C)(C)O)ncnc2cc1F	ZINC000450686720	CF	On-Demand	Anodyne	FLT1	25	42
COc1cc2c(N[C@@H](C)CC(C)(C)O)ncnc2cc1F	ZINC000450686720	CF	On-Demand	Anodyne	EPHA2	43	35
CCNc1ccc(Cl)cc1NC(=O)c1cc(S(C)(=O)=O)ccc1CC	ZINC000450686723	GH	On-Demand	Anodyne	F10	32	47
CC(C)[C@@H](NCCC[C@H](C)O)C(=O)OC(C)(C)C	ZINC000450686739	CE	On-Demand	Anodyne	PGA5	43	38
CC(C)[C@@H](NCCC[C@@H](C)O)C(=O)OC(C)(C)C	ZINC000450686740	CE	On-Demand	Anodyne	PGA5	43	38
COC(=O)CC1(CNC(=O)c2ccc(C#N)n2C)CCCCC1	ZINC000450686782	DE	On-Demand	Mild	HCN1	50	31
COC(=O)CC1(CNC(=O)c2ccc(C#N)n2C)CCCCC1	ZINC000450686782	DE	On-Demand	Mild	HCN4	48	31
COc1cc(CC(=O)NCCc2cn(C)c3cc(F)ccc23)ccc1Cl	ZINC000450686791	FH	On-Demand	Anodyne	P2RX7	48	39
COc1cc(CC(=O)NCCc2cn(C)c3cc(F)ccc23)ccc1Cl	ZINC000450686791	FH	On-Demand	Anodyne	MTNR1A	28	46
COc1cc(CC(=O)NCCc2cn(C)c3cc(F)ccc23)ccc1Cl	ZINC000450686791	FH	On-Demand	Anodyne	NCE103	22	48
COc1cc(CC(=O)NCCc2cn(C)c3cc(F)ccc23)ccc1Cl	ZINC000450686791	FH	On-Demand	Anodyne	P96878_MYCTU	18	48
O=C(Cc1cc2ccccc2s1)N1CCC2(CC1)OCCc1ccsc12	ZINC000450686796	GJ	On-Demand	Anodyne	OPRL1	49	40
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450686807	DF	On-Demand	Anodyne	CA2	59	38
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450686807	DF	On-Demand	Anodyne	CA1	52	37
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450686807	DF	On-Demand	Anodyne	CA7	46	36
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450686807	DF	On-Demand	Anodyne	CA4	46	36
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450686807	DF	On-Demand	Anodyne	CA5A	45	36
Cc1nn(C)cc1CC(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450686812	EE	On-Demand	Anodyne	P2RX7	28	41
C=CCCCCNC(=O)c1cccc(SC)c1	ZINC000450686820	BG	On-Demand	Mild	DRD4	40	30
CC/C=C\CNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450686831	EF	On-Demand	Anodyne	CA2	17	45
CC/C=C\CNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450686831	EF	On-Demand	Anodyne	CA4	15	45
CC/C=C/CNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450686832	EF	On-Demand	Anodyne	CA2	17	45
CC/C=C/CNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450686832	EF	On-Demand	Anodyne	CA4	15	45
CC(C)[C@H](NCc1ccc([C@H](C)C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000450686838	FG	On-Demand	Anodyne	FKBP1A	16	43
COC[C@H]1CCCCN(C(=O)c2ccccc2-n2ccc(C)n2)C1	ZINC000450686843	EG	On-Demand	Anodyne	AVPR2	18	40
COC[C@@]1(C(=O)OC)CCN(c2ncccc2C(F)(F)F)C1	ZINC000450686844	DE	On-Demand	Anodyne	TRPV1	35	45
COC[C@]1(C(=O)OC)CCN(c2ncccc2C(F)(F)F)C1	ZINC000450686845	DE	On-Demand	Anodyne	TRPV1	35	45
COC[C@@H]1CCCCN(C(=O)c2ccccc2-n2ccc(C)n2)C1	ZINC000450686848	EG	On-Demand	Anodyne	AVPR2	18	40
CS[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686850	EH	On-Demand	Anodyne	PRNP	61	43
CS[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686850	EH	On-Demand	Anodyne	HDAC1	30	44
CS[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686850	EH	On-Demand	Anodyne	P4HTM	0	51
CS[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686850	EH	On-Demand	Anodyne	MCHR1	16	53
CS[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686850	EH	On-Demand	Anodyne	DGAT1	41	39
CS[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686853	EH	On-Demand	Anodyne	PRNP	61	43
CS[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686853	EH	On-Demand	Anodyne	HDAC1	30	44
CS[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686853	EH	On-Demand	Anodyne	P4HTM	0	51
CS[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686853	EH	On-Demand	Anodyne	MCHR1	16	53
CS[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450686853	EH	On-Demand	Anodyne	DGAT1	41	39
COC[C@H]1CCCCN(C(=O)c2cnn3ccc(C)cc23)C1	ZINC000450686854	DF	On-Demand	Anodyne	EPHB3	25	42
COC[C@@H]1CCCCN(C(=O)c2cnn3ccc(C)cc23)C1	ZINC000450686855	DF	On-Demand	Anodyne	EPHB3	25	42
COC[C@@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450686856	GF	On-Demand	Mild	COLA	72	41
COC[C@@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450686856	GF	On-Demand	Mild	CPT1A	69	41
COC[C@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450686857	GF	On-Demand	Mild	COLA	72	41
COC[C@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450686857	GF	On-Demand	Mild	CPT1A	69	41
COCc1ccc([C@@H]2CCCN2C(=O)c2cn3nccc3nc2C)o1	ZINC000450686861	EF	On-Demand	Anodyne	COLA	51	34
COCc1ccc([C@H]2CCCN2C(=O)c2cn3nccc3nc2C)o1	ZINC000450686862	EF	On-Demand	Anodyne	COLA	51	34
CS[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450686875	DH	On-Demand	Bother	LIPG	57	38
CS[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450686877	DH	On-Demand	Bother	LIPG	57	38
CCOC(=O)c1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)on1	ZINC000450686921	EE	On-Demand	Anodyne	AVPR1A	22	48
CCOC(=O)c1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)on1	ZINC000450686925	EE	On-Demand	Anodyne	AVPR1A	22	48
O=C(N[C@@H](CC1CCC1)c1ccccc1)[C@H](O)C1CCC1	ZINC000450686930	CG	On-Demand	Anodyne	SOAT1	41	45
O=C(N[C@@H](CC1CCC1)c1ccccc1)[C@H](O)C1CCC1	ZINC000450686930	CG	On-Demand	Anodyne	METAP2	26	58
O=C(N[C@H](CC1CCC1)c1ccccc1)[C@H](O)C1CCC1	ZINC000450686933	CG	On-Demand	Anodyne	SOAT1	41	45
O=C(N[C@H](CC1CCC1)c1ccccc1)[C@H](O)C1CCC1	ZINC000450686933	CG	On-Demand	Anodyne	METAP2	26	58
O=C(N[C@@H](CC1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450686936	CG	On-Demand	Anodyne	SOAT1	41	45
O=C(N[C@@H](CC1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450686936	CG	On-Demand	Anodyne	METAP2	26	58
O=C(N[C@H](CC1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450686937	CG	On-Demand	Anodyne	SOAT1	41	45
O=C(N[C@H](CC1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450686937	CG	On-Demand	Anodyne	METAP2	26	58
COc1cccc(C2(NCCC(=O)NCc3ccc(OC)cc3OC)CC2)c1	ZINC000450686939	GF	On-Demand	Anodyne	MTNR1A	93	41
COc1cccc(C2(NCCC(=O)NCc3ccc(OC)cc3OC)CC2)c1	ZINC000450686939	GF	On-Demand	Anodyne	MTNR1B	81	41
C/C=C\COc1cccc(CC(=O)N2CCc3ccncc32)c1	ZINC000450686945	DG	On-Demand	Anodyne	EIF2AK3	49	42
CCN(CCO)CCNC(=O)c1ccc2cnccc2c1	ZINC000450686962	CD	On-Demand	Anodyne	PDE2A	18	40
CCN(CCO)CCNC(=O)c1ccc2cnccc2c1	ZINC000450686962	CD	On-Demand	Anodyne	AKT1	18	40
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)on1	ZINC000450686969	GI	On-Demand	Anodyne	COLA	88	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)on1	ZINC000450686969	GI	On-Demand	Anodyne	CPT1A	85	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)on1	ZINC000450686969	GI	On-Demand	Anodyne	GRM5	0	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)on1	ZINC000450686975	GI	On-Demand	Anodyne	COLA	88	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)on1	ZINC000450686975	GI	On-Demand	Anodyne	CPT1A	85	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)on1	ZINC000450686975	GI	On-Demand	Anodyne	GRM5	0	41
CCc1nc(C)c(CSc2nnc(-c3ccc(OC(F)F)cc3)o2)o1	ZINC000450687001	FI	On-Demand	Anodyne	GSK3B	0	44
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[C@]2(C1)OCc1ccccc12	ZINC000450687008	GH	On-Demand	Bother	AVPR1A	21	45
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450687018	GH	On-Demand	Bother	AVPR1A	21	45
CCc1cccc(C(=O)NC[C@H](OC(C)C)c2ccccc2OC)n1	ZINC000450687039	EH	On-Demand	Anodyne	PDE5A	23	41
CCc1cccc(C(=O)NC[C@@H](OC(C)C)c2ccccc2OC)n1	ZINC000450687040	EH	On-Demand	Anodyne	PDE5A	23	41
c1ccc(OC[C@@H]2CCCN2c2ccnc3cccnc23)cc1	ZINC000450687048	DH	On-Demand	Anodyne	CASP3	52	39
c1ccc(OC[C@@H]2CCCN2c2ccnc3cccnc23)cc1	ZINC000450687048	DH	On-Demand	Anodyne	CHRNA10	72	53
c1ccc(OC[C@@H]2CCCN2c2ccnc3cccnc23)cc1	ZINC000450687048	DH	On-Demand	Anodyne	CASP7	46	39
O=c1c(Cl)c(N2CCC(CF)CC2)cnn1-c1cccc(C(F)(F)F)c1	ZINC000450687058	GI	On-Demand	Anodyne	PDS	15	58
CCS(=O)(=O)c1ccc(COc2ccc(OC)cc2[N+](=O)[O-])cc1	ZINC000450687060	FF	On-Demand	Bother	TPPP	0	45
COC[C@](C)(CCO)NC(=O)c1cc2ccncc2s1	ZINC000450687067	CD	On-Demand	Anodyne	VCAM1	52	35
COC[C@@](C)(CCO)NC(=O)c1cc2ccncc2s1	ZINC000450687069	CD	On-Demand	Anodyne	VCAM1	52	35
O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(N2CCC2)nc1	ZINC000450687086	FF	On-Demand	Bother	CXCR3	22	40
CCc1cc(CCCN[C@@H](C)c2ccc(-n3cccn3)cc2)on1	ZINC000450687088	DH	On-Demand	Anodyne	AMP1_PLAFQ	49	33
CCc1cc(CCCN[C@H](C)c2ccc(-n3cccn3)cc2)on1	ZINC000450687090	DH	On-Demand	Anodyne	AMP1_PLAFQ	52	38
COc1ccccc1-c1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)o1	ZINC000450687109	GK	On-Demand	Anodyne	GSK3B	20	47
COc1ccccc1-c1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)o1	ZINC000450687109	GK	On-Demand	Anodyne	GSK3A	55	43
COc1ccccc1-c1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)o1	ZINC000450687109	GK	On-Demand	Anodyne	ALOX15	56	35
COc1ccccc1-c1nnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)o1	ZINC000450687114	GK	On-Demand	Anodyne	GSK3B	20	47
COc1ccccc1-c1nnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)o1	ZINC000450687114	GK	On-Demand	Anodyne	GSK3A	55	43
COc1ccccc1-c1nnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)o1	ZINC000450687114	GK	On-Demand	Anodyne	ALOX15	56	35
CS[C@H]1CCN(c2nc(-c3ccccc3F)cs2)C1	ZINC000450687117	CH	On-Demand	Anodyne	GABRA3	47	32
CS[C@@H]1CCN(c2nc(-c3ccccc3F)cs2)C1	ZINC000450687120	CH	On-Demand	Anodyne	GABRA3	47	32
COc1ccccc1[C@@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC(C)C	ZINC000450687126	GH	On-Demand	Anodyne	TACR3	16	41
COc1ccccc1[C@@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC(C)C	ZINC000450687126	GH	On-Demand	Anodyne	CTSV	45	31
COC[C@]1(C(=O)OC)CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C1	ZINC000450687127	GF	On-Demand	Anodyne	MCHR1	16	40
COc1ccccc1[C@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC(C)C	ZINC000450687129	GH	On-Demand	Anodyne	TACR3	16	41
COc1ccccc1[C@H](CNC(=O)c1cc(-c2ccccc2)nn1C)OC(C)C	ZINC000450687129	GH	On-Demand	Anodyne	CTSV	45	31
COC[C@@]1(C(=O)OC)CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C1	ZINC000450687130	GF	On-Demand	Anodyne	MCHR1	16	40
COc1ccccc1[C@H](CNC(=O)c1ccc2cnccc2c1)OC(C)C	ZINC000450687150	FI	On-Demand	Anodyne	DRD3	19	44
COc1ccccc1[C@H](CNC(=O)c1ccc2cnccc2c1)OC(C)C	ZINC000450687150	FI	On-Demand	Anodyne	AKT1	0	44
COc1ccccc1[C@H](CNC(=O)c1ccc2cnccc2c1)OC(C)C	ZINC000450687150	FI	On-Demand	Anodyne	KCNK3	47	38
COc1ccccc1[C@@H](CNC(=O)c1ccc2cnccc2c1)OC(C)C	ZINC000450687151	FI	On-Demand	Anodyne	DRD3	19	44
COc1ccccc1[C@@H](CNC(=O)c1ccc2cnccc2c1)OC(C)C	ZINC000450687151	FI	On-Demand	Anodyne	AKT1	0	44
COc1ccccc1[C@@H](CNC(=O)c1ccc2cnccc2c1)OC(C)C	ZINC000450687151	FI	On-Demand	Anodyne	KCNK3	47	38
CCS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)cc1	ZINC000450687152	EH	On-Demand	Anodyne	CASP3	81	48
CCS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)cc1	ZINC000450687152	EH	On-Demand	Anodyne	CHRNA10	87	54
CCS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)cc1	ZINC000450687152	EH	On-Demand	Anodyne	CASP9	15	43
CCS(=O)(=O)c1ccc(N2CCC[C@H]2COc2ccccc2)cc1	ZINC000450687152	EH	On-Demand	Anodyne	CASP7	66	48
CC1(O)CC(C(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)C1	ZINC000450687156	DG	On-Demand	Anodyne	SRD5A2	0	40
CCCOc1ccc(C(=O)N2CCCC[C@H](COC)C2)c(OC)c1	ZINC000450687181	EG	On-Demand	Anodyne	OXTR	24	42
COC[C@]1(C(=O)OC)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450687185	EC	On-Demand	Anodyne	P2RY12	29	43
COC[C@]1(C(=O)OC)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450687185	EC	On-Demand	Anodyne	CXCR3	27	41
COC[C@@]1(C(=O)OC)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450687187	EC	On-Demand	Anodyne	P2RY12	29	43
COC[C@@]1(C(=O)OC)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450687187	EC	On-Demand	Anodyne	CXCR3	27	41
FCC1CCN(c2ccc(-c3ccc(Br)s3)nn2)CC1	ZINC000450687217	FI	On-Demand	Anodyne	SCD1	41	44
FCC1CCN(c2ccc(-c3ccc(Br)s3)nn2)CC1	ZINC000450687217	FI	On-Demand	Anodyne	SCD	30	44
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cn1	ZINC000450687234	GG	On-Demand	Anodyne	AVPR1A	17	43
C[C@H](CCC1CC1)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450687256	CG	On-Demand	Anodyne	TRPV1	57	35
C[C@@H](CCC1CC1)NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450687257	CG	On-Demand	Anodyne	TRPV1	57	35
COC[C@@H](NC(=O)C1(c2cccc(Cl)c2)CC(C)C1)C(=O)OC	ZINC000450687284	EE	On-Demand	Anodyne	TIMP3	41	33
COC[C@H](NC(=O)C1(c2cccc(Cl)c2)CC(C)C1)C(=O)OC	ZINC000450687285	EE	On-Demand	Anodyne	TIMP3	41	33
Cc1ccnc(-c2noc(CN3CCN(c4ccc(F)cn4)CC3)n2)c1	ZINC000450687291	FE	On-Demand	Anodyne	DRD4	17	41
C=CCOc1ccc(CC(=O)N[C@@H](C)CCC2CC2)cc1	ZINC000450687292	CG	On-Demand	Mild	ACACA	21	44
C=CCOc1ccc(CC(=O)N[C@@H](C)CCC2CC2)cc1	ZINC000450687292	CG	On-Demand	Mild	CACNA1I	18	41
C=CCOc1ccc(CC(=O)N[C@H](C)CCC2CC2)cc1	ZINC000450687293	CG	On-Demand	Mild	ACACA	21	44
C=CCOc1ccc(CC(=O)N[C@H](C)CCC2CC2)cc1	ZINC000450687293	CG	On-Demand	Mild	CACNA1I	18	41
CC(F)(F)c1ccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)cn1	ZINC000450687311	GJ	On-Demand	Anodyne	CHRM2	15	42
CC(F)(F)c1ccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)cn1	ZINC000450687311	GJ	On-Demand	Anodyne	GRIN2B	46	38
CC(F)(F)c1ccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)cn1	ZINC000450687311	GJ	On-Demand	Anodyne	CCR3	29	45
CC(F)(F)c1ccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)cn1	ZINC000450687311	GJ	On-Demand	Anodyne	SFRP1	67	43
CC(F)(F)c1ccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)cn1	ZINC000450687311	GJ	On-Demand	Anodyne	WNT3	54	33
Cc1cccc(-c2nnc(SCC3CC(F)(F)C3)n2C)c1	ZINC000450687328	DH	On-Demand	Anodyne	DRD2	22	41
Cc1cccc(-c2nnc(SCC3CC(F)(F)C3)n2C)c1	ZINC000450687328	DH	On-Demand	Anodyne	DRD3	24	41
CC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)C(C)(C)C1	ZINC000450687329	GG	On-Demand	Anodyne	CYP2J2	45	32
O=C(c1ccnn1CC(F)(F)F)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450687330	GH	On-Demand	Anodyne	CCR3	18	40
CCCOc1cccc(CN2CCc3ncc([N+](=O)[O-])cc3C2)c1	ZINC000450687340	EG	On-Demand	Bother	HRH2	30	40
CCCOc1cccc(CN2CCc3ncc([N+](=O)[O-])cc3C2)c1	ZINC000450687340	EG	On-Demand	Bother	ABHD6	0	40
CC1(C)CN(C(=O)C2CC2)CCN1CCCC(=O)c1ccccc1	ZINC000450687376	EF	On-Demand	Anodyne	CYP2J2	56	40
C[C@@H](OCc1ccc(F)cc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450687401	ED	On-Demand	Anodyne	CCR3	49	31
C[C@H](OCc1ccc(F)cc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450687402	ED	On-Demand	Anodyne	CCR3	49	31
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450687403	FF	On-Demand	Anodyne	DRD4	27	42
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450687403	FF	On-Demand	Anodyne	HDAC1	29	41
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450687403	FF	On-Demand	Anodyne	BIRC2	30	42
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450687403	FF	On-Demand	Anodyne	HPGDS	30	44
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450687404	FF	On-Demand	Anodyne	DRD4	27	42
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450687404	FF	On-Demand	Anodyne	HDAC1	29	41
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450687404	FF	On-Demand	Anodyne	BIRC2	30	42
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450687404	FF	On-Demand	Anodyne	HPGDS	30	44
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450687405	FF	On-Demand	Anodyne	DRD4	27	42
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450687405	FF	On-Demand	Anodyne	HDAC1	29	41
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450687405	FF	On-Demand	Anodyne	BIRC2	30	42
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450687405	FF	On-Demand	Anodyne	HPGDS	30	44
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450687406	FF	On-Demand	Anodyne	DRD4	27	42
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450687406	FF	On-Demand	Anodyne	HDAC1	29	41
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450687406	FF	On-Demand	Anodyne	BIRC2	30	42
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450687406	FF	On-Demand	Anodyne	HPGDS	30	44
CC/C=C/CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450687413	DE	On-Demand	Anodyne	TGM2	34	42
CC/C=C/CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450687413	DE	On-Demand	Anodyne	NAMPT	29	41
CC/C=C\CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450687414	DE	On-Demand	Anodyne	TGM2	34	42
CC/C=C\CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450687414	DE	On-Demand	Anodyne	NAMPT	29	41
CC[C@@H](O)CC(=O)N1CCC2(CC1)OCCc1ccsc12	ZINC000450687418	DE	On-Demand	Anodyne	OPRL1	43	37
CC[C@H](O)CC(=O)N1CCC2(CC1)OCCc1ccsc12	ZINC000450687419	DE	On-Demand	Anodyne	OPRL1	43	37
COc1cccc(-c2nnc(SCC3(C#N)CCC3)n2Cc2ccco2)c1	ZINC000450687426	GI	On-Demand	Mild	HCRTR2	19	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cn1	ZINC000450687438	GG	On-Demand	Anodyne	AVPR1A	17	43
CCC[C@@](C)(CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450687451	CE	On-Demand	Anodyne	CTSG	25	40
CCC[C@@](C)(CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450687451	CE	On-Demand	Anodyne	CTRB1	33	40
CCC[C@@](C)(CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450687451	CE	On-Demand	Anodyne	CELA2A	25	40
CCC[C@@](C)(CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450687451	CE	On-Demand	Anodyne	CAPN2	50	33
CCC[C@](C)(CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450687452	CE	On-Demand	Anodyne	CTSG	25	40
CCC[C@](C)(CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450687452	CE	On-Demand	Anodyne	CTRB1	33	40
CCC[C@](C)(CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450687452	CE	On-Demand	Anodyne	CELA2A	25	40
CCC[C@](C)(CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450687452	CE	On-Demand	Anodyne	CAPN2	50	33
CCC[C@](C)(CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450687453	CE	On-Demand	Anodyne	CTSG	25	40
CCC[C@](C)(CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450687453	CE	On-Demand	Anodyne	CTRB1	33	40
CCC[C@](C)(CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450687453	CE	On-Demand	Anodyne	CELA2A	25	40
CCC[C@](C)(CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450687453	CE	On-Demand	Anodyne	CAPN2	50	33
CCC[C@@](C)(CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450687454	CE	On-Demand	Anodyne	CTSG	25	40
CCC[C@@](C)(CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450687454	CE	On-Demand	Anodyne	CTRB1	33	40
CCC[C@@](C)(CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450687454	CE	On-Demand	Anodyne	CELA2A	25	40
CCC[C@@](C)(CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450687454	CE	On-Demand	Anodyne	CAPN2	50	33
Cc1cc(F)c(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1F	ZINC000450687459	EG	On-Demand	Anodyne	AVPR1A	0	42
Cc1cc(F)c(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1F	ZINC000450687460	EG	On-Demand	Anodyne	AVPR1A	0	42
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC=C(c3c(F)cccc3F)CC2)cn1	ZINC000450687483	GI	On-Demand	Anodyne	BDKRB1	0	41
CSc1ccc2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450687499	CH	On-Demand	Anodyne	PDE3A	50	38
CSc1ccc2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450687499	CH	On-Demand	Anodyne	PDGFRB	33	41
CSc1ccc2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450687499	CH	On-Demand	Anodyne	AKT2	22	42
CSc1ccc2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450687499	CH	On-Demand	Anodyne	PDE3B	74	38
CSc1ccc2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450687499	CH	On-Demand	Anodyne	SIRT3	61	37
CSc1ccc2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450687499	CH	On-Demand	Anodyne	SIRT2	60	37
CSc1ccc2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450687499	CH	On-Demand	Anodyne	SIRT1	59	36
CSc1ccc2ncnc(N3CCC(CF)CC3)c2c1	ZINC000450687499	CH	On-Demand	Anodyne	HTT	0	52
FCC1CCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450687521	CI	On-Demand	Anodyne	HRP1_PLAFA	97	37
FCC1CCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450687521	CI	On-Demand	Anodyne	HNMT	56	40
CCS(=O)(=O)c1ccc(CN[C@@H](c2cccc(C)c2)C(C)(C)C)cc1	ZINC000450687541	FJ	On-Demand	Anodyne	RORC	44	34
CCS(=O)(=O)c1ccc(CN[C@H](c2cccc(C)c2)C(C)(C)C)cc1	ZINC000450687542	FJ	On-Demand	Anodyne	RORC	44	34
COc1cc(CC(=O)NCC(C)(C)c2cccc(Cl)c2F)ccc1O	ZINC000450687585	FH	On-Demand	Anodyne	TRPV1	49	53
COc1cc(CC(=O)NCC(C)(C)c2cccc(Cl)c2F)ccc1O	ZINC000450687585	FH	On-Demand	Anodyne	NCE103	33	48
COc1cc(CC(=O)NCC(C)(C)c2cccc(Cl)c2F)ccc1O	ZINC000450687585	FH	On-Demand	Anodyne	ADCYAP1R1	41	34
COc1cc(CC(=O)NCC(C)(C)c2cccc(Cl)c2F)ccc1O	ZINC000450687585	FH	On-Demand	Anodyne	P96878_MYCTU	20	48
COC[C@]1(C(=O)OC)CCN(c2cc(C)nc3ccc(OC(F)F)cc23)C1	ZINC000450687594	GG	On-Demand	Anodyne	ADAM17	56	39
COC[C@@]1(C(=O)OC)CCN(c2cc(C)nc3ccc(OC(F)F)cc23)C1	ZINC000450687595	GG	On-Demand	Anodyne	ADAM17	56	39
CCS(=O)(=O)c1ccc(CNC(C)(C)c2ccc(F)c(F)c2)cc1	ZINC000450687600	FH	On-Demand	Anodyne	TRPV1	15	40
CCS(=O)(=O)c1ccc(CNC(C)(C)c2ccc(F)c(F)c2)cc1	ZINC000450687600	FH	On-Demand	Anodyne	RORC	41	35
CCCOc1ccc(C(=O)N2CCCC[C@@H](COC)C2)c(OC)c1	ZINC000450687621	EG	On-Demand	Anodyne	OXTR	24	42
COCC[C@@H]1CCCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450687670	FG	On-Demand	Anodyne	RIR1_HHV11	47	32
COCC[C@@H]1CCCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450687670	FG	On-Demand	Anodyne	RHODESAIN	0	44
COCC[C@H]1CCCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450687671	FG	On-Demand	Anodyne	RIR1_HHV11	47	32
COCC[C@H]1CCCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450687671	FG	On-Demand	Anodyne	RHODESAIN	0	44
COc1ccc(-c2nnc(N3CC[C@H](SC)C3)c3ccccc23)cc1	ZINC000450687688	FI	On-Demand	Anodyne	SMO	46	53
COc1ccc(-c2nnc(N3CC[C@@H](SC)C3)c3ccccc23)cc1	ZINC000450687689	FI	On-Demand	Anodyne	SMO	46	53
COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)o1	ZINC000450687700	FJ	On-Demand	Anodyne	CPT1A	69	36
COCc1nc(N2CC[C@H](SC)C2)c2c(-c3ccccc3)csc2n1	ZINC000450687701	FI	On-Demand	Anodyne	ADRB3	21	41
CCn1ccnc1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450687704	FD	On-Demand	Bother	BDKRB1	0	42
COCc1nc(N2CC[C@@H](SC)C2)c2c(-c3ccccc3)csc2n1	ZINC000450687706	FI	On-Demand	Anodyne	ADRB3	21	41
c1ccc(CCn2ccc(CNC3(c4ccc5c(c4)OCO5)CC3)n2)cc1	ZINC000450687710	FH	On-Demand	Anodyne	SCN9A	23	40
CC(C)[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCO1	ZINC000450687730	EE	On-Demand	Anodyne	EPHX2	20	42
CC(C)[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CCO1	ZINC000450687732	EE	On-Demand	Anodyne	EPHX2	20	42
c1ccc(OC[C@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450687754	DF	On-Demand	Anodyne	MAN2A1	0	40
c1ccc(OC[C@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450687754	DF	On-Demand	Anodyne	MAN1B1	55	40
COc1ccccc1-c1nnc(SCc2cn(CC3CC3)nn2)o1	ZINC000450687764	EG	On-Demand	Anodyne	ALOX15	0	41
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	MME	66	42
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	ANPEP	46	37
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	SDH1	0	41
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	CTSG	29	50
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	CTRB1	37	50
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	MMP2	27	44
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	MMP3	47	44
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	CELA2A	29	50
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	PAM	0	41
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	ACE2	62	37
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	LAP3	44	34
CC[C@@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687765	DF	On-Demand	Anodyne	POL	0	40
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	MME	66	42
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	ANPEP	46	37
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	SDH1	0	41
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	CTSG	29	50
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	CTRB1	37	50
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	MMP2	27	44
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	MMP3	47	44
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	CELA2A	29	50
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	PAM	0	41
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	ACE2	62	37
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	LAP3	44	34
CC[C@@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687766	DF	On-Demand	Anodyne	POL	0	40
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	MME	66	42
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	ANPEP	46	37
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	SDH1	0	41
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	CTSG	29	50
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	CTRB1	37	50
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	MMP2	27	44
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	MMP3	47	44
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	CELA2A	29	50
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	PAM	0	41
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	ACE2	62	37
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	LAP3	44	34
CC[C@H](O)CC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450687767	DF	On-Demand	Anodyne	POL	0	40
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	MME	66	42
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	ANPEP	46	37
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	SDH1	0	41
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	CTSG	29	50
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	CTRB1	37	50
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	MMP2	27	44
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	MMP3	47	44
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	CELA2A	29	50
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	PAM	0	41
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	ACE2	62	37
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	LAP3	44	34
CC[C@H](O)CC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450687768	DF	On-Demand	Anodyne	POL	0	40
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1nc2cc(F)ccc2o1	ZINC000450687796	DG	On-Demand	Anodyne	HTR3A	15	57
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1nc2cc(F)ccc2o1	ZINC000450687797	DG	On-Demand	Anodyne	HTR3A	15	57
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1nc2cc(F)ccc2o1	ZINC000450687798	DG	On-Demand	Anodyne	HTR3A	15	57
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1nc2cc(F)ccc2o1	ZINC000450687799	DG	On-Demand	Anodyne	HTR3A	15	57
COC(=O)CC1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCCCC1	ZINC000450687830	FF	On-Demand	Anodyne	HCN1	50	32
COC(=O)CC1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCCCC1	ZINC000450687830	FF	On-Demand	Anodyne	HCN4	48	32
COc1cccc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)c1	ZINC000450687845	GI	On-Demand	Anodyne	HCRTR2	19	41
COc1cccc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)c1	ZINC000450687846	GI	On-Demand	Anodyne	HCRTR2	19	41
c1ccc(C[C@@H]2CN(Cc3cn(CC4CC4)nn3)CCO2)cc1	ZINC000450687872	DE	On-Demand	Anodyne	DRD4	15	47
c1ccc(C[C@H]2CN(Cc3cn(CC4CC4)nn3)CCO2)cc1	ZINC000450687873	DE	On-Demand	Anodyne	DRD4	15	47
COC(=O)CC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450687880	GG	On-Demand	Anodyne	HCN1	54	34
COC(=O)CC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450687880	GG	On-Demand	Anodyne	HCN4	52	34
COC(=O)CC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450687880	GG	On-Demand	Anodyne	PDEC	0	41
COC(=O)CC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450687881	GG	On-Demand	Anodyne	HCN1	54	34
COC(=O)CC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450687881	GG	On-Demand	Anodyne	HCN4	52	34
COC(=O)CC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450687881	GG	On-Demand	Anodyne	PDEC	0	41
COc1cc(CC(=O)N[C@H]2C[C@H](OCc3ccccc3)C2(C)C)ccc1O	ZINC000450687893	FG	On-Demand	Anodyne	TRPV1	31	46
COc1cc(CC(=O)N[C@@H]2C[C@H](OCc3ccccc3)C2(C)C)ccc1O	ZINC000450687894	FG	On-Demand	Anodyne	TRPV1	31	46
COc1cc(CC(=O)N[C@H]2C[C@@H](OCc3ccccc3)C2(C)C)ccc1O	ZINC000450687895	FG	On-Demand	Anodyne	TRPV1	31	46
COc1cc(CC(=O)N[C@@H]2C[C@@H](OCc3ccccc3)C2(C)C)ccc1O	ZINC000450687896	FG	On-Demand	Anodyne	TRPV1	31	46
CC/C=C\CNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450687904	DH	On-Demand	Anodyne	AVPR2	70	42
CC/C=C\CNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450687904	DH	On-Demand	Anodyne	GPBAR1	18	43
CC/C=C/CNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450687905	DH	On-Demand	Anodyne	AVPR2	70	42
CC/C=C/CNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450687905	DH	On-Demand	Anodyne	GPBAR1	18	43
Cc1nc(C2CC2)ccc1C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450687935	FI	On-Demand	Anodyne	KCNA3	40	35
Cc1nc(C2CC2)ccc1C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450687935	FI	On-Demand	Anodyne	HCN1	43	32
Cc1nc(C2CC2)ccc1C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450687935	FI	On-Demand	Anodyne	HCN4	41	32
C=CCCCCNC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450687936	DE	On-Demand	Mild	CPT1A	46	32
COC(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450687949	FF	On-Demand	Anodyne	SIGMAR1	15	47
COC(=O)c1ccc(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450687950	FF	On-Demand	Anodyne	SIGMAR1	15	47
COc1ccc(CNC(=O)CCN[C@H](C)[C@H](C)c2ccccc2)c(OC)c1	ZINC000450687953	FG	On-Demand	Anodyne	NQO2	20	40
COc1ccc(CNC(=O)CCN[C@H](C)[C@H](C)c2ccccc2)c(OC)c1	ZINC000450687953	FG	On-Demand	Anodyne	MTNR1A	72	42
COc1ccc(CNC(=O)CCN[C@H](C)[C@H](C)c2ccccc2)c(OC)c1	ZINC000450687953	FG	On-Demand	Anodyne	MTNR1B	62	37
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450687954	FG	On-Demand	Anodyne	NQO2	20	40
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450687954	FG	On-Demand	Anodyne	MTNR1A	72	42
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450687954	FG	On-Demand	Anodyne	MTNR1B	62	37
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H](C)c2ccccc2)c(OC)c1	ZINC000450687955	FG	On-Demand	Anodyne	NQO2	20	40
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H](C)c2ccccc2)c(OC)c1	ZINC000450687955	FG	On-Demand	Anodyne	MTNR1A	72	42
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H](C)c2ccccc2)c(OC)c1	ZINC000450687955	FG	On-Demand	Anodyne	MTNR1B	62	37
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450687956	FG	On-Demand	Anodyne	NQO2	20	40
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450687956	FG	On-Demand	Anodyne	MTNR1A	72	42
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H](C)c2ccccc2)c(OC)c1	ZINC000450687956	FG	On-Demand	Anodyne	MTNR1B	62	37
Cc1nn(C)cc1CC(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450687957	EH	On-Demand	Anodyne	NPFFR2	25	43
Cc1nn(C)cc1CC(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450687957	EH	On-Demand	Anodyne	NPFFR1	41	43
Cc1nn(C)cc1CC(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450687957	EH	On-Demand	Anodyne	HCN1	51	33
Cc1nn(C)cc1CC(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450687957	EH	On-Demand	Anodyne	HCN4	47	31
Cc1cc(N2CCC(CF)CC2)c2cccc(F)c2n1	ZINC000450687961	CH	On-Demand	Anodyne	HTR4	15	40
CC(=O)CCCCCSc1nnc(-c2ccc(C)cc2)o1	ZINC000450687968	DI	On-Demand	Anodyne	TERT	0	42
COC(=O)c1ccc(CN[C@H](c2nnc3ccccn23)C(C)C)cc1Cl	ZINC000450687977	FH	On-Demand	Anodyne	PLK1	27	40
COC(=O)c1ccc(CN[C@@H](c2nnc3ccccn23)C(C)C)cc1Cl	ZINC000450687978	FH	On-Demand	Anodyne	PLK1	27	40
O=C(NCC1(CCOCc2ccccc2)CC1)c1ccsc1Br	ZINC000450687981	GJ	On-Demand	Anodyne	HCN1	52	35
O=C(NCC1(CCOCc2ccccc2)CC1)c1ccsc1Br	ZINC000450687981	GJ	On-Demand	Anodyne	HCN4	47	30
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450687985	EI	On-Demand	Anodyne	CCR3	27	43
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450687986	EI	On-Demand	Anodyne	CCR3	27	43
O=C(C[C@@H]1CC[C@H]2C[C@H]12)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450687987	EI	On-Demand	Anodyne	CCR3	27	43
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450687988	EI	On-Demand	Anodyne	CCR3	27	43
COc1ccc(-c2nnc(SCC3CC(F)(F)C3)n2Cc2ccco2)cc1	ZINC000450687989	GJ	On-Demand	Anodyne	HCRTR2	21	49
Cc1nc(C2CC2)ccc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450687990	EH	On-Demand	Anodyne	AVPR1A	0	47
Cc1nc(C2CC2)ccc1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450687991	EH	On-Demand	Anodyne	AVPR1A	0	47
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CC[C@@]3(C1)OCc1ccccc13)C(=O)C2	ZINC000450687999	EG	On-Demand	Anodyne	OXTR	29	41
COc1ccc(CC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c(Cl)c1OC	ZINC000450688005	GI	On-Demand	Anodyne	CCR1	42	38
CC1(C)[C@H]2CC[C@@]1(C(=O)N1CC[C@]3(C1)OCc1ccccc13)C(=O)C2	ZINC000450688006	EG	On-Demand	Anodyne	OXTR	29	41
C[C@H](O)CCCN[C@@H](COc1ccccc1F)C(C)(C)C	ZINC000450688009	CG	On-Demand	Anodyne	SDH1	0	45
C[C@@H](O)CCCN[C@@H](COc1ccccc1F)C(C)(C)C	ZINC000450688010	CG	On-Demand	Anodyne	SDH1	0	45
C[C@@H](O)CCCN[C@H](COc1ccccc1F)C(C)(C)C	ZINC000450688011	CG	On-Demand	Anodyne	SDH1	0	45
C[C@H](O)CCCN[C@H](COc1ccccc1F)C(C)(C)C	ZINC000450688012	CG	On-Demand	Anodyne	SDH1	0	45
O=C(Nc1nncs1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450688013	DE	On-Demand	Anodyne	DGAT1	30	41
O=C(Nc1nncs1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450688013	DE	On-Demand	Anodyne	HPGDS	29	44
COc1ccc(CC(=O)N2CC[C@H](c3c(F)cccc3F)C2)c(Cl)c1OC	ZINC000450688017	GI	On-Demand	Anodyne	CCR1	42	38
CCNc1ccc(Cl)cc1NC(=O)c1nn(C)c2c1CCCC2	ZINC000450688028	EH	On-Demand	Anodyne	CNR1	57	35
Cc1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)o2)cc1	ZINC000450688039	DH	On-Demand	Anodyne	TERT	0	41
Cc1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)o2)cc1	ZINC000450688041	DH	On-Demand	Anodyne	TERT	0	41
Cc1cc(N2CCC(CF)CC2)c2ccccc2n1	ZINC000450688056	CH	On-Demand	Anodyne	HTR1D	74	42
Cc1cc(N2CCC(CF)CC2)c2ccccc2n1	ZINC000450688056	CH	On-Demand	Anodyne	HTR1B	65	42
Cc1cc(N2CCC(CF)CC2)c2ccccc2n1	ZINC000450688056	CH	On-Demand	Anodyne	ADAM17	42	34
CC(=O)N[C@H](C(=O)N(C)CCN(C)CC(F)F)C(C)(C)C	ZINC000450688068	DD	On-Demand	Anodyne	PDF	45	32
COc1ccc(-c2nnc(SCC3(C#N)CCC3)n2Cc2ccco2)cc1	ZINC000450688099	GI	On-Demand	Mild	HCRTR2	19	47
C[C@H](CC(C)(C)O)Nc1ncc(-c2ccccc2)s1	ZINC000450688117	CH	On-Demand	Anodyne	FABK	0	44
C[C@@H](CC(C)(C)O)Nc1ncc(-c2ccccc2)s1	ZINC000450688118	CH	On-Demand	Anodyne	FABK	0	44
c1ccc(OC[C@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450688121	DF	On-Demand	Anodyne	MAN2A1	0	40
c1ccc(OC[C@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450688121	DF	On-Demand	Anodyne	MAN1B1	55	40
c1ccc(OC[C@@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450688122	DF	On-Demand	Anodyne	MAN2A1	0	40
c1ccc(OC[C@@H](NC[C@H]2COCCO2)c2ccccc2)cc1	ZINC000450688122	DF	On-Demand	Anodyne	MAN1B1	55	40
c1ccc(OC[C@@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450688123	DF	On-Demand	Anodyne	MAN2A1	0	40
c1ccc(OC[C@@H](NC[C@@H]2COCCO2)c2ccccc2)cc1	ZINC000450688123	DF	On-Demand	Anodyne	MAN1B1	55	40
COCC[C@@H]1CCCCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C1	ZINC000450688125	FF	On-Demand	Anodyne	DRD4	42	32
COCC[C@H]1CCCCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C1	ZINC000450688126	FF	On-Demand	Anodyne	DRD4	42	32
FC(F)Oc1nccnc1N1CCC[C@H]1COc1ccccc1	ZINC000450688127	DG	On-Demand	Anodyne	CHRNA10	67	49
COCC[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450688139	GI	On-Demand	Anodyne	CCR8	23	40
COCC[C@H]1CCCCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450688140	GI	On-Demand	Anodyne	CCR8	23	40
CS[C@@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450688148	CF	On-Demand	Anodyne	CREBBP	44	35
CS[C@@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450688148	CF	On-Demand	Anodyne	BRD9	56	35
CS[C@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450688153	CF	On-Demand	Anodyne	CREBBP	44	35
CS[C@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450688153	CF	On-Demand	Anodyne	BRD9	56	35
CS[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450688154	FI	On-Demand	Bother	AVPR2	24	40
CS[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450688154	FI	On-Demand	Bother	PRNP	44	33
CS[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450688154	FI	On-Demand	Bother	TAAR1	38	52
CS[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450688161	FI	On-Demand	Bother	AVPR2	24	40
CS[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450688161	FI	On-Demand	Bother	PRNP	44	33
CS[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450688161	FI	On-Demand	Bother	TAAR1	38	52
O=C(Cc1ccccc1O[C@H]1CCOC1)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450688176	GE	On-Demand	Anodyne	PDEC	0	40
CO[C@H]1COCC[C@@H]1CNc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl	ZINC000450688179	GG	On-Demand	Anodyne	NPBWR1	43	35
CO[C@@H]1COCC[C@@H]1CNc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl	ZINC000450688180	GG	On-Demand	Anodyne	NPBWR1	43	35
CO[C@H]1COCC[C@H]1CNc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl	ZINC000450688181	GG	On-Demand	Anodyne	NPBWR1	43	35
CO[C@@H]1COCC[C@H]1CNc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl	ZINC000450688182	GG	On-Demand	Anodyne	NPBWR1	43	35
O=C(Cc1ccccc1O[C@H]1CCOC1)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450688188	GE	On-Demand	Anodyne	PDEC	0	40
COC(=O)CC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450688189	FG	On-Demand	Anodyne	CACNA1G	28	41
COC(=O)CC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450688189	FG	On-Demand	Anodyne	HCN1	53	34
COC(=O)CC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450688189	FG	On-Demand	Anodyne	HCN4	52	34
COC(=O)CC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450688190	FG	On-Demand	Anodyne	CACNA1G	28	41
COC(=O)CC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450688190	FG	On-Demand	Anodyne	HCN1	53	34
COC(=O)CC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450688190	FG	On-Demand	Anodyne	HCN4	52	34
O=C(Cc1ccccc1O[C@@H]1CCOC1)N[C@@H](c1ccccc1)c1nc[nH]n1	ZINC000450688191	GE	On-Demand	Anodyne	PDEC	0	40
O=C(Cc1ccccc1O[C@@H]1CCOC1)N[C@H](c1ccccc1)c1nc[nH]n1	ZINC000450688193	GE	On-Demand	Anodyne	PDEC	0	40
N#Cc1ccc([N+](=O)[O-])c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450688223	DH	On-Demand	Mild	CASP3	45	43
N#Cc1ccc([N+](=O)[O-])c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450688223	DH	On-Demand	Mild	CHRNA10	82	49
N#Cc1ccc([N+](=O)[O-])c(N2CCC[C@H]2COc2ccccc2)c1	ZINC000450688223	DH	On-Demand	Mild	CASP7	52	43
COc1cc(OC)c2ncnc(N3CC[C@@H](SC)C3)c2c1	ZINC000450688245	DF	On-Demand	Anodyne	PDE3A	58	46
COc1cc(OC)c2ncnc(N3CC[C@@H](SC)C3)c2c1	ZINC000450688245	DF	On-Demand	Anodyne	PDE3B	85	46
COc1cc(OC)c2ncnc(N3CC[C@H](SC)C3)c2c1	ZINC000450688250	DF	On-Demand	Anodyne	PDE3A	58	46
COc1cc(OC)c2ncnc(N3CC[C@H](SC)C3)c2c1	ZINC000450688250	DF	On-Demand	Anodyne	PDE3B	85	46
CO[C@@H]1COCC[C@H]1CNc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450688299	GG	On-Demand	Anodyne	NPBWR1	47	40
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450688302	FH	On-Demand	Anodyne	OPRM1	0	43
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450688302	FH	On-Demand	Anodyne	OPRK1	43	43
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450688302	FH	On-Demand	Anodyne	COLA	51	37
COCc1ccc([C@@H]2CCCN2C(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450688302	FH	On-Demand	Anodyne	CPT1A	43	37
CO[C@H]1COCC[C@H]1CNc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450688303	GG	On-Demand	Anodyne	NPBWR1	47	40
CO[C@@H]1COCC[C@@H]1CNc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450688305	GG	On-Demand	Anodyne	NPBWR1	47	40
CO[C@H]1COCC[C@@H]1CNc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450688307	GG	On-Demand	Anodyne	NPBWR1	47	40
COC(=O)CC1(CNC(=O)c2ocnc2-c2ccccc2)CCCCC1	ZINC000450688312	FH	On-Demand	Anodyne	HCN1	53	32
COC(=O)CC1(CNC(=O)c2ocnc2-c2ccccc2)CCCCC1	ZINC000450688312	FH	On-Demand	Anodyne	HCN4	52	34
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450688317	FH	On-Demand	Anodyne	OPRM1	0	43
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450688317	FH	On-Demand	Anodyne	OPRK1	43	43
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450688317	FH	On-Demand	Anodyne	COLA	51	37
COCc1ccc([C@H]2CCCN2C(=O)Cc2ccc(Cl)c(OC)c2)o1	ZINC000450688317	FH	On-Demand	Anodyne	CPT1A	43	37
CCN(CC)S(=O)(=O)c1ccc(NCc2nccn2CC)c([N+](=O)[O-])c1	ZINC000450688350	GE	On-Demand	Bother	BDKRB1	0	43
COCCOc1ccc(Br)cc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450688355	FE	On-Demand	Anodyne	P2RX7	20	44
COCCOc1ccc(Br)cc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450688357	FE	On-Demand	Anodyne	P2RX7	20	44
CN(C)C(=O)N1CCN(CCCC(=O)c2ccccc2)C(C)(C)C1	ZINC000450688364	EF	On-Demand	Anodyne	CYP2J2	50	36
CCCn1c(S[C@H](C)C(=O)Nc2nccs2)nnc1-c1cccc(C)c1	ZINC000450688373	GI	On-Demand	Anodyne	MAP1	77	35
CCCn1c(S[C@@H](C)C(=O)Nc2nccs2)nnc1-c1cccc(C)c1	ZINC000450688375	GI	On-Demand	Anodyne	MAP1	77	35
CC1(C)[C@H](NC(=O)[C@@H]2CC2(F)F)C[C@H]1OCc1ccccc1	ZINC000450688407	DG	On-Demand	Anodyne	GRM2	40	43
CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)[C@H]1CC1(F)F	ZINC000450688409	DG	On-Demand	Anodyne	GRM2	40	43
CC1(C)[C@H](NC(=O)[C@H]2CC2(F)F)C[C@H]1OCc1ccccc1	ZINC000450688411	DG	On-Demand	Anodyne	GRM2	40	43
CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1(F)F	ZINC000450688413	DG	On-Demand	Anodyne	GRM2	40	43
CCC[C@@](C)(CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450688422	CE	On-Demand	Anodyne	MTNR1A	41	43
CCC[C@@](C)(CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450688422	CE	On-Demand	Anodyne	MTNR1B	37	43
CCC[C@](C)(CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450688423	CE	On-Demand	Anodyne	MTNR1A	41	43
CCC[C@](C)(CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450688423	CE	On-Demand	Anodyne	MTNR1B	37	43
NC(=O)c1cccc(N2CCC(CF)CC2)c1[N+](=O)[O-]	ZINC000450688438	CD	On-Demand	Bother	MDAA	0	43
O=C(NCC1(CCOCc2ccccc2)CC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450688448	GI	On-Demand	Anodyne	CACNA1G	19	40
O=C(NCC1(CCOCc2ccccc2)CC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450688449	GI	On-Demand	Anodyne	CACNA1G	18	40
CCOC(=O)c1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)[nH]c1C	ZINC000450688450	FF	On-Demand	Anodyne	AVPR1A	22	49
CCOC(=O)c1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)[nH]c1C	ZINC000450688451	FF	On-Demand	Anodyne	AVPR1A	22	49
CSc1cccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450688452	EH	On-Demand	Anodyne	AVPR1A	0	45
CSc1cccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450688453	EH	On-Demand	Anodyne	AVPR1A	0	45
O=C(NC1(CCO)CCCCC1)c1ccc(I)cc1F	ZINC000450688460	GG	On-Demand	Anodyne	MAP2K1	57	36
C=CCC1(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)CCCC1	ZINC000450688465	DH	On-Demand	Mild	AVPR1A	17	47
C=CCC1(C(=O)N2CC[C@]3(C2)OCc2ccccc23)CCCC1	ZINC000450688466	DH	On-Demand	Mild	AVPR1A	17	47
COc1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])cc1F	ZINC000450688477	FG	On-Demand	Bother	AVPR1A	21	43
COc1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])cc1F	ZINC000450688478	FG	On-Demand	Bother	AVPR1A	21	43
FCC1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450688485	FG	On-Demand	Anodyne	PDE3A	48	37
FCC1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450688485	FG	On-Demand	Anodyne	AKT2	20	41
FCC1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450688485	FG	On-Demand	Anodyne	PDE3B	71	37
FCC1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450688485	FG	On-Demand	Anodyne	SIRT3	54	34
FCC1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450688485	FG	On-Demand	Anodyne	SIRT2	55	34
FCC1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450688485	FG	On-Demand	Anodyne	SIRT1	54	34
FCC1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450688485	FG	On-Demand	Anodyne	HTT	0	48
Cc1ccn2ncc(C(=O)N3CC[C@@]4(C3)OCc3ccccc34)c2c1	ZINC000450688487	EF	On-Demand	Anodyne	AVPR1A	22	46
Cc1ccn2ncc(C(=O)N3CC[C@@]4(C3)OCc3ccccc34)c2c1	ZINC000450688487	EF	On-Demand	Anodyne	EPHB3	30	41
Cc1ccn2ncc(C(=O)N3CC[C@]4(C3)OCc3ccccc34)c2c1	ZINC000450688488	EF	On-Demand	Anodyne	AVPR1A	22	46
Cc1ccn2ncc(C(=O)N3CC[C@]4(C3)OCc3ccccc34)c2c1	ZINC000450688488	EF	On-Demand	Anodyne	EPHB3	30	41
CC[C@H](NCC1(C(=O)OC)CC1)C(C)(C)c1ccccc1	ZINC000450688495	CG	On-Demand	Anodyne	AMY2	53	33
CC[C@@H](NCC1(C(=O)OC)CC1)C(C)(C)c1ccccc1	ZINC000450688496	CG	On-Demand	Anodyne	AMY2	53	33
COc1ccccc1[C@@H](CNC(=O)[C@H](Cc1ccccc1)OC)OC(C)C	ZINC000450688499	FH	On-Demand	Anodyne	SOAT1	0	49
COc1ccccc1[C@@H](CNC(=O)[C@@H](Cc1ccccc1)OC)OC(C)C	ZINC000450688500	FH	On-Demand	Anodyne	SOAT1	0	49
COc1ccccc1[C@H](CNC(=O)[C@@H](Cc1ccccc1)OC)OC(C)C	ZINC000450688501	FH	On-Demand	Anodyne	SOAT1	0	49
COc1ccccc1[C@H](CNC(=O)[C@H](Cc1ccccc1)OC)OC(C)C	ZINC000450688502	FH	On-Demand	Anodyne	SOAT1	0	49
COc1ccc(-c2noc(CN[C@@H]3C[C@@H](C)CC[C@@H]3C(C)C)n2)nn1	ZINC000450688515	EG	On-Demand	Anodyne	TRPM8	0	43
COc1ccc(-c2noc(CN[C@@H]3C[C@@H](C)CC[C@H]3C(C)C)n2)nn1	ZINC000450688516	EG	On-Demand	Anodyne	TRPM8	0	43
COc1ccc(-c2noc(CN[C@@H]3C[C@H](C)CC[C@@H]3C(C)C)n2)nn1	ZINC000450688517	EG	On-Demand	Anodyne	TRPM8	0	43
COc1ccc(-c2noc(CN[C@@H]3C[C@H](C)CC[C@H]3C(C)C)n2)nn1	ZINC000450688518	EG	On-Demand	Anodyne	TRPM8	0	43
CC(C)CN1C(=O)C(=O)N(CCc2ccc(Cl)cc2)C1=O	ZINC000450688521	DE	On-Demand	Anodyne	CACNA1C	28	44
CC(C)CN1C(=O)C(=O)N(CCc2ccc(Cl)cc2)C1=O	ZINC000450688521	DE	On-Demand	Anodyne	CACNA1D	83	48
CCc1cc(NC[C@@H]2CCOC[C@H]2OC)n2ncnc2n1	ZINC000450688526	CD	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@@H]2CCOC[C@@H]2OC)n2ncnc2n1	ZINC000450688527	CD	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@H]2CCOC[C@@H]2OC)n2ncnc2n1	ZINC000450688528	CD	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@H]2CCOC[C@H]2OC)n2ncnc2n1	ZINC000450688529	CD	On-Demand	Anodyne	DHOD	0	44
COc1cc(CN2CCN(S(C)(=O)=O)[C@@H](C)C2)ccc1Cl	ZINC000450688577	ED	On-Demand	Anodyne	SSTR5	40	36
COc1cc(CN2CCN(S(C)(=O)=O)[C@@H](C)C2)ccc1Cl	ZINC000450688577	ED	On-Demand	Anodyne	UTS2R	24	44
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450688582	GH	On-Demand	Anodyne	CA2	36	42
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450688582	GH	On-Demand	Anodyne	CA1	30	42
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450688582	GH	On-Demand	Anodyne	CA7	21	45
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC(C)(C)C)c2ccccc2)cc1	ZINC000450688582	GH	On-Demand	Anodyne	CA14	20	40
CC/C=C/CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450688589	CG	On-Demand	Bother	TAAR1	18	47
CC/C=C\CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450688590	CG	On-Demand	Bother	TAAR1	18	47
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)C1CCOCC1	ZINC000450688597	FF	On-Demand	Anodyne	MTNR1A	55	38
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)C1CCOCC1	ZINC000450688598	FF	On-Demand	Anodyne	MTNR1A	55	38
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450688599	EE	On-Demand	Anodyne	NMUR2	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450688599	EE	On-Demand	Anodyne	NMUR1	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450688600	EE	On-Demand	Anodyne	NMUR2	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450688600	EE	On-Demand	Anodyne	NMUR1	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450688601	EE	On-Demand	Anodyne	NMUR2	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450688601	EE	On-Demand	Anodyne	NMUR1	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450688602	EE	On-Demand	Anodyne	NMUR2	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)C2CC2)CC1(C)C	ZINC000450688602	EE	On-Demand	Anodyne	NMUR1	0	42
COc1cccc(-n2cc(C(=O)NCc3nnnn3CC3CC3)nn2)c1	ZINC000450688610	FC	On-Demand	Anodyne	DRD4	41	32
C=CCCCCNC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450688612	CG	On-Demand	Mild	TBXA2R	17	42
COCc1ccc([C@H]2CCCN2C(=O)[C@H](C)Oc2ccccn2)o1	ZINC000450688631	EF	On-Demand	Anodyne	COLA	73	38
COCc1ccc([C@H]2CCCN2C(=O)[C@H](C)Oc2ccccn2)o1	ZINC000450688631	EF	On-Demand	Anodyne	CPT1A	44	38
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](C)Oc2ccccn2)o1	ZINC000450688632	EF	On-Demand	Anodyne	COLA	73	38
COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](C)Oc2ccccn2)o1	ZINC000450688632	EF	On-Demand	Anodyne	CPT1A	44	38
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](C)Oc2ccccn2)o1	ZINC000450688633	EF	On-Demand	Anodyne	COLA	73	38
COCc1ccc([C@H]2CCCN2C(=O)[C@@H](C)Oc2ccccn2)o1	ZINC000450688633	EF	On-Demand	Anodyne	CPT1A	44	38
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](C)Oc2ccccn2)o1	ZINC000450688634	EF	On-Demand	Anodyne	COLA	73	38
COCc1ccc([C@@H]2CCCN2C(=O)[C@H](C)Oc2ccccn2)o1	ZINC000450688634	EF	On-Demand	Anodyne	CPT1A	44	38
CC(=O)CCCCCOc1ccc(Br)cc1F	ZINC000450688642	DI	On-Demand	Anodyne	THRA	27	46
CC(=O)CCCCCOc1ccc(Br)cc1F	ZINC000450688642	DI	On-Demand	Anodyne	THRB	0	46
COCc1ccc([C@H]2CCCN2C(=O)CC2CC(F)(F)C2)o1	ZINC000450688653	DH	On-Demand	Anodyne	COLA	65	34
COCc1ccc([C@H]2CCCN2C(=O)CC2CC(F)(F)C2)o1	ZINC000450688653	DH	On-Demand	Anodyne	CPT1A	62	34
COCc1ccc([C@@H]2CCCN2C(=O)CC2CC(F)(F)C2)o1	ZINC000450688654	DH	On-Demand	Anodyne	COLA	65	34
COCc1ccc([C@@H]2CCCN2C(=O)CC2CC(F)(F)C2)o1	ZINC000450688654	DH	On-Demand	Anodyne	CPT1A	62	34
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450688662	EI	On-Demand	Anodyne	SLC6A1	28	42
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450688662	EI	On-Demand	Anodyne	SLC6A3	16	44
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450688662	EI	On-Demand	Anodyne	CCR5	26	44
COCC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450688663	EI	On-Demand	Anodyne	SLC6A1	28	42
COCC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450688663	EI	On-Demand	Anodyne	SLC6A3	16	44
COCC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450688663	EI	On-Demand	Anodyne	CCR5	26	44
COCC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450688664	EI	On-Demand	Anodyne	SLC6A1	28	42
COCC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450688664	EI	On-Demand	Anodyne	SLC6A3	16	44
COCC[C@@H]1CCCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450688664	EI	On-Demand	Anodyne	CCR5	26	44
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450688665	EI	On-Demand	Anodyne	SLC6A1	28	42
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450688665	EI	On-Demand	Anodyne	SLC6A3	16	44
COCC[C@@H]1CCCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450688665	EI	On-Demand	Anodyne	CCR5	26	44
COC(=O)c1nc(N2CCC[C@H]2COc2ccccc2)sc1C	ZINC000450688666	EG	On-Demand	Anodyne	COLA	64	40
COC(=O)c1nc(N2CCC[C@H]2COc2ccccc2)sc1C	ZINC000450688666	EG	On-Demand	Anodyne	CPT1A	60	40
COC(=O)c1nc(N2CCC[C@H]2COc2ccccc2)sc1C	ZINC000450688666	EG	On-Demand	Anodyne	CHRNA10	66	46
COc1ccc(C2(NCCC(=O)NCc3ccc(OC)cc3OC)CC2)cc1	ZINC000450688676	GF	On-Demand	Anodyne	HTR7	23	40
COc1ccc(C2(NCCC(=O)NCc3ccc(OC)cc3OC)CC2)cc1	ZINC000450688676	GF	On-Demand	Anodyne	MTNR1A	83	40
COc1ccc(C2(NCCC(=O)NCc3ccc(OC)cc3OC)CC2)cc1	ZINC000450688676	GF	On-Demand	Anodyne	MTNR1B	68	39
Fc1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450688679	CG	On-Demand	Anodyne	CASP3	53	38
Fc1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450688679	CG	On-Demand	Anodyne	CHRNA10	80	53
Fc1ccc(N2CCC[C@H]2COc2ccccc2)nc1	ZINC000450688679	CG	On-Demand	Anodyne	CASP7	51	41
CS[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C1	ZINC000450688692	DF	On-Demand	Anodyne	PDE3B	57	35
CS[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C1	ZINC000450688693	DF	On-Demand	Anodyne	PDE3B	57	35
COCc1ccc([C@@H]2CCCN2C(=O)c2cccc3c2CCCC3)o1	ZINC000450688699	EI	On-Demand	Anodyne	COLA	50	33
COCc1ccc([C@@H]2CCCN2C(=O)c2cccc3c2CCCC3)o1	ZINC000450688699	EI	On-Demand	Anodyne	CPT1A	50	33
COCc1ccc([C@H]2CCCN2C(=O)c2cccc3c2CCCC3)o1	ZINC000450688700	EI	On-Demand	Anodyne	COLA	50	33
COCc1ccc([C@H]2CCCN2C(=O)c2cccc3c2CCCC3)o1	ZINC000450688700	EI	On-Demand	Anodyne	CPT1A	50	33
COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(C)(F)F)nc2)o1	ZINC000450688701	FH	On-Demand	Anodyne	COLA	40	36
COCc1ccc([C@H]2CCCN2C(=O)c2ccc(C(C)(F)F)nc2)o1	ZINC000450688702	FH	On-Demand	Anodyne	COLA	40	36
COc1ccc(-c2noc(N3CCC(CF)CC3)n2)cc1	ZINC000450688758	CF	On-Demand	Anodyne	LUCI_PHOPE	21	42
Cc1nc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)ncc1[N+](=O)[O-]	ZINC000450688760	EI	On-Demand	Bother	MAPK1	41	36
C[C@@H](O)CCCN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450688766	CD	On-Demand	Anodyne	ALDH1A1	45	38
C[C@H](O)CCCN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000450688769	CD	On-Demand	Anodyne	ALDH1A1	45	38
Cc1nc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)ncc1[N+](=O)[O-]	ZINC000450688788	EI	On-Demand	Bother	MAPK1	41	36
Cc1ccc2c(c1)nc(CNC(=O)CCCn1nc(C)nc1C)n2C	ZINC000450688808	EE	On-Demand	Anodyne	HTR7	22	41
FCC1CCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450688818	CI	On-Demand	Anodyne	HRP1_PLAFA	47	36
FCC1CCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450688818	CI	On-Demand	Anodyne	HNMT	47	33
FCC1CCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450688818	CI	On-Demand	Anodyne	HTT	0	42
O=C(CSC1CC1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450688823	EH	On-Demand	Anodyne	GRIN2B	43	39
O=C(CSC1CC1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450688823	EH	On-Demand	Anodyne	CCR3	34	46
COC[C@H](NC(=O)c1cc(OC)ccc1OC(F)(F)F)C(=O)OC	ZINC000450688835	FD	On-Demand	Anodyne	KCNK9	20	40
COC[C@@H](NC(=O)c1cc(OC)ccc1OC(F)(F)F)C(=O)OC	ZINC000450688837	FD	On-Demand	Anodyne	KCNK9	20	40
Cc1nc(C)n(CCCC(=O)NCC2(Cc3ccccc3)CCCCC2)n1	ZINC000450688848	FH	On-Demand	Anodyne	NPFFR1	31	40
COC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450688865	EC	On-Demand	Anodyne	PTGER3	24	42
COC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450688865	EC	On-Demand	Anodyne	F7	31	45
COC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450688865	EC	On-Demand	Anodyne	PSBA	0	43
CCC[C@@](C)(CO)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450688869	DD	On-Demand	Anodyne	DRD4	40	31
COC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450688870	EC	On-Demand	Anodyne	PTGER3	24	42
COC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450688870	EC	On-Demand	Anodyne	F7	31	45
COC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450688870	EC	On-Demand	Anodyne	PSBA	0	43
CCC[C@](C)(CO)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450688871	DD	On-Demand	Anodyne	DRD4	40	31
C[C@H](OCCc1ccccc1)C(=O)NC1(CCO)CCCCC1	ZINC000450688873	DF	On-Demand	Anodyne	ACE	15	41
C[C@@H](OCCc1ccccc1)C(=O)NC1(CCO)CCCCC1	ZINC000450688874	DF	On-Demand	Anodyne	ACE	15	41
CCC(CC)(CCSc1nnc(-c2ccccc2OC)n1C)C(=O)OC	ZINC000450688892	GH	On-Demand	Anodyne	KCNH2	0	41
O=C(Cc1ccc(O)c(F)c1)NCC1(CCOCc2ccccc2)CC1	ZINC000450688901	FH	On-Demand	Anodyne	NCE103	17	40
COc1cc(CC(=O)NC2(CCO)CCCCC2)ccc1Cl	ZINC000450688902	EG	On-Demand	Anodyne	PDE6A	40	30
CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450688903	GG	On-Demand	Anodyne	SMO	0	40
CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450688903	GG	On-Demand	Anodyne	RORC	18	42
Cc1sccc1C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450688908	DH	On-Demand	Anodyne	L3MBTL3	41	35
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1C(F)(F)F	ZINC000450688909	FI	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1C(F)(F)F	ZINC000450688910	FI	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1C(F)(F)F	ZINC000450688911	FI	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1C(F)(F)F	ZINC000450688913	FI	On-Demand	Bother	AADAC	0	40
Cc1sccc1C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450688921	DH	On-Demand	Anodyne	L3MBTL3	41	35
COc1ccc(-n2c(SC[C@H](O)CC#N)nnc2-c2cccc(C)c2)cc1	ZINC000450688943	GH	On-Demand	Mild	WNT3A	20	40
O=C(c1cc2n(n1)CCC2)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450688948	EG	On-Demand	Anodyne	GRIN2B	34	40
O=C(c1cc2n(n1)CCC2)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450688948	EG	On-Demand	Anodyne	CCR3	24	41
COC(=O)CCN1CCN(CCc2ccc(Cl)cc2)[C@H](C)C1	ZINC000450688965	DE	On-Demand	Anodyne	SLC6A1	34	45
COC(=O)CCN1CCN(CCc2ccc(Cl)cc2)[C@H](C)C1	ZINC000450688965	DE	On-Demand	Anodyne	HRH3	30	55
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1	ZINC000450688999	FE	On-Demand	Anodyne	DRD4	25	43
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1	ZINC000450688999	FE	On-Demand	Anodyne	MLNR	19	42
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1	ZINC000450688999	FE	On-Demand	Anodyne	SLC27A1	45	44
C/C=C\COc1cccc(CC(=O)NCc2ncc(CC)o2)c1	ZINC000450689002	DG	On-Demand	Anodyne	PDS	40	32
O=C(c1ccsn1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450689007	DH	On-Demand	Anodyne	GRIN2B	43	42
O=C(c1ccsn1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450689007	DH	On-Demand	Anodyne	CCR3	27	40
O=C(c1ccsn1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450689007	DH	On-Demand	Anodyne	PARP1	40	36
CO[C@@H]1COCC[C@H]1CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450689030	FC	On-Demand	Anodyne	NPY1R	40	34
CO[C@H]1COCC[C@@H]1CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450689031	FC	On-Demand	Anodyne	NPY1R	40	34
CO[C@@H]1COCC[C@@H]1CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450689032	FC	On-Demand	Anodyne	NPY1R	40	34
CO[C@H]1COCC[C@H]1CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450689033	FC	On-Demand	Anodyne	NPY1R	40	34
CC/C=C\CNc1ncnc2c1ncn2C1CC1	ZINC000450689038	BF	On-Demand	Anodyne	ADORA1	49	43
CC/C=C\CNc1ncnc2c1ncn2C1CC1	ZINC000450689038	BF	On-Demand	Anodyne	ADORA2A	24	48
CC/C=C\CNc1ncnc2c1ncn2C1CC1	ZINC000450689038	BF	On-Demand	Anodyne	ADORA3	70	40
CC/C=C/CNc1ncnc2c1ncn2C1CC1	ZINC000450689039	BF	On-Demand	Anodyne	ADORA1	49	43
CC/C=C/CNc1ncnc2c1ncn2C1CC1	ZINC000450689039	BF	On-Demand	Anodyne	ADORA2A	24	48
CC/C=C/CNc1ncnc2c1ncn2C1CC1	ZINC000450689039	BF	On-Demand	Anodyne	ADORA3	70	40
COC(=O)C1(CN[C@H](c2ccc(F)c(C)c2)C2CC2)CC1	ZINC000450689040	CG	On-Demand	Anodyne	LEF	53	39
COC(=O)C1(CN[C@@H](c2ccc(F)c(C)c2)C2CC2)CC1	ZINC000450689041	CG	On-Demand	Anodyne	LEF	53	39
O=C(NCc1nnnn1CC1CC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450689042	GD	On-Demand	Anodyne	TRPC6	55	33
O=C(NCc1nnnn1CC1CC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450689042	GD	On-Demand	Anodyne	TRPC3	48	33
CC[S@](=O)CC(=O)N[C@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450689043	FF	On-Demand	Anodyne	UTS2	54	37
CC[S@@](=O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450689044	FF	On-Demand	Anodyne	UTS2	54	37
CC[S@](=O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450689045	FF	On-Demand	Anodyne	UTS2	54	37
CC[S@@](=O)CC(=O)N[C@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450689046	FF	On-Demand	Anodyne	UTS2	54	37
C[C@H]1CN(C[C@@H](O)[C@H](C)c2ccccc2)C[C@@H](C)O1	ZINC000450689053	CE	On-Demand	Anodyne	ERG2	25	44
C[C@H]1CN(C[C@@H](O)[C@@H](C)c2ccccc2)C[C@@H](C)O1	ZINC000450689055	CE	On-Demand	Anodyne	ERG2	25	44
CCC[C@H]1CN(Cc2nc(C(=O)OC)cs2)CCN1Cc1ccccc1	ZINC000450689057	FG	On-Demand	Anodyne	SIGMAR1	26	40
CCC[C@@H]1CN(Cc2nc(C(=O)OC)cs2)CCN1Cc1ccccc1	ZINC000450689059	FG	On-Demand	Anodyne	SIGMAR1	26	40
CCOC(=O)[C@H](NCCC[C@H](C)O)[C@H](C)CC	ZINC000450689068	BD	On-Demand	Anodyne	METAP2	0	41
CCOC(=O)[C@H](NCCC[C@@H](C)O)[C@H](C)CC	ZINC000450689070	BD	On-Demand	Anodyne	METAP2	0	41
CCOC(=O)[C@H](NCCC[C@@H](C)O)[C@@H](C)CC	ZINC000450689071	BD	On-Demand	Anodyne	METAP2	0	41
CCOC(=O)[C@H](NCCC[C@H](C)O)[C@@H](C)CC	ZINC000450689073	BD	On-Demand	Anodyne	METAP2	0	41
COC[C@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689075	FH	On-Demand	Anodyne	GRM3	15	46
COC[C@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689075	FH	On-Demand	Anodyne	COLA	45	36
COC[C@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689075	FH	On-Demand	Anodyne	CPT1A	49	36
COC[C@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689075	FH	On-Demand	Anodyne	MMP2	0	40
COC[C@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689075	FH	On-Demand	Anodyne	MMP9	15	40
COC[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689076	FH	On-Demand	Anodyne	GRM3	15	46
COC[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689076	FH	On-Demand	Anodyne	COLA	45	36
COC[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689076	FH	On-Demand	Anodyne	CPT1A	49	36
COC[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689076	FH	On-Demand	Anodyne	MMP2	0	40
COC[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)C1	ZINC000450689076	FH	On-Demand	Anodyne	MMP9	15	40
COC[C@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450689079	DD	On-Demand	Anodyne	TRPV1	26	42
COC[C@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450689079	DD	On-Demand	Anodyne	NCE103	23	43
CN(C)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450689080	EF	On-Demand	Anodyne	DRD2	30	42
CN(C)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450689080	EF	On-Demand	Anodyne	DRD4	0	43
CN(C)C(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450689080	EF	On-Demand	Anodyne	SLC18A3	0	45
COC[C@@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450689081	DD	On-Demand	Anodyne	TRPV1	26	42
COC[C@@](C)(CCO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450689081	DD	On-Demand	Anodyne	NCE103	23	43
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@H]2COc2ccccc2)n1	ZINC000450689083	FF	On-Demand	Bother	CHRNA10	60	43
CCCOc1ccc(C(=O)N[C@H](c2ccccc2)c2nc[nH]n2)c(OC)c1	ZINC000450689090	FG	On-Demand	Anodyne	SOAT1	20	48
CCCOc1ccc(C(=O)N[C@@H](c2ccccc2)c2nc[nH]n2)c(OC)c1	ZINC000450689091	FG	On-Demand	Anodyne	SOAT1	20	48
CS[C@@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450689095	DF	On-Demand	Anodyne	LRRK2	25	41
CS[C@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450689096	DF	On-Demand	Anodyne	LRRK2	25	41
CO[C@@H]1COCC[C@@H]1CNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450689123	FE	On-Demand	Anodyne	NPBWR1	55	42
CO[C@@H]1COCC[C@H]1CNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450689125	FE	On-Demand	Anodyne	NPBWR1	55	42
CO[C@H]1COCC[C@H]1CNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450689127	FE	On-Demand	Anodyne	NPBWR1	55	42
CO[C@H]1COCC[C@@H]1CNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450689128	FE	On-Demand	Anodyne	NPBWR1	55	42
C=CCCCCNC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450689153	CG	On-Demand	Mild	DRD4	40	31
C=CCCCCNC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450689153	CG	On-Demand	Mild	MTNR1A	38	40
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450689159	EH	On-Demand	Anodyne	SIGMAR1	42	38
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450689159	EH	On-Demand	Anodyne	TIMP3	57	33
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450689159	EH	On-Demand	Anodyne	BIRC2	31	42
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450689159	EH	On-Demand	Anodyne	NPFFR1	42	32
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450689160	EH	On-Demand	Anodyne	SIGMAR1	42	38
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450689160	EH	On-Demand	Anodyne	TIMP3	57	33
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450689160	EH	On-Demand	Anodyne	BIRC2	31	42
C[C@H](NC(=O)[C@@]1(C)CC=CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450689160	EH	On-Demand	Anodyne	NPFFR1	42	32
C[C@H](NC(=O)[C@]1(C)CC=CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450689161	EH	On-Demand	Anodyne	SIGMAR1	42	38
C[C@H](NC(=O)[C@]1(C)CC=CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450689161	EH	On-Demand	Anodyne	TIMP3	57	33
C[C@H](NC(=O)[C@]1(C)CC=CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450689161	EH	On-Demand	Anodyne	BIRC2	31	42
C[C@H](NC(=O)[C@]1(C)CC=CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450689161	EH	On-Demand	Anodyne	NPFFR1	42	32
C[C@H](NC(=O)[C@]1(C)CC=CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450689162	EH	On-Demand	Anodyne	SIGMAR1	42	38
C[C@H](NC(=O)[C@]1(C)CC=CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450689162	EH	On-Demand	Anodyne	TIMP3	57	33
C[C@H](NC(=O)[C@]1(C)CC=CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450689162	EH	On-Demand	Anodyne	BIRC2	31	42
C[C@H](NC(=O)[C@]1(C)CC=CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450689162	EH	On-Demand	Anodyne	NPFFR1	42	32
CN(C)c1nccc(N2CCC(CF)CC2)n1	ZINC000450689175	BD	On-Demand	Anodyne	SORD	62	40
CS(=O)(=O)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450689176	CD	On-Demand	Anodyne	GPR119	32	56
Cc1cc(C(=O)NCC2(CCOCc3ccccc3)CC2)nn1C(C)C	ZINC000450689180	FH	On-Demand	Anodyne	HCN1	54	32
Cc1cc(C(=O)NCC2(CCOCc3ccccc3)CC2)nn1C(C)C	ZINC000450689180	FH	On-Demand	Anodyne	HCN4	48	34
Cc1cccc(Cl)c1CN[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450689194	DI	On-Demand	Bother	COLA	51	33
Cc1cccc(Cl)c1CN[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000450689195	DI	On-Demand	Bother	COLA	51	33
Cc1c(C(=O)NCC2(CCOCc3ccccc3)CC2)nn2c1OCCC2	ZINC000450689198	FG	On-Demand	Anodyne	HCN1	48	30
Cc1c(C(=O)NCC2(CCOCc3ccccc3)CC2)nn2c1OCCC2	ZINC000450689198	FG	On-Demand	Anodyne	HCN4	46	30
Cc1ccccc1-c1nnc(SCC[C@H]2CCOC2)n1C	ZINC000450689209	DG	On-Demand	Anodyne	DRD3	47	36
Cc1ccccc1-c1nnc(SCC[C@@H]2CCOC2)n1C	ZINC000450689210	DG	On-Demand	Anodyne	DRD3	47	36
N=c1ccc2c(N3CCC(CF)CC3)ncnc2[nH]1	ZINC000450689231	CD	On-Demand	Anodyne	SIRT1	53	33
C[C@H](Oc1ccccn1)C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450689232	FG	On-Demand	Anodyne	CAPN2	40	36
C[C@@H](Oc1ccccn1)C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450689233	FG	On-Demand	Anodyne	CAPN2	40	36
Cc1cc(N2CCC(CF)CC2)c2cc(F)ccc2n1	ZINC000450689234	CH	On-Demand	Anodyne	DHODH	44	37
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2C)C2CC2)c(OC)c1	ZINC000450689235	GH	On-Demand	Anodyne	MTNR1A	69	36
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2C)C2CC2)c(OC)c1	ZINC000450689235	GH	On-Demand	Anodyne	MTNR1B	56	36
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2C)C2CC2)c(OC)c1	ZINC000450689236	GH	On-Demand	Anodyne	MTNR1A	69	36
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2C)C2CC2)c(OC)c1	ZINC000450689236	GH	On-Demand	Anodyne	MTNR1B	56	36
COc1ccccc1[C@@H](CNC(=O)C[C@H]1COc2ccccc2O1)OC(C)C	ZINC000450689242	GH	On-Demand	Anodyne	ADRA1B	15	45
COc1ccccc1[C@@H](CNC(=O)C[C@H]1COc2ccccc2O1)OC(C)C	ZINC000450689242	GH	On-Demand	Anodyne	ADRA2B	15	45
COc1ccccc1[C@H](CNC(=O)C[C@@H]1COc2ccccc2O1)OC(C)C	ZINC000450689243	GH	On-Demand	Anodyne	ADRA1B	15	45
COc1ccccc1[C@H](CNC(=O)C[C@@H]1COc2ccccc2O1)OC(C)C	ZINC000450689243	GH	On-Demand	Anodyne	ADRA2B	15	45
COc1ccccc1[C@@H](CNC(=O)C[C@@H]1COc2ccccc2O1)OC(C)C	ZINC000450689244	GH	On-Demand	Anodyne	ADRA1B	15	45
COc1ccccc1[C@@H](CNC(=O)C[C@@H]1COc2ccccc2O1)OC(C)C	ZINC000450689244	GH	On-Demand	Anodyne	ADRA2B	15	45
COc1ccccc1[C@H](CNC(=O)C[C@H]1COc2ccccc2O1)OC(C)C	ZINC000450689245	GH	On-Demand	Anodyne	ADRA1B	15	45
COc1ccccc1[C@H](CNC(=O)C[C@H]1COc2ccccc2O1)OC(C)C	ZINC000450689245	GH	On-Demand	Anodyne	ADRA2B	15	45
CCC[C@](C)(CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450689262	FG	On-Demand	Anodyne	DUSP3	0	40
CCC[C@@](C)(CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450689263	FG	On-Demand	Anodyne	DUSP3	0	40
COc1cccc(-n2cc(C(=O)NC3(CCO)CCCCC3)nn2)c1	ZINC000450689264	EE	On-Demand	Anodyne	DRD4	41	32
CC(=O)c1cn(CC(=O)NCC2(CCOCc3ccccc3)CC2)nn1	ZINC000450689269	FD	On-Demand	Anodyne	NPFFR1	43	38
COC1(CSc2nnc(-c3ccc(OC(F)F)cc3)o2)CCC1	ZINC000450689289	EH	On-Demand	Anodyne	GSK3A	22	40
CC[C@@H](NCc1ccccc1OC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000450689294	EI	On-Demand	Bother	CACNA1D	61	34
CC[C@H](NCc1ccccc1OC1CC1)c1cccc([N+](=O)[O-])c1	ZINC000450689295	EI	On-Demand	Bother	CACNA1D	61	34
CC(C)N1CCCC[C@H]1CN1CCN(c2ccc(F)cn2)CC1	ZINC000450689388	DF	On-Demand	Anodyne	SLC27A1	44	44
CC(C)N1CCCC[C@@H]1CN1CCN(c2ccc(F)cn2)CC1	ZINC000450689389	DF	On-Demand	Anodyne	SLC27A1	44	44
O=C(CCCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)C1CC1	ZINC000450689392	DG	On-Demand	Anodyne	ETHR	47	35
O=C(CCCC(=O)N1CC[C@H](c2c(F)cccc2F)C1)C1CC1	ZINC000450689393	DG	On-Demand	Anodyne	ETHR	47	35
C[C@H](CCC1CC1)NC(=O)c1ccnc(OC(F)F)c1	ZINC000450689394	CF	On-Demand	Anodyne	PDE4D	43	39
COc1ccc(CNC(=O)CCN2CC(=O)N(C)C2)c(OC)c1	ZINC000450689397	DC	On-Demand	Anodyne	HTR7	25	40
COc1ccc(CNC(=O)CCN2CC(=O)N(C)C2)c(OC)c1	ZINC000450689397	DC	On-Demand	Anodyne	MTNR1A	54	36
C[C@@H](CCC1CC1)NC(=O)c1ccnc(OC(F)F)c1	ZINC000450689400	CF	On-Demand	Anodyne	PDE4D	43	39
COC(=O)c1cc(N[C@@H](C)CC(C)(C)O)c2cc(Br)ccc2n1	ZINC000450689406	GH	On-Demand	Anodyne	GPR35	45	34
COC(=O)c1cc(N[C@H](C)CC(C)(C)O)c2cc(Br)ccc2n1	ZINC000450689409	GH	On-Demand	Anodyne	GPR35	45	34
NC(=O)c1ccc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450689433	DH	On-Demand	Anodyne	AKT1	22	41
NC(=O)c1ccc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450689434	DH	On-Demand	Anodyne	AKT1	22	41
C=CCCCCNC(=O)[C@H]1C[C@]1(C)c1ccccc1	ZINC000450689444	CG	On-Demand	Mild	DPEP1	77	38
FC1(F)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450689456	BG	On-Demand	Anodyne	SIGMAR1	21	44
CC(=O)N[C@H](C(=O)N1CC[C@H](c2c(F)cccc2F)C1)C(C)(C)C	ZINC000450689457	EF	On-Demand	Anodyne	CCR1	44	42
CC(=O)N[C@H](C(=O)N1CC[C@@H](c2c(F)cccc2F)C1)C(C)(C)C	ZINC000450689458	EF	On-Demand	Anodyne	CCR1	44	42
CSc1ccc2ncnc(N[C@@H](C)CC(C)(C)O)c2c1	ZINC000450689461	CG	On-Demand	Anodyne	CLK4	51	32
CSc1ccc2ncnc(N[C@@H](C)CC(C)(C)O)c2c1	ZINC000450689461	CG	On-Demand	Anodyne	CD38	40	41
CSc1ccc2ncnc(N[C@@H](C)CC(C)(C)O)c2c1	ZINC000450689461	CG	On-Demand	Anodyne	HTT	0	41
CSc1ccc2ncnc(N[C@H](C)CC(C)(C)O)c2c1	ZINC000450689462	CG	On-Demand	Anodyne	CLK4	51	32
CSc1ccc2ncnc(N[C@H](C)CC(C)(C)O)c2c1	ZINC000450689462	CG	On-Demand	Anodyne	CD38	40	41
CSc1ccc2ncnc(N[C@H](C)CC(C)(C)O)c2c1	ZINC000450689462	CG	On-Demand	Anodyne	HTT	0	41
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450689490	GH	On-Demand	Bother	BCL2	15	41
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450689490	GH	On-Demand	Bother	TAAR1	22	47
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450689491	GH	On-Demand	Bother	BCL2	15	41
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450689491	GH	On-Demand	Bother	TAAR1	22	47
COc1ccc(-c2nnc(SCc3cn(C)nc3C)n2C)cc1	ZINC000450689492	EF	On-Demand	Anodyne	AXIN2	0	42
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450689493	GH	On-Demand	Bother	BCL2	15	41
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450689493	GH	On-Demand	Bother	TAAR1	22	47
C[C@H]1C[C@]1(C#N)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450689494	DG	On-Demand	Mild	CCR3	43	42
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450689495	GH	On-Demand	Bother	BCL2	15	41
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450689495	GH	On-Demand	Bother	TAAR1	22	47
C[C@@H]1C[C@]1(C#N)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450689501	DG	On-Demand	Mild	CCR3	43	42
C[C@H]1C[C@@]1(C#N)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450689502	DG	On-Demand	Mild	CCR3	43	42
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450689503	DG	On-Demand	Mild	CCR3	43	42
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450689504	EG	On-Demand	Anodyne	AVPR2	32	40
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450689505	EG	On-Demand	Anodyne	AVPR2	32	40
C=CCCCCNC(=O)c1cccc(CC)n1	ZINC000450689518	BF	On-Demand	Mild	PDE5A	0	45
CC[C@H](O)CC(=O)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450689522	CG	On-Demand	Anodyne	CCR1	42	42
CC[C@H](O)CC(=O)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450689523	CG	On-Demand	Anodyne	CCR1	42	42
CC[C@@H](O)CC(=O)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450689525	CG	On-Demand	Anodyne	CCR1	42	42
CC[C@@H](O)CC(=O)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450689527	CG	On-Demand	Anodyne	CCR1	42	42
O=C(C1CC1)C1(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000450689534	EH	On-Demand	Anodyne	CCR3	26	40
CC(=O)CCCCCSc1nnc(-c2cccc(C)c2)n1C	ZINC000450689540	DI	On-Demand	Anodyne	DRD3	61	38
Cc1cc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)ncc1C(N)=O	ZINC000450689544	EE	On-Demand	Anodyne	HSD11B1	19	40
Cc1cc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)ncc1C(N)=O	ZINC000450689545	EE	On-Demand	Anodyne	HSD11B1	19	40
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(OC)cc3)n2C)nc1	ZINC000450689548	GG	On-Demand	Anodyne	WNT3A	20	41
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	PPIA	16	40
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	F10	32	40
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	KIT	15	42
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	CPT1A	43	31
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	KDR	17	42
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	GRM4	22	46
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	GRM5	21	40
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	CSF1R	27	41
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	LUCI_LUCLA	30	41
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	TAAR1	37	49
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	KCNK3	108	42
C[C@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689549	EH	On-Demand	Anodyne	KCNK9	78	42
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	PPIA	16	40
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	F10	32	40
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	KIT	15	42
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	CPT1A	43	31
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	KDR	17	42
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	GRM4	22	46
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	GRM5	21	40
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	CSF1R	27	41
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	LUCI_LUCLA	30	41
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	TAAR1	37	49
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	KCNK3	108	42
C[C@@H](CC(C)(C)O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450689550	EH	On-Demand	Anodyne	KCNK9	78	42
CCc1cnc(CNC(=O)[C@H](Cc2ccccc2)OC)o1	ZINC000450689555	CE	On-Demand	Anodyne	PDS	41	33
CCc1cnc(CNC(=O)[C@@H](Cc2ccccc2)OC)o1	ZINC000450689556	CE	On-Demand	Anodyne	PDS	41	33
CCc1cnc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)o1	ZINC000450689563	CE	On-Demand	Anodyne	PDE8B	43	32
CCc1cnc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)o1	ZINC000450689564	CE	On-Demand	Anodyne	PDE8B	43	32
O=C(CC1CC(F)(F)C1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450689571	EI	On-Demand	Anodyne	CCR3	30	45
COc1cccc2c(N3CCC(CF)CC3)nccc12	ZINC000450689574	CG	On-Demand	Anodyne	PDE3A	49	38
COc1cccc2c(N3CCC(CF)CC3)nccc12	ZINC000450689574	CG	On-Demand	Anodyne	PDE3B	73	40
Cc1nc2ccnn2cc1C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450689577	FG	On-Demand	Anodyne	HCN1	61	35
Cc1nc2ccnn2cc1C(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450689577	FG	On-Demand	Anodyne	HCN4	50	32
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450689603	FG	On-Demand	Anodyne	SIGMAR1	18	52
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450689603	FG	On-Demand	Anodyne	SLC18A3	34	42
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450689603	FG	On-Demand	Anodyne	MCHR1	16	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450689604	FG	On-Demand	Anodyne	SIGMAR1	18	52
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450689604	FG	On-Demand	Anodyne	SLC18A3	34	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450689604	FG	On-Demand	Anodyne	MCHR1	16	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450689605	FG	On-Demand	Anodyne	SIGMAR1	18	52
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450689605	FG	On-Demand	Anodyne	SLC18A3	34	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450689605	FG	On-Demand	Anodyne	MCHR1	16	41
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450689606	FG	On-Demand	Anodyne	SIGMAR1	18	52
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450689606	FG	On-Demand	Anodyne	SLC18A3	34	42
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450689606	FG	On-Demand	Anodyne	MCHR1	16	41
N#Cc1cnc2ccc(Cl)cc2c1N1CCC(CF)CC1	ZINC000450689613	DH	On-Demand	Mild	SRC	15	42
N#Cc1cnc2ccc(Cl)cc2c1N1CCC(CF)CC1	ZINC000450689613	DH	On-Demand	Mild	MAP3K8	47	39
COC(=O)c1csc(CN[C@H](C)c2ccccc2[N+](=O)[O-])n1	ZINC000450689614	DF	On-Demand	Bother	COLA	60	33
COC(=O)c1csc(CN[C@@H](C)c2ccccc2[N+](=O)[O-])n1	ZINC000450689615	DF	On-Demand	Bother	COLA	60	33
Cc1nnc2c3ccccc3c(N3CCC(CF)CC3)nn12	ZINC000450689634	CF	On-Demand	Anodyne	CREBBP	45	36
Cc1nnc2c3ccccc3c(N3CCC(CF)CC3)nn12	ZINC000450689634	CF	On-Demand	Anodyne	BRD9	57	36
CCC[C@@](C)(CO)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450689643	DE	On-Demand	Anodyne	IRAK4	20	41
CCC[C@](C)(CO)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450689644	DE	On-Demand	Anodyne	IRAK4	20	41
FCC1CCN(c2nc(N3CCC(CF)CC3)c3ccccc3n2)CC1	ZINC000450689656	FI	On-Demand	Anodyne	HTR3A	18	43
CCC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450689710	EG	On-Demand	Anodyne	CAPNS1	46	35
CCC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450689710	EG	On-Demand	Anodyne	CAPN1	64	35
CCC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450689710	EG	On-Demand	Anodyne	CAPN2	96	37
CCC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450689710	EG	On-Demand	Anodyne	NPR	62	38
CCC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450689711	EG	On-Demand	Anodyne	CAPNS1	46	35
CCC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450689711	EG	On-Demand	Anodyne	CAPN1	64	35
CCC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450689711	EG	On-Demand	Anodyne	CAPN2	96	37
CCC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450689711	EG	On-Demand	Anodyne	NPR	62	38
CO[C@@H]1COCC[C@H]1CNc1ncccc1[N+](=O)[O-]	ZINC000450689716	CD	On-Demand	Bother	PRKCQ	44	35
CO[C@H]1COCC[C@@H]1CNc1ncccc1[N+](=O)[O-]	ZINC000450689717	CD	On-Demand	Bother	PRKCQ	44	35
CO[C@@H]1COCC[C@@H]1CNc1ncccc1[N+](=O)[O-]	ZINC000450689718	CD	On-Demand	Bother	PRKCQ	44	35
CO[C@H]1COCC[C@H]1CNc1ncccc1[N+](=O)[O-]	ZINC000450689719	CD	On-Demand	Bother	PRKCQ	44	35
CC/C=C\CN=c1ccc(S(=O)(=O)NCC2CC2)c[nH]1	ZINC000450689737	CD	On-Demand	Anodyne	NPY1R	42	35
CC/C=C/CN=c1ccc(S(=O)(=O)NCC2CC2)c[nH]1	ZINC000450689738	CD	On-Demand	Anodyne	NPY1R	42	35
COc1ccc(CNC(=O)CCN2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c(OC)c1	ZINC000450689741	GE	On-Demand	Anodyne	MTNR1A	50	37
COc1ccc(CNC(=O)CCN2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c(OC)c1	ZINC000450689741	GE	On-Demand	Anodyne	MTNR1B	41	37
COc1ccc(CNC(=O)CCN2CC[C@@H](C(C)(C)C)[C@H](O)C2)c(OC)c1	ZINC000450689742	GE	On-Demand	Anodyne	MTNR1A	50	37
COc1ccc(CNC(=O)CCN2CC[C@@H](C(C)(C)C)[C@H](O)C2)c(OC)c1	ZINC000450689742	GE	On-Demand	Anodyne	MTNR1B	41	37
COc1ccc(CNC(=O)CCN2CC[C@H](C(C)(C)C)[C@@H](O)C2)c(OC)c1	ZINC000450689743	GE	On-Demand	Anodyne	MTNR1A	50	37
COc1ccc(CNC(=O)CCN2CC[C@H](C(C)(C)C)[C@@H](O)C2)c(OC)c1	ZINC000450689743	GE	On-Demand	Anodyne	MTNR1B	41	37
COc1ccc(CNC(=O)CCN2CC[C@H](C(C)(C)C)[C@H](O)C2)c(OC)c1	ZINC000450689744	GE	On-Demand	Anodyne	MTNR1A	50	37
COc1ccc(CNC(=O)CCN2CC[C@H](C(C)(C)C)[C@H](O)C2)c(OC)c1	ZINC000450689744	GE	On-Demand	Anodyne	MTNR1B	41	37
CC/C=C\CNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000450689747	DF	On-Demand	Anodyne	CA2	17	40
CC/C=C\CNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000450689747	DF	On-Demand	Anodyne	CA7	15	40
CC/C=C\CNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000450689747	DF	On-Demand	Anodyne	CA12	15	40
CC/C=C/CNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000450689748	DF	On-Demand	Anodyne	CA2	17	40
CC/C=C/CNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000450689748	DF	On-Demand	Anodyne	CA7	15	40
CC/C=C/CNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000450689748	DF	On-Demand	Anodyne	CA12	15	40
CCn1ccnc1CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450689788	GD	On-Demand	Bother	TAAR1	19	43
CCn1ccnc1CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450689789	GD	On-Demand	Bother	TAAR1	19	43
O[C@@H]1CCC[C@H]1[C@@H]1CCCCN1c1ncc(C(F)(F)F)s1	ZINC000450689802	DH	On-Demand	Anodyne	MLYCD	42	35
O[C@@H]1CCC[C@@H]1[C@H]1CCCCN1c1ncc(C(F)(F)F)s1	ZINC000450689803	DH	On-Demand	Anodyne	MLYCD	42	35
O[C@@H]1CCC[C@H]1[C@H]1CCCCN1c1ncc(C(F)(F)F)s1	ZINC000450689804	DH	On-Demand	Anodyne	MLYCD	42	35
O[C@@H]1CCC[C@@H]1[C@@H]1CCCCN1c1ncc(C(F)(F)F)s1	ZINC000450689805	DH	On-Demand	Anodyne	MLYCD	42	35
CS(=O)(=O)C[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450689811	EG	On-Demand	Anodyne	METAP1	45	41
CS(=O)(=O)C[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450689812	EG	On-Demand	Anodyne	METAP1	45	41
C[C@@H](O)CCN1CCN(c2ccc(F)cn2)CC1	ZINC000450689845	CD	On-Demand	Anodyne	HTR1A	17	50
C[C@@H](O)CCN1CCN(c2ccc(F)cn2)CC1	ZINC000450689845	CD	On-Demand	Anodyne	DRD4	32	51
C[C@@H](O)CCN1CCN(c2ccc(F)cn2)CC1	ZINC000450689845	CD	On-Demand	Anodyne	SORD	57	35
C[C@@H](O)CCN1CCN(c2ccc(F)cn2)CC1	ZINC000450689845	CD	On-Demand	Anodyne	SLC27A1	48	48
C[C@H](O)CCN1CCN(c2ccc(F)cn2)CC1	ZINC000450689847	CD	On-Demand	Anodyne	HTR1A	17	50
C[C@H](O)CCN1CCN(c2ccc(F)cn2)CC1	ZINC000450689847	CD	On-Demand	Anodyne	DRD4	32	51
C[C@H](O)CCN1CCN(c2ccc(F)cn2)CC1	ZINC000450689847	CD	On-Demand	Anodyne	SORD	57	35
C[C@H](O)CCN1CCN(c2ccc(F)cn2)CC1	ZINC000450689847	CD	On-Demand	Anodyne	SLC27A1	48	48
CNC(=O)c1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450689869	EE	On-Demand	Bother	TAAR1	15	42
CNC(=O)c1ccc(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450689871	EE	On-Demand	Bother	TAAR1	15	42
CNC(=O)c1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450689873	EE	On-Demand	Bother	TAAR1	15	42
CNC(=O)c1ccc(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450689875	EE	On-Demand	Bother	TAAR1	15	42
CCC[C@H](O)CN[C@H](CC(C)C)c1ccccc1OC	ZINC000450689879	CH	On-Demand	Anodyne	ADRB2	17	49
C[C@H](CCC1CC1)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450689887	FG	On-Demand	Mild	AR	17	43
C[C@H](CCC1CC1)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450689888	FG	On-Demand	Mild	AR	17	43
C[C@@H](CCC1CC1)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450689889	FG	On-Demand	Mild	AR	17	43
C[C@@H](CCC1CC1)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450689890	FG	On-Demand	Mild	AR	17	43
COC(=O)c1cccc(CN[C@@H](C)c2cccc(N3CCCC3)c2)c1Cl	ZINC000450689918	FJ	On-Demand	Anodyne	KCNQ2	53	37
COc1ccc(CNC(=O)CCN2CCN(C(C)=O)CC2(C)C)c(OC)c1	ZINC000450689919	GD	On-Demand	Anodyne	HTR7	20	40
COc1ccc(CNC(=O)CCN2CCN(C(C)=O)CC2(C)C)c(OC)c1	ZINC000450689919	GD	On-Demand	Anodyne	MTNR1A	55	38
COc1ccc(CNC(=O)CCN2CCN(C(C)=O)CC2(C)C)c(OC)c1	ZINC000450689919	GD	On-Demand	Anodyne	MTNR1B	44	38
COC(=O)c1cccc(CN[C@H](C)c2cccc(N3CCCC3)c2)c1Cl	ZINC000450689920	FJ	On-Demand	Anodyne	KCNQ2	53	37
CCS(=O)(=O)c1ccc(CN2CCC(C)(OC)CC2)cc1	ZINC000450689930	DE	On-Demand	Anodyne	ADAM17	25	46
CCNc1ccc(Cl)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450689933	EH	On-Demand	Anodyne	PPARA	16	42
CCNc1ccc(Cl)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450689933	EH	On-Demand	Anodyne	MME	59	37
CCNc1ccc(Cl)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450689933	EH	On-Demand	Anodyne	AMP1_PLAFQ	53	39
CCNc1ccc(Cl)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450689933	EH	On-Demand	Anodyne	ACPS	0	52
CCNc1ccc(Cl)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450689933	EH	On-Demand	Anodyne	PDS	40	35
CCNc1ccc(Cl)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450689934	EH	On-Demand	Anodyne	PPARA	16	42
CCNc1ccc(Cl)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450689934	EH	On-Demand	Anodyne	MME	59	37
CCNc1ccc(Cl)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450689934	EH	On-Demand	Anodyne	AMP1_PLAFQ	53	39
CCNc1ccc(Cl)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450689934	EH	On-Demand	Anodyne	ACPS	0	52
CCNc1ccc(Cl)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450689934	EH	On-Demand	Anodyne	PDS	40	35
O=C1CC[C@@H](CN2CCN(c3ccc(F)cn3)CC2)CCN1	ZINC000450689941	DD	On-Demand	Anodyne	SLC27A1	26	41
O=C1CC[C@H](CN2CCN(c3ccc(F)cn3)CC2)CCN1	ZINC000450689943	DD	On-Demand	Anodyne	SLC27A1	26	41
COC[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450689955	ED	On-Demand	Anodyne	POLG_WNV	40	31
COC[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450689957	ED	On-Demand	Anodyne	POLG_WNV	40	31
Fc1ccc(N2CCN(C[C@H]3CCCCC3(F)F)CC2)nc1	ZINC000450689964	DG	On-Demand	Anodyne	SLC27A1	61	44
Fc1ccc(N2CCN(C[C@@H]3CCCCC3(F)F)CC2)nc1	ZINC000450689965	DG	On-Demand	Anodyne	SLC27A1	61	44
C[C@H](CC(C)(C)O)Nc1ncnc2ccc(I)cc12	ZINC000450689975	FG	On-Demand	Anodyne	CLK4	53	33
C[C@H](CC(C)(C)O)Nc1ncnc2ccc(I)cc12	ZINC000450689975	FG	On-Demand	Anodyne	CD38	88	44
C[C@H](CC(C)(C)O)Nc1ncnc2ccc(I)cc12	ZINC000450689975	FG	On-Demand	Anodyne	HTT	0	42
C[C@@H](CC(C)(C)O)Nc1ncnc2ccc(I)cc12	ZINC000450689976	FG	On-Demand	Anodyne	CLK4	53	33
C[C@@H](CC(C)(C)O)Nc1ncnc2ccc(I)cc12	ZINC000450689976	FG	On-Demand	Anodyne	CD38	88	44
C[C@@H](CC(C)(C)O)Nc1ncnc2ccc(I)cc12	ZINC000450689976	FG	On-Demand	Anodyne	HTT	0	42
FCC1CCN(c2nc3ccccc3nc2N2CCCC2)CC1	ZINC000450689979	DG	On-Demand	Anodyne	PDE1B	0	40
COC[C@@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450689984	EF	On-Demand	Anodyne	PYGL	24	40
COC[C@@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450689984	EF	On-Demand	Anodyne	ALPL	27	40
N#Cc1cccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1Br	ZINC000450689985	GH	On-Demand	Mild	AVPR1A	21	48
COC[C@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450689986	EF	On-Demand	Anodyne	PYGL	24	40
COC[C@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450689986	EF	On-Demand	Anodyne	ALPL	27	40
N#Cc1cccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c1Br	ZINC000450689987	GH	On-Demand	Mild	AVPR1A	21	48
CCC[C@@](C)(CO)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450689988	ED	On-Demand	Anodyne	COLA	48	35
CCC[C@@](C)(CO)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450689988	ED	On-Demand	Anodyne	CPT1A	45	32
CCC[C@](C)(CO)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450689989	ED	On-Demand	Anodyne	COLA	48	35
CCC[C@](C)(CO)NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1	ZINC000450689989	ED	On-Demand	Anodyne	CPT1A	45	32
CC(C)[C@H](NCc1ccccc1OC1CC1)c1nnc2ccccn12	ZINC000450689990	EH	On-Demand	Anodyne	SCD1	25	40
CC(C)[C@@H](NCc1ccccc1OC1CC1)c1nnc2ccccn12	ZINC000450689991	EH	On-Demand	Anodyne	SCD1	25	40
O=c1c(Cl)c(N2CCC(CF)CC2)cnn1Cc1ccccc1	ZINC000450690008	EG	On-Demand	Anodyne	MRGPRX1	29	41
O=c1c(Cl)c(N2CCC(CF)CC2)cnn1Cc1ccccc1	ZINC000450690008	EG	On-Demand	Anodyne	NPBWR1	26	40
CCc1c(C(=O)N2CC[C@]3(C2)OCc2ccccc23)oc2ccccc12	ZINC000450690009	EI	On-Demand	Anodyne	AVPR1A	20	48
CCc1c(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)oc2ccccc12	ZINC000450690010	EI	On-Demand	Anodyne	AVPR1A	20	48
CN1CCN(c2nc3ccccc3nc2N2CCC(CF)CC2)CC1	ZINC000450690017	EF	On-Demand	Anodyne	HRH1	0	47
CN1CCN(c2nc3ccccc3nc2N2CCC(CF)CC2)CC1	ZINC000450690017	EF	On-Demand	Anodyne	HTR3A	28	56
C[C@H](c1ccc(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)cc1)C(F)(F)F	ZINC000450690018	GH	On-Demand	Anodyne	CTSG	17	51
C[C@@H](c1ccc(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)cc1)C(F)(F)F	ZINC000450690019	GH	On-Demand	Anodyne	CTSG	17	51
FCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450690022	DH	On-Demand	Anodyne	PDE3A	47	36
FCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450690022	DH	On-Demand	Anodyne	PDE3B	70	37
FCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450690022	DH	On-Demand	Anodyne	SIRT3	60	35
FCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450690022	DH	On-Demand	Anodyne	SIRT2	54	33
FCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450690022	DH	On-Demand	Anodyne	SIRT1	53	32
FCC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450690022	DH	On-Demand	Anodyne	HTT	0	42
O=C1C(=O)N(C[C@H]2CCCC2(F)F)C(=O)N1Cc1ccccc1	ZINC000450690026	DE	On-Demand	Anodyne	CTSG	15	45
O=C1C(=O)N(C[C@@H]2CCCC2(F)F)C(=O)N1Cc1ccccc1	ZINC000450690027	DE	On-Demand	Anodyne	CTSG	15	45
CNS(=O)(=O)c1ccc(N2CCC(CF)CC2)c(F)c1	ZINC000450690047	DD	On-Demand	Anodyne	SLC6A9	0	46
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450690048	GJ	On-Demand	Anodyne	PRCP	49	33
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450690049	GJ	On-Demand	Anodyne	PRCP	49	33
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450690050	GJ	On-Demand	Anodyne	PRCP	49	33
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450690051	GJ	On-Demand	Anodyne	PRCP	49	33
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	F10	21	43
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	MPL	29	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	PRNP	37	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	HDAC1	26	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	GRM5	20	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	MCHR1	26	42
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	CACNA1I	43	35
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	TAAR1	41	47
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	HT1	0	48
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	DGAT1	46	49
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	HPGDS	33	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	KCNK3	55	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCC(CF)CC2)nc1	ZINC000450690052	EI	On-Demand	Anodyne	LMGT2	0	48
CCC[C@@](C)(CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450690055	EG	On-Demand	Anodyne	MTNR1B	28	42
CCC[C@](C)(CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450690056	EG	On-Demand	Anodyne	MTNR1B	28	42
COc1cc(CC(=O)NC[C@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690063	GI	On-Demand	Anodyne	TRPV1	29	41
COc1cc(CC(=O)NC[C@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690063	GI	On-Demand	Anodyne	NCE103	26	43
COc1cc(CC(=O)NC[C@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690063	GI	On-Demand	Anodyne	P96878_MYCTU	18	43
COc1cc(CC(=O)NC[C@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690063	GI	On-Demand	Anodyne	CAN2	0	43
COc1cc(CC(=O)NC[C@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690063	GI	On-Demand	Anodyne	KCNK3	42	39
COc1cc(CC(=O)NC[C@@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690064	GI	On-Demand	Anodyne	TRPV1	29	41
COc1cc(CC(=O)NC[C@@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690064	GI	On-Demand	Anodyne	NCE103	26	43
COc1cc(CC(=O)NC[C@@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690064	GI	On-Demand	Anodyne	P96878_MYCTU	18	43
COc1cc(CC(=O)NC[C@@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690064	GI	On-Demand	Anodyne	CAN2	0	43
COc1cc(CC(=O)NC[C@@H](OC(C)C)c2ccccc2OC)ccc1Cl	ZINC000450690064	GI	On-Demand	Anodyne	KCNK3	42	39
COc1ccccc1[C@H](CNC(=O)c1scnc1C(C)C)OC(C)C	ZINC000450690065	FI	On-Demand	Anodyne	MAP1	15	41
COc1ccccc1[C@H](CNC(=O)c1scnc1C(C)C)OC(C)C	ZINC000450690065	FI	On-Demand	Anodyne	KCNK3	25	40
COc1ccccc1[C@H](CNC(=O)c1scnc1C(C)C)OC(C)C	ZINC000450690065	FI	On-Demand	Anodyne	KCNK9	24	40
COc1ccccc1[C@@H](CNC(=O)c1scnc1C(C)C)OC(C)C	ZINC000450690066	FI	On-Demand	Anodyne	MAP1	15	41
COc1ccccc1[C@@H](CNC(=O)c1scnc1C(C)C)OC(C)C	ZINC000450690066	FI	On-Demand	Anodyne	KCNK3	25	40
COc1ccccc1[C@@H](CNC(=O)c1scnc1C(C)C)OC(C)C	ZINC000450690066	FI	On-Demand	Anodyne	KCNK9	24	40
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690087	GD	On-Demand	Bother	BCL2L1	36	44
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690087	GD	On-Demand	Bother	BCL2	26	44
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690087	GD	On-Demand	Bother	LRRK2	27	45
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690088	GD	On-Demand	Bother	BCL2L1	36	44
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690088	GD	On-Demand	Bother	BCL2	26	44
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690088	GD	On-Demand	Bother	LRRK2	27	45
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690089	GD	On-Demand	Bother	BCL2L1	36	44
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690089	GD	On-Demand	Bother	BCL2	26	44
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690089	GD	On-Demand	Bother	LRRK2	27	45
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690090	GD	On-Demand	Bother	BCL2L1	36	44
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690090	GD	On-Demand	Bother	BCL2	26	44
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690090	GD	On-Demand	Bother	LRRK2	27	45
COC(=O)CC1(CNC(=O)c2ccc(C3CC3)nc2C)CCCCC1	ZINC000450690105	EH	On-Demand	Anodyne	HCN1	54	35
COC(=O)CC1(CNC(=O)c2ccc(C3CC3)nc2C)CCCCC1	ZINC000450690105	EH	On-Demand	Anodyne	HCN4	52	35
CO[C@H]1COCC[C@@H]1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450690106	FD	On-Demand	Anodyne	LRRK2	34	45
CO[C@@H]1COCC[C@@H]1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450690107	FD	On-Demand	Anodyne	LRRK2	34	45
CO[C@@H]1COCC[C@H]1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450690108	FD	On-Demand	Anodyne	LRRK2	34	45
CO[C@H]1COCC[C@H]1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450690109	FD	On-Demand	Anodyne	LRRK2	34	45
C=CCCCCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450690141	DF	On-Demand	Mild	TBXAS1	16	40
C=CCCCCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450690141	DF	On-Demand	Mild	PTAFR	17	41
CO[C@@H]1COCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450690151	EG	On-Demand	Bother	AADAC	0	43
CO[C@H]1COCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450690152	EG	On-Demand	Bother	AADAC	0	43
CO[C@@H]1COCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450690153	EG	On-Demand	Bother	AADAC	0	43
CO[C@H]1COCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450690154	EG	On-Demand	Bother	AADAC	0	43
CO[C@H]1COCC[C@@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450690156	ED	On-Demand	Anodyne	DHOD	0	46
CO[C@@H]1COCC[C@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450690157	ED	On-Demand	Anodyne	DHOD	0	46
CO[C@H]1COCC[C@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450690158	ED	On-Demand	Anodyne	DHOD	0	46
CO[C@@H]1COCC[C@@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450690159	ED	On-Demand	Anodyne	DHOD	0	46
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCOC[C@@H]1OC	ZINC000450690167	FC	On-Demand	Anodyne	CA2	22	45
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCOC[C@H]1OC	ZINC000450690168	FC	On-Demand	Anodyne	CA2	22	45
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCOC[C@H]1OC	ZINC000450690169	FC	On-Demand	Anodyne	CA2	22	45
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCOC[C@@H]1OC	ZINC000450690170	FC	On-Demand	Anodyne	CA2	22	45
C=CCC1(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)CCCCC1	ZINC000450690174	EI	On-Demand	Mild	AVPR1A	0	46
C=CCC1(C(=O)N2CC[C@]3(C2)OCc2ccccc23)CCCCC1	ZINC000450690175	EI	On-Demand	Mild	AVPR1A	0	46
COc1ccccc1[C@H](CNC(=O)CCc1nc2cnccc2[nH]1)OC(C)C	ZINC000450690177	GG	On-Demand	Anodyne	ENPP1	26	41
COc1ccccc1[C@@H](CNC(=O)CCc1nc2cnccc2[nH]1)OC(C)C	ZINC000450690178	GG	On-Demand	Anodyne	ENPP1	26	41
COc1ccccc1[C@H](CNC(=O)c1ccsc1Br)OC(C)C	ZINC000450690183	GI	On-Demand	Anodyne	KCNA3	16	43
COc1ccccc1[C@@H](CNC(=O)c1ccsc1Br)OC(C)C	ZINC000450690184	GI	On-Demand	Anodyne	KCNA3	16	43
Cn1ncc(Br)c1C(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450690192	GI	On-Demand	Anodyne	SLC12A5	45	34
Cn1ncc(Br)c1C(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450690192	GI	On-Demand	Anodyne	HCN1	62	37
Cn1ncc(Br)c1C(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450690192	GI	On-Demand	Anodyne	HCN4	53	34
O=C(Cc1cc2ccccc2s1)NC1(CCO)CCCCC1	ZINC000450690193	DH	On-Demand	Anodyne	AROQ	22	41
CCCc1nc(C)c(CSc2nnc(-c3ccc(C)cc3)o2)o1	ZINC000450690205	EJ	On-Demand	Anodyne	GSK3B	17	42
CCCc1nc(C)c(CSc2nnc(-c3ccc(C)cc3)o2)o1	ZINC000450690205	EJ	On-Demand	Anodyne	GSK3A	47	40
CCCc1nc(C)c(CSc2nnc(-c3ccc(C)cc3)o2)o1	ZINC000450690205	EJ	On-Demand	Anodyne	TERT	23	45
C[C@H]1Cc2cccc(C(=O)N3CC[C@]4(C3)OCc3ccccc34)c2O1	ZINC000450690206	EG	On-Demand	Anodyne	AVPR1A	0	48
C[C@H]1Cc2cccc(C(=O)N3CC[C@@]4(C3)OCc3ccccc34)c2O1	ZINC000450690207	EG	On-Demand	Anodyne	AVPR1A	0	48
C[C@@H]1Cc2cccc(C(=O)N3CC[C@]4(C3)OCc3ccccc34)c2O1	ZINC000450690208	EG	On-Demand	Anodyne	AVPR1A	0	48
C[C@@H]1Cc2cccc(C(=O)N3CC[C@@]4(C3)OCc3ccccc34)c2O1	ZINC000450690209	EG	On-Demand	Anodyne	AVPR1A	0	48
COc1cc(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450690212	FH	On-Demand	Anodyne	TACR1	22	43
COc1cc(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450690212	FH	On-Demand	Anodyne	TACR2	19	43
COc1cc(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450690212	FH	On-Demand	Anodyne	SIGMAR1	17	48
COc1cc(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450690213	FH	On-Demand	Anodyne	TACR1	22	43
COc1cc(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450690213	FH	On-Demand	Anodyne	TACR2	19	43
COc1cc(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450690213	FH	On-Demand	Anodyne	SIGMAR1	17	48
COc1ccccc1[C@@H](CNC(=O)[C@@H]1CCCCC1(F)F)OC(C)C	ZINC000450690228	FI	On-Demand	Anodyne	HCN1	41	34
COc1ccccc1[C@@H](CNC(=O)[C@@H]1CCCCC1(F)F)OC(C)C	ZINC000450690228	FI	On-Demand	Anodyne	HCN4	41	34
COc1ccccc1[C@@H](CNC(=O)[C@H]1CCCCC1(F)F)OC(C)C	ZINC000450690229	FI	On-Demand	Anodyne	HCN1	41	34
COc1ccccc1[C@@H](CNC(=O)[C@H]1CCCCC1(F)F)OC(C)C	ZINC000450690229	FI	On-Demand	Anodyne	HCN4	41	34
COc1ccccc1[C@H](CNC(=O)[C@@H]1CCCCC1(F)F)OC(C)C	ZINC000450690230	FI	On-Demand	Anodyne	HCN1	41	34
COc1ccccc1[C@H](CNC(=O)[C@@H]1CCCCC1(F)F)OC(C)C	ZINC000450690230	FI	On-Demand	Anodyne	HCN4	41	34
COc1ccccc1[C@H](CNC(=O)[C@H]1CCCCC1(F)F)OC(C)C	ZINC000450690231	FI	On-Demand	Anodyne	HCN1	41	34
COc1ccccc1[C@H](CNC(=O)[C@H]1CCCCC1(F)F)OC(C)C	ZINC000450690231	FI	On-Demand	Anodyne	HCN4	41	34
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)(C)C	ZINC000450690236	EG	On-Demand	Anodyne	MTNR1A	67	41
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)(C)C	ZINC000450690236	EG	On-Demand	Anodyne	MTNR1B	41	34
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)(C)C	ZINC000450690237	EG	On-Demand	Anodyne	MTNR1A	67	41
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)C(C)(C)C	ZINC000450690237	EG	On-Demand	Anodyne	MTNR1B	41	34
COc1ccccc1[C@@H](CNC(=O)c1cc(C#N)[nH]c1C)OC(C)C	ZINC000450690238	EG	On-Demand	Mild	KCNK3	44	40
COc1ccccc1[C@@H](CNC(=O)c1cc(C#N)[nH]c1C)OC(C)C	ZINC000450690238	EG	On-Demand	Mild	KCNK9	38	40
COc1ccccc1[C@H](CNC(=O)c1cc(C#N)[nH]c1C)OC(C)C	ZINC000450690239	EG	On-Demand	Mild	KCNK3	44	40
COc1ccccc1[C@H](CNC(=O)c1cc(C#N)[nH]c1C)OC(C)C	ZINC000450690239	EG	On-Demand	Mild	KCNK9	38	40
CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@@H](C)CC(C)(C)O)nc1	ZINC000450690291	GG	On-Demand	Anodyne	NR1I2	20	45
CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@@H](C)CC(C)(C)O)nc1	ZINC000450690291	GG	On-Demand	Anodyne	RORC	18	45
CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@H](C)CC(C)(C)O)nc1	ZINC000450690295	GG	On-Demand	Anodyne	NR1I2	20	45
CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@H](C)CC(C)(C)O)nc1	ZINC000450690295	GG	On-Demand	Anodyne	RORC	18	45
CCN(CCO)CCNC(=O)c1cc2c(Br)cccc2cn1	ZINC000450690303	FE	On-Demand	Anodyne	POLR1A	30	40
Cn1c(N2CCCC[C@@H]2[C@H]2CCC[C@H]2O)nc2ccccc21	ZINC000450690304	CG	On-Demand	Anodyne	HRH1	16	48
Cn1c(N2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)nc2ccccc21	ZINC000450690305	CG	On-Demand	Anodyne	HRH1	16	48
Cn1c(N2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)nc2ccccc21	ZINC000450690306	CG	On-Demand	Anodyne	HRH1	16	48
Cn1c(N2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)nc2ccccc21	ZINC000450690307	CG	On-Demand	Anodyne	HRH1	16	48
Cc1nn(C)cc1CSc1nnc(-c2ccc(OC(F)F)cc2)o1	ZINC000450690312	FH	On-Demand	Anodyne	GSK3B	15	41
Cc1nn(C)cc1CSc1nnc(-c2ccc(OC(F)F)cc2)o1	ZINC000450690312	FH	On-Demand	Anodyne	GSK3A	35	41
O=C(CNC(=O)C1(Cc2cccc(Cl)c2)CC1)NCC1CC1	ZINC000450690317	DE	On-Demand	Anodyne	NPFFR1	43	35
CNS(=O)(=O)NCC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450690322	FC	On-Demand	Anodyne	MME	40	38
CNS(=O)(=O)NCC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450690322	FC	On-Demand	Anodyne	ANPEP	45	32
CNS(=O)(=O)NCC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450690322	FC	On-Demand	Anodyne	MMP3	52	38
CNS(=O)(=O)NCC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450690323	FC	On-Demand	Anodyne	MME	40	38
CNS(=O)(=O)NCC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450690323	FC	On-Demand	Anodyne	ANPEP	45	32
CNS(=O)(=O)NCC(=O)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450690323	FC	On-Demand	Anodyne	MMP3	52	38
CC[C@@H](NCc1nc(C(=O)OC)co1)c1cccc([N+](=O)[O-])c1	ZINC000450690356	DF	On-Demand	Bother	CACNA1C	59	38
CC[C@@H](NCc1nc(C(=O)OC)co1)c1cccc([N+](=O)[O-])c1	ZINC000450690356	DF	On-Demand	Bother	CACNA1D	89	38
CC[C@H](NCc1nc(C(=O)OC)co1)c1cccc([N+](=O)[O-])c1	ZINC000450690357	DF	On-Demand	Bother	CACNA1C	59	38
CC[C@H](NCc1nc(C(=O)OC)co1)c1cccc([N+](=O)[O-])c1	ZINC000450690357	DF	On-Demand	Bother	CACNA1D	89	38
CN(CCN(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)CC(F)F	ZINC000450690378	FG	On-Demand	Anodyne	GPR88	0	47
CCc1cnc(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)o1	ZINC000450690381	EE	On-Demand	Anodyne	PDEC	0	41
CCc1cnc(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)o1	ZINC000450690383	EE	On-Demand	Anodyne	PDEC	0	41
O=C(c1cc2c([nH]1)CCCC2)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450690390	EH	On-Demand	Anodyne	HRH4	24	53
O=C(c1cc2c([nH]1)CCCC2)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450690391	EH	On-Demand	Anodyne	HRH4	24	53
CC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690404	CD	On-Demand	Anodyne	FOLH1	41	38
CC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690404	CD	On-Demand	Anodyne	CTSB	27	44
CC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690404	CD	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690404	CD	On-Demand	Anodyne	CAPNS1	48	37
CC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690404	CD	On-Demand	Anodyne	MMP8	30	43
CC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690404	CD	On-Demand	Anodyne	CAPN1	63	36
CC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690404	CD	On-Demand	Anodyne	CAPN2	89	38
CC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690404	CD	On-Demand	Anodyne	NPR	38	56
CC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690405	CD	On-Demand	Anodyne	FOLH1	41	38
CC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690405	CD	On-Demand	Anodyne	CTSB	27	44
CC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690405	CD	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690405	CD	On-Demand	Anodyne	CAPNS1	48	37
CC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690405	CD	On-Demand	Anodyne	MMP8	30	43
CC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690405	CD	On-Demand	Anodyne	CAPN1	63	36
CC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690405	CD	On-Demand	Anodyne	CAPN2	89	38
CC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690405	CD	On-Demand	Anodyne	NPR	38	56
CC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690406	CD	On-Demand	Anodyne	FOLH1	41	38
CC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690406	CD	On-Demand	Anodyne	CTSB	27	44
CC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690406	CD	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690406	CD	On-Demand	Anodyne	CAPNS1	48	37
CC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690406	CD	On-Demand	Anodyne	MMP8	30	43
CC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690406	CD	On-Demand	Anodyne	CAPN1	63	36
CC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690406	CD	On-Demand	Anodyne	CAPN2	89	38
CC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450690406	CD	On-Demand	Anodyne	NPR	38	56
CC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690408	CD	On-Demand	Anodyne	FOLH1	41	38
CC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690408	CD	On-Demand	Anodyne	CTSB	27	44
CC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690408	CD	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690408	CD	On-Demand	Anodyne	CAPNS1	48	37
CC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690408	CD	On-Demand	Anodyne	MMP8	30	43
CC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690408	CD	On-Demand	Anodyne	CAPN1	63	36
CC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690408	CD	On-Demand	Anodyne	CAPN2	89	38
CC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450690408	CD	On-Demand	Anodyne	NPR	38	56
COc1cc(CC(=O)N[C@H](C)CCC2CC2)ccc1Cl	ZINC000450690410	CH	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@@H](C)CCC2CC2)ccc1Cl	ZINC000450690411	CH	On-Demand	Anodyne	CAN2	0	40
COc1cc(CN2CCc3ncc([N+](=O)[O-])cc3C2)ccc1Cl	ZINC000450690416	EG	On-Demand	Bother	SSTR5	41	40
COc1cc(CN2CCc3ncc([N+](=O)[O-])cc3C2)ccc1Cl	ZINC000450690416	EG	On-Demand	Bother	ABCB1	24	46
CCCc1cc(C(=O)NCC2(CC(=O)OC)CCCCC2)no1	ZINC000450690417	DF	On-Demand	Anodyne	HCN1	49	30
CCCc1cc(C(=O)NCC2(CC(=O)OC)CCCCC2)no1	ZINC000450690417	DF	On-Demand	Anodyne	HCN4	48	30
COC(=O)C[C@H](NC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690418	GF	On-Demand	Anodyne	TRHR	42	36
COC(=O)C[C@H](NC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690418	GF	On-Demand	Anodyne	LGMN	43	35
COC(=O)C[C@H](NC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690418	GF	On-Demand	Anodyne	UTS2	40	37
COC(=O)C[C@H](NC(=O)[C@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690420	GF	On-Demand	Anodyne	TRHR	42	36
COC(=O)C[C@H](NC(=O)[C@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690420	GF	On-Demand	Anodyne	LGMN	43	35
COC(=O)C[C@H](NC(=O)[C@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690420	GF	On-Demand	Anodyne	UTS2	40	37
COC(=O)C[C@@H](NC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690422	GF	On-Demand	Anodyne	TRHR	42	36
COC(=O)C[C@@H](NC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690422	GF	On-Demand	Anodyne	LGMN	43	35
COC(=O)C[C@@H](NC(=O)[C@@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690422	GF	On-Demand	Anodyne	UTS2	40	37
COC(=O)C[C@@H](NC(=O)[C@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690424	GF	On-Demand	Anodyne	TRHR	42	36
COC(=O)C[C@@H](NC(=O)[C@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690424	GF	On-Demand	Anodyne	LGMN	43	35
COC(=O)C[C@@H](NC(=O)[C@H]1CCCN(C)C1=O)c1ccc(-c2ccccc2)cc1	ZINC000450690424	GF	On-Demand	Anodyne	UTS2	40	37
CCn1c(S[C@@H](C)C(=O)C2CCCCC2)nnc1-c1ccccc1OC	ZINC000450690431	FJ	On-Demand	Anodyne	PDE4A	20	41
CCn1c(S[C@H](C)C(=O)C2CCCCC2)nnc1-c1ccccc1OC	ZINC000450690439	FJ	On-Demand	Anodyne	PDE4A	20	41
COc1ccc(CNC(=O)CCN2CCC[C@H]2C2CCOCC2)c(OC)c1	ZINC000450690451	GF	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C2CCOCC2)c(OC)c1	ZINC000450690452	GF	On-Demand	Anodyne	MTNR1A	48	36
CCc1cnc(CNC(=O)Cc2cc(C)ccc2F)o1	ZINC000450690458	CF	On-Demand	Anodyne	P2RX7	48	45
C[C@@H](CC(C)(C)O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450690473	GH	On-Demand	Anodyne	PDS	15	67
C[C@H](CC(C)(C)O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450690474	GH	On-Demand	Anodyne	PDS	15	67
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	F2	56	35
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	PLG	40	37
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	FKBP1A	62	50
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	OPRM1	25	40
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	OPRD1	0	40
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	ELANE	53	38
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	TRHR	46	38
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CMA1	37	41
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CTRA_BOVIN	51	32
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	PRSS3	0	43
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CASP3	47	33
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	XPNPEP1	0	40
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	MMP13	62	48
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	TRY1_BOVIN	80	35
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	NTSR1	43	32
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CTSG	41	32
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CCR4	0	43
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	ADAM17	52	42
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	ITGA4	67	51
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CAPNS1	34	51
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	MMP2	37	41
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	MMP3	64	47
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	MMP8	41	45
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CELA2A	42	34
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	LGMN	57	37
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	TGM1	24	40
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	XPNPEP2	0	40
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CAPN1	42	59
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	MMP9	36	45
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	CASP7	56	34
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	MMP7	81	48
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	MMP1	67	52
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	XIAP	76	42
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	SFRP1	57	32
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	WNT3	55	33
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	BRCA1	66	36
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	TMPRSS11D	52	35
COC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690493	FC	On-Demand	Anodyne	TMPRSS6	45	31
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	F2	56	35
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	PLG	40	37
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	FKBP1A	62	50
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	OPRM1	25	40
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	OPRD1	0	40
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	ELANE	53	38
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	TRHR	46	38
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CMA1	37	41
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CTRA_BOVIN	51	32
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	PRSS3	0	43
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CASP3	47	33
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	XPNPEP1	0	40
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	MMP13	62	48
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	TRY1_BOVIN	80	35
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	NTSR1	43	32
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CTSG	41	32
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CCR4	0	43
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	ADAM17	52	42
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	ITGA4	67	51
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CAPNS1	34	51
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	MMP2	37	41
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	MMP3	64	47
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	MMP8	41	45
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CELA2A	42	34
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	LGMN	57	37
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	TGM1	24	40
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	XPNPEP2	0	40
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CAPN1	42	59
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	MMP9	36	45
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	CASP7	56	34
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	MMP7	81	48
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	MMP1	67	52
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	XIAP	76	42
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	SFRP1	57	32
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	WNT3	55	33
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	BRCA1	66	36
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	TMPRSS11D	52	35
COC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450690498	FC	On-Demand	Anodyne	TMPRSS6	45	31
C[C@H](CC(C)(C)O)Nc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450690500	DG	On-Demand	Mild	MAP3K8	82	38
C[C@@H](CC(C)(C)O)Nc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450690501	DG	On-Demand	Mild	MAP3K8	82	38
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450690503	DG	On-Demand	Mild	FASN	42	36
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450690504	DG	On-Demand	Mild	FASN	42	36
COC[C@H](NC(=O)C(C)(C)c1cccc2ccccc12)C(=O)OC	ZINC000450690528	EE	On-Demand	Anodyne	CA15	16	40
COC[C@@H](NC(=O)C(C)(C)c1cccc2ccccc12)C(=O)OC	ZINC000450690530	EE	On-Demand	Anodyne	CA15	16	40
COC(=O)CC1(CNC(=O)c2cc3cccnc3s2)CCCCC1	ZINC000450690557	EH	On-Demand	Anodyne	HCN1	50	32
COC(=O)CC1(CNC(=O)c2cc3cccnc3s2)CCCCC1	ZINC000450690557	EH	On-Demand	Anodyne	HCN4	48	32
CO[C@@H]1COCC[C@@H]1CNc1cc(C)nc2ncnn12	ZINC000450690566	CC	On-Demand	Anodyne	DHOD	0	47
CO[C@H]1COCC[C@@H]1CNc1cc(C)nc2ncnn12	ZINC000450690567	CC	On-Demand	Anodyne	DHOD	0	47
CO[C@H]1COCC[C@H]1CNc1cc(C)nc2ncnn12	ZINC000450690568	CC	On-Demand	Anodyne	DHOD	0	47
CO[C@@H]1COCC[C@H]1CNc1cc(C)nc2ncnn12	ZINC000450690569	CC	On-Demand	Anodyne	DHOD	0	47
C[C@@H](O)CCCN[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450690572	EI	On-Demand	Anodyne	PHES	0	42
C[C@H](O)CCCN[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450690573	EI	On-Demand	Anodyne	PHES	0	42
N#Cc1ccc(OCC(=O)NC2(CO)CCOCC2)cc1Br	ZINC000450690575	FD	On-Demand	Mild	TRPV4	41	31
CC[C@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC(C)(C)C	ZINC000450690582	FG	On-Demand	Anodyne	CA2	28	43
CC[C@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC(C)(C)C	ZINC000450690582	FG	On-Demand	Anodyne	CA1	22	43
CC[C@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC(C)(C)C	ZINC000450690582	FG	On-Demand	Anodyne	CA7	17	43
CC[C@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC(C)(C)C	ZINC000450690582	FG	On-Demand	Anodyne	RORC	40	33
CN(C)c1nc(N2CCC(CF)CC2)nc2ccccc12	ZINC000450690587	CF	On-Demand	Anodyne	ADRA2A	15	46
COc1cccc(OCCC(=O)NC2(CCO)CCCCC2)c1	ZINC000450690601	DF	On-Demand	Anodyne	MTNR1A	34	46
COCc1nc(N2CCC(CF)CC2)c2c(-c3ccccc3)csc2n1	ZINC000450690615	FJ	On-Demand	Anodyne	ADRB3	0	45
O=C(c1cncc(Cl)c1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450690620	DG	On-Demand	Anodyne	AVPR1A	0	48
O=C(c1cncc(Cl)c1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450690621	DG	On-Demand	Anodyne	AVPR1A	0	48
O=C(NCC1(CCOCc2ccccc2)CC1)c1cn(CC2CC2)nn1	ZINC000450690622	FF	On-Demand	Anodyne	HCN4	42	33
Cn1nc(C(=O)Nc2cc(F)cc(Cl)c2O)c2c1CCCC2	ZINC000450690623	DG	On-Demand	Anodyne	CNR1	40	30
CCC[C@@](C)(CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450690625	DG	On-Demand	Anodyne	SORT1	15	41
CCC[C@](C)(CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450690626	DG	On-Demand	Anodyne	SORT1	15	41
Cc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450690642	CI	On-Demand	Anodyne	TYMS	0	43
Cc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450690642	CI	On-Demand	Anodyne	GSK3B	17	40
Cc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450690642	CI	On-Demand	Anodyne	GSK3A	44	40
Cc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450690642	CI	On-Demand	Anodyne	TERT	0	45
Cc1ccn2ncc(C(=O)NC3(CCO)CCCCC3)c2c1	ZINC000450690645	DE	On-Demand	Anodyne	EPHB3	36	51
Cc1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)nn1C(C)C	ZINC000450690649	EG	On-Demand	Anodyne	AVPR1A	0	45
Cc1cc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)nn1C(C)C	ZINC000450690649	EG	On-Demand	Anodyne	BCL2	0	42
Cc1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)nn1C(C)C	ZINC000450690650	EG	On-Demand	Anodyne	AVPR1A	0	45
Cc1cc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)nn1C(C)C	ZINC000450690650	EG	On-Demand	Anodyne	BCL2	0	42
O=C(NC1CC1)c1ccc(N2CCC(CF)CC2)c([N+](=O)[O-])c1	ZINC000450690653	DF	On-Demand	Bother	TAAR1	21	44
COC(=O)c1ccc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1Cl	ZINC000450690654	GI	On-Demand	Anodyne	PDE10A	22	41
COC(=O)c1ccc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1Cl	ZINC000450690655	GI	On-Demand	Anodyne	PDE10A	22	41
O=C(NCC1(CCOCc2ccccc2)CC1)c1cc2n(n1)CCCC2	ZINC000450690672	FG	On-Demand	Anodyne	HCN1	50	31
O=C(NCC1(CCOCc2ccccc2)CC1)c1cc2n(n1)CCCC2	ZINC000450690672	FG	On-Demand	Anodyne	HCN4	48	31
Cc1cccc(CNC2(c3ccc4c(c3)OCO4)CC2)n1	ZINC000450690687	CF	On-Demand	Anodyne	TGFBR1	29	41
Fc1ccc([C@H](Nc2nccc(C(F)F)n2)C2CC2)cc1Cl	ZINC000450690703	EJ	On-Demand	Anodyne	MAPK1	57	41
Fc1ccc([C@@H](Nc2nccc(C(F)F)n2)C2CC2)cc1Cl	ZINC000450690704	EJ	On-Demand	Anodyne	MAPK1	57	41
C[C@H](O)CCCN[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450690706	EI	On-Demand	Anodyne	PHES	0	42
C[C@@H](O)CCCN[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450690707	EI	On-Demand	Anodyne	PHES	0	42
O=C(CS(=O)(=O)C1CC1)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450690713	EE	On-Demand	Anodyne	SDH1	0	41
O=C(CS(=O)(=O)C1CC1)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000450690713	EE	On-Demand	Anodyne	CAPN2	46	32
O=C(CS(=O)(=O)C1CC1)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450690714	EE	On-Demand	Anodyne	SDH1	0	41
O=C(CS(=O)(=O)C1CC1)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000450690714	EE	On-Demand	Anodyne	CAPN2	46	32
Nc1ncccc1CN1CCO[C@@H](Cc2ccccc2)C1	ZINC000450690719	CE	On-Demand	Anodyne	DRD4	16	45
Nc1ncccc1CN1CCO[C@@H](Cc2ccccc2)C1	ZINC000450690719	CE	On-Demand	Anodyne	PDE8B	16	40
Nc1ncccc1CN1CCO[C@H](Cc2ccccc2)C1	ZINC000450690720	CE	On-Demand	Anodyne	DRD4	16	45
Nc1ncccc1CN1CCO[C@H](Cc2ccccc2)C1	ZINC000450690720	CE	On-Demand	Anodyne	PDE8B	16	40
CC/C=C\CNc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690733	GD	On-Demand	Bother	BCL2	25	42
CC/C=C/CNc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1[N+](=O)[O-]	ZINC000450690734	GD	On-Demand	Bother	BCL2	25	42
COCC[C@H](NC(=O)C1(C)CCC(=O)CC1)c1ccc(C)o1	ZINC000450690735	DF	On-Demand	Anodyne	NPPA	43	33
COCC[C@@H](NC(=O)C1(C)CCC(=O)CC1)c1ccc(C)o1	ZINC000450690737	DF	On-Demand	Anodyne	NPPA	43	33
COc1cccc(-c2nnc(SCc3cn(C)nc3C)n2Cc2ccco2)c1	ZINC000450690740	GH	On-Demand	Anodyne	HCRTR2	19	43
COC(=O)c1cnc(N[C@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450690750	EH	On-Demand	Anodyne	MAPK1	53	37
COC(=O)c1cnc(N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)nc1	ZINC000450690751	EH	On-Demand	Anodyne	MAPK1	53	37
CC(C)[C@H]1CN(C(=O)C2(Cc3ccccc3)CCOCC2)CCO1	ZINC000450690763	EF	On-Demand	Anodyne	SLC12A5	42	33
CC(C)[C@@H]1CN(C(=O)C2(Cc3ccccc3)CCOCC2)CCO1	ZINC000450690766	EF	On-Demand	Anodyne	SLC12A5	42	33
COc1ccccc1-c1nnc(SCc2nnc(C(C)C)s2)o1	ZINC000450690775	EI	On-Demand	Anodyne	ALOX15	40	34
CCc1cccc(C(=O)NCCN(CC)CCO)n1	ZINC000450690780	CC	On-Demand	Anodyne	PDE5A	0	40
COC(=O)CC1(CNC(=O)c2ccc3nccnc3n2)CCCCC1	ZINC000450690789	EE	On-Demand	Anodyne	HCN1	52	32
COC(=O)CC1(CNC(=O)c2ccc3nccnc3n2)CCCCC1	ZINC000450690789	EE	On-Demand	Anodyne	HCN4	50	32
COC(=O)CC1(CNC(=O)[C@H](C)Oc2ccccn2)CCCCC1	ZINC000450690795	EE	On-Demand	Anodyne	HCN1	51	32
COC(=O)CC1(CNC(=O)[C@H](C)Oc2ccccn2)CCCCC1	ZINC000450690795	EE	On-Demand	Anodyne	HCN4	48	32
COC(=O)CC1(CNC(=O)[C@@H](C)Oc2ccccn2)CCCCC1	ZINC000450690796	EE	On-Demand	Anodyne	HCN1	51	32
COC(=O)CC1(CNC(=O)[C@@H](C)Oc2ccccn2)CCCCC1	ZINC000450690796	EE	On-Demand	Anodyne	HCN4	48	32
Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690807	FI	On-Demand	Anodyne	DRD4	46	40
Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690807	FI	On-Demand	Anodyne	ACHE	28	40
Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690807	FI	On-Demand	Anodyne	SIGMAR1	32	44
Cc1ccc(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690812	FI	On-Demand	Anodyne	DRD4	46	40
Cc1ccc(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690812	FI	On-Demand	Anodyne	ACHE	28	40
Cc1ccc(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690812	FI	On-Demand	Anodyne	SIGMAR1	32	44
Cc1ccc(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690813	FI	On-Demand	Anodyne	DRD4	46	40
Cc1ccc(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690813	FI	On-Demand	Anodyne	ACHE	28	40
Cc1ccc(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690813	FI	On-Demand	Anodyne	SIGMAR1	32	44
Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690814	FI	On-Demand	Anodyne	DRD4	46	40
Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690814	FI	On-Demand	Anodyne	ACHE	28	40
Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c(C(C)C)n1	ZINC000450690814	FI	On-Demand	Anodyne	SIGMAR1	32	44
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000450690817	FF	On-Demand	Bother	COLA	67	34
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000450690818	FF	On-Demand	Bother	COLA	67	34
CC[C@H](CC(F)(F)F)C(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450690831	EH	On-Demand	Anodyne	NQO2	17	40
CC[C@@H](CC(F)(F)F)C(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450690833	EH	On-Demand	Anodyne	NQO2	17	40
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450690838	FC	On-Demand	Anodyne	TGM2	29	44
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450690838	FC	On-Demand	Anodyne	GCK	64	37
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450690838	FC	On-Demand	Anodyne	GCKR	72	38
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450690839	FC	On-Demand	Anodyne	TGM2	29	44
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450690839	FC	On-Demand	Anodyne	GCK	64	37
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450690839	FC	On-Demand	Anodyne	GCKR	72	38
C=CCCCCNC(=O)[C@H]1CC(=O)N(CC)[C@@H]1c1cccnc1	ZINC000450690862	DE	On-Demand	Mild	NAMPT	15	41
CCC(=O)CCCN1CCN(c2ccc(F)cn2)CC1	ZINC000450690874	CE	On-Demand	Anodyne	HTR1A	42	59
CCC(=O)CCCN1CCN(c2ccc(F)cn2)CC1	ZINC000450690874	CE	On-Demand	Anodyne	DRD1	25	55
CCC(=O)CCCN1CCN(c2ccc(F)cn2)CC1	ZINC000450690874	CE	On-Demand	Anodyne	DRD4	42	55
CCC(=O)CCCN1CCN(c2ccc(F)cn2)CC1	ZINC000450690874	CE	On-Demand	Anodyne	HTR2A	33	47
CCC(=O)CCCN1CCN(c2ccc(F)cn2)CC1	ZINC000450690874	CE	On-Demand	Anodyne	HTR7	57	43
CCC(=O)CCCN1CCN(c2ccc(F)cn2)CC1	ZINC000450690874	CE	On-Demand	Anodyne	SLC27A1	64	47
CCc1cnc(CNC(=O)c2ccc(C(F)(F)F)cc2C)o1	ZINC000450690876	DG	On-Demand	Anodyne	PPARA	17	41
CCc1cnc(CNC(=O)c2ccc(C(F)(F)F)cc2C)o1	ZINC000450690876	DG	On-Demand	Anodyne	PPARD	25	41
COC[C@H](NC(=O)C1=C(c2ccccc2)CCC1)C(=O)OC	ZINC000450690901	DD	On-Demand	Anodyne	CHRM5	40	43
COC[C@H](NC(=O)C1=C(c2ccccc2)CCC1)C(=O)OC	ZINC000450690901	DD	On-Demand	Anodyne	NPPA	43	34
COC[C@@H](NC(=O)C1=C(c2ccccc2)CCC1)C(=O)OC	ZINC000450690902	DD	On-Demand	Anodyne	CHRM5	40	43
COC[C@@H](NC(=O)C1=C(c2ccccc2)CCC1)C(=O)OC	ZINC000450690902	DD	On-Demand	Anodyne	NPPA	43	34
COc1ccccc1-c1nnc(SCCC(C)(F)F)n1C	ZINC000450690905	DH	On-Demand	Anodyne	DRD3	47	39
COc1ccccc1-c1nnc(SCCC(C)(F)F)n1C	ZINC000450690905	DH	On-Demand	Anodyne	KCNH2	26	45
COc1ccccc1-c1nnc(SCCC(C)(F)F)n1C	ZINC000450690905	DH	On-Demand	Anodyne	HSD11B1	0	43
COC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690908	DC	On-Demand	Anodyne	MTNR1A	50	44
COC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690908	DC	On-Demand	Anodyne	MTNR1B	53	44
COC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690908	DC	On-Demand	Anodyne	CPG2	0	40
COC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690908	DC	On-Demand	Anodyne	HDA106	0	44
COC[C@@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690908	DC	On-Demand	Anodyne	PDS	44	32
COC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690909	DC	On-Demand	Anodyne	MTNR1A	50	44
COC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690909	DC	On-Demand	Anodyne	MTNR1B	53	44
COC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690909	DC	On-Demand	Anodyne	CPG2	0	40
COC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690909	DC	On-Demand	Anodyne	HDA106	0	44
COC[C@H](NC(=O)CCOc1cccc(OC)c1)C(=O)OC	ZINC000450690909	DC	On-Demand	Anodyne	PDS	44	32
CC(C)c1nccc(N2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)n1	ZINC000450690940	CG	On-Demand	Anodyne	SORD	50	34
CC(C)c1nccc(N2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)n1	ZINC000450690941	CG	On-Demand	Anodyne	SORD	50	34
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450690942	FI	On-Demand	Anodyne	RBP4	41	38
O=C(c1cccc(C(F)(F)F)n1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450690943	FI	On-Demand	Anodyne	RBP4	41	38
CCn1c(SCc2nc(C(=O)OC)co2)nnc1-c1cccc(C)c1	ZINC000450690969	FG	On-Demand	Anodyne	SLC27A1	43	39
CCOC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)nc1	ZINC000450690971	EE	On-Demand	Anodyne	DRD4	15	41
CCOC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)nc1	ZINC000450690971	EE	On-Demand	Anodyne	SLC27A1	44	44
FCC1CCN(c2nc(-c3cccc(Cl)c3)no2)CC1	ZINC000450690984	CH	On-Demand	Anodyne	GRM5	28	48
Cn1c(C(=O)NCC2(CCOCc3ccccc3)CC2)c2n(c1=O)CCCC2	ZINC000450691004	GF	On-Demand	Anodyne	SLC12A5	40	31
Cn1c(C(=O)NCC2(CCOCc3ccccc3)CC2)c2n(c1=O)CCCC2	ZINC000450691004	GF	On-Demand	Anodyne	HCN1	52	33
Cn1c(C(=O)NCC2(CCOCc3ccccc3)CC2)c2n(c1=O)CCCC2	ZINC000450691004	GF	On-Demand	Anodyne	HCN4	46	30
CCC[C@H](O)CN[C@H](C(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000450691017	CE	On-Demand	Anodyne	PGA5	40	36
CCC[C@@H](O)CN[C@H](C(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000450691018	CE	On-Demand	Anodyne	PGA5	40	36
NC(=O)c1ncc(Br)cc1N1CCC(CF)CC1	ZINC000450691019	DE	On-Demand	Anodyne	SIRT3	43	33
COc1cc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)ccc1Cl	ZINC000450691025	FI	On-Demand	Anodyne	PDE10A	23	49
COc1cc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)ccc1Cl	ZINC000450691026	FI	On-Demand	Anodyne	PDE10A	23	49
Cc1ccc(F)c(CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450691045	EG	On-Demand	Anodyne	AVPR1A	0	42
Cc1ccc(F)c(CC(=O)N2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450691046	EG	On-Demand	Anodyne	AVPR1A	0	42
CC(F)(F)C(C)(C)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450691054	DG	On-Demand	Anodyne	AVPR1A	0	47
CC(F)(F)C(C)(C)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450691055	DG	On-Demand	Anodyne	AVPR1A	0	47
O=C1C(=O)N(Cc2ccn(CC(F)(F)F)n2)C(=O)N1Cc1ccccc1	ZINC000450691060	FD	On-Demand	Anodyne	CTSG	15	45
COC[C@H](NCc1ccccc1OC1CC1)C1CC1	ZINC000450691061	CF	On-Demand	Anodyne	SLC5A4	51	32
COC[C@@H](NCc1ccccc1OC1CC1)C1CC1	ZINC000450691062	CF	On-Demand	Anodyne	SLC5A4	51	32
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	CHRM2	26	40
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	ACE	62	36
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	DRD4	43	45
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	ACHE	33	40
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	CHRM3	33	40
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	SIGMAR1	54	46
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	CCR5	44	36
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	REN	45	34
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	POL	0	42
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	MCHR1	29	43
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	XIAP	49	42
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691081	DE	On-Demand	Anodyne	BIRC2	80	43
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	CHRM2	26	40
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	ACE	62	36
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	DRD4	43	45
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	ACHE	33	40
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	CHRM3	33	40
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	SIGMAR1	54	46
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	CCR5	44	36
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	REN	45	34
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	POL	0	42
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	MCHR1	29	43
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	XIAP	49	42
C[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691082	DE	On-Demand	Anodyne	BIRC2	80	43
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	CHRM2	26	40
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	ACE	62	36
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	DRD4	43	45
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	ACHE	33	40
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	CHRM3	33	40
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	SIGMAR1	54	46
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	CCR5	44	36
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	REN	45	34
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	POL	0	42
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	MCHR1	29	43
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	XIAP	49	42
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691083	DE	On-Demand	Anodyne	BIRC2	80	43
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	CHRM2	26	40
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	ACE	62	36
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	DRD4	43	45
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	ACHE	33	40
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	CHRM3	33	40
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	SIGMAR1	54	46
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	CCR5	44	36
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	REN	45	34
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	POL	0	42
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	MCHR1	29	43
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	XIAP	49	42
C[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691084	DE	On-Demand	Anodyne	BIRC2	80	43
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2)CC(C)(C)O)cc1	ZINC000450691085	FG	On-Demand	Anodyne	RORC	40	53
Cc1onc(C2CC2)c1C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450691086	FE	On-Demand	Anodyne	COLA	42	36
Cc1onc(C2CC2)c1C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450691086	FE	On-Demand	Anodyne	CPT1A	40	36
COC[C@]1(C(=O)NCCc2cn(C)c3cc(F)ccc23)CCOC1	ZINC000450691097	EE	On-Demand	Anodyne	MTNR1A	16	43
COC[C@@]1(C(=O)NCCc2cn(C)c3cc(F)ccc23)CCOC1	ZINC000450691098	EE	On-Demand	Anodyne	MTNR1A	16	43
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	DRD2	17	40
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	DRD4	47	42
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	ACHE	34	51
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	DRD3	26	40
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	TACR2	55	36
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	SIGMAR1	43	43
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	CCR3	34	45
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	MCHR1	29	44
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691120	GI	On-Demand	Anodyne	BIRC2	30	41
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	DRD2	17	40
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	DRD4	47	42
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	ACHE	34	51
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	DRD3	26	40
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	TACR2	55	36
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	SIGMAR1	43	43
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	CCR3	34	45
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	MCHR1	29	44
C[C@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691121	GI	On-Demand	Anodyne	BIRC2	30	41
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	DRD2	17	40
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	DRD4	47	42
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	ACHE	34	51
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	DRD3	26	40
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	TACR2	55	36
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	SIGMAR1	43	43
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	CCR3	34	45
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	MCHR1	29	44
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691122	GI	On-Demand	Anodyne	BIRC2	30	41
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	DRD2	17	40
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	DRD4	47	42
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	ACHE	34	51
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	DRD3	26	40
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	TACR2	55	36
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	SIGMAR1	43	43
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	CCR3	34	45
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	MCHR1	29	44
C[C@@H](NC(=O)Cc1cc2ccccc2s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691123	GI	On-Demand	Anodyne	BIRC2	30	41
COC(=O)CC1(CNC(=O)c2cn3nccc3nc2C)CCCCC1	ZINC000450691148	EE	On-Demand	Anodyne	HCN4	56	37
Cc1cccc(Cl)c1C(=O)N1CCC2(CC1)OCCc1ccsc12	ZINC000450691149	FI	On-Demand	Anodyne	OPRL1	47	39
COC(=O)CC1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450691162	ED	On-Demand	Anodyne	HCN1	52	32
COC(=O)CC1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450691162	ED	On-Demand	Anodyne	HCN4	50	32
CC(C)(C)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@@H]1O	ZINC000450691167	EG	On-Demand	Anodyne	SIGMAR1	40	38
CC(C)(C)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@@H]1O	ZINC000450691168	EG	On-Demand	Anodyne	SIGMAR1	40	38
CC(C)(C)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@H]1O	ZINC000450691169	EG	On-Demand	Anodyne	SIGMAR1	40	38
CC(C)(C)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@H]1O	ZINC000450691170	EG	On-Demand	Anodyne	SIGMAR1	40	38
COC(=O)C[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc(-c2ccccc2)cc1	ZINC000450691171	FG	On-Demand	Anodyne	UTS2	47	35
COC(=O)C[C@H](NC(=O)C1CC(C)(O)C1)c1ccc(-c2ccccc2)cc1	ZINC000450691172	FG	On-Demand	Anodyne	UTS2	47	35
CC(=O)c1cccc(CN2CCC[C@@H]2C2CCOCC2)c1	ZINC000450691174	CG	On-Demand	Anodyne	HRH3	17	42
CC(=O)c1cccc(CN2CCC[C@H]2C2CCOCC2)c1	ZINC000450691175	CG	On-Demand	Anodyne	HRH3	17	42
COC(=O)[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(OC(F)F)cc1	ZINC000450691185	FF	On-Demand	Anodyne	ADRB3	26	46
COC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(OC(F)F)cc1	ZINC000450691186	FF	On-Demand	Anodyne	ADRB3	26	46
COC[C@H](NC(=O)[C@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450691199	DD	On-Demand	Anodyne	SCN9A	22	42
COC[C@H](NC(=O)[C@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450691199	DD	On-Demand	Anodyne	AMY2	43	30
COC[C@H](NC(=O)[C@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450691199	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	23	41
COC[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450691200	DD	On-Demand	Anodyne	SCN9A	22	42
COC[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450691200	DD	On-Demand	Anodyne	AMY2	43	30
COC[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450691200	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	23	41
COC[C@H](NC(=O)[C@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450691201	DD	On-Demand	Anodyne	SCN9A	22	42
COC[C@H](NC(=O)[C@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450691201	DD	On-Demand	Anodyne	AMY2	43	30
COC[C@H](NC(=O)[C@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450691201	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	23	41
COC[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450691202	DD	On-Demand	Anodyne	SCN9A	22	42
COC[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450691202	DD	On-Demand	Anodyne	AMY2	43	30
COC[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)C(=O)OC	ZINC000450691202	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	23	41
CCNc1ccc(Cl)cc1NC(=O)C[C@@H](O)CC	ZINC000450691208	CF	On-Demand	Anodyne	SLC1A1	27	41
CCNc1ccc(Cl)cc1NC(=O)C[C@@H](O)CC	ZINC000450691208	CF	On-Demand	Anodyne	SLC1A3	26	41
CCNc1ccc(Cl)cc1NC(=O)C[C@@H](O)CC	ZINC000450691208	CF	On-Demand	Anodyne	SLC1A2	32	41
CCNc1ccc(Cl)cc1NC(=O)C[C@H](O)CC	ZINC000450691209	CF	On-Demand	Anodyne	SLC1A1	27	41
CCNc1ccc(Cl)cc1NC(=O)C[C@H](O)CC	ZINC000450691209	CF	On-Demand	Anodyne	SLC1A3	26	41
CCNc1ccc(Cl)cc1NC(=O)C[C@H](O)CC	ZINC000450691209	CF	On-Demand	Anodyne	SLC1A2	32	41
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450691210	FH	On-Demand	Anodyne	ACE	48	37
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450691210	FH	On-Demand	Anodyne	CCR1	42	43
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450691210	FH	On-Demand	Anodyne	CCR5	55	32
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450691211	FH	On-Demand	Anodyne	ACE	48	37
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450691211	FH	On-Demand	Anodyne	CCR1	42	43
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450691211	FH	On-Demand	Anodyne	CCR5	55	32
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450691212	FH	On-Demand	Anodyne	ACE	48	37
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450691212	FH	On-Demand	Anodyne	CCR1	42	43
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450691212	FH	On-Demand	Anodyne	CCR5	55	32
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450691213	FH	On-Demand	Anodyne	ACE	48	37
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450691213	FH	On-Demand	Anodyne	CCR1	42	43
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450691213	FH	On-Demand	Anodyne	CCR5	55	32
C=CC(C)(C)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450691232	DH	On-Demand	Mild	CACNA1I	41	34
Cc1nn(C)cc1CC(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450691235	EG	On-Demand	Anodyne	CCR3	32	52
CCNc1ccc(Cl)cc1NC(=O)c1cc2n(n1)CCCC2	ZINC000450691241	DH	On-Demand	Anodyne	CNR2	25	40
Cc1onc(C2CC2)c1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450691247	FI	On-Demand	Anodyne	CCR3	23	40
COc1ccc(CNC(=O)CCN2CCC(C)(OC)CC2)c(OC)c1	ZINC000450691249	FE	On-Demand	Anodyne	HTR1A	17	40
COc1ccc(CNC(=O)CCN2CCC(C)(OC)CC2)c(OC)c1	ZINC000450691249	FE	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCC(C)(OC)CC2)c(OC)c1	ZINC000450691249	FE	On-Demand	Anodyne	HTR7	31	43
COc1ccc(CNC(=O)CCN2CCC(C)(OC)CC2)c(OC)c1	ZINC000450691249	FE	On-Demand	Anodyne	MTNR1A	64	46
COc1ccc(CNC(=O)CCN2CCC(C)(OC)CC2)c(OC)c1	ZINC000450691249	FE	On-Demand	Anodyne	MTNR1B	51	46
CCc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)n1	ZINC000450691257	DH	On-Demand	Anodyne	HSD11B1	0	45
CCc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)n1	ZINC000450691257	DH	On-Demand	Anodyne	PDE7A	18	41
CCc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)n1	ZINC000450691258	DH	On-Demand	Anodyne	HSD11B1	0	45
CCc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)n1	ZINC000450691258	DH	On-Demand	Anodyne	PDE7A	18	41
C[C@H](CCC1CC1)NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450691275	DG	On-Demand	Anodyne	GCK	26	43
C[C@@H](CCC1CC1)NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450691276	DG	On-Demand	Anodyne	GCK	26	43
COc1ccc(C(=O)NC2(CCO)CCCCC2)cc1S(C)(=O)=O	ZINC000450691317	FD	On-Demand	Anodyne	COLA	54	34
COc1ccc(C(=O)NC2(CCO)CCCCC2)cc1S(C)(=O)=O	ZINC000450691317	FD	On-Demand	Anodyne	CPT1A	54	34
COc1cc(CC(=O)NC2(CCO)CCCCC2)ccc1O	ZINC000450691320	DE	On-Demand	Anodyne	NCE103	33	41
COc1cc(CC(=O)NC2(CCO)CCCCC2)ccc1O	ZINC000450691320	DE	On-Demand	Anodyne	CAN2	0	41
CC(C)(C)[C@H](COc1ccccc1F)NCc1cnns1	ZINC000450691327	DG	On-Demand	Anodyne	SDH1	0	40
CC(C)(C)[C@@H](COc1ccccc1F)NCc1cnns1	ZINC000450691328	DG	On-Demand	Anodyne	SDH1	0	40
COc1ccccc1Oc1ccc(C(=O)NC2(CCO)CCCCC2)nc1	ZINC000450691329	FH	On-Demand	Anodyne	HCN1	54	36
COc1ccccc1Oc1ccc(C(=O)NC2(CCO)CCCCC2)nc1	ZINC000450691329	FH	On-Demand	Anodyne	HCN4	51	36
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCC(CF)CC2)c([N+](=O)[O-])c1	ZINC000450691345	FE	On-Demand	Bother	TAAR1	28	50
COC(=O)[C@H](C)NC(=O)c1ccc(N2CCC(CF)CC2)c([N+](=O)[O-])c1	ZINC000450691346	FE	On-Demand	Bother	TAAR1	28	50
Cc1ccc(-n2ncc(N3CCC(CF)CC3)c(Cl)c2=O)cc1Cl	ZINC000450691353	FI	On-Demand	Anodyne	NPBWR1	40	38
Cc1ccn(CC(=O)NCC2(CCOCc3ccccc3)CC2)n1	ZINC000450691375	EF	On-Demand	Anodyne	NPFFR1	42	37
COC(=O)C[C@@H](NC(=O)[C@@H]1CC1(F)F)c1ccc(-c2ccccc2)cc1	ZINC000450691380	FH	On-Demand	Anodyne	UTS2	51	36
COC(=O)C[C@@H](NC(=O)[C@H]1CC1(F)F)c1ccc(-c2ccccc2)cc1	ZINC000450691381	FH	On-Demand	Anodyne	UTS2	51	36
COC(=O)C[C@H](NC(=O)[C@@H]1CC1(F)F)c1ccc(-c2ccccc2)cc1	ZINC000450691382	FH	On-Demand	Anodyne	UTS2	51	36
COC(=O)C[C@H](NC(=O)[C@H]1CC1(F)F)c1ccc(-c2ccccc2)cc1	ZINC000450691383	FH	On-Demand	Anodyne	UTS2	51	36
Cn1cc(CCNC(=O)CCCC(=O)C(C)(C)C)c2ccc(F)cc21	ZINC000450691406	EH	On-Demand	Anodyne	NQO2	17	42
COc1cccc(-c2nnc(SCC3(OC)CCC3)n2Cc2ccco2)c1	ZINC000450691414	GI	On-Demand	Anodyne	HCRTR2	20	44
COC(=O)c1csc(CN2CCO[C@@H](Cc3ccccc3)C2)n1	ZINC000450691421	EE	On-Demand	Anodyne	DRD4	17	45
COC(=O)c1csc(CN2CCO[C@H](Cc3ccccc3)C2)n1	ZINC000450691422	EE	On-Demand	Anodyne	DRD4	17	45
CC(C)(O)CN(Cc1ccccc1)Cc1cn(CC2CC2)nn1	ZINC000450691423	DE	On-Demand	Anodyne	HSP90AB1	17	42
C=CCCCCNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450691439	CG	On-Demand	Mild	CTSL	19	44
C=CCCCCNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450691439	CG	On-Demand	Mild	CAPN1	27	44
C=CCCCCNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450691439	CG	On-Demand	Mild	Q9NAW4_PLAFA	24	44
CC/C=C\CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450691448	CF	On-Demand	Anodyne	DHOD	0	56
O=C(Cc1cc2ccccc2s1)N1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000450691450	GJ	On-Demand	Anodyne	ETHR	67	37
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCc1nnnn1CC1CC1	ZINC000450691455	GE	On-Demand	Anodyne	AVPR1B	43	44
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCc1nnnn1CC1CC1	ZINC000450691455	GE	On-Demand	Anodyne	PDE6D	93	39
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCc1nnnn1CC1CC1	ZINC000450691455	GE	On-Demand	Anodyne	IMDH_CRYPV	33	48
CCC[C@@](C)(CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450691484	DE	On-Demand	Anodyne	CTSV	46	32
CCC[C@@](C)(CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450691484	DE	On-Demand	Anodyne	AGER	0	40
CCC[C@](C)(CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450691485	DE	On-Demand	Anodyne	CTSV	46	32
CCC[C@](C)(CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450691485	DE	On-Demand	Anodyne	AGER	0	40
Cc1ccccc1-c1nnc(SC[C@H]2CCCC2(F)F)n1C	ZINC000450691487	DI	On-Demand	Anodyne	DRD3	41	37
Cc1ccccc1-c1nnc(SC[C@@H]2CCCC2(F)F)n1C	ZINC000450691488	DI	On-Demand	Anodyne	DRD3	41	37
CCOC(=O)c1cc(N2CCC(CF)CC2)ncc1Cl	ZINC000450691489	DG	On-Demand	Anodyne	HTR4	50	36
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(CF)CC2)c1	ZINC000450691502	CF	On-Demand	Bother	TAAR1	18	40
COC(=O)CCN1CCN(Cc2ccc(Cl)c(OC)c2)[C@H](C)C1	ZINC000450691504	EE	On-Demand	Anodyne	HTR4	59	35
COC(=O)CCN1CCN(Cc2ccc(Cl)c(OC)c2)[C@H](C)C1	ZINC000450691504	EE	On-Demand	Anodyne	CCR1	55	42
COC(=O)CCN1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C)C1	ZINC000450691505	EE	On-Demand	Anodyne	HTR4	59	35
COC(=O)CCN1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C)C1	ZINC000450691505	EE	On-Demand	Anodyne	CCR1	55	42
CCCc1cc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)no1	ZINC000450691506	EI	On-Demand	Anodyne	GRIN2B	42	39
O=C(c1cc2ccncc2s1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450691509	EH	On-Demand	Anodyne	AVPR1A	0	43
O=C(c1cc2ccncc2s1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450691511	EH	On-Demand	Anodyne	AVPR1A	0	43
CCc1cc(N[C@H](C)CC(C)(C)O)n2ncnc2n1	ZINC000450691518	CD	On-Demand	Anodyne	DHOD	0	53
CCc1cc(N[C@@H](C)CC(C)(C)O)n2ncnc2n1	ZINC000450691520	CD	On-Demand	Anodyne	DHOD	0	53
COc1ccc(C(=O)N[C@H](C)CCC2CC2)cc1S(C)(=O)=O	ZINC000450691541	EE	On-Demand	Anodyne	COLA	68	36
COc1ccc(C(=O)N[C@H](C)CCC2CC2)cc1S(C)(=O)=O	ZINC000450691541	EE	On-Demand	Anodyne	CPT1A	59	36
COc1ccc(C(=O)N[C@H](C)CCC2CC2)cc1S(C)(=O)=O	ZINC000450691541	EE	On-Demand	Anodyne	CPT1B	54	34
COc1ccc(C(=O)N[C@@H](C)CCC2CC2)cc1S(C)(=O)=O	ZINC000450691543	EE	On-Demand	Anodyne	COLA	68	36
COc1ccc(C(=O)N[C@@H](C)CCC2CC2)cc1S(C)(=O)=O	ZINC000450691543	EE	On-Demand	Anodyne	CPT1A	59	36
COc1ccc(C(=O)N[C@@H](C)CCC2CC2)cc1S(C)(=O)=O	ZINC000450691543	EE	On-Demand	Anodyne	CPT1B	54	34
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450691553	EF	On-Demand	Anodyne	SIGMAR1	20	47
CC(=O)c1cccc(CN2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450691555	DF	On-Demand	Anodyne	HTR1A	23	46
CC(=O)c1cccc(CN2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450691555	DF	On-Demand	Anodyne	DRD2	23	47
CC(=O)c1cccc(CN2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450691555	DF	On-Demand	Anodyne	DRD4	41	47
CC(=O)c1cccc(CN2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450691555	DF	On-Demand	Anodyne	IKBKB	41	35
CC(=O)c1cccc(CN2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450691555	DF	On-Demand	Anodyne	ABCB1	0	45
CC(=O)c1cccc(CN2CCN(c3ccc(F)cn3)CC2)c1	ZINC000450691555	DF	On-Demand	Anodyne	SLC27A1	62	44
CC(=O)N1CCN(CCCC(=O)c2ccccc2)C(C)(C)C1	ZINC000450691559	DF	On-Demand	Anodyne	CYP2J2	53	38
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450691561	EF	On-Demand	Anodyne	SIGMAR1	20	47
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450691562	EF	On-Demand	Anodyne	SIGMAR1	20	47
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450691563	EF	On-Demand	Anodyne	SIGMAR1	20	47
O=C(c1ccc2cnccc2c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450691582	FJ	On-Demand	Anodyne	CHRM2	15	44
O=C(c1ccc2cnccc2c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450691582	FJ	On-Demand	Anodyne	GRIN2B	49	42
O=C(c1ccc2cnccc2c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450691582	FJ	On-Demand	Anodyne	CCR3	46	46
O=C(c1ccc2cnccc2c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450691582	FJ	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc2cnccc2c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450691582	FJ	On-Demand	Anodyne	L3MBTL3	54	41
CCc1cc(CCCN2CCN(c3ccc(F)cn3)CC2)on1	ZINC000450691595	DF	On-Demand	Anodyne	DRD4	20	50
CCc1cc(CCCN2CCN(c3ccc(F)cn3)CC2)on1	ZINC000450691595	DF	On-Demand	Anodyne	DRD3	15	46
Cc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1	ZINC000450691601	DG	On-Demand	Anodyne	GSK3B	17	42
Cc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1	ZINC000450691601	DG	On-Demand	Anodyne	GSK3A	42	42
CC(=O)N[C@H](C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1)C(C)(C)C	ZINC000450691617	FG	On-Demand	Anodyne	CCR1	44	40
CC(=O)N[C@H](C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1)C(C)(C)C	ZINC000450691617	FG	On-Demand	Anodyne	Q9JN24_ECOLX	0	46
CCC[C@](C)(CO)NC(=O)c1ccc(I)cc1F	ZINC000450691618	FF	On-Demand	Anodyne	MAP2K1	41	33
CCC[C@@](C)(CO)NC(=O)c1ccc(I)cc1F	ZINC000450691619	FF	On-Demand	Anodyne	MAP2K1	41	33
COc1ccc2nc(C)nc(N3CCC(CF)CC3)c2c1	ZINC000450691631	CG	On-Demand	Anodyne	PDE3A	48	40
COc1ccc2nc(C)nc(N3CCC(CF)CC3)c2c1	ZINC000450691631	CG	On-Demand	Anodyne	PDE3B	70	40
COc1cc(CC(=O)N(C)CCN(C)CC(F)F)ccc1O	ZINC000450691640	DD	On-Demand	Anodyne	TRPV1	0	42
Cc1c(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)nn2c1OCCC2	ZINC000450691648	GG	On-Demand	Anodyne	CCR3	19	40
CCOC(=O)c1ccc(CSc2nnc(-c3ccccc3OC)n2CC)nc1	ZINC000450691651	GH	On-Demand	Anodyne	SLC27A1	36	41
C[C@H](CCC1CC1)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450691657	CG	On-Demand	Anodyne	CCR3	43	33
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)CCC1CC1	ZINC000450691658	CG	On-Demand	Anodyne	CCR3	43	33
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450691659	CG	On-Demand	Anodyne	CCR3	43	33
C[C@@H](CCC1CC1)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450691660	CG	On-Demand	Anodyne	CCR3	43	33
COc1ccc(-c2nnc(S[C@H](C)C(=O)C3CCCCC3)n2C)cc1	ZINC000450691663	FI	On-Demand	Anodyne	DGAT1	18	40
COc1ccc(-c2nnc(S[C@@H](C)C(=O)C3CCCCC3)n2C)cc1	ZINC000450691664	FI	On-Demand	Anodyne	DGAT1	18	40
CCNc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450691671	EH	On-Demand	Anodyne	KLKB1	28	40
CCNc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450691671	EH	On-Demand	Anodyne	CNR1	49	29
CCNc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450691671	EH	On-Demand	Anodyne	F10	45	46
CCNc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450691671	EH	On-Demand	Anodyne	HDAC1	30	43
CCNc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450691671	EH	On-Demand	Anodyne	CXCR3	27	40
C[C@H](CCC1CC1)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450691672	EH	On-Demand	Bother	LIPC	0	44
C[C@H](CCC1CC1)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450691672	EH	On-Demand	Bother	LIPG	48	44
C[C@H](CCC1CC1)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450691672	EH	On-Demand	Bother	AADAC	0	41
C[C@@H](CCC1CC1)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450691673	EH	On-Demand	Bother	LIPC	0	44
C[C@@H](CCC1CC1)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450691673	EH	On-Demand	Bother	LIPG	48	44
C[C@@H](CCC1CC1)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450691673	EH	On-Demand	Bother	AADAC	0	41
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCn2cncc2C1	ZINC000450691692	FE	On-Demand	Anodyne	GSK3A	21	43
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCn2cncc2C1	ZINC000450691693	FE	On-Demand	Anodyne	GSK3A	21	43
C[C@@H](NC(=O)CCCC(=O)C1CC1)[C@H](c1ccccc1)N(C)C	ZINC000450691694	DF	On-Demand	Anodyne	ACER2	0	48
C[C@H](NC(=O)CCCC(=O)C1CC1)[C@H](c1ccccc1)N(C)C	ZINC000450691695	DF	On-Demand	Anodyne	ACER2	0	48
C[C@@H](NC(=O)CCCC(=O)C1CC1)[C@@H](c1ccccc1)N(C)C	ZINC000450691696	DF	On-Demand	Anodyne	ACER2	0	48
C[C@H](NC(=O)CCCC(=O)C1CC1)[C@@H](c1ccccc1)N(C)C	ZINC000450691697	DF	On-Demand	Anodyne	ACER2	0	48
COc1ccc(CN(C(=O)c2cccc(C(F)(F)F)n2)[C@H](CO)C(C)C)cc1	ZINC000450691698	GH	On-Demand	Anodyne	TRPV1	67	40
COC(=O)c1ccc(CC(=O)N(Cc2ccc(OC)cc2)[C@H](CO)C(C)C)cc1	ZINC000450691700	GG	On-Demand	Anodyne	BMP1	33	40
CC[C@H](O)CC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691705	DE	On-Demand	Anodyne	DRD4	43	42
CC[C@H](O)CC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691705	DE	On-Demand	Anodyne	SIGMAR1	50	45
CC[C@H](O)CC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691705	DE	On-Demand	Anodyne	CCR3	29	41
CC[C@H](O)CC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691705	DE	On-Demand	Anodyne	SLC18A3	22	40
CC[C@H](O)CC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691705	DE	On-Demand	Anodyne	MCHR1	23	42
CC[C@H](O)CC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691705	DE	On-Demand	Anodyne	CACNA1G	29	41
CC[C@H](O)CC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691705	DE	On-Demand	Anodyne	BIRC2	34	43
CC[C@H](O)CC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691706	DE	On-Demand	Anodyne	DRD4	43	42
CC[C@H](O)CC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691706	DE	On-Demand	Anodyne	SIGMAR1	50	45
CC[C@H](O)CC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691706	DE	On-Demand	Anodyne	CCR3	29	41
CC[C@H](O)CC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691706	DE	On-Demand	Anodyne	SLC18A3	22	40
CC[C@H](O)CC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691706	DE	On-Demand	Anodyne	MCHR1	23	42
CC[C@H](O)CC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691706	DE	On-Demand	Anodyne	CACNA1G	29	41
CC[C@H](O)CC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691706	DE	On-Demand	Anodyne	BIRC2	34	43
CC[C@H](O)CC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691707	DE	On-Demand	Anodyne	DRD4	43	42
CC[C@H](O)CC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691707	DE	On-Demand	Anodyne	SIGMAR1	50	45
CC[C@H](O)CC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691707	DE	On-Demand	Anodyne	CCR3	29	41
CC[C@H](O)CC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691707	DE	On-Demand	Anodyne	SLC18A3	22	40
CC[C@H](O)CC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691707	DE	On-Demand	Anodyne	MCHR1	23	42
CC[C@H](O)CC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691707	DE	On-Demand	Anodyne	CACNA1G	29	41
CC[C@H](O)CC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450691707	DE	On-Demand	Anodyne	BIRC2	34	43
CC[C@H](O)CC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691708	DE	On-Demand	Anodyne	DRD4	43	42
CC[C@H](O)CC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691708	DE	On-Demand	Anodyne	SIGMAR1	50	45
CC[C@H](O)CC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691708	DE	On-Demand	Anodyne	CCR3	29	41
CC[C@H](O)CC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691708	DE	On-Demand	Anodyne	SLC18A3	22	40
CC[C@H](O)CC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691708	DE	On-Demand	Anodyne	MCHR1	23	42
CC[C@H](O)CC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691708	DE	On-Demand	Anodyne	CACNA1G	29	41
CC[C@H](O)CC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450691708	DE	On-Demand	Anodyne	BIRC2	34	43
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(OC)c1C(C)C	ZINC000450691725	FH	On-Demand	Anodyne	PRNP	55	43
CC[C@H](CC(F)(F)F)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450691730	FF	On-Demand	Anodyne	PDS	51	34
CC[C@@H](CC(F)(F)F)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450691731	FF	On-Demand	Anodyne	PDS	51	34
CC(=O)CCCCCN1C(=O)C(=O)N(CC(C)C)C1=O	ZINC000450691742	CD	On-Demand	Anodyne	PAOX	39	41
CO[C@@H]1COCC[C@H]1CNc1cc(C(F)(F)F)ccn1	ZINC000450691747	CF	On-Demand	Anodyne	CCR2	33	42
CO[C@H]1COCC[C@@H]1CNc1cc(C(F)(F)F)ccn1	ZINC000450691749	CF	On-Demand	Anodyne	CCR2	33	42
CO[C@@H]1COCC[C@@H]1CNc1cc(C(F)(F)F)ccn1	ZINC000450691751	CF	On-Demand	Anodyne	CCR2	33	42
CO[C@H]1COCC[C@H]1CNc1cc(C(F)(F)F)ccn1	ZINC000450691752	CF	On-Demand	Anodyne	CCR2	33	42
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccc(Br)cc1	ZINC000450691753	GI	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccc(Br)cc1	ZINC000450691754	GI	On-Demand	Anodyne	CYP2J2	51	36
C=CCCCCNC(=O)c1cn2nccc2nc1C	ZINC000450691766	CE	On-Demand	Mild	DDR1	44	41
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@H]1CCN(c2ccccc2)C1	ZINC000450691787	GF	On-Demand	Anodyne	COLA	91	41
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@H]1CCN(c2ccccc2)C1	ZINC000450691787	GF	On-Demand	Anodyne	CPT1A	86	34
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450691789	GF	On-Demand	Anodyne	COLA	91	41
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450691789	GF	On-Demand	Anodyne	CPT1A	86	34
C[C@@H]1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450691790	DG	On-Demand	Anodyne	GSK3A	24	51
C[C@@H]1CC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450691792	DG	On-Demand	Anodyne	GSK3A	24	51
C[C@H]1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450691794	DG	On-Demand	Anodyne	GSK3A	24	51
C[C@H]1CC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450691796	DG	On-Demand	Anodyne	GSK3A	24	51
C[C@@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CO1	ZINC000450691801	DE	On-Demand	Anodyne	GSK3A	20	45
C[C@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CO1	ZINC000450691803	DE	On-Demand	Anodyne	GSK3A	20	45
C[C@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CO1	ZINC000450691805	DE	On-Demand	Anodyne	GSK3A	20	45
C[C@@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CO1	ZINC000450691806	DE	On-Demand	Anodyne	GSK3A	20	45
COc1ccc(CNC(=O)CCN2CCO[C@@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691819	GF	On-Demand	Anodyne	HTR1A	24	44
COc1ccc(CNC(=O)CCN2CCO[C@@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691819	GF	On-Demand	Anodyne	DRD2	23	44
COc1ccc(CNC(=O)CCN2CCO[C@@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691819	GF	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCO[C@@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691819	GF	On-Demand	Anodyne	HTR7	39	43
COc1ccc(CNC(=O)CCN2CCO[C@@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691819	GF	On-Demand	Anodyne	SIGMAR1	19	44
COc1ccc(CNC(=O)CCN2CCO[C@@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691819	GF	On-Demand	Anodyne	MTNR1A	44	35
COc1ccc(CNC(=O)CCN2CCO[C@@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691819	GF	On-Demand	Anodyne	MTNR1B	41	35
COc1ccc(CNC(=O)CCN2CCO[C@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691820	GF	On-Demand	Anodyne	HTR1A	24	44
COc1ccc(CNC(=O)CCN2CCO[C@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691820	GF	On-Demand	Anodyne	DRD2	23	44
COc1ccc(CNC(=O)CCN2CCO[C@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691820	GF	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCO[C@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691820	GF	On-Demand	Anodyne	HTR7	39	43
COc1ccc(CNC(=O)CCN2CCO[C@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691820	GF	On-Demand	Anodyne	SIGMAR1	19	44
COc1ccc(CNC(=O)CCN2CCO[C@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691820	GF	On-Demand	Anodyne	MTNR1A	44	35
COc1ccc(CNC(=O)CCN2CCO[C@H](Cc3ccccc3)C2)c(OC)c1	ZINC000450691820	GF	On-Demand	Anodyne	MTNR1B	41	35
COC(=O)CC1(CNC(=O)c2cc(C)n(C(C)C)n2)CCCCC1	ZINC000450691830	EG	On-Demand	Anodyne	HCN4	50	37
O=C(Cc1ccccc1O[C@H]1CCOC1)NC1(CCO)CCCCC1	ZINC000450691837	EF	On-Demand	Anodyne	PDEC	0	40
O=C(Cc1ccccc1O[C@@H]1CCOC1)NC1(CCO)CCCCC1	ZINC000450691838	EF	On-Demand	Anodyne	PDEC	0	40
COc1cc2c(N3CC(=O)N(CCC(F)(F)F)C3)ncnc2cc1F	ZINC000450691842	FE	On-Demand	Anodyne	PDE3A	47	38
COc1cc2c(N3CC(=O)N(CCC(F)(F)F)C3)ncnc2cc1F	ZINC000450691842	FE	On-Demand	Anodyne	PDGFRB	64	37
COc1cc2c(N3CC(=O)N(CCC(F)(F)F)C3)ncnc2cc1F	ZINC000450691842	FE	On-Demand	Anodyne	PDE3B	45	35
COC(=O)c1coc(CN[C@@H](COc2ccccc2F)C(C)(C)C)n1	ZINC000450691844	FG	On-Demand	Anodyne	SDH1	0	40
COC(=O)c1coc(CN[C@H](COc2ccccc2F)C(C)(C)C)n1	ZINC000450691845	FG	On-Demand	Anodyne	SDH1	0	40
C=CCOc1ccc(CC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000450691859	FH	On-Demand	Mild	ACACA	41	36
C=CCOc1ccc(CC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000450691859	FH	On-Demand	Mild	ACE2	40	33
C=CCOc1ccc(CC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000450691859	FH	On-Demand	Mild	CYP26A1	41	36
C=CCOc1ccc(CC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000450691861	FH	On-Demand	Mild	ACACA	41	36
C=CCOc1ccc(CC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000450691861	FH	On-Demand	Mild	ACE2	40	33
C=CCOc1ccc(CC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000450691861	FH	On-Demand	Mild	CYP26A1	41	36
C=CCOc1ccc(CC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000450691866	FH	On-Demand	Mild	ACACA	41	36
C=CCOc1ccc(CC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000450691866	FH	On-Demand	Mild	ACE2	40	33
C=CCOc1ccc(CC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000450691866	FH	On-Demand	Mild	CYP26A1	41	36
C=CCOc1ccc(CC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000450691868	FH	On-Demand	Mild	ACACA	41	36
C=CCOc1ccc(CC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000450691868	FH	On-Demand	Mild	ACE2	40	33
C=CCOc1ccc(CC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000450691868	FH	On-Demand	Mild	CYP26A1	41	36
Cc1cc(N2CCC(CF)CC2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450691878	DH	On-Demand	Bother	GYRB	0	55
COc1cccc2c(N3CCC(CF)CC3)ccnc12	ZINC000450691916	CG	On-Demand	Anodyne	PDE3A	44	34
COc1cccc2c(N3CCC(CF)CC3)ccnc12	ZINC000450691916	CG	On-Demand	Anodyne	PDE3B	65	34
CCCOc1cccc(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)c1	ZINC000450691918	FF	On-Demand	Anodyne	UPP1	55	41
CCCOc1cccc(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)c1	ZINC000450691918	FF	On-Demand	Anodyne	TSPAN17	0	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC=C(c3c(F)cccc3F)CC2)c1	ZINC000450691919	FI	On-Demand	Anodyne	ADAM10	28	44
O=C(c1ccsc1Br)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450691920	FH	On-Demand	Anodyne	AVPR1A	0	52
O=C(c1ccsc1Br)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450691921	FH	On-Demand	Anodyne	AVPR1A	0	52
O=C(CC[C@@H]1CCC(=O)N1)NCC1(Cc2ccccc2)CCCCC1	ZINC000450691922	EG	On-Demand	Anodyne	NPFFR1	31	41
O=C(CC[C@H]1CCC(=O)N1)NCC1(Cc2ccccc2)CCCCC1	ZINC000450691923	EG	On-Demand	Anodyne	NPFFR1	31	41
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@@H]2CCC(=O)N2C)cc1	ZINC000450692000	GH	On-Demand	Anodyne	ACHE	16	42
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@@H]2CCC(=O)N2C)cc1	ZINC000450692000	GH	On-Demand	Anodyne	PPARG	48	38
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@@H]2CCC(=O)N2C)cc1	ZINC000450692000	GH	On-Demand	Anodyne	AVPR1A	20	41
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@@H]2CCC(=O)N2C)cc1	ZINC000450692000	GH	On-Demand	Anodyne	LTA4H	70	42
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@@H]2CCC(=O)N2C)cc1	ZINC000450692000	GH	On-Demand	Anodyne	PLA2G4B	53	33
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@H]2CCC(=O)N2C)cc1	ZINC000450692003	GH	On-Demand	Anodyne	ACHE	16	42
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@H]2CCC(=O)N2C)cc1	ZINC000450692003	GH	On-Demand	Anodyne	PPARG	48	38
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@H]2CCC(=O)N2C)cc1	ZINC000450692003	GH	On-Demand	Anodyne	AVPR1A	20	41
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@H]2CCC(=O)N2C)cc1	ZINC000450692003	GH	On-Demand	Anodyne	LTA4H	70	42
CCCOc1ccc(CN(Cc2ccccc2)C(=O)[C@H]2CCC(=O)N2C)cc1	ZINC000450692003	GH	On-Demand	Anodyne	PLA2G4B	53	33
O=C(CCc1ccc2ccccc2c1O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450692015	GJ	On-Demand	Anodyne	ETHR	41	33
O=C(CCc1ccc2ccccc2c1O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450692016	GJ	On-Demand	Anodyne	ETHR	41	33
COc1ccc(-c2nnc(SCCC(C)(F)F)n2Cc2ccco2)cc1	ZINC000450692019	GJ	On-Demand	Anodyne	HCRTR2	21	50
C[C@H](CCC1CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450692022	CG	On-Demand	Anodyne	CTSV	48	33
C[C@H](CCC1CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450692022	CG	On-Demand	Anodyne	VCP	45	37
C[C@@H](CCC1CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450692023	CG	On-Demand	Anodyne	CTSV	48	33
C[C@@H](CCC1CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450692023	CG	On-Demand	Anodyne	VCP	45	37
Cc1nnnn1-c1ccc(C(=O)N[C@@H](C)CCC2CC2)c(F)c1	ZINC000450692024	DE	On-Demand	Anodyne	CCR3	51	38
Cc1nnnn1-c1ccc(C(=O)N[C@H](C)CCC2CC2)c(F)c1	ZINC000450692025	DE	On-Demand	Anodyne	CCR3	51	38
CCOC(=O)c1ccc(CSc2nnc(-c3cccc(C)c3)n2C)nc1	ZINC000450692030	FH	On-Demand	Anodyne	P2RY12	20	40
Cc1cc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)nn1C(C)C	ZINC000450692060	FI	On-Demand	Anodyne	CHRM2	15	43
Cc1cc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)nn1C(C)C	ZINC000450692060	FI	On-Demand	Anodyne	GRIN2B	43	39
Cc1cc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)nn1C(C)C	ZINC000450692060	FI	On-Demand	Anodyne	CCR3	24	40
CCNc1ccc(Cl)cc1NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450692080	GI	On-Demand	Anodyne	TACR3	43	33
CCNc1ccc(Cl)cc1NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450692081	GI	On-Demand	Anodyne	TACR3	43	33
COC[C@H](NC(=O)C1=C(c2ccccc2)CCCC1)C(=O)OC	ZINC000450692089	DE	On-Demand	Anodyne	CHRM5	41	43
COC[C@H](NC(=O)C1=C(c2ccccc2)CCCC1)C(=O)OC	ZINC000450692089	DE	On-Demand	Anodyne	ACE2	45	34
COC[C@H](NC(=O)C1=C(c2ccccc2)CCCC1)C(=O)OC	ZINC000450692089	DE	On-Demand	Anodyne	NPPA	46	36
COC[C@@H](NC(=O)C1=C(c2ccccc2)CCCC1)C(=O)OC	ZINC000450692090	DE	On-Demand	Anodyne	CHRM5	41	43
COC[C@@H](NC(=O)C1=C(c2ccccc2)CCCC1)C(=O)OC	ZINC000450692090	DE	On-Demand	Anodyne	ACE2	45	34
COC[C@@H](NC(=O)C1=C(c2ccccc2)CCCC1)C(=O)OC	ZINC000450692090	DE	On-Demand	Anodyne	NPPA	46	36
COC[C@H](NC(=O)c1c(C)cccc1Cl)C(=O)OC	ZINC000450692091	CD	On-Demand	Anodyne	PYGL	20	40
COC[C@@H](NC(=O)c1c(C)cccc1Cl)C(=O)OC	ZINC000450692092	CD	On-Demand	Anodyne	PYGL	20	40
COCCOC[C@@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450692093	DC	On-Demand	Anodyne	ABCB1	49	39
COCCOC[C@@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450692093	DC	On-Demand	Anodyne	HSP90AB1	44	50
COCCOC[C@@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450692093	DC	On-Demand	Anodyne	SLC27A1	43	42
COCCOC[C@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450692094	DC	On-Demand	Anodyne	ABCB1	49	39
COCCOC[C@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450692094	DC	On-Demand	Anodyne	HSP90AB1	44	50
COCCOC[C@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450692094	DC	On-Demand	Anodyne	SLC27A1	43	42
CCOc1cc(C(=O)NCC2(CC(=O)OC)CCCCC2)on1	ZINC000450692121	DE	On-Demand	Anodyne	HCN4	44	33
COc1cccc([C@@H]2C[C@H]2C(=O)NCc2nnnn2CC2CC2)c1	ZINC000450692149	ED	On-Demand	Anodyne	MTNR1B	15	40
O=C(C1=C(c2ccccc2)CCC1)N1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000450692152	GJ	On-Demand	Anodyne	SFRP1	53	34
O=C(C1=C(c2ccccc2)CCC1)N1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000450692152	GJ	On-Demand	Anodyne	L3MBTL3	46	34
COC(=O)CC1(CNC(=O)Cc2ccc(C(=O)OC)cc2)CCCCC1	ZINC000450692195	FF	On-Demand	Anodyne	NPFFR1	20	40
CO[C@H]1COCC[C@@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692203	FE	On-Demand	Anodyne	ACACB	25	40
CO[C@H]1COCC[C@@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692203	FE	On-Demand	Anodyne	TNKS	45	31
CO[C@H]1COCC[C@@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692203	FE	On-Demand	Anodyne	VCP	42	33
CO[C@@H]1COCC[C@@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692204	FE	On-Demand	Anodyne	ACACB	25	40
CO[C@@H]1COCC[C@@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692204	FE	On-Demand	Anodyne	TNKS	45	31
CO[C@@H]1COCC[C@@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692204	FE	On-Demand	Anodyne	VCP	42	33
CCC(=O)CCCN1CCC2(CC1)OCCc1ccsc12	ZINC000450692213	DG	On-Demand	Anodyne	OPRL1	49	39
CCC(=O)CCCN1CCC2(CC1)OCCc1ccsc12	ZINC000450692213	DG	On-Demand	Anodyne	SIGMAR1	19	55
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450692218	FE	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450692218	FE	On-Demand	Anodyne	MTR1B_CHICK	0	44
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450692218	FE	On-Demand	Anodyne	MTNR1A	72	39
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450692218	FE	On-Demand	Anodyne	MTNR1B	62	37
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450692219	FE	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450692219	FE	On-Demand	Anodyne	MTR1B_CHICK	0	44
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450692219	FE	On-Demand	Anodyne	MTNR1A	72	39
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450692219	FE	On-Demand	Anodyne	MTNR1B	62	37
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450692220	FE	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450692220	FE	On-Demand	Anodyne	MTR1B_CHICK	0	44
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450692220	FE	On-Demand	Anodyne	MTNR1A	72	39
COc1ccc(CNC(=O)CCN(C)C[C@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450692220	FE	On-Demand	Anodyne	MTNR1B	62	37
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450692221	FE	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450692221	FE	On-Demand	Anodyne	MTR1B_CHICK	0	44
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450692221	FE	On-Demand	Anodyne	MTNR1A	72	39
COc1ccc(CNC(=O)CCN(C)C[C@@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450692221	FE	On-Demand	Anodyne	MTNR1B	62	37
COc1ccc(CN(Cc2ccc(C(C)=O)cc2)[C@H](CO)C(C)C)cc1	ZINC000450692248	FH	On-Demand	Anodyne	BMP1	23	41
COC(=O)c1csc(CN2CCC[C@@H](c3ccc(F)cc3)CC2)n1	ZINC000450692268	EH	On-Demand	Anodyne	CCR3	62	35
COC(=O)c1csc(CN2CCC[C@@H](c3ccc(F)cc3)CC2)n1	ZINC000450692268	EH	On-Demand	Anodyne	MCHR1	22	43
COC(=O)c1csc(CN2CCC[C@@H](c3ccc(F)cc3)CC2)n1	ZINC000450692268	EH	On-Demand	Anodyne	CARM1	45	33
COC(=O)c1csc(CN2CCC[C@H](c3ccc(F)cc3)CC2)n1	ZINC000450692269	EH	On-Demand	Anodyne	CCR3	62	35
COC(=O)c1csc(CN2CCC[C@H](c3ccc(F)cc3)CC2)n1	ZINC000450692269	EH	On-Demand	Anodyne	MCHR1	22	43
COC(=O)c1csc(CN2CCC[C@H](c3ccc(F)cc3)CC2)n1	ZINC000450692269	EH	On-Demand	Anodyne	CARM1	45	33
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	DRD2	20	40
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	DRD4	46	40
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	ACHE	22	41
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	DRD3	16	40
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	HTR4	24	40
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	SSTR5	61	39
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	CCR3	33	46
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	CXCR3	23	41
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	MCHR1	16	42
COc1cc(CN2CCC(N3CCS(=O)(=O)CC3)CC2)ccc1Cl	ZINC000450692270	FE	On-Demand	Anodyne	CCR8	18	40
CC(C)Oc1cc(F)ccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450692285	EI	On-Demand	Anodyne	ADRA1D	32	45
CC(C)Oc1cc(F)ccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450692285	EI	On-Demand	Anodyne	ADRA1A	28	45
CC(C)Oc1cc(F)ccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450692285	EI	On-Demand	Anodyne	ADRA1B	22	45
CC(C)Oc1cc(F)ccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450692286	EI	On-Demand	Anodyne	ADRA1D	32	45
CC(C)Oc1cc(F)ccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450692286	EI	On-Demand	Anodyne	ADRA1A	28	45
CC(C)Oc1cc(F)ccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450692286	EI	On-Demand	Anodyne	ADRA1B	22	45
COCCOC[C@H](O)CN1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000450692288	FD	On-Demand	Anodyne	CTSS	42	33
COCCOC[C@@H](O)CN1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000450692289	FD	On-Demand	Anodyne	CTSS	42	33
COc1cc(CC(=O)Nc2ccc(F)cc2OC(C)C)ccc1Cl	ZINC000450692294	FI	On-Demand	Anodyne	P2RX7	22	41
COc1cc2c(N[C@@H](C)CC(C)(C)O)ccnc2cc1F	ZINC000450692357	CG	On-Demand	Anodyne	PDGFRA	45	36
COc1cc2c(N[C@H](C)CC(C)(C)O)ccnc2cc1F	ZINC000450692359	CG	On-Demand	Anodyne	PDGFRA	45	36
COC(=O)c1cccc(CN2CCN(c3ccc(F)cn3)CC2)c1Cl	ZINC000450692360	FF	On-Demand	Anodyne	SLC27A1	43	41
O=C(c1cncc(Cl)c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450692361	FI	On-Demand	Anodyne	GRIN2B	48	43
O=C(c1cncc(Cl)c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450692361	FI	On-Demand	Anodyne	CCR3	39	43
CO[C@@H]1COCC[C@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692362	FE	On-Demand	Anodyne	ACACB	25	40
CO[C@@H]1COCC[C@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692362	FE	On-Demand	Anodyne	TNKS	45	31
CO[C@@H]1COCC[C@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692362	FE	On-Demand	Anodyne	VCP	42	33
CO[C@H]1COCC[C@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692363	FE	On-Demand	Anodyne	ACACB	25	40
CO[C@H]1COCC[C@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692363	FE	On-Demand	Anodyne	TNKS	45	31
CO[C@H]1COCC[C@H]1CNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450692363	FE	On-Demand	Anodyne	VCP	42	33
Fc1ccc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)nc1	ZINC000450692373	FF	On-Demand	Anodyne	DRD4	32	44
Cc1ccn2ncc(C(=O)N[C@H](C)CCC3CC3)c2c1	ZINC000450692375	CF	On-Demand	Anodyne	EPHB3	35	50
Cc1ccn2ncc(C(=O)N[C@@H](C)CCC3CC3)c2c1	ZINC000450692379	CF	On-Demand	Anodyne	EPHB3	35	50
O=C(c1cnc(C2CC2)nc1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450692389	FH	On-Demand	Anodyne	GRIN2B	37	41
O=C(c1cnc(C2CC2)nc1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450692389	FH	On-Demand	Anodyne	CCR3	35	48
CC(C)CCCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450692437	CI	On-Demand	Anodyne	CCR1	39	41
CC(C)CCCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450692437	CI	On-Demand	Anodyne	ETHR	49	40
CC(C)CCCC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450692438	CI	On-Demand	Anodyne	CCR1	39	41
CC(C)CCCC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450692438	CI	On-Demand	Anodyne	ETHR	49	40
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	CA2	22	45
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	BMP1	25	42
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	CA1	20	41
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	CA4	31	41
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	MMP2	23	41
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	MMP3	20	45
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	MMP8	28	41
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	MMP9	27	41
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	MMP1	26	41
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	LIMK2	46	41
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)CC(=O)OC)cc1	ZINC000450692482	GF	On-Demand	Anodyne	RORC	60	56
COc1cc2c(cc1F)CN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450692514	EG	On-Demand	Anodyne	ABCB1B	61	39
COc1cc2c(cc1F)CN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450692514	EG	On-Demand	Anodyne	ABCB1	27	44
CCc1cccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450692515	EI	On-Demand	Anodyne	CHRM2	15	40
CCc1cccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450692515	EI	On-Demand	Anodyne	GRIN2B	55	43
CCc1cccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450692515	EI	On-Demand	Anodyne	CCR3	56	42
N#CC1(CN2CCN(c3ccc(F)cn3)CC2)CCC1	ZINC000450692517	CE	On-Demand	Mild	SLC27A1	26	42
COC(=O)C[C@H](NC(=O)CC[C@@H]1CCC(=O)N1)c1ccc(-c2ccccc2)cc1	ZINC000450692518	GG	On-Demand	Anodyne	UTS2	42	35
COc1cc2c(cc1F)CN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450692519	EG	On-Demand	Anodyne	ABCB1B	61	39
COc1cc2c(cc1F)CN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450692519	EG	On-Demand	Anodyne	ABCB1	27	44
COC(=O)C[C@H](NC(=O)CC[C@H]1CCC(=O)N1)c1ccc(-c2ccccc2)cc1	ZINC000450692521	GG	On-Demand	Anodyne	UTS2	42	35
COC(=O)C[C@@H](NC(=O)CC[C@@H]1CCC(=O)N1)c1ccc(-c2ccccc2)cc1	ZINC000450692522	GG	On-Demand	Anodyne	UTS2	42	35
COC(=O)C[C@@H](NC(=O)CC[C@H]1CCC(=O)N1)c1ccc(-c2ccccc2)cc1	ZINC000450692524	GG	On-Demand	Anodyne	UTS2	42	35
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450692564	FG	On-Demand	Anodyne	HRP1_PLAFA	81	34
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450692564	FG	On-Demand	Anodyne	HNMT	46	32
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450692565	FG	On-Demand	Anodyne	HRP1_PLAFA	81	34
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450692565	FG	On-Demand	Anodyne	HNMT	46	32
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450692566	FG	On-Demand	Anodyne	HRP1_PLAFA	81	34
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450692566	FG	On-Demand	Anodyne	HNMT	46	32
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450692567	FG	On-Demand	Anodyne	HRP1_PLAFA	81	34
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(Br)ccc12	ZINC000450692567	FG	On-Demand	Anodyne	HNMT	46	32
CCOC(=O)c1cc(C(=O)NCC2(CC(=O)OC)CCCCC2)on1	ZINC000450692568	FE	On-Demand	Anodyne	HCN1	54	33
CCOC(=O)c1cc(C(=O)NCC2(CC(=O)OC)CCCCC2)on1	ZINC000450692568	FE	On-Demand	Anodyne	HCN4	51	33
COc1cc(CN2CCC(C)(OC)CC2)ccc1Cl	ZINC000450692576	CG	On-Demand	Anodyne	SIGMAR1	33	42
COc1cc(CN2CCC(C)(OC)CC2)ccc1Cl	ZINC000450692576	CG	On-Demand	Anodyne	SSTR5	42	38
CC(C)(C)c1cc(N2CC(=O)N(CCC(F)(F)F)C2)nc(C(C)(C)C)n1	ZINC000450692613	FH	On-Demand	Anodyne	DRD3	18	45
CSc1cccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450692614	EH	On-Demand	Anodyne	UTS2	43	39
CSc1cccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450692614	EH	On-Demand	Anodyne	KCNK3	43	34
CSc1cccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450692615	EH	On-Demand	Anodyne	UTS2	43	39
CSc1cccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450692615	EH	On-Demand	Anodyne	KCNK3	43	34
CSc1cccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450692616	EH	On-Demand	Anodyne	UTS2	43	39
CSc1cccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450692616	EH	On-Demand	Anodyne	KCNK3	43	34
CSc1cccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450692617	EH	On-Demand	Anodyne	UTS2	43	39
CSc1cccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450692617	EH	On-Demand	Anodyne	KCNK3	43	34
CC(=O)CCCCCOc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000450692618	CH	On-Demand	Bother	ENR	0	40
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCCC(F)(F)C1	ZINC000450692626	FH	On-Demand	Anodyne	GSK3A	29	48
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCCC(F)(F)C1	ZINC000450692627	FH	On-Demand	Anodyne	GSK3A	29	48
CCc1nc(C)c(COc2ccc(Cl)cc2[N+](=O)[O-])o1	ZINC000450692629	CH	On-Demand	Bother	S1PR4	24	46
COc1cc(CN2CCC3(CC2)OCCc2ccsc23)ccc1Cl	ZINC000450692630	FI	On-Demand	Anodyne	OPRL1	52	42
COc1cc(CN2CCC3(CC2)OCCc2ccsc23)ccc1Cl	ZINC000450692630	FI	On-Demand	Anodyne	SIGMAR1	38	65
COc1cc(CN2CCC3(CC2)OCCc2ccsc23)ccc1Cl	ZINC000450692630	FI	On-Demand	Anodyne	SSTR5	43	36
COC(=O)CCCCC(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450692635	FF	On-Demand	Anodyne	GYRB	30	40
Cc1cnc([C@@H](C)NC(=O)Cc2sccc2Br)o1	ZINC000450692652	EG	On-Demand	Anodyne	UL26	90	40
Cc1cnc([C@@H](C)NC(=O)Cc2sccc2Br)o1	ZINC000450692652	EG	On-Demand	Anodyne	U53	0	40
Cc1cnc([C@@H](C)NC(=O)Cc2sccc2Br)o1	ZINC000450692652	EG	On-Demand	Anodyne	SCAF_EBVB9	75	37
Cc1cnc([C@H](C)NC(=O)Cc2sccc2Br)o1	ZINC000450692654	EG	On-Demand	Anodyne	UL26	90	40
Cc1cnc([C@H](C)NC(=O)Cc2sccc2Br)o1	ZINC000450692654	EG	On-Demand	Anodyne	U53	0	40
Cc1cnc([C@H](C)NC(=O)Cc2sccc2Br)o1	ZINC000450692654	EG	On-Demand	Anodyne	SCAF_EBVB9	75	37
CO[C@H]1COCC[C@H]1CNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450692656	DD	On-Demand	Bother	TAAR1	16	40
CO[C@@H]1COCC[C@H]1CNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450692658	DD	On-Demand	Bother	TAAR1	16	40
CO[C@H]1COCC[C@@H]1CNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450692660	DD	On-Demand	Bother	TAAR1	16	40
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450692662	DD	On-Demand	Bother	TAAR1	16	40
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1[C@@H]2CCCO[C@@H]21	ZINC000450692669	EE	On-Demand	Anodyne	GSK3A	18	41
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1[C@H]2OCCC[C@@H]21	ZINC000450692670	EE	On-Demand	Anodyne	GSK3A	18	41
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1[C@H]2CCCO[C@H]21	ZINC000450692671	EE	On-Demand	Anodyne	GSK3A	18	41
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1[C@@H]2CCCO[C@H]21	ZINC000450692672	EE	On-Demand	Anodyne	GSK3A	18	41
CO[C@@H]1COCC[C@@H]1CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450692674	DG	On-Demand	Mild	AR	42	38
CO[C@H]1COCC[C@H]1CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450692675	DG	On-Demand	Mild	AR	42	38
CO[C@H]1COCC[C@@H]1CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450692676	DG	On-Demand	Mild	AR	42	38
CO[C@@H]1COCC[C@H]1CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450692677	DG	On-Demand	Mild	AR	42	38
CC[C@@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450692700	FE	On-Demand	Anodyne	GSK3A	26	47
CC[C@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450692701	FE	On-Demand	Anodyne	GSK3A	26	47
CC[C@@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450692702	FE	On-Demand	Anodyne	GSK3A	26	47
CC[C@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450692703	FE	On-Demand	Anodyne	GSK3A	26	47
COc1ccc(CNC(=O)CCN(C)Cc2noc(C)n2)c(OC)c1	ZINC000450692705	ED	On-Demand	Anodyne	PDGFRB	25	41
COc1cccc(OCCC(=O)N2CCC3(CC2)OCCc2ccsc23)c1	ZINC000450692710	GH	On-Demand	Anodyne	OPRL1	46	35
COC(=O)C[C@H](NC(=O)Cc1cn(C)nc1C)c1ccc(-c2ccccc2)cc1	ZINC000450692730	GG	On-Demand	Anodyne	UTS2	45	35
COC(=O)C[C@@H](NC(=O)Cc1cn(C)nc1C)c1ccc(-c2ccccc2)cc1	ZINC000450692734	GG	On-Demand	Anodyne	UTS2	45	35
COCCOC[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450692746	ED	On-Demand	Anodyne	OPRL1	50	41
COCCOC[C@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450692747	ED	On-Demand	Anodyne	OPRL1	50	41
NC(=O)[C@H]1CC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)O1	ZINC000450692748	FC	On-Demand	Anodyne	GSK3A	16	44
NC(=O)[C@@H]1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)O1	ZINC000450692753	FC	On-Demand	Anodyne	GSK3A	16	44
NC(=O)[C@@H]1CC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)O1	ZINC000450692755	FC	On-Demand	Anodyne	GSK3A	16	44
CN(CCN1CCC(F)(F)C1)Cc1ccccc1	ZINC000450692756	CE	On-Demand	Anodyne	SIGMAR1	46	47
NC(=O)[C@H]1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)O1	ZINC000450692758	FC	On-Demand	Anodyne	GSK3A	16	44
CC(C)(C)Oc1ccc(CNC(=O)c2ccc(N3CCC3)nc2)cn1	ZINC000450692766	EF	On-Demand	Anodyne	HDAC1	27	40
CC/C=C\CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450692768	BG	On-Demand	Bother	TAAR1	16	46
CC/C=C/CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450692769	BG	On-Demand	Bother	TAAR1	16	46
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450692784	FE	On-Demand	Anodyne	AVPR2	66	39
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450692785	FE	On-Demand	Anodyne	AVPR2	66	39
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450692786	FE	On-Demand	Anodyne	AVPR2	66	39
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450692787	FE	On-Demand	Anodyne	AVPR2	66	39
COc1cc2c(cc1F)CN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450692797	EG	On-Demand	Anodyne	ABCB1B	61	39
COc1cc2c(cc1F)CN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450692797	EG	On-Demand	Anodyne	ABCB1	27	44
COc1cc2c(cc1F)CN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450692798	EG	On-Demand	Anodyne	ABCB1B	61	39
COc1cc2c(cc1F)CN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450692798	EG	On-Demand	Anodyne	ABCB1	27	44
C=C(C)CN(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450692803	CE	On-Demand	Mild	RORC	20	40
O=C1CN(c2ncnc3scc(-c4ccccc4)c23)CN1CCC(F)(F)F	ZINC000450692814	GH	On-Demand	Anodyne	ADRB3	29	43
COc1ccc(-c2n[nH]c(S[C@H]3CC[C@H](C#N)C3)n2)cc1	ZINC000450692823	DG	On-Demand	Mild	GCN5	0	44
COc1ccc(-c2n[nH]c(S[C@H]3CC[C@H](C#N)C3)n2)cc1	ZINC000450692823	DG	On-Demand	Mild	RTT109	0	45
COc1ccc(-c2n[nH]c(S[C@@H]3CC[C@H](C#N)C3)n2)cc1	ZINC000450692824	DG	On-Demand	Mild	GCN5	0	44
COc1ccc(-c2n[nH]c(S[C@@H]3CC[C@H](C#N)C3)n2)cc1	ZINC000450692824	DG	On-Demand	Mild	RTT109	0	45
COc1ccc(-c2n[nH]c(S[C@H]3CC[C@@H](C#N)C3)n2)cc1	ZINC000450692825	DG	On-Demand	Mild	GCN5	0	44
COc1ccc(-c2n[nH]c(S[C@H]3CC[C@@H](C#N)C3)n2)cc1	ZINC000450692825	DG	On-Demand	Mild	RTT109	0	45
COc1ccc(-c2n[nH]c(S[C@@H]3CC[C@@H](C#N)C3)n2)cc1	ZINC000450692826	DG	On-Demand	Mild	GCN5	0	44
COc1ccc(-c2n[nH]c(S[C@@H]3CC[C@@H](C#N)C3)n2)cc1	ZINC000450692826	DG	On-Demand	Mild	RTT109	0	45
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450692831	EH	On-Demand	Anodyne	HRP1_PLAFA	69	33
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450692831	EH	On-Demand	Anodyne	HNMT	40	31
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450692832	EH	On-Demand	Anodyne	HRP1_PLAFA	69	33
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450692832	EH	On-Demand	Anodyne	HNMT	40	31
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450692833	EH	On-Demand	Anodyne	HRP1_PLAFA	69	33
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450692833	EH	On-Demand	Anodyne	HNMT	40	31
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450692834	EH	On-Demand	Anodyne	HRP1_PLAFA	69	33
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(C(F)(F)F)ccc12	ZINC000450692834	EH	On-Demand	Anodyne	HNMT	40	31
COc1cccc(Oc2ccc(C(=O)N(C)CCN(C)C3CC3)nc2)c1	ZINC000450692848	FG	On-Demand	Anodyne	GPBAR1	44	35
COC(=O)c1cnc(NC[C@H]2CCOC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450692863	ED	On-Demand	Bother	PRKCQ	40	33
COC(=O)c1cnc(NC[C@@H]2CCOC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000450692864	ED	On-Demand	Bother	PRKCQ	40	33
COC(=O)c1cnc(NC[C@@H]2CCOC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450692865	ED	On-Demand	Bother	PRKCQ	40	33
COC(=O)c1cnc(NC[C@H]2CCOC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000450692866	ED	On-Demand	Bother	PRKCQ	40	33
COC(=O)[C@@H]1C[C@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692878	DF	On-Demand	Anodyne	SLC6A1	71	46
COC(=O)[C@@H]1C[C@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692878	DF	On-Demand	Anodyne	SLC6A3	28	40
COC(=O)[C@@H]1C[C@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692878	DF	On-Demand	Anodyne	HRH3	0	40
CCCc1nc(C)c(CSc2nnc(-c3ccc(OC)cc3)n2C)o1	ZINC000450692890	FI	On-Demand	Anodyne	AXIN2	0	41
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692891	DF	On-Demand	Anodyne	SLC6A1	71	46
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692891	DF	On-Demand	Anodyne	SLC6A3	28	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692891	DF	On-Demand	Anodyne	HRH3	0	40
COC(=O)[C@H]1C[C@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692893	DF	On-Demand	Anodyne	SLC6A1	71	46
COC(=O)[C@H]1C[C@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692893	DF	On-Demand	Anodyne	SLC6A3	28	40
COC(=O)[C@H]1C[C@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692893	DF	On-Demand	Anodyne	HRH3	0	40
CCc1cc(CCCSc2nnc(-c3cccc(C)c3)n2C)on1	ZINC000450692898	EI	On-Demand	Anodyne	DRD3	39	43
CCc1cc(CCCSc2nnc(-c3cccc(C)c3)n2C)on1	ZINC000450692898	EI	On-Demand	Anodyne	KCNH2	32	43
COc1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)cc1	ZINC000450692899	GI	On-Demand	Anodyne	HCRTR2	19	47
COC(=O)[C@H]1C[C@@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692900	DF	On-Demand	Anodyne	SLC6A1	71	46
COC(=O)[C@H]1C[C@@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692900	DF	On-Demand	Anodyne	SLC6A3	28	40
COC(=O)[C@H]1C[C@@H](OC)CCN1CCc1ccc(Cl)cc1	ZINC000450692900	DF	On-Demand	Anodyne	HRH3	0	40
COc1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)cc1	ZINC000450692902	GI	On-Demand	Anodyne	HCRTR2	19	47
Cc1cnc(CCCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)o1	ZINC000450692919	EH	On-Demand	Anodyne	ETHR	47	34
Cc1cnc(CCCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)o1	ZINC000450692920	EH	On-Demand	Anodyne	ETHR	47	34
CCc1cc(CCCN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)on1	ZINC000450692923	FH	On-Demand	Anodyne	AKT2	51	33
CCc1cc(CCCN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)on1	ZINC000450692925	FH	On-Demand	Anodyne	AKT2	51	33
O=C(N1CCC[C@H](c2ccc(F)cc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450692927	GJ	On-Demand	Anodyne	CCR1	17	41
O=C(N1CCC[C@H](c2ccc(F)cc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450692927	GJ	On-Demand	Anodyne	SLC12A5	43	38
O=C(N1CCC[C@@H](c2ccc(F)cc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450692933	GJ	On-Demand	Anodyne	CCR1	17	41
O=C(N1CCC[C@@H](c2ccc(F)cc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450692933	GJ	On-Demand	Anodyne	SLC12A5	43	38
CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)[nH]c1C	ZINC000450692947	FG	On-Demand	Anodyne	TPSAB1	27	40
CCOC(=O)c1cc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)[nH]c1C	ZINC000450692948	FG	On-Demand	Anodyne	TPSAB1	27	40
C[C@@H](CCC1CC1)NC(=O)c1ccn(CCc2ccccc2)n1	ZINC000450692974	DG	On-Demand	Anodyne	SLC18A2	40	37
C[C@@H](CCC1CC1)NC(=O)c1ccn(CCc2ccccc2)n1	ZINC000450692974	DG	On-Demand	Anodyne	BIRC2	40	38
C[C@H](CCC1CC1)NC(=O)c1ccn(CCc2ccccc2)n1	ZINC000450692975	DG	On-Demand	Anodyne	SLC18A2	40	37
C[C@H](CCC1CC1)NC(=O)c1ccn(CCc2ccccc2)n1	ZINC000450692975	DG	On-Demand	Anodyne	BIRC2	40	38
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	HTR1A	79	63
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	DRD2	69	72
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	DRD1	40	54
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	DRD4	64	54
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	ADRA1D	27	46
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	HTR2A	57	63
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	HTR2C	40	56
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	DRD3	59	72
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	HTR3A	33	41
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	DRD5	33	44
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	SIGMAR1	26	59
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	ABCB1	22	46
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	CYP2J2	57	40
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	SMO	0	40
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	NET	0	50
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	AP2S1	0	46
O=C(CCCN1CCN(c2ccc(F)cn2)CC1)c1ccccc1	ZINC000450693001	EG	On-Demand	Anodyne	SLC27A1	54	48
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	DRD2	24	42
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	DRD4	54	43
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	ACHE	39	44
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	HRH2	50	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	DRD3	29	42
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	OPRD1	15	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	HRH3	17	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	SIGMAR1	51	53
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	MMP13	22	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	BCHE	17	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	CCR3	33	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	CCR5	32	43
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	PLA2G2A	40	35
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	SLC18A3	16	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	MTNR1A	26	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	MTNR1B	36	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	GHSR	17	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	MCHR1	36	46
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	CCR8	27	42
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	NPFFR1	15	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693019	GG	On-Demand	Anodyne	PDS	60	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	DRD2	24	42
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	DRD4	54	43
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	ACHE	39	44
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	HRH2	50	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	DRD3	29	42
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	OPRD1	15	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	HRH3	17	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	SIGMAR1	51	53
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	MMP13	22	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	BCHE	17	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	CCR3	33	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	CCR5	32	43
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	PLA2G2A	40	35
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	SLC18A3	16	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	MTNR1A	26	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	MTNR1B	36	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	GHSR	17	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	MCHR1	36	46
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	CCR8	27	42
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	NPFFR1	15	40
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693020	GG	On-Demand	Anodyne	PDS	60	40
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	DRD2	24	42
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	DRD4	54	43
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	ACHE	39	44
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	HRH2	50	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	DRD3	29	42
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	OPRD1	15	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	HRH3	17	40
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	SIGMAR1	51	53
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	MMP13	22	40
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	BCHE	17	40
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	CCR3	33	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	CCR5	32	43
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	PLA2G2A	40	35
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	SLC18A3	16	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	MTNR1A	26	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	MTNR1B	36	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	GHSR	17	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	MCHR1	36	46
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	CCR8	27	42
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	NPFFR1	15	40
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693021	GG	On-Demand	Anodyne	PDS	60	40
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	DRD2	24	42
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	DRD4	54	43
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	ACHE	39	44
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	HRH2	50	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	DRD3	29	42
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	OPRD1	15	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	HRH3	17	40
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	SIGMAR1	51	53
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	MMP13	22	40
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	BCHE	17	40
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	CCR3	33	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	CCR5	32	43
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	PLA2G2A	40	35
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	SLC18A3	16	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	MTNR1A	26	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	MTNR1B	36	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	GHSR	17	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	MCHR1	36	46
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	CCR8	27	42
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	NPFFR1	15	40
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450693022	GG	On-Demand	Anodyne	PDS	60	40
CCc1cnccc1CNC(=O)CCOc1cccc(OC)c1	ZINC000450693033	DF	On-Demand	Anodyne	TRPV1	0	41
CCc1cnccc1CNC(=O)CCOc1cccc(OC)c1	ZINC000450693033	DF	On-Demand	Anodyne	MTNR1A	73	46
CCc1cnccc1CNC(=O)CCOc1cccc(OC)c1	ZINC000450693033	DF	On-Demand	Anodyne	MTNR1B	58	46
CCC[C@H]1CN(CC[C@@H](C)O)CCN1Cc1ccccc1	ZINC000450693045	CF	On-Demand	Anodyne	SIGMAR1	30	50
CCC[C@@H]1CN(CC[C@H](C)O)CCN1Cc1ccccc1	ZINC000450693046	CF	On-Demand	Anodyne	SIGMAR1	30	50
CCC[C@@H]1CN(CC[C@@H](C)O)CCN1Cc1ccccc1	ZINC000450693047	CF	On-Demand	Anodyne	SIGMAR1	30	50
CCC[C@H]1CN(CC[C@H](C)O)CCN1Cc1ccccc1	ZINC000450693048	CF	On-Demand	Anodyne	SIGMAR1	30	50
CC/C=C\CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450693049	DF	On-Demand	Anodyne	LRRK2	28	42
CC/C=C/CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450693050	DF	On-Demand	Anodyne	LRRK2	28	42
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450693057	FE	On-Demand	Bother	TAAR1	19	41
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450693058	FE	On-Demand	Bother	TAAR1	19	41
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450693059	FE	On-Demand	Bother	TAAR1	19	41
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450693060	FE	On-Demand	Bother	TAAR1	19	41
CO[C@H]1COCC[C@H]1CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450693074	FE	On-Demand	Anodyne	ROS1	53	34
CO[C@@H]1COCC[C@@H]1CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450693075	FE	On-Demand	Anodyne	ROS1	53	34
CO[C@@H]1COCC[C@H]1CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450693076	FE	On-Demand	Anodyne	ROS1	53	34
CO[C@H]1COCC[C@@H]1CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450693077	FE	On-Demand	Anodyne	ROS1	53	34
CCOC(=O)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(O)c1	ZINC000450693116	GF	On-Demand	Anodyne	RORC	40	36
CCOC(=O)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)c1cccc(O)c1	ZINC000450693117	GF	On-Demand	Anodyne	RORC	40	36
COc1cccc(-c2nnn(C[C@H](Cc3ccccc3)OC)n2)c1	ZINC000450693130	DF	On-Demand	Anodyne	SCARB1	22	43
COc1cccc(-c2nnn(C[C@@H](Cc3ccccc3)OC)n2)c1	ZINC000450693131	DF	On-Demand	Anodyne	SCARB1	22	43
C[C@@H](NCC1(C#N)CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693133	CG	On-Demand	Mild	SIGMAR1	40	36
C[C@@H](NCC1(C#N)CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693133	CG	On-Demand	Mild	NPFFR1	42	32
C[C@H](NCC1(C#N)CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693134	CG	On-Demand	Mild	SIGMAR1	40	36
C[C@H](NCC1(C#N)CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693134	CG	On-Demand	Mild	NPFFR1	42	32
C[C@@H](NCC1(C#N)CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693135	CG	On-Demand	Mild	SIGMAR1	40	36
C[C@@H](NCC1(C#N)CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693135	CG	On-Demand	Mild	NPFFR1	42	32
C[C@H](NCC1(C#N)CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693136	CG	On-Demand	Mild	SIGMAR1	40	36
C[C@H](NCC1(C#N)CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693136	CG	On-Demand	Mild	NPFFR1	42	32
COc1cccc(-c2nnn(CC3(C#N)CCC3)n2)c1	ZINC000450693137	CE	On-Demand	Mild	SCARB1	19	42
COc1cccc(-c2nnn(CC[C@@H](C)O)n2)c1	ZINC000450693139	BD	On-Demand	Anodyne	SCARB1	27	48
COc1cccc(-c2nnn(CC[C@H](C)O)n2)c1	ZINC000450693140	BD	On-Demand	Anodyne	SCARB1	27	48
CCCCCOCC(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450693142	EF	On-Demand	Anodyne	GSK3A	18	41
COc1cccc(-c2nnn(C[C@H]3CCCCC3(F)F)n2)c1	ZINC000450693144	DG	On-Demand	Anodyne	SCARB1	47	49
COc1cccc(-c2nnn(C[C@@H]3CCCCC3(F)F)n2)c1	ZINC000450693145	DG	On-Demand	Anodyne	SCARB1	47	49
c1cc2c(s1)C1(CCN(Cc3cn(CC4CC4)nn3)CC1)OCC2	ZINC000450693159	EF	On-Demand	Anodyne	OPRL1	42	39
CN1C(=O)CC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450693168	ED	On-Demand	Anodyne	GSK3A	24	42
CN1C(=O)CC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450693169	ED	On-Demand	Anodyne	GSK3A	24	42
CC(C)c1nccc(N2CC(C(=O)OC(C)(C)C)C2)n1	ZINC000450693170	CE	On-Demand	Anodyne	SORD	70	39
COC(=O)[C@@H]1CCC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450693185	GF	On-Demand	Anodyne	GSK3A	25	46
COC(=O)[C@H]1CCC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450693186	GF	On-Demand	Anodyne	GSK3A	25	46
COC(=O)[C@H]1CCC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450693187	GF	On-Demand	Anodyne	GSK3A	25	46
COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450693188	GF	On-Demand	Anodyne	GSK3A	25	46
COCCCOCC(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450693198	ED	On-Demand	Anodyne	CAN2	0	40
O=C1CC[C@H](CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)CCN1	ZINC000450693209	FF	On-Demand	Anodyne	AKT2	49	38
O=C1CC[C@@H](CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)CCN1	ZINC000450693210	FF	On-Demand	Anodyne	AKT2	49	38
O=C1CC[C@H](CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)CCN1	ZINC000450693211	FF	On-Demand	Anodyne	AKT2	49	38
O=C1CC[C@@H](CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)CCN1	ZINC000450693212	FF	On-Demand	Anodyne	AKT2	49	38
COc1ncc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)cc1Cl	ZINC000450693215	GD	On-Demand	Anodyne	NPY2R	60	39
C[C@H](O)CCN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450693223	DE	On-Demand	Anodyne	AKT2	41	35
C[C@@H](O)CCN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450693224	DE	On-Demand	Anodyne	AKT2	41	35
C[C@@H](O)CCN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450693225	DE	On-Demand	Anodyne	AKT2	41	35
C[C@H](O)CCN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450693226	DE	On-Demand	Anodyne	AKT2	41	35
O=C1CN(c2ncnc3sc4c(c23)CCCC4)CN1CCC(F)(F)F	ZINC000450693232	FG	On-Demand	Anodyne	RBP4	19	45
CN(CCN(C)C1CC1)C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450693242	FE	On-Demand	Mild	SHC	31	42
CN(CCN(C)C1CC1)C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450693242	FE	On-Demand	Mild	LSS	22	42
CCC[C@H](O)CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450693243	DF	On-Demand	Anodyne	AKT2	51	33
CCC[C@H](O)CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450693244	DF	On-Demand	Anodyne	AKT2	51	33
CCC[C@@H](O)CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450693245	DF	On-Demand	Anodyne	AKT2	51	33
CCC[C@@H](O)CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450693246	DF	On-Demand	Anodyne	AKT2	51	33
COC(=O)c1ccc(CN(C)[C@H](C)c2cnn(C)c2)cc1Cl	ZINC000450693248	DG	On-Demand	Anodyne	SLC6A9	40	32
COC(=O)c1ccc(CN(C)[C@@H](C)c2cnn(C)c2)cc1Cl	ZINC000450693250	DG	On-Demand	Anodyne	SLC6A9	40	32
CCCCN(CCCO)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450693286	DE	On-Demand	Anodyne	PLM2_PLAFA	49	36
CCCCN(CCCO)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450693286	DE	On-Demand	Anodyne	RORC	18	49
COC[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(=O)OC	ZINC000450693292	FD	On-Demand	Bother	CCR3	0	40
COC[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(=O)OC	ZINC000450693292	FD	On-Demand	Bother	PPXII	0	41
COC[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(=O)OC	ZINC000450693298	FD	On-Demand	Bother	CCR3	0	40
COC[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(=O)OC	ZINC000450693298	FD	On-Demand	Bother	PPXII	0	41
C[C@H](CCC1CC1)NC(=O)c1cncc(Cl)c1	ZINC000450693301	CG	On-Demand	Anodyne	CACNA1I	45	37
C[C@@H](CCC1CC1)NC(=O)c1cncc(Cl)c1	ZINC000450693302	CG	On-Demand	Anodyne	CACNA1I	45	37
O=C(c1cnc(C2CC2)nc1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450693306	EG	On-Demand	Anodyne	L3MBTL3	51	38
O=C(c1cnc(C2CC2)nc1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450693307	EG	On-Demand	Anodyne	L3MBTL3	51	38
C[C@H](CN1CCN(c2ccc(F)cn2)CC1)S(C)(=O)=O	ZINC000450693308	DC	On-Demand	Anodyne	SLC27A1	46	48
C[C@@H](CN1CCN(c2ccc(F)cn2)CC1)S(C)(=O)=O	ZINC000450693309	DC	On-Demand	Anodyne	SLC27A1	46	48
CCC(CC)Oc1ccc(C(=O)N(C)CCN(C)C2CC2)cc1	ZINC000450693316	DG	On-Demand	Anodyne	LSS	24	42
COC(=O)CN(CCc1ccccc1)Cc1nc(C(=O)OC)co1	ZINC000450693319	ED	On-Demand	Anodyne	FAAH	16	49
CC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)cc1	ZINC000450693322	GI	On-Demand	Anodyne	OPRM1	20	49
CC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)cc1	ZINC000450693322	GI	On-Demand	Anodyne	OPRD1	25	49
CC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)cc1	ZINC000450693322	GI	On-Demand	Anodyne	KCNH2	37	43
CC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)cc1	ZINC000450693322	GI	On-Demand	Anodyne	LTA4H	20	46
CC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)cc1	ZINC000450693322	GI	On-Demand	Anodyne	CCR3	23	44
CC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)cc1	ZINC000450693322	GI	On-Demand	Anodyne	ACHP_LYMST	24	42
CC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)cc1	ZINC000450693322	GI	On-Demand	Anodyne	MBTPS1	40	35
CC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)cc1	ZINC000450693322	GI	On-Demand	Anodyne	Q8WSF8_APLCA	47	42
C[C@H](CCC1CC1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450693328	CF	On-Demand	Anodyne	MMP13	0	48
C[C@@H](CCC1CC1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450693329	CF	On-Demand	Anodyne	MMP13	0	48
CN(CCN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)CC(F)F	ZINC000450693336	FG	On-Demand	Anodyne	RBP4	69	38
COc1ncc(Cl)c(NCc2cnc(OC)c(Cl)c2)n1	ZINC000450693343	DE	On-Demand	Anodyne	PDE5A	17	40
COC[C@@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OC	ZINC000450693361	ED	On-Demand	Anodyne	P2RY12	57	31
COC[C@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OC	ZINC000450693362	ED	On-Demand	Anodyne	P2RY12	57	31
COC(=O)C1(CN2CCN(c3ccc(F)cn3)CC2)CC1	ZINC000450693366	CD	On-Demand	Anodyne	DRD4	18	42
COC(=O)C1(CN2CCN(c3ccc(F)cn3)CC2)CC1	ZINC000450693366	CD	On-Demand	Anodyne	SLC27A1	64	45
COc1ccc2c(N[C@H](C)CC(C)(C)O)ncnc2c1F	ZINC000450693367	CF	On-Demand	Anodyne	PDE6A	40	32
COc1ccc2c(N[C@@H](C)CC(C)(C)O)ncnc2c1F	ZINC000450693368	CF	On-Demand	Anodyne	PDE6A	40	32
Cc1ccn2ncc(C(=O)N(C)CCN(C)CC(F)F)c2c1	ZINC000450693388	DD	On-Demand	Anodyne	EPHB3	19	42
COc1ccc(-c2nnc(SCCC(C)(F)F)n2C)cc1	ZINC000450693389	DH	On-Demand	Anodyne	DRD2	0	40
COc1ccc(-c2nnc(SCCC(C)(F)F)n2C)cc1	ZINC000450693389	DH	On-Demand	Anodyne	DRD3	24	46
COc1ccc(-c2nnc(SCCC(C)(F)F)n2C)cc1	ZINC000450693389	DH	On-Demand	Anodyne	KCNH2	22	46
CC(C)C[C@@H](C)N1CCN(c2ccc(F)cn2)CC1	ZINC000450693404	CF	On-Demand	Anodyne	SLC27A1	25	41
COc1ccc(CNC(=O)CCN2CCC(F)(F)C2)c(OC)c1	ZINC000450693442	EE	On-Demand	Anodyne	HTR7	27	41
COc1ccc(CNC(=O)CCN2CCC(F)(F)C2)c(OC)c1	ZINC000450693442	EE	On-Demand	Anodyne	MTNR1A	59	37
COc1ccc(CNC(=O)CCN2CCC(F)(F)C2)c(OC)c1	ZINC000450693442	EE	On-Demand	Anodyne	MTNR1B	39	41
CO[C@H]1COCC[C@@H]1CNc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl	ZINC000450693448	GF	On-Demand	Anodyne	MAPK14	15	41
CO[C@H]1COCC[C@H]1CNc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl	ZINC000450693449	GF	On-Demand	Anodyne	MAPK14	15	41
CO[C@@H]1COCC[C@@H]1CNc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl	ZINC000450693450	GF	On-Demand	Anodyne	MAPK14	15	41
CO[C@@H]1COCC[C@H]1CNc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl	ZINC000450693451	GF	On-Demand	Anodyne	MAPK14	15	41
COc1cccc(Oc2ccc(C(=O)NCc3nnnn3CC3CC3)nc2)c1	ZINC000450693458	GE	On-Demand	Anodyne	ROCK2	17	43
CC/C=C\CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450693464	EF	On-Demand	Bother	TBXA2R	26	40
CC/C=C/CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450693465	EF	On-Demand	Bother	TBXA2R	26	40
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	DRD2	15	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	DRD4	46	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	OPRM1	17	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	OPRK1	18	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	TACR2	58	34
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	SIGMAR1	47	45
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	TIMP3	40	33
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	MCHR1	15	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	BIRC2	35	44
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	NPFFR1	42	32
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	LOC100281352	0	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693477	EH	On-Demand	Anodyne	ZM.86993	0	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	DRD2	15	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	DRD4	46	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	OPRM1	17	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	OPRK1	18	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	TACR2	58	34
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	SIGMAR1	47	45
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	TIMP3	40	33
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	MCHR1	15	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	BIRC2	35	44
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	NPFFR1	42	32
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	LOC100281352	0	41
C[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693478	EH	On-Demand	Anodyne	ZM.86993	0	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	DRD2	15	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	DRD4	46	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	OPRM1	17	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	OPRK1	18	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	TACR2	58	34
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	SIGMAR1	47	45
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	TIMP3	40	33
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	MCHR1	15	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	BIRC2	35	44
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	NPFFR1	42	32
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	LOC100281352	0	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450693479	EH	On-Demand	Anodyne	ZM.86993	0	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	DRD2	15	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	DRD4	46	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	OPRM1	17	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	OPRK1	18	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	TACR2	58	34
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	SIGMAR1	47	45
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	TIMP3	40	33
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	MCHR1	15	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	BIRC2	35	44
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	NPFFR1	42	32
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	LOC100281352	0	41
C[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450693480	EH	On-Demand	Anodyne	ZM.86993	0	41
Cn1cc(-c2ccc(C(=O)NCc3nnnn3CC3CC3)o2)cn1	ZINC000450693484	ED	On-Demand	Anodyne	MMP13	0	41
CCC(CC)N1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1=O	ZINC000450693508	GF	On-Demand	Anodyne	GSK3A	19	44
CCC(CC)N1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1=O	ZINC000450693509	GF	On-Demand	Anodyne	GSK3A	19	44
COc1cc(CC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)ccc1Cl	ZINC000450693513	FH	On-Demand	Anodyne	OPRK1	24	43
COc1cc(CC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)ccc1Cl	ZINC000450693513	FH	On-Demand	Anodyne	PTGDR2	0	40
COc1cc(CC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)ccc1Cl	ZINC000450693514	FH	On-Demand	Anodyne	OPRK1	24	43
COc1cc(CC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)ccc1Cl	ZINC000450693514	FH	On-Demand	Anodyne	PTGDR2	0	40
COc1cc(CC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)ccc1Cl	ZINC000450693515	FH	On-Demand	Anodyne	OPRK1	24	43
COc1cc(CC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)ccc1Cl	ZINC000450693515	FH	On-Demand	Anodyne	PTGDR2	0	40
COc1cc(CC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ccc1Cl	ZINC000450693516	FH	On-Demand	Anodyne	OPRK1	24	43
COc1cc(CC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ccc1Cl	ZINC000450693516	FH	On-Demand	Anodyne	PTGDR2	0	40
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCC(F)(F)C1	ZINC000450693518	EG	On-Demand	Anodyne	GSK3A	29	50
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCC(F)(F)C1	ZINC000450693519	EG	On-Demand	Anodyne	GSK3A	29	50
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccccc1	ZINC000450693542	FI	On-Demand	Anodyne	DRD2	28	40
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccccc1	ZINC000450693542	FI	On-Demand	Anodyne	DRD4	15	44
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccccc1	ZINC000450693542	FI	On-Demand	Anodyne	HTR2A	22	54
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccccc1	ZINC000450693542	FI	On-Demand	Anodyne	DRD3	20	44
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccccc1	ZINC000450693542	FI	On-Demand	Anodyne	HTR7	15	42
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccccc1	ZINC000450693542	FI	On-Demand	Anodyne	SIGMAR1	17	45
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccccc1	ZINC000450693542	FI	On-Demand	Anodyne	CYP2J2	66	47
COc1ccc(CN(C(=O)c2cnn3ccc(C)cc23)[C@H](CO)C(C)C)cc1	ZINC000450693545	GG	On-Demand	Anodyne	ACAT	46	36
CC(C)Oc1cc(F)ccc1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450693546	FI	On-Demand	Bother	PYGL	24	42
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	DRD2	35	52
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	DRD1	15	53
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	HTR2A	20	53
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	OPRL1	44	38
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	SIGMAR1	20	54
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	SLC18A3	0	54
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccc(F)cc1	ZINC000450693550	FI	On-Demand	Anodyne	CYP2J2	49	34
COc1cccc(OCCC(=O)Nc2ccc(F)cc2OC(C)C)c1	ZINC000450693559	EI	On-Demand	Anodyne	MTNR1A	26	43
COc1cccc(OCCC(=O)Nc2ccc(F)cc2OC(C)C)c1	ZINC000450693559	EI	On-Demand	Anodyne	MTNR1B	31	50
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2ccncc2)cc1	ZINC000450693565	GI	On-Demand	Anodyne	CACNA2D1	89	42
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2ccncc2)cc1	ZINC000450693565	GI	On-Demand	Anodyne	CACNA2D2	56	34
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2ccncc2)cc1	ZINC000450693565	GI	On-Demand	Anodyne	WNT3A	24	57
O=S1(=O)CCN(C2CCN(CC/C=C/c3ccccc3)CC2)CC1	ZINC000450693573	EE	On-Demand	Anodyne	SIGMAR1	15	43
O=S1(=O)CCN(C2CCN(CC/C=C\c3ccccc3)CC2)CC1	ZINC000450693574	EE	On-Demand	Anodyne	SIGMAR1	15	43
CC(C)(C)OC(=O)C1CN(c2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450693577	FF	On-Demand	Anodyne	COLA	45	33
CC(C)(C)OC(=O)C1CN(c2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450693577	FF	On-Demand	Anodyne	VCP	44	38
Nc1ncccc1CN1CCC2(CC1)OCCc1ccsc12	ZINC000450693603	DF	On-Demand	Anodyne	OPRL1	63	48
CO[C@@H]1COCC[C@H]1CNc1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450693612	CD	On-Demand	Mild	PRKCQ	40	33
CO[C@H]1COCC[C@H]1CNc1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450693613	CD	On-Demand	Mild	PRKCQ	40	33
CO[C@H]1COCC[C@@H]1CNc1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450693614	CD	On-Demand	Mild	PRKCQ	40	33
CO[C@@H]1COCC[C@@H]1CNc1ncc(C#N)cc1[N+](=O)[O-]	ZINC000450693615	CD	On-Demand	Mild	PRKCQ	40	33
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCSC2(CCOCC2)C1	ZINC000450693650	GG	On-Demand	Bother	SLC6A9	17	44
C=C(C)CN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450693662	BG	On-Demand	Mild	THRA	34	40
C=C(C)CN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450693662	BG	On-Demand	Mild	LSS	18	41
CC(C)C[C@H](C)N1CCN(c2ccc(F)cn2)CC1	ZINC000450693664	CF	On-Demand	Anodyne	SLC27A1	25	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cn1	ZINC000450693718	GH	On-Demand	Anodyne	BDKRB1	22	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cn1	ZINC000450693718	GH	On-Demand	Anodyne	L3MBTL3	42	36
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cn1	ZINC000450693721	GH	On-Demand	Anodyne	BDKRB1	22	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cn1	ZINC000450693721	GH	On-Demand	Anodyne	L3MBTL3	42	36
CCC(=O)CCCN1CCc2cc(OC)c(F)cc2C1	ZINC000450693745	CF	On-Demand	Anodyne	HTR7	23	40
CCC(=O)CCCN1CCc2cc(OC)c(F)cc2C1	ZINC000450693745	CF	On-Demand	Anodyne	ABCB1B	65	38
CCC(=O)CCCN1CCc2cc(OC)c(F)cc2C1	ZINC000450693745	CF	On-Demand	Anodyne	ABCB1	23	45
CC(=O)[C@@](C)(O)CN[C@@H](c1ccc(F)c(C)c1)C1CC1	ZINC000450693752	CF	On-Demand	Anodyne	LEF	22	40
CC(=O)[C@@](C)(O)CN[C@H](c1ccc(F)c(C)c1)C1CC1	ZINC000450693754	CF	On-Demand	Anodyne	LEF	22	40
CC(=O)[C@](C)(O)CN[C@@H](c1ccc(F)c(C)c1)C1CC1	ZINC000450693755	CF	On-Demand	Anodyne	LEF	22	40
CC(=O)[C@](C)(O)CN[C@H](c1ccc(F)c(C)c1)C1CC1	ZINC000450693756	CF	On-Demand	Anodyne	LEF	22	40
CNC(=O)c1ccc(NC[C@H]2CCOC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450693770	DD	On-Demand	Bother	TAAR1	17	41
CNC(=O)c1ccc(NC[C@@H]2CCOC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000450693772	DD	On-Demand	Bother	TAAR1	17	41
CNC(=O)c1ccc(NC[C@H]2CCOC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000450693774	DD	On-Demand	Bother	TAAR1	17	41
CNC(=O)c1ccc(NC[C@@H]2CCOC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450693776	DD	On-Demand	Bother	TAAR1	17	41
C[C@H](CCC1CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450693780	CH	On-Demand	Anodyne	AKT1	28	51
C[C@@H](CCC1CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450693781	CH	On-Demand	Anodyne	AKT1	28	51
COC(=O)c1coc(CN2CCN(c3ccc(F)cn3)CC2)n1	ZINC000450693796	DD	On-Demand	Anodyne	SLC27A1	65	47
C[C@@H](CCC1CC1)NC(=O)c1cc2ccncc2s1	ZINC000450693803	CH	On-Demand	Anodyne	SELE	47	35
C[C@@H](CCC1CC1)NC(=O)c1cc2ccncc2s1	ZINC000450693803	CH	On-Demand	Anodyne	ICAM1	42	35
C[C@H](CCC1CC1)NC(=O)c1cc2ccncc2s1	ZINC000450693804	CH	On-Demand	Anodyne	SELE	46	35
CC/C=C\CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450693843	CF	On-Demand	Bother	TAAR1	16	44
CC/C=C/CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450693845	CF	On-Demand	Bother	TAAR1	16	44
COC(=O)CC1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450693848	GF	On-Demand	Anodyne	DRD4	43	34
COC(=O)CC1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450693848	GF	On-Demand	Anodyne	HCN1	52	35
COC(=O)CC1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450693848	GF	On-Demand	Anodyne	HCN4	49	33
CC/C=C/CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450693850	FD	On-Demand	Bother	BDKRB1	0	49
CC/C=C\CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450693851	FD	On-Demand	Bother	BDKRB1	0	49
COC(=O)CC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450693860	GE	On-Demand	Anodyne	HCN1	52	32
COC(=O)CC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450693860	GE	On-Demand	Anodyne	HCN4	50	32
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450693873	EH	On-Demand	Anodyne	ACE	58	37
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450693873	EH	On-Demand	Anodyne	CCR1	40	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450693874	EH	On-Demand	Anodyne	ACE	58	37
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450693874	EH	On-Demand	Anodyne	CCR1	40	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450693875	EH	On-Demand	Anodyne	ACE	58	37
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450693875	EH	On-Demand	Anodyne	CCR1	40	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450693876	EH	On-Demand	Anodyne	ACE	58	37
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450693876	EH	On-Demand	Anodyne	CCR1	40	40
Cc1nc(C)n(CCCC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450693890	GG	On-Demand	Anodyne	CCR3	25	42
C[C@@H](CC(C)(C)O)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450693901	CG	On-Demand	Anodyne	UTS2R	31	49
C[C@H](CC(C)(C)O)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450693903	CG	On-Demand	Anodyne	UTS2R	31	49
C[C@@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCO1	ZINC000450693905	EF	On-Demand	Anodyne	GSK3A	20	46
C[C@@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCO1	ZINC000450693906	EF	On-Demand	Anodyne	GSK3A	20	46
C[C@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCO1	ZINC000450693907	EF	On-Demand	Anodyne	GSK3A	20	46
C[C@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCO1	ZINC000450693908	EF	On-Demand	Anodyne	GSK3A	20	46
CN(Cc1ccccc1OC1CC1)C[C@H]1CCCC[C@@H]1O	ZINC000450693915	CG	On-Demand	Anodyne	SLC5A4	54	36
CN(Cc1ccccc1OC1CC1)C[C@H]1CCCC[C@H]1O	ZINC000450693916	CG	On-Demand	Anodyne	SLC5A4	54	36
CN(Cc1ccccc1OC1CC1)C[C@@H]1CCCC[C@H]1O	ZINC000450693917	CG	On-Demand	Anodyne	SLC5A4	54	36
CN(Cc1ccccc1OC1CC1)C[C@@H]1CCCC[C@@H]1O	ZINC000450693918	CG	On-Demand	Anodyne	SLC5A4	54	36
CC(C)(C)OC(=O)C1CN(c2ncnc3c2cnn3-c2ccccc2)C1	ZINC000450693936	FF	On-Demand	Anodyne	GPR119	20	47
CCC(=O)N1CCC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450693939	GE	On-Demand	Anodyne	GSK3A	27	44
CCC(=O)N1CCC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450693939	GE	On-Demand	Anodyne	MAPK1	32	42
CCC(=O)N1CCC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450693940	GE	On-Demand	Anodyne	GSK3A	27	44
CCC(=O)N1CCC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450693940	GE	On-Demand	Anodyne	MAPK1	32	42
CCOC(=O)CNC(=O)[C@@H]1COCCN1Cc1c(C)cccc1Cl	ZINC000450693945	FD	On-Demand	Anodyne	P2RX7	17	43
CCOC(=O)CNC(=O)[C@H]1COCCN1Cc1c(C)cccc1Cl	ZINC000450693946	FD	On-Demand	Anodyne	P2RX7	17	43
Cc1cccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c12	ZINC000450693980	CF	On-Demand	Anodyne	LIMK2	47	34
c1cc2c(s1)C1(CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC1)OCC2	ZINC000450693981	DG	On-Demand	Anodyne	OPRL1	42	32
c1cc2c(s1)C1(CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC1)OCC2	ZINC000450693982	DG	On-Demand	Anodyne	OPRL1	42	32
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccccc1	ZINC000450693985	FI	On-Demand	Anodyne	DRD2	31	43
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccccc1	ZINC000450693985	FI	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccccc1	ZINC000450693985	FI	On-Demand	Anodyne	OPRL1	48	39
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccccc1	ZINC000450693985	FI	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccccc1	ZINC000450693985	FI	On-Demand	Anodyne	SIGMAR1	29	61
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccccc1	ZINC000450693985	FI	On-Demand	Anodyne	SLC18A3	0	46
O=C(CCCN1CCC2(CC1)OCCc1ccsc12)c1ccccc1	ZINC000450693985	FI	On-Demand	Anodyne	CYP2J2	56	39
Cc1cccc(Cl)c1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000450694009	FI	On-Demand	Anodyne	CCR3	22	41
Cc1cccc(Cl)c1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000450694009	FI	On-Demand	Anodyne	CCR5	49	41
Cc1cccc(Cl)c1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1	ZINC000450694009	FI	On-Demand	Anodyne	L3MBTL3	73	37
CCC[C@H]1CN(Cc2nc(C(=O)OC)co2)CCN1Cc1ccccc1	ZINC000450694010	FF	On-Demand	Anodyne	SIGMAR1	15	40
CCC[C@@H]1CN(Cc2nc(C(=O)OC)co2)CCN1Cc1ccccc1	ZINC000450694011	FF	On-Demand	Anodyne	SIGMAR1	15	40
C=CCCCCNC(=O)c1cn(-c2cccnc2)nn1	ZINC000450694017	CD	On-Demand	Mild	PTAFR	17	40
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(F)ccc12	ZINC000450694020	CF	On-Demand	Anodyne	HRP1_PLAFA	42	37
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(F)ccc12	ZINC000450694020	CF	On-Demand	Anodyne	HNMT	46	32
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(F)ccc12	ZINC000450694021	CF	On-Demand	Anodyne	HRP1_PLAFA	42	37
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(F)ccc12	ZINC000450694021	CF	On-Demand	Anodyne	HNMT	46	32
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(F)ccc12	ZINC000450694022	CF	On-Demand	Anodyne	HRP1_PLAFA	42	37
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(F)ccc12	ZINC000450694022	CF	On-Demand	Anodyne	HNMT	46	32
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(F)ccc12	ZINC000450694023	CF	On-Demand	Anodyne	HRP1_PLAFA	42	37
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(F)ccc12	ZINC000450694023	CF	On-Demand	Anodyne	HNMT	46	32
COC(=O)CC1(CNC(=O)c2ccsc2Br)CCCCC1	ZINC000450694033	FH	On-Demand	Anodyne	HCN1	56	35
COC(=O)CC1(CNC(=O)c2ccsc2Br)CCCCC1	ZINC000450694033	FH	On-Demand	Anodyne	HCN4	53	35
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	ADORA1	133	77
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	SLC29A1	117	60
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	P2RY12	56	45
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	ADORA2A	66	67
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	ADORA2B	33	58
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	GAPC	0	44
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	ADK	79	58
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	P2RX5	0	41
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	AK3	0	43
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	AHCY	61	45
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	P2RX4	36	43
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	P2RX1	47	41
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	P2RX6	0	41
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	P2RY4	17	41
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	P2RY1	32	43
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	P2RY11	0	42
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	MAT2A	0	41
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	AMD1	36	41
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	GAPDH	37	40
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	ITPR1	55	39
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	AK2	0	43
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	NS5B	0	48
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	ADORA3	131	63
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	OXGR1	120	44
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	MTAP	0	48
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	QARS	0	40
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	IMPDH2	55	35
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	AK	0	53
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	SETD7	0	43
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	PRMT1	0	43
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	SLC28A2	0	40
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	MBTA	0	48
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	DNMT3B	77	47
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	NADK	0	41
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	PANC	37	41
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	Q4VQ11_PIG	87	63
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	GPR17	59	44
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	SAE1	0	40
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	HSPA5	54	40
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	DOT1L	87	46
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	METJ	0	43
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	NAE1	0	40
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	UBA6	0	40
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	UBA7	0	40
CC/C=C\CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450694040	EB	On-Demand	Anodyne	SETD2	0	43
COC(=O)CC1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCCC1	ZINC000450694050	GF	On-Demand	Anodyne	HCN1	63	39
COC(=O)CC1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCCC1	ZINC000450694050	GF	On-Demand	Anodyne	HCN4	55	36
C=CCCCCNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450694061	DF	On-Demand	Mild	TGM2	35	42
C=CCCCCNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450694061	DF	On-Demand	Mild	CLPP	0	44
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450694062	CD	On-Demand	Anodyne	CA12	40	43
COC(=O)CC1(CNC(=O)c2cn(-c3cccnc3)nn2)CCCCC1	ZINC000450694080	FD	On-Demand	Anodyne	HCN1	53	33
COC(=O)CC1(CNC(=O)c2cn(-c3cccnc3)nn2)CCCCC1	ZINC000450694080	FD	On-Demand	Anodyne	HCN4	49	33
CO[C@H]1COCC[C@@H]1CNc1cc(C#N)ccn1	ZINC000450694094	BD	On-Demand	Mild	MAP3K12	49	35
CO[C@@H]1COCC[C@H]1CNc1cc(C#N)ccn1	ZINC000450694095	BD	On-Demand	Mild	MAP3K12	49	35
CO[C@H]1COCC[C@H]1CNc1cc(C#N)ccn1	ZINC000450694096	BD	On-Demand	Mild	MAP3K12	49	35
CO[C@@H]1COCC[C@@H]1CNc1cc(C#N)ccn1	ZINC000450694097	BD	On-Demand	Mild	MAP3K12	49	35
CC(C)(C)C(=O)N1CCN(CCCC(=O)c2ccccc2)C(C)(C)C1	ZINC000450694103	EH	On-Demand	Anodyne	CYP2J2	54	40
CCc1cc(CCCN2CCc3cc(OC)c(F)cc3C2)on1	ZINC000450694111	DG	On-Demand	Anodyne	ABCB1B	60	35
CCc1cc(CCCN2CCc3cc(OC)c(F)cc3C2)on1	ZINC000450694111	DG	On-Demand	Anodyne	ABCB1	21	42
CCOCCOc1ccc(Br)cc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450694162	GE	On-Demand	Anodyne	P2RX7	20	42
CCOCCOc1ccc(Br)cc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450694163	GE	On-Demand	Anodyne	P2RX7	20	42
Nc1ncccc1CN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450694168	GG	On-Demand	Anodyne	PRCP	25	44
Nc1ncccc1CN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450694168	GG	On-Demand	Anodyne	MMP2	15	40
COCc1nn(C)cc1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450694186	FF	On-Demand	Anodyne	GRIN2B	40	40
COCc1nn(C)cc1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450694186	FF	On-Demand	Anodyne	PARP1	55	37
COc1cc2c(cc1F)CN(Cc1nnc(C3CC3)s1)CC2	ZINC000450694188	DG	On-Demand	Anodyne	ABCB1	18	41
CC(C)[C@@H]1CN(CCN(C)Cc2ccccc2)CCO1	ZINC000450694204	CE	On-Demand	Anodyne	SIGMAR1	24	45
CC(C)[C@H]1CN(CCN(C)Cc2ccccc2)CCO1	ZINC000450694205	CE	On-Demand	Anodyne	SIGMAR1	24	45
C[C@H](CC(C)(C)O)Nc1cncc(SCc2ccccc2)n1	ZINC000450694224	DH	On-Demand	Anodyne	CXCR2	22	44
C[C@H](CC(C)(C)O)Nc1cncc(SCc2ccccc2)n1	ZINC000450694224	DH	On-Demand	Anodyne	CX3CR1	45	35
C[C@@H](CC(C)(C)O)Nc1cncc(SCc2ccccc2)n1	ZINC000450694225	DH	On-Demand	Anodyne	CXCR2	22	44
C[C@@H](CC(C)(C)O)Nc1cncc(SCc2ccccc2)n1	ZINC000450694225	DH	On-Demand	Anodyne	CX3CR1	45	35
COc1cccc(-n2cc(C(=O)N[C@H](C)[C@H](c3ccccc3)N(C)C)nn2)c1	ZINC000450694235	GF	On-Demand	Anodyne	ESRRA	25	47
COc1ccc(-c2nnc(SCC3(OC)CCC3)n2Cc2ccco2)cc1	ZINC000450694237	GI	On-Demand	Anodyne	HCRTR2	20	49
COc1cccc(-n2cc(C(=O)N[C@@H](C)[C@H](c3ccccc3)N(C)C)nn2)c1	ZINC000450694238	GF	On-Demand	Anodyne	ESRRA	25	47
COc1cccc(-n2cc(C(=O)N[C@H](C)[C@@H](c3ccccc3)N(C)C)nn2)c1	ZINC000450694239	GF	On-Demand	Anodyne	ESRRA	25	47
COc1cccc(-n2cc(C(=O)N[C@@H](C)[C@@H](c3ccccc3)N(C)C)nn2)c1	ZINC000450694244	GF	On-Demand	Anodyne	ESRRA	25	47
CCCOc1ccc(CN(Cc2ccccc2)C(=O)CC[C@@H]2CCC(=O)N2)cc1	ZINC000450694247	GI	On-Demand	Anodyne	LTA4H	40	38
CCCOc1ccc(CN(Cc2ccccc2)C(=O)CC[C@H]2CCC(=O)N2)cc1	ZINC000450694248	GI	On-Demand	Anodyne	LTA4H	40	38
CN1CCC[C@H](C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)C1=O	ZINC000450694259	FF	On-Demand	Anodyne	CCR3	41	42
CN1CCC[C@@H](C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)C1=O	ZINC000450694260	FF	On-Demand	Anodyne	CCR3	41	42
O=C(c1cc2ccncc2s1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450694263	FJ	On-Demand	Anodyne	GRIN2B	41	39
O=C(c1cc2ccncc2s1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450694263	FJ	On-Demand	Anodyne	NAMPT	15	50
C[C@H](CC(C)(C)O)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450694266	EE	On-Demand	Anodyne	LRRK2	28	42
C[C@@H](CC(C)(C)O)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450694267	EE	On-Demand	Anodyne	LRRK2	28	42
COC[C@@H](NC(=O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)C(=O)OC	ZINC000450694281	GD	On-Demand	Anodyne	TIMP3	46	32
COC[C@@H](NC(=O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)C(=O)OC	ZINC000450694282	GD	On-Demand	Anodyne	TIMP3	46	32
COC[C@H](NC(=O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)C(=O)OC	ZINC000450694283	GD	On-Demand	Anodyne	TIMP3	46	32
COC[C@H](NC(=O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)C(=O)OC	ZINC000450694284	GD	On-Demand	Anodyne	TIMP3	46	32
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450694299	FH	On-Demand	Anodyne	HSD11B1	0	46
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450694299	FH	On-Demand	Anodyne	FASN	49	51
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450694299	FH	On-Demand	Anodyne	L3MBTL3	53	38
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450694300	FH	On-Demand	Anodyne	HSD11B1	0	46
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450694300	FH	On-Demand	Anodyne	FASN	49	51
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450694300	FH	On-Demand	Anodyne	L3MBTL3	53	38
COc1cccc2c(N[C@H](C)CC(C)(C)O)c(C)cnc12	ZINC000450694302	CH	On-Demand	Anodyne	ATP4A	24	44
COc1cccc2c(N[C@@H](C)CC(C)(C)O)c(C)cnc12	ZINC000450694303	CH	On-Demand	Anodyne	ATP4A	24	44
Cc1nn(C)cc1CN[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450694307	FI	On-Demand	Anodyne	PHES	0	41
Cc1nn(C)cc1CN[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000450694308	FI	On-Demand	Anodyne	PHES	0	41
COC(=O)CC1(CNC(=O)c2cccc(C#N)c2Br)CCCCC1	ZINC000450694311	GH	On-Demand	Mild	HCN1	59	38
COC(=O)CC1(CNC(=O)c2cccc(C#N)c2Br)CCCCC1	ZINC000450694311	GH	On-Demand	Mild	HCN4	55	36
COC(=O)CC1(CNC(=O)c2ccc3cnccc3c2)CCCCC1	ZINC000450694320	EG	On-Demand	Anodyne	AKT1	0	41
COc1cc(CC(=O)NCc2nnnn2CC2CC2)ccc1Cl	ZINC000450694340	ED	On-Demand	Anodyne	CAN2	0	41
CC1(C)CN(C(=O)C2CC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450694363	EG	On-Demand	Anodyne	DRD2	29	41
CC1(C)CN(C(=O)C2CC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450694363	EG	On-Demand	Anodyne	DRD4	0	45
CC1(C)CN(C(=O)C2CC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450694363	EG	On-Demand	Anodyne	SLC18A3	0	47
CC1(C)CN(C(=O)C2CC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450694363	EG	On-Demand	Anodyne	CYP2J2	48	34
O=C(C1=C(c2ccccc2)CCC1)N1CCC2(CC1)OCCc1ccsc12	ZINC000450694381	GJ	On-Demand	Anodyne	OPRL1	15	43
O=C(NCc1nc(COc2ccccc2)n[nH]1)c1cn(CC2CC2)nn1	ZINC000450694396	FD	On-Demand	Anodyne	GRIN2B	17	40
COC(=O)[C@@H]1C[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694405	ED	On-Demand	Anodyne	GSK3A	15	42
COC(=O)[C@@H]1C[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694406	ED	On-Demand	Anodyne	GSK3A	15	42
COC(=O)[C@H]1C[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694407	ED	On-Demand	Anodyne	GSK3A	15	42
COC(=O)[C@H]1C[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694408	ED	On-Demand	Anodyne	GSK3A	15	42
COC(=O)C1(CN2CCC3(CC2)OCCc2ccsc23)CC1	ZINC000450694424	DF	On-Demand	Anodyne	OPRL1	49	41
CCN1CCCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694432	EF	On-Demand	Anodyne	GSK3A	21	42
CCN1CCCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694433	EF	On-Demand	Anodyne	GSK3A	21	42
CCc1cccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)n1	ZINC000450694454	DG	On-Demand	Anodyne	TACR3	44	36
CCc1cccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)n1	ZINC000450694455	DG	On-Demand	Anodyne	TACR3	44	36
CCc1cccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)n1	ZINC000450694456	DG	On-Demand	Anodyne	TACR3	44	36
CCc1cccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)n1	ZINC000450694457	DG	On-Demand	Anodyne	TACR3	44	36
CCCC(=O)N1CCC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450694459	GF	On-Demand	Anodyne	GSK3B	15	48
CCCC(=O)N1CCC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450694459	GF	On-Demand	Anodyne	GSK3A	40	48
CCCC(=O)N1CCC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450694459	GF	On-Demand	Anodyne	MAPK1	32	43
CCOC(=O)CNC(=O)[C@@H]1COCCN1CCN(C)Cc1ccccc1	ZINC000450694466	FC	On-Demand	Anodyne	ADAM9	54	33
CCOC(=O)CNC(=O)[C@H]1COCCN1CCN(C)Cc1ccccc1	ZINC000450694467	FC	On-Demand	Anodyne	ADAM9	54	33
C[C@@H](NC(=O)CCc1nc2cnccc2[nH]1)[C@H](c1ccccc1)N(C)C	ZINC000450694484	FF	On-Demand	Anodyne	PARP3	26	50
C[C@H](NC(=O)CCc1nc2cnccc2[nH]1)[C@H](c1ccccc1)N(C)C	ZINC000450694485	FF	On-Demand	Anodyne	PARP3	26	50
C[C@@H](NC(=O)CCc1nc2cnccc2[nH]1)[C@@H](c1ccccc1)N(C)C	ZINC000450694486	FF	On-Demand	Anodyne	PARP3	26	50
C[C@H](NC(=O)CCc1nc2cnccc2[nH]1)[C@@H](c1ccccc1)N(C)C	ZINC000450694487	FF	On-Demand	Anodyne	PARP3	26	50
CC(C)[C@H]1C[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694504	DG	On-Demand	Anodyne	GSK3A	15	44
COc1cccc(-n2cc(C(=O)N[C@H](C)CCC3CC3)nn2)c1	ZINC000450694513	DF	On-Demand	Anodyne	DRD4	42	33
COc1cccc(-n2cc(C(=O)N[C@@H](C)CCC3CC3)nn2)c1	ZINC000450694514	DF	On-Demand	Anodyne	DRD4	42	33
COC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1Cl	ZINC000450694528	FF	On-Demand	Anodyne	DRD1	0	42
COC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1Cl	ZINC000450694528	FF	On-Demand	Anodyne	DRD4	32	43
COC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1Cl	ZINC000450694528	FF	On-Demand	Anodyne	IKBKB	47	37
COC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1Cl	ZINC000450694528	FF	On-Demand	Anodyne	CACNA1G	34	42
COC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1Cl	ZINC000450694528	FF	On-Demand	Anodyne	SLC27A1	53	43
COc1ncc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1Cl	ZINC000450694547	GG	On-Demand	Bother	TAAR1	22	49
CCC[C@@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450694555	CD	On-Demand	Anodyne	ABCB1	34	42
CCC[C@@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450694555	CD	On-Demand	Anodyne	SLC27A1	46	46
CO[C@@H]1COCC[C@@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450694561	ED	On-Demand	Bother	VCP	27	42
CCC[C@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450694562	CD	On-Demand	Anodyne	ABCB1	34	42
CCC[C@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450694562	CD	On-Demand	Anodyne	SLC27A1	46	46
CO[C@H]1COCC[C@@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450694567	ED	On-Demand	Bother	VCP	27	42
CO[C@@H]1COCC[C@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450694568	ED	On-Demand	Bother	VCP	27	42
CO[C@H]1COCC[C@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450694569	ED	On-Demand	Bother	VCP	27	42
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450694573	DF	On-Demand	Anodyne	DRD2	31	44
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450694573	DF	On-Demand	Anodyne	DRD4	0	45
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450694573	DF	On-Demand	Anodyne	SLC18A3	0	47
CC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)C(C)(C)C1	ZINC000450694573	DF	On-Demand	Anodyne	CYP2J2	45	32
Cc1cccc(-c2nnc(SCC[C@H]3CCOC3)n2C)c1	ZINC000450694580	DG	On-Demand	Anodyne	DRD3	59	36
Cc1cccc(-c2nnc(SCC[C@@H]3CCOC3)n2C)c1	ZINC000450694581	DG	On-Demand	Anodyne	DRD3	59	36
O=C(N[C@@H](CO)c1ccsc1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450694611	EH	On-Demand	Anodyne	GPR88	0	50
O=C(N[C@H](CO)c1ccsc1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450694613	EH	On-Demand	Anodyne	GPR88	0	50
COc1ncc(CNc2ccc(S(=O)(=O)N3CCCCC3)cn2)cc1Cl	ZINC000450694632	GE	On-Demand	Anodyne	NAMPT	41	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)CCC1CC1	ZINC000450694634	DG	On-Demand	Anodyne	PFDN6	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)CCC1CC1	ZINC000450694634	DG	On-Demand	Anodyne	CAPN1	41	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)CCC1CC1	ZINC000450694634	DG	On-Demand	Anodyne	FPR1	40	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)CCC1CC1	ZINC000450694635	DG	On-Demand	Anodyne	PFDN6	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)CCC1CC1	ZINC000450694635	DG	On-Demand	Anodyne	CAPN1	41	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)CCC1CC1	ZINC000450694635	DG	On-Demand	Anodyne	FPR1	40	37
COC(=O)c1coc(CSc2nnc(-c3ccc(OC)cc3)n2C)n1	ZINC000450694651	FF	On-Demand	Anodyne	AXIN2	0	42
COc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1O	ZINC000450694670	CE	On-Demand	Anodyne	PRNP	25	41
COc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1O	ZINC000450694670	CE	On-Demand	Anodyne	HDAC1	29	43
CCOC(=O)c1cc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)on1	ZINC000450694675	FF	On-Demand	Anodyne	GYRB	0	40
CCOC(=O)c1cc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)on1	ZINC000450694675	FF	On-Demand	Anodyne	TPSAB1	23	42
CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)on1	ZINC000450694677	FF	On-Demand	Anodyne	GYRB	0	40
CCOC(=O)c1cc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)on1	ZINC000450694677	FF	On-Demand	Anodyne	TPSAB1	23	42
c1ccc(-c2nc([C@@H]3CCCN(Cc4cnn[nH]4)C3)n[nH]2)cc1	ZINC000450694678	DD	On-Demand	Anodyne	AKT2	56	37
c1ccc(-c2nc([C@H]3CCCN(Cc4cnn[nH]4)C3)n[nH]2)cc1	ZINC000450694680	DD	On-Demand	Anodyne	AKT2	56	37
C[C@H](CCC1CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450694684	CG	On-Demand	Anodyne	F2R	16	40
C[C@@H](CCC1CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450694685	CG	On-Demand	Anodyne	F2R	16	40
C[C@@H](CCC1CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450694686	CG	On-Demand	Anodyne	F2R	16	40
C[C@H](CCC1CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450694687	CG	On-Demand	Anodyne	F2R	16	40
COc1ccc(-c2nnc(SCCCCCC(C)=O)n2C)cc1	ZINC000450694690	EH	On-Demand	Anodyne	DRD3	16	48
COc1cc(CN2CCN(c3ccc(F)cn3)CC2)ccc1Cl	ZINC000450694693	EG	On-Demand	Anodyne	DRD2	22	44
COc1cc(CN2CCN(c3ccc(F)cn3)CC2)ccc1Cl	ZINC000450694693	EG	On-Demand	Anodyne	DRD1	29	48
COc1cc(CN2CCN(c3ccc(F)cn3)CC2)ccc1Cl	ZINC000450694693	EG	On-Demand	Anodyne	DRD4	42	45
COc1cc(CN2CCN(c3ccc(F)cn3)CC2)ccc1Cl	ZINC000450694693	EG	On-Demand	Anodyne	DRD3	29	44
COc1cc(CN2CCN(c3ccc(F)cn3)CC2)ccc1Cl	ZINC000450694693	EG	On-Demand	Anodyne	SSTR5	54	37
COc1cc(CN2CCN(c3ccc(F)cn3)CC2)ccc1Cl	ZINC000450694693	EG	On-Demand	Anodyne	SLC27A1	41	39
CC/C=C\CNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450694742	CE	On-Demand	Anodyne	PRCP	0	42
CC/C=C\CNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450694743	CE	On-Demand	Anodyne	PRCP	0	42
CC/C=C\CN=c1ccc(C(=O)N2CCc3ccccc32)c[nH]1	ZINC000450694777	DG	On-Demand	Anodyne	AVPR2	43	40
CC/C=C/CN=c1ccc(C(=O)N2CCc3ccccc32)c[nH]1	ZINC000450694778	DG	On-Demand	Anodyne	AVPR2	43	40
COC(=O)CNC(=O)c1ccc(NC[C@H]2CCOC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000450694786	GC	On-Demand	Bother	TAAR1	19	41
COC(=O)CNC(=O)c1ccc(NC[C@H]2CCOC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450694787	GC	On-Demand	Bother	TAAR1	19	41
COC(=O)CNC(=O)c1ccc(NC[C@@H]2CCOC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450694788	GC	On-Demand	Bother	TAAR1	19	41
COC(=O)CNC(=O)c1ccc(NC[C@@H]2CCOC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000450694789	GC	On-Demand	Bother	TAAR1	19	41
C=CCCCCNC(=O)CCc1ccc2ccccc2c1O	ZINC000450694798	CH	On-Demand	Mild	SUCNR1	42	40
CC(C)[C@@H]1C[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694805	DG	On-Demand	Anodyne	GSK3A	15	44
CC(C)[C@@H]1C[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694806	DG	On-Demand	Anodyne	GSK3A	15	44
CC(C)[C@H]1C[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694807	DG	On-Demand	Anodyne	GSK3A	15	44
COC(=O)c1cc(Cl)cc(Cl)c1N1CC(=O)N(CCC(F)(F)F)C1	ZINC000450694814	GG	On-Demand	Anodyne	SLC5A2	34	43
NC(=O)C1(NCC23CC4CC(CC(C4)C2)C3)CC1	ZINC000450694815	BD	On-Demand	Anodyne	P2RX7	0	40
NC(=O)C1(NCC23CC4CC(CC(C4)C2)C3)CC1	ZINC000450694815	BD	On-Demand	Anodyne	EPHX2	0	47
CCCC(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694835	CF	On-Demand	Anodyne	GSK3B	0	48
CCCC(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450694835	CF	On-Demand	Anodyne	GSK3A	25	41
CCOC(=O)C1CCC(Sc2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450694837	GH	On-Demand	Anodyne	TIMP3	64	34
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCN(CC(F)(F)F)C1	ZINC000450694848	GF	On-Demand	Anodyne	GSK3A	21	43
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCN(CC(F)(F)F)C1	ZINC000450694848	GF	On-Demand	Anodyne	MAPK1	33	44
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCN(CC(F)(F)F)C1	ZINC000450694849	GF	On-Demand	Anodyne	GSK3A	21	43
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCN(CC(F)(F)F)C1	ZINC000450694849	GF	On-Demand	Anodyne	MAPK1	33	44
CC(C)Oc1cc(F)ccc1NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450694854	DG	On-Demand	Anodyne	P2RY1	22	44
CC(C)Oc1cc(F)ccc1NC(=O)[C@H](C)Oc1ccccn1	ZINC000450694855	DG	On-Demand	Anodyne	P2RY1	22	44
COc1ccc(CN(C(=O)c2cn3nccc3nc2C)[C@H](CO)C(C)C)cc1	ZINC000450694856	GF	On-Demand	Anodyne	ACAT	42	35
CC(=O)c1cccc(CN2CCC3(CC2)OCCc2ccsc23)c1	ZINC000450694858	EI	On-Demand	Anodyne	OPRL1	55	44
CC(=O)c1cccc(CN2CCC3(CC2)OCCc2ccsc23)c1	ZINC000450694858	EI	On-Demand	Anodyne	CHRM3	15	41
CC(=O)c1cccc(CN2CCC3(CC2)OCCc2ccsc23)c1	ZINC000450694858	EI	On-Demand	Anodyne	SIGMAR1	40	69
COc1cc(Cn2cc(S(=O)(=O)N3CCCC3)ccc2=O)ccc1Cl	ZINC000450694860	GE	On-Demand	Anodyne	AVPR1B	41	35
COc1cc(Cn2cc(S(=O)(=O)N3CCCC3)ccc2=O)ccc1Cl	ZINC000450694860	GE	On-Demand	Anodyne	CASP3	0	41
COc1cc(Cn2cc(S(=O)(=O)N3CCCC3)ccc2=O)ccc1Cl	ZINC000450694860	GE	On-Demand	Anodyne	CASP7	22	41
COC(=O)c1ccc(CN2CCC3(CC2)OCCc2ccsc23)cc1Cl	ZINC000450694862	GI	On-Demand	Anodyne	OPRL1	52	44
COC(=O)c1ccc(CN2CCC3(CC2)OCCc2ccsc23)cc1Cl	ZINC000450694862	GI	On-Demand	Anodyne	SIGMAR1	30	60
FC1(F)CC[C@@H](CN2CCC3(CC2)OCCc2ccsc23)C1	ZINC000450694863	EI	On-Demand	Anodyne	OPRL1	44	35
FC1(F)CC[C@H](CN2CCC3(CC2)OCCc2ccsc23)C1	ZINC000450694864	EI	On-Demand	Anodyne	OPRL1	44	35
COc1cccc(OCCC(=O)Nc2cc(OC)c(C(C)C)c(OC)c2)c1	ZINC000450694867	FI	On-Demand	Anodyne	LTA4H	18	42
COc1cccc(OCCC(=O)Nc2cc(OC)c(C(C)C)c(OC)c2)c1	ZINC000450694867	FI	On-Demand	Anodyne	MTNR1A	49	48
COc1cccc(OCCC(=O)Nc2cc(OC)c(C(C)C)c(OC)c2)c1	ZINC000450694867	FI	On-Demand	Anodyne	MTNR1B	51	49
COc1cccc(OCCC(=O)Nc2cc(OC)c(C(C)C)c(OC)c2)c1	ZINC000450694867	FI	On-Demand	Anodyne	ENPP1	51	32
COc1cccc(OCCC(=O)Nc2cc(OC)c(C(C)C)c(OC)c2)c1	ZINC000450694867	FI	On-Demand	Anodyne	ACAT	0	40
CCOC(=O)C1CCC(Sc2ccc(CC(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450694871	GH	On-Demand	Bother	GSTM2	49	37
CC(C)CCn1c(COc2ccccc2)nnc1SCC1(C#N)CCC1	ZINC000450694877	FJ	On-Demand	Mild	VCP	51	37
CCc1cc(N2CC(C(=O)OC(C)(C)C)C2)nc(-c2ccccn2)n1	ZINC000450694885	EF	On-Demand	Anodyne	METAP1	40	37
c1cc2c(s1)C1(CCN(Cc3cnns3)CC1)OCC2	ZINC000450694886	DF	On-Demand	Anodyne	OPRL1	48	39
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)cc(OC)c1C(C)C	ZINC000450694895	FJ	On-Demand	Anodyne	ENPP1	55	31
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)cc(OC)c1C(C)C	ZINC000450694895	FJ	On-Demand	Anodyne	KCNK3	40	43
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)cc(OC)c1C(C)C	ZINC000450694895	FJ	On-Demand	Anodyne	KCNK9	36	43
C[C@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450694904	CG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450694904	CG	On-Demand	Anodyne	PRCP	24	40
C[C@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450694904	CG	On-Demand	Anodyne	CCR3	60	36
C[C@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450694904	CG	On-Demand	Anodyne	CCR5	28	44
C[C@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450694904	CG	On-Demand	Anodyne	SLC18A3	32	44
Cc1cnc(N[C@H](C)CC(C)(C)O)s1	ZINC000450694907	BE	On-Demand	Anodyne	FDPS	15	50
Cc1cnc(N[C@@H](C)CC(C)(C)O)s1	ZINC000450694908	BE	On-Demand	Anodyne	FDPS	15	50
C[C@@H](CC(C)(C)O)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450694915	EE	On-Demand	Anodyne	HTR3A	24	52
C[C@H](CC(C)(C)O)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450694916	EE	On-Demand	Anodyne	HTR3A	24	52
O=C(c1cc2n(n1)CCCC2)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450694939	FH	On-Demand	Anodyne	GRIN2B	34	40
O=C(c1cc2n(n1)CCCC2)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450694939	FH	On-Demand	Anodyne	CCR3	23	41
O=C(c1cc2n(n1)CCCC2)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450694939	FH	On-Demand	Anodyne	L3MBTL3	56	34
Cc1cc(=N[C@H](C)CC(C)(C)O)c2cc(F)ccc2[nH]1	ZINC000450694944	CG	On-Demand	Anodyne	MPO	59	33
Cc1cc(=N[C@@H](C)CC(C)(C)O)c2cc(F)ccc2[nH]1	ZINC000450694948	CG	On-Demand	Anodyne	MPO	59	33
C=C(C)CN(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450694959	BF	On-Demand	Mild	AOC3	19	40
C=C(C)CN(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450694961	BF	On-Demand	Mild	AOC3	19	40
COc1cc(OC)c2ncnc(N[C@@H](C)CC(C)(C)O)c2c1	ZINC000450694962	DF	On-Demand	Anodyne	PDE6A	41	32
C=C(C)CN(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450694963	BF	On-Demand	Mild	AOC3	19	40
C=C(C)CN(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450694964	BF	On-Demand	Mild	AOC3	19	40
COc1cc(OC)c2ncnc(N[C@H](C)CC(C)(C)O)c2c1	ZINC000450694965	DF	On-Demand	Anodyne	PDE6A	41	32
C[C@H](O)CCSc1nnc(COc2ccccc2Cl)n1-c1ccccc1	ZINC000450694966	GI	On-Demand	Anodyne	VCP	43	40
COc1ccc(-c2nnc(SCc3cn(C)nc3C)n2Cc2ccco2)cc1	ZINC000450694967	GH	On-Demand	Anodyne	HCRTR2	20	48
C[C@@H](O)CCSc1nnc(COc2ccccc2Cl)n1-c1ccccc1	ZINC000450694970	GI	On-Demand	Anodyne	VCP	43	40
C[C@@H](CCC1CC1)NC(=O)c1cc2cccnc2s1	ZINC000450694977	CH	On-Demand	Anodyne	SIRT3	51	32
C[C@@H](CCC1CC1)NC(=O)c1cc2cccnc2s1	ZINC000450694977	CH	On-Demand	Anodyne	SIRT2	51	32
C[C@@H](CCC1CC1)NC(=O)c1cc2cccnc2s1	ZINC000450694977	CH	On-Demand	Anodyne	SIRT1	51	32
C[C@H](CCC1CC1)NC(=O)c1cc2cccnc2s1	ZINC000450694978	CH	On-Demand	Anodyne	SIRT3	51	32
C[C@H](CCC1CC1)NC(=O)c1cc2cccnc2s1	ZINC000450694978	CH	On-Demand	Anodyne	SIRT2	51	32
C[C@H](CCC1CC1)NC(=O)c1cc2cccnc2s1	ZINC000450694978	CH	On-Demand	Anodyne	SIRT1	51	32
COc1cc(CC(=O)N(C)CCN(C)C2CC2)ccc1Cl	ZINC000450694993	DE	On-Demand	Anodyne	MBTPS1	41	33
CCCCN(CCCO)Cc1ccccc1OC1CC1	ZINC000450695004	CG	On-Demand	Anodyne	SLC5A4	45	36
O=C(c1ccnn1CC(F)(F)F)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450695031	FG	On-Demand	Anodyne	ETHR	47	34
O=C(c1ccnn1CC(F)(F)F)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450695033	FG	On-Demand	Anodyne	ETHR	47	34
O=C(CCCC(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1)C1CC1	ZINC000450695041	EH	On-Demand	Anodyne	CCR3	29	44
CCn1nnc(C)c1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450695043	EF	On-Demand	Anodyne	CCR3	24	40
C[C@H](CCC1CC1)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450695054	DG	On-Demand	Anodyne	PDE4D	15	42
C[C@H](CCC1CC1)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450695054	DG	On-Demand	Anodyne	PDEC	0	40
C[C@H](CCC1CC1)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450695057	DG	On-Demand	Anodyne	PDE4D	15	42
C[C@H](CCC1CC1)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450695057	DG	On-Demand	Anodyne	PDEC	0	40
C[C@@H](CCC1CC1)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450695058	DG	On-Demand	Anodyne	PDE4D	15	42
C[C@@H](CCC1CC1)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450695058	DG	On-Demand	Anodyne	PDEC	0	40
C[C@@H](CCC1CC1)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450695059	DG	On-Demand	Anodyne	PDE4D	15	42
C[C@@H](CCC1CC1)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450695059	DG	On-Demand	Anodyne	PDEC	0	40
CC(C)(C)C(=O)CCCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450695081	EI	On-Demand	Anodyne	ETHR	49	36
CC(C)(C)C(=O)CCCC(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450695083	EI	On-Demand	Anodyne	ETHR	49	36
CCNc1ccc(Cl)cc1NC(=O)CNS(=O)(=O)NC	ZINC000450695085	DC	On-Demand	Anodyne	CA4	24	42
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1cscn1	ZINC000450695088	FG	On-Demand	Anodyne	OPRM1	15	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1cscn1	ZINC000450695088	FG	On-Demand	Anodyne	OPRD1	18	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1cscn1	ZINC000450695088	FG	On-Demand	Anodyne	ACHP_LYMST	16	42
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1cscn1	ZINC000450695088	FG	On-Demand	Anodyne	Q8WSF8_APLCA	33	42
NC(=O)c1ccc(CCC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)cc1	ZINC000450695093	GG	On-Demand	Anodyne	GRIN2B	46	40
NC(=O)c1ccc(CCC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)cc1	ZINC000450695093	GG	On-Demand	Anodyne	CCR3	51	43
CC/C=C\CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000450695100	CD	On-Demand	Bother	CA1	20	42
CC/C=C\CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000450695100	CD	On-Demand	Bother	CA9	22	42
CC/C=C\CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000450695100	CD	On-Demand	Bother	P96878_MYCTU	17	42
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695144	EG	On-Demand	Anodyne	DRD4	39	41
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695144	EG	On-Demand	Anodyne	SIGMAR1	51	40
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695144	EG	On-Demand	Anodyne	TIMP3	44	32
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695144	EG	On-Demand	Anodyne	BIRC2	33	41
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695144	EG	On-Demand	Anodyne	NPFFR1	46	33
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695145	EG	On-Demand	Anodyne	DRD4	39	41
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695145	EG	On-Demand	Anodyne	SIGMAR1	51	40
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695145	EG	On-Demand	Anodyne	TIMP3	44	32
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695145	EG	On-Demand	Anodyne	BIRC2	33	41
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695145	EG	On-Demand	Anodyne	NPFFR1	46	33
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695146	EG	On-Demand	Anodyne	DRD4	39	41
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695146	EG	On-Demand	Anodyne	SIGMAR1	51	40
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695146	EG	On-Demand	Anodyne	TIMP3	44	32
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695146	EG	On-Demand	Anodyne	BIRC2	33	41
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695146	EG	On-Demand	Anodyne	NPFFR1	46	33
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695147	EG	On-Demand	Anodyne	DRD4	39	41
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695147	EG	On-Demand	Anodyne	SIGMAR1	51	40
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695147	EG	On-Demand	Anodyne	TIMP3	44	32
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695147	EG	On-Demand	Anodyne	BIRC2	33	41
C[C@H](NC(=O)C1(C)CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695147	EG	On-Demand	Anodyne	NPFFR1	46	33
C=CCCCCNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450695182	CG	On-Demand	Mild	TRPV1	33	54
C=CCCCCNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450695182	CG	On-Demand	Mild	NCE103	29	51
C=CCCCCNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450695182	CG	On-Demand	Mild	P96878_MYCTU	19	51
COC(=O)CC1(CNC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])CCCCC1	ZINC000450695187	GF	On-Demand	Bother	HCN1	51	35
COC(=O)CC1(CNC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])CCCCC1	ZINC000450695187	GF	On-Demand	Bother	HCN4	49	35
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450695203	ED	On-Demand	Bother	TAAR1	16	40
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450695204	ED	On-Demand	Bother	TAAR1	16	40
C[C@@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450695205	CG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450695205	CG	On-Demand	Anodyne	PRCP	24	40
C[C@@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450695205	CG	On-Demand	Anodyne	CCR3	60	36
C[C@@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450695205	CG	On-Demand	Anodyne	CCR5	28	44
C[C@@H](O)CCN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450695205	CG	On-Demand	Anodyne	SLC18A3	32	44
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450695206	ED	On-Demand	Bother	TAAR1	16	40
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450695207	ED	On-Demand	Bother	TAAR1	16	40
C[C@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695208	CG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695208	CG	On-Demand	Anodyne	PRCP	24	40
C[C@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695208	CG	On-Demand	Anodyne	CCR3	60	36
C[C@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695208	CG	On-Demand	Anodyne	CCR5	28	44
C[C@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695208	CG	On-Demand	Anodyne	SLC18A3	32	44
C[C@@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695209	CG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695209	CG	On-Demand	Anodyne	PRCP	24	40
C[C@@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695209	CG	On-Demand	Anodyne	CCR3	60	36
C[C@@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695209	CG	On-Demand	Anodyne	CCR5	28	44
C[C@@H](O)CCN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695209	CG	On-Demand	Anodyne	SLC18A3	32	44
CCc1cnccc1CNC(=O)c1c(C)cccc1Cl	ZINC000450695219	CH	On-Demand	Anodyne	P2RX7	40	38
CCc1cnccc1CNC(=O)c1c(C)cccc1Cl	ZINC000450695219	CH	On-Demand	Anodyne	SCN10A	32	40
O=C1CC[C@H](CN2CCC3(CC2)OCCc2ccsc23)CCN1	ZINC000450695220	EF	On-Demand	Anodyne	OPRL1	0	42
O=C1CC[C@@H](CN2CCC3(CC2)OCCc2ccsc23)CCN1	ZINC000450695221	EF	On-Demand	Anodyne	OPRL1	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450695223	FH	On-Demand	Anodyne	OPRL1	51	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450695223	FH	On-Demand	Anodyne	SIGMAR1	15	61
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450695224	FH	On-Demand	Anodyne	OPRL1	51	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450695224	FH	On-Demand	Anodyne	SIGMAR1	15	61
C[C@@H](c1ccccc1)[C@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450695225	FH	On-Demand	Anodyne	OPRL1	51	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450695225	FH	On-Demand	Anodyne	SIGMAR1	15	61
C[C@H](c1ccccc1)[C@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450695226	FH	On-Demand	Anodyne	OPRL1	51	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450695226	FH	On-Demand	Anodyne	SIGMAR1	15	61
C[C@H](CN1CCC2(CC1)OCCc1ccsc12)S(C)(=O)=O	ZINC000450695227	EE	On-Demand	Anodyne	OPRL1	24	52
C[C@@H](CN1CCC2(CC1)OCCc1ccsc12)S(C)(=O)=O	ZINC000450695228	EE	On-Demand	Anodyne	OPRL1	24	52
Cn1cc(-c2ccc(C(=O)N3CCC(Cc4ccc(F)c(F)c4)CC3)o2)cn1	ZINC000450695250	GI	On-Demand	Anodyne	GRIN2B	40	38
Cn1cc(-c2ccc(C(=O)N3CCC(Cc4ccc(F)c(F)c4)CC3)o2)cn1	ZINC000450695250	GI	On-Demand	Anodyne	MAP3K7	42	31
CN(CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2)Cc1ccccc1	ZINC000450695264	GH	On-Demand	Anodyne	OPRM1	19	54
CN(CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2)Cc1ccccc1	ZINC000450695264	GH	On-Demand	Anodyne	OPRD1	21	54
CN(CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2)Cc1ccccc1	ZINC000450695264	GH	On-Demand	Anodyne	KCNH2	31	41
CN(CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2)Cc1ccccc1	ZINC000450695264	GH	On-Demand	Anodyne	ACHP_LYMST	27	47
CN(CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2)Cc1ccccc1	ZINC000450695264	GH	On-Demand	Anodyne	Q8WSF8_APLCA	42	47
CN(CCN1CC(=O)N(C)C1)Cc1ccccc1	ZINC000450695273	BC	On-Demand	Anodyne	SIGMAR1	22	47
CCn1c(SCc2ccc(Cl)c(OC)c2)nnc1-c1ccccc1OC	ZINC000450695274	GJ	On-Demand	Anodyne	AGTR1	16	41
CCC[C@@H](O)CN1CCO[C@@H](Cc2ccccc2)C1	ZINC000450695276	CE	On-Demand	Anodyne	LUCI_PHOPY	50	31
CCC[C@H](O)CN1CCO[C@@H](Cc2ccccc2)C1	ZINC000450695278	CE	On-Demand	Anodyne	LUCI_PHOPY	50	31
CCC[C@@H](O)CN1CCO[C@H](Cc2ccccc2)C1	ZINC000450695279	CE	On-Demand	Anodyne	LUCI_PHOPY	50	31
CCC[C@H](O)CN1CCO[C@H](Cc2ccccc2)C1	ZINC000450695281	CE	On-Demand	Anodyne	LUCI_PHOPY	50	31
CC(C)N1CCCC[C@H]1CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450695285	FH	On-Demand	Anodyne	AKT2	50	34
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450695287	FH	On-Demand	Anodyne	AKT2	50	34
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450695289	FH	On-Demand	Anodyne	AKT2	50	34
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450695294	FH	On-Demand	Anodyne	AKT2	50	34
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	DRD2	24	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	DRD4	61	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	ACHE	33	44
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	SLC6A1	44	37
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	DRD3	27	41
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	TACR2	36	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	SIGMAR1	41	48
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	CCR5	53	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	TACR3	19	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	PYGM	40	36
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	MCHR1	20	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695302	FI	On-Demand	Anodyne	BIRC2	24	43
COc1cc(-c2noc(CN3CCC4(CC3)OCCc3ccsc34)n2)ncn1	ZINC000450695303	GF	On-Demand	Anodyne	OPRL1	45	39
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	DRD2	24	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	DRD4	61	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	ACHE	33	44
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	SLC6A1	44	37
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	DRD3	27	41
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	TACR2	36	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	SIGMAR1	41	48
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	CCR5	53	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	TACR3	19	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	PYGM	40	36
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	MCHR1	20	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695310	FI	On-Demand	Anodyne	BIRC2	24	43
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	DRD2	24	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	DRD4	61	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	ACHE	33	44
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	SLC6A1	44	37
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	DRD3	27	41
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	TACR2	36	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	SIGMAR1	41	48
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	CCR5	53	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	TACR3	19	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	PYGM	40	36
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	MCHR1	20	42
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450695312	FI	On-Demand	Anodyne	BIRC2	24	43
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	DRD2	24	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	DRD4	61	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	ACHE	33	44
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	SLC6A1	44	37
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	DRD3	27	41
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	TACR2	36	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	SIGMAR1	41	48
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	CCR5	53	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	TACR3	19	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	PYGM	40	36
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	MCHR1	20	42
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450695313	FI	On-Demand	Anodyne	BIRC2	24	43
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	MME	53	48
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	TIMP3	74	39
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	CAPNS1	48	37
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	CAPN1	61	42
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	CAPN2	87	37
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	ACE2	50	32
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	NPPA	45	34
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	NPR	49	39
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	PSMB8	49	38
COC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695332	ED	On-Demand	Anodyne	SLC12A5	49	36
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	MME	53	48
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	TIMP3	74	39
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	CAPNS1	48	37
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	CAPN1	61	42
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	CAPN2	87	37
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	ACE2	50	32
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	NPPA	45	34
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	NPR	49	39
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	PSMB8	49	38
COC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450695335	ED	On-Demand	Anodyne	SLC12A5	49	36
CCOC(=O)c1ccc(CN2CCc3cc(OC)c(F)cc3C2)nc1	ZINC000450695359	EF	On-Demand	Anodyne	ABCB1	29	44
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450695367	CD	On-Demand	Bother	CA2	50	42
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450695367	CD	On-Demand	Bother	CA1	47	35
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450695367	CD	On-Demand	Bother	CA5B	43	34
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450695367	CD	On-Demand	Bother	CA5A	49	34
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450695369	FH	On-Demand	Anodyne	PAPA1_CARPA	40	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450695369	FH	On-Demand	Anodyne	CAPNS1	43	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450695369	FH	On-Demand	Anodyne	MTTP	40	32
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450695369	FH	On-Demand	Anodyne	ACE2	44	36
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450695371	FH	On-Demand	Anodyne	PAPA1_CARPA	40	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450695371	FH	On-Demand	Anodyne	CAPNS1	43	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450695371	FH	On-Demand	Anodyne	MTTP	40	32
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450695371	FH	On-Demand	Anodyne	ACE2	44	36
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450695373	FH	On-Demand	Anodyne	PAPA1_CARPA	40	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450695373	FH	On-Demand	Anodyne	CAPNS1	43	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450695373	FH	On-Demand	Anodyne	MTTP	40	32
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450695373	FH	On-Demand	Anodyne	ACE2	44	36
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450695375	FH	On-Demand	Anodyne	PAPA1_CARPA	40	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450695375	FH	On-Demand	Anodyne	CAPNS1	43	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450695375	FH	On-Demand	Anodyne	MTTP	40	32
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450695375	FH	On-Demand	Anodyne	ACE2	44	36
COc1ccc(CN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695381	GG	On-Demand	Anodyne	PPARG	16	42
COc1ccc(CN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695381	GG	On-Demand	Anodyne	PPARA	22	42
COc1ccc(CN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695381	GG	On-Demand	Anodyne	MMP3	19	43
COc1ccc(CN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695381	GG	On-Demand	Anodyne	NPY5R	16	42
COc1ccc(CN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695381	GG	On-Demand	Anodyne	MMP9	20	43
COc1ccc(CN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695381	GG	On-Demand	Anodyne	MMP12	17	43
COc1ccc(CN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695381	GG	On-Demand	Anodyne	MMP1	26	43
COc1ccc(CN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695381	GG	On-Demand	Anodyne	POL	0	46
COc1ccc(CN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695382	GG	On-Demand	Anodyne	PPARG	16	42
COc1ccc(CN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695382	GG	On-Demand	Anodyne	PPARA	22	42
COc1ccc(CN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695382	GG	On-Demand	Anodyne	MMP3	19	43
COc1ccc(CN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695382	GG	On-Demand	Anodyne	NPY5R	16	42
COc1ccc(CN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695382	GG	On-Demand	Anodyne	MMP9	20	43
COc1ccc(CN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695382	GG	On-Demand	Anodyne	MMP12	17	43
COc1ccc(CN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695382	GG	On-Demand	Anodyne	MMP1	26	43
COc1ccc(CN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](CO)C(C)C)cc1	ZINC000450695382	GG	On-Demand	Anodyne	POL	0	46
Fc1ccc(N2CCN(Cc3nnc(C4CC4)s3)CC2)nc1	ZINC000450695386	DE	On-Demand	Anodyne	SLC27A1	25	40
COc1ccc(-c2n[nH]c(SCC(=O)CC(C)(C)C3CC3)n2)cc1	ZINC000450695398	EH	On-Demand	Anodyne	GCN5	0	44
COc1ccc(-c2n[nH]c(SCC(=O)CC(C)(C)C3CC3)n2)cc1	ZINC000450695398	EH	On-Demand	Anodyne	RTT109	0	45
Cc1ccc(SC[C@H](C)NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450695418	FG	On-Demand	Anodyne	PARP3	21	40
Cc1ccc(SC[C@@H](C)NC(=O)CCc2nc3cnccc3[nH]2)cc1	ZINC000450695420	FG	On-Demand	Anodyne	PARP3	21	40
COc1cccc(-c2nnn(C[C@@H](C)S(C)(=O)=O)n2)c1	ZINC000450695465	CC	On-Demand	Anodyne	SCARB1	28	49
COc1cccc(-c2nnn(C[C@H](C)S(C)(=O)=O)n2)c1	ZINC000450695466	CC	On-Demand	Anodyne	SCARB1	28	49
COc1cnc(N[C@@H](C)CC(C)(C)O)nc1N[C@H](C)CC(C)(C)O	ZINC000450695507	ED	On-Demand	Anodyne	P2RX2	64	43
COc1cnc(N[C@@H](C)CC(C)(C)O)nc1N[C@H](C)CC(C)(C)O	ZINC000450695507	ED	On-Demand	Anodyne	P2RX3	51	43
COc1cnc(N[C@H](C)CC(C)(C)O)nc1N[C@@H](C)CC(C)(C)O	ZINC000450695510	ED	On-Demand	Anodyne	P2RX2	64	43
COc1cnc(N[C@H](C)CC(C)(C)O)nc1N[C@@H](C)CC(C)(C)O	ZINC000450695510	ED	On-Demand	Anodyne	P2RX3	51	43
COc1cnc(N[C@@H](C)CC(C)(C)O)nc1N[C@@H](C)CC(C)(C)O	ZINC000450695515	ED	On-Demand	Anodyne	P2RX2	64	43
COc1cnc(N[C@@H](C)CC(C)(C)O)nc1N[C@@H](C)CC(C)(C)O	ZINC000450695515	ED	On-Demand	Anodyne	P2RX3	51	43
COc1cnc(N[C@H](C)CC(C)(C)O)nc1N[C@H](C)CC(C)(C)O	ZINC000450695519	ED	On-Demand	Anodyne	P2RX2	64	43
COc1cnc(N[C@H](C)CC(C)(C)O)nc1N[C@H](C)CC(C)(C)O	ZINC000450695519	ED	On-Demand	Anodyne	P2RX3	51	43
CC/C=C\CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695525	BC	On-Demand	Anodyne	CA2	53	40
CC/C=C\CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695525	BC	On-Demand	Anodyne	CA1	40	38
CC/C=C\CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695525	BC	On-Demand	Anodyne	CA7	43	37
CC/C=C\CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695525	BC	On-Demand	Anodyne	CA9	37	40
CC/C=C\CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695525	BC	On-Demand	Anodyne	CYNT	44	32
COC[C@@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450695526	EC	On-Demand	Bother	CACNA1D	57	33
COC[C@@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450695526	EC	On-Demand	Bother	CCR3	0	45
CC/C=C/CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695527	BC	On-Demand	Anodyne	CA2	53	40
CC/C=C/CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695527	BC	On-Demand	Anodyne	CA1	40	38
CC/C=C/CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695527	BC	On-Demand	Anodyne	CA7	43	37
CC/C=C/CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695527	BC	On-Demand	Anodyne	CA9	37	40
CC/C=C/CNc1ccc(S(N)(=O)=O)cn1	ZINC000450695527	BC	On-Demand	Anodyne	CYNT	44	32
COC[C@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450695529	EC	On-Demand	Bother	CACNA1D	57	33
COC[C@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450695529	EC	On-Demand	Bother	CCR3	0	45
Cc1nc(N2CC(C(=O)OC(C)(C)C)C2)c2c(C)csc2n1	ZINC000450695537	DG	On-Demand	Anodyne	UL26	41	30
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	ADORA1	118	52
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	SLC29A1	125	54
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	ADORA2A	40	49
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	ADORA2B	31	49
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	ADK	41	51
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	AHCY	45	37
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	P2RX1	41	35
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	P2RY1	51	37
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	ITPR1	49	36
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	NS5B	0	42
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	ADORA3	85	51
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	OXGR1	110	37
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	AK	0	45
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	DNMT3B	56	38
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	Q4VQ11_PIG	72	49
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695538	GC	On-Demand	Anodyne	DOT1L	75	37
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	ADORA1	118	52
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	SLC29A1	125	54
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	ADORA2A	40	49
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	ADORA2B	31	49
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	ADK	41	51
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	AHCY	45	37
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	P2RX1	41	35
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	P2RY1	51	37
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	ITPR1	49	36
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	NS5B	0	42
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	ADORA3	85	51
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	OXGR1	110	37
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	AK	0	45
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	DNMT3B	56	38
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	Q4VQ11_PIG	72	49
C[C@@]12CN(c3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450695549	GC	On-Demand	Anodyne	DOT1L	75	37
O=C(Nc1nc(-c2ccc(O)c(Cl)c2)n[nH]1)c1ccc(CN2CCCC2)cc1	ZINC000450695555	GH	On-Demand	Anodyne	HDAC1	16	44
O=C(Nc1nc(-c2ccc(O)c(Cl)c2)n[nH]1)c1ccc(CN2CCCC2)cc1	ZINC000450695555	GH	On-Demand	Anodyne	FLT3	23	41
O=C(Nc1nc(-c2ccc(O)c(Cl)c2)n[nH]1)c1ccc(CN2CCCC2)cc1	ZINC000450695555	GH	On-Demand	Anodyne	CHEK1	15	40
O=C(Nc1nc(-c2ccc(O)c(Cl)c2)n[nH]1)c1ccc(CN2CCCC2)cc1	ZINC000450695555	GH	On-Demand	Anodyne	MCHR1	21	48
O=C(Nc1nc(-c2ccc(O)c(Cl)c2)n[nH]1)c1ccc(CN2CCCC2)cc1	ZINC000450695555	GH	On-Demand	Anodyne	NOD2	40	35
CCc1cc(CCCN2CCC3(CC2)OCCc2ccsc23)on1	ZINC000450695556	EH	On-Demand	Anodyne	OPRL1	44	35
Cc1cccc(-c2nnc(SCC[C@@H](C)O)n2C)c1	ZINC000450695561	CF	On-Demand	Anodyne	DRD3	52	38
Cc1cccc(-c2nnc(SCC[C@H](C)O)n2C)c1	ZINC000450695562	CF	On-Demand	Anodyne	DRD3	52	38
CCOC(=O)C1CCC(Sc2ccc(C(=O)NC)cc2[N+](=O)[O-])CC1	ZINC000450695567	FG	On-Demand	Bother	GSTM2	47	36
COc1ccccc1-c1nnc(SCC[C@H]2CCOC2)n1C	ZINC000450695568	DG	On-Demand	Anodyne	KCNH2	19	45
COc1ccccc1-c1nnc(SCC[C@@H]2CCOC2)n1C	ZINC000450695569	DG	On-Demand	Anodyne	KCNH2	19	45
C[C@H](CC(C)(C)O)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450695574	DE	On-Demand	Anodyne	LRRK2	32	45
O=C1CC[C@@H](CN2CCC[C@H](c3ccc(F)cc3)CC2)CCN1	ZINC000450695575	DG	On-Demand	Anodyne	DRD2	15	40
C[C@@H](CC(C)(C)O)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450695576	DE	On-Demand	Anodyne	LRRK2	32	45
O=C1CC[C@H](CN2CCC[C@H](c3ccc(F)cc3)CC2)CCN1	ZINC000450695577	DG	On-Demand	Anodyne	DRD2	15	40
O=C1CC[C@@H](CN2CCC[C@@H](c3ccc(F)cc3)CC2)CCN1	ZINC000450695578	DG	On-Demand	Anodyne	DRD2	15	40
O=C1CC[C@H](CN2CCC[C@@H](c3ccc(F)cc3)CC2)CCN1	ZINC000450695579	DG	On-Demand	Anodyne	DRD2	15	40
COC(=O)CC1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCCCC1	ZINC000450695612	GH	On-Demand	Anodyne	HCN1	52	35
COC(=O)CC1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCCCC1	ZINC000450695612	GH	On-Demand	Anodyne	HCN4	50	35
CC[C@H](O)CC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000450695622	CG	On-Demand	Anodyne	NPFFR2	25	43
CC[C@H](O)CC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000450695622	CG	On-Demand	Anodyne	NPFFR1	45	46
CC[C@H](O)CC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000450695622	CG	On-Demand	Anodyne	SLC12A5	40	36
CC[C@@H](O)CC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000450695623	CG	On-Demand	Anodyne	NPFFR2	25	43
CC[C@@H](O)CC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000450695623	CG	On-Demand	Anodyne	NPFFR1	45	46
CC[C@@H](O)CC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000450695623	CG	On-Demand	Anodyne	SLC12A5	40	36
COC(=O)CC1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCCC1	ZINC000450695635	GG	On-Demand	Bother	CACNA1C	57	37
COC(=O)CC1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCCC1	ZINC000450695635	GG	On-Demand	Bother	CACNA1D	89	36
CC1(C(=O)NCC2(Cc3ccccc3)CCCC2)CCC(=O)CC1	ZINC000450695648	EI	On-Demand	Anodyne	NPFFR1	15	41
CC1(C(=O)NCC2(Cc3ccccc3)CCCC2)CCC(=O)CC1	ZINC000450695648	EI	On-Demand	Anodyne	SLC12A5	43	33
COC(=O)c1coc(CN[C@H](c2ccc(F)c(C)c2)C2CC2)n1	ZINC000450695653	DG	On-Demand	Anodyne	LEF	41	35
COC(=O)c1coc(CN[C@@H](c2ccc(F)c(C)c2)C2CC2)n1	ZINC000450695654	DG	On-Demand	Anodyne	LEF	41	35
CO[C@@H]1COCC[C@H]1CNc1ncc([N+](=O)[O-])cc1Cl	ZINC000450695665	DE	On-Demand	Bother	PRKCQ	42	36
CO[C@H]1COCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1Cl	ZINC000450695666	DE	On-Demand	Bother	PRKCQ	42	36
CO[C@H]1COCC[C@H]1CNc1ncc([N+](=O)[O-])cc1Cl	ZINC000450695667	DE	On-Demand	Bother	PRKCQ	42	36
CO[C@@H]1COCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1Cl	ZINC000450695668	DE	On-Demand	Bother	PRKCQ	42	36
COC(=O)CC1(CNC(=O)[C@H](Cc2ccccc2)OC)CCCCC1	ZINC000450695673	EF	On-Demand	Anodyne	ACAT	0	43
COC(=O)CC1(CNC(=O)[C@@H](Cc2ccccc2)OC)CCCCC1	ZINC000450695674	EF	On-Demand	Anodyne	ACAT	0	43
CC/C=C\CN=c1ccc(C(=O)N2CCC(C)CC2)c[nH]1	ZINC000450695676	CF	On-Demand	Anodyne	L3MBTL3	46	36
CC/C=C/CN=c1ccc(C(=O)N2CCC(C)CC2)c[nH]1	ZINC000450695677	CF	On-Demand	Anodyne	L3MBTL3	46	36
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450695683	DD	On-Demand	Anodyne	CA2	65	39
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450695683	DD	On-Demand	Anodyne	CA1	55	37
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450695683	DD	On-Demand	Anodyne	CA7	48	36
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450695683	DD	On-Demand	Anodyne	CA5B	48	36
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450695683	DD	On-Demand	Anodyne	CA4	57	38
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450695683	DD	On-Demand	Anodyne	CA5A	51	36
CC/C=C\CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450695683	DD	On-Demand	Anodyne	CAH_METTE	47	33
CC(C)[C@@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(=O)OC(C)(C)C	ZINC000450695710	DG	On-Demand	Anodyne	POL	0	44
CC(C)[C@@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(=O)OC(C)(C)C	ZINC000450695711	DG	On-Demand	Anodyne	POL	0	44
CC(C)[C@@H](NC[C@H](O)[C@H](C)c1ccccc1)C(=O)OC(C)(C)C	ZINC000450695712	DG	On-Demand	Anodyne	POL	0	44
O=C(c1cc2cccnc2s1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450695726	FJ	On-Demand	Anodyne	GRIN2B	53	39
O=C(c1cc2cccnc2s1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450695726	FJ	On-Demand	Anodyne	CCR3	30	43
O=C(c1cc2cccnc2s1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450695726	FJ	On-Demand	Anodyne	MLNR	16	42
COC[C@H](NC(=O)C1(c2ccccc2Br)CCCCC1)C(=O)OC	ZINC000450695752	GF	On-Demand	Anodyne	ECE1	20	42
COC[C@H](NC(=O)C1(c2ccccc2Br)CCCCC1)C(=O)OC	ZINC000450695752	GF	On-Demand	Anodyne	NPPA	46	37
COC[C@@H](NC(=O)C1(c2ccccc2Br)CCCCC1)C(=O)OC	ZINC000450695753	GF	On-Demand	Anodyne	ECE1	20	42
COC[C@@H](NC(=O)C1(c2ccccc2Br)CCCCC1)C(=O)OC	ZINC000450695753	GF	On-Demand	Anodyne	NPPA	46	37
CCNc1ccc(Cl)cc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450695755	DI	On-Demand	Anodyne	PTGER1	36	41
C[C@H](CC(C)(C)O)Nc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450695756	FE	On-Demand	Anodyne	CA2	15	47
C[C@H](CC(C)(C)O)Nc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450695756	FE	On-Demand	Anodyne	CA4	17	47
C[C@@H](CC(C)(C)O)Nc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450695757	FE	On-Demand	Anodyne	CA2	15	47
C[C@@H](CC(C)(C)O)Nc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450695757	FE	On-Demand	Anodyne	CA4	17	47
CCC(=O)C1(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000450695758	EH	On-Demand	Anodyne	GRIN2B	40	36
CCC(=O)C1(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000450695758	EH	On-Demand	Anodyne	CCR3	31	41
CCOC(=O)c1cc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)on1	ZINC000450695759	GG	On-Demand	Anodyne	GRIN2B	43	38
Fc1ccc(N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)nc1	ZINC000450695764	CD	On-Demand	Anodyne	SLC27A1	40	38
Fc1ccc(N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)nc1	ZINC000450695765	CD	On-Demand	Anodyne	SLC27A1	40	38
O=C([C@H](O)C1CCC1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695768	DG	On-Demand	Anodyne	CCR1	41	42
O=C([C@@H](O)C1CCC1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450695769	DG	On-Demand	Anodyne	CCR1	41	42
O=C([C@@H](O)C1CCC1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450695770	DG	On-Demand	Anodyne	CCR1	41	42
O=C([C@H](O)C1CCC1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450695772	DG	On-Demand	Anodyne	CCR1	41	42
C[C@H](Oc1ccccn1)C(=O)N[C@H](C)CCC1CC1	ZINC000450695774	CF	On-Demand	Anodyne	ACACA	25	50
C[C@@H](CCC1CC1)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450695775	CF	On-Demand	Anodyne	ACACA	25	50
C[C@@H](CCC1CC1)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450695777	CF	On-Demand	Anodyne	ACACA	25	50
C[C@H](CCC1CC1)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450695778	CF	On-Demand	Anodyne	ACACA	25	50
CC(C)C[C@@H](C)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450695779	EI	On-Demand	Anodyne	OPRM1	16	42
CC(C)C[C@@H](C)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450695779	EI	On-Demand	Anodyne	OPRD1	19	46
O=C(N1CCC(Cc2ccc(F)c(F)c2)CC1)C1(C(F)(F)F)CCC1	ZINC000450695784	FI	On-Demand	Anodyne	CCR3	25	41
CC(C)C[C@H](C)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450695795	EI	On-Demand	Anodyne	OPRM1	16	42
CC(C)C[C@H](C)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450695795	EI	On-Demand	Anodyne	OPRD1	19	46
CCn1c(SCc2nc(C(=O)OC)co2)nnc1-c1ccccc1OC	ZINC000450695801	FG	On-Demand	Anodyne	HCRTR2	16	42
CCn1c(SCc2nc(C(=O)OC)co2)nnc1-c1ccccc1OC	ZINC000450695801	FG	On-Demand	Anodyne	SLC27A1	44	38
CSc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450695802	EI	On-Demand	Anodyne	RBP4	15	41
CSc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450695802	EI	On-Demand	Anodyne	RHOA	0	45
CSc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450695802	EI	On-Demand	Anodyne	L3MBTL1	0	44
CSc1cccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450695802	EI	On-Demand	Anodyne	L3MBTL3	66	44
CSc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450695803	EI	On-Demand	Anodyne	RBP4	15	41
CSc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450695803	EI	On-Demand	Anodyne	RHOA	0	45
CSc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450695803	EI	On-Demand	Anodyne	L3MBTL1	0	44
CSc1cccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450695803	EI	On-Demand	Anodyne	L3MBTL3	66	44
CNC(=O)c1cccnc1N[C@H](C)CC(C)(C)O	ZINC000450695804	CD	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	43
CNC(=O)c1cccnc1N[C@@H](C)CC(C)(C)O	ZINC000450695805	CD	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	43
COc1ccc(CN(C(=O)c2ccc(C)nc2C)[C@H](CO)C(C)C)cc1	ZINC000450695827	FG	On-Demand	Anodyne	ACAT	50	39
C1=C(CCN2CCC3(CC2)OCCc2ccsc23)CCCC1	ZINC000450695841	DJ	On-Demand	Anodyne	OPRL1	42	33
CO[C@H]1COCC[C@@H]1CNc1ccnc2c(Cl)cccc12	ZINC000450695849	DG	On-Demand	Anodyne	HRP1_PLAFA	49	34
CO[C@@H]1COCC[C@@H]1CNc1ccnc2c(Cl)cccc12	ZINC000450695850	DG	On-Demand	Anodyne	HRP1_PLAFA	49	34
CO[C@H]1COCC[C@H]1CNc1ccnc2c(Cl)cccc12	ZINC000450695851	DG	On-Demand	Anodyne	HRP1_PLAFA	49	34
CO[C@@H]1COCC[C@H]1CNc1ccnc2c(Cl)cccc12	ZINC000450695853	DG	On-Demand	Anodyne	HRP1_PLAFA	49	34
COc1ncc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)cc1Cl	ZINC000450695855	GF	On-Demand	Anodyne	PDE5A	29	43
COc1ncc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)cc1Cl	ZINC000450695855	GF	On-Demand	Anodyne	PDE6A	41	31
COc1ncc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)cc1Cl	ZINC000450695855	GF	On-Demand	Anodyne	STAT6	40	34
COc1ncc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)cc1Cl	ZINC000450695855	GF	On-Demand	Anodyne	LRRK2	37	49
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	F2	66	42
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	PRSS1	21	42
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	ACE	43	45
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	OPRM1	24	40
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	OPRD1	15	40
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	CELA1	51	36
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	ELANE	91	45
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	TACR1	15	43
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	TRY1_BOVIN	92	38
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	PREP	78	49
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	LGMN	68	37
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	PEPD	0	41
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	XPNPEP2	0	41
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	XIAP	84	48
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	FAP	0	41
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	BIRC3	44	35
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	BIRC8	55	33
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	BRCA1	63	34
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	TMPRSS11D	59	35
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000450695857	GG	On-Demand	Anodyne	MLX	0	42
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	F2	66	42
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	PRSS1	21	42
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	ACE	43	45
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	OPRM1	24	40
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	OPRD1	15	40
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	CELA1	51	36
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	ELANE	91	45
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	TACR1	15	43
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	TRY1_BOVIN	92	38
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	PREP	78	49
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	LGMN	68	37
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	PEPD	0	41
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	XPNPEP2	0	41
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	XIAP	84	48
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	FAP	0	41
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	BIRC3	44	35
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	BIRC8	55	33
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	BRCA1	63	34
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	TMPRSS11D	59	35
C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000450695859	GG	On-Demand	Anodyne	MLX	0	42
CC(C)(C)OC(=O)C1CN(c2ncnc3c2ncn3C2CC2)C1	ZINC000450695864	DD	On-Demand	Anodyne	ADCY5	26	41
CC(C)(C)OC(=O)C1CN(c2ncnc3c2ncn3C2CC2)C1	ZINC000450695864	DD	On-Demand	Anodyne	OXGR1	47	32
C[C@H]1OCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450695865	DE	On-Demand	Anodyne	GSK3A	18	43
C[C@@H]1OCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450695866	DE	On-Demand	Anodyne	GSK3A	18	43
C[C@@H]1OCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450695867	DE	On-Demand	Anodyne	GSK3A	18	43
C[C@H]1OCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450695868	DE	On-Demand	Anodyne	GSK3A	18	43
CC(C)(C)OC(=O)C1CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450695871	DF	On-Demand	Anodyne	PDE3A	45	36
CC(C)(C)OC(=O)C1CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450695871	DF	On-Demand	Anodyne	PDGFRB	36	43
CC(C)(C)OC(=O)C1CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450695871	DF	On-Demand	Anodyne	PDE3B	66	34
CC(C)(C)OC(=O)C1CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450695871	DF	On-Demand	Anodyne	SIRT3	44	37
C[C@@H](NC(=O)CCCC(=O)C(C)(C)C)[C@@H](c1ccccc1)N(C)C	ZINC000450695878	EH	On-Demand	Anodyne	ACER2	0	47
C[C@@H](NC(=O)CCCC(=O)C(C)(C)C)[C@H](c1ccccc1)N(C)C	ZINC000450695879	EH	On-Demand	Anodyne	ACER2	0	47
C[C@H](NC(=O)CCCC(=O)C(C)(C)C)[C@H](c1ccccc1)N(C)C	ZINC000450695880	EH	On-Demand	Anodyne	ACER2	0	47
C[C@H](NC(=O)CCCC(=O)C(C)(C)C)[C@@H](c1ccccc1)N(C)C	ZINC000450695881	EH	On-Demand	Anodyne	ACER2	0	47
COc1cc2c(N3CC(C(=O)OC(C)(C)C)C3)ncnc2cc1F	ZINC000450695935	EF	On-Demand	Anodyne	PDE3A	56	43
COc1cc2c(N3CC(C(=O)OC(C)(C)C)C3)ncnc2cc1F	ZINC000450695935	EF	On-Demand	Anodyne	PDGFRB	71	45
COc1cc2c(N3CC(C(=O)OC(C)(C)C)C3)ncnc2cc1F	ZINC000450695935	EF	On-Demand	Anodyne	PDE3B	81	42
Clc1ccc(CCN2CCC[C@H]2C2CCOCC2)cc1	ZINC000450695948	CH	On-Demand	Anodyne	HRH3	47	47
Clc1ccc(CCN2CCC[C@@H]2C2CCOCC2)cc1	ZINC000450695949	CH	On-Demand	Anodyne	HRH3	47	47
COc1ccc(CNC(=O)CCN2CCO[C@@H](C(C)C)C2)c(OC)c1	ZINC000450695950	FE	On-Demand	Anodyne	MTNR1A	41	36
CNS(=O)(=O)NCC(=O)N(Cc1ccc(OC)cc1)[C@H](CO)C(C)C	ZINC000450695951	FC	On-Demand	Anodyne	BMP1	55	38
COc1ccc(CNC(=O)CCN2CCO[C@H](C(C)C)C2)c(OC)c1	ZINC000450695952	FE	On-Demand	Anodyne	MTNR1A	41	36
COc1ncc(CNc2nccc(C(C)(C)C)n2)cc1Cl	ZINC000450695961	DG	On-Demand	Anodyne	CLK4	22	50
Cc1nn(C)cc1COc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000450695985	CF	On-Demand	Bother	S1PR4	23	49
CN(CCN1CCC(n2ccc(C(F)(F)F)n2)CC1)Cc1ccccc1	ZINC000450695988	FH	On-Demand	Anodyne	SIGMAR1	29	40
CN(CCN1CCC(n2ccc(C(F)(F)F)n2)CC1)Cc1ccccc1	ZINC000450695988	FH	On-Demand	Anodyne	CCR5	46	36
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H](c1ccccc1)N(C)C	ZINC000450696003	FH	On-Demand	Anodyne	TACR3	28	45
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H](c1ccccc1)N(C)C	ZINC000450696003	FH	On-Demand	Anodyne	CTSV	45	31
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H](c1ccccc1)N(C)C	ZINC000450696004	FH	On-Demand	Anodyne	TACR3	28	45
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H](c1ccccc1)N(C)C	ZINC000450696004	FH	On-Demand	Anodyne	CTSV	45	31
CC(C)[C@@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(=O)OC(C)(C)C	ZINC000450696005	DG	On-Demand	Anodyne	POL	0	44
CC/C=C\CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450696009	EE	On-Demand	Bother	TAAR1	17	46
CC/C=C\CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450696010	EE	On-Demand	Bother	TAAR1	17	46
CC/C=C/CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450696011	EE	On-Demand	Bother	TAAR1	17	46
CC/C=C/CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450696012	EE	On-Demand	Bother	TAAR1	17	46
CC/C=C\CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450696021	FD	On-Demand	Bother	DDIT3	0	43
CC/C=C/CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450696022	FD	On-Demand	Bother	DDIT3	0	43
CO[C@H]1COCC[C@@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450696023	DE	On-Demand	Bother	TAAR1	16	41
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450696024	DE	On-Demand	Bother	TAAR1	16	41
CO[C@@H]1COCC[C@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450696025	DE	On-Demand	Bother	TAAR1	16	41
CO[C@H]1COCC[C@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450696026	DE	On-Demand	Bother	TAAR1	16	41
COc1cccc(-c2nnc(SCC3CC(F)(F)C3)n2Cc2ccco2)c1	ZINC000450696027	GJ	On-Demand	Anodyne	HCRTR2	20	44
CCOC(=O)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)CC	ZINC000450696033	EF	On-Demand	Anodyne	RORC	47	35
CCOC(=O)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)[C@H](C)CC	ZINC000450696034	EF	On-Demand	Anodyne	RORC	47	35
CCOC(=O)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)[C@H](C)CC	ZINC000450696035	EF	On-Demand	Anodyne	RORC	47	35
CCOC(=O)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)[C@@H](C)CC	ZINC000450696036	EF	On-Demand	Anodyne	RORC	47	35
O=C(CS(=O)(=O)C1CC1)NCC1(Cc2ccccc2)CCCC1	ZINC000450696042	EE	On-Demand	Anodyne	NPFFR2	22	44
O=C(CS(=O)(=O)C1CC1)NCC1(Cc2ccccc2)CCCC1	ZINC000450696042	EE	On-Demand	Anodyne	NPFFR1	36	45
CO[C@@H]1COCC[C@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450696062	DF	On-Demand	Anodyne	MAOB	24	41
CO[C@H]1COCC[C@@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450696063	DF	On-Demand	Anodyne	MAOB	24	41
CO[C@@H]1COCC[C@@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450696064	DF	On-Demand	Anodyne	MAOB	24	41
CO[C@H]1COCC[C@H]1CNc1nc(-c2ccccc2)cs1	ZINC000450696065	DF	On-Demand	Anodyne	MAOB	24	41
CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)CC1CC(F)(F)C1	ZINC000450696075	EH	On-Demand	Anodyne	GRM2	36	41
CC1(C)[C@@H](NC(=O)CC2CC(F)(F)C2)C[C@@H]1OCc1ccccc1	ZINC000450696076	EH	On-Demand	Anodyne	GRM2	36	41
CC1(C)[C@H](NC(=O)CC2CC(F)(F)C2)C[C@H]1OCc1ccccc1	ZINC000450696077	EH	On-Demand	Anodyne	GRM2	36	41
CC1(C)[C@@H](NC(=O)CC2CC(F)(F)C2)C[C@H]1OCc1ccccc1	ZINC000450696078	EH	On-Demand	Anodyne	GRM2	36	41
COC(=O)C[C@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2ccccc2)cc1	ZINC000450696079	GH	On-Demand	Anodyne	P2RY12	74	33
COC(=O)C[C@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2ccccc2)cc1	ZINC000450696079	GH	On-Demand	Anodyne	UTS2	63	39
COC(=O)C[C@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2ccccc2)cc1	ZINC000450696079	GH	On-Demand	Anodyne	CTSA	72	38
COC(=O)C[C@@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2ccccc2)cc1	ZINC000450696080	GH	On-Demand	Anodyne	P2RY12	74	33
COC(=O)C[C@@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2ccccc2)cc1	ZINC000450696080	GH	On-Demand	Anodyne	UTS2	63	39
COC(=O)C[C@@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(-c2ccccc2)cc1	ZINC000450696080	GH	On-Demand	Anodyne	CTSA	72	38
CCSc1cccnc1C(=O)NCC1(CC(=O)OC)CCCCC1	ZINC000450696081	FG	On-Demand	Anodyne	HCN1	55	33
CCSc1cccnc1C(=O)NCC1(CC(=O)OC)CCCCC1	ZINC000450696081	FG	On-Demand	Anodyne	HCN4	52	33
COc1cccc(OCCC(=O)NCc2ccc(OC(C)(C)C)nc2)c1	ZINC000450696090	FG	On-Demand	Anodyne	MTNR1A	43	41
COc1cccc(OCCC(=O)NCc2ccc(OC(C)(C)C)nc2)c1	ZINC000450696090	FG	On-Demand	Anodyne	MTNR1B	40	41
CCCCN(CCCO)Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450696107	DG	On-Demand	Anodyne	PLM2_PLAFA	46	37
CCNc1ccc(Cl)cc1NC(=O)c1sc(COCC)nc1C	ZINC000450696125	FI	On-Demand	Anodyne	F10	22	45
C[C@@H](CCC1CC1)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450696128	DF	On-Demand	Anodyne	SLC18A2	40	37
C[C@H](CCC1CC1)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450696129	DF	On-Demand	Anodyne	SLC18A2	40	37
Cc1cnc(CCCC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)o1	ZINC000450696148	FI	On-Demand	Anodyne	CCR3	24	42
Cc1nc(C)n(CCCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)n1	ZINC000450696151	EF	On-Demand	Anodyne	ETHR	47	34
Cc1nc(C)n(CCCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)n1	ZINC000450696152	EF	On-Demand	Anodyne	ETHR	47	34
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H](c1ccccc1)N(C)C	ZINC000450696172	FH	On-Demand	Anodyne	TACR3	28	45
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H](c1ccccc1)N(C)C	ZINC000450696172	FH	On-Demand	Anodyne	CTSV	45	31
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H](c1ccccc1)N(C)C	ZINC000450696174	FH	On-Demand	Anodyne	TACR3	28	45
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H](c1ccccc1)N(C)C	ZINC000450696174	FH	On-Demand	Anodyne	CTSV	45	31
CC(C)Oc1cc(F)ccc1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450696185	EI	On-Demand	Anodyne	TRPV1	66	35
CC(C)Oc1cc(F)ccc1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450696185	EI	On-Demand	Anodyne	KCNK3	36	41
CC(C)Oc1cc(F)ccc1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450696185	EI	On-Demand	Anodyne	KCNK9	36	41
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696199	DH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696199	DH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696199	DH	On-Demand	Anodyne	HTR2A	21	45
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696199	DH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696199	DH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696199	DH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696199	DH	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696200	DH	On-Demand	Anodyne	DRD2	28	41
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696200	DH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696200	DH	On-Demand	Anodyne	HTR2A	21	45
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696200	DH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696200	DH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696200	DH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccc(F)cc1	ZINC000450696200	DH	On-Demand	Anodyne	CYP2J2	51	36
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450696208	DG	On-Demand	Anodyne	HRP1_PLAFA	93	35
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450696208	DG	On-Demand	Anodyne	HNMT	47	33
O=C(CCCCN1CCOCC1)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696210	GE	On-Demand	Anodyne	CHRNA7	22	56
O=C(CCCCN1CCOCC1)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696210	GE	On-Demand	Anodyne	GSK3A	15	46
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450696212	DG	On-Demand	Anodyne	HRP1_PLAFA	93	35
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450696212	DG	On-Demand	Anodyne	HNMT	47	33
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450696217	DG	On-Demand	Anodyne	HRP1_PLAFA	93	35
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450696217	DG	On-Demand	Anodyne	HNMT	47	33
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450696221	DG	On-Demand	Anodyne	HRP1_PLAFA	93	35
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(F)c(Cl)cc12	ZINC000450696221	DG	On-Demand	Anodyne	HNMT	47	33
CC1(C)CN(CC(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450696222	FH	On-Demand	Anodyne	DRD2	32	44
CC1(C)CN(CC(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450696222	FH	On-Demand	Anodyne	DRD1	15	48
CC1(C)CN(CC(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450696222	FH	On-Demand	Anodyne	DRD4	0	45
CC1(C)CN(CC(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450696222	FH	On-Demand	Anodyne	HTR2A	15	44
CC1(C)CN(CC(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450696222	FH	On-Demand	Anodyne	ERG2	22	45
CC1(C)CN(CC(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450696222	FH	On-Demand	Anodyne	SLC18A3	0	48
CC1(C)CN(CC(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450696222	FH	On-Demand	Anodyne	CYP2J2	49	35
CCc1cnc(CNC(=O)Cc2ccc(OC)c(OC)c2Cl)o1	ZINC000450696226	EF	On-Demand	Anodyne	PDE4D	17	42
COc1ccc(-c2csc3ncnc(NC[C@H]4CCOC[C@@H]4OC)c23)cc1	ZINC000450696243	GH	On-Demand	Anodyne	ADRB3	22	42
COc1ccc(-c2csc3ncnc(NC[C@H]4CCOC[C@@H]4OC)c23)cc1	ZINC000450696243	GH	On-Demand	Anodyne	TNK2	48	41
COc1ccc(-c2csc3ncnc(NC[C@H]4CCOC[C@H]4OC)c23)cc1	ZINC000450696247	GH	On-Demand	Anodyne	ADRB3	22	42
COc1ccc(-c2csc3ncnc(NC[C@H]4CCOC[C@H]4OC)c23)cc1	ZINC000450696247	GH	On-Demand	Anodyne	TNK2	48	41
COc1ccc(-c2csc3ncnc(NC[C@@H]4CCOC[C@H]4OC)c23)cc1	ZINC000450696248	GH	On-Demand	Anodyne	ADRB3	22	42
COc1ccc(-c2csc3ncnc(NC[C@@H]4CCOC[C@H]4OC)c23)cc1	ZINC000450696248	GH	On-Demand	Anodyne	TNK2	48	41
COc1ccc(-c2csc3ncnc(NC[C@@H]4CCOC[C@@H]4OC)c23)cc1	ZINC000450696250	GH	On-Demand	Anodyne	ADRB3	22	42
COc1ccc(-c2csc3ncnc(NC[C@@H]4CCOC[C@@H]4OC)c23)cc1	ZINC000450696250	GH	On-Demand	Anodyne	TNK2	48	41
CCCOc1ccc(C(=O)NCc2nc(COc3ccccc3)n[nH]2)c(OC)c1	ZINC000450696257	GG	On-Demand	Anodyne	TSHR	46	31
CCCOc1ccc(C(=O)NCc2nc(COc3ccccc3)n[nH]2)c(OC)c1	ZINC000450696257	GG	On-Demand	Anodyne	CASR	17	41
O=S1(=O)CCN(C2CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450696279	GF	On-Demand	Anodyne	L3MBTL3	65	44
CO[C@@H](CNC1(C(N)=O)CC1)Cc1ccccc1	ZINC000450696280	BC	On-Demand	Anodyne	MME	43	39
CO[C@@H](CNC1(C(N)=O)CC1)Cc1ccccc1	ZINC000450696280	BC	On-Demand	Anodyne	TIMP3	46	37
CO[C@H](CNC1(C(N)=O)CC1)Cc1ccccc1	ZINC000450696281	BC	On-Demand	Anodyne	MME	43	39
CO[C@H](CNC1(C(N)=O)CC1)Cc1ccccc1	ZINC000450696281	BC	On-Demand	Anodyne	TIMP3	46	37
CCC[C@@H]1CN(C[C@](C)(O)C(C)=O)CCN1Cc1ccccc1	ZINC000450696306	DE	On-Demand	Anodyne	SIGMAR1	22	52
CCC[C@H]1CN(C[C@](C)(O)C(C)=O)CCN1Cc1ccccc1	ZINC000450696307	DE	On-Demand	Anodyne	SIGMAR1	22	52
CCC[C@H]1CN(C[C@@](C)(O)C(C)=O)CCN1Cc1ccccc1	ZINC000450696308	DE	On-Demand	Anodyne	SIGMAR1	22	52
CCC[C@@H]1CN(C[C@@](C)(O)C(C)=O)CCN1Cc1ccccc1	ZINC000450696309	DE	On-Demand	Anodyne	SIGMAR1	22	52
COC(=O)CC1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450696315	GF	On-Demand	Anodyne	HCN1	53	34
COC(=O)CC1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450696315	GF	On-Demand	Anodyne	HCN4	51	34
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696319	DF	On-Demand	Anodyne	SLC6A1	27	42
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696319	DF	On-Demand	Anodyne	OPRD1	21	51
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696319	DF	On-Demand	Anodyne	SLC6A3	24	42
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696319	DF	On-Demand	Anodyne	GLRA1	41	34
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696319	DF	On-Demand	Anodyne	ACHP_LYMST	25	44
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696319	DF	On-Demand	Anodyne	Q8WSF8_APLCA	50	44
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696323	DF	On-Demand	Anodyne	SLC6A1	27	42
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696323	DF	On-Demand	Anodyne	OPRD1	21	51
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696323	DF	On-Demand	Anodyne	SLC6A3	24	42
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696323	DF	On-Demand	Anodyne	GLRA1	41	34
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696323	DF	On-Demand	Anodyne	ACHP_LYMST	25	44
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696323	DF	On-Demand	Anodyne	Q8WSF8_APLCA	50	44
C[C@H]1OCCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696326	EF	On-Demand	Anodyne	GSK3A	15	41
C[C@H]1OCCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696330	EF	On-Demand	Anodyne	GSK3A	15	41
C[C@@H]1OCCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696332	EF	On-Demand	Anodyne	GSK3A	15	41
C[C@@H]1OCCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696333	EF	On-Demand	Anodyne	GSK3A	15	41
NC(=O)[C@@H]1CCC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450696336	FE	On-Demand	Anodyne	GSK3A	30	47
NC(=O)[C@@H]1CCC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450696337	FE	On-Demand	Anodyne	GSK3A	30	47
NC(=O)[C@H]1CCC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450696338	FE	On-Demand	Anodyne	GSK3A	30	47
NC(=O)[C@H]1CCC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450696340	FE	On-Demand	Anodyne	GSK3A	30	47
C=CCCCCNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450696358	EF	On-Demand	Mild	E1	0	44
CC(C)(C(=O)NCc1nc(COc2ccccc2)n[nH]1)C1CCC1	ZINC000450696361	EF	On-Demand	Anodyne	COLA	43	34
c1nc(CCN2CCC3(CC2)OCCc2ccsc23)cs1	ZINC000450696368	DG	On-Demand	Anodyne	OPRL1	43	35
Cc1cnc([C@H](C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)o1	ZINC000450696395	EF	On-Demand	Anodyne	F7	31	47
COC(=O)CC1(CNC(=O)Cc2ccc(O)c(F)c2)CCCCC1	ZINC000450696397	EF	On-Demand	Anodyne	CAN2	0	40
Cc1cnc([C@@H](C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)o1	ZINC000450696398	EF	On-Demand	Anodyne	F7	31	47
CC[S@](=O)CC(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450696402	DD	On-Demand	Anodyne	MTNR1A	17	43
CC[S@@](=O)CC(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450696403	DD	On-Demand	Anodyne	MTNR1A	17	43
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccccc1	ZINC000450696415	EH	On-Demand	Anodyne	HTR2A	20	58
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccccc1	ZINC000450696415	EH	On-Demand	Anodyne	HTR5A	42	58
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccccc1	ZINC000450696415	EH	On-Demand	Anodyne	CYP2J2	56	40
Cc1[nH]c(C#N)cc1C(=O)N[C@@H]1C[C@H](OCc2ccccc2)C1(C)C	ZINC000450696423	EG	On-Demand	Mild	EZH2	42	34
COC(=O)C1(CN2CCc3cc(OC)c(F)cc3C2)CC1	ZINC000450696424	CE	On-Demand	Anodyne	ABCB1B	59	36
COC(=O)C1(CN2CCc3cc(OC)c(F)cc3C2)CC1	ZINC000450696424	CE	On-Demand	Anodyne	ABCB1	26	43
Cc1[nH]c(C#N)cc1C(=O)N[C@@H]1C[C@@H](OCc2ccccc2)C1(C)C	ZINC000450696425	EG	On-Demand	Mild	EZH2	42	34
Cc1[nH]c(C#N)cc1C(=O)N[C@H]1C[C@H](OCc2ccccc2)C1(C)C	ZINC000450696427	EG	On-Demand	Mild	EZH2	42	34
Cc1[nH]c(C#N)cc1C(=O)N[C@H]1C[C@@H](OCc2ccccc2)C1(C)C	ZINC000450696428	EG	On-Demand	Mild	EZH2	42	34
COc1ncc(CNc2nccc(N[C@@H]3CCCOC3)n2)cc1Cl	ZINC000450696465	EE	On-Demand	Anodyne	MAPK1	41	33
COc1ncc(CNc2nccc(N[C@@H]3CCCOC3)n2)cc1Cl	ZINC000450696465	EE	On-Demand	Anodyne	CLK4	15	41
COc1ncc(CNc2nccc(N[C@H]3CCCOC3)n2)cc1Cl	ZINC000450696466	EE	On-Demand	Anodyne	MAPK1	41	33
COc1ncc(CNc2nccc(N[C@H]3CCCOC3)n2)cc1Cl	ZINC000450696466	EE	On-Demand	Anodyne	CLK4	15	41
FC1(F)CC(CN2CCC3(CC2)OCCc2ccsc23)C1	ZINC000450696483	DH	On-Demand	Anodyne	OPRL1	46	36
FC1(F)CC(CN2CCC3(CC2)OCCc2ccsc23)C1	ZINC000450696483	DH	On-Demand	Anodyne	SIGMAR1	15	59
CCC(=O)CCCN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450696499	EG	On-Demand	Anodyne	SLC6A1	100	37
CCC(=O)CCCN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450696499	EG	On-Demand	Anodyne	AKT2	41	34
CCC(=O)CCCN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450696500	EG	On-Demand	Anodyne	SLC6A1	100	37
CCC(=O)CCCN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450696500	EG	On-Demand	Anodyne	AKT2	41	34
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1S(C)(=O)=O	ZINC000450696517	ED	On-Demand	Anodyne	DRD2	31	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1S(C)(=O)=O	ZINC000450696517	ED	On-Demand	Anodyne	DRD1	0	50
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1S(C)(=O)=O	ZINC000450696517	ED	On-Demand	Anodyne	DRD4	22	51
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1S(C)(=O)=O	ZINC000450696517	ED	On-Demand	Anodyne	HTR2A	23	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1S(C)(=O)=O	ZINC000450696517	ED	On-Demand	Anodyne	SLC18A3	0	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1S(C)(=O)=O	ZINC000450696517	ED	On-Demand	Anodyne	HTR3B	0	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1S(C)(=O)=O	ZINC000450696517	ED	On-Demand	Anodyne	CYP2J2	56	40
C[C@@H](Oc1ccccn1)C(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450696604	EF	On-Demand	Anodyne	MTNR1A	16	40
C[C@H](Oc1ccccn1)C(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450696606	EF	On-Demand	Anodyne	MTNR1A	16	40
Fc1ccc(N2CCN(CCc3cscn3)CC2)nc1	ZINC000450696608	CE	On-Demand	Anodyne	SLC27A1	26	43
CCNC(=O)c1ccc(N2CCC3(CCCC3)CC2)nn1	ZINC000450696619	CE	On-Demand	Anodyne	SCD1	50	44
CCNC(=O)c1ccc(N2CCC3(CCCC3)CC2)nn1	ZINC000450696619	CE	On-Demand	Anodyne	SCD	33	43
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696620	GE	On-Demand	Anodyne	DYRK1A	23	47
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696620	GE	On-Demand	Anodyne	CLK1	18	47
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696620	GE	On-Demand	Anodyne	CLK2	27	47
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696620	GE	On-Demand	Anodyne	CLK4	63	43
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696620	GE	On-Demand	Anodyne	CD38	50	35
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696620	GE	On-Demand	Anodyne	DYRK1B	30	47
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696621	GE	On-Demand	Anodyne	DYRK1A	23	47
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696621	GE	On-Demand	Anodyne	CLK1	18	47
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696621	GE	On-Demand	Anodyne	CLK2	27	47
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696621	GE	On-Demand	Anodyne	CLK4	63	43
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696621	GE	On-Demand	Anodyne	CD38	50	35
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696621	GE	On-Demand	Anodyne	DYRK1B	30	47
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696622	GE	On-Demand	Anodyne	DYRK1A	23	47
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696622	GE	On-Demand	Anodyne	CLK1	18	47
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696622	GE	On-Demand	Anodyne	CLK2	27	47
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696622	GE	On-Demand	Anodyne	CLK4	63	43
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696622	GE	On-Demand	Anodyne	CD38	50	35
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696622	GE	On-Demand	Anodyne	DYRK1B	30	47
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696623	GE	On-Demand	Anodyne	DYRK1A	23	47
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696623	GE	On-Demand	Anodyne	CLK1	18	47
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696623	GE	On-Demand	Anodyne	CLK2	27	47
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696623	GE	On-Demand	Anodyne	CLK4	63	43
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696623	GE	On-Demand	Anodyne	CD38	50	35
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(I)cc12	ZINC000450696623	GE	On-Demand	Anodyne	DYRK1B	30	47
CCCc1nc(C)c(CSc2nnc(-c3cccc(C)c3)n2C)o1	ZINC000450696668	EI	On-Demand	Anodyne	CACNA1G	34	40
COCCOC[C@@H](O)CN1CCc2cc(Br)cc(C)c2C1	ZINC000450696696	FE	On-Demand	Anodyne	HSP90AB1	34	41
COCCOC[C@H](O)CN1CCc2cc(Br)cc(C)c2C1	ZINC000450696697	FE	On-Demand	Anodyne	HSP90AB1	34	41
CC(C)[C@@H]1OCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696721	FF	On-Demand	Anodyne	GSK3A	19	45
CC(C)[C@H]1OCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696725	FF	On-Demand	Anodyne	GSK3A	19	45
CC(C)[C@@H]1OCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696726	FF	On-Demand	Anodyne	GSK3A	19	45
CC(C)[C@H]1OCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450696727	FF	On-Demand	Anodyne	GSK3A	19	45
O=C1CN(c2ccnc3cc(F)c(Cl)cc23)CN1CCC(F)(F)F	ZINC000450696772	FH	On-Demand	Anodyne	HRP1_PLAFA	51	33
C[C@@H](NC(=O)C(C)(C)C1CCC1)[C@@H](c1ccccc1)N(C)C	ZINC000450696788	DH	On-Demand	Anodyne	AMY2	52	35
C[C@@H](NC(=O)C(C)(C)C1CCC1)[C@H](c1ccccc1)N(C)C	ZINC000450696790	DH	On-Demand	Anodyne	AMY2	52	35
C[C@H](NC(=O)C(C)(C)C1CCC1)[C@H](c1ccccc1)N(C)C	ZINC000450696793	DH	On-Demand	Anodyne	AMY2	52	35
C[C@H](NC(=O)C(C)(C)C1CCC1)[C@@H](c1ccccc1)N(C)C	ZINC000450696794	DH	On-Demand	Anodyne	AMY2	52	35
CC(C)(C)OC(=O)C1CN(c2nc(-c3ccccn3)nc3c2CCC3)C1	ZINC000450696822	FF	On-Demand	Anodyne	METAP1	16	43
COc1cc2c(cc1F)CN(Cc1nnc(C(C)C)s1)CC2	ZINC000450696826	DG	On-Demand	Anodyne	ABCB1	20	42
COc1cc2c(cc1F)CN(CC1CC(F)(F)C1)CC2	ZINC000450696844	CG	On-Demand	Anodyne	ABCB1B	48	34
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450696845	CG	On-Demand	Anodyne	DRD2	32	47
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450696845	CG	On-Demand	Anodyne	HTR2A	23	50
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450696845	CG	On-Demand	Anodyne	ERG2	22	47
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450696845	CG	On-Demand	Anodyne	CYP2J2	56	40
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450696846	CG	On-Demand	Anodyne	DRD2	32	47
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450696846	CG	On-Demand	Anodyne	HTR2A	23	50
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450696846	CG	On-Demand	Anodyne	ERG2	22	47
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450696846	CG	On-Demand	Anodyne	CYP2J2	56	40
CCC[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696847	EF	On-Demand	Anodyne	OPRM1	15	48
CCC[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696847	EF	On-Demand	Anodyne	OPRD1	21	48
CCC[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696847	EF	On-Demand	Anodyne	ACHP_LYMST	18	43
CCC[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696847	EF	On-Demand	Anodyne	Q8WSF8_APLCA	41	43
CCC[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696848	EF	On-Demand	Anodyne	OPRM1	15	48
CCC[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696848	EF	On-Demand	Anodyne	OPRD1	21	48
CCC[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696848	EF	On-Demand	Anodyne	ACHP_LYMST	18	43
CCC[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450696848	EF	On-Demand	Anodyne	Q8WSF8_APLCA	41	43
N#CC1(CN2CCC3(CC2)OCCc2ccsc23)CCC1	ZINC000450696869	DG	On-Demand	Mild	OPRL1	43	33
CCOC(=O)CNC(=O)[C@@H]1COCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450696881	GC	On-Demand	Anodyne	MMP13	20	42
CCOC(=O)CNC(=O)[C@@H]1COCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450696881	GC	On-Demand	Anodyne	MMP3	15	42
CCOC(=O)CNC(=O)[C@@H]1COCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450696881	GC	On-Demand	Anodyne	MMP1	15	42
CC(C)c1nccc(N2CC(=O)N(CCC(F)(F)F)C2)n1	ZINC000450696882	DE	On-Demand	Anodyne	SORD	73	37
Cc1ccc(SC[C@H](C)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450696898	FH	On-Demand	Anodyne	MMP13	0	43
Cc1ccc(SC[C@@H](C)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450696899	FH	On-Demand	Anodyne	MMP13	0	43
COC(=O)CC1(CNC(=O)c2cc3n(n2)CCCC3)CCCCC1	ZINC000450696914	EE	On-Demand	Anodyne	HCN1	55	34
COC(=O)CC1(CNC(=O)c2cc3n(n2)CCCC3)CCCCC1	ZINC000450696914	EE	On-Demand	Anodyne	HCN4	52	34
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696920	FD	On-Demand	Anodyne	DRD2	16	43
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696920	FD	On-Demand	Anodyne	DRD4	45	43
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696920	FD	On-Demand	Anodyne	ACHE	37	40
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696920	FD	On-Demand	Anodyne	SIGMAR1	47	48
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696920	FD	On-Demand	Anodyne	CCR5	43	38
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696920	FD	On-Demand	Anodyne	BIRC2	31	42
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696921	FD	On-Demand	Anodyne	DRD2	16	43
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696921	FD	On-Demand	Anodyne	DRD4	45	43
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696921	FD	On-Demand	Anodyne	ACHE	37	40
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696921	FD	On-Demand	Anodyne	SIGMAR1	47	48
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696921	FD	On-Demand	Anodyne	CCR5	43	38
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696921	FD	On-Demand	Anodyne	BIRC2	31	42
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696922	FD	On-Demand	Anodyne	DRD2	16	43
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696922	FD	On-Demand	Anodyne	DRD4	45	43
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696922	FD	On-Demand	Anodyne	ACHE	37	40
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696922	FD	On-Demand	Anodyne	SIGMAR1	47	48
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696922	FD	On-Demand	Anodyne	CCR5	43	38
C[C@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696922	FD	On-Demand	Anodyne	BIRC2	31	42
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696923	FD	On-Demand	Anodyne	DRD2	16	43
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696923	FD	On-Demand	Anodyne	DRD4	45	43
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696923	FD	On-Demand	Anodyne	ACHE	37	40
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696923	FD	On-Demand	Anodyne	SIGMAR1	47	48
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696923	FD	On-Demand	Anodyne	CCR5	43	38
C[C@@H](NC(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696923	FD	On-Demand	Anodyne	BIRC2	31	42
CCOC(=O)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc(O)c1	ZINC000450696948	EF	On-Demand	Anodyne	KYNU	0	40
CCOC(=O)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc(O)c1	ZINC000450696949	EF	On-Demand	Anodyne	KYNU	0	40
CCOC(=O)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc(O)c1	ZINC000450696950	EF	On-Demand	Anodyne	KYNU	0	40
CCOC(=O)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc(O)c1	ZINC000450696951	EF	On-Demand	Anodyne	KYNU	0	40
COC(=O)c1ccc(CN2CCc3ncc([N+](=O)[O-])cc3C2)cc1Cl	ZINC000450696959	FF	On-Demand	Bother	ABCG2	36	44
COC(=O)c1ccc(CN2CCc3ncc([N+](=O)[O-])cc3C2)cc1Cl	ZINC000450696959	FF	On-Demand	Bother	NOD2	40	35
C=CCCCCNC(=O)C1CC(C)(O)C1	ZINC000450696972	BD	On-Demand	Mild	DPEP1	60	39
COC(=O)CC1(CNC(=O)c2cc3ccncc3s2)CCCCC1	ZINC000450696979	EH	On-Demand	Anodyne	SELE	48	37
COC(=O)CC1(CNC(=O)c2cc3ccncc3s2)CCCCC1	ZINC000450696979	EH	On-Demand	Anodyne	ICAM1	44	37
COC(=O)CC1(CNC(=O)c2cc3ccncc3s2)CCCCC1	ZINC000450696979	EH	On-Demand	Anodyne	VCAM1	46	37
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696986	FC	On-Demand	Anodyne	DRD4	38	40
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696986	FC	On-Demand	Anodyne	SIGMAR1	43	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696986	FC	On-Demand	Anodyne	CCR5	41	35
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696986	FC	On-Demand	Anodyne	BIRC2	38	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696986	FC	On-Demand	Anodyne	NPFFR1	40	34
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696987	FC	On-Demand	Anodyne	DRD4	38	40
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696987	FC	On-Demand	Anodyne	SIGMAR1	43	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696987	FC	On-Demand	Anodyne	CCR5	41	35
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696987	FC	On-Demand	Anodyne	BIRC2	38	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696987	FC	On-Demand	Anodyne	NPFFR1	40	34
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696988	FC	On-Demand	Anodyne	DRD4	38	40
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696988	FC	On-Demand	Anodyne	SIGMAR1	43	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696988	FC	On-Demand	Anodyne	CCR5	41	35
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696988	FC	On-Demand	Anodyne	BIRC2	38	43
CNS(=O)(=O)NCC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450696988	FC	On-Demand	Anodyne	NPFFR1	40	34
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696989	FC	On-Demand	Anodyne	DRD4	38	40
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696989	FC	On-Demand	Anodyne	SIGMAR1	43	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696989	FC	On-Demand	Anodyne	CCR5	41	35
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696989	FC	On-Demand	Anodyne	BIRC2	38	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450696989	FC	On-Demand	Anodyne	NPFFR1	40	34
Cc1cccc(Cl)c1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000450696996	FD	On-Demand	Anodyne	CHRM2	41	42
Cc1cccc(Cl)c1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000450696996	FD	On-Demand	Anodyne	CCR3	37	41
Cc1cccc(Cl)c1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000450696996	FD	On-Demand	Anodyne	CCR5	30	55
Cc1cccc(Cl)c1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000450696996	FD	On-Demand	Anodyne	L3MBTL1	0	47
Cc1cccc(Cl)c1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000450696996	FD	On-Demand	Anodyne	L3MBTL3	104	47
Cc1cccc(Cl)c1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000450696996	FD	On-Demand	Anodyne	L3MBTL4	0	40
Cc1cccc(Cl)c1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000450696996	FD	On-Demand	Anodyne	MBTD1	0	44
Cc1cccc(Cl)c1C(=O)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000450696996	FD	On-Demand	Anodyne	TP53BP1	0	46
Cc1ccc(NC(=O)c2ccc(N[C@@H](C)CC(C)(C)O)nc2)cc1	ZINC000450697008	EH	On-Demand	Anodyne	TRPV1	16	42
Cc1ccc(NC(=O)c2ccc(N[C@@H](C)CC(C)(C)O)nc2)cc1	ZINC000450697008	EH	On-Demand	Anodyne	PRNP	50	33
Cc1ccc(NC(=O)c2ccc(N[C@@H](C)CC(C)(C)O)nc2)cc1	ZINC000450697008	EH	On-Demand	Anodyne	P4HTM	0	55
Cc1ccc(NC(=O)c2ccc(N[C@H](C)CC(C)(C)O)nc2)cc1	ZINC000450697009	EH	On-Demand	Anodyne	TRPV1	16	42
Cc1ccc(NC(=O)c2ccc(N[C@H](C)CC(C)(C)O)nc2)cc1	ZINC000450697009	EH	On-Demand	Anodyne	PRNP	50	33
Cc1ccc(NC(=O)c2ccc(N[C@H](C)CC(C)(C)O)nc2)cc1	ZINC000450697009	EH	On-Demand	Anodyne	P4HTM	0	55
C[C@H](CC(C)(C)O)Nc1ncnc2cc(Br)ccc12	ZINC000450697020	DG	On-Demand	Anodyne	EGFR	68	38
C[C@H](CC(C)(C)O)Nc1ncnc2cc(Br)ccc12	ZINC000450697020	DG	On-Demand	Anodyne	HTT	0	48
C[C@@H](CC(C)(C)O)Nc1ncnc2cc(Br)ccc12	ZINC000450697021	DG	On-Demand	Anodyne	EGFR	68	38
C[C@@H](CC(C)(C)O)Nc1ncnc2cc(Br)ccc12	ZINC000450697021	DG	On-Demand	Anodyne	HTT	0	48
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450697022	ED	On-Demand	Bother	COLA	82	36
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450697022	ED	On-Demand	Bother	BCL2L1	89	34
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450697022	ED	On-Demand	Bother	BCL2	58	32
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450697022	ED	On-Demand	Bother	BCL2L2	42	32
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450697023	ED	On-Demand	Bother	COLA	82	36
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450697023	ED	On-Demand	Bother	BCL2L1	89	34
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450697023	ED	On-Demand	Bother	BCL2	58	32
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450697023	ED	On-Demand	Bother	BCL2L2	42	32
CN(CCN(C)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1)CC(F)F	ZINC000450697033	GF	On-Demand	Anodyne	TRPC6	62	34
CN(CCN(C)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1)CC(F)F	ZINC000450697033	GF	On-Demand	Anodyne	TRPC3	48	34
COc1ccc(-c2nnc(SCC[C@H]3CCOC3)n2C)cc1	ZINC000450697037	DG	On-Demand	Anodyne	KCNH2	15	46
COc1ccc(-c2nnc(SCC[C@@H]3CCOC3)n2C)cc1	ZINC000450697038	DG	On-Demand	Anodyne	KCNH2	15	46
C[C@H](CC(C)(C)O)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450697043	GI	On-Demand	Anodyne	NPBWR1	44	36
C[C@@H](CC(C)(C)O)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450697044	GI	On-Demand	Anodyne	NPBWR1	44	36
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450697048	EF	On-Demand	Anodyne	SMO	0	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450697049	EF	On-Demand	Anodyne	SMO	0	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450697050	EF	On-Demand	Anodyne	SMO	0	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ccc(F)cn2)CC1	ZINC000450697051	EF	On-Demand	Anodyne	SMO	0	41
CCc1nc(C)c(CSc2nnc(-c3ccc(OC)cc3)n2C)o1	ZINC000450697054	EH	On-Demand	Anodyne	AXIN2	0	42
CCOC(=O)c1ccc(CSc2nnc(-c3cccc(C)c3)n2CC)nc1	ZINC000450697066	GI	On-Demand	Anodyne	SLC27A1	32	41
Fc1ccc(N2CCN(Cc3cnns3)CC2)nc1	ZINC000450697079	CD	On-Demand	Anodyne	SLC27A1	33	46
COc1ccccc1-c1nnc(SCCCCCC(C)=O)n1C	ZINC000450697087	EH	On-Demand	Anodyne	DRD2	15	47
COc1ccccc1-c1nnc(SCCCCCC(C)=O)n1C	ZINC000450697087	EH	On-Demand	Anodyne	DRD3	32	47
COc1ccccc1-c1nnc(SCCCCCC(C)=O)n1C	ZINC000450697087	EH	On-Demand	Anodyne	KCNH2	0	47
COC(=O)CCN1CCN(CCCC(=O)c2ccccc2)[C@@H](C)C1	ZINC000450697092	EE	On-Demand	Anodyne	SLC6A1	62	36
COC(=O)CCN1CCN(CCCC(=O)c2ccccc2)[C@H](C)C1	ZINC000450697093	EE	On-Demand	Anodyne	SLC6A1	62	36
CCc1cnc(CNC(=O)Cc2ccc(C)cc2Br)o1	ZINC000450697102	EG	On-Demand	Anodyne	P2RX7	28	41
CCOC(=O)CNC(=O)[C@H]1COCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450697110	GC	On-Demand	Anodyne	MMP13	20	42
CCOC(=O)CNC(=O)[C@H]1COCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450697110	GC	On-Demand	Anodyne	MMP3	15	42
CCOC(=O)CNC(=O)[C@H]1COCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450697110	GC	On-Demand	Anodyne	MMP1	15	42
CCOc1cc(C#N)ccc1OCCCCCC(C)=O	ZINC000450697142	CG	On-Demand	Mild	PLA2G4B	40	30
CC[C@@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCO1	ZINC000450697144	FF	On-Demand	Anodyne	GSK3A	19	44
CC[C@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCO1	ZINC000450697147	FF	On-Demand	Anodyne	GSK3A	19	44
CC[C@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCO1	ZINC000450697149	FF	On-Demand	Anodyne	GSK3A	19	44
CC[C@@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCO1	ZINC000450697150	FF	On-Demand	Anodyne	GSK3A	19	44
COc1cc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc(OC)c1C(C)C	ZINC000450697186	GJ	On-Demand	Anodyne	TIMP3	40	34
COc1cc(CN2CCO[C@H](C(C)C)C2)ccc1Cl	ZINC000450697191	CG	On-Demand	Anodyne	DRD4	24	55
COc1cc(CN2CCO[C@H](C(C)C)C2)ccc1Cl	ZINC000450697191	CG	On-Demand	Anodyne	SSTR5	42	36
COc1cc(CN2CCO[C@@H](C(C)C)C2)ccc1Cl	ZINC000450697193	CG	On-Demand	Anodyne	DRD4	24	55
COc1cc(CN2CCO[C@@H](C(C)C)C2)ccc1Cl	ZINC000450697193	CG	On-Demand	Anodyne	SSTR5	42	36
CCC(CC)Oc1ccc(C(=O)N[C@@H](CO)c2ccsc2)cc1	ZINC000450697199	EH	On-Demand	Anodyne	UTS2	46	37
CCC(CC)Oc1ccc(C(=O)N[C@@H](CO)c2ccsc2)cc1	ZINC000450697199	EH	On-Demand	Anodyne	GPR88	0	43
CCC(CC)Oc1ccc(C(=O)N[C@H](CO)c2ccsc2)cc1	ZINC000450697200	EH	On-Demand	Anodyne	UTS2	46	37
CCC(CC)Oc1ccc(C(=O)N[C@H](CO)c2ccsc2)cc1	ZINC000450697200	EH	On-Demand	Anodyne	GPR88	0	43
O=C(CCNC(=O)C1CCCCC1)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450697211	GF	On-Demand	Anodyne	GSK3A	30	45
COC(=O)[C@H]1C[C@H](OC)CCN1C[C@H](O)Cc1ccccc1	ZINC000450697226	DD	On-Demand	Anodyne	ACE	41	38
COC(=O)[C@H]1C[C@H](OC)CCN1C[C@H](O)Cc1ccccc1	ZINC000450697226	DD	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1C[C@H](OC)CCN1C[C@H](O)Cc1ccccc1	ZINC000450697226	DD	On-Demand	Anodyne	Q8WSF8_APLCA	41	32
COC(=O)[C@H]1C[C@@H](OC)CCN1C[C@H](O)Cc1ccccc1	ZINC000450697227	DD	On-Demand	Anodyne	ACE	41	38
COC(=O)[C@H]1C[C@@H](OC)CCN1C[C@H](O)Cc1ccccc1	ZINC000450697227	DD	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1C[C@@H](OC)CCN1C[C@H](O)Cc1ccccc1	ZINC000450697227	DD	On-Demand	Anodyne	Q8WSF8_APLCA	41	32
CCOc1ccc(-n2c(SCC3(C#N)CCC3)nnc2-c2ccncc2)cc1	ZINC000450697230	GJ	On-Demand	Mild	CACNA2D1	81	38
CCOc1ccc(-n2c(SCC3(C#N)CCC3)nnc2-c2ccncc2)cc1	ZINC000450697230	GJ	On-Demand	Mild	CACNA2D2	54	33
CO[C@@H]1COCC[C@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br	ZINC000450697243	FD	On-Demand	Bother	PRKCQ	47	38
CO[C@H]1COCC[C@@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br	ZINC000450697245	FD	On-Demand	Bother	PRKCQ	47	38
CO[C@@H]1COCC[C@@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br	ZINC000450697246	FD	On-Demand	Bother	PRKCQ	47	38
CO[C@H]1COCC[C@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br	ZINC000450697247	FD	On-Demand	Bother	PRKCQ	47	38
Cn1ncc2c1C[C@@H](C(=O)Nc1n[nH]c(-c3ccc(O)c(Cl)c3)n1)CC2	ZINC000450697256	FE	On-Demand	Anodyne	GSK3A	24	43
Cn1ncc2c1C[C@H](C(=O)Nc1n[nH]c(-c3ccc(O)c(Cl)c3)n1)CC2	ZINC000450697259	FE	On-Demand	Anodyne	GSK3A	24	43
C[C@@H](NC(=O)C1CCCC1)C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450697270	GE	On-Demand	Anodyne	GSK3A	26	48
C[C@H](NC(=O)C1CCCC1)C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450697271	GE	On-Demand	Anodyne	GSK3A	26	48
CCN1C(=O)C[C@H](C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)[C@H]1c1cccnc1	ZINC000450697276	GF	On-Demand	Anodyne	KCNA5	41	36
CCN1C(=O)C[C@H](C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)[C@H]1c1cccnc1	ZINC000450697277	GF	On-Demand	Anodyne	KCNA5	41	36
CCN1C(=O)C[C@H](C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)[C@H]1c1cccnc1	ZINC000450697278	GF	On-Demand	Anodyne	KCNA5	41	36
CCN1C(=O)C[C@H](C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)[C@H]1c1cccnc1	ZINC000450697279	GF	On-Demand	Anodyne	KCNA5	41	36
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CCN(C2CC2)CC1	ZINC000450697289	FF	On-Demand	Anodyne	GSK3A	32	51
COc1ccc(CN(C(=O)[C@@H](O)C2CCC2)[C@H](CO)C(C)C)cc1	ZINC000450697297	EE	On-Demand	Anodyne	SLC18A2	20	41
COc1ccc(CN(C(=O)[C@H](O)C2CCC2)[C@H](CO)C(C)C)cc1	ZINC000450697298	EE	On-Demand	Anodyne	SLC18A2	20	41
O=C(CNC(=O)C1CCCCC1)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450697301	GE	On-Demand	Anodyne	GSK3A	29	46
COC(=O)C[C@H](NC(=O)CC1(O)CCC1)c1ccc(-c2ccccc2)cc1	ZINC000450697306	FG	On-Demand	Anodyne	UTS2	59	36
COC(=O)C[C@@H](NC(=O)CC1(O)CCC1)c1ccc(-c2ccccc2)cc1	ZINC000450697307	FG	On-Demand	Anodyne	UTS2	59	36
O=[N+]([O-])c1cnc2c(c1)CN(CCc1ccc(Cl)cc1)CC2	ZINC000450697324	DG	On-Demand	Bother	ABCG2	19	40
O=[N+]([O-])c1cnc2c(c1)CN(CCc1ccc(Cl)cc1)CC2	ZINC000450697324	DG	On-Demand	Bother	KCNJ1	36	47
CC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697337	EG	On-Demand	Anodyne	PTGER3	44	33
CC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697337	EG	On-Demand	Anodyne	CAPNS1	45	33
CC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697337	EG	On-Demand	Anodyne	CAPN1	61	35
CC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697337	EG	On-Demand	Anodyne	CAPN2	94	35
CC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697337	EG	On-Demand	Anodyne	ACE2	42	36
CC[C@@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697337	EG	On-Demand	Anodyne	NPR	63	37
CC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697338	EG	On-Demand	Anodyne	PTGER3	44	33
CC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697338	EG	On-Demand	Anodyne	CAPNS1	45	33
CC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697338	EG	On-Demand	Anodyne	CAPN1	61	35
CC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697338	EG	On-Demand	Anodyne	CAPN2	94	35
CC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697338	EG	On-Demand	Anodyne	ACE2	42	36
CC[C@H](CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450697338	EG	On-Demand	Anodyne	NPR	63	37
CCOCc1nc(C)c(C(=O)NCc2nc(COc3ccccc3)n[nH]2)s1	ZINC000450697364	GF	On-Demand	Anodyne	SCD1	39	45
CCOCc1nc(C)c(C(=O)NCc2nc(COc3ccccc3)n[nH]2)s1	ZINC000450697364	GF	On-Demand	Anodyne	SCD	32	45
C=CCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450697376	CF	On-Demand	Mild	NCE103	28	47
C=CCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450697376	CF	On-Demand	Mild	P96878_MYCTU	18	40
C=CCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450697376	CF	On-Demand	Mild	CAN2	0	47
C=CCCCCNC(=O)c1ccc2cnccc2c1	ZINC000450697386	CG	On-Demand	Mild	PTAFR	20	42
C=CCCCCNC(=O)c1ccc2cnccc2c1	ZINC000450697386	CG	On-Demand	Mild	HDAC9	15	43
C=CCCCCNC(=O)c1ccc2cnccc2c1	ZINC000450697386	CG	On-Demand	Mild	AKT1	0	42
OC1(Cc2ccc(OC(F)(F)F)cc2)CCN(Cc2cnn[nH]2)CC1	ZINC000450697418	FE	On-Demand	Anodyne	PRCP	19	41
CO[C@@H]1COCC[C@H]1CNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450697429	EH	On-Demand	Mild	SRC	61	37
CO[C@@H]1COCC[C@H]1CNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450697429	EH	On-Demand	Mild	MAP3K8	76	37
COc1ccc(-c2nnc(S[C@@H]3C[C@H](C)CCC3=O)n2Cc2ccco2)cc1	ZINC000450697434	GI	On-Demand	Anodyne	HCRTR2	18	44
COc1ccc(-c2nnc(S[C@@H]3C[C@@H](C)CCC3=O)n2Cc2ccco2)cc1	ZINC000450697435	GI	On-Demand	Anodyne	HCRTR2	18	44
CO[C@H]1COCC[C@H]1CNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450697436	EH	On-Demand	Mild	SRC	61	37
CO[C@H]1COCC[C@H]1CNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450697436	EH	On-Demand	Mild	MAP3K8	76	37
COc1ccc(-c2nnc(S[C@H]3C[C@H](C)CCC3=O)n2Cc2ccco2)cc1	ZINC000450697437	GI	On-Demand	Anodyne	HCRTR2	18	44
CO[C@@H]1COCC[C@@H]1CNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450697438	EH	On-Demand	Mild	SRC	61	37
CO[C@@H]1COCC[C@@H]1CNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450697438	EH	On-Demand	Mild	MAP3K8	76	37
COc1ccc(-c2nnc(S[C@H]3C[C@@H](C)CCC3=O)n2Cc2ccco2)cc1	ZINC000450697439	GI	On-Demand	Anodyne	HCRTR2	18	44
CO[C@H]1COCC[C@@H]1CNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450697440	EH	On-Demand	Mild	SRC	61	37
CO[C@H]1COCC[C@@H]1CNc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450697440	EH	On-Demand	Mild	MAP3K8	76	37
CO[C@@H]1COCC[C@H]1CNc1ccnc(C(F)(F)F)c1	ZINC000450697442	CF	On-Demand	Anodyne	CCR2	20	41
CO[C@H]1COCC[C@@H]1CNc1ccnc(C(F)(F)F)c1	ZINC000450697443	CF	On-Demand	Anodyne	CCR2	20	41
CO[C@@H]1COCC[C@@H]1CNc1ccnc(C(F)(F)F)c1	ZINC000450697444	CF	On-Demand	Anodyne	CCR2	20	41
CO[C@H]1COCC[C@H]1CNc1ccnc(C(F)(F)F)c1	ZINC000450697445	CF	On-Demand	Anodyne	CCR2	20	41
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	SLC6A4	18	40
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	OPRM1	25	59
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	OPRD1	23	59
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	SLC6A3	39	44
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	KCNH2	29	45
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	CCR5	21	43
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	C5AR1	31	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	MCHR1	16	46
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	ACHP_LYMST	24	52
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450697452	GJ	On-Demand	Anodyne	Q8WSF8_APLCA	44	52
C[C@@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCC1=O	ZINC000450697464	EF	On-Demand	Anodyne	GSK3A	20	46
C[C@@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCC1=O	ZINC000450697465	EF	On-Demand	Anodyne	GSK3A	20	46
C[C@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCC1=O	ZINC000450697466	EF	On-Demand	Anodyne	GSK3A	20	46
C[C@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CCC1=O	ZINC000450697467	EF	On-Demand	Anodyne	GSK3A	20	46
CCOC(=O)c1ccc(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)nc1	ZINC000450697472	GG	On-Demand	Anodyne	SSTR5	42	35
O=S(=O)(c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1)N1CCCC1	ZINC000450697493	ED	On-Demand	Anodyne	GCK	40	32
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC(C)(C)C)C(C)C)cc1	ZINC000450697494	FF	On-Demand	Anodyne	CA2	27	43
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC(C)(C)C)C(C)C)cc1	ZINC000450697494	FF	On-Demand	Anodyne	CA1	22	43
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC(C)(C)C)C(C)C)cc1	ZINC000450697494	FF	On-Demand	Anodyne	ADAMTS4	47	41
CCS(=O)(=O)c1ccc(CN(C)C[C@@H]2CCCC[C@H]2O)cc1	ZINC000450697499	EE	On-Demand	Anodyne	RORC	17	44
CCS(=O)(=O)c1ccc(CN(C)C[C@H]2CCCC[C@H]2O)cc1	ZINC000450697500	EE	On-Demand	Anodyne	RORC	17	44
CCS(=O)(=O)c1ccc(CN(C)C[C@@H]2CCCC[C@@H]2O)cc1	ZINC000450697501	EE	On-Demand	Anodyne	RORC	17	44
CCS(=O)(=O)c1ccc(CN(C)C[C@H]2CCCC[C@@H]2O)cc1	ZINC000450697502	EE	On-Demand	Anodyne	RORC	17	44
O=S(=O)(c1ccc(N2CC[C@](O)(C(F)F)C2)nc1)N1CCCC1	ZINC000450697511	ED	On-Demand	Anodyne	GCK	40	32
CCOC(=O)C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450697512	EE	On-Demand	Bother	CACNA1C	40	38
Cc1nn(C(C)C)c(C)c1CC(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450697514	GG	On-Demand	Anodyne	P2RX7	32	47
CC(C)(C)OC(=O)C1CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450697524	EF	On-Demand	Anodyne	RBP4	18	46
CCn1nnc(C)c1COc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000450697526	CF	On-Demand	Bother	S1PR4	0	46
CC[C@@H](O)CC(=O)Nc1cc(OC)c(C(C)C)c(OC)c1	ZINC000450697527	CF	On-Demand	Anodyne	ENPP1	52	33
CC[C@H](O)CC(=O)Nc1cc(OC)c(C(C)C)c(OC)c1	ZINC000450697528	CF	On-Demand	Anodyne	ENPP1	52	33
COC(=O)CNC(=O)c1ccc(N2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)c([N+](=O)[O-])c1	ZINC000450697538	GE	On-Demand	Bother	TAAR1	15	40
COC(=O)CNC(=O)c1ccc(N2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)c([N+](=O)[O-])c1	ZINC000450697539	GE	On-Demand	Bother	TAAR1	15	40
COc1ccc(CNC(=O)CCN2CCN(S(C)(=O)=O)[C@@H](C)C2)c(OC)c1	ZINC000450697546	GC	On-Demand	Anodyne	HTR7	26	40
CC(C)c1nccc(N2CC[C@@H](C(F)(F)F)C[C@H]2C)n1	ZINC000450697577	CH	On-Demand	Anodyne	SORD	105	43
CC(C)c1nccc(N2CC[C@H](C(F)(F)F)C[C@H]2C)n1	ZINC000450697578	CH	On-Demand	Anodyne	SORD	54	37
CC(C)c1nccc(N2CC[C@H](C(F)(F)F)C[C@@H]2C)n1	ZINC000450697579	CH	On-Demand	Anodyne	SORD	105	43
CC(C)c1nccc(N2CC[C@@H](C(F)(F)F)C[C@@H]2C)n1	ZINC000450697580	CH	On-Demand	Anodyne	SORD	105	43
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCCS1	ZINC000450697599	DF	On-Demand	Anodyne	GSK3A	18	44
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCCS1	ZINC000450697600	DF	On-Demand	Anodyne	GSK3A	18	44
CCOC(=O)c1ccc(CN2CCC3(CC2)OCCc2ccsc23)nc1	ZINC000450697603	FG	On-Demand	Anodyne	OPRL1	49	39
C[C@@H](CC(C)(C)O)Nc1ncccc1OCc1ccccc1	ZINC000450697613	DH	On-Demand	Anodyne	PPIA	56	47
C[C@H](CC(C)(C)O)Nc1ncccc1OCc1ccccc1	ZINC000450697614	DH	On-Demand	Anodyne	PPIA	56	47
CC1(O)CC(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000450697615	DF	On-Demand	Anodyne	GRIN2B	42	38
CC1(O)CC(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000450697615	DF	On-Demand	Anodyne	SFRP1	54	32
CC1(O)CC(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000450697615	DF	On-Demand	Anodyne	WNT3	51	32
COC(=O)c1ccc(OCCC(C)(F)F)c(Cl)c1	ZINC000450697630	CH	On-Demand	Anodyne	PPARA	21	41
COC(=O)c1ccc(OCCC(C)(F)F)c(Cl)c1	ZINC000450697630	CH	On-Demand	Anodyne	S1PR4	22	44
CCOc1cc(NCc2cnc(OC)c(Cl)c2)ccc1[N+](=O)[O-]	ZINC000450697661	EH	On-Demand	Bother	DRTS_TRYCR	44	31
CCCOc1ccc(C(=O)N(C)CCN(C)C2CC2)c(OC)c1	ZINC000450697666	DF	On-Demand	Anodyne	SHC	23	42
CCOC(=O)CNC(=O)[C@H]1COCCN1C[C@H](Cc1ccccc1)OC	ZINC000450697677	FC	On-Demand	Anodyne	CYSP_TRYCR	23	41
CCOC(=O)CNC(=O)[C@H]1COCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450697687	FC	On-Demand	Anodyne	CYSP_TRYCR	23	41
CCOC(=O)CNC(=O)[C@@H]1COCCN1C[C@H](Cc1ccccc1)OC	ZINC000450697689	FC	On-Demand	Anodyne	CYSP_TRYCR	23	41
CCOC(=O)CNC(=O)[C@@H]1COCCN1C[C@@H](Cc1ccccc1)OC	ZINC000450697691	FC	On-Demand	Anodyne	CYSP_TRYCR	23	41
COc1cc([C@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc(OC)c1OC	ZINC000450697706	GH	On-Demand	Anodyne	ADRB2	15	43
COc1cc([C@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc(OC)c1OC	ZINC000450697706	GH	On-Demand	Anodyne	ADRB3	22	43
COc1cc([C@@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc(OC)c1OC	ZINC000450697708	GH	On-Demand	Anodyne	ADRB2	15	43
COc1cc([C@@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc(OC)c1OC	ZINC000450697708	GH	On-Demand	Anodyne	ADRB3	22	43
c1ccc(CCn2ccc(CN3CCC4(CC3)OCCc3ccsc34)n2)cc1	ZINC000450697723	GI	On-Demand	Anodyne	OPRL1	48	40
c1ccc(CCn2ccc(CN3CCC4(CC3)OCCc3ccsc34)n2)cc1	ZINC000450697723	GI	On-Demand	Anodyne	SIGMAR1	45	72
CCCOc1cccc(CN2CCOC[C@H]2C(=O)NCC(=O)OCC)c1	ZINC000450697739	FD	On-Demand	Anodyne	HRH2	34	42
CCCOc1cccc(CN2CCOC[C@@H]2C(=O)NCC(=O)OCC)c1	ZINC000450697741	FD	On-Demand	Anodyne	HRH2	34	42
COc1ccc(CN(C(=O)CS(=O)(=O)C2CC2)[C@H](CO)C(C)C)cc1	ZINC000450697744	FD	On-Demand	Anodyne	BMP1	59	38
CC1(C(=O)N2CCC[C@H](c3ccc(F)cc3)CC2)CCC(=O)CC1	ZINC000450697753	EI	On-Demand	Anodyne	CCR1	19	41
CC1(C(=O)N2CCC[C@@H](c3ccc(F)cc3)CC2)CCC(=O)CC1	ZINC000450697754	EI	On-Demand	Anodyne	CCR1	19	41
CCOC(=O)C1CCC(Sc2cc(-c3ccccc3)nc3ncnn23)CC1	ZINC000450697764	GI	On-Demand	Anodyne	P2RY12	62	35
CCOC(=O)C1CCC(Sc2cc(-c3ccccc3)nc3ncnn23)CC1	ZINC000450697764	GI	On-Demand	Anodyne	VCP	54	37
CCc1cnc(CNC(=O)COc2ccc(C#N)c(Br)c2)o1	ZINC000450697778	FF	On-Demand	Mild	SLC22A12	51	36
CC[C@@H](O)CC(=O)N[C@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1	ZINC000450697781	GI	On-Demand	Anodyne	FFAR1	17	43
CC[C@H](O)CC(=O)N[C@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1	ZINC000450697782	GI	On-Demand	Anodyne	FFAR1	17	43
CC[C@H](O)CC(=O)N[C@@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1	ZINC000450697784	GI	On-Demand	Anodyne	FFAR1	17	43
CC[C@@H](O)CC(=O)N[C@@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1	ZINC000450697785	GI	On-Demand	Anodyne	FFAR1	17	43
Fc1ccc(N2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)nc1	ZINC000450697795	EE	On-Demand	Anodyne	SLC27A1	25	42
COC1(C)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450697796	DG	On-Demand	Anodyne	SIGMAR1	48	38
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450697802	GH	On-Demand	Anodyne	COLA	66	40
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450697802	GH	On-Demand	Anodyne	CPT1A	63	37
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@H]1CCCCN1C1CCCC1	ZINC000450697803	GF	On-Demand	Anodyne	COLA	126	51
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@H]1CCCCN1C1CCCC1	ZINC000450697803	GF	On-Demand	Anodyne	CPT1A	118	38
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@H]1CCCCN1C1CCCC1	ZINC000450697803	GF	On-Demand	Anodyne	CPT2	46	35
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@H]1CCCCN1C1CCCC1	ZINC000450697803	GF	On-Demand	Anodyne	TMPRSS11D	40	32
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@@H]1CCCCN1C1CCCC1	ZINC000450697804	GF	On-Demand	Anodyne	COLA	126	51
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@@H]1CCCCN1C1CCCC1	ZINC000450697804	GF	On-Demand	Anodyne	CPT1A	118	38
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@@H]1CCCCN1C1CCCC1	ZINC000450697804	GF	On-Demand	Anodyne	CPT2	46	35
O=C(NCc1nc(COc2ccccc2)n[nH]1)[C@@H]1CCCCN1C1CCCC1	ZINC000450697804	GF	On-Demand	Anodyne	TMPRSS11D	40	32
CCC[C@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450697822	CF	On-Demand	Anodyne	OPRL1	24	52
CCC[C@@H](O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450697824	CF	On-Demand	Anodyne	OPRL1	24	52
Fc1ccc(N2CCN(Cc3cnn[nH]3)CC2)nc1	ZINC000450697873	CC	On-Demand	Anodyne	DRD4	25	46
Fc1ccc(N2CCN(Cc3cnn[nH]3)CC2)nc1	ZINC000450697873	CC	On-Demand	Anodyne	SLC27A1	30	45
CCC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697874	CD	On-Demand	Anodyne	CAPNS1	49	38
CCC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697874	CD	On-Demand	Anodyne	MMP8	26	41
CCC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697874	CD	On-Demand	Anodyne	CAPN1	63	38
CCC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697874	CD	On-Demand	Anodyne	CAPN2	84	40
CCC[C@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697874	CD	On-Demand	Anodyne	NPR	38	57
CCC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697876	CD	On-Demand	Anodyne	CAPNS1	49	38
CCC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697876	CD	On-Demand	Anodyne	MMP8	26	41
CCC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697876	CD	On-Demand	Anodyne	CAPN1	63	38
CCC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697876	CD	On-Demand	Anodyne	CAPN2	84	40
CCC[C@@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697876	CD	On-Demand	Anodyne	NPR	38	57
CCC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697877	CD	On-Demand	Anodyne	CAPNS1	49	38
CCC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697877	CD	On-Demand	Anodyne	MMP8	26	41
CCC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697877	CD	On-Demand	Anodyne	CAPN1	63	38
CCC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697877	CD	On-Demand	Anodyne	CAPN2	84	40
CCC[C@@H](CC(C)C)C(=O)N[C@@H](COC)C(=O)OC	ZINC000450697877	CD	On-Demand	Anodyne	NPR	38	57
CCC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697878	CD	On-Demand	Anodyne	CAPNS1	49	38
CCC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697878	CD	On-Demand	Anodyne	MMP8	26	41
CCC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697878	CD	On-Demand	Anodyne	CAPN1	63	38
CCC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697878	CD	On-Demand	Anodyne	CAPN2	84	40
CCC[C@H](CC(C)C)C(=O)N[C@H](COC)C(=O)OC	ZINC000450697878	CD	On-Demand	Anodyne	NPR	38	57
COC(=O)[C@H]1C[C@@H](OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450697894	EF	On-Demand	Anodyne	DRD2	37	40
COC(=O)[C@H]1C[C@@H](OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450697894	EF	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450697895	EF	On-Demand	Anodyne	DRD2	37	40
COC(=O)[C@@H]1C[C@@H](OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450697895	EF	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@@H]1C[C@H](OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450697896	EF	On-Demand	Anodyne	DRD2	37	40
COC(=O)[C@@H]1C[C@H](OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450697896	EF	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@H]1C[C@H](OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450697897	EF	On-Demand	Anodyne	DRD2	37	40
COC(=O)[C@H]1C[C@H](OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450697897	EF	On-Demand	Anodyne	DRD3	0	40
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450697910	GI	On-Demand	Anodyne	OPRM1	15	50
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450697910	GI	On-Demand	Anodyne	OPRD1	18	50
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450697910	GI	On-Demand	Anodyne	SLC6A3	15	56
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450697910	GI	On-Demand	Anodyne	CYP2J2	55	40
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450697910	GI	On-Demand	Anodyne	ACHP_LYMST	22	43
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450697910	GI	On-Demand	Anodyne	Q8WSF8_APLCA	40	43
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)c(F)c(F)c2)c(OC)c1	ZINC000450697913	GG	On-Demand	Anodyne	PDGFRB	31	40
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)c(F)c(F)c2)c(OC)c1	ZINC000450697913	GG	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)c(F)c(F)c2)c(OC)c1	ZINC000450697913	GG	On-Demand	Anodyne	MTNR1B	47	35
O=[N+]([O-])c1cc(Cl)ccc1OCC[C@H]1CCOC1	ZINC000450697921	CG	On-Demand	Bother	S1PR4	18	49
O=[N+]([O-])c1cc(Cl)ccc1OCC[C@@H]1CCOC1	ZINC000450697922	CG	On-Demand	Bother	S1PR4	18	49
C[C@@H](C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CC1	ZINC000450697923	DF	On-Demand	Anodyne	GSK3A	19	45
C[C@H](C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CC1	ZINC000450697924	DF	On-Demand	Anodyne	GSK3A	19	45
COc1cc(NC(=O)Cc2scnc2-c2ccccc2)cc(OC)c1C(C)C	ZINC000450697930	GK	On-Demand	Anodyne	MAP1	42	37
COc1cc(NC(=O)Cc2scnc2-c2ccccc2)cc(OC)c1C(C)C	ZINC000450697930	GK	On-Demand	Anodyne	ENPP1	44	30
COc1ccnc(CN[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450697931	EE	On-Demand	Anodyne	SSTR5	44	35
COc1ccnc(CN[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450697932	EE	On-Demand	Anodyne	SSTR5	44	35
COc1ccnc(CN[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450697933	EE	On-Demand	Anodyne	SSTR5	44	35
COc1ccnc(CN[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000450697934	EE	On-Demand	Anodyne	SSTR5	44	35
CCc1cc(N2CC[C@@H](C(F)(F)F)C[C@H]2C)n2ncnc2n1	ZINC000450697960	DF	On-Demand	Anodyne	DHOD	0	41
CCc1cc(N2CC[C@H](C(F)(F)F)C[C@@H]2C)n2ncnc2n1	ZINC000450697961	DF	On-Demand	Anodyne	DHOD	0	41
CCc1cc(N2CC[C@@H](C(F)(F)F)C[C@@H]2C)n2ncnc2n1	ZINC000450697962	DF	On-Demand	Anodyne	DHOD	0	41
CCc1cc(N2CC[C@H](C(F)(F)F)C[C@H]2C)n2ncnc2n1	ZINC000450697963	DF	On-Demand	Anodyne	DHOD	0	41
COc1cc2c(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)ncnc2cc1F	ZINC000450698001	EF	On-Demand	Anodyne	PDGFRB	45	34
COc1cc2c(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)ncnc2cc1F	ZINC000450698002	EF	On-Demand	Anodyne	PDGFRB	45	34
COc1cc2c(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)ncnc2cc1F	ZINC000450698003	EF	On-Demand	Anodyne	PDGFRB	45	34
COc1cc2c(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)ncnc2cc1F	ZINC000450698004	EF	On-Demand	Anodyne	PDGFRB	45	34
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CCSCC1	ZINC000450698010	EF	On-Demand	Anodyne	GSK3A	33	52
CC1(C)C[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450698016	DF	On-Demand	Anodyne	GSK3A	18	44
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CC(F)(F)C1	ZINC000450698020	EF	On-Demand	Anodyne	GSK3A	29	50
CCc1cccc(C(=O)Nc2ccc(F)cc2OC(C)C)n1	ZINC000450698022	DH	On-Demand	Anodyne	PDE5A	27	40
CO[C@@H]1COCC[C@@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000450698026	DC	On-Demand	Bother	IKBKB	25	41
CO[C@H]1COCC[C@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000450698027	DC	On-Demand	Bother	IKBKB	25	41
CO[C@@H]1COCC[C@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000450698028	DC	On-Demand	Bother	IKBKB	25	41
CO[C@H]1COCC[C@@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000450698029	DC	On-Demand	Bother	IKBKB	25	41
COc1ccc(CN(C(=O)c2cc(C#N)[nH]c2C)[C@H](CO)C(C)C)cc1	ZINC000450698065	FF	On-Demand	Mild	ACAT	47	37
COc1cc2c(cc1F)CN(CC[C@H](C)O)CC2	ZINC000450698077	CD	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1F)CN(CC[C@H](C)O)CC2	ZINC000450698077	CD	On-Demand	Anodyne	DHCR7	0	49
COc1cc2c(cc1F)CN(CC[C@@H](C)O)CC2	ZINC000450698078	CD	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1F)CN(CC[C@@H](C)O)CC2	ZINC000450698078	CD	On-Demand	Anodyne	DHCR7	0	49
COC(=O)[C@@H]1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450698098	GF	On-Demand	Anodyne	GSK3B	17	53
COC(=O)[C@@H]1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450698098	GF	On-Demand	Anodyne	GSK3A	39	53
COC(=O)[C@@H]1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450698098	GF	On-Demand	Anodyne	HSP90AA1	16	42
COC(=O)C1CCC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450698100	GF	On-Demand	Anodyne	GSK3B	17	53
COC(=O)C1CCC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450698100	GF	On-Demand	Anodyne	GSK3A	39	53
COC(=O)C1CCC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450698100	GF	On-Demand	Anodyne	HSP90AA1	16	42
CC(=O)c1ccc(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)cc1	ZINC000450698107	FH	On-Demand	Anodyne	ACHE	18	44
CC(=O)c1ccc(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)cc1	ZINC000450698107	FH	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCN1CCC2(CC1)OCCc1ccsc12)Cc1ccccc1	ZINC000450698109	FH	On-Demand	Anodyne	OPRL1	52	41
CN(CCN1CCC2(CC1)OCCc1ccsc12)Cc1ccccc1	ZINC000450698109	FH	On-Demand	Anodyne	SIGMAR1	47	49
CCOC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)nc1	ZINC000450698114	GG	On-Demand	Anodyne	AKT2	41	36
CCOC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)nc1	ZINC000450698116	GG	On-Demand	Anodyne	AKT2	41	36
CCS(=O)(=O)c1ccc(CN2CCC3(CC2)OCCc2ccsc23)cc1	ZINC000450698123	GH	On-Demand	Anodyne	OPRL1	47	37
CCS(=O)(=O)c1ccc(CN2CCC3(CC2)OCCc2ccsc23)cc1	ZINC000450698123	GH	On-Demand	Anodyne	SIGMAR1	32	69
CCOc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2ccncc2)cc1	ZINC000450698125	GJ	On-Demand	Anodyne	CACNA2D1	82	42
CCOc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2ccncc2)cc1	ZINC000450698125	GJ	On-Demand	Anodyne	CACNA2D2	40	31
CCOc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2ccncc2)cc1	ZINC000450698125	GJ	On-Demand	Anodyne	WNT3A	22	55
O=C1CCC(CN2CCC[C@H](c3ccc(F)cc3)CC2)CC1	ZINC000450698137	DI	On-Demand	Anodyne	DRD2	0	44
O=C1CCC(CN2CCC[C@H](c3ccc(F)cc3)CC2)CC1	ZINC000450698137	DI	On-Demand	Anodyne	SIGMAR1	20	44
O=C(N[C@H](CO)c1ccsc1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450698140	DG	On-Demand	Anodyne	GPR88	0	50
O=C(N[C@H](CO)c1ccsc1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450698141	DG	On-Demand	Anodyne	GPR88	0	50
O=C(N[C@H](CO)c1ccsc1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450698144	DG	On-Demand	Anodyne	GPR88	0	50
O=C(N[C@H](CO)c1ccsc1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450698145	DG	On-Demand	Anodyne	GPR88	0	50
O=C1CCC(CN2CCC[C@@H](c3ccc(F)cc3)CC2)CC1	ZINC000450698167	DI	On-Demand	Anodyne	DRD2	0	44
O=C1CCC(CN2CCC[C@@H](c3ccc(F)cc3)CC2)CC1	ZINC000450698167	DI	On-Demand	Anodyne	SIGMAR1	20	44
CCOC(=O)C1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CC1	ZINC000450698178	ED	On-Demand	Anodyne	DRD4	43	35
COC(=O)[C@@H]1C[C@H](OC)CCN1Cc1ccccc1OC1CC1	ZINC000450698182	DE	On-Demand	Anodyne	SLC5A4	43	32
COC(=O)[C@@H]1C[C@@H](OC)CCN1Cc1ccccc1OC1CC1	ZINC000450698183	DE	On-Demand	Anodyne	SLC5A4	43	32
COC(=O)[C@H]1C[C@H](OC)CCN1Cc1ccccc1OC1CC1	ZINC000450698184	DE	On-Demand	Anodyne	SLC5A4	43	32
CC(C)OC(C)(C)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450698209	EH	On-Demand	Anodyne	GRIN2B	44	36
CC(C)OC(C)(C)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450698209	EH	On-Demand	Anodyne	CCR3	37	41
CC(C)OC(C)(C)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450698209	EH	On-Demand	Anodyne	CACNA1I	56	33
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(C)(C)C)[C@H](O)C1	ZINC000450698234	DF	On-Demand	Anodyne	OPRK1	22	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(C)(C)C)[C@H](O)C1	ZINC000450698234	DF	On-Demand	Anodyne	CCR5	36	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(C)(C)C)[C@@H](O)C1	ZINC000450698235	DF	On-Demand	Anodyne	OPRK1	22	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(C)(C)C)[C@@H](O)C1	ZINC000450698235	DF	On-Demand	Anodyne	CCR5	36	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(C)(C)C)[C@@H](O)C1	ZINC000450698236	DF	On-Demand	Anodyne	OPRK1	22	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(C)(C)C)[C@@H](O)C1	ZINC000450698236	DF	On-Demand	Anodyne	CCR5	36	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(C)(C)C)[C@H](O)C1	ZINC000450698237	DF	On-Demand	Anodyne	OPRK1	22	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(C)(C)C)[C@H](O)C1	ZINC000450698237	DF	On-Demand	Anodyne	CCR5	36	40
O=C(CC1(O)CCC1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450698247	DG	On-Demand	Anodyne	CCR3	27	44
CC(C)CC(CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450698260	FH	On-Demand	Anodyne	PTGER3	49	35
CC(C)CC(CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450698260	FH	On-Demand	Anodyne	CAPNS1	46	33
CC(C)CC(CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450698260	FH	On-Demand	Anodyne	CAPN1	61	36
CC(C)CC(CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450698260	FH	On-Demand	Anodyne	CAPN2	83	35
CC(C)CC(CC(C)C)C(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450698260	FH	On-Demand	Anodyne	NPR	64	38
COC(=O)C[C@H](NC(=O)c1cnn2c1CCC2)c1ccc(-c2ccccc2)cc1	ZINC000450698277	GH	On-Demand	Anodyne	UTS2	65	42
COC(=O)C[C@@H](NC(=O)c1cnn2c1CCC2)c1ccc(-c2ccccc2)cc1	ZINC000450698279	GH	On-Demand	Anodyne	UTS2	65	42
COC(=O)CC1(CNC(=O)c2ccsc2C)CCCCC1	ZINC000450698280	DG	On-Demand	Anodyne	HCN1	59	38
COC(=O)CC1(CNC(=O)c2ccsc2C)CCCCC1	ZINC000450698280	DG	On-Demand	Anodyne	HCN4	57	38
COC[C@H](NC(=O)COc1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450698305	FE	On-Demand	Anodyne	CAPN2	17	41
COC[C@@H](NC(=O)COc1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450698306	FE	On-Demand	Anodyne	CAPN2	17	41
CO[C@H]1COCC[C@H]1CNc1ncnc2cc(Cl)ccc12	ZINC000450698307	DE	On-Demand	Anodyne	HRP1_PLAFA	65	32
CN(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)CC(F)F	ZINC000450698308	GD	On-Demand	Anodyne	FKBP1A	27	42
CN(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)CC(F)F	ZINC000450698308	GD	On-Demand	Anodyne	CCR4	19	43
CN(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)CC(F)F	ZINC000450698308	GD	On-Demand	Anodyne	ITGA4	38	40
CN(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)CC(F)F	ZINC000450698308	GD	On-Demand	Anodyne	CAPNS1	21	41
CN(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)CC(F)F	ZINC000450698308	GD	On-Demand	Anodyne	CAPN1	15	45
CN(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)CC(F)F	ZINC000450698308	GD	On-Demand	Anodyne	SFRP1	47	34
CN(CCN(C)C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)CC(F)F	ZINC000450698308	GD	On-Demand	Anodyne	WNT3	60	34
CO[C@@H]1COCC[C@H]1CNc1ncnc2cc(Cl)ccc12	ZINC000450698309	DE	On-Demand	Anodyne	HRP1_PLAFA	65	32
CO[C@@H]1COCC[C@@H]1CNc1ncnc2cc(Cl)ccc12	ZINC000450698310	DE	On-Demand	Anodyne	HRP1_PLAFA	65	32
CO[C@H]1COCC[C@@H]1CNc1ncnc2cc(Cl)ccc12	ZINC000450698311	DE	On-Demand	Anodyne	HRP1_PLAFA	65	32
Cc1cnc(CCCC(=O)NCCc2cn(C)c3cc(F)ccc23)o1	ZINC000450698316	EG	On-Demand	Anodyne	MTNR1A	16	40
COC[C@H](NC(=O)C(C)(C)C1CCC1)C(=O)OC	ZINC000450698322	CD	On-Demand	Anodyne	AMY2	45	31
COC[C@@H](NC(=O)C(C)(C)C1CCC1)C(=O)OC	ZINC000450698323	CD	On-Demand	Anodyne	AMY2	45	31
C=CCCCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450698331	CG	On-Demand	Mild	PAPA1_CARPA	48	38
C=CCCCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450698331	CG	On-Demand	Mild	NPR	42	33
C=CCCCCNC(=O)[C@H](C)OCCc1ccccc1	ZINC000450698331	CG	On-Demand	Mild	AMP1_PLAFQ	36	43
C=CCCCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450698333	CG	On-Demand	Mild	PAPA1_CARPA	48	38
C=CCCCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450698333	CG	On-Demand	Mild	NPR	42	33
C=CCCCCNC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450698333	CG	On-Demand	Mild	AMP1_PLAFQ	36	43
CC(F)(F)C(C)(C)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450698382	EI	On-Demand	Anodyne	GRIN2B	49	38
CC(F)(F)C(C)(C)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450698382	EI	On-Demand	Anodyne	CCR3	43	43
CCCc1cc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)no1	ZINC000450698395	DH	On-Demand	Anodyne	ETHR	46	33
CCCc1cc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)no1	ZINC000450698396	DH	On-Demand	Anodyne	ETHR	46	33
COC(=O)[C@H]1C[C@@H](OC)CCN1Cc1ccccc1OC1CC1	ZINC000450698460	DE	On-Demand	Anodyne	SLC5A4	43	32
COc1cc2c(cc1F)CN(C[C@@H]1CCC(F)(F)C1)CC2	ZINC000450698461	CH	On-Demand	Anodyne	ABCB1B	45	32
COc1cc2c(cc1F)CN(C[C@H]1CCC(F)(F)C1)CC2	ZINC000450698464	CH	On-Demand	Anodyne	ABCB1B	45	32
COc1cc(OC)c2ncnc(N3CC[C@@](O)(C(F)F)C3)c2c1	ZINC000450698468	ED	On-Demand	Anodyne	PDE3A	43	34
COc1cc(OC)c2ncnc(N3CC[C@@](O)(C(F)F)C3)c2c1	ZINC000450698468	ED	On-Demand	Anodyne	PDE3B	63	34
COc1cc(OC)c2ncnc(N3CC[C@](O)(C(F)F)C3)c2c1	ZINC000450698469	ED	On-Demand	Anodyne	PDE3A	43	34
COc1cc(OC)c2ncnc(N3CC[C@](O)(C(F)F)C3)c2c1	ZINC000450698469	ED	On-Demand	Anodyne	PDE3B	63	34
CCOC(=O)C1CCC(Sc2ncc([N+](=O)[O-])cc2C)CC1	ZINC000450698495	DH	On-Demand	Bother	CACNA1C	24	40
COc1cc(NC(=O)c2c[nH]c3nccc-3c2)cc(OC)c1C(C)C	ZINC000450698497	EH	On-Demand	Anodyne	GRM4	19	41
COc1cc(NC(=O)c2c[nH]c3nccc-3c2)cc(OC)c1C(C)C	ZINC000450698497	EH	On-Demand	Anodyne	ENPP1	50	32
COc1cc(NC(=O)c2c[nH]c3nccc-3c2)cc(OC)c1C(C)C	ZINC000450698497	EH	On-Demand	Anodyne	GLMU	0	42
COc1cccc(-c2nnn(CCC[C@H](C)O)n2)c1	ZINC000450698500	CD	On-Demand	Anodyne	SCARB1	24	46
COc1cccc(-c2nnn(CCC[C@@H](C)O)n2)c1	ZINC000450698501	CD	On-Demand	Anodyne	SCARB1	24	46
CC(C)Oc1cc(F)ccc1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450698510	GH	On-Demand	Anodyne	PRKDC	17	42
CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)nc1	ZINC000450698513	GF	On-Demand	Anodyne	RORC	26	42
CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1	ZINC000450698515	GF	On-Demand	Anodyne	RORC	26	42
C[C@@H](CN1CCC[C@H](c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450698525	DF	On-Demand	Anodyne	SLC18A3	15	41
C[C@H](CN1CCC[C@H](c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450698528	DF	On-Demand	Anodyne	SLC18A3	15	41
C[C@@H](CN1CCC[C@@H](c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450698530	DF	On-Demand	Anodyne	SLC18A3	15	41
C[C@H](CN1CCC[C@@H](c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450698532	DF	On-Demand	Anodyne	SLC18A3	15	41
CN(CCN1CCc2c(ncn2-c2ccccc2)C1)Cc1ccccc1	ZINC000450698539	EG	On-Demand	Anodyne	SIGMAR1	19	44
COC(=O)[C@@H]1C[C@H](OC)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450698541	GG	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450698543	GG	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@H]1C[C@H](OC)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450698546	GG	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450698556	GG	On-Demand	Anodyne	CYP2J2	48	34
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450698560	CF	On-Demand	Anodyne	CCR2	15	42
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450698563	CF	On-Demand	Anodyne	CCR2	15	42
CC(=O)[C@](C)(O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450698564	CF	On-Demand	Anodyne	CCR2	15	42
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450698567	CF	On-Demand	Anodyne	CCR2	15	42
CO[C@@H]1COCC[C@@H]1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450698572	FD	On-Demand	Anodyne	HTR3A	23	41
CO[C@@H]1COCC[C@@H]1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450698572	FD	On-Demand	Anodyne	HRH4	21	41
CO[C@@H]1COCC[C@H]1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450698574	FD	On-Demand	Anodyne	HTR3A	23	41
CO[C@@H]1COCC[C@H]1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450698574	FD	On-Demand	Anodyne	HRH4	21	41
CO[C@H]1COCC[C@@H]1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450698577	FD	On-Demand	Anodyne	HTR3A	23	41
CO[C@H]1COCC[C@@H]1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450698577	FD	On-Demand	Anodyne	HRH4	21	41
CC[C@](C)(OC)C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450698578	DF	On-Demand	Anodyne	HSC82	40	38
CO[C@H]1COCC[C@H]1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450698579	FD	On-Demand	Anodyne	HTR3A	23	41
CO[C@H]1COCC[C@H]1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450698579	FD	On-Demand	Anodyne	HRH4	21	41
CC[C@@](C)(OC)C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450698580	DF	On-Demand	Anodyne	HSC82	40	38
CC(C)N1CC[C@@H](NC(=O)C2(C)CCC(=O)CC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000450698592	GH	On-Demand	Anodyne	CACNA1H	17	40
CC(C)N1CC[C@H](NC(=O)C2(C)CCC(=O)CC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000450698593	GH	On-Demand	Anodyne	CACNA1H	17	40
CC(C)N1CC[C@H](NC(=O)C2(C)CCC(=O)CC2)[C@H]1c1ccc(F)c(F)c1	ZINC000450698594	GH	On-Demand	Anodyne	CACNA1H	17	40
CC(C)N1CC[C@@H](NC(=O)C2(C)CCC(=O)CC2)[C@H]1c1ccc(F)c(F)c1	ZINC000450698595	GH	On-Demand	Anodyne	CACNA1H	17	40
COc1ncc(CNc2nc3ccccc3nc2N2CCOCC2)cc1Cl	ZINC000450698614	GG	On-Demand	Anodyne	PDE5A	39	46
COc1ncc(CNc2nc3ccccc3nc2N2CCOCC2)cc1Cl	ZINC000450698614	GG	On-Demand	Anodyne	EPHB4	64	36
COc1ncc(CNc2nc3ccccc3nc2N2CCOCC2)cc1Cl	ZINC000450698614	GG	On-Demand	Anodyne	STAT6	77	43
COC(=O)c1cccc(CN2CCC3(CC2)OCCc2ccsc23)c1Cl	ZINC000450698621	GI	On-Demand	Anodyne	OPRL1	65	45
COC(=O)c1cccc(CN2CCC3(CC2)OCCc2ccsc23)c1Cl	ZINC000450698621	GI	On-Demand	Anodyne	SIGMAR1	18	57
CCCC(=O)NCC(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450698622	ED	On-Demand	Anodyne	GSK3B	0	42
O=C(N[C@@H](CO)c1ccsc1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450698643	FH	On-Demand	Anodyne	RBP4	57	38
O=C(N[C@H](CO)c1ccsc1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450698644	FH	On-Demand	Anodyne	RBP4	57	38
C[C@@H]1CCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450698670	DG	On-Demand	Anodyne	GSK3A	19	44
C[C@@H]1CCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450698671	DG	On-Demand	Anodyne	GSK3A	19	44
C[C@H]1CCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450698672	DG	On-Demand	Anodyne	GSK3A	19	44
C[C@H]1CCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450698673	DG	On-Demand	Anodyne	GSK3A	19	44
CC(C)Oc1cc(F)ccc1NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450698678	EH	On-Demand	Anodyne	ADRA1D	18	40
CC(C)Oc1cc(F)ccc1NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450698679	EH	On-Demand	Anodyne	ADRA1D	18	40
COc1cc2c(cc1F)CN(C[C@H]1CCNC(=O)CC1)CC2	ZINC000450698691	DE	On-Demand	Anodyne	ABCB1B	56	32
COc1cc2c(cc1F)CN(C[C@@H]1CCNC(=O)CC1)CC2	ZINC000450698692	DE	On-Demand	Anodyne	ABCB1B	56	32
COc1cc(OC)c2ncnc(NC[C@H]3CCOC[C@@H]3OC)c2c1	ZINC000450698704	ED	On-Demand	Anodyne	PDE6A	40	31
CC/C=C\CNc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-]	ZINC000450698729	DD	On-Demand	Bother	TAAR1	17	47
C=CCCCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450698743	CG	On-Demand	Mild	CTSV	46	31
C=CCCCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450698743	CG	On-Demand	Mild	POLG_WNV	45	31
C[C@@H](OCCc1ccccc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450698748	ED	On-Demand	Anodyne	DAGLA	28	42
C[C@H](OCCc1ccccc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450698749	ED	On-Demand	Anodyne	DAGLA	28	42
CO[C@@H](Cc1ccccc1)C(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450698767	FG	On-Demand	Anodyne	MTNR1A	23	42
CO[C@H](Cc1ccccc1)C(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450698768	FG	On-Demand	Anodyne	MTNR1A	23	42
CO[C@H]1COCC[C@@H]1CNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450698777	EF	On-Demand	Mild	MAP3K8	46	34
CO[C@H]1COCC[C@H]1CNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450698778	EF	On-Demand	Mild	MAP3K8	46	34
CO[C@@H]1COCC[C@@H]1CNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450698779	EF	On-Demand	Mild	MAP3K8	46	34
CO[C@@H]1COCC[C@H]1CNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450698780	EF	On-Demand	Mild	MAP3K8	46	34
COC(=O)CC1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450698782	DE	On-Demand	Mild	HCN1	52	33
COC(=O)CC1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450698782	DE	On-Demand	Mild	HCN4	50	33
Cc1nc(C2CC2)ccc1C(=O)N[C@H](C)CCC1CC1	ZINC000450698819	CH	On-Demand	Anodyne	JAK3	15	42
Cc1nc(C2CC2)ccc1C(=O)N[C@@H](C)CCC1CC1	ZINC000450698820	CH	On-Demand	Anodyne	JAK3	15	42
CCNc1ccc(Cl)cc1NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450698829	DH	On-Demand	Anodyne	IMDH_CRYPV	18	42
CCNc1ccc(Cl)cc1NC(=O)[C@H](C)Oc1ccccn1	ZINC000450698830	DH	On-Demand	Anodyne	IMDH_CRYPV	25	42
CCn1c(SCc2nc(C(=O)OC)cs2)nnc1-c1ccccc1OC	ZINC000450698831	GH	On-Demand	Anodyne	SLC27A1	43	38
COc1cc(CC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)ccc1O	ZINC000450698832	GH	On-Demand	Anodyne	CCR3	34	47
COc1cc(CC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)ccc1O	ZINC000450698832	GH	On-Demand	Anodyne	MLNR	29	44
COc1cc(CC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)ccc1O	ZINC000450698832	GH	On-Demand	Anodyne	SHBG	18	43
CC1(C)CC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450698904	DG	On-Demand	Anodyne	GSK3A	25	48
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450698928	FI	On-Demand	Anodyne	ADRB3	31	46
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450698930	FI	On-Demand	Anodyne	ADRB3	31	46
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450698932	FI	On-Demand	Anodyne	ADRB3	31	46
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450698933	FI	On-Demand	Anodyne	ADRB3	31	46
COc1ccc(-c2nnc(N3CC[C@@](O)(C(F)F)C3)c3ccccc23)cc1	ZINC000450698960	FH	On-Demand	Anodyne	SMO	41	41
O=C1CC[C@@H](CCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)N1	ZINC000450698961	DE	On-Demand	Anodyne	ETHR	42	35
COc1ccc(-c2nnc(N3CC[C@](O)(C(F)F)C3)c3ccccc23)cc1	ZINC000450698962	FH	On-Demand	Anodyne	SMO	41	41
O=C1CC[C@H](CCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)N1	ZINC000450698963	DE	On-Demand	Anodyne	ETHR	42	35
O=C1CC[C@@H](CCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)N1	ZINC000450698967	DE	On-Demand	Anodyne	ETHR	42	35
O=C1CC[C@H](CCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)N1	ZINC000450698968	DE	On-Demand	Anodyne	ETHR	42	35
Cc1cccc(-c2nnc(SC[C@@H]3CCC(F)(F)C3)n2C)c1	ZINC000450698969	DI	On-Demand	Anodyne	DRD3	50	38
Cc1cccc(-c2nnc(SC[C@H]3CCC(F)(F)C3)n2C)c1	ZINC000450698970	DI	On-Demand	Anodyne	DRD3	50	38
Cc1cnc2c(C)cccc2c1N1CC[C@@](O)(C(F)F)C1	ZINC000450698973	CG	On-Demand	Anodyne	ATP4A	18	40
Cc1cnc2c(C)cccc2c1N1CC[C@](O)(C(F)F)C1	ZINC000450698974	CG	On-Demand	Anodyne	ATP4A	18	40
CC(=O)c1cn(CC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)nn1	ZINC000450698992	FE	On-Demand	Anodyne	CCR3	27	42
C[C@@H](CC(C)(C)O)Nc1c(C#N)cnc2c(Br)cccc12	ZINC000450698995	EH	On-Demand	Mild	MAP3K8	47	40
C[C@H](CC(C)(C)O)Nc1c(C#N)cnc2c(Br)cccc12	ZINC000450698996	EH	On-Demand	Mild	MAP3K8	47	40
CCOc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2ccncc2)cc1	ZINC000450699005	GI	On-Demand	Anodyne	CACNA2D1	73	40
CCOc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2ccncc2)cc1	ZINC000450699005	GI	On-Demand	Anodyne	CACNA2D2	49	31
CCOc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2ccncc2)cc1	ZINC000450699005	GI	On-Demand	Anodyne	WNT3A	21	52
CCOc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2ccncc2)cc1	ZINC000450699006	GI	On-Demand	Anodyne	CACNA2D1	73	40
CCOc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2ccncc2)cc1	ZINC000450699006	GI	On-Demand	Anodyne	CACNA2D2	49	31
CCOc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2ccncc2)cc1	ZINC000450699006	GI	On-Demand	Anodyne	WNT3A	21	52
Cc1cncc(-c2nc(CN3CCC[C@H](c4ccc(F)cc4)CC3)no2)c1	ZINC000450699017	FI	On-Demand	Anodyne	SSTR5	18	40
Cc1cncc(-c2nc(CN3CCC[C@@H](c4ccc(F)cc4)CC3)no2)c1	ZINC000450699018	FI	On-Demand	Anodyne	SSTR5	18	40
COc1cc(OC)c2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450699019	EE	On-Demand	Anodyne	PDE3A	48	38
COc1cc(OC)c2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450699019	EE	On-Demand	Anodyne	PDE3B	70	38
COc1cccc(-c2nnn(C[C@H]3CCCC3(F)F)n2)c1	ZINC000450699028	CF	On-Demand	Anodyne	SCARB1	36	47
COc1cccc(-c2nnn(C[C@@H]3CCCC3(F)F)n2)c1	ZINC000450699029	CF	On-Demand	Anodyne	SCARB1	36	47
CC(F)(F)CCOc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000450699035	CH	On-Demand	Bother	ENR	0	40
C[C@@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450699064	ED	On-Demand	Anodyne	GSK3A	20	46
C[C@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450699065	ED	On-Demand	Anodyne	GSK3A	20	46
C[C@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450699066	ED	On-Demand	Anodyne	GSK3A	20	46
C[C@@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450699067	ED	On-Demand	Anodyne	GSK3A	20	46
Cn1cc([C@H]2CN(c3ccnc4cc(Cl)ccc34)CC23CCOCC3)cn1	ZINC000450699072	GI	On-Demand	Anodyne	HRP1_PLAFA	43	31
Cn1cc([C@@H]2CN(c3ccnc4cc(Cl)ccc34)CC23CCOCC3)cn1	ZINC000450699073	GI	On-Demand	Anodyne	HRP1_PLAFA	43	31
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCCCS1(=O)=O	ZINC000450699079	FD	On-Demand	Anodyne	GSK3A	15	43
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCCCS1(=O)=O	ZINC000450699080	FD	On-Demand	Anodyne	GSK3A	15	43
COC(=O)c1ccc(OCCC[C@@H](C)O)c(Cl)c1	ZINC000450699084	CF	On-Demand	Anodyne	S1PR4	23	44
COC(=O)c1ccc(OCCC[C@H](C)O)c(Cl)c1	ZINC000450699085	CF	On-Demand	Anodyne	S1PR4	23	44
CC(=O)N[C@H](C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)C(C)(C)C	ZINC000450699086	EE	On-Demand	Anodyne	Q82323_9DELA	52	30
CC(=O)N[C@H](C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C)C(C)(C)C	ZINC000450699086	EE	On-Demand	Anodyne	DERP1	0	40
CC(=O)N[C@H](C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C)C(C)(C)C	ZINC000450699087	EE	On-Demand	Anodyne	Q82323_9DELA	52	30
CC(=O)N[C@H](C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C)C(C)(C)C	ZINC000450699087	EE	On-Demand	Anodyne	DERP1	0	40
CC(=O)N[C@H](C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)C(C)(C)C	ZINC000450699088	EE	On-Demand	Anodyne	Q82323_9DELA	52	30
CC(=O)N[C@H](C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C)C(C)(C)C	ZINC000450699088	EE	On-Demand	Anodyne	DERP1	0	40
CC(=O)N[C@H](C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C)C(C)(C)C	ZINC000450699089	EE	On-Demand	Anodyne	Q82323_9DELA	52	30
CC(=O)N[C@H](C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C)C(C)(C)C	ZINC000450699089	EE	On-Demand	Anodyne	DERP1	0	40
COCC(C)(C)C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450699096	DE	On-Demand	Anodyne	HSC82	42	39
CC(C)(C)OC(=O)C1CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450699097	FF	On-Demand	Anodyne	SCD1	41	48
Cc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450699098	CF	On-Demand	Anodyne	PDE3A	45	35
Cc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450699098	CF	On-Demand	Anodyne	PDGFRB	33	46
Cc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450699098	CF	On-Demand	Anodyne	PDE3B	66	35
Cc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450699098	CF	On-Demand	Anodyne	SIRT3	43	37
Cc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450699098	CF	On-Demand	Anodyne	SIRT1	40	35
COc1ccc(-c2noc(CN3CCC4(CC3)OCCc3ccsc34)n2)nn1	ZINC000450699099	GF	On-Demand	Anodyne	OPRL1	45	38
COc1cc(OC)c2ncnc(NC[C@H]3CCOC[C@H]3OC)c2c1	ZINC000450699101	ED	On-Demand	Anodyne	PDE6A	40	31
COc1cc(OC)c2ncnc(NC[C@@H]3CCOC[C@@H]3OC)c2c1	ZINC000450699103	ED	On-Demand	Anodyne	PDE6A	40	31
COc1cc(OC)c2ncnc(NC[C@@H]3CCOC[C@H]3OC)c2c1	ZINC000450699105	ED	On-Demand	Anodyne	PDE6A	40	31
c1ccc(-c2nc([C@@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n[nH]2)cc1	ZINC000450699142	EG	On-Demand	Anodyne	AKT2	45	33
c1ccc(-c2nc([C@H]3CCCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)n[nH]2)cc1	ZINC000450699143	EG	On-Demand	Anodyne	AKT2	45	33
c1ccc(-c2nc([C@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n[nH]2)cc1	ZINC000450699144	EG	On-Demand	Anodyne	AKT2	45	33
c1ccc(-c2nc([C@@H]3CCCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)n[nH]2)cc1	ZINC000450699145	EG	On-Demand	Anodyne	AKT2	45	33
CC(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450699161	CG	On-Demand	Anodyne	SLC6A1	62	35
CC(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450699161	CG	On-Demand	Anodyne	CYP2J2	64	46
CC(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450699171	CG	On-Demand	Anodyne	SLC6A1	62	35
CC(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450699171	CG	On-Demand	Anodyne	CYP2J2	64	46
CCOCc1nc(C)c(C(=O)NCCc2cn(C)c3cc(F)ccc23)s1	ZINC000450699173	GH	On-Demand	Anodyne	SCD1	24	41
CCOCc1nc(C)c(C(=O)NCCc2cn(C)c3cc(F)ccc23)s1	ZINC000450699173	GH	On-Demand	Anodyne	SCD	19	41
COc1cc2c(cc1F)CN(Cc1cnns1)CC2	ZINC000450699176	CE	On-Demand	Anodyne	ABCB1B	56	32
COc1cc2c(cc1F)CN(Cc1cnns1)CC2	ZINC000450699176	CE	On-Demand	Anodyne	ABCB1	0	48
COc1ncc(CNc2cncc(C(=O)N(C)C)n2)cc1Cl	ZINC000450699205	DD	On-Demand	Anodyne	PDE6A	40	32
COC(=O)c1csc(CN2CCc3cc(OC)c(F)cc3C2)n1	ZINC000450699206	EF	On-Demand	Anodyne	ABCB1	29	46
CN(CCN1CCc2ncc([N+](=O)[O-])cc2C1)Cc1ccccc1	ZINC000450699235	EE	On-Demand	Bother	SIGMAR1	17	47
C=C(C)CN(C)Cc1cccc(C(C)=O)c1	ZINC000450699238	BF	On-Demand	Mild	MAOA	16	40
C=C(C)CN(C)Cc1cccc(C(C)=O)c1	ZINC000450699238	BF	On-Demand	Mild	HSD17B2	19	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCSC2(CCOCC2)C1	ZINC000450699253	FH	On-Demand	Anodyne	CACNA1B	36	40
COc1cccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)c1	ZINC000450699264	GI	On-Demand	Anodyne	HCRTR2	19	41
COc1cccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)c1	ZINC000450699266	GI	On-Demand	Anodyne	HCRTR2	19	41
CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)c1ccnn1CC(F)(F)F	ZINC000450699267	GH	On-Demand	Anodyne	CTRA_BOVIN	59	32
CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)c1ccnn1CC(F)(F)F	ZINC000450699267	GH	On-Demand	Anodyne	CTSG	41	32
CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)c1ccnn1CC(F)(F)F	ZINC000450699267	GH	On-Demand	Anodyne	CELA2A	48	32
CC1(C)[C@@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@@H]1OCc1ccccc1	ZINC000450699268	GH	On-Demand	Anodyne	CTRA_BOVIN	59	32
CC1(C)[C@@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@@H]1OCc1ccccc1	ZINC000450699268	GH	On-Demand	Anodyne	CTSG	41	32
CC1(C)[C@@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@@H]1OCc1ccccc1	ZINC000450699268	GH	On-Demand	Anodyne	CELA2A	48	32
CC1(C)[C@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@H]1OCc1ccccc1	ZINC000450699269	GH	On-Demand	Anodyne	CTRA_BOVIN	59	32
CC1(C)[C@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@H]1OCc1ccccc1	ZINC000450699269	GH	On-Demand	Anodyne	CTSG	41	32
CC1(C)[C@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@H]1OCc1ccccc1	ZINC000450699269	GH	On-Demand	Anodyne	CELA2A	48	32
CC1(C)[C@@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@H]1OCc1ccccc1	ZINC000450699271	GH	On-Demand	Anodyne	CTRA_BOVIN	59	32
CC1(C)[C@@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@H]1OCc1ccccc1	ZINC000450699271	GH	On-Demand	Anodyne	CTSG	41	32
CC1(C)[C@@H](NC(=O)c2ccnn2CC(F)(F)F)C[C@H]1OCc1ccccc1	ZINC000450699271	GH	On-Demand	Anodyne	CELA2A	48	32
COC(=O)CC1(CNC(=O)c2nnn(-c3cnn(C)c3)c2C)CCCCC1	ZINC000450699280	FD	On-Demand	Anodyne	HCN1	49	31
COC(=O)CC1(CNC(=O)c2nnn(-c3cnn(C)c3)c2C)CCCCC1	ZINC000450699280	FD	On-Demand	Anodyne	HCN4	47	31
COC(=O)c1ccc(CN2CCC[C@H]2C2CCOCC2)cc1Cl	ZINC000450699282	EH	On-Demand	Anodyne	OPRK1	0	40
COC(=O)c1ccc(CN2CCC[C@@H]2C2CCOCC2)cc1Cl	ZINC000450699283	EH	On-Demand	Anodyne	OPRK1	0	40
CO[C@@H]1COCC[C@H]1CNc1ncc(C)cc1[N+](=O)[O-]	ZINC000450699293	CD	On-Demand	Bother	PRKCQ	45	38
CO[C@H]1COCC[C@H]1CNc1ncc(C)cc1[N+](=O)[O-]	ZINC000450699294	CD	On-Demand	Bother	PRKCQ	45	38
CO[C@H]1COCC[C@@H]1CNc1ncc(C)cc1[N+](=O)[O-]	ZINC000450699295	CD	On-Demand	Bother	PRKCQ	45	38
CO[C@@H]1COCC[C@@H]1CNc1ncc(C)cc1[N+](=O)[O-]	ZINC000450699296	CD	On-Demand	Bother	PRKCQ	45	38
CC(=O)[C@@](C)(O)CN1CCO[C@H](Cc2ccccc2)C1	ZINC000450699301	CD	On-Demand	Anodyne	CYP2J2	45	32
CC(=O)[C@@](C)(O)CN1CCO[C@@H](Cc2ccccc2)C1	ZINC000450699302	CD	On-Demand	Anodyne	CYP2J2	45	32
CC(=O)[C@](C)(O)CN1CCO[C@H](Cc2ccccc2)C1	ZINC000450699303	CD	On-Demand	Anodyne	CYP2J2	45	32
CC(=O)[C@](C)(O)CN1CCO[C@@H](Cc2ccccc2)C1	ZINC000450699304	CD	On-Demand	Anodyne	CYP2J2	45	32
Cc1nc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1C#N	ZINC000450699320	CE	On-Demand	Mild	AR	41	38
Cc1nc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1C#N	ZINC000450699321	CE	On-Demand	Mild	AR	41	38
Cc1nc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1C#N	ZINC000450699322	CE	On-Demand	Mild	AR	41	38
Cc1nc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1C#N	ZINC000450699323	CE	On-Demand	Mild	AR	41	38
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1nc2ccccc2[nH]1	ZINC000450699366	CF	On-Demand	Anodyne	KCNN3	42	54
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1nc2ccccc2[nH]1	ZINC000450699367	CF	On-Demand	Anodyne	KCNN3	42	54
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1nc2ccccc2[nH]1	ZINC000450699368	CF	On-Demand	Anodyne	KCNN3	42	54
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1nc2ccccc2[nH]1	ZINC000450699369	CF	On-Demand	Anodyne	KCNN3	42	54
N#Cc1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1C(F)(F)F	ZINC000450699379	DH	On-Demand	Mild	AR	70	52
N#Cc1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)cc1C(F)(F)F	ZINC000450699380	DH	On-Demand	Mild	AR	70	52
N#Cc1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1C(F)(F)F	ZINC000450699381	DH	On-Demand	Mild	AR	70	52
N#Cc1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1C(F)(F)F	ZINC000450699382	DH	On-Demand	Mild	AR	70	52
O=C1CCC(CN2CCN(c3ccc(F)cn3)CC2)CC1	ZINC000450699405	CE	On-Demand	Anodyne	SLC27A1	28	45
C[C@H](CCC1CC1)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450699436	DF	On-Demand	Anodyne	CA2	22	40
C[C@@H](CCC1CC1)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450699438	DF	On-Demand	Anodyne	CA2	22	40
O=C(NCc1nnnn1CC1CC1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450699444	FF	On-Demand	Anodyne	RBP4	66	38
CC/C=C\CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699445	DC	On-Demand	Anodyne	ADORA2B	41	32
CC/C=C\CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699445	DC	On-Demand	Anodyne	TGM2	48	43
CC/C=C\CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699445	DC	On-Demand	Anodyne	F13A1	47	34
CC/C=C\CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699445	DC	On-Demand	Anodyne	GCKR	54	32
CC/C=C\CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699445	DC	On-Demand	Anodyne	NAMPT	24	40
CC/C=C/CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699446	DC	On-Demand	Anodyne	ADORA2B	41	32
CC/C=C/CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699446	DC	On-Demand	Anodyne	TGM2	48	43
CC/C=C/CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699446	DC	On-Demand	Anodyne	F13A1	47	34
CC/C=C/CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699446	DC	On-Demand	Anodyne	GCKR	54	32
CC/C=C/CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450699446	DC	On-Demand	Anodyne	NAMPT	24	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CC(=O)N(C)C1	ZINC000450699447	BC	On-Demand	Anodyne	HSD17B2	56	37
CCNc1ccc(Cl)cc1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450699451	GI	On-Demand	Anodyne	F10	25	41
C[C@H](c1ccccc1)[C@H](O)CN1CC(=O)N(C)C1	ZINC000450699453	BC	On-Demand	Anodyne	HSD17B2	56	37
C[C@@H](c1ccccc1)[C@H](O)CN1CC(=O)N(C)C1	ZINC000450699454	BC	On-Demand	Anodyne	HSD17B2	56	37
C[C@H](c1ccccc1)[C@@H](O)CN1CC(=O)N(C)C1	ZINC000450699456	BC	On-Demand	Anodyne	HSD17B2	56	37
O=C(c1cccc(C(F)(F)F)n1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450699465	GI	On-Demand	Anodyne	GRIN2B	51	43
O=C(c1cccc(C(F)(F)F)n1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450699465	GI	On-Demand	Anodyne	TRPV1	35	46
O=C(c1cccc(C(F)(F)F)n1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450699465	GI	On-Demand	Anodyne	CCR3	48	40
O=C(c1cccc(C(F)(F)F)n1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450699465	GI	On-Demand	Anodyne	SFRP1	86	36
O=C(c1cccc(C(F)(F)F)n1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450699465	GI	On-Demand	Anodyne	WNT3	66	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699475	GH	On-Demand	Anodyne	GHRHR	45	30
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699475	GH	On-Demand	Anodyne	MC4R	40	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699475	GH	On-Demand	Anodyne	CTSK	17	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699475	GH	On-Demand	Anodyne	CACNA1B	25	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699475	GH	On-Demand	Anodyne	CCR1	44	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699475	GH	On-Demand	Anodyne	CCKBR	32	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699478	GH	On-Demand	Anodyne	GHRHR	45	30
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699478	GH	On-Demand	Anodyne	MC4R	40	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699478	GH	On-Demand	Anodyne	CTSK	17	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699478	GH	On-Demand	Anodyne	CACNA1B	25	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699478	GH	On-Demand	Anodyne	CCR1	44	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699478	GH	On-Demand	Anodyne	CCKBR	32	40
COc1cc(CC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)ccc1O	ZINC000450699486	EG	On-Demand	Anodyne	MLNR	28	45
COc1cc(CC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)ccc1O	ZINC000450699486	EG	On-Demand	Anodyne	RORC	46	38
COc1cc(CC(=O)N2CC[C@H](c3c(F)cccc3F)C2)ccc1O	ZINC000450699487	EG	On-Demand	Anodyne	MLNR	28	45
COc1cc(CC(=O)N2CC[C@H](c3c(F)cccc3F)C2)ccc1O	ZINC000450699487	EG	On-Demand	Anodyne	RORC	46	38
CN(CCN(C)C(=O)c1cc(Cl)c2ccccc2n1)CC(F)F	ZINC000450699498	EG	On-Demand	Anodyne	TSPO	34	45
COC[C@@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450699499	DE	On-Demand	Anodyne	AMY2	46	32
COC[C@@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450699499	DE	On-Demand	Anodyne	Q9NBD4_PLAFA	0	43
COC[C@@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450699499	DE	On-Demand	Anodyne	Q9NAW4_PLAFA	35	43
COC[C@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450699500	DE	On-Demand	Anodyne	AMY2	46	32
COC[C@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450699500	DE	On-Demand	Anodyne	Q9NBD4_PLAFA	0	43
COC[C@H](NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)OC	ZINC000450699500	DE	On-Demand	Anodyne	Q9NAW4_PLAFA	35	43
CCNc1ccc(Cl)cc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450699520	EJ	On-Demand	Anodyne	KLKB1	28	44
CCNc1ccc(Cl)cc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450699520	EJ	On-Demand	Anodyne	F10	37	45
CC(C)(C)OC(=O)C1CN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450699523	EF	On-Demand	Anodyne	SORD	43	37
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450699526	ED	On-Demand	Anodyne	NPY2R	59	37
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450699529	ED	On-Demand	Anodyne	NPY2R	59	37
COc1cccc(-c2nnn(CC3(OC)CCC3)n2)c1	ZINC000450699543	CD	On-Demand	Anodyne	SCARB1	19	44
CC/C=C\CNc1nccn(C(F)F)c1=O	ZINC000450699565	BE	On-Demand	Anodyne	CASP3	63	36
CC/C=C\CNc1nccn(C(F)F)c1=O	ZINC000450699565	BE	On-Demand	Anodyne	CASP8	51	36
CC/C=C\CNc1nccn(C(F)F)c1=O	ZINC000450699565	BE	On-Demand	Anodyne	CASP7	46	36
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699593	FI	On-Demand	Anodyne	CCR1	40	42
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699593	FI	On-Demand	Anodyne	DPP4	18	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699595	FI	On-Demand	Anodyne	CCR1	40	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699595	FI	On-Demand	Anodyne	DPP4	18	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699597	FI	On-Demand	Anodyne	CCR1	40	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450699597	FI	On-Demand	Anodyne	DPP4	18	41
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699598	FI	On-Demand	Anodyne	CCR1	40	42
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450699598	FI	On-Demand	Anodyne	DPP4	18	41
COc1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1S(C)(=O)=O	ZINC000450699600	GG	On-Demand	Anodyne	SLC9A1	30	41
COc1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1S(C)(=O)=O	ZINC000450699600	GG	On-Demand	Anodyne	L3MBTL1	0	40
COc1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)cc1S(C)(=O)=O	ZINC000450699600	GG	On-Demand	Anodyne	L3MBTL3	82	40
COc1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1S(C)(=O)=O	ZINC000450699601	GG	On-Demand	Anodyne	SLC9A1	30	41
COc1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1S(C)(=O)=O	ZINC000450699601	GG	On-Demand	Anodyne	L3MBTL1	0	40
COc1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)cc1S(C)(=O)=O	ZINC000450699601	GG	On-Demand	Anodyne	L3MBTL3	82	40
Fc1ccc(N2CCN(CC3=CCCCC3)CC2)nc1	ZINC000450699602	CF	On-Demand	Anodyne	SLC27A1	34	45
CC(=O)c1ccc(CN2CCO[C@H](C(C)C)C2)cc1	ZINC000450699617	CF	On-Demand	Anodyne	DRD4	21	42
CC(=O)c1ccc(CN2CCO[C@@H](C(C)C)C2)cc1	ZINC000450699619	CF	On-Demand	Anodyne	DRD4	21	42
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](Cc3ccccc3)C2)cc1	ZINC000450699620	FF	On-Demand	Anodyne	DRD4	24	53
CCS(=O)(=O)c1ccc(CN2CCO[C@H](Cc3ccccc3)C2)cc1	ZINC000450699622	FF	On-Demand	Anodyne	DRD4	24	53
COC(=O)C1(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000450699651	GF	On-Demand	Anodyne	MMP13	20	41
COC(=O)C1(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000450699651	GF	On-Demand	Anodyne	MMP2	27	41
COC(=O)C1(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000450699651	GF	On-Demand	Anodyne	EPHX2	42	38
CO[C@@H](Cc1ccccc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450699656	DC	On-Demand	Anodyne	TIMP3	55	36
CO[C@@H](Cc1ccccc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450699656	DC	On-Demand	Anodyne	F11	44	34
CO[C@@H](Cc1ccccc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450699656	DC	On-Demand	Anodyne	AMP1_PLAFQ	45	34
CO[C@H](Cc1ccccc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450699658	DC	On-Demand	Anodyne	TIMP3	55	36
CO[C@H](Cc1ccccc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450699658	DC	On-Demand	Anodyne	F11	44	34
CO[C@H](Cc1ccccc1)C(=O)NCc1nnnn1CC1CC1	ZINC000450699658	DC	On-Demand	Anodyne	AMP1_PLAFQ	45	34
COc1cccc(-c2nnc(SCCC(C)(F)F)n2Cc2ccco2)c1	ZINC000450699679	GJ	On-Demand	Anodyne	HCRTR2	20	44
COC(=O)[C@H]1C[C@@H](OC)CCN1CCN(C)Cc1ccccc1	ZINC000450699691	DD	On-Demand	Anodyne	AGTR2	52	37
COC(=O)[C@H]1C[C@H](OC)CCN1CCN(C)Cc1ccccc1	ZINC000450699692	DD	On-Demand	Anodyne	AGTR2	52	37
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCN(C)Cc1ccccc1	ZINC000450699693	DD	On-Demand	Anodyne	AGTR2	52	37
COC(=O)[C@@H]1C[C@H](OC)CCN1CCN(C)Cc1ccccc1	ZINC000450699694	DD	On-Demand	Anodyne	AGTR2	52	37
Nc1ncccc1CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450699712	EF	On-Demand	Anodyne	AKT2	38	43
Nc1ncccc1CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450699712	EF	On-Demand	Anodyne	AKT1	23	41
Nc1ncccc1CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450699716	EF	On-Demand	Anodyne	AKT2	38	43
Nc1ncccc1CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450699716	EF	On-Demand	Anodyne	AKT1	23	41
COc1ncc(CNc2ncccc2C(=O)OC(C)C)cc1Cl	ZINC000450699719	EG	On-Demand	Anodyne	BDKRB1	0	42
COc1ncc(CNc2ncccc2C(=O)OC(C)C)cc1Cl	ZINC000450699719	EG	On-Demand	Anodyne	PDE6A	41	31
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450699736	ED	On-Demand	Anodyne	AKT2	50	34
CC(=O)[C@](C)(O)CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450699737	ED	On-Demand	Anodyne	AKT2	50	34
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450699738	ED	On-Demand	Anodyne	AKT2	50	34
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1	ZINC000450699739	ED	On-Demand	Anodyne	AKT2	50	34
CC1CCN(C(=O)C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450699745	FD	On-Demand	Anodyne	GSK3A	18	43
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1OC1CC1	ZINC000450699749	GI	On-Demand	Anodyne	KCNH2	39	44
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1OC1CC1	ZINC000450699749	GI	On-Demand	Anodyne	MBTPS1	51	36
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1OC1CC1	ZINC000450699749	GI	On-Demand	Anodyne	Q8WSF8_APLCA	46	39
COCCOC1CCC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450699750	GF	On-Demand	Anodyne	GSK3B	0	49
COCCOC1CCC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1	ZINC000450699750	GF	On-Demand	Anodyne	GSK3A	32	49
COc1ncc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])cc1Cl	ZINC000450699763	GG	On-Demand	Bother	TAAR1	25	51
Cc1cnc(CCCC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)o1	ZINC000450699764	EG	On-Demand	Anodyne	ACER2	0	41
N#CC1(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)CCC1	ZINC000450699765	DG	On-Demand	Mild	AKT2	47	35
Cc1cnc(CCCC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)o1	ZINC000450699766	EG	On-Demand	Anodyne	ACER2	0	41
N#CC1(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)CCC1	ZINC000450699767	DG	On-Demand	Mild	AKT2	47	35
Cc1cnc(CCCC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)o1	ZINC000450699768	EG	On-Demand	Anodyne	ACER2	0	41
Cc1cnc(CCCC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)o1	ZINC000450699770	EG	On-Demand	Anodyne	ACER2	0	41
CC(C)Oc1cc(F)ccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450699771	FI	On-Demand	Anodyne	F10	25	41
CC(C)Oc1cc(F)ccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450699771	FI	On-Demand	Anodyne	GCK	28	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	MME	29	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	ANPEP	40	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	KLK3	48	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	CTSB	49	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	CTSK	54	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	CTSL	37	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	CAPNS1	62	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	HLA-DRB1	42	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	CTSS	29	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	CAPN1	97	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	CAPN2	125	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	FPR1	80	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	NPR	76	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	PSMB5	44	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699782	GG	On-Demand	Anodyne	Q9N6S8_PLAFA	41	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	MME	29	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	ANPEP	40	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	KLK3	48	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	CTSB	49	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	CTSK	54	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	CTSL	37	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	CAPNS1	62	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	HLA-DRB1	42	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	CTSS	29	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	CAPN1	97	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	CAPN2	125	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	FPR1	80	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	NPR	76	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	PSMB5	44	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699783	GG	On-Demand	Anodyne	Q9N6S8_PLAFA	41	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	MME	29	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	ANPEP	40	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	KLK3	48	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	CTSB	49	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	CTSK	54	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	CTSL	37	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	CAPNS1	62	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	HLA-DRB1	42	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	CTSS	29	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	CAPN1	97	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	CAPN2	125	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	FPR1	80	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	NPR	76	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	PSMB5	44	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450699785	GG	On-Demand	Anodyne	Q9N6S8_PLAFA	41	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	MME	29	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	ANPEP	40	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	KLK3	48	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	CTSB	49	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	CTSK	54	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	CTSL	37	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	CAPNS1	62	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	HLA-DRB1	42	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	CTSS	29	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	CAPN1	97	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	CAPN2	125	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	FPR1	80	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	NPR	76	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	PSMB5	44	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450699786	GG	On-Demand	Anodyne	Q9N6S8_PLAFA	41	34
CC1(C)CC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)O1	ZINC000450699788	EF	On-Demand	Anodyne	GSK3A	18	43
CC1(C)CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)O1	ZINC000450699790	EF	On-Demand	Anodyne	GSK3A	18	43
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000450699794	GI	On-Demand	Anodyne	GSK3A	24	45
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000450699797	GI	On-Demand	Anodyne	GSK3A	24	45
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000450699800	GI	On-Demand	Anodyne	GSK3A	24	45
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000450699802	GI	On-Demand	Anodyne	GSK3A	24	45
CC(C)c1nnc(CN2CCC3(CC2)OCCc2ccsc23)s1	ZINC000450699811	EH	On-Demand	Anodyne	OPRL1	59	44
c1cc2c(s1)C1(CCN(Cc3nnc(C4CC4)s3)CC1)OCC2	ZINC000450699822	EH	On-Demand	Anodyne	OPRL1	48	41
COC(=O)[C@H]1CC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450699833	FD	On-Demand	Anodyne	GSK3A	19	44
COC(=O)[C@@H]1CC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450699834	FD	On-Demand	Anodyne	GSK3A	19	44
COC(=O)[C@H]1CC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450699835	FD	On-Demand	Anodyne	GSK3A	19	44
COC(=O)[C@@H]1CC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450699836	FD	On-Demand	Anodyne	GSK3A	19	44
CC(=O)CCCCCSc1nnc(O)n1CCc1ccccc1	ZINC000450699863	EG	On-Demand	Anodyne	FAAH	48	40
CC(=O)CCCCCSc1nnc(O)n1CCc1ccccc1	ZINC000450699863	EG	On-Demand	Anodyne	CES1	49	34
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)nc1	ZINC000450699864	ED	On-Demand	Anodyne	GCKR	17	43
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)nc1	ZINC000450699865	ED	On-Demand	Anodyne	GCKR	17	43
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)nc1	ZINC000450699866	ED	On-Demand	Anodyne	GCKR	17	43
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)nc1	ZINC000450699867	ED	On-Demand	Anodyne	GCKR	17	43
O[C@@]1(C(F)F)CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450699894	DE	On-Demand	Anodyne	SORD	51	41
O[C@]1(C(F)F)CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450699895	DE	On-Demand	Anodyne	SORD	51	41
O=C(Nc1ccccc1)c1ccc(N2CC[C@@](O)(C(F)F)C2)nn1	ZINC000450699896	ED	On-Demand	Anodyne	SCD1	45	51
O=C(Nc1ccccc1)c1ccc(N2CC[C@@](O)(C(F)F)C2)nn1	ZINC000450699896	ED	On-Demand	Anodyne	SCD	37	40
O=C(Nc1ccccc1)c1ccc(N2CC[C@](O)(C(F)F)C2)nn1	ZINC000450699897	ED	On-Demand	Anodyne	SCD1	45	51
O=C(Nc1ccccc1)c1ccc(N2CC[C@](O)(C(F)F)C2)nn1	ZINC000450699897	ED	On-Demand	Anodyne	SCD	37	40
CC1(O)CC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450699900	DD	On-Demand	Anodyne	GSK3A	23	48
CC/C=C/CNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450699957	FE	On-Demand	Bother	BDKRB1	37	52
CC/C=C\CNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450699958	FE	On-Demand	Bother	BDKRB1	37	52
CO[C@@H]1COCC[C@@H]1CNc1ncnc2scc(-c3ccccc3)c12	ZINC000450699987	FH	On-Demand	Anodyne	ADRB3	0	40
CO[C@@H]1COCC[C@@H]1CNc1ncnc2scc(-c3ccccc3)c12	ZINC000450699987	FH	On-Demand	Anodyne	TNK2	68	38
CO[C@@H]1COCC[C@H]1CNc1ncnc2scc(-c3ccccc3)c12	ZINC000450699988	FH	On-Demand	Anodyne	ADRB3	0	40
CO[C@@H]1COCC[C@H]1CNc1ncnc2scc(-c3ccccc3)c12	ZINC000450699988	FH	On-Demand	Anodyne	TNK2	68	38
CO[C@H]1COCC[C@H]1CNc1ncnc2scc(-c3ccccc3)c12	ZINC000450699989	FH	On-Demand	Anodyne	ADRB3	0	40
CO[C@H]1COCC[C@H]1CNc1ncnc2scc(-c3ccccc3)c12	ZINC000450699989	FH	On-Demand	Anodyne	TNK2	68	38
CO[C@H]1COCC[C@@H]1CNc1ncnc2scc(-c3ccccc3)c12	ZINC000450699990	FH	On-Demand	Anodyne	ADRB3	0	40
CO[C@H]1COCC[C@@H]1CNc1ncnc2scc(-c3ccccc3)c12	ZINC000450699990	FH	On-Demand	Anodyne	TNK2	68	38
CCc1cc(CCCN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)on1	ZINC000450700019	GH	On-Demand	Anodyne	OPRD1	15	48
C[C@@]12CN(c3ncnc4[nH]ccc34)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450700036	CF	On-Demand	Anodyne	AKT2	41	41
C[C@@]12CN(c3ncnc4[nH]ccc34)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000450700036	CF	On-Demand	Anodyne	AKT1	31	40
C[C@@]12CN(c3ncnc4[nH]ccc34)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450700038	CF	On-Demand	Anodyne	AKT2	41	41
C[C@@]12CN(c3ncnc4[nH]ccc34)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000450700038	CF	On-Demand	Anodyne	AKT1	31	40
C[C@H](CC(C)(C)O)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450700061	CC	On-Demand	Anodyne	CA2	47	41
C[C@H](CC(C)(C)O)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450700061	CC	On-Demand	Anodyne	CYNT	45	33
C[C@@H](CC(C)(C)O)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450700063	CC	On-Demand	Anodyne	CA2	47	41
C[C@@H](CC(C)(C)O)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450700063	CC	On-Demand	Anodyne	CYNT	45	33
C[C@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1	ZINC000450700081	GG	On-Demand	Anodyne	MTNN	44	32
C[C@@H](CC(C)(C)O)Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1	ZINC000450700083	GG	On-Demand	Anodyne	MTNN	44	32
CC(C)Oc1cc(F)ccc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450700087	CE	On-Demand	Anodyne	P2RX7	28	51
CC(C)Oc1cc(F)ccc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450700090	CE	On-Demand	Anodyne	P2RX7	28	51
CCNc1ccc(Cl)cc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450700093	CE	On-Demand	Anodyne	P2RX7	45	56
CCNc1ccc(Cl)cc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450700094	CE	On-Demand	Anodyne	P2RX7	45	56
CC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1	ZINC000450700104	DF	On-Demand	Anodyne	DRD4	42	50
CC(=O)c1ccc(CN2CCN(c3ccc(F)cn3)CC2)cc1	ZINC000450700104	DF	On-Demand	Anodyne	SLC27A1	66	49
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCC1=CCCCC1	ZINC000450700111	FJ	On-Demand	Anodyne	OPRD1	15	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCC1=CCCCC1	ZINC000450700111	FJ	On-Demand	Anodyne	ACHP_LYMST	16	42
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CCC1=CCCCC1	ZINC000450700111	FJ	On-Demand	Anodyne	Q8WSF8_APLCA	33	42
O=C(c1cn(CCc2ccccc2)nn1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450700113	GG	On-Demand	Anodyne	THYX_PBCV1	0	42
O=C(c1cn(CCc2ccccc2)nn1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450700115	GG	On-Demand	Anodyne	THYX_PBCV1	0	42
CCC[C@H](OC)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450700117	EH	On-Demand	Anodyne	GRIN2B	41	36
CCC[C@H](OC)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450700117	EH	On-Demand	Anodyne	CCR3	40	41
C[C@@H]1CCCN(C(=O)C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450700120	FD	On-Demand	Anodyne	GSK3A	15	41
C[C@H]1CCCN(C(=O)C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450700121	FD	On-Demand	Anodyne	GSK3A	15	41
CCC[C@@H](OC)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450700126	EH	On-Demand	Anodyne	GRIN2B	41	36
CCC[C@@H](OC)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450700126	EH	On-Demand	Anodyne	CCR3	40	41
COC(=O)[C@@H]1C[C@H](OC)CCN1CCCC(=O)c1ccccc1	ZINC000450700130	DE	On-Demand	Anodyne	CYP2J2	55	39
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccccc1	ZINC000450700133	DE	On-Demand	Anodyne	CYP2J2	55	39
COC(=O)[C@H]1C[C@H](OC)CCN1CCCC(=O)c1ccccc1	ZINC000450700135	DE	On-Demand	Anodyne	CYP2J2	55	39
COC(=O)[C@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccccc1	ZINC000450700137	DE	On-Demand	Anodyne	CYP2J2	55	39
O=[N+]([O-])c1cc(Cl)ccc1OCC1CC(F)(F)C1	ZINC000450700145	CH	On-Demand	Bother	ENR	0	40
C[C@H](CC(C)(C)O)Nc1ccc(S(C)(=O)=O)cc1C(F)(F)F	ZINC000450700156	EG	On-Demand	Anodyne	TRPV1	45	32
C[C@@H](CC(C)(C)O)Nc1ccc(S(C)(=O)=O)cc1C(F)(F)F	ZINC000450700158	EG	On-Demand	Anodyne	TRPV1	45	32
COc1ncc(CNc2ncnc3c2CCCCC3)cc1Cl	ZINC000450700175	DF	On-Demand	Anodyne	PDE6A	44	34
COC(=O)Cc1ccc(NCc2cnc(OC)c(Cl)c2)c([N+](=O)[O-])c1	ZINC000450700176	FF	On-Demand	Bother	PDE5A	15	41
CO[C@H]1COCC[C@@H]1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450700177	FD	On-Demand	Bother	BDKRB1	0	41
CO[C@@H]1COCC[C@@H]1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450700178	FD	On-Demand	Bother	BDKRB1	0	41
CO[C@H]1COCC[C@H]1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450700180	FD	On-Demand	Bother	BDKRB1	0	41
CO[C@@H]1COCC[C@H]1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450700181	FD	On-Demand	Bother	BDKRB1	0	41
Fc1ccc(N2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450700186	EG	On-Demand	Anodyne	DRD1	0	40
Fc1ccc(N2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450700186	EG	On-Demand	Anodyne	DRD4	32	43
Fc1ccc(N2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450700186	EG	On-Demand	Anodyne	DRD3	23	43
Fc1ccc(N2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450700186	EG	On-Demand	Anodyne	SCD1	57	41
Fc1ccc(N2CCN(Cc3ccccc3OC3CC3)CC2)nc1	ZINC000450700186	EG	On-Demand	Anodyne	SLC27A1	40	38
COC(=O)C1(CN[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000450700208	CG	On-Demand	Anodyne	TIMP3	41	31
COC(=O)C1(CN[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000450700210	CG	On-Demand	Anodyne	TIMP3	41	31
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CCN(CC(F)F)CC1	ZINC000450700224	GF	On-Demand	Anodyne	GSK3A	35	51
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CCN(CC(F)F)CC1	ZINC000450700224	GF	On-Demand	Anodyne	MAPK1	32	43
COC[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)OC	ZINC000450700241	DD	On-Demand	Anodyne	PIN1	41	39
O=C(CC1CC1)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450700242	CF	On-Demand	Anodyne	GSK3A	16	44
COC[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)OC	ZINC000450700244	DD	On-Demand	Anodyne	PIN1	41	39
C[C@H](CCC1CC1)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450700247	CG	On-Demand	Anodyne	SDH1	0	44
C[C@@H](CCC1CC1)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450700248	CG	On-Demand	Anodyne	SDH1	0	44
CN(CCN(C)C(=O)[C@H]1CCCN1C(=O)c1ccccc1)CC(F)F	ZINC000450700250	FD	On-Demand	Anodyne	ACE	37	40
CN(CCN(C)C(=O)[C@H]1CCCN1C(=O)c1ccccc1)CC(F)F	ZINC000450700250	FD	On-Demand	Anodyne	PREP	71	51
CC(C)C[C@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450700303	GF	On-Demand	Anodyne	GSK3A	19	46
CC(C)C[C@@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450700305	GF	On-Demand	Anodyne	GSK3A	19	46
CC(C)C[C@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450700306	GF	On-Demand	Anodyne	GSK3A	19	46
CC(C)C[C@@H]1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC(=O)N1	ZINC000450700307	GF	On-Demand	Anodyne	GSK3A	19	46
COC[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)C(=O)OC	ZINC000450700328	ED	On-Demand	Anodyne	TIMP3	70	41
COC[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)C(=O)OC	ZINC000450700328	ED	On-Demand	Anodyne	CTSV	40	41
Cc1ccc(-n2cnnc2S[C@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450700332	FG	On-Demand	Anodyne	MAP1	53	33
Cc1ccc(-n2cnnc2S[C@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450700332	FG	On-Demand	Anodyne	GCK	16	42
Cc1ccc(-n2cnnc2S[C@@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450700340	FG	On-Demand	Anodyne	MAP1	53	33
Cc1ccc(-n2cnnc2S[C@@H](C)C(=O)Nc2nccs2)c(C)c1	ZINC000450700340	FG	On-Demand	Anodyne	GCK	16	42
COC[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)C(=O)OC	ZINC000450700347	ED	On-Demand	Anodyne	TIMP3	70	41
COC[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)C(=O)OC	ZINC000450700347	ED	On-Demand	Anodyne	CTSV	40	41
CCOC(=O)C1(CNC(=O)c2ccc(C3CC3)nc2C)CC1	ZINC000450700348	DE	On-Demand	Anodyne	HCN4	41	32
COc1cccc(-c2nnn(C[C@H]3CCC(F)(F)C3)n2)c1	ZINC000450700353	CF	On-Demand	Anodyne	SCARB1	29	45
COc1cccc(-c2nnn(C[C@@H]3CCC(F)(F)C3)n2)c1	ZINC000450700355	CF	On-Demand	Anodyne	SCARB1	29	45
CCOC(=O)C1(CNC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450700389	GF	On-Demand	Anodyne	MMP13	18	46
CCOC(=O)C1(CNC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450700389	GF	On-Demand	Anodyne	KCNK3	43	34
C[C@@H]1C[C@H](C(F)(F)F)CCN1c1nc2ccccc2o1	ZINC000450700394	CH	On-Demand	Anodyne	HTR3A	18	51
C[C@H]1C[C@@H](C(F)(F)F)CCN1c1nc2ccccc2o1	ZINC000450700395	CH	On-Demand	Anodyne	HTR3A	18	51
COC(=O)CC1(CNC(=O)c2cn(CC3CC3)nn2)CCCCC1	ZINC000450700405	ED	On-Demand	Anodyne	HCN1	55	36
COC(=O)CC1(CNC(=O)c2cn(CC3CC3)nn2)CCCCC1	ZINC000450700405	ED	On-Demand	Anodyne	HCN4	54	36
CC(=O)CCCCCSc1nnc(-c2ccoc2C)n1-c1ccccc1	ZINC000450700422	FK	On-Demand	Anodyne	HCRTR2	20	43
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700423	DG	On-Demand	Anodyne	HRP1_PLAFA	125	47
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700423	DG	On-Demand	Anodyne	HNMT	69	45
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700423	DG	On-Demand	Anodyne	BOTA	41	49
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700424	DG	On-Demand	Anodyne	HRP1_PLAFA	125	47
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700424	DG	On-Demand	Anodyne	HNMT	69	45
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700424	DG	On-Demand	Anodyne	BOTA	41	49
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700425	DG	On-Demand	Anodyne	HRP1_PLAFA	125	47
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700425	DG	On-Demand	Anodyne	HNMT	69	45
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700425	DG	On-Demand	Anodyne	BOTA	41	49
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700426	DG	On-Demand	Anodyne	HRP1_PLAFA	125	47
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700426	DG	On-Demand	Anodyne	HNMT	69	45
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(Cl)ccc12	ZINC000450700426	DG	On-Demand	Anodyne	BOTA	41	49
O=C(CSC1CC1)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450700436	DD	On-Demand	Anodyne	COLA	48	35
CC/C=C/CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450700448	DE	On-Demand	Bother	BDKRB1	24	45
CC/C=C\CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450700449	DE	On-Demand	Bother	BDKRB1	24	45
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700460	GF	On-Demand	Anodyne	CPT1A	44	30
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700460	GF	On-Demand	Anodyne	TAAR1	27	41
CO[C@@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700460	GF	On-Demand	Anodyne	KCNK3	42	35
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700461	GF	On-Demand	Anodyne	CPT1A	44	30
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700461	GF	On-Demand	Anodyne	TAAR1	27	41
CO[C@H]1COCC[C@@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700461	GF	On-Demand	Anodyne	KCNK3	42	35
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700462	GF	On-Demand	Anodyne	CPT1A	44	30
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700462	GF	On-Demand	Anodyne	TAAR1	27	41
CO[C@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700462	GF	On-Demand	Anodyne	KCNK3	42	35
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700463	GF	On-Demand	Anodyne	CPT1A	44	30
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700463	GF	On-Demand	Anodyne	TAAR1	27	41
CO[C@@H]1COCC[C@H]1CNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450700463	GF	On-Demand	Anodyne	KCNK3	42	35
COC(=O)CC1(CNC(=O)c2cnn3ccc(C)cc23)CCCCC1	ZINC000450700469	EF	On-Demand	Anodyne	HCN1	56	35
COC(=O)CC1(CNC(=O)c2cnn3ccc(C)cc23)CCCCC1	ZINC000450700469	EF	On-Demand	Anodyne	HCN4	53	35
C[C@H]1CN(CCc2ccc(Cl)cc2)CCN1S(C)(=O)=O	ZINC000450700470	DD	On-Demand	Anodyne	SIGMAR1	16	41
COC(=O)c1coc(CN2CCO[C@@H](Cc3ccccc3)C2)n1	ZINC000450700471	DD	On-Demand	Anodyne	DRD4	18	45
COC(=O)c1coc(CN2CCO[C@H](Cc3ccccc3)C2)n1	ZINC000450700472	DD	On-Demand	Anodyne	DRD4	18	45
CCC[C@H](O)CN[C@@H](C(=O)OC(C)(C)C)C(C)C	ZINC000450700491	CE	On-Demand	Anodyne	PGA5	46	42
CCC[C@@H](O)CN[C@@H](C(=O)OC(C)(C)C)C(C)C	ZINC000450700492	CE	On-Demand	Anodyne	PGA5	46	42
COC(=O)c1ccc(CN2CCC(F)(F)C2)cc1Cl	ZINC000450700502	CF	On-Demand	Anodyne	MCHR2	40	32
Cc1nn(C)cc1CN(C)c1ccc(F)c(Cl)c1	ZINC000450700513	CG	On-Demand	Anodyne	DYR_PNECA	18	40
C[C@H]1C[C@H](C(F)(F)F)CCN1c1nc2ccccc2o1	ZINC000450700518	CH	On-Demand	Anodyne	HTR3A	18	51
C[C@@H]1C[C@@H](C(F)(F)F)CCN1c1nc2ccccc2o1	ZINC000450700519	CH	On-Demand	Anodyne	HTR3A	18	51
COc1cc2c(cc1F)CN(Cc1cn(CC3CC3)nn1)CC2	ZINC000450700527	DE	On-Demand	Anodyne	ABCB1	22	46
FC(F)(F)Cn1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)n1	ZINC000450700535	GH	On-Demand	Anodyne	AKT2	40	34
FC(F)(F)Cn1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)n1	ZINC000450700537	GH	On-Demand	Anodyne	AKT2	40	34
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1nc2ccccc2o1	ZINC000450700568	CF	On-Demand	Anodyne	HTR3A	0	53
COc1ncc(CNc2nccc(CO)n2)cc1Cl	ZINC000450700585	CD	On-Demand	Anodyne	CLK4	21	49
COc1ncc(CNc2ncc(C(=O)N3CCCCC3)cc2Cl)cc1Cl	ZINC000450700586	GI	On-Demand	Anodyne	PDE5A	29	43
COc1ncc(CNc2ncc(C(=O)N3CCCCC3)cc2Cl)cc1Cl	ZINC000450700586	GI	On-Demand	Anodyne	PDE6A	42	33
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1nc2ccccc2o1	ZINC000450700588	CF	On-Demand	Anodyne	HTR3A	0	53
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1nc2ccccc2o1	ZINC000450700590	CF	On-Demand	Anodyne	HTR3A	0	53
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1nc2ccccc2o1	ZINC000450700592	CF	On-Demand	Anodyne	HTR3A	0	53
O=C1CN(c2ncccc2C(F)(F)F)CN1CCC(F)(F)F	ZINC000450700635	EF	On-Demand	Anodyne	TRPV1	24	40
COc1cc2c(cc1F)CN(CCc1cscn1)CC2	ZINC000450700656	CF	On-Demand	Anodyne	ABCB1B	64	37
COc1cc2c(cc1F)CN(CCc1cscn1)CC2	ZINC000450700656	CF	On-Demand	Anodyne	ABCB1	24	46
C=C(C)CN(C)CCCC(=O)c1ccccc1	ZINC000450700664	BG	On-Demand	Mild	THRA	26	45
C=C(C)CN(C)CCCC(=O)c1ccccc1	ZINC000450700664	BG	On-Demand	Mild	CYP2J2	47	33
CC(C)(C)OC(=O)C1CN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450700702	DD	On-Demand	Anodyne	GPR119	33	42
COC(=O)c1coc(CN2CCC[C@@H](c3ccc(F)cc3)CC2)n1	ZINC000450700708	EG	On-Demand	Anodyne	CACNA1G	22	57
COC(=O)c1coc(CN2CCC[C@H](c3ccc(F)cc3)CC2)n1	ZINC000450700710	EG	On-Demand	Anodyne	CACNA1G	22	57
CCCc1nc(C)c(COc2ccc(Cl)cc2[N+](=O)[O-])o1	ZINC000450700730	DI	On-Demand	Bother	S1PR4	25	45
FC(F)(F)Cn1ccc(CN2CCC3(CC2)OCCc2ccsc23)n1	ZINC000450700741	FH	On-Demand	Anodyne	OPRL1	46	39
CO[C@@H](C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CC1	ZINC000450700776	DE	On-Demand	Anodyne	GSK3A	15	43
CO[C@H](C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CC1	ZINC000450700777	DE	On-Demand	Anodyne	GSK3A	15	43
C=CCN(CCc1ccco1)C(=O)CCOc1cccc(OC)c1	ZINC000450700787	EG	On-Demand	Mild	LSS	64	39
CC(C)(C)OC(=O)C1CN(c2nc(-c3ccccc3)ns2)C1	ZINC000450700789	DF	On-Demand	Anodyne	FAAH	0	48
CC(C)N1CCCC[C@@H]1CN1CCC2(CC1)OCCc1ccsc12	ZINC000450700793	EH	On-Demand	Anodyne	OPRL1	45	37
CC(C)N1CCCC[C@H]1CN1CCC2(CC1)OCCc1ccsc12	ZINC000450700794	EH	On-Demand	Anodyne	OPRL1	45	37
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	DRD2	31	44
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	DRD1	19	47
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	DRD4	23	48
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	HTR2A	33	56
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	HTR2C	21	57
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	DRD3	15	49
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	CCR3	21	41
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCC(n2ccc(C(F)(F)F)n2)CC1)c1ccc(F)cc1	ZINC000450700796	GI	On-Demand	Anodyne	CYP2J2	59	42
C[C@@H]1[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1(F)F	ZINC000450700797	EF	On-Demand	Anodyne	HSC82	40	36
C[C@H]1[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1(F)F	ZINC000450700798	EF	On-Demand	Anodyne	HSC82	40	36
C[C@@H]1[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1(F)F	ZINC000450700799	EF	On-Demand	Anodyne	HSC82	40	36
C[C@H]1[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1(F)F	ZINC000450700800	EF	On-Demand	Anodyne	HSC82	40	36
COc1cc(CN2CC[C@@H]3CCN(C)C[C@H]32)ccc1Cl	ZINC000450700806	CF	On-Demand	Anodyne	UTS2R	32	48
COc1cc(CN2CC[C@H]3CCN(C)C[C@@H]32)ccc1Cl	ZINC000450700807	CF	On-Demand	Anodyne	UTS2R	32	48
COc1cc(CN2CC[C@H]3CCN(C)C[C@H]32)ccc1Cl	ZINC000450700808	CF	On-Demand	Anodyne	UTS2R	32	48
COc1cc(CN2CC[C@@H]3CCN(C)C[C@@H]32)ccc1Cl	ZINC000450700809	CF	On-Demand	Anodyne	UTS2R	32	48
COc1cccc(OCCC(=O)N[C@H](C)c2ncc(C)o2)c1	ZINC000450700810	DF	On-Demand	Anodyne	MTNR1A	40	42
COc1cccc(OCCC(=O)N[C@H](C)c2ncc(C)o2)c1	ZINC000450700810	DF	On-Demand	Anodyne	MTNR1B	42	42
COc1cccc(OCCC(=O)N[C@@H](C)c2ncc(C)o2)c1	ZINC000450700811	DF	On-Demand	Anodyne	MTNR1A	40	42
COc1cccc(OCCC(=O)N[C@@H](C)c2ncc(C)o2)c1	ZINC000450700811	DF	On-Demand	Anodyne	MTNR1B	42	42
CCOC(=O)c1ccc(CN[C@H](C)[C@H](OC)c2ccccc2Cl)nc1	ZINC000450700822	FH	On-Demand	Anodyne	P2RY12	26	41
CCOC(=O)c1ccc(CN[C@H](C)[C@@H](OC)c2ccccc2Cl)nc1	ZINC000450700823	FH	On-Demand	Anodyne	P2RY12	26	41
CCOC(=O)c1ccc(CN[C@@H](C)[C@@H](OC)c2ccccc2Cl)nc1	ZINC000450700824	FH	On-Demand	Anodyne	P2RY12	26	41
CCOC(=O)c1ccc(CN[C@@H](C)[C@H](OC)c2ccccc2Cl)nc1	ZINC000450700825	FH	On-Demand	Anodyne	P2RY12	26	41
COc1ccc(-c2noc(CN3CCc4cc(OC)c(F)cc4C3)n2)nn1	ZINC000450700826	FE	On-Demand	Anodyne	ABCB1B	58	34
COc1ccc(-c2noc(CN3CCc4cc(OC)c(F)cc4C3)n2)nn1	ZINC000450700826	FE	On-Demand	Anodyne	ABCB1	23	42
COc1ccc(-c2noc(CN3CCc4cc(OC)c(F)cc4C3)n2)nn1	ZINC000450700826	FE	On-Demand	Anodyne	ABCG2	26	41
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700856	GH	On-Demand	Anodyne	OPRD1	18	46
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700856	GH	On-Demand	Anodyne	SLC6A3	15	43
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700856	GH	On-Demand	Anodyne	SLC18A3	15	43
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700856	GH	On-Demand	Anodyne	ACHP_LYMST	20	48
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700856	GH	On-Demand	Anodyne	Q8WSF8_APLCA	51	48
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700858	GH	On-Demand	Anodyne	OPRD1	18	46
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700858	GH	On-Demand	Anodyne	SLC6A3	15	43
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700858	GH	On-Demand	Anodyne	SLC18A3	15	43
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700858	GH	On-Demand	Anodyne	ACHP_LYMST	20	48
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700858	GH	On-Demand	Anodyne	Q8WSF8_APLCA	51	48
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700860	GH	On-Demand	Anodyne	OPRD1	18	46
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700860	GH	On-Demand	Anodyne	SLC6A3	15	43
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700860	GH	On-Demand	Anodyne	SLC18A3	15	43
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700860	GH	On-Demand	Anodyne	ACHP_LYMST	20	48
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700860	GH	On-Demand	Anodyne	Q8WSF8_APLCA	51	48
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700863	GH	On-Demand	Anodyne	OPRD1	18	46
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700863	GH	On-Demand	Anodyne	SLC6A3	15	43
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700863	GH	On-Demand	Anodyne	SLC18A3	15	43
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700863	GH	On-Demand	Anodyne	ACHP_LYMST	20	48
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450700863	GH	On-Demand	Anodyne	Q8WSF8_APLCA	51	48
COc1ncc(CNc2ccnc(N3CCOCC3)n2)cc1Cl	ZINC000450700878	ED	On-Demand	Anodyne	PIK3CA	17	44
COc1ncc(CNc2ccnc(N3CCOCC3)n2)cc1Cl	ZINC000450700878	ED	On-Demand	Anodyne	EPHB4	86	37
COc1ncc(CNc2ccnc(N3CCOCC3)n2)cc1Cl	ZINC000450700878	ED	On-Demand	Anodyne	SMG1	40	35
COc1cc2c(N3CC[C@@](O)(C(F)F)C3)ncnc2cc1F	ZINC000450700879	DD	On-Demand	Anodyne	PDE3A	53	41
COc1cc2c(N3CC[C@@](O)(C(F)F)C3)ncnc2cc1F	ZINC000450700879	DD	On-Demand	Anodyne	PDGFRB	69	43
COc1cc2c(N3CC[C@@](O)(C(F)F)C3)ncnc2cc1F	ZINC000450700879	DD	On-Demand	Anodyne	PDE3B	78	41
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	DRD2	26	44
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	OPRM1	21	48
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	DRD3	15	40
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	OPRD1	18	48
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	KCNH2	37	42
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	CCR3	24	41
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	MCHR1	19	44
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	MBTPS1	67	38
COc1cc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)ccc1Cl	ZINC000450700880	GJ	On-Demand	Anodyne	ACKR3	56	32
COc1cc2c(N3CC[C@](O)(C(F)F)C3)ncnc2cc1F	ZINC000450700881	DD	On-Demand	Anodyne	PDE3A	53	41
COc1cc2c(N3CC[C@](O)(C(F)F)C3)ncnc2cc1F	ZINC000450700881	DD	On-Demand	Anodyne	PDGFRB	69	43
COc1cc2c(N3CC[C@](O)(C(F)F)C3)ncnc2cc1F	ZINC000450700881	DD	On-Demand	Anodyne	PDE3B	78	41
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC/C=C/c1ccccc1	ZINC000450700895	FJ	On-Demand	Anodyne	OPRM1	15	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC/C=C/c1ccccc1	ZINC000450700895	FJ	On-Demand	Anodyne	OPRD1	16	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC/C=C/c1ccccc1	ZINC000450700895	FJ	On-Demand	Anodyne	ACHP_LYMST	20	41
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC/C=C/c1ccccc1	ZINC000450700895	FJ	On-Demand	Anodyne	Q8WSF8_APLCA	33	41
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC/C=C\c1ccccc1	ZINC000450700897	FJ	On-Demand	Anodyne	OPRM1	15	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC/C=C\c1ccccc1	ZINC000450700897	FJ	On-Demand	Anodyne	OPRD1	16	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC/C=C\c1ccccc1	ZINC000450700897	FJ	On-Demand	Anodyne	ACHP_LYMST	20	41
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC/C=C\c1ccccc1	ZINC000450700897	FJ	On-Demand	Anodyne	Q8WSF8_APLCA	33	41
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)c1	ZINC000450700901	GI	On-Demand	Anodyne	OPRM1	17	48
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)c1	ZINC000450700901	GI	On-Demand	Anodyne	OPRD1	22	48
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)c1	ZINC000450700901	GI	On-Demand	Anodyne	KCNH2	40	46
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)c1	ZINC000450700901	GI	On-Demand	Anodyne	CCR3	30	48
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)c1	ZINC000450700901	GI	On-Demand	Anodyne	ACHP_LYMST	22	41
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)c1	ZINC000450700901	GI	On-Demand	Anodyne	Q8WSF8_APLCA	41	41
CSc1ccc2ncnc(N3CC[C@@](O)(C(F)F)C3)c2c1	ZINC000450700910	DF	On-Demand	Anodyne	HTT	0	42
CSc1ccc2ncnc(N3CC[C@](O)(C(F)F)C3)c2c1	ZINC000450700911	DF	On-Demand	Anodyne	HTT	0	42
N#Cc1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1Cl	ZINC000450700912	CG	On-Demand	Mild	NR3C2	25	43
N#Cc1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1Cl	ZINC000450700912	CG	On-Demand	Mild	AR	22	48
N#Cc1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)cc1Cl	ZINC000450700916	CG	On-Demand	Mild	NR3C2	25	43
N#Cc1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)cc1Cl	ZINC000450700916	CG	On-Demand	Mild	AR	22	48
N#Cc1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1Cl	ZINC000450700917	CG	On-Demand	Mild	NR3C2	25	43
N#Cc1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1Cl	ZINC000450700917	CG	On-Demand	Mild	AR	22	48
N#Cc1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1Cl	ZINC000450700918	CG	On-Demand	Mild	NR3C2	25	43
N#Cc1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1Cl	ZINC000450700918	CG	On-Demand	Mild	AR	22	48
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)CCN(C)C1CC1	ZINC000450700994	DG	On-Demand	Anodyne	LIPG	40	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC(=O)N(CCC(F)(F)F)C1	ZINC000450700996	GC	On-Demand	Anodyne	CA7	23	40
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701005	DE	On-Demand	Anodyne	DYRK1A	22	46
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701005	DE	On-Demand	Anodyne	CLK1	15	43
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701005	DE	On-Demand	Anodyne	CLK2	27	46
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701005	DE	On-Demand	Anodyne	CLK4	61	43
CO[C@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701005	DE	On-Demand	Anodyne	DYRK1B	29	46
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701006	DE	On-Demand	Anodyne	DYRK1A	22	46
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701006	DE	On-Demand	Anodyne	CLK1	15	43
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701006	DE	On-Demand	Anodyne	CLK2	27	46
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701006	DE	On-Demand	Anodyne	CLK4	61	43
CO[C@@H]1COCC[C@@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701006	DE	On-Demand	Anodyne	DYRK1B	29	46
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701007	DE	On-Demand	Anodyne	DYRK1A	22	46
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701007	DE	On-Demand	Anodyne	CLK1	15	43
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701007	DE	On-Demand	Anodyne	CLK2	27	46
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701007	DE	On-Demand	Anodyne	CLK4	61	43
CO[C@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701007	DE	On-Demand	Anodyne	DYRK1B	29	46
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701008	DE	On-Demand	Anodyne	DYRK1A	22	46
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701008	DE	On-Demand	Anodyne	CLK1	15	43
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701008	DE	On-Demand	Anodyne	CLK2	27	46
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701008	DE	On-Demand	Anodyne	CLK4	61	43
CO[C@@H]1COCC[C@H]1CNc1ncnc2ccc(SC)cc12	ZINC000450701008	DE	On-Demand	Anodyne	DYRK1B	29	46
C[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@H](c1ccccc1)N(C)C	ZINC000450701026	GF	On-Demand	Anodyne	DAGLA	32	40
C[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@H](c1ccccc1)N(C)C	ZINC000450701027	GF	On-Demand	Anodyne	DAGLA	32	40
C[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@@H](c1ccccc1)N(C)C	ZINC000450701028	GF	On-Demand	Anodyne	DAGLA	32	40
C[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@@H](c1ccccc1)N(C)C	ZINC000450701029	GF	On-Demand	Anodyne	DAGLA	32	40
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C(C1CC1)C1CC1	ZINC000450701034	EG	On-Demand	Anodyne	GSK3A	17	47
CCOC(=O)C1CCC(Sc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000450701035	FH	On-Demand	Bother	CACNA1C	46	35
CCOC(=O)C1CCC(Sc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000450701035	FH	On-Demand	Bother	CACNA1D	74	34
CN(CCCC(=O)c1ccc(F)cc1)C[C@H]1CCCC[C@H]1O	ZINC000450701036	DG	On-Demand	Anodyne	THRA	40	36
CN(CCCC(=O)c1ccc(F)cc1)C[C@@H]1CCCC[C@H]1O	ZINC000450701037	DG	On-Demand	Anodyne	THRA	40	36
CN(CCCC(=O)c1ccc(F)cc1)C[C@H]1CCCC[C@@H]1O	ZINC000450701038	DG	On-Demand	Anodyne	THRA	40	36
CN(CCCC(=O)c1ccc(F)cc1)C[C@@H]1CCCC[C@@H]1O	ZINC000450701039	DG	On-Demand	Anodyne	THRA	40	36
C(=C/c1ccccc1)\CCN1CCC2(CC1)OCCc1ccsc12	ZINC000450701045	EJ	On-Demand	Anodyne	OPRL1	47	37
C(=C/c1ccccc1)\CCN1CCC2(CC1)OCCc1ccsc12	ZINC000450701045	EJ	On-Demand	Anodyne	SIGMAR1	22	65
C(=C\c1ccccc1)\CCN1CCC2(CC1)OCCc1ccsc12	ZINC000450701046	EJ	On-Demand	Anodyne	OPRL1	47	37
C(=C\c1ccccc1)\CCN1CCC2(CC1)OCCc1ccsc12	ZINC000450701046	EJ	On-Demand	Anodyne	SIGMAR1	22	65
O=C1CCC(CN2CCC3(CC2)OCCc2ccsc23)CC1	ZINC000450701047	DG	On-Demand	Anodyne	OPRL1	46	35
O=C1CCC(CN2CCC3(CC2)OCCc2ccsc23)CC1	ZINC000450701047	DG	On-Demand	Anodyne	SIGMAR1	15	58
CO[C@@H](Cc1ccccc1)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450701077	FH	On-Demand	Anodyne	OPRL1	54	45
CO[C@@H](Cc1ccccc1)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450701077	FH	On-Demand	Anodyne	SIGMAR1	31	66
CO[C@H](Cc1ccccc1)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450701078	FH	On-Demand	Anodyne	OPRL1	54	45
CO[C@H](Cc1ccccc1)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450701078	FH	On-Demand	Anodyne	SIGMAR1	31	66
CC(C)(C)N1C[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1=O	ZINC000450701088	GE	On-Demand	Anodyne	GSK3A	19	43
CC(C)(C)N1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)CC1=O	ZINC000450701089	GE	On-Demand	Anodyne	GSK3A	19	43
COCCOC[C@H](O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450701090	EE	On-Demand	Anodyne	VACHT_TETCF	0	41
COCCOC[C@H](O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450701090	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	49
COCCOC[C@H](O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450701091	EE	On-Demand	Anodyne	VACHT_TETCF	0	41
COCCOC[C@H](O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450701091	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	49
COCCOC[C@@H](O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450701092	EE	On-Demand	Anodyne	VACHT_TETCF	0	41
COCCOC[C@@H](O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000450701092	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	49
COCCOC[C@@H](O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450701093	EE	On-Demand	Anodyne	VACHT_TETCF	0	41
COCCOC[C@@H](O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000450701093	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	49
C[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C	ZINC000450701102	GI	On-Demand	Bother	COLA	51	38
C[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C	ZINC000450701102	GI	On-Demand	Bother	MTTP	53	32
C[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C	ZINC000450701103	GI	On-Demand	Bother	COLA	51	38
C[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C	ZINC000450701103	GI	On-Demand	Bother	MTTP	53	32
C[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C	ZINC000450701104	GI	On-Demand	Bother	COLA	51	38
C[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C	ZINC000450701104	GI	On-Demand	Bother	MTTP	53	32
C[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C	ZINC000450701105	GI	On-Demand	Bother	COLA	51	38
C[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C	ZINC000450701105	GI	On-Demand	Bother	MTTP	53	32
COc1ccc(CN(C(=O)c2ocnc2-c2ccccc2)[C@H](CO)C(C)C)cc1	ZINC000450701108	GI	On-Demand	Anodyne	TSPO	15	43
C[C@H](O)CCCN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701138	FG	On-Demand	Anodyne	SLC6A1	84	36
C[C@H](O)CCCN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701138	FG	On-Demand	Anodyne	HTR1F	44	36
C[C@H](O)CCCN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701138	FG	On-Demand	Anodyne	BIRC2	46	34
C[C@@H](O)CCCN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701139	FG	On-Demand	Anodyne	SLC6A1	84	36
C[C@@H](O)CCCN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701139	FG	On-Demand	Anodyne	HTR1F	44	36
C[C@@H](O)CCCN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701139	FG	On-Demand	Anodyne	BIRC2	46	34
C[C@H](O)CCCN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701140	FG	On-Demand	Anodyne	SLC6A1	84	36
C[C@H](O)CCCN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701140	FG	On-Demand	Anodyne	HTR1F	44	36
C[C@H](O)CCCN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701140	FG	On-Demand	Anodyne	BIRC2	46	34
C[C@@H](O)CCCN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701141	FG	On-Demand	Anodyne	SLC6A1	84	36
C[C@@H](O)CCCN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701141	FG	On-Demand	Anodyne	HTR1F	44	36
C[C@@H](O)CCCN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450701141	FG	On-Demand	Anodyne	BIRC2	46	34
CCCCn1c(O)nnc1SCc1ccn(CCc2ccccc2)n1	ZINC000450701168	FH	On-Demand	Anodyne	AGTR1	18	40
COC(=O)CNC(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450701240	GD	On-Demand	Bother	TAAR1	19	41
COC(=O)CNC(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450701241	GD	On-Demand	Bother	TAAR1	19	41
COC(=O)CNC(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450701242	GD	On-Demand	Bother	TAAR1	19	41
CCC(=O)c1ccc(NCc2cnc(OC)c(Cl)c2)c([N+](=O)[O-])c1	ZINC000450701271	EH	On-Demand	Bother	TAAR1	21	49
C[C@@H]1COCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450701326	EE	On-Demand	Anodyne	GSK3A	15	41
C[C@@H]1COCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450701327	EE	On-Demand	Anodyne	GSK3A	15	41
C[C@H]1COCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450701328	EE	On-Demand	Anodyne	GSK3A	15	41
C[C@H]1COCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450701329	EE	On-Demand	Anodyne	GSK3A	15	41
c1cc2c(s1)C1(CCN(C[C@H]3COCCO3)CC1)OCC2	ZINC000450701341	DE	On-Demand	Anodyne	OPRL1	43	33
c1cc2c(s1)C1(CCN(C[C@@H]3COCCO3)CC1)OCC2	ZINC000450701342	DE	On-Demand	Anodyne	OPRL1	43	33
COc1ccc(CN(Cc2cccc(C(C)=O)c2)[C@H](CO)C(C)C)cc1	ZINC000450701343	FH	On-Demand	Anodyne	BMP1	44	39
COc1ccc(CN(C(=O)c2cc(C)cs2)[C@H](CO)C(C)C)cc1	ZINC000450701347	EH	On-Demand	Anodyne	BMP1	60	38
CCc1cc2c(N3CC(C(=O)OC(C)(C)C)C3)ncnc2s1	ZINC000450701360	DG	On-Demand	Anodyne	SIRT3	52	39
CCc1cc2c(N3CC(C(=O)OC(C)(C)C)C3)ncnc2s1	ZINC000450701360	DG	On-Demand	Anodyne	SIRT2	42	39
CCc1cc2c(N3CC(C(=O)OC(C)(C)C)C3)ncnc2s1	ZINC000450701360	DG	On-Demand	Anodyne	SIRT1	42	35
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CCC(C(F)(F)F)CC1	ZINC000450701377	GI	On-Demand	Anodyne	GSK3A	37	52
CC(C)Oc1cc(F)ccc1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450701378	FH	On-Demand	Anodyne	PDE4D	15	42
CC(C)Oc1cc(F)ccc1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450701379	FH	On-Demand	Anodyne	PDE4D	15	42
CCOC(=O)C1CCC(Sc2nc3ccccc3o2)CC1	ZINC000450701380	DI	On-Demand	Anodyne	SSTR5	29	41
COC(=O)c1csc(CN2CCC3(CC2)OCCc2ccsc23)n1	ZINC000450701381	FG	On-Demand	Anodyne	OPRL1	54	40
COC(=O)c1csc(CN2CCC3(CC2)OCCc2ccsc23)n1	ZINC000450701381	FG	On-Demand	Anodyne	SIGMAR1	15	43
FC1(F)CCCC[C@H]1CN1CCC2(CC1)OCCc1ccsc12	ZINC000450701382	EI	On-Demand	Anodyne	OPRL1	46	38
FC1(F)CCCC[C@H]1CN1CCC2(CC1)OCCc1ccsc12	ZINC000450701382	EI	On-Demand	Anodyne	SIGMAR1	17	55
FC1(F)CCCC[C@@H]1CN1CCC2(CC1)OCCc1ccsc12	ZINC000450701383	EI	On-Demand	Anodyne	OPRL1	46	38
FC1(F)CCCC[C@@H]1CN1CCC2(CC1)OCCc1ccsc12	ZINC000450701383	EI	On-Demand	Anodyne	SIGMAR1	17	55
CC(C)(C)OC(=O)C1CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701404	DG	On-Demand	Anodyne	PDE3A	44	36
CC(C)(C)OC(=O)C1CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701404	DG	On-Demand	Anodyne	HRP1_PLAFA	69	32
CC(C)(C)OC(=O)C1CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701404	DG	On-Demand	Anodyne	PDE3B	65	36
CC(C)(C)OC(=O)C1CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701404	DG	On-Demand	Anodyne	HTT	0	40
COc1cc(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)ccc1Cl	ZINC000450701407	FI	On-Demand	Anodyne	DRD4	24	40
COc1cc(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)ccc1Cl	ZINC000450701407	FI	On-Demand	Anodyne	DRD3	0	40
COc1cc(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)ccc1Cl	ZINC000450701407	FI	On-Demand	Anodyne	SSTR5	62	39
COc1cc(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)ccc1Cl	ZINC000450701407	FI	On-Demand	Anodyne	CCR1	28	40
CCOC(=O)C1CCC(Sc2ccc([N+](=O)[O-])cc2)CC1	ZINC000450701410	DH	On-Demand	Bother	NR3C1	0	40
CCOC(=O)C1CCC(Sc2ccc([N+](=O)[O-])cc2)CC1	ZINC000450701410	DH	On-Demand	Bother	CACNA1D	51	38
CCOC(=O)C1CCC(Sc2ccc([N+](=O)[O-])cc2)CC1	ZINC000450701410	DH	On-Demand	Bother	SLC27A4	56	37
COC(=O)CNC(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450701418	GD	On-Demand	Bother	TAAR1	19	41
CCOC(=O)C1(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450701431	GD	On-Demand	Anodyne	CA2	17	41
CCOC(=O)C1(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450701431	GD	On-Demand	Anodyne	CA1	15	41
CCOC(=O)C1(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450701431	GD	On-Demand	Anodyne	CA12	15	41
CCOC(=O)C1(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450701431	GD	On-Demand	Anodyne	CA9	30	41
COC(=O)c1cn(C2CN(C(=O)CCOc3cccc(OC)c3)C2)nn1	ZINC000450701468	FC	On-Demand	Anodyne	DRD4	40	31
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CC[C@H](C(F)(F)F)C1	ZINC000450701479	FH	On-Demand	Anodyne	GSK3A	23	48
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CC[C@@H](C(F)(F)F)C1	ZINC000450701480	FH	On-Demand	Anodyne	GSK3A	23	48
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CC[C@H](C(F)(F)F)C1	ZINC000450701481	FH	On-Demand	Anodyne	GSK3A	23	48
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CC[C@@H](C(F)(F)F)C1	ZINC000450701482	FH	On-Demand	Anodyne	GSK3A	23	48
O[C@]1(C(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701505	CE	On-Demand	Anodyne	AKT2	42	40
O[C@]1(C(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701505	CE	On-Demand	Anodyne	AKT3	39	40
O[C@]1(C(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701505	CE	On-Demand	Anodyne	ROCK2	38	40
O[C@]1(C(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701505	CE	On-Demand	Anodyne	AKT1	28	40
O[C@@]1(C(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701506	CE	On-Demand	Anodyne	AKT2	42	40
O[C@@]1(C(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701506	CE	On-Demand	Anodyne	AKT3	39	40
O[C@@]1(C(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701506	CE	On-Demand	Anodyne	ROCK2	38	40
O[C@@]1(C(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450701506	CE	On-Demand	Anodyne	AKT1	28	40
COc1cc2c(cc1F)CN(C[C@@H]1COCCO1)CC2	ZINC000450701539	CD	On-Demand	Anodyne	ABCB1B	46	33
COc1cc2c(cc1F)CN(C[C@H]1COCCO1)CC2	ZINC000450701540	CD	On-Demand	Anodyne	ABCB1B	46	33
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450701553	FG	On-Demand	Anodyne	PAPA1_CARPA	41	32
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450701554	FG	On-Demand	Anodyne	PAPA1_CARPA	41	32
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450701555	FG	On-Demand	Anodyne	PAPA1_CARPA	41	32
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450701556	FG	On-Demand	Anodyne	PAPA1_CARPA	41	32
CCC[C@@H](OC)C(=O)N[C@H](CO)c1ccsc1	ZINC000450701560	CD	On-Demand	Anodyne	GPR88	0	42
CCC[C@H](OC)C(=O)N[C@H](CO)c1ccsc1	ZINC000450701561	CD	On-Demand	Anodyne	GPR88	0	42
CCC[C@H](OC)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450701562	CD	On-Demand	Anodyne	GPR88	0	42
CCC[C@@H](OC)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450701563	CD	On-Demand	Anodyne	GPR88	0	42
CC(C)c1nnc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)s1	ZINC000450701568	FH	On-Demand	Anodyne	AKT2	51	33
CC(C)c1nnc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)s1	ZINC000450701569	FH	On-Demand	Anodyne	AKT2	51	33
COc1cccc(NC(=O)C2(C)CCC(=O)CC2)c1O	ZINC000450701572	CE	On-Demand	Anodyne	CETP	19	41
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	DRD2	16	41
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	DRD4	34	42
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	DRD3	0	43
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	SIGMAR1	16	54
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	ABCB1B	65	42
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	ABCB1	29	58
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	ABCG2	41	44
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	NOD1	34	47
COc1cc2c(cc1F)CN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450701573	DH	On-Demand	Anodyne	NOD2	52	47
COc1ccc(-c2ccnc(NC[C@H]3CCOC[C@@H]3OC)n2)cc1	ZINC000450701599	EF	On-Demand	Anodyne	VCP	28	43
COc1ccc(-c2ccnc(NC[C@H]3CCOC[C@H]3OC)n2)cc1	ZINC000450701600	EF	On-Demand	Anodyne	VCP	28	43
COc1ccc(-c2ccnc(NC[C@@H]3CCOC[C@H]3OC)n2)cc1	ZINC000450701601	EF	On-Demand	Anodyne	VCP	28	43
COc1ccc(-c2ccnc(NC[C@@H]3CCOC[C@@H]3OC)n2)cc1	ZINC000450701602	EF	On-Demand	Anodyne	VCP	28	43
C[C@H]1C[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C[C@@H](C)O1	ZINC000450701639	FF	On-Demand	Anodyne	GSK3A	20	46
C[C@H]1CC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C[C@H](C)O1	ZINC000450701640	FF	On-Demand	Anodyne	GSK3A	20	46
C[C@@H]1CC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C[C@@H](C)O1	ZINC000450701641	FF	On-Demand	Anodyne	GSK3A	20	46
CSc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450701651	EG	On-Demand	Anodyne	PDE3A	44	35
CSc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450701651	EG	On-Demand	Anodyne	PDGFRB	29	42
CSc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450701651	EG	On-Demand	Anodyne	PDE3B	65	35
CSc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450701651	EG	On-Demand	Anodyne	SIRT3	55	38
CSc1ccc2ncnc(N3CC(C(=O)OC(C)(C)C)C3)c2c1	ZINC000450701651	EG	On-Demand	Anodyne	SIRT1	42	36
CCC(=O)N1CC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450701657	FE	On-Demand	Anodyne	GSK3A	29	46
CCC(=O)N1CC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450701657	FE	On-Demand	Anodyne	MAPK1	34	44
CCC(=O)N1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450701658	FE	On-Demand	Anodyne	GSK3A	29	46
CCC(=O)N1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450701658	FE	On-Demand	Anodyne	MAPK1	34	44
O[C@]1(C(F)F)CCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450701670	CE	On-Demand	Anodyne	FAAH	0	46
O[C@@]1(C(F)F)CCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450701671	CE	On-Demand	Anodyne	FAAH	0	46
CCOC(=O)C1CCC(Sc2cc(C)nc(-c3cccnc3)n2)CC1	ZINC000450701679	FI	On-Demand	Anodyne	VCP	43	36
Cc1csc2c(N3CC(C(=O)OC(C)(C)C)C3)ncnc12	ZINC000450701685	DF	On-Demand	Anodyne	SIRT3	43	36
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H](C1CC1)N1CCCC1	ZINC000450701750	FF	On-Demand	Anodyne	GSK3A	16	44
COc1ccc(-c2csc3ncnc(N4CC[C@](O)(C(F)F)C4)c23)cc1	ZINC000450701751	GH	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CC[C@](O)(C(F)F)C4)c23)cc1	ZINC000450701751	GH	On-Demand	Anodyne	ADRB3	30	45
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H](C1CC1)N1CCCC1	ZINC000450701752	FF	On-Demand	Anodyne	GSK3A	16	44
COc1ccc(-c2csc3ncnc(N4CC[C@@](O)(C(F)F)C4)c23)cc1	ZINC000450701753	GH	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CC[C@@](O)(C(F)F)C4)c23)cc1	ZINC000450701753	GH	On-Demand	Anodyne	ADRB3	30	45
CCC[C@H](O)CN1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450701756	FD	On-Demand	Anodyne	ABCB1	51	39
CCC[C@@H](O)CN1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450701757	FD	On-Demand	Anodyne	ABCB1	51	39
CCC[C@H](O)CN1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450701758	FD	On-Demand	Anodyne	ABCB1	51	39
CCC[C@@H](O)CN1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450701759	FD	On-Demand	Anodyne	ABCB1	51	39
c1ccc(OC2CC2)c(CN2CCC3(CC2)OCCc2ccsc23)c1	ZINC000450701772	FI	On-Demand	Anodyne	OPRL1	51	41
c1ccc(OC2CC2)c(CN2CCC3(CC2)OCCc2ccsc23)c1	ZINC000450701772	FI	On-Demand	Anodyne	SIGMAR1	23	63
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@](O)(C(F)F)C1	ZINC000450701809	DE	On-Demand	Bother	WDR5	32	40
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@@](O)(C(F)F)C1	ZINC000450701810	DE	On-Demand	Bother	WDR5	32	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450701842	DF	On-Demand	Anodyne	KLK3	45	30
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450701842	DF	On-Demand	Anodyne	GPR88	0	41
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450701843	DF	On-Demand	Anodyne	KLK3	45	30
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450701843	DF	On-Demand	Anodyne	GPR88	0	41
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450701844	DF	On-Demand	Anodyne	KLK3	45	30
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450701844	DF	On-Demand	Anodyne	GPR88	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450701845	DF	On-Demand	Anodyne	KLK3	45	30
C[C@H](OCCc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450701845	DF	On-Demand	Anodyne	GPR88	0	41
COc1ccc(-c2n[nH]c(SCc3cn(CC4CC4)nn3)n2)cc1	ZINC000450701846	EF	On-Demand	Anodyne	GCN5	0	43
CCOC(=O)c1cccnc1NCc1cnc(OC)c(Cl)c1	ZINC000450701855	DF	On-Demand	Anodyne	PDE5A	27	53
CCOC(=O)c1cccnc1NCc1cnc(OC)c(Cl)c1	ZINC000450701855	DF	On-Demand	Anodyne	PDE6A	45	37
CCOC(=O)c1cccnc1NCc1cnc(OC)c(Cl)c1	ZINC000450701855	DF	On-Demand	Anodyne	STAT6	45	37
CCOC(=O)c1cccnc1NCc1cnc(OC)c(Cl)c1	ZINC000450701855	DF	On-Demand	Anodyne	ILV2	0	41
CCC[C@@H](O)CN1CCc2cc(OC)c(F)cc2C1	ZINC000450701864	CE	On-Demand	Anodyne	ABCB1B	51	32
CCC[C@@H](O)CN1CCc2cc(OC)c(F)cc2C1	ZINC000450701864	CE	On-Demand	Anodyne	ABCB1	0	45
CCC[C@H](O)CN1CCc2cc(OC)c(F)cc2C1	ZINC000450701865	CE	On-Demand	Anodyne	ABCB1B	51	32
CCC[C@H](O)CN1CCc2cc(OC)c(F)cc2C1	ZINC000450701865	CE	On-Demand	Anodyne	ABCB1	0	45
COc1cc2c(cc1F)CN(C[C@H](C)S(C)(=O)=O)CC2	ZINC000450701906	DD	On-Demand	Anodyne	ABCB1B	59	36
COc1cc2c(cc1F)CN(C[C@H](C)S(C)(=O)=O)CC2	ZINC000450701906	DD	On-Demand	Anodyne	ABCB1	24	45
COc1cc2c(cc1F)CN(C[C@@H](C)S(C)(=O)=O)CC2	ZINC000450701907	DD	On-Demand	Anodyne	ABCB1B	59	36
COc1cc2c(cc1F)CN(C[C@@H](C)S(C)(=O)=O)CC2	ZINC000450701907	DD	On-Demand	Anodyne	ABCB1	24	45
COc1cc2c(cc1F)CN(Cc1nc(-c3cc(C)ccn3)no1)CC2	ZINC000450701909	FG	On-Demand	Anodyne	ABCB1B	58	33
COc1cc2c(cc1F)CN(Cc1nc(-c3cc(C)ccn3)no1)CC2	ZINC000450701909	FG	On-Demand	Anodyne	ABCB1	25	44
CN(CCN(C)C1CC1)C(=O)c1cc(Cl)c(Br)cc1F	ZINC000450701915	FG	On-Demand	Anodyne	SHC	17	41
CCOC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450701925	EE	On-Demand	Anodyne	CAN2	0	43
O[C@@]1(C(F)F)CCN(c2ncccc2C(F)(F)F)C1	ZINC000450701942	CE	On-Demand	Anodyne	TRPV1	34	47
O[C@]1(C(F)F)CCN(c2ncccc2C(F)(F)F)C1	ZINC000450701943	CE	On-Demand	Anodyne	TRPV1	34	47
CNC(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450701951	DD	On-Demand	Bother	TAAR1	19	43
CNC(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450701952	DD	On-Demand	Bother	TAAR1	19	43
CCOC(=O)C1(CNC(=O)CCCC(C)C)CC1	ZINC000450701984	CE	On-Demand	Anodyne	NOD1	45	33
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCCCC1(F)F	ZINC000450701998	FH	On-Demand	Anodyne	GSK3A	24	45
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCCCC1(F)F	ZINC000450701999	FH	On-Demand	Anodyne	GSK3A	24	45
C[C@@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)[C@@H](c1ccccc1)N(C)C	ZINC000450702007	GG	On-Demand	Anodyne	MTTP	49	33
C[C@@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)[C@@H](c1ccccc1)N(C)C	ZINC000450702007	GG	On-Demand	Anodyne	GCK	24	43
O[C@@]1(C(F)F)CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450702008	ED	On-Demand	Anodyne	LRRK2	0	40
C[C@@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)[C@H](c1ccccc1)N(C)C	ZINC000450702009	GG	On-Demand	Anodyne	MTTP	49	33
C[C@@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)[C@H](c1ccccc1)N(C)C	ZINC000450702009	GG	On-Demand	Anodyne	GCK	24	43
C[C@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)[C@H](c1ccccc1)N(C)C	ZINC000450702010	GG	On-Demand	Anodyne	MTTP	49	33
C[C@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)[C@H](c1ccccc1)N(C)C	ZINC000450702010	GG	On-Demand	Anodyne	GCK	24	43
O[C@]1(C(F)F)CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450702011	ED	On-Demand	Anodyne	LRRK2	0	40
C[C@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)[C@@H](c1ccccc1)N(C)C	ZINC000450702012	GG	On-Demand	Anodyne	MTTP	49	33
C[C@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)[C@@H](c1ccccc1)N(C)C	ZINC000450702012	GG	On-Demand	Anodyne	GCK	24	43
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CCC(OC(F)F)CC1	ZINC000450702035	GH	On-Demand	Anodyne	GSK3A	35	52
COc1cc(NC(=O)c2c(C)cccc2Cl)cc(OC)c1C(C)C	ZINC000450702038	EK	On-Demand	Anodyne	JAK1	0	41
COc1cc(NC(=O)c2c(C)cccc2Cl)cc(OC)c1C(C)C	ZINC000450702038	EK	On-Demand	Anodyne	GRM4	22	42
COc1cc(NC(=O)c2c(C)cccc2Cl)cc(OC)c1C(C)C	ZINC000450702038	EK	On-Demand	Anodyne	TYK2	46	36
COc1cc(NC(=O)c2c(C)cccc2Cl)cc(OC)c1C(C)C	ZINC000450702038	EK	On-Demand	Anodyne	KCNK3	60	43
COc1cc(NC(=O)c2c(C)cccc2Cl)cc(OC)c1C(C)C	ZINC000450702038	EK	On-Demand	Anodyne	KCNK9	53	43
CC(C)(C)OC(=O)C1CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450702070	DD	On-Demand	Anodyne	P2RY12	27	42
CC(C)(C)OC(=O)C1CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450702070	DD	On-Demand	Anodyne	CXCR3	29	43
CC(=O)[C@@](C)(O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450702075	DD	On-Demand	Anodyne	OPRL1	23	51
CC(=O)[C@](C)(O)CN1CCC2(CC1)OCCc1ccsc12	ZINC000450702077	DD	On-Demand	Anodyne	OPRL1	23	51
CC(C)Oc1cc(F)ccc1NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450702082	GI	On-Demand	Anodyne	ADRA1D	20	41
CC(C)Oc1cc(F)ccc1NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450702082	GI	On-Demand	Anodyne	ADRA1A	19	41
CC(C)Oc1cc(F)ccc1NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450702082	GI	On-Demand	Anodyne	ADRA1B	15	41
CC(C)Oc1cc(F)ccc1NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450702083	GI	On-Demand	Anodyne	ADRA1D	20	41
CC(C)Oc1cc(F)ccc1NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450702083	GI	On-Demand	Anodyne	ADRA1A	19	41
CC(C)Oc1cc(F)ccc1NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450702083	GI	On-Demand	Anodyne	ADRA1B	15	41
Fc1ccc([C@H]2CCCN(CCc3cscn3)CC2)cc1	ZINC000450702084	DI	On-Demand	Anodyne	SCN5A	40	34
Fc1ccc([C@H]2CCCN(CCc3cscn3)CC2)cc1	ZINC000450702084	DI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Fc1ccc([C@@H]2CCCN(CCc3cscn3)CC2)cc1	ZINC000450702085	DI	On-Demand	Anodyne	SCN5A	40	34
Fc1ccc([C@@H]2CCCN(CCc3cscn3)CC2)cc1	ZINC000450702085	DI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
CC(C)Oc1cc(F)ccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450702086	EG	On-Demand	Anodyne	PRNP	32	43
CC(C)Oc1cc(F)ccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450702086	EG	On-Demand	Anodyne	HDAC1	23	42
CCOC(=O)C1CCC(Sc2ccc3nnc(-c4ccsc4)n3n2)CC1	ZINC000450702092	GI	On-Demand	Anodyne	LRRK2	29	41
C1=C(CN2CCC3(CC2)OCCc2ccsc23)CCCC1	ZINC000450702100	DI	On-Demand	Anodyne	OPRL1	45	37
CCOC(=O)C1CCC(Sc2ccc3nnc(-c4ccccc4)n3n2)CC1	ZINC000450702107	GI	On-Demand	Anodyne	LRRK2	32	41
COC(=O)c1ccc(OCCCCCC(C)=O)c(Cl)c1	ZINC000450702114	CH	On-Demand	Anodyne	S1PR4	22	44
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCSC2(CCOCC2)C1	ZINC000450702171	GI	On-Demand	Anodyne	PRCP	51	36
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCSC2(CCOCC2)C1	ZINC000450702172	GI	On-Demand	Anodyne	PRCP	51	36
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCSC2(CCOCC2)C1	ZINC000450702173	GI	On-Demand	Anodyne	PRCP	51	36
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCSC2(CCOCC2)C1	ZINC000450702174	GI	On-Demand	Anodyne	PRCP	51	36
Cc1cccc(CNC(=O)c2ccc(C(=O)N(C)CCN(C)C3CC3)cc2)c1	ZINC000450702179	GG	On-Demand	Anodyne	CHRM3	15	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N(C)CCN(C)C3CC3)cc2)c1	ZINC000450702179	GG	On-Demand	Anodyne	LIMK2	24	41
CN(CCN(C)C1CC1)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450702191	EF	On-Demand	Bother	PPXII	0	40
COC(=O)C1(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)CC1	ZINC000450702207	EF	On-Demand	Anodyne	AKT2	46	34
COC(=O)C1(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)CC1	ZINC000450702208	EF	On-Demand	Anodyne	AKT2	46	34
COC(=O)CN(CCc1ccccc1)Cc1ccc(C(C)=O)cc1	ZINC000450702217	EG	On-Demand	Anodyne	PLM2_PLAFA	37	41
COC(=O)CN(CCc1ccccc1)Cc1ccc(C(C)=O)cc1	ZINC000450702217	EG	On-Demand	Anodyne	LIMK2	42	38
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	ADORA1	177	79
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	SLC29A1	138	59
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	P2RY12	53	43
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	ADORA2A	70	62
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	ADORA2B	32	55
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	DNMT1	22	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	GAPC	0	43
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	ADK	70	55
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	LOC100912604	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	AK3	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	AHCY	54	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	P2RX4	35	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	P2RX1	45	39
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	P2RY1	35	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	P2RY11	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	SMS	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	AMD1	28	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	SRM	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	ITPR1	50	36
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	AK2	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	NS5B	0	45
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	ADORA3	146	62
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	OXGR1	125	42
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	MTAP	0	46
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	QARS	0	42
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	IMPDH2	45	35
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	AT1	0	40
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	AK	0	49
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	SETD7	0	45
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	PRMT1	0	45
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	MBTA	0	44
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	DNMT3B	81	45
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	PANC	39	43
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	Q4VQ11_PIG	83	60
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	GPR17	58	42
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	KMT2A	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	DOT1L	103	49
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	SUV39H1	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	METJ	0	43
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	SMYD2	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	EZH1	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	KMT5C	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	SETDB1	0	41
CCC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702239	GD	On-Demand	Anodyne	SETD2	0	45
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	ADORA1	177	79
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	SLC29A1	138	59
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	P2RY12	53	43
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	ADORA2A	70	62
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	ADORA2B	32	55
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	DNMT1	22	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	GAPC	0	43
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	ADK	70	55
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	LOC100912604	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	AK3	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	AHCY	54	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	P2RX4	35	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	P2RX1	45	39
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	P2RY1	35	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	P2RY11	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	SMS	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	AMD1	28	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	SRM	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	ITPR1	50	36
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	AK2	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	NS5B	0	45
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	ADORA3	146	62
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	OXGR1	125	42
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	MTAP	0	46
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	QARS	0	42
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	IMPDH2	45	35
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	AT1	0	40
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	AK	0	49
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	SETD7	0	45
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	PRMT1	0	45
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	MBTA	0	44
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	DNMT3B	81	45
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	PANC	39	43
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	Q4VQ11_PIG	83	60
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	GPR17	58	42
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	KMT2A	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	DOT1L	103	49
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	SUV39H1	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	METJ	0	43
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	SMYD2	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	EZH1	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	KMT5C	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	SETDB1	0	41
CCC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)(C)C	ZINC000450702240	GD	On-Demand	Anodyne	SETD2	0	45
O=C(c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450702241	FE	On-Demand	Anodyne	AVPR2	47	40
O=C(c1ccc(N2CC[C@](O)(C(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450702242	FE	On-Demand	Anodyne	AVPR2	47	40
CCCc1cc(N2CC[C@@](O)(C(F)F)C2)c2ccccc2n1	ZINC000450702243	DG	On-Demand	Anodyne	METAP1	41	36
CCCc1cc(N2CC[C@](O)(C(F)F)C2)c2ccccc2n1	ZINC000450702244	DG	On-Demand	Anodyne	METAP1	41	36
C[C@H](Sc1nnc(O)n1C[C@@H]1CCCO1)C(=O)C1CCCCC1	ZINC000450702280	EF	On-Demand	Anodyne	PDE8B	41	34
C[C@@H](Sc1nnc(O)n1C[C@H]1CCCO1)C(=O)C1CCCCC1	ZINC000450702281	EF	On-Demand	Anodyne	PDE8B	41	34
C[C@H](Sc1nnc(O)n1C[C@H]1CCCO1)C(=O)C1CCCCC1	ZINC000450702282	EF	On-Demand	Anodyne	PDE8B	41	34
C[C@@H](Sc1nnc(O)n1C[C@@H]1CCCO1)C(=O)C1CCCCC1	ZINC000450702283	EF	On-Demand	Anodyne	PDE8B	41	34
O[C@@]1(C(F)F)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450702284	FD	On-Demand	Anodyne	PIK3CA	19	45
O[C@@]1(C(F)F)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450702284	FD	On-Demand	Anodyne	PIK3CD	21	42
O[C@@]1(C(F)F)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450702284	FD	On-Demand	Anodyne	PIK3CB	23	40
O[C@@]1(C(F)F)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450702284	FD	On-Demand	Anodyne	PIK3C2B	15	42
O[C@]1(C(F)F)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450702285	FD	On-Demand	Anodyne	PIK3CA	19	45
O[C@]1(C(F)F)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450702285	FD	On-Demand	Anodyne	PIK3CD	21	42
O[C@]1(C(F)F)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450702285	FD	On-Demand	Anodyne	PIK3CB	23	40
O[C@]1(C(F)F)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450702285	FD	On-Demand	Anodyne	PIK3C2B	15	42
C[C@@H](NC(=O)c1cc2ccncc2s1)[C@@H](c1ccccc1)N(C)C	ZINC000450702324	EH	On-Demand	Anodyne	SELE	41	35
C[C@@H](NC(=O)c1cc2ccncc2s1)[C@H](c1ccccc1)N(C)C	ZINC000450702325	EH	On-Demand	Anodyne	SELE	41	35
C[C@H](NC(=O)c1cc2ccncc2s1)[C@H](c1ccccc1)N(C)C	ZINC000450702326	EH	On-Demand	Anodyne	SELE	41	35
C[C@H](NC(=O)c1cc2ccncc2s1)[C@@H](c1ccccc1)N(C)C	ZINC000450702327	EH	On-Demand	Anodyne	SELE	41	35
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CN(CC(F)(F)F)C1	ZINC000450702337	GE	On-Demand	Anodyne	GSK3A	19	43
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(F)cc2OC(C)C)c1	ZINC000450702346	EI	On-Demand	Anodyne	ROCK2	21	42
CCOC(=O)C1CCC(Sc2ccc(C(C)=O)cc2[N+](=O)[O-])CC1	ZINC000450702366	FI	On-Demand	Bother	GSTM2	46	38
COc1cc2c(cc1F)CN(Cc1cccnc1N)CC2	ZINC000450702372	CE	On-Demand	Anodyne	ABCB1B	61	36
COc1cc2c(cc1F)CN(Cc1cccnc1N)CC2	ZINC000450702372	CE	On-Demand	Anodyne	ABCB1	25	44
CO[C@H]1COCC[C@@H]1CNc1ncccc1OCc1ccccc1	ZINC000450702375	EG	On-Demand	Anodyne	PPIA	35	41
CO[C@@H]1COCC[C@H]1CNc1ncccc1OCc1ccccc1	ZINC000450702376	EG	On-Demand	Anodyne	PPIA	35	41
CO[C@@H]1COCC[C@@H]1CNc1ncccc1OCc1ccccc1	ZINC000450702377	EG	On-Demand	Anodyne	PPIA	35	41
CO[C@H]1COCC[C@H]1CNc1ncccc1OCc1ccccc1	ZINC000450702378	EG	On-Demand	Anodyne	PPIA	35	41
FC1(F)CC(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)C1	ZINC000450702398	EH	On-Demand	Anodyne	AKT2	50	34
FC1(F)CC(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)C1	ZINC000450702400	EH	On-Demand	Anodyne	AKT2	50	34
COc1ccc(-c2n[nH]c(SCC(=O)CC[C@@H]3CCCCO3)n2)cc1	ZINC000450702403	FG	On-Demand	Anodyne	COLA	48	41
COc1ccc(-c2n[nH]c(SCC(=O)CC[C@H]3CCCCO3)n2)cc1	ZINC000450702404	FG	On-Demand	Anodyne	COLA	48	41
Cc1cccc(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)n1	ZINC000450702413	GH	On-Demand	Anodyne	PRCP	0	40
Cc1cccc(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)n1	ZINC000450702413	GH	On-Demand	Anodyne	MMP14	17	41
COC[C@]1(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)CCOC1	ZINC000450702421	DD	On-Demand	Anodyne	PSMB8	45	34
COC[C@]1(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)CCOC1	ZINC000450702423	DD	On-Demand	Anodyne	PSMB8	45	34
COC[C@]1(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)CCOC1	ZINC000450702425	DD	On-Demand	Anodyne	PSMB8	45	34
COC[C@]1(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)CCOC1	ZINC000450702426	DD	On-Demand	Anodyne	PSMB8	45	34
C[C@H](O)CCCN1CCN([C@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000450702432	ED	On-Demand	Anodyne	MC4R	27	40
C[C@@H](O)CCCN1CCN([C@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000450702434	ED	On-Demand	Anodyne	MC4R	27	40
C[C@@H](O)CCCN1CCN([C@@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000450702436	ED	On-Demand	Anodyne	MC4R	27	40
C[C@H](O)CCCN1CCN([C@@H](C(N)=O)c2ccc(Cl)cc2)CC1	ZINC000450702438	ED	On-Demand	Anodyne	MC4R	27	40
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccccc1	ZINC000450702443	DH	On-Demand	Anodyne	SLC6A1	57	38
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccccc1	ZINC000450702443	DH	On-Demand	Anodyne	HRH3	22	44
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccccc1	ZINC000450702443	DH	On-Demand	Anodyne	PREP	26	42
O=C(CCCN1CCC[C@@H]1C1CCOCC1)c1ccccc1	ZINC000450702443	DH	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccccc1	ZINC000450702444	DH	On-Demand	Anodyne	SLC6A1	57	38
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccccc1	ZINC000450702444	DH	On-Demand	Anodyne	HRH3	22	44
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccccc1	ZINC000450702444	DH	On-Demand	Anodyne	PREP	26	42
O=C(CCCN1CCC[C@H]1C1CCOCC1)c1ccccc1	ZINC000450702444	DH	On-Demand	Anodyne	CYP2J2	59	42
COc1ccc(-c2n[nH]c(S[C@H]3C[C@@H](C)CCC3=O)n2)cc1	ZINC000450702493	DG	On-Demand	Anodyne	GCN5	0	52
COc1ccc(-c2n[nH]c(S[C@H]3C[C@@H](C)CCC3=O)n2)cc1	ZINC000450702493	DG	On-Demand	Anodyne	RTT109	0	54
COc1ccc(-c2n[nH]c(S[C@@H]3C[C@@H](C)CCC3=O)n2)cc1	ZINC000450702494	DG	On-Demand	Anodyne	GCN5	0	52
COc1ccc(-c2n[nH]c(S[C@@H]3C[C@@H](C)CCC3=O)n2)cc1	ZINC000450702494	DG	On-Demand	Anodyne	RTT109	0	54
COc1ccc(-c2n[nH]c(S[C@@H]3C[C@H](C)CCC3=O)n2)cc1	ZINC000450702495	DG	On-Demand	Anodyne	GCN5	0	52
COc1ccc(-c2n[nH]c(S[C@@H]3C[C@H](C)CCC3=O)n2)cc1	ZINC000450702495	DG	On-Demand	Anodyne	RTT109	0	54
COc1ccc(-c2n[nH]c(S[C@H]3C[C@H](C)CCC3=O)n2)cc1	ZINC000450702496	DG	On-Demand	Anodyne	GCN5	0	52
COc1ccc(-c2n[nH]c(S[C@H]3C[C@H](C)CCC3=O)n2)cc1	ZINC000450702496	DG	On-Demand	Anodyne	RTT109	0	54
COC(=O)[C@H]1C[C@@H](OC)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450702501	GD	On-Demand	Anodyne	MTNR1A	46	35
COC(=O)[C@H]1C[C@H](OC)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450702502	GD	On-Demand	Anodyne	MTNR1A	46	35
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450702503	GD	On-Demand	Anodyne	MTNR1A	46	35
COC(=O)[C@@H]1C[C@H](OC)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450702504	GD	On-Demand	Anodyne	MTNR1A	46	35
C[C@H]1C[C@H](C(F)(F)F)CCN1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450702566	FH	On-Demand	Anodyne	LRRK2	0	42
C[C@H]1C[C@@H](C(F)(F)F)CCN1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450702567	FH	On-Demand	Anodyne	LRRK2	0	42
C[C@@H]1C[C@@H](C(F)(F)F)CCN1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450702568	FH	On-Demand	Anodyne	LRRK2	0	42
C[C@@H]1C[C@H](C(F)(F)F)CCN1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450702569	FH	On-Demand	Anodyne	LRRK2	0	42
CCN1CCN(c2cccc(NC(=O)[C@@H]3CC3(F)F)c2)CC1	ZINC000450702614	DE	On-Demand	Anodyne	HTR1A	26	47
CCN1CCN(c2cccc(NC(=O)[C@@H]3CC3(F)F)c2)CC1	ZINC000450702614	DE	On-Demand	Anodyne	PRNP	30	42
CCN1CCN(c2cccc(NC(=O)[C@H]3CC3(F)F)c2)CC1	ZINC000450702615	DE	On-Demand	Anodyne	HTR1A	26	47
CCN1CCN(c2cccc(NC(=O)[C@H]3CC3(F)F)c2)CC1	ZINC000450702615	DE	On-Demand	Anodyne	PRNP	30	42
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450702626	FG	On-Demand	Anodyne	GRIN2B	15	42
F[C@H]1CN(c2nc(N3CCOCC3)nc(N3C[C@H](F)[C@H](F)C3)n2)C[C@H]1F	ZINC000450702627	GC	On-Demand	Anodyne	PIK3CA	23	41
F[C@H]1CN(c2nc(N3CCOCC3)nc(N3C[C@H](F)[C@H](F)C3)n2)C[C@H]1F	ZINC000450702627	GC	On-Demand	Anodyne	PIK3CG	15	41
F[C@H]1CN(c2nc(N3CCOCC3)nc(N3C[C@H](F)[C@H](F)C3)n2)C[C@H]1F	ZINC000450702627	GC	On-Demand	Anodyne	PIK3CB	19	41
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	FKBP1A	31	50
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	MMP13	38	41
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	CCR4	0	42
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	ITGA4	47	48
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	CAPNS1	27	54
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	MMP3	41	41
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	MMP8	26	40
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	CAPN1	23	58
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	MMP7	48	41
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	MMP1	42	44
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	XIAP	42	35
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	SFRP1	100	35
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702628	FD	On-Demand	Anodyne	WNT3	77	35
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	FKBP1A	31	50
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	MMP13	38	41
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	CCR4	0	42
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	ITGA4	47	48
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	CAPNS1	27	54
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	MMP3	41	41
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	MMP8	26	40
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	CAPN1	23	58
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	MMP7	48	41
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	MMP1	42	44
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	XIAP	42	35
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	SFRP1	100	35
C/C=C\C[C@H](CO)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450702629	FD	On-Demand	Anodyne	WNT3	77	35
CCOC(=O)c1ccc(CN2CCC(CC(=O)N(C)C)CC2)nc1	ZINC000450702641	ED	On-Demand	Anodyne	SSTR5	44	36
COc1ccc([C@H](NC[C@H](O)[C@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450702649	FI	On-Demand	Anodyne	CTSK	17	43
COc1ccc([C@H](NC[C@H](O)[C@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450702649	FI	On-Demand	Anodyne	AOC3	16	40
COc1ccc([C@H](NC[C@H](O)[C@@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450702650	FI	On-Demand	Anodyne	CTSK	17	43
COc1ccc([C@H](NC[C@H](O)[C@@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450702650	FI	On-Demand	Anodyne	AOC3	16	40
COc1ccc([C@H](NC[C@@H](O)[C@@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450702651	FI	On-Demand	Anodyne	CTSK	17	43
COc1ccc([C@H](NC[C@@H](O)[C@@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450702651	FI	On-Demand	Anodyne	AOC3	16	40
COc1ccc([C@H](NC[C@@H](O)[C@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450702652	FI	On-Demand	Anodyne	CTSK	17	43
COc1ccc([C@H](NC[C@@H](O)[C@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450702652	FI	On-Demand	Anodyne	AOC3	16	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC1(CO)CCCC1	ZINC000450702658	EE	On-Demand	Anodyne	CTSS	15	40
O=C(CC[C@H]1CCCCO1)COc1ccc(Cl)cc1F	ZINC000450702685	DH	On-Demand	Anodyne	PTGDR2	16	43
O=C(CC[C@@H]1CCCCO1)COc1ccc(Cl)cc1F	ZINC000450702686	DH	On-Demand	Anodyne	PTGDR2	15	42
F[C@H]1CN(c2ccnc(N3CCCCC3)n2)C[C@H]1F	ZINC000450702687	CD	On-Demand	Anodyne	SORD	50	42
Cc1ccc(NC(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450702689	FH	On-Demand	Bother	PRNP	49	33
Cc1ccc(NC(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450702689	FH	On-Demand	Bother	TAAR1	39	51
COC(=O)c1ccc(CN2CCO[C@H](C(C)C)C2)cc1Cl	ZINC000450702717	DF	On-Demand	Anodyne	DRD4	24	42
COC(=O)c1ccc(CN2CCO[C@@H](C(C)C)C2)cc1Cl	ZINC000450702718	DF	On-Demand	Anodyne	DRD4	24	42
COc1cc2c(NC[C@@H]3CCOC[C@H]3OC)ccnc2cc1F	ZINC000450702807	DF	On-Demand	Anodyne	HRP1_PLAFA	63	31
COc1cc2c(NC[C@@H]3CCOC[C@H]3OC)ccnc2cc1F	ZINC000450702807	DF	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(NC[C@@H]3CCOC[C@H]3OC)ccnc2cc1F	ZINC000450702807	DF	On-Demand	Anodyne	FLT1	22	40
COc1cc2c(NC[C@H]3CCOC[C@@H]3OC)ccnc2cc1F	ZINC000450702808	DF	On-Demand	Anodyne	HRP1_PLAFA	63	31
COc1cc2c(NC[C@H]3CCOC[C@@H]3OC)ccnc2cc1F	ZINC000450702808	DF	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(NC[C@H]3CCOC[C@@H]3OC)ccnc2cc1F	ZINC000450702808	DF	On-Demand	Anodyne	FLT1	22	40
COc1cc2c(NC[C@@H]3CCOC[C@@H]3OC)ccnc2cc1F	ZINC000450702809	DF	On-Demand	Anodyne	HRP1_PLAFA	63	31
COc1cc2c(NC[C@@H]3CCOC[C@@H]3OC)ccnc2cc1F	ZINC000450702809	DF	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(NC[C@@H]3CCOC[C@@H]3OC)ccnc2cc1F	ZINC000450702809	DF	On-Demand	Anodyne	FLT1	22	40
COc1cc2c(NC[C@H]3CCOC[C@H]3OC)ccnc2cc1F	ZINC000450702810	DF	On-Demand	Anodyne	HRP1_PLAFA	63	31
COc1cc2c(NC[C@H]3CCOC[C@H]3OC)ccnc2cc1F	ZINC000450702810	DF	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(NC[C@H]3CCOC[C@H]3OC)ccnc2cc1F	ZINC000450702810	DF	On-Demand	Anodyne	FLT1	22	40
CCOC(=O)c1cccnc1N1CC[C@](O)(C(F)F)C1	ZINC000450702852	CD	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)c1cccnc1N1CC[C@@](O)(C(F)F)C1	ZINC000450702853	CD	On-Demand	Anodyne	P2RY12	40	35
O[C@@]1(C(F)F)CCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450702860	CE	On-Demand	Anodyne	SORD	41	36
O[C@]1(C(F)F)CCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450702861	CE	On-Demand	Anodyne	SORD	41	36
CCCCn1c(O)nnc1SCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450702906	FH	On-Demand	Anodyne	AGTR1	30	44
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	ABL1	40	38
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	HTR1A	21	42
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	LCK	34	42
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	PRNP	73	48
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	KDR	0	43
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	HCK	25	43
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	LYN	24	41
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	TAAR1	40	41
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	MLYCD	22	40
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	DDR1	43	37
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	KCNK3	47	35
CCN1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450702916	FH	On-Demand	Anodyne	KCNK9	43	32
COc1ccc2c(c1)nc(CNC(=O)[C@@H](NC(C)=O)C(C)(C)C)n2C	ZINC000450702946	ED	On-Demand	Anodyne	MTNR1A	46	39
COc1ccc2c(c1)nc(CNC(=O)[C@@H](NC(C)=O)C(C)(C)C)n2C	ZINC000450702946	ED	On-Demand	Anodyne	MTNR1B	43	41
COC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1Cl	ZINC000450702948	FH	On-Demand	Anodyne	CCR3	27	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1(CO)CCCC1	ZINC000450702951	DG	On-Demand	Anodyne	PPARA	17	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1(CO)CCCC1	ZINC000450702951	DG	On-Demand	Anodyne	SLC6A9	20	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1(CO)CCCC1	ZINC000450702951	DG	On-Demand	Anodyne	SORT1	16	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1(CO)CCCC1	ZINC000450702951	DG	On-Demand	Anodyne	MTTP	50	35
CCOC(=O)C1(CNC(=O)c2ccsc2Br)CC1	ZINC000450702952	EF	On-Demand	Anodyne	HCN1	41	33
CCOC(=O)C1(CNC(=O)c2ccsc2Br)CC1	ZINC000450702952	EF	On-Demand	Anodyne	HCN4	40	33
O=C(c1ccc(I)cc1F)N1CCn2ncnc2C1	ZINC000450702953	FD	On-Demand	Anodyne	P2RX7	33	42
COc1ccc2c(c1)nc(CNC(=O)CC1(O)CCC1)n2C	ZINC000450702964	DD	On-Demand	Anodyne	MTNR1A	48	37
COc1ccc2c(c1)nc(CNC(=O)CC1(O)CCC1)n2C	ZINC000450702964	DD	On-Demand	Anodyne	MTNR1B	25	42
CCOC(=O)C1(CNC(=O)c2cn3nccc3nc2C)CC1	ZINC000450702974	DD	On-Demand	Anodyne	HCN1	57	35
CCOC(=O)C1(CNC(=O)c2cn3nccc3nc2C)CC1	ZINC000450702974	DD	On-Demand	Anodyne	HCN4	52	36
Clc1cnn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450702985	FH	On-Demand	Anodyne	DRD2	0	47
Clc1cnn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450702985	FH	On-Demand	Anodyne	DRD4	22	47
Clc1cnn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450702985	FH	On-Demand	Anodyne	DRD3	15	45
Nc1ncccc1CN1CCC(n2cc(Cl)cn2)CC1	ZINC000450702998	CE	On-Demand	Anodyne	MAP3K7	46	33
CC(=O)N[C@H](C(=O)N(C)CCN(C)C1CC1)C(C)(C)C	ZINC000450703049	CD	On-Demand	Anodyne	PDF	45	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703050	EE	On-Demand	Anodyne	KLK3	46	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703050	EE	On-Demand	Anodyne	CAPN2	41	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703051	EE	On-Demand	Anodyne	KLK3	46	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703051	EE	On-Demand	Anodyne	CAPN2	41	32
Cc1ccc(NC(=O)c2ccc(N3CC[C@@](O)(C(F)F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450703143	GG	On-Demand	Bother	PRNP	50	34
Cc1ccc(NC(=O)c2ccc(N3CC[C@@](O)(C(F)F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450703143	GG	On-Demand	Bother	TAAR1	41	47
Cc1ccc(NC(=O)c2ccc(N3CC[C@](O)(C(F)F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450703144	GG	On-Demand	Bother	PRNP	50	34
Cc1ccc(NC(=O)c2ccc(N3CC[C@](O)(C(F)F)C3)c([N+](=O)[O-])c2)cc1	ZINC000450703144	GG	On-Demand	Bother	TAAR1	41	47
CCN1CCN(c2cccc(NC(=O)c3cc4ccncc4s3)c2)CC1	ZINC000450703222	FH	On-Demand	Anodyne	PRNP	37	47
CCOC(=O)C1(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450703223	FG	On-Demand	Anodyne	CACNA1C	16	42
CCOC(=O)C1(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450703223	FG	On-Demand	Anodyne	RBP4	53	35
COc1ccc([C@H](NCc2ccc(Cl)c(OC)c2)C(F)(F)F)cc1	ZINC000450703231	FJ	On-Demand	Anodyne	CASR	15	44
COc1ccc([C@@H](NCc2ccc(Cl)c(OC)c2)C(F)(F)F)cc1	ZINC000450703232	FJ	On-Demand	Anodyne	CASR	15	44
C=CCOc1ccc(CC(=O)Nc2cccc(N3CCN(CC)CC3)c2)cc1	ZINC000450703233	GH	On-Demand	Mild	HTR1A	20	50
C/C=C\C[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450703235	FF	On-Demand	Anodyne	PIN1	26	42
C/C=C/C[C@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450703236	FF	On-Demand	Anodyne	PIN1	26	42
C/C=C\C[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450703237	FF	On-Demand	Anodyne	PIN1	26	42
C/C=C/C[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450703238	FF	On-Demand	Anodyne	PIN1	26	42
CCOC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)nc1	ZINC000450703241	EF	On-Demand	Anodyne	P2RY12	27	40
CCOC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)nc1	ZINC000450703241	EF	On-Demand	Anodyne	SSTR5	45	38
CC(C)N1CCCC[C@H]1CN1CC[C@@H](COc2ccccc2)C1	ZINC000450703243	DH	On-Demand	Anodyne	SIGMAR1	23	52
CC(C)N1CCCC[C@H]1CN1CC[C@@H](COc2ccccc2)C1	ZINC000450703243	DH	On-Demand	Anodyne	CHRNA10	73	46
CC(C)N1CCCC[C@H]1CN1CC[C@H](COc2ccccc2)C1	ZINC000450703246	DH	On-Demand	Anodyne	SIGMAR1	23	52
CC(C)N1CCCC[C@H]1CN1CC[C@H](COc2ccccc2)C1	ZINC000450703246	DH	On-Demand	Anodyne	CHRNA10	73	46
CC(C)N1CCCC[C@@H]1CN1CC[C@H](COc2ccccc2)C1	ZINC000450703248	DH	On-Demand	Anodyne	SIGMAR1	23	52
CC(C)N1CCCC[C@@H]1CN1CC[C@H](COc2ccccc2)C1	ZINC000450703248	DH	On-Demand	Anodyne	CHRNA10	73	46
CC(C)N1CCCC[C@@H]1CN1CC[C@@H](COc2ccccc2)C1	ZINC000450703249	DH	On-Demand	Anodyne	SIGMAR1	23	52
CC(C)N1CCCC[C@@H]1CN1CC[C@@H](COc2ccccc2)C1	ZINC000450703249	DH	On-Demand	Anodyne	CHRNA10	73	46
c1ccc(OC[C@H]2CCN(Cc3cn(CC4CC4)nn3)C2)cc1	ZINC000450703254	DF	On-Demand	Anodyne	SIGMAR1	24	57
c1ccc(OC[C@H]2CCN(Cc3cn(CC4CC4)nn3)C2)cc1	ZINC000450703254	DF	On-Demand	Anodyne	MAL12	0	40
c1ccc(OC[C@@H]2CCN(Cc3cn(CC4CC4)nn3)C2)cc1	ZINC000450703255	DF	On-Demand	Anodyne	SIGMAR1	24	57
c1ccc(OC[C@@H]2CCN(Cc3cn(CC4CC4)nn3)C2)cc1	ZINC000450703255	DF	On-Demand	Anodyne	MAL12	0	40
Clc1ccc(CCN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450703256	DI	On-Demand	Anodyne	DRD4	15	44
Clc1ccc(CCN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450703256	DI	On-Demand	Anodyne	SIGMAR1	24	46
Clc1ccc(CCN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450703256	DI	On-Demand	Anodyne	L3MBTL3	32	41
C[C@H](O)CCN1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450703267	BF	On-Demand	Anodyne	SLC18A2	15	54
C[C@H](O)CCN1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450703268	BF	On-Demand	Anodyne	SLC18A2	15	54
C[C@H](O)CCN1CCC[C@H]1/C=C/c1ccccc1	ZINC000450703269	BF	On-Demand	Anodyne	SLC18A2	15	54
C[C@H](O)CCN1CCC[C@H]1/C=C\c1ccccc1	ZINC000450703270	BF	On-Demand	Anodyne	SLC18A2	15	54
Cc1cccc2c1C[C@@H](C(=O)NCC1(CO)CCCC1)O2	ZINC000450703271	CD	On-Demand	Anodyne	ACAT	0	40
Cc1cccc2c1C[C@H](C(=O)NCC1(CO)CCCC1)O2	ZINC000450703273	CD	On-Demand	Anodyne	ACAT	0	40
COc1cc2c(N3C[C@H](F)[C@H](F)C3)ncnc2cc1F	ZINC000450703291	CE	On-Demand	Anodyne	PDE3A	63	47
COc1cc2c(N3C[C@H](F)[C@H](F)C3)ncnc2cc1F	ZINC000450703291	CE	On-Demand	Anodyne	PDGFRB	67	43
COc1cc2c(N3C[C@H](F)[C@H](F)C3)ncnc2cc1F	ZINC000450703291	CE	On-Demand	Anodyne	PDE3B	92	47
COc1ccc(Cn2c(S[C@H]3CC[C@@H](C#N)C3)nc3ccccc3c2=O)cc1	ZINC000450703318	GI	On-Demand	Mild	PROKR1	48	33
COc1ccc(Cn2c(S[C@@H]3CC[C@H](C#N)C3)nc3ccccc3c2=O)cc1	ZINC000450703321	GI	On-Demand	Mild	PROKR1	48	33
COc1ccc(Cn2c(S[C@@H]3CC[C@@H](C#N)C3)nc3ccccc3c2=O)cc1	ZINC000450703322	GI	On-Demand	Mild	PROKR1	48	33
COc1ccc(Cn2c(S[C@H]3CC[C@H](C#N)C3)nc3ccccc3c2=O)cc1	ZINC000450703323	GI	On-Demand	Mild	PROKR1	48	33
CC(=O)CCCCCOc1ccc(Cl)cc1F	ZINC000450703327	CI	On-Demand	Anodyne	THRA	29	47
CC(=O)CCCCCOc1ccc(Cl)cc1F	ZINC000450703327	CI	On-Demand	Anodyne	THRB	27	47
CC(=O)CCCCCOc1ccc(Cl)cc1F	ZINC000450703327	CI	On-Demand	Anodyne	S1PR4	29	45
COc1ccc2c(c1)nc(CNC(=O)C[C@@H](CNC(C)=O)CC(C)C)n2C	ZINC000450703328	FE	On-Demand	Anodyne	NQO2	19	41
COc1ccc2c(c1)nc(CNC(=O)C[C@@H](CNC(C)=O)CC(C)C)n2C	ZINC000450703328	FE	On-Demand	Anodyne	MTNR1A	59	47
COc1ccc2c(c1)nc(CNC(=O)C[C@@H](CNC(C)=O)CC(C)C)n2C	ZINC000450703328	FE	On-Demand	Anodyne	MTNR1B	56	47
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](CO)c1ccsc1	ZINC000450703333	EH	On-Demand	Anodyne	MTTP	45	33
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703334	EH	On-Demand	Anodyne	MTTP	45	33
C[C@@H](CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1)S(C)(=O)=O	ZINC000450703372	EE	On-Demand	Anodyne	AKT2	50	35
C[C@H](CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1)S(C)(=O)=O	ZINC000450703373	EE	On-Demand	Anodyne	AKT2	50	35
C[C@H](CN1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1)S(C)(=O)=O	ZINC000450703374	EE	On-Demand	Anodyne	AKT2	50	35
C[C@@H](CN1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1)S(C)(=O)=O	ZINC000450703375	EE	On-Demand	Anodyne	AKT2	50	35
CCOC(=O)C1(CNC(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450703428	DD	On-Demand	Anodyne	EPHB3	34	48
CCOC(=O)C1(CNC(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450703428	DD	On-Demand	Anodyne	HCN1	41	33
CCOC(=O)C1(CNC(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450703428	DD	On-Demand	Anodyne	HCN4	41	33
COc1cc(OC)nc(N2CC[C@](O)(C(F)F)C2)n1	ZINC000450703444	CC	On-Demand	Anodyne	ALS	53	33
COc1cc(OC)nc(N2CC[C@@](O)(C(F)F)C2)n1	ZINC000450703445	CC	On-Demand	Anodyne	ALS	53	33
CO[C@H]1CCCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450703482	FF	On-Demand	Anodyne	GSK3A	15	42
CO[C@@H]1CCCC[C@@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450703483	FF	On-Demand	Anodyne	GSK3A	15	42
CO[C@H]1CCCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450703484	FF	On-Demand	Anodyne	GSK3A	15	42
CO[C@@H]1CCCC[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450703485	FF	On-Demand	Anodyne	GSK3A	15	42
Cn1nnc2c1C[C@H](C(=O)Nc1n[nH]c(-c3ccc(O)c(Cl)c3)n1)CC2	ZINC000450703492	FD	On-Demand	Anodyne	GSK3A	21	43
Cn1nnc2c1C[C@@H](C(=O)Nc1n[nH]c(-c3ccc(O)c(Cl)c3)n1)CC2	ZINC000450703493	FD	On-Demand	Anodyne	GSK3A	21	43
CO[C@H]1COCC[C@@H]1CNc1nc(-c2ccc(F)cc2)cs1	ZINC000450703518	DF	On-Demand	Anodyne	MAOB	29	43
CO[C@@H]1COCC[C@@H]1CNc1nc(-c2ccc(F)cc2)cs1	ZINC000450703519	DF	On-Demand	Anodyne	MAOB	29	43
CO[C@@H]1COCC[C@H]1CNc1nc(-c2ccc(F)cc2)cs1	ZINC000450703520	DF	On-Demand	Anodyne	MAOB	29	43
CO[C@H]1COCC[C@H]1CNc1nc(-c2ccc(F)cc2)cs1	ZINC000450703521	DF	On-Demand	Anodyne	MAOB	29	43
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC1CC(F)(F)C1	ZINC000450703549	EH	On-Demand	Anodyne	OPRM1	15	48
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC1CC(F)(F)C1	ZINC000450703549	EH	On-Demand	Anodyne	OPRD1	15	48
CCSc1cccnc1C(=O)NCC1(CO)CCCC1	ZINC000450703571	CE	On-Demand	Anodyne	HCN4	47	31
CCOC(=O)C1(CNC(=O)c2cccc(CC)n2)CC1	ZINC000450703603	CD	On-Demand	Anodyne	HCN1	41	33
COC(=O)C1(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)CC1	ZINC000450703610	FF	On-Demand	Anodyne	ACHP_LYMST	18	40
COC(=O)C1(CN2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)CC1	ZINC000450703610	FF	On-Demand	Anodyne	Q8WSF8_APLCA	38	40
CCc1cccc(C(=O)N[C@H](CO)c2ccsc2)n1	ZINC000450703611	CE	On-Demand	Anodyne	PDE5A	27	41
CCc1cccc(C(=O)NCC2(CO)CCCC2)n1	ZINC000450703613	CD	On-Demand	Anodyne	HCN4	49	32
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@H](F)[C@H](F)C1	ZINC000450703622	EF	On-Demand	Anodyne	ATP4A	25	54
Cc1cc(N2CC[C@@](O)(C(F)F)C2)nc(-c2cccnc2)n1	ZINC000450703641	DE	On-Demand	Anodyne	ROS1	35	41
Cc1cc(N2CC[C@](O)(C(F)F)C2)nc(-c2cccnc2)n1	ZINC000450703642	DE	On-Demand	Anodyne	ROS1	35	41
CCc1cccc(C(=O)N[C@@H](CO)c2ccsc2)n1	ZINC000450703651	CE	On-Demand	Anodyne	PDE5A	27	41
CCOC(=O)C1(CNC(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450703653	FF	On-Demand	Anodyne	HCN1	63	35
CCOC(=O)C1(CNC(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450703653	FF	On-Demand	Anodyne	HCN4	53	36
c1ccc(OC[C@@H]2CCN(Cc3nnc(C4CC4)s3)C2)cc1	ZINC000450703656	DG	On-Demand	Anodyne	SIGMAR1	19	49
c1ccc(OC[C@H]2CCN(Cc3nnc(C4CC4)s3)C2)cc1	ZINC000450703657	DG	On-Demand	Anodyne	SIGMAR1	19	49
COc1cc(CC(=O)N[C@@H](C)CSc2ccc(C)cc2)ccc1O	ZINC000450703668	EH	On-Demand	Anodyne	TRPV1	43	47
COc1cc(CC(=O)N[C@@H](C)CSc2ccc(C)cc2)ccc1O	ZINC000450703668	EH	On-Demand	Anodyne	NCE103	31	44
COc1cc(CC(=O)N[C@@H](C)CSc2ccc(C)cc2)ccc1O	ZINC000450703668	EH	On-Demand	Anodyne	CAN2	0	44
COc1cc(CC(=O)N[C@H](C)CSc2ccc(C)cc2)ccc1O	ZINC000450703671	EH	On-Demand	Anodyne	TRPV1	43	47
COc1cc(CC(=O)N[C@H](C)CSc2ccc(C)cc2)ccc1O	ZINC000450703671	EH	On-Demand	Anodyne	NCE103	31	44
COc1cc(CC(=O)N[C@H](C)CSc2ccc(C)cc2)ccc1O	ZINC000450703671	EH	On-Demand	Anodyne	CAN2	0	44
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	DRD2	18	49
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	DRD4	27	43
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	SLC6A4	17	44
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	SLC6A3	17	53
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	HRH3	15	45
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	SIGMAR1	47	62
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	CCR4	16	44
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	CCR5	30	47
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	NOS3	17	42
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	C5AR1	16	42
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	MCHR1	16	41
CN(C)C(=O)CC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450703678	DG	On-Demand	Anodyne	CACNA1I	48	36
O=C(Nc1c[nH]nc1[C@H]1CCCN(Cc2cnn[nH]2)C1)c1ccccc1	ZINC000450703688	FE	On-Demand	Anodyne	SLC6A1	40	34
O=C(Nc1c[nH]nc1[C@@H]1CCCN(Cc2cnn[nH]2)C1)c1ccccc1	ZINC000450703689	FE	On-Demand	Anodyne	SLC6A1	40	34
CCOC(=O)CCN(Cc1cccnc1)Cc1cccc(C)n1	ZINC000450703736	DF	On-Demand	Anodyne	NR1D1	40	37
CCC(=O)CCCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450703744	EH	On-Demand	Anodyne	OPRD1	20	51
CCC(=O)CCCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450703744	EH	On-Demand	Anodyne	ACHP_LYMST	16	41
CCC(=O)CCCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450703744	EH	On-Demand	Anodyne	Q8WSF8_APLCA	34	41
CCOC(=O)c1c(N2CC[C@](O)(C(F)F)C2)nc2ccccc2c1C	ZINC000450703765	FF	On-Demand	Anodyne	TSPO	18	42
CCOC(=O)c1c(N2CC[C@@](O)(C(F)F)C2)nc2ccccc2c1C	ZINC000450703766	FF	On-Demand	Anodyne	TSPO	18	42
COc1cc(CC(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)ccc1Cl	ZINC000450703775	GH	On-Demand	Anodyne	CCR1	24	42
COc1cc(CC(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)ccc1Cl	ZINC000450703775	GH	On-Demand	Anodyne	MLNR	17	41
COC(=O)c1coc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)n1	ZINC000450703778	FF	On-Demand	Anodyne	AKT2	44	34
COC(=O)c1coc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)n1	ZINC000450703779	FF	On-Demand	Anodyne	AKT2	44	34
CCN1CCN(c2cccc(NC(=O)C(C)(C)C3CCC3)c2)CC1	ZINC000450703793	EH	On-Demand	Anodyne	HTR1A	31	48
CCN1CCN(c2cccc(NC(=O)C(C)(C)C3CCC3)c2)CC1	ZINC000450703793	EH	On-Demand	Anodyne	DRD2	18	42
CCN1CCN(c2cccc(NC(=O)C(C)(C)C3CCC3)c2)CC1	ZINC000450703793	EH	On-Demand	Anodyne	DRD3	22	42
CCN1CCN(c2cccc(NC(=O)C(C)(C)C3CCC3)c2)CC1	ZINC000450703793	EH	On-Demand	Anodyne	HTR7	24	48
CCN1CCN(c2cccc(NC(=O)C(C)(C)C3CCC3)c2)CC1	ZINC000450703793	EH	On-Demand	Anodyne	PRNP	25	40
COC(=O)[C@@H](C)NC(=O)c1ccc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450703798	FD	On-Demand	Bother	TAAR1	25	45
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450703799	FD	On-Demand	Bother	TAAR1	25	45
CCS(=O)(=O)c1ccc(CN2CCC(CC(=O)N(C)C)CC2)cc1	ZINC000450703807	FE	On-Demand	Anodyne	DRD4	18	40
CCS(=O)(=O)c1ccc(CN2CCC(CC(=O)N(C)C)CC2)cc1	ZINC000450703807	FE	On-Demand	Anodyne	ACHE	32	49
CCS(=O)(=O)c1ccc(CN2CCC(CC(=O)N(C)C)CC2)cc1	ZINC000450703807	FE	On-Demand	Anodyne	AVPR1B	43	35
CCS(=O)(=O)c1ccc(CN2CCC(CC(=O)N(C)C)CC2)cc1	ZINC000450703807	FE	On-Demand	Anodyne	SIGMAR1	38	46
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	HTR1A	28	44
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	DRD4	41	31
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	HTR1D	23	40
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	HTR1B	28	40
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	HTR2A	43	38
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	HTR2C	41	38
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	HTR7	22	40
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	NPY2R	69	35
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	PRNP	62	43
CCN1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450703808	FG	On-Demand	Anodyne	NPY5R	15	41
O=C(NCC(=O)N1CC(n2ccnn2)C1)Nc1cccc(Cl)c1	ZINC000450703809	ED	On-Demand	Anodyne	PTGER3	17	41
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	HTR1A	28	43
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	DRD2	19	44
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	MME	24	40
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	HTR7	28	43
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	KCNQ2	48	38
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	NPY2R	42	34
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	TIMP3	55	33
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	PRNP	34	43
CCN1CCN(c2cccc(NC(=O)[C@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703810	FG	On-Demand	Anodyne	GPR142	40	37
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	HTR1A	28	43
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	DRD2	19	44
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	MME	24	40
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	HTR7	28	43
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	KCNQ2	48	38
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	NPY2R	42	34
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	TIMP3	55	33
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	PRNP	34	43
CCN1CCN(c2cccc(NC(=O)[C@@H](Cc3ccccc3)OC)c2)CC1	ZINC000450703811	FG	On-Demand	Anodyne	GPR142	40	37
Cc1cc(OCc2ccccc2)nc(N2CC[C@@](O)(C(F)F)C2)n1	ZINC000450703822	EF	On-Demand	Anodyne	SLC12A5	44	31
Cc1cc(OCc2ccccc2)nc(N2CC[C@](O)(C(F)F)C2)n1	ZINC000450703823	EF	On-Demand	Anodyne	SLC12A5	44	31
CCOC(=O)C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450703856	ED	On-Demand	Anodyne	NPFFR1	40	35
CCOC(=O)C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450703856	ED	On-Demand	Anodyne	THYX_PBCV1	0	45
CCOC(=O)C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450703856	ED	On-Demand	Anodyne	HCN1	56	35
CCOC(=O)C1(CNC(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450703856	ED	On-Demand	Anodyne	HCN4	50	34
O[C@]1(C(F)F)CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450703901	CE	On-Demand	Anodyne	MLYCD	29	41
O[C@@]1(C(F)F)CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450703904	CE	On-Demand	Anodyne	MLYCD	29	41
CC(=O)[C@@](C)(O)CN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450703947	GE	On-Demand	Anodyne	P2RY1	31	41
CC(=O)[C@](C)(O)CN1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000450703948	GE	On-Demand	Anodyne	P2RY1	31	41
CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2CC1CCC(=O)CC1	ZINC000450703983	FH	On-Demand	Anodyne	OPRD1	17	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703986	DE	On-Demand	Anodyne	MME	58	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703986	DE	On-Demand	Anodyne	PAPA1_CARPA	54	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703986	DE	On-Demand	Anodyne	CAPNS1	45	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703986	DE	On-Demand	Anodyne	CAPN2	55	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703986	DE	On-Demand	Anodyne	ACE2	43	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703986	DE	On-Demand	Anodyne	POL	0	43
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703986	DE	On-Demand	Anodyne	GPR88	0	43
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703987	DE	On-Demand	Anodyne	MME	58	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703987	DE	On-Demand	Anodyne	PAPA1_CARPA	54	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703987	DE	On-Demand	Anodyne	CAPNS1	45	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703987	DE	On-Demand	Anodyne	CAPN2	55	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703987	DE	On-Demand	Anodyne	ACE2	43	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703987	DE	On-Demand	Anodyne	POL	0	43
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703987	DE	On-Demand	Anodyne	GPR88	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703988	DE	On-Demand	Anodyne	MME	58	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703988	DE	On-Demand	Anodyne	PAPA1_CARPA	54	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703988	DE	On-Demand	Anodyne	CAPNS1	45	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703988	DE	On-Demand	Anodyne	CAPN2	55	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703988	DE	On-Demand	Anodyne	ACE2	43	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703988	DE	On-Demand	Anodyne	POL	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@H](CO)c1ccsc1	ZINC000450703988	DE	On-Demand	Anodyne	GPR88	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703989	DE	On-Demand	Anodyne	MME	58	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703989	DE	On-Demand	Anodyne	PAPA1_CARPA	54	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703989	DE	On-Demand	Anodyne	CAPNS1	45	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703989	DE	On-Demand	Anodyne	CAPN2	55	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703989	DE	On-Demand	Anodyne	ACE2	43	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703989	DE	On-Demand	Anodyne	POL	0	43
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](CO)c1ccsc1	ZINC000450703989	DE	On-Demand	Anodyne	GPR88	0	43
COc1ncc(CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])cc1Cl	ZINC000450703990	GG	On-Demand	Bother	SRC	40	42
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C(C)(C)C)c2)CC1	ZINC000450704010	FH	On-Demand	Anodyne	HTR1A	25	50
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C(C)(C)C)c2)CC1	ZINC000450704010	FH	On-Demand	Anodyne	PRNP	24	40
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	HTR1A	45	49
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	DRD2	28	44
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	HTR1B	22	40
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	HTR2A	29	40
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	DRD3	37	44
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	HTR7	42	45
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	PRNP	37	47
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	MAPK1	33	48
CCN1CCN(c2cccc(NC(=O)[C@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704021	GG	On-Demand	Anodyne	EPHX2	19	41
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	HTR1A	45	49
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	DRD2	28	44
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	HTR1B	22	40
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	HTR2A	29	40
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	DRD3	37	44
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	HTR7	42	45
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	PRNP	37	47
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	MAPK1	33	48
CCN1CCN(c2cccc(NC(=O)[C@@H]3CCN(c4ccccc4)C3)c2)CC1	ZINC000450704022	GG	On-Demand	Anodyne	EPHX2	19	41
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	HTR1A	34	47
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	DRD2	21	40
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	HTR2A	30	41
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	DRD3	32	41
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	HTR7	30	40
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	LCK	23	40
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	PRNP	41	44
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	NPY5R	15	41
CCN1CCN(c2cccc(NC(=O)c3cccc(C(F)(F)F)n3)c2)CC1	ZINC000450704023	GG	On-Demand	Anodyne	LYN	19	40
Cc1cc(N2C[C@H](F)[C@H](F)C2)n2ncnc2n1	ZINC000450704026	BC	On-Demand	Anodyne	DHOD	0	43
CCOC(=O)C1(CNC(=O)c2ccn(CCn3cccn3)n2)CC1	ZINC000450704032	EC	On-Demand	Anodyne	HCN1	54	35
CCOC(=O)C1(CNC(=O)c2ccn(CCn3cccn3)n2)CC1	ZINC000450704032	EC	On-Demand	Anodyne	HCN4	52	35
Cc1sccc1C(=O)NCC1(CO)CCCC1	ZINC000450704040	CE	On-Demand	Anodyne	HCN1	54	33
Cc1sccc1C(=O)NCC1(CO)CCCC1	ZINC000450704040	CE	On-Demand	Anodyne	HCN4	52	33
O=C(NCC1(CO)CCCC1)c1ccccc1-n1cc(Br)cn1	ZINC000450704049	GF	On-Demand	Anodyne	HCN1	71	36
O=C(NCC1(CO)CCCC1)c1ccccc1-n1cc(Br)cn1	ZINC000450704049	GF	On-Demand	Anodyne	HCN4	53	34
CCS(=O)(=O)c1ccc(CN(C)CCN(C(C)C)C(C)C)cc1	ZINC000450704052	EG	On-Demand	Anodyne	RORC	17	40
CCCCCN(CC(N)=O)C[C@H](O)CCC	ZINC000450704053	BD	On-Demand	Anodyne	CQSS	51	35
CCCCCN(CC(N)=O)C[C@@H](O)CCC	ZINC000450704054	BD	On-Demand	Anodyne	CQSS	51	35
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	F2	39	40
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	FKBP1A	50	52
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	MMP13	67	45
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	CCR4	0	41
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	ADAM17	59	39
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	ITGA4	43	45
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	CAPNS1	23	46
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	MMP2	30	42
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	MMP3	68	45
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	MMP8	32	42
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	CAPN1	19	48
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	MMP9	37	44
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	MMP7	77	45
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	MMP1	73	48
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	SFRP1	46	33
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	WNT3	51	33
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	HCN1	40	31
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	HCN4	41	31
CCOC(=O)C1(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450704059	GD	On-Demand	Anodyne	TMPRSS11D	46	34
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450704077	DF	On-Demand	Anodyne	HTR1A	24	45
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450704077	DF	On-Demand	Anodyne	PRNP	30	42
CCN1CCN(c2cccc(NC(=O)CC3CC(F)(F)C3)c2)CC1	ZINC000450704086	EG	On-Demand	Anodyne	HTR1A	23	45
CCN1CCN(c2cccc(NC(=O)CC3CC(F)(F)C3)c2)CC1	ZINC000450704086	EG	On-Demand	Anodyne	PRNP	24	40
C/C=C/C[C@H](CO)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450704097	CD	On-Demand	Anodyne	MMP13	17	44
C/C=C\C[C@@H](CO)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450704098	CD	On-Demand	Anodyne	MMP13	17	44
C/C=C/C[C@@H](CO)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450704099	CD	On-Demand	Anodyne	MMP13	17	44
C/C=C\C[C@H](CO)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450704100	CD	On-Demand	Anodyne	MMP13	17	44
c1ccc(OC[C@@H]2CCN(C[C@@H]3COCCO3)C2)cc1	ZINC000450704107	CD	On-Demand	Anodyne	SIGMAR1	22	54
c1ccc(OC[C@H]2CCN(C[C@@H]3COCCO3)C2)cc1	ZINC000450704108	CD	On-Demand	Anodyne	SIGMAR1	22	54
c1ccc(OC[C@H]2CCN(C[C@H]3COCCO3)C2)cc1	ZINC000450704109	CD	On-Demand	Anodyne	SIGMAR1	22	54
c1ccc(OC[C@@H]2CCN(C[C@H]3COCCO3)C2)cc1	ZINC000450704110	CD	On-Demand	Anodyne	SIGMAR1	22	54
Cc1ccc2ncnc(N3CC[C@@](O)(C(F)F)C3)c2c1	ZINC000450704113	CE	On-Demand	Anodyne	PDE3B	41	31
Cc1ccc2ncnc(N3CC[C@@](O)(C(F)F)C3)c2c1	ZINC000450704113	CE	On-Demand	Anodyne	AKT1	32	48
Cc1ccc2ncnc(N3CC[C@](O)(C(F)F)C3)c2c1	ZINC000450704114	CE	On-Demand	Anodyne	PDE3B	41	31
Cc1ccc2ncnc(N3CC[C@](O)(C(F)F)C3)c2c1	ZINC000450704114	CE	On-Demand	Anodyne	AKT1	32	48
CCOC(=O)C1(CNC(=O)c2cc(OC)c(OC)cc2Br)CC1	ZINC000450704135	GF	On-Demand	Anodyne	KCNA3	41	36
CCOC(=O)C1(CNC(=O)c2cc(OC)c(OC)cc2Br)CC1	ZINC000450704135	GF	On-Demand	Anodyne	HCN1	62	34
CCOC(=O)C1(CNC(=O)c2cc(OC)c(OC)cc2Br)CC1	ZINC000450704135	GF	On-Demand	Anodyne	HCN4	49	33
CC(C)(C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)C1CC1	ZINC000450704175	DG	On-Demand	Anodyne	GSK3A	15	43
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450704203	GD	On-Demand	Bother	TAAR1	21	43
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450704204	GD	On-Demand	Bother	TAAR1	21	43
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450704205	GD	On-Demand	Bother	TAAR1	21	43
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450704206	GD	On-Demand	Bother	TAAR1	21	43
Nc1ncccc1CN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450704209	GG	On-Demand	Anodyne	HDAC1	44	39
Nc1ncccc1CN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450704210	GG	On-Demand	Anodyne	HDAC1	44	39
CN(CCN(C)C1CC1)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450704213	FE	On-Demand	Mild	NR3C2	31	40
CN(CCN(C)C1CC1)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450704213	FE	On-Demand	Mild	AR	19	43
CN(CCN(C)C1CC1)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450704214	FE	On-Demand	Mild	NR3C2	31	40
CN(CCN(C)C1CC1)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450704214	FE	On-Demand	Mild	AR	19	43
Cc1nc(C(C)C)oc1COc1ccc(Cl)cc1F	ZINC000450704224	CI	On-Demand	Anodyne	S1PR4	0	40
COc1ncc(CNc2nccc(C(F)F)n2)cc1Cl	ZINC000450704225	DG	On-Demand	Anodyne	CLK4	21	48
COc1ncc(CNc2ccc(S(C)(=O)=O)cc2C(F)(F)F)cc1Cl	ZINC000450704236	GH	On-Demand	Anodyne	PTGS2	31	42
COc1ncc(CNc2ccc(S(C)(=O)=O)cc2C(F)(F)F)cc1Cl	ZINC000450704236	GH	On-Demand	Anodyne	NR1H3	49	37
CCN1CCN(c2cccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)c2)CC1	ZINC000450704239	FE	On-Demand	Anodyne	HTR1A	22	51
CCN1CCN(c2cccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)c2)CC1	ZINC000450704239	FE	On-Demand	Anodyne	HTR7	15	45
CCN1CCN(c2cccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)c2)CC1	ZINC000450704239	FE	On-Demand	Anodyne	PRNP	24	40
CN(CCN1CCC(n2cc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450704248	EG	On-Demand	Anodyne	DRD2	0	44
CN(CCN1CCC(n2cc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450704248	EG	On-Demand	Anodyne	DRD4	23	41
CN(CCN1CCC(n2cc(Cl)cn2)CC1)Cc1ccccc1	ZINC000450704248	EG	On-Demand	Anodyne	SIGMAR1	48	43
CC(=O)N[C@H](C(=O)N[C@H](C)CSc1ccc(C)cc1)C(C)(C)C	ZINC000450704295	EG	On-Demand	Anodyne	TNF	19	40
CC(=O)N[C@H](C(=O)N[C@@H](C)CSc1ccc(C)cc1)C(C)(C)C	ZINC000450704296	EG	On-Demand	Anodyne	TNF	19	40
COC(=O)c1csc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)n1	ZINC000450704314	GG	On-Demand	Anodyne	AKT2	47	35
COC(=O)c1csc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)n1	ZINC000450704315	GG	On-Demand	Anodyne	AKT2	47	35
COc1ncc(CNc2ccc(C(=O)NCCO)nn2)cc1Cl	ZINC000450704320	EC	On-Demand	Anodyne	PDE6A	41	32
COC(=O)[C@@H]1C[C@@H](OC)CCN1CC/C=C/c1ccccc1	ZINC000450704332	DF	On-Demand	Anodyne	SLC6A1	26	41
COC(=O)[C@@H]1C[C@H](OC)CCN1CC/C=C/c1ccccc1	ZINC000450704333	DF	On-Demand	Anodyne	SLC6A1	26	41
COC(=O)[C@@H]1C[C@H](OC)CCN1CC/C=C\c1ccccc1	ZINC000450704334	DF	On-Demand	Anodyne	SLC6A1	26	41
COC(=O)[C@@H]1C[C@@H](OC)CCN1CC/C=C\c1ccccc1	ZINC000450704335	DF	On-Demand	Anodyne	SLC6A1	26	41
CO[C@@H]1COCC[C@H]1CNc1nc(C)ccc1[N+](=O)[O-]	ZINC000450704336	CD	On-Demand	Bother	PRKCQ	45	36
CO[C@H]1COCC[C@H]1CNc1nc(C)ccc1[N+](=O)[O-]	ZINC000450704337	CD	On-Demand	Bother	PRKCQ	45	36
CO[C@H]1COCC[C@@H]1CNc1nc(C)ccc1[N+](=O)[O-]	ZINC000450704338	CD	On-Demand	Bother	PRKCQ	45	36
CO[C@@H]1COCC[C@@H]1CNc1nc(C)ccc1[N+](=O)[O-]	ZINC000450704339	CD	On-Demand	Bother	PRKCQ	45	36
CSc1cccc(C(=O)N(C)CCN(C)C2CC2)c1	ZINC000450704340	CF	On-Demand	Anodyne	ACE	20	44
CC[C@H](CC(C)C)C(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000450704371	DG	On-Demand	Anodyne	MTNR1A	40	38
CC[C@@H](CC(C)C)C(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000450704372	DG	On-Demand	Anodyne	MTNR1A	40	38
CC(C)N1CCN(CCN(C)Cc2ccccc2)CC1=O	ZINC000450704380	CD	On-Demand	Anodyne	SIGMAR1	26	44
COc1ccc(OC(F)(F)F)c(C(=O)NCC2(CO)CCCC2)c1	ZINC000450704382	EF	On-Demand	Anodyne	HCN1	51	34
CC(=O)CCCCCSc1nccn1Cc1ccccc1	ZINC000450704386	DI	On-Demand	Anodyne	PLA2G7	16	40
CC(=O)CCCCCSc1nccn1Cc1ccccc1	ZINC000450704386	DI	On-Demand	Anodyne	CES1	42	33
C/C=C\C[C@@H](CO)NC(=O)c1cc2ccc(Br)cc2s1	ZINC000450704389	FH	On-Demand	Anodyne	PIN1	28	44
C/C=C/C[C@@H](CO)NC(=O)c1cc2ccc(Br)cc2s1	ZINC000450704390	FH	On-Demand	Anodyne	PIN1	28	44
C/C=C/C[C@H](CO)NC(=O)c1cc2ccc(Br)cc2s1	ZINC000450704391	FH	On-Demand	Anodyne	PIN1	28	44
C/C=C\C[C@H](CO)NC(=O)c1cc2ccc(Br)cc2s1	ZINC000450704392	FH	On-Demand	Anodyne	PIN1	28	44
COCCn1c(S[C@@H](C)C(=O)Nc2nccs2)nc2cc(Cl)ccc21	ZINC000450704397	GH	On-Demand	Anodyne	MAP1	85	38
COCCn1c(S[C@H](C)C(=O)Nc2nccs2)nc2cc(Cl)ccc21	ZINC000450704398	GH	On-Demand	Anodyne	MAP1	85	38
CC(C)c1nccc(N2CC[C@](O)(C(F)F)C2)n1	ZINC000450704414	CD	On-Demand	Anodyne	SORD	70	43
CC(C)c1nccc(N2CC[C@@](O)(C(F)F)C2)n1	ZINC000450704415	CD	On-Demand	Anodyne	SORD	70	43
O[C@@]1(C(F)F)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450704504	FH	On-Demand	Anodyne	ADRB2	15	51
O[C@@]1(C(F)F)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450704504	FH	On-Demand	Anodyne	ADRB3	31	52
O[C@]1(C(F)F)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450704505	FH	On-Demand	Anodyne	ADRB2	15	51
O[C@]1(C(F)F)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450704505	FH	On-Demand	Anodyne	ADRB3	31	52
COC(=O)[C@@H]1C[C@@H](OC)CCN1C[C@@H](Cc1ccccc1)OC	ZINC000450704521	DD	On-Demand	Anodyne	ACE	53	38
COC(=O)[C@@H]1C[C@H](OC)CCN1C[C@H](Cc1ccccc1)OC	ZINC000450704522	DD	On-Demand	Anodyne	ACE	53	38
COC(=O)[C@@H]1C[C@@H](OC)CCN1C[C@H](Cc1ccccc1)OC	ZINC000450704523	DD	On-Demand	Anodyne	ACE	53	38
COC(=O)[C@@H]1C[C@H](OC)CCN1C[C@@H](Cc1ccccc1)OC	ZINC000450704524	DD	On-Demand	Anodyne	ACE	53	38
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450704544	FE	On-Demand	Anodyne	PDGFRB	41	46
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450704544	FE	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450704544	FE	On-Demand	Anodyne	MTNR1B	22	40
COc1ccc(CNC(=O)CCN(C)[C@@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450704544	FE	On-Demand	Anodyne	CSF1R	17	46
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450704545	FE	On-Demand	Anodyne	PDGFRB	41	46
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450704545	FE	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450704545	FE	On-Demand	Anodyne	MTNR1B	22	40
COc1ccc(CNC(=O)CCN(C)[C@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450704545	FE	On-Demand	Anodyne	CSF1R	17	46
COc1cc2c(cc1F)CN(Cc1noc(-c3cncc(C)c3)n1)CC2	ZINC000450704566	FG	On-Demand	Anodyne	ABCB1	16	41
COc1cccc(NC(=O)c2ccc(C)nc2C(C)C)c1O	ZINC000450704568	DG	On-Demand	Anodyne	KCNK3	39	41
COc1cccc(NC(=O)c2ccc(C)nc2C(C)C)c1O	ZINC000450704568	DG	On-Demand	Anodyne	KCNK9	34	41
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	HTR1A	15	53
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	DRD2	35	49
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	DRD1	0	46
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	DRD4	22	54
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	HTR2A	33	60
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	HTR2C	19	60
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	HTR7	26	49
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	SIGMAR1	17	51
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	HTR5A	41	60
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	SLC18A3	0	48
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCc2c(ncn2-c2ccccc2)C1)c1ccc(F)cc1	ZINC000450704602	FI	On-Demand	Anodyne	CYP2J2	55	39
COc1cc(OC)c2ncc(C#N)c(NC[C@H]3CCOC[C@@H]3OC)c2c1	ZINC000450704604	FF	On-Demand	Mild	SRC	44	36
COc1cc(OC)c2ncc(C#N)c(NC[C@@H]3CCOC[C@@H]3OC)c2c1	ZINC000450704605	FF	On-Demand	Mild	SRC	44	36
COc1cc(OC)c2ncc(C#N)c(NC[C@H]3CCOC[C@H]3OC)c2c1	ZINC000450704606	FF	On-Demand	Mild	SRC	44	36
COc1cc(OC)c2ncc(C#N)c(NC[C@@H]3CCOC[C@H]3OC)c2c1	ZINC000450704607	FF	On-Demand	Mild	SRC	44	36
FC1(F)CC(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1	ZINC000450704617	EI	On-Demand	Anodyne	RBP4	42	35
FC1(F)CC(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1	ZINC000450704618	EI	On-Demand	Anodyne	RBP4	42	35
CCOC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)[C@H]1CCCOC1	ZINC000450704629	DD	On-Demand	Anodyne	TIMP3	41	33
CCOC(=O)[C@@H](NC[C@H](O)Cc1ccccc1)[C@@H]1CCCOC1	ZINC000450704630	DD	On-Demand	Anodyne	TIMP3	41	33
Cc1csc(NC2CCN(C(=O)Cc3ccc(O)c(F)c3)CC2)n1	ZINC000450704635	EF	On-Demand	Anodyne	MLNR	24	41
COc1cccc2c(N3C[C@H](F)[C@H](F)C3)cc(C)nc12	ZINC000450704656	CG	On-Demand	Anodyne	ATP4A	21	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000450704657	CD	On-Demand	Anodyne	CYP26A1	53	33
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000450704657	CD	On-Demand	Anodyne	CYP27B1	45	33
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000450704658	CD	On-Demand	Anodyne	CYP26A1	53	33
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000450704658	CD	On-Demand	Anodyne	CYP27B1	45	33
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000450704659	CD	On-Demand	Anodyne	CYP26A1	53	33
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000450704659	CD	On-Demand	Anodyne	CYP27B1	45	33
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000450704660	CD	On-Demand	Anodyne	CYP26A1	53	33
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000450704660	CD	On-Demand	Anodyne	CYP27B1	45	33
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704665	GF	On-Demand	Anodyne	HTR1A	18	43
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704665	GF	On-Demand	Anodyne	DRD4	51	38
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704665	GF	On-Demand	Anodyne	DRD3	22	43
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704665	GF	On-Demand	Anodyne	ACACA	42	36
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704665	GF	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(Oc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704665	GF	On-Demand	Anodyne	MTNR1B	30	40
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704666	GF	On-Demand	Anodyne	HTR1A	18	43
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704666	GF	On-Demand	Anodyne	DRD4	51	38
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704666	GF	On-Demand	Anodyne	DRD3	22	43
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704666	GF	On-Demand	Anodyne	ACACA	42	36
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704666	GF	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(Oc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)nc2)c1	ZINC000450704666	GF	On-Demand	Anodyne	MTNR1B	30	40
Cc1noc(C2(C)CCN(CC/C=C\c3ccccc3)CC2)n1	ZINC000450704667	DH	On-Demand	Anodyne	SIGMAR1	16	52
Cc1noc(C2(C)CCN(CC/C=C/c3ccccc3)CC2)n1	ZINC000450704668	DH	On-Demand	Anodyne	SIGMAR1	16	52
CC(=O)c1ccc(CN2CCC(C)(c3nc(C)no3)CC2)cc1	ZINC000450704679	DG	On-Demand	Anodyne	SIGMAR1	27	40
COC(=O)c1ccc(CC(=O)NCC2(CO)CCCC2)cc1	ZINC000450704680	DD	On-Demand	Anodyne	NPFFR1	38	44
COc1cc(CC(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)ccc1O	ZINC000450704688	FF	On-Demand	Anodyne	MLNR	18	44
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cn(CC2CC2)nn1	ZINC000450704719	GE	On-Demand	Anodyne	P2RY12	74	34
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cn(CC2CC2)nn1	ZINC000450704720	GE	On-Demand	Anodyne	P2RY12	74	34
CCOC(=O)c1ccc(CN2CC[C@H]([C@H](C)O)C2)nc1	ZINC000450704731	CD	On-Demand	Anodyne	SSTR5	28	40
CCOC(=O)c1ccc(CN2CC[C@@H]([C@@H](C)O)C2)nc1	ZINC000450704733	CD	On-Demand	Anodyne	SSTR5	28	40
CCOC(=O)c1ccc(CN2CC[C@@H]([C@H](C)O)C2)nc1	ZINC000450704735	CD	On-Demand	Anodyne	SSTR5	28	40
CCOC(=O)c1ccc(CN2CC[C@H]([C@@H](C)O)C2)nc1	ZINC000450704737	CD	On-Demand	Anodyne	SSTR5	28	40
CCN1CCN(c2cccc(NC(=O)c3ccsc3Br)c2)CC1	ZINC000450704772	GH	On-Demand	Anodyne	HTR1A	19	46
CCN1CCN(c2cccc(NC(=O)c3ccsc3Br)c2)CC1	ZINC000450704772	GH	On-Demand	Anodyne	PRNP	37	44
CCN1CCN(c2cccc(NC(=O)c3ccsc3Br)c2)CC1	ZINC000450704772	GH	On-Demand	Anodyne	KCNK3	49	33
CCN1CCN(c2cccc(NC(=O)c3ccsc3Br)c2)CC1	ZINC000450704772	GH	On-Demand	Anodyne	KCNK9	56	33
CCCCCN(CC(N)=O)Cc1ccccc1OC1CC1	ZINC000450704773	CF	On-Demand	Anodyne	ACHE	0	49
CCCCCN(CC(N)=O)Cc1ccccc1OC1CC1	ZINC000450704773	CF	On-Demand	Anodyne	BCHE	0	49
CCCCCN(CC(N)=O)Cc1ccccc1OC1CC1	ZINC000450704773	CF	On-Demand	Anodyne	AMY2	46	34
C[C@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704784	FI	On-Demand	Anodyne	PTGS2	42	42
C[C@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704784	FI	On-Demand	Anodyne	CA7	15	46
C[C@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704784	FI	On-Demand	Anodyne	CTSF	53	35
C[C@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704784	FI	On-Demand	Anodyne	ADAMTS4	39	41
C[C@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704784	FI	On-Demand	Anodyne	FFAR1	27	40
C[C@@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704785	FI	On-Demand	Anodyne	PTGS2	42	42
C[C@@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704785	FI	On-Demand	Anodyne	CA7	15	46
C[C@@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704785	FI	On-Demand	Anodyne	CTSF	53	35
C[C@@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704785	FI	On-Demand	Anodyne	ADAMTS4	39	41
C[C@@H](c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450704785	FI	On-Demand	Anodyne	FFAR1	27	40
CC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450704797	EG	On-Demand	Anodyne	ACHE	41	54
CC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450704797	EG	On-Demand	Anodyne	HTR4	52	32
CC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450704797	EG	On-Demand	Anodyne	THRB	0	43
CC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450704797	EG	On-Demand	Anodyne	HRH3	24	44
CC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450704797	EG	On-Demand	Anodyne	SIGMAR1	44	44
CC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450704797	EG	On-Demand	Anodyne	CCR3	32	45
CC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450704797	EG	On-Demand	Anodyne	CACNA1I	43	35
CC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450704797	EG	On-Demand	Anodyne	CYP2J2	54	39
CCOC(=O)C1(CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450704801	EG	On-Demand	Anodyne	HCN1	41	32
CCOC(=O)C1(CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450704801	EG	On-Demand	Anodyne	HCN4	41	33
CN(C)Cc1nc(N2C[C@H](F)[C@H](F)C2)c2c(-c3ccccc3)csc2n1	ZINC000450704809	FH	On-Demand	Anodyne	ADRB3	0	40
COC(=O)[C@H]1CC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)O1	ZINC000450704824	FD	On-Demand	Anodyne	GSK3A	15	42
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1nc2cc(F)ccc2o1	ZINC000450704881	CG	On-Demand	Anodyne	HTR3A	15	57
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1nc2cc(F)ccc2o1	ZINC000450704882	CG	On-Demand	Anodyne	HTR3A	15	57
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1nc2cc(F)ccc2o1	ZINC000450704883	CG	On-Demand	Anodyne	HTR3A	15	57
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1nc2cc(F)ccc2o1	ZINC000450704884	CG	On-Demand	Anodyne	HTR3A	15	57
O=C(c1cc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450704910	FF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450704910	FF	On-Demand	Bother	L3MBTL3	23	43
O=C(c1cc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450704911	FF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450704911	FF	On-Demand	Bother	L3MBTL3	23	43
CCC[C@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704925	EF	On-Demand	Anodyne	ACE	17	41
CCC[C@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704925	EF	On-Demand	Anodyne	TACR1	18	43
CCC[C@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704925	EF	On-Demand	Anodyne	CAPNS1	40	33
CCC[C@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704925	EF	On-Demand	Anodyne	CAPN2	71	35
CCC[C@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704925	EF	On-Demand	Anodyne	ACE2	45	35
CCC[C@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704926	EF	On-Demand	Anodyne	ACE	17	41
CCC[C@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704926	EF	On-Demand	Anodyne	TACR1	18	43
CCC[C@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704926	EF	On-Demand	Anodyne	CAPNS1	40	33
CCC[C@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704926	EF	On-Demand	Anodyne	CAPN2	71	35
CCC[C@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704926	EF	On-Demand	Anodyne	ACE2	45	35
CCC[C@@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704927	EF	On-Demand	Anodyne	ACE	17	41
CCC[C@@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704927	EF	On-Demand	Anodyne	TACR1	18	43
CCC[C@@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704927	EF	On-Demand	Anodyne	CAPNS1	40	33
CCC[C@@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704927	EF	On-Demand	Anodyne	CAPN2	71	35
CCC[C@@H](OC)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704927	EF	On-Demand	Anodyne	ACE2	45	35
CCC[C@@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704928	EF	On-Demand	Anodyne	ACE	17	41
CCC[C@@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704928	EF	On-Demand	Anodyne	TACR1	18	43
CCC[C@@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704928	EF	On-Demand	Anodyne	CAPNS1	40	33
CCC[C@@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704928	EF	On-Demand	Anodyne	CAPN2	71	35
CCC[C@@H](OC)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450704928	EF	On-Demand	Anodyne	ACE2	45	35
CCCn1c(S[C@@H]2C[C@H](C)CCC2=O)nc2cc(S(N)(=O)=O)ccc21	ZINC000450704929	GF	On-Demand	Anodyne	CNR2	15	40
CCCn1c(S[C@H]2C[C@H](C)CCC2=O)nc2cc(S(N)(=O)=O)ccc21	ZINC000450704931	GF	On-Demand	Anodyne	CNR2	15	40
CCCn1c(S[C@@H]2C[C@@H](C)CCC2=O)nc2cc(S(N)(=O)=O)ccc21	ZINC000450704932	GF	On-Demand	Anodyne	CNR2	15	40
CCCn1c(S[C@H]2C[C@@H](C)CCC2=O)nc2cc(S(N)(=O)=O)ccc21	ZINC000450704933	GF	On-Demand	Anodyne	CNR2	15	40
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450704938	FG	On-Demand	Anodyne	SLC6A1	43	33
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450704938	FG	On-Demand	Anodyne	SLC6A3	24	45
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450704938	FG	On-Demand	Anodyne	PRCP	24	40
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450704938	FG	On-Demand	Anodyne	CCR5	54	39
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450704939	FG	On-Demand	Anodyne	SLC6A1	43	33
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450704939	FG	On-Demand	Anodyne	SLC6A3	24	45
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450704939	FG	On-Demand	Anodyne	PRCP	24	40
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450704939	FG	On-Demand	Anodyne	CCR5	54	39
Cc1csc(NC2CCN(C(=O)C3CC(C)(O)C3)CC2)n1	ZINC000450704948	DE	On-Demand	Anodyne	TRPC6	48	36
Cc1csc(NC2CCN(C(=O)c3ccc(-c4cnn(C)c4)o3)CC2)n1	ZINC000450704998	FG	On-Demand	Anodyne	TRPC6	47	35
COc1cc(OC)c(C[C@@H](C)Nc2ncc([N+](=O)[O-])c(N)n2)c(OC)c1	ZINC000450704999	FD	On-Demand	Bother	P2RX2	65	39
COc1cc(OC)c(C[C@@H](C)Nc2ncc([N+](=O)[O-])c(N)n2)c(OC)c1	ZINC000450704999	FD	On-Demand	Bother	P2RX3	46	39
COc1cc(OC)c(C[C@H](C)Nc2ncc([N+](=O)[O-])c(N)n2)c(OC)c1	ZINC000450705001	FD	On-Demand	Bother	P2RX2	65	39
COc1cc(OC)c(C[C@H](C)Nc2ncc([N+](=O)[O-])c(N)n2)c(OC)c1	ZINC000450705001	FD	On-Demand	Bother	P2RX3	46	39
CO[C@@H]1COCC[C@H]1CNc1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450705018	DE	On-Demand	Bother	PRKCQ	46	39
CO[C@H]1COCC[C@@H]1CNc1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450705019	DE	On-Demand	Bother	PRKCQ	46	39
CO[C@H]1COCC[C@H]1CNc1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450705020	DE	On-Demand	Bother	PRKCQ	46	39
CO[C@@H]1COCC[C@@H]1CNc1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450705022	DE	On-Demand	Bother	PRKCQ	46	39
C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc2cccnc2s1	ZINC000450705046	EE	On-Demand	Anodyne	P2RX3	27	43
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc2cccnc2s1	ZINC000450705048	EE	On-Demand	Anodyne	P2RX3	27	43
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450705049	GF	On-Demand	Anodyne	RBP4	91	45
Cc1cccc(Cl)c1CN[C@@H](CO)c1ccc(Br)cc1	ZINC000450705051	FI	On-Demand	Anodyne	EIF2AK1	39	40
Cc1cccc(Cl)c1CN[C@H](CO)c1ccc(Br)cc1	ZINC000450705066	FI	On-Demand	Anodyne	EIF2AK1	39	40
Cc1csc(NC2CCN(C(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)CC2)n1	ZINC000450705068	EH	On-Demand	Anodyne	TRPC6	47	35
Cc1csc(NC2CCN(C(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)n1	ZINC000450705071	EH	On-Demand	Anodyne	TRPC6	47	35
Cc1csc(NC2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)n1	ZINC000450705073	EH	On-Demand	Anodyne	TRPC6	47	35
Cc1csc(NC2CCN(C(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)n1	ZINC000450705075	EH	On-Demand	Anodyne	TRPC6	47	35
CCOC(=O)c1cc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)on1	ZINC000450705088	FE	On-Demand	Anodyne	TRPC6	48	35
Cc1cc(Cl)c2ncc(C#N)c(N3C[C@H](F)[C@H](F)C3)c2c1	ZINC000450705089	DH	On-Demand	Mild	MAP3K8	56	33
COCc1nc(N2C[C@H](F)[C@H](F)C2)c2c(-c3ccccc3)csc2n1	ZINC000450705116	FI	On-Demand	Anodyne	ADRB3	20	40
COc1ccc2c(c1)nc(CNC(=O)CCCc1ncc(C)o1)n2C	ZINC000450705156	EF	On-Demand	Anodyne	MTNR1A	45	39
CO[C@@H](Cc1ccccc1)C(=O)NCC1(CO)CCCC1	ZINC000450705157	CD	On-Demand	Anodyne	ACAT	0	43
CO[C@H](Cc1ccccc1)C(=O)NCC1(CO)CCCC1	ZINC000450705158	CD	On-Demand	Anodyne	ACAT	0	43
Cc1ccc(C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)c(Cl)c1Cl	ZINC000450705182	GJ	On-Demand	Anodyne	P2RX7	39	43
C/C=C\C[C@@H](CO)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450705185	CD	On-Demand	Anodyne	CAN2	0	46
C/C=C\C[C@H](CO)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450705186	CD	On-Demand	Anodyne	CAN2	0	46
O=C(c1cc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450705195	FF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450705195	FF	On-Demand	Bother	L3MBTL3	23	43
O=C(c1cc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450705198	FF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450705198	FF	On-Demand	Bother	L3MBTL3	23	43
O[C@]1(C(F)F)CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450705199	DF	On-Demand	Anodyne	GRM5	23	44
O=C(Nc1nncs1)c1ccc(N2C[C@H](F)[C@H](F)C2)nc1	ZINC000450705200	DD	On-Demand	Anodyne	HDAC1	29	45
CCN1CCN(c2cccc(NC(=O)c3cc(C)cs3)c2)CC1	ZINC000450705208	EG	On-Demand	Anodyne	HTR1A	24	46
CCN1CCN(c2cccc(NC(=O)c3cc(C)cs3)c2)CC1	ZINC000450705208	EG	On-Demand	Anodyne	DRD4	43	37
CCN1CCN(c2cccc(NC(=O)c3cc(C)cs3)c2)CC1	ZINC000450705208	EG	On-Demand	Anodyne	HTR2A	24	41
CCN1CCN(c2cccc(NC(=O)c3cc(C)cs3)c2)CC1	ZINC000450705208	EG	On-Demand	Anodyne	PRNP	37	46
CCN1CCN(c2cccc(NC(=O)c3cc(C)cs3)c2)CC1	ZINC000450705208	EG	On-Demand	Anodyne	KCNK3	50	35
CCN1CCN(c2cccc(NC(=O)c3cc(C)cs3)c2)CC1	ZINC000450705208	EG	On-Demand	Anodyne	KCNK9	55	38
O[C@@]1(C(F)F)CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450705211	DF	On-Demand	Anodyne	GRM5	23	44
CCOC(=O)C1(CNC(=O)c2ocnc2-c2ccccc2)CC1	ZINC000450705236	DE	On-Demand	Anodyne	HCN1	40	32
CCOC(=O)C1(CNC(=O)c2ocnc2-c2ccccc2)CC1	ZINC000450705236	DE	On-Demand	Anodyne	HCN4	40	32
CN(C)c1nccc(N2CC[C@](O)(C(F)F)C2)n1	ZINC000450705258	CC	On-Demand	Anodyne	SORD	67	34
CN(C)c1nccc(N2CC[C@@](O)(C(F)F)C2)n1	ZINC000450705259	CC	On-Demand	Anodyne	SORD	67	34
COC(=O)C1(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)CC1	ZINC000450705274	GF	On-Demand	Anodyne	SLC6A1	62	33
COC(=O)C1(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)CC1	ZINC000450705275	GF	On-Demand	Anodyne	SLC6A1	62	33
NC(=O)c1cnc(N2CC[C@](O)(C(F)F)C2)c(Cl)c1	ZINC000450705290	CD	On-Demand	Anodyne	CXCR3	22	40
NC(=O)c1cnc(N2CC[C@@](O)(C(F)F)C2)c(Cl)c1	ZINC000450705291	CD	On-Demand	Anodyne	CXCR3	22	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1	ZINC000450705301	FG	On-Demand	Anodyne	PRNP	42	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1	ZINC000450705301	FG	On-Demand	Anodyne	HDAC1	30	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1	ZINC000450705301	FG	On-Demand	Anodyne	TAAR1	34	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1	ZINC000450705301	FG	On-Demand	Anodyne	KCNK3	53	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@](O)(C(F)F)C2)nc1	ZINC000450705302	FG	On-Demand	Anodyne	PRNP	42	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@](O)(C(F)F)C2)nc1	ZINC000450705302	FG	On-Demand	Anodyne	HDAC1	30	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@](O)(C(F)F)C2)nc1	ZINC000450705302	FG	On-Demand	Anodyne	TAAR1	34	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@](O)(C(F)F)C2)nc1	ZINC000450705302	FG	On-Demand	Anodyne	KCNK3	53	41
Cc1cccc(Cl)c1CN[C@H](CO)C(C)(C)C	ZINC000450705321	CG	On-Demand	Anodyne	EIF2AK1	41	34
COc1cc(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)ccc1Cl	ZINC000450705322	GH	On-Demand	Anodyne	OPRK1	35	42
COc1cc(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)ccc1Cl	ZINC000450705322	GH	On-Demand	Anodyne	SSTR5	57	39
COc1cc(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)ccc1Cl	ZINC000450705322	GH	On-Demand	Anodyne	CCR1	28	42
COc1cc(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)ccc1Cl	ZINC000450705322	GH	On-Demand	Anodyne	MLNR	33	42
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450705349	FG	On-Demand	Anodyne	P2RY12	66	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450705349	FG	On-Demand	Anodyne	CYP51A1	21	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450705349	FG	On-Demand	Anodyne	REN	32	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450705349	FG	On-Demand	Anodyne	TRPC6	45	34
CO[C@H](Cc1ccccc1)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450705350	FG	On-Demand	Anodyne	P2RY12	66	34
CO[C@H](Cc1ccccc1)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450705350	FG	On-Demand	Anodyne	CYP51A1	21	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450705350	FG	On-Demand	Anodyne	REN	32	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450705350	FG	On-Demand	Anodyne	TRPC6	45	34
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450705359	FG	On-Demand	Anodyne	SCN9A	0	41
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450705360	FG	On-Demand	Anodyne	SCN9A	0	41
Cc1csc(NC2CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC2)n1	ZINC000450705372	GG	On-Demand	Anodyne	GHRHR	41	31
CCOC(=O)c1ccc(CN2CCc3c(ncn3-c3ccccc3)C2)nc1	ZINC000450705386	FG	On-Demand	Anodyne	NOD1	25	42
CCOC(=O)c1ccc(CN2CCc3c(ncn3-c3ccccc3)C2)nc1	ZINC000450705386	FG	On-Demand	Anodyne	NOD2	40	42
COc1cc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705390	FE	On-Demand	Anodyne	DRD2	29	41
COc1cc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705390	FE	On-Demand	Anodyne	DRD4	43	34
COc1cc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705390	FE	On-Demand	Anodyne	DRD3	34	41
COc1cc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705390	FE	On-Demand	Anodyne	AVPR1A	19	46
COc1cc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705390	FE	On-Demand	Anodyne	OPRK1	18	40
COc1cc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705390	FE	On-Demand	Anodyne	HTR4	67	36
COc1cc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705390	FE	On-Demand	Anodyne	HTR7	25	40
COc1cc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705390	FE	On-Demand	Anodyne	SIGMAR1	19	42
COc1cc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705391	FE	On-Demand	Anodyne	DRD2	29	41
COc1cc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705391	FE	On-Demand	Anodyne	DRD4	43	34
COc1cc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705391	FE	On-Demand	Anodyne	DRD3	34	41
COc1cc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705391	FE	On-Demand	Anodyne	AVPR1A	19	46
COc1cc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705391	FE	On-Demand	Anodyne	OPRK1	18	40
COc1cc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705391	FE	On-Demand	Anodyne	HTR4	67	36
COc1cc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705391	FE	On-Demand	Anodyne	HTR7	25	40
COc1cc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450705391	FE	On-Demand	Anodyne	SIGMAR1	19	42
CCN(CC)S(=O)(=O)c1ccc(NCCc2scnc2C)c([N+](=O)[O-])c1	ZINC000450705398	GG	On-Demand	Bother	BDKRB1	22	41
COc1cc2c(cc1F)CN(C[C@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000450705446	CF	On-Demand	Anodyne	ABCB1	0	41
COc1cc2c(cc1F)CN(C[C@@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000450705447	CF	On-Demand	Anodyne	ABCB1	0	41
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450705475	GI	On-Demand	Anodyne	OPRM1	17	46
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450705475	GI	On-Demand	Anodyne	OPRD1	17	46
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450705475	GI	On-Demand	Anodyne	ACHP_LYMST	25	42
CO[C@@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450705475	GI	On-Demand	Anodyne	Q8WSF8_APLCA	50	42
CO[C@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450705476	GI	On-Demand	Anodyne	OPRM1	17	46
CO[C@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450705476	GI	On-Demand	Anodyne	OPRD1	17	46
CO[C@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450705476	GI	On-Demand	Anodyne	ACHP_LYMST	25	42
CO[C@H](Cc1ccccc1)CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450705476	GI	On-Demand	Anodyne	Q8WSF8_APLCA	50	42
C=C(C)CN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450705500	DE	On-Demand	Mild	MTNR1A	60	37
C=C(C)CN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450705500	DE	On-Demand	Mild	MTNR1B	51	36
COc1ccccc1-n1cnc2cc(C(=O)N(C)CCN(C)C3CC3)ccc21	ZINC000450705501	GG	On-Demand	Anodyne	PDGFRB	0	42
COc1ccccc1-n1cnc2cc(C(=O)N(C)CCN(C)C3CC3)ccc21	ZINC000450705501	GG	On-Demand	Anodyne	PLK1	46	35
COc1ccccc1-n1cnc2cc(C(=O)N(C)CCN(C)C3CC3)ccc21	ZINC000450705501	GG	On-Demand	Anodyne	HPGD	49	58
COc1ccccc1-n1cnc2cc(C(=O)N(C)CCN(C)C3CC3)ccc21	ZINC000450705501	GG	On-Demand	Anodyne	ACKR3	56	32
Cc1cc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)n2ncnc2n1	ZINC000450705542	CD	On-Demand	Anodyne	DHOD	0	45
Cc1cc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)n2ncnc2n1	ZINC000450705543	CD	On-Demand	Anodyne	DHOD	0	45
Cc1cc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)n2ncnc2n1	ZINC000450705544	CD	On-Demand	Anodyne	DHOD	0	45
Cc1cc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)n2ncnc2n1	ZINC000450705545	CD	On-Demand	Anodyne	DHOD	0	45
CCOC(=O)C1(CNC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CC1	ZINC000450705561	FD	On-Demand	Anodyne	COLA	55	36
CCOC(=O)C1(CNC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CC1	ZINC000450705561	FD	On-Demand	Anodyne	CPT1A	52	35
CCOC(=O)C1(CNC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CC1	ZINC000450705561	FD	On-Demand	Anodyne	CPT1B	43	32
F[C@H]1CN(c2ccnc3cc(Cl)ccc23)C[C@H]1F	ZINC000450705593	CG	On-Demand	Anodyne	HRP1_PLAFA	100	39
F[C@H]1CN(c2ccnc3cc(Cl)ccc23)C[C@H]1F	ZINC000450705593	CG	On-Demand	Anodyne	HNMT	54	38
NC(=O)c1ccc(CCC(=O)NCC2(CO)CCCC2)cc1	ZINC000450705595	DD	On-Demand	Anodyne	NPFFR1	40	38
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	HTR1A	20	49
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	DRD2	29	50
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	DRD4	32	44
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	HTR2A	30	52
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	HTR2C	15	52
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	HRH1	15	44
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	DRD3	22	44
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	ERG2	19	43
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	HTR7	26	43
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	SIGMAR1	25	48
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	PRCP	31	40
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	HTR3B	0	41
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	MCHR1	16	47
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccccc1	ZINC000450705597	EH	On-Demand	Anodyne	CYP2J2	66	47
CCC(=O)CCCN1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450705598	CH	On-Demand	Anodyne	SLC6A1	73	35
CCC(=O)CCCN1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450705598	CH	On-Demand	Anodyne	PREP	47	39
CCC(=O)CCCN1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450705598	CH	On-Demand	Anodyne	CYP2J2	46	33
CCC(=O)CCCN1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450705600	CH	On-Demand	Anodyne	SLC6A1	73	35
CCC(=O)CCCN1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450705600	CH	On-Demand	Anodyne	PREP	47	39
CCC(=O)CCCN1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450705600	CH	On-Demand	Anodyne	CYP2J2	46	33
CCC(=O)CCCN1CCC[C@H]1/C=C\c1ccccc1	ZINC000450705602	CH	On-Demand	Anodyne	SLC6A1	73	35
CCC(=O)CCCN1CCC[C@H]1/C=C\c1ccccc1	ZINC000450705602	CH	On-Demand	Anodyne	PREP	47	39
CCC(=O)CCCN1CCC[C@H]1/C=C\c1ccccc1	ZINC000450705602	CH	On-Demand	Anodyne	CYP2J2	46	33
CCC(=O)CCCN1CCC[C@H]1/C=C/c1ccccc1	ZINC000450705603	CH	On-Demand	Anodyne	SLC6A1	73	35
CCC(=O)CCCN1CCC[C@H]1/C=C/c1ccccc1	ZINC000450705603	CH	On-Demand	Anodyne	PREP	47	39
CCC(=O)CCCN1CCC[C@H]1/C=C/c1ccccc1	ZINC000450705603	CH	On-Demand	Anodyne	CYP2J2	46	33
C/C=C/C[C@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450705621	CE	On-Demand	Anodyne	AKT1	50	31
C/C=C/C[C@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450705621	CE	On-Demand	Anodyne	PIN1	27	43
C/C=C\C[C@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450705622	CE	On-Demand	Anodyne	AKT1	50	31
C/C=C\C[C@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450705622	CE	On-Demand	Anodyne	PIN1	27	43
C/C=C\C[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450705623	CE	On-Demand	Anodyne	AKT1	50	31
C/C=C\C[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450705623	CE	On-Demand	Anodyne	PIN1	27	43
C/C=C/C[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450705624	CE	On-Demand	Anodyne	AKT1	50	31
C/C=C/C[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450705624	CE	On-Demand	Anodyne	PIN1	27	43
O[C@@]1(C(F)F)CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450705646	DE	On-Demand	Anodyne	RBP4	20	47
O[C@]1(C(F)F)CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450705648	DE	On-Demand	Anodyne	RBP4	20	47
CCOC(=O)C1(CNC(=O)c2cc(Cl)c3ccccc3n2)CC1	ZINC000450705651	EF	On-Demand	Anodyne	ADAM17	28	41
CCOC(=O)C1(CNC(=O)c2cc(Cl)c3ccccc3n2)CC1	ZINC000450705651	EF	On-Demand	Anodyne	HCN1	40	32
CCN1CCN(c2cccc(NC(=O)CCCc3ncc(C)o3)c2)CC1	ZINC000450705674	FG	On-Demand	Anodyne	HTR1A	16	47
CCN1CCN(c2cccc(NC(=O)CCCc3ncc(C)o3)c2)CC1	ZINC000450705674	FG	On-Demand	Anodyne	CACNA1G	0	43
COc1ccc2c(c1)nc(CNC(=O)CCCC(=O)C1CC1)n2C	ZINC000450705675	EE	On-Demand	Anodyne	MTNR1A	43	37
CC(F)(F)CCOc1ccc(Cl)cc1F	ZINC000450705688	BH	On-Demand	Anodyne	S1PR4	29	46
C/C=C\C[C@H](CO)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450705692	DD	On-Demand	Anodyne	PDE4D	15	40
C/C=C\C[C@H](CO)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450705693	DD	On-Demand	Anodyne	PDE4D	15	40
C/C=C/C[C@H](CO)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450705694	DD	On-Demand	Anodyne	PDE4D	15	40
C/C=C/C[C@H](CO)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450705695	DD	On-Demand	Anodyne	PDE4D	15	40
OC[C@H](NCc1ccccc1OC1CC1)c1ccc(Br)cc1	ZINC000450705705	FH	On-Demand	Anodyne	SLC5A4	51	34
OC[C@@H](NCc1ccccc1OC1CC1)c1ccc(Br)cc1	ZINC000450705707	FH	On-Demand	Anodyne	SLC5A4	51	34
COC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1Cl	ZINC000450705729	FH	On-Demand	Anodyne	SIGMAR1	26	42
COC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1Cl	ZINC000450705729	FH	On-Demand	Anodyne	SSTR5	51	37
COC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1Cl	ZINC000450705729	FH	On-Demand	Anodyne	CCR3	45	42
COC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1Cl	ZINC000450705729	FH	On-Demand	Anodyne	CXCR3	38	43
COC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1Cl	ZINC000450705729	FH	On-Demand	Anodyne	MCHR1	37	45
Cc1ccc(F)c(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)c1	ZINC000450705742	EH	On-Demand	Anodyne	TRPC6	56	39
Cc1ccc(F)c(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)c1	ZINC000450705742	EH	On-Demand	Anodyne	TRPC3	55	39
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cn(C)nc1COC	ZINC000450705749	GE	On-Demand	Anodyne	CCR3	0	47
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cn(C)nc1COC	ZINC000450705750	GE	On-Demand	Anodyne	CCR3	0	47
Cc1csc(NC2CCN(C(=O)CCCC(=O)C3CC3)CC2)n1	ZINC000450705798	EG	On-Demand	Anodyne	TRPC6	47	35
CCc1ccc([C@H](CO)NCc2ccccc2OC2CC2)cc1	ZINC000450705799	DH	On-Demand	Anodyne	SLC5A4	60	45
CCc1ccc([C@@H](CO)NCc2ccccc2OC2CC2)cc1	ZINC000450705800	DH	On-Demand	Anodyne	SLC5A4	60	45
CCCOc1ccc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)c(OC)c1	ZINC000450705803	GH	On-Demand	Anodyne	OXTR	21	41
CCCOc1ccc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)c(OC)c1	ZINC000450705803	GH	On-Demand	Anodyne	TRPC6	48	39
CCOC(=O)COCCNc1cc(CC)nc2ncnn12	ZINC000450705806	CC	On-Demand	Anodyne	DHOD	0	46
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc2n(n1)CCCC2	ZINC000450705808	GF	On-Demand	Anodyne	P2RY12	141	39
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc2n(n1)CCCC2	ZINC000450705808	GF	On-Demand	Anodyne	MC4R	43	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc2n(n1)CCCC2	ZINC000450705809	GF	On-Demand	Anodyne	P2RY12	141	39
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc2n(n1)CCCC2	ZINC000450705809	GF	On-Demand	Anodyne	MC4R	43	40
CN(CCN(C)C1CC1)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450705813	FF	On-Demand	Anodyne	TRPC6	71	40
CN(CCN(C)C1CC1)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450705813	FF	On-Demand	Anodyne	TRPC3	57	40
CN(CCN(C)C1CC1)C(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450705843	FG	On-Demand	Anodyne	PYGL	40	38
CC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705859	FI	On-Demand	Anodyne	DRD4	36	40
CC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705859	FI	On-Demand	Anodyne	SLC6A1	45	34
CC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705859	FI	On-Demand	Anodyne	DRD3	0	44
CC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705859	FI	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705859	FI	On-Demand	Anodyne	CHEK2	27	41
CC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705859	FI	On-Demand	Anodyne	AKT2	91	42
CC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705859	FI	On-Demand	Anodyne	MLNR	47	35
CC(=O)c1ccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705859	FI	On-Demand	Anodyne	AKT1	37	42
CC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705860	FI	On-Demand	Anodyne	DRD4	36	40
CC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705860	FI	On-Demand	Anodyne	SLC6A1	45	34
CC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705860	FI	On-Demand	Anodyne	DRD3	0	44
CC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705860	FI	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705860	FI	On-Demand	Anodyne	CHEK2	27	41
CC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705860	FI	On-Demand	Anodyne	AKT2	91	42
CC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705860	FI	On-Demand	Anodyne	MLNR	47	35
CC(=O)c1ccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)cc1	ZINC000450705860	FI	On-Demand	Anodyne	AKT1	37	42
COc1cc2c(cc1F)CN(Cc1ccn(CC(F)(F)F)n1)CC2	ZINC000450705863	EG	On-Demand	Anodyne	ABCB1B	55	32
COc1cc2c(cc1F)CN(Cc1ccn(CC(F)(F)F)n1)CC2	ZINC000450705863	EG	On-Demand	Anodyne	ABCB1	25	50
c1ccc(-c2nc([C@@H]3CCCN(Cc4cnns4)C3)n[nH]2)cc1	ZINC000450705871	EF	On-Demand	Anodyne	AKT2	59	37
c1ccc(-c2nc([C@H]3CCCN(Cc4cnns4)C3)n[nH]2)cc1	ZINC000450705872	EF	On-Demand	Anodyne	AKT2	59	37
CN1CCN(c2nc3ccccc3nc2N2CC[C@](O)(C(F)F)C2)CC1	ZINC000450705920	FD	On-Demand	Anodyne	HTR3A	32	56
CN1CCN(c2nc3ccccc3nc2N2CC[C@](O)(C(F)F)C2)CC1	ZINC000450705920	FD	On-Demand	Anodyne	HRH4	30	56
CN1CCN(c2nc3ccccc3nc2N2CC[C@@](O)(C(F)F)C2)CC1	ZINC000450705921	FD	On-Demand	Anodyne	HTR3A	32	56
CN1CCN(c2nc3ccccc3nc2N2CC[C@@](O)(C(F)F)C2)CC1	ZINC000450705921	FD	On-Demand	Anodyne	HRH4	30	56
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450705927	EE	On-Demand	Anodyne	DHOD	0	41
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450705928	EE	On-Demand	Anodyne	DHOD	0	41
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450705929	EE	On-Demand	Anodyne	DHOD	0	41
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450705930	EE	On-Demand	Anodyne	DHOD	0	41
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@](O)(C(F)F)C3)nc2)CC1	ZINC000450705931	GC	On-Demand	Anodyne	GCK	59	34
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@](O)(C(F)F)C3)nc2)CC1	ZINC000450705931	GC	On-Demand	Anodyne	GCKR	40	34
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@](O)(C(F)F)C3)nc2)CC1	ZINC000450705932	GC	On-Demand	Anodyne	GCK	59	34
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@](O)(C(F)F)C3)nc2)CC1	ZINC000450705932	GC	On-Demand	Anodyne	GCKR	40	34
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ccnc2cc(Cl)ccc12	ZINC000450705946	DI	On-Demand	Anodyne	HRP1_PLAFA	83	38
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ccnc2cc(Cl)ccc12	ZINC000450705946	DI	On-Demand	Anodyne	HNMT	53	37
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ccnc2cc(Cl)ccc12	ZINC000450705947	DI	On-Demand	Anodyne	HRP1_PLAFA	83	38
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ccnc2cc(Cl)ccc12	ZINC000450705947	DI	On-Demand	Anodyne	HNMT	53	37
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ccnc2cc(Cl)ccc12	ZINC000450705948	DI	On-Demand	Anodyne	HRP1_PLAFA	67	38
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ccnc2cc(Cl)ccc12	ZINC000450705948	DI	On-Demand	Anodyne	HNMT	53	37
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ccnc2cc(Cl)ccc12	ZINC000450705949	DI	On-Demand	Anodyne	HRP1_PLAFA	67	38
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ccnc2cc(Cl)ccc12	ZINC000450705949	DI	On-Demand	Anodyne	HNMT	53	37
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@H]1CC12CCSCC2	ZINC000450706014	GG	On-Demand	Anodyne	TIMP3	43	32
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450706015	GG	On-Demand	Anodyne	TIMP3	43	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450706016	GG	On-Demand	Anodyne	TIMP3	43	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@H]1CC12CCSCC2	ZINC000450706017	GG	On-Demand	Anodyne	TIMP3	43	32
COc1cc(OC)c(C[C@H](C)Nc2ccnc(N3CCOCC3)n2)c(OC)c1	ZINC000450706024	GD	On-Demand	Anodyne	EPHB4	77	37
COc1cc(OC)c(C[C@@H](C)Nc2ccnc(N3CCOCC3)n2)c(OC)c1	ZINC000450706025	GD	On-Demand	Anodyne	EPHB4	77	37
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C1CC(C)(O)C1	ZINC000450706032	EE	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C1CC(C)(O)C1	ZINC000450706033	EE	On-Demand	Anodyne	TIMP3	45	32
O=C(c1cccc2c1CCCC2)N1CCCC2(CC2)C1	ZINC000450706047	CH	On-Demand	Anodyne	FABP4	47	36
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450706052	GH	On-Demand	Anodyne	CTRB_BOVIN	51	39
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450706053	GH	On-Demand	Anodyne	CTRB_BOVIN	51	39
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	DRD4	48	43
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	ACHE	23	46
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	DRD3	23	42
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	HRH3	18	40
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	CCR3	41	41
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	PLD1	49	34
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	SLC18A3	20	40
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	MLNR	46	33
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	CXCR3	33	41
CC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000450706067	DH	On-Demand	Anodyne	MCHR1	29	42
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	DRD4	48	43
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	ACHE	23	46
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	DRD3	23	42
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	HRH3	18	40
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	CCR3	41	41
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	PLD1	49	34
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	SLC18A3	20	40
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	MLNR	46	33
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	CXCR3	33	41
CC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000450706068	DH	On-Demand	Anodyne	MCHR1	29	42
Cc1csc(NC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)n1	ZINC000450706069	FH	On-Demand	Anodyne	EPHX2	15	40
Cc1csc(NC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)n1	ZINC000450706069	FH	On-Demand	Anodyne	SFRP1	51	40
Cc1csc(NC2CCN(C(=O)c3ccc(C(C)(F)F)nc3)CC2)n1	ZINC000450706069	FH	On-Demand	Anodyne	TRPC6	48	36
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC4(CC4)C3)cc2)c1	ZINC000450706080	FH	On-Demand	Anodyne	CHRM3	17	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC4(CC4)C3)cc2)c1	ZINC000450706080	FH	On-Demand	Anodyne	MMP13	15	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCCC4(CC4)C3)cc2)c1	ZINC000450706080	FH	On-Demand	Anodyne	HPGD	16	41
CCn1c(SC2CC(OC(C)(C)C)C2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450706085	GG	On-Demand	Anodyne	CNR2	20	41
F[C@H]1CN(c2ncccc2OCc2ccccc2)C[C@H]1F	ZINC000450706095	CG	On-Demand	Anodyne	PPIA	46	35
O=C(CCCC(=O)N1CCCC2(CC2)C1)C1CC1	ZINC000450706098	BF	On-Demand	Anodyne	PREP	21	40
Cc1csc(NC2CCN(C(=O)C(C)(C)C(C)(F)F)CC2)n1	ZINC000450706099	EH	On-Demand	Anodyne	TRPC6	46	34
O=C(COc1c(F)cccc1F)NCCCN1CCCCCC1=O	ZINC000450706103	EE	On-Demand	Anodyne	TYRO3	26	45
CCOCc1nc(C)c(C(=O)NCc2nc3cc(OC)ccc3n2C)s1	ZINC000450706104	FF	On-Demand	Anodyne	SCD1	37	42
CO[C@@H](CN[C@@H](CO)c1cccc(Br)c1)Cc1ccccc1	ZINC000450706122	FG	On-Demand	Anodyne	PHES	0	40
CO[C@@H](CN[C@H](CO)c1cccc(Br)c1)Cc1ccccc1	ZINC000450706123	FG	On-Demand	Anodyne	PHES	0	40
CO[C@H](CN[C@@H](CO)c1cccc(Br)c1)Cc1ccccc1	ZINC000450706125	FG	On-Demand	Anodyne	PHES	0	40
CO[C@H](CN[C@H](CO)c1cccc(Br)c1)Cc1ccccc1	ZINC000450706127	FG	On-Demand	Anodyne	PHES	0	40
CCc1cc(N2C[C@H](F)[C@H](F)C2)c2ccccc2n1	ZINC000450706145	CG	On-Demand	Anodyne	METAP1	40	34
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(=O)OC)C1	ZINC000450706157	FE	On-Demand	Anodyne	HTR2A	25	43
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(=O)OC)C1	ZINC000450706157	FE	On-Demand	Anodyne	SLC6A3	15	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(=O)OC)C1	ZINC000450706157	FE	On-Demand	Anodyne	HTR3B	0	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(=O)OC)C1	ZINC000450706157	FE	On-Demand	Anodyne	CYP2J2	49	34
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(=O)OC)C1	ZINC000450706158	FE	On-Demand	Anodyne	HTR2A	25	43
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(=O)OC)C1	ZINC000450706158	FE	On-Demand	Anodyne	SLC6A3	15	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(=O)OC)C1	ZINC000450706158	FE	On-Demand	Anodyne	HTR3B	0	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(=O)OC)C1	ZINC000450706158	FE	On-Demand	Anodyne	CYP2J2	49	34
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C(=O)OC)C1	ZINC000450706159	FE	On-Demand	Anodyne	HTR2A	25	43
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C(=O)OC)C1	ZINC000450706159	FE	On-Demand	Anodyne	SLC6A3	15	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C(=O)OC)C1	ZINC000450706159	FE	On-Demand	Anodyne	HTR3B	0	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C(=O)OC)C1	ZINC000450706159	FE	On-Demand	Anodyne	CYP2J2	49	34
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706160	FE	On-Demand	Anodyne	HTR2A	25	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706160	FE	On-Demand	Anodyne	SLC6A3	15	44
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706160	FE	On-Demand	Anodyne	HTR3B	0	40
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706160	FE	On-Demand	Anodyne	CYP2J2	49	34
COc1cc(CC(=O)NCC2(CO)CCCC2)ccc1Cl	ZINC000450706168	DF	On-Demand	Anodyne	TRPV1	26	43
COc1cc(CC(=O)NCC2(CO)CCCC2)ccc1Cl	ZINC000450706168	DF	On-Demand	Anodyne	NCE103	32	46
COc1cc(CC(=O)NCC2(CO)CCCC2)ccc1Cl	ZINC000450706168	DF	On-Demand	Anodyne	CAN2	0	46
F[C@H]1CN(c2ccnc(N3CCOCC3)n2)C[C@H]1F	ZINC000450706177	CC	On-Demand	Anodyne	SORD	23	40
F[C@H]1CN(c2ccnc(N3CCOCC3)n2)C[C@H]1F	ZINC000450706177	CC	On-Demand	Anodyne	SMG1	42	34
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450706190	GJ	On-Demand	Anodyne	MC4R	24	41
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450706190	GJ	On-Demand	Anodyne	SLC12A5	49	35
O=C(c1cnc(C2CC2)nc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450706192	FF	On-Demand	Anodyne	GRM5	0	45
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(O)c(OC)c1)n2C	ZINC000450706197	FE	On-Demand	Anodyne	PDGFRB	41	36
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(O)c(OC)c1)n2C	ZINC000450706197	FE	On-Demand	Anodyne	TRPV1	23	52
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(O)c(OC)c1)n2C	ZINC000450706197	FE	On-Demand	Anodyne	MTNR1A	52	39
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(O)c(OC)c1)n2C	ZINC000450706197	FE	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(O)c(OC)c1)n2C	ZINC000450706197	FE	On-Demand	Anodyne	CA9	16	41
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(O)c(OC)c1)n2C	ZINC000450706197	FE	On-Demand	Anodyne	NCE103	25	40
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(O)c(OC)c1)n2C	ZINC000450706197	FE	On-Demand	Anodyne	CAN2	0	40
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	PDE5A	0	40
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	HTR1A	32	43
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	DRD4	43	34
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	HTR1D	23	40
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	HTR1B	24	40
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	HTR2A	35	40
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	HTR2C	27	40
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	HTR7	25	41
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	PRNP	60	48
CCc1cccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)n1	ZINC000450706199	EG	On-Demand	Anodyne	KCNK3	53	37
FC1(F)CC[C@@H](CN2CC[C@H](COc3ccccc3)C2)C1	ZINC000450706211	CH	On-Demand	Anodyne	SIGMAR1	29	59
FC1(F)CC[C@@H](CN2CC[C@H](COc3ccccc3)C2)C1	ZINC000450706211	CH	On-Demand	Anodyne	CHRNA10	44	38
COc1cc(-c2noc(CN3CCc4cc(OC)c(F)cc4C3)n2)ncn1	ZINC000450706215	FE	On-Demand	Anodyne	ABCB1B	50	31
COc1ncc(CNc2ncnc3sc(C)c(C)c23)cc1Cl	ZINC000450706219	EH	On-Demand	Anodyne	PDE6A	42	32
COc1cc2c(cc1F)CN(Cc1cnn[nH]1)CC2	ZINC000450706228	CD	On-Demand	Anodyne	ABCB1B	58	33
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	DRD2	22	43
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	DRD3	16	40
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	ADRA2B	0	43
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	ADRA2C	15	43
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	ABCB1B	66	42
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	ABCB1	33	50
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	HCRTR2	19	45
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	ABCG2	38	41
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	NOD1	29	40
COc1cc2c(cc1F)CN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450706229	DH	On-Demand	Anodyne	NOD2	44	40
COc1ncc(CN=c2cc(C(=O)NC3CC3)c3ccccc3[nH]2)cc1Cl	ZINC000450706236	GG	On-Demand	Anodyne	DRD3	0	41
CN(CCN(C)C1CC1)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450706239	ED	On-Demand	Anodyne	LIMK2	40	40
COc1ccc(-c2n[nH]c(SCCCCCC(C)=O)n2)cc1	ZINC000450706249	DH	On-Demand	Anodyne	SOAT1	21	47
CO[C@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706256	FE	On-Demand	Anodyne	EGFR	42	36
CO[C@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706256	FE	On-Demand	Anodyne	EPHA2	42	35
CO[C@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706256	FE	On-Demand	Anodyne	CLK2	15	43
CO[C@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706256	FE	On-Demand	Anodyne	CLK4	24	43
CO[C@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706256	FE	On-Demand	Anodyne	DYRK1B	15	43
CO[C@@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706257	FE	On-Demand	Anodyne	EGFR	42	36
CO[C@@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706257	FE	On-Demand	Anodyne	EPHA2	42	35
CO[C@@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706257	FE	On-Demand	Anodyne	CLK2	15	43
CO[C@@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706257	FE	On-Demand	Anodyne	CLK4	24	43
CO[C@@H]1COCC[C@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706257	FE	On-Demand	Anodyne	DYRK1B	15	43
CO[C@@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706258	FE	On-Demand	Anodyne	EGFR	42	36
CO[C@@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706258	FE	On-Demand	Anodyne	EPHA2	42	35
CO[C@@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706258	FE	On-Demand	Anodyne	CLK2	15	43
CO[C@@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706258	FE	On-Demand	Anodyne	CLK4	24	43
CO[C@@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706258	FE	On-Demand	Anodyne	DYRK1B	15	43
CO[C@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706259	FE	On-Demand	Anodyne	EGFR	42	36
CO[C@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706259	FE	On-Demand	Anodyne	EPHA2	42	35
CO[C@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706259	FE	On-Demand	Anodyne	CLK2	15	43
CO[C@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706259	FE	On-Demand	Anodyne	CLK4	24	43
CO[C@H]1COCC[C@@H]1CNc1ncnc2cc(Br)ccc12	ZINC000450706259	FE	On-Demand	Anodyne	DYRK1B	15	43
Cc1nc(C)n(CCCC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)n1	ZINC000450706260	EE	On-Demand	Anodyne	ACER2	0	42
Cc1nc(C)n(CCCC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)n1	ZINC000450706261	EE	On-Demand	Anodyne	ACER2	0	42
Cc1nc(C)n(CCCC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)n1	ZINC000450706262	EE	On-Demand	Anodyne	ACER2	0	42
Cc1nc(C)n(CCCC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)n1	ZINC000450706263	EE	On-Demand	Anodyne	ACER2	0	42
CO[C@@H]1COCC[C@H]1CNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000450706282	EE	On-Demand	Bother	PRKCQ	44	35
CO[C@H]1COCC[C@@H]1CNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000450706283	EE	On-Demand	Bother	PRKCQ	44	35
CO[C@H]1COCC[C@H]1CNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000450706284	EE	On-Demand	Bother	PRKCQ	44	35
CO[C@@H]1COCC[C@@H]1CNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000450706285	EE	On-Demand	Bother	PRKCQ	44	35
Cc1cccc(Cl)c1CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450706299	GJ	On-Demand	Anodyne	OPRM1	19	42
Cc1cccc(Cl)c1CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450706299	GJ	On-Demand	Anodyne	OPRD1	17	42
Cc1cccc(Cl)c1CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2	ZINC000450706299	GJ	On-Demand	Anodyne	KCNH2	35	40
COc1cc(OC)c2ncnc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)c2c1	ZINC000450706330	EF	On-Demand	Anodyne	PDE3B	56	33
COc1cc(OC)c2ncnc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)c2c1	ZINC000450706331	EF	On-Demand	Anodyne	PDE3B	56	33
COc1cc(OC)c2ncnc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)c2c1	ZINC000450706332	EF	On-Demand	Anodyne	PDE3B	56	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)CSC1CC1	ZINC000450706333	EF	On-Demand	Anodyne	TIMP3	58	32
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)CSC1CC1	ZINC000450706334	EF	On-Demand	Anodyne	TIMP3	58	32
COc1cc(OC)c2ncnc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)c2c1	ZINC000450706335	EF	On-Demand	Anodyne	PDE3B	56	33
C[C@H](O)CCCN1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450706341	FD	On-Demand	Anodyne	HTR1A	28	42
C[C@H](O)CCCN1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450706341	FD	On-Demand	Anodyne	SIGMAR1	46	42
C[C@H](O)CCCN1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450706343	FD	On-Demand	Anodyne	HTR1A	28	42
C[C@H](O)CCCN1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450706343	FD	On-Demand	Anodyne	SIGMAR1	46	42
C[C@@H](O)CCCN1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450706345	FD	On-Demand	Anodyne	HTR1A	28	42
C[C@@H](O)CCCN1CCN([C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450706345	FD	On-Demand	Anodyne	SIGMAR1	46	42
C[C@@H](O)CCCN1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450706347	FD	On-Demand	Anodyne	HTR1A	28	42
C[C@@H](O)CCCN1CCN([C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000450706347	FD	On-Demand	Anodyne	SIGMAR1	46	42
Cc1csc(NC2CCN(C(=O)[C@@H]3C[C@H]3CC(C)C)CC2)n1	ZINC000450706354	DH	On-Demand	Anodyne	NPBWR1	48	31
COc1ccc(CNC(=O)CCN[C@H](CO)c2ccc(F)cc2)c(OC)c1	ZINC000450706378	GE	On-Demand	Anodyne	MTNR1A	49	37
COc1ccc(CNC(=O)CCN[C@@H](CO)c2ccc(F)cc2)c(OC)c1	ZINC000450706382	GE	On-Demand	Anodyne	MTNR1A	49	37
CCOC(=O)C1(CNC(=O)c2cc3n(n2)CCC3)CC1	ZINC000450706399	CC	On-Demand	Anodyne	HCN1	44	33
CS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c(F)c1	ZINC000450706418	EE	On-Demand	Anodyne	SLC6A9	34	47
CS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c(F)c1	ZINC000450706419	EE	On-Demand	Anodyne	SLC6A9	34	47
CS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)c(F)c1	ZINC000450706420	EE	On-Demand	Anodyne	SLC6A9	34	47
CS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c(F)c1	ZINC000450706421	EE	On-Demand	Anodyne	SLC6A9	34	47
Cc1cc(NCCc2scnc2C)nc(-c2ccccn2)n1	ZINC000450706436	DF	On-Demand	Anodyne	METAP1	23	43
Cc1csc(NC2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)n1	ZINC000450706457	FG	On-Demand	Anodyne	P2RY12	59	39
Cc1csc(NC2CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)CC2)n1	ZINC000450706457	FG	On-Demand	Anodyne	TRPC6	44	33
Cc1csc(NC2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)n1	ZINC000450706458	FG	On-Demand	Anodyne	P2RY12	59	39
Cc1csc(NC2CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)CC2)n1	ZINC000450706458	FG	On-Demand	Anodyne	TRPC6	44	33
CN(CCN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1)Cc1ccccc1	ZINC000450706461	GE	On-Demand	Anodyne	SLC6A1	59	34
CN(CCN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1)Cc1ccccc1	ZINC000450706461	GE	On-Demand	Anodyne	SIGMAR1	24	43
CN(CCN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1)Cc1ccccc1	ZINC000450706461	GE	On-Demand	Anodyne	BIRC2	45	39
CN(CCN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1)Cc1ccccc1	ZINC000450706462	GE	On-Demand	Anodyne	SLC6A1	59	34
CN(CCN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1)Cc1ccccc1	ZINC000450706462	GE	On-Demand	Anodyne	SIGMAR1	24	43
CN(CCN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1)Cc1ccccc1	ZINC000450706462	GE	On-Demand	Anodyne	BIRC2	45	39
OC[C@@H](NC[C@@H]1COCCO1)c1cccc(F)c1	ZINC000450706481	CC	On-Demand	Anodyne	MAN1	0	41
OC[C@H](NC[C@@H]1COCCO1)c1cccc(F)c1	ZINC000450706482	CC	On-Demand	Anodyne	MAN1	0	41
OC[C@@H](NC[C@H]1COCCO1)c1cccc(F)c1	ZINC000450706483	CC	On-Demand	Anodyne	MAN1	0	41
OC[C@H](NC[C@H]1COCCO1)c1cccc(F)c1	ZINC000450706484	CC	On-Demand	Anodyne	MAN1	0	41
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1ccc(C#N)n1C	ZINC000450706485	FE	On-Demand	Mild	CTSV	43	30
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1ccc(C#N)n1C	ZINC000450706485	FE	On-Demand	Mild	CTRB_BOVIN	49	38
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1ccc(C#N)n1C	ZINC000450706486	FE	On-Demand	Mild	CTSV	43	30
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1ccc(C#N)n1C	ZINC000450706486	FE	On-Demand	Mild	CTRB_BOVIN	49	38
Fc1cccc(-c2nnn(C[C@H]3CCCCC3(F)F)n2)c1	ZINC000450706487	CG	On-Demand	Anodyne	SCARB1	44	46
Fc1cccc(-c2nnn(C[C@@H]3CCCCC3(F)F)n2)c1	ZINC000450706488	CG	On-Demand	Anodyne	SCARB1	44	46
Cc1csc(NC2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)CC2)n1	ZINC000450706507	FH	On-Demand	Anodyne	TRPC6	49	37
FC1(F)CC[C@H](CN2CC[C@H](COc3ccccc3)C2)C1	ZINC000450706512	CH	On-Demand	Anodyne	SIGMAR1	29	59
FC1(F)CC[C@H](CN2CC[C@H](COc3ccccc3)C2)C1	ZINC000450706512	CH	On-Demand	Anodyne	CHRNA10	44	38
FC1(F)CC[C@@H](CN2CC[C@@H](COc3ccccc3)C2)C1	ZINC000450706513	CH	On-Demand	Anodyne	SIGMAR1	29	59
FC1(F)CC[C@@H](CN2CC[C@@H](COc3ccccc3)C2)C1	ZINC000450706513	CH	On-Demand	Anodyne	CHRNA10	44	38
FC1(F)CC[C@H](CN2CC[C@@H](COc3ccccc3)C2)C1	ZINC000450706514	CH	On-Demand	Anodyne	SIGMAR1	29	59
FC1(F)CC[C@H](CN2CC[C@@H](COc3ccccc3)C2)C1	ZINC000450706514	CH	On-Demand	Anodyne	CHRNA10	44	38
O=C(NCC1(CO)CCCC1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450706520	DG	On-Demand	Anodyne	SCN9A	0	40
O=C(NCC1(CO)CCCC1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450706521	DG	On-Demand	Anodyne	SCN9A	0	40
O=C(NCC1(CO)CCCC1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450706522	DG	On-Demand	Anodyne	SCN9A	0	40
O=C(NCC1(CO)CCCC1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450706523	DG	On-Demand	Anodyne	SCN9A	0	40
O=C(Nc1ccc(Br)cc1)c1cccnc1N1C[C@H](F)[C@H](F)C1	ZINC000450706528	GH	On-Demand	Anodyne	TRPV1	23	49
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1)n2C	ZINC000450706535	EG	On-Demand	Anodyne	MTNR1B	25	42
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1)n2C	ZINC000450706535	EG	On-Demand	Anodyne	GIP	0	40
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1)n2C	ZINC000450706535	EG	On-Demand	Anodyne	GCG	0	40
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1)n2C	ZINC000450706536	EG	On-Demand	Anodyne	MTNR1B	25	42
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1)n2C	ZINC000450706536	EG	On-Demand	Anodyne	GIP	0	40
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1)n2C	ZINC000450706536	EG	On-Demand	Anodyne	GCG	0	40
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1)n2C	ZINC000450706537	EG	On-Demand	Anodyne	MTNR1B	25	42
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1)n2C	ZINC000450706537	EG	On-Demand	Anodyne	GIP	0	40
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1)n2C	ZINC000450706537	EG	On-Demand	Anodyne	GCG	0	40
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1)n2C	ZINC000450706538	EG	On-Demand	Anodyne	MTNR1B	25	42
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1)n2C	ZINC000450706538	EG	On-Demand	Anodyne	GIP	0	40
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1)n2C	ZINC000450706538	EG	On-Demand	Anodyne	GCG	0	40
Fc1ccc(-c2csc3ncnc(N4C[C@H](F)[C@H](F)C4)c23)cc1	ZINC000450706540	EH	On-Demand	Anodyne	ADRB3	0	42
COc1ccc(Nc2cc(N3C[C@H](F)[C@H](F)C3)ncn2)c(OC)c1	ZINC000450706541	EF	On-Demand	Anodyne	GALR2	43	35
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	DRD4	44	44
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	ACHE	37	49
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	HRH1	26	46
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	DRD3	15	43
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	AVPR1B	49	40
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	HTR4	63	45
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	SIGMAR1	48	46
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	SSTR5	69	43
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	CCR3	49	43
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	CCR5	18	40
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	UTS2R	31	41
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	MCHR1	42	46
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	CACNA1G	21	40
COc1cc(CN2CCC(CC(=O)N(C)C)CC2)ccc1Cl	ZINC000450706549	DG	On-Demand	Anodyne	CACNA1I	44	42
CCOc1nc2ccc(C(=O)NCC3(CO)CCCC3)cc2[nH]1	ZINC000450706553	DE	On-Demand	Anodyne	HCN1	43	33
CCOc1nc2ccc(C(=O)NCC3(CO)CCCC3)cc2[nH]1	ZINC000450706553	DE	On-Demand	Anodyne	HCN4	43	33
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@H](C)O)C2)c(OC)c1	ZINC000450706556	ED	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@H](C)O)C2)c(OC)c1	ZINC000450706556	ED	On-Demand	Anodyne	MTNR1A	58	42
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@H](C)O)C2)c(OC)c1	ZINC000450706556	ED	On-Demand	Anodyne	MTNR1B	44	40
COc1ccc(CNC(=O)CCN2CC[C@H]([C@@H](C)O)C2)c(OC)c1	ZINC000450706557	ED	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CC[C@H]([C@@H](C)O)C2)c(OC)c1	ZINC000450706557	ED	On-Demand	Anodyne	MTNR1A	58	42
COc1ccc(CNC(=O)CCN2CC[C@H]([C@@H](C)O)C2)c(OC)c1	ZINC000450706557	ED	On-Demand	Anodyne	MTNR1B	44	40
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@@H](C)O)C2)c(OC)c1	ZINC000450706558	ED	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@@H](C)O)C2)c(OC)c1	ZINC000450706558	ED	On-Demand	Anodyne	MTNR1A	58	42
COc1ccc(CNC(=O)CCN2CC[C@@H]([C@@H](C)O)C2)c(OC)c1	ZINC000450706558	ED	On-Demand	Anodyne	MTNR1B	44	40
COc1ccc(CNC(=O)CCN2CC[C@H]([C@H](C)O)C2)c(OC)c1	ZINC000450706559	ED	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CC[C@H]([C@H](C)O)C2)c(OC)c1	ZINC000450706559	ED	On-Demand	Anodyne	MTNR1A	58	42
COc1ccc(CNC(=O)CCN2CC[C@H]([C@H](C)O)C2)c(OC)c1	ZINC000450706559	ED	On-Demand	Anodyne	MTNR1B	44	40
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450706566	GG	On-Demand	Anodyne	SLC12A5	43	33
C[C@H](OCCc1ccccc1)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450706567	GG	On-Demand	Anodyne	SLC12A5	43	33
CCOC(=O)c1cc(C(=O)NCC2(CO)CCCC2)on1	ZINC000450706587	CD	On-Demand	Anodyne	HCN1	51	32
CCOC(=O)c1cc(C(=O)NCC2(CO)CCCC2)on1	ZINC000450706587	CD	On-Demand	Anodyne	HCN4	49	32
CCOC(=O)C1(CNC(=O)c2ccccc2-n2ccc(C)n2)CC1	ZINC000450706588	EE	On-Demand	Anodyne	HCN1	65	36
CCOC(=O)C1(CNC(=O)c2ccccc2-n2ccc(C)n2)CC1	ZINC000450706588	EE	On-Demand	Anodyne	HCN4	54	37
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450706590	FF	On-Demand	Anodyne	SLC12A5	53	34
CO[C@H](Cc1ccccc1)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450706591	FF	On-Demand	Anodyne	SLC12A5	53	34
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NCC2(CO)CCCC2)cc1OC	ZINC000450706603	GD	On-Demand	Anodyne	NMBR	74	41
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)NCC2(CO)CCCC2)cc1OC	ZINC000450706603	GD	On-Demand	Anodyne	GRPR	42	41
CCCc1nc(C)c(COc2ccc(Cl)cc2F)o1	ZINC000450706605	CI	On-Demand	Anodyne	S1PR4	0	42
COc1ccc(CNC(=O)CCN2CCC(CC(=O)N(C)C)CC2)c(OC)c1	ZINC000450706607	GD	On-Demand	Anodyne	AVPR1B	45	32
COc1ccc(CNC(=O)CCN2CCC(CC(=O)N(C)C)CC2)c(OC)c1	ZINC000450706607	GD	On-Demand	Anodyne	HTR4	47	38
COc1ccc(CNC(=O)CCN2CCC(CC(=O)N(C)C)CC2)c(OC)c1	ZINC000450706607	GD	On-Demand	Anodyne	HTR7	28	41
COc1ccc(CNC(=O)CCN2CCC(CC(=O)N(C)C)CC2)c(OC)c1	ZINC000450706607	GD	On-Demand	Anodyne	MTNR1A	43	36
CO[C@H]1COCC[C@@H]1CNc1ccnc2cc(F)c(Br)cc12	ZINC000450706636	FH	On-Demand	Anodyne	HRP1_PLAFA	68	32
CO[C@@H]1COCC[C@H]1CNc1ccnc2cc(F)c(Br)cc12	ZINC000450706637	FH	On-Demand	Anodyne	HRP1_PLAFA	68	32
CO[C@H]1COCC[C@H]1CNc1ccnc2cc(F)c(Br)cc12	ZINC000450706638	FH	On-Demand	Anodyne	HRP1_PLAFA	68	32
CO[C@@H]1COCC[C@@H]1CNc1ccnc2cc(F)c(Br)cc12	ZINC000450706639	FH	On-Demand	Anodyne	HRP1_PLAFA	68	32
COC(=O)[C@@H]1C[C@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706641	EE	On-Demand	Anodyne	DRD4	18	44
COC(=O)[C@@H]1C[C@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706641	EE	On-Demand	Anodyne	HTR2A	17	42
COC(=O)[C@@H]1C[C@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706641	EE	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706642	EE	On-Demand	Anodyne	DRD4	18	44
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706642	EE	On-Demand	Anodyne	HTR2A	17	42
COC(=O)[C@@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706642	EE	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@H]1C[C@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706643	EE	On-Demand	Anodyne	DRD4	18	44
COC(=O)[C@H]1C[C@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706643	EE	On-Demand	Anodyne	HTR2A	17	42
COC(=O)[C@H]1C[C@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706643	EE	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)[C@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706644	EE	On-Demand	Anodyne	DRD4	18	44
COC(=O)[C@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706644	EE	On-Demand	Anodyne	HTR2A	17	42
COC(=O)[C@H]1C[C@@H](OC)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450706644	EE	On-Demand	Anodyne	CYP2J2	48	34
CC(=O)c1cccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706657	FI	On-Demand	Anodyne	DRD2	16	44
CC(=O)c1cccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706657	FI	On-Demand	Anodyne	DRD4	33	41
CC(=O)c1cccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706657	FI	On-Demand	Anodyne	SLC6A1	41	34
CC(=O)c1cccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706657	FI	On-Demand	Anodyne	DRD3	0	44
CC(=O)c1cccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706657	FI	On-Demand	Anodyne	CHRM3	19	40
CC(=O)c1cccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706657	FI	On-Demand	Anodyne	AKT2	72	41
CC(=O)c1cccc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706657	FI	On-Demand	Anodyne	AKT1	32	41
CC(=O)c1cccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706658	FI	On-Demand	Anodyne	DRD2	16	44
CC(=O)c1cccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706658	FI	On-Demand	Anodyne	DRD4	33	41
CC(=O)c1cccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706658	FI	On-Demand	Anodyne	SLC6A1	41	34
CC(=O)c1cccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706658	FI	On-Demand	Anodyne	DRD3	0	44
CC(=O)c1cccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706658	FI	On-Demand	Anodyne	CHRM3	19	40
CC(=O)c1cccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706658	FI	On-Demand	Anodyne	AKT2	72	41
CC(=O)c1cccc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c1	ZINC000450706658	FI	On-Demand	Anodyne	AKT1	32	41
CO[C@H]1COCC[C@@H]1CNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450706663	DE	On-Demand	Bother	PRKCQ	46	36
CO[C@@H]1COCC[C@@H]1CNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450706664	DE	On-Demand	Bother	PRKCQ	46	36
CO[C@@H]1COCC[C@H]1CNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450706665	DE	On-Demand	Bother	PRKCQ	46	36
CO[C@H]1COCC[C@H]1CNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450706666	DE	On-Demand	Bother	PRKCQ	46	36
CCS(=O)(=O)c1ccc(CN2CCc3cc(OC)c(F)cc3C2)cc1	ZINC000450706670	FG	On-Demand	Anodyne	ABCB1B	61	36
CCS(=O)(=O)c1ccc(CN2CCc3cc(OC)c(F)cc3C2)cc1	ZINC000450706670	FG	On-Demand	Anodyne	ABCB1	24	56
CCS(=O)(=O)c1ccc(CN2CCc3cc(OC)c(F)cc3C2)cc1	ZINC000450706670	FG	On-Demand	Anodyne	ABCG2	34	42
CCS(=O)(=O)c1ccc(CN2CCc3cc(OC)c(F)cc3C2)cc1	ZINC000450706670	FG	On-Demand	Anodyne	NOD2	42	37
COc1cc(CC(=O)N[C@H](CO)c2ccsc2)ccc1O	ZINC000450706673	DD	On-Demand	Anodyne	TRPV1	36	46
COc1cc(CC(=O)N[C@H](CO)c2ccsc2)ccc1O	ZINC000450706673	DD	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@@H](CO)c2ccsc2)ccc1O	ZINC000450706674	DD	On-Demand	Anodyne	TRPV1	36	46
COc1cc(CC(=O)N[C@@H](CO)c2ccsc2)ccc1O	ZINC000450706674	DD	On-Demand	Anodyne	NCE103	22	41
FC1(F)CC[C@@H](CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)C1	ZINC000450706679	EI	On-Demand	Anodyne	AKT2	40	34
FC1(F)CC[C@H](CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)C1	ZINC000450706680	EI	On-Demand	Anodyne	AKT2	40	34
FC1(F)CC[C@H](CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)C1	ZINC000450706681	EI	On-Demand	Anodyne	AKT2	40	34
FC1(F)CC[C@@H](CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)C1	ZINC000450706682	EI	On-Demand	Anodyne	AKT2	40	34
COC(=O)c1coc(CN2CCc3cc(OC)c(F)cc3C2)n1	ZINC000450706699	DE	On-Demand	Anodyne	ABCB1B	59	35
COC(=O)c1coc(CN2CCc3cc(OC)c(F)cc3C2)n1	ZINC000450706699	DE	On-Demand	Anodyne	ABCG2	35	43
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	HTR1A	72	44
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	DRD2	56	44
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	DRD1	25	44
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	DRD4	43	38
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	HTR2A	30	41
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	ADRA1A	28	44
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	DRD3	76	44
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	HTR7	50	42
COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706712	GF	On-Demand	Anodyne	HCN1	40	37
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	HTR1A	72	44
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	DRD2	56	44
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	DRD1	25	44
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	DRD4	43	38
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	HTR2A	30	41
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	ADRA1A	28	44
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	DRD3	76	44
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	HTR7	50	42
COc1ccccc1Oc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)nc1	ZINC000450706713	GF	On-Demand	Anodyne	HCN1	40	37
COc1ccc(OC(F)(F)F)c(C(=O)N2CCCC3(CC3)C2)c1	ZINC000450706714	EH	On-Demand	Anodyne	EPHX2	29	43
COC(=O)C[C@@H](NC(=O)[C@H]1CC1(F)F)c1ccc2ccccc2c1	ZINC000450706715	EG	On-Demand	Anodyne	UTS2	32	41
COC(=O)C[C@@H](NC(=O)[C@@H]1CC1(F)F)c1ccc2ccccc2c1	ZINC000450706716	EG	On-Demand	Anodyne	UTS2	32	41
COC(=O)C[C@H](NC(=O)c1cc2n(n1)CCCC2)c1ccc2ccccc2c1	ZINC000450706717	GG	On-Demand	Anodyne	CTSA	47	35
COC(=O)C[C@@H](NC(=O)c1cc2n(n1)CCCC2)c1ccc2ccccc2c1	ZINC000450706718	GG	On-Demand	Anodyne	CTSA	47	35
COCc1nn(C)cc1C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450706744	GF	On-Demand	Anodyne	PTGER3	40	36
COCc1nn(C)cc1C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450706744	GF	On-Demand	Anodyne	CYP26A1	40	34
COCc1nn(C)cc1C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450706744	GF	On-Demand	Anodyne	UTS2	47	43
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1ccsn1	ZINC000450706766	EF	On-Demand	Anodyne	CCR3	0	48
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1ccsn1	ZINC000450706767	EF	On-Demand	Anodyne	CCR3	0	48
Cc1csc(NC2CCN(C(=O)[C@@H]3C[C@H]3C(F)(F)F)CC2)n1	ZINC000450706769	EG	On-Demand	Anodyne	TRPC6	44	33
O=C(CC[C@@H]1CCCCO1)CSc1nnc(O)n1C[C@@H]1CCCO1	ZINC000450706816	FE	On-Demand	Anodyne	PDE8B	40	34
O=C(CC[C@H]1CCCCO1)CSc1nnc(O)n1C[C@@H]1CCCO1	ZINC000450706818	FE	On-Demand	Anodyne	PDE8B	40	34
O=C(CC[C@@H]1CCCCO1)CSc1nnc(O)n1C[C@H]1CCCO1	ZINC000450706820	FE	On-Demand	Anodyne	PDE8B	40	34
O=C(CC[C@H]1CCCCO1)CSc1nnc(O)n1C[C@H]1CCCO1	ZINC000450706822	FE	On-Demand	Anodyne	PDE8B	40	34
Cc1cccc(CN2CCN([C@@H]3CCCN(Cc4ccccc4)C3=O)CC2)n1	ZINC000450706824	GF	On-Demand	Anodyne	DRD4	23	41
Cc1cccc(CN2CCN([C@@H]3CCCN(Cc4ccccc4)C3=O)CC2)n1	ZINC000450706824	GF	On-Demand	Anodyne	SCN5A	23	43
Cc1cccc(CN2CCN([C@H]3CCCN(Cc4ccccc4)C3=O)CC2)n1	ZINC000450706826	GF	On-Demand	Anodyne	DRD4	23	41
Cc1cccc(CN2CCN([C@H]3CCCN(Cc4ccccc4)C3=O)CC2)n1	ZINC000450706826	GF	On-Demand	Anodyne	SCN5A	23	43
COc1ccc(CNC(=O)CCN[C@H](CO)C(C)C)c(OC)c1	ZINC000450706834	DD	On-Demand	Anodyne	MTNR1A	51	37
Cc1csc(NC2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)n1	ZINC000450706857	FH	On-Demand	Anodyne	L3MBTL3	45	34
Cc1csc(NC2CCN(C(=O)c3ccc(C)c4c3CCC4)CC2)n1	ZINC000450706857	FH	On-Demand	Anodyne	TRPC6	58	38
CCC(=O)CCCN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450706895	EH	On-Demand	Anodyne	RBP4	80	39
CCC(=O)CCCN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450706895	EH	On-Demand	Anodyne	CYP2J2	46	32
CCC(=O)CCCN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450706896	EH	On-Demand	Anodyne	RBP4	80	39
CCC(=O)CCCN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450706896	EH	On-Demand	Anodyne	CYP2J2	46	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)CCCn1nc(C)nc1C	ZINC000450706897	GF	On-Demand	Anodyne	HDA106	0	41
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)CCCn1nc(C)nc1C	ZINC000450706898	GF	On-Demand	Anodyne	HDA106	0	41
CCOC(=O)C1(CNC(=O)c2cc3ccncc3s2)CC1	ZINC000450706930	DE	On-Demand	Anodyne	SELE	61	37
CCOC(=O)C1(CNC(=O)c2cc3ccncc3s2)CC1	ZINC000450706930	DE	On-Demand	Anodyne	VCAM1	46	37
Cc1cc(OCc2nnc(C3CC3)s2)ccc1[N+](=O)[O-]	ZINC000450706943	CG	On-Demand	Bother	MAOA	31	41
CN1CCN(S(=O)(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)nc2)CC1	ZINC000450706952	EC	On-Demand	Anodyne	GCK	60	34
CN1CCN(S(=O)(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)nc2)CC1	ZINC000450706952	EC	On-Demand	Anodyne	GCKR	70	39
COc1cc2c(cc1F)CN(C[C@](C)(O)C(C)=O)CC2	ZINC000450706958	CD	On-Demand	Anodyne	ABCB1B	59	35
COc1cc2c(cc1F)CN(C[C@](C)(O)C(C)=O)CC2	ZINC000450706958	CD	On-Demand	Anodyne	ABCB1	26	44
COc1cc2c(cc1F)CN(C[C@@](C)(O)C(C)=O)CC2	ZINC000450706960	CD	On-Demand	Anodyne	ABCB1B	59	35
COc1cc2c(cc1F)CN(C[C@@](C)(O)C(C)=O)CC2	ZINC000450706960	CD	On-Demand	Anodyne	ABCB1	26	44
C[C@H](O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450706982	CD	On-Demand	Anodyne	OPRK1	28	41
C[C@H](O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450706982	CD	On-Demand	Anodyne	SLC18A3	15	42
C[C@H](O)[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450706984	CD	On-Demand	Anodyne	OPRK1	28	41
C[C@H](O)[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450706984	CD	On-Demand	Anodyne	SLC18A3	15	42
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450706985	FE	On-Demand	Anodyne	NPBWR1	81	37
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@@H]([C@H](C)O)C1	ZINC000450706986	CD	On-Demand	Anodyne	OPRK1	28	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@@H]([C@H](C)O)C1	ZINC000450706986	CD	On-Demand	Anodyne	SLC18A3	15	42
C[C@@H](c1ccccc1)[C@H](O)CN1CC[C@@H]([C@H](C)O)C1	ZINC000450706988	CD	On-Demand	Anodyne	OPRK1	28	41
C[C@@H](c1ccccc1)[C@H](O)CN1CC[C@@H]([C@H](C)O)C1	ZINC000450706988	CD	On-Demand	Anodyne	SLC18A3	15	42
c1nc(CCN2CCC(CCCN3CCOCC3)CC2)cs1	ZINC000450706996	DF	On-Demand	Anodyne	NPY1R	40	34
CC(=O)c1cccc(CN(C)CCN(C(C)C)C(C)C)c1	ZINC000450706998	CG	On-Demand	Anodyne	HSD17B2	20	40
C[C@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707007	BE	On-Demand	Anodyne	DRD2	0	57
C[C@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707007	BE	On-Demand	Anodyne	SLC6A4	18	43
C[C@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707007	BE	On-Demand	Anodyne	HTR4	42	40
C[C@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707007	BE	On-Demand	Anodyne	LTA4H	34	42
C[C@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707007	BE	On-Demand	Anodyne	SIGMAR1	42	57
C[C@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707007	BE	On-Demand	Anodyne	CHRNA10	63	47
CC[C@@](C)(CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])OC	ZINC000450707008	GD	On-Demand	Bother	BDKRB1	0	49
CC[C@@](C)(CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])OC	ZINC000450707008	GD	On-Demand	Bother	BCL2L1	71	37
CC[C@@](C)(CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])OC	ZINC000450707008	GD	On-Demand	Bother	BCL2	51	31
C[C@@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707009	BE	On-Demand	Anodyne	DRD2	0	57
C[C@@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707009	BE	On-Demand	Anodyne	SLC6A4	18	43
C[C@@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707009	BE	On-Demand	Anodyne	HTR4	42	40
C[C@@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707009	BE	On-Demand	Anodyne	LTA4H	34	42
C[C@@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707009	BE	On-Demand	Anodyne	SIGMAR1	42	57
C[C@@H](O)CCN1CC[C@H](COc2ccccc2)C1	ZINC000450707009	BE	On-Demand	Anodyne	CHRNA10	63	47
CC[C@](C)(CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])OC	ZINC000450707015	GD	On-Demand	Bother	BDKRB1	0	49
CC[C@](C)(CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])OC	ZINC000450707015	GD	On-Demand	Bother	BCL2L1	71	37
CC[C@](C)(CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])OC	ZINC000450707015	GD	On-Demand	Bother	BCL2	51	31
C[C@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707030	BE	On-Demand	Anodyne	DRD2	0	57
C[C@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707030	BE	On-Demand	Anodyne	SLC6A4	18	43
C[C@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707030	BE	On-Demand	Anodyne	HTR4	42	40
C[C@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707030	BE	On-Demand	Anodyne	LTA4H	34	42
C[C@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707030	BE	On-Demand	Anodyne	SIGMAR1	42	57
C[C@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707030	BE	On-Demand	Anodyne	CHRNA10	63	47
C[C@@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707031	BE	On-Demand	Anodyne	DRD2	0	57
C[C@@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707031	BE	On-Demand	Anodyne	SLC6A4	18	43
C[C@@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707031	BE	On-Demand	Anodyne	HTR4	42	40
C[C@@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707031	BE	On-Demand	Anodyne	LTA4H	34	42
C[C@@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707031	BE	On-Demand	Anodyne	SIGMAR1	42	57
C[C@@H](O)CCN1CC[C@@H](COc2ccccc2)C1	ZINC000450707031	BE	On-Demand	Anodyne	CHRNA10	63	47
Cc1cnc2c(C)cccc2c1N1C[C@H](F)[C@H](F)C1	ZINC000450707038	CG	On-Demand	Anodyne	ATP4A	25	45
Cc1ccnc(-c2noc(CN3CCC(CCCn4ccnc4)CC3)n2)c1	ZINC000450707047	FG	On-Demand	Anodyne	HMOX2	43	30
COCCOC[C@@H](O)CN1CCc2cc(OC)c(F)cc2C1	ZINC000450707068	DD	On-Demand	Anodyne	HSP90AB1	34	40
COCCOC[C@H](O)CN1CCc2cc(OC)c(F)cc2C1	ZINC000450707070	DD	On-Demand	Anodyne	HSP90AB1	34	40
CC(F)(F)CCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450707083	EJ	On-Demand	Anodyne	GSK3B	0	40
CC(F)(F)CCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450707083	EJ	On-Demand	Anodyne	GSK3A	46	37
CC(F)(F)CCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450707083	EJ	On-Demand	Anodyne	TERT	26	47
CC(F)(F)CCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450707083	EJ	On-Demand	Anodyne	MVFR	0	48
CC[C@@](C)(CNc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1)OC	ZINC000450707089	DF	On-Demand	Mild	F2RL3	45	32
CC[C@](C)(CNc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1)OC	ZINC000450707090	DF	On-Demand	Mild	F2RL3	45	32
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(=O)OC)C1	ZINC000450707110	EE	On-Demand	Anodyne	SLC6A1	84	47
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(=O)OC)C1	ZINC000450707110	EE	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(=O)OC)C1	ZINC000450707110	EE	On-Demand	Anodyne	SLC6A3	31	43
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(=O)OC)C1	ZINC000450707110	EE	On-Demand	Anodyne	HRH3	21	41
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCc1ccc(Cl)cc1	ZINC000450707111	EE	On-Demand	Anodyne	SLC6A1	84	47
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCc1ccc(Cl)cc1	ZINC000450707111	EE	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCc1ccc(Cl)cc1	ZINC000450707111	EE	On-Demand	Anodyne	SLC6A3	31	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCc1ccc(Cl)cc1	ZINC000450707111	EE	On-Demand	Anodyne	HRH3	21	41
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(=O)OC)C1	ZINC000450707112	EE	On-Demand	Anodyne	SLC6A1	84	47
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(=O)OC)C1	ZINC000450707112	EE	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(=O)OC)C1	ZINC000450707112	EE	On-Demand	Anodyne	SLC6A3	31	43
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(=O)OC)C1	ZINC000450707112	EE	On-Demand	Anodyne	HRH3	21	41
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(=O)OC)C1	ZINC000450707113	EE	On-Demand	Anodyne	SLC6A1	84	47
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(=O)OC)C1	ZINC000450707113	EE	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(=O)OC)C1	ZINC000450707113	EE	On-Demand	Anodyne	SLC6A3	31	43
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(=O)OC)C1	ZINC000450707113	EE	On-Demand	Anodyne	HRH3	21	41
COc1cc(CN2C[C@@H]3CC[C@H](O)[C@H]3C2)ccc1Cl	ZINC000450707117	CF	On-Demand	Anodyne	DRD4	15	42
COc1cc(CN2C[C@H]3[C@H](O)CC[C@H]3C2)ccc1Cl	ZINC000450707119	CF	On-Demand	Anodyne	DRD4	15	42
COc1cc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)ccc1Cl	ZINC000450707121	CF	On-Demand	Anodyne	DRD4	15	42
COc1cc(CN2C[C@@H]3CC[C@@H](O)[C@H]3C2)ccc1Cl	ZINC000450707124	CF	On-Demand	Anodyne	DRD4	15	42
CCC[C@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707129	GG	On-Demand	Anodyne	LTA4H	24	41
CCC[C@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707129	GG	On-Demand	Anodyne	MMP2	16	44
CCC[C@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707129	GG	On-Demand	Anodyne	MMP3	15	44
CCC[C@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707129	GG	On-Demand	Anodyne	MMP9	16	44
CCC[C@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707129	GG	On-Demand	Anodyne	FBPC	0	40
CCC[C@@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707130	GG	On-Demand	Anodyne	LTA4H	24	41
CCC[C@@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707130	GG	On-Demand	Anodyne	MMP2	16	44
CCC[C@@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707130	GG	On-Demand	Anodyne	MMP3	15	44
CCC[C@@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707130	GG	On-Demand	Anodyne	MMP9	16	44
CCC[C@@H](OC)C(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450707130	GG	On-Demand	Anodyne	FBPC	0	40
CC[S@@](=O)CC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450707137	EF	On-Demand	Anodyne	HDAC3	15	40
CC[S@](=O)CC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450707138	EF	On-Demand	Anodyne	HDAC3	15	40
COc1ccc(CNC(=O)CCN2CCC(C)(C#N)CC2)c(OC)c1	ZINC000450707140	EE	On-Demand	Mild	DRD4	43	32
COc1ccc(CNC(=O)CCN2CCC(C)(C#N)CC2)c(OC)c1	ZINC000450707140	EE	On-Demand	Mild	HTR7	26	42
COc1ccc(CNC(=O)CCN2CCC(C)(C#N)CC2)c(OC)c1	ZINC000450707140	EE	On-Demand	Mild	MTNR1A	40	34
COc1ccc(CNC(=O)CCN2CCC(C)(C#N)CC2)c(OC)c1	ZINC000450707140	EE	On-Demand	Mild	MTNR1B	23	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450707153	EH	On-Demand	Anodyne	OPRK1	15	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450707153	EH	On-Demand	Anodyne	SIGMAR1	26	51
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450707153	EH	On-Demand	Anodyne	CHRNA10	45	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450707155	EH	On-Demand	Anodyne	OPRK1	15	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450707155	EH	On-Demand	Anodyne	SIGMAR1	26	51
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450707155	EH	On-Demand	Anodyne	CHRNA10	45	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450707157	EH	On-Demand	Anodyne	OPRK1	15	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450707157	EH	On-Demand	Anodyne	SIGMAR1	26	51
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450707157	EH	On-Demand	Anodyne	CHRNA10	45	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450707158	EH	On-Demand	Anodyne	OPRK1	15	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450707158	EH	On-Demand	Anodyne	SIGMAR1	26	51
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450707158	EH	On-Demand	Anodyne	CHRNA10	45	40
CCOC(=O)C[C@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450707169	CE	On-Demand	Anodyne	ACHE	0	44
CCOC(=O)C[C@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450707169	CE	On-Demand	Anodyne	PAPA1_CARPA	40	31
CCOC(=O)C[C@@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450707170	CE	On-Demand	Anodyne	ACHE	0	44
CCOC(=O)C[C@@H](C)N(C)CCN(C)Cc1ccccc1	ZINC000450707170	CE	On-Demand	Anodyne	PAPA1_CARPA	40	31
C=C(C)CCNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450707171	DG	On-Demand	Mild	MRGPRX1	27	40
C=C(C)CCNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450707171	DG	On-Demand	Mild	NPBWR1	44	42
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450707173	FG	On-Demand	Anodyne	ERBB2	0	42
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450707173	FG	On-Demand	Anodyne	SFRP1	58	38
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450707173	FG	On-Demand	Anodyne	WNT3	51	33
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450707173	FG	On-Demand	Anodyne	NPBWR1	52	33
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450707175	FG	On-Demand	Anodyne	ERBB2	0	42
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450707175	FG	On-Demand	Anodyne	SFRP1	58	38
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450707175	FG	On-Demand	Anodyne	WNT3	51	33
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450707175	FG	On-Demand	Anodyne	NPBWR1	52	33
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450707176	FG	On-Demand	Anodyne	ERBB2	0	42
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450707176	FG	On-Demand	Anodyne	SFRP1	58	38
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450707176	FG	On-Demand	Anodyne	WNT3	51	33
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450707176	FG	On-Demand	Anodyne	NPBWR1	52	33
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450707177	FG	On-Demand	Anodyne	ERBB2	0	42
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450707177	FG	On-Demand	Anodyne	SFRP1	58	38
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450707177	FG	On-Demand	Anodyne	WNT3	51	33
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450707177	FG	On-Demand	Anodyne	NPBWR1	52	33
CCOC(=O)C1(CNC(=O)c2cccc3c2O[C@H](C)C3)CC1	ZINC000450707195	DE	On-Demand	Anodyne	HCN1	65	36
CCOC(=O)C1(CNC(=O)c2cccc3c2O[C@H](C)C3)CC1	ZINC000450707195	DE	On-Demand	Anodyne	HCN4	54	35
CCOC(=O)C1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CC1	ZINC000450707196	DE	On-Demand	Anodyne	HCN1	65	36
CCOC(=O)C1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CC1	ZINC000450707196	DE	On-Demand	Anodyne	HCN4	54	35
O=C(NC1CC1)c1cc(N2CC[C@](O)(C(F)F)C2)nc2ccccc12	ZINC000450707224	EE	On-Demand	Anodyne	ACACB	22	41
O=C(NC1CC1)c1cc(N2CC[C@@](O)(C(F)F)C2)nc2ccccc12	ZINC000450707225	EE	On-Demand	Anodyne	ACACB	22	41
CCOC(=O)c1ccc(CSc2nnc(O)n2CC)nc1	ZINC000450707226	DD	On-Demand	Anodyne	SLC27A1	36	42
O=C1CCC(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)CC1	ZINC000450707241	EH	On-Demand	Anodyne	RBP4	61	39
O=C1CCC(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CC1	ZINC000450707242	EH	On-Demand	Anodyne	RBP4	61	39
CCn1c(SCCC(C)(F)F)nc2cc(S(N)(=O)=O)ccc21	ZINC000450707246	EF	On-Demand	Anodyne	CNR2	0	41
COc1cc2c(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)ccnc2cc1F	ZINC000450707252	EH	On-Demand	Anodyne	PDE3B	45	32
COc1cc2c(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)ccnc2cc1F	ZINC000450707253	EH	On-Demand	Anodyne	PDE3B	45	32
COc1cc2c(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)ccnc2cc1F	ZINC000450707254	EH	On-Demand	Anodyne	PDE3B	45	32
COc1cc2c(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)ccnc2cc1F	ZINC000450707255	EH	On-Demand	Anodyne	PDE3B	45	32
N#Cc1ccc(N2CC[C@](O)(C(F)F)C2)cc1C(F)(F)F	ZINC000450707276	DF	On-Demand	Mild	AR	54	51
N#Cc1ccc(N2CC[C@@](O)(C(F)F)C2)cc1C(F)(F)F	ZINC000450707277	DF	On-Demand	Mild	AR	54	51
CC(=O)N[C@H](C(=O)N1CCC(Nc2nc(C)cs2)CC1)C(C)(C)C	ZINC000450707301	FE	On-Demand	Anodyne	TRPC6	44	33
CCC[C@@H](OC)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450707306	DF	On-Demand	Anodyne	P2RY12	42	33
CCC[C@H](OC)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450707311	DF	On-Demand	Anodyne	P2RY12	42	33
CCCOc1ccc(C(=O)NCC2(C(=O)OCC)CC2)c(OC)c1	ZINC000450707326	EF	On-Demand	Anodyne	HCN1	52	35
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450707348	GE	On-Demand	Anodyne	CCR3	0	47
CCOC(=O)C1(CNC(=O)c2cc(Cl)c(Br)cc2F)CC1	ZINC000450707349	GG	On-Demand	Anodyne	SLC6A9	43	36
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450707353	GE	On-Demand	Anodyne	CCR3	0	47
CC(C)NC(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450707384	ED	On-Demand	Bother	TAAR1	26	46
CCCOc1ccc(C(=O)N2CCCC3(CC3)C2)c(OC)c1	ZINC000450707385	DH	On-Demand	Anodyne	OXTR	0	40
CCOC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)nc1	ZINC000450707400	EG	On-Demand	Anodyne	SSTR5	31	41
FC1(F)CC(CSc2nnc(-c3cccc(Br)c3)o2)C1	ZINC000450707403	FJ	On-Demand	Anodyne	GSK3A	40	38
FC1(F)CC(CSc2nnc(-c3cccc(Br)c3)o2)C1	ZINC000450707403	FJ	On-Demand	Anodyne	MVFR	0	45
Cc1ccc(I)cc1NC(=O)c1cnc(C2CC2)nc1	ZINC000450707411	GH	On-Demand	Anodyne	MAPK14	28	40
C[C@@H](Sc1nnc(-c2cccc(Cl)c2)o1)C(=O)C1CCCCC1	ZINC000450707423	FK	On-Demand	Anodyne	GRM5	19	40
C[C@H](Sc1nnc(-c2cccc(Cl)c2)o1)C(=O)C1CCCCC1	ZINC000450707424	FK	On-Demand	Anodyne	GRM5	19	40
CCOC(=O)c1ccc(CN2C[C@H](C)C[C@@H]2c2cccc(OC)c2)nc1	ZINC000450707425	FH	On-Demand	Anodyne	P2RY12	19	42
CCOC(=O)c1ccc(CN2C[C@@H](C)C[C@@H]2c2cccc(OC)c2)nc1	ZINC000450707426	FH	On-Demand	Anodyne	P2RY12	19	42
CCOC(=O)c1ccc(CN2C[C@H](C)C[C@H]2c2cccc(OC)c2)nc1	ZINC000450707427	FH	On-Demand	Anodyne	P2RY12	19	42
CCOC(=O)c1ccc(CN2C[C@@H](C)C[C@H]2c2cccc(OC)c2)nc1	ZINC000450707428	FH	On-Demand	Anodyne	P2RY12	19	42
C=C(C)CCNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450707444	CF	On-Demand	Mild	DHOD	0	56
COc1cc(CC(=O)N(CCN(C)C)C2CC2)ccc1Cl	ZINC000450707447	DE	On-Demand	Anodyne	MBTPS1	42	33
CC[C@@](C)(CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1)OC	ZINC000450707453	DD	On-Demand	Bother	F2RL3	44	31
CC[C@](C)(CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1)OC	ZINC000450707454	DD	On-Demand	Bother	F2RL3	44	31
O=C(CCCC(=O)C1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707467	GG	On-Demand	Anodyne	RBP4	63	36
O=C(CCCC(=O)C1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707468	GG	On-Demand	Anodyne	RBP4	63	36
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CCCn2ccnc2)CC1	ZINC000450707474	EH	On-Demand	Anodyne	TBXAS1	30	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CCCn2ccnc2)CC1	ZINC000450707475	EH	On-Demand	Anodyne	TBXAS1	30	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CCCn2ccnc2)CC1	ZINC000450707476	EH	On-Demand	Anodyne	TBXAS1	30	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CCCn2ccnc2)CC1	ZINC000450707477	EH	On-Demand	Anodyne	TBXAS1	30	43
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707492	FG	On-Demand	Anodyne	RBP4	61	33
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707493	FG	On-Demand	Anodyne	RBP4	50	33
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707494	FG	On-Demand	Anodyne	RBP4	61	33
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707495	FG	On-Demand	Anodyne	RBP4	50	33
CCOC(=O)CCN(Cc1cccnc1)Cc1cc(C)ccc1F	ZINC000450707503	EG	On-Demand	Anodyne	NR1D1	46	43
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	HTR1A	18	58
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	THRA	0	45
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	DRD4	17	48
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	ACHE	33	47
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	HTR2A	23	52
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	HTR2C	23	55
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	HRH1	19	54
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	DRD3	17	48
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	HTR4	47	36
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	GRIN2B	31	42
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	THRB	0	45
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	HTR7	24	40
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	TACR2	27	48
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	SIGMAR1	30	47
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	NPY1R	42	48
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	CCR3	25	45
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	HTR3B	0	43
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	CYP2J2	77	55
O=C(CCCN1CCC(CCCN2CCOCC2)CC1)c1ccccc1	ZINC000450707518	FG	On-Demand	Anodyne	CDPK1	0	41
Fc1ccc(-c2csc(N3C[C@H](F)[C@H](F)C3)n2)cc1	ZINC000450707519	CG	On-Demand	Anodyne	EGFR	15	42
COc1ccc2c(c1)nc(CNC(=O)C(C)(C)C1CCC1)n2C	ZINC000450707526	DG	On-Demand	Anodyne	MTNR1A	28	41
COc1ccc2c(c1)nc(CNC(=O)C(C)(C)C1CCC1)n2C	ZINC000450707526	DG	On-Demand	Anodyne	GIP	0	41
COc1ccc2c(c1)nc(CNC(=O)C(C)(C)C1CCC1)n2C	ZINC000450707526	DG	On-Demand	Anodyne	GCG	0	41
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)on1	ZINC000450707527	FE	On-Demand	Anodyne	HTR1A	22	43
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)on1	ZINC000450707527	FE	On-Demand	Anodyne	PRNP	31	42
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)on1	ZINC000450707527	FE	On-Demand	Anodyne	LIMK2	40	31
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)on1	ZINC000450707527	FE	On-Demand	Anodyne	KCNK3	40	33
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	DRD2	18	51
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	ACHE	31	43
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	CASP3	71	44
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	HRH3	18	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	SIGMAR1	59	57
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	SSTR5	41	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	MMP13	27	43
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	ADAM17	24	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	MMP3	15	43
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	MMP9	20	43
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	CASP7	66	44
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)cc1	ZINC000450707551	FG	On-Demand	Anodyne	MMP1	23	43
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	DRD2	18	51
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	ACHE	31	43
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	CASP3	71	44
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	HRH3	18	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	SIGMAR1	59	57
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	SSTR5	41	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	MMP13	27	43
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	ADAM17	24	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	MMP3	15	43
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	MMP9	20	43
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	CASP7	66	44
CCS(=O)(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)cc1	ZINC000450707552	FG	On-Demand	Anodyne	MMP1	23	43
CCOC(=O)C1(CNC(=O)c2ccsn2)CC1	ZINC000450707553	CD	On-Demand	Anodyne	HCN1	41	33
CCOC(=O)C1(CNC(=O)c2ccsn2)CC1	ZINC000450707553	CD	On-Demand	Anodyne	HCN4	41	33
c1ccc(OC[C@H]2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)cc1	ZINC000450707559	CF	On-Demand	Anodyne	SIGMAR1	21	53
c1ccc(OC[C@H]2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)cc1	ZINC000450707560	CF	On-Demand	Anodyne	SIGMAR1	21	53
c1ccc(OC[C@@H]2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)C2)cc1	ZINC000450707561	CF	On-Demand	Anodyne	SIGMAR1	21	53
c1ccc(OC[C@@H]2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)C2)cc1	ZINC000450707562	CF	On-Demand	Anodyne	SIGMAR1	21	53
COCCOC[C@H](O)CN1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450707564	DE	On-Demand	Anodyne	HSP90AB1	39	42
COCCOC[C@@H](O)CN1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450707565	DE	On-Demand	Anodyne	HSP90AB1	39	42
COc1cccc(OCCC(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c1	ZINC000450707566	GF	On-Demand	Anodyne	PREP	23	43
Cc1ccc(C(=O)NCC2(CO)CCCC2)c(Cl)c1Cl	ZINC000450707567	DH	On-Demand	Anodyne	HCN1	50	31
Cc1ccc(C(=O)NCC2(CO)CCCC2)c(Cl)c1Cl	ZINC000450707567	DH	On-Demand	Anodyne	HCN4	48	31
CCN1CCN(c2cccc(NC(=O)C3(C(F)(F)F)CCC3)c2)CC1	ZINC000450707568	FG	On-Demand	Anodyne	HTR1A	25	42
CCN1CCN(c2cccc(NC(=O)C3(C(F)(F)F)CCC3)c2)CC1	ZINC000450707568	FG	On-Demand	Anodyne	PRNP	30	42
COC(=O)c1ccccc1C(=O)c1ccc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450707575	GG	On-Demand	Bother	TAAR1	20	43
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCC1(CO)CCCC1	ZINC000450707576	FE	On-Demand	Anodyne	E1	0	40
CC(C)c1nnc(CN2CC[C@H](COc3ccccc3)C2)s1	ZINC000450707578	DH	On-Demand	Anodyne	HTR4	48	33
CC(C)c1nnc(CN2CC[C@H](COc3ccccc3)C2)s1	ZINC000450707578	DH	On-Demand	Anodyne	SIGMAR1	21	48
CC(C)c1nnc(CN2CC[C@@H](COc3ccccc3)C2)s1	ZINC000450707579	DH	On-Demand	Anodyne	HTR4	48	33
CC(C)c1nnc(CN2CC[C@@H](COc3ccccc3)C2)s1	ZINC000450707579	DH	On-Demand	Anodyne	SIGMAR1	21	48
CCOC(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)nc1	ZINC000450707581	EG	On-Demand	Anodyne	P2RY12	32	40
CCOC(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)nc1	ZINC000450707581	EG	On-Demand	Anodyne	SIGMAR1	24	47
CCOC(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)nc1	ZINC000450707581	EG	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)c1ccc(CN2CC[C@H](COc3ccccc3)C2)nc1	ZINC000450707581	EG	On-Demand	Anodyne	CHEK2	27	41
CCOC(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)nc1	ZINC000450707582	EG	On-Demand	Anodyne	P2RY12	32	40
CCOC(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)nc1	ZINC000450707582	EG	On-Demand	Anodyne	SIGMAR1	24	47
CCOC(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)nc1	ZINC000450707582	EG	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)c1ccc(CN2CC[C@@H](COc3ccccc3)C2)nc1	ZINC000450707582	EG	On-Demand	Anodyne	CHEK2	27	41
Cc1ncsc1CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450707636	FF	On-Demand	Anodyne	LRRK2	23	40
CC(C)NC(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450707648	ED	On-Demand	Bother	TAAR1	26	46
CCC[C@@H](Nc1cc(C)nc2ncnn12)C(C)(C)C	ZINC000450707657	CG	On-Demand	Anodyne	DHOD	0	58
CCC[C@H](Nc1cc(C)nc2ncnn12)C(C)(C)C	ZINC000450707658	CG	On-Demand	Anodyne	DHOD	0	58
CC[C@@H]1C[C@H]1C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450707670	CF	On-Demand	Anodyne	NPBWR1	42	31
CC[C@@H]1C[C@H]1C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450707670	CF	On-Demand	Anodyne	TRPC6	44	33
CCOC(=O)COCCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450707712	GC	On-Demand	Bother	BDKRB1	0	43
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cn2nccc2nc1C	ZINC000450707731	GF	On-Demand	Anodyne	CCR3	0	41
O=[N+]([O-])c1ccc(N2CC[C@](O)(C(F)F)C2)cc1C(F)(F)F	ZINC000450707734	EF	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2CC[C@@](O)(C(F)F)C2)cc1C(F)(F)F	ZINC000450707735	EF	On-Demand	Bother	AADAC	0	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cn2nccc2nc1C	ZINC000450707736	GF	On-Demand	Anodyne	CCR3	0	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707738	DI	On-Demand	Anodyne	MC4R	35	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707738	DI	On-Demand	Anodyne	PRCP	52	39
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707738	DI	On-Demand	Anodyne	MC3R	42	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707738	DI	On-Demand	Anodyne	MC5R	31	40
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707743	DI	On-Demand	Anodyne	MC4R	35	40
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707743	DI	On-Demand	Anodyne	PRCP	52	39
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707743	DI	On-Demand	Anodyne	MC3R	42	40
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707743	DI	On-Demand	Anodyne	MC5R	31	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707744	DI	On-Demand	Anodyne	MC4R	35	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707744	DI	On-Demand	Anodyne	PRCP	52	39
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707744	DI	On-Demand	Anodyne	MC3R	42	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707744	DI	On-Demand	Anodyne	MC5R	31	40
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707745	DI	On-Demand	Anodyne	MC4R	35	40
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707745	DI	On-Demand	Anodyne	PRCP	52	39
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707745	DI	On-Demand	Anodyne	MC3R	42	40
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCCC2(CC2)C1	ZINC000450707745	DI	On-Demand	Anodyne	MC5R	31	40
Cc1csc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)c1	ZINC000450707756	DH	On-Demand	Anodyne	TRPC6	53	41
Cc1csc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)c1	ZINC000450707756	DH	On-Demand	Anodyne	TRPC3	36	41
COC(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1Cl	ZINC000450707805	GI	On-Demand	Anodyne	ACHE	42	43
COC(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1Cl	ZINC000450707805	GI	On-Demand	Anodyne	HTR4	53	43
COC(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1Cl	ZINC000450707805	GI	On-Demand	Anodyne	TBXAS1	55	41
COC(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1Cl	ZINC000450707805	GI	On-Demand	Anodyne	CYP17A1	0	40
COC(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1Cl	ZINC000450707805	GI	On-Demand	Anodyne	MCHR1	34	41
COC(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1Cl	ZINC000450707805	GI	On-Demand	Anodyne	CACNA1I	48	38
C[C@H](OCCc1ccccc1)C(=O)N(CCN(C)C)C1CC1	ZINC000450707810	DE	On-Demand	Anodyne	AMY2	51	39
C[C@@H](OCCc1ccccc1)C(=O)N(CCN(C)C)C1CC1	ZINC000450707811	DE	On-Demand	Anodyne	AMY2	51	39
C[C@@H]1C[C@]1(C#N)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707815	FE	On-Demand	Mild	RBP4	57	35
C[C@@H]1C[C@]1(C#N)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707816	FE	On-Demand	Mild	RBP4	57	35
C[C@@H]1C[C@@]1(C#N)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707817	FE	On-Demand	Mild	RBP4	57	35
C[C@@H]1C[C@@]1(C#N)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707818	FE	On-Demand	Mild	RBP4	57	35
CC(=O)c1cccc(CN2CCNC(=O)[C@@H]2Cc2ccccc2)c1	ZINC000450707827	DE	On-Demand	Anodyne	PROTEASE	0	48
CC(=O)c1cccc(CN2CCNC(=O)[C@@H]2Cc2ccccc2)c1	ZINC000450707827	DE	On-Demand	Anodyne	POL	0	53
CC(=O)c1cccc(CN2CCNC(=O)[C@H]2Cc2ccccc2)c1	ZINC000450707828	DE	On-Demand	Anodyne	PROTEASE	0	48
CC(=O)c1cccc(CN2CCNC(=O)[C@H]2Cc2ccccc2)c1	ZINC000450707828	DE	On-Demand	Anodyne	POL	0	53
COc1ccc(C(=O)NCC(C)(C)C2=CCCCC2)cc1S(C)(=O)=O	ZINC000450707837	FG	On-Demand	Anodyne	COLA	47	37
COc1ccc(C(=O)NCC(C)(C)C2=CCCCC2)cc1S(C)(=O)=O	ZINC000450707837	FG	On-Demand	Anodyne	CPT1A	40	35
CCC[C@H](O)CN1CCC(CCCn2ccnc2)CC1	ZINC000450707842	CF	On-Demand	Anodyne	TBXAS1	17	43
CCC[C@@H](O)CN1CCC(CCCn2ccnc2)CC1	ZINC000450707843	CF	On-Demand	Anodyne	TBXAS1	17	43
CCc1cc(CCCSc2nnc(-c3cccc(Cl)c3)o2)on1	ZINC000450707844	EJ	On-Demand	Anodyne	TERT	0	44
CCc1cc(CCCSc2nnc(-c3cccc(Cl)c3)o2)on1	ZINC000450707844	EJ	On-Demand	Anodyne	SUCNR1	20	40
COc1cc(CC(=O)N(CCN(C)C)C2CC2)ccc1O	ZINC000450707852	CD	On-Demand	Anodyne	MBTPS1	40	33
COc1cc(CC(=O)N(CCN(C)C)C2CC2)ccc1O	ZINC000450707852	CD	On-Demand	Anodyne	CAN2	0	42
O=C(CC1CC(F)(F)C1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707861	GG	On-Demand	Anodyne	RBP4	52	34
O=C(CC1CC(F)(F)C1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450707862	GG	On-Demand	Anodyne	RBP4	52	34
CC[C@@H](CO)N(CCc1cscn1)Cc1ccccc1	ZINC000450707863	CF	On-Demand	Anodyne	BMP1	43	35
Cc1nc(C)n(CCCC(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)n1	ZINC000450707878	GH	On-Demand	Anodyne	HDAC10	28	42
Cc1nc(C)n(CCCC(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)n1	ZINC000450707878	GH	On-Demand	Anodyne	HDAC2	16	42
Cc1nc(C)n(CCCC(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)n1	ZINC000450707878	GH	On-Demand	Anodyne	HDAC3	36	42
Cc1nc(C)n(CCCC(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)n1	ZINC000450707878	GH	On-Demand	Anodyne	HDAC6	27	42
CCc1nc(C)c(CSc2nnc(-c3cccc(Br)c3)o2)o1	ZINC000450707879	GJ	On-Demand	Anodyne	GSK3A	48	38
CCc1nc(C)c(CSc2nnc(-c3cccc(Br)c3)o2)o1	ZINC000450707879	GJ	On-Demand	Anodyne	TERT	26	48
CC1(O)CC(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)C1	ZINC000450707885	FE	On-Demand	Anodyne	RBP4	58	37
CC1(O)CC(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)C1	ZINC000450707885	FE	On-Demand	Anodyne	SFRP1	93	32
CC1(O)CC(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)C1	ZINC000450707885	FE	On-Demand	Anodyne	WNT3	57	32
CC1(O)CC(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)C1	ZINC000450707887	FE	On-Demand	Anodyne	RBP4	58	37
CC1(O)CC(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)C1	ZINC000450707887	FE	On-Demand	Anodyne	SFRP1	93	32
CC1(O)CC(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)C1	ZINC000450707887	FE	On-Demand	Anodyne	WNT3	57	32
CCc1cc(CCCSc2nnc(-c3cccc(Br)c3)o2)on1	ZINC000450707898	GJ	On-Demand	Anodyne	TERT	23	44
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCn2ncnc2C1	ZINC000450707906	ED	On-Demand	Bother	P2RX7	27	40
C[C@@H](CN1CC[C@H](COc2ccccc2)C1)S(C)(=O)=O	ZINC000450707913	CD	On-Demand	Anodyne	SIGMAR1	26	52
C[C@@H](CN1CC[C@H](COc2ccccc2)C1)S(C)(=O)=O	ZINC000450707913	CD	On-Demand	Anodyne	CHRNA10	43	41
C[C@H](CN1CC[C@H](COc2ccccc2)C1)S(C)(=O)=O	ZINC000450707915	CD	On-Demand	Anodyne	SIGMAR1	26	52
C[C@H](CN1CC[C@H](COc2ccccc2)C1)S(C)(=O)=O	ZINC000450707915	CD	On-Demand	Anodyne	CHRNA10	43	41
C[C@@H](CN1CC[C@@H](COc2ccccc2)C1)S(C)(=O)=O	ZINC000450707917	CD	On-Demand	Anodyne	SIGMAR1	26	52
C[C@@H](CN1CC[C@@H](COc2ccccc2)C1)S(C)(=O)=O	ZINC000450707917	CD	On-Demand	Anodyne	CHRNA10	43	41
C[C@H](CN1CC[C@@H](COc2ccccc2)C1)S(C)(=O)=O	ZINC000450707918	CD	On-Demand	Anodyne	SIGMAR1	26	52
C[C@H](CN1CC[C@@H](COc2ccccc2)C1)S(C)(=O)=O	ZINC000450707918	CD	On-Demand	Anodyne	CHRNA10	43	41
O=C(NCC1(CO)CCCC1)c1cccc2c1CCCC2	ZINC000450707919	CF	On-Demand	Anodyne	FABP4	43	33
O=C(NCC1(CO)CCCC1)c1cccc2c1CCCC2	ZINC000450707919	CF	On-Demand	Anodyne	HCN1	63	36
O=C(NCC1(CO)CCCC1)c1cccc2c1CCCC2	ZINC000450707919	CF	On-Demand	Anodyne	HCN4	51	34
CC[C@H](CC(F)(F)F)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450707941	EH	On-Demand	Anodyne	EPHX2	17	40
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450707943	EH	On-Demand	Anodyne	EPHX2	17	40
COc1cc(CC(=O)NCC2(CO)CCCC2)ccc1O	ZINC000450707955	CD	On-Demand	Anodyne	CAN2	0	47
CCOC(=O)C1(CNC(=O)c2ccc(C)c(Cl)c2Cl)CC1	ZINC000450707961	EG	On-Demand	Anodyne	HCN1	41	33
CCOC(=O)C1(CNC(=O)c2ccc(C)c(Cl)c2Cl)CC1	ZINC000450707961	EG	On-Demand	Anodyne	HCN4	41	33
CCCCCN(CC[C@H](C)O)CC(N)=O	ZINC000450707964	BC	On-Demand	Anodyne	CQSS	54	35
CCCCCN(CC[C@@H](C)O)CC(N)=O	ZINC000450707965	BC	On-Demand	Anodyne	CQSS	54	35
Cn1nc(C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)c2c1CCCC2	ZINC000450707966	FF	On-Demand	Anodyne	FABP4	38	41
COC(=O)C[C@H](NC(=O)c1cnc(C2CC2)nc1)c1ccc2ccccc2c1	ZINC000450707974	GH	On-Demand	Anodyne	AKT1	0	41
COC(=O)C[C@H](NC(=O)c1cnc(C2CC2)nc1)c1ccc2ccccc2c1	ZINC000450707974	GH	On-Demand	Anodyne	UTS2	64	45
COC(=O)C[C@@H](NC(=O)c1cnc(C2CC2)nc1)c1ccc2ccccc2c1	ZINC000450707976	GH	On-Demand	Anodyne	AKT1	0	41
COC(=O)C[C@@H](NC(=O)c1cnc(C2CC2)nc1)c1ccc2ccccc2c1	ZINC000450707976	GH	On-Demand	Anodyne	UTS2	64	45
CCN1CCN(c2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450707977	EF	On-Demand	Anodyne	HTR1A	25	46
CCN1CCN(c2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450707977	EF	On-Demand	Anodyne	PRNP	29	40
CCN1CCN(c2cccc(NC(=O)Cc3ccc(O)c(F)c3)c2)CC1	ZINC000450707987	FF	On-Demand	Anodyne	HTR1A	17	45
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	F2	52	39
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	OPRD1	0	42
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	CELA1	48	36
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	ELANE	69	42
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	TRY1_BOVIN	81	36
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	PREP	69	43
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	LGMN	62	36
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	XIAP	63	42
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	SFRP1	40	38
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	WNT3	41	31
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	BRCA1	65	34
C/C=C\C[C@@H](CO)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450707999	DD	On-Demand	Anodyne	TMPRSS11D	53	34
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC4(CC4)C3)ccc21	ZINC000450708002	FI	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC4(CC4)C3)ccc21	ZINC000450708002	FI	On-Demand	Anodyne	SCN5A	41	37
COc1ccccc1-n1cnc2cc(C(=O)N3CCCC4(CC4)C3)ccc21	ZINC000450708002	FI	On-Demand	Anodyne	HPGD	67	77
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](C)CCN2CCN(C)CC2)c1	ZINC000450708020	GE	On-Demand	Anodyne	DRD4	44	34
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H](C)CCN2CCN(C)CC2)c1	ZINC000450708021	GE	On-Demand	Anodyne	DRD4	44	34
C/C=C\COc1cccc(CC(=O)NCc2nc3cc(OC)ccc3n2C)c1	ZINC000450708026	GG	On-Demand	Anodyne	ROCK1	29	40
C/C=C\COc1cccc(CC(=O)NCc2nc3cc(OC)ccc3n2C)c1	ZINC000450708026	GG	On-Demand	Anodyne	MTNR1A	54	37
C/C=C\COc1cccc(CC(=O)NCc2nc3cc(OC)ccc3n2C)c1	ZINC000450708026	GG	On-Demand	Anodyne	MTNR1B	52	37
C/C=C\COc1cccc(CC(=O)NCc2nc3cc(OC)ccc3n2C)c1	ZINC000450708026	GG	On-Demand	Anodyne	ROCK2	27	40
C/C=C/COc1cccc(CC(=O)NCc2nc3cc(OC)ccc3n2C)c1	ZINC000450708027	GG	On-Demand	Anodyne	ROCK1	29	40
C/C=C/COc1cccc(CC(=O)NCc2nc3cc(OC)ccc3n2C)c1	ZINC000450708027	GG	On-Demand	Anodyne	MTNR1A	54	37
C/C=C/COc1cccc(CC(=O)NCc2nc3cc(OC)ccc3n2C)c1	ZINC000450708027	GG	On-Demand	Anodyne	MTNR1B	52	37
C/C=C/COc1cccc(CC(=O)NCc2nc3cc(OC)ccc3n2C)c1	ZINC000450708027	GG	On-Demand	Anodyne	ROCK2	27	40
COc1cccc2c1nc(NC(=O)CC1(O)CCC1)n2C	ZINC000450708039	CD	On-Demand	Anodyne	ENPP1	50	31
Cc1csc(NC2CCN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450708041	FI	On-Demand	Anodyne	NPBWR1	95	38
CCN1CCN(c2cccc(NC(=O)c3ccc(C#N)n3C)c2)CC1	ZINC000450708045	EE	On-Demand	Mild	DRD4	43	33
Cc1csc(NC2CCN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450708047	FI	On-Demand	Anodyne	NPBWR1	95	38
Cc1csc(NC2CCN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)CC2)n1	ZINC000450708048	FI	On-Demand	Anodyne	NPBWR1	95	38
Cc1csc(NC2CCN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450708049	FI	On-Demand	Anodyne	NPBWR1	95	38
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	DRD2	0	47
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	DRD4	40	47
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	ACHE	26	44
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	DRD3	0	47
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	CHRM3	25	40
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	SIGMAR1	41	41
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	SSTR5	40	35
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	CCR3	55	42
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	MCHR1	38	40
CC(=O)c1cccc(CN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450708053	DH	On-Demand	Anodyne	MAP3K7	48	40
C[C@H](Cn1nnc(-c2cccc(F)c2)n1)S(C)(=O)=O	ZINC000450708097	CC	On-Demand	Anodyne	SCARB1	41	47
C[C@@H](Cn1nnc(-c2cccc(F)c2)n1)S(C)(=O)=O	ZINC000450708101	CC	On-Demand	Anodyne	SCARB1	41	47
CCc1ccc([C@H](CO)NC[C@@H]2COCCO2)cc1	ZINC000450708125	CD	On-Demand	Anodyne	MAN1	0	40
COc1cc2c(N3CC[C@@H](C(F)(F)F)C[C@H]3C)ncnc2cc1F	ZINC000450708126	EH	On-Demand	Anodyne	PDE3A	52	41
COc1cc2c(N3CC[C@@H](C(F)(F)F)C[C@H]3C)ncnc2cc1F	ZINC000450708126	EH	On-Demand	Anodyne	PDE3B	76	38
CCc1ccc([C@H](CO)NC[C@H]2COCCO2)cc1	ZINC000450708127	CD	On-Demand	Anodyne	MAN1	0	40
CCc1ccc([C@@H](CO)NC[C@@H]2COCCO2)cc1	ZINC000450708128	CD	On-Demand	Anodyne	MAN1	0	40
COc1cc2c(N3CC[C@H](C(F)(F)F)C[C@@H]3C)ncnc2cc1F	ZINC000450708129	EH	On-Demand	Anodyne	PDE3A	52	41
COc1cc2c(N3CC[C@H](C(F)(F)F)C[C@@H]3C)ncnc2cc1F	ZINC000450708129	EH	On-Demand	Anodyne	PDE3B	76	38
COc1cc2c(N3CC[C@@H](C(F)(F)F)C[C@@H]3C)ncnc2cc1F	ZINC000450708130	EH	On-Demand	Anodyne	PDE3A	52	41
COc1cc2c(N3CC[C@@H](C(F)(F)F)C[C@@H]3C)ncnc2cc1F	ZINC000450708130	EH	On-Demand	Anodyne	PDE3B	76	38
COc1cc2c(N3CC[C@H](C(F)(F)F)C[C@H]3C)ncnc2cc1F	ZINC000450708131	EH	On-Demand	Anodyne	PDE3A	52	41
COc1cc2c(N3CC[C@H](C(F)(F)F)C[C@H]3C)ncnc2cc1F	ZINC000450708131	EH	On-Demand	Anodyne	PDE3B	76	38
Cc1cccc2ncnc(N3CC[C@@](O)(C(F)F)C3)c12	ZINC000450708138	CE	On-Demand	Anodyne	AKT1	25	47
Cc1cccc2ncnc(N3CC[C@](O)(C(F)F)C3)c12	ZINC000450708139	CE	On-Demand	Anodyne	AKT1	25	47
CCOC(=O)C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450708144	FD	On-Demand	Anodyne	CA2	26	45
CCOC(=O)C1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450708144	FD	On-Demand	Anodyne	CA14	18	40
CC(C)c1nccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)n1	ZINC000450708163	CF	On-Demand	Anodyne	SORD	52	36
CC(C)c1nccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)n1	ZINC000450708164	CF	On-Demand	Anodyne	SORD	52	36
CC(C)c1nccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)n1	ZINC000450708165	CF	On-Demand	Anodyne	SORD	52	36
CC(C)c1nccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)n1	ZINC000450708166	CF	On-Demand	Anodyne	SORD	52	36
O[C@]1(C(F)F)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450708174	CD	On-Demand	Anodyne	SORD	51	33
O[C@@]1(C(F)F)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450708175	CD	On-Demand	Anodyne	SORD	51	33
O[C@@]1(C(F)F)CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450708176	EF	On-Demand	Anodyne	RBP4	19	45
O[C@]1(C(F)F)CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450708177	EF	On-Demand	Anodyne	RBP4	19	45
CC(C)(C)NC(=O)N1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450708199	GE	On-Demand	Bother	MGLL	0	41
CO[C@@H](Cc1ccccc1)C(=O)N(CCN(C)C)C1CC1	ZINC000450708207	CD	On-Demand	Anodyne	AMY2	49	37
CO[C@H](Cc1ccccc1)C(=O)N(CCN(C)C)C1CC1	ZINC000450708208	CD	On-Demand	Anodyne	AMY2	49	37
CC(=O)CCCCCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450708211	FJ	On-Demand	Anodyne	GSK3A	36	41
CC(=O)CCCCCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450708211	FJ	On-Demand	Anodyne	ALOX15	53	38
CC(=O)CCCCCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450708211	FJ	On-Demand	Anodyne	MVFR	0	44
CCc1ccc([C@@H](CO)NC[C@H]2COCCO2)cc1	ZINC000450708214	CD	On-Demand	Anodyne	MAN1	0	40
CC(C)(C)NC(=O)N1CCN(C(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450708215	ED	On-Demand	Anodyne	CAN2	0	44
CCOC(=O)c1cc(N2C[C@H](F)[C@H](F)C2)ncc1Cl	ZINC000450708264	CE	On-Demand	Anodyne	Q9FYV8_MAIZE	39	40
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	DRD2	32	41
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	DRD4	30	55
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	HTR2A	39	51
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	HTR2C	21	53
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	SLC6A1	44	33
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	HTR1F	15	46
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	HTR7	19	41
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	SIGMAR1	17	48
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	CCR3	29	40
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	PLD1	76	39
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	SLC18A3	20	48
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	PLD2	59	39
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	MCHR1	16	40
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	CACNA1G	19	41
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	AP2S1	0	40
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708271	FI	On-Demand	Anodyne	USP1	0	41
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	DRD2	32	41
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	DRD4	30	55
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	HTR2A	39	51
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	HTR2C	21	53
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	SLC6A1	44	33
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	HTR1F	15	46
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	HTR7	19	41
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	SIGMAR1	17	48
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	CCR3	29	40
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	PLD1	76	39
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	SLC18A3	20	48
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	PLD2	59	39
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	MCHR1	16	40
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	CACNA1G	19	41
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	AP2S1	0	40
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccc(F)cc1	ZINC000450708272	FI	On-Demand	Anodyne	USP1	0	41
COC(=O)C[C@@H](NC(=O)[C@@H]1CC[C@H](C)O1)c1ccc2ccccc2c1	ZINC000450708276	EG	On-Demand	Anodyne	GPR88	0	48
COc1ccc(-c2noc(N3C[C@H](F)[C@H](F)C3)n2)cc1	ZINC000450708281	CE	On-Demand	Anodyne	LUCI_PHOPE	23	46
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1cn(C)nc1C	ZINC000450708286	FE	On-Demand	Anodyne	P2RX7	38	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1cn(C)nc1C	ZINC000450708288	FE	On-Demand	Anodyne	P2RX7	38	40
CCOC(=O)COCCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450708301	ED	On-Demand	Anodyne	P2RY12	110	36
CCOC(=O)COCCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450708301	ED	On-Demand	Anodyne	DHOD	0	41
COc1cccc(-n2cc(C(=O)N(CCN(C)C)C3CC3)nn2)c1	ZINC000450708318	ED	On-Demand	Anodyne	DRD4	43	33
Cc1cnc(CCCC(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)o1	ZINC000450708319	GI	On-Demand	Anodyne	HDAC10	23	41
Cc1cnc(CCCC(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)o1	ZINC000450708319	GI	On-Demand	Anodyne	HDAC3	32	41
Cc1cnc(CCCC(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)o1	ZINC000450708319	GI	On-Demand	Anodyne	HDAC6	25	42
Cc1cc(C(F)(F)F)ccc1C(=O)N(CCN(C)C)C1CC1	ZINC000450708322	DG	On-Demand	Anodyne	LIPG	40	37
CCn1c(S[C@H]2C[C@H](C)CCC2=O)nc2cc(S(N)(=O)=O)ccc21	ZINC000450708325	FF	On-Demand	Anodyne	CNR2	17	41
CCn1c(S[C@H]2C[C@@H](C)CCC2=O)nc2cc(S(N)(=O)=O)ccc21	ZINC000450708328	FF	On-Demand	Anodyne	CNR2	17	41
Cc1ccc(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)cn1	ZINC000450708329	FI	On-Demand	Anodyne	DRD4	22	42
Cc1ccc(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)cn1	ZINC000450708329	FI	On-Demand	Anodyne	SIGMAR1	25	41
CCn1c(S[C@@H]2C[C@H](C)CCC2=O)nc2cc(S(N)(=O)=O)ccc21	ZINC000450708330	FF	On-Demand	Anodyne	CNR2	17	41
CCn1c(S[C@@H]2C[C@@H](C)CCC2=O)nc2cc(S(N)(=O)=O)ccc21	ZINC000450708331	FF	On-Demand	Anodyne	CNR2	17	41
O[C@@H](CN[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F)Cc1ccccc1	ZINC000450708332	GI	On-Demand	Anodyne	PPARA	16	44
O[C@@H](CN[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F)Cc1ccccc1	ZINC000450708332	GI	On-Demand	Anodyne	ADRB3	16	44
O[C@@H](CN[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F)Cc1ccccc1	ZINC000450708332	GI	On-Demand	Anodyne	CTSF	41	35
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1cc2n(n1)CCCC2	ZINC000450708333	EI	On-Demand	Anodyne	JUN	25	42
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1cc2n(n1)CCCC2	ZINC000450708333	EI	On-Demand	Anodyne	ATF1	59	41
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1cc2n(n1)CCCC2	ZINC000450708333	EI	On-Demand	Anodyne	NFKB1	54	41
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1cc2n(n1)CCCC2	ZINC000450708333	EI	On-Demand	Anodyne	RHOA	0	41
O[C@@H](CN[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F)Cc1ccccc1	ZINC000450708334	GI	On-Demand	Anodyne	PPARA	16	44
O[C@@H](CN[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F)Cc1ccccc1	ZINC000450708334	GI	On-Demand	Anodyne	ADRB3	16	44
O[C@@H](CN[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F)Cc1ccccc1	ZINC000450708334	GI	On-Demand	Anodyne	CTSF	41	35
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)CC1(O)CCC1	ZINC000450708339	EE	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)CC1(O)CCC1	ZINC000450708341	EE	On-Demand	Anodyne	TIMP3	45	32
CC(C)(C)OC1CC(Sc2nnc(-c3cccc(Cl)c3)o2)C1	ZINC000450708347	EJ	On-Demand	Anodyne	CYP73A16	15	46
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450708352	GD	On-Demand	Anodyne	ACE	33	44
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450708352	GD	On-Demand	Anodyne	UL80	23	42
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450708352	GD	On-Demand	Anodyne	CPT2	42	37
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450708352	GD	On-Demand	Anodyne	DPP4	25	48
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450708352	GD	On-Demand	Anodyne	PREP	142	70
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450708352	GD	On-Demand	Anodyne	SFRP1	110	54
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450708352	GD	On-Demand	Anodyne	WNT3	93	54
CC[C@@](C)(CNc1ccnc2cc(F)ccc12)OC	ZINC000450708355	CH	On-Demand	Anodyne	HRP1_PLAFA	86	36
CC[C@@](C)(CNc1ccnc2cc(F)ccc12)OC	ZINC000450708355	CH	On-Demand	Anodyne	HNMT	53	34
CC[C@](C)(CNc1ccnc2cc(F)ccc12)OC	ZINC000450708356	CH	On-Demand	Anodyne	HRP1_PLAFA	86	36
CC[C@](C)(CNc1ccnc2cc(F)ccc12)OC	ZINC000450708356	CH	On-Demand	Anodyne	HNMT	53	34
CC[C@](C)(CNc1c(C#N)cnc2c(OC)cc(OC)cc12)OC	ZINC000450708361	EG	On-Demand	Mild	SRC	45	37
CC[C@](C)(CNc1c(C#N)cnc2c(OC)cc(OC)cc12)OC	ZINC000450708361	EG	On-Demand	Mild	MAP2K1	0	40
CC[C@@](C)(CNc1c(C#N)cnc2c(OC)cc(OC)cc12)OC	ZINC000450708365	EG	On-Demand	Mild	SRC	45	37
C=C(C)CCNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450708374	FE	On-Demand	Mild	BCL2L1	49	41
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	ANPEP	16	40
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	MMP13	17	50
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	CAPNS1	52	58
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	MMP2	25	50
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	MMP3	20	50
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	CAPN1	55	63
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	MMP9	15	47
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	CAPN2	47	39
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	MMP7	15	41
C/C=C\C[C@@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708377	GE	On-Demand	Anodyne	PSMB5	29	40
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	ANPEP	16	40
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	MMP13	17	50
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	CAPNS1	52	58
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	MMP2	25	50
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	MMP3	20	50
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	CAPN1	55	63
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	MMP9	15	47
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	CAPN2	47	39
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	MMP7	15	41
C/C=C\C[C@H](CO)NC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc(C)cc1	ZINC000450708385	GE	On-Demand	Anodyne	PSMB5	29	40
C/C=C\C[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450708391	CD	On-Demand	Anodyne	SLC15A1	0	42
C/C=C\C[C@H](CO)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450708391	CD	On-Demand	Anodyne	POL	0	40
Cc1csc(NC2CCN(C(=O)c3cncc(Cl)c3)CC2)n1	ZINC000450708392	EG	On-Demand	Anodyne	TRPC6	52	40
Cc1csc(NC2CCN(C(=O)c3cncc(Cl)c3)CC2)n1	ZINC000450708392	EG	On-Demand	Anodyne	TRPC3	44	40
C/C=C\C[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450708393	CD	On-Demand	Anodyne	SLC15A1	0	42
C/C=C\C[C@H](CO)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450708393	CD	On-Demand	Anodyne	POL	0	40
COc1cc(OC)c(C[C@@H](C)Nc2nccn3c(C(C)C)nnc23)c(OC)c1	ZINC000450708401	GF	On-Demand	Anodyne	ZAP70	40	36
COc1cc(OC)c(C[C@H](C)Nc2nccn3c(C(C)C)nnc23)c(OC)c1	ZINC000450708402	GF	On-Demand	Anodyne	ZAP70	40	36
C/C=C\C[C@@H](CO)NC(=O)c1cnn2ccc(C)cc12	ZINC000450708412	CD	On-Demand	Anodyne	EPHB3	34	48
C/C=C\C[C@H](CO)NC(=O)c1cnn2ccc(C)cc12	ZINC000450708415	CD	On-Demand	Anodyne	EPHB3	34	48
C[C@@H]1C[C@@H](C(F)(F)F)CCN1c1ccc(C(F)(F)F)cn1	ZINC000450708422	DI	On-Demand	Anodyne	CXCR3	15	44
C[C@H]1C[C@H](C(F)(F)F)CCN1c1ccc(C(F)(F)F)cn1	ZINC000450708425	DI	On-Demand	Anodyne	CXCR3	15	44
CN(C)C(=O)CC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450708428	DG	On-Demand	Anodyne	SLC6A1	40	35
CN(C)C(=O)CC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450708428	DG	On-Demand	Anodyne	SIGMAR1	29	45
CN(C)C(=O)CC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450708428	DG	On-Demand	Anodyne	CYP2J2	43	31
C[C@H]1C[C@@H](C(F)(F)F)CCN1c1ccc(C(F)(F)F)cn1	ZINC000450708429	DI	On-Demand	Anodyne	CXCR3	15	44
CN(C)C(=O)CC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450708430	DG	On-Demand	Anodyne	SLC6A1	40	35
CN(C)C(=O)CC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450708430	DG	On-Demand	Anodyne	SIGMAR1	29	45
CN(C)C(=O)CC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450708430	DG	On-Demand	Anodyne	CYP2J2	43	31
C[C@@H]1C[C@H](C(F)(F)F)CCN1c1ccc(C(F)(F)F)cn1	ZINC000450708432	DI	On-Demand	Anodyne	CXCR3	15	44
C=CCOc1ccc(CC(=O)N2CCn3ncnc3C2)cc1	ZINC000450708442	CD	On-Demand	Mild	GPR183	0	40
CCOC(=O)C1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CC1	ZINC000450708454	GF	On-Demand	Anodyne	HCN1	78	38
CCOC(=O)C1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CC1	ZINC000450708454	GF	On-Demand	Anodyne	HCN4	55	38
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)[nH]c1C	ZINC000450708461	GF	On-Demand	Anodyne	HTR1A	16	42
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)[nH]c1C	ZINC000450708461	GF	On-Demand	Anodyne	PRNP	36	43
O=C(NC1CCCC1)c1ccc(N2CC[C@@](O)(C(F)F)C2)nn1	ZINC000450708463	ED	On-Demand	Anodyne	SCD1	43	38
O=C(NC1CCCC1)c1ccc(N2CC[C@](O)(C(F)F)C2)nn1	ZINC000450708464	ED	On-Demand	Anodyne	SCD1	43	38
CNS(=O)(=O)NCC(=O)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450708466	FB	On-Demand	Anodyne	PREP	24	45
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ncc(C(F)(F)F)s1	ZINC000450708468	DG	On-Demand	Anodyne	MLYCD	46	36
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ncc(C(F)(F)F)s1	ZINC000450708471	DG	On-Demand	Anodyne	MLYCD	46	36
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ncc(C(F)(F)F)s1	ZINC000450708472	DG	On-Demand	Anodyne	MLYCD	46	36
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ncc(C(F)(F)F)s1	ZINC000450708473	DG	On-Demand	Anodyne	MLYCD	46	36
CCCOc1cccc(Cn2cc(S(=O)(=O)N(C)C)ccc2=O)c1	ZINC000450708482	FD	On-Demand	Anodyne	UPP1	46	41
CCCOc1cccc(Cn2cc(S(=O)(=O)N(C)C)ccc2=O)c1	ZINC000450708482	FD	On-Demand	Anodyne	SQLE	43	35
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	SLC6A1	79	35
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	HRH1	23	42
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	HTR4	55	38
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	LTA4H	24	41
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	HRH3	24	41
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	SIGMAR1	40	50
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	NPY1R	42	38
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	CCR3	33	41
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	PLA2G4B	41	30
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	CHRNA10	44	42
CCC(=O)CCCN1CC[C@H](COc2ccccc2)C1	ZINC000450708490	CG	On-Demand	Anodyne	CYP2J2	52	37
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	SLC6A1	79	35
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	HRH1	23	42
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	HTR4	55	38
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	LTA4H	24	41
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	HRH3	24	41
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	SIGMAR1	40	50
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	NPY1R	42	38
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	CCR3	33	41
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	PLA2G4B	41	30
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	CHRNA10	44	42
CCC(=O)CCCN1CC[C@@H](COc2ccccc2)C1	ZINC000450708492	CG	On-Demand	Anodyne	CYP2J2	52	37
CCOC(=O)C1(CNC(=O)c2cc(Cl)c(F)cc2Br)CC1	ZINC000450708496	GG	On-Demand	Anodyne	SLC6A9	47	40
CCOC(=O)C1(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450708518	GG	On-Demand	Anodyne	PYGL	58	39
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCC1(CO)CCCC1	ZINC000450708529	CF	On-Demand	Anodyne	ACAT	0	43
CCN1CCN(c2cccc(NC(=O)Cc3ccc(C(=O)OC)cc3)c2)CC1	ZINC000450708531	GF	On-Demand	Anodyne	HTR1A	33	53
CCN1CCN(c2cccc(NC(=O)Cc3ccc(C(=O)OC)cc3)c2)CC1	ZINC000450708531	GF	On-Demand	Anodyne	DRD2	19	49
CCN1CCN(c2cccc(NC(=O)Cc3ccc(C(=O)OC)cc3)c2)CC1	ZINC000450708531	GF	On-Demand	Anodyne	DRD4	43	34
CCN1CCN(c2cccc(NC(=O)Cc3ccc(C(=O)OC)cc3)c2)CC1	ZINC000450708531	GF	On-Demand	Anodyne	HTR7	21	48
CCN1CCN(c2cccc(NC(=O)Cc3ccc(C(=O)OC)cc3)c2)CC1	ZINC000450708531	GF	On-Demand	Anodyne	PRNP	36	44
CCOC(=O)C1(CNC(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450708533	DF	On-Demand	Anodyne	HCN1	54	35
CCOC(=O)C1(CNC(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450708533	DF	On-Demand	Anodyne	HCN4	52	35
CCN1CCN(c2cccc(NC(=O)c3cc4cccnc4s3)c2)CC1	ZINC000450708534	FH	On-Demand	Anodyne	EGFR	0	41
CCN1CCN(c2cccc(NC(=O)c3cc4cccnc4s3)c2)CC1	ZINC000450708534	FH	On-Demand	Anodyne	DRD3	17	46
CCN1CCN(c2cccc(NC(=O)c3cc4cccnc4s3)c2)CC1	ZINC000450708534	FH	On-Demand	Anodyne	PRNP	62	45
Cc1csc(C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)c1	ZINC000450708538	EG	On-Demand	Anodyne	UTS2R	0	42
O=C(COc1ccc(Cl)cc1F)NCCCN1CCCCCC1=O	ZINC000450708552	FF	On-Demand	Anodyne	HNMT	45	31
O=C(COc1ccc(Cl)cc1F)NCCCN1CCCCCC1=O	ZINC000450708552	FF	On-Demand	Anodyne	TYRO3	25	43
COc1ccc([C@@H](NCC2(C#N)CCC2)C(F)(F)F)cc1	ZINC000450708554	CH	On-Demand	Mild	CTSK	25	43
O=C(Nc1c[nH]nc1[C@@H]1CCCN(CC/C=C\c2ccccc2)C1)C1CCCC1	ZINC000450708564	GJ	On-Demand	Anodyne	SLC6A1	144	40
CCOC(=O)c1c(N2C[C@H](F)[C@H](F)C2)nc2ccccc2c1C	ZINC000450708565	DG	On-Demand	Anodyne	GABRA1	19	40
CCOC(=O)c1c(N2C[C@H](F)[C@H](F)C2)nc2ccccc2c1C	ZINC000450708565	DG	On-Demand	Anodyne	TSPO	19	43
O=C(Nc1c[nH]nc1[C@H]1CCCN(CC/C=C/c2ccccc2)C1)C1CCCC1	ZINC000450708567	GJ	On-Demand	Anodyne	SLC6A1	144	40
O=C(Nc1c[nH]nc1[C@H]1CCCN(CC/C=C\c2ccccc2)C1)C1CCCC1	ZINC000450708568	GJ	On-Demand	Anodyne	SLC6A1	144	40
O=C(Nc1c[nH]nc1[C@@H]1CCCN(CC/C=C/c2ccccc2)C1)C1CCCC1	ZINC000450708571	GJ	On-Demand	Anodyne	SLC6A1	144	40
CCC(=O)CCCN1CCC(CCCN2CCOCC2)CC1	ZINC000450708585	DF	On-Demand	Anodyne	CYP2J2	48	34
CCN1CCN(c2cccc(NC(=O)CCCn3nc(C)nc3C)c2)CC1	ZINC000450708598	FE	On-Demand	Anodyne	HTR1A	35	49
CCN1CCN(c2cccc(NC(=O)CCCn3nc(C)nc3C)c2)CC1	ZINC000450708598	FE	On-Demand	Anodyne	HTR2A	27	40
CCN1CCN(c2cccc(NC(=O)CCCn3nc(C)nc3C)c2)CC1	ZINC000450708598	FE	On-Demand	Anodyne	HTR7	51	41
CC(=O)[C@@](C)(O)CN[C@H](c1cccnc1)C1CC1	ZINC000450708608	BD	On-Demand	Anodyne	KCNA5	61	38
CC(=O)[C@@](C)(O)CN[C@@H](c1cccnc1)C1CC1	ZINC000450708609	BD	On-Demand	Anodyne	KCNA5	61	38
CC(=O)[C@](C)(O)CN[C@H](c1cccnc1)C1CC1	ZINC000450708610	BD	On-Demand	Anodyne	KCNA5	61	38
CC(=O)[C@](C)(O)CN[C@@H](c1cccnc1)C1CC1	ZINC000450708611	BD	On-Demand	Anodyne	KCNA5	61	38
COCCOC[C@H](O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450708628	FF	On-Demand	Mild	MCHR1	15	40
COCCOC[C@@H](O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450708629	FF	On-Demand	Mild	MCHR1	15	40
COCCOC[C@H](O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450708630	FF	On-Demand	Mild	MCHR1	15	40
COCCOC[C@@H](O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450708631	FF	On-Demand	Mild	MCHR1	15	40
CN(C)CCN(C(=O)c1cc(F)c2ccccc2c1)C1CC1	ZINC000450708633	DG	On-Demand	Anodyne	C5AR1	16	40
CCOC(=O)[C@@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450708652	FD	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)[C@@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450708652	FD	On-Demand	Anodyne	TRPC6	60	33
CCOC(=O)[C@@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450708652	FD	On-Demand	Anodyne	TRPC3	46	33
CCOC(=O)[C@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450708653	FD	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)[C@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450708653	FD	On-Demand	Anodyne	TRPC6	60	33
CCOC(=O)[C@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450708653	FD	On-Demand	Anodyne	TRPC3	46	33
COc1cc(OC)c2ncnc(NCc3ncc(C(F)(F)F)cn3)c2c1	ZINC000450708658	FE	On-Demand	Anodyne	PDE6A	43	33
CC(=O)c1ccc(CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)cc1	ZINC000450708676	GH	On-Demand	Anodyne	RBP4	76	37
CC(=O)c1ccc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)cc1	ZINC000450708677	GH	On-Demand	Anodyne	RBP4	76	37
Cc1ccccc1-c1nnc(SCCC(C)(F)F)n1Cc1ccco1	ZINC000450708693	FK	On-Demand	Anodyne	HCRTR2	23	48
O=C(CCCN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)c1ccccc1	ZINC000450708694	FI	On-Demand	Anodyne	HTR2A	16	44
O=C(CCCN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)c1ccccc1	ZINC000450708694	FI	On-Demand	Anodyne	SLC6A1	142	40
O=C(CCCN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1)c1ccccc1	ZINC000450708694	FI	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)c1ccccc1	ZINC000450708695	FI	On-Demand	Anodyne	HTR2A	16	44
O=C(CCCN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)c1ccccc1	ZINC000450708695	FI	On-Demand	Anodyne	SLC6A1	142	40
O=C(CCCN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1)c1ccccc1	ZINC000450708695	FI	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)C1(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CC1	ZINC000450708698	EH	On-Demand	Mild	MCHR1	36	44
COC(=O)CNC(=O)c1ccc(NCCc2scnc2C)c([N+](=O)[O-])c1	ZINC000450708700	GD	On-Demand	Bother	TAAR1	19	44
Cc1noc(C2(C)CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450708704	EG	On-Demand	Anodyne	DRD2	31	43
Cc1noc(C2(C)CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450708704	EG	On-Demand	Anodyne	DRD4	0	42
Cc1noc(C2(C)CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450708704	EG	On-Demand	Anodyne	ADRA1A	22	42
Cc1noc(C2(C)CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450708704	EG	On-Demand	Anodyne	SLC18A3	0	46
Cc1noc(C2(C)CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450708704	EG	On-Demand	Anodyne	CYP2J2	64	47
CCS(=O)(=O)c1ccc(CN[C@@H](CO)c2cccc(F)c2)cc1	ZINC000450708707	EE	On-Demand	Anodyne	RORC	41	36
CCS(=O)(=O)c1ccc(CN[C@H](CO)c2cccc(F)c2)cc1	ZINC000450708708	EE	On-Demand	Anodyne	RORC	41	36
COC(=O)C[C@@H](NC(=O)c1cn(CC2CC2)nn1)c1ccc2ccccc2c1	ZINC000450708715	GF	On-Demand	Anodyne	UTS2	38	40
COC(=O)C[C@H](NC(=O)c1cn(CC2CC2)nn1)c1ccc2ccccc2c1	ZINC000450708716	GF	On-Demand	Anodyne	UTS2	38	40
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450708719	GF	On-Demand	Anodyne	CAPN2	45	34
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450708720	GF	On-Demand	Anodyne	CAPN2	45	34
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450708721	GF	On-Demand	Anodyne	CAPN2	45	34
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450708722	GF	On-Demand	Anodyne	CAPN2	45	34
Cc1csc(NC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)n1	ZINC000450708732	FF	On-Demand	Anodyne	C3AR1	41	38
Cc1csc(NC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)n1	ZINC000450708732	FF	On-Demand	Anodyne	MLNR	23	42
Cc1csc(NC2CCN(C(=O)CCc3ccc(C(N)=O)cc3)CC2)n1	ZINC000450708732	FF	On-Demand	Anodyne	TRPC6	48	36
CCOC(=O)[C@@H](NCCN(C)Cc1ccccc1)[C@@H]1CCCOC1	ZINC000450708735	EE	On-Demand	Anodyne	AMY2	43	31
CCOC(=O)[C@H](NCCN(C)Cc1ccccc1)[C@@H]1CCCOC1	ZINC000450708736	EE	On-Demand	Anodyne	AMY2	43	31
CCOC(=O)[C@@H](NCCN(C)Cc1ccccc1)[C@H]1CCCOC1	ZINC000450708737	EE	On-Demand	Anodyne	AMY2	43	31
CCOC(=O)[C@H](NCCN(C)Cc1ccccc1)[C@H]1CCCOC1	ZINC000450708738	EE	On-Demand	Anodyne	AMY2	43	31
Cc1csc(NC2CCN(C(=O)CSC3CC3)CC2)n1	ZINC000450708739	DF	On-Demand	Anodyne	TRPC6	45	34
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H](CO)c1ccc(F)cc1	ZINC000450708749	DF	On-Demand	Anodyne	MAN1	0	40
C[C@H](c1ccccc1)[C@H](O)CN[C@H](CO)c1ccc(F)cc1	ZINC000450708750	DF	On-Demand	Anodyne	MAN1	0	40
C[C@H](c1ccccc1)[C@H](O)CN[C@@H](CO)c1ccc(F)cc1	ZINC000450708751	DF	On-Demand	Anodyne	MAN1	0	40
C[C@H](c1ccccc1)[C@@H](O)CN[C@H](CO)c1ccc(F)cc1	ZINC000450708752	DF	On-Demand	Anodyne	MAN1	0	40
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450708755	EE	On-Demand	Anodyne	HTR4	15	43
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450708756	EE	On-Demand	Anodyne	HTR4	15	43
O=C(c1ccc(I)cc1F)N1CCCC2(CC2)C1	ZINC000450708773	FG	On-Demand	Anodyne	MAP2K1	17	42
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708780	GG	On-Demand	Anodyne	SLC6A1	43	38
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708780	GG	On-Demand	Anodyne	MC4R	31	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708780	GG	On-Demand	Anodyne	PRCP	55	34
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708780	GG	On-Demand	Anodyne	PLD1	41	38
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708780	GG	On-Demand	Anodyne	MC3R	37	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708780	GG	On-Demand	Anodyne	MC5R	36	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708781	GG	On-Demand	Anodyne	SLC6A1	43	38
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708781	GG	On-Demand	Anodyne	MC4R	31	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708781	GG	On-Demand	Anodyne	PRCP	55	34
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708781	GG	On-Demand	Anodyne	PLD1	41	38
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708781	GG	On-Demand	Anodyne	MC3R	37	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708781	GG	On-Demand	Anodyne	MC5R	36	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708783	GG	On-Demand	Anodyne	SLC6A1	43	38
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708783	GG	On-Demand	Anodyne	MC4R	31	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708783	GG	On-Demand	Anodyne	PRCP	55	34
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708783	GG	On-Demand	Anodyne	PLD1	41	38
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708783	GG	On-Demand	Anodyne	MC3R	37	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450708783	GG	On-Demand	Anodyne	MC5R	36	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708784	GG	On-Demand	Anodyne	SLC6A1	43	38
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708784	GG	On-Demand	Anodyne	MC4R	31	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708784	GG	On-Demand	Anodyne	PRCP	55	34
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708784	GG	On-Demand	Anodyne	PLD1	41	38
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708784	GG	On-Demand	Anodyne	MC3R	37	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450708784	GG	On-Demand	Anodyne	MC5R	36	41
Cc1csc(NC2CCN(C(=O)c3cccc4c3CCCC4)CC2)n1	ZINC000450708794	FI	On-Demand	Anodyne	TRPC6	63	36
Cc1csc(NC2CCN(C(=O)c3cccc4c3CCCC4)CC2)n1	ZINC000450708794	FI	On-Demand	Anodyne	TRPC3	43	36
O=C(CCCC(=O)C1CC1)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450708805	FH	On-Demand	Anodyne	HDAC10	38	49
O=C(CCCC(=O)C1CC1)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450708805	FH	On-Demand	Anodyne	HDAC2	23	49
O=C(CCCC(=O)C1CC1)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450708805	FH	On-Demand	Anodyne	HDAC3	49	49
O=C(CCCC(=O)C1CC1)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450708805	FH	On-Demand	Anodyne	HDAC6	39	49
CSc1cccc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)c1	ZINC000450708814	EH	On-Demand	Anodyne	TRPC6	50	37
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	ADORA1	58	47
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	ADORA2A	24	45
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	ADORA2B	28	44
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	AHCY	51	35
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	P2RY1	56	39
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	ADORA3	89	44
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	OXGR1	99	36
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	DNMT3B	44	38
C=C(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000450708849	BF	On-Demand	Mild	Q4VQ11_PIG	55	44
COC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1Cl	ZINC000450708850	FI	On-Demand	Anodyne	HRH1	17	41
COC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1Cl	ZINC000450708850	FI	On-Demand	Anodyne	SIGMAR1	23	42
COC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1Cl	ZINC000450708850	FI	On-Demand	Anodyne	SSTR5	66	41
COC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1Cl	ZINC000450708850	FI	On-Demand	Anodyne	CXCR3	26	40
COC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1Cl	ZINC000450708850	FI	On-Demand	Anodyne	MCHR1	52	44
CCOC(=O)c1sc2ncnc(NC[C@](C)(CC)OC)c2c1C	ZINC000450708860	EG	On-Demand	Anodyne	MKNK2	19	40
CCOC(=O)c1sc2ncnc(NC[C@@](C)(CC)OC)c2c1C	ZINC000450708861	EG	On-Demand	Anodyne	MKNK2	19	40
CCn1c(O)nnc1SCc1nc(-c2cc(OC)ncn2)no1	ZINC000450708875	ED	On-Demand	Anodyne	AXIN2	0	42
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450708876	EG	On-Demand	Anodyne	RBP4	17	40
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450708877	EG	On-Demand	Anodyne	RBP4	17	40
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450708878	EG	On-Demand	Anodyne	RBP4	17	40
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450708879	EG	On-Demand	Anodyne	RBP4	17	40
CCCOc1ccc(C(=O)N2CCC([C@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450708902	FF	On-Demand	Anodyne	OXTR	27	40
CCCOc1ccc(C(=O)N2CCC([C@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450708902	FF	On-Demand	Anodyne	ACACA	53	40
CCCOc1ccc(C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450708907	FF	On-Demand	Anodyne	OXTR	27	40
CCCOc1ccc(C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450708907	FF	On-Demand	Anodyne	ACACA	53	40
CCN(CC)S(=O)(=O)c1ccc(NC[C@](C)(CC)OC)c([N+](=O)[O-])c1	ZINC000450708928	FF	On-Demand	Bother	BDKRB1	24	48
CCN(CC)S(=O)(=O)c1ccc(NC[C@](C)(CC)OC)c([N+](=O)[O-])c1	ZINC000450708928	FF	On-Demand	Bother	COLA	42	34
CCN(CC)S(=O)(=O)c1ccc(NC[C@@](C)(CC)OC)c([N+](=O)[O-])c1	ZINC000450708929	FF	On-Demand	Bother	BDKRB1	24	48
CCN(CC)S(=O)(=O)c1ccc(NC[C@@](C)(CC)OC)c([N+](=O)[O-])c1	ZINC000450708929	FF	On-Demand	Bother	COLA	42	34
CC[C@@](C)(CNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)OC	ZINC000450708932	GI	On-Demand	Anodyne	NPBWR1	57	39
CC[C@](C)(CNc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)OC	ZINC000450708934	GI	On-Demand	Anodyne	NPBWR1	57	39
O=S(=O)([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)N1CCOCC1	ZINC000450708977	FE	On-Demand	Anodyne	HRH3	19	44
O=S(=O)([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)N1CCOCC1	ZINC000450708977	FE	On-Demand	Anodyne	BIRC2	36	43
O=S(=O)([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)N1CCOCC1	ZINC000450708977	FE	On-Demand	Anodyne	L3MBTL3	27	40
O=S(=O)([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)N1CCOCC1	ZINC000450708978	FE	On-Demand	Anodyne	HRH3	19	44
O=S(=O)([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)N1CCOCC1	ZINC000450708978	FE	On-Demand	Anodyne	BIRC2	36	43
O=S(=O)([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)N1CCOCC1	ZINC000450708978	FE	On-Demand	Anodyne	L3MBTL3	27	40
Cc1cccc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)n1	ZINC000450708979	GH	On-Demand	Anodyne	SLC6A1	50	35
Cc1cccc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)n1	ZINC000450708980	GH	On-Demand	Anodyne	SLC6A1	50	35
CCCCn1c(O)nnc1SCc1cccc(C(=O)OC)c1Cl	ZINC000450708993	FH	On-Demand	Anodyne	AGTR1	26	48
O=C(NCC1(CO)CCCC1)c1ccn(CCc2ccccc2)n1	ZINC000450708999	EE	On-Demand	Anodyne	HCN1	54	33
O=C(NCC1(CO)CCCC1)c1ccn(CCc2ccccc2)n1	ZINC000450708999	EE	On-Demand	Anodyne	HCN4	52	33
COC(=O)C[C@H](NC(=O)CSC1CC1)c1ccc2ccccc2c1	ZINC000450709007	EG	On-Demand	Anodyne	UTS2	32	41
COC(=O)C[C@@H](NC(=O)CSC1CC1)c1ccc2ccccc2c1	ZINC000450709008	EG	On-Demand	Anodyne	UTS2	32	41
C[C@H](O)[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450709010	DH	On-Demand	Anodyne	SIGMAR1	26	45
C[C@H](O)[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450709011	DH	On-Demand	Anodyne	SIGMAR1	26	45
C[C@H](O)[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450709012	DH	On-Demand	Anodyne	SIGMAR1	26	45
C[C@H](O)[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450709013	DH	On-Demand	Anodyne	SIGMAR1	26	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2C[C@H](F)[C@H](F)C2)nc1	ZINC000450709019	EG	On-Demand	Anodyne	HDAC1	34	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2C[C@H](F)[C@H](F)C2)nc1	ZINC000450709019	EG	On-Demand	Anodyne	GRM5	22	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2C[C@H](F)[C@H](F)C2)nc1	ZINC000450709019	EG	On-Demand	Anodyne	RPS6KA3	23	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2C[C@H](F)[C@H](F)C2)nc1	ZINC000450709019	EG	On-Demand	Anodyne	TAAR1	38	52
O=C(Nc1cccc(Cl)c1)c1ccc(N2C[C@H](F)[C@H](F)C2)nc1	ZINC000450709019	EG	On-Demand	Anodyne	KCNK3	71	39
O=C(Nc1cccc(Cl)c1)c1ccc(N2C[C@H](F)[C@H](F)C2)nc1	ZINC000450709019	EG	On-Demand	Anodyne	KCNK9	32	42
O=C(c1cccc2c1CCCC2)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450709035	FH	On-Demand	Anodyne	FABP4	45	45
O=C(NCC1(CO)CCCC1)c1cc2ccncc2s1	ZINC000450709038	CF	On-Demand	Anodyne	NAMPT	22	42
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)C[C@H]2C(=O)OC)nc1	ZINC000450709048	FD	On-Demand	Anodyne	PTR1	54	39
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)C[C@@H]2C(=O)OC)nc1	ZINC000450709049	FD	On-Demand	Anodyne	PTR1	54	39
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)OC)C[C@@H]2C(=O)OC)nc1	ZINC000450709050	FD	On-Demand	Anodyne	PTR1	54	39
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)OC)C[C@H]2C(=O)OC)nc1	ZINC000450709051	FD	On-Demand	Anodyne	PTR1	54	39
COC(=O)c1cccc(CN[C@@H](c2ccc(OC)cc2)C(F)(F)F)c1Cl	ZINC000450709062	GJ	On-Demand	Anodyne	CTSK	16	42
COC(=O)c1cccc(CN[C@H](c2ccc(OC)cc2)C(F)(F)F)c1Cl	ZINC000450709063	GJ	On-Demand	Anodyne	CTSK	16	42
CCCCCN(CC(N)=O)Cc1nc(-c2ccc(OC)nn2)no1	ZINC000450709067	ED	On-Demand	Anodyne	TSPO	19	42
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450709068	FE	On-Demand	Anodyne	DRD2	40	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450709068	FE	On-Demand	Anodyne	DRD4	17	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450709068	FE	On-Demand	Anodyne	HTR4	49	37
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450709068	FE	On-Demand	Anodyne	SIGMAR1	15	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H](C(=O)OC)C1	ZINC000450709069	FE	On-Demand	Anodyne	DRD2	40	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H](C(=O)OC)C1	ZINC000450709069	FE	On-Demand	Anodyne	DRD4	17	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H](C(=O)OC)C1	ZINC000450709069	FE	On-Demand	Anodyne	HTR4	49	37
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H](C(=O)OC)C1	ZINC000450709069	FE	On-Demand	Anodyne	SIGMAR1	15	41
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450709070	FE	On-Demand	Anodyne	DRD2	40	41
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450709070	FE	On-Demand	Anodyne	DRD4	17	41
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450709070	FE	On-Demand	Anodyne	HTR4	49	37
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1Cc1ccc(Cl)c(OC)c1	ZINC000450709070	FE	On-Demand	Anodyne	SIGMAR1	15	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450709071	FE	On-Demand	Anodyne	DRD2	40	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450709071	FE	On-Demand	Anodyne	DRD4	17	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450709071	FE	On-Demand	Anodyne	HTR4	49	37
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450709071	FE	On-Demand	Anodyne	SIGMAR1	15	41
CCOC(=O)C1(CNC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450709074	CD	On-Demand	Anodyne	CAN2	0	40
Cc1ccc(NC(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)nc2)cc1	ZINC000450709076	DG	On-Demand	Anodyne	PRNP	67	42
Cc1ccc(NC(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)nc2)cc1	ZINC000450709076	DG	On-Demand	Anodyne	HDAC1	21	44
Cc1ccc(NC(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)nc2)cc1	ZINC000450709076	DG	On-Demand	Anodyne	P4HTM	0	54
Cc1ccc(NC(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)nc2)cc1	ZINC000450709076	DG	On-Demand	Anodyne	SHH	16	40
Cc1ccc(NC(=O)c2ccc(N3C[C@H](F)[C@H](F)C3)nc2)cc1	ZINC000450709076	DG	On-Demand	Anodyne	DGAT1	47	39
CCNC(=O)c1ccc(N2C[C@H](F)[C@H](F)C2)nn1	ZINC000450709086	CC	On-Demand	Anodyne	SCD1	39	40
CCNC(=O)c1ccc(N2C[C@H](F)[C@H](F)C2)nn1	ZINC000450709086	CC	On-Demand	Anodyne	SCD	25	45
COc1cccc(Oc2ccc(C(=O)NCC3(CO)CCCC3)nc2)c1	ZINC000450709090	FG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(Oc2ccc(C(=O)NCC3(CO)CCCC3)nc2)c1	ZINC000450709090	FG	On-Demand	Anodyne	MTNR1A	39	42
COc1cccc(Oc2ccc(C(=O)NCC3(CO)CCCC3)nc2)c1	ZINC000450709090	FG	On-Demand	Anodyne	MTNR1B	36	43
COc1ccc2c(c1)nc(CNC(=O)Cc1ccccc1O[C@H]1CCOC1)n2C	ZINC000450709092	GF	On-Demand	Anodyne	MTNR1A	48	34
COc1ccc2c(c1)nc(CNC(=O)Cc1ccccc1O[C@@H]1CCOC1)n2C	ZINC000450709093	GF	On-Demand	Anodyne	MTNR1A	48	34
C/C=C/C[C@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450709095	CE	On-Demand	Anodyne	AKT1	50	31
C/C=C/C[C@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450709095	CE	On-Demand	Anodyne	PIN1	26	41
C/C=C\C[C@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450709096	CE	On-Demand	Anodyne	AKT1	50	31
C/C=C\C[C@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450709096	CE	On-Demand	Anodyne	PIN1	26	41
C/C=C\C[C@@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450709097	CE	On-Demand	Anodyne	AKT1	50	31
C/C=C\C[C@@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450709097	CE	On-Demand	Anodyne	PIN1	26	41
C/C=C/C[C@@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450709098	CE	On-Demand	Anodyne	AKT1	50	31
C/C=C/C[C@@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450709098	CE	On-Demand	Anodyne	PIN1	26	41
Cc1ncsc1CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450709113	FF	On-Demand	Anodyne	METG	70	32
COC(=O)C1(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CC1	ZINC000450709120	EH	On-Demand	Mild	MCHR1	36	44
CC(C)c1nccc(N2CCC[C@@H](O)[C@H]2C)n1	ZINC000450709128	BD	On-Demand	Anodyne	SORD	67	40
CC(C)c1nccc(N2CCC[C@H](O)[C@H]2C)n1	ZINC000450709130	BD	On-Demand	Anodyne	SORD	67	40
CC(C)c1nccc(N2CCC[C@H](O)[C@@H]2C)n1	ZINC000450709131	BD	On-Demand	Anodyne	SORD	67	40
CC(C)c1nccc(N2CCC[C@@H](O)[C@@H]2C)n1	ZINC000450709133	BD	On-Demand	Anodyne	SORD	67	40
Cc1ccnc(OC2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)c1	ZINC000450709144	FG	On-Demand	Anodyne	SCN9A	0	42
Cc1ccnc(OC2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)c1	ZINC000450709144	FG	On-Demand	Anodyne	SCN5A	77	42
COC(=O)c1ccc(CN2CCC(C)(c3nc(C)no3)CC2)cc1Cl	ZINC000450709153	FG	On-Demand	Anodyne	ADAM17	15	42
COc1ccc(CNC(=O)CCN[C@@H](CO)c2c(F)cccc2F)c(OC)c1	ZINC000450709183	GE	On-Demand	Anodyne	MTNR1A	68	40
COc1ccc(CNC(=O)CCN[C@@H](CO)c2c(F)cccc2F)c(OC)c1	ZINC000450709183	GE	On-Demand	Anodyne	MTNR1B	58	40
COc1ccc(CNC(=O)CCN[C@H](CO)c2c(F)cccc2F)c(OC)c1	ZINC000450709200	GE	On-Demand	Anodyne	MTNR1A	68	40
COc1ccc(CNC(=O)CCN[C@H](CO)c2c(F)cccc2F)c(OC)c1	ZINC000450709200	GE	On-Demand	Anodyne	MTNR1B	58	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)CCN1CCN(C)CC1	ZINC000450709236	FF	On-Demand	Anodyne	CCR2	55	37
CC(C)c1nnc(Cn2cnc3ccc(Cl)cc3c2=O)s1	ZINC000450709240	DG	On-Demand	Anodyne	SCD1	16	44
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)CCN1CCN(C)CC1	ZINC000450709241	FF	On-Demand	Anodyne	CCR2	55	37
COc1ccc2ccc(C(=O)N(CCN(C)C)C3CC3)cc2c1	ZINC000450709265	DG	On-Demand	Anodyne	MTNR1B	34	40
COc1ccc2ccc(C(=O)N(CCN(C)C)C3CC3)cc2c1	ZINC000450709265	DG	On-Demand	Anodyne	UTS2	36	40
COc1ccc2ccc(C(=O)N(CCN(C)C)C3CC3)cc2c1	ZINC000450709265	DG	On-Demand	Anodyne	MBTPS1	47	35
CC[C@H](CC(F)(F)F)C(=O)Nc1nc2c(OC)cccc2n1C	ZINC000450709296	EG	On-Demand	Anodyne	TLR8	0	45
CC[C@@H](CC(F)(F)F)C(=O)Nc1nc2c(OC)cccc2n1C	ZINC000450709297	EG	On-Demand	Anodyne	TLR8	0	45
C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc2ccncc2s1	ZINC000450709298	EE	On-Demand	Anodyne	TACR2	46	43
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709306	GH	On-Demand	Anodyne	MC4R	76	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709306	GH	On-Demand	Anodyne	PRCP	60	41
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709306	GH	On-Demand	Anodyne	MC3R	51	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709306	GH	On-Demand	Anodyne	MC5R	44	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709306	GH	On-Demand	Anodyne	MC1R	33	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709307	GH	On-Demand	Anodyne	MC4R	76	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709307	GH	On-Demand	Anodyne	PRCP	60	41
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709307	GH	On-Demand	Anodyne	MC3R	51	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709307	GH	On-Demand	Anodyne	MC5R	44	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709307	GH	On-Demand	Anodyne	MC1R	33	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709308	GH	On-Demand	Anodyne	MC4R	76	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709308	GH	On-Demand	Anodyne	PRCP	60	41
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709308	GH	On-Demand	Anodyne	MC3R	51	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709308	GH	On-Demand	Anodyne	MC5R	44	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709308	GH	On-Demand	Anodyne	MC1R	33	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709309	GH	On-Demand	Anodyne	MC4R	76	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709309	GH	On-Demand	Anodyne	PRCP	60	41
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709309	GH	On-Demand	Anodyne	MC3R	51	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709309	GH	On-Demand	Anodyne	MC5R	44	56
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450709309	GH	On-Demand	Anodyne	MC1R	33	40
CC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)C(C)(C)C	ZINC000450709327	GE	On-Demand	Anodyne	SCN9A	0	43
CC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)C(C)(C)C	ZINC000450709327	GE	On-Demand	Anodyne	RBP4	52	34
CC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)C(C)(C)C	ZINC000450709328	GE	On-Demand	Anodyne	SCN9A	0	43
CC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)C(C)(C)C	ZINC000450709328	GE	On-Demand	Anodyne	RBP4	52	34
O=C(CC1(O)CCC1)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450709333	DH	On-Demand	Anodyne	ATF1	59	41
O=C(CC1(O)CCC1)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450709333	DH	On-Demand	Anodyne	NFKB1	54	41
COC(=O)c1csc(CN2CCC(c3ccc(C)nc3)CC2)n1	ZINC000450709334	EG	On-Demand	Anodyne	MGEA5	26	41
O=C1[C@@H](N2CCN(CC3CC(F)(F)C3)CC2)CCCN1Cc1ccccc1	ZINC000450709339	GF	On-Demand	Anodyne	SIGMAR1	23	41
O=C1[C@H](N2CCN(CC3CC(F)(F)C3)CC2)CCCN1Cc1ccccc1	ZINC000450709340	GF	On-Demand	Anodyne	SIGMAR1	23	41
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@](O)(C(F)F)C1	ZINC000450709341	FF	On-Demand	Anodyne	ATP4A	19	49
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@](O)(C(F)F)C1	ZINC000450709342	FF	On-Demand	Anodyne	ATP4A	19	49
CCOc1ccccc1-c1nnc(SCC(=O)CC(C)(C)C2CC2)o1	ZINC000450709380	FJ	On-Demand	Anodyne	ALOX15	59	38
CC[C@@H](CO)N(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450709404	FG	On-Demand	Anodyne	LIMK2	40	38
CC[C@@H](CO)N(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450709404	FG	On-Demand	Anodyne	RORC	35	46
Cc1nc(NCC2(N(C)Cc3ccccc3)CCC2)ncc1[N+](=O)[O-]	ZINC000450709446	EG	On-Demand	Bother	PRKCQ	44	39
CCCc1nc(C)c(CSc2nnc(-c3cccc(Cl)c3)o2)o1	ZINC000450709454	EJ	On-Demand	Anodyne	GSK3B	17	47
CCCc1nc(C)c(CSc2nnc(-c3cccc(Cl)c3)o2)o1	ZINC000450709454	EJ	On-Demand	Anodyne	GSK3A	47	37
CCCc1nc(C)c(CSc2nnc(-c3cccc(Cl)c3)o2)o1	ZINC000450709454	EJ	On-Demand	Anodyne	TERT	25	46
C[C@@H]1C[C@@H](C(F)(F)F)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450709473	DG	On-Demand	Anodyne	CXCR3	30	44
C[C@H]1C[C@@H](C(F)(F)F)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450709474	DG	On-Demand	Anodyne	CXCR3	30	44
C[C@H]1C[C@H](C(F)(F)F)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450709475	DG	On-Demand	Anodyne	CXCR3	30	44
C[C@@H]1C[C@H](C(F)(F)F)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450709476	DG	On-Demand	Anodyne	CXCR3	30	44
CCNC(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)nc1	ZINC000450709493	CD	On-Demand	Anodyne	HDAC1	23	41
CCNC(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1	ZINC000450709494	CD	On-Demand	Anodyne	HDAC1	23	41
CCOC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450709503	EE	On-Demand	Anodyne	P2RY12	94	38
CCOC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450709503	EE	On-Demand	Anodyne	HCN1	40	32
COc1ccc(CC(=O)NCC2(CO)CCCC2)c(Cl)c1OC	ZINC000450709505	EF	On-Demand	Anodyne	CPT1A	43	30
CC(=O)N[C@H](C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1)C(C)(C)C	ZINC000450709507	FE	On-Demand	Anodyne	GHRHR	49	35
CC(=O)N[C@H](C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1)C(C)(C)C	ZINC000450709507	FE	On-Demand	Anodyne	CTSD	37	41
CC(=O)N[C@H](C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1)C(C)(C)C	ZINC000450709507	FE	On-Demand	Anodyne	BACE1	29	43
COc1ccc(CNC(=O)CCN(C)Cc2cnc(N(C)C)nc2)c(OC)c1	ZINC000450709516	GD	On-Demand	Anodyne	PDGFRB	47	42
COc1ccc(CNC(=O)CCN(C)Cc2cnc(N(C)C)nc2)c(OC)c1	ZINC000450709516	GD	On-Demand	Anodyne	MTNR1A	53	38
COc1ccc(CNC(=O)CCN(C)Cc2cnc(N(C)C)nc2)c(OC)c1	ZINC000450709516	GD	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc(CNC(=O)CCN(C)Cc2cnc(N(C)C)nc2)c(OC)c1	ZINC000450709516	GD	On-Demand	Anodyne	CSF1R	19	42
CCCCCN(CC(N)=O)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450709530	ED	On-Demand	Anodyne	THRB	0	42
CCCCCN(CC(N)=O)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450709530	ED	On-Demand	Anodyne	RORC	27	49
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	DPOL_HHV11	0	40
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	DRD2	17	42
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	DRD4	34	42
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	ACHE	56	44
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	HRH1	21	40
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	DRD3	18	42
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	HTR4	110	42
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	HRH3	17	41
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	SIGMAR1	43	42
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	BCHE	19	44
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	CCR3	50	39
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	MCHR1	46	42
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	CACNA1G	32	41
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	CACNA1I	66	40
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	DPOL_VZVD	22	40
COC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1Cl	ZINC000450709535	GG	On-Demand	Anodyne	CYP2J2	44	33
Cc1ccn2ncc(C(=O)NCC3(CO)CCCC3)c2c1	ZINC000450709536	CD	On-Demand	Anodyne	HCN1	51	31
Cc1ccn2ncc(C(=O)NCC3(CO)CCCC3)c2c1	ZINC000450709536	CD	On-Demand	Anodyne	HCN4	48	31
CCOC(=O)C1(CNC(=O)c2cc3n(n2)CCCC3)CC1	ZINC000450709538	CD	On-Demand	Anodyne	HCN1	52	34
CCOC(=O)C1(CNC(=O)c2cc3n(n2)CCCC3)CC1	ZINC000450709538	CD	On-Demand	Anodyne	HCN4	49	34
COc1ccc2c(c1)nc(CNC(=O)[C@H]1CCCCC1(F)F)n2C	ZINC000450709543	EG	On-Demand	Anodyne	MTNR1A	28	42
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CCCCC1(F)F)n2C	ZINC000450709544	EG	On-Demand	Anodyne	MTNR1A	28	42
CCN1CCN(c2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450709547	EF	On-Demand	Mild	PRNP	30	42
CCN1CCN(c2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450709547	EF	On-Demand	Mild	KCNK3	46	33
CCN1CCN(c2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450709547	EF	On-Demand	Mild	KCNK9	56	33
CN(C)C(=O)CC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450709552	FF	On-Demand	Anodyne	ACHE	37	42
CN(C)C(=O)CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450709561	EF	On-Demand	Anodyne	DRD2	36	48
CN(C)C(=O)CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450709561	EF	On-Demand	Anodyne	DRD1	0	51
CN(C)C(=O)CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450709561	EF	On-Demand	Anodyne	DRD4	27	49
CN(C)C(=O)CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450709561	EF	On-Demand	Anodyne	SLC18A3	0	49
CN(C)C(=O)CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450709561	EF	On-Demand	Anodyne	HTR3B	0	48
CN(C)C(=O)CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450709561	EF	On-Demand	Anodyne	NET	0	48
CN(C)C(=O)CC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450709561	EF	On-Demand	Anodyne	AP2S1	0	48
COC(=O)c1csc(CN2CCc3ccc(C(C)(C)C)cc3C2)n1	ZINC000450709565	EH	On-Demand	Anodyne	NOD2	44	39
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CC(=O)N(C)C)CC1	ZINC000450709572	DE	On-Demand	Anodyne	OPRK1	26	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CC(=O)N(C)C)CC1	ZINC000450709572	DE	On-Demand	Anodyne	CCR5	35	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CC(=O)N(C)C)CC1	ZINC000450709573	DE	On-Demand	Anodyne	OPRK1	26	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CC(=O)N(C)C)CC1	ZINC000450709573	DE	On-Demand	Anodyne	CCR5	35	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CC(=O)N(C)C)CC1	ZINC000450709574	DE	On-Demand	Anodyne	OPRK1	26	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CC(=O)N(C)C)CC1	ZINC000450709574	DE	On-Demand	Anodyne	CCR5	35	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CC(=O)N(C)C)CC1	ZINC000450709575	DE	On-Demand	Anodyne	OPRK1	26	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CC(=O)N(C)C)CC1	ZINC000450709575	DE	On-Demand	Anodyne	CCR5	35	41
CCOC(=O)C1(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450709587	DG	On-Demand	Anodyne	HCN1	41	33
CCOC(=O)C1(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450709587	DG	On-Demand	Anodyne	HCN4	41	33
CCOC(=O)C1(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450709588	DG	On-Demand	Anodyne	HCN1	41	33
CCOC(=O)C1(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450709588	DG	On-Demand	Anodyne	HCN4	41	33
CCOC(=O)C1(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450709589	DG	On-Demand	Anodyne	HCN1	41	33
CCOC(=O)C1(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450709589	DG	On-Demand	Anodyne	HCN4	41	33
CCOC(=O)C1(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450709590	DG	On-Demand	Anodyne	HCN1	41	33
CCOC(=O)C1(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450709590	DG	On-Demand	Anodyne	HCN4	41	33
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc2ccncc2s1	ZINC000450709599	EE	On-Demand	Anodyne	TACR2	46	43
CCCn1c(SC2CC(OC(C)(C)C)C2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450709601	GH	On-Demand	Anodyne	CNR2	19	40
COc1ccc(Oc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)nc2)cc1	ZINC000450709606	GF	On-Demand	Anodyne	DRD4	41	32
COc1ccc(Oc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)nc2)cc1	ZINC000450709607	GF	On-Demand	Anodyne	DRD4	41	32
Cc1cccc([C@H](NCc2cccc(S(C)(=O)=O)c2)C(F)(F)F)c1	ZINC000450709614	FH	On-Demand	Anodyne	CTSF	47	34
Cc1cccc([C@@H](NCc2cccc(S(C)(=O)=O)c2)C(F)(F)F)c1	ZINC000450709615	FH	On-Demand	Anodyne	CTSF	47	34
OC[C@@H](NC[C@@H]1COCCO1)c1ccc(F)cc1	ZINC000450709630	CC	On-Demand	Anodyne	MAN1	0	41
OC[C@H](NC[C@@H]1COCCO1)c1ccc(F)cc1	ZINC000450709631	CC	On-Demand	Anodyne	MAN1	0	41
OC[C@@H](NC[C@H]1COCCO1)c1ccc(F)cc1	ZINC000450709632	CC	On-Demand	Anodyne	MAN1	0	41
OC[C@H](NC[C@H]1COCCO1)c1ccc(F)cc1	ZINC000450709633	CC	On-Demand	Anodyne	MAN1	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCC2(CC2)C1	ZINC000450709655	CI	On-Demand	Anodyne	CACNA1B	41	49
COCCOC[C@@H](O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450709660	FE	On-Demand	Anodyne	HSP90AB1	39	44
COCCOC[C@@H](O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450709660	FE	On-Demand	Anodyne	RBP4	72	35
COCCOC[C@H](O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450709661	FE	On-Demand	Anodyne	HSP90AB1	39	44
COCCOC[C@H](O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450709661	FE	On-Demand	Anodyne	RBP4	72	35
COCCOC[C@H](O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450709662	FE	On-Demand	Anodyne	HSP90AB1	39	44
COCCOC[C@H](O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450709662	FE	On-Demand	Anodyne	RBP4	72	35
COCCOC[C@@H](O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450709663	FE	On-Demand	Anodyne	HSP90AB1	39	44
COCCOC[C@@H](O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450709663	FE	On-Demand	Anodyne	RBP4	72	35
Cc1cccc(Cl)c1CN[C@@H](CO)c1cccc(Br)c1	ZINC000450709680	FI	On-Demand	Anodyne	EIF2AK1	40	41
Cc1cccc(Cl)c1CN[C@H](CO)c1cccc(Br)c1	ZINC000450709681	FI	On-Demand	Anodyne	EIF2AK1	40	41
COc1cc(OC)c(C[C@H](C)Nc2cc(N3CCCC3)ncn2)c(OC)c1	ZINC000450709682	FG	On-Demand	Anodyne	GALR2	43	35
COc1cc(OC)c(C[C@@H](C)Nc2cc(N3CCCC3)ncn2)c(OC)c1	ZINC000450709683	FG	On-Demand	Anodyne	GALR2	43	35
CCn1c(SCc2cn(CC3CC3)nn2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450709686	GD	On-Demand	Anodyne	CNR2	23	43
CCC[C@H](CC(C)C)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450709702	DI	On-Demand	Anodyne	BRD4	16	44
CCC[C@@H](CC(C)C)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450709703	DI	On-Demand	Anodyne	BRD4	16	44
Cc1csc(CNc2ncccc2S(=O)(=O)N2CCCCC2)c1	ZINC000450709715	FG	On-Demand	Anodyne	LPL	46	37
Cc1csc(CNc2nccc(CO)n2)c1	ZINC000450709722	BD	On-Demand	Anodyne	ZAP70	16	44
COc1cc(CC(=O)NCCc2nn(C)c3ccccc23)ccc1O	ZINC000450709748	EE	On-Demand	Anodyne	CAN2	0	49
CC(C)(C)c1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)o2)cc1	ZINC000450709749	FI	On-Demand	Anodyne	GSK3A	42	35
O=C([C@@H](O)C1CCC1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450709768	ED	On-Demand	Anodyne	COLA	44	43
O=C([C@@H](O)C1CCC1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450709768	ED	On-Demand	Anodyne	CPT1A	35	43
O=C([C@@H](O)C1CCC1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450709769	ED	On-Demand	Anodyne	COLA	44	43
O=C([C@@H](O)C1CCC1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450709769	ED	On-Demand	Anodyne	CPT1A	35	43
O=C([C@H](O)C1CCC1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450709770	ED	On-Demand	Anodyne	COLA	44	43
O=C([C@H](O)C1CCC1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450709770	ED	On-Demand	Anodyne	CPT1A	35	43
O=C([C@H](O)C1CCC1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450709771	ED	On-Demand	Anodyne	COLA	44	43
O=C([C@H](O)C1CCC1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450709771	ED	On-Demand	Anodyne	CPT1A	35	43
COC[C@@H](CNc1nc(C)nc2c1cnn2C)c1ccc(Cl)cc1	ZINC000450709772	EG	On-Demand	Anodyne	ABL1	41	38
COC[C@H](CNc1nc(C)nc2c1cnn2C)c1ccc(Cl)cc1	ZINC000450709773	EG	On-Demand	Anodyne	ABL1	41	38
CC(C)CCCC(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450709776	CG	On-Demand	Anodyne	PTPRF	42	32
CC(C)CCCC(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450709776	CG	On-Demand	Anodyne	CALCRL	40	35
Cc1cc(C)cc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)c1	ZINC000450709779	FI	On-Demand	Anodyne	GSK3B	16	40
Cc1cc(C)cc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)c1	ZINC000450709779	FI	On-Demand	Anodyne	GSK3A	42	35
Cc1cc(C)cc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)c1	ZINC000450709779	FI	On-Demand	Anodyne	TERT	22	42
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCOC3(CCC3)C2)n1	ZINC000450709787	CG	On-Demand	Bother	PRKCQ	47	37
Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCOC3(CCC3)C2)n1	ZINC000450709788	CG	On-Demand	Bother	PRKCQ	47	37
CCOC(=O)c1cc(C(=O)NCC2(OC)CCCCC2)on1	ZINC000450709797	DD	On-Demand	Anodyne	HCN1	53	33
CCOC(=O)c1cc(C(=O)NCC2(OC)CCCCC2)on1	ZINC000450709797	DD	On-Demand	Anodyne	HCN4	51	33
CCOc1ccccc1-c1nnc(SC[C@H]2CCCC2(F)F)o1	ZINC000450709800	EJ	On-Demand	Anodyne	ALOX15	43	37
CCOc1ccccc1-c1nnc(SC[C@@H]2CCCC2(F)F)o1	ZINC000450709801	EJ	On-Demand	Anodyne	ALOX15	43	37
CC[C@@](C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])OC	ZINC000450709803	DF	On-Demand	Bother	MAPK13	45	34
CC[C@](C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])OC	ZINC000450709804	DF	On-Demand	Bother	MAPK13	45	34
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450709811	GH	On-Demand	Anodyne	RBP4	96	46
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450709811	GH	On-Demand	Anodyne	SFRP1	51	34
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450709811	GH	On-Demand	Anodyne	WNT3	54	34
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450709812	GH	On-Demand	Anodyne	RBP4	96	46
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450709812	GH	On-Demand	Anodyne	SFRP1	51	34
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450709812	GH	On-Demand	Anodyne	WNT3	54	34
O=C(CSC1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450709818	FF	On-Demand	Anodyne	RBP4	51	36
O=C(CSC1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450709819	FF	On-Demand	Anodyne	RBP4	51	36
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450709834	FH	On-Demand	Anodyne	ERBB2	0	44
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450709834	FH	On-Demand	Anodyne	SFRP1	58	38
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450709834	FH	On-Demand	Anodyne	WNT3	51	33
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450709834	FH	On-Demand	Anodyne	NPBWR1	52	33
Nc1ncccc1CN1CCC(CCCn2ccnc2)CC1	ZINC000450709835	CF	On-Demand	Anodyne	CYP11B1	24	41
Nc1ncccc1CN1CCC(CCCn2ccnc2)CC1	ZINC000450709835	CF	On-Demand	Anodyne	TBXAS1	24	41
Nc1ncccc1CN1CCC(CCCn2ccnc2)CC1	ZINC000450709835	CF	On-Demand	Anodyne	CYP11B2	22	41
CCOC(=O)C[C@@H](C)N(C)Cc1ccc(C(=O)OCC)cn1	ZINC000450709850	DE	On-Demand	Anodyne	RXRA	41	37
CCOC(=O)C[C@H](C)N(C)Cc1ccc(C(=O)OCC)cn1	ZINC000450709851	DE	On-Demand	Anodyne	RXRA	41	37
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450709867	FE	On-Demand	Anodyne	RIR1_HHV11	52	34
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450709867	FE	On-Demand	Anodyne	RHODESAIN	0	44
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450709869	FE	On-Demand	Anodyne	RIR1_HHV11	52	34
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450709869	FE	On-Demand	Anodyne	RHODESAIN	0	44
COc1cc(CC(=O)N2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450709873	FF	On-Demand	Anodyne	OPRM1	0	41
COc1cc(CC(=O)N2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450709873	FF	On-Demand	Anodyne	OPRK1	39	40
COc1cc(CC(=O)N2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450709873	FF	On-Demand	Anodyne	CCR1	36	40
COc1cc(CC(=O)N2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450709876	FF	On-Demand	Anodyne	OPRM1	0	41
COc1cc(CC(=O)N2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450709876	FF	On-Demand	Anodyne	OPRK1	39	40
COc1cc(CC(=O)N2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450709876	FF	On-Demand	Anodyne	CCR1	36	40
Cc1ccc(I)cc1NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450709910	FF	On-Demand	Anodyne	LDLR	0	41
Cc1ccc(I)cc1NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450709912	FF	On-Demand	Anodyne	LDLR	0	41
CCOC(=O)c1cc(NCc2ncc(C(F)(F)F)cn2)ncc1Cl	ZINC000450709945	FG	On-Demand	Anodyne	ATF1	33	41
CCOC(=O)c1cc(NCc2ncc(C(F)(F)F)cn2)ncc1Cl	ZINC000450709945	FG	On-Demand	Anodyne	NFKB1	30	41
CC(=O)N[C@H](C)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450709949	FG	On-Demand	Anodyne	CACNA1B	48	44
CC(=O)N[C@H](C)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450709949	FG	On-Demand	Anodyne	CCR2	44	34
CC(=O)N[C@@H](C)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450709952	FG	On-Demand	Anodyne	CACNA1B	48	44
CC(=O)N[C@@H](C)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450709952	FG	On-Demand	Anodyne	CCR2	44	34
C[C@@H]1C[C@@H](C(F)(F)F)CCN1c1nc2cc(F)ccc2o1	ZINC000450709984	DI	On-Demand	Anodyne	HTR3A	16	57
CCn1nnc(C)c1CSc1nnc(-c2ccccc2C)n1Cc1ccco1	ZINC000450709987	GI	On-Demand	Anodyne	HCRTR2	22	45
C[C@H]1C[C@H](C(F)(F)F)CCN1c1nc2cc(F)ccc2o1	ZINC000450709989	DI	On-Demand	Anodyne	HTR3A	0	57
C[C@H]1C[C@@H](C(F)(F)F)CCN1c1nc2cc(F)ccc2o1	ZINC000450709990	DI	On-Demand	Anodyne	HTR3A	0	57
C[C@@H]1C[C@H](C(F)(F)F)CCN1c1nc2cc(F)ccc2o1	ZINC000450709992	DI	On-Demand	Anodyne	HTR3A	0	57
CCOC(=O)c1cnc(SCc2ccc(S(=O)(=O)CC)cc2)nc1N	ZINC000450709998	GE	On-Demand	Anodyne	CA13	17	49
O=C(c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450710011	GE	On-Demand	Bother	L3MBTL1	0	44
O=C(c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450710011	GE	On-Demand	Bother	L3MBTL3	37	44
O=C(c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450710014	GE	On-Demand	Bother	L3MBTL1	0	44
O=C(c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450710014	GE	On-Demand	Bother	L3MBTL3	23	44
O=C(c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450710016	GE	On-Demand	Bother	L3MBTL1	0	44
O=C(c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450710016	GE	On-Demand	Bother	L3MBTL3	37	44
O=C(c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450710018	GE	On-Demand	Bother	L3MBTL1	0	44
O=C(c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450710018	GE	On-Demand	Bother	L3MBTL3	37	44
O=[N+]([O-])c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1C(F)(F)F	ZINC000450710023	EH	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1C(F)(F)F	ZINC000450710025	EH	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1C(F)(F)F	ZINC000450710027	EH	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)cc1C(F)(F)F	ZINC000450710028	EH	On-Demand	Bother	AADAC	0	40
O=S(=O)([C@H]1CCCN(CC/C=C\c2ccccc2)C1)N1CCOCC1	ZINC000450710065	FE	On-Demand	Anodyne	SLC6A1	78	38
O=S(=O)([C@H]1CCCN(CC/C=C/c2ccccc2)C1)N1CCOCC1	ZINC000450710066	FE	On-Demand	Anodyne	SLC6A1	78	38
O=S(=O)([C@@H]1CCCN(CC/C=C/c2ccccc2)C1)N1CCOCC1	ZINC000450710068	FE	On-Demand	Anodyne	SLC6A1	78	38
O=S(=O)([C@@H]1CCCN(CC/C=C\c2ccccc2)C1)N1CCOCC1	ZINC000450710069	FE	On-Demand	Anodyne	SLC6A1	78	38
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	HTR1A	87	58
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	DRD2	73	53
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	DRD1	40	42
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	DRD4	51	53
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	ACHE	20	41
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	ADRA1D	34	40
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	HTR2A	42	54
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	HTR2C	29	54
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	SLC6A1	45	41
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	ADRA1A	34	42
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	ADRA1B	30	40
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	DRD3	72	47
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	CHRM5	27	40
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	DRD5	27	45
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	HTR7	69	58
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	AGTR2	58	32
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	SIGMAR1	34	46
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	HTR5A	41	54
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	CHRNA6	0	43
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	SLC18A3	25	45
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	ABCB1B	60	39
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	EBP	25	41
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	SSTR1	47	39
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	HTR3B	0	42
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	ABCB1	35	41
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	ALS	42	34
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	AKR1C3	22	50
COc1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450710092	DH	On-Demand	Anodyne	CYP2J2	56	40
N#Cc1cnc2c(F)ccc(Cl)c2c1N1C[C@H](F)[C@H](F)C1	ZINC000450710112	DG	On-Demand	Mild	MAP3K8	63	32
C/C=C\C[C@H](CO)NC(=O)c1ccc(I)cc1F	ZINC000450710115	FE	On-Demand	Anodyne	MAP2K1	42	36
C/C=C\C[C@@H](CO)NC(=O)c1ccc(I)cc1F	ZINC000450710116	FE	On-Demand	Anodyne	MAP2K1	42	36
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450710117	GH	On-Demand	Anodyne	PREP	45	38
O=C([C@H]1CCCCN1C1CCCC1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450710118	GH	On-Demand	Anodyne	PREP	45	38
CCOC(=O)C1(CNC(=O)c2ccn(CCc3ccccc3)n2)CC1	ZINC000450710120	EE	On-Demand	Anodyne	HCN1	55	36
C/C=C\COc1cccc(CC(=O)N[C@H](CO)C/C=C\C)c1	ZINC000450710129	DF	On-Demand	Anodyne	PDS	62	32
C/C=C\COc1cccc(CC(=O)N[C@H](CO)C/C=C/C)c1	ZINC000450710130	DF	On-Demand	Anodyne	PDS	62	32
C/C=C\C[C@@H](CO)NC(=O)Cc1cccc(OC/C=C/C)c1	ZINC000450710131	DF	On-Demand	Anodyne	PDS	62	32
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450710133	FH	On-Demand	Anodyne	HTR1A	19	44
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450710133	FH	On-Demand	Anodyne	NPY2R	46	40
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450710133	FH	On-Demand	Anodyne	PRNP	24	40
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450710134	FH	On-Demand	Anodyne	HTR1A	19	44
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450710134	FH	On-Demand	Anodyne	NPY2R	46	40
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450710134	FH	On-Demand	Anodyne	PRNP	24	40
CCN1CCN(c2cccc(NC(=O)c3c(Br)cnn3C)c2)CC1	ZINC000450710136	GF	On-Demand	Anodyne	HTR1A	30	44
CCN1CCN(c2cccc(NC(=O)c3c(Br)cnn3C)c2)CC1	ZINC000450710136	GF	On-Demand	Anodyne	DRD4	41	33
CCN1CCN(c2cccc(NC(=O)c3c(Br)cnn3C)c2)CC1	ZINC000450710136	GF	On-Demand	Anodyne	DRD3	22	40
CCN1CCN(c2cccc(NC(=O)c3c(Br)cnn3C)c2)CC1	ZINC000450710136	GF	On-Demand	Anodyne	HTR7	22	40
CCN1CCN(c2cccc(NC(=O)c3c(Br)cnn3C)c2)CC1	ZINC000450710136	GF	On-Demand	Anodyne	PRNP	37	44
CC[C@H](O)CC(=O)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450710137	DD	On-Demand	Anodyne	PREP	25	45
CC[C@@H](O)CC(=O)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450710138	DD	On-Demand	Anodyne	PREP	25	45
N#Cc1ccc(OCC(=O)NCC2(CO)CCCC2)cc1Br	ZINC000450710154	FE	On-Demand	Mild	TRPV4	42	32
O=C(NCC1(CO)CCCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450710155	DE	On-Demand	Anodyne	CACNA1G	21	44
O=C(NCC1(CO)CCCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450710156	DE	On-Demand	Anodyne	CACNA1G	21	44
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCc3ccc(F)cc3)c2)CC1	ZINC000450710157	GH	On-Demand	Anodyne	HTR1A	24	49
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCc3ccc(F)cc3)c2)CC1	ZINC000450710157	GH	On-Demand	Anodyne	CCR3	67	39
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCc3ccc(F)cc3)c2)CC1	ZINC000450710158	GH	On-Demand	Anodyne	HTR1A	24	49
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCc3ccc(F)cc3)c2)CC1	ZINC000450710158	GH	On-Demand	Anodyne	CCR3	67	39
COc1cc(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)ccc1O	ZINC000450710163	FF	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)ccc1O	ZINC000450710163	FF	On-Demand	Anodyne	MLNR	33	43
O=C(NCC1(CO)CCCC1)c1ccc(I)cc1F	ZINC000450710170	GF	On-Demand	Anodyne	MAP2K1	54	34
CCOC(=O)COCCNc1nc(C(F)(F)F)nc2ccc(OC)cc12	ZINC000450710174	FE	On-Demand	Anodyne	DRTS_TRYCR	46	37
COC(=O)C[C@@H](NC(=O)c1coc2c1C(=O)CCC2)c1ccc2ccccc2c1	ZINC000450710180	GH	On-Demand	Anodyne	UTS2	46	42
CC(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450710183	DE	On-Demand	Anodyne	DRD2	35	48
CC(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450710183	DE	On-Demand	Anodyne	HTR2A	23	61
CC(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450710183	DE	On-Demand	Anodyne	HTR3B	0	44
CC(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450710183	DE	On-Demand	Anodyne	CYP2J2	51	37
CC(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450710183	DE	On-Demand	Anodyne	NET	0	48
CC(=O)CCCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000450710185	CF	On-Demand	Anodyne	THRA	29	41
CC(=O)CCCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000450710185	CF	On-Demand	Anodyne	P2RY12	0	40
CC(=O)CCCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000450710185	CF	On-Demand	Anodyne	THRB	0	41
CC(=O)CCCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000450710185	CF	On-Demand	Anodyne	PLA2G4B	80	41
CC(=O)CCCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000450710185	CF	On-Demand	Anodyne	LOX1.1	48	34
CC(=O)CCCCCOc1ccc(S(C)(=O)=O)cc1	ZINC000450710185	CF	On-Demand	Anodyne	O49150_SOLTU	52	35
COC(=O)C[C@H](NC(=O)c1coc2c1C(=O)CCC2)c1ccc2ccccc2c1	ZINC000450710186	GH	On-Demand	Anodyne	UTS2	46	42
CCOC(=O)C1(CNC(=O)c2ccc3cnccc3c2)CC1	ZINC000450710188	CE	On-Demand	Anodyne	AKT1	0	40
COc1ccc(C(=O)NCC2(CO)CCCC2)cc1S(C)(=O)=O	ZINC000450710189	ED	On-Demand	Anodyne	COLA	76	39
COc1ccc(C(=O)NCC2(CO)CCCC2)cc1S(C)(=O)=O	ZINC000450710189	ED	On-Demand	Anodyne	CPT1A	67	39
COc1ccc(C(=O)NCC2(CO)CCCC2)cc1S(C)(=O)=O	ZINC000450710189	ED	On-Demand	Anodyne	CPT2	43	36
COc1ccc(C(=O)NCC2(CO)CCCC2)cc1S(C)(=O)=O	ZINC000450710189	ED	On-Demand	Anodyne	CPT1B	63	36
C/C=C\C[C@@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450710194	BD	On-Demand	Anodyne	PDE5A	23	45
C/C=C\C[C@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450710195	BD	On-Demand	Anodyne	PDE5A	23	45
C/C=C/C[C@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450710196	BD	On-Demand	Anodyne	PDE5A	23	45
C/C=C/C[C@@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450710197	BD	On-Demand	Anodyne	PDE5A	23	45
FC(F)(F)Cn1ccc(CN2CC[C@H](COc3ccccc3)C2)n1	ZINC000450710202	EG	On-Demand	Anodyne	SIGMAR1	19	48
FC(F)(F)Cn1ccc(CN2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450710203	EG	On-Demand	Anodyne	SIGMAR1	19	48
CCN1CCN(c2cccc(NC(=O)c3ccc(C4CC4)nc3C)c2)CC1	ZINC000450710205	FH	On-Demand	Anodyne	HTR1A	18	41
CCN1CCN(c2cccc(NC(=O)c3ccc(C4CC4)nc3C)c2)CC1	ZINC000450710205	FH	On-Demand	Anodyne	PRNP	35	42
C[C@@H](O)CCN1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450710217	CG	On-Demand	Anodyne	CHRNA6	0	40
C[C@H](O)CCN1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450710218	CG	On-Demand	Anodyne	CHRNA6	0	40
COC(=O)CNC(=O)c1ccc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000450710223	EC	On-Demand	Bother	TAAR1	23	45
COC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1Cl	ZINC000450710241	GG	On-Demand	Anodyne	ACHE	39	40
COC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1Cl	ZINC000450710241	GG	On-Demand	Anodyne	HTR4	84	40
COC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1Cl	ZINC000450710241	GG	On-Demand	Anodyne	SIGMAR1	27	41
COC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1Cl	ZINC000450710241	GG	On-Demand	Anodyne	CCR3	34	42
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450710258	EF	On-Demand	Anodyne	SLC6A1	44	33
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450710258	EF	On-Demand	Anodyne	SCN9A	0	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450710259	EF	On-Demand	Anodyne	SLC6A1	44	33
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450710259	EF	On-Demand	Anodyne	SCN9A	0	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450710260	EF	On-Demand	Anodyne	SLC6A1	44	33
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450710260	EF	On-Demand	Anodyne	SCN9A	0	41
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450710261	EF	On-Demand	Anodyne	SLC6A1	44	33
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450710261	EF	On-Demand	Anodyne	SCN9A	0	41
CC[C@H](O)CC(=O)N1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450710266	FF	On-Demand	Anodyne	P2RY12	85	33
CC[C@H](O)CC(=O)N1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450710267	FF	On-Demand	Anodyne	P2RY12	85	33
CC[C@@H](O)CC(=O)N1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450710268	FF	On-Demand	Anodyne	P2RY12	85	33
CC[C@@H](O)CC(=O)N1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450710269	FF	On-Demand	Anodyne	P2RY12	85	33
CC(=O)[C@@](C)(O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450710275	EE	On-Demand	Anodyne	RBP4	45	40
CC(=O)[C@@](C)(O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450710276	EE	On-Demand	Anodyne	RBP4	45	40
CC(=O)[C@](C)(O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450710277	EE	On-Demand	Anodyne	RBP4	45	40
CC(=O)[C@](C)(O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450710278	EE	On-Demand	Anodyne	RBP4	45	40
COc1cc(OC)c2ncnc(N3C[C@H](F)[C@H](F)C3)c2c1	ZINC000450710285	CE	On-Demand	Anodyne	PDE3A	51	41
COC(=O)C[C@H](NC(=O)CCCC(=O)C1CC1)c1ccc2ccccc2c1	ZINC000450710286	FH	On-Demand	Anodyne	HDA106	0	42
COC(=O)C[C@H](NC(=O)CCCC(=O)C1CC1)c1ccc2ccccc2c1	ZINC000450710286	FH	On-Demand	Anodyne	CYP74A	0	40
COC(=O)C[C@@H](NC(=O)CCCC(=O)C1CC1)c1ccc2ccccc2c1	ZINC000450710287	FH	On-Demand	Anodyne	HDA106	0	42
COC(=O)C[C@@H](NC(=O)CCCC(=O)C1CC1)c1ccc2ccccc2c1	ZINC000450710287	FH	On-Demand	Anodyne	CYP74A	0	40
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450710288	GJ	On-Demand	Anodyne	TPH1	41	35
CC[C@H](CC(F)(F)F)C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450710288	GJ	On-Demand	Anodyne	UTS2	35	44
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450710289	GJ	On-Demand	Anodyne	TPH1	41	35
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450710289	GJ	On-Demand	Anodyne	UTS2	35	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450710290	GJ	On-Demand	Anodyne	TPH1	41	35
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450710290	GJ	On-Demand	Anodyne	UTS2	35	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450710291	GJ	On-Demand	Anodyne	TPH1	41	35
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450710291	GJ	On-Demand	Anodyne	UTS2	35	44
CCc1cc(N[C@H](C)Cc2c(OC)cc(OC)cc2OC)n2ncnc2n1	ZINC000450710295	FF	On-Demand	Anodyne	DHOD	0	47
CCc1cc(N[C@@H](C)Cc2c(OC)cc(OC)cc2OC)n2ncnc2n1	ZINC000450710296	FF	On-Demand	Anodyne	DHOD	0	47
COC[C@@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)cc1	ZINC000450710307	FH	On-Demand	Anodyne	ADORA1	36	43
COC[C@@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)cc1	ZINC000450710307	FH	On-Demand	Anodyne	ADORA2A	0	41
COC[C@@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)cc1	ZINC000450710307	FH	On-Demand	Anodyne	ADORA3	45	41
COC[C@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)cc1	ZINC000450710308	FH	On-Demand	Anodyne	ADORA1	36	43
COC[C@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)cc1	ZINC000450710308	FH	On-Demand	Anodyne	ADORA2A	0	41
COC[C@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)cc1	ZINC000450710308	FH	On-Demand	Anodyne	ADORA3	45	41
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2nn(C)cc2Cl)c([N+](=O)[O-])c1	ZINC000450710310	GD	On-Demand	Bother	TAAR1	19	41
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2nn(C)cc2Cl)c([N+](=O)[O-])c1	ZINC000450710311	GD	On-Demand	Bother	TAAR1	19	41
CN1CCC[C@@H](C(=O)NCc2nc3cccc(Cl)c3n2C)C1=O	ZINC000450710316	ED	On-Demand	Anodyne	P2RX7	60	39
CN1CCC[C@H](C(=O)NCc2nc3cccc(Cl)c3n2C)C1=O	ZINC000450710317	ED	On-Demand	Anodyne	P2RX7	60	39
CC[C@H](O)CC(=O)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450710341	ED	On-Demand	Anodyne	COLA	65	46
CC[C@H](O)CC(=O)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450710341	ED	On-Demand	Anodyne	CPT1A	50	46
CC[C@@H](O)CC(=O)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450710342	ED	On-Demand	Anodyne	COLA	65	46
CC[C@@H](O)CC(=O)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450710342	ED	On-Demand	Anodyne	CPT1A	50	46
CC[C@H](O)CC(=O)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450710343	ED	On-Demand	Anodyne	COLA	65	46
CC[C@H](O)CC(=O)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450710343	ED	On-Demand	Anodyne	CPT1A	50	46
CC[C@@H](O)CC(=O)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450710344	ED	On-Demand	Anodyne	COLA	65	46
CC[C@@H](O)CC(=O)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450710344	ED	On-Demand	Anodyne	CPT1A	50	46
Cn1nc(CCNC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)c2ccccc21	ZINC000450710352	GI	On-Demand	Anodyne	PRCP	45	34
Cn1nc(CCNC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)c2ccccc21	ZINC000450710353	GI	On-Demand	Anodyne	PRCP	45	34
Cn1nc(CCNC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)c2ccccc21	ZINC000450710354	GI	On-Demand	Anodyne	PRCP	45	34
Cn1nc(CCNC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)c2ccccc21	ZINC000450710355	GI	On-Demand	Anodyne	PRCP	45	34
Cc1ccc(F)c(CC(=O)NCCc2nn(C)c3ccccc23)c1	ZINC000450710359	EF	On-Demand	Anodyne	P2RX7	50	43
Cc1ccc(F)c(CC(=O)NCCc2nn(C)c3ccccc23)c1	ZINC000450710359	EF	On-Demand	Anodyne	IMDH_CRYPV	26	40
O[C@]1(C(F)F)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450710392	CD	On-Demand	Anodyne	AKT2	39	56
O[C@@]1(C(F)F)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450710393	CD	On-Demand	Anodyne	AKT2	39	56
CCOC(=O)C1(CNC(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450710394	DD	On-Demand	Anodyne	TRPV1	50	55
CCOC(=O)C1(CNC(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450710394	DD	On-Demand	Anodyne	NCE103	38	44
CCOC(=O)C1(CNC(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450710394	DD	On-Demand	Anodyne	P96878_MYCTU	24	44
COc1ccc(CNC(=O)CCSc2nc(C)cc(N)n2)c(OC)c1	ZINC000450710407	FE	On-Demand	Anodyne	DRTS_TOXGO	23	42
COc1ccc(CNC(=O)CCSc2nc(C)cc(N)n2)c(OC)c1	ZINC000450710407	FE	On-Demand	Anodyne	MTNR1A	44	38
CNS(=O)(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)c(F)c1	ZINC000450710450	DC	On-Demand	Anodyne	SLC6A9	0	43
CNS(=O)(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)c(F)c1	ZINC000450710451	DC	On-Demand	Anodyne	SLC6A9	0	43
C=C(C)CCNc1ncnc2c1ncn2CC	ZINC000450710469	BE	On-Demand	Mild	ADORA3	56	34
CCc1nc(C)c(CSc2nnc(O)n2CCc2ccccc2)o1	ZINC000450710493	EG	On-Demand	Anodyne	CASR	0	41
Cc1c(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)nn2c1OCCC2	ZINC000450710495	FH	On-Demand	Anodyne	ATF1	61	41
Cc1c(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)nn2c1OCCC2	ZINC000450710495	FH	On-Demand	Anodyne	NFKB1	57	41
Cc1cncn1C1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)CC1	ZINC000450710516	EG	On-Demand	Anodyne	L3MBTL3	49	33
CC[C@](C)(CNc1cc(COC)nc2ncnn12)OC	ZINC000450710545	CD	On-Demand	Anodyne	DHOD	0	44
CC[C@@](C)(CNc1cc(COC)nc2ncnn12)OC	ZINC000450710546	CD	On-Demand	Anodyne	DHOD	0	44
Cc1cncn1C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450710551	DH	On-Demand	Anodyne	L3MBTL1	0	41
Cc1cncn1C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450710551	DH	On-Demand	Anodyne	L3MBTL3	73	41
Cc1cncn1C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450710551	DH	On-Demand	Anodyne	TP53BP1	0	41
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450710552	GG	On-Demand	Anodyne	P2RX7	26	41
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450710552	GG	On-Demand	Anodyne	RBP4	41	33
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450710552	GG	On-Demand	Anodyne	LUXR	39	45
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450710553	GG	On-Demand	Anodyne	P2RX7	26	41
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450710553	GG	On-Demand	Anodyne	RBP4	41	33
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450710553	GG	On-Demand	Anodyne	LUXR	39	45
Cc1cc(C(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)nn1C(C)C	ZINC000450710554	GI	On-Demand	Anodyne	NPY5R	20	53
Cc1cc(C(=O)Nc2cccc(-n3cc(C(F)(F)F)cn3)c2)nn1C(C)C	ZINC000450710554	GI	On-Demand	Anodyne	KCNK3	40	38
O[C@H](Cc1ccccc1)CN1C[C@H]2CC[C@@H](O)[C@@H]2C1	ZINC000450710555	CD	On-Demand	Anodyne	VACHT_TETCF	0	46
O[C@H](Cc1ccccc1)CN1C[C@H]2CC[C@@H](O)[C@H]2C1	ZINC000450710556	CD	On-Demand	Anodyne	VACHT_TETCF	0	46
O=C(CCCN1CCNC(=O)[C@@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710572	FF	On-Demand	Anodyne	DRD2	33	49
O=C(CCCN1CCNC(=O)[C@@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710572	FF	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCNC(=O)[C@@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710572	FF	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCNC(=O)[C@@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710572	FF	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCNC(=O)[C@@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710572	FF	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCNC(=O)[C@@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710572	FF	On-Demand	Anodyne	NET	0	43
O=C(CCCN1CCNC(=O)[C@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710573	FF	On-Demand	Anodyne	DRD2	33	49
O=C(CCCN1CCNC(=O)[C@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710573	FF	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCNC(=O)[C@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710573	FF	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCNC(=O)[C@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710573	FF	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCNC(=O)[C@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710573	FF	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCNC(=O)[C@H]1Cc1ccccc1)c1ccc(F)cc1	ZINC000450710573	FF	On-Demand	Anodyne	NET	0	43
COC(=O)c1ccc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)cc1	ZINC000450710574	FD	On-Demand	Anodyne	HRH3	0	47
COC(=O)c1ccc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)cc1	ZINC000450710574	FD	On-Demand	Anodyne	KCNJ1	41	33
COC(=O)c1ccc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)cc1	ZINC000450710574	FD	On-Demand	Anodyne	GPR183	0	40
CO[C@@H]1COCC[C@H]1CC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450710582	GG	On-Demand	Anodyne	CCR2	37	40
CO[C@H]1COCC[C@H]1CC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450710583	GG	On-Demand	Anodyne	CCR2	37	40
CO[C@@H]1COCC[C@@H]1CC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450710584	GG	On-Demand	Anodyne	CCR2	37	40
CO[C@H]1COCC[C@@H]1CC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1	ZINC000450710585	GG	On-Demand	Anodyne	CCR2	37	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	ACE	55	38
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	GHRHR	53	33
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	P2RY12	45	30
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	CCKAR	16	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	CCR1	37	44
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	REN	41	38
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	CCKBR	15	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	ACE2	55	37
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	GAG-PRO	59	35
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450710598	EE	On-Demand	Anodyne	BRCA1	45	33
COc1cccc2c1CCN(C[C@@H]1CCC(F)(F)C1)C2	ZINC000450710608	CG	On-Demand	Anodyne	HTR1A	16	60
COc1cccc2c1CCN(C[C@H]1CCC(F)(F)C1)C2	ZINC000450710609	CG	On-Demand	Anodyne	HTR1A	16	60
CCc1cc(CCCN2CCC(CCC(=O)N(CC)CC)CC2)on1	ZINC000450710617	EH	On-Demand	Anodyne	HTR4	42	38
CCc1cc(CCCN2CCC(CCC(=O)N(CC)CC)CC2)on1	ZINC000450710617	EH	On-Demand	Anodyne	CYP2J2	47	34
COc1cccc2c1CCN(Cc1cnn[nH]1)C2	ZINC000450710621	BD	On-Demand	Anodyne	ABCB1	24	40
CC(=O)c1ccc(CN2Cc3ccccc3OC[C@@H]2C)cc1	ZINC000450710626	CH	On-Demand	Anodyne	HCRTR2	0	41
CC(=O)c1ccc(CN2Cc3ccccc3OC[C@H]2C)cc1	ZINC000450710627	CH	On-Demand	Anodyne	HCRTR2	0	41
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450710634	DG	On-Demand	Mild	CTSF	47	32
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450710634	DG	On-Demand	Mild	MCHR1	19	44
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450710635	DG	On-Demand	Mild	CTSF	47	32
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450710635	DG	On-Demand	Mild	MCHR1	19	44
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450710636	DG	On-Demand	Mild	CTSF	47	32
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450710636	DG	On-Demand	Mild	MCHR1	19	44
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450710637	DG	On-Demand	Mild	CTSF	47	32
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450710637	DG	On-Demand	Mild	MCHR1	19	44
COc1ccc(CNC(=O)CCN[C@H](C)c2cncc(F)c2)c(OC)c1	ZINC000450710649	FF	On-Demand	Anodyne	GRIN2B	0	40
COc1ccc(CNC(=O)CCN[C@H](C)c2cncc(F)c2)c(OC)c1	ZINC000450710649	FF	On-Demand	Anodyne	MTNR1A	48	37
COc1ccc(CNC(=O)CCN[C@@H](C)c2cncc(F)c2)c(OC)c1	ZINC000450710650	FF	On-Demand	Anodyne	GRIN2B	0	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2cncc(F)c2)c(OC)c1	ZINC000450710650	FF	On-Demand	Anodyne	MTNR1A	48	37
CC(=O)c1cccc(CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000450710656	GH	On-Demand	Anodyne	RBP4	66	35
CC(=O)c1cccc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000450710657	GH	On-Demand	Anodyne	RBP4	66	35
Cc1ccc2ncnc(N3CCC[C@@H](O)[C@H]3C)c2c1	ZINC000450710661	CE	On-Demand	Anodyne	PDE3B	41	31
Cc1ccc2ncnc(N3CCC[C@H](O)[C@@H]3C)c2c1	ZINC000450710662	CE	On-Demand	Anodyne	PDE3B	41	31
Cc1ccc2ncnc(N3CCC[C@H](O)[C@H]3C)c2c1	ZINC000450710663	CE	On-Demand	Anodyne	PDE3B	41	31
Cc1ccc2ncnc(N3CCC[C@@H](O)[C@@H]3C)c2c1	ZINC000450710664	CE	On-Demand	Anodyne	PDE3B	41	31
COc1ccc(CC[C@@]2(C)NC(=O)N(Cc3ccc(C(C)=O)cc3)C2=O)cc1	ZINC000450710669	GG	On-Demand	Anodyne	PROKR1	42	32
Cc1cccc(CN2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)n1	ZINC000450710670	EE	On-Demand	Anodyne	PDE8A	0	40
COc1ccc(CC[C@]2(C)NC(=O)N(Cc3ccc(C(C)=O)cc3)C2=O)cc1	ZINC000450710671	GG	On-Demand	Anodyne	PROKR1	42	32
Cc1cccc(CN2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)n1	ZINC000450710673	EE	On-Demand	Anodyne	PDE8A	0	40
CN(CCN[C@H](CO)c1ccc(Cl)cc1)Cc1ccccc1	ZINC000450710676	DG	On-Demand	Anodyne	UTS2	51	42
CN(CCN[C@@H](CO)c1ccc(Cl)cc1)Cc1ccccc1	ZINC000450710677	DG	On-Demand	Anodyne	UTS2	51	42
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)CC1CC(F)(F)C1	ZINC000450710678	FG	On-Demand	Anodyne	TIMP3	49	32
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)CC1CC(F)(F)C1	ZINC000450710679	FG	On-Demand	Anodyne	TIMP3	49	32
CCN(CC)CCCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450710687	GH	On-Demand	Anodyne	ACHE	38	52
CCN(CC)CCCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450710687	GH	On-Demand	Anodyne	SIGMAR1	20	41
CCN(CC)CCCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450710687	GH	On-Demand	Anodyne	CAS1	20	43
CCC[C@@H](O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450710700	DG	On-Demand	Anodyne	RBP4	55	36
CCC[C@@H](O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450710701	DG	On-Demand	Anodyne	RBP4	55	36
CN(C)CCN(C(=O)c1ccc(C(C)(F)F)cc1)C1CC1	ZINC000450710702	CF	On-Demand	Anodyne	MCHR1	22	41
CN(C)CCN(C(=O)c1ccc(C(C)(F)F)cc1)C1CC1	ZINC000450710702	CF	On-Demand	Anodyne	MBTPS1	51	31
CCC[C@H](O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450710703	DG	On-Demand	Anodyne	RBP4	55	36
CCC[C@H](O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450710704	DG	On-Demand	Anodyne	RBP4	55	36
C[C@@H](c1csnn1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450710711	EH	On-Demand	Anodyne	RBP4	40	32
C[C@@H](c1csnn1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450710712	EH	On-Demand	Anodyne	RBP4	40	32
C[C@H](c1csnn1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450710713	EH	On-Demand	Anodyne	RBP4	40	32
C[C@H](c1csnn1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450710714	EH	On-Demand	Anodyne	RBP4	40	32
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(OCC)no1	ZINC000450710715	FF	On-Demand	Anodyne	PSMB8	32	41
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc(OCC)no1	ZINC000450710716	FF	On-Demand	Anodyne	PSMB8	32	41
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450710733	ED	On-Demand	Anodyne	DRD4	41	31
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450710733	ED	On-Demand	Anodyne	PLD1	41	36
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450710733	ED	On-Demand	Anodyne	PLD2	41	39
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450710733	ED	On-Demand	Anodyne	AKT1	23	53
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450710738	ED	On-Demand	Anodyne	DRD4	41	31
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450710738	ED	On-Demand	Anodyne	PLD1	41	36
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450710738	ED	On-Demand	Anodyne	PLD2	41	39
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc2cnccc2c1	ZINC000450710738	ED	On-Demand	Anodyne	AKT1	23	53
Cc1csc(NC2CCN(C(=O)C(CC(C)C)CC(C)C)CC2)n1	ZINC000450710746	FJ	On-Demand	Anodyne	TRPC6	45	34
Cc1csc(NC2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CC2)n1	ZINC000450710754	GI	On-Demand	Anodyne	NPBWR1	69	35
CC(=O)c1cccc(CN2CCC(CC(=O)N(C)C)CC2)c1	ZINC000450710840	DF	On-Demand	Anodyne	DRD4	31	44
CC(=O)c1cccc(CN2CCC(CC(=O)N(C)C)CC2)c1	ZINC000450710840	DF	On-Demand	Anodyne	ACHE	38	47
CC(=O)c1cccc(CN2CCC(CC(=O)N(C)C)CC2)c1	ZINC000450710840	DF	On-Demand	Anodyne	CHRM3	22	44
CC(=O)c1cccc(CN2CCC(CC(=O)N(C)C)CC2)c1	ZINC000450710840	DF	On-Demand	Anodyne	SIGMAR1	49	46
CC(=O)c1cccc(CN2CCC(CC(=O)N(C)C)CC2)c1	ZINC000450710840	DF	On-Demand	Anodyne	CCR3	48	46
CC(=O)c1cccc(CN2CCC(CC(=O)N(C)C)CC2)c1	ZINC000450710840	DF	On-Demand	Anodyne	MCHR1	38	42
O=C(NCC1(CO)CCCC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450710849	EF	On-Demand	Bother	AKR1C4	0	41
O=C(NCC1(CO)CCCC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450710849	EF	On-Demand	Bother	PPXII	0	41
COc1ccc2c(c1)nc(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)n2C	ZINC000450710856	GF	On-Demand	Anodyne	ANPEP	27	43
COc1ccc2c(c1)nc(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)n2C	ZINC000450710856	GF	On-Demand	Anodyne	CTSK	23	43
COc1ccc2c(c1)nc(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)n2C	ZINC000450710856	GF	On-Demand	Anodyne	CTSL	25	43
COc1ccc2c(c1)nc(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)n2C	ZINC000450710856	GF	On-Demand	Anodyne	CTSS	18	43
CCOc1cc(C(=O)NCC2(CO)CCCC2)on1	ZINC000450710866	CD	On-Demand	Anodyne	HCN1	42	32
CCOc1cc(C(=O)NCC2(CO)CCCC2)on1	ZINC000450710866	CD	On-Demand	Anodyne	HCN4	42	32
CCN1CCN(c2cccc(NC(=O)C(C)(C)OC(C)C)c2)CC1	ZINC000450710884	EF	On-Demand	Anodyne	HTR1A	25	47
CCN1CCN(c2cccc(NC(=O)C(C)(C)OC(C)C)c2)CC1	ZINC000450710884	EF	On-Demand	Anodyne	PRNP	40	43
CCOc1nc2ccc(C(=O)NCc3nc4cc(OC)ccc4n3C)cc2[nH]1	ZINC000450710885	GF	On-Demand	Anodyne	DRD4	42	32
CCOC(=O)CCN(Cc1cccnc1)Cc1nnc(C2CC2)s1	ZINC000450710886	EF	On-Demand	Anodyne	NR1D1	42	35
COC(=O)c1coc(CN2CCc3ccc(C(C)(C)C)cc3C2)n1	ZINC000450710887	EG	On-Demand	Anodyne	NOD2	41	37
COc1ccccc1Oc1ccc(C(=O)NCC2(CO)CCCC2)nc1	ZINC000450710890	FG	On-Demand	Anodyne	KCNA3	42	41
COc1ccccc1Oc1ccc(C(=O)NCC2(CO)CCCC2)nc1	ZINC000450710890	FG	On-Demand	Anodyne	SLC6A5	15	42
COc1ccccc1Oc1ccc(C(=O)NCC2(CO)CCCC2)nc1	ZINC000450710890	FG	On-Demand	Anodyne	HCN1	66	41
COc1ccccc1Oc1ccc(C(=O)NCC2(CO)CCCC2)nc1	ZINC000450710890	FG	On-Demand	Anodyne	HCN4	56	39
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	HTR1A	15	59
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	DRD2	39	58
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	DRD1	25	54
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	DRD4	26	58
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	HTR2A	24	63
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	HTR2C	18	61
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	ADRA1A	20	46
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	HRH1	17	58
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	ADRA1B	25	40
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	DRD3	0	58
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	ADRA2B	15	58
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	DRD5	16	44
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	ERG2	27	58
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	SLC18A3	24	59
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	EBP	20	58
CC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450710895	CG	On-Demand	Mild	CYP2J2	55	39
O=C([C@@H](O)C1CCC1)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450710896	DD	On-Demand	Anodyne	PREP	22	46
O=C([C@H](O)C1CCC1)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450710897	DD	On-Demand	Anodyne	PREP	22	46
CN(C)c1nccc(N2C[C@H](F)[C@H](F)C2)n1	ZINC000450710898	BD	On-Demand	Anodyne	SORD	47	41
COC1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450710904	DD	On-Demand	Anodyne	HCN1	51	31
COC1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450710904	DD	On-Demand	Anodyne	HCN4	49	31
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450710911	EH	On-Demand	Anodyne	BRD4	0	42
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450710912	EH	On-Demand	Anodyne	BRD4	0	42
Cc1nc([C@H]2CCCCCN2C(=O)Cc2sccc2Br)no1	ZINC000450710915	GH	On-Demand	Anodyne	COLA	99	44
Cc1nc([C@H]2CCCCCN2C(=O)Cc2sccc2Br)no1	ZINC000450710915	GH	On-Demand	Anodyne	CPT1A	96	44
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2sccc2Br)no1	ZINC000450710916	GH	On-Demand	Anodyne	COLA	99	44
Cc1nc([C@@H]2CCCCCN2C(=O)Cc2sccc2Br)no1	ZINC000450710916	GH	On-Demand	Anodyne	CPT1A	96	44
N#Cc1cc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1C(F)(F)F	ZINC000450710930	DH	On-Demand	Mild	AR	21	43
N#Cc1cc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1C(F)(F)F	ZINC000450710932	DH	On-Demand	Mild	AR	21	43
N#Cc1cc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1C(F)(F)F	ZINC000450710935	DH	On-Demand	Mild	AR	21	43
N#Cc1cc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1C(F)(F)F	ZINC000450710936	DH	On-Demand	Mild	AR	21	43
CCc1cc(NC[C@H](COC)c2ccc(Cl)cc2)n2ncnc2n1	ZINC000450710938	EG	On-Demand	Anodyne	DHOD	0	48
CCc1cc(NC[C@@H](COC)c2ccc(Cl)cc2)n2ncnc2n1	ZINC000450710940	EG	On-Demand	Anodyne	DHOD	0	48
COC1(CNC(=O)c2cc3cccnc3s2)CCCCC1	ZINC000450710954	DG	On-Demand	Anodyne	HCN1	50	32
COC1(CNC(=O)c2cc3cccnc3s2)CCCCC1	ZINC000450710954	DG	On-Demand	Anodyne	HCN4	48	32
Cn1c(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)nc2cccc(Cl)c21	ZINC000450710958	EG	On-Demand	Anodyne	P2RX7	58	36
COCCOC[C@H](O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450710982	EF	On-Demand	Anodyne	VACHT_TETCF	0	40
COCCOC[C@H](O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450710982	EF	On-Demand	Anodyne	CCR2	43	39
COCCOC[C@H](O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450710984	EF	On-Demand	Anodyne	VACHT_TETCF	0	40
COCCOC[C@H](O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450710984	EF	On-Demand	Anodyne	CCR2	43	39
COCCOC[C@@H](O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450710985	EF	On-Demand	Anodyne	VACHT_TETCF	0	40
COCCOC[C@@H](O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450710985	EF	On-Demand	Anodyne	CCR2	43	39
COCCOC[C@@H](O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450710986	EF	On-Demand	Anodyne	VACHT_TETCF	0	40
COCCOC[C@@H](O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450710986	EF	On-Demand	Anodyne	CCR2	43	39
COc1cc(CC(=O)NCC2(OC)CCCCC2)ccc1Cl	ZINC000450710987	EG	On-Demand	Anodyne	TRPV1	28	44
COc1cc(CC(=O)NCC2(OC)CCCCC2)ccc1Cl	ZINC000450710987	EG	On-Demand	Anodyne	NCE103	26	45
COc1cc(CC(=O)NCC2(OC)CCCCC2)ccc1Cl	ZINC000450710987	EG	On-Demand	Anodyne	CAN2	0	45
CCc1nc(C)c(CSc2nnc(-c3cc(C)cc(C)c3)o2)o1	ZINC000450711000	EJ	On-Demand	Anodyne	TERT	22	40
CCOC1CC(C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450711018	EF	On-Demand	Anodyne	GSK3A	19	44
CCC(=O)c1ccc(NCc2nn(C)cc2Cl)c(S(N)(=O)=O)c1	ZINC000450711035	FD	On-Demand	Anodyne	CA2	19	41
CCC(=O)c1ccc(NCc2nn(C)cc2Cl)c(S(N)(=O)=O)c1	ZINC000450711035	FD	On-Demand	Anodyne	CA6	26	41
CCC(=O)c1ccc(NCc2nn(C)cc2Cl)c(S(N)(=O)=O)c1	ZINC000450711035	FD	On-Demand	Anodyne	CA1	19	41
CCC(=O)c1ccc(NCc2nn(C)cc2Cl)c(S(N)(=O)=O)c1	ZINC000450711035	FD	On-Demand	Anodyne	CA7	24	41
CCC(=O)c1ccc(NCc2nn(C)cc2Cl)c(S(N)(=O)=O)c1	ZINC000450711035	FD	On-Demand	Anodyne	CA13	45	41
CCCc1nc(C)c(CSc2nnc(-c3ccc(N(CC)CC)cc3)o2)o1	ZINC000450711057	GK	On-Demand	Anodyne	GSK3A	45	36
CCNC(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)nn1	ZINC000450711078	DD	On-Demand	Anodyne	SCD1	40	39
CCNC(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)nn1	ZINC000450711079	DD	On-Demand	Anodyne	SCD1	40	39
CCNC(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)nn1	ZINC000450711080	DD	On-Demand	Anodyne	SCD1	40	39
CCNC(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)nn1	ZINC000450711081	DD	On-Demand	Anodyne	SCD1	40	39
CCC[C@@H](Nc1cc(COC)nc2ncnn12)C(C)(C)C	ZINC000450711083	CF	On-Demand	Anodyne	DHOD	0	43
CCC[C@H](Nc1cc(COC)nc2ncnn12)C(C)(C)C	ZINC000450711084	CF	On-Demand	Anodyne	DHOD	0	43
CCn1c(SCC(=O)CC(C)(C)C2CC2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450711101	GG	On-Demand	Anodyne	CNR2	21	42
COC(=O)C[C@H](NC(=O)CCCn1nc(C)nc1C)c1ccc2ccccc2c1	ZINC000450711107	GG	On-Demand	Anodyne	CYP26A1	54	36
COC(=O)C[C@@H](NC(=O)CCCn1nc(C)nc1C)c1ccc2ccccc2c1	ZINC000450711108	GG	On-Demand	Anodyne	CYP26A1	54	36
COc1cc(CN2CCC(C)(c3nc(C)no3)CC2)ccc1Cl	ZINC000450711112	EH	On-Demand	Anodyne	SSTR5	49	37
CCOC(=O)c1cc(C(=O)N[C@H](Cc2ccccc2Cl)C(=O)OCC)on1	ZINC000450711113	GE	On-Demand	Anodyne	CCR3	0	46
CCOC(=O)c1cc(C(=O)N[C@H](Cc2ccccc2Cl)C(=O)OCC)on1	ZINC000450711113	GE	On-Demand	Anodyne	PSMB5	28	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2Cl)C(=O)OCC)on1	ZINC000450711114	GE	On-Demand	Anodyne	CCR3	0	46
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2Cl)C(=O)OCC)on1	ZINC000450711114	GE	On-Demand	Anodyne	PSMB5	28	40
CSc1cccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)c1	ZINC000450711115	DE	On-Demand	Anodyne	DRD4	45	34
CSc1cccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)c1	ZINC000450711115	DE	On-Demand	Anodyne	PRKD1	39	42
CSc1cccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)c1	ZINC000450711116	DE	On-Demand	Anodyne	DRD4	45	34
CSc1cccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)c1	ZINC000450711116	DE	On-Demand	Anodyne	PRKD1	39	42
COC(=O)c1csc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450711126	GH	On-Demand	Anodyne	RBP4	73	39
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	ACE	55	38
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	GHRHR	53	33
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	P2RY12	45	30
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	CCKAR	16	40
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	CCR1	37	44
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	REN	41	38
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	CCKBR	15	40
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	ACE2	55	37
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	40
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	GAG-PRO	59	35
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450711127	EE	On-Demand	Anodyne	BRCA1	45	33
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	ACE	55	38
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	GHRHR	53	33
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	P2RY12	45	30
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	CCKAR	16	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	CCR1	37	44
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	REN	41	38
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	CCKBR	15	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	ACE2	55	37
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	GAG-PRO	59	35
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711128	EE	On-Demand	Anodyne	BRCA1	45	33
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	ACE	55	38
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	GHRHR	53	33
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	P2RY12	45	30
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	CCKAR	16	40
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	CCR1	37	44
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	REN	41	38
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	CCKBR	15	40
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	ACE2	55	37
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	40
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	GAG-PRO	59	35
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450711129	EE	On-Demand	Anodyne	BRCA1	45	33
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	ACE	30	40
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	MME	77	40
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	ANPEP	41	31
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	PAPA1_CARPA	47	35
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	TIMP3	49	33
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	CAPNS1	46	31
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	CAPN1	48	36
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	ACE2	56	34
C=C(C)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711132	EH	On-Demand	Mild	POL	0	41
COC(=O)c1csc(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450711133	GH	On-Demand	Anodyne	RBP4	73	39
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	ACE	30	40
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	MME	77	40
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	ANPEP	41	31
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	PAPA1_CARPA	47	35
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	TIMP3	49	33
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	CAPNS1	46	31
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	CAPN1	48	36
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	ACE2	56	34
C=C(C)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711134	EH	On-Demand	Mild	POL	0	41
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	ACE	30	40
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	MME	77	40
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	ANPEP	41	31
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	PAPA1_CARPA	47	35
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	TIMP3	49	33
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	CAPNS1	46	31
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	CAPN1	48	36
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	ACE2	56	34
C=C(C)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711136	EH	On-Demand	Mild	POL	0	41
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	ACE	30	40
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	MME	77	40
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	ANPEP	41	31
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	PAPA1_CARPA	47	35
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	TIMP3	49	33
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	CAPNS1	46	31
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	CAPN1	48	36
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	ACE2	56	34
C=C(C)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(F)c1	ZINC000450711138	EH	On-Demand	Mild	POL	0	41
COc1ccccc1-n1cnc2cc(C(=O)N(CCN(C)C)C3CC3)ccc21	ZINC000450711140	GG	On-Demand	Anodyne	PDGFRB	15	43
COc1ccccc1-n1cnc2cc(C(=O)N(CCN(C)C)C3CC3)ccc21	ZINC000450711140	GG	On-Demand	Anodyne	PLK1	42	35
COc1ccccc1-n1cnc2cc(C(=O)N(CCN(C)C)C3CC3)ccc21	ZINC000450711140	GG	On-Demand	Anodyne	MBTPS1	60	37
COc1ccccc1-n1cnc2cc(C(=O)N(CCN(C)C)C3CC3)ccc21	ZINC000450711140	GG	On-Demand	Anodyne	HPGD	49	59
COc1ccccc1-n1cnc2cc(C(=O)N(CCN(C)C)C3CC3)ccc21	ZINC000450711140	GG	On-Demand	Anodyne	ACKR3	60	33
CC(C)(C)NC(=O)N1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450711176	EF	On-Demand	Anodyne	FABP4	43	34
CN(C)CCN(C(=O)c1csc(Nc2cc(F)cc(F)c2)n1)C1CC1	ZINC000450711181	FF	On-Demand	Anodyne	TRPC6	71	41
CN(C)CCN(C(=O)c1csc(Nc2cc(F)cc(F)c2)n1)C1CC1	ZINC000450711181	FF	On-Demand	Anodyne	TRPC3	56	41
Cc1nn(C)cc1CC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711184	GE	On-Demand	Anodyne	P2RX7	46	38
Cc1nn(C)cc1CC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711185	GE	On-Demand	Anodyne	P2RX7	46	38
Cc1noc(C2(C)CCN(CCN(C)Cc3ccccc3)CC2)n1	ZINC000450711199	EF	On-Demand	Anodyne	SIGMAR1	46	43
Cc1sccc1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711203	FH	On-Demand	Anodyne	RBP4	54	37
Cc1sccc1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711205	FH	On-Demand	Anodyne	RBP4	54	37
Cc1ccc(C(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c(Cl)c1Cl	ZINC000450711221	FH	On-Demand	Anodyne	P2RX7	40	39
CO[C@H](Cc1ccccc1)C(=O)N1CCC(n2cncc2C)CC1	ZINC000450711229	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(n2cncc2C)CC1	ZINC000450711230	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	40
CCOc1ccccc1-c1nnc(SCC2=CCCCC2)o1	ZINC000450711232	DJ	On-Demand	Anodyne	TERT	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(n2cncc2C)CC1	ZINC000450711258	FH	On-Demand	Anodyne	CACNA1B	41	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(n2cncc2C)CC1	ZINC000450711258	FH	On-Demand	Anodyne	LIPG	52	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(n2cncc2C)CC1	ZINC000450711258	FH	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(n2cncc2C)CC1	ZINC000450711258	FH	On-Demand	Anodyne	L3MBTL3	55	36
CC(=O)N[C@@H](C)C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450711261	EF	On-Demand	Anodyne	L3MBTL3	44	33
CC(=O)N[C@H](C)C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450711263	EF	On-Demand	Anodyne	L3MBTL3	44	33
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	DRD2	35	51
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	DRD1	24	50
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	DRD4	23	51
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	HTR2A	27	54
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	DRD3	15	55
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	ERG2	24	51
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	SIGMAR1	15	54
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	SLC18A3	22	54
Cc1noc(C2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450711268	EH	On-Demand	Anodyne	CYP2J2	56	41
CCOc1ccccc1-c1nnc(S[C@H](C)C(=O)C2CCCCC2)o1	ZINC000450711271	FJ	On-Demand	Anodyne	ALOX15	35	43
CCOc1ccccc1-c1nnc(S[C@H](C)C(=O)C2CCCCC2)o1	ZINC000450711271	FJ	On-Demand	Anodyne	HCN1	41	32
CCOc1ccccc1-c1nnc(S[C@H](C)C(=O)C2CCCCC2)o1	ZINC000450711271	FJ	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1-c1nnc(S[C@@H](C)C(=O)C2CCCCC2)o1	ZINC000450711272	FJ	On-Demand	Anodyne	ALOX15	35	43
CCOc1ccccc1-c1nnc(S[C@@H](C)C(=O)C2CCCCC2)o1	ZINC000450711272	FJ	On-Demand	Anodyne	HCN1	41	32
CCOc1ccccc1-c1nnc(S[C@@H](C)C(=O)C2CCCCC2)o1	ZINC000450711272	FJ	On-Demand	Anodyne	HCN4	41	32
Cc1csc(NC2CCN(C(=O)[C@@H]3CC3(F)F)CC2)n1	ZINC000450711288	DF	On-Demand	Anodyne	TRPC6	46	34
Cc1csc(NC2CCN(C(=O)[C@H]3CC3(F)F)CC2)n1	ZINC000450711289	DF	On-Demand	Anodyne	TRPC6	46	34
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711292	GH	On-Demand	Anodyne	SCN9A	37	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711292	GH	On-Demand	Anodyne	RBP4	50	33
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711292	GH	On-Demand	Anodyne	SLC16A1	40	31
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711293	GH	On-Demand	Anodyne	SCN9A	37	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711293	GH	On-Demand	Anodyne	RBP4	50	33
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711293	GH	On-Demand	Anodyne	SLC16A1	40	31
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711294	GH	On-Demand	Anodyne	SCN9A	37	41
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711294	GH	On-Demand	Anodyne	RBP4	50	33
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711294	GH	On-Demand	Anodyne	SLC16A1	40	31
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711295	GH	On-Demand	Anodyne	SCN9A	37	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711295	GH	On-Demand	Anodyne	RBP4	50	33
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711295	GH	On-Demand	Anodyne	SLC16A1	40	31
COC(=O)c1csc(CN2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450711307	EF	On-Demand	Anodyne	COLA	45	43
COC(=O)c1csc(CN2CC[C@H](COc3ccccc3)C2)n1	ZINC000450711308	EF	On-Demand	Anodyne	COLA	45	43
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450711325	GG	On-Demand	Anodyne	SLC12A5	54	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450711326	GG	On-Demand	Anodyne	SLC12A5	54	40
C/C=C\C[C@@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450711344	EF	On-Demand	Anodyne	MTNR1A	19	42
C/C=C\C[C@@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450711344	EF	On-Demand	Anodyne	MTNR1B	19	42
C/C=C/C[C@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450711349	EF	On-Demand	Anodyne	MTNR1A	19	42
C/C=C/C[C@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450711349	EF	On-Demand	Anodyne	MTNR1B	19	42
C/C=C\C[C@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450711350	EF	On-Demand	Anodyne	MTNR1A	19	42
C/C=C\C[C@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450711350	EF	On-Demand	Anodyne	MTNR1B	19	42
C/C=C/C[C@@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450711351	EF	On-Demand	Anodyne	MTNR1A	19	42
C/C=C/C[C@@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450711351	EF	On-Demand	Anodyne	MTNR1B	19	42
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCCC(=O)c1ccccc1	ZINC000450711373	EE	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCCC(=O)c1ccccc1	ZINC000450711373	EE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCCC(=O)c1ccccc1	ZINC000450711373	EE	On-Demand	Anodyne	PREP	28	40
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CCCC(=O)c1ccccc1	ZINC000450711373	EE	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H](C(=O)OC)C1	ZINC000450711374	EE	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H](C(=O)OC)C1	ZINC000450711374	EE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H](C(=O)OC)C1	ZINC000450711374	EE	On-Demand	Anodyne	PREP	28	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H](C(=O)OC)C1	ZINC000450711374	EE	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450711375	EE	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450711375	EE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450711375	EE	On-Demand	Anodyne	PREP	28	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450711375	EE	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450711377	EE	On-Demand	Anodyne	SLC6A1	52	34
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450711377	EE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450711377	EE	On-Demand	Anodyne	PREP	28	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450711377	EE	On-Demand	Anodyne	CYP2J2	56	40
CCN1CCN(c2cccc(NC(=O)Cn3cc(C(C)=O)nn3)c2)CC1	ZINC000450711384	FD	On-Demand	Anodyne	HTR1A	16	43
Cc1nc2ccccc2c(N2C[C@H](F)[C@H](F)C2)c1C	ZINC000450711394	CG	On-Demand	Anodyne	ATP4A	25	41
COc1ccc(-c2csc3ncnc(N4C[C@H](F)[C@H](F)C4)c23)cc1	ZINC000450711396	EH	On-Demand	Anodyne	ADRB3	16	51
C[C@H]1[C@H](O)CCCN1c1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450711399	GF	On-Demand	Bother	NOD2	19	44
C[C@@H]1[C@@H](O)CCCN1c1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450711400	GF	On-Demand	Bother	NOD2	19	44
C[C@H]1[C@@H](O)CCCN1c1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450711401	GF	On-Demand	Bother	NOD2	19	44
C[C@@H]1[C@H](O)CCCN1c1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450711402	GF	On-Demand	Bother	NOD2	19	44
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(Cl)c(OC)c1)n2C	ZINC000450711408	FG	On-Demand	Anodyne	PTGS1	0	42
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(Cl)c(OC)c1)n2C	ZINC000450711408	FG	On-Demand	Anodyne	PTGS2	45	42
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(Cl)c(OC)c1)n2C	ZINC000450711408	FG	On-Demand	Anodyne	TRPV1	33	43
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(Cl)c(OC)c1)n2C	ZINC000450711408	FG	On-Demand	Anodyne	MTNR1A	44	38
COc1ccc2c(c1)nc(CNC(=O)Cc1ccc(Cl)c(OC)c1)n2C	ZINC000450711408	FG	On-Demand	Anodyne	PTGES	15	44
CN(C)CCN(C(=O)[C@H]1CCCN(c2ccccc2)C1=O)C1CC1	ZINC000450711411	ED	On-Demand	Anodyne	HDAC8	0	42
COc1ccc2c(c1)nc(CNC(=O)[C@H]1CCN(c3ccccc3)C1)n2C	ZINC000450711412	FF	On-Demand	Anodyne	DRD4	42	32
CN(C)CCN(C(=O)[C@@H]1CCCN(c2ccccc2)C1=O)C1CC1	ZINC000450711413	ED	On-Demand	Anodyne	HDAC8	0	42
COc1ccc2c(c1)nc(CNC(=O)[C@@H]1CCN(c3ccccc3)C1)n2C	ZINC000450711415	FF	On-Demand	Anodyne	DRD4	42	32
CCN1CCN(c2cccc(NC(=O)C[C@@H]3CC[C@H]4C[C@H]34)c2)CC1	ZINC000450711444	EG	On-Demand	Anodyne	HTR1A	25	46
CCN1CCN(c2cccc(NC(=O)C[C@@H]3CC[C@H]4C[C@H]34)c2)CC1	ZINC000450711444	EG	On-Demand	Anodyne	HTR7	18	44
CCN1CCN(c2cccc(NC(=O)C[C@@H]3CC[C@@H]4C[C@H]34)c2)CC1	ZINC000450711446	EG	On-Demand	Anodyne	HTR1A	22	44
CCN1CCN(c2cccc(NC(=O)C[C@@H]3CC[C@@H]4C[C@@H]34)c2)CC1	ZINC000450711448	EG	On-Demand	Anodyne	HTR1A	25	46
CCN1CCN(c2cccc(NC(=O)C[C@@H]3CC[C@@H]4C[C@@H]34)c2)CC1	ZINC000450711448	EG	On-Demand	Anodyne	HTR7	18	44
CCN1CCN(c2cccc(NC(=O)C[C@@H]3CC[C@H]4C[C@@H]34)c2)CC1	ZINC000450711450	EG	On-Demand	Anodyne	HTR1A	22	44
CN1CCN(c2nc3ccccc3nc2N2C[C@H](F)[C@H](F)C2)CC1	ZINC000450711462	ED	On-Demand	Anodyne	HRH1	0	50
CN1CCN(c2nc3ccccc3nc2N2C[C@H](F)[C@H](F)C2)CC1	ZINC000450711462	ED	On-Demand	Anodyne	HTR3A	29	61
CN1CCN(c2nc3ccccc3nc2N2C[C@H](F)[C@H](F)C2)CC1	ZINC000450711462	ED	On-Demand	Anodyne	HRH4	49	48
CC(=O)[C@](C)(O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450711467	CD	On-Demand	Anodyne	ACHE	18	40
CC(=O)[C@](C)(O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450711467	CD	On-Demand	Anodyne	LTA4H	19	44
CC(=O)[C@](C)(O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450711467	CD	On-Demand	Anodyne	SIGMAR1	31	51
CC(=O)[C@](C)(O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450711467	CD	On-Demand	Anodyne	CHRNA10	38	40
CC(=O)[C@](C)(O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450711469	CD	On-Demand	Anodyne	ACHE	18	40
CC(=O)[C@](C)(O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450711469	CD	On-Demand	Anodyne	LTA4H	19	44
CC(=O)[C@](C)(O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450711469	CD	On-Demand	Anodyne	SIGMAR1	31	51
CC(=O)[C@](C)(O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450711469	CD	On-Demand	Anodyne	CHRNA10	38	40
CC(=O)[C@@](C)(O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450711470	CD	On-Demand	Anodyne	ACHE	18	40
CC(=O)[C@@](C)(O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450711470	CD	On-Demand	Anodyne	LTA4H	19	44
CC(=O)[C@@](C)(O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450711470	CD	On-Demand	Anodyne	SIGMAR1	31	51
CC(=O)[C@@](C)(O)CN1CC[C@H](COc2ccccc2)C1	ZINC000450711470	CD	On-Demand	Anodyne	CHRNA10	38	40
CC(=O)[C@@](C)(O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450711471	CD	On-Demand	Anodyne	ACHE	18	40
CC(=O)[C@@](C)(O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450711471	CD	On-Demand	Anodyne	LTA4H	19	44
CC(=O)[C@@](C)(O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450711471	CD	On-Demand	Anodyne	SIGMAR1	31	51
CC(=O)[C@@](C)(O)CN1CC[C@@H](COc2ccccc2)C1	ZINC000450711471	CD	On-Demand	Anodyne	CHRNA10	38	40
O=C(c1cc(Cl)c(Br)cc1F)N1CCn2ncnc2C1	ZINC000450711493	FE	On-Demand	Anodyne	P2RX7	40	43
N#Cc1cc(N2CC[C@](O)(C(F)F)C2)ccc1C(F)(F)F	ZINC000450711525	DF	On-Demand	Mild	AR	19	42
N#Cc1cc(N2CC[C@@](O)(C(F)F)C2)ccc1C(F)(F)F	ZINC000450711526	DF	On-Demand	Mild	AR	19	42
COC1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCCCC1	ZINC000450711532	EG	On-Demand	Anodyne	HCN1	67	41
COC1(CNC(=O)c2ccccc2-n2ccc(C)n2)CCCCC1	ZINC000450711532	EG	On-Demand	Anodyne	HCN4	59	39
CC(C)c1ccc(-n2nnnc2SCC[C@@H](C)O)cc1	ZINC000450711535	CF	On-Demand	Anodyne	CELA2A	27	40
CC(C)c1ccc(-n2nnnc2SCC[C@H](C)O)cc1	ZINC000450711537	CF	On-Demand	Anodyne	CELA2A	27	40
CS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1	ZINC000450711553	DE	On-Demand	Anodyne	GPR119	18	40
CS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)cc1	ZINC000450711555	DE	On-Demand	Anodyne	GPR119	18	40
CS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1	ZINC000450711557	DE	On-Demand	Anodyne	GPR119	18	40
CS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1	ZINC000450711559	DE	On-Demand	Anodyne	GPR119	18	40
CCOC(=O)C1(CNC(=O)c2cccc3c2CCCC3)CC1	ZINC000450711577	DF	On-Demand	Anodyne	KCNA3	34	40
CCOC(=O)C1(CNC(=O)c2cccc3c2CCCC3)CC1	ZINC000450711577	DF	On-Demand	Anodyne	HCN1	67	38
CCOC(=O)C1(CNC(=O)c2cccc3c2CCCC3)CC1	ZINC000450711577	DF	On-Demand	Anodyne	HCN4	56	37
CCc1cc(N2CC[C@@](O)(C(F)F)C2)c2ccccc2n1	ZINC000450711633	CG	On-Demand	Anodyne	METAP1	41	36
CCc1cc(N2CC[C@](O)(C(F)F)C2)c2ccccc2n1	ZINC000450711635	CG	On-Demand	Anodyne	METAP1	41	36
CC(C)CCCC(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450711662	DH	On-Demand	Anodyne	HTR7	24	42
Cn1cc(Cl)c(CNc2cc(C(F)(F)F)nc3ncnn23)n1	ZINC000450711677	EE	On-Demand	Anodyne	DHOD	0	51
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711700	EH	On-Demand	Anodyne	DRD4	18	44
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711700	EH	On-Demand	Anodyne	HTR2A	22	45
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711700	EH	On-Demand	Anodyne	SLC6A1	80	37
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711700	EH	On-Demand	Anodyne	PLD1	43	34
O=C(CCCN1CC[C@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711700	EH	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711701	EH	On-Demand	Anodyne	DRD4	18	44
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711701	EH	On-Demand	Anodyne	HTR2A	22	45
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711701	EH	On-Demand	Anodyne	SLC6A1	80	37
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711701	EH	On-Demand	Anodyne	PLD1	43	34
O=C(CCCN1CC[C@@H](n2ncc3ccccc32)C1)c1ccccc1	ZINC000450711701	EH	On-Demand	Anodyne	CYP2J2	60	42
COCCOC[C@@H](O)CN1CCc2c(ncn2-c2ccc(F)cc2)C1	ZINC000450711713	ED	On-Demand	Anodyne	HSP90AB1	33	40
COCCOC[C@H](O)CN1CCc2c(ncn2-c2ccc(F)cc2)C1	ZINC000450711714	ED	On-Demand	Anodyne	HSP90AB1	33	40
Cc1csc(NC2CCN(C(=O)c3cccc(C(F)(F)F)n3)CC2)n1	ZINC000450711724	FH	On-Demand	Anodyne	SFRP1	79	37
Cc1csc(NC2CCN(C(=O)c3cccc(C(F)(F)F)n3)CC2)n1	ZINC000450711724	FH	On-Demand	Anodyne	WNT3	59	32
Cc1csc(NC2CCN(C(=O)c3cccc(C(F)(F)F)n3)CC2)n1	ZINC000450711724	FH	On-Demand	Anodyne	TRPC6	62	41
Cc1csc(NC2CCN(C(=O)c3cccc(C(F)(F)F)n3)CC2)n1	ZINC000450711724	FH	On-Demand	Anodyne	TRPC3	36	41
OC[C@@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(F)c1	ZINC000450711737	CE	On-Demand	Anodyne	MAN1B1	45	37
OC[C@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(F)c1	ZINC000450711738	CE	On-Demand	Anodyne	MAN1B1	45	37
OC[C@H](NC[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(F)c1	ZINC000450711739	CE	On-Demand	Anodyne	MAN1B1	45	37
OC[C@@H](NC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(F)c1	ZINC000450711740	CE	On-Demand	Anodyne	MAN1B1	45	37
CCCc1cc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)no1	ZINC000450711742	EG	On-Demand	Anodyne	TRPC6	51	38
COc1cccc2c1nc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)n2C	ZINC000450711747	FG	On-Demand	Anodyne	ANPEP	29	43
O=C1CCC(CN2CCNC(=O)[C@@H]2Cc2ccccc2)CC1	ZINC000450711761	DD	On-Demand	Anodyne	GHRL	51	32
O=C1CCC(CN2CCNC(=O)[C@H]2Cc2ccccc2)CC1	ZINC000450711763	DD	On-Demand	Anodyne	GHRL	51	32
CC(C)(C)C(=O)CCCC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711788	GH	On-Demand	Anodyne	RBP4	55	33
CC(C)(C)C(=O)CCCC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450711790	GH	On-Demand	Anodyne	RBP4	55	33
CC[C@@](C)(CNc1ccc([N+](=O)[O-])cc1C(=O)NC)OC	ZINC000450711823	CE	On-Demand	Bother	KCNMA1	19	40
CC[C@](C)(CNc1ccc([N+](=O)[O-])cc1C(=O)NC)OC	ZINC000450711824	CE	On-Demand	Bother	KCNMA1	19	40
COC1(CSc2nnc(-c3cccc(Br)c3)o2)CCC1	ZINC000450711832	FI	On-Demand	Anodyne	GSK3A	40	38
COC1(CSc2nnc(-c3cccc(Br)c3)o2)CCC1	ZINC000450711832	FI	On-Demand	Anodyne	TERT	25	46
COc1cc(CC(=O)N2CCCC3(CC3)C2)ccc1Cl	ZINC000450711837	CG	On-Demand	Anodyne	OPRK1	40	38
COc1cc(CC(=O)N2CCCC3(CC3)C2)ccc1Cl	ZINC000450711837	CG	On-Demand	Anodyne	TACR2	16	42
COc1cc(CC(=O)N2CCCC3(CC3)C2)ccc1Cl	ZINC000450711837	CG	On-Demand	Anodyne	CCR1	30	41
Cc1cncn1C1CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450711840	FF	On-Demand	Anodyne	RHODESAIN	0	41
CC(C)(C)NC(=O)N1CCN(C(=O)C[C@H]2COc3ccccc3O2)CC1	ZINC000450711841	FD	On-Demand	Anodyne	ADRA2B	19	40
CC(C)(C)NC(=O)N1CCN(C(=O)C[C@@H]2COc3ccccc3O2)CC1	ZINC000450711842	FD	On-Demand	Anodyne	ADRA2B	19	40
CCOc1ccccc1-c1nnc(SCc2nc(C(=O)OC)co2)o1	ZINC000450711845	FG	On-Demand	Anodyne	ALOX15	61	37
C=C(C)CCNc1cc(COC)nc2ncnn12	ZINC000450711857	BD	On-Demand	Mild	DHOD	0	44
C=C(C)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450711859	DH	On-Demand	Mild	AVPR2	42	37
Cc1cncn1C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711896	GI	On-Demand	Anodyne	MC4R	41	41
Cc1cncn1C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711896	GI	On-Demand	Anodyne	PRCP	63	46
Cc1cncn1C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711896	GI	On-Demand	Anodyne	MC3R	44	41
Cc1cncn1C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711896	GI	On-Demand	Anodyne	MC5R	33	41
Cc1cncn1C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711897	GI	On-Demand	Anodyne	MC4R	41	41
Cc1cncn1C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711897	GI	On-Demand	Anodyne	PRCP	63	46
Cc1cncn1C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711897	GI	On-Demand	Anodyne	MC3R	44	41
Cc1cncn1C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711897	GI	On-Demand	Anodyne	MC5R	33	41
Cc1cncn1C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711898	GI	On-Demand	Anodyne	MC4R	41	41
Cc1cncn1C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711898	GI	On-Demand	Anodyne	PRCP	63	46
Cc1cncn1C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711898	GI	On-Demand	Anodyne	MC3R	44	41
Cc1cncn1C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450711898	GI	On-Demand	Anodyne	MC5R	33	41
C=CC(C)(C)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450711906	DF	On-Demand	Mild	HTR1A	19	44
C=CC(C)(C)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450711906	DF	On-Demand	Mild	NPY2R	30	40
C=CC(C)(C)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450711906	DF	On-Demand	Mild	PRNP	30	42
COc1cc(CN2CCC(n3cc(Cl)cn3)CC2)ccc1Cl	ZINC000450711912	EI	On-Demand	Anodyne	DRD4	34	42
COc1cc(CN2CCC(n3cc(Cl)cn3)CC2)ccc1Cl	ZINC000450711912	EI	On-Demand	Anodyne	SSTR5	69	42
COc1cc(CN2CCC(n3cc(Cl)cn3)CC2)ccc1Cl	ZINC000450711912	EI	On-Demand	Anodyne	CCR3	15	41
COc1cc(CN2CCC(n3cc(Cl)cn3)CC2)ccc1Cl	ZINC000450711912	EI	On-Demand	Anodyne	CXCR3	33	40
COc1cc(CN2CCC(n3cc(Cl)cn3)CC2)ccc1Cl	ZINC000450711912	EI	On-Demand	Anodyne	MCHR1	15	42
Cn1c(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)nc2ccccc21	ZINC000450711930	CF	On-Demand	Anodyne	HRH1	17	49
Cn1c(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)nc2ccccc21	ZINC000450711931	CF	On-Demand	Anodyne	HRH1	17	49
Cn1c(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)nc2ccccc21	ZINC000450711932	CF	On-Demand	Anodyne	HRH1	17	49
Cn1c(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)nc2ccccc21	ZINC000450711933	CF	On-Demand	Anodyne	HRH1	17	49
CCCn1c(SCc2nc(C(=O)OC)co2)nc2cc(Cl)ccc21	ZINC000450711934	FI	On-Demand	Anodyne	GNRHR	0	40
C=CCc1cc([N+](=O)[O-])ccc1OCCCCCC(C)=O	ZINC000450711938	CH	On-Demand	Mild	ACR	32	42
O=C(Nc1c[nH]nc1[C@@H]1CCCN(C(=O)[C@@H](O)C2CCC2)C1)c1ccccc1	ZINC000450711949	GF	On-Demand	Anodyne	P2RY12	44	34
O=C(Nc1c[nH]nc1[C@H]1CCCN(C(=O)[C@@H](O)C2CCC2)C1)c1ccccc1	ZINC000450711952	GF	On-Demand	Anodyne	P2RY12	44	34
O=C(Nc1c[nH]nc1[C@H]1CCCN(C(=O)[C@H](O)C2CCC2)C1)c1ccccc1	ZINC000450711954	GF	On-Demand	Anodyne	P2RY12	44	34
O=C(Nc1c[nH]nc1[C@@H]1CCCN(C(=O)[C@H](O)C2CCC2)C1)c1ccccc1	ZINC000450711955	GF	On-Demand	Anodyne	P2RY12	44	34
O=c1c(Cl)c(N2C[C@H](F)[C@H](F)C2)cnn1-c1cccc(C(F)(F)F)c1	ZINC000450711978	GG	On-Demand	Anodyne	PDS	15	59
F[C@H]1CN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1F	ZINC000450711989	DH	On-Demand	Anodyne	ADRB3	0	52
Cc1ccnc(OC2CCN(CC[C@@H](C)O)CC2)c1	ZINC000450712005	CE	On-Demand	Anodyne	HCRTR1	0	40
Cc1ccnc(OC2CCN(CC[C@@H](C)O)CC2)c1	ZINC000450712005	CE	On-Demand	Anodyne	HCRTR2	0	40
F[C@H]1CN(c2ncnc3ccc(I)cc23)C[C@H]1F	ZINC000450712008	FF	On-Demand	Anodyne	PDE3A	44	33
F[C@H]1CN(c2ncnc3ccc(I)cc23)C[C@H]1F	ZINC000450712008	FF	On-Demand	Anodyne	HTT	0	42
COC[C@@H](CNc1ccc(C(N)=O)cn1)c1ccc(Cl)cc1	ZINC000450712013	DF	On-Demand	Anodyne	GCK	24	41
Cc1ccnc(OC2CCN(CC[C@H](C)O)CC2)c1	ZINC000450712015	CE	On-Demand	Anodyne	HCRTR1	0	40
Cc1ccnc(OC2CCN(CC[C@H](C)O)CC2)c1	ZINC000450712015	CE	On-Demand	Anodyne	HCRTR2	0	40
COC[C@H](CNc1ccc(C(N)=O)cn1)c1ccc(Cl)cc1	ZINC000450712017	DF	On-Demand	Anodyne	GCK	24	41
CC[C@@H]1C[C@H]1C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450712032	EH	On-Demand	Anodyne	UTS2	33	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450712033	EH	On-Demand	Anodyne	UTS2	33	40
O=C(CSC1CC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450712034	GG	On-Demand	Anodyne	SIGMAR1	15	47
O=C(CSC1CC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450712034	GG	On-Demand	Anodyne	RBP4	82	44
O=C(CSC1CC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450712034	GG	On-Demand	Anodyne	SCD1	29	44
O=C(CSC1CC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450712034	GG	On-Demand	Anodyne	SFRP1	122	42
O=C(CSC1CC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450712034	GG	On-Demand	Anodyne	SCD	32	43
O=C(CSC1CC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450712034	GG	On-Demand	Anodyne	WNT3	80	34
CCC[C@@H](OC)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450712036	CE	On-Demand	Anodyne	BRD4	17	47
CC(C)(CC(=O)COc1ccc(S(C)(=O)=O)cc1)C1CC1	ZINC000450712037	DF	On-Demand	Anodyne	PLA2G4B	60	34
CC(C)(CC(=O)COc1ccc(S(C)(=O)=O)cc1)C1CC1	ZINC000450712037	DF	On-Demand	Anodyne	O49150_SOLTU	46	32
CCC[C@H](OC)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450712038	CE	On-Demand	Anodyne	BRD4	17	47
Cc1csc(NC2CCN(C(=O)CCCC(=O)C(C)(C)C)CC2)n1	ZINC000450712043	FH	On-Demand	Anodyne	TRPC6	46	34
CCc1cccc(C(=O)NCCc2nn(C)c3ccccc23)n1	ZINC000450712050	DF	On-Demand	Anodyne	INHA	46	34
CC(=O)[C@](C)(O)CN1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450712051	CF	On-Demand	Anodyne	HSD17B3	47	35
Cc1csc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)c1	ZINC000450712055	GG	On-Demand	Bother	TBXA2R	27	42
CC(=O)[C@@](C)(O)CN1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450712064	CF	On-Demand	Anodyne	HSD17B3	47	35
CCN1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450712067	FD	On-Demand	Anodyne	HTR1A	24	45
CCN1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450712067	FD	On-Demand	Anodyne	HTR2A	25	42
CCN1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450712067	FD	On-Demand	Anodyne	HTR2C	16	42
CCN1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450712067	FD	On-Demand	Anodyne	DRD3	15	42
CCN1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450712067	FD	On-Demand	Anodyne	PRNP	56	44
CCN1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450712067	FD	On-Demand	Anodyne	STAT6	70	35
CCN1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450712067	FD	On-Demand	Anodyne	LIMK2	45	34
COC(=O)C[C@H](NC(=O)c1nn(C)c2c1CCCC2)c1ccc2ccccc2c1	ZINC000450712073	GG	On-Demand	Anodyne	UTS2	39	40
COC(=O)C[C@@H](NC(=O)c1nn(C)c2c1CCCC2)c1ccc2ccccc2c1	ZINC000450712077	GG	On-Demand	Anodyne	UTS2	39	40
CN1Cc2cc(NC(=O)CCCC(=O)C3CC3)ccc2NC1=O	ZINC000450712092	DF	On-Demand	Anodyne	PTPRF	44	34
CN1Cc2cc(NC(=O)CCCC(=O)C3CC3)ccc2NC1=O	ZINC000450712092	DF	On-Demand	Anodyne	BRD4	0	42
CNC(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450712112	EE	On-Demand	Bother	TAAR1	16	41
FC(F)(F)c1ccccc1[C@@H]1CN(CCc2cscn2)CCO1	ZINC000450712114	EH	On-Demand	Anodyne	RBP4	54	37
CNC(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450712116	EE	On-Demand	Bother	TAAR1	16	41
FC(F)(F)c1ccccc1[C@H]1CN(CCc2cscn2)CCO1	ZINC000450712117	EH	On-Demand	Anodyne	RBP4	54	37
CNC(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450712118	EE	On-Demand	Bother	TAAR1	16	41
CNC(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450712120	EE	On-Demand	Bother	TAAR1	16	41
Cc1cncn1C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450712131	GI	On-Demand	Anodyne	MC4R	41	41
Cc1cncn1C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450712131	GI	On-Demand	Anodyne	PRCP	63	46
Cc1cncn1C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450712131	GI	On-Demand	Anodyne	MC3R	44	41
Cc1cncn1C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450712131	GI	On-Demand	Anodyne	MC5R	33	41
CS(=O)(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)c(F)c1	ZINC000450712132	DD	On-Demand	Anodyne	SLC6A9	33	47
CS(=O)(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)c(F)c1	ZINC000450712134	DD	On-Demand	Anodyne	SLC6A9	33	47
Cc1csc(NC2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450712157	GJ	On-Demand	Anodyne	NPBWR1	95	38
Cc1csc(NC2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)n1	ZINC000450712157	GJ	On-Demand	Anodyne	TRPC6	45	33
COc1cccc2c1CCN(C[C@](C)(O)C(C)=O)C2	ZINC000450712158	CD	On-Demand	Anodyne	ABCB1B	40	32
COc1cccc2c1CCN(C[C@@](C)(O)C(C)=O)C2	ZINC000450712162	CD	On-Demand	Anodyne	ABCB1B	40	32
CC(=O)CCCCCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712178	DJ	On-Demand	Anodyne	GSK3B	0	46
CC(=O)CCCCCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712178	DJ	On-Demand	Anodyne	GSK3A	31	41
CC(=O)CCCCCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712178	DJ	On-Demand	Anodyne	ALOX15	56	38
CC(=O)CCCCCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712178	DJ	On-Demand	Anodyne	TERT	24	44
CCC[C@@H](O)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450712190	CD	On-Demand	Anodyne	GALR1	48	35
CCC[C@@H](O)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450712190	CD	On-Demand	Anodyne	GHRL	51	32
CCC[C@H](O)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450712193	CD	On-Demand	Anodyne	GALR1	48	35
CCC[C@H](O)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450712193	CD	On-Demand	Anodyne	GHRL	51	32
CCC[C@@H](O)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450712197	CD	On-Demand	Anodyne	GALR1	48	35
CCC[C@@H](O)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450712197	CD	On-Demand	Anodyne	GHRL	51	32
CCC[C@H](O)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450712200	CD	On-Demand	Anodyne	GALR1	48	35
CCC[C@H](O)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450712200	CD	On-Demand	Anodyne	GHRL	51	32
C[C@H](NCc1cn(CC2CC2)nn1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450712218	FI	On-Demand	Mild	MCHR1	26	44
CCOC(=O)C1(CNC(=O)c2cc3c(Br)cccc3cn2)CC1	ZINC000450712221	GG	On-Demand	Anodyne	HCN1	42	32
CCOC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)nc1	ZINC000450712234	GF	On-Demand	Anodyne	ACHE	15	41
CCOC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)nc1	ZINC000450712234	GF	On-Demand	Anodyne	HTR4	46	41
CCOC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)nc1	ZINC000450712234	GF	On-Demand	Anodyne	HRH3	15	47
CCOC(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)nc1	ZINC000450712234	GF	On-Demand	Anodyne	SSTR5	42	35
O=C(c1cnc(N2C[C@H](F)[C@H](F)C2)c(Cl)c1)N1CCOCC1	ZINC000450712238	ED	On-Demand	Anodyne	AKR1C3	27	41
O=C(c1cnc(N2C[C@H](F)[C@H](F)C2)c(Cl)c1)N1CCOCC1	ZINC000450712238	ED	On-Demand	Anodyne	LRRK2	27	42
C[C@@H](NCc1cn(CC2CC2)nn1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450712240	FI	On-Demand	Mild	MCHR1	26	44
Cc1ccc(-n2ncc(N3C[C@H](F)[C@H](F)C3)c(Cl)c2=O)cc1Cl	ZINC000450712247	FG	On-Demand	Anodyne	NPBWR1	42	40
CC[C@@](C)(CNc1ncnc2c1ncn2C1CC1)OC	ZINC000450712257	CE	On-Demand	Anodyne	ADORA1	39	41
CC[C@@](C)(CNc1ncnc2c1ncn2C1CC1)OC	ZINC000450712257	CE	On-Demand	Anodyne	ADORA2A	0	45
CC[C@@](C)(CNc1ncnc2c1ncn2C1CC1)OC	ZINC000450712257	CE	On-Demand	Anodyne	P2RY1	37	41
CC[C@@](C)(CNc1ncnc2c1ncn2C1CC1)OC	ZINC000450712257	CE	On-Demand	Anodyne	ADORA3	40	36
CC[C@](C)(CNc1ncnc2c1ncn2C1CC1)OC	ZINC000450712260	CE	On-Demand	Anodyne	ADORA1	39	41
CC[C@](C)(CNc1ncnc2c1ncn2C1CC1)OC	ZINC000450712260	CE	On-Demand	Anodyne	ADORA2A	0	45
CC[C@](C)(CNc1ncnc2c1ncn2C1CC1)OC	ZINC000450712260	CE	On-Demand	Anodyne	P2RY1	37	41
CC[C@](C)(CNc1ncnc2c1ncn2C1CC1)OC	ZINC000450712260	CE	On-Demand	Anodyne	ADORA3	40	36
CCc1cccc(C(=O)NCc2nc3cc(OC)ccc3n2C)n1	ZINC000450712262	DE	On-Demand	Anodyne	DRD4	41	31
CC[C@@](C)(CNc1nc(-c2cccnc2)nc(C)c1C)OC	ZINC000450712264	DF	On-Demand	Anodyne	ROS1	41	33
CC[C@](C)(CNc1nc(-c2cccnc2)nc(C)c1C)OC	ZINC000450712268	DF	On-Demand	Anodyne	ROS1	41	33
COc1cccc(Oc2ccc(C(=O)N(CCN(C)C)C3CC3)nc2)c1	ZINC000450712272	FG	On-Demand	Anodyne	ROCK1	20	41
COc1cccc(Oc2ccc(C(=O)N(CCN(C)C)C3CC3)nc2)c1	ZINC000450712272	FG	On-Demand	Anodyne	MTNR1A	25	42
Fc1cccc(-c2nnn(C[C@@H]3CCCC3(F)F)n2)c1	ZINC000450712285	CF	On-Demand	Anodyne	SCARB1	34	45
Fc1cccc(-c2nnn(C[C@H]3CCCC3(F)F)n2)c1	ZINC000450712287	CF	On-Demand	Anodyne	SCARB1	34	45
C[C@H](OCCc1ccccc1)C(=O)N1CCCC2(CC2)C1	ZINC000450712288	CG	On-Demand	Anodyne	GHRHR	40	32
C[C@H](OCCc1ccccc1)C(=O)N1CCCC2(CC2)C1	ZINC000450712288	CG	On-Demand	Anodyne	SLC12A5	56	37
Cc1ccc(C2CCN(Cc3cnns3)CC2)cn1	ZINC000450712289	CF	On-Demand	Anodyne	MGEA5	27	41
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC2(CC2)C1	ZINC000450712291	CG	On-Demand	Anodyne	GHRHR	40	32
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC2(CC2)C1	ZINC000450712291	CG	On-Demand	Anodyne	SLC12A5	56	37
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCCC2(CC2)C1	ZINC000450712292	CH	On-Demand	Anodyne	ADAM10	43	41
COCCOC[C@H](O)CN1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450712296	GG	On-Demand	Anodyne	VACHT_TETCF	0	44
COCCOC[C@H](O)CN1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450712296	GG	On-Demand	Anodyne	HSP90AB1	35	44
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCCC2(CC2)C1	ZINC000450712308	CH	On-Demand	Anodyne	ADAM10	43	41
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CCCC2(CC2)C1	ZINC000450712310	CH	On-Demand	Anodyne	ADAM10	43	41
COCCOC[C@H](O)CN1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450712311	GG	On-Demand	Anodyne	VACHT_TETCF	0	44
COCCOC[C@H](O)CN1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450712311	GG	On-Demand	Anodyne	HSP90AB1	35	44
COCCOC[C@H](O)CN1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450712312	GG	On-Demand	Anodyne	VACHT_TETCF	0	44
COCCOC[C@H](O)CN1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450712312	GG	On-Demand	Anodyne	HSP90AB1	35	44
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CCCC2(CC2)C1	ZINC000450712313	CH	On-Demand	Anodyne	ADAM10	43	41
CCOC(=O)C1(CNC(=O)COc2cccc(Br)c2C#N)CC1	ZINC000450712315	GE	On-Demand	Mild	RPS27	42	33
COCCOC[C@H](O)CN1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450712316	GG	On-Demand	Anodyne	VACHT_TETCF	0	44
COCCOC[C@H](O)CN1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450712316	GG	On-Demand	Anodyne	HSP90AB1	35	44
COC(=O)C[C@H](NC(=O)CC1(O)CCC1)c1ccc2ccccc2c1	ZINC000450712330	EF	On-Demand	Anodyne	UTS2	34	41
C[C@H](O)CCCN1CCC(CCCn2ccnc2)CC1	ZINC000450712332	CF	On-Demand	Anodyne	TBXAS1	17	41
C[C@@H](O)CCCN1CCC(CCCn2ccnc2)CC1	ZINC000450712334	CF	On-Demand	Anodyne	TBXAS1	17	41
COC(=O)C[C@@H](NC(=O)CC1(O)CCC1)c1ccc2ccccc2c1	ZINC000450712335	EF	On-Demand	Anodyne	UTS2	34	41
COc1ccc(CNC(=O)CCN[C@H](CO)c2cccc(F)c2)c(OC)c1	ZINC000450712338	GE	On-Demand	Anodyne	MTNR1A	59	41
COc1ccc(CNC(=O)CCN[C@H](CO)c2cccc(F)c2)c(OC)c1	ZINC000450712338	GE	On-Demand	Anodyne	MTNR1B	53	41
COc1ccc(CNC(=O)CCN[C@@H](CO)c2cccc(F)c2)c(OC)c1	ZINC000450712341	GE	On-Demand	Anodyne	MTNR1A	59	41
COc1ccc(CNC(=O)CCN[C@@H](CO)c2cccc(F)c2)c(OC)c1	ZINC000450712341	GE	On-Demand	Anodyne	MTNR1B	53	41
Cc1ccccc1-c1nnc(SCC2CC(F)(F)C2)n1Cc1ccco1	ZINC000450712342	GK	On-Demand	Anodyne	HCRTR2	23	47
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	HTR1A	15	61
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	DRD2	36	46
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	DRD1	23	48
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	DRD4	26	47
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	ACHE	22	43
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	HTR2A	40	53
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	HTR2C	23	60
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	SLC6A4	15	45
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	HRH1	23	48
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	DRD3	15	48
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	SLC6A3	22	45
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	ERG2	22	46
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	HTR7	17	46
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	SIGMAR1	26	55
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	CCR3	50	45
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	CCR5	18	42
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	SLC18A3	0	47
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	HTR3B	0	46
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	MCHR1	15	47
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	CYP2J2	69	48
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450712374	GI	On-Demand	Anodyne	AP2S1	0	46
C=CCOc1ccc(CC(=O)N2CCC([C@H](C)NC(C)=O)CC2)cc1	ZINC000450712387	EF	On-Demand	Mild	ACACA	65	35
C=CCOc1ccc(CC(=O)N2CCC([C@@H](C)NC(C)=O)CC2)cc1	ZINC000450712390	EF	On-Demand	Mild	ACACA	65	35
CC[C@@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450712392	EE	On-Demand	Bother	BDKRB1	24	45
CC[C@@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450712392	EE	On-Demand	Bother	COLA	45	34
CC[C@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450712394	EE	On-Demand	Bother	BDKRB1	24	45
CC[C@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])OC	ZINC000450712394	EE	On-Demand	Bother	COLA	45	34
COc1cccc(-n2cc(C(=O)NCC3(CO)CCCC3)nn2)c1	ZINC000450712426	ED	On-Demand	Anodyne	DRD4	44	35
CN1Cc2cc(NC(=O)CCCC(=O)C(C)(C)C)ccc2NC1=O	ZINC000450712431	EG	On-Demand	Anodyne	PTPRF	41	32
CN1Cc2cc(NC(=O)CCCC(=O)C(C)(C)C)ccc2NC1=O	ZINC000450712431	EG	On-Demand	Anodyne	BRD4	0	43
C/C=C/C[C@@H](CO)NC(=O)c1ccc2cnccc2c1	ZINC000450712441	CE	On-Demand	Anodyne	AKT1	23	45
C/C=C\C[C@@H](CO)NC(=O)c1ccc2cnccc2c1	ZINC000450712444	CE	On-Demand	Anodyne	AKT1	23	45
C/C=C\C[C@H](CO)NC(=O)c1ccc2cnccc2c1	ZINC000450712445	CE	On-Demand	Anodyne	AKT1	23	45
C/C=C/C[C@H](CO)NC(=O)c1ccc2cnccc2c1	ZINC000450712447	CE	On-Demand	Anodyne	AKT1	23	45
CNS(=O)(=O)NCC(=O)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450712469	GB	On-Demand	Anodyne	COLA	56	45
CNS(=O)(=O)NCC(=O)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450712469	GB	On-Demand	Anodyne	CPT1A	53	45
CNS(=O)(=O)NCC(=O)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450712479	GB	On-Demand	Anodyne	COLA	56	45
CNS(=O)(=O)NCC(=O)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450712479	GB	On-Demand	Anodyne	CPT1A	53	45
CCc1nc(C)c(CSc2nnc(-c3cccc(Cl)c3)o2)o1	ZINC000450712482	EJ	On-Demand	Anodyne	GSK3B	17	49
CCc1nc(C)c(CSc2nnc(-c3cccc(Cl)c3)o2)o1	ZINC000450712482	EJ	On-Demand	Anodyne	GSK3A	48	38
CCc1nc(C)c(CSc2nnc(-c3cccc(Cl)c3)o2)o1	ZINC000450712482	EJ	On-Demand	Anodyne	TERT	26	48
C=C(C)CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450712483	CE	On-Demand	Mild	TBXA2R	30	41
FC1(F)CCC[C@H]1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712485	EJ	On-Demand	Anodyne	GSK3B	0	44
FC1(F)CCC[C@H]1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712485	EJ	On-Demand	Anodyne	GSK3A	41	36
FC1(F)CCC[C@H]1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712485	EJ	On-Demand	Anodyne	TERT	22	45
FC1(F)CCC[C@@H]1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712487	EJ	On-Demand	Anodyne	GSK3B	0	44
FC1(F)CCC[C@@H]1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712487	EJ	On-Demand	Anodyne	GSK3A	41	36
FC1(F)CCC[C@@H]1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450712487	EJ	On-Demand	Anodyne	TERT	22	45
COC(=O)c1coc(CN2CCC(CCCN3CCOCC3)CC2)n1	ZINC000450712488	FD	On-Demand	Anodyne	HTR4	43	40
COC(=O)c1cccc(CN2CCC(CCCn3ccnc3)CC2)c1Cl	ZINC000450712489	GI	On-Demand	Anodyne	TBXAS1	48	41
CO[C@@H](Cc1ccccc1)CN1CCC(c2ccc(C)nc2)CC1	ZINC000450712491	DH	On-Demand	Anodyne	VACHT_TETCF	0	44
CO[C@H](Cc1ccccc1)CN1CCC(c2ccc(C)nc2)CC1	ZINC000450712492	DH	On-Demand	Anodyne	VACHT_TETCF	0	44
CCCCCN(CC(N)=O)Cc1cccc(C(C)=O)c1	ZINC000450712495	CE	On-Demand	Anodyne	PLM2_PLAFA	53	34
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCCC2(CC2)C1	ZINC000450712556	CI	On-Demand	Anodyne	PREP	22	43
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCCC2(CC2)C1	ZINC000450712556	CI	On-Demand	Anodyne	ADAM10	43	41
CCCn1c(SCC[C@H]2CCOC2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450712557	FF	On-Demand	Anodyne	CNR2	0	47
CCCn1c(SCC[C@@H]2CCOC2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450712558	FF	On-Demand	Anodyne	CNR2	0	47
COC(=O)c1ccc(CC(=O)N2CCC(Nc3nc(C)cs3)CC2)cc1	ZINC000450712580	FF	On-Demand	Anodyne	TRPC6	47	36
CCCCn1c(O)nnc1SCc1nc(-c2ccc(OC)nn2)no1	ZINC000450712591	FD	On-Demand	Anodyne	AXIN2	0	44
Nc1ncnc(N2CC[C@](O)(C(F)F)C2)c1Cl	ZINC000450712625	CC	On-Demand	Anodyne	AKT1	30	44
Nc1ncnc(N2CC[C@@](O)(C(F)F)C2)c1Cl	ZINC000450712626	CC	On-Demand	Anodyne	AKT1	30	44
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](COC)c1ccc(Cl)cc1	ZINC000450712676	GG	On-Demand	Bother	KCNMA1	24	44
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](COC)c1ccc(Cl)cc1	ZINC000450712677	GG	On-Demand	Bother	KCNMA1	24	44
COC1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450712679	CE	On-Demand	Mild	HCN1	52	33
COC1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450712679	CE	On-Demand	Mild	HCN4	50	33
Cc1nnc2c3ccccc3c(N3CC[C@@](O)(C(F)F)C3)nn12	ZINC000450712680	DD	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3CC[C@@](O)(C(F)F)C3)nn12	ZINC000450712680	DD	On-Demand	Anodyne	BRD9	54	34
COC(=O)c1csc(CSc2nnc(-c3cc(C)cc(C)c3)o2)n1	ZINC000450712681	FH	On-Demand	Anodyne	GSK3A	26	45
Cc1nnc2c3ccccc3c(N3CC[C@](O)(C(F)F)C3)nn12	ZINC000450712685	DD	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3CC[C@](O)(C(F)F)C3)nn12	ZINC000450712685	DD	On-Demand	Anodyne	BRD9	54	34
CCCCn1c(O)nnc1SCc1nc(-c2cc(OC)ncn2)no1	ZINC000450712693	FD	On-Demand	Anodyne	AXIN2	0	40
CCCc1cc(NCc2cc(C)cs2)n2ncnc2n1	ZINC000450712696	CG	On-Demand	Anodyne	DHOD	0	44
C[C@@H]1CCCN(c2cc(N3CC[C@@](O)(C(F)F)C3)ncn2)C1	ZINC000450712706	DD	On-Demand	Anodyne	PRCP	0	40
C[C@@H]1CCCN(c2cc(N3CC[C@](O)(C(F)F)C3)ncn2)C1	ZINC000450712707	DD	On-Demand	Anodyne	PRCP	0	40
C[C@H]1CCCN(c2cc(N3CC[C@@](O)(C(F)F)C3)ncn2)C1	ZINC000450712708	DD	On-Demand	Anodyne	PRCP	0	40
C[C@H]1CCCN(c2cc(N3CC[C@](O)(C(F)F)C3)ncn2)C1	ZINC000450712709	DD	On-Demand	Anodyne	PRCP	0	40
CCn1nc(C)c(CC(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)c1C	ZINC000450712714	FF	On-Demand	Anodyne	P2RX7	34	46
CC[C@@](C)(CNc1nccc(-c2ccc(OC)cc2)n1)OC	ZINC000450712736	DG	On-Demand	Anodyne	CLK4	25	56
CC[C@](C)(CNc1nccc(-c2ccc(OC)cc2)n1)OC	ZINC000450712738	DG	On-Demand	Anodyne	CLK4	25	56
Cc1cccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)c1	ZINC000450712745	GJ	On-Demand	Anodyne	HCRTR2	20	41
Cc1cccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)c1	ZINC000450712748	GJ	On-Demand	Anodyne	HCRTR2	20	41
CCOCc1nc(C)c(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)s1	ZINC000450712791	GG	On-Demand	Anodyne	HTR1A	20	42
CCOCc1nc(C)c(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)s1	ZINC000450712791	GG	On-Demand	Anodyne	PRNP	25	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450712800	GG	On-Demand	Anodyne	ANPEP	32	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450712800	GG	On-Demand	Anodyne	SCN9A	0	44
CCOC(=O)C1(CNC(=O)c2cncc(Cl)c2)CC1	ZINC000450712811	CD	On-Demand	Anodyne	SCN10A	53	37
CN(C)CCN(C(=O)c1cc2c(Br)c(F)ccc2[nH]1)C1CC1	ZINC000450712812	FG	On-Demand	Anodyne	PYGL	41	39
C=C(C)CCNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450712815	FD	On-Demand	Mild	DDIT3	0	40
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)nn1C(C)C	ZINC000450712817	GG	On-Demand	Anodyne	RBP4	44	34
Cn1cc(Cl)c(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)n1	ZINC000450712821	FE	On-Demand	Anodyne	LRRK2	33	41
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)nn1C(C)C	ZINC000450712823	GG	On-Demand	Anodyne	RBP4	44	34
COc1ccc2c(c1)nc(CNC(=O)Cc1cn(C)nc1C)n2C	ZINC000450712837	ED	On-Demand	Anodyne	MTNR1A	48	41
COc1ccc2c(c1)nc(CNC(=O)Cc1cn(C)nc1C)n2C	ZINC000450712837	ED	On-Demand	Anodyne	MTNR1B	24	41
COc1cc(CN2CCC(CCCO)CC2)ccc1Cl	ZINC000450712840	CG	On-Demand	Anodyne	ACHE	45	48
COc1cc(CN2CCC(CCCO)CC2)ccc1Cl	ZINC000450712840	CG	On-Demand	Anodyne	HRH1	22	46
COc1cc(CN2CCC(CCCO)CC2)ccc1Cl	ZINC000450712840	CG	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC(CCCO)CC2)ccc1Cl	ZINC000450712840	CG	On-Demand	Anodyne	HTR4	45	40
COc1cc(CN2CCC(CCCO)CC2)ccc1Cl	ZINC000450712840	CG	On-Demand	Anodyne	SIGMAR1	46	41
COc1cc(CN2CCC(CCCO)CC2)ccc1Cl	ZINC000450712840	CG	On-Demand	Anodyne	CCR3	35	41
COc1cc(CN2CCC(CCCO)CC2)ccc1Cl	ZINC000450712840	CG	On-Demand	Anodyne	MCHR1	29	44
COc1ccc(Cn2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450712849	FG	On-Demand	Anodyne	PTGDR2	19	46
COc1ccc(Cn2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450712849	FG	On-Demand	Anodyne	PROKR1	53	32
COc1ccc(Cn2c(SCC[C@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450712849	FG	On-Demand	Anodyne	NPBWR1	81	40
CO[C@@H](Cc1ccccc1)CN(C)C1CCC(NC(C)=O)CC1	ZINC000450712850	DF	On-Demand	Anodyne	TIMP3	52	36
COc1ccc(Cn2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450712852	FG	On-Demand	Anodyne	PTGDR2	19	46
COc1ccc(Cn2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450712852	FG	On-Demand	Anodyne	PROKR1	53	32
COc1ccc(Cn2c(SCC[C@@H](C)O)nc3ccccc3c2=O)cc1	ZINC000450712852	FG	On-Demand	Anodyne	NPBWR1	81	40
CO[C@H](Cc1ccccc1)CN(C)C1CCC(NC(C)=O)CC1	ZINC000450712853	DF	On-Demand	Anodyne	TIMP3	52	36
C=C(C)CCNc1ccc(S(=O)(=O)NC)cc1F	ZINC000450712857	CE	On-Demand	Mild	CA4	15	40
CC[C@H](CC(C)C)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450712907	DH	On-Demand	Anodyne	BRD4	0	43
CC[C@@H](CC(C)C)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450712909	DH	On-Demand	Anodyne	BRD4	0	43
Cc1cccc(-c2nnc(SCc3cn(C)nc3C)n2Cc2ccco2)c1	ZINC000450712917	GI	On-Demand	Anodyne	HCRTR2	21	42
CC[C@@](C)(CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)OC	ZINC000450712920	EE	On-Demand	Anodyne	TGM2	15	42
COC(=O)CNC(=O)c1ccc(NCc2cc(C)cs2)c([N+](=O)[O-])c1	ZINC000450712921	FE	On-Demand	Bother	TAAR1	19	44
CC[C@](C)(CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)OC	ZINC000450712923	EE	On-Demand	Anodyne	TGM2	15	42
Cc1cnc(CCCC(=O)NCc2nc(-c3cc4ccccc4o3)cs2)o1	ZINC000450712940	GI	On-Demand	Anodyne	SUCNR1	36	43
CC[C@@](C)(CNc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl)OC	ZINC000450712941	FH	On-Demand	Anodyne	NPBWR1	49	38
CC[C@](C)(CNc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl)OC	ZINC000450712943	FH	On-Demand	Anodyne	NPBWR1	49	38
COC(=O)C[C@@H](NC(=O)c1cc2n(n1)CCC2)c1ccc2ccccc2c1	ZINC000450712948	FG	On-Demand	Anodyne	CTSA	46	35
COc1cccc(OCCC(=O)N2CC=C(c3ccccc3C)C2)c1	ZINC000450712993	EH	On-Demand	Anodyne	MTNR1B	17	40
C=C(C)CCN=c1ccc(S(=O)(=O)NCC2CC2)c[nH]1	ZINC000450713005	CD	On-Demand	Mild	NPY1R	42	36
CCOC(=O)C1(CNC(=O)c2cnn3c2CCC3)CC1	ZINC000450713034	CC	On-Demand	Anodyne	HCN1	52	35
CCSc1cccnc1C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450713043	FH	On-Demand	Anodyne	TRPC6	47	35
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CC)CC(F)(F)F	ZINC000450713059	GH	On-Demand	Anodyne	ACE2	44	35
O=C(c1ccc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450713060	ED	On-Demand	Bother	SLC6A9	0	43
O=C(c1ccc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450713060	ED	On-Demand	Bother	L3MBTL1	0	44
CCc1c(C(=O)NCC2(CO)CCCC2)oc2ccccc12	ZINC000450713061	DG	On-Demand	Anodyne	HCN1	48	30
CCc1c(C(=O)NCC2(CO)CCCC2)oc2ccccc12	ZINC000450713061	DG	On-Demand	Anodyne	HCN4	46	30
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CC)CC(F)(F)F	ZINC000450713066	GH	On-Demand	Anodyne	ACE2	44	35
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CC)CC(F)(F)F	ZINC000450713067	GH	On-Demand	Anodyne	ACE2	44	35
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CC)CC(F)(F)F	ZINC000450713068	GH	On-Demand	Anodyne	ACE2	44	35
Cc1ccccc1-c1nnc(SCc2cn(C)nc2C)n1Cc1ccco1	ZINC000450713077	GI	On-Demand	Anodyne	HCRTR2	22	46
Cc1csc(NC2CCN(C(=O)Cc3cn(C)nc3C)CC2)n1	ZINC000450713094	EE	On-Demand	Anodyne	TRPC6	46	34
C[C@H](CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1)S(C)(=O)=O	ZINC000450713101	FF	On-Demand	Anodyne	RBP4	68	37
C[C@@H](CN1CCO[C@H](c2ccccc2C(F)(F)F)C1)S(C)(=O)=O	ZINC000450713102	FF	On-Demand	Anodyne	RBP4	68	37
C[C@H](CN1CCO[C@H](c2ccccc2C(F)(F)F)C1)S(C)(=O)=O	ZINC000450713103	FF	On-Demand	Anodyne	RBP4	68	37
C[C@@H](CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1)S(C)(=O)=O	ZINC000450713104	FF	On-Demand	Anodyne	RBP4	68	37
Cc1ccccc1-c1nnc(SCC[C@@H]2CCOC2)n1Cc1ccco1	ZINC000450713131	FI	On-Demand	Anodyne	HCRTR2	22	44
Cc1ccccc1-c1nnc(SCC[C@H]2CCOC2)n1Cc1ccco1	ZINC000450713132	FI	On-Demand	Anodyne	HCRTR2	22	44
C[C@H](NCC1(C#N)CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450713134	DJ	On-Demand	Mild	MCHR1	25	41
C[C@@H](NCC1(C#N)CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450713137	DJ	On-Demand	Mild	MCHR1	25	41
COC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713138	FH	On-Demand	Anodyne	DRD4	35	40
COC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713138	FH	On-Demand	Anodyne	DRD3	28	40
COC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713138	FH	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713138	FH	On-Demand	Anodyne	SSTR5	44	34
COC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713138	FH	On-Demand	Anodyne	CCR3	54	44
COC(=O)c1ccc(CN2CC[C@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713138	FH	On-Demand	Anodyne	MCHR1	32	45
COC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713140	FH	On-Demand	Anodyne	DRD4	35	40
COC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713140	FH	On-Demand	Anodyne	DRD3	28	40
COC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713140	FH	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713140	FH	On-Demand	Anodyne	SSTR5	44	34
COC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713140	FH	On-Demand	Anodyne	CCR3	54	44
COC(=O)c1ccc(CN2CC[C@@H](n3ncc4ccccc43)C2)cc1Cl	ZINC000450713140	FH	On-Demand	Anodyne	MCHR1	32	45
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	AVPR1A	15	40
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	MME	20	44
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	TRPV1	24	48
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	CTSL	18	41
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	PTPRA	42	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	ACE2	48	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	TTR	0	42
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	NCE103	32	44
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	P96878_MYCTU	18	44
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713142	GF	On-Demand	Anodyne	CAN2	0	44
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	AVPR1A	15	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	MME	20	44
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	TRPV1	24	48
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	CTSL	18	41
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	PTPRA	42	32
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	ACE2	48	33
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	TTR	0	42
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	NCE103	32	44
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	P96878_MYCTU	18	44
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450713145	GF	On-Demand	Anodyne	CAN2	0	44
CCOC(=O)c1cc(C(=O)Nc2nc3c(OC)cccc3n2C)[nH]c1C	ZINC000450713186	FF	On-Demand	Anodyne	ENPP1	40	31
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450713203	GD	On-Demand	Anodyne	CASR	40	34
CCOC(=O)C1(CNC(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450713211	DE	On-Demand	Anodyne	TIMP3	65	35
CCOC(=O)C1(CNC(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450713211	DE	On-Demand	Anodyne	CAPN2	58	32
CCOC(=O)C1(CNC(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450713212	DE	On-Demand	Anodyne	TIMP3	65	35
CCOC(=O)C1(CNC(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450713212	DE	On-Demand	Anodyne	CAPN2	58	32
Cc1ccc2oc(N3CC[C@@H](C(F)(F)F)C[C@H]3C)nc2c1	ZINC000450713232	CI	On-Demand	Anodyne	HTR3A	0	55
Cc1ccc2oc(N3CC[C@H](C(F)(F)F)C[C@H]3C)nc2c1	ZINC000450713233	CI	On-Demand	Anodyne	HTR3A	0	55
Cc1ccc2oc(N3CC[C@H](C(F)(F)F)C[C@@H]3C)nc2c1	ZINC000450713234	CI	On-Demand	Anodyne	HTR3A	0	55
Cc1ccc2oc(N3CC[C@@H](C(F)(F)F)C[C@@H]3C)nc2c1	ZINC000450713235	CI	On-Demand	Anodyne	HTR3A	0	55
O=C(c1cccnc1N1CC[C@@](O)(C(F)F)C1)N1CCc2ccccc21	ZINC000450713247	FE	On-Demand	Anodyne	AVPR2	43	39
O=C(c1cccnc1N1CC[C@](O)(C(F)F)C1)N1CCc2ccccc21	ZINC000450713248	FE	On-Demand	Anodyne	AVPR2	43	39
Cc1ccc(Br)cc1CC(=O)NCCc1nn(C)c2ccccc12	ZINC000450713300	GH	On-Demand	Anodyne	IMDH_CRYPV	26	43
C[C@H](OCCc1ccccc1)C(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450713312	FG	On-Demand	Anodyne	ANPEP	15	41
C[C@@H](OCCc1ccccc1)C(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450713313	FG	On-Demand	Anodyne	ANPEP	15	41
Cc1cccc([C@H]2CCN(CC3CC(F)(F)C3)C2)c1	ZINC000450713314	CH	On-Demand	Anodyne	VACHT_TETCF	0	42
Cc1cccc([C@@H]2CCN(CC3CC(F)(F)C3)C2)c1	ZINC000450713315	CH	On-Demand	Anodyne	VACHT_TETCF	0	42
CC(=O)CCCCCSc1nnc(-c2cccc(C)c2)n1Cc1ccco1	ZINC000450713351	GK	On-Demand	Anodyne	HCRTR2	23	47
Cn1nc(C(=O)NCc2nc3cccc(Cl)c3n2C)c2c1CCCC2	ZINC000450713352	FF	On-Demand	Anodyne	CNR1	40	30
CCC(=O)C1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC1	ZINC000450713357	GG	On-Demand	Anodyne	EPHX2	39	41
CCC(=O)C1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC1	ZINC000450713357	GG	On-Demand	Anodyne	RBP4	71	42
CCC(=O)C1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC1	ZINC000450713357	GG	On-Demand	Anodyne	SCD1	24	44
CCC(=O)C1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC1	ZINC000450713357	GG	On-Demand	Anodyne	SFRP1	107	40
CCC(=O)C1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC1	ZINC000450713357	GG	On-Demand	Anodyne	SCD	27	41
CCC(=O)C1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC1	ZINC000450713357	GG	On-Demand	Anodyne	WNT3	73	34
Cc1csc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)c1	ZINC000450713382	EE	On-Demand	Anodyne	NPY1R	41	35
Cc1csc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)c1	ZINC000450713382	EE	On-Demand	Anodyne	NPY2R	52	39
Cc1cc(C)c(C(=O)NCCc2nn(C)c3ccccc23)cc1Br	ZINC000450713384	GH	On-Demand	Anodyne	IMDH_CRYPV	15	41
COc1cccc(C2=CCN(C(=O)[C@]3(C)CCC[C@H]3C)C2)c1	ZINC000450713386	CH	On-Demand	Anodyne	ADAM10	17	42
COc1cccc(C2=CCN(C(=O)[C@]3(C)CCC[C@@H]3C)C2)c1	ZINC000450713387	CH	On-Demand	Anodyne	ADAM10	17	42
COc1cccc(C2=CCN(C(=O)[C@@]3(C)CCC[C@H]3C)C2)c1	ZINC000450713388	CH	On-Demand	Anodyne	ADAM10	17	42
COc1cccc(C2=CCN(C(=O)[C@@]3(C)CCC[C@@H]3C)C2)c1	ZINC000450713389	CH	On-Demand	Anodyne	ADAM10	17	42
CN(C)CCN(C(=O)c1cccc2c1CCCC2)C1CC1	ZINC000450713413	CF	On-Demand	Anodyne	HTR1A	0	42
CN(C)CCN(C(=O)c1cccc2c1CCCC2)C1CC1	ZINC000450713413	CF	On-Demand	Anodyne	ACE	41	39
O=[N+]([O-])c1cnc(NC[C@H]2CCOC3(CCC3)C2)c(Cl)c1	ZINC000450713414	DG	On-Demand	Bother	PRKCQ	42	36
O=[N+]([O-])c1cnc(NC[C@@H]2CCOC3(CCC3)C2)c(Cl)c1	ZINC000450713417	DG	On-Demand	Bother	PRKCQ	42	36
CCCOc1ccc(C(=O)N2CCC(n3cncc3C)CC2)c(OC)c1	ZINC000450713431	FG	On-Demand	Anodyne	OXTR	39	41
CC(C)N1CCCC[C@H]1CN1CCC(CCCn2ccnc2)CC1	ZINC000450713432	EH	On-Demand	Anodyne	CAMC	0	40
CC(C)N1CCCC[C@@H]1CN1CCC(CCCn2ccnc2)CC1	ZINC000450713433	EH	On-Demand	Anodyne	CAMC	0	40
CC[C@@](C)(CNc1ncc(C(=O)N2CCOCC2)cc1Cl)OC	ZINC000450713434	EE	On-Demand	Anodyne	LRRK2	28	41
CC[C@](C)(CNc1ncc(C(=O)N2CCOCC2)cc1Cl)OC	ZINC000450713435	EE	On-Demand	Anodyne	LRRK2	28	41
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450713439	FE	On-Demand	Anodyne	SFRP1	66	39
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450713439	FE	On-Demand	Anodyne	WNT3	69	39
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450713440	FE	On-Demand	Anodyne	SFRP1	66	39
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450713440	FE	On-Demand	Anodyne	WNT3	69	39
CC[C@@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450713441	FE	On-Demand	Bother	BCL2L1	19	40
CC[C@@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450713441	FE	On-Demand	Bother	TAAR1	19	40
CC[C@@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450713441	FE	On-Demand	Bother	LRRK2	27	40
CC[C@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450713442	FE	On-Demand	Bother	BCL2L1	19	40
CC[C@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450713442	FE	On-Demand	Bother	TAAR1	19	40
CC[C@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])OC	ZINC000450713442	FE	On-Demand	Bother	LRRK2	27	40
CCOC(=O)C[C@@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450713443	CF	On-Demand	Anodyne	PFDN6	0	40
CCOC(=O)C[C@@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450713443	CF	On-Demand	Anodyne	CTSB	31	40
CCOC(=O)C[C@@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450713443	CF	On-Demand	Anodyne	CYSP_TRYCR	25	40
CCOC(=O)C[C@@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450713443	CF	On-Demand	Anodyne	CAPNS1	46	35
CCOC(=O)C[C@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450713444	CF	On-Demand	Anodyne	PFDN6	0	40
CCOC(=O)C[C@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450713444	CF	On-Demand	Anodyne	CTSB	31	40
CCOC(=O)C[C@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450713444	CF	On-Demand	Anodyne	CYSP_TRYCR	25	40
CCOC(=O)C[C@H](C)N(C)C[C@@H](Cc1ccccc1)OC	ZINC000450713444	CF	On-Demand	Anodyne	CAPNS1	46	35
CCOC(=O)C[C@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450713445	CF	On-Demand	Anodyne	PFDN6	0	40
CCOC(=O)C[C@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450713445	CF	On-Demand	Anodyne	CTSB	31	40
CCOC(=O)C[C@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450713445	CF	On-Demand	Anodyne	CYSP_TRYCR	25	40
CCOC(=O)C[C@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450713445	CF	On-Demand	Anodyne	CAPNS1	46	35
CCOC(=O)C[C@@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450713446	CF	On-Demand	Anodyne	PFDN6	0	40
CCOC(=O)C[C@@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450713446	CF	On-Demand	Anodyne	CTSB	31	40
CCOC(=O)C[C@@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450713446	CF	On-Demand	Anodyne	CYSP_TRYCR	25	40
CCOC(=O)C[C@@H](C)N(C)C[C@H](Cc1ccccc1)OC	ZINC000450713446	CF	On-Demand	Anodyne	CAPNS1	46	35
C[C@@H]1C[C@]1(C#N)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450713465	DH	On-Demand	Mild	ATF1	55	38
C[C@@H]1C[C@]1(C#N)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450713465	DH	On-Demand	Mild	NFKB1	51	38
C[C@H]1C[C@]1(C#N)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450713466	DH	On-Demand	Mild	ATF1	55	38
C[C@H]1C[C@]1(C#N)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450713466	DH	On-Demand	Mild	NFKB1	51	38
C[C@@H]1C[C@@]1(C#N)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450713467	DH	On-Demand	Mild	ATF1	55	38
C[C@@H]1C[C@@]1(C#N)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450713467	DH	On-Demand	Mild	NFKB1	51	38
C[C@H]1C[C@@]1(C#N)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450713468	DH	On-Demand	Mild	ATF1	55	38
C[C@H]1C[C@@]1(C#N)C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450713468	DH	On-Demand	Mild	NFKB1	51	38
C[C@H](Sc1ccc2c(c1)CCC2)C(=O)Nc1nccs1	ZINC000450713471	DH	On-Demand	Anodyne	MAP1	113	37
C[C@@H](Sc1ccc2c(c1)CCC2)C(=O)Nc1nccs1	ZINC000450713472	DH	On-Demand	Anodyne	MAP1	113	37
CC(C)(C)c1cc(CSc2nnc(-c3cccc(Br)c3)o2)no1	ZINC000450713479	GK	On-Demand	Anodyne	GSK3B	17	40
CC(C)(C)c1cc(CSc2nnc(-c3cccc(Br)c3)o2)no1	ZINC000450713479	GK	On-Demand	Anodyne	GSK3A	50	40
CC(C)(C)c1cc(CSc2nnc(-c3cccc(Br)c3)o2)no1	ZINC000450713479	GK	On-Demand	Anodyne	MVFR	0	42
Cc1csc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)c1	ZINC000450713482	FH	On-Demand	Anodyne	RBP4	46	33
Cc1csc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)c1	ZINC000450713483	FH	On-Demand	Anodyne	RBP4	46	33
CCOC(=O)c1cc(C(=O)N2CCN(C(=O)NC(C)(C)C)CC2)on1	ZINC000450713498	FD	On-Demand	Anodyne	P2RY12	44	38
C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450713499	GD	On-Demand	Anodyne	CASR	40	34
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450713518	FD	On-Demand	Anodyne	MC4R	31	42
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450713519	FD	On-Demand	Anodyne	MC4R	31	42
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450713520	FD	On-Demand	Anodyne	MC4R	31	42
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450713521	FD	On-Demand	Anodyne	MC4R	31	42
Cc1csc(NC2CCN(C(=O)c3ccsc3Br)CC2)n1	ZINC000450713534	GH	On-Demand	Anodyne	TRPC6	52	39
Cc1csc(NC2CCN(C(=O)c3ccsc3Br)CC2)n1	ZINC000450713534	GH	On-Demand	Anodyne	TRPC3	44	39
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCCC2(CC2)C1	ZINC000450713546	FI	On-Demand	Anodyne	HRH4	24	49
Cc1ccc(Br)cc1CN[C@@H](CO)c1ccc(F)cc1	ZINC000450713551	EH	On-Demand	Anodyne	LEF	44	36
Cc1ccc(Br)cc1CN[C@H](CO)c1ccc(F)cc1	ZINC000450713552	EH	On-Demand	Anodyne	LEF	44	36
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450713562	GE	On-Demand	Anodyne	BIRC2	44	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450713563	GE	On-Demand	Anodyne	BIRC2	44	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450713564	GE	On-Demand	Anodyne	BIRC2	44	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450713565	GE	On-Demand	Anodyne	BIRC2	44	44
CCOC(=O)COCCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450713595	EC	On-Demand	Bother	CA2	41	39
CCN1CCN(c2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450713608	FG	On-Demand	Anodyne	HTR1A	22	42
CCN1CCN(c2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450713608	FG	On-Demand	Anodyne	PRNP	37	45
CCN1CCN(c2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)CC1	ZINC000450713624	EG	On-Demand	Anodyne	HTR1A	25	44
CCN1CCN(c2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)CC1	ZINC000450713624	EG	On-Demand	Anodyne	NPY2R	33	41
CCN1CCN(c2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)CC1	ZINC000450713624	EG	On-Demand	Anodyne	PRNP	30	42
O=C(NCC1(CO)CCCC1)c1cn(CCc2ccccc2)nn1	ZINC000450713626	ED	On-Demand	Anodyne	HCN1	51	31
O=C(NCC1(CO)CCCC1)c1cn(CCc2ccccc2)nn1	ZINC000450713626	ED	On-Demand	Anodyne	HCN4	48	31
C/C=C\C[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450713627	EG	On-Demand	Anodyne	RBP4	53	36
C/C=C/C[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450713628	EG	On-Demand	Anodyne	RBP4	53	36
CCOC(=O)C1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CC1	ZINC000450713630	FD	On-Demand	Anodyne	PDE8B	49	35
CCOC(=O)C1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CC1	ZINC000450713631	FD	On-Demand	Anodyne	PDE8B	49	35
COc1cccc(OCCC(=O)N2CC(n3ccnn3)C2)c1	ZINC000450713632	DD	On-Demand	Anodyne	MTNR1A	15	40
CCOC(=O)C1(CNC(=O)c2ccsc2C)CC1	ZINC000450713633	CE	On-Demand	Anodyne	HCN1	54	34
CCOC(=O)C1(CNC(=O)c2ccsc2C)CC1	ZINC000450713633	CE	On-Demand	Anodyne	HCN4	52	34
O=C(Cc1ccccc1O[C@H]1CCOC1)NCC1(CO)CCCC1	ZINC000450713636	EE	On-Demand	Anodyne	HCN4	40	31
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCC1(CO)CCCC1	ZINC000450713637	EE	On-Demand	Anodyne	HCN4	40	31
CCN1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450713648	GG	On-Demand	Anodyne	HTR1A	21	40
CCN1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450713648	GG	On-Demand	Anodyne	DRD4	41	33
CCN1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450713648	GG	On-Demand	Anodyne	PRNP	66	47
CCN1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450713648	GG	On-Demand	Anodyne	TAAR1	42	41
CCN1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450713648	GG	On-Demand	Anodyne	DDR1	41	32
CCN1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450713648	GG	On-Demand	Anodyne	KCNK3	80	45
CCN1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450713648	GG	On-Demand	Anodyne	KCNK9	52	33
CCn1nnc(C)c1COc1cc(C(F)(F)F)ccc1Cl	ZINC000450713650	DH	On-Demand	Anodyne	GABRB3	0	44
C[C@@H]1C[C@H](C(F)(F)F)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450713654	FH	On-Demand	Anodyne	SCD1	39	48
C[C@@H]1C[C@@H](C(F)(F)F)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450713656	FH	On-Demand	Anodyne	SCD1	39	48
C[C@H]1C[C@H](C(F)(F)F)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450713657	FH	On-Demand	Anodyne	SCD1	39	48
C[C@H]1C[C@@H](C(F)(F)F)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450713658	FH	On-Demand	Anodyne	SCD1	39	48
CC[C@@H]1C[C@H]1C(=O)Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1	ZINC000450713663	DF	On-Demand	Anodyne	GSK3A	18	42
Cc1nc(N2CC[C@](O)(C(F)F)C2)c2cc[nH]c2n1	ZINC000450713684	CD	On-Demand	Anodyne	AKT2	40	38
Cc1nc(N2CC[C@](O)(C(F)F)C2)c2cc[nH]c2n1	ZINC000450713684	CD	On-Demand	Anodyne	ROCK2	38	40
Cc1nc(N2CC[C@](O)(C(F)F)C2)c2cc[nH]c2n1	ZINC000450713684	CD	On-Demand	Anodyne	AKT1	31	40
Cc1nc(N2CC[C@@](O)(C(F)F)C2)c2cc[nH]c2n1	ZINC000450713685	CD	On-Demand	Anodyne	AKT2	40	38
Cc1nc(N2CC[C@@](O)(C(F)F)C2)c2cc[nH]c2n1	ZINC000450713685	CD	On-Demand	Anodyne	ROCK2	38	40
Cc1nc(N2CC[C@@](O)(C(F)F)C2)c2cc[nH]c2n1	ZINC000450713685	CD	On-Demand	Anodyne	AKT1	21	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@](O)(C(F)F)C3)nc2)cc1	ZINC000450713687	EF	On-Demand	Anodyne	HDAC1	28	43
Cc1ccc(NC(=O)c2ccc(N3CC[C@](O)(C(F)F)C3)nc2)cc1	ZINC000450713687	EF	On-Demand	Anodyne	P4HTM	0	49
Cc1ccc(NC(=O)c2ccc(N3CC[C@@](O)(C(F)F)C3)nc2)cc1	ZINC000450713688	EF	On-Demand	Anodyne	HDAC1	28	43
Cc1ccc(NC(=O)c2ccc(N3CC[C@@](O)(C(F)F)C3)nc2)cc1	ZINC000450713688	EF	On-Demand	Anodyne	P4HTM	0	49
COC(=O)CNC(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450713697	FC	On-Demand	Bother	TAAR1	21	40
COC(=O)CNC(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)c([N+](=O)[O-])c1	ZINC000450713700	FC	On-Demand	Bother	TAAR1	21	40
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713713	CE	On-Demand	Anodyne	AKT2	40	42
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713713	CE	On-Demand	Anodyne	JAK1	41	34
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713713	CE	On-Demand	Anodyne	AKT1	30	41
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713715	CE	On-Demand	Anodyne	AKT2	40	42
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713715	CE	On-Demand	Anodyne	JAK1	41	34
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713715	CE	On-Demand	Anodyne	AKT1	30	41
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713716	CE	On-Demand	Anodyne	AKT2	40	42
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713716	CE	On-Demand	Anodyne	JAK1	41	34
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713716	CE	On-Demand	Anodyne	AKT1	30	41
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713717	CE	On-Demand	Anodyne	AKT2	40	42
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713717	CE	On-Demand	Anodyne	JAK1	41	34
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450713717	CE	On-Demand	Anodyne	AKT1	30	41
Cc1cc(N2CC[C@@H](C(F)(F)F)C[C@H]2C)n2ncnc2n1	ZINC000450713732	CF	On-Demand	Anodyne	DHOD	0	41
Cc1cc(N2CC[C@H](C(F)(F)F)C[C@@H]2C)n2ncnc2n1	ZINC000450713733	CF	On-Demand	Anodyne	DHOD	0	41
Cc1cc(N2CC[C@@H](C(F)(F)F)C[C@@H]2C)n2ncnc2n1	ZINC000450713734	CF	On-Demand	Anodyne	DHOD	0	41
Cc1cc(N2CC[C@H](C(F)(F)F)C[C@H]2C)n2ncnc2n1	ZINC000450713735	CF	On-Demand	Anodyne	DHOD	0	41
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713738	FE	On-Demand	Anodyne	ADRA1D	22	56
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713738	FE	On-Demand	Anodyne	ADRA1A	17	57
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713738	FE	On-Demand	Anodyne	ADRA1B	54	56
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713738	FE	On-Demand	Anodyne	PDE3A	43	32
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713738	FE	On-Demand	Anodyne	CCR4	47	39
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713738	FE	On-Demand	Anodyne	PDE3B	64	32
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713738	FE	On-Demand	Anodyne	EHMT2	70	40
Cc1ncsc1CCN=c1ccc(C(=O)N2CCC(C)CC2)c[nH]1	ZINC000450713739	EF	On-Demand	Anodyne	TRPC6	40	35
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713740	FE	On-Demand	Anodyne	ADRA1D	22	56
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713740	FE	On-Demand	Anodyne	ADRA1A	17	57
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713740	FE	On-Demand	Anodyne	ADRA1B	54	56
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713740	FE	On-Demand	Anodyne	PDE3A	43	32
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713740	FE	On-Demand	Anodyne	CCR4	47	39
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713740	FE	On-Demand	Anodyne	PDE3B	64	32
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc(N)c2cc1OC	ZINC000450713740	FE	On-Demand	Anodyne	EHMT2	70	40
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713741	FE	On-Demand	Anodyne	ADRA1D	22	56
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713741	FE	On-Demand	Anodyne	ADRA1A	17	57
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713741	FE	On-Demand	Anodyne	ADRA1B	54	56
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713741	FE	On-Demand	Anodyne	PDE3A	43	32
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713741	FE	On-Demand	Anodyne	CCR4	47	39
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713741	FE	On-Demand	Anodyne	PDE3B	64	32
COc1cc2nc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713741	FE	On-Demand	Anodyne	EHMT2	70	40
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713742	FE	On-Demand	Anodyne	ADRA1D	22	56
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713742	FE	On-Demand	Anodyne	ADRA1A	17	57
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713742	FE	On-Demand	Anodyne	ADRA1B	54	56
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713742	FE	On-Demand	Anodyne	PDE3A	43	32
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713742	FE	On-Demand	Anodyne	CCR4	47	39
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713742	FE	On-Demand	Anodyne	PDE3B	64	32
COc1cc2nc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc(N)c2cc1OC	ZINC000450713742	FE	On-Demand	Anodyne	EHMT2	70	40
CCN1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450713772	GG	On-Demand	Anodyne	HTR1A	24	42
CCN1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450713772	GG	On-Demand	Anodyne	DRD4	41	33
CCN1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450713772	GG	On-Demand	Anodyne	PRNP	37	44
CCN1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450713772	GG	On-Demand	Anodyne	MAPKAPK2	23	46
CCN1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450713772	GG	On-Demand	Anodyne	SCN10A	20	46
C/C=C\C[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450713774	CE	On-Demand	Anodyne	CTSV	48	33
C/C=C/C[C@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450713775	CE	On-Demand	Anodyne	CTSV	48	33
C/C=C\C[C@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450713776	CE	On-Demand	Anodyne	CTSV	48	33
C/C=C/C[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450713777	CE	On-Demand	Anodyne	CTSV	48	33
COC(=O)[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)[C@@H](C(=O)OC)C1	ZINC000450713778	GG	On-Demand	Anodyne	SLC6A3	15	43
COC(=O)[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)[C@@H](C(=O)OC)C1	ZINC000450713779	GG	On-Demand	Anodyne	SLC6A3	15	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450713780	GG	On-Demand	Anodyne	SLC6A3	15	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450713781	GG	On-Demand	Anodyne	SLC6A3	15	43
COC(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450713787	EF	On-Demand	Anodyne	SLC6A1	29	41
COC(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450713789	EF	On-Demand	Anodyne	SLC6A1	29	41
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CC/C=C/c1ccccc1	ZINC000450713790	EF	On-Demand	Anodyne	SLC6A1	29	41
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CC/C=C\c1ccccc1	ZINC000450713791	EF	On-Demand	Anodyne	SLC6A1	29	41
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(F)cc1	ZINC000450713800	CF	On-Demand	Anodyne	DRD2	36	51
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(F)cc1	ZINC000450713800	CF	On-Demand	Anodyne	DRD1	0	51
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(F)cc1	ZINC000450713800	CF	On-Demand	Anodyne	DRD4	22	54
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(F)cc1	ZINC000450713800	CF	On-Demand	Anodyne	ERG2	24	51
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(F)cc1	ZINC000450713800	CF	On-Demand	Anodyne	SLC18A3	0	52
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(F)cc1	ZINC000450713800	CF	On-Demand	Anodyne	CYP2J2	51	36
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000450713818	FE	On-Demand	Anodyne	PREP	30	40
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000450713822	FE	On-Demand	Anodyne	PREP	30	40
COC(=O)c1cccc(CN[C@H](c2cccnc2)C2CC2)c1Cl	ZINC000450713826	EH	On-Demand	Anodyne	KCNA5	43	38
COC(=O)c1cccc(CN[C@@H](c2cccnc2)C2CC2)c1Cl	ZINC000450713833	EH	On-Demand	Anodyne	KCNA5	43	38
Cc1ccc([N+](=O)[O-])c(OCCC(C)(F)F)c1	ZINC000450713860	BG	On-Demand	Bother	S1PR4	0	52
Cc1ccn2ncc(C(=O)N(CCN(C)C)C3CC3)c2c1	ZINC000450713877	CD	On-Demand	Anodyne	EPHB3	25	43
COC(=O)C1(CN[C@H](c2ccc(OC(F)(F)F)cc2)C(F)(F)F)CC1	ZINC000450713914	FH	On-Demand	Anodyne	EPHX2	44	40
COC(=O)C1(CN[C@@H](c2ccc(OC(F)(F)F)cc2)C(F)(F)F)CC1	ZINC000450713915	FH	On-Demand	Anodyne	EPHX2	44	40
COCc1cc([N+](=O)[O-])ccc1NCc1ncc(C(F)(F)F)cn1	ZINC000450713926	EG	On-Demand	Bother	MET	16	40
N#CC[C@@H](O)CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450713927	CF	On-Demand	Mild	GSK3B	0	46
N#CC[C@@H](O)CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450713927	CF	On-Demand	Mild	GSK3A	39	40
N#CC[C@@H](O)CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450713927	CF	On-Demand	Mild	TERT	24	45
C=C(C)CCNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450713937	CE	On-Demand	Mild	PRCP	15	42
C=C(C)CCNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450713939	CE	On-Demand	Mild	PRCP	15	42
Clc1cccc(-c2nnc(SCC[C@@H]3CCOC3)o2)c1	ZINC000450713959	DH	On-Demand	Anodyne	GSK3B	0	47
Clc1cccc(-c2nnc(SCC[C@@H]3CCOC3)o2)c1	ZINC000450713959	DH	On-Demand	Anodyne	GSK3A	42	39
Clc1cccc(-c2nnc(SCC[C@@H]3CCOC3)o2)c1	ZINC000450713959	DH	On-Demand	Anodyne	TERT	25	49
Clc1cccc(-c2nnc(SCC[C@H]3CCOC3)o2)c1	ZINC000450713961	DH	On-Demand	Anodyne	GSK3B	0	47
Clc1cccc(-c2nnc(SCC[C@H]3CCOC3)o2)c1	ZINC000450713961	DH	On-Demand	Anodyne	GSK3A	42	39
Clc1cccc(-c2nnc(SCC[C@H]3CCOC3)o2)c1	ZINC000450713961	DH	On-Demand	Anodyne	TERT	25	49
CCOC(=O)c1ccc(CSc2nnc(-c3ccccc3OCC)o2)nc1	ZINC000450713963	GH	On-Demand	Anodyne	ALOX15	70	42
CN(CCCC(=O)c1ccccc1)CCc1ccccc1O	ZINC000450713983	CH	On-Demand	Anodyne	THRA	22	49
COCCOC[C@H](O)CN1[C@H](C)Cc2cc(OC)ccc2[C@H]1C	ZINC000450713986	DE	On-Demand	Anodyne	HSP90AB1	34	41
COCCOC[C@H](O)CN1[C@@H](C)c2ccc(OC)cc2C[C@H]1C	ZINC000450713988	DE	On-Demand	Anodyne	HSP90AB1	34	41
COCCOC[C@H](O)CN1[C@@H](C)Cc2cc(OC)ccc2[C@@H]1C	ZINC000450713990	DE	On-Demand	Anodyne	HSP90AB1	34	41
C=C(C)CCNc1cc(CC)nc2ncnn12	ZINC000450713993	BE	On-Demand	Mild	DHOD	0	54
CCOC(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)nc1	ZINC000450713994	DH	On-Demand	Anodyne	P2RY12	31	42
CCOC(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)nc1	ZINC000450713994	DH	On-Demand	Anodyne	SSTR5	45	39
CCOC(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)nc1	ZINC000450713994	DH	On-Demand	Anodyne	CCR5	68	34
CCOC(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)nc1	ZINC000450713994	DH	On-Demand	Anodyne	MCHR1	20	41
CCOC(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)nc1	ZINC000450713994	DH	On-Demand	Anodyne	MGEA5	26	47
CCOC(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)nc1	ZINC000450713996	DH	On-Demand	Anodyne	P2RY12	31	42
CCOC(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)nc1	ZINC000450713996	DH	On-Demand	Anodyne	SSTR5	45	39
CCOC(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)nc1	ZINC000450713996	DH	On-Demand	Anodyne	CCR5	68	34
CCOC(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)nc1	ZINC000450713996	DH	On-Demand	Anodyne	MCHR1	20	41
CCOC(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)nc1	ZINC000450713996	DH	On-Demand	Anodyne	MGEA5	26	47
COc1cc(OC)c2ncnc(NCc3nn(C)cc3Cl)c2c1	ZINC000450713998	EE	On-Demand	Anodyne	PDE6A	49	38
CC(=O)[C@@](C)(O)CN1CCC(CCCn2ccnc2)CC1	ZINC000450714005	CD	On-Demand	Anodyne	TBXAS1	36	44
CC(=O)[C@](C)(O)CN1CCC(CCCn2ccnc2)CC1	ZINC000450714006	CD	On-Demand	Anodyne	TBXAS1	36	44
CC(C)(C)NC(=O)N1CCN(C(=O)CCc2ccc(C(N)=O)cc2)CC1	ZINC000450714015	FD	On-Demand	Anodyne	HRH3	0	45
CC(C)(C)NC(=O)N1CCN(C(=O)CCc2ccc(C(N)=O)cc2)CC1	ZINC000450714015	FD	On-Demand	Anodyne	GPBAR1	22	42
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450714016	CD	On-Demand	Mild	CA2	74	54
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450714016	CD	On-Demand	Mild	CA1	57	40
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450714016	CD	On-Demand	Mild	CA7	52	37
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450714016	CD	On-Demand	Mild	CA5B	47	37
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450714016	CD	On-Demand	Mild	CA4	64	43
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450714016	CD	On-Demand	Mild	CA5A	50	37
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450714016	CD	On-Demand	Mild	CA12	27	41
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450714016	CD	On-Demand	Mild	CA9	32	40
C=C(C)CCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450714031	CF	On-Demand	Mild	TAAR1	16	42
CCc1cc(NC[C@@](C)(CC)OC)n2ncnc2n1	ZINC000450714035	CD	On-Demand	Anodyne	DHOD	0	54
CCc1cc(NC[C@](C)(CC)OC)n2ncnc2n1	ZINC000450714036	CD	On-Demand	Anodyne	DHOD	0	54
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	ACE	61	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	P2RY12	48	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	MME	70	43
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	PAPA1_CARPA	42	38
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	CCR1	38	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	TIMP3	67	38
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	CAPNS1	60	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	REN	56	46
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	CAPN1	55	39
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	CAPN2	42	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	ACE2	89	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	PPP2CA	0	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	AMP1_PLAFQ	30	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	GAG-PRO	59	35
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	PSMB8	43	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714038	EE	On-Demand	Anodyne	BRCA1	63	36
CO[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450714040	EE	On-Demand	Anodyne	PPP2CA	0	42
CO[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H](C)NC(C)=O)CC1	ZINC000450714041	EE	On-Demand	Anodyne	PPP2CA	0	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450714042	EE	On-Demand	Anodyne	PPP2CA	0	42
O=C(CSC1CC1)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450714052	GG	On-Demand	Anodyne	LTA4H	42	42
COc1ccc(OC(F)(F)F)c(C(=O)NCCc2nn(C)c3ccccc23)c1	ZINC000450714062	GG	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(OC(F)(F)F)c(C(=O)NCCc2nn(C)c3ccccc23)c1	ZINC000450714062	GG	On-Demand	Anodyne	MTNR1B	57	38
FC(F)(F)c1cccc([C@@H]2CCN(CCc3cscn3)C2)c1	ZINC000450714063	EI	On-Demand	Anodyne	SCN5A	41	37
FC(F)(F)c1cccc([C@@H]2CCN(CCc3cscn3)C2)c1	ZINC000450714063	EI	On-Demand	Anodyne	CCR2	25	45
C=C(C)CCNc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-]	ZINC000450714065	DD	On-Demand	Mild	TAAR1	17	45
CC[C@@H](CO)N(Cc1ccccc1)C[C@@H]1CCNC(=O)CC1	ZINC000450714066	DE	On-Demand	Anodyne	GALR1	45	33
CC[C@@H](CO)N(Cc1ccccc1)C[C@H]1CCNC(=O)CC1	ZINC000450714067	DE	On-Demand	Anodyne	GALR1	45	33
FC(F)(F)c1cccc([C@H]2CCN(CCc3cscn3)C2)c1	ZINC000450714068	EI	On-Demand	Anodyne	SCN5A	41	37
FC(F)(F)c1cccc([C@H]2CCN(CCc3cscn3)C2)c1	ZINC000450714068	EI	On-Demand	Anodyne	CCR2	25	45
Cc1cncn1C1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450714069	EF	On-Demand	Anodyne	L3MBTL3	60	38
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450714072	GI	On-Demand	Anodyne	COLA	58	43
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450714072	GI	On-Demand	Anodyne	CPT1A	58	43
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450714073	GI	On-Demand	Anodyne	COLA	58	43
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccc(C(C)(F)F)nc2)no1	ZINC000450714073	GI	On-Demand	Anodyne	CPT1A	58	43
Cc1cncn1C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450714081	GH	On-Demand	Bother	LIPG	50	35
Cc1csc(CNc2ccc(S(C)(=O)=O)cc2C(F)(F)F)c1	ZINC000450714083	EI	On-Demand	Anodyne	PTGS2	22	40
CCCOc1ccc(C(=O)NCCc2nn(C)c3ccccc23)c(OC)c1	ZINC000450714084	FG	On-Demand	Anodyne	CNR2	31	42
CCCOc1ccc(C(=O)NCCc2nn(C)c3ccccc23)c(OC)c1	ZINC000450714084	FG	On-Demand	Anodyne	MTNR1A	41	39
Cc1cccc([C@@H]2CCN(CC[C@H](C)O)C2)c1	ZINC000450714090	BF	On-Demand	Anodyne	VACHT_TETCF	0	45
Cc1cccc([C@@H]2CCN(CC[C@H](C)O)C2)c1	ZINC000450714090	BF	On-Demand	Anodyne	CCR5	33	45
Cc1cccc([C@@H]2CCN(CC[C@H](C)O)C2)c1	ZINC000450714090	BF	On-Demand	Anodyne	SLC18A3	19	42
Cc1cccc([C@@H]2CCN(CC[C@H](C)O)C2)c1	ZINC000450714090	BF	On-Demand	Anodyne	MGEA5	16	44
Cc1cccc([C@H]2CCN(CC[C@@H](C)O)C2)c1	ZINC000450714091	BF	On-Demand	Anodyne	VACHT_TETCF	0	45
Cc1cccc([C@H]2CCN(CC[C@@H](C)O)C2)c1	ZINC000450714091	BF	On-Demand	Anodyne	CCR5	33	45
Cc1cccc([C@H]2CCN(CC[C@@H](C)O)C2)c1	ZINC000450714091	BF	On-Demand	Anodyne	SLC18A3	19	42
Cc1cccc([C@H]2CCN(CC[C@@H](C)O)C2)c1	ZINC000450714091	BF	On-Demand	Anodyne	MGEA5	16	44
Cc1cccc([C@@H]2CCN(CC[C@@H](C)O)C2)c1	ZINC000450714092	BF	On-Demand	Anodyne	VACHT_TETCF	0	45
Cc1cccc([C@@H]2CCN(CC[C@@H](C)O)C2)c1	ZINC000450714092	BF	On-Demand	Anodyne	CCR5	33	45
Cc1cccc([C@@H]2CCN(CC[C@@H](C)O)C2)c1	ZINC000450714092	BF	On-Demand	Anodyne	SLC18A3	19	42
Cc1cccc([C@@H]2CCN(CC[C@@H](C)O)C2)c1	ZINC000450714092	BF	On-Demand	Anodyne	MGEA5	16	44
Cc1cccc([C@H]2CCN(CC[C@H](C)O)C2)c1	ZINC000450714093	BF	On-Demand	Anodyne	VACHT_TETCF	0	45
Cc1cccc([C@H]2CCN(CC[C@H](C)O)C2)c1	ZINC000450714093	BF	On-Demand	Anodyne	CCR5	33	45
Cc1cccc([C@H]2CCN(CC[C@H](C)O)C2)c1	ZINC000450714093	BF	On-Demand	Anodyne	SLC18A3	19	42
Cc1cccc([C@H]2CCN(CC[C@H](C)O)C2)c1	ZINC000450714093	BF	On-Demand	Anodyne	MGEA5	16	44
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714112	GG	On-Demand	Anodyne	AVPR1A	16	43
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714112	GG	On-Demand	Anodyne	CCR3	0	55
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714112	GG	On-Demand	Anodyne	GRIA1	47	37
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714112	GG	On-Demand	Anodyne	ACE2	55	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714112	GG	On-Demand	Anodyne	NCE103	27	40
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714112	GG	On-Demand	Anodyne	POLG_WNV	40	30
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714112	GG	On-Demand	Anodyne	CAN2	0	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714113	GG	On-Demand	Anodyne	AVPR1A	16	43
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714113	GG	On-Demand	Anodyne	CCR3	0	55
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714113	GG	On-Demand	Anodyne	GRIA1	47	37
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714113	GG	On-Demand	Anodyne	ACE2	55	33
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714113	GG	On-Demand	Anodyne	NCE103	27	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714113	GG	On-Demand	Anodyne	POLG_WNV	40	30
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450714113	GG	On-Demand	Anodyne	CAN2	0	40
C=CC(C)(C)C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450714131	CG	On-Demand	Mild	TRPC6	45	34
COC(=O)C[C@H](NC(=O)C1CC(C)(O)C1)c1ccc2ccccc2c1	ZINC000450714143	EF	On-Demand	Anodyne	UTS2	32	40
COC(=O)C[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc2ccccc2c1	ZINC000450714144	EF	On-Demand	Anodyne	UTS2	32	40
COc1ccc(CNC(=O)CCn2nnc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450714158	GE	On-Demand	Anodyne	PDGFRB	41	39
COc1ccc(CNC(=O)CCn2nnc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450714158	GE	On-Demand	Anodyne	HTR7	20	44
COc1ccc(CNC(=O)CCn2nnc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450714158	GE	On-Demand	Anodyne	P2RX7	39	42
COc1ccc(CNC(=O)CCn2nnc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450714158	GE	On-Demand	Anodyne	MTNR1A	40	35
COc1ccc(CNC(=O)CCn2nnc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450714158	GE	On-Demand	Anodyne	MTNR1B	41	34
COc1ccc(CNC(=O)CCn2nnc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450714158	GE	On-Demand	Anodyne	SOAT1	19	40
CCCc1cc(C(=O)N[C@@H](Cc2ccccc2Cl)C(=O)OCC)no1	ZINC000450714174	FG	On-Demand	Anodyne	P2RY12	55	35
CCCc1cc(C(=O)N[C@@H](Cc2ccccc2Cl)C(=O)OCC)no1	ZINC000450714174	FG	On-Demand	Anodyne	PSMB5	22	44
CCCc1cc(C(=O)N[C@H](Cc2ccccc2Cl)C(=O)OCC)no1	ZINC000450714175	FG	On-Demand	Anodyne	P2RY12	55	35
CCCc1cc(C(=O)N[C@H](Cc2ccccc2Cl)C(=O)OCC)no1	ZINC000450714175	FG	On-Demand	Anodyne	PSMB5	22	44
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450714181	FF	On-Demand	Anodyne	P2RX3	26	40
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450714181	FF	On-Demand	Anodyne	HRH3	28	43
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450714181	FF	On-Demand	Anodyne	PLD1	41	36
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450714181	FF	On-Demand	Anodyne	PRKD1	29	45
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450714182	FF	On-Demand	Anodyne	P2RX3	26	40
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450714182	FF	On-Demand	Anodyne	HRH3	28	43
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450714182	FF	On-Demand	Anodyne	PLD1	41	36
C[C@H](CCN1CCN(C)CC1)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450714182	FF	On-Demand	Anodyne	PRKD1	29	45
O[C@@H]1CCC[C@@H]1[C@@H]1CCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450714215	GJ	On-Demand	Anodyne	ADRB3	28	45
O[C@@H]1CCC[C@H]1[C@H]1CCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450714216	GJ	On-Demand	Anodyne	ADRB3	28	45
O[C@@H]1CCC[C@@H]1[C@H]1CCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450714217	GJ	On-Demand	Anodyne	ADRB3	28	45
O[C@@H]1CCC[C@H]1[C@@H]1CCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450714218	GJ	On-Demand	Anodyne	ADRB3	28	45
COc1cc(CN2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450714233	GD	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC[C@H](S(=O)(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450714233	GD	On-Demand	Anodyne	SSTR5	48	37
COc1cc(CN2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450714234	GD	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC[C@@H](S(=O)(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450714234	GD	On-Demand	Anodyne	SSTR5	48	37
O=S(=O)(c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1)N1CCCCC1	ZINC000450714245	FD	On-Demand	Anodyne	GCK	29	44
O=S(=O)(c1ccc(N2CC[C@](O)(C(F)F)C2)nc1)N1CCCCC1	ZINC000450714246	FD	On-Demand	Anodyne	GCK	29	44
Cc1nc(-c2ccccn2)nc(N2CC[C@@](O)(C(F)F)C2)c1C	ZINC000450714261	DE	On-Demand	Anodyne	METAP1	30	40
Cc1nc(-c2ccccn2)nc(N2CC[C@](O)(C(F)F)C2)c1C	ZINC000450714263	DE	On-Demand	Anodyne	METAP1	30	40
C[C@H](c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1)C(F)(F)F	ZINC000450714267	FK	On-Demand	Anodyne	DRD4	18	42
C[C@@H](c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1)C(F)(F)F	ZINC000450714269	FK	On-Demand	Anodyne	DRD4	18	42
COc1ccc2c(c1)nc(CNC(=O)c1ccc(C(F)(F)F)cc1C)n2C	ZINC000450714270	GH	On-Demand	Anodyne	PPARG	17	43
COc1ccc2c(c1)nc(CNC(=O)c1ccc(C(F)(F)F)cc1C)n2C	ZINC000450714270	GH	On-Demand	Anodyne	GCGR	34	40
COc1ccc2c(c1)nc(CNC(=O)c1ccc(C(F)(F)F)cc1C)n2C	ZINC000450714270	GH	On-Demand	Anodyne	PPARA	24	43
COc1ccc2c(c1)nc(CNC(=O)c1ccc(C(F)(F)F)cc1C)n2C	ZINC000450714270	GH	On-Demand	Anodyne	RAF1	23	41
COc1ccc2c(c1)nc(CNC(=O)c1ccc(C(F)(F)F)cc1C)n2C	ZINC000450714270	GH	On-Demand	Anodyne	PPARD	42	43
COc1ccc2c(c1)nc(CNC(=O)c1ccc(C(F)(F)F)cc1C)n2C	ZINC000450714270	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	29	41
COc1ccc2c(c1)nc(CNC(=O)c1ccc(C(F)(F)F)cc1C)n2C	ZINC000450714270	GH	On-Demand	Anodyne	BRAF	15	41
COc1ccc2c(c1)nc(CNC(=O)c1ccc(C(F)(F)F)cc1C)n2C	ZINC000450714270	GH	On-Demand	Anodyne	AKR1C3	19	41
CC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450714279	EG	On-Demand	Anodyne	ACHE	46	48
CC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450714279	EG	On-Demand	Anodyne	HTR4	43	32
CC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450714279	EG	On-Demand	Anodyne	CNR2	0	40
CC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450714279	EG	On-Demand	Anodyne	CASR	31	41
CC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450714279	EG	On-Demand	Anodyne	SIGMAR1	45	39
CC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450714279	EG	On-Demand	Anodyne	CCR3	54	44
CC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450714279	EG	On-Demand	Anodyne	MCHR1	38	40
CC(=O)c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450714279	EG	On-Demand	Anodyne	CYP2J2	49	35
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CO)CCCC1	ZINC000450714280	DE	On-Demand	Anodyne	CTSV	44	31
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CO)CCCC1	ZINC000450714280	DE	On-Demand	Anodyne	HCN1	50	30
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CO)CCCC1	ZINC000450714280	DE	On-Demand	Anodyne	HCN4	47	30
CC[C@@](C)(CNc1ncnc2c(OC)cc(OC)cc12)OC	ZINC000450714327	DE	On-Demand	Anodyne	PDE6A	42	32
CO[C@@H]1CCC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450714332	FF	On-Demand	Anodyne	GSK3A	25	45
CO[C@H]1CCC[C@@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450714335	FF	On-Demand	Anodyne	GSK3A	25	45
CC[C@](C)(CNc1ncnc2c(OC)cc(OC)cc12)OC	ZINC000450714337	DE	On-Demand	Anodyne	PDE6A	42	32
CO[C@H]1CCC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450714338	FF	On-Demand	Anodyne	GSK3A	25	45
CO[C@@H]1CCC[C@H](C(=O)Nc2n[nH]c(-c3ccc(O)c(Cl)c3)n2)C1	ZINC000450714339	FF	On-Demand	Anodyne	GSK3A	25	45
CC(C)(C)c1cc(CSc2nnc(-c3cccc(Cl)c3)o2)no1	ZINC000450714347	EJ	On-Demand	Anodyne	GSK3B	18	49
CC(C)(C)c1cc(CSc2nnc(-c3cccc(Cl)c3)o2)no1	ZINC000450714347	EJ	On-Demand	Anodyne	GSK3A	50	40
CC(C)(C)c1cc(CSc2nnc(-c3cccc(Cl)c3)o2)no1	ZINC000450714347	EJ	On-Demand	Anodyne	TERT	27	50
COc1ccc2c(c1)nc(CNC(=O)Cc1cc(F)c(C)cc1F)n2C	ZINC000450714353	FG	On-Demand	Anodyne	PTGS2	37	40
COc1ccc2c(c1)nc(CNC(=O)Cc1cc(F)c(C)cc1F)n2C	ZINC000450714353	FG	On-Demand	Anodyne	MTNR1A	46	38
CC(C)c1nnc(CSc2nnc(-c3cccc(Cl)c3)o2)s1	ZINC000450714355	FJ	On-Demand	Anodyne	GSK3B	17	50
CC(C)c1nnc(CSc2nnc(-c3cccc(Cl)c3)o2)s1	ZINC000450714355	FJ	On-Demand	Anodyne	GSK3A	49	39
COc1cc(CC(=O)N2CCn3ncnc3C2)ccc1Cl	ZINC000450714359	DD	On-Demand	Anodyne	CCR1	34	43
COc1cc(CC(=O)N2CCn3ncnc3C2)ccc1Cl	ZINC000450714359	DD	On-Demand	Anodyne	PDE6A	42	32
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)CC1	ZINC000450714378	FG	On-Demand	Anodyne	RBP4	52	32
C=C(C)CCNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450714388	CD	On-Demand	Mild	BDKRB1	27	45
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450714396	GG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCC[C@H](O)CN1CCC(c2ccc(C)nc2)CC1	ZINC000450714422	CF	On-Demand	Anodyne	VACHT_TETCF	0	40
CCC[C@H](O)CN1CCC(c2ccc(C)nc2)CC1	ZINC000450714422	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
CCC[C@@H](O)CN1CCC(c2ccc(C)nc2)CC1	ZINC000450714424	CF	On-Demand	Anodyne	VACHT_TETCF	0	40
CCC[C@@H](O)CN1CCC(c2ccc(C)nc2)CC1	ZINC000450714424	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
CCC[C@H](OC)C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450714429	EG	On-Demand	Anodyne	UTS2	43	51
CCC[C@@H](OC)C(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450714434	EG	On-Demand	Anodyne	UTS2	43	51
C=C(C)CCNc1cc(CCC)nc2ncnn12	ZINC000450714435	BE	On-Demand	Mild	DHOD	0	50
CCC[C@H](OC)C(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450714437	EG	On-Demand	Anodyne	UTS2	43	51
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450714438	DF	On-Demand	Mild	CA2	61	43
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450714438	DF	On-Demand	Mild	CA1	51	38
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450714438	DF	On-Demand	Mild	CA4	48	41
CCC[C@@H](OC)C(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450714439	EG	On-Demand	Anodyne	UTS2	43	51
C[C@@H]1Cc2cccc(C(=O)NCC3(CO)CCCC3)c2O1	ZINC000450714441	CE	On-Demand	Anodyne	HCN1	65	37
C[C@@H]1Cc2cccc(C(=O)NCC3(CO)CCCC3)c2O1	ZINC000450714441	CE	On-Demand	Anodyne	HCN4	54	35
C[C@H]1Cc2cccc(C(=O)NCC3(CO)CCCC3)c2O1	ZINC000450714443	CE	On-Demand	Anodyne	HCN1	65	37
C[C@H]1Cc2cccc(C(=O)NCC3(CO)CCCC3)c2O1	ZINC000450714443	CE	On-Demand	Anodyne	HCN4	54	35
COC(=O)c1ccc(CN2C[C@@H]3CC[C@@H](O)[C@H]3C2)cc1Cl	ZINC000450714462	DE	On-Demand	Anodyne	MCHR1	15	40
COC(=O)c1ccc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1Cl	ZINC000450714463	DE	On-Demand	Anodyne	MCHR1	15	40
COC(=O)c1ccc(CN2C[C@H]3[C@H](O)CC[C@H]3C2)cc1Cl	ZINC000450714464	DE	On-Demand	Anodyne	MCHR1	15	40
COC(=O)c1ccc(CN2C[C@@H]3CC[C@H](O)[C@H]3C2)cc1Cl	ZINC000450714465	DE	On-Demand	Anodyne	MCHR1	15	40
O=C(NCC1(CO)CCCC1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450714466	FG	On-Demand	Anodyne	PYGL	59	37
Cc1ccc(C(=O)NCC2(CO)CCCC2)c2c1CCC2	ZINC000450714468	CF	On-Demand	Anodyne	HCN4	49	33
CCC(CC)Oc1ccc(C(=O)N(CCN(C)C)C2CC2)cc1	ZINC000450714479	DG	On-Demand	Anodyne	MBTPS1	69	36
CCOCc1nc(C)c(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)s1	ZINC000450714480	GJ	On-Demand	Anodyne	JUN	27	45
CCOCc1nc(C)c(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)s1	ZINC000450714480	GJ	On-Demand	Anodyne	ATF1	65	46
CCOCc1nc(C)c(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)s1	ZINC000450714480	GJ	On-Demand	Anodyne	NFKB1	60	46
CO[C@@H](Cc1ccccc1)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450714481	EE	On-Demand	Anodyne	GHRL	51	33
CO[C@H](Cc1ccccc1)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450714482	EE	On-Demand	Anodyne	GHRL	51	33
CO[C@@H](Cc1ccccc1)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450714483	EE	On-Demand	Anodyne	GHRL	51	33
CO[C@H](Cc1ccccc1)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450714484	EE	On-Demand	Anodyne	GHRL	51	33
CCC(=O)C1(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)CC1	ZINC000450714489	FF	On-Demand	Anodyne	RBP4	50	33
CCC(=O)C1(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)CC1	ZINC000450714490	FF	On-Demand	Anodyne	RBP4	50	33
Cn1c(CNC(=O)C2CC(C)(O)C2)nc2cccc(Cl)c21	ZINC000450714501	DE	On-Demand	Anodyne	P2RX7	40	36
Cn1cc(Cl)c(CNc2ccc(S(N)(=O)=O)cc2C(F)(F)F)n1	ZINC000450714504	FE	On-Demand	Anodyne	CA2	28	41
Cn1cc(Cl)c(CNc2ccc(S(N)(=O)=O)cc2C(F)(F)F)n1	ZINC000450714504	FE	On-Demand	Anodyne	PTGS2	25	40
Cn1cc(Cl)c(CNc2ccc(S(N)(=O)=O)cc2C(F)(F)F)n1	ZINC000450714504	FE	On-Demand	Anodyne	CA4	24	41
COC[C@H](CNc1ncccc1C(=O)N1CCCCC1)c1ccc(Cl)cc1	ZINC000450714507	GI	On-Demand	Anodyne	FAAH	29	42
COC[C@@H](CNc1ncccc1C(=O)N1CCCCC1)c1ccc(Cl)cc1	ZINC000450714508	GI	On-Demand	Anodyne	FAAH	29	42
COc1cc(CC(=O)NCCc2nn(C)c3ccccc23)ccc1Cl	ZINC000450714509	FG	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)NCCc2nn(C)c3ccccc23)ccc1Cl	ZINC000450714509	FG	On-Demand	Anodyne	P2RX7	28	41
COc1cc(CC(=O)NCCc2nn(C)c3ccccc23)ccc1Cl	ZINC000450714509	FG	On-Demand	Anodyne	NCE103	25	48
COc1cc(CC(=O)NCCc2nn(C)c3ccccc23)ccc1Cl	ZINC000450714509	FG	On-Demand	Anodyne	P96878_MYCTU	20	48
COc1cc(CC(=O)NCCc2nn(C)c3ccccc23)ccc1Cl	ZINC000450714509	FG	On-Demand	Anodyne	IMDH_CRYPV	30	52
COc1cc(CC(=O)NCCc2nn(C)c3ccccc23)ccc1Cl	ZINC000450714509	FG	On-Demand	Anodyne	CAN2	0	48
COC[C@@H](CNc1ncnc2c1cnn2C)c1ccc(Cl)cc1	ZINC000450714522	EF	On-Demand	Anodyne	ABL1	51	46
COC[C@@H](CNc1ncnc2c1cnn2C)c1ccc(Cl)cc1	ZINC000450714522	EF	On-Demand	Anodyne	SRC	24	45
COC[C@H](CNc1ncnc2c1cnn2C)c1ccc(Cl)cc1	ZINC000450714523	EF	On-Demand	Anodyne	ABL1	51	46
COC[C@H](CNc1ncnc2c1cnn2C)c1ccc(Cl)cc1	ZINC000450714523	EF	On-Demand	Anodyne	SRC	24	45
CCSc1cccnc1C(=O)NCC1(OC)CCCCC1	ZINC000450714524	DG	On-Demand	Anodyne	HCN1	54	34
CCSc1cccnc1C(=O)NCC1(OC)CCCCC1	ZINC000450714524	DG	On-Demand	Anodyne	HCN4	52	34
CCOC(=O)c1cc(C(=O)Nc2ccc3c(c2)CN(C)C(=O)N3)on1	ZINC000450714542	EE	On-Demand	Anodyne	BRD4	15	43
COCCOC[C@H](O)CN1[C@@H](C)Cc2cc(OC)ccc2[C@H]1C	ZINC000450714560	DE	On-Demand	Anodyne	HSP90AB1	34	41
CO[C@@H](CN[C@@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714564	DF	On-Demand	Anodyne	MAN2A1	0	41
CO[C@@H](CN[C@@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714564	DF	On-Demand	Anodyne	MAN1B1	39	41
CO[C@@H](CN[C@@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714564	DF	On-Demand	Anodyne	MAN1	0	41
CO[C@@H](CN[C@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714566	DF	On-Demand	Anodyne	MAN2A1	0	41
CO[C@@H](CN[C@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714566	DF	On-Demand	Anodyne	MAN1B1	39	41
CO[C@@H](CN[C@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714566	DF	On-Demand	Anodyne	MAN1	0	41
Cc1nc(C)n(CCCC(=O)NCc2nc3cccc(Cl)c3n2C)n1	ZINC000450714567	FF	On-Demand	Anodyne	HTR7	22	41
CO[C@H](CN[C@@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714568	DF	On-Demand	Anodyne	MAN2A1	0	41
CO[C@H](CN[C@@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714568	DF	On-Demand	Anodyne	MAN1B1	39	41
CO[C@H](CN[C@@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714568	DF	On-Demand	Anodyne	MAN1	0	41
CO[C@H](CN[C@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714569	DF	On-Demand	Anodyne	MAN2A1	0	41
CO[C@H](CN[C@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714569	DF	On-Demand	Anodyne	MAN1B1	39	41
CO[C@H](CN[C@H](CO)c1cccc(F)c1)Cc1ccccc1	ZINC000450714569	DF	On-Demand	Anodyne	MAN1	0	41
O=[N+]([O-])c1cccnc1NC[C@@H]1CCOC2(CCC2)C1	ZINC000450714579	CF	On-Demand	Bother	PRKCQ	46	37
O=[N+]([O-])c1cccnc1NC[C@H]1CCOC2(CCC2)C1	ZINC000450714581	CF	On-Demand	Bother	PRKCQ	46	37
CCc1cccc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)n1	ZINC000450714584	EG	On-Demand	Anodyne	TRPC6	62	42
CCc1cccc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)n1	ZINC000450714584	EG	On-Demand	Anodyne	TRPC3	37	42
Cc1csc(NC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450714605	GI	On-Demand	Anodyne	CACNA1B	40	39
Cc1csc(NC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450714605	GI	On-Demand	Anodyne	CCR2	33	40
Cc1csc(NC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450714605	GI	On-Demand	Anodyne	LIPG	49	33
Cc1csc(NC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450714605	GI	On-Demand	Anodyne	TRPC6	52	38
Cc1csc(NC2CCN(C(=O)c3ccc(C(F)(F)F)cc3C)CC2)n1	ZINC000450714605	GI	On-Demand	Anodyne	TRPC3	50	38
COC1(CNC(=O)Cc2ccc(O)c(F)c2)CCCCC1	ZINC000450714610	CF	On-Demand	Anodyne	NCE103	25	41
COC1(CNC(=O)Cc2ccc(O)c(F)c2)CCCCC1	ZINC000450714610	CF	On-Demand	Anodyne	CAN2	0	41
Cc1cnc(NC[C@@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000450714627	CG	On-Demand	Bother	PRKCQ	47	39
COc1cccc2c(N3C[C@H](F)[C@H](F)C3)c(C)cnc12	ZINC000450714628	CG	On-Demand	Anodyne	ATP4A	32	40
Cc1cnc(NC[C@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000450714629	CG	On-Demand	Bother	PRKCQ	47	39
COC[C@H](CNc1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)cc1	ZINC000450714640	FH	On-Demand	Anodyne	PTGS2	16	46
C[C@@H]1[C@@H](O)CCCN1c1nc(CN(C)C)nc2scc(-c3ccccc3)c12	ZINC000450714641	GH	On-Demand	Anodyne	ADRB3	25	41
COC[C@@H](CNc1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)cc1	ZINC000450714642	FH	On-Demand	Anodyne	PTGS2	16	46
C[C@@H]1[C@H](O)CCCN1c1nc(CN(C)C)nc2scc(-c3ccccc3)c12	ZINC000450714645	GH	On-Demand	Anodyne	ADRB3	25	41
C[C@H]1[C@H](O)CCCN1c1nc(CN(C)C)nc2scc(-c3ccccc3)c12	ZINC000450714646	GH	On-Demand	Anodyne	ADRB3	25	41
C[C@H]1[C@@H](O)CCCN1c1nc(CN(C)C)nc2scc(-c3ccccc3)c12	ZINC000450714647	GH	On-Demand	Anodyne	ADRB3	25	41
C[C@H](c1ccccc1)[C@@H](O)CN[C@H](c1cccnc1)C1CC1	ZINC000450714663	CG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](c1ccccc1)[C@@H](O)CN[C@H](c1cccnc1)C1CC1	ZINC000450714663	CG	On-Demand	Anodyne	KCNA5	26	40
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H](c1cccnc1)C1CC1	ZINC000450714665	CG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H](c1cccnc1)C1CC1	ZINC000450714665	CG	On-Demand	Anodyne	KCNA5	26	40
C[C@H](c1ccccc1)[C@H](O)CN[C@@H](c1cccnc1)C1CC1	ZINC000450714667	CG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](c1ccccc1)[C@H](O)CN[C@@H](c1cccnc1)C1CC1	ZINC000450714667	CG	On-Demand	Anodyne	KCNA5	26	40
C[C@H](c1ccccc1)[C@H](O)CN[C@H](c1cccnc1)C1CC1	ZINC000450714669	CG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](c1ccccc1)[C@H](O)CN[C@H](c1cccnc1)C1CC1	ZINC000450714669	CG	On-Demand	Anodyne	KCNA5	26	40
COC[C@@H](CNc1ccnc2c1cnn2C)c1ccc(Cl)cc1	ZINC000450714677	EG	On-Demand	Anodyne	HNMT	40	31
Cc1ccnc(OC2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450714678	EG	On-Demand	Anodyne	OPRL1	0	40
Cc1ccnc(OC2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450714678	EG	On-Demand	Anodyne	SCN5A	44	41
COC[C@H](CNc1ccnc2c1cnn2C)c1ccc(Cl)cc1	ZINC000450714680	EG	On-Demand	Anodyne	HNMT	40	31
Cc1ccnc(OC2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1	ZINC000450714681	EG	On-Demand	Anodyne	OPRL1	0	40
Cc1ccnc(OC2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450714684	EG	On-Demand	Anodyne	OPRL1	0	40
Cc1ccnc(OC2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1	ZINC000450714687	EG	On-Demand	Anodyne	OPRL1	0	40
OCCCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450714689	EG	On-Demand	Anodyne	ACHE	38	43
OCCCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450714689	EG	On-Demand	Anodyne	SIGMAR1	51	44
Cc1cccc(Cl)c1C(=O)N1CCC[C@H](S(=O)(=O)N2CCOCC2)C1	ZINC000450714692	GD	On-Demand	Anodyne	CNR2	0	43
Cc1cccc(Cl)c1C(=O)N1CCC[C@@H](S(=O)(=O)N2CCOCC2)C1	ZINC000450714695	GD	On-Demand	Anodyne	CNR2	0	43
CN(C)CCN(C(=O)Cc1c[nH]c2cccc(Cl)c12)C1CC1	ZINC000450714716	DF	On-Demand	Anodyne	MC4R	0	41
COc1ccc(CC(=O)N[C@@H](C)CCN2CCN(C)CC2)c(Cl)c1OC	ZINC000450714717	GE	On-Demand	Anodyne	SLC9A1	59	33
CC(C)CCCC(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450714719	DI	On-Demand	Anodyne	COLA	92	45
CC(C)CCCC(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450714719	DI	On-Demand	Anodyne	CPT1A	76	43
CC(C)CCCC(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450714721	DI	On-Demand	Anodyne	COLA	92	45
CC(C)CCCC(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450714721	DI	On-Demand	Anodyne	CPT1A	76	43
COc1ccc(CC(=O)N[C@H](C)CCN2CCN(C)CC2)c(Cl)c1OC	ZINC000450714729	GE	On-Demand	Anodyne	SLC9A1	59	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1ccsc1C	ZINC000450714731	FH	On-Demand	Anodyne	CCR3	0	46
C[C@@H](O)CCCN[C@@H](c1cccnc1)C1CC1	ZINC000450714733	BE	On-Demand	Anodyne	KCNA5	47	37
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1ccsc1C	ZINC000450714735	FH	On-Demand	Anodyne	CCR3	0	46
C[C@H](O)CCCN[C@H](c1cccnc1)C1CC1	ZINC000450714741	BE	On-Demand	Anodyne	KCNA5	47	37
C[C@@H](O)CCCN[C@H](c1cccnc1)C1CC1	ZINC000450714742	BE	On-Demand	Anodyne	KCNA5	47	37
C[C@H](O)CCCN[C@@H](c1cccnc1)C1CC1	ZINC000450714743	BE	On-Demand	Anodyne	KCNA5	47	37
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450714775	FD	On-Demand	Anodyne	P2RY12	99	36
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450714775	FD	On-Demand	Anodyne	P2RX3	28	52
C[C@@H](CCN1CCN(C)CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450714775	FD	On-Demand	Anodyne	CTSV	45	31
C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450714776	FD	On-Demand	Anodyne	P2RY12	99	36
C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450714776	FD	On-Demand	Anodyne	P2RX3	28	52
C[C@H](CCN1CCN(C)CC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450714776	FD	On-Demand	Anodyne	CTSV	45	31
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450714777	GF	On-Demand	Anodyne	SLC6A1	0	44
CCOC(=O)C1(CNC(=O)Cc2ccc(C(=O)OC)cc2)CC1	ZINC000450714816	DD	On-Demand	Anodyne	NPFFR1	28	42
CC(C)(C)NC(=O)N1CCN(C(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450714831	GD	On-Demand	Anodyne	THYX_PBCV1	0	40
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450714836	GD	On-Demand	Anodyne	SLC9A1	22	41
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450714836	GD	On-Demand	Anodyne	SFRP1	65	41
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450714836	GD	On-Demand	Anodyne	L3MBTL1	0	40
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450714836	GD	On-Demand	Anodyne	L3MBTL3	64	40
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450714836	GD	On-Demand	Anodyne	MBTD1	0	40
CN1CCC[C@H](C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)C1=O	ZINC000450714861	EG	On-Demand	Anodyne	RHOA	0	43
CN1CCC[C@@H](C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)C1=O	ZINC000450714862	EG	On-Demand	Anodyne	RHOA	0	43
C=C(C)CCNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000450714865	CD	On-Demand	Mild	TBXA2R	30	40
CC[C@@](C)(CNc1nc(-c2ccccn2)nc(C)c1C)OC	ZINC000450714869	DF	On-Demand	Anodyne	METAP1	40	45
CC[C@](C)(CNc1nc(-c2ccccn2)nc(C)c1C)OC	ZINC000450714871	DF	On-Demand	Anodyne	METAP1	40	45
CC[C@@](C)(CNc1c(C#N)cnc2c(F)cc(F)cc12)OC	ZINC000450714874	DH	On-Demand	Mild	MAP3K8	98	36
CC[C@](C)(CNc1c(C#N)cnc2c(F)cc(F)cc12)OC	ZINC000450714876	DH	On-Demand	Mild	MAP3K8	98	36
Cc1cncn1C1CCN(C(=O)c2ccsc2Br)CC1	ZINC000450714879	FG	On-Demand	Anodyne	L3MBTL3	45	36
C=C(C)CCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450714880	DE	On-Demand	Mild	TGM2	35	43
C=C(C)CCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450714880	DE	On-Demand	Mild	NAMPT	25	40
CC(C)OC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450714888	FG	On-Demand	Anodyne	SCN9A	0	42
CC(C)OC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450714888	FG	On-Demand	Anodyne	RBP4	57	34
CC(C)OC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450714893	FG	On-Demand	Anodyne	SCN9A	0	42
CC(C)OC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450714893	FG	On-Demand	Anodyne	RBP4	57	34
COc1cc(CC(=O)N2CCC(n3cncc3C)CC2)ccc1Cl	ZINC000450714897	EG	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CCC(n3cncc3C)CC2)ccc1Cl	ZINC000450714897	EG	On-Demand	Anodyne	OPRK1	40	41
COc1cc(CC(=O)N2CCC(n3cncc3C)CC2)ccc1Cl	ZINC000450714897	EG	On-Demand	Anodyne	CCR1	24	46
CC(C)c1nnc(CSc2nnc(-c3cccc(Br)c3)o2)s1	ZINC000450714907	GJ	On-Demand	Anodyne	GSK3A	49	39
FC1(F)CCC[C@H]1CSc1nnc(-c2cccc(Br)c2)o1	ZINC000450714909	GK	On-Demand	Anodyne	GSK3A	41	36
FC1(F)CCC[C@H]1CSc1nnc(-c2cccc(Br)c2)o1	ZINC000450714909	GK	On-Demand	Anodyne	TERT	23	45
FC1(F)CCC[C@@H]1CSc1nnc(-c2cccc(Br)c2)o1	ZINC000450714910	GK	On-Demand	Anodyne	GSK3A	41	36
FC1(F)CCC[C@@H]1CSc1nnc(-c2cccc(Br)c2)o1	ZINC000450714910	GK	On-Demand	Anodyne	TERT	23	45
CCCOc1ccc(C(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c(OC)c1	ZINC000450714913	GF	On-Demand	Anodyne	OXTR	23	42
CC[C@@](C)(CNc1ccc(S(=O)(=O)N2CCCC2)cn1)OC	ZINC000450714915	EE	On-Demand	Anodyne	TGM2	15	42
CC[C@](C)(CNc1ccc(S(=O)(=O)N2CCCC2)cn1)OC	ZINC000450714917	EE	On-Demand	Anodyne	TGM2	15	42
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c(F)c1	ZINC000450714935	ED	On-Demand	Anodyne	SLC6A9	15	40
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c(F)c1	ZINC000450714936	ED	On-Demand	Anodyne	SLC6A9	15	40
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)c(F)c1	ZINC000450714937	ED	On-Demand	Anodyne	SLC6A9	15	40
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c(F)c1	ZINC000450714938	ED	On-Demand	Anodyne	SLC6A9	15	40
COc1cc(CC(=O)NCC(C)(C)C2=CCCCC2)ccc1O	ZINC000450714939	DH	On-Demand	Anodyne	TRPV1	46	56
COc1cc(CC(=O)NCC(C)(C)C2=CCCCC2)ccc1O	ZINC000450714939	DH	On-Demand	Anodyne	NCE103	31	43
COc1cc(CC(=O)NCC(C)(C)C2=CCCCC2)ccc1O	ZINC000450714939	DH	On-Demand	Anodyne	P96878_MYCTU	22	43
COc1cc(CC(=O)NCC(C)(C)C2=CCCCC2)ccc1O	ZINC000450714939	DH	On-Demand	Anodyne	CAN2	0	43
CCS(=O)(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1	ZINC000450714944	GG	On-Demand	Anodyne	ACHE	28	43
CCS(=O)(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1	ZINC000450714944	GG	On-Demand	Anodyne	TBXAS1	42	41
CCS(=O)(=O)c1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1	ZINC000450714944	GG	On-Demand	Anodyne	CYP17A1	18	42
CC[C@@](C)(CNc1cnn(Cc2ccccc2)c(=O)c1Cl)OC	ZINC000450714946	EG	On-Demand	Anodyne	NPBWR1	61	46
CC[C@](C)(CNc1cnn(Cc2ccccc2)c(=O)c1Cl)OC	ZINC000450714948	EG	On-Demand	Anodyne	NPBWR1	61	46
Cc1cc(C)c(C(=O)N2CCC(n3cncc3C)CC2)cc1Br	ZINC000450714967	GI	On-Demand	Anodyne	L3MBTL1	0	48
Cc1cc(C)c(C(=O)N2CCC(n3cncc3C)CC2)cc1Br	ZINC000450714967	GI	On-Demand	Anodyne	L3MBTL3	60	48
Cc1cc(C)c(C(=O)N2CCC(n3cncc3C)CC2)cc1Br	ZINC000450714967	GI	On-Demand	Anodyne	MBTD1	0	40
O=C1[C@H](NC(=O)C2(C(F)(F)F)CCC2)CCN1c1ccccc1C(F)(F)F	ZINC000450714975	GH	On-Demand	Anodyne	RBP4	48	35
O=C1[C@@H](NC(=O)C2(C(F)(F)F)CCC2)CCN1c1ccccc1C(F)(F)F	ZINC000450714979	GH	On-Demand	Anodyne	RBP4	48	35
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC([C@H](C)NC(C)=O)CC2)c1	ZINC000450714983	EF	On-Demand	Anodyne	NPBWR1	55	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC([C@H](C)NC(C)=O)CC2)c1	ZINC000450714983	EF	On-Demand	Anodyne	GPR88	0	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c1	ZINC000450714985	EF	On-Demand	Anodyne	NPBWR1	55	33
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c1	ZINC000450714985	EF	On-Demand	Anodyne	GPR88	0	41
COC(=O)c1cccc(CN2CCC(c3ccc(C)nc3)CC2)c1Cl	ZINC000450714986	FI	On-Demand	Anodyne	MGEA5	26	40
CCC(CC)Oc1ccc(C(=O)N2CCC([C@H](C)NC(C)=O)CC2)cc1	ZINC000450714990	FH	On-Demand	Anodyne	ACACA	44	35
CCC(CC)Oc1ccc(C(=O)N2CCC([C@H](C)NC(C)=O)CC2)cc1	ZINC000450714990	FH	On-Demand	Anodyne	L3MBTL3	65	39
CCC(CC)Oc1ccc(C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)cc1	ZINC000450714991	FH	On-Demand	Anodyne	ACACA	44	35
CCC(CC)Oc1ccc(C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)cc1	ZINC000450714991	FH	On-Demand	Anodyne	L3MBTL3	65	39
CCOC(=O)C1(CNC(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450715000	FF	On-Demand	Anodyne	DRD4	40	30
CCOC(=O)C1(CNC(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450715000	FF	On-Demand	Anodyne	MTNR1A	32	40
CCOC(=O)C1(CNC(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450715000	FF	On-Demand	Anodyne	MTNR1B	31	40
CCOc1ccc(-c2cn(C3CN(C(=O)[C@H](O)C4CCC4)C3)nn2)cc1	ZINC000450715001	FD	On-Demand	Anodyne	CA14	19	40
CCOc1ccc(-c2cn(C3CN(C(=O)[C@@H](O)C4CCC4)C3)nn2)cc1	ZINC000450715002	FD	On-Demand	Anodyne	CA14	19	40
CCN1CCN(c2cccc(NC(=O)C3(CF)CCOCC3)c2)CC1	ZINC000450715011	EF	On-Demand	Anodyne	HTR1A	16	42
CCN1CCN(c2cccc(NC(=O)C3(CF)CCOCC3)c2)CC1	ZINC000450715011	EF	On-Demand	Anodyne	HTR7	16	40
CCN1CCN(c2cccc(NC(=O)C3(CF)CCOCC3)c2)CC1	ZINC000450715011	EF	On-Demand	Anodyne	PRNP	24	41
CCc1nc(C)c(COc2ccc(S(C)(=O)=O)cc2)o1	ZINC000450715012	CF	On-Demand	Anodyne	PTGS2	26	41
CC(=O)CCCCCOc1ccc(F)cc1F	ZINC000450715016	BG	On-Demand	Anodyne	THRA	32	48
CC(=O)CCCCCOc1ccc(F)cc1F	ZINC000450715016	BG	On-Demand	Anodyne	THRB	0	48
COc1ccc2c(c1)nc(CNC(=O)Cc1cc(C)ccc1F)n2C	ZINC000450715029	EF	On-Demand	Anodyne	PTGS1	0	44
COc1ccc2c(c1)nc(CNC(=O)Cc1cc(C)ccc1F)n2C	ZINC000450715029	EF	On-Demand	Anodyne	PTGS2	42	44
CCc1nc(C)c(COc2ccc(Cl)cc2F)o1	ZINC000450715033	CH	On-Demand	Anodyne	S1PR4	17	41
O=C(c1ccc(N2C[C@H](F)[C@H](F)C2)nc1)N1CCc2ccccc21	ZINC000450715050	EF	On-Demand	Anodyne	AVPR2	52	45
O=C(c1ccc(N2C[C@H](F)[C@H](F)C2)nc1)N1CCc2ccccc21	ZINC000450715050	EF	On-Demand	Anodyne	AVPR1A	36	40
CCOC(=O)C1(CNC(=O)c2ccc(I)cc2F)CC1	ZINC000450715051	GF	On-Demand	Anodyne	SLC6A9	44	34
CCOC(=O)C1(CNC(=O)c2ccc(I)cc2F)CC1	ZINC000450715051	GF	On-Demand	Anodyne	MAP2K1	54	35
CCOC(=O)C1(CNC(=O)c2ccc(I)cc2F)CC1	ZINC000450715051	GF	On-Demand	Anodyne	HCN1	42	32
Cc1nn(C)cc1COc1ccc(S(C)(=O)=O)cc1	ZINC000450715052	CD	On-Demand	Anodyne	PTGS2	25	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450715065	GI	On-Demand	Anodyne	CACNA1B	47	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450715065	GI	On-Demand	Anodyne	CCR5	19	41
O=C(c1cc(Cl)c(F)cc1Br)N1CCn2ncnc2C1	ZINC000450715072	FE	On-Demand	Anodyne	P2RX7	40	43
Cc1nc2ccnn2cc1C(=O)NCC1(CO)CCCC1	ZINC000450715075	CD	On-Demand	Anodyne	HCN4	51	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCCC2(CC2)C1	ZINC000450715077	DF	On-Demand	Anodyne	RIR1_HHV11	48	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCCC2(CC2)C1	ZINC000450715077	DF	On-Demand	Anodyne	RHODESAIN	0	40
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	DRD2	27	41
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	HRH1	16	45
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	OPRM1	0	40
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	KCNH2	15	40
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	HTR4	48	35
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	LTA4H	17	44
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	HTR7	38	43
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	SIGMAR1	31	46
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	CCR3	28	43
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	MTNR1A	66	38
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	MTNR1B	60	38
COc1ccc(CNC(=O)CCN2CC[C@@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715082	GG	On-Demand	Anodyne	ACKR3	57	35
Cc1csc(NC2CCN(C(=O)CCCC(C)C)CC2)n1	ZINC000450715083	DH	On-Demand	Anodyne	TRPC6	46	35
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	DRD2	27	41
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	HRH1	16	45
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	OPRM1	0	40
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	KCNH2	15	40
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	HTR4	48	35
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	LTA4H	17	44
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	HTR7	38	43
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	SIGMAR1	31	46
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	CCR3	28	43
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	MTNR1A	66	38
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	MTNR1B	60	38
COc1ccc(CNC(=O)CCN2CC[C@H](COc3ccccc3)C2)c(OC)c1	ZINC000450715085	GG	On-Demand	Anodyne	ACKR3	57	35
Cc1csc(NC2CCN(C(=O)Cc3cc(F)c(C)cc3F)CC2)n1	ZINC000450715089	FH	On-Demand	Anodyne	TRPC6	47	36
Cc1csc(NC2CCN(C(=O)C(C)(C)C3CCC3)CC2)n1	ZINC000450715096	DH	On-Demand	Anodyne	TRPC6	46	36
CCOC(=O)COCCNc1ncnc2c1cnn2-c1ccccc1	ZINC000450715098	ED	On-Demand	Anodyne	ADORA1	0	40
CCOC(=O)COCCNc1ncnc2c1cnn2-c1ccccc1	ZINC000450715098	ED	On-Demand	Anodyne	SRC	22	50
CCN1CCN(c2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450715099	FH	On-Demand	Anodyne	HTR1A	15	43
CCN1CCN(c2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450715099	FH	On-Demand	Anodyne	HTR1D	18	44
CCN1CCN(c2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450715099	FH	On-Demand	Anodyne	HTR1B	20	44
CCN1CCN(c2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450715099	FH	On-Demand	Anodyne	PRNP	51	42
CCOC(=O)c1cnc2ccccc2c1N1C[C@H](F)[C@H](F)C1	ZINC000450715108	DF	On-Demand	Anodyne	ADORA1	0	44
CCS(=O)(=O)c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000450715119	FE	On-Demand	Anodyne	PTGS2	29	42
CCS(=O)(=O)c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000450715119	FE	On-Demand	Anodyne	CA7	19	50
CCS(=O)(=O)c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000450715119	FE	On-Demand	Anodyne	MMP13	17	41
CCS(=O)(=O)c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000450715119	FE	On-Demand	Anodyne	ADAM17	16	41
CCS(=O)(=O)c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000450715119	FE	On-Demand	Anodyne	MMP14	22	41
CCS(=O)(=O)c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000450715119	FE	On-Demand	Anodyne	ADAMTS4	43	38
CCS(=O)(=O)c1ccc(COc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000450715119	FE	On-Demand	Anodyne	CA9	17	40
CC(F)(F)CCOc1ccc(S(C)(=O)=O)cc1	ZINC000450715134	CF	On-Demand	Anodyne	PTGS2	46	42
CC(F)(F)CCOc1ccc(S(C)(=O)=O)cc1	ZINC000450715134	CF	On-Demand	Anodyne	CA7	15	44
C[C@@H](CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O	ZINC000450715142	EF	On-Demand	Anodyne	CACNA1B	28	41
C[C@H](CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O	ZINC000450715143	EF	On-Demand	Anodyne	CACNA1B	28	41
C[C@@H](CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O	ZINC000450715144	EF	On-Demand	Anodyne	CACNA1B	28	41
C[C@H](CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O	ZINC000450715145	EF	On-Demand	Anodyne	CACNA1B	28	41
CC(=O)NC1CCC(N(C)CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450715171	GH	On-Demand	Anodyne	SHC	44	44
CC(=O)NC1CCC(N(C)CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450715171	GH	On-Demand	Anodyne	HDAC8	18	43
CC(=O)NC1CCC(N(C)CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450715171	GH	On-Demand	Anodyne	LSS	26	52
COc1cccc(OCCC(=O)N2CC=C(c3cccc(OC)c3)C2)c1	ZINC000450715188	FG	On-Demand	Anodyne	MTNR1A	22	43
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450715215	GF	On-Demand	Anodyne	PRCP	22	43
F[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H]1F	ZINC000450715232	DF	On-Demand	Anodyne	PDE3A	44	33
F[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H]1F	ZINC000450715232	DF	On-Demand	Anodyne	PDE3B	65	33
CCOC(=O)c1cc(C(=O)Nc2ccc3c(c2)CN(C)C(=O)N3)[nH]c1C	ZINC000450715247	FF	On-Demand	Anodyne	BRD4	15	44
COC1(Cn2nnc(-c3cccc(F)c3)n2)CCC1	ZINC000450715248	CE	On-Demand	Anodyne	SCARB1	22	41
CCOC(=O)c1cc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)[nH]c1C	ZINC000450715260	GF	On-Demand	Anodyne	TRPC6	47	35
CCN(CC)c1ccc(-c2nnc(SCc3ccnc(OC)n3)o2)cc1	ZINC000450715265	FH	On-Demand	Anodyne	GSK3B	16	41
CCN(CC)c1ccc(-c2nnc(SCc3ccnc(OC)n3)o2)cc1	ZINC000450715265	FH	On-Demand	Anodyne	GSK3A	38	41
O=[N+]([O-])c1cc(Br)cnc1NC[C@H]1CCOC2(CCC2)C1	ZINC000450715278	FH	On-Demand	Bother	PRKCQ	46	36
O=[N+]([O-])c1cc(Br)cnc1NC[C@@H]1CCOC2(CCC2)C1	ZINC000450715279	FH	On-Demand	Bother	PRKCQ	46	36
O=C1[C@H](N2CCN(CC3=CCCCC3)CC2)CCCN1Cc1ccccc1	ZINC000450715303	FG	On-Demand	Anodyne	DRD4	15	41
O=C1[C@@H](N2CCN(CC3=CCCCC3)CC2)CCCN1Cc1ccccc1	ZINC000450715304	FG	On-Demand	Anodyne	DRD4	15	41
CCOC(=O)C1(CNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450715314	DD	On-Demand	Anodyne	MME	52	38
CCOC(=O)C1(CNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450715314	DD	On-Demand	Anodyne	PAPA1_CARPA	51	38
CCOC(=O)C1(CNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450715314	DD	On-Demand	Anodyne	TIMP3	71	38
CCOC(=O)C1(CNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450715314	DD	On-Demand	Anodyne	CAPNS1	46	32
CCOC(=O)C1(CNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450715314	DD	On-Demand	Anodyne	HLA-DRB1	43	36
CCOC(=O)C1(CNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450715314	DD	On-Demand	Anodyne	F11	42	36
CCOC(=O)C1(CNC(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450715314	DD	On-Demand	Anodyne	CAPN2	43	34
CCOC(=O)C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450715315	DD	On-Demand	Anodyne	MME	52	38
CCOC(=O)C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450715315	DD	On-Demand	Anodyne	PAPA1_CARPA	51	38
CCOC(=O)C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450715315	DD	On-Demand	Anodyne	TIMP3	71	38
CCOC(=O)C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450715315	DD	On-Demand	Anodyne	CAPNS1	46	32
CCOC(=O)C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450715315	DD	On-Demand	Anodyne	HLA-DRB1	43	36
CCOC(=O)C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450715315	DD	On-Demand	Anodyne	F11	42	36
CCOC(=O)C1(CNC(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450715315	DD	On-Demand	Anodyne	CAPN2	43	34
COc1cc(OC)nc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)n1	ZINC000450715332	CD	On-Demand	Anodyne	ALS	64	31
COc1cc(OC)nc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)n1	ZINC000450715333	CD	On-Demand	Anodyne	ALS	64	31
COc1cc(OC)nc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)n1	ZINC000450715334	CD	On-Demand	Anodyne	ALS	64	31
COc1cc(OC)nc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)n1	ZINC000450715335	CD	On-Demand	Anodyne	ALS	64	31
CC(C)NC(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450715359	FF	On-Demand	Bother	TAAR1	17	41
CC(C)NC(=O)c1ccc(N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450715360	FF	On-Demand	Bother	TAAR1	17	41
CC(C)NC(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450715361	FF	On-Demand	Bother	TAAR1	17	41
CC(C)NC(=O)c1ccc(N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450715362	FF	On-Demand	Bother	TAAR1	17	41
COc1cccc(C2=CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450715392	EF	On-Demand	Anodyne	CCKAR	0	40
COc1cccc(C2=CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450715392	EF	On-Demand	Anodyne	HPGD	23	41
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450715395	GG	On-Demand	Anodyne	PRCP	19	41
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450715397	GG	On-Demand	Anodyne	PRCP	19	41
Clc1cccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)o2)c1	ZINC000450715402	DI	On-Demand	Anodyne	TERT	22	44
Clc1cccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)o2)c1	ZINC000450715403	DI	On-Demand	Anodyne	TERT	22	44
CN(C)CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2)cn1)C1CC1	ZINC000450715404	FH	On-Demand	Anodyne	UTS2	40	33
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450715409	DD	On-Demand	Mild	CA2	68	43
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450715409	DD	On-Demand	Mild	CA1	57	38
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450715409	DD	On-Demand	Mild	CA7	50	36
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450715409	DD	On-Demand	Mild	CA5B	43	35
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450715409	DD	On-Demand	Mild	CA4	60	43
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450715409	DD	On-Demand	Mild	CA5A	45	35
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450715409	DD	On-Demand	Mild	CAH_METTE	45	31
C=C(C)CCNc1ccc([N+](=O)[O-])cc1COC	ZINC000450715433	CG	On-Demand	Mild	CACNA1D	50	39
COC(=O)c1coc(CN2CCC(c3ccc(C)nc3)CC2)n1	ZINC000450715442	DF	On-Demand	Anodyne	MGEA5	26	41
CC(C)(CC(=O)CSc1nnc(-c2cccc(Cl)c2)o1)C1CC1	ZINC000450715446	FJ	On-Demand	Anodyne	TERT	20	42
CC(C)O[C@@]1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCOC1	ZINC000450715452	FH	On-Demand	Anodyne	ATF1	56	37
CC(C)O[C@@]1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCOC1	ZINC000450715452	FH	On-Demand	Anodyne	NFKB1	51	37
CC(C)O[C@]1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCOC1	ZINC000450715453	FH	On-Demand	Anodyne	ATF1	56	37
CC(C)O[C@]1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCOC1	ZINC000450715453	FH	On-Demand	Anodyne	NFKB1	51	37
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cn1)OC	ZINC000450715458	CC	On-Demand	Anodyne	CYNT	43	33
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cn1)OC	ZINC000450715459	CC	On-Demand	Anodyne	CYNT	43	33
CN(Cc1ccccc1)C1(CNc2ncnc3c2ncn3C2CC2)CCC1	ZINC000450715472	FH	On-Demand	Anodyne	ADORA2A	0	41
CN(Cc1ccccc1)C1(CNc2ncnc3c2ncn3C2CC2)CCC1	ZINC000450715472	FH	On-Demand	Anodyne	CDK1	20	41
CN(Cc1ccccc1)C1(CNc2ncnc3c2ncn3C2CC2)CCC1	ZINC000450715472	FH	On-Demand	Anodyne	ADORA3	53	39
CCS(=O)(=O)c1ccc(CN[C@@H](c2cccnc2)C2CC2)cc1	ZINC000450715484	EG	On-Demand	Anodyne	ADRB3	61	40
CCS(=O)(=O)c1ccc(CN[C@@H](c2cccnc2)C2CC2)cc1	ZINC000450715484	EG	On-Demand	Anodyne	NAMPT	44	35
CCS(=O)(=O)c1ccc(CN[C@H](c2cccnc2)C2CC2)cc1	ZINC000450715486	EG	On-Demand	Anodyne	ADRB3	61	40
CCS(=O)(=O)c1ccc(CN[C@H](c2cccnc2)C2CC2)cc1	ZINC000450715486	EG	On-Demand	Anodyne	NAMPT	44	35
CSc1cccc(C(=O)N2CCC(n3cncc3C)CC2)c1	ZINC000450715511	DG	On-Demand	Anodyne	L3MBTL1	0	45
CSc1cccc(C(=O)N2CCC(n3cncc3C)CC2)c1	ZINC000450715511	DG	On-Demand	Anodyne	L3MBTL3	62	35
C=C(C)CCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450715512	CG	On-Demand	Mild	TAAR1	17	44
CC[C@@](C)(CNc1ccc(C(=O)Nc2ccccc2)nn1)OC	ZINC000450715518	DE	On-Demand	Anodyne	KCNK3	46	33
CC[C@@](C)(CNc1ccc(C(=O)Nc2ccccc2)nn1)OC	ZINC000450715518	DE	On-Demand	Anodyne	KCNK9	43	33
CC[C@](C)(CNc1ccc(C(=O)Nc2ccccc2)nn1)OC	ZINC000450715523	DE	On-Demand	Anodyne	KCNK3	46	33
CC[C@](C)(CNc1ccc(C(=O)Nc2ccccc2)nn1)OC	ZINC000450715523	DE	On-Demand	Anodyne	KCNK9	43	33
C[C@H](NC[C@@H]1CCCC1(F)F)c1cccc(NS(C)(=O)=O)c1	ZINC000450715526	EG	On-Demand	Anodyne	POL	0	40
C[C@@H](NC[C@H]1CCCC1(F)F)c1cccc(NS(C)(=O)=O)c1	ZINC000450715528	EG	On-Demand	Anodyne	POL	0	40
C[C@H](NC[C@H]1CCCC1(F)F)c1cccc(NS(C)(=O)=O)c1	ZINC000450715530	EG	On-Demand	Anodyne	POL	0	40
C[C@@H](NC[C@@H]1CCCC1(F)F)c1cccc(NS(C)(=O)=O)c1	ZINC000450715531	EG	On-Demand	Anodyne	POL	0	40
CC(=O)N[C@H](C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1)C(C)(C)C	ZINC000450715532	FH	On-Demand	Anodyne	ATF1	58	40
CC(=O)N[C@H](C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1)C(C)(C)C	ZINC000450715532	FH	On-Demand	Anodyne	NFKB1	53	40
CC(=O)N[C@H](C)C1CCN(C(=O)CCc2cccc(F)c2Br)CC1	ZINC000450715539	GG	On-Demand	Anodyne	CCR1	19	40
CC(=O)N[C@H](C)C1CCN(C(=O)CCc2cccc(F)c2Br)CC1	ZINC000450715539	GG	On-Demand	Anodyne	C3AR1	37	40
CC(=O)N[C@@H](C)C1CCN(C(=O)CCc2cccc(F)c2Br)CC1	ZINC000450715540	GG	On-Demand	Anodyne	CCR1	19	40
CC(=O)N[C@@H](C)C1CCN(C(=O)CCc2cccc(F)c2Br)CC1	ZINC000450715540	GG	On-Demand	Anodyne	C3AR1	37	40
Cc1cncn1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)CC1	ZINC000450715542	GF	On-Demand	Bother	L3MBTL1	0	43
Cc1cncn1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)CC1	ZINC000450715542	GF	On-Demand	Bother	L3MBTL3	57	43
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(Br)cc1	ZINC000450715554	FH	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(Br)cc1	ZINC000450715554	FH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1CCOCC2(CC2)C1)c1ccc(Br)cc1	ZINC000450715554	FH	On-Demand	Anodyne	CYP2J2	51	36
COC1(CSc2nnc(-c3ccccc3C)n2Cc2ccco2)CCC1	ZINC000450715560	FJ	On-Demand	Anodyne	HCRTR2	23	47
C[C@@H](NCC1=CCCCC1)c1cccc(NS(C)(=O)=O)c1	ZINC000450715561	DG	On-Demand	Anodyne	POL	17	40
C[C@H](NCC1=CCCCC1)c1cccc(NS(C)(=O)=O)c1	ZINC000450715562	DG	On-Demand	Anodyne	POL	17	40
CCN(CC)C(=O)CCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450715568	GG	On-Demand	Anodyne	ACHE	46	58
CCN(CC)C(=O)CCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450715568	GG	On-Demand	Anodyne	SIGMAR1	32	40
CCN(CC)C(=O)CCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450715568	GG	On-Demand	Anodyne	CCR5	27	40
CCN(CC)C(=O)CCC1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450715568	GG	On-Demand	Anodyne	MCHR1	23	41
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1ncc(C(F)(F)F)cn1	ZINC000450715590	GG	On-Demand	Bother	CACNA1D	48	35
C[C@H](NCCC[C@@H](C)O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450715596	DI	On-Demand	Mild	MCHR1	17	40
C[C@H](O)CCCN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450715597	DI	On-Demand	Mild	MCHR1	22	46
C[C@@H](O)CCCN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450715598	DI	On-Demand	Mild	MCHR1	17	40
Cc1csc(NC2CCN(C(=O)c3ccc(C#N)n3C)CC2)n1	ZINC000450715604	EE	On-Demand	Mild	TRPC6	49	37
CCS(=O)(=O)c1ccc(CN2CCC(C)(C#N)CC2)cc1	ZINC000450715622	DF	On-Demand	Mild	SIGMAR1	15	42
CCS(=O)(=O)c1ccc(CN2CCC(C)(C#N)CC2)cc1	ZINC000450715622	DF	On-Demand	Mild	ADAM17	20	40
CCn1c(S[C@H](C)C(=O)C2CCCCC2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450715623	GG	On-Demand	Anodyne	CNR2	20	47
CCn1c(S[C@H](C)C(=O)C2CCCCC2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450715623	GG	On-Demand	Anodyne	ITK	22	41
CCn1c(S[C@@H](C)C(=O)C2CCCCC2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450715624	GG	On-Demand	Anodyne	CNR2	20	47
CCn1c(S[C@@H](C)C(=O)C2CCCCC2)nc2cc(S(N)(=O)=O)ccc21	ZINC000450715624	GG	On-Demand	Anodyne	ITK	22	41
CCOC(=O)c1ccc(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)nc1	ZINC000450715632	GH	On-Demand	Anodyne	RBP4	58	36
CCOC(=O)c1ccc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)nc1	ZINC000450715635	GH	On-Demand	Anodyne	RBP4	58	36
Cc1ccn(-c2ccccc2C(=O)NCC2(CO)CCCC2)n1	ZINC000450715638	DE	On-Demand	Anodyne	HCN1	64	36
Cc1ccn(-c2ccccc2C(=O)NCC2(CO)CCCC2)n1	ZINC000450715638	DE	On-Demand	Anodyne	HCN4	54	35
CCOC(=O)C1(CNC(=O)c2cccc(C#N)c2Br)CC1	ZINC000450715640	FE	On-Demand	Mild	HCN1	62	34
CCOC(=O)C1(CNC(=O)c2cccc(C#N)c2Br)CC1	ZINC000450715640	FE	On-Demand	Mild	HCN4	50	34
CCCOc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450715641	FE	On-Demand	Anodyne	THRA	19	41
CCCOc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450715641	FE	On-Demand	Anodyne	HTR4	42	35
CCCOc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450715641	FE	On-Demand	Anodyne	THRB	16	41
CCCOc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450715642	FE	On-Demand	Anodyne	THRA	19	41
CCCOc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450715642	FE	On-Demand	Anodyne	HTR4	42	35
CCCOc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450715642	FE	On-Demand	Anodyne	THRB	16	41
Cc1csc(NC2CCN(C(=O)c3ccsc3C)CC2)n1	ZINC000450715645	DH	On-Demand	Anodyne	TRPC6	54	41
Cc1csc(NC2CCN(C(=O)c3ccsc3C)CC2)n1	ZINC000450715645	DH	On-Demand	Anodyne	TRPC3	36	41
CCOC(=O)CCN(Cc1cccnc1)Cc1ccc(Cl)c(OC)c1	ZINC000450715650	FH	On-Demand	Anodyne	NR1D1	45	40
CC(=O)c1cccc(CN2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450715666	DH	On-Demand	Anodyne	DRD2	15	43
CC(=O)c1cccc(CN2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450715666	DH	On-Demand	Anodyne	DRD4	43	42
CC(=O)c1cccc(CN2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450715666	DH	On-Demand	Anodyne	ACHE	24	42
CC(=O)c1cccc(CN2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450715666	DH	On-Demand	Anodyne	DRD3	22	41
CC(=O)c1cccc(CN2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450715666	DH	On-Demand	Anodyne	CHRM3	24	41
CC(=O)c1cccc(CN2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450715666	DH	On-Demand	Anodyne	CCR3	52	38
CC(=O)c1cccc(CN2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000450715666	DH	On-Demand	Anodyne	MCHR1	35	43
CC(=O)c1cccc(CN2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450715667	DH	On-Demand	Anodyne	DRD2	15	43
CC(=O)c1cccc(CN2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450715667	DH	On-Demand	Anodyne	DRD4	43	42
CC(=O)c1cccc(CN2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450715667	DH	On-Demand	Anodyne	ACHE	24	42
CC(=O)c1cccc(CN2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450715667	DH	On-Demand	Anodyne	DRD3	22	41
CC(=O)c1cccc(CN2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450715667	DH	On-Demand	Anodyne	CHRM3	24	41
CC(=O)c1cccc(CN2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450715667	DH	On-Demand	Anodyne	CCR3	52	38
CC(=O)c1cccc(CN2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000450715667	DH	On-Demand	Anodyne	MCHR1	35	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715670	FF	On-Demand	Anodyne	TACR2	22	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715670	FF	On-Demand	Anodyne	NPY1R	40	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715670	FF	On-Demand	Anodyne	CYP2J2	46	33
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715672	FF	On-Demand	Anodyne	TACR2	22	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715672	FF	On-Demand	Anodyne	NPY1R	40	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715672	FF	On-Demand	Anodyne	CYP2J2	46	33
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715674	FF	On-Demand	Anodyne	TACR2	22	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715674	FF	On-Demand	Anodyne	NPY1R	40	37
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715674	FF	On-Demand	Anodyne	CYP2J2	46	33
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715676	FF	On-Demand	Anodyne	TACR2	22	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715676	FF	On-Demand	Anodyne	NPY1R	40	37
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450715676	FF	On-Demand	Anodyne	CYP2J2	46	33
Cc1ccc(CC(=O)NCCc2nn(C)c3ccccc23)c(Br)c1	ZINC000450715695	GH	On-Demand	Anodyne	P2RX7	31	41
Cc1ccc(CC(=O)NCCc2nn(C)c3ccccc23)c(Br)c1	ZINC000450715695	GH	On-Demand	Anodyne	IMDH_CRYPV	24	40
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc(C#N)[nH]c1C	ZINC000450715702	FF	On-Demand	Mild	CCR3	0	42
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc(C#N)[nH]c1C	ZINC000450715702	FF	On-Demand	Mild	CTRB_BOVIN	48	38
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(C#N)[nH]c1C	ZINC000450715703	FF	On-Demand	Mild	CCR3	0	42
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(C#N)[nH]c1C	ZINC000450715703	FF	On-Demand	Mild	CTRB_BOVIN	48	38
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450715708	EI	On-Demand	Anodyne	TRPC6	45	33
CC(C)CC(CC(C)C)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450715709	EI	On-Demand	Anodyne	BRD4	17	48
CCC[C@H]1CCC[C@H]1C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450715712	EI	On-Demand	Anodyne	TRPC6	45	33
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450715714	EI	On-Demand	Anodyne	TRPC6	45	33
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000450715715	EI	On-Demand	Anodyne	TRPC6	45	33
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	EGFR	0	40
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	HTR1A	50	48
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	DRD2	43	48
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	DRD4	45	36
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	HTR2A	24	41
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	DRD3	49	39
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	HTR4	27	42
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	TACR1	0	42
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	HTR7	45	37
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	CCR1	35	41
CCN1CCN(c2cccc(NC(=O)Cc3ccc(Cl)c(OC)c3)c2)CC1	ZINC000450715732	GH	On-Demand	Anodyne	IMDH_CRYPV	19	43
CCN1CCN(c2cccc(NC(=O)Cc3ccc(O)c(OC)c3)c2)CC1	ZINC000450715744	FF	On-Demand	Anodyne	HTR1A	36	43
CCN1CCN(c2cccc(NC(=O)Cc3ccc(O)c(OC)c3)c2)CC1	ZINC000450715744	FF	On-Demand	Anodyne	DRD2	32	43
CCN1CCN(c2cccc(NC(=O)Cc3ccc(O)c(OC)c3)c2)CC1	ZINC000450715744	FF	On-Demand	Anodyne	DRD4	41	33
CCN1CCN(c2cccc(NC(=O)Cc3ccc(O)c(OC)c3)c2)CC1	ZINC000450715744	FF	On-Demand	Anodyne	HTR7	44	37
CCN1CCN(c2cccc(NC(=O)Cc3ccc(O)c(OC)c3)c2)CC1	ZINC000450715744	FF	On-Demand	Anodyne	TRPV1	0	44
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450715779	ED	On-Demand	Anodyne	HTR2A	29	42
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450715779	ED	On-Demand	Anodyne	SLC6A1	64	33
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450715779	ED	On-Demand	Anodyne	DRD3	25	42
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450715779	ED	On-Demand	Anodyne	HTR7	45	43
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450715782	ED	On-Demand	Anodyne	HTR2A	29	42
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450715782	ED	On-Demand	Anodyne	SLC6A1	64	33
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450715782	ED	On-Demand	Anodyne	DRD3	25	42
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450715782	ED	On-Demand	Anodyne	HTR7	45	43
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450715784	ED	On-Demand	Anodyne	HTR2A	29	42
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450715784	ED	On-Demand	Anodyne	SLC6A1	64	33
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450715784	ED	On-Demand	Anodyne	DRD3	25	42
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450715784	ED	On-Demand	Anodyne	HTR7	45	43
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450715786	ED	On-Demand	Anodyne	HTR2A	29	42
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450715786	ED	On-Demand	Anodyne	SLC6A1	64	33
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450715786	ED	On-Demand	Anodyne	DRD3	25	42
C[C@@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450715786	ED	On-Demand	Anodyne	HTR7	45	43
Cc1csc(NC2CCN(C(=O)c3ccc(C)c(Cl)c3Cl)CC2)n1	ZINC000450715789	GJ	On-Demand	Anodyne	TRPC6	53	40
Cc1csc(NC2CCN(C(=O)c3ccc(C)c(Cl)c3Cl)CC2)n1	ZINC000450715789	GJ	On-Demand	Anodyne	TRPC3	35	40
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715813	GH	On-Demand	Anodyne	RBP4	81	38
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715813	GH	On-Demand	Anodyne	SCD1	23	41
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715813	GH	On-Demand	Anodyne	SFRP1	100	41
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715813	GH	On-Demand	Anodyne	SCD	27	41
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715813	GH	On-Demand	Anodyne	WNT3	61	32
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715814	GH	On-Demand	Anodyne	RBP4	81	38
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715814	GH	On-Demand	Anodyne	SCD1	23	41
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715814	GH	On-Demand	Anodyne	SFRP1	100	41
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715814	GH	On-Demand	Anodyne	SCD	27	41
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715814	GH	On-Demand	Anodyne	WNT3	61	32
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715815	GH	On-Demand	Anodyne	RBP4	81	38
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715815	GH	On-Demand	Anodyne	SCD1	23	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715815	GH	On-Demand	Anodyne	SFRP1	100	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715815	GH	On-Demand	Anodyne	SCD	27	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715815	GH	On-Demand	Anodyne	WNT3	61	32
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715816	GH	On-Demand	Anodyne	RBP4	81	38
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715816	GH	On-Demand	Anodyne	SCD1	23	41
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715816	GH	On-Demand	Anodyne	SFRP1	100	41
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715816	GH	On-Demand	Anodyne	SCD	27	41
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450715816	GH	On-Demand	Anodyne	WNT3	61	32
CC(C)Cn1cc(C(=O)Nc2ccc3c(c2)CN(C)C(=O)N3)c(C(F)F)n1	ZINC000450715828	GH	On-Demand	Anodyne	BRD4	15	41
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	HTR1A	33	48
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	DRD2	19	45
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	HTR1D	26	41
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	HTR1B	23	41
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	HTR2A	23	40
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	DRD3	15	40
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	SLC6A3	19	42
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	HTR7	26	42
CCN1CCN(c2cccc(NC(=O)[C@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715834	GG	On-Demand	Anodyne	PRNP	33	42
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	HTR1A	33	48
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	DRD2	19	45
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	HTR1D	26	41
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	HTR1B	23	41
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	HTR2A	23	40
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	DRD3	15	40
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	SLC6A3	19	42
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	HTR7	26	42
CCN1CCN(c2cccc(NC(=O)[C@@H](C)OCCc3ccccc3)c2)CC1	ZINC000450715835	GG	On-Demand	Anodyne	PRNP	33	42
CCCOc1ccc(C(=O)NCC2(CO)CCCC2)c(OC)c1	ZINC000450715854	DF	On-Demand	Anodyne	KCNA3	44	44
CCCOc1ccc(C(=O)NCC2(CO)CCCC2)c(OC)c1	ZINC000450715854	DF	On-Demand	Anodyne	HCN1	66	40
CCCOc1ccc(C(=O)NCC2(CO)CCCC2)c(OC)c1	ZINC000450715854	DF	On-Demand	Anodyne	HCN4	57	38
CC1(C#N)CCN(Cc2ccc(F)c(CN3CCC(C)(C#N)CC3)c2)CC1	ZINC000450715859	FI	On-Demand	Mild	MCHR2	47	32
O=[N+]([O-])c1cnc(NC[C@H]2CCOC3(CCC3)C2)c(Br)c1	ZINC000450715874	FH	On-Demand	Bother	PRKCQ	40	35
O=[N+]([O-])c1cnc(NC[C@@H]2CCOC3(CCC3)C2)c(Br)c1	ZINC000450715876	FH	On-Demand	Bother	PRKCQ	40	35
Cn1c(CNC(=O)CCCC(=O)C2CC2)nc2cccc(Cl)c21	ZINC000450715884	EF	On-Demand	Anodyne	HTR7	28	44
N#Cc1cnc(NC[C@@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000450715888	DF	On-Demand	Mild	PRKCQ	44	34
N#Cc1cnc(NC[C@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000450715890	DF	On-Demand	Mild	PRKCQ	44	34
COc1cc(Br)c(C(=O)NCC2(CO)CCCC2)cc1OC	ZINC000450715893	FF	On-Demand	Anodyne	HCN1	54	38
COc1cc(Br)c(C(=O)NCC2(CO)CCCC2)cc1OC	ZINC000450715893	FF	On-Demand	Anodyne	HCN4	51	38
CN1Cc2cc(NC(=O)C(C)(C)C(C)(F)F)ccc2NC1=O	ZINC000450715894	DG	On-Demand	Anodyne	BRD4	18	56
N#CC1(CN2CC[C@H](COc3ccccc3)C2)CCC1	ZINC000450715895	CG	On-Demand	Mild	SIGMAR1	26	54
N#CC1(CN2CC[C@H](COc3ccccc3)C2)CCC1	ZINC000450715895	CG	On-Demand	Mild	CHRNA10	40	39
N#CC1(CN2CC[C@@H](COc3ccccc3)C2)CCC1	ZINC000450715898	CG	On-Demand	Mild	SIGMAR1	26	54
N#CC1(CN2CC[C@@H](COc3ccccc3)C2)CCC1	ZINC000450715898	CG	On-Demand	Mild	CHRNA10	40	39
CCC[C@@H](O)CN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450715899	FG	On-Demand	Anodyne	P2RY12	81	34
CCC[C@@H](O)CN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450715900	FG	On-Demand	Anodyne	P2RY12	81	34
CCC[C@H](O)CN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450715901	FG	On-Demand	Anodyne	P2RY12	81	34
CCC[C@H](O)CN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1	ZINC000450715902	FG	On-Demand	Anodyne	P2RY12	81	34
CCCOc1cccc(CN(C)Cc2cnc(N(C)C)nc2)c1	ZINC000450715943	DF	On-Demand	Anodyne	ACHE	0	41
CCCOc1cccc(CN(C)Cc2cnc(N(C)C)nc2)c1	ZINC000450715943	DF	On-Demand	Anodyne	SQLE	65	33
CCOC(=O)C1(CNC(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450715975	EG	On-Demand	Anodyne	PPARA	16	40
CCOC(=O)C1(CNC(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450715975	EG	On-Demand	Anodyne	SLC6A9	15	42
CCCNC(=O)c1ccc(N2CC[C@@](O)(C(F)F)C2)nc1	ZINC000450715980	CD	On-Demand	Anodyne	HDAC1	22	40
CCCNC(=O)c1ccc(N2CC[C@](O)(C(F)F)C2)nc1	ZINC000450715981	CD	On-Demand	Anodyne	HDAC1	22	40
COc1cc2nc(N3CC[C@@](O)(C(F)F)C3)nc(N)c2cc1OC	ZINC000450715988	ED	On-Demand	Anodyne	ADRA1D	16	47
COc1cc2nc(N3CC[C@@](O)(C(F)F)C3)nc(N)c2cc1OC	ZINC000450715988	ED	On-Demand	Anodyne	ADRA1B	44	53
COc1cc2nc(N3CC[C@@](O)(C(F)F)C3)nc(N)c2cc1OC	ZINC000450715988	ED	On-Demand	Anodyne	PDE3B	52	33
COc1cc2nc(N3CC[C@@](O)(C(F)F)C3)nc(N)c2cc1OC	ZINC000450715988	ED	On-Demand	Anodyne	EHMT2	44	35
COc1cc2nc(N3CC[C@](O)(C(F)F)C3)nc(N)c2cc1OC	ZINC000450715989	ED	On-Demand	Anodyne	ADRA1D	16	47
COc1cc2nc(N3CC[C@](O)(C(F)F)C3)nc(N)c2cc1OC	ZINC000450715989	ED	On-Demand	Anodyne	ADRA1B	44	53
COc1cc2nc(N3CC[C@](O)(C(F)F)C3)nc(N)c2cc1OC	ZINC000450715989	ED	On-Demand	Anodyne	PDE3B	52	33
COc1cc2nc(N3CC[C@](O)(C(F)F)C3)nc(N)c2cc1OC	ZINC000450715989	ED	On-Demand	Anodyne	EHMT2	44	35
CCS(=O)(=O)c1ccc(COc2ccc([N+](=O)[O-])c(C)c2)cc1	ZINC000450716008	EG	On-Demand	Bother	MAOB	38	42
FC1(F)CC(CN2CCC(CCCn3ccnc3)CC2)C1	ZINC000450716014	CG	On-Demand	Anodyne	CAMC	0	41
CC1(O)CC(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)C1	ZINC000450716016	DG	On-Demand	Anodyne	ATF1	55	38
CC1(O)CC(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)C1	ZINC000450716016	DG	On-Demand	Anodyne	NFKB1	51	38
CC1(O)CC(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)C1	ZINC000450716016	DG	On-Demand	Anodyne	RHOA	0	41
Cc1nc(C)n(CCCC(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)n1	ZINC000450716017	FH	On-Demand	Anodyne	ATF1	56	37
Cc1nc(C)n(CCCC(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)n1	ZINC000450716017	FH	On-Demand	Anodyne	NFKB1	52	37
COC[C@]1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCOC1	ZINC000450716024	EG	On-Demand	Anodyne	ATF1	42	36
COC[C@@]1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCOC1	ZINC000450716025	EG	On-Demand	Anodyne	ATF1	42	36
FC1(F)CC[C@@H](CSc2nnc(-c3cccc(Br)c3)o2)C1	ZINC000450716031	GK	On-Demand	Anodyne	TERT	23	44
FC1(F)CC[C@H](CSc2nnc(-c3cccc(Br)c3)o2)C1	ZINC000450716032	GK	On-Demand	Anodyne	TERT	23	44
COc1cccc(-n2cc(C(=O)N3CCN(C(=O)NC(C)(C)C)CC3)nn2)c1	ZINC000450716038	GD	On-Demand	Anodyne	DRD4	40	32
COc1cccc(-n2cc(C(=O)N3CCN(C(=O)NC(C)(C)C)CC3)nn2)c1	ZINC000450716038	GD	On-Demand	Anodyne	ESRRA	21	42
COc1cccc(-n2cc(C(=O)N3CCN(C(=O)NC(C)(C)C)CC3)nn2)c1	ZINC000450716038	GD	On-Demand	Anodyne	CCKAR	27	44
CC(=O)CCCCCOc1cc(C)ccc1[N+](=O)[O-]	ZINC000450716042	CG	On-Demand	Bother	THRA	18	43
CC(=O)CCCCCOc1cc(C)ccc1[N+](=O)[O-]	ZINC000450716042	CG	On-Demand	Bother	S1PR4	17	47
Cn1nc(-c2ccccc2)cc1C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450716058	FE	On-Demand	Anodyne	TACR3	15	50
C[C@@H](O)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450716062	CG	On-Demand	Anodyne	GSK3B	18	49
C[C@@H](O)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450716062	CG	On-Demand	Anodyne	TERT	25	47
C[C@@H](O)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450716062	CG	On-Demand	Anodyne	CYP73A16	15	48
C[C@H](O)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450716063	CG	On-Demand	Anodyne	GSK3B	18	49
C[C@H](O)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450716063	CG	On-Demand	Anodyne	TERT	25	47
C[C@H](O)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450716063	CG	On-Demand	Anodyne	CYP73A16	15	48
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)C1(C(=O)C2CC2)CC1	ZINC000450716064	EI	On-Demand	Anodyne	JUN	25	40
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)C1(C(=O)C2CC2)CC1	ZINC000450716064	EI	On-Demand	Anodyne	ATF1	59	42
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)C1(C(=O)C2CC2)CC1	ZINC000450716064	EI	On-Demand	Anodyne	NFKB1	55	42
Cc1cncn1C1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450716095	EH	On-Demand	Anodyne	L3MBTL3	42	35
Cc1cncn1C1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450716096	EH	On-Demand	Anodyne	L3MBTL3	42	35
Cc1cncn1C1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450716097	EH	On-Demand	Anodyne	L3MBTL3	42	35
Cc1cncn1C1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450716098	EH	On-Demand	Anodyne	L3MBTL3	42	35
C[C@H](O)CCCN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450716099	DI	On-Demand	Mild	MCHR1	22	46
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	DRD2	22	41
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	DRD4	39	43
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	ACHE	59	52
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	HRH1	27	48
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	DRD3	0	41
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	AVPR1B	43	35
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	KCNH2	15	42
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	HTR4	73	52
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	SSTR5	83	46
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	CCR3	44	48
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	PDK1	41	37
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	MCHR1	37	45
CCN(CC)C(=O)CCC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450716131	FI	On-Demand	Anodyne	CACNA1I	57	42
COc1cccc2c1CCN(C[C@H]1C[C@H]3CC[C@H]1O3)C2	ZINC000450716132	CF	On-Demand	Anodyne	HTR1A	19	54
COc1cccc2c1CCN(C[C@@H]1C[C@H]3CC[C@H]1O3)C2	ZINC000450716133	CF	On-Demand	Anodyne	HTR1A	19	54
COc1cc(OC)c(C[C@@H](C)Nc2nccn3c(C)nnc23)c(OC)c1	ZINC000450716143	FD	On-Demand	Anodyne	ZAP70	41	36
COc1cc(OC)c(C[C@H](C)Nc2nccn3c(C)nnc23)c(OC)c1	ZINC000450716144	FD	On-Demand	Anodyne	ZAP70	41	36
Cc1nc([C@@H](C)Sc2nnc(-c3ccccc3C)n2Cc2ccco2)no1	ZINC000450716148	GI	On-Demand	Anodyne	HCRTR2	20	41
Cc1nc([C@H](C)Sc2nnc(-c3ccccc3C)n2Cc2ccco2)no1	ZINC000450716151	GI	On-Demand	Anodyne	HCRTR2	20	41
COCCOC[C@H](O)CN[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450716165	FG	On-Demand	Anodyne	KCNJ11	40	34
COCCOC[C@H](O)CN[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450716165	FG	On-Demand	Anodyne	CYP2D26	0	42
COCCOC[C@H](O)CN[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450716167	FG	On-Demand	Anodyne	KCNJ11	40	34
COCCOC[C@H](O)CN[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450716167	FG	On-Demand	Anodyne	CYP2D26	0	42
COCCOC[C@@H](O)CN[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450716170	FG	On-Demand	Anodyne	KCNJ11	40	34
COCCOC[C@@H](O)CN[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450716170	FG	On-Demand	Anodyne	CYP2D26	0	42
COCCOC[C@@H](O)CN[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450716172	FG	On-Demand	Anodyne	KCNJ11	40	34
COCCOC[C@@H](O)CN[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450716172	FG	On-Demand	Anodyne	CYP2D26	0	42
COc1cc2c(NCCc3scnc3C)ncnc2cc1F	ZINC000450716211	DF	On-Demand	Anodyne	EGFR	34	41
COc1cc2c(NCCc3scnc3C)ncnc2cc1F	ZINC000450716211	DF	On-Demand	Anodyne	FGFR1	19	41
COc1cc2c(NCCc3scnc3C)ncnc2cc1F	ZINC000450716211	DF	On-Demand	Anodyne	FLT1	28	41
COc1cc2c(NCCc3scnc3C)ncnc2cc1F	ZINC000450716211	DF	On-Demand	Anodyne	FBP1	15	40
CN(C)CCN(C(=O)c1cc(Cl)c2ccccc2n1)C1CC1	ZINC000450716213	DG	On-Demand	Anodyne	TSPO	33	41
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCc2scnc2C)c([N+](=O)[O-])c1	ZINC000450716234	GE	On-Demand	Bother	TAAR1	19	44
COC(=O)[C@H](C)NC(=O)c1ccc(NCCc2scnc2C)c([N+](=O)[O-])c1	ZINC000450716239	GE	On-Demand	Bother	TAAR1	19	44
CC(C)OC(=O)C[C@H](NCCc1cscn1)c1ccccc1	ZINC000450716243	DG	On-Demand	Anodyne	BMP1	50	35
CC(C)OC(=O)C[C@@H](NCCc1cscn1)c1ccccc1	ZINC000450716244	DG	On-Demand	Anodyne	BMP1	50	35
CC(=O)CCCCCn1cnc2ccc(Cl)cc2c1=O	ZINC000450716245	CG	On-Demand	Anodyne	TBXAS1	17	65
CC(=O)CCCCCn1cnc2ccc(Cl)cc2c1=O	ZINC000450716245	CG	On-Demand	Anodyne	SCD1	17	47
CCOc1nc2ccc(C(=O)N(CCN(C)C)C3CC3)cc2[nH]1	ZINC000450716252	DE	On-Demand	Anodyne	MBTPS1	60	32
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H]1CC1(F)F	ZINC000450716274	EF	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H]1CC1(F)F	ZINC000450716275	EF	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@H]1CC1(F)F	ZINC000450716276	EF	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@H]1CC1(F)F	ZINC000450716277	EF	On-Demand	Anodyne	TIMP3	45	32
COc1ccc(CNC(=O)CCN[C@H](CO)c2ccc(Cl)cc2)c(OC)c1	ZINC000450716284	GF	On-Demand	Anodyne	PTGS1	0	42
COc1ccc(CNC(=O)CCN[C@H](CO)c2ccc(Cl)cc2)c(OC)c1	ZINC000450716284	GF	On-Demand	Anodyne	PTGS2	36	42
COc1ccc(CNC(=O)CCN[C@H](CO)c2ccc(Cl)cc2)c(OC)c1	ZINC000450716284	GF	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@@H](CO)c2ccc(Cl)cc2)c(OC)c1	ZINC000450716285	GF	On-Demand	Anodyne	PTGS1	0	42
COc1ccc(CNC(=O)CCN[C@@H](CO)c2ccc(Cl)cc2)c(OC)c1	ZINC000450716285	GF	On-Demand	Anodyne	PTGS2	36	42
COc1ccc(CNC(=O)CCN[C@@H](CO)c2ccc(Cl)cc2)c(OC)c1	ZINC000450716285	GF	On-Demand	Anodyne	MTNR1A	48	36
C[C@H](O)CCCN[C@@H](CO)c1ccc(F)cc1	ZINC000450716290	BD	On-Demand	Anodyne	LEF	38	40
C[C@H](O)CCCN[C@H](CO)c1ccc(F)cc1	ZINC000450716291	BD	On-Demand	Anodyne	LEF	38	40
C[C@@H](O)CCCN[C@@H](CO)c1ccc(F)cc1	ZINC000450716293	BD	On-Demand	Anodyne	LEF	38	40
C[C@@H](O)CCCN[C@H](CO)c1ccc(F)cc1	ZINC000450716295	BD	On-Demand	Anodyne	LEF	38	40
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	CHRM2	15	45
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	EPHX2	44	51
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	RBP4	80	44
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	SCD1	23	46
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	SFRP1	134	46
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	SCD	26	41
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	WNT3	90	38
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	L3MBTL1	0	42
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	L3MBTL3	54	42
CC1(O)CC(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)C1	ZINC000450716302	GF	On-Demand	Anodyne	TP53BP1	0	42
CCN(CC)c1ccc(-c2nnc(SCc3cnn[nH]3)o2)cc1	ZINC000450716324	EF	On-Demand	Anodyne	GSK3B	0	40
COc1ccc(CNC(=O)CCN2CCN(C(C)C)C(=O)C2)c(OC)c1	ZINC000450716336	FD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCN(C(C)C)C(=O)C2)c(OC)c1	ZINC000450716336	FD	On-Demand	Anodyne	HTR7	31	41
COc1ccc(CNC(=O)CCN2CCN(C(C)C)C(=O)C2)c(OC)c1	ZINC000450716336	FD	On-Demand	Anodyne	MTNR1A	45	39
Cc1cc(N2C[C@H](F)[C@H](F)C2)c2cc(F)ccc2n1	ZINC000450716338	CG	On-Demand	Anodyne	DHODH	45	36
COc1ccc2c(c1)nc(CNC(=O)CC1CC(F)(F)C1)n2C	ZINC000450716343	DF	On-Demand	Anodyne	MTNR1A	47	38
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)C[C@@H]2C(=O)OC)cc1	ZINC000450716360	GD	On-Demand	Anodyne	MMP1	23	48
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)C[C@@H]2C(=O)OC)cc1	ZINC000450716361	GD	On-Demand	Anodyne	MMP1	23	48
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)C[C@H]2C(=O)OC)cc1	ZINC000450716363	GD	On-Demand	Anodyne	MMP1	23	48
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)C[C@H]2C(=O)OC)cc1	ZINC000450716364	GD	On-Demand	Anodyne	MMP1	23	48
CCSc1cccnc1C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450716367	FH	On-Demand	Anodyne	HTR1A	19	43
CCSc1cccnc1C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450716367	FH	On-Demand	Anodyne	PRNP	63	46
Cc1sccc1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450716370	GI	On-Demand	Anodyne	EPHX2	33	40
Cc1sccc1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450716370	GI	On-Demand	Anodyne	RBP4	77	44
Cc1sccc1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450716370	GI	On-Demand	Anodyne	CCR8	47	35
Cc1sccc1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450716370	GI	On-Demand	Anodyne	SCD1	30	48
Cc1sccc1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450716370	GI	On-Demand	Anodyne	SFRP1	117	41
Cc1sccc1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450716370	GI	On-Demand	Anodyne	SCD	32	44
Cc1sccc1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450716370	GI	On-Demand	Anodyne	WNT3	79	34
CC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450716382	DH	On-Demand	Anodyne	DRD4	40	40
CC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450716382	DH	On-Demand	Anodyne	ACHE	17	44
CC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450716382	DH	On-Demand	Anodyne	HRH3	21	44
CC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450716382	DH	On-Demand	Anodyne	SIGMAR1	33	40
CC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450716382	DH	On-Demand	Anodyne	SSTR5	42	35
CC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450716382	DH	On-Demand	Anodyne	CXCR3	48	50
CC(=O)c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000450716382	DH	On-Demand	Anodyne	MCHR1	30	41
CCOC(=O)C1(CNC(=O)[C@H]2CCc3nnc(-c4cccc(C)c4)n3C2)CC1	ZINC000450716395	GE	On-Demand	Anodyne	TACR3	43	31
CCOC(=O)C1(CNC(=O)[C@@H]2CCc3nnc(-c4cccc(C)c4)n3C2)CC1	ZINC000450716399	GE	On-Demand	Anodyne	TACR3	43	31
Cc1csc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])c1	ZINC000450716401	EH	On-Demand	Bother	TAAR1	18	43
C/C=C\COc1cccc(CC(=O)N2CCn3ncnc3C2)c1	ZINC000450716403	DD	On-Demand	Anodyne	BRS3	18	41
C/C=C/COc1cccc(CC(=O)N2CCn3ncnc3C2)c1	ZINC000450716404	DD	On-Demand	Anodyne	BRS3	18	41
CCC(=O)C1(C(=O)NCc2nc3cc(OC)ccc3n2C)CC1	ZINC000450716412	DD	On-Demand	Anodyne	MTNR1A	42	37
COC[C@@H](CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000450716419	GF	On-Demand	Bother	CA2	16	42
COC[C@H](CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000450716421	GF	On-Demand	Bother	CA2	16	42
COc1ccc2nc(C)nc(N3C[C@H](F)[C@H](F)C3)c2c1	ZINC000450716435	CE	On-Demand	Anodyne	PDE3B	44	37
C[C@@H]1CCC[C@@]1(C)C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450716436	DG	On-Demand	Anodyne	PREP	19	42
C[C@H]1CCC[C@@]1(C)C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450716437	DG	On-Demand	Anodyne	PREP	19	42
C[C@@H]1CCC[C@]1(C)C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450716439	DG	On-Demand	Anodyne	PREP	19	42
C[C@H]1CCC[C@]1(C)C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1	ZINC000450716441	DG	On-Demand	Anodyne	PREP	19	42
COc1ccc(Cn2c(SCC[C@@H]3CCOC3)nc3ccccc3c2=O)cc1	ZINC000450716444	GH	On-Demand	Anodyne	NPBWR1	47	36
COc1ccc(Cn2c(SCC[C@H]3CCOC3)nc3ccccc3c2=O)cc1	ZINC000450716452	GH	On-Demand	Anodyne	NPBWR1	47	36
CCS(=O)(=O)c1ccc(CN(C)CCc2ccccc2O)cc1	ZINC000450716472	EF	On-Demand	Anodyne	RORC	53	38
C[C@H](OCCc1ccccc1)C(=O)NCC1(CO)CCCC1	ZINC000450716474	DE	On-Demand	Anodyne	TIMP3	54	33
Cc1csc(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)c1	ZINC000450716476	EH	On-Demand	Anodyne	BDKRB1	18	41
Cc1csc(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)c1	ZINC000450716476	EH	On-Demand	Anodyne	L3MBTL3	49	37
Cc1csc(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)c1	ZINC000450716476	EH	On-Demand	Anodyne	TRPC6	45	41
Cc1csc(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)c1	ZINC000450716476	EH	On-Demand	Anodyne	TRPC3	25	41
C[C@@H](OCCc1ccccc1)C(=O)NCC1(CO)CCCC1	ZINC000450716477	DE	On-Demand	Anodyne	TIMP3	54	33
CC(C)(C)c1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450716487	EJ	On-Demand	Anodyne	TYMS	0	44
CO[C@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716491	FG	On-Demand	Anodyne	ACHE	25	45
CO[C@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716491	FG	On-Demand	Anodyne	SLC6A3	19	42
CO[C@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716491	FG	On-Demand	Anodyne	SIGMAR1	30	40
CO[C@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716491	FG	On-Demand	Anodyne	NPY1R	42	36
CO[C@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716491	FG	On-Demand	Anodyne	ABCB1	0	41
CO[C@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716491	FG	On-Demand	Anodyne	CYP2J2	44	31
CO[C@@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716492	FG	On-Demand	Anodyne	ACHE	25	45
CO[C@@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716492	FG	On-Demand	Anodyne	SLC6A3	19	42
CO[C@@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716492	FG	On-Demand	Anodyne	SIGMAR1	30	40
CO[C@@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716492	FG	On-Demand	Anodyne	NPY1R	42	36
CO[C@@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716492	FG	On-Demand	Anodyne	ABCB1	0	41
CO[C@@H](Cc1ccccc1)CN1CCC(CCCN2CCOCC2)CC1	ZINC000450716492	FG	On-Demand	Anodyne	CYP2J2	44	31
CC(C)(C)c1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450716498	EJ	On-Demand	Anodyne	TYMS	0	44
Cc1cccc(-c2nnc(S[C@H]3C[C@H](C)CCC3=O)n2Cc2ccco2)c1	ZINC000450716500	GJ	On-Demand	Anodyne	HCRTR2	17	44
Cc1cccc(-c2nnc(S[C@@H]3C[C@H](C)CCC3=O)n2Cc2ccco2)c1	ZINC000450716502	GJ	On-Demand	Anodyne	HCRTR2	17	44
Cc1cccc(-c2nnc(S[C@@H]3C[C@@H](C)CCC3=O)n2Cc2ccco2)c1	ZINC000450716504	GJ	On-Demand	Anodyne	HCRTR2	17	44
Cc1cccc(-c2nnc(S[C@H]3C[C@@H](C)CCC3=O)n2Cc2ccco2)c1	ZINC000450716506	GJ	On-Demand	Anodyne	HCRTR2	17	44
CCN(CC)c1ccc(-c2nnc(SCc3nnc(C4CC4)s3)o2)cc1	ZINC000450716510	GJ	On-Demand	Anodyne	GSK3A	44	35
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@@H]1CCc2nncn2C1	ZINC000450716518	FD	On-Demand	Anodyne	GSK3A	20	44
O=C(Nc1n[nH]c(-c2ccc(O)c(Cl)c2)n1)[C@H]1CCc2nncn2C1	ZINC000450716519	FD	On-Demand	Anodyne	GSK3A	20	44
Cc1ccc2oc(N3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc2c1	ZINC000450716537	CG	On-Demand	Anodyne	HTR3A	16	56
Cc1ccc2oc(N3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc2c1	ZINC000450716538	CG	On-Demand	Anodyne	HTR3A	16	56
Cc1ccc2oc(N3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc2c1	ZINC000450716539	CG	On-Demand	Anodyne	HTR3A	16	56
Cc1ccc2oc(N3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc2c1	ZINC000450716540	CG	On-Demand	Anodyne	HTR3A	16	56
O[C@@]1(C(F)F)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450716541	EH	On-Demand	Anodyne	ADRB3	18	51
O[C@]1(C(F)F)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450716542	EH	On-Demand	Anodyne	ADRB3	18	51
COc1cc2c(N3CC[C@@](O)(C(F)F)C3)ccnc2cc1F	ZINC000450716548	DF	On-Demand	Anodyne	PDE3A	40	32
COc1cc2c(N3CC[C@@](O)(C(F)F)C3)ccnc2cc1F	ZINC000450716548	DF	On-Demand	Anodyne	PDE3B	58	32
COc1cc2c(N3CC[C@](O)(C(F)F)C3)ccnc2cc1F	ZINC000450716549	DF	On-Demand	Anodyne	PDE3A	40	32
COc1cc2c(N3CC[C@](O)(C(F)F)C3)ccnc2cc1F	ZINC000450716549	DF	On-Demand	Anodyne	PDE3B	58	32
CC(=O)N[C@@H](C)C1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450716585	FE	On-Demand	Anodyne	P2RY12	68	32
CC(=O)N[C@H](C)C1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450716586	FE	On-Demand	Anodyne	P2RY12	68	32
CC(=O)N[C@H](C)C1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450716595	GE	On-Demand	Bother	CACNA1D	45	31
CC(=O)N[C@@H](C)C1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450716596	GE	On-Demand	Bother	CACNA1D	45	31
CCC(=O)C1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CC1	ZINC000450716600	DI	On-Demand	Anodyne	JUN	26	45
CCC(=O)C1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CC1	ZINC000450716600	DI	On-Demand	Anodyne	ATF1	64	42
CCC(=O)C1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CC1	ZINC000450716600	DI	On-Demand	Anodyne	NFKB1	59	42
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@H](C)OCc2ccc(F)cc2)CC1	ZINC000450716618	FE	On-Demand	Anodyne	CCR1	31	41
CC(=O)N[C@H](C)C1CCN(C(=O)[C@H](C)OCc2ccc(F)cc2)CC1	ZINC000450716619	FE	On-Demand	Anodyne	CCR1	31	41
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)CC1	ZINC000450716620	FE	On-Demand	Anodyne	CCR1	31	41
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)CC1	ZINC000450716621	FE	On-Demand	Anodyne	CCR1	31	41
CN(CCN1C[C@H]2[C@@H](O)CC[C@H]2C1)Cc1ccccc1	ZINC000450716628	CD	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCN1C[C@H]2[C@H](O)CC[C@H]2C1)Cc1ccccc1	ZINC000450716629	CD	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCN1C[C@@H]2CC[C@H](O)[C@H]2C1)Cc1ccccc1	ZINC000450716630	CD	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCN1C[C@@H]2CC[C@@H](O)[C@H]2C1)Cc1ccccc1	ZINC000450716631	CD	On-Demand	Anodyne	SIGMAR1	26	43
CN(Cc1ccccc1)C1(CNc2ncc([N+](=O)[O-])c(N)n2)CCC1	ZINC000450716637	EE	On-Demand	Bother	PRKCQ	46	41
C=C(C)CCN=c1ccc(C(=O)N2CCC(C)CC2)c[nH]1	ZINC000450716650	CF	On-Demand	Mild	L3MBTL3	58	36
COC(=O)C[C@@H](NC(=O)Cn1ccc(C)n1)c1ccc2ccccc2c1	ZINC000450716661	FF	On-Demand	Anodyne	CYP74A	0	40
COC(=O)C[C@H](NC(=O)Cn1ccc(C)n1)c1ccc2ccccc2c1	ZINC000450716662	FF	On-Demand	Anodyne	CYP74A	0	40
Cc1csc(NC2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)n1	ZINC000450716683	GI	On-Demand	Anodyne	TRPC6	70	42
Cc1csc(NC2CCN(C(=O)c3cc(Cl)c4ccccc4n3)CC2)n1	ZINC000450716683	GI	On-Demand	Anodyne	TRPC3	51	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N(CCN(C)C)C1CC1	ZINC000450716684	FF	On-Demand	Anodyne	UTS2	45	36
CSc1cccc(C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c1	ZINC000450716685	DF	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c1	ZINC000450716685	DF	On-Demand	Anodyne	L3MBTL3	50	42
CSc1cccc(C(=O)N2CCC([C@H](C)NC(C)=O)CC2)c1	ZINC000450716686	DF	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CCC([C@H](C)NC(C)=O)CC2)c1	ZINC000450716686	DF	On-Demand	Anodyne	L3MBTL3	50	42
COc1ccc(-c2ccnc(N3C[C@H](F)[C@H](F)C3)n2)cc1	ZINC000450716697	CF	On-Demand	Anodyne	DKK1	0	44
CC(=O)CCCCCn1nnc(-c2cccc(F)c2)n1	ZINC000450716721	CF	On-Demand	Anodyne	SCARB1	22	45
COc1cc(OC)c(C[C@@H](C)Nc2ccc(S(C)(=O)=O)cc2)c(OC)c1	ZINC000450716722	GG	On-Demand	Anodyne	PTGS2	16	44
COc1cc(OC)c(C[C@H](C)Nc2ccc(S(C)(=O)=O)cc2)c(OC)c1	ZINC000450716723	GG	On-Demand	Anodyne	PTGS2	16	44
CC(=O)c1cccc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)c1	ZINC000450716726	FI	On-Demand	Anodyne	RBP4	79	40
CC(=O)c1cccc(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c1	ZINC000450716727	FI	On-Demand	Anodyne	RBP4	79	40
COC(=O)C[C@H](NC(=O)c1cc(C)n(C(C)C)n1)c1ccc2ccccc2c1	ZINC000450716729	GH	On-Demand	Anodyne	UTS2	37	41
COC(=O)C[C@H](NC(=O)c1cc(C)n(C(C)C)n1)c1ccc2ccccc2c1	ZINC000450716729	GH	On-Demand	Anodyne	CTSA	59	37
COC(=O)C[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)c1ccc2ccccc2c1	ZINC000450716730	GH	On-Demand	Anodyne	UTS2	37	41
COC(=O)C[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)c1ccc2ccccc2c1	ZINC000450716730	GH	On-Demand	Anodyne	CTSA	59	37
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc2n(n1)CCC2	ZINC000450716752	FE	On-Demand	Anodyne	P2RY12	149	39
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc2n(n1)CCC2	ZINC000450716752	FE	On-Demand	Anodyne	MC4R	39	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc2n(n1)CCC2	ZINC000450716753	FE	On-Demand	Anodyne	P2RY12	149	39
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc2n(n1)CCC2	ZINC000450716753	FE	On-Demand	Anodyne	MC4R	39	40
COc1ccc(CNC(=O)CCN[C@H](CO)C(C)(C)C)c(OC)c1	ZINC000450716754	ED	On-Demand	Anodyne	MTNR1A	59	38
COc1ccc(CNC(=O)CCN[C@H](CO)C(C)(C)C)c(OC)c1	ZINC000450716754	ED	On-Demand	Anodyne	MTNR1B	44	37
CCOc1nc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)cc2[nH]1	ZINC000450716757	FD	On-Demand	Anodyne	DRD4	40	30
CCOc1nc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)cc2[nH]1	ZINC000450716757	FD	On-Demand	Anodyne	PLD1	62	37
CCOc1nc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)cc2[nH]1	ZINC000450716757	FD	On-Demand	Anodyne	PRKD1	35	40
CCOc1nc2ccc(C(=O)N[C@@H](C)CCN3CCN(C)CC3)cc2[nH]1	ZINC000450716757	FD	On-Demand	Anodyne	PLD2	44	37
CCOc1nc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)cc2[nH]1	ZINC000450716758	FD	On-Demand	Anodyne	DRD4	40	30
CCOc1nc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)cc2[nH]1	ZINC000450716758	FD	On-Demand	Anodyne	PLD1	62	37
CCOc1nc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)cc2[nH]1	ZINC000450716758	FD	On-Demand	Anodyne	PRKD1	35	40
CCOc1nc2ccc(C(=O)N[C@H](C)CCN3CCN(C)CC3)cc2[nH]1	ZINC000450716758	FD	On-Demand	Anodyne	PLD2	44	37
Cc1cc2ncc(C(=O)N(CCN(C)C)C3CC3)c(C)n2n1	ZINC000450716774	DD	On-Demand	Anodyne	DPP9	21	42
Cc1csc(NC2CCN(C(=O)[C@@H]3C[C@@]3(C)c3ccccc3)CC2)n1	ZINC000450716787	FH	On-Demand	Anodyne	TRPC6	44	33
COC(=O)c1coc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450716800	FG	On-Demand	Anodyne	RBP4	64	34
CC(=O)[C@@](C)(O)CN1CCC(Oc2cc(C)ccn2)CC1	ZINC000450716856	CD	On-Demand	Anodyne	HCRTR1	18	41
CC(=O)[C@@](C)(O)CN1CCC(Oc2cc(C)ccn2)CC1	ZINC000450716856	CD	On-Demand	Anodyne	HCRTR2	18	41
CC(=O)[C@](C)(O)CN1CCC(Oc2cc(C)ccn2)CC1	ZINC000450716857	CD	On-Demand	Anodyne	HCRTR1	18	41
CC(=O)[C@](C)(O)CN1CCC(Oc2cc(C)ccn2)CC1	ZINC000450716857	CD	On-Demand	Anodyne	HCRTR2	18	41
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450716868	EH	On-Demand	Anodyne	ACHE	53	57
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450716868	EH	On-Demand	Anodyne	OPRD1	20	47
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450716868	EH	On-Demand	Anodyne	SIGMAR1	40	46
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450716868	EH	On-Demand	Anodyne	SSTR5	45	36
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450716868	EH	On-Demand	Anodyne	CCR3	26	44
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450716868	EH	On-Demand	Anodyne	MCHR1	35	42
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450716868	EH	On-Demand	Anodyne	CACNA1I	63	42
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450716868	EH	On-Demand	Anodyne	CYP2J2	48	36
CCOC(=O)[C@@H](CO)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450716882	DD	On-Demand	Anodyne	P2RY12	65	33
CCOC(=O)[C@@H](CO)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450716882	DD	On-Demand	Anodyne	TSPO	23	40
CCOC(=O)[C@@H](CO)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450716882	DD	On-Demand	Anodyne	CCR3	0	47
CCOC(=O)[C@@H](CO)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450716882	DD	On-Demand	Anodyne	TACR3	65	41
CCS(=O)(=O)c1ccc(CSc2nnc(-c3cc(C)cc(C)c3)o2)cc1	ZINC000450716884	GI	On-Demand	Anodyne	GSK3B	24	45
CCS(=O)(=O)c1ccc(CSc2nnc(-c3cc(C)cc(C)c3)o2)cc1	ZINC000450716884	GI	On-Demand	Anodyne	GSK3A	59	44
CCS(=O)(=O)c1ccc(CSc2nnc(-c3cc(C)cc(C)c3)o2)cc1	ZINC000450716884	GI	On-Demand	Anodyne	TERT	28	52
CCOC(=O)[C@H](CO)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450716885	DD	On-Demand	Anodyne	P2RY12	65	33
CCOC(=O)[C@H](CO)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450716885	DD	On-Demand	Anodyne	TSPO	23	40
CCOC(=O)[C@H](CO)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450716885	DD	On-Demand	Anodyne	CCR3	0	47
CCOC(=O)[C@H](CO)NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450716885	DD	On-Demand	Anodyne	TACR3	65	41
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	DRD4	37	41
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	ACHE	25	49
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	LTA4H	18	40
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	HRH3	15	47
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	SIGMAR1	36	45
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	SLC18A3	18	41
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	MLNR	52	38
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	MCHR1	23	41
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	CACNA1I	50	36
CC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)cc1	ZINC000450716893	CH	On-Demand	Anodyne	CYP2J2	54	39
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	DRD4	37	41
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	ACHE	25	49
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	LTA4H	18	40
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	HRH3	15	47
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	SIGMAR1	36	45
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	SLC18A3	18	41
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	MLNR	52	38
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	MCHR1	23	41
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	CACNA1I	50	36
CC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)cc1	ZINC000450716894	CH	On-Demand	Anodyne	CYP2J2	54	39
CCOC(=O)C1(CNC(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450716898	GE	On-Demand	Mild	TRPV4	40	30
COC(=O)C1(CN2CC[C@H](c3cccc(C)c3)C2)CC1	ZINC000450716918	CF	On-Demand	Anodyne	DRD4	0	46
COC(=O)C1(CN2CC[C@H](c3cccc(C)c3)C2)CC1	ZINC000450716918	CF	On-Demand	Anodyne	MGEA5	25	45
COC(=O)C1(CN2CC[C@@H](c3cccc(C)c3)C2)CC1	ZINC000450716920	CF	On-Demand	Anodyne	DRD4	0	46
COC(=O)C1(CN2CC[C@@H](c3cccc(C)c3)C2)CC1	ZINC000450716920	CF	On-Demand	Anodyne	MGEA5	25	45
C/C=C\C[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450716931	CE	On-Demand	Anodyne	KLK3	41	32
C/C=C\C[C@H](CO)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450716931	CE	On-Demand	Anodyne	CAPN2	53	33
C/C=C\C[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450716932	CE	On-Demand	Anodyne	KLK3	41	32
C/C=C\C[C@H](CO)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450716932	CE	On-Demand	Anodyne	CAPN2	53	33
COC(=O)c1coc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450716953	FG	On-Demand	Anodyne	CCR2	48	41
COC(=O)c1coc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450716953	FG	On-Demand	Anodyne	MCHR1	23	44
CC1(C#N)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450716954	DG	On-Demand	Mild	SIGMAR1	40	45
COC(=O)c1coc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450716955	FG	On-Demand	Anodyne	CCR2	48	41
COC(=O)c1coc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450716955	FG	On-Demand	Anodyne	MCHR1	23	44
c1ccc(CCn2ccc(CN3CCC(CCCN4CCOCC4)CC3)n2)cc1	ZINC000450716962	GG	On-Demand	Anodyne	ACHE	43	45
c1ccc(CCn2ccc(CN3CCC(CCCN4CCOCC4)CC3)n2)cc1	ZINC000450716962	GG	On-Demand	Anodyne	GRIN2B	21	40
c1ccc(CCn2ccc(CN3CCC(CCCN4CCOCC4)CC3)n2)cc1	ZINC000450716962	GG	On-Demand	Anodyne	SIGMAR1	47	44
C=CCOc1ccc(CC(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450717001	GH	On-Demand	Mild	GPR183	0	40
Clc1ccc2c(NC[C@H]3CC34CCOCC4)ccnc2c1	ZINC000450717007	DI	On-Demand	Anodyne	HRP1_PLAFA	119	43
Clc1ccc2c(NC[C@H]3CC34CCOCC4)ccnc2c1	ZINC000450717007	DI	On-Demand	Anodyne	HNMT	69	46
Clc1ccc2c(NC[C@H]3CC34CCOCC4)ccnc2c1	ZINC000450717007	DI	On-Demand	Anodyne	BOTA	39	50
Clc1ccc2c(NC[C@H]3CC34CCOCC4)ccnc2c1	ZINC000450717007	DI	On-Demand	Anodyne	RBP_CHICK	0	40
Clc1ccc2c(NC[C@@H]3CC34CCOCC4)ccnc2c1	ZINC000450717009	DI	On-Demand	Anodyne	HRP1_PLAFA	119	43
Clc1ccc2c(NC[C@@H]3CC34CCOCC4)ccnc2c1	ZINC000450717009	DI	On-Demand	Anodyne	HNMT	69	46
Clc1ccc2c(NC[C@@H]3CC34CCOCC4)ccnc2c1	ZINC000450717009	DI	On-Demand	Anodyne	BOTA	39	50
Clc1ccc2c(NC[C@@H]3CC34CCOCC4)ccnc2c1	ZINC000450717009	DI	On-Demand	Anodyne	RBP_CHICK	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCn2ncnc2C1	ZINC000450717014	DE	On-Demand	Anodyne	P2RX7	42	36
COc1cc(CN2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717016	CF	On-Demand	Anodyne	DRD4	34	41
COc1cc(CN2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717016	CF	On-Demand	Anodyne	DRD3	0	41
COc1cc(CN2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717016	CF	On-Demand	Anodyne	SSTR5	60	40
COc1cc(CN2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717016	CF	On-Demand	Anodyne	CCR1	28	41
COc1cc(CN2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717016	CF	On-Demand	Anodyne	CCR3	26	41
COc1cc(CN2CC[C@@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717016	CF	On-Demand	Anodyne	UTS2R	32	40
COc1cc(CN2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717017	CF	On-Demand	Anodyne	DRD4	34	41
COc1cc(CN2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717017	CF	On-Demand	Anodyne	DRD3	0	41
COc1cc(CN2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717017	CF	On-Demand	Anodyne	SSTR5	60	40
COc1cc(CN2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717017	CF	On-Demand	Anodyne	CCR1	28	41
COc1cc(CN2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717017	CF	On-Demand	Anodyne	CCR3	26	41
COc1cc(CN2CC[C@H]([C@H](C)O)C2)ccc1Cl	ZINC000450717017	CF	On-Demand	Anodyne	UTS2R	32	40
COc1cc(CN2CC[C@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717019	CF	On-Demand	Anodyne	DRD4	34	41
COc1cc(CN2CC[C@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717019	CF	On-Demand	Anodyne	DRD3	0	41
COc1cc(CN2CC[C@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717019	CF	On-Demand	Anodyne	SSTR5	60	40
COc1cc(CN2CC[C@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717019	CF	On-Demand	Anodyne	CCR1	28	41
COc1cc(CN2CC[C@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717019	CF	On-Demand	Anodyne	CCR3	26	41
COc1cc(CN2CC[C@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717019	CF	On-Demand	Anodyne	UTS2R	32	40
COc1cc(CN2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717021	CF	On-Demand	Anodyne	DRD4	34	41
COc1cc(CN2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717021	CF	On-Demand	Anodyne	DRD3	0	41
COc1cc(CN2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717021	CF	On-Demand	Anodyne	SSTR5	60	40
COc1cc(CN2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717021	CF	On-Demand	Anodyne	CCR1	28	41
COc1cc(CN2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717021	CF	On-Demand	Anodyne	CCR3	26	41
COc1cc(CN2CC[C@@H]([C@@H](C)O)C2)ccc1Cl	ZINC000450717021	CF	On-Demand	Anodyne	UTS2R	32	40
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450717028	GI	On-Demand	Anodyne	MC4R	22	40
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450717028	GI	On-Demand	Anodyne	CCR5	44	36
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450717032	GI	On-Demand	Anodyne	MC4R	22	40
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450717032	GI	On-Demand	Anodyne	CCR5	44	36
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450717034	GI	On-Demand	Anodyne	MC4R	22	40
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450717034	GI	On-Demand	Anodyne	CCR5	44	36
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450717037	GI	On-Demand	Anodyne	MC4R	22	40
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450717037	GI	On-Demand	Anodyne	CCR5	44	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450717055	FG	On-Demand	Anodyne	BRD4	16	45
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	DRD2	35	59
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	DRD1	25	56
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	DRD4	35	56
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	HTR2A	41	56
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	HTR2C	25	60
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	ADRA1A	15	56
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	ADRA1B	15	56
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	DRD3	18	56
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	ERG2	24	56
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	HTR7	19	56
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	SIGMAR1	19	59
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	PLD1	46	38
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	SLC18A3	0	47
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	MCHR1	15	47
O=C(CCCN1CCC(n2cc(Cl)cn2)CC1)c1ccc(F)cc1	ZINC000450717062	EH	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)c1coc(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)n1	ZINC000450717079	FG	On-Demand	Anodyne	RBP4	64	34
CCOc1cc(C(=O)N[C@@H](CC(=O)OC)c2ccc3ccccc3c2)on1	ZINC000450717101	FG	On-Demand	Anodyne	UTS2	33	40
CCOc1cc(C(=O)N[C@H](CC(=O)OC)c2ccc3ccccc3c2)on1	ZINC000450717102	FG	On-Demand	Anodyne	UTS2	33	40
CC(C)CCCC(=O)N[C@@H](C)CCN1CCN(C)CC1	ZINC000450717108	CD	On-Demand	Anodyne	NOD1	47	34
CC(C)CCCC(=O)N[C@H](C)CCN1CCN(C)CC1	ZINC000450717109	CD	On-Demand	Anodyne	NOD1	47	34
Cc1nnc2c3ccccc3c(N3C[C@H](F)[C@H](F)C3)nn12	ZINC000450717119	CE	On-Demand	Anodyne	CREBBP	46	37
Cc1nnc2c3ccccc3c(N3C[C@H](F)[C@H](F)C3)nn12	ZINC000450717119	CE	On-Demand	Anodyne	BRD9	59	39
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450717126	GG	On-Demand	Anodyne	P2RY12	82	35
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450717126	GG	On-Demand	Anodyne	MC4R	30	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450717127	GG	On-Demand	Anodyne	P2RY12	82	35
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450717127	GG	On-Demand	Anodyne	MC4R	30	40
CC(=O)c1ccc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)cc1	ZINC000450717128	FI	On-Demand	Anodyne	DRD4	29	43
CC(=O)c1ccc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)cc1	ZINC000450717128	FI	On-Demand	Anodyne	RBP4	80	39
CC(=O)c1ccc(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)cc1	ZINC000450717129	FI	On-Demand	Anodyne	DRD4	29	43
CC(=O)c1ccc(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)cc1	ZINC000450717129	FI	On-Demand	Anodyne	RBP4	80	39
CC(=O)N[C@@H](C)C1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450717153	FE	On-Demand	Anodyne	L3MBTL3	58	35
CC(=O)N[C@H](C)C1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450717156	FE	On-Demand	Anodyne	L3MBTL3	58	35
C=C(C)CCNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450717160	FD	On-Demand	Mild	BCL2L1	58	33
C=C(C)CCNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450717160	FD	On-Demand	Mild	BCL2	40	35
C/C=C/COc1cccc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450717171	FF	On-Demand	Anodyne	GPR183	0	41
C/C=C\COc1cccc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450717173	FF	On-Demand	Anodyne	GPR183	0	41
COCc1cc(NCC2(N(C)Cc3ccccc3)CCC2)n2ncnc2n1	ZINC000450717175	FF	On-Demand	Anodyne	DHOD	0	41
CCC[C@@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450717177	FF	On-Demand	Anodyne	SCN9A	0	42
CCC[C@@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450717177	FF	On-Demand	Anodyne	RBP4	50	31
CCC[C@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450717179	FF	On-Demand	Anodyne	SCN9A	0	42
CCC[C@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450717179	FF	On-Demand	Anodyne	RBP4	50	31
CCC[C@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450717181	FF	On-Demand	Anodyne	SCN9A	0	42
CCC[C@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450717181	FF	On-Demand	Anodyne	RBP4	50	31
CCC[C@@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450717182	FF	On-Demand	Anodyne	SCN9A	0	42
CCC[C@@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450717182	FF	On-Demand	Anodyne	RBP4	50	31
CC[C@@](C)(CNc1cc(-c2ccccc2)nc2ncnn12)OC	ZINC000450717188	DG	On-Demand	Anodyne	DHOD	0	42
CC[C@](C)(CNc1cc(-c2ccccc2)nc2ncnn12)OC	ZINC000450717189	DG	On-Demand	Anodyne	DHOD	0	42
CCOc1ccccc1-c1nnc(SCCC(C)(F)F)o1	ZINC000450717205	DI	On-Demand	Anodyne	ALOX15	61	35
Cc1nc(C(C)C)oc1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450717211	EK	On-Demand	Anodyne	GSK3B	17	48
Cc1nc(C(C)C)oc1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450717211	EK	On-Demand	Anodyne	GSK3A	48	38
Cc1nc(C(C)C)oc1CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450717211	EK	On-Demand	Anodyne	TERT	26	47
CC[C@@](C)(CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])OC	ZINC000450717273	DF	On-Demand	Bother	TAAR1	19	48
CC[C@](C)(CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])OC	ZINC000450717274	DF	On-Demand	Bother	TAAR1	19	48
CC(C)N1CCCC[C@@H]1CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450717276	EE	On-Demand	Anodyne	GHRL	60	35
CC(C)N1CCCC[C@H]1CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450717277	EE	On-Demand	Anodyne	GHRL	60	35
CC(C)N1CCCC[C@H]1CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450717278	EE	On-Demand	Anodyne	GHRL	60	35
COC(=O)c1coc(CN2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450717282	DE	On-Demand	Anodyne	SIGMAR1	23	47
COC(=O)c1coc(CN2CC[C@@H](COc3ccccc3)C2)n1	ZINC000450717282	DE	On-Demand	Anodyne	CPT1A	47	34
COC(=O)c1coc(CN2CC[C@H](COc3ccccc3)C2)n1	ZINC000450717283	DE	On-Demand	Anodyne	SIGMAR1	23	47
COC(=O)c1coc(CN2CC[C@H](COc3ccccc3)C2)n1	ZINC000450717283	DE	On-Demand	Anodyne	CPT1A	47	34
CC[S@](=O)CC(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450717294	EE	On-Demand	Anodyne	UTS2	33	41
CC[S@@](=O)CC(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450717295	EE	On-Demand	Anodyne	UTS2	33	41
CCN1CCN(c2cccc(NC(=O)Cc3cc(C)ccc3F)c2)CC1	ZINC000450717310	FG	On-Demand	Anodyne	HTR1A	21	51
CCS(=O)(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450717311	GF	On-Demand	Anodyne	ACHE	39	44
CCS(=O)(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450717311	GF	On-Demand	Anodyne	HRH3	18	43
CCS(=O)(=O)c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000450717311	GF	On-Demand	Anodyne	SIGMAR1	24	44
CN(CCN1CCOC[C@@H]1c1noc(-c2cnn(C)c2)n1)Cc1ccccc1	ZINC000450717320	GD	On-Demand	Anodyne	ALOX5AP	42	31
CN(CCN1CCOC[C@H]1c1noc(-c2cnn(C)c2)n1)Cc1ccccc1	ZINC000450717321	GD	On-Demand	Anodyne	ALOX5AP	42	31
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(CO)CCCC3)cc2)c1	ZINC000450717322	GG	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(CO)CCCC3)cc2)c1	ZINC000450717322	GG	On-Demand	Anodyne	MMP13	15	49
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(CO)CCCC3)cc2)c1	ZINC000450717322	GG	On-Demand	Anodyne	E1	0	46
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(CO)CCCC3)cc2)c1	ZINC000450717322	GG	On-Demand	Anodyne	ACAT	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(CO)CCCC3)cc2)c1	ZINC000450717322	GG	On-Demand	Anodyne	KCNK3	55	38
COc1ccc(-c2nnc(N3C[C@H](F)[C@H](F)C3)c3ccccc23)cc1	ZINC000450717328	EH	On-Demand	Anodyne	SMO	49	57
CCc1cc(CCCN2CC[C@H](COc3ccccc3)C2)on1	ZINC000450717329	DH	On-Demand	Anodyne	SIGMAR1	30	44
CCc1cc(CCCN2CC[C@H](COc3ccccc3)C2)on1	ZINC000450717329	DH	On-Demand	Anodyne	CHRNA10	47	38
CCc1cc(CCCN2CC[C@@H](COc3ccccc3)C2)on1	ZINC000450717330	DH	On-Demand	Anodyne	SIGMAR1	30	44
CCc1cc(CCCN2CC[C@@H](COc3ccccc3)C2)on1	ZINC000450717330	DH	On-Demand	Anodyne	CHRNA10	47	38
O=S(=O)(NCC1CC1)c1ccc(N2C[C@H](F)[C@H](F)C2)nc1	ZINC000450717331	DD	On-Demand	Anodyne	NPY2R	55	38
O=C(NCC1(CO)CCCC1)c1ccn(CCn2cccn2)n1	ZINC000450717334	DD	On-Demand	Anodyne	HCN1	54	33
O=C(NCC1(CO)CCCC1)c1ccn(CCn2cccn2)n1	ZINC000450717334	DD	On-Demand	Anodyne	HCN4	51	33
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450717336	EF	On-Demand	Anodyne	HTR1A	31	49
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450717336	EF	On-Demand	Anodyne	HTR2A	18	40
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450717336	EF	On-Demand	Anodyne	HTR7	48	38
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450717336	EF	On-Demand	Anodyne	PRNP	24	40
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450717336	EF	On-Demand	Anodyne	HDAC10	31	43
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450717336	EF	On-Demand	Anodyne	HDAC2	21	43
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450717336	EF	On-Demand	Anodyne	HDAC3	39	43
CCN1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450717336	EF	On-Demand	Anodyne	HDAC6	31	43
COC(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450717337	ED	On-Demand	Anodyne	AGTR2	43	38
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450717338	ED	On-Demand	Anodyne	AGTR2	43	38
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450717339	ED	On-Demand	Anodyne	AGTR2	43	38
COC(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)[C@@H](C(=O)OC)C1	ZINC000450717340	ED	On-Demand	Anodyne	AGTR2	43	38
COC(=O)c1csc(CN2CCC(CCCN3CCOCC3)CC2)n1	ZINC000450717342	FE	On-Demand	Anodyne	HTR4	40	38
COc1cc(OC)c(C[C@@H](C)Nc2ncnc3c2ncn3C2CC2)c(OC)c1	ZINC000450717347	GG	On-Demand	Anodyne	ADORA1	39	42
COc1cc(OC)c(C[C@@H](C)Nc2ncnc3c2ncn3C2CC2)c(OC)c1	ZINC000450717347	GG	On-Demand	Anodyne	ADORA3	24	42
COc1cc(OC)c(C[C@H](C)Nc2ncnc3c2ncn3C2CC2)c(OC)c1	ZINC000450717348	GG	On-Demand	Anodyne	ADORA1	39	42
COc1cc(OC)c(C[C@H](C)Nc2ncnc3c2ncn3C2CC2)c(OC)c1	ZINC000450717348	GG	On-Demand	Anodyne	ADORA3	24	42
CCOC(=O)COCCNc1ncnc2c(OC)cc(OC)cc12	ZINC000450717352	ED	On-Demand	Anodyne	PDE6A	52	42
Cc1csc(NC2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)n1	ZINC000450717359	FH	On-Demand	Anodyne	GHRHR	52	32
Cc1csc(NC2CCN(C(=O)[C@H](C)OCCc3ccccc3)CC2)n1	ZINC000450717359	FH	On-Demand	Anodyne	P2RY12	65	34
Cc1csc(NC2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)n1	ZINC000450717360	FH	On-Demand	Anodyne	GHRHR	52	32
Cc1csc(NC2CCN(C(=O)[C@@H](C)OCCc3ccccc3)CC2)n1	ZINC000450717360	FH	On-Demand	Anodyne	P2RY12	65	34
CC(=O)c1ccc(CN2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000450717389	FI	On-Demand	Anodyne	DRD4	20	49
CC(=O)c1ccc(CN2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000450717390	FI	On-Demand	Anodyne	DRD4	20	49
C[C@H]1CC[C@@]2(CCN(C[C@H](O)Cc3ccccc3)C2)C1	ZINC000450717418	CG	On-Demand	Anodyne	VACHT_TETCF	0	46
C[C@H]1CC[C@]2(CCN(C[C@H](O)Cc3ccccc3)C2)C1	ZINC000450717419	CG	On-Demand	Anodyne	VACHT_TETCF	0	46
Cc1cccc(C)c1-n1nnnc1SCCN(C)Cc1ccccc1	ZINC000450717423	FH	On-Demand	Anodyne	CELA2A	26	40
CC(=O)c1cccc(CN2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000450717435	FI	On-Demand	Anodyne	DRD4	17	44
CC(=O)c1cccc(CN2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000450717436	FI	On-Demand	Anodyne	DRD4	17	44
Cc1cccc(C)c1-n1nnnc1S[C@H](C)C(=O)Nc1nccs1	ZINC000450717445	FF	On-Demand	Anodyne	MAP1	96	35
COC(=O)c1cnc(NC[C@@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000450717457	EF	On-Demand	Bother	PRKCQ	46	35
COC(=O)c1cnc(NC[C@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000450717458	EF	On-Demand	Bother	PRKCQ	46	35
Cc1csc(CNc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])c1	ZINC000450717464	GF	On-Demand	Bother	DDIT3	0	40
O=C(CC1(O)CCC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450717470	GF	On-Demand	Anodyne	CCR2	32	40
O=C(CC1(O)CCC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450717470	GF	On-Demand	Anodyne	RBP4	82	39
O=C(CC1(O)CCC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450717470	GF	On-Demand	Anodyne	SCD1	25	42
O=C(CC1(O)CCC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450717470	GF	On-Demand	Anodyne	SFRP1	115	40
O=C(CC1(O)CCC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450717470	GF	On-Demand	Anodyne	SCD	28	42
O=C(CC1(O)CCC1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450717470	GF	On-Demand	Anodyne	WNT3	80	34
C=CCc1cc([N+](=O)[O-])ccc1OCC[C@H](C)O	ZINC000450717471	CE	On-Demand	Mild	CYP19A1	15	40
C=CCc1cc([N+](=O)[O-])ccc1OCC[C@@H](C)O	ZINC000450717472	CE	On-Demand	Mild	CYP19A1	15	40
CC(C)N1CCCC[C@@H]1CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450717478	EE	On-Demand	Anodyne	GHRL	60	35
Cc1ccc(I)cc1NC(=O)CCCC(=O)C1CC1	ZINC000450717481	FH	On-Demand	Anodyne	LDLR	0	42
Cc1cccc(C)c1-n1nnnc1S[C@@H](C)C(=O)Nc1nccs1	ZINC000450717482	FF	On-Demand	Anodyne	MAP1	96	35
COC(=O)c1csc(CN2CCc3c(cccc3OC)C2)n1	ZINC000450717488	DE	On-Demand	Anodyne	ABCB1B	57	34
COC(=O)c1csc(CN2CCc3c(cccc3OC)C2)n1	ZINC000450717488	DE	On-Demand	Anodyne	NOD1	29	41
COC(=O)c1csc(CN2CCc3c(cccc3OC)C2)n1	ZINC000450717488	DE	On-Demand	Anodyne	NOD2	44	41
Cc1cccc(Cl)c1CN[C@H](C)c1cncc(F)c1	ZINC000450717491	CI	On-Demand	Anodyne	EIF2AK1	41	35
Cc1cccc(Cl)c1CN[C@@H](C)c1cncc(F)c1	ZINC000450717509	CI	On-Demand	Anodyne	EIF2AK1	41	35
COc1ccc(-c2noc(CSc3nc(C)c(C)n3CC(C)C)n2)nn1	ZINC000450717517	FG	On-Demand	Anodyne	TNKS2	16	40
COc1ccc(-c2noc(CSc3nc(C)c(C)n3CC(C)C)n2)nn1	ZINC000450717517	FG	On-Demand	Anodyne	AXIN2	0	43
Cc1cccc([C@H]2CCN(Cc3ccn(CC(F)(F)F)n3)C2)c1	ZINC000450717526	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
Cc1cccc([C@@H]2CCN(Cc3ccn(CC(F)(F)F)n3)C2)c1	ZINC000450717527	DH	On-Demand	Anodyne	VACHT_TETCF	0	42
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])OC	ZINC000450717532	DD	On-Demand	Bother	CA2	26	40
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])OC	ZINC000450717534	DD	On-Demand	Bother	CA2	26	40
COc1ccc(CNC(=O)CCN(C)C2CCC(NC(C)=O)CC2)c(OC)c1	ZINC000450717546	GE	On-Demand	Anodyne	MTNR1A	66	40
COc1ccc(CNC(=O)CCN(C)C2CCC(NC(C)=O)CC2)c(OC)c1	ZINC000450717546	GE	On-Demand	Anodyne	MTNR1B	52	39
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717551	ED	On-Demand	Anodyne	CA2	59	53
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717551	ED	On-Demand	Anodyne	CA1	52	40
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717551	ED	On-Demand	Anodyne	CA7	42	37
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717551	ED	On-Demand	Anodyne	CA4	52	39
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717551	ED	On-Demand	Anodyne	CA12	24	40
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717551	ED	On-Demand	Anodyne	CA9	31	40
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717553	ED	On-Demand	Anodyne	CA2	59	53
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717553	ED	On-Demand	Anodyne	CA1	52	40
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717553	ED	On-Demand	Anodyne	CA7	42	37
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717553	ED	On-Demand	Anodyne	CA4	52	39
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717553	ED	On-Demand	Anodyne	CA12	24	40
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(=O)OC)OC	ZINC000450717553	ED	On-Demand	Anodyne	CA9	31	40
CC(C)(C)NC(=O)N1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC000450717554	EE	On-Demand	Anodyne	HRH4	27	70
CC[C@](C)(CNc1cc(C(F)(F)F)nc2ncnn12)OC	ZINC000450717564	DE	On-Demand	Anodyne	DHOD	0	54
COC1(CNC(=O)c2cccc(C(F)(F)F)n2)CCCCC1	ZINC000450717567	DG	On-Demand	Anodyne	HCN1	52	33
COC1(CNC(=O)c2cccc(C(F)(F)F)n2)CCCCC1	ZINC000450717567	DG	On-Demand	Anodyne	HCN4	50	33
CC[C@@](C)(CNc1cc(C(F)(F)F)nc2ncnn12)OC	ZINC000450717568	DE	On-Demand	Anodyne	DHOD	0	54
Cc1csc(CNc2cc(C(F)(F)F)nc3ncnn23)c1	ZINC000450717569	DG	On-Demand	Anodyne	DHOD	0	53
C=C(C)CCNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000450717575	CD	On-Demand	Mild	P96878_MYCTU	16	40
CO[C@@H](Cc1ccccc1)CN1CCC(CCCn2ccnc2)CC1	ZINC000450717587	EH	On-Demand	Anodyne	NPY1R	40	35
CO[C@H](Cc1ccccc1)CN1CCC(CCCn2ccnc2)CC1	ZINC000450717589	EH	On-Demand	Anodyne	NPY1R	40	35
C=C(C)CCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450717592	DG	On-Demand	Mild	ROS1	56	39
C[C@H](O)CCN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450717595	CG	On-Demand	Anodyne	CCR5	47	36
C[C@H](O)CCN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450717595	CG	On-Demand	Anodyne	CCR2	49	45
C[C@@H](O)CCN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450717596	CG	On-Demand	Anodyne	CCR5	47	36
C[C@@H](O)CCN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450717596	CG	On-Demand	Anodyne	CCR2	49	45
C[C@H](O)CCN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450717597	CG	On-Demand	Anodyne	CCR5	47	36
C[C@H](O)CCN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450717597	CG	On-Demand	Anodyne	CCR2	49	45
C[C@@H](O)CCN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450717598	CG	On-Demand	Anodyne	CCR5	47	36
C[C@@H](O)CCN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450717598	CG	On-Demand	Anodyne	CCR2	49	45
CN(C)CCN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)C1CC1	ZINC000450717612	EH	On-Demand	Anodyne	PRCP	40	35
CN(C)CCN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)C1CC1	ZINC000450717614	EH	On-Demand	Anodyne	PRCP	40	35
CN(C)CCN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)C1CC1	ZINC000450717616	EH	On-Demand	Anodyne	PRCP	40	35
CN(C)CCN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)C1CC1	ZINC000450717617	EH	On-Demand	Anodyne	PRCP	40	35
CCc1nc(C)c(CSc2nnc(-c3cccc(C)c3)n2Cc2ccco2)o1	ZINC000450717630	GK	On-Demand	Anodyne	HCRTR2	20	41
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1cccs1	ZINC000450717631	FH	On-Demand	Anodyne	MTNR1A	59	40
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1cccs1	ZINC000450717631	FH	On-Demand	Anodyne	MTNR1B	46	36
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1cccs1	ZINC000450717632	FH	On-Demand	Anodyne	MTNR1A	59	40
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1cccs1	ZINC000450717632	FH	On-Demand	Anodyne	MTNR1B	46	36
CC[C@](C)(CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450717647	DG	On-Demand	Anodyne	PTR1	47	34
CC[C@](C)(CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450717647	DG	On-Demand	Anodyne	L3MBTL3	43	32
CC[C@@](C)(CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450717648	DG	On-Demand	Anodyne	PTR1	47	34
CC[C@@](C)(CNc1ccc(C(=O)N2CCC(C)CC2)cn1)OC	ZINC000450717648	DG	On-Demand	Anodyne	L3MBTL3	43	32
COc1ccc(CC(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c(Cl)c1OC	ZINC000450717653	GF	On-Demand	Anodyne	CCR1	45	36
COc1ccc(CC(=O)N2CCC([C@H](C)NC(C)=O)CC2)c(Cl)c1OC	ZINC000450717654	GF	On-Demand	Anodyne	CCR1	45	36
Cc1cncn1C1CCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CC1	ZINC000450717673	FG	On-Demand	Anodyne	L3MBTL1	0	41
Cc1cncn1C1CCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CC1	ZINC000450717673	FG	On-Demand	Anodyne	L3MBTL3	60	35
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450717679	FE	On-Demand	Anodyne	SFRP1	34	43
C=C(C)CCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450717699	EF	On-Demand	Mild	CA2	17	44
CC(=O)N[C@H](C(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1)C(C)(C)C	ZINC000450717700	GG	On-Demand	Anodyne	NPY5R	16	42
CCOc1ccccc1-c1nnc(SCc2oc(CC)nc2C)o1	ZINC000450717702	EI	On-Demand	Anodyne	ALOX15	47	32
Cc1cnc(CCCC(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)o1	ZINC000450717708	EJ	On-Demand	Anodyne	JUN	25	40
Cc1cnc(CCCC(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)o1	ZINC000450717708	EJ	On-Demand	Anodyne	ATF1	60	39
Cc1cnc(CCCC(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)o1	ZINC000450717708	EJ	On-Demand	Anodyne	NFKB1	55	39
CCS(=O)(=O)c1ccc(CN2CCNC(=O)[C@@H]2Cc2ccccc2)cc1	ZINC000450717711	FE	On-Demand	Anodyne	GALR1	44	33
CCS(=O)(=O)c1ccc(CN2CCNC(=O)[C@@H]2Cc2ccccc2)cc1	ZINC000450717711	FE	On-Demand	Anodyne	GHRL	43	30
CCS(=O)(=O)c1ccc(CN2CCNC(=O)[C@H]2Cc2ccccc2)cc1	ZINC000450717712	FE	On-Demand	Anodyne	GALR1	44	33
CCS(=O)(=O)c1ccc(CN2CCNC(=O)[C@H]2Cc2ccccc2)cc1	ZINC000450717712	FE	On-Demand	Anodyne	GHRL	43	30
COc1ccccc1Oc1ccc(C(=O)N(CCN(C)C)C2CC2)nc1	ZINC000450717730	FG	On-Demand	Anodyne	MBTPS1	55	39
C=C(C)CCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450717739	DG	On-Demand	Mild	AVPR2	77	43
C=C(C)CCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450717739	DG	On-Demand	Mild	AVPR1A	54	43
COc1cccc(C2=CCN(C(=O)C3(C)CCC(=O)CC3)C2)c1	ZINC000450717742	DG	On-Demand	Anodyne	ADAM10	15	43
O=C(CCCN1CCNC(=O)[C@@H]1Cc1ccccc1)c1ccccc1	ZINC000450717754	EF	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1CCNC(=O)[C@@H]1Cc1ccccc1)c1ccccc1	ZINC000450717754	EF	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCNC(=O)[C@H]1Cc1ccccc1)c1ccccc1	ZINC000450717755	EF	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1CCNC(=O)[C@H]1Cc1ccccc1)c1ccccc1	ZINC000450717755	EF	On-Demand	Anodyne	DRD4	0	41
COc1cc(CN[C@@H](C)c2cncc(F)c2)ccc1Cl	ZINC000450717766	CH	On-Demand	Anodyne	GRIN2B	22	43
COc1cc(CN[C@H](C)c2cncc(F)c2)ccc1Cl	ZINC000450717769	CH	On-Demand	Anodyne	GRIN2B	22	43
CC(C)c1nnc(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)s1	ZINC000450717815	FK	On-Demand	Anodyne	GSK3A	44	39
COc1cccc([C@@H]2C[C@H]2C(=O)NCc2nc3cccc(Cl)c3n2C)c1	ZINC000450717818	FH	On-Demand	Anodyne	DRD4	44	36
COc1cccc([C@@H]2C[C@H]2C(=O)NCc2nc3cccc(Cl)c3n2C)c1	ZINC000450717818	FH	On-Demand	Anodyne	ROCK2	25	40
CCN(CC)C(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450717827	EI	On-Demand	Anodyne	ACHE	29	45
CCN(CC)C(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450717827	EI	On-Demand	Anodyne	HRH1	22	40
CCN(CC)C(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450717827	EI	On-Demand	Anodyne	OPRD1	18	43
CCN(CC)C(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450717827	EI	On-Demand	Anodyne	SIGMAR1	21	51
CCN(CC)C(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450717827	EI	On-Demand	Anodyne	CYP2J2	50	36
CCN(CC)C(=O)CCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450717827	EI	On-Demand	Anodyne	ACKR3	36	42
COC1(CNC(=O)c2ccc(C#N)n2C)CCCCC1	ZINC000450717833	CD	On-Demand	Mild	HCN1	50	32
COC1(CNC(=O)c2ccc(C#N)n2C)CCCCC1	ZINC000450717833	CD	On-Demand	Mild	HCN4	47	32
COC(=O)c1coc(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)n1	ZINC000450717834	FI	On-Demand	Anodyne	GSK3B	0	45
COC(=O)c1coc(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)n1	ZINC000450717834	FI	On-Demand	Anodyne	GSK3A	35	44
COC(=O)c1coc(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)n1	ZINC000450717834	FI	On-Demand	Anodyne	ALOX15	48	38
CCN(CC)C(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450717837	EI	On-Demand	Anodyne	ACHE	29	45
CCN(CC)C(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450717837	EI	On-Demand	Anodyne	HRH1	22	40
CCN(CC)C(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450717837	EI	On-Demand	Anodyne	OPRD1	18	43
CCN(CC)C(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450717837	EI	On-Demand	Anodyne	SIGMAR1	21	51
CCN(CC)C(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450717837	EI	On-Demand	Anodyne	CYP2J2	50	36
CCN(CC)C(=O)CCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450717837	EI	On-Demand	Anodyne	ACKR3	36	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCOC2(CCC2)C1	ZINC000450717845	FD	On-Demand	Anodyne	CA2	19	43
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCOC2(CCC2)C1	ZINC000450717848	FD	On-Demand	Anodyne	CA2	19	43
COC(=O)c1csc(CN[C@H](c2ccc(Cl)cc2F)C(C)C)n1	ZINC000450717892	FI	On-Demand	Anodyne	PTGER1	15	44
COC(=O)c1csc(CN[C@@H](c2ccc(Cl)cc2F)C(C)C)n1	ZINC000450717894	FI	On-Demand	Anodyne	PTGER1	15	44
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)cc1	ZINC000450717899	EH	On-Demand	Anodyne	DRD4	36	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)cc1	ZINC000450717899	EH	On-Demand	Anodyne	VACHT_TETCF	0	47
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)cc1	ZINC000450717899	EH	On-Demand	Anodyne	SIGMAR1	23	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)cc1	ZINC000450717899	EH	On-Demand	Anodyne	CCR5	27	49
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C)c3)C2)cc1	ZINC000450717899	EH	On-Demand	Anodyne	MGEA5	16	44
COC(=O)c1cccc(CN[C@H](CC(=O)OC(C)C)c2ccccc2)c1Cl	ZINC000450717906	GI	On-Demand	Anodyne	SOAT1	15	40
COC(=O)c1cccc(CN[C@@H](CC(=O)OC(C)C)c2ccccc2)c1Cl	ZINC000450717907	GI	On-Demand	Anodyne	SOAT1	15	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)cc1	ZINC000450717909	EH	On-Demand	Anodyne	DRD4	36	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)cc1	ZINC000450717909	EH	On-Demand	Anodyne	VACHT_TETCF	0	47
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)cc1	ZINC000450717909	EH	On-Demand	Anodyne	SIGMAR1	23	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)cc1	ZINC000450717909	EH	On-Demand	Anodyne	CCR5	27	49
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C)c3)C2)cc1	ZINC000450717909	EH	On-Demand	Anodyne	MGEA5	16	44
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	DRD4	27	40
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	ACHE	49	46
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	HRH1	24	42
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	HTR4	70	46
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	SIGMAR1	30	41
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	SSTR5	67	39
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	CCR3	44	42
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	MCHR1	42	44
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450717919	GH	On-Demand	Anodyne	CACNA1I	69	42
CCc1nc(C)c(CSc2nnc(-c3ccccc3C)n2Cc2ccco2)o1	ZINC000450717921	GK	On-Demand	Anodyne	HCRTR2	22	44
COC1(CNC(=O)COc2ccc(C#N)c(Br)c2)CCCCC1	ZINC000450717929	GG	On-Demand	Mild	TRPV4	40	30
CC(=O)N[C@@H](C)C1CCN(C(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450717967	EF	On-Demand	Anodyne	L3MBTL3	62	36
CC(=O)N[C@H](C)C1CCN(C(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450717968	EF	On-Demand	Anodyne	L3MBTL3	62	36
CSc1cccc(C(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450717972	EF	On-Demand	Anodyne	NPY2R	16	40
C=C(C)CCNc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1[N+](=O)[O-]	ZINC000450717981	GD	On-Demand	Mild	BDKRB1	0	43
C=C(C)CCNc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1[N+](=O)[O-]	ZINC000450717981	GD	On-Demand	Mild	BCL2L1	50	43
C=C(C)CCNc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1[N+](=O)[O-]	ZINC000450717981	GD	On-Demand	Mild	BCL2	39	40
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	HTR1A	26	49
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	DRD2	32	60
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	DRD1	15	47
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	DRD4	33	49
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	ADRA1D	28	45
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	HTR2A	31	49
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	HTR2C	21	51
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	ADRA1A	25	43
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	HRH1	28	43
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	ADRA1B	23	43
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	DRD3	19	45
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	ADRA2B	15	45
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	HTR7	29	49
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	SIGMAR1	27	59
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	PRCP	28	42
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	SLC18A3	22	41
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	MCHR1	31	59
Cc1ccc(C2CCN(CCCC(=O)c3ccccc3)CC2)cn1	ZINC000450717991	DI	On-Demand	Anodyne	CYP2J2	68	51
CCOc1ccccc1-c1nnc(SCC2(OC)CCC2)o1	ZINC000450717992	DH	On-Demand	Anodyne	ALOX15	48	36
Cc1ccc(C(=O)N2CCC(n3cncc3C)CC2)c(Cl)c1Cl	ZINC000450718009	FI	On-Demand	Anodyne	L3MBTL1	0	40
Cc1ccc(C(=O)N2CCC(n3cncc3C)CC2)c(Cl)c1Cl	ZINC000450718009	FI	On-Demand	Anodyne	L3MBTL3	62	40
C[C@@H](O)CCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450718011	EG	On-Demand	Anodyne	TERT	25	47
C[C@@H](O)CCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450718011	EG	On-Demand	Anodyne	MVFR	0	48
C[C@H](O)CCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450718012	EG	On-Demand	Anodyne	TERT	25	47
C[C@H](O)CCSc1nnc(-c2cccc(Br)c2)o1	ZINC000450718012	EG	On-Demand	Anodyne	MVFR	0	48
Cc1nc(C(C)C)oc1CSc1nnc(-c2cccc(Br)c2)o1	ZINC000450718013	GK	On-Demand	Anodyne	GSK3A	48	38
Cc1nc(C(C)C)oc1CSc1nnc(-c2cccc(Br)c2)o1	ZINC000450718013	GK	On-Demand	Anodyne	TERT	26	48
COc1cccc(-n2cc(C(=O)N3CCC(n4cncc4C)CC3)nn2)c1	ZINC000450718014	FE	On-Demand	Anodyne	CCKAR	22	41
COc1cccc(-n2cc(C(=O)N3CCC(n4cncc4C)CC3)nn2)c1	ZINC000450718014	FE	On-Demand	Anodyne	HPGD	18	40
O=C(CC1(O)CCC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450718027	FE	On-Demand	Anodyne	RBP4	67	34
O=C(CC1(O)CCC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450718028	FE	On-Demand	Anodyne	RBP4	67	34
CCCc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)no1	ZINC000450718030	GG	On-Demand	Anodyne	RBP4	49	32
CCCc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)no1	ZINC000450718031	GG	On-Demand	Anodyne	RBP4	49	32
CCOc1ccccc1-c1nnc(SCCCCCC(C)=O)o1	ZINC000450718040	EI	On-Demand	Anodyne	ALOX15	65	37
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450718052	GH	On-Demand	Anodyne	MC4R	30	47
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450718052	GH	On-Demand	Anodyne	EPHX2	16	40
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450718053	GH	On-Demand	Anodyne	MC4R	30	47
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450718053	GH	On-Demand	Anodyne	EPHX2	16	40
COC1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCCCC1	ZINC000450718061	EH	On-Demand	Anodyne	HCN1	57	35
COC1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCCCC1	ZINC000450718061	EH	On-Demand	Anodyne	HCN4	49	35
COC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450718062	DF	On-Demand	Anodyne	CACNA1G	25	42
COC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450718062	DF	On-Demand	Anodyne	HCN1	53	33
COC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450718062	DF	On-Demand	Anodyne	HCN4	51	33
COC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450718064	DF	On-Demand	Anodyne	CACNA1G	25	42
COC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450718064	DF	On-Demand	Anodyne	HCN1	53	33
COC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450718064	DF	On-Demand	Anodyne	HCN4	51	33
COC(=O)C1(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450718066	EG	On-Demand	Anodyne	CACNA1B	47	37
COC(=O)C1(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450718066	EG	On-Demand	Anodyne	CCR2	100	44
COC(=O)C1(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450718066	EG	On-Demand	Anodyne	MCHR1	23	45
COC(=O)C1(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450718066	EG	On-Demand	Anodyne	LIPG	46	33
COC(=O)C1(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450718068	EG	On-Demand	Anodyne	CACNA1B	47	37
COC(=O)C1(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450718068	EG	On-Demand	Anodyne	CCR2	100	44
COC(=O)C1(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450718068	EG	On-Demand	Anodyne	MCHR1	23	45
COC(=O)C1(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450718068	EG	On-Demand	Anodyne	LIPG	46	33
Cn1cc(Cl)c(CNc2cc(C(=O)NC3CC3)c3ccccc3n2)n1	ZINC000450718083	FF	On-Demand	Anodyne	METG	42	35
Cn1cc(Cl)c(CNc2cc(C(=O)NC3CC3)c3ccccc3n2)n1	ZINC000450718083	FF	On-Demand	Anodyne	TNKS	40	32
CO[C@@H](Cc1ccccc1)C(=O)NCCc1nn(C)c2ccccc12	ZINC000450718090	EE	On-Demand	Anodyne	AMP1_PLAFQ	43	39
CO[C@H](Cc1ccccc1)C(=O)NCCc1nn(C)c2ccccc12	ZINC000450718091	EE	On-Demand	Anodyne	AMP1_PLAFQ	43	39
O=C(CCCN1CCOCC2(CCOCC2)C1)c1ccccc1	ZINC000450718105	DF	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1CCOCC2(CCOCC2)C1)c1ccccc1	ZINC000450718105	DF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCOCC2(CCOCC2)C1)c1ccccc1	ZINC000450718105	DF	On-Demand	Anodyne	SLC18A3	0	42
O=C(CCCN1CCOCC2(CCOCC2)C1)c1ccccc1	ZINC000450718105	DF	On-Demand	Anodyne	CYP2J2	60	43
CC(=O)NC1CCC(N(C)CCc2ccc(Cl)cc2)CC1	ZINC000450718106	DG	On-Demand	Anodyne	AVPR1A	38	45
CC(=O)NC1CCC(N(C)CCc2ccc(Cl)cc2)CC1	ZINC000450718106	DG	On-Demand	Anodyne	C5AR1	28	44
Cc1cncc(-c2nc(CN3CC[C@H](c4cccc(C)c4)C3)no2)c1	ZINC000450718141	EH	On-Demand	Anodyne	MGEA5	15	41
Cc1cncc(-c2nc(CN3CC[C@@H](c4cccc(C)c4)C3)no2)c1	ZINC000450718142	EH	On-Demand	Anodyne	MGEA5	15	41
Cc1cc(C)cc(-c2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450718144	DH	On-Demand	Anodyne	GSK3B	16	41
Cc1cc(C)cc(-c2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450718144	DH	On-Demand	Anodyne	GSK3A	44	37
Cc1cc(C)cc(-c2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450718144	DH	On-Demand	Anodyne	TERT	25	43
COC1(CNC(=O)c2cc(C)n(C(C)C)n2)CCCCC1	ZINC000450718148	CF	On-Demand	Anodyne	HCN1	43	37
c1ccc(-c2cnc(NC[C@H]3CCOC4(CCC4)C3)cn2)cc1	ZINC000450718185	DH	On-Demand	Anodyne	TPH1	28	46
c1ccc(-c2cnc(NC[C@@H]3CCOC4(CCC4)C3)cn2)cc1	ZINC000450718188	DH	On-Demand	Anodyne	TPH1	28	46
Cc1ccccc1-c1nnc(SC[C@@H]2COCCO2)n1Cc1ccco1	ZINC000450718191	FG	On-Demand	Anodyne	HCRTR2	23	46
Cn1c(CNC(=O)[C@H]2CCN(c3ccccc3)C2)nc2cccc(Cl)c21	ZINC000450718193	FG	On-Demand	Anodyne	HTR7	29	41
Cn1c(CNC(=O)[C@H]2CCN(c3ccccc3)C2)nc2cccc(Cl)c21	ZINC000450718193	FG	On-Demand	Anodyne	SMO	42	35
Cn1c(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)nc2cccc(Cl)c21	ZINC000450718194	FG	On-Demand	Anodyne	HTR7	29	41
Cn1c(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)nc2cccc(Cl)c21	ZINC000450718194	FG	On-Demand	Anodyne	SMO	42	35
Cc1ccccc1-c1nnc(SC[C@H]2COCCO2)n1Cc1ccco1	ZINC000450718196	FG	On-Demand	Anodyne	HCRTR2	23	46
COC(=O)c1coc(CN2CCc3c(cccc3OC)C2)n1	ZINC000450718206	DE	On-Demand	Anodyne	NOD2	42	39
C[C@@H](O)CCCn1cnc2ccc(Cl)cc2c1=O	ZINC000450718241	CE	On-Demand	Anodyne	TBXAS1	0	60
C[C@H](O)CCCn1cnc2ccc(Cl)cc2c1=O	ZINC000450718242	CE	On-Demand	Anodyne	TBXAS1	0	60
CCS(=O)(=O)c1ccc(CN2CCC(CCCO)CC2)cc1	ZINC000450718249	EE	On-Demand	Anodyne	SIGMAR1	39	41
CN(Cc1ccccc1)C1(CNc2cc(N3CCOCC3)ncn2)CCC1	ZINC000450718272	FF	On-Demand	Anodyne	ADK	17	40
CC(=O)CCCCCOc1ccc([N+](=O)[O-])c(C)c1	ZINC000450718275	CG	On-Demand	Bother	PLA2G4B	61	32
CC[C@](C)(CNc1nc2ccccc2nc1N1CCOCC1)OC	ZINC000450718287	EF	On-Demand	Anodyne	PIK3CA	15	41
CC[C@@](C)(CNc1nc2ccccc2nc1N1CCOCC1)OC	ZINC000450718288	EF	On-Demand	Anodyne	PIK3CA	15	41
CC(C)(C)NC(=O)N1CCN(C(=O)c2cccc(C(F)(F)F)n2)CC1	ZINC000450718289	FE	On-Demand	Anodyne	SFRP1	91	38
CC(C)(C)NC(=O)N1CCN(C(=O)c2cccc(C(F)(F)F)n2)CC1	ZINC000450718289	FE	On-Demand	Anodyne	WNT3	54	37
CCCc1cc(C(=O)N(CCN(C)C)C2CC2)no1	ZINC000450718292	CD	On-Demand	Anodyne	S1PR3	20	63
C[C@@H]1CCO[C@@H]1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450718297	FE	On-Demand	Anodyne	RBP4	50	35
C[C@@H]1CCO[C@@H]1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450718298	FE	On-Demand	Anodyne	RBP4	50	35
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c1	ZINC000450718304	GF	On-Demand	Anodyne	CACNA1B	21	42
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC([C@H](C)NC(C)=O)CC2)c1	ZINC000450718305	GF	On-Demand	Anodyne	CACNA1B	21	42
CC(C)(C)OC1CC(Sc2nnc(-c3cccc(Br)c3)o2)C1	ZINC000450718310	GJ	On-Demand	Anodyne	MVFR	0	43
Cc1ccccc1C1=CCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450718316	DG	On-Demand	Anodyne	SLC6A7	0	45
C=C(C)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450718321	BC	On-Demand	Mild	CA2	65	38
C=C(C)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450718321	BC	On-Demand	Mild	CA1	50	38
C=C(C)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450718321	BC	On-Demand	Mild	CA7	44	34
C=C(C)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450718321	BC	On-Demand	Mild	CA14	42	38
C=C(C)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450718321	BC	On-Demand	Mild	CA9	46	38
C=C(C)CCNc1ccc(S(N)(=O)=O)cn1	ZINC000450718321	BC	On-Demand	Mild	CYNT	52	38
COc1cccc(C2=CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450718328	GH	On-Demand	Anodyne	HSD17B2	18	41
CC[C@](C)(CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)OC	ZINC000450718329	FC	On-Demand	Anodyne	CA2	40	36
CC[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)OC	ZINC000450718330	FC	On-Demand	Anodyne	CA2	40	36
C=CCNC(=O)c1ccc(NC[C@](C)(CC)OC)nc1	ZINC000450718333	CE	On-Demand	Mild	HCAR3	15	52
C=CCNC(=O)c1ccc(NC[C@@](C)(CC)OC)nc1	ZINC000450718334	CE	On-Demand	Mild	HCAR3	15	52
C[C@H](O)CCN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718336	CC	On-Demand	Anodyne	GALR1	51	38
C[C@H](O)CCN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718336	CC	On-Demand	Anodyne	GHRL	54	36
C[C@H](O)CCN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718337	CC	On-Demand	Anodyne	GALR1	51	38
C[C@H](O)CCN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718337	CC	On-Demand	Anodyne	GHRL	54	36
C[C@@H](O)CCN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718338	CC	On-Demand	Anodyne	GALR1	51	38
C[C@@H](O)CCN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718338	CC	On-Demand	Anodyne	GHRL	54	36
C[C@@H](O)CCN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718339	CC	On-Demand	Anodyne	GALR1	51	38
C[C@@H](O)CCN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718339	CC	On-Demand	Anodyne	GHRL	54	36
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1cnc(C2CC2)nc1	ZINC000450718349	EI	On-Demand	Anodyne	JUN	31	63
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1cnc(C2CC2)nc1	ZINC000450718349	EI	On-Demand	Anodyne	ATF1	70	48
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1cnc(C2CC2)nc1	ZINC000450718349	EI	On-Demand	Anodyne	NFKB1	65	48
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1cnc(C2CC2)nc1	ZINC000450718349	EI	On-Demand	Anodyne	PTPA	0	42
FC1(F)CC(CSc2nnc(-c3cccc(Cl)c3)o2)C1	ZINC000450718353	DJ	On-Demand	Anodyne	GSK3B	0	46
FC1(F)CC(CSc2nnc(-c3cccc(Cl)c3)o2)C1	ZINC000450718353	DJ	On-Demand	Anodyne	TERT	25	47
FC1(F)CC(CSc2nnc(-c3cccc(Cl)c3)o2)C1	ZINC000450718353	DJ	On-Demand	Anodyne	CYP73A16	15	45
CO[C@H](CN[C@H](C)c1ccc(C#N)cc1F)Cc1ccccc1	ZINC000450718373	DH	On-Demand	Mild	CTRB_BOVIN	44	30
CO[C@@H](CN[C@H](C)c1ccc(C#N)cc1F)Cc1ccccc1	ZINC000450718374	DH	On-Demand	Mild	CTRB_BOVIN	44	30
CO[C@@H](CN[C@@H](C)c1ccc(C#N)cc1F)Cc1ccccc1	ZINC000450718375	DH	On-Demand	Mild	CTRB_BOVIN	44	30
CO[C@H](CN[C@@H](C)c1ccc(C#N)cc1F)Cc1ccccc1	ZINC000450718376	DH	On-Demand	Mild	CTRB_BOVIN	44	30
CCC[C@@H](CC(C)C)C(=O)NCCc1nn(C)c2ccccc12	ZINC000450718379	DH	On-Demand	Anodyne	CAPN2	41	32
CCC[C@H](CC(C)C)C(=O)NCCc1nn(C)c2ccccc12	ZINC000450718380	DH	On-Demand	Anodyne	CAPN2	41	32
Cc1cc(C)cc(-c2nnc(SCC[C@H]3CCOC3)o2)c1	ZINC000450718388	DH	On-Demand	Anodyne	TERT	0	40
Cc1cc(C)cc(-c2nnc(SCC[C@@H]3CCOC3)o2)c1	ZINC000450718389	DH	On-Demand	Anodyne	TERT	0	40
CC[C@@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718394	GI	On-Demand	Anodyne	P2RX7	40	36
CC[C@@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718394	GI	On-Demand	Anodyne	RBP4	65	41
CC[C@@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718394	GI	On-Demand	Anodyne	SCD1	30	43
CC[C@@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718394	GI	On-Demand	Anodyne	SFRP1	109	39
CC[C@@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718394	GI	On-Demand	Anodyne	SCD	33	42
CC[C@@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718394	GI	On-Demand	Anodyne	WNT3	80	34
CC[C@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718395	GI	On-Demand	Anodyne	P2RX7	40	36
CC[C@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718395	GI	On-Demand	Anodyne	RBP4	65	41
CC[C@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718395	GI	On-Demand	Anodyne	SCD1	30	43
CC[C@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718395	GI	On-Demand	Anodyne	SFRP1	109	39
CC[C@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718395	GI	On-Demand	Anodyne	SCD	33	42
CC[C@H]1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718395	GI	On-Demand	Anodyne	WNT3	80	34
CC[C@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718396	GI	On-Demand	Anodyne	P2RX7	40	36
CC[C@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718396	GI	On-Demand	Anodyne	RBP4	65	41
CC[C@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718396	GI	On-Demand	Anodyne	SCD1	30	43
CC[C@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718396	GI	On-Demand	Anodyne	SFRP1	109	39
CC[C@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718396	GI	On-Demand	Anodyne	SCD	33	42
CC[C@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718396	GI	On-Demand	Anodyne	WNT3	80	34
CC[C@@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718397	GI	On-Demand	Anodyne	P2RX7	40	36
CC[C@@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718397	GI	On-Demand	Anodyne	RBP4	65	41
CC[C@@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718397	GI	On-Demand	Anodyne	SCD1	30	43
CC[C@@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718397	GI	On-Demand	Anodyne	SFRP1	109	39
CC[C@@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718397	GI	On-Demand	Anodyne	SCD	33	42
CC[C@@H]1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718397	GI	On-Demand	Anodyne	WNT3	80	34
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2cc(C)cs2)c([N+](=O)[O-])c1	ZINC000450718404	GF	On-Demand	Bother	TAAR1	19	43
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2cc(C)cs2)c([N+](=O)[O-])c1	ZINC000450718405	GF	On-Demand	Bother	TAAR1	19	43
COC(=O)c1coc(CSc2nnc(-c3cc(C)cc(C)c3)o2)n1	ZINC000450718418	EG	On-Demand	Anodyne	GSK3A	24	43
CCOC(=O)c1ccc(CSc2nnc(-c3cc(C)cc(C)c3)o2)nc1	ZINC000450718428	FI	On-Demand	Anodyne	GSK3B	15	44
CCOC(=O)c1ccc(CSc2nnc(-c3cc(C)cc(C)c3)o2)nc1	ZINC000450718428	FI	On-Demand	Anodyne	GSK3A	45	44
CCOC(=O)c1ccc(CSc2nnc(-c3cc(C)cc(C)c3)o2)nc1	ZINC000450718428	FI	On-Demand	Anodyne	ALOX15	51	40
Fc1ccc2c(NC[C@@H]3CCOC4(CCC4)C3)ccnc2c1	ZINC000450718429	DI	On-Demand	Anodyne	HRP1_PLAFA	62	38
Fc1ccc2c(NC[C@@H]3CCOC4(CCC4)C3)ccnc2c1	ZINC000450718429	DI	On-Demand	Anodyne	HNMT	48	34
Fc1ccc2c(NC[C@H]3CCOC4(CCC4)C3)ccnc2c1	ZINC000450718430	DI	On-Demand	Anodyne	HRP1_PLAFA	62	38
Fc1ccc2c(NC[C@H]3CCOC4(CCC4)C3)ccnc2c1	ZINC000450718430	DI	On-Demand	Anodyne	HNMT	48	34
CCS(=O)(=O)c1ccc(CSc2nc(C)cc(N)n2)cc1	ZINC000450718436	DE	On-Demand	Anodyne	CA13	18	42
CCc1nc(C)c(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)o1	ZINC000450718449	FK	On-Demand	Anodyne	TYMS	0	46
CCc1nc(C)c(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)o1	ZINC000450718449	FK	On-Demand	Anodyne	GSK3B	15	41
CCc1nc(C)c(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)o1	ZINC000450718449	FK	On-Demand	Anodyne	GSK3A	42	39
CCOC(=O)c1ccc(CN2CCc3c(cccc3OC)C2)nc1	ZINC000450718456	EF	On-Demand	Anodyne	ABCB1B	41	32
Cc1csc(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])c1	ZINC000450718471	FF	On-Demand	Bother	COLA	50	34
CC(C)(C)c1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450718472	GK	On-Demand	Anodyne	TYMS	0	42
CC(C)(C)c1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450718472	GK	On-Demand	Anodyne	GSK3B	16	40
CC(C)(C)c1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450718472	GK	On-Demand	Anodyne	GSK3A	42	37
Cc1ccn(CC(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1	ZINC000450718477	GF	On-Demand	Anodyne	RBP4	59	42
Cc1ccn(CC(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1	ZINC000450718477	GF	On-Demand	Anodyne	SCD1	27	42
Cc1ccn(CC(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1	ZINC000450718477	GF	On-Demand	Anodyne	SFRP1	101	38
Cc1ccn(CC(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1	ZINC000450718477	GF	On-Demand	Anodyne	SCD	30	41
Cc1ccn(CC(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1	ZINC000450718477	GF	On-Demand	Anodyne	WNT3	70	35
COc1ccc(C(=O)N(CCN(C)C)C2CC2)cc1Cl	ZINC000450718489	CF	On-Demand	Anodyne	MBTPS1	72	36
Cc1ccnc(OC2CCN(CCc3cscn3)CC2)c1	ZINC000450718491	DF	On-Demand	Anodyne	SCN5A	61	44
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	ACHE	45	45
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	HRH1	28	43
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	OPRD1	22	41
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	HTR4	43	37
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	GRIN2B	44	37
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	HRH3	17	46
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	SIGMAR1	63	42
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	BCHE	0	45
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	CCR3	37	40
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	CCR5	49	37
CCN(CC)C(=O)CCC1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450718505	FG	On-Demand	Anodyne	CYP2J2	53	38
CO[C@H](CN[C@H](C)c1cccc(NS(C)(=O)=O)c1)Cc1ccccc1	ZINC000450718529	FF	On-Demand	Anodyne	ADRB3	34	44
CO[C@@H](CN[C@H](C)c1cccc(NS(C)(=O)=O)c1)Cc1ccccc1	ZINC000450718530	FF	On-Demand	Anodyne	ADRB3	34	44
CO[C@@H](CN[C@@H](C)c1cccc(NS(C)(=O)=O)c1)Cc1ccccc1	ZINC000450718531	FF	On-Demand	Anodyne	ADRB3	34	44
CO[C@H](CN[C@@H](C)c1cccc(NS(C)(=O)=O)c1)Cc1ccccc1	ZINC000450718532	FF	On-Demand	Anodyne	ADRB3	34	44
CC(=O)c1ccc(CN2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)cc1	ZINC000450718534	FH	On-Demand	Anodyne	CCR3	53	35
CC(=O)c1ccc(CN2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)cc1	ZINC000450718535	FH	On-Demand	Anodyne	CCR3	53	35
CCCOc1ccc(C(=O)N(CCN(C)C)C2CC2)c(OC)c1	ZINC000450718552	DF	On-Demand	Anodyne	THRA	55	44
CCCOc1ccc(C(=O)N(CCN(C)C)C2CC2)c(OC)c1	ZINC000450718552	DF	On-Demand	Anodyne	THRB	29	44
CCOC(=O)[C@@H](CO)NC(=O)c1ccc2nc(OCC)[nH]c2c1	ZINC000450718553	DC	On-Demand	Anodyne	DHFR	29	42
CCOC(=O)[C@@H](CO)NC(=O)c1ccc2nc(OCC)[nH]c2c1	ZINC000450718553	DC	On-Demand	Anodyne	TYMS	43	34
CCOC(=O)[C@@H](CO)NC(=O)c1ccc2nc(OCC)[nH]c2c1	ZINC000450718553	DC	On-Demand	Anodyne	PIN1	36	40
CCOC(=O)[C@H](CO)NC(=O)c1ccc2nc(OCC)[nH]c2c1	ZINC000450718554	DC	On-Demand	Anodyne	DHFR	29	42
CCOC(=O)[C@H](CO)NC(=O)c1ccc2nc(OCC)[nH]c2c1	ZINC000450718554	DC	On-Demand	Anodyne	TYMS	43	34
CCOC(=O)[C@H](CO)NC(=O)c1ccc2nc(OCC)[nH]c2c1	ZINC000450718554	DC	On-Demand	Anodyne	PIN1	36	40
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(=O)OC)c2Cl)CC1	ZINC000450718557	GH	On-Demand	Anodyne	ACHE	38	46
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(=O)OC)c2Cl)CC1	ZINC000450718557	GH	On-Demand	Anodyne	HTR4	47	40
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(=O)OC)c2Cl)CC1	ZINC000450718557	GH	On-Demand	Anodyne	SIGMAR1	20	43
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(=O)OC)c2Cl)CC1	ZINC000450718557	GH	On-Demand	Anodyne	CCR3	26	41
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(=O)OC)c2Cl)CC1	ZINC000450718557	GH	On-Demand	Anodyne	CACNA1I	51	35
c1ccc(CCn2ccc(CN3CCC(CCCn4ccnc4)CC3)n2)cc1	ZINC000450718590	GI	On-Demand	Anodyne	CYP11B1	20	40
c1ccc(CCn2ccc(CN3CCC(CCCn4ccnc4)CC3)n2)cc1	ZINC000450718590	GI	On-Demand	Anodyne	ACHE	39	44
c1ccc(CCn2ccc(CN3CCC(CCCn4ccnc4)CC3)n2)cc1	ZINC000450718590	GI	On-Demand	Anodyne	TBXAS1	21	42
c1ccc(CCn2ccc(CN3CCC(CCCn4ccnc4)CC3)n2)cc1	ZINC000450718590	GI	On-Demand	Anodyne	SIGMAR1	25	40
c1ccc(CCn2ccc(CN3CCC(CCCn4ccnc4)CC3)n2)cc1	ZINC000450718590	GI	On-Demand	Anodyne	CYP11B2	24	40
C=C(C)CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450718597	DF	On-Demand	Mild	LRRK2	29	45
C[C@H](OCCc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450718600	FE	On-Demand	Anodyne	GHRHR	61	36
C[C@@H](OCCc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450718601	FE	On-Demand	Anodyne	GHRHR	61	36
CCOC(=O)C[C@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450718612	CF	On-Demand	Anodyne	THRA	43	38
CCOC(=O)C[C@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450718612	CF	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)C[C@@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450718613	CF	On-Demand	Anodyne	THRA	43	38
CCOC(=O)C[C@@H](C)N(C)CCCC(=O)c1ccccc1	ZINC000450718613	CF	On-Demand	Anodyne	AMY2	44	31
CC[C@@](C)(CNc1ncnc2[nH]c3ccccc3c12)OC	ZINC000450718616	CG	On-Demand	Anodyne	UTS2R	23	44
CC[C@](C)(CNc1ncnc2[nH]c3ccccc3c12)OC	ZINC000450718617	CG	On-Demand	Anodyne	UTS2R	23	44
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450718619	EF	On-Demand	Anodyne	RBP4	62	34
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450718620	EF	On-Demand	Anodyne	RBP4	62	34
CC(=O)c1cccc(CN2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450718626	DH	On-Demand	Anodyne	VACHT_TETCF	0	40
CC(=O)c1cccc(CN2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450718626	DH	On-Demand	Anodyne	SSTR5	42	34
CC(=O)c1cccc(CN2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450718626	DH	On-Demand	Anodyne	CCR3	23	41
CC(=O)c1cccc(CN2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450718626	DH	On-Demand	Anodyne	MCHR1	42	42
CC(=O)c1cccc(CN2CCC(c3ccc(C)nc3)CC2)c1	ZINC000450718626	DH	On-Demand	Anodyne	MGEA5	27	44
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450718638	CD	On-Demand	Mild	CA2	50	44
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450718638	CD	On-Demand	Mild	CA1	44	36
C=C(C)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450718638	CD	On-Demand	Mild	CA4	44	41
CCC(CC)Oc1ccc(C(=O)N2CCC(n3cncc3C)CC2)cc1	ZINC000450718644	FI	On-Demand	Anodyne	L3MBTL3	76	39
FC1(F)CCCC[C@H]1CN1CCC(CCCn2ccnc2)CC1	ZINC000450718661	EI	On-Demand	Anodyne	CAMC	0	40
FC1(F)CCCC[C@@H]1CN1CCC(CCCn2ccnc2)CC1	ZINC000450718662	EI	On-Demand	Anodyne	CAMC	0	40
COC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450718671	EG	On-Demand	Anodyne	CTSV	47	32
COC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450718671	EG	On-Demand	Anodyne	NPPA	46	36
COC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450718671	EG	On-Demand	Anodyne	HCN1	54	34
COC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450718671	EG	On-Demand	Anodyne	HCN4	51	34
CCN(CC)c1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1	ZINC000450718674	GJ	On-Demand	Anodyne	GSK3A	44	37
CCN(CC)c1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450718678	EI	On-Demand	Anodyne	GSK3A	41	35
CCN(CC)c1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450718679	EI	On-Demand	Anodyne	GSK3A	41	35
CCC[C@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718680	GG	On-Demand	Anodyne	EPHX2	42	41
CCC[C@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718680	GG	On-Demand	Anodyne	RBP4	89	41
CCC[C@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718680	GG	On-Demand	Anodyne	SCD1	29	43
CCC[C@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718680	GG	On-Demand	Anodyne	SFRP1	109	39
CCC[C@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718680	GG	On-Demand	Anodyne	SCD	32	42
CCC[C@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718680	GG	On-Demand	Anodyne	WNT3	73	35
CCC[C@@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718681	GG	On-Demand	Anodyne	EPHX2	42	41
CCC[C@@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718681	GG	On-Demand	Anodyne	RBP4	89	41
CCC[C@@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718681	GG	On-Demand	Anodyne	SCD1	29	43
CCC[C@@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718681	GG	On-Demand	Anodyne	SFRP1	109	39
CCC[C@@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718681	GG	On-Demand	Anodyne	SCD	32	42
CCC[C@@H](OC)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450718681	GG	On-Demand	Anodyne	WNT3	73	35
CCOC(=O)c1cc(C(=O)NCC2(OC)CCCCC2)[nH]c1C	ZINC000450718686	DF	On-Demand	Anodyne	HCN1	50	31
CCOC(=O)c1cc(C(=O)NCC2(OC)CCCCC2)[nH]c1C	ZINC000450718686	DF	On-Demand	Anodyne	HCN4	48	31
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCOC3(CCC3)C2)n1	ZINC000450718687	EF	On-Demand	Bother	PRKCQ	46	35
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCOC3(CCC3)C2)n1	ZINC000450718688	EF	On-Demand	Bother	PRKCQ	46	35
CC[C@@H]1C[C@H]1C(=O)NCCc1nn(C)c2ccccc12	ZINC000450718690	CE	On-Demand	Anodyne	INHA	62	34
CCN(CC)c1ccc(-c2nnc(SCc3ccc(C(C)=O)cc3)o2)cc1	ZINC000450718703	GK	On-Demand	Anodyne	GSK3B	20	52
CCN(CC)c1ccc(-c2nnc(SCc3ccc(C(C)=O)cc3)o2)cc1	ZINC000450718703	GK	On-Demand	Anodyne	GSK3A	60	52
Cc1nn(C)cc1CC(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450718718	EE	On-Demand	Anodyne	P2RX7	36	45
Cc1cccc([C@H]2CCN(Cc3cn(CC4CC4)nn3)C2)c1	ZINC000450718731	CF	On-Demand	Anodyne	VACHT_TETCF	0	42
Cc1cccc([C@@H]2CCN(Cc3cn(CC4CC4)nn3)C2)c1	ZINC000450718732	CF	On-Demand	Anodyne	VACHT_TETCF	0	42
CCN(CC)c1ccc(-c2nnc(SCn3cccn3)o2)cc1	ZINC000450718735	EH	On-Demand	Anodyne	GSK3B	0	42
CCN(CC)c1ccc(-c2nnc(SCn3cccn3)o2)cc1	ZINC000450718735	EH	On-Demand	Anodyne	GSK3A	39	42
Cn1nc(CCNC(=O)C(C)(C)C2CCC2)c2ccccc21	ZINC000450718737	CG	On-Demand	Anodyne	HTR3A	15	44
O=[N+]([O-])c1ccc2nc(NC[C@@H]3CCOC4(CCC4)C3)nc(O)c2c1	ZINC000450718748	EE	On-Demand	Bother	VCP	26	41
O=[N+]([O-])c1ccc2nc(NC[C@H]3CCOC4(CCC4)C3)nc(O)c2c1	ZINC000450718749	EE	On-Demand	Bother	VCP	26	41
O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1CCOC2(CCC2)C1	ZINC000450718757	DG	On-Demand	Bother	PRKCQ	29	40
O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1CCOC2(CCC2)C1	ZINC000450718758	DG	On-Demand	Bother	PRKCQ	29	40
O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NCc1ncc(C(F)(F)F)cn1	ZINC000450718771	GF	On-Demand	Bother	MET	15	43
CCN(CC)C(=O)CCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450718819	GH	On-Demand	Anodyne	ACHE	56	52
CCN(CC)C(=O)CCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450718819	GH	On-Demand	Anodyne	OPRM1	15	42
CCN(CC)C(=O)CCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450718819	GH	On-Demand	Anodyne	OPRD1	19	42
CCN(CC)C(=O)CCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450718819	GH	On-Demand	Anodyne	SIGMAR1	48	40
CCN(CC)C(=O)CCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450718819	GH	On-Demand	Anodyne	CYP2J2	40	36
CNC(=O)[C@@H]1CN(CC/C=C/c2ccccc2)CCO1	ZINC000450718826	CD	On-Demand	Anodyne	SLC6A1	59	35
CNC(=O)[C@H]1CN(CC/C=C/c2ccccc2)CCO1	ZINC000450718827	CD	On-Demand	Anodyne	SLC6A1	59	35
CNC(=O)[C@H]1CN(CC/C=C\c2ccccc2)CCO1	ZINC000450718828	CD	On-Demand	Anodyne	SLC6A1	59	35
CNC(=O)[C@@H]1CN(CC/C=C\c2ccccc2)CCO1	ZINC000450718829	CD	On-Demand	Anodyne	SLC6A1	59	35
O=S(=O)(NCC1CC1)c1ccc(NCc2ncc(C(F)(F)F)cn2)nc1	ZINC000450718841	GE	On-Demand	Anodyne	NPY2R	54	37
O=S(=O)(NCC1CC1)c1ccc(NCc2ncc(C(F)(F)F)cn2)nc1	ZINC000450718841	GE	On-Demand	Anodyne	NPY5R	15	40
CC(=O)c1cccc(CN2CC[C@@]3(CC[C@H](C)C3)C2)c1	ZINC000450718849	CH	On-Demand	Anodyne	CHRM3	22	45
CC(=O)c1cccc(CN2CC[C@@]3(CC[C@H](C)C3)C2)c1	ZINC000450718849	CH	On-Demand	Anodyne	MCHR2	43	35
CC(=O)c1cccc(CN2CC[C@]3(CC[C@@H](C)C3)C2)c1	ZINC000450718850	CH	On-Demand	Anodyne	CHRM3	22	45
CC(=O)c1cccc(CN2CC[C@]3(CC[C@@H](C)C3)C2)c1	ZINC000450718850	CH	On-Demand	Anodyne	MCHR2	43	35
CC(=O)c1cccc(CN2CC[C@]3(CC[C@H](C)C3)C2)c1	ZINC000450718851	CH	On-Demand	Anodyne	CHRM3	22	45
CC(=O)c1cccc(CN2CC[C@]3(CC[C@H](C)C3)C2)c1	ZINC000450718851	CH	On-Demand	Anodyne	MCHR2	43	35
CC(=O)c1cccc(CN2CC[C@@]3(CC[C@@H](C)C3)C2)c1	ZINC000450718852	CH	On-Demand	Anodyne	CHRM3	22	45
CC(=O)c1cccc(CN2CC[C@@]3(CC[C@@H](C)C3)C2)c1	ZINC000450718852	CH	On-Demand	Anodyne	MCHR2	43	35
CCc1cnccc1[C@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450718853	EG	On-Demand	Anodyne	NAMPT	41	34
CCc1cnccc1[C@@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450718854	EG	On-Demand	Anodyne	NAMPT	41	34
C[C@H](c1ccccc1)[C@@H](O)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718872	EE	On-Demand	Anodyne	GALR1	51	37
C[C@H](c1ccccc1)[C@H](O)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718873	EE	On-Demand	Anodyne	GALR1	51	37
C[C@H](c1ccccc1)[C@H](O)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718874	EE	On-Demand	Anodyne	GALR1	51	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718875	EE	On-Demand	Anodyne	GALR1	51	37
COC1(CSc2nnc(-c3cccc(Cl)c3)o2)CCC1	ZINC000450718878	DI	On-Demand	Anodyne	GSK3B	0	45
COC1(CSc2nnc(-c3cccc(Cl)c3)o2)CCC1	ZINC000450718878	DI	On-Demand	Anodyne	TERT	25	46
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)C1(CF)CCOCC1	ZINC000450718883	EI	On-Demand	Anodyne	ATF1	57	38
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)C1(CF)CCOCC1	ZINC000450718883	EI	On-Demand	Anodyne	NFKB1	53	38
COc1cc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450718886	FF	On-Demand	Anodyne	OPRK1	36	41
COc1cc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450718886	FF	On-Demand	Anodyne	CCR1	24	47
COc1cc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450718886	FF	On-Demand	Anodyne	CAN2	0	42
COc1ccc(CNC(=O)CCN2C[C@@H]3CC[C@@H](O)[C@H]3C2)c(OC)c1	ZINC000450718888	ED	On-Demand	Anodyne	MTNR1A	44	35
COc1ccc(CNC(=O)CCN2C[C@H]3[C@@H](O)CC[C@H]3C2)c(OC)c1	ZINC000450718889	ED	On-Demand	Anodyne	MTNR1A	44	35
COc1ccc(CNC(=O)CCN2C[C@H]3[C@H](O)CC[C@H]3C2)c(OC)c1	ZINC000450718890	ED	On-Demand	Anodyne	MTNR1A	44	35
COc1ccc(CNC(=O)CCN2C[C@@H]3CC[C@H](O)[C@H]3C2)c(OC)c1	ZINC000450718891	ED	On-Demand	Anodyne	MTNR1A	44	35
CCC(=O)CCCN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718901	CD	On-Demand	Anodyne	GALR1	43	31
CCC(=O)CCCN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718901	CD	On-Demand	Anodyne	CYP2J2	47	34
CCC(=O)CCCN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718902	CD	On-Demand	Anodyne	GALR1	43	31
CCC(=O)CCCN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718902	CD	On-Demand	Anodyne	CYP2J2	47	34
CCOc1ccccc1-c1nnc(SCc2cn(C)nc2C)o1	ZINC000450718905	EG	On-Demand	Anodyne	ALOX15	44	31
Cc1ccc(C2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)cn1	ZINC000450718906	DH	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1ccc(C2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)cn1	ZINC000450718907	DH	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1ccc(C2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)cn1	ZINC000450718908	DH	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1ccc(C2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)cn1	ZINC000450718908	DH	On-Demand	Anodyne	SLC18A3	21	47
Cc1ccc(C2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)cn1	ZINC000450718909	DH	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1ccc(C2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)cn1	ZINC000450718909	DH	On-Demand	Anodyne	SLC18A3	21	47
C=C(C)CCNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450718912	EE	On-Demand	Mild	TAAR1	17	44
C=C(C)CCNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450718913	EE	On-Demand	Mild	TAAR1	17	44
CC[C@@](C)(CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450718914	EH	On-Demand	Anodyne	AVPR2	94	43
CC[C@@](C)(CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450718914	EH	On-Demand	Anodyne	AVPR1A	56	41
CC[C@](C)(CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450718915	EH	On-Demand	Anodyne	AVPR2	94	43
CC[C@](C)(CNc1ccc(C(=O)N2CCc3ccccc32)cn1)OC	ZINC000450718915	EH	On-Demand	Anodyne	AVPR1A	56	41
COCCOC[C@H](O)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718935	DC	On-Demand	Anodyne	ABCB1	44	37
COCCOC[C@@H](O)CN1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450718936	DC	On-Demand	Anodyne	ABCB1	44	37
COCCOC[C@H](O)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718937	DC	On-Demand	Anodyne	ABCB1	44	37
COCCOC[C@@H](O)CN1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450718938	DC	On-Demand	Anodyne	ABCB1	44	37
C=C(C)CCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450718946	EF	On-Demand	Mild	TBXA2R	29	41
CN(CCN1CCC(CCCn2ccnc2)CC1)Cc1ccccc1	ZINC000450718950	EH	On-Demand	Anodyne	ACHE	42	42
CN(CCN1CCC(CCCn2ccnc2)CC1)Cc1ccccc1	ZINC000450718950	EH	On-Demand	Anodyne	HTR1D	24	40
CN(CCN1CCC(CCCn2ccnc2)CC1)Cc1ccccc1	ZINC000450718950	EH	On-Demand	Anodyne	HTR1B	17	40
CN(CCN1CCC(CCCn2ccnc2)CC1)Cc1ccccc1	ZINC000450718950	EH	On-Demand	Anodyne	TBXAS1	46	42
CN(CCN1CCC(CCCn2ccnc2)CC1)Cc1ccccc1	ZINC000450718950	EH	On-Demand	Anodyne	SIGMAR1	37	40
CN(CCN1CCC(CCCn2ccnc2)CC1)Cc1ccccc1	ZINC000450718950	EH	On-Demand	Anodyne	NPY1R	41	35
CC(C)c1ncsc1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450718960	GH	On-Demand	Anodyne	RBP4	41	34
CC(C)c1ncsc1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450718962	GH	On-Demand	Anodyne	RBP4	41	34
Cc1cc(F)c(CC(=O)NCCc2nn(C)c3ccccc23)cc1F	ZINC000450718967	EG	On-Demand	Anodyne	P2RX7	48	40
COCCNC(=O)c1ccc(NC[C@@H](COC)c2ccc(Cl)cc2)nc1	ZINC000450718969	GF	On-Demand	Anodyne	GCK	26	42
COCCNC(=O)c1ccc(NC[C@H](COC)c2ccc(Cl)cc2)nc1	ZINC000450718970	GF	On-Demand	Anodyne	GCK	26	42
O=C(CCCN1CCOCC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450718972	EF	On-Demand	Anodyne	DRD2	34	49
O=C(CCCN1CCOCC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450718972	EF	On-Demand	Anodyne	DRD4	0	53
O=C(CCCN1CCOCC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450718972	EF	On-Demand	Anodyne	SLC18A3	0	50
O=C(CCCN1CCOCC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450718972	EF	On-Demand	Anodyne	CYP2J2	52	37
CN1Cc2cc(NC(=O)C3CC(O)(CCC(C)(C)C)C3)ccc2NC1=O	ZINC000450718975	FH	On-Demand	Anodyne	BRD4	15	44
C=CC(C)(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719006	FH	On-Demand	Mild	RBP4	78	41
C=CC(C)(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719006	FH	On-Demand	Mild	SCD1	21	42
C=CC(C)(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719006	FH	On-Demand	Mild	SFRP1	98	43
C=CC(C)(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719006	FH	On-Demand	Mild	SCD	28	41
C=CC(C)(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719006	FH	On-Demand	Mild	WNT3	76	36
Cc1csc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1	ZINC000450719008	EG	On-Demand	Bother	MAPK13	41	32
CCCc1cc(NCc2nn(C)cc2Cl)n2ncnc2n1	ZINC000450719013	DE	On-Demand	Anodyne	DHOD	0	41
Cn1cc(Cl)c(CNc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])n1	ZINC000450719022	GE	On-Demand	Bother	LRRK2	26	41
COc1ccc(CNC(=O)CCN(C)[C@H](C)C[S@](C)=O)c(OC)c1	ZINC000450719054	FD	On-Demand	Anodyne	MTNR1A	49	41
COc1ccc(CNC(=O)CCN(C)[C@H](C)C[S@](C)=O)c(OC)c1	ZINC000450719054	FD	On-Demand	Anodyne	MTNR1B	40	41
COc1ccc(CNC(=O)CCN(C)[C@@H](C)C[S@@](C)=O)c(OC)c1	ZINC000450719055	FD	On-Demand	Anodyne	MTNR1A	49	41
COc1ccc(CNC(=O)CCN(C)[C@@H](C)C[S@@](C)=O)c(OC)c1	ZINC000450719055	FD	On-Demand	Anodyne	MTNR1B	40	41
COc1ccc(CNC(=O)CCN(C)[C@@H](C)C[S@](C)=O)c(OC)c1	ZINC000450719056	FD	On-Demand	Anodyne	MTNR1A	49	41
COc1ccc(CNC(=O)CCN(C)[C@@H](C)C[S@](C)=O)c(OC)c1	ZINC000450719056	FD	On-Demand	Anodyne	MTNR1B	40	41
COc1ccc(CNC(=O)CCN(C)[C@H](C)C[S@@](C)=O)c(OC)c1	ZINC000450719057	FD	On-Demand	Anodyne	MTNR1A	49	41
COc1ccc(CNC(=O)CCN(C)[C@H](C)C[S@@](C)=O)c(OC)c1	ZINC000450719057	FD	On-Demand	Anodyne	MTNR1B	40	41
CC(C)CCCC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719058	GI	On-Demand	Anodyne	CCR2	22	40
CC(C)CCCC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719058	GI	On-Demand	Anodyne	EPHX2	34	40
CC(C)CCCC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719058	GI	On-Demand	Anodyne	RBP4	86	38
CC(C)CCCC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719058	GI	On-Demand	Anodyne	SCD1	27	49
CC(C)CCCC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719058	GI	On-Demand	Anodyne	SFRP1	109	40
CC(C)CCCC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719058	GI	On-Demand	Anodyne	SCD	30	49
CC(C)CCCC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719058	GI	On-Demand	Anodyne	WNT3	74	37
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719059	GI	On-Demand	Anodyne	ACE	31	40
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719059	GI	On-Demand	Anodyne	FKBP1A	50	36
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719059	GI	On-Demand	Anodyne	COLA	109	45
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719059	GI	On-Demand	Anodyne	CPT1A	105	45
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719059	GI	On-Demand	Anodyne	PREP	53	35
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719059	GI	On-Demand	Anodyne	AMY2	42	29
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719060	GI	On-Demand	Anodyne	ACE	31	40
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719060	GI	On-Demand	Anodyne	FKBP1A	50	36
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719060	GI	On-Demand	Anodyne	COLA	109	45
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719060	GI	On-Demand	Anodyne	CPT1A	105	45
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719060	GI	On-Demand	Anodyne	PREP	53	35
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719060	GI	On-Demand	Anodyne	AMY2	42	29
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719061	GI	On-Demand	Anodyne	ACE	31	40
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719061	GI	On-Demand	Anodyne	FKBP1A	50	36
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719061	GI	On-Demand	Anodyne	COLA	109	45
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719061	GI	On-Demand	Anodyne	CPT1A	105	45
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719061	GI	On-Demand	Anodyne	PREP	53	35
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H](C)OCCc2ccccc2)no1	ZINC000450719061	GI	On-Demand	Anodyne	AMY2	42	29
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719062	GI	On-Demand	Anodyne	ACE	31	40
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719062	GI	On-Demand	Anodyne	FKBP1A	50	36
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719062	GI	On-Demand	Anodyne	COLA	109	45
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719062	GI	On-Demand	Anodyne	CPT1A	105	45
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719062	GI	On-Demand	Anodyne	PREP	53	35
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@H](C)OCCc2ccccc2)no1	ZINC000450719062	GI	On-Demand	Anodyne	AMY2	42	29
COC(=O)c1coc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450719074	GE	On-Demand	Anodyne	RBP4	59	36
COC(=O)c1coc(CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450719075	GE	On-Demand	Anodyne	RBP4	59	36
CCOC(=O)c1cc(N2CCC=C(c3cn(C(C)C)nn3)CC2)ncc1Cl	ZINC000450719076	GH	On-Demand	Anodyne	IKBKB	48	33
CCC(=O)CCCN1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450719090	DG	On-Demand	Anodyne	CYP2J2	48	34
CCS(=O)(=O)c1ccc(CSc2ccc(OC)cc2)cc1	ZINC000450719091	DH	On-Demand	Anodyne	MMP13	33	45
CCS(=O)(=O)c1ccc(CSc2ccc(OC)cc2)cc1	ZINC000450719091	DH	On-Demand	Anodyne	MMP1	34	41
C[C@@H]1[C@H](O)CCCN1c1ncnc2cc(F)c(F)cc12	ZINC000450719102	CE	On-Demand	Anodyne	PDE3B	51	31
C[C@H]1[C@H](O)CCCN1c1ncnc2cc(F)c(F)cc12	ZINC000450719103	CE	On-Demand	Anodyne	PDE3B	51	31
C[C@@H]1[C@@H](O)CCCN1c1ncnc2cc(F)c(F)cc12	ZINC000450719104	CE	On-Demand	Anodyne	PDE3B	51	31
C[C@H]1[C@@H](O)CCCN1c1ncnc2cc(F)c(F)cc12	ZINC000450719105	CE	On-Demand	Anodyne	PDE3B	51	31
Cc1ccccc1-c1nnc(SCC[C@H](C)O)n1Cc1ccco1	ZINC000450719107	EH	On-Demand	Anodyne	HCRTR2	24	50
Cc1ccccc1-c1nnc(SCC[C@@H](C)O)n1Cc1ccco1	ZINC000450719108	EH	On-Demand	Anodyne	HCRTR2	24	50
CO[C@@H](CN[C@H](c1cccnc1)C1CC1)Cc1ccccc1	ZINC000450719134	CG	On-Demand	Anodyne	KCNA5	49	38
CO[C@H](CN[C@H](c1cccnc1)C1CC1)Cc1ccccc1	ZINC000450719135	CG	On-Demand	Anodyne	KCNA5	49	38
CO[C@H](CN[C@@H](c1cccnc1)C1CC1)Cc1ccccc1	ZINC000450719136	CG	On-Demand	Anodyne	KCNA5	49	38
CO[C@@H](CN[C@@H](c1cccnc1)C1CC1)Cc1ccccc1	ZINC000450719137	CG	On-Demand	Anodyne	KCNA5	49	38
Cc1ccccc1-c1nnc(SC[C@H](O)CC#N)n1Cc1ccco1	ZINC000450719151	FG	On-Demand	Mild	HCRTR2	23	47
COC(=O)c1csc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450719152	GF	On-Demand	Anodyne	RBP4	56	36
COC(=O)c1csc(CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450719153	GF	On-Demand	Anodyne	RBP4	56	36
C[C@@H]1[C@@H](O)CCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450719158	EH	On-Demand	Anodyne	ADRB3	18	51
C[C@@H]1[C@H](O)CCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450719159	EH	On-Demand	Anodyne	ADRB3	18	51
C[C@H]1[C@H](O)CCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450719160	EH	On-Demand	Anodyne	ADRB3	18	51
C[C@H]1[C@@H](O)CCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450719161	EH	On-Demand	Anodyne	ADRB3	18	51
Cc1ccccc1-c1nnc(SCC2(C#N)CCC2)n1Cc1ccco1	ZINC000450719162	FJ	On-Demand	Mild	HCRTR2	22	44
CC(C)n1cc(C2=CCCN(c3ncc(C(F)(F)F)s3)CC2)nn1	ZINC000450719164	FI	On-Demand	Anodyne	MLYCD	46	32
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450719167	FG	On-Demand	Anodyne	CACNA1B	40	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450719167	FG	On-Demand	Anodyne	EPHX2	15	46
CC[C@@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])OC	ZINC000450719175	CG	On-Demand	Bother	TAAR1	18	48
CC[C@@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])OC	ZINC000450719175	CG	On-Demand	Bother	AKR1C3	16	47
CC[C@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])OC	ZINC000450719176	CG	On-Demand	Bother	TAAR1	18	48
CC[C@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])OC	ZINC000450719176	CG	On-Demand	Bother	AKR1C3	16	47
C=C(C)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450719185	DC	On-Demand	Mild	TGM2	42	45
C=C(C)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450719185	DC	On-Demand	Mild	GCKR	45	30
CC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1	ZINC000450719190	DH	On-Demand	Anodyne	SIGMAR1	31	40
CC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1	ZINC000450719190	DH	On-Demand	Anodyne	SSTR5	42	34
CC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1	ZINC000450719190	DH	On-Demand	Anodyne	CXCR3	23	41
CC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1	ZINC000450719190	DH	On-Demand	Anodyne	MCHR1	33	41
CC(=O)c1ccc(CN2CCC(c3ccc(C)nc3)CC2)cc1	ZINC000450719190	DH	On-Demand	Anodyne	MGEA5	27	41
Cc1ccc(CN(CCO)CCCC(=O)c2ccccc2)cc1	ZINC000450719192	DG	On-Demand	Anodyne	PLM2_PLAFA	22	40
CC(=O)N[C@@H](C)C1CCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)CC1	ZINC000450719219	EF	On-Demand	Anodyne	NPY1R	0	40
CC(=O)N[C@H](C)C1CCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)CC1	ZINC000450719220	EF	On-Demand	Anodyne	NPY1R	0	40
N#CC[C@@H](O)CSc1nnc(-c2cccc(Br)c2)o1	ZINC000450719234	EF	On-Demand	Mild	GSK3B	0	40
N#CC[C@@H](O)CSc1nnc(-c2cccc(Br)c2)o1	ZINC000450719234	EF	On-Demand	Mild	TERT	23	45
Cc1ccn2ncc(C(=O)N3CCC(n4cncc4C)CC3)c2c1	ZINC000450719238	DF	On-Demand	Anodyne	EPHB3	30	43
CC[C@@](C)(CNc1cc(N2CCC[C@H](C)C2)ncn1)OC	ZINC000450719242	CF	On-Demand	Anodyne	PRCP	0	45
CC[C@@](C)(CNc1cc(N2CCC[C@@H](C)C2)ncn1)OC	ZINC000450719243	CF	On-Demand	Anodyne	PRCP	0	45
CC[C@](C)(CNc1cc(N2CCC[C@@H](C)C2)ncn1)OC	ZINC000450719244	CF	On-Demand	Anodyne	PRCP	0	45
CC[C@](C)(CNc1cc(N2CCC[C@H](C)C2)ncn1)OC	ZINC000450719245	CF	On-Demand	Anodyne	PRCP	0	45
Brc1cccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)o2)c1	ZINC000450719258	FI	On-Demand	Anodyne	TERT	23	44
Brc1cccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)o2)c1	ZINC000450719259	FI	On-Demand	Anodyne	TERT	23	44
COC[C@@H](CNc1cc(N2CCC[C@H](CO)C2)ncn1)c1ccc(Cl)cc1	ZINC000450719272	GG	On-Demand	Anodyne	PRCP	0	44
COC[C@@H](CNc1cc(N2CCC[C@@H](CO)C2)ncn1)c1ccc(Cl)cc1	ZINC000450719273	GG	On-Demand	Anodyne	PRCP	0	44
COC[C@H](CNc1cc(N2CCC[C@H](CO)C2)ncn1)c1ccc(Cl)cc1	ZINC000450719274	GG	On-Demand	Anodyne	PRCP	0	44
COC[C@H](CNc1cc(N2CCC[C@@H](CO)C2)ncn1)c1ccc(Cl)cc1	ZINC000450719276	GG	On-Demand	Anodyne	PRCP	0	44
CC[C@@](C)(CNc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])OC	ZINC000450719291	FD	On-Demand	Bother	TAAR1	21	47
CC[C@](C)(CNc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])OC	ZINC000450719292	FD	On-Demand	Bother	TAAR1	21	47
Cn1cc(Cl)c(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])n1	ZINC000450719294	EE	On-Demand	Bother	MAPK14	44	36
Cn1cc(Cl)c(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])n1	ZINC000450719294	EE	On-Demand	Bother	MAPK13	70	38
COC[C@@H](CNc1ncnc2[nH]ccc12)c1ccc(Cl)cc1	ZINC000450719320	DF	On-Demand	Anodyne	AKT2	31	43
COC[C@@H](CNc1ncnc2[nH]ccc12)c1ccc(Cl)cc1	ZINC000450719320	DF	On-Demand	Anodyne	AKT3	34	42
COC[C@@H](CNc1ncnc2[nH]ccc12)c1ccc(Cl)cc1	ZINC000450719320	DF	On-Demand	Anodyne	ROCK2	31	42
COC[C@@H](CNc1ncnc2[nH]ccc12)c1ccc(Cl)cc1	ZINC000450719320	DF	On-Demand	Anodyne	AKT1	30	42
COC[C@H](CNc1ncnc2[nH]ccc12)c1ccc(Cl)cc1	ZINC000450719321	DF	On-Demand	Anodyne	AKT2	31	43
COC[C@H](CNc1ncnc2[nH]ccc12)c1ccc(Cl)cc1	ZINC000450719321	DF	On-Demand	Anodyne	AKT3	34	42
COC[C@H](CNc1ncnc2[nH]ccc12)c1ccc(Cl)cc1	ZINC000450719321	DF	On-Demand	Anodyne	ROCK2	31	42
COC[C@H](CNc1ncnc2[nH]ccc12)c1ccc(Cl)cc1	ZINC000450719321	DF	On-Demand	Anodyne	AKT1	30	42
CC(=O)NC1CCC(N(C)CCN(C)Cc2ccccc2)CC1	ZINC000450719322	DE	On-Demand	Anodyne	NA	19	40
COC1(CNC(=O)c2ccn(CCn3cccn3)n2)CCCCC1	ZINC000450719323	ED	On-Demand	Anodyne	HCN1	67	41
COC1(CNC(=O)c2ccn(CCn3cccn3)n2)CCCCC1	ZINC000450719323	ED	On-Demand	Anodyne	HCN4	58	37
COc1ccc(C(=O)NCCc2nn(C)c3ccccc23)cc1S(C)(=O)=O	ZINC000450719327	GD	On-Demand	Anodyne	DRD4	40	31
COc1ccc(C(=O)NCCc2nn(C)c3ccccc23)cc1S(C)(=O)=O	ZINC000450719327	GD	On-Demand	Anodyne	CYSLTR1	50	34
COc1ccc(C(=O)NCCc2nn(C)c3ccccc23)cc1S(C)(=O)=O	ZINC000450719327	GD	On-Demand	Anodyne	COLA	28	45
COc1ccc(C(=O)NCCc2nn(C)c3ccccc23)cc1S(C)(=O)=O	ZINC000450719327	GD	On-Demand	Anodyne	CPT1A	54	39
CC(C)(C)c1ccc(-c2nnc(SCC(=O)CC[C@H]3CCCCO3)o2)cc1	ZINC000450719336	GK	On-Demand	Anodyne	TYMS	0	43
CC(C)(C)c1ccc(-c2nnc(SCC(=O)CC[C@@H]3CCCCO3)o2)cc1	ZINC000450719337	GK	On-Demand	Anodyne	TYMS	0	43
CC(=O)N[C@H](C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2)C(C)(C)C	ZINC000450719338	EE	On-Demand	Anodyne	BRD4	17	48
NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@H]1CCOC2(CCC2)C1	ZINC000450719348	DD	On-Demand	Bother	PRKCQ	42	34
NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H]1CCOC2(CCC2)C1	ZINC000450719349	DD	On-Demand	Bother	PRKCQ	42	34
CCc1cc(NCc2nn(C)cc2Cl)n2ncnc2n1	ZINC000450719356	CD	On-Demand	Anodyne	DHOD	0	49
CCOC(=O)c1cc(C(=O)N2CCNC(=O)[C@H]2Cc2nc3ccccc3o2)on1	ZINC000450719365	GD	On-Demand	Anodyne	SSTR5	21	40
CCOC(=O)c1cc(C(=O)N2CCNC(=O)[C@@H]2Cc2nc3ccccc3o2)on1	ZINC000450719366	GD	On-Demand	Anodyne	SSTR5	21	40
CNC(=O)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719370	DD	On-Demand	Anodyne	DRD2	30	44
CNC(=O)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719370	DD	On-Demand	Anodyne	DRD4	0	47
CNC(=O)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719370	DD	On-Demand	Anodyne	HTR2A	22	46
CNC(=O)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719370	DD	On-Demand	Anodyne	SLC18A3	0	44
CNC(=O)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719370	DD	On-Demand	Anodyne	CYP2J2	54	38
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719371	DD	On-Demand	Anodyne	DRD2	30	44
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719371	DD	On-Demand	Anodyne	DRD4	0	47
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719371	DD	On-Demand	Anodyne	HTR2A	22	46
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719371	DD	On-Demand	Anodyne	SLC18A3	0	44
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450719371	DD	On-Demand	Anodyne	CYP2J2	54	38
CNC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719375	CD	On-Demand	Anodyne	DRD4	29	46
CNC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719375	CD	On-Demand	Anodyne	DRD3	23	42
CNC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719375	CD	On-Demand	Anodyne	HTR4	59	34
CNC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719375	CD	On-Demand	Anodyne	SSTR5	45	36
CNC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719375	CD	On-Demand	Anodyne	CCR1	42	43
CNC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719375	CD	On-Demand	Anodyne	CCR3	26	42
CNC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719375	CD	On-Demand	Anodyne	MCHR1	20	42
CNC(=O)[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719376	CD	On-Demand	Anodyne	DRD4	29	46
CNC(=O)[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719376	CD	On-Demand	Anodyne	DRD3	23	42
CNC(=O)[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719376	CD	On-Demand	Anodyne	HTR4	59	34
CNC(=O)[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719376	CD	On-Demand	Anodyne	SSTR5	45	36
CNC(=O)[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719376	CD	On-Demand	Anodyne	CCR1	42	43
CNC(=O)[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719376	CD	On-Demand	Anodyne	CCR3	26	42
CNC(=O)[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450719376	CD	On-Demand	Anodyne	MCHR1	20	42
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	HTR1A	21	55
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	CHRM1	19	54
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	DRD2	35	54
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	DRD4	24	51
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	ACHE	41	56
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	HTR2A	28	51
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	HRH1	28	54
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	OPRM1	15	42
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	DRD3	22	51
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	OPRD1	26	45
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	HTR4	55	38
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	CHRM4	18	51
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	CHRM5	16	51
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	CHRM3	16	51
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	GRIN2B	20	40
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	HTR7	36	47
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	SIGMAR1	33	48
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	CCR3	22	46
CCN(CC)C(=O)CCC1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450719377	FI	On-Demand	Anodyne	CYP2J2	79	55
CCN(CC)C(=O)CCC1CCN(CC2=CCCCC2)CC1	ZINC000450719397	DH	On-Demand	Anodyne	ACHE	19	42
COc1cccc(C(=O)CCCC(=O)N(CCN(C)C)C2CC2)c1	ZINC000450719423	EF	On-Demand	Anodyne	THRA	44	47
COc1cccc(C(=O)CCCC(=O)N(CCN(C)C)C2CC2)c1	ZINC000450719423	EF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C(=O)CCCC(=O)N(CCN(C)C)C2CC2)c1	ZINC000450719423	EF	On-Demand	Anodyne	THRB	23	47
COCc1nc(N2CCC[C@H](O)[C@@H]2C)c2c(-c3ccccc3)csc2n1	ZINC000450719425	FH	On-Demand	Anodyne	ADRB3	26	40
COCc1nc(N2CCC[C@H](O)[C@H]2C)c2c(-c3ccccc3)csc2n1	ZINC000450719426	FH	On-Demand	Anodyne	ADRB3	26	40
CN(C)CCN(C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C1CC1	ZINC000450719428	ED	On-Demand	Anodyne	MBTPS1	44	31
COCc1nc(N2CCC[C@@H](O)[C@H]2C)c2c(-c3ccccc3)csc2n1	ZINC000450719429	FH	On-Demand	Anodyne	ADRB3	26	40
COCc1nc(N2CCC[C@@H](O)[C@@H]2C)c2c(-c3ccccc3)csc2n1	ZINC000450719431	FH	On-Demand	Anodyne	ADRB3	26	40
CCC(=O)CCCN1CCC(c2ccc(C)nc2)CC1	ZINC000450719442	CG	On-Demand	Anodyne	CYP2J2	47	34
COCCOC[C@H](O)CN1C[C@H](C)C[C@H]1c1cccc(OC)c1	ZINC000450719446	DE	On-Demand	Anodyne	HSP90AB1	31	44
COCCOC[C@H](O)CN1C[C@@H](C)C[C@H]1c1cccc(OC)c1	ZINC000450719448	DE	On-Demand	Anodyne	HSP90AB1	31	44
COCCOC[C@H](O)CN1C[C@H](C)C[C@@H]1c1cccc(OC)c1	ZINC000450719450	DE	On-Demand	Anodyne	HSP90AB1	31	44
COCCOC[C@H](O)CN1C[C@@H](C)C[C@@H]1c1cccc(OC)c1	ZINC000450719452	DE	On-Demand	Anodyne	HSP90AB1	31	44
CN(Cc1ccccc1)C1(CNc2ccc(S(N)(=O)=O)cn2)CCC1	ZINC000450719477	FE	On-Demand	Anodyne	LIMK2	42	35
CC[C@@](C)(CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450719496	EH	On-Demand	Anodyne	AVPR2	47	41
CC[C@@](C)(CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450719496	EH	On-Demand	Anodyne	GPBAR1	29	46
CC[C@](C)(CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450719497	EH	On-Demand	Anodyne	AVPR2	47	41
CC[C@](C)(CNc1ncccc1C(=O)N1CCc2ccccc21)OC	ZINC000450719497	EH	On-Demand	Anodyne	GPBAR1	29	46
COc1ccc(CNC(=O)CCN2Cc3ccccc3OC[C@@H]2C)c(OC)c1	ZINC000450719506	GF	On-Demand	Anodyne	MTNR1A	50	43
COc1ccc(CNC(=O)CCN2Cc3ccccc3OC[C@@H]2C)c(OC)c1	ZINC000450719506	GF	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc(CNC(=O)CCN2Cc3ccccc3OC[C@H]2C)c(OC)c1	ZINC000450719507	GF	On-Demand	Anodyne	MTNR1A	50	43
COc1ccc(CNC(=O)CCN2Cc3ccccc3OC[C@H]2C)c(OC)c1	ZINC000450719507	GF	On-Demand	Anodyne	MTNR1B	41	38
COC(=O)C1(CSc2nnc(-c3cccc(Cl)c3)o2)CCCC1	ZINC000450719517	FI	On-Demand	Anodyne	GSK3B	15	42
COC(=O)C1(CSc2nnc(-c3cccc(Cl)c3)o2)CCCC1	ZINC000450719517	FI	On-Demand	Anodyne	GSK3A	40	40
COC(=O)C1(CSc2nnc(-c3cccc(Cl)c3)o2)CCCC1	ZINC000450719517	FI	On-Demand	Anodyne	TERT	24	43
CC(=O)N[C@@H](C)C1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450719519	FG	On-Demand	Anodyne	L3MBTL3	41	33
CC(=O)N[C@H](C)C1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450719520	FG	On-Demand	Anodyne	L3MBTL3	41	33
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2CC[C@@H](C)O)c1	ZINC000450719523	EH	On-Demand	Anodyne	SLC6A1	28	43
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2CC[C@@H](C)O)c1	ZINC000450719523	EH	On-Demand	Anodyne	SLC6A3	19	43
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2CC[C@@H](C)O)c1	ZINC000450719523	EH	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2CC[C@@H](C)O)c1	ZINC000450719523	EH	On-Demand	Anodyne	HSD17B2	43	44
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2CC[C@H](C)O)c1	ZINC000450719524	EH	On-Demand	Anodyne	SLC6A1	28	43
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2CC[C@H](C)O)c1	ZINC000450719524	EH	On-Demand	Anodyne	SLC6A3	19	43
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2CC[C@H](C)O)c1	ZINC000450719524	EH	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2CC[C@H](C)O)c1	ZINC000450719524	EH	On-Demand	Anodyne	HSD17B2	43	44
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2CC[C@@H](C)O)c1	ZINC000450719525	EH	On-Demand	Anodyne	SLC6A1	28	43
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2CC[C@@H](C)O)c1	ZINC000450719525	EH	On-Demand	Anodyne	SLC6A3	19	43
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2CC[C@@H](C)O)c1	ZINC000450719525	EH	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2CC[C@@H](C)O)c1	ZINC000450719525	EH	On-Demand	Anodyne	HSD17B2	43	44
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2CC[C@H](C)O)c1	ZINC000450719526	EH	On-Demand	Anodyne	SLC6A1	28	43
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2CC[C@H](C)O)c1	ZINC000450719526	EH	On-Demand	Anodyne	SLC6A3	19	43
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2CC[C@H](C)O)c1	ZINC000450719526	EH	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2CC[C@H](C)O)c1	ZINC000450719526	EH	On-Demand	Anodyne	HSD17B2	43	44
COc1ccc(CNC(=O)CCN2CCC(c3ccc(C)nc3)CC2)c(OC)c1	ZINC000450719530	GG	On-Demand	Anodyne	PDGFRB	42	40
COc1ccc(CNC(=O)CCN2CCC(c3ccc(C)nc3)CC2)c(OC)c1	ZINC000450719530	GG	On-Demand	Anodyne	CSF1R	22	40
COc1ccc(CNC(=O)CCN2CCC(c3ccc(C)nc3)CC2)c(OC)c1	ZINC000450719530	GG	On-Demand	Anodyne	ALK	15	40
COc1ccc(CNC(=O)CCN2CCC(c3ccc(C)nc3)CC2)c(OC)c1	ZINC000450719530	GG	On-Demand	Anodyne	CARM1	59	35
Cc1cncn1C1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450719544	FI	On-Demand	Anodyne	L3MBTL3	41	35
CC(F)(F)C(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450719556	GH	On-Demand	Anodyne	RBP4	71	37
CC(F)(F)C(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450719556	GH	On-Demand	Anodyne	SFRP1	73	31
CC(F)(F)C(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450719556	GH	On-Demand	Anodyne	WNT3	48	29
CC(F)(F)C(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450719557	GH	On-Demand	Anodyne	RBP4	71	37
CC(F)(F)C(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450719557	GH	On-Demand	Anodyne	SFRP1	73	31
CC(F)(F)C(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450719557	GH	On-Demand	Anodyne	WNT3	48	29
CNS(=O)(=O)NCC(=O)N1CC=C(c2cccc(OC)c2)C1	ZINC000450719624	EB	On-Demand	Anodyne	DRD4	43	34
CNS(=O)(=O)NCC(=O)N1CC=C(c2cccc(OC)c2)C1	ZINC000450719624	EB	On-Demand	Anodyne	ADAM10	15	40
CC(=O)c1cccc(CN2CC[C@H](C(C)(C)C)C2)c1	ZINC000450719633	CH	On-Demand	Anodyne	CHRM2	15	43
CC(=O)c1cccc(CN2CC[C@H](C(C)(C)C)C2)c1	ZINC000450719633	CH	On-Demand	Anodyne	DRD2	17	50
CC(=O)c1cccc(CN2CC[C@H](C(C)(C)C)C2)c1	ZINC000450719633	CH	On-Demand	Anodyne	DRD4	35	43
CC(=O)c1cccc(CN2CC[C@H](C(C)(C)C)C2)c1	ZINC000450719633	CH	On-Demand	Anodyne	ACHE	33	46
CC(=O)c1cccc(CN2CC[C@H](C(C)(C)C)C2)c1	ZINC000450719633	CH	On-Demand	Anodyne	CHRM3	29	45
CC(=O)c1cccc(CN2CC[C@H](C(C)(C)C)C2)c1	ZINC000450719633	CH	On-Demand	Anodyne	CCR3	45	40
CC(=O)c1cccc(CN2CC[C@H](C(C)(C)C)C2)c1	ZINC000450719633	CH	On-Demand	Anodyne	MCHR1	27	40
CC(=O)c1cccc(CN2CC[C@H](C(C)(C)C)C2)c1	ZINC000450719633	CH	On-Demand	Anodyne	CYP2J2	49	35
CC(=O)c1cccc(CN2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450719634	CH	On-Demand	Anodyne	CHRM2	15	43
CC(=O)c1cccc(CN2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450719634	CH	On-Demand	Anodyne	DRD2	17	50
CC(=O)c1cccc(CN2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450719634	CH	On-Demand	Anodyne	DRD4	35	43
CC(=O)c1cccc(CN2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450719634	CH	On-Demand	Anodyne	ACHE	33	46
CC(=O)c1cccc(CN2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450719634	CH	On-Demand	Anodyne	CHRM3	29	45
CC(=O)c1cccc(CN2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450719634	CH	On-Demand	Anodyne	CCR3	45	40
CC(=O)c1cccc(CN2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450719634	CH	On-Demand	Anodyne	MCHR1	27	40
CC(=O)c1cccc(CN2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450719634	CH	On-Demand	Anodyne	CYP2J2	49	35
CCn1cnc2c(NCc3cc(C)cs3)ncnc21	ZINC000450719639	CF	On-Demand	Anodyne	CLK4	17	43
CC[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719640	FG	On-Demand	Anodyne	RBP4	75	38
CC[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719640	FG	On-Demand	Anodyne	SCD1	20	42
CC[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719640	FG	On-Demand	Anodyne	SFRP1	95	40
CC[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719640	FG	On-Demand	Anodyne	SCD	26	42
CC[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450719640	FG	On-Demand	Anodyne	WNT3	75	35
CCn1nnc(C)c1CSc1nnc(-c2cccc(C)c2)n1Cc1ccco1	ZINC000450719648	GI	On-Demand	Anodyne	HCRTR2	20	43
Cc1csc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)c1	ZINC000450719652	FG	On-Demand	Anodyne	LRRK2	29	43
CC(C)n1cc(C2=CCCN(c3ccc4ccccc4n3)CC2)nn1	ZINC000450719670	EI	On-Demand	Anodyne	HTR3A	22	40
CSCC[C@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450719691	FE	On-Demand	Anodyne	TRPC6	52	32
CSCC[C@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450719691	FE	On-Demand	Anodyne	TRPC3	46	32
CSCC[C@@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450719692	FE	On-Demand	Anodyne	TRPC6	52	32
CSCC[C@@H](CO)NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450719692	FE	On-Demand	Anodyne	TRPC3	46	32
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CC1	ZINC000450719707	GE	On-Demand	Anodyne	NPY2R	17	40
COc1cccc2c1CCN(CC[C@@H](C)O)C2	ZINC000450719715	BD	On-Demand	Anodyne	ABCB1	34	43
COc1cccc2c1CCN(CC[C@H](C)O)C2	ZINC000450719721	BD	On-Demand	Anodyne	ABCB1	34	43
Cc1nn(C)cc1CC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450719731	EH	On-Demand	Anodyne	JUN	25	43
Cc1nn(C)cc1CC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450719731	EH	On-Demand	Anodyne	ATF1	59	39
Cc1nn(C)cc1CC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450719731	EH	On-Demand	Anodyne	NFKB1	54	39
CC[C@](C)(CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-])OC	ZINC000450719740	FE	On-Demand	Bother	TAAR1	21	46
CC[C@@](C)(CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-])OC	ZINC000450719742	FE	On-Demand	Bother	TAAR1	21	46
CC[C@@](C)(CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-])OC	ZINC000450719744	FE	On-Demand	Bother	TAAR1	21	46
CC[C@](C)(CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-])OC	ZINC000450719746	FE	On-Demand	Bother	TAAR1	21	46
CCOc1ccccc1-c1nnc(SCc2nc(C(=O)OC)cs2)o1	ZINC000450719792	GH	On-Demand	Anodyne	ALOX15	61	39
Cc1ccc(C(=O)N2CCC(n3cncc3C)CC2)c2c1CCC2	ZINC000450719796	DG	On-Demand	Anodyne	L3MBTL3	73	42
CC[C@@](C)(CNc1nc2ccccc2nc1N1CCN(C)CC1)OC	ZINC000450719805	EF	On-Demand	Anodyne	HTR3A	22	48
CC[C@](C)(CNc1nc2ccccc2nc1N1CCN(C)CC1)OC	ZINC000450719806	EF	On-Demand	Anodyne	HTR3A	22	48
CCc1cc(CCCN2CCc3c(cccc3OC)C2)on1	ZINC000450719822	DG	On-Demand	Anodyne	HTR1A	20	40
CCc1cc(CCCN2CCc3c(cccc3OC)C2)on1	ZINC000450719822	DG	On-Demand	Anodyne	DRD2	23	42
CCc1cc(CCCN2CCc3c(cccc3OC)C2)on1	ZINC000450719822	DG	On-Demand	Anodyne	DRD4	17	44
CCc1cc(CCCN2CCc3c(cccc3OC)C2)on1	ZINC000450719822	DG	On-Demand	Anodyne	DRD3	26	42
CCc1cc(CCCN2CCc3c(cccc3OC)C2)on1	ZINC000450719822	DG	On-Demand	Anodyne	SIGMAR1	15	40
CCc1cc(CCCN2CCc3c(cccc3OC)C2)on1	ZINC000450719822	DG	On-Demand	Anodyne	ABCB1B	52	33
CCc1cc(CCCN2CCc3c(cccc3OC)C2)on1	ZINC000450719822	DG	On-Demand	Anodyne	ABCB1	20	40
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719843	GH	On-Demand	Anodyne	CACNA1H	48	34
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719843	GH	On-Demand	Anodyne	MC4R	66	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719843	GH	On-Demand	Anodyne	PRCP	60	44
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719843	GH	On-Demand	Anodyne	MC3R	49	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719843	GH	On-Demand	Anodyne	MC5R	40	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719843	GH	On-Demand	Anodyne	MC1R	34	41
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719843	GH	On-Demand	Anodyne	NPBWR1	52	37
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719844	GH	On-Demand	Anodyne	CACNA1H	48	34
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719844	GH	On-Demand	Anodyne	MC4R	66	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719844	GH	On-Demand	Anodyne	PRCP	60	44
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719844	GH	On-Demand	Anodyne	MC3R	49	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719844	GH	On-Demand	Anodyne	MC5R	40	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719844	GH	On-Demand	Anodyne	MC1R	34	41
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719844	GH	On-Demand	Anodyne	NPBWR1	52	37
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719845	GH	On-Demand	Anodyne	CACNA1H	48	34
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719845	GH	On-Demand	Anodyne	MC4R	66	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719845	GH	On-Demand	Anodyne	PRCP	60	44
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719845	GH	On-Demand	Anodyne	MC3R	49	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719845	GH	On-Demand	Anodyne	MC5R	40	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719845	GH	On-Demand	Anodyne	MC1R	34	41
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719845	GH	On-Demand	Anodyne	NPBWR1	52	37
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719846	GH	On-Demand	Anodyne	CACNA1H	48	34
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719846	GH	On-Demand	Anodyne	MC4R	66	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719846	GH	On-Demand	Anodyne	PRCP	60	44
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719846	GH	On-Demand	Anodyne	MC3R	49	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719846	GH	On-Demand	Anodyne	MC5R	40	47
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719846	GH	On-Demand	Anodyne	MC1R	34	41
CC(C)(C)NC(=O)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450719846	GH	On-Demand	Anodyne	NPBWR1	52	37
CSc1cccc(C(=O)N(CCN(C)C)C2CC2)c1	ZINC000450719849	CF	On-Demand	Anodyne	ACE	28	49
CCC(=O)c1ccc(NC[C@](C)(CC)OC)c([N+](=O)[O-])c1	ZINC000450719851	CG	On-Demand	Bother	TAAR1	17	45
CCC(=O)c1ccc(NC[C@@](C)(CC)OC)c([N+](=O)[O-])c1	ZINC000450719852	CG	On-Demand	Bother	TAAR1	17	45
Brc1cccc(-c2nnc(SCC[C@@H]3CCOC3)o2)c1	ZINC000450719857	FI	On-Demand	Anodyne	GSK3A	42	39
Brc1cccc(-c2nnc(SCC[C@@H]3CCOC3)o2)c1	ZINC000450719857	FI	On-Demand	Anodyne	TERT	25	49
Brc1cccc(-c2nnc(SCC[C@H]3CCOC3)o2)c1	ZINC000450719858	FI	On-Demand	Anodyne	GSK3A	42	39
Brc1cccc(-c2nnc(SCC[C@H]3CCOC3)o2)c1	ZINC000450719858	FI	On-Demand	Anodyne	TERT	25	49
CC[C@@](C)(CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450719862	ED	On-Demand	Anodyne	NPY2R	50	35
CC[C@](C)(CNc1ccc(S(=O)(=O)NCC2CC2)cn1)OC	ZINC000450719863	ED	On-Demand	Anodyne	NPY2R	50	35
CC(=O)NC1CCC(N(C)CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450719876	EG	On-Demand	Anodyne	LSS	17	46
COC(=O)c1csc(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)n1	ZINC000450719878	GJ	On-Demand	Anodyne	GSK3A	35	46
COC(=O)c1csc(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)n1	ZINC000450719878	GJ	On-Demand	Anodyne	ALOX15	44	38
COC[C@@H](CNc1cc(C)nc2ncnn12)c1ccc(Cl)cc1	ZINC000450719895	EF	On-Demand	Anodyne	DHOD	0	54
COC[C@H](CNc1cc(C)nc2ncnn12)c1ccc(Cl)cc1	ZINC000450719896	EF	On-Demand	Anodyne	DHOD	0	54
COc1cccc2c(NCc3nn(C)cc3Cl)c(C)cnc12	ZINC000450719906	DH	On-Demand	Anodyne	ATP4A	23	41
CCc1cc(CCCN2CC[C@H](c3cccc(C)c3)C2)on1	ZINC000450719915	CH	On-Demand	Anodyne	MGEA5	15	41
CCc1cc(CCCN2CC[C@@H](c3cccc(C)c3)C2)on1	ZINC000450719916	CH	On-Demand	Anodyne	MGEA5	15	41
O=C(CCCC(=O)C1CC1)NCc1nc(-c2cc3ccccc3o2)cs1	ZINC000450719933	FI	On-Demand	Anodyne	CDC25C	0	42
CCOC(=O)c1sc2ncnc(NCc3nn(C)cc3Cl)c2c1C	ZINC000450719938	FG	On-Demand	Anodyne	MKNK2	20	41
Cc1nc([C@@H]2CCCCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)no1	ZINC000450719939	GG	On-Demand	Anodyne	COLA	104	49
Cc1nc([C@@H]2CCCCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)no1	ZINC000450719939	GG	On-Demand	Anodyne	CPT1A	101	49
Cc1nc([C@@H]2CCCCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)no1	ZINC000450719939	GG	On-Demand	Anodyne	GRM5	24	46
Cc1nc([C@H]2CCCCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)no1	ZINC000450719940	GG	On-Demand	Anodyne	COLA	104	49
Cc1nc([C@H]2CCCCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)no1	ZINC000450719940	GG	On-Demand	Anodyne	CPT1A	101	49
Cc1nc([C@H]2CCCCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)no1	ZINC000450719940	GG	On-Demand	Anodyne	GRM5	24	46
COC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450719958	EE	On-Demand	Anodyne	HCN1	52	33
COC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450719958	EE	On-Demand	Anodyne	HCN4	49	33
CCN(CC)c1ccc(-c2nnc(SCc3cc[nH]n3)o2)cc1	ZINC000450720006	EH	On-Demand	Anodyne	GSK3B	17	41
CCN(CC)c1ccc(-c2nnc(SCc3cc[nH]n3)o2)cc1	ZINC000450720006	EH	On-Demand	Anodyne	GSK3A	49	39
CC(C)(CC(=O)Cn1cnc2ccc(Cl)cc2c1=O)C1CC1	ZINC000450720016	DG	On-Demand	Anodyne	Q8MHZ5_SHEEP	27	43
COc1ccc(SCCCCCC(C)=O)cc1	ZINC000450720017	CH	On-Demand	Anodyne	MTNR1A	24	40
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	HTR1A	42	43
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	DRD2	38	46
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	DRD4	47	36
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	HTR2A	15	41
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	SSTR2	43	38
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	DRD3	48	42
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	HTR7	48	46
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	SIGMAR1	16	43
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	HTR5A	17	40
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	ABCB1B	53	36
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	MTNR1A	75	40
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	MTNR1B	71	40
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	SSTR1	51	38
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	ABCB1	30	41
COc1ccc(CNC(=O)CCN2CCc3c(cccc3OC)C2)c(OC)c1	ZINC000450720018	GF	On-Demand	Anodyne	NOD2	40	39
COC1(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)CCC1	ZINC000450720030	EJ	On-Demand	Anodyne	TYMS	0	42
COC1(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)CCC1	ZINC000450720030	EJ	On-Demand	Anodyne	GSK3B	15	41
C=CCNC(=O)c1ccc(NC[C@@H](COC)c2ccc(Cl)cc2)nc1	ZINC000450720040	FG	On-Demand	Mild	UTS2	42	33
C=CCNC(=O)c1ccc(NC[C@H](COC)c2ccc(Cl)cc2)nc1	ZINC000450720042	FG	On-Demand	Mild	UTS2	42	33
CN(C)c1nc(NCc2nn(C)cc2Cl)nc2ccccc12	ZINC000450720050	DE	On-Demand	Anodyne	ADRA2A	15	45
CN(CCc1ccccc1O)CCN(C)Cc1ccccc1	ZINC000450720054	CF	On-Demand	Anodyne	FDPS	22	43
CN(CCc1ccccc1O)CCN(C)Cc1ccccc1	ZINC000450720054	CF	On-Demand	Anodyne	ACHE	0	43
CCOC(=O)C[C@@H](C)N(C)CCCC(=O)c1ccc(F)cc1	ZINC000450720062	DG	On-Demand	Anodyne	THRA	54	38
CCOC(=O)C[C@H](C)N(C)CCCC(=O)c1ccc(F)cc1	ZINC000450720063	DG	On-Demand	Anodyne	THRA	54	38
CCc1cc(NC[C@@H]2CCOC3(CCC3)C2)n2ncnc2n1	ZINC000450720068	DE	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@H]2CCOC3(CCC3)C2)n2ncnc2n1	ZINC000450720070	DE	On-Demand	Anodyne	DHOD	0	44
CCN(CC)c1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)o2)cc1	ZINC000450720071	GH	On-Demand	Anodyne	GSK3A	41	35
CC(C)(CC(=O)CSc1nnc(-c2cccc(Br)c2)o1)C1CC1	ZINC000450720083	GJ	On-Demand	Anodyne	TERT	21	42
CN(C)CCN(C(=O)c1ccn(CCc2ccccc2)n1)C1CC1	ZINC000450720088	EE	On-Demand	Anodyne	OPRM1	15	42
CN(C)CCN(C(=O)c1ccn(CCc2ccccc2)n1)C1CC1	ZINC000450720088	EE	On-Demand	Anodyne	OPRD1	15	42
CN(C)CCN(C(=O)c1ccn(CCc2ccccc2)n1)C1CC1	ZINC000450720088	EE	On-Demand	Anodyne	MBTPS1	51	31
CCN(CC)c1ccc(-c2nnc(SCc3nc(C(=O)OC)co3)o2)cc1	ZINC000450720098	GH	On-Demand	Anodyne	GSK3B	0	44
CCN(CC)c1ccc(-c2nnc(SCc3nc(C(=O)OC)co3)o2)cc1	ZINC000450720098	GH	On-Demand	Anodyne	GSK3A	38	44
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000450720132	GF	On-Demand	Bother	BDKRB1	21	40
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000450720133	GF	On-Demand	Bother	BDKRB1	21	40
O=[N+]([O-])c1ccc(NC[C@@H]2CC23CCOCC3)cc1C(F)(F)F	ZINC000450720136	EH	On-Demand	Bother	AADAC	0	43
O=[N+]([O-])c1ccc(NC[C@H]2CC23CCOCC3)cc1C(F)(F)F	ZINC000450720137	EH	On-Demand	Bother	AADAC	0	43
CN1Cc2cc(NC(=O)c3cnc(C4CC4)nc3)ccc2NC1=O	ZINC000450720139	DF	On-Demand	Anodyne	HTR1F	29	41
CN1Cc2cc(NC(=O)c3cnc(C4CC4)nc3)ccc2NC1=O	ZINC000450720139	DF	On-Demand	Anodyne	BRD4	0	44
COC(=O)C1(CN[C@@H](c2cccnc2)C2CC2)CC1	ZINC000450720151	CE	On-Demand	Anodyne	KCNA5	22	42
COC(=O)C1(CN[C@H](c2cccnc2)C2CC2)CC1	ZINC000450720160	CE	On-Demand	Anodyne	KCNA5	22	42
Cc1csc(CNc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])c1	ZINC000450720162	GE	On-Demand	Bother	BDKRB1	0	47
Cc1cccc([C@H]2CCN(Cc3nnc(C4CC4)s3)C2)c1	ZINC000450720168	CH	On-Demand	Anodyne	VACHT_TETCF	0	44
Cc1cccc([C@H]2CCN(Cc3nnc(C4CC4)s3)C2)c1	ZINC000450720168	CH	On-Demand	Anodyne	MGEA5	25	46
CNS(=O)(=O)c1ccc(NCC2(N(C)Cc3ccccc3)CCC2)nc1	ZINC000450720176	FE	On-Demand	Anodyne	LIMK2	48	37
Cc1cccc([C@@H]2CCN(Cc3nnc(C4CC4)s3)C2)c1	ZINC000450720185	CH	On-Demand	Anodyne	VACHT_TETCF	0	44
Cc1cccc([C@@H]2CCN(Cc3nnc(C4CC4)s3)C2)c1	ZINC000450720185	CH	On-Demand	Anodyne	MGEA5	25	46
CCOC(=O)c1ccc(CN2CCC(CCC(=O)N(CC)CC)CC2)nc1	ZINC000450720188	GG	On-Demand	Anodyne	ACHE	24	43
CCOC(=O)c1ccc(CN2CCC(CCC(=O)N(CC)CC)CC2)nc1	ZINC000450720188	GG	On-Demand	Anodyne	SSTR5	47	42
CC(C)NC(=O)c1ccc(NCc2nn(C)cc2Cl)c([N+](=O)[O-])c1	ZINC000450720193	FF	On-Demand	Bother	TAAR1	16	40
COCCNC(=O)c1ccc(NCC2(N(C)Cc3ccccc3)CCC2)nc1	ZINC000450720200	GF	On-Demand	Anodyne	CASR	15	40
CCCc1nc(C)c(CSc2nnc(-c3cccc(Br)c3)o2)o1	ZINC000450720202	GK	On-Demand	Anodyne	GSK3A	47	37
CCCc1nc(C)c(CSc2nnc(-c3cccc(Br)c3)o2)o1	ZINC000450720202	GK	On-Demand	Anodyne	TERT	25	46
CC(C)OC(=O)C[C@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450720217	DE	On-Demand	Anodyne	MAN1B1	50	31
CC(C)OC(=O)C[C@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450720221	DE	On-Demand	Anodyne	MAN1B1	50	31
CC(C)OC(=O)C[C@@H](NC[C@@H]1COCCO1)c1ccccc1	ZINC000450720222	DE	On-Demand	Anodyne	MAN1B1	50	31
CC(C)OC(=O)C[C@@H](NC[C@H]1COCCO1)c1ccccc1	ZINC000450720225	DE	On-Demand	Anodyne	MAN1B1	50	31
COC(=O)c1ccc(CN[C@H](c2cccnc2)C2CC2)cc1Cl	ZINC000450720228	EH	On-Demand	Anodyne	ADRB3	30	40
COC(=O)c1ccc(CN[C@H](c2cccnc2)C2CC2)cc1Cl	ZINC000450720228	EH	On-Demand	Anodyne	KCNA5	41	37
COC(=O)c1ccc(CN[C@@H](c2cccnc2)C2CC2)cc1Cl	ZINC000450720230	EH	On-Demand	Anodyne	ADRB3	30	40
COC(=O)c1ccc(CN[C@@H](c2cccnc2)C2CC2)cc1Cl	ZINC000450720230	EH	On-Demand	Anodyne	KCNA5	41	37
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	DRD2	16	43
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	ACHE	59	58
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	HRH1	15	47
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	OPRD1	23	53
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	CHRM3	23	43
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	SIGMAR1	41	41
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	SSTR5	46	37
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	CCR3	49	47
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450720244	EH	On-Demand	Anodyne	CACNA1I	54	41
Cc1ccnc(-c2noc(CSc3nc(C)c(C)n3CC(C)C)n2)c1	ZINC000450720268	FI	On-Demand	Anodyne	TNKS2	15	40
CN(C)CCN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C1CC1	ZINC000450720272	FE	On-Demand	Mild	NR3C2	34	41
CN(C)CCN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C1CC1	ZINC000450720272	FE	On-Demand	Mild	AR	21	43
CN(C)CCN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C1CC1	ZINC000450720273	FE	On-Demand	Mild	NR3C2	34	41
CN(C)CCN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C1CC1	ZINC000450720273	FE	On-Demand	Mild	AR	21	43
CC(F)(F)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450720287	DJ	On-Demand	Anodyne	GSK3B	18	49
CC(F)(F)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450720287	DJ	On-Demand	Anodyne	GSK3A	46	37
CC(F)(F)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450720287	DJ	On-Demand	Anodyne	TERT	25	47
CC(F)(F)CCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450720287	DJ	On-Demand	Anodyne	CYP73A16	16	48
Cc1ccc(C(=O)N(CCN(C)C)C2CC2)c2c1CCC2	ZINC000450720296	CF	On-Demand	Anodyne	ACE	45	33
Cc1onc(C2CC2)c1C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450720299	EJ	On-Demand	Anodyne	JUN	25	41
Cc1onc(C2CC2)c1C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450720299	EJ	On-Demand	Anodyne	ATF1	58	39
Cc1onc(C2CC2)c1C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450720299	EJ	On-Demand	Anodyne	NFKB1	54	39
COc1cc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)ccc1O	ZINC000450720301	ED	On-Demand	Anodyne	TRPV1	40	50
COc1cc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)ccc1O	ZINC000450720301	ED	On-Demand	Anodyne	NCE103	25	42
COc1cc(CC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)ccc1O	ZINC000450720301	ED	On-Demand	Anodyne	CAN2	0	42
c1cn(CCCC2CCN(Cc3cn(CC4CC4)nn3)CC2)cn1	ZINC000450720302	EF	On-Demand	Anodyne	CAMC	0	41
CC(=O)N[C@H](C)C1CCN(C(=O)c2cc(Br)c(C)cc2C)CC1	ZINC000450720304	GG	On-Demand	Anodyne	L3MBTL1	0	43
CC(=O)N[C@H](C)C1CCN(C(=O)c2cc(Br)c(C)cc2C)CC1	ZINC000450720304	GG	On-Demand	Anodyne	L3MBTL3	19	43
CC(=O)N[C@@H](C)C1CCN(C(=O)c2cc(Br)c(C)cc2C)CC1	ZINC000450720310	GG	On-Demand	Anodyne	L3MBTL1	0	43
CC(=O)N[C@@H](C)C1CCN(C(=O)c2cc(Br)c(C)cc2C)CC1	ZINC000450720310	GG	On-Demand	Anodyne	L3MBTL3	19	43
C=C(C)CCNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450720318	BG	On-Demand	Mild	TAAR1	16	44
CC[C@](C)(CNc1ncc([N+](=O)[O-])c(C)n1)OC	ZINC000450720330	CD	On-Demand	Bother	PRKCQ	44	35
COc1ccc(CNC(=O)CCN[C@@]2(C)CCO[C@H]2C2CC2)c(OC)c1	ZINC000450720332	FE	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN[C@@]2(C)CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450720333	FE	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN[C@]2(C)CCO[C@H]2C2CC2)c(OC)c1	ZINC000450720334	FE	On-Demand	Anodyne	MTNR1A	43	36
CC[C@@](C)(CNc1ncc([N+](=O)[O-])c(C)n1)OC	ZINC000450720335	CD	On-Demand	Bother	PRKCQ	44	35
COc1ccc(CNC(=O)CCN[C@]2(C)CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450720337	FE	On-Demand	Anodyne	MTNR1A	43	36
CC[C@@](C)(CNc1ccc2nnc(-c3ccccc3)n2n1)OC	ZINC000450720338	DE	On-Demand	Anodyne	LRRK2	34	43
CC(=O)[C@@](C)(O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720339	CE	On-Demand	Anodyne	DRD4	0	46
CC(=O)[C@@](C)(O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720339	CE	On-Demand	Anodyne	CCR5	47	34
CC(=O)[C@@](C)(O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720339	CE	On-Demand	Anodyne	MGEA5	25	48
CC[C@](C)(CNc1ccc2nnc(-c3ccccc3)n2n1)OC	ZINC000450720340	DE	On-Demand	Anodyne	LRRK2	34	43
CC(=O)[C@@](C)(O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720344	CE	On-Demand	Anodyne	DRD4	0	46
CC(=O)[C@@](C)(O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720344	CE	On-Demand	Anodyne	CCR5	47	34
CC(=O)[C@@](C)(O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720344	CE	On-Demand	Anodyne	MGEA5	25	48
CC(=O)[C@](C)(O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720345	CE	On-Demand	Anodyne	DRD4	0	46
CC(=O)[C@](C)(O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720345	CE	On-Demand	Anodyne	CCR5	47	34
CC(=O)[C@](C)(O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720345	CE	On-Demand	Anodyne	MGEA5	25	48
CC(=O)[C@](C)(O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720347	CE	On-Demand	Anodyne	DRD4	0	46
CC(=O)[C@](C)(O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720347	CE	On-Demand	Anodyne	CCR5	47	34
CC(=O)[C@](C)(O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720347	CE	On-Demand	Anodyne	MGEA5	25	48
COC1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCCCC1	ZINC000450720376	EG	On-Demand	Anodyne	HCN1	63	42
COC1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCCCC1	ZINC000450720376	EG	On-Demand	Anodyne	HCN4	58	39
COc1cccc(OCCC(=O)N2CCOC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450720378	GF	On-Demand	Anodyne	COLA	69	38
COc1cccc(OCCC(=O)N2CCOC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450720378	GF	On-Demand	Anodyne	CPT1A	65	38
COc1cccc(OCCC(=O)N2CCOC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450720381	GF	On-Demand	Anodyne	COLA	69	38
COc1cccc(OCCC(=O)N2CCOC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450720381	GF	On-Demand	Anodyne	CPT1A	65	38
CC[C@@](C)(CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450720382	FD	On-Demand	Anodyne	PDE5A	24	40
CC[C@@](C)(CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450720382	FD	On-Demand	Anodyne	TGM2	15	43
CCC[C@H](O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720383	BF	On-Demand	Anodyne	VACHT_TETCF	0	44
CCC[C@H](O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720383	BF	On-Demand	Anodyne	SLC18A3	17	51
CCC[C@H](O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720384	BF	On-Demand	Anodyne	VACHT_TETCF	0	44
CCC[C@H](O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720384	BF	On-Demand	Anodyne	SLC18A3	17	51
CCC[C@@H](O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720385	BF	On-Demand	Anodyne	VACHT_TETCF	0	44
CCC[C@@H](O)CN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720385	BF	On-Demand	Anodyne	SLC18A3	17	51
CC[C@](C)(CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450720386	FD	On-Demand	Anodyne	PDE5A	24	40
CC[C@](C)(CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)OC	ZINC000450720386	FD	On-Demand	Anodyne	TGM2	15	43
CCC[C@@H](O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720387	BF	On-Demand	Anodyne	VACHT_TETCF	0	44
CCC[C@@H](O)CN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720387	BF	On-Demand	Anodyne	SLC18A3	17	51
COc1cc(Br)c(C(=O)NCC2(OC)CCCCC2)cc1OC	ZINC000450720389	GH	On-Demand	Anodyne	KCNA3	42	37
COc1cc(Br)c(C(=O)NCC2(OC)CCCCC2)cc1OC	ZINC000450720389	GH	On-Demand	Anodyne	HCN1	58	42
COc1cc(Br)c(C(=O)NCC2(OC)CCCCC2)cc1OC	ZINC000450720389	GH	On-Demand	Anodyne	HCN4	54	40
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450720403	GG	On-Demand	Anodyne	RBP4	106	44
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450720403	GG	On-Demand	Anodyne	SFRP1	65	39
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450720403	GG	On-Demand	Anodyne	TRPM8	17	42
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450720403	GG	On-Demand	Anodyne	WNT3	70	39
CCS(=O)(=O)c1ccc(CN2CCc3c(cccc3OC)C2)cc1	ZINC000450720408	EG	On-Demand	Anodyne	DRD4	23	42
CCS(=O)(=O)c1ccc(CN2CCc3c(cccc3OC)C2)cc1	ZINC000450720408	EG	On-Demand	Anodyne	ABCB1	23	46
CCS(=O)(=O)c1ccc(CN2CCc3c(cccc3OC)C2)cc1	ZINC000450720408	EG	On-Demand	Anodyne	NOD1	31	43
CCS(=O)(=O)c1ccc(CN2CCc3c(cccc3OC)C2)cc1	ZINC000450720408	EG	On-Demand	Anodyne	NOD2	48	43
CC(=O)N[C@H](C)C1CCN(C(=O)CCCC(C)C)CC1	ZINC000450720410	CF	On-Demand	Anodyne	GNAI1	0	40
CC(=O)N[C@@H](C)C1CCN(C(=O)CCCC(C)C)CC1	ZINC000450720413	CF	On-Demand	Anodyne	GNAI1	0	40
C[C@H](O)CCN1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450720414	DD	On-Demand	Anodyne	RBP4	68	36
C[C@H](O)CCN1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450720418	DD	On-Demand	Anodyne	RBP4	68	36
C[C@@H](O)CCN1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450720421	DD	On-Demand	Anodyne	RBP4	68	36
C[C@@H](O)CCN1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450720424	DD	On-Demand	Anodyne	RBP4	68	36
Cc1nc(S[C@H](C)C(=O)Nc2nccs2)n(CC(C)C)c1C	ZINC000450720428	EH	On-Demand	Anodyne	MAP	0	41
Cc1nc(S[C@H](C)C(=O)Nc2nccs2)n(CC(C)C)c1C	ZINC000450720428	EH	On-Demand	Anodyne	MAP1	101	41
Cc1nc(S[C@@H](C)C(=O)Nc2nccs2)n(CC(C)C)c1C	ZINC000450720444	EH	On-Demand	Anodyne	MAP	0	41
Cc1nc(S[C@@H](C)C(=O)Nc2nccs2)n(CC(C)C)c1C	ZINC000450720444	EH	On-Demand	Anodyne	MAP1	101	41
COc1cc(CN2CCOCC3(CC3)C2)ccc1Cl	ZINC000450720485	CF	On-Demand	Anodyne	SRC	32	41
COc1cccc2c1CCN(C[C@@H](C)S(C)(=O)=O)C2	ZINC000450720496	CD	On-Demand	Anodyne	HTR1A	18	51
COc1cccc2c1CCN(C[C@@H](C)S(C)(=O)=O)C2	ZINC000450720496	CD	On-Demand	Anodyne	AKR1C3	20	49
COc1cccc2c1CCN(C[C@H](C)S(C)(=O)=O)C2	ZINC000450720498	CD	On-Demand	Anodyne	HTR1A	18	51
COc1cccc2c1CCN(C[C@H](C)S(C)(=O)=O)C2	ZINC000450720498	CD	On-Demand	Anodyne	AKR1C3	20	49
Cc1ncsc1CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450720499	FE	On-Demand	Bother	BDKRB1	22	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450720508	FH	On-Demand	Anodyne	OPRM1	15	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450720508	FH	On-Demand	Anodyne	COLA	114	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450720508	FH	On-Demand	Anodyne	CPT1A	99	45
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450720508	FH	On-Demand	Anodyne	BRCA1	43	30
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450720510	FH	On-Demand	Anodyne	OPRM1	15	46
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450720510	FH	On-Demand	Anodyne	COLA	114	46
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450720510	FH	On-Demand	Anodyne	CPT1A	99	45
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450720510	FH	On-Demand	Anodyne	BRCA1	43	30
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450720513	FH	On-Demand	Anodyne	OPRM1	15	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450720513	FH	On-Demand	Anodyne	COLA	114	46
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450720513	FH	On-Demand	Anodyne	CPT1A	99	45
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450720513	FH	On-Demand	Anodyne	BRCA1	43	30
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450720515	FH	On-Demand	Anodyne	OPRM1	15	46
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450720515	FH	On-Demand	Anodyne	COLA	114	46
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450720515	FH	On-Demand	Anodyne	CPT1A	99	45
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450720515	FH	On-Demand	Anodyne	BRCA1	43	30
CN(CCN[C@H](c1cccnc1)C1CC1)Cc1ccccc1	ZINC000450720539	CG	On-Demand	Anodyne	KCNA5	26	41
CN(CCN[C@@H](c1cccnc1)C1CC1)Cc1ccccc1	ZINC000450720540	CG	On-Demand	Anodyne	KCNA5	26	41
CCOC(=O)c1ccc(CN2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)nc1	ZINC000450720542	GH	On-Demand	Anodyne	GPR119	0	41
CCOC(=O)c1ccc(CN2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)nc1	ZINC000450720543	GH	On-Demand	Anodyne	GPR119	0	41
COc1cc(CN[C@@H](CO)C2CCOCC2)ccc1Cl	ZINC000450720545	CE	On-Demand	Anodyne	PDE5A	18	41
COc1cc(CN[C@H](CO)C2CCOCC2)ccc1Cl	ZINC000450720546	CE	On-Demand	Anodyne	PDE5A	18	41
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	DRD2	20	40
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	HTR4	64	42
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	HTR7	36	45
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	SIGMAR1	18	41
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	MTNR1B	45	36
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	EBP	50	37
COc1ccc(CNC(=O)CCN2CCC(CCCO)CC2)c(OC)c1	ZINC000450720549	FE	On-Demand	Anodyne	CACNA1I	49	37
CCOC(=O)[C@H](CO)NC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450720557	DC	On-Demand	Anodyne	HLA-DRB3	45	31
CCOC(=O)[C@@H](CO)NC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450720558	DC	On-Demand	Anodyne	HLA-DRB3	45	31
CCOC(=O)[C@H](CO)NC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450720559	DC	On-Demand	Anodyne	HLA-DRB3	45	31
CCOC(=O)[C@@H](CO)NC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450720560	DC	On-Demand	Anodyne	HLA-DRB3	45	31
COC(=O)C1(CSc2nnc(-c3cccc(Br)c3)o2)CCCC1	ZINC000450720589	GI	On-Demand	Anodyne	GSK3B	0	42
COC(=O)C1(CSc2nnc(-c3cccc(Br)c3)o2)CCCC1	ZINC000450720589	GI	On-Demand	Anodyne	GSK3A	41	41
COC(=O)C1(CSc2nnc(-c3cccc(Br)c3)o2)CCCC1	ZINC000450720589	GI	On-Demand	Anodyne	TERT	24	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720592	ED	On-Demand	Anodyne	GHRHR	62	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720592	ED	On-Demand	Anodyne	MME	50	42
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720592	ED	On-Demand	Anodyne	TRY2_BOVIN	57	35
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720592	ED	On-Demand	Anodyne	ACE2	53	36
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720592	ED	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720593	ED	On-Demand	Anodyne	GHRHR	62	34
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720593	ED	On-Demand	Anodyne	MME	50	42
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720593	ED	On-Demand	Anodyne	TRY2_BOVIN	57	35
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720593	ED	On-Demand	Anodyne	ACE2	53	36
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450720593	ED	On-Demand	Anodyne	POL	0	40
O=C(CC1(O)CCC1)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450720594	GF	On-Demand	Anodyne	LTA4H	35	42
O=C(CC[C@@H]1CCCCO1)CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450720603	FI	On-Demand	Anodyne	GRM5	15	40
O=C(CC[C@@H]1CCCCO1)CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450720603	FI	On-Demand	Anodyne	TERT	0	43
O=C(CC[C@H]1CCCCO1)CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450720604	FI	On-Demand	Anodyne	GRM5	15	40
O=C(CC[C@H]1CCCCO1)CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000450720604	FI	On-Demand	Anodyne	TERT	0	43
Cn1c(CNC(=O)CC[C@H]2CCC(=O)N2)nc2cccc(Cl)c21	ZINC000450720617	ED	On-Demand	Anodyne	HTR7	22	41
Cn1c(CNC(=O)CC[C@@H]2CCC(=O)N2)nc2cccc(Cl)c21	ZINC000450720618	ED	On-Demand	Anodyne	HTR7	22	41
N#Cc1ccc(NC[C@@H]2CCOC3(CCC3)C2)cc1C(F)(F)F	ZINC000450720622	DI	On-Demand	Mild	AR	43	43
N#Cc1ccc(NC[C@H]2CCOC3(CCC3)C2)cc1C(F)(F)F	ZINC000450720623	DI	On-Demand	Mild	AR	38	40
O=C1CC[C@@H](CN2CCNC(=O)[C@@H]2Cc2ccccc2)CCN1	ZINC000450720641	DC	On-Demand	Anodyne	GHRL	51	34
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720642	GF	On-Demand	Mild	EPHX2	29	42
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720642	GF	On-Demand	Mild	RBP4	78	42
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720642	GF	On-Demand	Mild	SCD1	22	44
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720642	GF	On-Demand	Mild	SFRP1	111	40
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720642	GF	On-Demand	Mild	SCD	25	40
C[C@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720642	GF	On-Demand	Mild	WNT3	75	34
O=C1CC[C@H](CN2CCNC(=O)[C@@H]2Cc2ccccc2)CCN1	ZINC000450720643	DC	On-Demand	Anodyne	GHRL	51	34
O=C1CC[C@@H](CN2CCNC(=O)[C@H]2Cc2ccccc2)CCN1	ZINC000450720644	DC	On-Demand	Anodyne	GHRL	51	34
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720645	GF	On-Demand	Mild	EPHX2	29	42
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720645	GF	On-Demand	Mild	RBP4	78	42
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720645	GF	On-Demand	Mild	SCD1	22	44
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720645	GF	On-Demand	Mild	SFRP1	111	40
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720645	GF	On-Demand	Mild	SCD	25	40
C[C@@H]1C[C@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720645	GF	On-Demand	Mild	WNT3	75	34
O=C1CC[C@H](CN2CCNC(=O)[C@H]2Cc2ccccc2)CCN1	ZINC000450720646	DC	On-Demand	Anodyne	GHRL	51	34
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720647	GF	On-Demand	Mild	EPHX2	29	42
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720647	GF	On-Demand	Mild	RBP4	78	42
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720647	GF	On-Demand	Mild	SCD1	22	44
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720647	GF	On-Demand	Mild	SFRP1	111	40
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720647	GF	On-Demand	Mild	SCD	25	40
C[C@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720647	GF	On-Demand	Mild	WNT3	75	34
COC(=O)[C@@H](NCc1cn(C)nc1C)c1ccc(Cl)cc1Cl	ZINC000450720648	EG	On-Demand	Anodyne	DPP9	41	35
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720649	GF	On-Demand	Mild	EPHX2	29	42
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720649	GF	On-Demand	Mild	RBP4	78	42
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720649	GF	On-Demand	Mild	SCD1	22	44
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720649	GF	On-Demand	Mild	SFRP1	111	40
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720649	GF	On-Demand	Mild	SCD	25	40
C[C@@H]1C[C@@]1(C#N)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450720649	GF	On-Demand	Mild	WNT3	75	34
COC(=O)[C@H](NCc1cn(C)nc1C)c1ccc(Cl)cc1Cl	ZINC000450720650	EG	On-Demand	Anodyne	DPP9	41	35
CNC(=O)c1ccc(NC[C@@H](COC)c2ccc(Cl)cc2)c([N+](=O)[O-])c1	ZINC000450720654	GG	On-Demand	Bother	TAAR1	19	42
CNC(=O)c1ccc(NC[C@H](COC)c2ccc(Cl)cc2)c([N+](=O)[O-])c1	ZINC000450720655	GG	On-Demand	Bother	TAAR1	19	42
CC(=O)N[C@@H](C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450720699	GF	On-Demand	Bother	CACNA1B	38	40
CC(=O)N[C@@H](C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450720699	GF	On-Demand	Bother	PPXII	0	40
CC(=O)N[C@H](C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450720700	GF	On-Demand	Bother	CACNA1B	38	40
CC(=O)N[C@H](C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450720700	GF	On-Demand	Bother	PPXII	0	40
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	HTR1A	19	58
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	DRD2	41	67
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	DRD1	26	49
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	DRD4	24	53
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	ADRA1D	31	42
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	HTR2A	46	53
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	HTR2C	24	58
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	ADRA1A	31	42
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	HRH1	20	53
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	ADRA1B	24	45
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	DRD3	17	53
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	ERG2	21	45
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	HTR1F	25	40
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	HTR7	22	45
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	SIGMAR1	22	55
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	PRCP	22	41
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	SLC18A3	17	48
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	HTR3B	0	45
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	MCHR1	31	58
Cc1ccc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)cn1	ZINC000450720708	EI	On-Demand	Anodyne	CYP2J2	60	44
CCC(=O)CCCN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720723	CH	On-Demand	Anodyne	DRD2	19	57
CCC(=O)CCCN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720723	CH	On-Demand	Anodyne	DRD4	17	45
CCC(=O)CCCN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720723	CH	On-Demand	Anodyne	VACHT_TETCF	0	40
CCC(=O)CCCN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720723	CH	On-Demand	Anodyne	MCHR1	31	49
CCC(=O)CCCN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720723	CH	On-Demand	Anodyne	CYP2J2	48	37
CCC(=O)CCCN1CC[C@H](c2cccc(C)c2)C1	ZINC000450720723	CH	On-Demand	Anodyne	MGEA5	23	44
CCC(=O)CCCN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720724	CH	On-Demand	Anodyne	DRD2	19	57
CCC(=O)CCCN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720724	CH	On-Demand	Anodyne	DRD4	17	45
CCC(=O)CCCN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720724	CH	On-Demand	Anodyne	VACHT_TETCF	0	40
CCC(=O)CCCN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720724	CH	On-Demand	Anodyne	MCHR1	31	49
CCC(=O)CCCN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720724	CH	On-Demand	Anodyne	CYP2J2	48	37
CCC(=O)CCCN1CC[C@@H](c2cccc(C)c2)C1	ZINC000450720724	CH	On-Demand	Anodyne	MGEA5	23	44
COC[C@H](CNc1nc(C(N)=O)cs1)c1ccc(Cl)cc1	ZINC000450720725	EE	On-Demand	Anodyne	TRPC6	40	38
COC[C@@H](CNc1nc(C(N)=O)cs1)c1ccc(Cl)cc1	ZINC000450720726	EE	On-Demand	Anodyne	TRPC6	40	38
C[C@H]1C[C@@H](C(=O)NCCc2nn(C)c3ccccc23)CC[C@H]1C	ZINC000450720729	DG	On-Demand	Anodyne	MTNR1A	24	42
C[C@@H]1CC[C@H](C(=O)NCCc2nn(C)c3ccccc23)C[C@H]1C	ZINC000450720730	DG	On-Demand	Anodyne	MTNR1A	24	42
C[C@H]1C[C@H](C(=O)NCCc2nn(C)c3ccccc23)CC[C@H]1C	ZINC000450720731	DG	On-Demand	Anodyne	MTNR1A	24	42
C[C@@H]1CC[C@@H](C(=O)NCCc2nn(C)c3ccccc23)C[C@H]1C	ZINC000450720732	DG	On-Demand	Anodyne	MTNR1A	24	42
COC[C@H](CNc1ccc(C(C)=O)cn1)c1ccc(Cl)cc1	ZINC000450720746	DH	On-Demand	Anodyne	GCK	26	42
COC[C@@H](CNc1ccc(C(C)=O)cn1)c1ccc(Cl)cc1	ZINC000450720747	DH	On-Demand	Anodyne	GCK	26	42
C[C@@H]1[C@@H](O)CCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450720767	DE	On-Demand	Anodyne	SCD1	36	45
C[C@@H]1[C@H](O)CCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450720768	DE	On-Demand	Anodyne	SCD1	36	45
C[C@H]1[C@H](O)CCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450720769	DE	On-Demand	Anodyne	SCD1	36	45
C[C@H]1[C@@H](O)CCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450720770	DE	On-Demand	Anodyne	SCD1	36	45
CN(C)CCN(C(=O)c1ccc(OC(F)F)c(F)c1)C1CC1	ZINC000450720785	DF	On-Demand	Anodyne	THRA	0	42
CN(C)CCN(C(=O)c1ccc(OC(F)F)c(F)c1)C1CC1	ZINC000450720785	DF	On-Demand	Anodyne	PDEC	0	40
CCN(CC)C(=O)CCC1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450720792	FH	On-Demand	Anodyne	ACHE	35	42
CCN(CC)C(=O)CCC1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450720792	FH	On-Demand	Anodyne	SLC6A3	20	45
CCN(CC)C(=O)CCC1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450720794	FH	On-Demand	Anodyne	ACHE	35	42
CCN(CC)C(=O)CCC1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450720794	FH	On-Demand	Anodyne	SLC6A3	20	45
FC1(F)CC[C@@H](CSc2nnc(-c3cccc(Cl)c3)o2)C1	ZINC000450720795	EJ	On-Demand	Anodyne	TERT	22	44
FC1(F)CC[C@H](CSc2nnc(-c3cccc(Cl)c3)o2)C1	ZINC000450720797	EJ	On-Demand	Anodyne	TERT	22	44
COC(=O)c1ccc(CC(=O)N(CCN(C)C)C2CC2)cc1	ZINC000450720836	DD	On-Demand	Anodyne	MBTPS1	40	32
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450720841	GG	On-Demand	Anodyne	EPHX2	16	41
CC(C)(C)NC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450720841	GG	On-Demand	Anodyne	TRPM8	57	47
C=C(C)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450720847	DE	On-Demand	Mild	BDKRB1	0	47
C=C(C)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450720847	DE	On-Demand	Mild	COLA	49	31
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450720855	GG	On-Demand	Anodyne	RBP4	84	37
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450720859	GG	On-Demand	Anodyne	RBP4	84	37
CCS(=O)(=O)c1ccc(CN(CCO)Cc2ccc(C)cc2)cc1	ZINC000450720864	EF	On-Demand	Anodyne	RORC	25	62
C=C(C)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450720884	DE	On-Demand	Mild	BCL2	19	41
Cc1ccn(-c2ccccc2C(=O)N2CCN(C(=O)NC(C)(C)C)CC2)n1	ZINC000450720896	FE	On-Demand	Anodyne	AVPR2	19	40
CCN(CC)C(=O)CCC1CCN(Cc2nc(-c3cc(C)ccn3)no2)CC1	ZINC000450720906	GG	On-Demand	Anodyne	ACHE	24	41
Cc1ccccc1-c1nnc(S[C@@H]2C[C@H](C)CCC2=O)n1Cc1ccco1	ZINC000450720931	GJ	On-Demand	Anodyne	HCRTR2	21	43
Cc1ccccc1-c1nnc(S[C@@H]2C[C@@H](C)CCC2=O)n1Cc1ccco1	ZINC000450720932	GJ	On-Demand	Anodyne	HCRTR2	21	43
Cc1ccccc1-c1nnc(S[C@H]2C[C@H](C)CCC2=O)n1Cc1ccco1	ZINC000450720933	GJ	On-Demand	Anodyne	HCRTR2	21	43
Cc1ccccc1-c1nnc(S[C@H]2C[C@@H](C)CCC2=O)n1Cc1ccco1	ZINC000450720934	GJ	On-Demand	Anodyne	HCRTR2	21	43
Cc1csc(CNc2cc(N3CCC[C@@H](CO)C3)ncn2)c1	ZINC000450720945	DF	On-Demand	Anodyne	PRCP	0	44
Cc1csc(CNc2cc(N3CCC[C@H](CO)C3)ncn2)c1	ZINC000450720946	DF	On-Demand	Anodyne	PRCP	0	44
COc1ccc(CC(=O)NCCc2nn(C)c3ccccc23)c(Cl)c1OC	ZINC000450720951	GG	On-Demand	Anodyne	IMDH_CRYPV	18	41
CCN(CC)c1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1	ZINC000450720964	FH	On-Demand	Anodyne	GSK3A	40	38
CCN(CC)c1ccc(-c2nnc(SCc3cn(C)nc3C)o2)cc1	ZINC000450720964	FH	On-Demand	Anodyne	TERT	24	44
COC1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450720987	CG	On-Demand	Anodyne	DRD4	41	31
COC1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450720987	CG	On-Demand	Anodyne	HCN1	50	32
COC1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450720987	CG	On-Demand	Anodyne	HCN4	48	32
CCc1nc(C)c(CSc2nnc(-c3ccc(N(CC)CC)cc3)o2)o1	ZINC000450720998	FJ	On-Demand	Anodyne	GSK3A	44	37
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721005	GI	On-Demand	Anodyne	DRD4	15	46
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721005	GI	On-Demand	Anodyne	CACNA1B	57	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721005	GI	On-Demand	Anodyne	CCR5	35	47
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721005	GI	On-Demand	Anodyne	MLNR	15	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721005	GI	On-Demand	Anodyne	CCR2	64	47
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721005	GI	On-Demand	Anodyne	MCHR1	16	44
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721006	GI	On-Demand	Anodyne	DRD4	15	46
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721006	GI	On-Demand	Anodyne	CACNA1B	57	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721006	GI	On-Demand	Anodyne	CCR5	35	47
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721006	GI	On-Demand	Anodyne	MLNR	15	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721006	GI	On-Demand	Anodyne	CCR2	64	47
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450721006	GI	On-Demand	Anodyne	MCHR1	16	44
CCN(CC)C(=O)CCC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450721074	FH	On-Demand	Anodyne	OPRM1	0	44
CCN(CC)C(=O)CCC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450721074	FH	On-Demand	Anodyne	OPRD1	15	40
CCN(CC)C(=O)CCC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450721074	FH	On-Demand	Anodyne	SLC6A3	17	42
CCN(CC)C(=O)CCC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450721075	FH	On-Demand	Anodyne	OPRM1	0	44
CCN(CC)C(=O)CCC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450721075	FH	On-Demand	Anodyne	OPRD1	15	40
CCN(CC)C(=O)CCC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450721075	FH	On-Demand	Anodyne	SLC6A3	17	42
CCN(CC)C(=O)CCC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450721076	FH	On-Demand	Anodyne	OPRM1	0	44
CCN(CC)C(=O)CCC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450721076	FH	On-Demand	Anodyne	OPRD1	15	40
CCN(CC)C(=O)CCC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450721076	FH	On-Demand	Anodyne	SLC6A3	17	42
CCN(CC)C(=O)CCC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450721077	FH	On-Demand	Anodyne	OPRM1	0	44
CCN(CC)C(=O)CCC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450721077	FH	On-Demand	Anodyne	OPRD1	15	40
CCN(CC)C(=O)CCC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450721077	FH	On-Demand	Anodyne	SLC6A3	17	42
C[C@@H]1[C@H](O)CCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450721078	CD	On-Demand	Anodyne	CXCR3	29	45
C[C@H]1[C@H](O)CCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450721079	CD	On-Demand	Anodyne	CXCR3	29	45
C[C@@H]1[C@@H](O)CCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450721080	CD	On-Demand	Anodyne	CXCR3	29	45
C[C@H]1[C@@H](O)CCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450721081	CD	On-Demand	Anodyne	CXCR3	29	45
COc1ccc(-c2nnc(N3CCC[C@@H](O)[C@H]3C)c3ccccc23)cc1	ZINC000450721110	EH	On-Demand	Anodyne	SMO	51	53
COc1ccc(-c2nnc(N3CCC[C@@H](O)[C@@H]3C)c3ccccc23)cc1	ZINC000450721111	EH	On-Demand	Anodyne	SMO	51	53
COc1ccc(-c2nnc(N3CCC[C@H](O)[C@H]3C)c3ccccc23)cc1	ZINC000450721112	EH	On-Demand	Anodyne	SMO	51	53
COc1ccc(-c2nnc(N3CCC[C@H](O)[C@@H]3C)c3ccccc23)cc1	ZINC000450721113	EH	On-Demand	Anodyne	SMO	51	53
Cc1cccc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)c1	ZINC000450721149	FI	On-Demand	Anodyne	HCRTR2	0	44
Cc1cccc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)c1	ZINC000450721150	FI	On-Demand	Anodyne	HCRTR2	0	44
Cc1cc(=N)[nH]c(SCc2ccc([C@H](C)C(F)(F)F)cc2)n1	ZINC000450721155	EI	On-Demand	Anodyne	CYP2C19	18	40
Cc1cc(=N)[nH]c(SCc2ccc([C@@H](C)C(F)(F)F)cc2)n1	ZINC000450721156	EI	On-Demand	Anodyne	CYP2C19	18	40
CC(C)C[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721169	GI	On-Demand	Anodyne	EPHX2	34	40
CC(C)C[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721169	GI	On-Demand	Anodyne	RBP4	81	38
CC(C)C[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721169	GI	On-Demand	Anodyne	SCD1	23	43
CC(C)C[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721169	GI	On-Demand	Anodyne	SFRP1	110	39
CC(C)C[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721169	GI	On-Demand	Anodyne	SCD	27	43
CC(C)C[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721169	GI	On-Demand	Anodyne	WNT3	80	35
O=[N+]([O-])c1cccc2c(NC[C@@H]3CCOC4(CCC4)C3)nccc12	ZINC000450721170	EH	On-Demand	Bother	PRKCQ	44	35
O=[N+]([O-])c1cccc2c(NC[C@H]3CCOC4(CCC4)C3)nccc12	ZINC000450721171	EH	On-Demand	Bother	PRKCQ	44	35
Cc1cccc(-c2nnc(SCCC(C)(F)F)n2Cc2ccco2)c1	ZINC000450721181	FK	On-Demand	Anodyne	HCRTR2	22	45
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721186	GI	On-Demand	Anodyne	P2RX7	39	40
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721186	GI	On-Demand	Anodyne	EPHX2	39	43
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721186	GI	On-Demand	Anodyne	RBP4	84	38
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721186	GI	On-Demand	Anodyne	SLC16A1	54	38
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721186	GI	On-Demand	Anodyne	SCD1	26	45
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721186	GI	On-Demand	Anodyne	SFRP1	112	40
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721186	GI	On-Demand	Anodyne	SCD	29	45
CC[C@@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721186	GI	On-Demand	Anodyne	WNT3	77	36
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721187	GI	On-Demand	Anodyne	P2RX7	39	40
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721187	GI	On-Demand	Anodyne	EPHX2	39	43
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721187	GI	On-Demand	Anodyne	RBP4	84	38
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721187	GI	On-Demand	Anodyne	SLC16A1	54	38
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721187	GI	On-Demand	Anodyne	SCD1	26	45
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721187	GI	On-Demand	Anodyne	SFRP1	112	40
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721187	GI	On-Demand	Anodyne	SCD	29	45
CC[C@H](CC(C)C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450721187	GI	On-Demand	Anodyne	WNT3	77	36
COCc1cc([N+](=O)[O-])ccc1NCc1cc(C)cs1	ZINC000450721188	CH	On-Demand	Bother	CACNA1D	49	35
CCc1cccc(C(=O)NCC2(OC)CCCCC2)n1	ZINC000450721196	CF	On-Demand	Anodyne	HCN1	56	34
CCc1cccc(C(=O)NCC2(OC)CCCCC2)n1	ZINC000450721196	CF	On-Demand	Anodyne	HCN4	53	34
CN(CCCC(=O)c1ccc(F)cc1)CCc1ccccc1O	ZINC000450721203	DH	On-Demand	Anodyne	THRA	30	46
CN(CCCC(=O)c1ccc(F)cc1)CCc1ccccc1O	ZINC000450721203	DH	On-Demand	Anodyne	THRB	0	46
COC1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCCCC1	ZINC000450721206	DF	On-Demand	Anodyne	HCN1	50	32
COC1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCCCC1	ZINC000450721206	DF	On-Demand	Anodyne	HCN4	48	32
Cc1csc(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000450721211	GI	On-Demand	Anodyne	EPHX2	37	41
Cc1csc(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000450721211	GI	On-Demand	Anodyne	RBP4	79	42
Cc1csc(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000450721211	GI	On-Demand	Anodyne	CCR8	46	32
Cc1csc(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000450721211	GI	On-Demand	Anodyne	SCD1	30	47
Cc1csc(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000450721211	GI	On-Demand	Anodyne	SFRP1	123	44
Cc1csc(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000450721211	GI	On-Demand	Anodyne	SCD	29	44
Cc1csc(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000450721211	GI	On-Demand	Anodyne	WNT3	81	35
CCOCc1nc(C)c(C(=O)NCc2nc3cccc(Cl)c3n2C)s1	ZINC000450721212	GG	On-Demand	Anodyne	SCD1	41	36
COC1(CSc2nnc(-c3cccc(C)c3)n2Cc2ccco2)CCC1	ZINC000450721220	FJ	On-Demand	Anodyne	HCRTR2	21	41
CCN(CC)c1ccc(-c2nnc(SCc3oc(C(C)C)nc3C)o2)cc1	ZINC000450721242	GK	On-Demand	Anodyne	GSK3A	40	36
CCc1cnccc1[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450721253	FG	On-Demand	Anodyne	PDGFRB	39	41
CCc1cnccc1[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450721253	FG	On-Demand	Anodyne	MTNR1A	51	41
CCc1cnccc1[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450721253	FG	On-Demand	Anodyne	MTNR1B	35	41
CCc1cnccc1[C@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450721253	FG	On-Demand	Anodyne	CSF1R	18	41
CCc1cnccc1[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450721254	FG	On-Demand	Anodyne	PDGFRB	39	41
CCc1cnccc1[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450721254	FG	On-Demand	Anodyne	MTNR1A	51	41
CCc1cnccc1[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450721254	FG	On-Demand	Anodyne	MTNR1B	35	41
CCc1cnccc1[C@@H](C)NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450721254	FG	On-Demand	Anodyne	CSF1R	18	41
Cc1ccccc1-c1nnc(SC[C@@H]2CCNC(=O)CC2)n1Cc1ccco1	ZINC000450721271	GH	On-Demand	Anodyne	HCRTR2	22	44
Cc1ccccc1-c1nnc(SC[C@H]2CCNC(=O)CC2)n1Cc1ccco1	ZINC000450721272	GH	On-Demand	Anodyne	HCRTR2	22	44
Cc1cccc(-c2nnc(SCC3CC(F)(F)C3)n2Cc2ccco2)c1	ZINC000450721322	GK	On-Demand	Anodyne	HCRTR2	21	44
COc1ccc(CNC(=O)CCN2CC[C@H](C(C)(C)C)C2)c(OC)c1	ZINC000450721335	EG	On-Demand	Anodyne	DRD4	41	31
COc1ccc(CNC(=O)CCN2CC[C@H](C(C)(C)C)C2)c(OC)c1	ZINC000450721335	EG	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CC[C@H](C(C)(C)C)C2)c(OC)c1	ZINC000450721335	EG	On-Demand	Anodyne	MTNR1A	50	38
COc1ccc(CNC(=O)CCN2CC[C@H](C(C)(C)C)C2)c(OC)c1	ZINC000450721335	EG	On-Demand	Anodyne	CACNA1I	41	34
COc1ccc(CNC(=O)CCN2CC[C@@H](C(C)(C)C)C2)c(OC)c1	ZINC000450721337	EG	On-Demand	Anodyne	DRD4	41	31
COc1ccc(CNC(=O)CCN2CC[C@@H](C(C)(C)C)C2)c(OC)c1	ZINC000450721337	EG	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CC[C@@H](C(C)(C)C)C2)c(OC)c1	ZINC000450721337	EG	On-Demand	Anodyne	MTNR1A	50	38
COc1ccc(CNC(=O)CCN2CC[C@@H](C(C)(C)C)C2)c(OC)c1	ZINC000450721337	EG	On-Demand	Anodyne	CACNA1I	41	34
COC(=O)CNC(=O)c1ccc(NCc2nn(C)cc2Cl)c([N+](=O)[O-])c1	ZINC000450721348	GD	On-Demand	Bother	TAAR1	19	42
COC(=O)c1coc(CN2CC[C@H](c3cccc(C)c3)C2)n1	ZINC000450721356	DF	On-Demand	Anodyne	DRD4	0	41
COC(=O)c1coc(CN2CC[C@H](c3cccc(C)c3)C2)n1	ZINC000450721356	DF	On-Demand	Anodyne	MGEA5	26	47
COC(=O)c1coc(CN2CC[C@@H](c3cccc(C)c3)C2)n1	ZINC000450721357	DF	On-Demand	Anodyne	DRD4	0	41
COC(=O)c1coc(CN2CC[C@@H](c3cccc(C)c3)C2)n1	ZINC000450721357	DF	On-Demand	Anodyne	MGEA5	26	47
CN1Cc2cc(NC(=O)c3ccc(NC(=O)C(C)(C)C)nc3)ccc2NC1=O	ZINC000450721380	GG	On-Demand	Anodyne	BRD4	17	47
COC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450721426	EF	On-Demand	Anodyne	HCN1	53	33
COC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450721426	EF	On-Demand	Anodyne	HCN4	51	33
COC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450721426	EF	On-Demand	Anodyne	PDEC	0	41
COC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450721428	EF	On-Demand	Anodyne	HCN1	53	33
COC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450721428	EF	On-Demand	Anodyne	HCN4	51	33
COC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450721428	EF	On-Demand	Anodyne	PDEC	0	41
CN(C)S(=O)(=O)c1ccc(NCc2nn(C)cc2Cl)c([N+](=O)[O-])c1	ZINC000450721439	FD	On-Demand	Bother	BDKRB1	0	41
C[C@H]1C[C@]1(C#N)C(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450721482	DE	On-Demand	Mild	SMO	42	35
C[C@@H]1C[C@@]1(C#N)C(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450721484	DE	On-Demand	Mild	SMO	42	35
C[C@@H]1C[C@]1(C#N)C(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450721486	DE	On-Demand	Mild	SMO	42	35
C[C@H]1C[C@@]1(C#N)C(=O)NCc1nc2cccc(Cl)c2n1C	ZINC000450721488	DE	On-Demand	Mild	SMO	42	35
O=c1c2cc(Cl)ccc2ncn1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450721494	CF	On-Demand	Anodyne	Q8MHZ5_SHEEP	19	43
O=c1c2cc(Cl)ccc2ncn1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450721495	CF	On-Demand	Anodyne	Q8MHZ5_SHEEP	19	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CCCO)CC1	ZINC000450721524	CF	On-Demand	Anodyne	SLC6A3	20	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CCCO)CC1	ZINC000450721526	CF	On-Demand	Anodyne	SLC6A3	20	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CCCO)CC1	ZINC000450721529	CF	On-Demand	Anodyne	SLC6A3	20	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CCCO)CC1	ZINC000450721531	CF	On-Demand	Anodyne	SLC6A3	20	45
COC[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000450721546	GG	On-Demand	Bother	BDKRB1	21	43
COC[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000450721548	GG	On-Demand	Bother	BDKRB1	21	43
CCN(CC)c1ccc(-c2nnc(SCC3(OC)CCC3)o2)cc1	ZINC000450721565	EI	On-Demand	Anodyne	GSK3B	17	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccn2)c(OC)c1	ZINC000450721567	EE	On-Demand	Anodyne	NQO2	19	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccn2)c(OC)c1	ZINC000450721567	EE	On-Demand	Anodyne	MTNR1A	63	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccn2)c(OC)c1	ZINC000450721567	EE	On-Demand	Anodyne	MTNR1B	51	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccn2)c(OC)c1	ZINC000450721568	EE	On-Demand	Anodyne	NQO2	19	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccn2)c(OC)c1	ZINC000450721568	EE	On-Demand	Anodyne	MTNR1A	63	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccn2)c(OC)c1	ZINC000450721568	EE	On-Demand	Anodyne	MTNR1B	51	41
CCS(=O)(=O)c1ccc(CN2CCC(Oc3cc(C)ccn3)CC2)cc1	ZINC000450721569	FG	On-Demand	Anodyne	SSTR5	56	42
CCS(=O)(=O)c1ccc(CN2CCC(Oc3cc(C)ccn3)CC2)cc1	ZINC000450721569	FG	On-Demand	Anodyne	SCN5A	41	41
CCNC(=O)c1ccc(NC[C@@H](COC)c2ccc(Cl)cc2)nc1	ZINC000450721595	EG	On-Demand	Anodyne	GCK	29	44
CCNC(=O)c1ccc(NC[C@H](COC)c2ccc(Cl)cc2)nc1	ZINC000450721598	EG	On-Demand	Anodyne	GCK	29	44
COc1cc2c(NCCc3scnc3C)ccnc2cc1F	ZINC000450721599	DH	On-Demand	Anodyne	HNMT	45	33
C[C@@H](c1ccc(CN2CCC(CCCO)CC2)cc1)C(F)(F)F	ZINC000450721608	EI	On-Demand	Anodyne	ACHE	46	45
C[C@@H](c1ccc(CN2CCC(CCCO)CC2)cc1)C(F)(F)F	ZINC000450721608	EI	On-Demand	Anodyne	SLC6A3	23	47
C[C@@H](c1ccc(CN2CCC(CCCO)CC2)cc1)C(F)(F)F	ZINC000450721608	EI	On-Demand	Anodyne	SIGMAR1	41	47
C[C@H](c1ccc(CN2CCC(CCCO)CC2)cc1)C(F)(F)F	ZINC000450721609	EI	On-Demand	Anodyne	ACHE	46	45
C[C@H](c1ccc(CN2CCC(CCCO)CC2)cc1)C(F)(F)F	ZINC000450721609	EI	On-Demand	Anodyne	SLC6A3	23	47
C[C@H](c1ccc(CN2CCC(CCCO)CC2)cc1)C(F)(F)F	ZINC000450721609	EI	On-Demand	Anodyne	SIGMAR1	41	47
CCC[C@@H](O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450721618	DI	On-Demand	Mild	MCHR1	17	41
CCC[C@@H](O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450721619	DI	On-Demand	Mild	MCHR1	19	46
CCC[C@H](O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450721620	DI	On-Demand	Mild	MCHR1	19	46
CCC[C@H](O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450721621	DI	On-Demand	Mild	MCHR1	19	46
COc1cc(Cl)cc(C(=O)N(CCN(C)C)C2CC2)c1	ZINC000450721624	CF	On-Demand	Anodyne	MBTPS1	44	32
CN(CCN1CCOCC2(CC2)C1)Cc1ccccc1	ZINC000450721629	CE	On-Demand	Anodyne	SIGMAR1	20	42
COc1cccc2c1CCN(Cc1cn(CC3CC3)nn1)C2	ZINC000450721635	CE	On-Demand	Anodyne	ADRB1	18	42
COc1cccc2c1CCN(Cc1cn(CC3CC3)nn1)C2	ZINC000450721635	CE	On-Demand	Anodyne	DRD2	15	42
C[C@H](NC[C@H]1CCNC(=O)CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450721640	EH	On-Demand	Mild	MCHR1	28	42
C[C@@H](NC[C@H]1CCNC(=O)CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450721641	EH	On-Demand	Mild	MCHR1	28	42
C[C@H](NC[C@@H]1CCNC(=O)CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450721642	EH	On-Demand	Mild	MCHR1	28	42
COC[C@H](CNc1ccc(C(=O)N(C)C)cn1)c1ccc(Cl)cc1	ZINC000450721643	EG	On-Demand	Anodyne	F10	23	42
COC[C@H](CNc1ccc(C(=O)N(C)C)cn1)c1ccc(Cl)cc1	ZINC000450721643	EG	On-Demand	Anodyne	GCK	24	40
COC[C@H](CNc1ccc(C(=O)N(C)C)cn1)c1ccc(Cl)cc1	ZINC000450721643	EG	On-Demand	Anodyne	UTS2	42	33
COC[C@@H](CNc1ccc(C(=O)N(C)C)cn1)c1ccc(Cl)cc1	ZINC000450721644	EG	On-Demand	Anodyne	F10	23	42
COC[C@@H](CNc1ccc(C(=O)N(C)C)cn1)c1ccc(Cl)cc1	ZINC000450721644	EG	On-Demand	Anodyne	GCK	24	40
COC[C@@H](CNc1ccc(C(=O)N(C)C)cn1)c1ccc(Cl)cc1	ZINC000450721644	EG	On-Demand	Anodyne	UTS2	42	33
CC(=O)NC[C@H](CC(=O)Nc1ccc2c(c1)CN(C)C(=O)N2)CC(C)C	ZINC000450721650	FF	On-Demand	Anodyne	BRD4	15	42
Cc1csc(CNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1	ZINC000450721653	FD	On-Demand	Anodyne	GCK	43	39
COc1cc(CN(C)CCc2ccccc2O)ccc1Cl	ZINC000450721682	DH	On-Demand	Anodyne	NCE103	22	42
COc1cc(CN(C)CCc2ccccc2O)ccc1Cl	ZINC000450721682	DH	On-Demand	Anodyne	MBTPS1	43	32
COc1cc(CN(C)CCc2ccccc2O)ccc1Cl	ZINC000450721682	DH	On-Demand	Anodyne	CAN2	0	42
CC(C)(C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCC1	ZINC000450721685	GI	On-Demand	Anodyne	RBP4	85	44
CC(C)(C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCC1	ZINC000450721685	GI	On-Demand	Anodyne	SCD1	28	46
CC(C)(C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCC1	ZINC000450721685	GI	On-Demand	Anodyne	SFRP1	127	43
CC(C)(C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCC1	ZINC000450721685	GI	On-Demand	Anodyne	SCD	30	43
CC(C)(C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCC1	ZINC000450721685	GI	On-Demand	Anodyne	WNT3	87	36
CCOC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)nc1	ZINC000450721711	CG	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)nc1	ZINC000450721712	CG	On-Demand	Anodyne	SSTR5	42	35
Cn1nc(CCNC(=O)c2cccc3c2CCCC3)c2ccccc21	ZINC000450721724	EG	On-Demand	Anodyne	MTNR1C	0	40
C[C@@H](NC[C@@H]1CCNC(=O)CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450721727	EH	On-Demand	Mild	MCHR1	28	42
Cc1nn(C)cc1CSc1nnc(-c2ccc(C(C)(C)C)cc2)o1	ZINC000450721731	EI	On-Demand	Anodyne	TYMS	28	48
Cc1nn(C)cc1CSc1nnc(-c2ccc(C(C)(C)C)cc2)o1	ZINC000450721731	EI	On-Demand	Anodyne	GSK3B	20	43
Cc1nn(C)cc1CSc1nnc(-c2ccc(C(C)(C)C)cc2)o1	ZINC000450721731	EI	On-Demand	Anodyne	GSK3A	47	39
Cc1nn(C)cc1CSc1nnc(-c2ccc(C(C)(C)C)cc2)o1	ZINC000450721731	EI	On-Demand	Anodyne	TERT	25	43
Cc1ccccc1-c1nnc(SC[C@@H]2C[C@H]3CC[C@H]2O3)n1Cc1ccco1	ZINC000450721734	GJ	On-Demand	Anodyne	HCRTR2	22	44
Cc1ccccc1-c1nnc(SC[C@H]2C[C@H]3CC[C@H]2O3)n1Cc1ccco1	ZINC000450721736	GJ	On-Demand	Anodyne	HCRTR2	22	44
COc1ccc(CNC(=O)CCN[C@H](c2cccnc2)C2CC2)c(OC)c1	ZINC000450721778	FF	On-Demand	Anodyne	KCNA5	42	36
COc1ccc(CNC(=O)CCN[C@@H](c2cccnc2)C2CC2)c(OC)c1	ZINC000450721779	FF	On-Demand	Anodyne	KCNA5	42	36
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	HTR1A	22	49
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	DRD2	27	49
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	DRD4	32	49
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	HTR2A	24	49
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	SLC6A1	41	33
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	HRH1	26	49
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	DRD3	17	49
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	HCRTR1	0	42
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	HTR7	28	44
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	SIGMAR1	27	44
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	FAAH	29	44
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	HCRTR2	16	42
Cc1ccnc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450721824	EH	On-Demand	Anodyne	CYP2J2	65	50
O=C(CCCN1CCOCC2(CC2)C1)c1ccccc1	ZINC000450721826	CF	On-Demand	Anodyne	DRD2	31	45
O=C(CCCN1CCOCC2(CC2)C1)c1ccccc1	ZINC000450721826	CF	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCOCC2(CC2)C1)c1ccccc1	ZINC000450721826	CF	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCOCC2(CC2)C1)c1ccccc1	ZINC000450721826	CF	On-Demand	Anodyne	CYP2J2	59	42
CC(=O)CCCCCSc1nnc(-c2ccccc2C)n1Cc1ccco1	ZINC000450721828	GK	On-Demand	Anodyne	HCRTR2	25	51
COC1(CNC(=O)c2ccsc2Br)CCCCC1	ZINC000450721844	EH	On-Demand	Anodyne	HCN1	57	39
COC1(CNC(=O)c2ccsc2Br)CCCCC1	ZINC000450721844	EH	On-Demand	Anodyne	HCN4	52	35
Cc1cccc(-c2nnc(SCC3(C#N)CCC3)n2Cc2ccco2)c1	ZINC000450721860	FJ	On-Demand	Mild	HCRTR2	20	41
COCCNC(=O)c1ccc(NC[C@H]2CCOC3(CCC3)C2)nc1	ZINC000450721874	ED	On-Demand	Anodyne	IKBKB	16	41
COCCNC(=O)c1ccc(NC[C@@H]2CCOC3(CCC3)C2)nc1	ZINC000450721875	ED	On-Demand	Anodyne	IKBKB	16	41
COC(=O)c1csc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450721877	FH	On-Demand	Anodyne	CCR5	48	36
COC(=O)c1csc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450721877	FH	On-Demand	Anodyne	CCR2	51	41
COC(=O)c1csc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450721877	FH	On-Demand	Anodyne	MCHR1	27	45
COC(=O)c1csc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450721877	FH	On-Demand	Anodyne	LIPG	47	32
COC(=O)c1csc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450721878	FH	On-Demand	Anodyne	CCR5	48	36
COC(=O)c1csc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450721878	FH	On-Demand	Anodyne	CCR2	51	41
COC(=O)c1csc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450721878	FH	On-Demand	Anodyne	MCHR1	27	45
COC(=O)c1csc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450721878	FH	On-Demand	Anodyne	LIPG	47	32
CC(=O)NC1CCC(N(C)CC/C=C\c2ccccc2)CC1	ZINC000450721889	DG	On-Demand	Anodyne	FASN	17	43
CC(=O)NC1CCC(N(C)CC/C=C/c2ccccc2)CC1	ZINC000450721890	DG	On-Demand	Anodyne	FASN	17	43
Cn1nc(CCNC(=O)[C@H]2CCN(c3ccccc3)C2)c2ccccc21	ZINC000450721893	EF	On-Demand	Anodyne	GPBAR1	29	42
Cn1nc(CCNC(=O)[C@@H]2CCN(c3ccccc3)C2)c2ccccc21	ZINC000450721894	EF	On-Demand	Anodyne	GPBAR1	29	42
Cc1nc([C@@H]2CCCCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)no1	ZINC000450721912	GG	On-Demand	Bother	COLA	67	43
Cc1nc([C@@H]2CCCCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)no1	ZINC000450721912	GG	On-Demand	Bother	CPT1A	64	43
Cc1nc([C@H]2CCCCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)no1	ZINC000450721913	GG	On-Demand	Bother	COLA	67	43
Cc1nc([C@H]2CCCCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)no1	ZINC000450721913	GG	On-Demand	Bother	CPT1A	64	43
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CC1(F)F	ZINC000450721915	GG	On-Demand	Anodyne	EPHX2	36	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CC1(F)F	ZINC000450721915	GG	On-Demand	Anodyne	RBP4	83	45
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CC1(F)F	ZINC000450721915	GG	On-Demand	Anodyne	SCD1	24	45
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CC1(F)F	ZINC000450721915	GG	On-Demand	Anodyne	SFRP1	120	43
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CC1(F)F	ZINC000450721915	GG	On-Demand	Anodyne	SCD	26	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H]1CC1(F)F	ZINC000450721915	GG	On-Demand	Anodyne	WNT3	79	33
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CC1(F)F	ZINC000450721916	GG	On-Demand	Anodyne	EPHX2	36	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CC1(F)F	ZINC000450721916	GG	On-Demand	Anodyne	RBP4	83	45
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CC1(F)F	ZINC000450721916	GG	On-Demand	Anodyne	SCD1	24	45
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CC1(F)F	ZINC000450721916	GG	On-Demand	Anodyne	SFRP1	120	43
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CC1(F)F	ZINC000450721916	GG	On-Demand	Anodyne	SCD	26	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H]1CC1(F)F	ZINC000450721916	GG	On-Demand	Anodyne	WNT3	79	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nn(C)c2ccccc12	ZINC000450721940	FF	On-Demand	Anodyne	CAPN1	45	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nn(C)c2ccccc12	ZINC000450721940	FF	On-Demand	Anodyne	CAPN2	65	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nn(C)c2ccccc12	ZINC000450721940	FF	On-Demand	Anodyne	FPR1	42	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCc1nn(C)c2ccccc12	ZINC000450721940	FF	On-Demand	Anodyne	NPR	45	32
COc1cc2c(N3CCC[C@@H](O)[C@H]3C)ncnc2cc1F	ZINC000450721946	CE	On-Demand	Anodyne	PDE3A	53	40
COc1cc2c(N3CCC[C@@H](O)[C@H]3C)ncnc2cc1F	ZINC000450721946	CE	On-Demand	Anodyne	PDGFRB	47	36
COc1cc2c(N3CCC[C@@H](O)[C@H]3C)ncnc2cc1F	ZINC000450721946	CE	On-Demand	Anodyne	PDE3B	78	40
COc1cc2c(N3CCC[C@H](O)[C@H]3C)ncnc2cc1F	ZINC000450721947	CE	On-Demand	Anodyne	PDE3A	53	40
COc1cc2c(N3CCC[C@H](O)[C@H]3C)ncnc2cc1F	ZINC000450721947	CE	On-Demand	Anodyne	PDGFRB	47	36
COc1cc2c(N3CCC[C@H](O)[C@H]3C)ncnc2cc1F	ZINC000450721947	CE	On-Demand	Anodyne	PDE3B	78	40
COc1cc2c(N3CCC[C@@H](O)[C@@H]3C)ncnc2cc1F	ZINC000450721948	CE	On-Demand	Anodyne	PDE3A	53	40
COc1cc2c(N3CCC[C@@H](O)[C@@H]3C)ncnc2cc1F	ZINC000450721948	CE	On-Demand	Anodyne	PDGFRB	47	36
COc1cc2c(N3CCC[C@@H](O)[C@@H]3C)ncnc2cc1F	ZINC000450721948	CE	On-Demand	Anodyne	PDE3B	78	40
COc1cc2c(N3CCC[C@H](O)[C@@H]3C)ncnc2cc1F	ZINC000450721949	CE	On-Demand	Anodyne	PDE3A	53	40
COc1cc2c(N3CCC[C@H](O)[C@@H]3C)ncnc2cc1F	ZINC000450721949	CE	On-Demand	Anodyne	PDGFRB	47	36
COc1cc2c(N3CCC[C@H](O)[C@@H]3C)ncnc2cc1F	ZINC000450721949	CE	On-Demand	Anodyne	PDE3B	78	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N(CCN(C)C)C3CC3)cc2)c1	ZINC000450721952	GG	On-Demand	Anodyne	CHRM3	15	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N(CCN(C)C)C3CC3)cc2)c1	ZINC000450721952	GG	On-Demand	Anodyne	MBTPS1	59	33
Clc1ccc(CCN[C@H](c2cccnc2)C2CC2)cc1	ZINC000450721957	CI	On-Demand	Anodyne	ADRB3	67	47
Clc1ccc(CCN[C@H](c2cccnc2)C2CC2)cc1	ZINC000450721957	CI	On-Demand	Anodyne	TBXA2R	19	45
Clc1ccc(CCN[C@H](c2cccnc2)C2CC2)cc1	ZINC000450721957	CI	On-Demand	Anodyne	TBXAS1	29	45
Clc1ccc(CCN[C@@H](c2cccnc2)C2CC2)cc1	ZINC000450721958	CI	On-Demand	Anodyne	ADRB3	67	47
Clc1ccc(CCN[C@@H](c2cccnc2)C2CC2)cc1	ZINC000450721958	CI	On-Demand	Anodyne	TBXA2R	19	45
Clc1ccc(CCN[C@@H](c2cccnc2)C2CC2)cc1	ZINC000450721958	CI	On-Demand	Anodyne	TBXAS1	29	45
CCOC(=O)c1ccc(CN2CCC(CCCO)CC2)nc1	ZINC000450721981	DE	On-Demand	Anodyne	SSTR5	44	36
COc1cc(OC)c2ncnc(N3CCC[C@H](O)[C@@H]3C)c2c1	ZINC000450721982	DD	On-Demand	Anodyne	PDE3A	44	35
COc1cc(OC)c2ncnc(N3CCC[C@@H](O)[C@@H]3C)c2c1	ZINC000450721983	DD	On-Demand	Anodyne	PDE3A	44	35
COc1cc(OC)c2ncnc(N3CCC[C@H](O)[C@H]3C)c2c1	ZINC000450721984	DD	On-Demand	Anodyne	PDE3A	44	35
COc1cc(OC)c2ncnc(N3CCC[C@@H](O)[C@H]3C)c2c1	ZINC000450721985	DD	On-Demand	Anodyne	PDE3A	44	35
O=c1c2cc(Cl)ccc2ncn1CC1=CCCCC1	ZINC000450721987	CH	On-Demand	Anodyne	SCD1	17	47
CCOC(=O)c1ccc(CN2CCC(Oc3cc(C)ccn3)CC2)nc1	ZINC000450722003	FG	On-Demand	Anodyne	SSTR5	46	37
CC(C)n1cc(C2=CCCN(c3ncc(-c4ccccc4)s3)CC2)nn1	ZINC000450722004	FJ	On-Demand	Anodyne	LUCI_LUCLA	15	40
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](O)[C@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722007	FH	On-Demand	Bother	AVPR2	34	41
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](O)[C@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722007	FH	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](O)[C@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722007	FH	On-Demand	Bother	TAAR1	36	47
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](O)[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722008	FH	On-Demand	Bother	AVPR2	34	41
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](O)[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722008	FH	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](O)[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722008	FH	On-Demand	Bother	TAAR1	36	47
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](O)[C@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722009	FH	On-Demand	Bother	AVPR2	34	41
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](O)[C@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722009	FH	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](O)[C@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722009	FH	On-Demand	Bother	TAAR1	36	47
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](O)[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722010	FH	On-Demand	Bother	AVPR2	34	41
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](O)[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722010	FH	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](O)[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450722010	FH	On-Demand	Bother	TAAR1	36	47
C[C@@H]1[C@@H](O)CCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450722027	EH	On-Demand	Anodyne	ADRB3	30	49
C[C@@H]1[C@H](O)CCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450722028	EH	On-Demand	Anodyne	ADRB3	30	49
C[C@H]1[C@@H](O)CCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450722029	EH	On-Demand	Anodyne	ADRB3	30	49
C[C@H]1[C@H](O)CCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450722030	EH	On-Demand	Anodyne	ADRB3	30	49
Cc1ccccc1-c1nnc(S[C@@H]2CC[C@H](C#N)C2)n1Cc1ccco1	ZINC000450722031	FJ	On-Demand	Mild	HCRTR2	21	42
Cc1ccccc1-c1nnc(S[C@@H]2CC[C@@H](C#N)C2)n1Cc1ccco1	ZINC000450722032	FJ	On-Demand	Mild	HCRTR2	21	42
Cc1ccccc1-c1nnc(S[C@H]2CC[C@H](C#N)C2)n1Cc1ccco1	ZINC000450722033	FJ	On-Demand	Mild	HCRTR2	21	42
Cc1ccccc1-c1nnc(S[C@H]2CC[C@@H](C#N)C2)n1Cc1ccco1	ZINC000450722034	FJ	On-Demand	Mild	HCRTR2	21	42
CCN(Cc1ccc(C(=O)OC)c(Cl)c1)Cc1cn(C)nn1	ZINC000450722036	DE	On-Demand	Anodyne	SLC6A9	56	34
Cc1ccnc(-c2noc(CSc3nnnn3-c3ccc(C(C)C)cc3)n2)c1	ZINC000450722055	GH	On-Demand	Anodyne	TNKS2	17	44
CC(=O)[C@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722063	DF	On-Demand	Anodyne	CACNA1B	54	36
CC(=O)[C@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722063	DF	On-Demand	Anodyne	CCR5	58	36
CC(=O)[C@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722063	DF	On-Demand	Anodyne	CCR2	54	41
CC(=O)[C@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722063	DF	On-Demand	Anodyne	MCHR1	30	44
CC(=O)[C@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722063	DF	On-Demand	Anodyne	LIPG	40	33
CC(=O)[C@@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722064	DF	On-Demand	Anodyne	CACNA1B	54	36
CC(=O)[C@@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722064	DF	On-Demand	Anodyne	CCR5	58	36
CC(=O)[C@@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722064	DF	On-Demand	Anodyne	CCR2	54	41
CC(=O)[C@@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722064	DF	On-Demand	Anodyne	MCHR1	30	44
CC(=O)[C@@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722064	DF	On-Demand	Anodyne	LIPG	40	33
CC(=O)[C@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722065	DF	On-Demand	Anodyne	CACNA1B	54	36
CC(=O)[C@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722065	DF	On-Demand	Anodyne	CCR5	58	36
CC(=O)[C@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722065	DF	On-Demand	Anodyne	CCR2	54	41
CC(=O)[C@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722065	DF	On-Demand	Anodyne	MCHR1	30	44
CC(=O)[C@](C)(O)CN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722065	DF	On-Demand	Anodyne	LIPG	40	33
CC(=O)[C@@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722066	DF	On-Demand	Anodyne	CACNA1B	54	36
CC(=O)[C@@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722066	DF	On-Demand	Anodyne	CCR5	58	36
CC(=O)[C@@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722066	DF	On-Demand	Anodyne	CCR2	54	41
CC(=O)[C@@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722066	DF	On-Demand	Anodyne	MCHR1	30	44
CC(=O)[C@@](C)(O)CN1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450722066	DF	On-Demand	Anodyne	LIPG	40	33
C=CCc1cc([N+](=O)[O-])ccc1OCCC[C@@H](C)O	ZINC000450722068	CF	On-Demand	Mild	CYP19A1	15	45
C=CCc1cc([N+](=O)[O-])ccc1OCCC[C@@H](C)O	ZINC000450722068	CF	On-Demand	Mild	ACR	23	40
C=CCc1cc([N+](=O)[O-])ccc1OCCC[C@H](C)O	ZINC000450722069	CF	On-Demand	Mild	CYP19A1	15	45
C=CCc1cc([N+](=O)[O-])ccc1OCCC[C@H](C)O	ZINC000450722069	CF	On-Demand	Mild	ACR	23	40
CCc1cc(NCc2cc(C)cs2)n2ncnc2n1	ZINC000450722077	CF	On-Demand	Anodyne	DHOD	0	52
CC(C)OC(C)(C)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2	ZINC000450722086	DF	On-Demand	Anodyne	BRD4	0	48
CCN(CC)c1ccc(-c2nnc(SCc3cccc(C(C)=O)c3)o2)cc1	ZINC000450722090	GK	On-Demand	Anodyne	GSK3B	21	53
CCN(CC)c1ccc(-c2nnc(SCc3cccc(C(C)=O)c3)o2)cc1	ZINC000450722090	GK	On-Demand	Anodyne	GSK3A	59	46
COC1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCCCC1	ZINC000450722091	DG	On-Demand	Anodyne	HCN1	68	42
COC1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCCCC1	ZINC000450722091	DG	On-Demand	Anodyne	HCN4	59	40
COC1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCCCC1	ZINC000450722092	DG	On-Demand	Anodyne	HCN1	68	42
COC1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCCCC1	ZINC000450722092	DG	On-Demand	Anodyne	HCN4	59	40
CC(=O)NC1CCC(N(C)CCCC(=O)c2ccccc2)CC1	ZINC000450722101	DG	On-Demand	Anodyne	FASN	16	41
CC(=O)NC1CCC(N(C)CCCC(=O)c2ccccc2)CC1	ZINC000450722101	DG	On-Demand	Anodyne	CYP2J2	47	33
COc1ccc(CNC(=O)CCN(C)CCc2ccccc2O)c(OC)c1	ZINC000450722102	FF	On-Demand	Anodyne	MTNR1B	60	37
COC1(CNC(=O)c2cc3ccncc3s2)CCCCC1	ZINC000450722110	DG	On-Demand	Anodyne	VCAM1	46	37
COC(=O)c1csc(CN2CC[C@H](c3cccc(C)c3)C2)n1	ZINC000450722111	DG	On-Demand	Anodyne	DRD4	17	40
COC(=O)c1csc(CN2CC[C@H](c3cccc(C)c3)C2)n1	ZINC000450722111	DG	On-Demand	Anodyne	MGEA5	26	47
COC(=O)c1csc(CN2CC[C@H](c3cccc(C)c3)C2)n1	ZINC000450722111	DG	On-Demand	Anodyne	TRPC6	53	34
COC(=O)c1csc(CN2CC[C@@H](c3cccc(C)c3)C2)n1	ZINC000450722112	DG	On-Demand	Anodyne	DRD4	17	40
COC(=O)c1csc(CN2CC[C@@H](c3cccc(C)c3)C2)n1	ZINC000450722112	DG	On-Demand	Anodyne	MGEA5	26	47
COC(=O)c1csc(CN2CC[C@@H](c3cccc(C)c3)C2)n1	ZINC000450722112	DG	On-Demand	Anodyne	TRPC6	53	34
COCc1cc(NC[C@H](COC)c2ccc(Cl)cc2)n2ncnc2n1	ZINC000450722115	FF	On-Demand	Anodyne	DHOD	0	40
COCc1cc(NC[C@@H](COC)c2ccc(Cl)cc2)n2ncnc2n1	ZINC000450722116	FF	On-Demand	Anodyne	DHOD	0	40
CCC[C@@H]1CCC[C@@H]1C(=O)NCCc1nn(C)c2ccccc12	ZINC000450722119	DG	On-Demand	Anodyne	INHA	42	33
CCC[C@H]1CCC[C@@H]1C(=O)NCCc1nn(C)c2ccccc12	ZINC000450722120	DG	On-Demand	Anodyne	INHA	42	33
CCC[C@@H]1CCC[C@H]1C(=O)NCCc1nn(C)c2ccccc12	ZINC000450722121	DG	On-Demand	Anodyne	INHA	42	33
CCC[C@H]1CCC[C@H]1C(=O)NCCc1nn(C)c2ccccc12	ZINC000450722122	DG	On-Demand	Anodyne	INHA	42	33
CN1Cc2cc(NC(=O)C3(C(F)(F)F)CCC3)ccc2NC1=O	ZINC000450722126	EG	On-Demand	Anodyne	BRD4	0	46
Cc1cccc(Cl)c1CN1CCC(CCCO)CC1	ZINC000450722140	CH	On-Demand	Anodyne	ACHE	33	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450722150	GG	On-Demand	Anodyne	RBP4	63	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450722151	GG	On-Demand	Anodyne	RBP4	63	35
C[C@H](c1ccccc1)[C@H](O)CN1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450722152	GG	On-Demand	Anodyne	RBP4	63	35
C[C@H](c1ccccc1)[C@H](O)CN1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450722153	GG	On-Demand	Anodyne	RBP4	63	35
CNC(=O)[C@@H]1CN(C[C@@H](O)[C@@H](C)c2ccccc2)CCO1	ZINC000450722158	CC	On-Demand	Anodyne	CASR	46	34
CNC(=O)[C@@H]1CN(C[C@H](O)[C@@H](C)c2ccccc2)CCO1	ZINC000450722159	CC	On-Demand	Anodyne	CASR	46	34
CNC(=O)[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)CCO1	ZINC000450722160	CC	On-Demand	Anodyne	CASR	46	34
CNC(=O)[C@@H]1CN(C[C@@H](O)[C@H](C)c2ccccc2)CCO1	ZINC000450722161	CC	On-Demand	Anodyne	CASR	46	34
COc1ccc(-c2csc3ncnc(N4CCC[C@@H](O)[C@@H]4C)c23)cc1	ZINC000450722168	FH	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CCC[C@@H](O)[C@@H]4C)c23)cc1	ZINC000450722168	FH	On-Demand	Anodyne	ADRB3	15	51
COc1ccc(-c2csc3ncnc(N4CCC[C@H](O)[C@@H]4C)c23)cc1	ZINC000450722169	FH	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CCC[C@H](O)[C@@H]4C)c23)cc1	ZINC000450722169	FH	On-Demand	Anodyne	ADRB3	15	51
COc1ccc(-c2csc3ncnc(N4CCC[C@@H](O)[C@H]4C)c23)cc1	ZINC000450722170	FH	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CCC[C@@H](O)[C@H]4C)c23)cc1	ZINC000450722170	FH	On-Demand	Anodyne	ADRB3	15	51
COc1ccc(-c2csc3ncnc(N4CCC[C@H](O)[C@H]4C)c23)cc1	ZINC000450722171	FH	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CCC[C@H](O)[C@H]4C)c23)cc1	ZINC000450722171	FH	On-Demand	Anodyne	ADRB3	15	51
COc1cccc2c1CCN(C[C@H](O)[C@H](C)c1ccccc1)C2	ZINC000450722198	DG	On-Demand	Anodyne	AGTR2	57	33
COc1cccc2c1CCN(C[C@@H](O)[C@H](C)c1ccccc1)C2	ZINC000450722199	DG	On-Demand	Anodyne	AGTR2	57	33
COc1cccc2c1CCN(C[C@@H](O)[C@@H](C)c1ccccc1)C2	ZINC000450722200	DG	On-Demand	Anodyne	AGTR2	57	33
COc1cccc2c1CCN(C[C@H](O)[C@@H](C)c1ccccc1)C2	ZINC000450722201	DG	On-Demand	Anodyne	AGTR2	57	33
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1cn(C)nn1	ZINC000450722221	FD	On-Demand	Anodyne	PDGFRB	26	40
CCN(CC)C(=O)CCC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450722244	FI	On-Demand	Anodyne	ACHE	44	47
CCN(CC)C(=O)CCC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450722244	FI	On-Demand	Anodyne	HRH1	22	43
CCN(CC)C(=O)CCC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450722244	FI	On-Demand	Anodyne	CHRM5	15	48
CCN(CC)C(=O)CCC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450722244	FI	On-Demand	Anodyne	SIGMAR1	26	43
CCN(CC)C(=O)CCC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450722244	FI	On-Demand	Anodyne	CCR3	33	43
Cc1cccnc1CCCNc1ncc(C(=O)N2CCCCC2)cc1Cl	ZINC000450722267	FI	On-Demand	Anodyne	HNMT	46	32
COc1cc(O)cc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000450722291	FI	On-Demand	Anodyne	RBP4	81	38
Cc1cccnc1CCCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450722305	FG	On-Demand	Bother	TAAR1	17	43
O=C(Cc1cc2ccccc2s1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450722339	FI	On-Demand	Anodyne	MAP3K7	49	37
C=CC(C)(C)CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450722350	DF	On-Demand	Mild	LRRK2	31	44
O=C(NCC(=O)N1CCC(n2cc(Cl)cn2)CC1)Nc1cccc(Cl)c1	ZINC000450722365	GG	On-Demand	Anodyne	EPHX2	34	52
O=C(NCC(=O)N1CCC(n2cc(Cl)cn2)CC1)Nc1cccc(Cl)c1	ZINC000450722365	GG	On-Demand	Anodyne	MAP3K7	46	32
O=C(NCC(=O)N1CCC(n2cc(Cl)cn2)CC1)Nc1cccc(Cl)c1	ZINC000450722365	GG	On-Demand	Anodyne	PRMT3	24	40
C=CC(C)(C)CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450722375	FE	On-Demand	Mild	BCL2L1	85	34
C=CC(C)(C)CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450722375	FE	On-Demand	Mild	BCL2	74	34
C=CC(C)(C)CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450722375	FE	On-Demand	Mild	BCL2L2	43	31
CN(Cc1cnc(N(C)C)nc1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450722378	GD	On-Demand	Anodyne	PSBA	0	43
C[C@@H]1CCCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450722382	DI	On-Demand	Anodyne	HSD11B1	15	40
C[C@@H]1CCCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450722382	DI	On-Demand	Anodyne	TRPC6	48	37
C[C@H]1CCCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450722383	DI	On-Demand	Anodyne	HSD11B1	15	40
C[C@H]1CCCCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450722383	DI	On-Demand	Anodyne	TRPC6	48	37
CCOc1nc2ccc(C(=O)N3CCC(O)(Cc4ccc(F)cc4)CC3)cc2[nH]1	ZINC000450722390	GG	On-Demand	Anodyne	ACACA	44	39
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450722398	ED	On-Demand	Mild	CA2	43	38
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450722398	ED	On-Demand	Mild	CAH_METTE	46	33
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450722398	ED	On-Demand	Mild	CYNT	42	37
CCSc1cccnc1C(=O)N1CCCC[C@@H](C)C1	ZINC000450722400	CG	On-Demand	Anodyne	FAAH	20	40
CCSc1cccnc1C(=O)N1CCCC[C@H](C)C1	ZINC000450722401	CG	On-Demand	Anodyne	FAAH	20	40
C[C@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450722403	CG	On-Demand	Anodyne	CPT1A	62	37
C[C@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450722403	CG	On-Demand	Anodyne	PREP	45	36
C[C@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450722403	CG	On-Demand	Anodyne	HPGD	25	41
C[C@@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450722404	CG	On-Demand	Anodyne	CPT1A	62	37
C[C@@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450722404	CG	On-Demand	Anodyne	PREP	45	36
C[C@@H]1CCCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450722404	CG	On-Demand	Anodyne	HPGD	25	41
COC(=O)c1ccc(CC(=O)NCCCCc2ccc(F)c(F)c2)cc1	ZINC000450722405	FG	On-Demand	Anodyne	LEF	46	32
COC(=O)c1ccc(CC(=O)NCCCCc2ccc(F)c(F)c2)cc1	ZINC000450722405	FG	On-Demand	Anodyne	CRTM	42	39
C=CC(C)(C)CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450722407	CF	On-Demand	Mild	DHOD	0	57
Cc1cc(C(=O)NCCCCc2ccc(F)c(F)c2)ncc1C(N)=O	ZINC000450722408	EF	On-Demand	Anodyne	STAT6	29	40
COC(=O)c1coc(CN2CCc3ccc([N+](=O)[O-])cc32)n1	ZINC000450722423	DD	On-Demand	Bother	CACNA1D	50	32
CN1CCC(C)(CNC(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450722460	DG	On-Demand	Anodyne	HCN1	57	38
CN1CCC(C)(CNC(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450722460	DG	On-Demand	Anodyne	HCN4	47	30
CC[C@H](CC(F)(F)F)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450722461	EI	On-Demand	Anodyne	GRIA1	43	33
CC[C@H](CC(F)(F)F)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450722461	EI	On-Demand	Anodyne	LEF	76	35
CC[C@@H](CC(F)(F)F)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450722462	EI	On-Demand	Anodyne	GRIA1	43	33
CC[C@@H](CC(F)(F)F)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450722462	EI	On-Demand	Anodyne	LEF	76	35
Cc1cccnc1CCCN=c1ccc(C(=O)N2CCC(C)CC2)c[nH]1	ZINC000450722468	FG	On-Demand	Anodyne	L3MBTL3	47	32
Cc1cccnc1CCCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450722473	FF	On-Demand	Anodyne	LRRK2	25	42
O=C(N1CCC(n2cc(Cl)cn2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450722490	GH	On-Demand	Anodyne	MAP3K7	44	35
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450722491	DG	On-Demand	Anodyne	GPR88	0	44
Cc1cnc(CCCC(=O)N2CCCC[C@@H](C)C2)o1	ZINC000450722492	CF	On-Demand	Anodyne	PREP	43	36
Cc1cnc(CCCC(=O)N2CCCC[C@H](C)C2)o1	ZINC000450722493	CF	On-Demand	Anodyne	PREP	43	36
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H]2CCCOC2)c(OC)c1	ZINC000450722533	FE	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H]2CCCOC2)c(OC)c1	ZINC000450722533	FE	On-Demand	Anodyne	MTNR1B	51	38
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H]2CCCOC2)c(OC)c1	ZINC000450722534	FE	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H]2CCCOC2)c(OC)c1	ZINC000450722534	FE	On-Demand	Anodyne	MTNR1B	51	38
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H]2CCCOC2)c(OC)c1	ZINC000450722535	FE	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H]2CCCOC2)c(OC)c1	ZINC000450722535	FE	On-Demand	Anodyne	MTNR1B	51	38
COc1ccc(CNC(=O)CCN[C@H](C)[C@H]2CCCOC2)c(OC)c1	ZINC000450722536	FE	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@H](C)[C@H]2CCCOC2)c(OC)c1	ZINC000450722536	FE	On-Demand	Anodyne	MTNR1B	51	38
CC[C@@H]1C[C@H]1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450722541	EE	On-Demand	Bother	BDKRB1	23	43
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)c1	ZINC000450722557	GH	On-Demand	Anodyne	NPBWR1	56	35
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)noc1C	ZINC000450722568	GG	On-Demand	Anodyne	PDGFRB	27	44
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)noc1C	ZINC000450722568	GG	On-Demand	Anodyne	MTNR1A	40	40
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)noc1C	ZINC000450722568	GG	On-Demand	Anodyne	MTNR1B	28	40
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)noc1C	ZINC000450722569	GG	On-Demand	Anodyne	PDGFRB	27	44
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)noc1C	ZINC000450722569	GG	On-Demand	Anodyne	MTNR1A	40	40
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)noc1C	ZINC000450722569	GG	On-Demand	Anodyne	MTNR1B	28	40
COc1cc(O)cc(NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1	ZINC000450722571	DF	On-Demand	Anodyne	MTNR1B	19	40
CC(C)C[C@H](CO)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450722586	GE	On-Demand	Mild	PGR	27	41
CC(C)C[C@H](CO)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450722586	GE	On-Demand	Mild	NR3C2	16	42
CC(C)C[C@H](CO)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450722587	GE	On-Demand	Mild	PGR	27	41
CC(C)C[C@H](CO)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450722587	GE	On-Demand	Mild	NR3C2	16	42
CC(C)C[C@@H](CO)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450722588	GE	On-Demand	Mild	PGR	27	41
CC(C)C[C@@H](CO)N(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450722588	GE	On-Demand	Mild	NR3C2	16	42
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450722589	GE	On-Demand	Mild	PGR	27	41
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450722589	GE	On-Demand	Mild	NR3C2	16	42
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450722596	GG	On-Demand	Anodyne	SLC12A5	37	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450722597	GG	On-Demand	Anodyne	SLC12A5	37	40
Cc1cccnc1CCCNc1ccc(C#N)c(Cl)c1	ZINC000450722599	CH	On-Demand	Mild	MAP3K8	66	36
CC(=O)CCCCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450722632	FF	On-Demand	Anodyne	SCN9A	28	43
CC(=O)CCCCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450722633	FF	On-Demand	Anodyne	SCN9A	28	43
CCc1cc(NC[C@](C)(OC)c2ccccc2)n2ncnc2n1	ZINC000450722665	DF	On-Demand	Anodyne	DHOD	0	55
CCc1cc(NC[C@@](C)(OC)c2ccccc2)n2ncnc2n1	ZINC000450722666	DF	On-Demand	Anodyne	DHOD	0	55
C[C@@H](O)CCN1C(=O)N[C@@](C)(Cc2ccc3c(c2)OCO3)C1=O	ZINC000450722675	DD	On-Demand	Anodyne	SCN9A	26	43
C[C@H](O)CCN1C(=O)N[C@](C)(Cc2ccc3c(c2)OCO3)C1=O	ZINC000450722676	DD	On-Demand	Anodyne	SCN9A	26	43
C[C@H](O)CCN1C(=O)N[C@@](C)(Cc2ccc3c(c2)OCO3)C1=O	ZINC000450722677	DD	On-Demand	Anodyne	SCN9A	26	43
C[C@@H](O)CCN1C(=O)N[C@](C)(Cc2ccc3c(c2)OCO3)C1=O	ZINC000450722678	DD	On-Demand	Anodyne	SCN9A	26	43
Cc1nn(C)cc1CC(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450722679	EF	On-Demand	Anodyne	COLA	74	46
Cc1nn(C)cc1CC(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450722679	EF	On-Demand	Anodyne	CPT1A	53	41
Cc1nn(C)cc1CC(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450722680	EF	On-Demand	Anodyne	COLA	74	46
Cc1nn(C)cc1CC(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450722680	EF	On-Demand	Anodyne	CPT1A	53	41
CC(C)c1nnc(CSc2nc3cc4ccccc4cc3c(=O)n2C)s1	ZINC000450722695	GI	On-Demand	Bother	POLR1A	56	33
CC[C@H](NCc1c(C)cccc1Cl)c1nc(C)cs1	ZINC000450722715	CJ	On-Demand	Anodyne	EIF2AK1	40	34
CC[C@@H](NCc1c(C)cccc1Cl)c1nc(C)cs1	ZINC000450722716	CJ	On-Demand	Anodyne	EIF2AK1	40	34
Cc1nc(-c2ccccn2)nc(NCc2nn(C)cc2Br)c1C	ZINC000450722719	FF	On-Demand	Anodyne	METAP1	37	42
COc1cc(C)c(NC(=O)[C@@H]2Cc3cccc(C)c3O2)cc1F	ZINC000450722722	DG	On-Demand	Anodyne	ROCK2	25	41
COc1cc(C)c(NC(=O)[C@H]2Cc3cccc(C)c3O2)cc1F	ZINC000450722723	DG	On-Demand	Anodyne	ROCK2	25	41
COc1cc(C)c(NC(=O)[C@@H](C)Oc2ccccn2)cc1F	ZINC000450722724	DF	On-Demand	Anodyne	GRM4	15	44
COc1cc(C)c(NC(=O)[C@H](C)Oc2ccccn2)cc1F	ZINC000450722725	DF	On-Demand	Anodyne	GRM4	15	44
CCOC(=O)c1csc(NC[C@](C)(OC)c2ccccc2)n1	ZINC000450722728	DF	On-Demand	Anodyne	DHODH	20	40
CCOC(=O)c1csc(NC[C@@](C)(OC)c2ccccc2)n1	ZINC000450722729	DF	On-Demand	Anodyne	DHODH	20	40
CO[C@@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450722730	GG	On-Demand	Bother	BCL2L1	85	37
CO[C@@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450722730	GG	On-Demand	Bother	BCL2	58	33
CO[C@@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450722730	GG	On-Demand	Bother	TAAR1	19	40
CO[C@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450722731	GG	On-Demand	Bother	BCL2L1	85	37
CO[C@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450722731	GG	On-Demand	Bother	BCL2	58	33
CO[C@](C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450722731	GG	On-Demand	Bother	TAAR1	19	40
CO[C@@](C)(CNc1nccn(C(F)F)c1=O)c1ccccc1	ZINC000450722748	DE	On-Demand	Anodyne	CASP3	47	35
CO[C@@](C)(CNc1nccn(C(F)F)c1=O)c1ccccc1	ZINC000450722748	DE	On-Demand	Anodyne	CASP8	46	35
CO[C@](C)(CNc1nccn(C(F)F)c1=O)c1ccccc1	ZINC000450722749	DE	On-Demand	Anodyne	CASP3	47	35
CO[C@](C)(CNc1nccn(C(F)F)c1=O)c1ccccc1	ZINC000450722749	DE	On-Demand	Anodyne	CASP8	46	35
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450722752	FH	On-Demand	Anodyne	PRCP	47	36
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450722753	FH	On-Demand	Anodyne	PRCP	47	36
O=C(c1cccc2c1CCCC2)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450722777	FH	On-Demand	Anodyne	FABP4	48	43
Cc1nc(C2CC2)ccc1C(=O)N1CCCC[C@@H](C)C1	ZINC000450722786	CH	On-Demand	Anodyne	L3MBTL3	42	35
Cc1nc(C2CC2)ccc1C(=O)N1CCCC[C@@H](C)C1	ZINC000450722786	CH	On-Demand	Anodyne	HPGD	15	40
Cc1nc(C2CC2)ccc1C(=O)N1CCCC[C@H](C)C1	ZINC000450722787	CH	On-Demand	Anodyne	HPGD	15	40
C[C@@H](NCCc1ccc(Cl)cc1)c1nnc2n1CCCC2	ZINC000450722829	DG	On-Demand	Anodyne	HSD11B2	21	46
C[C@H](NCCc1ccc(Cl)cc1)c1nnc2n1CCCC2	ZINC000450722830	DG	On-Demand	Anodyne	HSD11B2	21	46
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450722846	GJ	On-Demand	Anodyne	SLC6A9	20	40
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450722846	GJ	On-Demand	Anodyne	SLC12A5	40	39
Cc1cccnc1CCCNc1ncnc2c1cnn2C	ZINC000450722849	CE	On-Demand	Anodyne	ABL1	24	41
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)ccc1O	ZINC000450722869	FH	On-Demand	Anodyne	OPRK1	27	40
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)ccc1O	ZINC000450722869	FH	On-Demand	Anodyne	COLA	97	43
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)ccc1O	ZINC000450722869	FH	On-Demand	Anodyne	CPT1A	81	43
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)ccc1O	ZINC000450722870	FH	On-Demand	Anodyne	OPRK1	27	40
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)ccc1O	ZINC000450722870	FH	On-Demand	Anodyne	COLA	97	43
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)ccc1O	ZINC000450722870	FH	On-Demand	Anodyne	CPT1A	81	43
O=C([C@@H]1CCCCC1(F)F)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450722901	FI	On-Demand	Anodyne	PRCP	45	33
O=C([C@H]1CCCCC1(F)F)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450722902	FI	On-Demand	Anodyne	PRCP	45	33
O=C([C@H]1CCCCC1(F)F)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450722903	FI	On-Demand	Anodyne	PRCP	45	33
O=C([C@@H]1CCCCC1(F)F)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450722904	FI	On-Demand	Anodyne	PRCP	45	33
Cc1nn(C)cc1CC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450722914	GH	On-Demand	Anodyne	RBP4	49	41
Cc1nn(C)cc1CC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450722914	GH	On-Demand	Anodyne	SCD	31	42
CC[C@@H]1C[C@H]1CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450722921	EE	On-Demand	Bother	TAAR1	17	44
CC[C@@H]1C[C@H]1CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450722922	EE	On-Demand	Bother	TAAR1	17	44
Cc1cc(NC(=O)c2c(Br)cnn2C)ccc1C1CC1	ZINC000450722940	EH	On-Demand	Anodyne	FLT1	16	42
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)nn(C)c1C	ZINC000450722945	GF	On-Demand	Anodyne	PDGFRB	25	42
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)nn(C)c1C	ZINC000450722945	GF	On-Demand	Anodyne	MTNR1A	45	36
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)nn(C)c1C	ZINC000450722946	GF	On-Demand	Anodyne	PDGFRB	25	42
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1c(C)nn(C)c1C	ZINC000450722946	GF	On-Demand	Anodyne	MTNR1A	45	36
C[C@H]1CCC[C@@]1(C)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450722968	DH	On-Demand	Anodyne	MAP3K7	46	32
C[C@H]1CCC[C@]1(C)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450722969	DH	On-Demand	Anodyne	MAP3K7	46	32
C[C@@H]1CCC[C@@]1(C)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450722970	DH	On-Demand	Anodyne	MAP3K7	46	32
C[C@@H]1CCC[C@]1(C)C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450722971	DH	On-Demand	Anodyne	MAP3K7	46	32
Cc1ccc(F)c(CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCCCO4)C2=O)c1	ZINC000450722994	GG	On-Demand	Anodyne	SCN9A	0	43
Cc1ccc(F)c(CN2C(=O)N[C@](C)(c3ccc4c(c3)OCCCO4)C2=O)c1	ZINC000450722995	GG	On-Demand	Anodyne	SCN9A	0	43
C=CC(C)(C)CNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450722999	CE	On-Demand	Mild	PRCP	15	45
C=CC(C)(C)CNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450723000	CE	On-Demand	Mild	PRCP	15	45
COc1cc(O)cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450723006	FF	On-Demand	Anodyne	DGAT1	24	40
COc1cc(O)cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450723006	FF	On-Demand	Anodyne	BRPF1	0	40
CC[C@@H]1C[C@H]1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450723029	DF	On-Demand	Anodyne	LRRK2	28	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450723034	GI	On-Demand	Anodyne	SLC6A9	20	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450723034	GI	On-Demand	Anodyne	LIPG	31	42
COc1cc(O)cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450723055	GG	On-Demand	Anodyne	TAAR1	29	43
COc1ccc(CC(=O)N2CCCC[C@@H](C)C2)c(Cl)c1OC	ZINC000450723056	EH	On-Demand	Anodyne	RORC	48	41
COc1ccc(CC(=O)N2CCCC[C@H](C)C2)c(Cl)c1OC	ZINC000450723057	EH	On-Demand	Anodyne	RORC	48	41
CCC(=O)C1(C(=O)N[C@H](Cc2cccc(Br)c2)CC2CC2)CC1	ZINC000450723058	GI	On-Demand	Anodyne	TIMP3	43	31
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2cc(C)n(C(C)C)n2)cc1	ZINC000450723076	FF	On-Demand	Anodyne	FPR1	34	44
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2cc(C)n(C(C)C)n2)cc1	ZINC000450723077	FF	On-Demand	Anodyne	FPR1	34	44
CCC(=O)C1(C(=O)N[C@@H](Cc2cccc(Br)c2)CC2CC2)CC1	ZINC000450723103	GI	On-Demand	Anodyne	TIMP3	43	31
COC(=O)c1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)cc1	ZINC000450723115	GH	On-Demand	Anodyne	COLA	107	45
COC(=O)c1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)cc1	ZINC000450723115	GH	On-Demand	Anodyne	CPT1A	104	45
COC(=O)c1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)cc1	ZINC000450723117	GH	On-Demand	Anodyne	COLA	107	45
COC(=O)c1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)cc1	ZINC000450723117	GH	On-Demand	Anodyne	CPT1A	104	45
Cn1c(SCCC(C)(F)F)nc2cc3ccccc3cc2c1=O	ZINC000450723122	EI	On-Demand	Bother	POLR1A	69	32
Cc1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1C1CC1	ZINC000450723129	FI	On-Demand	Anodyne	ADAM10	23	40
Cc1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)ccc1C1CC1	ZINC000450723129	FI	On-Demand	Anodyne	PDEC	0	40
Cc1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1C1CC1	ZINC000450723132	FI	On-Demand	Anodyne	ADAM10	23	40
Cc1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccc1C1CC1	ZINC000450723132	FI	On-Demand	Anodyne	PDEC	0	40
O=C(N1CCC(n2cc(Cl)cn2)CC1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450723137	GI	On-Demand	Anodyne	MAP3K7	46	37
CC[C@H](C)[C@H](NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450723138	CG	On-Demand	Anodyne	PDE6A	43	33
CC[C@H](C)[C@@H](NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450723139	CG	On-Demand	Anodyne	PDE6A	43	33
CC[C@@H](C)[C@@H](NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450723140	CG	On-Demand	Anodyne	PDE6A	43	33
CC[C@@H](C)[C@H](NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450723141	CG	On-Demand	Anodyne	PDE6A	43	33
O=C(C1=C(c2ccccc2)CCC1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450723149	FI	On-Demand	Anodyne	MAP3K7	40	37
O=C(C1=C(c2ccccc2)CCC1)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450723149	FI	On-Demand	Anodyne	L3MBTL3	54	36
COc1cc(CC(=O)N2CCCC[C@@H](C)C2)ccc1Cl	ZINC000450723150	CH	On-Demand	Anodyne	OPRK1	26	45
COc1cc(CC(=O)N2CCCC[C@@H](C)C2)ccc1Cl	ZINC000450723150	CH	On-Demand	Anodyne	ECE2	0	40
COc1cc(CC(=O)N2CCCC[C@H](C)C2)ccc1Cl	ZINC000450723151	CH	On-Demand	Anodyne	OPRK1	26	45
COc1cc(CC(=O)N2CCCC[C@H](C)C2)ccc1Cl	ZINC000450723151	CH	On-Demand	Anodyne	ECE2	0	40
C=CC(C)(C)CNc1cc(CCC)nc2ncnn12	ZINC000450723167	CF	On-Demand	Mild	DHOD	0	46
Cc1nc([C@H]2CCCN2C(=O)c2cc3ccncc3s2)cs1	ZINC000450723183	EI	On-Demand	Anodyne	CPT1A	24	40
CC(C)CCCC(=O)N1CCCC[C@@H](C)C1	ZINC000450723205	BG	On-Demand	Anodyne	PREP	30	40
CC(C)CCCC(=O)N1CCCC[C@H](C)C1	ZINC000450723206	BG	On-Demand	Anodyne	PREP	30	40
COc1cc(O)cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450723215	GF	On-Demand	Anodyne	CA12	15	49
COc1cc(O)cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450723215	GF	On-Demand	Anodyne	CA9	22	49
COc1cc(O)cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450723215	GF	On-Demand	Anodyne	RORC	66	39
C=CC(C)(C)CNc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-]	ZINC000450723223	EE	On-Demand	Mild	TAAR1	19	49
Cc1ccc(C(=O)NCC2(C)CCN(C)CC2)c(C(C)C)n1	ZINC000450723224	DF	On-Demand	Anodyne	HCN1	57	35
Cc1cccc(Cl)c1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450723239	EH	On-Demand	Anodyne	CHRM2	19	40
Cc1cccc(Cl)c1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450723239	EH	On-Demand	Anodyne	CCR3	32	43
Cc1cccc(Cl)c1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450723239	EH	On-Demand	Anodyne	CCR5	44	43
Cc1cccc(Cl)c1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450723239	EH	On-Demand	Anodyne	MAP3K7	45	34
Cc1cccc(Cl)c1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450723239	EH	On-Demand	Anodyne	L3MBTL3	80	39
O=C(Cc1ccc(O)c(F)c1)NCCCCc1ccc(F)c(F)c1	ZINC000450723247	EG	On-Demand	Anodyne	NCE103	30	48
O=C(Cc1ccc(O)c(F)c1)NCCCCc1ccc(F)c(F)c1	ZINC000450723247	EG	On-Demand	Anodyne	CAN2	0	48
C[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450723254	CG	On-Demand	Anodyne	PREP	54	38
C[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450723254	CG	On-Demand	Anodyne	NMUR2	0	40
C[C@@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450723254	CG	On-Demand	Anodyne	NMUR1	0	40
C[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450723255	CG	On-Demand	Anodyne	PREP	54	38
C[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450723255	CG	On-Demand	Anodyne	NMUR2	0	40
C[C@H]1CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450723255	CG	On-Demand	Anodyne	NMUR1	0	40
C[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450723256	CG	On-Demand	Anodyne	PREP	54	38
C[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450723256	CG	On-Demand	Anodyne	NMUR2	0	40
C[C@@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450723256	CG	On-Demand	Anodyne	NMUR1	0	40
C[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450723257	CG	On-Demand	Anodyne	PREP	54	38
C[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450723257	CG	On-Demand	Anodyne	NMUR2	0	40
C[C@H]1CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450723257	CG	On-Demand	Anodyne	NMUR1	0	40
CO[C@@](C)(CNc1ncc(C(=O)N2CCOCC2)cc1Cl)c1ccccc1	ZINC000450723273	GG	On-Demand	Anodyne	PTK6	15	40
CO[C@@](C)(CNc1ncc(C(=O)N2CCOCC2)cc1Cl)c1ccccc1	ZINC000450723273	GG	On-Demand	Anodyne	LRRK2	35	42
CO[C@](C)(CNc1ncc(C(=O)N2CCOCC2)cc1Cl)c1ccccc1	ZINC000450723274	GG	On-Demand	Anodyne	PTK6	15	40
CO[C@](C)(CNc1ncc(C(=O)N2CCOCC2)cc1Cl)c1ccccc1	ZINC000450723274	GG	On-Demand	Anodyne	LRRK2	35	42
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450723287	DG	On-Demand	Anodyne	CPT1A	41	38
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450723289	DG	On-Demand	Anodyne	CPT1A	41	38
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450723291	DG	On-Demand	Anodyne	CPT1A	41	38
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450723293	DG	On-Demand	Anodyne	CPT1A	41	38
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H]2CCCO2)c(OC)c1	ZINC000450723294	ED	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H]2CCCO2)c(OC)c1	ZINC000450723300	ED	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(CNC(=O)CCN[C@H](C)[C@H]2CCCO2)c(OC)c1	ZINC000450723302	ED	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H]2CCCO2)c(OC)c1	ZINC000450723303	ED	On-Demand	Anodyne	MTNR1A	53	37
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450723304	FF	On-Demand	Anodyne	LEF	48	38
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)Cc2cc(C)ccc2F)cc1	ZINC000450723308	FF	On-Demand	Anodyne	LEF	48	38
COc1cc(O)cc(NC(=O)[C@@H](C)OCCc2ccccc2)c1	ZINC000450723312	DF	On-Demand	Anodyne	MMP3	35	44
COc1cc(O)cc(NC(=O)[C@@H](C)OCCc2ccccc2)c1	ZINC000450723312	DF	On-Demand	Anodyne	ABCB1	23	42
COc1cc(O)cc(NC(=O)[C@H](C)OCCc2ccccc2)c1	ZINC000450723314	DF	On-Demand	Anodyne	MMP3	35	44
COc1cc(O)cc(NC(=O)[C@H](C)OCCc2ccccc2)c1	ZINC000450723314	DF	On-Demand	Anodyne	ABCB1	23	42
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](CO)CC(C)C)ccc21	ZINC000450723316	GH	On-Demand	Anodyne	PDGFRB	0	42
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](CO)CC(C)C)ccc21	ZINC000450723316	GH	On-Demand	Anodyne	PLK1	48	35
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@H](CO)CC(C)C)ccc21	ZINC000450723316	GH	On-Demand	Anodyne	HPGD	44	55
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](CO)CC(C)C)ccc21	ZINC000450723319	GH	On-Demand	Anodyne	PDGFRB	0	42
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](CO)CC(C)C)ccc21	ZINC000450723319	GH	On-Demand	Anodyne	PLK1	48	35
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H](CO)CC(C)C)ccc21	ZINC000450723319	GH	On-Demand	Anodyne	HPGD	44	55
Cc1cccnc1CCCNc1nc2ccccc2nc1N1CCOCC1	ZINC000450723337	FG	On-Demand	Anodyne	HNMT	50	33
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723373	GF	On-Demand	Anodyne	MMP13	20	44
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723373	GF	On-Demand	Anodyne	CAPNS1	58	39
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723373	GF	On-Demand	Anodyne	MMP2	32	45
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723373	GF	On-Demand	Anodyne	MMP3	27	40
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723373	GF	On-Demand	Anodyne	MMP8	16	42
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723373	GF	On-Demand	Anodyne	CAPN1	46	41
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723373	GF	On-Demand	Anodyne	MMP9	20	42
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723373	GF	On-Demand	Anodyne	CAPN2	53	33
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723374	GF	On-Demand	Anodyne	MMP13	20	44
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723374	GF	On-Demand	Anodyne	CAPNS1	58	39
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723374	GF	On-Demand	Anodyne	MMP2	32	45
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723374	GF	On-Demand	Anodyne	MMP3	27	40
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723374	GF	On-Demand	Anodyne	MMP8	16	42
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723374	GF	On-Demand	Anodyne	CAPN1	46	41
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723374	GF	On-Demand	Anodyne	MMP9	20	42
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723374	GF	On-Demand	Anodyne	CAPN2	53	33
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723375	GF	On-Demand	Anodyne	MMP13	20	44
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723375	GF	On-Demand	Anodyne	CAPNS1	58	39
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723375	GF	On-Demand	Anodyne	MMP2	32	45
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723375	GF	On-Demand	Anodyne	MMP3	27	40
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723375	GF	On-Demand	Anodyne	MMP8	16	42
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723375	GF	On-Demand	Anodyne	CAPN1	46	41
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723375	GF	On-Demand	Anodyne	MMP9	20	42
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H](C)OCCc2ccccc2)cc1	ZINC000450723375	GF	On-Demand	Anodyne	CAPN2	53	33
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723376	GF	On-Demand	Anodyne	MMP13	20	44
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723376	GF	On-Demand	Anodyne	CAPNS1	58	39
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723376	GF	On-Demand	Anodyne	MMP2	32	45
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723376	GF	On-Demand	Anodyne	MMP3	27	40
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723376	GF	On-Demand	Anodyne	MMP8	16	42
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723376	GF	On-Demand	Anodyne	CAPN1	46	41
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723376	GF	On-Demand	Anodyne	MMP9	20	42
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H](C)OCCc2ccccc2)cc1	ZINC000450723376	GF	On-Demand	Anodyne	CAPN2	53	33
CC(=O)N[C@H](C(=O)NCCCCc1ccc(F)c(F)c1)C(C)(C)C	ZINC000450723432	EF	On-Demand	Anodyne	LEF	58	35
CC1(O)CC(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1	ZINC000450723452	FG	On-Demand	Anodyne	RBP4	59	40
CC1(O)CC(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1	ZINC000450723452	FG	On-Demand	Anodyne	SCD1	28	40
CC1(O)CC(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1	ZINC000450723452	FG	On-Demand	Anodyne	SFRP1	98	37
CC1(O)CC(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1	ZINC000450723452	FG	On-Demand	Anodyne	WNT3	76	34
C=C[C@@H]1OCC[C@H]1C(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450723453	EF	On-Demand	Mild	PRCP	46	35
C=C[C@@H]1OCC[C@H]1C(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450723454	EF	On-Demand	Mild	PRCP	46	35
Cc1nc([C@H]2CCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)cs1	ZINC000450723475	FI	On-Demand	Anodyne	COLA	39	42
Cc1nc([C@H]2CCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)cs1	ZINC000450723475	FI	On-Demand	Anodyne	CPT1A	37	42
Cc1nc([C@H]2CCCN2C(=O)c2cc(Cl)c3ccccc3n2)cs1	ZINC000450723504	FJ	On-Demand	Anodyne	CPT1A	41	39
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450723540	FE	On-Demand	Anodyne	MMP13	28	43
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450723540	FE	On-Demand	Anodyne	MMP2	22	43
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450723540	FE	On-Demand	Anodyne	MMP14	16	40
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450723540	FE	On-Demand	Anodyne	MMP10	24	40
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450723541	FE	On-Demand	Anodyne	MMP13	28	43
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450723541	FE	On-Demand	Anodyne	MMP2	22	43
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450723541	FE	On-Demand	Anodyne	MMP14	16	40
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C2(CF)CCOCC2)cc1	ZINC000450723541	FE	On-Demand	Anodyne	MMP10	24	40
COCCOC[C@H](O)CN[C@H](C)[C@@H](C)C1CCCCC1	ZINC000450723544	CE	On-Demand	Anodyne	ADRB2	34	45
COCCOC[C@H](O)CN[C@H](C)[C@@H](C)C1CCCCC1	ZINC000450723544	CE	On-Demand	Anodyne	ADRB1	0	44
COCCOC[C@H](O)CN[C@@H](C)[C@@H](C)C1CCCCC1	ZINC000450723545	CE	On-Demand	Anodyne	ADRB2	34	45
COCCOC[C@H](O)CN[C@@H](C)[C@@H](C)C1CCCCC1	ZINC000450723545	CE	On-Demand	Anodyne	ADRB1	0	44
COCCOC[C@H](O)CN[C@@H](C)[C@H](C)C1CCCCC1	ZINC000450723546	CE	On-Demand	Anodyne	ADRB2	34	45
COCCOC[C@H](O)CN[C@@H](C)[C@H](C)C1CCCCC1	ZINC000450723546	CE	On-Demand	Anodyne	ADRB1	0	44
COCCOC[C@H](O)CN[C@H](C)[C@H](C)C1CCCCC1	ZINC000450723547	CE	On-Demand	Anodyne	ADRB2	34	45
COCCOC[C@H](O)CN[C@H](C)[C@H](C)C1CCCCC1	ZINC000450723547	CE	On-Demand	Anodyne	ADRB1	0	44
Cn1c(SCC2CC(F)(F)C2)nc2cc3ccccc3cc2c1=O	ZINC000450723550	EI	On-Demand	Bother	POLR1A	69	33
CC(C)c1nc([C@@H]2CCCCCN2C(=O)CCc2ccc(C(N)=O)cc2)no1	ZINC000450723551	GG	On-Demand	Anodyne	COLA	110	45
CC(C)c1nc([C@@H]2CCCCCN2C(=O)CCc2ccc(C(N)=O)cc2)no1	ZINC000450723551	GG	On-Demand	Anodyne	CPT1A	106	45
CC(C)c1nc([C@H]2CCCCCN2C(=O)CCc2ccc(C(N)=O)cc2)no1	ZINC000450723552	GG	On-Demand	Anodyne	COLA	110	45
CC(C)c1nc([C@H]2CCCCCN2C(=O)CCc2ccc(C(N)=O)cc2)no1	ZINC000450723552	GG	On-Demand	Anodyne	CPT1A	106	45
COc1ccc(CNC(=O)CCN[C@H](C)c2cnn(C)c2C)c(OC)c1	ZINC000450723574	FE	On-Demand	Anodyne	PDGFRB	44	51
COc1ccc(CNC(=O)CCN[C@H](C)c2cnn(C)c2C)c(OC)c1	ZINC000450723574	FE	On-Demand	Anodyne	MTNR1A	45	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cnn(C)c2C)c(OC)c1	ZINC000450723574	FE	On-Demand	Anodyne	MTNR1B	33	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cnn(C)c2C)c(OC)c1	ZINC000450723574	FE	On-Demand	Anodyne	CSF1R	18	51
COc1ccc(CNC(=O)CCN[C@@H](C)c2cnn(C)c2C)c(OC)c1	ZINC000450723575	FE	On-Demand	Anodyne	PDGFRB	44	51
COc1ccc(CNC(=O)CCN[C@@H](C)c2cnn(C)c2C)c(OC)c1	ZINC000450723575	FE	On-Demand	Anodyne	MTNR1A	45	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cnn(C)c2C)c(OC)c1	ZINC000450723575	FE	On-Demand	Anodyne	MTNR1B	33	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cnn(C)c2C)c(OC)c1	ZINC000450723575	FE	On-Demand	Anodyne	CSF1R	18	51
O=C(NC1(c2ccc(C(F)(F)F)cc2)CCCC1)c1cc2n(n1)CCC2	ZINC000450723576	FI	On-Demand	Anodyne	SLC6A9	15	47
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(C)o2)c(OC)c1	ZINC000450723577	EF	On-Demand	Anodyne	MTNR1A	61	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(C)o2)c(OC)c1	ZINC000450723577	EF	On-Demand	Anodyne	MTNR1B	42	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(C)o2)c(OC)c1	ZINC000450723578	EF	On-Demand	Anodyne	MTNR1A	61	39
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(C)o2)c(OC)c1	ZINC000450723578	EF	On-Demand	Anodyne	MTNR1B	42	38
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450723581	DF	On-Demand	Mild	CA2	42	38
CC[C@H](CC(F)(F)F)C(=O)Nc1cc(O)cc(OC)c1	ZINC000450723586	CG	On-Demand	Anodyne	ACAT	0	46
CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(O)cc(OC)c1	ZINC000450723587	CG	On-Demand	Anodyne	ACAT	0	46
CC[C@@H]1C[C@H]1CNc1ncc(C(=O)OC)cc1[N+](=O)[O-]	ZINC000450723596	CE	On-Demand	Bother	PRKCQ	46	36
Cc1cccc(CNC(=O)c2ccc(C(=O)N(C)[C@H](CO)CC(C)C)cc2)c1	ZINC000450723607	GG	On-Demand	Anodyne	ANPEP	25	49
Cc1cccc(CNC(=O)c2ccc(C(=O)N(C)[C@@H](CO)CC(C)C)cc2)c1	ZINC000450723608	GG	On-Demand	Anodyne	ANPEP	25	49
Cc1cccnc1CCCNc1ncc(Cl)cc1F	ZINC000450723613	CH	On-Demand	Anodyne	HNMT	40	30
C=CC(C)(C)CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450723630	CG	On-Demand	Mild	TAAR1	17	47
C=CC(C)(C)CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450723630	CG	On-Demand	Mild	AKR1C3	18	43
COc1cc(O)cc(NC(=O)c2ccc(C)c3c2CCC3)c1	ZINC000450723637	CG	On-Demand	Anodyne	KCNK9	41	37
C[C@@H]1CCCCN(C(=O)c2cc3c(Br)cccc3cn2)C1	ZINC000450723642	EI	On-Demand	Anodyne	TRPC6	45	32
C[C@H]1CCCCN(C(=O)c2cc3c(Br)cccc3cn2)C1	ZINC000450723643	EI	On-Demand	Anodyne	TRPC6	45	32
C[C@@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450723654	FG	On-Demand	Mild	COLA	59	40
C[C@@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450723654	FG	On-Demand	Mild	CPT1A	56	40
C[C@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450723655	FG	On-Demand	Mild	COLA	59	40
C[C@H]1CCCCN(C(=O)COc2cccc(Br)c2C#N)C1	ZINC000450723655	FG	On-Demand	Mild	CPT1A	56	40
COc1cc(O)cc(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450723669	CE	On-Demand	Anodyne	PRNP	34	41
COc1cc(O)cc(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450723669	CE	On-Demand	Anodyne	HDAC1	32	40
COc1cc(O)cc(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450723669	CE	On-Demand	Anodyne	TAAR1	41	44
COc1cc(O)cc(NC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450723669	CE	On-Demand	Anodyne	DGAT1	49	44
C[C@@H](Oc1ccccn1)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450723670	EG	On-Demand	Anodyne	LEF	42	32
C[C@H](Oc1ccccn1)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450723671	EG	On-Demand	Anodyne	LEF	42	32
COc1cc(O)cc(NC(=O)c2cc3n(n2)CCC3)c1	ZINC000450723681	CD	On-Demand	Anodyne	GLMU	0	40
C[C@H]1CCCCN(C(=O)[C@H](C)OCc2ccc(F)cc2)C1	ZINC000450723686	CG	On-Demand	Anodyne	CCR3	43	32
C[C@H]1CCCCN(C(=O)[C@H](C)OCc2ccc(F)cc2)C1	ZINC000450723686	CG	On-Demand	Anodyne	DPP7	48	33
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450723687	CG	On-Demand	Anodyne	CCR3	43	32
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450723687	CG	On-Demand	Anodyne	DPP7	48	33
C[C@H]1CCCCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450723688	CG	On-Demand	Anodyne	CCR3	43	32
C[C@H]1CCCCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450723688	CG	On-Demand	Anodyne	DPP7	48	33
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450723689	CG	On-Demand	Anodyne	CCR3	43	32
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450723689	CG	On-Demand	Anodyne	DPP7	48	33
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCCC2)cc1C(N)=O	ZINC000450723696	FD	On-Demand	Anodyne	SLC6A9	19	42
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCCC2)cc1C(N)=O	ZINC000450723696	FD	On-Demand	Anodyne	GCK	50	31
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCCC2)cc1C(N)=O	ZINC000450723696	FD	On-Demand	Anodyne	GCKR	45	31
CC[C@@H](CC(C)C)C(=O)N1CCCC[C@H](C)C1	ZINC000450723701	BH	On-Demand	Anodyne	RIR1_HHV11	64	37
CC[C@@H](CC(C)C)C(=O)N1CCCC[C@@H](C)C1	ZINC000450723702	BH	On-Demand	Anodyne	RIR1_HHV11	64	37
CC[C@H](CC(C)C)C(=O)N1CCCC[C@H](C)C1	ZINC000450723703	BH	On-Demand	Anodyne	RIR1_HHV11	64	37
CC[C@H](CC(C)C)C(=O)N1CCCC[C@@H](C)C1	ZINC000450723704	BH	On-Demand	Anodyne	RIR1_HHV11	64	37
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	ACE	24	42
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	MME	63	42
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	ANPEP	70	35
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	BMP1	63	38
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	CTSB	47	40
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	PAPA1_CARPA	57	42
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	CPA1	35	42
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	CTRB1	26	40
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	CAPNS1	48	35
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	HLA-DRB1	43	32
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	CAPN1	47	35
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	CAPN2	70	35
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	ACE2	60	42
CC[C@H](C)[C@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723710	CE	On-Demand	Anodyne	PDS	46	33
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	ACE	24	42
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	MME	63	42
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	ANPEP	70	35
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	BMP1	63	38
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	CTSB	47	40
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	PAPA1_CARPA	57	42
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	CPA1	35	42
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	CTRB1	26	40
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	CAPNS1	48	35
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	HLA-DRB1	43	32
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	CAPN1	47	35
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	CAPN2	70	35
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	ACE2	60	42
CC[C@H](C)[C@@H](NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723711	CE	On-Demand	Anodyne	PDS	46	33
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	ACE	24	42
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	MME	63	42
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	ANPEP	70	35
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	BMP1	63	38
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	CTSB	47	40
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	PAPA1_CARPA	57	42
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	CPA1	35	42
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	CTRB1	26	40
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	CAPNS1	48	35
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	HLA-DRB1	43	32
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	CAPN1	47	35
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	CAPN2	70	35
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	ACE2	60	42
CC[C@H](C)[C@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723712	CE	On-Demand	Anodyne	PDS	46	33
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	ACE	24	42
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	MME	63	42
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	ANPEP	70	35
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	BMP1	63	38
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	CTSB	47	40
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	PAPA1_CARPA	57	42
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	CPA1	35	42
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	CTRB1	26	40
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	CAPNS1	48	35
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	HLA-DRB1	43	32
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	CAPN1	47	35
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	CAPN2	70	35
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	ACE2	60	42
CC[C@H](C)[C@@H](NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450723713	CE	On-Demand	Anodyne	PDS	46	33
Cc1cccnc1CCCNc1ccc([N+](=O)[O-])cc1F	ZINC000450723714	CG	On-Demand	Bother	NFKBIA	0	42
C=CC(C)(C)CNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450723726	GE	On-Demand	Mild	BCL2L1	82	33
C=CC(C)(C)CNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450723726	GE	On-Demand	Mild	BCL2	57	33
C=CC(C)(C)CNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450723726	GE	On-Demand	Mild	BCL2L2	42	30
CN1C(=O)CC[C@H]1C(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450723734	FG	On-Demand	Anodyne	SRD5A2	18	41
CN1C(=O)CC[C@H]1C(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450723734	FG	On-Demand	Anodyne	P2RX7	26	45
CN1C(=O)CC[C@@H]1C(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450723735	FG	On-Demand	Anodyne	SRD5A2	18	41
CN1C(=O)CC[C@@H]1C(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450723735	FG	On-Demand	Anodyne	P2RX7	26	45
C[C@@H]1CCCCN(C(=O)c2cccc(C#N)c2Br)C1	ZINC000450723757	DH	On-Demand	Mild	L3MBTL3	46	37
CCn1c(SCC[C@@H](C)O)nc2cc3ccccc3cc2c1=O	ZINC000450723782	EG	On-Demand	Bother	POLR1A	77	40
CCn1c(SCC[C@H](C)O)nc2cc3ccccc3cc2c1=O	ZINC000450723784	EG	On-Demand	Bother	POLR1A	77	40
C[C@H](c1ccccc1)[C@H](O)CN[C@@H](CC(N)=O)C1CCCCC1	ZINC000450723785	DF	On-Demand	Anodyne	AMY2	44	31
C[C@H](c1ccccc1)[C@H](O)CN[C@@H](CC(N)=O)C1CCCCC1	ZINC000450723785	DF	On-Demand	Anodyne	METAP2	0	41
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H](CC(N)=O)C1CCCCC1	ZINC000450723786	DF	On-Demand	Anodyne	AMY2	44	31
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H](CC(N)=O)C1CCCCC1	ZINC000450723786	DF	On-Demand	Anodyne	METAP2	0	41
C[C@H](c1ccccc1)[C@@H](O)CN[C@H](CC(N)=O)C1CCCCC1	ZINC000450723787	DF	On-Demand	Anodyne	AMY2	44	31
C[C@H](c1ccccc1)[C@@H](O)CN[C@H](CC(N)=O)C1CCCCC1	ZINC000450723787	DF	On-Demand	Anodyne	METAP2	0	41
C[C@H](c1ccccc1)[C@H](O)CN[C@H](CC(N)=O)C1CCCCC1	ZINC000450723788	DF	On-Demand	Anodyne	AMY2	44	31
C[C@H](c1ccccc1)[C@H](O)CN[C@H](CC(N)=O)C1CCCCC1	ZINC000450723788	DF	On-Demand	Anodyne	METAP2	0	41
CC[C@@H]1C[C@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000450723801	CD	On-Demand	Bother	PRKCQ	41	36
O=C(CC1CC(F)(F)C1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450723805	GJ	On-Demand	Anodyne	RBP4	67	39
O=C(CC1CC(F)(F)C1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450723805	GJ	On-Demand	Anodyne	SFRP1	28	41
O=C(CC1CC(F)(F)C1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450723805	GJ	On-Demand	Anodyne	SCD	33	42
COCc1cc([N+](=O)[O-])ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450723806	EH	On-Demand	Bother	F2RL3	50	41
COCc1cc([N+](=O)[O-])ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450723807	EH	On-Demand	Bother	F2RL3	50	41
Cc1cc(NC(=O)c2ccnn2CC(F)(F)F)ccc1C1CC1	ZINC000450723812	DH	On-Demand	Anodyne	FLT1	29	47
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450723814	GF	On-Demand	Anodyne	MMP13	0	42
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2ccc(-c3cnn(C)c3)o2)cc1	ZINC000450723815	GF	On-Demand	Anodyne	MMP13	0	42
CO[C@](C)(CNc1cc(N2CCCC2)ncn1)c1ccccc1	ZINC000450723848	DG	On-Demand	Anodyne	GALR2	46	35
CO[C@@](C)(CNc1cc(N2CCCC2)ncn1)c1ccccc1	ZINC000450723849	DG	On-Demand	Anodyne	GALR2	46	35
C=CC(C)(C)CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000450723870	CD	On-Demand	Mild	TBXA2R	25	40
COc1cc(O)cc(NC(=O)Cc2cn(C)nc2C)c1	ZINC000450723871	CD	On-Demand	Anodyne	PDGFRB	23	41
CN1C(=O)C[C@@H](C(=O)NCCCCc2ccc(F)c(F)c2)[C@@H]1c1cccnc1	ZINC000450723877	GG	On-Demand	Anodyne	NAMPT	17	42
C[C@H](O)CCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450723886	ED	On-Demand	Anodyne	SCN9A	25	42
C[C@@H](O)CCCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450723887	ED	On-Demand	Anodyne	SCN9A	25	42
C[C@H](O)CCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450723888	ED	On-Demand	Anodyne	SCN9A	25	42
C[C@@H](O)CCCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450723889	ED	On-Demand	Anodyne	SCN9A	25	42
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	F2	71	41
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	PLG	18	41
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	FKBP1A	60	51
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	OPRM1	27	40
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	ELANE	42	37
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	TRY1_BOVIN	76	40
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	NTSR1	47	32
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	NTSR2	40	30
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	DPP4	19	49
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	PREP	104	53
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	LGMN	58	37
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	CFTR	57	38
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	XIAP	35	42
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	SFRP1	40	38
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	WNT3	45	38
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	BRCA1	44	32
O=C(NCCCCc1ccc(F)c(F)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450723898	GH	On-Demand	Anodyne	TMPRSS11D	71	41
C=CC(C)(C)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450723907	ED	On-Demand	Mild	TGM2	62	49
C=CC(C)(C)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450723907	ED	On-Demand	Mild	F13A1	60	35
C=CC(C)(C)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450723907	ED	On-Demand	Mild	GCKR	45	30
COc1cc(O)cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450723909	DF	On-Demand	Anodyne	LIMK2	22	42
COc1cc(O)cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450723910	DF	On-Demand	Anodyne	LIMK2	22	42
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(Cl)s2)c(OC)c1	ZINC000450723912	GH	On-Demand	Anodyne	MTNR1A	48	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(Cl)s2)c(OC)c1	ZINC000450723913	GH	On-Demand	Anodyne	MTNR1A	48	38
Cc1cc([N+](=O)[O-])ccc1NCCCc1ncccc1C	ZINC000450723914	CH	On-Demand	Bother	NFKBIA	0	44
COCc1nn(C)cc1C(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450723922	GH	On-Demand	Anodyne	SLC6A9	0	40
COCc1cc(NCCCc2ncccc2C)n2ncnc2n1	ZINC000450723928	DE	On-Demand	Anodyne	DHOD	0	45
C[C@@H]1CCCCN(C(=O)c2ccsc2Br)C1	ZINC000450723930	DH	On-Demand	Anodyne	TRPC6	46	32
C[C@H]1CCCCN(C(=O)c2ccsc2Br)C1	ZINC000450723931	DH	On-Demand	Anodyne	TRPC6	46	32
COc1cccc(OCCC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450723963	GI	On-Demand	Anodyne	COLA	147	51
COc1cccc(OCCC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450723963	GI	On-Demand	Anodyne	CPT1A	137	51
COc1cccc(OCCC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450723964	GI	On-Demand	Anodyne	COLA	147	51
COc1cccc(OCCC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450723964	GI	On-Demand	Anodyne	CPT1A	137	51
CO[C@@](C)(CNc1ncc([N+](=O)[O-])c(N)n1)c1ccccc1	ZINC000450723965	DD	On-Demand	Bother	PRKCQ	50	45
CO[C@](C)(CNc1ncc([N+](=O)[O-])c(N)n1)c1ccccc1	ZINC000450723966	DD	On-Demand	Bother	PRKCQ	50	45
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1nccs1	ZINC000450723968	FF	On-Demand	Anodyne	MTNR1B	24	41
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1nccs1	ZINC000450723969	FF	On-Demand	Anodyne	MTNR1B	24	41
C[C@@H](O)CCSc1nc2cc3ccccc3cc2c(=O)n1C	ZINC000450723979	DF	On-Demand	Bother	POLR1A	75	37
C[C@H](O)CCSc1nc2cc3ccccc3cc2c(=O)n1C	ZINC000450723980	DF	On-Demand	Bother	POLR1A	75	37
C=CCOc1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)cc1	ZINC000450723981	GI	On-Demand	Mild	COLA	130	48
C=CCOc1ccc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)cc1	ZINC000450723981	GI	On-Demand	Mild	CPT1A	122	48
C=CCOc1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)cc1	ZINC000450723982	GI	On-Demand	Mild	COLA	130	48
C=CCOc1ccc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)cc1	ZINC000450723982	GI	On-Demand	Mild	CPT1A	122	48
CC[C@@H]1C[C@H]1CNc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-]	ZINC000450723991	ED	On-Demand	Bother	TAAR1	17	45
CNS(=O)(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)c(F)c1	ZINC000450723992	FF	On-Demand	Anodyne	PRTN3	43	30
CNS(=O)(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)c(F)c1	ZINC000450723993	FF	On-Demand	Anodyne	PRTN3	43	30
Cc1nc([C@H]2CCCN2C(=O)c2ccc(C(C)(F)F)nc2)cs1	ZINC000450723994	EH	On-Demand	Anodyne	COLA	0	43
Cc1nc([C@H]2CCCN2C(=O)c2ccc(C(C)(F)F)nc2)cs1	ZINC000450723994	EH	On-Demand	Anodyne	CPT1A	20	43
Cc1cc(NC(=O)c2ccc(C#N)n2C)ccc1C1CC1	ZINC000450724022	CG	On-Demand	Mild	DHODH	19	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724025	GJ	On-Demand	Anodyne	RBP4	85	39
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724025	GJ	On-Demand	Anodyne	SCD1	33	42
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724025	GJ	On-Demand	Anodyne	SFRP1	77	33
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724025	GJ	On-Demand	Anodyne	SCD	32	42
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724025	GJ	On-Demand	Anodyne	WNT3	68	33
C/C=C/COc1cccc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450724026	FI	On-Demand	Anodyne	COLA	120	46
C/C=C/COc1cccc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450724026	FI	On-Demand	Anodyne	CPT1A	113	46
C/C=C\COc1cccc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450724027	FI	On-Demand	Anodyne	COLA	120	46
C/C=C\COc1cccc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450724027	FI	On-Demand	Anodyne	CPT1A	113	46
COC(=O)c1coc(CN[C@@H]2CCCCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450724039	GJ	On-Demand	Anodyne	RBP4	44	31
COC(=O)c1coc(CN[C@@H]2CCCCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450724040	GJ	On-Demand	Anodyne	RBP4	44	31
COC(=O)c1coc(CN[C@H]2CCCCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450724041	GJ	On-Demand	Anodyne	RBP4	44	31
COC(=O)c1coc(CN[C@H]2CCCCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450724042	GJ	On-Demand	Anodyne	RBP4	44	31
CC(=O)c1ccc(CSc2ccc(S(=O)(=O)N3CCCCC3)cn2)cc1	ZINC000450724048	GH	On-Demand	Anodyne	NAMPT	34	42
C[C@H]1CCCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450724070	DG	On-Demand	Anodyne	CPT2	22	40
C[C@H]1CCCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450724070	DG	On-Demand	Anodyne	PDEC	0	40
C[C@@H]1CCCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450724071	DG	On-Demand	Anodyne	CPT2	22	40
C[C@@H]1CCCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450724071	DG	On-Demand	Anodyne	PDEC	0	40
C[C@H]1CCCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450724072	DG	On-Demand	Anodyne	CPT2	22	40
C[C@H]1CCCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450724072	DG	On-Demand	Anodyne	PDEC	0	40
C[C@@H]1CCCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450724073	DG	On-Demand	Anodyne	CPT2	22	40
C[C@@H]1CCCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450724073	DG	On-Demand	Anodyne	PDEC	0	40
CSc1cccc(C(=O)N2CCCC[C@@H](C)C2)c1	ZINC000450724089	CH	On-Demand	Anodyne	PREP	30	43
CSc1cccc(C(=O)N2CCCC[C@@H](C)C2)c1	ZINC000450724089	CH	On-Demand	Anodyne	RHOA	0	51
CSc1cccc(C(=O)N2CCCC[C@@H](C)C2)c1	ZINC000450724089	CH	On-Demand	Anodyne	L3MBTL1	0	46
CSc1cccc(C(=O)N2CCCC[C@@H](C)C2)c1	ZINC000450724089	CH	On-Demand	Anodyne	L3MBTL3	70	46
CSc1cccc(C(=O)N2CCCC[C@@H](C)C2)c1	ZINC000450724089	CH	On-Demand	Anodyne	HPGD	42	45
CSc1cccc(C(=O)N2CCCC[C@H](C)C2)c1	ZINC000450724090	CH	On-Demand	Anodyne	PREP	25	43
CSc1cccc(C(=O)N2CCCC[C@H](C)C2)c1	ZINC000450724090	CH	On-Demand	Anodyne	RHOA	0	51
CSc1cccc(C(=O)N2CCCC[C@H](C)C2)c1	ZINC000450724090	CH	On-Demand	Anodyne	L3MBTL1	0	46
CSc1cccc(C(=O)N2CCCC[C@H](C)C2)c1	ZINC000450724090	CH	On-Demand	Anodyne	L3MBTL3	57	46
CSc1cccc(C(=O)N2CCCC[C@H](C)C2)c1	ZINC000450724090	CH	On-Demand	Anodyne	HPGD	42	45
Cc1cc(C)cc(-n2ncc3c(=O)n(CCC(C)(F)F)cnc32)c1	ZINC000450724105	EG	On-Demand	Anodyne	Q9M629_MAIZE	54	32
O=C(NCCCCc1ccc(F)c(F)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450724137	DH	On-Demand	Anodyne	SCNN1A	47	32
CCC[C@H](OC)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450724190	CG	On-Demand	Anodyne	INHA	40	32
CCC[C@H](OC)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450724190	CG	On-Demand	Anodyne	LEF	86	38
CCC[C@H](OC)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450724190	CG	On-Demand	Anodyne	ASAH1	41	32
CCC[C@@H](OC)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450724191	CG	On-Demand	Anodyne	INHA	40	32
CCC[C@@H](OC)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450724191	CG	On-Demand	Anodyne	LEF	86	38
CCC[C@@H](OC)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450724191	CG	On-Demand	Anodyne	ASAH1	41	32
Cc1ccc2c(NCCCc3ncccc3C)ccnc2n1	ZINC000450724192	CH	On-Demand	Anodyne	HNMT	52	33
O=C([C@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724193	FH	On-Demand	Anodyne	RBP4	55	36
O=C([C@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724193	FH	On-Demand	Anodyne	SCD1	27	42
O=C([C@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724193	FH	On-Demand	Anodyne	SFRP1	61	33
O=C([C@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724193	FH	On-Demand	Anodyne	SCD	30	40
O=C([C@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724193	FH	On-Demand	Anodyne	WNT3	52	33
C=CC(C)(C)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000450724195	GE	On-Demand	Mild	F13A1	40	33
O=C([C@@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724196	FH	On-Demand	Anodyne	RBP4	55	36
O=C([C@@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724196	FH	On-Demand	Anodyne	SCD1	27	42
O=C([C@@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724196	FH	On-Demand	Anodyne	SFRP1	61	33
O=C([C@@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724196	FH	On-Demand	Anodyne	SCD	30	40
O=C([C@@H]1CC1(F)F)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724196	FH	On-Demand	Anodyne	WNT3	52	33
Cn1c(C(=O)NCCCCc2ccc(F)c(F)c2)c2n(c1=O)CCCC2	ZINC000450724200	FF	On-Demand	Anodyne	ABCC1	45	43
Cc1nc([C@H]2CCCN2C(=O)c2ccc(-c3cnn(C)c3)o2)cs1	ZINC000450724211	EG	On-Demand	Anodyne	TRPC6	44	32
CCCOc1ccc(C(=O)Nc2cc(O)cc(OC)c2)c(OC)c1	ZINC000450724223	EG	On-Demand	Anodyne	KCNK3	55	45
CCCOc1ccc(C(=O)Nc2cc(O)cc(OC)c2)c(OC)c1	ZINC000450724223	EG	On-Demand	Anodyne	KCNK9	46	45
CSc1cccc(C(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450724224	DI	On-Demand	Anodyne	COLA	36	41
CSc1cccc(C(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450724224	DI	On-Demand	Anodyne	CPT1A	35	41
CSc1cccc(C(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450724224	DI	On-Demand	Anodyne	GRM5	0	43
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2c2csc(C)n2)on1	ZINC000450724230	EF	On-Demand	Anodyne	COLA	61	40
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2c2csc(C)n2)on1	ZINC000450724230	EF	On-Demand	Anodyne	CPT1A	43	39
C=CC(C)(C)CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450724237	FG	On-Demand	Mild	TBXA2R	20	40
COC(=O)c1csc(CN2CCc3ccc([N+](=O)[O-])cc32)n1	ZINC000450724256	DE	On-Demand	Bother	CACNA1D	48	32
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc3ccccc3o2)c(OC)c1	ZINC000450724278	GH	On-Demand	Anodyne	NQO2	21	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc3ccccc3o2)c(OC)c1	ZINC000450724278	GH	On-Demand	Anodyne	MTNR1A	85	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc3ccccc3o2)c(OC)c1	ZINC000450724278	GH	On-Demand	Anodyne	MTNR1B	75	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cc3ccccc3o2)c(OC)c1	ZINC000450724280	GH	On-Demand	Anodyne	NQO2	21	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cc3ccccc3o2)c(OC)c1	ZINC000450724280	GH	On-Demand	Anodyne	MTNR1A	85	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cc3ccccc3o2)c(OC)c1	ZINC000450724280	GH	On-Demand	Anodyne	MTNR1B	75	41
Cc1cccnc1CCCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000450724291	EF	On-Demand	Bother	NFKBIA	0	40
Cc1cccnc1CCCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450724294	FD	On-Demand	Anodyne	NPY2R	63	38
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2cncc(Cl)c2)no1	ZINC000450724312	EH	On-Demand	Anodyne	COLA	54	39
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2cncc(Cl)c2)no1	ZINC000450724312	EH	On-Demand	Anodyne	CPT1A	53	39
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2cncc(Cl)c2)no1	ZINC000450724313	EH	On-Demand	Anodyne	COLA	54	39
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2cncc(Cl)c2)no1	ZINC000450724313	EH	On-Demand	Anodyne	CPT1A	53	39
CO[C@@](C)(CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)c1ccccc1	ZINC000450724324	FE	On-Demand	Bother	F2RL3	46	34
CO[C@](C)(CNc1cc([N+](=O)[O-])ccc1S(N)(=O)=O)c1ccccc1	ZINC000450724325	FE	On-Demand	Bother	F2RL3	46	34
Cc1csc(C(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)c1	ZINC000450724390	EG	On-Demand	Anodyne	UTS2R	0	44
C[C@@H]1CCCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450724391	CF	On-Demand	Anodyne	PREP	31	42
C[C@@H]1CCCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450724391	CF	On-Demand	Anodyne	GNAI1	0	40
C[C@H]1CCCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450724392	CF	On-Demand	Anodyne	PREP	31	42
C[C@H]1CCCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450724392	CF	On-Demand	Anodyne	GNAI1	0	40
COc1cc(O)cc(NC(=O)CCCC(=O)C(C)(C)C)c1	ZINC000450724394	CG	On-Demand	Anodyne	ACAT	0	42
Cc1ccn(-c2ccccc2C(=O)N2CCCC[C@H](C)C2)n1	ZINC000450724397	CG	On-Demand	Anodyne	AVPR2	25	44
Cc1ccn(-c2ccccc2C(=O)N2CCCC[C@@H](C)C2)n1	ZINC000450724398	CG	On-Demand	Anodyne	AVPR2	25	44
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)N2CCCC[C@@H](C)C2)cc1OC	ZINC000450724413	GF	On-Demand	Anodyne	FKBP1A	51	39
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)N2CCCC[C@H](C)C2)cc1OC	ZINC000450724414	GF	On-Demand	Anodyne	FKBP1A	51	39
C=CC(C)(C)CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450724416	DE	On-Demand	Mild	TGM2	60	48
C=CC(C)(C)CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450724416	DE	On-Demand	Mild	F13A1	56	41
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](CO)CC(C)C)nc2)c1	ZINC000450724427	FG	On-Demand	Anodyne	MTNR1A	19	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](CO)CC(C)C)nc2)c1	ZINC000450724427	FG	On-Demand	Anodyne	MTNR1B	23	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](CO)CC(C)C)nc2)c1	ZINC000450724428	FG	On-Demand	Anodyne	MTNR1A	19	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](CO)CC(C)C)nc2)c1	ZINC000450724428	FG	On-Demand	Anodyne	MTNR1B	23	40
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450724457	GG	On-Demand	Anodyne	MMP2	0	43
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450724458	GG	On-Demand	Anodyne	MMP2	0	43
CC(C)[C@H](NCCC[C@@H](C)O)C(=O)OC(C)(C)C	ZINC000450724462	CE	On-Demand	Anodyne	PGA5	43	38
CC(C)[C@H](NCCC[C@H](C)O)C(=O)OC(C)(C)C	ZINC000450724463	CE	On-Demand	Anodyne	PGA5	43	38
COC(=O)Cn1ncc(NC(=O)Cc2ccc(OC)c(OC)c2Cl)c1C	ZINC000450724480	GE	On-Demand	Anodyne	PDGFRB	36	43
COC(=O)Cn1ncc(NC(=O)Cc2ccc(OC)c(OC)c2Cl)c1C	ZINC000450724480	GE	On-Demand	Anodyne	CSF1R	18	43
COC(=O)[C@H]1CCN(C(=O)c2ccc(C)c(Cl)c2Cl)[C@@H](C(=O)OC)C1	ZINC000450724486	GF	On-Demand	Anodyne	PTR1	44	32
COC(=O)[C@H]1CCN(C(=O)c2ccc(C)c(Cl)c2Cl)[C@H](C(=O)OC)C1	ZINC000450724487	GF	On-Demand	Anodyne	PTR1	44	32
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc(C)c(Cl)c1Cl	ZINC000450724488	GF	On-Demand	Anodyne	PTR1	44	32
COC(=O)[C@@H]1CCN(C(=O)c2ccc(C)c(Cl)c2Cl)[C@@H](C(=O)OC)C1	ZINC000450724489	GF	On-Demand	Anodyne	PTR1	44	32
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C1CCCC1	ZINC000450724494	CG	On-Demand	Anodyne	ADRB1	18	43
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)C1CCCC1	ZINC000450724495	CG	On-Demand	Anodyne	ADRB1	18	43
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)C1CCCC1	ZINC000450724496	CG	On-Demand	Anodyne	ADRB1	18	43
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)C1CCCC1	ZINC000450724497	CG	On-Demand	Anodyne	ADRB1	18	43
CC(C)c1cccc(CNC(=O)c2ccnn2CC(F)(F)F)c1	ZINC000450724509	EG	On-Demand	Anodyne	CARM1	49	41
CC[C@@H]1C[C@H]1C(=O)NC1(Cc2ccccc2)CC1	ZINC000450724514	BF	On-Demand	Anodyne	SLC12A5	46	34
CCOC(=O)c1c(CN[C@H](C)[C@@H](C)CO)nc2ccccc2c1C	ZINC000450724515	EF	On-Demand	Anodyne	TSPO	19	42
CCOC(=O)c1c(CN[C@@H](C)[C@@H](C)CO)nc2ccccc2c1C	ZINC000450724516	EF	On-Demand	Anodyne	TSPO	19	42
CCOC(=O)c1c(CN[C@@H](C)[C@H](C)CO)nc2ccccc2c1C	ZINC000450724517	EF	On-Demand	Anodyne	TSPO	19	42
CCOC(=O)c1c(CN[C@H](C)[C@H](C)CO)nc2ccccc2c1C	ZINC000450724518	EF	On-Demand	Anodyne	TSPO	19	42
C=CCOc1ccc(CC(=O)Nc2onc(C(F)(F)F)c2CC)cc1	ZINC000450724524	FI	On-Demand	Mild	NR1H2	15	42
CSc1cccc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450724537	FJ	On-Demand	Anodyne	CPT1A	73	40
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450724539	FJ	On-Demand	Anodyne	CPT1A	73	40
COC(=O)C1(CN[C@@H](Cc2ccccc2)c2cccs2)CC1	ZINC000450724550	DH	On-Demand	Anodyne	TIMP3	55	33
COC(=O)C1(CN[C@H](Cc2ccccc2)c2cccs2)CC1	ZINC000450724552	DH	On-Demand	Anodyne	TIMP3	69	36
C=CCNC(=O)c1ccc(NCC(C)(C)C=C)nc1	ZINC000450724554	CF	On-Demand	Mild	HCAR3	17	58
CC[C@@H]1C[C@H]1CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450724555	FD	On-Demand	Bother	BDKRB1	0	47
CC[C@@H]1C[C@H]1CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450724555	FD	On-Demand	Bother	BCL2L1	47	35
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2CC(C)C)cs1	ZINC000450724557	CH	On-Demand	Anodyne	COLA	18	40
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2CC(C)C)cs1	ZINC000450724557	CH	On-Demand	Anodyne	CPT1A	17	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	BMP1	52	37
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	MMP13	78	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	MMP2	47	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	MMP3	73	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	MMP8	46	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	MMP9	58	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	MMP12	30	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	TGM2	67	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	MMP7	63	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	MMP1	70	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724565	GC	On-Demand	Anodyne	F13A1	77	41
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	BMP1	52	37
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	MMP13	78	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	MMP2	47	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	MMP3	73	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	MMP8	46	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	MMP9	58	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	MMP12	30	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	TGM2	67	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	MMP7	63	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	MMP1	70	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724566	GC	On-Demand	Anodyne	F13A1	77	41
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	BMP1	52	37
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	MMP13	78	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	MMP2	47	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	MMP3	73	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	MMP8	46	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	MMP9	58	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	MMP12	30	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	TGM2	67	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	MMP7	63	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	MMP1	70	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450724567	GC	On-Demand	Anodyne	F13A1	77	41
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	BMP1	52	37
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	MMP13	78	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	MMP2	47	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	MMP3	73	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	MMP8	46	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	MMP9	58	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	MMP12	30	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	TGM2	67	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	MMP7	63	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	MMP1	70	47
COc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450724568	GC	On-Demand	Anodyne	F13A1	77	41
CCCOc1c(OC)cc(CCNc2ccc(C#N)nc2)cc1OC	ZINC000450724576	EG	On-Demand	Mild	DFR1	15	40
O=C(C1CC1)C1(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)CC1	ZINC000450724584	FG	On-Demand	Anodyne	PRCP	41	33
O=C(C1CC1)C1(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)CC1	ZINC000450724585	FG	On-Demand	Anodyne	PRCP	41	33
CC(C)c1nc([C@@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450724598	FH	On-Demand	Anodyne	OPRK1	22	41
CC(C)c1nc([C@@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450724598	FH	On-Demand	Anodyne	COLA	92	44
CC(C)c1nc([C@@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450724598	FH	On-Demand	Anodyne	CPT1A	76	44
CC(C)c1nc([C@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450724599	FH	On-Demand	Anodyne	OPRK1	22	41
CC(C)c1nc([C@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450724599	FH	On-Demand	Anodyne	COLA	92	44
CC(C)c1nc([C@H]2CCCCCN2C(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450724599	FH	On-Demand	Anodyne	CPT1A	76	44
C[C@H](NCCc1ccc(Cl)cc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450724600	DI	On-Demand	Anodyne	CCR4	15	40
C[C@@H](NCCc1ccc(Cl)cc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450724601	DI	On-Demand	Anodyne	CCR4	15	40
C[C@H](NCCc1ccc(Cl)cc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450724602	DI	On-Demand	Anodyne	CCR4	15	40
C[C@@H](NCCc1ccc(Cl)cc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450724603	DI	On-Demand	Anodyne	CCR4	15	40
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2cnn(-c3ccncc3)c2)no1	ZINC000450724604	GH	On-Demand	Anodyne	COLA	45	39
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2cnn(-c3ccncc3)c2)no1	ZINC000450724604	GH	On-Demand	Anodyne	CPT1A	44	39
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2cnn(-c3ccncc3)c2)no1	ZINC000450724605	GH	On-Demand	Anodyne	COLA	45	39
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2cnn(-c3ccncc3)c2)no1	ZINC000450724605	GH	On-Demand	Anodyne	CPT1A	44	39
CC(=O)CCCCCN1C(=O)N[C@@](C)(Cc2ccc3c(c2)OCO3)C1=O	ZINC000450724616	FE	On-Demand	Anodyne	SCN9A	25	41
CC(=O)CCCCCN1C(=O)N[C@](C)(Cc2ccc3c(c2)OCO3)C1=O	ZINC000450724617	FE	On-Demand	Anodyne	SCN9A	25	41
Cc1cc(NC(=O)CCCC(=O)C2CC2)ccc1C1CC1	ZINC000450724623	CH	On-Demand	Anodyne	HDAC10	25	43
Cc1cc(NC(=O)CCCC(=O)C2CC2)ccc1C1CC1	ZINC000450724623	CH	On-Demand	Anodyne	HDAC2	15	43
Cc1cc(NC(=O)CCCC(=O)C2CC2)ccc1C1CC1	ZINC000450724623	CH	On-Demand	Anodyne	HDAC3	27	51
Cc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1C1CC1	ZINC000450724625	GI	On-Demand	Anodyne	CA5A	41	39
Cc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1C1CC1	ZINC000450724625	GI	On-Demand	Anodyne	CA9	15	40
Cc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1C1CC1	ZINC000450724625	GI	On-Demand	Anodyne	E1	0	40
Cc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1C1CC1	ZINC000450724625	GI	On-Demand	Anodyne	PFK	0	40
Cc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1C1CC1	ZINC000450724625	GI	On-Demand	Anodyne	RORC	68	40
CCS(=O)(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)cc1	ZINC000450724653	EG	On-Demand	Anodyne	CYNT	24	40
CCS(=O)(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)cc1	ZINC000450724654	EG	On-Demand	Anodyne	CYNT	24	40
COC1(CNC(=O)C2(Cc3ccccc3)CCOCC2)CCC1	ZINC000450724665	DF	On-Demand	Anodyne	SLC12A5	40	35
CCC[C@H](CC(C)C)C(=O)Nc1cc(O)cc(OC)c1	ZINC000450724674	CH	On-Demand	Anodyne	ACAT	0	44
CCC[C@@H](CC(C)C)C(=O)Nc1cc(O)cc(OC)c1	ZINC000450724675	CH	On-Demand	Anodyne	ACAT	0	44
COC1(CNC(=O)C2=C(c3ccccc3)CCC2)CCC1	ZINC000450724682	CG	On-Demand	Anodyne	CHRM5	28	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2nnc3ccccn23)c(OC)c1	ZINC000450724683	GE	On-Demand	Anodyne	MTNR1A	58	39
COc1ccc(CNC(=O)CCN[C@@H](C)c2nnc3ccccn23)c(OC)c1	ZINC000450724683	GE	On-Demand	Anodyne	MTNR1B	56	39
COc1ccc(CNC(=O)CCN[C@H](C)c2nnc3ccccn23)c(OC)c1	ZINC000450724684	GE	On-Demand	Anodyne	MTNR1A	58	39
COc1ccc(CNC(=O)CCN[C@H](C)c2nnc3ccccn23)c(OC)c1	ZINC000450724684	GE	On-Demand	Anodyne	MTNR1B	56	39
NC(=O)c1ccc(CCC(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000450724685	GE	On-Demand	Anodyne	S1PR2	19	41
Cc1cccnc1CCCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450724688	FE	On-Demand	Anodyne	NAMPT	32	43
CC[C@@H](C)[C@@H](NC[C@H](O)Cc1ccccc1)C(=O)OC	ZINC000450724693	CD	On-Demand	Anodyne	POL	0	50
CC[C@@H](C)[C@H](NC[C@H](O)Cc1ccccc1)C(=O)OC	ZINC000450724694	CD	On-Demand	Anodyne	POL	0	50
CN1CCC[C@H](C(=O)NCCCCc2ccc(F)c(F)c2)C1=O	ZINC000450724696	DE	On-Demand	Anodyne	ADRA1D	41	37
CN1CCC[C@@H](C(=O)NCCCCc2ccc(F)c(F)c2)C1=O	ZINC000450724697	DE	On-Demand	Anodyne	ADRA1D	41	37
Cc1nn(C)cc1CC(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450724705	DF	On-Demand	Anodyne	P2RX7	44	45
C=CC(C)(C)CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450724719	DF	On-Demand	Mild	TGM2	55	48
C=CC(C)(C)CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450724719	DF	On-Demand	Mild	F13A1	52	40
COC(=O)c1ccc(CNC(=O)c2ccc(N3CCC3)nc2)nc1C1CC1	ZINC000450724739	FE	On-Demand	Anodyne	HPGDS	15	41
Cc1nc2ccnn2cc1C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450724740	EG	On-Demand	Anodyne	ABCC1	43	33
COc1cccc(NC(=O)[C@H](N[C@H](C)[C@@H](C)CO)c2ccccc2)c1	ZINC000450724759	EF	On-Demand	Anodyne	GPR88	0	41
COc1cccc(NC(=O)[C@H](N[C@H](C)[C@H](C)CO)c2ccccc2)c1	ZINC000450724760	EF	On-Demand	Anodyne	GPR88	0	41
COc1cccc(NC(=O)[C@H](N[C@@H](C)[C@@H](C)CO)c2ccccc2)c1	ZINC000450724761	EF	On-Demand	Anodyne	GPR88	0	41
COc1cccc(NC(=O)[C@H](N[C@@H](C)[C@H](C)CO)c2ccccc2)c1	ZINC000450724762	EF	On-Demand	Anodyne	GPR88	0	41
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)[C@H](C(=O)OC)C1	ZINC000450724770	FD	On-Demand	Anodyne	OPRK1	15	52
COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)[C@@H](C(=O)OC)C1	ZINC000450724771	FD	On-Demand	Anodyne	OPRK1	15	52
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)[C@@H](C(=O)OC)C1	ZINC000450724772	FD	On-Demand	Anodyne	OPRK1	15	52
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450724773	FD	On-Demand	Anodyne	OPRK1	15	52
Cc1ccc(CNC(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO)cc1	ZINC000450724774	CD	On-Demand	Anodyne	ANPEP	15	46
Cc1ccc(CNC(=O)[C@H](C)N[C@H](C)[C@H](C)CO)cc1	ZINC000450724775	CD	On-Demand	Anodyne	ANPEP	15	46
Cc1ccc(CNC(=O)[C@H](C)N[C@H](C)[C@@H](C)CO)cc1	ZINC000450724776	CD	On-Demand	Anodyne	ANPEP	15	46
Cc1ccc(CNC(=O)[C@H](C)N[C@@H](C)[C@H](C)CO)cc1	ZINC000450724777	CD	On-Demand	Anodyne	ANPEP	15	46
COC(=O)[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C(=O)OC)C1	ZINC000450724792	GF	On-Demand	Anodyne	CACNA1B	40	33
COC(=O)[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C(=O)OC)C1	ZINC000450724792	GF	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C(=O)OC)C1	ZINC000450724792	GF	On-Demand	Anodyne	LIPG	49	37
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@H](C(=O)OC)C1	ZINC000450724793	GF	On-Demand	Anodyne	CACNA1B	40	33
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@H](C(=O)OC)C1	ZINC000450724793	GF	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@H](C(=O)OC)C1	ZINC000450724793	GF	On-Demand	Anodyne	LIPG	49	37
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450724794	GF	On-Demand	Anodyne	CACNA1B	40	33
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450724794	GF	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450724794	GF	On-Demand	Anodyne	LIPG	49	37
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C(=O)OC)C1	ZINC000450724795	GF	On-Demand	Anodyne	CACNA1B	40	33
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C(=O)OC)C1	ZINC000450724795	GF	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C(=O)OC)C1	ZINC000450724795	GF	On-Demand	Anodyne	LIPG	49	37
CC(C)c1cccc(CNC(=O)c2ccn(CCn3cccn3)n2)c1	ZINC000450724798	EF	On-Demand	Anodyne	MMP13	0	40
CC(=O)[C@@](C)(O)CN[C@H](C)c1cc2ccccc2s1	ZINC000450724803	CF	On-Demand	Anodyne	LTB4R	15	45
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cc2ccccc2s1	ZINC000450724804	CF	On-Demand	Anodyne	LTB4R	15	45
CC(=O)[C@](C)(O)CN[C@H](C)c1cc2ccccc2s1	ZINC000450724805	CF	On-Demand	Anodyne	LTB4R	15	45
CC(=O)[C@](C)(O)CN[C@@H](C)c1cc2ccccc2s1	ZINC000450724806	CF	On-Demand	Anodyne	LTB4R	15	45
CC(C)c1cccc(CNC(=O)c2cc3n(n2)CCC3)c1	ZINC000450724831	CF	On-Demand	Anodyne	MMP13	23	40
C/C=C\c1ccc(OC[C@H](O)CN[C@H](C)[C@H](C)CO)c(OC)c1	ZINC000450724832	DE	On-Demand	Anodyne	ADRB2	31	78
C/C=C/c1ccc(OC[C@H](O)CN[C@H](C)[C@@H](C)CO)c(OC)c1	ZINC000450724833	DE	On-Demand	Anodyne	ADRB2	31	78
C/C=C\c1ccc(OC[C@H](O)CN[C@H](C)[C@@H](C)CO)c(OC)c1	ZINC000450724834	DE	On-Demand	Anodyne	ADRB2	31	78
C/C=C/c1ccc(OC[C@H](O)CN[C@H](C)[C@H](C)CO)c(OC)c1	ZINC000450724835	DE	On-Demand	Anodyne	ADRB2	31	78
C[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCOC1	ZINC000450724840	DH	On-Demand	Anodyne	TIMP3	42	34
C[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@H]1CCCOC1	ZINC000450724841	DH	On-Demand	Anodyne	TIMP3	42	34
C[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCOC1	ZINC000450724842	DH	On-Demand	Anodyne	TIMP3	42	34
C[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@H]1CCCOC1	ZINC000450724843	DH	On-Demand	Anodyne	TIMP3	42	34
CCOc1ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc1OCC	ZINC000450724867	DE	On-Demand	Anodyne	ENPP1	53	32
CCOc1ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc1OCC	ZINC000450724875	DE	On-Demand	Anodyne	ENPP1	53	32
CCOc1ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc1OCC	ZINC000450724877	DE	On-Demand	Anodyne	ENPP1	53	32
COC(=O)c1ccc(OCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450724889	CF	On-Demand	Bother	THRA	0	46
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450724912	GH	On-Demand	Mild	RBP4	43	39
Cc1nc([C@H]2CCCN2C(=O)C[C@H]2CSc3ccccc3O2)cs1	ZINC000450724955	FI	On-Demand	Anodyne	COLA	91	44
Cc1nc([C@H]2CCCN2C(=O)C[C@H]2CSc3ccccc3O2)cs1	ZINC000450724955	FI	On-Demand	Anodyne	CPT1A	86	44
Cc1nc([C@H]2CCCN2C(=O)C[C@@H]2CSc3ccccc3O2)cs1	ZINC000450724956	FI	On-Demand	Anodyne	COLA	91	44
Cc1nc([C@H]2CCCN2C(=O)C[C@@H]2CSc3ccccc3O2)cs1	ZINC000450724956	FI	On-Demand	Anodyne	CPT1A	86	44
COC(=O)c1ccc([N+](=O)[O-])c(NCCCc2ncccc2C)c1	ZINC000450724980	EG	On-Demand	Bother	APLNR	0	40
Cc1ccc(C(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)c2c1CCC2	ZINC000450725014	FH	On-Demand	Anodyne	UTS2R	0	41
CN1CCC(C)(CNC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450725017	DD	On-Demand	Anodyne	HDAC1	26	40
C=CC(C)(C)CNc1cc(COC)nc2ncnn12	ZINC000450725025	CD	On-Demand	Mild	DHOD	0	42
CCOc1ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1OCC	ZINC000450725059	DE	On-Demand	Anodyne	ENPP1	53	32
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450725077	GE	On-Demand	Anodyne	PREP	18	40
COC(=O)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)[C@@H](C(=O)OC)C1	ZINC000450725078	GE	On-Demand	Anodyne	PREP	18	40
COC(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)[C@@H](C(=O)OC)C1	ZINC000450725079	GE	On-Demand	Anodyne	PREP	18	40
COC(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)[C@H](C(=O)OC)C1	ZINC000450725080	GE	On-Demand	Anodyne	PREP	18	40
Cc1ccc([C@H](OC[C@H](O)CN[C@@H](C)[C@H](C)CO)c2ccccc2)cc1	ZINC000450725082	FG	On-Demand	Anodyne	CASR	16	42
Cc1ccc([C@H](OC[C@H](O)CN[C@H](C)[C@H](C)CO)c2ccccc2)cc1	ZINC000450725083	FG	On-Demand	Anodyne	CASR	16	42
Cc1ccc([C@H](OC[C@H](O)CN[C@@H](C)[C@@H](C)CO)c2ccccc2)cc1	ZINC000450725084	FG	On-Demand	Anodyne	CASR	16	42
Cc1ccc([C@H](OC[C@H](O)CN[C@H](C)[C@@H](C)CO)c2ccccc2)cc1	ZINC000450725085	FG	On-Demand	Anodyne	CASR	16	42
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cc2ccncc2s1	ZINC000450725092	FD	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@H]1CCN(C(=O)c2cc3ccncc3s2)[C@@H](C(=O)OC)C1	ZINC000450725093	FD	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@H]1CCN(C(=O)c2cc3ccncc3s2)[C@H](C(=O)OC)C1	ZINC000450725094	FD	On-Demand	Anodyne	PREP	17	42
COC(=O)[C@@H]1CCN(C(=O)c2cc3ccncc3s2)[C@@H](C(=O)OC)C1	ZINC000450725095	FD	On-Demand	Anodyne	PREP	17	42
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1	ZINC000450725100	GG	On-Demand	Anodyne	PTPA	0	45
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1	ZINC000450725101	GG	On-Demand	Anodyne	PTPA	0	45
C[C@H](NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450725102	GG	On-Demand	Anodyne	PTPA	0	45
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1	ZINC000450725103	GG	On-Demand	Anodyne	PTPA	0	45
CC(=O)c1cccc(CSc2nnc(N3CCOCC3)n2-c2ccccc2)c1	ZINC000450725111	GH	On-Demand	Anodyne	CASR	28	41
NC(=O)c1cc([N+](=O)[O-])cnc1NCC1CCCCCC1	ZINC000450725125	CE	On-Demand	Bother	PRKCQ	53	41
C[C@H](CO)[C@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725140	DG	On-Demand	Anodyne	PRNP	65	43
C[C@H](CO)[C@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725140	DG	On-Demand	Anodyne	HDAC1	29	41
C[C@H](CO)[C@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725140	DG	On-Demand	Anodyne	HDAC2	27	48
C[C@H](CO)[C@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725140	DG	On-Demand	Anodyne	TAAR1	19	40
C[C@H](CO)[C@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725140	DG	On-Demand	Anodyne	NOD2	42	35
C[C@H](CO)[C@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725140	DG	On-Demand	Anodyne	NAMPT	20	42
C[C@H](CO)[C@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725140	DG	On-Demand	Anodyne	KCNK3	77	40
C[C@H](CO)[C@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725140	DG	On-Demand	Anodyne	KCNK9	48	39
C[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)CO	ZINC000450725141	DG	On-Demand	Anodyne	PRNP	65	43
C[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)CO	ZINC000450725141	DG	On-Demand	Anodyne	HDAC1	29	41
C[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)CO	ZINC000450725141	DG	On-Demand	Anodyne	HDAC2	27	48
C[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)CO	ZINC000450725141	DG	On-Demand	Anodyne	TAAR1	19	40
C[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)CO	ZINC000450725141	DG	On-Demand	Anodyne	NOD2	42	35
C[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)CO	ZINC000450725141	DG	On-Demand	Anodyne	NAMPT	20	42
C[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)CO	ZINC000450725141	DG	On-Demand	Anodyne	KCNK3	77	40
C[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)CO	ZINC000450725141	DG	On-Demand	Anodyne	KCNK9	48	39
C[C@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725142	DG	On-Demand	Anodyne	PRNP	65	43
C[C@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725142	DG	On-Demand	Anodyne	HDAC1	29	41
C[C@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725142	DG	On-Demand	Anodyne	HDAC2	27	48
C[C@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725142	DG	On-Demand	Anodyne	TAAR1	19	40
C[C@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725142	DG	On-Demand	Anodyne	NOD2	42	35
C[C@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725142	DG	On-Demand	Anodyne	NAMPT	20	42
C[C@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725142	DG	On-Demand	Anodyne	KCNK3	77	40
C[C@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725142	DG	On-Demand	Anodyne	KCNK9	48	39
C[C@@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725143	DG	On-Demand	Anodyne	PRNP	65	43
C[C@@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725143	DG	On-Demand	Anodyne	HDAC1	29	41
C[C@@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725143	DG	On-Demand	Anodyne	HDAC2	27	48
C[C@@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725143	DG	On-Demand	Anodyne	TAAR1	19	40
C[C@@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725143	DG	On-Demand	Anodyne	NOD2	42	35
C[C@@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725143	DG	On-Demand	Anodyne	NAMPT	20	42
C[C@@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725143	DG	On-Demand	Anodyne	KCNK3	77	40
C[C@@H](CO)[C@@H](C)NCc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000450725143	DG	On-Demand	Anodyne	KCNK9	48	39
CC(=O)N[C@H](C(=O)NCc1cccc(C(C)C)c1)C(C)(C)C	ZINC000450725150	DF	On-Demand	Anodyne	TNF	27	40
CC(=O)N[C@H](C(=O)NCc1cccc(C(C)C)c1)C(C)(C)C	ZINC000450725150	DF	On-Demand	Anodyne	PAPA1_CARPA	32	40
CC(=O)N[C@H](C(=O)NCc1cccc(C(C)C)c1)C(C)(C)C	ZINC000450725150	DF	On-Demand	Anodyne	ADAM17	26	40
CC(=O)N[C@H](C(=O)NCc1cccc(C(C)C)c1)C(C)(C)C	ZINC000450725150	DF	On-Demand	Anodyne	MMP3	23	40
CC(=O)N[C@H](C(=O)NCc1cccc(C(C)C)c1)C(C)(C)C	ZINC000450725150	DF	On-Demand	Anodyne	CARM1	40	33
CC(=O)N[C@H](C(=O)NCc1cccc(C(C)C)c1)C(C)(C)C	ZINC000450725150	DF	On-Demand	Anodyne	Q82323_9DELA	64	31
CC(=O)N[C@H](C(=O)NCc1cccc(C(C)C)c1)C(C)(C)C	ZINC000450725150	DF	On-Demand	Anodyne	DERP1	0	40
O=C1CC[C@@H](CCC(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)N1	ZINC000450725159	GG	On-Demand	Anodyne	RBP4	46	32
O=C1CC[C@H](CCC(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)N1	ZINC000450725160	GG	On-Demand	Anodyne	RBP4	46	32
Cc1ccc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c(Br)c1	ZINC000450725161	GI	On-Demand	Anodyne	COLA	52	41
Cc1ccc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c(Br)c1	ZINC000450725161	GI	On-Demand	Anodyne	CPT1A	50	41
CO[C@@](C)(CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)c1ccccc1	ZINC000450725176	FE	On-Demand	Bother	F2RL3	46	34
CO[C@](C)(CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)c1ccccc1	ZINC000450725177	FE	On-Demand	Bother	F2RL3	46	34
Cc1ccc(F)c(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450725192	DH	On-Demand	Anodyne	COLA	52	43
Cc1ccc(F)c(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450725192	DH	On-Demand	Anodyne	CPT1A	50	43
Cc1ccc(F)c(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450725192	DH	On-Demand	Anodyne	TRPC6	48	35
Cc1ccc(F)c(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c1	ZINC000450725192	DH	On-Demand	Anodyne	TRPC3	43	35
CCCc1cc(NCc2nn(C)cc2Br)n2ncnc2n1	ZINC000450725195	FE	On-Demand	Anodyne	DHOD	0	41
CC[C@@H]1C[C@H]1CNc1cc(Br)cnc1C(N)=O	ZINC000450725226	CE	On-Demand	Anodyne	SYK	45	33
O=C(CC1(O)CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450725256	FH	On-Demand	Anodyne	RBP4	46	37
O=C(CC1(O)CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450725256	FH	On-Demand	Anodyne	SCD	26	40
C=CC(C)(C)CNc1cc(CC)nc2ncnn12	ZINC000450725263	BE	On-Demand	Mild	DHOD	0	56
COCc1cc(NC[C@](C)(OC)c2ccccc2)n2ncnc2n1	ZINC000450725279	EE	On-Demand	Anodyne	DHOD	0	44
COCc1cc(NC[C@@](C)(OC)c2ccccc2)n2ncnc2n1	ZINC000450725280	EE	On-Demand	Anodyne	DHOD	0	44
C[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450725287	CI	On-Demand	Anodyne	SLC6A1	0	44
C[C@H]1CCCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450725287	CI	On-Demand	Anodyne	PREP	34	42
COc1cc(O)cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1	ZINC000450725288	EF	On-Demand	Anodyne	FOLH1	43	35
COc1cc(O)cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c1	ZINC000450725288	EF	On-Demand	Anodyne	ADAM17	0	40
CN1CCC(C)(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)CC1	ZINC000450725297	EI	On-Demand	Anodyne	SLC6A9	56	36
CN1CCC(C)(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)CC1	ZINC000450725297	EI	On-Demand	Anodyne	CACNA1I	52	34
C[C@H](O)CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450725307	ED	On-Demand	Anodyne	SCN9A	24	45
C[C@@H](O)CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450725308	ED	On-Demand	Anodyne	SCN9A	24	45
C[C@H](O)CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450725309	ED	On-Demand	Anodyne	SCN9A	24	45
C[C@@H](O)CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450725310	ED	On-Demand	Anodyne	SCN9A	24	45
COc1cc(O)cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)c1	ZINC000450725313	EG	On-Demand	Anodyne	GCK	26	41
COc1cc(O)cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)c1	ZINC000450725313	EG	On-Demand	Anodyne	LUCI_LUCLA	39	42
COc1cc(O)cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)c1	ZINC000450725313	EG	On-Demand	Anodyne	TAAR1	25	40
COc1ccc(CNC(=O)CCN[C@H](C)c2cccs2)c(OC)c1	ZINC000450725320	EG	On-Demand	Anodyne	MTNR1A	47	35
COc1ccc(CNC(=O)CCN[C@@H](C)c2cccs2)c(OC)c1	ZINC000450725321	EG	On-Demand	Anodyne	MTNR1A	47	35
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450725343	GG	On-Demand	Anodyne	GHRHR	43	32
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450725343	GG	On-Demand	Anodyne	SLC12A5	47	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450725344	GG	On-Demand	Anodyne	GHRHR	43	32
C[C@H](OCCc1ccccc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450725344	GG	On-Demand	Anodyne	SLC12A5	47	40
Cc1cccnc1CCCN=c1ccc(C(=O)N2CCc3ccccc32)c[nH]1	ZINC000450725349	FG	On-Demand	Anodyne	AVPR2	44	39
Cc1cccnc1CCCNc1cc(N2CCCCC2)ncn1	ZINC000450725353	DG	On-Demand	Anodyne	HNMT	49	33
CCc1c(C(F)(F)F)noc1NC(=O)c1ncccc1Cl	ZINC000450725362	DH	On-Demand	Anodyne	ATF1	45	32
CCc1c(C(F)(F)F)noc1NC(=O)c1ncccc1Cl	ZINC000450725362	DH	On-Demand	Anodyne	NFKB1	41	32
CC(C)C[C@@H](CO)N(C)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450725366	EE	On-Demand	Anodyne	PDE4D	15	45
CC(C)C[C@H](CO)N(C)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450725367	EE	On-Demand	Anodyne	PDE4D	15	45
CC(C)C[C@@H](CO)N(C)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450725368	EE	On-Demand	Anodyne	PDE4D	15	45
CC(C)C[C@H](CO)N(C)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450725369	EE	On-Demand	Anodyne	PDE4D	15	45
CCCOc1c(OC)cc(CCNc2ncnc3c2ncn3C2CC2)cc1OC	ZINC000450725370	GH	On-Demand	Anodyne	ADORA1	38	56
CCCOc1c(OC)cc(CCNc2ncnc3c2ncn3C2CC2)cc1OC	ZINC000450725370	GH	On-Demand	Anodyne	ADORA3	49	39
Cn1ncc2c(=O)n(CCCCc3ccc(Cl)c(Cl)c3)cnc21	ZINC000450725371	FG	On-Demand	Anodyne	DNAE	76	36
Cn1ncc2c(=O)n(CCCCc3ccc(Cl)c(Cl)c3)cnc21	ZINC000450725371	FG	On-Demand	Anodyne	Q9M629_MAIZE	65	38
CC(C)c1cccc(CNC(=O)[C@@]2(C#N)C[C@@H]2C)c1	ZINC000450725372	CF	On-Demand	Mild	PDS	23	40
CC(C)c1cccc(CNC(=O)[C@]2(C#N)C[C@@H]2C)c1	ZINC000450725373	CF	On-Demand	Mild	PDS	23	40
CC(C)c1cccc(CNC(=O)[C@@]2(C#N)C[C@H]2C)c1	ZINC000450725374	CF	On-Demand	Mild	PDS	23	40
CC(C)c1cccc(CNC(=O)[C@]2(C#N)C[C@H]2C)c1	ZINC000450725375	CF	On-Demand	Mild	PDS	23	40
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450725378	FG	On-Demand	Anodyne	GPR88	0	41
CCCOc1c(OC)cc(CCNc2ccc(S(N)(=O)=O)cn2)cc1OC	ZINC000450725389	GD	On-Demand	Anodyne	CA2	26	43
CCCOc1c(OC)cc(CCNc2ccc(S(N)(=O)=O)cn2)cc1OC	ZINC000450725389	GD	On-Demand	Anodyne	CA1	26	43
CCCOc1c(OC)cc(CCNc2ccc(S(N)(=O)=O)cn2)cc1OC	ZINC000450725389	GD	On-Demand	Anodyne	CA7	29	41
CCCOc1c(OC)cc(CCNc2ccc(S(N)(=O)=O)cn2)cc1OC	ZINC000450725389	GD	On-Demand	Anodyne	CA14	22	44
CCCOc1c(OC)cc(CCNc2ccc(S(N)(=O)=O)cn2)cc1OC	ZINC000450725389	GD	On-Demand	Anodyne	CA12	17	40
CC(C)OC(C)(C)C(=O)NCc1cccc(C(C)C)c1	ZINC000450725400	CH	On-Demand	Anodyne	PDS	40	33
CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450725409	DE	On-Demand	Anodyne	TRPM8	17	46
CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450725410	DE	On-Demand	Anodyne	TRPM8	17	46
CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450725411	DE	On-Demand	Anodyne	TRPM8	17	46
CC[C@@H]1c2ccsc2CCN1C(=O)CN[C@H](C)[C@H](C)CO	ZINC000450725412	DE	On-Demand	Anodyne	TRPM8	17	46
CC(C)(CNc1ccc(S(N)(=O)=O)cn1)C1CCC1	ZINC000450725422	CD	On-Demand	Anodyne	CYNT	43	33
C=CC(C)(C)CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450725425	EE	On-Demand	Mild	BDKRB1	24	44
COC(=O)CCn1c(SCC2(C#N)CCC2)nc2ccccc2c1=O	ZINC000450725426	FF	On-Demand	Mild	TNKS	40	32
N#Cc1cc(Br)ccc1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450725457	GH	On-Demand	Mild	MAP3K7	49	37
N#Cc1cc(Br)ccc1C(=O)N1CCC(n2cc(Cl)cn2)CC1	ZINC000450725457	GH	On-Demand	Mild	L3MBTL3	58	39
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCC1CCCCCC1	ZINC000450725462	EF	On-Demand	Bother	TBXA2R	28	42
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NCCCCc1ccc(F)c(F)c1	ZINC000450725486	GH	On-Demand	Bother	CACNA1D	21	41
C[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725490	FG	On-Demand	Mild	HTR1B	15	41
C[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725490	FG	On-Demand	Mild	COLA	89	42
C[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725490	FG	On-Demand	Mild	CPT1A	78	42
C[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725490	FG	On-Demand	Mild	CPT2	43	38
C[C@@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725490	FG	On-Demand	Mild	RORC	45	41
C[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725491	FG	On-Demand	Mild	HTR1B	15	41
C[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725491	FG	On-Demand	Mild	COLA	89	42
C[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725491	FG	On-Demand	Mild	CPT1A	78	42
C[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725491	FG	On-Demand	Mild	CPT2	43	38
C[C@H]1CCCCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450725491	FG	On-Demand	Mild	RORC	45	41
NC(=O)c1ccc(CCC(=O)NCCCCc2ccc(F)c(F)c2)cc1	ZINC000450725508	FG	On-Demand	Anodyne	SCNN1A	47	34
NC(=O)c1ccc(CCC(=O)NCCCCc2ccc(F)c(F)c2)cc1	ZINC000450725508	FG	On-Demand	Anodyne	SCN5A	0	42
Cc1cccnc1CCCNc1ccnc(N2CCCCC2)n1	ZINC000450725527	DF	On-Demand	Anodyne	HNMT	54	33
C=CC(C)(C)CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450725582	DG	On-Demand	Mild	TAAR1	19	48
CC(C)c1nc([C@H]2CCCCCN2C(=O)Cc2cc3ccccc3c(O)n2)no1	ZINC000450725590	GI	On-Demand	Anodyne	COLA	111	44
CC(C)c1nc([C@H]2CCCCCN2C(=O)Cc2cc3ccccc3c(O)n2)no1	ZINC000450725590	GI	On-Demand	Anodyne	CPT1A	108	44
CC(C)c1nc([C@@H]2CCCCCN2C(=O)Cc2cc3ccccc3c(O)n2)no1	ZINC000450725596	GI	On-Demand	Anodyne	COLA	111	44
CC(C)c1nc([C@@H]2CCCCCN2C(=O)Cc2cc3ccccc3c(O)n2)no1	ZINC000450725596	GI	On-Demand	Anodyne	CPT1A	108	44
CC[C@H](C)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(=O)OC	ZINC000450725597	CE	On-Demand	Anodyne	PAPA1_CARPA	46	34
CC[C@H](C)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(=O)OC	ZINC000450725597	CE	On-Demand	Anodyne	POL	0	42
CC[C@H](C)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(=O)OC	ZINC000450725598	CE	On-Demand	Anodyne	PAPA1_CARPA	46	34
CC[C@H](C)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(=O)OC	ZINC000450725598	CE	On-Demand	Anodyne	POL	0	42
CC[C@H](C)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(=O)OC	ZINC000450725600	CE	On-Demand	Anodyne	PAPA1_CARPA	46	34
CC[C@H](C)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(=O)OC	ZINC000450725600	CE	On-Demand	Anodyne	POL	0	42
CC[C@H](C)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)C(=O)OC	ZINC000450725602	CE	On-Demand	Anodyne	PAPA1_CARPA	46	34
CC[C@H](C)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)C(=O)OC	ZINC000450725602	CE	On-Demand	Anodyne	POL	0	42
Cc1cccnc1CCCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450725611	FI	On-Demand	Anodyne	ADRA1D	15	45
Cc1cccnc1CCCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450725611	FI	On-Demand	Anodyne	AVPR2	76	43
Cc1cccnc1CCCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450725611	FI	On-Demand	Anodyne	AVPR1A	27	42
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2cccc(C(F)(F)F)n2)cc1	ZINC000450725624	GG	On-Demand	Anodyne	TRPV1	55	35
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2cccc(C(F)(F)F)n2)cc1	ZINC000450725628	GG	On-Demand	Anodyne	TRPV1	55	35
CO[C@@](C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1	ZINC000450725629	FF	On-Demand	Bother	F2RL3	47	34
CO[C@](C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1	ZINC000450725630	FF	On-Demand	Bother	F2RL3	47	34
O=C(c1ccc(N2CCC2)nc1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450725660	FE	On-Demand	Anodyne	HRH3	17	42
O=C(c1ccc(N2CCC2)nc1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450725660	FE	On-Demand	Anodyne	HPGDS	19	46
O=C(c1ccc(N2CCC2)nc1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450725660	FE	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(N2CCC2)nc1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450725660	FE	On-Demand	Anodyne	L3MBTL3	46	37
COC1(CNC(=O)c2ccc(C)c(C(=O)NCC3(OC)CCC3)c2)CCC1	ZINC000450725662	FF	On-Demand	Anodyne	HCN1	49	32
COC1(CNC(=O)c2ccc(C)c(C(=O)NCC3(OC)CCC3)c2)CCC1	ZINC000450725662	FF	On-Demand	Anodyne	HCN4	47	32
COc1cc(O)cc(NC(=O)CCCC(C)C)c1	ZINC000450725664	CG	On-Demand	Anodyne	ACAT	0	43
C=CC(C)(C)CNc1ccc([N+](=O)[O-])cc1COC	ZINC000450725691	CG	On-Demand	Mild	CACNA1D	50	35
CCOC(=O)c1ccc(C(=O)Nc2onc(C(F)(F)F)c2CC)nc1	ZINC000450725701	FG	On-Demand	Anodyne	ATF1	56	43
CCOC(=O)c1ccc(C(=O)Nc2onc(C(F)(F)F)c2CC)nc1	ZINC000450725701	FG	On-Demand	Anodyne	NFKB1	52	43
CC(C)c1cccc(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450725708	FH	On-Demand	Anodyne	EPHX2	16	41
CC(C)c1cccc(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450725708	FH	On-Demand	Anodyne	PDE8B	58	34
CC(C)c1cccc(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450725708	FH	On-Demand	Anodyne	TMPRSS11D	42	31
CC(C)c1cccc(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450725710	FH	On-Demand	Anodyne	EPHX2	16	41
CC(C)c1cccc(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450725710	FH	On-Demand	Anodyne	PDE8B	58	34
CC(C)c1cccc(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450725710	FH	On-Demand	Anodyne	TMPRSS11D	42	31
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H](C)C2)cc1	ZINC000450725746	CF	On-Demand	Anodyne	BIRC2	17	41
COC(=O)c1ccc(CC(=O)N2CCCC[C@H](C)C2)cc1	ZINC000450725748	CF	On-Demand	Anodyne	BIRC2	17	41
CCCOc1c(OC)cc(CCNc2ncccc2C(=O)NC)cc1OC	ZINC000450725751	FF	On-Demand	Anodyne	CNR2	30	41
CCc1cc(CCCN[C@@H](C)c2nc(-c3ccccc3)cs2)on1	ZINC000450725754	EJ	On-Demand	Anodyne	SREBF2	0	40
COc1cccc(OCCC(=O)N2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450725756	FG	On-Demand	Anodyne	DRD4	42	33
COc1cccc(OCCC(=O)N2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000450725756	FG	On-Demand	Anodyne	MAP3K7	50	34
CCc1cc(CCCN[C@H](C)c2nc(-c3ccccc3)cs2)on1	ZINC000450725757	EJ	On-Demand	Anodyne	SREBF2	0	40
Cc1cccnc1CCCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450725763	GF	On-Demand	Bother	BDKRB1	23	43
Cc1sccc1C(=O)N1CCCC[C@H](C)C1	ZINC000450725769	BG	On-Demand	Anodyne	L3MBTL3	49	38
Cc1sccc1C(=O)N1CCCC[C@H](C)C1	ZINC000450725769	BG	On-Demand	Anodyne	TRPC6	47	35
Cc1sccc1C(=O)N1CCCC[C@@H](C)C1	ZINC000450725770	BG	On-Demand	Anodyne	L3MBTL3	49	38
Cc1sccc1C(=O)N1CCCC[C@@H](C)C1	ZINC000450725770	BG	On-Demand	Anodyne	TRPC6	47	35
COc1cc(-c2noc(CSc3nnc(C4CC4)n3C3CC3)n2)ncn1	ZINC000450725780	FF	On-Demand	Anodyne	TNKS2	15	41
CC(C)c1cccc(CNC(=O)CCc2ccc(C(N)=O)cc2)c1	ZINC000450725806	DG	On-Demand	Anodyne	FURIN	41	32
CO[C@H]1COCC[C@@H]1CC(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450725831	GI	On-Demand	Anodyne	CCR2	42	40
CC(C)c1cccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)c1	ZINC000450725832	FG	On-Demand	Anodyne	NAMPT	45	34
C[C@H](NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1)[C@@H](C)CO	ZINC000450725833	GC	On-Demand	Anodyne	PKM	37	45
C[C@H](NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1)[C@@H](C)CO	ZINC000450725833	GC	On-Demand	Anodyne	F13A1	49	37
C[C@H](NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1)[C@@H](C)CO	ZINC000450725833	GC	On-Demand	Anodyne	AKR1C3	41	37
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725834	GC	On-Demand	Anodyne	PKM	37	45
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725834	GC	On-Demand	Anodyne	F13A1	49	37
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725834	GC	On-Demand	Anodyne	AKR1C3	41	37
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725835	GC	On-Demand	Anodyne	PKM	37	45
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725835	GC	On-Demand	Anodyne	F13A1	49	37
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725835	GC	On-Demand	Anodyne	AKR1C3	41	37
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725836	GC	On-Demand	Anodyne	PKM	37	45
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725836	GC	On-Demand	Anodyne	F13A1	49	37
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000450725836	GC	On-Demand	Anodyne	AKR1C3	41	37
COc1ccc(CNC(=O)CCN[C@H](C)c2ncc(C)o2)c(OC)c1	ZINC000450725840	EE	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ncc(C)o2)c(OC)c1	ZINC000450725841	EE	On-Demand	Anodyne	MTNR1A	51	38
CCN(Cc1ccccc1)C(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450725850	CD	On-Demand	Anodyne	PTGES	23	41
CCN(Cc1ccccc1)C(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450725851	CD	On-Demand	Anodyne	PTGES	23	41
CCN(Cc1ccccc1)C(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450725852	CD	On-Demand	Anodyne	PTGES	23	41
CCN(Cc1ccccc1)C(=O)CN[C@H](C)[C@H](C)CO	ZINC000450725853	CD	On-Demand	Anodyne	PTGES	23	41
CO[C@@](C)(CNc1ncnc2c1cnn2C)c1ccccc1	ZINC000450725860	CE	On-Demand	Anodyne	ABL1	36	41
CO[C@@](C)(CNc1ncnc2c1cnn2C)c1ccccc1	ZINC000450725860	CE	On-Demand	Anodyne	SRC	0	42
CO[C@](C)(CNc1ncnc2c1cnn2C)c1ccccc1	ZINC000450725861	CE	On-Demand	Anodyne	ABL1	36	41
CO[C@](C)(CNc1ncnc2c1cnn2C)c1ccccc1	ZINC000450725861	CE	On-Demand	Anodyne	SRC	0	42
Cc1ccn(CC(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)n1	ZINC000450725898	EF	On-Demand	Anodyne	PRCP	45	33
Cc1ccn(CC(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)n1	ZINC000450725899	EF	On-Demand	Anodyne	PRCP	45	33
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccnn2CC(F)(F)F)no1	ZINC000450725901	GH	On-Demand	Anodyne	COLA	41	39
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccnn2CC(F)(F)F)no1	ZINC000450725901	GH	On-Demand	Anodyne	CPT1A	40	39
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccnn2CC(F)(F)F)no1	ZINC000450725902	GH	On-Demand	Anodyne	COLA	41	39
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccnn2CC(F)(F)F)no1	ZINC000450725902	GH	On-Demand	Anodyne	CPT1A	40	39
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1nc(C)cs1	ZINC000450725903	GG	On-Demand	Anodyne	MTNR1A	41	36
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)c1nc(C)cs1	ZINC000450725904	GG	On-Demand	Anodyne	MTNR1A	41	36
CNC(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450725909	EF	On-Demand	Bother	TAAR1	19	47
CNC(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450725910	EF	On-Demand	Bother	TAAR1	19	47
CO[C@@H]1COCC[C@@H]1CC(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450725959	GI	On-Demand	Anodyne	CCR2	42	40
CO[C@@H]1COCC[C@H]1CC(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450725960	GI	On-Demand	Anodyne	CCR2	42	40
CO[C@H]1COCC[C@H]1CC(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000450725961	GI	On-Demand	Anodyne	CCR2	42	40
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450725981	CD	On-Demand	Mild	CA2	32	44
C[C@H]1CCCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450725998	DI	On-Demand	Anodyne	L3MBTL3	64	37
C[C@H]1CCCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450725998	DI	On-Demand	Anodyne	HPGD	39	41
C[C@@H]1CCCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450725999	DI	On-Demand	Anodyne	L3MBTL3	54	36
C[C@@H]1CCCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450725999	DI	On-Demand	Anodyne	HPGD	39	41
CC(=O)NC[C@H](CC(=O)N1CCCC[C@H](C)C1)CC(C)C	ZINC000450726006	CF	On-Demand	Anodyne	RIR1_HHV11	61	38
CC(=O)NC[C@H](CC(=O)N1CCCC[C@@H](C)C1)CC(C)C	ZINC000450726007	CF	On-Demand	Anodyne	RIR1_HHV11	61	38
C[C@@H]1CCCCN(C(=O)CCCC(=O)C(C)(C)C)C1	ZINC000450726015	CG	On-Demand	Anodyne	PREP	27	40
C[C@H]1CCCCN(C(=O)CCCC(=O)C(C)(C)C)C1	ZINC000450726016	CG	On-Demand	Anodyne	PREP	27	40
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450726023	GG	On-Demand	Anodyne	HAO2	41	32
CC[C@@H](C)[C@@H](NCc1ccn(CCc2ccccc2)n1)C(=O)OC	ZINC000450726024	EF	On-Demand	Anodyne	PAPA1_CARPA	46	33
CC[C@H](C)[C@@H](NCc1ccn(CCc2ccccc2)n1)C(=O)OC	ZINC000450726025	EF	On-Demand	Anodyne	PAPA1_CARPA	46	33
CC[C@@H](C)[C@H](NCc1ccn(CCc2ccccc2)n1)C(=O)OC	ZINC000450726026	EF	On-Demand	Anodyne	PAPA1_CARPA	46	33
CC[C@H](C)[C@H](NCc1ccn(CCc2ccccc2)n1)C(=O)OC	ZINC000450726027	EF	On-Demand	Anodyne	PAPA1_CARPA	46	33
COC(=O)c1ccc(CNC(=O)CCOc2cccc(OC)c2)nc1C1CC1	ZINC000450726037	GF	On-Demand	Anodyne	MTNR1A	47	42
COC(=O)c1ccc(CNC(=O)CCOc2cccc(OC)c2)nc1C1CC1	ZINC000450726037	GF	On-Demand	Anodyne	MTNR1B	40	42
CC[C@@H]1C[C@H]1CNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450726038	DG	On-Demand	Anodyne	PTR1	45	33
CC[C@@H]1C[C@H]1CNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450726038	DG	On-Demand	Anodyne	L3MBTL3	57	33
C[C@@H]1CCCCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450726046	EG	On-Demand	Bother	L3MBTL1	0	41
C[C@H]1CCCCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450726047	EG	On-Demand	Bother	L3MBTL1	0	41
CCc1cc(NCc2nn(C)cc2Br)n2ncnc2n1	ZINC000450726068	ED	On-Demand	Anodyne	DHOD	0	49
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cs1	ZINC000450726069	EI	On-Demand	Anodyne	CPT1A	42	42
Cn1cc([C@@H](NC(=O)CCCC(=O)C2CC2)c2ccc(F)cc2)cn1	ZINC000450726083	EF	On-Demand	Anodyne	PRCP	17	44
Cn1cc([C@H](NC(=O)CCCC(=O)C2CC2)c2ccc(F)cc2)cn1	ZINC000450726084	EF	On-Demand	Anodyne	PRCP	17	44
COC(=O)c1ccc(OC[C@H](Cc2ccccc2)OC)c([N+](=O)[O-])c1	ZINC000450726102	EG	On-Demand	Bother	PDS	48	36
COC(=O)c1ccc(OC[C@@H](Cc2ccccc2)OC)c([N+](=O)[O-])c1	ZINC000450726104	EG	On-Demand	Bother	PDS	48	36
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450726130	GD	On-Demand	Anodyne	PREP	17	41
COC(=O)[C@@H]1CCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@@H](C(=O)OC)C1	ZINC000450726132	GD	On-Demand	Anodyne	PREP	17	41
COC(=O)[C@H]1CCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@@H](C(=O)OC)C1	ZINC000450726134	GD	On-Demand	Anodyne	PREP	17	41
COC(=O)[C@H]1CCN(C(=O)c2cc(-c3ccccc3)nn2C)[C@H](C(=O)OC)C1	ZINC000450726136	GD	On-Demand	Anodyne	PREP	17	41
CC(C)c1cccc(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)c1	ZINC000450726137	CH	On-Demand	Anodyne	CTSD	16	42
Cc1nn(C)cc1CC(=O)NCc1cccc(C(C)C)c1	ZINC000450726154	CF	On-Demand	Anodyne	P2RX7	44	42
Cc1nn(C)cc1CC(=O)NCc1cccc(C(C)C)c1	ZINC000450726154	CF	On-Demand	Anodyne	CARM1	40	38
Cc1nn(C)cc1CC(=O)NCc1cccc(C(C)C)c1	ZINC000450726154	CF	On-Demand	Anodyne	PDS	23	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	CA2	78	50
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	CA1	63	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	CA7	38	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	CA5B	47	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	CA4	78	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	CA5A	54	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	PRTN3	45	33
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	CA12	34	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450726164	GE	On-Demand	Anodyne	CA9	41	44
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	CA2	78	50
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	CA1	63	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	CA7	38	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	CA5B	47	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	CA4	78	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	CA5A	54	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	PRTN3	45	33
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	CA12	34	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450726165	GE	On-Demand	Anodyne	CA9	41	44
Cc1cc(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)nn1C(C)C	ZINC000450726177	FH	On-Demand	Anodyne	PRCP	44	32
Cc1cc(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)nn1C(C)C	ZINC000450726180	FH	On-Demand	Anodyne	PRCP	44	32
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2cccc(C(F)(F)F)n2)no1	ZINC000450726189	GI	On-Demand	Anodyne	COLA	56	44
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2cccc(C(F)(F)F)n2)no1	ZINC000450726189	GI	On-Demand	Anodyne	CPT1A	56	44
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2cccc(C(F)(F)F)n2)no1	ZINC000450726191	GI	On-Demand	Anodyne	COLA	56	44
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2cccc(C(F)(F)F)n2)no1	ZINC000450726191	GI	On-Demand	Anodyne	CPT1A	56	44
Cc1cc(NC(=O)c2cc3n(n2)CCCC3)ccc1C1CC1	ZINC000450726219	CH	On-Demand	Anodyne	TYK2	42	33
Cc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)ccc1C1CC1	ZINC000450726223	DI	On-Demand	Anodyne	MMP13	0	47
Cc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)ccc1C1CC1	ZINC000450726223	DI	On-Demand	Anodyne	S1PR4	31	41
Cc1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)ccc1C1CC1	ZINC000450726223	DI	On-Demand	Anodyne	SCN10A	22	44
COC(=O)Cn1ncc(NC(=O)c2cccc3c2O[C@@H](C)C3)c1C	ZINC000450726224	ED	On-Demand	Anodyne	G2YM83_BOTF4	45	34
COC(=O)Cn1ncc(NC(=O)c2cccc3c2O[C@H](C)C3)c1C	ZINC000450726226	ED	On-Demand	Anodyne	G2YM83_BOTF4	45	34
Cc1ccccc1CNC(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO	ZINC000450726239	CD	On-Demand	Anodyne	AMP1_PLAFQ	25	48
Cc1ccccc1CNC(=O)[C@H](C)N[C@H](C)[C@H](C)CO	ZINC000450726241	CD	On-Demand	Anodyne	AMP1_PLAFQ	25	48
Cc1ccccc1CNC(=O)[C@H](C)N[C@H](C)[C@@H](C)CO	ZINC000450726243	CD	On-Demand	Anodyne	AMP1_PLAFQ	25	48
Cc1ccccc1CNC(=O)[C@H](C)N[C@@H](C)[C@H](C)CO	ZINC000450726245	CD	On-Demand	Anodyne	AMP1_PLAFQ	25	48
COC(=O)CCn1c(SCc2cn(C)nc2C)nc2ccccc2c1=O	ZINC000450726246	FE	On-Demand	Anodyne	PTGDR2	17	41
CCCCCN(CC(N)=O)C(=O)c1c[nH]c2nccc-2c1	ZINC000450726252	CD	On-Demand	Anodyne	TSPO	18	40
CCCCCN(CC(N)=O)C(=O)c1c[nH]c2nccc-2c1	ZINC000450726252	CD	On-Demand	Anodyne	PLM2_PLAFA	43	35
C=CC(C)(C)CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450726253	DH	On-Demand	Mild	AVPR2	97	42
C=CC(C)(C)CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450726253	DH	On-Demand	Mild	AVPR1A	57	42
COc1cc(CC(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450726295	GH	On-Demand	Anodyne	CCR1	32	44
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	ADORA1	132	74
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	SLC29A1	112	56
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	P2RY12	54	42
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	ADORA2A	65	65
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	ADORA2B	31	59
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	GAPC	0	45
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	ADK	77	56
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	P2RX5	0	40
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	AK3	0	41
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	AHCY	53	42
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	P2RX4	35	41
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	P2RX1	46	40
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	P2RX6	0	40
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	P2RY1	33	41
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	P2RY11	0	41
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	AMD1	35	40
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	IARS	0	40
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	ITPR1	53	38
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	P2RY2	18	41
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	AK2	0	41
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	NS5B	0	46
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	ADORA3	128	64
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	OXGR1	118	42
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	MTAP	0	46
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	IMPDH2	48	34
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	AK	0	49
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	SETD7	0	40
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	PRMT1	0	40
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	RNASE1	45	35
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	MBTA	0	49
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	DNMT3B	75	44
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	NADK	0	42
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	PANC	37	40
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	Q4VQ11_PIG	88	64
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	GPR17	58	45
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	SAE1	0	43
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	DOT1L	83	45
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	METJ	0	41
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	NAE1	0	43
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	UBA6	0	43
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	UBA7	0	43
CC[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450726356	EB	On-Demand	Anodyne	SETD2	0	40
COc1ccc2oc([C@H](C)NC[C@@](C)(O)C(C)=O)c(C)c2c1	ZINC000450726359	DF	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc2oc([C@@H](C)NC[C@](C)(O)C(C)=O)c(C)c2c1	ZINC000450726360	DF	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc2oc([C@H](C)NC[C@](C)(O)C(C)=O)c(C)c2c1	ZINC000450726361	DF	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc2oc([C@@H](C)NC[C@@](C)(O)C(C)=O)c(C)c2c1	ZINC000450726362	DF	On-Demand	Anodyne	MTNR1A	42	36
CCc1c(C(F)(F)F)noc1NC(=O)CCCC(=O)c1cccc(OC)c1	ZINC000450726373	GI	On-Demand	Anodyne	MTNR1A	20	40
CCc1c(C(F)(F)F)noc1NC(=O)CCCC(=O)c1cccc(OC)c1	ZINC000450726373	GI	On-Demand	Anodyne	MTNR1B	23	40
CS(=O)(=O)c1cccc(CNc2nnc(C(F)(F)F)s2)c1	ZINC000450726388	ED	On-Demand	Anodyne	PTGS2	19	45
CS(=O)(=O)c1cccc(CNc2nnc(C(F)(F)F)s2)c1	ZINC000450726388	ED	On-Demand	Anodyne	PTK2	21	41
Cn1c(NCCOc2ccc(Cl)c(F)c2)nc2c1c(O)nc(=O)n2C	ZINC000450726406	FD	On-Demand	Anodyne	PROKR1	65	35
CNC(=O)c1cccnc1NCC(C)(C)C1CCC1	ZINC000450726411	CF	On-Demand	Anodyne	G2YM83_BOTF4	44	33
COc1cc(C)c(NC(=O)c2cccc3c2O[C@H](C)C3)cc1F	ZINC000450726414	DH	On-Demand	Anodyne	G2YM83_BOTF4	40	36
COc1cc(C)c(NC(=O)c2cccc3c2O[C@H](C)C3)cc1F	ZINC000450726414	DH	On-Demand	Anodyne	BRPF1	0	41
COc1cc(C)c(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1F	ZINC000450726415	DH	On-Demand	Anodyne	G2YM83_BOTF4	40	36
COc1cc(C)c(NC(=O)c2cccc3c2O[C@@H](C)C3)cc1F	ZINC000450726415	DH	On-Demand	Anodyne	BRPF1	0	41
Cc1nn(C)cc1CC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450726416	FF	On-Demand	Anodyne	PRCP	44	33
Cc1nn(C)cc1CC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450726416	FF	On-Demand	Anodyne	P2RX7	42	36
Cc1nn(C)cc1CC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450726418	FF	On-Demand	Anodyne	PRCP	44	33
Cc1nn(C)cc1CC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450726418	FF	On-Demand	Anodyne	P2RX7	42	36
Cc1nc([C@H]2CCCN2C(=O)c2ccc(C(F)(F)F)cc2C)cs1	ZINC000450726420	FJ	On-Demand	Anodyne	CPT1A	21	43
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000450726429	FE	On-Demand	Anodyne	MC4R	16	41
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000450726429	FE	On-Demand	Anodyne	Q6PRC7_IXORI	48	33
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000450726430	FE	On-Demand	Anodyne	MC4R	16	41
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000450726430	FE	On-Demand	Anodyne	Q6PRC7_IXORI	48	33
C[C@H](NCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)[C@@H](C)CO	ZINC000450726432	FE	On-Demand	Anodyne	MC4R	16	41
C[C@H](NCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)[C@@H](C)CO	ZINC000450726432	FE	On-Demand	Anodyne	Q6PRC7_IXORI	48	33
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000450726434	FE	On-Demand	Anodyne	MC4R	16	41
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000450726434	FE	On-Demand	Anodyne	Q6PRC7_IXORI	48	33
CC(=O)c1cccc(CSc2ccc(S(=O)(=O)N3CCCCC3)cn2)c1	ZINC000450726460	GH	On-Demand	Anodyne	NAMPT	35	41
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450726461	DH	On-Demand	Anodyne	COLA	42	39
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450726461	DH	On-Demand	Anodyne	CPT1A	40	39
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450726462	DH	On-Demand	Anodyne	COLA	42	39
CC[C@@H]1C[C@H]1C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450726462	DH	On-Demand	Anodyne	CPT1A	40	39
CCn1c(S[C@H](C)c2noc(C)n2)nc2cc3ccccc3cc2c1=O	ZINC000450726469	FI	On-Demand	Bother	POLR1A	57	35
C[C@H](NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)[C@@H](C)CO	ZINC000450726471	GF	On-Demand	Anodyne	OPRK1	0	42
C[C@H](NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)[C@@H](C)CO	ZINC000450726471	GF	On-Demand	Anodyne	OPRL1	19	42
C[C@H](NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)[C@@H](C)CO	ZINC000450726471	GF	On-Demand	Anodyne	PTAFR	43	47
C[C@H](NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)[C@@H](C)CO	ZINC000450726471	GF	On-Demand	Anodyne	DPP8	16	40
C[C@H](NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)[C@@H](C)CO	ZINC000450726471	GF	On-Demand	Anodyne	NMUR2	0	47
C[C@H](NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)[C@@H](C)CO	ZINC000450726471	GF	On-Demand	Anodyne	NMUR1	0	47
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726472	GF	On-Demand	Anodyne	OPRK1	0	42
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726472	GF	On-Demand	Anodyne	OPRL1	19	42
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726472	GF	On-Demand	Anodyne	PTAFR	43	47
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726472	GF	On-Demand	Anodyne	DPP8	16	40
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726472	GF	On-Demand	Anodyne	NMUR2	0	47
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726472	GF	On-Demand	Anodyne	NMUR1	0	47
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726473	GF	On-Demand	Anodyne	OPRK1	0	42
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726473	GF	On-Demand	Anodyne	OPRL1	19	42
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726473	GF	On-Demand	Anodyne	PTAFR	43	47
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726473	GF	On-Demand	Anodyne	DPP8	16	40
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726473	GF	On-Demand	Anodyne	NMUR2	0	47
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726473	GF	On-Demand	Anodyne	NMUR1	0	47
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726474	GF	On-Demand	Anodyne	OPRK1	0	42
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726474	GF	On-Demand	Anodyne	OPRL1	19	42
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726474	GF	On-Demand	Anodyne	PTAFR	43	47
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726474	GF	On-Demand	Anodyne	DPP8	16	40
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726474	GF	On-Demand	Anodyne	NMUR2	0	47
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000450726474	GF	On-Demand	Anodyne	NMUR1	0	47
CCc1c(C(F)(F)F)noc1NC(=O)Cc1cc(C)ccc1F	ZINC000450726475	EH	On-Demand	Anodyne	P2RX7	18	43
CCn1c(S[C@@H](C)c2noc(C)n2)nc2cc3ccccc3cc2c1=O	ZINC000450726476	FI	On-Demand	Bother	POLR1A	57	35
CCCOc1c(OC)cc(CCNc2ccnc(C(N)=O)c2)cc1OC	ZINC000450726529	FF	On-Demand	Anodyne	DRTS_TRYCR	49	34
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)on1	ZINC000450726545	GG	On-Demand	Anodyne	COLA	74	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)on1	ZINC000450726545	GG	On-Demand	Anodyne	CPT1A	72	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)on1	ZINC000450726548	GG	On-Demand	Anodyne	COLA	74	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)on1	ZINC000450726548	GG	On-Demand	Anodyne	CPT1A	72	40
CN(Cc1cnc(N(C)C)nc1)C(=O)C1=C(c2ccccc2)CCCC1	ZINC000450726564	FH	On-Demand	Anodyne	TSPO	18	42
Cc1ccn(CC(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)n1	ZINC000450726565	GH	On-Demand	Anodyne	RBP4	47	37
Cc1ccn(CC(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)n1	ZINC000450726565	GH	On-Demand	Anodyne	SCD	32	42
Cc1nc([C@H]2CCCN2C(=O)c2cc3cccnc3s2)cs1	ZINC000450726567	EI	On-Demand	Anodyne	CPT1A	31	40
COc1cc(O)cc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450726597	CE	On-Demand	Anodyne	ACAT	0	42
COc1cc(CC(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)ccc1O	ZINC000450726599	FF	On-Demand	Anodyne	MLNR	18	41
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450726605	FH	On-Demand	Anodyne	S1PR2	26	41
CC[C@H](CC(F)(F)F)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450726606	FH	On-Demand	Anodyne	S1PR2	26	41
CC[C@@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726613	CE	On-Demand	Anodyne	ACHE	0	41
CC[C@@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726613	CE	On-Demand	Anodyne	BMP1	40	34
CC[C@@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726613	CE	On-Demand	Anodyne	CTSB	60	43
CC[C@@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726613	CE	On-Demand	Anodyne	PAPA1_CARPA	52	39
CC[C@@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726613	CE	On-Demand	Anodyne	CAPN2	51	33
CC[C@@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726613	CE	On-Demand	Anodyne	POL	0	42
CC[C@@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726613	CE	On-Demand	Anodyne	NPR	52	32
CC[C@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726614	CE	On-Demand	Anodyne	ACHE	0	41
CC[C@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726614	CE	On-Demand	Anodyne	BMP1	40	34
CC[C@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726614	CE	On-Demand	Anodyne	CTSB	60	43
CC[C@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726614	CE	On-Demand	Anodyne	PAPA1_CARPA	52	39
CC[C@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726614	CE	On-Demand	Anodyne	CAPN2	51	33
CC[C@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726614	CE	On-Demand	Anodyne	POL	0	42
CC[C@H](C)[C@@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726614	CE	On-Demand	Anodyne	NPR	52	32
CC[C@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726615	CE	On-Demand	Anodyne	ACHE	0	41
CC[C@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726615	CE	On-Demand	Anodyne	BMP1	40	34
CC[C@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726615	CE	On-Demand	Anodyne	CTSB	60	43
CC[C@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726615	CE	On-Demand	Anodyne	PAPA1_CARPA	52	39
CC[C@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726615	CE	On-Demand	Anodyne	CAPN2	51	33
CC[C@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726615	CE	On-Demand	Anodyne	POL	0	42
CC[C@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726615	CE	On-Demand	Anodyne	NPR	52	32
CC[C@@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726616	CE	On-Demand	Anodyne	ACHE	0	41
CC[C@@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726616	CE	On-Demand	Anodyne	BMP1	40	34
CC[C@@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726616	CE	On-Demand	Anodyne	CTSB	60	43
CC[C@@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726616	CE	On-Demand	Anodyne	PAPA1_CARPA	52	39
CC[C@@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726616	CE	On-Demand	Anodyne	CAPN2	51	33
CC[C@@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726616	CE	On-Demand	Anodyne	POL	0	42
CC[C@@H](C)[C@H](NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450726616	CE	On-Demand	Anodyne	NPR	52	32
COc1cc(O)cc(NC(=O)c2cccc3c2CCCC3)c1	ZINC000450726624	CH	On-Demand	Anodyne	KCNK3	55	43
COc1cc(O)cc(NC(=O)c2cccc3c2CCCC3)c1	ZINC000450726624	CH	On-Demand	Anodyne	KCNK9	64	43
Cc1cccnc1CCCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450726630	GF	On-Demand	Bother	BCL2	19	40
Cc1cccnc1CCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450726667	FG	On-Demand	Bother	MAPK14	43	39
Cc1cccnc1CCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450726667	FG	On-Demand	Bother	MAPK13	40	35
Cc1cccnc1CCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450726667	FG	On-Demand	Bother	TTK	42	31
Cc1cccnc1CCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450726667	FG	On-Demand	Bother	TAAR1	16	40
Cn1cc(-c2ccc(C(=O)NCCCCc3ccc(F)c(F)c3)o2)cn1	ZINC000450726679	FH	On-Demand	Anodyne	SCN10A	16	42
COc1ccc(CNC(=O)CCN[C@H](C)c2nc(C)no2)c(OC)c1	ZINC000450726703	ED	On-Demand	Anodyne	PDGFRB	25	42
COc1ccc(CNC(=O)CCN[C@H](C)c2nc(C)no2)c(OC)c1	ZINC000450726703	ED	On-Demand	Anodyne	MTNR1A	49	40
COc1ccc(CNC(=O)CCN[C@H](C)c2nc(C)no2)c(OC)c1	ZINC000450726703	ED	On-Demand	Anodyne	MTNR1B	36	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2nc(C)no2)c(OC)c1	ZINC000450726708	ED	On-Demand	Anodyne	PDGFRB	25	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2nc(C)no2)c(OC)c1	ZINC000450726708	ED	On-Demand	Anodyne	MTNR1A	49	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2nc(C)no2)c(OC)c1	ZINC000450726708	ED	On-Demand	Anodyne	MTNR1B	36	40
CC(F)(F)CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450726714	FF	On-Demand	Anodyne	SCN9A	22	43
CC(F)(F)CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCCCO3)C1=O	ZINC000450726715	FF	On-Demand	Anodyne	SCN9A	22	43
CC(F)(F)CCSc1ccc(S(=O)(=O)N2CCOCC2)cn1	ZINC000450726718	FE	On-Demand	Anodyne	GCK	57	34
CC(F)(F)CCSc1ccc(S(=O)(=O)N2CCOCC2)cn1	ZINC000450726718	FE	On-Demand	Anodyne	GCKR	60	34
Cc1cccnc1CCCNc1ccnc2ccsc12	ZINC000450726729	CI	On-Demand	Anodyne	HRP1_PLAFA	64	33
Cc1cccnc1CCCNc1ccnc2ccsc12	ZINC000450726729	CI	On-Demand	Anodyne	HNMT	46	33
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@H]2C)c(OC)c1	ZINC000450726731	EF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2C)c(OC)c1	ZINC000450726732	EF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@@H]2C)c(OC)c1	ZINC000450726734	EF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@@H]2C)c(OC)c1	ZINC000450726736	EF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COC(=O)CCn1c(SCC[C@H]2CCOC2)nc2ccccc2c1=O	ZINC000450726742	FE	On-Demand	Anodyne	TNKS	56	31
COC(=O)CCn1c(SCC[C@@H]2CCOC2)nc2ccccc2c1=O	ZINC000450726743	FE	On-Demand	Anodyne	TNKS	56	31
Cc1cnc(CCCC(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)o1	ZINC000450726776	FH	On-Demand	Anodyne	PRCP	42	32
Cc1cnc(CCCC(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)o1	ZINC000450726781	FH	On-Demand	Anodyne	PRCP	42	32
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450726798	GH	On-Demand	Anodyne	CCR2	47	40
COc1cccc(OCCC(=O)N(C)Cc2cnc(N(C)C)nc2)c1	ZINC000450726800	ED	On-Demand	Anodyne	MTNR1A	23	44
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	ACE	67	39
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	FKBP1A	57	40
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	GHRHR	42	32
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	XPNPEP1	0	40
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	PREP	56	39
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	AMY2	45	31
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	REN	36	41
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	XPNPEP2	0	40
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	DPP7	46	41
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H](C)C1	ZINC000450726802	CG	On-Demand	Anodyne	RHODESAIN	0	41
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	ACE	67	39
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	FKBP1A	57	40
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	GHRHR	42	32
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	XPNPEP1	0	40
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	PREP	56	39
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	AMY2	45	31
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	REN	36	41
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	XPNPEP2	0	40
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	DPP7	46	41
C[C@H]1CCCCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450726803	CG	On-Demand	Anodyne	RHODESAIN	0	41
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	ACE	67	39
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	FKBP1A	57	40
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	GHRHR	42	32
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	XPNPEP1	0	40
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	PREP	56	39
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	AMY2	45	31
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	REN	36	41
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	XPNPEP2	0	40
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	DPP7	46	41
C[C@@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726805	CG	On-Demand	Anodyne	RHODESAIN	0	41
C[C@H](CO)[C@@H](C)NCC(=O)N(Cc1ccccc1)CC(F)(F)F	ZINC000450726806	EE	On-Demand	Anodyne	PTGES	25	41
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	ACE	67	39
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	FKBP1A	57	40
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	GHRHR	42	32
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	XPNPEP1	0	40
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	PREP	56	39
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	AMY2	45	31
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	REN	36	41
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	XPNPEP2	0	40
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	DPP7	46	41
C[C@H]1CCCCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450726807	CG	On-Demand	Anodyne	RHODESAIN	0	41
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450726808	GH	On-Demand	Anodyne	CCR2	47	40
Fc1ccc(-c2csc(NC[C@H]3CC34CCOCC4)n2)cc1	ZINC000450726810	DH	On-Demand	Anodyne	MAOB	22	42
Fc1ccc(-c2csc(NC[C@@H]3CC34CCOCC4)n2)cc1	ZINC000450726811	DH	On-Demand	Anodyne	MAOB	22	42
C[C@H](CO)[C@H](C)NCC(=O)N(Cc1ccccc1)CC(F)(F)F	ZINC000450726812	EE	On-Demand	Anodyne	PTGES	25	41
C[C@@H](CO)[C@@H](C)NCC(=O)N(Cc1ccccc1)CC(F)(F)F	ZINC000450726814	EE	On-Demand	Anodyne	PTGES	25	41
C[C@H](NCC(=O)N(Cc1ccccc1)CC(F)(F)F)[C@@H](C)CO	ZINC000450726817	EE	On-Demand	Anodyne	PTGES	25	41
C[C@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450726830	EH	On-Demand	Bother	CACNA1B	42	35
C[C@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450726830	EH	On-Demand	Bother	LIPG	52	36
C[C@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450726830	EH	On-Demand	Bother	PPXII	0	41
C[C@@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450726832	EH	On-Demand	Bother	CACNA1B	42	35
C[C@@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450726832	EH	On-Demand	Bother	LIPG	52	36
C[C@@H]1CCCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1	ZINC000450726832	EH	On-Demand	Bother	PPXII	0	41
CC[C@@H](NCC1(C(=O)OC)CC1)c1nccs1	ZINC000450726833	CE	On-Demand	Anodyne	MAP1	46	34
CC[C@H](NCC1(C(=O)OC)CC1)c1nccs1	ZINC000450726835	CE	On-Demand	Anodyne	MAP1	46	34
CCc1c(C(F)(F)F)noc1NC(=O)c1ccc(OC(C)(C)C)cn1	ZINC000450726842	FI	On-Demand	Anodyne	ATF1	51	31
CCc1c(C(F)(F)F)noc1NC(=O)c1ccc(OC(C)(C)C)cn1	ZINC000450726842	FI	On-Demand	Anodyne	NFKB1	47	31
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)n1	ZINC000450726844	EH	On-Demand	Anodyne	COLA	83	42
CCc1cccc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)n1	ZINC000450726844	EH	On-Demand	Anodyne	CPT1A	81	42
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)n1	ZINC000450726845	EH	On-Demand	Anodyne	COLA	83	42
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)n1	ZINC000450726845	EH	On-Demand	Anodyne	CPT1A	81	42
COc1cc(C)c(NC(=O)[C@@H]2Cc3c(C)cccc3O2)cc1F	ZINC000450726855	DG	On-Demand	Anodyne	ROCK2	16	41
COc1cc(C)c(NC(=O)[C@@H]2Cc3c(C)cccc3O2)cc1F	ZINC000450726855	DG	On-Demand	Anodyne	MT-ND4	43	33
COc1cc(C)c(NC(=O)[C@H]2Cc3c(C)cccc3O2)cc1F	ZINC000450726856	DG	On-Demand	Anodyne	ROCK2	16	41
COc1cc(C)c(NC(=O)[C@H]2Cc3c(C)cccc3O2)cc1F	ZINC000450726856	DG	On-Demand	Anodyne	MT-ND4	43	33
CCCNC(=O)c1ccc(NC[C@@H]2C[C@H]2CC)nc1	ZINC000450726864	CF	On-Demand	Anodyne	IKBKB	0	40
CC[C@@H]1C[C@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450726873	DF	On-Demand	Bother	TAAR1	16	42
Cc1ccc(F)c(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450726887	FI	On-Demand	Anodyne	COLA	94	46
Cc1ccc(F)c(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450726887	FI	On-Demand	Anodyne	CPT1A	91	46
Cc1ccc(F)c(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450726889	FI	On-Demand	Anodyne	COLA	94	46
Cc1ccc(F)c(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450726889	FI	On-Demand	Anodyne	CPT1A	91	46
O=C(N1CCO[C@@H](c2ccc(F)cc2Cl)C1)C1(C(F)(F)F)CCC1	ZINC000450726908	FI	On-Demand	Anodyne	PRCP	42	35
O=C(N1CCO[C@H](c2ccc(F)cc2Cl)C1)C1(C(F)(F)F)CCC1	ZINC000450726909	FI	On-Demand	Anodyne	PRCP	42	35
CNS(=O)(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450726913	GE	On-Demand	Bother	BDKRB1	0	44
CNS(=O)(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450726913	GE	On-Demand	Bother	BCL2L1	58	36
CNS(=O)(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450726916	GE	On-Demand	Bother	BDKRB1	0	44
CNS(=O)(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450726916	GE	On-Demand	Bother	BCL2L1	58	36
CO[C@@](C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450726918	FG	On-Demand	Bother	MAPK13	41	33
CO[C@@](C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450726918	FG	On-Demand	Bother	TAAR1	18	43
CO[C@](C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450726920	FG	On-Demand	Bother	MAPK13	41	33
CO[C@](C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccccc1	ZINC000450726920	FG	On-Demand	Bother	TAAR1	18	43
CC(C)CCCC(=O)NC1(Cc2ccccc2)CC1	ZINC000450726936	CH	On-Demand	Anodyne	KLK3	40	30
CCc1nc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cs1	ZINC000450726938	GG	On-Demand	Anodyne	MTNR1A	63	41
CCc1nc([C@@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cs1	ZINC000450726938	GG	On-Demand	Anodyne	MTNR1B	48	39
CCc1nc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cs1	ZINC000450726941	GG	On-Demand	Anodyne	MTNR1A	63	41
CCc1nc([C@H](C)NCCC(=O)NCc2ccc(OC)cc2OC)cs1	ZINC000450726941	GG	On-Demand	Anodyne	MTNR1B	48	39
COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@H](C)[C@H](C)CO	ZINC000450726943	ED	On-Demand	Anodyne	ADRB2	27	52
Cc1nc(-c2cccnc2)nc(NCc2nn(C)cc2Br)c1C	ZINC000450726944	FF	On-Demand	Anodyne	ROS1	51	39
COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@@H](C)[C@@H](C)CO	ZINC000450726945	ED	On-Demand	Anodyne	ADRB2	27	52
COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@@H](C)[C@H](C)CO	ZINC000450726947	ED	On-Demand	Anodyne	ADRB2	27	52
CC[C@@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726989	EE	On-Demand	Anodyne	CA1	19	44
CC[C@@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726989	EE	On-Demand	Anodyne	CA7	15	44
CC[C@@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726989	EE	On-Demand	Anodyne	RORC	47	35
CC[C@@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726989	EE	On-Demand	Anodyne	TMPRSS11D	24	42
CC[C@@H](C)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726990	EE	On-Demand	Anodyne	CA1	19	44
CC[C@@H](C)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726990	EE	On-Demand	Anodyne	CA7	15	44
CC[C@@H](C)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726990	EE	On-Demand	Anodyne	RORC	47	35
CC[C@@H](C)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726990	EE	On-Demand	Anodyne	TMPRSS11D	24	42
CC[C@H](C)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726991	EE	On-Demand	Anodyne	CA1	19	44
CC[C@H](C)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726991	EE	On-Demand	Anodyne	CA7	15	44
CC[C@H](C)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726991	EE	On-Demand	Anodyne	RORC	47	35
CC[C@H](C)[C@@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726991	EE	On-Demand	Anodyne	TMPRSS11D	24	42
CC[C@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726992	EE	On-Demand	Anodyne	CA1	19	44
CC[C@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726992	EE	On-Demand	Anodyne	CA7	15	44
CC[C@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726992	EE	On-Demand	Anodyne	RORC	47	35
CC[C@H](C)[C@H](NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450726992	EE	On-Demand	Anodyne	TMPRSS11D	24	42
C=CCn1c(=O)n(CC=C)c(=O)n(CCCCCC(C)=O)c1=O	ZINC000450727007	DC	On-Demand	Mild	PAOX	42	38
CC[C@H](C)[C@@H](NCCc1cscn1)C(=O)OC	ZINC000450727008	CD	On-Demand	Anodyne	BMP1	22	42
CC[C@@H](C)[C@H](NCCc1cscn1)C(=O)OC	ZINC000450727009	CD	On-Demand	Anodyne	BMP1	22	42
CC[C@@H](C)[C@@H](NCCc1cscn1)C(=O)OC	ZINC000450727010	CD	On-Demand	Anodyne	BMP1	22	42
Cc1ccc(C(=O)N2CCC(n3cc(Cl)cn3)CC2)c(C(C)C)n1	ZINC000450727039	EH	On-Demand	Anodyne	L3MBTL3	49	34
COc1cc(C(C)=O)ccc1OC[C@H](O)CN[C@H](C)[C@@H](C)CO	ZINC000450727059	ED	On-Demand	Anodyne	ADRB2	27	52
CCOCc1nc(C)c(C(=O)NCc2cccc(C(C)C)c2)s1	ZINC000450727061	EI	On-Demand	Anodyne	SCD1	44	43
CCOCc1nc(C)c(C(=O)NCc2cccc(C(C)C)c2)s1	ZINC000450727061	EI	On-Demand	Anodyne	SCD	37	43
CCOCc1nc(C)c(C(=O)NCc2cccc(C(C)C)c2)s1	ZINC000450727061	EI	On-Demand	Anodyne	PDS	46	42
COc1ccc(CNC(=O)CCNC(C)(C)c2ncc(C)s2)c(OC)c1	ZINC000450727071	GF	On-Demand	Anodyne	PDGFRB	35	47
COc1ccc(CNC(=O)CCNC(C)(C)c2ncc(C)s2)c(OC)c1	ZINC000450727071	GF	On-Demand	Anodyne	MTNR1A	40	37
COc1ccc(CNC(=O)CCNC(C)(C)c2ncc(C)s2)c(OC)c1	ZINC000450727071	GF	On-Demand	Anodyne	CSF1R	15	47
C[C@H](CO)[C@H](C)NCC(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000450727084	EC	On-Demand	Anodyne	HCN1	40	35
C[C@H](CO)[C@H](C)NCC(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000450727084	EC	On-Demand	Anodyne	HCN4	51	35
C[C@H](NCC(=O)NCC1(N2CCOCC2)CCCCC1)[C@@H](C)CO	ZINC000450727085	EC	On-Demand	Anodyne	HCN1	40	35
C[C@H](NCC(=O)NCC1(N2CCOCC2)CCCCC1)[C@@H](C)CO	ZINC000450727085	EC	On-Demand	Anodyne	HCN4	51	35
C[C@H](CO)[C@@H](C)NCC(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000450727086	EC	On-Demand	Anodyne	HCN1	40	35
C[C@H](CO)[C@@H](C)NCC(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000450727086	EC	On-Demand	Anodyne	HCN4	51	35
C[C@@H](CO)[C@@H](C)NCC(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000450727087	EC	On-Demand	Anodyne	HCN1	40	35
C[C@@H](CO)[C@@H](C)NCC(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000450727087	EC	On-Demand	Anodyne	HCN4	51	35
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)c1ccccc1	ZINC000450727114	GG	On-Demand	Anodyne	CA2	42	37
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)c1ccccc1	ZINC000450727114	GG	On-Demand	Anodyne	CA4	42	36
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)c1ccccc1	ZINC000450727114	GG	On-Demand	Anodyne	SFRP1	56	33
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)c1ccccc1	ZINC000450727115	GG	On-Demand	Anodyne	CA2	42	37
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)c1ccccc1	ZINC000450727115	GG	On-Demand	Anodyne	CA4	42	36
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)c1ccccc1	ZINC000450727115	GG	On-Demand	Anodyne	SFRP1	56	33
CC[C@@H]1C[C@H]1CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727117	DD	On-Demand	Anodyne	CA2	49	51
CC[C@@H]1C[C@H]1CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727117	DD	On-Demand	Anodyne	CA1	47	39
CC[C@@H]1C[C@H]1CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727117	DD	On-Demand	Anodyne	CA7	47	42
CC[C@@H]1C[C@H]1CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727117	DD	On-Demand	Anodyne	CA4	45	40
Cc1onc(C2CC2)c1C(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450727128	FH	On-Demand	Anodyne	PRCP	45	33
Cc1onc(C2CC2)c1C(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450727134	FH	On-Demand	Anodyne	PRCP	45	33
CCCOc1c(OC)cc(CCNc2cc(=O)n3ccccc3n2)cc1OC	ZINC000450727148	GG	On-Demand	Anodyne	PTGDR	22	40
CC(C)c1cccc(CNC(=O)C2(CF)CCOCC2)c1	ZINC000450727150	CG	On-Demand	Anodyne	NR3C2	19	40
CO[C@@](C)(CNc1ncc([N+](=O)[O-])c(C)n1)c1ccccc1	ZINC000450727178	DF	On-Demand	Bother	PRKCQ	48	43
CO[C@](C)(CNc1ncc([N+](=O)[O-])c(C)n1)c1ccccc1	ZINC000450727181	DF	On-Demand	Bother	PRKCQ	48	43
O=C(c1cnn2c1CCC2)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450727183	GH	On-Demand	Anodyne	RBP4	57	42
O=C(c1cnn2c1CCC2)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450727183	GH	On-Demand	Anodyne	SCD1	46	41
O=C(c1cnn2c1CCC2)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450727183	GH	On-Demand	Anodyne	SCD	49	41
C[C@H](CO)[C@@H](C)N[C@@H](C(=O)Nc1ccccc1)c1ccccc1	ZINC000450727185	DF	On-Demand	Anodyne	MMP3	28	40
C[C@H](CO)[C@@H](C)N[C@H](C(=O)Nc1ccccc1)c1ccccc1	ZINC000450727186	DF	On-Demand	Anodyne	MMP3	28	40
C[C@H](CO)[C@H](C)N[C@@H](C(=O)Nc1ccccc1)c1ccccc1	ZINC000450727187	DF	On-Demand	Anodyne	MMP3	28	40
C[C@H](CO)[C@H](C)N[C@H](C(=O)Nc1ccccc1)c1ccccc1	ZINC000450727188	DF	On-Demand	Anodyne	MMP3	28	40
COC[C@@]1(C(=O)NCc2cccc(C(C)C)c2)CCOC1	ZINC000450727209	CE	On-Demand	Anodyne	NR3C2	0	40
COC[C@]1(C(=O)NCc2cccc(C(C)C)c2)CCOC1	ZINC000450727210	CE	On-Demand	Anodyne	NR3C2	0	40
CO[C@@](C)(CNc1ccc(S(=O)(=O)N2CCCC2)cn1)c1ccccc1	ZINC000450727230	GF	On-Demand	Anodyne	TGM2	29	43
CO[C@](C)(CNc1ccc(S(=O)(=O)N2CCCC2)cn1)c1ccccc1	ZINC000450727231	GF	On-Demand	Anodyne	TGM2	29	43
CCCOc1ccc(C(=O)Nc2cc(F)c(OC)cc2C)c(OC)c1	ZINC000450727239	EI	On-Demand	Anodyne	KCNK3	41	36
CCCOc1ccc(C(=O)Nc2cc(F)c(OC)cc2C)c(OC)c1	ZINC000450727239	EI	On-Demand	Anodyne	BRPF1	0	41
CO[C@@](C)(CNc1cc(C)nc2ncnn12)c1ccccc1	ZINC000450727244	CE	On-Demand	Anodyne	DHOD	0	56
CO[C@](C)(CNc1cc(C)nc2ncnn12)c1ccccc1	ZINC000450727245	CE	On-Demand	Anodyne	DHOD	0	56
CN1CCC(C)(CNC(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450727268	EF	On-Demand	Anodyne	NPFFR1	42	33
CC(C)OC(C)(C)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450727272	DH	On-Demand	Anodyne	LEF	60	33
C=CC(C)(C)CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450727277	EF	On-Demand	Mild	TAAR1	18	48
C=CC(C)(C)CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450727278	EF	On-Demand	Mild	TAAR1	18	48
CC(=O)N[C@H](C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1)C(C)(C)C	ZINC000450727289	FE	On-Demand	Anodyne	MC4R	17	40
CC(=O)N[C@H](C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1)C(C)(C)C	ZINC000450727289	FE	On-Demand	Anodyne	MC5R	24	40
COc1cc(CC(=O)NCCCCc2ccc(F)c(F)c2)ccc1O	ZINC000450727292	EG	On-Demand	Anodyne	INHA	59	34
COc1cc(CC(=O)NCCCCc2ccc(F)c(F)c2)ccc1O	ZINC000450727292	EG	On-Demand	Anodyne	TRPV1	22	53
COc1cc(CC(=O)NCCCCc2ccc(F)c(F)c2)ccc1O	ZINC000450727292	EG	On-Demand	Anodyne	NCE103	33	55
COc1cc(CC(=O)NCCCCc2ccc(F)c(F)c2)ccc1O	ZINC000450727292	EG	On-Demand	Anodyne	P96878_MYCTU	23	55
COc1cc(CC(=O)NCCCCc2ccc(F)c(F)c2)ccc1O	ZINC000450727292	EG	On-Demand	Anodyne	CAN2	0	55
C=CC(C)(C)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450727325	DG	On-Demand	Mild	MAPK14	40	36
C=CC(C)(C)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450727325	DG	On-Demand	Mild	MAPK13	45	35
C=CC(C)(C)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450727325	DG	On-Demand	Mild	TAAR1	17	45
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450727326	FF	On-Demand	Anodyne	MC4R	28	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450727326	FF	On-Demand	Anodyne	SLC12A5	51	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450727327	FF	On-Demand	Anodyne	MC4R	28	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450727327	FF	On-Demand	Anodyne	SLC12A5	51	42
CN(Cc1cnc(N(C)C)nc1)C(=O)C1=C(c2ccccc2)CCC1	ZINC000450727333	EG	On-Demand	Anodyne	TSPO	17	42
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727344	DD	On-Demand	Mild	CA2	57	53
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727344	DD	On-Demand	Mild	CA1	49	40
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727344	DD	On-Demand	Mild	CA7	46	36
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727344	DD	On-Demand	Mild	CA4	50	41
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450727344	DD	On-Demand	Mild	CA12	31	40
COc1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)cc1S(C)(=O)=O	ZINC000450727345	GG	On-Demand	Anodyne	PTAFR	15	44
COc1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)cc1S(C)(=O)=O	ZINC000450727345	GG	On-Demand	Anodyne	TRPV1	18	40
COc1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)cc1S(C)(=O)=O	ZINC000450727345	GG	On-Demand	Anodyne	COLA	67	35
COc1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)cc1S(C)(=O)=O	ZINC000450727345	GG	On-Demand	Anodyne	CPT1A	62	35
COc1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)cc1S(C)(=O)=O	ZINC000450727345	GG	On-Demand	Anodyne	CPT1B	59	35
COc1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)cc1S(C)(=O)=O	ZINC000450727345	GG	On-Demand	Anodyne	PTGDR	28	42
COc1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)cc1S(C)(=O)=O	ZINC000450727345	GG	On-Demand	Anodyne	PTGDR2	23	43
CCCCSc1nnc(S[C@H](C)C(=O)Nc2nccs2)s1	ZINC000450727357	FI	On-Demand	Anodyne	MAP	0	42
CCCCSc1nnc(S[C@H](C)C(=O)Nc2nccs2)s1	ZINC000450727357	FI	On-Demand	Anodyne	MAP1	111	41
CCCCSc1nnc(S[C@@H](C)C(=O)Nc2nccs2)s1	ZINC000450727358	FI	On-Demand	Anodyne	MAP	0	42
CCCCSc1nnc(S[C@@H](C)C(=O)Nc2nccs2)s1	ZINC000450727358	FI	On-Demand	Anodyne	MAP1	111	41
CCCOc1c(OC)cc(CCNc2cnc(C#N)cn2)cc1OC	ZINC000450727365	EF	On-Demand	Mild	CHEK1	15	40
Cc1cc(=NCc2cccc(S(C)(=O)=O)c2)[nH]nc1C	ZINC000450727392	CD	On-Demand	Anodyne	HAO2	50	32
Cc1cc(OC[C@H](O)CN[C@@H](C)[C@H](C)CO)c(C(C)C)cc1Cl	ZINC000450727393	EG	On-Demand	Anodyne	ADRB2	26	42
Cc1cc(OC[C@H](O)CN[C@H](C)[C@H](C)CO)c(C(C)C)cc1Cl	ZINC000450727394	EG	On-Demand	Anodyne	ADRB2	26	42
Cc1cc(OC[C@H](O)CN[C@H](C)[C@@H](C)CO)c(C(C)C)cc1Cl	ZINC000450727395	EG	On-Demand	Anodyne	ADRB2	26	42
Cc1cc(OC[C@H](O)CN[C@@H](C)[C@@H](C)CO)c(C(C)C)cc1Cl	ZINC000450727396	EG	On-Demand	Anodyne	ADRB2	26	42
CC(C)(CC(=O)CSc1ccc(S(=O)(=O)N2CCCC2)cn1)C1CC1	ZINC000450727408	GG	On-Demand	Anodyne	GCK	46	31
C[C@H](CO)[C@@H](C)NCC(=O)N(C)Cc1ccccc1	ZINC000450727419	CD	On-Demand	Anodyne	CTSB	26	42
C[C@H](CO)[C@H](C)NCC(=O)N(C)Cc1ccccc1	ZINC000450727420	CD	On-Demand	Anodyne	CTSB	26	42
C[C@@H](CO)[C@@H](C)NCC(=O)N(C)Cc1ccccc1	ZINC000450727421	CD	On-Demand	Anodyne	CTSB	26	42
C[C@H](NCC(=O)N(C)Cc1ccccc1)[C@@H](C)CO	ZINC000450727422	CD	On-Demand	Anodyne	CTSB	26	42
C[C@@H](O)CCSc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450727432	DD	On-Demand	Anodyne	GCKR	41	31
C[C@H](O)CCSc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450727433	DD	On-Demand	Anodyne	GCKR	41	31
CCCC[C@@H]1CCC[C@H]1NCc1cn(CC2CC2)nn1	ZINC000450727434	CG	On-Demand	Anodyne	GBA	16	42
CCCC[C@H]1CCC[C@H]1NCc1cn(CC2CC2)nn1	ZINC000450727435	CG	On-Demand	Anodyne	GBA	16	42
CCCC[C@H]1CCC[C@@H]1NCc1cn(CC2CC2)nn1	ZINC000450727436	CG	On-Demand	Anodyne	GBA	16	42
CCCC[C@@H]1CCC[C@@H]1NCc1cn(CC2CC2)nn1	ZINC000450727437	CG	On-Demand	Anodyne	GBA	16	42
COCc1nn(C)cc1C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450727495	FF	On-Demand	Anodyne	COLA	66	43
COCc1nn(C)cc1C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450727495	FF	On-Demand	Anodyne	CPT1A	47	41
COCc1nn(C)cc1C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450727496	FF	On-Demand	Anodyne	COLA	66	43
COCc1nn(C)cc1C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450727496	FF	On-Demand	Anodyne	CPT1A	47	41
CCS(=O)(=O)c1ccc(CN[C@@H](CC(N)=O)C2CCCCC2)cc1	ZINC000450727511	FE	On-Demand	Anodyne	PROC	43	34
CCS(=O)(=O)c1ccc(CN[C@H](CC(N)=O)C2CCCCC2)cc1	ZINC000450727512	FE	On-Demand	Anodyne	PROC	43	34
CCn1c(SC[C@H](O)CC#N)nc2cc3ccccc3cc2c1=O	ZINC000450727532	EF	On-Demand	Mild	POLR1A	77	38
CCOc1cccc2cc([C@@H](C)NCC3(C(=O)OC)CC3)oc12	ZINC000450727567	DG	On-Demand	Anodyne	HCN1	53	36
CCOc1cccc2cc([C@@H](C)NCC3(C(=O)OC)CC3)oc12	ZINC000450727567	DG	On-Demand	Anodyne	HCN4	50	36
CCOc1cccc2cc([C@H](C)NCC3(C(=O)OC)CC3)oc12	ZINC000450727568	DG	On-Demand	Anodyne	HCN1	53	36
CCOc1cccc2cc([C@H](C)NCC3(C(=O)OC)CC3)oc12	ZINC000450727568	DG	On-Demand	Anodyne	HCN4	50	36
CC(C)c1ncsc1C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450727569	EI	On-Demand	Anodyne	LEF	44	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCCC[C@@H](C)C1	ZINC000450727604	DG	On-Demand	Anodyne	RIR1_HHV11	68	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCCC[C@@H](C)C1	ZINC000450727604	DG	On-Demand	Anodyne	RHODESAIN	0	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCCC[C@H](C)C1	ZINC000450727605	DG	On-Demand	Anodyne	RIR1_HHV11	68	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCCC[C@H](C)C1	ZINC000450727605	DG	On-Demand	Anodyne	RHODESAIN	0	48
COc1cc(CC(=O)N(C)[C@@H](CO)CC(C)C)ccc1Cl	ZINC000450727627	DF	On-Demand	Anodyne	OPRK1	0	55
COc1cc(CC(=O)N(C)[C@@H](CO)CC(C)C)ccc1Cl	ZINC000450727627	DF	On-Demand	Anodyne	PDE6A	41	32
COc1cc(CC(=O)N(C)[C@H](CO)CC(C)C)ccc1Cl	ZINC000450727628	DF	On-Demand	Anodyne	OPRK1	0	55
COc1cc(CC(=O)N(C)[C@H](CO)CC(C)C)ccc1Cl	ZINC000450727628	DF	On-Demand	Anodyne	PDE6A	41	32
O=C(c1cc2cccnc2s1)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450727629	FH	On-Demand	Anodyne	UTS2R	0	42
C[C@H](CO)[C@H](C)NC[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450727659	GG	On-Demand	Anodyne	SLC6A3	20	40
C[C@H](CO)[C@H](C)NC[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450727660	GG	On-Demand	Anodyne	SLC6A3	20	40
C[C@H](CO)[C@@H](C)NC[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450727661	GG	On-Demand	Anodyne	SLC6A3	20	40
C[C@H](CO)[C@@H](C)NC[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000450727662	GG	On-Demand	Anodyne	SLC6A3	20	40
Cc1nc([C@H]2CCCN2C(=O)CCCC(=O)C2CC2)cs1	ZINC000450727686	DG	On-Demand	Anodyne	CPT1A	81	45
COc1ccc(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1S(C)(=O)=O	ZINC000450727695	FH	On-Demand	Anodyne	COLA	91	44
COc1ccc(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1S(C)(=O)=O	ZINC000450727695	FH	On-Demand	Anodyne	CPT1A	83	44
COc1ccc(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1S(C)(=O)=O	ZINC000450727695	FH	On-Demand	Anodyne	CPT2	56	44
COc1ccc(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1S(C)(=O)=O	ZINC000450727695	FH	On-Demand	Anodyne	CPT1B	74	40
COc1ccc(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1S(C)(=O)=O	ZINC000450727695	FH	On-Demand	Anodyne	KCNK3	59	37
COc1ccc(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1S(C)(=O)=O	ZINC000450727695	FH	On-Demand	Anodyne	KCNK9	60	39
Cn1nc(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)c2c1CCCC2	ZINC000450727696	GG	On-Demand	Anodyne	PRCP	46	34
Cn1nc(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)c2c1CCCC2	ZINC000450727697	GG	On-Demand	Anodyne	PRCP	46	34
CCc1c(C(F)(F)F)noc1NC(=O)c1cc(C)cc(O)n1	ZINC000450727705	DF	On-Demand	Anodyne	ATF1	44	32
CCc1c(C(F)(F)F)noc1NC(=O)c1cc(C)cc(O)n1	ZINC000450727705	DF	On-Demand	Anodyne	NFKB1	41	32
CC(C)c1nc([C@@H]2CCCCCN2C(=O)CCCC(=O)C2CC2)no1	ZINC000450727719	EH	On-Demand	Anodyne	COLA	89	44
CC(C)c1nc([C@@H]2CCCCCN2C(=O)CCCC(=O)C2CC2)no1	ZINC000450727719	EH	On-Demand	Anodyne	CPT1A	87	44
CC(C)c1nc([C@H]2CCCCCN2C(=O)CCCC(=O)C2CC2)no1	ZINC000450727720	EH	On-Demand	Anodyne	COLA	89	44
CC(C)c1nc([C@H]2CCCCCN2C(=O)CCCC(=O)C2CC2)no1	ZINC000450727720	EH	On-Demand	Anodyne	CPT1A	87	44
CCCOc1c(OC)cc(CCNc2ccnc(N(C)C)n2)cc1OC	ZINC000450727730	FE	On-Demand	Anodyne	PTGDR	15	41
C[C@H](CO)[C@@H](C)NCC(=O)N(C)CCOc1ccc(Br)cc1	ZINC000450727731	FD	On-Demand	Anodyne	LSS	25	41
C[C@H](CO)[C@H](C)NCC(=O)N(C)CCOc1ccc(Br)cc1	ZINC000450727736	FD	On-Demand	Anodyne	LSS	25	41
C[C@@H](CO)[C@@H](C)NCC(=O)N(C)CCOc1ccc(Br)cc1	ZINC000450727737	FD	On-Demand	Anodyne	LSS	25	41
C[C@H](NCC(=O)N(C)CCOc1ccc(Br)cc1)[C@@H](C)CO	ZINC000450727738	FD	On-Demand	Anodyne	LSS	25	41
COC(=O)CCn1c(SC[C@H]2CCCC2(F)F)nc2ccccc2c1=O	ZINC000450727739	GG	On-Demand	Anodyne	TNKS	40	31
COC(=O)CCn1c(SC[C@@H]2CCCC2(F)F)nc2ccccc2c1=O	ZINC000450727740	GG	On-Demand	Anodyne	TNKS	40	31
CC[C@@H]1C[C@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450727805	CG	On-Demand	Bother	TAAR1	16	44
CC[C@@H]1C[C@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450727805	CG	On-Demand	Bother	AKR1C3	16	45
CO[C@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccccc1	ZINC000450727824	GF	On-Demand	Bother	COLA	70	35
CO[C@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccccc1	ZINC000450727824	GF	On-Demand	Bother	BCL2L1	89	33
CO[C@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccccc1	ZINC000450727824	GF	On-Demand	Bother	BCL2	63	34
CO[C@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccccc1	ZINC000450727824	GF	On-Demand	Bother	BCL2L2	43	31
CO[C@@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccccc1	ZINC000450727825	GF	On-Demand	Bother	COLA	70	35
CO[C@@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccccc1	ZINC000450727825	GF	On-Demand	Bother	BCL2L1	89	33
CO[C@@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccccc1	ZINC000450727825	GF	On-Demand	Bother	BCL2	63	34
CO[C@@](C)(CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])c1ccccc1	ZINC000450727825	GF	On-Demand	Bother	BCL2L2	43	31
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	ACHE	24	45
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	AVPR1B	34	46
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	THRB	0	40
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	HRH3	48	48
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	SIGMAR1	30	43
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	NPY1R	41	35
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	BCHE	18	43
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	EBP	45	35
COc1cccc(OCCC(=O)N2CCC(CCCN3CCOCC3)CC2)c1	ZINC000450727840	GF	On-Demand	Anodyne	EPHX2	30	49
CCn1c(S[C@H]2CC[C@H](C#N)C2)nc2cc3ccccc3cc2c1=O	ZINC000450727844	EI	On-Demand	Mild	POLR1A	62	33
CCn1c(S[C@H]2CC[C@@H](C#N)C2)nc2cc3ccccc3cc2c1=O	ZINC000450727846	EI	On-Demand	Mild	POLR1A	62	33
CCn1c(S[C@@H]2CC[C@@H](C#N)C2)nc2cc3ccccc3cc2c1=O	ZINC000450727847	EI	On-Demand	Mild	POLR1A	62	33
CCn1c(S[C@@H]2CC[C@H](C#N)C2)nc2cc3ccccc3cc2c1=O	ZINC000450727848	EI	On-Demand	Mild	POLR1A	62	33
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450727882	GH	On-Demand	Anodyne	PREP	40	35
O=C([C@H]1CCCCN1C1CCCC1)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450727883	GH	On-Demand	Anodyne	PREP	40	35
COc1ccc([N+](=O)[O-])c(NCCCc2ncccc2C)c1	ZINC000450727901	DG	On-Demand	Bother	NFKBIA	0	42
CCOCc1nc(C)c(C(=O)NCCCCc2ccc(F)c(F)c2)s1	ZINC000450727908	FI	On-Demand	Anodyne	SCD1	33	45
CCOCc1nc(C)c(C(=O)NCCCCc2ccc(F)c(F)c2)s1	ZINC000450727908	FI	On-Demand	Anodyne	SCD	25	45
CCc1cc(NCCCc2ncccc2C)n2ncnc2n1	ZINC000450727921	CE	On-Demand	Anodyne	DHOD	0	52
CC[C@@H]1C[C@H]1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450727949	EF	On-Demand	Bother	LRRK2	16	40
Cn1c(C#N)ccc1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450727954	GH	On-Demand	Mild	RBP4	49	40
Cc1nc(C(C)C)oc1CSc1nc2cc3ccccc3cc2c(=O)n1C	ZINC000450727967	GJ	On-Demand	Bother	POLR1A	44	32
CO[C@@](C)(CNc1cc(N2CCC[C@H](CO)C2)ncn1)c1ccccc1	ZINC000450727972	FF	On-Demand	Anodyne	PRCP	0	42
CO[C@](C)(CNc1cc(N2CCC[C@H](CO)C2)ncn1)c1ccccc1	ZINC000450727973	FF	On-Demand	Anodyne	PRCP	0	42
CO[C@](C)(CNc1cc(N2CCC[C@@H](CO)C2)ncn1)c1ccccc1	ZINC000450727974	FF	On-Demand	Anodyne	PRCP	0	42
CO[C@@](C)(CNc1cc(N2CCC[C@@H](CO)C2)ncn1)c1ccccc1	ZINC000450727975	FF	On-Demand	Anodyne	PRCP	0	42
O=C(NC1(Cc2ccccc2)CC1)[C@@H]1CCCCC1(F)F	ZINC000450727982	CH	On-Demand	Anodyne	SLC12A5	43	36
O=C(NC1(Cc2ccccc2)CC1)[C@H]1CCCCC1(F)F	ZINC000450727983	CH	On-Demand	Anodyne	SLC12A5	43	36
CCCOc1c(OC)cc(CCNc2cc(CC)nc3ncnn23)cc1OC	ZINC000450727989	GG	On-Demand	Anodyne	DHOD	0	44
CO[C@@](C)(CNc1cc(C(F)(F)F)nc2ncnn12)c1ccccc1	ZINC000450728018	FG	On-Demand	Anodyne	DHOD	0	56
CO[C@](C)(CNc1cc(C(F)(F)F)nc2ncnn12)c1ccccc1	ZINC000450728019	FG	On-Demand	Anodyne	DHOD	0	56
CCc1cccc(C(=O)Nc2cc(F)c(OC)cc2C)n1	ZINC000450728020	CG	On-Demand	Anodyne	GRM4	22	43
CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO	ZINC000450728023	DE	On-Demand	Anodyne	MME	29	40
CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N[C@H](C)[C@H](C)CO	ZINC000450728025	DE	On-Demand	Anodyne	MME	29	40
CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N[C@@H](C)[C@H](C)CO	ZINC000450728027	DE	On-Demand	Anodyne	MME	29	40
CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N[C@H](C)[C@@H](C)CO	ZINC000450728029	DE	On-Demand	Anodyne	MME	29	40
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@@H](C)[C@H](C)CO	ZINC000450728038	ED	On-Demand	Anodyne	ACAT	0	42
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@H](C)[C@H](C)CO	ZINC000450728039	ED	On-Demand	Anodyne	ACAT	0	42
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO	ZINC000450728040	ED	On-Demand	Anodyne	ACAT	0	42
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N[C@H](C)[C@@H](C)CO	ZINC000450728041	ED	On-Demand	Anodyne	ACAT	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	ACE	45	48
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	OPRM1	32	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	OPRD1	29	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	MME	95	49
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	ANPEP	83	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	FCER2	74	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	TACR2	34	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	KLK3	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CTSB	46	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	PAPA1_CARPA	57	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CYSP_TRYCR	45	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CTSL	29	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CPA1	42	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	SLC15A1	0	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CTRB1	33	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CAPNS1	55	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	HLA-DRB1	45	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	PAM	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CAPN1	55	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CAPN2	46	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	ACE2	95	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	FPR1	52	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	CTRB_BOVIN	45	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	HDA106	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	SLC15A2	0	46
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	BLA1_STEMA	59	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	QRFPR	54	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	NPFFR1	49	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450728097	DC	On-Demand	Anodyne	VM1B1_BOTAS	0	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	ACE	45	48
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	OPRM1	32	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	OPRD1	29	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	MME	95	49
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	ANPEP	83	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	FCER2	74	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	TACR2	34	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	KLK3	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CTSB	46	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	PAPA1_CARPA	57	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CYSP_TRYCR	45	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CTSL	29	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CPA1	42	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	SLC15A1	0	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CTRB1	33	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CAPNS1	55	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	HLA-DRB1	45	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	PAM	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CAPN1	55	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CAPN2	46	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	ACE2	95	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	FPR1	52	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	CTRB_BOVIN	45	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	HDA106	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	SLC15A2	0	46
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	BLA1_STEMA	59	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	QRFPR	54	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	NPFFR1	49	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450728099	DC	On-Demand	Anodyne	VM1B1_BOTAS	0	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	ACE	45	48
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	OPRM1	32	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	OPRD1	29	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	MME	95	49
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	ANPEP	83	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	FCER2	74	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	TACR2	34	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	KLK3	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CTSB	46	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	PAPA1_CARPA	57	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CYSP_TRYCR	45	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CTSL	29	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CPA1	42	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	SLC15A1	0	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CTRB1	33	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CAPNS1	55	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	HLA-DRB1	45	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	PAM	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CAPN1	55	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CAPN2	46	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	ACE2	95	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	FPR1	52	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	CTRB_BOVIN	45	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	HDA106	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	SLC15A2	0	46
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	BLA1_STEMA	59	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	QRFPR	54	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	NPFFR1	49	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728100	DC	On-Demand	Anodyne	VM1B1_BOTAS	0	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	ACE	45	48
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	OPRM1	32	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	OPRD1	29	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	MME	95	49
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	ANPEP	83	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	FCER2	74	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	TACR2	34	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	KLK3	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CTSB	46	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	PAPA1_CARPA	57	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CYSP_TRYCR	45	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CTSL	29	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CPA1	42	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	SLC15A1	0	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CTRB1	33	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CAPNS1	55	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	HLA-DRB1	45	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	PAM	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CAPN1	55	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CAPN2	46	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	ACE2	95	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	FPR1	52	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	CTRB_BOVIN	45	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	HDA106	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	SLC15A2	0	46
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	BLA1_STEMA	59	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	QRFPR	54	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	NPFFR1	49	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450728101	DC	On-Demand	Anodyne	VM1B1_BOTAS	0	41
C=CC(C)(C)CNc1ccc(S(N)(=O)=O)cn1	ZINC000450728106	CD	On-Demand	Mild	CYNT	45	34
COc1ccc(CN(C)C(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450728107	DD	On-Demand	Anodyne	MT-ND1	25	43
COc1ccc(CN(C)C(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450728108	DD	On-Demand	Anodyne	MT-ND1	25	43
COc1ccc(CN(C)C(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450728109	DD	On-Demand	Anodyne	MT-ND1	25	43
COc1ccc(CN(C)C(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450728110	DD	On-Demand	Anodyne	MT-ND1	25	43
CCc1cccc(C(=O)Nc2onc(C(F)(F)F)c2CC)n1	ZINC000450728112	DG	On-Demand	Anodyne	ATF1	51	32
CCc1cccc(C(=O)Nc2onc(C(F)(F)F)c2CC)n1	ZINC000450728112	DG	On-Demand	Anodyne	NFKB1	47	32
FC(F)c1ccnc(NCC2CCCCCC2)n1	ZINC000450728119	CH	On-Demand	Anodyne	PKNB	21	44
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCCOC2)c1	ZINC000450728124	DE	On-Demand	Anodyne	MTNR1A	33	42
COc1cccc(OCCC(=O)N[C@@H](C)[C@H]2CCCOC2)c1	ZINC000450728124	DE	On-Demand	Anodyne	MTNR1B	33	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCCOC2)c1	ZINC000450728125	DE	On-Demand	Anodyne	MTNR1A	33	42
COc1cccc(OCCC(=O)N[C@H](C)[C@H]2CCCOC2)c1	ZINC000450728125	DE	On-Demand	Anodyne	MTNR1B	33	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCCOC2)c1	ZINC000450728126	DE	On-Demand	Anodyne	MTNR1A	33	42
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H]2CCCOC2)c1	ZINC000450728126	DE	On-Demand	Anodyne	MTNR1B	33	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCCOC2)c1	ZINC000450728127	DE	On-Demand	Anodyne	MTNR1A	33	42
COc1cccc(OCCC(=O)N[C@H](C)[C@@H]2CCCOC2)c1	ZINC000450728127	DE	On-Demand	Anodyne	MTNR1B	33	41
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccsn2)no1	ZINC000450728158	DG	On-Demand	Anodyne	CPT1A	44	38
COC(=O)Cn1ncc(NC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)c1C	ZINC000450728159	GG	On-Demand	Anodyne	PRCP	47	36
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccsn2)no1	ZINC000450728160	DG	On-Demand	Anodyne	CPT1A	44	38
COC(=O)Cn1ncc(NC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)c1C	ZINC000450728161	GG	On-Demand	Anodyne	PRCP	47	36
COC(=O)Cn1ncc(NC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)c1C	ZINC000450728164	GG	On-Demand	Anodyne	PRCP	47	36
COC(=O)Cn1ncc(NC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)c1C	ZINC000450728166	GG	On-Demand	Anodyne	PRCP	47	36
CS(=O)(=O)c1cc(S(N)(=O)=O)ccc1NCC1CCCCCC1	ZINC000450728179	FE	On-Demand	Anodyne	CA2	44	37
CS(=O)(=O)c1cc(S(N)(=O)=O)ccc1NCC1CCCCCC1	ZINC000450728179	FE	On-Demand	Anodyne	CA1	43	36
CCc1cc(NCCOc2ccc(Cl)c(F)c2)n2ncnc2n1	ZINC000450728194	EF	On-Demand	Anodyne	DHOD	0	49
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	MME	76	37
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	TIMP3	67	38
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	CAPNS1	51	33
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	CAPN1	44	35
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	CAPN2	56	32
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	ACE2	50	35
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	AMP1_PLAFQ	55	35
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	ACAT	0	44
CO[C@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728195	DG	On-Demand	Anodyne	SLC12A5	46	39
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	MME	76	37
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	TIMP3	67	38
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	CAPNS1	51	33
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	CAPN1	44	35
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	CAPN2	56	32
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	ACE2	50	35
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	AMP1_PLAFQ	55	35
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	ACAT	0	44
CO[C@@H](Cc1ccccc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728196	DG	On-Demand	Anodyne	SLC12A5	46	39
CCc1cccc(C(=O)N2CC[C@@H](C(=O)OC)C[C@@H]2C(=O)OC)n1	ZINC000450728198	ED	On-Demand	Anodyne	PTR1	51	36
CCc1cccc(C(=O)N2CC[C@H](C(=O)OC)C[C@H]2C(=O)OC)n1	ZINC000450728200	ED	On-Demand	Anodyne	PTR1	51	36
CCc1cccc(C(=O)N2CC[C@@H](C(=O)OC)C[C@H]2C(=O)OC)n1	ZINC000450728202	ED	On-Demand	Anodyne	PTR1	51	36
CCc1cccc(C(=O)N2CC[C@H](C(=O)OC)C[C@@H]2C(=O)OC)n1	ZINC000450728204	ED	On-Demand	Anodyne	PTR1	51	36
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cc2cccnc2s1	ZINC000450728224	FD	On-Demand	Anodyne	PREP	25	44
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cc2cccnc2s1	ZINC000450728224	FD	On-Demand	Anodyne	PTR1	45	33
COC(=O)[C@H]1CCN(C(=O)c2cc3cccnc3s2)[C@@H](C(=O)OC)C1	ZINC000450728227	FD	On-Demand	Anodyne	PREP	25	44
COC(=O)[C@H]1CCN(C(=O)c2cc3cccnc3s2)[C@@H](C(=O)OC)C1	ZINC000450728227	FD	On-Demand	Anodyne	PTR1	45	33
COC(=O)[C@H]1CCN(C(=O)c2cc3cccnc3s2)[C@H](C(=O)OC)C1	ZINC000450728229	FD	On-Demand	Anodyne	PREP	25	44
COC(=O)[C@H]1CCN(C(=O)c2cc3cccnc3s2)[C@H](C(=O)OC)C1	ZINC000450728229	FD	On-Demand	Anodyne	PTR1	45	33
COC(=O)[C@@H]1CCN(C(=O)c2cc3cccnc3s2)[C@@H](C(=O)OC)C1	ZINC000450728231	FD	On-Demand	Anodyne	PREP	25	44
COC(=O)[C@@H]1CCN(C(=O)c2cc3cccnc3s2)[C@@H](C(=O)OC)C1	ZINC000450728231	FD	On-Demand	Anodyne	PTR1	45	33
COCCOC[C@H](O)CNC(C)(C)c1cccs1	ZINC000450728245	CD	On-Demand	Anodyne	ADRB2	41	47
COCCOC[C@@H](O)CNC(C)(C)c1cccs1	ZINC000450728255	CD	On-Demand	Anodyne	ADRB2	41	47
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@H](C)[C@H](C)CO	ZINC000450728261	DF	On-Demand	Anodyne	ADRB2	26	49
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@H](C)[C@H](C)CO	ZINC000450728261	DF	On-Demand	Anodyne	VDR	62	51
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@@H](C)[C@H](C)CO	ZINC000450728267	DF	On-Demand	Anodyne	ADRB2	26	49
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@@H](C)[C@H](C)CO	ZINC000450728267	DF	On-Demand	Anodyne	VDR	62	51
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728269	DF	On-Demand	Anodyne	ADRB2	26	49
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@@H](C)[C@@H](C)CO	ZINC000450728269	DF	On-Demand	Anodyne	VDR	62	51
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@H](C)[C@@H](C)CO	ZINC000450728272	DF	On-Demand	Anodyne	ADRB2	26	49
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@H](C)[C@@H](C)CO	ZINC000450728272	DF	On-Demand	Anodyne	VDR	62	51
CCOCc1nc(C)c(C(=O)N[C@@H](c2ccc(F)cc2)c2cnn(C)c2)s1	ZINC000450728274	GG	On-Demand	Anodyne	SCD1	22	41
CCOCc1nc(C)c(C(=O)N[C@@H](c2ccc(F)cc2)c2cnn(C)c2)s1	ZINC000450728274	GG	On-Demand	Anodyne	SCD	20	41
CCOCc1nc(C)c(C(=O)N[C@H](c2ccc(F)cc2)c2cnn(C)c2)s1	ZINC000450728276	GG	On-Demand	Anodyne	SCD1	22	41
CCOCc1nc(C)c(C(=O)N[C@H](c2ccc(F)cc2)c2cnn(C)c2)s1	ZINC000450728276	GG	On-Demand	Anodyne	SCD	20	41
CC1(O)CC(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)C1	ZINC000450728283	EF	On-Demand	Anodyne	PRCP	45	37
CC1(O)CC(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)C1	ZINC000450728285	EF	On-Demand	Anodyne	PRCP	45	37
OCc1ccnc(NCC2CCCCCC2)n1	ZINC000450728315	BE	On-Demand	Anodyne	PKNB	16	42
COc1cc(C)c(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)cc1F	ZINC000450728341	GH	On-Demand	Anodyne	CA9	21	41
COc1cc(C)c(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)cc1F	ZINC000450728341	GH	On-Demand	Anodyne	RORC	55	33
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	F2	68	51
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	PLG	36	43
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	PRSS1	22	46
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	ACE	46	43
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	FKBP1A	48	43
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	OPRM1	27	41
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	OPRD1	24	41
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	ELANE	62	40
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	TACR1	29	43
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	CMA1	44	39
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	CTRA_BOVIN	46	32
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	XPNPEP1	0	41
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	TRY2_BOVIN	35	40
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	P2RX7	22	40
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	TRY1_BOVIN	82	51
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	DPP4	20	50
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	PREP	93	43
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	CELA2A	49	33
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	LGMN	55	42
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	PLAT	15	42
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	PEPD	0	41
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	XPNPEP2	0	41
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	ACE2	26	40
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	ST14	26	44
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	XIAP	69	52
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	BRCA1	67	38
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	TMPRSS11D	72	48
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	TMPRSS2	0	43
CC(C)c1cccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1	ZINC000450728349	FH	On-Demand	Anodyne	MLX	0	44
CC(C)c1cccc(CNC(=O)[C@H](C)Oc2ccccn2)c1	ZINC000450728365	CG	On-Demand	Anodyne	CARM1	46	39
CC(C)c1cccc(CNC(=O)[C@H](C)Oc2ccccn2)c1	ZINC000450728365	CG	On-Demand	Anodyne	PDS	41	32
CC(C)c1cccc(CNC(=O)[C@@H](C)Oc2ccccn2)c1	ZINC000450728366	CG	On-Demand	Anodyne	CARM1	46	39
CC(C)c1cccc(CNC(=O)[C@@H](C)Oc2ccccn2)c1	ZINC000450728366	CG	On-Demand	Anodyne	PDS	41	32
CC(C)(C)OC1CC(Sc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450728370	FG	On-Demand	Anodyne	GCK	42	30
CC(C)(C)OC1CC(Sc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450728370	FG	On-Demand	Anodyne	GCKR	49	32
C=CC(C)(C)CNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450728375	DH	On-Demand	Mild	AVPR2	45	38
CC(C)Cn1c(CCC(N)=O)nnc1SCCc1ccc(Cl)cc1	ZINC000450728381	FG	On-Demand	Anodyne	SLC5A2	33	41
CCc1c(C(F)(F)F)noc1NC(=O)c1ccc(C#N)o1	ZINC000450728392	CF	On-Demand	Mild	CSF1R	24	41
CC(C)c1cccc(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450728399	FH	On-Demand	Anodyne	PDE4D	15	42
CC(C)c1cccc(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450728399	FH	On-Demand	Anodyne	PDEC	0	42
CC(C)c1cccc(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450728400	FH	On-Demand	Anodyne	PDE4D	15	42
CC(C)c1cccc(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450728400	FH	On-Demand	Anodyne	PDEC	0	42
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	ADRB3	15	43
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	MME	84	38
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	CTSB	35	40
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	CYSP_TRYCR	50	41
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	CTSF	66	41
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	CTSL	31	41
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	SOAT1	0	41
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	CTSS	26	41
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	ACE2	62	36
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)c1ccc([C@@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728405	GG	On-Demand	Anodyne	POL	0	41
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	ADRB3	15	43
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	MME	84	38
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	CTSB	35	40
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	CYSP_TRYCR	50	41
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	CTSF	66	41
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	CTSL	31	41
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	SOAT1	0	41
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	CTSS	26	41
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	ACE2	62	36
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)c1ccc([C@@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728406	GG	On-Demand	Anodyne	POL	0	41
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	ADRB3	15	43
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	MME	84	38
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	CTSB	35	40
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	CYSP_TRYCR	50	41
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	CTSF	66	41
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	CTSL	31	41
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	SOAT1	0	41
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	CTSS	26	41
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	ACE2	62	36
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)c1ccc([C@H](NC(=O)[C@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728407	GG	On-Demand	Anodyne	POL	0	41
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	ADRB3	15	43
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	MME	84	38
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	CTSB	35	40
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	CYSP_TRYCR	50	41
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	CTSF	66	41
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	CTSL	31	41
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	SOAT1	0	41
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	CTSS	26	41
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	ACE2	62	36
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)c1ccc([C@H](NC(=O)[C@@H](Cc2ccccc2)OC)C(F)(F)F)cc1	ZINC000450728408	GG	On-Demand	Anodyne	POL	0	41
CCCOc1c(OC)cc(CCNc2cc(C)nc3ncnn23)cc1OC	ZINC000450728409	FF	On-Demand	Anodyne	DHOD	0	56
Cn1c(SC[C@@H]2COCCO2)nc2cc3ccccc3cc2c1=O	ZINC000450728430	EF	On-Demand	Bother	POLR1A	61	32
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN([C@H](C)c2ccccc2)CC1	ZINC000450728432	ED	On-Demand	Anodyne	PTAFR	43	47
C[C@H](CO)[C@H](C)NCC(=O)N1CCN([C@@H](C)c2ccccc2)CC1	ZINC000450728433	ED	On-Demand	Anodyne	PTAFR	43	47
C[C@H](CO)[C@H](C)NCC(=O)N1CCN([C@H](C)c2ccccc2)CC1	ZINC000450728434	ED	On-Demand	Anodyne	PTAFR	43	47
Cn1c(SC[C@H]2COCCO2)nc2cc3ccccc3cc2c1=O	ZINC000450728435	EF	On-Demand	Bother	POLR1A	61	32
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN([C@@H](C)c2ccccc2)CC1	ZINC000450728436	ED	On-Demand	Anodyne	PTAFR	43	47
CCC(=O)C1(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)CC1	ZINC000450728452	GI	On-Demand	Anodyne	RBP4	69	39
CCC(=O)C1(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)CC1	ZINC000450728452	GI	On-Demand	Anodyne	SCD1	28	41
CCC(=O)C1(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)CC1	ZINC000450728452	GI	On-Demand	Anodyne	SCD	27	41
Cn1c(SCCC2CCOCC2)nc2cc3ccccc3cc2c1=O	ZINC000450728453	FH	On-Demand	Bother	POLR1A	62	34
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)[C@H]1CCCO1	ZINC000450728489	FE	On-Demand	Anodyne	MTNR1A	54	38
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)[C@H]1CCCO1	ZINC000450728489	FE	On-Demand	Anodyne	MTNR1B	43	36
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)[C@H]1CCCO1	ZINC000450728490	FE	On-Demand	Anodyne	MTNR1A	54	38
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)[C@H]1CCCO1	ZINC000450728490	FE	On-Demand	Anodyne	MTNR1B	43	36
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)[C@@H]1CCCO1	ZINC000450728491	FE	On-Demand	Anodyne	MTNR1A	54	38
CC[C@H](NCCC(=O)NCc1ccc(OC)cc1OC)[C@@H]1CCCO1	ZINC000450728491	FE	On-Demand	Anodyne	MTNR1B	43	36
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)[C@@H]1CCCO1	ZINC000450728492	FE	On-Demand	Anodyne	MTNR1A	54	38
CC[C@@H](NCCC(=O)NCc1ccc(OC)cc1OC)[C@@H]1CCCO1	ZINC000450728492	FE	On-Demand	Anodyne	MTNR1B	43	36
Cc1nc([C@H]2CCCN2C(=O)Cc2cc(Br)ccc2C)cs1	ZINC000450728496	GI	On-Demand	Anodyne	COLA	58	41
Cc1nc([C@H]2CCCN2C(=O)Cc2cc(Br)ccc2C)cs1	ZINC000450728496	GI	On-Demand	Anodyne	CPT1A	56	41
CC(C)(C)OC1CC(Sc2ccc(S(=O)(=O)N3CCCCC3)cn2)C1	ZINC000450728499	GH	On-Demand	Anodyne	GCKR	48	31
COc1cc(C)c(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1F	ZINC000450728500	EH	On-Demand	Anodyne	HRH3	23	41
COc1cc(C)c(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1F	ZINC000450728500	EH	On-Demand	Anodyne	EPHX2	20	43
COc1cc(C)c(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1F	ZINC000450728501	EH	On-Demand	Anodyne	HRH3	23	41
COc1cc(C)c(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1F	ZINC000450728501	EH	On-Demand	Anodyne	EPHX2	20	43
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)ccc1Cl	ZINC000450728507	GJ	On-Demand	Anodyne	OPRK1	29	47
COc1cc(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)ccc1Cl	ZINC000450728507	GJ	On-Demand	Anodyne	CPT1A	92	42
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)ccc1Cl	ZINC000450728508	GJ	On-Demand	Anodyne	OPRK1	29	47
COc1cc(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)ccc1Cl	ZINC000450728508	GJ	On-Demand	Anodyne	CPT1A	92	42
C=CCNC(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)nc1	ZINC000450728528	EF	On-Demand	Mild	HCAR3	15	52
C=CCNC(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)nc1	ZINC000450728529	EF	On-Demand	Mild	HCAR3	15	52
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2Cc3cccc(C)c3O2)cs1	ZINC000450728530	EG	On-Demand	Anodyne	COLA	36	41
Cc1nc([C@H]2CCCN2C(=O)[C@H]2Cc3cccc(C)c3O2)cs1	ZINC000450728531	EG	On-Demand	Anodyne	COLA	36	41
CC[C@@H]1C[C@H]1CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450728540	DE	On-Demand	Anodyne	TGM2	37	42
CC[C@@H]1C[C@H]1CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450728540	DE	On-Demand	Anodyne	GCKR	51	33
Cc1cc(C(=O)NCc2cccc(C(C)C)c2)nn1C(C)C	ZINC000450728546	CH	On-Demand	Anodyne	MMP13	15	45
Cc1cc(C(=O)NCc2cccc(C(C)C)c2)nn1C(C)C	ZINC000450728546	CH	On-Demand	Anodyne	CARM1	47	36
Cc1cc(C(=O)NCc2cccc(C(C)C)c2)nn1C(C)C	ZINC000450728546	CH	On-Demand	Anodyne	PDS	23	40
CCc1c(C(F)(F)F)noc1NC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450728556	EE	On-Demand	Anodyne	ATF1	57	36
CCc1c(C(F)(F)F)noc1NC(=O)c1cc(C)c(C(N)=O)cn1	ZINC000450728556	EE	On-Demand	Anodyne	NFKB1	52	36
CCCCCN(CC(N)=O)C(=O)c1ccc(N2CCC2)nc1	ZINC000450728577	DD	On-Demand	Anodyne	PLM2_PLAFA	55	39
Cc1nc(NCCOc2ccc(Cl)c(F)c2)c2cnn(C)c2n1	ZINC000450728610	EF	On-Demand	Anodyne	Q9M629_MAIZE	59	36
O=C(Cc1cc2ccccc2s1)N1CCC(CCCN2CCOCC2)CC1	ZINC000450728629	GH	On-Demand	Anodyne	PRKDC	49	34
CCC(=O)C1(C(=O)NCc2cccc(C(C)C)c2)CC1	ZINC000450728638	CG	On-Demand	Anodyne	ACAT	0	40
Cc1nc(C2CC2)ccc1C(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450728651	FI	On-Demand	Anodyne	PRCP	46	33
Cc1nc(C2CC2)ccc1C(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450728652	FI	On-Demand	Anodyne	PRCP	46	33
Cn1cc(Br)c(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])n1	ZINC000450728686	GF	On-Demand	Bother	MAPK13	53	34
COCCNC(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)nc1	ZINC000450728689	EE	On-Demand	Anodyne	EPHX2	16	41
COCCNC(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)nc1	ZINC000450728690	EE	On-Demand	Anodyne	EPHX2	16	41
CN1CCC[C@H](C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1=O	ZINC000450728704	GG	On-Demand	Anodyne	RBP4	47	36
CN1CCC[C@H](C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1=O	ZINC000450728704	GG	On-Demand	Anodyne	SFRP1	76	34
CN1CCC[C@H](C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1=O	ZINC000450728704	GG	On-Demand	Anodyne	WNT3	72	34
CN1CCC[C@@H](C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1=O	ZINC000450728705	GG	On-Demand	Anodyne	RBP4	47	36
CN1CCC[C@@H](C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1=O	ZINC000450728705	GG	On-Demand	Anodyne	SFRP1	76	34
CN1CCC[C@@H](C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)C1=O	ZINC000450728705	GG	On-Demand	Anodyne	WNT3	72	34
Cc1cc(F)c(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)cc1F	ZINC000450728714	GI	On-Demand	Anodyne	COLA	87	43
Cc1cc(F)c(CC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)cc1F	ZINC000450728714	GI	On-Demand	Anodyne	CPT1A	85	43
Cc1cc(F)c(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)cc1F	ZINC000450728715	GI	On-Demand	Anodyne	COLA	87	43
Cc1cc(F)c(CC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)cc1F	ZINC000450728715	GI	On-Demand	Anodyne	CPT1A	85	43
COC(=O)c1coc(CN2C(=O)N[C@](C)(Cc3ccc4c(c3)OCO4)C2=O)n1	ZINC000450728735	GD	On-Demand	Anodyne	MCHR1	15	40
COC(=O)c1coc(CN2C(=O)N[C@@](C)(Cc3ccc4c(c3)OCO4)C2=O)n1	ZINC000450728736	GD	On-Demand	Anodyne	MCHR1	15	40
Cc1nc(C)n(CCCC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)n1	ZINC000450728737	FG	On-Demand	Anodyne	COLA	80	43
Cc1nc(C)n(CCCC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)n1	ZINC000450728737	FG	On-Demand	Anodyne	CPT1A	67	43
Cc1nc(C)n(CCCC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)n1	ZINC000450728738	FG	On-Demand	Anodyne	COLA	80	43
Cc1nc(C)n(CCCC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)n1	ZINC000450728738	FG	On-Demand	Anodyne	CPT1A	67	43
COC(=O)CCn1c(SCc2cn(CC3CC3)nn2)nc2ccccc2c1=O	ZINC000450728773	GE	On-Demand	Anodyne	TNKS	45	31
C[C@H](NCC(=O)NCCCc1ccccc1)[C@@H](C)CO	ZINC000450728790	CD	On-Demand	Anodyne	SDH1	0	45
C[C@H](CO)[C@H](C)NCC(=O)NCCCc1ccccc1	ZINC000450728791	CD	On-Demand	Anodyne	SDH1	0	45
C[C@@H](CO)[C@@H](C)NCC(=O)NCCCc1ccccc1	ZINC000450728792	CD	On-Demand	Anodyne	SDH1	0	45
C[C@H](CO)[C@@H](C)NCC(=O)NCCCc1ccccc1	ZINC000450728793	CD	On-Demand	Anodyne	SDH1	0	45
CCCOc1ccc(C(=O)Nc2onc(C(F)(F)F)c2CC)c(OC)c1	ZINC000450728798	FI	On-Demand	Anodyne	PPARG	15	40
CCCOc1ccc(C(=O)Nc2onc(C(F)(F)F)c2CC)c(OC)c1	ZINC000450728798	FI	On-Demand	Anodyne	PPARA	18	40
CCCOc1ccc(C(=O)Nc2onc(C(F)(F)F)c2CC)c(OC)c1	ZINC000450728798	FI	On-Demand	Anodyne	PPARD	22	40
C[C@H](CO)[C@@H](C)NCCOc1ccc(Cl)cc1Br	ZINC000450728799	EG	On-Demand	Anodyne	S1PR4	27	43
C[C@H](NCCOc1ccc(Cl)cc1Br)[C@@H](C)CO	ZINC000450728800	EG	On-Demand	Anodyne	S1PR4	27	43
C[C@@H](CO)[C@@H](C)NCCOc1ccc(Cl)cc1Br	ZINC000450728801	EG	On-Demand	Anodyne	S1PR4	27	43
C[C@H](CO)[C@H](C)NCCOc1ccc(Cl)cc1Br	ZINC000450728802	EG	On-Demand	Anodyne	S1PR4	27	43
OC[C@H]1CCCN1c1cc(NCCOc2ccc(Cl)c(F)c2)ncn1	ZINC000450728803	FF	On-Demand	Anodyne	PRCP	24	41
OC[C@@H]1CCCN1c1cc(NCCOc2ccc(Cl)c(F)c2)ncn1	ZINC000450728804	FF	On-Demand	Anodyne	PRCP	24	41
Cc1cccc(Cl)c1C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450728821	FH	On-Demand	Anodyne	CNR1	0	40
Cc1cccc(Cl)c1C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450728821	FH	On-Demand	Anodyne	CNR2	0	40
Cc1cccc(Cl)c1C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450728821	FH	On-Demand	Anodyne	CCR3	20	42
Cc1cccc(Cl)c1C(=O)N1CCC(CCCN2CCOCC2)CC1	ZINC000450728821	FH	On-Demand	Anodyne	CCR5	41	45
Cc1ccn(CC(=O)NC2(Cc3ccccc3)CC2)n1	ZINC000450728822	CE	On-Demand	Anodyne	SLC12A5	43	37
COC(=O)[C@@H]1CCN(C(=O)CCCC(=O)C2CC2)[C@@H](C(=O)OC)C1	ZINC000450728823	ED	On-Demand	Anodyne	PREP	15	40
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)CCCC(=O)C1CC1	ZINC000450728824	ED	On-Demand	Anodyne	PREP	15	40
COC(=O)[C@H]1CCN(C(=O)CCCC(=O)C2CC2)[C@@H](C(=O)OC)C1	ZINC000450728825	ED	On-Demand	Anodyne	PREP	15	40
COC(=O)[C@H]1CCN(C(=O)CCCC(=O)C2CC2)[C@H](C(=O)OC)C1	ZINC000450728826	ED	On-Demand	Anodyne	PREP	15	40
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728834	EH	On-Demand	Anodyne	TIMP3	55	38
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728834	EH	On-Demand	Anodyne	CAPNS1	46	30
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728834	EH	On-Demand	Anodyne	CAPN1	41	35
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728834	EH	On-Demand	Anodyne	CAPN2	46	35
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728834	EH	On-Demand	Anodyne	POL	0	41
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728834	EH	On-Demand	Anodyne	NPR	40	31
C[C@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728834	EH	On-Demand	Anodyne	SLC12A5	64	44
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728835	EH	On-Demand	Anodyne	TIMP3	55	38
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728835	EH	On-Demand	Anodyne	CAPNS1	46	30
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728835	EH	On-Demand	Anodyne	CAPN1	41	35
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728835	EH	On-Demand	Anodyne	CAPN2	46	35
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728835	EH	On-Demand	Anodyne	POL	0	41
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728835	EH	On-Demand	Anodyne	NPR	40	31
C[C@@H](OCc1ccc(F)cc1)C(=O)NC1(Cc2ccccc2)CC1	ZINC000450728835	EH	On-Demand	Anodyne	SLC12A5	64	44
CO[C@@](C)(CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)c1ccccc1	ZINC000450728849	GG	On-Demand	Anodyne	TGM2	29	42
CO[C@](C)(CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)c1ccccc1	ZINC000450728850	GG	On-Demand	Anodyne	TGM2	29	42
CCCc1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)no1	ZINC000450728851	EH	On-Demand	Anodyne	COLA	43	38
CCCc1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)no1	ZINC000450728851	EH	On-Demand	Anodyne	CPT1A	42	38
CCCc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)no1	ZINC000450728852	EH	On-Demand	Anodyne	COLA	43	38
CCCc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)no1	ZINC000450728852	EH	On-Demand	Anodyne	CPT1A	42	38
C[C@@H]1CCO[C@@H]1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450728878	FH	On-Demand	Anodyne	RBP4	58	38
C[C@@H]1CCO[C@@H]1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450728878	FH	On-Demand	Anodyne	SFRP1	71	32
C[C@@H]1CCO[C@@H]1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450728878	FH	On-Demand	Anodyne	SCD	26	40
C[C@@H]1CCO[C@@H]1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450728878	FH	On-Demand	Anodyne	WNT3	62	32
C=CC(C)(C)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450728887	FJ	On-Demand	Mild	RBP4	79	39
C=CC(C)(C)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450728887	FJ	On-Demand	Mild	SFRP1	68	34
C=CC(C)(C)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450728887	FJ	On-Demand	Mild	SCD	38	44
C=CC(C)(C)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450728887	FJ	On-Demand	Mild	WNT3	45	32
Cc1sccc1C(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1	ZINC000450728888	EI	On-Demand	Anodyne	CPT1A	56	39
Cc1sccc1C(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1	ZINC000450728889	EI	On-Demand	Anodyne	CPT1A	56	39
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)c1ccccc1	ZINC000450728890	GD	On-Demand	Anodyne	CA2	41	37
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)c1ccccc1	ZINC000450728890	GD	On-Demand	Anodyne	CA4	41	35
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)c1ccccc1	ZINC000450728890	GD	On-Demand	Anodyne	CA5A	41	37
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)c1ccccc1	ZINC000450728891	GD	On-Demand	Anodyne	CA2	41	37
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)c1ccccc1	ZINC000450728891	GD	On-Demand	Anodyne	CA4	41	35
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O)c1ccccc1	ZINC000450728891	GD	On-Demand	Anodyne	CA5A	41	37
Cc1cc(NC(=O)c2ccsc2Br)ccc1C1CC1	ZINC000450728900	EJ	On-Demand	Anodyne	KCNK3	41	35
CC[C@@H]1C[C@H]1CNc1cc(COC)nc2ncnn12	ZINC000450728933	CD	On-Demand	Anodyne	DHOD	0	41
CCn1c(SC[C@@H]2C[C@H]3CC[C@H]2O3)nc2cc3ccccc3cc2c1=O	ZINC000450728936	FI	On-Demand	Bother	POLR1A	61	34
CCn1c(SC[C@H]2C[C@H]3CC[C@H]2O3)nc2cc3ccccc3cc2c1=O	ZINC000450728937	FI	On-Demand	Bother	POLR1A	61	34
C[C@H](CO)[C@H](C)NCC(=O)NCCC(c1ccccc1)c1ccccc1	ZINC000450728954	FF	On-Demand	Anodyne	C3AR1	45	34
C[C@H](CO)[C@@H](C)NCC(=O)NCCC(c1ccccc1)c1ccccc1	ZINC000450728955	FF	On-Demand	Anodyne	C3AR1	45	34
C[C@H](NCC(=O)NCCC(c1ccccc1)c1ccccc1)[C@@H](C)CO	ZINC000450728956	FF	On-Demand	Anodyne	C3AR1	45	34
C[C@@H](CO)[C@@H](C)NCC(=O)NCCC(c1ccccc1)c1ccccc1	ZINC000450728957	FF	On-Demand	Anodyne	C3AR1	45	34
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@H](C)CO)[C@H](c3ccco3)C2)cc1	ZINC000450728963	GF	On-Demand	Anodyne	EGFR	0	40
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@H](C)CO)[C@H](c3ccco3)C2)cc1	ZINC000450728963	GF	On-Demand	Anodyne	MAOB	0	49
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@H](C)CO)[C@H](c3ccco3)C2)cc1	ZINC000450728963	GF	On-Demand	Anodyne	ERBB2	0	40
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@@H](C)CO)[C@H](c3ccco3)C2)cc1	ZINC000450728964	GF	On-Demand	Anodyne	EGFR	0	40
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@@H](C)CO)[C@H](c3ccco3)C2)cc1	ZINC000450728964	GF	On-Demand	Anodyne	MAOB	0	49
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@@H](C)CO)[C@H](c3ccco3)C2)cc1	ZINC000450728964	GF	On-Demand	Anodyne	ERBB2	0	40
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@@H](C)CO)[C@@H](c3ccco3)C2)cc1	ZINC000450728965	GF	On-Demand	Anodyne	EGFR	0	40
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@@H](C)CO)[C@@H](c3ccco3)C2)cc1	ZINC000450728965	GF	On-Demand	Anodyne	MAOB	0	49
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@@H](C)CO)[C@@H](c3ccco3)C2)cc1	ZINC000450728965	GF	On-Demand	Anodyne	ERBB2	0	40
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@H](C)CO)[C@@H](c3ccco3)C2)cc1	ZINC000450728966	GF	On-Demand	Anodyne	EGFR	0	40
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@H](C)CO)[C@@H](c3ccco3)C2)cc1	ZINC000450728966	GF	On-Demand	Anodyne	MAOB	0	49
COc1ccc(C2=NN(C(=O)CN[C@H](C)[C@H](C)CO)[C@@H](c3ccco3)C2)cc1	ZINC000450728966	GF	On-Demand	Anodyne	ERBB2	0	40
O=C(NCCO)c1ccc(NCCOc2ccc(Cl)c(F)c2)nn1	ZINC000450728971	FC	On-Demand	Anodyne	ALPL	42	38
COC(=O)Cn1ncc(NC(=O)CCc2ccc3ccccc3c2O)c1C	ZINC000450728981	FF	On-Demand	Anodyne	HCAR2	15	40
CCc1c(C(F)(F)F)noc1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450728983	FH	On-Demand	Anodyne	ATF1	51	32
CCc1c(C(F)(F)F)noc1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450728983	FH	On-Demand	Anodyne	NFKB1	47	32
CC(=O)c1cccc(CSc2ccc(S(=O)(=O)N3CCCC3)cn2)c1	ZINC000450728986	GG	On-Demand	Anodyne	AKR1C3	45	33
COC(=O)[C@@H]1CCN(C(=O)c2ccc3cnccc3c2)[C@@H](C(=O)OC)C1	ZINC000450728989	FD	On-Demand	Anodyne	PREP	27	48
COC(=O)[C@@H]1CCN(C(=O)c2ccc3cnccc3c2)[C@@H](C(=O)OC)C1	ZINC000450728989	FD	On-Demand	Anodyne	PTR1	49	35
COC(=O)[C@H]1CCN(C(=O)c2ccc3cnccc3c2)[C@@H](C(=O)OC)C1	ZINC000450728990	FD	On-Demand	Anodyne	PREP	27	48
COC(=O)[C@H]1CCN(C(=O)c2ccc3cnccc3c2)[C@@H](C(=O)OC)C1	ZINC000450728990	FD	On-Demand	Anodyne	PTR1	49	35
COC(=O)[C@H]1CCN(C(=O)c2ccc3cnccc3c2)[C@H](C(=O)OC)C1	ZINC000450728991	FD	On-Demand	Anodyne	PREP	27	48
COC(=O)[C@H]1CCN(C(=O)c2ccc3cnccc3c2)[C@H](C(=O)OC)C1	ZINC000450728991	FD	On-Demand	Anodyne	PTR1	49	35
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc2cnccc2c1	ZINC000450728992	FD	On-Demand	Anodyne	PREP	27	48
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc2cnccc2c1	ZINC000450728992	FD	On-Demand	Anodyne	PTR1	49	35
CO[C@@](C)(CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1)c1ccccc1	ZINC000450729023	FE	On-Demand	Bother	CA2	18	41
CO[C@@](C)(CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1)c1ccccc1	ZINC000450729023	FE	On-Demand	Bother	CYNT	40	35
CO[C@](C)(CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1)c1ccccc1	ZINC000450729024	FE	On-Demand	Bother	CA2	18	41
CO[C@](C)(CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1)c1ccccc1	ZINC000450729024	FE	On-Demand	Bother	CYNT	40	35
COc1cccc2c(NC[C@@H]3CC34CCOCC4)cc(C)nc12	ZINC000450729051	DH	On-Demand	Anodyne	BDKRB2	58	34
COc1cccc2c(NC[C@H]3CC34CCOCC4)cc(C)nc12	ZINC000450729053	DH	On-Demand	Anodyne	BDKRB2	58	34
CCc1cccc(C(=O)Nc2cnn(CC(=O)OC)c2C)n1	ZINC000450729056	DD	On-Demand	Anodyne	SHH	40	31
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729059	EH	On-Demand	Anodyne	SLC6A1	70	33
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729059	EH	On-Demand	Anodyne	ADAM17	0	44
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729059	EH	On-Demand	Anodyne	COLA	81	49
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729059	EH	On-Demand	Anodyne	CPT1A	78	42
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729059	EH	On-Demand	Anodyne	PREP	47	32
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729063	EH	On-Demand	Anodyne	SLC6A1	70	33
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729063	EH	On-Demand	Anodyne	ADAM17	0	44
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729063	EH	On-Demand	Anodyne	COLA	81	49
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729063	EH	On-Demand	Anodyne	CPT1A	78	42
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450729063	EH	On-Demand	Anodyne	PREP	47	32
O=C(Cc1ccccc1O[C@H]1CCOC1)NC1(Cc2ccccc2)CC1	ZINC000450729072	FG	On-Demand	Anodyne	PDE4D	15	45
O=C(Cc1ccccc1O[C@H]1CCOC1)NC1(Cc2ccccc2)CC1	ZINC000450729072	FG	On-Demand	Anodyne	PDEC	0	45
O=C(Cc1ccccc1O[C@@H]1CCOC1)NC1(Cc2ccccc2)CC1	ZINC000450729073	FG	On-Demand	Anodyne	PDE4D	15	45
O=C(Cc1ccccc1O[C@@H]1CCOC1)NC1(Cc2ccccc2)CC1	ZINC000450729073	FG	On-Demand	Anodyne	PDEC	0	45
C=CC(C)(C)CNc1ncnc2c1ncn2C1CC1	ZINC000450729078	CF	On-Demand	Mild	ADORA1	44	46
C=CC(C)(C)CNc1ncnc2c1ncn2C1CC1	ZINC000450729078	CF	On-Demand	Mild	ADORA2A	0	47
C=CC(C)(C)CNc1ncnc2c1ncn2C1CC1	ZINC000450729078	CF	On-Demand	Mild	ADORA3	54	37
COC(=O)c1ccc(OCCCCCC(C)=O)c([N+](=O)[O-])c1	ZINC000450729095	DF	On-Demand	Bother	THRA	31	55
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccc(C#N)n2C)no1	ZINC000450729098	EG	On-Demand	Mild	COLA	36	40
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccc(C#N)n2C)no1	ZINC000450729098	EG	On-Demand	Mild	CPT1A	25	40
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccc(C#N)n2C)no1	ZINC000450729099	EG	On-Demand	Mild	COLA	36	40
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccc(C#N)n2C)no1	ZINC000450729099	EG	On-Demand	Mild	CPT1A	25	40
O=C([C@H](O)C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450729112	FG	On-Demand	Anodyne	COLA	63	47
O=C([C@H](O)C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450729112	FG	On-Demand	Anodyne	CPT1A	49	44
O=C([C@H](O)C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450729113	FG	On-Demand	Anodyne	COLA	63	47
O=C([C@H](O)C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450729113	FG	On-Demand	Anodyne	CPT1A	49	44
O=C([C@@H](O)C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450729114	FG	On-Demand	Anodyne	COLA	63	47
O=C([C@@H](O)C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450729114	FG	On-Demand	Anodyne	CPT1A	49	44
O=C([C@@H](O)C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450729115	FG	On-Demand	Anodyne	COLA	63	47
O=C([C@@H](O)C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000450729115	FG	On-Demand	Anodyne	CPT1A	49	44
CC(C)Cn1cc(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2)c(C(F)F)n1	ZINC000450729116	GJ	On-Demand	Anodyne	MAPK10	15	42
CO[C@](C)(CNc1ccc(C(=O)N2CCC(C)CC2)cn1)c1ccccc1	ZINC000450729117	FH	On-Demand	Anodyne	BDKRB1	23	41
CO[C@@](C)(CNc1ccc(C(=O)N2CCC(C)CC2)cn1)c1ccccc1	ZINC000450729118	FH	On-Demand	Anodyne	BDKRB1	23	41
c1ccc(COc2cccnc2NC[C@@H]2CC23CCOCC3)cc1	ZINC000450729123	DH	On-Demand	Anodyne	PPIA	43	43
c1ccc(COc2cccnc2NC[C@H]2CC23CCOCC3)cc1	ZINC000450729124	DH	On-Demand	Anodyne	PPIA	36	43
Cc1ccn(CC(=O)Nc2ccc(C3CC3)c(C)c2)n1	ZINC000450729125	CG	On-Demand	Anodyne	DRD4	15	47
COc1cc(C)c(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)cc1F	ZINC000450729137	GH	On-Demand	Anodyne	STK17B	40	35
COc1cc(C)c(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)cc1F	ZINC000450729138	GH	On-Demand	Anodyne	STK17B	40	35
COCc1cc(NCC2CCCCCC2)n2ncnc2n1	ZINC000450729142	CF	On-Demand	Anodyne	DHOD	0	41
COC(=O)Cn1ncc(NC(=O)c2cc(OC)ccc2OC(F)(F)F)c1C	ZINC000450729143	GF	On-Demand	Anodyne	SHH	43	36
COC(=O)Cn1ncc(NC(=O)c2cc(OC)ccc2OC(F)(F)F)c1C	ZINC000450729143	GF	On-Demand	Anodyne	AKR1C2	45	34
O=C(NC1(Cc2ccccc2)CC1)c1cc2n(n1)CCCC2	ZINC000450729144	CF	On-Demand	Anodyne	SLC12A5	45	33
CC(C)c1cccc(CNC(=O)[C@@H]2CCCN(C)C2=O)c1	ZINC000450729146	CE	On-Demand	Anodyne	TMPRSS11D	46	33
CC(C)c1cccc(CNC(=O)[C@H]2CCCN(C)C2=O)c1	ZINC000450729147	CE	On-Demand	Anodyne	TMPRSS11D	46	33
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450729148	GC	On-Demand	Anodyne	CA2	57	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450729148	GC	On-Demand	Anodyne	CA1	46	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450729148	GC	On-Demand	Anodyne	CA4	69	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450729148	GC	On-Demand	Anodyne	CA5A	43	38
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450729149	GC	On-Demand	Anodyne	CA2	57	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450729149	GC	On-Demand	Anodyne	CA1	46	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450729149	GC	On-Demand	Anodyne	CA4	69	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450729149	GC	On-Demand	Anodyne	CA5A	43	38
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450729150	GC	On-Demand	Anodyne	CA2	57	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450729150	GC	On-Demand	Anodyne	CA1	46	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450729150	GC	On-Demand	Anodyne	CA4	69	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450729150	GC	On-Demand	Anodyne	CA5A	43	38
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450729151	GC	On-Demand	Anodyne	CA2	57	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450729151	GC	On-Demand	Anodyne	CA1	46	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450729151	GC	On-Demand	Anodyne	CA4	69	46
CCN(CC)c1ccc(S(N)(=O)=O)cc1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450729151	GC	On-Demand	Anodyne	CA5A	43	38
COC(=O)c1ccc([C@H](NC(=O)Cc2ccc(O)c(OC)c2)C(F)(F)F)cc1	ZINC000450729152	GG	On-Demand	Anodyne	TRPV1	46	47
COC(=O)c1ccc([C@H](NC(=O)Cc2ccc(O)c(OC)c2)C(F)(F)F)cc1	ZINC000450729152	GG	On-Demand	Anodyne	NCE103	19	40
COC(=O)c1ccc([C@H](NC(=O)Cc2ccc(O)c(OC)c2)C(F)(F)F)cc1	ZINC000450729152	GG	On-Demand	Anodyne	CAN2	0	40
COC(=O)c1ccc([C@@H](NC(=O)Cc2ccc(O)c(OC)c2)C(F)(F)F)cc1	ZINC000450729153	GG	On-Demand	Anodyne	TRPV1	46	47
COC(=O)c1ccc([C@@H](NC(=O)Cc2ccc(O)c(OC)c2)C(F)(F)F)cc1	ZINC000450729153	GG	On-Demand	Anodyne	NCE103	19	40
COC(=O)c1ccc([C@@H](NC(=O)Cc2ccc(O)c(OC)c2)C(F)(F)F)cc1	ZINC000450729153	GG	On-Demand	Anodyne	CAN2	0	40
CC(C)c1cccc(CNC(=O)C2(C(F)(F)F)CCC2)c1	ZINC000450729178	CI	On-Demand	Anodyne	SDH1	0	41
COC(=O)c1csc(CSc2nnc(-c3cccs3)n2C2CC2)n1	ZINC000450729179	GH	On-Demand	Anodyne	LRRK2	0	42
COc1ccc(C(=O)NCc2cccc(C(C)C)c2)cc1S(C)(=O)=O	ZINC000450729181	FG	On-Demand	Anodyne	CPT1A	45	31
COc1ccc(C(=O)NCc2cccc(C(C)C)c2)cc1S(C)(=O)=O	ZINC000450729181	FG	On-Demand	Anodyne	PPARD	16	40
COc1ccc(C(=O)NCc2cccc(C(C)C)c2)cc1S(C)(=O)=O	ZINC000450729181	FG	On-Demand	Anodyne	MT-ND1	24	44
O=C(NC1(Cc2ccccc2)CC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450729211	DG	On-Demand	Anodyne	SLC12A5	46	36
O=C(NC1(Cc2ccccc2)CC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450729212	DG	On-Demand	Anodyne	SLC12A5	46	36
CCOC(=O)c1cc(C(=O)NCc2cccc(C(C)C)c2)on1	ZINC000450729217	DF	On-Demand	Anodyne	PDS	31	40
COc1ccc(CNC(=O)CCN[C@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450729223	ED	On-Demand	Anodyne	PDGFRB	33	47
COc1ccc(CNC(=O)CCN[C@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450729223	ED	On-Demand	Anodyne	MTNR1A	56	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450729223	ED	On-Demand	Anodyne	MTNR1B	33	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450729224	ED	On-Demand	Anodyne	PDGFRB	33	47
COc1ccc(CNC(=O)CCN[C@@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450729224	ED	On-Demand	Anodyne	MTNR1A	56	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cnn(C)c2)c(OC)c1	ZINC000450729224	ED	On-Demand	Anodyne	MTNR1B	33	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C1CCC1	ZINC000450729229	EE	On-Demand	Anodyne	CA2	46	50
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C1CCC1	ZINC000450729229	EE	On-Demand	Anodyne	CA1	41	38
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C1CCC1	ZINC000450729229	EE	On-Demand	Anodyne	CA7	42	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C1CCC1	ZINC000450729229	EE	On-Demand	Anodyne	CA4	42	37
Cc1cc(NC(=O)c2ccsn2)ccc1C1CC1	ZINC000450729243	CH	On-Demand	Anodyne	TYK2	50	34
Cc1cc(NC(=O)c2ccsn2)ccc1C1CC1	ZINC000450729243	CH	On-Demand	Anodyne	KCNK3	48	33
COc1cc(C(=O)Nc2ccc(C3CC3)c(C)c2)c([N+](=O)[O-])cc1F	ZINC000450729262	EI	On-Demand	Bother	TAAR1	22	42
COc1cc(C(=O)Nc2ccc(C3CC3)c(C)c2)c([N+](=O)[O-])cc1F	ZINC000450729262	EI	On-Demand	Bother	KCNK9	41	37
COc1cc(C)c(NC(=O)c2ccc(C(C)(F)F)nc2)cc1F	ZINC000450729268	DH	On-Demand	Anodyne	SMO	24	40
CCn1c(SCc2nnc(C(C)C)s2)nc2cc3ccccc3cc2c1=O	ZINC000450729300	GJ	On-Demand	Bother	POLR1A	52	35
COc1ccc(CNC(=O)CCN[C@H](c2ncc(C)s2)C2CC2)c(OC)c1	ZINC000450729301	GG	On-Demand	Anodyne	PDGFRB	25	44
COc1ccc(CNC(=O)CCN[C@@H](c2ncc(C)s2)C2CC2)c(OC)c1	ZINC000450729302	GG	On-Demand	Anodyne	PDGFRB	25	44
CCCc1cc(NC[C@@H]2C[C@H]2CC)n2ncnc2n1	ZINC000450729340	CF	On-Demand	Anodyne	DHOD	0	43
CC(C)C[C@@H](CO)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450729344	DF	On-Demand	Anodyne	KLK3	40	31
CC(C)C[C@H](CO)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450729345	DF	On-Demand	Anodyne	KLK3	40	31
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(C(C)C)c1	ZINC000450729346	DI	On-Demand	Anodyne	CARM1	56	39
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(C(C)C)c1	ZINC000450729346	DI	On-Demand	Anodyne	PDS	67	43
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(C(C)C)c1	ZINC000450729347	DI	On-Demand	Anodyne	CARM1	53	39
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(C(C)C)c1	ZINC000450729347	DI	On-Demand	Anodyne	PDS	61	36
NS(=O)(=O)c1ccc(NCC2CCCCCC2)c([N+](=O)[O-])c1	ZINC000450729348	EF	On-Demand	Bother	CA2	28	42
C=CC(C)(C)CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450729350	DE	On-Demand	Mild	NPY2R	70	36
CCCOc1c(OC)cc(CCNc2ccc(C(N)=O)nn2)cc1OC	ZINC000450729367	FD	On-Demand	Anodyne	PTGDR	15	40
CCc1c(C(F)(F)F)noc1NC(=O)c1cccc(SC)c1	ZINC000450729372	EI	On-Demand	Anodyne	KCNK3	43	34
COC(=O)[C@@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)[C@@H](C(=O)OC)C1	ZINC000450729382	FD	On-Demand	Anodyne	PREP	18	44
COC(=O)[C@@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)[C@@H](C(=O)OC)C1	ZINC000450729382	FD	On-Demand	Anodyne	PTR1	46	34
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450729383	FD	On-Demand	Anodyne	PREP	18	44
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccnc(OC(F)F)c1	ZINC000450729383	FD	On-Demand	Anodyne	PTR1	46	34
COC(=O)[C@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)[C@H](C(=O)OC)C1	ZINC000450729384	FD	On-Demand	Anodyne	PREP	18	44
COC(=O)[C@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)[C@H](C(=O)OC)C1	ZINC000450729384	FD	On-Demand	Anodyne	PTR1	46	34
COC(=O)[C@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)[C@@H](C(=O)OC)C1	ZINC000450729385	FD	On-Demand	Anodyne	PREP	18	44
COC(=O)[C@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)[C@@H](C(=O)OC)C1	ZINC000450729385	FD	On-Demand	Anodyne	PTR1	46	34
C[C@H](NCC(=O)N1CCN(c2cccc(Cl)c2)CC1)[C@@H](C)CO	ZINC000450729386	ED	On-Demand	Anodyne	HTR1A	24	47
C[C@H](NCC(=O)N1CCN(c2cccc(Cl)c2)CC1)[C@@H](C)CO	ZINC000450729386	ED	On-Demand	Anodyne	IGF1R	35	40
C[C@H](NCC(=O)N1CCN(c2cccc(Cl)c2)CC1)[C@@H](C)CO	ZINC000450729386	ED	On-Demand	Anodyne	MAPK1	0	45
C[C@H](NCC(=O)N1CCN(c2cccc(Cl)c2)CC1)[C@@H](C)CO	ZINC000450729386	ED	On-Demand	Anodyne	CYP3A4	40	35
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729387	ED	On-Demand	Anodyne	HTR1A	24	47
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729387	ED	On-Demand	Anodyne	IGF1R	35	40
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729387	ED	On-Demand	Anodyne	MAPK1	0	45
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729387	ED	On-Demand	Anodyne	CYP3A4	40	35
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729388	ED	On-Demand	Anodyne	HTR1A	24	47
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729388	ED	On-Demand	Anodyne	IGF1R	35	40
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729388	ED	On-Demand	Anodyne	MAPK1	0	45
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729388	ED	On-Demand	Anodyne	CYP3A4	40	35
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729389	ED	On-Demand	Anodyne	HTR1A	24	47
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729389	ED	On-Demand	Anodyne	IGF1R	35	40
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729389	ED	On-Demand	Anodyne	MAPK1	0	45
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450729389	ED	On-Demand	Anodyne	CYP3A4	40	35
COc1ccc(CC(=O)NC2(Cc3ccccc3)CC2)c(Cl)c1OC	ZINC000450729402	FH	On-Demand	Anodyne	TSHR	41	31
COc1ccc(CC(=O)NC2(Cc3ccccc3)CC2)c(Cl)c1OC	ZINC000450729402	FH	On-Demand	Anodyne	PTGER4	24	44
COC(=O)c1coc(CSc2nnc(-c3cccs3)n2C2CC2)n1	ZINC000450729407	FG	On-Demand	Anodyne	LRRK2	0	41
CCCOc1c(OC)cc(CCNc2cccc(C#N)n2)cc1OC	ZINC000450729440	EG	On-Demand	Mild	PTGDR	29	41
COC(=O)[C@@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)[C@@H](C(=O)OC)C1	ZINC000450729441	FD	On-Demand	Anodyne	SLC6A1	46	39
COC(=O)[C@@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)[C@@H](C(=O)OC)C1	ZINC000450729441	FD	On-Demand	Anodyne	PREP	31	40
COC(=O)[C@@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)[C@@H](C(=O)OC)C1	ZINC000450729441	FD	On-Demand	Anodyne	MMP2	0	43
CC[C@@H]1C[C@H]1CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450729451	FE	On-Demand	Bother	DDIT3	0	40
CCOc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)on1	ZINC000450729458	EG	On-Demand	Anodyne	COLA	88	41
CCOc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)on1	ZINC000450729458	EG	On-Demand	Anodyne	CPT1A	65	41
CCOc1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)on1	ZINC000450729459	EG	On-Demand	Anodyne	COLA	88	41
CCOc1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)on1	ZINC000450729459	EG	On-Demand	Anodyne	CPT1A	65	41
Cc1ccn2ncc(C(=O)N3CCO[C@@H](c4ccc(F)cc4Cl)C3)c2c1	ZINC000450729476	FH	On-Demand	Anodyne	PRCP	43	32
Cc1ccn2ncc(C(=O)N3CCO[C@@H](c4ccc(F)cc4Cl)C3)c2c1	ZINC000450729476	FH	On-Demand	Anodyne	EPHB3	26	42
Cc1ccn2ncc(C(=O)N3CCO[C@H](c4ccc(F)cc4Cl)C3)c2c1	ZINC000450729477	FH	On-Demand	Anodyne	PRCP	43	32
Cc1ccn2ncc(C(=O)N3CCO[C@H](c4ccc(F)cc4Cl)C3)c2c1	ZINC000450729477	FH	On-Demand	Anodyne	EPHB3	26	42
COc1cc(C)c(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)cc1F	ZINC000450729480	GI	On-Demand	Anodyne	PDE4D	15	43
COc1cc(C)c(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)cc1F	ZINC000450729480	GI	On-Demand	Anodyne	PDEC	0	40
Cc1csc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450729483	EI	On-Demand	Anodyne	COLA	52	39
Cc1csc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1	ZINC000450729483	EI	On-Demand	Anodyne	CPT1A	51	39
Cc1csc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450729484	EI	On-Demand	Anodyne	COLA	52	39
Cc1csc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1	ZINC000450729484	EI	On-Demand	Anodyne	CPT1A	51	39
C[C@@H](O)CCCSc1nc2cc3ccccc3cc2c(=O)n1C	ZINC000450729505	EG	On-Demand	Bother	POLR1A	73	36
C[C@H](O)CCCSc1nc2cc3ccccc3cc2c(=O)n1C	ZINC000450729506	EG	On-Demand	Bother	POLR1A	73	36
Cn1cc(Br)c(CNc2cc(C(F)(F)F)nc3ncnn23)n1	ZINC000450729507	GE	On-Demand	Anodyne	DHOD	0	51
COC(=O)[C@@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)[C@@H](C(=O)OC)C1	ZINC000450729542	FD	On-Demand	Anodyne	SLC6A1	46	39
COC(=O)[C@@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)[C@@H](C(=O)OC)C1	ZINC000450729542	FD	On-Demand	Anodyne	PREP	31	40
COC(=O)[C@@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)[C@@H](C(=O)OC)C1	ZINC000450729542	FD	On-Demand	Anodyne	MMP2	0	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450729543	FD	On-Demand	Anodyne	SLC6A1	46	39
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450729543	FD	On-Demand	Anodyne	PREP	31	40
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450729543	FD	On-Demand	Anodyne	MMP2	0	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450729544	FD	On-Demand	Anodyne	SLC6A1	46	39
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450729544	FD	On-Demand	Anodyne	PREP	31	40
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450729544	FD	On-Demand	Anodyne	MMP2	0	43
CCc1cccc(OCCN[C@H](C)[C@H](C)CO)c1	ZINC000450729555	CE	On-Demand	Anodyne	HRH2	21	40
CCc1cccc(OCCN[C@@H](C)[C@H](C)CO)c1	ZINC000450729556	CE	On-Demand	Anodyne	HRH2	21	40
CCc1cccc(OCCN[C@H](C)[C@@H](C)CO)c1	ZINC000450729557	CE	On-Demand	Anodyne	HRH2	21	40
CCc1cccc(OCCN[C@@H](C)[C@@H](C)CO)c1	ZINC000450729558	CE	On-Demand	Anodyne	HRH2	21	40
CC(C)c1ccccc1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450729560	CE	On-Demand	Anodyne	ACAT	0	50
CC(C)c1ccccc1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450729561	CE	On-Demand	Anodyne	ACAT	0	50
CC(C)c1ccccc1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450729562	CE	On-Demand	Anodyne	ACAT	0	50
CC(C)c1ccccc1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450729563	CE	On-Demand	Anodyne	ACAT	0	50
C[C@H](CO)[C@@H](C)NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1	ZINC000450729564	GG	On-Demand	Anodyne	TERT	23	40
C[C@H](CO)[C@@H](C)NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1	ZINC000450729565	GG	On-Demand	Anodyne	TERT	23	40
C[C@H](CO)[C@H](C)NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1	ZINC000450729566	GG	On-Demand	Anodyne	TERT	23	40
C[C@H](CO)[C@H](C)NCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1	ZINC000450729567	GG	On-Demand	Anodyne	TERT	23	40
CC(C)c1cccc(CNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)c1	ZINC000450729569	FE	On-Demand	Anodyne	UL54	59	34
O=C(CCc1ccc2ccccc2c1O)NC1(Cc2ccccc2)CC1	ZINC000450729593	EI	On-Demand	Anodyne	ALOX5	17	46
CCc1c(C(F)(F)F)noc1NC(=O)c1ccc(C)c(Cl)c1Cl	ZINC000450729595	FK	On-Demand	Anodyne	ATF1	54	33
CCc1c(C(F)(F)F)noc1NC(=O)c1ccc(C)c(Cl)c1Cl	ZINC000450729595	FK	On-Demand	Anodyne	NFKB1	50	33
Cc1nnnn1-c1ccc(C(=O)NCc2cccc(C(C)C)c2)c(F)c1	ZINC000450729598	FG	On-Demand	Anodyne	CARM1	57	35
C=CC(C)(C)CNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450729599	DH	On-Demand	Mild	L3MBTL3	47	33
CC(C)c1cccc(CNC(=O)c2cc3n(n2)CCCC3)c1	ZINC000450729610	CG	On-Demand	Anodyne	MMP13	26	40
C[C@H](CO)[C@H](C)N[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729613	FE	On-Demand	Anodyne	EDNRA	30	40
C[C@H](CO)[C@H](C)N[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729613	FE	On-Demand	Anodyne	BMP1	52	39
C[C@H](CO)[C@H](C)N[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729613	FE	On-Demand	Anodyne	NOS2	82	34
C[C@H](CO)[C@H](C)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729614	FE	On-Demand	Anodyne	EDNRA	30	40
C[C@H](CO)[C@H](C)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729614	FE	On-Demand	Anodyne	BMP1	52	39
C[C@H](CO)[C@H](C)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729614	FE	On-Demand	Anodyne	NOS2	82	34
C[C@H](CO)[C@@H](C)N[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729615	FE	On-Demand	Anodyne	EDNRA	30	40
C[C@H](CO)[C@@H](C)N[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729615	FE	On-Demand	Anodyne	BMP1	52	39
C[C@H](CO)[C@@H](C)N[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729615	FE	On-Demand	Anodyne	NOS2	82	34
C[C@H](CO)[C@@H](C)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729616	FE	On-Demand	Anodyne	EDNRA	30	40
C[C@H](CO)[C@@H](C)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729616	FE	On-Demand	Anodyne	BMP1	52	39
C[C@H](CO)[C@@H](C)N[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000450729616	FE	On-Demand	Anodyne	NOS2	82	34
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000450729628	FG	On-Demand	Anodyne	PRCP	23	43
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000450729629	FG	On-Demand	Anodyne	PRCP	23	43
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000450729630	FG	On-Demand	Anodyne	PRCP	23	43
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000450729631	FG	On-Demand	Anodyne	PRCP	23	43
Cc1nc([C@H]2CCCN2C(=O)C(CC(C)C)CC(C)C)cs1	ZINC000450729671	DJ	On-Demand	Anodyne	ADAM17	31	49
Cc1ccc(OCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450729685	BG	On-Demand	Bother	S1PR4	0	60
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@](C)(OC)c1ccccc1	ZINC000450729689	EF	On-Demand	Bother	F2RL3	46	33
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@](C)(OC)c1ccccc1	ZINC000450729690	EF	On-Demand	Bother	F2RL3	46	33
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1)CC(C)C	ZINC000450729700	GH	On-Demand	Anodyne	COLA	48	40
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1)CC(C)C	ZINC000450729700	GH	On-Demand	Anodyne	CPT1A	46	40
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1)CC(C)C	ZINC000450729701	GH	On-Demand	Anodyne	COLA	48	40
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1)CC(C)C	ZINC000450729701	GH	On-Demand	Anodyne	CPT1A	46	40
CCCc1nc(C)c(COc2ccc(C)cc2[N+](=O)[O-])o1	ZINC000450729707	CH	On-Demand	Bother	S1PR4	16	44
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@H](C)[C@@H](C)C2)cs1	ZINC000450729727	DI	On-Demand	Anodyne	COLA	22	41
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)cs1	ZINC000450729728	DI	On-Demand	Anodyne	COLA	22	41
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@H](C)[C@H](C)C2)cs1	ZINC000450729729	DI	On-Demand	Anodyne	COLA	22	41
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)cs1	ZINC000450729730	DI	On-Demand	Anodyne	COLA	22	41
NC(=O)C[C@H](NCCc1ccc(Cl)cc1)C1CCCCC1	ZINC000450729739	DG	On-Demand	Anodyne	MMP2	50	38
NC(=O)C[C@@H](NCCc1ccc(Cl)cc1)C1CCCCC1	ZINC000450729740	DG	On-Demand	Anodyne	MMP2	50	38
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cn1)c1ccccc1	ZINC000450729741	DD	On-Demand	Anodyne	CYNT	44	33
Cc1cc(F)c(CC(=O)NC2(Cc3ccccc3)CC2)cc1F	ZINC000450729749	DH	On-Demand	Anodyne	PTGER4	22	40
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(C)(F)F)nc2)[C@@H](C(=O)OC)C1	ZINC000450729750	FD	On-Demand	Anodyne	SFRP1	55	38
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(C)(F)F)nc2)[C@@H](C(=O)OC)C1	ZINC000450729750	FD	On-Demand	Anodyne	PTR1	48	36
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(C)(F)F)nc2)[C@H](C(=O)OC)C1	ZINC000450729751	FD	On-Demand	Anodyne	SFRP1	55	38
COC(=O)[C@H]1CCN(C(=O)c2ccc(C(C)(F)F)nc2)[C@H](C(=O)OC)C1	ZINC000450729751	FD	On-Demand	Anodyne	PTR1	48	36
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450729752	FD	On-Demand	Anodyne	SFRP1	55	38
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450729752	FD	On-Demand	Anodyne	PTR1	48	36
COC(=O)[C@@H]1CCN(C(=O)c2ccc(C(C)(F)F)nc2)[C@@H](C(=O)OC)C1	ZINC000450729753	FD	On-Demand	Anodyne	SFRP1	55	38
COC(=O)[C@@H]1CCN(C(=O)c2ccc(C(C)(F)F)nc2)[C@@H](C(=O)OC)C1	ZINC000450729753	FD	On-Demand	Anodyne	PTR1	48	36
Cc1cnc(CCCC(=O)NC2(Cc3ccccc3)CC2)o1	ZINC000450729762	CG	On-Demand	Anodyne	FAAH	44	35
Cc1cnc(CCCC(=O)NC2(Cc3ccccc3)CC2)o1	ZINC000450729762	CG	On-Demand	Anodyne	CES1D	45	32
COC(=O)Cn1ncc(NC(=O)c2ccc(C(F)(F)F)cc2C)c1C	ZINC000450729781	FF	On-Demand	Anodyne	SORT1	16	41
CC(C)(NC[C@H](O)Cc1ccccc1)c1cccs1	ZINC000450729802	CG	On-Demand	Anodyne	CASR	23	40
NC(=O)c1cccc(NCC2CCCCCC2)c1[N+](=O)[O-]	ZINC000450729803	CG	On-Demand	Bother	PRKCQ	43	37
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cn1)c1ccccc1	ZINC000450729806	DD	On-Demand	Anodyne	CYNT	44	33
CCOCc1nc(C)c(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)s1	ZINC000450729808	GH	On-Demand	Anodyne	PRCP	40	31
CCOCc1nc(C)c(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)s1	ZINC000450729809	GH	On-Demand	Anodyne	PRCP	40	31
CCOC(=O)c1cc(C(=O)NC2(Cc3ccccc3)CC2)[nH]c1C	ZINC000450729835	EG	On-Demand	Anodyne	SLC12A5	49	33
COc1ccc(CNC(=O)CCNC(C)(C)c2cccs2)c(OC)c1	ZINC000450729848	FG	On-Demand	Anodyne	MTNR1A	53	36
COc1ccc(CNC(=O)CCNC(C)(C)c2cccs2)c(OC)c1	ZINC000450729848	FG	On-Demand	Anodyne	MTNR1B	45	36
COc1ccc(CNC(=O)CCNC(C)(C)c2cccs2)c(OC)c1	ZINC000450729848	FG	On-Demand	Anodyne	MT-ND1	15	40
COc1ccc(CNC(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450729851	DC	On-Demand	Anodyne	TRPV1	38	47
COc1ccc(CNC(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450729851	DC	On-Demand	Anodyne	MT-ND1	26	44
COc1ccc(CNC(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450729851	DC	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(CNC(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450729851	DC	On-Demand	Anodyne	DRTS_TRYCR	44	32
COc1ccc(CNC(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450729854	DC	On-Demand	Anodyne	TRPV1	38	47
COc1ccc(CNC(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450729854	DC	On-Demand	Anodyne	MT-ND1	26	44
COc1ccc(CNC(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450729854	DC	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(CNC(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450729854	DC	On-Demand	Anodyne	DRTS_TRYCR	44	32
COc1ccc(CNC(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450729855	DC	On-Demand	Anodyne	TRPV1	38	47
COc1ccc(CNC(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450729855	DC	On-Demand	Anodyne	MT-ND1	26	44
COc1ccc(CNC(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450729855	DC	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(CNC(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450729855	DC	On-Demand	Anodyne	DRTS_TRYCR	44	32
COc1ccc(CNC(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450729856	DC	On-Demand	Anodyne	TRPV1	38	47
COc1ccc(CNC(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450729856	DC	On-Demand	Anodyne	MT-ND1	26	44
COc1ccc(CNC(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450729856	DC	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(CNC(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450729856	DC	On-Demand	Anodyne	DRTS_TRYCR	44	32
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450729858	GD	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450729858	GD	On-Demand	Anodyne	OPRK1	29	45
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450729858	GD	On-Demand	Anodyne	HTR4	45	34
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450729858	GD	On-Demand	Anodyne	ITGA4	20	40
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@H](C(=O)OC)C1	ZINC000450729859	GD	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@H](C(=O)OC)C1	ZINC000450729859	GD	On-Demand	Anodyne	OPRK1	29	45
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@H](C(=O)OC)C1	ZINC000450729859	GD	On-Demand	Anodyne	HTR4	45	34
COC(=O)[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@H](C(=O)OC)C1	ZINC000450729859	GD	On-Demand	Anodyne	ITGA4	20	40
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450729861	GD	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450729861	GD	On-Demand	Anodyne	OPRK1	29	45
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450729861	GD	On-Demand	Anodyne	HTR4	45	34
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450729861	GD	On-Demand	Anodyne	ITGA4	20	40
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450729865	GG	On-Demand	Anodyne	LEF	57	38
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)Cc2cc(F)c(C)cc2F)cc1	ZINC000450729866	GG	On-Demand	Anodyne	LEF	57	38
C[C@H](N[C@H](CC(N)=O)C1CCOCC1)c1ccc(Oc2ccccc2)cc1	ZINC000450729867	FH	On-Demand	Anodyne	ACACA	22	43
C[C@@H](N[C@@H](CC(N)=O)C1CCOCC1)c1ccc(Oc2ccccc2)cc1	ZINC000450729868	FH	On-Demand	Anodyne	ACACA	22	43
C[C@@H](N[C@H](CC(N)=O)C1CCOCC1)c1ccc(Oc2ccccc2)cc1	ZINC000450729869	FH	On-Demand	Anodyne	ACACA	22	43
C[C@H](N[C@@H](CC(N)=O)C1CCOCC1)c1ccc(Oc2ccccc2)cc1	ZINC000450729870	FH	On-Demand	Anodyne	ACACA	22	43
C=CCOc1ccc(CC(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)cc1	ZINC000450729886	GG	On-Demand	Mild	ADAMTS4	58	36
C=CCOc1ccc(CC(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)cc1	ZINC000450729887	GG	On-Demand	Mild	ADAMTS4	58	36
O=C(c1cncc(Cl)c1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450729896	GJ	On-Demand	Anodyne	CHEK2	17	40
O=C(c1cncc(Cl)c1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450729896	GJ	On-Demand	Anodyne	SLC9A1	42	42
O=C(c1cncc(Cl)c1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450729896	GJ	On-Demand	Anodyne	RBP4	57	40
O=C(c1cncc(Cl)c1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450729896	GJ	On-Demand	Anodyne	CACNA1I	41	32
O=C(c1cncc(Cl)c1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450729896	GJ	On-Demand	Anodyne	SCD1	52	46
O=C(c1cncc(Cl)c1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450729896	GJ	On-Demand	Anodyne	SFRP1	54	41
O=C(c1cncc(Cl)c1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450729896	GJ	On-Demand	Anodyne	SCD	49	41
CSc1cccc(C(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	ZINC000450729897	FG	On-Demand	Anodyne	E1	0	44
CSc1cccc(C(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	ZINC000450729898	FG	On-Demand	Anodyne	E1	0	44
CC[C@@H]1C[C@H]1CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450729899	CD	On-Demand	Bother	CA2	29	40
CO[C@@](C)(CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F)c1ccccc1	ZINC000450729901	GI	On-Demand	Anodyne	SFRP1	60	33
CO[C@](C)(CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F)c1ccccc1	ZINC000450729902	GI	On-Demand	Anodyne	SFRP1	60	33
COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450729942	GD	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450729942	GD	On-Demand	Anodyne	OPRK1	29	45
COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450729942	GD	On-Demand	Anodyne	HTR4	45	34
COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450729942	GD	On-Demand	Anodyne	ITGA4	20	40
CCC[C@H](OC)C(=O)NCc1cccc(C(C)C)c1	ZINC000450729955	CG	On-Demand	Anodyne	PDS	43	44
CCC[C@@H](OC)C(=O)NCc1cccc(C(C)C)c1	ZINC000450729957	CG	On-Demand	Anodyne	PDS	43	44
CC(C)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(=O)OC(C)(C)C	ZINC000450729960	DG	On-Demand	Anodyne	POL	0	44
CC(C)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)C(=O)OC(C)(C)C	ZINC000450729961	DG	On-Demand	Anodyne	POL	0	44
CC(C)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(=O)OC(C)(C)C	ZINC000450729962	DG	On-Demand	Anodyne	POL	0	44
CC(C)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(=O)OC(C)(C)C	ZINC000450729964	DG	On-Demand	Anodyne	POL	0	44
COc1cc(CC(=O)NC2(Cc3ccccc3)CC2)ccc1Cl	ZINC000450729980	EH	On-Demand	Anodyne	PTGER4	23	43
COc1cc(CC(=O)NC2(Cc3ccccc3)CC2)ccc1Cl	ZINC000450729980	EH	On-Demand	Anodyne	CAN2	0	40
Cc1nc([C@H]2CCCN2C(=O)CCCC(=O)C(C)(C)C)cs1	ZINC000450730013	DH	On-Demand	Anodyne	COLA	48	44
Cc1nc([C@H]2CCCN2C(=O)CCCC(=O)C(C)(C)C)cs1	ZINC000450730013	DH	On-Demand	Anodyne	CPT1A	48	44
O=C(Cc1ccc(O)c(F)c1)NC1(Cc2ccccc2)CC1	ZINC000450730032	CF	On-Demand	Anodyne	CAN2	0	41
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	ADA	48	41
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	ADORA1	0	47
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	SLC29A1	145	64
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RY12	52	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	ADORA2A	65	77
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	ADORA2B	28	63
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	GAPC	0	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	ADK	73	58
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RX5	0	43
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	AK3	0	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	AHCY	63	41
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	CDA	44	34
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RX4	45	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RX1	60	43
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RX6	0	43
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RY4	17	43
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RY1	41	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RY11	0	44
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	MAT2A	0	42
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	RNASEL	0	40
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	AMD1	38	47
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	GAPDH	37	40
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	ITPR1	56	41
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	P2RY2	22	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	AK2	0	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	NS5B	0	48
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	ADORA3	145	77
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	OXGR1	128	48
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	PARG	0	40
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	MTAP	0	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	QARS	0	42
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	IMPDH2	58	36
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	AK	0	50
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	RNASE1	47	37
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	MBTA	0	46
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	DNMT3B	75	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	NADK	0	41
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	Q4VQ11_PIG	102	75
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	GPR17	63	54
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	SAE1	0	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	HSPA5	52	38
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	DOT1L	91	44
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	NAE1	0	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	UBA6	0	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	UBA7	0	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4CCCCCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450730043	GC	On-Demand	Anodyne	DNPH1	0	41
CCOc1cc(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)on1	ZINC000450730055	GI	On-Demand	Anodyne	PLK1	43	38
CCOc1cc(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)on1	ZINC000450730055	GI	On-Demand	Anodyne	RBP4	43	40
CCOc1cc(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)on1	ZINC000450730055	GI	On-Demand	Anodyne	SCD1	38	45
CCOc1cc(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)on1	ZINC000450730055	GI	On-Demand	Anodyne	SCD	36	45
CC(C)c1cccc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450730062	GH	On-Demand	Anodyne	CA7	16	44
CC(C)c1cccc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450730062	GH	On-Demand	Anodyne	CA5B	37	44
CC(C)c1cccc(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450730062	GH	On-Demand	Anodyne	CA5A	38	44
CCCCCN(CC(N)=O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450730076	FD	On-Demand	Anodyne	CCKAR	0	41
CCCCCN(CC(N)=O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450730076	FD	On-Demand	Anodyne	CCKBR	0	41
CCCCCN(CC(N)=O)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450730076	FD	On-Demand	Anodyne	PSBA	0	42
COC(=O)[C@H]1CCN(C(=O)c2cccc(SC)c2)[C@@H](C(=O)OC)C1	ZINC000450730083	FD	On-Demand	Anodyne	PREP	28	54
COc1cc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)ccc1Cl	ZINC000450730085	FI	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)ccc1Cl	ZINC000450730085	FI	On-Demand	Anodyne	OPRK1	49	46
COc1cc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)ccc1Cl	ZINC000450730085	FI	On-Demand	Anodyne	HCRTR1	17	43
COc1cc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)ccc1Cl	ZINC000450730085	FI	On-Demand	Anodyne	COLA	67	46
COc1cc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)ccc1Cl	ZINC000450730085	FI	On-Demand	Anodyne	CPT1A	63	46
COC(=O)[C@H]1CCN(C(=O)c2cccc(SC)c2)[C@H](C(=O)OC)C1	ZINC000450730086	FD	On-Demand	Anodyne	PREP	28	54
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cccc(SC)c1	ZINC000450730087	FD	On-Demand	Anodyne	PREP	28	54
COC(=O)[C@@H]1CCN(C(=O)c2cccc(SC)c2)[C@@H](C(=O)OC)C1	ZINC000450730088	FD	On-Demand	Anodyne	PREP	28	54
COCc1nn(C)cc1C(=O)NCc1cccc(C(C)C)c1	ZINC000450730089	DF	On-Demand	Anodyne	CARM1	50	37
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2C(F)(F)F)no1	ZINC000450730112	EH	On-Demand	Anodyne	COLA	41	39
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2C(F)(F)F)no1	ZINC000450730112	EH	On-Demand	Anodyne	CPT1A	41	39
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2C(F)(F)F)no1	ZINC000450730113	EH	On-Demand	Anodyne	COLA	41	39
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2C(F)(F)F)no1	ZINC000450730113	EH	On-Demand	Anodyne	CPT1A	41	39
Cc1nc(NCC(C)(C)C2CCC2)ncc1[N+](=O)[O-]	ZINC000450730116	CF	On-Demand	Bother	PRKCQ	24	40
CC(C)c1cccc(CNC(=O)Cc2ccc(O)c(F)c2)c1	ZINC000450730123	DH	On-Demand	Anodyne	ADRB2	61	44
CC(C)c1cccc(CNC(=O)Cc2ccc(O)c(F)c2)c1	ZINC000450730123	DH	On-Demand	Anodyne	TRPV1	24	60
CC(C)c1cccc(CNC(=O)Cc2ccc(O)c(F)c2)c1	ZINC000450730123	DH	On-Demand	Anodyne	NCE103	27	48
CC(C)c1cccc(CNC(=O)Cc2ccc(O)c(F)c2)c1	ZINC000450730123	DH	On-Demand	Anodyne	CAN2	0	48
COc1ccc(CNC(=O)CCN[C@@H](C)C2CCCC2)c(OC)c1	ZINC000450730129	EF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN[C@@H](C)C2CCCC2)c(OC)c1	ZINC000450730129	EF	On-Demand	Anodyne	MTNR1A	48	37
COc1ccc(CNC(=O)CCN[C@H](C)C2CCCC2)c(OC)c1	ZINC000450730130	EF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN[C@H](C)C2CCCC2)c(OC)c1	ZINC000450730130	EF	On-Demand	Anodyne	MTNR1A	48	37
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730133	EF	On-Demand	Anodyne	ACE	28	40
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730133	EF	On-Demand	Anodyne	MME	74	42
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730133	EF	On-Demand	Anodyne	ANPEP	77	40
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730133	EF	On-Demand	Anodyne	SLC15A1	0	41
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730133	EF	On-Demand	Anodyne	CTRB1	32	40
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730133	EF	On-Demand	Anodyne	SOAT1	22	52
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730133	EF	On-Demand	Anodyne	ACE2	55	37
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730134	EF	On-Demand	Anodyne	ACE	28	40
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730134	EF	On-Demand	Anodyne	MME	74	42
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730134	EF	On-Demand	Anodyne	ANPEP	77	40
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730134	EF	On-Demand	Anodyne	SLC15A1	0	41
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730134	EF	On-Demand	Anodyne	CTRB1	32	40
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730134	EF	On-Demand	Anodyne	SOAT1	22	52
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730134	EF	On-Demand	Anodyne	ACE2	55	37
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730135	EF	On-Demand	Anodyne	ACE	28	40
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730135	EF	On-Demand	Anodyne	MME	74	42
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730135	EF	On-Demand	Anodyne	ANPEP	77	40
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730135	EF	On-Demand	Anodyne	SLC15A1	0	41
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730135	EF	On-Demand	Anodyne	CTRB1	32	40
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730135	EF	On-Demand	Anodyne	SOAT1	22	52
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000450730135	EF	On-Demand	Anodyne	ACE2	55	37
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730136	EF	On-Demand	Anodyne	ACE	28	40
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730136	EF	On-Demand	Anodyne	MME	74	42
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730136	EF	On-Demand	Anodyne	ANPEP	77	40
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730136	EF	On-Demand	Anodyne	SLC15A1	0	41
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730136	EF	On-Demand	Anodyne	CTRB1	32	40
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730136	EF	On-Demand	Anodyne	SOAT1	22	52
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000450730136	EF	On-Demand	Anodyne	ACE2	55	37
COC1(CSc2nc3cc4ccccc4cc3c(=O)n2C)CCC1	ZINC000450730171	EH	On-Demand	Bother	POLR1A	69	33
CCc1c(C(F)(F)F)noc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450730173	FI	On-Demand	Anodyne	P2RX7	15	43
CCc1c(C(F)(F)F)noc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450730173	FI	On-Demand	Anodyne	NR1H2	0	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(C)oc2C)c(OC)c1	ZINC000450730176	FG	On-Demand	Anodyne	PDGFRB	27	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2cc(C)oc2C)c(OC)c1	ZINC000450730176	FG	On-Demand	Anodyne	MTNR1A	55	38
COc1cc(CC(=O)Nc2ccc(C3CC3)c(C)c2)ccc1O	ZINC000450730179	DH	On-Demand	Anodyne	TRPV1	30	50
COc1cc(CC(=O)Nc2ccc(C3CC3)c(C)c2)ccc1O	ZINC000450730179	DH	On-Demand	Anodyne	ENPP1	55	32
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(C)oc2C)c(OC)c1	ZINC000450730181	FG	On-Demand	Anodyne	PDGFRB	27	41
COc1ccc(CNC(=O)CCN[C@H](C)c2cc(C)oc2C)c(OC)c1	ZINC000450730181	FG	On-Demand	Anodyne	MTNR1A	55	38
COc1cc(CC(=O)NCc2cccc(C(C)C)c2)ccc1O	ZINC000450730189	DG	On-Demand	Anodyne	ADRB2	55	43
COc1cc(CC(=O)NCc2cccc(C(C)C)c2)ccc1O	ZINC000450730189	DG	On-Demand	Anodyne	TRPV1	30	55
COc1cc(CC(=O)NCc2cccc(C(C)C)c2)ccc1O	ZINC000450730189	DG	On-Demand	Anodyne	NCE103	37	46
COc1cc(CC(=O)NCc2cccc(C(C)C)c2)ccc1O	ZINC000450730189	DG	On-Demand	Anodyne	MTCA1	15	46
COc1cc(CC(=O)NCc2cccc(C(C)C)c2)ccc1O	ZINC000450730189	DG	On-Demand	Anodyne	P96878_MYCTU	26	46
COc1cc(CC(=O)NCc2cccc(C(C)C)c2)ccc1O	ZINC000450730189	DG	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)NCc2cccc(C(C)C)c2)ccc1O	ZINC000450730189	DG	On-Demand	Anodyne	PDS	18	40
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccnc(OC(F)F)c2)no1	ZINC000450730193	GH	On-Demand	Anodyne	COLA	76	40
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccnc(OC(F)F)c2)no1	ZINC000450730193	GH	On-Demand	Anodyne	CPT1A	75	40
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccnc(OC(F)F)c2)no1	ZINC000450730199	GH	On-Demand	Anodyne	COLA	76	40
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccnc(OC(F)F)c2)no1	ZINC000450730199	GH	On-Demand	Anodyne	CPT1A	75	40
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450730268	DC	On-Demand	Anodyne	FKBP12.6	0	50
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450730270	DC	On-Demand	Anodyne	FKBP12.6	0	50
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@H](C)[C@H](C)CO	ZINC000450730271	DC	On-Demand	Anodyne	FKBP12.6	0	50
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450730273	DC	On-Demand	Anodyne	FKBP12.6	0	50
CC[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OC)cc1	ZINC000450730278	CE	On-Demand	Anodyne	NPY5R	23	40
CC[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OC)cc1	ZINC000450730279	CE	On-Demand	Anodyne	NPY5R	23	40
CC[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OC)cc1	ZINC000450730280	CE	On-Demand	Anodyne	NPY5R	23	40
CC[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OC)cc1	ZINC000450730281	CE	On-Demand	Anodyne	NPY5R	23	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NC1(Cc2ccccc2)CC1	ZINC000450730282	GG	On-Demand	Anodyne	CA5B	38	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NC1(Cc2ccccc2)CC1	ZINC000450730282	GG	On-Demand	Anodyne	CA5A	39	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NC1(Cc2ccccc2)CC1	ZINC000450730282	GG	On-Demand	Anodyne	E1	0	41
C/C=C/COc1cccc(CC(=O)Nc2onc(C(F)(F)F)c2CC)c1	ZINC000450730304	FI	On-Demand	Anodyne	PDS	41	33
C/C=C\COc1cccc(CC(=O)Nc2onc(C(F)(F)F)c2CC)c1	ZINC000450730307	FI	On-Demand	Anodyne	PDS	41	33
CC[C@@H]1C[C@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450730320	CF	On-Demand	Anodyne	DHOD	0	53
COC(=O)c1ccc([C@@H](NC(=O)[C@H]2CCCN(C)C2=O)C(F)(F)F)cc1	ZINC000450730330	FE	On-Demand	Anodyne	ELANE	38	44
COC(=O)c1ccc([C@H](NC(=O)[C@H]2CCCN(C)C2=O)C(F)(F)F)cc1	ZINC000450730332	FE	On-Demand	Anodyne	ELANE	38	44
COC(=O)c1ccc([C@@H](NC(=O)[C@@H]2CCCN(C)C2=O)C(F)(F)F)cc1	ZINC000450730334	FE	On-Demand	Anodyne	ELANE	38	44
COC(=O)c1ccc([C@H](NC(=O)[C@@H]2CCCN(C)C2=O)C(F)(F)F)cc1	ZINC000450730336	FE	On-Demand	Anodyne	ELANE	38	44
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)o1	ZINC000450730345	FH	On-Demand	Anodyne	COLA	96	44
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)o1	ZINC000450730345	FH	On-Demand	Anodyne	CPT1A	81	44
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)o1	ZINC000450730352	FH	On-Demand	Anodyne	COLA	96	44
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)o1	ZINC000450730352	FH	On-Demand	Anodyne	CPT1A	81	44
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)[nH]c1C	ZINC000450730384	GH	On-Demand	Anodyne	COLA	45	38
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)[nH]c1C	ZINC000450730384	GH	On-Demand	Anodyne	CPT1A	44	38
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)[nH]c1C	ZINC000450730385	GH	On-Demand	Anodyne	COLA	45	38
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)[nH]c1C	ZINC000450730385	GH	On-Demand	Anodyne	CPT1A	44	38
CCc1cccc(C(=O)N2CCC[C@@H]2c2csc(C)n2)n1	ZINC000450730387	DG	On-Demand	Anodyne	ADAM17	21	42
CCc1cccc(C(=O)N2CCC[C@@H]2c2csc(C)n2)n1	ZINC000450730387	DG	On-Demand	Anodyne	COLA	41	39
CC(C)c1nc([C@@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)no1	ZINC000450730416	GK	On-Demand	Anodyne	CPT1A	69	42
CC(C)c1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)no1	ZINC000450730420	GK	On-Demand	Anodyne	CPT1A	69	42
CC(C)c1nc([C@H]2CCCCCN2C(=O)c2ccsc2Br)no1	ZINC000450730425	GJ	On-Demand	Anodyne	CPT1A	48	38
CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2ccsc2Br)no1	ZINC000450730430	GJ	On-Demand	Anodyne	CPT1A	48	38
CCn1c(SCC[C@@H]2CCOC2)nc2cc3ccccc3cc2c1=O	ZINC000450730431	FI	On-Demand	Bother	POLR1A	57	34
CCn1c(SCC[C@H]2CCOC2)nc2cc3ccccc3cc2c1=O	ZINC000450730432	FI	On-Demand	Bother	POLR1A	57	34
O=C(CCCC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1)C1CC1	ZINC000450730438	GI	On-Demand	Anodyne	RBP4	60	40
O=C(CCCC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1)C1CC1	ZINC000450730438	GI	On-Demand	Anodyne	SFRP1	44	42
O=C(CCCC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1)C1CC1	ZINC000450730438	GI	On-Demand	Anodyne	SCD	33	41
O=C(C1CC1)C1(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)CC1	ZINC000450730440	GI	On-Demand	Anodyne	RBP4	60	40
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450730447	FH	On-Demand	Mild	RBP4	66	38
C[C@@H]1C[C@]1(C#N)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450730452	FH	On-Demand	Mild	RBP4	66	38
C[C@H]1C[C@]1(C#N)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450730453	FH	On-Demand	Mild	RBP4	66	38
C[C@H]1C[C@@]1(C#N)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450730455	FH	On-Demand	Mild	RBP4	66	38
COc1ccc(CNC(=O)CCN[C@H](C)c2csc(C)n2)c(OC)c1	ZINC000450730462	FF	On-Demand	Anodyne	MTNR1A	48	37
COc1ccc(CNC(=O)CCN[C@@H](C)c2csc(C)n2)c(OC)c1	ZINC000450730465	FF	On-Demand	Anodyne	MTNR1A	48	37
C[C@H](Sc1ccc(S(=O)(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450730525	GG	On-Demand	Anodyne	EPHX2	18	45
C[C@@H](Sc1ccc(S(=O)(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450730526	GG	On-Demand	Anodyne	EPHX2	18	45
Ic1ccc2ncnc(NC[C@H]3CC34CCOCC4)c2c1	ZINC000450730530	GF	On-Demand	Anodyne	DYRK1A	23	40
Ic1ccc2ncnc(NC[C@H]3CC34CCOCC4)c2c1	ZINC000450730530	GF	On-Demand	Anodyne	CLK1	17	40
Ic1ccc2ncnc(NC[C@H]3CC34CCOCC4)c2c1	ZINC000450730530	GF	On-Demand	Anodyne	CLK2	27	40
Ic1ccc2ncnc(NC[C@H]3CC34CCOCC4)c2c1	ZINC000450730530	GF	On-Demand	Anodyne	CLK4	57	40
Ic1ccc2ncnc(NC[C@H]3CC34CCOCC4)c2c1	ZINC000450730530	GF	On-Demand	Anodyne	CD38	43	33
Ic1ccc2ncnc(NC[C@H]3CC34CCOCC4)c2c1	ZINC000450730530	GF	On-Demand	Anodyne	DYRK1B	29	40
Ic1ccc2ncnc(NC[C@@H]3CC34CCOCC4)c2c1	ZINC000450730532	GF	On-Demand	Anodyne	DYRK1A	23	40
Ic1ccc2ncnc(NC[C@@H]3CC34CCOCC4)c2c1	ZINC000450730532	GF	On-Demand	Anodyne	CLK1	17	40
Ic1ccc2ncnc(NC[C@@H]3CC34CCOCC4)c2c1	ZINC000450730532	GF	On-Demand	Anodyne	CLK2	27	40
Ic1ccc2ncnc(NC[C@@H]3CC34CCOCC4)c2c1	ZINC000450730532	GF	On-Demand	Anodyne	CLK4	57	40
Ic1ccc2ncnc(NC[C@@H]3CC34CCOCC4)c2c1	ZINC000450730532	GF	On-Demand	Anodyne	CD38	43	33
Ic1ccc2ncnc(NC[C@@H]3CC34CCOCC4)c2c1	ZINC000450730532	GF	On-Demand	Anodyne	DYRK1B	29	40
CCCc1cc(NC[C@@](C)(OC)c2ccccc2)n2ncnc2n1	ZINC000450730537	EG	On-Demand	Anodyne	DHOD	0	46
CCCc1cc(NC[C@](C)(OC)c2ccccc2)n2ncnc2n1	ZINC000450730538	EG	On-Demand	Anodyne	DHOD	0	46
COC(=O)Cn1ncc(NC(=O)Cc2ccc(Cl)c(OC)c2)c1C	ZINC000450730566	FE	On-Demand	Anodyne	CCR1	35	48
COC(=O)Cn1ncc(NC(=O)Cc2ccc(Cl)c(OC)c2)c1C	ZINC000450730566	FE	On-Demand	Anodyne	IMDH_CRYPV	15	42
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](C(=O)OC)C[C@@H]2C(=O)OC)cc1	ZINC000450730572	GF	On-Demand	Anodyne	PREP	18	42
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](C(=O)OC)C[C@@H]2C(=O)OC)cc1	ZINC000450730572	GF	On-Demand	Anodyne	PTR1	40	34
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](C(=O)OC)C[C@@H]2C(=O)OC)cc1	ZINC000450730573	GF	On-Demand	Anodyne	PREP	18	42
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](C(=O)OC)C[C@@H]2C(=O)OC)cc1	ZINC000450730573	GF	On-Demand	Anodyne	PTR1	40	34
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](C(=O)OC)C[C@H]2C(=O)OC)cc1	ZINC000450730574	GF	On-Demand	Anodyne	PREP	18	42
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](C(=O)OC)C[C@H]2C(=O)OC)cc1	ZINC000450730574	GF	On-Demand	Anodyne	PTR1	40	34
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](C(=O)OC)C[C@H]2C(=O)OC)cc1	ZINC000450730575	GF	On-Demand	Anodyne	PREP	18	42
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](C(=O)OC)C[C@H]2C(=O)OC)cc1	ZINC000450730575	GF	On-Demand	Anodyne	PTR1	40	34
C=CC(C)(C)CNc1ccc(C(=O)CC)cc1S(N)(=O)=O	ZINC000450730607	DF	On-Demand	Mild	CA13	41	37
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730638	GF	On-Demand	Anodyne	ITGA4	43	46
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730638	GF	On-Demand	Anodyne	CAPNS1	28	43
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730638	GF	On-Demand	Anodyne	CAPN1	18	41
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730638	GF	On-Demand	Anodyne	EPHX2	27	40
C=CC(C)(C)CNc1ncc([N+](=O)[O-])c(C)n1	ZINC000450730639	BE	On-Demand	Mild	PRKCQ	46	37
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730641	GF	On-Demand	Anodyne	ITGA4	43	46
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730641	GF	On-Demand	Anodyne	CAPNS1	28	43
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730641	GF	On-Demand	Anodyne	CAPN1	18	41
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730641	GF	On-Demand	Anodyne	EPHX2	27	40
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730642	GF	On-Demand	Anodyne	ITGA4	43	46
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730642	GF	On-Demand	Anodyne	CAPNS1	28	43
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730642	GF	On-Demand	Anodyne	CAPN1	18	41
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730642	GF	On-Demand	Anodyne	EPHX2	27	40
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730644	GF	On-Demand	Anodyne	ITGA4	43	46
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730644	GF	On-Demand	Anodyne	CAPNS1	28	43
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730644	GF	On-Demand	Anodyne	CAPN1	18	41
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450730644	GF	On-Demand	Anodyne	EPHX2	27	40
CCOC(=O)c1cc(C(=O)NC2(Cc3ccccc3)CC2)on1	ZINC000450730648	DE	On-Demand	Anodyne	CACNA1C	52	35
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC(C)(C)C)C(C)C)cc1	ZINC000450730660	FF	On-Demand	Anodyne	CA2	27	43
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC(C)(C)C)C(C)C)cc1	ZINC000450730660	FF	On-Demand	Anodyne	CA1	22	43
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC(C)(C)C)C(C)C)cc1	ZINC000450730660	FF	On-Demand	Anodyne	ADAMTS4	47	41
CCOc1cc(C(=O)NCc2cccc(C(C)C)c2)on1	ZINC000450730662	CG	On-Demand	Anodyne	PDS	43	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450730666	FD	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1CCN(C(=O)[C@@H]2Cc3cccc(C)c3O2)[C@@H](C(=O)OC)C1	ZINC000450730678	FD	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450730680	FD	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1CCN(C(=O)[C@H]2Cc3cccc(C)c3O2)[C@@H](C(=O)OC)C1	ZINC000450730683	FD	On-Demand	Anodyne	AGTR2	0	40
C[C@@H]1C[C@]1(C#N)C(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450730688	DF	On-Demand	Mild	PRCP	42	34
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450730692	DF	On-Demand	Mild	PRCP	42	34
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450730693	DF	On-Demand	Mild	PRCP	42	34
C[C@@H]1C[C@]1(C#N)C(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450730695	DF	On-Demand	Mild	PRCP	42	34
O=C(c1ccsn1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450730702	FI	On-Demand	Anodyne	RBP4	54	44
O=C(c1ccsn1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450730702	FI	On-Demand	Anodyne	SCD1	45	41
O=C(c1ccsn1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450730702	FI	On-Demand	Anodyne	SFRP1	45	32
O=C(c1ccsn1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450730702	FI	On-Demand	Anodyne	SCD	45	41
COc1cc(OC)c2ncnc(NCc3nn(C)cc3Br)c2c1	ZINC000450730704	GE	On-Demand	Anodyne	PDE6A	42	32
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450730747	EH	On-Demand	Anodyne	GPR88	0	45
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NC1(Cc2ccccc2)CC1	ZINC000450730748	FG	On-Demand	Bother	CACNA1D	68	38
C=CC(C)(C)CNc1ccc(C(C)=O)cn1	ZINC000450730750	BF	On-Demand	Mild	HCAR3	15	53
C=CC(C)(C)CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450730751	CF	On-Demand	Mild	TBXA2R	26	41
CCCOc1c(OC)cc(CCNc2ccccn2)cc1OC	ZINC000450730755	DH	On-Demand	Anodyne	PTGDR	0	42
COc1ccc(CNC(=O)CCN[C@H](C)c2nc(C)cs2)c(OC)c1	ZINC000450730761	FF	On-Demand	Anodyne	MTNR1A	48	37
COc1ccc(CNC(=O)CCN[C@@H](C)c2nc(C)cs2)c(OC)c1	ZINC000450730762	FF	On-Demand	Anodyne	MTNR1A	48	37
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	ADORA1	126	79
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	SLC29A1	113	57
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	P2RY12	54	43
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	ADORA2A	62	63
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	ADORA2B	28	57
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	GAPC	0	46
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	ADK	82	57
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	P2RX5	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	AK3	0	42
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	AHCY	58	42
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	P2RX4	36	42
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	P2RX1	47	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	P2RX6	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	P2RY1	32	42
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	P2RY11	0	42
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	MAT2A	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	AMD1	35	41
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	GAPDH	37	41
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	ITPR1	53	39
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	AK2	0	42
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	ADORA3	119	62
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	OXGR1	115	41
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	MTAP	0	47
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	IMPDH2	53	38
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	AT1	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	AK	0	50
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	SETD7	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	PRMT1	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	MBTA	0	45
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	DNMT3B	75	44
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	NADK	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	PANC	37	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	Q4VQ11_PIG	86	62
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	GPR17	58	43
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	SAE1	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	DOT1L	83	46
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	METJ	0	44
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	NAE1	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	UBA6	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	UBA7	0	40
C=CC(C)(C)CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450730772	EC	On-Demand	Mild	SETD2	0	40
COc1ccc(CCNC(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450730786	DC	On-Demand	Anodyne	TRPV1	0	41
COc1ccc(CCNC(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450730786	DC	On-Demand	Anodyne	CAN2	0	53
COc1ccc(CCNC(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450730788	DC	On-Demand	Anodyne	TRPV1	0	41
COc1ccc(CCNC(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450730788	DC	On-Demand	Anodyne	CAN2	0	53
COc1ccc(CCNC(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450730789	DC	On-Demand	Anodyne	TRPV1	0	41
COc1ccc(CCNC(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450730789	DC	On-Demand	Anodyne	CAN2	0	53
COc1ccc(CCNC(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450730791	DC	On-Demand	Anodyne	TRPV1	0	41
COc1ccc(CCNC(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450730791	DC	On-Demand	Anodyne	CAN2	0	53
CO[C@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450730792	EH	On-Demand	Bother	TAAR1	21	48
CO[C@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450730792	EH	On-Demand	Bother	AKR1C3	25	47
CO[C@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450730792	EH	On-Demand	Bother	AKR1C2	25	42
CO[C@@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450730794	EH	On-Demand	Bother	TAAR1	21	48
CO[C@@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450730794	EH	On-Demand	Bother	AKR1C3	25	47
CO[C@@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450730794	EH	On-Demand	Bother	AKR1C2	25	42
Cc1nc([C@H]2CCCN2C(=O)c2ccc(-c3ccncc3)c(F)c2)cs1	ZINC000450730798	FJ	On-Demand	Anodyne	CPT1A	23	41
Cc1nc([C@H]2CCCN2C(=O)c2ccc(-c3ccncc3)c(F)c2)cs1	ZINC000450730798	FJ	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
Cc1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)nn1C(C)C	ZINC000450730803	FI	On-Demand	Anodyne	COLA	49	39
Cc1cc(C(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)nn1C(C)C	ZINC000450730803	FI	On-Demand	Anodyne	CPT1A	48	39
Cc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)nn1C(C)C	ZINC000450730804	FI	On-Demand	Anodyne	COLA	49	39
Cc1cc(C(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)nn1C(C)C	ZINC000450730804	FI	On-Demand	Anodyne	CPT1A	48	39
COC(=O)[C@@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)[C@@H](C(=O)OC)C1	ZINC000450730806	FE	On-Demand	Anodyne	PREP	18	43
CN(C)c1nc(NCc2nn(C)cc2Br)nc2ccccc12	ZINC000450730814	FE	On-Demand	Anodyne	ADRA2A	16	46
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1ccc(C)c2c1CCC2	ZINC000450730815	FE	On-Demand	Anodyne	PREP	18	43
COC(=O)[C@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)[C@H](C(=O)OC)C1	ZINC000450730816	FE	On-Demand	Anodyne	PREP	18	43
COC(=O)[C@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)[C@@H](C(=O)OC)C1	ZINC000450730817	FE	On-Demand	Anodyne	PREP	18	43
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCOC1	ZINC000450730818	EF	On-Demand	Anodyne	TIMP3	62	37
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCOC1	ZINC000450730820	EF	On-Demand	Anodyne	TIMP3	62	37
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCOC1	ZINC000450730821	EF	On-Demand	Anodyne	TIMP3	62	37
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCOC1	ZINC000450730822	EF	On-Demand	Anodyne	TIMP3	62	37
CC(C)c1nc([C@@H]2CCCCCN2C(=O)CCCC(=O)C(C)(C)C)no1	ZINC000450730835	FI	On-Demand	Anodyne	COLA	79	43
CC(C)c1nc([C@@H]2CCCCCN2C(=O)CCCC(=O)C(C)(C)C)no1	ZINC000450730835	FI	On-Demand	Anodyne	CPT1A	77	43
CC(C)c1nc([C@H]2CCCCCN2C(=O)CCCC(=O)C(C)(C)C)no1	ZINC000450730838	FI	On-Demand	Anodyne	COLA	79	43
CC(C)c1nc([C@H]2CCCCCN2C(=O)CCCC(=O)C(C)(C)C)no1	ZINC000450730838	FI	On-Demand	Anodyne	CPT1A	77	43
CCc1c(C(F)(F)F)noc1NC(=O)c1ncc(OC)cn1	ZINC000450730845	DE	On-Demand	Anodyne	ATF1	50	31
CCc1c(C(F)(F)F)noc1NC(=O)c1ncc(OC)cn1	ZINC000450730845	DE	On-Demand	Anodyne	NFKB1	47	31
CC(C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCC1	ZINC000450730859	FG	On-Demand	Bother	BCL2	16	40
CC(C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCC1	ZINC000450730859	FG	On-Demand	Bother	L3MBTL1	0	44
CC(C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCC1	ZINC000450730859	FG	On-Demand	Bother	L3MBTL3	31	44
CCC(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)c(S(N)(=O)=O)c1	ZINC000450730860	GF	On-Demand	Anodyne	CA2	30	41
CCC(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)c(S(N)(=O)=O)c1	ZINC000450730860	GF	On-Demand	Anodyne	CA1	21	40
CCC(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)c(S(N)(=O)=O)c1	ZINC000450730860	GF	On-Demand	Anodyne	CA7	25	40
CCC(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)c(S(N)(=O)=O)c1	ZINC000450730860	GF	On-Demand	Anodyne	CA13	42	40
CCC(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)c(S(N)(=O)=O)c1	ZINC000450730861	GF	On-Demand	Anodyne	CA2	30	41
CCC(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)c(S(N)(=O)=O)c1	ZINC000450730861	GF	On-Demand	Anodyne	CA1	21	40
CCC(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)c(S(N)(=O)=O)c1	ZINC000450730861	GF	On-Demand	Anodyne	CA7	25	40
CCC(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)c(S(N)(=O)=O)c1	ZINC000450730861	GF	On-Demand	Anodyne	CA13	42	40
N#C[C@@H]1CC[C@@H](Sc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450730871	EF	On-Demand	Mild	GCKR	47	32
N#C[C@@H]1CC[C@H](Sc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450730876	EF	On-Demand	Mild	GCKR	47	32
N#C[C@H]1CC[C@@H](Sc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450730878	EF	On-Demand	Mild	GCKR	47	32
N#C[C@H]1CC[C@H](Sc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450730880	EF	On-Demand	Mild	GCKR	47	32
CC(=O)CCCCCOc1ccc(C)cc1[N+](=O)[O-]	ZINC000450730881	CG	On-Demand	Bother	THRA	22	51
CC(=O)CCCCCOc1ccc(C)cc1[N+](=O)[O-]	ZINC000450730881	CG	On-Demand	Bother	S1PR4	18	56
O=C(Cc1ccc(OC(F)F)c(F)c1)NC1(Cc2ccccc2)CC1	ZINC000450730882	EH	On-Demand	Anodyne	PDEC	0	42
CC(C)NC(=O)c1ccc(NCc2nn(C)cc2Br)c([N+](=O)[O-])c1	ZINC000450730893	GF	On-Demand	Bother	TAAR1	19	42
CO[C@@](C)(CNc1ccc(C(=O)NC2CCCC2)nn1)c1ccccc1	ZINC000450730895	FF	On-Demand	Anodyne	AMY2	47	32
CO[C@](C)(CNc1ccc(C(=O)NC2CCCC2)nn1)c1ccccc1	ZINC000450730897	FF	On-Demand	Anodyne	AMY2	47	32
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H]2c2csc(C)n2)n1	ZINC000450730905	EF	On-Demand	Anodyne	COLA	54	41
Cc1nc(C)n(CCCC(=O)N2CCC[C@@H]2c2csc(C)n2)n1	ZINC000450730905	EF	On-Demand	Anodyne	CPT1A	55	40
CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(C(=O)OC)cc1)C(F)(F)F	ZINC000450730920	GI	On-Demand	Anodyne	CTSF	67	37
COCCOC[C@H](O)CN[C@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450730924	GH	On-Demand	Anodyne	RBP4	51	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(C(=O)OC)cc1)C(F)(F)F	ZINC000450730925	GI	On-Demand	Anodyne	CTSF	67	37
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1ccc(C(=O)OC)cc1)C(F)(F)F	ZINC000450730926	GI	On-Demand	Anodyne	CTSF	67	37
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1ccc(C(=O)OC)cc1)C(F)(F)F	ZINC000450730927	GI	On-Demand	Anodyne	CTSF	67	37
COCCOC[C@H](O)CN[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450730930	GH	On-Demand	Anodyne	RBP4	51	32
COCCOC[C@H](O)CN[C@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450730931	GH	On-Demand	Anodyne	RBP4	51	32
COCCOC[C@H](O)CN[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450730932	GH	On-Demand	Anodyne	RBP4	51	32
CCc1ccc([C@H](C)NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450730966	CE	On-Demand	Anodyne	ACACA	41	37
CCc1ccc([C@H](C)NC(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450730967	CE	On-Demand	Anodyne	ACACA	41	37
CCc1ccc([C@H](C)NC(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450730968	CE	On-Demand	Anodyne	ACACA	41	37
CCc1ccc([C@H](C)NC(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450730969	CE	On-Demand	Anodyne	ACACA	41	37
Cc1ccn2ncc(C(=O)NC3(Cc4ccccc4)CC3)c2c1	ZINC000450730970	DG	On-Demand	Anodyne	EPHB3	38	53
Cc1cc(C(=O)N2CCO[C@H](c3ccc(F)cc3Cl)C2)ncc1C(N)=O	ZINC000450730989	GE	On-Demand	Anodyne	PRCP	43	32
Cc1cc(C(=O)N2CCO[C@@H](c3ccc(F)cc3Cl)C2)ncc1C(N)=O	ZINC000450730990	GE	On-Demand	Anodyne	PRCP	43	32
CC[C@@H]1C[C@H]1CNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450730997	GE	On-Demand	Bother	BDKRB1	0	50
Cc1cc(C(=O)NCc2cccc(C(C)C)c2)ncc1C(N)=O	ZINC000450731016	DF	On-Demand	Anodyne	MMP13	0	48
Cc1cc(C(=O)NCc2cccc(C(C)C)c2)ncc1C(N)=O	ZINC000450731016	DF	On-Demand	Anodyne	PDS	30	40
NC(=O)c1ccnc(NCC2CCCCCC2)c1[N+](=O)[O-]	ZINC000450731031	CE	On-Demand	Bother	PRKCQ	48	39
CC[C@@H]1C[C@H]1C(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450731033	DG	On-Demand	Anodyne	PRCP	46	35
CC[C@@H]1C[C@H]1C(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450731035	DG	On-Demand	Anodyne	PRCP	46	35
COc1cc(Br)c(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1OC	ZINC000450731057	GJ	On-Demand	Anodyne	ENPP1	61	33
COc1cc(Br)c(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1OC	ZINC000450731057	GJ	On-Demand	Anodyne	KCNK3	59	44
COc1cc(Br)c(C(=O)Nc2ccc(C3CC3)c(C)c2)cc1OC	ZINC000450731057	GJ	On-Demand	Anodyne	KCNK9	62	43
CCCCCN(CC(N)=O)C(=O)C[C@@H](O)CC	ZINC000450731071	BC	On-Demand	Anodyne	CQSS	41	32
CCCCCN(CC(N)=O)C(=O)C[C@H](O)CC	ZINC000450731073	BC	On-Demand	Anodyne	CQSS	41	32
COc1cccc2c(NCc3nn(C)cc3Br)c(C)cnc12	ZINC000450731077	FH	On-Demand	Anodyne	ATP4A	18	40
Cn1ncc2c(NCC(C)(C)C3CCC3)ccnc21	ZINC000450731078	CG	On-Demand	Anodyne	HNMT	40	33
C[C@H](CO)[C@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731102	FH	On-Demand	Anodyne	GNRHR	15	41
C[C@H](CO)[C@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731102	FH	On-Demand	Anodyne	TBXA2R	22	48
C[C@H](CO)[C@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731102	FH	On-Demand	Anodyne	ALOX5AP	28	50
C[C@H](CO)[C@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731102	FH	On-Demand	Anodyne	PTGES2	58	32
C[C@H](NCc1nc2cc(Cl)ccc2n1Cc1ccccc1)[C@@H](C)CO	ZINC000450731119	FH	On-Demand	Anodyne	GNRHR	15	41
C[C@H](NCc1nc2cc(Cl)ccc2n1Cc1ccccc1)[C@@H](C)CO	ZINC000450731119	FH	On-Demand	Anodyne	TBXA2R	22	48
C[C@H](NCc1nc2cc(Cl)ccc2n1Cc1ccccc1)[C@@H](C)CO	ZINC000450731119	FH	On-Demand	Anodyne	ALOX5AP	28	50
C[C@H](NCc1nc2cc(Cl)ccc2n1Cc1ccccc1)[C@@H](C)CO	ZINC000450731119	FH	On-Demand	Anodyne	PTGES2	58	32
C[C@H](CO)[C@@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731121	FH	On-Demand	Anodyne	GNRHR	15	41
C[C@H](CO)[C@@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731121	FH	On-Demand	Anodyne	TBXA2R	22	48
C[C@H](CO)[C@@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731121	FH	On-Demand	Anodyne	ALOX5AP	28	50
C[C@H](CO)[C@@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731121	FH	On-Demand	Anodyne	PTGES2	58	32
C[C@@H](CO)[C@@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731122	FH	On-Demand	Anodyne	GNRHR	15	41
C[C@@H](CO)[C@@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731122	FH	On-Demand	Anodyne	TBXA2R	22	48
C[C@@H](CO)[C@@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731122	FH	On-Demand	Anodyne	ALOX5AP	28	50
C[C@@H](CO)[C@@H](C)NCc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450731122	FH	On-Demand	Anodyne	PTGES2	58	32
CCCCCN(CC(N)=O)C(=O)Cc1cc2ccccc2s1	ZINC000450731178	DF	On-Demand	Anodyne	TSPO	29	43
Cc1[nH]c(C#N)cc1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450731180	GI	On-Demand	Mild	SLC9A1	29	40
Cc1[nH]c(C#N)cc1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450731180	GI	On-Demand	Mild	SLC6A9	18	42
Cc1[nH]c(C#N)cc1C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450731180	GI	On-Demand	Mild	RBP4	48	37
CC[C@@H](CC(F)(F)F)C(=O)N1CCC[C@@H]1c1csc(C)n1	ZINC000450731194	DI	On-Demand	Anodyne	ADAM17	0	44
CC[C@H](CC(F)(F)F)C(=O)N1CCC[C@@H]1c1csc(C)n1	ZINC000450731197	DI	On-Demand	Anodyne	ADAM17	0	44
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731226	GK	On-Demand	Anodyne	PRCP	48	36
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731226	GK	On-Demand	Anodyne	GRM5	15	40
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731226	GK	On-Demand	Anodyne	TRPC6	42	41
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731226	GK	On-Demand	Anodyne	TRPC3	29	41
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731227	GK	On-Demand	Anodyne	PRCP	48	36
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731227	GK	On-Demand	Anodyne	GRM5	15	40
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731227	GK	On-Demand	Anodyne	TRPC6	42	41
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731227	GK	On-Demand	Anodyne	TRPC3	29	41
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731228	GK	On-Demand	Anodyne	PRCP	48	36
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731228	GK	On-Demand	Anodyne	GRM5	15	40
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731228	GK	On-Demand	Anodyne	TRPC6	42	41
Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731228	GK	On-Demand	Anodyne	TRPC3	29	41
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731229	GK	On-Demand	Anodyne	PRCP	48	36
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731229	GK	On-Demand	Anodyne	GRM5	15	40
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731229	GK	On-Demand	Anodyne	TRPC6	42	41
Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450731229	GK	On-Demand	Anodyne	TRPC3	29	41
CC(C)c1nc([C@H]2CCCCCN2C(=O)CC2(O)CCC2)no1	ZINC000450731235	DF	On-Demand	Anodyne	COLA	69	42
CC(C)c1nc([C@H]2CCCCCN2C(=O)CC2(O)CCC2)no1	ZINC000450731235	DF	On-Demand	Anodyne	CPT1A	58	41
CC(C)c1nc([C@@H]2CCCCCN2C(=O)CC2(O)CCC2)no1	ZINC000450731237	DF	On-Demand	Anodyne	COLA	69	42
CC(C)c1nc([C@@H]2CCCCCN2C(=O)CC2(O)CCC2)no1	ZINC000450731237	DF	On-Demand	Anodyne	CPT1A	58	41
COCc1cc(NCCOc2ccc(Cl)c(F)c2)n2ncnc2n1	ZINC000450731248	FF	On-Demand	Anodyne	DHOD	0	48
CCCCCN(CC(N)=O)C(=O)Cc1scnc1-c1ccccc1	ZINC000450731249	EF	On-Demand	Anodyne	TSPO	36	46
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450731267	FE	On-Demand	Bother	CA2	32	41
CO[C@@](C)(CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450731267	FE	On-Demand	Bother	BDKRB1	22	42
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450731268	FE	On-Demand	Bother	CA2	32	41
CO[C@](C)(CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450731268	FE	On-Demand	Bother	BDKRB1	22	42
Cc1nc([C@H]2CCCN2C(=O)c2ccc3cnccc3c2)cs1	ZINC000450731284	DH	On-Demand	Anodyne	COLA	50	43
Cc1nc([C@H]2CCCN2C(=O)c2ccc3cnccc3c2)cs1	ZINC000450731284	DH	On-Demand	Anodyne	CPT1A	49	43
Cc1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@H](C)CO)c1	ZINC000450731292	CD	On-Demand	Anodyne	KCNK3	39	40
Cc1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO)c1	ZINC000450731296	CD	On-Demand	Anodyne	CCKAR	0	40
Cc1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO)c1	ZINC000450731296	CD	On-Demand	Anodyne	KCNK3	59	42
Cc1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO)c1	ZINC000450731296	CD	On-Demand	Anodyne	KCNK9	63	42
Cc1cccc(NC(=O)[C@H](C)N[C@H](C)[C@H](C)CO)c1	ZINC000450731299	CD	On-Demand	Anodyne	CCKAR	0	40
Cc1cccc(NC(=O)[C@H](C)N[C@H](C)[C@H](C)CO)c1	ZINC000450731299	CD	On-Demand	Anodyne	KCNK3	59	42
Cc1cccc(NC(=O)[C@H](C)N[C@H](C)[C@H](C)CO)c1	ZINC000450731299	CD	On-Demand	Anodyne	KCNK9	63	42
Cc1cccc(NC(=O)[C@H](C)N[C@H](C)[C@@H](C)CO)c1	ZINC000450731301	CD	On-Demand	Anodyne	CCKAR	0	40
Cc1cccc(NC(=O)[C@H](C)N[C@H](C)[C@@H](C)CO)c1	ZINC000450731301	CD	On-Demand	Anodyne	KCNK3	59	42
Cc1cccc(NC(=O)[C@H](C)N[C@H](C)[C@@H](C)CO)c1	ZINC000450731301	CD	On-Demand	Anodyne	KCNK9	63	42
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731323	CD	On-Demand	Anodyne	SLC15A1	0	43
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731323	CD	On-Demand	Anodyne	DNPEP	0	40
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731323	CD	On-Demand	Anodyne	SLC15A2	0	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731324	CD	On-Demand	Anodyne	SLC15A1	0	43
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731324	CD	On-Demand	Anodyne	DNPEP	0	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731324	CD	On-Demand	Anodyne	SLC15A2	0	40
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731325	CD	On-Demand	Anodyne	SLC15A1	0	43
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731325	CD	On-Demand	Anodyne	DNPEP	0	40
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731325	CD	On-Demand	Anodyne	SLC15A2	0	40
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731326	CD	On-Demand	Anodyne	SLC15A1	0	43
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731326	CD	On-Demand	Anodyne	DNPEP	0	40
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)NCCc1ccccc1	ZINC000450731326	CD	On-Demand	Anodyne	SLC15A2	0	40
CCc1cc(NCC(C)(C)C2CCC2)n2ncnc2n1	ZINC000450731327	CF	On-Demand	Anodyne	DHOD	0	53
CC(=O)CCCCCSc1nc2cc3ccccc3cc2c(=O)n1C	ZINC000450731347	FI	On-Demand	Bother	POLR1A	75	35
CCc1cccc(C(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450731349	EF	On-Demand	Anodyne	FPR1	17	40
CCc1cccc(C(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)n1	ZINC000450731350	EF	On-Demand	Anodyne	FPR1	17	40
CC(F)(F)CCSc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450731361	FG	On-Demand	Anodyne	GCK	57	32
CC(F)(F)CCSc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450731361	FG	On-Demand	Anodyne	GCKR	52	32
CO[C@@](C)(CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450731407	FF	On-Demand	Bother	BDKRB1	23	43
CO[C@@](C)(CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450731407	FF	On-Demand	Bother	BCL2L1	40	37
CO[C@](C)(CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450731408	FF	On-Demand	Bother	BDKRB1	23	43
CO[C@](C)(CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000450731408	FF	On-Demand	Bother	BCL2L1	40	37
O=C([C@H](O)C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450731416	FG	On-Demand	Anodyne	COLA	117	52
O=C([C@H](O)C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450731416	FG	On-Demand	Anodyne	CPT1A	100	49
O=C([C@H](O)C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450731417	FG	On-Demand	Anodyne	COLA	117	52
O=C([C@H](O)C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450731417	FG	On-Demand	Anodyne	CPT1A	100	49
O=C([C@@H](O)C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450731418	FG	On-Demand	Anodyne	COLA	117	52
O=C([C@@H](O)C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000450731418	FG	On-Demand	Anodyne	CPT1A	100	49
O=C([C@@H](O)C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450731419	FG	On-Demand	Anodyne	COLA	117	52
O=C([C@@H](O)C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000450731419	FG	On-Demand	Anodyne	CPT1A	100	49
Cc1nc([C@H]2CCCN2C(=O)CC2CC(F)(F)C2)cs1	ZINC000450731421	DH	On-Demand	Anodyne	COLA	34	40
Cc1nc([C@H]2CCCN2C(=O)CC2CC(F)(F)C2)cs1	ZINC000450731421	DH	On-Demand	Anodyne	CPT1A	33	40
CCNC(=O)c1ccc(NC[C@@](C)(OC)c2ccccc2)nc1	ZINC000450731426	DF	On-Demand	Anodyne	E3UJZ5_SPOLI	41	34
CCNC(=O)c1ccc(NC[C@](C)(OC)c2ccccc2)nc1	ZINC000450731427	DF	On-Demand	Anodyne	E3UJZ5_SPOLI	41	34
COC(=O)c1ccc(OC[C@@H](C)S(C)(=O)=O)c([N+](=O)[O-])c1	ZINC000450731437	DD	On-Demand	Bother	COLA	57	33
COC(=O)c1ccc(OC[C@H](C)S(C)(=O)=O)c([N+](=O)[O-])c1	ZINC000450731438	DD	On-Demand	Bother	COLA	57	33
CC(F)(F)CCSc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450731448	EG	On-Demand	Anodyne	GCK	58	32
CC(F)(F)CCSc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450731448	EG	On-Demand	Anodyne	GCKR	53	32
CC(C)c1cccc(CNC(=O)c2ccc(-c3cnn(C)c3)o2)c1	ZINC000450731457	DH	On-Demand	Anodyne	MMP13	22	51
CC[S@@](=O)CC(=O)NCc1cccc(C(C)C)c1	ZINC000450731469	CE	On-Demand	Anodyne	PDS	41	43
CC[S@](=O)CC(=O)NCc1cccc(C(C)C)c1	ZINC000450731470	CE	On-Demand	Anodyne	PDS	41	43
CCC[C@H](NC(=O)CN[C@@H](C)[C@@H](C)CO)c1ccccc1	ZINC000450731472	CE	On-Demand	Anodyne	ACER2	0	40
CCC[C@H](NC(=O)CN[C@@H](C)[C@@H](C)CO)c1ccccc1	ZINC000450731472	CE	On-Demand	Anodyne	GPR88	0	43
CCC[C@H](NC(=O)CN[C@H](C)[C@H](C)CO)c1ccccc1	ZINC000450731473	CE	On-Demand	Anodyne	ACER2	0	40
CCC[C@H](NC(=O)CN[C@H](C)[C@H](C)CO)c1ccccc1	ZINC000450731473	CE	On-Demand	Anodyne	GPR88	0	43
CCC[C@H](NC(=O)CN[C@H](C)[C@@H](C)CO)c1ccccc1	ZINC000450731474	CE	On-Demand	Anodyne	ACER2	0	40
CCC[C@H](NC(=O)CN[C@H](C)[C@@H](C)CO)c1ccccc1	ZINC000450731474	CE	On-Demand	Anodyne	GPR88	0	43
CCC[C@H](NC(=O)CN[C@@H](C)[C@H](C)CO)c1ccccc1	ZINC000450731475	CE	On-Demand	Anodyne	ACER2	0	40
CCC[C@H](NC(=O)CN[C@@H](C)[C@H](C)CO)c1ccccc1	ZINC000450731475	CE	On-Demand	Anodyne	GPR88	0	43
CCc1c(C(F)(F)F)noc1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450731477	FJ	On-Demand	Anodyne	ATF1	56	37
CCc1c(C(F)(F)F)noc1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450731477	FJ	On-Demand	Anodyne	SORT1	17	44
CCc1c(C(F)(F)F)noc1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450731477	FJ	On-Demand	Anodyne	NFKB1	52	37
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450731487	EH	On-Demand	Anodyne	RBP4	67	40
Cc1cnc(CCCC(=O)NCc2cccc(C(C)C)c2)o1	ZINC000450731507	DH	On-Demand	Anodyne	SUCNR1	41	36
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450731532	FD	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450731533	FD	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1CCN(C(=O)[C@H]2Cc3c(C)cccc3O2)[C@@H](C(=O)OC)C1	ZINC000450731534	FD	On-Demand	Anodyne	AGTR2	0	40
COC(=O)[C@@H]1CCN(C(=O)[C@@H]2Cc3c(C)cccc3O2)[C@@H](C(=O)OC)C1	ZINC000450731535	FD	On-Demand	Anodyne	AGTR2	0	40
CC(C)c1ccc(CN2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450731549	FE	On-Demand	Anodyne	DRD4	16	44
CC(C)c1ccc(CN2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450731550	FE	On-Demand	Anodyne	DRD4	16	44
CC(C)c1ccc(CN2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450731551	FE	On-Demand	Anodyne	DRD4	16	44
CC(C)c1ccc(CN2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450731552	FE	On-Demand	Anodyne	DRD4	16	44
COc1ccc([C@H](CNC(=O)CN[C@H](C)[C@H](C)CO)N2CCCCC2)cc1	ZINC000450731600	GD	On-Demand	Anodyne	CCR3	15	44
COc1ccc([C@H](CNC(=O)CN[C@H](C)[C@@H](C)CO)N2CCCCC2)cc1	ZINC000450731601	GD	On-Demand	Anodyne	CCR3	15	44
COc1ccc([C@H](CNC(=O)CN[C@@H](C)[C@H](C)CO)N2CCCCC2)cc1	ZINC000450731602	GD	On-Demand	Anodyne	CCR3	15	44
COc1ccc([C@H](CNC(=O)CN[C@@H](C)[C@@H](C)CO)N2CCCCC2)cc1	ZINC000450731603	GD	On-Demand	Anodyne	CCR3	15	44
CN(C)c1ccnc(NCc2cccc(S(C)(=O)=O)c2)n1	ZINC000450731618	DD	On-Demand	Anodyne	EPHB4	0	44
COC(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)[C@H](C(=O)OC)C1	ZINC000450731644	GD	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)[C@H](C(=O)OC)C1	ZINC000450731644	GD	On-Demand	Anodyne	PREP	23	43
COC(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450731645	GD	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450731645	GD	On-Demand	Anodyne	PREP	23	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450731646	GD	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450731646	GD	On-Demand	Anodyne	PREP	23	43
COC(=O)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450731647	GD	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)[C@@H](C(=O)OC)C1	ZINC000450731647	GD	On-Demand	Anodyne	PREP	23	43
CC(=O)c1ccc(CSc2ccc(S(=O)(=O)N3CCCC3)cn2)cc1	ZINC000450731649	GG	On-Demand	Anodyne	NAMPT	34	40
CCC[C@@H](O)CN[C@H](C(=O)OC(C)(C)C)C(C)C	ZINC000450731658	CE	On-Demand	Anodyne	PGA5	46	42
CCC[C@H](O)CN[C@H](C(=O)OC(C)(C)C)C(C)C	ZINC000450731659	CE	On-Demand	Anodyne	PGA5	46	42
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cccc2c1CCCC2	ZINC000450731684	FE	On-Demand	Anodyne	AVPR2	28	43
COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1C(=O)c1cccc2c1CCCC2	ZINC000450731684	FE	On-Demand	Anodyne	PREP	31	47
COC(=O)[C@@H]1CCN(C(=O)c2cccc3c2CCCC3)[C@@H](C(=O)OC)C1	ZINC000450731685	FE	On-Demand	Anodyne	AVPR2	28	43
COC(=O)[C@@H]1CCN(C(=O)c2cccc3c2CCCC3)[C@@H](C(=O)OC)C1	ZINC000450731685	FE	On-Demand	Anodyne	PREP	31	47
COC(=O)[C@H]1CCN(C(=O)c2cccc3c2CCCC3)[C@@H](C(=O)OC)C1	ZINC000450731686	FE	On-Demand	Anodyne	AVPR2	28	43
COC(=O)[C@H]1CCN(C(=O)c2cccc3c2CCCC3)[C@@H](C(=O)OC)C1	ZINC000450731686	FE	On-Demand	Anodyne	PREP	31	47
COC(=O)[C@H]1CCN(C(=O)c2cccc3c2CCCC3)[C@H](C(=O)OC)C1	ZINC000450731687	FE	On-Demand	Anodyne	AVPR2	28	43
COC(=O)[C@H]1CCN(C(=O)c2cccc3c2CCCC3)[C@H](C(=O)OC)C1	ZINC000450731687	FE	On-Demand	Anodyne	PREP	31	47
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731718	GD	On-Demand	Anodyne	LPL	48	38
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731718	GD	On-Demand	Anodyne	EPHX2	16	42
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731718	GD	On-Demand	Anodyne	TGM2	65	44
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731718	GD	On-Demand	Anodyne	F13A1	99	49
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731718	GD	On-Demand	Anodyne	RAC1	0	42
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731718	GD	On-Demand	Anodyne	NAMPT	34	48
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731718	GD	On-Demand	Anodyne	DDIT3	0	44
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H](C)CO	ZINC000450731719	GD	On-Demand	Anodyne	LPL	48	38
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H](C)CO	ZINC000450731719	GD	On-Demand	Anodyne	EPHX2	16	42
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H](C)CO	ZINC000450731719	GD	On-Demand	Anodyne	TGM2	65	44
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H](C)CO	ZINC000450731719	GD	On-Demand	Anodyne	F13A1	99	49
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H](C)CO	ZINC000450731719	GD	On-Demand	Anodyne	RAC1	0	42
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H](C)CO	ZINC000450731719	GD	On-Demand	Anodyne	NAMPT	34	48
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@@H](C)CO	ZINC000450731719	GD	On-Demand	Anodyne	DDIT3	0	44
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731720	GD	On-Demand	Anodyne	LPL	48	38
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731720	GD	On-Demand	Anodyne	EPHX2	16	42
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731720	GD	On-Demand	Anodyne	TGM2	65	44
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731720	GD	On-Demand	Anodyne	F13A1	99	49
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731720	GD	On-Demand	Anodyne	RAC1	0	42
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731720	GD	On-Demand	Anodyne	NAMPT	34	48
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731720	GD	On-Demand	Anodyne	DDIT3	0	44
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731721	GD	On-Demand	Anodyne	LPL	48	38
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731721	GD	On-Demand	Anodyne	EPHX2	16	42
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731721	GD	On-Demand	Anodyne	TGM2	65	44
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731721	GD	On-Demand	Anodyne	F13A1	99	49
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731721	GD	On-Demand	Anodyne	RAC1	0	42
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731721	GD	On-Demand	Anodyne	NAMPT	34	48
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450731721	GD	On-Demand	Anodyne	DDIT3	0	44
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nc(CO)cs1	ZINC000450731724	EF	On-Demand	Anodyne	PPARD	23	41
COc1cccc2c(NCC3(CF)CCOCC3)cc(C)nc12	ZINC000450731745	DH	On-Demand	Anodyne	BDKRB2	58	33
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	ACE	17	45
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	TSHR	42	33
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	LTA4H	39	52
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	CA1	23	47
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	CTSK	15	44
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	SCN2A	15	50
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	SLC15A1	0	50
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	S1PR4	15	42
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	ACE2	45	45
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	PLAU	46	38
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	ADAMTS4	54	40
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731760	FG	On-Demand	Anodyne	FFAR1	39	41
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	ACE	17	45
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	TSHR	42	33
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	LTA4H	39	52
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	CA1	23	47
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	CTSK	15	44
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	SCN2A	15	50
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	SLC15A1	0	50
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	S1PR4	15	42
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	ACE2	45	45
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	PLAU	46	38
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	ADAMTS4	54	40
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731761	FG	On-Demand	Anodyne	FFAR1	39	41
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	ACE	17	45
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	TSHR	42	33
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	LTA4H	39	52
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	CA1	23	47
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	CTSK	15	44
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	SCN2A	15	50
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	SLC15A1	0	50
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	S1PR4	15	42
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	ACE2	45	45
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	PLAU	46	38
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	ADAMTS4	54	40
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731762	FG	On-Demand	Anodyne	FFAR1	39	41
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	ACE	17	45
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	TSHR	42	33
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	LTA4H	39	52
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	CA1	23	47
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	CTSK	15	44
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	SCN2A	15	50
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	SLC15A1	0	50
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	S1PR4	15	42
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	ACE2	45	45
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	PLAU	46	38
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	ADAMTS4	54	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000450731763	FG	On-Demand	Anodyne	FFAR1	39	41
C[C@H](O)[C@@H]1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450731771	DF	On-Demand	Anodyne	CCR1	34	43
C[C@H](O)[C@H]1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450731772	DF	On-Demand	Anodyne	CCR1	34	43
C[C@@H](O)[C@H]1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450731773	DF	On-Demand	Anodyne	CCR1	34	43
C[C@@H](O)[C@@H]1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450731774	DF	On-Demand	Anodyne	CCR1	34	43
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N1c2ccccc2CC[C@@H]1C	ZINC000450731784	DE	On-Demand	Anodyne	ACE	40	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N1c2ccccc2CC[C@@H]1C	ZINC000450731784	DE	On-Demand	Anodyne	TPP2	24	45
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000450731785	DE	On-Demand	Anodyne	ACE	40	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000450731785	DE	On-Demand	Anodyne	TPP2	24	45
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N1c2ccccc2CC[C@@H]1C	ZINC000450731786	DE	On-Demand	Anodyne	ACE	40	40
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N1c2ccccc2CC[C@@H]1C	ZINC000450731786	DE	On-Demand	Anodyne	TPP2	24	45
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000450731787	DE	On-Demand	Anodyne	ACE	40	40
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000450731787	DE	On-Demand	Anodyne	TPP2	24	45
Cc1ccn2ncc(C(=O)NCc3nc(N(C)C)no3)c2c1	ZINC000450731818	DD	On-Demand	Anodyne	EPHB3	22	40
COC(=O)Cn1ncc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000450731834	FD	On-Demand	Bother	CACNA1C	41	32
COC(=O)Cn1ncc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000450731834	FD	On-Demand	Bother	CACNA1D	61	32
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000450731839	CD	On-Demand	Anodyne	XIAP	22	40
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H]1CCCc2ccccc21	ZINC000450731840	CD	On-Demand	Anodyne	XIAP	22	40
C[C@H](CO)[C@H](C)NCC(=O)N[C@H]1CCCc2ccccc21	ZINC000450731841	CD	On-Demand	Anodyne	XIAP	22	40
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000450731842	CD	On-Demand	Anodyne	XIAP	22	40
N#Cc1cnc2c(F)cc(F)cc2c1NCC1(CF)CCOCC1	ZINC000450731845	EH	On-Demand	Mild	MAP3K8	84	36
CCc1cc(NCC2(CF)CCOCC2)n2ncnc2n1	ZINC000450731848	CD	On-Demand	Anodyne	DHOD	0	48
CC(C)NC(=O)c1ccc(NCC2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000450731849	FF	On-Demand	Bother	TAAR1	17	41
FCC1(CNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450731860	EI	On-Demand	Anodyne	HRP1_PLAFA	68	33
FCC1(CNc2ccnc3cc(F)c(Cl)cc23)CCOCC1	ZINC000450731860	EI	On-Demand	Anodyne	HNMT	43	33
CN(C)c1noc(CNC(=O)Cc2ccc(O)c(F)c2)n1	ZINC000450731868	CC	On-Demand	Anodyne	P2RX7	16	41
CNS(=O)(=O)NCC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450731871	EB	On-Demand	Anodyne	F2	15	40
CNS(=O)(=O)NCC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450731871	EB	On-Demand	Anodyne	ITGA4	46	33
CNS(=O)(=O)NCC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450731871	EB	On-Demand	Anodyne	MMP9	20	44
CNS(=O)(=O)NCC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450731871	EB	On-Demand	Anodyne	MMP7	31	44
CNS(=O)(=O)NCC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450731872	EB	On-Demand	Anodyne	F2	15	40
CNS(=O)(=O)NCC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450731872	EB	On-Demand	Anodyne	ITGA4	46	33
CNS(=O)(=O)NCC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450731872	EB	On-Demand	Anodyne	MMP9	20	44
CNS(=O)(=O)NCC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450731872	EB	On-Demand	Anodyne	MMP7	31	44
Cc1cccc(Oc2ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc2)c1	ZINC000450731903	EG	On-Demand	Anodyne	LTA4H	39	47
Cc1cccc(Oc2ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc2)c1	ZINC000450731903	EG	On-Demand	Anodyne	RAF1	31	45
Cc1cccc(Oc2ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc2)c1	ZINC000450731903	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	35	45
Cc1cccc(Oc2ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc2)c1	ZINC000450731903	EG	On-Demand	Anodyne	PFKFB3	42	36
Cc1cccc(Oc2ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc2)c1	ZINC000450731904	EG	On-Demand	Anodyne	LTA4H	39	47
Cc1cccc(Oc2ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc2)c1	ZINC000450731904	EG	On-Demand	Anodyne	RAF1	31	45
Cc1cccc(Oc2ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc2)c1	ZINC000450731904	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	35	45
Cc1cccc(Oc2ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc2)c1	ZINC000450731904	EG	On-Demand	Anodyne	PFKFB3	42	36
Cc1cccc(Oc2ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc2)c1	ZINC000450731905	EG	On-Demand	Anodyne	LTA4H	39	47
Cc1cccc(Oc2ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc2)c1	ZINC000450731905	EG	On-Demand	Anodyne	RAF1	31	45
Cc1cccc(Oc2ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc2)c1	ZINC000450731905	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	35	45
Cc1cccc(Oc2ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc2)c1	ZINC000450731905	EG	On-Demand	Anodyne	PFKFB3	42	36
Cc1cccc(Oc2ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc2)c1	ZINC000450731906	EG	On-Demand	Anodyne	LTA4H	39	47
Cc1cccc(Oc2ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc2)c1	ZINC000450731906	EG	On-Demand	Anodyne	RAF1	31	45
Cc1cccc(Oc2ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc2)c1	ZINC000450731906	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	35	45
Cc1cccc(Oc2ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc2)c1	ZINC000450731906	EG	On-Demand	Anodyne	PFKFB3	42	36
C[C@H]1C[C@@]1(C#N)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450731915	DG	On-Demand	Mild	ENV	44	34
C[C@@H]1C[C@]1(C#N)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450731916	DG	On-Demand	Mild	ENV	44	34
C[C@@H]1C[C@@]1(C#N)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450731917	DG	On-Demand	Mild	ENV	44	34
C[C@H]1C[C@]1(C#N)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450731918	DG	On-Demand	Mild	ENV	44	34
C[C@H](CO)[C@H](C)NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1	ZINC000450731933	GG	On-Demand	Anodyne	MAOB	26	48
C[C@H](CO)[C@H](C)NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1	ZINC000450731933	GG	On-Demand	Anodyne	GRIN2D	77	34
C[C@H](CO)[C@@H](C)NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1	ZINC000450731934	GG	On-Demand	Anodyne	MAOB	26	48
C[C@H](CO)[C@@H](C)NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1	ZINC000450731934	GG	On-Demand	Anodyne	GRIN2D	77	34
C[C@H](CO)[C@@H](C)NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1	ZINC000450731935	GG	On-Demand	Anodyne	MAOB	26	48
C[C@H](CO)[C@@H](C)NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1	ZINC000450731935	GG	On-Demand	Anodyne	GRIN2D	77	34
C[C@H](CO)[C@H](C)NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1	ZINC000450731936	GG	On-Demand	Anodyne	MAOB	26	48
C[C@H](CO)[C@H](C)NCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1	ZINC000450731936	GG	On-Demand	Anodyne	GRIN2D	77	34
C[C@H](CO)[C@H](C)NCC(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000450731944	ED	On-Demand	Anodyne	PDS	69	42
C[C@@H](CO)[C@@H](C)NCC(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000450731945	ED	On-Demand	Anodyne	PDS	69	42
C[C@H](NCC(=O)NCc1cccc(OCC(F)(F)F)c1)[C@@H](C)CO	ZINC000450731946	ED	On-Demand	Anodyne	PDS	69	42
C[C@H](CO)[C@@H](C)NCC(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000450731947	ED	On-Demand	Anodyne	PDS	69	42
Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(N3CCC3)nc1)[C@H](C)C2	ZINC000450731948	DG	On-Demand	Anodyne	HPGDS	16	43
Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(N3CCC3)nc1)[C@@H](C)C2	ZINC000450731949	DG	On-Demand	Anodyne	HPGDS	16	43
Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(N3CCC3)nc1)[C@H](C)C2	ZINC000450731950	DG	On-Demand	Anodyne	HPGDS	16	43
Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(N3CCC3)nc1)[C@@H](C)C2	ZINC000450731951	DG	On-Demand	Anodyne	HPGDS	16	43
O=C(Nc1ccc(Cl)c(OC(F)F)c1)[C@@H]1CC12CCSCC2	ZINC000450731970	EI	On-Demand	Anodyne	ENV	42	33
O=C(Nc1ccc(Cl)c(OC(F)F)c1)[C@H]1CC12CCSCC2	ZINC000450731971	EI	On-Demand	Anodyne	ENV	42	33
CC1(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)CCC(=O)CC1	ZINC000450731977	EI	On-Demand	Anodyne	ENV	46	37
COc1ccc(-c2ccnc(NCC3(CF)CCOCC3)n2)cc1	ZINC000450731988	EG	On-Demand	Anodyne	IKBKB	0	41
COc1ccc(-c2ccnc(NCC3(CF)CCOCC3)n2)cc1	ZINC000450731988	EG	On-Demand	Anodyne	CLK4	27	52
COc1ccc(-c2ccnc(NCC3(CF)CCOCC3)n2)cc1	ZINC000450731988	EG	On-Demand	Anodyne	SMG1	42	34
C[C@@H]1CCC[C@@]1(C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732003	DH	On-Demand	Anodyne	GRIN2B	28	40
C[C@@H]1CCC[C@@]1(C)C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732003	DH	On-Demand	Anodyne	CHRNA10	45	39
CCCOc1ccc(C(=O)Nc2cnn(CC(=O)OC)c2C)c(OC)c1	ZINC000450732013	FE	On-Demand	Anodyne	LUCI_LUCLA	17	48
C[C@H](CO)[C@H](C)NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000450732018	CC	On-Demand	Anodyne	ADRB1	24	43
C[C@H](CO)[C@@H](C)NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000450732019	CC	On-Demand	Anodyne	ADRB1	24	43
C[C@H](CO)[C@@H](C)NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000450732020	CC	On-Demand	Anodyne	ADRB1	24	43
C[C@H](CO)[C@H](C)NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000450732021	CC	On-Demand	Anodyne	ADRB1	24	43
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCc2ncccc2C)c([N+](=O)[O-])c1	ZINC000450732029	GE	On-Demand	Bother	TAAR1	19	44
COC(=O)[C@H](C)NC(=O)c1ccc(NCCc2ncccc2C)c([N+](=O)[O-])c1	ZINC000450732030	GE	On-Demand	Bother	TAAR1	19	44
CC(C)[C@H](CCc1ccccc1)C(=O)NCc1nc(CO)cs1	ZINC000450732044	EG	On-Demand	Anodyne	LAP3	43	33
CC(C)[C@@H](CCc1ccccc1)C(=O)NCc1nc(CO)cs1	ZINC000450732045	EG	On-Demand	Anodyne	LAP3	43	33
COc1cc(CC(=O)NCc2nc(N(C)C)no2)ccc1Cl	ZINC000450732051	DD	On-Demand	Anodyne	TRPV1	0	44
COc1cc(CC(=O)NCc2nc(N(C)C)no2)ccc1Cl	ZINC000450732051	DD	On-Demand	Anodyne	NCE103	23	42
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450732061	EF	On-Demand	Anodyne	CHEK2	23	41
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450732061	EF	On-Demand	Anodyne	COLA	51	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450732061	EF	On-Demand	Anodyne	GRM5	0	41
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450732061	EF	On-Demand	Anodyne	FASN	25	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450732061	EF	On-Demand	Anodyne	L3MBTL3	41	34
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732062	EF	On-Demand	Anodyne	CHEK2	23	41
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732062	EF	On-Demand	Anodyne	COLA	51	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732062	EF	On-Demand	Anodyne	GRM5	0	41
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732062	EF	On-Demand	Anodyne	FASN	25	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732062	EF	On-Demand	Anodyne	L3MBTL3	41	34
O=C(Cc1sccc1Br)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732063	GH	On-Demand	Anodyne	GRIN2B	17	40
O=C(Cc1sccc1Br)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732063	GH	On-Demand	Anodyne	ITGA4	43	33
O=C(Cc1sccc1Br)N1CC[C@H](COc2ccccc2)C1	ZINC000450732064	GH	On-Demand	Anodyne	GRIN2B	17	40
O=C(Cc1sccc1Br)N1CC[C@H](COc2ccccc2)C1	ZINC000450732064	GH	On-Demand	Anodyne	ITGA4	43	33
COc1cccc(NC(=O)CN(C)C(=O)CN[C@H](C)[C@H](C)CO)c1	ZINC000450732113	EC	On-Demand	Anodyne	MTNR1B	29	43
COc1cccc(NC(=O)CN(C)C(=O)CN[C@@H](C)[C@H](C)CO)c1	ZINC000450732114	EC	On-Demand	Anodyne	MTNR1B	29	43
COc1cccc(NC(=O)CN(C)C(=O)CN[C@H](C)[C@@H](C)CO)c1	ZINC000450732115	EC	On-Demand	Anodyne	MTNR1B	29	43
COc1cccc(NC(=O)CN(C)C(=O)CN[C@@H](C)[C@@H](C)CO)c1	ZINC000450732116	EC	On-Demand	Anodyne	MTNR1B	29	43
C[C@H](NCC(=O)NC12CC3CC(CC(C3)C1)C2)[C@@H](C)CO	ZINC000450732154	CD	On-Demand	Anodyne	EPHX2	81	47
C[C@H](CO)[C@@H](C)NCC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450732155	CD	On-Demand	Anodyne	EPHX2	81	47
C[C@@H](CO)[C@@H](C)NCC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450732156	CD	On-Demand	Anodyne	EPHX2	81	47
C[C@H](CO)[C@H](C)NCC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450732157	CD	On-Demand	Anodyne	EPHX2	81	47
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732160	FD	On-Demand	Anodyne	CA2	15	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732160	FD	On-Demand	Anodyne	CA1	16	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732160	FD	On-Demand	Anodyne	CA4	15	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732161	FD	On-Demand	Anodyne	CA2	15	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732161	FD	On-Demand	Anodyne	CA1	16	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732161	FD	On-Demand	Anodyne	CA4	15	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732162	FD	On-Demand	Anodyne	CA2	15	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732162	FD	On-Demand	Anodyne	CA1	16	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732162	FD	On-Demand	Anodyne	CA4	15	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732163	FD	On-Demand	Anodyne	CA2	15	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732163	FD	On-Demand	Anodyne	CA1	16	41
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732163	FD	On-Demand	Anodyne	CA4	15	41
Cc1cc(NCC2(CF)CCOCC2)nc(-c2cccnc2)n1	ZINC000450732198	DE	On-Demand	Anodyne	ROS1	55	36
O=C(Nc1ccc(Cl)c(OC(F)F)c1)c1cc2n(n1)CCCC2	ZINC000450732219	EH	On-Demand	Anodyne	GRM4	40	39
O=C(Nc1ccc(Cl)c(OC(F)F)c1)c1cc2n(n1)CCCC2	ZINC000450732219	EH	On-Demand	Anodyne	TYK2	48	32
Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450732223	CD	On-Demand	Bother	COLA	44	32
Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450732224	CD	On-Demand	Bother	COLA	44	32
Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450732225	CD	On-Demand	Bother	COLA	44	32
Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450732226	CD	On-Demand	Bother	COLA	44	32
C[C@H](CO)[C@@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732227	DE	On-Demand	Anodyne	PIM1	19	46
C[C@H](CO)[C@@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732227	DE	On-Demand	Anodyne	PIM2	23	46
C[C@H](CO)[C@@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732227	DE	On-Demand	Anodyne	PIM3	41	46
C[C@H](NCc1nc(O)c2oc3ccccc3c2n1)[C@@H](C)CO	ZINC000450732228	DE	On-Demand	Anodyne	PIM1	19	46
C[C@H](NCc1nc(O)c2oc3ccccc3c2n1)[C@@H](C)CO	ZINC000450732228	DE	On-Demand	Anodyne	PIM2	23	46
C[C@H](NCc1nc(O)c2oc3ccccc3c2n1)[C@@H](C)CO	ZINC000450732228	DE	On-Demand	Anodyne	PIM3	41	46
C[C@@H](CO)[C@@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732229	DE	On-Demand	Anodyne	PIM1	19	46
C[C@@H](CO)[C@@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732229	DE	On-Demand	Anodyne	PIM2	23	46
C[C@@H](CO)[C@@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732229	DE	On-Demand	Anodyne	PIM3	41	46
C[C@H](CO)[C@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732230	DE	On-Demand	Anodyne	PIM1	19	46
C[C@H](CO)[C@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732230	DE	On-Demand	Anodyne	PIM2	23	46
C[C@H](CO)[C@H](C)NCc1nc(O)c2oc3ccccc3c2n1	ZINC000450732230	DE	On-Demand	Anodyne	PIM3	41	46
COC(=O)Cn1ncc(NC(=O)c2cccc(C(F)(F)F)n2)c1C	ZINC000450732251	EE	On-Demand	Anodyne	SHH	41	34
N#Cc1ccc(NCC2(CF)CCOCC2)cc1C(F)(F)F	ZINC000450732261	DH	On-Demand	Mild	AR	51	40
CNc1nnc(SCc2nc(-c3cc(C)ccn3)no2)s1	ZINC000450732263	DE	On-Demand	Anodyne	TNKS2	15	40
COC(=O)Cn1ncc(NC(=O)c2cnn3ccc(C)cc23)c1C	ZINC000450732317	ED	On-Demand	Anodyne	EPHB3	42	58
COC(=O)Cn1ncc(NC(=O)c2ccn(CCc3ccccc3)n2)c1C	ZINC000450732318	FE	On-Demand	Anodyne	FAS	23	40
CC(=O)Nc1sc(NC(=O)CC2CC(F)(F)C2)nc1-c1ccccc1	ZINC000450732321	FI	On-Demand	Anodyne	RORC	15	40
C[C@H](CO)[C@H](C)NCC(=O)NCC1(c2ccccc2)CCCC1	ZINC000450732326	DE	On-Demand	Anodyne	ACAT	0	52
C[C@H](CO)[C@H](C)NCC(=O)NCC1(c2ccccc2)CCCC1	ZINC000450732326	DE	On-Demand	Anodyne	NPFFR1	32	43
C[C@H](NCC(=O)NCC1(c2ccccc2)CCCC1)[C@@H](C)CO	ZINC000450732327	DE	On-Demand	Anodyne	ACAT	0	52
C[C@H](NCC(=O)NCC1(c2ccccc2)CCCC1)[C@@H](C)CO	ZINC000450732327	DE	On-Demand	Anodyne	NPFFR1	32	43
C[C@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CCCC1	ZINC000450732328	DE	On-Demand	Anodyne	ACAT	0	52
C[C@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CCCC1	ZINC000450732328	DE	On-Demand	Anodyne	NPFFR1	32	43
C[C@@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CCCC1	ZINC000450732329	DE	On-Demand	Anodyne	ACAT	0	52
C[C@@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CCCC1	ZINC000450732329	DE	On-Demand	Anodyne	NPFFR1	32	43
O=C(Nc1ccc(Cl)c(OC(F)F)c1)C1(C(F)(F)F)CCC1	ZINC000450732330	EJ	On-Demand	Anodyne	ENV	44	34
O=C(COc1c(Cl)cc(Cl)cc1Cl)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000450732335	GG	On-Demand	Anodyne	CACNA1I	47	33
O=C(COc1c(Cl)cc(Cl)cc1Cl)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000450732336	GG	On-Demand	Anodyne	CACNA1I	47	33
COc1cccc(OCCC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450732340	FG	On-Demand	Anodyne	GRIN2B	27	42
COc1cccc(OCCC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450732340	FG	On-Demand	Anodyne	HRH3	17	42
COc1cccc(OCCC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450732340	FG	On-Demand	Anodyne	SIGMAR1	16	44
COc1cccc(OCCC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450732340	FG	On-Demand	Anodyne	CCR3	20	43
COc1cccc(OCCC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450732340	FG	On-Demand	Anodyne	COLA	62	39
COc1cccc(OCCC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450732340	FG	On-Demand	Anodyne	CPT1A	57	39
COc1cccc(OCCC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450732340	FG	On-Demand	Anodyne	MTNR1A	23	42
COc1cccc(OCCC(=O)N2CC[C@H](COc3ccccc3)C2)c1	ZINC000450732340	FG	On-Demand	Anodyne	CHRNA10	53	37
COc1cccc(OCCC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450732341	FG	On-Demand	Anodyne	GRIN2B	27	42
COc1cccc(OCCC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450732341	FG	On-Demand	Anodyne	HRH3	17	42
COc1cccc(OCCC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450732341	FG	On-Demand	Anodyne	SIGMAR1	16	44
COc1cccc(OCCC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450732341	FG	On-Demand	Anodyne	CCR3	20	43
COc1cccc(OCCC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450732341	FG	On-Demand	Anodyne	COLA	62	39
COc1cccc(OCCC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450732341	FG	On-Demand	Anodyne	CPT1A	57	39
COc1cccc(OCCC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450732341	FG	On-Demand	Anodyne	MTNR1A	23	42
COc1cccc(OCCC(=O)N2CC[C@@H](COc3ccccc3)C2)c1	ZINC000450732341	FG	On-Demand	Anodyne	CHRNA10	53	37
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732346	EG	On-Demand	Anodyne	LTA4H	49	52
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732346	EG	On-Demand	Anodyne	CA1	30	41
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732346	EG	On-Demand	Anodyne	GUAB	0	41
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732346	EG	On-Demand	Anodyne	NPY5R	33	45
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732346	EG	On-Demand	Anodyne	ACE2	35	40
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732346	EG	On-Demand	Anodyne	PLAU	47	36
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732347	EG	On-Demand	Anodyne	LTA4H	49	52
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732347	EG	On-Demand	Anodyne	CA1	30	41
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732347	EG	On-Demand	Anodyne	GUAB	0	41
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732347	EG	On-Demand	Anodyne	NPY5R	33	45
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732347	EG	On-Demand	Anodyne	ACE2	35	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732347	EG	On-Demand	Anodyne	PLAU	47	36
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732348	EG	On-Demand	Anodyne	LTA4H	49	52
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732348	EG	On-Demand	Anodyne	CA1	30	41
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732348	EG	On-Demand	Anodyne	GUAB	0	41
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732348	EG	On-Demand	Anodyne	NPY5R	33	45
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732348	EG	On-Demand	Anodyne	ACE2	35	40
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732348	EG	On-Demand	Anodyne	PLAU	47	36
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732349	EG	On-Demand	Anodyne	LTA4H	49	52
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732349	EG	On-Demand	Anodyne	CA1	30	41
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732349	EG	On-Demand	Anodyne	GUAB	0	41
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732349	EG	On-Demand	Anodyne	NPY5R	33	45
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732349	EG	On-Demand	Anodyne	ACE2	35	40
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000450732349	EG	On-Demand	Anodyne	PLAU	47	36
Cc1cccc(C)c1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450732351	CD	On-Demand	Anodyne	ACAT	0	47
Cc1cccc(C)c1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450732352	CD	On-Demand	Anodyne	ACAT	0	47
Cc1cccc(C)c1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450732353	CD	On-Demand	Anodyne	ACAT	0	47
Cc1cccc(C)c1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450732354	CD	On-Demand	Anodyne	ACAT	0	47
Cc1cccnc1CCN=c1cc(C(=O)NC2CC2)c2ccccc2[nH]1	ZINC000450732386	EF	On-Demand	Anodyne	CNR2	20	41
CC[C@H](CC(F)(F)F)C(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1	ZINC000450732389	GJ	On-Demand	Anodyne	PI4KB	16	40
CC[C@@H](CC(F)(F)F)C(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1	ZINC000450732390	GJ	On-Demand	Anodyne	PI4KB	16	40
CC(C)CCn1nc(CNc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000450732393	GI	On-Demand	Anodyne	ADORA1	45	39
CC(C)CCn1nc(CNc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000450732393	GI	On-Demand	Anodyne	ADORA3	58	38
COC(=O)[C@@H](C)NC(=O)c1ccc(NCC2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000450732394	GE	On-Demand	Bother	TAAR1	20	41
COC(=O)[C@H](C)NC(=O)c1ccc(NCC2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000450732395	GE	On-Demand	Bother	TAAR1	20	41
COCC[C@H](NC(=O)[C@]1(C)CCC[C@H]1C)c1ccco1	ZINC000450732414	CG	On-Demand	Anodyne	NPPA	43	34
COCC[C@H](NC(=O)[C@]1(C)CCC[C@@H]1C)c1ccco1	ZINC000450732415	CG	On-Demand	Anodyne	NPPA	43	34
COCC[C@H](NC(=O)[C@@]1(C)CCC[C@H]1C)c1ccco1	ZINC000450732416	CG	On-Demand	Anodyne	NPPA	43	34
COCC[C@H](NC(=O)[C@@]1(C)CCC[C@@H]1C)c1ccco1	ZINC000450732417	CG	On-Demand	Anodyne	NPPA	43	34
CC[C@H](O)CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732430	CE	On-Demand	Anodyne	COLA	47	37
CC[C@H](O)CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732430	CE	On-Demand	Anodyne	CPT1A	45	37
CC[C@H](O)CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732430	CE	On-Demand	Anodyne	ITGA4	42	33
CC[C@H](O)CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732430	CE	On-Demand	Anodyne	RORC	47	35
CC[C@H](O)CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732431	CE	On-Demand	Anodyne	COLA	47	37
CC[C@H](O)CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732431	CE	On-Demand	Anodyne	CPT1A	45	37
CC[C@H](O)CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732431	CE	On-Demand	Anodyne	ITGA4	42	33
CC[C@H](O)CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732431	CE	On-Demand	Anodyne	RORC	47	35
CC[C@@H](O)CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732432	CE	On-Demand	Anodyne	COLA	47	37
CC[C@@H](O)CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732432	CE	On-Demand	Anodyne	CPT1A	45	37
CC[C@@H](O)CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732432	CE	On-Demand	Anodyne	ITGA4	42	33
CC[C@@H](O)CC(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732432	CE	On-Demand	Anodyne	RORC	47	35
CC[C@@H](O)CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732433	CE	On-Demand	Anodyne	COLA	47	37
CC[C@@H](O)CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732433	CE	On-Demand	Anodyne	CPT1A	45	37
CC[C@@H](O)CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732433	CE	On-Demand	Anodyne	ITGA4	42	33
CC[C@@H](O)CC(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732433	CE	On-Demand	Anodyne	RORC	47	35
COc1cc2c(NCC3(CF)CCOCC3)ncnc2cc1F	ZINC000450732434	DE	On-Demand	Anodyne	EGFR	38	42
COc1cc2c(NCC3(CF)CCOCC3)ncnc2cc1F	ZINC000450732434	DE	On-Demand	Anodyne	ERBB2	15	40
COc1cc2c(NCC3(CF)CCOCC3)ncnc2cc1F	ZINC000450732434	DE	On-Demand	Anodyne	FGFR1	22	41
COc1cc2c(NCC3(CF)CCOCC3)ncnc2cc1F	ZINC000450732434	DE	On-Demand	Anodyne	FLT1	31	42
COc1cc2c(NCC3(CF)CCOCC3)ncnc2cc1F	ZINC000450732434	DE	On-Demand	Anodyne	FBP1	15	40
COc1cc2c(NCC3(CF)CCOCC3)ncnc2cc1F	ZINC000450732434	DE	On-Demand	Anodyne	EPHA2	51	39
CCC(=O)C1(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)CC1	ZINC000450732441	DH	On-Demand	Anodyne	ENV	42	32
C1=C[C@H](Sc2nnc(-c3cccnc3)n2C2CC2)CCCCC1	ZINC000450732442	EJ	On-Demand	Anodyne	VCP	40	32
C1=C[C@@H](Sc2nnc(-c3cccnc3)n2C2CC2)CCCCC1	ZINC000450732443	EJ	On-Demand	Anodyne	VCP	40	32
C[C@H](CO)[C@H](C)NCCCOc1cccc2ccccc12	ZINC000450732456	CG	On-Demand	Anodyne	CYP2D26	0	48
C[C@H](NCCCOc1cccc2ccccc12)[C@@H](C)CO	ZINC000450732457	CG	On-Demand	Anodyne	CYP2D26	0	48
C[C@H](CO)[C@@H](C)NCCCOc1cccc2ccccc12	ZINC000450732458	CG	On-Demand	Anodyne	CYP2D26	0	48
C[C@@H](CO)[C@@H](C)NCCCOc1cccc2ccccc12	ZINC000450732459	CG	On-Demand	Anodyne	CYP2D26	0	48
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732462	GF	On-Demand	Anodyne	EGFR	49	46
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732462	GF	On-Demand	Anodyne	MAOA	21	62
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732462	GF	On-Demand	Anodyne	MAOB	41	62
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732462	GF	On-Demand	Anodyne	ERBB2	52	46
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732462	GF	On-Demand	Anodyne	GRIN2D	85	35
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732462	GF	On-Demand	Anodyne	TERT	29	44
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732462	GF	On-Demand	Anodyne	GRIN2C	40	35
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450732462	GF	On-Demand	Anodyne	A0A060INS8_CAPHI	0	51
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732463	GF	On-Demand	Anodyne	EGFR	49	46
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732463	GF	On-Demand	Anodyne	MAOA	21	62
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732463	GF	On-Demand	Anodyne	MAOB	41	62
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732463	GF	On-Demand	Anodyne	ERBB2	52	46
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732463	GF	On-Demand	Anodyne	GRIN2D	85	35
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732463	GF	On-Demand	Anodyne	TERT	29	44
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732463	GF	On-Demand	Anodyne	GRIN2C	40	35
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450732463	GF	On-Demand	Anodyne	A0A060INS8_CAPHI	0	51
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732464	GF	On-Demand	Anodyne	EGFR	49	46
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732464	GF	On-Demand	Anodyne	MAOA	21	62
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732464	GF	On-Demand	Anodyne	MAOB	41	62
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732464	GF	On-Demand	Anodyne	ERBB2	52	46
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732464	GF	On-Demand	Anodyne	GRIN2D	85	35
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732464	GF	On-Demand	Anodyne	TERT	29	44
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732464	GF	On-Demand	Anodyne	GRIN2C	40	35
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450732464	GF	On-Demand	Anodyne	A0A060INS8_CAPHI	0	51
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732465	GF	On-Demand	Anodyne	EGFR	49	46
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732465	GF	On-Demand	Anodyne	MAOA	21	62
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732465	GF	On-Demand	Anodyne	MAOB	41	62
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732465	GF	On-Demand	Anodyne	ERBB2	52	46
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732465	GF	On-Demand	Anodyne	GRIN2D	85	35
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732465	GF	On-Demand	Anodyne	TERT	29	44
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732465	GF	On-Demand	Anodyne	GRIN2C	40	35
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450732465	GF	On-Demand	Anodyne	A0A060INS8_CAPHI	0	51
Cc1ccc(NC(=O)[C@H](N[C@H](C)[C@@H](C)CO)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450732499	FG	On-Demand	Bother	COLA	72	35
Cc1ccc(NC(=O)[C@H](N[C@H](C)[C@H](C)CO)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450732500	FG	On-Demand	Bother	COLA	72	35
Cc1ccc(NC(=O)[C@H](N[C@@H](C)[C@@H](C)CO)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450732501	FG	On-Demand	Bother	COLA	72	35
Cc1ccc(NC(=O)[C@H](N[C@@H](C)[C@H](C)CO)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450732502	FG	On-Demand	Bother	COLA	72	35
CC(C)(C)OC1CC(Sc2nnc(-c3cccnc3)n2C2CC2)C1	ZINC000450732515	EI	On-Demand	Anodyne	VCP	59	35
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732520	GH	On-Demand	Anodyne	MPL	15	43
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732520	GH	On-Demand	Anodyne	ROCK1	21	42
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732520	GH	On-Demand	Anodyne	HDAC9	16	44
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732520	GH	On-Demand	Anodyne	TRPA1	21	50
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)[C@@H](C)CO	ZINC000450732521	GH	On-Demand	Anodyne	MPL	15	43
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)[C@@H](C)CO	ZINC000450732521	GH	On-Demand	Anodyne	ROCK1	21	42
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)[C@@H](C)CO	ZINC000450732521	GH	On-Demand	Anodyne	HDAC9	16	44
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1)[C@@H](C)CO	ZINC000450732521	GH	On-Demand	Anodyne	TRPA1	21	50
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732522	GH	On-Demand	Anodyne	MPL	15	43
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732522	GH	On-Demand	Anodyne	ROCK1	21	42
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732522	GH	On-Demand	Anodyne	HDAC9	16	44
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732522	GH	On-Demand	Anodyne	TRPA1	21	50
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732523	GH	On-Demand	Anodyne	MPL	15	43
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732523	GH	On-Demand	Anodyne	ROCK1	21	42
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732523	GH	On-Demand	Anodyne	HDAC9	16	44
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000450732523	GH	On-Demand	Anodyne	TRPA1	21	50
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)C1=C(c2ccccc2)CCC1	ZINC000450732531	DF	On-Demand	Anodyne	INHA	36	43
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)C1=C(c2ccccc2)CCC1	ZINC000450732532	DF	On-Demand	Anodyne	INHA	36	43
C[C@H](CO)[C@@H](C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000450732597	CD	On-Demand	Bother	GYRB	42	39
C[C@H](CO)[C@H](C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000450732598	CD	On-Demand	Bother	GYRB	42	39
C[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](C)CO	ZINC000450732599	CD	On-Demand	Bother	GYRB	42	39
C[C@@H](CO)[C@@H](C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000450732600	CD	On-Demand	Bother	GYRB	42	39
COc1cc(OC)c2ncnc(NCC3(CF)CCOCC3)c2c1	ZINC000450732616	EE	On-Demand	Anodyne	PDE6A	40	30
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nc(N(C)C)no1	ZINC000450732617	EE	On-Demand	Anodyne	PPARD	22	46
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1C	ZINC000450732640	GC	On-Demand	Anodyne	TGM2	53	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1C	ZINC000450732640	GC	On-Demand	Anodyne	F13A1	66	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1C	ZINC000450732641	GC	On-Demand	Anodyne	TGM2	53	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1C	ZINC000450732641	GC	On-Demand	Anodyne	F13A1	66	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1C	ZINC000450732642	GC	On-Demand	Anodyne	TGM2	53	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1C	ZINC000450732642	GC	On-Demand	Anodyne	F13A1	66	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1C	ZINC000450732643	GC	On-Demand	Anodyne	TGM2	53	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1C	ZINC000450732643	GC	On-Demand	Anodyne	F13A1	66	38
Cc1cccnc1CCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450732646	GF	On-Demand	Bother	PIK3CA	0	41
Cc1cccnc1CCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450732646	GF	On-Demand	Bother	NFKBIA	0	45
O=C(N1CC[C@H](COc2ccccc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450732668	GH	On-Demand	Anodyne	GRIN2B	38	42
O=C(N1CC[C@H](COc2ccccc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450732668	GH	On-Demand	Anodyne	SIGMAR1	19	43
O=C(N1CC[C@@H](COc2ccccc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450732669	GH	On-Demand	Anodyne	GRIN2B	38	42
O=C(N1CC[C@@H](COc2ccccc2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450732669	GH	On-Demand	Anodyne	SIGMAR1	19	43
CC(=O)Nc1sc(NC(=O)CCCC(C)C)nc1-c1ccccc1	ZINC000450732683	EJ	On-Demand	Anodyne	HDAC9	16	40
CC(=O)Nc1sc(NC(=O)CCCC(C)C)nc1-c1ccccc1	ZINC000450732683	EJ	On-Demand	Anodyne	RORC	15	41
Cc1ccc(F)c(CC(=O)NCc2nc(N(C)C)no2)c1	ZINC000450732686	CD	On-Demand	Anodyne	P2RX7	35	47
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC1(CF)CCOCC1	ZINC000450732705	FD	On-Demand	Anodyne	CA2	32	47
NC(=O)c1cc([N+](=O)[O-])cnc1NCC1(CF)CCOCC1	ZINC000450732716	DD	On-Demand	Bother	STAT6	47	31
Cc1ccc(F)c(CC(=O)NCc2nc(CO)cs2)c1	ZINC000450732724	CD	On-Demand	Anodyne	P2RX7	27	40
FCC1(CNc2ncnc3scc(-c4ccccc4)c23)CCOCC1	ZINC000450732744	FJ	On-Demand	Anodyne	ADRB3	24	42
C[C@H](CO)[C@H](C)NCC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1	ZINC000450732755	EG	On-Demand	Anodyne	DPP4	22	41
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1	ZINC000450732756	EG	On-Demand	Anodyne	DPP4	22	41
C[C@H](CO)[C@H](C)NCC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1	ZINC000450732757	EG	On-Demand	Anodyne	DPP4	22	41
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1	ZINC000450732758	EG	On-Demand	Anodyne	DPP4	22	41
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)C1(C)CCC(=O)CC1	ZINC000450732768	EH	On-Demand	Anodyne	SDH1	0	40
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)C1(C)CCC(=O)CC1	ZINC000450732768	EH	On-Demand	Anodyne	SCN9A	0	45
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)C1(C)CCC(=O)CC1	ZINC000450732769	EH	On-Demand	Anodyne	SDH1	0	40
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)C1(C)CCC(=O)CC1	ZINC000450732769	EH	On-Demand	Anodyne	SCN9A	0	45
Cc1cccnc1CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450732778	FF	On-Demand	Anodyne	CNR2	0	41
Cc1cccnc1CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450732778	FF	On-Demand	Anodyne	LRRK2	27	43
Cc1ccc2nc(-c3ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc3)sc2c1	ZINC000450732791	GH	On-Demand	Anodyne	CSNK1D	32	40
Cc1ccc2nc(-c3ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc3)sc2c1	ZINC000450732791	GH	On-Demand	Anodyne	APP	26	54
Cc1ccc2nc(-c3ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc3)sc2c1	ZINC000450732792	GH	On-Demand	Anodyne	CSNK1D	31	40
Cc1ccc2nc(-c3ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc3)sc2c1	ZINC000450732792	GH	On-Demand	Anodyne	APP	26	54
Cc1ccc2nc(-c3ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc3)sc2c1	ZINC000450732793	GH	On-Demand	Anodyne	CSNK1D	32	40
Cc1ccc2nc(-c3ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc3)sc2c1	ZINC000450732793	GH	On-Demand	Anodyne	APP	26	54
Cc1ccc2nc(-c3ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc3)sc2c1	ZINC000450732794	GH	On-Demand	Anodyne	CSNK1D	32	40
Cc1ccc2nc(-c3ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc3)sc2c1	ZINC000450732794	GH	On-Demand	Anodyne	APP	26	54
O=C(Nc1ccc(Cl)c(OC(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450732798	FH	On-Demand	Anodyne	TAAR1	30	41
O=C(Nc1ccc(Cl)c(OC(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450732798	FH	On-Demand	Anodyne	DGAT1	42	42
O=C(Nc1ccc(Cl)c(OC(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450732798	FH	On-Demand	Anodyne	HPGDS	19	41
CC(=O)N[C@H](C(=O)Nc1ccc(Cl)c(OC(F)F)c1)C(C)(C)C	ZINC000450732799	EG	On-Demand	Anodyne	IMDH_CRYPV	50	40
CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@H](C)CO)sc2c1CCC2	ZINC000450732811	FD	On-Demand	Anodyne	NS5B	0	52
CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@H](C)CO)sc2c1CCC2	ZINC000450732811	FD	On-Demand	Anodyne	FLT3	0	48
CCOC(=O)c1c(NC(=O)CN[C@@H](C)[C@H](C)CO)sc2c1CCC2	ZINC000450732812	FD	On-Demand	Anodyne	NS5B	0	52
CCOC(=O)c1c(NC(=O)CN[C@@H](C)[C@H](C)CO)sc2c1CCC2	ZINC000450732812	FD	On-Demand	Anodyne	FLT3	0	48
CCOC(=O)c1c(NC(=O)CN[C@@H](C)[C@@H](C)CO)sc2c1CCC2	ZINC000450732813	FD	On-Demand	Anodyne	NS5B	0	52
CCOC(=O)c1c(NC(=O)CN[C@@H](C)[C@@H](C)CO)sc2c1CCC2	ZINC000450732813	FD	On-Demand	Anodyne	FLT3	0	48
CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@@H](C)CO)sc2c1CCC2	ZINC000450732814	FD	On-Demand	Anodyne	NS5B	0	52
CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@@H](C)CO)sc2c1CCC2	ZINC000450732814	FD	On-Demand	Anodyne	FLT3	0	48
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@H](C)[C@@H](C)CO)C1	ZINC000450732818	DC	On-Demand	Anodyne	RHODESAIN	0	44
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO)C1	ZINC000450732819	DC	On-Demand	Anodyne	RHODESAIN	0	44
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@H](C)[C@H](C)CO)C1	ZINC000450732820	DC	On-Demand	Anodyne	RHODESAIN	0	44
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@@H](C)[C@H](C)CO)C1	ZINC000450732821	DC	On-Demand	Anodyne	RHODESAIN	0	44
COCC[C@@H](NC(=O)C1(C)CCC(=O)CC1)c1ccco1	ZINC000450732834	CF	On-Demand	Anodyne	NPPA	43	34
COCC[C@H](NC(=O)C1(C)CCC(=O)CC1)c1ccco1	ZINC000450732835	CF	On-Demand	Anodyne	NPPA	43	34
FCC1(CNc2ccnc3cc(Cl)ccc23)CCOCC1	ZINC000450732846	DI	On-Demand	Anodyne	HRP1_PLAFA	116	43
FCC1(CNc2ccnc3cc(Cl)ccc23)CCOCC1	ZINC000450732846	DI	On-Demand	Anodyne	HNMT	69	46
FCC1(CNc2ccnc3cc(Cl)ccc23)CCOCC1	ZINC000450732846	DI	On-Demand	Anodyne	BOTA	39	50
CSc1ccc2ncnc(NCC3(CF)CCOCC3)c2c1	ZINC000450732868	DF	On-Demand	Anodyne	CLK4	61	34
COC(=O)Cn1ncc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1C	ZINC000450732880	FD	On-Demand	Anodyne	ELANE	55	36
COC(=O)Cn1ncc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1C	ZINC000450732880	FD	On-Demand	Anodyne	HCRTR1	16	42
COC(=O)Cn1ncc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1C	ZINC000450732880	FD	On-Demand	Anodyne	PREP	92	42
COC(=O)Cn1ncc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1C	ZINC000450732880	FD	On-Demand	Anodyne	HCRTR2	18	41
COC(=O)Cn1ncc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1C	ZINC000450732880	FD	On-Demand	Anodyne	TMPRSS11D	61	33
Cc1cccc(Cl)c1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732891	EI	On-Demand	Anodyne	GRIN2B	33	42
Cc1cccc(Cl)c1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732891	EI	On-Demand	Anodyne	SIGMAR1	15	42
Cc1cccc(Cl)c1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732891	EI	On-Demand	Anodyne	CCR3	40	44
Cc1cccc(Cl)c1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732891	EI	On-Demand	Anodyne	CCR5	41	44
Cc1cccc(Cl)c1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732891	EI	On-Demand	Anodyne	CPT1A	49	36
Cc1cccc(Cl)c1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732891	EI	On-Demand	Anodyne	ITGA4	53	38
Cc1cccc(Cl)c1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450732891	EI	On-Demand	Anodyne	CHRNA10	44	37
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732892	EI	On-Demand	Anodyne	GRIN2B	33	42
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732892	EI	On-Demand	Anodyne	SIGMAR1	15	42
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732892	EI	On-Demand	Anodyne	CCR3	40	44
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732892	EI	On-Demand	Anodyne	CCR5	41	44
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732892	EI	On-Demand	Anodyne	CPT1A	49	36
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732892	EI	On-Demand	Anodyne	ITGA4	53	38
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450732892	EI	On-Demand	Anodyne	CHRNA10	44	37
C[C@H]1CCC[C@@]1(C)C(=O)NCCCOCCOCc1ccccc1	ZINC000450732902	EH	On-Demand	Anodyne	SLC12A5	42	32
C[C@H]1CCC[C@]1(C)C(=O)NCCCOCCOCc1ccccc1	ZINC000450732903	EH	On-Demand	Anodyne	SLC12A5	42	32
C[C@@H]1CCC[C@]1(C)C(=O)NCCCOCCOCc1ccccc1	ZINC000450732904	EH	On-Demand	Anodyne	SLC12A5	42	32
C[C@@H]1CCC[C@@]1(C)C(=O)NCCCOCCOCc1ccccc1	ZINC000450732905	EH	On-Demand	Anodyne	SLC12A5	42	32
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(F)cc1Cl	ZINC000450732912	DE	On-Demand	Anodyne	PYGL	19	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(F)cc1Cl	ZINC000450732913	DE	On-Demand	Anodyne	PYGL	19	40
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(F)cc1Cl	ZINC000450732914	DE	On-Demand	Anodyne	PYGL	19	40
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(F)cc1Cl	ZINC000450732915	DE	On-Demand	Anodyne	PYGL	19	40
O=C(Nc1cccc(Cl)c1)c1ccc(NCC2(CF)CCOCC2)nc1	ZINC000450732920	GI	On-Demand	Anodyne	TAAR1	18	46
O=C(Nc1cccc(Cl)c1)c1ccc(NCC2(CF)CCOCC2)nc1	ZINC000450732920	GI	On-Demand	Anodyne	KCNK3	50	39
NC(=O)c1ccc(NCC2(CF)CCOCC2)nc1	ZINC000450732928	CD	On-Demand	Anodyne	STAT6	52	32
COc1ccc(CNC(=O)CCSc2ccc(F)cc2F)c(OC)c1	ZINC000450732935	FH	On-Demand	Anodyne	GRIN2B	22	43
COc1ccc(CNC(=O)CCSc2ccc(F)cc2F)c(OC)c1	ZINC000450732935	FH	On-Demand	Anodyne	P2RX7	48	38
COc1ccc(CNC(=O)CCSc2ccc(F)cc2F)c(OC)c1	ZINC000450732935	FH	On-Demand	Anodyne	MTNR1A	55	38
C[C@H](NCC(=O)NCC1(c2ccccc2)CC1)[C@@H](C)CO	ZINC000450732944	CD	On-Demand	Anodyne	ACAT	0	50
C[C@H](CO)[C@H](C)NCC(=O)NCC1(c2ccccc2)CC1	ZINC000450732945	CD	On-Demand	Anodyne	ACAT	0	50
C[C@@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CC1	ZINC000450732946	CD	On-Demand	Anodyne	ACAT	0	50
C[C@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CC1	ZINC000450732947	CD	On-Demand	Anodyne	ACAT	0	50
Cc1cc(NCC2(CF)CCOCC2)n2ncnc2n1	ZINC000450732964	CD	On-Demand	Anodyne	DHOD	0	49
CC1(C)[C@H]2CC[C@@]1(C(=O)Nc1ccc(Cl)c(OC(F)F)c1)C(=O)C2	ZINC000450732965	FI	On-Demand	Anodyne	ENV	41	31
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000450732971	DE	On-Demand	Mild	MURF	0	48
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000450732971	DE	On-Demand	Mild	VIPR1	30	48
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000450732972	DE	On-Demand	Mild	MURF	0	48
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000450732972	DE	On-Demand	Mild	VIPR1	30	48
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000450732973	DE	On-Demand	Mild	MURF	0	48
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000450732973	DE	On-Demand	Mild	VIPR1	30	48
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000450732974	DE	On-Demand	Mild	MURF	0	48
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000450732974	DE	On-Demand	Mild	VIPR1	30	48
FCC1(CNc2ncnc3cc(Br)ccc23)CCOCC1	ZINC000450732977	FF	On-Demand	Anodyne	EGFR	60	41
C[C@H](CO)[C@H](C)NCCCOc1cccc(C(F)(F)F)c1	ZINC000450732978	DG	On-Demand	Anodyne	GALR3	49	33
C[C@H](CO)[C@H](C)NCCCOc1cccc(C(F)(F)F)c1	ZINC000450732978	DG	On-Demand	Anodyne	PDS	48	43
C[C@@H](CO)[C@@H](C)NCCCOc1cccc(C(F)(F)F)c1	ZINC000450732979	DG	On-Demand	Anodyne	GALR3	49	33
C[C@@H](CO)[C@@H](C)NCCCOc1cccc(C(F)(F)F)c1	ZINC000450732979	DG	On-Demand	Anodyne	PDS	48	43
C[C@H](NCCCOc1cccc(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450732980	DG	On-Demand	Anodyne	GALR3	49	33
C[C@H](NCCCOc1cccc(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450732980	DG	On-Demand	Anodyne	PDS	48	43
C[C@H](CO)[C@@H](C)NCCCOc1cccc(C(F)(F)F)c1	ZINC000450732981	DG	On-Demand	Anodyne	GALR3	49	33
C[C@H](CO)[C@@H](C)NCCCOc1cccc(C(F)(F)F)c1	ZINC000450732981	DG	On-Demand	Anodyne	PDS	48	43
Cc1cc(F)c(CC(=O)NCc2nc(N(C)C)no2)cc1F	ZINC000450732986	DD	On-Demand	Anodyne	P2RX7	21	41
C[C@H](CO)[C@@H](C)NCC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000450732987	DD	On-Demand	Anodyne	SSTR4	46	33
C[C@H](CO)[C@H](C)NCC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000450732988	DD	On-Demand	Anodyne	SSTR4	46	33
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000450732989	DD	On-Demand	Anodyne	SSTR4	46	33
C[C@H](NCC(=O)N1CCc2[nH]c3ccccc3c2C1)[C@@H](C)CO	ZINC000450732990	DD	On-Demand	Anodyne	SSTR4	46	33
Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450732994	DE	On-Demand	Anodyne	KCNQ2	48	34
Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450732995	DE	On-Demand	Anodyne	KCNQ2	48	34
Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450732996	DE	On-Demand	Anodyne	KCNQ2	48	34
Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450732997	DE	On-Demand	Anodyne	KCNQ2	48	34
COc1cc(CC(=O)NCc2nc(CO)cs2)ccc1Cl	ZINC000450733012	EE	On-Demand	Anodyne	CAN2	0	42
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733021	FD	On-Demand	Anodyne	HRH3	17	44
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733021	FD	On-Demand	Anodyne	MMP13	19	41
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733021	FD	On-Demand	Anodyne	FAAH	15	50
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733021	FD	On-Demand	Anodyne	MMP1	18	41
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733021	FD	On-Demand	Anodyne	CACNA1G	20	42
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733021	FD	On-Demand	Anodyne	ABHD6	0	45
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733022	FD	On-Demand	Anodyne	HRH3	17	44
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733022	FD	On-Demand	Anodyne	MMP13	19	41
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733022	FD	On-Demand	Anodyne	FAAH	15	50
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733022	FD	On-Demand	Anodyne	MMP1	18	41
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733022	FD	On-Demand	Anodyne	CACNA1G	20	42
COc1ccc(CN2CCCN(C(=O)CN[C@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733022	FD	On-Demand	Anodyne	ABHD6	0	45
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733023	FD	On-Demand	Anodyne	HRH3	17	44
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733023	FD	On-Demand	Anodyne	MMP13	19	41
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733023	FD	On-Demand	Anodyne	FAAH	15	50
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733023	FD	On-Demand	Anodyne	MMP1	18	41
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733023	FD	On-Demand	Anodyne	CACNA1G	20	42
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@@H](C)CO)CC2)cc1	ZINC000450733023	FD	On-Demand	Anodyne	ABHD6	0	45
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733024	FD	On-Demand	Anodyne	HRH3	17	44
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733024	FD	On-Demand	Anodyne	MMP13	19	41
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733024	FD	On-Demand	Anodyne	FAAH	15	50
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733024	FD	On-Demand	Anodyne	MMP1	18	41
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733024	FD	On-Demand	Anodyne	CACNA1G	20	42
COc1ccc(CN2CCCN(C(=O)CN[C@@H](C)[C@H](C)CO)CC2)cc1	ZINC000450733024	FD	On-Demand	Anodyne	ABHD6	0	45
CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@@H](C)CO)sc2c1CC[C@@H](C)C2	ZINC000450733031	GF	On-Demand	Anodyne	NS5B	0	53
CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@H](C)CO)sc2c1CC[C@@H](C)C2	ZINC000450733032	GF	On-Demand	Anodyne	NS5B	0	53
CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@@H](C)CO)sc2c1CC[C@H](C)C2	ZINC000450733033	GF	On-Demand	Anodyne	NS5B	0	53
CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@H](C)CO)sc2c1CC[C@H](C)C2	ZINC000450733034	GF	On-Demand	Anodyne	NS5B	0	53
CCc1cc(NCCc2ncccc2C)n2ncnc2n1	ZINC000450733049	CE	On-Demand	Anodyne	DHOD	0	54
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733052	EF	On-Demand	Anodyne	RAF1	23	40
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733052	EF	On-Demand	Anodyne	SLC1A1	23	40
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733052	EF	On-Demand	Anodyne	SLC1A3	22	40
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733052	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	44	42
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733052	EF	On-Demand	Anodyne	PFK	0	41
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733053	EF	On-Demand	Anodyne	RAF1	23	40
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733053	EF	On-Demand	Anodyne	SLC1A1	23	40
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733053	EF	On-Demand	Anodyne	SLC1A3	22	40
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733053	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	44	42
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733053	EF	On-Demand	Anodyne	PFK	0	41
C[C@H](NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450733054	EF	On-Demand	Anodyne	RAF1	23	40
C[C@H](NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450733054	EF	On-Demand	Anodyne	SLC1A1	23	40
C[C@H](NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450733054	EF	On-Demand	Anodyne	SLC1A3	22	40
C[C@H](NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450733054	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	44	42
C[C@H](NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450733054	EF	On-Demand	Anodyne	PFK	0	41
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733055	EF	On-Demand	Anodyne	RAF1	23	40
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733055	EF	On-Demand	Anodyne	SLC1A1	23	40
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733055	EF	On-Demand	Anodyne	SLC1A3	22	40
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733055	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	44	42
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000450733055	EF	On-Demand	Anodyne	PFK	0	41
CC[C@H](C)c1ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450733071	CF	On-Demand	Anodyne	SCN2A	17	51
CC[C@H](C)c1ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450733072	CF	On-Demand	Anodyne	SCN2A	17	51
CC[C@H](C)c1ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450733073	CF	On-Demand	Anodyne	SCN2A	17	51
CC[C@H](C)c1ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450733074	CF	On-Demand	Anodyne	SCN2A	17	51
CC(C)OC(C)(C)C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733075	DI	On-Demand	Anodyne	IMDH_CRYPV	40	40
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N1CCC[C@H]1c1cccs1	ZINC000450733082	DE	On-Demand	Anodyne	ADAM17	57	46
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N1CCC[C@H]1c1cccs1	ZINC000450733083	DE	On-Demand	Anodyne	ADAM17	57	46
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N1CCC[C@@H]1c1cccs1	ZINC000450733084	DE	On-Demand	Anodyne	ADAM17	57	46
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N1CCC[C@@H]1c1cccs1	ZINC000450733085	DE	On-Demand	Anodyne	ADAM17	57	46
CC(=O)Nc1sc(NC(=O)C2CC(C)(O)C2)nc1-c1ccccc1	ZINC000450733086	EF	On-Demand	Anodyne	ADORA1	0	49
Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](C)[C@@H](C)CO)s2)c1	ZINC000450733091	EF	On-Demand	Anodyne	CDK5	23	41
Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](C)[C@@H](C)CO)s2)c1	ZINC000450733091	EF	On-Demand	Anodyne	SCD1	24	43
Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](C)[C@@H](C)CO)s2)c1	ZINC000450733091	EF	On-Demand	Anodyne	SCD	25	40
Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](C)[C@H](C)CO)s2)c1	ZINC000450733092	EF	On-Demand	Anodyne	CDK5	23	41
Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](C)[C@H](C)CO)s2)c1	ZINC000450733092	EF	On-Demand	Anodyne	SCD1	24	43
Cc1cccc(Cc2cnc(NC(=O)CN[C@@H](C)[C@H](C)CO)s2)c1	ZINC000450733092	EF	On-Demand	Anodyne	SCD	25	40
Cc1cccc(Cc2cnc(NC(=O)CN[C@H](C)[C@@H](C)CO)s2)c1	ZINC000450733093	EF	On-Demand	Anodyne	CDK5	23	41
Cc1cccc(Cc2cnc(NC(=O)CN[C@H](C)[C@@H](C)CO)s2)c1	ZINC000450733093	EF	On-Demand	Anodyne	SCD1	24	43
Cc1cccc(Cc2cnc(NC(=O)CN[C@H](C)[C@@H](C)CO)s2)c1	ZINC000450733093	EF	On-Demand	Anodyne	SCD	25	40
Cc1cccc(Cc2cnc(NC(=O)CN[C@H](C)[C@H](C)CO)s2)c1	ZINC000450733094	EF	On-Demand	Anodyne	CDK5	23	41
Cc1cccc(Cc2cnc(NC(=O)CN[C@H](C)[C@H](C)CO)s2)c1	ZINC000450733094	EF	On-Demand	Anodyne	SCD1	24	43
Cc1cccc(Cc2cnc(NC(=O)CN[C@H](C)[C@H](C)CO)s2)c1	ZINC000450733094	EF	On-Demand	Anodyne	SCD	25	40
COc1cc(Cn2nc(C)c(C)c(C#N)c2=O)ccc1Cl	ZINC000450733102	DE	On-Demand	Mild	NPBWR1	24	40
COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450733128	FD	On-Demand	Anodyne	ADAM17	40	41
COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1OC	ZINC000450733128	FD	On-Demand	Anodyne	FAP	0	40
COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450733129	FD	On-Demand	Anodyne	ADAM17	40	41
COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@H](C)CO)cc1OC	ZINC000450733129	FD	On-Demand	Anodyne	FAP	0	40
COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450733130	FD	On-Demand	Anodyne	ADAM17	40	41
COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1OC	ZINC000450733130	FD	On-Demand	Anodyne	FAP	0	40
COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450733131	FD	On-Demand	Anodyne	ADAM17	40	41
COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1OC	ZINC000450733131	FD	On-Demand	Anodyne	FAP	0	40
Cc1ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc1S(=O)(=O)N1CCCCC1	ZINC000450733132	GD	On-Demand	Anodyne	CNR2	16	51
Cc1ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc1S(=O)(=O)N1CCCCC1	ZINC000450733132	GD	On-Demand	Anodyne	NR1H4	17	41
Cc1ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1S(=O)(=O)N1CCCCC1	ZINC000450733133	GD	On-Demand	Anodyne	CNR2	16	51
Cc1ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1S(=O)(=O)N1CCCCC1	ZINC000450733133	GD	On-Demand	Anodyne	NR1H4	17	41
Cc1ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc1S(=O)(=O)N1CCCCC1	ZINC000450733134	GD	On-Demand	Anodyne	CNR2	16	51
Cc1ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc1S(=O)(=O)N1CCCCC1	ZINC000450733134	GD	On-Demand	Anodyne	NR1H4	17	41
Cc1ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc1S(=O)(=O)N1CCCCC1	ZINC000450733135	GD	On-Demand	Anodyne	CNR2	16	51
Cc1ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc1S(=O)(=O)N1CCCCC1	ZINC000450733135	GD	On-Demand	Anodyne	NR1H4	17	41
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733154	EE	On-Demand	Anodyne	ROCK1	22	47
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733154	EE	On-Demand	Anodyne	ROCK2	15	43
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733154	EE	On-Demand	Anodyne	CAPN1	17	43
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733154	EE	On-Demand	Anodyne	HDAC9	19	54
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733154	EE	On-Demand	Anodyne	TRPA1	21	41
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733155	EE	On-Demand	Anodyne	ROCK1	22	47
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733155	EE	On-Demand	Anodyne	ROCK2	15	43
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733155	EE	On-Demand	Anodyne	CAPN1	17	43
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733155	EE	On-Demand	Anodyne	HDAC9	19	54
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733155	EE	On-Demand	Anodyne	TRPA1	21	41
C[C@H](NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1)[C@@H](C)CO	ZINC000450733156	EE	On-Demand	Anodyne	ROCK1	22	47
C[C@H](NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1)[C@@H](C)CO	ZINC000450733156	EE	On-Demand	Anodyne	ROCK2	15	43
C[C@H](NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1)[C@@H](C)CO	ZINC000450733156	EE	On-Demand	Anodyne	CAPN1	17	43
C[C@H](NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1)[C@@H](C)CO	ZINC000450733156	EE	On-Demand	Anodyne	HDAC9	19	54
C[C@H](NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1)[C@@H](C)CO	ZINC000450733156	EE	On-Demand	Anodyne	TRPA1	21	41
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733157	EE	On-Demand	Anodyne	ROCK1	22	47
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733157	EE	On-Demand	Anodyne	ROCK2	15	43
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733157	EE	On-Demand	Anodyne	CAPN1	17	43
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733157	EE	On-Demand	Anodyne	HDAC9	19	54
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450733157	EE	On-Demand	Anodyne	TRPA1	21	41
CN(C)c1nc(NCC2(CF)CCOCC2)nc2ccccc12	ZINC000450733159	DE	On-Demand	Anodyne	ADRA2A	15	46
Cc1cc(Cl)c2ncc(C#N)c(NCC3(CF)CCOCC3)c2c1	ZINC000450733196	EI	On-Demand	Mild	MAP3K8	68	41
Cc1nc(C)n(CCCC(=O)Nc2ccc(Cl)c(OC(F)F)c2)n1	ZINC000450733201	FH	On-Demand	Anodyne	IMDH_CRYPV	33	40
FCC1(CNc2cc(C(F)(F)F)nc3ncnn23)CCOCC1	ZINC000450733227	EE	On-Demand	Anodyne	DHOD	0	50
C[C@H](NCC(=O)N1CCN(c2ccccc2F)CC1)[C@@H](C)CO	ZINC000450733229	DD	On-Demand	Anodyne	MC4R	40	36
C[C@H](NCC(=O)N1CCN(c2ccccc2F)CC1)[C@@H](C)CO	ZINC000450733229	DD	On-Demand	Anodyne	KCNQ2	55	38
C[C@H](NCC(=O)N1CCN(c2ccccc2F)CC1)[C@@H](C)CO	ZINC000450733229	DD	On-Demand	Anodyne	NPY2R	63	35
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733230	DD	On-Demand	Anodyne	MC4R	40	36
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733230	DD	On-Demand	Anodyne	KCNQ2	55	38
C[C@H](CO)[C@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733230	DD	On-Demand	Anodyne	NPY2R	63	35
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733231	DD	On-Demand	Anodyne	MC4R	40	36
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733231	DD	On-Demand	Anodyne	KCNQ2	55	38
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733231	DD	On-Demand	Anodyne	NPY2R	63	35
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733232	DD	On-Demand	Anodyne	MC4R	40	36
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733232	DD	On-Demand	Anodyne	KCNQ2	55	38
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000450733232	DD	On-Demand	Anodyne	NPY2R	63	35
CCC(=O)C1(C(=O)Nc2nc(-c3ccccc3)c(NC(C)=O)s2)CC1	ZINC000450733265	FG	On-Demand	Anodyne	RORC	15	40
CC(=O)Nc1sc(NC(=O)CC2(O)CCC2)nc1-c1ccccc1	ZINC000450733283	EG	On-Demand	Anodyne	RORC	15	41
CC(=O)Nc1sc(NC(=O)CCCC(=O)C2CC2)nc1-c1ccccc1	ZINC000450733284	FH	On-Demand	Anodyne	HDAC9	19	40
CC(=O)Nc1sc(NC(=O)CCCC(=O)C2CC2)nc1-c1ccccc1	ZINC000450733284	FH	On-Demand	Anodyne	RORC	15	44
O=C(NCCc1cc(F)c(F)c(F)c1)c1ccc(N2CCC2)nc1	ZINC000450733287	EF	On-Demand	Anodyne	HDAC1	28	42
O=C(NCCc1cc(F)c(F)c(F)c1)c1ccc(N2CCC2)nc1	ZINC000450733287	EF	On-Demand	Anodyne	HPGDS	24	46
O=C(N1CC[C@@H](COc2ccccc2)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450733297	FJ	On-Demand	Anodyne	SIGMAR1	25	43
O=C(N1CC[C@@H](COc2ccccc2)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450733297	FJ	On-Demand	Anodyne	ITGA4	42	33
O=C(N1CC[C@H](COc2ccccc2)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450733298	FJ	On-Demand	Anodyne	SIGMAR1	25	43
O=C(N1CC[C@H](COc2ccccc2)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450733298	FJ	On-Demand	Anodyne	ITGA4	42	33
COCC[C@@H](NC(=O)C1=C(c2ccccc2)CCC1)c1ccco1	ZINC000450733311	EI	On-Demand	Anodyne	NPPA	44	36
COCC[C@H](NC(=O)C1=C(c2ccccc2)CCC1)c1ccco1	ZINC000450733312	EI	On-Demand	Anodyne	NPPA	44	36
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000450733326	ED	On-Demand	Anodyne	KCNQ2	22	40
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000450733327	ED	On-Demand	Anodyne	KCNQ2	22	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000450733328	ED	On-Demand	Anodyne	KCNQ2	22	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000450733329	ED	On-Demand	Anodyne	KCNQ2	22	40
CN(C)c1noc(CNC(=O)c2cncc(Cl)c2)n1	ZINC000450733333	CD	On-Demand	Anodyne	SCN10A	39	41
C[C@H](CO)[C@H](C)NCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450733349	EC	On-Demand	Anodyne	CA4	18	47
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450733350	EC	On-Demand	Anodyne	CA4	18	47
C[C@H](NCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)[C@@H](C)CO	ZINC000450733351	EC	On-Demand	Anodyne	CA4	18	47
C[C@H](CO)[C@@H](C)NCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	ZINC000450733352	EC	On-Demand	Anodyne	CA4	18	47
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733353	GH	On-Demand	Anodyne	MPL	26	45
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733353	GH	On-Demand	Anodyne	ROCK1	16	41
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733353	GH	On-Demand	Anodyne	ALPL	46	41
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733353	GH	On-Demand	Anodyne	DPP8	26	40
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733353	GH	On-Demand	Anodyne	DPP9	27	40
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1)[C@@H](C)CO	ZINC000450733354	GH	On-Demand	Anodyne	MPL	26	45
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1)[C@@H](C)CO	ZINC000450733354	GH	On-Demand	Anodyne	ROCK1	16	41
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1)[C@@H](C)CO	ZINC000450733354	GH	On-Demand	Anodyne	ALPL	46	41
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1)[C@@H](C)CO	ZINC000450733354	GH	On-Demand	Anodyne	DPP8	26	40
C[C@H](NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1)[C@@H](C)CO	ZINC000450733354	GH	On-Demand	Anodyne	DPP9	27	40
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733355	GH	On-Demand	Anodyne	MPL	26	45
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733355	GH	On-Demand	Anodyne	ROCK1	16	41
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733355	GH	On-Demand	Anodyne	ALPL	46	41
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733355	GH	On-Demand	Anodyne	DPP8	26	40
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733355	GH	On-Demand	Anodyne	DPP9	27	40
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733356	GH	On-Demand	Anodyne	MPL	26	45
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733356	GH	On-Demand	Anodyne	ROCK1	16	41
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733356	GH	On-Demand	Anodyne	ALPL	46	41
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733356	GH	On-Demand	Anodyne	DPP8	26	40
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000450733356	GH	On-Demand	Anodyne	DPP9	27	40
CC(C)CCn1nc(CNc2ncnc3c2cnn3C)c2ccccc21	ZINC000450733370	EG	On-Demand	Anodyne	ABL1	42	40
CC(C)CCn1nc(CNc2ncnc3c2cnn3C)c2ccccc21	ZINC000450733370	EG	On-Demand	Anodyne	SRC	0	40
CN(C)c1noc(CNC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450733373	ED	On-Demand	Anodyne	CTSV	44	30
O=C(CS(=O)(=O)C1CC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733376	EE	On-Demand	Anodyne	ENV	40	32
O=C(CS(=O)(=O)C1CC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733376	EE	On-Demand	Anodyne	RORC	18	40
C[C@H](CO)[C@H](C)NCC(=O)N(C)[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450733384	GG	On-Demand	Anodyne	KCNK3	122	45
C[C@H](CO)[C@H](C)NCC(=O)N(C)[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450733384	GG	On-Demand	Anodyne	KCNK9	80	42
C[C@H](CO)[C@@H](C)NCC(=O)N(C)[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450733385	GG	On-Demand	Anodyne	KCNK3	122	45
C[C@H](CO)[C@@H](C)NCC(=O)N(C)[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450733385	GG	On-Demand	Anodyne	KCNK9	80	42
C[C@H](CO)[C@@H](C)NCC(=O)N(C)[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450733386	GG	On-Demand	Anodyne	KCNK3	122	45
C[C@H](CO)[C@@H](C)NCC(=O)N(C)[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450733386	GG	On-Demand	Anodyne	KCNK9	80	42
C[C@H](CO)[C@H](C)NCC(=O)N(C)[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450733387	GG	On-Demand	Anodyne	KCNK3	122	45
C[C@H](CO)[C@H](C)NCC(=O)N(C)[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000450733387	GG	On-Demand	Anodyne	KCNK9	80	42
N#Cc1cc(Br)ccc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450733392	GH	On-Demand	Mild	GRIN2B	37	43
N#Cc1cc(Br)ccc1C(=O)N1CC[C@H](COc2ccccc2)C1	ZINC000450733392	GH	On-Demand	Mild	CHEK2	21	41
N#Cc1cc(Br)ccc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450733393	GH	On-Demand	Mild	GRIN2B	37	43
N#Cc1cc(Br)ccc1C(=O)N1CC[C@@H](COc2ccccc2)C1	ZINC000450733393	GH	On-Demand	Mild	CHEK2	21	41
O=C(Nc1ccc(Cl)c(OC(F)F)c1)[C@H](O)C1CCC1	ZINC000450733414	DG	On-Demand	Anodyne	ENV	43	33
O=C(Nc1ccc(Cl)c(OC(F)F)c1)[C@@H](O)C1CCC1	ZINC000450733415	DG	On-Demand	Anodyne	ENV	43	33
C[C@H](CO)[C@@H](C)NCC(=O)NCCC1CCCCC1	ZINC000450733417	CD	On-Demand	Anodyne	NMT1	22	40
C[C@H](CO)[C@H](C)NCC(=O)NCCC1CCCCC1	ZINC000450733418	CD	On-Demand	Anodyne	NMT1	22	40
C[C@@H](CO)[C@@H](C)NCC(=O)NCCC1CCCCC1	ZINC000450733419	CD	On-Demand	Anodyne	NMT1	22	40
C[C@H](NCC(=O)NCCC1CCCCC1)[C@@H](C)CO	ZINC000450733420	CD	On-Demand	Anodyne	NMT1	22	40
C[C@H](CO)[C@H](C)N[C@H]1CCCN(c2ccccc2)C1=O	ZINC000450733425	CD	On-Demand	Anodyne	BIRC2	42	32
C[C@H](CO)[C@@H](C)N[C@H]1CCCN(c2ccccc2)C1=O	ZINC000450733426	CD	On-Demand	Anodyne	BIRC2	42	32
C[C@H](CO)[C@@H](C)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000450733427	CD	On-Demand	Anodyne	BIRC2	42	32
C[C@H](CO)[C@H](C)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000450733428	CD	On-Demand	Anodyne	BIRC2	42	32
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H](O)C1CCC1	ZINC000450733443	DF	On-Demand	Anodyne	RBP4	42	34
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H](O)C1CCC1	ZINC000450733443	DF	On-Demand	Anodyne	SLC16A1	47	33
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H](O)C1CCC1	ZINC000450733444	DF	On-Demand	Anodyne	RBP4	42	34
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H](O)C1CCC1	ZINC000450733444	DF	On-Demand	Anodyne	SLC16A1	47	33
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H](O)C1CCC1	ZINC000450733445	DF	On-Demand	Anodyne	RBP4	42	34
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H](O)C1CCC1	ZINC000450733445	DF	On-Demand	Anodyne	SLC16A1	47	33
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H](O)C1CCC1	ZINC000450733446	DF	On-Demand	Anodyne	RBP4	42	34
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H](O)C1CCC1	ZINC000450733446	DF	On-Demand	Anodyne	SLC16A1	47	33
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733477	GI	On-Demand	Anodyne	PDE4D	16	47
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733477	GI	On-Demand	Anodyne	IMDH_CRYPV	22	40
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733477	GI	On-Demand	Anodyne	RORC	18	41
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733477	GI	On-Demand	Anodyne	PDEC	0	47
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733478	GI	On-Demand	Anodyne	PDE4D	16	47
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733478	GI	On-Demand	Anodyne	IMDH_CRYPV	22	40
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733478	GI	On-Demand	Anodyne	RORC	18	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733478	GI	On-Demand	Anodyne	PDEC	0	47
CC(C)c1ncsc1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733479	EJ	On-Demand	Anodyne	FLT1	18	43
CC(C)c1ncsc1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733479	EJ	On-Demand	Anodyne	GRM4	31	40
N#Cc1cnc2c(Br)cccc2c1NCC1(CF)CCOCC1	ZINC000450733488	GI	On-Demand	Mild	MAP3K8	40	36
Cc1cccc(OCCCNC(=O)CN[C@@H](C)[C@H](C)CO)c1	ZINC000450733497	DD	On-Demand	Anodyne	HRH2	34	40
Cc1cccc(OCCCNC(=O)CN[C@@H](C)[C@@H](C)CO)c1	ZINC000450733498	DD	On-Demand	Anodyne	HRH2	34	40
Cc1cccc(OCCCNC(=O)CN[C@H](C)[C@H](C)CO)c1	ZINC000450733499	DD	On-Demand	Anodyne	HRH2	34	40
Cc1cccc(OCCCNC(=O)CN[C@H](C)[C@@H](C)CO)c1	ZINC000450733500	DD	On-Demand	Anodyne	HRH2	34	40
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)CS(=O)(=O)C1CC1	ZINC000450733501	EE	On-Demand	Anodyne	SFRP1	50	32
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)CS(=O)(=O)C1CC1	ZINC000450733502	EE	On-Demand	Anodyne	SFRP1	50	32
C[C@@H](Sc1nnc(-c2cccnc2)n1C1CC1)C(=O)C1CCCCC1	ZINC000450733532	FI	On-Demand	Anodyne	VCP	51	34
C[C@H](Sc1nnc(-c2cccnc2)n1C1CC1)C(=O)C1CCCCC1	ZINC000450733533	FI	On-Demand	Anodyne	VCP	51	34
FCC1(CNc2nc(-c3ccc(F)cc3)cs2)CCOCC1	ZINC000450733550	DH	On-Demand	Anodyne	MAOB	21	44
C[C@]1(C(=O)N2CC[C@H](COc3ccccc3)C2)CC=CCC1	ZINC000450733571	CH	On-Demand	Anodyne	GRIN2B	24	44
C[C@H](CO)[C@H](C)NCC(=O)N(C)[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000450733592	FF	On-Demand	Anodyne	NPY5R	19	40
C[C@H](CO)[C@@H](C)NCC(=O)N(C)[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000450733593	FF	On-Demand	Anodyne	NPY5R	19	40
C[C@H](CO)[C@H](C)NCC(=O)N(C)[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000450733594	FF	On-Demand	Anodyne	NPY5R	19	40
C[C@H](CO)[C@@H](C)NCC(=O)N(C)[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000450733595	FF	On-Demand	Anodyne	NPY5R	19	40
FCC1(CNc2ccnc3cc(F)ccc23)CCOCC1	ZINC000450733597	CH	On-Demand	Anodyne	HRP1_PLAFA	61	31
FCC1(CNc2ccnc3cc(F)ccc23)CCOCC1	ZINC000450733597	CH	On-Demand	Anodyne	HNMT	42	33
Cc1cc(Cl)ccc1NC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450733600	CE	On-Demand	Anodyne	H9CNL0_SPOEX	0	41
Cc1cc(Cl)ccc1NC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450733601	CE	On-Demand	Anodyne	H9CNL0_SPOEX	0	41
Cc1cc(Cl)ccc1NC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450733602	CE	On-Demand	Anodyne	H9CNL0_SPOEX	0	41
Cc1cc(Cl)ccc1NC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450733603	CE	On-Demand	Anodyne	H9CNL0_SPOEX	0	41
Cc1nn(C)cc1CC(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450733608	EG	On-Demand	Anodyne	IMDH_CRYPV	42	47
CCC[C@H](OC)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733610	DH	On-Demand	Anodyne	SLC6A1	71	40
CCC[C@H](OC)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733610	DH	On-Demand	Anodyne	CCR1	57	54
CCC[C@H](OC)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733610	DH	On-Demand	Anodyne	DPP7	40	42
CCC[C@@H](OC)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733611	DH	On-Demand	Anodyne	SLC6A1	71	40
CCC[C@@H](OC)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733611	DH	On-Demand	Anodyne	CCR1	57	54
CCC[C@@H](OC)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733611	DH	On-Demand	Anodyne	DPP7	42	42
CCOC(=O)c1sc([C@@H](C)NCc2cc[nH]n2)nc1C	ZINC000450733617	CE	On-Demand	Anodyne	DHODH	22	40
CCOC(=O)c1sc([C@H](C)NCc2cc[nH]n2)nc1C	ZINC000450733618	CE	On-Demand	Anodyne	DHODH	22	40
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733623	DH	On-Demand	Mild	SLC6A1	49	36
C[C@@H]1C[C@@]1(C#N)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733623	DH	On-Demand	Mild	CCR1	52	48
C[C@H]1C[C@@]1(C#N)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733624	DH	On-Demand	Mild	SLC6A1	49	36
C[C@H]1C[C@@]1(C#N)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733624	DH	On-Demand	Mild	CCR1	52	48
C[C@@H]1C[C@]1(C#N)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733625	DH	On-Demand	Mild	SLC6A1	49	36
C[C@@H]1C[C@]1(C#N)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733625	DH	On-Demand	Mild	CCR1	52	48
C[C@H]1C[C@]1(C#N)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733626	DH	On-Demand	Mild	SLC6A1	49	36
C[C@H]1C[C@]1(C#N)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450733626	DH	On-Demand	Mild	CCR1	52	48
Cc1cccc(Cn2nnc(-c3cccc(C(=O)OC(C)C)c3)n2)n1	ZINC000450733627	EF	On-Demand	Anodyne	SCARB1	44	36
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCO[C@@H](C(C)C)C2)n1	ZINC000450733634	EF	On-Demand	Bother	PRKCQ	46	37
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCO[C@H](C(C)C)C2)n1	ZINC000450733635	EF	On-Demand	Bother	PRKCQ	46	37
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCO[C@H](C(C)C)C2)n1	ZINC000450733636	EF	On-Demand	Bother	PRKCQ	46	37
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCO[C@@H](C(C)C)C2)n1	ZINC000450733637	EF	On-Demand	Bother	PRKCQ	46	37
COC(=O)c1cnc(NC[C@@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450733642	EF	On-Demand	Bother	PRKCQ	46	38
COC(=O)c1cnc(NC[C@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450733643	EF	On-Demand	Bother	PRKCQ	46	38
COC(=O)c1cnc(NC[C@@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450733644	EF	On-Demand	Bother	PRKCQ	46	38
COC(=O)c1cnc(NC[C@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450733645	EF	On-Demand	Bother	PRKCQ	46	38
CC(C)[C@H]1C[C@H](CNc2ncc(C#N)cc2[N+](=O)[O-])CCO1	ZINC000450733654	DF	On-Demand	Mild	PRKCQ	45	36
CC(C)[C@@H]1C[C@@H](CNc2ncc(C#N)cc2[N+](=O)[O-])CCO1	ZINC000450733655	DF	On-Demand	Mild	PRKCQ	45	36
CC(C)[C@@H]1C[C@H](CNc2ncc(C#N)cc2[N+](=O)[O-])CCO1	ZINC000450733656	DF	On-Demand	Mild	PRKCQ	45	36
CC(C)[C@H]1C[C@@H](CNc2ncc(C#N)cc2[N+](=O)[O-])CCO1	ZINC000450733657	DF	On-Demand	Mild	PRKCQ	45	36
Cc1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)nn1C(C)C	ZINC000450733683	EI	On-Demand	Anodyne	CCR1	52	46
COCC[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccco1	ZINC000450733715	DE	On-Demand	Anodyne	HPGDS	15	41
COCC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccco1	ZINC000450733716	DE	On-Demand	Anodyne	HPGDS	15	41
COC(=O)CNC(=O)c1ccc(NCC2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000450733719	GD	On-Demand	Bother	TAAR1	20	42
O=C(c1ccc(NCC2(CF)CCOCC2)nc1)N1CCc2ccccc21	ZINC000450733774	FG	On-Demand	Anodyne	AVPR2	52	39
COc1ccc(-c2csc(NC(=O)CN[C@@H](C)[C@H](C)CO)n2)cc1	ZINC000450733778	EE	On-Demand	Anodyne	KCNQ1	0	43
COc1ccc(-c2csc(NC(=O)CN[C@@H](C)[C@H](C)CO)n2)cc1	ZINC000450733778	EE	On-Demand	Anodyne	U38	0	47
COc1ccc(-c2csc(NC(=O)CN[C@H](C)[C@@H](C)CO)n2)cc1	ZINC000450733779	EE	On-Demand	Anodyne	KCNQ1	0	43
COc1ccc(-c2csc(NC(=O)CN[C@H](C)[C@@H](C)CO)n2)cc1	ZINC000450733779	EE	On-Demand	Anodyne	U38	0	47
COc1ccc(-c2csc(NC(=O)CN[C@@H](C)[C@@H](C)CO)n2)cc1	ZINC000450733780	EE	On-Demand	Anodyne	KCNQ1	0	43
COc1ccc(-c2csc(NC(=O)CN[C@@H](C)[C@@H](C)CO)n2)cc1	ZINC000450733780	EE	On-Demand	Anodyne	U38	0	47
COc1ccc(-c2csc(NC(=O)CN[C@H](C)[C@H](C)CO)n2)cc1	ZINC000450733781	EE	On-Demand	Anodyne	KCNQ1	0	43
COc1ccc(-c2csc(NC(=O)CN[C@H](C)[C@H](C)CO)n2)cc1	ZINC000450733781	EE	On-Demand	Anodyne	U38	0	47
Cc1ccccc1CN1CCC(NC(=O)CN[C@H](C)[C@@H](C)CO)CC1	ZINC000450733782	ED	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccccc1CN1CCC(NC(=O)CN[C@H](C)[C@@H](C)CO)CC1	ZINC000450733782	ED	On-Demand	Anodyne	CCR3	18	40
Cc1ccccc1CN1CCC(NC(=O)CN[C@H](C)[C@H](C)CO)CC1	ZINC000450733783	ED	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccccc1CN1CCC(NC(=O)CN[C@H](C)[C@H](C)CO)CC1	ZINC000450733783	ED	On-Demand	Anodyne	CCR3	18	40
Cc1ccccc1CN1CCC(NC(=O)CN[C@@H](C)[C@@H](C)CO)CC1	ZINC000450733784	ED	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccccc1CN1CCC(NC(=O)CN[C@@H](C)[C@@H](C)CO)CC1	ZINC000450733784	ED	On-Demand	Anodyne	CCR3	18	40
Cc1ccccc1CN1CCC(NC(=O)CN[C@@H](C)[C@H](C)CO)CC1	ZINC000450733785	ED	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccccc1CN1CCC(NC(=O)CN[C@@H](C)[C@H](C)CO)CC1	ZINC000450733785	ED	On-Demand	Anodyne	CCR3	18	40
Cc1cccnc1CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450733786	FE	On-Demand	Bother	BCL2L1	37	40
Cc1cccnc1CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450733786	FE	On-Demand	Bother	BCL2	28	40
Cc1cccnc1CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450733786	FE	On-Demand	Bother	LRRK2	19	40
COc1cccc(-n2cc(C(=O)N3CCC(c4ccc(Cl)cc4)CC3)nn2)c1	ZINC000450733821	GH	On-Demand	Anodyne	DRD4	42	37
COc1cccc(-n2cc(C(=O)N3CCC(c4ccc(Cl)cc4)CC3)nn2)c1	ZINC000450733821	GH	On-Demand	Anodyne	CCKAR	22	46
COc1cccc(-n2cc(C(=O)N3CCC(c4ccc(Cl)cc4)CC3)nn2)c1	ZINC000450733821	GH	On-Demand	Anodyne	CCR1	43	40
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H]2COc3ccccc32)c(OC)c1	ZINC000450733828	GF	On-Demand	Anodyne	MTNR1A	55	41
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H]2COc3ccccc32)c(OC)c1	ZINC000450733828	GF	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN[C@H](C)[C@H]2COc3ccccc32)c(OC)c1	ZINC000450733829	GF	On-Demand	Anodyne	MTNR1A	55	41
COc1ccc(CNC(=O)CCN[C@H](C)[C@H]2COc3ccccc32)c(OC)c1	ZINC000450733829	GF	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H]2COc3ccccc32)c(OC)c1	ZINC000450733830	GF	On-Demand	Anodyne	MTNR1A	55	41
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H]2COc3ccccc32)c(OC)c1	ZINC000450733830	GF	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H]2COc3ccccc32)c(OC)c1	ZINC000450733831	GF	On-Demand	Anodyne	MTNR1A	55	41
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H]2COc3ccccc32)c(OC)c1	ZINC000450733831	GF	On-Demand	Anodyne	MTNR1B	46	38
CCOC(=O)c1sc([C@H](C)NCc2nnc(C(C)C)s2)nc1C	ZINC000450733832	FG	On-Demand	Anodyne	DHODH	18	42
CCOC(=O)c1sc([C@@H](C)NCc2nnc(C(C)C)s2)nc1C	ZINC000450733833	FG	On-Demand	Anodyne	DHODH	18	42
O=S(=O)(c1cccnc1NC[C@H]1CCCC1(F)F)N1CCCCC1	ZINC000450733847	FG	On-Demand	Anodyne	EPHX2	16	41
O=S(=O)(c1cccnc1NC[C@@H]1CCCC1(F)F)N1CCCCC1	ZINC000450733848	FG	On-Demand	Anodyne	EPHX2	16	41
COc1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])cc1F	ZINC000450733873	GI	On-Demand	Bother	CCR1	42	40
Fc1ccc(OCC2CC(F)(F)C2)cc1F	ZINC000450733880	BG	On-Demand	Anodyne	CHRNA10	37	50
Cc1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)ncc1C(N)=O	ZINC000450733908	FG	On-Demand	Anodyne	CCR1	45	43
Cc1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)ncc1C(N)=O	ZINC000450733908	FG	On-Demand	Anodyne	FASN	46	39
Cc1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)ncc1C(N)=O	ZINC000450733908	FG	On-Demand	Anodyne	CXCR3	19	40
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000450733911	GG	On-Demand	Anodyne	GPR142	19	40
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000450733911	GG	On-Demand	Anodyne	A0A060INS8_CAPHI	0	41
C[C@H](CO)[C@@H](C)NCC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000450733912	GG	On-Demand	Anodyne	GPR142	19	40
C[C@H](CO)[C@@H](C)NCC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000450733912	GG	On-Demand	Anodyne	A0A060INS8_CAPHI	0	41
C[C@H](NCC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1)[C@@H](C)CO	ZINC000450733913	GG	On-Demand	Anodyne	GPR142	19	40
C[C@H](NCC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1)[C@@H](C)CO	ZINC000450733913	GG	On-Demand	Anodyne	A0A060INS8_CAPHI	0	41
C[C@H](CO)[C@H](C)NCC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000450733914	GG	On-Demand	Anodyne	GPR142	19	40
C[C@H](CO)[C@H](C)NCC(=O)Nc1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000450733914	GG	On-Demand	Anodyne	A0A060INS8_CAPHI	0	41
C[C@H](CO)[C@H](C)NCc1nnc(-c2ccc(Cl)cc2Cl)o1	ZINC000450733951	EG	On-Demand	Anodyne	ALPL	41	36
C[C@@H](CO)[C@@H](C)NCc1nnc(-c2ccc(Cl)cc2Cl)o1	ZINC000450733952	EG	On-Demand	Anodyne	ALPL	41	36
C[C@H](NCc1nnc(-c2ccc(Cl)cc2Cl)o1)[C@@H](C)CO	ZINC000450733953	EG	On-Demand	Anodyne	ALPL	41	36
C[C@H](CO)[C@@H](C)NCc1nnc(-c2ccc(Cl)cc2Cl)o1	ZINC000450733954	EG	On-Demand	Anodyne	ALPL	41	36
Cc1ccc(NC(=O)c2ccc(NCC3(CF)CCOCC3)nc2)cc1	ZINC000450733972	FH	On-Demand	Anodyne	PRNP	44	31
Cc1ccc(NC(=O)c2ccc(NCC3(CF)CCOCC3)nc2)cc1	ZINC000450733972	FH	On-Demand	Anodyne	P4HTM	0	46
Cc1cc(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)nn1C(C)C	ZINC000450733980	EI	On-Demand	Anodyne	GRM4	48	43
FCC1(CNc2ncccc2OCc2ccccc2)CCOCC1	ZINC000450733983	EH	On-Demand	Anodyne	PPIA	43	46
O=C(CC1CC(F)(F)C1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450734003	EI	On-Demand	Anodyne	ENV	44	35
O=C(c1cc2ccncc2s1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734012	FJ	On-Demand	Anodyne	CCR1	43	49
CCCOc1cccc(Cn2nnc3ccccc32)c1	ZINC000450734025	CG	On-Demand	Anodyne	PTK2	25	50
C[C@H](N[C@@H](C)[C@@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734038	FI	On-Demand	Anodyne	TBXA2R	0	42
C[C@H](N[C@@H](C)[C@@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734038	FI	On-Demand	Anodyne	ALOX5AP	22	56
C[C@H](N[C@@H](C)[C@@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734038	FI	On-Demand	Anodyne	PTGES2	48	32
C[C@H](N[C@H](C)[C@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734045	FI	On-Demand	Anodyne	TBXA2R	0	42
C[C@H](N[C@H](C)[C@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734045	FI	On-Demand	Anodyne	ALOX5AP	22	56
C[C@H](N[C@H](C)[C@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734045	FI	On-Demand	Anodyne	PTGES2	48	32
C[C@H](N[C@@H](C)[C@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734048	FI	On-Demand	Anodyne	TBXA2R	0	42
C[C@H](N[C@@H](C)[C@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734048	FI	On-Demand	Anodyne	ALOX5AP	22	56
C[C@H](N[C@@H](C)[C@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734048	FI	On-Demand	Anodyne	PTGES2	48	32
C[C@H](N[C@H](C)[C@@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734050	FI	On-Demand	Anodyne	TBXA2R	0	42
C[C@H](N[C@H](C)[C@@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734050	FI	On-Demand	Anodyne	ALOX5AP	22	56
C[C@H](N[C@H](C)[C@@H](C)CO)c1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000450734050	FI	On-Demand	Anodyne	PTGES2	48	32
CC(C)[C@H]1C[C@@H](CNc2ccc(S(C)(=O)=O)cc2F)CCO1	ZINC000450734062	EG	On-Demand	Anodyne	GPR119	15	41
CC(C)[C@@H]1C[C@@H](CNc2ccc(S(C)(=O)=O)cc2F)CCO1	ZINC000450734064	EG	On-Demand	Anodyne	GPR119	15	41
CC(C)[C@H]1C[C@H](CNc2ccc(S(C)(=O)=O)cc2F)CCO1	ZINC000450734066	EG	On-Demand	Anodyne	GPR119	15	41
CC(C)[C@@H]1C[C@H](CNc2ccc(S(C)(=O)=O)cc2F)CCO1	ZINC000450734069	EG	On-Demand	Anodyne	GPR119	15	41
Cc1ccc(-c2csc(NC(=O)CN[C@H](C)[C@H](C)CO)n2)cc1	ZINC000450734092	EF	On-Demand	Anodyne	ROCK1	22	41
Cc1ccc(-c2csc(NC(=O)CN[C@H](C)[C@H](C)CO)n2)cc1	ZINC000450734092	EF	On-Demand	Anodyne	TRPA1	0	43
Cc1ccc(-c2csc(NC(=O)CN[C@@H](C)[C@H](C)CO)n2)cc1	ZINC000450734096	EF	On-Demand	Anodyne	ROCK1	22	41
Cc1ccc(-c2csc(NC(=O)CN[C@@H](C)[C@H](C)CO)n2)cc1	ZINC000450734096	EF	On-Demand	Anodyne	TRPA1	0	43
Cc1ccc(-c2csc(NC(=O)CN[C@H](C)[C@@H](C)CO)n2)cc1	ZINC000450734097	EF	On-Demand	Anodyne	ROCK1	22	41
Cc1ccc(-c2csc(NC(=O)CN[C@H](C)[C@@H](C)CO)n2)cc1	ZINC000450734097	EF	On-Demand	Anodyne	TRPA1	0	43
Cc1ccc(-c2csc(NC(=O)CN[C@@H](C)[C@@H](C)CO)n2)cc1	ZINC000450734099	EF	On-Demand	Anodyne	ROCK1	22	41
Cc1ccc(-c2csc(NC(=O)CN[C@@H](C)[C@@H](C)CO)n2)cc1	ZINC000450734099	EF	On-Demand	Anodyne	TRPA1	0	43
Cc1cccnc1CCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450734105	ED	On-Demand	Anodyne	NAMPT	28	41
CC(C)N1CCCC[C@H]1CN[C@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000450734119	EH	On-Demand	Anodyne	GRM5	0	44
CC(C)N1CCCC[C@@H]1CN[C@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000450734121	EH	On-Demand	Anodyne	GRM5	0	44
CC(C)N1CCCC[C@@H]1CN[C@@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000450734123	EH	On-Demand	Anodyne	GRM5	0	44
CC(C)N1CCCC[C@H]1CN[C@@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000450734125	EH	On-Demand	Anodyne	GRM5	0	44
Cc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c(C(C)C)n1	ZINC000450734130	EI	On-Demand	Anodyne	GRIN2B	37	43
Cc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c(C(C)C)n1	ZINC000450734133	EI	On-Demand	Anodyne	GRIN2B	37	43
Cc1nn(C)cc1CC(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734142	EG	On-Demand	Anodyne	SLC6A1	55	38
Cc1nn(C)cc1CC(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734142	EG	On-Demand	Anodyne	CCR1	24	45
C[C@H](NCC(=O)NCCCC1CCCCC1)[C@@H](C)CO	ZINC000450734167	CE	On-Demand	Anodyne	NMT1	21	43
C[C@H](CO)[C@H](C)NCC(=O)NCCCC1CCCCC1	ZINC000450734168	CE	On-Demand	Anodyne	NMT1	21	43
C[C@@H](CO)[C@@H](C)NCC(=O)NCCCC1CCCCC1	ZINC000450734169	CE	On-Demand	Anodyne	NMT1	21	43
C[C@H](CO)[C@@H](C)NCC(=O)NCCCC1CCCCC1	ZINC000450734170	CE	On-Demand	Anodyne	NMT1	21	43
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450734171	CH	On-Demand	Anodyne	ENV	40	31
C[C@H](NCC(=O)Nc1ccc(Oc2ccccc2Cl)cc1)[C@@H](C)CO	ZINC000450734174	FH	On-Demand	Anodyne	LTA4H	38	44
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Oc2ccccc2Cl)cc1	ZINC000450734175	FH	On-Demand	Anodyne	LTA4H	38	44
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2ccccc2Cl)cc1	ZINC000450734177	FH	On-Demand	Anodyne	LTA4H	38	44
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2ccccc2Cl)cc1	ZINC000450734179	FH	On-Demand	Anodyne	LTA4H	38	44
Cn1c(C#N)ccc1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734217	EH	On-Demand	Mild	SLC6A1	50	36
Cn1c(C#N)ccc1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734217	EH	On-Demand	Mild	CCR1	46	42
Cn1c(C#N)ccc1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734217	EH	On-Demand	Mild	FASN	41	34
CC[C@@H]1[C@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450734243	CG	On-Demand	Anodyne	ACE	45	38
CC[C@@H]1[C@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450734243	CG	On-Demand	Anodyne	AMY2	43	30
CC[C@@H]1[C@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450734246	CG	On-Demand	Anodyne	ACE	45	38
CC[C@@H]1[C@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450734246	CG	On-Demand	Anodyne	AMY2	43	30
CC[C@@H]1[C@@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450734247	CG	On-Demand	Anodyne	ACE	45	38
CC[C@@H]1[C@@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450734247	CG	On-Demand	Anodyne	AMY2	43	30
CC[C@@H]1[C@@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450734248	CG	On-Demand	Anodyne	ACE	45	38
CC[C@@H]1[C@@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450734248	CG	On-Demand	Anodyne	AMY2	43	30
O=C(C1CC1)C1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC1	ZINC000450734260	EH	On-Demand	Anodyne	CACNA1H	44	37
O=C(C1CC1)C1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC1	ZINC000450734260	EH	On-Demand	Anodyne	SLC6A1	41	37
O=C(C1CC1)C1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC1	ZINC000450734260	EH	On-Demand	Anodyne	CCR1	50	48
FCC1(CNc2ccnc3cc(Br)ccc23)CCOCC1	ZINC000450734263	FI	On-Demand	Anodyne	HRP1_PLAFA	50	30
FCC1(CNc2ccnc3cc(Br)ccc23)CCOCC1	ZINC000450734263	FI	On-Demand	Anodyne	HNMT	42	32
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450734268	FH	On-Demand	Anodyne	ENPP2	19	41
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450734268	FH	On-Demand	Anodyne	SCD1	26	56
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450734268	FH	On-Demand	Anodyne	SCD	29	56
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450734268	FH	On-Demand	Anodyne	HPGDS	30	45
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450734269	FH	On-Demand	Anodyne	ENPP2	19	41
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450734269	FH	On-Demand	Anodyne	SCD1	26	56
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450734269	FH	On-Demand	Anodyne	SCD	29	56
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450734269	FH	On-Demand	Anodyne	HPGDS	30	45
CCCc1cc(NCC2(CF)CCOCC2)n2ncnc2n1	ZINC000450734272	DE	On-Demand	Anodyne	DHOD	0	41
CC(=O)Nc1sc(NC(=O)CCCC(=O)C(C)(C)C)nc1-c1ccccc1	ZINC000450734278	GI	On-Demand	Anodyne	RORC	15	40
CNC(=O)c1ccc(NCC2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000450734292	EE	On-Demand	Bother	TAAR1	16	41
COc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@@H](C)CO)c([N+](=O)[O-])c1	ZINC000450734315	ED	On-Demand	Bother	TAAR1	17	43
COc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@@H](C)CO)c([N+](=O)[O-])c1	ZINC000450734315	ED	On-Demand	Bother	AKR1C2	15	46
COc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO)c([N+](=O)[O-])c1	ZINC000450734317	ED	On-Demand	Bother	TAAR1	17	43
COc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H](C)CO)c([N+](=O)[O-])c1	ZINC000450734317	ED	On-Demand	Bother	AKR1C2	15	46
COc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@H](C)CO)c([N+](=O)[O-])c1	ZINC000450734318	ED	On-Demand	Bother	TAAR1	17	43
COc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@H](C)CO)c([N+](=O)[O-])c1	ZINC000450734318	ED	On-Demand	Bother	AKR1C2	15	46
COc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@H](C)CO)c([N+](=O)[O-])c1	ZINC000450734319	ED	On-Demand	Bother	TAAR1	17	43
COc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@H](C)CO)c([N+](=O)[O-])c1	ZINC000450734319	ED	On-Demand	Bother	AKR1C2	15	46
O=C(NCC[C@H]1CCCCO1)C1(Cc2ccccc2)CCOCC1	ZINC000450734326	EG	On-Demand	Anodyne	SLC12A5	45	33
O=C(NCC[C@@H]1CCCCO1)C1(Cc2ccccc2)CCOCC1	ZINC000450734327	EG	On-Demand	Anodyne	SLC12A5	45	33
O=C(NC1CC1)c1cc(NCC2(CF)CCOCC2)nc2ccccc12	ZINC000450734341	FF	On-Demand	Anodyne	TNKS	56	32
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450734361	CD	On-Demand	Anodyne	LUXR	69	37
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450734361	CD	On-Demand	Anodyne	TRAR	77	37
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450734361	CD	On-Demand	Anodyne	LASR	49	37
C[C@H](CO)[C@H](C)NCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450734365	CD	On-Demand	Anodyne	LUXR	69	37
C[C@H](CO)[C@H](C)NCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450734365	CD	On-Demand	Anodyne	TRAR	77	37
C[C@H](CO)[C@H](C)NCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450734365	CD	On-Demand	Anodyne	LASR	49	37
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450734366	CD	On-Demand	Anodyne	LUXR	69	37
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450734366	CD	On-Demand	Anodyne	TRAR	77	37
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450734366	CD	On-Demand	Anodyne	LASR	49	37
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450734368	CD	On-Demand	Anodyne	LUXR	69	37
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450734368	CD	On-Demand	Anodyne	TRAR	77	37
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450734368	CD	On-Demand	Anodyne	LASR	49	37
Cc1ccc(NC(=O)CN[C@H](C)[C@H](C)CO)cc1F	ZINC000450734387	CD	On-Demand	Anodyne	FPR2	19	41
Cc1ccc(NC(=O)CN[C@@H](C)[C@H](C)CO)cc1F	ZINC000450734392	CD	On-Demand	Anodyne	FPR2	19	41
Cc1ccc(NC(=O)CN[C@@H](C)[C@@H](C)CO)cc1F	ZINC000450734394	CD	On-Demand	Anodyne	FPR2	19	41
Cc1ccc(NC(=O)CN[C@H](C)[C@@H](C)CO)cc1F	ZINC000450734397	CD	On-Demand	Anodyne	FPR2	19	41
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734398	FD	On-Demand	Anodyne	EPHX2	92	47
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734398	FD	On-Demand	Anodyne	P95276_MYCTO	0	41
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734399	FD	On-Demand	Anodyne	EPHX2	92	47
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734399	FD	On-Demand	Anodyne	P95276_MYCTO	0	41
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734400	FD	On-Demand	Anodyne	EPHX2	92	47
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734400	FD	On-Demand	Anodyne	P95276_MYCTO	0	41
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734401	FD	On-Demand	Anodyne	EPHX2	92	47
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734401	FD	On-Demand	Anodyne	P95276_MYCTO	0	41
CC[C@@H]1[C@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450734414	CH	On-Demand	Anodyne	OPRM1	18	43
CC[C@@H]1[C@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450734414	CH	On-Demand	Anodyne	OPRK1	50	45
CC[C@H]1[C@@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450734415	CH	On-Demand	Anodyne	OPRM1	18	43
CC[C@H]1[C@@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450734415	CH	On-Demand	Anodyne	OPRK1	50	45
CC[C@H]1[C@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450734416	CH	On-Demand	Anodyne	OPRM1	18	43
CC[C@H]1[C@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450734416	CH	On-Demand	Anodyne	OPRK1	50	45
CC[C@@H]1[C@@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450734417	CH	On-Demand	Anodyne	OPRM1	18	43
CC[C@@H]1[C@@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450734417	CH	On-Demand	Anodyne	OPRK1	50	45
C=CC(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734420	CI	On-Demand	Mild	SLC6A1	57	41
C=CC(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734420	CI	On-Demand	Mild	SLC6A3	20	41
C=CC(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734420	CI	On-Demand	Mild	CCR1	52	48
CC(C)OC(=O)c1cccc(-c2nnn(CC(=O)CC[C@H]3CCCCO3)n2)c1	ZINC000450734433	GF	On-Demand	Anodyne	SCARB1	58	44
CC(C)OC(=O)c1cccc(-c2nnn(CC(=O)CC[C@@H]3CCCCO3)n2)c1	ZINC000450734434	GF	On-Demand	Anodyne	SCARB1	58	44
O=C(CCCN1CCN2CCOC[C@@H]2C1)c1ccc(Br)cc1	ZINC000450734439	FE	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCN2CCOC[C@H]2C1)c1ccc(Br)cc1	ZINC000450734440	FE	On-Demand	Anodyne	CYP2J2	52	37
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000450734446	EF	On-Demand	Mild	MURF	0	45
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000450734446	EF	On-Demand	Mild	VIPR1	31	49
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000450734451	EF	On-Demand	Mild	MURF	0	45
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000450734451	EF	On-Demand	Mild	VIPR1	31	49
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000450734453	EF	On-Demand	Mild	MURF	0	45
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000450734453	EF	On-Demand	Mild	VIPR1	31	49
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000450734454	EF	On-Demand	Mild	MURF	0	45
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000450734454	EF	On-Demand	Mild	VIPR1	31	49
CC(C)[C@@H]1C[C@@H](CNc2ncc([N+](=O)[O-])cc2Br)CCO1	ZINC000450734492	FH	On-Demand	Bother	PRKCQ	42	36
CC(C)[C@H]1C[C@@H](CNc2ncc([N+](=O)[O-])cc2Br)CCO1	ZINC000450734493	FH	On-Demand	Bother	PRKCQ	42	36
CC(C)[C@@H]1C[C@H](CNc2ncc([N+](=O)[O-])cc2Br)CCO1	ZINC000450734494	FH	On-Demand	Bother	PRKCQ	42	36
CC(C)[C@H]1C[C@H](CNc2ncc([N+](=O)[O-])cc2Br)CCO1	ZINC000450734495	FH	On-Demand	Bother	PRKCQ	42	36
C[C@@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000450734509	EF	On-Demand	Anodyne	ACAT	0	53
C[C@@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000450734509	EF	On-Demand	Anodyne	NPFFR1	29	43
C[C@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000450734511	EF	On-Demand	Anodyne	ACAT	0	53
C[C@H](CO)[C@@H](C)NCC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000450734511	EF	On-Demand	Anodyne	NPFFR1	29	43
C[C@H](NCC(=O)NCC1(c2ccccc2)CCCCC1)[C@@H](C)CO	ZINC000450734512	EF	On-Demand	Anodyne	ACAT	0	53
C[C@H](NCC(=O)NCC1(c2ccccc2)CCCCC1)[C@@H](C)CO	ZINC000450734512	EF	On-Demand	Anodyne	NPFFR1	29	43
C[C@H](CO)[C@H](C)NCC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000450734514	EF	On-Demand	Anodyne	ACAT	0	53
C[C@H](CO)[C@H](C)NCC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000450734514	EF	On-Demand	Anodyne	NPFFR1	29	43
CC(=O)N[C@H](C(=O)N1CCC(c2ccc(Cl)cc2)CC1)C(C)(C)C	ZINC000450734535	FH	On-Demand	Anodyne	CACNA1H	45	35
CC(=O)N[C@H](C(=O)N1CCC(c2ccc(Cl)cc2)CC1)C(C)(C)C	ZINC000450734535	FH	On-Demand	Anodyne	SLC6A1	61	40
CC(=O)N[C@H](C(=O)N1CCC(c2ccc(Cl)cc2)CC1)C(C)(C)C	ZINC000450734535	FH	On-Demand	Anodyne	MC4R	42	40
CC(=O)N[C@H](C(=O)N1CCC(c2ccc(Cl)cc2)CC1)C(C)(C)C	ZINC000450734535	FH	On-Demand	Anodyne	PRCP	22	41
CC(=O)N[C@H](C(=O)N1CCC(c2ccc(Cl)cc2)CC1)C(C)(C)C	ZINC000450734535	FH	On-Demand	Anodyne	CCR1	69	57
CC(=O)N[C@H](C(=O)N1CCC(c2ccc(Cl)cc2)CC1)C(C)(C)C	ZINC000450734535	FH	On-Demand	Anodyne	MC5R	22	40
O=C(CC1(O)CCC1)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450734556	DG	On-Demand	Anodyne	ENV	43	35
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)N1CCN(c2ccccn2)CC1	ZINC000450734587	DC	On-Demand	Anodyne	SLC6A7	0	45
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N1CCN(c2ccccn2)CC1	ZINC000450734588	DC	On-Demand	Anodyne	SLC6A7	0	45
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)N1CCN(c2ccccn2)CC1	ZINC000450734589	DC	On-Demand	Anodyne	SLC6A7	0	45
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N1CCN(c2ccccn2)CC1	ZINC000450734590	DC	On-Demand	Anodyne	SLC6A7	0	45
O=[N+]([O-])c1ccc(NCC2(CF)CCOCC2)cc1C(F)(F)F	ZINC000450734591	EH	On-Demand	Bother	AADAC	0	44
CCN(CC)S(=O)(=O)c1ccc(NCCc2ncccc2C)c([N+](=O)[O-])c1	ZINC000450734606	GF	On-Demand	Bother	BDKRB1	24	46
Cc1nnnn1-c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c(F)c1	ZINC000450734619	GH	On-Demand	Anodyne	PRCP	59	41
Cc1nnnn1-c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c(F)c1	ZINC000450734619	GH	On-Demand	Anodyne	CCR1	44	40
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734644	FJ	On-Demand	Anodyne	PRCP	22	42
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734644	FJ	On-Demand	Anodyne	CCR1	47	40
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734644	FJ	On-Demand	Anodyne	RBP4	43	40
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450734644	FJ	On-Demand	Anodyne	SFRP1	28	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCO[C@@H](C(C)C)C1	ZINC000450734645	FD	On-Demand	Anodyne	CA2	25	44
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCO[C@H](C(C)C)C1	ZINC000450734646	FD	On-Demand	Anodyne	CA2	25	44
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCO[C@@H](C(C)C)C1	ZINC000450734647	FD	On-Demand	Anodyne	CA2	25	44
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCO[C@H](C(C)C)C1	ZINC000450734648	FD	On-Demand	Anodyne	CA2	25	44
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734661	GD	On-Demand	Anodyne	LPL	48	38
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734661	GD	On-Demand	Anodyne	EPHX2	16	42
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734661	GD	On-Demand	Anodyne	TGM2	65	44
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734661	GD	On-Demand	Anodyne	F13A1	99	49
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734661	GD	On-Demand	Anodyne	RAC1	0	42
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734661	GD	On-Demand	Anodyne	NAMPT	34	48
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734661	GD	On-Demand	Anodyne	DDIT3	0	44
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@@H](C)CO	ZINC000450734665	GD	On-Demand	Anodyne	LPL	48	38
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@@H](C)CO	ZINC000450734665	GD	On-Demand	Anodyne	EPHX2	16	42
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@@H](C)CO	ZINC000450734665	GD	On-Demand	Anodyne	TGM2	65	44
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@@H](C)CO	ZINC000450734665	GD	On-Demand	Anodyne	F13A1	99	49
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@@H](C)CO	ZINC000450734665	GD	On-Demand	Anodyne	RAC1	0	42
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@@H](C)CO	ZINC000450734665	GD	On-Demand	Anodyne	NAMPT	34	48
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)[C@@H](C)CO	ZINC000450734665	GD	On-Demand	Anodyne	DDIT3	0	44
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734666	GD	On-Demand	Anodyne	LPL	48	38
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734666	GD	On-Demand	Anodyne	EPHX2	16	42
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734666	GD	On-Demand	Anodyne	TGM2	65	44
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734666	GD	On-Demand	Anodyne	F13A1	99	49
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734666	GD	On-Demand	Anodyne	RAC1	0	42
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734666	GD	On-Demand	Anodyne	NAMPT	34	48
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734666	GD	On-Demand	Anodyne	DDIT3	0	44
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734667	GD	On-Demand	Anodyne	LPL	48	38
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734667	GD	On-Demand	Anodyne	EPHX2	16	42
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734667	GD	On-Demand	Anodyne	TGM2	65	44
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734667	GD	On-Demand	Anodyne	F13A1	99	49
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734667	GD	On-Demand	Anodyne	RAC1	0	42
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734667	GD	On-Demand	Anodyne	NAMPT	34	48
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000450734667	GD	On-Demand	Anodyne	DDIT3	0	44
O=C(CCCC(=O)N1CCC(c2ccc(Cl)cc2)CC1)C1CC1	ZINC000450734692	EI	On-Demand	Anodyne	CCR1	52	48
O=C(CCCC(=O)N1CCC(c2ccc(Cl)cc2)CC1)C1CC1	ZINC000450734692	EI	On-Demand	Anodyne	ETHR	40	32
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000450734693	ED	On-Demand	Anodyne	MC4R	42	37
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000450734694	ED	On-Demand	Anodyne	MC4R	42	37
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000450734695	ED	On-Demand	Anodyne	MC4R	42	37
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000450734696	ED	On-Demand	Anodyne	MC4R	42	37
COc1cc(OC)c2ncc(C#N)c(NCC3(CF)CCOCC3)c2c1	ZINC000450734704	FG	On-Demand	Mild	SRC	43	35
CCOC(=O)c1sc([C@@H](C)NCc2cccc(C(=O)OC)c2Cl)nc1C	ZINC000450734721	GH	On-Demand	Anodyne	DHODH	20	40
CCOC(=O)c1sc([C@H](C)NCc2cccc(C(=O)OC)c2Cl)nc1C	ZINC000450734723	GH	On-Demand	Anodyne	DHODH	20	40
COC(=O)CCCCCn1c(SCn2cccn2)nc2ccccc2c1=O	ZINC000450734724	GG	On-Demand	Anodyne	CYP74A	0	41
C[C@H](CO)[C@H](C)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000450734729	DC	On-Demand	Anodyne	SLC6A7	0	44
CC(C)OC(=O)c1cccc(-c2nnn(C[C@H]3COCCO3)n2)c1	ZINC000450734730	ED	On-Demand	Anodyne	SCARB1	48	37
C[C@H](NCCC(=O)N1CCN(c2ccccn2)CC1)[C@@H](C)CO	ZINC000450734731	DC	On-Demand	Anodyne	SLC6A7	0	44
CC(C)OC(=O)c1cccc(-c2nnn(C[C@@H]3COCCO3)n2)c1	ZINC000450734732	ED	On-Demand	Anodyne	SCARB1	48	37
C[C@H](CO)[C@@H](C)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000450734733	DC	On-Demand	Anodyne	SLC6A7	0	44
C[C@@H](CO)[C@@H](C)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000450734735	DC	On-Demand	Anodyne	SLC6A7	0	44
COCc1cc([N+](=O)[O-])ccc1NC[C@H]1CCCC1(F)F	ZINC000450734740	DH	On-Demand	Bother	CACNA1D	51	33
COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCC1(F)F	ZINC000450734741	DH	On-Demand	Bother	CACNA1D	51	33
COC(=O)CCCCCn1c(SCC2(C#N)CCC2)nc2ccccc2c1=O	ZINC000450734742	GH	On-Demand	Mild	TNKS	40	32
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)C1=C(c2ccccc2)CCCC1	ZINC000450734777	EG	On-Demand	Anodyne	INHA	36	43
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)C1=C(c2ccccc2)CCCC1	ZINC000450734778	EG	On-Demand	Anodyne	INHA	36	43
COc1ccc(OC(F)(F)F)c(C(=O)NCc2nc(CO)cs2)c1	ZINC000450734784	FE	On-Demand	Anodyne	PPARD	24	42
COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@H](C)CO)c(OC)c1	ZINC000450734785	FD	On-Demand	Anodyne	FAP	0	42
COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@H](C)CO)c(OC)c1	ZINC000450734786	FD	On-Demand	Anodyne	FAP	0	42
COc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@@H](C)CO)c(OC)c1	ZINC000450734787	FD	On-Demand	Anodyne	FAP	0	42
COc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@@H](C)CO)c(OC)c1	ZINC000450734788	FD	On-Demand	Anodyne	FAP	0	42
COCC[C@H](NC(=O)[C@@]1(C)CC=CCC1)c1ccco1	ZINC000450734800	CG	On-Demand	Anodyne	NPPA	41	32
COCC[C@@H](NC(=O)[C@@]1(C)CC=CCC1)c1ccco1	ZINC000450734801	CG	On-Demand	Anodyne	NPPA	41	32
COCC[C@@H](NC(=O)[C@]1(C)CC=CCC1)c1ccco1	ZINC000450734802	CG	On-Demand	Anodyne	NPPA	41	32
COCC[C@H](NC(=O)[C@]1(C)CC=CCC1)c1ccco1	ZINC000450734803	CG	On-Demand	Anodyne	NPPA	41	32
COc1ccccc1-c1noc([C@@H](C)NC[C@](C)(O)C(C)=O)n1	ZINC000450734819	DD	On-Demand	Anodyne	LUCI_PHOPE	30	43
COc1ccccc1-c1noc([C@H](C)NC[C@@](C)(O)C(C)=O)n1	ZINC000450734820	DD	On-Demand	Anodyne	LUCI_PHOPE	30	43
COc1ccccc1-c1noc([C@H](C)NC[C@](C)(O)C(C)=O)n1	ZINC000450734821	DD	On-Demand	Anodyne	LUCI_PHOPE	30	43
COc1ccccc1-c1noc([C@@H](C)NC[C@@](C)(O)C(C)=O)n1	ZINC000450734822	DD	On-Demand	Anodyne	LUCI_PHOPE	30	43
CCCc1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)no1	ZINC000450734823	EI	On-Demand	Anodyne	CCR1	47	44
CN(C)c1noc(CNC(=O)c2ccc3c(c2)OC(F)(F)O3)n1	ZINC000450734900	ED	On-Demand	Anodyne	BRAF	23	42
COc1ccc2c(NCC3(CF)CCOCC3)ncnc2c1F	ZINC000450734904	DE	On-Demand	Anodyne	PDE6A	40	30
CC1CCN(C(=O)c2ccc(NCC3(CF)CCOCC3)nc2)CC1	ZINC000450734915	EG	On-Demand	Anodyne	BDKRB1	0	41
COc1cccc(C(=O)CCCC(=O)NCc2nc(CO)cs2)c1	ZINC000450734919	EE	On-Demand	Anodyne	DRD4	40	31
CC(=O)c1ccc(NCC2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000450734922	DF	On-Demand	Bother	TAAR1	16	40
COc1cccc(OCCC(=O)NCCc2cc(F)c(F)c(F)c2)c1	ZINC000450734947	FG	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCC(=O)NCCc2cc(F)c(F)c(F)c2)c1	ZINC000450734947	FG	On-Demand	Anodyne	MTNR1A	91	42
COc1cccc(OCCC(=O)NCCc2cc(F)c(F)c(F)c2)c1	ZINC000450734947	FG	On-Demand	Anodyne	MTNR1B	76	45
COc1cccc(OCCC(=O)NCCc2cc(F)c(F)c(F)c2)c1	ZINC000450734947	FG	On-Demand	Anodyne	CAN2	0	45
COc1cccc(OCCC(=O)NCCc2cc(F)c(F)c(F)c2)c1	ZINC000450734947	FG	On-Demand	Anodyne	PDS	45	36
CC1(O)CC(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)C1	ZINC000450734959	DG	On-Demand	Anodyne	ENV	48	38
C[C@H](CO)[C@@H](C)NCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734967	ED	On-Demand	Anodyne	EPHX2	80	46
C[C@H](NCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)[C@@H](C)CO	ZINC000450734968	ED	On-Demand	Anodyne	EPHX2	80	46
C[C@@H](CO)[C@@H](C)NCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734969	ED	On-Demand	Anodyne	EPHX2	80	46
C[C@H](CO)[C@H](C)NCC(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450734970	ED	On-Demand	Anodyne	EPHX2	80	46
C[C@H](CO)[C@H](C)NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734977	FG	On-Demand	Anodyne	OPRK1	31	40
C[C@H](CO)[C@H](C)NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734977	FG	On-Demand	Anodyne	KCNA5	18	42
C[C@H](CO)[C@H](C)NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734977	FG	On-Demand	Anodyne	FAP	0	40
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734978	FG	On-Demand	Anodyne	OPRK1	31	40
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734978	FG	On-Demand	Anodyne	KCNA5	18	42
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734978	FG	On-Demand	Anodyne	FAP	0	40
C[C@H](CO)[C@H](C)NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734979	FG	On-Demand	Anodyne	OPRK1	31	40
C[C@H](CO)[C@H](C)NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734979	FG	On-Demand	Anodyne	KCNA5	18	42
C[C@H](CO)[C@H](C)NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734979	FG	On-Demand	Anodyne	FAP	0	40
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734980	FG	On-Demand	Anodyne	OPRK1	31	40
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734980	FG	On-Demand	Anodyne	KCNA5	18	42
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000450734980	FG	On-Demand	Anodyne	FAP	0	40
COCc1cc(NCCc2ncccc2C)n2ncnc2n1	ZINC000450735002	CD	On-Demand	Anodyne	DHOD	0	42
O=C(Cc1scnc1-c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450735003	GI	On-Demand	Anodyne	COLA	71	38
O=C(Cc1scnc1-c1ccccc1)N1CC[C@H](COc2ccccc2)C1	ZINC000450735003	GI	On-Demand	Anodyne	CPT1A	68	38
O=C(Cc1scnc1-c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450735004	GI	On-Demand	Anodyne	COLA	71	38
O=C(Cc1scnc1-c1ccccc1)N1CC[C@@H](COc2ccccc2)C1	ZINC000450735004	GI	On-Demand	Anodyne	CPT1A	68	38
CC(C)Oc1cccc(CNC(=O)CN[C@@H](C)[C@@H](C)CO)c1	ZINC000450735008	DD	On-Demand	Anodyne	PDS	45	33
CC(C)Oc1cccc(CNC(=O)CN[C@@H](C)[C@H](C)CO)c1	ZINC000450735009	DD	On-Demand	Anodyne	PDS	45	33
CC(C)O[C@@]1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CCOC1	ZINC000450735019	FH	On-Demand	Anodyne	CCR1	50	44
CC(C)O[C@]1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CCOC1	ZINC000450735020	FH	On-Demand	Anodyne	CCR1	50	44
O=[N+]([O-])c1ccc(NC[C@H]2CCCC2(F)F)c(S(=O)(=O)N2CCCC2)c1	ZINC000450735033	GG	On-Demand	Bother	EPHX2	18	47
O=[N+]([O-])c1ccc(NC[C@@H]2CCCC2(F)F)c(S(=O)(=O)N2CCCC2)c1	ZINC000450735034	GG	On-Demand	Bother	EPHX2	18	47
CC(C)Oc1cccc(CNC(=O)CN[C@H](C)[C@@H](C)CO)c1	ZINC000450735036	DD	On-Demand	Anodyne	PDS	45	33
CC(C)Oc1cccc(CNC(=O)CN[C@H](C)[C@H](C)CO)c1	ZINC000450735038	DD	On-Demand	Anodyne	PDS	45	33
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](C)C2	ZINC000450735058	FH	On-Demand	Anodyne	PREP	42	41
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](C)C2	ZINC000450735058	FH	On-Demand	Anodyne	WNT3	40	32
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](C)C2	ZINC000450735058	FH	On-Demand	Anodyne	O60989_PLAVI	0	40
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@@H](C)C2	ZINC000450735058	FH	On-Demand	Anodyne	TMPRSS11D	47	33
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](C)C2	ZINC000450735060	FH	On-Demand	Anodyne	PREP	42	41
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](C)C2	ZINC000450735060	FH	On-Demand	Anodyne	WNT3	40	32
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](C)C2	ZINC000450735060	FH	On-Demand	Anodyne	O60989_PLAVI	0	40
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)[C@H](C)C2	ZINC000450735060	FH	On-Demand	Anodyne	TMPRSS11D	47	33
COc1cc(CN[C@H](C)c2nc(-c3ccccc3OC)no2)ccc1Cl	ZINC000450735083	FI	On-Demand	Anodyne	LUCI_PHOPE	30	43
FCC1(CNc2ccnc3cc(C(F)(F)F)ccc23)CCOCC1	ZINC000450735088	EI	On-Demand	Anodyne	HNMT	40	31
COc1cc(CN[C@@H](C)c2nc(-c3ccccc3OC)no2)ccc1Cl	ZINC000450735097	FI	On-Demand	Anodyne	LUCI_PHOPE	30	43
CC(F)(F)C(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735099	EJ	On-Demand	Anodyne	SLC6A1	55	41
CC(F)(F)C(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735099	EJ	On-Demand	Anodyne	SLC6A3	18	41
CC(F)(F)C(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735099	EJ	On-Demand	Anodyne	CCR1	57	45
O=C(C[C@@H]1CC[C@H]2C[C@H]12)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735108	DI	On-Demand	Anodyne	SLC6A1	49	38
O=C(C[C@@H]1CC[C@H]2C[C@H]12)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735108	DI	On-Demand	Anodyne	CCR1	47	44
CCCOc1cccc(CSc2nnc(-c3cccnc3)n2C2CC2)c1	ZINC000450735112	FJ	On-Demand	Anodyne	VCP	48	36
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735117	DI	On-Demand	Anodyne	SLC6A1	49	38
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735117	DI	On-Demand	Anodyne	CCR1	47	44
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735118	DI	On-Demand	Anodyne	SLC6A1	49	38
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735118	DI	On-Demand	Anodyne	CCR1	47	44
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735121	DI	On-Demand	Anodyne	SLC6A1	49	38
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735121	DI	On-Demand	Anodyne	CCR1	47	44
CC(C)OC(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735124	DI	On-Demand	Anodyne	SLC6A1	58	41
CC(C)OC(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735124	DI	On-Demand	Anodyne	PRCP	20	42
CC(C)OC(C)(C)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735124	DI	On-Demand	Anodyne	CCR1	53	48
FC1(F)CCC[C@@H]1CNc1nc2ccccc2nc1N1CCOCC1	ZINC000450735146	EG	On-Demand	Anodyne	STAT6	47	32
O=C(NCCCOCCOCc1ccccc1)c1c[nH]c2nccc-2c1	ZINC000450735147	FF	On-Demand	Anodyne	KDM4E	21	40
FC1(F)CCC[C@H]1CNc1nc2ccccc2nc1N1CCOCC1	ZINC000450735148	EG	On-Demand	Anodyne	STAT6	47	32
COCC1=CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450735157	EE	On-Demand	Bother	CACNA1C	44	35
COCC1=CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450735157	EE	On-Demand	Bother	CACNA1D	75	35
COC(=O)c1coc(CSc2nnc(N3CCCC3)n2-c2ccc(C)cc2)n1	ZINC000450735164	GG	On-Demand	Anodyne	TNKS2	15	41
COc1ccccc1-c1noc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)n1	ZINC000450735165	FH	On-Demand	Anodyne	LUCI_PHOPE	32	47
COc1ccccc1-c1noc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)n1	ZINC000450735166	FH	On-Demand	Anodyne	LUCI_PHOPE	32	47
COc1ccccc1-c1noc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)n1	ZINC000450735167	FH	On-Demand	Anodyne	LUCI_PHOPE	32	47
COc1ccccc1-c1noc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)n1	ZINC000450735169	FH	On-Demand	Anodyne	LUCI_PHOPE	32	47
CC(=O)c1cn(CC(=O)N2CCC(c3ccc(Cl)cc3)CC2)nn1	ZINC000450735170	EF	On-Demand	Anodyne	CCR1	47	41
CCn1c2ccccc2c2cc(NC(=O)CN[C@@H](C)[C@H](C)CO)ccc21	ZINC000450735194	FG	On-Demand	Anodyne	NPY2R	25	63
CCn1c2ccccc2c2cc(NC(=O)CN[C@@H](C)[C@H](C)CO)ccc21	ZINC000450735194	FG	On-Demand	Anodyne	NPY5R	17	60
CCn1c2ccccc2c2cc(NC(=O)CN[C@@H](C)[C@H](C)CO)ccc21	ZINC000450735194	FG	On-Demand	Anodyne	IMDH_CRYPV	48	34
CCn1c2ccccc2c2cc(NC(=O)CN[C@@H](C)[C@@H](C)CO)ccc21	ZINC000450735195	FG	On-Demand	Anodyne	NPY2R	25	63
CCn1c2ccccc2c2cc(NC(=O)CN[C@@H](C)[C@@H](C)CO)ccc21	ZINC000450735195	FG	On-Demand	Anodyne	NPY5R	17	60
CCn1c2ccccc2c2cc(NC(=O)CN[C@@H](C)[C@@H](C)CO)ccc21	ZINC000450735195	FG	On-Demand	Anodyne	IMDH_CRYPV	48	34
CCn1c2ccccc2c2cc(NC(=O)CN[C@H](C)[C@H](C)CO)ccc21	ZINC000450735196	FG	On-Demand	Anodyne	NPY2R	25	63
CCn1c2ccccc2c2cc(NC(=O)CN[C@H](C)[C@H](C)CO)ccc21	ZINC000450735196	FG	On-Demand	Anodyne	NPY5R	17	60
CCn1c2ccccc2c2cc(NC(=O)CN[C@H](C)[C@H](C)CO)ccc21	ZINC000450735196	FG	On-Demand	Anodyne	IMDH_CRYPV	48	34
CCn1c2ccccc2c2cc(NC(=O)CN[C@H](C)[C@@H](C)CO)ccc21	ZINC000450735197	FG	On-Demand	Anodyne	NPY2R	25	63
CCn1c2ccccc2c2cc(NC(=O)CN[C@H](C)[C@@H](C)CO)ccc21	ZINC000450735197	FG	On-Demand	Anodyne	NPY5R	17	60
CCn1c2ccccc2c2cc(NC(=O)CN[C@H](C)[C@@H](C)CO)ccc21	ZINC000450735197	FG	On-Demand	Anodyne	IMDH_CRYPV	48	34
C[C@H](N[C@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450735206	DF	On-Demand	Anodyne	ACPS	0	40
C[C@H](N[C@H](C)[C@H](C)CO)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450735207	DF	On-Demand	Anodyne	ACPS	0	40
C[C@H](N[C@@H](C)[C@@H](C)CO)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450735208	DF	On-Demand	Anodyne	ACPS	0	40
C[C@H](N[C@@H](C)[C@H](C)CO)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000450735209	DF	On-Demand	Anodyne	ACPS	0	40
COC(=O)Cn1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)c1C	ZINC000450735212	FD	On-Demand	Anodyne	CSNK1D	18	40
O=C(NCCN1C(=O)NC2(CCCC2)C1=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450735239	GD	On-Demand	Anodyne	PLD2	59	34
N#Cc1ccnc(NCC2(CF)CCOCC2)c1	ZINC000450735245	BE	On-Demand	Mild	MAP3K12	50	39
CN(C)S(=O)(=O)c1ccc(NCC2(CF)CCOCC2)c([N+](=O)[O-])c1	ZINC000450735246	GE	On-Demand	Bother	BDKRB1	0	40
Cc1ccc(C(=O)N2CCc3nnc(O)cc3C2)c(Cl)c1Cl	ZINC000450735247	EF	On-Demand	Anodyne	P2RX7	34	40
Cc1ccc(C(=O)N2CCc3nnc(O)cc3C2)c(Cl)c1Cl	ZINC000450735247	EF	On-Demand	Anodyne	HSP90AB1	17	40
Cc1cccc(Cl)c1C(=O)N1CCN(C(C)C)C(=O)C1	ZINC000450735254	CE	On-Demand	Anodyne	P2RX7	30	56
Cc1cccnc1CCNc1ncnc2sc3c(c12)CCC3	ZINC000450735273	DH	On-Demand	Anodyne	RBP4	16	40
C[C@H](CO)[C@@H](C)NCCCCOc1cccc(C(F)(F)F)c1	ZINC000450735287	DG	On-Demand	Anodyne	GALR3	49	33
C[C@H](CO)[C@@H](C)NCCCCOc1cccc(C(F)(F)F)c1	ZINC000450735287	DG	On-Demand	Anodyne	PDS	48	42
C[C@H](CO)[C@H](C)NCCCCOc1cccc(C(F)(F)F)c1	ZINC000450735288	DG	On-Demand	Anodyne	GALR3	49	33
C[C@H](CO)[C@H](C)NCCCCOc1cccc(C(F)(F)F)c1	ZINC000450735288	DG	On-Demand	Anodyne	PDS	48	42
C[C@@H](CO)[C@@H](C)NCCCCOc1cccc(C(F)(F)F)c1	ZINC000450735290	DG	On-Demand	Anodyne	GALR3	49	33
C[C@@H](CO)[C@@H](C)NCCCCOc1cccc(C(F)(F)F)c1	ZINC000450735290	DG	On-Demand	Anodyne	PDS	48	42
C[C@H](NCCCCOc1cccc(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450735292	DG	On-Demand	Anodyne	GALR3	49	33
C[C@H](NCCCCOc1cccc(C(F)(F)F)c1)[C@@H](C)CO	ZINC000450735292	DG	On-Demand	Anodyne	PDS	48	42
CC(C)CCCC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450735300	EI	On-Demand	Anodyne	PRKCD	15	41
CC(C)CCCC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450735300	EI	On-Demand	Anodyne	NAMPT	17	41
O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450735301	FH	On-Demand	Anodyne	RBP4	46	33
O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450735302	FH	On-Demand	Anodyne	RBP4	46	33
O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450735303	FH	On-Demand	Anodyne	RBP4	46	33
O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450735304	FH	On-Demand	Anodyne	RBP4	46	33
C[C@H](CO)[C@H](C)NCC(=O)N1CCc2sccc2[C@H]1c1ccccc1	ZINC000450735337	FF	On-Demand	Anodyne	TRPM8	24	49
C[C@H](CO)[C@H](C)NCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1	ZINC000450735338	FF	On-Demand	Anodyne	TRPM8	24	49
C[C@H](CO)[C@@H](C)NCC(=O)N1CCc2sccc2[C@H]1c1ccccc1	ZINC000450735339	FF	On-Demand	Anodyne	TRPM8	24	49
C[C@H](CO)[C@@H](C)NCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1	ZINC000450735340	FF	On-Demand	Anodyne	TRPM8	24	49
CC(=O)N[C@H](C(=O)NC[C@H](C)C(F)(F)F)C(C)(C)C	ZINC000450735346	CD	On-Demand	Anodyne	PROTEASE	20	43
CC(=O)N[C@H](C(=O)NC[C@@H](C)C(F)(F)F)C(C)(C)C	ZINC000450735347	CD	On-Demand	Anodyne	PROTEASE	20	43
CCCCOc1ccc(NC(=O)[C@@H]2CC(=O)N(CC)[C@H]2c2cccnc2)cn1	ZINC000450735360	GG	On-Demand	Anodyne	NAMPT	29	41
O=C1CC[C@@H](CCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)N1	ZINC000450735406	EG	On-Demand	Anodyne	SLC6A1	41	36
O=C1CC[C@@H](CCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)N1	ZINC000450735406	EG	On-Demand	Anodyne	CCR1	46	43
O=C1CC[C@@H](CCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)N1	ZINC000450735406	EG	On-Demand	Anodyne	GRIN2D	62	31
O=C1CC[C@H](CCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)N1	ZINC000450735407	EG	On-Demand	Anodyne	SLC6A1	41	36
O=C1CC[C@H](CCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)N1	ZINC000450735407	EG	On-Demand	Anodyne	CCR1	46	43
O=C1CC[C@H](CCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)N1	ZINC000450735407	EG	On-Demand	Anodyne	GRIN2D	62	31
Cc1c(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)nn2c1OCCC2	ZINC000450735433	FH	On-Demand	Anodyne	CCR1	44	40
O=C(c1ccsn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735438	DH	On-Demand	Anodyne	CCR1	46	41
O=C(c1ccsn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735438	DH	On-Demand	Anodyne	TRPC6	34	41
O=C(c1ccsn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735438	DH	On-Demand	Anodyne	TRPC3	17	41
COCC(=O)NC1CN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450735486	EC	On-Demand	Anodyne	INHA	59	34
COCC(=O)NC1CN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450735486	EC	On-Demand	Anodyne	P2RY12	83	32
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450735502	DH	On-Demand	Anodyne	PPARA	17	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450735502	DH	On-Demand	Anodyne	PPARD	39	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450735502	DH	On-Demand	Anodyne	SORT1	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450735502	DH	On-Demand	Anodyne	MTTP	55	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450735502	DH	On-Demand	Anodyne	CCR2	46	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](C)C(F)(F)F	ZINC000450735503	DH	On-Demand	Anodyne	PPARA	17	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](C)C(F)(F)F	ZINC000450735503	DH	On-Demand	Anodyne	PPARD	39	42
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](C)C(F)(F)F	ZINC000450735503	DH	On-Demand	Anodyne	SORT1	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](C)C(F)(F)F	ZINC000450735503	DH	On-Demand	Anodyne	MTTP	55	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H](C)C(F)(F)F	ZINC000450735503	DH	On-Demand	Anodyne	CCR2	46	40
CO[C@@H](Cc1ccccc1)C(=O)NCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450735536	FD	On-Demand	Anodyne	MME	63	36
CO[C@H](Cc1ccccc1)C(=O)NCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450735537	FD	On-Demand	Anodyne	MME	63	36
CC(C)NC(=O)c1ccc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450735577	EH	On-Demand	Bother	TAAR1	19	41
CC(C)NC(=O)c1ccc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450735578	EH	On-Demand	Bother	TAAR1	19	41
COC(=O)c1ccc(CN2CCC(C)(CN3CCN(C)CC3)CC2)cc1Cl	ZINC000450735616	GF	On-Demand	Anodyne	ADAM17	17	41
COC(=O)c1ccc(CN2CCC(C)(CN3CCN(C)CC3)CC2)cc1Cl	ZINC000450735616	GF	On-Demand	Anodyne	MCHR2	54	34
COc1nccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450735636	FD	On-Demand	Anodyne	MMP13	33	41
COc1nccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450735636	FD	On-Demand	Anodyne	IKBKB	0	42
COc1nccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450735636	FD	On-Demand	Anodyne	PKM	16	50
Cc1noc(-c2cccnc2NC[C@@H]2CCCC2(F)F)n1	ZINC000450735672	CG	On-Demand	Anodyne	KCNQ1	0	43
COc1ccc2nc(C)nc(NCCc3ncccc3C)c2c1	ZINC000450735674	DF	On-Demand	Anodyne	SYK	22	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	MMP13	28	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	CTSK	33	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	CTSL	23	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	MMP2	32	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	MMP3	17	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	MMP14	16	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	CTSS	27	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	CAPN1	18	58
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	MMP9	21	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	MMP7	23	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	ADAMTS4	57	37
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	PSMB5	32	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](C)C(F)(F)F)cc1	ZINC000450735678	GG	On-Demand	Anodyne	LEF	53	39
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	MMP13	28	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	CTSK	33	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	CTSL	23	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	MMP2	32	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	MMP3	17	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	MMP14	16	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	CTSS	27	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	CAPN1	18	58
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	MMP9	21	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	MMP7	23	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	ADAMTS4	57	37
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	PSMB5	32	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](C)C(F)(F)F)cc1	ZINC000450735679	GG	On-Demand	Anodyne	LEF	53	39
O=C(NCc1noc(-c2cccc(F)c2)n1)[C@H]1CCN(c2ccccc2)C1	ZINC000450735682	FG	On-Demand	Anodyne	PDE8B	56	33
O=C(NCc1noc(-c2cccc(F)c2)n1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450735683	FG	On-Demand	Anodyne	PDE8B	56	33
O=C(NCCN1C(=O)NC2(CCCC2)C1=O)c1cncc(Cl)c1	ZINC000450735696	ED	On-Demand	Anodyne	PLD2	53	36
Cc1noc(-c2cccnc2NC[C@H]2CCCC2(F)F)n1	ZINC000450735719	CG	On-Demand	Anodyne	KCNQ1	0	43
Cc1onc(C2CC2)c1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735743	EJ	On-Demand	Anodyne	CCR1	46	42
C[C@H](CO)[C@H](C)NCc1ccc(OCc2ccc(F)cc2)cc1	ZINC000450735749	DH	On-Demand	Anodyne	ACE2	19	46
C[C@H](CO)[C@H](C)NCc1ccc(OCc2ccc(F)cc2)cc1	ZINC000450735749	DH	On-Demand	Anodyne	FFAR1	15	44
C[C@H](NCc1ccc(OCc2ccc(F)cc2)cc1)[C@@H](C)CO	ZINC000450735750	DH	On-Demand	Anodyne	ACE2	19	46
C[C@H](NCc1ccc(OCc2ccc(F)cc2)cc1)[C@@H](C)CO	ZINC000450735750	DH	On-Demand	Anodyne	FFAR1	15	44
C[C@H](CO)[C@@H](C)NCc1ccc(OCc2ccc(F)cc2)cc1	ZINC000450735751	DH	On-Demand	Anodyne	FFAR1	15	44
C[C@@H](CO)[C@@H](C)NCc1ccc(OCc2ccc(F)cc2)cc1	ZINC000450735752	DH	On-Demand	Anodyne	ACE2	19	46
C[C@@H](CO)[C@@H](C)NCc1ccc(OCc2ccc(F)cc2)cc1	ZINC000450735752	DH	On-Demand	Anodyne	FFAR1	15	44
CCNC(=O)c1ccc(NC[C@H]2CCCC2(F)F)nc1	ZINC000450735760	CF	On-Demand	Anodyne	KCNQ1	0	41
CCNC(=O)c1ccc(NC[C@@H]2CCCC2(F)F)nc1	ZINC000450735761	CF	On-Demand	Anodyne	KCNQ1	0	41
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1	ZINC000450735815	EE	On-Demand	Anodyne	MCHR1	15	45
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1	ZINC000450735817	EE	On-Demand	Anodyne	MCHR1	15	45
CCOC(=O)c1sc([C@H](C)NCCN(C)Cc2ccccc2)nc1C	ZINC000450735818	FG	On-Demand	Anodyne	DHODH	24	42
C[C@H](NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1)[C@@H](C)CO	ZINC000450735819	EE	On-Demand	Anodyne	MCHR1	15	45
CCOC(=O)c1sc([C@@H](C)NCCN(C)Cc2ccccc2)nc1C	ZINC000450735820	FG	On-Demand	Anodyne	DHODH	24	42
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1	ZINC000450735827	EE	On-Demand	Anodyne	MCHR1	15	45
CCCCOc1ccc(NC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])cn1	ZINC000450735833	FH	On-Demand	Bother	TAAR1	17	41
CCCCOc1ccc(NC(=O)Cc2ccc(O)c(OC)c2)cn1	ZINC000450735834	EG	On-Demand	Anodyne	INHA	54	38
CCCCOc1ccc(NC(=O)Cc2ccc(O)c(OC)c2)cn1	ZINC000450735834	EG	On-Demand	Anodyne	TRPV1	26	55
CCCCOc1ccc(NC(=O)Cc2ccc(O)c(OC)c2)cn1	ZINC000450735834	EG	On-Demand	Anodyne	ENPP1	52	33
COc1ccc(CNC(=O)CCN[C@H](C)c2cn[nH]c2)c(OC)c1	ZINC000450735836	ED	On-Demand	Anodyne	MTNR1A	50	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2cn[nH]c2)c(OC)c1	ZINC000450735841	ED	On-Demand	Anodyne	MTNR1A	50	38
CCn1nnc(C)c1COc1ccc(Cl)cc1C(N)=O	ZINC000450735843	CD	On-Demand	Anodyne	PTGER1	40	36
COCC1=CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450735851	DG	On-Demand	Anodyne	LIPG	40	35
COc1cc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1Cl	ZINC000450735858	GF	On-Demand	Anodyne	CASP3	22	45
COc1cc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1Cl	ZINC000450735858	GF	On-Demand	Anodyne	MMP13	43	41
COc1cc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1Cl	ZINC000450735858	GF	On-Demand	Anodyne	PKM	19	45
COc1cc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1Cl	ZINC000450735858	GF	On-Demand	Anodyne	CASP7	0	45
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCCC1(F)F	ZINC000450735862	ED	On-Demand	Anodyne	CA2	35	50
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1CCCC1(F)F	ZINC000450735862	ED	On-Demand	Anodyne	CA7	36	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCCC1(F)F	ZINC000450735863	ED	On-Demand	Anodyne	CA2	35	50
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1CCCC1(F)F	ZINC000450735863	ED	On-Demand	Anodyne	CA7	36	40
Cc1nc2ccnn2cc1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450735893	FH	On-Demand	Anodyne	CCR1	45	42
CCOC(=O)c1sc([C@@H](C)NCc2cccc(S(C)(=O)=O)c2)nc1C	ZINC000450735927	GF	On-Demand	Anodyne	DHODH	22	40
CCOC(=O)c1sc([C@H](C)NCc2cccc(S(C)(=O)=O)c2)nc1C	ZINC000450735931	GF	On-Demand	Anodyne	DHODH	22	40
CCC(CC)(NCc1cccc(S(C)(=O)=O)c1)C(=O)OC	ZINC000450735938	DD	On-Demand	Anodyne	PTPRB	50	40
CC(=O)c1cccc(Cn2nnc(-c3cccc(C(=O)OC(C)C)c3)n2)c1	ZINC000450735943	FG	On-Demand	Anodyne	MGLL	0	43
CC(=O)c1cccc(Cn2nnc(-c3cccc(C(=O)OC(C)C)c3)n2)c1	ZINC000450735943	FG	On-Demand	Anodyne	SCARB1	43	36
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735955	ED	On-Demand	Anodyne	MMP13	51	46
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735955	ED	On-Demand	Anodyne	ADAM17	33	40
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735955	ED	On-Demand	Anodyne	MMP3	35	46
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735955	ED	On-Demand	Anodyne	MMP7	47	42
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735955	ED	On-Demand	Anodyne	MMP1	36	46
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735958	ED	On-Demand	Anodyne	MMP13	51	46
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735958	ED	On-Demand	Anodyne	ADAM17	33	40
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735958	ED	On-Demand	Anodyne	MMP3	35	46
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735958	ED	On-Demand	Anodyne	MMP7	47	42
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450735958	ED	On-Demand	Anodyne	MMP1	36	46
CCc1cc2c(=O)n(Cc3ccc(Cl)c(OC)c3)cnc2s1	ZINC000450735967	EH	On-Demand	Anodyne	SCD1	0	44
CCc1cc2c(=O)n(Cc3ccc(Cl)c(OC)c3)cnc2s1	ZINC000450735967	EH	On-Demand	Anodyne	NPBWR1	59	38
CCCCOc1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cn1	ZINC000450735992	FG	On-Demand	Anodyne	PRNP	40	33
CCCCOc1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cn1	ZINC000450735992	FG	On-Demand	Anodyne	GCK	23	41
O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@@H]1CC12CCSCC2	ZINC000450736006	FH	On-Demand	Anodyne	NAMPT	23	42
O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@H]1CC12CCSCC2	ZINC000450736008	FH	On-Demand	Anodyne	NAMPT	23	42
CC(C)(C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)C1CCC1	ZINC000450736033	EI	On-Demand	Anodyne	NAMPT	28	42
COC(=O)c1c(C)nc(O)nc1SCc1ccn(CCc2ccccc2)n1	ZINC000450736057	GG	On-Demand	Anodyne	FAS	30	40
O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@@H]1CCCCC1(F)F	ZINC000450736134	FI	On-Demand	Anodyne	NAMPT	24	41
O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@H]1CCCCC1(F)F	ZINC000450736136	FI	On-Demand	Anodyne	NAMPT	24	41
CCOC(=O)c1sc([C@@H](C)NCc2ccc(Cl)c(OC)c2)nc1C	ZINC000450736158	FI	On-Demand	Anodyne	DHODH	23	44
CCOC(=O)c1sc([C@H](C)NCc2ccc(Cl)c(OC)c2)nc1C	ZINC000450736164	FI	On-Demand	Anodyne	DHODH	23	44
CC(C)OC(=O)c1cccc(-c2nnn(CCC(C)(F)F)n2)c1	ZINC000450736175	DF	On-Demand	Anodyne	SCARB1	47	37
COc1ccccc1-c1noc([C@H](C)NCCC[C@@H](C)O)n1	ZINC000450736192	DF	On-Demand	Anodyne	LUCI_PHOPE	33	46
COc1ccccc1-c1noc([C@@H](C)NCCC[C@H](C)O)n1	ZINC000450736195	DF	On-Demand	Anodyne	LUCI_PHOPE	33	46
COc1ccccc1-c1noc([C@H](C)NCCC[C@H](C)O)n1	ZINC000450736196	DF	On-Demand	Anodyne	LUCI_PHOPE	33	46
COc1ccccc1-c1noc([C@@H](C)NCCC[C@@H](C)O)n1	ZINC000450736198	DF	On-Demand	Anodyne	LUCI_PHOPE	33	46
CCc1cccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450736200	EI	On-Demand	Anodyne	CCR1	53	49
CCc1cccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450736200	EI	On-Demand	Anodyne	MCHR1	17	42
CCc1cccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450736200	EI	On-Demand	Anodyne	TRPC6	33	40
CCc1cccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450736200	EI	On-Demand	Anodyne	TRPC3	17	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NCc1cn(CC2CC2)nn1	ZINC000450736204	FF	On-Demand	Anodyne	GBA	18	42
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NCc1cn(CC2CC2)nn1	ZINC000450736205	FF	On-Demand	Anodyne	GBA	18	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NCc1cn(CC2CC2)nn1	ZINC000450736206	FF	On-Demand	Anodyne	GBA	18	42
C[C@H](NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1)[C@@H](C)CO	ZINC000450736252	FH	On-Demand	Anodyne	ADRB3	22	41
C[C@H](NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1)[C@@H](C)CO	ZINC000450736252	FH	On-Demand	Anodyne	LTA4H	38	46
C[C@H](NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1)[C@@H](C)CO	ZINC000450736252	FH	On-Demand	Anodyne	MTNR1B	17	47
C[C@H](NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1)[C@@H](C)CO	ZINC000450736252	FH	On-Demand	Anodyne	PFKFB3	41	35
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736253	FH	On-Demand	Anodyne	ADRB3	22	41
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736253	FH	On-Demand	Anodyne	LTA4H	38	46
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736253	FH	On-Demand	Anodyne	MTNR1B	17	47
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736253	FH	On-Demand	Anodyne	PFKFB3	41	35
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736254	FH	On-Demand	Anodyne	ADRB3	22	41
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736254	FH	On-Demand	Anodyne	LTA4H	38	46
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736254	FH	On-Demand	Anodyne	MTNR1B	17	47
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736254	FH	On-Demand	Anodyne	PFKFB3	41	35
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736273	FH	On-Demand	Anodyne	ADRB3	22	41
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736273	FH	On-Demand	Anodyne	LTA4H	38	46
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736273	FH	On-Demand	Anodyne	MTNR1B	17	47
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1	ZINC000450736273	FH	On-Demand	Anodyne	PFKFB3	41	35
CCCCOc1ccc(NC(=O)CCc2ccc(C(N)=O)cc2)cn1	ZINC000450736297	EF	On-Demand	Anodyne	ACR	24	40
CCCCOc1ccc(NC(=O)CCc2ccc(C(N)=O)cc2)cn1	ZINC000450736297	EF	On-Demand	Anodyne	PPO2	40	39
CCCCOc1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cn1	ZINC000450736387	DF	On-Demand	Anodyne	ACACA	43	38
CCCCOc1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cn1	ZINC000450736387	DF	On-Demand	Anodyne	MMP3	25	40
CCCCOc1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cn1	ZINC000450736387	DF	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
C[C@H](CNC(=O)c1cc2cccnc2s1)C(F)(F)F	ZINC000450736396	CG	On-Demand	Anodyne	SUCNR1	53	35
C[C@@H](CNC(=O)c1cc2cccnc2s1)C(F)(F)F	ZINC000450736397	CG	On-Demand	Anodyne	SUCNR1	53	35
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(c2nnc3n2CCCC3)CC1	ZINC000450736425	FF	On-Demand	Anodyne	L3MBTL3	48	31
CNS(=O)(=O)NCC(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450736429	FC	On-Demand	Anodyne	CTSL	22	45
CNS(=O)(=O)NCC(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F	ZINC000450736430	FC	On-Demand	Anodyne	CTSL	22	45
CSc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c1	ZINC000450736446	FI	On-Demand	Anodyne	MAPK14	19	41
CSc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c1	ZINC000450736446	FI	On-Demand	Anodyne	NAMPT	0	41
CSc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC2CC2)c1	ZINC000450736446	FI	On-Demand	Anodyne	KCNK3	77	34
O=S(=O)(c1ccc(NC[C@H]2CCCC2(F)F)nc1)N1CCCC1	ZINC000450736492	EE	On-Demand	Anodyne	TGM2	22	40
COCC(=O)NC1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450736495	ED	On-Demand	Anodyne	CACNA1B	41	34
COCC(=O)NC1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450736495	ED	On-Demand	Anodyne	CCR2	71	39
COCC(=O)NC1CN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450736495	ED	On-Demand	Anodyne	LIPG	47	37
O=S(=O)(c1ccc(NC[C@@H]2CCCC2(F)F)nc1)N1CCCC1	ZINC000450736497	EE	On-Demand	Anodyne	TGM2	22	40
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450736516	GD	On-Demand	Anodyne	MMP13	63	38
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450736516	GD	On-Demand	Anodyne	ADAM17	55	38
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450736516	GD	On-Demand	Anodyne	MMP3	50	39
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450736516	GD	On-Demand	Anodyne	MMP7	48	36
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450736516	GD	On-Demand	Anodyne	MMP1	52	39
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450736516	GD	On-Demand	Anodyne	NAMPT	21	41
COc1ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc1S(C)(=O)=O	ZINC000450736524	EE	On-Demand	Anodyne	CPT1A	47	33
CCOC(=O)c1sc([C@@H](C)NCC/C=C/c2ccccc2)nc1C	ZINC000450736531	EI	On-Demand	Anodyne	DHODH	26	44
CCOC(=O)c1sc([C@H](C)NCC/C=C/c2ccccc2)nc1C	ZINC000450736532	EI	On-Demand	Anodyne	DHODH	26	44
CCOC(=O)c1sc([C@@H](C)NCC/C=C\c2ccccc2)nc1C	ZINC000450736533	EI	On-Demand	Anodyne	DHODH	26	44
CCOC(=O)c1sc([C@H](C)NCC/C=C\c2ccccc2)nc1C	ZINC000450736534	EI	On-Demand	Anodyne	DHODH	26	44
COc1ccc(C(=O)NC[C@H](C)C(F)(F)F)cc1S(C)(=O)=O	ZINC000450736538	EE	On-Demand	Anodyne	CPT1A	47	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450736556	DF	On-Demand	Anodyne	CTSK	24	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450736556	DF	On-Demand	Anodyne	CTSL	25	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450736556	DF	On-Demand	Anodyne	CTSS	25	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450736557	DF	On-Demand	Anodyne	CTSK	24	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450736557	DF	On-Demand	Anodyne	CTSL	25	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450736557	DF	On-Demand	Anodyne	CTSS	25	41
C[C@H](CO)[C@@H](C)NCCC(=O)Nc1cccnc1	ZINC000450736563	CD	On-Demand	Anodyne	NAMPT	20	40
C[C@H](CO)[C@H](C)NCCC(=O)Nc1cccnc1	ZINC000450736564	CD	On-Demand	Anodyne	NAMPT	20	40
CCOC(=O)[C@H](NCCN(C)Cc1ccccc1)C1CCOCC1	ZINC000450736565	EE	On-Demand	Anodyne	AMY2	52	31
CCOC(=O)[C@@H](NCCN(C)Cc1ccccc1)C1CCOCC1	ZINC000450736566	EE	On-Demand	Anodyne	AMY2	52	31
COc1ccccc1-c1noc([C@H](C)NCCN(C)Cc2ccccc2)n1	ZINC000450736567	FH	On-Demand	Anodyne	LUCI_PHOPE	32	45
COc1ccccc1-c1noc([C@@H](C)NCCN(C)Cc2ccccc2)n1	ZINC000450736568	FH	On-Demand	Anodyne	LUCI_PHOPE	32	45
C[C@H](NCCC(=O)Nc1cccnc1)[C@@H](C)CO	ZINC000450736569	CD	On-Demand	Anodyne	NAMPT	20	40
CCOC(=O)c1sc([C@@H](C)NCc2cccc(C)n2)nc1C	ZINC000450736570	DG	On-Demand	Anodyne	DHODH	23	42
C[C@@H](CO)[C@@H](C)NCCC(=O)Nc1cccnc1	ZINC000450736571	CD	On-Demand	Anodyne	NAMPT	20	40
CCOC(=O)c1sc([C@H](C)NCc2cccc(C)n2)nc1C	ZINC000450736575	DG	On-Demand	Anodyne	DHODH	23	42
CC(=O)c1cccc(CSc2nc3ccccc3c(=O)n2C2CC2)c1	ZINC000450736612	FI	On-Demand	Anodyne	PTGDR2	15	57
CC(C)OC(=O)c1cccc(-c2nnn(Cc3nnc(C4CC4)s3)n2)c1	ZINC000450736672	FF	On-Demand	Anodyne	SCARB1	50	38
CC(C)OC(=O)c1cccc(-c2nnn(C[C@@H]3CCCC3(F)F)n2)c1	ZINC000450736685	FG	On-Demand	Anodyne	SCARB1	54	41
CC(C)OC(=O)c1cccc(-c2nnn(C[C@H]3CCCC3(F)F)n2)c1	ZINC000450736686	FG	On-Demand	Anodyne	SCARB1	54	41
O=C([C@@H]1CC12CCSCC2)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450736717	EJ	On-Demand	Anodyne	CCR1	44	40
O=C([C@H]1CC12CCSCC2)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450736721	EJ	On-Demand	Anodyne	CCR1	44	40
Cn1c(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c2n(c1=O)CCCC2	ZINC000450736752	FG	On-Demand	Anodyne	CCR1	43	43
CCCCOc1ccc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cn1	ZINC000450736754	EH	On-Demand	Anodyne	SCN10A	22	41
CCCCOc1ccc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cn1	ZINC000450736754	EH	On-Demand	Anodyne	DGAT1	19	49
CC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450736765	EG	On-Demand	Mild	MMP1	22	41
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450736767	EG	On-Demand	Mild	MMP1	22	41
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450736769	EG	On-Demand	Mild	MMP1	22	41
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450736771	EG	On-Demand	Mild	MMP1	22	41
Cn1cc(-c2ccc(C(=O)N3CCC(c4ccc(Cl)cc4)CC3)o2)cn1	ZINC000450736791	FI	On-Demand	Anodyne	CCR1	44	41
Cn1cc(-c2ccc(C(=O)N3CCC(c4ccc(Cl)cc4)CC3)o2)cn1	ZINC000450736791	FI	On-Demand	Anodyne	SCN10A	18	51
CC(C)[C@H]1C[C@H](CNc2cc(C(F)(F)F)nc3ncnn23)CCO1	ZINC000450736798	EG	On-Demand	Anodyne	DHOD	0	46
CC(C)[C@@H]1C[C@H](CNc2cc(C(F)(F)F)nc3ncnn23)CCO1	ZINC000450736800	EG	On-Demand	Anodyne	DHOD	0	46
CC(C)[C@@H]1C[C@@H](CNc2cc(C(F)(F)F)nc3ncnn23)CCO1	ZINC000450736801	EG	On-Demand	Anodyne	DHOD	0	46
CC(C)[C@H]1C[C@@H](CNc2cc(C(F)(F)F)nc3ncnn23)CCO1	ZINC000450736802	EG	On-Demand	Anodyne	DHOD	0	46
Cc1cccnc1CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450736826	ED	On-Demand	Anodyne	NPY1R	40	33
Cc1cccnc1CCNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450736826	ED	On-Demand	Anodyne	NPY2R	61	36
CSc1cccc(C(=O)NCCN2C(=O)NC3(CCCC3)C2=O)c1	ZINC000450736870	EE	On-Demand	Anodyne	DRD4	46	36
Cc1ccc(F)c(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450736875	FF	On-Demand	Anodyne	PKM	35	40
Cc1ccc(F)c(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450736875	FF	On-Demand	Anodyne	ADAMTS4	23	41
NC(=O)c1ncc(Br)cc1NC[C@H]1CCCC1(F)F	ZINC000450736937	EF	On-Demand	Anodyne	SYK	45	33
NC(=O)c1ncc(Br)cc1NC[C@@H]1CCCC1(F)F	ZINC000450736938	EF	On-Demand	Anodyne	SYK	45	33
C[C@H](CO)[C@H](C)NCC[C@@H](C)OCc1ccccc1	ZINC000450736977	CF	On-Demand	Anodyne	KLK3	40	33
C[C@H](CO)[C@@H](C)NCC[C@@H](C)OCc1ccccc1	ZINC000450736978	CF	On-Demand	Anodyne	KLK3	40	33
C[C@H](CCN[C@H](C)[C@@H](C)CO)OCc1ccccc1	ZINC000450736979	CF	On-Demand	Anodyne	KLK3	40	33
C[C@H](NCC[C@@H](C)OCc1ccccc1)[C@@H](C)CO	ZINC000450736980	CF	On-Demand	Anodyne	KLK3	40	33
CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450736984	EE	On-Demand	Anodyne	COLA	66	35
CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450736984	EE	On-Demand	Anodyne	CPT1A	62	35
CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450736985	EE	On-Demand	Anodyne	COLA	66	35
CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450736985	EE	On-Demand	Anodyne	CPT1A	62	35
CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450736986	EE	On-Demand	Anodyne	COLA	66	35
CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@H](C)[C@H](C)CO)cc1	ZINC000450736986	EE	On-Demand	Anodyne	CPT1A	62	35
CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450736987	EE	On-Demand	Anodyne	COLA	66	35
CCOc1ccc([C@@H]2CCCN2C(=O)CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450736987	EE	On-Demand	Anodyne	CPT1A	62	35
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@H](C)C(F)(F)F)cc2)c1	ZINC000450737039	GH	On-Demand	Anodyne	CHRM3	17	47
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@H](C)C(F)(F)F)cc2)c1	ZINC000450737039	GH	On-Demand	Anodyne	GRIN2B	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@H](C)C(F)(F)F)cc2)c1	ZINC000450737039	GH	On-Demand	Anodyne	ANPEP	18	45
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@H](C)C(F)(F)F)cc2)c1	ZINC000450737039	GH	On-Demand	Anodyne	MMP13	21	50
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@H](C)C(F)(F)F)cc2)c1	ZINC000450737039	GH	On-Demand	Anodyne	PPARD	18	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@H](C)C(F)(F)F)cc2)c1	ZINC000450737039	GH	On-Demand	Anodyne	CTRC	42	33
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@H](C)C(F)(F)F)cc2)c1	ZINC000450737039	GH	On-Demand	Anodyne	CARM1	47	34
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@H](C)C(F)(F)F)cc2)c1	ZINC000450737039	GH	On-Demand	Anodyne	KCNK3	40	34
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc2)c1	ZINC000450737040	GH	On-Demand	Anodyne	CHRM3	17	47
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc2)c1	ZINC000450737040	GH	On-Demand	Anodyne	GRIN2B	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc2)c1	ZINC000450737040	GH	On-Demand	Anodyne	ANPEP	18	45
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc2)c1	ZINC000450737040	GH	On-Demand	Anodyne	MMP13	21	50
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc2)c1	ZINC000450737040	GH	On-Demand	Anodyne	PPARD	18	42
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc2)c1	ZINC000450737040	GH	On-Demand	Anodyne	CTRC	42	33
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc2)c1	ZINC000450737040	GH	On-Demand	Anodyne	CARM1	47	34
Cc1cccc(CNC(=O)c2ccc(C(=O)NC[C@@H](C)C(F)(F)F)cc2)c1	ZINC000450737040	GH	On-Demand	Anodyne	KCNK3	40	34
COC(=O)c1ccc(CN[C@H](C)c2noc(Cc3ccccc3)n2)cc1Cl	ZINC000450737041	GH	On-Demand	Anodyne	TPSAB1	77	36
COC(=O)c1ccc(CN[C@@H](C)c2noc(Cc3ccccc3)n2)cc1Cl	ZINC000450737042	GH	On-Demand	Anodyne	TPSAB1	77	36
Cc1cccnc1CCNc1cc(N2CCOCC2)ncn1	ZINC000450737054	CD	On-Demand	Anodyne	EPHB4	48	34
C[C@H](CO)[C@H](C)NC[C@@H]1CCc2ccccc2C1	ZINC000450737056	BE	On-Demand	Anodyne	NPY1R	0	43
C[C@H](CO)[C@@H](C)NC[C@H]1CCc2ccccc2C1	ZINC000450737057	BE	On-Demand	Anodyne	NPY1R	0	43
C[C@H](CO)[C@@H](C)NC[C@@H]1CCc2ccccc2C1	ZINC000450737058	BE	On-Demand	Anodyne	NPY1R	0	43
C[C@H](CO)[C@H](C)NC[C@H]1CCc2ccccc2C1	ZINC000450737059	BE	On-Demand	Anodyne	NPY1R	0	43
COCC(=O)NC1CN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450737064	GD	On-Demand	Anodyne	HPGD	57	65
O=C(CCCC(=O)C1CC1)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450737065	FG	On-Demand	Anodyne	NAMPT	0	44
CCc1cccc(C(=O)NC[C@@H](C)C(F)(F)F)n1	ZINC000450737072	CF	On-Demand	Anodyne	PDE5A	22	40
COC(=O)CNC(=O)c1ccc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450737073	FE	On-Demand	Bother	TAAR1	19	40
COC(=O)CNC(=O)c1ccc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450737074	FE	On-Demand	Bother	TAAR1	19	40
CC(C)Cn1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c(C(F)F)n1	ZINC000450737086	GK	On-Demand	Anodyne	CCR1	50	45
CC(C)(CC(=O)COc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1	ZINC000450737089	GE	On-Demand	Anodyne	MMP13	44	40
CC(C)(CC(=O)COc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1	ZINC000450737089	GE	On-Demand	Anodyne	ADAM17	40	38
CC(C)(CC(=O)COc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1	ZINC000450737089	GE	On-Demand	Anodyne	MMP9	17	40
CC(C)(CC(=O)COc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1	ZINC000450737089	GE	On-Demand	Anodyne	MMP1	33	40
CCc1cc(NC[C@H]2CCCC2(F)F)n2ncnc2n1	ZINC000450737099	CF	On-Demand	Anodyne	DHOD	0	50
CCc1cc(NC[C@@H]2CCCC2(F)F)n2ncnc2n1	ZINC000450737100	CF	On-Demand	Anodyne	DHOD	0	50
O=C(N1CCC(c2ccc(Cl)cc2)CC1)C1(CF)CCOCC1	ZINC000450737136	EH	On-Demand	Anodyne	CACNA1H	40	36
O=C(N1CCC(c2ccc(Cl)cc2)CC1)C1(CF)CCOCC1	ZINC000450737136	EH	On-Demand	Anodyne	SLC6A1	36	41
O=C(N1CCC(c2ccc(Cl)cc2)CC1)C1(CF)CCOCC1	ZINC000450737136	EH	On-Demand	Anodyne	CCR1	46	42
O=[N+]([O-])c1ccc2nc(NC[C@H]3CCCC3(F)F)nc(O)c2c1	ZINC000450737155	DF	On-Demand	Bother	VCP	30	41
O=[N+]([O-])c1ccc2nc(NC[C@@H]3CCCC3(F)F)nc(O)c2c1	ZINC000450737156	DF	On-Demand	Bother	VCP	30	41
CC(C)NC(=O)c1ccc(NC[C@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450737157	FH	On-Demand	Bother	TAAR1	17	40
CC(C)NC(=O)c1ccc(NC[C@@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450737158	FH	On-Demand	Bother	TAAR1	17	40
CC(C)NC(=O)c1ccc(NC[C@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450737159	FH	On-Demand	Bother	TAAR1	17	40
CC(C)NC(=O)c1ccc(NC[C@@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450737160	FH	On-Demand	Bother	TAAR1	17	40
CCc1cccc(C(=O)NC[C@H](C)C(F)(F)F)n1	ZINC000450737173	CF	On-Demand	Anodyne	PDE5A	22	40
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450737179	EH	On-Demand	Anodyne	PREP	55	36
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450737180	EH	On-Demand	Anodyne	PREP	58	36
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450737181	EH	On-Demand	Anodyne	PREP	58	36
O=C(c1ccc(N2CCC2)nc1)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450737182	EH	On-Demand	Anodyne	PREP	58	36
Cc1cc(-c2nc(C(=O)NC[C@@H](C)C(F)(F)F)co2)ccn1	ZINC000450737193	DF	On-Demand	Anodyne	IRAK4	22	44
Cc1cc(-c2nc(C(=O)NC[C@H](C)C(F)(F)F)co2)ccn1	ZINC000450737194	DF	On-Demand	Anodyne	IRAK4	22	44
CCCCCN(CCCOC)C(=O)c1c[nH]c2nccc-2c1	ZINC000450737197	DG	On-Demand	Anodyne	TSPO	17	41
CCCCCN(CCCOC)C(=O)c1c[nH]c2nccc-2c1	ZINC000450737197	DG	On-Demand	Anodyne	PLM2_PLAFA	40	35
CCCCOc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cn1	ZINC000450737202	EI	On-Demand	Anodyne	TRPV1	18	42
CCCCOc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cn1	ZINC000450737202	EI	On-Demand	Anodyne	P4HTM	0	47
CCCCOc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cn1	ZINC000450737202	EI	On-Demand	Anodyne	DGAT1	18	48
CCOC(=O)[C@H](C)[C@H](C)NCCC[C@H](C)O	ZINC000450737203	BD	On-Demand	Anodyne	METAP2	0	42
CCOC(=O)[C@H](C)[C@@H](C)NCCC[C@@H](C)O	ZINC000450737204	BD	On-Demand	Anodyne	METAP2	0	42
CCOC(=O)[C@H](C)[C@@H](C)NCCC[C@H](C)O	ZINC000450737205	BD	On-Demand	Anodyne	METAP2	0	42
CCOC(=O)[C@H](C)[C@H](C)NCCC[C@@H](C)O	ZINC000450737206	BD	On-Demand	Anodyne	METAP2	0	42
CC(F)(F)c1ccc(C(=O)NCCN2C(=O)NC3(CCCC3)C2=O)cn1	ZINC000450737230	FD	On-Demand	Anodyne	PLD2	50	33
C[C@@H](CNC(=O)c1cncc(Cl)c1)C(F)(F)F	ZINC000450737234	CF	On-Demand	Anodyne	SCN10A	45	41
C[C@H](CNC(=O)c1cncc(Cl)c1)C(F)(F)F	ZINC000450737235	CF	On-Demand	Anodyne	SCN10A	45	41
C[C@H](CNC(=O)c1ccc(-c2cnn(C)c2)o1)C(F)(F)F	ZINC000450737242	DF	On-Demand	Anodyne	MMP13	0	41
C[C@@H](CNC(=O)c1ccc(-c2cnn(C)c2)o1)C(F)(F)F	ZINC000450737243	DF	On-Demand	Anodyne	MMP13	0	41
CC[C@@H](O)CC(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450737244	CG	On-Demand	Anodyne	ENPP1	48	29
CC[C@H](O)CC(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450737245	CG	On-Demand	Anodyne	ENPP1	48	29
COc1ccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)cc1	ZINC000450737260	FH	On-Demand	Anodyne	ACACA	55	36
COc1ccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)cc1	ZINC000450737260	FH	On-Demand	Anodyne	RAF1	23	41
COc1ccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)cc1	ZINC000450737260	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	30	41
COc1ccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)cc1	ZINC000450737260	FH	On-Demand	Anodyne	NPBWR1	56	34
COc1ccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)cc1	ZINC000450737261	FH	On-Demand	Anodyne	ACACA	55	36
COc1ccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)cc1	ZINC000450737261	FH	On-Demand	Anodyne	RAF1	23	41
COc1ccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)cc1	ZINC000450737261	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	30	41
COc1ccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)cc1	ZINC000450737261	FH	On-Demand	Anodyne	NPBWR1	56	34
COC(=O)c1ccc(CN2C[C@H](N3CCCC3)[C@H](SC)C2)cc1Cl	ZINC000450737276	FG	On-Demand	Anodyne	OPRK1	15	41
COC(=O)c1ccc(CN2C[C@@H](SC)[C@H](N3CCCC3)C2)cc1Cl	ZINC000450737277	FG	On-Demand	Anodyne	OPRK1	15	41
COC(=O)c1ccc(CN2C[C@H](SC)[C@@H](N3CCCC3)C2)cc1Cl	ZINC000450737278	FG	On-Demand	Anodyne	OPRK1	15	41
COC(=O)c1ccc(CN2C[C@H](SC)[C@H](N3CCCC3)C2)cc1Cl	ZINC000450737279	FG	On-Demand	Anodyne	OPRK1	15	41
O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450737295	FH	On-Demand	Anodyne	HPGDS	30	45
O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450737296	FH	On-Demand	Anodyne	HPGDS	30	45
COc1ccccc1-c1noc([C@@H](C)NC[C@H]2CCC(F)(F)C2)n1	ZINC000450737318	EH	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc([C@H](C)NC[C@@H]2CCC(F)(F)C2)n1	ZINC000450737319	EH	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc([C@H](C)NC[C@H]2CCC(F)(F)C2)n1	ZINC000450737320	EH	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc([C@@H](C)NC[C@@H]2CCC(F)(F)C2)n1	ZINC000450737321	EH	On-Demand	Anodyne	LUCI_PHOPE	29	41
CC(C)OC(=O)c1cccc(-c2nnn(Cc3ccn(CC(F)(F)F)n3)n2)c1	ZINC000450737322	GF	On-Demand	Anodyne	SCARB1	43	36
O=C(CC1(O)CCC1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450737366	DG	On-Demand	Anodyne	CCR1	57	49
CCCOc1cccc(CSc2nnc([C@H]3COc4ccccc4O3)o2)c1	ZINC000450737374	GJ	On-Demand	Anodyne	GSK3A	40	36
CCCOc1cccc(CSc2nnc([C@@H]3COc4ccccc4O3)o2)c1	ZINC000450737375	GJ	On-Demand	Anodyne	GSK3A	40	36
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H]2CCOC2)c(OC)c1	ZINC000450737380	ED	On-Demand	Anodyne	MTNR1A	58	38
COc1ccc(CNC(=O)CCN[C@H](C)[C@H]2CCOC2)c(OC)c1	ZINC000450737381	ED	On-Demand	Anodyne	MTNR1A	58	38
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H]2CCOC2)c(OC)c1	ZINC000450737382	ED	On-Demand	Anodyne	MTNR1A	58	38
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H]2CCOC2)c(OC)c1	ZINC000450737383	ED	On-Demand	Anodyne	MTNR1A	58	38
COc1cc(OC)c2ncc(C#N)c(NCCc3ncccc3C)c2c1	ZINC000450737388	EG	On-Demand	Mild	SRC	45	38
COc1ccc(CNC(=O)CCN[C@H](C)[C@H](C)CO)c(OC)c1	ZINC000450737390	DD	On-Demand	Anodyne	MTNR1A	59	37
COc1ccc(CNC(=O)CCN[C@@H](C)[C@H](C)CO)c(OC)c1	ZINC000450737391	DD	On-Demand	Anodyne	MTNR1A	59	37
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H](C)CO)c(OC)c1	ZINC000450737392	DD	On-Demand	Anodyne	MTNR1A	59	37
COc1ccc(CNC(=O)CCN[C@@H](C)[C@@H](C)CO)c(OC)c1	ZINC000450737393	DD	On-Demand	Anodyne	MTNR1A	59	37
C[C@H](NCCc1ccc(Cl)cc1)c1noc(Cc2ccccc2)n1	ZINC000450737395	EI	On-Demand	Anodyne	TPSAB1	65	38
C[C@@H](NCCc1ccc(Cl)cc1)c1noc(Cc2ccccc2)n1	ZINC000450737396	EI	On-Demand	Anodyne	TPSAB1	65	38
O=C(NCCN1C(=O)NC2(CCCC2)C1=O)c1cc(Cl)c2ccccc2n1	ZINC000450737430	GE	On-Demand	Anodyne	PLD2	47	41
CCOC(=O)c1sc([C@@H](C)NCc2ccc(C(=O)OC)c(Cl)c2)nc1C	ZINC000450737495	GH	On-Demand	Anodyne	DHODH	24	45
CCOC(=O)c1sc([C@H](C)NCc2ccc(C(=O)OC)c(Cl)c2)nc1C	ZINC000450737496	GH	On-Demand	Anodyne	DHODH	24	45
CCc1ccc(-c2noc([C@H](C)NCc3ccc(S(=O)(=O)CC)cc3)n2)cc1	ZINC000450737509	GH	On-Demand	Anodyne	DPP7	0	41
CCc1ccc(-c2noc([C@@H](C)NCc3ccc(S(=O)(=O)CC)cc3)n2)cc1	ZINC000450737510	GH	On-Demand	Anodyne	DPP7	0	41
Cc1cccc(Cl)c1CNC(C)(C)c1nc(C(F)(F)F)cs1	ZINC000450737513	EK	On-Demand	Anodyne	EIF2AK1	41	34
CCOC(=O)c1sc([C@@H](C)NC[C@@H](Cc2ccccc2)OC)nc1C	ZINC000450737561	FH	On-Demand	Anodyne	DHODH	23	42
CCOC(=O)c1sc([C@H](C)NC[C@@H](Cc2ccccc2)OC)nc1C	ZINC000450737562	FH	On-Demand	Anodyne	DHODH	23	42
CCOC(=O)c1sc([C@H](C)NC[C@H](Cc2ccccc2)OC)nc1C	ZINC000450737563	FH	On-Demand	Anodyne	DHODH	23	42
CCOC(=O)c1sc([C@@H](C)NC[C@H](Cc2ccccc2)OC)nc1C	ZINC000450737564	FH	On-Demand	Anodyne	DHODH	23	42
CCc1cc(CCCN[C@H](C)c2nc(-c3ccccc3OC)no2)on1	ZINC000450737567	FH	On-Demand	Anodyne	LUCI_PHOPE	29	41
CCc1cc(CCCN[C@@H](C)c2nc(-c3ccccc3OC)no2)on1	ZINC000450737568	FH	On-Demand	Anodyne	LUCI_PHOPE	29	41
Cn1cc(-c2ccc(C(=O)Nc3ccc4c(c3)CCC(=O)N4CC3CC3)o2)cn1	ZINC000450737579	GH	On-Demand	Anodyne	SCN10A	16	40
Cc1onc(C2CC2)c1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450737588	EI	On-Demand	Anodyne	GHSR	17	40
Cc1onc(C2CC2)c1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450737588	EI	On-Demand	Anodyne	TYK2	55	34
CC(F)(F)C(C)(C)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450737590	FH	On-Demand	Anodyne	NAMPT	25	41
CC(C)N1CCN(C(=O)c2c(Cl)cc(F)cc2Br)CC1=O	ZINC000450737596	GF	On-Demand	Anodyne	P2RX7	24	53
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	FKBP1A	50	55
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	ELANE	53	37
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	MMP13	50	43
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	ADAM17	45	40
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	ITGA4	45	47
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	CAPNS1	24	49
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	MMP3	59	43
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	MMP8	35	42
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	CAPN1	21	53
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	MMP9	31	40
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	MMP7	61	43
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	MMP1	58	47
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	XIAP	34	40
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	SFRP1	139	41
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	WNT3	97	41
C[C@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737612	FE	On-Demand	Anodyne	TMPRSS11D	57	36
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	FKBP1A	50	55
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	ELANE	53	37
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	MMP13	50	43
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	ADAM17	45	40
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	ITGA4	45	47
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	CAPNS1	24	49
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	MMP3	59	43
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	MMP8	35	42
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	CAPN1	21	53
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	MMP9	31	40
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	MMP7	61	43
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	MMP1	58	47
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	XIAP	34	40
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	SFRP1	139	41
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	WNT3	97	41
C[C@@H](CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(F)(F)F	ZINC000450737613	FE	On-Demand	Anodyne	TMPRSS11D	57	36
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](C)CO)cc1	ZINC000450737615	CD	On-Demand	Anodyne	RORC	47	34
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](C)CO)cc1	ZINC000450737616	CD	On-Demand	Anodyne	RORC	47	34
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](C)CO)cc1	ZINC000450737617	CD	On-Demand	Anodyne	RORC	47	34
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](C)CO)cc1	ZINC000450737618	CD	On-Demand	Anodyne	RORC	47	34
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc2c(s1)CCC2	ZINC000450737638	CD	On-Demand	Anodyne	SLC27A1	27	46
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc2c(s1)CCC2	ZINC000450737639	CD	On-Demand	Anodyne	SLC27A1	27	46
C[C@H](NCC(=O)Nc1nc2c(s1)CCC2)[C@@H](C)CO	ZINC000450737640	CD	On-Demand	Anodyne	SLC27A1	27	46
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc2c(s1)CCC2	ZINC000450737641	CD	On-Demand	Anodyne	SLC27A1	27	46
COCC(=O)NC1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450737652	GD	On-Demand	Anodyne	AVPR1B	46	39
COCC(=O)NC1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450737652	GD	On-Demand	Anodyne	PDE6D	94	39
COCC(=O)NC1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450737652	GD	On-Demand	Anodyne	FASN	16	41
COCC(=O)NC1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450737652	GD	On-Demand	Anodyne	IMDH_CRYPV	35	48
C=CCn1c(S[C@@H](C)C(=O)C2CCCCC2)nnc1-c1cccnc1	ZINC000450737695	FI	On-Demand	Mild	VCP	53	37
C=CCn1c(S[C@H](C)C(=O)C2CCCCC2)nnc1-c1cccnc1	ZINC000450737696	FI	On-Demand	Mild	VCP	53	37
Fc1ccc(OCc2cn(CC3CC3)nn2)cc1F	ZINC000450737699	CF	On-Demand	Anodyne	CHRNA10	16	42
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450737700	FJ	On-Demand	Anodyne	CCR1	46	43
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450737700	FJ	On-Demand	Anodyne	SLC9A1	43	38
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450737700	FJ	On-Demand	Anodyne	FASN	40	38
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450737700	FJ	On-Demand	Anodyne	SFRP1	31	42
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450737700	FJ	On-Demand	Anodyne	L3MBTL1	0	40
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450737700	FJ	On-Demand	Anodyne	L3MBTL3	49	40
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450737700	FJ	On-Demand	Anodyne	SLC6A7	0	40
Cc1cnc(NC[C@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450737733	CG	On-Demand	Bother	PRKCQ	48	40
Cc1cnc(NC[C@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450737734	CG	On-Demand	Bother	PRKCQ	48	40
Cc1cnc(NC[C@@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450737735	CG	On-Demand	Bother	PRKCQ	48	40
Cc1cnc(NC[C@@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450737736	CG	On-Demand	Bother	PRKCQ	48	40
CC1CCN(C(=O)c2ccc(=NC[C@H]3CCO[C@H](C(C)C)C3)[nH]c2)CC1	ZINC000450737744	FG	On-Demand	Anodyne	L3MBTL3	45	31
CC1CCN(C(=O)c2ccc(=NC[C@@H]3CCO[C@@H](C(C)C)C3)[nH]c2)CC1	ZINC000450737745	FG	On-Demand	Anodyne	L3MBTL3	45	31
CC1CCN(C(=O)c2ccc(=NC[C@@H]3CCO[C@H](C(C)C)C3)[nH]c2)CC1	ZINC000450737746	FG	On-Demand	Anodyne	L3MBTL3	45	31
CC1CCN(C(=O)c2ccc(=NC[C@H]3CCO[C@@H](C(C)C)C3)[nH]c2)CC1	ZINC000450737747	FG	On-Demand	Anodyne	L3MBTL3	45	31
C[C@@H](CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1)C(F)(F)F	ZINC000450737781	FH	On-Demand	Anodyne	PYGL	61	37
C[C@@H](CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1)C(F)(F)F	ZINC000450737781	FH	On-Demand	Anodyne	PYK	33	41
C[C@H](CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1)C(F)(F)F	ZINC000450737782	FH	On-Demand	Anodyne	PYGL	61	37
C[C@H](CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1)C(F)(F)F	ZINC000450737782	FH	On-Demand	Anodyne	PYK	33	41
CN1C(=O)CC[C@@H]1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450737798	DF	On-Demand	Anodyne	P2RX7	43	51
CN1C(=O)CC[C@@H]1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450737798	DF	On-Demand	Anodyne	ENV	40	33
CN1C(=O)CC[C@H]1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450737799	DF	On-Demand	Anodyne	P2RX7	43	51
CN1C(=O)CC[C@H]1C(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000450737799	DF	On-Demand	Anodyne	ENV	40	33
C[C@H](CO)[C@@H](C)NCC(=O)Nc1nc2c(s1)CCCC2	ZINC000450737812	CD	On-Demand	Anodyne	SLC27A1	28	48
C[C@H](NCC(=O)Nc1nc2c(s1)CCCC2)[C@@H](C)CO	ZINC000450737813	CD	On-Demand	Anodyne	SLC27A1	28	48
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1nc2c(s1)CCCC2	ZINC000450737814	CD	On-Demand	Anodyne	SLC27A1	28	48
C[C@H](CO)[C@H](C)NCC(=O)Nc1nc2c(s1)CCCC2	ZINC000450737815	CD	On-Demand	Anodyne	SLC27A1	28	48
CCOC(=O)[C@H](C)[C@@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450737837	EE	On-Demand	Anodyne	CA2	23	41
CCOC(=O)[C@H](C)[C@@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450737837	EE	On-Demand	Anodyne	CA4	15	41
CCOC(=O)[C@H](C)[C@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450737838	EE	On-Demand	Anodyne	CA2	23	41
CCOC(=O)[C@H](C)[C@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450737838	EE	On-Demand	Anodyne	CA4	15	41
CCOC(=O)[C@@H](C)[C@@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450737839	EE	On-Demand	Anodyne	CA2	23	41
CCOC(=O)[C@@H](C)[C@@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450737839	EE	On-Demand	Anodyne	CA4	15	41
CCOC(=O)[C@@H](C)[C@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450737840	EE	On-Demand	Anodyne	CA2	23	41
CCOC(=O)[C@@H](C)[C@H](C)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000450737840	EE	On-Demand	Anodyne	CA4	15	41
COCC(=O)NC1CN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450737853	EC	On-Demand	Anodyne	OPRK1	33	43
COCC(=O)NC1CN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450737853	EC	On-Demand	Anodyne	CAN2	0	40
Clc1ccc(CCN2CCN3CCOC[C@@H]3C2)cc1	ZINC000450737939	CD	On-Demand	Anodyne	L3MBTL3	24	45
Clc1ccc(CCN2CCN3CCOC[C@H]3C2)cc1	ZINC000450737940	CD	On-Demand	Anodyne	L3MBTL3	24	45
CCOC(=O)c1sc([C@@H](C)NCc2cc(Cl)sc2Cl)nc1C	ZINC000450737941	GJ	On-Demand	Anodyne	DHODH	22	44
CCOC(=O)c1sc([C@H](C)NCc2cc(Cl)sc2Cl)nc1C	ZINC000450737942	GJ	On-Demand	Anodyne	DHODH	22	44
Cc1ccn2ncc(C(=O)N[C@@H](C)CN3CCCCCC3)c2c1	ZINC000450737951	DF	On-Demand	Anodyne	PLD1	45	35
Cc1ccn2ncc(C(=O)N[C@@H](C)CN3CCCCCC3)c2c1	ZINC000450737951	DF	On-Demand	Anodyne	EPHB3	36	51
Cc1ccn2ncc(C(=O)N[C@H](C)CN3CCCCCC3)c2c1	ZINC000450737952	DF	On-Demand	Anodyne	PLD1	45	35
Cc1ccn2ncc(C(=O)N[C@H](C)CN3CCCCCC3)c2c1	ZINC000450737952	DF	On-Demand	Anodyne	EPHB3	36	51
CC1(O)CC(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)C1	ZINC000450737958	DG	On-Demand	Anodyne	CCR1	53	47
CC1(O)CC(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)C1	ZINC000450737958	DG	On-Demand	Anodyne	L3MBTL3	47	33
FC(F)(F)c1cc(NC[C@H]2CCCC2(F)F)n2ncnc2n1	ZINC000450737959	DF	On-Demand	Anodyne	DHOD	0	51
FC(F)(F)c1cc(NC[C@@H]2CCCC2(F)F)n2ncnc2n1	ZINC000450737960	DF	On-Demand	Anodyne	DHOD	0	51
CSc1cccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1	ZINC000450737963	GG	On-Demand	Anodyne	CHRM3	15	41
CSc1cccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1	ZINC000450737963	GG	On-Demand	Anodyne	CALCA	0	41
COCC(=O)NC1CN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450737984	GD	On-Demand	Anodyne	CCR2	34	40
C[C@H](CNC(=O)CCc1ccc2ccccc2c1O)C(F)(F)F	ZINC000450737992	EH	On-Demand	Anodyne	KCNJ11	58	39
C[C@H](CNC(=O)CCc1ccc2ccccc2c1O)C(F)(F)F	ZINC000450737992	EH	On-Demand	Anodyne	SUCNR1	60	35
C[C@@H](CNC(=O)CCc1ccc2ccccc2c1O)C(F)(F)F	ZINC000450737993	EH	On-Demand	Anodyne	KCNJ11	58	39
C[C@@H](CNC(=O)CCc1ccc2ccccc2c1O)C(F)(F)F	ZINC000450737993	EH	On-Demand	Anodyne	SUCNR1	60	35
CC(C)[C@@H]1C[C@@H](CNc2ncc(Br)cc2[N+](=O)[O-])CCO1	ZINC000450738015	FH	On-Demand	Bother	PRKCQ	47	37
CC(C)[C@H]1C[C@@H](CNc2ncc(Br)cc2[N+](=O)[O-])CCO1	ZINC000450738016	FH	On-Demand	Bother	PRKCQ	47	37
CC(C)[C@@H]1C[C@H](CNc2ncc(Br)cc2[N+](=O)[O-])CCO1	ZINC000450738017	FH	On-Demand	Bother	PRKCQ	47	37
CC(C)[C@H]1C[C@H](CNc2ncc(Br)cc2[N+](=O)[O-])CCO1	ZINC000450738018	FH	On-Demand	Bother	PRKCQ	47	37
C[C@H](OCCc1ccccc1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738036	GH	On-Demand	Anodyne	ACE	34	40
C[C@H](OCCc1ccccc1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738036	GH	On-Demand	Anodyne	TIMP3	57	32
C[C@@H](OCCc1ccccc1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738037	GH	On-Demand	Anodyne	ACE	34	40
C[C@@H](OCCc1ccccc1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738037	GH	On-Demand	Anodyne	TIMP3	57	32
C[C@@H](CNC(=O)c1cc(O)ccc1F)C(F)(F)F	ZINC000450738068	CE	For-Sale	Anodyne	HSD17B1	28	40
C[C@H](CNC(=O)c1cc(O)ccc1F)C(F)(F)F	ZINC000450738070	CE	For-Sale	Anodyne	HSD17B1	28	40
NS(=O)(=O)c1ccc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450738071	EE	On-Demand	Bother	CA2	23	40
NS(=O)(=O)c1ccc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450738072	EE	On-Demand	Bother	CA2	23	40
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450738094	FF	On-Demand	Bother	BDKRB1	22	41
CN(C)S(=O)(=O)c1ccc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450738095	FF	On-Demand	Bother	BDKRB1	22	41
CCOC(=O)[C@@H](NCCc1ccc(Cl)cc1)C1CCOCC1	ZINC000450738096	EF	On-Demand	Anodyne	MMP2	40	32
CCOC(=O)[C@H](NCCc1ccc(Cl)cc1)C1CCOCC1	ZINC000450738097	EF	On-Demand	Anodyne	MMP2	40	32
CC(C)(C)C(=O)CCCC(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738113	FI	On-Demand	Anodyne	NAMPT	29	42
CC(C)[C@H]1C[C@@H](CNc2ccc(S(=O)(=O)NCC3CC3)cn2)CCO1	ZINC000450738115	FE	On-Demand	Anodyne	NPY1R	40	32
CC(C)[C@H]1C[C@H](CNc2ccc(S(=O)(=O)NCC3CC3)cn2)CCO1	ZINC000450738116	FE	On-Demand	Anodyne	NPY1R	40	32
CC(C)[C@@H]1C[C@@H](CNc2ccc(S(=O)(=O)NCC3CC3)cn2)CCO1	ZINC000450738118	FE	On-Demand	Anodyne	NPY1R	40	32
CC(C)[C@@H]1C[C@H](CNc2ccc(S(=O)(=O)NCC3CC3)cn2)CCO1	ZINC000450738119	FE	On-Demand	Anodyne	NPY1R	40	32
COc1ccccc1-c1noc([C@H](C)NCCC2=CCCCC2)n1	ZINC000450738131	EI	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc([C@@H](C)NCCC2=CCCCC2)n1	ZINC000450738132	EI	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccc([C@@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738133	GH	On-Demand	Anodyne	ACACA	38	42
COc1ccc([C@@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738133	GH	On-Demand	Anodyne	CTSL	18	41
COc1ccc([C@@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738133	GH	On-Demand	Anodyne	ACACB	18	43
COc1ccc([C@@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738133	GH	On-Demand	Anodyne	MTNR1A	68	46
COc1ccc([C@@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738133	GH	On-Demand	Anodyne	MTNR1B	65	46
COc1ccc([C@@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738133	GH	On-Demand	Anodyne	FFAR1	26	40
COc1ccc([C@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738134	GH	On-Demand	Anodyne	ACACA	38	42
COc1ccc([C@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738134	GH	On-Demand	Anodyne	CTSL	18	41
COc1ccc([C@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738134	GH	On-Demand	Anodyne	ACACB	18	43
COc1ccc([C@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738134	GH	On-Demand	Anodyne	MTNR1A	68	46
COc1ccc([C@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738134	GH	On-Demand	Anodyne	MTNR1B	65	46
COc1ccc([C@H](NC(=O)CCOc2cccc(OC)c2)C(F)(F)F)cc1	ZINC000450738134	GH	On-Demand	Anodyne	FFAR1	26	40
COCC1=CCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000450738138	DF	On-Demand	Anodyne	PREP	44	37
COCC1=CCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000450738140	DF	On-Demand	Anodyne	PREP	44	37
COC(=O)c1ccc(CC(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1	ZINC000450738154	FF	On-Demand	Anodyne	DRD4	41	31
COC(=O)c1ccc(CC(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1	ZINC000450738154	FF	On-Demand	Anodyne	CACNA1I	27	40
CC[C@H](CC(C)C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450738158	DH	On-Demand	Anodyne	ANPEP	28	43
CC[C@@H](CC(C)C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450738159	DH	On-Demand	Anodyne	ANPEP	28	43
C[C@H](NCc1ccccc1OC1CC1)c1cnn(Cc2ccccc2)c1	ZINC000450738168	EI	On-Demand	Anodyne	PANC	42	36
C[C@@H](NCc1ccccc1OC1CC1)c1cnn(Cc2ccccc2)c1	ZINC000450738169	EI	On-Demand	Anodyne	PANC	42	36
CC(C)[C@@H]1C[C@@H](CNc2ncc([N+](=O)[O-])cc2Cl)CCO1	ZINC000450738193	DH	On-Demand	Bother	PRKCQ	43	36
CC(C)[C@H]1C[C@@H](CNc2ncc([N+](=O)[O-])cc2Cl)CCO1	ZINC000450738194	DH	On-Demand	Bother	PRKCQ	43	36
CC(C)[C@@H]1C[C@H](CNc2ncc([N+](=O)[O-])cc2Cl)CCO1	ZINC000450738195	DH	On-Demand	Bother	PRKCQ	43	36
CC(C)[C@H]1C[C@H](CNc2ncc([N+](=O)[O-])cc2Cl)CCO1	ZINC000450738196	DH	On-Demand	Bother	PRKCQ	43	36
O=C(CSC1CC1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738201	DH	On-Demand	Anodyne	SLC6A1	54	43
O=C(CSC1CC1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738201	DH	On-Demand	Anodyne	SLC6A3	18	43
O=C(CSC1CC1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738201	DH	On-Demand	Anodyne	CCR1	40	48
CC(=O)NC[C@H](CC(=O)N1CCC(c2ccc(Cl)cc2)CC1)CC(C)C	ZINC000450738215	GI	On-Demand	Anodyne	SLC6A1	40	36
CC(=O)NC[C@H](CC(=O)N1CCC(c2ccc(Cl)cc2)CC1)CC(C)C	ZINC000450738215	GI	On-Demand	Anodyne	IL2RA	53	37
CC(=O)NC[C@H](CC(=O)N1CCC(c2ccc(Cl)cc2)CC1)CC(C)C	ZINC000450738215	GI	On-Demand	Anodyne	CCR1	55	52
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450738235	DF	On-Demand	Anodyne	PAPA1_CARPA	41	31
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450738235	DF	On-Demand	Anodyne	CAPN2	52	31
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450738235	DF	On-Demand	Anodyne	NPR	41	32
C[C@@H](CNC(=O)[C@@H](C)OCCc1ccccc1)C(F)(F)F	ZINC000450738237	DF	On-Demand	Anodyne	PAPA1_CARPA	41	31
C[C@@H](CNC(=O)[C@@H](C)OCCc1ccccc1)C(F)(F)F	ZINC000450738237	DF	On-Demand	Anodyne	CAPN2	52	31
C[C@@H](CNC(=O)[C@@H](C)OCCc1ccccc1)C(F)(F)F	ZINC000450738237	DF	On-Demand	Anodyne	NPR	41	32
C[C@H](OCCc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450738239	DF	On-Demand	Anodyne	PAPA1_CARPA	41	31
C[C@H](OCCc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450738239	DF	On-Demand	Anodyne	CAPN2	52	31
C[C@H](OCCc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450738239	DF	On-Demand	Anodyne	NPR	41	32
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450738240	DF	On-Demand	Anodyne	PAPA1_CARPA	41	31
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450738240	DF	On-Demand	Anodyne	CAPN2	52	31
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450738240	DF	On-Demand	Anodyne	NPR	41	32
COc1ccc([C@@H](NC(=O)[C@H](O)C2CCC2)C(F)(F)F)cc1	ZINC000450738257	DF	On-Demand	Anodyne	CTSL	21	43
COc1ccc([C@@H](NC(=O)[C@H](O)C2CCC2)C(F)(F)F)cc1	ZINC000450738257	DF	On-Demand	Anodyne	CTSS	15	43
COc1ccc([C@H](NC(=O)[C@H](O)C2CCC2)C(F)(F)F)cc1	ZINC000450738258	DF	On-Demand	Anodyne	CTSL	21	43
COc1ccc([C@H](NC(=O)[C@H](O)C2CCC2)C(F)(F)F)cc1	ZINC000450738258	DF	On-Demand	Anodyne	CTSS	15	43
COc1ccc([C@@H](NC(=O)[C@@H](O)C2CCC2)C(F)(F)F)cc1	ZINC000450738259	DF	On-Demand	Anodyne	CTSL	21	43
COc1ccc([C@@H](NC(=O)[C@@H](O)C2CCC2)C(F)(F)F)cc1	ZINC000450738259	DF	On-Demand	Anodyne	CTSS	15	43
COc1ccc([C@H](NC(=O)[C@@H](O)C2CCC2)C(F)(F)F)cc1	ZINC000450738261	DF	On-Demand	Anodyne	CTSL	21	43
COc1ccc([C@H](NC(=O)[C@@H](O)C2CCC2)C(F)(F)F)cc1	ZINC000450738261	DF	On-Demand	Anodyne	CTSS	15	43
CCCCOc1ccc(NC(=O)c2cncc(Cl)c2)cn1	ZINC000450738292	DH	On-Demand	Anodyne	PLA2G4B	43	31
CCCCOc1ccc(NC(=O)c2cncc(Cl)c2)cn1	ZINC000450738292	DH	On-Demand	Anodyne	SCN10A	46	41
CCCCOc1ccc(NC(=O)c2cncc(Cl)c2)cn1	ZINC000450738292	DH	On-Demand	Anodyne	USP47	44	37
CCC[C@H](CC(C)C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450738294	EH	On-Demand	Anodyne	ANPEP	27	42
CCC[C@@H](CC(C)C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450738299	EH	On-Demand	Anodyne	ANPEP	27	42
COc1cccc(OCCC(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450738333	DF	On-Demand	Anodyne	DRD4	44	33
COc1cccc(OCCC(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450738333	DF	On-Demand	Anodyne	NQO2	38	43
COc1cccc(OCCC(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450738333	DF	On-Demand	Anodyne	MTNR1A	63	39
COc1cccc(OCCC(=O)NCC[C@@H]2CCCCO2)c1	ZINC000450738333	DF	On-Demand	Anodyne	MTNR1B	51	39
COc1cccc(OCCC(=O)NCC[C@H]2CCCCO2)c1	ZINC000450738335	DF	On-Demand	Anodyne	DRD4	44	33
COc1cccc(OCCC(=O)NCC[C@H]2CCCCO2)c1	ZINC000450738335	DF	On-Demand	Anodyne	NQO2	38	43
COc1cccc(OCCC(=O)NCC[C@H]2CCCCO2)c1	ZINC000450738335	DF	On-Demand	Anodyne	MTNR1A	63	39
COc1cccc(OCCC(=O)NCC[C@H]2CCCCO2)c1	ZINC000450738335	DF	On-Demand	Anodyne	MTNR1B	51	39
C[C@H]1C[C@@H](C(=O)NCc2noc(-c3cccc(F)c3)n2)CC[C@H]1C	ZINC000450738356	EH	On-Demand	Anodyne	PDE8B	52	33
C[C@H]1C[C@H](C(=O)NCc2noc(-c3cccc(F)c3)n2)CC[C@H]1C	ZINC000450738357	EH	On-Demand	Anodyne	PDE8B	52	33
C[C@@H]1CC[C@@H](C(=O)NCc2noc(-c3cccc(F)c3)n2)C[C@H]1C	ZINC000450738358	EH	On-Demand	Anodyne	PDE8B	52	33
C[C@@H]1CC[C@H](C(=O)NCc2noc(-c3cccc(F)c3)n2)C[C@H]1C	ZINC000450738359	EH	On-Demand	Anodyne	PDE8B	52	33
CC(C)(C)C1=CCN(CCNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450738363	GG	On-Demand	Anodyne	DRD4	43	33
CC(C)(C)C1=CCN(CCNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450738363	GG	On-Demand	Anodyne	PLD1	43	36
CC(C)(C)C1=CCN(CCNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450738363	GG	On-Demand	Anodyne	PLD2	46	36
CC(C)(C)C1=CCN(CCNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450738363	GG	On-Demand	Anodyne	TGM2	27	43
CC(C)(C)C1=CCN(CCNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450738363	GG	On-Demand	Anodyne	CACNA1I	46	32
Cn1ncc(Br)c1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738397	GH	On-Demand	Anodyne	SLC6A1	46	38
Cn1ncc(Br)c1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738397	GH	On-Demand	Anodyne	CCR1	46	41
CC(C)[C@H]1C[C@H](CNc2nccc3c([N+](=O)[O-])cccc23)CCO1	ZINC000450738430	EI	On-Demand	Bother	PRKCQ	45	36
CC(C)[C@@H]1C[C@H](CNc2nccc3c([N+](=O)[O-])cccc23)CCO1	ZINC000450738431	EI	On-Demand	Bother	PRKCQ	45	36
CC(C)[C@@H]1C[C@@H](CNc2nccc3c([N+](=O)[O-])cccc23)CCO1	ZINC000450738432	EI	On-Demand	Bother	PRKCQ	45	36
CC(C)[C@H]1C[C@@H](CNc2nccc3c([N+](=O)[O-])cccc23)CCO1	ZINC000450738433	EI	On-Demand	Bother	PRKCQ	45	36
COc1ccccc1-c1noc([C@@H](C)NCCc2ccc(Cl)cc2)n1	ZINC000450738448	FI	On-Demand	Anodyne	LUCI_PHOPE	32	44
COc1ccccc1-c1noc([C@H](C)NCCc2ccc(Cl)cc2)n1	ZINC000450738449	FI	On-Demand	Anodyne	LUCI_PHOPE	32	44
Cc1cccc(CN[C@@H]2CCCC[C@H]2C(N)=O)n1	ZINC000450738514	BD	On-Demand	Anodyne	SYK	19	41
Cc1cccc(CN[C@H]2CCCC[C@H]2C(N)=O)n1	ZINC000450738515	BD	On-Demand	Anodyne	SYK	19	41
Cc1cccc(CN[C@@H]2CCCC[C@@H]2C(N)=O)n1	ZINC000450738516	BD	On-Demand	Anodyne	SYK	19	41
Cc1cccc(CN[C@H]2CCCC[C@@H]2C(N)=O)n1	ZINC000450738517	BD	On-Demand	Anodyne	SYK	19	41
C[C@H](CNC(=O)Cc1ccc(O)c(F)c1)C(F)(F)F	ZINC000450738518	CE	On-Demand	Anodyne	TRPV1	25	59
C[C@@H](CNC(=O)Cc1ccc(O)c(F)c1)C(F)(F)F	ZINC000450738519	CE	On-Demand	Anodyne	TRPV1	25	59
C[C@@H](CNC(=O)c1cccc(C(F)(F)F)n1)C(F)(F)F	ZINC000450738522	DG	On-Demand	Anodyne	TRPV1	48	33
C[C@H](CNC(=O)c1cccc(C(F)(F)F)n1)C(F)(F)F	ZINC000450738523	DG	On-Demand	Anodyne	TRPV1	48	33
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1Cc1cccnc1	ZINC000450738554	GI	On-Demand	Anodyne	TBXAS1	35	40
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1Cc1cccnc1	ZINC000450738554	GI	On-Demand	Anodyne	PTGDR2	16	43
COCC(=O)NC1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450738565	EC	On-Demand	Bother	CACNA1C	50	36
COc1ccccc1-c1noc([C@H](C)NC[C@H]2C[C@H]3CC[C@H]2O3)n1	ZINC000450738590	EF	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc([C@@H](C)NC[C@@H]2C[C@H]3CC[C@H]2O3)n1	ZINC000450738591	EF	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc([C@@H](C)NC[C@H]2C[C@H]3CC[C@H]2O3)n1	ZINC000450738592	EF	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc([C@H](C)NC[C@@H]2C[C@H]3CC[C@H]2O3)n1	ZINC000450738593	EF	On-Demand	Anodyne	LUCI_PHOPE	29	41
COCC(=O)NC1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450738599	GD	On-Demand	Anodyne	HRH4	17	43
COc1cc(CC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450738618	FC	On-Demand	Anodyne	TRPV1	36	54
COc1cc(CC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450738618	FC	On-Demand	Anodyne	NCE103	35	46
COc1cc(CC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450738618	FC	On-Demand	Anodyne	P96878_MYCTU	24	46
COc1cc(CC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450738618	FC	On-Demand	Anodyne	CAN2	0	46
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	HRH3	15	47
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	PAOX	18	42
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	MMP13	59	45
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	MMP2	25	45
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	MMP3	38	45
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	MMP8	19	45
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	PLA2G4B	75	34
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	MMP9	24	45
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	EPHX2	16	41
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	MMP7	45	43
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	MMP1	40	45
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450738635	FE	On-Demand	Anodyne	NAMPT	22	40
CC(C)[C@@H]1C[C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])CCO1	ZINC000450738666	DH	On-Demand	Bother	PRKCQ	30	40
CC(C)[C@H]1C[C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])CCO1	ZINC000450738667	DH	On-Demand	Bother	PRKCQ	30	40
CC(C)[C@@H]1C[C@H](CNc2ncc(Cl)cc2[N+](=O)[O-])CCO1	ZINC000450738668	DH	On-Demand	Bother	PRKCQ	30	40
CC(C)[C@H]1C[C@H](CNc2ncc(Cl)cc2[N+](=O)[O-])CCO1	ZINC000450738669	DH	On-Demand	Bother	PRKCQ	30	40
COc1ccc([C@@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450738713	FD	On-Demand	Anodyne	CTSF	45	32
COc1ccc([C@@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450738713	FD	On-Demand	Anodyne	CTSK	28	42
COc1ccc([C@@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450738713	FD	On-Demand	Anodyne	CTSL	24	42
COc1ccc([C@@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450738713	FD	On-Demand	Anodyne	CTSS	19	42
COc1ccc([C@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450738714	FD	On-Demand	Anodyne	CTSF	45	32
COc1ccc([C@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450738714	FD	On-Demand	Anodyne	CTSK	28	42
COc1ccc([C@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450738714	FD	On-Demand	Anodyne	CTSL	24	42
COc1ccc([C@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450738714	FD	On-Demand	Anodyne	CTSS	19	42
CC(C)[C@H]1C[C@H](CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CCO1	ZINC000450738715	GF	On-Demand	Bother	BDKRB1	21	40
CC(C)[C@@H]1C[C@H](CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CCO1	ZINC000450738716	GF	On-Demand	Bother	BDKRB1	21	40
CC(C)[C@@H]1C[C@@H](CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CCO1	ZINC000450738717	GF	On-Demand	Bother	BDKRB1	21	40
CC(C)[C@H]1C[C@@H](CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CCO1	ZINC000450738718	GF	On-Demand	Bother	BDKRB1	21	40
CCOCc1nc(C)c(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)s1	ZINC000450738731	GJ	On-Demand	Anodyne	CCR1	44	41
C[C@H](CNC(=O)C(C)(C)c1cccc2ccccc12)C(F)(F)F	ZINC000450738762	DI	On-Demand	Anodyne	KCNJ11	103	38
C[C@@H](CNC(=O)C(C)(C)c1cccc2ccccc12)C(F)(F)F	ZINC000450738763	DI	On-Demand	Anodyne	KCNJ11	88	38
CCc1nc(C)c(CSc2nnc(N3CCOCC3)n2-c2cccc(C)c2)o1	ZINC000450738764	GH	On-Demand	Anodyne	NPY1R	19	40
Cc1cnc(CCCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)o1	ZINC000450738788	EI	On-Demand	Anodyne	CCR1	47	43
Cc1cnc(CCCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)o1	ZINC000450738788	EI	On-Demand	Anodyne	ETHR	45	32
Cc1cccc(Cl)c1C(=O)NCC[C@H]1CCCCO1	ZINC000450738789	CG	On-Demand	Anodyne	DRD4	42	34
Cc1cccc(Cl)c1C(=O)NCC[C@@H]1CCCCO1	ZINC000450738790	CG	On-Demand	Anodyne	DRD4	42	34
CC(C)[C@@H]1C[C@H](CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450738799	FG	On-Demand	Bother	TTK	25	40
CC(C)[C@H]1C[C@H](CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450738800	FG	On-Demand	Bother	TTK	25	40
CC(C)[C@H]1C[C@@H](CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450738801	FG	On-Demand	Bother	TTK	25	40
CC(C)[C@@H]1C[C@@H](CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450738802	FG	On-Demand	Bother	TTK	25	40
O=C(c1cncc(Cl)c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738821	EI	On-Demand	Anodyne	CCR1	47	44
O=C(c1cncc(Cl)c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738821	EI	On-Demand	Anodyne	SLC9A1	17	40
O=C(c1cncc(Cl)c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738821	EI	On-Demand	Anodyne	FASN	41	36
O=C(c1cncc(Cl)c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738821	EI	On-Demand	Anodyne	L3MBTL1	0	44
O=C(c1cncc(Cl)c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738821	EI	On-Demand	Anodyne	L3MBTL3	67	37
O=C(c1cncc(Cl)c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450738821	EI	On-Demand	Anodyne	SLC6A7	0	40
CN(CCN1CCN2CCOC[C@@H]2C1)Cc1ccccc1	ZINC000450738826	CD	On-Demand	Anodyne	SIGMAR1	24	40
CN(CCN1CCN2CCOC[C@H]2C1)Cc1ccccc1	ZINC000450738827	CD	On-Demand	Anodyne	SIGMAR1	24	40
Fc1ccc(OC[C@@H]2CCC(F)(F)C2)cc1F	ZINC000450738837	BH	On-Demand	Anodyne	CHRNA10	37	49
Fc1ccc(OC[C@H]2CCC(F)(F)C2)cc1F	ZINC000450738838	BH	On-Demand	Anodyne	CHRNA10	37	49
CCC(=O)C1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC1	ZINC000450738851	DH	On-Demand	Anodyne	CACNA1H	48	36
CCC(=O)C1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC1	ZINC000450738851	DH	On-Demand	Anodyne	SLC6A1	62	42
CCC(=O)C1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC1	ZINC000450738851	DH	On-Demand	Anodyne	CCR1	51	48
CCC(=O)C1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC1	ZINC000450738851	DH	On-Demand	Anodyne	DPP7	25	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450738873	GG	On-Demand	Anodyne	ANPEP	36	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450738873	GG	On-Demand	Anodyne	CTSK	26	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450738873	GG	On-Demand	Anodyne	CTSS	20	42
O=C(CS(=O)(=O)C1CC1)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000450738896	GG	On-Demand	Anodyne	RBP4	45	32
O=C(CS(=O)(=O)C1CC1)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000450738897	GG	On-Demand	Anodyne	RBP4	45	32
CCC(CC)(NCc1ccc(Cl)c(OC)c1)C(=O)OC	ZINC000450738913	CG	On-Demand	Anodyne	TRPV1	39	40
COC(=O)c1coc(CNC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450738914	FF	On-Demand	Anodyne	PDE8B	40	31
COC(=O)c1coc(CNC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450738915	FF	On-Demand	Anodyne	PDE8B	40	31
COC(=O)c1coc(CN[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450738916	FF	On-Demand	Anodyne	PDE8B	40	31
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738919	EH	On-Demand	Anodyne	NAMPT	27	42
CCCCOc1ccc(NC(=O)c2coc(-c3ccnc(C)c3)n2)cn1	ZINC000450738920	FH	On-Demand	Anodyne	IRAK4	20	40
C[C@H](CO)[C@H](C)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450738926	CD	On-Demand	Bother	GYRB	41	37
C[C@@H](CO)[C@@H](C)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450738927	CD	On-Demand	Bother	GYRB	41	37
C[C@H](NCc1nc2ccc([N+](=O)[O-])cc2[nH]1)[C@@H](C)CO	ZINC000450738928	CD	On-Demand	Bother	GYRB	41	37
C[C@H](CO)[C@@H](C)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450738929	CD	On-Demand	Bother	GYRB	41	37
CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738937	EI	On-Demand	Anodyne	NAMPT	27	42
CC[C@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738938	EI	On-Demand	Anodyne	NAMPT	27	42
CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738939	EI	On-Demand	Anodyne	NAMPT	27	42
CC[C@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450738940	EI	On-Demand	Anodyne	NAMPT	27	42
C[C@@H](CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C(F)(F)F	ZINC000450738945	FF	On-Demand	Mild	NR3C2	15	42
C[C@@H](CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C(F)(F)F	ZINC000450738945	FF	On-Demand	Mild	AR	21	40
C[C@H](CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C(F)(F)F	ZINC000450738946	FF	On-Demand	Mild	NR3C2	15	42
C[C@H](CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C(F)(F)F	ZINC000450738946	FF	On-Demand	Mild	AR	21	40
C[C@H](CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C(F)(F)F	ZINC000450738947	FF	On-Demand	Mild	NR3C2	15	42
C[C@H](CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C(F)(F)F	ZINC000450738947	FF	On-Demand	Mild	AR	21	40
C[C@@H](CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C(F)(F)F	ZINC000450738948	FF	On-Demand	Mild	NR3C2	15	42
C[C@@H](CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)C(F)(F)F	ZINC000450738948	FF	On-Demand	Mild	AR	21	40
Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCO[C@@H](C(C)C)C2)n1	ZINC000450738988	CG	On-Demand	Bother	PRKCQ	48	38
Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCO[C@H](C(C)C)C2)n1	ZINC000450738989	CG	On-Demand	Bother	PRKCQ	48	38
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCO[C@H](C(C)C)C2)n1	ZINC000450738990	CG	On-Demand	Bother	PRKCQ	48	38
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCO[C@@H](C(C)C)C2)n1	ZINC000450738991	CG	On-Demand	Bother	PRKCQ	48	38
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)c(OC)c1	ZINC000450739070	GG	On-Demand	Anodyne	MTNR1A	45	37
COc1ccc(CNC(=O)CCN[C@H](C)[C@H]2Oc3ccccc3[C@H]2C)c(OC)c1	ZINC000450739071	GG	On-Demand	Anodyne	MTNR1A	45	37
COc1ccc(CNC(=O)CCN[C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)c(OC)c1	ZINC000450739072	GG	On-Demand	Anodyne	MTNR1A	45	37
C[C@H](CNC(=O)c1ccc2cnccc2c1)C(F)(F)F	ZINC000450739074	CG	On-Demand	Anodyne	AKT1	21	44
C[C@H](CNC(=O)c1ccc2cnccc2c1)C(F)(F)F	ZINC000450739074	CG	On-Demand	Anodyne	CYP17A1	27	40
C[C@@H](CNC(=O)c1ccc2cnccc2c1)C(F)(F)F	ZINC000450739075	CG	On-Demand	Anodyne	AKT1	21	44
C[C@@H](CNC(=O)c1ccc2cnccc2c1)C(F)(F)F	ZINC000450739075	CG	On-Demand	Anodyne	CYP17A1	27	40
C[C@@H](CNC(=O)c1ccc(-c2ccncc2)c(F)c1)C(F)(F)F	ZINC000450739092	EH	On-Demand	Anodyne	F3	82	43
C[C@@H](CNC(=O)c1ccc(-c2ccncc2)c(F)c1)C(F)(F)F	ZINC000450739092	EH	On-Demand	Anodyne	ROCK2	33	41
C[C@H](CNC(=O)c1ccc(-c2ccncc2)c(F)c1)C(F)(F)F	ZINC000450739093	EH	On-Demand	Anodyne	F3	82	43
C[C@H](CNC(=O)c1ccc(-c2ccncc2)c(F)c1)C(F)(F)F	ZINC000450739093	EH	On-Demand	Anodyne	ROCK2	33	41
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450739130	EH	On-Demand	Anodyne	PPARA	15	45
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450739130	EH	On-Demand	Anodyne	GRIN2B	0	42
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450739130	EH	On-Demand	Anodyne	PPARD	29	45
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450739130	EH	On-Demand	Anodyne	KCNK3	26	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450739130	EH	On-Demand	Anodyne	KCNK9	26	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450739131	EH	On-Demand	Anodyne	PPARA	15	45
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450739131	EH	On-Demand	Anodyne	GRIN2B	0	42
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450739131	EH	On-Demand	Anodyne	PPARD	29	45
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450739131	EH	On-Demand	Anodyne	KCNK3	26	40
COc1ccc(OC(F)(F)F)c(C(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450739131	EH	On-Demand	Anodyne	KCNK9	26	40
C[C@H](CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(F)(F)F	ZINC000450739142	FF	On-Demand	Anodyne	PIK3CD	23	40
C[C@H](CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(F)(F)F	ZINC000450739142	FF	On-Demand	Anodyne	PIK3CB	37	40
C[C@@H](CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(F)(F)F	ZINC000450739143	FF	On-Demand	Anodyne	PIK3CD	23	40
C[C@@H](CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C(F)(F)F	ZINC000450739143	FF	On-Demand	Anodyne	PIK3CB	37	40
C[C@H](OCCc1ccccc1)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450739158	FG	On-Demand	Anodyne	PPARG	21	48
C[C@H](OCCc1ccccc1)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450739158	FG	On-Demand	Anodyne	PPARA	22	48
C[C@H](OCCc1ccccc1)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450739158	FG	On-Demand	Anodyne	AMP1_PLAFQ	40	31
C[C@@H](OCCc1ccccc1)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450739159	FG	On-Demand	Anodyne	PPARG	21	48
C[C@@H](OCCc1ccccc1)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450739159	FG	On-Demand	Anodyne	PPARA	22	48
C[C@@H](OCCc1ccccc1)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450739159	FG	On-Demand	Anodyne	AMP1_PLAFQ	40	31
COc1ccc(CNC(=O)CCN[C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)c(OC)c1	ZINC000450739173	GG	On-Demand	Anodyne	MTNR1A	45	37
CC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2C2CC2)cc1	ZINC000450739187	FI	On-Demand	Anodyne	PTGDR2	15	43
Cc1cc(NC[C@@H]2CCO[C@@H](C(C)C)C2)n2ncnc2n1	ZINC000450739188	CE	On-Demand	Anodyne	DHOD	0	46
Cc1cc(NC[C@@H]2CCO[C@H](C(C)C)C2)n2ncnc2n1	ZINC000450739189	CE	On-Demand	Anodyne	DHOD	0	46
Cc1cc(NC[C@H]2CCO[C@@H](C(C)C)C2)n2ncnc2n1	ZINC000450739190	CE	On-Demand	Anodyne	DHOD	0	46
Cc1cc(NC[C@H]2CCO[C@H](C(C)C)C2)n2ncnc2n1	ZINC000450739191	CE	On-Demand	Anodyne	DHOD	0	46
CC(C)OC(=O)c1cccc(-c2nnn(Cc3cc(C(C)(C)C)on3)n2)c1	ZINC000450739214	FG	On-Demand	Anodyne	SCARB1	43	35
COc1ccccc1-c1noc([C@@H](C)NCc2c(C)cccc2Cl)n1	ZINC000450739215	FJ	On-Demand	Anodyne	LUCI_PHOPE	30	43
COc1ccccc1-c1noc([C@@H](C)NCc2c(C)cccc2Cl)n1	ZINC000450739215	FJ	On-Demand	Anodyne	EIF2AK1	53	43
COc1ccccc1-c1noc([C@H](C)NCc2c(C)cccc2Cl)n1	ZINC000450739216	FJ	On-Demand	Anodyne	LUCI_PHOPE	30	43
COc1ccccc1-c1noc([C@H](C)NCc2c(C)cccc2Cl)n1	ZINC000450739216	FJ	On-Demand	Anodyne	EIF2AK1	53	43
CNC(=O)c1cccnc1NC[C@H]1CCCC1(F)F	ZINC000450739255	CE	On-Demand	Anodyne	G2YM83_BOTF4	43	29
CNC(=O)c1cccnc1NC[C@@H]1CCCC1(F)F	ZINC000450739256	CE	On-Demand	Anodyne	G2YM83_BOTF4	43	29
CC(C)OC(C)(C)C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450739277	EH	On-Demand	Anodyne	NAMPT	0	40
C[C@@H](CNC(=O)Cc1ccccc1O[C@H]1CCOC1)C(F)(F)F	ZINC000450739279	EF	On-Demand	Anodyne	PDE4D	15	41
C[C@H](CNC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(F)(F)F	ZINC000450739280	EF	On-Demand	Anodyne	PDE4D	15	41
C[C@@H](CNC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(F)(F)F	ZINC000450739281	EF	On-Demand	Anodyne	PDE4D	15	41
C[C@H](CNC(=O)Cc1ccccc1O[C@H]1CCOC1)C(F)(F)F	ZINC000450739282	EF	On-Demand	Anodyne	PDE4D	15	41
C[C@H](CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000450739283	CH	On-Demand	Anodyne	SCN9A	0	44
C[C@H](CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1)C(F)(F)F	ZINC000450739284	CH	On-Demand	Anodyne	SCN9A	0	44
C[C@H](CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000450739285	CH	On-Demand	Anodyne	SCN9A	0	44
C[C@H](CNC(=O)[C@H]1CCC[C@H]1c1ccccc1)C(F)(F)F	ZINC000450739286	CH	On-Demand	Anodyne	SCN9A	0	44
Cc1cccc(Cl)c1CN[C@@H](CO)c1cnn(C)c1	ZINC000450739287	CE	On-Demand	Anodyne	EIF2AK1	40	35
Cc1cccc(Cl)c1CN[C@H](CO)c1cnn(C)c1	ZINC000450739288	CE	On-Demand	Anodyne	EIF2AK1	40	35
CCS(=O)(=O)c1ccc(CN[C@H]2CCCC[C@H]2C(N)=O)cc1	ZINC000450739297	DD	On-Demand	Anodyne	SSTR3	0	41
CCS(=O)(=O)c1ccc(CN[C@H]2CCCC[C@@H]2C(N)=O)cc1	ZINC000450739298	DD	On-Demand	Anodyne	SSTR3	0	41
CCS(=O)(=O)c1ccc(CN[C@@H]2CCCC[C@H]2C(N)=O)cc1	ZINC000450739299	DD	On-Demand	Anodyne	SSTR3	0	41
CCS(=O)(=O)c1ccc(CN[C@@H]2CCCC[C@@H]2C(N)=O)cc1	ZINC000450739300	DD	On-Demand	Anodyne	SSTR3	0	41
COCC(=O)NC1CN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450739305	FD	On-Demand	Anodyne	MTNR1A	23	49
COCC(=O)NC1CN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)C1	ZINC000450739305	FD	On-Demand	Anodyne	MTNR1B	26	49
C[C@@H](CNC(=O)c1ccc(I)cc1F)C(F)(F)F	ZINC000450739336	GG	On-Demand	Anodyne	MAP2K1	40	34
C[C@H](CNC(=O)c1ccc(I)cc1F)C(F)(F)F	ZINC000450739337	GG	On-Demand	Anodyne	MAP2K1	40	34
CCC(CC)(NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450739349	CE	On-Demand	Anodyne	ACHE	22	43
CCC(CC)(NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450739349	CE	On-Demand	Anodyne	LTA4H	28	41
CCC(CC)(NCCN(C)Cc1ccccc1)C(=O)OC	ZINC000450739349	CE	On-Demand	Anodyne	AMY2	53	32
COc1cc(CC(=O)NC[C@@H](C)C(F)(F)F)ccc1O	ZINC000450739351	CE	On-Demand	Anodyne	TRPV1	31	59
COc1cc(CC(=O)NC[C@@H](C)C(F)(F)F)ccc1O	ZINC000450739351	CE	On-Demand	Anodyne	ALOX15	0	46
COc1cc(CC(=O)NC[C@@H](C)C(F)(F)F)ccc1O	ZINC000450739351	CE	On-Demand	Anodyne	NCE103	40	49
COc1cc(CC(=O)NC[C@@H](C)C(F)(F)F)ccc1O	ZINC000450739351	CE	On-Demand	Anodyne	P96878_MYCTU	24	47
COc1cc(CC(=O)NC[C@@H](C)C(F)(F)F)ccc1O	ZINC000450739351	CE	On-Demand	Anodyne	CAN2	0	49
COc1cc(CC(=O)NC[C@@H](C)C(F)(F)F)ccc1O	ZINC000450739351	CE	On-Demand	Anodyne	SLC22A3	0	40
COc1cc(CC(=O)NC[C@H](C)C(F)(F)F)ccc1O	ZINC000450739352	CE	On-Demand	Anodyne	TRPV1	31	59
COc1cc(CC(=O)NC[C@H](C)C(F)(F)F)ccc1O	ZINC000450739352	CE	On-Demand	Anodyne	ALOX15	0	46
COc1cc(CC(=O)NC[C@H](C)C(F)(F)F)ccc1O	ZINC000450739352	CE	On-Demand	Anodyne	NCE103	40	49
COc1cc(CC(=O)NC[C@H](C)C(F)(F)F)ccc1O	ZINC000450739352	CE	On-Demand	Anodyne	P96878_MYCTU	24	47
COc1cc(CC(=O)NC[C@H](C)C(F)(F)F)ccc1O	ZINC000450739352	CE	On-Demand	Anodyne	CAN2	0	49
COc1cc(CC(=O)NC[C@H](C)C(F)(F)F)ccc1O	ZINC000450739352	CE	On-Demand	Anodyne	SLC22A3	0	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	ACE	33	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	MME	83	42
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	ANPEP	48	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	FCER2	48	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	PAPA1_CARPA	54	38
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	CYSP_TRYCR	47	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	CAPNS1	47	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	CTSS	29	46
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	CAPN1	45	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	CAPN2	48	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	ACE2	58	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	FPR1	47	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	NPR	44	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739356	CF	On-Demand	Anodyne	AMP1_PLAFQ	58	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	ACE	33	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	MME	83	42
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	ANPEP	48	35
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	FCER2	48	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	PAPA1_CARPA	54	38
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	CYSP_TRYCR	47	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	CAPNS1	47	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	CTSS	29	46
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	CAPN1	45	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	CAPN2	48	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	ACE2	58	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	FPR1	47	34
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	NPR	44	35
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450739357	CF	On-Demand	Anodyne	AMP1_PLAFQ	58	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	ACE	33	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	MME	83	42
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	ANPEP	48	35
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	FCER2	48	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	PAPA1_CARPA	54	38
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	CYSP_TRYCR	47	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	CAPNS1	47	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	CTSS	29	46
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	CAPN1	45	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	CAPN2	48	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	ACE2	58	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	FPR1	47	34
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	NPR	44	35
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739358	CF	On-Demand	Anodyne	AMP1_PLAFQ	58	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	ACE	33	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	MME	83	42
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	ANPEP	48	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	FCER2	48	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	PAPA1_CARPA	54	38
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	CYSP_TRYCR	47	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	CAPNS1	47	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	CTSS	29	46
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	CAPN1	45	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	CAPN2	48	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	ACE2	58	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	FPR1	47	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	NPR	44	35
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450739359	CF	On-Demand	Anodyne	AMP1_PLAFQ	58	37
CC[C@H](O)CC(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000450739368	CF	On-Demand	Anodyne	PREP	40	38
CC[C@H](O)CC(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000450739369	CF	On-Demand	Anodyne	PREP	40	38
CC[C@H](O)CC(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000450739370	CF	On-Demand	Anodyne	PREP	40	38
CC[C@H](O)CC(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000450739371	CF	On-Demand	Anodyne	PREP	40	38
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1	ZINC000450739372	FG	On-Demand	Anodyne	ADRB1	20	41
C[C@H](CO)[C@H](C)NCC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1	ZINC000450739372	FG	On-Demand	Anodyne	ADRB3	32	41
CCOC(=O)c1sc([C@@H](C)NCc2cc(Br)ccc2C)nc1C	ZINC000450739383	GJ	On-Demand	Anodyne	DHODH	23	44
CCOC(=O)c1sc([C@H](C)NCc2cc(Br)ccc2C)nc1C	ZINC000450739384	GJ	On-Demand	Anodyne	DHODH	23	44
Cc1nc(C)n(CCCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450739420	FH	On-Demand	Anodyne	SLC6A1	41	35
Cc1nc(C)n(CCCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450739420	FH	On-Demand	Anodyne	CCR1	47	42
Cc1nc(C)n(CCCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450739420	FH	On-Demand	Anodyne	MCHR1	15	48
Cc1nc(C)n(CCCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450739420	FH	On-Demand	Anodyne	ETHR	40	31
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1C1CC1	ZINC000450739433	EH	On-Demand	Anodyne	TNKS	46	31
CC(C)[C@@H]1C[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)CCO1	ZINC000450739438	DD	On-Demand	Bother	PRKCQ	42	36
CC(C)[C@H]1C[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)CCO1	ZINC000450739439	DD	On-Demand	Bother	PRKCQ	42	36
CC(C)[C@@H]1C[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)CCO1	ZINC000450739440	DD	On-Demand	Bother	PRKCQ	42	36
CC(C)[C@H]1C[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)CCO1	ZINC000450739441	DD	On-Demand	Bother	PRKCQ	42	36
COC[C@]1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CCOC1	ZINC000450739458	EG	On-Demand	Anodyne	SLC6A1	41	36
COC[C@]1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CCOC1	ZINC000450739458	EG	On-Demand	Anodyne	CCR1	46	43
COC[C@@]1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CCOC1	ZINC000450739459	EG	On-Demand	Anodyne	SLC6A1	41	36
COC[C@@]1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CCOC1	ZINC000450739459	EG	On-Demand	Anodyne	CCR1	46	43
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1	ZINC000450739473	FG	On-Demand	Anodyne	ADRB1	20	41
C[C@H](CO)[C@H](C)NCC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1	ZINC000450739473	FG	On-Demand	Anodyne	ADRB3	32	41
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1	ZINC000450739474	FG	On-Demand	Anodyne	ADRB1	20	41
C[C@H](CO)[C@@H](C)NCC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1	ZINC000450739474	FG	On-Demand	Anodyne	ADRB3	32	41
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1	ZINC000450739475	FG	On-Demand	Anodyne	ADRB1	20	41
C[C@H](CO)[C@@H](C)NCC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1	ZINC000450739475	FG	On-Demand	Anodyne	ADRB3	32	41
C/C=C/COc1cccc(CC(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450739476	DG	On-Demand	Anodyne	PDS	62	37
C/C=C\COc1cccc(CC(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450739477	DG	On-Demand	Anodyne	PDS	62	37
C/C=C/COc1cccc(CC(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450739478	DG	On-Demand	Anodyne	PDS	62	37
C/C=C\COc1cccc(CC(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450739479	DG	On-Demand	Anodyne	PDS	62	37
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@@H](C)[C@@H](C)CO	ZINC000450739496	ED	On-Demand	Anodyne	P2RX7	38	53
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@@H](C)[C@H](C)CO	ZINC000450739497	ED	On-Demand	Anodyne	P2RX7	38	53
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@H](C)[C@@H](C)CO	ZINC000450739498	ED	On-Demand	Anodyne	P2RX7	38	53
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN[C@H](C)[C@H](C)CO	ZINC000450739499	ED	On-Demand	Anodyne	P2RX7	38	53
C[C@@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(F)(F)F	ZINC000450739507	EH	On-Demand	Bother	PPXII	0	41
C[C@@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(F)(F)F	ZINC000450739507	EH	On-Demand	Bother	AADAC	0	41
C[C@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(F)(F)F	ZINC000450739508	EH	On-Demand	Bother	PPXII	0	41
C[C@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(F)(F)F	ZINC000450739508	EH	On-Demand	Bother	AADAC	0	41
C[C@H](CO)[C@H](C)NCC(=O)N1CCC(OCc2ccccc2)CC1	ZINC000450739526	ED	On-Demand	Anodyne	CAPN2	42	31
C[C@H](CO)[C@H](C)NCC(=O)N1CCC(OCc2ccccc2)CC1	ZINC000450739526	ED	On-Demand	Anodyne	SCD	23	42
C[C@H](NCC(=O)N1CCC(OCc2ccccc2)CC1)[C@@H](C)CO	ZINC000450739527	ED	On-Demand	Anodyne	CAPN2	42	31
C[C@H](NCC(=O)N1CCC(OCc2ccccc2)CC1)[C@@H](C)CO	ZINC000450739527	ED	On-Demand	Anodyne	SCD	23	42
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC(OCc2ccccc2)CC1	ZINC000450739528	ED	On-Demand	Anodyne	CAPN2	42	31
C[C@H](CO)[C@@H](C)NCC(=O)N1CCC(OCc2ccccc2)CC1	ZINC000450739528	ED	On-Demand	Anodyne	SCD	23	42
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCC(OCc2ccccc2)CC1	ZINC000450739529	ED	On-Demand	Anodyne	CAPN2	42	31
C[C@@H](CO)[C@@H](C)NCC(=O)N1CCC(OCc2ccccc2)CC1	ZINC000450739529	ED	On-Demand	Anodyne	SCD	23	42
C[C@@H](CNC(=O)c1cc2c(=O)n(C)c(=O)n(C)c2s1)C(F)(F)F	ZINC000450739535	ED	On-Demand	Anodyne	SLC16A1	45	32
C[C@H](CNC(=O)c1cc2c(=O)n(C)c(=O)n(C)c2s1)C(F)(F)F	ZINC000450739536	ED	On-Demand	Anodyne	SLC16A1	45	32
CCCOc1ccc(C(=O)NCc2noc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450739542	GH	On-Demand	Anodyne	PPARG	25	47
CCCOc1ccc(C(=O)NCc2noc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450739542	GH	On-Demand	Anodyne	PPARA	26	47
CCCOc1ccc(C(=O)NCc2noc(-c3cccc(F)c3)n2)c(OC)c1	ZINC000450739542	GH	On-Demand	Anodyne	HCRTR2	22	41
C[C@@H](CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(F)(F)F	ZINC000450739549	FF	On-Demand	Anodyne	PDE8B	56	33
C[C@H](CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(F)(F)F	ZINC000450739550	FF	On-Demand	Anodyne	PDE8B	56	33
C[C@@H](CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(F)(F)F	ZINC000450739551	FF	On-Demand	Anodyne	PDE8B	56	33
C[C@H](CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(F)(F)F	ZINC000450739552	FF	On-Demand	Anodyne	PDE8B	56	33
Cc1ccc(S(=O)(=O)N[C@H](CN[C@@H](C)[C@@H](C)CO)c2ccccc2)cc1	ZINC000450739568	GF	On-Demand	Anodyne	MMP13	21	43
Cc1ccc(S(=O)(=O)N[C@H](CN[C@@H](C)[C@@H](C)CO)c2ccccc2)cc1	ZINC000450739568	GF	On-Demand	Anodyne	MMP2	22	40
Cc1ccc(S(=O)(=O)N[C@H](CN[C@@H](C)[C@@H](C)CO)c2ccccc2)cc1	ZINC000450739568	GF	On-Demand	Anodyne	ADAMTS4	51	33
Cc1ccc(S(=O)(=O)N[C@H](CN[C@@H](C)[C@H](C)CO)c2ccccc2)cc1	ZINC000450739569	GF	On-Demand	Anodyne	MMP13	21	43
Cc1ccc(S(=O)(=O)N[C@H](CN[C@@H](C)[C@H](C)CO)c2ccccc2)cc1	ZINC000450739569	GF	On-Demand	Anodyne	MMP2	22	40
Cc1ccc(S(=O)(=O)N[C@H](CN[C@@H](C)[C@H](C)CO)c2ccccc2)cc1	ZINC000450739569	GF	On-Demand	Anodyne	ADAMTS4	51	33
Cc1ccc(S(=O)(=O)N[C@H](CN[C@H](C)[C@H](C)CO)c2ccccc2)cc1	ZINC000450739570	GF	On-Demand	Anodyne	MMP13	21	43
Cc1ccc(S(=O)(=O)N[C@H](CN[C@H](C)[C@H](C)CO)c2ccccc2)cc1	ZINC000450739570	GF	On-Demand	Anodyne	MMP2	22	40
Cc1ccc(S(=O)(=O)N[C@H](CN[C@H](C)[C@H](C)CO)c2ccccc2)cc1	ZINC000450739570	GF	On-Demand	Anodyne	ADAMTS4	51	33
Cc1ccc(S(=O)(=O)N[C@H](CN[C@H](C)[C@@H](C)CO)c2ccccc2)cc1	ZINC000450739571	GF	On-Demand	Anodyne	MMP13	21	43
Cc1ccc(S(=O)(=O)N[C@H](CN[C@H](C)[C@@H](C)CO)c2ccccc2)cc1	ZINC000450739571	GF	On-Demand	Anodyne	MMP2	22	40
Cc1ccc(S(=O)(=O)N[C@H](CN[C@H](C)[C@@H](C)CO)c2ccccc2)cc1	ZINC000450739571	GF	On-Demand	Anodyne	ADAMTS4	51	33
CCc1cc(NCCc2ncccc2C)nc(-c2ccccn2)n1	ZINC000450739572	DF	On-Demand	Anodyne	METAP1	29	41
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	ZINC000450739599	GE	On-Demand	Anodyne	CDK1	24	43
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	ZINC000450739599	GE	On-Demand	Anodyne	CDK4	23	43
O=C(Cc1ccc(O)c(F)c1)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	ZINC000450739599	GE	On-Demand	Anodyne	CALCA	0	42
COc1cccc(-n2cc(C(=O)NC[C@@H](C)C(F)(F)F)nn2)c1	ZINC000450739661	EE	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)NC[C@H](C)C(F)(F)F)nn2)c1	ZINC000450739662	EE	On-Demand	Anodyne	DRD4	43	33
O=C(CC1CC(F)(F)C1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450739665	EI	On-Demand	Anodyne	CACNA1H	41	33
O=C(CC1CC(F)(F)C1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450739665	EI	On-Demand	Anodyne	SLC6A3	15	40
O=C(CC1CC(F)(F)C1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450739665	EI	On-Demand	Anodyne	CCR1	52	51
O=C(CC1CC(F)(F)C1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450739665	EI	On-Demand	Anodyne	SLC18A3	20	45
CC(C)(C(=O)NCc1noc(-c2cccc(F)c2)n1)C1CCC1	ZINC000450739695	DG	On-Demand	Anodyne	KCNQ1	0	40
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)c1	ZINC000450739697	FH	On-Demand	Anodyne	ACACB	16	43
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)c1	ZINC000450739697	FH	On-Demand	Anodyne	RAF1	32	40
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)c1	ZINC000450739697	FH	On-Demand	Anodyne	MTNR1A	31	45
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)c1	ZINC000450739697	FH	On-Demand	Anodyne	MTNR1B	33	45
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)c1	ZINC000450739697	FH	On-Demand	Anodyne	ROCK2	40	36
COc1cccc(Oc2ccc(C(=O)NC[C@@H](C)C(F)(F)F)nc2)c1	ZINC000450739697	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	46	40
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)c1	ZINC000450739698	FH	On-Demand	Anodyne	ACACB	16	43
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)c1	ZINC000450739698	FH	On-Demand	Anodyne	RAF1	32	40
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)c1	ZINC000450739698	FH	On-Demand	Anodyne	MTNR1A	31	45
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)c1	ZINC000450739698	FH	On-Demand	Anodyne	MTNR1B	33	45
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)c1	ZINC000450739698	FH	On-Demand	Anodyne	ROCK2	40	36
COc1cccc(Oc2ccc(C(=O)NC[C@H](C)C(F)(F)F)nc2)c1	ZINC000450739698	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	46	40
CCOCc1nc(C)c(C(=O)NCc2noc(-c3cccc(F)c3)n2)s1	ZINC000450739712	GG	On-Demand	Anodyne	SCD1	36	42
CCOCc1nc(C)c(C(=O)NCc2noc(-c3cccc(F)c3)n2)s1	ZINC000450739712	GG	On-Demand	Anodyne	SCD	30	42
C[C@H](CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1)C(F)(F)F	ZINC000450739724	FF	On-Demand	Anodyne	E1	0	41
C[C@@H](CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1)C(F)(F)F	ZINC000450739725	FF	On-Demand	Anodyne	E1	0	41
C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000450739732	EI	On-Demand	Anodyne	RBP4	82	43
C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000450739733	EI	On-Demand	Anodyne	RBP4	82	43
Cc1ccc(C(=O)N2CCN(C(C)C)C(=O)C2)c(C(C)C)n1	ZINC000450739738	DE	On-Demand	Anodyne	P2RX7	19	55
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1)[C@@H](C)CO	ZINC000450739745	GE	On-Demand	Anodyne	CA2	18	45
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1)[C@@H](C)CO	ZINC000450739745	GE	On-Demand	Anodyne	CA4	17	42
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1)[C@@H](C)CO	ZINC000450739745	GE	On-Demand	Anodyne	IDO1	21	40
C[C@H](NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1)[C@@H](C)CO	ZINC000450739745	GE	On-Demand	Anodyne	P96878_MYCTU	20	41
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739746	GE	On-Demand	Anodyne	CA2	18	45
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739746	GE	On-Demand	Anodyne	CA4	17	42
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739746	GE	On-Demand	Anodyne	IDO1	21	40
C[C@H](CO)[C@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739746	GE	On-Demand	Anodyne	P96878_MYCTU	20	41
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739747	GE	On-Demand	Anodyne	CA2	18	45
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739747	GE	On-Demand	Anodyne	CA4	17	42
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739747	GE	On-Demand	Anodyne	IDO1	21	40
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739747	GE	On-Demand	Anodyne	P96878_MYCTU	20	41
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739748	GE	On-Demand	Anodyne	CA2	18	45
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739748	GE	On-Demand	Anodyne	CA4	17	42
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739748	GE	On-Demand	Anodyne	IDO1	21	40
C[C@H](CO)[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000450739748	GE	On-Demand	Anodyne	P96878_MYCTU	20	41
C[C@H](CO)[C@H](C)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000450739749	CE	On-Demand	Anodyne	CISD1	0	40
C[C@@H](CO)[C@@H](C)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000450739750	CE	On-Demand	Anodyne	CISD1	0	40
C[C@H](NCc1ccc2c(c1)OC(F)(F)O2)[C@@H](C)CO	ZINC000450739751	CE	On-Demand	Anodyne	CISD1	0	40
C[C@H](CO)[C@@H](C)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000450739752	CE	On-Demand	Anodyne	CISD1	0	40
C[C@H](CO)[C@@H](C)NCC(=O)Nc1cc(C(C)(C)C)nn1C	ZINC000450739758	CD	On-Demand	Anodyne	MAPK14	26	47
C[C@H](CO)[C@H](C)NCC(=O)Nc1cc(C(C)(C)C)nn1C	ZINC000450739759	CD	On-Demand	Anodyne	MAPK14	26	47
C[C@H](NCC(=O)Nc1cc(C(C)(C)C)nn1C)[C@@H](C)CO	ZINC000450739760	CD	On-Demand	Anodyne	MAPK14	26	47
C[C@@H](CO)[C@@H](C)NCC(=O)Nc1cc(C(C)(C)C)nn1C	ZINC000450739761	CD	On-Demand	Anodyne	MAPK14	26	47
C[C@H](CO)[C@@H](C)NC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000450739768	FD	On-Demand	Anodyne	ADRB2	15	45
C[C@H](CO)[C@H](C)NC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000450739769	FD	On-Demand	Anodyne	ADRB2	15	45
C[C@H](CO)[C@@H](C)NC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000450739770	FD	On-Demand	Anodyne	ADRB2	15	45
C[C@H](CO)[C@H](C)NC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000450739771	FD	On-Demand	Anodyne	ADRB2	15	45
CC(C)(C)C1=CCN(CCNC(=O)c2cccc(C#N)c2Br)CC1	ZINC000450739772	GH	On-Demand	Mild	DRD4	43	32
O=C(c1cc2n(n1)CCCC2)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450739776	EH	On-Demand	Anodyne	CCR1	44	45
O=C(c1cc2n(n1)CCCC2)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450739776	EH	On-Demand	Anodyne	L3MBTL3	72	36
C[C@@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739804	DC	On-Demand	Anodyne	MMP13	52	45
C[C@@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739804	DC	On-Demand	Anodyne	ADAM17	46	43
C[C@@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739804	DC	On-Demand	Anodyne	MMP3	36	45
C[C@@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739804	DC	On-Demand	Anodyne	MMP7	47	41
C[C@@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739804	DC	On-Demand	Anodyne	MMP1	44	45
C[C@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739805	DC	On-Demand	Anodyne	MMP13	52	45
C[C@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739805	DC	On-Demand	Anodyne	ADAM17	46	43
C[C@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739805	DC	On-Demand	Anodyne	MMP3	36	45
C[C@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739805	DC	On-Demand	Anodyne	MMP7	47	41
C[C@H](O)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450739805	DC	On-Demand	Anodyne	MMP1	44	45
CC(C)c1ncsc1C(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	ZINC000450739835	GF	On-Demand	Anodyne	CALCA	0	41
CCOC(=O)c1sc([C@H](C)NCCc2cscn2)nc1C	ZINC000450739840	EF	On-Demand	Anodyne	BMP1	54	35
CCOC(=O)c1sc([C@@H](C)NCCc2cscn2)nc1C	ZINC000450739841	EF	On-Demand	Anodyne	BMP1	54	35
O=C(c1cc2cccnc2s1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450739856	FJ	On-Demand	Anodyne	CCR1	44	47
Cc1cccc(Cl)c1CN[C@@H](C)c1cn[nH]c1	ZINC000450739857	BG	On-Demand	Anodyne	EIF2AK1	42	36
Cc1cccc(Cl)c1CN[C@H](C)c1cn[nH]c1	ZINC000450739858	BG	On-Demand	Anodyne	EIF2AK1	42	36
COc1cc(OC)c2ncnc(NCCc3ncccc3C)c2c1	ZINC000450739874	DE	On-Demand	Anodyne	PDE6A	42	33
CCCOc1cccc(CN[C@@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450739881	CG	On-Demand	Anodyne	HRH2	21	40
CCCOc1cccc(CN[C@@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450739881	CG	On-Demand	Anodyne	ACACA	32	42
CCCOc1cccc(CN[C@@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450739881	CG	On-Demand	Anodyne	PTGES	18	41
CCCOc1cccc(CN[C@@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450739881	CG	On-Demand	Anodyne	PDS	72	36
CCCOc1cccc(CN[C@@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450739882	CG	On-Demand	Anodyne	HRH2	21	40
CCCOc1cccc(CN[C@@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450739882	CG	On-Demand	Anodyne	ACACA	32	42
CCCOc1cccc(CN[C@@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450739882	CG	On-Demand	Anodyne	PTGES	18	41
CCCOc1cccc(CN[C@@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450739882	CG	On-Demand	Anodyne	PDS	72	36
CCCOc1cccc(CN[C@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450739883	CG	On-Demand	Anodyne	HRH2	21	40
CCCOc1cccc(CN[C@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450739883	CG	On-Demand	Anodyne	ACACA	32	42
CCCOc1cccc(CN[C@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450739883	CG	On-Demand	Anodyne	PTGES	18	41
CCCOc1cccc(CN[C@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450739883	CG	On-Demand	Anodyne	PDS	72	36
CCCOc1cccc(CN[C@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450739884	CG	On-Demand	Anodyne	HRH2	21	40
CCCOc1cccc(CN[C@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450739884	CG	On-Demand	Anodyne	ACACA	32	42
CCCOc1cccc(CN[C@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450739884	CG	On-Demand	Anodyne	PTGES	18	41
CCCOc1cccc(CN[C@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450739884	CG	On-Demand	Anodyne	PDS	72	36
C[C@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739885	FI	On-Demand	Anodyne	AVPR1B	46	42
C[C@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739885	FI	On-Demand	Anodyne	ELANE	47	42
C[C@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739885	FI	On-Demand	Anodyne	PDE6D	94	39
C[C@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739885	FI	On-Demand	Anodyne	CTRC	51	37
C[C@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739885	FI	On-Demand	Anodyne	IMDH_CRYPV	39	55
C[C@@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739886	FI	On-Demand	Anodyne	AVPR1B	46	42
C[C@@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739886	FI	On-Demand	Anodyne	ELANE	47	42
C[C@@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739886	FI	On-Demand	Anodyne	PDE6D	94	39
C[C@@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739886	FI	On-Demand	Anodyne	CTRC	51	37
C[C@@H](CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21)C(F)(F)F	ZINC000450739886	FI	On-Demand	Anodyne	IMDH_CRYPV	39	55
O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450739895	FH	On-Demand	Anodyne	NAMPT	25	41
Cc1cnc(CCCC(=O)NCc2noc(-c3cccc(F)c3)n2)o1	ZINC000450739902	EF	On-Demand	Anodyne	SUCNR1	45	35
CCCCOc1ccc(NC(=O)CCc2nc3cnccc3[nH]2)cn1	ZINC000450739952	EG	On-Demand	Anodyne	ENPP1	40	32
COCC(=O)NC1CN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450739963	FD	On-Demand	Anodyne	CCR8	23	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450739966	GF	On-Demand	Anodyne	CCR2	40	39
COc1cc(CC(=O)NC[C@@H](C)C(F)(F)F)ccc1Cl	ZINC000450739970	DG	On-Demand	Anodyne	NCE103	30	46
COc1cc(CC(=O)NC[C@@H](C)C(F)(F)F)ccc1Cl	ZINC000450739970	DG	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)NC[C@H](C)C(F)(F)F)ccc1Cl	ZINC000450739971	DG	On-Demand	Anodyne	NCE103	30	46
COc1cc(CC(=O)NC[C@H](C)C(F)(F)F)ccc1Cl	ZINC000450739971	DG	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)NCCN2CC=C(C(C)(C)C)CC2)ccc1O	ZINC000450739972	EF	On-Demand	Anodyne	DRD4	41	32
COc1cc(CC(=O)NCCN2CC=C(C(C)(C)C)CC2)ccc1O	ZINC000450739972	EF	On-Demand	Anodyne	TRPV1	46	55
COc1cc(CC(=O)NCCN2CC=C(C(C)(C)C)CC2)ccc1O	ZINC000450739972	EF	On-Demand	Anodyne	QDPR	0	40
COc1cc(CC(=O)NCCN2CC=C(C(C)(C)C)CC2)ccc1O	ZINC000450739972	EF	On-Demand	Anodyne	NCE103	30	45
COc1cc(CC(=O)NCCN2CC=C(C(C)(C)C)CC2)ccc1O	ZINC000450739972	EF	On-Demand	Anodyne	CAN2	0	45
Cn1nc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c2c1CCCC2	ZINC000450740021	FH	On-Demand	Anodyne	SLC6A1	40	37
Cn1nc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c2c1CCCC2	ZINC000450740021	FH	On-Demand	Anodyne	CCR1	45	42
Cn1nc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c2c1CCCC2	ZINC000450740021	FH	On-Demand	Anodyne	L3MBTL3	43	32
Cc1ccc(F)c(CC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1	ZINC000450740031	GF	On-Demand	Anodyne	CDK1	23	44
Cc1ccc(F)c(CC(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)c1	ZINC000450740031	GF	On-Demand	Anodyne	CDK4	22	44
COc1ccc(CNC(=O)CCN[C@H](C)c2nc(C(C)(C)C)no2)c(OC)c1	ZINC000450740034	GF	On-Demand	Anodyne	PDGFRB	25	40
COc1ccc(CNC(=O)CCN[C@H](C)c2nc(C(C)(C)C)no2)c(OC)c1	ZINC000450740034	GF	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN[C@H](C)c2nc(C(C)(C)C)no2)c(OC)c1	ZINC000450740034	GF	On-Demand	Anodyne	MTNR1B	43	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2nc(C(C)(C)C)no2)c(OC)c1	ZINC000450740035	GF	On-Demand	Anodyne	PDGFRB	25	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2nc(C(C)(C)C)no2)c(OC)c1	ZINC000450740035	GF	On-Demand	Anodyne	MTNR1A	51	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2nc(C(C)(C)C)no2)c(OC)c1	ZINC000450740035	GF	On-Demand	Anodyne	MTNR1B	43	38
COc1ccccc1-c1noc([C@@H](C)NCc2cccc(C)n2)n1	ZINC000450740040	DG	On-Demand	Anodyne	LUCI_PHOPE	31	44
COc1ccccc1-c1noc([C@H](C)NCc2cccc(C)n2)n1	ZINC000450740041	DG	On-Demand	Anodyne	LUCI_PHOPE	31	44
CC(C)[C@@H]1C[C@@H](CNc2cc(C#N)ccn2)CCO1	ZINC000450740052	CF	On-Demand	Mild	MAP3K12	47	35
CC(C)[C@@H]1C[C@H](CNc2cc(C#N)ccn2)CCO1	ZINC000450740053	CF	On-Demand	Mild	MAP3K12	47	35
CC(C)[C@H]1C[C@@H](CNc2cc(C#N)ccn2)CCO1	ZINC000450740054	CF	On-Demand	Mild	MAP3K12	47	35
CC(C)[C@H]1C[C@H](CNc2cc(C#N)ccn2)CCO1	ZINC000450740055	CF	On-Demand	Mild	MAP3K12	47	35
CC(C)OC(=O)c1cccc(-c2nnn(CC[C@@H](C)O)n2)c1	ZINC000450740056	DD	On-Demand	Anodyne	SCARB1	49	38
CC(C)OC(=O)c1cccc(-c2nnn(CC[C@H](C)O)n2)c1	ZINC000450740057	DD	On-Demand	Anodyne	SCARB1	49	38
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	ALOX5	18	42
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	MAOB	40	38
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	PRKDC	15	45
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	MMP13	67	48
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	TRY2_BOVIN	63	37
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	ADAM17	56	44
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	MMP2	24	40
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	MMP3	39	40
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	NR1H4	41	36
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	TGM2	43	37
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	MMP7	44	37
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	ADAMTS4	57	44
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	MMP1	50	41
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	F13A1	53	37
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	FFAR1	52	35
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	AKR1C3	47	37
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000450740064	GE	On-Demand	Anodyne	NAMPT	34	42
C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)C(F)(F)F	ZINC000450740081	EI	On-Demand	Anodyne	GPR88	0	43
C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)C(F)(F)F	ZINC000450740082	EI	On-Demand	Anodyne	GPR88	0	43
CCCCOc1ccc(NC(=O)c2cn3nccc3nc2C)cn1	ZINC000450740084	EF	On-Demand	Anodyne	KIT	0	43
CCCCOc1ccc(NC(=O)c2cn3nccc3nc2C)cn1	ZINC000450740084	EF	On-Demand	Anodyne	DDR1	59	43
CCC(CC)(NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450740088	EE	On-Demand	Anodyne	PTPRB	61	37
CCC(CC)(NCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450740088	EE	On-Demand	Anodyne	RORC	55	34
CCOC(=O)c1ccc2c(c1)nc(CN[C@H](C)[C@H](C)CO)n2CC	ZINC000450740117	EE	On-Demand	Anodyne	SLC27A1	17	40
CCOC(=O)c1ccc2c(c1)nc(CN[C@@H](C)[C@H](C)CO)n2CC	ZINC000450740118	EE	On-Demand	Anodyne	SLC27A1	17	40
CCOC(=O)c1ccc2c(c1)nc(CN[C@H](C)[C@@H](C)CO)n2CC	ZINC000450740119	EE	On-Demand	Anodyne	SLC27A1	17	40
CCOC(=O)c1ccc2c(c1)nc(CN[C@@H](C)[C@@H](C)CO)n2CC	ZINC000450740120	EE	On-Demand	Anodyne	SLC27A1	17	40
CC[C@@H]1[C@H](C)CCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450740130	EI	On-Demand	Anodyne	MTNR1B	23	40
CC[C@@H]1[C@@H](C)CCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450740131	EI	On-Demand	Anodyne	MTNR1B	23	40
CC[C@H]1[C@H](C)CCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450740132	EI	On-Demand	Anodyne	MTNR1B	23	40
CC[C@H]1[C@@H](C)CCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450740133	EI	On-Demand	Anodyne	MTNR1B	23	40
C[C@@H](Sc1nnc([C@H]2COc3ccccc3O2)o1)C(=O)Nc1nccs1	ZINC000450740154	GG	On-Demand	Anodyne	MAP1	68	33
C[C@H](Sc1nnc([C@@H]2COc3ccccc3O2)o1)C(=O)Nc1nccs1	ZINC000450740155	GG	On-Demand	Anodyne	MAP1	68	33
C[C@H](Sc1nnc([C@H]2COc3ccccc3O2)o1)C(=O)Nc1nccs1	ZINC000450740156	GG	On-Demand	Anodyne	MAP1	68	33
C[C@@H](Sc1nnc([C@@H]2COc3ccccc3O2)o1)C(=O)Nc1nccs1	ZINC000450740157	GG	On-Demand	Anodyne	MAP1	68	33
Cc1cccc(Cl)c1C(=O)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450740159	FG	On-Demand	Mild	HDAC8	0	45
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000450740160	FG	On-Demand	Mild	HDAC8	0	45
CCC(CC)Oc1ccc(C(=O)NCCN2C(=O)NC3(CCCC3)C2=O)cc1	ZINC000450740161	GF	On-Demand	Anodyne	PLD2	47	36
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC[C@@H](C)C(F)(F)F	ZINC000450740162	FG	On-Demand	Anodyne	TRPV1	16	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC[C@H](C)C(F)(F)F	ZINC000450740163	FG	On-Demand	Anodyne	TRPV1	16	41
CC(C)(C)C1=CCN(CCNC(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450740164	FH	On-Demand	Anodyne	PLD2	45	32
CC(C)OC(=O)c1cccc(-c2nnn(C[C@@H]3CCC(F)(F)C3)n2)c1	ZINC000450740177	FG	On-Demand	Anodyne	SCARB1	51	39
CC(C)OC(=O)c1cccc(-c2nnn(C[C@H]3CCC(F)(F)C3)n2)c1	ZINC000450740178	FG	On-Demand	Anodyne	SCARB1	51	39
CCOC(=O)c1sc([C@@H](C)NCc2c(C)cccc2Cl)nc1C	ZINC000450740208	FI	On-Demand	Anodyne	DHODH	25	46
CCOC(=O)c1sc([C@H](C)NCc2c(C)cccc2Cl)nc1C	ZINC000450740209	FI	On-Demand	Anodyne	DHODH	25	46
CC(=O)CCCCCOc1ccc(C#N)cc1Cl	ZINC000450740242	CH	On-Demand	Mild	ENR	0	43
CC(C)[C@@H]1C[C@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)CCO1	ZINC000450740253	DD	On-Demand	Bother	IKBKB	26	41
CC(C)[C@H]1C[C@@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)CCO1	ZINC000450740254	DD	On-Demand	Bother	IKBKB	26	41
CC(C)[C@@H]1C[C@@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)CCO1	ZINC000450740255	DD	On-Demand	Bother	IKBKB	26	41
CC(C)[C@H]1C[C@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)CCO1	ZINC000450740256	DD	On-Demand	Bother	IKBKB	26	41
C[C@@H](NCCc1cscn1)c1nc(-c2ccc(Br)cc2)cs1	ZINC000450740276	GJ	On-Demand	Anodyne	SREBF2	0	43
C[C@H](NCCc1cscn1)c1nc(-c2ccc(Br)cc2)cs1	ZINC000450740277	GJ	On-Demand	Anodyne	SREBF2	0	43
CCCCCN(CCCOC)C(=O)c1ccc(N2CCC2)nc1	ZINC000450740289	DF	On-Demand	Anodyne	PLM2_PLAFA	54	38
CC[C@@H]1C[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450740302	DG	On-Demand	Anodyne	NAMPT	30	44
Cc1cccc(CNC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450740308	DH	On-Demand	Anodyne	PDE8A	0	40
Cc1cccc(CNC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450740308	DH	On-Demand	Anodyne	PDE8B	50	41
Cc1cccc(CNC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450740309	DH	On-Demand	Anodyne	PDE8A	0	40
Cc1cccc(CNC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450740309	DH	On-Demand	Anodyne	PDE8B	50	41
Cc1cccc(CN[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450740310	DH	On-Demand	Anodyne	PDE8A	0	40
Cc1cccc(CN[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450740310	DH	On-Demand	Anodyne	PDE8B	50	41
COC(=O)C1(CN[C@H](C)c2noc(Cc3ccccc3)n2)CC1	ZINC000450740313	DE	On-Demand	Anodyne	TPSAB1	40	35
COC(=O)C1(CN[C@@H](C)c2noc(Cc3ccccc3)n2)CC1	ZINC000450740314	DE	On-Demand	Anodyne	TPSAB1	40	35
CCC(CC)(NCc1ccn(CCc2ccccc2)n1)C(=O)OC	ZINC000450740338	EF	On-Demand	Anodyne	FAS	19	40
Cn1c(C#N)ccc1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450740343	EF	On-Demand	Mild	NAMPT	0	42
COC(=O)[C@H](CC(C)C)N[C@H](C)[C@@H](C)CO	ZINC000450740351	BD	On-Demand	Anodyne	FOLH1	30	40
COC(=O)[C@H](CC(C)C)N[C@@H](C)[C@@H](C)CO	ZINC000450740352	BD	On-Demand	Anodyne	FOLH1	30	40
COC(=O)[C@H](CC(C)C)N[C@H](C)[C@H](C)CO	ZINC000450740353	BD	On-Demand	Anodyne	FOLH1	30	40
COC(=O)[C@H](CC(C)C)N[C@@H](C)[C@H](C)CO	ZINC000450740354	BD	On-Demand	Anodyne	FOLH1	30	40
CCC(CC)(NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740358	CF	On-Demand	Anodyne	MME	52	37
CCC(CC)(NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740358	CF	On-Demand	Anodyne	CPA1	49	36
CCC(CC)(NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740358	CF	On-Demand	Anodyne	SOAT1	0	40
CCC(CC)(NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740358	CF	On-Demand	Anodyne	PTPRB	42	38
CCC(CC)(NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740358	CF	On-Demand	Anodyne	ACE2	48	36
CCC(CC)(NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740358	CF	On-Demand	Anodyne	POL	0	40
CCC(CC)(NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740358	CF	On-Demand	Anodyne	BLAIMP-1	0	40
CCC(CC)(NC[C@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740358	CF	On-Demand	Anodyne	PDS	56	36
CCC(CC)(NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740359	CF	On-Demand	Anodyne	MME	52	37
CCC(CC)(NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740359	CF	On-Demand	Anodyne	CPA1	49	36
CCC(CC)(NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740359	CF	On-Demand	Anodyne	SOAT1	0	40
CCC(CC)(NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740359	CF	On-Demand	Anodyne	PTPRB	42	38
CCC(CC)(NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740359	CF	On-Demand	Anodyne	ACE2	48	36
CCC(CC)(NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740359	CF	On-Demand	Anodyne	POL	0	40
CCC(CC)(NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740359	CF	On-Demand	Anodyne	BLAIMP-1	0	40
CCC(CC)(NC[C@@H](Cc1ccccc1)OC)C(=O)OC	ZINC000450740359	CF	On-Demand	Anodyne	PDS	56	36
O=C(N1CCC(c2ccc(Cl)cc2)CC1)C1(C(F)(F)F)CCC1	ZINC000450740399	EJ	On-Demand	Anodyne	CACNA1H	40	35
O=C(N1CCC(c2ccc(Cl)cc2)CC1)C1(C(F)(F)F)CCC1	ZINC000450740399	EJ	On-Demand	Anodyne	CCR1	55	44
O=C(N1CCC(c2ccc(Cl)cc2)CC1)C1(C(F)(F)F)CCC1	ZINC000450740399	EJ	On-Demand	Anodyne	SLC18A3	26	48
CCCc1nc(C)c(COc2ccc(C#N)cc2Cl)o1	ZINC000450740424	CI	On-Demand	Mild	ENR	0	45
COc1cc(CN2CCN3CCOC[C@H]3C2)ccc1Cl	ZINC000450740425	CD	On-Demand	Anodyne	DRD4	17	46
COc1cc(CN2CCN3CCOC[C@H]3C2)ccc1Cl	ZINC000450740425	CD	On-Demand	Anodyne	SIGMAR1	18	42
COc1cc(CN2CCN3CCOC[C@@H]3C2)ccc1Cl	ZINC000450740426	CD	On-Demand	Anodyne	DRD4	17	46
COc1cc(CN2CCN3CCOC[C@@H]3C2)ccc1Cl	ZINC000450740426	CD	On-Demand	Anodyne	SIGMAR1	18	42
O=C(c1ccc2nccnc2n1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740462	FH	On-Demand	Anodyne	CCR1	44	43
CCCc1cc(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)no1	ZINC000450740479	EI	On-Demand	Anodyne	GRM4	29	42
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)C(F)(F)F	ZINC000450740494	EF	On-Demand	Bother	GSTM2	44	32
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)C(F)(F)F	ZINC000450740495	EF	On-Demand	Bother	GSTM2	44	32
O=C(Nc1ccc(Cl)c(OC(F)F)c1)C1(CF)CCOCC1	ZINC000450740525	EH	On-Demand	Anodyne	ENV	42	33
C[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000450740528	EF	On-Demand	Bother	CACNA1D	40	34
C[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000450740529	EF	On-Demand	Bother	CACNA1D	40	34
N#Cc1cnc(NC[C@H]2CCCC2(F)F)c(Cl)c1	ZINC000450740577	CG	On-Demand	Mild	IRAK4	16	44
N#Cc1cnc(NC[C@@H]2CCCC2(F)F)c(Cl)c1	ZINC000450740578	CG	On-Demand	Mild	IRAK4	16	44
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740594	FJ	On-Demand	Anodyne	CCR1	46	42
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740594	FJ	On-Demand	Anodyne	SLC9A1	21	43
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450740595	EE	On-Demand	Anodyne	HSD11B1	15	40
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450740595	EE	On-Demand	Anodyne	MMP13	33	40
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450740595	EE	On-Demand	Anodyne	MMP3	16	40
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450740595	EE	On-Demand	Anodyne	PKM	30	44
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000450740595	EE	On-Demand	Anodyne	MMP1	16	40
COCCNC(=O)c1ccc(NC[C@@H]2CCO[C@@H](C(C)C)C2)nc1	ZINC000450740603	ED	On-Demand	Anodyne	IKBKB	15	45
COCCNC(=O)c1ccc(NC[C@H]2CCO[C@@H](C(C)C)C2)nc1	ZINC000450740604	ED	On-Demand	Anodyne	IKBKB	15	45
COCCNC(=O)c1ccc(NC[C@H]2CCO[C@H](C(C)C)C2)nc1	ZINC000450740605	ED	On-Demand	Anodyne	IKBKB	15	45
COCCNC(=O)c1ccc(NC[C@@H]2CCO[C@H](C(C)C)C2)nc1	ZINC000450740606	ED	On-Demand	Anodyne	IKBKB	15	45
COCC1=CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450740607	FG	On-Demand	Anodyne	HRH4	22	46
CS(=O)(=O)c1ccc(NC[C@H]2CCCC2(F)F)c(C(F)(F)F)c1	ZINC000450740636	FH	On-Demand	Anodyne	SFRP1	48	32
CS(=O)(=O)c1ccc(NC[C@@H]2CCCC2(F)F)c(C(F)(F)F)c1	ZINC000450740637	FH	On-Demand	Anodyne	SFRP1	48	32
CCc1cccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)c(F)c2)n1	ZINC000450740638	GE	On-Demand	Anodyne	CALCA	0	45
CCCOc1ccc(C(=O)NCCN2C(=O)NC3(CCCC3)C2=O)c(OC)c1	ZINC000450740705	GE	On-Demand	Anodyne	HCN1	54	38
CCCOc1ccc(C(=O)NCCN2C(=O)NC3(CCCC3)C2=O)c(OC)c1	ZINC000450740705	GE	On-Demand	Anodyne	HCN4	49	34
COC(=O)c1ccc(C(=O)Cn2nnc(-c3cccc(C(=O)OC(C)C)c3)n2)o1	ZINC000450740790	GE	On-Demand	Anodyne	SCARB1	52	41
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450740830	GF	On-Demand	Bother	TAAR1	19	40
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450740831	GF	On-Demand	Bother	TAAR1	19	40
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450740832	GF	On-Demand	Bother	TAAR1	19	40
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450740833	GF	On-Demand	Bother	TAAR1	19	40
CC[C@@H]1C[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740842	CI	On-Demand	Anodyne	SLC6A1	68	49
CC[C@@H]1C[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740842	CI	On-Demand	Anodyne	SLC6A4	15	41
CC[C@@H]1C[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740842	CI	On-Demand	Anodyne	SLC6A3	20	41
CC[C@@H]1C[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740842	CI	On-Demand	Anodyne	MC4R	42	38
CC[C@@H]1C[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740842	CI	On-Demand	Anodyne	PRCP	48	38
CC[C@@H]1C[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740842	CI	On-Demand	Anodyne	CCR1	52	49
CC[C@H](CC(F)(F)F)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740858	EK	On-Demand	Anodyne	SLC6A1	50	34
CC[C@H](CC(F)(F)F)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740858	EK	On-Demand	Anodyne	PRCP	15	42
CC[C@H](CC(F)(F)F)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740858	EK	On-Demand	Anodyne	CCR1	62	53
CC[C@H](CC(F)(F)F)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740858	EK	On-Demand	Anodyne	DPP7	36	42
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740859	EK	On-Demand	Anodyne	SLC6A1	50	34
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740859	EK	On-Demand	Anodyne	PRCP	15	42
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740859	EK	On-Demand	Anodyne	CCR1	62	53
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740859	EK	On-Demand	Anodyne	DPP7	36	42
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450740860	GJ	On-Demand	Anodyne	CCR1	45	43
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450740860	GJ	On-Demand	Anodyne	FASN	40	40
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)cn1	ZINC000450740860	GJ	On-Demand	Anodyne	L3MBTL3	40	38
Cc1cccnc1CCNc1nc(N(C)C)c2ccccc2n1	ZINC000450740921	DE	On-Demand	Anodyne	ADRA2A	16	45
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@H](C)C(F)(F)F)ccc21	ZINC000450740948	GH	On-Demand	Anodyne	DRD2	19	42
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@H](C)C(F)(F)F)ccc21	ZINC000450740948	GH	On-Demand	Anodyne	DRD3	31	42
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@H](C)C(F)(F)F)ccc21	ZINC000450740948	GH	On-Demand	Anodyne	CYSLTR1	51	44
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@H](C)C(F)(F)F)ccc21	ZINC000450740948	GH	On-Demand	Anodyne	PDGFRB	15	44
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@H](C)C(F)(F)F)ccc21	ZINC000450740948	GH	On-Demand	Anodyne	CPT1A	46	32
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@H](C)C(F)(F)F)ccc21	ZINC000450740948	GH	On-Demand	Anodyne	PLK1	76	38
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@H](C)C(F)(F)F)ccc21	ZINC000450740948	GH	On-Demand	Anodyne	PLK3	41	37
COc1ccccc1-n1cnc2cc(C(=O)NC[C@@H](C)C(F)(F)F)ccc21	ZINC000450740948	GH	On-Demand	Anodyne	HPGD	45	55
COc1ccccc1-n1cnc2cc(C(=O)NC[C@H](C)C(F)(F)F)ccc21	ZINC000450740949	GH	On-Demand	Anodyne	DRD2	19	42
COc1ccccc1-n1cnc2cc(C(=O)NC[C@H](C)C(F)(F)F)ccc21	ZINC000450740949	GH	On-Demand	Anodyne	DRD3	31	42
COc1ccccc1-n1cnc2cc(C(=O)NC[C@H](C)C(F)(F)F)ccc21	ZINC000450740949	GH	On-Demand	Anodyne	CYSLTR1	51	44
COc1ccccc1-n1cnc2cc(C(=O)NC[C@H](C)C(F)(F)F)ccc21	ZINC000450740949	GH	On-Demand	Anodyne	PDGFRB	15	44
COc1ccccc1-n1cnc2cc(C(=O)NC[C@H](C)C(F)(F)F)ccc21	ZINC000450740949	GH	On-Demand	Anodyne	CPT1A	46	32
COc1ccccc1-n1cnc2cc(C(=O)NC[C@H](C)C(F)(F)F)ccc21	ZINC000450740949	GH	On-Demand	Anodyne	PLK1	76	38
COc1ccccc1-n1cnc2cc(C(=O)NC[C@H](C)C(F)(F)F)ccc21	ZINC000450740949	GH	On-Demand	Anodyne	PLK3	41	37
COc1ccccc1-n1cnc2cc(C(=O)NC[C@H](C)C(F)(F)F)ccc21	ZINC000450740949	GH	On-Demand	Anodyne	HPGD	45	55
C[C@H](CNC(=O)c1cc(Cl)c2ccccc2n1)C(F)(F)F	ZINC000450740957	DH	On-Demand	Anodyne	TACR3	48	34
C[C@@H](CNC(=O)c1cc(Cl)c2ccccc2n1)C(F)(F)F	ZINC000450740958	DH	On-Demand	Anodyne	TACR3	48	34
COc1cc(CC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)ccc1Cl	ZINC000450740959	GD	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)ccc1Cl	ZINC000450740959	GD	On-Demand	Anodyne	NCE103	23	44
COc1cc(CC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)ccc1Cl	ZINC000450740959	GD	On-Demand	Anodyne	P96878_MYCTU	17	44
COc1cc(CC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)ccc1Cl	ZINC000450740959	GD	On-Demand	Anodyne	CAN2	0	44
COCC1=CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450740978	DF	On-Demand	Anodyne	CCR1	27	40
O=C(Cc1ccc(O)c(F)c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450740985	EI	On-Demand	Anodyne	CCR1	55	48
Cc1[nH]c(C#N)cc1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741014	EH	On-Demand	Mild	CCR1	45	42
Cc1[nH]c(C#N)cc1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741014	EH	On-Demand	Mild	FASN	50	43
C[C@@H]1CCO[C@@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741036	DG	On-Demand	Anodyne	CACNA1H	44	35
C[C@@H]1CCO[C@@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741036	DG	On-Demand	Anodyne	CCR1	52	47
CCOC(=O)[C@@H](NCc1ccc(Cl)c(OC)c1)C1CCOCC1	ZINC000450741054	EF	On-Demand	Anodyne	PDE6A	41	33
CCOC(=O)[C@H](NCc1ccc(Cl)c(OC)c1)C1CCOCC1	ZINC000450741055	EF	On-Demand	Anodyne	PDE6A	41	33
COCCNC(=O)c1ccc(NC[C@H]2CCCC2(F)F)nc1	ZINC000450741066	DE	On-Demand	Anodyne	KCNQ1	0	40
COCCNC(=O)c1ccc(NC[C@@H]2CCCC2(F)F)nc1	ZINC000450741067	DE	On-Demand	Anodyne	KCNQ1	0	40
CC[C@H]1[C@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450741070	FG	On-Demand	Mild	COLA	36	40
CC[C@H]1[C@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450741070	FG	On-Demand	Mild	CPT1A	29	40
CC[C@@H]1[C@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450741071	FG	On-Demand	Mild	COLA	36	40
CC[C@@H]1[C@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450741071	FG	On-Demand	Mild	CPT1A	29	40
CC[C@H]1[C@@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450741072	FG	On-Demand	Mild	COLA	36	40
CC[C@H]1[C@@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450741072	FG	On-Demand	Mild	CPT1A	29	40
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@H]2C(N)=O)c(OC)c1	ZINC000450741092	FD	On-Demand	Anodyne	NQO2	30	40
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@H]2C(N)=O)c(OC)c1	ZINC000450741092	FD	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@H]2C(N)=O)c(OC)c1	ZINC000450741092	FD	On-Demand	Anodyne	MTNR1B	48	37
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@@H]2C(N)=O)c(OC)c1	ZINC000450741093	FD	On-Demand	Anodyne	NQO2	30	40
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@@H]2C(N)=O)c(OC)c1	ZINC000450741093	FD	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@@H]2C(N)=O)c(OC)c1	ZINC000450741093	FD	On-Demand	Anodyne	MTNR1B	48	37
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2C(N)=O)c(OC)c1	ZINC000450741094	FD	On-Demand	Anodyne	NQO2	30	40
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2C(N)=O)c(OC)c1	ZINC000450741094	FD	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2C(N)=O)c(OC)c1	ZINC000450741094	FD	On-Demand	Anodyne	MTNR1B	48	37
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@@H]2C(N)=O)c(OC)c1	ZINC000450741095	FD	On-Demand	Anodyne	NQO2	30	40
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@@H]2C(N)=O)c(OC)c1	ZINC000450741095	FD	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@@H]2C(N)=O)c(OC)c1	ZINC000450741095	FD	On-Demand	Anodyne	MTNR1B	48	37
C[C@H](CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000450741108	DI	On-Demand	Anodyne	SCN9A	0	42
C[C@@H](CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000450741109	DI	On-Demand	Anodyne	SCN9A	0	42
COc1cc(CN[C@H]2CCCC[C@@H]2C(N)=O)ccc1Cl	ZINC000450741118	CE	On-Demand	Anodyne	SSTR3	28	53
COc1cc(CN[C@@H]2CCCC[C@H]2C(N)=O)ccc1Cl	ZINC000450741119	CE	On-Demand	Anodyne	SSTR3	28	53
COc1cc(CN[C@@H]2CCCC[C@@H]2C(N)=O)ccc1Cl	ZINC000450741120	CE	On-Demand	Anodyne	SSTR3	28	53
COc1cc(CN[C@H]2CCCC[C@H]2C(N)=O)ccc1Cl	ZINC000450741121	CE	On-Demand	Anodyne	SSTR3	28	53
C[C@H](CNC(=O)c1cc2ccncc2s1)C(F)(F)F	ZINC000450741143	CG	On-Demand	Anodyne	ICAM1	46	37
C[C@H](CNC(=O)c1cc2ccncc2s1)C(F)(F)F	ZINC000450741143	CG	On-Demand	Anodyne	VCAM1	47	37
C[C@@H](CNC(=O)c1cc2ccncc2s1)C(F)(F)F	ZINC000450741144	CG	On-Demand	Anodyne	ICAM1	46	37
C[C@@H](CNC(=O)c1cc2ccncc2s1)C(F)(F)F	ZINC000450741144	CG	On-Demand	Anodyne	VCAM1	47	37
CC(C)(C)C1=CCN(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450741148	DG	On-Demand	Anodyne	CACNA1H	27	40
CC(C)(C)C1=CCN(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450741148	DG	On-Demand	Anodyne	DRD4	46	36
CC(C)(C)C1=CCN(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450741148	DG	On-Demand	Anodyne	PLD2	44	34
CC(C)(C)C1=CCN(CCNC(=O)c2cncc(Cl)c2)CC1	ZINC000450741148	DG	On-Demand	Anodyne	CACNA1I	52	35
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	HTR1A	16	45
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	DRD2	21	44
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	DRD4	50	38
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	DRD3	39	44
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	COLA	61	36
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	CPT1A	59	36
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	CPT2	44	36
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	PLD2	49	38
COc1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450741154	GF	On-Demand	Anodyne	CPT1B	40	36
C[C@@H](CNC(=O)c1cc(-c2ccccc2)nn1C)C(F)(F)F	ZINC000450741162	DG	On-Demand	Anodyne	CTSV	52	36
C[C@@H](CNC(=O)c1cc(-c2ccccc2)nn1C)C(F)(F)F	ZINC000450741162	DG	On-Demand	Anodyne	CARM1	51	34
C[C@H](CNC(=O)c1cc(-c2ccccc2)nn1C)C(F)(F)F	ZINC000450741163	DG	On-Demand	Anodyne	CTSV	52	36
C[C@H](CNC(=O)c1cc(-c2ccccc2)nn1C)C(F)(F)F	ZINC000450741163	DG	On-Demand	Anodyne	CARM1	51	34
O=C(NCCN1C(=O)NC2(CCCC2)C1=O)c1ccnc(OC(F)F)c1	ZINC000450741169	FD	On-Demand	Anodyne	PLD2	56	34
CC[C@@H]1[C@@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450741173	FG	On-Demand	Mild	COLA	36	40
CC[C@@H]1[C@@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450741173	FG	On-Demand	Mild	CPT1A	29	40
CC[C@@H]1[C@@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450741178	CG	On-Demand	Anodyne	GPR88	0	42
CC[C@H]1[C@@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450741179	CG	On-Demand	Anodyne	GPR88	0	42
CC[C@H]1[C@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450741180	CG	On-Demand	Anodyne	GPR88	0	42
CCOC(=O)c1sc([C@@H](C)NCCC[C@H](C)O)nc1C	ZINC000450741181	DE	On-Demand	Anodyne	DHODH	19	40
CCOC(=O)c1sc([C@H](C)NCCC[C@@H](C)O)nc1C	ZINC000450741182	DE	On-Demand	Anodyne	DHODH	19	40
CCOC(=O)c1sc([C@@H](C)NCCC[C@@H](C)O)nc1C	ZINC000450741183	DE	On-Demand	Anodyne	DHODH	19	40
CCOC(=O)c1sc([C@H](C)NCCC[C@H](C)O)nc1C	ZINC000450741184	DE	On-Demand	Anodyne	DHODH	19	40
COCC1=CCN(C(=O)c2ccccc2-n2ccc(C)n2)CC1	ZINC000450741187	DF	On-Demand	Anodyne	AVPR2	19	41
CCOC(=O)c1sc([C@@H](C)NCc2cc(C)ccc2F)nc1C	ZINC000450741198	EH	On-Demand	Anodyne	DHODH	23	40
CCOC(=O)c1sc([C@H](C)NCc2cc(C)ccc2F)nc1C	ZINC000450741199	EH	On-Demand	Anodyne	DHODH	23	40
O=C(c1ccc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450741200	FF	On-Demand	Bother	L3MBTL1	0	42
O=C(c1ccc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450741200	FF	On-Demand	Bother	L3MBTL3	23	42
O=C(c1ccc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450741201	FF	On-Demand	Bother	L3MBTL1	0	42
O=C(c1ccc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450741201	FF	On-Demand	Bother	L3MBTL3	23	42
C=CCn1c(SC2CC(OC(C)(C)C)C2)nnc1-c1cccnc1	ZINC000450741211	EH	On-Demand	Mild	VCP	50	33
Cc1ccn(CC(=O)N2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450741253	DG	On-Demand	Anodyne	CCR1	62	43
C[C@H](Oc1ccccn1)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741266	EH	On-Demand	Anodyne	PRCP	23	40
C[C@H](Oc1ccccn1)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741266	EH	On-Demand	Anodyne	CCR1	59	53
C[C@@H](Oc1ccccn1)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741267	EH	On-Demand	Anodyne	PRCP	23	40
C[C@@H](Oc1ccccn1)C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741267	EH	On-Demand	Anodyne	CCR1	59	53
C[C@H](NCc1cncn1Cc1ccccc1)[C@@H](C)CO	ZINC000450741319	CE	On-Demand	Anodyne	CYP11B1	0	43
C[C@H](NCc1cncn1Cc1ccccc1)[C@@H](C)CO	ZINC000450741319	CE	On-Demand	Anodyne	CYP11B2	23	57
C[C@H](CO)[C@H](C)NCc1cncn1Cc1ccccc1	ZINC000450741320	CE	On-Demand	Anodyne	CYP11B1	0	43
C[C@H](CO)[C@H](C)NCc1cncn1Cc1ccccc1	ZINC000450741320	CE	On-Demand	Anodyne	CYP11B2	23	57
C[C@@H](CO)[C@@H](C)NCc1cncn1Cc1ccccc1	ZINC000450741321	CE	On-Demand	Anodyne	CYP11B1	0	43
C[C@@H](CO)[C@@H](C)NCc1cncn1Cc1ccccc1	ZINC000450741321	CE	On-Demand	Anodyne	CYP11B2	23	57
C[C@H](CO)[C@@H](C)NCc1cncn1Cc1ccccc1	ZINC000450741322	CE	On-Demand	Anodyne	CYP11B1	0	43
C[C@H](CO)[C@@H](C)NCc1cncn1Cc1ccccc1	ZINC000450741322	CE	On-Demand	Anodyne	CYP11B2	23	57
CC(C)c1sc(NC(=O)CN[C@@H](C)[C@@H](C)CO)nc1-c1ccccc1	ZINC000450741345	FG	On-Demand	Anodyne	RORC	15	40
CC(C)c1sc(NC(=O)CN[C@@H](C)[C@H](C)CO)nc1-c1ccccc1	ZINC000450741346	FG	On-Demand	Anodyne	RORC	15	40
CC(C)c1sc(NC(=O)CN[C@H](C)[C@@H](C)CO)nc1-c1ccccc1	ZINC000450741347	FG	On-Demand	Anodyne	RORC	15	40
CC(C)c1sc(NC(=O)CN[C@H](C)[C@H](C)CO)nc1-c1ccccc1	ZINC000450741348	FG	On-Demand	Anodyne	RORC	15	40
Cc1nn(C)cc1CC(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450741358	ED	On-Demand	Anodyne	P2RX7	55	41
COc1cc([N+](=O)[O-])ccc1CN[C@H](C)[C@H](C)CO	ZINC000450741359	CD	On-Demand	Bother	KCNMA1	19	40
COc1cc([N+](=O)[O-])ccc1CN[C@@H](C)[C@@H](C)CO	ZINC000450741360	CD	On-Demand	Bother	KCNMA1	19	40
COc1cc([N+](=O)[O-])ccc1CN[C@H](C)[C@@H](C)CO	ZINC000450741361	CD	On-Demand	Bother	KCNMA1	19	40
COc1cc([N+](=O)[O-])ccc1CN[C@@H](C)[C@H](C)CO	ZINC000450741362	CD	On-Demand	Bother	KCNMA1	19	40
CC1CCN(C(=O)c2ccc(NC[C@@H]3CCCC3(F)F)nc2)CC1	ZINC000450741437	EH	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(NC[C@@H]3CCCC3(F)F)nc2)CC1	ZINC000450741437	EH	On-Demand	Anodyne	L3MBTL3	69	40
CC1CCN(C(=O)c2ccc(NC[C@H]3CCCC3(F)F)nc2)CC1	ZINC000450741438	EH	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(NC[C@H]3CCCC3(F)F)nc2)CC1	ZINC000450741438	EH	On-Demand	Anodyne	L3MBTL3	69	40
CCOC(=O)c1sc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)nc1C	ZINC000450741447	FG	On-Demand	Anodyne	DHODH	24	43
CCOC(=O)c1sc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)nc1C	ZINC000450741448	FG	On-Demand	Anodyne	DHODH	24	43
CCOC(=O)c1sc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)nc1C	ZINC000450741449	FG	On-Demand	Anodyne	DHODH	24	43
CCOC(=O)c1sc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)nc1C	ZINC000450741450	FG	On-Demand	Anodyne	DHODH	24	43
CC(C)OC(=O)c1cccc(-c2nnn(CC3(C#N)CCC3)n2)c1	ZINC000450741453	EF	On-Demand	Mild	SCARB1	48	37
CC(=O)c1ccc(Cn2nnc(-c3cccc(C(=O)OC(C)C)c3)n2)cc1	ZINC000450741454	FG	On-Demand	Anodyne	MGLL	0	43
CC(=O)c1ccc(Cn2nnc(-c3cccc(C(=O)OC(C)C)c3)n2)cc1	ZINC000450741454	FG	On-Demand	Anodyne	SCARB1	44	36
Fc1ccc(OC[C@H]2CCCC2(F)F)cc1F	ZINC000450741455	BH	On-Demand	Anodyne	CHRNA10	53	52
Fc1ccc(OC[C@@H]2CCCC2(F)F)cc1F	ZINC000450741456	BH	On-Demand	Anodyne	CHRNA10	53	52
CCCNC(=O)c1ccc(NC[C@@H]2CCO[C@@H](C(C)C)C2)nc1	ZINC000450741463	DF	On-Demand	Anodyne	IKBKB	15	44
CCCNC(=O)c1ccc(NC[C@H]2CCO[C@@H](C(C)C)C2)nc1	ZINC000450741464	DF	On-Demand	Anodyne	IKBKB	15	44
CCCNC(=O)c1ccc(NC[C@H]2CCO[C@H](C(C)C)C2)nc1	ZINC000450741465	DF	On-Demand	Anodyne	IKBKB	15	44
CCCNC(=O)c1ccc(NC[C@@H]2CCO[C@H](C(C)C)C2)nc1	ZINC000450741466	DF	On-Demand	Anodyne	IKBKB	15	44
CO[C@H](COc1ccc(S(=O)(=O)N2CCOCC2)cc1)Cc1ccccc1	ZINC000450741467	GE	On-Demand	Anodyne	PKM	19	42
CO[C@@H](COc1ccc(S(=O)(=O)N2CCOCC2)cc1)Cc1ccccc1	ZINC000450741468	GE	On-Demand	Anodyne	PKM	19	42
CC(C)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1=O	ZINC000450741474	FD	On-Demand	Anodyne	P2RX7	17	47
CC(C)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1=O	ZINC000450741474	FD	On-Demand	Anodyne	EPHX2	21	49
Cc1cccnc1CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450741498	FE	On-Demand	Bother	BDKRB1	24	44
COC(=O)C1(CN[C@@H](C)c2cnn(Cc3ccccc3)c2)CC1	ZINC000450741525	DF	On-Demand	Anodyne	NPFFR1	44	35
COC(=O)C1(CN[C@H](C)c2cnn(Cc3ccccc3)c2)CC1	ZINC000450741526	DF	On-Demand	Anodyne	NPFFR1	44	35
Cc1ccn2ncc(C(=O)NC[C@@H](C)C(F)(F)F)c2c1	ZINC000450741535	CF	On-Demand	Anodyne	EPHB3	35	51
Cc1ccn2ncc(C(=O)NC[C@H](C)C(F)(F)F)c2c1	ZINC000450741536	CF	On-Demand	Anodyne	EPHB3	35	51
COc1cc(CN[C@H](C)[C@H](C)CO)ccc1Cl	ZINC000450741595	CE	On-Demand	Anodyne	TTR	0	40
COc1cc(CN[C@@H](C)[C@@H](C)CO)ccc1Cl	ZINC000450741596	CE	On-Demand	Anodyne	TTR	0	40
COc1cc(CN[C@H](C)[C@@H](C)CO)ccc1Cl	ZINC000450741597	CE	On-Demand	Anodyne	TTR	0	40
COc1cc(CN[C@@H](C)[C@H](C)CO)ccc1Cl	ZINC000450741598	CE	On-Demand	Anodyne	TTR	0	40
COCCOC[C@H](O)CN[C@@H](C)c1ncc(-c2ccccc2)o1	ZINC000450741604	DE	On-Demand	Anodyne	ADRB2	19	40
COCCOC[C@@H](O)CN[C@H](C)c1ncc(-c2ccccc2)o1	ZINC000450741605	DE	On-Demand	Anodyne	ADRB2	19	40
COCCOC[C@H](O)CN[C@H](C)c1ncc(-c2ccccc2)o1	ZINC000450741606	DE	On-Demand	Anodyne	ADRB2	19	40
COCCOC[C@@H](O)CN[C@@H](C)c1ncc(-c2ccccc2)o1	ZINC000450741607	DE	On-Demand	Anodyne	ADRB2	19	40
C[C@H](CO)[C@H](C)NCC(=O)N1CCN([C@@H](C#N)c2cccs2)CC1	ZINC000450741617	FD	On-Demand	Mild	PTAFR	40	49
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN([C@@H](C#N)c2cccs2)CC1	ZINC000450741618	FD	On-Demand	Mild	PTAFR	40	49
C[C@H](CO)[C@H](C)NCC(=O)N1CCN([C@H](C#N)c2cccs2)CC1	ZINC000450741619	FD	On-Demand	Mild	PTAFR	40	49
C[C@H](CO)[C@@H](C)NCC(=O)N1CCN([C@H](C#N)c2cccs2)CC1	ZINC000450741620	FD	On-Demand	Mild	PTAFR	40	49
CC(=O)c1ccc(CN2CCN3CCOC[C@@H]3C2)cc1	ZINC000450741676	CD	On-Demand	Anodyne	L3MBTL1	0	40
CC(=O)c1ccc(CN2CCN3CCOC[C@H]3C2)cc1	ZINC000450741677	CD	On-Demand	Anodyne	L3MBTL1	0	40
CC(=O)CCCCCn1nnc(-c2cccc(C(=O)OC(C)C)c2)n1	ZINC000450741710	EG	On-Demand	Anodyne	SCARB1	44	37
CC[C@@H]1[C@@H](C)CCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450741712	DG	On-Demand	Anodyne	PDEC	0	40
CC[C@@H]1[C@H](C)CCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450741713	DG	On-Demand	Anodyne	PDEC	0	40
CC[C@@H]1[C@H](C)CCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450741714	DG	On-Demand	Anodyne	PDEC	0	40
CC[C@@H]1[C@@H](C)CCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450741715	DG	On-Demand	Anodyne	PDEC	0	40
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741738	DH	On-Demand	Mild	SLC6A1	0	42
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741738	DH	On-Demand	Mild	MC4R	19	41
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741738	DH	On-Demand	Mild	CCR1	45	42
CCCNC(=O)c1ccc(NC[C@H]2CCCC2(F)F)nc1	ZINC000450741742	CG	On-Demand	Anodyne	KCNQ1	0	42
CCCNC(=O)c1ccc(NC[C@@H]2CCCC2(F)F)nc1	ZINC000450741743	CG	On-Demand	Anodyne	KCNQ1	0	42
COc1cc(CC(=O)N2CCC(c3ccc(Cl)cc3)CC2)ccc1O	ZINC000450741744	FI	On-Demand	Anodyne	SLC6A1	40	38
COc1cc(CC(=O)N2CCC(c3ccc(Cl)cc3)CC2)ccc1O	ZINC000450741744	FI	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N2CCC(c3ccc(Cl)cc3)CC2)ccc1O	ZINC000450741744	FI	On-Demand	Anodyne	CCR1	53	48
COc1cc(CC(=O)N2CCC(c3ccc(Cl)cc3)CC2)ccc1O	ZINC000450741744	FI	On-Demand	Anodyne	CCR2	0	51
O=C(Cc1cc2ccccc2c(O)n1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741749	GJ	On-Demand	Anodyne	CCR1	49	45
O=C(Cc1cc2ccccc2c(O)n1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741749	GJ	On-Demand	Anodyne	GRIN2D	76	33
COCC1=CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450741792	FH	On-Demand	Anodyne	FABI	49	35
COCC1=CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450741792	FH	On-Demand	Anodyne	PDE6D	65	39
COCC1=CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450741792	FH	On-Demand	Anodyne	IMDH_CRYPV	30	44
COc1ccc(CNC(=O)CCN[C@H](C)c2ncc(C)s2)c(OC)c1	ZINC000450741799	FF	On-Demand	Anodyne	PDGFRB	32	48
COc1ccc(CNC(=O)CCN[C@@H](C)c2ncc(C)s2)c(OC)c1	ZINC000450741800	FF	On-Demand	Anodyne	PDGFRB	32	48
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450741803	GD	On-Demand	Anodyne	MMP13	68	39
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450741803	GD	On-Demand	Anodyne	ADAM17	49	36
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450741803	GD	On-Demand	Anodyne	MMP3	52	39
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450741803	GD	On-Demand	Anodyne	MMP7	53	37
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450741803	GD	On-Demand	Anodyne	MMP1	51	39
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1	ZINC000450741803	GD	On-Demand	Anodyne	NAMPT	18	40
O=C(c1ccc(NC[C@@H]2CCCC2(F)F)nc1)N1CCc2ccccc21	ZINC000450741806	FI	On-Demand	Anodyne	AVPR2	110	40
O=C(c1ccc(NC[C@@H]2CCCC2(F)F)nc1)N1CCc2ccccc21	ZINC000450741806	FI	On-Demand	Anodyne	AVPR1A	61	40
O=C(c1ccc(NC[C@H]2CCCC2(F)F)nc1)N1CCc2ccccc21	ZINC000450741807	FI	On-Demand	Anodyne	AVPR2	110	40
O=C(c1ccc(NC[C@H]2CCCC2(F)F)nc1)N1CCc2ccccc21	ZINC000450741807	FI	On-Demand	Anodyne	AVPR1A	61	40
CC(C)OC(=O)c1cccc(-c2nnn(Cc3cn(CC4CC4)nn3)n2)c1	ZINC000450741819	FD	On-Demand	Anodyne	SCARB1	54	43
N#C[C@]1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC12CCCC2	ZINC000450741837	EJ	On-Demand	Mild	CCR1	44	41
N#C[C@@]1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CC12CCCC2	ZINC000450741838	EJ	On-Demand	Mild	CCR1	44	41
COCC1=CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741839	EH	On-Demand	Anodyne	MC4R	27	40
COCC1=CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741839	EH	On-Demand	Anodyne	PRCP	52	37
COCC1=CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741839	EH	On-Demand	Anodyne	MC3R	35	40
COCC1=CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741839	EH	On-Demand	Anodyne	MC5R	28	40
COCC1=CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741840	EH	On-Demand	Anodyne	MC4R	27	40
COCC1=CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741840	EH	On-Demand	Anodyne	PRCP	52	37
COCC1=CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741840	EH	On-Demand	Anodyne	MC3R	35	40
COCC1=CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741840	EH	On-Demand	Anodyne	MC5R	28	40
COCC1=CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741841	EH	On-Demand	Anodyne	MC4R	27	40
COCC1=CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741841	EH	On-Demand	Anodyne	PRCP	52	37
COCC1=CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741841	EH	On-Demand	Anodyne	MC3R	35	40
COCC1=CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741841	EH	On-Demand	Anodyne	MC5R	28	40
COCC1=CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741842	EH	On-Demand	Anodyne	MC4R	27	40
COCC1=CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741842	EH	On-Demand	Anodyne	PRCP	52	37
COCC1=CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741842	EH	On-Demand	Anodyne	MC3R	35	40
COCC1=CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450741842	EH	On-Demand	Anodyne	MC5R	28	40
O=[N+]([O-])c1cccc2ncnc(NC[C@H]3CCCC3(F)F)c12	ZINC000450741847	DF	On-Demand	Bother	PRKCQ	40	34
O=[N+]([O-])c1cccc2ncnc(NC[C@@H]3CCCC3(F)F)c12	ZINC000450741848	DF	On-Demand	Bother	PRKCQ	40	34
CC(C)OC(=O)c1cccc(-c2nnn(C[C@@H]3C[C@H]4CC[C@H]3O4)n2)c1	ZINC000450741861	EE	On-Demand	Anodyne	SCARB1	49	37
CC(C)OC(=O)c1cccc(-c2nnn(C[C@H]3C[C@H]4CC[C@H]3O4)n2)c1	ZINC000450741862	EE	On-Demand	Anodyne	SCARB1	49	37
O=S(=O)(NCC1CC1)c1ccc(NC[C@H]2CCCC2(F)F)nc1	ZINC000450741882	EE	On-Demand	Anodyne	NPY1R	41	35
O=S(=O)(NCC1CC1)c1ccc(NC[C@H]2CCCC2(F)F)nc1	ZINC000450741882	EE	On-Demand	Anodyne	NPY2R	68	37
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H]2CCCC2(F)F)nc1	ZINC000450741883	EE	On-Demand	Anodyne	NPY1R	41	35
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H]2CCCC2(F)F)nc1	ZINC000450741883	EE	On-Demand	Anodyne	NPY2R	68	37
CCc1nc(C)c(Cn2c(=O)oc3cc(Cl)ccc32)o1	ZINC000450741884	CG	On-Demand	Anodyne	MIF	16	40
CC(C)[C@@H]1C[C@@H](CNc2ncccc2[N+](=O)[O-])CCO1	ZINC000450741885	CF	On-Demand	Bother	PRKCQ	47	38
CC(C)[C@H]1C[C@H](CNc2ncccc2[N+](=O)[O-])CCO1	ZINC000450741886	CF	On-Demand	Bother	PRKCQ	47	38
CC(C)[C@H]1C[C@@H](CNc2ncccc2[N+](=O)[O-])CCO1	ZINC000450741887	CF	On-Demand	Bother	PRKCQ	47	38
CC(C)[C@@H]1C[C@H](CNc2ncccc2[N+](=O)[O-])CCO1	ZINC000450741888	CF	On-Demand	Bother	PRKCQ	47	38
CCOC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)C1CCOCC1	ZINC000450741897	EE	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)C1CCOCC1	ZINC000450741898	EE	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)C1CCOCC1	ZINC000450741899	EE	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)C1CCOCC1	ZINC000450741900	EE	On-Demand	Anodyne	TIMP3	45	32
O=C(c1cccnc1NC[C@@H]1CCCC1(F)F)N1CCc2ccccc21	ZINC000450741911	FI	On-Demand	Anodyne	AVPR2	65	38
O=C(c1cccnc1NC[C@@H]1CCCC1(F)F)N1CCc2ccccc21	ZINC000450741911	FI	On-Demand	Anodyne	GPBAR1	15	40
O=C(c1cccnc1NC[C@H]1CCCC1(F)F)N1CCc2ccccc21	ZINC000450741912	FI	On-Demand	Anodyne	AVPR2	65	38
O=C(c1cccnc1NC[C@H]1CCCC1(F)F)N1CCc2ccccc21	ZINC000450741912	FI	On-Demand	Anodyne	GPBAR1	15	40
CC(C)[C@H]1C[C@@H](CNc2ccc(C(=O)N(C)C)cn2)CCO1	ZINC000450741913	DE	On-Demand	Anodyne	IKBKB	15	40
CC(C)[C@@H]1C[C@H](CNc2ccc(C(=O)N(C)C)cn2)CCO1	ZINC000450741914	DE	On-Demand	Anodyne	IKBKB	15	40
CC(C)[C@H]1C[C@H](CNc2ccc(C(=O)N(C)C)cn2)CCO1	ZINC000450741915	DE	On-Demand	Anodyne	IKBKB	15	40
CC(C)[C@@H]1C[C@@H](CNc2ccc(C(=O)N(C)C)cn2)CCO1	ZINC000450741916	DE	On-Demand	Anodyne	IKBKB	15	40
O=C(c1cc(NC[C@H]2CCCC2(F)F)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450741937	FH	On-Demand	Bother	L3MBTL3	18	40
O=C(c1cc(NC[C@@H]2CCCC2(F)F)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450741938	FH	On-Demand	Bother	L3MBTL3	18	40
CCCc1cc(NC[C@@H]2CCCC2(F)F)n2ncnc2n1	ZINC000450741960	CF	On-Demand	Anodyne	DHOD	0	41
CCCc1cc(NC[C@H]2CCCC2(F)F)n2ncnc2n1	ZINC000450741961	CF	On-Demand	Anodyne	DHOD	0	41
CC[C@H]1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O	ZINC000450741976	BC	On-Demand	Anodyne	XPNPEP1	0	51
CC[C@H]1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O	ZINC000450741976	BC	On-Demand	Anodyne	PEPD	0	40
CC[C@H]1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O	ZINC000450741976	BC	On-Demand	Anodyne	XPNPEP2	0	51
CC[C@H]1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O	ZINC000450741977	BC	On-Demand	Anodyne	XPNPEP1	0	51
CC[C@H]1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O	ZINC000450741977	BC	On-Demand	Anodyne	PEPD	0	40
CC[C@H]1CCC[C@H]1C(=O)N[C@@H](C)C(N)=O	ZINC000450741977	BC	On-Demand	Anodyne	XPNPEP2	0	51
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	CASP3	0	41
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	MMP13	87	45
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	ADAM17	68	42
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	MMP2	35	43
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	MMP3	52	43
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	MMP14	23	41
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	MMP9	35	40
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	TGM2	48	37
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	MMP7	52	39
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	ADAMTS4	52	51
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	MMP1	64	43
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	F13A1	53	37
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	NAMPT	31	45
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1	ZINC000450741982	GE	On-Demand	Anodyne	DDIT3	0	42
O=C(c1cn(CCc2ccccc2)nn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741988	GI	On-Demand	Anodyne	SLC6A1	24	42
O=C(c1cn(CCc2ccccc2)nn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741988	GI	On-Demand	Anodyne	SIGMAR1	17	40
O=C(c1cn(CCc2ccccc2)nn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741988	GI	On-Demand	Anodyne	PRCP	25	41
O=C(c1cn(CCc2ccccc2)nn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741988	GI	On-Demand	Anodyne	CCR1	49	50
O=C(c1cn(CCc2ccccc2)nn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450741988	GI	On-Demand	Anodyne	THYX_PBCV1	0	41
CCc1cc(NC[C@H]2CCO[C@@H](C(C)C)C2)n2ncnc2n1	ZINC000450741990	DF	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@H]2CCO[C@H](C(C)C)C2)n2ncnc2n1	ZINC000450741991	DF	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@@H]2CCO[C@H](C(C)C)C2)n2ncnc2n1	ZINC000450741992	DF	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@@H]2CCO[C@@H](C(C)C)C2)n2ncnc2n1	ZINC000450741993	DF	On-Demand	Anodyne	DHOD	0	44
C[C@H](c1ccc(Cn2nnc3ccccc32)cc1)C(F)(F)F	ZINC000450742050	DI	On-Demand	Anodyne	ALOX5AP	34	41
C[C@H](c1ccc(Cn2nnc3ccccc32)cc1)C(F)(F)F	ZINC000450742050	DI	On-Demand	Anodyne	PTK2	27	45
C[C@@H](c1ccc(Cn2nnc3ccccc32)cc1)C(F)(F)F	ZINC000450742051	DI	On-Demand	Anodyne	ALOX5AP	34	41
C[C@@H](c1ccc(Cn2nnc3ccccc32)cc1)C(F)(F)F	ZINC000450742051	DI	On-Demand	Anodyne	PTK2	27	45
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450742071	EI	On-Demand	Anodyne	SLC6A3	17	47
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450742071	EI	On-Demand	Anodyne	PRCP	63	39
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450742071	EI	On-Demand	Anodyne	CCR1	50	44
CC(C)OC(=O)c1cccc(-c2nnn(CCC[C@@H](C)O)n2)c1	ZINC000450742077	DE	On-Demand	Anodyne	SCARB1	45	37
CC(C)OC(=O)c1cccc(-c2nnn(CCC[C@H](C)O)n2)c1	ZINC000450742078	DE	On-Demand	Anodyne	SCARB1	45	37
Fc1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1F	ZINC000450742079	BF	On-Demand	Anodyne	CHRNA10	36	48
Fc1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1F	ZINC000450742080	BF	On-Demand	Anodyne	CHRNA10	36	48
COC(=O)c1cnc(NC[C@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450742099	DF	On-Demand	Bother	PRKCQ	45	34
COC(=O)c1cnc(NC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])c1	ZINC000450742100	DF	On-Demand	Bother	PRKCQ	45	34
COc1ccccc1-c1noc([C@@H](C)NCC2=CCCCC2)n1	ZINC000450742109	DH	On-Demand	Anodyne	LUCI_PHOPE	30	42
COc1ccccc1-c1noc([C@H](C)NCC2=CCCCC2)n1	ZINC000450742110	DH	On-Demand	Anodyne	LUCI_PHOPE	30	42
CCOC(=O)c1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)on1	ZINC000450742133	FH	On-Demand	Anodyne	SLC6A1	40	39
CCOC(=O)c1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)on1	ZINC000450742133	FH	On-Demand	Anodyne	CCR1	46	44
CCO[C@@H]1CCN(c2ncnc3c(C)cccc23)C[C@@H]1C	ZINC000450742144	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2ncnc3c(C)cccc23)C[C@H]1C	ZINC000450742145	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@@H]1CCN(c2ncnc3c(C)cccc23)C[C@H]1C	ZINC000450742146	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2ncnc3c(C)cccc23)C[C@@H]1C	ZINC000450742147	CG	On-Demand	Anodyne	PDE3A	47	38
CC(C)(C(=O)NCCc1ccc(OCC(F)(F)F)nc1)C1CCC1	ZINC000450742149	EH	On-Demand	Anodyne	SCN9A	0	40
Cc1nn(C)cc1CC(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450742150	FD	On-Demand	Anodyne	SCN9A	0	48
CCO[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450742157	DF	On-Demand	Bother	PDE3A	42	35
CCO[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450742157	DF	On-Demand	Bother	PDE3B	63	35
CCO[C@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450742158	DF	On-Demand	Bother	PDE3A	42	35
CCO[C@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450742158	DF	On-Demand	Bother	PDE3B	63	35
CCO[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450742159	DF	On-Demand	Bother	PDE3A	42	35
CCO[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450742159	DF	On-Demand	Bother	PDE3B	63	35
CCO[C@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450742160	DF	On-Demand	Bother	PDE3A	42	35
CCO[C@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450742160	DF	On-Demand	Bother	PDE3B	63	35
CC[C@H]1CN(Cc2cnn[nH]2)CCN1Cc1ccccc1	ZINC000450742173	CD	On-Demand	Anodyne	SIGMAR1	19	45
CC[C@@H]1CN(Cc2cnn[nH]2)CCN1Cc1ccccc1	ZINC000450742174	CD	On-Demand	Anodyne	SIGMAR1	19	45
COc1ccc(CNC(=O)CCN2CCC3(CCOCC3)[C@@H]2C)c(OC)c1	ZINC000450742184	GF	On-Demand	Anodyne	MTNR1A	47	38
COc1ccc(CNC(=O)CCN2CCC3(CCOCC3)[C@H]2C)c(OC)c1	ZINC000450742185	GF	On-Demand	Anodyne	MTNR1A	47	38
COc1cccc(-n2cc(C(=O)N[C@@H](C)CN3CCCCCC3)nn2)c1	ZINC000450742187	FE	On-Demand	Anodyne	DRD4	47	36
COc1cccc(-n2cc(C(=O)N[C@@H](C)CN3CCCCCC3)nn2)c1	ZINC000450742187	FE	On-Demand	Anodyne	ESRRA	23	40
COc1cccc(-n2cc(C(=O)N[C@H](C)CN3CCCCCC3)nn2)c1	ZINC000450742188	FE	On-Demand	Anodyne	DRD4	47	36
COc1cccc(-n2cc(C(=O)N[C@H](C)CN3CCCCCC3)nn2)c1	ZINC000450742188	FE	On-Demand	Anodyne	ESRRA	23	40
CCCN(CC(=O)OC(C)(C)C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450742189	FG	On-Demand	Anodyne	RORC	22	56
COc1ccc(-c2cc3ncn(C[C@@H](C)S(C)(=O)=O)c(=O)c3s2)cc1	ZINC000450742204	GF	On-Demand	Anodyne	MCHR1	33	46
COc1ccc(-c2cc3ncn(C[C@H](C)S(C)(=O)=O)c(=O)c3s2)cc1	ZINC000450742205	GF	On-Demand	Anodyne	MCHR1	33	46
CCO[C@@H]1CCN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450742248	GD	On-Demand	Bother	TAAR1	23	47
CCO[C@H]1CCN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450742249	GD	On-Demand	Bother	TAAR1	23	47
CCO[C@@H]1CCN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450742250	GD	On-Demand	Bother	TAAR1	23	47
CCO[C@H]1CCN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450742251	GD	On-Demand	Bother	TAAR1	23	47
CC(C)N1CCCC[C@@H]1CN1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450742256	DH	On-Demand	Anodyne	CHRNA2	41	43
CC(C)N1CCCC[C@@H]1CN1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450742256	DH	On-Demand	Anodyne	CRTY	0	43
CC(C)N1CCCC[C@H]1CN1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450742257	DH	On-Demand	Anodyne	CHRNA2	41	43
CC(C)N1CCCC[C@H]1CN1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450742257	DH	On-Demand	Anodyne	CRTY	0	43
CC(C)N1CCCC[C@H]1CN1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450742258	DH	On-Demand	Anodyne	CHRNA2	41	43
CC(C)N1CCCC[C@H]1CN1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450742258	DH	On-Demand	Anodyne	CRTY	0	43
CC(C)N1CCCC[C@@H]1CN1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450742259	DH	On-Demand	Anodyne	CHRNA2	41	43
CC(C)N1CCCC[C@@H]1CN1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450742259	DH	On-Demand	Anodyne	CRTY	0	43
C[C@@H]1C[C@@H](c2cccnc2)N(C[C@H]2CCCCC2(F)F)C1	ZINC000450742276	CI	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@@H](c2cccnc2)N(C[C@H]2CCCCC2(F)F)C1	ZINC000450742276	CI	On-Demand	Anodyne	CRTY	0	41
C[C@@H]1C[C@H](c2cccnc2)N(C[C@H]2CCCCC2(F)F)C1	ZINC000450742277	CI	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@H](c2cccnc2)N(C[C@H]2CCCCC2(F)F)C1	ZINC000450742277	CI	On-Demand	Anodyne	CRTY	0	41
C[C@@H]1C[C@@H](c2cccnc2)N(C[C@@H]2CCCCC2(F)F)C1	ZINC000450742278	CI	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@@H](c2cccnc2)N(C[C@@H]2CCCCC2(F)F)C1	ZINC000450742278	CI	On-Demand	Anodyne	CRTY	0	41
C[C@@H]1C[C@H](c2cccnc2)N(C[C@@H]2CCCCC2(F)F)C1	ZINC000450742279	CI	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@H](c2cccnc2)N(C[C@@H]2CCCCC2(F)F)C1	ZINC000450742279	CI	On-Demand	Anodyne	CRTY	0	41
C[C@H](NC(=O)CC1(O)CCC1)C1(c2ccccc2)CCCC1	ZINC000450742286	DG	On-Demand	Anodyne	ACAT	0	41
C[C@@H](NC(=O)CC1(O)CCC1)C1(c2ccccc2)CCCC1	ZINC000450742287	DG	On-Demand	Anodyne	ACAT	0	41
COC(=O)c1csc(CN2CCC[C@@H](C)c3ccccc32)n1	ZINC000450742288	DH	On-Demand	Anodyne	TRPC6	51	36
COC(=O)c1csc(CN2CCC[C@@H](C)c3ccccc32)n1	ZINC000450742288	DH	On-Demand	Anodyne	TRPC3	45	36
COC(=O)c1csc(CN2CCC[C@H](C)c3ccccc32)n1	ZINC000450742289	DH	On-Demand	Anodyne	TRPC3	45	36
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](OCC)[C@H](C)C1	ZINC000450742294	FH	On-Demand	Anodyne	ATP4A	19	50
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](OCC)[C@H](C)C1	ZINC000450742295	FH	On-Demand	Anodyne	ATP4A	19	50
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](OCC)[C@@H](C)C1	ZINC000450742296	FH	On-Demand	Anodyne	ATP4A	19	50
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](OCC)[C@@H](C)C1	ZINC000450742297	FH	On-Demand	Anodyne	ATP4A	19	50
CCO[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450742302	CF	On-Demand	Anodyne	PDE3A	49	41
CCO[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450742302	CF	On-Demand	Anodyne	PDE3B	73	41
CCO[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450742302	CF	On-Demand	Anodyne	SIRT3	56	35
CCO[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450742302	CF	On-Demand	Anodyne	SIRT1	56	35
CCO[C@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450742303	CF	On-Demand	Anodyne	PDE3A	49	41
CCO[C@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450742303	CF	On-Demand	Anodyne	PDE3B	73	41
CCO[C@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450742303	CF	On-Demand	Anodyne	SIRT3	56	35
CCO[C@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450742303	CF	On-Demand	Anodyne	SIRT1	56	35
CCO[C@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450742304	CF	On-Demand	Anodyne	PDE3A	49	41
CCO[C@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450742304	CF	On-Demand	Anodyne	PDE3B	73	41
CCO[C@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450742304	CF	On-Demand	Anodyne	SIRT3	56	35
CCO[C@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450742304	CF	On-Demand	Anodyne	SIRT1	56	35
CCO[C@@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450742305	CF	On-Demand	Anodyne	PDE3A	49	41
CCO[C@@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450742305	CF	On-Demand	Anodyne	PDE3B	73	41
CCO[C@@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450742305	CF	On-Demand	Anodyne	SIRT3	56	35
CCO[C@@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450742305	CF	On-Demand	Anodyne	SIRT1	56	35
C[C@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742312	CF	On-Demand	Anodyne	P2RX3	28	40
C[C@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742312	CF	On-Demand	Anodyne	PLD1	53	45
C[C@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742312	CF	On-Demand	Anodyne	CCKBR	58	33
C[C@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742312	CF	On-Demand	Anodyne	PLD2	26	42
C[C@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742312	CF	On-Demand	Anodyne	CACNA1I	51	37
C[C@@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742313	CF	On-Demand	Anodyne	P2RX3	28	40
C[C@@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742313	CF	On-Demand	Anodyne	PLD1	53	45
C[C@@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742313	CF	On-Demand	Anodyne	CCKBR	58	33
C[C@@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742313	CF	On-Demand	Anodyne	PLD2	26	42
C[C@@H](CN1CCCCCC1)NC(=O)c1cncc(Cl)c1	ZINC000450742313	CF	On-Demand	Anodyne	CACNA1I	51	37
CCC[C@H](O)CN1CCC(Oc2cccc(Br)c2)CC1	ZINC000450742322	EG	On-Demand	Anodyne	HRH1	35	48
CCC[C@H](O)CN1CCC(Oc2cccc(Br)c2)CC1	ZINC000450742322	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
CCC[C@H](O)CN1CCC(Oc2cccc(Br)c2)CC1	ZINC000450742322	EG	On-Demand	Anodyne	CCR3	26	42
CCC[C@@H](O)CN1CCC(Oc2cccc(Br)c2)CC1	ZINC000450742323	EG	On-Demand	Anodyne	HRH1	35	48
CCC[C@@H](O)CN1CCC(Oc2cccc(Br)c2)CC1	ZINC000450742323	EG	On-Demand	Anodyne	VACHT_TETCF	0	45
CCC[C@@H](O)CN1CCC(Oc2cccc(Br)c2)CC1	ZINC000450742323	EG	On-Demand	Anodyne	CCR3	26	42
CC(C)c1ncsc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450742335	DG	On-Demand	Anodyne	PLD1	43	32
CC(C)c1ncsc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450742336	DG	On-Demand	Anodyne	PLD1	43	32
Cc1nccc(N2CCN(C[C@@H]3CCC(F)(F)C3)CC2)n1	ZINC000450742337	CE	On-Demand	Anodyne	SORD	51	38
Cc1nccc(N2CCN(C[C@H]3CCC(F)(F)C3)CC2)n1	ZINC000450742338	CE	On-Demand	Anodyne	SORD	51	38
CC(C)(CC(N)=O)NCCCCc1ccc(Cl)c(Cl)c1	ZINC000450742356	DH	On-Demand	Anodyne	SCNN1A	55	33
CC(C)(CC(N)=O)NCCCCc1ccc(Cl)c(Cl)c1	ZINC000450742356	DH	On-Demand	Anodyne	DNAE	65	34
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450742370	GI	On-Demand	Bother	TAAR1	43	53
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450742371	GI	On-Demand	Bother	TAAR1	43	53
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450742372	GI	On-Demand	Bother	TAAR1	43	53
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450742373	GI	On-Demand	Bother	TAAR1	43	53
CCNC(=O)c1ccc(N2CC[C@H](OCC)[C@@H](C)C2)nn1	ZINC000450742378	CD	On-Demand	Anodyne	SCD	24	43
CCNC(=O)c1ccc(N2CC[C@@H](OCC)[C@H](C)C2)nn1	ZINC000450742379	CD	On-Demand	Anodyne	SCD	24	43
CCNC(=O)c1ccc(N2CC[C@@H](OCC)[C@@H](C)C2)nn1	ZINC000450742380	CD	On-Demand	Anodyne	SCD	24	43
CCNC(=O)c1ccc(N2CC[C@H](OCC)[C@H](C)C2)nn1	ZINC000450742381	CD	On-Demand	Anodyne	SCD	24	43
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450742397	FF	On-Demand	Anodyne	HSD11B1	0	42
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450742397	FF	On-Demand	Anodyne	LIPG	48	37
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450742398	FF	On-Demand	Anodyne	HSD11B1	0	42
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450742398	FF	On-Demand	Anodyne	LIPG	48	37
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450742399	FF	On-Demand	Anodyne	HSD11B1	0	42
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450742399	FF	On-Demand	Anodyne	LIPG	48	37
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450742400	FF	On-Demand	Anodyne	HSD11B1	0	42
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450742400	FF	On-Demand	Anodyne	LIPG	48	37
CCOC(=O)c1ccc(CN2CCN(c3ccnc(C)n3)CC2)nc1	ZINC000450742401	ED	On-Demand	Anodyne	P2RY12	35	42
CCOC(=O)c1ccc(CN2CCN(c3ccnc(C)n3)CC2)nc1	ZINC000450742401	ED	On-Demand	Anodyne	SORD	49	36
C[C@H](CN1CCCCCC1)NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450742402	FG	On-Demand	Anodyne	OPRK1	0	48
C[C@@H](CN1CCCCCC1)NC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450742403	FG	On-Demand	Anodyne	OPRK1	0	48
CC[C@H]1CN(Cc2cn(CC3CC3)nn2)CCN1Cc1ccccc1	ZINC000450742408	EF	On-Demand	Anodyne	SIGMAR1	20	46
CC[C@@H]1CN(Cc2cn(CC3CC3)nn2)CCN1Cc1ccccc1	ZINC000450742409	EF	On-Demand	Anodyne	SIGMAR1	20	46
CC(=O)c1cccc(CN2CCO[C@@H](CCc3ccccc3)C2)c1	ZINC000450742419	DH	On-Demand	Anodyne	DRD4	38	68
CC(=O)c1cccc(CN2CCO[C@@H](CCc3ccccc3)C2)c1	ZINC000450742419	DH	On-Demand	Anodyne	ACHE	24	41
CC(=O)c1cccc(CN2CCO[C@@H](CCc3ccccc3)C2)c1	ZINC000450742419	DH	On-Demand	Anodyne	OPRD1	15	42
CC(=O)c1cccc(CN2CCO[C@@H](CCc3ccccc3)C2)c1	ZINC000450742419	DH	On-Demand	Anodyne	CCR3	23	41
CC(=O)c1cccc(CN2CCO[C@@H](CCc3ccccc3)C2)c1	ZINC000450742419	DH	On-Demand	Anodyne	PROTEASE	0	48
CC(=O)c1cccc(CN2CCO[C@H](CCc3ccccc3)C2)c1	ZINC000450742420	DH	On-Demand	Anodyne	DRD4	38	68
CC(=O)c1cccc(CN2CCO[C@H](CCc3ccccc3)C2)c1	ZINC000450742420	DH	On-Demand	Anodyne	ACHE	24	41
CC(=O)c1cccc(CN2CCO[C@H](CCc3ccccc3)C2)c1	ZINC000450742420	DH	On-Demand	Anodyne	OPRD1	15	42
CC(=O)c1cccc(CN2CCO[C@H](CCc3ccccc3)C2)c1	ZINC000450742420	DH	On-Demand	Anodyne	CCR3	23	41
CC(=O)c1cccc(CN2CCO[C@H](CCc3ccccc3)C2)c1	ZINC000450742420	DH	On-Demand	Anodyne	PROTEASE	0	48
C[C@@H]1Cc2cccc(C(=O)NCCc3ccc(OCC(F)(F)F)nc3)c2O1	ZINC000450742426	GG	On-Demand	Anodyne	SCN9A	0	45
C[C@H]1Cc2cccc(C(=O)NCCc3ccc(OCC(F)(F)F)nc3)c2O1	ZINC000450742427	GG	On-Demand	Anodyne	SCN9A	0	45
CN(CCCC(=O)c1ccc(Br)cc1)C1CC(O)C1	ZINC000450742428	EF	On-Demand	Anodyne	SHC	46	39
O=C(CCCN1CCOCC2(CCC2)C1)c1ccccc1	ZINC000450742429	CG	On-Demand	Anodyne	DRD2	30	42
CCO[C@@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C[C@@H]1C	ZINC000450742430	EF	On-Demand	Anodyne	FAAH	0	42
CCO[C@@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C[C@H]1C	ZINC000450742431	EF	On-Demand	Anodyne	FAAH	0	42
CCO[C@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C[C@@H]1C	ZINC000450742432	EF	On-Demand	Anodyne	FAAH	0	42
CCO[C@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C[C@H]1C	ZINC000450742433	EF	On-Demand	Anodyne	FAAH	0	42
COc1ccc(-c2cc3ncn(C[C@H]4CCCC4(F)F)c(=O)c3s2)cc1	ZINC000450742437	GJ	On-Demand	Anodyne	MCHR1	37	48
COc1ccc(-c2cc3ncn(C[C@@H]4CCCC4(F)F)c(=O)c3s2)cc1	ZINC000450742438	GJ	On-Demand	Anodyne	MCHR1	37	48
C[C@H](CN1CCCCCC1)NC(=O)c1cc2cccnc2s1	ZINC000450742448	DG	On-Demand	Anodyne	P2RX3	33	47
C[C@H](CN1CCCCCC1)NC(=O)c1cc2cccnc2s1	ZINC000450742448	DG	On-Demand	Anodyne	PLD1	44	35
C[C@@H](CN1CCCCCC1)NC(=O)c1cc2cccnc2s1	ZINC000450742449	DG	On-Demand	Anodyne	P2RX3	33	47
C[C@@H](CN1CCCCCC1)NC(=O)c1cc2cccnc2s1	ZINC000450742449	DG	On-Demand	Anodyne	PLD1	44	35
CCO[C@H]1CCN(c2cc(C#N)ccn2)C[C@@H]1C	ZINC000450742466	BE	On-Demand	Mild	MAP3K12	44	32
CCO[C@@H]1CCN(c2cc(C#N)ccn2)C[C@H]1C	ZINC000450742467	BE	On-Demand	Mild	MAP3K12	44	32
CCO[C@@H]1CCN(c2cc(C#N)ccn2)C[C@@H]1C	ZINC000450742468	BE	On-Demand	Mild	MAP3K12	44	32
CCO[C@H]1CCN(c2cc(C#N)ccn2)C[C@H]1C	ZINC000450742469	BE	On-Demand	Mild	MAP3K12	44	32
CCO[C@H]1CCN(c2noc3ccc(Br)cc23)C[C@@H]1C	ZINC000450742475	EH	On-Demand	Anodyne	HRH4	17	40
CCO[C@@H]1CCN(c2noc3ccc(Br)cc23)C[C@@H]1C	ZINC000450742476	EH	On-Demand	Anodyne	HRH4	17	40
CCO[C@H]1CCN(c2noc3ccc(Br)cc23)C[C@H]1C	ZINC000450742477	EH	On-Demand	Anodyne	HRH4	17	40
CCO[C@@H]1CCN(c2noc3ccc(Br)cc23)C[C@H]1C	ZINC000450742478	EH	On-Demand	Anodyne	HRH4	17	40
COc1cc(CN2CCN(c3ccnc(C)n3)CC2)ccc1Cl	ZINC000450742521	EF	On-Demand	Anodyne	DRD1	22	45
COc1cc(CN2CCN(c3ccnc(C)n3)CC2)ccc1Cl	ZINC000450742521	EF	On-Demand	Anodyne	DRD4	33	42
COc1cc(CN2CCN(c3ccnc(C)n3)CC2)ccc1Cl	ZINC000450742521	EF	On-Demand	Anodyne	DRD3	27	41
COc1cc(CN2CCN(c3ccnc(C)n3)CC2)ccc1Cl	ZINC000450742521	EF	On-Demand	Anodyne	SORD	51	39
CC(F)(F)c1ccc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)cn1	ZINC000450742534	GH	On-Demand	Anodyne	SCN9A	22	52
CC(F)(F)c1ccc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)cn1	ZINC000450742534	GH	On-Demand	Anodyne	EPHX2	0	56
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@H]1C	ZINC000450742564	CE	On-Demand	Anodyne	GPR119	23	41
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@H]1C	ZINC000450742565	CE	On-Demand	Anodyne	GPR119	23	41
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@@H]1C	ZINC000450742566	CE	On-Demand	Anodyne	GPR119	23	41
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@@H]1C	ZINC000450742567	CE	On-Demand	Anodyne	GPR119	23	41
C[C@H](CN1CCCCCC1)NC(=O)c1ccsn1	ZINC000450742604	CE	On-Demand	Anodyne	PLD1	46	35
C[C@@H](CN1CCCCCC1)NC(=O)c1ccsn1	ZINC000450742605	CE	On-Demand	Anodyne	PLD1	46	35
COC(=O)c1csc(CN2CCN(c3ccnc(C)n3)CC2)n1	ZINC000450742621	ED	On-Demand	Anodyne	SORD	42	37
COC(=O)c1ccc(CC(=O)N[C@@H](C)CN2CCCCCC2)cc1	ZINC000450742632	EE	On-Demand	Anodyne	OPRK1	22	48
COC(=O)c1ccc(CC(=O)N[C@H](C)CN2CCCCCC2)cc1	ZINC000450742633	EE	On-Demand	Anodyne	OPRK1	22	48
CCO[C@@H]1C[C@H](NC(=O)[C@]2(OC(C)C)CCOC2)[C@@H]1Oc1ccccc1	ZINC000450742643	FE	On-Demand	Anodyne	TIMP3	60	32
CCO[C@@H]1C[C@H](NC(=O)[C@@]2(OC(C)C)CCOC2)[C@@H]1Oc1ccccc1	ZINC000450742644	FE	On-Demand	Anodyne	TIMP3	60	32
CCO[C@@H]1C[C@H](NC(=O)[C@@]2(OC(C)C)CCOC2)[C@H]1Oc1ccccc1	ZINC000450742645	FE	On-Demand	Anodyne	TIMP3	60	32
CCO[C@@H]1C[C@H](NC(=O)[C@]2(OC(C)C)CCOC2)[C@H]1Oc1ccccc1	ZINC000450742646	FE	On-Demand	Anodyne	TIMP3	60	32
Cc1[nH]c(C#N)cc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450742659	CE	On-Demand	Mild	PLD1	46	37
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450742660	CE	On-Demand	Mild	PLD1	46	37
CCO[C@@H]1CCN(c2ncnc3cccc(I)c23)C[C@H]1C	ZINC000450742665	GG	On-Demand	Anodyne	PDE3A	46	37
CCO[C@@H]1CCN(c2ncnc3cccc(I)c23)C[C@H]1C	ZINC000450742665	GG	On-Demand	Anodyne	PDE3B	69	37
CCO[C@H]1CCN(c2ncnc3cccc(I)c23)C[C@@H]1C	ZINC000450742666	GG	On-Demand	Anodyne	PDE3A	46	37
CCO[C@H]1CCN(c2ncnc3cccc(I)c23)C[C@@H]1C	ZINC000450742666	GG	On-Demand	Anodyne	PDE3B	69	37
CCO[C@H]1CCN(c2ncnc3cccc(I)c23)C[C@H]1C	ZINC000450742667	GG	On-Demand	Anodyne	PDE3A	46	37
CCO[C@H]1CCN(c2ncnc3cccc(I)c23)C[C@H]1C	ZINC000450742667	GG	On-Demand	Anodyne	PDE3B	69	37
CCO[C@@H]1CCN(c2ncnc3cccc(I)c23)C[C@@H]1C	ZINC000450742668	GG	On-Demand	Anodyne	PDE3A	46	37
CCO[C@@H]1CCN(c2ncnc3cccc(I)c23)C[C@@H]1C	ZINC000450742668	GG	On-Demand	Anodyne	PDE3B	69	37
CC[C@H]1CN(Cc2nnc(C(C)C)s2)CCN1Cc1ccccc1	ZINC000450742679	EH	On-Demand	Anodyne	SIGMAR1	15	50
CC[C@@H]1CN(Cc2nnc(C(C)C)s2)CCN1Cc1ccccc1	ZINC000450742680	EH	On-Demand	Anodyne	SIGMAR1	15	50
CCO[C@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@@H]1C	ZINC000450742697	FH	On-Demand	Anodyne	HCRTR1	52	35
CCO[C@@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@@H]1C	ZINC000450742698	FH	On-Demand	Anodyne	HCRTR1	52	35
CCO[C@@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@H]1C	ZINC000450742699	FH	On-Demand	Anodyne	HCRTR1	52	35
CCO[C@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@H]1C	ZINC000450742700	FH	On-Demand	Anodyne	HCRTR1	52	35
C[C@@H]1N(CCc2ccc(Cl)cc2)CCC12CCOCC2	ZINC000450742701	CH	On-Demand	Anodyne	HRH3	17	41
C[C@H]1N(CCc2ccc(Cl)cc2)CCC12CCOCC2	ZINC000450742702	CH	On-Demand	Anodyne	HRH3	17	41
CCO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1C	ZINC000450742709	EG	On-Demand	Anodyne	PDE3A	45	35
CCO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1C	ZINC000450742709	EG	On-Demand	Anodyne	PDE3B	67	36
CCO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1C	ZINC000450742710	EG	On-Demand	Anodyne	PDE3A	45	35
CCO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1C	ZINC000450742710	EG	On-Demand	Anodyne	PDE3B	67	36
CCO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@@H]1C	ZINC000450742711	EG	On-Demand	Anodyne	PDE3A	45	35
CCO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@@H]1C	ZINC000450742711	EG	On-Demand	Anodyne	PDE3B	67	36
CCO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@@H]1C	ZINC000450742712	EG	On-Demand	Anodyne	PDE3A	45	35
CCO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@@H]1C	ZINC000450742712	EG	On-Demand	Anodyne	PDE3B	67	36
CC(C)c1ncsc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450742715	FH	On-Demand	Anodyne	SCN9A	0	42
CCS(=O)(=O)c1ccc(CN2CC[C@H](C)C(C)(C)C2)cc1	ZINC000450742727	DG	On-Demand	Anodyne	LOC100281352	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](C)C(C)(C)C2)cc1	ZINC000450742727	DG	On-Demand	Anodyne	ZM.86993	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C)C(C)(C)C2)cc1	ZINC000450742728	DG	On-Demand	Anodyne	LOC100281352	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C)C(C)(C)C2)cc1	ZINC000450742728	DG	On-Demand	Anodyne	ZM.86993	0	40
CCO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450742737	FJ	On-Demand	Anodyne	ADRB2	21	53
CCO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450742737	FJ	On-Demand	Anodyne	ADRB3	20	56
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450742738	FJ	On-Demand	Anodyne	ADRB2	21	53
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450742738	FJ	On-Demand	Anodyne	ADRB3	20	56
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450742739	FJ	On-Demand	Anodyne	ADRB2	21	53
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450742739	FJ	On-Demand	Anodyne	ADRB3	20	56
CCO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450742740	FJ	On-Demand	Anodyne	ADRB2	21	53
CCO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450742740	FJ	On-Demand	Anodyne	ADRB3	20	56
CSc1cccc(C(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450742745	DG	On-Demand	Anodyne	P2RX3	30	49
CSc1cccc(C(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450742745	DG	On-Demand	Anodyne	PLD1	53	44
CSc1cccc(C(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450742745	DG	On-Demand	Anodyne	PLD2	28	44
CSc1cccc(C(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450742746	DG	On-Demand	Anodyne	P2RX3	30	49
CSc1cccc(C(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450742746	DG	On-Demand	Anodyne	PLD1	53	44
CSc1cccc(C(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450742746	DG	On-Demand	Anodyne	PLD2	28	44
CCO[C@@H]1CCN(c2nc(-c3ccccc3)ns2)C[C@@H]1C	ZINC000450742751	DG	On-Demand	Anodyne	FAAH	16	43
CCO[C@H]1CCN(c2nc(-c3ccccc3)ns2)C[C@@H]1C	ZINC000450742752	DG	On-Demand	Anodyne	FAAH	16	43
CCO[C@H]1CCN(c2nc(-c3ccccc3)ns2)C[C@H]1C	ZINC000450742753	DG	On-Demand	Anodyne	FAAH	16	43
CCO[C@@H]1CCN(c2nc(-c3ccccc3)ns2)C[C@H]1C	ZINC000450742754	DG	On-Demand	Anodyne	FAAH	16	43
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	HTR1A	57	44
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	DRD2	42	41
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	DRD4	45	36
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	HTR2A	22	41
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	ADRA1A	29	40
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	DRD3	57	40
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	PDGFRB	55	42
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	HTR7	59	47
COc1ccc(CNC(=O)CCN2CCN(c3ccnc(C)n3)CC2)c(OC)c1	ZINC000450742758	GD	On-Demand	Anodyne	CSF1R	19	41
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450742774	FG	On-Demand	Anodyne	HSD11B1	16	40
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450742774	FG	On-Demand	Anodyne	LIPG	48	37
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450742775	FG	On-Demand	Anodyne	HSD11B1	16	40
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450742775	FG	On-Demand	Anodyne	LIPG	48	37
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450742776	FG	On-Demand	Anodyne	HSD11B1	16	40
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450742776	FG	On-Demand	Anodyne	LIPG	48	37
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450742777	FG	On-Demand	Anodyne	HSD11B1	16	40
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450742777	FG	On-Demand	Anodyne	LIPG	48	37
CCOc1cc(N2CC[C@H](OCC)[C@H](C)C2)ncn1	ZINC000450742794	CE	On-Demand	Anodyne	PDE3B	42	36
CCOc1cc(N2CC[C@@H](OCC)[C@@H](C)C2)ncn1	ZINC000450742795	CE	On-Demand	Anodyne	PDE3B	42	36
CCOc1cc(N2CC[C@H](OCC)[C@@H](C)C2)ncn1	ZINC000450742796	CE	On-Demand	Anodyne	PDE3B	42	36
CCOc1cc(N2CC[C@@H](OCC)[C@H](C)C2)ncn1	ZINC000450742797	CE	On-Demand	Anodyne	PDE3B	42	36
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C[C@@H]1C	ZINC000450742802	CD	On-Demand	Anodyne	GPR119	26	43
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C[C@H]1C	ZINC000450742803	CD	On-Demand	Anodyne	GPR119	26	43
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C[C@@H]1C	ZINC000450742804	CD	On-Demand	Anodyne	GPR119	26	43
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C[C@H]1C	ZINC000450742805	CD	On-Demand	Anodyne	GPR119	26	43
CCN1CCN(Cc2c(C)cccc2Cl)CC1=O	ZINC000450742810	CE	On-Demand	Anodyne	P2RX7	18	51
CCO[C@H]1CCN(c2ncc(C#N)cc2Cl)C[C@@H]1C	ZINC000450742838	CF	On-Demand	Mild	CXCR3	18	43
CCO[C@@H]1CCN(c2ncc(C#N)cc2Cl)C[C@@H]1C	ZINC000450742839	CF	On-Demand	Mild	CXCR3	18	43
CCO[C@H]1CCN(c2ncc(C#N)cc2Cl)C[C@H]1C	ZINC000450742840	CF	On-Demand	Mild	CXCR3	18	43
CCO[C@@H]1CCN(c2ncc(C#N)cc2Cl)C[C@H]1C	ZINC000450742841	CF	On-Demand	Mild	CXCR3	18	43
COC(=O)c1cn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)nn1	ZINC000450742846	GE	On-Demand	Anodyne	DRD4	26	42
COC(=O)c1cn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)nn1	ZINC000450742846	GE	On-Demand	Anodyne	DRD3	0	45
CC(=O)c1ccc(CN2CCC[C@H](S(=O)(=O)N3CCc4ccccc43)C2)cc1	ZINC000450742857	GG	On-Demand	Anodyne	DRD4	36	41
CC(=O)c1ccc(CN2CCC[C@H](S(=O)(=O)N3CCc4ccccc43)C2)cc1	ZINC000450742857	GG	On-Demand	Anodyne	SIGMAR1	16	40
CC(=O)c1ccc(CN2CCC[C@H](S(=O)(=O)N3CCc4ccccc43)C2)cc1	ZINC000450742857	GG	On-Demand	Anodyne	NOD2	42	36
CC(=O)c1ccc(CN2CCC[C@@H](S(=O)(=O)N3CCc4ccccc43)C2)cc1	ZINC000450742858	GG	On-Demand	Anodyne	DRD4	36	41
CC(=O)c1ccc(CN2CCC[C@@H](S(=O)(=O)N3CCc4ccccc43)C2)cc1	ZINC000450742858	GG	On-Demand	Anodyne	SIGMAR1	16	40
CC(=O)c1ccc(CN2CCC[C@@H](S(=O)(=O)N3CCc4ccccc43)C2)cc1	ZINC000450742858	GG	On-Demand	Anodyne	NOD2	42	36
CCO[C@@H]1CCN(c2ccc(C(N)=O)cn2)C[C@@H]1C	ZINC000450742874	CD	On-Demand	Anodyne	ENPP2	18	42
CCO[C@H]1CCN(c2ccc(C(N)=O)cn2)C[C@@H]1C	ZINC000450742875	CD	On-Demand	Anodyne	ENPP2	18	42
CCO[C@H]1CCN(c2ccc(C(N)=O)cn2)C[C@H]1C	ZINC000450742876	CD	On-Demand	Anodyne	ENPP2	18	42
CCO[C@@H]1CCN(c2ccc(C(N)=O)cn2)C[C@H]1C	ZINC000450742877	CD	On-Demand	Anodyne	ENPP2	18	42
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742892	GG	On-Demand	Anodyne	PDE3A	55	45
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742892	GG	On-Demand	Anodyne	PDE3B	82	45
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742892	GG	On-Demand	Anodyne	SIRT3	60	32
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742892	GG	On-Demand	Anodyne	SIRT2	57	32
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742892	GG	On-Demand	Anodyne	SIRT1	51	32
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742892	GG	On-Demand	Anodyne	HTT	0	40
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742893	GG	On-Demand	Anodyne	PDE3A	55	45
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742893	GG	On-Demand	Anodyne	PDE3B	82	45
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742893	GG	On-Demand	Anodyne	SIRT3	60	32
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742893	GG	On-Demand	Anodyne	SIRT2	57	32
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742893	GG	On-Demand	Anodyne	SIRT1	51	32
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450742893	GG	On-Demand	Anodyne	HTT	0	40
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742894	GG	On-Demand	Anodyne	PDE3A	55	45
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742894	GG	On-Demand	Anodyne	PDE3B	82	45
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742894	GG	On-Demand	Anodyne	SIRT3	60	32
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742894	GG	On-Demand	Anodyne	SIRT2	57	32
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742894	GG	On-Demand	Anodyne	SIRT1	51	32
CCO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742894	GG	On-Demand	Anodyne	HTT	0	40
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742895	GG	On-Demand	Anodyne	PDE3A	55	45
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742895	GG	On-Demand	Anodyne	PDE3B	82	45
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742895	GG	On-Demand	Anodyne	SIRT3	60	32
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742895	GG	On-Demand	Anodyne	SIRT2	57	32
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742895	GG	On-Demand	Anodyne	SIRT1	51	32
CCO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450742895	GG	On-Demand	Anodyne	HTT	0	40
COc1cc(CN2CCN(c3ncc(F)cn3)CC2)ccc1Cl	ZINC000450742896	EF	On-Demand	Anodyne	DRD1	27	49
COc1cc(CN2CCN(c3ncc(F)cn3)CC2)ccc1Cl	ZINC000450742896	EF	On-Demand	Anodyne	DRD4	40	47
COc1cc(CN2CCN(c3ncc(F)cn3)CC2)ccc1Cl	ZINC000450742896	EF	On-Demand	Anodyne	DRD3	25	47
COc1cc(CN2CCN(c3ncc(F)cn3)CC2)ccc1Cl	ZINC000450742896	EF	On-Demand	Anodyne	SSTR5	57	38
Cc1nccc(N2CCN(CCC3=CCCCC3)CC2)n1	ZINC000450742897	CF	On-Demand	Anodyne	SORD	53	41
CCc1cccc(C(=O)N[C@@H](C)CN2CCCCCC2)n1	ZINC000450742899	CF	On-Demand	Anodyne	P2RX3	31	40
CCc1cccc(C(=O)N[C@@H](C)CN2CCCCCC2)n1	ZINC000450742899	CF	On-Demand	Anodyne	PLD1	46	36
CCc1cccc(C(=O)N[C@H](C)CN2CCCCCC2)n1	ZINC000450742900	CF	On-Demand	Anodyne	P2RX3	31	40
CCc1cccc(C(=O)N[C@H](C)CN2CCCCCC2)n1	ZINC000450742900	CF	On-Demand	Anodyne	PLD1	46	36
CCSc1cccnc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450742910	DG	On-Demand	Anodyne	P2RX3	32	42
CCSc1cccnc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450742911	DG	On-Demand	Anodyne	P2RX3	32	42
CCN1CCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450742936	CE	On-Demand	Anodyne	DRD4	22	40
CCN1CCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450742936	CE	On-Demand	Anodyne	SSTR5	40	35
CCN1CCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450742936	CE	On-Demand	Anodyne	NOX1	40	34
CCN1CCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450742936	CE	On-Demand	Anodyne	NOX5	40	34
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@H]1Oc1ccccc1	ZINC000450742949	FE	On-Demand	Anodyne	TIMP3	67	32
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@H]1Oc1ccccc1	ZINC000450742949	FE	On-Demand	Anodyne	GAG-PRO	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@H]1Oc1ccccc1	ZINC000450742950	FE	On-Demand	Anodyne	TIMP3	67	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@H]1Oc1ccccc1	ZINC000450742950	FE	On-Demand	Anodyne	GAG-PRO	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@@H]1Oc1ccccc1	ZINC000450742951	FE	On-Demand	Anodyne	TIMP3	67	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@@H]1Oc1ccccc1	ZINC000450742951	FE	On-Demand	Anodyne	GAG-PRO	41	32
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@@H]1Oc1ccccc1	ZINC000450742952	FE	On-Demand	Anodyne	TIMP3	67	32
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)[C@@H]1Oc1ccccc1	ZINC000450742952	FE	On-Demand	Anodyne	GAG-PRO	41	32
CC(=O)CCCCCn1c(S(C)(=O)=O)nc2ccccc21	ZINC000450742987	DF	On-Demand	Anodyne	PTGDR2	15	41
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2cccc(O)c2)cc1	ZINC000450743014	FE	On-Demand	Anodyne	RORC	45	36
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2cccc(O)c2)cc1	ZINC000450743015	FE	On-Demand	Anodyne	RORC	45	36
CCO[C@@H]1C[C@@H](NC(=O)Cc2ccc(O)c(OC)c2)[C@@H]1Oc1ccccc1	ZINC000450743018	FF	On-Demand	Anodyne	TRPV1	26	45
CCO[C@@H]1C[C@H](NC(=O)Cc2ccc(O)c(OC)c2)[C@H]1Oc1ccccc1	ZINC000450743019	FF	On-Demand	Anodyne	TRPV1	26	45
CCO[C@@H]1C[C@@H](NC(=O)Cc2ccc(O)c(OC)c2)[C@H]1Oc1ccccc1	ZINC000450743020	FF	On-Demand	Anodyne	TRPV1	26	45
CCO[C@@H]1C[C@H](NC(=O)Cc2ccc(O)c(OC)c2)[C@@H]1Oc1ccccc1	ZINC000450743021	FF	On-Demand	Anodyne	TRPV1	26	45
C[C@H](CN1CCCCCC1)NC(=O)c1ccn(CCc2ccccc2)n1	ZINC000450743030	FG	On-Demand	Anodyne	BIRC2	52	46
C[C@@H](CN1CCCCCC1)NC(=O)c1ccn(CCc2ccccc2)n1	ZINC000450743031	FG	On-Demand	Anodyne	BIRC2	52	46
CCO[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450743032	EJ	On-Demand	Anodyne	LIPC	0	40
CCO[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450743032	EJ	On-Demand	Anodyne	LIPG	57	40
CCO[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450743033	EJ	On-Demand	Anodyne	LIPC	0	40
CCO[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450743033	EJ	On-Demand	Anodyne	LIPG	57	40
CCO[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450743034	EJ	On-Demand	Anodyne	LIPC	0	40
CCO[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450743034	EJ	On-Demand	Anodyne	LIPG	57	40
CCO[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450743035	EJ	On-Demand	Anodyne	LIPC	0	40
CCO[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450743035	EJ	On-Demand	Anodyne	LIPG	57	40
NC(=O)c1ccc(-c2nnn(CC3CC(F)(F)C3)n2)cc1	ZINC000450743036	CD	On-Demand	Anodyne	SCARB1	40	35
COc1ccc(CNC(=O)CCN2CCCC[C@@]2(C)C(N)=O)c(OC)c1	ZINC000450743037	FD	On-Demand	Anodyne	MTNR1A	43	42
COc1ccc(CNC(=O)CCN2CCCC[C@@]2(C)C(N)=O)c(OC)c1	ZINC000450743037	FD	On-Demand	Anodyne	MTNR1B	33	42
COc1ccc(CNC(=O)CCN2CCCC[C@@]2(C)C(N)=O)c(OC)c1	ZINC000450743037	FD	On-Demand	Anodyne	EBP	21	40
COc1ccc(CNC(=O)CCN2CCCC[C@]2(C)C(N)=O)c(OC)c1	ZINC000450743038	FD	On-Demand	Anodyne	MTNR1A	43	42
COc1ccc(CNC(=O)CCN2CCCC[C@]2(C)C(N)=O)c(OC)c1	ZINC000450743038	FD	On-Demand	Anodyne	MTNR1B	33	42
COc1ccc(CNC(=O)CCN2CCCC[C@]2(C)C(N)=O)c(OC)c1	ZINC000450743038	FD	On-Demand	Anodyne	EBP	21	40
CCO[C@H]1CCN(c2ccnc(N(C)C)n2)C[C@H]1C	ZINC000450743039	CD	On-Demand	Anodyne	HRH4	15	42
CCO[C@@H]1CCN(c2ccnc(N(C)C)n2)C[C@@H]1C	ZINC000450743040	CD	On-Demand	Anodyne	HRH4	15	42
CCO[C@H]1CCN(c2ccnc(N(C)C)n2)C[C@@H]1C	ZINC000450743041	CD	On-Demand	Anodyne	HRH4	15	42
CCO[C@@H]1CCN(c2ccnc(N(C)C)n2)C[C@H]1C	ZINC000450743042	CD	On-Demand	Anodyne	HRH4	15	42
CCO[C@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@@H]1C	ZINC000450743043	FH	On-Demand	Anodyne	AVPR2	40	38
CCO[C@@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@@H]1C	ZINC000450743044	FH	On-Demand	Anodyne	AVPR2	40	38
CCO[C@@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@H]1C	ZINC000450743045	FH	On-Demand	Anodyne	AVPR2	40	38
CCO[C@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@H]1C	ZINC000450743046	FH	On-Demand	Anodyne	AVPR2	40	38
CCO[C@@H]1CCN(c2ccnc(C(C)C)n2)C[C@H]1C	ZINC000450743088	CF	On-Demand	Anodyne	HRH4	0	59
CCO[C@@H]1CCN(c2ccnc(C(C)C)n2)C[C@H]1C	ZINC000450743088	CF	On-Demand	Anodyne	SORD	65	39
CCO[C@H]1CCN(c2ccnc(C(C)C)n2)C[C@H]1C	ZINC000450743089	CF	On-Demand	Anodyne	HRH4	0	59
CCO[C@H]1CCN(c2ccnc(C(C)C)n2)C[C@H]1C	ZINC000450743089	CF	On-Demand	Anodyne	SORD	65	39
CCO[C@@H]1CCN(c2ccnc(C(C)C)n2)C[C@@H]1C	ZINC000450743090	CF	On-Demand	Anodyne	HRH4	0	59
CCO[C@@H]1CCN(c2ccnc(C(C)C)n2)C[C@@H]1C	ZINC000450743090	CF	On-Demand	Anodyne	SORD	65	39
CCO[C@H]1CCN(c2ccnc(C(C)C)n2)C[C@@H]1C	ZINC000450743091	CF	On-Demand	Anodyne	HRH4	0	59
CCO[C@H]1CCN(c2ccnc(C(C)C)n2)C[C@@H]1C	ZINC000450743091	CF	On-Demand	Anodyne	SORD	65	39
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450743098	EF	On-Demand	Anodyne	MMP13	0	46
C[C@H](CN1CCCCCC1)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450743099	EF	On-Demand	Anodyne	MMP13	0	46
CC[C@@H]1C[C@H]1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450743100	DF	On-Demand	Anodyne	SCN9A	0	41
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)[C@@H](O)C3CCC3)no2)cn1	ZINC000450743101	FE	On-Demand	Anodyne	CPT1A	41	43
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)[C@@H](O)C3CCC3)no2)cn1	ZINC000450743102	FE	On-Demand	Anodyne	CPT1A	41	43
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)[C@H](O)C3CCC3)no2)cn1	ZINC000450743103	FE	On-Demand	Anodyne	CPT1A	41	43
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)[C@H](O)C3CCC3)no2)cn1	ZINC000450743104	FE	On-Demand	Anodyne	CPT1A	41	43
COC(=O)c1cccc(CN2CCn3c(O)nnc3C2)c1Cl	ZINC000450743114	DD	On-Demand	Anodyne	P2RX7	21	40
CCO[C@H]1CCN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@H]1C	ZINC000450743122	DH	On-Demand	Mild	AR	64	47
CCO[C@@H]1CCN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@H]1C	ZINC000450743123	DH	On-Demand	Mild	AR	64	47
CCO[C@H]1CCN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@@H]1C	ZINC000450743124	DH	On-Demand	Mild	AR	64	47
CCO[C@@H]1CCN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@@H]1C	ZINC000450743125	DH	On-Demand	Mild	AR	64	47
CCO[C@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@H]1C	ZINC000450743126	FH	On-Demand	Anodyne	P2RY12	30	42
CCO[C@@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@H]1C	ZINC000450743127	FH	On-Demand	Anodyne	P2RY12	30	42
CCO[C@@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@@H]1C	ZINC000450743128	FH	On-Demand	Anodyne	P2RY12	30	42
CCO[C@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@@H]1C	ZINC000450743129	FH	On-Demand	Anodyne	P2RY12	30	42
CCO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743145	DI	On-Demand	Anodyne	HRP1_PLAFA	110	38
CCO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743145	DI	On-Demand	Anodyne	HNMT	51	35
CCO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743146	DI	On-Demand	Anodyne	HRP1_PLAFA	110	38
CCO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743146	DI	On-Demand	Anodyne	HNMT	51	35
CCO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743147	DI	On-Demand	Anodyne	HRP1_PLAFA	110	38
CCO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743147	DI	On-Demand	Anodyne	HNMT	51	35
CCO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743148	DI	On-Demand	Anodyne	HRP1_PLAFA	110	38
CCO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743148	DI	On-Demand	Anodyne	HNMT	51	35
CCO[C@@H]1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C[C@@H]1C	ZINC000450743149	GJ	On-Demand	Anodyne	PDE3B	52	36
CCO[C@@H]1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C[C@@H]1C	ZINC000450743149	GJ	On-Demand	Anodyne	SMO	47	49
CCO[C@H]1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C[C@H]1C	ZINC000450743150	GJ	On-Demand	Anodyne	PDE3B	52	36
CCO[C@H]1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C[C@H]1C	ZINC000450743150	GJ	On-Demand	Anodyne	SMO	47	49
CCO[C@@H]1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C[C@H]1C	ZINC000450743151	GJ	On-Demand	Anodyne	PDE3B	52	36
CCO[C@@H]1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C[C@H]1C	ZINC000450743151	GJ	On-Demand	Anodyne	SMO	47	49
CCO[C@H]1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C[C@@H]1C	ZINC000450743152	GJ	On-Demand	Anodyne	PDE3B	52	36
CCO[C@H]1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C[C@@H]1C	ZINC000450743152	GJ	On-Demand	Anodyne	SMO	47	49
CN(CCCC(=O)c1ccc(Br)cc1)CC1(O)CCC1	ZINC000450743174	EG	On-Demand	Anodyne	HDAC8	18	43
C[C@H](CN1CCCCCC1)NC(=O)c1cnc(C2CC2)nc1	ZINC000450743183	DE	On-Demand	Anodyne	P2RX3	29	40
C[C@H](CN1CCCCCC1)NC(=O)c1cnc(C2CC2)nc1	ZINC000450743183	DE	On-Demand	Anodyne	PLD1	48	38
C[C@@H](CN1CCCCCC1)NC(=O)c1cnc(C2CC2)nc1	ZINC000450743184	DE	On-Demand	Anodyne	P2RX3	29	40
C[C@@H](CN1CCCCCC1)NC(=O)c1cnc(C2CC2)nc1	ZINC000450743184	DE	On-Demand	Anodyne	PLD1	48	38
CCO[C@@H]1C[C@H](NC(=O)C2(CF)CCOCC2)[C@@H]1Oc1ccccc1	ZINC000450743196	FE	On-Demand	Anodyne	TIMP3	70	33
CCO[C@@H]1C[C@@H](NC(=O)C2(CF)CCOCC2)[C@H]1Oc1ccccc1	ZINC000450743197	FE	On-Demand	Anodyne	TIMP3	70	33
CCO[C@@H]1C[C@H](NC(=O)C2(CF)CCOCC2)[C@H]1Oc1ccccc1	ZINC000450743198	FE	On-Demand	Anodyne	TIMP3	70	33
CCO[C@@H]1C[C@@H](NC(=O)C2(CF)CCOCC2)[C@@H]1Oc1ccccc1	ZINC000450743199	FE	On-Demand	Anodyne	TIMP3	70	33
CCO[C@@H]1C[C@H](NC(=O)C2(C(=O)C3CC3)CC2)[C@@H]1Oc1ccccc1	ZINC000450743213	EE	On-Demand	Anodyne	TIMP3	52	34
CCO[C@@H]1C[C@@H](NC(=O)C2(C(=O)C3CC3)CC2)[C@H]1Oc1ccccc1	ZINC000450743214	EE	On-Demand	Anodyne	TIMP3	52	34
CCO[C@@H]1C[C@H](NC(=O)C2(C(=O)C3CC3)CC2)[C@H]1Oc1ccccc1	ZINC000450743215	EE	On-Demand	Anodyne	TIMP3	52	34
CCO[C@@H]1C[C@@H](NC(=O)C2(C(=O)C3CC3)CC2)[C@@H]1Oc1ccccc1	ZINC000450743216	EE	On-Demand	Anodyne	TIMP3	52	34
CCSc1cccnc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450743234	GH	On-Demand	Anodyne	SCN9A	0	40
CCO[C@@H]1CCN(c2ncnc3cccc(C)c23)C[C@@H]1C	ZINC000450743250	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@@H]1CCN(c2ncnc3cccc(C)c23)C[C@@H]1C	ZINC000450743250	CG	On-Demand	Anodyne	PDE3B	70	38
CCO[C@H]1CCN(c2ncnc3cccc(C)c23)C[C@H]1C	ZINC000450743251	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2ncnc3cccc(C)c23)C[C@H]1C	ZINC000450743251	CG	On-Demand	Anodyne	PDE3B	70	38
CCO[C@@H]1CCN(c2ncnc3cccc(C)c23)C[C@H]1C	ZINC000450743252	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@@H]1CCN(c2ncnc3cccc(C)c23)C[C@H]1C	ZINC000450743252	CG	On-Demand	Anodyne	PDE3B	70	38
CCO[C@H]1CCN(c2ncnc3cccc(C)c23)C[C@@H]1C	ZINC000450743253	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2ncnc3cccc(C)c23)C[C@@H]1C	ZINC000450743253	CG	On-Demand	Anodyne	PDE3B	70	38
COc1ccc(CNC(=O)CCN[C@H](C)c2nnc(C)s2)c(OC)c1	ZINC000450743273	FE	On-Demand	Anodyne	MTNR1A	48	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2nnc(C)s2)c(OC)c1	ZINC000450743274	FE	On-Demand	Anodyne	MTNR1A	48	38
CCO[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@H]1C	ZINC000450743288	CG	On-Demand	Anodyne	PDE3A	27	40
CCO[C@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1C	ZINC000450743289	CG	On-Demand	Anodyne	PDE3A	27	40
CCO[C@H]1CCN(c2ncnc3cccc(F)c23)C[C@H]1C	ZINC000450743290	CG	On-Demand	Anodyne	PDE3A	27	40
CCO[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1C	ZINC000450743291	CG	On-Demand	Anodyne	PDE3A	27	40
C[C@@H](CN1CCCCCC1)NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450743302	GF	On-Demand	Anodyne	P2RX3	30	46
C[C@@H](CN1CCCCCC1)NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450743302	GF	On-Demand	Anodyne	PLD1	46	41
C[C@@H](CN1CCCCCC1)NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450743302	GF	On-Demand	Anodyne	PLD2	25	42
C[C@H](CN1CCCCCC1)NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450743303	GF	On-Demand	Anodyne	P2RX3	30	46
C[C@H](CN1CCCCCC1)NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450743303	GF	On-Demand	Anodyne	PLD1	46	41
C[C@H](CN1CCCCCC1)NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450743303	GF	On-Demand	Anodyne	PLD2	25	42
CC[C@@H]1CN(C[C@H](C)S(C)(=O)=O)CCN1Cc1ccccc1	ZINC000450743305	DE	On-Demand	Anodyne	SIGMAR1	18	46
CC[C@@H]1CN(C[C@@H](C)S(C)(=O)=O)CCN1Cc1ccccc1	ZINC000450743306	DE	On-Demand	Anodyne	SIGMAR1	18	46
CC[C@H]1CN(C[C@H](C)S(C)(=O)=O)CCN1Cc1ccccc1	ZINC000450743307	DE	On-Demand	Anodyne	SIGMAR1	18	46
CC[C@H]1CN(C[C@@H](C)S(C)(=O)=O)CCN1Cc1ccccc1	ZINC000450743308	DE	On-Demand	Anodyne	SIGMAR1	18	46
C[C@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743345	EF	On-Demand	Anodyne	SLC6A1	85	35
C[C@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743345	EF	On-Demand	Anodyne	OPRK1	0	40
C[C@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743345	EF	On-Demand	Anodyne	HRH3	0	42
C[C@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743345	EF	On-Demand	Anodyne	PLD1	45	36
C[C@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743345	EF	On-Demand	Anodyne	BIRC2	45	40
C[C@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743346	EF	On-Demand	Anodyne	SLC6A1	85	35
C[C@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743346	EF	On-Demand	Anodyne	OPRK1	0	40
C[C@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743346	EF	On-Demand	Anodyne	HRH3	0	42
C[C@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743346	EF	On-Demand	Anodyne	PLD1	45	36
C[C@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743346	EF	On-Demand	Anodyne	BIRC2	45	40
C[C@@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743347	EF	On-Demand	Anodyne	SLC6A1	85	35
C[C@@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743347	EF	On-Demand	Anodyne	OPRK1	0	40
C[C@@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743347	EF	On-Demand	Anodyne	HRH3	0	42
C[C@@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743347	EF	On-Demand	Anodyne	PLD1	45	36
C[C@@H](CN1CCCCCC1)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450743347	EF	On-Demand	Anodyne	BIRC2	45	40
C[C@@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743348	EF	On-Demand	Anodyne	SLC6A1	85	35
C[C@@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743348	EF	On-Demand	Anodyne	OPRK1	0	40
C[C@@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743348	EF	On-Demand	Anodyne	HRH3	0	42
C[C@@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743348	EF	On-Demand	Anodyne	PLD1	45	36
C[C@@H](CN1CCCCCC1)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450743348	EF	On-Demand	Anodyne	BIRC2	45	40
CCO[C@H]1CCN(c2ccnc(C3CC3)n2)C[C@@H]1C	ZINC000450743395	CF	On-Demand	Anodyne	SORD	40	33
CCO[C@@H]1CCN(c2ccnc(C3CC3)n2)C[C@H]1C	ZINC000450743396	CF	On-Demand	Anodyne	SORD	40	33
CCO[C@@H]1CCN(c2ccnc(C3CC3)n2)C[C@@H]1C	ZINC000450743397	CF	On-Demand	Anodyne	SORD	40	33
CCO[C@H]1CCN(c2ccnc(C3CC3)n2)C[C@H]1C	ZINC000450743398	CF	On-Demand	Anodyne	SORD	40	33
CC(C)(CC(=O)Cn1nnc(-c2ccc(C(N)=O)cc2)n1)C1CC1	ZINC000450743402	ED	On-Demand	Anodyne	SCARB1	47	38
COc1ccc(-c2cc3ncn(CCC(C)(F)F)c(=O)c3s2)cc1	ZINC000450743434	FI	On-Demand	Anodyne	MCHR1	36	49
C[C@@H](CN1CCCCCC1)NC(=O)CCCC(=O)C1CC1	ZINC000450743439	CF	On-Demand	Anodyne	NOD1	41	33
C[C@H](CN1CCCCCC1)NC(=O)CCCC(=O)C1CC1	ZINC000450743440	CF	On-Demand	Anodyne	NOD1	41	33
CN(CCCC(=O)c1ccc(F)cc1)CC1(O)CCC1	ZINC000450743457	CF	On-Demand	Anodyne	DRD2	27	42
CN(CCCC(=O)c1ccc(F)cc1)CC1(O)CCC1	ZINC000450743457	CF	On-Demand	Anodyne	DRD4	0	43
CN(CCCC(=O)c1ccc(F)cc1)CC1(O)CCC1	ZINC000450743457	CF	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H](NC(=O)c1ccn(CCn2cccn2)n1)C1(c2ccccc2)CCCC1	ZINC000450743458	GG	On-Demand	Anodyne	HCN1	56	32
C[C@@H](NC(=O)c1ccn(CCn2cccn2)n1)C1(c2ccccc2)CCCC1	ZINC000450743458	GG	On-Demand	Anodyne	HCN4	48	32
C[C@H](NC(=O)c1ccn(CCn2cccn2)n1)C1(c2ccccc2)CCCC1	ZINC000450743459	GG	On-Demand	Anodyne	HCN1	56	32
C[C@H](NC(=O)c1ccn(CCn2cccn2)n1)C1(c2ccccc2)CCCC1	ZINC000450743459	GG	On-Demand	Anodyne	HCN4	48	32
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743464	DH	On-Demand	Anodyne	PDE3A	54	44
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743464	DH	On-Demand	Anodyne	HRP1_PLAFA	45	36
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743464	DH	On-Demand	Anodyne	HNMT	45	31
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743464	DH	On-Demand	Anodyne	PDE3B	80	44
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743464	DH	On-Demand	Anodyne	SIRT3	51	32
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743464	DH	On-Demand	Anodyne	SIRT1	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743465	DH	On-Demand	Anodyne	PDE3A	54	44
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743465	DH	On-Demand	Anodyne	HRP1_PLAFA	45	36
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743465	DH	On-Demand	Anodyne	HNMT	45	31
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743465	DH	On-Demand	Anodyne	PDE3B	80	44
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743465	DH	On-Demand	Anodyne	SIRT3	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450743465	DH	On-Demand	Anodyne	SIRT1	51	32
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743466	DH	On-Demand	Anodyne	PDE3A	54	44
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743466	DH	On-Demand	Anodyne	HRP1_PLAFA	45	36
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743466	DH	On-Demand	Anodyne	HNMT	45	31
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743466	DH	On-Demand	Anodyne	PDE3B	80	44
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743466	DH	On-Demand	Anodyne	SIRT3	51	32
CCO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743466	DH	On-Demand	Anodyne	SIRT1	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743467	DH	On-Demand	Anodyne	PDE3A	54	44
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743467	DH	On-Demand	Anodyne	HRP1_PLAFA	45	36
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743467	DH	On-Demand	Anodyne	HNMT	45	31
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743467	DH	On-Demand	Anodyne	PDE3B	80	44
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743467	DH	On-Demand	Anodyne	SIRT3	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450743467	DH	On-Demand	Anodyne	SIRT1	51	32
Cc1nccc(N2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450743474	CC	On-Demand	Anodyne	SORD	74	43
Cc1nccc(N2CCN(CC[C@H](C)O)CC2)n1	ZINC000450743475	CC	On-Demand	Anodyne	SORD	74	43
O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1ccnc(OC(F)F)c1	ZINC000450743485	GF	On-Demand	Anodyne	SCN9A	0	47
O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1ccnc(OC(F)F)c1	ZINC000450743485	GF	On-Demand	Anodyne	KDM4E	23	43
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	DRD4	35	43
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	ACHE	31	42
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	DRD3	33	43
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	LTA4H	24	44
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	SIGMAR1	69	44
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	CCR5	43	36
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	TIMP3	44	31
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	MCHR1	27	41
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	NPFFR1	47	34
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	ADIPOR1	0	40
CCN(CC1(C(=O)OC)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743486	DF	On-Demand	Anodyne	ADIPOR2	0	40
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	DRD4	35	43
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	ACHE	31	42
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	DRD3	33	43
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	LTA4H	24	44
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	SIGMAR1	69	44
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	CCR5	43	36
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	TIMP3	44	31
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	MCHR1	27	41
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	NPFFR1	47	34
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	ADIPOR1	0	40
CCN(CC1(C(=O)OC)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743487	DF	On-Demand	Anodyne	ADIPOR2	0	40
C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743532	DH	On-Demand	Anodyne	DRD2	31	47
C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743532	DH	On-Demand	Anodyne	DRD4	0	47
C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743532	DH	On-Demand	Anodyne	HTR2A	22	48
C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743532	DH	On-Demand	Anodyne	ERG2	22	47
C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743532	DH	On-Demand	Anodyne	SLC18A3	0	46
C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743532	DH	On-Demand	Anodyne	CYP2J2	50	35
C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743533	DH	On-Demand	Anodyne	DRD2	31	47
C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743533	DH	On-Demand	Anodyne	DRD4	0	47
C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743533	DH	On-Demand	Anodyne	HTR2A	22	48
C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743533	DH	On-Demand	Anodyne	ERG2	22	47
C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743533	DH	On-Demand	Anodyne	SLC18A3	0	46
C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC12CCOCC2	ZINC000450743533	DH	On-Demand	Anodyne	CYP2J2	50	35
COC(=O)c1ccc(CN2CCNC(=O)[C@H]2c2ccccc2C)cc1Cl	ZINC000450743534	FG	On-Demand	Anodyne	MBTPS1	42	34
COC(=O)c1ccc(CN2CCNC(=O)[C@@H]2c2ccccc2C)cc1Cl	ZINC000450743535	FG	On-Demand	Anodyne	MBTPS1	42	34
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	THRA	0	42
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	DRD2	48	62
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	DRD1	36	58
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	DRD4	50	56
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	HTR2A	51	65
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	HTR2C	33	51
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	DRD3	40	68
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	DRD5	23	42
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	ERG2	22	48
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	HTR7	52	45
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	SLC18A3	0	48
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	HTR3B	0	44
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	SORD	51	38
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	CYP2J2	55	41
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	NET	0	53
Cc1nccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450743536	EF	On-Demand	Anodyne	AP2S1	0	48
CCN1CCN(CCc2ccc(Cl)cc2)CC1=O	ZINC000450743539	CE	On-Demand	Anodyne	KCNJ1	24	40
CN(CCN1CCn2c(O)nnc2C1)Cc1ccccc1	ZINC000450743540	CC	On-Demand	Anodyne	SIGMAR1	21	41
CCCCNc1cc(N2CC[C@@H](OCC)[C@H](C)C2)nc(N)n1	ZINC000450743549	DE	On-Demand	Anodyne	HRH4	46	51
CCCCNc1cc(N2CC[C@H](OCC)[C@H](C)C2)nc(N)n1	ZINC000450743550	DE	On-Demand	Anodyne	HRH4	46	51
CCCCNc1cc(N2CC[C@@H](OCC)[C@@H](C)C2)nc(N)n1	ZINC000450743551	DE	On-Demand	Anodyne	HRH4	46	51
CCCCNc1cc(N2CC[C@H](OCC)[C@@H](C)C2)nc(N)n1	ZINC000450743552	DE	On-Demand	Anodyne	HRH4	46	51
CCO[C@H]1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)C[C@H]1C	ZINC000450743553	EG	On-Demand	Anodyne	L3MBTL3	44	33
CCO[C@@H]1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)C[C@@H]1C	ZINC000450743554	EG	On-Demand	Anodyne	L3MBTL3	44	33
CCO[C@@H]1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)C[C@H]1C	ZINC000450743555	EG	On-Demand	Anodyne	L3MBTL3	44	33
CCO[C@H]1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)C[C@@H]1C	ZINC000450743556	EG	On-Demand	Anodyne	L3MBTL3	44	33
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	ABCC8	21	44
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	MME	19	44
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	TRPV1	35	46
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	MTNR1A	15	41
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	TTR	0	45
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	NCE103	31	45
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	MTCA1	19	45
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	ACAT	0	43
COc1cc(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743557	FH	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	ABCC8	21	44
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	MME	19	44
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	TRPV1	35	46
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	MTNR1A	15	41
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	TTR	0	45
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	NCE103	31	45
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	MTCA1	19	45
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	ACAT	0	43
COc1cc(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)ccc1O	ZINC000450743558	FH	On-Demand	Anodyne	CAN2	0	45
CCOC(=O)c1cccnc1N1CC[C@@H](OCC)[C@@H](C)C1	ZINC000450743576	CF	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)c1cccnc1N1CC[C@H](OCC)[C@@H](C)C1	ZINC000450743577	CF	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)c1cccnc1N1CC[C@H](OCC)[C@H](C)C1	ZINC000450743578	CF	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)c1cccnc1N1CC[C@@H](OCC)[C@H](C)C1	ZINC000450743579	CF	On-Demand	Anodyne	P2RY12	43	35
CN(Cc1ccccc1OC1CC1)C1CC(O)C1	ZINC000450743591	BE	On-Demand	Anodyne	SLC5A4	58	36
COC(=O)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1cccc(O)c1	ZINC000450743592	EE	On-Demand	Anodyne	KYNU	0	41
COC(=O)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1cccc(O)c1	ZINC000450743593	EE	On-Demand	Anodyne	KYNU	0	41
COC(=O)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1cccc(O)c1	ZINC000450743594	EE	On-Demand	Anodyne	KYNU	0	41
COC(=O)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1cccc(O)c1	ZINC000450743595	EE	On-Demand	Anodyne	KYNU	0	41
C[C@H](c1ccc(Cn2c(S(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450743598	GI	On-Demand	Anodyne	ALOX5AP	50	48
C[C@H](c1ccc(Cn2c(S(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450743598	GI	On-Demand	Anodyne	PDE6D	77	39
C[C@@H](c1ccc(Cn2c(S(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450743599	GI	On-Demand	Anodyne	ALOX5AP	50	48
C[C@@H](c1ccc(Cn2c(S(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450743599	GI	On-Demand	Anodyne	PDE6D	77	39
Cc1ccc(F)c(CC(=O)NCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000450743600	FG	On-Demand	Anodyne	SCN9A	0	48
CCO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450743601	DG	On-Demand	Anodyne	PDE3A	55	45
CCO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450743601	DG	On-Demand	Anodyne	PDE3B	81	45
CCO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450743601	DG	On-Demand	Anodyne	SIRT3	43	32
CCO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450743601	DG	On-Demand	Anodyne	SIRT1	41	31
CCO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450743602	DG	On-Demand	Anodyne	PDE3A	55	45
CCO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450743602	DG	On-Demand	Anodyne	PDE3B	81	45
CCO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450743602	DG	On-Demand	Anodyne	SIRT3	43	32
CCO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450743602	DG	On-Demand	Anodyne	SIRT1	41	31
CCO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450743603	DG	On-Demand	Anodyne	PDE3A	55	45
CCO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450743603	DG	On-Demand	Anodyne	PDE3B	81	45
CCO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450743603	DG	On-Demand	Anodyne	SIRT3	43	32
CCO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450743603	DG	On-Demand	Anodyne	SIRT1	41	31
CCO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450743604	DG	On-Demand	Anodyne	PDE3A	55	45
CCO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450743604	DG	On-Demand	Anodyne	PDE3B	81	45
CCO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450743604	DG	On-Demand	Anodyne	SIRT3	43	32
CCO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450743604	DG	On-Demand	Anodyne	SIRT1	41	31
c1ccc(CC[C@H]2CN(Cc3cn(CC4CC4)nn3)CCO2)cc1	ZINC000450743609	EF	On-Demand	Anodyne	DRD4	17	61
c1ccc(CC[C@@H]2CN(Cc3cn(CC4CC4)nn3)CCO2)cc1	ZINC000450743610	EF	On-Demand	Anodyne	DRD4	17	61
Cc1cnc(CCCC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)o1	ZINC000450743619	EI	On-Demand	Anodyne	NPPA	43	35
Cc1cnc(CCCC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)o1	ZINC000450743620	EI	On-Demand	Anodyne	NPPA	43	35
CCO[C@@H]1CCN(c2cc(C)nc3c(OC)cccc23)C[C@H]1C	ZINC000450743629	DH	On-Demand	Anodyne	PDE3B	46	32
CCO[C@H]1CCN(c2cc(C)nc3c(OC)cccc23)C[C@H]1C	ZINC000450743630	DH	On-Demand	Anodyne	PDE3B	46	32
CCO[C@H]1CCN(c2cc(C)nc3c(OC)cccc23)C[C@@H]1C	ZINC000450743631	DH	On-Demand	Anodyne	PDE3B	46	32
CCO[C@@H]1CCN(c2cc(C)nc3c(OC)cccc23)C[C@@H]1C	ZINC000450743632	DH	On-Demand	Anodyne	PDE3B	46	32
C[C@H](c1ccc(CN2CCN(c3ncc(F)cn3)CC2)cc1)C(F)(F)F	ZINC000450743665	FH	On-Demand	Anodyne	DRD4	19	46
C[C@@H](c1ccc(CN2CCN(c3ncc(F)cn3)CC2)cc1)C(F)(F)F	ZINC000450743666	FH	On-Demand	Anodyne	DRD4	19	46
CCN(Cc1cnns1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450743684	DF	On-Demand	Anodyne	SIGMAR1	41	39
CCN(Cc1cnns1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450743685	DF	On-Demand	Anodyne	SIGMAR1	41	39
Cc1ccccc1[C@H]1C(=O)NCCN1CCCC(=O)c1ccccc1	ZINC000450743720	EG	On-Demand	Anodyne	CYP2J2	53	39
Cc1ccccc1[C@@H]1C(=O)NCCN1CCCC(=O)c1ccccc1	ZINC000450743721	EG	On-Demand	Anodyne	CYP2J2	53	39
C[C@@H]1N(CCCC(=O)c2ccccc2)CCC12CCOCC2	ZINC000450743726	DH	On-Demand	Anodyne	CYP2J2	57	41
C[C@H]1N(CCCC(=O)c2ccccc2)CCC12CCOCC2	ZINC000450743727	DH	On-Demand	Anodyne	CYP2J2	57	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccon2)c(OC)c1	ZINC000450743759	EE	On-Demand	Anodyne	MTNR1A	52	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccon2)c(OC)c1	ZINC000450743760	EE	On-Demand	Anodyne	MTNR1A	52	41
CC[C@H]1CN(Cc2nc(C(=O)OC)co2)CCN1Cc1ccccc1	ZINC000450743761	EF	On-Demand	Anodyne	SIGMAR1	23	40
CC[C@@H]1CN(Cc2nc(C(=O)OC)co2)CCN1Cc1ccccc1	ZINC000450743762	EF	On-Demand	Anodyne	SIGMAR1	23	40
Cc1nccc(N2CCN(CC/C=C\c3ccccc3)CC2)n1	ZINC000450743768	DG	On-Demand	Anodyne	SORD	61	36
Cc1nccc(N2CCN(CC/C=C/c3ccccc3)CC2)n1	ZINC000450743769	DG	On-Demand	Anodyne	SORD	61	36
CCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450743775	CD	On-Demand	Anodyne	DRD2	36	49
CCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450743775	CD	On-Demand	Anodyne	HTR2A	25	53
CCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450743775	CD	On-Demand	Anodyne	ERG2	22	48
CCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450743775	CD	On-Demand	Anodyne	HTR3B	0	46
CCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450743775	CD	On-Demand	Anodyne	CYP2J2	54	39
CCN1CCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450743775	CD	On-Demand	Anodyne	AP2S1	0	48
COc1cc(Br)c(C(=O)N[C@H](C)CN2CCCCCC2)cc1OC	ZINC000450743776	GG	On-Demand	Anodyne	HTR4	37	41
COc1cc(Br)c(C(=O)N[C@H](C)CN2CCCCCC2)cc1OC	ZINC000450743776	GG	On-Demand	Anodyne	PLD1	41	36
COc1cc(Br)c(C(=O)N[C@@H](C)CN2CCCCCC2)cc1OC	ZINC000450743777	GG	On-Demand	Anodyne	HTR4	37	41
COc1cc(Br)c(C(=O)N[C@@H](C)CN2CCCCCC2)cc1OC	ZINC000450743777	GG	On-Demand	Anodyne	PLD1	41	36
C[C@@H](CN1CCCCCC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450743794	EG	On-Demand	Anodyne	P2RY12	55	33
C[C@@H](CN1CCCCCC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450743794	EG	On-Demand	Anodyne	P2RX3	34	59
C[C@@H](CN1CCCCCC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450743794	EG	On-Demand	Anodyne	PLD1	47	36
C[C@@H](CN1CCCCCC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450743794	EG	On-Demand	Anodyne	CTSV	45	31
C[C@H](CN1CCCCCC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450743795	EG	On-Demand	Anodyne	P2RY12	55	33
C[C@H](CN1CCCCCC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450743795	EG	On-Demand	Anodyne	P2RX3	34	59
C[C@H](CN1CCCCCC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450743795	EG	On-Demand	Anodyne	PLD1	47	36
C[C@H](CN1CCCCCC1)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450743795	EG	On-Demand	Anodyne	CTSV	45	31
CCOC(=O)c1ccc(N2CC[C@@H](OCC)[C@@H](C)C2)nc1	ZINC000450743797	CF	On-Demand	Anodyne	ENPP2	17	40
CCOC(=O)c1ccc(N2CC[C@H](OCC)[C@@H](C)C2)nc1	ZINC000450743798	CF	On-Demand	Anodyne	ENPP2	17	40
CCOC(=O)c1ccc(N2CC[C@H](OCC)[C@H](C)C2)nc1	ZINC000450743799	CF	On-Demand	Anodyne	ENPP2	17	40
CCOC(=O)c1ccc(N2CC[C@@H](OCC)[C@H](C)C2)nc1	ZINC000450743800	CF	On-Demand	Anodyne	ENPP2	17	40
CN1CCN(CC2(C)CCN(CCc3c(Cl)cccc3Cl)CC2)CC1	ZINC000450743801	GH	On-Demand	Anodyne	SIGMAR1	16	43
CCO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450743822	CH	On-Demand	Anodyne	HTR1D	49	36
CCO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450743822	CH	On-Demand	Anodyne	HTR1B	42	36
CCO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450743822	CH	On-Demand	Anodyne	METAP1	42	41
CCO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450743822	CH	On-Demand	Anodyne	ADAM17	50	33
CCO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450743823	CH	On-Demand	Anodyne	HTR1D	49	36
CCO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450743823	CH	On-Demand	Anodyne	HTR1B	42	36
CCO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450743823	CH	On-Demand	Anodyne	METAP1	42	41
CCO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450743823	CH	On-Demand	Anodyne	ADAM17	50	33
CCO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450743824	CH	On-Demand	Anodyne	HTR1D	49	36
CCO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450743824	CH	On-Demand	Anodyne	HTR1B	42	36
CCO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450743824	CH	On-Demand	Anodyne	METAP1	42	41
CCO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450743824	CH	On-Demand	Anodyne	ADAM17	50	33
CCO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450743825	CH	On-Demand	Anodyne	HTR1D	49	36
CCO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450743825	CH	On-Demand	Anodyne	HTR1B	42	36
CCO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450743825	CH	On-Demand	Anodyne	METAP1	42	41
CCO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450743825	CH	On-Demand	Anodyne	ADAM17	50	33
NC(=O)c1ccc(-c2nnn(C[C@H]3CCCCC3(F)F)n2)cc1	ZINC000450743826	DE	On-Demand	Anodyne	SCARB1	46	37
NC(=O)c1ccc(-c2nnn(C[C@@H]3CCCCC3(F)F)n2)cc1	ZINC000450743827	DE	On-Demand	Anodyne	SCARB1	46	37
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743845	EE	On-Demand	Anodyne	ADRA1D	16	50
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743845	EE	On-Demand	Anodyne	ADRA1B	45	52
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743845	EE	On-Demand	Anodyne	PDE3A	48	41
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743845	EE	On-Demand	Anodyne	CCR4	46	41
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743845	EE	On-Demand	Anodyne	PDE3B	72	41
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743845	EE	On-Demand	Anodyne	EHMT2	71	38
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743846	EE	On-Demand	Anodyne	ADRA1D	16	50
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743846	EE	On-Demand	Anodyne	ADRA1B	45	52
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743846	EE	On-Demand	Anodyne	PDE3A	48	41
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743846	EE	On-Demand	Anodyne	CCR4	46	41
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743846	EE	On-Demand	Anodyne	PDE3B	72	41
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743846	EE	On-Demand	Anodyne	EHMT2	71	38
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743847	EE	On-Demand	Anodyne	ADRA1D	16	50
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743847	EE	On-Demand	Anodyne	ADRA1B	45	52
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743847	EE	On-Demand	Anodyne	PDE3A	48	41
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743847	EE	On-Demand	Anodyne	CCR4	46	41
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743847	EE	On-Demand	Anodyne	PDE3B	72	41
CCO[C@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@H]1C	ZINC000450743847	EE	On-Demand	Anodyne	EHMT2	71	38
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743848	EE	On-Demand	Anodyne	ADRA1D	16	50
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743848	EE	On-Demand	Anodyne	ADRA1B	45	52
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743848	EE	On-Demand	Anodyne	PDE3A	48	41
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743848	EE	On-Demand	Anodyne	CCR4	46	41
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743848	EE	On-Demand	Anodyne	PDE3B	72	41
CCO[C@@H]1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C[C@@H]1C	ZINC000450743848	EE	On-Demand	Anodyne	EHMT2	71	38
Cc1nccc(N2CCN(CC3=CCCCC3)CC2)n1	ZINC000450743865	CE	On-Demand	Anodyne	SORD	57	38
C[C@@H](O)CCn1c(S(C)(=O)=O)nc2ccccc21	ZINC000450743900	CD	On-Demand	Anodyne	HRH1	16	44
C[C@H](O)CCn1c(S(C)(=O)=O)nc2ccccc21	ZINC000450743901	CD	On-Demand	Anodyne	HRH1	16	44
CCO[C@@H]1CCN(c2ccc(C(=O)NCCOC)cn2)C[C@@H]1C	ZINC000450743907	DD	On-Demand	Anodyne	HDAC1	0	41
CCO[C@H]1CCN(c2ccc(C(=O)NCCOC)cn2)C[C@H]1C	ZINC000450743908	DD	On-Demand	Anodyne	HDAC1	0	41
CCO[C@@H]1CCN(c2ccc(C(=O)NCCOC)cn2)C[C@H]1C	ZINC000450743909	DD	On-Demand	Anodyne	HDAC1	0	41
CCO[C@H]1CCN(c2ccc(C(=O)NCCOC)cn2)C[C@@H]1C	ZINC000450743910	DD	On-Demand	Anodyne	HDAC1	0	41
CCN1CCN(CCN(C)Cc2ccccc2)CC1=O	ZINC000450743941	CD	On-Demand	Anodyne	SIGMAR1	27	45
CC[C@H]1CN(CC2CCC(=O)CC2)CCN1Cc1ccccc1	ZINC000450743945	DG	On-Demand	Anodyne	SIGMAR1	43	57
CC[C@@H]1CN(CC2CCC(=O)CC2)CCN1Cc1ccccc1	ZINC000450743946	DG	On-Demand	Anodyne	SIGMAR1	43	57
CCO[C@H]1CCN(c2ncccc2OCc2ccccc2)C[C@H]1C	ZINC000450743949	EH	On-Demand	Anodyne	PDE3B	43	36
CCO[C@@H]1CCN(c2ncccc2OCc2ccccc2)C[C@@H]1C	ZINC000450743950	EH	On-Demand	Anodyne	PDE3B	43	36
CCO[C@@H]1CCN(c2ncccc2OCc2ccccc2)C[C@H]1C	ZINC000450743951	EH	On-Demand	Anodyne	PDE3B	43	36
CCO[C@H]1CCN(c2ncccc2OCc2ccccc2)C[C@@H]1C	ZINC000450743952	EH	On-Demand	Anodyne	PDE3B	43	36
COC(=O)[C@@H]1CS(=O)(=O)CCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450743964	EC	On-Demand	Anodyne	POL	0	40
COC(=O)[C@@H]1CS(=O)(=O)CCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450743965	EC	On-Demand	Anodyne	POL	0	40
COC(=O)[C@@H]1CS(=O)(=O)CCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450743966	EC	On-Demand	Anodyne	POL	0	40
COC(=O)[C@@H]1CS(=O)(=O)CCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450743967	EC	On-Demand	Anodyne	POL	0	40
CCO[C@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450743968	DG	On-Demand	Anodyne	PDE3A	66	53
CCO[C@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450743968	DG	On-Demand	Anodyne	PDGFRB	61	39
CCO[C@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450743968	DG	On-Demand	Anodyne	PDE3B	97	53
CCO[C@@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450743969	DG	On-Demand	Anodyne	PDE3A	66	53
CCO[C@@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450743969	DG	On-Demand	Anodyne	PDGFRB	61	39
CCO[C@@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450743969	DG	On-Demand	Anodyne	PDE3B	97	53
CCO[C@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450743970	DG	On-Demand	Anodyne	PDE3A	66	53
CCO[C@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450743970	DG	On-Demand	Anodyne	PDGFRB	61	39
CCO[C@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450743970	DG	On-Demand	Anodyne	PDE3B	97	53
CCO[C@@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450743971	DG	On-Demand	Anodyne	PDE3A	66	53
CCO[C@@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450743971	DG	On-Demand	Anodyne	PDGFRB	61	39
CCO[C@@H]1CCN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450743971	DG	On-Demand	Anodyne	PDE3B	97	53
C[C@@H](CN1CCCCCC1)NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450743994	EE	On-Demand	Anodyne	ABCB1	21	40
C[C@H](CN1CCCCCC1)NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450743995	EE	On-Demand	Anodyne	ABCB1	21	40
CC[C@@H](CC(C)C)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450743996	EH	On-Demand	Anodyne	SCN9A	0	41
CC[C@H](CC(C)C)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450743997	EH	On-Demand	Anodyne	SCN9A	0	41
Fc1cnc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450743998	DF	On-Demand	Anodyne	HTR1A	23	55
Fc1cnc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450743998	DF	On-Demand	Anodyne	DRD2	25	53
Fc1cnc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450743998	DF	On-Demand	Anodyne	DRD1	0	53
Fc1cnc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450743998	DF	On-Demand	Anodyne	DRD4	42	53
Fc1cnc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450743998	DF	On-Demand	Anodyne	DRD3	25	53
Fc1cnc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450743998	DF	On-Demand	Anodyne	SIGMAR1	22	52
Fc1cnc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450743998	DF	On-Demand	Anodyne	ABCC1	102	42
Fc1cnc(N2CCN(CCc3ccc(Cl)cc3)CC2)nc1	ZINC000450743998	DF	On-Demand	Anodyne	ABCB1A	52	34
CCO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450744003	CG	On-Demand	Anodyne	SIRT1	52	33
CCO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450744003	CG	On-Demand	Anodyne	HTT	0	41
CCO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450744004	CG	On-Demand	Anodyne	SIRT1	52	33
CCO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450744004	CG	On-Demand	Anodyne	HTT	0	41
CCO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450744005	CG	On-Demand	Anodyne	SIRT1	52	33
CCO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450744005	CG	On-Demand	Anodyne	HTT	0	41
CCO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450744006	CG	On-Demand	Anodyne	SIRT1	52	33
CCO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450744006	CG	On-Demand	Anodyne	HTT	0	41
CCO[C@@H]1CCN(c2c(C#N)cnc3c(OC)cc(OC)cc23)C[C@H]1C	ZINC000450744019	FG	On-Demand	Mild	PDE3B	43	34
CCO[C@H]1CCN(c2c(C#N)cnc3c(OC)cc(OC)cc23)C[C@H]1C	ZINC000450744020	FG	On-Demand	Mild	PDE3B	43	34
CCO[C@H]1CCN(c2c(C#N)cnc3c(OC)cc(OC)cc23)C[C@@H]1C	ZINC000450744021	FG	On-Demand	Mild	PDE3B	43	34
CCO[C@@H]1CCN(c2c(C#N)cnc3c(OC)cc(OC)cc23)C[C@@H]1C	ZINC000450744022	FG	On-Demand	Mild	PDE3B	43	34
O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1cccc(C(F)(F)F)n1	ZINC000450744035	GG	On-Demand	Anodyne	SCN9A	0	43
CCO[C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1C	ZINC000450744054	DG	On-Demand	Anodyne	SORD	40	37
CCO[C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@H]1C	ZINC000450744055	DG	On-Demand	Anodyne	SORD	40	37
CCO[C@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1C	ZINC000450744056	DG	On-Demand	Anodyne	SORD	40	37
CCO[C@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@H]1C	ZINC000450744057	DG	On-Demand	Anodyne	SORD	40	37
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](CCc3ccccc3)C2)cc1	ZINC000450744088	FG	On-Demand	Anodyne	DRD4	22	69
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](CCc3ccccc3)C2)cc1	ZINC000450744088	FG	On-Demand	Anodyne	ACHE	15	42
CCS(=O)(=O)c1ccc(CN2CCO[C@H](CCc3ccccc3)C2)cc1	ZINC000450744089	FG	On-Demand	Anodyne	DRD4	22	69
CCS(=O)(=O)c1ccc(CN2CCO[C@H](CCc3ccccc3)C2)cc1	ZINC000450744089	FG	On-Demand	Anodyne	ACHE	15	42
CCO[C@H]1CCN(c2nc(C)nc3ccc(OC)cc23)C[C@H]1C	ZINC000450744104	DG	On-Demand	Anodyne	PDE3A	50	43
CCO[C@H]1CCN(c2nc(C)nc3ccc(OC)cc23)C[C@H]1C	ZINC000450744104	DG	On-Demand	Anodyne	PDE3B	74	43
CCO[C@H]1CCN(c2nc(C)nc3ccc(OC)cc23)C[C@@H]1C	ZINC000450744105	DG	On-Demand	Anodyne	PDE3A	50	43
CCO[C@H]1CCN(c2nc(C)nc3ccc(OC)cc23)C[C@@H]1C	ZINC000450744105	DG	On-Demand	Anodyne	PDE3B	74	43
CCO[C@@H]1CCN(c2nc(C)nc3ccc(OC)cc23)C[C@H]1C	ZINC000450744106	DG	On-Demand	Anodyne	PDE3A	50	43
CCO[C@@H]1CCN(c2nc(C)nc3ccc(OC)cc23)C[C@H]1C	ZINC000450744106	DG	On-Demand	Anodyne	PDE3B	74	43
CCO[C@@H]1CCN(c2nc(C)nc3ccc(OC)cc23)C[C@@H]1C	ZINC000450744107	DG	On-Demand	Anodyne	PDE3A	50	43
CCO[C@@H]1CCN(c2nc(C)nc3ccc(OC)cc23)C[C@@H]1C	ZINC000450744107	DG	On-Demand	Anodyne	PDE3B	74	43
CCC(=O)CCCN1CCN(c2ccnc(C)n2)CC1	ZINC000450744112	CD	On-Demand	Anodyne	HTR1A	45	44
CCC(=O)CCCN1CCN(c2ccnc(C)n2)CC1	ZINC000450744112	CD	On-Demand	Anodyne	DRD2	36	43
CCC(=O)CCCN1CCN(c2ccnc(C)n2)CC1	ZINC000450744112	CD	On-Demand	Anodyne	HTR2A	40	44
CCC(=O)CCCN1CCN(c2ccnc(C)n2)CC1	ZINC000450744112	CD	On-Demand	Anodyne	DRD3	32	43
CCC(=O)CCCN1CCN(c2ccnc(C)n2)CC1	ZINC000450744112	CD	On-Demand	Anodyne	HTR7	58	36
CCC(=O)CCCN1CCN(c2ccnc(C)n2)CC1	ZINC000450744112	CD	On-Demand	Anodyne	SORD	74	42
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744136	CE	On-Demand	Anodyne	PDE3A	46	38
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744136	CE	On-Demand	Anodyne	AKT2	47	49
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744136	CE	On-Demand	Anodyne	JAK3	26	41
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744136	CE	On-Demand	Anodyne	JAK1	77	33
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744136	CE	On-Demand	Anodyne	ROCK2	41	39
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744136	CE	On-Demand	Anodyne	PDE3B	68	38
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744136	CE	On-Demand	Anodyne	AKT1	0	43
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744137	CE	On-Demand	Anodyne	PDE3A	46	38
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744137	CE	On-Demand	Anodyne	AKT2	47	49
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744137	CE	On-Demand	Anodyne	JAK3	26	41
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744137	CE	On-Demand	Anodyne	JAK1	77	33
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744137	CE	On-Demand	Anodyne	ROCK2	41	39
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744137	CE	On-Demand	Anodyne	PDE3B	68	38
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1C	ZINC000450744137	CE	On-Demand	Anodyne	AKT1	0	43
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744138	CE	On-Demand	Anodyne	PDE3A	46	38
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744138	CE	On-Demand	Anodyne	AKT2	47	49
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744138	CE	On-Demand	Anodyne	JAK3	26	41
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744138	CE	On-Demand	Anodyne	JAK1	77	33
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744138	CE	On-Demand	Anodyne	ROCK2	41	39
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744138	CE	On-Demand	Anodyne	PDE3B	68	38
CCO[C@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744138	CE	On-Demand	Anodyne	AKT1	0	43
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744139	CE	On-Demand	Anodyne	PDE3A	46	38
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744139	CE	On-Demand	Anodyne	AKT2	47	49
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744139	CE	On-Demand	Anodyne	JAK3	26	41
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744139	CE	On-Demand	Anodyne	JAK1	77	33
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744139	CE	On-Demand	Anodyne	ROCK2	41	39
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744139	CE	On-Demand	Anodyne	PDE3B	68	38
CCO[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@H]1C	ZINC000450744139	CE	On-Demand	Anodyne	AKT1	0	43
C[C@@H]1N(CCCC(=O)c2ccc(Br)cc2)CCC12CCOCC2	ZINC000450744142	GI	On-Demand	Anodyne	CYP2J2	50	35
C[C@H]1N(CCCC(=O)c2ccc(Br)cc2)CCC12CCOCC2	ZINC000450744143	GI	On-Demand	Anodyne	CYP2J2	50	35
CCO[C@@H]1CCN(c2ccnc(C)n2)C[C@@H]1C	ZINC000450744158	BE	On-Demand	Anodyne	SORD	41	32
CCO[C@H]1CCN(c2ccnc(C)n2)C[C@@H]1C	ZINC000450744159	BE	On-Demand	Anodyne	SORD	41	32
CCO[C@H]1CCN(c2ccnc(C)n2)C[C@H]1C	ZINC000450744160	BE	On-Demand	Anodyne	SORD	41	32
CCO[C@@H]1CCN(c2ccnc(C)n2)C[C@H]1C	ZINC000450744161	BE	On-Demand	Anodyne	SORD	41	32
CN(CCN1CCOCC2(CCC2)C1)Cc1ccccc1	ZINC000450744163	CF	On-Demand	Anodyne	SIGMAR1	18	43
COc1ccc(-c2cc3ncn(CC[C@@H](C)O)c(=O)c3s2)cc1	ZINC000450744170	EF	On-Demand	Anodyne	MCHR1	34	47
COc1ccc(-c2cc3ncn(CC[C@H](C)O)c(=O)c3s2)cc1	ZINC000450744171	EF	On-Demand	Anodyne	MCHR1	34	47
C[C@H](CN1CCC(Oc2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450744175	GF	On-Demand	Anodyne	HRH3	0	41
C[C@H](CN1CCC(Oc2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450744175	GF	On-Demand	Anodyne	CCR3	33	42
C[C@@H](CN1CCC(Oc2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450744176	GF	On-Demand	Anodyne	HRH3	0	41
C[C@@H](CN1CCC(Oc2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450744176	GF	On-Demand	Anodyne	CCR3	33	42
O=C(C[C@H]1COc2ccccc2O1)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450744179	GF	On-Demand	Anodyne	SCN9A	0	43
O=C(C[C@@H]1COc2ccccc2O1)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450744180	GF	On-Demand	Anodyne	SCN9A	0	43
CCO[C@@H]1CCN(c2ccc(C(=O)OC)nn2)C[C@@H]1C	ZINC000450744202	CD	On-Demand	Anodyne	SCD1	33	44
CCO[C@H]1CCN(c2ccc(C(=O)OC)nn2)C[C@@H]1C	ZINC000450744203	CD	On-Demand	Anodyne	SCD1	33	44
CCO[C@H]1CCN(c2ccc(C(=O)OC)nn2)C[C@H]1C	ZINC000450744204	CD	On-Demand	Anodyne	SCD1	33	44
CCO[C@@H]1CCN(c2ccc(C(=O)OC)nn2)C[C@H]1C	ZINC000450744205	CD	On-Demand	Anodyne	SCD1	33	44
CCC(=O)CCCN(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450744217	DG	On-Demand	Anodyne	ACHE	29	43
CCC(=O)CCCN(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450744218	DG	On-Demand	Anodyne	ACHE	29	43
C[C@H]1C[C@@H](c2cccnc2)N(Cc2cnns2)C1	ZINC000450744219	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@@H](c2cccnc2)N(Cc2cnns2)C1	ZINC000450744219	CF	On-Demand	Anodyne	CRTY	0	40
C[C@H]1C[C@H](c2cccnc2)N(Cc2cnns2)C1	ZINC000450744220	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@H](c2cccnc2)N(Cc2cnns2)C1	ZINC000450744220	CF	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@@H](c2cccnc2)N(Cc2cnns2)C1	ZINC000450744221	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@@H](c2cccnc2)N(Cc2cnns2)C1	ZINC000450744221	CF	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@H](c2cccnc2)N(Cc2cnns2)C1	ZINC000450744222	CF	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@H](c2cccnc2)N(Cc2cnns2)C1	ZINC000450744222	CF	On-Demand	Anodyne	CRTY	0	40
CCO[C@@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@@H]1C	ZINC000450744223	CF	On-Demand	Anodyne	GPR39	0	44
CCO[C@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@@H]1C	ZINC000450744224	CF	On-Demand	Anodyne	GPR39	0	44
CCO[C@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@H]1C	ZINC000450744225	CF	On-Demand	Anodyne	GPR39	0	44
CCO[C@@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@H]1C	ZINC000450744226	CF	On-Demand	Anodyne	GPR39	0	44
C[C@H](CN1CCCCCC1)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450744228	EG	On-Demand	Anodyne	P2RX3	30	44
C[C@H](CN1CCCCCC1)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450744228	EG	On-Demand	Anodyne	PLD1	41	36
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450744229	EG	On-Demand	Anodyne	P2RX3	30	44
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450744229	EG	On-Demand	Anodyne	PLD1	41	36
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450744236	DH	On-Demand	Anodyne	PDE3A	55	45
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450744236	DH	On-Demand	Anodyne	PDE3B	81	45
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450744236	DH	On-Demand	Anodyne	SIRT3	54	34
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450744236	DH	On-Demand	Anodyne	SIRT1	54	34
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450744237	DH	On-Demand	Anodyne	PDE3A	55	45
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450744237	DH	On-Demand	Anodyne	PDE3B	81	45
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450744237	DH	On-Demand	Anodyne	SIRT3	54	34
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450744237	DH	On-Demand	Anodyne	SIRT1	54	34
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744238	DH	On-Demand	Anodyne	PDE3A	55	45
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744238	DH	On-Demand	Anodyne	PDE3B	81	45
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744238	DH	On-Demand	Anodyne	SIRT3	67	34
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744238	DH	On-Demand	Anodyne	SIRT2	66	34
CCO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744238	DH	On-Demand	Anodyne	SIRT1	55	34
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744239	DH	On-Demand	Anodyne	PDE3A	55	45
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744239	DH	On-Demand	Anodyne	PDE3B	81	45
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744239	DH	On-Demand	Anodyne	SIRT3	67	34
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744239	DH	On-Demand	Anodyne	SIRT2	66	34
CCO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450744239	DH	On-Demand	Anodyne	SIRT1	55	34
C[C@@H](Oc1ccccn1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450744264	FF	On-Demand	Anodyne	SCN9A	22	44
C[C@H](Oc1ccccn1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450744265	FF	On-Demand	Anodyne	SCN9A	22	44
CN1CCN(CC2(C)CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450744281	EG	On-Demand	Anodyne	SIGMAR1	23	43
CN1CCN(CC2(C)CCN(CCc3ccc(Cl)cc3)CC2)CC1	ZINC000450744281	EG	On-Demand	Anodyne	KCNJ1	33	40
CN1CCN(CC2(C)CCN(CCN(C)Cc3ccccc3)CC2)CC1	ZINC000450744287	FE	On-Demand	Anodyne	SIGMAR1	52	49
CC[C@H]1CN(C[C@H]2C[C@H]3CC[C@H]2O3)CCN1Cc1ccccc1	ZINC000450744296	DG	On-Demand	Anodyne	SIGMAR1	15	45
CC[C@@H]1CN(C[C@@H]2C[C@H]3CC[C@H]2O3)CCN1Cc1ccccc1	ZINC000450744297	DG	On-Demand	Anodyne	SIGMAR1	15	45
CC[C@@H]1CN(C[C@H]2C[C@H]3CC[C@H]2O3)CCN1Cc1ccccc1	ZINC000450744298	DG	On-Demand	Anodyne	SIGMAR1	15	45
CC[C@H]1CN(C[C@@H]2C[C@H]3CC[C@H]2O3)CCN1Cc1ccccc1	ZINC000450744299	DG	On-Demand	Anodyne	SIGMAR1	15	45
CN(CCCC(=O)c1ccccc1)C1CC(O)C1	ZINC000450744316	BE	On-Demand	Anodyne	CYP2J2	48	34
CSc1cccc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000450744349	FH	On-Demand	Anodyne	SCN9A	0	48
CSc1cccc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000450744349	FH	On-Demand	Anodyne	KDM4E	21	40
C[C@H](CN1CCCCCC1)NC(=O)c1ccsc1Br	ZINC000450744350	EH	On-Demand	Anodyne	PLD1	42	37
C[C@@H](CN1CCCCCC1)NC(=O)c1ccsc1Br	ZINC000450744351	EH	On-Demand	Anodyne	PLD1	42	37
CO[C@@H](CNC(C)(C)CC(N)=O)Cc1ccccc1	ZINC000450744363	CD	On-Demand	Anodyne	CYSP_TRYCR	40	36
CO[C@@H](CNC(C)(C)CC(N)=O)Cc1ccccc1	ZINC000450744363	CD	On-Demand	Anodyne	CTRB1	30	40
CO[C@@H](CNC(C)(C)CC(N)=O)Cc1ccccc1	ZINC000450744363	CD	On-Demand	Anodyne	HLA-DRB1	46	32
CO[C@H](CNC(C)(C)CC(N)=O)Cc1ccccc1	ZINC000450744364	CD	On-Demand	Anodyne	CYSP_TRYCR	40	36
CO[C@H](CNC(C)(C)CC(N)=O)Cc1ccccc1	ZINC000450744364	CD	On-Demand	Anodyne	CTRB1	30	40
CO[C@H](CNC(C)(C)CC(N)=O)Cc1ccccc1	ZINC000450744364	CD	On-Demand	Anodyne	HLA-DRB1	46	32
O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1cncc(Cl)c1	ZINC000450744367	FG	On-Demand	Anodyne	SCN9A	0	46
O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1cncc(Cl)c1	ZINC000450744367	FG	On-Demand	Anodyne	EPHX2	0	52
O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1cncc(Cl)c1	ZINC000450744367	FG	On-Demand	Anodyne	SCN10A	36	44
COCCn1cc2c(n1)[C@H](NC(=O)CCOc1cccc(OC)c1)CCC2	ZINC000450744374	FF	On-Demand	Anodyne	DRD4	41	31
COCCn1cc2c(n1)[C@@H](NC(=O)CCOc1cccc(OC)c1)CCC2	ZINC000450744375	FF	On-Demand	Anodyne	DRD4	41	31
CCO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H]1C	ZINC000450744384	FG	On-Demand	Anodyne	MMP13	0	41
CCO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H]1C	ZINC000450744384	FG	On-Demand	Anodyne	ALK	17	40
CCO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H]1C	ZINC000450744385	FG	On-Demand	Anodyne	MMP13	0	41
CCO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H]1C	ZINC000450744385	FG	On-Demand	Anodyne	ALK	17	40
CCO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1C	ZINC000450744386	FG	On-Demand	Anodyne	MMP13	0	41
CCO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1C	ZINC000450744386	FG	On-Demand	Anodyne	ALK	17	40
CCO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1C	ZINC000450744387	FG	On-Demand	Anodyne	MMP13	0	41
CCO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1C	ZINC000450744387	FG	On-Demand	Anodyne	ALK	17	40
CCO[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H]1C	ZINC000450744398	GD	On-Demand	Anodyne	GCKR	54	34
CCO[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@H]1C	ZINC000450744399	GD	On-Demand	Anodyne	GCKR	54	34
CCO[C@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H]1C	ZINC000450744400	GD	On-Demand	Anodyne	GCKR	54	34
CCO[C@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@H]1C	ZINC000450744401	GD	On-Demand	Anodyne	GCKR	54	34
CC1(O)CC(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)C1	ZINC000450744402	ED	On-Demand	Anodyne	SCN9A	0	42
CC1(O)CC(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)C1	ZINC000450744402	ED	On-Demand	Anodyne	GPBAR1	25	40
CCO[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C[C@@H]1C	ZINC000450744412	CD	On-Demand	Anodyne	SIRT1	51	33
CCO[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C[C@@H]1C	ZINC000450744413	CD	On-Demand	Anodyne	SIRT1	51	33
CCO[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C[C@H]1C	ZINC000450744414	CD	On-Demand	Anodyne	SIRT1	51	33
CCO[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C[C@H]1C	ZINC000450744415	CD	On-Demand	Anodyne	SIRT1	51	33
CCOC(=O)c1cc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)on1	ZINC000450744422	GE	On-Demand	Anodyne	SCN9A	0	49
C[C@@H]1C[C@@H](c2cccnc2)N(CC[C@@H]2CCOC2)C1	ZINC000450744427	CF	On-Demand	Anodyne	CHRNA2	40	42
C[C@@H]1C[C@@H](c2cccnc2)N(CC[C@@H]2CCOC2)C1	ZINC000450744427	CF	On-Demand	Anodyne	CRTY	0	42
C[C@@H]1C[C@H](c2cccnc2)N(CC[C@@H]2CCOC2)C1	ZINC000450744428	CF	On-Demand	Anodyne	CHRNA2	40	42
C[C@@H]1C[C@H](c2cccnc2)N(CC[C@@H]2CCOC2)C1	ZINC000450744428	CF	On-Demand	Anodyne	CRTY	0	42
C[C@@H]1C[C@H](c2cccnc2)N(CC[C@H]2CCOC2)C1	ZINC000450744429	CF	On-Demand	Anodyne	CHRNA2	40	42
C[C@@H]1C[C@H](c2cccnc2)N(CC[C@H]2CCOC2)C1	ZINC000450744429	CF	On-Demand	Anodyne	CRTY	0	42
C[C@@H]1C[C@@H](c2cccnc2)N(CC[C@H]2CCOC2)C1	ZINC000450744430	CF	On-Demand	Anodyne	CHRNA2	40	42
C[C@@H]1C[C@@H](c2cccnc2)N(CC[C@H]2CCOC2)C1	ZINC000450744430	CF	On-Demand	Anodyne	CRTY	0	42
CCCc1cc(C(=O)N[C@H](C)CN2CCCCCC2)no1	ZINC000450744448	CF	On-Demand	Anodyne	P2RX3	30	41
CCCc1cc(C(=O)N[C@@H](C)CN2CCCCCC2)no1	ZINC000450744449	CF	On-Demand	Anodyne	P2RX3	30	41
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744475	FI	On-Demand	Anodyne	PRNP	41	40
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744475	FI	On-Demand	Anodyne	GRM4	16	40
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744475	FI	On-Demand	Anodyne	HDAC1	31	43
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744475	FI	On-Demand	Anodyne	MCHR1	22	44
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744475	FI	On-Demand	Anodyne	TAAR1	43	43
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744475	FI	On-Demand	Anodyne	DGAT1	31	42
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744475	FI	On-Demand	Anodyne	KCNK3	47	37
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744476	FI	On-Demand	Anodyne	PRNP	41	40
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744476	FI	On-Demand	Anodyne	GRM4	16	40
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744476	FI	On-Demand	Anodyne	HDAC1	31	43
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744476	FI	On-Demand	Anodyne	MCHR1	22	44
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744476	FI	On-Demand	Anodyne	TAAR1	43	43
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744476	FI	On-Demand	Anodyne	DGAT1	31	42
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744476	FI	On-Demand	Anodyne	KCNK3	47	37
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744477	FI	On-Demand	Anodyne	PRNP	41	40
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744477	FI	On-Demand	Anodyne	GRM4	16	40
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744477	FI	On-Demand	Anodyne	HDAC1	31	43
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744477	FI	On-Demand	Anodyne	MCHR1	22	44
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744477	FI	On-Demand	Anodyne	TAAR1	43	43
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744477	FI	On-Demand	Anodyne	DGAT1	31	42
CCO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450744477	FI	On-Demand	Anodyne	KCNK3	47	37
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744478	FI	On-Demand	Anodyne	PRNP	41	40
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744478	FI	On-Demand	Anodyne	GRM4	16	40
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744478	FI	On-Demand	Anodyne	HDAC1	31	43
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744478	FI	On-Demand	Anodyne	MCHR1	22	44
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744478	FI	On-Demand	Anodyne	TAAR1	43	43
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744478	FI	On-Demand	Anodyne	DGAT1	31	42
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450744478	FI	On-Demand	Anodyne	KCNK3	47	37
CCO[C@H]1CCN(c2ccc(Cl)cc2C#N)C[C@H]1C	ZINC000450744480	CG	On-Demand	Mild	NOS2	18	40
CCO[C@H]1CCN(c2ccc(Cl)cc2C#N)C[C@H]1C	ZINC000450744480	CG	On-Demand	Mild	NOS3	15	40
CCO[C@@H]1CCN(c2ccc(Cl)cc2C#N)C[C@H]1C	ZINC000450744481	CG	On-Demand	Mild	NOS2	18	40
CCO[C@@H]1CCN(c2ccc(Cl)cc2C#N)C[C@H]1C	ZINC000450744481	CG	On-Demand	Mild	NOS3	15	40
CCO[C@H]1CCN(c2ccc(Cl)cc2C#N)C[C@@H]1C	ZINC000450744482	CG	On-Demand	Mild	NOS2	18	40
CCO[C@H]1CCN(c2ccc(Cl)cc2C#N)C[C@@H]1C	ZINC000450744482	CG	On-Demand	Mild	NOS3	15	40
CCO[C@@H]1CCN(c2ccc(Cl)cc2C#N)C[C@@H]1C	ZINC000450744483	CG	On-Demand	Mild	NOS2	18	40
CCO[C@@H]1CCN(c2ccc(Cl)cc2C#N)C[C@@H]1C	ZINC000450744483	CG	On-Demand	Mild	NOS3	15	40
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	DRD2	34	42
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	DRD1	23	44
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	DRD4	24	45
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	HTR2A	36	51
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	HTR2C	23	54
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	ADRA1B	30	42
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	PLD1	42	36
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	SLC18A3	0	43
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	HTR3B	0	43
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	PLD2	43	36
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	CYP2J2	56	41
COC(=O)c1cn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)nn1	ZINC000450744486	FF	On-Demand	Anodyne	AP2S1	0	42
CCN1CCN(CCCC(=O)c2ccc(Br)cc2)CC1=O	ZINC000450744499	FF	On-Demand	Anodyne	CYP2J2	54	39
COC(=O)c1cn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450744500	FF	On-Demand	Anodyne	DRD4	32	40
COC(=O)c1cn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450744500	FF	On-Demand	Anodyne	HRH1	0	43
COC(=O)c1cn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450744500	FF	On-Demand	Anodyne	DRD3	26	42
COC(=O)c1cn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450744500	FF	On-Demand	Anodyne	HTR4	55	35
COC(=O)c1cn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450744500	FF	On-Demand	Anodyne	SIGMAR1	23	42
COC(=O)c1cn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450744500	FF	On-Demand	Anodyne	SSTR5	69	42
COC(=O)c1cn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450744500	FF	On-Demand	Anodyne	CCR3	47	45
COC(=O)c1cn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)nn1	ZINC000450744500	FF	On-Demand	Anodyne	MCHR1	33	46
CCO[C@@H]1CCN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450744501	GE	On-Demand	Bother	TAAR1	21	47
CCO[C@@H]1CCN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450744502	GE	On-Demand	Bother	TAAR1	21	47
CCO[C@@H]1CCN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450744503	GE	On-Demand	Bother	TAAR1	21	47
CCO[C@@H]1CCN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450744504	GE	On-Demand	Bother	TAAR1	21	47
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450744528	EG	On-Demand	Anodyne	BIRC2	41	41
C[C@@H](CN1CCCCCC1)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450744529	EG	On-Demand	Anodyne	BIRC2	41	41
C[C@H](CN1CCCCCC1)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450744530	EG	On-Demand	Anodyne	BIRC2	41	41
C[C@@H](CN1CCCCCC1)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450744531	EG	On-Demand	Anodyne	BIRC2	41	41
CCO[C@H]1CCN(c2ncnc3c(F)c(OC)ccc23)C[C@@H]1C	ZINC000450744541	DG	On-Demand	Anodyne	PDE3A	30	42
CCO[C@H]1CCN(c2ncnc3c(F)c(OC)ccc23)C[C@@H]1C	ZINC000450744541	DG	On-Demand	Anodyne	PDE3B	80	43
CCO[C@@H]1CCN(c2ncnc3c(F)c(OC)ccc23)C[C@H]1C	ZINC000450744542	DG	On-Demand	Anodyne	PDE3A	30	42
CCO[C@@H]1CCN(c2ncnc3c(F)c(OC)ccc23)C[C@H]1C	ZINC000450744542	DG	On-Demand	Anodyne	PDE3B	80	43
CCO[C@@H]1CCN(c2ncnc3c(F)c(OC)ccc23)C[C@@H]1C	ZINC000450744543	DG	On-Demand	Anodyne	PDE3A	30	42
CCO[C@@H]1CCN(c2ncnc3c(F)c(OC)ccc23)C[C@@H]1C	ZINC000450744543	DG	On-Demand	Anodyne	PDE3B	80	43
CCO[C@H]1CCN(c2ncnc3c(F)c(OC)ccc23)C[C@H]1C	ZINC000450744544	DG	On-Demand	Anodyne	PDE3A	30	42
CCO[C@H]1CCN(c2ncnc3c(F)c(OC)ccc23)C[C@H]1C	ZINC000450744544	DG	On-Demand	Anodyne	PDE3B	80	43
C[C@H](CN1CCCCCC1)NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450744551	DG	On-Demand	Anodyne	PLD1	48	36
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450744552	DG	On-Demand	Anodyne	PLD1	48	36
CC(=O)N[C@H](C(=O)NCCc1ccc(OCC(F)(F)F)nc1)C(C)(C)C	ZINC000450744553	GE	On-Demand	Anodyne	ACACA	29	41
CC(=O)N[C@H](C(=O)NCCc1ccc(OCC(F)(F)F)nc1)C(C)(C)C	ZINC000450744553	GE	On-Demand	Anodyne	ACACB	15	41
Cc1nccc(N2CCN([C@@H](C)c3csnn3)CC2)n1	ZINC000450744555	CD	On-Demand	Anodyne	SORD	66	41
Cc1nccc(N2CCN([C@H](C)c3csnn3)CC2)n1	ZINC000450744556	CD	On-Demand	Anodyne	SORD	66	41
C[C@@]1(C(N)=O)CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450744567	DF	On-Demand	Anodyne	DRD2	32	48
C[C@@]1(C(N)=O)CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450744567	DF	On-Demand	Anodyne	DRD4	0	48
C[C@@]1(C(N)=O)CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450744567	DF	On-Demand	Anodyne	ERG2	22	48
C[C@@]1(C(N)=O)CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450744567	DF	On-Demand	Anodyne	SLC18A3	0	47
C[C@]1(C(N)=O)CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450744568	DF	On-Demand	Anodyne	DRD2	32	48
C[C@]1(C(N)=O)CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450744568	DF	On-Demand	Anodyne	DRD4	0	48
C[C@]1(C(N)=O)CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450744568	DF	On-Demand	Anodyne	ERG2	22	48
C[C@]1(C(N)=O)CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450744568	DF	On-Demand	Anodyne	SLC18A3	0	47
CCO[C@@H]1CCN(c2ccc(C(F)(F)F)cn2)C[C@@H]1C	ZINC000450744569	CG	On-Demand	Anodyne	LIPG	43	36
CCO[C@H]1CCN(c2ccc(C(F)(F)F)cn2)C[C@@H]1C	ZINC000450744570	CG	On-Demand	Anodyne	LIPG	43	36
CCO[C@H]1CCN(c2ccc(C(F)(F)F)cn2)C[C@H]1C	ZINC000450744571	CG	On-Demand	Anodyne	LIPG	43	36
CCO[C@@H]1CCN(c2ccc(C(F)(F)F)cn2)C[C@H]1C	ZINC000450744572	CG	On-Demand	Anodyne	LIPG	43	36
Cc1cc(F)c(CC(=O)NCCc2ccc(OCC(F)(F)F)nc2)cc1F	ZINC000450744581	GH	On-Demand	Anodyne	SCN9A	0	49
CN(CCCC(=O)c1ccc(F)cc1)C1CC(O)C1	ZINC000450744582	CE	On-Demand	Anodyne	DRD4	0	43
COc1ccc(CNC(=O)CCNC(C)(C)c2ccc(C)nc2)c(OC)c1	ZINC000450744583	FF	On-Demand	Anodyne	MTNR1A	41	38
C[C@@H](CN1CCCCCC1)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450744595	FF	On-Demand	Anodyne	BIRC2	51	43
C[C@H](CN1CCCCCC1)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450744596	FF	On-Demand	Anodyne	BIRC2	51	43
CCO[C@@H]1C[C@@H](NC(=O)C2(C(=O)CC)CC2)[C@H]1Oc1ccccc1	ZINC000450744603	EE	On-Demand	Anodyne	TIMP3	51	33
CCO[C@@H]1C[C@@H](NC(=O)C2(C(=O)CC)CC2)[C@@H]1Oc1ccccc1	ZINC000450744604	EE	On-Demand	Anodyne	TIMP3	51	33
CCO[C@@H]1C[C@H](NC(=O)C2(C(=O)CC)CC2)[C@@H]1Oc1ccccc1	ZINC000450744605	EE	On-Demand	Anodyne	TIMP3	51	33
CCO[C@@H]1C[C@H](NC(=O)C2(C(=O)CC)CC2)[C@H]1Oc1ccccc1	ZINC000450744606	EE	On-Demand	Anodyne	TIMP3	51	33
CC[C@@H]1CN(C[C@](C)(O)C(C)=O)CCN1Cc1ccccc1	ZINC000450744607	DD	On-Demand	Anodyne	SIGMAR1	33	44
CC[C@@H]1CN(C[C@@](C)(O)C(C)=O)CCN1Cc1ccccc1	ZINC000450744608	DD	On-Demand	Anodyne	SIGMAR1	33	44
CC[C@H]1CN(C[C@](C)(O)C(C)=O)CCN1Cc1ccccc1	ZINC000450744609	DD	On-Demand	Anodyne	SIGMAR1	33	44
CC[C@H]1CN(C[C@@](C)(O)C(C)=O)CCN1Cc1ccccc1	ZINC000450744610	DD	On-Demand	Anodyne	SIGMAR1	33	44
Cc1cccc2c1O[C@H](C(=O)NCCc1ccc(OCC(F)(F)F)nc1)C2	ZINC000450744611	GF	On-Demand	Anodyne	SCN9A	0	45
Cc1cccc2c1O[C@@H](C(=O)NCCc1ccc(OCC(F)(F)F)nc1)C2	ZINC000450744612	GF	On-Demand	Anodyne	SCN9A	0	45
CCOC(=O)c1ccc(CN2CCC(n3cc(C(=O)OC)nn3)CC2)nc1	ZINC000450744629	FD	On-Demand	Anodyne	SSTR5	47	41
CCO[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@@H]1C	ZINC000450744632	FE	On-Demand	Anodyne	P2RY12	28	40
CCO[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@@H]1C	ZINC000450744632	FE	On-Demand	Anodyne	LRRK2	26	41
CCO[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@H]1C	ZINC000450744633	FE	On-Demand	Anodyne	P2RY12	28	40
CCO[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@H]1C	ZINC000450744633	FE	On-Demand	Anodyne	LRRK2	26	41
CCO[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@H]1C	ZINC000450744634	FE	On-Demand	Anodyne	P2RY12	28	40
CCO[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@H]1C	ZINC000450744634	FE	On-Demand	Anodyne	LRRK2	26	41
CCO[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@@H]1C	ZINC000450744635	FE	On-Demand	Anodyne	P2RY12	28	40
CCO[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@@H]1C	ZINC000450744635	FE	On-Demand	Anodyne	LRRK2	26	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450744642	GG	On-Demand	Anodyne	PPARA	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450744642	GG	On-Demand	Anodyne	PPARD	23	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450744642	GG	On-Demand	Anodyne	PIK3CD	34	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450744642	GG	On-Demand	Anodyne	CCR2	42	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450744642	GG	On-Demand	Anodyne	PIK3CB	68	40
C/C=C\COc1cccc(CC(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450744644	GF	On-Demand	Anodyne	PIK3CB	43	39
COC(=O)CN(CCc1ccccc1)C(=O)[C@@H](O)C1CCC1	ZINC000450744655	DD	On-Demand	Anodyne	SLC18A2	52	47
COC(=O)CN(CCc1ccccc1)C(=O)[C@@H](O)C1CCC1	ZINC000450744655	DD	On-Demand	Anodyne	AMY2	43	30
COC(=O)CN(CCc1ccccc1)C(=O)[C@H](O)C1CCC1	ZINC000450744656	DD	On-Demand	Anodyne	SLC18A2	52	47
COC(=O)CN(CCc1ccccc1)C(=O)[C@H](O)C1CCC1	ZINC000450744656	DD	On-Demand	Anodyne	AMY2	43	30
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	DRD2	21	53
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	DRD4	48	53
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	ACHE	18	49
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	DRD3	18	53
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	HTR4	73	43
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	CHRM3	17	46
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	SIGMAR1	37	52
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	SSTR5	71	42
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	CCR1	15	40
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	CCR3	56	53
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	UTS2R	26	49
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	CCR2	24	45
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	EPHX2	31	41
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	PDK1	50	38
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	CXCR3	39	42
COC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744657	FE	On-Demand	Anodyne	MCHR1	54	58
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	DRD2	21	53
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	DRD4	48	53
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	ACHE	18	49
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	DRD3	18	53
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	HTR4	73	43
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	CHRM3	17	46
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	SIGMAR1	37	52
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	SSTR5	71	42
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	CCR1	15	40
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	CCR3	56	53
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	UTS2R	26	49
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	CCR2	24	45
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	EPHX2	31	41
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	PDK1	50	38
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	CXCR3	39	42
COC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1Cl	ZINC000450744658	FE	On-Demand	Anodyne	MCHR1	54	58
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450744659	FJ	On-Demand	Anodyne	TRPC6	50	38
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450744659	FJ	On-Demand	Anodyne	TRPC3	40	38
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450744660	FJ	On-Demand	Anodyne	TRPC6	50	38
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450744660	FJ	On-Demand	Anodyne	TRPC3	40	38
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450744661	FJ	On-Demand	Anodyne	TRPC6	50	38
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450744661	FJ	On-Demand	Anodyne	TRPC3	40	38
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450744662	FJ	On-Demand	Anodyne	TRPC6	50	38
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450744662	FJ	On-Demand	Anodyne	TRPC3	40	38
COC(=O)CN(CCc1ccccc1)C(=O)c1ccc(N2CCC2)nc1	ZINC000450744666	FE	On-Demand	Anodyne	ACKR3	65	34
Cc1cc(F)c(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)cc1F	ZINC000450744668	EE	On-Demand	Anodyne	P2RX7	26	40
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	DRD2	21	43
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	DRD4	28	43
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	HRH2	16	45
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	HTR2A	22	44
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	HTR2C	21	45
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	SIGMAR1	22	45
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	HDAC8	18	40
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	UTS2R	18	43
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	EPHX2	23	44
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744669	GF	On-Demand	Anodyne	CYP2J2	57	40
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	DRD2	21	43
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	DRD4	28	43
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	HRH2	16	45
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	HTR2A	22	44
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	HTR2C	21	45
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	SIGMAR1	22	45
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	HDAC8	18	40
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	UTS2R	18	43
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	EPHX2	23	44
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450744670	GF	On-Demand	Anodyne	CYP2J2	57	40
CCN(C)C(=O)CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450744671	FD	On-Demand	Anodyne	TRPC6	61	34
CCN(C)C(=O)CNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450744671	FD	On-Demand	Anodyne	TRPC3	47	34
CCC(=O)CCCN1CCN(c2cc(OC)ncn2)CC1	ZINC000450744676	CD	On-Demand	Anodyne	DRD3	40	34
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000450744677	FD	On-Demand	Bother	SSTR1	29	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000450744677	FD	On-Demand	Bother	SSTR3	40	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000450744678	FD	On-Demand	Bother	SSTR1	29	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000450744678	FD	On-Demand	Bother	SSTR3	40	41
Cc1cccc(Cl)c1CN1CCC[C@@H](S(C)(=O)=O)C1	ZINC000450744685	DF	On-Demand	Anodyne	SLC6A1	51	39
Cc1cccc(Cl)c1CN1CCC[C@H](S(C)(=O)=O)C1	ZINC000450744686	DF	On-Demand	Anodyne	SLC6A1	51	39
CSCCCCCNC(=O)[C@H]1CC1(F)F	ZINC000450744690	BE	On-Demand	Anodyne	DPEP1	16	42
CSCCCCCNC(=O)[C@@H]1CC1(F)F	ZINC000450744691	BE	On-Demand	Anodyne	DPEP1	16	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	ACE	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	SSTR2	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	OPRM1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	OPRD1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	GHRHR	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MME	27	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	EDNRB	55	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	TACR1	33	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MC4R	47	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	TACR2	26	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	CCKAR	107	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	BCHE	19	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	BRS3	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	NMBR	45	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MC3R	62	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MC5R	61	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MMP2	26	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MMP8	33	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	GRPR	75	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	ECE1	63	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MMP11	90	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	CCKBR	75	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	GHSR	77	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MMP9	25	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MC1R	96	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	MMP1	18	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	NPR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	SLC15A2	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	KISS1R	75	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	ERAP2	44	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn(C)c2c1CCCC2	ZINC000450744692	GE	On-Demand	Anodyne	ERAP1	0	40
COC(=O)c1ccc(CN2CCN(c3cccc(C#N)n3)CC2)cc1Cl	ZINC000450744693	FF	On-Demand	Mild	DRD4	42	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	GHRHR	31	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MME	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	EDNRB	55	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	TACR1	26	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MC4R	40	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	TACR2	23	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	CCKAR	96	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	CTSL	29	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	BRS3	26	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	NMBR	47	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MC3R	53	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MC5R	59	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MMP2	23	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MMP8	38	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MMP14	23	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	GRPR	75	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	ECE1	59	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	SSTR3	26	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MMP11	73	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	CCKBR	72	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	GHSR	86	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MMP9	23	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MC1R	74	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	ADAM9	41	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	AKT1	44	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	MMP1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	NPR	32	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	SSSIM	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	KISS1R	64	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1ccc(C)n1	ZINC000450744707	ED	On-Demand	Anodyne	ERAP2	44	38
COc1cc(N2CCN(Cc3cn(CC4CC4)nn3)CC2)ncn1	ZINC000450744714	EC	On-Demand	Anodyne	ADRB1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	ACE	21	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	SSTR2	54	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	OPRM1	18	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	OPRD1	22	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	GHRHR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MME	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	EDNRB	57	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	EDNRA	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	TACR1	35	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MC4R	44	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	BMP1	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	TACR2	33	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	CCKAR	122	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	CTSL	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	BRS3	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	NMBR	39	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MC3R	64	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MC5R	68	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MMP2	26	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MMP14	83	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	GRPR	54	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	ECE1	63	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MMP11	77	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	CCKBR	88	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	GHSR	72	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MMP9	24	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	MC1R	87	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	NPR	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	SLC15A2	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	KISS1R	63	31
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	ERAP2	42	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450744727	GF	On-Demand	Anodyne	LASB	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	ACE	21	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	SSTR2	54	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	OPRM1	18	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	OPRD1	22	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	GHRHR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MME	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	EDNRB	57	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	EDNRA	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	TACR1	35	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MC4R	44	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	BMP1	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	TACR2	33	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	CCKAR	122	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	CTSL	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	BRS3	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	NMBR	39	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MC3R	64	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MC5R	68	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MMP2	26	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MMP14	83	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	GRPR	54	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	ECE1	63	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MMP11	77	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	CCKBR	88	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	GHSR	72	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MMP9	24	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	MC1R	87	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	NPR	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	SLC15A2	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	KISS1R	63	31
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	ERAP2	42	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450744728	GF	On-Demand	Anodyne	LASB	0	40
CCNC(=O)c1ccc(N2CC[C@@H](OCC)[C@@H](C)C2)nc1	ZINC000450744740	CE	On-Demand	Anodyne	HDAC1	0	42
CCNC(=O)c1ccc(N2CC[C@H](OCC)[C@@H](C)C2)nc1	ZINC000450744741	CE	On-Demand	Anodyne	HDAC1	0	42
CCNC(=O)c1ccc(N2CC[C@H](OCC)[C@H](C)C2)nc1	ZINC000450744742	CE	On-Demand	Anodyne	HDAC1	0	42
CCNC(=O)c1ccc(N2CC[C@@H](OCC)[C@H](C)C2)nc1	ZINC000450744743	CE	On-Demand	Anodyne	HDAC1	0	42
CCO[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C[C@H]1C	ZINC000450744748	DI	On-Demand	Anodyne	CXCR3	20	41
Cc1ccc(F)c(CC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450744783	DG	On-Demand	Anodyne	PLD1	49	38
Cc1ccc(F)c(CC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450744784	DG	On-Demand	Anodyne	PLD1	49	38
CCO[C@@H]1CCN(c2cc(OC)ncn2)C[C@H]1C	ZINC000450744805	CD	On-Demand	Anodyne	PDE3A	42	36
CCO[C@H]1CCN(c2cc(OC)ncn2)C[C@H]1C	ZINC000450744806	CD	On-Demand	Anodyne	PDE3A	42	36
CCO[C@H]1CCN(c2cc(OC)ncn2)C[C@@H]1C	ZINC000450744807	CD	On-Demand	Anodyne	PDE3A	42	36
CCO[C@@H]1CCN(c2cc(OC)ncn2)C[C@@H]1C	ZINC000450744808	CD	On-Demand	Anodyne	PDE3A	42	36
CSCCCCCNC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450744852	CH	On-Demand	Anodyne	DPEP1	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	ACE	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	SSTR2	99	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	OPRM1	23	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	OPRD1	23	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	GHRHR	32	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	P2RY12	43	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MME	30	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	EDNRB	52	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	EDNRA	46	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	TACR1	46	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MC4R	52	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	BMP1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	TACR2	55	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	SSTR5	22	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	CTSB	15	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	CCKAR	140	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	NTSR1	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	CTSL	33	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	BRS3	28	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	NMBR	53	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MC3R	69	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MC5R	74	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MMP2	30	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MMP8	37	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MMP14	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	GRPR	78	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	ECE1	69	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	LNPEP	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	SSTR3	42	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MMP11	107	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	CCKBR	120	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	GHSR	83	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	CAPN1	15	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MMP9	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MC1R	103	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	C5AR1	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	NPR	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	SLC15A2	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	KISS1R	73	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	ERAP2	46	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	LASB	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	NRDE	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450744855	GF	On-Demand	Anodyne	IL1RN	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	ACE	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	SSTR2	99	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	OPRM1	23	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	OPRD1	23	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	GHRHR	32	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	P2RY12	43	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MME	30	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	EDNRB	52	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	EDNRA	46	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	TACR1	46	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MC4R	52	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	BMP1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	TACR2	55	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	SSTR5	22	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	CTSB	15	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	CCKAR	140	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	NTSR1	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	CTSL	33	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	BRS3	28	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	NMBR	53	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MC3R	69	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MC5R	74	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MMP2	30	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MMP8	37	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MMP14	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	GRPR	78	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	ECE1	69	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	LNPEP	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	SSTR3	42	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MMP11	107	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	CCKBR	120	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	GHSR	83	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	CAPN1	15	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MMP9	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MC1R	103	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	C5AR1	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	NPR	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	SLC15A2	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	KISS1R	73	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	ERAP2	46	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	LASB	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	NRDE	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450744856	GF	On-Demand	Anodyne	IL1RN	0	40
CO[C@@H](Cc1ccccc1)C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450744857	ED	On-Demand	Anodyne	AMP1_PLAFQ	42	35
CO[C@H](Cc1ccccc1)C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450744858	ED	On-Demand	Anodyne	AMP1_PLAFQ	42	35
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccccn3)C2)CC1	ZINC000450744864	DD	On-Demand	Anodyne	DRD4	31	42
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccccn3)C2)CC1	ZINC000450744864	DD	On-Demand	Anodyne	EBP	25	43
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccccn3)C2)CC1	ZINC000450744865	DD	On-Demand	Anodyne	DRD4	31	42
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccccn3)C2)CC1	ZINC000450744865	DD	On-Demand	Anodyne	EBP	25	43
Clc1ccc(CCSc2nnnn2C[C@H]2CCCO2)cc1	ZINC000450744881	DF	On-Demand	Anodyne	PDE8B	45	34
Clc1ccc(CCSc2nnnn2C[C@@H]2CCCO2)cc1	ZINC000450744882	DF	On-Demand	Anodyne	PDE8B	45	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	ACE	21	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	SSTR2	72	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	OPRM1	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	OPRD1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MME	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	EDNRB	51	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	EDNRA	44	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	TACR1	30	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MC4R	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	TACR2	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	CCKAR	106	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	BRS3	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	TIMP3	25	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MC3R	56	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MC5R	57	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MMP2	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MMP8	35	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	GRPR	71	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	ECE1	61	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	SSTR3	37	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MMP11	71	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	CCKBR	85	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	GHSR	77	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MMP9	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MC1R	80	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	SLC15A2	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	KISS1R	62	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	ERAP2	44	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	LASB	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450744883	FG	On-Demand	Anodyne	NRDE	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	ACE	21	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	SSTR2	72	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	OPRM1	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	OPRD1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MME	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	EDNRB	51	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	EDNRA	44	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	TACR1	30	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MC4R	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	TACR2	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	CCKAR	106	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	BRS3	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	TIMP3	25	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MC3R	56	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MC5R	57	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MMP2	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MMP8	35	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	GRPR	71	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	ECE1	61	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	SSTR3	37	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MMP11	71	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	CCKBR	85	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	GHSR	77	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MMP9	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MC1R	80	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	SLC15A2	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	KISS1R	62	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	ERAP2	44	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	LASB	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450744884	FG	On-Demand	Anodyne	NRDE	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	ACE	21	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	SSTR2	72	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	OPRM1	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	OPRD1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MME	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	EDNRB	51	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	EDNRA	44	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	TACR1	30	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MC4R	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	TACR2	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	CCKAR	106	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	BRS3	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	TIMP3	25	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MC3R	56	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MC5R	57	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MMP2	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MMP8	35	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	GRPR	71	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	ECE1	61	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	SSTR3	37	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MMP11	71	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	CCKBR	85	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	GHSR	77	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MMP9	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MC1R	80	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	SLC15A2	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	KISS1R	62	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	ERAP2	44	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	LASB	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450744885	FG	On-Demand	Anodyne	NRDE	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	ACE	21	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	SSTR2	72	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	OPRM1	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	OPRD1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MME	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	EDNRB	51	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	EDNRA	44	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	TACR1	30	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MC4R	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	TACR2	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	CCKAR	106	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	BRS3	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	TIMP3	25	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MC3R	56	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MC5R	57	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MMP2	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MMP8	35	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	GRPR	71	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	ECE1	61	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	SSTR3	37	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MMP11	71	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	CCKBR	85	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	GHSR	77	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MMP9	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MC1R	80	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	SLC15A2	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	KISS1R	62	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	ERAP2	44	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	LASB	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450744886	FG	On-Demand	Anodyne	NRDE	0	40
CCCc1nc(C)c(CSc2nnnn2C[C@H]2CCCO2)o1	ZINC000450744887	DE	On-Demand	Anodyne	PDE8B	45	36
CCCc1nc(C)c(CSc2nnnn2C[C@@H]2CCCO2)o1	ZINC000450744888	DE	On-Demand	Anodyne	PDE8B	45	36
CC1(CO)CCN(Cc2cc(Cl)cc(CN3CCC(C)(CO)CC3)c2)CC1	ZINC000450744901	GH	On-Demand	Anodyne	SIGMAR1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	SSTR2	25	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	OPRM1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	OPRD1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MME	23	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	EDNRB	53	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	EDNRA	34	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	TACR1	48	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MC4R	43	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	BMP1	28	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	TACR2	26	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	CCKAR	91	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	CTSL	30	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	BRS3	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	NMBR	40	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MC3R	57	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MC5R	63	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MMP2	22	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MMP14	23	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	GRPR	90	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	ECE1	56	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MMP11	75	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	CCKBR	62	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	GHSR	80	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MMP9	23	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MC1R	80	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	AKT1	52	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	MMP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	NPR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	HDA106	0	66
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	SLC15A2	0	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	KISS1R	66	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	ERAP2	43	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCc1ncc(C)o1	ZINC000450744903	FF	On-Demand	Anodyne	LASB	0	43
Cc1cc(C(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)nn1C(C)C	ZINC000450744905	GI	On-Demand	Anodyne	NPY5R	18	48
Cc1cc(C(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)nn1C(C)C	ZINC000450744905	GI	On-Demand	Anodyne	MST1R	47	37
CCc1cccc(C(=O)NCCCCCSC)n1	ZINC000450744909	CF	On-Demand	Anodyne	PDE5A	22	46
N#Cc1cccc(N2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450744914	EF	On-Demand	Mild	DRD1	0	40
N#Cc1cccc(N2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450744914	EF	On-Demand	Mild	DRD4	32	40
N#Cc1cccc(N2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450744914	EF	On-Demand	Mild	ABCC1	40	34
N#Cc1cccc(N2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450744914	EF	On-Demand	Mild	KCNJ1	50	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	SSTR2	45	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	GHRHR	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MME	24	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	EDNRB	54	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	EDNRA	40	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	TACR1	26	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MC4R	40	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	BMP1	30	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	TACR2	26	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	CCKAR	97	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	CTSL	30	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	BRS3	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	NMBR	48	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MC3R	52	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MC5R	57	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MMP2	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MMP8	36	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MMP14	24	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	GRPR	81	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	ECE1	60	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	LNPEP	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	SSTR3	26	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MMP11	76	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	CCKBR	61	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	GHSR	80	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MMP9	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	AKT1	46	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MMP7	33	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MMP1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	NPR	33	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	MAGI3	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	SLC15A2	0	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	KISS1R	69	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	ERAP2	47	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	ERAP1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	LASB	0	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450744927	FF	On-Demand	Anodyne	IL1RN	0	41
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450744941	FH	On-Demand	Anodyne	PRNP	55	40
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450744941	FH	On-Demand	Anodyne	HDAC1	30	45
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450744941	FH	On-Demand	Anodyne	P4HTM	0	47
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450744941	FH	On-Demand	Anodyne	DGAT1	41	41
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450744942	FH	On-Demand	Anodyne	PRNP	55	40
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450744942	FH	On-Demand	Anodyne	HDAC1	30	45
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450744942	FH	On-Demand	Anodyne	P4HTM	0	47
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450744942	FH	On-Demand	Anodyne	DGAT1	41	41
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450744943	FH	On-Demand	Anodyne	PRNP	55	40
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450744943	FH	On-Demand	Anodyne	HDAC1	30	45
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450744943	FH	On-Demand	Anodyne	P4HTM	0	47
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450744943	FH	On-Demand	Anodyne	DGAT1	41	41
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450744944	FH	On-Demand	Anodyne	PRNP	55	40
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450744944	FH	On-Demand	Anodyne	HDAC1	30	45
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450744944	FH	On-Demand	Anodyne	P4HTM	0	47
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450744944	FH	On-Demand	Anodyne	DGAT1	41	41
Cc1nccc(N2CCN(Cc3cc(Br)ccc3C)CC2)n1	ZINC000450744957	FG	On-Demand	Anodyne	SORD	55	42
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C[C@H]1CCCO1	ZINC000450744958	CE	On-Demand	Anodyne	OXTR	27	43
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C[C@H]1CCCO1	ZINC000450744958	CE	On-Demand	Anodyne	AVPR1A	0	41
C[C@@H](c1ccccc1)[C@H](O)CN(C)C[C@H]1CCCO1	ZINC000450744959	CE	On-Demand	Anodyne	OXTR	27	43
C[C@@H](c1ccccc1)[C@H](O)CN(C)C[C@H]1CCCO1	ZINC000450744959	CE	On-Demand	Anodyne	AVPR1A	0	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCc1ccc2ccccc2c1O	ZINC000450744966	FJ	On-Demand	Anodyne	PREP	43	37
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCc1ccc2ccccc2c1O	ZINC000450744970	FJ	On-Demand	Anodyne	PREP	43	37
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCc1ccc2ccccc2c1O	ZINC000450744972	FJ	On-Demand	Anodyne	PREP	43	37
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCc1ccc2ccccc2c1O	ZINC000450744973	FJ	On-Demand	Anodyne	PREP	43	37
COC(=O)c1cccc(CN2CCN(c3cc(OC)ncn3)CC2)c1Cl	ZINC000450744975	GE	On-Demand	Anodyne	DRD4	44	34
COC(=O)c1cccc(CN2CCN(c3cc(OC)ncn3)CC2)c1Cl	ZINC000450744975	GE	On-Demand	Anodyne	DRD3	28	40
COC(=O)c1cccc(CN2CCN(c3cc(OC)ncn3)CC2)c1Cl	ZINC000450744975	GE	On-Demand	Anodyne	MT-CYB	42	31
Cc1cccc(Cl)c1CSc1nnnn1C[C@H]1CCCO1	ZINC000450744980	DG	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(Cl)c1CSc1nnnn1C[C@@H]1CCCO1	ZINC000450744981	DG	On-Demand	Anodyne	PDE8B	41	36
COC(=O)c1cn(C2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)nn1	ZINC000450744984	FD	On-Demand	Anodyne	PLD1	44	34
COC(=O)c1cn(C2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)nn1	ZINC000450744985	FD	On-Demand	Anodyne	PLD1	44	34
COC(=O)c1cn(C2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)nn1	ZINC000450744987	FD	On-Demand	Anodyne	PLD1	44	34
COC(=O)c1cn(C2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)nn1	ZINC000450744988	FD	On-Demand	Anodyne	PLD1	44	34
COc1cc(CC(=O)N[C@@H](C)CN2CCCCCC2)ccc1O	ZINC000450744989	DE	On-Demand	Anodyne	ABCC8	23	48
COc1cc(CC(=O)N[C@@H](C)CN2CCCCCC2)ccc1O	ZINC000450744989	DE	On-Demand	Anodyne	NCE103	25	45
COc1cc(CC(=O)N[C@@H](C)CN2CCCCCC2)ccc1O	ZINC000450744989	DE	On-Demand	Anodyne	CAN2	0	45
COc1cc(CC(=O)N[C@H](C)CN2CCCCCC2)ccc1O	ZINC000450744990	DE	On-Demand	Anodyne	ABCC8	23	48
COc1cc(CC(=O)N[C@H](C)CN2CCCCCC2)ccc1O	ZINC000450744990	DE	On-Demand	Anodyne	NCE103	25	45
COc1cc(CC(=O)N[C@H](C)CN2CCCCCC2)ccc1O	ZINC000450744990	DE	On-Demand	Anodyne	CAN2	0	45
CCS(=O)(=O)c1ccc(CN2C[C@H](C)C[C@H]2c2cccnc2)cc1	ZINC000450745034	EG	On-Demand	Anodyne	NAMPT	43	38
Cc1ccc(Br)cc1CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450745035	FF	On-Demand	Anodyne	DRD4	24	47
Cc1ccc(Br)cc1CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450745035	FF	On-Demand	Anodyne	DRD3	0	45
Cc1ccc(Br)cc1CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450745035	FF	On-Demand	Anodyne	SIGMAR1	23	47
Cc1ccc(Br)cc1CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450745035	FF	On-Demand	Anodyne	MCHR1	28	43
CCS(=O)(=O)c1ccc(CN2C[C@H](C)C[C@@H]2c2cccnc2)cc1	ZINC000450745036	EG	On-Demand	Anodyne	NAMPT	43	38
CCS(=O)(=O)c1ccc(CN2C[C@@H](C)C[C@@H]2c2cccnc2)cc1	ZINC000450745037	EG	On-Demand	Anodyne	NAMPT	43	38
CCS(=O)(=O)c1ccc(CN2C[C@@H](C)C[C@H]2c2cccnc2)cc1	ZINC000450745038	EG	On-Demand	Anodyne	NAMPT	43	38
Cc1ccc(Br)cc1CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450745043	FF	On-Demand	Anodyne	DRD4	24	47
Cc1ccc(Br)cc1CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450745043	FF	On-Demand	Anodyne	DRD3	0	45
Cc1ccc(Br)cc1CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450745043	FF	On-Demand	Anodyne	SIGMAR1	23	47
Cc1ccc(Br)cc1CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450745043	FF	On-Demand	Anodyne	MCHR1	28	43
Cc1nccc(N2CCN(CC34CCC(CC3)C4)CC2)n1	ZINC000450745044	CE	On-Demand	Anodyne	SORD	46	37
CS(=O)(=O)[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450745047	CF	On-Demand	Anodyne	SLC6A1	93	41
CS(=O)(=O)[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450745048	CF	On-Demand	Anodyne	SLC6A1	93	41
CS(=O)(=O)[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450745050	CF	On-Demand	Anodyne	SLC6A1	93	41
CS(=O)(=O)[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450745052	CF	On-Demand	Anodyne	SLC6A1	93	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450745066	FH	On-Demand	Anodyne	FKBP1A	32	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450745066	FH	On-Demand	Anodyne	PREP	59	36
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450745067	FH	On-Demand	Anodyne	FKBP1A	32	41
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450745067	FH	On-Demand	Anodyne	PREP	59	36
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450745068	FH	On-Demand	Anodyne	FKBP1A	32	41
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450745068	FH	On-Demand	Anodyne	PREP	59	36
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450745070	FH	On-Demand	Anodyne	FKBP1A	32	41
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450745070	FH	On-Demand	Anodyne	PREP	59	36
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745072	EH	On-Demand	Anodyne	ELANE	40	38
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745072	EH	On-Demand	Anodyne	LGMN	56	34
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745072	EH	On-Demand	Anodyne	FAP	0	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745074	EH	On-Demand	Anodyne	ELANE	40	38
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745074	EH	On-Demand	Anodyne	LGMN	56	34
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745074	EH	On-Demand	Anodyne	FAP	0	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745076	EH	On-Demand	Anodyne	ELANE	40	38
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745076	EH	On-Demand	Anodyne	LGMN	56	34
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745076	EH	On-Demand	Anodyne	FAP	0	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745078	EH	On-Demand	Anodyne	ELANE	40	38
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745078	EH	On-Demand	Anodyne	LGMN	56	34
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745078	EH	On-Demand	Anodyne	FAP	0	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	ACE	20	45
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	SSTR2	26	41
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	GNRHR	0	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	OPRM1	0	45
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	OPRD1	0	45
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	GHRHR	31	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MME	28	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	EDNRB	60	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	EDNRA	34	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	TACR1	36	55
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MC4R	52	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	BMP1	33	44
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	TACR2	24	48
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	CCKAR	122	49
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	CTSL	30	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	CCR3	0	62
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	BRS3	29	46
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	NMBR	27	45
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MC3R	70	39
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MC5R	67	38
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MMP2	29	51
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MMP8	37	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MMP14	27	41
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	GRPR	77	39
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	ECE1	67	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	LNPEP	31	46
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MMP11	107	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	CCKBR	82	41
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	GHSR	80	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MMP9	27	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MC1R	99	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	AKT1	45	35
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	MMP1	20	42
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	NPR	32	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	SLC15A2	0	48
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	KISS1R	81	38
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	ERAP2	59	46
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	PSMB8	46	35
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	ERAP1	0	46
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	LASB	0	44
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)on1	ZINC000450745086	GD	On-Demand	Anodyne	IL1RN	0	46
CC(=O)c1ccc(CN2CCO[C@@H](CCc3ccccc3)C2)cc1	ZINC000450745089	DH	On-Demand	Anodyne	DRD4	53	77
CC(=O)c1ccc(CN2CCO[C@@H](CCc3ccccc3)C2)cc1	ZINC000450745089	DH	On-Demand	Anodyne	ACHE	33	48
CC(=O)c1ccc(CN2CCO[C@@H](CCc3ccccc3)C2)cc1	ZINC000450745089	DH	On-Demand	Anodyne	DRD3	0	70
CC(=O)c1ccc(CN2CCO[C@@H](CCc3ccccc3)C2)cc1	ZINC000450745089	DH	On-Demand	Anodyne	PTGER4	40	31
CC(=O)c1ccc(CN2CCO[C@@H](CCc3ccccc3)C2)cc1	ZINC000450745089	DH	On-Demand	Anodyne	SIGMAR1	60	40
CC(=O)c1ccc(CN2CCO[C@H](CCc3ccccc3)C2)cc1	ZINC000450745091	DH	On-Demand	Anodyne	DRD4	53	77
CC(=O)c1ccc(CN2CCO[C@H](CCc3ccccc3)C2)cc1	ZINC000450745091	DH	On-Demand	Anodyne	ACHE	33	48
CC(=O)c1ccc(CN2CCO[C@H](CCc3ccccc3)C2)cc1	ZINC000450745091	DH	On-Demand	Anodyne	DRD3	0	70
CC(=O)c1ccc(CN2CCO[C@H](CCc3ccccc3)C2)cc1	ZINC000450745091	DH	On-Demand	Anodyne	PTGER4	40	31
CC(=O)c1ccc(CN2CCO[C@H](CCc3ccccc3)C2)cc1	ZINC000450745091	DH	On-Demand	Anodyne	SIGMAR1	60	40
COC(=O)C1(CN2CCCC[C@H]2c2ccccc2)CC1	ZINC000450745110	CG	On-Demand	Anodyne	COLA	87	36
COC(=O)C1(CN2CCCC[C@H]2c2ccccc2)CC1	ZINC000450745110	CG	On-Demand	Anodyne	CPT1A	80	36
COC(=O)C1(CN2CCCC[C@H]2c2ccccc2)CC1	ZINC000450745110	CG	On-Demand	Anodyne	SLC12A5	50	37
COC(=O)C1(CN2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450745111	CG	On-Demand	Anodyne	COLA	87	36
COC(=O)C1(CN2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450745111	CG	On-Demand	Anodyne	CPT1A	80	36
COC(=O)C1(CN2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450745111	CG	On-Demand	Anodyne	SLC12A5	50	37
COC(=O)c1cn([C@@H]2CCCN(Cc3c(C)cccc3Cl)C2)nn1	ZINC000450745112	EF	On-Demand	Anodyne	SLC6A1	54	36
COC(=O)c1cn([C@H]2CCCN(Cc3c(C)cccc3Cl)C2)nn1	ZINC000450745113	EF	On-Demand	Anodyne	SLC6A1	54	36
CC(C)CCCC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000450745114	EJ	On-Demand	Anodyne	MST1R	45	36
C(=C/c1ccccc1)\CCSc1nnnn1C[C@H]1CCCO1	ZINC000450745126	DG	On-Demand	Anodyne	PDE8B	41	38
C(=C\c1ccccc1)\CCSc1nnnn1C[C@H]1CCCO1	ZINC000450745127	DG	On-Demand	Anodyne	PDE8B	41	38
C(=C\c1ccccc1)\CCSc1nnnn1C[C@@H]1CCCO1	ZINC000450745128	DG	On-Demand	Anodyne	PDE8B	41	38
C(=C/c1ccccc1)\CCSc1nnnn1C[C@@H]1CCCO1	ZINC000450745129	DG	On-Demand	Anodyne	PDE8B	41	38
COc1cccc(OCCC(=O)N[C@H]2CN(c3ccc(F)cc3)C2=O)c1	ZINC000450745134	FE	On-Demand	Anodyne	MTNR1A	22	41
COc1cccc(OCCC(=O)N[C@H]2CN(c3ccc(F)cc3)C2=O)c1	ZINC000450745134	FE	On-Demand	Anodyne	MTNR1B	26	44
COc1cccc(OCCC(=O)N[C@@H]2CN(c3ccc(F)cc3)C2=O)c1	ZINC000450745135	FE	On-Demand	Anodyne	MTNR1A	22	41
COc1cccc(OCCC(=O)N[C@@H]2CN(c3ccc(F)cc3)C2=O)c1	ZINC000450745135	FE	On-Demand	Anodyne	MTNR1B	26	44
CCc1cccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)n1	ZINC000450745147	DG	On-Demand	Anodyne	TRPC6	46	36
CCc1cccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)n1	ZINC000450745148	DG	On-Demand	Anodyne	TRPC6	46	36
CCc1cccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)n1	ZINC000450745149	DG	On-Demand	Anodyne	TRPC6	46	36
CCc1cccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)n1	ZINC000450745150	DG	On-Demand	Anodyne	TRPC6	46	36
COC(=O)c1cn([C@H]2CCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450745155	ED	On-Demand	Anodyne	DRD4	0	43
COC(=O)c1cn([C@H]2CCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450745155	ED	On-Demand	Anodyne	SLC6A1	56	35
COC(=O)c1cn([C@H]2CCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450745155	ED	On-Demand	Anodyne	CYP2J2	59	43
COC(=O)c1cn([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450745156	ED	On-Demand	Anodyne	DRD4	0	43
COC(=O)c1cn([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450745156	ED	On-Demand	Anodyne	SLC6A1	56	35
COC(=O)c1cn([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450745156	ED	On-Demand	Anodyne	CYP2J2	59	43
COc1cc(CN2CCC(C)(CO)CC2)ccc1Cl	ZINC000450745157	CF	On-Demand	Anodyne	SIGMAR1	36	43
COc1cc(CN2CCC(C)(CO)CC2)ccc1Cl	ZINC000450745157	CF	On-Demand	Anodyne	SSTR5	41	36
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccsc1Br	ZINC000450745160	FI	On-Demand	Anodyne	TRPC6	48	36
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccsc1Br	ZINC000450745161	FI	On-Demand	Anodyne	TRPC6	48	36
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccsc1Br	ZINC000450745162	FI	On-Demand	Anodyne	TRPC6	48	36
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccsc1Br	ZINC000450745163	FI	On-Demand	Anodyne	TRPC6	48	36
CC[C@@H]1CCC[C@H]1C(=O)NCCCCCSC	ZINC000450745164	CG	On-Demand	Anodyne	TPP2	19	41
CC[C@@H]1CCC[C@@H]1C(=O)NCCCCCSC	ZINC000450745165	CG	On-Demand	Anodyne	TPP2	19	41
CC[C@H]1CCC[C@H]1C(=O)NCCCCCSC	ZINC000450745166	CG	On-Demand	Anodyne	TPP2	19	41
CC[C@H]1CCC[C@@H]1C(=O)NCCCCCSC	ZINC000450745167	CG	On-Demand	Anodyne	TPP2	19	41
CCc1cccc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)n1	ZINC000450745187	FF	On-Demand	Anodyne	SCN9A	22	45
CCO[C@H]1CCN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1C	ZINC000450745194	EF	On-Demand	Anodyne	PDE3A	58	47
CCO[C@H]1CCN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1C	ZINC000450745194	EF	On-Demand	Anodyne	PDE3B	85	47
CCO[C@@H]1CCN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1C	ZINC000450745196	EF	On-Demand	Anodyne	PDE3A	58	47
CCO[C@@H]1CCN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1C	ZINC000450745196	EF	On-Demand	Anodyne	PDE3B	85	47
CCO[C@@H]1CCN(c2ncnc3c(OC)cc(OC)cc23)C[C@@H]1C	ZINC000450745198	EF	On-Demand	Anodyne	PDE3A	58	47
CCO[C@@H]1CCN(c2ncnc3c(OC)cc(OC)cc23)C[C@@H]1C	ZINC000450745198	EF	On-Demand	Anodyne	PDE3B	85	47
CCO[C@H]1CCN(c2ncnc3c(OC)cc(OC)cc23)C[C@@H]1C	ZINC000450745200	EF	On-Demand	Anodyne	PDE3A	58	47
CCO[C@H]1CCN(c2ncnc3c(OC)cc(OC)cc23)C[C@@H]1C	ZINC000450745200	EF	On-Demand	Anodyne	PDE3B	85	47
C[C@H](OCCc1ccccc1)C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450745201	EE	On-Demand	Anodyne	TRPV1	27	43
C[C@@H](OCCc1ccccc1)C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450745209	EE	On-Demand	Anodyne	TRPV1	27	43
CCO[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@H]1C	ZINC000450745210	DF	On-Demand	Bother	PDE3A	43	35
CCO[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@H]1C	ZINC000450745210	DF	On-Demand	Bother	PDE3B	65	35
CCO[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@@H]1C	ZINC000450745212	DF	On-Demand	Bother	PDE3A	43	35
CCO[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@@H]1C	ZINC000450745212	DF	On-Demand	Bother	PDE3B	65	35
CCO[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@H]1C	ZINC000450745214	DF	On-Demand	Bother	PDE3A	43	35
CCO[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@H]1C	ZINC000450745214	DF	On-Demand	Bother	PDE3B	65	35
CCO[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@@H]1C	ZINC000450745215	DF	On-Demand	Bother	PDE3A	43	35
CCO[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@@H]1C	ZINC000450745215	DF	On-Demand	Bother	PDE3B	65	35
CCO[C@@H]1CCN(c2cc(CC)nc3ccccc23)C[C@H]1C	ZINC000450745216	CI	On-Demand	Anodyne	METAP1	43	38
CCO[C@@H]1CCN(c2cc(CC)nc3ccccc23)C[C@@H]1C	ZINC000450745217	CI	On-Demand	Anodyne	METAP1	43	38
CCO[C@H]1CCN(c2cc(CC)nc3ccccc23)C[C@H]1C	ZINC000450745218	CI	On-Demand	Anodyne	METAP1	43	38
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	CACNA1H	23	44
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	DRD4	39	53
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	SIGMAR1	48	56
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	CCR1	25	41
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	CCR3	30	48
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	UTS2R	23	47
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	EPHX2	34	45
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	MCHR1	45	39
O=C(NC1CC1)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745219	DE	On-Demand	Anodyne	BIRC2	78	51
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	CACNA1H	23	44
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	DRD4	39	53
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	SIGMAR1	48	56
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	CCR1	25	41
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	CCR3	30	48
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	UTS2R	23	47
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	EPHX2	34	45
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	MCHR1	45	39
O=C(NC1CC1)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450745220	DE	On-Demand	Anodyne	BIRC2	78	51
CCO[C@H]1CCN(c2cc(CC)nc3ccccc23)C[C@@H]1C	ZINC000450745221	CI	On-Demand	Anodyne	METAP1	43	38
CCO[C@@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C[C@@H]1C	ZINC000450745241	EF	On-Demand	Anodyne	CREBBP	41	32
CCO[C@@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C[C@@H]1C	ZINC000450745241	EF	On-Demand	Anodyne	BRD9	53	34
CCO[C@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C[C@@H]1C	ZINC000450745242	EF	On-Demand	Anodyne	CREBBP	41	32
CCO[C@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C[C@@H]1C	ZINC000450745242	EF	On-Demand	Anodyne	BRD9	53	34
CCO[C@@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C[C@H]1C	ZINC000450745243	EF	On-Demand	Anodyne	CREBBP	41	32
CCO[C@@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C[C@H]1C	ZINC000450745243	EF	On-Demand	Anodyne	BRD9	53	34
CCO[C@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C[C@H]1C	ZINC000450745244	EF	On-Demand	Anodyne	CREBBP	41	32
CCO[C@H]1CCN(c2nn3c(C)nnc3c3ccccc23)C[C@H]1C	ZINC000450745244	EF	On-Demand	Anodyne	BRD9	53	34
CO[C@H]1COCC[C@H]1CC(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450745247	GE	On-Demand	Anodyne	SCN9A	0	41
CO[C@H]1COCC[C@@H]1CC(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450745249	GE	On-Demand	Anodyne	SCN9A	0	41
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450745250	FI	On-Demand	Anodyne	BMP1	0	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450745250	FI	On-Demand	Anodyne	SOAT1	28	45
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450745250	FI	On-Demand	Anodyne	CAPN2	29	42
CO[C@@H]1COCC[C@H]1CC(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450745251	GE	On-Demand	Anodyne	SCN9A	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450745252	FI	On-Demand	Anodyne	BMP1	0	42
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450745252	FI	On-Demand	Anodyne	SOAT1	28	45
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450745252	FI	On-Demand	Anodyne	CAPN2	29	42
CO[C@@H]1COCC[C@@H]1CC(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450745253	GE	On-Demand	Anodyne	SCN9A	0	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450745254	FI	On-Demand	Anodyne	BMP1	0	42
C[C@H](OCCc1ccccc1)C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450745254	FI	On-Demand	Anodyne	SOAT1	28	45
C[C@H](OCCc1ccccc1)C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450745254	FI	On-Demand	Anodyne	CAPN2	29	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450745256	FI	On-Demand	Anodyne	BMP1	0	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450745256	FI	On-Demand	Anodyne	SOAT1	28	45
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450745256	FI	On-Demand	Anodyne	CAPN2	29	42
CSCCCCCNC(=O)c1ccc(I)cc1F	ZINC000450745273	GH	On-Demand	Anodyne	FOLH1	18	42
Cn1cc(-c2ccc(C(=O)NCCc3ccc(OCC(F)(F)F)nc3)o2)cn1	ZINC000450745294	GF	On-Demand	Anodyne	SCN9A	0	42
Cc1ccc(C(=O)NCc2cccc(N3CCOCC3)n2)c(Cl)c1Cl	ZINC000450745296	GG	On-Demand	Anodyne	PIK3CB	60	39
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745316	DG	On-Demand	Anodyne	HCRTR1	33	41
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745316	DG	On-Demand	Anodyne	HCRTR2	38	41
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745318	DG	On-Demand	Anodyne	HCRTR1	33	41
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745318	DG	On-Demand	Anodyne	HCRTR2	38	41
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745320	DG	On-Demand	Anodyne	HCRTR1	33	41
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745320	DG	On-Demand	Anodyne	HCRTR2	38	41
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745322	DG	On-Demand	Anodyne	HCRTR1	33	41
C[C@H](Oc1ccccn1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745322	DG	On-Demand	Anodyne	HCRTR2	38	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	ACE	20	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	SSTR2	40	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	GHRHR	30	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MME	27	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	EDNRB	56	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	EDNRA	36	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	TACR1	36	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MC4R	49	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	TACR2	24	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	CCKAR	119	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	BRS3	30	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	NMBR	36	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MC3R	67	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MC5R	68	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MMP2	29	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MMP8	39	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	GRIA1	23	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MMP14	27	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	GRPR	78	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	ECE1	65	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	SSTR3	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MMP11	104	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	CCKBR	92	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	GHSR	84	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MMP9	28	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MC1R	97	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	ADAM9	41	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	AKT1	52	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	MMP1	21	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	NPR	32	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	SSSIM	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	SLC15A2	0	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	KISS1R	76	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	ERAP2	44	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cn(C)nc1C	ZINC000450745347	FD	On-Demand	Anodyne	LASB	0	46
COC(=O)c1cn([C@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)nn1	ZINC000450745352	EE	On-Demand	Anodyne	CCR3	34	40
COC(=O)c1cn([C@@H]2CCCN(Cc3cccc(C(C)=O)c3)C2)nn1	ZINC000450745353	EE	On-Demand	Anodyne	CCR3	34	40
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc4ccccc4n3)C2)CC1	ZINC000450745358	FG	On-Demand	Anodyne	HTR3A	38	49
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc4ccccc4n3)C2)CC1	ZINC000450745358	FG	On-Demand	Anodyne	PDE1B	0	47
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc4ccccc4n3)C2)CC1	ZINC000450745359	FG	On-Demand	Anodyne	HTR3A	38	49
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc4ccccc4n3)C2)CC1	ZINC000450745359	FG	On-Demand	Anodyne	PDE1B	0	47
CC(C)(C)C(=O)CCCC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000450745363	GJ	On-Demand	Anodyne	MST1R	41	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	HTR1A	23	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	ACE	22	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	TYR	15	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	SSTR2	29	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	ADRA1B	15	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	OPRM1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	OPRD1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	GHRHR	31	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MME	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	EDNRB	56	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	EDNRA	40	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	TACR1	37	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MC4R	47	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	TACR2	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	CCKAR	129	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	BRS3	28	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	NMBR	32	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MC3R	65	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MC5R	67	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MMP2	27	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MMP8	35	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MMP14	24	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	GRPR	71	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	ECE1	67	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MMP11	92	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	CCKBR	103	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	GHSR	74	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MMP9	26	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MC1R	95	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	MMP1	20	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	NPR	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	SLC15A2	0	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	KISS1R	75	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	ERAP2	45	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450745375	GF	On-Demand	Anodyne	LASB	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	HTR1A	23	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	ACE	22	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	TYR	15	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	SSTR2	29	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	ADRA1B	15	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	OPRM1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	OPRD1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	GHRHR	31	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MME	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	EDNRB	56	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	EDNRA	40	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	TACR1	37	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MC4R	47	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	TACR2	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	CCKAR	129	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	BRS3	28	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	NMBR	32	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MC3R	65	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MC5R	67	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MMP2	27	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MMP8	35	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MMP14	24	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	GRPR	71	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	ECE1	67	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MMP11	92	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	CCKBR	103	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	GHSR	74	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MMP9	26	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MC1R	95	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	MMP1	20	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	NPR	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	SLC15A2	0	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	KISS1R	75	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	ERAP2	45	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450745376	GF	On-Demand	Anodyne	LASB	0	44
COC(=O)c1ccc(C(=O)CSc2nnnn2C[C@H]2CCCO2)o1	ZINC000450745377	FD	On-Demand	Anodyne	PDE8B	58	37
COC(=O)c1ccc(C(=O)CSc2nnnn2C[C@@H]2CCCO2)o1	ZINC000450745378	FD	On-Demand	Anodyne	PDE8B	58	37
COC(=O)c1cn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745381	FF	On-Demand	Anodyne	DRD4	0	47
COC(=O)c1cn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745381	FF	On-Demand	Anodyne	SLC6A1	62	35
COC(=O)c1cn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745381	FF	On-Demand	Anodyne	CCR3	87	36
COC(=O)c1cn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745381	FF	On-Demand	Anodyne	HTR3B	0	41
COC(=O)c1cn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745381	FF	On-Demand	Anodyne	CYP2J2	48	35
COC(=O)c1cn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745382	FF	On-Demand	Anodyne	DRD4	0	47
COC(=O)c1cn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745382	FF	On-Demand	Anodyne	SLC6A1	62	35
COC(=O)c1cn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745382	FF	On-Demand	Anodyne	CCR3	87	36
COC(=O)c1cn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745382	FF	On-Demand	Anodyne	HTR3B	0	41
COC(=O)c1cn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450745382	FF	On-Demand	Anodyne	CYP2J2	48	35
Cc1nc(C)n(CCCC(=O)N[C@@H](Cc2ccccn2)c2ccccc2)n1	ZINC000450745388	FG	On-Demand	Anodyne	SOAT1	17	40
Cc1nc(C)n(CCCC(=O)N[C@H](Cc2ccccn2)c2ccccc2)n1	ZINC000450745389	FG	On-Demand	Anodyne	SOAT1	17	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	ACE	22	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	SSTR2	28	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	OPRM1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	OPRD1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	GHRHR	31	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MME	29	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	EDNRB	54	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	EDNRA	38	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	TACR1	26	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MC4R	44	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	BMP1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	TACR2	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	CCKAR	103	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	CTSL	28	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	BRS3	25	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	NMBR	46	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MC3R	56	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MC5R	61	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MMP2	23	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MMP14	23	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	GRPR	57	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	ECE1	65	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	LNPEP	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MMP11	76	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	CCKBR	72	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	GHSR	77	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MMP9	23	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	MMP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	SLC15A2	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	KISS1R	69	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	ERAP2	48	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	ERAP1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	LASB	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450745391	FF	On-Demand	Anodyne	IL1RN	0	42
CCOC(=O)c1ccc(CN2CCN(c3cc(OC)ncn3)CC2)nc1	ZINC000450745402	FD	On-Demand	Anodyne	P2RY12	32	43
CCOC(=O)c1ccc(CN2CCN(c3cccc(C#N)n3)CC2)nc1	ZINC000450745425	FD	On-Demand	Mild	P2RY12	55	45
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450745429	FJ	On-Demand	Anodyne	MAPK13	47	31
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450745429	FJ	On-Demand	Anodyne	TRPC6	45	32
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450745430	FJ	On-Demand	Anodyne	MAPK13	47	31
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450745430	FJ	On-Demand	Anodyne	TRPC6	45	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450745431	FJ	On-Demand	Anodyne	MAPK13	47	31
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450745431	FJ	On-Demand	Anodyne	TRPC6	45	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450745432	FJ	On-Demand	Anodyne	MAPK13	47	31
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450745432	FJ	On-Demand	Anodyne	TRPC6	45	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)OC)[C@@H]1Oc1ccccc1	ZINC000450745484	FF	On-Demand	Anodyne	TIMP3	63	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)OC)[C@H]1Oc1ccccc1	ZINC000450745485	FF	On-Demand	Anodyne	TIMP3	63	36
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)OC)[C@H]1Oc1ccccc1	ZINC000450745486	FF	On-Demand	Anodyne	TIMP3	63	36
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)OC)[C@@H]1Oc1ccccc1	ZINC000450745487	FF	On-Demand	Anodyne	TIMP3	63	36
COC(=O)c1ccc(CNC(C)(C)c2ccc(C)nc2)cc1Cl	ZINC000450745533	EH	On-Demand	Anodyne	PDE5A	18	40
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450745534	EF	On-Demand	Anodyne	TIMP3	40	31
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450745534	EF	On-Demand	Anodyne	PRNP	44	34
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450745534	EF	On-Demand	Anodyne	SCD1	53	51
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450745534	EF	On-Demand	Anodyne	SCD	37	40
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450745535	EF	On-Demand	Anodyne	TIMP3	40	31
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450745535	EF	On-Demand	Anodyne	PRNP	44	34
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450745535	EF	On-Demand	Anodyne	SCD1	53	51
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450745535	EF	On-Demand	Anodyne	SCD	37	40
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450745536	EF	On-Demand	Anodyne	TIMP3	40	31
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450745536	EF	On-Demand	Anodyne	PRNP	44	34
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450745536	EF	On-Demand	Anodyne	SCD1	53	51
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450745536	EF	On-Demand	Anodyne	SCD	37	40
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450745537	EF	On-Demand	Anodyne	TIMP3	40	31
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450745537	EF	On-Demand	Anodyne	PRNP	44	34
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450745537	EF	On-Demand	Anodyne	SCD1	53	51
CCO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450745537	EF	On-Demand	Anodyne	SCD	37	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1O	ZINC000450745547	CD	On-Demand	Anodyne	POL	0	52
CC(C)CCCC(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450745555	DE	On-Demand	Anodyne	PIK3CB	64	38
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450745556	GK	On-Demand	Anodyne	MC4R	31	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450745556	GK	On-Demand	Anodyne	PRCP	52	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450745557	GK	On-Demand	Anodyne	MC4R	31	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450745557	GK	On-Demand	Anodyne	PRCP	52	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450745558	GK	On-Demand	Anodyne	MC4R	31	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450745558	GK	On-Demand	Anodyne	PRCP	52	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450745559	GK	On-Demand	Anodyne	MC4R	31	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450745559	GK	On-Demand	Anodyne	PRCP	52	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450745562	GF	On-Demand	Anodyne	CXCR3	15	42
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450745562	GF	On-Demand	Anodyne	LIPG	42	35
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450745562	GF	On-Demand	Anodyne	ADAM33	0	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450745563	GF	On-Demand	Anodyne	CXCR3	15	42
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450745563	GF	On-Demand	Anodyne	LIPG	42	35
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(C(F)(F)F)cn3)C2)CC1	ZINC000450745563	GF	On-Demand	Anodyne	ADAM33	0	41
CC(F)(F)CCSc1nnnn1C[C@H]1CCCO1	ZINC000450745565	CD	On-Demand	Anodyne	PDE8B	41	42
CC(F)(F)CCSc1nnnn1C[C@@H]1CCCO1	ZINC000450745566	CD	On-Demand	Anodyne	PDE8B	41	42
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745576	GG	On-Demand	Anodyne	HTR1D	76	38
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745576	GG	On-Demand	Anodyne	HTR1B	65	38
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745576	GG	On-Demand	Anodyne	SLC6A1	40	31
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745576	GG	On-Demand	Anodyne	ADAM17	52	38
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745576	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	69	36
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745577	GG	On-Demand	Anodyne	HTR1D	76	38
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745577	GG	On-Demand	Anodyne	HTR1B	65	38
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745577	GG	On-Demand	Anodyne	SLC6A1	40	31
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745577	GG	On-Demand	Anodyne	ADAM17	52	38
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4ccccc34)C2)CC1	ZINC000450745577	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	69	36
CCC[C@@H](CC(C)C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450745597	EF	On-Demand	Anodyne	PIK3CB	44	32
CCC[C@H](CC(C)C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450745598	EF	On-Demand	Anodyne	PIK3CB	44	32
COc1cccc(-n2cc(C(=O)Nc3cccc(C(C)(C)C)c3O)nn2)c1	ZINC000450745604	FH	On-Demand	Anodyne	ESRRA	18	43
COc1cccc(-n2cc(C(=O)Nc3cccc(C(C)(C)C)c3O)nn2)c1	ZINC000450745604	FH	On-Demand	Anodyne	ABCG2	22	40
CC(C)(C(=O)NCc1nc(C(F)(F)F)n[nH]1)c1cccc2ccccc12	ZINC000450745611	FH	On-Demand	Anodyne	KCNJ11	42	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	ACE	22	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	SSTR2	56	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	OPRM1	17	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	OPRD1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	GHRHR	33	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MME	30	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	EDNRB	52	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	EDNRA	43	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	TACR1	37	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MC4R	50	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	BMP1	30	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	TACR2	39	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	CCKAR	136	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	CTSL	29	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	BRS3	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	TIMP3	20	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	NMBR	84	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MC3R	69	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MC5R	70	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MMP2	28	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MMP8	35	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MMP14	24	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	GRPR	100	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	ECE1	70	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	LNPEP	28	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	SSTR3	36	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MMP11	92	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	CCKBR	119	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	GHSR	77	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MMP9	27	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MC1R	101	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	AKT1	40	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	MMP1	20	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	SSSIM	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	SLC15A2	0	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	KISS1R	73	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	ERAP2	46	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	PSMB8	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	ERAP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	LASB	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450745631	GG	On-Demand	Anodyne	IL1RN	0	42
CCO[C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1C	ZINC000450745644	DH	On-Demand	Anodyne	GRM5	27	45
CCO[C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C[C@@H]1C	ZINC000450745645	DH	On-Demand	Anodyne	GRM5	27	45
CCO[C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1C	ZINC000450745646	DH	On-Demand	Anodyne	GRM5	27	45
CCO[C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C[C@@H]1C	ZINC000450745647	DH	On-Demand	Anodyne	GRM5	27	45
Cc1cccc(Cl)c1CN1CCN(c2ncc(F)cn2)CC1	ZINC000450745660	DF	On-Demand	Anodyne	DRD4	27	42
CCO[C@H]1CCN(c2ccc(C#N)cn2)C[C@@H]1C	ZINC000450745683	BE	On-Demand	Mild	SMO	0	44
CCO[C@@H]1CCN(c2ccc(C#N)cn2)C[C@H]1C	ZINC000450745684	BE	On-Demand	Mild	SMO	0	44
CCO[C@@H]1CCN(c2ccc(C#N)cn2)C[C@@H]1C	ZINC000450745685	BE	On-Demand	Mild	SMO	0	44
CCO[C@H]1CCN(c2ccc(C#N)cn2)C[C@H]1C	ZINC000450745686	BE	On-Demand	Mild	SMO	0	44
CC(C)OC(C)(C)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450745689	EF	On-Demand	Anodyne	SCN9A	0	40
CCO[C@@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450745694	EF	On-Demand	Bother	TAAR1	23	47
CCO[C@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450745695	EF	On-Demand	Bother	TAAR1	23	47
CCO[C@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450745696	EF	On-Demand	Bother	TAAR1	23	47
CCO[C@@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450745697	EF	On-Demand	Bother	TAAR1	23	47
CCO[C@@H]1C[C@H](NC(=O)[C@@]2(COC)CCOC2)[C@H]1Oc1ccccc1	ZINC000450745698	ED	On-Demand	Anodyne	TIMP3	54	33
CCO[C@@H]1C[C@H](NC(=O)[C@]2(COC)CCOC2)[C@H]1Oc1ccccc1	ZINC000450745699	ED	On-Demand	Anodyne	TIMP3	54	33
CCO[C@@H]1C[C@H](NC(=O)[C@@]2(COC)CCOC2)[C@@H]1Oc1ccccc1	ZINC000450745700	ED	On-Demand	Anodyne	TIMP3	54	33
CCO[C@@H]1C[C@H](NC(=O)[C@]2(COC)CCOC2)[C@@H]1Oc1ccccc1	ZINC000450745701	ED	On-Demand	Anodyne	TIMP3	54	33
CCO[C@@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450745706	EH	On-Demand	Bother	GYRB	0	47
CCO[C@@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450745707	EH	On-Demand	Bother	GYRB	0	47
CCO[C@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450745708	EH	On-Demand	Bother	GYRB	0	47
CCO[C@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450745709	EH	On-Demand	Bother	GYRB	0	47
Brc1cccc(OC2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450745726	GG	On-Demand	Anodyne	HRH1	19	43
Brc1cccc(OC2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450745726	GG	On-Demand	Anodyne	CCR3	16	40
Brc1cccc(OC2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450745726	GG	On-Demand	Anodyne	SCN5A	59	32
CC(F)(F)C(C)(C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450745741	EE	On-Demand	Anodyne	PIK3CB	53	33
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nc4ccccc4s3)C2)CC1	ZINC000450745742	FG	On-Demand	Anodyne	PRSS3	0	40
CC(=O)N1CCCN(C[C@H]2CCCN(c3nc4ccccc4s3)C2)CC1	ZINC000450745743	FG	On-Demand	Anodyne	PRSS3	0	40
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450745744	DI	On-Demand	Anodyne	AKT1	0	40
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450745744	DI	On-Demand	Anodyne	TRPC6	46	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450745745	DI	On-Demand	Anodyne	AKT1	0	40
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450745745	DI	On-Demand	Anodyne	TRPC6	46	32
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450745746	DI	On-Demand	Anodyne	AKT1	0	40
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450745746	DI	On-Demand	Anodyne	TRPC6	46	32
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450745747	DI	On-Demand	Anodyne	AKT1	0	40
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450745747	DI	On-Demand	Anodyne	TRPC6	46	32
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	DRD4	34	50
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	DRD3	0	50
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	CHRM3	16	42
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	SIGMAR1	32	48
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	SSTR5	55	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	CCR3	31	56
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	UTS2R	23	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	MLNR	47	36
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	CCR2	17	44
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	EPHX2	34	45
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	MCHR1	40	49
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	RORC	43	31
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	ADIPOR1	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745759	FD	On-Demand	Anodyne	ADIPOR2	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	DRD4	34	50
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	DRD3	0	50
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	CHRM3	16	42
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	SIGMAR1	32	48
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	SSTR5	55	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	CCR3	31	56
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	UTS2R	23	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	MLNR	47	36
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	CCR2	17	44
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	EPHX2	34	45
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	MCHR1	40	49
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	RORC	43	31
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	ADIPOR1	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1	ZINC000450745760	FD	On-Demand	Anodyne	ADIPOR2	0	40
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	HTR1A	95	63
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	DRD2	95	64
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	DRD1	48	60
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	DRD4	79	61
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	ADRA1D	42	50
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	HTR2A	63	61
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	HTR2C	32	50
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	ADRA1A	43	50
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	ADRA1B	28	50
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	DRD3	93	64
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	ERG2	23	50
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	HTR7	77	50
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	SIGMAR1	29	64
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	ABCB1	18	50
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	CYP2J2	52	40
COc1cc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)ncn1	ZINC000450745771	FE	On-Demand	Anodyne	SLC27A1	50	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cnc(C2CC2)nc1	ZINC000450745789	DG	On-Demand	Anodyne	TRPC6	44	32
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cnc(C2CC2)nc1	ZINC000450745790	DG	On-Demand	Anodyne	TRPC6	44	32
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cnc(C2CC2)nc1	ZINC000450745791	DG	On-Demand	Anodyne	TRPC6	44	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cnc(C2CC2)nc1	ZINC000450745792	DG	On-Demand	Anodyne	TRPC6	44	32
CC(C)(C)C(=O)CCCC(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450745793	FI	On-Demand	Anodyne	SOAT1	17	44
CC(C)(C)C(=O)CCCC(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450745794	FI	On-Demand	Anodyne	SOAT1	17	44
CN(C)C(=O)CC1CCN(C(=O)Cc2cc3ccccc3s2)CC1	ZINC000450745797	EG	On-Demand	Anodyne	AROQ	22	40
CC[C@@H](CC(C)C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450745798	DF	On-Demand	Anodyne	PIK3CB	53	33
CC[C@H](CC(C)C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450745799	DF	On-Demand	Anodyne	PIK3CB	53	33
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450745811	EI	On-Demand	Anodyne	OPRK1	31	48
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450745811	EI	On-Demand	Anodyne	CCR1	33	40
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450745811	EI	On-Demand	Anodyne	ITGA4	32	42
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450745811	EI	On-Demand	Anodyne	UTS2R	29	41
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450745812	EI	On-Demand	Anodyne	OPRK1	31	48
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450745812	EI	On-Demand	Anodyne	CCR1	33	40
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450745812	EI	On-Demand	Anodyne	ITGA4	32	42
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450745812	EI	On-Demand	Anodyne	UTS2R	29	41
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450745813	EI	On-Demand	Anodyne	OPRK1	31	48
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450745813	EI	On-Demand	Anodyne	CCR1	33	40
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450745813	EI	On-Demand	Anodyne	ITGA4	32	42
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450745813	EI	On-Demand	Anodyne	UTS2R	29	41
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450745814	EI	On-Demand	Anodyne	OPRK1	31	48
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450745814	EI	On-Demand	Anodyne	CCR1	33	40
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450745814	EI	On-Demand	Anodyne	ITGA4	32	42
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450745814	EI	On-Demand	Anodyne	UTS2R	29	41
O=C(CC[C@@H]1CCCCO1)CSc1nnnn1C[C@@H]1CCCO1	ZINC000450745835	ED	On-Demand	Anodyne	PDE8B	55	40
O=C(CC[C@H]1CCCCO1)CSc1nnnn1C[C@@H]1CCCO1	ZINC000450745836	ED	On-Demand	Anodyne	PDE8B	55	40
O=C(CC[C@@H]1CCCCO1)CSc1nnnn1C[C@H]1CCCO1	ZINC000450745837	ED	On-Demand	Anodyne	PDE8B	55	40
O=C(CC[C@H]1CCCCO1)CSc1nnnn1C[C@H]1CCCO1	ZINC000450745838	ED	On-Demand	Anodyne	PDE8B	55	40
CSc1cccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)c1	ZINC000450745840	DI	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1	ZINC000450745841	DI	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)c1	ZINC000450745842	DI	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)c1	ZINC000450745843	DI	On-Demand	Anodyne	RHOA	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	ACE	61	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	FKBP1A	40	38
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	CELA1	24	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	MME	35	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	CMA1	42	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	CTRA_BOVIN	50	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	TRY1_BOVIN	50	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	CTSG	40	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	PREP	58	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	CELA2A	49	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	DPP8	26	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450745855	EG	On-Demand	Anodyne	BRCA1	60	33
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	ACE	61	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	FKBP1A	40	38
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	CELA1	24	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	MME	35	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	CMA1	42	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	CTRA_BOVIN	50	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	TRY1_BOVIN	50	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	CTSG	40	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	PREP	58	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	CELA2A	49	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	DPP8	26	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450745856	EG	On-Demand	Anodyne	BRCA1	60	33
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	ACE	61	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	FKBP1A	40	38
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	CELA1	24	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	MME	35	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	CMA1	42	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	CTRA_BOVIN	50	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	TRY1_BOVIN	50	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	CTSG	40	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	PREP	58	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	CELA2A	49	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	DPP8	26	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450745857	EG	On-Demand	Anodyne	BRCA1	60	33
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	ACE	61	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	FKBP1A	40	38
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	CELA1	24	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	MME	35	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	CMA1	42	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	CTRA_BOVIN	50	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	TRY1_BOVIN	50	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	CTSG	40	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	PREP	58	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	CELA2A	49	31
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	DPP8	26	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450745858	EG	On-Demand	Anodyne	BRCA1	60	33
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ncn3)CC2)cc1	ZINC000450745864	GD	On-Demand	Anodyne	SSTR5	21	42
COc1cc(-c2noc(CN3CC[C@@H](NC(=O)NC4CC4)C3)n2)ncn1	ZINC000450745867	FC	On-Demand	Anodyne	PDK1	46	33
COc1cc(-c2noc(CN3CC[C@H](NC(=O)NC4CC4)C3)n2)ncn1	ZINC000450745868	FC	On-Demand	Anodyne	PDK1	46	33
CCC(=O)CCCN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450745873	CD	On-Demand	Anodyne	EPHX2	18	47
CCC(=O)CCCN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450745874	CD	On-Demand	Anodyne	EPHX2	18	47
COC(=O)c1cn([C@@H]2CCCN(Cc3ccc(C(=O)OC)c(Cl)c3)C2)nn1	ZINC000450745875	GE	On-Demand	Anodyne	CCR3	56	40
COC(=O)c1cn([C@H]2CCCN(Cc3ccc(C(=O)OC)c(Cl)c3)C2)nn1	ZINC000450745876	GE	On-Demand	Anodyne	CCR3	56	40
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)nc1	ZINC000450745905	ED	On-Demand	Anodyne	SSTR5	52	51
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)nc1	ZINC000450745906	ED	On-Demand	Anodyne	SSTR5	52	51
CN1CCN(CC2(C)CCN(Cc3ccn(CCc4ccccc4)n3)CC2)CC1	ZINC000450745910	GF	On-Demand	Anodyne	SIGMAR1	40	39
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450745923	FH	On-Demand	Bother	CACNA1D	40	33
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450745923	FH	On-Demand	Bother	PREP	18	47
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450745924	FH	On-Demand	Bother	CACNA1D	40	33
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450745924	FH	On-Demand	Bother	PREP	18	47
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450745925	FH	On-Demand	Bother	CACNA1D	40	33
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450745925	FH	On-Demand	Bother	PREP	18	47
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450745926	FH	On-Demand	Bother	CACNA1D	40	33
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450745926	FH	On-Demand	Bother	PREP	18	47
CCO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450745933	FG	On-Demand	Anodyne	P2RY12	43	31
CCO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450745933	FG	On-Demand	Anodyne	ACACA	0	49
CCO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450745933	FG	On-Demand	Anodyne	ACACB	28	49
CCO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450745933	FG	On-Demand	Anodyne	TNKS	52	33
CCO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450745935	FG	On-Demand	Anodyne	P2RY12	43	31
CCO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450745935	FG	On-Demand	Anodyne	ACACA	0	49
CCO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450745935	FG	On-Demand	Anodyne	ACACB	28	49
CCO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450745935	FG	On-Demand	Anodyne	TNKS	52	33
CCO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450745936	FG	On-Demand	Anodyne	P2RY12	43	31
CCO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450745936	FG	On-Demand	Anodyne	ACACA	0	49
CCO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450745936	FG	On-Demand	Anodyne	ACACB	28	49
CCO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450745936	FG	On-Demand	Anodyne	TNKS	52	33
CCO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450745937	FG	On-Demand	Anodyne	P2RY12	43	31
CCO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450745937	FG	On-Demand	Anodyne	ACACA	0	49
CCO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450745937	FG	On-Demand	Anodyne	ACACB	28	49
CCO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450745937	FG	On-Demand	Anodyne	TNKS	52	33
CCO[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450745938	DI	On-Demand	Anodyne	HRP1_PLAFA	56	33
CCO[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450745938	DI	On-Demand	Anodyne	HNMT	44	31
CCO[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450745939	DI	On-Demand	Anodyne	HRP1_PLAFA	56	33
CCO[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450745939	DI	On-Demand	Anodyne	HNMT	44	31
CCO[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450745940	DI	On-Demand	Anodyne	HRP1_PLAFA	56	33
CCO[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450745940	DI	On-Demand	Anodyne	HNMT	44	31
CCO[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450745941	DI	On-Demand	Anodyne	HRP1_PLAFA	56	33
CCO[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450745941	DI	On-Demand	Anodyne	HNMT	44	31
CCS(=O)(=O)c1ccc(CN2CCC(n3cc(C(=O)OC)nn3)CC2)cc1	ZINC000450745956	GD	On-Demand	Anodyne	DRD4	16	44
CCS(=O)(=O)c1ccc(CN2CCC(n3cc(C(=O)OC)nn3)CC2)cc1	ZINC000450745956	GD	On-Demand	Anodyne	SSTR5	46	41
Cn1cc(-c2ccc(C(=O)NCc3cccc(N4CCOCC4)n3)o2)cn1	ZINC000450745975	FD	On-Demand	Anodyne	NAMPT	21	40
CCO[C@@H]1CCN(c2ncnc3c(C)csc23)C[C@@H]1C	ZINC000450745993	CG	On-Demand	Anodyne	PDE3B	40	34
CCO[C@H]1CCN(c2ncnc3c(C)csc23)C[C@@H]1C	ZINC000450745999	CG	On-Demand	Anodyne	PDE3B	40	34
CCO[C@H]1CCN(c2ncnc3c(C)csc23)C[C@H]1C	ZINC000450746000	CG	On-Demand	Anodyne	PDE3B	40	34
CCO[C@@H]1CCN(c2ncnc3c(C)csc23)C[C@H]1C	ZINC000450746001	CG	On-Demand	Anodyne	PDE3B	40	34
Cc1cncc(-c2nc(CN3CCN(c4ccnc(C)n4)CC3)no2)c1	ZINC000450746002	FD	On-Demand	Anodyne	SORD	43	39
C[C@@H](O)CCN1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1	ZINC000450746004	ED	On-Demand	Anodyne	SLC6A1	64	32
C[C@H](O)CCN1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1	ZINC000450746006	ED	On-Demand	Anodyne	SLC6A1	64	32
C[C@H](O)CCN1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1	ZINC000450746007	ED	On-Demand	Anodyne	SLC6A1	64	32
C[C@@H](O)CCN1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1	ZINC000450746008	ED	On-Demand	Anodyne	SLC6A1	64	32
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	HTR1A	17	56
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	DRD2	40	56
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	DRD1	28	54
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	DRD4	27	56
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	HTR2A	31	60
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	HTR2C	19	59
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	DRD3	19	56
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	DRD5	15	47
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	ERG2	26	56
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	HTR7	20	56
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	SIGMAR1	18	60
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	SLC18A3	25	60
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	EBP	23	56
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	HTR3B	0	48
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	CYP2J2	54	39
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	NET	0	56
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450746013	GG	On-Demand	Anodyne	AP2S1	0	56
COC(=O)c1ccc(CC(=O)Nc2cccc(C(C)(C)C)c2O)cc1	ZINC000450746021	EH	On-Demand	Anodyne	MAPK10	0	42
CCO[C@@H]1CCN(c2ncnc3sc(CC)cc23)C[C@H]1C	ZINC000450746033	DH	On-Demand	Anodyne	PDE3A	45	37
CCO[C@@H]1CCN(c2ncnc3sc(CC)cc23)C[C@H]1C	ZINC000450746033	DH	On-Demand	Anodyne	PDE3B	68	37
CCO[C@@H]1CCN(c2ncnc3sc(CC)cc23)C[C@H]1C	ZINC000450746033	DH	On-Demand	Anodyne	SIRT1	40	30
CCO[C@H]1CCN(c2ncnc3sc(CC)cc23)C[C@@H]1C	ZINC000450746034	DH	On-Demand	Anodyne	PDE3A	45	37
CCO[C@H]1CCN(c2ncnc3sc(CC)cc23)C[C@@H]1C	ZINC000450746034	DH	On-Demand	Anodyne	PDE3B	68	37
CCO[C@H]1CCN(c2ncnc3sc(CC)cc23)C[C@@H]1C	ZINC000450746034	DH	On-Demand	Anodyne	SIRT1	40	30
CCO[C@H]1CCN(c2ncnc3sc(CC)cc23)C[C@H]1C	ZINC000450746035	DH	On-Demand	Anodyne	PDE3A	45	37
CCO[C@H]1CCN(c2ncnc3sc(CC)cc23)C[C@H]1C	ZINC000450746035	DH	On-Demand	Anodyne	PDE3B	68	37
CCO[C@H]1CCN(c2ncnc3sc(CC)cc23)C[C@H]1C	ZINC000450746035	DH	On-Demand	Anodyne	SIRT3	48	31
CCO[C@H]1CCN(c2ncnc3sc(CC)cc23)C[C@H]1C	ZINC000450746035	DH	On-Demand	Anodyne	SIRT1	40	30
CCO[C@@H]1CCN(c2ncnc3sc(CC)cc23)C[C@@H]1C	ZINC000450746036	DH	On-Demand	Anodyne	PDE3A	45	37
CCO[C@@H]1CCN(c2ncnc3sc(CC)cc23)C[C@@H]1C	ZINC000450746036	DH	On-Demand	Anodyne	PDE3B	68	37
CCO[C@@H]1CCN(c2ncnc3sc(CC)cc23)C[C@@H]1C	ZINC000450746036	DH	On-Demand	Anodyne	SIRT1	40	30
Cc1ccc(Br)cc1CN1CCN(c2ncc(F)cn2)CC1	ZINC000450746037	FG	On-Demand	Anodyne	DRD4	15	40
CC(C)C[C@@H](C)Sc1nnnn1C[C@H]1CCCO1	ZINC000450746038	CE	On-Demand	Anodyne	PDE8B	42	40
CC(C)C[C@@H](C)Sc1nnnn1C[C@@H]1CCCO1	ZINC000450746039	CE	On-Demand	Anodyne	PDE8B	42	40
CC(C)C[C@H](C)Sc1nnnn1C[C@@H]1CCCO1	ZINC000450746040	CE	On-Demand	Anodyne	PDE8B	42	40
CC(C)C[C@H](C)Sc1nnnn1C[C@H]1CCCO1	ZINC000450746041	CE	On-Demand	Anodyne	PDE8B	42	40
CCC[C@H](O)CN(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746047	CF	On-Demand	Anodyne	DRD2	0	47
CCC[C@H](O)CN(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746047	CF	On-Demand	Anodyne	ACHE	31	40
CCC[C@@H](O)CN(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746048	CF	On-Demand	Anodyne	DRD2	0	47
CCC[C@@H](O)CN(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746048	CF	On-Demand	Anodyne	ACHE	31	40
CCC[C@H](O)CN(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746049	CF	On-Demand	Anodyne	DRD2	0	47
CCC[C@H](O)CN(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746049	CF	On-Demand	Anodyne	ACHE	31	40
CCC[C@@H](O)CN(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746050	CF	On-Demand	Anodyne	DRD2	0	47
CCC[C@@H](O)CN(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746050	CF	On-Demand	Anodyne	ACHE	31	40
CCO[C@@H]1CCN(c2nc(-c3ccccc3F)cs2)C[C@@H]1C	ZINC000450746069	DI	On-Demand	Anodyne	GABRA3	41	34
CCO[C@H]1CCN(c2nc(-c3ccccc3F)cs2)C[C@@H]1C	ZINC000450746070	DI	On-Demand	Anodyne	GABRA3	41	34
CCO[C@@H]1CCN(c2nc(-c3ccccc3F)cs2)C[C@H]1C	ZINC000450746071	DI	On-Demand	Anodyne	GABRA3	41	34
CCO[C@H]1CCN(c2nc(-c3ccccc3F)cs2)C[C@H]1C	ZINC000450746072	DI	On-Demand	Anodyne	GABRA3	41	34
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450746083	FG	On-Demand	Anodyne	PPARA	18	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450746083	FG	On-Demand	Anodyne	PPARD	23	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450746083	FG	On-Demand	Anodyne	SORT1	16	43
CCN=c1[nH]c(S[C@@H](C)C(=O)Nc2nccs2)nc2ccccc12	ZINC000450746085	FG	On-Demand	Anodyne	MAP1	90	35
CCN=c1[nH]c(S[C@H](C)C(=O)Nc2nccs2)nc2ccccc12	ZINC000450746086	FG	On-Demand	Anodyne	MAP1	90	35
COc1cc(CN2CCN(c3cccc(C#N)n3)CC2)ccc1Cl	ZINC000450746096	EF	On-Demand	Mild	DRD1	23	41
COc1cc(CN2CCN(c3cccc(C#N)n3)CC2)ccc1Cl	ZINC000450746096	EF	On-Demand	Mild	DRD4	35	43
COc1cc(CN2CCN(c3cccc(C#N)n3)CC2)ccc1Cl	ZINC000450746096	EF	On-Demand	Mild	SSTR5	46	37
CSCCCCCNC(=O)[C@H]1CCCN(C)C1=O	ZINC000450746097	CD	On-Demand	Anodyne	TPP2	21	43
CSCCCCCNC(=O)[C@@H]1CCCN(C)C1=O	ZINC000450746098	CD	On-Demand	Anodyne	TPP2	21	43
CCCc1cc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)no1	ZINC000450746099	DG	On-Demand	Anodyne	TRPC6	44	32
CCCc1cc(C(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)no1	ZINC000450746100	DG	On-Demand	Anodyne	TRPC6	44	32
CCCc1cc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)no1	ZINC000450746101	DG	On-Demand	Anodyne	TRPC6	44	32
CCCc1cc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)no1	ZINC000450746102	DG	On-Demand	Anodyne	TRPC6	44	32
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	PDE5A	31	53
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	ACE	22	47
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	SSTR2	27	41
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	OPRM1	0	45
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	OPRD1	0	45
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	GHRHR	31	41
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MME	28	45
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	EDNRB	54	38
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	EDNRA	36	40
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	TACR1	24	53
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MC4R	42	40
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	BMP1	35	44
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	TACR2	29	46
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	CCKAR	94	49
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	CTSL	34	44
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	CCR3	0	62
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	BRS3	24	42
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MC3R	53	40
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MC5R	62	37
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MMP2	25	46
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MMP8	38	41
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MMP14	24	43
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	GRPR	79	37
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	ECE1	64	46
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	LNPEP	30	44
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	SSTR3	30	43
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MMP11	78	41
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	CCKBR	73	39
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	GHSR	82	45
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MMP9	25	46
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MC1R	77	44
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	ADAM9	40	41
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MMP7	30	40
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	MMP1	0	44
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	NPR	33	45
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	SLC15A2	0	48
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	KISS1R	69	39
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	ERAP2	58	44
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	ERAP1	0	44
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	LASB	0	43
CCc1cccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)n1	ZINC000450746124	FF	On-Demand	Anodyne	IL1RN	0	44
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746128	FG	On-Demand	Anodyne	PREP	57	36
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746128	FG	On-Demand	Anodyne	DPP9	20	44
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746128	FG	On-Demand	Anodyne	THYX_PBCV1	0	44
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746129	FG	On-Demand	Anodyne	PREP	57	36
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746129	FG	On-Demand	Anodyne	DPP9	20	44
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746129	FG	On-Demand	Anodyne	THYX_PBCV1	0	44
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746130	FG	On-Demand	Anodyne	PREP	57	36
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746130	FG	On-Demand	Anodyne	DPP9	20	44
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746130	FG	On-Demand	Anodyne	THYX_PBCV1	0	44
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746131	FG	On-Demand	Anodyne	PREP	57	36
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746131	FG	On-Demand	Anodyne	DPP9	20	44
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450746131	FG	On-Demand	Anodyne	THYX_PBCV1	0	44
CCS(=O)(=O)c1ccc(CN2CCN(c3cccc(C#N)n3)CC2)cc1	ZINC000450746132	FE	On-Demand	Mild	ADORA2B	40	33
CCS(=O)(=O)c1ccc(CSc2nnnn2C[C@H]2CCCO2)cc1	ZINC000450746136	FD	On-Demand	Anodyne	PDE8B	51	36
CCS(=O)(=O)c1ccc(CSc2nnnn2C[C@@H]2CCCO2)cc1	ZINC000450746137	FD	On-Demand	Anodyne	PDE8B	51	36
CCO[C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C[C@@H]1C	ZINC000450746146	EJ	On-Demand	Anodyne	LIPG	45	36
CCO[C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C[C@@H]1C	ZINC000450746147	EJ	On-Demand	Anodyne	LIPG	45	36
CCO[C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C[C@H]1C	ZINC000450746148	EJ	On-Demand	Anodyne	LIPG	45	36
CCO[C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C[C@H]1C	ZINC000450746149	EJ	On-Demand	Anodyne	LIPG	45	36
COC(=O)c1cn(C2CCN(C[C@H](Cc3ccccc3)OC)CC2)nn1	ZINC000450746170	FD	On-Demand	Anodyne	DRD4	15	43
COC(=O)c1cn(C2CCN(C[C@@H](Cc3ccccc3)OC)CC2)nn1	ZINC000450746171	FD	On-Demand	Anodyne	DRD4	15	43
CN(CCc1ccc(Cl)cc1)C1CC(O)C1	ZINC000450746176	BE	On-Demand	Anodyne	C5AR1	24	42
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@H]1C	ZINC000450746207	DE	On-Demand	Anodyne	SLC6A9	25	47
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@H]1C	ZINC000450746208	DE	On-Demand	Anodyne	SLC6A9	25	47
CCO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@@H]1C	ZINC000450746209	DE	On-Demand	Anodyne	SLC6A9	25	47
CCO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@@H]1C	ZINC000450746210	DE	On-Demand	Anodyne	SLC6A9	25	47
CCO[C@H]1CCN(c2cc(Cl)ccc2C#N)C[C@H]1C	ZINC000450746219	CG	On-Demand	Mild	NOS2	20	42
CCO[C@H]1CCN(c2cc(Cl)ccc2C#N)C[C@H]1C	ZINC000450746219	CG	On-Demand	Mild	NOS3	18	42
CCO[C@@H]1CCN(c2cc(Cl)ccc2C#N)C[C@H]1C	ZINC000450746220	CG	On-Demand	Mild	NOS2	20	42
CCO[C@@H]1CCN(c2cc(Cl)ccc2C#N)C[C@H]1C	ZINC000450746220	CG	On-Demand	Mild	NOS3	18	42
CCO[C@H]1CCN(c2cc(Cl)ccc2C#N)C[C@@H]1C	ZINC000450746221	CG	On-Demand	Mild	NOS2	20	42
CCO[C@H]1CCN(c2cc(Cl)ccc2C#N)C[C@@H]1C	ZINC000450746221	CG	On-Demand	Mild	NOS3	18	42
CCO[C@@H]1CCN(c2cc(Cl)ccc2C#N)C[C@@H]1C	ZINC000450746222	CG	On-Demand	Mild	NOS2	20	42
CCO[C@@H]1CCN(c2cc(Cl)ccc2C#N)C[C@@H]1C	ZINC000450746222	CG	On-Demand	Mild	NOS3	18	42
COc1cc(CNC(C)(C)CC(N)=O)ccc1Cl	ZINC000450746223	CE	On-Demand	Anodyne	TRPV1	37	42
COc1cc(CNC(C)(C)CC(N)=O)ccc1Cl	ZINC000450746223	CE	On-Demand	Anodyne	PDE6A	44	34
COc1cc(CNC(C)(C)CC(N)=O)ccc1Cl	ZINC000450746223	CE	On-Demand	Anodyne	MT-ND1	24	40
COc1cc(CNC(C)(C)CC(N)=O)ccc1Cl	ZINC000450746223	CE	On-Demand	Anodyne	DRTS_TRYCR	45	31
CCO[C@@H]1CCN(c2cc(C(F)(F)F)ccn2)C[C@@H]1C	ZINC000450746228	CG	On-Demand	Anodyne	LIPG	52	37
CCO[C@H]1CCN(c2cc(C(F)(F)F)ccn2)C[C@@H]1C	ZINC000450746229	CG	On-Demand	Anodyne	LIPG	52	37
CCO[C@H]1CCN(c2cc(C(F)(F)F)ccn2)C[C@H]1C	ZINC000450746230	CG	On-Demand	Anodyne	LIPG	52	37
CCO[C@@H]1CCN(c2cc(C(F)(F)F)ccn2)C[C@H]1C	ZINC000450746231	CG	On-Demand	Anodyne	LIPG	52	37
Cc1nnnn1-c1ccc(C(=O)NCc2cccc(N3CCOCC3)n2)c(F)c1	ZINC000450746244	GD	On-Demand	Anodyne	STAT6	55	36
O=C(Cc1ccc(OC(F)F)c(F)c1)NCc1cccc(N2CCOCC2)n1	ZINC000450746245	GF	On-Demand	Anodyne	PIK3CB	56	37
CCO[C@@H]1CCN(c2nccc(-c3ccc(OC)cc3)n2)C[C@@H]1C	ZINC000450746254	EG	On-Demand	Anodyne	DKK1	0	41
CCO[C@H]1CCN(c2nccc(-c3ccc(OC)cc3)n2)C[C@H]1C	ZINC000450746255	EG	On-Demand	Anodyne	DKK1	0	41
CCO[C@H]1CCN(c2nccc(-c3ccc(OC)cc3)n2)C[C@@H]1C	ZINC000450746256	EG	On-Demand	Anodyne	DKK1	0	41
CCO[C@@H]1CCN(c2nccc(-c3ccc(OC)cc3)n2)C[C@H]1C	ZINC000450746257	EG	On-Demand	Anodyne	DKK1	0	41
CCN(C)C(=O)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450746272	DD	On-Demand	Anodyne	CTSV	44	30
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	SSTR2	63	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	OPRD1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	GHRHR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MME	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	EDNRB	53	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	EDNRA	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	TACR1	31	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	BMP1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	TACR2	33	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	CCKAR	103	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	CTSL	29	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	BRS3	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	NMBR	61	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MC3R	52	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MC5R	56	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MMP2	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MMP8	35	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MMP14	23	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	GRPR	45	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	ECE1	61	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	LNPEP	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	SSTR3	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MMP11	72	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	CCKBR	89	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	GHSR	79	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MMP9	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	MMP1	22	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	SLC15A2	0	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	KISS1R	59	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	ERAP2	46	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	ERAP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	LASB	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746273	FF	On-Demand	Anodyne	IL1RN	0	41
CCS(=O)(=O)c1ccc(CN2CCC[C@H](n3cc(C(=O)OC)nn3)C2)cc1	ZINC000450746300	GD	On-Demand	Anodyne	CCR3	41	33
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](n3cc(C(=O)OC)nn3)C2)cc1	ZINC000450746301	GD	On-Demand	Anodyne	CCR3	41	33
COC(=O)c1cn([C@H]2CCCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450746303	FE	On-Demand	Anodyne	SLC6A1	143	40
COC(=O)c1cn([C@H]2CCCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450746303	FE	On-Demand	Anodyne	CYP2J2	55	39
COC(=O)c1cn([C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450746304	FE	On-Demand	Anodyne	SLC6A1	143	40
COC(=O)c1cn([C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)nn1	ZINC000450746304	FE	On-Demand	Anodyne	CYP2J2	55	39
Clc1cc(CSc2nnnn2C[C@H]2CCCO2)c(Cl)s1	ZINC000450746306	FH	On-Demand	Anodyne	PDE8B	44	33
Clc1cc(CSc2nnnn2C[C@@H]2CCCO2)c(Cl)s1	ZINC000450746307	FH	On-Demand	Anodyne	PDE8B	44	33
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450746328	DG	On-Demand	Anodyne	TRPC6	45	34
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450746329	DG	On-Demand	Anodyne	TRPC6	45	34
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450746330	DG	On-Demand	Anodyne	TRPC6	45	34
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450746331	DG	On-Demand	Anodyne	TRPC6	45	34
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	ACE	20	45
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	SSTR2	24	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	GNRHR	0	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	OPRM1	0	45
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	OPRD1	0	45
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	GHRHR	31	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MME	27	47
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	EDNRB	52	38
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	TACR1	34	53
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MC4R	50	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	BMP1	29	42
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	TACR2	22	46
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	CCKAR	119	51
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	CTSL	30	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	CCR3	0	62
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	BRS3	28	44
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	NMBR	22	45
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MC3R	68	39
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MC5R	65	39
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MMP2	28	49
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MMP8	36	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MMP14	27	41
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	GRPR	71	37
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	ECE1	64	47
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	LNPEP	29	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MMP11	108	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	CCKBR	75	41
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	GHSR	76	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MMP9	27	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MC1R	95	40
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	MMP1	22	42
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	NPR	33	47
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	SLC15A2	0	48
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	KISS1R	81	39
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	ERAP2	48	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	ERAP1	0	43
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	LASB	0	46
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OC)[nH]c1C	ZINC000450746333	GE	On-Demand	Anodyne	IL1RN	0	43
CN(CCN1CCCC[C@@]1(C)C(N)=O)Cc1ccccc1	ZINC000450746344	CD	On-Demand	Anodyne	SIGMAR1	20	41
CN(CCN1CCCC[C@@]1(C)C(N)=O)Cc1ccccc1	ZINC000450746344	CD	On-Demand	Anodyne	SLC12A5	45	34
CN(CCN1CCCC[C@]1(C)C(N)=O)Cc1ccccc1	ZINC000450746345	CD	On-Demand	Anodyne	SIGMAR1	20	41
CN(CCN1CCCC[C@]1(C)C(N)=O)Cc1ccccc1	ZINC000450746345	CD	On-Demand	Anodyne	SLC12A5	45	34
COC(=O)c1csc(CN2CCO[C@@H](CCc3ccccc3)C2)n1	ZINC000450746350	EF	On-Demand	Anodyne	DRD4	20	57
COC(=O)c1csc(CN2CCO[C@H](CCc3ccccc3)C2)n1	ZINC000450746351	EF	On-Demand	Anodyne	DRD4	20	57
Cc1ccn(CC(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)n1	ZINC000450746364	DG	On-Demand	Anodyne	ACAT	0	41
Cc1ccn(CC(=O)N[C@H](C)C2(c3ccccc3)CCCC2)n1	ZINC000450746365	DG	On-Demand	Anodyne	ACAT	0	41
CCOC(=O)c1sc2ncnc(N3CC[C@H](OCC)[C@@H](C)C3)c2c1C	ZINC000450746398	FG	On-Demand	Anodyne	SIRT3	48	32
CCOC(=O)c1sc2ncnc(N3CC[C@H](OCC)[C@@H](C)C3)c2c1C	ZINC000450746398	FG	On-Demand	Anodyne	SIRT2	51	32
CCOC(=O)c1sc2ncnc(N3CC[C@H](OCC)[C@@H](C)C3)c2c1C	ZINC000450746398	FG	On-Demand	Anodyne	SIRT1	41	32
CCOC(=O)c1sc2ncnc(N3CC[C@@H](OCC)[C@H](C)C3)c2c1C	ZINC000450746399	FG	On-Demand	Anodyne	SIRT3	48	32
CCOC(=O)c1sc2ncnc(N3CC[C@@H](OCC)[C@H](C)C3)c2c1C	ZINC000450746399	FG	On-Demand	Anodyne	SIRT2	51	32
CCOC(=O)c1sc2ncnc(N3CC[C@@H](OCC)[C@H](C)C3)c2c1C	ZINC000450746399	FG	On-Demand	Anodyne	SIRT1	41	32
CCOC(=O)c1sc2ncnc(N3CC[C@@H](OCC)[C@@H](C)C3)c2c1C	ZINC000450746400	FG	On-Demand	Anodyne	SIRT3	48	32
CCOC(=O)c1sc2ncnc(N3CC[C@@H](OCC)[C@@H](C)C3)c2c1C	ZINC000450746400	FG	On-Demand	Anodyne	SIRT2	51	32
CCOC(=O)c1sc2ncnc(N3CC[C@@H](OCC)[C@@H](C)C3)c2c1C	ZINC000450746400	FG	On-Demand	Anodyne	SIRT1	41	32
CCOC(=O)c1sc2ncnc(N3CC[C@H](OCC)[C@H](C)C3)c2c1C	ZINC000450746401	FG	On-Demand	Anodyne	SIRT3	48	32
CCOC(=O)c1sc2ncnc(N3CC[C@H](OCC)[C@H](C)C3)c2c1C	ZINC000450746401	FG	On-Demand	Anodyne	SIRT2	51	32
CCOC(=O)c1sc2ncnc(N3CC[C@H](OCC)[C@H](C)C3)c2c1C	ZINC000450746401	FG	On-Demand	Anodyne	SIRT1	41	32
COC(=O)c1cn([C@H]2CCCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)C2)nn1	ZINC000450746444	GH	On-Demand	Anodyne	CCR3	71	34
COC(=O)c1cn([C@H]2CCCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)C2)nn1	ZINC000450746445	GH	On-Demand	Anodyne	CCR3	71	34
COC(=O)c1cn([C@@H]2CCCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)C2)nn1	ZINC000450746446	GH	On-Demand	Anodyne	CCR3	71	34
COC(=O)c1cn([C@@H]2CCCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)C2)nn1	ZINC000450746447	GH	On-Demand	Anodyne	CCR3	71	34
CCN(C)C(=O)CNC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450746448	CD	On-Demand	Anodyne	SLC6A2	15	44
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	CHRM2	15	42
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	DRD4	28	53
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	DRD3	0	48
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	CHRM3	24	42
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	SIGMAR1	34	49
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	SSTR5	41	35
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	CCR3	29	53
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	UTS2R	19	40
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	MLNR	46	41
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	CCR2	24	45
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	SLC6A5	32	44
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	MCHR1	49	41
C[C@@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746459	FG	On-Demand	Anodyne	BIRC2	61	38
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	CHRM2	15	42
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	DRD4	28	53
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	DRD3	0	48
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	CHRM3	24	42
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	SIGMAR1	34	49
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	SSTR5	41	35
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	CCR3	29	53
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	UTS2R	19	40
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	MLNR	46	41
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	CCR2	24	45
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	SLC6A5	32	44
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	MCHR1	49	41
C[C@@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746460	FG	On-Demand	Anodyne	BIRC2	61	38
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	CHRM2	15	42
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	DRD4	28	53
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	DRD3	0	48
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	CHRM3	24	42
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	SIGMAR1	34	49
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	SSTR5	41	35
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	CCR3	29	53
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	UTS2R	19	40
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	MLNR	46	41
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	CCR2	24	45
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	SLC6A5	32	44
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	MCHR1	49	41
C[C@H](c1ccc(CN2CC[C@@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746461	FG	On-Demand	Anodyne	BIRC2	61	38
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	CHRM2	15	42
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	DRD4	28	53
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	DRD3	0	48
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	CHRM3	24	42
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	SIGMAR1	34	49
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	SSTR5	41	35
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	CCR3	29	53
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	UTS2R	19	40
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	MLNR	46	41
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	CCR2	24	45
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	SLC6A5	32	44
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	MCHR1	49	41
C[C@H](c1ccc(CN2CC[C@H](NC(=O)NC3CC3)C2)cc1)C(F)(F)F	ZINC000450746462	FG	On-Demand	Anodyne	BIRC2	61	38
COc1ccc(CNC(=O)CCN2CC[C@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746463	GD	On-Demand	Anodyne	DRD4	25	42
COc1ccc(CNC(=O)CCN2CC[C@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746463	GD	On-Demand	Anodyne	HTR4	44	39
COc1ccc(CNC(=O)CCN2CC[C@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746463	GD	On-Demand	Anodyne	SIGMAR1	20	52
COc1ccc(CNC(=O)CCN2CC[C@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746463	GD	On-Demand	Anodyne	MTNR1A	49	43
COc1ccc(CNC(=O)CCN2CC[C@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746463	GD	On-Demand	Anodyne	MTNR1B	38	43
COc1ccc(CNC(=O)CCN2CC[C@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746463	GD	On-Demand	Anodyne	MCHR1	23	44
COc1ccc(CNC(=O)CCN2CC[C@@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746464	GD	On-Demand	Anodyne	DRD4	25	42
COc1ccc(CNC(=O)CCN2CC[C@@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746464	GD	On-Demand	Anodyne	HTR4	44	39
COc1ccc(CNC(=O)CCN2CC[C@@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746464	GD	On-Demand	Anodyne	SIGMAR1	20	52
COc1ccc(CNC(=O)CCN2CC[C@@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746464	GD	On-Demand	Anodyne	MTNR1A	49	43
COc1ccc(CNC(=O)CCN2CC[C@@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746464	GD	On-Demand	Anodyne	MTNR1B	38	43
COc1ccc(CNC(=O)CCN2CC[C@@H](NC(=O)NC3CC3)C2)c(OC)c1	ZINC000450746464	GD	On-Demand	Anodyne	MCHR1	23	44
O=C(NC1CC1)N[C@@H]1CCN(CC23CCC(CC2)C3)C1	ZINC000450746465	CE	On-Demand	Anodyne	EPHX2	27	42
O=C(NC1CC1)N[C@H]1CCN(CC23CCC(CC2)C3)C1	ZINC000450746466	CE	On-Demand	Anodyne	EPHX2	27	42
C[C@@H](O)CCN1CCN(c2cccc(C#N)n2)CC1	ZINC000450746480	CC	On-Demand	Mild	SORD	55	34
C[C@H](O)CCN1CCN(c2cccc(C#N)n2)CC1	ZINC000450746481	CC	On-Demand	Mild	SORD	55	34
CSCCCCCNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450746493	EF	On-Demand	Anodyne	FOLH1	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	ACE	20	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	SSTR2	58	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	OPRM1	17	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	GHRHR	32	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MME	27	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	EDNRB	43	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	EDNRA	42	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	TACR1	36	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MC4R	51	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	BMP1	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	TACR2	41	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	CCKAR	128	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	BRS3	27	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	NMBR	41	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MC3R	71	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MC5R	75	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MMP2	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MMP8	35	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MMP14	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	GRPR	74	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	ECE1	64	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MMP11	104	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	CCKBR	102	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	GHSR	84	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MMP9	27	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MC1R	101	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	MMP1	19	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	NPR	31	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	SLC15A2	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	KISS1R	76	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	ERAP2	44	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cn(CC2CC2)nn1	ZINC000450746495	FD	On-Demand	Anodyne	LASB	0	42
CCC[C@H](O)CN1CCN(c2cccc(C#N)n2)CC1	ZINC000450746496	CD	On-Demand	Mild	ACOX1	43	31
CCC[C@@H](O)CN1CCN(c2cccc(C#N)n2)CC1	ZINC000450746497	CD	On-Demand	Mild	ACOX1	43	31
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nccc(C(F)(F)F)n3)C2)CC1	ZINC000450746504	GE	On-Demand	Anodyne	RBP4	20	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nccc(C(F)(F)F)n3)C2)CC1	ZINC000450746504	GE	On-Demand	Anodyne	SLC6A7	0	45
CC(=O)N1CCCN(C[C@H]2CCCN(c3nccc(C(F)(F)F)n3)C2)CC1	ZINC000450746505	GE	On-Demand	Anodyne	RBP4	20	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3nccc(C(F)(F)F)n3)C2)CC1	ZINC000450746505	GE	On-Demand	Anodyne	SLC6A7	0	45
CCC(CC)Oc1ccc(C(=O)NCc2cccc(N3CCOCC3)n2)cc1	ZINC000450746514	GG	On-Demand	Anodyne	PIK3CD	20	40
CCC(CC)Oc1ccc(C(=O)NCc2cccc(N3CCOCC3)n2)cc1	ZINC000450746514	GG	On-Demand	Anodyne	PIK3CB	43	40
CCOC(=O)c1cc(C(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)on1	ZINC000450746525	EF	On-Demand	Anodyne	TRPC6	43	30
CCOC(=O)c1cc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)on1	ZINC000450746526	EF	On-Demand	Anodyne	TRPC6	43	30
CCOC(=O)c1cc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)on1	ZINC000450746527	EF	On-Demand	Anodyne	TRPC6	43	30
CCOC(=O)c1cc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)on1	ZINC000450746528	EF	On-Demand	Anodyne	TRPC6	43	30
CCOC(=O)c1ccc(CN(CC)[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746529	FG	On-Demand	Anodyne	CHRM2	17	43
CCOC(=O)c1ccc(CN(CC)[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746529	FG	On-Demand	Anodyne	ACHE	22	40
CCOC(=O)c1ccc(CN(CC)[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746529	FG	On-Demand	Anodyne	CHRM3	19	43
CCOC(=O)c1ccc(CN(CC)[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746529	FG	On-Demand	Anodyne	LTA4H	17	40
CCOC(=O)c1ccc(CN(CC)[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746529	FG	On-Demand	Anodyne	SSTR5	44	38
CCOC(=O)c1ccc(CN(CC)[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746529	FG	On-Demand	Anodyne	F2RL3	19	41
CCOC(=O)c1ccc(CN(CC)[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746530	FG	On-Demand	Anodyne	CHRM2	17	43
CCOC(=O)c1ccc(CN(CC)[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746530	FG	On-Demand	Anodyne	ACHE	22	40
CCOC(=O)c1ccc(CN(CC)[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746530	FG	On-Demand	Anodyne	CHRM3	19	43
CCOC(=O)c1ccc(CN(CC)[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746530	FG	On-Demand	Anodyne	LTA4H	17	40
CCOC(=O)c1ccc(CN(CC)[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746530	FG	On-Demand	Anodyne	SSTR5	44	38
CCOC(=O)c1ccc(CN(CC)[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000450746530	FG	On-Demand	Anodyne	F2RL3	19	41
Cc1ccc(F)c(CSc2nnnn2C[C@H]2CCCO2)c1	ZINC000450746531	DF	On-Demand	Anodyne	PDE8B	41	34
Cc1ccc(F)c(CSc2nnnn2C[C@@H]2CCCO2)c1	ZINC000450746532	DF	On-Demand	Anodyne	PDE8B	41	34
CSc1cccc(C(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450746533	EF	On-Demand	Anodyne	DRD4	40	32
Cc1onc(C2CC2)c1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746548	FG	On-Demand	Anodyne	SCN9A	0	49
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746563	GF	On-Demand	Anodyne	PPARG	15	42
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746563	GF	On-Demand	Anodyne	PPARA	19	42
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746563	GF	On-Demand	Anodyne	SCN9A	0	40
CO[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746563	GF	On-Demand	Anodyne	AMP1_PLAFQ	39	40
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746564	GF	On-Demand	Anodyne	PPARG	15	42
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746564	GF	On-Demand	Anodyne	PPARA	19	42
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746564	GF	On-Demand	Anodyne	SCN9A	0	40
CO[C@H](Cc1ccccc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450746564	GF	On-Demand	Anodyne	AMP1_PLAFQ	39	40
CCN(CCc1cscn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746569	DG	On-Demand	Anodyne	SCN5A	62	41
CCN(CCc1cscn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746570	DG	On-Demand	Anodyne	SCN5A	62	41
Cc1nc(C2CC2)ccc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450746571	DG	On-Demand	Anodyne	PLD1	48	38
Cc1nc(C2CC2)ccc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450746572	DG	On-Demand	Anodyne	PLD1	48	38
Cc1ccn2ncc(C(=O)NCCc3ccc(OCC(F)(F)F)nc3)c2c1	ZINC000450746573	GF	On-Demand	Anodyne	EPHB3	32	44
Cc1nccc(N2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)CC2)n1	ZINC000450746606	FH	On-Demand	Anodyne	SORD	70	39
Cc1nccc(N2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)CC2)n1	ZINC000450746607	FH	On-Demand	Anodyne	SORD	70	39
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cncc(Cl)c1	ZINC000450746642	DH	On-Demand	Anodyne	TRPC6	47	36
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cncc(Cl)c1	ZINC000450746643	DH	On-Demand	Anodyne	TRPC6	47	36
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cncc(Cl)c1	ZINC000450746644	DH	On-Demand	Anodyne	TRPC6	47	36
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cncc(Cl)c1	ZINC000450746645	DH	On-Demand	Anodyne	TRPC6	47	36
COc1ccccc1Oc1ccc(C(=O)NCCCCCSC)nc1	ZINC000450746652	FI	On-Demand	Anodyne	DRD2	21	41
COc1ccccc1Oc1ccc(C(=O)NCCCCCSC)nc1	ZINC000450746652	FI	On-Demand	Anodyne	DRD3	42	45
COCCOC[C@H](O)CN1CC[C@@H](Cc2ccc(C(C)C)cc2)C1	ZINC000450746662	EF	On-Demand	Anodyne	O19067_PIG	0	40
COCCOC[C@@H](O)CN1CC[C@@H](Cc2ccc(C(C)C)cc2)C1	ZINC000450746663	EF	On-Demand	Anodyne	O19067_PIG	0	40
COCCOC[C@@H](O)CN1CC[C@H](Cc2ccc(C(C)C)cc2)C1	ZINC000450746664	EF	On-Demand	Anodyne	O19067_PIG	0	40
COCCOC[C@H](O)CN1CC[C@H](Cc2ccc(C(C)C)cc2)C1	ZINC000450746665	EF	On-Demand	Anodyne	O19067_PIG	0	40
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccnn1CC(F)(F)F	ZINC000450746678	EG	On-Demand	Anodyne	TRPC6	42	30
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccnn1CC(F)(F)F	ZINC000450746679	EG	On-Demand	Anodyne	TRPC6	42	30
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccnn1CC(F)(F)F	ZINC000450746680	EG	On-Demand	Anodyne	TRPC6	42	30
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccnn1CC(F)(F)F	ZINC000450746681	EG	On-Demand	Anodyne	TRPC6	42	30
Cc1cncc(-c2nc(CN3CCCC[C@@H]3c3ccccc3)no2)c1	ZINC000450746693	EI	On-Demand	Anodyne	COLA	46	41
Cc1cncc(-c2nc(CN3CCCC[C@@H]3c3ccccc3)no2)c1	ZINC000450746693	EI	On-Demand	Anodyne	CPT1A	45	41
Cc1cncc(-c2nc(CN3CCCC[C@H]3c3ccccc3)no2)c1	ZINC000450746694	EI	On-Demand	Anodyne	COLA	46	41
Cc1cncc(-c2nc(CN3CCCC[C@H]3c3ccccc3)no2)c1	ZINC000450746694	EI	On-Demand	Anodyne	CPT1A	45	41
CCN(C)C(=O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450746695	DE	On-Demand	Anodyne	PPARD	27	42
CCN(C)C(=O)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450746695	DE	On-Demand	Anodyne	CCR2	43	38
CCC[C@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450746697	CC	On-Demand	Anodyne	EPHX2	21	48
CCC[C@@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450746698	CC	On-Demand	Anodyne	EPHX2	21	48
CCC[C@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450746699	CC	On-Demand	Anodyne	EPHX2	21	48
CCC[C@@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450746700	CC	On-Demand	Anodyne	EPHX2	21	48
Cc1cc(C(=O)Nc2cccc(C(C)(C)C)c2O)nn1C(C)C	ZINC000450746705	DI	On-Demand	Anodyne	NPY5R	15	41
CCc1cc(CCCN2CCN(c3cccc(C#N)n3)CC2)on1	ZINC000450746706	EE	On-Demand	Mild	DRD3	19	44
O=C(Nc1cnn(-c2ccccc2)c1C(F)(F)F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450746709	FI	On-Demand	Anodyne	RBP4	52	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450746710	FJ	On-Demand	Anodyne	CACNA1B	49	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450746710	FJ	On-Demand	Anodyne	LIPG	53	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450746711	FJ	On-Demand	Anodyne	CACNA1B	49	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450746711	FJ	On-Demand	Anodyne	LIPG	53	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450746712	FJ	On-Demand	Anodyne	CACNA1B	49	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450746712	FJ	On-Demand	Anodyne	LIPG	53	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450746713	FJ	On-Demand	Anodyne	CACNA1B	49	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450746713	FJ	On-Demand	Anodyne	LIPG	53	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	ACE	21	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	SSTR2	66	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	GHRHR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MME	28	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	EDNRB	52	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	EDNRA	33	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	TACR1	38	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MC4R	59	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	CCKAR	113	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	CTSL	27	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	BCHE	15	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	BRS3	27	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	NMBR	51	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MC3R	68	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MC5R	74	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MMP2	27	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MMP8	35	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	GRPR	88	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	ECE1	67	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	LNPEP	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MMP11	100	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	CCKBR	86	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	GHSR	79	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MMP9	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MC1R	100	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	MMP1	19	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	NPR	30	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	KISS1R	76	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc2n(n1)CCCC2	ZINC000450746720	FE	On-Demand	Anodyne	ERAP2	45	40
CS(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450746721	DE	On-Demand	Anodyne	HRH3	22	41
CS(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450746721	DE	On-Demand	Anodyne	SIGMAR1	22	50
CS(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450746721	DE	On-Demand	Anodyne	BIRC2	60	48
CS(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450746722	DE	On-Demand	Anodyne	HRH3	22	41
CS(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450746722	DE	On-Demand	Anodyne	SIGMAR1	22	50
CS(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450746722	DE	On-Demand	Anodyne	BIRC2	60	48
CCN(C[C@H]1COCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746728	DD	On-Demand	Anodyne	DRD4	23	41
CCN(C[C@H]1COCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746728	DD	On-Demand	Anodyne	DRD3	0	40
CCN(C[C@@H]1COCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746729	DD	On-Demand	Anodyne	DRD4	23	41
CCN(C[C@@H]1COCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746729	DD	On-Demand	Anodyne	DRD3	0	40
CCN(C[C@H]1COCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746730	DD	On-Demand	Anodyne	DRD4	23	41
CCN(C[C@H]1COCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746730	DD	On-Demand	Anodyne	DRD3	0	40
CCN(C[C@@H]1COCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746731	DD	On-Demand	Anodyne	DRD4	23	41
CCN(C[C@@H]1COCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746731	DD	On-Demand	Anodyne	DRD3	0	40
COc1cc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)ncn1	ZINC000450746732	GE	On-Demand	Anodyne	DRD2	23	44
COc1cc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)ncn1	ZINC000450746732	GE	On-Demand	Anodyne	DRD4	32	42
COc1cc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)ncn1	ZINC000450746732	GE	On-Demand	Anodyne	DRD3	24	40
COc1cc(N2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)ncn1	ZINC000450746732	GE	On-Demand	Anodyne	SIGMAR1	22	41
CCN(CCC1CC1)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450746733	CG	On-Demand	Anodyne	AMY2	41	36
CCN(CCC1CC1)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450746734	CG	On-Demand	Anodyne	AMY2	41	36
CCN(CCC1CC1)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450746735	CG	On-Demand	Anodyne	AMY2	41	36
CCN(CCC1CC1)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450746736	CG	On-Demand	Anodyne	AMY2	41	36
CSCCCCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450746737	DG	On-Demand	Anodyne	CTSV	46	31
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	ACE	22	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	SSTR2	55	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	OPRM1	15	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	GHRHR	29	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MME	32	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	EDNRB	57	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	EDNRA	42	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	TACR1	34	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MC4R	56	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	CTSB	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	PAPA1_CARPA	15	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	CCKAR	117	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	CTSL	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	BRS3	29	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	NMBR	59	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MC3R	74	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MC5R	73	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MMP2	31	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MMP8	47	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MMP14	25	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	GRPR	99	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	ECE1	69	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	REN1	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	LNPEP	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	SSTR3	24	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MMP11	93	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	CCKBR	77	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	GHSR	81	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	CAPN1	15	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MMP9	30	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MC1R	108	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	ADAM9	44	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	AKT1	50	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MMP7	19	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	MMP1	25	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	NPR	37	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	ADAM12	15	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	KISS1R	84	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	ERAP2	49	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	TMPRSS6	16	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450746740	FE	On-Demand	Anodyne	HPN	22	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	ACE	22	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	SSTR2	55	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	OPRM1	15	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	GHRHR	29	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MME	32	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	EDNRB	57	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	EDNRA	42	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	TACR1	34	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MC4R	56	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	CTSB	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	PAPA1_CARPA	15	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	CCKAR	117	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	CTSL	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	BRS3	29	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	NMBR	59	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MC3R	74	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MC5R	73	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MMP2	31	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MMP8	47	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MMP14	25	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	GRPR	99	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	ECE1	69	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	REN1	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	LNPEP	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	SSTR3	24	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MMP11	93	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	CCKBR	77	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	GHSR	81	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	CAPN1	15	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MMP9	30	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MC1R	108	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	ADAM9	44	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	AKT1	50	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MMP7	19	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	MMP1	25	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	NPR	37	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	ADAM12	15	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	KISS1R	84	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	ERAP2	49	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	TMPRSS6	16	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450746741	FE	On-Demand	Anodyne	HPN	22	44
CC(=O)CCCCCSc1nnnn1C[C@H]1CCCO1	ZINC000450746744	CE	On-Demand	Anodyne	PDE8B	40	36
CC(=O)CCCCCSc1nnnn1C[C@@H]1CCCO1	ZINC000450746745	CE	On-Demand	Anodyne	PDE8B	40	36
CCN(C)C(=O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450746749	FE	On-Demand	Anodyne	CHRM3	15	43
CCN(C)C(=O)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450746749	FE	On-Demand	Anodyne	MMP13	15	51
CC(C)Cn1cc(C(=O)NCc2cccc(N3CCOCC3)n2)c(C(F)F)n1	ZINC000450746750	GF	On-Demand	Anodyne	PIK3CB	55	35
CCOC(=O)c1ccc(CSc2nnnn2C[C@H]2CCCO2)nc1	ZINC000450746773	ED	On-Demand	Anodyne	PDE8B	49	36
CCOC(=O)c1ccc(CSc2nnnn2C[C@@H]2CCCO2)nc1	ZINC000450746774	ED	On-Demand	Anodyne	PDE8B	49	36
Cc1ccn2ncc(C(=O)N3CCC[C@H](C(F)(F)F)[C@@H]3C)c2c1	ZINC000450746779	EG	On-Demand	Anodyne	HCRTR1	46	41
Cc1ccn2ncc(C(=O)N3CCC[C@H](C(F)(F)F)[C@@H]3C)c2c1	ZINC000450746779	EG	On-Demand	Anodyne	EPHB3	24	41
Cc1ccn2ncc(C(=O)N3CCC[C@@H](C(F)(F)F)[C@H]3C)c2c1	ZINC000450746785	EG	On-Demand	Anodyne	HCRTR1	46	41
Cc1ccn2ncc(C(=O)N3CCC[C@@H](C(F)(F)F)[C@H]3C)c2c1	ZINC000450746785	EG	On-Demand	Anodyne	EPHB3	24	41
COc1cc(CN2CCC(C)(CN3CCN(C)CC3)CC2)ccc1Cl	ZINC000450746786	FG	On-Demand	Anodyne	SIGMAR1	29	40
Cc1ccn2ncc(C(=O)N3CCC[C@@H](C(F)(F)F)[C@@H]3C)c2c1	ZINC000450746788	EG	On-Demand	Anodyne	HCRTR1	46	41
Cc1ccn2ncc(C(=O)N3CCC[C@@H](C(F)(F)F)[C@@H]3C)c2c1	ZINC000450746788	EG	On-Demand	Anodyne	EPHB3	24	41
Cc1ccn2ncc(C(=O)N3CCC[C@H](C(F)(F)F)[C@H]3C)c2c1	ZINC000450746789	EG	On-Demand	Anodyne	HCRTR1	46	41
Cc1ccn2ncc(C(=O)N3CCC[C@H](C(F)(F)F)[C@H]3C)c2c1	ZINC000450746789	EG	On-Demand	Anodyne	EPHB3	24	41
COCCOC[C@@H](O)CN1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450746818	EG	On-Demand	Anodyne	ADRB2	22	44
COCCOC[C@@H](O)CN1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450746818	EG	On-Demand	Anodyne	ADRB3	31	44
COCCOC[C@@H](O)CN1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450746818	EG	On-Demand	Anodyne	ABCB1	30	48
COCCOC[C@@H](O)CN1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450746818	EG	On-Demand	Anodyne	O19067_PIG	0	47
COCCOC[C@H](O)CN1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450746822	EG	On-Demand	Anodyne	ADRB2	22	44
COCCOC[C@H](O)CN1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450746822	EG	On-Demand	Anodyne	ADRB3	31	44
COCCOC[C@H](O)CN1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450746822	EG	On-Demand	Anodyne	ABCB1	30	48
COCCOC[C@H](O)CN1CCC(Cc2ccc(C(C)C)cc2)CC1	ZINC000450746822	EG	On-Demand	Anodyne	O19067_PIG	0	47
CCO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@H]1C	ZINC000450746823	CE	On-Demand	Anodyne	P2RY12	32	46
CCO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@H]1C	ZINC000450746823	CE	On-Demand	Anodyne	CXCR3	37	51
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	CHRM2	16	40
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	CHRM1	18	40
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	DRD2	17	50
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	DRD4	41	50
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	CHRM3	23	40
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	LTA4H	15	40
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	SIGMAR1	44	48
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	CCR3	37	45
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	CCR2	15	40
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	MCHR1	34	49
O=C(NC1CC1)N[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746829	FE	On-Demand	Anodyne	BIRC2	48	41
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	CHRM2	16	40
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	CHRM1	18	40
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	DRD2	17	50
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	DRD4	41	50
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	CHRM3	23	40
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	LTA4H	15	40
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	SIGMAR1	44	48
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	CCR3	37	45
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	CCR2	15	40
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	MCHR1	34	49
O=C(NC1CC1)N[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450746830	FE	On-Demand	Anodyne	BIRC2	48	41
CC(C)(C)OC1CC(Sc2nnnn2C[C@@H]2CCCO2)C1	ZINC000450746835	DE	On-Demand	Anodyne	PDE8B	41	39
CC(C)(C)OC1CC(Sc2nnnn2C[C@H]2CCCO2)C1	ZINC000450746836	DE	On-Demand	Anodyne	PDE8B	41	39
CSCCCCCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450746840	EG	On-Demand	Bother	TBXAS1	0	40
CCO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1C	ZINC000450746842	CE	On-Demand	Anodyne	P2RY12	32	46
CCO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1C	ZINC000450746842	CE	On-Demand	Anodyne	CXCR3	37	51
CCO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1C	ZINC000450746843	CE	On-Demand	Anodyne	P2RY12	32	46
CCO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1C	ZINC000450746843	CE	On-Demand	Anodyne	CXCR3	37	51
CCO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@H]1C	ZINC000450746844	CE	On-Demand	Anodyne	P2RY12	32	46
CCO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@H]1C	ZINC000450746844	CE	On-Demand	Anodyne	CXCR3	37	51
CC[C@H]1CN(Cc2nnc(C3CC3)s2)CCN1Cc1ccccc1	ZINC000450746853	EH	On-Demand	Anodyne	SIGMAR1	17	49
CC[C@@H]1CN(Cc2nnc(C3CC3)s2)CCN1Cc1ccccc1	ZINC000450746854	EH	On-Demand	Anodyne	SIGMAR1	17	49
CCO[C@@H]1CCN(c2c(C)cnc3c(OC)cccc23)C[C@H]1C	ZINC000450746857	DH	On-Demand	Anodyne	PDE3B	57	34
CCO[C@@H]1CCN(c2c(C)cnc3c(OC)cccc23)C[C@@H]1C	ZINC000450746858	DH	On-Demand	Anodyne	PDE3B	57	34
CCO[C@H]1CCN(c2c(C)cnc3c(OC)cccc23)C[C@@H]1C	ZINC000450746859	DH	On-Demand	Anodyne	PDE3B	57	34
CCO[C@H]1CCN(c2c(C)cnc3c(OC)cccc23)C[C@H]1C	ZINC000450746860	DH	On-Demand	Anodyne	PDE3B	57	34
CCS(=O)(=O)c1ccc(CNC2(Cc3ccccc3)CCCC2)cc1	ZINC000450746872	FI	On-Demand	Anodyne	RORC	31	40
CC[C@@H](CC(F)(F)F)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000450746877	GJ	On-Demand	Anodyne	MST1R	46	36
CC[C@H](CC(F)(F)F)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000450746886	GJ	On-Demand	Anodyne	MST1R	46	36
O=C(NCc1nc(C(F)(F)F)n[nH]1)[C@H]1CCN(c2ccccc2)C1	ZINC000450746889	ED	On-Demand	Anodyne	GPBAR1	36	42
O=C(NCc1nc(C(F)(F)F)n[nH]1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450746891	ED	On-Demand	Anodyne	GPBAR1	36	42
C/C=C\COc1cccc(CC(=O)NCC(=O)N(C)CC)c1	ZINC000450746908	DD	On-Demand	Anodyne	CRTM	44	34
C[C@@H]1C[C@@H](c2cccnc2)N(CC2=CCCCC2)C1	ZINC000450746919	CH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@@H](c2cccnc2)N(CC2=CCCCC2)C1	ZINC000450746919	CH	On-Demand	Anodyne	CRTY	0	40
C[C@@H]1C[C@H](c2cccnc2)N(CC2=CCCCC2)C1	ZINC000450746920	CH	On-Demand	Anodyne	CHRNA2	39	40
C[C@@H]1C[C@H](c2cccnc2)N(CC2=CCCCC2)C1	ZINC000450746920	CH	On-Demand	Anodyne	CRTY	0	40
C[C@H]1C[C@H](c2cccnc2)N(CC2=CCCCC2)C1	ZINC000450746921	CH	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@H](c2cccnc2)N(CC2=CCCCC2)C1	ZINC000450746921	CH	On-Demand	Anodyne	CRTY	0	40
C[C@H]1C[C@@H](c2cccnc2)N(CC2=CCCCC2)C1	ZINC000450746922	CH	On-Demand	Anodyne	CHRNA2	39	40
C[C@H]1C[C@@H](c2cccnc2)N(CC2=CCCCC2)C1	ZINC000450746922	CH	On-Demand	Anodyne	CRTY	0	40
C[C@H](O)CCN1CCCC[C@@H]1c1ccccc1	ZINC000450746940	BF	On-Demand	Anodyne	HSD17B2	62	35
C[C@@H](O)CCN1CCCC[C@H]1c1ccccc1	ZINC000450746941	BF	On-Demand	Anodyne	HSD17B2	62	35
C[C@@H](O)CCN1CCCC[C@@H]1c1ccccc1	ZINC000450746942	BF	On-Demand	Anodyne	HSD17B2	62	35
C[C@H](O)CCN1CCCC[C@H]1c1ccccc1	ZINC000450746943	BF	On-Demand	Anodyne	HSD17B2	62	35
CCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746950	GH	On-Demand	Anodyne	DRD2	0	41
CCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746950	GH	On-Demand	Anodyne	ACHE	26	47
CCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746950	GH	On-Demand	Anodyne	SIGMAR1	46	42
CCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450746950	GH	On-Demand	Anodyne	CCR5	49	44
CCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746951	GH	On-Demand	Anodyne	DRD2	0	41
CCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746951	GH	On-Demand	Anodyne	ACHE	26	47
CCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746951	GH	On-Demand	Anodyne	SIGMAR1	46	42
CCN(Cc1ccc(S(=O)(=O)CC)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450746951	GH	On-Demand	Anodyne	CCR5	49	44
C/C=C\COc1cccc(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000450746979	FF	On-Demand	Anodyne	PDS	47	35
C/C=C/COc1cccc(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000450746980	FF	On-Demand	Anodyne	PDS	47	35
COc1cc(N2CCN(Cc3cccnc3N)CC2)ncn1	ZINC000450746996	DC	On-Demand	Anodyne	DRD4	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	SSTR2	61	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	GNRHR	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	OPRD1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MME	28	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	EDNRB	51	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	EDNRA	48	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	TACR1	29	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	BMP1	30	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	TACR2	48	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	CCKAR	100	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	CTSL	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	BRS3	24	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MC3R	53	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MC5R	56	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MMP2	26	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MMP8	39	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MMP14	23	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	GRPR	48	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	ECE1	64	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MMP11	72	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	CCKBR	81	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	GHSR	79	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MMP9	24	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	ADAM9	43	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	C5AR1	31	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MMP7	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	MMP1	24	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	NPR	35	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	SLC15A2	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	KISS1R	65	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	ERAP2	45	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	ERAP1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450747007	EG	On-Demand	Anodyne	LASB	0	47
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	ACE	25	52
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	SSTR2	66	45
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	OPRM1	0	49
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	OPRD1	0	49
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	GHRHR	31	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MME	34	50
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	EDNRB	58	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	EDNRA	41	47
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	TACR1	30	55
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MC4R	44	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	BMP1	43	50
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	TACR2	25	52
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	CTSB	17	47
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	CCKAR	101	39
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	CTSL	34	47
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	BRS3	25	46
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	NMBR	61	32
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MC3R	59	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MC5R	63	38
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MMP2	29	49
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MMP8	49	49
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MMP14	27	47
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	GRPR	93	39
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	ECE1	68	51
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	REN	15	40
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	REN1	24	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	LNPEP	29	43
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	SSTR3	27	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MMP11	85	44
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	CCKBR	73	44
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	GHSR	78	49
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MMP9	25	58
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MC1R	77	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	ADAM9	48	49
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	CTSC	19	48
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MMP7	31	48
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MMP1	25	52
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	NPR	36	50
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	ADAM12	16	49
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	MAGI3	0	43
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	SLC15A2	0	55
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	KISS1R	66	39
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	ERAP2	49	45
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	ERAP1	0	45
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	LASB	0	48
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	CD36	0	40
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	NRDE	0	42
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747009	FG	On-Demand	Anodyne	IL1RN	0	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	ACE	25	52
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	SSTR2	66	45
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	OPRM1	0	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	OPRD1	0	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	GHRHR	31	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MME	34	50
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	EDNRB	58	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	EDNRA	41	47
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	TACR1	30	55
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MC4R	44	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	BMP1	43	50
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	TACR2	25	52
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	CTSB	17	47
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	CCKAR	101	39
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	CTSL	34	47
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	BRS3	25	46
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	NMBR	61	32
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MC3R	59	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MC5R	63	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MMP2	29	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MMP8	49	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MMP14	27	47
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	GRPR	93	39
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	ECE1	68	51
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	REN	15	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	REN1	24	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	LNPEP	29	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	SSTR3	27	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MMP11	85	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	CCKBR	73	44
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	GHSR	78	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MMP9	25	58
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MC1R	77	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	ADAM9	48	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	CTSC	19	48
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MMP7	31	48
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MMP1	25	52
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	NPR	36	50
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	ADAM12	16	49
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	MAGI3	0	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	SLC15A2	0	55
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	KISS1R	66	39
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	ERAP2	49	45
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	ERAP1	0	45
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	LASB	0	48
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	CD36	0	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	NRDE	0	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747010	FG	On-Demand	Anodyne	IL1RN	0	43
CSCCCCCNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450747013	DI	On-Demand	Anodyne	PPARA	15	40
CSCCCCCNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450747013	DI	On-Demand	Anodyne	SORT1	15	40
CCN(C)C(=O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450747018	CC	On-Demand	Anodyne	NCE103	26	41
CCN(C)C(=O)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450747018	CC	On-Demand	Anodyne	CAN2	0	41
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450747025	EE	On-Demand	Anodyne	P2RX7	29	40
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450747025	EE	On-Demand	Anodyne	PIK3CA	31	44
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450747025	EE	On-Demand	Anodyne	PIK3CD	44	44
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450747025	EE	On-Demand	Anodyne	PIK3CB	84	44
Cc1ccc(F)c(CC(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450747025	EE	On-Demand	Anodyne	STAT6	41	35
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747026	DD	On-Demand	Anodyne	DRD4	23	45
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747026	DD	On-Demand	Anodyne	OPRK1	22	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747026	DD	On-Demand	Anodyne	SIGMAR1	27	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747026	DD	On-Demand	Anodyne	CCR3	26	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747026	DD	On-Demand	Anodyne	CCR5	39	45
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747026	DD	On-Demand	Anodyne	EPHX2	36	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747026	DD	On-Demand	Anodyne	BIRC2	53	45
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747027	DD	On-Demand	Anodyne	DRD4	23	45
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747027	DD	On-Demand	Anodyne	OPRK1	22	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747027	DD	On-Demand	Anodyne	SIGMAR1	27	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747027	DD	On-Demand	Anodyne	CCR3	26	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747027	DD	On-Demand	Anodyne	CCR5	39	45
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747027	DD	On-Demand	Anodyne	EPHX2	36	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747027	DD	On-Demand	Anodyne	BIRC2	53	45
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747028	DD	On-Demand	Anodyne	DRD4	23	45
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747028	DD	On-Demand	Anodyne	OPRK1	22	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747028	DD	On-Demand	Anodyne	SIGMAR1	27	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747028	DD	On-Demand	Anodyne	CCR3	26	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747028	DD	On-Demand	Anodyne	CCR5	39	45
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747028	DD	On-Demand	Anodyne	EPHX2	36	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450747028	DD	On-Demand	Anodyne	BIRC2	53	45
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747029	DD	On-Demand	Anodyne	DRD4	23	45
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747029	DD	On-Demand	Anodyne	OPRK1	22	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747029	DD	On-Demand	Anodyne	SIGMAR1	27	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747029	DD	On-Demand	Anodyne	CCR3	26	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747029	DD	On-Demand	Anodyne	CCR5	39	45
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747029	DD	On-Demand	Anodyne	EPHX2	36	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450747029	DD	On-Demand	Anodyne	BIRC2	53	45
COC(=O)c1cn([C@@H]2CCCN(CC3CC(F)(F)C3)C2)nn1	ZINC000450747035	DD	On-Demand	Anodyne	CCR3	61	32
COC(=O)c1cn([C@H]2CCCN(CC3CC(F)(F)C3)C2)nn1	ZINC000450747036	DD	On-Demand	Anodyne	CCR3	61	32
C[C@H](CN1CCCCCC1)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450747047	DE	On-Demand	Anodyne	PLD1	41	34
C[C@@H](CN1CCCCCC1)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450747048	DE	On-Demand	Anodyne	PLD1	41	34
CCO[C@H]1CCN(c2ccnc(C(N)=O)c2)C[C@@H]1C	ZINC000450747052	CD	On-Demand	Anodyne	SIRT2	44	31
CCO[C@@H]1CCN(c2ccnc(C(N)=O)c2)C[C@@H]1C	ZINC000450747053	CD	On-Demand	Anodyne	SIRT2	44	31
CCO[C@H]1CCN(c2ccnc(C(N)=O)c2)C[C@H]1C	ZINC000450747054	CD	On-Demand	Anodyne	SIRT2	44	31
CCO[C@@H]1CCN(c2ccnc(C(N)=O)c2)C[C@H]1C	ZINC000450747055	CD	On-Demand	Anodyne	SIRT2	44	31
COc1ccc(CNC(=O)CCn2nnn(-c3ccccc3)c2=O)c(OC)c1	ZINC000450747081	GD	On-Demand	Anodyne	MTNR1A	60	36
COc1ccc(CNC(=O)CCn2nnn(-c3ccccc3)c2=O)c(OC)c1	ZINC000450747081	GD	On-Demand	Anodyne	MTNR1B	53	36
CCO[C@H]1CCN(c2ncncc2-c2ccccc2)C[C@H]1C	ZINC000450747091	CG	On-Demand	Anodyne	SLC9A1	20	49
CCO[C@@H]1CCN(c2ncncc2-c2ccccc2)C[C@H]1C	ZINC000450747092	CG	On-Demand	Anodyne	SLC9A1	20	49
CCO[C@@H]1CCN(c2ncncc2-c2ccccc2)C[C@@H]1C	ZINC000450747093	CG	On-Demand	Anodyne	SLC9A1	20	49
CCO[C@H]1CCN(c2ncncc2-c2ccccc2)C[C@@H]1C	ZINC000450747094	CG	On-Demand	Anodyne	SLC9A1	20	49
Fc1cnc(N2CCN(CC/C=C/c3ccccc3)CC2)nc1	ZINC000450747099	DF	On-Demand	Anodyne	HTR1A	17	52
Fc1cnc(N2CCN(CC/C=C/c3ccccc3)CC2)nc1	ZINC000450747099	DF	On-Demand	Anodyne	DRD4	21	42
Fc1cnc(N2CCN(CC/C=C\c3ccccc3)CC2)nc1	ZINC000450747100	DF	On-Demand	Anodyne	HTR1A	17	52
Fc1cnc(N2CCN(CC/C=C\c3ccccc3)CC2)nc1	ZINC000450747100	DF	On-Demand	Anodyne	DRD4	21	42
Brc1cccc(OC2CCN(C[C@H]3COCCO3)CC2)c1	ZINC000450747118	FF	On-Demand	Anodyne	HRH1	18	43
Brc1cccc(OC2CCN(C[C@H]3COCCO3)CC2)c1	ZINC000450747118	FF	On-Demand	Anodyne	CCR3	16	43
Brc1cccc(OC2CCN(C[C@@H]3COCCO3)CC2)c1	ZINC000450747119	FF	On-Demand	Anodyne	HRH1	18	43
Brc1cccc(OC2CCN(C[C@@H]3COCCO3)CC2)c1	ZINC000450747119	FF	On-Demand	Anodyne	CCR3	16	43
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450747120	EC	On-Demand	Anodyne	DRD4	40	31
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450747120	EC	On-Demand	Anodyne	HTR7	34	42
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450747120	EC	On-Demand	Anodyne	MTNR1A	41	39
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450747120	EC	On-Demand	Anodyne	MTNR1B	40	40
O=C(Cc1ccc(O)c(F)c1)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450747123	FF	On-Demand	Anodyne	NCE103	24	41
O=C(Cc1ccc(O)c(F)c1)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450747123	FF	On-Demand	Anodyne	CAN2	0	41
CC[C@H](O)CC(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450747124	ED	On-Demand	Anodyne	CCR3	40	31
CC[C@H](O)CC(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450747125	ED	On-Demand	Anodyne	CCR3	40	31
CC[C@@H](O)CC(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450747126	ED	On-Demand	Anodyne	CCR3	40	31
CC[C@@H](O)CC(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450747127	ED	On-Demand	Anodyne	CCR3	40	31
CCOC(=O)c1ccc(CN2CCO[C@@H](CCc3ccccc3)C2)nc1	ZINC000450747128	FG	On-Demand	Anodyne	DRD4	15	52
CCOC(=O)c1ccc(CN2CCO[C@H](CCc3ccccc3)C2)nc1	ZINC000450747129	FG	On-Demand	Anodyne	DRD4	15	52
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	ACE	49	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	OPRK1	25	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	MME	90	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	ANPEP	47	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	FCER2	41	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	KCNQ2	45	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	CTSB	41	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	PAPA1_CARPA	47	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	CYSP_TRYCR	48	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	CAPNS1	69	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	REN	40	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	ABCB1	31	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	CAPN1	70	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	CAPN2	59	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	ACE2	85	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	FPR1	44	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	POL	0	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	NPR	48	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	BIRC2	44	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	PSMB8	65	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	Q6PRC7_IXORI	40	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747130	DF	On-Demand	Anodyne	DERP1	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	ACE	49	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	OPRK1	25	45
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	MME	90	45
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	ANPEP	47	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	FCER2	41	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	KCNQ2	45	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	CTSB	41	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	PAPA1_CARPA	47	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	CYSP_TRYCR	48	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	CAPNS1	69	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	REN	40	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	ABCB1	31	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	CAPN1	70	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	CAPN2	59	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	ACE2	85	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	FPR1	44	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	POL	0	45
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	NPR	48	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	BIRC2	44	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	PSMB8	65	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	Q6PRC7_IXORI	40	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747131	DF	On-Demand	Anodyne	DERP1	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	ACE	49	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	OPRK1	25	45
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	MME	90	45
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	ANPEP	47	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	FCER2	41	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	KCNQ2	45	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	CTSB	41	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	PAPA1_CARPA	47	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	CYSP_TRYCR	48	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	CAPNS1	69	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	REN	40	40
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	ABCB1	31	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	CAPN1	70	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	CAPN2	59	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	ACE2	85	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	FPR1	44	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	POL	0	45
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	NPR	48	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	BIRC2	44	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	PSMB8	65	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	Q6PRC7_IXORI	40	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747132	DF	On-Demand	Anodyne	DERP1	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	ACE	49	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	OPRK1	25	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	MME	90	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	ANPEP	47	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	FCER2	41	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	KCNQ2	45	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	CTSB	41	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	PAPA1_CARPA	47	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	CYSP_TRYCR	48	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	CAPNS1	69	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	REN	40	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	ABCB1	31	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	CAPN1	70	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	CAPN2	59	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	ACE2	85	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	FPR1	44	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	POL	0	45
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	NPR	48	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	BIRC2	44	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	PSMB8	65	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	Q6PRC7_IXORI	40	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747133	DF	On-Demand	Anodyne	DERP1	0	41
N#Cc1ncn(CCCCc2ccc(Cl)c(Cl)c2)n1	ZINC000450747134	CG	On-Demand	Mild	Q6R7Z5_9TRYP	0	41
C[C@@]1(C(N)=O)CCCCN1CCCC(=O)c1ccccc1	ZINC000450747135	CE	On-Demand	Anodyne	CYP2J2	52	37
C[C@]1(C(N)=O)CCCCN1CCCC(=O)c1ccccc1	ZINC000450747136	CE	On-Demand	Anodyne	CYP2J2	52	37
COc1ccc(-c2cc3ncn(CC4CC(F)(F)C4)c(=O)c3s2)cc1	ZINC000450747137	FI	On-Demand	Anodyne	MCHR1	37	48
C[C@@H](OCc1ccc(F)cc1)C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450747146	EE	On-Demand	Anodyne	TRPV1	66	36
C[C@H](OCc1ccc(F)cc1)C(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450747147	EE	On-Demand	Anodyne	TRPV1	66	36
CC1(CO)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450747178	DF	On-Demand	Anodyne	SIGMAR1	44	39
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747179	EH	On-Demand	Anodyne	SFRP1	61	40
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747179	EH	On-Demand	Anodyne	WNT3	45	33
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747180	EH	On-Demand	Anodyne	SFRP1	61	40
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747180	EH	On-Demand	Anodyne	WNT3	45	33
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747181	EH	On-Demand	Anodyne	SFRP1	61	40
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747181	EH	On-Demand	Anodyne	WNT3	45	33
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747182	EH	On-Demand	Anodyne	SFRP1	61	40
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747182	EH	On-Demand	Anodyne	WNT3	45	33
COC(=O)c1cn([C@H]2CCN(Cc3cccc(C(C)=O)c3)C2)nn1	ZINC000450747190	ED	On-Demand	Anodyne	CCR3	53	41
COC(=O)c1cn([C@@H]2CCN(Cc3cccc(C(C)=O)c3)C2)nn1	ZINC000450747191	ED	On-Demand	Anodyne	CCR3	53	41
COC(=O)c1cn([C@@H]2CCN(Cc3ccn(CCc4ccccc4)n3)C2)nn1	ZINC000450747194	GD	On-Demand	Anodyne	DRD4	25	40
COC(=O)c1cn([C@@H]2CCN(Cc3ccn(CCc4ccccc4)n3)C2)nn1	ZINC000450747194	GD	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1cn([C@@H]2CCN(Cc3ccn(CCc4ccccc4)n3)C2)nn1	ZINC000450747194	GD	On-Demand	Anodyne	FAS	19	40
COC(=O)c1cn([C@H]2CCN(Cc3ccn(CCc4ccccc4)n3)C2)nn1	ZINC000450747195	GD	On-Demand	Anodyne	DRD4	25	40
COC(=O)c1cn([C@H]2CCN(Cc3ccn(CCc4ccccc4)n3)C2)nn1	ZINC000450747195	GD	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1cn([C@H]2CCN(Cc3ccn(CCc4ccccc4)n3)C2)nn1	ZINC000450747195	GD	On-Demand	Anodyne	FAS	19	40
COCCOC[C@H](O)CN1CCN(c2cc(OC)ncn2)CC1	ZINC000450747196	EB	On-Demand	Anodyne	ABCB1	45	35
COCCOC[C@H](O)CN1CCN(c2cc(OC)ncn2)CC1	ZINC000450747196	EB	On-Demand	Anodyne	HSP90AB1	43	46
COCCOC[C@@H](O)CN1CCN(c2cc(OC)ncn2)CC1	ZINC000450747197	EB	On-Demand	Anodyne	ABCB1	45	35
COCCOC[C@@H](O)CN1CCN(c2cc(OC)ncn2)CC1	ZINC000450747197	EB	On-Demand	Anodyne	HSP90AB1	43	46
O=C(N[C@H](Cc1ccccn1)c1ccccc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450747203	FI	On-Demand	Anodyne	CCR5	23	40
O=C(N[C@H](Cc1ccccn1)c1ccccc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450747204	FI	On-Demand	Anodyne	CCR5	23	40
O=C(N[C@@H](Cc1ccccn1)c1ccccc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450747205	FI	On-Demand	Anodyne	CCR5	23	40
O=C(N[C@@H](Cc1ccccn1)c1ccccc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450747206	FI	On-Demand	Anodyne	CCR5	23	40
O=C(NC1CC1)N[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747212	CF	On-Demand	Anodyne	SLC6A1	72	38
O=C(NC1CC1)N[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747212	CF	On-Demand	Anodyne	SIGMAR1	33	45
O=C(NC1CC1)N[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747212	CF	On-Demand	Anodyne	CCR3	26	40
O=C(NC1CC1)N[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747212	CF	On-Demand	Anodyne	SLC6A5	47	36
O=C(NC1CC1)N[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747212	CF	On-Demand	Anodyne	EPHX2	22	42
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747213	CF	On-Demand	Anodyne	SLC6A1	72	38
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747213	CF	On-Demand	Anodyne	SIGMAR1	33	45
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747213	CF	On-Demand	Anodyne	CCR3	26	40
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747213	CF	On-Demand	Anodyne	SLC6A5	47	36
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450747213	CF	On-Demand	Anodyne	EPHX2	22	42
O=C(NC1CC1)N[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747214	CF	On-Demand	Anodyne	SLC6A1	72	38
O=C(NC1CC1)N[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747214	CF	On-Demand	Anodyne	SIGMAR1	33	45
O=C(NC1CC1)N[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747214	CF	On-Demand	Anodyne	CCR3	26	40
O=C(NC1CC1)N[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747214	CF	On-Demand	Anodyne	SLC6A5	47	36
O=C(NC1CC1)N[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747214	CF	On-Demand	Anodyne	EPHX2	22	42
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747215	CF	On-Demand	Anodyne	SLC6A1	72	38
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747215	CF	On-Demand	Anodyne	SIGMAR1	33	45
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747215	CF	On-Demand	Anodyne	CCR3	26	40
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747215	CF	On-Demand	Anodyne	SLC6A5	47	36
O=C(NC1CC1)N[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450747215	CF	On-Demand	Anodyne	EPHX2	22	42
FC1(F)CCCC[C@@H]1CSc1nnnn1C[C@H]1CCCO1	ZINC000450747230	DF	On-Demand	Anodyne	PDE8B	49	35
FC1(F)CCCC[C@@H]1CSc1nnnn1C[C@@H]1CCCO1	ZINC000450747231	DF	On-Demand	Anodyne	PDE8B	49	35
FC1(F)CCCC[C@H]1CSc1nnnn1C[C@@H]1CCCO1	ZINC000450747232	DF	On-Demand	Anodyne	PDE8B	49	35
FC1(F)CCCC[C@H]1CSc1nnnn1C[C@H]1CCCO1	ZINC000450747233	DF	On-Demand	Anodyne	PDE8B	49	35
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450747236	DH	On-Demand	Anodyne	PREP	23	40
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450747237	DH	On-Demand	Anodyne	PREP	23	40
CCO[C@@H]1C[C@@H](NC(=O)C2(C(F)(F)F)CCC2)[C@@H]1Oc1ccccc1	ZINC000450747248	FG	On-Demand	Anodyne	TIMP3	60	30
CCO[C@@H]1C[C@@H](NC(=O)C2(C(F)(F)F)CCC2)[C@H]1Oc1ccccc1	ZINC000450747249	FG	On-Demand	Anodyne	TIMP3	60	30
CCO[C@@H]1C[C@H](NC(=O)C2(C(F)(F)F)CCC2)[C@H]1Oc1ccccc1	ZINC000450747250	FG	On-Demand	Anodyne	TIMP3	60	30
CCO[C@@H]1C[C@H](NC(=O)C2(C(F)(F)F)CCC2)[C@@H]1Oc1ccccc1	ZINC000450747251	FG	On-Demand	Anodyne	TIMP3	60	30
CCc1cc(CCCN2CCN(c3ccnc(C)n3)CC2)on1	ZINC000450747254	DE	On-Demand	Anodyne	DRD4	17	43
CCc1cc(CCCN2CCN(c3ccnc(C)n3)CC2)on1	ZINC000450747254	DE	On-Demand	Anodyne	DRD3	16	43
C[C@H](O)CCCN1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450747288	BF	On-Demand	Anodyne	CHRNA2	41	42
C[C@H](O)CCCN1C[C@H](C)C[C@H]1c1cccnc1	ZINC000450747288	BF	On-Demand	Anodyne	CRTY	0	42
C[C@H](O)CCCN1C[C@@H](C)C[C@@H]1c1cccnc1	ZINC000450747289	BF	On-Demand	Anodyne	CHRNA2	41	42
C[C@H](O)CCCN1C[C@@H](C)C[C@@H]1c1cccnc1	ZINC000450747289	BF	On-Demand	Anodyne	CRTY	0	42
C[C@H](O)CCCN1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450747290	BF	On-Demand	Anodyne	CHRNA2	41	42
C[C@H](O)CCCN1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000450747290	BF	On-Demand	Anodyne	CRTY	0	42
C[C@H](O)CCCN1C[C@@H](C)C[C@H]1c1cccnc1	ZINC000450747291	BF	On-Demand	Anodyne	CHRNA2	41	42
C[C@H](O)CCCN1C[C@@H](C)C[C@H]1c1cccnc1	ZINC000450747291	BF	On-Demand	Anodyne	CRTY	0	42
CCO[C@@H]1CCN(c2nc(C(=O)OC)c(C)s2)C[C@@H]1C	ZINC000450747292	CE	On-Demand	Anodyne	GYRB	0	42
CCO[C@H]1CCN(c2nc(C(=O)OC)c(C)s2)C[C@H]1C	ZINC000450747293	CE	On-Demand	Anodyne	GYRB	0	42
CCO[C@@H]1CCN(c2nc(C(=O)OC)c(C)s2)C[C@H]1C	ZINC000450747294	CE	On-Demand	Anodyne	GYRB	0	42
CCO[C@H]1CCN(c2nc(C(=O)OC)c(C)s2)C[C@@H]1C	ZINC000450747295	CE	On-Demand	Anodyne	GYRB	0	42
COC(=O)C1(CNC2(Cc3ccccc3)CCCC2)CC1	ZINC000450747297	CG	On-Demand	Anodyne	ACAT	0	47
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450747338	DH	On-Demand	Anodyne	PREP	23	40
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450747339	DH	On-Demand	Anodyne	PREP	23	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	SSTR2	60	44
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	GHRHR	32	42
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MME	27	48
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	EDNRB	55	38
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	EDNRA	45	42
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	TACR1	28	51
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MC4R	42	39
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	CCKAR	102	42
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	CTSL	30	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	BRS3	24	43
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	NMBR	61	32
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MC3R	55	39
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MC5R	62	34
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MMP2	26	45
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MMP8	39	45
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MMP14	23	41
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	GRPR	61	33
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	ECE1	63	44
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	LNPEP	28	41
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	SSTR3	29	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MMP11	73	38
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	CCKBR	84	42
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	GHSR	79	48
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MMP9	25	47
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	ADAM9	42	43
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	MMP1	24	44
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	NPR	35	48
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	SLC15A2	0	52
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	KISS1R	61	34
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	ERAP2	46	41
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	ERAP1	0	41
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	LASB	0	44
CC[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450747340	DE	On-Demand	Anodyne	IL1RN	0	41
COc1ccc(CNC(=O)CCN2CCC[C@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450747343	GD	On-Demand	Anodyne	MTNR1A	44	36
COc1ccc(CNC(=O)CCN2CCC[C@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450747343	GD	On-Demand	Anodyne	EBP	35	42
COc1ccc(CNC(=O)CCN2CCC[C@@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450747344	GD	On-Demand	Anodyne	MTNR1A	44	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450747344	GD	On-Demand	Anodyne	EBP	35	42
COC(=O)CN(CCc1ccccc1)C(=O)Cc1sccc1Br	ZINC000450747351	GG	On-Demand	Anodyne	LTB4R	18	40
COc1ccc(OC(F)(F)F)c(C(=O)NCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000450747353	GF	On-Demand	Anodyne	PPARA	16	42
COc1ccc(OC(F)(F)F)c(C(=O)NCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000450747353	GF	On-Demand	Anodyne	PPARD	28	42
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2n(n1)CCC2	ZINC000450747358	DF	On-Demand	Anodyne	TRPC6	46	35
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2n(n1)CCC2	ZINC000450747359	DF	On-Demand	Anodyne	TRPC6	46	35
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2n(n1)CCC2	ZINC000450747360	DF	On-Demand	Anodyne	TRPC6	46	35
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2n(n1)CCC2	ZINC000450747361	DF	On-Demand	Anodyne	TRPC6	46	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	ACE	21	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	SSTR2	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	OPRM1	15	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	OPRD1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	GHRHR	33	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MME	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	EDNRB	52	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	TACR1	35	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MC4R	43	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	TACR2	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	CCKAR	120	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	CCR3	0	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	BRS3	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	NMBR	47	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MC3R	62	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MC5R	59	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MMP2	27	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MMP8	33	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	GRPR	45	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	ECE1	65	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MMP11	87	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	CCKBR	89	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	GHSR	72	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MMP9	25	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MC1R	85	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	MMP1	20	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	NPR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	SLC15A2	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	KISS1R	73	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450747362	GG	On-Demand	Anodyne	ERAP2	43	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	ACE	21	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	SSTR2	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	OPRM1	15	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	OPRD1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	GHRHR	33	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MME	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	EDNRB	52	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	TACR1	35	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MC4R	43	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	TACR2	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	CCKAR	120	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	CCR3	0	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	BRS3	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	NMBR	47	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MC3R	62	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MC5R	59	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MMP2	27	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MMP8	33	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	GRPR	45	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	ECE1	65	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MMP11	87	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	CCKBR	89	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	GHSR	72	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MMP9	25	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MC1R	85	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	MMP1	20	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	NPR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	SLC15A2	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	KISS1R	73	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450747363	GG	On-Demand	Anodyne	ERAP2	43	38
COC(=O)c1cn([C@H]2CCCN(CC/C=C/c3ccccc3)C2)nn1	ZINC000450747366	EF	On-Demand	Anodyne	SLC6A1	101	37
COC(=O)c1cn([C@H]2CCCN(CC/C=C/c3ccccc3)C2)nn1	ZINC000450747366	EF	On-Demand	Anodyne	HDAC8	22	40
COC(=O)c1cn([C@@H]2CCCN(CC/C=C/c3ccccc3)C2)nn1	ZINC000450747367	EF	On-Demand	Anodyne	SLC6A1	101	37
COC(=O)c1cn([C@@H]2CCCN(CC/C=C/c3ccccc3)C2)nn1	ZINC000450747367	EF	On-Demand	Anodyne	HDAC8	22	40
COC(=O)c1cn([C@@H]2CCCN(CC/C=C\c3ccccc3)C2)nn1	ZINC000450747368	EF	On-Demand	Anodyne	SLC6A1	101	37
COC(=O)c1cn([C@@H]2CCCN(CC/C=C\c3ccccc3)C2)nn1	ZINC000450747368	EF	On-Demand	Anodyne	HDAC8	22	40
COC(=O)c1cn([C@H]2CCCN(CC/C=C\c3ccccc3)C2)nn1	ZINC000450747369	EF	On-Demand	Anodyne	SLC6A1	101	37
COC(=O)c1cn([C@H]2CCCN(CC/C=C\c3ccccc3)C2)nn1	ZINC000450747369	EF	On-Demand	Anodyne	HDAC8	22	40
COC(=O)c1cn([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747370	FE	On-Demand	Anodyne	DRD4	19	51
COC(=O)c1cn([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747370	FE	On-Demand	Anodyne	HTR2A	28	46
COC(=O)c1cn([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747370	FE	On-Demand	Anodyne	HTR2C	15	50
COC(=O)c1cn([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747370	FE	On-Demand	Anodyne	CCR3	70	36
COC(=O)c1cn([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747370	FE	On-Demand	Anodyne	CYP2J2	52	38
COC(=O)c1cn([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747371	FE	On-Demand	Anodyne	DRD4	19	51
COC(=O)c1cn([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747371	FE	On-Demand	Anodyne	HTR2A	28	46
COC(=O)c1cn([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747371	FE	On-Demand	Anodyne	HTR2C	15	50
COC(=O)c1cn([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747371	FE	On-Demand	Anodyne	CCR3	70	36
COC(=O)c1cn([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)nn1	ZINC000450747371	FE	On-Demand	Anodyne	CYP2J2	52	38
COC(=O)c1coc(CN2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)n1	ZINC000450747372	EH	On-Demand	Anodyne	CCR3	44	35
COC(=O)c1coc(CN2CC[C@H](Cc3ccc(C(C)C)cc3)C2)n1	ZINC000450747373	EH	On-Demand	Anodyne	CCR3	44	35
CCN1C(=O)C[C@H](C(=O)NCCCCCSC)[C@H]1c1cccnc1	ZINC000450747374	EF	On-Demand	Anodyne	NAMPT	16	42
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450747383	EE	On-Demand	Anodyne	DRD2	35	46
O=C(NC1CC1)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450747383	EE	On-Demand	Anodyne	HTR3B	0	46
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450747384	EE	On-Demand	Anodyne	DRD2	35	46
O=C(NC1CC1)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450747384	EE	On-Demand	Anodyne	HTR3B	0	46
Cc1cncc(-c2nc(CSc3nnnn3C[C@H]3CCCO3)no2)c1	ZINC000450747397	FD	On-Demand	Anodyne	PDE8B	45	35
Cc1cncc(-c2nc(CSc3nnnn3C[C@@H]3CCCO3)no2)c1	ZINC000450747398	FD	On-Demand	Anodyne	PDE8B	45	35
COC(=O)c1cn([C@H]2CCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747409	EE	On-Demand	Anodyne	SLC6A1	32	48
COC(=O)c1cn([C@H]2CCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747409	EE	On-Demand	Anodyne	CCR3	27	45
COC(=O)c1cn([C@H]2CCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747409	EE	On-Demand	Anodyne	BIRC2	61	43
COC(=O)c1cn([C@@H]2CCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747410	EE	On-Demand	Anodyne	SLC6A1	32	48
COC(=O)c1cn([C@@H]2CCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747410	EE	On-Demand	Anodyne	CCR3	27	45
COC(=O)c1cn([C@@H]2CCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747410	EE	On-Demand	Anodyne	BIRC2	61	43
CCOC(=O)c1cc(C(=O)NCc2cccc(N3CCOCC3)n2)on1	ZINC000450747412	FD	On-Demand	Anodyne	SOAT1	0	40
CCOC(=O)c1cc(C(=O)NCc2cccc(N3CCOCC3)n2)on1	ZINC000450747412	FD	On-Demand	Anodyne	PIK3CB	46	35
CCOC(=O)c1cc(C(=O)NCc2cccc(N3CCOCC3)n2)on1	ZINC000450747412	FD	On-Demand	Anodyne	DGAT1	35	40
COC(=O)c1cn([C@H]2CCCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747426	EF	On-Demand	Anodyne	SLC6A1	26	45
COC(=O)c1cn([C@H]2CCCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747426	EF	On-Demand	Anodyne	CCR3	50	49
COC(=O)c1cn([C@H]2CCCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747426	EF	On-Demand	Anodyne	BIRC2	69	46
COC(=O)c1cn([C@@H]2CCCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747427	EF	On-Demand	Anodyne	SLC6A1	26	45
COC(=O)c1cn([C@@H]2CCCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747427	EF	On-Demand	Anodyne	CCR3	50	49
COC(=O)c1cn([C@@H]2CCCN(CCc3ccc(Cl)cc3)C2)nn1	ZINC000450747427	EF	On-Demand	Anodyne	BIRC2	69	46
CSCCCCCNC(=O)c1ccc2cnccc2c1	ZINC000450747428	CG	On-Demand	Anodyne	PTAFR	18	43
CSCCCCCNC(=O)c1ccc2cnccc2c1	ZINC000450747428	CG	On-Demand	Anodyne	HDAC9	15	42
CSCCCCCNC(=O)c1ccc2cnccc2c1	ZINC000450747428	CG	On-Demand	Anodyne	AKT1	18	41
CSCCCCCNC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450747434	DG	On-Demand	Anodyne	TPP2	28	49
CSCCCCCNC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450747435	DG	On-Demand	Anodyne	TPP2	28	49
Cc1cccc2c1C[C@@H](C(=O)NCCc1ccc(OCC(F)(F)F)nc1)O2	ZINC000450747449	GF	On-Demand	Anodyne	SCN9A	22	47
Cc1cccc2c1C[C@H](C(=O)NCCc1ccc(OCC(F)(F)F)nc1)O2	ZINC000450747450	GF	On-Demand	Anodyne	SCN9A	22	47
CCO[C@@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H]1C	ZINC000450747457	DG	On-Demand	Bother	SLC6A4	0	54
CCO[C@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H]1C	ZINC000450747458	DG	On-Demand	Bother	SLC6A4	0	54
CCO[C@@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@H]1C	ZINC000450747459	DG	On-Demand	Bother	SLC6A4	0	54
CCO[C@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@H]1C	ZINC000450747460	DG	On-Demand	Bother	SLC6A4	0	54
COc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747470	FE	On-Demand	Anodyne	CPT1A	72	36
COc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747470	FE	On-Demand	Anodyne	CPT2	44	34
COc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747470	FE	On-Demand	Anodyne	PLD1	45	38
COc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747470	FE	On-Demand	Anodyne	SLC5A7	29	41
COc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747470	FE	On-Demand	Anodyne	CPT1B	64	35
COc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747471	FE	On-Demand	Anodyne	CPT1A	72	36
COc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747471	FE	On-Demand	Anodyne	CPT2	44	34
COc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747471	FE	On-Demand	Anodyne	PLD1	45	38
COc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747471	FE	On-Demand	Anodyne	SLC5A7	29	41
COc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)cc1S(C)(=O)=O	ZINC000450747471	FE	On-Demand	Anodyne	CPT1B	64	35
Cc1c(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)nn2c1OCCC2	ZINC000450747478	GE	On-Demand	Anodyne	SCN9A	0	41
COc1cc(CC(=O)N[C@@H](C)CN2CCCCCC2)ccc1Cl	ZINC000450747487	EG	On-Demand	Anodyne	OPRM1	0	44
COc1cc(CC(=O)N[C@@H](C)CN2CCCCCC2)ccc1Cl	ZINC000450747487	EG	On-Demand	Anodyne	OPRK1	28	53
COc1cc(CC(=O)N[C@@H](C)CN2CCCCCC2)ccc1Cl	ZINC000450747487	EG	On-Demand	Anodyne	ABCC8	23	48
COc1cc(CC(=O)N[C@@H](C)CN2CCCCCC2)ccc1Cl	ZINC000450747487	EG	On-Demand	Anodyne	HTR4	40	39
COc1cc(CC(=O)N[C@H](C)CN2CCCCCC2)ccc1Cl	ZINC000450747488	EG	On-Demand	Anodyne	OPRM1	0	44
COc1cc(CC(=O)N[C@H](C)CN2CCCCCC2)ccc1Cl	ZINC000450747488	EG	On-Demand	Anodyne	OPRK1	28	53
COc1cc(CC(=O)N[C@H](C)CN2CCCCCC2)ccc1Cl	ZINC000450747488	EG	On-Demand	Anodyne	ABCC8	23	48
COc1cc(CC(=O)N[C@H](C)CN2CCCCCC2)ccc1Cl	ZINC000450747488	EG	On-Demand	Anodyne	HTR4	40	39
O=C(NCCc1ccc(OCC(F)(F)F)nc1)c1ccc(C(F)(F)F)[nH]1	ZINC000450747500	GG	On-Demand	Anodyne	SCN9A	0	41
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450747511	GG	On-Demand	Anodyne	SCN9A	0	41
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450747511	GG	On-Demand	Anodyne	ALK	15	40
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450747511	GG	On-Demand	Anodyne	GPBAR1	35	47
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450747511	GG	On-Demand	Anodyne	ERG	0	42
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450747512	GG	On-Demand	Anodyne	SCN9A	0	41
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450747512	GG	On-Demand	Anodyne	ALK	15	40
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450747512	GG	On-Demand	Anodyne	GPBAR1	35	47
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450747512	GG	On-Demand	Anodyne	ERG	0	42
CSCCCCCNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450747545	CH	On-Demand	Anodyne	GNAI1	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450747545	CH	On-Demand	Anodyne	GNAI3	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450747545	CH	On-Demand	Anodyne	GNAO1	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450747546	CH	On-Demand	Anodyne	GNAI1	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450747546	CH	On-Demand	Anodyne	GNAI3	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450747546	CH	On-Demand	Anodyne	GNAO1	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450747547	CH	On-Demand	Anodyne	GNAI1	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450747547	CH	On-Demand	Anodyne	GNAI3	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450747547	CH	On-Demand	Anodyne	GNAO1	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450747548	CH	On-Demand	Anodyne	GNAI1	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450747548	CH	On-Demand	Anodyne	GNAI3	0	41
CSCCCCCNC(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450747548	CH	On-Demand	Anodyne	GNAO1	0	41
CCOc1nc2ccc(C(=O)NCCCCCSC)cc2[nH]1	ZINC000450747577	DG	On-Demand	Anodyne	HDAC9	17	41
Cc1csc(C(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450747580	DE	On-Demand	Anodyne	PIK3CD	43	39
Cc1csc(C(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450747580	DE	On-Demand	Anodyne	PIK3CB	70	39
Cc1csc(C(=O)NCc2cccc(N3CCOCC3)n2)c1	ZINC000450747580	DE	On-Demand	Anodyne	SMG1	41	37
COc1cc(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)ccc1Cl	ZINC000450747586	EE	On-Demand	Anodyne	CAN2	0	43
CCN(CC1(C#N)CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450747595	CG	On-Demand	Mild	SIGMAR1	42	41
CCN(CC1(C#N)CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450747596	CG	On-Demand	Mild	SIGMAR1	42	41
C[C@@H](O)CCSc1nc2ccccc2c(=O)n1CCCCCC(N)=O	ZINC000450747597	FE	On-Demand	Anodyne	PTGDR2	15	43
C[C@H](O)CCSc1nc2ccccc2c(=O)n1CCCCCC(N)=O	ZINC000450747598	FE	On-Demand	Anodyne	PTGDR2	15	43
COc1ccc(-c2noc(CSc3nnnn3C(C)(C)C)n2)nn1	ZINC000450747603	ED	On-Demand	Anodyne	TNKS2	16	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	SSTR2	33	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	GHRHR	33	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	MME	25	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	EDNRB	52	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	EDNRA	38	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	TACR1	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	BMP1	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	TACR2	26	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	CCKAR	93	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	BRS3	23	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	NMBR	52	31
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	MC5R	54	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	MMP2	22	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	MMP8	34	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	GRPR	54	31
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	ECE1	59	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	MMP11	69	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	CCKBR	71	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	GHSR	73	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	MMP9	22	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	MMP1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	SLC15A2	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	KISS1R	57	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	ERAP2	43	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CC12CCSCC2	ZINC000450747615	FF	On-Demand	Anodyne	LASB	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	SSTR2	33	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	GHRHR	33	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	MME	25	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	EDNRB	52	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	EDNRA	38	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	TACR1	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	BMP1	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	TACR2	26	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	CCKAR	93	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	BRS3	23	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	NMBR	52	31
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	MC5R	54	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	MMP2	22	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	MMP8	34	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	GRPR	54	31
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	ECE1	59	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	MMP11	69	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	CCKBR	71	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	GHSR	73	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	MMP9	22	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	MMP1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	SLC15A2	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	KISS1R	57	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	ERAP2	43	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC12CCSCC2	ZINC000450747616	FF	On-Demand	Anodyne	LASB	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	SSTR2	37	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	GHRHR	30	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	MME	26	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	EDNRB	50	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	EDNRA	43	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	TACR1	28	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	BMP1	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	TACR2	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	CCKAR	100	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	BRS3	25	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	MC3R	54	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	MC5R	62	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	MMP2	23	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	MMP8	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	ECE1	59	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	LNPEP	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	MMP11	70	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	CCKBR	85	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	GHSR	75	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	MMP9	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	MMP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	SLC15A2	0	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	KISS1R	63	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	ERAP2	44	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450747621	EF	On-Demand	Anodyne	LASB	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	ACE	21	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	SSTR2	40	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	GHRHR	30	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MME	28	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	EDNRB	50	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	EDNRA	43	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	TACR1	38	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MC4R	48	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	BMP1	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	TACR2	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	CCKAR	133	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	BRS3	29	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	NMBR	39	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MC3R	68	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MC5R	72	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MMP2	28	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MMP8	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MMP14	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	GRPR	72	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	ECE1	66	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	LNPEP	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MMP11	90	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	CCKBR	118	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	GHSR	75	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MMP9	27	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MC1R	94	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	SLC15A2	0	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	KISS1R	74	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	ERAP2	44	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450747622	EF	On-Demand	Anodyne	LASB	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	SSTR2	37	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	GHRHR	30	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	MME	26	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	EDNRB	50	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	EDNRA	43	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	TACR1	28	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	BMP1	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	TACR2	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	CCKAR	100	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	BRS3	25	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	MC3R	54	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	MC5R	62	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	MMP2	23	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	MMP8	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	ECE1	59	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	LNPEP	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	MMP11	70	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	CCKBR	85	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	GHSR	75	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	MMP9	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	MMP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	SLC15A2	0	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	KISS1R	63	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	ERAP2	44	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450747623	EF	On-Demand	Anodyne	LASB	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	ACE	21	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	SSTR2	40	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	GHRHR	30	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MME	28	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	EDNRB	50	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	EDNRA	43	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	TACR1	38	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MC4R	48	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	BMP1	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	TACR2	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	CCKAR	133	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	BRS3	29	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	NMBR	39	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MC3R	68	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MC5R	72	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MMP2	28	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MMP8	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MMP14	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	GRPR	72	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	ECE1	66	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	LNPEP	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MMP11	90	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	CCKBR	118	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	GHSR	75	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MMP9	27	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MC1R	94	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	SLC15A2	0	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	KISS1R	74	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	ERAP2	44	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450747624	EF	On-Demand	Anodyne	LASB	0	46
COC(=O)c1cn([C@H]2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)C2)nn1	ZINC000450747625	GG	On-Demand	Anodyne	DRD4	20	40
COC(=O)c1cn([C@@H]2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)C2)nn1	ZINC000450747626	GG	On-Demand	Anodyne	DRD4	20	40
COC(=O)c1cn([C@@H]2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)C2)nn1	ZINC000450747627	GG	On-Demand	Anodyne	DRD4	20	40
COC(=O)c1cn([C@H]2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)C2)nn1	ZINC000450747628	GG	On-Demand	Anodyne	DRD4	20	40
COc1cc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)ncn1	ZINC000450747629	ED	On-Demand	Anodyne	SORD	43	33
COc1cc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)ncn1	ZINC000450747630	ED	On-Demand	Anodyne	SORD	43	33
COc1cc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)ncn1	ZINC000450747631	ED	On-Demand	Anodyne	SORD	43	33
COc1cc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)ncn1	ZINC000450747632	ED	On-Demand	Anodyne	SORD	43	33
Cn1cc(-c2ccc(C(=O)Nc3cccc(C(C)(C)C)c3O)o2)cn1	ZINC000450747640	EH	On-Demand	Anodyne	S1PR4	27	40
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)ccc1O	ZINC000450747657	EG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)ccc1O	ZINC000450747657	EG	On-Demand	Anodyne	RORC	48	36
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)ccc1O	ZINC000450747658	EG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)ccc1O	ZINC000450747658	EG	On-Demand	Anodyne	RORC	48	36
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)ccc1O	ZINC000450747659	EG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)ccc1O	ZINC000450747659	EG	On-Demand	Anodyne	RORC	48	36
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)ccc1O	ZINC000450747660	EG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)ccc1O	ZINC000450747660	EG	On-Demand	Anodyne	RORC	48	36
COC(=O)CN(CCc1ccccc1)C(=O)CS(=O)(=O)C1CC1	ZINC000450747665	EC	On-Demand	Anodyne	AMY2	45	31
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](Cc2ccccn2)c2ccccc2)c1	ZINC000450747672	FI	On-Demand	Anodyne	SOAT1	26	45
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](Cc2ccccn2)c2ccccc2)c1	ZINC000450747673	FI	On-Demand	Anodyne	SOAT1	26	45
NC(=O)CCCCCn1c(SCC[C@@H]2CCOC2)nc2ccccc2c1=O	ZINC000450747680	GF	On-Demand	Anodyne	TNKS	40	32
NC(=O)CCCCCn1c(SCC[C@H]2CCOC2)nc2ccccc2c1=O	ZINC000450747681	GF	On-Demand	Anodyne	TNKS	40	32
CCC[C@@H](O)CN1CCCC[C@H]1c1ccccc1	ZINC000450747687	BG	On-Demand	Anodyne	SLC18A3	29	44
CCC[C@H](O)CN1CCCC[C@H]1c1ccccc1	ZINC000450747688	BG	On-Demand	Anodyne	SLC18A3	29	44
CCC[C@@H](O)CN1CCCC[C@@H]1c1ccccc1	ZINC000450747689	BG	On-Demand	Anodyne	SLC18A3	29	44
CCC[C@H](O)CN1CCCC[C@@H]1c1ccccc1	ZINC000450747690	BG	On-Demand	Anodyne	SLC18A3	29	44
CCC(CC)(CCSc1nnnn1C[C@H]1CCCO1)C(=O)OC	ZINC000450747699	EE	On-Demand	Anodyne	PDE8B	43	37
CCC(CC)(CCSc1nnnn1C[C@@H]1CCCO1)C(=O)OC	ZINC000450747700	EE	On-Demand	Anodyne	PDE8B	43	37
COc1cc(N2CCN(CCCC(=O)c3ccccc3)CC2)ncn1	ZINC000450747710	EE	On-Demand	Anodyne	ALS	65	32
Cc1ccnc(-c2noc(CSc3nnnn3C3CCCCC3)n2)c1	ZINC000450747711	FG	On-Demand	Anodyne	TNKS2	16	42
COc1cc(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)ccc1O	ZINC000450747712	ED	On-Demand	Anodyne	TRPV1	0	56
COc1cc(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)ccc1O	ZINC000450747712	ED	On-Demand	Anodyne	NCE103	31	44
COc1cc(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)ccc1O	ZINC000450747712	ED	On-Demand	Anodyne	P96878_MYCTU	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	ACE	19	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	SSTR2	32	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	OPRD1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	GHRHR	31	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MME	26	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	EDNRB	52	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	EDNRA	34	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	TACR1	33	55
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MC4R	40	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	BMP1	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	TACR2	0	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	CCKAR	120	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	CTSL	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	NMBR	72	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MC3R	62	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MC5R	59	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MMP2	28	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MMP14	24	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	GRPR	98	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	ECE1	62	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	LNPEP	30	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	SSTR3	28	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MMP11	92	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	CCKBR	88	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	GHSR	77	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MMP9	27	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MC1R	88	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	AKT1	48	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	MMP1	21	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	NPR	31	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	SLC15A2	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	KISS1R	82	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	ERAP2	48	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	ERAP1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	LASB	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450747713	GG	On-Demand	Anodyne	IL1RN	0	44
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(C(=O)OC)c(Cl)c3)C2)nn1	ZINC000450747714	GD	On-Demand	Anodyne	CCR3	44	41
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(C(=O)OC)c(Cl)c3)C2)nn1	ZINC000450747714	GD	On-Demand	Anodyne	MCHR1	22	42
COC(=O)c1cn([C@H]2CCN(Cc3ccc(C(=O)OC)c(Cl)c3)C2)nn1	ZINC000450747715	GD	On-Demand	Anodyne	CCR3	44	41
COC(=O)c1cn([C@H]2CCN(Cc3ccc(C(=O)OC)c(Cl)c3)C2)nn1	ZINC000450747715	GD	On-Demand	Anodyne	MCHR1	22	42
CC(C)CCCC(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450747716	DI	On-Demand	Anodyne	SOAT1	20	46
CC(C)CCCC(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450747716	DI	On-Demand	Anodyne	ACER2	0	40
CC(C)CCCC(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450747717	DI	On-Demand	Anodyne	SOAT1	20	46
CC(C)CCCC(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450747717	DI	On-Demand	Anodyne	ACER2	0	40
CCN(CC1CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450747718	DH	On-Demand	Anodyne	ACHE	30	43
CCN(CC1CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450747718	DH	On-Demand	Anodyne	SIGMAR1	52	41
CCN(CC1CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450747719	DH	On-Demand	Anodyne	ACHE	30	43
CCN(CC1CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450747719	DH	On-Demand	Anodyne	SIGMAR1	52	41
Cc1sccc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450747730	CG	On-Demand	Anodyne	PLD1	46	37
Cc1sccc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450747731	CG	On-Demand	Anodyne	PLD1	46	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2cccc(C#N)n2)CC1	ZINC000450747741	EE	On-Demand	Mild	SORD	53	35
CCO[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@@H]1C	ZINC000450747745	EH	On-Demand	Anodyne	RBP4	17	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2cccc(C#N)n2)CC1	ZINC000450747746	EE	On-Demand	Mild	SORD	53	35
CCO[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@@H]1C	ZINC000450747747	EH	On-Demand	Anodyne	RBP4	17	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2cccc(C#N)n2)CC1	ZINC000450747748	EE	On-Demand	Mild	SORD	53	35
CCO[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@H]1C	ZINC000450747749	EH	On-Demand	Anodyne	RBP4	17	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2cccc(C#N)n2)CC1	ZINC000450747750	EE	On-Demand	Mild	SORD	53	35
CCO[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@H]1C	ZINC000450747752	EH	On-Demand	Anodyne	RBP4	17	41
CCN(CCC1CC1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450747759	CG	On-Demand	Anodyne	ERG7	17	40
CCN(CCC1CC1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450747759	CG	On-Demand	Anodyne	CAS1	20	44
CCN(CCC1CC1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450747759	CG	On-Demand	Anodyne	RORC	20	43
CCO[C@@H]1CCN(c2ncnc3c2oc2ccccc23)C[C@@H]1C	ZINC000450747762	DH	On-Demand	Anodyne	HRH4	22	55
CCO[C@@H]1CCN(c2ncnc3c2oc2ccccc23)C[C@@H]1C	ZINC000450747762	DH	On-Demand	Anodyne	PDE3B	57	34
CCO[C@H]1CCN(c2ncnc3c2oc2ccccc23)C[C@@H]1C	ZINC000450747764	DH	On-Demand	Anodyne	PDE3B	57	34
CCO[C@H]1CCN(c2ncnc3c2oc2ccccc23)C[C@H]1C	ZINC000450747765	DH	On-Demand	Anodyne	HRH4	22	55
CCO[C@H]1CCN(c2ncnc3c2oc2ccccc23)C[C@H]1C	ZINC000450747765	DH	On-Demand	Anodyne	PDE3B	57	34
CCO[C@@H]1CCN(c2ncnc3c2oc2ccccc23)C[C@H]1C	ZINC000450747766	DH	On-Demand	Anodyne	HRH4	22	55
CCO[C@@H]1CCN(c2ncnc3c2oc2ccccc23)C[C@H]1C	ZINC000450747766	DH	On-Demand	Anodyne	PDE3B	57	34
Cc1nccc(N2CCN(C[C@@H]3CCCCN3C(C)C)CC2)n1	ZINC000450747787	DE	On-Demand	Anodyne	SORD	80	41
Cc1nccc(N2CCN(C[C@H]3CCCCN3C(C)C)CC2)n1	ZINC000450747788	DE	On-Demand	Anodyne	SORD	80	41
CO[C@@H](Cc1ccccc1)CN1CCCC[C@]1(C)C(N)=O	ZINC000450747793	CD	On-Demand	Anodyne	SLC12A5	68	36
CO[C@H](Cc1ccccc1)CN1CCCC[C@]1(C)C(N)=O	ZINC000450747794	CD	On-Demand	Anodyne	SLC12A5	68	36
CO[C@@H](Cc1ccccc1)CN1CCCC[C@@]1(C)C(N)=O	ZINC000450747795	CD	On-Demand	Anodyne	SLC12A5	68	36
CO[C@H](Cc1ccccc1)CN1CCCC[C@@]1(C)C(N)=O	ZINC000450747796	CD	On-Demand	Anodyne	SLC12A5	68	36
CN(Cc1cc(CN(C)C2CC(O)C2)cc(C(F)(F)F)c1)C1CC(O)C1	ZINC000450747805	FF	On-Demand	Anodyne	TACR1	28	40
NC(=O)c1ccc(-c2nnn(CC(=O)CC[C@@H]3CCCCO3)n2)cc1	ZINC000450747808	ED	On-Demand	Anodyne	PDE8B	41	37
NC(=O)c1ccc(-c2nnn(CC(=O)CC[C@@H]3CCCCO3)n2)cc1	ZINC000450747808	ED	On-Demand	Anodyne	SCARB1	48	38
NC(=O)c1ccc(-c2nnn(CC(=O)CC[C@H]3CCCCO3)n2)cc1	ZINC000450747809	ED	On-Demand	Anodyne	PDE8B	41	37
NC(=O)c1ccc(-c2nnn(CC(=O)CC[C@H]3CCCCO3)n2)cc1	ZINC000450747809	ED	On-Demand	Anodyne	SCARB1	48	38
Cc1nccc(N2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)n1	ZINC000450747812	CD	On-Demand	Anodyne	SORD	62	38
Cc1nccc(N2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)n1	ZINC000450747813	CD	On-Demand	Anodyne	SORD	62	38
Cn1c(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)c2n(c1=O)CCCC2	ZINC000450747822	GD	On-Demand	Anodyne	SCN9A	0	41
CCO[C@@H]1CCN(c2ccc([N+](=O)[O-])nc2)C[C@@H]1C	ZINC000450747833	CE	On-Demand	Bother	CHRNA3	15	54
CCO[C@H]1CCN(c2ccc([N+](=O)[O-])nc2)C[C@@H]1C	ZINC000450747834	CE	On-Demand	Bother	CHRNA3	15	54
CCO[C@H]1CCN(c2ccc([N+](=O)[O-])nc2)C[C@H]1C	ZINC000450747835	CE	On-Demand	Bother	CHRNA3	15	54
CCO[C@@H]1CCN(c2ccc([N+](=O)[O-])nc2)C[C@H]1C	ZINC000450747836	CE	On-Demand	Bother	CHRNA3	15	54
CCN(Cc1nc(C(=O)OC)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450747838	FG	On-Demand	Anodyne	DRD3	24	43
CCN(Cc1nc(C(=O)OC)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450747838	FG	On-Demand	Anodyne	SIGMAR1	44	39
CCN(Cc1nc(C(=O)OC)cs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450747838	FG	On-Demand	Anodyne	CCR5	25	41
CCN(Cc1nc(C(=O)OC)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450747839	FG	On-Demand	Anodyne	DRD3	24	43
CCN(Cc1nc(C(=O)OC)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450747839	FG	On-Demand	Anodyne	SIGMAR1	44	39
CCN(Cc1nc(C(=O)OC)cs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450747839	FG	On-Demand	Anodyne	CCR5	25	41
N#Cc1cccc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450747846	EF	On-Demand	Mild	HTR1A	55	55
N#Cc1cccc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450747846	EF	On-Demand	Mild	DRD2	48	44
N#Cc1cccc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450747846	EF	On-Demand	Mild	DRD1	27	42
N#Cc1cccc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450747846	EF	On-Demand	Mild	HTR2A	48	50
N#Cc1cccc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450747846	EF	On-Demand	Mild	HTR2C	28	46
N#Cc1cccc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450747846	EF	On-Demand	Mild	DRD3	51	54
N#Cc1cccc(N2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450747846	EF	On-Demand	Mild	CYP2J2	56	39
N#Cc1ccc(N2C[C@@H](C(=O)N[C@@H]3CCCC[C@H]3O)CC2=O)cc1Cl	ZINC000450747848	FD	On-Demand	Mild	NR3C2	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	ACE	21	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	SSTR2	58	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	OPRM1	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	OPRD1	23	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	GHRHR	32	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MME	27	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	EDNRB	54	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	EDNRA	44	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	TACR1	30	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MC4R	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	BMP1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	TACR2	40	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	CCKAR	100	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	BRS3	23	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	TIMP3	38	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	NMBR	66	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MC3R	53	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MC5R	54	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MMP2	22	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MMP8	35	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	GRPR	78	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	ECE1	63	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	LNPEP	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	SSTR3	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MMP11	72	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	CCKBR	77	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	GHSR	75	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MMP9	25	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MC1R	75	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	CTSC	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	SLC15A2	0	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	KISS1R	59	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	ERAP2	43	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	LASB	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	PSMB9	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCCC1(F)F	ZINC000450747850	FG	On-Demand	Anodyne	IL1RN	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	ACE	21	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	SSTR2	58	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	OPRM1	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	OPRD1	23	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	GHRHR	32	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MME	27	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	EDNRB	54	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	EDNRA	44	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	TACR1	30	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MC4R	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	BMP1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	TACR2	40	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	CCKAR	100	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	BRS3	23	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	TIMP3	38	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	NMBR	66	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MC3R	53	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MC5R	54	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MMP2	22	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MMP8	35	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	GRPR	78	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	ECE1	63	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	LNPEP	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	SSTR3	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MMP11	72	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	CCKBR	77	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	GHSR	75	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MMP9	25	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MC1R	75	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	CTSC	17	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	SLC15A2	0	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	KISS1R	59	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	ERAP2	43	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	LASB	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	PSMB9	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCCCC1(F)F	ZINC000450747851	FG	On-Demand	Anodyne	IL1RN	0	40
COc1cc(N2CCN(Cc3cccc(C(C)=O)c3)CC2)ncn1	ZINC000450747861	EE	On-Demand	Anodyne	DRD4	28	40
COCCOC[C@@H](O)CN[C@H](C)c1c(C)cccc1C	ZINC000450747873	CD	On-Demand	Anodyne	ADRB2	35	44
COCCOC[C@@H](O)CN[C@@H](C)c1c(C)cccc1C	ZINC000450747874	CD	On-Demand	Anodyne	ADRB2	35	44
COCCOC[C@H](O)CN[C@H](C)c1c(C)cccc1C	ZINC000450747875	CD	On-Demand	Anodyne	ADRB2	35	44
COCCOC[C@H](O)CN[C@@H](C)c1c(C)cccc1C	ZINC000450747876	CD	On-Demand	Anodyne	ADRB2	35	44
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450747888	DG	On-Demand	Anodyne	OPRK1	18	41
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450747889	DG	On-Demand	Anodyne	OPRK1	18	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450747890	DG	On-Demand	Anodyne	OPRK1	18	41
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450747891	DG	On-Demand	Anodyne	OPRK1	18	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccccc3[N+](=O)[O-])C2)CC1	ZINC000450747912	FE	On-Demand	Bother	SSTR1	28	42
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccccc3[N+](=O)[O-])C2)CC1	ZINC000450747913	FE	On-Demand	Bother	SSTR1	28	42
CCO[C@H]1CCN(c2nc3ccc(OC)cc3nc2C)C[C@H]1C	ZINC000450747925	DG	On-Demand	Anodyne	PDE3A	40	40
CCO[C@H]1CCN(c2nc3ccc(OC)cc3nc2C)C[C@H]1C	ZINC000450747925	DG	On-Demand	Anodyne	PDE3B	61	40
CCO[C@H]1CCN(c2nc3ccc(OC)cc3nc2C)C[C@@H]1C	ZINC000450747926	DG	On-Demand	Anodyne	PDE3A	40	40
CCO[C@H]1CCN(c2nc3ccc(OC)cc3nc2C)C[C@@H]1C	ZINC000450747926	DG	On-Demand	Anodyne	PDE3B	61	40
CCO[C@@H]1CCN(c2nc3ccc(OC)cc3nc2C)C[C@H]1C	ZINC000450747927	DG	On-Demand	Anodyne	PDE3A	40	40
CCO[C@@H]1CCN(c2nc3ccc(OC)cc3nc2C)C[C@H]1C	ZINC000450747927	DG	On-Demand	Anodyne	PDE3B	61	40
CCO[C@@H]1CCN(c2nc3ccc(OC)cc3nc2C)C[C@@H]1C	ZINC000450747928	DG	On-Demand	Anodyne	PDE3A	40	40
CCO[C@@H]1CCN(c2nc3ccc(OC)cc3nc2C)C[C@@H]1C	ZINC000450747928	DG	On-Demand	Anodyne	PDE3B	61	40
COC(=O)c1coc(CN2CCCC[C@H]2c2ccccc2)n1	ZINC000450747929	DG	On-Demand	Anodyne	CPT1A	61	43
COC(=O)c1coc(CN2CCCC[C@@H]2c2ccccc2)n1	ZINC000450747930	DG	On-Demand	Anodyne	CPT1A	61	43
COC(=O)C1(CSc2nnnn2Cc2ccccc2)CCCC1	ZINC000450747935	EF	On-Demand	Anodyne	NPFFR1	40	33
C[C@@H](Oc1ccccn1)C(=O)Nc1cccc(C(C)(C)C)c1O	ZINC000450747936	DG	On-Demand	Anodyne	P2RY1	47	41
C[C@H](Oc1ccccn1)C(=O)Nc1cccc(C(C)(C)C)c1O	ZINC000450747937	DG	On-Demand	Anodyne	P2RY1	47	41
COc1ccc(CNC(=O)CCN(C)CC2(O)CCC2)c(OC)c1	ZINC000450747943	ED	On-Demand	Anodyne	MTNR1A	50	37
COc1ccc(CNC(=O)CCN(C)CC2(O)CCC2)c(OC)c1	ZINC000450747943	ED	On-Demand	Anodyne	MTNR1B	31	40
COc1ccc(CNC(=O)CCN2CCn3c(O)nnc3C2)c(OC)c1	ZINC000450747948	FC	On-Demand	Anodyne	HTR7	29	42
COc1ccc(CNC(=O)CCN2CCn3c(O)nnc3C2)c(OC)c1	ZINC000450747948	FC	On-Demand	Anodyne	MTNR1A	41	41
CCO[C@H]1CCN(c2ncnc3sc4c(c23)CCC4)C[C@@H]1C	ZINC000450747956	DG	On-Demand	Anodyne	RBP4	18	43
CCO[C@@H]1CCN(c2ncnc3sc4c(c23)CCC4)C[C@H]1C	ZINC000450747957	DG	On-Demand	Anodyne	RBP4	18	43
CCO[C@@H]1CCN(c2ncnc3sc4c(c23)CCC4)C[C@@H]1C	ZINC000450747958	DG	On-Demand	Anodyne	RBP4	18	43
CCO[C@H]1CCN(c2ncnc3sc4c(c23)CCC4)C[C@H]1C	ZINC000450747959	DG	On-Demand	Anodyne	RBP4	18	43
COc1ccc(CNC(=O)CCN2CCOCC3(CCC3)C2)c(OC)c1	ZINC000450747968	FE	On-Demand	Anodyne	MTNR1A	36	40
COc1ccc(CNC(=O)CCN2CCOCC3(CCC3)C2)c(OC)c1	ZINC000450747968	FE	On-Demand	Anodyne	MTNR1B	32	40
CCC(=O)CCCN1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1	ZINC000450747969	FF	On-Demand	Anodyne	SLC6A1	94	34
CCC(=O)CCCN1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1	ZINC000450747969	FF	On-Demand	Anodyne	HTR7	27	42
CCC(=O)CCCN1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1	ZINC000450747970	FF	On-Demand	Anodyne	SLC6A1	94	34
CCC(=O)CCCN1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1	ZINC000450747970	FF	On-Demand	Anodyne	HTR7	27	42
COC(=O)c1coc(CNC2(Cc3ccccc3)CCCC2)n1	ZINC000450747971	DG	On-Demand	Anodyne	SLC12A5	42	36
CC(C)(CC(N)=O)NCC12CC3CC(CC(C3)C1)C2	ZINC000450747976	CE	On-Demand	Anodyne	EPHX2	0	44
CC[C@@H]1CN(CC[C@H](C)O)CCN1Cc1ccccc1	ZINC000450747981	CE	On-Demand	Anodyne	SIGMAR1	46	49
CC[C@@H]1CN(CC[C@@H](C)O)CCN1Cc1ccccc1	ZINC000450747982	CE	On-Demand	Anodyne	SIGMAR1	46	49
CC[C@H]1CN(CC[C@H](C)O)CCN1Cc1ccccc1	ZINC000450747983	CE	On-Demand	Anodyne	SIGMAR1	46	49
CC[C@H]1CN(CC[C@@H](C)O)CCN1Cc1ccccc1	ZINC000450747984	CE	On-Demand	Anodyne	SIGMAR1	46	49
CC[C@H](CC(F)(F)F)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450747993	FH	On-Demand	Anodyne	SCN9A	0	42
CC[C@@H](CC(F)(F)F)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450747994	FH	On-Demand	Anodyne	SCN9A	0	42
C[C@@]1(C(N)=O)CCCCN1CCc1ccc(Cl)cc1	ZINC000450748014	CF	On-Demand	Anodyne	SLC6A1	0	41
C[C@@]1(C(N)=O)CCCCN1CCc1ccc(Cl)cc1	ZINC000450748014	CF	On-Demand	Anodyne	FFAR2	42	36
C[C@]1(C(N)=O)CCCCN1CCc1ccc(Cl)cc1	ZINC000450748015	CF	On-Demand	Anodyne	SLC6A1	0	41
C[C@]1(C(N)=O)CCCCN1CCc1ccc(Cl)cc1	ZINC000450748015	CF	On-Demand	Anodyne	FFAR2	42	36
CCO[C@@H]1CCN(c2ncnc3sccc23)C[C@@H]1C	ZINC000450748020	CF	On-Demand	Anodyne	PDE3B	69	38
CCO[C@H]1CCN(c2ncnc3sccc23)C[C@@H]1C	ZINC000450748021	CF	On-Demand	Anodyne	PDE3B	69	38
CCO[C@H]1CCN(c2ncnc3sccc23)C[C@H]1C	ZINC000450748022	CF	On-Demand	Anodyne	PDE3B	69	38
CCO[C@@H]1CCN(c2ncnc3sccc23)C[C@H]1C	ZINC000450748023	CF	On-Demand	Anodyne	PDE3B	69	38
CCO[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@H]1C	ZINC000450748028	FF	On-Demand	Anodyne	HTR3A	22	47
CCO[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H]1C	ZINC000450748029	FF	On-Demand	Anodyne	HTR3A	22	47
CCO[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H]1C	ZINC000450748030	FF	On-Demand	Anodyne	HTR3A	22	47
CCO[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@H]1C	ZINC000450748031	FF	On-Demand	Anodyne	HTR3A	22	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	SSTR2	70	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	OPRD1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	GHRHR	34	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MME	27	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	EDNRB	52	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	EDNRA	44	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	TACR1	31	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MC4R	42	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	BMP1	30	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	TACR2	46	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	CCKAR	100	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	BRS3	24	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	NMBR	66	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MC3R	56	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MC5R	63	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MMP2	24	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MMP8	36	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MMP14	23	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	GRPR	87	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	ECE1	63	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	LNPEP	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	SSTR3	32	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MMP11	72	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	CCKBR	81	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	GHSR	78	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MMP9	24	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MC1R	79	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	MMP1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	NPR	34	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	KISS1R	61	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(C)(O)C1	ZINC000450748038	ED	On-Demand	Anodyne	ERAP2	46	40
COC(=O)c1cn([C@@H]2CCN(CC/C=C/c3ccccc3)C2)nn1	ZINC000450748042	EE	On-Demand	Anodyne	SLC6A1	43	32
COC(=O)c1cn([C@H]2CCN(CC/C=C\c3ccccc3)C2)nn1	ZINC000450748043	EE	On-Demand	Anodyne	SLC6A1	43	32
COC(=O)c1cn([C@@H]2CCN(CC/C=C\c3ccccc3)C2)nn1	ZINC000450748044	EE	On-Demand	Anodyne	SLC6A1	43	32
COC(=O)c1cn([C@H]2CCN(CC/C=C/c3ccccc3)C2)nn1	ZINC000450748045	EE	On-Demand	Anodyne	SLC6A1	43	32
C[C@H](c1ccc(CSc2nnnn2C[C@H]2CCCO2)cc1)C(F)(F)F	ZINC000450748049	FH	On-Demand	Anodyne	PDE8B	41	33
C[C@@H](c1ccc(CSc2nnnn2C[C@@H]2CCCO2)cc1)C(F)(F)F	ZINC000450748050	FH	On-Demand	Anodyne	PDE8B	41	33
C[C@H](c1ccc(CSc2nnnn2C[C@@H]2CCCO2)cc1)C(F)(F)F	ZINC000450748051	FH	On-Demand	Anodyne	PDE8B	41	33
C[C@@H](c1ccc(CSc2nnnn2C[C@H]2CCCO2)cc1)C(F)(F)F	ZINC000450748052	FH	On-Demand	Anodyne	PDE8B	41	33
CCCN(CCN(CC)CC)Cc1ccc(C(C)=O)cc1	ZINC000450748053	CG	On-Demand	Anodyne	PLM2_PLAFA	67	40
O=C(NCc1cccc(N2CCOCC2)n1)c1cc(Cl)c2ccccc2n1	ZINC000450748067	GG	On-Demand	Anodyne	PIK3CB	65	38
COC(=O)c1cn([C@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)nn1	ZINC000450748068	EE	On-Demand	Anodyne	CCR3	56	35
COC(=O)c1cn([C@@H]2CCCN(Cc3ccc(C(C)=O)cc3)C2)nn1	ZINC000450748069	EE	On-Demand	Anodyne	CCR3	56	35
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450748074	DG	On-Demand	Anodyne	PREP	26	43
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450748075	DG	On-Demand	Anodyne	PREP	26	43
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450748076	DG	On-Demand	Anodyne	PREP	26	43
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450748077	DG	On-Demand	Anodyne	PREP	26	43
c1ccc([C@@H]2CCCCN2CCc2cscn2)cc1	ZINC000450748084	CH	On-Demand	Anodyne	SCN5A	40	34
c1ccc([C@H]2CCCCN2CCc2cscn2)cc1	ZINC000450748085	CH	On-Demand	Anodyne	SCN5A	40	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450748086	GE	On-Demand	Anodyne	CTSS	23	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450748086	GE	On-Demand	Anodyne	PIK3CB	52	35
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450748090	EF	On-Demand	Anodyne	PIK3CB	57	35
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450748091	EF	On-Demand	Anodyne	PIK3CB	57	35
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450748093	EI	On-Demand	Anodyne	PREP	40	36
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450748094	EI	On-Demand	Anodyne	PREP	40	36
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450748095	EI	On-Demand	Anodyne	PREP	40	36
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450748096	EI	On-Demand	Anodyne	PREP	40	36
CCN(C)C(=O)CNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450748101	FD	On-Demand	Anodyne	PYGL	41	41
COC(=O)c1cn([C@@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)nn1	ZINC000450748112	GG	On-Demand	Anodyne	SLC6A1	75	35
COC(=O)c1cn([C@@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)nn1	ZINC000450748112	GG	On-Demand	Anodyne	BIRC2	42	33
COC(=O)c1cn([C@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)nn1	ZINC000450748113	GG	On-Demand	Anodyne	SLC6A1	75	35
COC(=O)c1cn([C@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)nn1	ZINC000450748113	GG	On-Demand	Anodyne	BIRC2	42	33
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748118	EI	On-Demand	Anodyne	HCRTR1	29	41
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748118	EI	On-Demand	Anodyne	HCRTR2	15	41
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748118	EI	On-Demand	Anodyne	TRPC6	49	35
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748119	EI	On-Demand	Anodyne	HCRTR1	29	41
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748119	EI	On-Demand	Anodyne	HCRTR2	15	41
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748119	EI	On-Demand	Anodyne	TRPC6	49	35
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748120	EI	On-Demand	Anodyne	HCRTR1	29	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748120	EI	On-Demand	Anodyne	HCRTR2	15	41
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748120	EI	On-Demand	Anodyne	TRPC6	49	35
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748121	EI	On-Demand	Anodyne	HCRTR1	29	41
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748121	EI	On-Demand	Anodyne	HCRTR2	15	41
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2cccnc2s1	ZINC000450748121	EI	On-Demand	Anodyne	TRPC6	49	35
Cc1cnc(CCCC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)o1	ZINC000450748123	DG	On-Demand	Anodyne	PREP	41	38
Cc1cnc(CCCC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)o1	ZINC000450748124	DG	On-Demand	Anodyne	PREP	41	38
Cc1cnc(CCCC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)o1	ZINC000450748125	DG	On-Demand	Anodyne	PREP	41	38
Cc1cnc(CCCC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)o1	ZINC000450748126	DG	On-Demand	Anodyne	PREP	41	38
CCC[C@H]1CCC[C@@H]1C(=O)NCCCCCSC	ZINC000450748131	CH	On-Demand	Anodyne	TPP2	21	42
CCC[C@@H]1CCC[C@@H]1C(=O)NCCCCCSC	ZINC000450748132	CH	On-Demand	Anodyne	TPP2	21	42
CCC[C@H]1CCC[C@H]1C(=O)NCCCCCSC	ZINC000450748133	CH	On-Demand	Anodyne	TPP2	21	42
CCC[C@@H]1CCC[C@H]1C(=O)NCCCCCSC	ZINC000450748134	CH	On-Demand	Anodyne	TPP2	21	42
CC(=O)c1ccc(CN2CCNC(=O)[C@@H]2c2ccccc2C)cc1	ZINC000450748172	DF	On-Demand	Anodyne	MBTPS1	42	35
CC(=O)c1ccc(CN2CCNC(=O)[C@H]2c2ccccc2C)cc1	ZINC000450748173	DF	On-Demand	Anodyne	MBTPS1	42	35
Cc1ccccc1[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748195	FG	On-Demand	Anodyne	DRD2	31	45
Cc1ccccc1[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748195	FG	On-Demand	Anodyne	DRD4	0	45
Cc1ccccc1[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748195	FG	On-Demand	Anodyne	HTR2A	18	45
Cc1ccccc1[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748195	FG	On-Demand	Anodyne	HTR2C	15	46
Cc1ccccc1[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748195	FG	On-Demand	Anodyne	SLC18A3	0	43
Cc1ccccc1[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748195	FG	On-Demand	Anodyne	HTR3B	0	45
Cc1ccccc1[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748195	FG	On-Demand	Anodyne	CYP2J2	50	37
Cc1ccccc1[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748196	FG	On-Demand	Anodyne	DRD2	31	45
Cc1ccccc1[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748196	FG	On-Demand	Anodyne	DRD4	0	45
Cc1ccccc1[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748196	FG	On-Demand	Anodyne	HTR2A	18	45
Cc1ccccc1[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748196	FG	On-Demand	Anodyne	HTR2C	15	46
Cc1ccccc1[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748196	FG	On-Demand	Anodyne	SLC18A3	0	43
Cc1ccccc1[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748196	FG	On-Demand	Anodyne	HTR3B	0	45
Cc1ccccc1[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450748196	FG	On-Demand	Anodyne	CYP2J2	50	37
Cc1nccc(N2CCN(Cc3c(C)cccc3Cl)CC2)n1	ZINC000450748209	DG	On-Demand	Anodyne	SORD	64	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	SSTR2	69	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	OPRD1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MME	26	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	EDNRB	52	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	EDNRA	43	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	TACR1	30	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MC4R	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	TACR2	45	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	CCKAR	101	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	BRS3	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	NMBR	46	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MC3R	54	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MC5R	55	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MMP2	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MMP8	35	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	GRPR	70	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	ECE1	61	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	SSTR3	37	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MMP11	71	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	CCKBR	79	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	GHSR	77	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MMP9	23	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MC1R	74	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	AKT1	46	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	MMP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	KISS1R	58	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450748240	ED	On-Demand	Anodyne	ERAP2	44	39
CC(=O)[C@@](C)(O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450748242	CB	On-Demand	Anodyne	EPHX2	16	41
CC(=O)[C@](C)(O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450748243	CB	On-Demand	Anodyne	EPHX2	16	41
CC(=O)[C@](C)(O)CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450748244	CB	On-Demand	Anodyne	EPHX2	16	41
CC(=O)[C@@](C)(O)CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450748245	CB	On-Demand	Anodyne	EPHX2	16	41
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)c(F)c1	ZINC000450748264	FF	On-Demand	Anodyne	TRPC6	45	33
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)c(F)c1	ZINC000450748265	FF	On-Demand	Anodyne	TRPC6	45	33
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)c(F)c1	ZINC000450748266	FF	On-Demand	Anodyne	TRPC6	45	33
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)c(F)c1	ZINC000450748267	FF	On-Demand	Anodyne	TRPC6	45	33
CCNc1nnc(SCCC(=O)NCc2ccc(OC)cc2OC)s1	ZINC000450748282	GE	On-Demand	Anodyne	MTNR1A	43	38
Cc1c(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)nn2c1OCCC2	ZINC000450748297	EF	On-Demand	Anodyne	TRPC6	48	36
Cc1c(C(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)nn2c1OCCC2	ZINC000450748298	EF	On-Demand	Anodyne	TRPC6	48	36
Cc1c(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)nn2c1OCCC2	ZINC000450748299	EF	On-Demand	Anodyne	TRPC6	48	36
Cc1c(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)nn2c1OCCC2	ZINC000450748300	EF	On-Demand	Anodyne	TRPC6	48	36
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(C)(C)C)c1O	ZINC000450748306	EH	On-Demand	Anodyne	MME	65	39
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(C)(C)C)c1O	ZINC000450748306	EH	On-Demand	Anodyne	ANPEP	45	36
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(C)(C)C)c1O	ZINC000450748307	EH	On-Demand	Anodyne	MME	65	39
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(C)(C)C)c1O	ZINC000450748307	EH	On-Demand	Anodyne	ANPEP	45	36
COC(=O)c1cn([C@H]2CCCN(CCN(C)Cc3ccccc3)C2)nn1	ZINC000450748321	FD	On-Demand	Anodyne	SLC6A1	101	35
COC(=O)c1cn([C@H]2CCCN(CCN(C)Cc3ccccc3)C2)nn1	ZINC000450748321	FD	On-Demand	Anodyne	CCR3	51	38
COC(=O)c1cn([C@@H]2CCCN(CCN(C)Cc3ccccc3)C2)nn1	ZINC000450748322	FD	On-Demand	Anodyne	SLC6A1	101	35
COC(=O)c1cn([C@@H]2CCCN(CCN(C)Cc3ccccc3)C2)nn1	ZINC000450748322	FD	On-Demand	Anodyne	CCR3	51	38
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(Cl)cc3Cl)C2)CC1	ZINC000450748323	GG	On-Demand	Anodyne	CXCR3	33	44
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(Cl)cc3Cl)C2)CC1	ZINC000450748324	GG	On-Demand	Anodyne	CXCR3	33	44
CCS(=O)(=O)c1ccc(CN2CCC(C)(CO)CC2)cc1	ZINC000450748325	DE	On-Demand	Anodyne	ADAM17	25	44
CCN(C)C(=O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450748329	FE	On-Demand	Anodyne	DRD2	19	43
CCN(C)C(=O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450748329	FE	On-Demand	Anodyne	DRD3	29	43
CCN(C)C(=O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450748329	FE	On-Demand	Anodyne	CPT1A	44	31
CCN(C)C(=O)CNC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450748329	FE	On-Demand	Anodyne	HPGD	46	56
Cc1cnc(CCCC(=O)Nc2cnn(-c3ccccc3)c2C(F)(F)F)o1	ZINC000450748330	GI	On-Demand	Anodyne	MST1R	41	36
Cc1cccc(Cl)c1C(=O)N1CCC(CC(=O)N(C)C)CC1	ZINC000450748331	DF	On-Demand	Anodyne	CCR5	35	46
Cc1cccc(Cl)c1C(=O)N1CCC(CC(=O)N(C)C)CC1	ZINC000450748331	DF	On-Demand	Anodyne	L3MBTL3	51	36
Cc1ccc(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)c(Br)c1	ZINC000450748332	GF	On-Demand	Anodyne	P2RX7	27	42
COc1cc(C(=O)Nc2cccc(C(C)(C)C)c2O)c([N+](=O)[O-])cc1F	ZINC000450748336	FH	On-Demand	Bother	KCNMA1	33	45
CCC(=O)CCCN1CCN(c2cccc(C#N)n2)CC1	ZINC000450748337	CD	On-Demand	Mild	HTR1A	41	42
CCC(=O)CCCN1CCN(c2cccc(C#N)n2)CC1	ZINC000450748337	CD	On-Demand	Mild	DRD2	37	40
CCC(=O)CCCN1CCN(c2cccc(C#N)n2)CC1	ZINC000450748337	CD	On-Demand	Mild	HTR2A	33	45
CCC(=O)CCCN1CCN(c2cccc(C#N)n2)CC1	ZINC000450748337	CD	On-Demand	Mild	HTR7	50	35
CCS(=O)(=O)c1ccc(CN2CCN(c3ncc(F)cn3)CC2)cc1	ZINC000450748339	FD	On-Demand	Anodyne	DRD4	20	42
Cc1nc2ccnn2cc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450748343	GE	On-Demand	Anodyne	SCN9A	0	42
Cc1nc2ccnn2cc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450748343	GE	On-Demand	Anodyne	DDR1	62	37
COc1ccc(CNC(=O)CCNC(C)(C)CC(N)=O)c(OC)c1	ZINC000450748354	EC	On-Demand	Anodyne	MTNR1A	58	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncc(F)cn2)CC1	ZINC000450748360	ED	On-Demand	Anodyne	P2RX3	32	44
C[C@H](c1ccccc1)[C@H](O)CN1CCN(c2ncc(F)cn2)CC1	ZINC000450748361	ED	On-Demand	Anodyne	P2RX3	32	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(c2ncc(F)cn2)CC1	ZINC000450748362	ED	On-Demand	Anodyne	P2RX3	32	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(c2ncc(F)cn2)CC1	ZINC000450748363	ED	On-Demand	Anodyne	P2RX3	32	44
CCOC(=O)c1cc(C(=O)N[C@H](C)CN2CCCCCC2)[nH]c1C	ZINC000450748371	EE	On-Demand	Anodyne	PLD1	44	34
CCOC(=O)c1cc(C(=O)N[C@@H](C)CN2CCCCCC2)[nH]c1C	ZINC000450748372	EE	On-Demand	Anodyne	PLD1	44	34
Cn1nc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)c2c1CCCC2	ZINC000450748387	GF	On-Demand	Anodyne	SCN9A	0	43
CCO[C@@H]1C[C@@H](NC(=O)Cc2cc3ccccc3c(O)n2)[C@H]1Oc1ccccc1	ZINC000450748400	GG	On-Demand	Anodyne	TNKS	50	34
CCO[C@@H]1C[C@@H](NC(=O)Cc2cc3ccccc3c(O)n2)[C@@H]1Oc1ccccc1	ZINC000450748401	GG	On-Demand	Anodyne	TNKS	50	34
CCO[C@@H]1C[C@H](NC(=O)Cc2cc3ccccc3c(O)n2)[C@H]1Oc1ccccc1	ZINC000450748402	GG	On-Demand	Anodyne	TNKS	50	34
CCO[C@@H]1C[C@H](NC(=O)Cc2cc3ccccc3c(O)n2)[C@@H]1Oc1ccccc1	ZINC000450748403	GG	On-Demand	Anodyne	TNKS	50	34
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450748404	GH	On-Demand	Anodyne	SCN9A	0	42
CCO[C@H]1CCN(c2ccnc3c(OC)cccc23)C[C@@H]1C	ZINC000450748412	DG	On-Demand	Anodyne	PDE3B	65	35
CCO[C@H]1CCN(c2ccnc3c(OC)cccc23)C[C@H]1C	ZINC000450748413	DG	On-Demand	Anodyne	PDE3B	65	35
CCO[C@@H]1CCN(c2ccnc3c(OC)cccc23)C[C@H]1C	ZINC000450748414	DG	On-Demand	Anodyne	PDE3B	65	35
CCO[C@@H]1CCN(c2ccnc3c(OC)cccc23)C[C@@H]1C	ZINC000450748415	DG	On-Demand	Anodyne	PDE3B	65	35
CCC[C@@H](O)CN1CCN(c2ccnc(C)n2)CC1	ZINC000450748424	CD	On-Demand	Anodyne	SORD	60	38
CCC[C@H](O)CN1CCN(c2ccnc(C)n2)CC1	ZINC000450748425	CD	On-Demand	Anodyne	SORD	60	38
CCc1ccccc1-n1c(SC[C@H](O)CC#N)nc2ccccc2c1=O	ZINC000450748438	FG	On-Demand	Mild	PDE7A	0	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	ACE	20	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	SSTR2	65	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	OPRM1	15	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	OPRD1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	GHRHR	34	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MME	27	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	EDNRB	43	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	EDNRA	59	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	TACR1	51	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MC4R	46	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	TACR2	30	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	CCKAR	93	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	CTSL	26	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	NMBR	32	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MC3R	59	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MC5R	66	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MMP2	25	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MMP8	55	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MMP14	86	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	GRPR	62	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	ECE1	64	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MMP11	83	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	CCKBR	66	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	GHSR	72	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MMP9	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	MC1R	92	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	NPR	29	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	SLC15A2	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	KISS1R	71	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450748447	GD	On-Demand	Anodyne	ERAP2	43	38
COC(=O)c1csc(CN2CCCC[C@H]2c2ccccc2)n1	ZINC000450748476	DH	On-Demand	Anodyne	COLA	73	46
COC(=O)c1csc(CN2CCCC[C@H]2c2ccccc2)n1	ZINC000450748476	DH	On-Demand	Anodyne	CPT1A	70	46
COC(=O)c1csc(CN2CCCC[C@@H]2c2ccccc2)n1	ZINC000450748477	DH	On-Demand	Anodyne	COLA	73	46
COC(=O)c1csc(CN2CCCC[C@@H]2c2ccccc2)n1	ZINC000450748477	DH	On-Demand	Anodyne	CPT1A	70	46
COC(=O)c1cn([C@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)nn1	ZINC000450748487	EE	On-Demand	Anodyne	CCR3	45	31
COC(=O)c1cn([C@@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)nn1	ZINC000450748488	EE	On-Demand	Anodyne	CCR3	45	31
COC(=O)c1cn([C@H]2CCCN(C[C@H]3CCC(F)(F)C3)C2)nn1	ZINC000450748489	EE	On-Demand	Anodyne	CCR3	45	31
COC(=O)c1cn([C@@H]2CCCN(C[C@@H]3CCC(F)(F)C3)C2)nn1	ZINC000450748490	EE	On-Demand	Anodyne	CCR3	45	31
CCO[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450748491	EJ	On-Demand	Anodyne	LIPG	45	36
CCO[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450748492	EJ	On-Demand	Anodyne	LIPG	45	36
CCO[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450748493	EJ	On-Demand	Anodyne	LIPG	45	36
CCO[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450748494	EJ	On-Demand	Anodyne	LIPG	45	36
CSCCCCCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450748507	DG	On-Demand	Anodyne	DRD3	18	44
CSCCCCCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450748507	DG	On-Demand	Anodyne	GPBAR1	23	42
CSCCCCCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450748508	DG	On-Demand	Anodyne	DRD3	18	44
CSCCCCCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450748508	DG	On-Demand	Anodyne	GPBAR1	23	42
C=CCOc1ccc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1	ZINC000450748509	EH	On-Demand	Mild	OPRK1	0	40
C=CCOc1ccc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1	ZINC000450748509	EH	On-Demand	Mild	ITGA4	42	35
C=CCOc1ccc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)cc1	ZINC000450748510	EH	On-Demand	Mild	OPRK1	0	40
C=CCOc1ccc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)cc1	ZINC000450748510	EH	On-Demand	Mild	ITGA4	42	35
C=CCOc1ccc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1	ZINC000450748511	EH	On-Demand	Mild	OPRK1	0	40
C=CCOc1ccc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1	ZINC000450748511	EH	On-Demand	Mild	ITGA4	42	35
C=CCOc1ccc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1	ZINC000450748512	EH	On-Demand	Mild	OPRK1	0	40
C=CCOc1ccc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1	ZINC000450748512	EH	On-Demand	Mild	ITGA4	42	35
CC(C)(C)n1nnnc1SCC(=O)CC[C@H]1CCCCO1	ZINC000450748528	DE	On-Demand	Anodyne	PDE8B	43	35
CC(C)(C)n1nnnc1SCC(=O)CC[C@@H]1CCCCO1	ZINC000450748529	DE	On-Demand	Anodyne	PDE8B	43	35
CC(C)(C)c1cccc(NC(=O)CCc2ccc(C(N)=O)cc2)c1O	ZINC000450748536	EG	On-Demand	Anodyne	HCAR2	16	42
Cc1ccc(Br)cc1CSc1nnnn1C[C@H]1CCCO1	ZINC000450748545	FG	On-Demand	Anodyne	PDE8B	48	35
Cc1ccc(Br)cc1CSc1nnnn1C[C@@H]1CCCO1	ZINC000450748546	FG	On-Demand	Anodyne	PDE8B	48	35
CCN(C)C(=O)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450748552	CD	On-Demand	Anodyne	CAN2	0	46
COc1cc(CC(=O)NCc2cccc(N3CCOCC3)n2)ccc1Cl	ZINC000450748553	GE	On-Demand	Anodyne	PDE5A	33	43
COc1cc(CC(=O)NCc2cccc(N3CCOCC3)n2)ccc1Cl	ZINC000450748553	GE	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CC(=O)NCc2cccc(N3CCOCC3)n2)ccc1Cl	ZINC000450748553	GE	On-Demand	Anodyne	PIK3CD	34	40
COc1cc(CC(=O)NCc2cccc(N3CCOCC3)n2)ccc1Cl	ZINC000450748553	GE	On-Demand	Anodyne	PIK3CB	67	40
COc1cc(CC(=O)NCc2cccc(N3CCOCC3)n2)ccc1Cl	ZINC000450748553	GE	On-Demand	Anodyne	ALK	16	40
COc1cc(CC(=O)NCc2cccc(N3CCOCC3)n2)ccc1Cl	ZINC000450748553	GE	On-Demand	Anodyne	NCE103	20	40
COc1cc(CC(=O)NCc2cccc(N3CCOCC3)n2)ccc1Cl	ZINC000450748553	GE	On-Demand	Anodyne	CAN2	0	40
COc1ccc(CNC(=O)CCN2CCC(C)(CO)CC2)c(OC)c1	ZINC000450748558	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCC(C)(CO)CC2)c(OC)c1	ZINC000450748558	FD	On-Demand	Anodyne	HTR7	31	44
COc1ccc(CNC(=O)CCN2CCC(C)(CO)CC2)c(OC)c1	ZINC000450748558	FD	On-Demand	Anodyne	MTNR1A	59	41
COc1ccc(CNC(=O)CCN2CCC(C)(CO)CC2)c(OC)c1	ZINC000450748558	FD	On-Demand	Anodyne	MTNR1B	47	41
CSCCCCCNC(=O)c1cccc(SC)c1	ZINC000450748560	CH	On-Demand	Anodyne	DRD4	41	31
O=C(Cc1ccc(O)c(F)c1)NCc1cccc(N2CCOCC2)n1	ZINC000450748565	ED	On-Demand	Anodyne	PIK3CD	36	40
O=C(Cc1ccc(O)c(F)c1)NCc1cccc(N2CCOCC2)n1	ZINC000450748565	ED	On-Demand	Anodyne	PIK3CB	65	40
O=C(Cc1ccc(O)c(F)c1)NCc1cccc(N2CCOCC2)n1	ZINC000450748565	ED	On-Demand	Anodyne	STAT6	45	34
COc1ccc(CNC(=O)CCN(C)C2CC(O)C2)c(OC)c1	ZINC000450748589	DD	On-Demand	Anodyne	MTNR1A	52	37
CCN(CC1CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748590	DG	On-Demand	Anodyne	DRD4	34	40
CCN(CC1CCC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748590	DG	On-Demand	Anodyne	ACHE	36	40
CCN(CC1CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748591	DG	On-Demand	Anodyne	DRD4	34	40
CCN(CC1CCC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748591	DG	On-Demand	Anodyne	ACHE	36	40
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nc(-c4ccccc4)cs3)C2)CC1	ZINC000450748592	GH	On-Demand	Anodyne	P2RY12	24	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3nc(-c4ccccc4)cs3)C2)CC1	ZINC000450748595	GH	On-Demand	Anodyne	P2RY12	24	41
CCO[C@H]1CCN(c2ccc(C(F)(F)F)cc2C#N)C[C@H]1C	ZINC000450748599	DH	On-Demand	Mild	LIPG	63	44
CCO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2C#N)C[C@H]1C	ZINC000450748601	DH	On-Demand	Mild	LIPG	63	44
CCO[C@H]1CCN(c2ccc(C(F)(F)F)cc2C#N)C[C@@H]1C	ZINC000450748603	DH	On-Demand	Mild	LIPG	63	44
CCO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2C#N)C[C@@H]1C	ZINC000450748605	DH	On-Demand	Mild	LIPG	63	44
CC[C@H]1CN(Cc2nc(C(=O)OC)cs2)CCN1Cc1ccccc1	ZINC000450748613	FG	On-Demand	Anodyne	SIGMAR1	31	41
CC[C@@H]1CN(Cc2nc(C(=O)OC)cs2)CCN1Cc1ccccc1	ZINC000450748614	FG	On-Demand	Anodyne	SIGMAR1	31	41
O=C(NCCc1ccc(OCC(F)(F)F)nc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450748615	FF	On-Demand	Anodyne	SCN9A	0	43
CCNC(=O)c1ccc(N2CCC[C@@H](Cc3ccc(OC)cc3)C2)nn1	ZINC000450748616	FF	On-Demand	Anodyne	DRD4	40	32
CCNC(=O)c1ccc(N2CCC[C@@H](Cc3ccc(OC)cc3)C2)nn1	ZINC000450748616	FF	On-Demand	Anodyne	CCR3	91	33
CCNC(=O)c1ccc(N2CCC[C@@H](Cc3ccc(OC)cc3)C2)nn1	ZINC000450748616	FF	On-Demand	Anodyne	SCD1	42	43
CCNC(=O)c1ccc(N2CCC[C@H](Cc3ccc(OC)cc3)C2)nn1	ZINC000450748617	FF	On-Demand	Anodyne	DRD4	40	32
CCNC(=O)c1ccc(N2CCC[C@H](Cc3ccc(OC)cc3)C2)nn1	ZINC000450748617	FF	On-Demand	Anodyne	CCR3	91	33
CCNC(=O)c1ccc(N2CCC[C@H](Cc3ccc(OC)cc3)C2)nn1	ZINC000450748617	FF	On-Demand	Anodyne	SCD1	42	43
CC(=O)c1cccc(CN2CCCC[C@@]2(C)C(N)=O)c1	ZINC000450748619	CE	On-Demand	Anodyne	TRY2_BOVIN	40	32
COc1cc(CC(=O)NCCCCCSC)ccc1Cl	ZINC000450748620	DH	On-Demand	Anodyne	TRPV1	29	57
COc1cc(CC(=O)NCCCCCSC)ccc1Cl	ZINC000450748620	DH	On-Demand	Anodyne	NCE103	29	51
CC(=O)c1cccc(CN2CCCC[C@]2(C)C(N)=O)c1	ZINC000450748621	CE	On-Demand	Anodyne	TRY2_BOVIN	40	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748648	GJ	On-Demand	Anodyne	RBP4	92	44
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748648	GJ	On-Demand	Anodyne	SFRP1	74	35
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748648	GJ	On-Demand	Anodyne	WNT3	67	35
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748649	GJ	On-Demand	Anodyne	RBP4	92	44
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748649	GJ	On-Demand	Anodyne	SFRP1	74	35
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748649	GJ	On-Demand	Anodyne	WNT3	67	35
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748650	GJ	On-Demand	Anodyne	RBP4	92	44
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748650	GJ	On-Demand	Anodyne	SFRP1	74	35
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748650	GJ	On-Demand	Anodyne	WNT3	67	35
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc2cnccc2c1	ZINC000450748651	DG	On-Demand	Anodyne	P2RX3	31	43
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc2cnccc2c1	ZINC000450748651	DG	On-Demand	Anodyne	PLD1	46	44
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc2cnccc2c1	ZINC000450748651	DG	On-Demand	Anodyne	PLD2	30	48
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc2cnccc2c1	ZINC000450748651	DG	On-Demand	Anodyne	RPS6KA3	42	34
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748652	GJ	On-Demand	Anodyne	RBP4	92	44
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748652	GJ	On-Demand	Anodyne	SFRP1	74	35
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450748652	GJ	On-Demand	Anodyne	WNT3	67	35
C[C@H](CN1CCCCCC1)NC(=O)c1ccc2cnccc2c1	ZINC000450748653	DG	On-Demand	Anodyne	P2RX3	31	43
C[C@H](CN1CCCCCC1)NC(=O)c1ccc2cnccc2c1	ZINC000450748653	DG	On-Demand	Anodyne	PLD1	46	44
C[C@H](CN1CCCCCC1)NC(=O)c1ccc2cnccc2c1	ZINC000450748653	DG	On-Demand	Anodyne	PLD2	30	48
C[C@H](CN1CCCCCC1)NC(=O)c1ccc2cnccc2c1	ZINC000450748653	DG	On-Demand	Anodyne	RPS6KA3	42	34
CCOCc1nc(C)c(C(=O)NCc2cccc(N3CCOCC3)n2)s1	ZINC000450748654	GE	On-Demand	Anodyne	DGAT1	26	41
CCO[C@H]1CCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)C[C@H]1C	ZINC000450748660	FG	On-Demand	Anodyne	PDE3A	46	39
CCO[C@H]1CCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)C[C@H]1C	ZINC000450748660	FG	On-Demand	Anodyne	PDE3B	68	39
CCO[C@@H]1CCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)C[C@H]1C	ZINC000450748662	FG	On-Demand	Anodyne	PDE3A	46	39
CCO[C@@H]1CCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)C[C@H]1C	ZINC000450748662	FG	On-Demand	Anodyne	PDE3B	68	39
CCO[C@@H]1CCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)C[C@@H]1C	ZINC000450748664	FG	On-Demand	Anodyne	PDE3A	46	39
CCO[C@@H]1CCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)C[C@@H]1C	ZINC000450748664	FG	On-Demand	Anodyne	PDE3B	68	39
CCO[C@H]1CCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)C[C@@H]1C	ZINC000450748665	FG	On-Demand	Anodyne	PDE3A	46	39
CCO[C@H]1CCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)C[C@@H]1C	ZINC000450748665	FG	On-Demand	Anodyne	PDE3B	68	39
COC(=O)c1ccc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1	ZINC000450748667	EG	On-Demand	Anodyne	OPRK1	24	42
COC(=O)c1ccc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1	ZINC000450748667	EG	On-Demand	Anodyne	ELANE	26	41
COC(=O)c1ccc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1	ZINC000450748669	EG	On-Demand	Anodyne	OPRK1	24	42
COC(=O)c1ccc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1	ZINC000450748669	EG	On-Demand	Anodyne	ELANE	26	41
COC(=O)c1ccc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)cc1	ZINC000450748671	EG	On-Demand	Anodyne	OPRK1	24	42
COC(=O)c1ccc(CC(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)cc1	ZINC000450748671	EG	On-Demand	Anodyne	ELANE	26	41
COC(=O)c1ccc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1	ZINC000450748672	EG	On-Demand	Anodyne	OPRK1	24	42
COC(=O)c1ccc(CC(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1	ZINC000450748672	EG	On-Demand	Anodyne	ELANE	26	41
CCN(CC[C@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748674	CE	On-Demand	Anodyne	DRD2	0	48
CCN(CC[C@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748674	CE	On-Demand	Anodyne	DRD4	27	40
CCN(CC[C@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748674	CE	On-Demand	Anodyne	ACHE	27	41
CCN(CC[C@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748674	CE	On-Demand	Anodyne	DRD3	26	40
CCN(CC[C@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748674	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
CCN(CC[C@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748674	CE	On-Demand	Anodyne	CCR5	40	40
CCN(CC[C@@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748676	CE	On-Demand	Anodyne	DRD2	0	48
CCN(CC[C@@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748676	CE	On-Demand	Anodyne	DRD4	27	40
CCN(CC[C@@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748676	CE	On-Demand	Anodyne	ACHE	27	41
CCN(CC[C@@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748676	CE	On-Demand	Anodyne	DRD3	26	40
CCN(CC[C@@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748676	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
CCN(CC[C@@H](C)O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748676	CE	On-Demand	Anodyne	CCR5	40	40
CCN(CC[C@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748677	CE	On-Demand	Anodyne	DRD2	0	48
CCN(CC[C@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748677	CE	On-Demand	Anodyne	DRD4	27	40
CCN(CC[C@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748677	CE	On-Demand	Anodyne	ACHE	27	41
CCN(CC[C@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748677	CE	On-Demand	Anodyne	DRD3	26	40
CCN(CC[C@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748677	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
CCN(CC[C@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748677	CE	On-Demand	Anodyne	CCR5	40	40
CCN(CC[C@@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748678	CE	On-Demand	Anodyne	DRD2	0	48
CCN(CC[C@@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748678	CE	On-Demand	Anodyne	DRD4	27	40
CCN(CC[C@@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748678	CE	On-Demand	Anodyne	ACHE	27	41
CCN(CC[C@@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748678	CE	On-Demand	Anodyne	DRD3	26	40
CCN(CC[C@@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748678	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
CCN(CC[C@@H](C)O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748678	CE	On-Demand	Anodyne	CCR5	40	40
CCO[C@H]1CCN(c2cc(N3CC[C@@H](OCC)[C@@H](C)C3)ncn2)C[C@H]1C	ZINC000450748695	FF	On-Demand	Anodyne	PDE3A	40	36
CCO[C@H]1CCN(c2cc(N3CC[C@@H](OCC)[C@@H](C)C3)ncn2)C[C@H]1C	ZINC000450748695	FF	On-Demand	Anodyne	PDE3B	59	36
CCO[C@H]1CCN(c2cc(N3CC[C@@H](OCC)[C@H](C)C3)ncn2)C[C@H]1C	ZINC000450748696	FF	On-Demand	Anodyne	PDE3A	40	36
CCO[C@H]1CCN(c2cc(N3CC[C@@H](OCC)[C@H](C)C3)ncn2)C[C@H]1C	ZINC000450748696	FF	On-Demand	Anodyne	PDE3B	59	36
CCO[C@H]1CCN(c2cc(N3CC[C@@H](OCC)[C@H](C)C3)ncn2)C[C@@H]1C	ZINC000450748697	FF	On-Demand	Anodyne	PDE3A	40	36
CCO[C@H]1CCN(c2cc(N3CC[C@@H](OCC)[C@H](C)C3)ncn2)C[C@@H]1C	ZINC000450748697	FF	On-Demand	Anodyne	PDE3B	59	36
CCO[C@H]1CCN(c2cc(N3CC[C@@H](OCC)[C@@H](C)C3)ncn2)C[C@@H]1C	ZINC000450748698	FF	On-Demand	Anodyne	PDE3A	40	36
CCO[C@H]1CCN(c2cc(N3CC[C@@H](OCC)[C@@H](C)C3)ncn2)C[C@@H]1C	ZINC000450748698	FF	On-Demand	Anodyne	PDE3B	59	36
CSCCCCCNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450748708	EH	On-Demand	Anodyne	GRIA1	43	32
CCOC(=O)c1ccc(CN2CC[C@@H](C)C(C)(C)C2)nc1	ZINC000450748719	CG	On-Demand	Anodyne	SSTR5	29	40
CCOC(=O)c1ccc(CN2CC[C@H](C)C(C)(C)C2)nc1	ZINC000450748720	CG	On-Demand	Anodyne	SSTR5	29	40
CSCCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450748738	CF	On-Demand	Anodyne	GRIA1	70	35
CSCCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450748738	CF	On-Demand	Anodyne	NCE103	29	49
CSCCCCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450748738	CF	On-Demand	Anodyne	CAN2	0	49
COc1cc(N2CCN(Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450748748	EE	On-Demand	Anodyne	DRD2	18	42
COc1cc(N2CCN(Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450748748	EE	On-Demand	Anodyne	DRD1	20	47
COc1cc(N2CCN(Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450748748	EE	On-Demand	Anodyne	DRD4	36	42
COc1cc(N2CCN(Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450748748	EE	On-Demand	Anodyne	DRD3	24	41
COc1cc(N2CCN(Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450748748	EE	On-Demand	Anodyne	SIGMAR1	16	44
COc1cc(N2CCN(Cc3ccc(Cl)c(OC)c3)CC2)ncn1	ZINC000450748748	EE	On-Demand	Anodyne	SSTR5	52	39
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450748753	EH	On-Demand	Anodyne	TRPC6	47	37
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450748754	EH	On-Demand	Anodyne	TRPC6	47	37
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450748755	EH	On-Demand	Anodyne	TRPC6	47	37
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC000450748756	EH	On-Demand	Anodyne	TRPC6	47	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	ACE	22	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	SSTR2	48	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	OPRM1	15	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	GHRHR	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MME	28	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	EDNRB	51	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	EDNRA	43	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	TACR1	37	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MC4R	53	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	TACR2	17	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	CCKAR	129	57
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	CTSL	28	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	BRS3	27	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	NMBR	54	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MC3R	80	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MC5R	81	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MMP2	29	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MMP8	35	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MMP14	25	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	GRPR	87	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	ECE1	67	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	LNPEP	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MMP11	97	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	CCKBR	103	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	GHSR	79	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MMP9	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MC1R	104	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	AKT1	49	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	KISS1R	81	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cnc(C2CC2)nc1	ZINC000450748763	FE	On-Demand	Anodyne	ERAP2	48	43
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748776	FH	On-Demand	Anodyne	PDE3A	53	44
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748776	FH	On-Demand	Anodyne	PDE3B	79	44
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748776	FH	On-Demand	Anodyne	SIRT3	51	32
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748776	FH	On-Demand	Anodyne	SIRT2	51	32
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748776	FH	On-Demand	Anodyne	SIRT1	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748777	FH	On-Demand	Anodyne	PDE3A	53	44
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748777	FH	On-Demand	Anodyne	PDE3B	79	44
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748777	FH	On-Demand	Anodyne	SIRT3	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748777	FH	On-Demand	Anodyne	SIRT2	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450748777	FH	On-Demand	Anodyne	SIRT1	51	32
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748778	FH	On-Demand	Anodyne	PDE3A	53	44
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748778	FH	On-Demand	Anodyne	PDE3B	79	44
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748778	FH	On-Demand	Anodyne	SIRT3	51	32
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748778	FH	On-Demand	Anodyne	SIRT2	51	32
CCO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748778	FH	On-Demand	Anodyne	SIRT1	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748779	FH	On-Demand	Anodyne	PDE3A	53	44
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748779	FH	On-Demand	Anodyne	PDE3B	79	44
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748779	FH	On-Demand	Anodyne	SIRT3	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748779	FH	On-Demand	Anodyne	SIRT2	51	32
CCO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450748779	FH	On-Demand	Anodyne	SIRT1	51	32
CC(C)(CC(=O)CSc1nnnn1C[C@H]1CCCO1)C1CC1	ZINC000450748789	DE	On-Demand	Anodyne	PDE8B	47	35
CC(C)(CC(=O)CSc1nnnn1C[C@@H]1CCCO1)C1CC1	ZINC000450748790	DE	On-Demand	Anodyne	PDE8B	47	35
CCCNC(=O)c1ccc(N2CC[C@@H](OCC)[C@@H](C)C2)nc1	ZINC000450748800	DE	On-Demand	Anodyne	HDAC1	19	42
CCCNC(=O)c1ccc(N2CC[C@@H](OCC)[C@@H](C)C2)nc1	ZINC000450748800	DE	On-Demand	Anodyne	HPGDS	28	40
CCCNC(=O)c1ccc(N2CC[C@H](OCC)[C@H](C)C2)nc1	ZINC000450748801	DE	On-Demand	Anodyne	HDAC1	19	42
CCCNC(=O)c1ccc(N2CC[C@H](OCC)[C@H](C)C2)nc1	ZINC000450748801	DE	On-Demand	Anodyne	HPGDS	28	40
Cc1cc(C(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)nn1C(C)C	ZINC000450748802	DH	On-Demand	Anodyne	TRPC6	45	34
CCCNC(=O)c1ccc(N2CC[C@@H](OCC)[C@H](C)C2)nc1	ZINC000450748803	DE	On-Demand	Anodyne	HDAC1	19	42
CCCNC(=O)c1ccc(N2CC[C@@H](OCC)[C@H](C)C2)nc1	ZINC000450748803	DE	On-Demand	Anodyne	HPGDS	28	40
CCCNC(=O)c1ccc(N2CC[C@H](OCC)[C@@H](C)C2)nc1	ZINC000450748804	DE	On-Demand	Anodyne	HDAC1	19	42
CCCNC(=O)c1ccc(N2CC[C@H](OCC)[C@@H](C)C2)nc1	ZINC000450748804	DE	On-Demand	Anodyne	HPGDS	28	40
Cc1cc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)nn1C(C)C	ZINC000450748806	DH	On-Demand	Anodyne	TRPC6	45	34
Cc1cc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)nn1C(C)C	ZINC000450748808	DH	On-Demand	Anodyne	TRPC6	45	34
Cc1cc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)nn1C(C)C	ZINC000450748809	DH	On-Demand	Anodyne	TRPC6	45	34
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@H]1C	ZINC000450748821	FD	On-Demand	Anodyne	CA2	19	43
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@H]1C	ZINC000450748821	FD	On-Demand	Anodyne	CA7	29	40
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@H]1C	ZINC000450748821	FD	On-Demand	Anodyne	LIPG	43	35
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@H]1C	ZINC000450748822	FD	On-Demand	Anodyne	CA2	19	43
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@H]1C	ZINC000450748822	FD	On-Demand	Anodyne	CA7	29	40
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@H]1C	ZINC000450748822	FD	On-Demand	Anodyne	LIPG	43	35
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@@H]1C	ZINC000450748823	FD	On-Demand	Anodyne	CA2	19	43
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@@H]1C	ZINC000450748823	FD	On-Demand	Anodyne	CA7	29	40
CCO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@@H]1C	ZINC000450748823	FD	On-Demand	Anodyne	LIPG	43	35
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@@H]1C	ZINC000450748824	FD	On-Demand	Anodyne	CA2	19	43
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@@H]1C	ZINC000450748824	FD	On-Demand	Anodyne	CA7	29	40
CCO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)C[C@@H]1C	ZINC000450748824	FD	On-Demand	Anodyne	LIPG	43	35
COC(=O)c1coc(CN2CCO[C@@H](CCc3ccccc3)C2)n1	ZINC000450748825	EE	On-Demand	Anodyne	DRD4	20	58
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	ACE	21	44
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	SSTR2	59	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	GNRHR	0	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	OPRM1	23	51
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	OPRD1	27	51
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MME	25	45
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	EDNRB	55	36
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	EDNRA	46	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	TACR1	28	47
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MC4R	47	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	BMP1	28	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	TACR2	43	44
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	CCKAR	102	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	BRS3	23	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	TIMP3	24	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MC3R	72	38
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MC5R	79	34
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MMP2	22	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MMP8	34	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MMP14	23	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	GRPR	73	37
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	ECE1	58	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	LNPEP	28	44
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MMP11	72	38
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	CCKBR	73	48
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	GHSR	79	47
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MMP9	23	42
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MC1R	85	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MMP7	23	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	MMP1	19	40
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	NPR	32	45
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	SLC15A2	0	47
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	KISS1R	58	33
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	ERAP2	57	44
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	ERAP1	0	44
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	LASB	0	43
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748826	FH	On-Demand	Anodyne	IL1RN	0	42
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	ACE	21	44
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	SSTR2	59	41
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	GNRHR	0	41
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	OPRM1	23	51
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	OPRD1	27	51
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MME	25	45
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	EDNRB	55	36
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	EDNRA	46	41
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	TACR1	28	47
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MC4R	47	40
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	BMP1	28	42
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	TACR2	43	44
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	CCKAR	102	41
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	BRS3	23	41
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	TIMP3	24	40
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MC3R	72	38
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MC5R	79	34
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MMP2	22	42
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MMP8	34	42
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MMP14	23	41
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	GRPR	73	37
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	ECE1	58	42
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	LNPEP	28	44
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MMP11	72	38
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	CCKBR	73	48
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	GHSR	79	47
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MMP9	23	42
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MC1R	85	40
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MMP7	23	40
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	MMP1	19	40
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	NPR	32	45
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	SLC15A2	0	47
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	KISS1R	58	33
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	ERAP2	57	44
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	ERAP1	0	44
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	LASB	0	43
CCC[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748827	FH	On-Demand	Anodyne	IL1RN	0	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	ACE	21	44
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	SSTR2	59	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	GNRHR	0	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	OPRM1	23	51
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	OPRD1	27	51
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MME	25	45
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	EDNRB	55	36
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	EDNRA	46	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	TACR1	28	47
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MC4R	47	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	BMP1	28	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	TACR2	43	44
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	CCKAR	102	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	BRS3	23	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	TIMP3	24	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MC3R	72	38
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MC5R	79	34
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MMP2	22	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MMP8	34	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MMP14	23	41
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	GRPR	73	37
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	ECE1	58	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	LNPEP	28	44
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MMP11	72	38
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	CCKBR	73	48
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	GHSR	79	47
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MMP9	23	42
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MC1R	85	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MMP7	23	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	MMP1	19	40
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	NPR	32	45
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	SLC15A2	0	47
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	KISS1R	58	33
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	ERAP2	57	44
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	ERAP1	0	44
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	LASB	0	43
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748828	FH	On-Demand	Anodyne	IL1RN	0	42
COC(=O)c1coc(CN2CCO[C@H](CCc3ccccc3)C2)n1	ZINC000450748829	EE	On-Demand	Anodyne	DRD4	20	58
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	ACE	21	44
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	SSTR2	59	41
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	GNRHR	0	41
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	OPRM1	23	51
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	OPRD1	27	51
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MME	25	45
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	EDNRB	55	36
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	EDNRA	46	41
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	TACR1	28	47
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MC4R	47	40
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	BMP1	28	42
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	TACR2	43	44
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	CCKAR	102	41
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	BRS3	23	41
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	TIMP3	24	40
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MC3R	72	38
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MC5R	79	34
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MMP2	22	42
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MMP8	34	42
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MMP14	23	41
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	GRPR	73	37
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	ECE1	58	42
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	LNPEP	28	44
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MMP11	72	38
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	CCKBR	73	48
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	GHSR	79	47
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MMP9	23	42
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MC1R	85	40
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MMP7	23	40
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	MMP1	19	40
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	NPR	32	45
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	SLC15A2	0	47
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	KISS1R	58	33
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	ERAP2	57	44
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	ERAP1	0	44
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	LASB	0	43
CCC[C@H]1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748831	FH	On-Demand	Anodyne	IL1RN	0	42
Cc1cccc(Cl)c1C(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450748832	GH	On-Demand	Anodyne	P2RX7	22	47
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1	ZINC000450748834	GH	On-Demand	Anodyne	P2RX7	22	47
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	ACE	20	44
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	SSTR2	53	40
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	OPRM1	0	43
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	OPRD1	0	41
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MME	25	42
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	EDNRB	53	39
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	EDNRA	66	40
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	TACR1	49	48
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MC4R	51	40
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	BMP1	27	40
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	TACR2	34	43
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	CCKAR	91	37
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	BRS3	43	42
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	NMBR	35	45
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MC3R	52	39
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MC5R	54	33
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MMP2	21	41
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MMP8	52	40
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MMP14	84	38
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	GRPR	70	35
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	ECE1	58	40
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MMP11	62	35
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	CCKBR	68	39
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	GHSR	73	45
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MMP9	22	43
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MC1R	71	39
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	MMP1	22	40
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	NPR	30	42
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	SLC15A2	0	44
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	KISS1R	58	32
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	ERAP2	42	37
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450748868	ED	On-Demand	Mild	LASB	0	40
CC(C)N1CCCC[C@H]1CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450748869	DD	On-Demand	Anodyne	EPHX2	15	42
CC(C)N1CCCC[C@H]1CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450748870	DD	On-Demand	Anodyne	EPHX2	15	42
CC(C)N1CCCC[C@@H]1CN1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450748871	DD	On-Demand	Anodyne	EPHX2	15	42
CC(C)N1CCCC[C@@H]1CN1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450748872	DD	On-Demand	Anodyne	EPHX2	15	42
CC(C)CC(CC(C)C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450748874	EG	On-Demand	Anodyne	PIK3CB	66	36
CCN(C[C@H]1CCNC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748878	EE	On-Demand	Anodyne	ACHE	23	40
CCN(C[C@@H]1CCNC(=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748879	EE	On-Demand	Anodyne	ACHE	23	40
CCN(C[C@@H]1CCNC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748880	EE	On-Demand	Anodyne	ACHE	23	40
CCN(C[C@H]1CCNC(=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748882	EE	On-Demand	Anodyne	ACHE	23	40
Cc1nc(C2CC2)ccc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450748900	GH	On-Demand	Anodyne	SCN9A	0	41
CCO[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@@H]1C	ZINC000450748901	DI	On-Demand	Anodyne	LUCI_LUCLA	18	44
CCO[C@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@H]1C	ZINC000450748902	DI	On-Demand	Anodyne	LUCI_LUCLA	18	44
CCO[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@H]1C	ZINC000450748903	DI	On-Demand	Anodyne	LUCI_LUCLA	18	44
CCO[C@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@@H]1C	ZINC000450748904	DI	On-Demand	Anodyne	LUCI_LUCLA	18	44
Cc1cc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)nn1C(C)C	ZINC000450748911	FG	On-Demand	Anodyne	SCN9A	0	43
CCO[C@H]1CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C[C@H]1C	ZINC000450748932	FH	On-Demand	Anodyne	PDE3A	48	41
CCO[C@H]1CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C[C@H]1C	ZINC000450748932	FH	On-Demand	Anodyne	PDE3B	69	41
CCO[C@@H]1CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C[C@H]1C	ZINC000450748933	FH	On-Demand	Anodyne	PDE3A	48	41
CCO[C@@H]1CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C[C@H]1C	ZINC000450748933	FH	On-Demand	Anodyne	PDE3B	69	41
CCO[C@H]1CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C[C@@H]1C	ZINC000450748934	FH	On-Demand	Anodyne	PDE3A	48	41
CCO[C@H]1CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C[C@@H]1C	ZINC000450748934	FH	On-Demand	Anodyne	PDE3B	69	41
CCO[C@@H]1CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C[C@@H]1C	ZINC000450748935	FH	On-Demand	Anodyne	PDE3A	48	41
CCO[C@@H]1CCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)C[C@@H]1C	ZINC000450748935	FH	On-Demand	Anodyne	PDE3B	69	41
COc1cc(N2CCN(CC/C=C\c3ccccc3)CC2)ncn1	ZINC000450748939	DF	On-Demand	Anodyne	DRD3	23	40
COc1cc(N2CCN(CC/C=C/c3ccccc3)CC2)ncn1	ZINC000450748940	DF	On-Demand	Anodyne	DRD3	23	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	ACE	22	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	SSTR2	42	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	OPRM1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	OPRD1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	GHRHR	34	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MME	28	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	EDNRB	52	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	EDNRA	45	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	TACR1	27	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MC4R	48	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	BMP1	30	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	TACR2	37	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	CCKAR	104	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	CTSL	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	BRS3	26	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	NMBR	70	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MC3R	59	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MC5R	59	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MMP2	27	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MMP8	44	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	GRIA1	30	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MMP14	24	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	GRPR	94	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	ECE1	68	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	LNPEP	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	SSTR3	29	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MMP11	74	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	CCKBR	83	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	GHSR	78	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MMP9	25	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MC1R	78	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	ADAM9	45	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	AKT1	47	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MMP7	30	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	MMP1	23	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	NPR	34	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	SSSIM	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	KISS1R	66	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1(O)CCC1	ZINC000450748945	ED	On-Demand	Anodyne	ERAP2	46	40
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	DRD2	45	65
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	DRD1	34	54
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	DRD4	47	54
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	HTR2A	43	48
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	HTR2C	28	52
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	DRD3	32	43
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	ERG2	22	47
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	HTR7	39	47
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	SLC18A3	0	48
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	HTR3B	0	45
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	CYP2J2	50	35
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	NET	0	51
N#Cc1cccc(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450748958	FF	On-Demand	Mild	AP2S1	0	47
COC(=O)c1ccc(CN2CCN(c3cc(OC)ncn3)CC2)cc1Cl	ZINC000450748960	GE	On-Demand	Anodyne	DRD4	41	32
COC(=O)c1ccc(CN2CCN(c3cc(OC)ncn3)CC2)cc1Cl	ZINC000450748960	GE	On-Demand	Anodyne	EGLN2	0	40
COC(=O)c1ccc(CN2CCN(c3cc(OC)ncn3)CC2)cc1Cl	ZINC000450748960	GE	On-Demand	Anodyne	MCHR1	20	42
COC(=O)c1ccc(CN2CCN(c3cc(OC)ncn3)CC2)cc1Cl	ZINC000450748960	GE	On-Demand	Anodyne	EGLN1	0	40
COC(=O)c1ccc(CN2CCN(c3cc(OC)ncn3)CC2)cc1Cl	ZINC000450748960	GE	On-Demand	Anodyne	EGLN3	0	40
CCN(Cc1cn(CC2CC2)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450748970	EF	On-Demand	Anodyne	HSP90AB1	16	40
CCN(Cc1cn(CC2CC2)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450748971	EF	On-Demand	Anodyne	HSP90AB1	16	40
CC[C@@H]1CN(c2ccccc2)CCN1C[C@H](O)COCCOC	ZINC000450748973	DD	On-Demand	Anodyne	ABCB1	40	36
CC[C@H]1CN(c2ccccc2)CCN1C[C@@H](O)COCCOC	ZINC000450748974	DD	On-Demand	Anodyne	ABCB1	40	36
CC[C@@H]1CN(c2ccccc2)CCN1C[C@@H](O)COCCOC	ZINC000450748975	DD	On-Demand	Anodyne	ABCB1	40	36
CC[C@H]1CN(c2ccccc2)CCN1C[C@H](O)COCCOC	ZINC000450748976	DD	On-Demand	Anodyne	ABCB1	40	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	ACE	46	56
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	TYR	21	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	SSTR2	86	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	OPRM1	26	58
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	OPRD1	28	58
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MME	78	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	EDNRB	59	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	EDNRA	51	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	TACR1	47	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MC4R	64	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	BMP1	52	55
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	TACR2	44	58
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CTSB	47	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	PAPA1_CARPA	58	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CYSP_TRYCR	42	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CCKAR	144	55
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CTSK	17	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CTSL	46	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	PGA	22	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	BRS3	37	60
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	TIMP3	45	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	NMBR	35	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MC3R	86	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MC5R	92	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CAPNS1	58	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MMP2	46	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MMP3	36	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MMP8	54	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MMP14	33	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	GRPR	83	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	ECE1	79	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	HLA-DRB1	49	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	REN	30	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	REN1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	LNPEP	31	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	SSTR3	53	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MMP11	128	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	FURIN	25	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CCKBR	107	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	GHSR	91	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CAPN1	71	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MMP9	43	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CASP1	16	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CAPN2	86	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	ACE2	48	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MC1R	125	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	ADAM9	45	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CTSC	18	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	C5AR1	37	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MMP7	30	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MMP1	42	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	FPR1	64	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	NPR	77	58
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	HDA106	0	56
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	ADAM12	15	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	MAGI3	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	SLC15A2	0	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	KISS1R	89	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	ERAP2	53	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	PSMB8	41	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	ERAP1	0	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	LASB	0	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CD36	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	CBX7	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	PSMB9	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	HPN	20	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	NRDE	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	HGFAC	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450748983	GG	On-Demand	Anodyne	IL1RN	0	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	ACE	46	56
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	TYR	21	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	SSTR2	86	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	OPRM1	26	58
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	OPRD1	28	58
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MME	78	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	EDNRB	59	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	EDNRA	51	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	TACR1	47	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MC4R	64	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	BMP1	52	55
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	TACR2	44	58
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CTSB	47	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	PAPA1_CARPA	58	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CYSP_TRYCR	42	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CCKAR	144	55
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CTSK	17	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CTSL	46	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	PGA	22	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	BRS3	37	60
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	TIMP3	45	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	NMBR	35	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MC3R	86	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MC5R	92	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CAPNS1	58	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MMP2	46	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MMP3	36	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MMP8	54	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MMP14	33	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	GRPR	83	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	ECE1	79	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	HLA-DRB1	49	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	REN	30	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	REN1	29	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	LNPEP	31	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	SSTR3	53	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MMP11	128	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	FURIN	25	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CCKBR	107	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	GHSR	91	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CAPN1	71	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MMP9	43	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CASP1	16	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CAPN2	86	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	ACE2	48	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MC1R	125	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	ADAM9	45	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CTSC	18	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	C5AR1	37	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MMP7	30	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MMP1	42	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	FPR1	64	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	NPR	77	58
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	HDA106	0	56
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	ADAM12	15	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	MAGI3	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	SLC15A2	0	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	KISS1R	89	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	ERAP2	53	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	PSMB8	41	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	ERAP1	0	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	LASB	0	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CD36	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	CBX7	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	PSMB9	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	HPN	20	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	NRDE	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	HGFAC	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450748984	GG	On-Demand	Anodyne	IL1RN	0	48
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450748985	EF	On-Demand	Anodyne	PREP	40	37
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450748986	EF	On-Demand	Anodyne	PREP	40	37
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450748987	EF	On-Demand	Anodyne	PREP	40	37
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450748988	EF	On-Demand	Anodyne	PREP	40	37
O=C(Nc1cnn(-c2ccccc2)c1C(F)(F)F)[C@H](O)C1CCC1	ZINC000450748993	EF	On-Demand	Anodyne	MST1R	42	36
O=C(Nc1cnn(-c2ccccc2)c1C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450748994	EF	On-Demand	Anodyne	MST1R	42	36
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450749000	EG	On-Demand	Anodyne	TRPC6	46	32
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450749001	EG	On-Demand	Anodyne	TRPC6	46	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450749002	EG	On-Demand	Anodyne	TRPC6	46	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450749003	EG	On-Demand	Anodyne	TRPC6	46	32
COc1cc(CN2CCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450749006	DE	On-Demand	Anodyne	AVPR1B	43	36
COc1cc(CN2CCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450749006	DE	On-Demand	Anodyne	SSTR5	49	40
COc1cc(CN2CCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450749006	DE	On-Demand	Anodyne	UTS2R	26	42
COc1cc(CN2CCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450749007	DE	On-Demand	Anodyne	AVPR1B	43	36
COc1cc(CN2CCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450749007	DE	On-Demand	Anodyne	SSTR5	49	40
COc1cc(CN2CCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450749007	DE	On-Demand	Anodyne	UTS2R	26	42
CC(=O)c1cccc(CN2CCN(c3cccc(C#N)n3)CC2)c1	ZINC000450749010	DE	On-Demand	Mild	HTR1A	18	48
c1c(CSc2nnnn2C[C@H]2CCCO2)nnn1CC1CC1	ZINC000450749011	DD	On-Demand	Anodyne	PDE8B	45	35
c1c(CSc2nnnn2C[C@@H]2CCCO2)nnn1CC1CC1	ZINC000450749012	DD	On-Demand	Anodyne	PDE8B	45	35
CSCCCCCNC(=O)c1cc(Cl)c(F)cc1Br	ZINC000450749013	FJ	On-Demand	Anodyne	ASAH1	41	31
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	ACE	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	SSTR2	48	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	OPRM1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	OPRD1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	GHRHR	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MME	26	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	EDNRB	58	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	EDNRA	33	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	TACR1	36	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MC4R	42	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	TACR2	22	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	CCKAR	123	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	NMBR	43	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MC3R	58	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MC5R	55	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MMP2	26	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MMP14	84	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	GRPR	40	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	ECE1	61	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MMP11	79	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	CCKBR	89	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	GHSR	71	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MMP9	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	MC1R	86	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	NPR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	SLC15A2	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	KISS1R	67	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450749014	GF	On-Demand	Anodyne	ERAP2	43	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	ACE	20	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	SSTR2	48	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	OPRM1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	OPRD1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	GHRHR	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MME	26	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	EDNRB	58	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	EDNRA	33	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	TACR1	36	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MC4R	42	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	TACR2	22	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	CCKAR	123	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	NMBR	43	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MC3R	58	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MC5R	55	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MMP2	26	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MMP14	84	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	GRPR	40	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	ECE1	61	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MMP11	79	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	CCKBR	89	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	GHSR	71	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MMP9	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	MC1R	86	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	NPR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	SLC15A2	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	KISS1R	67	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450749015	GF	On-Demand	Anodyne	ERAP2	43	38
CC(C)OC(C)(C)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000450749029	DD	On-Demand	Anodyne	STAT6	41	30
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	SSTR2	70	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	OPRM1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	OPRD1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MME	27	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	EDNRB	51	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	EDNRA	45	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	TACR1	31	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MC4R	50	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	TACR2	52	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	CCKAR	109	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	CTSL	30	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	BRS3	25	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	TIMP3	26	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	HDAC10	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	NMBR	55	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MC3R	68	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MC5R	80	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MMP2	24	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MMP8	38	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	GRIA1	25	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MMP14	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	GRPR	69	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	ECE1	62	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	HDAC1	23	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	HDAC2	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	LNPEP	27	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MMP11	76	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	CCKBR	85	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	GHSR	79	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MMP9	25	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MC1R	89	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	ADAM9	41	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	HDAC11	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MMP7	31	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	MMP1	22	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	HDA106	0	76
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	SLC15A2	0	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	KISS1R	67	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	ERAP2	46	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	LASB	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	NRDE	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCC(=O)C1CC1	ZINC000450749032	FF	On-Demand	Anodyne	IL1RN	0	40
NC(=O)c1ccc(-c2nnn(C[C@H]3CCCC3(F)F)n2)cc1	ZINC000450749040	DD	On-Demand	Anodyne	SCARB1	42	36
NC(=O)c1ccc(-c2nnn(C[C@@H]3CCCC3(F)F)n2)cc1	ZINC000450749041	DD	On-Demand	Anodyne	SCARB1	42	36
CC[C@@H]1CN(CCc2cscn2)CCN1Cc1ccccc1	ZINC000450749042	DG	On-Demand	Anodyne	SCN5A	23	40
CC[C@H]1CN(CCc2cscn2)CCN1Cc1ccccc1	ZINC000450749043	DG	On-Demand	Anodyne	SCN5A	23	40
Cc1[nH]c(C#N)cc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749047	FF	On-Demand	Mild	CTSL	27	41
Cc1[nH]c(C#N)cc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749047	FF	On-Demand	Mild	SCN9A	0	42
COc1ccc(-c2cc3ncn(CCC[C@@H](C)O)c(=O)c3s2)cc1	ZINC000450749052	EG	On-Demand	Anodyne	MCHR1	33	45
COc1ccc(-c2cc3ncn(CCC[C@H](C)O)c(=O)c3s2)cc1	ZINC000450749053	EG	On-Demand	Anodyne	MCHR1	33	45
C[C@@H]1C[C@@H](c2cccnc2)N(C[C@H]2CCNC(=O)CC2)C1	ZINC000450749054	CE	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@@H](c2cccnc2)N(C[C@H]2CCNC(=O)CC2)C1	ZINC000450749054	CE	On-Demand	Anodyne	CRTY	0	41
C[C@@H]1C[C@H](c2cccnc2)N(C[C@H]2CCNC(=O)CC2)C1	ZINC000450749055	CE	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@H](c2cccnc2)N(C[C@H]2CCNC(=O)CC2)C1	ZINC000450749055	CE	On-Demand	Anodyne	CRTY	0	41
C[C@@H]1C[C@H](c2cccnc2)N(C[C@@H]2CCNC(=O)CC2)C1	ZINC000450749056	CE	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@H](c2cccnc2)N(C[C@@H]2CCNC(=O)CC2)C1	ZINC000450749056	CE	On-Demand	Anodyne	CRTY	0	41
C[C@@H]1C[C@@H](c2cccnc2)N(C[C@@H]2CCNC(=O)CC2)C1	ZINC000450749057	CE	On-Demand	Anodyne	CHRNA2	40	41
C[C@@H]1C[C@@H](c2cccnc2)N(C[C@@H]2CCNC(=O)CC2)C1	ZINC000450749057	CE	On-Demand	Anodyne	CRTY	0	41
CCO[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@H]1C	ZINC000450749072	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1C	ZINC000450749073	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2ncnc3c(F)cccc23)C[C@H]1C	ZINC000450749074	CG	On-Demand	Anodyne	PDE3A	47	38
CCO[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1C	ZINC000450749075	CG	On-Demand	Anodyne	PDE3A	47	38
O=C(CCCN1CCOCC2(CCC2)C1)c1ccc(F)cc1	ZINC000450749088	DG	On-Demand	Anodyne	DRD2	35	49
O=C(CCCN1CCOCC2(CCC2)C1)c1ccc(F)cc1	ZINC000450749088	DG	On-Demand	Anodyne	ERG2	23	49
O=C(CCCN1CCOCC2(CCC2)C1)c1ccc(F)cc1	ZINC000450749088	DG	On-Demand	Anodyne	CYP2J2	49	35
CC(F)(F)C(C)(C)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749097	FG	On-Demand	Anodyne	SCN9A	0	42
COc1ccc(-c2cc3ncn(C[C@@H]4CCC(F)(F)C4)c(=O)c3s2)cc1	ZINC000450749098	GJ	On-Demand	Anodyne	MCHR1	36	44
COc1ccc(-c2cc3ncn(C[C@H]4CCC(F)(F)C4)c(=O)c3s2)cc1	ZINC000450749099	GJ	On-Demand	Anodyne	MCHR1	36	44
CC(C)C[C@@H]1C[C@H]1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749102	EG	On-Demand	Anodyne	SCN9A	0	40
C[C@H](CN1CCCCCC1)NC(=O)c1cc2ccncc2s1	ZINC000450749111	DG	On-Demand	Anodyne	P2RX3	30	41
C[C@@H](CN1CCCCCC1)NC(=O)c1cc2ccncc2s1	ZINC000450749112	DG	On-Demand	Anodyne	P2RX3	30	41
CCO[C@@H]1CCN(c2nc(C(C)=O)c(C)s2)C[C@H]1C	ZINC000450749139	CF	On-Demand	Anodyne	PARE	42	39
CCO[C@H]1CCN(c2nc(C(C)=O)c(C)s2)C[C@@H]1C	ZINC000450749140	CF	On-Demand	Anodyne	PARE	42	39
CCO[C@@H]1CCN(c2nc(C(C)=O)c(C)s2)C[C@@H]1C	ZINC000450749141	CF	On-Demand	Anodyne	PARE	42	39
CCO[C@H]1CCN(c2nc(C(C)=O)c(C)s2)C[C@H]1C	ZINC000450749142	CF	On-Demand	Anodyne	PARE	42	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	ACE	32	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	TYR	16	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	SSTR2	75	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	OPRM1	24	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	OPRD1	26	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MME	52	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	EDNRB	59	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	EDNRA	43	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	TACR1	43	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MC4R	58	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	BMP1	57	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	TACR2	30	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CTSB	39	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	PAPA1_CARPA	46	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CCKAR	125	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CTSL	38	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	BRS3	31	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	TIMP3	36	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	NMBR	32	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MC3R	77	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MC5R	73	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CDC25B	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CAPNS1	57	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MMP2	33	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MMP8	45	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MMP14	28	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	GRPR	79	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	ECE1	76	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	REN1	20	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	LNPEP	30	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	SSTR3	42	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MMP11	109	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CCKBR	87	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	GHSR	78	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CAPN1	56	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MMP9	32	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CAPN2	74	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	ACE2	48	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MC1R	111	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	ADAM9	44	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MMP7	32	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MMP1	28	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	FPR1	18	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	NPR	65	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	ADAM12	15	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	MAGI3	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	SLC15A2	0	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	KISS1R	86	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	ERAP2	59	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	ERAP1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	LASB	0	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	CD36	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	HPN	21	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	NRDE	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	HGFAC	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450749144	GG	On-Demand	Anodyne	IL1RN	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	ACE	32	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	TYR	16	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	SSTR2	75	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	OPRM1	24	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	OPRD1	26	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MME	52	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	EDNRB	59	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	EDNRA	43	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	TACR1	43	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MC4R	58	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	BMP1	57	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	TACR2	30	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CTSB	39	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	PAPA1_CARPA	46	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CCKAR	125	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CTSL	38	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	BRS3	31	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	TIMP3	36	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	NMBR	32	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MC3R	77	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MC5R	73	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CDC25B	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CAPNS1	57	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MMP2	33	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MMP8	45	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MMP14	28	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	GRPR	79	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	ECE1	76	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	REN1	20	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	LNPEP	30	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	SSTR3	42	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MMP11	109	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CCKBR	87	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	GHSR	78	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CAPN1	56	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MMP9	32	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CAPN2	74	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	ACE2	48	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MC1R	111	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	ADAM9	44	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MMP7	32	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MMP1	28	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	FPR1	18	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	NPR	65	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	ADAM12	15	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	MAGI3	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	SLC15A2	0	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	KISS1R	86	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	ERAP2	59	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	ERAP1	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	LASB	0	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	CD36	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	HPN	21	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	NRDE	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	HGFAC	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450749145	GG	On-Demand	Anodyne	IL1RN	0	45
CC[C@@H]1C[C@H]1C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000450749161	DH	On-Demand	Anodyne	MST1R	45	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	ACE	20	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	SSTR2	63	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	GNRHR	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	OPRM1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	OPRD1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MME	27	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	EDNRB	56	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	EDNRA	37	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	TACR1	32	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MC4R	55	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	BMP1	30	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	TACR2	28	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	CCKAR	121	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	CTSL	30	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	BRS3	28	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	NMBR	30	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MC3R	72	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MC5R	72	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MMP2	29	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MMP8	41	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MMP14	26	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	GRPR	83	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	ECE1	65	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MMP11	101	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	CCKBR	92	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	GHSR	80	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MMP9	28	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MC1R	111	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MMP7	32	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MMP1	21	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	NPR	31	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	HDA106	0	66
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	MAGI3	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	SLC15A2	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	KISS1R	78	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	ERAP2	43	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	LASB	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCn1nc(C)nc1C	ZINC000450749178	GE	On-Demand	Anodyne	NRDE	0	41
CSCCCCCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450749179	EI	On-Demand	Anodyne	PTAFR	15	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450749180	FI	On-Demand	Anodyne	SOAT1	25	41
CC[C@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450749181	FI	On-Demand	Anodyne	SOAT1	25	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000450749182	FI	On-Demand	Anodyne	SOAT1	25	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450749183	FI	On-Demand	Anodyne	SOAT1	25	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	ACE	19	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	SSTR2	32	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	OPRM1	0	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	GHRHR	32	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MME	26	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	EDNRB	51	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	EDNRA	32	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	TACR1	32	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MC4R	41	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	TACR2	22	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	CCKAR	102	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	NMBR	38	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MC3R	56	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MC5R	64	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MMP2	25	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	GRPR	64	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	ECE1	62	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MMP11	85	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	CCKBR	69	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	GHSR	70	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MMP9	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MC1R	81	35
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	MMP1	17	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	NPR	29	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	SLC15A2	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	KISS1R	71	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1nn2c(c1C)OCCC2	ZINC000450749188	GD	On-Demand	Anodyne	ERAP2	42	37
CCO[C@H]1CCN(c2ncc(C(F)(F)F)s2)C[C@H]1C	ZINC000450749203	CG	On-Demand	Anodyne	MLYCD	58	39
CCO[C@@H]1CCN(c2ncc(C(F)(F)F)s2)C[C@@H]1C	ZINC000450749205	CG	On-Demand	Anodyne	MLYCD	58	39
CCO[C@H]1CCN(c2ncc(C(F)(F)F)s2)C[C@@H]1C	ZINC000450749207	CG	On-Demand	Anodyne	MLYCD	58	39
CCO[C@@H]1CCN(c2ncc(C(F)(F)F)s2)C[C@H]1C	ZINC000450749209	CG	On-Demand	Anodyne	MLYCD	58	39
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@@H]1C	ZINC000450749222	GJ	On-Demand	Anodyne	ADRB2	18	48
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@@H]1C	ZINC000450749222	GJ	On-Demand	Anodyne	PDE3A	41	37
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@@H]1C	ZINC000450749222	GJ	On-Demand	Anodyne	ADRB3	18	54
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@@H]1C	ZINC000450749222	GJ	On-Demand	Anodyne	PDE3B	64	37
CCO[C@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@H]1C	ZINC000450749224	GJ	On-Demand	Anodyne	ADRB2	18	48
CCO[C@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@H]1C	ZINC000450749224	GJ	On-Demand	Anodyne	PDE3A	41	37
CCO[C@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@H]1C	ZINC000450749224	GJ	On-Demand	Anodyne	ADRB3	18	54
CCO[C@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@H]1C	ZINC000450749224	GJ	On-Demand	Anodyne	PDE3B	64	37
CCO[C@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@@H]1C	ZINC000450749226	GJ	On-Demand	Anodyne	ADRB2	18	48
CCO[C@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@@H]1C	ZINC000450749226	GJ	On-Demand	Anodyne	PDE3A	41	37
CCO[C@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@@H]1C	ZINC000450749226	GJ	On-Demand	Anodyne	ADRB3	18	54
CCO[C@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@@H]1C	ZINC000450749226	GJ	On-Demand	Anodyne	PDE3B	64	37
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@H]1C	ZINC000450749227	GJ	On-Demand	Anodyne	ADRB2	18	48
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@H]1C	ZINC000450749227	GJ	On-Demand	Anodyne	PDE3A	41	37
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@H]1C	ZINC000450749227	GJ	On-Demand	Anodyne	ADRB3	18	54
CCO[C@@H]1CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C[C@H]1C	ZINC000450749227	GJ	On-Demand	Anodyne	PDE3B	64	37
CCO[C@H]1CCN(c2nc(N3CC[C@@H](OCC)[C@@H](C)C3)ncc2OC)C[C@H]1C	ZINC000450749230	GF	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2nc(N3CC[C@@H](OCC)[C@@H](C)C3)ncc2OC)C[C@H]1C	ZINC000450749230	GF	On-Demand	Anodyne	PDE3B	70	38
CCO[C@H]1CCN(c2nc(N3CC[C@@H](OCC)[C@@H](C)C3)ncc2OC)C[C@@H]1C	ZINC000450749232	GF	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2nc(N3CC[C@@H](OCC)[C@@H](C)C3)ncc2OC)C[C@@H]1C	ZINC000450749232	GF	On-Demand	Anodyne	PDE3B	70	38
CCO[C@H]1CCN(c2nc(N3CC[C@@H](OCC)[C@H](C)C3)ncc2OC)C[C@@H]1C	ZINC000450749233	GF	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2nc(N3CC[C@@H](OCC)[C@H](C)C3)ncc2OC)C[C@@H]1C	ZINC000450749233	GF	On-Demand	Anodyne	PDE3B	70	38
CCO[C@H]1CCN(c2nc(N3CC[C@@H](OCC)[C@H](C)C3)ncc2OC)C[C@H]1C	ZINC000450749234	GF	On-Demand	Anodyne	PDE3A	47	38
CCO[C@H]1CCN(c2nc(N3CC[C@@H](OCC)[C@H](C)C3)ncc2OC)C[C@H]1C	ZINC000450749234	GF	On-Demand	Anodyne	PDE3B	70	38
CCO[C@@H]1CCN(c2nc(O)c3ccccc3n2)C[C@H]1C	ZINC000450749247	CF	On-Demand	Anodyne	TNKS	40	32
CCO[C@H]1CCN(c2nc(O)c3ccccc3n2)C[C@@H]1C	ZINC000450749249	CF	On-Demand	Anodyne	TNKS	40	32
CCO[C@H]1CCN(c2nc(O)c3ccccc3n2)C[C@H]1C	ZINC000450749251	CF	On-Demand	Anodyne	TNKS	40	32
CCO[C@@H]1CCN(c2nc(O)c3ccccc3n2)C[C@@H]1C	ZINC000450749253	CF	On-Demand	Anodyne	TNKS	40	32
CC[C@H]1CCC[C@@H]1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749269	EH	On-Demand	Anodyne	SCN9A	0	40
CC[C@@H]1CCC[C@@H]1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749270	EH	On-Demand	Anodyne	SCN9A	0	40
CC[C@H]1CCC[C@H]1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749272	EH	On-Demand	Anodyne	SCN9A	0	40
CC[C@@H]1CCC[C@H]1C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749274	EH	On-Demand	Anodyne	SCN9A	0	40
CCO[C@@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@@H]1C	ZINC000450749276	EI	On-Demand	Anodyne	PDE3B	58	34
CCO[C@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@@H]1C	ZINC000450749277	EI	On-Demand	Anodyne	PDE3B	58	34
CCO[C@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@H]1C	ZINC000450749278	EI	On-Demand	Anodyne	PDE3B	58	34
CCO[C@@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@H]1C	ZINC000450749279	EI	On-Demand	Anodyne	PDE3B	58	34
CC(=O)c1cccc(CN2CCC(C)(CN3CCN(C)CC3)CC2)c1	ZINC000450749289	EF	On-Demand	Anodyne	MCHR2	50	33
CC(=O)c1cccc(CN2CCC(C)(CN3CCN(C)CC3)CC2)c1	ZINC000450749289	EF	On-Demand	Anodyne	MGLL	0	44
O=C(NC1CC1)N[C@H]1CCN(CC2=CCCCC2)C1	ZINC000450749290	CE	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CC1)N[C@H]1CCN(CC2=CCCCC2)C1	ZINC000450749290	CE	On-Demand	Anodyne	CCR3	17	50
O=C(NC1CC1)N[C@H]1CCN(CC2=CCCCC2)C1	ZINC000450749290	CE	On-Demand	Anodyne	CXCR3	19	62
O=C(NC1CC1)N[C@H]1CCN(CC2=CCCCC2)C1	ZINC000450749290	CE	On-Demand	Anodyne	MCHR1	15	41
O=C(NC1CC1)N[C@@H]1CCN(CC2=CCCCC2)C1	ZINC000450749291	CE	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CC1)N[C@@H]1CCN(CC2=CCCCC2)C1	ZINC000450749291	CE	On-Demand	Anodyne	CCR3	17	50
O=C(NC1CC1)N[C@@H]1CCN(CC2=CCCCC2)C1	ZINC000450749291	CE	On-Demand	Anodyne	CXCR3	19	62
O=C(NC1CC1)N[C@@H]1CCN(CC2=CCCCC2)C1	ZINC000450749291	CE	On-Demand	Anodyne	MCHR1	15	41
C[C@H](NC(=O)CCc1ccc(C(N)=O)cc1)C1(c2ccccc2)CCCC1	ZINC000450749314	FH	On-Demand	Anodyne	CCKBR	41	36
C[C@@H](NC(=O)CCc1ccc(C(N)=O)cc1)C1(c2ccccc2)CCCC1	ZINC000450749315	FH	On-Demand	Anodyne	CCKBR	41	36
CCO[C@@H]1CCN(c2ncccc2C(F)(F)F)C[C@@H]1C	ZINC000450749324	CG	On-Demand	Anodyne	TRPV1	30	44
CCO[C@@H]1CCN(c2ncccc2C(F)(F)F)C[C@@H]1C	ZINC000450749324	CG	On-Demand	Anodyne	RBP4	15	41
CCO[C@H]1CCN(c2ncccc2C(F)(F)F)C[C@@H]1C	ZINC000450749325	CG	On-Demand	Anodyne	TRPV1	30	44
CCO[C@H]1CCN(c2ncccc2C(F)(F)F)C[C@@H]1C	ZINC000450749325	CG	On-Demand	Anodyne	RBP4	15	41
CCO[C@H]1CCN(c2ncccc2C(F)(F)F)C[C@H]1C	ZINC000450749326	CG	On-Demand	Anodyne	TRPV1	30	44
CCO[C@H]1CCN(c2ncccc2C(F)(F)F)C[C@H]1C	ZINC000450749326	CG	On-Demand	Anodyne	RBP4	15	41
CCO[C@@H]1CCN(c2ncccc2C(F)(F)F)C[C@H]1C	ZINC000450749327	CG	On-Demand	Anodyne	TRPV1	30	44
CCO[C@@H]1CCN(c2ncccc2C(F)(F)F)C[C@H]1C	ZINC000450749327	CG	On-Demand	Anodyne	RBP4	15	41
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000450749342	FJ	On-Demand	Anodyne	MST1R	44	36
CCN(C)C(=O)CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450749343	FE	On-Demand	Anodyne	PYGL	72	52
CSCCCCCNC(=O)c1cn2nccc2nc1C	ZINC000450749363	CE	On-Demand	Anodyne	DDR1	44	41
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749367	FE	On-Demand	Anodyne	DRD4	32	42
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749367	FE	On-Demand	Anodyne	HTR4	55	36
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749367	FE	On-Demand	Anodyne	SIGMAR1	15	43
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749367	FE	On-Demand	Anodyne	SSTR5	67	40
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749367	FE	On-Demand	Anodyne	CCR1	27	40
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749367	FE	On-Demand	Anodyne	CCR3	54	44
COC(=O)c1cn([C@@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749367	FE	On-Demand	Anodyne	MCHR1	26	43
COC(=O)c1cn([C@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749368	FE	On-Demand	Anodyne	DRD4	32	42
COC(=O)c1cn([C@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749368	FE	On-Demand	Anodyne	HTR4	55	36
COC(=O)c1cn([C@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749368	FE	On-Demand	Anodyne	SIGMAR1	15	43
COC(=O)c1cn([C@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749368	FE	On-Demand	Anodyne	SSTR5	67	40
COC(=O)c1cn([C@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749368	FE	On-Demand	Anodyne	CCR1	27	40
COC(=O)c1cn([C@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749368	FE	On-Demand	Anodyne	CCR3	54	44
COC(=O)c1cn([C@H]2CCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749368	FE	On-Demand	Anodyne	MCHR1	26	43
CSCCCCCNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450749369	FG	On-Demand	Anodyne	PDE8B	51	32
CSCCCCCNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450749370	FG	On-Demand	Anodyne	PDE8B	51	32
CC(C)(C)c1cccc(NC(=O)c2cncc(Cl)c2)c1O	ZINC000450749374	DH	On-Demand	Anodyne	SCN10A	43	39
COc1cc(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)ncn1	ZINC000450749381	EE	On-Demand	Anodyne	DRD4	48	38
COc1cc(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)ncn1	ZINC000450749381	EE	On-Demand	Anodyne	DRD3	15	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)c4ccc(C)cc4n3)C2)CC1	ZINC000450749382	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	32
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)c4ccc(C)cc4n3)C2)CC1	ZINC000450749383	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	32
CSCCCCCNC(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450749384	GH	On-Demand	Anodyne	DRD2	16	40
CSCCCCCNC(=O)c1ccccc1-n1cc(Br)cn1	ZINC000450749384	GH	On-Demand	Anodyne	DRD3	29	40
CCO[C@H]1CCN(c2nccc3c(OC)cccc23)C[C@@H]1C	ZINC000450749392	DG	On-Demand	Anodyne	PDE3A	30	43
CCO[C@H]1CCN(c2nccc3c(OC)cccc23)C[C@H]1C	ZINC000450749393	DG	On-Demand	Anodyne	PDE3A	30	43
CCO[C@@H]1CCN(c2nccc3c(OC)cccc23)C[C@H]1C	ZINC000450749394	DG	On-Demand	Anodyne	PDE3A	30	43
CCO[C@@H]1CCN(c2nccc3c(OC)cccc23)C[C@@H]1C	ZINC000450749395	DG	On-Demand	Anodyne	PDE3A	30	43
CC[C@@H]1C[C@H]1C(=O)NCCCCCSC	ZINC000450749402	BF	On-Demand	Anodyne	TPP2	19	41
O=C(Cc1ccc(O)c(F)c1)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450749403	DD	On-Demand	Anodyne	P2RX7	17	41
CC(C)c1ccc(C[C@H]2CCN(C[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000450749437	DG	On-Demand	Anodyne	O19067_PIG	0	40
CCO[C@H]1CCN(c2ccnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450749444	DH	On-Demand	Anodyne	PDE3A	48	39
CCO[C@H]1CCN(c2ccnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450749444	DH	On-Demand	Anodyne	PDE3B	72	39
CCO[C@H]1CCN(c2ccnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450749445	DH	On-Demand	Anodyne	PDE3A	48	39
CCO[C@H]1CCN(c2ccnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450749445	DH	On-Demand	Anodyne	PDE3B	72	39
CCO[C@@H]1CCN(c2ccnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450749446	DH	On-Demand	Anodyne	PDE3A	48	39
CCO[C@@H]1CCN(c2ccnc3cc(F)c(OC)cc23)C[C@H]1C	ZINC000450749446	DH	On-Demand	Anodyne	PDE3B	72	39
CCO[C@@H]1CCN(c2ccnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450749447	DH	On-Demand	Anodyne	PDE3A	48	39
CCO[C@@H]1CCN(c2ccnc3cc(F)c(OC)cc23)C[C@@H]1C	ZINC000450749447	DH	On-Demand	Anodyne	PDE3B	72	39
CN(CCCC(=O)c1ccccc1)CC1(O)CCC1	ZINC000450749452	CE	On-Demand	Anodyne	CYP2J2	46	33
CCS(=O)(=O)c1ccc(CN2CCN(c3ccnc(C)n3)CC2)cc1	ZINC000450749457	FD	On-Demand	Anodyne	SORD	60	39
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	HTR1A	24	47
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	THRA	0	42
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	DRD2	33	48
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	DRD4	0	46
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	ADRA2B	0	42
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	HTR7	35	49
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	SIGMAR1	30	42
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	SLC18A3	0	51
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	EBP	29	42
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	HTR3B	0	41
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	CYP2J2	63	45
CN1CCN(CC2(C)CCN(CCCC(=O)c3ccccc3)CC2)CC1	ZINC000450749463	FF	On-Demand	Anodyne	AP2S1	0	42
NC(=O)c1ccc(-c2nnn(C[C@@H]3CCC(F)(F)C3)n2)cc1	ZINC000450749482	DD	On-Demand	Anodyne	SCARB1	41	35
NC(=O)c1ccc(-c2nnn(C[C@H]3CCC(F)(F)C3)n2)cc1	ZINC000450749483	DD	On-Demand	Anodyne	SCARB1	41	35
Cc1nccc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)n1	ZINC000450749488	EE	On-Demand	Anodyne	SORD	66	43
Cc1nccc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)n1	ZINC000450749489	EE	On-Demand	Anodyne	SORD	66	43
Cc1nccc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)n1	ZINC000450749490	EE	On-Demand	Anodyne	SORD	66	43
Cc1nccc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)n1	ZINC000450749491	EE	On-Demand	Anodyne	SORD	66	43
CCO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450749496	EH	On-Demand	Bother	LIPG	63	44
CCO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450749497	EH	On-Demand	Bother	LIPG	63	44
CCO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450749498	EH	On-Demand	Bother	LIPG	63	44
CCO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450749499	EH	On-Demand	Bother	LIPG	63	44
C[C@H]1C[C@@]1(C#N)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749511	EE	On-Demand	Mild	SCN9A	0	40
C[C@H]1C[C@]1(C#N)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749512	EE	On-Demand	Mild	SCN9A	0	40
C[C@@H]1C[C@]1(C#N)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749513	EE	On-Demand	Mild	SCN9A	0	40
C[C@@H]1C[C@@]1(C#N)C(=O)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450749514	EE	On-Demand	Mild	SCN9A	0	40
Cc1ccc(C(C)(C)NCc2c(C)cccc2Cl)cn1	ZINC000450749515	CI	On-Demand	Anodyne	EIF2AK1	41	35
CC(=O)c1ccc(CN2CCO[C@H](C3CCCCC3)C2)cc1	ZINC000450749528	DH	On-Demand	Anodyne	DRD4	21	40
CC(=O)c1ccc(CN2CCO[C@@H](C3CCCCC3)C2)cc1	ZINC000450749529	DH	On-Demand	Anodyne	DRD4	21	40
CC(C)c1ccc(C[C@H]2CCN(C[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000450749538	DG	On-Demand	Anodyne	O19067_PIG	0	40
CC(C)c1ccc(C[C@@H]2CCN(C[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000450749539	DG	On-Demand	Anodyne	O19067_PIG	0	40
CC(C)c1ccc(C[C@@H]2CCN(C[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000450749540	DG	On-Demand	Anodyne	O19067_PIG	0	40
Cc1nn(C)cc1CSc1nc2ccccc2c(=O)n1CCCCCC(N)=O	ZINC000450749541	GF	On-Demand	Anodyne	PTGDR2	15	40
Cc1ccc(Br)cc1CC(=O)NCc1nc(C(F)(F)F)n[nH]1	ZINC000450749543	GF	On-Demand	Anodyne	P2RX7	21	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	OPRM1	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	OPRD1	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	GHRHR	29	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MME	25	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	EDNRB	53	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	TACR1	26	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MC4R	43	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	BMP1	29	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	TACR2	23	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	CCKAR	97	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	CTSL	29	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	BRS3	25	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	NMBR	31	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MC3R	59	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MC5R	62	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MMP2	23	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MMP8	39	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MMP14	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	GRPR	78	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	ECE1	59	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MMP11	76	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	CCKBR	67	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	GHSR	86	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MMP9	24	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MC1R	77	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MMP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	NPR	32	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	MAGI3	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	SLC15A2	0	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	KISS1R	66	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	ERAP2	44	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	LASB	0	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn1cc(C(C)=O)nn1	ZINC000450749547	FC	On-Demand	Anodyne	NRDE	0	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	ACE	74	51
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	FKBP1A	69	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	ELANE	36	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	MME	17	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	CMA1	41	36
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	PREP	74	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	AMY2	45	31
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	ACE2	28	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	FKBP12.6	0	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C	ZINC000450749556	EH	On-Demand	Anodyne	BRCA1	45	32
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	ACE	74	51
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	FKBP1A	69	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	ELANE	36	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	MME	17	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	CMA1	41	36
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	PREP	74	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	AMY2	45	31
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	ACE2	28	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	FKBP12.6	0	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C	ZINC000450749557	EH	On-Demand	Anodyne	BRCA1	45	32
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	ACE	74	51
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	FKBP1A	69	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	ELANE	36	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	MME	17	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	CMA1	41	36
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	PREP	74	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	AMY2	45	31
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	ACE2	28	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	FKBP12.6	0	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000450749558	EH	On-Demand	Anodyne	BRCA1	45	32
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	ACE	74	51
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	FKBP1A	69	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	ELANE	36	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	MME	17	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	CMA1	41	36
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	PREP	74	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	AMY2	45	31
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	ACE2	28	43
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	FKBP12.6	0	41
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C	ZINC000450749559	EH	On-Demand	Anodyne	BRCA1	45	32
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	ACE	22	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	SSTR2	72	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	OPRM1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	OPRD1	0	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	GHRHR	33	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MME	28	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	EDNRB	53	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	EDNRA	47	54
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	TACR1	34	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MC4R	46	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	BMP1	30	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	TACR2	49	52
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	CCKAR	101	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	CTSL	32	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	BRS3	26	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	TIMP3	31	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	NMBR	63	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MC3R	57	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MC5R	65	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MMP2	27	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MMP8	41	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MMP14	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	GRPR	87	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	ECE1	64	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	SSTR3	35	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MMP11	74	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	CCKBR	83	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	GHSR	79	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MMP9	26	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MC1R	77	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	ADAM9	44	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MMP7	26	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	MMP1	23	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	NPR	35	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	SLC15A2	0	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	KISS1R	68	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	ERAP2	45	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	ERAP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	LASB	0	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC1CC(F)(F)C1	ZINC000450749561	FF	On-Demand	Anodyne	PSMB9	0	40
CC[C@H](O)CC(=O)N(CCc1ccccc1)CC(=O)OC	ZINC000450749579	CD	On-Demand	Anodyne	AMY2	52	30
CC[C@@H](O)CC(=O)N(CCc1ccccc1)CC(=O)OC	ZINC000450749580	CD	On-Demand	Anodyne	AMY2	52	30
CO[C@H](CSc1nnc(NC[C@H]2CCCO2)s1)Cc1ccccc1	ZINC000450749605	FF	On-Demand	Anodyne	TNK2	48	36
CO[C@H](CSc1nnc(NC[C@@H]2CCCO2)s1)Cc1ccccc1	ZINC000450749606	FF	On-Demand	Anodyne	TNK2	48	36
CO[C@@H](CSc1nnc(NC[C@H]2CCCO2)s1)Cc1ccccc1	ZINC000450749607	FF	On-Demand	Anodyne	TNK2	48	36
CO[C@@H](CSc1nnc(NC[C@@H]2CCCO2)s1)Cc1ccccc1	ZINC000450749608	FF	On-Demand	Anodyne	TNK2	48	36
CC1(CO)CCN(Cc2ccc(F)c(CN3CCC(C)(CO)CC3)c2)CC1	ZINC000450749609	GG	On-Demand	Anodyne	SIGMAR1	31	40
CC1(CO)CCN(Cc2ccc(F)c(CN3CCC(C)(CO)CC3)c2)CC1	ZINC000450749609	GG	On-Demand	Anodyne	MCHR2	49	31
C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2ccncc2s1	ZINC000450749629	EI	On-Demand	Anodyne	TRPC6	49	35
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2ccncc2s1	ZINC000450749630	EI	On-Demand	Anodyne	TRPC6	49	35
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2ccncc2s1	ZINC000450749631	EI	On-Demand	Anodyne	TRPC6	49	35
C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2ccncc2s1	ZINC000450749632	EI	On-Demand	Anodyne	TRPC6	49	35
CCO[C@H]1CCN(c2ccc(S(=O)(=O)NC)cc2F)C[C@H]1C	ZINC000450749644	ED	On-Demand	Anodyne	SLC6A9	16	40
CCO[C@@H]1CCN(c2ccc(S(=O)(=O)NC)cc2F)C[C@H]1C	ZINC000450749645	ED	On-Demand	Anodyne	SLC6A9	16	40
CCO[C@H]1CCN(c2ccc(S(=O)(=O)NC)cc2F)C[C@@H]1C	ZINC000450749646	ED	On-Demand	Anodyne	SLC6A9	16	40
CCO[C@@H]1CCN(c2ccc(S(=O)(=O)NC)cc2F)C[C@@H]1C	ZINC000450749647	ED	On-Demand	Anodyne	SLC6A9	16	40
Cc1cc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)ncc1C(N)=O	ZINC000450749674	GD	On-Demand	Anodyne	SCN9A	0	47
CCO[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C[C@@H]1C	ZINC000450749677	EE	On-Demand	Anodyne	HDAC1	28	42
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C[C@H]1C	ZINC000450749678	EE	On-Demand	Anodyne	HDAC1	28	42
CCO[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C[C@@H]1C	ZINC000450749679	EE	On-Demand	Anodyne	HDAC1	28	42
CCO[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C[C@H]1C	ZINC000450749680	EE	On-Demand	Anodyne	HDAC1	28	42
CCO[C@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450749703	EF	On-Demand	Bother	TAAR1	19	47
CCO[C@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450749704	EF	On-Demand	Bother	TAAR1	19	47
CCO[C@@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450749705	EF	On-Demand	Bother	TAAR1	19	47
CCO[C@@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450749706	EF	On-Demand	Bother	TAAR1	19	47
CCO[C@H]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450749726	DE	On-Demand	Bother	TAAR1	19	49
CCO[C@@H]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450749727	DE	On-Demand	Bother	TAAR1	19	49
CCO[C@H]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450749728	DE	On-Demand	Bother	TAAR1	19	49
CCO[C@@H]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450749729	DE	On-Demand	Bother	TAAR1	19	49
CCN(CCC1CC1)Cc1ccc(C(C)=O)cc1	ZINC000450749744	BH	On-Demand	Anodyne	MBTPS1	32	40
O=C(NC1CC1)N[C@H]1CCN(CCC2=CCCCC2)C1	ZINC000450749751	CE	On-Demand	Anodyne	BIRC2	61	33
O=C(NC1CC1)N[C@@H]1CCN(CCC2=CCCCC2)C1	ZINC000450749752	CE	On-Demand	Anodyne	BIRC2	61	33
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	DRD2	27	47
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	DRD4	49	59
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	ACHE	24	47
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	HRH1	23	51
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	HTR4	78	47
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	SIGMAR1	43	53
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	SSTR5	76	49
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	CCR3	64	54
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	UTS2R	41	50
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	CCR2	27	44
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	EPHX2	26	40
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	PDK1	53	40
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	MCHR1	56	59
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	CCR8	26	48
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	CYP3A43	0	47
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	ADIPOR1	0	40
COc1cc(CN2CC[C@@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749759	DE	On-Demand	Anodyne	ADIPOR2	0	40
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	DRD2	27	47
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	DRD4	49	59
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	ACHE	24	47
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	HRH1	23	51
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	HTR4	78	47
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	SIGMAR1	43	53
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	SSTR5	76	49
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	CCR3	64	54
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	UTS2R	41	50
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	CCR2	27	44
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	EPHX2	26	40
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	PDK1	53	40
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	MCHR1	56	59
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	CCR8	26	48
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	CYP3A43	0	47
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	ADIPOR1	0	40
COc1cc(CN2CC[C@H](NC(=O)NC3CC3)C2)ccc1Cl	ZINC000450749760	DE	On-Demand	Anodyne	ADIPOR2	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	ACE	22	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	SSTR2	84	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	OPRM1	17	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MME	30	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	EDNRB	50	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	EDNRA	44	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	TACR1	42	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MC4R	67	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	BMP1	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	TACR2	75	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	CCKAR	138	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	CTSL	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	BRS3	28	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	HDAC8	22	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	NMBR	49	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MC3R	93	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MC5R	97	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MMP2	28	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MMP8	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MMP14	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	GRPR	85	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	ECE1	67	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	HDAC1	19	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	HDAC3	29	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	LNPEP	27	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	SSTR3	49	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MMP11	91	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	CCKBR	113	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	GHSR	75	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MMP9	27	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MC1R	115	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	MMP1	21	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	HDA106	0	65
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	SLC15A2	0	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	KISS1R	79	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	ERAP2	45	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	ERAP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	LASB	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450749762	FD	On-Demand	Anodyne	IL1RN	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	ACE	22	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	SSTR2	84	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	OPRM1	17	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	OPRD1	0	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MME	30	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	EDNRB	50	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	EDNRA	44	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	TACR1	42	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MC4R	67	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	BMP1	28	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	TACR2	75	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	CCKAR	138	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	CTSL	28	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	BRS3	28	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	HDAC8	22	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	NMBR	49	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MC3R	93	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MC5R	97	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MMP2	28	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MMP8	36	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MMP14	24	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	GRPR	85	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	ECE1	67	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	HDAC1	19	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	HDAC3	29	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	LNPEP	27	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	SSTR3	49	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MMP11	91	37
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	CCKBR	113	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	GHSR	75	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MMP9	27	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MC1R	115	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	MMP1	21	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	NPR	32	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	HDA106	0	65
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	SLC15A2	0	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	KISS1R	79	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	ERAP2	45	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	ERAP1	0	42
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	LASB	0	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450749763	FD	On-Demand	Anodyne	IL1RN	0	40
Cc1ccc(F)c(CC(=O)NCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000450749764	DE	On-Demand	Anodyne	P2RX7	36	42
CC(=O)NC[C@H](CC(=O)N[C@H](Cc1ccccn1)c1ccccc1)CC(C)C	ZINC000450749767	GH	On-Demand	Anodyne	SOAT1	15	41
CC(=O)NC[C@H](CC(=O)N[C@@H](Cc1ccccn1)c1ccccc1)CC(C)C	ZINC000450749768	GH	On-Demand	Anodyne	SOAT1	15	41
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749775	EH	On-Demand	Anodyne	SLC6A1	46	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749775	EH	On-Demand	Anodyne	PREP	53	36
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749775	EH	On-Demand	Anodyne	SFRP1	45	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749775	EH	On-Demand	Anodyne	WNT3	44	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749776	EH	On-Demand	Anodyne	SLC6A1	46	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749776	EH	On-Demand	Anodyne	PREP	53	36
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749776	EH	On-Demand	Anodyne	SFRP1	45	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749776	EH	On-Demand	Anodyne	WNT3	44	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749777	EH	On-Demand	Anodyne	SLC6A1	46	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749777	EH	On-Demand	Anodyne	PREP	53	36
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749777	EH	On-Demand	Anodyne	SFRP1	45	32
C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749777	EH	On-Demand	Anodyne	WNT3	44	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749778	EH	On-Demand	Anodyne	SLC6A1	46	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749778	EH	On-Demand	Anodyne	PREP	53	36
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749778	EH	On-Demand	Anodyne	SFRP1	45	32
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749778	EH	On-Demand	Anodyne	WNT3	44	32
C[C@H](Sc1nnnn1C[C@@H]1CCCO1)C(=O)C1CCCCC1	ZINC000450749781	DE	On-Demand	Anodyne	PDE8B	43	38
C[C@@H](Sc1nnnn1C[C@H]1CCCO1)C(=O)C1CCCCC1	ZINC000450749782	DE	On-Demand	Anodyne	PDE8B	43	38
C[C@H](Sc1nnnn1C[C@H]1CCCO1)C(=O)C1CCCCC1	ZINC000450749783	DE	On-Demand	Anodyne	PDE8B	43	38
C[C@@H](Sc1nnnn1C[C@@H]1CCCO1)C(=O)C1CCCCC1	ZINC000450749784	DE	On-Demand	Anodyne	PDE8B	43	38
CC(C)(C)c1cccc(NC(=O)Cc2ccc(O)c(F)c2)c1O	ZINC000450749792	DH	On-Demand	Anodyne	TRPV1	0	54
COC(=O)c1cn([C@@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749801	FF	On-Demand	Anodyne	DRD3	0	42
COC(=O)c1cn([C@@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749801	FF	On-Demand	Anodyne	SSTR5	49	41
COC(=O)c1cn([C@@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749801	FF	On-Demand	Anodyne	CCR3	40	31
COC(=O)c1cn([C@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749802	FF	On-Demand	Anodyne	DRD3	0	42
COC(=O)c1cn([C@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749802	FF	On-Demand	Anodyne	SSTR5	49	41
COC(=O)c1cn([C@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)nn1	ZINC000450749802	FF	On-Demand	Anodyne	CCR3	40	31
O=C(NCc1cccc(N2CCOCC2)n1)c1ccc(C(F)(F)F)[nH]1	ZINC000450749807	FE	On-Demand	Anodyne	PIK3CB	54	38
CCC(=O)CCCN1CCCC[C@H]1c1ccccc1	ZINC000450749810	CH	On-Demand	Anodyne	SLC6A1	66	36
CCC(=O)CCCN1CCCC[C@H]1c1ccccc1	ZINC000450749810	CH	On-Demand	Anodyne	CPT1A	53	34
CCC(=O)CCCN1CCCC[C@H]1c1ccccc1	ZINC000450749810	CH	On-Demand	Anodyne	Q7YY76_CRYPV	0	41
CCC(=O)CCCN1CCCC[C@H]1c1ccccc1	ZINC000450749810	CH	On-Demand	Anodyne	Q7YY07_CRYPV	63	39
CCC(=O)CCCN1CCCC[C@@H]1c1ccccc1	ZINC000450749811	CH	On-Demand	Anodyne	SLC6A1	66	36
CCC(=O)CCCN1CCCC[C@@H]1c1ccccc1	ZINC000450749811	CH	On-Demand	Anodyne	CPT1A	53	34
CCC(=O)CCCN1CCCC[C@@H]1c1ccccc1	ZINC000450749811	CH	On-Demand	Anodyne	Q7YY76_CRYPV	0	41
CCC(=O)CCCN1CCCC[C@@H]1c1ccccc1	ZINC000450749811	CH	On-Demand	Anodyne	Q7YY07_CRYPV	63	39
O=c1c2ccc(Cl)cc2ncn1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450749827	CF	On-Demand	Anodyne	HRP1_PLAFA	67	31
O=c1c2ccc(Cl)cc2ncn1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450749828	CF	On-Demand	Anodyne	HRP1_PLAFA	67	31
Cc1nn(C)cc1CSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450749838	FG	On-Demand	Anodyne	TNKS	58	33
COCCOC[C@@H](O)CN1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450749841	FC	On-Demand	Anodyne	HSP90AB1	35	41
COCCOC[C@H](O)CN1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450749842	FC	On-Demand	Anodyne	HSP90AB1	35	41
CO[C@H]1CCN(c2cc(C)nc3ccccc23)CC1(C)C	ZINC000450749855	CH	On-Demand	Anodyne	HTR1D	40	36
CO[C@@H]1CCN(c2cc(C)nc3ccccc23)CC1(C)C	ZINC000450749856	CH	On-Demand	Anodyne	HTR1D	40	36
CCOC(=O)c1ccc(CN2CC[C@@H](NC(=O)NC)C2)nc1	ZINC000450749865	DC	On-Demand	Anodyne	SSTR5	49	42
CCOC(=O)c1ccc(CN2CC[C@H](NC(=O)NC)C2)nc1	ZINC000450749866	DC	On-Demand	Anodyne	SSTR5	49	42
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749873	GE	On-Demand	Anodyne	HTR1A	15	43
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749873	GE	On-Demand	Anodyne	SLC6A1	75	34
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450749873	GE	On-Demand	Anodyne	GPBAR1	25	42
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749874	GE	On-Demand	Anodyne	HTR1A	15	43
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749874	GE	On-Demand	Anodyne	SLC6A1	75	34
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450749874	GE	On-Demand	Anodyne	GPBAR1	25	42
CO[C@H]1CCN(c2ncnc(CC(C)C)c2I)C[C@@H]1C	ZINC000450749879	GG	On-Demand	Anodyne	PDE3B	46	32
CO[C@@H]1CCN(c2ncnc(CC(C)C)c2I)C[C@H]1C	ZINC000450749880	GG	On-Demand	Anodyne	PDE3B	46	32
CO[C@@H]1CCN(c2ncnc(CC(C)C)c2I)C[C@@H]1C	ZINC000450749881	GG	On-Demand	Anodyne	PDE3B	46	32
CO[C@H]1CCN(c2ncnc(CC(C)C)c2I)C[C@H]1C	ZINC000450749882	GG	On-Demand	Anodyne	PDE3B	46	32
CS(=O)(=O)CCCCCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450749893	GD	On-Demand	Bother	TBXAS1	17	41
CS(=O)(=O)CCCCCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450749893	GD	On-Demand	Bother	PTAFR	16	41
Cc1nn(C)cc1CC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450749899	FF	On-Demand	Anodyne	P2RX7	42	38
Cc1nn(C)cc1CC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450749899	FF	On-Demand	Anodyne	SFRP1	54	34
Cc1nn(C)cc1CC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450749900	FF	On-Demand	Anodyne	P2RX7	42	38
Cc1nn(C)cc1CC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450749900	FF	On-Demand	Anodyne	SFRP1	54	34
COCCC1(CNC(=O)c2ccsc2Br)CCCCC1	ZINC000450749903	FI	On-Demand	Anodyne	HCN1	58	38
COCCC1(CNC(=O)c2ccsc2Br)CCCCC1	ZINC000450749903	FI	On-Demand	Anodyne	HCN4	53	34
COc1cc(OC)c2ncc(C#N)c(N3CC[C@@H](OC)[C@@H](C)C3)c2c1	ZINC000450749908	EF	On-Demand	Mild	PDE3B	61	36
COc1cc(OC)c2ncc(C#N)c(N3CC[C@H](OC)[C@@H](C)C3)c2c1	ZINC000450749909	EF	On-Demand	Mild	PDE3B	61	36
COc1cc(OC)c2ncc(C#N)c(N3CC[C@@H](OC)[C@H](C)C3)c2c1	ZINC000450749910	EF	On-Demand	Mild	PDE3B	61	36
COc1cc(OC)c2ncc(C#N)c(N3CC[C@H](OC)[C@H](C)C3)c2c1	ZINC000450749911	EF	On-Demand	Mild	PDE3B	61	36
CCOC(=O)c1cccnc1N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000450749912	FH	On-Demand	Bother	SLC27A4	55	36
CCOC(=O)c1cccnc1N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000450749913	FH	On-Demand	Bother	SLC27A4	55	36
COC(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(F)c(C)c2)cc1Cl	ZINC000450749938	GH	On-Demand	Anodyne	LEF	53	40
COC(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(F)c(C)c2)cc1Cl	ZINC000450749939	GH	On-Demand	Anodyne	LEF	53	40
CO[C@H]1CCN(c2ncnc3sc4ccccc4c23)CC1(C)C	ZINC000450749943	EI	On-Demand	Anodyne	PDE3B	50	34
CO[C@@H]1CCN(c2ncnc3sc4ccccc4c23)CC1(C)C	ZINC000450749946	EI	On-Demand	Anodyne	PDE3B	50	34
COCCC1(CNC(=O)c2cn(CC3CC3)nn2)CCCCC1	ZINC000450749957	DE	On-Demand	Anodyne	HCN4	54	36
CNC(=O)N[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450749964	CE	On-Demand	Anodyne	SLC6A1	70	36
CNC(=O)N[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450749964	CE	On-Demand	Anodyne	BIRC2	67	37
CNC(=O)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450749965	CE	On-Demand	Anodyne	DRD4	19	41
CNC(=O)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450749965	CE	On-Demand	Anodyne	SLC6A1	70	36
CNC(=O)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450749965	CE	On-Demand	Anodyne	CCR3	16	44
CNC(=O)N[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450749965	CE	On-Demand	Anodyne	BIRC2	67	37
CNC(=O)N[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450749966	CE	On-Demand	Anodyne	SLC6A1	70	36
CNC(=O)N[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450749966	CE	On-Demand	Anodyne	BIRC2	67	37
CNC(=O)N[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450749968	CE	On-Demand	Anodyne	SLC6A1	70	36
CNC(=O)N[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450749968	CE	On-Demand	Anodyne	BIRC2	67	37
CCOC(=O)c1csc(N2CC[C@@H](OC)[C@@H](C)C2)n1	ZINC000450749993	CE	On-Demand	Anodyne	GYRB	0	45
CCOC(=O)c1csc(N2CC[C@H](OC)[C@H](C)C2)n1	ZINC000450749994	CE	On-Demand	Anodyne	GYRB	0	45
CCOC(=O)c1csc(N2CC[C@@H](OC)[C@H](C)C2)n1	ZINC000450749995	CE	On-Demand	Anodyne	GYRB	0	45
CCOC(=O)c1csc(N2CC[C@H](OC)[C@@H](C)C2)n1	ZINC000450749999	CE	On-Demand	Anodyne	GYRB	0	45
COc1cc(OC)c2ncnc(N3CC[C@H](OC)C(C)(C)C3)c2c1	ZINC000450750026	EF	On-Demand	Anodyne	PDE3A	53	42
COc1cc(OC)c2ncnc(N3CC[C@@H](OC)C(C)(C)C3)c2c1	ZINC000450750027	EF	On-Demand	Anodyne	PDE3A	53	42
COC(=O)[C@H](NCC/C=C\c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450750028	EG	On-Demand	Anodyne	TUBB1	40	36
COC(=O)[C@@H](NCC/C=C/c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450750030	EG	On-Demand	Anodyne	TUBB1	40	36
COC(=O)[C@@H](NCC/C=C\c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450750032	EG	On-Demand	Anodyne	TUBB1	40	36
COC(=O)[C@H](NCC/C=C/c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450750034	EG	On-Demand	Anodyne	TUBB1	40	36
CO[C@H]1CCN(c2nc(-c3ccccc3)cs2)CC1(C)C	ZINC000450750051	DI	On-Demand	Anodyne	EGFR	0	43
CO[C@@H]1CCN(c2nc(-c3ccccc3)cs2)CC1(C)C	ZINC000450750053	DI	On-Demand	Anodyne	EGFR	0	43
C[C@H](O)CCSc1cccc2cccnc12	ZINC000450750066	BG	On-Demand	Anodyne	CCR1	15	40
C[C@H](O)CCSc1cccc2cccnc12	ZINC000450750066	BG	On-Demand	Anodyne	METAP2	17	43
C[C@@H](O)CCSc1cccc2cccnc12	ZINC000450750067	BG	On-Demand	Anodyne	CCR1	15	40
C[C@@H](O)CCSc1cccc2cccnc12	ZINC000450750067	BG	On-Demand	Anodyne	METAP2	17	43
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	DRD2	37	43
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	DRD1	21	48
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	DRD4	19	48
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	HTR2A	22	49
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	HTR2C	20	44
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	DRD3	19	48
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	ERG2	19	42
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	HTR7	17	42
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	HRH3	17	44
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	SIGMAR1	22	45
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	HTR5A	19	46
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	SLC18A3	0	41
COc1ccc(CN2CCCN(CCCC(=O)c3ccc(F)cc3)CC2=O)cc1	ZINC000450750074	GH	On-Demand	Anodyne	CYP2J2	48	34
O=C(NCCN1c2ccccc2NS1(=O)=O)c1coc(C2CCCCC2)n1	ZINC000450750079	GF	On-Demand	Anodyne	TBXA2R	32	40
Cc1ccn2ncc(C(=O)N3CCC[C@@]4(C3)OCc3ccccc34)c2c1	ZINC000450750084	EG	On-Demand	Anodyne	EPHB3	24	40
Cc1ccn2ncc(C(=O)N3CCC[C@]4(C3)OCc3ccccc34)c2c1	ZINC000450750085	EG	On-Demand	Anodyne	EPHB3	24	40
COC(=O)c1coc(CNC2(Cc3ccccc3)CCCCC2)n1	ZINC000450750091	EG	On-Demand	Anodyne	NPPA	42	36
CNC(=O)N[C@@H]1CCN(CCC2=CCCCC2)C1	ZINC000450750094	CD	On-Demand	Anodyne	BIRC2	83	37
CNC(=O)N[C@H]1CCN(CCC2=CCCCC2)C1	ZINC000450750096	CD	On-Demand	Anodyne	BIRC2	83	37
CO[C@H]1CCN(c2nc3cccc(C)c3s2)C[C@@H]1C	ZINC000450750105	CG	On-Demand	Anodyne	GYRB	0	44
CO[C@@H]1CCN(c2nc3cccc(C)c3s2)C[C@H]1C	ZINC000450750110	CG	On-Demand	Anodyne	GYRB	0	44
COCC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750111	CH	On-Demand	Anodyne	DRD2	18	44
COCC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750111	CH	On-Demand	Anodyne	ACHE	30	41
COCC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750111	CH	On-Demand	Anodyne	HRH2	29	40
COCC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750111	CH	On-Demand	Anodyne	SLC6A1	65	35
COCC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750111	CH	On-Demand	Anodyne	CHRM3	18	40
COCC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750111	CH	On-Demand	Anodyne	SIGMAR1	23	41
COCC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750111	CH	On-Demand	Anodyne	CCR3	56	41
COCC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750111	CH	On-Demand	Anodyne	MCHR1	20	42
COCC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750112	CH	On-Demand	Anodyne	DRD2	18	44
COCC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750112	CH	On-Demand	Anodyne	ACHE	30	41
COCC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750112	CH	On-Demand	Anodyne	HRH2	29	40
COCC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750112	CH	On-Demand	Anodyne	SLC6A1	65	35
COCC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750112	CH	On-Demand	Anodyne	CHRM3	18	40
COCC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750112	CH	On-Demand	Anodyne	SIGMAR1	23	41
COCC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750112	CH	On-Demand	Anodyne	CCR3	56	41
COCC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750112	CH	On-Demand	Anodyne	MCHR1	20	42
CO[C@@H]1CCN(c2nc3cccc(C)c3s2)C[C@@H]1C	ZINC000450750114	CG	On-Demand	Anodyne	GYRB	0	44
CO[C@H]1CCN(c2nc3cccc(C)c3s2)C[C@H]1C	ZINC000450750115	CG	On-Demand	Anodyne	GYRB	0	44
CO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)CC1(C)C	ZINC000450750116	DG	On-Demand	Anodyne	PDE3A	56	43
CO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)CC1(C)C	ZINC000450750116	DG	On-Demand	Anodyne	PDE3B	83	43
CO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)CC1(C)C	ZINC000450750117	DG	On-Demand	Anodyne	PDE3A	56	43
CO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)CC1(C)C	ZINC000450750117	DG	On-Demand	Anodyne	PDE3B	83	43
COc1ccc(CNC(=O)CCn2cnc3ccsc3c2=O)c(OC)c1	ZINC000450750140	FE	On-Demand	Anodyne	PDGFRB	44	41
COc1ccc(CNC(=O)CCn2cnc3ccsc3c2=O)c(OC)c1	ZINC000450750140	FE	On-Demand	Anodyne	CSF1R	17	41
CO[C@H](Cc1ccccc1)CN1C(=O)[C@@H]2CCCCN2C1=O	ZINC000450750143	DE	On-Demand	Anodyne	AVPR2	15	40
CO[C@@H](Cc1ccccc1)CN1C(=O)[C@@H]2CCCCN2C1=O	ZINC000450750144	DE	On-Demand	Anodyne	AVPR2	15	40
CC[C@H](C(=O)NCCN1c2ccccc2NS1(=O)=O)c1ccc(OC)cc1	ZINC000450750159	GE	On-Demand	Anodyne	KCNQ2	47	51
CC[C@@H](C(=O)NCCN1c2ccccc2NS1(=O)=O)c1ccc(OC)cc1	ZINC000450750160	GE	On-Demand	Anodyne	KCNQ2	47	51
c1ccc2c(c1)CO[C@]21CCN(Cc2nnc(C3CC3)s2)C1	ZINC000450750170	DG	On-Demand	Anodyne	SIGMAR1	23	46
c1ccc2c(c1)CO[C@]21CCN(Cc2nnc(C3CC3)s2)C1	ZINC000450750170	DG	On-Demand	Anodyne	SLC18A3	21	41
c1ccc2c(c1)CO[C@@]21CCN(Cc2nnc(C3CC3)s2)C1	ZINC000450750171	DG	On-Demand	Anodyne	SIGMAR1	23	46
c1ccc2c(c1)CO[C@@]21CCN(Cc2nnc(C3CC3)s2)C1	ZINC000450750171	DG	On-Demand	Anodyne	SLC18A3	21	41
C1=C(CN2CC[C@]3(C2)OCc2ccccc23)CCCC1	ZINC000450750185	CH	On-Demand	Anodyne	SIGMAR1	37	53
C1=C(CN2CC[C@@]3(C2)OCc2ccccc23)CCCC1	ZINC000450750186	CH	On-Demand	Anodyne	SIGMAR1	37	53
CC(=O)CCCCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750195	CG	On-Demand	Anodyne	HRP1_PLAFA	92	35
CC(=O)CCCCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750195	CG	On-Demand	Anodyne	HNMT	45	35
CC(=O)CCCCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750195	CG	On-Demand	Anodyne	SCD1	15	46
CC(=O)CCCCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750195	CG	On-Demand	Anodyne	SCD	31	40
COC(=O)[C@@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(F)c(C)c1	ZINC000450750196	FF	On-Demand	Anodyne	LEF	53	31
COC(=O)[C@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(F)c(C)c1	ZINC000450750197	FF	On-Demand	Anodyne	LEF	53	31
C=CC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750217	EH	On-Demand	Mild	MTNR1A	32	42
C=CC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750217	EH	On-Demand	Mild	MTNR1B	0	42
C=CC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750217	EH	On-Demand	Mild	RBP4	83	37
C=CC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750217	EH	On-Demand	Mild	SFRP1	120	37
C=CC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750217	EH	On-Demand	Mild	WNT3	81	35
C=CC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750219	EH	On-Demand	Mild	MTNR1A	32	42
C=CC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750219	EH	On-Demand	Mild	MTNR1B	0	42
C=CC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750219	EH	On-Demand	Mild	RBP4	83	37
C=CC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750219	EH	On-Demand	Mild	SFRP1	120	37
C=CC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750219	EH	On-Demand	Mild	WNT3	81	35
CC[C@H](O)CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450750252	CD	On-Demand	Anodyne	P2RX7	43	58
CC[C@@H](O)CC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450750253	CD	On-Demand	Anodyne	P2RX7	43	58
CC(C)C[C@H](C(=O)NCCN1c2ccccc2NS1(=O)=O)c1ccccc1	ZINC000450750254	GG	On-Demand	Anodyne	KCNQ2	40	37
CC(C)C[C@@H](C(=O)NCCN1c2ccccc2NS1(=O)=O)c1ccccc1	ZINC000450750255	GG	On-Demand	Anodyne	KCNQ2	40	37
O=C(c1ccsn1)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450750265	DF	On-Demand	Anodyne	AVPR1A	0	44
O=C(c1ccsn1)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450750266	DF	On-Demand	Anodyne	AVPR1A	0	44
CN(Cc1ccccc1)[C@@H](CNC(=O)C1(C(F)(F)F)CCC1)C1CC1	ZINC000450750269	FH	On-Demand	Anodyne	SDH1	0	41
CN(Cc1ccccc1)[C@H](CNC(=O)C1(C(F)(F)F)CCC1)C1CC1	ZINC000450750270	FH	On-Demand	Anodyne	SDH1	0	41
COCCC1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCCCC1	ZINC000450750286	FH	On-Demand	Anodyne	HCN1	63	41
COCCC1(CNC(=O)c2ccn(CCc3ccccc3)n2)CCCCC1	ZINC000450750286	FH	On-Demand	Anodyne	HCN4	59	38
CS(=O)(=O)CCCCCNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450750287	FE	On-Demand	Anodyne	TRPV1	18	40
CS(=O)(=O)CCCCCNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450750287	FE	On-Demand	Anodyne	GRIA1	40	31
CC(=O)c1cccc(CN2CCO[C@H](c3cccc(Cl)c3)C2)c1	ZINC000450750313	EI	On-Demand	Anodyne	DRD4	31	42
CC(=O)c1cccc(CN2CCO[C@H](c3cccc(Cl)c3)C2)c1	ZINC000450750313	EI	On-Demand	Anodyne	CHRM3	15	41
CC(=O)c1cccc(CN2CCO[C@H](c3cccc(Cl)c3)C2)c1	ZINC000450750313	EI	On-Demand	Anodyne	MCHR1	21	40
CC(=O)c1cccc(CN2CCO[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000450750314	EI	On-Demand	Anodyne	DRD4	31	42
CC(=O)c1cccc(CN2CCO[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000450750314	EI	On-Demand	Anodyne	CHRM3	15	41
CC(=O)c1cccc(CN2CCO[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000450750314	EI	On-Demand	Anodyne	MCHR1	21	40
COCCC1(CNC(=O)Cc2ccc(O)c(F)c2)CCCCC1	ZINC000450750315	DG	On-Demand	Anodyne	CAN2	0	47
CC(C)(CO)C(C)(C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450750326	EE	On-Demand	Anodyne	PSBA	0	44
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750337	EH	On-Demand	Anodyne	MME	40	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750337	EH	On-Demand	Anodyne	BMP1	43	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750337	EH	On-Demand	Anodyne	PAPA1_CARPA	43	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750337	EH	On-Demand	Anodyne	CAPNS1	51	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750337	EH	On-Demand	Anodyne	CAPN1	56	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750337	EH	On-Demand	Anodyne	CAPN2	56	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750337	EH	On-Demand	Anodyne	ACE2	42	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750337	EH	On-Demand	Anodyne	CYP3A4	31	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750338	EH	On-Demand	Anodyne	MME	40	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750338	EH	On-Demand	Anodyne	BMP1	43	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750338	EH	On-Demand	Anodyne	PAPA1_CARPA	43	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750338	EH	On-Demand	Anodyne	CAPNS1	51	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750338	EH	On-Demand	Anodyne	CAPN1	56	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750338	EH	On-Demand	Anodyne	CAPN2	56	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750338	EH	On-Demand	Anodyne	ACE2	42	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450750338	EH	On-Demand	Anodyne	CYP3A4	31	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750339	EH	On-Demand	Anodyne	MME	40	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750339	EH	On-Demand	Anodyne	BMP1	43	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750339	EH	On-Demand	Anodyne	PAPA1_CARPA	43	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750339	EH	On-Demand	Anodyne	CAPNS1	51	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750339	EH	On-Demand	Anodyne	CAPN1	56	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750339	EH	On-Demand	Anodyne	CAPN2	56	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750339	EH	On-Demand	Anodyne	ACE2	42	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750339	EH	On-Demand	Anodyne	CYP3A4	31	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750340	EH	On-Demand	Anodyne	MME	40	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750340	EH	On-Demand	Anodyne	BMP1	43	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750340	EH	On-Demand	Anodyne	PAPA1_CARPA	43	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750340	EH	On-Demand	Anodyne	CAPNS1	51	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750340	EH	On-Demand	Anodyne	CAPN1	56	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750340	EH	On-Demand	Anodyne	CAPN2	56	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750340	EH	On-Demand	Anodyne	ACE2	42	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450750340	EH	On-Demand	Anodyne	CYP3A4	31	42
O=C(CCCN1CCCC2(CC2)C1)c1ccccc1	ZINC000450750348	CH	On-Demand	Anodyne	DRD2	32	46
O=C(CCCN1CCCC2(CC2)C1)c1ccccc1	ZINC000450750348	CH	On-Demand	Anodyne	HTR2A	17	48
O=C(CCCN1CCCC2(CC2)C1)c1ccccc1	ZINC000450750348	CH	On-Demand	Anodyne	SLC6A1	68	44
O=C(CCCN1CCCC2(CC2)C1)c1ccccc1	ZINC000450750348	CH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCCC2(CC2)C1)c1ccccc1	ZINC000450750348	CH	On-Demand	Anodyne	HTR7	15	44
O=C(CCCN1CCCC2(CC2)C1)c1ccccc1	ZINC000450750348	CH	On-Demand	Anodyne	SIGMAR1	28	40
O=C(CCCN1CCCC2(CC2)C1)c1ccccc1	ZINC000450750348	CH	On-Demand	Anodyne	EBP	32	43
O=C(CCCN1CCCC2(CC2)C1)c1ccccc1	ZINC000450750348	CH	On-Demand	Anodyne	CYP2J2	59	42
CC(C)(CO)C(C)(C)NC(=O)c1cccc2c1CCCC2	ZINC000450750350	CG	On-Demand	Anodyne	FABP4	45	36
Cc1cc(-c2nc(C(=O)NC(C)(C)C(C)(C)CO)co2)ccn1	ZINC000450750356	DF	On-Demand	Anodyne	IRAK4	21	43
COc1cc(CC(=O)N2CCO[C@H](C3CC3)C2)ccc1O	ZINC000450750357	CD	On-Demand	Anodyne	SHBG	18	41
COc1cc(CC(=O)N2CCO[C@H](C3CC3)C2)ccc1O	ZINC000450750357	CD	On-Demand	Anodyne	RORC	50	37
COc1cc(CC(=O)N2CCO[C@@H](C3CC3)C2)ccc1O	ZINC000450750358	CD	On-Demand	Anodyne	SHBG	18	41
COc1cc(CC(=O)N2CCO[C@@H](C3CC3)C2)ccc1O	ZINC000450750358	CD	On-Demand	Anodyne	RORC	50	37
CC(=O)CCCCCSc1nc(CN2CCOCC2)nc2ccccc12	ZINC000450750365	FH	On-Demand	Anodyne	PAOX	17	40
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	DRD2	15	40
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	DRD4	25	41
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	ACHE	15	42
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	SIGMAR1	52	49
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	CCR3	32	41
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	MCHR1	21	44
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	MCHR2	48	39
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	NPFFR1	44	35
CC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450750366	EH	On-Demand	Anodyne	SLC12A5	45	34
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](C2CC2)C1	ZINC000450750367	EH	On-Demand	Anodyne	MC4R	34	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](C2CC2)C1	ZINC000450750367	EH	On-Demand	Anodyne	PRCP	54	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](C2CC2)C1	ZINC000450750367	EH	On-Demand	Anodyne	MC3R	38	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](C2CC2)C1	ZINC000450750367	EH	On-Demand	Anodyne	MC5R	31	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@H](C2CC2)C1	ZINC000450750368	EH	On-Demand	Anodyne	MC4R	34	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@H](C2CC2)C1	ZINC000450750368	EH	On-Demand	Anodyne	PRCP	54	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@H](C2CC2)C1	ZINC000450750368	EH	On-Demand	Anodyne	MC3R	38	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@H](C2CC2)C1	ZINC000450750368	EH	On-Demand	Anodyne	MC5R	31	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@H](C2CC2)C1	ZINC000450750369	EH	On-Demand	Anodyne	MC4R	34	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@H](C2CC2)C1	ZINC000450750369	EH	On-Demand	Anodyne	PRCP	54	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@H](C2CC2)C1	ZINC000450750369	EH	On-Demand	Anodyne	MC3R	38	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@H](C2CC2)C1	ZINC000450750369	EH	On-Demand	Anodyne	MC5R	31	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](C2CC2)C1	ZINC000450750370	EH	On-Demand	Anodyne	MC4R	34	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](C2CC2)C1	ZINC000450750370	EH	On-Demand	Anodyne	PRCP	54	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](C2CC2)C1	ZINC000450750370	EH	On-Demand	Anodyne	MC3R	38	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](C2CC2)C1	ZINC000450750370	EH	On-Demand	Anodyne	MC5R	31	41
COc1ccc(C(=O)NC(C)(C)C(C)(C)CO)cc1S(C)(=O)=O	ZINC000450750398	ED	On-Demand	Anodyne	COLA	60	35
COc1ccc(C(=O)NC(C)(C)C(C)(C)CO)cc1S(C)(=O)=O	ZINC000450750398	ED	On-Demand	Anodyne	CPT1A	57	35
COc1ccc(C(=O)NC(C)(C)C(C)(C)CO)cc1S(C)(=O)=O	ZINC000450750398	ED	On-Demand	Anodyne	CPT1B	42	35
CO[C@H](COc1cccc2c1CCC2=O)Cc1ccccc1	ZINC000450750399	CG	On-Demand	Anodyne	ABCB1	15	40
CO[C@@H](COc1cccc2c1CCC2=O)Cc1ccccc1	ZINC000450750400	CG	On-Demand	Anodyne	ABCB1	15	40
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750441	DH	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750441	DH	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750441	DH	On-Demand	Anodyne	SIGMAR1	44	58
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750441	DH	On-Demand	Anodyne	SLC18A3	43	51
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750441	DH	On-Demand	Anodyne	MCHR1	17	47
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750441	DH	On-Demand	Anodyne	CYP2J2	55	39
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750442	DH	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750442	DH	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750442	DH	On-Demand	Anodyne	SIGMAR1	44	58
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750442	DH	On-Demand	Anodyne	SLC18A3	43	51
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750442	DH	On-Demand	Anodyne	MCHR1	17	47
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccccc1	ZINC000450750442	DH	On-Demand	Anodyne	CYP2J2	55	39
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCC1=O	ZINC000450750451	EG	On-Demand	Anodyne	RBP4	76	42
CS(=O)(=O)CCCCCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450750488	GG	On-Demand	Anodyne	AVPR1B	48	39
CS(=O)(=O)CCCCCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450750488	GG	On-Demand	Anodyne	PDE6D	71	37
CS(=O)(=O)CCCCCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450750488	GG	On-Demand	Anodyne	IMDH_CRYPV	37	53
CO[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)CC1(C)C	ZINC000450750492	CD	On-Demand	Anodyne	PDE3A	43	33
CO[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)CC1(C)C	ZINC000450750492	CD	On-Demand	Anodyne	AKT2	20	41
CO[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)CC1(C)C	ZINC000450750492	CD	On-Demand	Anodyne	PDE3B	64	33
CO[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)CC1(C)C	ZINC000450750495	CD	On-Demand	Anodyne	PDE3A	43	33
CO[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)CC1(C)C	ZINC000450750495	CD	On-Demand	Anodyne	AKT2	20	41
CO[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)CC1(C)C	ZINC000450750495	CD	On-Demand	Anodyne	PDE3B	64	33
CCc1cc(CCCN2CC[C@@]3(C2)OCc2ccccc23)on1	ZINC000450750507	DG	On-Demand	Anodyne	SIGMAR1	22	56
CCc1cc(CCCN2CC[C@@]3(C2)OCc2ccccc23)on1	ZINC000450750507	DG	On-Demand	Anodyne	MCHR1	15	41
CCc1cc(CCCN2CC[C@]3(C2)OCc2ccccc23)on1	ZINC000450750508	DG	On-Demand	Anodyne	SIGMAR1	22	56
CCc1cc(CCCN2CC[C@]3(C2)OCc2ccccc23)on1	ZINC000450750508	DG	On-Demand	Anodyne	MCHR1	15	41
O=C(NCCN1c2ccccc2NS1(=O)=O)c1noc2c1CCCCC2	ZINC000450750520	GD	On-Demand	Anodyne	PANC	45	32
CNC(=O)N[C@H]1CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750538	CD	On-Demand	Anodyne	DRD4	23	44
CNC(=O)N[C@@H]1CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450750539	CD	On-Demand	Anodyne	DRD4	23	44
CC[C@@H](CN(CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)c1ccccc1	ZINC000450750562	GI	On-Demand	Anodyne	OPRM1	22	45
CC[C@@H](CN(CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)c1ccccc1	ZINC000450750562	GI	On-Demand	Anodyne	OPRD1	39	47
CC[C@@H](CN(CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)c1ccccc1	ZINC000450750562	GI	On-Demand	Anodyne	CCR5	25	41
CC[C@@H](CN(CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)c1ccccc1	ZINC000450750562	GI	On-Demand	Anodyne	LIMK2	27	42
CC[C@H](CN(CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)c1ccccc1	ZINC000450750563	GI	On-Demand	Anodyne	OPRM1	22	45
CC[C@H](CN(CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)c1ccccc1	ZINC000450750563	GI	On-Demand	Anodyne	OPRD1	39	47
CC[C@H](CN(CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)c1ccccc1	ZINC000450750563	GI	On-Demand	Anodyne	CCR5	25	41
CC[C@H](CN(CC)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)c1ccccc1	ZINC000450750563	GI	On-Demand	Anodyne	LIMK2	27	42
Cc1onc(C2CC2)c1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750564	GH	On-Demand	Anodyne	RBP4	49	32
Cc1onc(C2CC2)c1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750564	GH	On-Demand	Anodyne	SFRP1	77	33
Cc1onc(C2CC2)c1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750565	GH	On-Demand	Anodyne	RBP4	49	32
Cc1onc(C2CC2)c1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750565	GH	On-Demand	Anodyne	SFRP1	77	33
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000450750574	GE	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000450750575	GE	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000450750576	GE	On-Demand	Bother	TAAR1	20	47
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000450750577	GE	On-Demand	Bother	TAAR1	20	47
CO[C@@H](Cc1ccccc1)C(=O)NCCCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450750582	GE	On-Demand	Anodyne	MME	49	38
CO[C@@H](Cc1ccccc1)C(=O)NCCCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450750582	GE	On-Demand	Anodyne	TIMP3	44	34
CO[C@@H](Cc1ccccc1)C(=O)NCCCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450750582	GE	On-Demand	Anodyne	NPFFR1	44	31
CO[C@H](Cc1ccccc1)C(=O)NCCCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450750583	GE	On-Demand	Anodyne	MME	49	38
CO[C@H](Cc1ccccc1)C(=O)NCCCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450750583	GE	On-Demand	Anodyne	TIMP3	44	34
CO[C@H](Cc1ccccc1)C(=O)NCCCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450750583	GE	On-Demand	Anodyne	NPFFR1	44	31
CC(=O)[C@@](C)(O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450750586	EE	On-Demand	Anodyne	DRD3	36	40
CC(=O)[C@](C)(O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450750587	EE	On-Demand	Anodyne	DRD3	36	40
CNS(=O)(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)c(F)c1	ZINC000450750588	DD	On-Demand	Anodyne	SLC6A9	18	42
CNS(=O)(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)c(F)c1	ZINC000450750589	DD	On-Demand	Anodyne	SLC6A9	18	42
CNS(=O)(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)c(F)c1	ZINC000450750590	DD	On-Demand	Anodyne	SLC6A9	18	42
CNS(=O)(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)c(F)c1	ZINC000450750591	DD	On-Demand	Anodyne	SLC6A9	18	42
CO[C@H]1CCN(c2cc(N3CCc4ccccc43)ncn2)C[C@H]1C	ZINC000450750606	DG	On-Demand	Anodyne	PDE3B	56	34
CO[C@@H]1CCN(c2cc(N3CCc4ccccc43)ncn2)C[C@H]1C	ZINC000450750607	DG	On-Demand	Anodyne	PDE3B	56	34
CO[C@@H]1CCN(c2cc(N3CCc4ccccc43)ncn2)C[C@@H]1C	ZINC000450750608	DG	On-Demand	Anodyne	PDE3B	56	34
CO[C@H]1CCN(c2cc(N3CCc4ccccc43)ncn2)C[C@@H]1C	ZINC000450750609	DG	On-Demand	Anodyne	PDE3B	56	34
Cc1n[nH]c(C)c1CC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450750628	EC	On-Demand	Anodyne	P2RX7	15	51
O=[N+]([O-])c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)cn1	ZINC000450750651	EH	On-Demand	Bother	CHRNA3	23	53
O=[N+]([O-])c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)cn1	ZINC000450750652	EH	On-Demand	Bother	CHRNA3	23	53
CCOC(=O)c1csc(N2CC[C@@H](c3nc(C)no3)C2)n1	ZINC000450750680	DE	On-Demand	Anodyne	ETHR	54	38
CCOC(=O)c1csc(N2CC[C@H](c3nc(C)no3)C2)n1	ZINC000450750681	DE	On-Demand	Anodyne	ETHR	54	38
CCC(=O)CCCN1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450750702	DF	On-Demand	Anodyne	DRD2	27	40
CC(C)(CO)C(C)(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450750714	CD	On-Demand	Anodyne	HPGDS	23	47
COc1ccc(-c2noc(CN[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C)n2)nn1	ZINC000450750717	GF	On-Demand	Anodyne	DRD4	22	40
COc1ccc(-c2noc(CN[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C)n2)nn1	ZINC000450750717	GF	On-Demand	Anodyne	DRD3	0	40
COc1ccc(-c2noc(CN[C@@H]3CCN(Cc4ccccc4)C[C@H]3C)n2)nn1	ZINC000450750718	GF	On-Demand	Anodyne	DRD4	22	40
COc1ccc(-c2noc(CN[C@@H]3CCN(Cc4ccccc4)C[C@H]3C)n2)nn1	ZINC000450750718	GF	On-Demand	Anodyne	DRD3	0	40
COc1ccc(-c2noc(CN[C@H]3CCN(Cc4ccccc4)C[C@@H]3C)n2)nn1	ZINC000450750719	GF	On-Demand	Anodyne	DRD4	22	40
COc1ccc(-c2noc(CN[C@H]3CCN(Cc4ccccc4)C[C@@H]3C)n2)nn1	ZINC000450750719	GF	On-Demand	Anodyne	DRD3	0	40
COc1ccc(-c2noc(CN[C@H]3CCN(Cc4ccccc4)C[C@H]3C)n2)nn1	ZINC000450750720	GF	On-Demand	Anodyne	DRD4	22	40
COc1ccc(-c2noc(CN[C@H]3CCN(Cc4ccccc4)C[C@H]3C)n2)nn1	ZINC000450750720	GF	On-Demand	Anodyne	DRD3	0	40
Cc1ccc(C(=O)NCc2cn(-c3ccccc3)nc2C)c(C(C)C)n1	ZINC000450750723	EH	On-Demand	Anodyne	P2RX7	16	49
CCOc1cc(C(=O)NCCN2c3ccccc3NS2(=O)=O)ccc1C	ZINC000450750724	GE	On-Demand	Anodyne	DRD4	44	36
CCS(=O)(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450750744	FG	On-Demand	Anodyne	SIGMAR1	46	58
CCS(=O)(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450750744	FG	On-Demand	Anodyne	SLC18A3	26	52
CCS(=O)(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450750744	FG	On-Demand	Anodyne	MCHR2	59	33
CCS(=O)(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450750745	FG	On-Demand	Anodyne	SIGMAR1	46	58
CCS(=O)(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450750745	FG	On-Demand	Anodyne	SLC18A3	26	52
CCS(=O)(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450750745	FG	On-Demand	Anodyne	MCHR2	59	33
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@@H](O)C1CCC1	ZINC000450750753	CD	On-Demand	Anodyne	P2RX7	18	48
Cc1nn(-c2ccccc2)cc1CNC(=O)[C@H](O)C1CCC1	ZINC000450750754	CD	On-Demand	Anodyne	P2RX7	18	48
CSc1cccc(C(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)c1	ZINC000450750788	GF	On-Demand	Anodyne	DRD4	42	33
CSc1cccc(C(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)c1	ZINC000450750788	GF	On-Demand	Anodyne	PLD2	55	35
CO[C@@H](Cc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450750795	GD	On-Demand	Anodyne	MME	50	37
CO[C@H](Cc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450750796	GD	On-Demand	Anodyne	MME	50	37
C[C@@H](O)CCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750819	CE	On-Demand	Anodyne	TBXAS1	0	48
C[C@@H](O)CCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750819	CE	On-Demand	Anodyne	HRP1_PLAFA	54	37
C[C@@H](O)CCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750819	CE	On-Demand	Anodyne	HNMT	41	32
C[C@H](O)CCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750820	CE	On-Demand	Anodyne	TBXAS1	0	48
C[C@H](O)CCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750820	CE	On-Demand	Anodyne	HRP1_PLAFA	54	37
C[C@H](O)CCCn1cnc2cc(Cl)ccc2c1=O	ZINC000450750820	CE	On-Demand	Anodyne	HNMT	41	32
CC(=O)CCCCCOc1ccccc1C(F)(F)F	ZINC000450750823	CI	On-Demand	Anodyne	THRA	25	43
CC(=O)CCCCCOc1ccccc1C(F)(F)F	ZINC000450750823	CI	On-Demand	Anodyne	RBP4	31	44
COC(=O)c1cc(C(=O)NCCN2c3ccccc3NS2(=O)=O)cn1C	ZINC000450750828	GC	On-Demand	Anodyne	DRD4	41	34
CCOC(=O)c1cc(N2CC[C@H](OC)[C@@H](C)C2)ncc1Cl	ZINC000450750830	DF	On-Demand	Anodyne	GYRB	45	35
CCOC(=O)c1cc(N2CC[C@H](OC)[C@@H](C)C2)ncc1Cl	ZINC000450750830	DF	On-Demand	Anodyne	PARE	44	35
CCOC(=O)c1cc(N2CC[C@@H](OC)[C@@H](C)C2)ncc1Cl	ZINC000450750831	DF	On-Demand	Anodyne	GYRB	45	35
CCOC(=O)c1cc(N2CC[C@@H](OC)[C@@H](C)C2)ncc1Cl	ZINC000450750831	DF	On-Demand	Anodyne	PARE	44	35
CCOC(=O)c1cc(N2CC[C@H](OC)[C@H](C)C2)ncc1Cl	ZINC000450750833	DF	On-Demand	Anodyne	GYRB	45	35
CCOC(=O)c1cc(N2CC[C@H](OC)[C@H](C)C2)ncc1Cl	ZINC000450750833	DF	On-Demand	Anodyne	PARE	44	35
CCOC(=O)c1cc(N2CC[C@@H](OC)[C@H](C)C2)ncc1Cl	ZINC000450750835	DF	On-Demand	Anodyne	GYRB	45	35
CCOC(=O)c1cc(N2CC[C@@H](OC)[C@H](C)C2)ncc1Cl	ZINC000450750835	DF	On-Demand	Anodyne	PARE	44	35
CCOC(=O)c1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450750836	GF	On-Demand	Anodyne	SCD1	38	41
CCOC(=O)c1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450750836	GF	On-Demand	Anodyne	SFRP1	52	32
CCOC(=O)c1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450750836	GF	On-Demand	Anodyne	SCD	34	41
CCOC(=O)c1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450750837	GF	On-Demand	Anodyne	SCD1	38	41
CCOC(=O)c1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450750837	GF	On-Demand	Anodyne	SFRP1	52	32
CCOC(=O)c1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450750837	GF	On-Demand	Anodyne	SCD	34	41
O=C(CC1(O)CCC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750843	EF	On-Demand	Anodyne	MTNR1A	29	40
O=C(CC1(O)CCC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750843	EF	On-Demand	Anodyne	MTNR1B	0	40
O=C(CC1(O)CCC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750843	EF	On-Demand	Anodyne	SFRP1	84	33
O=C(CC1(O)CCC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750843	EF	On-Demand	Anodyne	WNT3	40	30
O=C(CC1(O)CCC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750844	EF	On-Demand	Anodyne	MTNR1A	29	40
O=C(CC1(O)CCC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750844	EF	On-Demand	Anodyne	MTNR1B	0	40
O=C(CC1(O)CCC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750844	EF	On-Demand	Anodyne	SFRP1	84	33
O=C(CC1(O)CCC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450750844	EF	On-Demand	Anodyne	WNT3	40	30
CCS(=O)(=O)c1ccc(CN[C@@H](C)c2ccc(OCC(=O)OC)cc2)cc1	ZINC000450750862	GF	On-Demand	Anodyne	ACACA	45	38
CCS(=O)(=O)c1ccc(CN[C@H](C)c2ccc(OCC(=O)OC)cc2)cc1	ZINC000450750863	GF	On-Demand	Anodyne	ACACA	45	38
CC[C@H]1Cc2ccccc2CN1Cc1nc(C(=O)OC)co1	ZINC000450750870	DF	On-Demand	Anodyne	ADAM9	62	35
CC[C@@H]1Cc2ccccc2CN1Cc1nc(C(=O)OC)co1	ZINC000450750871	DF	On-Demand	Anodyne	ADAM9	62	35
O=C1CCC(CN2CCN(c3c(Cl)cccc3Cl)CC2)CC1	ZINC000450750877	EH	On-Demand	Anodyne	DRD2	22	46
COCCC1(CNC(=O)[C@@H](C)OCCc2ccccc2)CCCCC1	ZINC000450750887	EH	On-Demand	Anodyne	TIMP3	51	33
COCCC1(CNC(=O)[C@@H](C)OCCc2ccccc2)CCCCC1	ZINC000450750887	EH	On-Demand	Anodyne	CAPN2	51	33
COCCC1(CNC(=O)[C@@H](C)OCCc2ccccc2)CCCCC1	ZINC000450750887	EH	On-Demand	Anodyne	HCN1	53	34
COCCC1(CNC(=O)[C@@H](C)OCCc2ccccc2)CCCCC1	ZINC000450750887	EH	On-Demand	Anodyne	HCN4	50	34
COCCC1(CNC(=O)[C@H](C)OCCc2ccccc2)CCCCC1	ZINC000450750888	EH	On-Demand	Anodyne	TIMP3	51	33
COCCC1(CNC(=O)[C@H](C)OCCc2ccccc2)CCCCC1	ZINC000450750888	EH	On-Demand	Anodyne	CAPN2	51	33
COCCC1(CNC(=O)[C@H](C)OCCc2ccccc2)CCCCC1	ZINC000450750888	EH	On-Demand	Anodyne	HCN1	53	34
COCCC1(CNC(=O)[C@H](C)OCCc2ccccc2)CCCCC1	ZINC000450750888	EH	On-Demand	Anodyne	HCN4	50	34
CO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)CC1(C)C	ZINC000450750894	CE	On-Demand	Anodyne	P2RY12	29	42
CO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)CC1(C)C	ZINC000450750894	CE	On-Demand	Anodyne	CXCR3	32	47
CO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)CC1(C)C	ZINC000450750895	CE	On-Demand	Anodyne	P2RY12	29	42
CO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)CC1(C)C	ZINC000450750895	CE	On-Demand	Anodyne	CXCR3	32	47
CO[C@@H]1CCN(c2ncnc3c(C)cccc23)C[C@@H]1C	ZINC000450750896	CF	On-Demand	Anodyne	PDE3A	30	45
CO[C@@H]1CCN(c2ncnc3c(C)cccc23)C[C@@H]1C	ZINC000450750896	CF	On-Demand	Anodyne	PDE3B	77	41
CO[C@H]1CCN(c2ncnc3c(C)cccc23)C[C@@H]1C	ZINC000450750897	CF	On-Demand	Anodyne	PDE3A	30	45
CO[C@H]1CCN(c2ncnc3c(C)cccc23)C[C@@H]1C	ZINC000450750897	CF	On-Demand	Anodyne	PDE3B	77	41
CO[C@H]1CCN(c2ncnc3c(C)cccc23)C[C@H]1C	ZINC000450750898	CF	On-Demand	Anodyne	PDE3A	30	45
CO[C@H]1CCN(c2ncnc3c(C)cccc23)C[C@H]1C	ZINC000450750898	CF	On-Demand	Anodyne	PDE3B	77	41
CO[C@@H]1CCN(c2ncnc3c(C)cccc23)C[C@H]1C	ZINC000450750899	CF	On-Demand	Anodyne	PDE3A	30	45
CO[C@@H]1CCN(c2ncnc3c(C)cccc23)C[C@H]1C	ZINC000450750899	CF	On-Demand	Anodyne	PDE3B	77	41
CO[C@H]1CCN(c2nc(C3CC3)cc(N3CC[C@@H](OC)[C@H](C)C3)n2)C[C@@H]1C	ZINC000450750906	FG	On-Demand	Anodyne	HRH4	31	41
CO[C@H]1CCN(c2nc(C3CC3)cc(N3CC[C@@H](OC)[C@H](C)C3)n2)C[C@H]1C	ZINC000450750907	FG	On-Demand	Anodyne	HRH4	31	41
CO[C@H]1CCN(c2nc(C3CC3)cc(N3CC[C@@H](OC)[C@@H](C)C3)n2)C[C@@H]1C	ZINC000450750908	FG	On-Demand	Anodyne	HRH4	31	41
CO[C@H]1CCN(c2nc(C3CC3)cc(N3CC[C@@H](OC)[C@@H](C)C3)n2)C[C@H]1C	ZINC000450750909	FG	On-Demand	Anodyne	HRH4	31	41
CN(C)C(=O)c1cncc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450750914	FE	On-Demand	Bother	SLC27A4	47	32
CN(C)C(=O)c1cncc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450750915	FE	On-Demand	Bother	SLC27A4	47	32
COc1cccc(OCCC(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)c1	ZINC000450750938	GD	On-Demand	Anodyne	MTNR1A	30	42
COc1cccc(OCCC(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)c1	ZINC000450750938	GD	On-Demand	Anodyne	MTNR1B	34	42
CCOC(=O)c1ccc(CSc2nnc(C(C)C)n2Cc2ccco2)nc1	ZINC000450750991	GH	On-Demand	Anodyne	HCRTR2	0	40
Cc1cccc(CN2CCO[C@H](C(=O)C3CC3)C2)n1	ZINC000450750992	CD	On-Demand	Anodyne	PDE8A	0	42
Cc1cccc(CN2CCO[C@@H](C(=O)C3CC3)C2)n1	ZINC000450750993	CD	On-Demand	Anodyne	PDE8A	0	42
Cc1ccc(F)c(CSc2nnc(C(C)C)n2Cc2ccco2)c1	ZINC000450751006	EJ	On-Demand	Anodyne	HCRTR2	19	41
CCCCn1c(=O)n(CCC(C)(F)F)c(=O)c2c1nc(CO)n2CCC	ZINC000450751031	FE	On-Demand	Anodyne	ADORA2A	16	46
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)c1cc2cccnc2s1	ZINC000450751034	GF	On-Demand	Anodyne	DRD3	15	49
O=C1[C@H]2CCCCN2C(=O)N1CC/C=C/c1ccccc1	ZINC000450751053	CF	On-Demand	Anodyne	HTR1A	15	56
O=C1[C@@H]2CCCCN2C(=O)N1CC/C=C\c1ccccc1	ZINC000450751054	CF	On-Demand	Anodyne	HTR1A	15	56
O=C1[C@H]2CCCCN2C(=O)N1CC/C=C\c1ccccc1	ZINC000450751055	CF	On-Demand	Anodyne	HTR1A	15	56
O=C1[C@@H]2CCCCN2C(=O)N1CC/C=C/c1ccccc1	ZINC000450751056	CF	On-Demand	Anodyne	HTR1A	15	56
COc1ccc(-c2ccnc(N3CC[C@H](OC)C(C)(C)C3)n2)cc1	ZINC000450751066	EG	On-Demand	Anodyne	DKK1	0	45
COc1ccc(-c2ccnc(N3CC[C@@H](OC)C(C)(C)C3)n2)cc1	ZINC000450751067	EG	On-Demand	Anodyne	DKK1	0	45
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)c1ccc2cnccc2c1	ZINC000450751071	GF	On-Demand	Anodyne	PLD2	56	38
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)c1ccc2cnccc2c1	ZINC000450751071	GF	On-Demand	Anodyne	NAMPT	15	40
CCCOc1cccc(CN2CC(C(=O)NC)C2)c1	ZINC000450751078	CD	On-Demand	Anodyne	HRH2	58	54
CCCOc1cccc(CN2CC(C(=O)NC)C2)c1	ZINC000450751078	CD	On-Demand	Anodyne	LTA4H	23	46
CCCOc1cccc(CN2CC(C(=O)NC)C2)c1	ZINC000450751078	CD	On-Demand	Anodyne	MMP13	18	41
CCCOc1cccc(CN2CC(C(=O)NC)C2)c1	ZINC000450751078	CD	On-Demand	Anodyne	UPP1	61	42
CCCOc1cccc(CN2CC(C(=O)NC)C2)c1	ZINC000450751078	CD	On-Demand	Anodyne	S1PR1	27	40
COC[C@H]1CCCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450751081	CH	On-Demand	Anodyne	DRD4	28	46
COC[C@H]1CCCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450751081	CH	On-Demand	Anodyne	ACHE	16	42
COC[C@H]1CCCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450751081	CH	On-Demand	Anodyne	SSTR5	43	37
COC[C@H]1CCCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450751081	CH	On-Demand	Anodyne	UTS2R	26	41
COC[C@@H]1CCCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450751082	CH	On-Demand	Anodyne	DRD4	28	46
COC[C@@H]1CCCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450751082	CH	On-Demand	Anodyne	ACHE	16	42
COC[C@@H]1CCCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450751082	CH	On-Demand	Anodyne	SSTR5	43	37
COC[C@@H]1CCCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450751082	CH	On-Demand	Anodyne	UTS2R	26	41
CO[C@H]1CCN(c2nc(N(C)C)c3ccccc3n2)CC1(C)C	ZINC000450751107	DF	On-Demand	Anodyne	ADRA2A	15	46
CO[C@@H]1CCN(c2nc(N(C)C)c3ccccc3n2)CC1(C)C	ZINC000450751108	DF	On-Demand	Anodyne	ADRA2A	15	46
COc1cc2c(N3CC[C@H](OC)C(C)(C)C3)ncnc2cc1F	ZINC000450751115	DG	On-Demand	Anodyne	PDE3A	63	48
COc1cc2c(N3CC[C@H](OC)C(C)(C)C3)ncnc2cc1F	ZINC000450751115	DG	On-Demand	Anodyne	PDGFRB	64	41
COc1cc2c(N3CC[C@H](OC)C(C)(C)C3)ncnc2cc1F	ZINC000450751115	DG	On-Demand	Anodyne	PDE3B	93	48
COc1cc2c(N3CC[C@@H](OC)C(C)(C)C3)ncnc2cc1F	ZINC000450751116	DG	On-Demand	Anodyne	PDE3A	63	48
COc1cc2c(N3CC[C@@H](OC)C(C)(C)C3)ncnc2cc1F	ZINC000450751116	DG	On-Demand	Anodyne	PDGFRB	64	41
COc1cc2c(N3CC[C@@H](OC)C(C)(C)C3)ncnc2cc1F	ZINC000450751116	DG	On-Demand	Anodyne	PDE3B	93	48
COCCC1(CNC(=O)[C@H](C)Oc2ccccn2)CCCCC1	ZINC000450751123	DF	On-Demand	Anodyne	HCN1	53	34
COCCC1(CNC(=O)[C@H](C)Oc2ccccn2)CCCCC1	ZINC000450751123	DF	On-Demand	Anodyne	HCN4	51	34
COCCC1(CNC(=O)[C@@H](C)Oc2ccccn2)CCCCC1	ZINC000450751124	DF	On-Demand	Anodyne	HCN1	53	34
COCCC1(CNC(=O)[C@@H](C)Oc2ccccn2)CCCCC1	ZINC000450751124	DF	On-Demand	Anodyne	HCN4	51	34
O=[N+]([O-])c1ccc([C@H]2CCCN(c3cc(N4CCCC4)ncn3)C2)cc1	ZINC000450751141	FG	On-Demand	Bother	PRCP	28	41
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3cc(N4CCCC4)ncn3)C2)cc1	ZINC000450751142	FG	On-Demand	Bother	PRCP	28	41
CO[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1(C)C	ZINC000450751146	DD	On-Demand	Bother	TAAR1	17	44
CO[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1(C)C	ZINC000450751147	DD	On-Demand	Bother	TAAR1	17	44
CNC(=O)N[C@@H]1CCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450751149	ED	On-Demand	Anodyne	DRD3	0	43
CNC(=O)N[C@@H]1CCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450751149	ED	On-Demand	Anodyne	CCR3	30	42
CNC(=O)N[C@@H]1CCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450751149	ED	On-Demand	Anodyne	MCHR1	23	42
CNC(=O)N[C@H]1CCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450751150	ED	On-Demand	Anodyne	DRD3	0	43
CNC(=O)N[C@H]1CCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450751150	ED	On-Demand	Anodyne	CCR3	30	42
CNC(=O)N[C@H]1CCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450751150	ED	On-Demand	Anodyne	MCHR1	23	42
CO[C@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1C	ZINC000450751163	CF	On-Demand	Anodyne	PDE3A	50	38
CO[C@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1C	ZINC000450751163	CF	On-Demand	Anodyne	PDE3B	75	39
CO[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1C	ZINC000450751164	CF	On-Demand	Anodyne	PDE3A	50	38
CO[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1C	ZINC000450751164	CF	On-Demand	Anodyne	PDE3B	75	39
CO[C@H]1CCN(c2ncnc3c(F)cccc23)C[C@H]1C	ZINC000450751165	CF	On-Demand	Anodyne	PDE3A	50	38
CO[C@H]1CCN(c2ncnc3c(F)cccc23)C[C@H]1C	ZINC000450751165	CF	On-Demand	Anodyne	PDE3B	75	39
CO[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@H]1C	ZINC000450751166	CF	On-Demand	Anodyne	PDE3A	50	38
CO[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@H]1C	ZINC000450751166	CF	On-Demand	Anodyne	PDE3B	75	39
COCCC1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCCC1	ZINC000450751167	GH	On-Demand	Bother	CACNA1C	54	39
COCCC1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCCC1	ZINC000450751167	GH	On-Demand	Bother	CACNA1D	87	39
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)C(C)(C)C4)c23)cc1	ZINC000450751188	GJ	On-Demand	Anodyne	ADRB2	17	47
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)C(C)(C)C4)c23)cc1	ZINC000450751188	GJ	On-Demand	Anodyne	ADRB3	17	53
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)C(C)(C)C4)c23)cc1	ZINC000450751188	GJ	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)C(C)(C)C4)c23)cc1	ZINC000450751189	GJ	On-Demand	Anodyne	ADRB2	17	47
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)C(C)(C)C4)c23)cc1	ZINC000450751189	GJ	On-Demand	Anodyne	ADRB3	17	53
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)C(C)(C)C4)c23)cc1	ZINC000450751189	GJ	On-Demand	Anodyne	PDE3B	50	34
CCCc1nc(C)c(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)s1	ZINC000450751241	GH	On-Demand	Anodyne	RORC	63	36
COC(=O)c1csc(CSc2nnc(N3CCC(C)CC3)n2C2CC2)n1	ZINC000450751263	GG	On-Demand	Anodyne	TRPC6	40	37
COCc1nn(C)cc1C(=O)Nc1ccccc1NCC1CCCCC1	ZINC000450751296	FH	On-Demand	Anodyne	CCR8	43	32
C[C@@H](O)CCCN[C@@H](CN1CCc2ccccc2C1)C(C)(C)C	ZINC000450751322	DG	On-Demand	Anodyne	CHRNA6	0	40
C[C@H](O)CCCN[C@@H](CN1CCc2ccccc2C1)C(C)(C)C	ZINC000450751324	DG	On-Demand	Anodyne	CHRNA6	0	40
C[C@H](O)CCCN[C@H](CN1CCc2ccccc2C1)C(C)(C)C	ZINC000450751326	DG	On-Demand	Anodyne	CHRNA6	0	40
C[C@@H](O)CCCN[C@H](CN1CCc2ccccc2C1)C(C)(C)C	ZINC000450751327	DG	On-Demand	Anodyne	CHRNA6	0	40
CCOC(=O)c1cnc2ccccc2c1N1CC[C@@H](c2nc(C)no2)C1	ZINC000450751333	FG	On-Demand	Anodyne	SMO	49	34
CCOC(=O)c1cnc2ccccc2c1N1CC[C@H](c2nc(C)no2)C1	ZINC000450751335	FG	On-Demand	Anodyne	SMO	49	34
OC1(Cc2cccc(F)c2)CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450751336	FH	On-Demand	Anodyne	SIGMAR1	27	44
COc1cc(CC(=O)N2CCC(c3ccsc3)CC2)ccc1Cl	ZINC000450751342	EI	On-Demand	Anodyne	CCR1	36	40
O=C(NCc1ccccc1CN1CCC[C@H]1CO)c1ccc(N2CCC2)nc1	ZINC000450751355	GE	On-Demand	Anodyne	HPGDS	18	42
O=C(NCc1ccccc1CN1CCC[C@@H]1CO)c1ccc(N2CCC2)nc1	ZINC000450751356	GE	On-Demand	Anodyne	HPGDS	18	42
N#Cc1ccc(N2CC[C@H](c3cccc(Br)c3)C2)nc1	ZINC000450751361	EH	On-Demand	Mild	SMO	0	44
N#Cc1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)nc1	ZINC000450751362	EH	On-Demand	Mild	SMO	0	44
CN(CCN1CCO[C@H](C(=O)C2CC2)C1)Cc1ccccc1	ZINC000450751363	DD	On-Demand	Anodyne	SLC6A1	82	35
CN(CCN1CCO[C@H](C(=O)C2CC2)C1)Cc1ccccc1	ZINC000450751363	DD	On-Demand	Anodyne	SIGMAR1	31	42
CN(CCN1CCO[C@@H](C(=O)C2CC2)C1)Cc1ccccc1	ZINC000450751364	DD	On-Demand	Anodyne	SLC6A1	82	35
CN(CCN1CCO[C@@H](C(=O)C2CC2)C1)Cc1ccccc1	ZINC000450751364	DD	On-Demand	Anodyne	SIGMAR1	31	42
CC(C)(CO)C(C)(C)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450751381	GE	On-Demand	Mild	AR	18	44
CC(C)(CO)C(C)(C)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450751382	GE	On-Demand	Mild	AR	18	44
O=C(C1CC1)[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CCO1	ZINC000450751407	EE	On-Demand	Anodyne	DRD4	15	42
O=C(C1CC1)[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CCO1	ZINC000450751408	EE	On-Demand	Anodyne	DRD4	15	42
Nc1ncccc1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450751423	CE	On-Demand	Anodyne	SLC18A3	0	45
Nc1ncccc1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450751424	CE	On-Demand	Anodyne	SLC18A3	0	45
C[C@H](O)CCN1CCO[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1	ZINC000450751428	FH	On-Demand	Anodyne	CCR2	18	40
C[C@H](O)CCN1CCO[C@@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1	ZINC000450751429	FH	On-Demand	Anodyne	CCR2	18	40
C[C@@H](O)CCN1CCO[C@@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1	ZINC000450751430	FH	On-Demand	Anodyne	CCR2	18	40
C[C@@H](O)CCN1CCO[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1	ZINC000450751431	FH	On-Demand	Anodyne	CCR2	18	40
CC(C)N1CCCC[C@H]1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450751460	DG	On-Demand	Anodyne	SIGMAR1	22	50
CC(C)N1CCCC[C@H]1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450751461	DG	On-Demand	Anodyne	SIGMAR1	22	50
CC(C)N1CCCC[C@@H]1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450751462	DG	On-Demand	Anodyne	SIGMAR1	22	50
CC(C)N1CCCC[C@@H]1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450751463	DG	On-Demand	Anodyne	SIGMAR1	22	50
COC(=O)c1nc(N2CC[C@H](OC)C(C)(C)C2)sc1C	ZINC000450751464	CE	On-Demand	Anodyne	GYRB	0	41
COC(=O)c1nc(N2CC[C@H](OC)C(C)(C)C2)sc1C	ZINC000450751464	CE	On-Demand	Anodyne	PARE	42	33
COC(=O)c1nc(N2CC[C@@H](OC)C(C)(C)C2)sc1C	ZINC000450751465	CE	On-Demand	Anodyne	GYRB	0	41
COC(=O)c1nc(N2CC[C@@H](OC)C(C)(C)C2)sc1C	ZINC000450751465	CE	On-Demand	Anodyne	PARE	42	33
Fc1cccc(F)c1[C@@H]1CCN(CCc2cscn2)C1	ZINC000450751472	CG	On-Demand	Anodyne	SCN5A	45	40
Fc1cccc(F)c1[C@H]1CCN(CCc2cscn2)C1	ZINC000450751473	CG	On-Demand	Anodyne	SCN5A	45	40
O=C(CCSCc1ccccc1)NCCN1c2ccccc2NS1(=O)=O	ZINC000450751498	GF	On-Demand	Anodyne	CACNA2D1	24	40
CO[C@@H]1CCN(c2cc(C)nc3ccc(OC(F)F)cc23)C[C@@H]1C	ZINC000450751523	EI	On-Demand	Anodyne	GYRB	17	46
CO[C@H]1CCN(c2cc(C)nc3ccc(OC(F)F)cc23)C[C@H]1C	ZINC000450751525	EI	On-Demand	Anodyne	GYRB	17	46
CO[C@H]1CCN(c2cc(C)nc3ccc(OC(F)F)cc23)C[C@@H]1C	ZINC000450751527	EI	On-Demand	Anodyne	GYRB	17	46
CO[C@@H]1CCN(c2cc(C)nc3ccc(OC(F)F)cc23)C[C@H]1C	ZINC000450751529	EI	On-Demand	Anodyne	GYRB	17	46
O=C1CN(CCNC(=O)c2c(Cl)cc(F)cc2Br)CCN1	ZINC000450751535	GD	On-Demand	Anodyne	PLD1	42	36
O=C1CN(CCNC(=O)c2c(Cl)cc(F)cc2Br)CCN1	ZINC000450751535	GD	On-Demand	Anodyne	PLD2	74	39
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(F)(F)F)CCC1	ZINC000450751538	GI	On-Demand	Anodyne	RBP4	47	33
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(F)(F)F)CCC1	ZINC000450751538	GI	On-Demand	Anodyne	SFRP1	103	37
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(F)(F)F)CCC1	ZINC000450751538	GI	On-Demand	Anodyne	WNT3	68	32
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(F)(F)F)CCC1	ZINC000450751539	GI	On-Demand	Anodyne	RBP4	47	33
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(F)(F)F)CCC1	ZINC000450751539	GI	On-Demand	Anodyne	SFRP1	103	37
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(F)(F)F)CCC1	ZINC000450751539	GI	On-Demand	Anodyne	WNT3	68	32
COCCC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450751546	EH	On-Demand	Anodyne	P2RY12	51	34
COCCC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450751546	EH	On-Demand	Anodyne	CACNA1G	27	40
COCCC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450751546	EH	On-Demand	Anodyne	HCN1	62	35
COCCC1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450751546	EH	On-Demand	Anodyne	HCN4	54	35
COCCC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450751547	EH	On-Demand	Anodyne	P2RY12	51	34
COCCC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450751547	EH	On-Demand	Anodyne	CACNA1G	27	40
COCCC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450751547	EH	On-Demand	Anodyne	HCN1	62	35
COCCC1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCCCC1	ZINC000450751547	EH	On-Demand	Anodyne	HCN4	54	35
CO[C@H]1CCN(c2ncncc2-c2ccccc2)C[C@@H]1C	ZINC000450751566	CG	On-Demand	Anodyne	PDE3A	45	38
CO[C@H]1CCN(c2ncncc2-c2ccccc2)C[C@H]1C	ZINC000450751567	CG	On-Demand	Anodyne	PDE3A	45	38
CO[C@@H]1CCN(c2ncncc2-c2ccccc2)C[C@H]1C	ZINC000450751568	CG	On-Demand	Anodyne	PDE3A	45	38
CO[C@@H]1CCN(c2ncncc2-c2ccccc2)C[C@@H]1C	ZINC000450751569	CG	On-Demand	Anodyne	PDE3A	45	38
CC[C@@H](CN(CC)C(=O)Cc1ccc(O)c(OC)c1)c1ccccc1	ZINC000450751572	EH	On-Demand	Anodyne	TRPV1	0	43
CC[C@@H](CN(CC)C(=O)Cc1ccc(O)c(OC)c1)c1ccccc1	ZINC000450751572	EH	On-Demand	Anodyne	TTR	0	40
CC[C@@H](CN(CC)C(=O)Cc1ccc(O)c(OC)c1)c1ccccc1	ZINC000450751572	EH	On-Demand	Anodyne	CAN2	0	40
CC[C@H](CN(CC)C(=O)Cc1ccc(O)c(OC)c1)c1ccccc1	ZINC000450751573	EH	On-Demand	Anodyne	TRPV1	0	43
CC[C@H](CN(CC)C(=O)Cc1ccc(O)c(OC)c1)c1ccccc1	ZINC000450751573	EH	On-Demand	Anodyne	TTR	0	40
CC[C@H](CN(CC)C(=O)Cc1ccc(O)c(OC)c1)c1ccccc1	ZINC000450751573	EH	On-Demand	Anodyne	CAN2	0	40
CCOc1cc(C(=O)NCC2(CCOC)CCCCC2)on1	ZINC000450751576	DF	On-Demand	Anodyne	HCN1	43	33
CCOc1cc(C(=O)NCC2(CCOC)CCCCC2)on1	ZINC000450751576	DF	On-Demand	Anodyne	HCN4	42	33
COc1ccc(-c2nnc(N3CC[C@@H](OC)[C@H](C)C3)c3ccccc23)cc1	ZINC000450751579	FI	On-Demand	Anodyne	PDE3B	42	38
COc1ccc(-c2nnc(N3CC[C@@H](OC)[C@H](C)C3)c3ccccc23)cc1	ZINC000450751579	FI	On-Demand	Anodyne	SMO	52	53
COc1ccc(-c2nnc(N3CC[C@@H](OC)[C@@H](C)C3)c3ccccc23)cc1	ZINC000450751580	FI	On-Demand	Anodyne	PDE3B	42	38
COc1ccc(-c2nnc(N3CC[C@@H](OC)[C@@H](C)C3)c3ccccc23)cc1	ZINC000450751580	FI	On-Demand	Anodyne	SMO	52	53
COc1ccc(-c2nnc(N3CC[C@H](OC)[C@H](C)C3)c3ccccc23)cc1	ZINC000450751581	FI	On-Demand	Anodyne	PDE3B	42	38
COc1ccc(-c2nnc(N3CC[C@H](OC)[C@H](C)C3)c3ccccc23)cc1	ZINC000450751581	FI	On-Demand	Anodyne	SMO	52	53
COc1ccc(-c2nnc(N3CC[C@H](OC)[C@@H](C)C3)c3ccccc23)cc1	ZINC000450751582	FI	On-Demand	Anodyne	PDE3B	42	38
COc1ccc(-c2nnc(N3CC[C@H](OC)[C@@H](C)C3)c3ccccc23)cc1	ZINC000450751582	FI	On-Demand	Anodyne	SMO	52	53
CO[C@H]1CCN(c2nc(C(N)=O)cs2)C[C@H]1C	ZINC000450751591	CD	On-Demand	Anodyne	GYRB	0	46
CO[C@H]1CCN(c2nc(C(N)=O)cs2)C[C@@H]1C	ZINC000450751592	CD	On-Demand	Anodyne	GYRB	0	46
CO[C@@H]1CCN(c2nc(C(N)=O)cs2)C[C@@H]1C	ZINC000450751593	CD	On-Demand	Anodyne	GYRB	0	46
CO[C@@H]1CCN(c2nc(C(N)=O)cs2)C[C@H]1C	ZINC000450751594	CD	On-Demand	Anodyne	GYRB	0	46
COCCC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450751595	FH	On-Demand	Anodyne	P2RY12	86	34
COCCC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450751595	FH	On-Demand	Anodyne	CTSV	44	31
COCCC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450751595	FH	On-Demand	Anodyne	NPPA	48	37
COCCC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450751595	FH	On-Demand	Anodyne	HCN1	54	33
COCCC1(CNC(=O)c2cc(-c3ccccc3)nn2C)CCCCC1	ZINC000450751595	FH	On-Demand	Anodyne	HCN4	52	33
CO[C@H]1CCN(c2nc3ccccc3c(C)c2C#N)C[C@H]1C	ZINC000450751605	CG	On-Demand	Mild	PDE3B	40	33
CO[C@H]1CCN(c2nc3ccccc3c(C)c2C#N)C[C@@H]1C	ZINC000450751606	CG	On-Demand	Mild	PDE3B	40	33
CO[C@@H]1CCN(c2nc3ccccc3c(C)c2C#N)C[C@H]1C	ZINC000450751607	CG	On-Demand	Mild	PDE3B	40	33
CO[C@@H]1CCN(c2nc3ccccc3c(C)c2C#N)C[C@@H]1C	ZINC000450751608	CG	On-Demand	Mild	PDE3B	40	33
CS(=O)(=O)CCCCCNC(=O)c1cc2ccncc2s1	ZINC000450751617	EE	On-Demand	Anodyne	NAMPT	22	41
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	F10	26	40
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	COLA	61	37
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	CPT1A	65	35
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	CPT2	44	35
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	PRNP	17	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	HDAC1	32	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	GRM5	18	40
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	MCHR1	20	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	TAAR1	44	44
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	DGAT1	28	43
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751618	FI	On-Demand	Anodyne	KCNK3	62	38
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	F10	26	40
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	COLA	61	37
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	CPT1A	65	35
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	CPT2	44	35
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	PRNP	17	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	HDAC1	32	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	GRM5	18	40
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	MCHR1	20	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	TAAR1	44	44
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	DGAT1	28	43
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1(C)C	ZINC000450751619	FI	On-Demand	Anodyne	KCNK3	62	38
CCCc1nc(C)c(NC(=O)c2cn(CCc3ccccc3)nn2)s1	ZINC000450751635	FG	On-Demand	Anodyne	SCD1	16	42
CCCc1nc(C)c(NC(=O)c2cn(CCc3ccccc3)nn2)s1	ZINC000450751635	FG	On-Demand	Anodyne	THYX_PBCV1	0	40
COCC1=CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450751636	CG	On-Demand	Anodyne	DHCR7	0	46
O=C(c1cc2n(n1)CCCC2)N1CCC(c2ccsc2)CC1	ZINC000450751640	DG	On-Demand	Anodyne	L3MBTL3	56	35
CC(=O)c1cn(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)nn1	ZINC000450751641	GD	On-Demand	Anodyne	RBP4	44	35
CC(=O)c1cn(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)nn1	ZINC000450751642	GD	On-Demand	Anodyne	RBP4	44	35
O=C(CCC(=O)N(CCO)CC1CCCCC1)c1cccc([N+](=O)[O-])c1	ZINC000450751643	FF	On-Demand	Bother	CACNA1D	48	34
CC[C@@](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)(C(N)=O)C(C)C	ZINC000450751647	FG	On-Demand	Anodyne	RBP4	64	42
COc1ccc(CNC(=O)CCN2Cc3ccccc3C3(CC3)C2)c(OC)c1	ZINC000450751649	GG	On-Demand	Anodyne	HTR7	28	40
COc1ccc(CNC(=O)CCN2Cc3ccccc3C3(CC3)C2)c(OC)c1	ZINC000450751649	GG	On-Demand	Anodyne	MTNR1A	56	40
COc1ccc(CNC(=O)CCN2Cc3ccccc3C3(CC3)C2)c(OC)c1	ZINC000450751649	GG	On-Demand	Anodyne	MTNR1B	48	40
CCCNc1ccccc1NC(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450751673	EG	On-Demand	Anodyne	MAPK10	0	46
CCCNc1ccccc1NC(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450751673	EG	On-Demand	Anodyne	FAS	54	38
CC(C)c1ncsc1C(=O)N1CCC(c2ccsc2)CC1	ZINC000450751674	DI	On-Demand	Anodyne	NPBWR1	55	36
CCC[C@H](O)CN1CCC[C@]2(C1)OCc1ccccc12	ZINC000450751675	CF	On-Demand	Anodyne	SIGMAR1	19	40
CCC[C@@H](O)CN1CCC[C@]2(C1)OCc1ccccc12	ZINC000450751676	CF	On-Demand	Anodyne	SIGMAR1	19	40
CCC[C@H](O)CN1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450751677	CF	On-Demand	Anodyne	SIGMAR1	19	40
CCC[C@@H](O)CN1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450751678	CF	On-Demand	Anodyne	SIGMAR1	19	40
COC(=O)C1(CNC(=O)c2cccc(C#N)c2Br)CC1	ZINC000450751701	EE	On-Demand	Mild	HCN1	50	32
COC(=O)C1(CNC(=O)c2cccc(C#N)c2Br)CC1	ZINC000450751701	EE	On-Demand	Mild	HCN4	47	32
C[C@@H](Sc1ncnc2c1cnn2C)C(=O)Nc1nccs1	ZINC000450751713	DD	On-Demand	Anodyne	MAP1	58	35
C[C@H](Sc1ncnc2c1cnn2C)C(=O)Nc1nccs1	ZINC000450751714	DD	On-Demand	Anodyne	MAP1	58	35
COc1cccc([C@@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751726	GE	On-Demand	Anodyne	DRD4	46	38
COc1cccc([C@@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751726	GE	On-Demand	Anodyne	MTNR1A	32	41
COc1cccc([C@@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751726	GE	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc([C@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751727	GE	On-Demand	Anodyne	DRD4	46	38
COc1cccc([C@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751727	GE	On-Demand	Anodyne	MTNR1A	32	41
COc1cccc([C@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751727	GE	On-Demand	Anodyne	MTNR1B	35	41
O=C1CCC(CN2CCC(O)(Cc3cccc(F)c3)CC2)CC1	ZINC000450751735	DF	On-Demand	Anodyne	SIGMAR1	16	40
CC(C)COc1cccc(C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751739	GF	On-Demand	Anodyne	DRD4	52	42
CC(C)COc1cccc(C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751739	GF	On-Demand	Anodyne	ALPHA-1A	0	40
CC(C)COc1cccc(C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450751739	GF	On-Demand	Anodyne	PDS	52	36
Cc1noc([C@H]2CCN(c3nc4ccccc4nc3N3CCOCC3)C2)n1	ZINC000450751750	FE	On-Demand	Anodyne	PIK3CD	35	40
Cc1noc([C@H]2CCN(c3nc4ccccc4nc3N3CCOCC3)C2)n1	ZINC000450751750	FE	On-Demand	Anodyne	SMO	45	39
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3CCOCC3)C2)n1	ZINC000450751751	FE	On-Demand	Anodyne	PIK3CD	35	40
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3CCOCC3)C2)n1	ZINC000450751751	FE	On-Demand	Anodyne	SMO	45	39
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCO[C@H](C2CC2)C1	ZINC000450751756	FG	On-Demand	Anodyne	HRH4	21	44
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCO[C@@H](C2CC2)C1	ZINC000450751757	FG	On-Demand	Anodyne	HRH4	21	44
CC(=O)c1cccc(CSc2nnc(C(C)C)n2Cc2ccco2)c1	ZINC000450751809	FJ	On-Demand	Anodyne	HCRTR2	21	51
c1ccc2c(c1)CO[C@]21CCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450751846	CF	On-Demand	Anodyne	SIGMAR1	23	48
c1ccc2c(c1)CO[C@@]21CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450751847	CF	On-Demand	Anodyne	SIGMAR1	23	48
c1ccc2c(c1)CO[C@]21CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450751848	CF	On-Demand	Anodyne	SIGMAR1	23	48
c1ccc2c(c1)CO[C@@]21CCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450751849	CF	On-Demand	Anodyne	SIGMAR1	23	48
CCC(=O)CCCN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450751870	CH	On-Demand	Anodyne	DRD2	22	45
CCC(=O)CCCN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450751870	CH	On-Demand	Anodyne	DRD4	15	41
CCC(=O)CCCN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450751870	CH	On-Demand	Anodyne	HTR2A	22	41
CCC(=O)CCCN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450751870	CH	On-Demand	Anodyne	HTR2C	15	41
CCC(=O)CCCN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450751870	CH	On-Demand	Anodyne	SLC6A1	72	36
CCC(=O)CCCN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450751870	CH	On-Demand	Anodyne	ADRA1B	16	41
CCC(=O)CCCN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450751870	CH	On-Demand	Anodyne	MCHR1	26	41
CCC(=O)CCCN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450751870	CH	On-Demand	Anodyne	CYP2J2	48	34
CCC(=O)CCCN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450751871	CH	On-Demand	Anodyne	DRD2	22	45
CCC(=O)CCCN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450751871	CH	On-Demand	Anodyne	DRD4	15	41
CCC(=O)CCCN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450751871	CH	On-Demand	Anodyne	HTR2A	22	41
CCC(=O)CCCN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450751871	CH	On-Demand	Anodyne	HTR2C	15	41
CCC(=O)CCCN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450751871	CH	On-Demand	Anodyne	SLC6A1	72	36
CCC(=O)CCCN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450751871	CH	On-Demand	Anodyne	ADRA1B	16	41
CCC(=O)CCCN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450751871	CH	On-Demand	Anodyne	MCHR1	26	41
CCC(=O)CCCN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450751871	CH	On-Demand	Anodyne	CYP2J2	48	34
CO[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1(C)C	ZINC000450751881	DF	On-Demand	Bother	PDE3A	40	33
CO[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1(C)C	ZINC000450751881	DF	On-Demand	Bother	PDE3B	60	33
CO[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1(C)C	ZINC000450751882	DF	On-Demand	Bother	PDE3A	40	33
CO[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1(C)C	ZINC000450751882	DF	On-Demand	Bother	PDE3B	60	33
COc1ccc2nc(C)nc(N3CC[C@H](OC)C(C)(C)C3)c2c1	ZINC000450751883	DG	On-Demand	Anodyne	PDE3A	46	39
COc1ccc2nc(C)nc(N3CC[C@H](OC)C(C)(C)C3)c2c1	ZINC000450751883	DG	On-Demand	Anodyne	PDE3B	68	39
COc1ccc2nc(C)nc(N3CC[C@@H](OC)C(C)(C)C3)c2c1	ZINC000450751884	DG	On-Demand	Anodyne	PDE3A	46	39
COc1ccc2nc(C)nc(N3CC[C@@H](OC)C(C)(C)C3)c2c1	ZINC000450751884	DG	On-Demand	Anodyne	PDE3B	68	39
COc1cnc(N2CC[C@@H](OC)C(C)(C)C2)nc1N1CC[C@H](OC)C(C)(C)C1	ZINC000450751890	GF	On-Demand	Anodyne	PDE3B	46	32
COc1cnc(N2CC[C@@H](OC)C(C)(C)C2)nc1N1CC[C@@H](OC)C(C)(C)C1	ZINC000450751891	GF	On-Demand	Anodyne	PDE3B	46	32
COc1cnc(N2CC[C@H](OC)C(C)(C)C2)nc1N1CC[C@H](OC)C(C)(C)C1	ZINC000450751892	GF	On-Demand	Anodyne	PDE3B	46	32
COc1cnc(N2CC[C@H](OC)C(C)(C)C2)nc1N1CC[C@@H](OC)C(C)(C)C1	ZINC000450751893	GF	On-Demand	Anodyne	PDE3B	46	32
CO[C@H]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1(C)C	ZINC000450751900	EH	On-Demand	Bother	EGFR	0	47
CO[C@@H]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1(C)C	ZINC000450751901	EH	On-Demand	Bother	EGFR	0	47
CO[C@@H]1CCN(c2c(C#N)cnc3c(Cl)cc(C)cc23)C[C@@H]1C	ZINC000450751921	EH	On-Demand	Mild	SRC	41	35
CO[C@H]1CCN(c2c(C#N)cnc3c(Cl)cc(C)cc23)C[C@@H]1C	ZINC000450751928	EH	On-Demand	Mild	SRC	41	35
CO[C@@H]1CCN(c2c(C#N)cnc3c(Cl)cc(C)cc23)C[C@H]1C	ZINC000450751930	EH	On-Demand	Mild	SRC	41	35
CO[C@H]1CCN(c2c(C#N)cnc3c(Cl)cc(C)cc23)C[C@H]1C	ZINC000450751931	EH	On-Demand	Mild	SRC	41	35
CC[C@H]1Cc2ccccc2CN1Cc1nc(C(=O)OC)cs1	ZINC000450751933	DG	On-Demand	Anodyne	ADAM9	59	33
CC[C@@H]1Cc2ccccc2CN1Cc1nc(C(=O)OC)cs1	ZINC000450751934	DG	On-Demand	Anodyne	ADAM9	59	33
CO[C@@H]1CCN(c2ncccc2I)C[C@@H]1C	ZINC000450751951	EF	On-Demand	Anodyne	PDE3B	50	37
CO[C@H]1CCN(c2ncccc2I)C[C@H]1C	ZINC000450751952	EF	On-Demand	Anodyne	PDE3B	50	37
CO[C@@H]1CCN(c2ncccc2I)C[C@H]1C	ZINC000450751953	EF	On-Demand	Anodyne	PDE3B	50	37
CO[C@H]1CCN(c2ncccc2I)C[C@@H]1C	ZINC000450751954	EF	On-Demand	Anodyne	PDE3B	50	37
COC(=O)c1csc(CSc2cc(C(=O)NC3CC3)c3ccccc3n2)n1	ZINC000450751955	GH	On-Demand	Anodyne	TNKS	59	34
COC(=O)c1cccc(CN[C@H](C(=O)OC)c2ccc(F)c(C)c2)c1Cl	ZINC000450751971	GH	On-Demand	Anodyne	LEF	41	37
COC(=O)c1cccc(CN[C@@H](C(=O)OC)c2ccc(F)c(C)c2)c1Cl	ZINC000450751973	GH	On-Demand	Anodyne	LEF	41	37
CCCc1nc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)s1	ZINC000450752004	DH	On-Demand	Anodyne	GPR142	47	31
CCCc1nc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)s1	ZINC000450752012	DH	On-Demand	Anodyne	MME	47	34
CCCc1nc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)s1	ZINC000450752012	DH	On-Demand	Anodyne	GPR142	52	33
COc1ccc(-c2ccnc(N3CC[C@@H](OC)[C@H](C)C3)n2)cc1	ZINC000450752029	DG	On-Demand	Anodyne	DKK1	0	44
COc1ccc(-c2ccnc(N3CC[C@H](OC)[C@H](C)C3)n2)cc1	ZINC000450752030	DG	On-Demand	Anodyne	DKK1	0	44
COc1ccc(-c2ccnc(N3CC[C@H](OC)[C@@H](C)C3)n2)cc1	ZINC000450752032	DG	On-Demand	Anodyne	DKK1	0	44
Cc1ccc(F)c(CC(=O)N2CCC(c3ccsc3)CC2)c1	ZINC000450752033	DI	On-Demand	Anodyne	NPBWR1	43	35
COc1ccc(-c2ccnc(N3CC[C@@H](OC)[C@@H](C)C3)n2)cc1	ZINC000450752034	DG	On-Demand	Anodyne	DKK1	0	44
O=[N+]([O-])c1ccc([C@H]2CCCN(c3cc(N4CCCC[C@H]4CO)ncn3)C2)cc1	ZINC000450752043	GG	On-Demand	Bother	PRCP	30	40
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3cc(N4CCCC[C@@H]4CO)ncn3)C2)cc1	ZINC000450752046	GG	On-Demand	Bother	PRCP	30	40
COc1ccc(CC(=O)N2CCC(c3ccsc3)CC2)c(Cl)c1OC	ZINC000450752047	GI	On-Demand	Anodyne	NPBWR1	65	34
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3cc(N4CCCC[C@H]4CO)ncn3)C2)cc1	ZINC000450752048	GG	On-Demand	Bother	PRCP	30	40
O=[N+]([O-])c1ccc([C@H]2CCCN(c3cc(N4CCCC[C@@H]4CO)ncn3)C2)cc1	ZINC000450752050	GG	On-Demand	Bother	PRCP	30	40
O=C(c1cccc2c1CCCC2)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752054	GG	On-Demand	Anodyne	FABP4	41	36
O=C(c1cccc2c1CCCC2)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752054	GG	On-Demand	Anodyne	SCD1	22	45
O=C(c1cccc2c1CCCC2)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752054	GG	On-Demand	Anodyne	SCD	21	45
Cc1cnc(CCCC(=O)NCC2(c3ccc(F)cc3F)CCCC2)o1	ZINC000450752057	FI	On-Demand	Anodyne	MTNR1A	16	40
CC[C@](NC(=O)c1cc(-c2ccccc2)nn1C)(C(N)=O)C(C)C	ZINC000450752065	EE	On-Demand	Anodyne	P2RY12	42	32
CC[C@](NC(=O)c1cc(-c2ccccc2)nn1C)(C(N)=O)C(C)C	ZINC000450752065	EE	On-Demand	Anodyne	CTSV	47	32
CC[C@@](NC(=O)c1cc(-c2ccccc2)nn1C)(C(N)=O)C(C)C	ZINC000450752066	EE	On-Demand	Anodyne	P2RY12	42	32
CC[C@@](NC(=O)c1cc(-c2ccccc2)nn1C)(C(N)=O)C(C)C	ZINC000450752066	EE	On-Demand	Anodyne	CTSV	47	32
COC(=O)C1(CNC(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC1	ZINC000450752098	FE	On-Demand	Anodyne	TRPC6	64	35
COC(=O)C1(CNC(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC1	ZINC000450752098	FE	On-Demand	Anodyne	TRPC3	48	35
COC(=O)C1(CNC(=O)c2cn3nccc3nc2C)CC1	ZINC000450752099	CC	On-Demand	Anodyne	DDR1	46	35
COC(=O)C1(CNC(=O)c2cn3nccc3nc2C)CC1	ZINC000450752099	CC	On-Demand	Anodyne	HCN1	51	33
COC(=O)C1(CNC(=O)c2cn3nccc3nc2C)CC1	ZINC000450752099	CC	On-Demand	Anodyne	HCN4	49	33
CCCc1nc(C)c(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)s1	ZINC000450752100	FH	On-Demand	Bother	CACNA1D	47	32
CCc1cc(CCCN2CCC[C@@]3(C2)OCc2ccccc23)on1	ZINC000450752110	EH	On-Demand	Anodyne	SIGMAR1	20	48
CCc1cc(CCCN2CCC[C@]3(C2)OCc2ccccc23)on1	ZINC000450752111	EH	On-Demand	Anodyne	SIGMAR1	20	48
O=C(CCc1ccc2ccccc2c1O)N1CCC(c2ccsc2)CC1	ZINC000450752112	FJ	On-Demand	Anodyne	ETHR	53	35
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(CO)CO)ccc21	ZINC000450752124	FD	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(CO)CO)ccc21	ZINC000450752124	FD	On-Demand	Anodyne	DRD3	24	41
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(CO)CO)ccc21	ZINC000450752124	FD	On-Demand	Anodyne	PDGFRB	0	48
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(CO)CO)ccc21	ZINC000450752124	FD	On-Demand	Anodyne	CPT1A	49	34
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(CO)CO)ccc21	ZINC000450752124	FD	On-Demand	Anodyne	PLK1	52	37
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(CO)CO)ccc21	ZINC000450752124	FD	On-Demand	Anodyne	HPGD	49	60
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450752128	FG	On-Demand	Anodyne	MAP3K5	42	31
c1cc(N2C[C@H]3CCCC[C@H]3C2)nc(N2CCCCC2)n1	ZINC000450752132	CG	On-Demand	Anodyne	SORD	37	41
COc1cc(CN2CCNC(=O)[C@@H]2Cc2nc3ccccc3o2)ccc1Cl	ZINC000450752154	GG	On-Demand	Anodyne	SSTR5	66	45
COc1cc(CN2CCNC(=O)[C@H]2Cc2nc3ccccc3o2)ccc1Cl	ZINC000450752155	GG	On-Demand	Anodyne	SSTR5	66	45
COc1cc(CN2CCC(O)(Cc3cccc(F)c3)CC2)ccc1Cl	ZINC000450752173	FI	On-Demand	Anodyne	SIGMAR1	40	41
COc1cc(CN2CCC(O)(Cc3cccc(F)c3)CC2)ccc1Cl	ZINC000450752173	FI	On-Demand	Anodyne	MCHR2	41	35
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@H](O)C1CCC1	ZINC000450752189	CC	On-Demand	Anodyne	XIAP	40	35
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@H](O)C1CCC1	ZINC000450752189	CC	On-Demand	Anodyne	BIRC3	56	34
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@H](O)C1CCC1	ZINC000450752189	CC	On-Demand	Anodyne	BIRC2	52	36
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@H](O)C1CCC1	ZINC000450752189	CC	On-Demand	Anodyne	BIRC8	43	34
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@@H](O)C1CCC1	ZINC000450752190	CC	On-Demand	Anodyne	XIAP	40	35
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@@H](O)C1CCC1	ZINC000450752190	CC	On-Demand	Anodyne	BIRC3	56	34
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@@H](O)C1CCC1	ZINC000450752190	CC	On-Demand	Anodyne	BIRC2	52	36
O=C(N[C@@H]1CN(c2ccccc2)C1=O)[C@@H](O)C1CCC1	ZINC000450752190	CC	On-Demand	Anodyne	BIRC8	43	34
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@H](O)C1CCC1	ZINC000450752191	CC	On-Demand	Anodyne	XIAP	40	35
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@H](O)C1CCC1	ZINC000450752191	CC	On-Demand	Anodyne	BIRC3	56	34
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@H](O)C1CCC1	ZINC000450752191	CC	On-Demand	Anodyne	BIRC2	52	36
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@H](O)C1CCC1	ZINC000450752191	CC	On-Demand	Anodyne	BIRC8	43	34
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@@H](O)C1CCC1	ZINC000450752192	CC	On-Demand	Anodyne	XIAP	40	35
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@@H](O)C1CCC1	ZINC000450752192	CC	On-Demand	Anodyne	BIRC3	56	34
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@@H](O)C1CCC1	ZINC000450752192	CC	On-Demand	Anodyne	BIRC2	52	36
O=C(N[C@H]1CN(c2ccccc2)C1=O)[C@@H](O)C1CCC1	ZINC000450752192	CC	On-Demand	Anodyne	BIRC8	43	34
CCCNC(=O)c1ccc(N2CC[C@@H](c3nc(C)no3)C2)nc1	ZINC000450752199	DD	On-Demand	Anodyne	ETHR	40	34
CCCNC(=O)c1ccc(N2CC[C@H](c3nc(C)no3)C2)nc1	ZINC000450752200	DD	On-Demand	Anodyne	ETHR	40	34
N#CCC1(O)CN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450752228	FD	On-Demand	Mild	TRPV4	47	36
COC(=O)CN1CCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)CC1	ZINC000450752234	GD	On-Demand	Anodyne	HRH3	19	40
CCS(=O)(=O)c1ccc(CN2CCC(c3c(F)cccc3F)CC2)cc1	ZINC000450752240	GI	On-Demand	Anodyne	DRD2	15	46
CCS(=O)(=O)c1ccc(CN2CCC(c3c(F)cccc3F)CC2)cc1	ZINC000450752240	GI	On-Demand	Anodyne	SIGMAR1	40	40
C[C@@H]1Cc2cccc(C(=O)Nc3cccc4c3CN(CC(F)(F)F)C4)c2O1	ZINC000450752247	GI	On-Demand	Anodyne	G2YM83_BOTF4	47	39
C[C@H]1Cc2cccc(C(=O)Nc3cccc4c3CN(CC(F)(F)F)C4)c2O1	ZINC000450752248	GI	On-Demand	Anodyne	G2YM83_BOTF4	47	39
c1ccc(CCn2ccc(CN3CCC[C@H](OCC4CC4)C3)n2)cc1	ZINC000450752249	EH	On-Demand	Anodyne	SIGMAR1	15	48
c1ccc(CCn2ccc(CN3CCC[C@@H](OCC4CC4)C3)n2)cc1	ZINC000450752251	EH	On-Demand	Anodyne	SIGMAR1	15	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	ANPEP	46	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	FCER2	62	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	CAPNS1	48	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	MMP3	47	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	CAPN1	71	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	CAPN2	89	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	MMP1	32	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	FPR1	60	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752252	FF	On-Demand	Anodyne	NPR	69	36
C[C@H]1CN(CCN(C)Cc2ccccc2)CCC1=O	ZINC000450752253	CE	On-Demand	Anodyne	SIGMAR1	34	46
C[C@@H]1CN(CCN(C)Cc2ccccc2)CCC1=O	ZINC000450752254	CE	On-Demand	Anodyne	SIGMAR1	34	46
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450752281	GD	On-Demand	Anodyne	HTR1A	40	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450752281	GD	On-Demand	Anodyne	DRD2	33	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450752281	GD	On-Demand	Anodyne	DRD1	0	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450752281	GD	On-Demand	Anodyne	ADRA1A	15	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450752281	GD	On-Demand	Anodyne	DRD3	50	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450752281	GD	On-Demand	Anodyne	PDGFRB	21	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450752281	GD	On-Demand	Anodyne	CCR8	38	46
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(Br)cc1	ZINC000450752291	FH	On-Demand	Anodyne	HTR2C	15	45
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(Br)cc1	ZINC000450752291	FH	On-Demand	Anodyne	CYP2J2	57	40
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(Br)cc1	ZINC000450752293	FH	On-Demand	Anodyne	HTR2C	15	45
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(Br)cc1	ZINC000450752293	FH	On-Demand	Anodyne	CYP2J2	57	40
C[C@H](Sc1n[nH]c(CCC2CCCC2)n1)C(=O)Nc1nccs1	ZINC000450752294	FH	On-Demand	Anodyne	MAP1	57	35
C[C@H](Sc1n[nH]c(CCC2CCCC2)n1)C(=O)Nc1nccs1	ZINC000450752294	FH	On-Demand	Anodyne	GCK	15	43
C[C@@H](Sc1n[nH]c(CCC2CCCC2)n1)C(=O)Nc1nccs1	ZINC000450752295	FH	On-Demand	Anodyne	MAP1	57	35
C[C@@H](Sc1n[nH]c(CCC2CCCC2)n1)C(=O)Nc1nccs1	ZINC000450752295	FH	On-Demand	Anodyne	GCK	15	43
C[C@@H](O)CCN1CC=C(c2c(F)cccc2F)CC1	ZINC000450752299	CF	On-Demand	Anodyne	DRD2	0	42
COC(=O)C1(CN2CCC[C@]3(C2)OCc2ccccc23)CC1	ZINC000450752300	DE	On-Demand	Anodyne	SIGMAR1	20	45
C[C@H](O)CCN1CC=C(c2c(F)cccc2F)CC1	ZINC000450752301	CF	On-Demand	Anodyne	DRD2	0	42
COC(=O)C1(CN2CCC[C@@]3(C2)OCc2ccccc23)CC1	ZINC000450752302	DE	On-Demand	Anodyne	SIGMAR1	20	45
C[C@@H](Sc1nnc(N2CCCCC2)n1C1CC1)C(=O)Nc1nccs1	ZINC000450752304	GG	On-Demand	Anodyne	MAP1	65	36
C[C@H](Sc1nnc(N2CCCCC2)n1C1CC1)C(=O)Nc1nccs1	ZINC000450752309	GG	On-Demand	Anodyne	MAP1	65	36
Cc1ccc(C(=O)N[C@@H](CO)c2ccc(Cl)cc2)c(C)n1	ZINC000450752312	DF	On-Demand	Anodyne	MAPK1	58	36
Cc1ccc(C(=O)N[C@@H](CO)c2ccc(Cl)cc2)c(C)n1	ZINC000450752312	DF	On-Demand	Anodyne	UTS2	58	44
Cc1ccc(C(=O)N[C@H](CO)c2ccc(Cl)cc2)c(C)n1	ZINC000450752314	DF	On-Demand	Anodyne	MAPK1	58	36
Cc1ccc(C(=O)N[C@H](CO)c2ccc(Cl)cc2)c(C)n1	ZINC000450752314	DF	On-Demand	Anodyne	UTS2	58	44
CC(C)(C)[C@@H](CO)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450752316	CD	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)NCC2(c3ccc(F)cc3F)CCCC2)ccc1O	ZINC000450752324	GH	On-Demand	Anodyne	TRPV1	27	47
COc1cc(CC(=O)NCC2(c3ccc(F)cc3F)CCCC2)ccc1O	ZINC000450752324	GH	On-Demand	Anodyne	KCNA3	40	39
COc1cc(CC(=O)NCC2(c3ccc(F)cc3F)CCCC2)ccc1O	ZINC000450752324	GH	On-Demand	Anodyne	MTNR1A	20	40
COc1cc(CC(=O)NCC2(c3ccc(F)cc3F)CCCC2)ccc1O	ZINC000450752324	GH	On-Demand	Anodyne	NCE103	22	41
C/C=C\COc1cccc(CC(=O)N[C@H](CO)C(C)(C)C)c1	ZINC000450752327	DF	On-Demand	Anodyne	PDS	42	30
COC(=O)CN1CCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450752328	ED	On-Demand	Anodyne	BDKRB1	0	41
COC(=O)c1csc(CN2CCC[C@]3(C2)OCc2ccccc23)n1	ZINC000450752356	EF	On-Demand	Anodyne	SIGMAR1	18	43
COC(=O)c1csc(CN2CCC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450752362	EF	On-Demand	Anodyne	SIGMAR1	18	43
C[C@H](SCCN1CCOCC1)C(=O)Nc1nccs1	ZINC000450752369	DD	On-Demand	Anodyne	MAP1	122	43
C[C@H](SCCN1CCOCC1)C(=O)Nc1nccs1	ZINC000450752369	DD	On-Demand	Anodyne	GCK	22	40
C[C@@H](SCCN1CCOCC1)C(=O)Nc1nccs1	ZINC000450752371	DD	On-Demand	Anodyne	MAP1	122	43
C[C@@H](SCCN1CCOCC1)C(=O)Nc1nccs1	ZINC000450752371	DD	On-Demand	Anodyne	GCK	22	40
C[C@@H](O)CCCSc1cccc2cccnc12	ZINC000450752380	BG	On-Demand	Anodyne	METAP2	16	42
C[C@H](O)CCCSc1cccc2cccnc12	ZINC000450752381	BG	On-Demand	Anodyne	METAP2	16	42
CC[C@@](NC(=O)Cc1ccc(O)c(F)c1)(C(N)=O)C(C)C	ZINC000450752398	CD	On-Demand	Anodyne	CAN2	0	41
CC[C@](NC(=O)Cc1ccc(O)c(F)c1)(C(N)=O)C(C)C	ZINC000450752400	CD	On-Demand	Anodyne	CAN2	0	41
CC[C@H](O)CC(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450752410	ED	On-Demand	Anodyne	RBP4	66	37
CC[C@H](O)CC(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450752412	ED	On-Demand	Anodyne	RBP4	66	37
CC[C@@H](O)CC(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450752414	ED	On-Demand	Anodyne	RBP4	66	37
CC[C@@H](O)CC(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450752415	ED	On-Demand	Anodyne	RBP4	66	37
COc1cc(CN2CCN(c3nnc(C(F)(F)F)s3)CC2)ccc1Cl	ZINC000450752425	GH	On-Demand	Anodyne	DRD1	0	43
COc1cc(CN2CCN(c3nnc(C(F)(F)F)s3)CC2)ccc1Cl	ZINC000450752425	GH	On-Demand	Anodyne	DRD4	21	43
COc1cc(CN2CCN(c3nnc(C(F)(F)F)s3)CC2)ccc1Cl	ZINC000450752425	GH	On-Demand	Anodyne	SSTR5	43	37
CCC(=O)CCCN1CCC[C@]2(C1)OCc1ccccc12	ZINC000450752427	CG	On-Demand	Anodyne	SIGMAR1	27	49
CCC(=O)CCCN1CCC[C@]2(C1)OCc1ccccc12	ZINC000450752427	CG	On-Demand	Anodyne	MCHR1	15	44
CCC(=O)CCCN1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450752428	CG	On-Demand	Anodyne	SIGMAR1	27	49
CCC(=O)CCCN1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450752428	CG	On-Demand	Anodyne	MCHR1	15	44
CCOC(=O)c1ccc(CN2CCC(c3nnc4n3CCCC4)CC2)nc1	ZINC000450752434	FF	On-Demand	Anodyne	SSTR5	36	41
COCC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752439	EH	On-Demand	Anodyne	DRD2	20	41
COCC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752439	EH	On-Demand	Anodyne	DRD4	33	41
COCC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752439	EH	On-Demand	Anodyne	DRD3	15	41
COCC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752439	EH	On-Demand	Anodyne	OPRK1	38	42
COCC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752439	EH	On-Demand	Anodyne	HTR4	58	36
COCC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752439	EH	On-Demand	Anodyne	CCR3	49	43
COCC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752439	EH	On-Demand	Anodyne	UTS2R	20	40
COCC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752439	EH	On-Demand	Anodyne	MCHR1	29	41
CCN1C[C@H](Nc2ncc(C(=O)N3CCOCC3)cc2Cl)CC1=O	ZINC000450752441	FD	On-Demand	Anodyne	LRRK2	30	41
COCC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752442	EH	On-Demand	Anodyne	DRD2	20	41
COCC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752442	EH	On-Demand	Anodyne	DRD4	33	41
COCC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752442	EH	On-Demand	Anodyne	DRD3	15	41
COCC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752442	EH	On-Demand	Anodyne	OPRK1	38	42
COCC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752442	EH	On-Demand	Anodyne	HTR4	58	36
COCC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752442	EH	On-Demand	Anodyne	CCR3	49	43
COCC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752442	EH	On-Demand	Anodyne	UTS2R	20	40
COCC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450752442	EH	On-Demand	Anodyne	MCHR1	29	41
CCN1C[C@@H](Nc2ncc(C(=O)N3CCOCC3)cc2Cl)CC1=O	ZINC000450752444	FD	On-Demand	Anodyne	LRRK2	30	41
COc1ccnc(CN[C@H]2CCCC[C@@H]2c2ccccc2)n1	ZINC000450752445	CG	On-Demand	Anodyne	KDM1A	16	45
COc1ccnc(CN[C@H]2CCCC[C@H]2c2ccccc2)n1	ZINC000450752447	CG	On-Demand	Anodyne	KDM1A	16	45
COc1ccnc(CN[C@@H]2CCCC[C@@H]2c2ccccc2)n1	ZINC000450752451	CG	On-Demand	Anodyne	KDM1A	16	45
COc1ccnc(CN[C@@H]2CCCC[C@H]2c2ccccc2)n1	ZINC000450752454	CG	On-Demand	Anodyne	KDM1A	16	45
C=C[C@@H]1OCC[C@H]1Nc1ncnc2ccc(SC)cc12	ZINC000450752480	CG	On-Demand	Mild	CD38	51	40
CC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752492	FG	On-Demand	Anodyne	CTSB	0	40
CC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752492	FG	On-Demand	Anodyne	NPBWR1	25	44
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752496	FG	On-Demand	Anodyne	CTSB	0	40
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752496	FG	On-Demand	Anodyne	NPBWR1	25	44
CC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752497	FG	On-Demand	Anodyne	CTSB	0	40
CC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752497	FG	On-Demand	Anodyne	NPBWR1	25	44
CC[C@H]1CCC[C@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752498	FG	On-Demand	Anodyne	CTSB	0	40
CC[C@H]1CCC[C@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752498	FG	On-Demand	Anodyne	NPBWR1	25	44
CCc1cc(SCc2cccc(C)c2)n2ncnc2n1	ZINC000450752505	CG	On-Demand	Anodyne	DHOD	0	42
CCn1nc(C)c(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1C	ZINC000450752510	GD	On-Demand	Anodyne	P2RX7	35	44
COC(=O)COc1ccc([C@H](C)N[C@@H](C)CC(C)C)cc1	ZINC000450752536	CG	On-Demand	Anodyne	ACACA	55	39
COC(=O)COc1ccc([C@H](C)N[C@H](C)CC(C)C)cc1	ZINC000450752537	CG	On-Demand	Anodyne	ACACA	55	39
COC(=O)COc1ccc([C@@H](C)N[C@@H](C)CC(C)C)cc1	ZINC000450752538	CG	On-Demand	Anodyne	ACACA	55	39
COC(=O)COc1ccc([C@@H](C)N[C@H](C)CC(C)C)cc1	ZINC000450752539	CG	On-Demand	Anodyne	ACACA	55	39
C[C@@H](Sc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)Nc1nccs1	ZINC000450752540	GH	On-Demand	Anodyne	MAP1	93	34
C[C@@H](Sc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)Nc1nccs1	ZINC000450752540	GH	On-Demand	Anodyne	TNKS	40	31
C[C@H](Sc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)Nc1nccs1	ZINC000450752541	GH	On-Demand	Anodyne	MAP1	93	34
C[C@H](Sc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)Nc1nccs1	ZINC000450752541	GH	On-Demand	Anodyne	TNKS	40	31
CN(C)C(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450752542	FG	On-Demand	Bother	SLC27A4	42	32
CN(C)C(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450752543	FG	On-Demand	Bother	SLC27A4	42	32
COC(=O)c1cncc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450752551	EF	On-Demand	Bother	SLC27A4	51	34
COC(=O)c1cncc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450752552	EF	On-Demand	Bother	SLC27A4	51	34
COc1ccc2c(N3CC[C@@H](OC)[C@H](C)C3)c([N+](=O)[O-])cnc2c1	ZINC000450752570	EG	On-Demand	Bother	PDE3B	53	36
COc1ccc2c(N3CC[C@H](OC)[C@H](C)C3)c([N+](=O)[O-])cnc2c1	ZINC000450752571	EG	On-Demand	Bother	PDE3B	53	36
COc1ccc2c(N3CC[C@@H](OC)[C@@H](C)C3)c([N+](=O)[O-])cnc2c1	ZINC000450752572	EG	On-Demand	Bother	PDE3B	53	36
COc1ccc2c(N3CC[C@H](OC)[C@@H](C)C3)c([N+](=O)[O-])cnc2c1	ZINC000450752573	EG	On-Demand	Bother	PDE3B	53	36
COc1cnc(N2CC[C@H](OC)[C@H](C)C2)nc1N1CC[C@@H](OC)[C@H](C)C1	ZINC000450752580	FE	On-Demand	Anodyne	PDE3A	49	39
COc1cnc(N2CC[C@H](OC)[C@H](C)C2)nc1N1CC[C@@H](OC)[C@H](C)C1	ZINC000450752580	FE	On-Demand	Anodyne	PDE3B	48	39
COc1cnc(N2CC[C@H](OC)[C@H](C)C2)nc1N1CC[C@H](OC)[C@@H](C)C1	ZINC000450752581	FE	On-Demand	Anodyne	PDE3A	49	39
COc1cnc(N2CC[C@H](OC)[C@H](C)C2)nc1N1CC[C@H](OC)[C@@H](C)C1	ZINC000450752581	FE	On-Demand	Anodyne	PDE3B	48	39
COc1cnc(N2CC[C@H](OC)[C@H](C)C2)nc1N1CC[C@@H](OC)[C@@H](C)C1	ZINC000450752582	FE	On-Demand	Anodyne	PDE3A	49	39
COc1cnc(N2CC[C@H](OC)[C@H](C)C2)nc1N1CC[C@@H](OC)[C@@H](C)C1	ZINC000450752582	FE	On-Demand	Anodyne	PDE3B	48	39
COc1cnc(N2CC[C@H](OC)[C@H](C)C2)nc1N1CC[C@H](OC)[C@H](C)C1	ZINC000450752583	FE	On-Demand	Anodyne	PDE3A	49	39
COc1cnc(N2CC[C@H](OC)[C@H](C)C2)nc1N1CC[C@H](OC)[C@H](C)C1	ZINC000450752583	FE	On-Demand	Anodyne	PDE3B	48	39
CCOC(=O)c1ccnc(N2CC[C@@H](OC)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000450752590	EE	On-Demand	Bother	SLC27A4	44	33
CCOC(=O)c1ccnc(N2CC[C@H](OC)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000450752591	EE	On-Demand	Bother	SLC27A4	44	33
CO[C@H]1CCN(c2nccc3c([N+](=O)[O-])cccc23)C[C@H]1C	ZINC000450752592	DG	On-Demand	Bother	PDE3B	46	33
CO[C@@H]1CCN(c2nccc3c([N+](=O)[O-])cccc23)C[C@H]1C	ZINC000450752593	DG	On-Demand	Bother	PDE3B	46	33
CO[C@H]1CCN(c2nccc3c([N+](=O)[O-])cccc23)C[C@@H]1C	ZINC000450752594	DG	On-Demand	Bother	PDE3B	46	33
CO[C@@H]1CCN(c2nccc3c([N+](=O)[O-])cccc23)C[C@@H]1C	ZINC000450752595	DG	On-Demand	Bother	PDE3B	46	33
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450752596	GH	On-Demand	Anodyne	MTNR1A	27	40
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450752596	GH	On-Demand	Anodyne	MTNR1B	0	40
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450752596	GH	On-Demand	Anodyne	SFRP1	84	34
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450752596	GH	On-Demand	Anodyne	WNT3	41	34
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450752597	GH	On-Demand	Anodyne	MTNR1A	27	40
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450752597	GH	On-Demand	Anodyne	MTNR1B	0	40
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450752597	GH	On-Demand	Anodyne	SFRP1	84	34
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1C(C)C	ZINC000450752597	GH	On-Demand	Anodyne	WNT3	41	34
CO[C@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@@H]1C	ZINC000450752604	DH	On-Demand	Anodyne	PDE3A	47	38
CO[C@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@@H]1C	ZINC000450752604	DH	On-Demand	Anodyne	PDE3B	46	38
CO[C@@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@H]1C	ZINC000450752605	DH	On-Demand	Anodyne	PDE3A	47	38
CO[C@@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@H]1C	ZINC000450752605	DH	On-Demand	Anodyne	PDE3B	46	38
CO[C@@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@@H]1C	ZINC000450752606	DH	On-Demand	Anodyne	PDE3A	47	38
CO[C@H]1CCN(c2ncnc3sc4ccccc4c23)C[C@H]1C	ZINC000450752607	DH	On-Demand	Anodyne	PDE3A	47	38
CC(C)(CO)C(C)(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450752640	EE	On-Demand	Bother	CACNA1D	56	32
CN(C)CCNS(=O)(=O)c1ccc(N2C[C@H]3CCCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450752641	GE	On-Demand	Bother	BCL2L1	64	32
CN(C)CCNS(=O)(=O)c1ccc(N2C[C@H]3CCCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450752641	GE	On-Demand	Bother	BCL2	59	32
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1	ZINC000450752642	GF	On-Demand	Anodyne	HTR7	19	40
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1	ZINC000450752642	GF	On-Demand	Anodyne	MTNR1A	67	40
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1	ZINC000450752642	GF	On-Demand	Anodyne	MTNR1B	60	40
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1	ZINC000450752642	GF	On-Demand	Anodyne	CHRNA10	41	44
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1	ZINC000450752642	GF	On-Demand	Anodyne	ACKR3	65	34
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1	ZINC000450752643	GF	On-Demand	Anodyne	HTR7	19	40
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1	ZINC000450752643	GF	On-Demand	Anodyne	MTNR1A	67	40
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1	ZINC000450752643	GF	On-Demand	Anodyne	MTNR1B	60	40
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1	ZINC000450752643	GF	On-Demand	Anodyne	CHRNA10	41	44
COc1cccc(OCCC(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1	ZINC000450752643	GF	On-Demand	Anodyne	ACKR3	65	34
O=C(C1CC1)[C@@H]1CN(CCc2ccc(Cl)cc2)CCO1	ZINC000450752664	CF	On-Demand	Anodyne	SLC6A1	28	43
O=C(C1CC1)[C@@H]1CN(CCc2ccc(Cl)cc2)CCO1	ZINC000450752664	CF	On-Demand	Anodyne	BIRC2	35	42
O=C(C1CC1)[C@H]1CN(CCc2ccc(Cl)cc2)CCO1	ZINC000450752665	CF	On-Demand	Anodyne	SLC6A1	28	43
O=C(C1CC1)[C@H]1CN(CCc2ccc(Cl)cc2)CCO1	ZINC000450752665	CF	On-Demand	Anodyne	BIRC2	35	42
Cc1ccnc(-c2noc(CSc3nnc(C(C)C)n3Cc3ccco3)n2)c1	ZINC000450752666	GI	On-Demand	Anodyne	TNKS2	15	40
FC(F)(F)c1nnc(N2CC[C@@H](c3cccc(Br)c3)C2)s1	ZINC000450752678	GI	On-Demand	Anodyne	MLYCD	21	40
FC(F)(F)c1nnc(N2CC[C@H](c3cccc(Br)c3)C2)s1	ZINC000450752679	GI	On-Demand	Anodyne	MLYCD	21	40
Cc1noc([C@@H]2COCCN2C(=O)Cc2sccc2Br)n1	ZINC000450752705	FE	On-Demand	Anodyne	COLA	25	41
Cc1noc([C@@H]2COCCN2C(=O)Cc2sccc2Br)n1	ZINC000450752705	FE	On-Demand	Anodyne	CPT1A	22	41
Cc1noc([C@H]2COCCN2C(=O)Cc2sccc2Br)n1	ZINC000450752711	FE	On-Demand	Anodyne	COLA	25	41
Cc1noc([C@H]2COCCN2C(=O)Cc2sccc2Br)n1	ZINC000450752711	FE	On-Demand	Anodyne	CPT1A	22	41
COc1ccc(OC(F)(F)F)c(C(=O)NCc2nnc(N)o2)c1	ZINC000450752721	ED	On-Demand	Anodyne	GRIN2B	15	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450752739	GI	On-Demand	Anodyne	CAPN2	41	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450752739	GI	On-Demand	Anodyne	HPN	41	32
CC(C)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752749	CG	On-Demand	Anodyne	LTA4H	16	42
CC(C)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752749	CG	On-Demand	Anodyne	HDAC10	34	48
CC(C)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752749	CG	On-Demand	Anodyne	HDAC1	22	51
CC(C)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752749	CG	On-Demand	Anodyne	HDAC2	24	51
CC(C)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752749	CG	On-Demand	Anodyne	HDAC3	27	48
CC(C)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752749	CG	On-Demand	Anodyne	HDAC6	27	51
CC(C)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752749	CG	On-Demand	Anodyne	HDAC7	28	43
CC(C)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450752749	CG	On-Demand	Anodyne	DAGLA	32	41
COC(=O)CN1CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450752754	CC	On-Demand	Anodyne	GNAI1	0	40
CCN1C[C@H](Nc2ccnc3cc(F)ccc23)CC1=O	ZINC000450752793	CE	On-Demand	Anodyne	HNMT	45	31
CCN1C[C@@H](Nc2ccnc3cc(F)ccc23)CC1=O	ZINC000450752794	CE	On-Demand	Anodyne	HNMT	45	31
CC(=O)c1ccc(CN2CCC(c3ccsc3)CC2)cc1	ZINC000450752801	CI	On-Demand	Anodyne	DRD2	15	42
CC(=O)c1ccc(CN2CCC(c3ccsc3)CC2)cc1	ZINC000450752801	CI	On-Demand	Anodyne	DRD4	31	42
CC(=O)c1ccc(CN2CCC(c3ccsc3)CC2)cc1	ZINC000450752801	CI	On-Demand	Anodyne	ACHE	19	46
CC(=O)c1ccc(CN2CCC(c3ccsc3)CC2)cc1	ZINC000450752801	CI	On-Demand	Anodyne	SIGMAR1	36	45
CC(=O)c1ccc(CN2CCC(c3ccsc3)CC2)cc1	ZINC000450752801	CI	On-Demand	Anodyne	MCHR1	28	42
Cc1cc(C(=O)Nc2ccccc2NCC2CCCCC2)ncc1C(N)=O	ZINC000450752808	FH	On-Demand	Anodyne	CSF1R	44	40
Cc1cc(C(=O)Nc2ccccc2NCC2CCCCC2)ncc1C(N)=O	ZINC000450752808	FH	On-Demand	Anodyne	CCR8	46	33
CC(=O)c1cccc(CN2Cc3ccccc3C3(CC3)C2)c1	ZINC000450752810	CH	On-Demand	Anodyne	SIGMAR1	24	40
CC(=O)c1cccc(CN2Cc3ccccc3C3(CC3)C2)c1	ZINC000450752810	CH	On-Demand	Anodyne	MCHR2	64	34
COc1ccc(CNC(=O)CCSc2ncccc2Cl)c(OC)c1	ZINC000450752812	FH	On-Demand	Anodyne	MTNR1A	46	38
O=C(CCC(=O)N1CCC(c2ccsc2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000450752834	FI	On-Demand	Bother	CACNA1D	54	32
O=C(CCC(=O)N1CCC(c2ccsc2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000450752834	FI	On-Demand	Bother	ETHR	41	32
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752836	GG	On-Demand	Anodyne	NPBWR1	25	43
CCC[C@H]1CCC[C@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752844	GG	On-Demand	Anodyne	NPBWR1	25	43
CCC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752846	GG	On-Demand	Anodyne	NPBWR1	25	43
CCC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450752847	GG	On-Demand	Anodyne	NPBWR1	25	43
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](CO)C(C)(C)C)ccc21	ZINC000450752877	FG	On-Demand	Anodyne	F9	21	43
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](CO)C(C)(C)C)ccc21	ZINC000450752877	FG	On-Demand	Anodyne	PDGFRB	15	46
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](CO)C(C)(C)C)ccc21	ZINC000450752877	FG	On-Demand	Anodyne	CPT1A	48	33
COc1ccccc1-n1cnc2cc(C(=O)N[C@H](CO)C(C)(C)C)ccc21	ZINC000450752877	FG	On-Demand	Anodyne	HPGD	48	57
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1(C)C	ZINC000450752894	FF	On-Demand	Anodyne	HTR3A	22	42
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1(C)C	ZINC000450752894	FF	On-Demand	Anodyne	HRH4	24	51
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1(C)C	ZINC000450752896	FF	On-Demand	Anodyne	HTR3A	22	42
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1(C)C	ZINC000450752896	FF	On-Demand	Anodyne	HRH4	24	51
COC(=O)C1(CNC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)CC1	ZINC000450752897	CE	On-Demand	Anodyne	KCNA3	40	37
CCCCCn1cnc2c1c(=O)n(C[C@H](C)S(C)(=O)=O)c(=O)n2CCCC	ZINC000450752898	GD	On-Demand	Anodyne	CHIB1	0	41
CCCCCn1cnc2c1c(=O)n(C[C@@H](C)S(C)(=O)=O)c(=O)n2CCCC	ZINC000450752900	GD	On-Demand	Anodyne	CHIB1	0	41
CC[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450752931	EF	On-Demand	Anodyne	RBP4	65	36
CC[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450752933	EF	On-Demand	Anodyne	RBP4	65	36
CCSc1cccnc1C(=O)N1CCC(c2ccsc2)CC1	ZINC000450752935	EI	On-Demand	Anodyne	NPBWR1	44	35
CCCc1nc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)s1	ZINC000450752947	FG	On-Demand	Anodyne	COLA	71	36
CCCc1nc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)s1	ZINC000450752947	FG	On-Demand	Anodyne	CPT1A	65	36
CCCc1nc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)s1	ZINC000450752947	FG	On-Demand	Anodyne	CPT2	40	35
CCCc1nc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)s1	ZINC000450752947	FG	On-Demand	Anodyne	CPT1B	68	34
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	MMP13	32	45
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	CAPNS1	15	48
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	MMP2	36	56
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	MMP3	20	45
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	MMP8	17	56
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	CAPN1	17	54
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	MMP9	21	56
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	MMP7	21	43
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	ADAMTS4	48	32
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000450752963	GD	On-Demand	Anodyne	LEF	42	34
O=C(CCCN1CCO[C@@]2(CCOC2)C1)c1ccc(F)cc1	ZINC000450752969	DE	On-Demand	Anodyne	DRD2	32	49
O=C(CCCN1CCO[C@@]2(CCOC2)C1)c1ccc(F)cc1	ZINC000450752969	DE	On-Demand	Anodyne	ERG2	23	49
O=C(CCCN1CCO[C@@]2(CCOC2)C1)c1ccc(F)cc1	ZINC000450752969	DE	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCO[C@]2(CCOC2)C1)c1ccc(F)cc1	ZINC000450752970	DE	On-Demand	Anodyne	DRD2	32	49
O=C(CCCN1CCO[C@]2(CCOC2)C1)c1ccc(F)cc1	ZINC000450752970	DE	On-Demand	Anodyne	ERG2	23	49
O=C(CCCN1CCO[C@]2(CCOC2)C1)c1ccc(F)cc1	ZINC000450752970	DE	On-Demand	Anodyne	CYP2J2	49	35
COCC[C@@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752988	CH	On-Demand	Anodyne	DRD4	28	40
COCC[C@@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752988	CH	On-Demand	Anodyne	ACHE	24	46
COCC[C@@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752988	CH	On-Demand	Anodyne	SLC6A1	46	33
COCC[C@@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752988	CH	On-Demand	Anodyne	HRH3	27	52
COCC[C@@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752988	CH	On-Demand	Anodyne	SIGMAR1	21	44
COCC[C@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752989	CH	On-Demand	Anodyne	DRD4	28	40
COCC[C@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752989	CH	On-Demand	Anodyne	ACHE	24	46
COCC[C@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752989	CH	On-Demand	Anodyne	SLC6A1	46	33
COCC[C@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752989	CH	On-Demand	Anodyne	HRH3	27	52
COCC[C@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450752989	CH	On-Demand	Anodyne	SIGMAR1	21	44
CNC(=O)N[C@H]1CCN(C[C@@H]2CCCCN2C(C)C)C1	ZINC000450753035	CD	On-Demand	Anodyne	BIRC2	41	35
CNC(=O)N[C@@H]1CCN(C[C@@H]2CCCCN2C(C)C)C1	ZINC000450753036	CD	On-Demand	Anodyne	BIRC2	41	35
CNC(=O)N[C@H]1CCN(C[C@H]2CCCCN2C(C)C)C1	ZINC000450753037	CD	On-Demand	Anodyne	BIRC2	41	35
CNC(=O)N[C@@H]1CCN(C[C@H]2CCCCN2C(C)C)C1	ZINC000450753038	CD	On-Demand	Anodyne	BIRC2	41	35
CO[C@@H]1CCN(c2ccnc(C)n2)C[C@@H]1C	ZINC000450753048	BD	On-Demand	Anodyne	SORD	40	35
CO[C@H]1CCN(c2ccnc(C)n2)C[C@H]1C	ZINC000450753049	BD	On-Demand	Anodyne	SORD	40	35
CO[C@@H]1CCN(c2ccnc(C)n2)C[C@H]1C	ZINC000450753050	BD	On-Demand	Anodyne	SORD	40	35
CO[C@H]1CCN(c2ccnc(C)n2)C[C@@H]1C	ZINC000450753051	BD	On-Demand	Anodyne	SORD	40	35
CO[C@H]1CCN(c2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)CC1(C)C	ZINC000450753052	GI	On-Demand	Anodyne	NPBWR1	46	44
CO[C@@H]1CCN(c2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)CC1(C)C	ZINC000450753053	GI	On-Demand	Anodyne	NPBWR1	46	44
O=c1c2ccc(Cl)cc2ncn1CC1=CCCCC1	ZINC000450753060	CH	On-Demand	Anodyne	HRP1_PLAFA	65	34
O=c1c2ccc(Cl)cc2ncn1CC1=CCCCC1	ZINC000450753060	CH	On-Demand	Anodyne	HNMT	45	31
O=c1c2ccc(Cl)cc2ncn1CC1=CCCCC1	ZINC000450753060	CH	On-Demand	Anodyne	SCD	0	41
CNC(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000450753064	EE	On-Demand	Bother	SCD1	23	43
CNC(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000450753065	EE	On-Demand	Bother	SCD1	23	43
COCCC1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450753098	DI	On-Demand	Anodyne	DRD4	41	31
COCCC1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450753098	DI	On-Demand	Anodyne	HCN1	51	31
COCCC1(CNC(=O)c2cccc(SC)c2)CCCCC1	ZINC000450753098	DI	On-Demand	Anodyne	HCN4	49	31
CO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C	ZINC000450753113	EH	On-Demand	Bother	SERPINE1	16	41
CO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C	ZINC000450753113	EH	On-Demand	Bother	LIPG	55	36
CO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C	ZINC000450753114	EH	On-Demand	Bother	SERPINE1	16	41
CO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C	ZINC000450753114	EH	On-Demand	Bother	LIPG	55	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450753122	GI	On-Demand	Anodyne	CAPN2	41	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450753122	GI	On-Demand	Anodyne	HPN	41	32
Brc1cccc([C@H]2CCN(c3cc(N4CCOCC4)ncn3)C2)c1	ZINC000450753125	GG	On-Demand	Anodyne	ADK	37	42
Brc1cccc([C@@H]2CCN(c3cc(N4CCOCC4)ncn3)C2)c1	ZINC000450753126	GG	On-Demand	Anodyne	ADK	37	42
CCC(=O)CCCN1CCCC2(CC2)C1	ZINC000450753131	BF	On-Demand	Anodyne	EBP	18	49
COc1cc(CSc2nnc(CSC)o2)ccc1Cl	ZINC000450753140	DH	On-Demand	Anodyne	GSK3B	0	48
COc1cc(CSc2nnc(CSC)o2)ccc1Cl	ZINC000450753140	DH	On-Demand	Anodyne	GSK3A	29	41
COc1cc(CSc2nnc(CSC)o2)ccc1Cl	ZINC000450753140	DH	On-Demand	Anodyne	PTK2	0	42
COc1cc(CSc2nnc(CSC)o2)ccc1Cl	ZINC000450753140	DH	On-Demand	Anodyne	TERT	0	42
Cc1noc(Cl)c1CC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450753141	FD	On-Demand	Anodyne	P2RX7	29	40
CC(CO)(CO)NC(=O)c1cc2ccncc2s1	ZINC000450753148	CC	On-Demand	Anodyne	SELE	43	33
CC(CO)(CO)NC(=O)c1cc2ccncc2s1	ZINC000450753148	CC	On-Demand	Anodyne	VCAM1	47	36
Cc1cc(Br)cc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450753163	DH	On-Demand	Anodyne	HDAC10	19	46
Cc1cc(Br)cc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450753163	DH	On-Demand	Anodyne	HDAC3	17	59
NS(=O)(=O)c1cnc(N2CC[C@H](c3cccc(Br)c3)C2)s1	ZINC000450753168	GF	On-Demand	Anodyne	MLYCD	24	41
NS(=O)(=O)c1cnc(N2CC[C@@H](c3cccc(Br)c3)C2)s1	ZINC000450753169	GF	On-Demand	Anodyne	MLYCD	24	41
CC(C)c1nnc(S[C@H](C)C(=O)Nc2nccs2)n1Cc1ccco1	ZINC000450753175	GH	On-Demand	Anodyne	MAP1	74	34
CC(C)c1nnc(S[C@H](C)C(=O)Nc2nccs2)n1Cc1ccco1	ZINC000450753175	GH	On-Demand	Anodyne	HCRTR2	19	54
CC(C)c1nnc(S[C@@H](C)C(=O)Nc2nccs2)n1Cc1ccco1	ZINC000450753176	GH	On-Demand	Anodyne	MAP1	74	34
CC(C)c1nnc(S[C@@H](C)C(=O)Nc2nccs2)n1Cc1ccco1	ZINC000450753176	GH	On-Demand	Anodyne	HCRTR2	19	54
COC(=O)C1(CSc2nnc(C(C)C)n2Cc2ccco2)CCCC1	ZINC000450753187	FH	On-Demand	Anodyne	HCRTR2	20	41
COc1cc(CC(=O)NC(C)(CO)CO)ccc1Cl	ZINC000450753192	CC	On-Demand	Anodyne	TRPV1	36	46
COc1cc(CC(=O)NC(C)(CO)CO)ccc1Cl	ZINC000450753192	CC	On-Demand	Anodyne	NCE103	30	48
COc1cc(CC(=O)NC(C)(CO)CO)ccc1Cl	ZINC000450753192	CC	On-Demand	Anodyne	CAN2	0	48
Cc1ccnc(OC2CCN(C(=O)[C@@H](O)C3CCC3)CC2)c1	ZINC000450753211	DD	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)[C@@H](O)C3CCC3)CC2)c1	ZINC000450753211	DD	On-Demand	Anodyne	HCRTR2	0	41
Cc1ccnc(OC2CCN(C(=O)[C@H](O)C3CCC3)CC2)c1	ZINC000450753220	DD	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)[C@H](O)C3CCC3)CC2)c1	ZINC000450753220	DD	On-Demand	Anodyne	HCRTR2	0	41
COc1ccc(NC(=O)CCCn2nc(C)nc2C)cc1[N+](=O)[O-]	ZINC000450753222	EE	On-Demand	Bother	ENPP1	59	34
Cc1cnc(CCCC(=O)Nc2cn(Cc3ccccc3)nn2)o1	ZINC000450753270	EF	On-Demand	Anodyne	FAAH	52	35
Cc1cnc(CCCC(=O)Nc2cn(Cc3ccccc3)nn2)o1	ZINC000450753270	EF	On-Demand	Anodyne	CES1	40	32
Cc1cnc(CCCC(=O)Nc2cn(Cc3ccccc3)nn2)o1	ZINC000450753270	EF	On-Demand	Anodyne	CES1D	44	31
CCCNc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450753280	FH	On-Demand	Anodyne	PRTN3	43	32
CCCNc1ccccc1NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450753280	FH	On-Demand	Anodyne	CCR8	55	42
CC(=O)c1ccc(CN(C)[C@H](C)C(=O)NC(C)(C)C)cc1	ZINC000450753283	CF	On-Demand	Anodyne	CACNA1B	25	41
CC(=O)c1ccc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)cc1	ZINC000450753284	CF	On-Demand	Anodyne	CACNA1B	25	41
COc1ccc(CNC(=O)CCN[C@H]2CCCO[C@@H]2CC(C)C)c(OC)c1	ZINC000450753290	GF	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@H]2CCCO[C@H]2CC(C)C)c(OC)c1	ZINC000450753291	GF	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@@H]2CCCO[C@H]2CC(C)C)c(OC)c1	ZINC000450753292	GF	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@@H]2CCCO[C@@H]2CC(C)C)c(OC)c1	ZINC000450753294	GF	On-Demand	Anodyne	MTNR1A	48	36
COC(=O)CN1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450753295	EC	On-Demand	Anodyne	SLC6A1	43	32
COC(=O)CN1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450753295	EC	On-Demand	Anodyne	ERBB2	0	40
COC(=O)CN1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450753295	EC	On-Demand	Anodyne	MMP2	0	40
CC[C@@H](CC(C)C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450753298	CJ	On-Demand	Anodyne	CCR1	41	41
COC(=O)CN1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450753299	EC	On-Demand	Anodyne	SLC6A1	43	32
COC(=O)CN1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450753299	EC	On-Demand	Anodyne	ERBB2	0	40
COC(=O)CN1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450753299	EC	On-Demand	Anodyne	MMP2	0	40
CC[C@H](CC(C)C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450753304	CJ	On-Demand	Anodyne	CCR1	41	41
COCC1=CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450753306	CE	On-Demand	Anodyne	SIGMAR1	21	43
COC(=O)CN1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450753314	CD	On-Demand	Anodyne	DRD4	43	35
CCN1C[C@H](Nc2nc(-c3ccc(F)cc3)cs2)CC1=O	ZINC000450753338	DE	On-Demand	Anodyne	MAOA	15	44
CCN1C[C@H](Nc2nc(-c3ccc(F)cc3)cs2)CC1=O	ZINC000450753338	DE	On-Demand	Anodyne	MAOB	35	44
CCCNc1ccccc1NC(=O)c1cc2n(n1)CCCC2	ZINC000450753339	CG	On-Demand	Anodyne	KCNQ2	62	34
CCN1C[C@@H](Nc2nc(-c3ccc(F)cc3)cs2)CC1=O	ZINC000450753340	DE	On-Demand	Anodyne	MAOA	15	44
CCN1C[C@@H](Nc2nc(-c3ccc(F)cc3)cs2)CC1=O	ZINC000450753340	DE	On-Demand	Anodyne	MAOB	35	44
COc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1[N+](=O)[O-]	ZINC000450753347	FG	On-Demand	Bother	ANPEP	19	40
COc1ccc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1[N+](=O)[O-]	ZINC000450753347	FG	On-Demand	Bother	AADAC	0	42
COC(=O)c1cccc(CN2CCC[C@H](OCC3CC3)C2)c1Cl	ZINC000450753349	EH	On-Demand	Anodyne	SLC6A1	55	34
COC(=O)c1cccc(CN2CCC[C@@H](OCC3CC3)C2)c1Cl	ZINC000450753352	EH	On-Demand	Anodyne	SLC6A1	55	34
CCCNc1ccccc1NC(=O)CCOc1cccc(OC)c1	ZINC000450753365	EH	On-Demand	Anodyne	MTNR1A	70	51
CCCNc1ccccc1NC(=O)CCOc1cccc(OC)c1	ZINC000450753365	EH	On-Demand	Anodyne	MTNR1B	66	61
CCCNc1ccccc1NC(=O)CCOc1cccc(OC)c1	ZINC000450753365	EH	On-Demand	Anodyne	TAAR1	18	44
CCN1C[C@H](Nc2c(C#N)cnc3c(F)cc(F)cc23)CC1=O	ZINC000450753385	DE	On-Demand	Mild	MAP3K8	48	33
CCN1C[C@@H](Nc2c(C#N)cnc3c(F)cc(F)cc23)CC1=O	ZINC000450753394	DE	On-Demand	Mild	MAP3K8	48	33
COC(=O)CN1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450753397	EE	On-Demand	Anodyne	NPBWR1	45	33
O=C(NCCN1c2ccccc2NS1(=O)=O)c1cccc([C@H]2CCOC2)c1	ZINC000450753409	GE	On-Demand	Anodyne	DRD4	41	33
O=C(NCCN1c2ccccc2NS1(=O)=O)c1cccc([C@@H]2CCOC2)c1	ZINC000450753410	GE	On-Demand	Anodyne	DRD4	41	33
CN(C)c1ncn(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450753429	EE	On-Demand	Anodyne	HDAC10	33	47
CN(C)c1ncn(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450753429	EE	On-Demand	Anodyne	HDAC2	20	47
CN(C)c1ncn(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450753429	EE	On-Demand	Anodyne	HDAC3	41	47
CN(C)c1ncn(-c2cccc(NC(=O)CCCC(=O)C3CC3)c2)n1	ZINC000450753429	EE	On-Demand	Anodyne	HDAC6	31	47
COc1cc(CN2CCS(=O)(=O)c3ccccc3C2)ccc1Cl	ZINC000450753436	FG	On-Demand	Anodyne	UTS2R	19	40
COc1cc(CN2CCS(=O)(=O)c3ccccc3C2)ccc1Cl	ZINC000450753436	FG	On-Demand	Anodyne	NOX1	40	34
COc1cc(CN2CCS(=O)(=O)c3ccccc3C2)ccc1Cl	ZINC000450753436	FG	On-Demand	Anodyne	NOX5	40	34
CCOC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)nc1	ZINC000450753460	EH	On-Demand	Anodyne	SSTR5	43	40
CCOC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)nc1	ZINC000450753460	EH	On-Demand	Anodyne	MLNR	40	38
CCOC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)nc1	ZINC000450753461	EH	On-Demand	Anodyne	SSTR5	43	40
CCOC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)nc1	ZINC000450753461	EH	On-Demand	Anodyne	MLNR	40	38
Cn1nc(-c2ccccc2)cc1C(=O)N1CC(O)(CC#N)C1	ZINC000450753470	CD	On-Demand	Mild	CTSV	45	30
C=CCN(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450753472	CH	On-Demand	Mild	SHC	93	60
C=CCN(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450753472	CH	On-Demand	Mild	HDAC8	20	50
C=CCN(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450753472	CH	On-Demand	Mild	LSS	103	60
C=CCN(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450753472	CH	On-Demand	Mild	ERG7	50	54
C=CCN(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450753472	CH	On-Demand	Mild	CAS1	34	54
CO[C@H]1CCN(c2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1(C)C	ZINC000450753475	FE	On-Demand	Bother	CASP3	41	36
CO[C@H]1CCN(c2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1(C)C	ZINC000450753475	FE	On-Demand	Bother	CASP7	44	33
CO[C@@H]1CCN(c2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1(C)C	ZINC000450753478	FE	On-Demand	Bother	CASP3	41	36
CO[C@@H]1CCN(c2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1(C)C	ZINC000450753478	FE	On-Demand	Bother	CASP7	44	33
CCOC(=O)CN(CCCC(=O)c1ccccc1)C1CCC1	ZINC000450753525	DG	On-Demand	Anodyne	ACE	41	35
CCOC(=O)CN(CCCC(=O)c1ccccc1)C1CCC1	ZINC000450753525	DG	On-Demand	Anodyne	AMY2	47	32
CO[C@H]1CCN(c2nnc(C)s2)C[C@H]1C	ZINC000450753543	BD	On-Demand	Anodyne	GYRB	44	33
CO[C@H]1CCN(c2nnc(C)s2)C[C@@H]1C	ZINC000450753544	BD	On-Demand	Anodyne	GYRB	44	33
CO[C@@H]1CCN(c2nnc(C)s2)C[C@@H]1C	ZINC000450753545	BD	On-Demand	Anodyne	GYRB	44	33
CO[C@@H]1CCN(c2nnc(C)s2)C[C@H]1C	ZINC000450753546	BD	On-Demand	Anodyne	GYRB	44	33
CCOc1cc(N2CC[C@@H](OC)[C@H](C)C2)ncn1	ZINC000450753569	CD	On-Demand	Anodyne	PDE3A	43	38
CCOc1cc(N2CC[C@H](OC)[C@H](C)C2)ncn1	ZINC000450753570	CD	On-Demand	Anodyne	PDE3A	43	38
CCOc1cc(N2CC[C@H](OC)[C@@H](C)C2)ncn1	ZINC000450753571	CD	On-Demand	Anodyne	PDE3A	43	38
CCOc1cc(N2CC[C@@H](OC)[C@@H](C)C2)ncn1	ZINC000450753572	CD	On-Demand	Anodyne	PDE3A	43	38
C[C@@H](O)CCN1CCC[C@]1(C)Cc1ccccc1	ZINC000450753595	BF	On-Demand	Anodyne	SLC12A5	54	36
C[C@H](O)CCN1CCC[C@]1(C)Cc1ccccc1	ZINC000450753596	BF	On-Demand	Anodyne	SLC12A5	54	36
C[C@H](O)CCN1CCC[C@@]1(C)Cc1ccccc1	ZINC000450753597	BF	On-Demand	Anodyne	SLC12A5	54	36
C[C@@H](O)CCN1CCC[C@@]1(C)Cc1ccccc1	ZINC000450753598	BF	On-Demand	Anodyne	SLC12A5	54	36
CCNC(=O)c1ccc(N2CC[C@@H](OC)C(C)(C)C2)nc1	ZINC000450753600	CE	On-Demand	Anodyne	HDAC1	28	41
CCNC(=O)c1ccc(N2CC[C@H](OC)C(C)(C)C2)nc1	ZINC000450753601	CE	On-Demand	Anodyne	HDAC1	28	41
COC(=O)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(F)c(C)c1	ZINC000450753602	EG	On-Demand	Anodyne	LEF	44	41
COC(=O)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(F)c(C)c1	ZINC000450753603	EG	On-Demand	Anodyne	LEF	44	41
COC(=O)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(F)c(C)c1	ZINC000450753604	EG	On-Demand	Anodyne	LEF	44	41
COC(=O)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(F)c(C)c1	ZINC000450753605	EG	On-Demand	Anodyne	LEF	44	41
COC(=O)c1coc(CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450753622	EE	On-Demand	Anodyne	DRD4	25	40
COC(=O)c1coc(CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450753622	EE	On-Demand	Anodyne	DRD3	26	45
COC(=O)c1coc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450753623	EE	On-Demand	Anodyne	DRD4	25	40
COC(=O)c1coc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450753623	EE	On-Demand	Anodyne	DRD3	26	45
COC(=O)c1coc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450753624	EE	On-Demand	Anodyne	DRD4	25	40
COC(=O)c1coc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450753624	EE	On-Demand	Anodyne	DRD3	26	45
COC(=O)c1coc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450753625	EE	On-Demand	Anodyne	DRD4	25	40
COC(=O)c1coc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450753625	EE	On-Demand	Anodyne	DRD3	26	45
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](c2nc(C)no2)C1	ZINC000450753643	GG	On-Demand	Anodyne	ATP4A	19	47
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](c2nc(C)no2)C1	ZINC000450753644	GG	On-Demand	Anodyne	ATP4A	19	47
COc1ccc(CNC(=O)CCN[C@H]2CC(C)(C)OC2(C)C)c(OC)c1	ZINC000450753657	FF	On-Demand	Anodyne	MTNR1A	51	35
COc1ccc(CNC(=O)CCN[C@@H]2CC(C)(C)OC2(C)C)c(OC)c1	ZINC000450753658	FF	On-Demand	Anodyne	MTNR1A	51	35
CCCOc1ccc(C(=O)N2CCO[C@H](C3CC3)C2)c(OC)c1	ZINC000450753662	DF	On-Demand	Anodyne	OXTR	25	43
CCCOc1ccc(C(=O)N2CCO[C@@H](C3CC3)C2)c(OC)c1	ZINC000450753663	DF	On-Demand	Anodyne	OXTR	25	43
Cc1cc(N2CC[C@@H](c3cccc(Br)c3)C2)n2ncnc2n1	ZINC000450753692	FG	On-Demand	Anodyne	DHOD	0	42
Cc1cc(N2CC[C@H](c3cccc(Br)c3)C2)n2ncnc2n1	ZINC000450753693	FG	On-Demand	Anodyne	DHOD	0	42
CCc1cccc(C(=O)NCC2(C(=O)OC)CC2)n1	ZINC000450753706	CD	On-Demand	Anodyne	HCN1	49	30
CCc1cccc(C(=O)NCC2(C(=O)OC)CC2)n1	ZINC000450753706	CD	On-Demand	Anodyne	HCN4	46	30
NC(=O)c1ccc(CCC(=O)Nc2ccccc2NCC2CCCCC2)cc1	ZINC000450753708	GI	On-Demand	Anodyne	HCAR2	22	41
C=C[C@@H]1OCC[C@H]1Nc1ncnc2ccc(C)cc12	ZINC000450753712	CF	On-Demand	Mild	CD38	56	41
C/C=C\COc1cccc(CC(=O)N[C@@](CC)(C(N)=O)C(C)C)c1	ZINC000450753714	EF	On-Demand	Anodyne	PDS	70	32
C/C=C\COc1cccc(CC(=O)N[C@](CC)(C(N)=O)C(C)C)c1	ZINC000450753715	EF	On-Demand	Anodyne	PDS	70	32
COc1cc(CN2CCn3ncnc3C2)ccc1Cl	ZINC000450753719	CD	On-Demand	Anodyne	SSTR5	41	37
COc1cccc(-n2cc(C(=O)N(CCO)CC3CCCCC3)nn2)c1	ZINC000450753725	FE	On-Demand	Anodyne	DRD4	42	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCO[C@H](C2CC2)C1	ZINC000450753726	DE	On-Demand	Anodyne	RHODESAIN	0	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCO[C@@H](C2CC2)C1	ZINC000450753727	DE	On-Demand	Anodyne	RHODESAIN	0	40
COC[C@@]1(C(=O)NCC2(c3ccc(F)cc3F)CCCC2)CCOC1	ZINC000450753745	FF	On-Demand	Anodyne	ACAT	0	44
COC[C@]1(C(=O)NCC2(c3ccc(F)cc3F)CCCC2)CCOC1	ZINC000450753746	FF	On-Demand	Anodyne	ACAT	0	44
COC(=O)C1(CNC(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450753747	FD	On-Demand	Mild	TRPV4	43	34
COC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1Cl	ZINC000450753772	EH	On-Demand	Anodyne	DRD4	25	42
COC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1Cl	ZINC000450753772	EH	On-Demand	Anodyne	DRD3	0	42
COC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1Cl	ZINC000450753772	EH	On-Demand	Anodyne	OPRK1	33	40
COC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1Cl	ZINC000450753772	EH	On-Demand	Anodyne	HTR4	44	41
COC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1Cl	ZINC000450753772	EH	On-Demand	Anodyne	SIGMAR1	17	41
COC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1Cl	ZINC000450753772	EH	On-Demand	Anodyne	CCR3	37	43
COC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1Cl	ZINC000450753773	EH	On-Demand	Anodyne	DRD4	25	42
COC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1Cl	ZINC000450753773	EH	On-Demand	Anodyne	DRD3	0	42
COC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1Cl	ZINC000450753773	EH	On-Demand	Anodyne	OPRK1	33	40
COC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1Cl	ZINC000450753773	EH	On-Demand	Anodyne	HTR4	44	41
COC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1Cl	ZINC000450753773	EH	On-Demand	Anodyne	SIGMAR1	17	41
COC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1Cl	ZINC000450753773	EH	On-Demand	Anodyne	CCR3	37	43
CCOC(=O)c1ccc(CN2CCS(=O)(=O)c3ccccc3C2)nc1	ZINC000450753781	FE	On-Demand	Anodyne	NOD2	33	42
CC(=O)c1ccc(CN2CCC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450753783	DH	On-Demand	Anodyne	SIGMAR1	46	53
CC(=O)c1ccc(CN2CCC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450753783	DH	On-Demand	Anodyne	SLC18A3	36	47
CC(=O)c1ccc(CN2CCC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450753783	DH	On-Demand	Anodyne	MCHR2	66	36
CC(=O)c1ccc(CN2CCC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450753783	DH	On-Demand	Anodyne	NOD2	40	33
CC(=O)c1ccc(CN2CCC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450753786	DH	On-Demand	Anodyne	SIGMAR1	46	53
CC(=O)c1ccc(CN2CCC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450753786	DH	On-Demand	Anodyne	SLC18A3	36	47
CC(=O)c1ccc(CN2CCC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450753786	DH	On-Demand	Anodyne	MCHR2	66	36
CC(=O)c1ccc(CN2CCC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450753786	DH	On-Demand	Anodyne	NOD2	40	33
Cc1cccc(CSc2ncnc3c2ncn3C2CC2)c1	ZINC000450753788	CH	On-Demand	Anodyne	ADORA1	19	41
Cc1cccc(CSc2ncnc3c2ncn3C2CC2)c1	ZINC000450753788	CH	On-Demand	Anodyne	SLC29A1	118	66
Cc1cccc(CSc2ncnc3c2ncn3C2CC2)c1	ZINC000450753788	CH	On-Demand	Anodyne	ADORA3	41	42
Cc1cccc(CSc2ncnc3c2ncn3C2CC2)c1	ZINC000450753788	CH	On-Demand	Anodyne	AK	0	66
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccccc1	ZINC000450753793	DH	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccccc1	ZINC000450753793	DH	On-Demand	Anodyne	HTR2A	22	47
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccccc1	ZINC000450753793	DH	On-Demand	Anodyne	SLC6A1	172	46
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccccc1	ZINC000450753793	DH	On-Demand	Anodyne	HTR7	21	43
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccccc1	ZINC000450753793	DH	On-Demand	Anodyne	SIGMAR1	24	57
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccccc1	ZINC000450753793	DH	On-Demand	Anodyne	PREP	18	42
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccccc1	ZINC000450753793	DH	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccccc1	ZINC000450753794	DH	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccccc1	ZINC000450753794	DH	On-Demand	Anodyne	HTR2A	22	47
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccccc1	ZINC000450753794	DH	On-Demand	Anodyne	SLC6A1	172	46
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccccc1	ZINC000450753794	DH	On-Demand	Anodyne	HTR7	21	43
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccccc1	ZINC000450753794	DH	On-Demand	Anodyne	SIGMAR1	24	57
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccccc1	ZINC000450753794	DH	On-Demand	Anodyne	PREP	18	42
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccccc1	ZINC000450753794	DH	On-Demand	Anodyne	CYP2J2	59	42
CC(C)N1CCCC[C@@H]1CN1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450753822	EH	On-Demand	Anodyne	SIGMAR1	19	46
CC(C)N1CCCC[C@H]1CN1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450753823	EH	On-Demand	Anodyne	SIGMAR1	19	46
CC(C)N1CCCC[C@H]1CN1CCC[C@]2(C1)OCc1ccccc12	ZINC000450753825	EH	On-Demand	Anodyne	SIGMAR1	19	46
CC(C)N1CCCC[C@@H]1CN1CCC[C@]2(C1)OCc1ccccc12	ZINC000450753826	EH	On-Demand	Anodyne	SIGMAR1	19	46
COC(=O)c1coc(CN[C@@H](C)C2(c3ccccc3)CCCC2)n1	ZINC000450753833	EG	On-Demand	Anodyne	NPPA	45	38
COC(=O)c1coc(CN[C@H](C)C2(c3ccccc3)CCCC2)n1	ZINC000450753834	EG	On-Demand	Anodyne	NPPA	45	38
O=C1NCCN(C(=O)[C@@H]2CCCCC2(F)F)[C@H]1c1ccccc1C(F)(F)F	ZINC000450753847	GH	On-Demand	Anodyne	RBP4	61	37
O=C1NCCN(C(=O)[C@H]2CCCCC2(F)F)[C@H]1c1ccccc1C(F)(F)F	ZINC000450753848	GH	On-Demand	Anodyne	RBP4	61	37
FC(F)(F)Cn1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450753850	EG	On-Demand	Anodyne	SIGMAR1	23	47
FC(F)(F)Cn1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450753850	EG	On-Demand	Anodyne	SLC18A3	23	45
O=C1NCCN(C(=O)[C@@H]2CCCCC2(F)F)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450753851	GH	On-Demand	Anodyne	RBP4	61	37
O=C1NCCN(C(=O)[C@H]2CCCCC2(F)F)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450753852	GH	On-Demand	Anodyne	RBP4	61	37
FC(F)(F)Cn1ccc(CN2CC[C@]3(C2)OCc2ccccc23)n1	ZINC000450753853	EG	On-Demand	Anodyne	SIGMAR1	23	47
FC(F)(F)Cn1ccc(CN2CC[C@]3(C2)OCc2ccccc23)n1	ZINC000450753853	EG	On-Demand	Anodyne	SLC18A3	23	45
COC(=O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450753867	GD	On-Demand	Mild	HTR1D	15	45
COC(=O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450753867	GD	On-Demand	Mild	HTR1B	19	45
COC(=O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450753867	GD	On-Demand	Mild	GPR183	0	40
COC(=O)c1ccc(CN(C)[C@H](C)C(=O)NC(C)(C)C)cc1Cl	ZINC000450753868	EF	On-Demand	Anodyne	CACNA1B	23	40
COC(=O)c1ccc(CN(C)[C@H](C)C(=O)NC(C)(C)C)cc1Cl	ZINC000450753868	EF	On-Demand	Anodyne	CAN2	0	42
COC(=O)c1ccc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)cc1Cl	ZINC000450753869	EF	On-Demand	Anodyne	CACNA1B	23	40
COC(=O)c1ccc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)cc1Cl	ZINC000450753869	EF	On-Demand	Anodyne	CAN2	0	42
COCC[C@@H]1CCCCN(CCN(C)Cc2ccccc2)C1	ZINC000450753871	DG	On-Demand	Anodyne	SIGMAR1	24	41
COCC[C@H]1CCCCN(CCN(C)Cc2ccccc2)C1	ZINC000450753873	DG	On-Demand	Anodyne	SIGMAR1	24	41
CCO[C@H]1COCC[C@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450753894	EE	On-Demand	Anodyne	SSTR3	17	40
CCO[C@H]1COCC[C@@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450753895	EE	On-Demand	Anodyne	SSTR3	17	40
CCO[C@@H]1COCC[C@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450753896	EE	On-Demand	Anodyne	SSTR3	17	40
CCO[C@@H]1COCC[C@@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450753897	EE	On-Demand	Anodyne	SSTR3	17	40
CCN1C[C@H](Nc2ccc([N+](=O)[O-])cc2S(N)(=O)=O)CC1=O	ZINC000450753919	EC	On-Demand	Bother	TBXA2R	22	44
CCN1C[C@@H](Nc2ccc([N+](=O)[O-])cc2S(N)(=O)=O)CC1=O	ZINC000450753920	EC	On-Demand	Bother	TBXA2R	22	44
C[C@@H](O)CCN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753924	CF	On-Demand	Anodyne	SIGMAR1	24	42
C[C@@H](O)CCN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753924	CF	On-Demand	Anodyne	CCR5	38	48
C[C@@H](O)CCN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753924	CF	On-Demand	Anodyne	ABCC1	42	33
C[C@@H](O)CCN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753924	CF	On-Demand	Anodyne	O19067_PIG	0	48
C[C@H](O)CCN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753925	CF	On-Demand	Anodyne	SIGMAR1	24	42
C[C@H](O)CCN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753925	CF	On-Demand	Anodyne	CCR5	38	48
C[C@H](O)CCN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753925	CF	On-Demand	Anodyne	ABCC1	42	33
C[C@H](O)CCN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753925	CF	On-Demand	Anodyne	O19067_PIG	0	48
CN1CCc2ccc(C(=O)NCCN3c4ccccc4NS3(=O)=O)cc21	ZINC000450753926	FD	On-Demand	Anodyne	DRD2	15	42
CN1CCc2ccc(C(=O)NCCN3c4ccccc4NS3(=O)=O)cc21	ZINC000450753926	FD	On-Demand	Anodyne	DRD4	46	38
CN1CCc2ccc(C(=O)NCCN3c4ccccc4NS3(=O)=O)cc21	ZINC000450753926	FD	On-Demand	Anodyne	PLD1	40	34
CN1CCc2ccc(C(=O)NCCN3c4ccccc4NS3(=O)=O)cc21	ZINC000450753926	FD	On-Demand	Anodyne	PLD2	54	34
CC(C)(C)[C@@H](CO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450753930	EG	On-Demand	Anodyne	MC3R	26	42
CC(C)(C)[C@@H](CO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450753930	EG	On-Demand	Anodyne	MC5R	0	42
CC(C)(C)[C@@H](CO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450753931	EG	On-Demand	Anodyne	MC3R	26	42
CC(C)(C)[C@@H](CO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450753931	EG	On-Demand	Anodyne	MC5R	0	42
CC(C)(C)[C@@H](CO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450753932	EG	On-Demand	Anodyne	MC3R	26	42
CC(C)(C)[C@@H](CO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450753932	EG	On-Demand	Anodyne	MC5R	0	42
CC(C)(C)[C@@H](CO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450753933	EG	On-Demand	Anodyne	MC3R	26	42
CC(C)(C)[C@@H](CO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450753933	EG	On-Demand	Anodyne	MC5R	0	42
C[C@@H](Sc1n[nH]c(=NCCc2cccs2)s1)C(=O)Nc1nccs1	ZINC000450753957	GG	On-Demand	Anodyne	MAP1	91	37
C[C@H](Sc1n[nH]c(=NCCc2cccs2)s1)C(=O)Nc1nccs1	ZINC000450753958	GG	On-Demand	Anodyne	MAP1	91	37
COCCOC[C@@H](O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753986	EE	On-Demand	Anodyne	O19067_PIG	0	45
COCCOC[C@@H](O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753986	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
COCCOC[C@H](O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753987	EE	On-Demand	Anodyne	O19067_PIG	0	45
COCCOC[C@H](O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450753987	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Fc1ccc(CC2CCN(CCc3cscn3)CC2)cc1F	ZINC000450754003	DH	On-Demand	Anodyne	ABCC1	101	41
Fc1ccc(CC2CCN(CCc3cscn3)CC2)cc1F	ZINC000450754003	DH	On-Demand	Anodyne	SCN5A	43	36
Fc1ccc(CC2CCN(CCc3cscn3)CC2)cc1F	ZINC000450754003	DH	On-Demand	Anodyne	ABCB1A	48	35
CCC[C@H](O)CN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450754008	CF	On-Demand	Anodyne	VACHT_TETCF	0	41
CCC[C@H](O)CN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450754008	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@@H](O)CN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450754009	CF	On-Demand	Anodyne	VACHT_TETCF	0	41
CCC[C@@H](O)CN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450754009	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@H](O)CN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450754010	CF	On-Demand	Anodyne	VACHT_TETCF	0	41
CCC[C@H](O)CN1CC[C@H](c2c(F)cccc2F)C1	ZINC000450754010	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@@H](O)CN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450754011	CF	On-Demand	Anodyne	VACHT_TETCF	0	41
CCC[C@@H](O)CN1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450754011	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
Cn1c(SCC(=O)CC[C@H]2CCCCO2)nnc1-c1cccs1	ZINC000450754014	FH	On-Demand	Anodyne	PDE8B	15	41
Cn1c(SCC(=O)CC[C@@H]2CCCCO2)nnc1-c1cccs1	ZINC000450754015	FH	On-Demand	Anodyne	PDE8B	15	41
CC(C)CN(CC1CC(F)(F)C1)[C@H]1CCCc2cccnc21	ZINC000450754048	DI	On-Demand	Anodyne	CXCR4	88	49
CC(C)CN(CC1CC(F)(F)C1)[C@@H]1CCCc2cccnc21	ZINC000450754049	DI	On-Demand	Anodyne	CXCR4	88	49
CO[C@H]1CCN(c2ccnc3cc(F)ccc23)CC1(C)C	ZINC000450754067	CH	On-Demand	Anodyne	PDE3A	40	32
CO[C@H]1CCN(c2ccnc3cc(F)ccc23)CC1(C)C	ZINC000450754067	CH	On-Demand	Anodyne	PDE3B	58	32
CO[C@@H]1CCN(c2ccnc3cc(F)ccc23)CC1(C)C	ZINC000450754068	CH	On-Demand	Anodyne	PDE3A	40	32
CO[C@@H]1CCN(c2ccnc3cc(F)ccc23)CC1(C)C	ZINC000450754068	CH	On-Demand	Anodyne	PDE3B	58	32
COc1cc2c(N3CC[C@H](OC)[C@@H](C)C3)ncnc2cc1F	ZINC000450754080	DF	On-Demand	Anodyne	PDE3A	69	52
COc1cc2c(N3CC[C@H](OC)[C@@H](C)C3)ncnc2cc1F	ZINC000450754080	DF	On-Demand	Anodyne	PDGFRB	61	40
COc1cc2c(N3CC[C@H](OC)[C@@H](C)C3)ncnc2cc1F	ZINC000450754080	DF	On-Demand	Anodyne	PDE3B	102	52
COc1cc2c(N3CC[C@@H](OC)[C@@H](C)C3)ncnc2cc1F	ZINC000450754081	DF	On-Demand	Anodyne	PDE3A	69	52
COc1cc2c(N3CC[C@@H](OC)[C@@H](C)C3)ncnc2cc1F	ZINC000450754081	DF	On-Demand	Anodyne	PDGFRB	61	40
COc1cc2c(N3CC[C@@H](OC)[C@@H](C)C3)ncnc2cc1F	ZINC000450754081	DF	On-Demand	Anodyne	PDE3B	102	52
COc1cc2c(N3CC[C@@H](OC)[C@H](C)C3)ncnc2cc1F	ZINC000450754082	DF	On-Demand	Anodyne	PDE3A	69	52
COc1cc2c(N3CC[C@@H](OC)[C@H](C)C3)ncnc2cc1F	ZINC000450754082	DF	On-Demand	Anodyne	PDGFRB	61	40
COc1cc2c(N3CC[C@@H](OC)[C@H](C)C3)ncnc2cc1F	ZINC000450754082	DF	On-Demand	Anodyne	PDE3B	102	52
COc1cc(CN2CCc3nnc(O)cc3C2)ccc1Cl	ZINC000450754083	DE	On-Demand	Anodyne	SSTR5	42	36
COc1cc(CN2CCc3nnc(O)cc3C2)ccc1Cl	ZINC000450754083	DE	On-Demand	Anodyne	ABCB1	22	52
COc1cc2c(N3CC[C@H](OC)[C@H](C)C3)ncnc2cc1F	ZINC000450754084	DF	On-Demand	Anodyne	PDE3A	69	52
COc1cc2c(N3CC[C@H](OC)[C@H](C)C3)ncnc2cc1F	ZINC000450754084	DF	On-Demand	Anodyne	PDGFRB	61	40
COc1cc2c(N3CC[C@H](OC)[C@H](C)C3)ncnc2cc1F	ZINC000450754084	DF	On-Demand	Anodyne	PDE3B	102	52
CC(=O)c1c(F)cccc1N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000450754099	EI	On-Demand	Bother	SLC27A4	43	33
CC(=O)c1c(F)cccc1N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000450754105	EI	On-Demand	Bother	SLC27A4	43	33
N#Cc1ccnc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1	ZINC000450754112	DG	On-Demand	Mild	MAP3K12	46	32
N#Cc1ccnc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1	ZINC000450754113	DG	On-Demand	Mild	MAP3K12	46	32
COC(=O)[C@@H](NCc1cccc(C)n1)c1ccc(F)c(C)c1	ZINC000450754122	DF	On-Demand	Anodyne	LEF	59	37
COC(=O)[C@H](NCc1cccc(C)n1)c1ccc(F)c(C)c1	ZINC000450754127	DF	On-Demand	Anodyne	LEF	59	37
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450754132	FI	On-Demand	Anodyne	MTTP	57	34
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450754132	FI	On-Demand	Anodyne	CAPN2	45	34
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450754134	FI	On-Demand	Anodyne	MTTP	57	34
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450754134	FI	On-Demand	Anodyne	CAPN2	45	34
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450754136	FI	On-Demand	Anodyne	MTTP	57	34
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450754136	FI	On-Demand	Anodyne	CAPN2	45	34
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450754138	FI	On-Demand	Anodyne	MTTP	57	34
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450754138	FI	On-Demand	Anodyne	CAPN2	45	34
Cc1ccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c2c1CCC2	ZINC000450754140	GG	On-Demand	Anodyne	SCD1	23	42
Cc1ccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c2c1CCC2	ZINC000450754140	GG	On-Demand	Anodyne	SCD	22	42
COc1cc(OC)c2ncnc(N[C@H](C3CC3)[C@@H](CO)C3CC3)c2c1	ZINC000450754155	EF	On-Demand	Anodyne	PDE6A	41	32
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	DRD2	18	45
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	DRD4	27	44
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	DRD3	17	45
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	LTA4H	21	48
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	SIGMAR1	55	43
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	CCR3	46	44
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	CCR5	36	49
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	MTNR1A	27	44
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	MTNR1B	18	44
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	SLC6A5	26	40
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	MCHR1	28	43
CNC(=O)N[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754157	CD	On-Demand	Anodyne	BIRC2	83	41
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	DRD2	18	45
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	DRD4	27	44
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	DRD3	17	45
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	LTA4H	21	48
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	SIGMAR1	55	43
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	CCR3	46	44
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	CCR5	36	49
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	MTNR1A	27	44
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	MTNR1B	18	44
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	SLC6A5	26	40
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	MCHR1	28	43
CNC(=O)N[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450754158	CD	On-Demand	Anodyne	BIRC2	83	41
COc1cc(OC)c2ncnc(N3CC[C@@H](OC)[C@H](C)C3)c2c1	ZINC000450754162	DF	On-Demand	Anodyne	PDE3A	61	48
COc1cc(OC)c2ncnc(N3CC[C@@H](OC)[C@H](C)C3)c2c1	ZINC000450754162	DF	On-Demand	Anodyne	PDE3B	89	48
COc1cc(OC)c2ncnc(N3CC[C@H](OC)[C@@H](C)C3)c2c1	ZINC000450754163	DF	On-Demand	Anodyne	PDE3A	61	48
COc1cc(OC)c2ncnc(N3CC[C@H](OC)[C@@H](C)C3)c2c1	ZINC000450754163	DF	On-Demand	Anodyne	PDE3B	89	48
COc1cc(OC)c2ncnc(N[C@H](C3CC3)[C@H](CO)C3CC3)c2c1	ZINC000450754164	EF	On-Demand	Anodyne	PDE6A	41	32
COc1cc(OC)c2ncnc(N3CC[C@H](OC)[C@H](C)C3)c2c1	ZINC000450754165	DF	On-Demand	Anodyne	PDE3A	61	48
COc1cc(OC)c2ncnc(N3CC[C@H](OC)[C@H](C)C3)c2c1	ZINC000450754165	DF	On-Demand	Anodyne	PDE3B	89	48
COc1cc(OC)c2ncnc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)c2c1	ZINC000450754166	EF	On-Demand	Anodyne	PDE6A	41	32
COc1cc(OC)c2ncnc(N3CC[C@@H](OC)[C@@H](C)C3)c2c1	ZINC000450754167	DF	On-Demand	Anodyne	PDE3A	61	48
COc1cc(OC)c2ncnc(N3CC[C@@H](OC)[C@@H](C)C3)c2c1	ZINC000450754167	DF	On-Demand	Anodyne	PDE3B	89	48
COc1cc(OC)c2ncnc(N[C@@H](C3CC3)[C@H](CO)C3CC3)c2c1	ZINC000450754168	EF	On-Demand	Anodyne	PDE6A	41	32
COCCC1(CNC(=O)c2cccc(C(F)(F)F)n2)CCCCC1	ZINC000450754201	EH	On-Demand	Anodyne	HCN1	53	32
COCCC1(CNC(=O)c2cccc(C(F)(F)F)n2)CCCCC1	ZINC000450754201	EH	On-Demand	Anodyne	HCN4	51	32
COc1ccc(CN2CCCN(C[C@@](C)(O)C(C)=O)CC2=O)cc1	ZINC000450754202	ED	On-Demand	Anodyne	PROKR1	43	31
COc1ccc(CN2CCCN(C[C@](C)(O)C(C)=O)CC2=O)cc1	ZINC000450754203	ED	On-Demand	Anodyne	PROKR1	43	31
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450754214	FH	On-Demand	Anodyne	GHRHR	40	35
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450754214	FH	On-Demand	Anodyne	SLC12A5	45	35
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450754215	FH	On-Demand	Anodyne	GHRHR	40	35
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450754215	FH	On-Demand	Anodyne	SLC12A5	45	35
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450754216	FH	On-Demand	Anodyne	GHRHR	40	35
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450754216	FH	On-Demand	Anodyne	SLC12A5	45	35
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450754217	FH	On-Demand	Anodyne	GHRHR	40	35
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450754217	FH	On-Demand	Anodyne	SLC12A5	45	35
COC(=O)c1cnc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450754220	EF	On-Demand	Bother	SLC27A4	52	35
COC(=O)c1cnc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450754221	EF	On-Demand	Bother	SLC27A4	52	35
COC(=O)C1(CNC(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450754231	CD	On-Demand	Anodyne	CAN2	0	42
CCCc1cc(C(=O)N2CCC(c3ccsc3)CC2)no1	ZINC000450754234	DH	On-Demand	Anodyne	ETHR	40	33
COC(=O)c1cccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c1Cl	ZINC000450754262	GH	On-Demand	Anodyne	SIGMAR1	21	44
COC(=O)c1cccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c1Cl	ZINC000450754262	GH	On-Demand	Anodyne	NPFFR1	43	34
O=C(CS(=O)(=O)C1CC1)Nc1ccccc1NCC1CCCCC1	ZINC000450754269	FG	On-Demand	Anodyne	NPY2R	45	36
CC(=O)c1ccc(CSc2nnc(N3CCCC3)n2Cc2ccco2)cc1	ZINC000450754274	GI	On-Demand	Anodyne	HCRTR2	20	43
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1Cl	ZINC000450754305	GH	On-Demand	Anodyne	SIGMAR1	35	45
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1Cl	ZINC000450754305	GH	On-Demand	Anodyne	CCR3	36	40
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1Cl	ZINC000450754305	GH	On-Demand	Anodyne	MCHR2	53	39
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1Cl	ZINC000450754305	GH	On-Demand	Anodyne	CACNA1G	34	40
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1Cl	ZINC000450754305	GH	On-Demand	Anodyne	NPFFR1	42	39
O=C(Cc1ccccc1O[C@H]1CCOC1)N(CCO)CC1CCCCC1	ZINC000450754307	FF	On-Demand	Anodyne	PDEC	0	43
O=C(Cc1ccccc1O[C@@H]1CCOC1)N(CCO)CC1CCCCC1	ZINC000450754308	FF	On-Demand	Anodyne	PDEC	0	43
CCOc1cc2nccc(N3CC[C@H](c4nc(C)no4)C3)c2cc1OCC	ZINC000450754333	FH	On-Demand	Anodyne	PDE3A	46	41
CCOc1cc2nccc(N3CC[C@H](c4nc(C)no4)C3)c2cc1OCC	ZINC000450754333	FH	On-Demand	Anodyne	PDE3B	68	41
CCOc1cc2nccc(N3CC[C@@H](c4nc(C)no4)C3)c2cc1OCC	ZINC000450754337	FH	On-Demand	Anodyne	PDE3A	46	41
CCOc1cc2nccc(N3CC[C@@H](c4nc(C)no4)C3)c2cc1OCC	ZINC000450754337	FH	On-Demand	Anodyne	PDE3B	68	41
CCNC(=O)c1ccc(N2C[C@H]3CCCC[C@H]3C2)nn1	ZINC000450754338	CD	On-Demand	Anodyne	SCD	24	44
C=C[C@@H]1OCC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450754339	DF	On-Demand	Mild	MAOB	24	49
COc1cc(CC(=O)N2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450754345	DF	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450754345	DF	On-Demand	Anodyne	OPRK1	43	41
COc1cc(CC(=O)N2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450754347	DF	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450754347	DF	On-Demand	Anodyne	OPRK1	43	41
C[C@@H](CN1CCC[C@@]2(C1)OCc1ccccc12)S(C)(=O)=O	ZINC000450754357	DD	On-Demand	Anodyne	SIGMAR1	19	40
C[C@H](CN1CCC[C@@]2(C1)OCc1ccccc12)S(C)(=O)=O	ZINC000450754358	DD	On-Demand	Anodyne	SIGMAR1	19	40
C[C@H](CN1CCC[C@]2(C1)OCc1ccccc12)S(C)(=O)=O	ZINC000450754359	DD	On-Demand	Anodyne	SIGMAR1	19	40
C[C@@H](CN1CCC[C@]2(C1)OCc1ccccc12)S(C)(=O)=O	ZINC000450754360	DD	On-Demand	Anodyne	SIGMAR1	19	40
COCC1=CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450754366	CF	On-Demand	Anodyne	DRD4	0	41
COCC1=CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450754366	CF	On-Demand	Anodyne	CHRM5	28	41
COCC1=CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450754366	CF	On-Demand	Anodyne	HTR5A	23	50
COCC1=CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450754366	CF	On-Demand	Anodyne	CYP2J2	59	43
O=C(NCC1(c2ccc(F)cc2F)CCCC1)c1ccn(CCn2cccn2)n1	ZINC000450754367	GG	On-Demand	Anodyne	HCN1	52	33
O=C(NCC1(c2ccc(F)cc2F)CCCC1)c1ccn(CCn2cccn2)n1	ZINC000450754367	GG	On-Demand	Anodyne	HCN4	48	31
c1ccc2c(c1)CO[C@]21CCCN(CCc2cscn2)C1	ZINC000450754374	DG	On-Demand	Anodyne	SIGMAR1	15	41
COc1cc(CC(=O)NC(C)(C)C(C)(C)CO)ccc1Cl	ZINC000450754378	DF	On-Demand	Anodyne	TRPV1	35	45
COc1cc(CC(=O)NC(C)(C)C(C)(C)CO)ccc1Cl	ZINC000450754378	DF	On-Demand	Anodyne	NCE103	29	47
COc1cc(CC(=O)NC(C)(C)C(C)(C)CO)ccc1Cl	ZINC000450754378	DF	On-Demand	Anodyne	CAN2	0	47
c1ccc2c(c1)CO[C@@]21CCCN(CCc2cscn2)C1	ZINC000450754380	DG	On-Demand	Anodyne	SIGMAR1	15	41
CC1(O)CC(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)C1	ZINC000450754391	FD	On-Demand	Anodyne	RBP4	78	40
CC1(O)CC(C(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450754393	FD	On-Demand	Anodyne	RBP4	78	40
CCCNc1ccccc1NC(=O)c1cccc(CC)n1	ZINC000450754401	CH	On-Demand	Anodyne	PDE5A	28	47
CC[C@@](NC(=O)c1coc(-c2ccnc(C)c2)n1)(C(N)=O)C(C)C	ZINC000450754403	EE	On-Demand	Anodyne	IRAK4	21	42
CC[C@](NC(=O)c1coc(-c2ccnc(C)c2)n1)(C(N)=O)C(C)C	ZINC000450754412	EE	On-Demand	Anodyne	IRAK4	21	42
COC(=O)CN1CCN(C(=O)c2ocnc2-c2ccccc2)CC1	ZINC000450754442	ED	On-Demand	Anodyne	SMO	24	40
Cc1ccnc(OC2CCN(C(=O)c3ccc(C)nc3C(C)C)CC2)c1	ZINC000450754446	FH	On-Demand	Anodyne	HCRTR1	25	42
Cc1ccnc(OC2CCN(C(=O)c3ccc(C)nc3C(C)C)CC2)c1	ZINC000450754446	FH	On-Demand	Anodyne	HCRTR2	26	42
CNS(=O)(=O)NCC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000450754460	DB	On-Demand	Bother	ENPP1	55	32
COC(=O)CN1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450754462	DD	On-Demand	Anodyne	DRD2	31	43
COC(=O)CN1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450754462	DD	On-Demand	Anodyne	DRD3	28	41
COC(=O)CN1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450754462	DD	On-Demand	Anodyne	HTR4	52	34
COC(=O)CN1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450754462	DD	On-Demand	Anodyne	SIGMAR1	29	40
COC(=O)CN1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450754462	DD	On-Demand	Anodyne	CCR3	22	43
COC(=O)CN1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450754462	DD	On-Demand	Anodyne	MCHR1	30	46
COC(=O)CN1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450754462	DD	On-Demand	Anodyne	CACNA1G	24	40
CC(C)CCCC(=O)Nc1cccc(-n2cnc(N(C)C)n2)c1	ZINC000450754463	DG	On-Demand	Anodyne	HDAC3	37	41
CC[C@@H](O)CC(=O)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000450754466	CD	On-Demand	Anodyne	UTS2	46	38
CC[C@H](O)CC(=O)N[C@H](CO)c1ccc(Cl)cc1	ZINC000450754467	CD	On-Demand	Anodyne	UTS2	46	38
CC[C@H](O)CC(=O)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000450754468	CD	On-Demand	Anodyne	UTS2	46	38
CC[C@@H](O)CC(=O)N[C@H](CO)c1ccc(Cl)cc1	ZINC000450754469	CD	On-Demand	Anodyne	UTS2	46	38
COC(=O)CN1CCN(C(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450754472	FC	On-Demand	Anodyne	THYX_PBCV1	0	42
CCCOc1cccc(CN2CCN(CC(=O)OC)CC2)c1	ZINC000450754477	DD	On-Demand	Anodyne	DRD4	41	31
CCCOc1cccc(CN2CCN(CC(=O)OC)CC2)c1	ZINC000450754477	DD	On-Demand	Anodyne	HRH2	58	53
CCCOc1cccc(CN2CCN(CC(=O)OC)CC2)c1	ZINC000450754477	DD	On-Demand	Anodyne	FAAH	33	45
CCCOc1cccc(CN2CCN(CC(=O)OC)CC2)c1	ZINC000450754477	DD	On-Demand	Anodyne	CCR8	28	42
COC(=O)CN1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450754490	CD	On-Demand	Anodyne	DRD4	43	38
COC(=O)C1(CN2CC[C@@]3(C2)OCc2ccccc23)CC1	ZINC000450754498	CE	On-Demand	Anodyne	SLC18A3	34	45
COC(=O)C1(CN2CC[C@]3(C2)OCc2ccccc23)CC1	ZINC000450754501	CE	On-Demand	Anodyne	SLC18A3	34	45
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1[N+](=O)[O-]	ZINC000450754504	EE	On-Demand	Bother	ENPP1	48	31
COCCOC[C@@H](O)CN1CCC(c2c(F)cccc2F)CC1	ZINC000450754506	EE	On-Demand	Anodyne	VACHT_TETCF	0	40
COCCOC[C@@H](O)CN1CCC(c2c(F)cccc2F)CC1	ZINC000450754506	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
COCCOC[C@H](O)CN1CCC(c2c(F)cccc2F)CC1	ZINC000450754508	EE	On-Demand	Anodyne	VACHT_TETCF	0	40
COCCOC[C@H](O)CN1CCC(c2c(F)cccc2F)CC1	ZINC000450754508	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCCOc1ccc(C(=O)Nc2cccc(-n3cnc(N(C)C)n3)c2)c(OC)c1	ZINC000450754512	GG	On-Demand	Anodyne	KCNK3	54	42
CCCOc1ccc(C(=O)Nc2cccc(-n3cnc(N(C)C)n3)c2)c(OC)c1	ZINC000450754512	GG	On-Demand	Anodyne	KCNK9	49	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(CC#N)C2)cc1	ZINC000450754528	GD	On-Demand	Mild	TRY2_BOVIN	48	34
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(CC#N)C2)cc1	ZINC000450754528	GD	On-Demand	Mild	MMP2	17	43
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)C(=O)NC(C)(C)C)cc1	ZINC000450754534	EE	On-Demand	Anodyne	COLA	62	34
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)cc1	ZINC000450754535	EE	On-Demand	Anodyne	COLA	62	34
CC(C)c1nnc(CN2CC[C@@]3(C2)OCc2ccccc23)s1	ZINC000450754542	DG	On-Demand	Anodyne	SIGMAR1	25	50
CC(C)c1nnc(CN2CC[C@]3(C2)OCc2ccccc23)s1	ZINC000450754543	DG	On-Demand	Anodyne	SIGMAR1	25	50
Cc1noc([C@@H]2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])C2)n1	ZINC000450754574	FE	On-Demand	Bother	MAPK13	50	38
Cc1noc([C@H]2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])C2)n1	ZINC000450754575	FE	On-Demand	Bother	MAPK13	50	38
CCC1(CC)CN(CCC(=O)NCc2ccc(OC)cc2OC)CC[S@]1=O	ZINC000450754589	GE	On-Demand	Anodyne	MTNR1A	50	40
CCC1(CC)CN(CCC(=O)NCc2ccc(OC)cc2OC)CC[S@]1=O	ZINC000450754589	GE	On-Demand	Anodyne	MTNR1B	42	40
CCC1(CC)CN(CCC(=O)NCc2ccc(OC)cc2OC)CC[S@@]1=O	ZINC000450754590	GE	On-Demand	Anodyne	MTNR1A	50	40
CCC1(CC)CN(CCC(=O)NCc2ccc(OC)cc2OC)CC[S@@]1=O	ZINC000450754590	GE	On-Demand	Anodyne	MTNR1B	42	40
Cc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2ccncc2)cc1	ZINC000450754591	FJ	On-Demand	Anodyne	WNT3A	19	42
CO[C@H]1CCN(c2nccc3ccc(F)cc23)CC1(C)C	ZINC000450754599	CH	On-Demand	Anodyne	PDE3B	46	32
CO[C@@H]1CCN(c2nccc3ccc(F)cc23)CC1(C)C	ZINC000450754600	CH	On-Demand	Anodyne	PDE3B	46	32
COc1cccc([C@@H]2C[C@H]2C(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)c1	ZINC000450754608	GF	On-Demand	Anodyne	DRD4	41	32
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450754652	GH	On-Demand	Anodyne	NR1H4	15	48
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450754652	GH	On-Demand	Anodyne	KCNK3	60	43
CC[C@@H](O)CC(=O)Nc1cccc(CCCO)c1	ZINC000450754657	CD	On-Demand	Anodyne	SLC1A2	49	34
CC[C@H](O)CC(=O)Nc1cccc(CCCO)c1	ZINC000450754659	CD	On-Demand	Anodyne	SLC1A2	49	34
CC(=O)CCCCCSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450754713	FI	On-Demand	Anodyne	TACR3	41	38
CC(=O)CCCCCSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450754713	FI	On-Demand	Anodyne	TNKS	77	42
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCCCC2)C[C@H]1C	ZINC000450754734	EG	On-Demand	Anodyne	PDE3B	54	36
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCCCC2)C[C@@H]1C	ZINC000450754735	EG	On-Demand	Anodyne	PDE3B	54	36
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCCCC2)C[C@H]1C	ZINC000450754736	EG	On-Demand	Anodyne	PDE3B	54	36
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCCCC2)C[C@@H]1C	ZINC000450754737	EG	On-Demand	Anodyne	PDE3B	54	36
COCCC1(CNC(=O)[C@@H]2Cc3cccc(C)c3O2)CCCCC1	ZINC000450754750	EG	On-Demand	Anodyne	HCN1	48	29
COCCC1(CNC(=O)[C@@H]2Cc3cccc(C)c3O2)CCCCC1	ZINC000450754750	EG	On-Demand	Anodyne	HCN4	47	29
COCCC1(CNC(=O)[C@H]2Cc3cccc(C)c3O2)CCCCC1	ZINC000450754751	EG	On-Demand	Anodyne	HCN1	48	29
COCCC1(CNC(=O)[C@H]2Cc3cccc(C)c3O2)CCCCC1	ZINC000450754751	EG	On-Demand	Anodyne	HCN4	47	29
CO[C@@H]1CCN(c2ncncc2Cl)C[C@H]1C	ZINC000450754753	BD	On-Demand	Anodyne	PDE3A	43	37
CO[C@@H]1CCN(c2ncncc2Cl)C[C@H]1C	ZINC000450754753	BD	On-Demand	Anodyne	PDE3B	64	37
CO[C@H]1CCN(c2ncncc2Cl)C[C@H]1C	ZINC000450754754	BD	On-Demand	Anodyne	PDE3A	43	37
CO[C@H]1CCN(c2ncncc2Cl)C[C@H]1C	ZINC000450754754	BD	On-Demand	Anodyne	PDE3B	64	37
CO[C@@H]1CCN(c2ncncc2Cl)C[C@@H]1C	ZINC000450754755	BD	On-Demand	Anodyne	PDE3A	43	37
CO[C@@H]1CCN(c2ncncc2Cl)C[C@@H]1C	ZINC000450754755	BD	On-Demand	Anodyne	PDE3B	64	37
CO[C@H]1CCN(c2ncncc2Cl)C[C@@H]1C	ZINC000450754756	BD	On-Demand	Anodyne	PDE3A	43	37
CO[C@H]1CCN(c2ncncc2Cl)C[C@@H]1C	ZINC000450754756	BD	On-Demand	Anodyne	PDE3B	64	37
C[C@@H](O)CCN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450754758	CG	On-Demand	Anodyne	SLC6A3	24	40
C[C@@H](O)CCN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450754758	CG	On-Demand	Anodyne	CCR5	25	40
C[C@H](O)CCN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450754759	CG	On-Demand	Anodyne	SLC6A3	24	40
C[C@H](O)CCN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450754759	CG	On-Demand	Anodyne	CCR5	25	40
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	ZINC000450754760	GD	On-Demand	Anodyne	GCK	51	31
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	ZINC000450754760	GD	On-Demand	Anodyne	GCKR	75	34
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	ZINC000450754761	GD	On-Demand	Anodyne	GCK	51	31
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	ZINC000450754761	GD	On-Demand	Anodyne	GCKR	75	34
CC(C)[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](CO)C(C)C	ZINC000450754763	GD	On-Demand	Anodyne	GCK	51	31
CC(C)[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](CO)C(C)C	ZINC000450754763	GD	On-Demand	Anodyne	GCKR	75	34
CC(C)[C@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	ZINC000450754765	GD	On-Demand	Anodyne	GCK	51	31
CC(C)[C@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(C)C	ZINC000450754765	GD	On-Demand	Anodyne	GCKR	75	34
COCCC1(CNC(=O)[C@@H]2CCCN(C)C2=O)CCCCC1	ZINC000450754793	DD	On-Demand	Anodyne	HCN4	49	32
COCCC1(CNC(=O)[C@H]2CCCN(C)C2=O)CCCCC1	ZINC000450754794	DD	On-Demand	Anodyne	HCN4	49	32
Cc1noc(C2(C)CCN(C(=O)c3c(C)cccc3Cl)CC2)n1	ZINC000450754799	EH	On-Demand	Anodyne	CCR5	34	42
CO[C@@H]1CCN(c2ccnc3ccc(C)cc23)C[C@H]1C	ZINC000450754808	CG	On-Demand	Anodyne	PDE3A	42	33
CO[C@H]1CCN(c2ccnc3ccc(C)cc23)C[C@H]1C	ZINC000450754809	CG	On-Demand	Anodyne	PDE3A	42	33
CO[C@H]1CCN(c2ccnc3ccc(C)cc23)C[C@@H]1C	ZINC000450754810	CG	On-Demand	Anodyne	PDE3A	42	33
CO[C@@H]1CCN(c2ccnc3ccc(C)cc23)C[C@@H]1C	ZINC000450754811	CG	On-Demand	Anodyne	PDE3A	42	33
CC[C@@](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)(C(N)=O)C(C)C	ZINC000450754849	FF	On-Demand	Anodyne	MTNR1B	24	41
CC[C@](NC(=O)c1ccc(Oc2cccc(OC)c2)cn1)(C(N)=O)C(C)C	ZINC000450754850	FF	On-Demand	Anodyne	MTNR1B	24	41
CCOCc1nc(C)c(C(=O)N2CCC(c3ccsc3)CC2)s1	ZINC000450754853	FI	On-Demand	Anodyne	NPBWR1	43	32
CSc1cccc(C(=O)N2CCC(c3ccsc3)CC2)c1	ZINC000450754859	DI	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CCC(c3ccsc3)CC2)c1	ZINC000450754859	DI	On-Demand	Anodyne	L3MBTL3	42	42
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCC(c2ccsc2)CC1	ZINC000450754860	CI	On-Demand	Anodyne	NPBWR1	96	38
COC(=O)c1coc(CN[C@H](CN2CCc3ccccc3C2)C(C)(C)C)n1	ZINC000450754893	FG	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1coc(CN[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)n1	ZINC000450754894	FG	On-Demand	Anodyne	NOD2	40	36
CCS(=O)(=O)c1ccc(CSc2ncnc3c2cnn3C)cc1	ZINC000450754895	EE	On-Demand	Anodyne	SLC29A1	44	39
COCc1nn(C)cc1C(=O)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450754906	FG	On-Demand	Anodyne	HCN1	49	32
COCc1nn(C)cc1C(=O)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450754906	FG	On-Demand	Anodyne	HCN4	47	32
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450754907	FF	On-Demand	Anodyne	DRD4	0	40
CCOC(=O)C[C@H]1C[C@@H](OC)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450754908	FF	On-Demand	Anodyne	DRD4	0	40
CCOC(=O)C[C@@H]1C[C@H](OC)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450754910	FF	On-Demand	Anodyne	DRD4	0	40
CCOC(=O)C[C@H]1C[C@H](OC)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450754912	FF	On-Demand	Anodyne	DRD4	0	40
COC(=O)C1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CC1	ZINC000450754918	GE	On-Demand	Anodyne	HCN1	64	37
COC(=O)C1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CC1	ZINC000450754918	GE	On-Demand	Anodyne	HCN4	53	35
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@@H](c2nc(C)no2)C1	ZINC000450754973	DE	On-Demand	Bother	ETHR	41	33
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@H](c2nc(C)no2)C1	ZINC000450754974	DE	On-Demand	Bother	ETHR	41	33
C[C@H](c1ccccc1)[C@@H](O)CN1CCO[C@H](C(=O)C2CC2)C1	ZINC000450754981	DD	On-Demand	Anodyne	OPRK1	19	40
C[C@H](c1ccccc1)[C@H](O)CN1CCO[C@@H](C(=O)C2CC2)C1	ZINC000450754988	DD	On-Demand	Anodyne	OPRK1	19	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCO[C@@H](C(=O)C2CC2)C1	ZINC000450754989	DD	On-Demand	Anodyne	OPRK1	19	40
C=CCN(C)CCCc1cc(CC)no1	ZINC000450754990	BE	On-Demand	Mild	SHC	41	34
C[C@H](c1ccccc1)[C@H](O)CN1CCO[C@H](C(=O)C2CC2)C1	ZINC000450754991	DD	On-Demand	Anodyne	OPRK1	19	40
CS(=O)(=O)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)nc1	ZINC000450754994	GG	On-Demand	Anodyne	GPR119	15	46
CS(=O)(=O)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)nc1	ZINC000450754995	GG	On-Demand	Anodyne	GPR119	15	46
CC(=O)c1cccc(CN2CCC[C@@H](OCC3CC3)C2)c1	ZINC000450754999	CG	On-Demand	Anodyne	PRSS2	42	29
CC(=O)c1cccc(CN2CCC[C@H](OCC3CC3)C2)c1	ZINC000450755001	CG	On-Demand	Anodyne	PRSS2	42	29
CCOCc1nc(C)c(C(=O)Nc2cn(Cc3ccccc3)nn2)s1	ZINC000450755003	FF	On-Demand	Anodyne	SCD1	37	50
COc1cccc(OCCC(=O)NC(C)(C)C(C)(C)CO)c1	ZINC000450755014	DE	On-Demand	Anodyne	MTNR1A	40	41
COc1cccc(OCCC(=O)NC(C)(C)C(C)(C)CO)c1	ZINC000450755014	DE	On-Demand	Anodyne	MTNR1B	40	41
Cn1ncc2c(N3CC[C@@H](c4cccc(Br)c4)C3)ncnc21	ZINC000450755021	FG	On-Demand	Anodyne	PDE3A	41	32
Cn1ncc2c(N3CC[C@@H](c4cccc(Br)c4)C3)ncnc21	ZINC000450755021	FG	On-Demand	Anodyne	PDE3B	60	32
Cn1ncc2c(N3CC[C@H](c4cccc(Br)c4)C3)ncnc21	ZINC000450755022	FG	On-Demand	Anodyne	PDE3A	41	32
Cn1ncc2c(N3CC[C@H](c4cccc(Br)c4)C3)ncnc21	ZINC000450755022	FG	On-Demand	Anodyne	PDE3B	60	32
Cc1cccc(Cl)c1CN1CCO[C@H](C(=O)C2CC2)C1	ZINC000450755035	CF	On-Demand	Anodyne	SLC6A1	40	37
Cc1cccc(Cl)c1CN1CCO[C@@H](C(=O)C2CC2)C1	ZINC000450755036	CF	On-Demand	Anodyne	SLC6A1	40	37
CSCc1nnc(SCc2cc(C)ccc2F)o1	ZINC000450755037	CH	On-Demand	Anodyne	PTK2	18	41
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	HTR1A	23	41
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	DRD2	32	46
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	ADRA1D	15	40
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	HTR2A	34	40
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	HTR2C	23	41
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	HRH1	25	40
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	ADRA1B	21	40
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	DRD3	15	40
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	MCHR1	26	41
CCC(=O)CCCN1CCC(c2c(F)cccc2F)CC1	ZINC000450755039	CH	On-Demand	Anodyne	CYP2J2	52	37
CC(C)(C)C(=O)Nc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)cn1	ZINC000450755058	GF	On-Demand	Anodyne	MTTP	49	33
CC(C)(C)C(=O)Nc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)cn1	ZINC000450755059	GF	On-Demand	Anodyne	MTTP	49	33
COC(=O)c1coc(CN2CCC(c3ccsc3)CC2)n1	ZINC000450755084	DF	On-Demand	Anodyne	NPBWR1	64	33
COc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1[N+](=O)[O-]	ZINC000450755089	DE	On-Demand	Bother	CPT2	40	34
COc1cc(CN[C@@H]2CCCC[C@@H]2n2cccn2)ccc1Cl	ZINC000450755092	DH	On-Demand	Anodyne	SSTR3	20	45
COc1cc(CN[C@H]2CCCC[C@@H]2n2cccn2)ccc1Cl	ZINC000450755093	DH	On-Demand	Anodyne	SSTR3	20	45
COc1cc(CN[C@@H]2CCCC[C@H]2n2cccn2)ccc1Cl	ZINC000450755094	DH	On-Demand	Anodyne	SSTR3	20	45
COc1cc(CN[C@H]2CCCC[C@H]2n2cccn2)ccc1Cl	ZINC000450755095	DH	On-Demand	Anodyne	SSTR3	0	45
COC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450755111	CG	On-Demand	Anodyne	SLC6A11	0	40
COC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450755111	CG	On-Demand	Anodyne	SLC6A13	0	40
COC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450755112	CG	On-Demand	Anodyne	SLC6A11	0	40
COC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450755112	CG	On-Demand	Anodyne	SLC6A13	0	40
O=C(CCCCN1CCOCC1)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755113	GC	On-Demand	Anodyne	HTR1A	19	40
O=C(CCCCN1CCOCC1)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755113	GC	On-Demand	Anodyne	DRD2	17	40
O=C(CCCCN1CCOCC1)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755113	GC	On-Demand	Anodyne	HTR7	40	38
COc1ccc(CNC(=O)CCN2C[C@H](O)C3(CC3)C2)c(OC)c1	ZINC000450755124	ED	On-Demand	Anodyne	MTNR1A	48	34
COc1ccc(CNC(=O)CCN2C[C@H](O)C3(CC3)C2)c(OC)c1	ZINC000450755124	ED	On-Demand	Anodyne	MTNR1B	31	41
COc1ccc(CNC(=O)CCN2C[C@@H](O)C3(CC3)C2)c(OC)c1	ZINC000450755126	ED	On-Demand	Anodyne	MTNR1A	48	34
COc1ccc(CNC(=O)CCN2C[C@@H](O)C3(CC3)C2)c(OC)c1	ZINC000450755126	ED	On-Demand	Anodyne	MTNR1B	31	41
FC1(F)CCCC[C@H]1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450755130	DH	On-Demand	Anodyne	SIGMAR1	37	54
FC1(F)CCCC[C@H]1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450755130	DH	On-Demand	Anodyne	SLC18A3	22	43
FC1(F)CCCC[C@@H]1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450755133	DH	On-Demand	Anodyne	SIGMAR1	37	54
FC1(F)CCCC[C@@H]1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450755133	DH	On-Demand	Anodyne	SLC18A3	22	43
FC1(F)CCCC[C@H]1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450755136	DH	On-Demand	Anodyne	SIGMAR1	37	54
FC1(F)CCCC[C@H]1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450755136	DH	On-Demand	Anodyne	SLC18A3	22	43
FC1(F)CCCC[C@@H]1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450755139	DH	On-Demand	Anodyne	SIGMAR1	37	54
FC1(F)CCCC[C@@H]1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450755139	DH	On-Demand	Anodyne	SLC18A3	22	43
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000450755144	CG	On-Demand	Anodyne	SLC18A3	24	40
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000450755144	CG	On-Demand	Anodyne	HSD17B2	73	36
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000450755145	CG	On-Demand	Anodyne	SLC18A3	24	40
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000450755145	CG	On-Demand	Anodyne	HSD17B2	73	36
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000450755146	CG	On-Demand	Anodyne	SLC18A3	24	40
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000450755146	CG	On-Demand	Anodyne	HSD17B2	73	36
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000450755147	CG	On-Demand	Anodyne	SLC18A3	24	40
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000450755147	CG	On-Demand	Anodyne	HSD17B2	73	36
CCN(CC)C(=O)CCC1CCN(C(=O)CCOc2cccc(OC)c2)CC1	ZINC000450755149	GG	On-Demand	Anodyne	CHRNA10	26	42
CCN(CC)C(=O)CCC1CCN(C(=O)CCOc2cccc(OC)c2)CC1	ZINC000450755149	GG	On-Demand	Anodyne	ACKR3	52	33
COC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1Cl	ZINC000450755155	FH	On-Demand	Anodyne	SIGMAR1	44	56
COC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1Cl	ZINC000450755155	FH	On-Demand	Anodyne	SLC18A3	23	48
COC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1Cl	ZINC000450755155	FH	On-Demand	Anodyne	MCHR2	63	36
COC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1Cl	ZINC000450755156	FH	On-Demand	Anodyne	SIGMAR1	44	56
COC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1Cl	ZINC000450755156	FH	On-Demand	Anodyne	SLC18A3	23	48
COC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1Cl	ZINC000450755156	FH	On-Demand	Anodyne	MCHR2	63	36
CO[C@H]1CCN(c2ncnc3c(C)cccc23)CC1(C)C	ZINC000450755170	CG	On-Demand	Anodyne	PDE3A	27	41
CO[C@@H]1CCN(c2ncnc3c(C)cccc23)CC1(C)C	ZINC000450755171	CG	On-Demand	Anodyne	PDE3A	27	41
O=C(CCCN1C[C@@H](O)C[C@H]1CO)c1ccc(F)cc1	ZINC000450755186	CD	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1C[C@@H](O)C[C@H]1CO)c1ccc(F)cc1	ZINC000450755186	CD	On-Demand	Anodyne	CYP2J2	44	31
Cc1cccc(Cl)c1C(=O)NCCN1CCNC(=O)C1	ZINC000450755203	CC	On-Demand	Anodyne	DRD4	49	39
Cc1cccc(Cl)c1C(=O)NCCN1CCNC(=O)C1	ZINC000450755203	CC	On-Demand	Anodyne	HTR2A	26	42
Cc1cccc(Cl)c1C(=O)NCCN1CCNC(=O)C1	ZINC000450755203	CC	On-Demand	Anodyne	HTR2C	27	40
Cc1cccc(Cl)c1C(=O)NCCN1CCNC(=O)C1	ZINC000450755203	CC	On-Demand	Anodyne	PLD1	46	34
Cc1cccc(Cl)c1C(=O)NCCN1CCNC(=O)C1	ZINC000450755203	CC	On-Demand	Anodyne	PLD2	82	36
CO[C@@H]1CCN(c2noc(-c3ccccc3)n2)CC1(C)C	ZINC000450755212	CF	On-Demand	Anodyne	LUCI_PHOPE	15	41
CO[C@H]1CCN(c2noc(-c3ccccc3)n2)CC1(C)C	ZINC000450755213	CF	On-Demand	Anodyne	LUCI_PHOPE	15	41
COCCC1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCCC1	ZINC000450755221	FG	On-Demand	Anodyne	THYX_PBCV1	0	40
COCCC1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCCC1	ZINC000450755221	FG	On-Demand	Anodyne	HCN1	59	39
COCCC1(CNC(=O)c2cn(CCc3ccccc3)nn2)CCCCC1	ZINC000450755221	FG	On-Demand	Anodyne	HCN4	55	35
CCC[C@H](OC)C(=O)Nc1cccc(CCCO)c1	ZINC000450755226	CE	On-Demand	Anodyne	PARP10	0	45
CCC[C@@H](OC)C(=O)Nc1cccc(CCCO)c1	ZINC000450755227	CE	On-Demand	Anodyne	PARP10	0	45
COC(=O)[C@H](NCCC[C@@H](C)O)c1ccc(F)c(C)c1	ZINC000450755235	CE	On-Demand	Anodyne	LEF	71	40
COC(=O)[C@@H](NCCC[C@H](C)O)c1ccc(F)c(C)c1	ZINC000450755238	CE	On-Demand	Anodyne	LEF	71	40
COC(=O)[C@@H](NCCC[C@@H](C)O)c1ccc(F)c(C)c1	ZINC000450755240	CE	On-Demand	Anodyne	LEF	71	40
COC(=O)[C@H](NCCC[C@H](C)O)c1ccc(F)c(C)c1	ZINC000450755242	CE	On-Demand	Anodyne	LEF	71	40
CC(=O)c1nc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)sc1C	ZINC000450755247	EH	On-Demand	Bother	SLC27A4	42	32
CC(C)[C@H](CO)[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)C(C)C	ZINC000450755248	GF	On-Demand	Anodyne	LRRK2	31	41
CC(=O)c1nc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)sc1C	ZINC000450755250	EH	On-Demand	Bother	SLC27A4	42	32
O=C(CC[C@@H]1CCCCO1)CSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450755251	GI	On-Demand	Anodyne	TNKS	67	36
CC(C)[C@@H](CO)[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)C(C)C	ZINC000450755252	GF	On-Demand	Anodyne	LRRK2	31	41
CC(C)[C@H](CO)[C@@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)C(C)C	ZINC000450755254	GF	On-Demand	Anodyne	LRRK2	31	41
CC(C)[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)[C@H](CO)C(C)C	ZINC000450755255	GF	On-Demand	Anodyne	LRRK2	31	41
O=C(CC[C@H]1CCCCO1)CSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450755268	GI	On-Demand	Anodyne	TNKS	67	36
O=C(CSC1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755292	EG	On-Demand	Anodyne	MTNR1A	30	41
O=C(CSC1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755292	EG	On-Demand	Anodyne	MTNR1B	0	41
O=C(CSC1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755292	EG	On-Demand	Anodyne	RBP4	40	36
O=C(CSC1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755292	EG	On-Demand	Anodyne	SFRP1	85	35
O=C(CSC1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755292	EG	On-Demand	Anodyne	WNT3	40	31
O=C(CSC1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755294	EG	On-Demand	Anodyne	MTNR1A	30	41
O=C(CSC1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755294	EG	On-Demand	Anodyne	MTNR1B	0	41
O=C(CSC1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755294	EG	On-Demand	Anodyne	RBP4	40	36
O=C(CSC1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755294	EG	On-Demand	Anodyne	SFRP1	85	35
O=C(CSC1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450755294	EG	On-Demand	Anodyne	WNT3	40	31
CCC(=O)CCCN1Cc2ccccc2C2(CC2)C1	ZINC000450755295	CG	On-Demand	Anodyne	SLC18A3	44	43
CCC(=O)CCCN1Cc2ccccc2C2(CC2)C1	ZINC000450755295	CG	On-Demand	Anodyne	EBP	17	42
C=C[C@@H]1OCC[C@H]1Nc1ccnc2cc(Cl)ccc12	ZINC000450755297	CH	On-Demand	Mild	HRP1_PLAFA	122	39
C=C[C@@H]1OCC[C@H]1Nc1ccnc2cc(Cl)ccc12	ZINC000450755297	CH	On-Demand	Mild	HNMT	56	39
C=C[C@@H]1OCC[C@H]1Nc1ccnc2cc(Cl)ccc12	ZINC000450755297	CH	On-Demand	Mild	BOTA	15	43
COC(=O)C1(CSc2nnc(N3CCCC3)n2Cc2ccco2)CCCC1	ZINC000450755306	GG	On-Demand	Anodyne	HCRTR2	20	41
Cc1csc(C(=O)N2CCC(c3c(F)cccc3F)CC2)c1	ZINC000450755310	DI	On-Demand	Anodyne	RBP4	26	40
Cc1sccc1C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450755323	FG	On-Demand	Anodyne	RBP4	68	45
COCCOC[C@H](O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450755327	FE	On-Demand	Anodyne	HTR2A	17	41
COCCOC[C@H](O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450755327	FE	On-Demand	Anodyne	HTR2C	17	41
COCCOC[C@H](O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450755327	FE	On-Demand	Anodyne	DRD3	40	40
COCCOC[C@H](O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450755327	FE	On-Demand	Anodyne	ABCB1	69	42
Cc1sccc1C(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450755329	FG	On-Demand	Anodyne	RBP4	68	45
COCCOC[C@@H](O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450755332	FE	On-Demand	Anodyne	HTR2A	17	41
COCCOC[C@@H](O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450755332	FE	On-Demand	Anodyne	HTR2C	17	41
COCCOC[C@@H](O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450755332	FE	On-Demand	Anodyne	DRD3	40	40
COCCOC[C@@H](O)CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450755332	FE	On-Demand	Anodyne	ABCB1	69	42
CCS(=O)(=O)c1ccc(CN[C@H]2CCCCCC[C@H]2C(=O)OC)cc1	ZINC000450755337	FG	On-Demand	Anodyne	SSTR3	20	41
CCS(=O)(=O)c1ccc(CN[C@@H]2CCCCCC[C@H]2C(=O)OC)cc1	ZINC000450755338	FG	On-Demand	Anodyne	SSTR3	20	41
CCS(=O)(=O)c1ccc(CN[C@H]2CCCCCC[C@@H]2C(=O)OC)cc1	ZINC000450755340	FG	On-Demand	Anodyne	SSTR3	20	41
CCS(=O)(=O)c1ccc(CN[C@@H]2CCCCCC[C@@H]2C(=O)OC)cc1	ZINC000450755341	FG	On-Demand	Anodyne	SSTR3	20	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C(C)C)[C@H](CO)C(C)C	ZINC000450755343	FD	On-Demand	Anodyne	CA2	51	51
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C(C)C)[C@H](CO)C(C)C	ZINC000450755343	FD	On-Demand	Anodyne	CA1	42	39
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C(C)C)[C@H](CO)C(C)C	ZINC000450755343	FD	On-Demand	Anodyne	CA4	47	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450755345	FD	On-Demand	Anodyne	CA2	51	51
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450755345	FD	On-Demand	Anodyne	CA1	42	39
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450755345	FD	On-Demand	Anodyne	CA4	47	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450755347	FD	On-Demand	Anodyne	CA2	51	51
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450755347	FD	On-Demand	Anodyne	CA1	42	39
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450755347	FD	On-Demand	Anodyne	CA4	47	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C(C)C)[C@H](CO)C(C)C	ZINC000450755348	FD	On-Demand	Anodyne	CA2	51	51
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C(C)C)[C@H](CO)C(C)C	ZINC000450755348	FD	On-Demand	Anodyne	CA1	42	39
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C(C)C)[C@H](CO)C(C)C	ZINC000450755348	FD	On-Demand	Anodyne	CA4	47	40
CC(=O)c1cccc(CN2CCC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450755349	DH	On-Demand	Anodyne	SIGMAR1	35	45
CC(=O)c1cccc(CN2CCC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450755349	DH	On-Demand	Anodyne	SLC18A3	0	40
CC(=O)c1cccc(CN2CCC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450755349	DH	On-Demand	Anodyne	MCHR2	69	36
COC(=O)c1coc(CN2CCC[C@]2(C)Cc2ccccc2)n1	ZINC000450755356	DG	On-Demand	Anodyne	SLC12A5	66	40
COC(=O)c1coc(CN2CCC[C@@]2(C)Cc2ccccc2)n1	ZINC000450755358	DG	On-Demand	Anodyne	SLC12A5	66	40
CC(=O)c1cccc(CN2CCC[C@]3(C2)OCc2ccccc23)c1	ZINC000450755360	DH	On-Demand	Anodyne	SIGMAR1	35	45
CC(=O)c1cccc(CN2CCC[C@]3(C2)OCc2ccccc23)c1	ZINC000450755360	DH	On-Demand	Anodyne	SLC18A3	0	40
CC(=O)c1cccc(CN2CCC[C@]3(C2)OCc2ccccc23)c1	ZINC000450755360	DH	On-Demand	Anodyne	MCHR2	69	36
C[C@H]1C[C@]1(C#N)C(=O)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450755361	DG	On-Demand	Mild	ACAT	0	44
O=C(NC[C@H](c1ccccc1)C(F)(F)F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450755362	EH	On-Demand	Anodyne	GRM3	15	40
O=C(NC[C@@H](c1ccccc1)C(F)(F)F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450755363	EH	On-Demand	Anodyne	GRM3	15	40
C[C@@H]1C[C@]1(C#N)C(=O)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450755365	DG	On-Demand	Mild	ACAT	0	44
C[C@H]1C[C@@]1(C#N)C(=O)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450755368	DG	On-Demand	Mild	ACAT	0	44
C[C@@H]1C[C@@]1(C#N)C(=O)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450755372	DG	On-Demand	Mild	ACAT	0	44
O=C1NCCN(C(=O)[C@@H](O)C2CCC2)[C@H]1c1ccccc1C(F)(F)F	ZINC000450755375	FD	On-Demand	Anodyne	RBP4	75	39
O=C1NCCN(C(=O)[C@@H](O)C2CCC2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450755377	FD	On-Demand	Anodyne	RBP4	75	39
O=C1NCCN(C(=O)[C@H](O)C2CCC2)[C@H]1c1ccccc1C(F)(F)F	ZINC000450755378	FD	On-Demand	Anodyne	RBP4	75	39
O=C1NCCN(C(=O)[C@H](O)C2CCC2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450755380	FD	On-Demand	Anodyne	RBP4	75	39
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1(C)C	ZINC000450755381	FH	On-Demand	Anodyne	PRNP	58	39
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1(C)C	ZINC000450755381	FH	On-Demand	Anodyne	HDAC1	31	43
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1(C)C	ZINC000450755381	FH	On-Demand	Anodyne	P4HTM	0	49
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1(C)C	ZINC000450755381	FH	On-Demand	Anodyne	DGAT1	46	40
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1(C)C	ZINC000450755383	FH	On-Demand	Anodyne	PRNP	58	39
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1(C)C	ZINC000450755383	FH	On-Demand	Anodyne	HDAC1	31	43
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1(C)C	ZINC000450755383	FH	On-Demand	Anodyne	P4HTM	0	49
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1(C)C	ZINC000450755383	FH	On-Demand	Anodyne	DGAT1	46	40
Cc1cnccc1N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000450755408	CH	On-Demand	Bother	SLC27A4	43	33
Cc1cnccc1N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000450755411	CH	On-Demand	Bother	SLC27A4	43	33
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3cc(N4CCC[C@H]4CO)ncn3)C2)cc1	ZINC000450755423	GF	On-Demand	Bother	PRCP	32	41
O=[N+]([O-])c1ccc([C@H]2CCCN(c3cc(N4CCC[C@@H]4CO)ncn3)C2)cc1	ZINC000450755425	GF	On-Demand	Bother	PRCP	32	41
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3cc(N4CCC[C@@H]4CO)ncn3)C2)cc1	ZINC000450755427	GF	On-Demand	Bother	PRCP	32	41
O=[N+]([O-])c1ccc([C@H]2CCCN(c3cc(N4CCC[C@H]4CO)ncn3)C2)cc1	ZINC000450755430	GF	On-Demand	Bother	PRCP	32	41
COCCC1(CNC(=O)c2cc(C)c(C(N)=O)cn2)CCCCC1	ZINC000450755432	EE	On-Demand	Anodyne	HCN4	50	32
COCCC1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450755446	DF	On-Demand	Mild	HCN1	53	32
COCCC1(CNC(=O)c2cc(C#N)[nH]c2C)CCCCC1	ZINC000450755446	DF	On-Demand	Mild	HCN4	51	32
CCn1cnc2c(SCc3cccc(C)c3)ncnc21	ZINC000450755447	CG	On-Demand	Anodyne	AK	0	58
Cn1nc(C2CCCC2)cc1NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450755457	GG	On-Demand	Anodyne	CCKBR	42	39
COC(=O)C1(CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450755471	FF	On-Demand	Anodyne	PYGL	67	39
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450755505	GH	On-Demand	Anodyne	ACE	24	40
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450755505	GH	On-Demand	Anodyne	CPT2	42	37
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450755505	GH	On-Demand	Anodyne	PREP	121	69
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450755505	GH	On-Demand	Anodyne	SFRP1	61	49
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450755505	GH	On-Demand	Anodyne	WNT3	69	49
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450755505	GH	On-Demand	Anodyne	L3MBTL3	44	37
CCc1cccc(C(=O)N2CCC(c3c(F)cccc3F)CC2)n1	ZINC000450755508	EH	On-Demand	Anodyne	ETHR	40	32
COC(=O)COc1ccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450755510	FG	On-Demand	Anodyne	ADRB1	15	47
COC(=O)COc1ccc([C@H](C)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450755510	FG	On-Demand	Anodyne	ACACA	45	38
CC(C)CN(Cc1nnc(C(C)C)s1)[C@H]1CCCc2cccnc21	ZINC000450755511	EJ	On-Demand	Anodyne	CXCR4	88	52
CC(C)CN(Cc1nnc(C(C)C)s1)[C@@H]1CCCc2cccnc21	ZINC000450755513	EJ	On-Demand	Anodyne	CXCR4	88	52
O=C(c1cccc2c1CCCC2)N1CCO[C@H](C2CC2)C1	ZINC000450755523	CF	On-Demand	Anodyne	FABP4	43	34
O=C(c1cccc2c1CCCC2)N1CCO[C@@H](C2CC2)C1	ZINC000450755524	CF	On-Demand	Anodyne	FABP4	43	34
COc1cc(CN2CCO[C@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755532	DF	On-Demand	Anodyne	DRD4	30	45
COc1cc(CN2CCO[C@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755532	DF	On-Demand	Anodyne	DRD3	23	44
COc1cc(CN2CCO[C@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755532	DF	On-Demand	Anodyne	HTR4	54	40
COc1cc(CN2CCO[C@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755532	DF	On-Demand	Anodyne	SSTR5	46	36
COc1cc(CN2CCO[C@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755532	DF	On-Demand	Anodyne	CCR1	33	43
COc1cc(CN2CCO[C@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755532	DF	On-Demand	Anodyne	CCR3	30	43
COc1cc(CN2CCO[C@@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755533	DF	On-Demand	Anodyne	DRD4	30	45
COc1cc(CN2CCO[C@@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755533	DF	On-Demand	Anodyne	DRD3	23	44
COc1cc(CN2CCO[C@@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755533	DF	On-Demand	Anodyne	HTR4	54	40
COc1cc(CN2CCO[C@@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755533	DF	On-Demand	Anodyne	SSTR5	46	36
COc1cc(CN2CCO[C@@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755533	DF	On-Demand	Anodyne	CCR1	33	43
COc1cc(CN2CCO[C@@H](C(=O)C3CC3)C2)ccc1Cl	ZINC000450755533	DF	On-Demand	Anodyne	CCR3	30	43
Cc1ccn2ncc(C(=O)NC(C)(C)C(C)(C)CO)c2c1	ZINC000450755564	CE	On-Demand	Anodyne	EPHB3	37	54
COc1ccc(Nc2cc(N3CC[C@@H](c4nc(C)no4)C3)ncn2)c(OC)c1	ZINC000450755591	GF	On-Demand	Anodyne	PDE3B	59	37
Cc1cc(-c2nc(C(=O)N[C@H](CO)C(C)(C)C)co2)ccn1	ZINC000450755592	DE	On-Demand	Anodyne	IRAK4	21	42
COC(=O)CN1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450755599	FD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
COc1ccc(Nc2cc(N3CC[C@H](c4nc(C)no4)C3)ncn2)c(OC)c1	ZINC000450755601	GF	On-Demand	Anodyne	PDE3B	59	37
CC[C@@H](CC(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450755659	DG	On-Demand	Anodyne	CAPN1	48	33
CC[C@@H](CC(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450755659	DG	On-Demand	Anodyne	CAPN2	73	37
CC[C@H](CC(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450755661	DG	On-Demand	Anodyne	CAPN1	48	33
CC[C@H](CC(C)C)C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450755661	DG	On-Demand	Anodyne	CAPN2	73	37
COC(=O)CN1CCN(C(=O)c2cccc(SC)c2)CC1	ZINC000450755662	DD	On-Demand	Anodyne	DRD4	41	31
CCO[C@H]1COCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450755664	CD	On-Demand	Anodyne	TIMP3	47	32
CCO[C@H]1COCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450755665	CD	On-Demand	Anodyne	TIMP3	47	32
CC(CO)(CO)NC(=O)c1ccc2cnccc2c1	ZINC000450755672	CC	On-Demand	Anodyne	AKT1	0	43
CCN1CCCC[C@H]1C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755682	FD	On-Demand	Anodyne	FKBP1A	16	41
CCN1CCCC[C@@H]1C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755684	FD	On-Demand	Anodyne	FKBP1A	16	41
CC(=O)c1ccc(CN2CCO[C@@H](COCC3CC3)C2)cc1	ZINC000450755701	DF	On-Demand	Anodyne	DRD4	25	48
CC(=O)c1ccc(CN2CCO[C@H](COCC3CC3)C2)cc1	ZINC000450755702	DF	On-Demand	Anodyne	DRD4	25	48
COC(=O)CN1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450755713	ED	On-Demand	Anodyne	SIGMAR1	20	40
COC(=O)CN1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450755713	ED	On-Demand	Anodyne	MCHR1	20	43
FC(F)(F)c1cccc([C@@H](NCc2ccccc2OC2CC2)c2nc[nH]n2)c1	ZINC000450755739	GI	On-Demand	Anodyne	PHES	0	42
FC(F)(F)c1cccc([C@H](NCc2ccccc2OC2CC2)c2nc[nH]n2)c1	ZINC000450755740	GI	On-Demand	Anodyne	PHES	0	42
CCC1(CC)CN(CCN(C)Cc2ccccc2)CC[S@]1=O	ZINC000450755741	DF	On-Demand	Anodyne	SIGMAR1	18	43
CCC1(CC)CN(CCN(C)Cc2ccccc2)CC[S@@]1=O	ZINC000450755742	DF	On-Demand	Anodyne	SIGMAR1	18	43
O=C1CCC[C@@H]1[C@@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450755748	DF	On-Demand	Anodyne	CACNA1C	0	41
O=C1CCC[C@@H]1[C@@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450755748	DF	On-Demand	Anodyne	CACNA1D	43	41
O=C1CCC[C@H]1[C@@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450755749	DF	On-Demand	Anodyne	CACNA1C	0	41
O=C1CCC[C@H]1[C@@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450755749	DF	On-Demand	Anodyne	CACNA1D	43	41
O=C1CCC[C@@H]1[C@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450755750	DF	On-Demand	Anodyne	CACNA1C	0	41
O=C1CCC[C@@H]1[C@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450755750	DF	On-Demand	Anodyne	CACNA1D	43	41
O=C1CCC[C@H]1[C@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450755751	DF	On-Demand	Anodyne	CACNA1C	0	41
O=C1CCC[C@H]1[C@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450755751	DF	On-Demand	Anodyne	CACNA1D	43	41
COC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450755753	DD	On-Demand	Anodyne	TRPV1	24	43
COC(=O)C1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450755753	DD	On-Demand	Anodyne	NCE103	30	46
CC(=O)c1ccc(CN2Cc3ccccc3C3(CC3)C2)cc1	ZINC000450755754	CH	On-Demand	Anodyne	SIGMAR1	34	45
CC(=O)c1ccc(CN2Cc3ccccc3C3(CC3)C2)cc1	ZINC000450755754	CH	On-Demand	Anodyne	MCHR2	58	34
CC(=O)c1ccc(CN2Cc3ccccc3C3(CC3)C2)cc1	ZINC000450755754	CH	On-Demand	Anodyne	NOD1	31	40
CC(=O)c1ccc(CN2Cc3ccccc3C3(CC3)C2)cc1	ZINC000450755754	CH	On-Demand	Anodyne	NOD2	47	39
CNS(=O)(=O)NCC(=O)NCc1cn(-c2ccccc2)nc1C	ZINC000450755760	EB	On-Demand	Anodyne	P2RX7	23	53
COC(=O)c1coc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450755766	FG	On-Demand	Anodyne	SIGMAR1	18	41
COC(=O)c1coc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450755766	FG	On-Demand	Anodyne	CCR3	52	38
O=C(NCCN1c2ccccc2NS1(=O)=O)c1coc(C2CCCC2)n1	ZINC000450755767	GE	On-Demand	Anodyne	TBXA2R	25	40
C[C@H](c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755768	FJ	On-Demand	Anodyne	SIGMAR1	60	59
C[C@H](c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755768	FJ	On-Demand	Anodyne	MCHR1	19	42
C[C@H](c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755768	FJ	On-Demand	Anodyne	MCHR2	40	31
C[C@@H](c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755770	FJ	On-Demand	Anodyne	SIGMAR1	60	59
C[C@@H](c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755770	FJ	On-Demand	Anodyne	MCHR1	19	42
C[C@@H](c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755770	FJ	On-Demand	Anodyne	MCHR2	40	31
C[C@H](c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755771	FJ	On-Demand	Anodyne	SIGMAR1	60	59
C[C@H](c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755771	FJ	On-Demand	Anodyne	MCHR1	19	42
C[C@H](c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755771	FJ	On-Demand	Anodyne	MCHR2	40	31
C[C@@H](c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755772	FJ	On-Demand	Anodyne	SIGMAR1	60	59
C[C@@H](c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755772	FJ	On-Demand	Anodyne	MCHR1	19	42
C[C@@H](c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1)C(F)(F)F	ZINC000450755772	FJ	On-Demand	Anodyne	MCHR2	40	31
CCCc1nc(C)c(NC(=O)[C@H]2CCN(c3ccccc3)C2)s1	ZINC000450755777	EH	On-Demand	Anodyne	P2RY12	47	33
CCCC[C@@H](C)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755778	EE	On-Demand	Anodyne	NPFFR1	40	31
CCCC[C@H](C)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755779	EE	On-Demand	Anodyne	NPFFR1	40	31
CCCc1nc(C)c(NC(=O)[C@@H]2CCN(c3ccccc3)C2)s1	ZINC000450755785	EH	On-Demand	Anodyne	P2RY12	47	33
Cc1nc(C)n(CCCC(=O)N2CCC(c3ccsc3)CC2)n1	ZINC000450755794	EG	On-Demand	Anodyne	ETHR	53	34
O=C(NCCN1c2ccccc2NS1(=O)=O)[C@H]1CCCc2cccnc21	ZINC000450755805	FD	On-Demand	Anodyne	CXCR4	40	37
O=C(NCCN1c2ccccc2NS1(=O)=O)[C@@H]1CCCc2cccnc21	ZINC000450755807	FD	On-Demand	Anodyne	CXCR4	40	37
COC(=O)C1(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450755818	FD	On-Demand	Anodyne	CA12	15	44
COC(=O)C1(CNC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)CC1	ZINC000450755818	FD	On-Demand	Anodyne	CA9	26	44
COc1cc(CN[C@H]2CCCC[C@@H]2OC)ccc1Cl	ZINC000450755820	CG	On-Demand	Anodyne	TACR1	18	41
COc1cc(CN[C@H]2CCCC[C@@H]2OC)ccc1Cl	ZINC000450755820	CG	On-Demand	Anodyne	SSTR3	20	49
COc1cc(CN[C@@H]2CCCC[C@@H]2OC)ccc1Cl	ZINC000450755821	CG	On-Demand	Anodyne	TACR1	18	41
COc1cc(CN[C@@H]2CCCC[C@@H]2OC)ccc1Cl	ZINC000450755821	CG	On-Demand	Anodyne	SSTR3	20	49
COc1cc(CN[C@H]2CCCC[C@H]2OC)ccc1Cl	ZINC000450755823	CG	On-Demand	Anodyne	TACR1	18	41
COc1cc(CN[C@H]2CCCC[C@H]2OC)ccc1Cl	ZINC000450755823	CG	On-Demand	Anodyne	SSTR3	20	49
COc1cc(CN[C@@H]2CCCC[C@H]2OC)ccc1Cl	ZINC000450755824	CG	On-Demand	Anodyne	TACR1	18	41
COc1cc(CN[C@@H]2CCCC[C@H]2OC)ccc1Cl	ZINC000450755824	CG	On-Demand	Anodyne	SSTR3	20	49
CC[C@@](NC(=O)c1ccc2cnccc2c1)(C(N)=O)C(C)C	ZINC000450755827	CE	On-Demand	Anodyne	AKT1	0	42
CC[C@@](NC(=O)c1ccc2cnccc2c1)(C(N)=O)C(C)C	ZINC000450755827	CE	On-Demand	Anodyne	CYP17A1	0	40
CC[C@](NC(=O)c1ccc2cnccc2c1)(C(N)=O)C(C)C	ZINC000450755828	CE	On-Demand	Anodyne	AKT1	0	42
CC[C@](NC(=O)c1ccc2cnccc2c1)(C(N)=O)C(C)C	ZINC000450755828	CE	On-Demand	Anodyne	CYP17A1	0	40
Cc1nn(C)cc1CC(=O)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450755831	EG	On-Demand	Anodyne	ACAT	0	40
c1ccc2c(c1)CO[C@]21CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450755834	DF	On-Demand	Anodyne	SIGMAR1	20	42
c1ccc2c(c1)CO[C@@]21CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450755835	DF	On-Demand	Anodyne	SIGMAR1	20	42
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	HTR1A	23	58
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	DRD2	38	54
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	DRD1	25	51
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	DRD4	27	51
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	HRH2	0	47
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	HTR2A	40	51
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	HTR2C	29	58
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	SLC6A1	140	41
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	DRD3	21	51
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	ERG2	21	47
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	HTR7	21	47
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	HRH3	21	40
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	SIGMAR1	26	54
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	CCR3	81	42
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	SLC18A3	0	45
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	EBP	17	47
COC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755846	DH	On-Demand	Anodyne	CYP2J2	55	39
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	HTR1A	23	58
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	DRD2	38	54
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	DRD1	25	51
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	DRD4	27	51
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	HRH2	0	47
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	HTR2A	40	51
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	HTR2C	29	58
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	SLC6A1	140	41
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	DRD3	21	51
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	ERG2	21	47
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	HTR7	21	47
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	HRH3	21	40
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	SIGMAR1	26	54
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	CCR3	81	42
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	SLC18A3	0	45
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	EBP	17	47
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450755848	DH	On-Demand	Anodyne	CYP2J2	55	39
CN(CCc1ccc(Cl)cc1)CCN(C)C1CC1	ZINC000450755849	CF	On-Demand	Anodyne	C5AR1	19	42
COc1ccccc1C(C)(C)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755863	GE	On-Demand	Anodyne	HTR1A	26	44
COc1ccccc1C(C)(C)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450755863	GE	On-Demand	Anodyne	DRD2	22	43
COC(=O)COc1ccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450755871	FG	On-Demand	Anodyne	ADRB1	15	47
COC(=O)COc1ccc([C@H](C)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450755871	FG	On-Demand	Anodyne	ACACA	45	38
COC(=O)COc1ccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450755873	FG	On-Demand	Anodyne	ADRB1	15	47
COC(=O)COc1ccc([C@H](C)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450755873	FG	On-Demand	Anodyne	ACACA	45	38
COC(=O)COc1ccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450755875	FG	On-Demand	Anodyne	ADRB1	15	47
COC(=O)COc1ccc([C@H](C)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450755875	FG	On-Demand	Anodyne	ACACA	45	38
COCC[C@@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450755877	GF	On-Demand	Anodyne	DRD4	41	32
COCC[C@@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450755877	GF	On-Demand	Anodyne	MTNR1A	45	35
COCC[C@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450755882	GF	On-Demand	Anodyne	DRD4	41	32
COCC[C@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450755882	GF	On-Demand	Anodyne	MTNR1A	45	35
O=C(CC[C@H]1CCCCO1)COc1ccccc1C(F)(F)F	ZINC000450755884	DI	On-Demand	Anodyne	OXTR	26	46
O=C(CC[C@H]1CCCCO1)COc1ccccc1C(F)(F)F	ZINC000450755884	DI	On-Demand	Anodyne	AVPR1A	0	46
Cc1ccc(F)c(CSc2nnc(N3CCCC3)n2Cc2ccco2)c1	ZINC000450755886	FI	On-Demand	Anodyne	HCRTR2	0	40
COc1cccc2c(N3CC[C@@H](OC)[C@@H](C)C3)cc(C)nc12	ZINC000450755888	DG	On-Demand	Anodyne	PDE3B	54	34
CC(C)(C)C(=O)CCCC(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450755889	GG	On-Demand	Anodyne	RBP4	63	35
CC(C)(C)C(=O)CCCC(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450755890	GG	On-Demand	Anodyne	RBP4	63	35
O=C1NCCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)[C@H]1c1ccccc1C(F)(F)F	ZINC000450755891	GF	On-Demand	Anodyne	RBP4	82	39
O=C1NCCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450755892	GF	On-Demand	Anodyne	RBP4	82	39
O=S1(=O)CCN(CCc2ccc(Cl)cc2)Cc2ccccc21	ZINC000450755893	EG	On-Demand	Anodyne	DHCR7	0	45
CN1CCC[C@@H](C(=O)NCC2(c3ccc(F)cc3F)CCCC2)C1=O	ZINC000450755901	FF	On-Demand	Anodyne	MTNR1A	18	41
CN1CCC[C@H](C(=O)NCC2(c3ccc(F)cc3F)CCCC2)C1=O	ZINC000450755902	FF	On-Demand	Anodyne	MTNR1A	18	41
COC[C@@]1(C(=O)N2CCC(c3ccsc3)CC2)CCOC1	ZINC000450755904	DF	On-Demand	Anodyne	NPBWR1	44	30
COC[C@]1(C(=O)N2CCC(c3ccsc3)CC2)CCOC1	ZINC000450755905	DF	On-Demand	Anodyne	NPBWR1	44	30
COc1cccc2c(N3CC[C@H](OC)[C@@H](C)C3)cc(C)nc12	ZINC000450755908	DG	On-Demand	Anodyne	PDE3B	54	34
COc1cccc2c(N3CC[C@@H](OC)[C@H](C)C3)cc(C)nc12	ZINC000450755910	DG	On-Demand	Anodyne	PDE3B	54	34
COc1cccc2c(N3CC[C@H](OC)[C@H](C)C3)cc(C)nc12	ZINC000450755911	DG	On-Demand	Anodyne	PDE3B	54	34
COC(=O)[C@@H](NCC1(C#N)CCC1)c1ccc(F)c(C)c1	ZINC000450755932	CF	On-Demand	Mild	LEF	42	31
COC(=O)[C@H](NCC1(C#N)CCC1)c1ccc(F)c(C)c1	ZINC000450755933	CF	On-Demand	Mild	LEF	42	31
Cn1nc(-c2ccccc2)cc1C(=O)NCCCCCS(C)(=O)=O	ZINC000450755935	EE	On-Demand	Anodyne	CTSV	45	31
CN1C(=O)CC[C@H]1C(=O)Nc1ccccc1NCC1CCCCC1	ZINC000450755951	EG	On-Demand	Anodyne	P2RX7	24	47
CN1C(=O)CC[C@@H]1C(=O)Nc1ccccc1NCC1CCCCC1	ZINC000450755952	EG	On-Demand	Anodyne	P2RX7	24	47
CO[C@H]1CCN(c2cc3nccc(Br)c3cc2C)C[C@H]1C	ZINC000450755974	EI	On-Demand	Anodyne	PDE3B	40	33
CO[C@H]1CCN(c2cc3nccc(Br)c3cc2C)C[C@@H]1C	ZINC000450755977	EI	On-Demand	Anodyne	PDE3B	40	33
CO[C@@H]1CCN(c2cc3nccc(Br)c3cc2C)C[C@H]1C	ZINC000450755979	EI	On-Demand	Anodyne	PDE3B	40	33
CO[C@@H]1CCN(c2cc3nccc(Br)c3cc2C)C[C@@H]1C	ZINC000450755982	EI	On-Demand	Anodyne	PDE3B	40	33
OC[C@H](C1CC1)[C@H](Nc1nccc(N[C@@H]2CCCOC2)n1)C1CC1	ZINC000450755989	ED	On-Demand	Anodyne	MAPK1	41	32
OC[C@H](C1CC1)[C@@H](Nc1nccc(N[C@@H]2CCCOC2)n1)C1CC1	ZINC000450755991	ED	On-Demand	Anodyne	MAPK1	41	32
OC[C@H](C1CC1)[C@@H](Nc1nccc(N[C@H]2CCCOC2)n1)C1CC1	ZINC000450755992	ED	On-Demand	Anodyne	MAPK1	41	32
OC[C@H](C1CC1)[C@H](Nc1nccc(N[C@H]2CCCOC2)n1)C1CC1	ZINC000450755995	ED	On-Demand	Anodyne	MAPK1	41	32
CCC[C@@H](O)CN1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450755997	CF	On-Demand	Anodyne	MDM2	43	33
CCC[C@H](O)CN1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450755999	CF	On-Demand	Anodyne	MDM2	43	33
CCC[C@@H](O)CN1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450756001	CF	On-Demand	Anodyne	MDM2	43	33
CCC[C@H](O)CN1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450756003	CF	On-Demand	Anodyne	MDM2	43	33
O=C(CCCC(=O)N1CCC(c2c(F)cccc2F)CC1)C1CC1	ZINC000450756005	EH	On-Demand	Anodyne	ETHR	60	36
NC(=O)c1ccc(CCC(=O)Nc2cccc(CCCO)c2)cc1	ZINC000450756024	EE	On-Demand	Anodyne	PARP10	0	49
CCOC(=O)CN(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450756035	DF	On-Demand	Anodyne	ACE	41	34
CCOC(=O)CN(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450756035	DF	On-Demand	Anodyne	TIMP3	40	32
CCOC(=O)CN(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450756035	DF	On-Demand	Anodyne	AMY2	43	30
CCOC(=O)CN(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450756037	DF	On-Demand	Anodyne	ACE	41	34
CCOC(=O)CN(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450756037	DF	On-Demand	Anodyne	TIMP3	40	32
CCOC(=O)CN(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450756037	DF	On-Demand	Anodyne	AMY2	43	30
Cc1cccc([C@H](NC(=O)c2ccc(N3CCC3)nc2)C(F)(F)F)c1	ZINC000450756039	EH	On-Demand	Anodyne	TAAR1	19	40
Cc1cccc([C@H](NC(=O)c2ccc(N3CCC3)nc2)C(F)(F)F)c1	ZINC000450756039	EH	On-Demand	Anodyne	HPGDS	35	46
Cc1cccc([C@@H](NC(=O)c2ccc(N3CCC3)nc2)C(F)(F)F)c1	ZINC000450756045	EH	On-Demand	Anodyne	TAAR1	19	40
Cc1cccc([C@@H](NC(=O)c2ccc(N3CCC3)nc2)C(F)(F)F)c1	ZINC000450756045	EH	On-Demand	Anodyne	HPGDS	35	46
COCCC1(CNC(=O)c2cn(-c3cccnc3)nn2)CCCCC1	ZINC000450756047	EE	On-Demand	Anodyne	HCN1	52	33
COCCC1(CNC(=O)c2cn(-c3cccnc3)nn2)CCCCC1	ZINC000450756047	EE	On-Demand	Anodyne	HCN4	50	33
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450756049	GG	On-Demand	Anodyne	CPT2	41	36
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450756049	GG	On-Demand	Anodyne	PREP	91	58
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450756049	GG	On-Demand	Anodyne	WNT3	41	38
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450756052	GG	On-Demand	Anodyne	CPT2	41	36
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450756052	GG	On-Demand	Anodyne	PREP	91	58
O=C([C@H]1CCCN1C(=O)c1ccccc1)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450756052	GG	On-Demand	Anodyne	WNT3	41	38
CO[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@@H]1C	ZINC000450756055	DE	On-Demand	Bother	PDE3A	47	36
CO[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@@H]1C	ZINC000450756056	DE	On-Demand	Bother	PDE3A	47	36
CO[C@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@H]1C	ZINC000450756057	DE	On-Demand	Bother	PDE3A	47	36
CO[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c23)C[C@H]1C	ZINC000450756058	DE	On-Demand	Bother	PDE3A	47	36
CCn1nnc(C)c1C(=O)Nc1cccc(CCCO)c1	ZINC000450756090	CD	On-Demand	Anodyne	KCNK3	43	33
COCc1cc([N+](=O)[O-])ccc1N[C@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450756104	DG	On-Demand	Bother	CACNA1D	57	34
COCc1cc([N+](=O)[O-])ccc1N[C@H](C(C)C)[C@H](CO)C(C)C	ZINC000450756105	DG	On-Demand	Bother	CACNA1D	57	34
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450756106	DG	On-Demand	Bother	CACNA1D	57	34
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C(C)C)[C@H](CO)C(C)C	ZINC000450756107	DG	On-Demand	Bother	CACNA1D	57	34
Cc1ccc(F)c(CC(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c1	ZINC000450756110	GF	On-Demand	Anodyne	CCR1	27	40
CSc1ccc2ncnc(N[C@H](C3CC3)[C@@H](CO)C3CC3)c2c1	ZINC000450756111	EH	On-Demand	Anodyne	CD38	50	34
CSc1ccc2ncnc(N[C@H](C3CC3)[C@H](CO)C3CC3)c2c1	ZINC000450756112	EH	On-Demand	Anodyne	CD38	50	34
CSc1ccc2ncnc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)c2c1	ZINC000450756113	EH	On-Demand	Anodyne	CD38	50	34
CSc1ccc2ncnc(N[C@@H](C3CC3)[C@H](CO)C3CC3)c2c1	ZINC000450756114	EH	On-Demand	Anodyne	CD38	50	34
CCOCc1nc(C)c(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)s1	ZINC000450756149	FG	On-Demand	Bother	ENPP1	49	29
c1ccc(CCn2ccc(CN3CCCC4(CC4)C3)n2)cc1	ZINC000450756165	CH	On-Demand	Anodyne	EBP	15	41
COCCOC[C@H](O)CN[C@H]1CCCC[C@@H]1Oc1ccccc1C	ZINC000450756184	EE	On-Demand	Anodyne	ADRB2	25	41
COCCOC[C@H](O)CN[C@@H]1CCCC[C@@H]1Oc1ccccc1C	ZINC000450756191	EE	On-Demand	Anodyne	ADRB2	25	41
COCCOC[C@H](O)CN[C@@H]1CCCC[C@H]1Oc1ccccc1C	ZINC000450756192	EE	On-Demand	Anodyne	ADRB2	25	41
COCCOC[C@H](O)CN[C@H]1CCCC[C@H]1Oc1ccccc1C	ZINC000450756193	EE	On-Demand	Anodyne	ADRB2	25	41
CC(=O)c1cccc(CN(C)[C@H](C)C(=O)NC(C)(C)C)c1	ZINC000450756194	CF	On-Demand	Anodyne	CACNA1B	25	42
CC(=O)c1cccc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)c1	ZINC000450756195	CF	On-Demand	Anodyne	CACNA1B	25	42
CNC(=O)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)nn1	ZINC000450756204	FF	On-Demand	Anodyne	SCD1	43	40
CNC(=O)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)nn1	ZINC000450756205	FF	On-Demand	Anodyne	SCD1	43	40
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	HTR1A	32	42
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	DRD2	37	53
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	DRD4	36	40
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	HTR2A	34	40
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	OPRK1	42	44
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	TACR2	53	35
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	SIGMAR1	42	59
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	DNAE	61	35
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	CACNA1G	24	47
COC(=O)CN1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450756213	FG	On-Demand	Anodyne	EBPL	0	40
COc1ccc(NC(=O)c2scnc2C(C)C)cc1[N+](=O)[O-]	ZINC000450756215	DG	On-Demand	Bother	TAAR1	19	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](CO)C(C)(C)C)cc2)c1	ZINC000450756236	FG	On-Demand	Anodyne	ANPEP	15	45
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](CO)C(C)(C)C)cc2)c1	ZINC000450756236	FG	On-Demand	Anodyne	MMP13	16	50
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H](CO)C(C)(C)C)cc2)c1	ZINC000450756236	FG	On-Demand	Anodyne	CTRB_BOVIN	48	36
Cc1noc([C@H]2CCN(c3nc4ccccc4nc3N3CCN(C)CC3)C2)n1	ZINC000450756241	GE	On-Demand	Anodyne	HTR3A	24	46
Cc1noc([C@H]2CCN(c3nc4ccccc4nc3N3CCN(C)CC3)C2)n1	ZINC000450756241	GE	On-Demand	Anodyne	HRH4	15	46
Cc1noc([C@H]2CCN(c3nc4ccccc4nc3N3CCN(C)CC3)C2)n1	ZINC000450756241	GE	On-Demand	Anodyne	SMO	50	35
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3CCN(C)CC3)C2)n1	ZINC000450756244	GE	On-Demand	Anodyne	HTR3A	24	46
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3CCN(C)CC3)C2)n1	ZINC000450756244	GE	On-Demand	Anodyne	HRH4	15	46
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3CCN(C)CC3)C2)n1	ZINC000450756244	GE	On-Demand	Anodyne	SMO	50	35
CCc1cccc(C(=O)NC(C)(C)C(C)(C)CO)n1	ZINC000450756248	CE	On-Demand	Anodyne	PDE5A	0	45
C=CCN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450756251	CD	On-Demand	Mild	SHC	47	37
C=CCN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450756251	CD	On-Demand	Mild	MTNR1A	56	39
C=CCN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450756251	CD	On-Demand	Mild	MTNR1B	43	37
C=CCN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450756251	CD	On-Demand	Mild	LSS	65	43
COc1ccc(CNC(=O)CCN[C@@H]2CC[C@H](C)C[C@H]2C)c(OC)c1	ZINC000450756254	EG	On-Demand	Anodyne	NQO2	29	40
COc1ccc(CNC(=O)CCN[C@@H]2CC[C@H](C)C[C@H]2C)c(OC)c1	ZINC000450756254	EG	On-Demand	Anodyne	MTNR1A	50	38
COc1ccc(CNC(=O)CCN[C@@H]2CC[C@@H](C)C[C@H]2C)c(OC)c1	ZINC000450756255	EG	On-Demand	Anodyne	NQO2	29	40
COc1ccc(CNC(=O)CCN[C@@H]2CC[C@@H](C)C[C@H]2C)c(OC)c1	ZINC000450756255	EG	On-Demand	Anodyne	MTNR1A	50	38
COc1ccc(CNC(=O)CCN[C@@H]2CC[C@H](C)C[C@@H]2C)c(OC)c1	ZINC000450756256	EG	On-Demand	Anodyne	NQO2	29	40
COc1ccc(CNC(=O)CCN[C@@H]2CC[C@H](C)C[C@@H]2C)c(OC)c1	ZINC000450756256	EG	On-Demand	Anodyne	MTNR1A	50	38
COc1ccc(CNC(=O)CCN[C@@H]2CC[C@@H](C)C[C@@H]2C)c(OC)c1	ZINC000450756257	EG	On-Demand	Anodyne	NQO2	29	40
COc1ccc(CNC(=O)CCN[C@@H]2CC[C@@H](C)C[C@@H]2C)c(OC)c1	ZINC000450756257	EG	On-Demand	Anodyne	MTNR1A	50	38
COC(=O)c1csc(CN2CCC(c3c(F)cccc3F)CC2)n1	ZINC000450756279	FH	On-Demand	Anodyne	TRPC6	46	33
C=CCOc1ccc(CC(=O)N2CCN(CC(=O)OC)CC2)cc1	ZINC000450756292	ED	On-Demand	Mild	GPR183	0	43
C[C@H]1CN(Cc2cc(CN3CCC(=O)[C@H](C)C3)cc(C(F)(F)F)c2)CCC1=O	ZINC000450756310	GH	On-Demand	Anodyne	TACR1	15	48
C[C@H]1CN(Cc2cc(CN3CCC(=O)[C@@H](C)C3)cc(C(F)(F)F)c2)CCC1=O	ZINC000450756311	GH	On-Demand	Anodyne	TACR1	15	48
C[C@@H]1CN(Cc2cc(CN3CCC(=O)[C@H](C)C3)cc(C(F)(F)F)c2)CCC1=O	ZINC000450756312	GH	On-Demand	Anodyne	TACR1	15	48
COC(=O)CN1CCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450756315	FC	On-Demand	Anodyne	RHODESAIN	0	41
COC(=O)C[C@@](C)(NCc1ccc(Cl)c(OC)c1)c1ccccn1	ZINC000450756316	EG	On-Demand	Anodyne	PDE6A	44	33
COC(=O)C[C@](C)(NCc1ccc(Cl)c(OC)c1)c1ccccn1	ZINC000450756317	EG	On-Demand	Anodyne	PDE6A	44	33
COC(=O)CN1CCN(C(=O)Cc2ccc(OC)c(OC)c2Cl)CC1	ZINC000450756321	FD	On-Demand	Anodyne	SLC9A1	44	31
O=C(CC[C@@H]1CCCCO1)COc1ccccc1C(F)(F)F	ZINC000450756322	DI	On-Demand	Anodyne	OXTR	26	46
O=C(CC[C@@H]1CCCCO1)COc1ccccc1C(F)(F)F	ZINC000450756322	DI	On-Demand	Anodyne	AVPR1A	0	46
COC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450756359	CG	On-Demand	Anodyne	DRD2	17	43
COC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450756359	CG	On-Demand	Anodyne	SLC6A1	59	34
COC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450756359	CG	On-Demand	Anodyne	DRD3	16	40
COC[C@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450756359	CG	On-Demand	Anodyne	CCR3	47	42
COC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450756361	CG	On-Demand	Anodyne	DRD2	17	43
COC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450756361	CG	On-Demand	Anodyne	SLC6A1	59	34
COC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450756361	CG	On-Demand	Anodyne	DRD3	16	40
COC[C@@H]1CCCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450756361	CG	On-Demand	Anodyne	CCR3	47	42
COCC[C@H]1CCCCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450756375	DG	On-Demand	Anodyne	SLC6A3	17	45
COCC[C@@H]1CCCCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450756379	DG	On-Demand	Anodyne	SLC6A3	17	45
COCC[C@@H]1CCCCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450756380	DG	On-Demand	Anodyne	SLC6A3	17	45
COCC[C@H]1CCCCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450756381	DG	On-Demand	Anodyne	SLC6A3	17	45
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450756399	EG	On-Demand	Anodyne	DRD2	33	48
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450756399	EG	On-Demand	Anodyne	DRD4	0	52
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450756399	EG	On-Demand	Anodyne	ERG2	22	48
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450756399	EG	On-Demand	Anodyne	SLC18A3	0	52
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450756399	EG	On-Demand	Anodyne	CYP2J2	52	37
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450756401	EG	On-Demand	Anodyne	DRD2	33	48
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450756401	EG	On-Demand	Anodyne	DRD4	0	52
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450756401	EG	On-Demand	Anodyne	ERG2	22	48
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450756401	EG	On-Demand	Anodyne	SLC18A3	0	52
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450756401	EG	On-Demand	Anodyne	CYP2J2	52	37
CCCOc1cccc(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450756404	GE	On-Demand	Anodyne	MTNR1A	21	40
CCCOc1cccc(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450756404	GE	On-Demand	Anodyne	TSPAN17	0	40
CCCOc1cccc(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450756404	GE	On-Demand	Anodyne	PDS	42	32
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	DRD2	25	45
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	DRD4	64	42
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	ACHE	21	48
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	VACHT_TETCF	0	44
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	SIGMAR1	45	44
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	CCR3	52	40
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	SLC18A3	32	44
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	MLNR	77	39
CC(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450756408	DI	On-Demand	Anodyne	MCHR1	39	42
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	DRD2	25	45
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	DRD4	64	42
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	ACHE	21	48
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	VACHT_TETCF	0	44
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	SIGMAR1	45	44
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	CCR3	52	40
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	SLC18A3	32	44
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	MLNR	77	39
CC(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450756409	DI	On-Demand	Anodyne	MCHR1	39	42
CCCNc1ccccc1NC(=O)C[C@H]1COc2ccccc2O1	ZINC000450756414	EH	On-Demand	Anodyne	HTR1A	0	43
CCCNc1ccccc1NC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450756416	EH	On-Demand	Anodyne	HTR1A	0	43
CCc1cccc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450756440	GF	On-Demand	Anodyne	RBP4	57	36
CCc1cccc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450756441	GF	On-Demand	Anodyne	RBP4	57	36
CC(=O)c1cccc(CSc2nnc(N3CCCC3)n2Cc2ccco2)c1	ZINC000450756453	GI	On-Demand	Anodyne	HCRTR2	20	49
COC[C@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450756456	CG	On-Demand	Anodyne	SLC6A1	48	32
COC[C@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450756456	CG	On-Demand	Anodyne	MBTD1	0	41
COC[C@@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450756457	CG	On-Demand	Anodyne	SLC6A1	48	32
COC[C@@H]1CCCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450756457	CG	On-Demand	Anodyne	MBTD1	0	41
CO[C@H]1CCN(c2ncncc2-c2ccccc2)CC1(C)C	ZINC000450756469	CG	On-Demand	Anodyne	SLC9A1	21	53
CO[C@@H]1CCN(c2ncncc2-c2ccccc2)CC1(C)C	ZINC000450756470	CG	On-Demand	Anodyne	SLC9A1	21	53
CSc1cccc(C(=O)N(CCO)CC2CCCCC2)c1	ZINC000450756473	DG	On-Demand	Anodyne	ACE	19	42
COc1ccc(CNC(=O)CCN2CCOC[C@H]2[C@H]2CCCC2=O)c(OC)c1	ZINC000450756477	GD	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN2CCOC[C@@H]2[C@H]2CCCC2=O)c(OC)c1	ZINC000450756480	GD	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN2CCOC[C@H]2[C@@H]2CCCC2=O)c(OC)c1	ZINC000450756481	GD	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN2CCOC[C@@H]2[C@@H]2CCCC2=O)c(OC)c1	ZINC000450756482	GD	On-Demand	Anodyne	MTR1B_CHICK	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450756485	DG	On-Demand	Anodyne	SIGMAR1	24	52
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450756485	DG	On-Demand	Anodyne	SLC18A3	49	43
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450756486	DG	On-Demand	Anodyne	SIGMAR1	24	52
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450756486	DG	On-Demand	Anodyne	SLC18A3	49	43
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450756487	DG	On-Demand	Anodyne	SIGMAR1	24	52
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450756487	DG	On-Demand	Anodyne	SLC18A3	49	43
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450756488	DG	On-Demand	Anodyne	SIGMAR1	24	52
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450756488	DG	On-Demand	Anodyne	SLC18A3	49	43
COc1cccc(OCCC(=O)N2CC[C@]3(CC[C@@H](C)C3)C2)c1	ZINC000450756500	DH	On-Demand	Anodyne	MTNR1B	16	41
COc1cccc(OCCC(=O)N2CC[C@@]3(CC[C@@H](C)C3)C2)c1	ZINC000450756501	DH	On-Demand	Anodyne	MTNR1B	16	41
COc1cccc(OCCC(=O)N2CC[C@]3(CC[C@H](C)C3)C2)c1	ZINC000450756503	DH	On-Demand	Anodyne	MTNR1B	16	41
Cc1cc(C)nc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450756526	DG	On-Demand	Bother	SLC27A4	48	32
Cc1cc(C)nc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450756527	DG	On-Demand	Bother	SLC27A4	48	32
COCCC1(CNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CCCCC1	ZINC000450756531	GH	On-Demand	Anodyne	SLC6A9	18	40
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756543	EF	On-Demand	Anodyne	DRD4	28	51
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756543	EF	On-Demand	Anodyne	DRD3	0	44
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756543	EF	On-Demand	Anodyne	SIGMAR1	29	45
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756543	EF	On-Demand	Anodyne	CCR3	27	49
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756543	EF	On-Demand	Anodyne	SLC6A5	29	41
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756543	EF	On-Demand	Anodyne	MCHR1	41	46
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756543	EF	On-Demand	Anodyne	BIRC2	75	38
CNC(=O)N[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756544	EF	On-Demand	Anodyne	DRD4	28	51
CNC(=O)N[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756544	EF	On-Demand	Anodyne	DRD3	0	44
CNC(=O)N[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756544	EF	On-Demand	Anodyne	SIGMAR1	29	45
CNC(=O)N[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756544	EF	On-Demand	Anodyne	CCR3	27	49
CNC(=O)N[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756544	EF	On-Demand	Anodyne	SLC6A5	29	41
CNC(=O)N[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756544	EF	On-Demand	Anodyne	MCHR1	41	46
CNC(=O)N[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756544	EF	On-Demand	Anodyne	BIRC2	75	38
CNC(=O)N[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756545	EF	On-Demand	Anodyne	DRD4	28	51
CNC(=O)N[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756545	EF	On-Demand	Anodyne	DRD3	0	44
CNC(=O)N[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756545	EF	On-Demand	Anodyne	SIGMAR1	29	45
CNC(=O)N[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756545	EF	On-Demand	Anodyne	CCR3	27	49
CNC(=O)N[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756545	EF	On-Demand	Anodyne	SLC6A5	29	41
CNC(=O)N[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756545	EF	On-Demand	Anodyne	MCHR1	41	46
CNC(=O)N[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450756545	EF	On-Demand	Anodyne	BIRC2	75	38
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756546	EF	On-Demand	Anodyne	DRD4	28	51
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756546	EF	On-Demand	Anodyne	DRD3	0	44
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756546	EF	On-Demand	Anodyne	SIGMAR1	29	45
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756546	EF	On-Demand	Anodyne	CCR3	27	49
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756546	EF	On-Demand	Anodyne	SLC6A5	29	41
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756546	EF	On-Demand	Anodyne	MCHR1	41	46
CNC(=O)N[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450756546	EF	On-Demand	Anodyne	BIRC2	75	38
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(CF)CCOCC1	ZINC000450756551	FG	On-Demand	Anodyne	SFRP1	53	34
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(CF)CCOCC1	ZINC000450756552	FG	On-Demand	Anodyne	SFRP1	53	34
CO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450756553	DG	On-Demand	Anodyne	SIRT1	40	32
CO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@H]1C	ZINC000450756561	DG	On-Demand	Anodyne	SIRT1	40	32
CO[C@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450756563	DG	On-Demand	Anodyne	SIRT1	40	32
CO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)C[C@@H]1C	ZINC000450756566	DG	On-Demand	Anodyne	SIRT1	40	32
CNC(=O)N[C@H]1CCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450756573	CD	On-Demand	Anodyne	SSTR5	43	34
CNC(=O)N[C@H]1CCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450756573	CD	On-Demand	Anodyne	CYP3A43	0	41
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450756574	CD	On-Demand	Anodyne	SSTR5	43	34
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450756574	CD	On-Demand	Anodyne	CYP3A43	0	41
COc1cc(N2CC[C@@H](OC)[C@H](C)C2)ncn1	ZINC000450756584	BD	On-Demand	Anodyne	PDE3A	45	34
COc1cc(N2CC[C@H](OC)[C@@H](C)C2)ncn1	ZINC000450756585	BD	On-Demand	Anodyne	PDE3A	45	34
COc1cc(N2CC[C@@H](OC)[C@@H](C)C2)ncn1	ZINC000450756586	BD	On-Demand	Anodyne	PDE3A	45	34
COc1cc(N2CC[C@H](OC)[C@H](C)C2)ncn1	ZINC000450756587	BD	On-Demand	Anodyne	PDE3A	45	34
CO[C@H]1CCN(c2ccc(C(C)=O)cn2)C[C@@H]1C	ZINC000450756590	BE	On-Demand	Anodyne	MCHR1	0	40
CO[C@@H]1CCN(c2ccc(C(C)=O)cn2)C[C@@H]1C	ZINC000450756591	BE	On-Demand	Anodyne	MCHR1	0	40
CO[C@H]1CCN(c2ccc(C(C)=O)cn2)C[C@H]1C	ZINC000450756592	BE	On-Demand	Anodyne	MCHR1	0	40
CO[C@@H]1CCN(c2ccc(C(C)=O)cn2)C[C@H]1C	ZINC000450756593	BE	On-Demand	Anodyne	MCHR1	0	40
CO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1(C)C	ZINC000450756606	EG	On-Demand	Anodyne	PDE3A	43	34
Cc1nc2c3ccccc3nc(SCCC(C)(F)F)n2n1	ZINC000450756607	DH	On-Demand	Anodyne	PDE10A	19	62
CO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1(C)C	ZINC000450756608	EG	On-Demand	Anodyne	PDE3A	43	34
NC(=O)c1cnc(N2CC[C@@H](c3cccc(Br)c3)C2)c(Cl)c1	ZINC000450756640	GH	On-Demand	Anodyne	P2RY12	26	41
NC(=O)c1cnc(N2CC[C@@H](c3cccc(Br)c3)C2)c(Cl)c1	ZINC000450756640	GH	On-Demand	Anodyne	CXCR3	32	46
NC(=O)c1cnc(N2CC[C@H](c3cccc(Br)c3)C2)c(Cl)c1	ZINC000450756644	GH	On-Demand	Anodyne	P2RY12	26	41
NC(=O)c1cnc(N2CC[C@H](c3cccc(Br)c3)C2)c(Cl)c1	ZINC000450756644	GH	On-Demand	Anodyne	CXCR3	32	46
CS(=O)(=O)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)cc1	ZINC000450756646	GH	On-Demand	Anodyne	GPR119	15	45
CS(=O)(=O)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)cc1	ZINC000450756649	GH	On-Demand	Anodyne	GPR119	15	45
COCCNC(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450756654	GF	On-Demand	Bother	ADRA1A	21	41
COCCNC(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450756671	GF	On-Demand	Bother	ADRA1A	21	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCO[C@@H](C2CC2)C1	ZINC000450756680	DE	On-Demand	Anodyne	AKR1C3	27	41
CC[C@@H](CN(CC)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccnc1)c1ccccc1	ZINC000450756682	GH	On-Demand	Anodyne	HSD17B2	69	37
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCO[C@@H](C2CC2)C1	ZINC000450756684	DE	On-Demand	Anodyne	AKR1C3	27	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCO[C@H](C2CC2)C1	ZINC000450756686	DE	On-Demand	Anodyne	AKR1C3	27	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCO[C@H](C2CC2)C1	ZINC000450756688	DE	On-Demand	Anodyne	AKR1C3	27	41
CC(C)CN(Cc1cn(CC2CC2)nn1)[C@H]1CCCc2cccnc21	ZINC000450756694	EH	On-Demand	Anodyne	CXCR4	87	47
CC(C)CN(Cc1cn(CC2CC2)nn1)[C@@H]1CCCc2cccnc21	ZINC000450756696	EH	On-Demand	Anodyne	CXCR4	87	47
O=C(C1CC1)[C@@H]1CN(CC/C=C/c2ccccc2)CCO1	ZINC000450756700	CF	On-Demand	Anodyne	SLC6A1	81	39
O=C(C1CC1)[C@H]1CN(CC/C=C/c2ccccc2)CCO1	ZINC000450756702	CF	On-Demand	Anodyne	SLC6A1	81	39
O=C(NCCO)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000450756703	FD	On-Demand	Bother	SCD1	47	45
O=C(C1CC1)[C@@H]1CN(CC/C=C\c2ccccc2)CCO1	ZINC000450756705	CF	On-Demand	Anodyne	SLC6A1	81	39
O=C(NCCO)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000450756706	FD	On-Demand	Bother	SCD1	47	45
O=C(C1CC1)[C@H]1CN(CC/C=C\c2ccccc2)CCO1	ZINC000450756708	CF	On-Demand	Anodyne	SLC6A1	81	39
COC(=O)c1coc(CSc2cc(C(=O)NC3CC3)c3ccccc3n2)n1	ZINC000450756709	GG	On-Demand	Anodyne	TACR3	25	40
COC(=O)c1coc(CSc2cc(C(=O)NC3CC3)c3ccccc3n2)n1	ZINC000450756709	GG	On-Demand	Anodyne	TNKS	59	33
CC(C)(CC(=O)Cn1cnc2cc(Cl)ccc2c1=O)C1CC1	ZINC000450756724	DG	On-Demand	Anodyne	HRP1_PLAFA	45	36
CC(=O)N=c1cc[nH]cc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450756739	GD	On-Demand	Anodyne	RORC	40	32
CCc1cccc(C(=O)Nc2sc(CC)nc2C)n1	ZINC000450756759	CG	On-Demand	Anodyne	PDE5A	26	43
COC(=O)CN1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC1	ZINC000450756762	GD	On-Demand	Anodyne	TRPC6	91	52
COC(=O)CN1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC1	ZINC000450756762	GD	On-Demand	Anodyne	TRPC3	67	52
C[C@@H](Oc1ccccn1)C(=O)Nc1cccc(CCCO)c1	ZINC000450756783	DE	On-Demand	Anodyne	GUAB	0	40
C[C@@H](Oc1ccccn1)C(=O)Nc1cccc(CCCO)c1	ZINC000450756783	DE	On-Demand	Anodyne	IMDH_CRYPV	30	40
C[C@H](Oc1ccccn1)C(=O)Nc1cccc(CCCO)c1	ZINC000450756784	DE	On-Demand	Anodyne	GUAB	0	40
C[C@H](Oc1ccccn1)C(=O)Nc1cccc(CCCO)c1	ZINC000450756784	DE	On-Demand	Anodyne	IMDH_CRYPV	30	40
COC(=O)c1csc(CN2CCN(C3CC3)c3cc(F)ccc32)n1	ZINC000450756786	EG	On-Demand	Anodyne	SCD1	0	40
CCOC(=O)c1cc(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)on1	ZINC000450756812	FF	On-Demand	Anodyne	MTTP	49	33
CCOC(=O)c1cc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)on1	ZINC000450756814	FF	On-Demand	Anodyne	MTTP	49	33
CC(=O)c1cccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c1	ZINC000450756819	EH	On-Demand	Anodyne	CHRM3	20	43
CC(=O)c1cccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c1	ZINC000450756819	EH	On-Demand	Anodyne	SIGMAR1	32	47
CC(=O)c1cccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c1	ZINC000450756819	EH	On-Demand	Anodyne	CCR3	32	44
CC(=O)c1cccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c1	ZINC000450756819	EH	On-Demand	Anodyne	MCHR2	48	39
CC(=O)c1cccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)c1	ZINC000450756819	EH	On-Demand	Anodyne	CACNA1G	19	40
COC(=O)CN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450756833	GC	On-Demand	Anodyne	HTR1A	31	43
COC(=O)CN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450756833	GC	On-Demand	Anodyne	DRD2	28	42
COC(=O)CN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450756833	GC	On-Demand	Anodyne	DRD4	46	35
COC(=O)CN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450756833	GC	On-Demand	Anodyne	DRD3	42	37
COC(=O)CN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450756833	GC	On-Demand	Anodyne	HTR7	42	46
COC(=O)CN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450756833	GC	On-Demand	Anodyne	MTNR1A	69	39
COC(=O)CN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450756833	GC	On-Demand	Anodyne	MTNR1B	59	39
Cc1cc(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)ncc1C(N)=O	ZINC000450756838	GF	On-Demand	Anodyne	G2YM83_BOTF4	44	33
CC(=O)c1ccc(C#N)c(N2CC[C@H](c3nc(C)no3)C2)c1	ZINC000450756844	CE	On-Demand	Mild	ETHR	42	34
CC(=O)c1ccc(C#N)c(N2CC[C@@H](c3nc(C)no3)C2)c1	ZINC000450756846	CE	On-Demand	Mild	ETHR	42	34
C[C@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)C[C@H](O)Cc1ccccc1	ZINC000450756851	GF	On-Demand	Anodyne	BACE2	0	43
C[C@@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)C[C@H](O)Cc1ccccc1	ZINC000450756854	GF	On-Demand	Anodyne	BACE2	0	43
CCN1C[C@@H](Nc2ncnc3cc(Cl)ccc23)CC1=O	ZINC000450756855	CE	On-Demand	Anodyne	HRP1_PLAFA	89	35
CCN1C[C@@H](Nc2ncnc3cc(Cl)ccc23)CC1=O	ZINC000450756855	CE	On-Demand	Anodyne	HNMT	40	31
CCN1C[C@H](Nc2ncnc3cc(Cl)ccc23)CC1=O	ZINC000450756856	CE	On-Demand	Anodyne	HRP1_PLAFA	89	35
CCN1C[C@H](Nc2ncnc3cc(Cl)ccc23)CC1=O	ZINC000450756856	CE	On-Demand	Anodyne	HNMT	40	31
CCc1nc(C)c(NC(=O)c2cccc(SC)c2)s1	ZINC000450756865	CH	On-Demand	Anodyne	KCNK3	56	35
CN(CCN1CCO[C@H](C2CC2)C1)Cc1ccccc1	ZINC000450756890	CE	On-Demand	Anodyne	SIGMAR1	30	45
CN(CCN1CCO[C@@H](C2CC2)C1)Cc1ccccc1	ZINC000450756891	CE	On-Demand	Anodyne	SIGMAR1	30	45
CCS(=O)(=O)c1ccc(CN2CCC(c3ccsc3)CC2)cc1	ZINC000450756901	EH	On-Demand	Anodyne	SIGMAR1	17	40
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	HTR1A	67	51
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	DRD2	59	49
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	DRD1	22	44
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	DRD4	39	49
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	HTR2A	37	49
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	HTR2C	21	46
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	HRH1	15	49
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	DRD3	52	49
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	HTR7	85	51
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	SIGMAR1	15	49
O=C(CCCN1CCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450756904	GG	On-Demand	Anodyne	CYP2J2	59	42
CC(C)(C)[C@@H](CO)NC(=O)c1ccc(I)cc1F	ZINC000450756913	FF	On-Demand	Anodyne	MAP2K1	53	37
COC(=O)CN1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450756918	GC	On-Demand	Anodyne	SLC6A9	0	41
COC(=O)C1(CNC(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450756929	CD	On-Demand	Anodyne	CAN2	0	47
CC(C)(C(=O)N1CCC(c2ccsc2)CC1)C1CCC1	ZINC000450756935	CI	On-Demand	Anodyne	NPBWR1	47	32
O=C1NCCN(C(=O)CSC2CC2)[C@H]1c1ccccc1C(F)(F)F	ZINC000450756943	FF	On-Demand	Anodyne	RBP4	61	40
O=C1NCCN(C(=O)CSC2CC2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450756944	FF	On-Demand	Anodyne	RBP4	61	40
COC(=O)C1(CNC(=O)c2cc(OC)ccc2OC(F)(F)F)CC1	ZINC000450756946	EE	On-Demand	Anodyne	KCNK3	20	41
COC(=O)C1(CNC(=O)c2cc(OC)ccc2OC(F)(F)F)CC1	ZINC000450756946	EE	On-Demand	Anodyne	KCNK9	20	41
CC(C)CCCC(=O)N1CCC(c2ccsc2)CC1	ZINC000450756950	CI	On-Demand	Anodyne	CCR1	35	41
CC(C)CCCC(=O)N1CCC(c2ccsc2)CC1	ZINC000450756950	CI	On-Demand	Anodyne	ETHR	50	44
CC(=O)[C@@](C)(O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450757004	DF	On-Demand	Anodyne	CCR3	49	38
CC(=O)[C@@](C)(O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450757004	DF	On-Demand	Anodyne	CACNA1I	49	36
CC(=O)[C@](C)(O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450757006	DF	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)[C@](C)(O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450757006	DF	On-Demand	Anodyne	CCR3	49	38
CC(=O)[C@](C)(O)CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450757006	DF	On-Demand	Anodyne	CACNA1I	49	36
COC(=O)C1(CNC(=O)c2cccc(SC)c2)CC1	ZINC000450757021	CE	On-Demand	Anodyne	DRD4	42	32
C[C@@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCC1=O	ZINC000450757025	FG	On-Demand	Anodyne	HRH4	29	48
C[C@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCC1=O	ZINC000450757026	FG	On-Demand	Anodyne	HRH4	29	48
CCCNc1ccccc1NC(=O)Cc1sccc1Br	ZINC000450757032	FJ	On-Demand	Anodyne	MAPK10	16	40
Clc1ccc(CCSCCN2CCOCC2)cc1	ZINC000450757037	CF	On-Demand	Anodyne	SIGMAR1	19	43
CO[C@@H]1CCN(c2ncnc3c(F)cccc23)CC1(C)C	ZINC000450757043	CG	On-Demand	Anodyne	PDE3A	45	34
CO[C@H]1CCN(c2ncnc3c(F)cccc23)CC1(C)C	ZINC000450757046	CG	On-Demand	Anodyne	PDE3A	45	34
c1ccc2c(c1)CO[C@]21CCCN(Cc2cnns2)C1	ZINC000450757058	CF	On-Demand	Anodyne	SIGMAR1	20	40
c1ccc2c(c1)CO[C@@]21CCCN(Cc2cnns2)C1	ZINC000450757059	CF	On-Demand	Anodyne	SIGMAR1	20	40
CN(CCN(C)Cc1ccccc1)CCN(C)C1CC1	ZINC000450757068	CE	On-Demand	Anodyne	SIGMAR1	20	43
CCCCCn1cnc2c1c(=O)n(Cc1cn(C)nc1C)c(=O)n2CCCC	ZINC000450757078	GE	On-Demand	Anodyne	CHIB1	0	40
COC(=O)c1ccc(CNC(C)(C)c2nc3ccccc3n2C)cc1Cl	ZINC000450757084	FI	On-Demand	Anodyne	DNAE	74	33
COc1ccc2c(N3CC[C@@H](OC)C(C)(C)C3)ncnc2c1F	ZINC000450757107	DG	On-Demand	Anodyne	PDE3A	49	38
COc1ccc2c(N3CC[C@H](OC)C(C)(C)C3)ncnc2c1F	ZINC000450757108	DG	On-Demand	Anodyne	PDE3A	49	38
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757111	DG	On-Demand	Anodyne	MC4R	53	41
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757111	DG	On-Demand	Anodyne	PRCP	55	42
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757111	DG	On-Demand	Anodyne	MC3R	47	42
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757111	DG	On-Demand	Anodyne	MC5R	32	42
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757112	DG	On-Demand	Anodyne	MC4R	53	41
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757112	DG	On-Demand	Anodyne	PRCP	55	42
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757112	DG	On-Demand	Anodyne	MC3R	47	42
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757112	DG	On-Demand	Anodyne	MC5R	32	42
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757113	DG	On-Demand	Anodyne	MC4R	53	41
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757113	DG	On-Demand	Anodyne	PRCP	55	42
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757113	DG	On-Demand	Anodyne	MC3R	47	42
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757113	DG	On-Demand	Anodyne	MC5R	32	42
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757114	DG	On-Demand	Anodyne	MC4R	53	41
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757114	DG	On-Demand	Anodyne	PRCP	55	42
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757114	DG	On-Demand	Anodyne	MC3R	47	42
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCC1=O	ZINC000450757114	DG	On-Demand	Anodyne	MC5R	32	42
O=C(CCCN1CCSC2(CCOCC2)C1)c1ccc(Br)cc1	ZINC000450757121	GI	On-Demand	Anodyne	CYP2J2	49	36
CC[C@@H](CN(CC)C(=O)CCCc1ncc(C)o1)c1ccccc1	ZINC000450757159	EI	On-Demand	Anodyne	CES1D	45	32
CC[C@H](CN(CC)C(=O)CCCc1ncc(C)o1)c1ccccc1	ZINC000450757160	EI	On-Demand	Anodyne	CES1D	45	32
CCOC(=O)CN(C[C@H](O)[C@H](C)c1ccccc1)C1CCC1	ZINC000450757161	DF	On-Demand	Anodyne	AMY2	46	33
CCOC(=O)CN(C[C@@H](O)[C@H](C)c1ccccc1)C1CCC1	ZINC000450757162	DF	On-Demand	Anodyne	AMY2	46	33
CCOC(=O)CN(C[C@@H](O)[C@@H](C)c1ccccc1)C1CCC1	ZINC000450757163	DF	On-Demand	Anodyne	AMY2	46	33
CCOC(=O)CN(C[C@H](O)[C@@H](C)c1ccccc1)C1CCC1	ZINC000450757164	DF	On-Demand	Anodyne	AMY2	46	33
COC(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000450757165	EF	On-Demand	Bother	SLC27A4	51	35
COC(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000450757166	EF	On-Demand	Bother	SLC27A4	51	35
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450757167	FF	On-Demand	Anodyne	HSD11B1	0	45
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450757167	FF	On-Demand	Anodyne	LIPG	40	33
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450757167	FF	On-Demand	Anodyne	SFRP1	44	34
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450757168	FF	On-Demand	Anodyne	HSD11B1	0	45
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450757168	FF	On-Demand	Anodyne	LIPG	40	33
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450757168	FF	On-Demand	Anodyne	SFRP1	44	34
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450757169	FF	On-Demand	Anodyne	HSD11B1	0	45
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450757169	FF	On-Demand	Anodyne	LIPG	40	33
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450757169	FF	On-Demand	Anodyne	SFRP1	44	34
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450757170	FF	On-Demand	Anodyne	HSD11B1	0	45
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450757170	FF	On-Demand	Anodyne	LIPG	40	33
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450757170	FF	On-Demand	Anodyne	SFRP1	44	34
COc1ccc(CN2CCCN(C[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757178	GF	On-Demand	Anodyne	SIGMAR1	18	48
COc1ccc(CN2CCCN(C[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757178	GF	On-Demand	Anodyne	NOX4	15	40
COc1ccc(CN2CCCN(C[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757178	GF	On-Demand	Anodyne	CYBB	34	40
COc1ccc(CN2CCCN(C[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757178	GF	On-Demand	Anodyne	NOX1	38	40
COc1ccc(CN2CCCN(C[C@@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757178	GF	On-Demand	Anodyne	NOX5	38	40
COc1ccc(CN2CCCN(C[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757183	GF	On-Demand	Anodyne	SIGMAR1	18	48
COc1ccc(CN2CCCN(C[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757183	GF	On-Demand	Anodyne	NOX4	15	40
COc1ccc(CN2CCCN(C[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757183	GF	On-Demand	Anodyne	CYBB	34	40
COc1ccc(CN2CCCN(C[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757183	GF	On-Demand	Anodyne	NOX1	38	40
COc1ccc(CN2CCCN(C[C@H](Cc3ccccc3)OC)CC2=O)cc1	ZINC000450757183	GF	On-Demand	Anodyne	NOX5	38	40
CCOC(=O)c1cnccc1N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000450757185	FH	On-Demand	Bother	SLC27A4	54	36
CCOC(=O)c1cnccc1N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000450757187	FH	On-Demand	Bother	SLC27A4	54	36
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	CACNA1H	26	45
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	DRD2	17	46
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	DRD4	37	48
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	SLC6A1	56	51
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	DRD3	16	43
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	AVPR1A	17	40
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	LTA4H	15	43
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	SIGMAR1	38	48
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	CCR3	41	42
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	CCR5	16	42
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	UTS2R	23	45
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	CCR2	18	46
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	SLC6A5	29	46
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	EPHX2	23	44
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	CXCR3	35	41
CNC(=O)N[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757210	CD	On-Demand	Anodyne	BIRC2	95	54
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	CACNA1H	26	45
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	DRD2	17	46
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	DRD4	37	48
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	SLC6A1	56	51
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	DRD3	16	43
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	AVPR1A	17	40
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	LTA4H	15	43
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	SIGMAR1	38	48
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	CCR3	41	42
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	CCR5	16	42
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	UTS2R	23	45
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	CCR2	18	46
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	SLC6A5	29	46
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	EPHX2	23	44
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	CXCR3	35	41
CNC(=O)N[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450757211	CD	On-Demand	Anodyne	BIRC2	95	54
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757216	GG	On-Demand	Anodyne	SIGMAR1	15	47
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757216	GG	On-Demand	Anodyne	CCR3	17	42
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757216	GG	On-Demand	Anodyne	MTNR1A	30	40
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757216	GG	On-Demand	Anodyne	MTNR1B	0	40
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757216	GG	On-Demand	Anodyne	LIPG	40	35
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757216	GG	On-Demand	Anodyne	SFRP1	97	35
O=C(Cc1ccc(O)c(F)c1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757216	GG	On-Demand	Anodyne	WNT3	61	33
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757217	GG	On-Demand	Anodyne	SIGMAR1	15	47
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757217	GG	On-Demand	Anodyne	CCR3	17	42
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757217	GG	On-Demand	Anodyne	MTNR1A	30	40
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757217	GG	On-Demand	Anodyne	MTNR1B	0	40
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757217	GG	On-Demand	Anodyne	LIPG	40	35
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757217	GG	On-Demand	Anodyne	SFRP1	97	35
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757217	GG	On-Demand	Anodyne	WNT3	61	33
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](OC)[C@@H](C)C1	ZINC000450757228	FG	On-Demand	Anodyne	ATP4A	19	49
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](OC)[C@H](C)C1	ZINC000450757229	FG	On-Demand	Anodyne	ATP4A	19	49
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](OC)[C@H](C)C1	ZINC000450757230	FG	On-Demand	Anodyne	ATP4A	19	49
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](OC)[C@@H](C)C1	ZINC000450757231	FG	On-Demand	Anodyne	ATP4A	19	49
C[C@H](CN1CCN(c2c(Cl)cccc2Cl)CC1)S(C)(=O)=O	ZINC000450757232	FF	On-Demand	Anodyne	DRD3	22	40
C[C@@H](CN1CCN(c2c(Cl)cccc2Cl)CC1)S(C)(=O)=O	ZINC000450757233	FF	On-Demand	Anodyne	DRD3	22	40
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccccc1	ZINC000450757237	CE	On-Demand	Anodyne	DRD2	29	42
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccccc1	ZINC000450757237	CE	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccccc1	ZINC000450757237	CE	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccccc1	ZINC000450757237	CE	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccccc1	ZINC000450757238	CE	On-Demand	Anodyne	DRD2	29	42
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccccc1	ZINC000450757238	CE	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccccc1	ZINC000450757238	CE	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccccc1	ZINC000450757238	CE	On-Demand	Anodyne	CYP2J2	59	42
CC[C@@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757248	EG	On-Demand	Anodyne	NQO2	29	40
CC[C@@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757248	EG	On-Demand	Anodyne	MTR1B_CHICK	0	42
CC[C@@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757248	EG	On-Demand	Anodyne	MTNR1A	54	39
CC[C@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757249	EG	On-Demand	Anodyne	NQO2	29	40
CC[C@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757249	EG	On-Demand	Anodyne	MTR1B_CHICK	0	42
CC[C@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757249	EG	On-Demand	Anodyne	MTNR1A	54	39
CC[C@@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757251	EG	On-Demand	Anodyne	NQO2	29	40
CC[C@@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757251	EG	On-Demand	Anodyne	MTR1B_CHICK	0	42
CC[C@@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757251	EG	On-Demand	Anodyne	MTNR1A	54	39
CC[C@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757252	EG	On-Demand	Anodyne	NQO2	29	40
CC[C@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757252	EG	On-Demand	Anodyne	MTR1B_CHICK	0	42
CC[C@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450757252	EG	On-Demand	Anodyne	MTNR1A	54	39
CC(C)(C)[C@@H](CO)NC(=O)c1ccc2cnccc2c1	ZINC000450757257	CE	On-Demand	Anodyne	AKT1	25	48
COCCOC[C@@H](O)CN1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450757279	ED	On-Demand	Anodyne	ABCB1	60	38
COCCOC[C@H](O)CN1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450757280	ED	On-Demand	Anodyne	ABCB1	60	38
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCO[C@@H](C2CC2)C1	ZINC000450757292	EF	On-Demand	Bother	LIPG	50	33
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCO[C@H](C2CC2)C1	ZINC000450757293	EF	On-Demand	Bother	LIPG	50	33
CN(CCN1CCCC2(CC2)C1)Cc1ccccc1	ZINC000450757314	CF	On-Demand	Anodyne	SIGMAR1	39	45
CN(CCN1CCCC2(CC2)C1)Cc1ccccc1	ZINC000450757314	CF	On-Demand	Anodyne	SLC12A5	54	33
CCN1C[C@@H](Nc2ncnc3ccc(I)cc23)CC1=O	ZINC000450757315	GE	On-Demand	Anodyne	CD38	56	39
CCN1C[C@H](Nc2ncnc3ccc(I)cc23)CC1=O	ZINC000450757316	GE	On-Demand	Anodyne	CD38	56	39
C[C@@H](O)CCN1CCC(c2c(F)cccc2F)CC1	ZINC000450757330	CF	On-Demand	Anodyne	CCR5	42	38
C[C@H](O)CCN1CCC(c2c(F)cccc2F)CC1	ZINC000450757332	CF	On-Demand	Anodyne	CCR5	42	38
Cc1nc(C)n(CCCC(=O)Nc2cn(Cc3ccccc3)nn2)n1	ZINC000450757333	ED	On-Demand	Anodyne	HDAC10	23	43
COc1cccc(OCCC(=O)N[C@H]2CN(c3ccccc3)C2=O)c1	ZINC000450757358	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)N[C@H]2CN(c3ccccc3)C2=O)c1	ZINC000450757358	ED	On-Demand	Anodyne	MTNR1A	30	43
COc1cccc(OCCC(=O)N[C@H]2CN(c3ccccc3)C2=O)c1	ZINC000450757358	ED	On-Demand	Anodyne	MTNR1B	29	48
COc1cccc(OCCC(=O)N[C@@H]2CN(c3ccccc3)C2=O)c1	ZINC000450757359	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)N[C@@H]2CN(c3ccccc3)C2=O)c1	ZINC000450757359	ED	On-Demand	Anodyne	MTNR1A	30	43
COc1cccc(OCCC(=O)N[C@@H]2CN(c3ccccc3)C2=O)c1	ZINC000450757359	ED	On-Demand	Anodyne	MTNR1B	29	48
COC(=O)c1coc(CSc2nnc(C(C)C)n2Cc2ccco2)n1	ZINC000450757381	FG	On-Demand	Anodyne	HCRTR2	21	44
COC(=O)CN1CCN(C(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450757391	DC	On-Demand	Anodyne	TRPV1	22	45
COC(=O)CN1CCN(C(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450757391	DC	On-Demand	Anodyne	NCE103	27	41
COC(=O)CN1CCN(C(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450757391	DC	On-Demand	Anodyne	CAN2	0	41
COc1ccc(CNC(=O)CCN[C@@H]2CCCCC2(C)C)c(OC)c1	ZINC000450757408	EG	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@H]2CCCCC2(C)C)c(OC)c1	ZINC000450757409	EG	On-Demand	Anodyne	MTNR1A	48	36
C=C[C@@H]1OCC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450757414	DG	On-Demand	Mild	HTT	0	43
COC(=O)CN1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC000450757416	DC	On-Demand	Anodyne	HRH4	26	67
O=C(CCCC(=O)C1CC1)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450757420	EE	On-Demand	Anodyne	F11	41	36
O=C(CCCC(=O)C1CC1)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450757422	EE	On-Demand	Anodyne	F11	41	36
CN(CCN1C[C@H](O)C2(CC2)C1)Cc1ccccc1	ZINC000450757445	CD	On-Demand	Anodyne	SIGMAR1	21	42
CN(CCN1C[C@@H](O)C2(CC2)C1)Cc1ccccc1	ZINC000450757447	CD	On-Demand	Anodyne	SIGMAR1	21	42
O=C(Nc1cccc(CCCO)c1)c1cccc(C(F)(F)F)n1	ZINC000450757476	DG	On-Demand	Anodyne	GRM4	20	40
O=C(Nc1cccc(CCCO)c1)c1cccc(C(F)(F)F)n1	ZINC000450757476	DG	On-Demand	Anodyne	SHH	27	41
O=C(Nc1cccc(CCCO)c1)c1cccc(C(F)(F)F)n1	ZINC000450757476	DG	On-Demand	Anodyne	KCNK3	49	37
O=C(Nc1cccc(CCCO)c1)c1cccc(C(F)(F)F)n1	ZINC000450757476	DG	On-Demand	Anodyne	KCNK9	43	33
CCSc1cccnc1C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2	ZINC000450757482	GI	On-Demand	Anodyne	G2YM83_BOTF4	53	38
CC[C@@](NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)(C(N)=O)C(C)C	ZINC000450757484	FG	On-Demand	Anodyne	GPR88	0	44
CC[C@@](NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1)(C(N)=O)C(C)C	ZINC000450757492	FF	On-Demand	Anodyne	ACACA	47	36
CC[C@](NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1)(C(N)=O)C(C)C	ZINC000450757494	FF	On-Demand	Anodyne	ACACA	47	36
COC(=O)c1ccc(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000450757506	FG	On-Demand	Anodyne	TACR1	16	47
COC(=O)c1ccc(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000450757506	FG	On-Demand	Anodyne	MTTP	68	40
COC(=O)c1ccc(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000450757508	FG	On-Demand	Anodyne	TACR1	16	47
COC(=O)c1ccc(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000450757508	FG	On-Demand	Anodyne	MTTP	68	40
O=C(Nc1ccccc1NCC1CCCCC1)c1ccn(CCn2cccn2)n1	ZINC000450757513	GI	On-Demand	Anodyne	PIM1	42	37
CC(C)CCCC(=O)Nc1cccc(CCCO)c1	ZINC000450757517	CG	On-Demand	Anodyne	PARP10	0	41
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccccc1	ZINC000450757518	CE	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccccc1	ZINC000450757518	CE	On-Demand	Anodyne	HTR5A	25	52
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccccc1	ZINC000450757518	CE	On-Demand	Anodyne	CHRNA6	0	40
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccccc1	ZINC000450757518	CE	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccccc1	ZINC000450757518	CE	On-Demand	Anodyne	CYP2J2	55	39
COc1cc(CC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)ccc1O	ZINC000450757519	FI	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)ccc1O	ZINC000450757520	FI	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)ccc1O	ZINC000450757521	FI	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)ccc1O	ZINC000450757522	FI	On-Demand	Anodyne	TRPV1	0	40
C=C[C@@H]1OCC[C@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450757536	DG	On-Demand	Mild	AADAC	0	45
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@H]2OC)c(OC)c1	ZINC000450757557	FE	On-Demand	Anodyne	MTNR1A	73	37
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@H]2OC)c(OC)c1	ZINC000450757557	FE	On-Demand	Anodyne	MTNR1B	59	38
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2OC)c(OC)c1	ZINC000450757558	FE	On-Demand	Anodyne	MTNR1A	73	37
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2OC)c(OC)c1	ZINC000450757558	FE	On-Demand	Anodyne	MTNR1B	59	38
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@@H]2OC)c(OC)c1	ZINC000450757559	FE	On-Demand	Anodyne	MTNR1A	73	37
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@@H]2OC)c(OC)c1	ZINC000450757559	FE	On-Demand	Anodyne	MTNR1B	59	38
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@@H]2OC)c(OC)c1	ZINC000450757560	FE	On-Demand	Anodyne	MTNR1A	73	37
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@@H]2OC)c(OC)c1	ZINC000450757560	FE	On-Demand	Anodyne	MTNR1B	59	38
Cc1cccc(CSc2nc(C(F)(F)F)ns2)c1	ZINC000450757586	CI	On-Demand	Anodyne	PETD	0	48
CCCNc1ccccc1NC(=O)CS(=O)(=O)C1CC1	ZINC000450757599	CE	On-Demand	Anodyne	CCR8	41	33
O=C(Cc1ccc(OC(F)F)c(F)c1)N(CCO)CC1CCCCC1	ZINC000450757607	FG	On-Demand	Anodyne	PDEC	0	43
O=C(c1cc2cccnc2s1)N1CCC(c2ccsc2)CC1	ZINC000450757610	EI	On-Demand	Anodyne	NPBWR1	47	31
CCC[C@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757736	EG	On-Demand	Anodyne	KCNQ2	48	36
CCC[C@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757736	EG	On-Demand	Anodyne	MTNR1A	30	42
CCC[C@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757736	EG	On-Demand	Anodyne	MTNR1B	0	42
CCC[C@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757736	EG	On-Demand	Anodyne	SFRP1	69	36
CCC[C@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757736	EG	On-Demand	Anodyne	WNT3	49	30
CCC[C@@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757737	EG	On-Demand	Anodyne	KCNQ2	48	36
CCC[C@@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757737	EG	On-Demand	Anodyne	MTNR1A	30	42
CCC[C@@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757737	EG	On-Demand	Anodyne	MTNR1B	0	42
CCC[C@@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757737	EG	On-Demand	Anodyne	SFRP1	69	36
CCC[C@@H](OC)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757737	EG	On-Demand	Anodyne	WNT3	49	30
CCC[C@@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757738	EG	On-Demand	Anodyne	KCNQ2	48	36
CCC[C@@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757738	EG	On-Demand	Anodyne	MTNR1A	30	42
CCC[C@@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757738	EG	On-Demand	Anodyne	MTNR1B	0	42
CCC[C@@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757738	EG	On-Demand	Anodyne	SFRP1	69	36
CCC[C@@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757738	EG	On-Demand	Anodyne	WNT3	49	30
CCC[C@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757739	EG	On-Demand	Anodyne	KCNQ2	48	36
CCC[C@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757739	EG	On-Demand	Anodyne	MTNR1A	30	42
CCC[C@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757739	EG	On-Demand	Anodyne	MTNR1B	0	42
CCC[C@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757739	EG	On-Demand	Anodyne	SFRP1	69	36
CCC[C@H](OC)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450757739	EG	On-Demand	Anodyne	WNT3	49	30
COCCC1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450757742	GG	On-Demand	Anodyne	SLC6A9	29	42
COCCC1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450757742	GG	On-Demand	Anodyne	HCN1	53	33
COCCC1(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CCCCC1	ZINC000450757742	GG	On-Demand	Anodyne	HCN4	51	33
COCCC1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCCCC1	ZINC000450757756	FI	On-Demand	Anodyne	HCN1	57	34
COCCC1(CNC(=O)c2cn(CC(C)C)nc2C(F)F)CCCCC1	ZINC000450757756	FI	On-Demand	Anodyne	HCN4	50	34
Cc1nc(N(C)C)nc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450757757	EF	On-Demand	Bother	SLC27A4	50	33
Cc1nc(N(C)C)nc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450757758	EF	On-Demand	Bother	SLC27A4	50	33
CO[C@@H]1CCN(c2ncnc3c(C)csc23)C[C@@H]1C	ZINC000450757759	CF	On-Demand	Anodyne	PDE3B	67	34
CO[C@H]1CCN(c2ncnc3c(C)csc23)C[C@H]1C	ZINC000450757760	CF	On-Demand	Anodyne	PDE3B	67	34
CO[C@@H]1CCN(c2ncnc3c(C)csc23)C[C@H]1C	ZINC000450757761	CF	On-Demand	Anodyne	PDE3B	67	34
CO[C@H]1CCN(c2ncnc3c(C)csc23)C[C@@H]1C	ZINC000450757762	CF	On-Demand	Anodyne	PDE3B	67	34
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCN(C2CCC2)C1	ZINC000450757765	GH	On-Demand	Anodyne	TACR2	45	38
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCN(C2CCC2)C1	ZINC000450757765	GH	On-Demand	Anodyne	SLC12A5	45	34
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCN(C2CCC2)C1	ZINC000450757766	GH	On-Demand	Anodyne	TACR2	45	38
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H]1CCCN(C2CCC2)C1	ZINC000450757766	GH	On-Demand	Anodyne	SLC12A5	45	34
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450757768	GH	On-Demand	Anodyne	TACR2	45	38
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450757768	GH	On-Demand	Anodyne	SLC12A5	45	34
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450757770	GH	On-Demand	Anodyne	TACR2	45	38
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450757770	GH	On-Demand	Anodyne	SLC12A5	45	34
CNC(=O)N[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450757772	CD	On-Demand	Anodyne	DRD2	27	44
CNC(=O)N[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450757772	CD	On-Demand	Anodyne	CYP3A43	0	47
CNC(=O)N[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450757774	CD	On-Demand	Anodyne	DRD2	27	44
CNC(=O)N[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450757774	CD	On-Demand	Anodyne	CYP3A43	0	47
CCC(=O)C1(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)CC1	ZINC000450757784	FG	On-Demand	Anodyne	SFRP1	63	34
CCC(=O)C1(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)CC1	ZINC000450757786	FG	On-Demand	Anodyne	SFRP1	63	34
CCOC(=O)CN(Cc1ccccc1OC1CC1)C1CCC1	ZINC000450757787	DG	On-Demand	Anodyne	MBTPS1	45	33
COCCC1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450757792	FH	On-Demand	Anodyne	TRPV1	26	46
COCCC1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450757792	FH	On-Demand	Anodyne	NCE103	26	44
COCCC1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450757792	FH	On-Demand	Anodyne	P96878_MYCTU	17	44
COCCC1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450757792	FH	On-Demand	Anodyne	HCN1	40	33
COCCC1(CNC(=O)Cc2ccc(Cl)c(OC)c2)CCCCC1	ZINC000450757792	FH	On-Demand	Anodyne	CAN2	0	44
CO[C@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@H]1C	ZINC000450757813	FG	On-Demand	Anodyne	AVPR2	42	37
CO[C@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@H]1C	ZINC000450757813	FG	On-Demand	Anodyne	HCRTR1	44	35
CO[C@@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@H]1C	ZINC000450757815	FG	On-Demand	Anodyne	AVPR2	42	37
CO[C@@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@H]1C	ZINC000450757815	FG	On-Demand	Anodyne	HCRTR1	44	35
CO[C@@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@@H]1C	ZINC000450757817	FG	On-Demand	Anodyne	AVPR2	42	37
CO[C@@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@@H]1C	ZINC000450757817	FG	On-Demand	Anodyne	HCRTR1	44	35
CO[C@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@@H]1C	ZINC000450757819	FG	On-Demand	Anodyne	AVPR2	42	37
CO[C@H]1CCN(c2ncccc2C(=O)N2CCc3ccccc32)C[C@@H]1C	ZINC000450757819	FG	On-Demand	Anodyne	HCRTR1	44	35
COC(=O)c1ccc(CN2CCO[C@H](COCC3CC3)C2)cc1Cl	ZINC000450757823	FF	On-Demand	Anodyne	DRD4	25	50
COC(=O)c1ccc(CN2CCO[C@@H](COCC3CC3)C2)cc1Cl	ZINC000450757824	FF	On-Demand	Anodyne	DRD4	25	50
Clc1cccc(Cl)c1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450757846	DE	On-Demand	Anodyne	DRD4	35	44
CCc1cc(N[C@H]2CC(=O)N(CC)C2)n2ncnc2n1	ZINC000450757867	CC	On-Demand	Anodyne	DHOD	0	45
C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)C1=CCN(C)CC1	ZINC000450757868	FG	On-Demand	Anodyne	PRCP	17	46
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)C1=CCN(C)CC1	ZINC000450757870	FG	On-Demand	Anodyne	PRCP	17	46
CCc1cc(N[C@@H]2CC(=O)N(CC)C2)n2ncnc2n1	ZINC000450757872	CC	On-Demand	Anodyne	DHOD	0	45
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450757889	EI	On-Demand	Anodyne	L3MBTL3	58	34
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1	ZINC000450757900	EI	On-Demand	Anodyne	L3MBTL3	58	34
Cc1cccc(Cl)c1C(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450757904	EI	On-Demand	Anodyne	L3MBTL3	58	34
Cc1cccc(Cl)c1C(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1	ZINC000450757907	EI	On-Demand	Anodyne	L3MBTL3	58	34
C=C[C@@H]1OCC[C@H]1Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450757917	GD	On-Demand	Mild	BDKRB1	0	44
C=C[C@@H]1OCC[C@H]1Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450757917	GD	On-Demand	Mild	BCL2L1	64	33
C=C[C@@H]1OCC[C@H]1Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450757917	GD	On-Demand	Mild	BCL2	45	35
COC(=O)CN1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)CC1	ZINC000450757919	FC	On-Demand	Anodyne	DRD4	48	37
COC(=O)CN1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)CC1	ZINC000450757919	FC	On-Demand	Anodyne	CCKAR	30	44
COC(=O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450757944	DC	On-Demand	Anodyne	ABCB1	42	34
COC(=O)CN1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450757946	DC	On-Demand	Anodyne	ABCB1	42	34
COC(=O)CN1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450757949	DC	On-Demand	Anodyne	ABCB1	42	34
COC(=O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450757950	DC	On-Demand	Anodyne	ABCB1	42	34
Clc1ccc(CCN2CCC(c3nnc4n3CCCC4)CC2)cc1	ZINC000450757959	EH	On-Demand	Anodyne	DRD4	20	45
Clc1ccc(CCN2CCC(c3nnc4n3CCCC4)CC2)cc1	ZINC000450757959	EH	On-Demand	Anodyne	HRH3	15	42
Clc1ccc(CCN2CCC(c3nnc4n3CCCC4)CC2)cc1	ZINC000450757959	EH	On-Demand	Anodyne	SIGMAR1	27	42
Clc1ccc(CCN2CCC(c3nnc4n3CCCC4)CC2)cc1	ZINC000450757959	EH	On-Demand	Anodyne	ABCC1	28	40
FC1(F)CC(CN2CCC[C@@]3(C2)OCc2ccccc23)C1	ZINC000450757962	CH	On-Demand	Anodyne	SIGMAR1	21	46
FC1(F)CC(CN2CCC[C@]3(C2)OCc2ccccc23)C1	ZINC000450757964	CH	On-Demand	Anodyne	SIGMAR1	21	46
COC(=O)c1coc(CN2CCC(O)(Cc3cccc(F)c3)CC2)n1	ZINC000450757969	EE	On-Demand	Anodyne	CACNA1G	16	48
COc1ccccc1C1(C(=O)NCCN2c3ccccc3NS2(=O)=O)CC1	ZINC000450757974	GE	On-Demand	Anodyne	DRD2	19	42
CCCNc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450758007	DG	On-Demand	Anodyne	KCNQ2	66	34
CCCNc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450758007	DG	On-Demand	Anodyne	PRNP	57	42
CCCNc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450758007	DG	On-Demand	Anodyne	HDAC1	69	51
CCCNc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450758007	DG	On-Demand	Anodyne	HPGDS	20	44
COc1ccc(C(=O)N(CCO)CC2CCCCC2)cc1S(C)(=O)=O	ZINC000450758025	FE	On-Demand	Anodyne	ACKR3	54	35
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(c2ccsc2)CC1	ZINC000450758045	EH	On-Demand	Anodyne	VACHT_TETCF	0	43
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(c2ccsc2)CC1	ZINC000450758045	EH	On-Demand	Anodyne	NPBWR1	56	33
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(c2ccsc2)CC1	ZINC000450758046	EH	On-Demand	Anodyne	VACHT_TETCF	0	43
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(c2ccsc2)CC1	ZINC000450758046	EH	On-Demand	Anodyne	NPBWR1	56	33
CCOC(=O)c1cc(N2CC[C@H](c3nc(C)no3)C2)ncc1Cl	ZINC000450758054	EF	On-Demand	Anodyne	SMO	0	41
CCOC(=O)c1cc(N2CC[C@@H](c3nc(C)no3)C2)ncc1Cl	ZINC000450758057	EF	On-Demand	Anodyne	SMO	0	41
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450758137	EI	On-Demand	Anodyne	MTTP	44	37
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450758138	EI	On-Demand	Anodyne	MTTP	44	37
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450758139	EI	On-Demand	Anodyne	MTTP	44	37
CC[C@H](CC(F)(F)F)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450758140	EI	On-Demand	Anodyne	MTTP	44	37
O=C(Cc1sccc1Br)Nc1cccc(CCCO)c1	ZINC000450758178	FH	On-Demand	Anodyne	NAMPT	0	40
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(CCCO)c1	ZINC000450758180	DG	On-Demand	Anodyne	PARP10	0	43
CNC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450758225	CD	On-Demand	Anodyne	DRD4	27	42
CNC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450758225	CD	On-Demand	Anodyne	DRD3	23	42
CNC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450758225	CD	On-Demand	Anodyne	HTR4	47	35
CNC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450758225	CD	On-Demand	Anodyne	SSTR5	46	38
CNC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450758225	CD	On-Demand	Anodyne	CCR1	41	41
CNC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450758225	CD	On-Demand	Anodyne	CCR3	21	40
CNC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450758225	CD	On-Demand	Anodyne	S1PR5	27	41
CNC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450758225	CD	On-Demand	Anodyne	MCHR1	22	42
O=C(Nc1cccc(CCCO)c1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450758233	GG	On-Demand	Anodyne	INHA	17	40
O=C(Nc1cccc(CCCO)c1)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450758233	GG	On-Demand	Anodyne	RHOA	0	40
O=C(Nc1cccc(CCCO)c1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450758235	GG	On-Demand	Anodyne	INHA	17	40
O=C(Nc1cccc(CCCO)c1)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450758235	GG	On-Demand	Anodyne	RHOA	0	40
COc1ccc(CC(=O)Nc2cccc(CCCO)c2)c(Cl)c1OC	ZINC000450758236	FG	On-Demand	Anodyne	TSHR	52	30
COc1ccc(CC(=O)Nc2cccc(CCCO)c2)c(Cl)c1OC	ZINC000450758236	FG	On-Demand	Anodyne	PDE6A	42	34
O=C1CCC(CN2CCC(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000450758267	DH	On-Demand	Anodyne	SIGMAR1	25	49
C[C@@H](Sc1nnc(-c2cccs2)n1C)C(=O)C1CCCCC1	ZINC000450758272	EI	On-Demand	Anodyne	LRRK2	15	46
C[C@H](Sc1nnc(-c2cccs2)n1C)C(=O)C1CCCCC1	ZINC000450758273	EI	On-Demand	Anodyne	LRRK2	15	46
CC(C)(C)OCc1cc(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)no1	ZINC000450758278	FI	On-Demand	Anodyne	SCN9A	31	44
CC(C)(C)OCc1cc(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)no1	ZINC000450758279	FI	On-Demand	Anodyne	SCN9A	31	44
CC(C)(C)OCc1cc(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)no1	ZINC000450758280	FI	On-Demand	Anodyne	SCN9A	31	44
CC(C)(C)OCc1cc(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)no1	ZINC000450758281	FI	On-Demand	Anodyne	SCN9A	31	44
COC(=O)[C@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758284	DF	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758284	DF	On-Demand	Anodyne	AMY2	46	32
COC(=O)[C@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758284	DF	On-Demand	Anodyne	CAPNS1	65	33
COC(=O)[C@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758284	DF	On-Demand	Anodyne	REN	57	37
COC(=O)[C@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758284	DF	On-Demand	Anodyne	CAPN1	46	36
COC(=O)[C@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758284	DF	On-Demand	Anodyne	CAPN2	50	34
COC(=O)[C@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758284	DF	On-Demand	Anodyne	POL	0	46
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	HTR1A	20	55
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	THRA	0	40
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	DRD2	36	51
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	DRD1	26	48
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	DRD4	26	48
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	HRH2	0	44
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	HTR2A	38	48
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	HTR2C	28	55
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	SLC6A1	133	41
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	DRD3	24	48
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	ERG2	20	44
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	HTR7	18	44
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	HRH3	26	40
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	SIGMAR1	21	51
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	CCR3	73	41
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	SLC18A3	0	43
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	EBP	16	44
COCC[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758292	DH	On-Demand	Anodyne	CYP2J2	52	37
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	HTR1A	20	55
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	THRA	0	40
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	DRD2	36	51
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	DRD1	26	48
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	DRD4	26	48
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	HRH2	0	44
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	HTR2A	38	48
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	HTR2C	28	55
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	SLC6A1	133	41
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	DRD3	24	48
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	ERG2	20	44
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	HTR7	18	44
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	HRH3	26	40
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	SIGMAR1	21	51
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	CCR3	73	41
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	SLC18A3	0	43
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	EBP	16	44
COCC[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450758293	DH	On-Demand	Anodyne	CYP2J2	52	37
COC(=O)CN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450758324	ED	On-Demand	Anodyne	OPRK1	42	43
COC(=O)CN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450758324	ED	On-Demand	Anodyne	HTR4	40	34
COC(=O)CN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450758324	ED	On-Demand	Anodyne	CCR1	26	48
CCS(=O)(=O)c1ccc(CN2CCC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450758389	FH	On-Demand	Anodyne	SIGMAR1	28	51
CCS(=O)(=O)c1ccc(CN2CCC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450758389	FH	On-Demand	Anodyne	SLC18A3	22	45
CCS(=O)(=O)c1ccc(CN2CCC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450758389	FH	On-Demand	Anodyne	MCHR2	42	35
CCS(=O)(=O)c1ccc(CN2CCC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450758391	FH	On-Demand	Anodyne	SIGMAR1	28	51
CCS(=O)(=O)c1ccc(CN2CCC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450758391	FH	On-Demand	Anodyne	SLC18A3	22	45
CCS(=O)(=O)c1ccc(CN2CCC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450758391	FH	On-Demand	Anodyne	MCHR2	42	35
Cn1cc(-c2ccc(C(=O)N[C@H](CO)C(C)(C)C)o2)cn1	ZINC000450758410	CD	On-Demand	Anodyne	MMP13	19	44
CCCNc1ccccc1NC(=O)c1cc(OC)c(OC)cc1Br	ZINC000450758415	GJ	On-Demand	Anodyne	KCNK3	46	40
CCCNc1ccccc1NC(=O)c1cc(OC)c(OC)cc1Br	ZINC000450758415	GJ	On-Demand	Anodyne	KCNK9	35	40
CSc1cccc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000450758422	GH	On-Demand	Anodyne	RBP4	62	34
CSc1cccc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000450758423	GH	On-Demand	Anodyne	RBP4	62	34
Cc1ccn(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450758438	FD	On-Demand	Anodyne	RBP4	56	34
Cc1ccn(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450758439	FD	On-Demand	Anodyne	RBP4	56	34
Cc1cc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)nn1C(C)C	ZINC000450758459	GG	On-Demand	Anodyne	RBP4	54	37
Cc1cc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)nn1C(C)C	ZINC000450758466	GG	On-Demand	Anodyne	RBP4	54	37
COc1ccccc1Oc1ccc(C(=O)N(CCO)CC2CCCCC2)nc1	ZINC000450758468	GH	On-Demand	Anodyne	ACKR3	41	32
COc1ccc(NC(=O)c2cc3c([nH]2)CCCC3)cc1[N+](=O)[O-]	ZINC000450758477	DG	On-Demand	Bother	ENPP1	40	32
COc1ccc(NC(=O)Cc2cn(C)nc2C)cc1[N+](=O)[O-]	ZINC000450758483	DD	On-Demand	Bother	GNRHR	0	41
COc1ccc(NC(=O)Cc2cn(C)nc2C)cc1[N+](=O)[O-]	ZINC000450758483	DD	On-Demand	Bother	PDGFRB	26	41
COc1ccc(NC(=O)Cc2cn(C)nc2C)cc1[N+](=O)[O-]	ZINC000450758483	DD	On-Demand	Bother	ENPP1	60	35
CC(C)(C)[C@@H](CO)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450758497	FG	On-Demand	Anodyne	PYGL	45	36
CO[C@H]1CCN(c2ncccc2-c2nc(C)no2)C[C@@H]1C	ZINC000450758500	CE	On-Demand	Anodyne	ELANE	0	40
CO[C@@H]1CCN(c2ncccc2-c2nc(C)no2)C[C@@H]1C	ZINC000450758511	CE	On-Demand	Anodyne	ELANE	0	40
CO[C@H]1CCN(c2ncccc2-c2nc(C)no2)C[C@H]1C	ZINC000450758512	CE	On-Demand	Anodyne	ELANE	0	40
CO[C@@H]1CCN(c2ncccc2-c2nc(C)no2)C[C@H]1C	ZINC000450758514	CE	On-Demand	Anodyne	ELANE	0	40
CCc1cccc(C(=O)N[C@H](CO)C(C)(C)C)n1	ZINC000450758516	CD	On-Demand	Anodyne	PDE5A	25	41
C[C@@H](NC(=O)c1cc2ccncc2s1)C1=CCN(C)CC1	ZINC000450758530	DF	On-Demand	Anodyne	SELE	42	31
C[C@H](NC(=O)c1cc2ccncc2s1)C1=CCN(C)CC1	ZINC000450758532	DF	On-Demand	Anodyne	SELE	42	31
C[C@H]1CCC(=O)[C@H](Sc2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450758589	FH	On-Demand	Anodyne	TNKS	45	31
C[C@@H]1CCC(=O)[C@H](Sc2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450758591	FH	On-Demand	Anodyne	TNKS	45	31
C[C@H]1CCC(=O)[C@@H](Sc2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450758593	FH	On-Demand	Anodyne	TNKS	45	31
C[C@@H]1CCC(=O)[C@@H](Sc2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450758595	FH	On-Demand	Anodyne	TNKS	45	31
CC(CO)(CO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450758608	DD	On-Demand	Anodyne	MC3R	26	40
CC(CO)(CO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450758608	DD	On-Demand	Anodyne	MC5R	0	40
CC(CO)(CO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450758610	DD	On-Demand	Anodyne	MC3R	26	40
CC(CO)(CO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450758610	DD	On-Demand	Anodyne	MC5R	0	40
CC(CO)(CO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450758612	DD	On-Demand	Anodyne	MC3R	26	40
CC(CO)(CO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450758612	DD	On-Demand	Anodyne	MC5R	0	40
CC(CO)(CO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450758614	DD	On-Demand	Anodyne	MC3R	26	40
CC(CO)(CO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450758614	DD	On-Demand	Anodyne	MC5R	0	40
Cc1nc(C)c(F)c(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450758635	EH	On-Demand	Bother	SLC27A4	49	34
Cc1nc(C)c(F)c(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450758642	EH	On-Demand	Bother	SLC27A4	49	34
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)C(C)(C)CO	ZINC000450758656	DH	On-Demand	Anodyne	PPARA	16	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)C(C)(C)CO	ZINC000450758656	DH	On-Demand	Anodyne	PPARD	37	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)C(C)(C)CO	ZINC000450758656	DH	On-Demand	Anodyne	SORT1	15	42
CO[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)CC1(C)C	ZINC000450758674	EH	On-Demand	Anodyne	RBP4	17	43
CO[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)CC1(C)C	ZINC000450758675	EH	On-Demand	Anodyne	RBP4	17	43
CC(C)(CO)C(C)(C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450758690	FH	On-Demand	Anodyne	PYGL	55	38
CC(C)(CO)C(C)(C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450758690	FH	On-Demand	Anodyne	PYK	42	42
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450758743	FH	On-Demand	Anodyne	VACHT_TETCF	0	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000450758743	FH	On-Demand	Anodyne	CCR5	26	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450758744	FH	On-Demand	Anodyne	VACHT_TETCF	0	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000450758744	FH	On-Demand	Anodyne	CCR5	26	41
COc1ccc(CNC(=O)CCN[C@@H](CO)c2ccsc2)c(OC)c1	ZINC000450758757	FE	On-Demand	Anodyne	MTNR1A	45	35
COc1ccc(CNC(=O)CCN[C@H](CO)c2ccsc2)c(OC)c1	ZINC000450758758	FE	On-Demand	Anodyne	MTNR1A	45	35
COC(=O)c1cccc(CN2CC[C@@]3(C2)OCc2ccccc23)c1Cl	ZINC000450758776	FH	On-Demand	Anodyne	SIGMAR1	25	49
COC(=O)c1cccc(CN2CC[C@@]3(C2)OCc2ccccc23)c1Cl	ZINC000450758776	FH	On-Demand	Anodyne	SLC18A3	0	42
COC(=O)c1cccc(CN2CC[C@]3(C2)OCc2ccccc23)c1Cl	ZINC000450758777	FH	On-Demand	Anodyne	SIGMAR1	25	49
COC(=O)c1cccc(CN2CC[C@]3(C2)OCc2ccccc23)c1Cl	ZINC000450758777	FH	On-Demand	Anodyne	SLC18A3	0	42
COc1ccc(CNC(=O)CCN2CC[C@]3(C2)OCc2ccccc23)c(OC)c1	ZINC000450758780	GF	On-Demand	Anodyne	SIGMAR1	21	49
COc1ccc(CNC(=O)CCN2CC[C@]3(C2)OCc2ccccc23)c(OC)c1	ZINC000450758780	GF	On-Demand	Anodyne	SLC18A3	0	40
COc1ccc(CNC(=O)CCN2CC[C@]3(C2)OCc2ccccc23)c(OC)c1	ZINC000450758780	GF	On-Demand	Anodyne	MTNR1A	40	39
COc1ccc(CNC(=O)CCN2CC[C@@]3(C2)OCc2ccccc23)c(OC)c1	ZINC000450758781	GF	On-Demand	Anodyne	SIGMAR1	21	49
COc1ccc(CNC(=O)CCN2CC[C@@]3(C2)OCc2ccccc23)c(OC)c1	ZINC000450758781	GF	On-Demand	Anodyne	SLC18A3	0	40
COc1ccc(CNC(=O)CCN2CC[C@@]3(C2)OCc2ccccc23)c(OC)c1	ZINC000450758781	GF	On-Demand	Anodyne	MTNR1A	40	39
CN1CCCC[C@H]1CCC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450758785	FD	On-Demand	Anodyne	CHRNA10	43	35
CN1CCCC[C@H]1CCC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450758785	FD	On-Demand	Anodyne	ACKR3	62	32
CN1CCCC[C@H]1CCC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450758785	FD	On-Demand	Anodyne	GLS	0	41
CN1CCCC[C@@H]1CCC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450758786	FD	On-Demand	Anodyne	CHRNA10	43	35
CN1CCCC[C@@H]1CCC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450758786	FD	On-Demand	Anodyne	ACKR3	62	32
CN1CCCC[C@@H]1CCC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450758786	FD	On-Demand	Anodyne	GLS	0	41
CCCNc1ccccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450758795	CF	On-Demand	Anodyne	KCNQ2	50	36
CCCNc1ccccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450758795	CF	On-Demand	Anodyne	CCR8	44	36
CCCNc1ccccc1NC(=O)[C@H](O)C1CCC1	ZINC000450758796	CF	On-Demand	Anodyne	KCNQ2	50	36
CCCNc1ccccc1NC(=O)[C@H](O)C1CCC1	ZINC000450758796	CF	On-Demand	Anodyne	CCR8	44	36
C[C@@H]1CC[C@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758802	EH	On-Demand	Anodyne	CCKBR	41	36
C[C@@H]1CC[C@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758802	EH	On-Demand	Anodyne	EPHX2	42	48
C[C@@H]1CC[C@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758802	EH	On-Demand	Anodyne	MCHR1	21	42
C[C@@H]1CC[C@@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758803	EH	On-Demand	Anodyne	CCKBR	41	36
C[C@@H]1CC[C@@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758803	EH	On-Demand	Anodyne	EPHX2	42	48
C[C@@H]1CC[C@@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758803	EH	On-Demand	Anodyne	MCHR1	21	42
C[C@H]1CC[C@@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758804	EH	On-Demand	Anodyne	CCKBR	41	36
C[C@H]1CC[C@@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758804	EH	On-Demand	Anodyne	EPHX2	42	48
C[C@H]1CC[C@@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758804	EH	On-Demand	Anodyne	MCHR1	21	42
C[C@H]1CC[C@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758805	EH	On-Demand	Anodyne	CCKBR	41	36
C[C@H]1CC[C@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758805	EH	On-Demand	Anodyne	EPHX2	42	48
C[C@H]1CC[C@]2(CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)C2)C1	ZINC000450758805	EH	On-Demand	Anodyne	MCHR1	21	42
CCN1C[C@@H](Nc2ccc(C#N)cc2C(F)(F)F)CC1=O	ZINC000450758810	CF	On-Demand	Mild	AR	22	40
CCN1C[C@H](Nc2ccc(C#N)cc2C(F)(F)F)CC1=O	ZINC000450758827	CF	On-Demand	Mild	AR	22	40
COC(=O)CN1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450758830	EC	On-Demand	Anodyne	SLC18A2	15	43
CCCNc1ccccc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450758833	EI	On-Demand	Anodyne	GRM4	16	40
CCCNc1ccccc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450758833	EI	On-Demand	Anodyne	PTGDR	34	40
CCCNc1ccccc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450758833	EI	On-Demand	Anodyne	PTGDR2	24	40
CCCNc1ccccc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450758833	EI	On-Demand	Anodyne	NCE103	24	42
CCCNc1ccccc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450758833	EI	On-Demand	Anodyne	CAN2	0	42
COC(=O)CN1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450758834	EC	On-Demand	Anodyne	SLC18A2	15	43
C1=C(CCN2CC[C@@]3(C2)OCc2ccccc23)CCCC1	ZINC000450758842	CI	On-Demand	Anodyne	SIGMAR1	32	56
C1=C(CCN2CC[C@]3(C2)OCc2ccccc23)CCCC1	ZINC000450758845	CI	On-Demand	Anodyne	SIGMAR1	32	56
C=C[C@@H]1OCC[C@H]1Nc1ncnc2ccc(I)cc12	ZINC000450758872	FF	On-Demand	Mild	CD38	55	41
COC(=O)C1(CNC(=O)c2cc(Cl)c(Br)cc2F)CC1	ZINC000450758875	FF	On-Demand	Anodyne	SLC6A9	40	36
C=C[C@@H]1OCC[C@H]1Nc1cc(CC)nc2ncnn12	ZINC000450758895	CD	On-Demand	Mild	DHOD	0	45
COC(=O)c1ccc(CSc2n[nH]c(C3CC3)n2)c(Br)c1	ZINC000450758897	FH	On-Demand	Anodyne	METAP2	0	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450758898	FI	On-Demand	Anodyne	GHRHR	61	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450758898	FI	On-Demand	Anodyne	CCR1	43	48
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450758898	FI	On-Demand	Anodyne	NPBWR1	54	33
O=C1NCCN(C(=O)CC2(O)CCC2)[C@H]1c1ccccc1C(F)(F)F	ZINC000450758908	FE	On-Demand	Anodyne	RBP4	68	36
O=C1NCCN(C(=O)CC2(O)CCC2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450758910	FE	On-Demand	Anodyne	RBP4	68	36
COc1ccc(NC(=O)CCCC(C)C)cc1[N+](=O)[O-]	ZINC000450758914	CG	On-Demand	Bother	ENPP1	56	32
COC(=O)[C@@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758944	DF	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758944	DF	On-Demand	Anodyne	AMY2	46	32
COC(=O)[C@@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758944	DF	On-Demand	Anodyne	CAPNS1	65	33
COC(=O)[C@@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758944	DF	On-Demand	Anodyne	REN	57	37
COC(=O)[C@@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758944	DF	On-Demand	Anodyne	CAPN1	46	36
COC(=O)[C@@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758944	DF	On-Demand	Anodyne	CAPN2	50	34
COC(=O)[C@@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758944	DF	On-Demand	Anodyne	POL	0	46
COC(=O)[C@@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758946	DF	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758946	DF	On-Demand	Anodyne	AMY2	46	32
COC(=O)[C@@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758946	DF	On-Demand	Anodyne	CAPNS1	65	33
COC(=O)[C@@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758946	DF	On-Demand	Anodyne	REN	57	37
COC(=O)[C@@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758946	DF	On-Demand	Anodyne	CAPN1	46	36
COC(=O)[C@@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758946	DF	On-Demand	Anodyne	CAPN2	50	34
COC(=O)[C@@H]1CCCCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758946	DF	On-Demand	Anodyne	POL	0	46
COC(=O)[C@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758947	DF	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758947	DF	On-Demand	Anodyne	AMY2	46	32
COC(=O)[C@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758947	DF	On-Demand	Anodyne	CAPNS1	65	33
COC(=O)[C@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758947	DF	On-Demand	Anodyne	REN	57	37
COC(=O)[C@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758947	DF	On-Demand	Anodyne	CAPN1	46	36
COC(=O)[C@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758947	DF	On-Demand	Anodyne	CAPN2	50	34
COC(=O)[C@H]1CCCCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450758947	DF	On-Demand	Anodyne	POL	0	46
Cc1ccc(C(=O)Nc2cccc(N(C)C)n2)c(C(C)C)n1	ZINC000450759004	CG	On-Demand	Anodyne	SORT1	27	44
CC(C)(C)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450759013	FG	On-Demand	Anodyne	ELANE	50	39
CC(C)(C)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450759013	FG	On-Demand	Anodyne	CTRA_BOVIN	41	32
CC(C)(C)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450759013	FG	On-Demand	Anodyne	PDE6D	67	41
CC(C)(C)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450759013	FG	On-Demand	Anodyne	HDAC8	29	42
CC(C)(C)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450759013	FG	On-Demand	Anodyne	TACR3	44	33
CC(C)(C)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450759013	FG	On-Demand	Anodyne	HDAC6	21	42
CC(C)(C)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450759013	FG	On-Demand	Anodyne	CTRC	49	37
CC(C)(C)[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450759013	FG	On-Demand	Anodyne	IMDH_CRYPV	36	55
CC[C@H](O)CC(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450759035	DE	On-Demand	Anodyne	GNAI1	0	40
CC[C@H](O)CC(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450759035	DE	On-Demand	Anodyne	GNAI3	0	42
CC[C@H](O)CC(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450759035	DE	On-Demand	Anodyne	GNAO1	0	40
CC[C@@H](O)CC(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450759036	DE	On-Demand	Anodyne	GNAI1	0	40
CC[C@@H](O)CC(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450759036	DE	On-Demand	Anodyne	GNAI3	0	42
CC[C@@H](O)CC(=O)N1CCC(CCC(=O)N(CC)CC)CC1	ZINC000450759036	DE	On-Demand	Anodyne	GNAO1	0	40
COc1cc(CN2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450759047	CF	On-Demand	Anodyne	DRD4	25	55
COc1cc(CN2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450759047	CF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCO[C@H](C3CC3)C2)ccc1Cl	ZINC000450759047	CF	On-Demand	Anodyne	SSTR5	49	38
COc1cc(CN2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450759048	CF	On-Demand	Anodyne	DRD4	25	55
COc1cc(CN2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450759048	CF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCO[C@@H](C3CC3)C2)ccc1Cl	ZINC000450759048	CF	On-Demand	Anodyne	SSTR5	49	38
COC(=O)CN1CCN(C(=O)c2cc3n(n2)CCCC3)CC1	ZINC000450759055	DC	On-Demand	Anodyne	L3MBTL3	44	32
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccc(Br)cc1	ZINC000450759070	GH	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccc(Br)cc1	ZINC000450759071	GH	On-Demand	Anodyne	CYP2J2	52	37
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)nc2)c1	ZINC000450759080	GG	On-Demand	Anodyne	ACACB	15	42
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)nc2)c1	ZINC000450759080	GG	On-Demand	Anodyne	MTNR1A	29	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)nc2)c1	ZINC000450759080	GG	On-Demand	Anodyne	MTNR1B	27	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)nc2)c1	ZINC000450759081	GG	On-Demand	Anodyne	ACACB	15	42
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)nc2)c1	ZINC000450759081	GG	On-Demand	Anodyne	MTNR1A	29	40
COc1cccc(Oc2ccc(C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)nc2)c1	ZINC000450759081	GG	On-Demand	Anodyne	MTNR1B	27	40
CCCOc1ccc(C(=O)Nc2cccc(CCCO)c2)c(OC)c1	ZINC000450759094	EH	On-Demand	Anodyne	KCNK3	60	47
CCCOc1ccc(C(=O)Nc2cccc(CCCO)c2)c(OC)c1	ZINC000450759094	EH	On-Demand	Anodyne	KCNK9	63	47
N#Cc1ccc(N2C[C@@H](C(=O)Nc3cccc(CCCO)c3)CC2=O)cc1Cl	ZINC000450759100	GG	On-Demand	Mild	INHA	24	43
N#Cc1ccc(N2C[C@H](C(=O)Nc3cccc(CCCO)c3)CC2=O)cc1Cl	ZINC000450759101	GG	On-Demand	Mild	INHA	24	43
CC(F)(F)c1ccc(C(=O)N2CCC(c3c(F)cccc3F)CC2)cn1	ZINC000450759115	FI	On-Demand	Anodyne	SLC9A1	48	41
CC(F)(F)c1ccc(C(=O)N2CCC(c3c(F)cccc3F)CC2)cn1	ZINC000450759115	FI	On-Demand	Anodyne	RBP4	25	43
CC(F)(F)c1ccc(C(=O)N2CCC(c3c(F)cccc3F)CC2)cn1	ZINC000450759115	FI	On-Demand	Anodyne	SFRP1	35	44
CC(F)(F)c1ccc(C(=O)N2CCC(c3c(F)cccc3F)CC2)cn1	ZINC000450759115	FI	On-Demand	Anodyne	L3MBTL3	59	40
COC(=O)COc1ccc([C@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450759134	GJ	On-Demand	Anodyne	ACACA	48	38
COC(=O)COc1ccc([C@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450759139	GJ	On-Demand	Anodyne	ACACA	48	38
COC(=O)COc1ccc([C@@H](C)NCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450759141	GJ	On-Demand	Anodyne	ACACA	48	38
COC(=O)COc1ccc([C@@H](C)NCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450759143	GJ	On-Demand	Anodyne	ACACA	48	38
CCS(=O)(=O)c1ccc(CN2CCO[C@H](c3cccc(Cl)c3)C2)cc1	ZINC000450759145	GH	On-Demand	Anodyne	DRD4	16	42
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](c3cccc(Cl)c3)C2)cc1	ZINC000450759146	GH	On-Demand	Anodyne	DRD4	16	42
CO[C@@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C[C@H]1C	ZINC000450759168	DF	On-Demand	Anodyne	L3MBTL3	42	36
CO[C@@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C[C@@H]1C	ZINC000450759169	DF	On-Demand	Anodyne	L3MBTL3	42	36
CO[C@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C[C@@H]1C	ZINC000450759170	DF	On-Demand	Anodyne	L3MBTL3	42	36
CO[C@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C[C@H]1C	ZINC000450759171	DF	On-Demand	Anodyne	L3MBTL3	42	36
COC(=O)COc1ccc([C@@H](C)NCCC[C@@H](C)O)cc1	ZINC000450759184	CE	On-Demand	Anodyne	ACACA	49	37
COC(=O)COc1ccc([C@H](C)NCCC[C@@H](C)O)cc1	ZINC000450759185	CE	On-Demand	Anodyne	ACACA	49	37
COC(=O)COc1ccc([C@@H](C)NCCC[C@H](C)O)cc1	ZINC000450759186	CE	On-Demand	Anodyne	ACACA	49	37
COC(=O)COc1ccc([C@H](C)NCCC[C@H](C)O)cc1	ZINC000450759187	CE	On-Demand	Anodyne	ACACA	49	37
CCC[C@H](OC)C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000450759218	DF	On-Demand	Anodyne	CAPN2	41	32
CCC[C@@H](OC)C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000450759219	DF	On-Demand	Anodyne	CAPN2	41	32
CCC[C@H](OC)C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000450759220	DF	On-Demand	Anodyne	CAPN2	41	32
CCC[C@@H](OC)C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000450759221	DF	On-Demand	Anodyne	CAPN2	41	32
CCOC(=O)c1ccc(CN2CCO[C@@H](c3cccc(Cl)c3)C2)nc1	ZINC000450759229	FG	On-Demand	Anodyne	P2RY12	24	42
CCOC(=O)c1ccc(CN2CCO[C@H](c3cccc(Cl)c3)C2)nc1	ZINC000450759230	FG	On-Demand	Anodyne	P2RY12	24	42
CC(=O)CCCCCSc1nnc(C(C)C)n1Cc1ccco1	ZINC000450759244	EI	On-Demand	Anodyne	HCRTR2	20	40
CCC(=O)N1CCC[C@@H](C(=O)NCCN2c3ccccc3NS2(=O)=O)C1	ZINC000450759283	GC	On-Demand	Anodyne	F2R	25	43
CCC(=O)N1CCC[C@H](C(=O)NCCN2c3ccccc3NS2(=O)=O)C1	ZINC000450759284	GC	On-Demand	Anodyne	F2R	25	43
CCNC(=O)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)nn1	ZINC000450759301	GF	On-Demand	Anodyne	SCD1	58	44
CCNC(=O)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)nn1	ZINC000450759301	GF	On-Demand	Anodyne	SCD	45	40
CCNC(=O)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)nn1	ZINC000450759302	GF	On-Demand	Anodyne	SCD1	58	44
CCNC(=O)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)nn1	ZINC000450759302	GF	On-Demand	Anodyne	SCD	45	40
CS(=O)(=O)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)c(F)c1	ZINC000450759308	GH	On-Demand	Anodyne	SLC6A9	22	42
CS(=O)(=O)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)c(F)c1	ZINC000450759309	GH	On-Demand	Anodyne	SLC6A9	22	42
COc1cccc(Oc2ccc(C(=O)NC(C)(CO)CO)nc2)c1	ZINC000450759320	ED	On-Demand	Anodyne	RAF1	25	41
COc1cccc(Oc2ccc(C(=O)NC(C)(CO)CO)nc2)c1	ZINC000450759320	ED	On-Demand	Anodyne	MTNR1B	30	44
COc1cccc(Oc2ccc(C(=O)NC(C)(CO)CO)nc2)c1	ZINC000450759320	ED	On-Demand	Anodyne	Q8MMZ8_EIMTE	32	41
c1ccc2c(c1)CO[C@]21CCN(Cc2cnns2)C1	ZINC000450759323	CE	On-Demand	Anodyne	SIGMAR1	22	43
c1ccc2c(c1)CO[C@]21CCN(Cc2cnns2)C1	ZINC000450759323	CE	On-Demand	Anodyne	SLC18A3	0	44
c1ccc2c(c1)CO[C@@]21CCN(Cc2cnns2)C1	ZINC000450759324	CE	On-Demand	Anodyne	SIGMAR1	22	43
c1ccc2c(c1)CO[C@@]21CCN(Cc2cnns2)C1	ZINC000450759324	CE	On-Demand	Anodyne	SLC18A3	0	44
O=C(NCCN1c2ccccc2NS1(=O)=O)c1ccc(NCC2CC2)nc1	ZINC000450759330	GD	On-Demand	Anodyne	IKBKB	23	45
CCCCn1c(=O)n(Cc2cccc(C)n2)c(=O)c2c1nc(CO)n2CCC	ZINC000450759337	GD	On-Demand	Anodyne	ADORA1	20	42
CCCCn1c(=O)n(Cc2cccc(C)n2)c(=O)c2c1nc(CO)n2CCC	ZINC000450759337	GD	On-Demand	Anodyne	ADORA2A	0	45
CCCCn1c(=O)n(Cc2cccc(C)n2)c(=O)c2c1nc(CO)n2CCC	ZINC000450759337	GD	On-Demand	Anodyne	ADORA2B	19	42
C=C[C@@H]1OCC[C@H]1Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450759357	DE	On-Demand	Mild	TAAR1	16	41
COCC1=CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450759363	FH	On-Demand	Anodyne	CYP2J2	51	37
CCCc1nc(C)c(NC(=O)c2ncccc2SCC)s1	ZINC000450759366	DI	On-Demand	Anodyne	MAP1	66	38
COc1ccc(CNC(=O)CCSc2nnnn2CC(C)C)c(OC)c1	ZINC000450759371	GE	On-Demand	Anodyne	MTNR1A	41	38
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](OC)C(C)(C)C1	ZINC000450759382	FH	On-Demand	Anodyne	ATP4A	19	50
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](OC)C(C)(C)C1	ZINC000450759383	FH	On-Demand	Anodyne	ATP4A	19	50
C[C@H](Oc1ccccn1)C(=O)N(CCO)CC1CCCCC1	ZINC000450759402	DE	On-Demand	Anodyne	DEF	0	40
C[C@H](Oc1ccccn1)C(=O)N(CCO)CC1CCCCC1	ZINC000450759402	DE	On-Demand	Anodyne	AMY2	42	29
C[C@@H](Oc1ccccn1)C(=O)N(CCO)CC1CCCCC1	ZINC000450759403	DE	On-Demand	Anodyne	DEF	0	40
C[C@@H](Oc1ccccn1)C(=O)N(CCO)CC1CCCCC1	ZINC000450759403	DE	On-Demand	Anodyne	AMY2	42	29
COC[C@@H]1CCCCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450759411	EG	On-Demand	Anodyne	SLC6A1	74	36
COC[C@H]1CCCCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450759413	EG	On-Demand	Anodyne	SLC6A1	74	36
COC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759415	EG	On-Demand	Anodyne	DRD4	27	40
COC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759415	EG	On-Demand	Anodyne	OPRM1	0	41
COC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759415	EG	On-Demand	Anodyne	DRD3	0	41
COC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759415	EG	On-Demand	Anodyne	OPRK1	42	44
COC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759415	EG	On-Demand	Anodyne	HTR4	40	35
COC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759415	EG	On-Demand	Anodyne	SIGMAR1	27	40
COC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759415	EG	On-Demand	Anodyne	CCR3	46	43
COC[C@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759415	EG	On-Demand	Anodyne	MCHR1	27	41
COC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759417	EG	On-Demand	Anodyne	DRD4	27	40
COC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759417	EG	On-Demand	Anodyne	OPRM1	0	41
COC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759417	EG	On-Demand	Anodyne	DRD3	0	41
COC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759417	EG	On-Demand	Anodyne	OPRK1	42	44
COC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759417	EG	On-Demand	Anodyne	HTR4	40	35
COC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759417	EG	On-Demand	Anodyne	SIGMAR1	27	40
COC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759417	EG	On-Demand	Anodyne	CCR3	46	43
COC[C@@H]1CCCCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450759417	EG	On-Demand	Anodyne	MCHR1	27	41
COC(=O)C1(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)CC1	ZINC000450759441	ED	On-Demand	Anodyne	CTSS	18	42
COC(=O)c1csc(CN2CC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450759447	EF	On-Demand	Anodyne	SIGMAR1	34	49
COC(=O)c1csc(CN2CC[C@]3(C2)OCc2ccccc23)n1	ZINC000450759450	EF	On-Demand	Anodyne	SIGMAR1	34	49
CCC(=O)C1(C(=O)NCC2(c3ccc(F)cc3F)CCCC2)CC1	ZINC000450759452	EH	On-Demand	Anodyne	ACAT	0	46
COc1ccc(C(=O)NCCN2c3ccccc3NS2(=O)=O)c(C)c1OC	ZINC000450759453	GD	On-Demand	Anodyne	DRD2	19	41
CC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450759479	DH	On-Demand	Anodyne	SIGMAR1	66	61
CC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450759479	DH	On-Demand	Anodyne	SLC18A3	54	53
CC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450759479	DH	On-Demand	Anodyne	MCHR1	19	42
CC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450759479	DH	On-Demand	Anodyne	MCHR2	76	37
CC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450759479	DH	On-Demand	Anodyne	NOD2	41	34
CC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450759480	DH	On-Demand	Anodyne	SIGMAR1	66	61
CC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450759480	DH	On-Demand	Anodyne	SLC18A3	54	53
CC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450759480	DH	On-Demand	Anodyne	MCHR1	19	42
CC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450759480	DH	On-Demand	Anodyne	MCHR2	76	37
CC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450759480	DH	On-Demand	Anodyne	NOD2	41	34
O=C(NCCCCN1C(=O)NC2(CCCC2)C1=O)c1cc2ccncc2s1	ZINC000450759484	GF	On-Demand	Anodyne	NAMPT	15	51
O=C(CCCN1CCSC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450759498	EG	On-Demand	Anodyne	DRD2	32	48
O=C(CCCN1CCSC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450759498	EG	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1CCSC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450759498	EG	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCSC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450759498	EG	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CCSC2(CCOCC2)C1)c1ccc(F)cc1	ZINC000450759498	EG	On-Demand	Anodyne	CYP2J2	49	36
COC(=O)[C@@H](NCCc1ccc(Cl)cc1)c1ccc(OC)c(O)c1	ZINC000450759511	EG	On-Demand	Anodyne	CAN2	0	42
COC(=O)[C@H](NCCc1ccc(Cl)cc1)c1ccc(OC)c(O)c1	ZINC000450759513	EG	On-Demand	Anodyne	CAN2	0	42
COC(=O)C1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CC1	ZINC000450759520	CD	On-Demand	Anodyne	HCN1	64	36
COC(=O)C1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CC1	ZINC000450759520	CD	On-Demand	Anodyne	HCN4	51	35
COC(=O)C1(CNC(=O)c2cccc3c2O[C@H](C)C3)CC1	ZINC000450759522	CD	On-Demand	Anodyne	HCN1	64	36
COC(=O)C1(CNC(=O)c2cccc3c2O[C@H](C)C3)CC1	ZINC000450759522	CD	On-Demand	Anodyne	HCN4	51	35
CC(C)CCCC(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450759531	DG	On-Demand	Anodyne	SOAT1	16	44
CC(C)CCCC(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450759533	DG	On-Demand	Anodyne	SOAT1	16	44
COC(=O)CN1CCN(C(=O)C[C@@H]2COc3ccccc3O2)CC1	ZINC000450759538	EC	On-Demand	Anodyne	ADRA2B	29	47
COC(=O)CN1CCN(C(=O)C[C@@H]2COc3ccccc3O2)CC1	ZINC000450759538	EC	On-Demand	Anodyne	ADRA2C	41	32
COC(=O)CN1CCN(C(=O)C[C@H]2COc3ccccc3O2)CC1	ZINC000450759540	EC	On-Demand	Anodyne	ADRA2B	29	47
COC(=O)CN1CCN(C(=O)C[C@H]2COc3ccccc3O2)CC1	ZINC000450759540	EC	On-Demand	Anodyne	ADRA2C	41	32
CC(=O)c1ccc(CN2CCO[C@H](C3CC3)C2)cc1	ZINC000450759542	CF	On-Demand	Anodyne	DRD4	27	42
CC(=O)c1ccc(CN2CCO[C@@H](C3CC3)C2)cc1	ZINC000450759543	CF	On-Demand	Anodyne	DRD4	27	42
CC(C)(C)[C@@H](CO)NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450759544	FE	On-Demand	Anodyne	MAPK1	43	33
COc1cc(CC(=O)N[C@H](CO)C(C)(C)C)ccc1Cl	ZINC000450759560	CE	On-Demand	Anodyne	TRPV1	41	44
COc1cc(CC(=O)N[C@H](CO)C(C)(C)C)ccc1Cl	ZINC000450759560	CE	On-Demand	Anodyne	P2RX7	0	42
COc1cc(CC(=O)N[C@H](CO)C(C)(C)C)ccc1Cl	ZINC000450759560	CE	On-Demand	Anodyne	NCE103	28	42
COc1cc(CC(=O)N[C@H](CO)C(C)(C)C)ccc1Cl	ZINC000450759560	CE	On-Demand	Anodyne	CAN2	0	42
CN(C)c1ncn(-c2cccc(NC(=O)CCCC(=O)C(C)(C)C)c2)n1	ZINC000450759567	FG	On-Demand	Anodyne	HDAC2	16	41
CN(C)c1ncn(-c2cccc(NC(=O)CCCC(=O)C(C)(C)C)c2)n1	ZINC000450759567	FG	On-Demand	Anodyne	HDAC3	35	41
CN(C)c1ncn(-c2cccc(NC(=O)CCCC(=O)C(C)(C)C)c2)n1	ZINC000450759567	FG	On-Demand	Anodyne	HDAC6	26	41
CCCOc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1	ZINC000450759594	FH	On-Demand	Bother	TAAR1	18	40
CCCOc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1	ZINC000450759594	FH	On-Demand	Bother	ENPP1	46	30
CCCOc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1	ZINC000450759594	FH	On-Demand	Bother	KCNK3	47	42
CCCOc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1	ZINC000450759594	FH	On-Demand	Bother	KCNK9	36	42
COC(=O)CN1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450759605	DD	On-Demand	Anodyne	FABP4	50	40
CCN1C[C@H](Nc2ncnc3[nH]ccc23)CC1=O	ZINC000450759606	BC	On-Demand	Anodyne	JAK2	36	45
CCN1C[C@@H](Nc2ncnc3[nH]ccc23)CC1=O	ZINC000450759607	BC	On-Demand	Anodyne	JAK2	36	45
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@@H]2n2cccn2)c(OC)c1	ZINC000450759608	GF	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@@H]2n2cccn2)c(OC)c1	ZINC000450759608	GF	On-Demand	Anodyne	MTNR1B	41	37
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@@H]2n2cccn2)c(OC)c1	ZINC000450759609	GF	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@@H]2n2cccn2)c(OC)c1	ZINC000450759609	GF	On-Demand	Anodyne	MTNR1B	41	37
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@H]2n2cccn2)c(OC)c1	ZINC000450759610	GF	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCN[C@H]2CCCC[C@H]2n2cccn2)c(OC)c1	ZINC000450759610	GF	On-Demand	Anodyne	MTNR1B	41	37
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2n2cccn2)c(OC)c1	ZINC000450759611	GF	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2n2cccn2)c(OC)c1	ZINC000450759611	GF	On-Demand	Anodyne	MTNR1B	41	37
CCS(=O)(=O)c1ccc(CN(CCO)CC2CCCCC2)cc1	ZINC000450759619	EF	On-Demand	Anodyne	RORC	17	46
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	DRD2	38	40
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	DRD4	32	40
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	DRD3	42	40
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	SIGMAR1	18	44
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	MTNR1A	30	40
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	MTNR1B	25	40
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	CCR2	29	51
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	RBP4	58	43
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	MCHR1	15	41
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	LIPG	42	33
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	SFRP1	86	34
COc1cc(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759635	GG	On-Demand	Anodyne	WNT3	56	34
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	DRD2	38	40
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	DRD4	32	40
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	DRD3	42	40
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	TRPV1	0	43
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	SIGMAR1	18	44
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	MTNR1A	30	40
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	MTNR1B	25	40
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	CCR2	29	51
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	RBP4	58	43
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	MCHR1	15	41
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	LIPG	42	33
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	SFRP1	86	34
COc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ccc1O	ZINC000450759636	GG	On-Demand	Anodyne	WNT3	56	34
C[C@H](OCCc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450759650	EE	On-Demand	Anodyne	AMY2	44	31
C[C@H](OCCc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450759651	EE	On-Demand	Anodyne	AMY2	44	31
C[C@@H](OCCc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450759653	EE	On-Demand	Anodyne	AMY2	44	31
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450759655	EE	On-Demand	Anodyne	AMY2	44	31
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(C)C	ZINC000450759657	GF	On-Demand	Anodyne	GCKR	66	35
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(C)C	ZINC000450759658	GF	On-Demand	Anodyne	GCKR	66	35
CC(C)[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](CO)C(C)C	ZINC000450759659	GF	On-Demand	Anodyne	GCKR	66	35
CC(C)[C@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(C)C	ZINC000450759660	GF	On-Demand	Anodyne	GCKR	66	35
COc1cc(OC)c2ncc(C#N)c(N[C@@H](C3CC3)[C@@H](CO)C3CC3)c2c1	ZINC000450759680	FG	On-Demand	Mild	SRC	49	36
COc1cc(OC)c2ncc(C#N)c(N[C@H](C3CC3)[C@H](CO)C3CC3)c2c1	ZINC000450759681	FG	On-Demand	Mild	SRC	49	36
COc1cc(OC)c2ncc(C#N)c(N[C@@H](C3CC3)[C@H](CO)C3CC3)c2c1	ZINC000450759682	FG	On-Demand	Mild	SRC	49	36
COc1cc(OC)c2ncc(C#N)c(N[C@H](C3CC3)[C@@H](CO)C3CC3)c2c1	ZINC000450759684	FG	On-Demand	Mild	SRC	49	36
CCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nn1	ZINC000450759697	CD	On-Demand	Anodyne	SCD	25	43
CCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nn1	ZINC000450759699	CD	On-Demand	Anodyne	SCD	25	43
CCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nn1	ZINC000450759700	CD	On-Demand	Anodyne	SCD	25	43
CCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nn1	ZINC000450759701	CD	On-Demand	Anodyne	SCD	25	43
COCCC1(CNC(=O)c2cc3cccnc3s2)CCCCC1	ZINC000450759737	EI	On-Demand	Anodyne	HCN1	51	31
COCCC1(CNC(=O)c2cc3cccnc3s2)CCCCC1	ZINC000450759737	EI	On-Demand	Anodyne	HCN4	49	31
COc1ccc(-c2noc(CN3CCN(C4CC4)c4cc(F)ccc43)n2)nn1	ZINC000450759740	GF	On-Demand	Anodyne	SCD1	15	41
COc1ccc(-c2noc(CN3CCN(C4CC4)c4cc(F)ccc43)n2)nn1	ZINC000450759740	GF	On-Demand	Anodyne	SCD	24	41
Brc1cccc([C@@H]2CCN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450759750	EH	On-Demand	Anodyne	AKT2	52	56
Brc1cccc([C@@H]2CCN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450759750	EH	On-Demand	Anodyne	JAK3	19	50
Brc1cccc([C@@H]2CCN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450759750	EH	On-Demand	Anodyne	AKT1	35	42
Brc1cccc([C@@H]2CCN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450759750	EH	On-Demand	Anodyne	LIMK2	34	51
Brc1cccc([C@H]2CCN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450759753	EH	On-Demand	Anodyne	AKT2	52	56
Brc1cccc([C@H]2CCN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450759753	EH	On-Demand	Anodyne	JAK3	19	50
Brc1cccc([C@H]2CCN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450759753	EH	On-Demand	Anodyne	AKT1	35	42
Brc1cccc([C@H]2CCN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450759753	EH	On-Demand	Anodyne	LIMK2	34	51
CO[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C[C@@H]1C	ZINC000450759755	CD	On-Demand	Anodyne	PDE3A	48	37
COC(=O)C1(CN2CCC(O)(Cc3cccc(F)c3)CC2)CC1	ZINC000450759765	DE	On-Demand	Anodyne	SLC12A5	49	34
CO[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C[C@H]1C	ZINC000450759771	CD	On-Demand	Anodyne	PDE3A	48	37
COc1ccc(OC)c(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450759772	GD	On-Demand	Anodyne	DRD2	19	43
COc1ccc(OC)c(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450759772	GD	On-Demand	Anodyne	TSHR	49	33
COc1ccc(OC)c(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450759772	GD	On-Demand	Anodyne	DRD4	43	36
COc1ccc(OC)c(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450759772	GD	On-Demand	Anodyne	MTNR1A	52	39
COc1ccc(OC)c(CC(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450759772	GD	On-Demand	Anodyne	MTNR1B	51	36
CO[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C[C@H]1C	ZINC000450759774	CD	On-Demand	Anodyne	PDE3A	48	37
CC(C)(CO)C(C)(C)NC(=O)c1cc2ccncc2s1	ZINC000450759775	CF	On-Demand	Anodyne	SELE	42	33
CC(C)(CO)C(C)(C)NC(=O)c1cc2ccncc2s1	ZINC000450759775	CF	On-Demand	Anodyne	VCAM1	47	36
CO[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C[C@@H]1C	ZINC000450759777	CD	On-Demand	Anodyne	PDE3A	48	37
COC(=O)c1nc(N2CC[C@@H](c3nc(C)no3)C2)sc1C	ZINC000450759778	DD	On-Demand	Anodyne	PARE	41	39
COC(=O)c1nc(N2CC[C@H](c3nc(C)no3)C2)sc1C	ZINC000450759782	DD	On-Demand	Anodyne	PARE	41	39
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	HTR1A	15	53
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	DRD2	35	49
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	DRD1	19	49
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	DRD4	24	49
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	HTR2A	22	51
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	HTR2C	22	50
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	HRH1	15	48
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	DRD3	15	48
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	ERG2	24	51
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	HTR7	29	48
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	SIGMAR1	31	50
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	SLC18A3	0	50
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	EBP	22	51
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	FAAH	16	40
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	CYP2J2	60	44
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccccc1	ZINC000450759792	FH	On-Demand	Anodyne	NET	0	48
O=C(NCCO)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)nn1	ZINC000450759793	GD	On-Demand	Anodyne	SCD1	49	51
O=C(NCCO)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)nn1	ZINC000450759793	GD	On-Demand	Anodyne	SCD	38	43
O=C(NCCO)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)nn1	ZINC000450759794	GD	On-Demand	Anodyne	SCD1	49	51
O=C(NCCO)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)nn1	ZINC000450759794	GD	On-Demand	Anodyne	SCD	38	43
CCN(c1ccccc1)c1cc(N2CC[C@@H](OC)[C@@H](C)C2)ncn1	ZINC000450759809	EG	On-Demand	Anodyne	PDE3B	49	33
CCN(c1ccccc1)c1cc(N2CC[C@@H](OC)[C@H](C)C2)ncn1	ZINC000450759810	EG	On-Demand	Anodyne	PDE3B	49	33
CCN(c1ccccc1)c1cc(N2CC[C@H](OC)[C@@H](C)C2)ncn1	ZINC000450759811	EG	On-Demand	Anodyne	PDE3B	49	33
CCN(c1ccccc1)c1cc(N2CC[C@H](OC)[C@H](C)C2)ncn1	ZINC000450759812	EG	On-Demand	Anodyne	PDE3B	49	33
C[C@@H](NC(=O)C1(C(F)(F)F)CCC1)c1ccc2ncsc2c1	ZINC000450759825	EI	On-Demand	Anodyne	SDH1	0	46
C[C@H](NC(=O)C1(C(F)(F)F)CCC1)c1ccc2ncsc2c1	ZINC000450759832	EI	On-Demand	Anodyne	SDH1	0	46
COc1cccc(Oc2ccc(C(=O)NCCCCCS(C)(=O)=O)nc2)c1	ZINC000450759837	GF	On-Demand	Anodyne	DRD4	43	32
COc1cccc(Oc2ccc(C(=O)NCCCCCS(C)(=O)=O)nc2)c1	ZINC000450759837	GF	On-Demand	Anodyne	DRD3	15	45
COc1cccc(Oc2ccc(C(=O)NCCCCCS(C)(=O)=O)nc2)c1	ZINC000450759837	GF	On-Demand	Anodyne	MTNR1A	48	40
COc1cccc(Oc2ccc(C(=O)NCCCCCS(C)(=O)=O)nc2)c1	ZINC000450759837	GF	On-Demand	Anodyne	MTNR1B	45	40
COc1cccc(Oc2ccc(C(=O)NCCCCCS(C)(=O)=O)nc2)c1	ZINC000450759837	GF	On-Demand	Anodyne	CRTM	41	36
C[C@@H]1Cc2cccc(C(=O)Nc3cccc(CCCO)c3)c2O1	ZINC000450759842	DG	On-Demand	Anodyne	MTTP	49	33
C[C@@H]1Cc2cccc(C(=O)Nc3cccc(CCCO)c3)c2O1	ZINC000450759842	DG	On-Demand	Anodyne	KCNK3	47	34
C[C@@H]1Cc2cccc(C(=O)Nc3cccc(CCCO)c3)c2O1	ZINC000450759842	DG	On-Demand	Anodyne	KCNK9	53	34
C[C@H]1Cc2cccc(C(=O)Nc3cccc(CCCO)c3)c2O1	ZINC000450759845	DG	On-Demand	Anodyne	MTTP	49	33
C[C@H]1Cc2cccc(C(=O)Nc3cccc(CCCO)c3)c2O1	ZINC000450759845	DG	On-Demand	Anodyne	KCNK3	47	34
C[C@H]1Cc2cccc(C(=O)Nc3cccc(CCCO)c3)c2O1	ZINC000450759845	DG	On-Demand	Anodyne	KCNK9	53	34
CCC(=O)CCCN(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450759865	DI	On-Demand	Anodyne	CXCR4	93	51
Cn1nc(-c2ccccc2)cc1C(=O)NC(C)(CO)CO	ZINC000450759866	CC	On-Demand	Anodyne	CTSV	49	34
CCC(=O)CCCN(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450759868	DI	On-Demand	Anodyne	CXCR4	93	51
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccc(F)cc1	ZINC000450759877	DE	On-Demand	Anodyne	DRD2	31	44
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccc(F)cc1	ZINC000450759877	DE	On-Demand	Anodyne	HTR2A	22	53
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccc(F)cc1	ZINC000450759877	DE	On-Demand	Anodyne	HTR3B	0	47
O=C(CCCN1CCc2nnc(O)cc2C1)c1ccc(F)cc1	ZINC000450759877	DE	On-Demand	Anodyne	CYP2J2	49	35
C[C@@H](c1ccccc1)[C@H](O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450759887	FH	On-Demand	Anodyne	DRD4	28	44
C[C@@H](c1ccccc1)[C@H](O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450759887	FH	On-Demand	Anodyne	DRD3	24	44
C[C@@H](c1ccccc1)[C@H](O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450759887	FH	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H](c1ccccc1)[C@@H](O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450759889	FH	On-Demand	Anodyne	DRD4	28	44
C[C@@H](c1ccccc1)[C@@H](O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450759889	FH	On-Demand	Anodyne	DRD3	24	44
C[C@@H](c1ccccc1)[C@@H](O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450759889	FH	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450759891	FH	On-Demand	Anodyne	DRD4	28	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450759891	FH	On-Demand	Anodyne	DRD3	24	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450759891	FH	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450759893	FH	On-Demand	Anodyne	DRD4	28	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450759893	FH	On-Demand	Anodyne	DRD3	24	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450759893	FH	On-Demand	Anodyne	SLC6A3	15	40
Cn1nc(-c2ccccc2)cc1C(=O)NC(C)(C)C(C)(C)CO	ZINC000450759894	DF	On-Demand	Anodyne	CTSV	49	34
COC(=O)c1ccc(CN2CCCC3(CC3)C2)cc1Cl	ZINC000450759898	CH	On-Demand	Anodyne	Q9FYV8_MAIZE	39	40
CC(F)(F)c1ccc(C(=O)Nc2cccc(CCCO)c2)cn1	ZINC000450759907	DG	On-Demand	Anodyne	KCNK3	77	35
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450759909	EG	On-Demand	Anodyne	MMP2	22	40
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450759909	EG	On-Demand	Anodyne	MMP3	44	40
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450759911	EG	On-Demand	Anodyne	MMP2	22	40
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450759911	EG	On-Demand	Anodyne	MMP3	44	40
CCS(=O)(=O)c1ccc(CN2Cc3ccccc3C3(CC3)C2)cc1	ZINC000450759917	EH	On-Demand	Anodyne	SIGMAR1	21	44
CCCNc1ccccc1NC(=O)CNS(=O)(=O)NC	ZINC000450759935	DC	On-Demand	Anodyne	CA4	15	47
CCCc1nc(C)c(NC(=O)c2cn(-c3cccc(OC)c3)nn2)s1	ZINC000450759946	FG	On-Demand	Anodyne	DRD4	43	34
COC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450759957	CD	On-Demand	Anodyne	DRD2	25	41
COC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450759957	CD	On-Demand	Anodyne	DRD4	40	32
COC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450759957	CD	On-Demand	Anodyne	DRD3	33	43
COC(=O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450759957	CD	On-Demand	Anodyne	SIGMAR1	16	65
COC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450759958	CD	On-Demand	Anodyne	DRD2	25	41
COC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450759958	CD	On-Demand	Anodyne	DRD4	40	32
COC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450759958	CD	On-Demand	Anodyne	DRD3	33	43
COC(=O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450759958	CD	On-Demand	Anodyne	SIGMAR1	16	65
c1ccc2c(c1)CO[C@@]21CCCN(Cc2nnc(C3CC3)s2)C1	ZINC000450759982	EG	On-Demand	Anodyne	SIGMAR1	20	41
c1ccc2c(c1)CO[C@]21CCCN(Cc2nnc(C3CC3)s2)C1	ZINC000450759983	EG	On-Demand	Anodyne	SIGMAR1	20	41
CC[C@@](NC(=O)c1cc2ccncc2s1)(C(N)=O)C(C)C	ZINC000450759992	DE	On-Demand	Anodyne	ICAM1	62	37
CC(=O)N[C@H](C(=O)Nc1cn(Cc2ccccc2)nn1)C(C)(C)C	ZINC000450759993	ED	On-Demand	Anodyne	GAG-PRO	57	35
CC(=O)N[C@H](C(=O)Nc1cn(Cc2ccccc2)nn1)C(C)(C)C	ZINC000450759993	ED	On-Demand	Anodyne	Q82323_9DELA	64	30
CC[C@](NC(=O)c1cc2ccncc2s1)(C(N)=O)C(C)C	ZINC000450759995	DE	On-Demand	Anodyne	ICAM1	62	37
CCCc1nc(C)c(NC(=O)c2cccc(CC)n2)s1	ZINC000450759997	CH	On-Demand	Anodyne	PDE5A	24	41
CNC(=O)c1cccnc1N1CC[C@@H](OC)C(C)(C)C1	ZINC000450760006	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	32
CNC(=O)c1cccnc1N1CC[C@H](OC)C(C)(C)C1	ZINC000450760008	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	32
CC(C)c1nnc(COc2ccccc2C(F)(F)F)s1	ZINC000450760010	DI	On-Demand	Anodyne	SCD1	18	44
COC(=O)C1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CC1	ZINC000450760011	ED	On-Demand	Anodyne	PDE4D	15	40
COC(=O)C1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CC1	ZINC000450760014	ED	On-Demand	Anodyne	PDE4D	15	40
COc1cc(CN2CC[C@@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450760019	EH	On-Demand	Anodyne	SIGMAR1	55	64
COc1cc(CN2CC[C@@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450760019	EH	On-Demand	Anodyne	SLC18A3	32	52
COc1cc(CN2CC[C@@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450760019	EH	On-Demand	Anodyne	MCHR2	73	34
COc1cc(CN2CC[C@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450760021	EH	On-Demand	Anodyne	SIGMAR1	55	64
COc1cc(CN2CC[C@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450760021	EH	On-Demand	Anodyne	SLC18A3	32	52
COc1cc(CN2CC[C@]3(C2)OCc2ccccc23)ccc1Cl	ZINC000450760021	EH	On-Demand	Anodyne	MCHR2	73	34
CCC[C@@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450760023	CE	On-Demand	Anodyne	SIGMAR1	25	60
CCC[C@@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450760023	CE	On-Demand	Anodyne	SLC18A3	38	42
CCC[C@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450760026	CE	On-Demand	Anodyne	SIGMAR1	25	60
CCC[C@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450760026	CE	On-Demand	Anodyne	SLC18A3	38	42
CCC[C@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450760028	CE	On-Demand	Anodyne	SIGMAR1	25	60
CCC[C@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450760028	CE	On-Demand	Anodyne	SLC18A3	38	42
CCC[C@@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450760031	CE	On-Demand	Anodyne	SIGMAR1	25	60
CCC[C@@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450760031	CE	On-Demand	Anodyne	SLC18A3	38	42
COC(=O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760037	FE	On-Demand	Anodyne	MC4R	71	45
COC(=O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760037	FE	On-Demand	Anodyne	PRCP	58	40
COC(=O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760037	FE	On-Demand	Anodyne	NPBWR1	55	33
COC(=O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760040	FE	On-Demand	Anodyne	MC4R	71	45
COC(=O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760040	FE	On-Demand	Anodyne	PRCP	58	40
COC(=O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760040	FE	On-Demand	Anodyne	NPBWR1	55	33
COC(=O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760042	FE	On-Demand	Anodyne	MC4R	71	45
COC(=O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760042	FE	On-Demand	Anodyne	PRCP	58	40
COC(=O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760042	FE	On-Demand	Anodyne	NPBWR1	55	33
COC(=O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760043	FE	On-Demand	Anodyne	MC4R	71	45
COC(=O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760043	FE	On-Demand	Anodyne	PRCP	58	40
COC(=O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450760043	FE	On-Demand	Anodyne	NPBWR1	55	33
CO[C@H](Cc1ccccc1)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450760061	DG	On-Demand	Anodyne	SIGMAR1	47	55
CO[C@H](Cc1ccccc1)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450760061	DG	On-Demand	Anodyne	SLC18A3	36	44
Cc1ccc(F)c(CC(=O)NCc2nnc(C3CC3)o2)c1	ZINC000450760075	CE	On-Demand	Anodyne	P2RX7	27	41
CO[C@@H](Cc1ccccc1)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450760079	DG	On-Demand	Anodyne	SIGMAR1	47	55
CO[C@@H](Cc1ccccc1)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450760079	DG	On-Demand	Anodyne	SLC18A3	36	44
CC(=O)c1cccc(CN2CCO[C@@H](COCC3CC3)C2)c1	ZINC000450760080	DF	On-Demand	Anodyne	DRD4	26	45
CO[C@@H](Cc1ccccc1)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450760081	DG	On-Demand	Anodyne	SIGMAR1	47	55
CO[C@@H](Cc1ccccc1)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450760081	DG	On-Demand	Anodyne	SLC18A3	36	44
CC(=O)c1cccc(CN2CCO[C@H](COCC3CC3)C2)c1	ZINC000450760082	DF	On-Demand	Anodyne	DRD4	26	45
CO[C@H](Cc1ccccc1)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450760085	DG	On-Demand	Anodyne	SIGMAR1	47	55
CO[C@H](Cc1ccccc1)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450760085	DG	On-Demand	Anodyne	SLC18A3	36	44
O=C(NCC1(c2ccc(F)cc2F)CCCC1)C1(C(=O)C2CC2)CC1	ZINC000450760087	EH	On-Demand	Anodyne	ACAT	0	44
COc1ccc(Nc2cc(N3CC[C@H](OC)C(C)(C)C3)ncn2)c(OC)c1	ZINC000450760108	FG	On-Demand	Anodyne	PDE3B	57	36
COc1ccc(Nc2cc(N3CC[C@H](OC)C(C)(C)C3)ncn2)c(OC)c1	ZINC000450760108	FG	On-Demand	Anodyne	GALR2	43	35
COc1ccc(Nc2cc(N3CC[C@@H](OC)C(C)(C)C3)ncn2)c(OC)c1	ZINC000450760111	FG	On-Demand	Anodyne	PDE3B	57	36
COc1ccc(Nc2cc(N3CC[C@@H](OC)C(C)(C)C3)ncn2)c(OC)c1	ZINC000450760111	FG	On-Demand	Anodyne	GALR2	43	35
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(c2ccsc2)CC1	ZINC000450760125	DH	On-Demand	Anodyne	NPBWR1	96	37
Clc1ccc(CCN2CCO[C@H](COCC3CC3)C2)cc1	ZINC000450760138	DG	On-Demand	Anodyne	DRD4	15	51
Clc1ccc(CCN2CCO[C@H](COCC3CC3)C2)cc1	ZINC000450760138	DG	On-Demand	Anodyne	SIGMAR1	17	46
Clc1ccc(CCN2CCO[C@@H](COCC3CC3)C2)cc1	ZINC000450760140	DG	On-Demand	Anodyne	DRD4	15	51
Clc1ccc(CCN2CCO[C@@H](COCC3CC3)C2)cc1	ZINC000450760140	DG	On-Demand	Anodyne	SIGMAR1	17	46
COc1cc(CN2CCN(C[C@@H](C)O)C[C@H]2C)ccc1Cl	ZINC000450760167	DE	On-Demand	Anodyne	CCR1	27	42
COc1cc(CN2CCN(C[C@H](C)O)C[C@H]2C)ccc1Cl	ZINC000450760168	DE	On-Demand	Anodyne	CCR1	27	42
COc1cc(CN2CCN(C[C@@H](C)O)C[C@@H]2C)ccc1Cl	ZINC000450760169	DE	On-Demand	Anodyne	CCR1	27	42
COc1cc(CN2CCN(C[C@H](C)O)C[C@@H]2C)ccc1Cl	ZINC000450760170	DE	On-Demand	Anodyne	CCR1	27	42
CCOc1cc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)on1	ZINC000450760172	ED	On-Demand	Anodyne	TACR3	41	36
CCOc1cc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)on1	ZINC000450760173	ED	On-Demand	Anodyne	TACR3	41	36
c1ccc2c(c1)CO[C@]21CCN(Cc2cnn[nH]2)C1	ZINC000450760192	CD	On-Demand	Anodyne	SIGMAR1	29	52
c1ccc2c(c1)CO[C@]21CCN(Cc2cnn[nH]2)C1	ZINC000450760192	CD	On-Demand	Anodyne	SLC18A3	22	44
c1ccc2c(c1)CO[C@@]21CCN(Cc2cnn[nH]2)C1	ZINC000450760194	CD	On-Demand	Anodyne	SIGMAR1	29	52
c1ccc2c(c1)CO[C@@]21CCN(Cc2cnn[nH]2)C1	ZINC000450760194	CD	On-Demand	Anodyne	SLC18A3	22	44
COC[C@H]1CCCCN(CC/C=C/c2ccccc2)C1	ZINC000450760199	CH	On-Demand	Anodyne	SLC6A1	111	39
COC[C@H]1CCCCN(CC/C=C/c2ccccc2)C1	ZINC000450760199	CH	On-Demand	Anodyne	SIGMAR1	17	53
COC[C@@H]1CCCCN(CC/C=C/c2ccccc2)C1	ZINC000450760200	CH	On-Demand	Anodyne	SLC6A1	111	39
COC[C@@H]1CCCCN(CC/C=C/c2ccccc2)C1	ZINC000450760200	CH	On-Demand	Anodyne	SIGMAR1	17	53
COC[C@@H]1CCCCN(CC/C=C\c2ccccc2)C1	ZINC000450760201	CH	On-Demand	Anodyne	SLC6A1	111	39
COC[C@@H]1CCCCN(CC/C=C\c2ccccc2)C1	ZINC000450760201	CH	On-Demand	Anodyne	SIGMAR1	17	53
COC[C@H]1CCCCN(CC/C=C\c2ccccc2)C1	ZINC000450760202	CH	On-Demand	Anodyne	SLC6A1	111	39
COC[C@H]1CCCCN(CC/C=C\c2ccccc2)C1	ZINC000450760202	CH	On-Demand	Anodyne	SIGMAR1	17	53
COCC[C@@H]1CCCCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450760212	EH	On-Demand	Anodyne	SLC6A1	74	37
COCC[C@H]1CCCCN(Cc2cccc(C(=O)OC)c2Cl)C1	ZINC000450760213	EH	On-Demand	Anodyne	SLC6A1	74	37
COc1ccc(C[C@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)cc1	ZINC000450760215	GE	On-Demand	Anodyne	ACE	18	43
COc1ccc(C[C@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)cc1	ZINC000450760215	GE	On-Demand	Anodyne	MME	36	43
COc1ccc(C[C@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)cc1	ZINC000450760215	GE	On-Demand	Anodyne	ACE2	45	34
COc1ccc(C[C@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)cc1	ZINC000450760215	GE	On-Demand	Anodyne	PSMB8	46	32
COc1ccc(C[C@@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)cc1	ZINC000450760216	GE	On-Demand	Anodyne	ACE	18	43
COc1ccc(C[C@@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)cc1	ZINC000450760216	GE	On-Demand	Anodyne	MME	36	43
COc1ccc(C[C@@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)cc1	ZINC000450760216	GE	On-Demand	Anodyne	ACE2	45	34
COc1ccc(C[C@@H](C)C(=O)NCCN2c3ccccc3NS2(=O)=O)cc1	ZINC000450760216	GE	On-Demand	Anodyne	PSMB8	46	32
CC(=O)[C@@](C)(O)CN1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450760224	CE	On-Demand	Anodyne	MDM2	63	35
CC(=O)[C@@](C)(O)CN1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450760225	CE	On-Demand	Anodyne	MDM2	63	35
CC(=O)[C@](C)(O)CN1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450760226	CE	On-Demand	Anodyne	MDM2	63	35
CC(=O)[C@](C)(O)CN1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450760227	CE	On-Demand	Anodyne	MDM2	63	35
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(CCCO)c2)cn1	ZINC000450760247	FG	On-Demand	Anodyne	GCK	23	41
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(CCCO)c2)cn1	ZINC000450760247	FG	On-Demand	Anodyne	KCNK3	79	37
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(CCCO)c2)cn1	ZINC000450760247	FG	On-Demand	Anodyne	KCNK9	61	34
COc1ccc2c(N3CC[C@@H](OC)[C@@H](C)C3)ncnc2c1F	ZINC000450760248	DF	On-Demand	Anodyne	PDE3A	56	44
COc1ccc2c(N3CC[C@@H](OC)[C@@H](C)C3)ncnc2c1F	ZINC000450760248	DF	On-Demand	Anodyne	PDE3B	83	44
COc1ccc2c(N3CC[C@H](OC)[C@@H](C)C3)ncnc2c1F	ZINC000450760250	DF	On-Demand	Anodyne	PDE3A	56	44
COc1ccc2c(N3CC[C@H](OC)[C@@H](C)C3)ncnc2c1F	ZINC000450760250	DF	On-Demand	Anodyne	PDE3B	83	44
COc1ccc2c(N3CC[C@H](OC)[C@H](C)C3)ncnc2c1F	ZINC000450760251	DF	On-Demand	Anodyne	PDE3A	56	44
COc1ccc2c(N3CC[C@H](OC)[C@H](C)C3)ncnc2c1F	ZINC000450760251	DF	On-Demand	Anodyne	PDE3B	83	44
COc1ccc2c(N3CC[C@@H](OC)[C@H](C)C3)ncnc2c1F	ZINC000450760253	DF	On-Demand	Anodyne	PDE3A	56	44
COc1ccc2c(N3CC[C@@H](OC)[C@H](C)C3)ncnc2c1F	ZINC000450760253	DF	On-Demand	Anodyne	PDE3B	83	44
CO[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1(C)C	ZINC000450760270	FE	On-Demand	Anodyne	CXCR3	27	41
CO[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1(C)C	ZINC000450760270	FE	On-Demand	Anodyne	LRRK2	35	45
CO[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1(C)C	ZINC000450760272	FE	On-Demand	Anodyne	CXCR3	27	41
CO[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1(C)C	ZINC000450760272	FE	On-Demand	Anodyne	LRRK2	35	45
COCCOC[C@H](O)CN(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450760279	EE	On-Demand	Anodyne	CXCR4	84	44
COCCOC[C@H](O)CN(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450760280	EE	On-Demand	Anodyne	CXCR4	84	44
COCCOC[C@@H](O)CN(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450760281	EE	On-Demand	Anodyne	CXCR4	84	44
COCCOC[C@@H](O)CN(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450760282	EE	On-Demand	Anodyne	CXCR4	84	44
O=C(CCCN1C[C@@H]2CCC(=O)c3cccc1c32)c1ccccc1	ZINC000450760284	DI	On-Demand	Anodyne	CYSLTR2	55	35
O=C(CCCN1C[C@@H]2CCC(=O)c3cccc1c32)c1ccccc1	ZINC000450760284	DI	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1C[C@H]2CCC(=O)c3cccc1c32)c1ccccc1	ZINC000450760285	DI	On-Demand	Anodyne	CYSLTR2	55	35
O=C(CCCN1C[C@H]2CCC(=O)c3cccc1c32)c1ccccc1	ZINC000450760285	DI	On-Demand	Anodyne	CYP2J2	49	34
C[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@H]1CCCN(C2CCC2)C1	ZINC000450760286	FI	On-Demand	Anodyne	BIRC2	42	35
C[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450760289	FI	On-Demand	Anodyne	BIRC2	42	35
C[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450760291	FI	On-Demand	Anodyne	BIRC2	42	35
C[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@H]1CCCN(C2CCC2)C1	ZINC000450760294	FI	On-Demand	Anodyne	BIRC2	42	35
CN1CCC[C@H](C(=O)N2CCC(c3ccsc3)CC2)C1=O	ZINC000450760342	DE	On-Demand	Anodyne	NPBWR1	51	30
CN1CCC[C@@H](C(=O)N2CCC(c3ccsc3)CC2)C1=O	ZINC000450760344	DE	On-Demand	Anodyne	NPBWR1	51	30
COc1ccc(CNC(=O)CCSc2n[nH]c(C(C)(C)C)n2)c(OC)c1	ZINC000450760366	GF	On-Demand	Anodyne	PDGFRB	32	42
COc1ccc(CNC(=O)CCSc2n[nH]c(C(C)(C)C)n2)c(OC)c1	ZINC000450760366	GF	On-Demand	Anodyne	ENPP1	46	30
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCC(c2ccsc2)CC1	ZINC000450760381	EI	On-Demand	Anodyne	NPBWR1	82	33
CO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1(C)C	ZINC000450760383	FG	On-Demand	Anodyne	MMP13	27	42
CO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1(C)C	ZINC000450760383	FG	On-Demand	Anodyne	ALK	16	40
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(Br)cc1	ZINC000450760385	EF	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(Br)cc1	ZINC000450760385	EF	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(Br)cc1	ZINC000450760385	EF	On-Demand	Anodyne	CYP2J2	51	36
CO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1(C)C	ZINC000450760388	FG	On-Demand	Anodyne	MMP13	27	42
CO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1(C)C	ZINC000450760388	FG	On-Demand	Anodyne	ALK	16	40
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(Br)cc1	ZINC000450760390	EF	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(Br)cc1	ZINC000450760390	EF	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(Br)cc1	ZINC000450760390	EF	On-Demand	Anodyne	CYP2J2	51	36
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C)CCC[C@H]3C)CC2)c1	ZINC000450760393	DH	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C)CCC[C@H]3C)CC2)c1	ZINC000450760393	DH	On-Demand	Anodyne	HCRTR2	17	43
Cc1ccnc(OC2CCN(C(=O)[C@]3(C)CCC[C@H]3C)CC2)c1	ZINC000450760395	DH	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@]3(C)CCC[C@H]3C)CC2)c1	ZINC000450760395	DH	On-Demand	Anodyne	HCRTR2	17	43
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	DRD4	19	40
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	OPRK1	25	40
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	CCR5	40	50
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	MTNR1A	25	40
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	MTNR1B	21	40
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	MCHR1	15	42
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	XIAP	40	36
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	BIRC2	76	47
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760396	CD	On-Demand	Anodyne	BIRC8	53	34
Cc1ccnc(OC2CCN(C(=O)[C@]3(C)CCC[C@@H]3C)CC2)c1	ZINC000450760397	DH	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@]3(C)CCC[C@@H]3C)CC2)c1	ZINC000450760397	DH	On-Demand	Anodyne	HCRTR2	17	43
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C)CCC[C@@H]3C)CC2)c1	ZINC000450760399	DH	On-Demand	Anodyne	HCRTR1	0	43
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C)CCC[C@@H]3C)CC2)c1	ZINC000450760399	DH	On-Demand	Anodyne	HCRTR2	17	43
COC(=O)CN1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450760405	FC	On-Demand	Anodyne	L3MBTL1	0	41
COC(=O)CN1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450760405	FC	On-Demand	Anodyne	L3MBTL3	73	38
COC(=O)CN1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450760405	FC	On-Demand	Anodyne	MBTD1	0	41
CC(F)(F)c1ccc(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)cn1	ZINC000450760406	FJ	On-Demand	Anodyne	SFRP1	57	39
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	DRD4	19	40
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	OPRK1	25	40
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	CCR5	40	50
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	MTNR1A	25	40
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	MTNR1B	21	40
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	MCHR1	15	42
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	XIAP	40	36
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	BIRC2	76	47
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760408	CD	On-Demand	Anodyne	BIRC8	53	34
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	DRD4	19	40
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	OPRK1	25	40
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	CCR5	40	50
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	MTNR1A	25	40
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	MTNR1B	21	40
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	MCHR1	15	42
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	XIAP	40	36
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	BIRC2	76	47
CNC(=O)N[C@@H]1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450760409	CD	On-Demand	Anodyne	BIRC8	53	34
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	DRD4	19	40
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	OPRK1	25	40
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	CCR5	40	50
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	MTNR1A	25	40
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	MTNR1B	21	40
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	MCHR1	15	42
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	XIAP	40	36
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	BIRC2	76	47
CNC(=O)N[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450760410	CD	On-Demand	Anodyne	BIRC8	53	34
C[C@@H](O)CCN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450760412	DF	On-Demand	Anodyne	HTR1A	28	40
C[C@@H](O)CCN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450760412	DF	On-Demand	Anodyne	DRD2	32	50
C[C@@H](O)CCN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450760412	DF	On-Demand	Anodyne	DRD3	43	50
COc1cccc([C@@H]2C[C@H]2C(=O)N(CCO)CC2CCCCC2)c1	ZINC000450760413	EG	On-Demand	Anodyne	GPR88	0	44
C[C@H](O)CCN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450760414	DF	On-Demand	Anodyne	HTR1A	28	40
C[C@H](O)CCN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450760414	DF	On-Demand	Anodyne	DRD2	32	50
C[C@H](O)CCN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450760414	DF	On-Demand	Anodyne	DRD3	43	50
CO[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450760419	DE	On-Demand	Bother	PDE3A	46	35
CO[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450760419	DE	On-Demand	Bother	PDE3B	69	35
CO[C@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450760421	DE	On-Demand	Bother	PDE3A	46	35
CO[C@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450760421	DE	On-Demand	Bother	PDE3B	69	35
CO[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450760423	DE	On-Demand	Bother	PDE3A	46	35
CO[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450760423	DE	On-Demand	Bother	PDE3B	69	35
CCS(=O)(=O)c1ccc(CN[C@@H]2CCCC[C@H]2c2ccccc2)cc1	ZINC000450760425	FI	On-Demand	Anodyne	GRIA4	19	48
CC[C@@H](CC(F)(F)F)C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450760426	GH	On-Demand	Anodyne	RBP4	75	36
CO[C@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450760427	DE	On-Demand	Bother	PDE3A	46	35
CO[C@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450760427	DE	On-Demand	Bother	PDE3B	69	35
CC(F)(F)c1ccc(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)cn1	ZINC000450760428	FJ	On-Demand	Anodyne	SFRP1	57	39
CCS(=O)(=O)c1ccc(CN[C@@H]2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450760429	FI	On-Demand	Anodyne	GRIA4	19	48
CC[C@@H](CC(F)(F)F)C(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450760430	GH	On-Demand	Anodyne	RBP4	75	36
COC(=O)[C@@H](NCc1nnc(C2CC2)s1)c1ccc(F)c(C)c1	ZINC000450760431	EF	On-Demand	Anodyne	LEF	42	32
CCS(=O)(=O)c1ccc(CN[C@H]2CCCC[C@@H]2c2ccccc2)cc1	ZINC000450760432	FI	On-Demand	Anodyne	GRIA4	19	48
CC(F)(F)c1ccc(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)cn1	ZINC000450760433	FJ	On-Demand	Anodyne	SFRP1	57	39
CC[C@H](CC(F)(F)F)C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450760434	GH	On-Demand	Anodyne	RBP4	75	36
COC(=O)[C@H](NCc1nnc(C2CC2)s1)c1ccc(F)c(C)c1	ZINC000450760435	EF	On-Demand	Anodyne	LEF	42	32
CCS(=O)(=O)c1ccc(CN[C@H]2CCCC[C@H]2c2ccccc2)cc1	ZINC000450760436	FI	On-Demand	Anodyne	GRIA4	19	48
CC(F)(F)c1ccc(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)cn1	ZINC000450760437	FJ	On-Demand	Anodyne	SFRP1	57	39
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760438	FE	On-Demand	Anodyne	DRD4	25	41
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760438	FE	On-Demand	Anodyne	HTR2A	20	45
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760438	FE	On-Demand	Anodyne	UTS2R	18	43
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760438	FE	On-Demand	Anodyne	CYP2J2	58	41
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760438	FE	On-Demand	Anodyne	BIRC2	43	39
CC[C@H](CC(F)(F)F)C(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450760439	GH	On-Demand	Anodyne	RBP4	75	36
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760441	FE	On-Demand	Anodyne	DRD4	25	41
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760441	FE	On-Demand	Anodyne	HTR2A	20	45
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760441	FE	On-Demand	Anodyne	UTS2R	18	43
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760441	FE	On-Demand	Anodyne	CYP2J2	58	41
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450760441	FE	On-Demand	Anodyne	BIRC2	43	39
Cc1noc([C@H]2CCN(c3nc4ccccc4nc3N3CCC(C)CC3)C2)n1	ZINC000450760445	GH	On-Demand	Anodyne	SMO	44	35
O=C(Nc1cccc(CCCO)c1)c1cnc(C2CC2)nc1	ZINC000450760453	CF	On-Demand	Anodyne	KCNK3	69	36
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1cccc(CCCO)c1	ZINC000450760466	GF	On-Demand	Anodyne	CA7	17	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1cccc(CCCO)c1	ZINC000450760466	GF	On-Demand	Anodyne	CA5B	53	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1cccc(CCCO)c1	ZINC000450760466	GF	On-Demand	Anodyne	CA5A	56	40
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1cccc(CCCO)c1	ZINC000450760466	GF	On-Demand	Anodyne	E1	0	44
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)Nc1cccc(CCCO)c1	ZINC000450760466	GF	On-Demand	Anodyne	RORC	67	41
COCCC1(CNC(=O)c2ccc(C(C)(F)F)nc2)CCCCC1	ZINC000450760474	EH	On-Demand	Anodyne	HCN1	49	30
COCCC1(CNC(=O)c2ccc(C(C)(F)F)nc2)CCCCC1	ZINC000450760474	EH	On-Demand	Anodyne	HCN4	47	30
COc1ccc(NC(=O)CCCC(=O)C2CC2)cc1[N+](=O)[O-]	ZINC000450760476	DF	On-Demand	Bother	ENPP1	54	31
CC1CCN(c2nnc(S[C@H](C)C(=O)Nc3nccs3)n2C2CC2)CC1	ZINC000450760479	GG	On-Demand	Anodyne	MAP1	55	32
COc1ccc(CNC(=O)CCN[C@@H](CO)c2sccc2C)c(OC)c1	ZINC000450760480	GE	On-Demand	Anodyne	MTNR1A	45	35
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760484	GF	On-Demand	Anodyne	MAPK14	23	43
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760484	GF	On-Demand	Anodyne	SCD1	37	41
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760484	GF	On-Demand	Anodyne	SFRP1	87	34
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760484	GF	On-Demand	Anodyne	SCD	32	41
Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760484	GF	On-Demand	Anodyne	WNT3	47	32
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3CCC(C)CC3)C2)n1	ZINC000450760485	GH	On-Demand	Anodyne	SMO	44	35
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760487	GF	On-Demand	Anodyne	MAPK14	23	43
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760487	GF	On-Demand	Anodyne	SCD1	37	41
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760487	GF	On-Demand	Anodyne	SFRP1	87	34
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760487	GF	On-Demand	Anodyne	SCD	32	41
Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)ncc1C(N)=O	ZINC000450760487	GF	On-Demand	Anodyne	WNT3	47	32
CO[C@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1(C)C	ZINC000450760489	FI	On-Demand	Bother	TAAR1	15	46
CO[C@@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1(C)C	ZINC000450760492	FI	On-Demand	Bother	TAAR1	15	46
COc1ccc(CNC(=O)CCN[C@H](CO)c2sccc2C)c(OC)c1	ZINC000450760493	GE	On-Demand	Anodyne	MTNR1A	45	35
COC(=O)c1csc(CN2CCC[C@]2(C)Cc2ccccc2)n1	ZINC000450760497	EH	On-Demand	Anodyne	SLC12A5	60	38
COC(=O)c1csc(CN2CCC[C@@]2(C)Cc2ccccc2)n1	ZINC000450760498	EH	On-Demand	Anodyne	SLC12A5	60	38
CC1CCN(c2nnc(S[C@@H](C)C(=O)Nc3nccs3)n2C2CC2)CC1	ZINC000450760499	GG	On-Demand	Anodyne	MAP1	55	32
COc1cccc(-n2cc(C(=O)NC(C)(C)C(C)(C)CO)nn2)c1	ZINC000450760509	ED	On-Demand	Anodyne	DRD4	42	33
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450760526	EI	On-Demand	Anodyne	CCR1	38	43
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450760542	EI	On-Demand	Anodyne	CCR1	38	43
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450760543	FH	On-Demand	Anodyne	RBP4	63	40
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450760547	FH	On-Demand	Anodyne	RBP4	63	40
CC(=O)[C@](C)(O)CN[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000450760566	DD	On-Demand	Anodyne	DRD4	45	48
CC(=O)[C@](C)(O)CN[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000450760566	DD	On-Demand	Anodyne	ACHE	36	43
CC(=O)[C@](C)(O)CN[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000450760566	DD	On-Demand	Anodyne	DRD3	29	48
CCC[C@H](OC)C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450760567	FF	On-Demand	Anodyne	RBP4	67	35
CC(=O)[C@](C)(O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450760568	DD	On-Demand	Anodyne	DRD4	45	48
CC(=O)[C@](C)(O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450760568	DD	On-Demand	Anodyne	ACHE	36	43
CC(=O)[C@](C)(O)CN[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450760568	DD	On-Demand	Anodyne	DRD3	29	48
CCC[C@@H](OC)C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450760570	FF	On-Demand	Anodyne	RBP4	67	35
CC(=O)[C@](C)(O)CN[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000450760571	DD	On-Demand	Anodyne	DRD4	45	48
CC(=O)[C@](C)(O)CN[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000450760571	DD	On-Demand	Anodyne	ACHE	36	43
CC(=O)[C@](C)(O)CN[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000450760571	DD	On-Demand	Anodyne	DRD3	29	48
CC(=O)[C@](C)(O)CN[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450760572	DD	On-Demand	Anodyne	DRD4	45	48
CC(=O)[C@](C)(O)CN[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450760572	DD	On-Demand	Anodyne	ACHE	36	43
CC(=O)[C@](C)(O)CN[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000450760572	DD	On-Demand	Anodyne	DRD3	29	48
CCC[C@H](OC)C(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450760573	FF	On-Demand	Anodyne	RBP4	67	35
CCC[C@@H](OC)C(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450760575	FF	On-Demand	Anodyne	RBP4	67	35
Cc1csc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000450760579	FG	On-Demand	Anodyne	RBP4	59	38
Cc1csc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000450760581	FG	On-Demand	Anodyne	RBP4	59	38
N#CCC1(O)CN(C(=O)c2ccc(I)cc2F)C1	ZINC000450760600	FD	On-Demand	Mild	MAP2K1	23	51
COc1cc(-c2noc(CN[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C)n2)ncn1	ZINC000450760627	GF	On-Demand	Anodyne	DRD4	23	40
COc1cc(-c2noc(CN[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C)n2)ncn1	ZINC000450760627	GF	On-Demand	Anodyne	DRD3	0	40
COc1ccc(Oc2ccc(C(=O)N[C@H](CO)C(C)(C)C)nc2)cc1	ZINC000450760631	EG	On-Demand	Anodyne	ACACA	40	37
COc1cc(-c2noc(CN[C@@H]3CCN(Cc4ccccc4)C[C@H]3C)n2)ncn1	ZINC000450760632	GF	On-Demand	Anodyne	DRD4	23	40
COc1cc(-c2noc(CN[C@@H]3CCN(Cc4ccccc4)C[C@H]3C)n2)ncn1	ZINC000450760632	GF	On-Demand	Anodyne	DRD3	0	40
O=C(N[C@H](CO)c1ccc(Cl)cc1)[C@H](O)C1CCC1	ZINC000450760634	CD	On-Demand	Anodyne	METAP2	17	52
COc1cc(-c2noc(CN[C@H]3CCN(Cc4ccccc4)C[C@@H]3C)n2)ncn1	ZINC000450760635	GF	On-Demand	Anodyne	DRD4	23	40
COc1cc(-c2noc(CN[C@H]3CCN(Cc4ccccc4)C[C@@H]3C)n2)ncn1	ZINC000450760635	GF	On-Demand	Anodyne	DRD3	0	40
O=C(N[C@H](CO)c1ccc(Cl)cc1)[C@@H](O)C1CCC1	ZINC000450760637	CD	On-Demand	Anodyne	METAP2	17	52
COc1cc(-c2noc(CN[C@H]3CCN(Cc4ccccc4)C[C@H]3C)n2)ncn1	ZINC000450760639	GF	On-Demand	Anodyne	DRD4	23	40
COc1cc(-c2noc(CN[C@H]3CCN(Cc4ccccc4)C[C@H]3C)n2)ncn1	ZINC000450760639	GF	On-Demand	Anodyne	DRD3	0	40
O=C(N[C@@H](CO)c1ccc(Cl)cc1)[C@H](O)C1CCC1	ZINC000450760640	CD	On-Demand	Anodyne	METAP2	17	52
CCCc1nc(C)c(NC(=O)Cc2ccc(C(=O)OC)cc2)s1	ZINC000450760641	EG	On-Demand	Anodyne	MAPK9	0	46
CCCc1nc(C)c(NC(=O)Cc2ccc(C(=O)OC)cc2)s1	ZINC000450760641	EG	On-Demand	Anodyne	MAPK10	26	46
CCCc1nc(C)c(NC(=O)Cc2ccc(C(=O)OC)cc2)s1	ZINC000450760641	EG	On-Demand	Anodyne	MAPK8	23	46
O=C(N[C@@H](CO)c1ccc(Cl)cc1)[C@@H](O)C1CCC1	ZINC000450760642	CD	On-Demand	Anodyne	METAP2	17	52
COc1cc(CC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)ccc1O	ZINC000450760645	GG	On-Demand	Anodyne	TRPV1	0	42
CCCc1nc(C)c(NC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450760650	EI	On-Demand	Anodyne	P2RY12	88	35
CCCc1nc(C)c(NC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450760650	EI	On-Demand	Anodyne	TACR3	41	34
CCCc1nc(C)c(NC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450760650	EI	On-Demand	Anodyne	CTSV	46	34
CCCc1nc(C)c(NC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450760650	EI	On-Demand	Anodyne	GPR142	24	41
CCCc1nc(C)c(NC(=O)c2cc(-c3ccccc3)nn2C)s1	ZINC000450760650	EI	On-Demand	Anodyne	AGER	0	41
CC(C)[C@H](C(=O)NCCN1c2ccccc2NS1(=O)=O)c1cccnc1	ZINC000450760651	FE	On-Demand	Anodyne	KCNA5	43	37
CC(C)[C@@H](C(=O)NCCN1c2ccccc2NS1(=O)=O)c1cccnc1	ZINC000450760654	FE	On-Demand	Anodyne	KCNA5	43	37
CCOC(=O)c1cccnc1N1CC[C@@H](c2nc(C)no2)C1	ZINC000450760657	DD	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)c1cccnc1N1CC[C@@H](c2nc(C)no2)C1	ZINC000450760657	DD	On-Demand	Anodyne	ETHR	41	35
CCOC(=O)c1cccnc1N1CC[C@H](c2nc(C)no2)C1	ZINC000450760677	DD	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)c1cccnc1N1CC[C@H](c2nc(C)no2)C1	ZINC000450760677	DD	On-Demand	Anodyne	ETHR	41	35
CCN1C[C@H](Nc2ccc(S(=O)(=O)NCC3CC3)cn2)CC1=O	ZINC000450760688	EC	On-Demand	Anodyne	NPY2R	44	35
CCN1C[C@@H](Nc2ccc(S(=O)(=O)NCC3CC3)cn2)CC1=O	ZINC000450760689	EC	On-Demand	Anodyne	NPY2R	44	35
COc1ccc(CNC(=O)CCN2CCCC3(CC3)C2)c(OC)c1	ZINC000450760711	EF	On-Demand	Anodyne	HTR7	24	40
COc1ccc(CNC(=O)CCN2CCCC3(CC3)C2)c(OC)c1	ZINC000450760711	EF	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN2CCCC3(CC3)C2)c(OC)c1	ZINC000450760711	EF	On-Demand	Anodyne	EBP	26	42
Fc1ccc(CC2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1F	ZINC000450760716	EG	On-Demand	Anodyne	SIGMAR1	20	41
NC(=O)c1ccc(N2C[C@H]3CCCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450760724	CE	On-Demand	Bother	MDAA	0	43
CC(C)Oc1ccccc1C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760725	GE	On-Demand	Anodyne	HCN1	57	41
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450760739	FI	On-Demand	Anodyne	ACACA	56	36
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000450760741	FI	On-Demand	Anodyne	ACACA	56	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000450760744	FI	On-Demand	Anodyne	ACACA	56	36
C[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc2ncsc2c1	ZINC000450760746	FI	On-Demand	Anodyne	ACACA	56	36
COC[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450760751	CH	On-Demand	Anodyne	SLC6A3	17	41
COC[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450760751	CH	On-Demand	Anodyne	HRH3	31	48
COC[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450760751	CH	On-Demand	Anodyne	SIGMAR1	39	47
COC[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450760751	CH	On-Demand	Anodyne	BIRC2	41	44
COC[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450760753	CH	On-Demand	Anodyne	SLC6A3	17	41
COC[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450760753	CH	On-Demand	Anodyne	HRH3	31	48
COC[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450760753	CH	On-Demand	Anodyne	SIGMAR1	39	47
COC[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450760753	CH	On-Demand	Anodyne	BIRC2	41	44
Cn1c(SCCC(C)(F)F)nnc1-c1cccs1	ZINC000450760760	CH	On-Demand	Anodyne	DRD2	19	44
Cn1c(SCCC(C)(F)F)nnc1-c1cccs1	ZINC000450760760	CH	On-Demand	Anodyne	DRD3	48	40
Cn1c(SCCC(C)(F)F)nnc1-c1cccs1	ZINC000450760760	CH	On-Demand	Anodyne	KCNH2	24	44
Cc1ccc(C(=O)N2CCC(=O)[C@H](C)C2)c(Cl)c1Cl	ZINC000450760787	DG	On-Demand	Anodyne	P2RX7	22	44
Cc1ccc(C(=O)N2CCC(=O)[C@@H](C)C2)c(Cl)c1Cl	ZINC000450760788	DG	On-Demand	Anodyne	P2RX7	22	44
C[C@@H](CC1CCCCC1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760789	FF	On-Demand	Anodyne	PGC	44	31
C[C@@H](CC1CCCCC1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760789	FF	On-Demand	Anodyne	MMP2	45	33
C[C@@H](CC1CCCCC1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760789	FF	On-Demand	Anodyne	REN	82	35
C[C@@H](CC1CCCCC1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760789	FF	On-Demand	Anodyne	PROC	40	35
C[C@H](CC1CCCCC1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760790	FF	On-Demand	Anodyne	PGC	44	31
C[C@H](CC1CCCCC1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760790	FF	On-Demand	Anodyne	MMP2	45	33
C[C@H](CC1CCCCC1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760790	FF	On-Demand	Anodyne	REN	82	35
C[C@H](CC1CCCCC1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450760790	FF	On-Demand	Anodyne	PROC	40	35
COC(=O)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450760809	FE	On-Demand	Anodyne	FOLH1	41	41
COC(=O)[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450760809	FE	On-Demand	Anodyne	ADRB3	20	40
COC(=O)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450760810	FE	On-Demand	Anodyne	FOLH1	41	41
COC(=O)[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450760810	FE	On-Demand	Anodyne	ADRB3	20	40
COC(=O)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450760811	FE	On-Demand	Anodyne	FOLH1	41	41
COC(=O)[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450760811	FE	On-Demand	Anodyne	ADRB3	20	40
COC(=O)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450760812	FE	On-Demand	Anodyne	FOLH1	41	41
COC(=O)[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OC)c(O)c1	ZINC000450760812	FE	On-Demand	Anodyne	ADRB3	20	40
CO[C@H]1CCN(c2c(C#N)cnc3ccc(C)cc23)CC1(C)C	ZINC000450760813	DH	On-Demand	Mild	SRC	41	34
CO[C@@H]1CCN(c2c(C#N)cnc3ccc(C)cc23)CC1(C)C	ZINC000450760814	DH	On-Demand	Mild	SRC	41	34
O=C(Nc1ccccc1NCC1CCCCC1)[C@H](O)C1CCC1	ZINC000450760826	DH	On-Demand	Anodyne	METAP2	32	43
O=C(Nc1ccccc1NCC1CCCCC1)[C@@H](O)C1CCC1	ZINC000450760827	DH	On-Demand	Anodyne	METAP2	32	43
COc1cc(CC(=O)N(CCO)CC2CCCCC2)ccc1O	ZINC000450760829	DE	On-Demand	Anodyne	SHBG	17	40
CCCNc1ccccc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450760848	DH	On-Demand	Anodyne	KCNQ2	43	35
COC(=O)C1(CNC(=O)[C@H]2CCCc3sc(Nc4ccccc4)nc32)CC1	ZINC000450760866	GF	On-Demand	Anodyne	CYP2D6	16	42
COC(=O)C1(CNC(=O)[C@@H]2CCCc3sc(Nc4ccccc4)nc32)CC1	ZINC000450760867	GF	On-Demand	Anodyne	CYP2D6	16	42
CC[C@](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)(C(N)=O)C(C)C	ZINC000450760880	GG	On-Demand	Anodyne	PDE6D	91	38
CC[C@](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)(C(N)=O)C(C)C	ZINC000450760880	GG	On-Demand	Anodyne	IMDH_CRYPV	37	52
CC[C@@](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)(C(N)=O)C(C)C	ZINC000450760882	GG	On-Demand	Anodyne	PDE6D	91	38
CC[C@@](NC(=O)Cn1c(-c2ccccc2)nc2ccccc21)(C(N)=O)C(C)C	ZINC000450760882	GG	On-Demand	Anodyne	IMDH_CRYPV	37	52
Cc1cc(C(=O)N2CCC(c3ccsc3)CC2)ncc1C(N)=O	ZINC000450760885	EF	On-Demand	Anodyne	FASN	41	36
CCS(=O)(=O)c1ccc(CSCCN2CCOCC2)cc1	ZINC000450760891	EE	On-Demand	Anodyne	THRB	15	40
CC[C@](NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)(C(N)=O)C(C)C	ZINC000450760897	GD	On-Demand	Mild	AR	15	43
CC[C@@](NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)(C(N)=O)C(C)C	ZINC000450760899	GD	On-Demand	Mild	AR	15	43
CC[C@](NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)(C(N)=O)C(C)C	ZINC000450760900	GD	On-Demand	Mild	AR	15	43
CC[C@@](NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)(C(N)=O)C(C)C	ZINC000450760901	GD	On-Demand	Mild	AR	15	43
CO[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1(C)C	ZINC000450760909	EH	On-Demand	Bother	AR	18	50
CO[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1(C)C	ZINC000450760912	EH	On-Demand	Bother	AR	18	50
CCOC(=O)CN(Cc1cccc(C(C)=O)c1)C1CCC1	ZINC000450760925	CF	On-Demand	Anodyne	PRSS2	40	39
Cc1cccc(Cl)c1C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450760930	EI	On-Demand	Anodyne	CCR3	19	40
Cc1cccc(Cl)c1C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450760930	EI	On-Demand	Anodyne	CCR5	26	43
Cc1cccc(Cl)c1C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450760930	EI	On-Demand	Anodyne	REN	26	41
Cc1cccc(Cl)c1C(=O)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000450760930	EI	On-Demand	Anodyne	L3MBTL3	56	36
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450760931	EI	On-Demand	Anodyne	CCR3	19	40
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450760931	EI	On-Demand	Anodyne	CCR5	26	43
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450760931	EI	On-Demand	Anodyne	REN	26	41
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000450760931	EI	On-Demand	Anodyne	L3MBTL3	56	36
CCOC(=O)C[C@H]1C[C@H](OC)CN1CCc1ccc(Cl)cc1	ZINC000450760971	EF	On-Demand	Anodyne	SLC6A1	0	46
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@@H]1C	ZINC000450760972	DE	On-Demand	Anodyne	SLC6A9	29	47
CCOC(=O)C[C@@H]1C[C@H](OC)CN1CCc1ccc(Cl)cc1	ZINC000450760973	EF	On-Demand	Anodyne	SLC6A1	0	46
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@@H]1C	ZINC000450760974	DE	On-Demand	Anodyne	SLC6A9	29	47
CCOC(=O)C[C@H]1C[C@@H](OC)CN1CCc1ccc(Cl)cc1	ZINC000450760975	EF	On-Demand	Anodyne	SLC6A1	0	46
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@H]1C	ZINC000450760976	DE	On-Demand	Anodyne	SLC6A9	29	47
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1CCc1ccc(Cl)cc1	ZINC000450760977	EF	On-Demand	Anodyne	SLC6A1	0	46
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@H]1C	ZINC000450760978	DE	On-Demand	Anodyne	SLC6A9	29	47
CC(C)(CC(=O)CSc1nnc(N2CCCC2)n1Cc1ccco1)C1CC1	ZINC000450760979	GI	On-Demand	Anodyne	HCRTR2	21	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450760980	FG	On-Demand	Anodyne	SLC12A5	50	34
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450760981	FG	On-Demand	Anodyne	SLC12A5	50	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450760982	FG	On-Demand	Anodyne	SLC12A5	50	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450760986	FG	On-Demand	Anodyne	SLC12A5	50	34
CC(C)O[C@]1(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450760990	GF	On-Demand	Anodyne	MTNR1A	29	42
CC(C)O[C@]1(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450760990	GF	On-Demand	Anodyne	MTNR1B	0	42
O=C(Nc1cccc(CCCO)c1)c1ccnc(OC(F)F)c1	ZINC000450760992	DF	On-Demand	Anodyne	KCNK3	81	47
O=C(Nc1cccc(CCCO)c1)c1ccnc(OC(F)F)c1	ZINC000450760992	DF	On-Demand	Anodyne	KCNK9	57	34
CC(C)O[C@@]1(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450760993	GF	On-Demand	Anodyne	MTNR1A	29	42
CC(C)O[C@@]1(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450760993	GF	On-Demand	Anodyne	MTNR1B	0	42
CC(C)O[C@@]1(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450760996	GF	On-Demand	Anodyne	MTNR1A	29	42
CC(C)O[C@@]1(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450760996	GF	On-Demand	Anodyne	MTNR1B	0	42
CC(C)O[C@]1(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450760999	GF	On-Demand	Anodyne	MTNR1A	29	42
CC(C)O[C@]1(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)CCOC1	ZINC000450760999	GF	On-Demand	Anodyne	MTNR1B	0	42
C=CCN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450761012	BF	On-Demand	Mild	LSS	80	62
C=CCN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450761012	BF	On-Demand	Mild	ERG7	31	44
C=CCN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450761012	BF	On-Demand	Mild	CAS1	25	43
CO[C@H]1CCN(c2cc(N3CC[C@@H](OC)[C@H](C)C3)ncn2)C[C@H]1C	ZINC000450761024	EE	On-Demand	Anodyne	PDE3A	47	36
CO[C@H]1CCN(c2cc(N3CC[C@@H](OC)[C@H](C)C3)ncn2)C[C@@H]1C	ZINC000450761030	EE	On-Demand	Anodyne	PDE3A	47	36
CO[C@H]1CCN(c2cc(N3CC[C@@H](OC)[C@@H](C)C3)ncn2)C[C@H]1C	ZINC000450761034	EE	On-Demand	Anodyne	PDE3A	47	36
COc1cc(CC(=O)N2CCC(c3c(F)cccc3F)CC2)ccc1O	ZINC000450761035	FH	On-Demand	Anodyne	MLNR	31	46
CO[C@H]1CCN(c2cc(N3CC[C@@H](OC)[C@@H](C)C3)ncn2)C[C@@H]1C	ZINC000450761037	EE	On-Demand	Anodyne	PDE3A	47	36
O=C1NCCN(C(=O)[C@H]2CC23CCSCC3)[C@H]1c1ccccc1C(F)(F)F	ZINC000450761038	GG	On-Demand	Anodyne	RBP4	48	34
CC[C@@H](CN(CC)C(=O)c1cc(C)n(C(C)C)n1)c1ccccc1	ZINC000450761040	EI	On-Demand	Anodyne	NPY2R	46	37
O=C1NCCN(C(=O)[C@@H]2CC23CCSCC3)[C@H]1c1ccccc1C(F)(F)F	ZINC000450761042	GG	On-Demand	Anodyne	RBP4	48	34
O=C1NCCN(C(=O)[C@H]2CC23CCSCC3)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450761044	GG	On-Demand	Anodyne	RBP4	48	34
O=C1NCCN(C(=O)[C@@H]2CC23CCSCC3)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450761048	GG	On-Demand	Anodyne	RBP4	48	34
O=C1CC[C@@H](CCC(=O)N2CCC(c3ccsc3)CC2)N1	ZINC000450761051	DF	On-Demand	Anodyne	ETHR	47	35
O=C1CC[C@H](CCC(=O)N2CCC(c3ccsc3)CC2)N1	ZINC000450761052	DF	On-Demand	Anodyne	ETHR	47	35
CC[C@H](CN(CC)C(=O)c1cc(C)n(C(C)C)n1)c1ccccc1	ZINC000450761055	EI	On-Demand	Anodyne	NPY2R	46	37
CCC(CC)Oc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761070	GI	On-Demand	Anodyne	TACR2	0	41
CCC(CC)Oc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761070	GI	On-Demand	Anodyne	TACR3	51	41
CCC(CC)Oc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761070	GI	On-Demand	Anodyne	MTTP	42	34
CCC(CC)Oc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761070	GI	On-Demand	Anodyne	UTS2	65	38
CCC(CC)Oc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761070	GI	On-Demand	Anodyne	GPR88	0	42
CCC(CC)Oc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761071	GI	On-Demand	Anodyne	TACR2	0	41
CCC(CC)Oc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761071	GI	On-Demand	Anodyne	TACR3	51	41
CCC(CC)Oc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761071	GI	On-Demand	Anodyne	MTTP	42	34
CCC(CC)Oc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761071	GI	On-Demand	Anodyne	UTS2	65	38
CCC(CC)Oc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)cc1	ZINC000450761071	GI	On-Demand	Anodyne	GPR88	0	42
CCc1cc(N[C@H](C(C)C)[C@@H](CO)C(C)C)n2ncnc2n1	ZINC000450761087	DE	On-Demand	Anodyne	DHOD	0	48
Cc1[nH]c(C#N)cc1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450761097	FG	On-Demand	Mild	SFRP1	61	33
Cc1[nH]c(C#N)cc1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450761098	FG	On-Demand	Mild	SFRP1	61	33
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@H]1CC12CCSCC2	ZINC000450761099	GH	On-Demand	Anodyne	MTNR1B	20	40
CCc1cc(N[C@@H](C(C)C)[C@H](CO)C(C)C)n2ncnc2n1	ZINC000450761104	DE	On-Demand	Anodyne	DHOD	0	48
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1CC12CCSCC2	ZINC000450761106	GH	On-Demand	Anodyne	MTNR1B	20	40
CCc1cc(N[C@H](C(C)C)[C@H](CO)C(C)C)n2ncnc2n1	ZINC000450761107	DE	On-Demand	Anodyne	DHOD	0	48
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@H]1CC12CCSCC2	ZINC000450761108	GH	On-Demand	Anodyne	MTNR1B	20	40
CCc1cc(N[C@@H](C(C)C)[C@@H](CO)C(C)C)n2ncnc2n1	ZINC000450761110	DE	On-Demand	Anodyne	DHOD	0	48
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1CC12CCSCC2	ZINC000450761112	GH	On-Demand	Anodyne	MTNR1B	20	40
CCCc1cc(N[C@@H]2CC(=O)N(CC)C2)n2ncnc2n1	ZINC000450761116	CD	On-Demand	Anodyne	DHOD	0	43
CCOC(=O)c1csc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)n1	ZINC000450761117	DF	On-Demand	Anodyne	TRPC6	46	34
CCCc1cc(N[C@H]2CC(=O)N(CC)C2)n2ncnc2n1	ZINC000450761119	CD	On-Demand	Anodyne	DHOD	0	43
CCOC(=O)c1csc(N[C@H](C2CC2)[C@H](CO)C2CC2)n1	ZINC000450761120	DF	On-Demand	Anodyne	TRPC6	46	34
Cc1cccc(CNC(=O)c2ccc(C(=O)NCc3nnc(C4CC4)o3)cc2)c1	ZINC000450761122	GG	On-Demand	Anodyne	MMP13	18	47
CCOC(=O)c1csc(N[C@H](C2CC2)[C@@H](CO)C2CC2)n1	ZINC000450761123	DF	On-Demand	Anodyne	TRPC6	46	34
CCOC(=O)c1csc(N[C@@H](C2CC2)[C@H](CO)C2CC2)n1	ZINC000450761125	DF	On-Demand	Anodyne	TRPC6	46	34
CC(C)[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)[C@H](CO)C(C)C	ZINC000450761136	FF	On-Demand	Anodyne	GCK	41	30
CC(C)[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)[C@H](CO)C(C)C	ZINC000450761136	FF	On-Demand	Anodyne	GCKR	59	32
CC(C)[C@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(C)C	ZINC000450761137	FF	On-Demand	Anodyne	GCK	41	30
CC(C)[C@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(C)C	ZINC000450761137	FF	On-Demand	Anodyne	GCKR	59	32
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(C)C	ZINC000450761138	FF	On-Demand	Anodyne	GCK	41	30
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(C)C	ZINC000450761138	FF	On-Demand	Anodyne	GCKR	59	32
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(C)C	ZINC000450761140	FF	On-Demand	Anodyne	GCK	41	30
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(C)C	ZINC000450761140	FF	On-Demand	Anodyne	GCKR	59	32
CC(C)CN(C[C@H]1COCCO1)[C@@H]1CCCc2cccnc21	ZINC000450761156	DF	On-Demand	Anodyne	CXCR4	84	44
CC(C)CN(C[C@@H]1COCCO1)[C@@H]1CCCc2cccnc21	ZINC000450761159	DF	On-Demand	Anodyne	CXCR4	84	44
CC(C)CN(C[C@H]1COCCO1)[C@H]1CCCc2cccnc21	ZINC000450761163	DF	On-Demand	Anodyne	CXCR4	84	44
CC(C)CN(C[C@@H]1COCCO1)[C@H]1CCCc2cccnc21	ZINC000450761166	DF	On-Demand	Anodyne	CXCR4	84	44
COc1cc(CC(=O)NCc2cc(COC(C)(C)C)on2)ccc1Cl	ZINC000450761167	FH	On-Demand	Anodyne	TRPV1	31	46
COc1cc(CC(=O)NCc2cc(COC(C)(C)C)on2)ccc1Cl	ZINC000450761167	FH	On-Demand	Anodyne	P2RX7	21	43
COc1cc(CC(=O)NCc2cc(COC(C)(C)C)on2)ccc1Cl	ZINC000450761167	FH	On-Demand	Anodyne	NCE103	19	40
COc1cc(CC(=O)NCc2cc(COC(C)(C)C)on2)ccc1Cl	ZINC000450761167	FH	On-Demand	Anodyne	CAN2	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cc(COC(C)(C)C)on1	ZINC000450761169	FI	On-Demand	Anodyne	PPARA	25	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1cc(COC(C)(C)C)on1	ZINC000450761169	FI	On-Demand	Anodyne	PPARD	38	43
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)Nc2cccc(CCCO)c2)CC3)c1	ZINC000450761178	GG	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)Nc2cccc(CCCO)c2)CC3)c1	ZINC000450761178	GG	On-Demand	Anodyne	CCKBR	0	41
Cc1cccc(-c2nnc3n2C[C@H](C(=O)Nc2cccc(CCCO)c2)CC3)c1	ZINC000450761181	GG	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(-c2nnc3n2C[C@H](C(=O)Nc2cccc(CCCO)c2)CC3)c1	ZINC000450761181	GG	On-Demand	Anodyne	CCKBR	0	41
COC(=O)c1cccc(CN2CCO[C@H](COCC3CC3)C2)c1Cl	ZINC000450761182	FF	On-Demand	Anodyne	DRD4	15	41
COC(=O)c1cccc(CN2CCO[C@@H](COCC3CC3)C2)c1Cl	ZINC000450761184	FF	On-Demand	Anodyne	DRD4	15	41
O=C(Nc1cccc(CCCO)c1)c1ccc(N2CCC2)nc1	ZINC000450761191	DE	On-Demand	Anodyne	PRNP	45	38
O=C(Nc1cccc(CCCO)c1)c1ccc(N2CCC2)nc1	ZINC000450761191	DE	On-Demand	Anodyne	HT1	0	40
O=C(Nc1cccc(CCCO)c1)c1ccc(N2CCC2)nc1	ZINC000450761191	DE	On-Demand	Anodyne	DGAT1	38	42
O=C(Nc1cccc(CCCO)c1)c1ccc(N2CCC2)nc1	ZINC000450761191	DE	On-Demand	Anodyne	KCNK3	54	33
O=C(Nc1cccc(CCCO)c1)c1ccc(N2CCC2)nc1	ZINC000450761191	DE	On-Demand	Anodyne	LMGT2	0	40
CC(=O)c1ccc(CSc2nnc(N3CCCCC3)n2Cc2ccco2)cc1	ZINC000450761197	GI	On-Demand	Anodyne	HCRTR2	20	43
N#Cc1ccnc(N2CC[C@H](c3cccc(Br)c3)C2)c1	ZINC000450761214	EH	On-Demand	Mild	MAP3K12	48	34
N#Cc1ccnc(N2CC[C@@H](c3cccc(Br)c3)C2)c1	ZINC000450761216	EH	On-Demand	Mild	MAP3K12	48	34
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCC(c2c(F)cccc2F)CC1	ZINC000450761223	EH	On-Demand	Anodyne	PRCP	47	35
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	MME	70	39
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	ANPEP	50	37
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	PAPA1_CARPA	52	38
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	CPA1	44	36
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	SLC15A1	0	40
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	CAPN2	46	32
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	ACE2	48	36
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	AMP1_PLAFQ	55	36
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761233	CE	On-Demand	Anodyne	BLAIMP-1	0	40
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	MME	70	39
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	ANPEP	50	37
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	PAPA1_CARPA	52	38
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	CPA1	44	36
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	SLC15A1	0	40
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	CAPN2	46	32
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	ACE2	48	36
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	AMP1_PLAFQ	55	36
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450761236	CE	On-Demand	Anodyne	BLAIMP-1	0	40
COc1ccc(NC(=O)c2c(F)ccc(SCC3CC3)c2F)cc1[N+](=O)[O-]	ZINC000450761240	GJ	On-Demand	Bother	TAAR1	22	40
COc1ccc(NC(=O)c2c(F)ccc(SCC3CC3)c2F)cc1[N+](=O)[O-]	ZINC000450761240	GJ	On-Demand	Bother	ENPP1	53	30
Nc1ncccc1CN1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450761242	DG	On-Demand	Anodyne	SIGMAR1	28	43
CC1(C)[C@H]2CC[C@@]1(C(=O)N[C@@H]1CCN(c3ccccc3C(F)(F)F)C1)C(=O)C2	ZINC000450761244	GH	On-Demand	Anodyne	SFRP1	75	33
CC1(C)[C@H]2CC[C@@]1(C(=O)N[C@@H]1CCN(c3ccccc3C(F)(F)F)C1)C(=O)C2	ZINC000450761244	GH	On-Demand	Anodyne	WNT3	40	32
CC1(C)[C@H]2CC[C@@]1(C(=O)N[C@H]1CCN(c3ccccc3C(F)(F)F)C1)C(=O)C2	ZINC000450761245	GH	On-Demand	Anodyne	SFRP1	75	33
CC1(C)[C@H]2CC[C@@]1(C(=O)N[C@H]1CCN(c3ccccc3C(F)(F)F)C1)C(=O)C2	ZINC000450761245	GH	On-Demand	Anodyne	WNT3	40	32
Cc1ccc(F)c(CC(=O)N2CCC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450761247	EH	On-Demand	Anodyne	MCHR1	15	43
COc1cc(-c2noc(CN3CC[C@@]4(C3)OCc3ccccc34)n2)ncn1	ZINC000450761249	FE	On-Demand	Anodyne	SIGMAR1	15	48
COc1cc(-c2noc(CN3CC[C@]4(C3)OCc3ccccc34)n2)ncn1	ZINC000450761250	FE	On-Demand	Anodyne	SIGMAR1	15	48
Cc1ccc(F)c(CC(=O)N2CCC[C@]3(C2)OCc2ccccc23)c1	ZINC000450761253	EH	On-Demand	Anodyne	MCHR1	15	43
C(=C/c1ccccc1)\CCN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450761254	DI	On-Demand	Anodyne	SIGMAR1	39	56
C(=C/c1ccccc1)\CCN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450761254	DI	On-Demand	Anodyne	SLC18A3	22	43
C(=C\c1ccccc1)\CCN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450761257	DI	On-Demand	Anodyne	SIGMAR1	39	56
C(=C\c1ccccc1)\CCN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450761257	DI	On-Demand	Anodyne	SLC18A3	22	43
CS(=O)(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(F)c1	ZINC000450761258	GH	On-Demand	Bother	SLC6A9	24	49
C(=C\c1ccccc1)\CCN1CC[C@]2(C1)OCc1ccccc12	ZINC000450761259	DI	On-Demand	Anodyne	SIGMAR1	39	56
C(=C\c1ccccc1)\CCN1CC[C@]2(C1)OCc1ccccc12	ZINC000450761259	DI	On-Demand	Anodyne	SLC18A3	22	43
CS(=O)(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(F)c1	ZINC000450761260	GH	On-Demand	Bother	SLC6A9	24	49
C(=C/c1ccccc1)\CCN1CC[C@]2(C1)OCc1ccccc12	ZINC000450761261	DI	On-Demand	Anodyne	SIGMAR1	39	56
C(=C/c1ccccc1)\CCN1CC[C@]2(C1)OCc1ccccc12	ZINC000450761261	DI	On-Demand	Anodyne	SLC18A3	22	43
CC[C@@H](O)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000450761264	CD	On-Demand	Bother	SLC1A2	41	33
CC[C@@H](O)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000450761264	CD	On-Demand	Bother	TAAR1	18	42
CC[C@@H](O)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000450761264	CD	On-Demand	Bother	ENPP1	60	35
CC[C@H](CC(C)C)C(=O)NCCCCCS(C)(=O)=O	ZINC000450761270	CE	On-Demand	Anodyne	MME	23	50
CC(C)(CO)C(C)(C)NC(=O)c1ccc(I)cc1F	ZINC000450761284	GF	On-Demand	Anodyne	MAP2K1	51	38
CCC1(CC)CN(CCCC(=O)c2ccccc2)CC[S@]1=O	ZINC000450761290	DG	On-Demand	Anodyne	DRD2	29	41
CCC1(CC)CN(CCCC(=O)c2ccccc2)CC[S@@]1=O	ZINC000450761291	DG	On-Demand	Anodyne	DRD2	29	41
CCOC(=O)c1c(N2CC[C@H](c3nc(C)no3)C2)nc2ccccc2c1C	ZINC000450761303	FG	On-Demand	Anodyne	SMO	53	35
CCOC(=O)c1c(N2CC[C@@H](c3nc(C)no3)C2)nc2ccccc2c1C	ZINC000450761308	FG	On-Demand	Anodyne	SMO	53	35
CCCCn1cnc2c1c(=O)n(CCC1CCOCC1)c(=O)n2CCCC	ZINC000450761315	GF	On-Demand	Anodyne	CHIB1	0	40
c1ccc2c(c1)CO[C@@]21CCN(C[C@@H]2COCCO2)C1	ZINC000450761324	CD	On-Demand	Anodyne	SIGMAR1	24	50
c1ccc2c(c1)CO[C@@]21CCN(C[C@@H]2COCCO2)C1	ZINC000450761324	CD	On-Demand	Anodyne	SLC18A3	21	41
c1ccc2c(c1)CO[C@@]21CCN(C[C@H]2COCCO2)C1	ZINC000450761325	CD	On-Demand	Anodyne	SIGMAR1	24	50
c1ccc2c(c1)CO[C@@]21CCN(C[C@H]2COCCO2)C1	ZINC000450761325	CD	On-Demand	Anodyne	SLC18A3	21	41
c1ccc2c(c1)CO[C@]21CCN(C[C@H]2COCCO2)C1	ZINC000450761326	CD	On-Demand	Anodyne	SIGMAR1	24	50
c1ccc2c(c1)CO[C@]21CCN(C[C@H]2COCCO2)C1	ZINC000450761326	CD	On-Demand	Anodyne	SLC18A3	21	41
c1ccc2c(c1)CO[C@]21CCN(C[C@@H]2COCCO2)C1	ZINC000450761328	CD	On-Demand	Anodyne	SIGMAR1	24	50
c1ccc2c(c1)CO[C@]21CCN(C[C@@H]2COCCO2)C1	ZINC000450761328	CD	On-Demand	Anodyne	SLC18A3	21	41
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](OC)C(C)(C)C3)c2c1	ZINC000450761357	FH	On-Demand	Anodyne	PDE3A	41	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](OC)C(C)(C)C3)c2c1	ZINC000450761357	FH	On-Demand	Anodyne	PDE3B	59	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](OC)C(C)(C)C3)c2c1	ZINC000450761359	FH	On-Demand	Anodyne	PDE3A	41	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](OC)C(C)(C)C3)c2c1	ZINC000450761359	FH	On-Demand	Anodyne	PDE3B	59	38
CC(C)[C@@H](CN(C)Cc1ccccc1)NCCc1cscn1	ZINC000450761360	DG	On-Demand	Anodyne	BMP1	42	33
CC(C)[C@H](CN(C)Cc1ccccc1)NCCc1cscn1	ZINC000450761362	DG	On-Demand	Anodyne	BMP1	42	33
CSCc1nnc(SCCc2c(Cl)cccc2Cl)o1	ZINC000450761402	EJ	On-Demand	Anodyne	PTK2	0	40
C[C@@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761403	GF	On-Demand	Anodyne	MME	45	38
C[C@@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761403	GF	On-Demand	Anodyne	NPFFR2	50	35
C[C@@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761403	GF	On-Demand	Anodyne	C3AR1	50	34
C[C@@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761403	GF	On-Demand	Anodyne	MMP3	41	38
C[C@@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761403	GF	On-Demand	Anodyne	FURIN	54	35
C[C@@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761403	GF	On-Demand	Anodyne	POLG_WNV	47	32
C[C@@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761403	GF	On-Demand	Anodyne	QRFPR	44	32
C[C@@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761403	GF	On-Demand	Anodyne	NPFFR1	75	35
C[C@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761404	GF	On-Demand	Anodyne	MME	45	38
C[C@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761404	GF	On-Demand	Anodyne	NPFFR2	50	35
C[C@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761404	GF	On-Demand	Anodyne	C3AR1	50	34
C[C@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761404	GF	On-Demand	Anodyne	MMP3	41	38
C[C@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761404	GF	On-Demand	Anodyne	FURIN	54	35
C[C@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761404	GF	On-Demand	Anodyne	POLG_WNV	47	32
C[C@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761404	GF	On-Demand	Anodyne	QRFPR	44	32
C[C@H](CCCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450761404	GF	On-Demand	Anodyne	NPFFR1	75	35
CC(CO)(CO)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450761420	FC	On-Demand	Mild	AR	21	45
CC(CO)(CO)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450761421	FC	On-Demand	Mild	AR	21	45
CC[C@@](NC(=O)Cc1ccc(Cl)c(OC)c1)(C(N)=O)C(C)C	ZINC000450761423	EE	On-Demand	Anodyne	CAN2	0	42
CC[C@](NC(=O)Cc1ccc(Cl)c(OC)c1)(C(N)=O)C(C)C	ZINC000450761424	EE	On-Demand	Anodyne	CAN2	0	42
CCCc1cc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)no1	ZINC000450761440	GF	On-Demand	Anodyne	RBP4	62	35
CCCc1cc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)no1	ZINC000450761441	GF	On-Demand	Anodyne	RBP4	62	35
COC(=O)C1(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450761442	DF	On-Demand	Anodyne	SCN9A	0	40
COC(=O)C1(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450761443	DF	On-Demand	Anodyne	SCN9A	0	40
COC(=O)C1(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450761444	DF	On-Demand	Anodyne	SCN9A	0	40
COC(=O)C1(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450761445	DF	On-Demand	Anodyne	SCN9A	0	40
CC1(O)CC(C(=O)NCC2(c3ccc(F)cc3F)CCCC2)C1	ZINC000450761446	DG	On-Demand	Anodyne	ACAT	0	44
C[C@H](OCCc1ccccc1)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450761456	EI	On-Demand	Anodyne	CCR1	43	44
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450761457	EI	On-Demand	Anodyne	CCR1	43	44
CCCNc1ccccc1NC(=O)CCCC(=O)C1CC1	ZINC000450761458	CH	On-Demand	Anodyne	HDAC1	17	47
CCCNc1ccccc1NC(=O)CCCC(=O)C1CC1	ZINC000450761458	CH	On-Demand	Anodyne	HDAC3	22	47
COc1cc(CN2CCC(c3nnc4n3CCCC4)CC2)ccc1Cl	ZINC000450761468	FH	On-Demand	Anodyne	SSTR5	65	40
COCc1nn(C)cc1C(=O)Nc1cc(Cl)ccc1NCC1CCCCC1	ZINC000450761476	GI	On-Demand	Anodyne	CNR1	22	46
CCOC(=O)c1ccc(CN2Cc3ccccc3C3(CC3)C2)nc1	ZINC000450761482	DG	On-Demand	Anodyne	NOD2	25	41
CC[C@@](NC(=O)Cc1cc2ccccc2s1)(C(N)=O)C(C)C	ZINC000450761498	DF	On-Demand	Anodyne	LTB4R	0	42
CC[C@](NC(=O)Cc1cc2ccccc2s1)(C(N)=O)C(C)C	ZINC000450761499	DF	On-Demand	Anodyne	LTB4R	0	42
Cc1cnc(CCCC(=O)N2CCC(c3ccsc3)CC2)o1	ZINC000450761501	DH	On-Demand	Anodyne	ETHR	53	35
CC[C@H](O)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000450761522	CD	On-Demand	Bother	SLC1A2	41	33
CC[C@H](O)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000450761522	CD	On-Demand	Bother	TAAR1	18	42
CC[C@H](O)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000450761522	CD	On-Demand	Bother	ENPP1	60	35
CC(=O)c1cccc(CN2CCC(c3ccsc3)CC2)c1	ZINC000450761525	CI	On-Demand	Anodyne	DRD2	20	47
CC(=O)c1cccc(CN2CCC(c3ccsc3)CC2)c1	ZINC000450761525	CI	On-Demand	Anodyne	DRD4	37	44
CC(=O)c1cccc(CN2CCC(c3ccsc3)CC2)c1	ZINC000450761525	CI	On-Demand	Anodyne	ACHE	25	41
CC(=O)c1cccc(CN2CCC(c3ccsc3)CC2)c1	ZINC000450761525	CI	On-Demand	Anodyne	CHRM3	25	44
CC(=O)c1cccc(CN2CCC(c3ccsc3)CC2)c1	ZINC000450761525	CI	On-Demand	Anodyne	SIGMAR1	37	45
CC(=O)c1cccc(CN2CCC(c3ccsc3)CC2)c1	ZINC000450761525	CI	On-Demand	Anodyne	MCHR1	40	43
COc1ccc(NC(=O)C(C)(C)C(C)(F)F)cc1[N+](=O)[O-]	ZINC000450761534	DG	On-Demand	Bother	AADAC	0	43
COc1ccc(NC(=O)c2nn(C)c3c2CCCC3)cc1[N+](=O)[O-]	ZINC000450761541	EE	On-Demand	Bother	ENPP1	48	29
COc1ccc(NC(=O)c2cn(CC(C)C)nc2C(F)F)cc1[N+](=O)[O-]	ZINC000450761544	FH	On-Demand	Bother	ENPP1	48	29
COc1ccc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)cc1[N+](=O)[O-]	ZINC000450761550	DE	On-Demand	Bother	AADAC	0	42
COC(=O)c1ccc(CN2CCO[C@H](C3CC3)C2)cc1Cl	ZINC000450761551	DF	On-Demand	Anodyne	DRD4	30	42
COC(=O)c1ccc(CN2CCO[C@@H](C3CC3)C2)cc1Cl	ZINC000450761552	DF	On-Demand	Anodyne	DRD4	30	42
COCCOC[C@H](O)CN[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000450761557	DE	On-Demand	Anodyne	ADRB1	21	42
COCCOC[C@H](O)CN[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000450761558	DE	On-Demand	Anodyne	ADRB1	21	42
COCCOC[C@H](O)CN[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450761559	DE	On-Demand	Anodyne	ADRB1	21	42
COCCOC[C@H](O)CN[C@H]1CCCC[C@H]1c1ccccc1	ZINC000450761560	DE	On-Demand	Anodyne	ADRB1	21	42
COc1ccc(NC(=O)CCCc2ncc(C)o2)cc1[N+](=O)[O-]	ZINC000450761570	DF	On-Demand	Bother	ENPP1	57	34
CCN1C[C@H](Nc2ncc(C(=O)N3CCCCC3)cc2Cl)CC1=O	ZINC000450761575	FE	On-Demand	Anodyne	CXCR3	15	40
CCN1C[C@@H](Nc2ncc(C(=O)N3CCCCC3)cc2Cl)CC1=O	ZINC000450761576	FE	On-Demand	Anodyne	CXCR3	15	40
COC(=O)CN1CCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CC1	ZINC000450761577	FC	On-Demand	Anodyne	BDKRB1	22	42
COc1ccc(NC(=O)CC2(O)CCC2)cc1[N+](=O)[O-]	ZINC000450761588	CD	On-Demand	Bother	ENPP1	60	35
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450761593	FF	On-Demand	Anodyne	BMP1	59	36
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450761593	FF	On-Demand	Anodyne	SOAT1	26	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450761595	FF	On-Demand	Anodyne	BMP1	59	36
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450761595	FF	On-Demand	Anodyne	SOAT1	26	41
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450761597	FF	On-Demand	Anodyne	BMP1	59	36
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450761597	FF	On-Demand	Anodyne	SOAT1	26	41
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450761599	FF	On-Demand	Anodyne	BMP1	59	36
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450761599	FF	On-Demand	Anodyne	SOAT1	26	41
Cc1cc(C)c(C(=O)Nc2cccc(CCCO)c2)cc1Br	ZINC000450761600	FI	On-Demand	Anodyne	F2R	0	44
Cc1cc(C)c(C(=O)Nc2cccc(CCCO)c2)cc1Br	ZINC000450761600	FI	On-Demand	Anodyne	KCNK3	98	40
Cc1cc(C)c(C(=O)Nc2cccc(CCCO)c2)cc1Br	ZINC000450761600	FI	On-Demand	Anodyne	KCNK9	75	38
O=C(c1ccnn1CC(F)(F)F)N1CCC(c2c(F)cccc2F)CC1	ZINC000450761607	FH	On-Demand	Anodyne	ETHR	48	35
CCc1nc(C)c(NC(=O)COc2ccc(C#N)c(Br)c2)s1	ZINC000450761620	GH	On-Demand	Mild	MAPK9	15	40
CCN1C[C@H](Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)CC1=O	ZINC000450761621	GC	On-Demand	Bother	TBXA2R	15	40
CC[C@@H](CC(C)C)C(=O)NCCCCCS(C)(=O)=O	ZINC000450761627	CE	On-Demand	Anodyne	MME	23	50
CCN1C[C@@H](Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)CC1=O	ZINC000450761629	GC	On-Demand	Bother	TBXA2R	15	40
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)c1	ZINC000450761635	FG	On-Demand	Anodyne	SOAT1	25	45
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)c1	ZINC000450761635	FG	On-Demand	Anodyne	GPR88	0	47
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)c1	ZINC000450761637	FG	On-Demand	Anodyne	SOAT1	25	45
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)c1	ZINC000450761637	FG	On-Demand	Anodyne	GPR88	0	47
CC(F)(F)CCSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450761649	EI	On-Demand	Anodyne	ADRA2A	15	41
CC(F)(F)CCSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450761649	EI	On-Demand	Anodyne	ACACB	26	43
CC(F)(F)CCSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450761649	EI	On-Demand	Anodyne	TACR3	45	41
CC(F)(F)CCSc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450761649	EI	On-Demand	Anodyne	TNKS	71	38
COc1ccc(CNC(=O)CCN2CCC(c3ccsc3)CC2)c(OC)c1	ZINC000450761666	GH	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CCC(c3ccsc3)CC2)c(OC)c1	ZINC000450761666	GH	On-Demand	Anodyne	CARM1	46	33
COc1ccc(CNC(=O)CCN2CCC(c3ccsc3)CC2)c(OC)c1	ZINC000450761666	GH	On-Demand	Anodyne	NPBWR1	75	32
O=C(c1cnc(C2CC2)nc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450761683	EH	On-Demand	Anodyne	RBP4	21	40
O=C(c1cnc(C2CC2)nc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450761683	EH	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1cnc(C2CC2)nc1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450761683	EH	On-Demand	Anodyne	L3MBTL3	66	40
COCCC1(CNC(=O)c2cccc(C#N)c2Br)CCCCC1	ZINC000450761684	GI	On-Demand	Mild	HCN1	68	37
COCCC1(CNC(=O)c2cccc(C#N)c2Br)CCCCC1	ZINC000450761684	GI	On-Demand	Mild	HCN4	56	36
CCc1cccc(C(=O)NCC2(CCOC)CCCCC2)n1	ZINC000450761693	DG	On-Demand	Anodyne	HCN1	55	34
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450761703	GG	On-Demand	Anodyne	PDE3A	61	46
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450761703	GG	On-Demand	Anodyne	PDGFRB	30	41
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450761703	GG	On-Demand	Anodyne	PDE3B	90	46
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450761705	GG	On-Demand	Anodyne	PDE3A	61	46
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450761705	GG	On-Demand	Anodyne	PDGFRB	30	41
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@@H]1C	ZINC000450761705	GG	On-Demand	Anodyne	PDE3B	90	46
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450761707	GG	On-Demand	Anodyne	PDE3A	61	46
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450761707	GG	On-Demand	Anodyne	PDGFRB	30	41
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450761707	GG	On-Demand	Anodyne	PDE3B	90	46
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450761709	GG	On-Demand	Anodyne	PDE3A	61	46
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450761709	GG	On-Demand	Anodyne	PDGFRB	30	41
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)C[C@H]1C	ZINC000450761709	GG	On-Demand	Anodyne	PDE3B	90	46
Cc1cnc(CCCC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)o1	ZINC000450761721	GH	On-Demand	Anodyne	MTNR1A	29	43
Cc1cnc(CCCC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)o1	ZINC000450761721	GH	On-Demand	Anodyne	MTNR1B	0	43
Cc1cnc(CCCC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)o1	ZINC000450761721	GH	On-Demand	Anodyne	SFRP1	45	33
Cc1cnc(CCCC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)o1	ZINC000450761727	GH	On-Demand	Anodyne	MTNR1A	29	43
Cc1cnc(CCCC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)o1	ZINC000450761727	GH	On-Demand	Anodyne	MTNR1B	0	43
Cc1cnc(CCCC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)o1	ZINC000450761727	GH	On-Demand	Anodyne	SFRP1	45	33
CC(=O)[C@@](C)(O)CN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450761743	CF	On-Demand	Anodyne	SLC6A1	67	41
CC(=O)[C@@](C)(O)CN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450761743	CF	On-Demand	Anodyne	PRCP	24	44
CC(=O)[C@@](C)(O)CN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450761743	CF	On-Demand	Anodyne	CCR1	46	44
CC(=O)[C@](C)(O)CN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450761746	CF	On-Demand	Anodyne	SLC6A1	67	41
CC(=O)[C@](C)(O)CN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450761746	CF	On-Demand	Anodyne	PRCP	24	44
CC(=O)[C@](C)(O)CN1CCC(c2ccc(Cl)cc2)CC1	ZINC000450761746	CF	On-Demand	Anodyne	CCR1	46	44
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H](C)[C@H]2C)c(OC)c1	ZINC000450761754	EG	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H](C)[C@H]2C)c(OC)c1	ZINC000450761754	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H](C)[C@H]2C)c(OC)c1	ZINC000450761754	EG	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H](C)[C@H]2C)c(OC)c1	ZINC000450761756	EG	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H](C)[C@H]2C)c(OC)c1	ZINC000450761756	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H](C)[C@H]2C)c(OC)c1	ZINC000450761756	EG	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H](C)[C@@H]2C)c(OC)c1	ZINC000450761759	EG	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H](C)[C@@H]2C)c(OC)c1	ZINC000450761759	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H](C)[C@@H]2C)c(OC)c1	ZINC000450761759	EG	On-Demand	Anodyne	MTNR1A	54	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H](C)[C@@H]2C)c(OC)c1	ZINC000450761762	EG	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H](C)[C@@H]2C)c(OC)c1	ZINC000450761762	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H](C)[C@@H]2C)c(OC)c1	ZINC000450761762	EG	On-Demand	Anodyne	MTNR1A	54	37
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	DRD2	35	44
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	DRD4	26	48
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	HTR2A	33	52
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	HTR2C	27	58
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	DRD3	0	46
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	CCR3	55	38
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	SLC18A3	0	45
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	CYP2J2	58	41
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761772	DD	On-Demand	Anodyne	BIRC2	46	39
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	DRD2	35	44
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	DRD4	26	48
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	HTR2A	33	52
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	HTR2C	27	58
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	DRD3	0	46
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	CCR3	55	38
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	SLC18A3	0	45
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	CYP2J2	58	41
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450761774	DD	On-Demand	Anodyne	BIRC2	46	39
CNC(=O)C1CN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450761806	CC	On-Demand	Anodyne	BIRC8	52	32
CNC(=O)C1CN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450761807	CC	On-Demand	Anodyne	BIRC8	52	32
CNC(=O)C1CN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450761809	CC	On-Demand	Anodyne	BIRC8	52	32
CNC(=O)C1CN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450761811	CC	On-Demand	Anodyne	BIRC8	52	32
CC(CO)(CO)NC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450761828	EC	On-Demand	Mild	TRPV4	42	32
Cc1nnc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1	ZINC000450761833	CF	On-Demand	Bother	SLC27A4	44	34
Cc1ccc(F)c(CC(=O)NCc2cc(COC(C)(C)C)on2)c1	ZINC000450761834	EG	On-Demand	Anodyne	P2RX7	27	47
COc1cccc(CCC(=O)NCCN2c3ccccc3NS2(=O)=O)c1F	ZINC000450761835	GE	On-Demand	Anodyne	HTR7	18	40
Cc1nnc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1	ZINC000450761836	CF	On-Demand	Bother	SLC27A4	44	34
Nc1ncccc1CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450761838	EG	On-Demand	Anodyne	DRD1	0	42
Nc1ncccc1CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450761838	EG	On-Demand	Anodyne	DRD4	22	46
Nc1ncccc1CN1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450761838	EG	On-Demand	Anodyne	DRD3	0	44
Cc1cnc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450761842	CG	On-Demand	Bother	SLC27A4	48	32
Cc1cnc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450761843	CG	On-Demand	Bother	SLC27A4	48	32
CO[C@H]1CCN(c2ncc(-c3ccccc3)s2)CC1(C)C	ZINC000450761857	DI	On-Demand	Anodyne	LUCI_LUCLA	19	46
CO[C@@H]1CCN(c2ncc(-c3ccccc3)s2)CC1(C)C	ZINC000450761875	DI	On-Demand	Anodyne	LUCI_LUCLA	19	46
COc1cccc2c(N3CC[C@@H](OC)[C@@H](C)C3)c(C)cnc12	ZINC000450761877	DG	On-Demand	Anodyne	PDE3A	26	40
COc1cccc2c(N3CC[C@H](OC)[C@H](C)C3)c(C)cnc12	ZINC000450761879	DG	On-Demand	Anodyne	PDE3A	26	40
COc1cccc2c(N3CC[C@@H](OC)[C@H](C)C3)c(C)cnc12	ZINC000450761880	DG	On-Demand	Anodyne	PDE3A	26	40
COc1cccc2c(N3CC[C@H](OC)[C@@H](C)C3)c(C)cnc12	ZINC000450761881	DG	On-Demand	Anodyne	PDE3A	26	40
O=C(NCCN1c2ccccc2NS1(=O)=O)c1ccnc(C2CC2)c1	ZINC000450761904	FD	On-Demand	Anodyne	PLD2	42	34
Fc1ccc(C=C2CCN(CCc3cscn3)CC2)cc1F	ZINC000450761905	DI	On-Demand	Anodyne	ABCC1	48	32
CCS(=O)(=O)c1ccc(COc2ccccc2C(F)(F)F)cc1	ZINC000450761906	EI	On-Demand	Anodyne	ADAMTS4	18	40
CCS(=O)(=O)c1ccc(COc2ccccc2C(F)(F)F)cc1	ZINC000450761906	EI	On-Demand	Anodyne	RORC	40	40
O=C(NCCN1c2ccccc2NS1(=O)=O)c1cc(C2CC2)[nH]n1	ZINC000450761916	ED	On-Demand	Anodyne	CDK2	0	41
COc1cc(CNC(C)(C)c2nc3ccccc3n2C)ccc1Cl	ZINC000450761927	EI	On-Demand	Anodyne	ALDH3A1	17	44
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)CC1(C)C	ZINC000450761950	FH	On-Demand	Anodyne	PDE3A	55	41
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)CC1(C)C	ZINC000450761950	FH	On-Demand	Anodyne	PDGFRB	30	42
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)CC1(C)C	ZINC000450761950	FH	On-Demand	Anodyne	PDE3B	81	41
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)CC1(C)C	ZINC000450761951	FH	On-Demand	Anodyne	PDE3A	55	41
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)CC1(C)C	ZINC000450761951	FH	On-Demand	Anodyne	PDGFRB	30	42
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)CC1(C)C	ZINC000450761951	FH	On-Demand	Anodyne	PDE3B	81	41
Cc1noc([C@H]2CCN(c3nc4ccccc4[nH]3)C2)n1	ZINC000450761958	CE	On-Demand	Anodyne	KCNN3	23	40
Cc1noc([C@H]2CCN(c3nc4ccccc4[nH]3)C2)n1	ZINC000450761958	CE	On-Demand	Anodyne	NPY5R	22	45
Cc1noc([C@@H]2CCN(c3nc4ccccc4[nH]3)C2)n1	ZINC000450761961	CE	On-Demand	Anodyne	KCNN3	23	40
Cc1noc([C@@H]2CCN(c3nc4ccccc4[nH]3)C2)n1	ZINC000450761961	CE	On-Demand	Anodyne	NPY5R	22	45
CCCCn1c(=O)n(CC[C@@H](C)O)c(=O)c2c1nc(CO)n2CCC	ZINC000450761982	FC	On-Demand	Anodyne	ADORA2A	0	48
CCCCn1c(=O)n(CC[C@H](C)O)c(=O)c2c1nc(CO)n2CCC	ZINC000450761985	FC	On-Demand	Anodyne	ADORA2A	0	48
CC(C)(CO)C(C)(C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450761990	EH	On-Demand	Anodyne	RBP4	86	41
O=C(CCCN1CCn2ncnc2C1)c1ccc(F)cc1	ZINC000450761991	CD	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCn2ncnc2C1)c1ccc(F)cc1	ZINC000450761991	CD	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1CCn2ncnc2C1)c1ccc(F)cc1	ZINC000450761991	CD	On-Demand	Anodyne	AP2S1	0	46
Brc1cccc([C@@H]2CCN(c3ncnc4n[nH]cc34)C2)c1	ZINC000450762002	EG	On-Demand	Anodyne	PDE3A	42	32
Brc1cccc([C@H]2CCN(c3ncnc4n[nH]cc34)C2)c1	ZINC000450762003	EG	On-Demand	Anodyne	PDE3A	42	32
CCCCn1cnc2c1c(=O)n(CCC(C)(F)F)c(=O)n2CCCC	ZINC000450762008	FG	On-Demand	Anodyne	CHIB1	0	44
COc1cc2nc(N3CC[C@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762016	FD	On-Demand	Anodyne	ADRA1D	15	51
COc1cc2nc(N3CC[C@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762016	FD	On-Demand	Anodyne	ADRA1B	41	51
COc1cc2nc(N3CC[C@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762016	FD	On-Demand	Anodyne	PDE3A	47	38
COc1cc2nc(N3CC[C@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762016	FD	On-Demand	Anodyne	CCR4	40	38
COc1cc2nc(N3CC[C@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762016	FD	On-Demand	Anodyne	PDE3B	69	38
COc1cc2nc(N3CC[C@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762016	FD	On-Demand	Anodyne	EHMT2	67	42
COc1cc2nc(N3CC[C@@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762017	FD	On-Demand	Anodyne	ADRA1D	15	51
COc1cc2nc(N3CC[C@@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762017	FD	On-Demand	Anodyne	ADRA1B	41	51
COc1cc2nc(N3CC[C@@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762017	FD	On-Demand	Anodyne	PDE3A	47	38
COc1cc2nc(N3CC[C@@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762017	FD	On-Demand	Anodyne	CCR4	40	38
COc1cc2nc(N3CC[C@@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762017	FD	On-Demand	Anodyne	PDE3B	69	38
COc1cc2nc(N3CC[C@@H](c4nc(C)no4)C3)nc(N)c2cc1OC	ZINC000450762017	FD	On-Demand	Anodyne	EHMT2	67	42
COCC1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450762031	CG	On-Demand	Anodyne	AP2S1	0	46
COC(=O)C1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CC1	ZINC000450762053	FD	On-Demand	Anodyne	PDE8B	54	35
COC(=O)C1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CC1	ZINC000450762054	FD	On-Demand	Anodyne	PDE8B	54	35
c1ccc2c(c1)CO[C@@]21CCCN(C[C@H]2COCCO2)C1	ZINC000450762083	CD	On-Demand	Anodyne	SIGMAR1	20	42
c1ccc2c(c1)CO[C@@]21CCCN(C[C@@H]2COCCO2)C1	ZINC000450762084	CD	On-Demand	Anodyne	SIGMAR1	20	42
c1ccc2c(c1)CO[C@]21CCCN(C[C@H]2COCCO2)C1	ZINC000450762085	CD	On-Demand	Anodyne	SIGMAR1	20	42
c1ccc2c(c1)CO[C@]21CCCN(C[C@@H]2COCCO2)C1	ZINC000450762086	CD	On-Demand	Anodyne	SIGMAR1	20	42
CC(=O)[C@@](C)(O)CN1CCC[C@]2(C1)OCc1ccccc12	ZINC000450762087	CD	On-Demand	Anodyne	SIGMAR1	20	45
CC(=O)[C@](C)(O)CN1CCC[C@]2(C1)OCc1ccccc12	ZINC000450762088	CD	On-Demand	Anodyne	SIGMAR1	20	45
CC(=O)[C@@](C)(O)CN1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450762089	CD	On-Demand	Anodyne	SIGMAR1	20	45
CC(=O)[C@](C)(O)CN1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450762090	CD	On-Demand	Anodyne	SIGMAR1	20	45
C[C@H](O)CCN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450762149	CD	On-Demand	Anodyne	ETHR	39	43
C[C@@H](O)CCN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450762151	CD	On-Demand	Anodyne	ETHR	39	43
CC(=O)N1CCN(C(=O)C2CCN(c3nccc(C(C)(C)C)n3)CC2)CC1	ZINC000450762157	FD	On-Demand	Anodyne	SLC6A7	0	41
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1cn(Cc2ccccc2)nn1	ZINC000450762199	GF	On-Demand	Anodyne	PDEC	0	41
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1cn(Cc2ccccc2)nn1	ZINC000450762201	GF	On-Demand	Anodyne	PDEC	0	41
CC(C)(O)CCNC(=O)c1ccc2cnccc2c1	ZINC000450762205	CE	On-Demand	Anodyne	DRD4	40	30
CC(C)(O)CCNC(=O)c1ccc2cnccc2c1	ZINC000450762205	CE	On-Demand	Anodyne	KCNQ1	0	40
CC(C)(O)CCNC(=O)c1ccc2cnccc2c1	ZINC000450762205	CE	On-Demand	Anodyne	AKT1	22	46
CC(C)(O)CCNC(=O)c1ccc2cnccc2c1	ZINC000450762205	CE	On-Demand	Anodyne	CYP17A1	0	44
CO[C@H]1CCN(c2nc3ccccc3nc2C)C[C@H]1C	ZINC000450762207	CF	On-Demand	Anodyne	PDE3B	56	37
CO[C@@H]1CCN(c2nc3ccccc3nc2C)C[C@H]1C	ZINC000450762209	CF	On-Demand	Anodyne	PDE3B	56	37
CO[C@H]1CCN(c2nc3ccccc3nc2C)C[C@@H]1C	ZINC000450762211	CF	On-Demand	Anodyne	PDE3B	56	37
CO[C@@H]1CCN(c2nc3ccccc3nc2C)C[C@@H]1C	ZINC000450762213	CF	On-Demand	Anodyne	PDE3B	56	37
CCN(CC)C(=O)CCC1CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450762215	GJ	On-Demand	Anodyne	CHRM4	15	42
CCN(CC)C(=O)CCC1CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450762215	GJ	On-Demand	Anodyne	CHRM5	30	42
CCCOc1ccc(C(=O)N2CCN(CC(=O)OC)CC2)c(OC)c1	ZINC000450762272	FD	On-Demand	Anodyne	OXTR	24	43
O=C(Nc1cccc2c1CN(CC(F)(F)F)C2)c1cc2c([nH]1)CCCC2	ZINC000450762277	FI	On-Demand	Anodyne	CCKAR	24	52
COC(=O)CN1CCN(C(=O)c2ccc(C)c(Cl)c2Cl)CC1	ZINC000450762287	EE	On-Demand	Anodyne	P2RX7	36	44
Cc1ccn2ncc(C(=O)Nc3cccc4c3CN(CC(F)(F)F)C4)c2c1	ZINC000450762303	FH	On-Demand	Anodyne	EPHB3	43	58
Cc1ccn2ncc(C(=O)Nc3cccc4c3CN(CC(F)(F)F)C4)c2c1	ZINC000450762303	FH	On-Demand	Anodyne	PIM3	49	34
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2	ZINC000450762304	GI	On-Demand	Anodyne	P2RY1	21	41
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2	ZINC000450762305	GI	On-Demand	Anodyne	P2RY1	21	41
CNC(=O)N[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450762333	FC	On-Demand	Anodyne	MTNR1A	37	42
CNC(=O)N[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450762334	FC	On-Demand	Anodyne	MTNR1A	37	42
CCS(=O)(=O)c1ccc(CN[C@@H](C(=O)OC)c2ccc(F)c(C)c2)cc1	ZINC000450762339	GF	On-Demand	Anodyne	LEF	77	42
CCS(=O)(=O)c1ccc(CN[C@H](C(=O)OC)c2ccc(F)c(C)c2)cc1	ZINC000450762340	GF	On-Demand	Anodyne	LEF	77	42
O=C1CC[C@H](CN2CCC(Cc3ccc(F)c(F)c3)CC2)CCN1	ZINC000450762347	EG	On-Demand	Anodyne	SIGMAR1	18	44
O=C1CC[C@@H](CN2CCC(Cc3ccc(F)c(F)c3)CC2)CCN1	ZINC000450762349	EG	On-Demand	Anodyne	SIGMAR1	18	44
C[C@@H]1C[C@]1(C#N)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450762350	EF	On-Demand	Mild	RBP4	46	32
C[C@@H]1C[C@]1(C#N)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450762350	EF	On-Demand	Mild	SFRP1	76	34
C[C@@H]1C[C@@]1(C#N)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450762352	EF	On-Demand	Mild	RBP4	46	32
C[C@@H]1C[C@@]1(C#N)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450762352	EF	On-Demand	Mild	SFRP1	76	34
C[C@@H]1C[C@@]1(C#N)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450762353	EF	On-Demand	Mild	RBP4	46	32
C[C@@H]1C[C@@]1(C#N)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450762353	EF	On-Demand	Mild	SFRP1	76	34
C[C@@H]1C[C@]1(C#N)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450762355	EF	On-Demand	Mild	RBP4	46	32
C[C@@H]1C[C@]1(C#N)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450762355	EF	On-Demand	Mild	SFRP1	76	34
CC(C)(C)OCc1cc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)no1	ZINC000450762360	FG	On-Demand	Anodyne	PDE8B	57	33
Clc1ccc(CCN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450762362	DI	On-Demand	Anodyne	SIGMAR1	64	70
Clc1ccc(CCN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450762362	DI	On-Demand	Anodyne	SLC18A3	31	50
Clc1ccc(CCN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000450762362	DI	On-Demand	Anodyne	MCHR1	18	41
CC(C)(C)OCc1cc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)no1	ZINC000450762363	FG	On-Demand	Anodyne	PDE8B	57	33
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450762372	FI	On-Demand	Anodyne	SLC9A1	39	40
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450762372	FI	On-Demand	Anodyne	RBP4	44	41
O=C(c1cccc(C(F)(F)F)n1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450762372	FI	On-Demand	Anodyne	SFRP1	40	34
Clc1ccc(CCN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450762375	DI	On-Demand	Anodyne	SIGMAR1	64	70
Clc1ccc(CCN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450762375	DI	On-Demand	Anodyne	SLC18A3	31	50
Clc1ccc(CCN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000450762375	DI	On-Demand	Anodyne	MCHR1	18	41
CCSc1cccnc1C(=O)NCC1(CCOC)CCCCC1	ZINC000450762386	EH	On-Demand	Anodyne	SLC6A9	28	41
CCSc1cccnc1C(=O)NCC1(CCOC)CCCCC1	ZINC000450762386	EH	On-Demand	Anodyne	HCN1	54	34
CCSc1cccnc1C(=O)NCC1(CCOC)CCCCC1	ZINC000450762386	EH	On-Demand	Anodyne	HCN4	52	34
C[C@H]1C[C@H](C(=O)NCCCCCS(C)(=O)=O)CC[C@H]1C	ZINC000450762404	DE	On-Demand	Anodyne	GNAI1	0	40
C[C@H]1C[C@H](C(=O)NCCCCCS(C)(=O)=O)CC[C@H]1C	ZINC000450762404	DE	On-Demand	Anodyne	GNAI3	0	40
C[C@H]1C[C@H](C(=O)NCCCCCS(C)(=O)=O)CC[C@H]1C	ZINC000450762404	DE	On-Demand	Anodyne	GNAO1	0	40
C[C@@H]1CC[C@H](C(=O)NCCCCCS(C)(=O)=O)C[C@H]1C	ZINC000450762409	DE	On-Demand	Anodyne	GNAI1	0	40
C[C@@H]1CC[C@H](C(=O)NCCCCCS(C)(=O)=O)C[C@H]1C	ZINC000450762409	DE	On-Demand	Anodyne	GNAI3	0	40
C[C@@H]1CC[C@H](C(=O)NCCCCCS(C)(=O)=O)C[C@H]1C	ZINC000450762409	DE	On-Demand	Anodyne	GNAO1	0	40
C[C@@H]1CC[C@@H](C(=O)NCCCCCS(C)(=O)=O)C[C@H]1C	ZINC000450762411	DE	On-Demand	Anodyne	GNAI1	0	40
C[C@@H]1CC[C@@H](C(=O)NCCCCCS(C)(=O)=O)C[C@H]1C	ZINC000450762411	DE	On-Demand	Anodyne	GNAI3	0	40
C[C@@H]1CC[C@@H](C(=O)NCCCCCS(C)(=O)=O)C[C@H]1C	ZINC000450762411	DE	On-Demand	Anodyne	GNAO1	0	40
C[C@H]1C[C@@H](C(=O)NCCCCCS(C)(=O)=O)CC[C@H]1C	ZINC000450762413	DE	On-Demand	Anodyne	GNAI1	0	40
C[C@H]1C[C@@H](C(=O)NCCCCCS(C)(=O)=O)CC[C@H]1C	ZINC000450762413	DE	On-Demand	Anodyne	GNAI3	0	40
C[C@H]1C[C@@H](C(=O)NCCCCCS(C)(=O)=O)CC[C@H]1C	ZINC000450762413	DE	On-Demand	Anodyne	GNAO1	0	40
CO[C@H]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1(C)C	ZINC000450762423	DG	On-Demand	Bother	MGLL	0	40
CO[C@H]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1(C)C	ZINC000450762423	DG	On-Demand	Bother	ABHD6	0	40
CO[C@@H]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1(C)C	ZINC000450762426	DG	On-Demand	Bother	MGLL	0	40
CO[C@@H]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1(C)C	ZINC000450762426	DG	On-Demand	Bother	ABHD6	0	40
CO[C@@H]1CCN(c2c(C#N)cnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450762464	DH	On-Demand	Mild	SRC	59	41
CO[C@H]1CCN(c2ncnc3ccc(SC)cc23)CC1(C)C	ZINC000450762465	DH	On-Demand	Anodyne	PDE3A	54	41
CO[C@H]1CCN(c2ncnc3ccc(SC)cc23)CC1(C)C	ZINC000450762465	DH	On-Demand	Anodyne	PDGFRB	30	42
CO[C@H]1CCN(c2ncnc3ccc(SC)cc23)CC1(C)C	ZINC000450762465	DH	On-Demand	Anodyne	PDE3B	80	41
CO[C@H]1CCN(c2c(C#N)cnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450762466	DH	On-Demand	Mild	SRC	57	41
CO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)CC1(C)C	ZINC000450762467	DH	On-Demand	Anodyne	PDE3A	54	41
CO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)CC1(C)C	ZINC000450762467	DH	On-Demand	Anodyne	PDGFRB	30	42
CO[C@@H]1CCN(c2ncnc3ccc(SC)cc23)CC1(C)C	ZINC000450762467	DH	On-Demand	Anodyne	PDE3B	80	41
CO[C@@H]1CCN(c2c(C#N)cnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450762468	DH	On-Demand	Mild	SRC	57	41
Cc1ccc(C(=O)NCCN2CCNC(=O)C2)c(C(C)C)n1	ZINC000450762469	DC	On-Demand	Anodyne	PLD2	46	34
CC(C)CN(CC1CCC(=O)CC1)[C@H]1CCCc2cccnc21	ZINC000450762472	DI	On-Demand	Anodyne	CXCR4	88	49
CC(C)CN(CC1CCC(=O)CC1)[C@@H]1CCCc2cccnc21	ZINC000450762473	DI	On-Demand	Anodyne	CXCR4	88	49
CO[C@H]1CCN(c2c(C#N)cnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450762479	DH	On-Demand	Mild	SRC	57	41
COCCC1(CNC(=O)c2cc(C)n(C(C)C)n2)CCCCC1	ZINC000450762482	DG	On-Demand	Anodyne	HCN1	49	34
O=C(c1ccnc(OC(F)F)c1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450762489	FH	On-Demand	Anodyne	PDE4D	21	40
COc1cc2c(N3CC[C@@H](OC)[C@H](C)C3)ccnc2cc1F	ZINC000450762490	DG	On-Demand	Anodyne	PDE3A	51	39
COc1cc2c(N3CC[C@@H](OC)[C@H](C)C3)ccnc2cc1F	ZINC000450762490	DG	On-Demand	Anodyne	PDE3B	75	40
COc1cc2c(N3CC[C@H](OC)[C@H](C)C3)ccnc2cc1F	ZINC000450762493	DG	On-Demand	Anodyne	PDE3A	51	39
COc1cc2c(N3CC[C@H](OC)[C@H](C)C3)ccnc2cc1F	ZINC000450762493	DG	On-Demand	Anodyne	PDE3B	75	40
COc1cc2c(N3CC[C@@H](OC)[C@@H](C)C3)ccnc2cc1F	ZINC000450762494	DG	On-Demand	Anodyne	PDE3A	51	39
COc1cc2c(N3CC[C@@H](OC)[C@@H](C)C3)ccnc2cc1F	ZINC000450762494	DG	On-Demand	Anodyne	PDE3B	75	40
COc1cc2c(N3CC[C@H](OC)[C@@H](C)C3)ccnc2cc1F	ZINC000450762495	DG	On-Demand	Anodyne	PDE3A	51	39
COc1cc2c(N3CC[C@H](OC)[C@@H](C)C3)ccnc2cc1F	ZINC000450762495	DG	On-Demand	Anodyne	PDE3B	75	40
C[C@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CCC1=O	ZINC000450762500	FE	On-Demand	Mild	HTR1B	15	40
C[C@@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CCC1=O	ZINC000450762502	FE	On-Demand	Mild	HTR1B	15	40
CC(C)c1ncsc1C(=O)Nc1cccc(CCCO)c1	ZINC000450762532	DG	On-Demand	Anodyne	HTR1D	16	43
CC(C)c1ncsc1C(=O)Nc1cccc(CCCO)c1	ZINC000450762532	DG	On-Demand	Anodyne	HTR1B	17	43
CC(C)c1ncsc1C(=O)Nc1cccc(CCCO)c1	ZINC000450762532	DG	On-Demand	Anodyne	KCNK3	51	33
CC(C)c1ncsc1C(=O)Nc1cccc(CCCO)c1	ZINC000450762532	DG	On-Demand	Anodyne	KCNK9	52	34
N#C[C@H](CCc1ccccc1)C(=O)NCCN1CCNC(=O)C1	ZINC000450762542	DC	On-Demand	Mild	SDH1	0	40
N#C[C@@H](CCc1ccccc1)C(=O)NCCN1CCNC(=O)C1	ZINC000450762548	DC	On-Demand	Mild	SDH1	0	40
COCC[C@@H]1CCCCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450762563	DG	On-Demand	Anodyne	SLC6A3	21	48
COCC[C@@H]1CCCCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450762566	DG	On-Demand	Anodyne	SLC6A3	21	48
COCC[C@@H]1CCCCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450762569	DG	On-Demand	Anodyne	SLC6A3	21	48
COc1cc2c(N[C@H](C3CC3)[C@H](CO)C3CC3)ncnc2cc1F	ZINC000450762571	EF	On-Demand	Anodyne	FGFR1	22	42
COc1cc2c(N[C@H](C3CC3)[C@H](CO)C3CC3)ncnc2cc1F	ZINC000450762571	EF	On-Demand	Anodyne	FLT1	26	41
COc1cc2c(N[C@H](C3CC3)[C@H](CO)C3CC3)ncnc2cc1F	ZINC000450762571	EF	On-Demand	Anodyne	FBP1	0	41
COc1cc2c(N[C@H](C3CC3)[C@H](CO)C3CC3)ncnc2cc1F	ZINC000450762571	EF	On-Demand	Anodyne	EPHA2	47	37
COCC[C@@H]1CCCCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450762572	DG	On-Demand	Anodyne	SLC6A3	21	48
c1ccc(OC2CC2)c(CN2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450762573	DH	On-Demand	Anodyne	SIGMAR1	35	50
c1ccc(OC2CC2)c(CN2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450762573	DH	On-Demand	Anodyne	SLC18A3	22	44
c1ccc(OC2CC2)c(CN2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450762574	DH	On-Demand	Anodyne	SIGMAR1	35	50
c1ccc(OC2CC2)c(CN2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450762574	DH	On-Demand	Anodyne	SLC18A3	22	44
COc1cc2c(N[C@@H](C3CC3)[C@H](CO)C3CC3)ncnc2cc1F	ZINC000450762576	EF	On-Demand	Anodyne	FGFR1	22	42
COc1cc2c(N[C@@H](C3CC3)[C@H](CO)C3CC3)ncnc2cc1F	ZINC000450762576	EF	On-Demand	Anodyne	FLT1	26	41
COc1cc2c(N[C@@H](C3CC3)[C@H](CO)C3CC3)ncnc2cc1F	ZINC000450762576	EF	On-Demand	Anodyne	FBP1	0	41
COc1cc2c(N[C@@H](C3CC3)[C@H](CO)C3CC3)ncnc2cc1F	ZINC000450762576	EF	On-Demand	Anodyne	EPHA2	47	37
COc1cc2c(N[C@@H](C3CC3)[C@@H](CO)C3CC3)ncnc2cc1F	ZINC000450762577	EF	On-Demand	Anodyne	FGFR1	22	42
COc1cc2c(N[C@@H](C3CC3)[C@@H](CO)C3CC3)ncnc2cc1F	ZINC000450762577	EF	On-Demand	Anodyne	FLT1	26	41
COc1cc2c(N[C@@H](C3CC3)[C@@H](CO)C3CC3)ncnc2cc1F	ZINC000450762577	EF	On-Demand	Anodyne	FBP1	0	41
COc1cc2c(N[C@@H](C3CC3)[C@@H](CO)C3CC3)ncnc2cc1F	ZINC000450762577	EF	On-Demand	Anodyne	EPHA2	47	37
COc1cc2c(N[C@H](C3CC3)[C@@H](CO)C3CC3)ncnc2cc1F	ZINC000450762578	EF	On-Demand	Anodyne	FGFR1	22	42
COc1cc2c(N[C@H](C3CC3)[C@@H](CO)C3CC3)ncnc2cc1F	ZINC000450762578	EF	On-Demand	Anodyne	FLT1	26	41
COc1cc2c(N[C@H](C3CC3)[C@@H](CO)C3CC3)ncnc2cc1F	ZINC000450762578	EF	On-Demand	Anodyne	FBP1	0	41
COc1cc2c(N[C@H](C3CC3)[C@@H](CO)C3CC3)ncnc2cc1F	ZINC000450762578	EF	On-Demand	Anodyne	EPHA2	47	37
CCc1c(C(=O)Nc2cccc(CCCO)c2)oc2ccccc12	ZINC000450762580	DI	On-Demand	Anodyne	KCNK3	50	34
COc1ccc2c(N3CC[C@@H](c4nc(C)no4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450762583	FF	On-Demand	Bother	PDE3B	40	34
COc1ccc2c(N3CC[C@H](c4nc(C)no4)C3)c([N+](=O)[O-])cnc2c1	ZINC000450762584	FF	On-Demand	Bother	PDE3B	40	34
CCCCn1c(=O)n(CCC[C@@H](C)O)c(=O)c2c1nc(CO)n2CCC	ZINC000450762595	FD	On-Demand	Anodyne	ADORA2A	0	47
CCCCn1c(=O)n(CCC[C@H](C)O)c(=O)c2c1nc(CO)n2CCC	ZINC000450762598	FD	On-Demand	Anodyne	ADORA2A	0	47
COCCO[C@@H]1COCC[C@@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450762621	FE	On-Demand	Anodyne	ADAM17	31	42
COCCO[C@@H]1COCC[C@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450762623	FE	On-Demand	Anodyne	ADAM17	31	42
COCCO[C@H]1COCC[C@@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450762625	FE	On-Demand	Anodyne	ADAM17	31	42
COCCO[C@H]1COCC[C@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450762628	FE	On-Demand	Anodyne	ADAM17	31	42
COC(=O)c1ccc([C@H](NC[C@H](O)[C@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450762629	GH	On-Demand	Anodyne	ADRB3	15	40
COC(=O)c1ccc([C@H](NC[C@H](O)[C@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450762629	GH	On-Demand	Anodyne	CTSK	22	40
COC(=O)c1ccc([C@H](NC[C@H](O)[C@@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450762630	GH	On-Demand	Anodyne	ADRB3	15	40
COC(=O)c1ccc([C@H](NC[C@H](O)[C@@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450762630	GH	On-Demand	Anodyne	CTSK	22	40
COC(=O)c1ccc([C@H](NC[C@@H](O)[C@@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450762631	GH	On-Demand	Anodyne	ADRB3	15	40
COC(=O)c1ccc([C@H](NC[C@@H](O)[C@@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450762631	GH	On-Demand	Anodyne	CTSK	22	40
COC(=O)c1ccc([C@H](NC[C@@H](O)[C@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450762632	GH	On-Demand	Anodyne	ADRB3	15	40
COC(=O)c1ccc([C@H](NC[C@@H](O)[C@H](C)c2ccccc2)C(F)(F)F)cc1	ZINC000450762632	GH	On-Demand	Anodyne	CTSK	22	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCO[C@H](C2CC2)C1	ZINC000450762658	DG	On-Demand	Anodyne	LIPG	50	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCO[C@@H](C2CC2)C1	ZINC000450762659	DG	On-Demand	Anodyne	LIPG	50	33
Cc1ccc(C(=O)N2CCO[C@H](C3CC3)C2)c2c1CCC2	ZINC000450762663	CF	On-Demand	Anodyne	L3MBTL3	44	36
Cc1ccc(C(=O)N2CCO[C@@H](C3CC3)C2)c2c1CCC2	ZINC000450762664	CF	On-Demand	Anodyne	L3MBTL3	44	36
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450762695	DF	On-Demand	Anodyne	SDH1	0	40
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)C(C)(C)CO	ZINC000450762696	DF	On-Demand	Anodyne	SDH1	0	40
CC(C)c1nnc(SCCN(C)Cc2ccccc2)n1Cc1ccco1	ZINC000450762713	FI	On-Demand	Anodyne	HCRTR2	0	41
CCCNc1ccccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450762722	EI	On-Demand	Anodyne	MME	47	36
CCCNc1ccccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450762722	EI	On-Demand	Anodyne	ANPEP	53	35
CCCNc1ccccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450762722	EI	On-Demand	Anodyne	CTRB1	17	40
CCCNc1ccccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450762722	EI	On-Demand	Anodyne	MMP3	41	34
CCCNc1ccccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450762722	EI	On-Demand	Anodyne	CAPN2	43	33
CCCNc1ccccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450762722	EI	On-Demand	Anodyne	LAP3	43	35
CCCNc1ccccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450762722	EI	On-Demand	Anodyne	NPR	54	34
CCCNc1ccccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450762722	EI	On-Demand	Anodyne	AMP1_PLAFQ	41	40
CCCNc1ccccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450762724	EI	On-Demand	Anodyne	MME	47	36
CCCNc1ccccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450762724	EI	On-Demand	Anodyne	ANPEP	53	35
CCCNc1ccccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450762724	EI	On-Demand	Anodyne	CTRB1	17	40
CCCNc1ccccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450762724	EI	On-Demand	Anodyne	MMP3	41	34
CCCNc1ccccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450762724	EI	On-Demand	Anodyne	CAPN2	43	33
CCCNc1ccccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450762724	EI	On-Demand	Anodyne	LAP3	43	35
CCCNc1ccccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450762724	EI	On-Demand	Anodyne	NPR	54	34
CCCNc1ccccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450762724	EI	On-Demand	Anodyne	AMP1_PLAFQ	41	40
O=C(c1ccc2cnccc2c1)N1CCC(c2ccsc2)CC1	ZINC000450762727	DI	On-Demand	Anodyne	FASN	19	42
O=C(c1ccc2cnccc2c1)N1CCC(c2ccsc2)CC1	ZINC000450762727	DI	On-Demand	Anodyne	L3MBTL1	0	43
O=C(c1ccc2cnccc2c1)N1CCC(c2ccsc2)CC1	ZINC000450762727	DI	On-Demand	Anodyne	L3MBTL3	48	33
O=C(c1ccc2cnccc2c1)N1CCC(c2ccsc2)CC1	ZINC000450762727	DI	On-Demand	Anodyne	NPBWR1	42	30
O=C1CC[C@H](CCC(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)N1	ZINC000450762751	GD	On-Demand	Anodyne	RBP4	55	37
O=C1CC[C@H](CCC(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)N1	ZINC000450762752	GD	On-Demand	Anodyne	RBP4	55	37
O=C1CC[C@@H](CCC(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)N1	ZINC000450762753	GD	On-Demand	Anodyne	RBP4	55	37
O=C1CC[C@@H](CCC(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)N1	ZINC000450762754	GD	On-Demand	Anodyne	RBP4	55	37
COC(=O)c1ccc(CSCCN2CCOCC2)c(Br)c1	ZINC000450762763	FF	On-Demand	Anodyne	CASR	0	40
C=C[C@@H]1OCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450762765	GD	On-Demand	Mild	BDKRB1	0	41
C=C[C@@H]1OCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450762765	GD	On-Demand	Mild	BCL2L1	74	33
C=C[C@@H]1OCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450762765	GD	On-Demand	Mild	BCL2	59	33
C=C[C@@H]1OCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450762765	GD	On-Demand	Mild	BCL2L2	42	29
CCCNc1ccccc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450762767	DI	On-Demand	Anodyne	HDAC1	48	40
C[C@@H](Oc1ccccn1)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450762782	DG	On-Demand	Anodyne	NPBWR1	57	31
C[C@H](Oc1ccccn1)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450762783	DG	On-Demand	Anodyne	NPBWR1	57	31
CC[C@@](NC(=O)c1ccc(C(F)(F)F)cc1C)(C(N)=O)C(C)C	ZINC000450762784	EG	On-Demand	Anodyne	SORT1	15	40
CC[C@](NC(=O)c1ccc(C(F)(F)F)cc1C)(C(N)=O)C(C)C	ZINC000450762785	EG	On-Demand	Anodyne	SORT1	15	40
COC(=O)C1(CNC(=O)c2ccc3cnccc3c2)CC1	ZINC000450762800	CD	On-Demand	Anodyne	AKT1	19	42
COC(=O)C1(CNC(=O)c2ccc3cnccc3c2)CC1	ZINC000450762800	CD	On-Demand	Anodyne	CYP17A1	18	42
COC(=O)C1(CNC(=O)c2ccc3cnccc3c2)CC1	ZINC000450762800	CD	On-Demand	Anodyne	NAMPT	17	43
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	HTR1A	27	42
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	DRD2	24	44
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	DRD1	0	41
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	ADRA1A	15	41
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	DRD3	39	44
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	PDGFRB	15	44
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	KCNA3	40	33
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	CPT1A	47	33
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	HCN1	47	34
COC(=O)C1(CNC(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)CC1	ZINC000450762811	GF	On-Demand	Anodyne	HPGD	48	58
CN(CCSc1nnc(N2CCCC2)n1Cc1ccco1)Cc1ccccc1	ZINC000450762816	GH	On-Demand	Anodyne	HCRTR2	0	40
CCCc1nc(C)c(NC(=O)[C@@H](C)OCc2ccc(F)cc2)s1	ZINC000450762817	EI	On-Demand	Anodyne	ACAT	40	31
CCCc1nc(C)c(NC(=O)[C@H](C)OCc2ccc(F)cc2)s1	ZINC000450762818	EI	On-Demand	Anodyne	ACAT	40	31
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)CC1	ZINC000450762828	GF	On-Demand	Anodyne	TRPV1	36	47
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)CC1	ZINC000450762828	GF	On-Demand	Anodyne	RBP4	30	47
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)CC1	ZINC000450762829	GF	On-Demand	Anodyne	TRPV1	36	47
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)CC1	ZINC000450762829	GF	On-Demand	Anodyne	RBP4	30	47
CC(C)(C)c1ccc(C2CCN(c3ccc(C(=O)NCCO)nn3)CC2)cc1	ZINC000450762831	GF	On-Demand	Anodyne	SCD1	64	54
CC(C)(C)c1ccc(C2CCN(c3ccc(C(=O)NCCO)nn3)CC2)cc1	ZINC000450762831	GF	On-Demand	Anodyne	SCD	52	52
CO[C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C[C@@H]1C	ZINC000450762845	DG	On-Demand	Anodyne	GRM5	29	46
CO[C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C[C@@H]1C	ZINC000450762847	DG	On-Demand	Anodyne	GRM5	29	46
CO[C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1C	ZINC000450762849	DG	On-Demand	Anodyne	GRM5	29	46
CO[C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1C	ZINC000450762850	DG	On-Demand	Anodyne	GRM5	29	46
CO[C@H]1CCN(c2cc(C(C)C)ncn2)C[C@@H]1C	ZINC000450762853	BE	On-Demand	Anodyne	PDE3A	43	35
CO[C@H]1CCN(c2cc(C(C)C)ncn2)C[C@@H]1C	ZINC000450762853	BE	On-Demand	Anodyne	PDE3B	64	35
CO[C@@H]1CCN(c2cc(C(C)C)ncn2)C[C@H]1C	ZINC000450762854	BE	On-Demand	Anodyne	PDE3A	43	35
CO[C@@H]1CCN(c2cc(C(C)C)ncn2)C[C@H]1C	ZINC000450762854	BE	On-Demand	Anodyne	PDE3B	64	35
CO[C@@H]1CCN(c2cc(C(C)C)ncn2)C[C@@H]1C	ZINC000450762855	BE	On-Demand	Anodyne	PDE3A	43	35
CO[C@@H]1CCN(c2cc(C(C)C)ncn2)C[C@@H]1C	ZINC000450762855	BE	On-Demand	Anodyne	PDE3B	64	35
CO[C@H]1CCN(c2cc(C(C)C)ncn2)C[C@H]1C	ZINC000450762856	BE	On-Demand	Anodyne	PDE3A	43	35
CO[C@H]1CCN(c2cc(C(C)C)ncn2)C[C@H]1C	ZINC000450762856	BE	On-Demand	Anodyne	PDE3B	64	35
COc1ccc(CNC(=O)CCN2CCC(=O)[C@H](C)C2)c(OC)c1	ZINC000450762862	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC(=O)[C@H](C)C2)c(OC)c1	ZINC000450762862	ED	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CCC(=O)[C@H](C)C2)c(OC)c1	ZINC000450762862	ED	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc(CNC(=O)CCN2CCC(=O)[C@@H](C)C2)c(OC)c1	ZINC000450762863	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC(=O)[C@@H](C)C2)c(OC)c1	ZINC000450762863	ED	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CCC(=O)[C@@H](C)C2)c(OC)c1	ZINC000450762863	ED	On-Demand	Anodyne	MTNR1A	42	36
COC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450762866	GD	On-Demand	Anodyne	SLC6A1	33	40
COC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000450762866	GD	On-Demand	Anodyne	NPBWR1	42	32
CO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450762870	EI	On-Demand	Anodyne	ADRB2	15	52
CO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450762870	EI	On-Demand	Anodyne	PDE3A	41	36
CO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450762870	EI	On-Demand	Anodyne	ADRB3	19	55
CO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450762870	EI	On-Demand	Anodyne	PDE3B	41	36
CO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450762872	EI	On-Demand	Anodyne	ADRB2	15	52
CO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450762872	EI	On-Demand	Anodyne	PDE3A	41	36
CO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450762872	EI	On-Demand	Anodyne	ADRB3	19	55
CO[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450762872	EI	On-Demand	Anodyne	PDE3B	41	36
CO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450762873	EI	On-Demand	Anodyne	ADRB2	15	52
CO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450762873	EI	On-Demand	Anodyne	PDE3A	41	36
CO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450762873	EI	On-Demand	Anodyne	ADRB3	19	55
CO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450762873	EI	On-Demand	Anodyne	PDE3B	41	36
CO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450762874	EI	On-Demand	Anodyne	ADRB2	15	52
CO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450762874	EI	On-Demand	Anodyne	PDE3A	41	36
CO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450762874	EI	On-Demand	Anodyne	ADRB3	19	55
CO[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450762874	EI	On-Demand	Anodyne	PDE3B	41	36
COC(=O)CN1CCN(C(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450762885	DC	On-Demand	Anodyne	EPHB3	32	45
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccccc1	ZINC000450762886	CF	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccccc1	ZINC000450762886	CF	On-Demand	Anodyne	HTR2C	22	52
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccccc1	ZINC000450762886	CF	On-Demand	Anodyne	SLC6A1	77	38
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccccc1	ZINC000450762886	CF	On-Demand	Anodyne	CYP2J2	66	47
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccccc1	ZINC000450762888	CF	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccccc1	ZINC000450762888	CF	On-Demand	Anodyne	HTR2C	22	52
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccccc1	ZINC000450762888	CF	On-Demand	Anodyne	SLC6A1	77	38
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccccc1	ZINC000450762888	CF	On-Demand	Anodyne	CYP2J2	66	47
CCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450762902	CD	On-Demand	Anodyne	HDAC1	22	43
CCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450762904	CD	On-Demand	Anodyne	HDAC1	22	43
CCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450762906	CD	On-Demand	Anodyne	HDAC1	22	43
CCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450762908	CD	On-Demand	Anodyne	HDAC1	22	43
CC(=O)c1ccc(CN2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450762912	DF	On-Demand	Anodyne	ACHE	23	45
CC(=O)c1ccc(CN2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450762912	DF	On-Demand	Anodyne	CMA1	0	40
CC(=O)c1ccc(CN2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450762912	DF	On-Demand	Anodyne	SIGMAR1	36	40
CC(=O)c1ccc(CN2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450762912	DF	On-Demand	Anodyne	NOD1	30	40
CC(=O)c1ccc(CN2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450762912	DF	On-Demand	Anodyne	NOD2	45	40
COC(=O)CN1CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450762949	DD	On-Demand	Anodyne	L3MBTL3	39	40
COc1ccc(NC(=O)C[C@@H](CNC(C)=O)CC(C)C)cc1[N+](=O)[O-]	ZINC000450762969	FF	On-Demand	Bother	ENPP1	51	31
CCOC(=O)c1cc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)[nH]c1C	ZINC000450762976	FE	On-Demand	Anodyne	CTSA	48	34
CCOC(=O)c1cc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)[nH]c1C	ZINC000450762978	FE	On-Demand	Anodyne	CTSA	48	34
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H]3CCCC[C@H]32)c1	ZINC000450762987	DH	On-Demand	Anodyne	COLA	56	36
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H]3CCCC[C@H]32)c1	ZINC000450762987	DH	On-Demand	Anodyne	CPT1A	50	34
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H]3CCCC[C@H]32)c1	ZINC000450762987	DH	On-Demand	Anodyne	MTNR1A	23	43
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H]3CCCC[C@H]32)c1	ZINC000450762989	DH	On-Demand	Anodyne	COLA	56	36
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H]3CCCC[C@H]32)c1	ZINC000450762989	DH	On-Demand	Anodyne	CPT1A	52	34
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H]3CCCC[C@H]32)c1	ZINC000450762989	DH	On-Demand	Anodyne	MTNR1A	24	43
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H]3CCCC[C@H]32)c1	ZINC000450762989	DH	On-Demand	Anodyne	MTNR1B	30	43
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H]3CCCC[C@H]32)c1	ZINC000450762989	DH	On-Demand	Anodyne	CHRNA10	22	41
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)c1	ZINC000450762990	DH	On-Demand	Anodyne	COLA	56	36
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)c1	ZINC000450762990	DH	On-Demand	Anodyne	CPT1A	52	34
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)c1	ZINC000450762990	DH	On-Demand	Anodyne	MTNR1A	24	43
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)c1	ZINC000450762990	DH	On-Demand	Anodyne	MTNR1B	30	43
COc1cccc(OCCC(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)c1	ZINC000450762990	DH	On-Demand	Anodyne	CHRNA10	22	41
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1	ZINC000450762991	DH	On-Demand	Anodyne	COLA	56	36
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1	ZINC000450762991	DH	On-Demand	Anodyne	CPT1A	50	34
COc1cccc(OCCC(=O)N2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1	ZINC000450762991	DH	On-Demand	Anodyne	MTNR1A	23	43
CC(C)(C)[C@@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450762992	CD	On-Demand	Anodyne	HPGDS	23	46
C=CCN(C)Cc1ccc(F)c(CN(C)CC=C)c1	ZINC000450763000	CG	On-Demand	Mild	LSS	16	43
COC(=O)CN1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450763006	EE	On-Demand	Anodyne	DRD4	49	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450763013	GD	On-Demand	Anodyne	DRD4	44	33
COC(=O)CN1CCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450763013	GD	On-Demand	Anodyne	MTNR1A	28	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450763013	GD	On-Demand	Anodyne	MTNR1B	35	40
COC(=O)CN1CCN(C(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450763013	GD	On-Demand	Anodyne	FAAH	23	43
CCN1C[C@H](Nc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450763021	GC	On-Demand	Bother	BDKRB1	0	41
CCN1C[C@H](Nc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450763021	GC	On-Demand	Bother	BCL2L1	91	35
CCN1C[C@H](Nc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450763021	GC	On-Demand	Bother	BCL2	80	35
CCN1C[C@H](Nc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450763021	GC	On-Demand	Bother	BCL2L2	48	35
COc1ccc(Nc2cc(N3CC[C@H](OC)[C@@H](C)C3)ncn2)c(OC)c1	ZINC000450763026	FG	On-Demand	Anodyne	PDE3A	48	41
COc1ccc(Nc2cc(N3CC[C@H](OC)[C@@H](C)C3)ncn2)c(OC)c1	ZINC000450763026	FG	On-Demand	Anodyne	PDE3B	71	41
COc1ccc(Nc2cc(N3CC[C@H](OC)[C@@H](C)C3)ncn2)c(OC)c1	ZINC000450763026	FG	On-Demand	Anodyne	GALR2	42	34
COc1ccc(Nc2cc(N3CC[C@H](OC)[C@H](C)C3)ncn2)c(OC)c1	ZINC000450763027	FG	On-Demand	Anodyne	PDE3A	48	41
COc1ccc(Nc2cc(N3CC[C@H](OC)[C@H](C)C3)ncn2)c(OC)c1	ZINC000450763027	FG	On-Demand	Anodyne	PDE3B	71	41
COc1ccc(Nc2cc(N3CC[C@H](OC)[C@H](C)C3)ncn2)c(OC)c1	ZINC000450763027	FG	On-Demand	Anodyne	GALR2	42	34
COc1ccc(Nc2cc(N3CC[C@@H](OC)[C@H](C)C3)ncn2)c(OC)c1	ZINC000450763028	FG	On-Demand	Anodyne	PDE3A	48	41
COc1ccc(Nc2cc(N3CC[C@@H](OC)[C@H](C)C3)ncn2)c(OC)c1	ZINC000450763028	FG	On-Demand	Anodyne	PDE3B	71	41
COc1ccc(Nc2cc(N3CC[C@@H](OC)[C@H](C)C3)ncn2)c(OC)c1	ZINC000450763028	FG	On-Demand	Anodyne	GALR2	42	34
COc1ccc(Nc2cc(N3CC[C@@H](OC)[C@@H](C)C3)ncn2)c(OC)c1	ZINC000450763029	FG	On-Demand	Anodyne	PDE3A	48	41
COc1ccc(Nc2cc(N3CC[C@@H](OC)[C@@H](C)C3)ncn2)c(OC)c1	ZINC000450763029	FG	On-Demand	Anodyne	PDE3B	71	41
COc1ccc(Nc2cc(N3CC[C@@H](OC)[C@@H](C)C3)ncn2)c(OC)c1	ZINC000450763029	FG	On-Demand	Anodyne	GALR2	42	34
COCCC1(CNC(=O)c2cnn3ccc(C)cc23)CCCCC1	ZINC000450763036	EG	On-Demand	Anodyne	EPHB3	35	48
COCCC1(CNC(=O)c2cnn3ccc(C)cc23)CCCCC1	ZINC000450763036	EG	On-Demand	Anodyne	HCN1	56	34
COCCC1(CNC(=O)c2cnn3ccc(C)cc23)CCCCC1	ZINC000450763036	EG	On-Demand	Anodyne	HCN4	53	34
COC(=O)[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450763070	EG	On-Demand	Anodyne	LEF	44	40
COC(=O)[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450763071	EG	On-Demand	Anodyne	LEF	44	40
COC(=O)[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450763072	EG	On-Demand	Anodyne	LEF	44	40
COC(=O)[C@H](NC[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450763073	EG	On-Demand	Anodyne	LEF	44	40
COC(=O)[C@@H](NCc1cn(CC2CC2)nn1)c1ccc(F)c(C)c1	ZINC000450763076	EE	On-Demand	Anodyne	LEF	59	39
COC(=O)[C@H](NCc1cn(CC2CC2)nn1)c1ccc(F)c(C)c1	ZINC000450763077	EE	On-Demand	Anodyne	LEF	59	39
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)C1=CCN(C)CC1	ZINC000450763080	FH	On-Demand	Anodyne	RBP4	70	41
C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)C1=CCN(C)CC1	ZINC000450763081	FH	On-Demand	Anodyne	RBP4	70	41
COC(=O)c1csc(CN2CCN(c3c(Cl)cccc3Cl)CC2)n1	ZINC000450763082	GH	On-Demand	Anodyne	DRD3	44	36
Cc1cccc(Cl)c1C(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450763090	GG	On-Demand	Anodyne	CCR5	24	44
Cc1cccc(Cl)c1C(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450763090	GG	On-Demand	Anodyne	CCR8	55	35
Cc1cccc(Cl)c1C(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450763094	GG	On-Demand	Anodyne	CCR5	24	44
Cc1cccc(Cl)c1C(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1	ZINC000450763094	GG	On-Demand	Anodyne	CCR8	55	35
CCS(=O)(=O)c1ccc(CN(CC(C)C)[C@H]2CCCc3cccnc32)cc1	ZINC000450763105	GI	On-Demand	Anodyne	CXCR4	86	48
O=C(CCCC(=O)N(CCO)CC1CCCCC1)C1CC1	ZINC000450763117	CF	On-Demand	Anodyne	PHF8	0	40
CCS(=O)(=O)c1ccc(CN(CC(C)C)[C@@H]2CCCc3cccnc32)cc1	ZINC000450763142	GI	On-Demand	Anodyne	CXCR4	86	48
COC(=O)C1(CNC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450763144	GF	On-Demand	Anodyne	CHRM3	15	44
COC(=O)C1(CNC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450763144	GF	On-Demand	Anodyne	MMP13	25	48
COC(=O)C1(CNC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450763144	GF	On-Demand	Anodyne	ROCK2	24	40
COC(=O)C1(CNC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450763144	GF	On-Demand	Anodyne	KCNK3	51	35
COC(=O)C1(CNC(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)CC1	ZINC000450763144	GF	On-Demand	Anodyne	KCNK9	40	35
c1ccc2c(c1)CO[C@@]21CCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450763145	DE	On-Demand	Anodyne	SIGMAR1	22	45
COC(=O)COc1ccc([C@@H](C)N[C@H](C)c2csnn2)cc1	ZINC000450763148	DF	On-Demand	Anodyne	ACACA	42	37
COC(=O)COc1ccc([C@@H](C)N[C@@H](C)c2csnn2)cc1	ZINC000450763151	DF	On-Demand	Anodyne	ACACA	42	37
c1ccc2c(c1)CO[C@]21CCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450763152	DE	On-Demand	Anodyne	SIGMAR1	22	45
COC(=O)COc1ccc([C@H](C)N[C@@H](C)c2csnn2)cc1	ZINC000450763155	DF	On-Demand	Anodyne	ACACA	42	37
COC(=O)COc1ccc([C@H](C)N[C@H](C)c2csnn2)cc1	ZINC000450763158	DF	On-Demand	Anodyne	ACACA	42	37
O=C(c1cc2n(n1)CCC2)N1CCC(c2c(F)cccc2F)CC1	ZINC000450763159	EG	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1cc2n(n1)CCC2)N1CCC(c2c(F)cccc2F)CC1	ZINC000450763159	EG	On-Demand	Anodyne	L3MBTL3	50	34
CC(C)CN(Cc1cnns1)[C@H]1CCCc2cccnc21	ZINC000450763163	DG	On-Demand	Anodyne	CXCR4	89	52
CC(C)CN(Cc1cnns1)[C@@H]1CCCc2cccnc21	ZINC000450763166	DG	On-Demand	Anodyne	CXCR4	89	52
CCC[C@H](O)CN(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450763174	CH	On-Demand	Anodyne	CXCR4	89	47
COc1cccc2c(N3CC[C@H](OC)[C@H](C)C3)ccnc12	ZINC000450763176	CG	On-Demand	Anodyne	PDE3A	46	35
COc1cccc2c(N3CC[C@H](OC)[C@H](C)C3)ccnc12	ZINC000450763176	CG	On-Demand	Anodyne	PDE3B	68	37
CCC[C@@H](O)CN(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450763177	CH	On-Demand	Anodyne	CXCR4	89	47
CCC[C@H](O)CN(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450763179	CH	On-Demand	Anodyne	CXCR4	89	47
COc1cccc2c(N3CC[C@@H](OC)[C@H](C)C3)ccnc12	ZINC000450763180	CG	On-Demand	Anodyne	PDE3A	46	35
COc1cccc2c(N3CC[C@@H](OC)[C@H](C)C3)ccnc12	ZINC000450763180	CG	On-Demand	Anodyne	PDE3B	68	37
CCC[C@@H](O)CN(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450763181	CH	On-Demand	Anodyne	CXCR4	89	47
COc1cccc2c(N3CC[C@@H](OC)[C@@H](C)C3)ccnc12	ZINC000450763182	CG	On-Demand	Anodyne	PDE3A	46	35
COc1cccc2c(N3CC[C@@H](OC)[C@@H](C)C3)ccnc12	ZINC000450763182	CG	On-Demand	Anodyne	PDE3B	68	37
COc1cccc2c(N3CC[C@H](OC)[C@@H](C)C3)ccnc12	ZINC000450763184	CG	On-Demand	Anodyne	PDE3A	46	35
COc1cccc2c(N3CC[C@H](OC)[C@@H](C)C3)ccnc12	ZINC000450763184	CG	On-Demand	Anodyne	PDE3B	68	37
CC(=O)N[C@H](C(=O)NCC1(c2ccc(F)cc2F)CCCC1)C(C)(C)C	ZINC000450763202	FG	On-Demand	Anodyne	ACAT	0	44
C[C@@H](O)CCn1cnc2cc(-c3ccccc3)sc2c1=O	ZINC000450763205	DF	On-Demand	Anodyne	MCHR1	31	44
CN(CCN1CCn2ncnc2C1)Cc1ccccc1	ZINC000450763228	CD	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)c1cccc(CN2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450763264	DH	On-Demand	Anodyne	SIGMAR1	57	52
CC(=O)c1cccc(CN2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450763264	DH	On-Demand	Anodyne	SLC18A3	43	46
CC(=O)c1cccc(CN2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450763264	DH	On-Demand	Anodyne	MCHR1	20	42
CC(=O)c1cccc(CN2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000450763264	DH	On-Demand	Anodyne	MCHR2	77	37
CC(=O)c1cccc(CN2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450763266	DH	On-Demand	Anodyne	SIGMAR1	57	52
CC(=O)c1cccc(CN2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450763266	DH	On-Demand	Anodyne	SLC18A3	43	46
CC(=O)c1cccc(CN2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450763266	DH	On-Demand	Anodyne	MCHR1	20	42
CC(=O)c1cccc(CN2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000450763266	DH	On-Demand	Anodyne	MCHR2	77	37
COC[C@@H]1CCCCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450763268	CF	On-Demand	Anodyne	SLC6A1	15	40
COC[C@@H]1CCCCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450763268	CF	On-Demand	Anodyne	SLC6A3	16	40
COC[C@@H]1CCCCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450763269	CF	On-Demand	Anodyne	SLC6A1	15	40
COC[C@@H]1CCCCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450763269	CF	On-Demand	Anodyne	SLC6A3	16	40
COC[C@@H]1CCCCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450763270	CF	On-Demand	Anodyne	SLC6A1	15	40
COC[C@@H]1CCCCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450763270	CF	On-Demand	Anodyne	SLC6A3	16	40
COC[C@@H]1CCCCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450763271	CF	On-Demand	Anodyne	SLC6A1	15	40
COC[C@@H]1CCCCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450763271	CF	On-Demand	Anodyne	SLC6A3	16	40
Nc1c(Cl)ccc(C(=O)NCCN2CCNC(=O)C2)c1Cl	ZINC000450763273	EC	On-Demand	Anodyne	PLD2	40	33
CCCNc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450763276	GH	On-Demand	Anodyne	CA7	25	40
CCCNc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450763276	GH	On-Demand	Anodyne	CA5B	65	40
CCCNc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450763276	GH	On-Demand	Anodyne	CA5A	70	40
CCCNc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450763276	GH	On-Demand	Anodyne	RORC	63	38
CCN1C[C@@H](Nc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450763284	GC	On-Demand	Bother	BDKRB1	0	41
CCN1C[C@@H](Nc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450763284	GC	On-Demand	Bother	BCL2L1	91	35
CCN1C[C@@H](Nc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450763284	GC	On-Demand	Bother	BCL2	80	35
CCN1C[C@@H](Nc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450763284	GC	On-Demand	Bother	BCL2L2	48	35
CCS(=O)(=O)c1ccc(CN[C@H](CN(C)Cc2ccccc2)C(C)C)cc1	ZINC000450763287	GH	On-Demand	Anodyne	RORC	39	42
CCS(=O)(=O)c1ccc(CN[C@@H](CN(C)Cc2ccccc2)C(C)C)cc1	ZINC000450763290	GH	On-Demand	Anodyne	RORC	39	42
COc1cccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)CO)nc2)c1	ZINC000450763311	FG	On-Demand	Anodyne	RAF1	24	40
COc1cccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)CO)nc2)c1	ZINC000450763311	FG	On-Demand	Anodyne	MTNR1A	26	43
COc1cccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)CO)nc2)c1	ZINC000450763311	FG	On-Demand	Anodyne	MTNR1B	27	43
COc1cccc(Oc2ccc(C(=O)NC(C)(C)C(C)(C)CO)nc2)c1	ZINC000450763311	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	29	40
C[C@H](O)CCn1cnc2cc(-c3ccccc3)sc2c1=O	ZINC000450763328	DF	On-Demand	Anodyne	MCHR1	31	44
Cc1cc(C(=O)Nc2cccc(CCCO)c2)nn1C(C)C	ZINC000450763338	DF	On-Demand	Anodyne	KCNK3	56	33
COC(=O)C1(CNC(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450763341	FF	On-Demand	Anodyne	KCNA3	40	40
COC(=O)C1(CNC(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450763341	FF	On-Demand	Anodyne	HCN1	62	37
COC(=O)C1(CNC(=O)c2ccc(Oc3ccccc3OC)cn2)CC1	ZINC000450763341	FF	On-Demand	Anodyne	HCN4	51	36
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763342	CE	On-Demand	Anodyne	SLC6A3	19	46
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763342	CE	On-Demand	Anodyne	BIRC8	45	32
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763342	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	42
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763344	CE	On-Demand	Anodyne	SLC6A3	19	46
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763344	CE	On-Demand	Anodyne	BIRC8	45	32
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763344	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	42
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763346	CE	On-Demand	Anodyne	SLC6A3	19	46
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763346	CE	On-Demand	Anodyne	BIRC8	45	32
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763346	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	42
Cc1[nH]c(C#N)cc1C(=O)Nc1cccc(CCCO)c1	ZINC000450763349	CE	On-Demand	Mild	KCNK3	50	33
Cc1[nH]c(C#N)cc1C(=O)Nc1cccc(CCCO)c1	ZINC000450763349	CE	On-Demand	Mild	KCNK9	69	36
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763354	CE	On-Demand	Anodyne	SLC6A3	19	46
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763354	CE	On-Demand	Anodyne	BIRC8	45	32
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(=O)C2	ZINC000450763354	CE	On-Demand	Anodyne	Q8WSF8_APLCA	33	42
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763357	CE	On-Demand	Anodyne	DRD2	34	52
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763357	CE	On-Demand	Anodyne	DRD1	0	52
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763357	CE	On-Demand	Anodyne	DRD4	24	53
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763357	CE	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763357	CE	On-Demand	Anodyne	SLC18A3	22	53
O=C(CCCN1C[C@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763357	CE	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763359	CE	On-Demand	Anodyne	DRD2	34	52
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763359	CE	On-Demand	Anodyne	DRD1	0	52
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763359	CE	On-Demand	Anodyne	DRD4	24	53
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763359	CE	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763359	CE	On-Demand	Anodyne	SLC18A3	22	53
O=C(CCCN1C[C@@H](O)C2(CC2)C1)c1ccc(F)cc1	ZINC000450763359	CE	On-Demand	Anodyne	CYP2J2	51	36
CC[C@@](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)(C(N)=O)C(C)C	ZINC000450763373	ED	On-Demand	Anodyne	PDE4D	15	42
CC[C@](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)(C(N)=O)C(C)C	ZINC000450763374	ED	On-Demand	Anodyne	PDE4D	15	42
CC[C@](NC(=O)Cc1ccccc1O[C@H]1CCOC1)(C(N)=O)C(C)C	ZINC000450763376	ED	On-Demand	Anodyne	PDE4D	15	42
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763377	CF	On-Demand	Anodyne	DRD2	33	48
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763377	CF	On-Demand	Anodyne	DRD4	25	52
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763377	CF	On-Demand	Anodyne	HTR2A	29	51
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763377	CF	On-Demand	Anodyne	HTR2C	24	60
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763377	CF	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763377	CF	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763377	CF	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCO[C@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763377	CF	On-Demand	Anodyne	CYP2J2	57	40
CC[C@@](NC(=O)Cc1ccccc1O[C@H]1CCOC1)(C(N)=O)C(C)C	ZINC000450763378	ED	On-Demand	Anodyne	PDE4D	15	42
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763379	CF	On-Demand	Anodyne	DRD2	33	48
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763379	CF	On-Demand	Anodyne	DRD4	25	52
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763379	CF	On-Demand	Anodyne	HTR2A	29	51
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763379	CF	On-Demand	Anodyne	HTR2C	24	60
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763379	CF	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763379	CF	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763379	CF	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCO[C@@H](C2CC2)C1)c1ccc(F)cc1	ZINC000450763379	CF	On-Demand	Anodyne	CYP2J2	57	40
COC(=O)C1(CNC(=O)c2cc3ccncc3s2)CC1	ZINC000450763388	CD	On-Demand	Anodyne	ICAM1	45	33
CCN1C[C@H](Nc2cc(C(F)(F)F)nc(-c3cccnc3)n2)CC1=O	ZINC000450763400	FE	On-Demand	Anodyne	ROS1	42	31
CCCNc1ccccc1NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450763404	EI	On-Demand	Anodyne	LEF	57	33
CCN1C[C@@H](Nc2cc(C(F)(F)F)nc(-c3cccnc3)n2)CC1=O	ZINC000450763405	FE	On-Demand	Anodyne	ROS1	42	31
CCCNc1ccccc1NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450763407	EI	On-Demand	Anodyne	LEF	57	33
COC(=O)c1csc(CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450763409	FF	On-Demand	Anodyne	DRD4	26	40
COC(=O)c1csc(CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450763409	FF	On-Demand	Anodyne	DRD3	24	45
COC(=O)c1csc(CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450763409	FF	On-Demand	Anodyne	SIGMAR1	43	38
COC(=O)c1csc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450763414	FF	On-Demand	Anodyne	DRD4	26	40
COC(=O)c1csc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450763414	FF	On-Demand	Anodyne	DRD3	24	45
COC(=O)c1csc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450763414	FF	On-Demand	Anodyne	SIGMAR1	43	38
COC(=O)c1csc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450763421	FF	On-Demand	Anodyne	DRD4	26	40
COC(=O)c1csc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450763421	FF	On-Demand	Anodyne	DRD3	24	45
COC(=O)c1csc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450763421	FF	On-Demand	Anodyne	SIGMAR1	43	38
COC(=O)c1csc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450763428	FF	On-Demand	Anodyne	DRD4	26	40
COC(=O)c1csc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450763428	FF	On-Demand	Anodyne	DRD3	24	45
COC(=O)c1csc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450763428	FF	On-Demand	Anodyne	SIGMAR1	43	38
O=C([C@@H]1CC12CCSCC2)N1CCC(c2ccsc2)CC1	ZINC000450763438	DH	On-Demand	Anodyne	NPBWR1	45	31
O=C([C@H]1CC12CCSCC2)N1CCC(c2ccsc2)CC1	ZINC000450763446	DH	On-Demand	Anodyne	NPBWR1	45	31
Cc1cc(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)nn1C(C)C	ZINC000450763460	FH	On-Demand	Anodyne	NPY5R	16	47
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1n[nH]c(=N)o1	ZINC000450763468	DD	On-Demand	Anodyne	PPARD	22	41
COC(=O)[C@@H](NC[C@H]1CCC(F)(F)C1)c1ccc(OC)c(O)c1	ZINC000450763474	EF	On-Demand	Anodyne	FOLH1	40	40
COC(=O)[C@H](NC[C@H]1CCC(F)(F)C1)c1ccc(OC)c(O)c1	ZINC000450763476	EF	On-Demand	Anodyne	FOLH1	40	40
Cc1ccc(C(=O)Nc2cccc(CCCO)c2)c(C(C)C)n1	ZINC000450763492	DH	On-Demand	Anodyne	HTR1D	28	43
Cc1ccc(C(=O)Nc2cccc(CCCO)c2)c(C(C)C)n1	ZINC000450763492	DH	On-Demand	Anodyne	HTR1B	24	43
Cc1ccc(C(=O)Nc2cccc(CCCO)c2)c(C(C)C)n1	ZINC000450763492	DH	On-Demand	Anodyne	OPRL1	0	41
Cc1ccc(C(=O)Nc2cccc(CCCO)c2)c(C(C)C)n1	ZINC000450763492	DH	On-Demand	Anodyne	KCNK3	59	35
Cc1ccc(C(=O)Nc2cccc(CCCO)c2)c(C(C)C)n1	ZINC000450763492	DH	On-Demand	Anodyne	KCNK9	68	37
CC(C)(C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1)C1CCC1	ZINC000450763493	FG	On-Demand	Anodyne	NPBWR1	16	40
C[C@H](C(=O)NC(C)(C)C)N(C)CC/C=C/c1ccccc1	ZINC000450763534	CG	On-Demand	Anodyne	NA	20	42
C[C@@H](C(=O)NC(C)(C)C)N(C)CC/C=C\c1ccccc1	ZINC000450763536	CG	On-Demand	Anodyne	NA	20	42
C[C@@H](C(=O)NC(C)(C)C)N(C)CC/C=C/c1ccccc1	ZINC000450763537	CG	On-Demand	Anodyne	NA	20	42
C[C@H](C(=O)NC(C)(C)C)N(C)CC/C=C\c1ccccc1	ZINC000450763538	CG	On-Demand	Anodyne	NA	20	42
COc1ccc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000450763576	FF	On-Demand	Bother	PDEC	0	44
COc1ccc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000450763578	FF	On-Demand	Bother	PDEC	0	44
CC(C)(CO)C(C)(C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450763585	CD	On-Demand	Anodyne	CAN2	0	50
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	DRD2	37	56
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	DRD1	22	52
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	DRD4	27	56
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	HTR2A	29	49
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	HTR2C	25	52
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	HRH1	15	56
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	DRD5	17	42
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	ERG2	28	58
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	HTR7	19	56
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	SIGMAR1	20	55
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	SLC18A3	23	55
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	EBP	17	58
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	PLD2	40	37
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	CYP2J2	57	42
O=C(CCCN1CCC(O)(Cc2cccc(F)c2)CC1)c1ccc(F)cc1	ZINC000450763593	FH	On-Demand	Anodyne	NET	0	56
COCCOC[C@@H](O)CN1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450763596	EC	On-Demand	Anodyne	ABCB1	34	41
CN(CCN1CCC(O)(Cc2cccc(F)c2)CC1)Cc1ccccc1	ZINC000450763597	FG	On-Demand	Anodyne	SIGMAR1	42	53
COCCOC[C@H](O)CN1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450763601	EC	On-Demand	Anodyne	ABCB1	34	41
CC(=O)c1ccc(CSc2nnc(C(C)C)n2Cc2ccco2)cc1	ZINC000450763620	FJ	On-Demand	Anodyne	HCRTR2	21	45
C(=C/c1ccccc1)\CCN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450763625	DI	On-Demand	Anodyne	ETHR	45	38
C(=C\c1ccccc1)\CCN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450763627	DI	On-Demand	Anodyne	ETHR	45	38
C/C=C\COc1cccc(CC(=O)N2CCS(=O)(=O)c3ccccc3C2)c1	ZINC000450763629	GG	On-Demand	Anodyne	BRS3	18	40
COc1ccc(CC(=O)NCCC(C)(C)O)c(Cl)c1OC	ZINC000450763643	DE	On-Demand	Anodyne	CAN2	0	40
CCc1cccc(C(=O)NCC(=O)N(C)CC)n1	ZINC000450763659	BC	On-Demand	Anodyne	PDE5A	0	42
CO[C@@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450763661	EE	On-Demand	Bother	TAAR1	19	51
CO[C@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450763662	EE	On-Demand	Bother	TAAR1	19	51
CO[C@@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450763663	EE	On-Demand	Bother	TAAR1	19	51
CO[C@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450763664	EE	On-Demand	Bother	TAAR1	19	51
CN(CCN1CCC(c2noc(C3CC3)n2)CC1)Cc1ccccc1	ZINC000450763673	EG	On-Demand	Anodyne	SIGMAR1	26	41
CN(CCN1CCC(c2noc(C3CC3)n2)CC1)Cc1ccccc1	ZINC000450763673	EG	On-Demand	Anodyne	SMO	48	35
CN(CCN1CCC(c2noc(C3CC3)n2)CC1)Cc1ccccc1	ZINC000450763673	EG	On-Demand	Anodyne	ETHR	45	37
COc1ccc(CNC(=O)CCN2CCN(c3ccccc3)C(=O)C2)c(OC)c1	ZINC000450763683	GE	On-Demand	Anodyne	HTR1A	36	42
COc1ccc(CNC(=O)CCN2CCN(c3ccccc3)C(=O)C2)c(OC)c1	ZINC000450763683	GE	On-Demand	Anodyne	DRD2	28	40
COc1ccc(CNC(=O)CCN2CCN(c3ccccc3)C(=O)C2)c(OC)c1	ZINC000450763683	GE	On-Demand	Anodyne	DRD4	43	33
COc1ccc(CNC(=O)CCN2CCN(c3ccccc3)C(=O)C2)c(OC)c1	ZINC000450763683	GE	On-Demand	Anodyne	HTR2A	15	40
COc1ccc(CNC(=O)CCN2CCN(c3ccccc3)C(=O)C2)c(OC)c1	ZINC000450763683	GE	On-Demand	Anodyne	DRD3	41	39
COc1ccc(CNC(=O)CCN2CCN(c3ccccc3)C(=O)C2)c(OC)c1	ZINC000450763683	GE	On-Demand	Anodyne	HTR7	52	46
COc1ccc(CNC(=O)CCN2CCN(c3ccccc3)C(=O)C2)c(OC)c1	ZINC000450763683	GE	On-Demand	Anodyne	MTNR1A	59	36
COc1ccc(CNC(=O)CCN2CCN(c3ccccc3)C(=O)C2)c(OC)c1	ZINC000450763683	GE	On-Demand	Anodyne	MTNR1B	49	36
CO[C@@H]1CCN(c2ncnc3sc(C)c(C)c23)C[C@H]1C	ZINC000450763694	CG	On-Demand	Anodyne	PDE3A	40	32
CO[C@@H]1CCN(c2ncnc3sc(C)c(C)c23)C[C@H]1C	ZINC000450763694	CG	On-Demand	Anodyne	PDE3B	60	32
CO[C@H]1CCN(c2ncnc3sc(C)c(C)c23)C[C@@H]1C	ZINC000450763695	CG	On-Demand	Anodyne	PDE3A	40	32
CO[C@H]1CCN(c2ncnc3sc(C)c(C)c23)C[C@@H]1C	ZINC000450763695	CG	On-Demand	Anodyne	PDE3B	60	32
CO[C@@H]1CCN(c2ncnc3sc(C)c(C)c23)C[C@@H]1C	ZINC000450763696	CG	On-Demand	Anodyne	PDE3A	40	32
CO[C@@H]1CCN(c2ncnc3sc(C)c(C)c23)C[C@@H]1C	ZINC000450763696	CG	On-Demand	Anodyne	PDE3B	60	32
CO[C@H]1CCN(c2ncnc3sc(C)c(C)c23)C[C@H]1C	ZINC000450763697	CG	On-Demand	Anodyne	PDE3A	40	32
CO[C@H]1CCN(c2ncnc3sc(C)c(C)c23)C[C@H]1C	ZINC000450763697	CG	On-Demand	Anodyne	PDE3B	60	32
CO[C@@H]1CCN(c2ncc(C#N)cc2Cl)C[C@H]1C	ZINC000450763699	CE	On-Demand	Mild	PDE3B	47	39
CO[C@H]1CCN(c2ncc(C#N)cc2Cl)C[C@@H]1C	ZINC000450763700	CE	On-Demand	Mild	PDE3B	47	39
CO[C@@H]1CCN(c2ncc(C#N)cc2Cl)C[C@@H]1C	ZINC000450763701	CE	On-Demand	Mild	PDE3B	47	39
CO[C@H]1CCN(c2ncc(C#N)cc2Cl)C[C@H]1C	ZINC000450763702	CE	On-Demand	Mild	PDE3B	47	39
CCN(C)C(=O)CNC(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450763706	CD	On-Demand	Anodyne	PYGL	48	42
Cc1cc(-c2nc(C(=O)NCCC(C)(C)O)co2)ccn1	ZINC000450763711	CD	On-Demand	Anodyne	IRAK4	21	43
CCC[C@@H](O)CN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450763719	CE	On-Demand	Anodyne	ETHR	22	41
CCC[C@H](O)CN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450763720	CE	On-Demand	Anodyne	ETHR	22	41
CO[C@@H]1CCN(c2ccnc(C(C)C)n2)CC1(C)C	ZINC000450763727	CF	On-Demand	Anodyne	SORD	60	41
CO[C@H]1CCN(c2ccnc(C(C)C)n2)CC1(C)C	ZINC000450763728	CF	On-Demand	Anodyne	SORD	60	41
CC(=O)N[C@H](C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1)C(C)(C)C	ZINC000450763735	FF	On-Demand	Anodyne	Q82323_9DELA	65	33
CC(=O)N[C@H](C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1)C(C)(C)C	ZINC000450763735	FF	On-Demand	Anodyne	DERP1	0	40
CC(=O)N[C@H](C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1)C(C)(C)C	ZINC000450763736	FF	On-Demand	Anodyne	Q82323_9DELA	65	33
CC(=O)N[C@H](C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1)C(C)(C)C	ZINC000450763736	FF	On-Demand	Anodyne	DERP1	0	40
CO[C@@H]1CCN(c2ncnc3cccc(C)c23)C[C@@H]1C	ZINC000450763739	CF	On-Demand	Anodyne	PDE3A	29	44
CO[C@@H]1CCN(c2ncnc3cccc(C)c23)C[C@@H]1C	ZINC000450763739	CF	On-Demand	Anodyne	PDE3B	76	40
CO[C@H]1CCN(c2ncnc3cccc(C)c23)C[C@@H]1C	ZINC000450763740	CF	On-Demand	Anodyne	PDE3A	29	44
CO[C@H]1CCN(c2ncnc3cccc(C)c23)C[C@@H]1C	ZINC000450763740	CF	On-Demand	Anodyne	PDE3B	76	40
CO[C@H]1CCN(c2ncnc3cccc(C)c23)C[C@H]1C	ZINC000450763741	CF	On-Demand	Anodyne	PDE3A	29	44
CO[C@H]1CCN(c2ncnc3cccc(C)c23)C[C@H]1C	ZINC000450763741	CF	On-Demand	Anodyne	PDE3B	76	40
CO[C@@H]1CCN(c2ncnc3cccc(C)c23)C[C@H]1C	ZINC000450763742	CF	On-Demand	Anodyne	PDE3A	29	44
CO[C@@H]1CCN(c2ncnc3cccc(C)c23)C[C@H]1C	ZINC000450763742	CF	On-Demand	Anodyne	PDE3B	76	40
CCCNc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450763770	DH	On-Demand	Anodyne	KCNQ2	60	40
CCCNc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450763770	DH	On-Demand	Anodyne	CCR8	48	40
CCCNc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450763771	DH	On-Demand	Anodyne	KCNQ2	60	40
CC(=O)N[C@H](C(=O)N1CCC(c2ccsc2)CC1)C(C)(C)C	ZINC000450763773	DG	On-Demand	Anodyne	CCR1	42	38
CC(=O)N[C@H](C(=O)N1CCC(c2ccsc2)CC1)C(C)(C)C	ZINC000450763773	DG	On-Demand	Anodyne	NPBWR1	48	33
COC(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1OC	ZINC000450763775	FG	On-Demand	Bother	SLC27A4	49	33
COC(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1OC	ZINC000450763776	FG	On-Demand	Bother	SLC27A4	49	33
CO[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@@H]1C	ZINC000450763801	CH	On-Demand	Anodyne	LUCI_LUCLA	18	45
CO[C@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@@H]1C	ZINC000450763802	CH	On-Demand	Anodyne	LUCI_LUCLA	18	45
CO[C@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@H]1C	ZINC000450763803	CH	On-Demand	Anodyne	LUCI_LUCLA	18	45
CO[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C[C@H]1C	ZINC000450763804	CH	On-Demand	Anodyne	LUCI_LUCLA	18	45
CC(C)O[C@@]1(C(=O)NCC2(c3ccc(F)cc3F)CCCC2)CCOC1	ZINC000450763809	FG	On-Demand	Anodyne	ACAT	0	42
CC(C)O[C@]1(C(=O)NCC2(c3ccc(F)cc3F)CCCC2)CCOC1	ZINC000450763812	FG	On-Demand	Anodyne	ACAT	0	42
CC[C@@](NC(=O)c1ccc(-c2ccncc2)c(F)c1)(C(N)=O)C(C)C	ZINC000450763852	EF	On-Demand	Anodyne	ROCK2	27	40
CC[C@](NC(=O)c1ccc(-c2ccncc2)c(F)c1)(C(N)=O)C(C)C	ZINC000450763853	EF	On-Demand	Anodyne	ROCK2	27	40
COCc1nc(N2CC[C@H](OC)C(C)(C)C2)c2c(-c3ccccc3)csc2n1	ZINC000450763863	GJ	On-Demand	Anodyne	ADRB3	0	41
COCc1nc(N2CC[C@@H](OC)C(C)(C)C2)c2c(-c3ccccc3)csc2n1	ZINC000450763866	GJ	On-Demand	Anodyne	ADRB3	0	41
O=C(c1ccc(-c2ccncc2)c(F)c1)N(CCO)CC1CCCCC1	ZINC000450763868	FH	On-Demand	Anodyne	OXTR	0	41
COC(=O)c1coc(CN2CCN(c3c(Cl)cccc3Cl)CC2)n1	ZINC000450763882	FG	On-Demand	Anodyne	DRD3	43	36
CO[C@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@@H]1C	ZINC000450763893	CE	On-Demand	Anodyne	PDE3A	42	32
CO[C@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@@H]1C	ZINC000450763893	CE	On-Demand	Anodyne	GPR39	0	45
COC(=O)[C@H](NC[C@@H]1CCC(F)(F)C1)c1ccc(OC)c(O)c1	ZINC000450763900	EF	On-Demand	Anodyne	FOLH1	40	40
COC(=O)[C@@H](NC[C@@H]1CCC(F)(F)C1)c1ccc(OC)c(O)c1	ZINC000450763902	EF	On-Demand	Anodyne	FOLH1	40	40
CC(=O)c1ccc(C)cc1OCCC[C@@H](C)O	ZINC000450763932	BF	On-Demand	Anodyne	GRM2	27	40
CC(=O)c1ccc(C)cc1OCCC[C@H](C)O	ZINC000450763933	BF	On-Demand	Anodyne	GRM2	27	40
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	DRD2	35	49
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	HTR2A	21	52
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	ERG2	23	48
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	SIGMAR1	38	63
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	SLC18A3	47	63
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	EBP	22	48
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	MCHR1	26	47
O=C(CCCN1CC[C@@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763937	EH	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	DRD2	35	49
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	HTR2A	21	52
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	ERG2	23	48
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	SIGMAR1	38	63
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	SLC18A3	47	63
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	EBP	22	48
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	MCHR1	26	47
O=C(CCCN1CC[C@]2(C1)OCc1ccccc12)c1ccc(F)cc1	ZINC000450763938	EH	On-Demand	Anodyne	CYP2J2	52	37
COC(=O)C1(CNC(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450763942	CD	On-Demand	Anodyne	EPHB3	35	49
COC(=O)C1(CNC(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450763942	CD	On-Demand	Anodyne	HCN1	42	32
COC(=O)CN1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450763947	GD	On-Demand	Bother	SLC6A9	32	41
COC(=O)CN1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450763947	GD	On-Demand	Bother	LIPG	41	36
COC(=O)CN1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450763947	GD	On-Demand	Bother	PPXII	0	42
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccccc1	ZINC000450763950	DF	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccccc1	ZINC000450763950	DF	On-Demand	Anodyne	SLC6A1	69	37
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccccc1	ZINC000450763950	DF	On-Demand	Anodyne	HTR4	48	35
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccccc1	ZINC000450763950	DF	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccccc1	ZINC000450763951	DF	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccccc1	ZINC000450763951	DF	On-Demand	Anodyne	SLC6A1	69	37
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccccc1	ZINC000450763951	DF	On-Demand	Anodyne	HTR4	48	35
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccccc1	ZINC000450763951	DF	On-Demand	Anodyne	CYP2J2	60	42
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cn(Cc3ccccc3)nn2)cn1	ZINC000450763957	GF	On-Demand	Anodyne	GCK	26	42
COC(=O)CN1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450763958	ED	On-Demand	Anodyne	SIGMAR1	40	38
CCO[C@H]1COCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450763968	FD	On-Demand	Anodyne	MTNR1A	52	38
CCO[C@@H]1COCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450763970	FD	On-Demand	Anodyne	MTNR1A	52	38
CCO[C@@H]1COCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450763972	FD	On-Demand	Anodyne	MTNR1A	52	38
CCO[C@H]1COCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450763974	FD	On-Demand	Anodyne	MTNR1A	52	38
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	FKBP1A	42	45
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	MMP13	54	45
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	CCR4	0	41
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	ADAM17	44	42
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	ITGA4	40	43
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	PREP	67	39
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	CAPNS1	21	43
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	MMP2	25	43
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	MMP3	57	44
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	MMP8	31	43
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	CAPN1	17	46
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	MMP9	33	44
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	CASP7	42	33
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	MMP7	68	43
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	MMP1	60	47
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	SFRP1	88	38
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1	ZINC000450763976	GC	On-Demand	Anodyne	WNT3	86	38
N#CCC1(O)CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450763977	FD	On-Demand	Mild	TRPC6	75	39
N#CCC1(O)CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450763977	FD	On-Demand	Mild	TRPC3	56	39
Cc1cccc(Cl)c1CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450763992	CG	On-Demand	Anodyne	CXCL8	26	43
Cc1cccc(Cl)c1CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450763993	CG	On-Demand	Anodyne	CXCL8	26	43
COc1cc2c(N3CC[C@@H](c4nc(C)no4)C3)ccnc2cc1F	ZINC000450764016	EG	On-Demand	Anodyne	PDE3B	72	37
CO[C@H]1CCN(c2c(C#N)cnc3c(Cl)cc(C)cc23)CC1(C)C	ZINC000450764018	EI	On-Demand	Mild	SRC	47	35
CO[C@@H]1CCN(c2c(C#N)cnc3c(Cl)cc(C)cc23)CC1(C)C	ZINC000450764021	EI	On-Demand	Mild	SRC	47	35
COc1ccc(NC(=O)CC2CC(F)(F)C2)cc1[N+](=O)[O-]	ZINC000450764022	DF	On-Demand	Bother	ENPP1	50	31
CCS(=O)(=O)c1ccc(CN2CCCC[C@H](COC)C2)cc1	ZINC000450764024	EF	On-Demand	Anodyne	HRH3	20	40
CCS(=O)(=O)c1ccc(CN2CCCC[C@H](COC)C2)cc1	ZINC000450764024	EF	On-Demand	Anodyne	CASP7	44	36
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H](COC)C2)cc1	ZINC000450764026	EF	On-Demand	Anodyne	HRH3	20	40
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H](COC)C2)cc1	ZINC000450764026	EF	On-Demand	Anodyne	CASP7	44	36
COc1cc2c(N3CC[C@H](c4nc(C)no4)C3)ccnc2cc1F	ZINC000450764027	EG	On-Demand	Anodyne	PDE3B	72	37
CC(=O)c1ccc(C)cc1OCc1cc(C(C)(C)C)on1	ZINC000450764028	CI	On-Demand	Anodyne	RAF1	15	40
CC(=O)c1ccc(C)cc1OCc1cc(C(C)(C)C)on1	ZINC000450764028	CI	On-Demand	Anodyne	FLT3	42	41
CC(=O)c1ccc(C)cc1OCc1cc(C(C)(C)C)on1	ZINC000450764028	CI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
CC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1	ZINC000450764045	CG	On-Demand	Anodyne	SIGMAR1	22	46
CC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1	ZINC000450764045	CG	On-Demand	Anodyne	CHEK2	19	40
CC(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1	ZINC000450764045	CG	On-Demand	Anodyne	MLNR	40	35
CC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1	ZINC000450764046	CG	On-Demand	Anodyne	SIGMAR1	22	46
CC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1	ZINC000450764046	CG	On-Demand	Anodyne	CHEK2	19	40
CC(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1	ZINC000450764046	CG	On-Demand	Anodyne	MLNR	40	35
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	DRD2	36	55
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	DRD1	17	55
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	DRD4	19	58
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	HTR2A	26	58
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	ERG2	25	55
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	SIGMAR1	18	59
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	EBP	29	55
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	HTR3B	0	47
O=C(CCCN1CCCC2(CC2)C1)c1ccc(F)cc1	ZINC000450764054	CH	On-Demand	Anodyne	CYP2J2	51	36
CSCc1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)o1	ZINC000450764055	EJ	On-Demand	Anodyne	GSK3A	41	36
CSCc1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)o1	ZINC000450764055	EJ	On-Demand	Anodyne	PTK2	0	41
CSCc1nnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)o1	ZINC000450764056	EJ	On-Demand	Anodyne	GSK3A	41	36
CSCc1nnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)o1	ZINC000450764056	EJ	On-Demand	Anodyne	PTK2	0	41
Clc1ccc(CCN2CCO[C@H](C3CC3)C2)cc1	ZINC000450764064	CF	On-Demand	Anodyne	SIGMAR1	15	41
Clc1ccc(CCN2CCO[C@@H](C3CC3)C2)cc1	ZINC000450764066	CF	On-Demand	Anodyne	SIGMAR1	15	41
O=c1c2sc(-c3ccccc3)cc2ncn1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450764067	EH	On-Demand	Anodyne	MCHR1	30	41
O=c1c2sc(-c3ccccc3)cc2ncn1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450764072	EH	On-Demand	Anodyne	MCHR1	30	41
C[C@H](OCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450764091	GD	On-Demand	Anodyne	CAPN2	56	33
C[C@H](OCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450764091	GD	On-Demand	Anodyne	NPR	47	33
COc1ccnc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450764109	EE	On-Demand	Anodyne	SIGMAR1	24	41
COc1ccnc(CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450764110	EE	On-Demand	Anodyne	SIGMAR1	24	41
COc1ccnc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000450764112	EE	On-Demand	Anodyne	SIGMAR1	24	41
COc1ccnc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000450764113	EE	On-Demand	Anodyne	SIGMAR1	24	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](CO)C(C)(C)C	ZINC000450764223	DG	On-Demand	Anodyne	MTTP	54	35
CC(C)(CO)C(C)(C)NC(=O)c1ccc2cnccc2c1	ZINC000450764226	CF	On-Demand	Anodyne	AKT1	22	44
COC(=O)c1nc(N2CC[C@@H](c3cccc(Br)c3)C2)sc1C	ZINC000450764247	GH	On-Demand	Anodyne	GYRB	52	39
COC(=O)c1nc(N2CC[C@@H](c3cccc(Br)c3)C2)sc1C	ZINC000450764247	GH	On-Demand	Anodyne	PARE	75	39
COC(=O)c1nc(N2CC[C@H](c3cccc(Br)c3)C2)sc1C	ZINC000450764250	GH	On-Demand	Anodyne	GYRB	52	39
COC(=O)c1nc(N2CC[C@H](c3cccc(Br)c3)C2)sc1C	ZINC000450764250	GH	On-Demand	Anodyne	PARE	75	39
Brc1cccc([C@@H]2CCN(c3ccccn3)C2)c1	ZINC000450764264	DH	On-Demand	Anodyne	DRD4	23	42
Brc1cccc([C@@H]2CCN(c3ccccn3)C2)c1	ZINC000450764264	DH	On-Demand	Anodyne	AVPR1A	0	44
Brc1cccc([C@@H]2CCN(c3ccccn3)C2)c1	ZINC000450764264	DH	On-Demand	Anodyne	EBP	32	46
Brc1cccc([C@H]2CCN(c3ccccn3)C2)c1	ZINC000450764265	DH	On-Demand	Anodyne	DRD4	23	42
Brc1cccc([C@H]2CCN(c3ccccn3)C2)c1	ZINC000450764265	DH	On-Demand	Anodyne	AVPR1A	0	44
Brc1cccc([C@H]2CCN(c3ccccn3)C2)c1	ZINC000450764265	DH	On-Demand	Anodyne	EBP	32	46
CCCCn1cnc2c1c(=O)n(Cc1cccc(C)n1)c(=O)n2CCCC	ZINC000450764276	FF	On-Demand	Anodyne	ADORA2A	0	56
O=C(N1CCN(c2nnc(C(F)(F)F)s2)CC1)C1(C(F)(F)F)CCC1	ZINC000450764299	GF	On-Demand	Anodyne	NPBWR1	15	40
C=CCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450764327	CD	On-Demand	Mild	HDAC1	17	41
C=CCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450764328	CD	On-Demand	Mild	HDAC1	17	41
C=CCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450764329	CD	On-Demand	Mild	HDAC1	17	41
C=CCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450764330	CD	On-Demand	Mild	HDAC1	17	41
CO[C@H]1CCN(c2ccnc(C(C)C)n2)C[C@H]1C	ZINC000450764331	BE	On-Demand	Anodyne	HRH4	0	63
CO[C@H]1CCN(c2ccnc(C(C)C)n2)C[C@H]1C	ZINC000450764331	BE	On-Demand	Anodyne	SORD	104	43
CO[C@@H]1CCN(c2ccnc(C(C)C)n2)C[C@@H]1C	ZINC000450764332	BE	On-Demand	Anodyne	HRH4	0	63
CO[C@@H]1CCN(c2ccnc(C(C)C)n2)C[C@@H]1C	ZINC000450764332	BE	On-Demand	Anodyne	SORD	104	43
CO[C@H]1CCN(c2ccnc(C(C)C)n2)C[C@@H]1C	ZINC000450764333	BE	On-Demand	Anodyne	HRH4	0	63
CO[C@H]1CCN(c2ccnc(C(C)C)n2)C[C@@H]1C	ZINC000450764333	BE	On-Demand	Anodyne	SORD	104	43
CO[C@@H]1CCN(c2ccnc(C(C)C)n2)C[C@H]1C	ZINC000450764334	BE	On-Demand	Anodyne	HRH4	0	63
CO[C@@H]1CCN(c2ccnc(C(C)C)n2)C[C@H]1C	ZINC000450764334	BE	On-Demand	Anodyne	SORD	104	43
O=C(NC1CN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1)C1CCC1	ZINC000450764336	EF	On-Demand	Anodyne	ERBB2	0	41
O=C(NC1CN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1)C1CCC1	ZINC000450764336	EF	On-Demand	Anodyne	EPHX2	27	46
O=C(NC1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1)C1CCC1	ZINC000450764340	EF	On-Demand	Anodyne	ERBB2	0	41
O=C(NC1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1)C1CCC1	ZINC000450764340	EF	On-Demand	Anodyne	EPHX2	27	46
O=C(NC1CN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1)C1CCC1	ZINC000450764342	EF	On-Demand	Anodyne	ERBB2	0	41
O=C(NC1CN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1)C1CCC1	ZINC000450764342	EF	On-Demand	Anodyne	EPHX2	27	46
O=C(NC1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1)C1CCC1	ZINC000450764344	EF	On-Demand	Anodyne	ERBB2	0	41
O=C(NC1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1)C1CCC1	ZINC000450764344	EF	On-Demand	Anodyne	EPHX2	27	46
CC(=O)N1CCN(C(=O)C2CCN(c3cccc(Cl)c3C#N)CC2)CC1	ZINC000450764352	FE	On-Demand	Mild	SSTR1	34	40
CC(=O)N1CCCN(C[C@H]2CCCN(c3nc4ccccc4n3C)C2)CC1	ZINC000450764353	FE	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)N1CCCN(C[C@H]2CCCN(c3nc4ccccc4n3C)C2)CC1	ZINC000450764353	FE	On-Demand	Anodyne	HRH1	29	42
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nc4ccccc4n3C)C2)CC1	ZINC000450764354	FE	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nc4ccccc4n3C)C2)CC1	ZINC000450764354	FE	On-Demand	Anodyne	HRH1	29	42
CS(=O)(=O)c1ccc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nc1	ZINC000450764364	GH	On-Demand	Anodyne	GPR119	15	48
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	HTR1A	22	51
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	DRD4	23	49
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	HTR2A	23	49
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	HRH1	22	44
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	HTR7	37	45
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	SIGMAR1	30	49
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	PRCP	26	41
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	SLC18A3	0	40
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764385	DF	On-Demand	Anodyne	CYP2J2	72	51
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	HTR1A	22	51
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	DRD4	23	49
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	HTR2A	23	49
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	HRH1	22	44
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	HTR7	37	45
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	SIGMAR1	30	49
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	PRCP	26	41
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	SLC18A3	0	40
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450764387	DF	On-Demand	Anodyne	CYP2J2	72	51
CC(C)(O)CCNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450764417	CF	On-Demand	Anodyne	SCN9A	0	41
CC(C)(O)CCNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450764419	CF	On-Demand	Anodyne	SCN9A	0	41
CC(C)(O)CCNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450764421	CF	On-Demand	Anodyne	SCN9A	0	41
CC(C)(O)CCNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450764423	CF	On-Demand	Anodyne	SCN9A	0	41
CCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450764428	CE	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450764428	CE	On-Demand	Anodyne	HDAC1	0	42
CCCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450764429	CE	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450764429	CE	On-Demand	Anodyne	HDAC1	0	42
CCCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450764430	CE	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450764430	CE	On-Demand	Anodyne	HDAC1	0	42
CCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450764431	CE	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450764431	CE	On-Demand	Anodyne	HDAC1	0	42
Cc1cccc(Cl)c1CN[C@H](C)c1cn(C(C)(C)C)nc1C	ZINC000450764495	DJ	On-Demand	Anodyne	EIF2AK1	46	36
Cc1cccc(Cl)c1CN[C@@H](C)c1cn(C(C)(C)C)nc1C	ZINC000450764502	DJ	On-Demand	Anodyne	EIF2AK1	43	36
CCCc1nc(C)c(NC(=O)Cc2ccc(Cl)c(OC)c2)s1	ZINC000450764522	EI	On-Demand	Anodyne	MAPK10	15	40
CCC[C@H](O)CN1Cc2ccccc2C2(CC2)C1	ZINC000450764532	BF	On-Demand	Anodyne	SLC18A3	44	41
CCC[C@@H](O)CN1Cc2ccccc2C2(CC2)C1	ZINC000450764533	BF	On-Demand	Anodyne	SLC18A3	44	41
O=C1NCCN(C(=O)C[C@@H]2CC[C@@H]3C[C@H]23)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450764538	FG	On-Demand	Anodyne	RBP4	65	37
O=C1NCCN(C(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450764539	FG	On-Demand	Anodyne	RBP4	76	37
O=C1NCCN(C(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)[C@H]1c1ccccc1C(F)(F)F	ZINC000450764540	FG	On-Demand	Anodyne	RBP4	76	37
O=C1NCCN(C(=O)C[C@@H]2CC[C@@H]3C[C@H]23)[C@H]1c1ccccc1C(F)(F)F	ZINC000450764541	FG	On-Demand	Anodyne	RBP4	65	37
O=C1NCCN(C(=O)CC2CC(F)(F)C2)[C@H]1c1ccccc1C(F)(F)F	ZINC000450764542	GG	On-Demand	Anodyne	RBP4	69	37
O=C1NCCN(C(=O)CC2CC(F)(F)C2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450764543	GG	On-Demand	Anodyne	RBP4	69	37
C[C@H]1C[C@H](C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)CC[C@H]1C	ZINC000450764546	GG	On-Demand	Anodyne	NPBWR1	24	44
C[C@@H]1CC[C@@H](C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)C[C@H]1C	ZINC000450764547	GG	On-Demand	Anodyne	NPBWR1	24	44
C[C@@H]1CC[C@H](C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)C[C@H]1C	ZINC000450764548	GG	On-Demand	Anodyne	NPBWR1	24	44
C[C@H]1C[C@@H](C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)CC[C@H]1C	ZINC000450764549	GG	On-Demand	Anodyne	NPBWR1	24	44
COc1cc(CC(=O)N(CCO)CC2CCCCC2)ccc1Cl	ZINC000450764573	EG	On-Demand	Anodyne	OPRK1	28	40
O=C(CCCC(=O)N1CCC(c2ccsc2)CC1)C1CC1	ZINC000450764574	DH	On-Demand	Anodyne	ETHR	48	37
CO[C@@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@H]1C	ZINC000450764589	CE	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@H]1C	ZINC000450764589	CE	On-Demand	Anodyne	GPR39	0	45
CO[C@@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@@H]1C	ZINC000450764590	CE	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@@H]1C	ZINC000450764590	CE	On-Demand	Anodyne	GPR39	0	45
CO[C@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@H]1C	ZINC000450764591	CE	On-Demand	Anodyne	PDE3A	42	32
CO[C@H]1CCN(c2cc(NCC3CC3)ncn2)C[C@H]1C	ZINC000450764591	CE	On-Demand	Anodyne	GPR39	0	45
CCOC(=O)c1csc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450764592	FH	On-Demand	Bother	SLC27A4	54	36
CCOC(=O)c1csc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450764593	FH	On-Demand	Bother	SLC27A4	54	36
COC(=O)C1(CNC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450764605	FF	On-Demand	Anodyne	PDE6D	74	42
COC(=O)C1(CNC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450764605	FF	On-Demand	Anodyne	IMDH_CRYPV	36	53
CN(Cc1ccccc1)[C@@H](CNC(=O)c1ccc(-c2cnn(C)c2)o1)C1CC1	ZINC000450764616	GG	On-Demand	Anodyne	MMP13	0	42
CN(Cc1ccccc1)[C@H](CNC(=O)c1ccc(-c2cnn(C)c2)o1)C1CC1	ZINC000450764618	GG	On-Demand	Anodyne	MMP13	0	42
CO[C@@H]1CCN(c2cc(C)nc3ccc(F)cc23)C[C@@H]1C	ZINC000450764624	CH	On-Demand	Anodyne	DHODH	46	36
CO[C@H]1CCN(c2cc(C)nc3ccc(F)cc23)C[C@H]1C	ZINC000450764626	CH	On-Demand	Anodyne	DHODH	44	36
CO[C@H]1CCN(c2cc(C)nc3ccc(F)cc23)C[C@@H]1C	ZINC000450764628	CH	On-Demand	Anodyne	DHODH	44	36
CO[C@@H]1CCN(c2cc(C)nc3ccc(F)cc23)C[C@H]1C	ZINC000450764629	CH	On-Demand	Anodyne	DHODH	44	36
Cn1c(C#N)ccc1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450764640	FF	On-Demand	Mild	SFRP1	50	32
Cn1c(C#N)ccc1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450764641	FF	On-Demand	Mild	SFRP1	50	32
CCOC(=O)CN(Cc1ccc(C(=O)OC)c(Cl)c1)C1CCC1	ZINC000450764642	EG	On-Demand	Anodyne	ACE	19	42
CCOC(=O)c1cc(C(=O)NCC2(CCOC)CCCCC2)on1	ZINC000450764650	EF	On-Demand	Anodyne	HCN1	52	32
CCOC(=O)c1cc(C(=O)NCC2(CCOC)CCCCC2)on1	ZINC000450764650	EF	On-Demand	Anodyne	HCN4	50	32
CCOC(=O)c1cc(C(=O)NCC2(CCOC)CCCCC2)[nH]c1C	ZINC000450764652	FG	On-Demand	Anodyne	HCN1	50	31
CCOC(=O)c1cc(C(=O)NCC2(CCOC)CCCCC2)[nH]c1C	ZINC000450764652	FG	On-Demand	Anodyne	HCN4	48	31
FC1(F)CCCC[C@H]1CN[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450764667	EJ	On-Demand	Anodyne	SCN9A	0	40
FC1(F)CCCC[C@@H]1CN[C@H](Cc1ccccn1)c1ccccc1	ZINC000450764670	EJ	On-Demand	Anodyne	SCN9A	0	40
FC1(F)CCCC[C@@H]1CN[C@@H](Cc1ccccn1)c1ccccc1	ZINC000450764671	EJ	On-Demand	Anodyne	SCN9A	0	40
FC1(F)CCCC[C@H]1CN[C@H](Cc1ccccn1)c1ccccc1	ZINC000450764673	EJ	On-Demand	Anodyne	SCN9A	0	40
CO[C@@H]1CCN(c2cccc(C(=O)OC(C)(C)C)n2)C[C@@H]1C	ZINC000450764677	DF	On-Demand	Anodyne	PRKCQ	0	41
CO[C@H]1CCN(c2cccc(C(=O)OC(C)(C)C)n2)C[C@@H]1C	ZINC000450764678	DF	On-Demand	Anodyne	PRKCQ	0	41
CO[C@H]1CCN(c2cccc(C(=O)OC(C)(C)C)n2)C[C@H]1C	ZINC000450764679	DF	On-Demand	Anodyne	PRKCQ	0	41
CO[C@@H]1CCN(c2cccc(C(=O)OC(C)(C)C)n2)C[C@H]1C	ZINC000450764680	DF	On-Demand	Anodyne	PRKCQ	0	41
COc1ccc2nc(C)nc(N3CC[C@@H](OC)[C@H](C)C3)c2c1	ZINC000450764681	DF	On-Demand	Anodyne	PDE3A	53	46
COc1ccc2nc(C)nc(N3CC[C@@H](OC)[C@H](C)C3)c2c1	ZINC000450764681	DF	On-Demand	Anodyne	PDE3B	78	46
COc1ccc2nc(C)nc(N3CC[C@H](OC)[C@H](C)C3)c2c1	ZINC000450764683	DF	On-Demand	Anodyne	PDE3A	53	46
COc1ccc2nc(C)nc(N3CC[C@H](OC)[C@H](C)C3)c2c1	ZINC000450764683	DF	On-Demand	Anodyne	PDE3B	78	46
COc1ccc2nc(C)nc(N3CC[C@@H](OC)[C@@H](C)C3)c2c1	ZINC000450764685	DF	On-Demand	Anodyne	PDE3A	53	46
COc1ccc2nc(C)nc(N3CC[C@@H](OC)[C@@H](C)C3)c2c1	ZINC000450764685	DF	On-Demand	Anodyne	PDE3B	78	46
COc1ccc2nc(C)nc(N3CC[C@H](OC)[C@@H](C)C3)c2c1	ZINC000450764688	DF	On-Demand	Anodyne	PDE3A	53	46
COc1ccc2nc(C)nc(N3CC[C@H](OC)[C@@H](C)C3)c2c1	ZINC000450764688	DF	On-Demand	Anodyne	PDE3B	78	46
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCCCS(C)(=O)=O	ZINC000450764691	FF	On-Demand	Anodyne	PPARA	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCCCCCS(C)(=O)=O	ZINC000450764691	FF	On-Demand	Anodyne	PPARD	18	40
COCCC1(CNC(=O)c2ccc(C#N)n2C)CCCCC1	ZINC000450764697	DF	On-Demand	Mild	HCN1	51	31
COCCC1(CNC(=O)c2ccc(C#N)n2C)CCCCC1	ZINC000450764697	DF	On-Demand	Mild	HCN4	48	31
COC(=O)[C@@H](NCc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450764701	FG	On-Demand	Anodyne	PDE6A	40	30
COC(=O)[C@H](NCc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450764702	FG	On-Demand	Anodyne	PDE6A	40	30
COC[C@H]1CCCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450764703	EG	On-Demand	Anodyne	SIGMAR1	23	41
COC[C@@H]1CCCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450764704	EG	On-Demand	Anodyne	SIGMAR1	23	41
O=C1CC[C@H](CN2CC[C@]3(C2)OCc2ccccc23)CCN1	ZINC000450764705	DE	On-Demand	Anodyne	SIGMAR1	27	45
O=C1CC[C@@H](CN2CC[C@@]3(C2)OCc2ccccc23)CCN1	ZINC000450764706	DE	On-Demand	Anodyne	SIGMAR1	27	45
O=C1CC[C@H](CN2CC[C@@]3(C2)OCc2ccccc23)CCN1	ZINC000450764707	DE	On-Demand	Anodyne	SIGMAR1	27	45
O=C1CC[C@@H](CN2CC[C@]3(C2)OCc2ccccc23)CCN1	ZINC000450764708	DE	On-Demand	Anodyne	SIGMAR1	27	45
CC(C)c1nnc(CSc2cc(C(=O)NC3CC3)c3ccccc3n2)s1	ZINC000450764720	GI	On-Demand	Anodyne	TACR3	42	39
CC(C)c1nnc(CSc2cc(C(=O)NC3CC3)c3ccccc3n2)s1	ZINC000450764720	GI	On-Demand	Anodyne	TNKS	59	34
CCS(=O)(=O)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1	ZINC000450764765	EF	On-Demand	Anodyne	HRH3	17	42
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1	ZINC000450764768	EF	On-Demand	Anodyne	HRH3	17	42
Cc1noc([C@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764775	GD	On-Demand	Anodyne	COLA	38	42
Cc1noc([C@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764775	GD	On-Demand	Anodyne	CPT1A	36	42
Cc1noc([C@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764775	GD	On-Demand	Anodyne	GRM5	17	41
Cc1noc([C@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764775	GD	On-Demand	Anodyne	MTOR	45	34
Cc1noc([C@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764775	GD	On-Demand	Anodyne	EPHX2	15	41
COc1cc(C(=O)NCCN2c3ccccc3NS2(=O)=O)cc(C)n1	ZINC000450764776	FD	On-Demand	Anodyne	DRD4	43	35
Cc1noc([C@@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764778	GD	On-Demand	Anodyne	COLA	38	42
Cc1noc([C@@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764778	GD	On-Demand	Anodyne	CPT1A	36	42
Cc1noc([C@@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764778	GD	On-Demand	Anodyne	GRM5	17	41
Cc1noc([C@@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764778	GD	On-Demand	Anodyne	MTOR	45	34
Cc1noc([C@@H]2COCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450764778	GD	On-Demand	Anodyne	EPHX2	15	41
COCCC1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCCCC1	ZINC000450764784	EG	On-Demand	Anodyne	NPPA	41	33
COCCC1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCCCC1	ZINC000450764784	EG	On-Demand	Anodyne	HCN1	51	31
COCCC1(CNC(=O)c2ccc(-c3cnn(C)c3)o2)CCCCC1	ZINC000450764784	EG	On-Demand	Anodyne	HCN4	49	31
COC(=O)c1csc(CN2CC[C@H](c3c(F)cccc3F)C2)n1	ZINC000450764788	EG	On-Demand	Anodyne	TRPC6	44	32
COC(=O)c1csc(CN2CC[C@@H](c3c(F)cccc3F)C2)n1	ZINC000450764791	EG	On-Demand	Anodyne	TRPC6	44	32
CCN1C[C@@H](Nc2ncccc2C(=O)N2CCc3ccccc32)CC1=O	ZINC000450764792	FE	On-Demand	Anodyne	AVPR2	45	36
CCN1C[C@H](Nc2ncccc2C(=O)N2CCc3ccccc32)CC1=O	ZINC000450764794	FE	On-Demand	Anodyne	AVPR2	45	36
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764799	EF	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764799	EF	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764799	EF	On-Demand	Anodyne	HTR2A	22	46
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764799	EF	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCO[C@@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764799	EF	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764800	EF	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764800	EF	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764800	EF	On-Demand	Anodyne	HTR2A	22	46
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764800	EF	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCO[C@H](COCC2CC2)C1)c1ccc(F)cc1	ZINC000450764800	EF	On-Demand	Anodyne	CYP2J2	52	37
CC(=O)CCCCCSc1nnc(-c2cccs2)n1C	ZINC000450764832	DH	On-Demand	Anodyne	DRD2	0	46
CC(=O)CCCCCSc1nnc(-c2cccs2)n1C	ZINC000450764832	DH	On-Demand	Anodyne	DRD3	15	46
CC(=O)CCCCCSc1nnc(-c2cccs2)n1C	ZINC000450764832	DH	On-Demand	Anodyne	KCNH2	0	46
Fc1ccc(CC2CCN(C[C@H]3COCCO3)CC2)cc1F	ZINC000450764841	DF	On-Demand	Anodyne	CCR3	17	40
Fc1ccc(CC2CCN(C[C@@H]3COCCO3)CC2)cc1F	ZINC000450764842	DF	On-Demand	Anodyne	CCR3	17	40
CCC(CC)Oc1ccc(C(=O)N2CCN(CC(=O)OC)CC2)cc1	ZINC000450764856	EE	On-Demand	Anodyne	GPR183	0	40
CCS(=O)(=O)c1ccc(COc2cc(C)ccc2C(C)=O)cc1	ZINC000450764865	EH	On-Demand	Anodyne	RORC	41	34
c1ccc(CCn2ccc(CN3CC[C@]4(C3)OCc3ccccc34)n2)cc1	ZINC000450764896	FH	On-Demand	Anodyne	SIGMAR1	43	62
c1ccc(CCn2ccc(CN3CC[C@]4(C3)OCc3ccccc34)n2)cc1	ZINC000450764896	FH	On-Demand	Anodyne	SLC18A3	23	44
c1ccc(CCn2ccc(CN3CC[C@@]4(C3)OCc3ccccc34)n2)cc1	ZINC000450764899	FH	On-Demand	Anodyne	SIGMAR1	43	62
c1ccc(CCn2ccc(CN3CC[C@@]4(C3)OCc3ccccc34)n2)cc1	ZINC000450764899	FH	On-Demand	Anodyne	SLC18A3	23	44
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	HTR1A	33	47
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	DRD2	38	45
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	DRD4	33	42
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	ACHE	20	46
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	HTR2A	29	45
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	HTR2C	24	47
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	SLC6A1	173	47
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	ADRA1A	15	40
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	DRD3	38	45
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	CHRM4	18	42
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	CHRM5	22	42
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	HTR7	31	47
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	SIGMAR1	34	53
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	NPY1R	23	43
COCC[C@@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764922	DH	On-Demand	Anodyne	CYP2J2	60	43
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	HTR1A	33	47
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	DRD2	38	45
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	DRD4	33	42
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	ACHE	20	46
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	HTR2A	29	45
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	HTR2C	24	47
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	SLC6A1	173	47
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	ADRA1A	15	40
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	DRD3	38	45
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	CHRM4	18	42
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	CHRM5	22	42
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	HTR7	31	47
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	SIGMAR1	34	53
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	NPY1R	23	43
COCC[C@H]1CCCCN(CCCC(=O)c2ccccc2)C1	ZINC000450764923	DH	On-Demand	Anodyne	CYP2J2	60	43
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C)CC=CCC3)CC2)c1	ZINC000450764926	DH	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)[C@@]3(C)CC=CCC3)CC2)c1	ZINC000450764926	DH	On-Demand	Anodyne	HCRTR2	0	41
Cc1ccnc(OC2CCN(C(=O)[C@]3(C)CC=CCC3)CC2)c1	ZINC000450764927	DH	On-Demand	Anodyne	HCRTR1	0	41
Cc1ccnc(OC2CCN(C(=O)[C@]3(C)CC=CCC3)CC2)c1	ZINC000450764927	DH	On-Demand	Anodyne	HCRTR2	0	41
Cc1ccnc(OC2CCN(C(=O)[C@]3(C)CC=CCC3)CC2)c1	ZINC000450764927	DH	On-Demand	Anodyne	GPR119	23	40
CCN(CC)C(=O)CCC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450764932	FI	On-Demand	Anodyne	CCR3	18	42
CCN(CC)C(=O)CCC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450764932	FI	On-Demand	Anodyne	CCR5	62	44
CCN(CC)C(=O)CCC1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450764932	FI	On-Demand	Anodyne	L3MBTL3	41	33
C[C@H](C(=O)NC(C)(C)C)N(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450764935	GH	On-Demand	Anodyne	HDAC8	17	41
C[C@@H](C(=O)NC(C)(C)C)N(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450764937	GH	On-Demand	Anodyne	HDAC8	17	41
FC(F)(F)c1nnc(N2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450764970	GH	On-Demand	Anodyne	DRD4	18	43
FC(F)(F)c1nnc(N2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450764970	GH	On-Demand	Anodyne	SIGMAR1	17	50
FC(F)(F)c1nnc(N2CCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450764970	GH	On-Demand	Anodyne	ABCC1	58	36
COC(=O)CN1CCN(Cc2cccc(S(C)(=O)=O)c2)CC1	ZINC000450764979	EC	On-Demand	Anodyne	ADAM17	19	43
COC(=O)CN1CCN(Cc2cccc(S(C)(=O)=O)c2)CC1	ZINC000450764979	EC	On-Demand	Anodyne	FAAH	18	40
COC(=O)CN1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450764981	EF	On-Demand	Anodyne	SLC6A3	15	40
COC(=O)CN1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450764983	EF	On-Demand	Anodyne	SLC6A3	15	40
CC(C)(C(=O)NC[C@@H](c1ccccc1)C(F)(F)F)C1CCC1	ZINC000450764996	DI	On-Demand	Anodyne	AMY2	48	33
CC(C)(C(=O)NC[C@H](c1ccccc1)C(F)(F)F)C1CCC1	ZINC000450764997	DI	On-Demand	Anodyne	AMY2	48	33
CC(F)(F)CCn1cnc2cc(-c3ccccc3)sc2c1=O	ZINC000450765002	DI	On-Demand	Anodyne	MCHR1	31	44
CCN(Cc1cn(C)nn1)C(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450765003	EG	On-Demand	Anodyne	SLC6A9	53	32
CC1(O)CC(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000450765008	DF	On-Demand	Anodyne	Q82323_9DELA	46	30
CC1(O)CC(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000450765009	DF	On-Demand	Anodyne	Q82323_9DELA	46	30
NC(=O)c1csc(N[C@H](C2CC2)[C@@H](CO)C2CC2)n1	ZINC000450765010	CD	On-Demand	Anodyne	TRPC6	48	34
NC(=O)c1csc(N[C@@H](C2CC2)[C@H](CO)C2CC2)n1	ZINC000450765011	CD	On-Demand	Anodyne	TRPC6	48	34
NC(=O)c1csc(N[C@H](C2CC2)[C@H](CO)C2CC2)n1	ZINC000450765012	CD	On-Demand	Anodyne	TRPC6	48	34
NC(=O)c1csc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)n1	ZINC000450765013	CD	On-Demand	Anodyne	TRPC6	48	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765021	FH	On-Demand	Anodyne	PPARG	20	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765021	FH	On-Demand	Anodyne	PPARA	22	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765021	FH	On-Demand	Anodyne	MME	66	38
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765021	FH	On-Demand	Anodyne	PAPA1_CARPA	47	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765021	FH	On-Demand	Anodyne	SOAT1	23	42
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765021	FH	On-Demand	Anodyne	AMP1_PLAFQ	52	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765021	FH	On-Demand	Anodyne	NPFFR1	41	33
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765022	FH	On-Demand	Anodyne	PPARG	20	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765022	FH	On-Demand	Anodyne	PPARA	22	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765022	FH	On-Demand	Anodyne	MME	66	38
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765022	FH	On-Demand	Anodyne	PAPA1_CARPA	47	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765022	FH	On-Demand	Anodyne	SOAT1	23	42
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765022	FH	On-Demand	Anodyne	AMP1_PLAFQ	52	36
CO[C@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765022	FH	On-Demand	Anodyne	NPFFR1	41	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765023	FH	On-Demand	Anodyne	PPARG	20	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765023	FH	On-Demand	Anodyne	PPARA	22	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765023	FH	On-Demand	Anodyne	MME	66	38
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765023	FH	On-Demand	Anodyne	PAPA1_CARPA	47	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765023	FH	On-Demand	Anodyne	SOAT1	23	42
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765023	FH	On-Demand	Anodyne	AMP1_PLAFQ	52	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450765023	FH	On-Demand	Anodyne	NPFFR1	41	33
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765024	FH	On-Demand	Anodyne	PPARG	20	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765024	FH	On-Demand	Anodyne	PPARA	22	43
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765024	FH	On-Demand	Anodyne	MME	66	38
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765024	FH	On-Demand	Anodyne	PAPA1_CARPA	47	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765024	FH	On-Demand	Anodyne	SOAT1	23	42
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765024	FH	On-Demand	Anodyne	AMP1_PLAFQ	52	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450765024	FH	On-Demand	Anodyne	NPFFR1	41	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(CCCO)c1	ZINC000450765025	EG	On-Demand	Anodyne	ANPEP	43	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(CCCO)c1	ZINC000450765025	EG	On-Demand	Anodyne	CAPNS1	43	30
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(CCCO)c1	ZINC000450765025	EG	On-Demand	Anodyne	MMP3	52	49
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(CCCO)c1	ZINC000450765025	EG	On-Demand	Anodyne	CAPN1	40	35
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(CCCO)c1	ZINC000450765025	EG	On-Demand	Anodyne	CAPN2	54	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(CCCO)c1	ZINC000450765025	EG	On-Demand	Anodyne	FPR1	56	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(CCCO)c1	ZINC000450765025	EG	On-Demand	Anodyne	NPR	52	32
COC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450765059	DD	On-Demand	Anodyne	P2RY12	49	33
COC(=O)C1(CNC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450765059	DD	On-Demand	Anodyne	CTSV	46	31
C=C[C@@H]1OCC[C@H]1Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450765061	CG	On-Demand	Mild	AR	37	42
COc1cc(OC)c(Cn2nccc2NC(=O)[C@@H]2CCC(=O)N2C)c(OC)c1	ZINC000450765089	GD	On-Demand	Anodyne	P2RX7	17	43
CC(F)(F)c1ccc(C(=O)N(CCO)CC2CCCCC2)cn1	ZINC000450765090	EG	On-Demand	Anodyne	OXTR	0	41
COc1cc(OC)c(Cn2nccc2NC(=O)[C@H]2CCC(=O)N2C)c(OC)c1	ZINC000450765103	GD	On-Demand	Anodyne	P2RX7	17	43
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1cccc(CCCO)c1	ZINC000450765104	FF	On-Demand	Anodyne	PDEC	0	44
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1cccc(CCCO)c1	ZINC000450765106	FF	On-Demand	Anodyne	PDEC	0	44
CC(C)CN(CC1(C#N)CCC1)[C@H]1CCCc2cccnc21	ZINC000450765117	CI	On-Demand	Mild	CXCR4	83	47
COC(=O)C1(CNC(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450765118	FF	On-Demand	Anodyne	DRD4	41	32
COC(=O)C1(CNC(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450765118	FF	On-Demand	Anodyne	MTNR1A	35	41
COC(=O)C1(CNC(=O)c2ccc(Oc3cccc(OC)c3)cn2)CC1	ZINC000450765118	FF	On-Demand	Anodyne	MTNR1B	32	42
CC(C)CN(CC1(C#N)CCC1)[C@@H]1CCCc2cccnc21	ZINC000450765121	CI	On-Demand	Mild	CXCR4	83	47
C=C[C@@H]1OCC[C@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450765133	CD	On-Demand	Mild	PRKCQ	45	36
Cn1c(C#N)ccc1C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450765146	GE	On-Demand	Mild	RBP4	54	35
Cn1c(C#N)ccc1C(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450765147	GE	On-Demand	Mild	RBP4	54	35
COC(=O)C1(CNC(=O)c2ccccc2-n2ccc(C)n2)CC1	ZINC000450765149	DD	On-Demand	Anodyne	HCN1	54	34
COC(=O)C1(CNC(=O)c2ccccc2-n2ccc(C)n2)CC1	ZINC000450765149	DD	On-Demand	Anodyne	HCN4	51	34
CCCNc1ccccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450765150	FI	On-Demand	Anodyne	F10	29	42
CCCNc1ccccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450765150	FI	On-Demand	Anodyne	HDAC1	48	45
COCC1=CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450765161	ED	On-Demand	Anodyne	DRD4	40	31
COCC1=CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450765161	ED	On-Demand	Anodyne	HTR7	25	40
COCC1=CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450765161	ED	On-Demand	Anodyne	MTNR1A	44	38
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC(c2ccsc2)CC1	ZINC000450765176	GJ	On-Demand	Bother	LIPG	42	32
FC1(F)CC[C@@H](CN2CCC[C@@]3(C2)OCc2ccccc23)C1	ZINC000450765181	DH	On-Demand	Anodyne	SIGMAR1	21	46
FC1(F)CC[C@@H](CN2CCC[C@]3(C2)OCc2ccccc23)C1	ZINC000450765182	DH	On-Demand	Anodyne	SIGMAR1	21	46
FC1(F)CC[C@H](CN2CCC[C@]3(C2)OCc2ccccc23)C1	ZINC000450765183	DH	On-Demand	Anodyne	SIGMAR1	21	46
FC1(F)CC[C@H](CN2CCC[C@@]3(C2)OCc2ccccc23)C1	ZINC000450765184	DH	On-Demand	Anodyne	SIGMAR1	21	46
CCc1cccc(C(=O)NCCC(C)(C)O)n1	ZINC000450765194	BD	On-Demand	Anodyne	PDE5A	24	43
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	PDE3A	46	35
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	PDGFRB	74	54
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	AKT2	20	45
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	AKT3	19	45
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	PDE3B	68	35
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	AKT1	22	54
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	SIRT3	71	36
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	SIRT2	55	36
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	SIRT1	53	33
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4ccc(C)cc34)CC2)CC1	ZINC000450765196	GD	On-Demand	Anodyne	LIMK2	18	41
CC(C)(C)OC(=O)[C@@H]1CCCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450765199	EF	On-Demand	Anodyne	SLC6A1	64	34
CC(C)(C)OC(=O)[C@H]1CCCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450765200	EF	On-Demand	Anodyne	SLC6A1	64	34
CCOC(=O)[C@@H](NC(=O)c1cc2n(n1)CCCC2)[C@@H]1CCCOC1	ZINC000450765206	ED	On-Demand	Anodyne	P2RY12	45	38
CCOC(=O)[C@H](NC(=O)c1cc2n(n1)CCCC2)[C@@H]1CCCOC1	ZINC000450765207	ED	On-Demand	Anodyne	P2RY12	45	38
CCOC(=O)[C@H](NC(=O)c1cc2n(n1)CCCC2)[C@H]1CCCOC1	ZINC000450765208	ED	On-Demand	Anodyne	P2RY12	45	38
CCOC(=O)[C@@H](NC(=O)c1cc2n(n1)CCCC2)[C@H]1CCCOC1	ZINC000450765209	ED	On-Demand	Anodyne	P2RY12	45	38
FC1(Cc2ccc(Cl)cc2)CCN(c2ncnc3n[nH]cc23)CC1	ZINC000450765213	EH	On-Demand	Anodyne	AKT2	55	51
FC1(Cc2ccc(Cl)cc2)CCN(c2ncnc3n[nH]cc23)CC1	ZINC000450765213	EH	On-Demand	Anodyne	AKT3	35	42
FC1(Cc2ccc(Cl)cc2)CCN(c2ncnc3n[nH]cc23)CC1	ZINC000450765213	EH	On-Demand	Anodyne	AKT1	28	51
CC(=O)N1CCN(C(=O)C2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)CC1	ZINC000450765241	FD	On-Demand	Bother	SSTR2	40	36
CC(=O)N1CCN(C(=O)C2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)CC1	ZINC000450765241	FD	On-Demand	Bother	SSTR1	45	37
CCOC(=O)[C@H]1CCCN1CC1CCC(=O)CC1	ZINC000450765260	CD	On-Demand	Anodyne	FKBP12.6	0	41
COc1cc(CC(=O)N[C@H]2CCCO[C@@H]2CC(C)C)ccc1Cl	ZINC000450765261	EH	On-Demand	Anodyne	SSTR3	17	41
COc1cc(CC(=O)N[C@@H]2CCCO[C@@H]2CC(C)C)ccc1Cl	ZINC000450765262	EH	On-Demand	Anodyne	SSTR3	17	41
COc1cc(CC(=O)N[C@H]2CCCO[C@H]2CC(C)C)ccc1Cl	ZINC000450765263	EH	On-Demand	Anodyne	SSTR3	17	41
COc1cc(CC(=O)N[C@@H]2CCCO[C@H]2CC(C)C)ccc1Cl	ZINC000450765264	EH	On-Demand	Anodyne	SSTR3	17	41
FC1(F)CC(CN2CCC(c3noc(C4CC4)n3)CC2)C1	ZINC000450765272	CG	On-Demand	Anodyne	ETHR	17	42
CC[C@H](O)CC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450765281	EH	On-Demand	Anodyne	KCNJ11	96	42
CC[C@H](O)CC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450765281	EH	On-Demand	Anodyne	PPAF_PHAVU	0	40
CC[C@H](O)CC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450765282	EH	On-Demand	Anodyne	KCNJ11	96	42
CC[C@H](O)CC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450765282	EH	On-Demand	Anodyne	PPAF_PHAVU	0	40
CC[C@@H](O)CC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450765283	EH	On-Demand	Anodyne	KCNJ11	96	42
CC[C@@H](O)CC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450765283	EH	On-Demand	Anodyne	PPAF_PHAVU	0	40
CC[C@@H](O)CC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450765284	EH	On-Demand	Anodyne	KCNJ11	96	42
CC[C@@H](O)CC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450765284	EH	On-Demand	Anodyne	PPAF_PHAVU	0	40
CC(C)OC(=O)[C@@H](Nc1ncc(C#N)cc1Cl)C(C)C	ZINC000450765287	CF	On-Demand	Mild	IRAK4	15	40
CC(=O)c1cccc(CN2CCCC[C@@H](C)C2)c1	ZINC000450765292	BH	On-Demand	Anodyne	DRD4	25	41
CC(=O)c1cccc(CN2CCCC[C@@H](C)C2)c1	ZINC000450765292	BH	On-Demand	Anodyne	SLC6A1	65	36
CC(=O)c1cccc(CN2CCCC[C@@H](C)C2)c1	ZINC000450765292	BH	On-Demand	Anodyne	OPRK1	15	41
CC(=O)c1cccc(CN2CCCC[C@@H](C)C2)c1	ZINC000450765292	BH	On-Demand	Anodyne	CHRM3	17	43
CC(=O)c1cccc(CN2CCCC[C@@H](C)C2)c1	ZINC000450765292	BH	On-Demand	Anodyne	SIGMAR1	34	45
CC(=O)c1cccc(CN2CCCC[C@@H](C)C2)c1	ZINC000450765292	BH	On-Demand	Anodyne	BDKRB1	21	40
CC(=O)c1cccc(CN2CCCC[C@@H](C)C2)c1	ZINC000450765292	BH	On-Demand	Anodyne	MCHR1	18	40
CC(=O)c1cccc(CN2CCCC[C@@H](C)C2)c1	ZINC000450765292	BH	On-Demand	Anodyne	BIRC2	15	40
CC(=O)c1cccc(CN2CCCC[C@H](C)C2)c1	ZINC000450765293	BH	On-Demand	Anodyne	DRD4	25	41
CC(=O)c1cccc(CN2CCCC[C@H](C)C2)c1	ZINC000450765293	BH	On-Demand	Anodyne	SLC6A1	65	36
CC(=O)c1cccc(CN2CCCC[C@H](C)C2)c1	ZINC000450765293	BH	On-Demand	Anodyne	OPRK1	15	41
CC(=O)c1cccc(CN2CCCC[C@H](C)C2)c1	ZINC000450765293	BH	On-Demand	Anodyne	CHRM3	17	43
CC(=O)c1cccc(CN2CCCC[C@H](C)C2)c1	ZINC000450765293	BH	On-Demand	Anodyne	SIGMAR1	34	45
CC(=O)c1cccc(CN2CCCC[C@H](C)C2)c1	ZINC000450765293	BH	On-Demand	Anodyne	BDKRB1	21	40
CC(=O)c1cccc(CN2CCCC[C@H](C)C2)c1	ZINC000450765293	BH	On-Demand	Anodyne	MCHR1	18	40
CC(=O)c1cccc(CN2CCCC[C@H](C)C2)c1	ZINC000450765293	BH	On-Demand	Anodyne	BIRC2	15	40
CC(=O)c1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)cc1	ZINC000450765298	EI	On-Demand	Anodyne	DRD4	28	48
CC(=O)c1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)cc1	ZINC000450765298	EI	On-Demand	Anodyne	CCR3	53	40
CC(=O)c1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)cc1	ZINC000450765298	EI	On-Demand	Anodyne	MLNR	57	37
CC(=O)c1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)cc1	ZINC000450765298	EI	On-Demand	Anodyne	MCHR1	15	44
CC(=O)c1ccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)cc1	ZINC000450765299	EI	On-Demand	Anodyne	DRD4	28	48
CC(=O)c1ccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)cc1	ZINC000450765299	EI	On-Demand	Anodyne	CCR3	53	40
CC(=O)c1ccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)cc1	ZINC000450765299	EI	On-Demand	Anodyne	MLNR	57	37
CC(=O)c1ccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)cc1	ZINC000450765299	EI	On-Demand	Anodyne	MCHR1	15	44
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450765300	FF	On-Demand	Mild	MTNR1B	20	41
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450765302	FF	On-Demand	Mild	MTNR1B	20	41
COCCC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450765303	GH	On-Demand	Anodyne	HCN1	55	34
COCCC1(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)CCCCC1	ZINC000450765303	GH	On-Demand	Anodyne	HCN4	52	34
COCCC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450765304	GH	On-Demand	Anodyne	HCN1	55	34
COCCC1(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCCCC1	ZINC000450765304	GH	On-Demand	Anodyne	HCN4	52	34
CO[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450765305	DI	On-Demand	Anodyne	LIPG	54	38
CO[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450765306	DI	On-Demand	Anodyne	LIPG	54	38
CO[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450765307	DI	On-Demand	Anodyne	LIPG	54	38
CO[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450765308	DI	On-Demand	Anodyne	LIPG	54	38
CO[C@@H]1CCN(c2ncccc2OCc2ccccc2)C[C@@H]1C	ZINC000450765366	DH	On-Demand	Anodyne	PDE3B	57	39
CO[C@@H]1CCN(c2ncccc2OCc2ccccc2)C[C@H]1C	ZINC000450765368	DH	On-Demand	Anodyne	PDE3B	57	39
CO[C@H]1CCN(c2ncccc2OCc2ccccc2)C[C@@H]1C	ZINC000450765371	DH	On-Demand	Anodyne	PDE3B	57	39
CO[C@H]1CCN(c2ncccc2OCc2ccccc2)C[C@H]1C	ZINC000450765375	DH	On-Demand	Anodyne	PDE3B	57	39
Clc1cccc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ccc12	ZINC000450765376	CG	On-Demand	Anodyne	SMO	30	42
Clc1cccc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccc12	ZINC000450765381	CG	On-Demand	Anodyne	SMO	30	42
COc1ccc(NC(=O)[C@@H]2CCCCC2(F)F)cc1[N+](=O)[O-]	ZINC000450765383	DG	On-Demand	Bother	QRFPR	40	33
Clc1cccc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccc12	ZINC000450765384	CG	On-Demand	Anodyne	SMO	30	42
COc1ccc(NC(=O)[C@H]2CCCCC2(F)F)cc1[N+](=O)[O-]	ZINC000450765385	DG	On-Demand	Bother	QRFPR	40	33
C=CCN(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450765387	BE	On-Demand	Mild	AOC3	19	40
C=CCN(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450765388	BE	On-Demand	Mild	AOC3	19	40
C=CCN(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450765389	BE	On-Demand	Mild	AOC3	19	40
C=CCN(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450765390	BE	On-Demand	Mild	AOC3	19	40
COc1cccc2c(N3CC[C@H](OC)C(C)(C)C3)nccc12	ZINC000450765413	DG	On-Demand	Anodyne	PDE3A	27	40
COc1cccc2c(N3CC[C@@H](OC)C(C)(C)C3)nccc12	ZINC000450765416	DG	On-Demand	Anodyne	PDE3A	27	40
NC(=O)c1cnc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(Cl)c1	ZINC000450765431	FG	On-Demand	Bother	CXCR3	30	44
NC(=O)c1cnc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(Cl)c1	ZINC000450765433	FG	On-Demand	Bother	CXCR3	30	44
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3ncccn3)C2)cc1	ZINC000450765444	CF	On-Demand	Bother	SLC6A7	0	44
O=[N+]([O-])c1ccc([C@H]2CCCN(c3ncccn3)C2)cc1	ZINC000450765447	CF	On-Demand	Bother	SLC6A7	0	44
CC(=O)N[C@@H](C)C1CCN(CCC2=CCCCC2)CC1	ZINC000450765453	CG	On-Demand	Anodyne	BIRC2	45	32
CC(=O)N[C@H](C)C1CCN(CCC2=CCCCC2)CC1	ZINC000450765454	CG	On-Demand	Anodyne	BIRC2	45	32
CO[C@@H]1CCN(c2ccnc3ccc(OC(C)C)cc23)C[C@H]1C	ZINC000450765493	DH	On-Demand	Anodyne	PDE3B	58	35
CO[C@@H]1CCN(c2ccnc3ccc(OC(C)C)cc23)C[C@@H]1C	ZINC000450765497	DH	On-Demand	Anodyne	PDE3B	58	35
CO[C@H]1CCN(c2ccnc3ccc(OC(C)C)cc23)C[C@H]1C	ZINC000450765499	DH	On-Demand	Anodyne	PDE3B	58	35
CO[C@H]1CCN(c2ccnc3ccc(OC(C)C)cc23)C[C@@H]1C	ZINC000450765500	DH	On-Demand	Anodyne	PDE3B	58	35
Cc1ccc2[nH]cc(CCC(=O)NCCN3c4ccccc4NS3(=O)=O)c2c1	ZINC000450765516	GF	On-Demand	Anodyne	MPO	40	39
CCS(=O)(=O)c1ccc(CN2CCN(CC(=O)OC)CC2)cc1	ZINC000450765529	EC	On-Demand	Anodyne	MMP13	26	45
CCS(=O)(=O)c1ccc(CN2CCN(CC(=O)OC)CC2)cc1	ZINC000450765529	EC	On-Demand	Anodyne	ADAM17	29	45
CCS(=O)(=O)c1ccc(CN2CCN(CC(=O)OC)CC2)cc1	ZINC000450765529	EC	On-Demand	Anodyne	MMP9	22	42
CCS(=O)(=O)c1ccc(CN2CCN(CC(=O)OC)CC2)cc1	ZINC000450765529	EC	On-Demand	Anodyne	MMP1	22	45
CSc1ccc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450765530	DF	On-Demand	Anodyne	PDE3A	43	33
CSc1ccc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450765530	DF	On-Demand	Anodyne	PDE3B	63	33
CSc1ccc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450765530	DF	On-Demand	Anodyne	HTT	0	40
CSc1ccc2ncnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2c1	ZINC000450765534	DF	On-Demand	Anodyne	PDE3A	43	33
CSc1ccc2ncnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2c1	ZINC000450765534	DF	On-Demand	Anodyne	PDE3B	63	33
CSc1ccc2ncnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2c1	ZINC000450765534	DF	On-Demand	Anodyne	HTT	0	40
CSc1ccc2ncnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450765539	DF	On-Demand	Anodyne	PDE3A	43	33
CSc1ccc2ncnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450765539	DF	On-Demand	Anodyne	PDE3B	63	33
CSc1ccc2ncnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450765539	DF	On-Demand	Anodyne	HTT	0	40
CNc1nc(N2CC[C@H](OC)C(C)(C)C2)nc2ccccc12	ZINC000450765543	DE	On-Demand	Anodyne	CCR4	15	42
CNc1nc(N2CC[C@@H](OC)C(C)(C)C2)nc2ccccc12	ZINC000450765545	DE	On-Demand	Anodyne	CCR4	15	42
C[C@@H](O)CCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450765550	CD	On-Demand	Anodyne	CCR3	40	32
C[C@H](O)CCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450765552	CD	On-Demand	Anodyne	CCR3	40	32
CC(=O)[C@](C)(O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450765568	CD	On-Demand	Anodyne	SIGMAR1	22	49
CNC(=O)N[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450765571	DF	On-Demand	Anodyne	SIGMAR1	22	48
CNC(=O)N[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450765571	DF	On-Demand	Anodyne	MTNR1A	27	43
CNC(=O)N[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450765571	DF	On-Demand	Anodyne	MTNR1B	0	43
CNC(=O)N[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450765571	DF	On-Demand	Anodyne	BIRC2	83	39
CNC(=O)N[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450765572	DF	On-Demand	Anodyne	SIGMAR1	22	48
CNC(=O)N[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450765572	DF	On-Demand	Anodyne	MTNR1A	27	43
CNC(=O)N[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450765572	DF	On-Demand	Anodyne	MTNR1B	0	43
CNC(=O)N[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450765572	DF	On-Demand	Anodyne	BIRC2	83	39
CC(=O)[C@@](C)(O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450765589	CD	On-Demand	Anodyne	SIGMAR1	22	49
CC(=O)[C@](C)(O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450765591	CD	On-Demand	Anodyne	SIGMAR1	22	49
CC(=O)[C@@](C)(O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000450765594	CD	On-Demand	Anodyne	SIGMAR1	22	49
CC(C)CCCC(=O)N[C@H](CO)C(C)(C)C	ZINC000450765604	BE	On-Demand	Anodyne	PDF	41	33
CC(C)CCCC(=O)N[C@H](CO)C(C)(C)C	ZINC000450765604	BE	On-Demand	Anodyne	NMT1	19	40
CC(C)Oc1cncc(C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450765606	GD	On-Demand	Anodyne	DRD4	43	36
C[C@@H](O)CCN1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450765629	DI	On-Demand	Anodyne	CCR2	40	37
C[C@@H](O)CCN1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450765631	DI	On-Demand	Anodyne	CCR2	40	37
C[C@H](O)CCN1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450765633	DI	On-Demand	Anodyne	CCR2	40	37
C[C@H](O)CCN1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450765635	DI	On-Demand	Anodyne	CCR2	40	37
COc1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-]	ZINC000450765638	GF	On-Demand	Bother	COLA	60	40
COc1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-]	ZINC000450765638	GF	On-Demand	Bother	CPT1A	56	40
COc1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-]	ZINC000450765638	GF	On-Demand	Bother	CPT2	46	36
COc1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-]	ZINC000450765638	GF	On-Demand	Bother	CPT1B	45	37
COc1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-]	ZINC000450765638	GF	On-Demand	Bother	TAAR1	31	53
COc1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cc1[N+](=O)[O-]	ZINC000450765638	GF	On-Demand	Bother	WDR5	19	40
CCOC(=O)c1ccc(CN2CCC(c3ccsc3)CC2)nc1	ZINC000450765665	EH	On-Demand	Anodyne	SSTR5	42	35
COC[C@H]1CCCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450765680	FI	On-Demand	Anodyne	HTR2A	15	43
COC[C@H]1CCCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450765680	FI	On-Demand	Anodyne	SLC6A1	106	37
COC[C@H]1CCCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450765680	FI	On-Demand	Anodyne	CYP2J2	55	39
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450765681	FI	On-Demand	Anodyne	HTR2A	15	43
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450765681	FI	On-Demand	Anodyne	SLC6A1	106	37
COC[C@@H]1CCCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450765681	FI	On-Demand	Anodyne	CYP2J2	55	39
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	DRD2	23	54
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	DRD4	50	42
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	ACHE	23	42
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	CHRM3	21	41
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	VACHT_TETCF	0	45
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	SIGMAR1	37	41
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	CCR3	58	41
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	SLC18A3	31	40
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	MLNR	43	39
CC(=O)c1cccc(CN2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450765682	DI	On-Demand	Anodyne	MCHR1	43	41
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	DRD2	23	54
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	DRD4	50	42
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	ACHE	23	42
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	CHRM3	21	41
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	VACHT_TETCF	0	45
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	SIGMAR1	37	41
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	CCR3	58	41
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	SLC18A3	31	40
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	MLNR	43	39
CC(=O)c1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450765683	DI	On-Demand	Anodyne	MCHR1	43	41
CCCc1nc(C)c(NC(=O)Cc2ccc(O)c(OC)c2)s1	ZINC000450765690	DG	On-Demand	Anodyne	CAN2	0	40
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccsc3)CC2)cn1	ZINC000450765700	EI	On-Demand	Anodyne	SLC9A1	43	37
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccsc3)CC2)cn1	ZINC000450765700	EI	On-Demand	Anodyne	SFRP1	25	41
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccsc3)CC2)cn1	ZINC000450765700	EI	On-Demand	Anodyne	L3MBTL3	40	38
CC(F)(F)c1ccc(C(=O)N2CCC(c3ccsc3)CC2)cn1	ZINC000450765700	EI	On-Demand	Anodyne	NPBWR1	41	33
O=C(CCCC(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F)C1CC1	ZINC000450765701	GF	On-Demand	Anodyne	RBP4	68	38
O=C(CCCC(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F)C1CC1	ZINC000450765702	GF	On-Demand	Anodyne	RBP4	68	38
O=C1NCCN(C(=O)Cc2ccc(O)c(F)c2)[C@H]1c1ccccc1C(F)(F)F	ZINC000450765703	GF	On-Demand	Anodyne	RBP4	52	34
O=C1NCCN(C(=O)Cc2ccc(O)c(F)c2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450765704	GF	On-Demand	Anodyne	RBP4	52	34
CCCc1cc(C(=O)N(CCO)CC2CCCCC2)no1	ZINC000450765711	CF	On-Demand	Anodyne	S1PR3	0	65
CC(C)OC(C)(C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000450765712	CH	On-Demand	Anodyne	NPBWR1	49	32
Cc1[nH]c(C#N)cc1C(=O)Nc1ccccc1NCC1CCCCC1	ZINC000450765713	EI	On-Demand	Mild	CCR8	45	32
COC(=O)C1(CNC(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450765714	CE	On-Demand	Anodyne	HCN1	43	33
COC(=O)C1(CNC(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450765714	CE	On-Demand	Anodyne	HCN4	48	34
CO[C@H](Cc1ccccc1)C(=O)N(CCO)CC1CCCCC1	ZINC000450765723	DF	On-Demand	Anodyne	DEF	0	44
CO[C@H](Cc1ccccc1)C(=O)N(CCO)CC1CCCCC1	ZINC000450765723	DF	On-Demand	Anodyne	AMY2	48	33
CO[C@H](Cc1ccccc1)C(=O)N(CCO)CC1CCCCC1	ZINC000450765723	DF	On-Demand	Anodyne	REN	45	36
CO[C@@H](Cc1ccccc1)C(=O)N(CCO)CC1CCCCC1	ZINC000450765724	DF	On-Demand	Anodyne	DEF	0	44
CO[C@@H](Cc1ccccc1)C(=O)N(CCO)CC1CCCCC1	ZINC000450765724	DF	On-Demand	Anodyne	AMY2	48	33
CO[C@@H](Cc1ccccc1)C(=O)N(CCO)CC1CCCCC1	ZINC000450765724	DF	On-Demand	Anodyne	REN	45	36
CCCc1nc(C)c(NC(=O)CCc2ccc(C(N)=O)cc2)s1	ZINC000450765726	EG	On-Demand	Anodyne	VIPR1	24	40
O=C(CCc1nc2cnccc2[nH]1)Nc1ccccc1NCC1CCCCC1	ZINC000450765733	GJ	On-Demand	Anodyne	LDLR	0	40
CCCc1nc(C)c(NC(=O)c2cccc(SC)c2)s1	ZINC000450765752	DI	On-Demand	Anodyne	KCNK3	46	33
O=C([C@H]1CCCCC1(F)F)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450765755	GG	On-Demand	Anodyne	NPBWR1	23	42
O=C([C@@H]1CCCCC1(F)F)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450765756	GG	On-Demand	Anodyne	NPBWR1	23	42
C=C[C@@H]1OCC[C@H]1Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450765762	ED	On-Demand	Mild	L3MBTL1	0	42
COC(=O)C1(CNC(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450765770	DF	On-Demand	Anodyne	PPARA	18	41
COC(=O)C1(CNC(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450765770	DF	On-Demand	Anodyne	SORT1	15	40
CCOC(=O)c1cc(C(=O)N2CCC(c3ccsc3)CC2)on1	ZINC000450765780	EF	On-Demand	Anodyne	TPSAB1	24	41
Cc1[nH]c(C#N)cc1C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F	ZINC000450765781	GF	On-Demand	Mild	RBP4	62	34
Cc1[nH]c(C#N)cc1C(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F	ZINC000450765783	GF	On-Demand	Mild	RBP4	62	34
O=C(CC1(O)CCC1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000450765797	DG	On-Demand	Anodyne	UTS2R	42	29
O=C(CC1(O)CCC1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000450765799	DG	On-Demand	Anodyne	UTS2R	42	29
CCCNc1ccccc1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450765800	FH	On-Demand	Anodyne	PDE4D	15	42
CCCNc1ccccc1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450765800	FH	On-Demand	Anodyne	PDEC	0	42
O=C(CC1(O)CCC1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000450765801	DG	On-Demand	Anodyne	UTS2R	42	29
CCCNc1ccccc1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450765802	FH	On-Demand	Anodyne	PDE4D	15	42
CCCNc1ccccc1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450765802	FH	On-Demand	Anodyne	PDEC	0	42
O=C(CC1(O)CCC1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000450765803	DG	On-Demand	Anodyne	UTS2R	42	29
CC1=C(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)CCC(C)(C)C1	ZINC000450765821	GH	On-Demand	Anodyne	NPBWR1	22	40
COC(=O)C1(CN(CC(C)C)[C@H]2CCCc3cccnc32)CC1	ZINC000450765830	DG	On-Demand	Anodyne	CXCR4	83	46
COC(=O)C1(CN(CC(C)C)[C@@H]2CCCc3cccnc32)CC1	ZINC000450765831	DG	On-Demand	Anodyne	CXCR4	83	46
COc1ccc(C(=O)Nc2cccc(CCCO)c2)cc1S(C)(=O)=O	ZINC000450765836	FE	On-Demand	Anodyne	CPT1A	82	45
COc1ccc(C(=O)Nc2cccc(CCCO)c2)cc1S(C)(=O)=O	ZINC000450765836	FE	On-Demand	Anodyne	CPT2	50	38
COc1ccc(C(=O)Nc2cccc(CCCO)c2)cc1S(C)(=O)=O	ZINC000450765836	FE	On-Demand	Anodyne	CPT1B	67	39
COc1ccc(C(=O)Nc2cccc(CCCO)c2)cc1S(C)(=O)=O	ZINC000450765836	FE	On-Demand	Anodyne	TAAR1	40	40
COc1ccc(C(=O)Nc2cccc(CCCO)c2)cc1S(C)(=O)=O	ZINC000450765836	FE	On-Demand	Anodyne	KCNK3	107	41
COc1ccc(C(=O)Nc2cccc(CCCO)c2)cc1S(C)(=O)=O	ZINC000450765836	FE	On-Demand	Anodyne	KCNK9	73	40
CCOCc1nc(C)c(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)s1	ZINC000450765870	GJ	On-Demand	Anodyne	UTS2R	43	29
CCOCc1nc(C)c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)s1	ZINC000450765871	GJ	On-Demand	Anodyne	UTS2R	43	29
CCOCc1nc(C)c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)s1	ZINC000450765872	GJ	On-Demand	Anodyne	UTS2R	43	29
CCOCc1nc(C)c(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)s1	ZINC000450765873	GJ	On-Demand	Anodyne	UTS2R	43	29
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450765878	FF	On-Demand	Bother	BDKRB1	22	41
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450765878	FF	On-Demand	Bother	COLA	49	32
CC(C)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450765879	FF	On-Demand	Bother	BDKRB1	22	41
CC(C)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450765879	FF	On-Demand	Bother	COLA	49	32
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450765880	FF	On-Demand	Bother	BDKRB1	22	41
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450765880	FF	On-Demand	Bother	COLA	49	32
CC(C)[C@H](CO)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450765881	FF	On-Demand	Bother	BDKRB1	22	41
CC(C)[C@H](CO)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450765881	FF	On-Demand	Bother	COLA	49	32
COc1ccc(Cn2nnnc2SCC(=O)CC[C@@H]2CCCCO2)cc1	ZINC000450765892	GF	On-Demand	Anodyne	PDE8B	44	36
COc1ccc(Cn2nnnc2SCC(=O)CC[C@H]2CCCCO2)cc1	ZINC000450765893	GF	On-Demand	Anodyne	PDE8B	44	36
Cc1cc(C(=O)N2Cc3ccccc3C3(CC3)C2)nn1C(C)C	ZINC000450765894	DG	On-Demand	Anodyne	BCL2	24	47
CCn1ccnc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)c1=O	ZINC000450765902	EG	On-Demand	Anodyne	AKT2	20	40
CC(C)(O)CCNC(=O)COc1cccc(Br)c1C#N	ZINC000450765922	ED	On-Demand	Mild	CYSP_TRYCR	0	42
CC(=O)N1CCN(C(=O)C2CCN(c3ncc(C(C)C)s3)CC2)CC1	ZINC000450765924	FE	On-Demand	Anodyne	LUCI_LUCLA	18	42
CO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@@H]1C	ZINC000450765944	DF	On-Demand	Anodyne	PDE3A	49	38
CO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@@H]1C	ZINC000450765944	DF	On-Demand	Anodyne	PDE3B	72	39
CO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1C	ZINC000450765945	DF	On-Demand	Anodyne	PDE3A	49	38
CO[C@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1C	ZINC000450765945	DF	On-Demand	Anodyne	PDE3B	72	39
CO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1C	ZINC000450765946	DF	On-Demand	Anodyne	PDE3A	49	38
CO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1C	ZINC000450765946	DF	On-Demand	Anodyne	PDE3B	72	39
CO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@@H]1C	ZINC000450765947	DF	On-Demand	Anodyne	PDE3A	49	38
CO[C@@H]1CCN(c2ncnc3c2cnn3-c2ccccc2)C[C@@H]1C	ZINC000450765947	DF	On-Demand	Anodyne	PDE3B	72	39
CCc1nc(C)c(NC(=O)c2cc(OC)ccc2OC(F)(F)F)s1	ZINC000450765951	FI	On-Demand	Anodyne	KCNK3	19	40
CCc1nc(C)c(NC(=O)c2cc(OC)ccc2OC(F)(F)F)s1	ZINC000450765951	FI	On-Demand	Anodyne	KCNK9	25	40
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H](CO)C(C)(C)C	ZINC000450765953	DE	On-Demand	Anodyne	CTSV	53	37
CO[C@@H]1CCN(c2nc(C(C)=O)c(C)s2)C[C@@H]1C	ZINC000450765954	CF	On-Demand	Anodyne	GYRB	0	47
CO[C@H]1CCN(c2nc(C(C)=O)c(C)s2)C[C@H]1C	ZINC000450765956	CF	On-Demand	Anodyne	GYRB	0	47
CO[C@H]1CCN(c2nc(C(C)=O)c(C)s2)C[C@@H]1C	ZINC000450765958	CF	On-Demand	Anodyne	GYRB	0	47
CO[C@@H]1CCN(c2nc(C(C)=O)c(C)s2)C[C@H]1C	ZINC000450765959	CF	On-Demand	Anodyne	GYRB	0	47
Cc1ccn(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450765968	FF	On-Demand	Anodyne	MTNR1A	30	41
Cc1ccn(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450765968	FF	On-Demand	Anodyne	MTNR1B	0	41
Cc1ccn(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450765968	FF	On-Demand	Anodyne	SFRP1	56	33
Cc1ccn(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450765982	FF	On-Demand	Anodyne	MTNR1A	30	41
Cc1ccn(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450765982	FF	On-Demand	Anodyne	MTNR1B	0	41
Cc1ccn(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450765982	FF	On-Demand	Anodyne	SFRP1	56	33
CCOC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H]1CCCOC1	ZINC000450765983	FE	On-Demand	Anodyne	P2RY12	186	41
CCOC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H]1CCCOC1	ZINC000450765983	FE	On-Demand	Anodyne	CTSV	43	30
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450765989	FH	On-Demand	Anodyne	SIGMAR1	15	48
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450765989	FH	On-Demand	Anodyne	MCHR1	15	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450765989	FH	On-Demand	Anodyne	SLC12A5	44	40
CCOC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H]1CCCOC1	ZINC000450765990	FE	On-Demand	Anodyne	P2RY12	186	41
CCOC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H]1CCCOC1	ZINC000450765990	FE	On-Demand	Anodyne	CTSV	43	30
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450765992	FH	On-Demand	Anodyne	SIGMAR1	15	48
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450765992	FH	On-Demand	Anodyne	MCHR1	15	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450765992	FH	On-Demand	Anodyne	SLC12A5	44	40
CCOC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H]1CCCOC1	ZINC000450765993	FE	On-Demand	Anodyne	P2RY12	186	41
CCOC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@@H]1CCCOC1	ZINC000450765993	FE	On-Demand	Anodyne	CTSV	43	30
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450765995	FH	On-Demand	Anodyne	SIGMAR1	15	48
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450765995	FH	On-Demand	Anodyne	MCHR1	15	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450765995	FH	On-Demand	Anodyne	SLC12A5	44	40
CCOC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H]1CCCOC1	ZINC000450765996	FE	On-Demand	Anodyne	P2RY12	186	41
CCOC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)[C@H]1CCCOC1	ZINC000450765996	FE	On-Demand	Anodyne	CTSV	43	30
CO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450765998	DG	On-Demand	Bother	SERPINE1	18	40
CO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450765998	DG	On-Demand	Bother	LIPG	61	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450765999	FH	On-Demand	Anodyne	SIGMAR1	15	48
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450765999	FH	On-Demand	Anodyne	MCHR1	15	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450765999	FH	On-Demand	Anodyne	SLC12A5	44	40
CO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450766001	DG	On-Demand	Bother	SERPINE1	18	40
CO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450766001	DG	On-Demand	Bother	LIPG	61	40
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	DRD4	23	52
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	HRH2	0	44
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	HTR2A	31	50
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	HTR2C	23	54
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	SLC6A1	118	39
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	SIGMAR1	18	50
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766002	DH	On-Demand	Anodyne	CYP2J2	51	36
CC(=O)c1cn(CC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1	ZINC000450766003	GD	On-Demand	Anodyne	SFRP1	44	33
CO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450766004	DG	On-Demand	Bother	SERPINE1	18	40
CO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450766004	DG	On-Demand	Bother	LIPG	61	40
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	DRD4	23	52
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	HRH2	0	44
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	HTR2A	31	50
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	HTR2C	23	54
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	SLC6A1	118	39
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	SIGMAR1	18	50
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@H](OCC2CC2)C1)c1ccc(F)cc1	ZINC000450766005	DH	On-Demand	Anodyne	CYP2J2	51	36
CC(=O)c1cn(CC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)nn1	ZINC000450766006	GD	On-Demand	Anodyne	SFRP1	44	33
CO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450766007	DG	On-Demand	Bother	SERPINE1	18	40
CO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450766007	DG	On-Demand	Bother	LIPG	61	40
COCCC1(CNC(=O)c2ccsc2C)CCCCC1	ZINC000450766015	CH	On-Demand	Anodyne	P2RX7	16	41
COCCC1(CNC(=O)c2ccsc2C)CCCCC1	ZINC000450766015	CH	On-Demand	Anodyne	KCNA3	41	35
COCCC1(CNC(=O)c2ccsc2C)CCCCC1	ZINC000450766015	CH	On-Demand	Anodyne	SLC6A9	19	43
COCCC1(CNC(=O)c2ccsc2C)CCCCC1	ZINC000450766015	CH	On-Demand	Anodyne	HCN1	65	41
COCCC1(CNC(=O)c2ccsc2C)CCCCC1	ZINC000450766015	CH	On-Demand	Anodyne	HCN4	57	37
COC(=O)COc1ccc([C@H](C)NCc2cccc(C)n2)cc1	ZINC000450766021	DF	On-Demand	Anodyne	ACACA	45	34
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(F)cn3)C2)CC1	ZINC000450766028	ED	On-Demand	Anodyne	CCR3	59	34
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(F)cn3)C2)CC1	ZINC000450766028	ED	On-Demand	Anodyne	SLC27A1	51	44
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(F)cn3)C2)CC1	ZINC000450766030	ED	On-Demand	Anodyne	CCR3	59	34
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(F)cn3)C2)CC1	ZINC000450766030	ED	On-Demand	Anodyne	SLC27A1	51	44
COC(=O)COc1ccc([C@@H](C)NCc2cccc(C)n2)cc1	ZINC000450766034	DF	On-Demand	Anodyne	ACACA	45	34
COc1cccc(OCCC(=O)N[C@@H](C)C2=CCN(C)CC2)c1	ZINC000450766038	DE	On-Demand	Anodyne	DRD4	44	33
COc1cccc(OCCC(=O)N[C@H](C)C2=CCN(C)CC2)c1	ZINC000450766041	DE	On-Demand	Anodyne	DRD4	44	33
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCCC2)C[C@H]1C	ZINC000450766048	EG	On-Demand	Anodyne	PDE3B	55	37
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCCC2)C[C@H]1C	ZINC000450766050	EG	On-Demand	Anodyne	PDE3B	55	37
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCCC2)C[C@@H]1C	ZINC000450766052	EG	On-Demand	Anodyne	PDE3B	55	37
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C(F)(F)F)ccn3)C2)CC1	ZINC000450766053	GF	On-Demand	Anodyne	CCR2	21	45
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C(F)(F)F)ccn3)C2)CC1	ZINC000450766053	GF	On-Demand	Anodyne	LIPG	49	33
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCCC2)C[C@@H]1C	ZINC000450766054	EG	On-Demand	Anodyne	PDE3B	55	37
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C(F)(F)F)ccn3)C2)CC1	ZINC000450766055	GF	On-Demand	Anodyne	CCR2	21	45
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C(F)(F)F)ccn3)C2)CC1	ZINC000450766055	GF	On-Demand	Anodyne	LIPG	49	33
CO[C@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1(C)C	ZINC000450766063	GD	On-Demand	Anodyne	GCK	55	32
CO[C@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1(C)C	ZINC000450766063	GD	On-Demand	Anodyne	GCKR	57	39
COC(=O)CN1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450766068	ED	On-Demand	Anodyne	P2RY12	85	34
COC(=O)CN1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450766068	ED	On-Demand	Anodyne	TACR3	29	53
CO[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1(C)C	ZINC000450766070	GD	On-Demand	Anodyne	GCK	55	32
CO[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1(C)C	ZINC000450766070	GD	On-Demand	Anodyne	GCKR	57	39
FC(F)(F)c1nnc(N2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450766077	GG	On-Demand	Anodyne	SCD1	38	48
FC(F)(F)c1nnc(N2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450766077	GG	On-Demand	Anodyne	SCD	22	48
O=C(CCCC(=O)C1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766089	FH	On-Demand	Anodyne	MTNR1A	29	43
O=C(CCCC(=O)C1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766089	FH	On-Demand	Anodyne	MTNR1B	0	43
O=C(CCCC(=O)C1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766089	FH	On-Demand	Anodyne	RBP4	51	37
O=C(CCCC(=O)C1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766089	FH	On-Demand	Anodyne	SFRP1	92	39
O=C(CCCC(=O)C1CC1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766089	FH	On-Demand	Anodyne	WNT3	65	34
O=C(CCCC(=O)C1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766092	FH	On-Demand	Anodyne	MTNR1A	29	43
O=C(CCCC(=O)C1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766092	FH	On-Demand	Anodyne	MTNR1B	0	43
O=C(CCCC(=O)C1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766092	FH	On-Demand	Anodyne	RBP4	51	37
O=C(CCCC(=O)C1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766092	FH	On-Demand	Anodyne	SFRP1	92	39
O=C(CCCC(=O)C1CC1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450766092	FH	On-Demand	Anodyne	WNT3	65	34
COc1ccc2c(c1)[C@@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766093	GE	On-Demand	Anodyne	DRD4	42	35
COc1ccc2c(c1)[C@@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766093	GE	On-Demand	Anodyne	NQO2	42	43
COc1ccc2c(c1)[C@@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766093	GE	On-Demand	Anodyne	MTR1B_CHICK	0	42
COc1ccc2c(c1)[C@@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766093	GE	On-Demand	Anodyne	MTNR1A	31	43
COc1ccc2c(c1)[C@@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766093	GE	On-Demand	Anodyne	MTNR1B	27	43
COCCC1(CNC(=O)C[C@H]2CSc3ccccc3O2)CCCCC1	ZINC000450766103	FI	On-Demand	Anodyne	HCN1	49	32
COCCC1(CNC(=O)C[C@H]2CSc3ccccc3O2)CCCCC1	ZINC000450766103	FI	On-Demand	Anodyne	HCN4	47	32
COc1ccc2c(c1)[C@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766105	GE	On-Demand	Anodyne	DRD4	42	35
COc1ccc2c(c1)[C@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766105	GE	On-Demand	Anodyne	NQO2	42	43
COc1ccc2c(c1)[C@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766105	GE	On-Demand	Anodyne	MTR1B_CHICK	0	42
COc1ccc2c(c1)[C@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766105	GE	On-Demand	Anodyne	MTNR1A	31	43
COc1ccc2c(c1)[C@H](C(=O)NCCN1c3ccccc3NS1(=O)=O)CC2	ZINC000450766105	GE	On-Demand	Anodyne	MTNR1B	27	43
COCCC1(CNC(=O)C[C@@H]2CSc3ccccc3O2)CCCCC1	ZINC000450766111	FI	On-Demand	Anodyne	HCN1	49	32
COCCC1(CNC(=O)C[C@@H]2CSc3ccccc3O2)CCCCC1	ZINC000450766111	FI	On-Demand	Anodyne	HCN4	47	32
CO[C@H]1CCN(c2cc(C)nc3ccc(F)cc23)CC1(C)C	ZINC000450766114	DH	On-Demand	Anodyne	GYRB	0	52
CO[C@@H]1CCN(c2cc(C)nc3ccc(F)cc23)CC1(C)C	ZINC000450766119	DH	On-Demand	Anodyne	GYRB	0	52
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1-c1ccc(C#N)cc1	ZINC000450766121	GI	On-Demand	Mild	CCKBR	18	41
CC(=O)CCCCCSc1nc2ccccc2c(=O)n1-c1ccc(C#N)cc1	ZINC000450766121	GI	On-Demand	Mild	CXCR3	24	51
COc1ccc(NC(=O)C2CC(C)(O)C2)cc1[N+](=O)[O-]	ZINC000450766139	CD	On-Demand	Bother	KCNMA1	19	41
CCS[C@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766141	GG	On-Demand	Anodyne	MTR1B_CHICK	0	42
CCS[C@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766141	GG	On-Demand	Anodyne	MTNR1A	58	37
CCS[C@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766141	GG	On-Demand	Anodyne	MTNR1B	46	37
CCS[C@@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766142	GG	On-Demand	Anodyne	MTR1B_CHICK	0	42
CCS[C@@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766142	GG	On-Demand	Anodyne	MTNR1A	58	37
CCS[C@@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766142	GG	On-Demand	Anodyne	MTNR1B	46	37
CCS[C@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766143	GG	On-Demand	Anodyne	MTR1B_CHICK	0	42
CCS[C@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766143	GG	On-Demand	Anodyne	MTNR1A	58	37
CCS[C@H]1CCCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766143	GG	On-Demand	Anodyne	MTNR1B	46	37
CCS[C@@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766145	GG	On-Demand	Anodyne	MTR1B_CHICK	0	42
CCS[C@@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766145	GG	On-Demand	Anodyne	MTNR1A	58	37
CCS[C@@H]1CCCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450766145	GG	On-Demand	Anodyne	MTNR1B	46	37
COC(=O)CN1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450766150	DD	On-Demand	Anodyne	ACE	40	37
COC(=O)CN1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450766150	DD	On-Demand	Anodyne	MME	31	40
COC(=O)CN1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450766150	DD	On-Demand	Anodyne	ABCB1	49	38
COC(=O)CN1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450766151	DD	On-Demand	Anodyne	ACE	40	37
COC(=O)CN1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450766151	DD	On-Demand	Anodyne	MME	31	40
COC(=O)CN1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450766151	DD	On-Demand	Anodyne	ABCB1	49	38
COC[C@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766169	FE	On-Demand	Anodyne	DRD2	17	40
COC[C@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766169	FE	On-Demand	Anodyne	DRD4	40	31
COC[C@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766169	FE	On-Demand	Anodyne	HTR7	29	41
COC[C@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766169	FE	On-Demand	Anodyne	MTNR1A	51	36
COC[C@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766169	FE	On-Demand	Anodyne	MTNR1B	44	38
COC[C@@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766171	FE	On-Demand	Anodyne	DRD2	17	40
COC[C@@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766171	FE	On-Demand	Anodyne	DRD4	40	31
COC[C@@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766171	FE	On-Demand	Anodyne	HTR7	29	41
COC[C@@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766171	FE	On-Demand	Anodyne	MTNR1A	51	36
COC[C@@H]1CCCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450766171	FE	On-Demand	Anodyne	MTNR1B	44	38
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C1=CCN(C)CC1	ZINC000450766176	DD	On-Demand	Anodyne	HPGDS	15	42
C=CCN(C)Cc1ccc(C(=O)OCC)cn1	ZINC000450766177	BD	On-Demand	Mild	SHC	25	42
C=CCN(C)Cc1ccc(C(=O)OCC)cn1	ZINC000450766177	BD	On-Demand	Mild	LSS	49	42
Cc1cccc(Cl)c1C(=O)N1CCN(S(=O)(=O)c2nc[nH]n2)CC1	ZINC000450766180	FC	On-Demand	Anodyne	REN	23	41
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)C1=CCN(C)CC1	ZINC000450766184	DD	On-Demand	Anodyne	HPGDS	15	42
CC(C)C[C@@H](C)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450766198	ED	On-Demand	Anodyne	FCER2	42	34
CC(C)C[C@@H](C)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450766198	ED	On-Demand	Anodyne	CAPN2	53	32
COc1cc(CC(=O)NCCCCCS(C)(=O)=O)ccc1Cl	ZINC000450766199	EE	On-Demand	Anodyne	CAN2	0	50
CCN1C[C@@H](Nc2ccc(C(=O)N3CCC(C)CC3)cn2)CC1=O	ZINC000450766203	ED	On-Demand	Anodyne	L3MBTL3	47	33
CCN1C[C@H](Nc2ccc(C(=O)N3CCC(C)CC3)cn2)CC1=O	ZINC000450766204	ED	On-Demand	Anodyne	L3MBTL3	47	33
CC(C)C[C@H](C)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450766205	ED	On-Demand	Anodyne	FCER2	42	34
CC(C)C[C@H](C)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450766205	ED	On-Demand	Anodyne	CAPN2	53	32
Cc1cccc(Cl)c1CNC(C)(C)c1nc2ccccc2n1C	ZINC000450766222	EJ	On-Demand	Anodyne	EIF2AK1	42	36
CCOC(=O)c1ccc(N2CC[C@@H](c3nc(C)no3)C2)nc1	ZINC000450766226	DD	On-Demand	Anodyne	ETHR	47	35
CCOC(=O)c1ccc(N2CC[C@H](c3nc(C)no3)C2)nc1	ZINC000450766228	DD	On-Demand	Anodyne	ETHR	47	35
O=[N+]([O-])c1ccc([C@H]2CCCN(c3ccccn3)C2)cc1	ZINC000450766229	CG	On-Demand	Bother	EBP	27	43
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3ccccn3)C2)cc1	ZINC000450766231	CG	On-Demand	Bother	EBP	27	43
COc1ccc(CN2CCCN(CC[C@H](C)O)CC2=O)cc1	ZINC000450766235	DD	On-Demand	Anodyne	MMP1	15	41
COc1ccc(CN2CCCN(CC[C@@H](C)O)CC2=O)cc1	ZINC000450766237	DD	On-Demand	Anodyne	MMP1	15	41
CCC(=O)CCCN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450766260	CF	On-Demand	Anodyne	SIGMAR1	31	62
CCC(=O)CCCN1CC[C@@]2(C1)OCc1ccccc12	ZINC000450766260	CF	On-Demand	Anodyne	SLC18A3	49	43
CCC(=O)CCCN1CC[C@]2(C1)OCc1ccccc12	ZINC000450766261	CF	On-Demand	Anodyne	SIGMAR1	31	62
CCC(=O)CCCN1CC[C@]2(C1)OCc1ccccc12	ZINC000450766261	CF	On-Demand	Anodyne	SLC18A3	49	43
CO[C@@H]1CCN(c2ncnc3cccc(I)c23)CC1(C)C	ZINC000450766264	GG	On-Demand	Anodyne	PDE3A	45	34
CO[C@@H]1CCN(c2ncnc3cccc(I)c23)CC1(C)C	ZINC000450766264	GG	On-Demand	Anodyne	PDE3B	67	34
CO[C@H]1CCN(c2ncnc3cccc(I)c23)CC1(C)C	ZINC000450766265	GG	On-Demand	Anodyne	PDE3A	45	34
CO[C@H]1CCN(c2ncnc3cccc(I)c23)CC1(C)C	ZINC000450766265	GG	On-Demand	Anodyne	PDE3B	67	34
O=C(CC1CC(F)(F)C1)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450766287	EI	On-Demand	Anodyne	ACAT	0	44
CC[C@@](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)(C(N)=O)C(C)C	ZINC000450766319	DE	On-Demand	Anodyne	MTNR1B	24	40
CC[C@@](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)(C(N)=O)C(C)C	ZINC000450766319	DE	On-Demand	Anodyne	GPR88	0	48
CCCc1nc(C)c(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])s1	ZINC000450766320	FJ	On-Demand	Bother	SORT1	15	42
CCCNc1ccccc1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450766325	GH	On-Demand	Anodyne	HDAC1	23	41
CCCNc1ccccc1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450766325	GH	On-Demand	Anodyne	DGAT1	27	40
CCOC(=O)C[C@@](C)(NCc1ccc(S(=O)(=O)CC)cc1)C(C)C	ZINC000450766326	FF	On-Demand	Anodyne	PTPRB	18	41
CCOC(=O)C[C@](C)(NCc1ccc(S(=O)(=O)CC)cc1)C(C)C	ZINC000450766327	FF	On-Demand	Anodyne	PTPRB	18	41
CC[C@H]1CCC[C@@H]1C(=O)N1CCC(c2ccsc2)CC1	ZINC000450766328	CI	On-Demand	Anodyne	NPBWR1	70	36
CC[C@@H]1CCC[C@@H]1C(=O)N1CCC(c2ccsc2)CC1	ZINC000450766329	CI	On-Demand	Anodyne	NPBWR1	94	36
CC[C@@H]1CCC[C@H]1C(=O)N1CCC(c2ccsc2)CC1	ZINC000450766330	CI	On-Demand	Anodyne	NPBWR1	94	36
CC[C@H]1CCC[C@H]1C(=O)N1CCC(c2ccsc2)CC1	ZINC000450766331	CI	On-Demand	Anodyne	NPBWR1	94	36
CC[C@](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)(C(N)=O)C(C)C	ZINC000450766363	GG	On-Demand	Anodyne	CPT1A	45	31
CC[C@](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)(C(N)=O)C(C)C	ZINC000450766363	GG	On-Demand	Anodyne	PLK1	72	37
CC[C@](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)(C(N)=O)C(C)C	ZINC000450766363	GG	On-Demand	Anodyne	PLK3	40	36
CC[C@](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)(C(N)=O)C(C)C	ZINC000450766363	GG	On-Demand	Anodyne	HPGD	45	54
CC[C@@](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)(C(N)=O)C(C)C	ZINC000450766364	GG	On-Demand	Anodyne	CPT1A	45	31
CC[C@@](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)(C(N)=O)C(C)C	ZINC000450766364	GG	On-Demand	Anodyne	PLK1	72	37
CC[C@@](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)(C(N)=O)C(C)C	ZINC000450766364	GG	On-Demand	Anodyne	PLK3	40	36
CC[C@@](NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC)(C(N)=O)C(C)C	ZINC000450766364	GG	On-Demand	Anodyne	HPGD	45	54
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	DRD2	33	46
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	DRD1	17	50
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	HTR2A	24	54
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	HTR2C	25	52
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	ERG2	21	45
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	HTR7	15	45
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	HTR5A	17	54
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	SLC18A3	0	54
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	HTR3B	0	50
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	CYP2J2	53	38
O=C(CCCN1CCS(=O)(=O)c2ccccc2C1)c1ccc(F)cc1	ZINC000450766375	FG	On-Demand	Anodyne	AP2S1	0	45
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c([N+](=O)[O-])c1	ZINC000450766379	GD	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450766383	GD	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450766385	GD	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@@H](C)NC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450766388	GD	On-Demand	Bother	TAAR1	20	44
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1CCCC(=O)c1ccccc1	ZINC000450766392	EF	On-Demand	Anodyne	CYP2J2	50	38
CCOC(=O)C[C@H]1C[C@@H](OC)CN1CCCC(=O)c1ccccc1	ZINC000450766393	EF	On-Demand	Anodyne	CYP2J2	50	38
CCOC(=O)C[C@@H]1C[C@H](OC)CN1CCCC(=O)c1ccccc1	ZINC000450766394	EF	On-Demand	Anodyne	CYP2J2	50	38
CCOC(=O)C[C@H]1C[C@H](OC)CN1CCCC(=O)c1ccccc1	ZINC000450766395	EF	On-Demand	Anodyne	CYP2J2	50	38
CCCNc1ccccc1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450766408	FI	On-Demand	Bother	CACNA1D	47	31
O=C(CC1(O)CCC1)NCC1(c2ccc(F)cc2F)CCCC1	ZINC000450766410	DG	On-Demand	Anodyne	ACAT	0	46
CC(=O)c1cccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)c1	ZINC000450766419	EI	On-Demand	Anodyne	DRD2	16	41
CC(=O)c1cccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)c1	ZINC000450766419	EI	On-Demand	Anodyne	DRD4	35	45
CC(=O)c1cccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)c1	ZINC000450766419	EI	On-Demand	Anodyne	CCR3	55	40
CC(=O)c1cccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)c1	ZINC000450766419	EI	On-Demand	Anodyne	MLNR	43	36
CC(=O)c1cccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)c1	ZINC000450766420	EI	On-Demand	Anodyne	DRD2	16	41
CC(=O)c1cccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)c1	ZINC000450766420	EI	On-Demand	Anodyne	DRD4	35	45
CC(=O)c1cccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)c1	ZINC000450766420	EI	On-Demand	Anodyne	CCR3	55	40
CC(=O)c1cccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)c1	ZINC000450766420	EI	On-Demand	Anodyne	MLNR	43	36
O=C(NCC1(c2ccc(F)cc2F)CCCC1)C1(CF)CCOCC1	ZINC000450766422	FH	On-Demand	Anodyne	ACAT	0	43
Cc1cc(N[C@@H](C2CC2)[C@H](CO)C2CC2)nc(-c2cccnc2)n1	ZINC000450766456	DE	On-Demand	Anodyne	ROS1	55	36
Cc1cc(N[C@H](C2CC2)[C@@H](CO)C2CC2)nc(-c2cccnc2)n1	ZINC000450766457	DE	On-Demand	Anodyne	ROS1	55	36
Cc1cc(N[C@H](C2CC2)[C@H](CO)C2CC2)nc(-c2cccnc2)n1	ZINC000450766458	DE	On-Demand	Anodyne	ROS1	55	36
Cc1cc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)nc(-c2cccnc2)n1	ZINC000450766459	DE	On-Demand	Anodyne	ROS1	55	36
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C[C@@H]1CCCO1	ZINC000450766481	CE	On-Demand	Anodyne	OXTR	27	43
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C[C@@H]1CCCO1	ZINC000450766481	CE	On-Demand	Anodyne	AVPR1A	0	41
C[C@@H](c1ccccc1)[C@H](O)CN(C)C[C@@H]1CCCO1	ZINC000450766482	CE	On-Demand	Anodyne	OXTR	27	43
C[C@@H](c1ccccc1)[C@H](O)CN(C)C[C@@H]1CCCO1	ZINC000450766482	CE	On-Demand	Anodyne	AVPR1A	0	41
COC(=O)c1coc(CN(CC(C)C)[C@H]2CCCc3cccnc32)n1	ZINC000450766492	EG	On-Demand	Anodyne	CXCR4	85	47
COC(=O)c1coc(CN(CC(C)C)[C@@H]2CCCc3cccnc32)n1	ZINC000450766493	EG	On-Demand	Anodyne	CXCR4	85	47
CCC1(CC)CCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)CC1	ZINC000450766498	DH	On-Demand	Anodyne	RIR1_HHV11	41	33
CC(C)CN(Cc1ccn(CC(F)(F)F)n1)[C@H]1CCCc2cccnc21	ZINC000450766507	FI	On-Demand	Anodyne	CXCR4	86	46
CC(C)CN(Cc1ccn(CC(F)(F)F)n1)[C@@H]1CCCc2cccnc21	ZINC000450766508	FI	On-Demand	Anodyne	CXCR4	86	46
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450766509	FE	On-Demand	Bother	COLA	91	39
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450766511	FE	On-Demand	Bother	COLA	91	39
CC(C)c1nnc(CN2CCC(c3ccc(Cl)cc3)CC2)s1	ZINC000450766513	EJ	On-Demand	Anodyne	CCR1	41	38
COC(=O)CN1CCN(C(=O)Cc2ccc(C(=O)OC)cc2)CC1	ZINC000450766535	EC	On-Demand	Anodyne	GPR183	0	41
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H]2CCCC[C@H]12	ZINC000450766536	CF	On-Demand	Anodyne	ENPP2	16	40
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@@H]2CCCC[C@H]12	ZINC000450766539	CF	On-Demand	Anodyne	ENPP2	16	40
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@H]2CCCC[C@@H]12	ZINC000450766540	CF	On-Demand	Anodyne	ENPP2	16	40
C[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)[C@@H]2CCCC[C@@H]12	ZINC000450766542	CF	On-Demand	Anodyne	ENPP2	16	40
COC(=O)CN1CCN(C(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CC1	ZINC000450766548	GC	On-Demand	Anodyne	P2RY12	47	33
COC(=O)CN1CCN(C(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CC1	ZINC000450766549	GC	On-Demand	Anodyne	P2RY12	47	33
Cc1nc2c3ccccc3nc(SC3CC(OC(C)(C)C)C3)n2n1	ZINC000450766558	EI	On-Demand	Anodyne	PDE10A	15	51
COc1ccc(NC(=O)c2c3n(c(=O)n2C)CCCC3)cc1[N+](=O)[O-]	ZINC000450766562	ED	On-Demand	Bother	TAAR1	19	44
O=C(Nc1cccc(CCCO)c1)c1nc2ccccc2nc1C1CC1	ZINC000450766577	EH	On-Demand	Anodyne	KCNK3	44	34
COC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450766609	FE	On-Demand	Anodyne	CNR1	15	57
COC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450766609	FE	On-Demand	Anodyne	MC4R	24	40
COC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450766609	FE	On-Demand	Anodyne	NPBWR1	42	34
N#CCC1(O)CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450766611	EE	On-Demand	Mild	PDE6D	58	38
N#CCC1(O)CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450766611	EE	On-Demand	Mild	IMDH_CRYPV	31	47
O=C(CC1(O)CCC1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450766627	DF	On-Demand	Anodyne	ETHR	40	32
COc1cccc(Oc2ccc(C(=O)N[C@H](CO)C(C)(C)C)nc2)c1	ZINC000450766658	EG	On-Demand	Anodyne	MTNR1B	28	44
CC(C)(C)[C@@H](CO)NC(=O)c1cccc(C#N)c1Br	ZINC000450766663	EE	On-Demand	Mild	CTRB_BOVIN	47	34
CC(C)(C)[C@@H](CO)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450766668	DD	On-Demand	Anodyne	PDE4D	15	42
CC(C)(C)[C@@H](CO)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450766669	DD	On-Demand	Anodyne	PDE4D	15	42
CCOC(=O)c1ccc(CN2CC[C@@]3(C2)OCc2ccccc23)nc1	ZINC000450766677	EF	On-Demand	Anodyne	SLC18A3	0	41
CCN1C[C@@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766678	FG	On-Demand	Anodyne	F10	28	40
CCN1C[C@@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766678	FG	On-Demand	Anodyne	PRNP	26	42
CCN1C[C@@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766678	FG	On-Demand	Anodyne	GRM5	20	42
CCN1C[C@@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766678	FG	On-Demand	Anodyne	TAAR1	31	45
CCN1C[C@@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766678	FG	On-Demand	Anodyne	KCNK3	50	36
CCOC(=O)c1ccc(CN2CC[C@]3(C2)OCc2ccccc23)nc1	ZINC000450766679	EF	On-Demand	Anodyne	SLC18A3	0	41
CCN1C[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766680	FG	On-Demand	Anodyne	F10	28	40
CCN1C[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766680	FG	On-Demand	Anodyne	PRNP	26	42
CCN1C[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766680	FG	On-Demand	Anodyne	GRM5	20	42
CCN1C[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766680	FG	On-Demand	Anodyne	TAAR1	31	45
CCN1C[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1=O	ZINC000450766680	FG	On-Demand	Anodyne	KCNK3	50	36
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1cccs1	ZINC000450766693	CG	On-Demand	Anodyne	DRD2	15	44
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1cccs1	ZINC000450766693	CG	On-Demand	Anodyne	KCNH2	17	44
Cn1c(SCC[C@H]2CCOC2)nnc1-c1cccs1	ZINC000450766694	CG	On-Demand	Anodyne	DRD2	15	44
Cn1c(SCC[C@H]2CCOC2)nnc1-c1cccs1	ZINC000450766694	CG	On-Demand	Anodyne	KCNH2	17	44
COC[C@@H]1CCCCN(CCN(C)Cc2ccccc2)C1	ZINC000450766700	CF	On-Demand	Anodyne	SLC6A1	100	37
COC[C@@H]1CCCCN(CCN(C)Cc2ccccc2)C1	ZINC000450766700	CF	On-Demand	Anodyne	SIGMAR1	31	43
COC[C@H]1CCCCN(CCN(C)Cc2ccccc2)C1	ZINC000450766701	CF	On-Demand	Anodyne	SLC6A1	100	37
COC[C@H]1CCCCN(CCN(C)Cc2ccccc2)C1	ZINC000450766701	CF	On-Demand	Anodyne	SIGMAR1	31	43
CC(C)(O)CCNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450766712	ED	On-Demand	Anodyne	PDE8B	51	32
CC(C)(O)CCNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450766714	ED	On-Demand	Anodyne	PDE8B	51	32
Cc1ccc(F)c(CC(=O)NCCC(C)(C)O)c1	ZINC000450766716	CD	On-Demand	Anodyne	P2RX7	22	40
CN(CCN1CC[C@@]2(C1)OCc1ccccc12)Cc1ccccc1	ZINC000450766735	DG	On-Demand	Anodyne	SIGMAR1	24	46
CN(CCN1CC[C@]2(C1)OCc1ccccc12)Cc1ccccc1	ZINC000450766737	DG	On-Demand	Anodyne	SIGMAR1	24	46
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(Cl)cc3C#N)CC2)CC1	ZINC000450766738	FE	On-Demand	Mild	MC4R	45	38
O=C(NCCN1c2ccccc2NS1(=O)=O)c1ccc(OC2CCC2)cc1	ZINC000450766741	GF	On-Demand	Anodyne	PLD1	46	39
O=C(NCCN1c2ccccc2NS1(=O)=O)c1ccc(OC2CCC2)cc1	ZINC000450766741	GF	On-Demand	Anodyne	PLD2	41	35
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450766754	DF	On-Demand	Anodyne	DRD2	28	40
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450766754	DF	On-Demand	Anodyne	DRD4	0	43
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450766754	DF	On-Demand	Anodyne	SLC18A3	0	41
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450766754	DF	On-Demand	Anodyne	HTR3B	0	42
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450766754	DF	On-Demand	Anodyne	CYP2J2	51	37
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4cccc(C)c34)CC2)CC1	ZINC000450766779	GD	On-Demand	Anodyne	AKT1	22	54
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4cccc(C)c34)CC2)CC1	ZINC000450766779	GD	On-Demand	Anodyne	SIRT3	56	33
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4cccc(C)c34)CC2)CC1	ZINC000450766779	GD	On-Demand	Anodyne	SIRT2	50	33
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4cccc(C)c34)CC2)CC1	ZINC000450766779	GD	On-Demand	Anodyne	SIRT1	44	33
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4cccc(C)c34)CC2)CC1	ZINC000450766779	GD	On-Demand	Anodyne	LIMK2	39	45
CSc1cccc(C(=O)NCCC(C)(C)O)c1	ZINC000450766781	CE	On-Demand	Anodyne	DRD4	42	32
FC1(Cc2ccc(Cl)cc2)CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450766813	GH	On-Demand	Anodyne	SMG1	30	40
CCOC(=O)CN(Cc1ccc(S(=O)(=O)CC)cc1)C1CCC1	ZINC000450766821	EE	On-Demand	Anodyne	RORC	17	43
CO[C@@H]1CCN(c2ncnc3c2CN(C)CC3)C[C@H]1C	ZINC000450766825	CD	On-Demand	Anodyne	PDE3A	43	33
CO[C@@H]1CCN(c2ncnc3c2CN(C)CC3)C[C@H]1C	ZINC000450766825	CD	On-Demand	Anodyne	PDE3B	64	33
CO[C@H]1CCN(c2ncnc3c2CN(C)CC3)C[C@@H]1C	ZINC000450766837	CD	On-Demand	Anodyne	PDE3A	43	33
CO[C@H]1CCN(c2ncnc3c2CN(C)CC3)C[C@@H]1C	ZINC000450766837	CD	On-Demand	Anodyne	PDE3B	64	33
CO[C@H]1CCN(c2ncnc3c2CN(C)CC3)C[C@H]1C	ZINC000450766839	CD	On-Demand	Anodyne	PDE3A	43	33
CO[C@H]1CCN(c2ncnc3c2CN(C)CC3)C[C@H]1C	ZINC000450766839	CD	On-Demand	Anodyne	PDE3B	64	33
CO[C@@H]1CCN(c2ncnc3c2CN(C)CC3)C[C@@H]1C	ZINC000450766841	CD	On-Demand	Anodyne	PDE3A	43	33
CO[C@@H]1CCN(c2ncnc3c2CN(C)CC3)C[C@@H]1C	ZINC000450766841	CD	On-Demand	Anodyne	PDE3B	64	33
Cc1ccc(F)c(CC(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)c1	ZINC000450766842	GE	On-Demand	Anodyne	ADRA1D	45	36
CO[C@@H]1CCN(c2nccc(C)n2)C[C@@H]1C	ZINC000450766857	BD	On-Demand	Anodyne	SORD	20	40
CO[C@H]1CCN(c2nccc(C)n2)C[C@H]1C	ZINC000450766859	BD	On-Demand	Anodyne	SORD	20	40
COc1ccc(CNC(=O)CCSc2nnnn2C2CC2)c(OC)c1	ZINC000450766868	FD	On-Demand	Anodyne	PDGFRB	30	40
CO[C@@H]1CCN(c2nccc(C)n2)C[C@H]1C	ZINC000450766870	BD	On-Demand	Anodyne	SORD	20	40
CO[C@H]1CCN(c2nccc(C)n2)C[C@@H]1C	ZINC000450766875	BD	On-Demand	Anodyne	SORD	20	40
CCOc1nc2ccc(C(=O)NCCC(C)(C)O)cc2[nH]1	ZINC000450766905	CD	On-Demand	Anodyne	KCNQ1	0	41
COC(=O)C1(CSc2nnnn2Cc2ccc(OC)cc2)CCCC1	ZINC000450766907	FF	On-Demand	Anodyne	PROKR1	51	31
N#Cc1nccnc1N1CCC(F)(Cc2ccc(Cl)cc2)CC1	ZINC000450766908	EH	On-Demand	Mild	AKT2	19	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450766930	EC	On-Demand	Anodyne	DRD4	23	43
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450766930	EC	On-Demand	Anodyne	SIGMAR1	26	42
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450766930	EC	On-Demand	Anodyne	SSTR5	42	39
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450766930	EC	On-Demand	Anodyne	CCR3	27	50
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450766930	EC	On-Demand	Anodyne	MLNR	43	35
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450766930	EC	On-Demand	Anodyne	MCHR1	30	46
CCS(=O)(=O)c1ccc(CN2CC[C@@H](NC(=O)NC)C2)cc1	ZINC000450766930	EC	On-Demand	Anodyne	BIRC2	46	33
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450766941	EC	On-Demand	Anodyne	DRD4	23	43
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450766941	EC	On-Demand	Anodyne	SIGMAR1	26	42
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450766941	EC	On-Demand	Anodyne	SSTR5	42	39
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450766941	EC	On-Demand	Anodyne	CCR3	27	50
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450766941	EC	On-Demand	Anodyne	MLNR	43	35
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450766941	EC	On-Demand	Anodyne	MCHR1	30	46
CCS(=O)(=O)c1ccc(CN2CC[C@H](NC(=O)NC)C2)cc1	ZINC000450766941	EC	On-Demand	Anodyne	BIRC2	46	33
CO[C@@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450766981	DG	On-Demand	Bother	GYRB	15	51
CO[C@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450766982	DG	On-Demand	Bother	GYRB	15	51
CO[C@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C[C@@H]1C	ZINC000450766983	DG	On-Demand	Bother	GYRB	15	51
CO[C@@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)C[C@H]1C	ZINC000450766984	DG	On-Demand	Bother	GYRB	15	51
COc1cc(CN2CCO[C@H](COCC3CC3)C2)ccc1Cl	ZINC000450766990	EF	On-Demand	Anodyne	DRD4	24	64
COc1cc(CN2CCO[C@H](COCC3CC3)C2)ccc1Cl	ZINC000450766990	EF	On-Demand	Anodyne	SSTR5	40	35
COc1cc(CN2CCO[C@@H](COCC3CC3)C2)ccc1Cl	ZINC000450766992	EF	On-Demand	Anodyne	DRD4	24	64
COc1cc(CN2CCO[C@@H](COCC3CC3)C2)ccc1Cl	ZINC000450766992	EF	On-Demand	Anodyne	SSTR5	40	35
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450767008	DG	On-Demand	Anodyne	SIGMAR1	15	43
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450767010	DG	On-Demand	Anodyne	SIGMAR1	15	43
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450767012	DG	On-Demand	Anodyne	SIGMAR1	15	43
CCC[C@H]1CCC[C@H]1C(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450767013	DG	On-Demand	Anodyne	SIGMAR1	15	43
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(-n2cnc(N(C)C)n2)c1	ZINC000450767060	FF	On-Demand	Anodyne	GPR142	52	35
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(-n2cnc(N(C)C)n2)c1	ZINC000450767061	FF	On-Demand	Anodyne	GPR142	52	35
COc1ccc(NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)cc1[N+](=O)[O-]	ZINC000450767066	CF	On-Demand	Bother	ENPP1	41	31
COc1ccc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)cc1[N+](=O)[O-]	ZINC000450767068	CF	On-Demand	Bother	ENPP1	55	31
COc1ccc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)cc1[N+](=O)[O-]	ZINC000450767070	CF	On-Demand	Bother	ENPP1	55	31
COc1ccc(NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)cc1[N+](=O)[O-]	ZINC000450767071	CF	On-Demand	Bother	ENPP1	41	31
COC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450767086	DD	On-Demand	Anodyne	DRD2	23	47
COC(=O)CN1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450767086	DD	On-Demand	Anodyne	HTR7	25	41
CCN1C[C@H](Nc2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1=O	ZINC000450767092	EC	On-Demand	Anodyne	CA2	34	44
CCN1C[C@H](Nc2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1=O	ZINC000450767092	EC	On-Demand	Anodyne	CA7	41	39
CCN1C[C@@H](Nc2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1=O	ZINC000450767097	EC	On-Demand	Anodyne	CA2	34	44
CCN1C[C@@H](Nc2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1=O	ZINC000450767097	EC	On-Demand	Anodyne	CA7	41	39
COC(=O)CN1CCN(Cc2cc(C)ccc2F)CC1	ZINC000450767098	CD	On-Demand	Anodyne	DRD4	21	41
Cc1nc([C@H]2CCCN2Cc2ccn(CCc3ccccc3)n2)cs1	ZINC000450767103	FI	On-Demand	Anodyne	HRH3	0	40
COC(=O)CN1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450767127	GE	On-Demand	Anodyne	AVPR1B	50	38
COC(=O)CN1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450767127	GE	On-Demand	Anodyne	PDE6D	89	43
COC(=O)CN1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450767127	GE	On-Demand	Anodyne	HDAC8	36	42
COC(=O)CN1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450767127	GE	On-Demand	Anodyne	TACR3	33	40
COC(=O)CN1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450767127	GE	On-Demand	Anodyne	HDAC6	25	42
COC(=O)CN1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC1	ZINC000450767127	GE	On-Demand	Anodyne	IMDH_CRYPV	33	49
CO[C@@H](Cc1ccccc1)CN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450767134	FG	On-Demand	Anodyne	SIGMAR1	15	40
CO[C@H](Cc1ccccc1)CN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450767135	FG	On-Demand	Anodyne	SIGMAR1	15	40
COC(=O)CN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450767178	ED	On-Demand	Anodyne	CACNA1B	44	37
COC(=O)CN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450767178	ED	On-Demand	Anodyne	LIPG	47	38
COCCOc1cncc(C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450767208	GD	On-Demand	Anodyne	DRD4	46	38
COCCOc1cncc(C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450767208	GD	On-Demand	Anodyne	DRD3	27	40
COCCOc1cncc(C(=O)NCCN2c3ccccc3NS2(=O)=O)c1	ZINC000450767208	GD	On-Demand	Anodyne	ALPHA-1A	0	40
CCNC(=O)c1ccc(N2CC[C@@H](OC)C(C)(C)C2)nn1	ZINC000450767215	CD	On-Demand	Anodyne	SCD	24	45
CCNC(=O)c1ccc(N2CC[C@H](OC)C(C)(C)C2)nn1	ZINC000450767216	CD	On-Demand	Anodyne	SCD	24	45
Cc1noc([C@@H]2CCN(c3ccc4ccccc4n3)C2)n1	ZINC000450767244	CF	On-Demand	Anodyne	PDE1B	0	42
Cc1noc([C@@H]2CCN(c3ccc4ccccc4n3)C2)n1	ZINC000450767244	CF	On-Demand	Anodyne	SMO	60	41
Cc1noc([C@H]2CCN(c3ccc4ccccc4n3)C2)n1	ZINC000450767245	CF	On-Demand	Anodyne	PDE1B	0	42
Cc1noc([C@H]2CCN(c3ccc4ccccc4n3)C2)n1	ZINC000450767245	CF	On-Demand	Anodyne	SMO	60	41
C[C@H](Cc1ccc(Cl)cc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450767256	GF	On-Demand	Anodyne	MC4R	55	38
C[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450767257	GF	On-Demand	Anodyne	MC4R	55	38
CO[C@@H]1CCN(c2ncc(Cl)cc2Br)C[C@@H]1C	ZINC000450767272	DG	On-Demand	Anodyne	PDE3A	32	40
CO[C@H]1CCN(c2ncc(Cl)cc2Br)C[C@H]1C	ZINC000450767273	DG	On-Demand	Anodyne	PDE3A	32	40
CO[C@H]1CCN(c2ncc(Cl)cc2Br)C[C@@H]1C	ZINC000450767275	DG	On-Demand	Anodyne	PDE3A	32	40
CO[C@@H]1CCN(c2ncc(Cl)cc2Br)C[C@H]1C	ZINC000450767277	DG	On-Demand	Anodyne	PDE3A	32	40
CO[C@@H]1CCN(c2ncncc2Br)C[C@H]1C	ZINC000450767287	CE	On-Demand	Anodyne	PDE3A	43	33
CO[C@H]1CCN(c2ncncc2Br)C[C@H]1C	ZINC000450767289	CE	On-Demand	Anodyne	PDE3A	43	33
CO[C@@H]1CCN(c2ncncc2Br)C[C@@H]1C	ZINC000450767291	CE	On-Demand	Anodyne	PDE3A	43	33
CO[C@H]1CCN(c2ncncc2Br)C[C@@H]1C	ZINC000450767293	CE	On-Demand	Anodyne	PDE3A	43	33
COc1ccc2nc(N3CC[C@@H](OC)[C@H](C)C3)c(C)nc2c1	ZINC000450767326	DF	On-Demand	Anodyne	PDE3A	47	42
COc1ccc2nc(N3CC[C@@H](OC)[C@H](C)C3)c(C)nc2c1	ZINC000450767326	DF	On-Demand	Anodyne	PDE3B	70	42
COc1ccc2nc(N3CC[C@H](OC)[C@H](C)C3)c(C)nc2c1	ZINC000450767328	DF	On-Demand	Anodyne	PDE3A	47	42
COc1ccc2nc(N3CC[C@H](OC)[C@H](C)C3)c(C)nc2c1	ZINC000450767328	DF	On-Demand	Anodyne	PDE3B	70	42
COc1ccc2nc(N3CC[C@@H](OC)[C@@H](C)C3)c(C)nc2c1	ZINC000450767331	DF	On-Demand	Anodyne	PDE3A	47	42
COc1ccc2nc(N3CC[C@@H](OC)[C@@H](C)C3)c(C)nc2c1	ZINC000450767331	DF	On-Demand	Anodyne	PDE3B	70	42
COc1ccc2nc(N3CC[C@H](OC)[C@@H](C)C3)c(C)nc2c1	ZINC000450767333	DF	On-Demand	Anodyne	PDE3A	47	42
COc1ccc2nc(N3CC[C@H](OC)[C@@H](C)C3)c(C)nc2c1	ZINC000450767333	DF	On-Demand	Anodyne	PDE3B	70	42
CC(C)(O)CCNC(=O)c1ccnc(OC(F)F)c1	ZINC000450767349	CD	On-Demand	Anodyne	KDM4E	24	42
CO[C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)CC1(C)C	ZINC000450767360	DH	On-Demand	Anodyne	GRM5	26	45
CO[C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)CC1(C)C	ZINC000450767362	DH	On-Demand	Anodyne	GRM5	26	45
Cc1nnnn1-c1ccc(C(=O)NCCC(C)(C)O)c(F)c1	ZINC000450767365	DD	On-Demand	Anodyne	F9	0	43
CCOC(=O)[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)[C@@H]1CCCOC1	ZINC000450767367	FD	On-Demand	Anodyne	P2RY12	90	38
CCOC(=O)[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)[C@@H]1CCCOC1	ZINC000450767368	FD	On-Demand	Anodyne	P2RY12	90	38
CCOC(=O)[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)[C@H]1CCCOC1	ZINC000450767370	FD	On-Demand	Anodyne	P2RY12	90	38
CCOC(=O)[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)[C@H]1CCCOC1	ZINC000450767372	FD	On-Demand	Anodyne	P2RY12	90	38
CCOC(=O)[C@H]1CCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450767374	EE	On-Demand	Anodyne	FKBP1A	46	40
CCOC(=O)[C@H]1CCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450767374	EE	On-Demand	Anodyne	HRH3	15	47
CCc1ncnc(N2CC[C@@H](OC)[C@@H](C)C2)c1F	ZINC000450767375	CE	On-Demand	Anodyne	PDE3A	44	35
CCc1ncnc(N2CC[C@@H](OC)[C@@H](C)C2)c1F	ZINC000450767375	CE	On-Demand	Anodyne	PDE3B	65	35
CCc1ncnc(N2CC[C@H](OC)[C@H](C)C2)c1F	ZINC000450767377	CE	On-Demand	Anodyne	PDE3A	44	35
CCc1ncnc(N2CC[C@H](OC)[C@H](C)C2)c1F	ZINC000450767377	CE	On-Demand	Anodyne	PDE3B	65	35
CCc1ncnc(N2CC[C@@H](OC)[C@H](C)C2)c1F	ZINC000450767379	CE	On-Demand	Anodyne	PDE3A	44	35
CCc1ncnc(N2CC[C@@H](OC)[C@H](C)C2)c1F	ZINC000450767379	CE	On-Demand	Anodyne	PDE3B	65	35
CCc1ncnc(N2CC[C@H](OC)[C@@H](C)C2)c1F	ZINC000450767380	CE	On-Demand	Anodyne	PDE3A	44	35
CCc1ncnc(N2CC[C@H](OC)[C@@H](C)C2)c1F	ZINC000450767380	CE	On-Demand	Anodyne	PDE3B	65	35
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)CC1(C)C	ZINC000450767384	GG	On-Demand	Anodyne	PDE3A	55	41
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)CC1(C)C	ZINC000450767384	GG	On-Demand	Anodyne	PDGFRB	30	44
CO[C@H]1CCN(c2ncnc3ccc(I)cc23)CC1(C)C	ZINC000450767384	GG	On-Demand	Anodyne	PDE3B	81	41
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)CC1(C)C	ZINC000450767385	GG	On-Demand	Anodyne	PDE3A	55	41
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)CC1(C)C	ZINC000450767385	GG	On-Demand	Anodyne	PDGFRB	30	44
CO[C@@H]1CCN(c2ncnc3ccc(I)cc23)CC1(C)C	ZINC000450767385	GG	On-Demand	Anodyne	PDE3B	81	41
CC[C@@H](CN(CC)C(=O)c1cc2n(n1)CCCC2)c1ccccc1	ZINC000450767389	EH	On-Demand	Anodyne	KCNQ2	42	34
CC[C@@H](CN(CC)C(=O)c1cc2n(n1)CCCC2)c1ccccc1	ZINC000450767389	EH	On-Demand	Anodyne	NPY2R	44	35
CC[C@H](CN(CC)C(=O)c1cc2n(n1)CCCC2)c1ccccc1	ZINC000450767390	EH	On-Demand	Anodyne	KCNQ2	42	34
CC[C@H](CN(CC)C(=O)c1cc2n(n1)CCCC2)c1ccccc1	ZINC000450767390	EH	On-Demand	Anodyne	NPY2R	44	35
CO[C@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CC1(C)C	ZINC000450767401	FH	On-Demand	Anodyne	AVPR2	50	40
CO[C@@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CC1(C)C	ZINC000450767404	FH	On-Demand	Anodyne	AVPR2	50	40
CNC(=O)C1CN(CCc2ccc(Cl)cc2)C1	ZINC000450767407	CD	On-Demand	Anodyne	SLC6A1	37	45
CNC(=O)C1CN(CCc2ccc(Cl)cc2)C1	ZINC000450767407	CD	On-Demand	Anodyne	BIRC2	52	44
CO[C@H]1CCN(c2nc(-c3ccc(F)cc3)cs2)CC1(C)C	ZINC000450767411	DI	On-Demand	Anodyne	EGFR	0	42
CO[C@@H]1CCN(c2nc(-c3ccc(F)cc3)cs2)CC1(C)C	ZINC000450767412	DI	On-Demand	Anodyne	EGFR	0	42
COC(=O)c1csc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450767413	FH	On-Demand	Anodyne	SIGMAR1	17	41
COC(=O)c1csc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)n1	ZINC000450767413	FH	On-Demand	Anodyne	CCR3	57	38
Fc1ccc(CC2CCN(Cc3cnn[nH]3)CC2)cc1F	ZINC000450767426	CF	On-Demand	Anodyne	SIGMAR1	17	41
CO[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@@H]1C	ZINC000450767432	DG	On-Demand	Anodyne	PDE3B	42	31
CO[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@@H]1C	ZINC000450767432	DG	On-Demand	Anodyne	RBP4	17	41
CO[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@H]1C	ZINC000450767434	DG	On-Demand	Anodyne	PDE3B	42	31
CO[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@H]1C	ZINC000450767434	DG	On-Demand	Anodyne	RBP4	17	41
CO[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@@H]1C	ZINC000450767437	DG	On-Demand	Anodyne	PDE3B	42	31
CO[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@@H]1C	ZINC000450767437	DG	On-Demand	Anodyne	RBP4	17	41
CO[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@H]1C	ZINC000450767441	DG	On-Demand	Anodyne	PDE3B	42	31
CO[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C[C@H]1C	ZINC000450767441	DG	On-Demand	Anodyne	RBP4	17	41
CO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1C	ZINC000450767446	CD	On-Demand	Anodyne	P2RY12	28	41
CO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1C	ZINC000450767446	CD	On-Demand	Anodyne	CXCR3	35	51
CO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@H]1C	ZINC000450767449	CD	On-Demand	Anodyne	P2RY12	28	41
CO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@H]1C	ZINC000450767449	CD	On-Demand	Anodyne	CXCR3	35	51
CO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1C	ZINC000450767452	CD	On-Demand	Anodyne	P2RY12	28	41
CO[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1C	ZINC000450767452	CD	On-Demand	Anodyne	CXCR3	35	51
CC[C@H](O)CC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1	ZINC000450767453	FG	On-Demand	Anodyne	KCNQ2	18	42
CO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@H]1C	ZINC000450767454	CD	On-Demand	Anodyne	P2RY12	28	41
CO[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@H]1C	ZINC000450767454	CD	On-Demand	Anodyne	CXCR3	35	51
CC[C@@H](O)CC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1	ZINC000450767455	FG	On-Demand	Anodyne	KCNQ2	18	42
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	HTR1A	66	46
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	DRD2	43	42
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	DRD1	0	42
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	ADRA1D	49	46
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	HTR2A	25	41
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	ADRA1A	42	46
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	ADRA1B	38	46
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	DRD3	43	37
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	HTR7	40	36
COc1cccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767456	GE	On-Demand	Bother	SSTR1	42	40
CC[C@H](O)CC(=O)N[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1	ZINC000450767457	FG	On-Demand	Anodyne	KCNQ2	18	42
CC[C@@H](O)CC(=O)N[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1	ZINC000450767458	FG	On-Demand	Anodyne	KCNQ2	18	42
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	HTR1A	66	46
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	DRD2	43	42
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	DRD1	0	42
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	ADRA1D	49	46
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	HTR2A	25	41
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	ADRA1A	42	46
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	ADRA1B	38	46
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	DRD3	43	37
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	HTR7	40	36
COc1cccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1[N+](=O)[O-]	ZINC000450767459	GE	On-Demand	Bother	SSTR1	42	40
CCOC(=O)[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)[C@@H]1CCCOC1	ZINC000450767461	FE	On-Demand	Anodyne	YARS	38	40
CCOC(=O)[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)[C@H]1CCCOC1	ZINC000450767464	FE	On-Demand	Anodyne	YARS	38	40
CCOC(=O)[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)[C@H]1CCCOC1	ZINC000450767467	FE	On-Demand	Anodyne	YARS	38	40
CCOC(=O)[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)[C@@H]1CCCOC1	ZINC000450767469	FE	On-Demand	Anodyne	YARS	38	40
C[C@@H](C(=O)NC(C)(C)C)N(C)CCc1cscn1	ZINC000450767475	CD	On-Demand	Anodyne	BMP1	41	32
C[C@H](C(=O)NC(C)(C)C)N(C)CCc1cscn1	ZINC000450767478	CD	On-Demand	Anodyne	BMP1	41	32
COC(=O)CN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450767507	FC	On-Demand	Bother	DRD4	40	30
COC(=O)CN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450767507	FC	On-Demand	Bother	CACNA1D	72	33
COC(=O)CN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450767507	FC	On-Demand	Bother	MGLL	0	41
CCN1C[C@H](Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)CC1=O	ZINC000450767517	GD	On-Demand	Bother	TBXA2R	18	44
CCN1C[C@@H](Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)CC1=O	ZINC000450767523	GD	On-Demand	Bother	TBXA2R	18	44
CCc1cc(CCCN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)on1	ZINC000450767551	EH	On-Demand	Anodyne	DRD4	30	41
CCc1cc(CCCN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)on1	ZINC000450767551	EH	On-Demand	Anodyne	DRD3	0	41
CC(C)(O)CCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450767555	CD	On-Demand	Anodyne	CAN2	0	46
CC(=O)N1CCN(C(=O)C2CCN(c3cc(C(F)(F)F)ccn3)CC2)CC1	ZINC000450767556	GE	On-Demand	Anodyne	CCR2	17	51
CC(=O)N1CCN(C(=O)C2CCN(c3cc(C(F)(F)F)ccn3)CC2)CC1	ZINC000450767556	GE	On-Demand	Anodyne	LIPG	54	38
CC(=O)N1CCN(C(=O)C2CCN(c3cc(C(F)(F)F)ccn3)CC2)CC1	ZINC000450767556	GE	On-Demand	Anodyne	MAP3K12	30	43
CCc1cc(CCCN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000450767558	EH	On-Demand	Anodyne	DRD4	30	41
CCc1cc(CCCN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000450767558	EH	On-Demand	Anodyne	DRD3	0	41
Cc1cncc(-c2nc(CN3CCN(C[C@H](C)O)C[C@@H]3C)no2)c1	ZINC000450767562	ED	On-Demand	Anodyne	ACOX1	34	43
Cc1cncc(-c2nc(CN3CCN(C[C@H](C)O)C[C@H]3C)no2)c1	ZINC000450767565	ED	On-Demand	Anodyne	ACOX1	34	43
Cc1cncc(-c2nc(CN3CCN(C[C@@H](C)O)C[C@@H]3C)no2)c1	ZINC000450767567	ED	On-Demand	Anodyne	ACOX1	34	43
Cc1cncc(-c2nc(CN3CCN(C[C@@H](C)O)C[C@H]3C)no2)c1	ZINC000450767569	ED	On-Demand	Anodyne	ACOX1	34	43
CCc1cc(CCCN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)on1	ZINC000450767574	EH	On-Demand	Anodyne	DRD4	30	41
CCc1cc(CCCN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)on1	ZINC000450767574	EH	On-Demand	Anodyne	DRD3	0	41
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1[N+](=O)[O-]	ZINC000450767580	EH	On-Demand	Bother	KCNMA1	29	40
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1[N+](=O)[O-]	ZINC000450767580	EH	On-Demand	Bother	ENPP1	60	31
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1[N+](=O)[O-]	ZINC000450767580	EH	On-Demand	Bother	KCNK3	38	40
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1[N+](=O)[O-]	ZINC000450767580	EH	On-Demand	Bother	KCNK9	34	40
CCc1cc(CCCN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000450767583	EH	On-Demand	Anodyne	DRD4	30	41
CCc1cc(CCCN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000450767583	EH	On-Demand	Anodyne	DRD3	0	41
CCOC(=O)[C@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450767586	CE	On-Demand	Anodyne	ACE	28	40
CCOC(=O)[C@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450767586	CE	On-Demand	Anodyne	FKBP1A	65	41
CCOC(=O)[C@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450767586	CE	On-Demand	Anodyne	SLC6A1	43	32
CCOC(=O)[C@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450767586	CE	On-Demand	Anodyne	SIGMAR1	23	40
CCOC(=O)[C@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450767586	CE	On-Demand	Anodyne	PREP	70	42
CCOC(=O)[C@H]1CCCN1CCN(C)Cc1ccccc1	ZINC000450767586	CE	On-Demand	Anodyne	AMY2	44	30
CC(C)(O)CCNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450767598	EF	On-Demand	Anodyne	PYGL	56	40
CC(C)(O)CCNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450767598	EF	On-Demand	Anodyne	PLD2	44	34
CC(C)(O)CCNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450767598	EF	On-Demand	Anodyne	ALPL	40	34
CC(C)(O)CCNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450767598	EF	On-Demand	Anodyne	PYK	32	40
Fc1cccc(F)c1C1CCN(CCc2cscn2)CC1	ZINC000450767626	DH	On-Demand	Anodyne	SCN5A	46	41
O=C(CCCN1C[C@@H](O)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450767634	CD	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1C[C@@H](O)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450767634	CD	On-Demand	Anodyne	CYP2J2	44	31
COc1ccc(NC(=O)CC[C@H]2CCC(=O)N2)cc1[N+](=O)[O-]	ZINC000450767637	DD	On-Demand	Bother	ENPP1	51	31
O=C(CCCN1C[C@H](O)C[C@H]1CO)c1ccc(F)cc1	ZINC000450767638	CD	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1C[C@H](O)C[C@H]1CO)c1ccc(F)cc1	ZINC000450767638	CD	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1C[C@H](O)C[C@H]1CO)c1ccc(F)cc1	ZINC000450767638	CD	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@H](O)C[C@H]1CO)c1ccc(F)cc1	ZINC000450767638	CD	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@H](O)C[C@H]1CO)c1ccc(F)cc1	ZINC000450767638	CD	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@H](O)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450767640	CD	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1C[C@H](O)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450767640	CD	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1C[C@H](O)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450767640	CD	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1C[C@H](O)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450767640	CD	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@H](O)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450767640	CD	On-Demand	Anodyne	CYP2J2	44	31
COc1ccc(NC(=O)CC[C@@H]2CCC(=O)N2)cc1[N+](=O)[O-]	ZINC000450767642	DD	On-Demand	Bother	ENPP1	51	31
COC(=O)c1csc(CSc2nnc(C(C)C)n2Cc2ccco2)n1	ZINC000450767651	GH	On-Demand	Anodyne	HCRTR2	20	41
COc1ccc(CNC(=O)CCN2[C@H]3CC[C@H]2CC(=O)C3)c(OC)c1	ZINC000450767652	ED	On-Demand	Anodyne	PDGFRB	30	42
COc1ccc(CNC(=O)CCN2[C@H]3CC[C@H]2CC(=O)C3)c(OC)c1	ZINC000450767652	ED	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN2[C@H]3CC[C@H]2CC(=O)C3)c(OC)c1	ZINC000450767652	ED	On-Demand	Anodyne	MTNR1B	51	38
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)CC1	ZINC000450767653	GD	On-Demand	Anodyne	TRPC6	33	41
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccc(OC)cc3)cn2)CC1	ZINC000450767653	GD	On-Demand	Anodyne	TRPC3	17	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767655	FE	On-Demand	Anodyne	MME	73	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767655	FE	On-Demand	Anodyne	FCER2	40	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767655	FE	On-Demand	Anodyne	PAPA1_CARPA	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767655	FE	On-Demand	Anodyne	CAPNS1	51	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767655	FE	On-Demand	Anodyne	CAPN1	40	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767655	FE	On-Demand	Anodyne	CAPN2	44	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767655	FE	On-Demand	Anodyne	GPR142	40	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767657	FE	On-Demand	Anodyne	MME	73	42
CO[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767657	FE	On-Demand	Anodyne	FCER2	40	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767657	FE	On-Demand	Anodyne	PAPA1_CARPA	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767657	FE	On-Demand	Anodyne	CAPNS1	51	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767657	FE	On-Demand	Anodyne	CAPN1	40	39
CO[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767657	FE	On-Demand	Anodyne	CAPN2	44	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767657	FE	On-Demand	Anodyne	GPR142	40	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767659	FE	On-Demand	Anodyne	MME	73	42
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767659	FE	On-Demand	Anodyne	FCER2	40	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767659	FE	On-Demand	Anodyne	PAPA1_CARPA	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767659	FE	On-Demand	Anodyne	CAPNS1	51	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767659	FE	On-Demand	Anodyne	CAPN1	40	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767659	FE	On-Demand	Anodyne	CAPN2	44	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767659	FE	On-Demand	Anodyne	GPR142	40	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767660	FE	On-Demand	Anodyne	MME	73	42
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767660	FE	On-Demand	Anodyne	FCER2	40	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767660	FE	On-Demand	Anodyne	PAPA1_CARPA	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767660	FE	On-Demand	Anodyne	CAPNS1	51	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767660	FE	On-Demand	Anodyne	CAPN1	40	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767660	FE	On-Demand	Anodyne	CAPN2	44	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450767660	FE	On-Demand	Anodyne	GPR142	40	33
COC(=O)c1csc(CN2CCC(c3ccsc3)CC2)n1	ZINC000450767668	DG	On-Demand	Anodyne	NPBWR1	56	30
Cc1cc(N[C@H](C(C)C)[C@@H](CO)C(C)C)n2ncnc2n1	ZINC000450767682	CE	On-Demand	Anodyne	DHOD	0	49
Cc1cc(N[C@@H](C(C)C)[C@@H](CO)C(C)C)n2ncnc2n1	ZINC000450767684	CE	On-Demand	Anodyne	DHOD	0	49
Cc1cc(N[C@@H](C(C)C)[C@H](CO)C(C)C)n2ncnc2n1	ZINC000450767686	CE	On-Demand	Anodyne	DHOD	0	49
Cc1cc(N[C@H](C(C)C)[C@H](CO)C(C)C)n2ncnc2n1	ZINC000450767688	CE	On-Demand	Anodyne	DHOD	0	49
O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N1CCO[C@@H](C2CC2)C1	ZINC000450767692	FG	On-Demand	Anodyne	PRCP	15	43
O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N1CCO[C@H](C2CC2)C1	ZINC000450767693	FG	On-Demand	Anodyne	PRCP	15	43
O=C(CCCN1CCn2ncnc2C1)c1ccc(Br)cc1	ZINC000450767707	EF	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCc1cccc(F)c1Br)Nc1cccc(CCCO)c1	ZINC000450767728	GI	On-Demand	Anodyne	HDAC10	20	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(c3c(F)cccc3F)CC2)c1	ZINC000450767731	FI	On-Demand	Anodyne	PRCP	48	35
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(c3c(F)cccc3F)CC2)c1	ZINC000450767731	FI	On-Demand	Anodyne	NPBWR1	75	33
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)C(C)(C)CO)cc2)c1	ZINC000450767734	GG	On-Demand	Anodyne	KCNK3	39	40
C[C@@H](OCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450767739	GD	On-Demand	Anodyne	CAPN2	56	33
C[C@@H](OCc1ccccc1)C(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450767739	GD	On-Demand	Anodyne	NPR	47	33
Cc1cnc(CCCC(=O)N2CCC(c3c(F)cccc3F)CC2)o1	ZINC000450767747	EH	On-Demand	Anodyne	ETHR	65	35
CC(C)CN(CCc1cscn1)[C@H]1CCCc2cccnc21	ZINC000450767757	DI	On-Demand	Anodyne	CXCR4	87	46
CC(C)(CO)C(C)(C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450767758	EE	On-Demand	Anodyne	PDE4D	15	41
CC(C)(CO)C(C)(C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450767759	EE	On-Demand	Anodyne	PDE4D	15	41
CC(C)CN(CCc1cscn1)[C@@H]1CCCc2cccnc21	ZINC000450767764	DI	On-Demand	Anodyne	CXCR4	87	46
COC(=O)c1csc(CN2CCN(C3CC3)c3ccc(F)cc32)n1	ZINC000450767766	EG	On-Demand	Anodyne	SCD1	0	40
Cc1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)ncc1C(N)=O	ZINC000450767804	FF	On-Demand	Anodyne	SLC9A1	49	38
CC(C)CN(C[C@H]1CCNC(=O)CC1)[C@H]1CCCc2cccnc21	ZINC000450767810	EG	On-Demand	Anodyne	CXCR4	86	46
CC(C)CN(C[C@@H]1CCNC(=O)CC1)[C@@H]1CCCc2cccnc21	ZINC000450767811	EG	On-Demand	Anodyne	CXCR4	86	46
CC(C)CN(C[C@H]1CCNC(=O)CC1)[C@@H]1CCCc2cccnc21	ZINC000450767812	EG	On-Demand	Anodyne	CXCR4	86	46
CC(C)CN(C[C@@H]1CCNC(=O)CC1)[C@H]1CCCc2cccnc21	ZINC000450767813	EG	On-Demand	Anodyne	CXCR4	86	46
CC(C)(C)OCc1cc(CNC(=O)c2cc3ccncc3s2)no1	ZINC000450767857	EH	On-Demand	Anodyne	NAMPT	23	48
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ccc4ccccc4n3)C[C@@H]12	ZINC000450767862	CF	On-Demand	Anodyne	HTR3A	27	42
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ccc4ccccc4n3)C[C@@H]12	ZINC000450767862	CF	On-Demand	Anodyne	PDE1B	0	43
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ccc4ccccc4n3)C[C@@H]12	ZINC000450767862	CF	On-Demand	Anodyne	SORD	16	45
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ccc4ccccc4n3)C[C@H]12	ZINC000450767863	CF	On-Demand	Anodyne	HTR3A	27	42
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ccc4ccccc4n3)C[C@H]12	ZINC000450767863	CF	On-Demand	Anodyne	PDE1B	0	43
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ccc4ccccc4n3)C[C@H]12	ZINC000450767863	CF	On-Demand	Anodyne	SORD	16	45
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ccc4ccccc4n3)C[C@H]21	ZINC000450767864	CF	On-Demand	Anodyne	HTR3A	27	42
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ccc4ccccc4n3)C[C@H]21	ZINC000450767864	CF	On-Demand	Anodyne	PDE1B	0	43
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ccc4ccccc4n3)C[C@H]21	ZINC000450767864	CF	On-Demand	Anodyne	SORD	16	45
CC(C)(C)NC(=O)N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450767870	EF	On-Demand	Anodyne	EPHX2	15	42
CC(C)(C)OCc1cc(CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)no1	ZINC000450767871	FJ	On-Demand	Anodyne	SCN9A	0	42
OC1(Cc2ccc(F)cc2)CCN(CCc2cscn2)CC1	ZINC000450767886	DF	On-Demand	Anodyne	UTS2R	0	44
CC(C)NC(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450767892	FF	On-Demand	Bother	TAAR1	18	48
CC(C)NC(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450767893	FF	On-Demand	Bother	TAAR1	18	48
CC(C)NC(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450767894	FF	On-Demand	Bother	TAAR1	18	48
CC(C)NC(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450767895	FF	On-Demand	Bother	TAAR1	18	48
FC(F)(F)c1ccccc1OCC1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450767901	GJ	On-Demand	Anodyne	SIGMAR1	17	43
FC(F)(F)c1ccccc1OCC1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450767901	GJ	On-Demand	Anodyne	SCD1	26	40
CC(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450767902	BH	On-Demand	Anodyne	DRD4	29	41
CC(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450767902	BH	On-Demand	Anodyne	ACHE	15	44
CC(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450767902	BH	On-Demand	Anodyne	SLC6A1	53	34
CC(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450767902	BH	On-Demand	Anodyne	HRH3	27	42
CC(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450767902	BH	On-Demand	Anodyne	SIGMAR1	31	43
CC(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450767902	BH	On-Demand	Anodyne	SLC18A3	19	44
CC(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450767902	BH	On-Demand	Anodyne	MLNR	52	38
CC(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450767902	BH	On-Demand	Anodyne	L3MBTL3	37	44
CC(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450767903	BH	On-Demand	Anodyne	DRD4	29	41
CC(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450767903	BH	On-Demand	Anodyne	ACHE	15	44
CC(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450767903	BH	On-Demand	Anodyne	SLC6A1	53	34
CC(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450767903	BH	On-Demand	Anodyne	HRH3	27	42
CC(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450767903	BH	On-Demand	Anodyne	SIGMAR1	31	43
CC(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450767903	BH	On-Demand	Anodyne	SLC18A3	19	44
CC(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450767903	BH	On-Demand	Anodyne	MLNR	52	38
CC(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450767903	BH	On-Demand	Anodyne	L3MBTL3	37	44
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncnc4sc5c(c34)CCC5)C[C@H]12	ZINC000450767908	DF	On-Demand	Anodyne	RBP4	19	48
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ncnc4sc5c(c34)CCC5)C[C@H]21	ZINC000450767909	DF	On-Demand	Anodyne	RBP4	19	48
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncnc4sc5c(c34)CCC5)C[C@@H]12	ZINC000450767910	DF	On-Demand	Anodyne	RBP4	19	48
COC(=O)CN1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450767930	DC	On-Demand	Anodyne	ACE	43	36
COC(=O)CN1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450767930	DC	On-Demand	Anodyne	MME	58	35
COC(=O)CN1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450767930	DC	On-Demand	Anodyne	TRY2_BOVIN	66	36
COC(=O)CN1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450767930	DC	On-Demand	Anodyne	ACE2	44	34
COC(=O)CN1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450767931	DC	On-Demand	Anodyne	ACE	43	36
COC(=O)CN1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450767931	DC	On-Demand	Anodyne	MME	58	35
COC(=O)CN1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450767931	DC	On-Demand	Anodyne	TRY2_BOVIN	66	36
COC(=O)CN1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450767931	DC	On-Demand	Anodyne	ACE2	44	34
COC(=O)COc1ccc([C@@H](C)NC[C@@](C)(O)C(C)=O)cc1	ZINC000450767965	DD	On-Demand	Anodyne	ACACA	47	38
COC(=O)COc1ccc([C@@H](C)NC[C@](C)(O)C(C)=O)cc1	ZINC000450767966	DD	On-Demand	Anodyne	ACACA	47	38
COC(=O)COc1ccc([C@H](C)NC[C@@](C)(O)C(C)=O)cc1	ZINC000450767975	DD	On-Demand	Anodyne	ACACA	47	38
COC(=O)COc1ccc([C@H](C)NC[C@](C)(O)C(C)=O)cc1	ZINC000450767977	DD	On-Demand	Anodyne	ACACA	47	38
COc1cc(CSc2n[nH]c(C(C)(C)C)n2)ccc1Cl	ZINC000450767985	DI	On-Demand	Anodyne	METAP2	0	41
COC(=O)c1ccc(CSc2n[nH]c(C(C)(C)C)n2)c(Br)c1	ZINC000450767986	GH	On-Demand	Anodyne	METAP2	0	44
CCS(=O)(=O)c1ccc(CN2CCc3c(C)cc(C)cc3C2)cc1	ZINC000450768000	EH	On-Demand	Anodyne	NOD2	41	36
COc1ccccc1Oc1ccc(C(=O)NCCCCCS(C)(=O)=O)nc1	ZINC000450768019	GF	On-Demand	Anodyne	DRD2	20	40
COc1ccccc1Oc1ccc(C(=O)NCCCCCS(C)(=O)=O)nc1	ZINC000450768019	GF	On-Demand	Anodyne	DRD3	40	44
CCc1cc(N2CC[C@H](OC)[C@H](C)C2)c2ccccc2n1	ZINC000450768028	CH	On-Demand	Anodyne	METAP1	43	37
CCc1cc(N2CC[C@@H](OC)[C@H](C)C2)c2ccccc2n1	ZINC000450768029	CH	On-Demand	Anodyne	METAP1	43	37
CCc1cc(N2CC[C@@H](OC)[C@@H](C)C2)c2ccccc2n1	ZINC000450768030	CH	On-Demand	Anodyne	METAP1	43	37
CCc1cc(N2CC[C@H](OC)[C@@H](C)C2)c2ccccc2n1	ZINC000450768031	CH	On-Demand	Anodyne	METAP1	43	37
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450768040	FF	On-Demand	Anodyne	FASN	25	41
CCN(CC)C(=O)CCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450768040	FF	On-Demand	Anodyne	L3MBTL3	56	36
CO[C@H]1CCN(c2ncnc3cccc(I)c23)C[C@@H]1C	ZINC000450768050	GG	On-Demand	Anodyne	PDE3A	51	38
CO[C@H]1CCN(c2ncnc3cccc(I)c23)C[C@@H]1C	ZINC000450768050	GG	On-Demand	Anodyne	PDE3B	75	39
CO[C@@H]1CCN(c2ncnc3cccc(I)c23)C[C@@H]1C	ZINC000450768052	GG	On-Demand	Anodyne	PDE3A	51	38
CO[C@@H]1CCN(c2ncnc3cccc(I)c23)C[C@@H]1C	ZINC000450768052	GG	On-Demand	Anodyne	PDE3B	75	39
CO[C@H]1CCN(c2ncnc3cccc(I)c23)C[C@H]1C	ZINC000450768054	GG	On-Demand	Anodyne	PDE3A	51	38
CO[C@H]1CCN(c2ncnc3cccc(I)c23)C[C@H]1C	ZINC000450768054	GG	On-Demand	Anodyne	PDE3B	75	39
CO[C@@H]1CCN(c2ncnc3cccc(I)c23)C[C@H]1C	ZINC000450768055	GG	On-Demand	Anodyne	PDE3A	51	38
CO[C@@H]1CCN(c2ncnc3cccc(I)c23)C[C@H]1C	ZINC000450768055	GG	On-Demand	Anodyne	PDE3B	75	39
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1(C)C	ZINC000450768056	FG	On-Demand	Anodyne	DRD3	22	43
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1(C)C	ZINC000450768056	FG	On-Demand	Anodyne	CNR2	17	40
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1(C)C	ZINC000450768056	FG	On-Demand	Anodyne	ACACA	0	47
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1(C)C	ZINC000450768056	FG	On-Demand	Anodyne	ACACB	26	47
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1(C)C	ZINC000450768057	FG	On-Demand	Anodyne	DRD3	22	43
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1(C)C	ZINC000450768057	FG	On-Demand	Anodyne	CNR2	17	40
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1(C)C	ZINC000450768057	FG	On-Demand	Anodyne	ACACA	0	47
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1(C)C	ZINC000450768057	FG	On-Demand	Anodyne	ACACB	26	47
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)CC1(C)C	ZINC000450768058	DI	On-Demand	Anodyne	PDE3A	40	34
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)CC1(C)C	ZINC000450768058	DI	On-Demand	Anodyne	HRP1_PLAFA	98	37
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)CC1(C)C	ZINC000450768058	DI	On-Demand	Anodyne	HNMT	50	35
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)CC1(C)C	ZINC000450768058	DI	On-Demand	Anodyne	PDE3B	59	34
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)CC1(C)C	ZINC000450768059	DI	On-Demand	Anodyne	PDE3A	40	34
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)CC1(C)C	ZINC000450768059	DI	On-Demand	Anodyne	HRP1_PLAFA	84	37
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)CC1(C)C	ZINC000450768059	DI	On-Demand	Anodyne	HNMT	50	35
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)CC1(C)C	ZINC000450768059	DI	On-Demand	Anodyne	PDE3B	59	34
CCN1C[C@H](Nc2cc(-c3nc(C(C)C)no3)ccn2)CC1=O	ZINC000450768072	DE	On-Demand	Anodyne	PRKD1	40	31
CCN1C[C@@H](Nc2cc(-c3nc(C(C)C)no3)ccn2)CC1=O	ZINC000450768073	DE	On-Demand	Anodyne	PRKD1	40	31
CO[C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@H]1C	ZINC000450768089	CF	On-Demand	Anodyne	SORD	45	38
CO[C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1C	ZINC000450768090	CF	On-Demand	Anodyne	SORD	45	38
CO[C@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1C	ZINC000450768091	CF	On-Demand	Anodyne	SORD	45	38
CO[C@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@H]1C	ZINC000450768092	CF	On-Demand	Anodyne	SORD	45	38
COCCC1(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCCCC1	ZINC000450768108	GI	On-Demand	Bother	HCN1	50	30
COCCC1(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCCCC1	ZINC000450768108	GI	On-Demand	Bother	HCN4	47	30
COCCC1(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCCCC1	ZINC000450768108	GI	On-Demand	Bother	PPXII	0	40
CC(C)c1nnc(SCC(=O)CC(C)(C)C2CC2)n1Cc1ccco1	ZINC000450768167	FJ	On-Demand	Anodyne	HCRTR2	21	42
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450768168	EG	On-Demand	Anodyne	INHA	62	36
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450768169	EG	On-Demand	Anodyne	INHA	62	36
CC(C)C[C@H]1OCCC[C@@H]1NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450768170	EG	On-Demand	Anodyne	INHA	62	36
CC(C)C[C@H]1OCCC[C@H]1NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450768171	EG	On-Demand	Anodyne	INHA	62	36
Cc1noc([C@@H]2CCN(c3cncc(-c4cccs4)n3)C2)n1	ZINC000450768172	DF	On-Demand	Anodyne	ETHR	37	42
Cc1noc([C@H]2CCN(c3cncc(-c4cccs4)n3)C2)n1	ZINC000450768174	DF	On-Demand	Anodyne	ETHR	37	42
CC(=O)c1cccc(CN2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450768184	EH	On-Demand	Anodyne	DRD2	15	42
CC(=O)c1cccc(CN2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450768184	EH	On-Demand	Anodyne	ACHE	26	41
CC(=O)c1cccc(CN2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450768184	EH	On-Demand	Anodyne	CHRM3	16	40
CC(=O)c1cccc(CN2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450768184	EH	On-Demand	Anodyne	CCR3	24	40
CC(=O)c1cccc(CN2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450768184	EH	On-Demand	Anodyne	SMO	51	35
CC(=O)c1cccc(CN2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450768184	EH	On-Demand	Anodyne	ETHR	64	40
CC(=O)N1CCN(C(=O)C2CCN(c3ccnc(-c4ccccc4)n3)CC2)CC1	ZINC000450768227	GE	On-Demand	Anodyne	P2RY12	62	43
CC(=O)N1CCN(C(=O)C2CCN(c3ccnc(-c4ccccc4)n3)CC2)CC1	ZINC000450768227	GE	On-Demand	Anodyne	SORD	77	37
CC(=O)N1CCN(C(=O)C2CCN(c3ccnc(-c4ccccc4)n3)CC2)CC1	ZINC000450768227	GE	On-Demand	Anodyne	DGAT1	16	40
CC(=O)N1CCN(C(=O)C2CCN(c3ccnc(-c4ccccc4)n3)CC2)CC1	ZINC000450768227	GE	On-Demand	Anodyne	SLC6A7	0	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccnc4cc(F)ccc34)C2)CC1	ZINC000450768228	GG	On-Demand	Anodyne	CCR3	67	36
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccnc4cc(F)ccc34)C2)CC1	ZINC000450768239	GG	On-Demand	Anodyne	CCR3	67	36
CCOC(=O)c1ccc(CN2CCC[C@H](C(=O)OC(C)(C)C)C2)nc1	ZINC000450768256	EF	On-Demand	Anodyne	SLC6A1	93	35
CCOC(=O)c1ccc(CN2CCC[C@@H](C(=O)OC(C)(C)C)C2)nc1	ZINC000450768257	EF	On-Demand	Anodyne	SLC6A1	93	35
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3C[C@@H](C)O[C@H](C)C3)C2)n1	ZINC000450768259	GF	On-Demand	Anodyne	SMO	52	36
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3C[C@H](C)O[C@H](C)C3)C2)n1	ZINC000450768260	GF	On-Demand	Anodyne	SMO	52	36
Cc1noc([C@H]2CCN(c3nc4ccccc4nc3N3C[C@H](C)O[C@H](C)C3)C2)n1	ZINC000450768263	GF	On-Demand	Anodyne	SMO	52	36
Cc1noc([C@@H]2CCN(c3nc4ccccc4nc3N3C[C@H](C)O[C@@H](C)C3)C2)n1	ZINC000450768264	GF	On-Demand	Anodyne	SMO	52	36
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4c(F)cccc34)C2)CC1	ZINC000450768288	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	32
CC(CO)(CO)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450768291	ED	On-Demand	Anodyne	PYGL	50	36
CC(CO)(CO)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450768291	ED	On-Demand	Anodyne	PYK	32	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4c(F)cccc34)C2)CC1	ZINC000450768306	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	32
CC(=O)N[C@H](C(=O)Nc1cccc(CCCO)c1)C(C)(C)C	ZINC000450768351	DE	On-Demand	Anodyne	MMP2	24	53
CC(=O)N[C@H](C(=O)Nc1cccc(CCCO)c1)C(C)(C)C	ZINC000450768351	DE	On-Demand	Anodyne	MMP3	22	45
CC[C@@H]1C[C@H]1C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450768370	CH	On-Demand	Anodyne	PRCP	46	34
CN(CCN[C@@H](c1ccc(F)cc1)c1cnn(C)c1)Cc1ccccc1	ZINC000450768374	FG	On-Demand	Anodyne	PLA2G7	44	33
CN(CCN[C@H](c1ccc(F)cc1)c1cnn(C)c1)Cc1ccccc1	ZINC000450768375	FG	On-Demand	Anodyne	PLA2G7	44	33
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768377	DE	On-Demand	Anodyne	MME	57	38
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768377	DE	On-Demand	Anodyne	PAPA1_CARPA	51	37
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768377	DE	On-Demand	Anodyne	CACNA1B	28	40
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768377	DE	On-Demand	Anodyne	CAPNS1	45	32
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768377	DE	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768377	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	34
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768378	DE	On-Demand	Anodyne	MME	57	38
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768378	DE	On-Demand	Anodyne	PAPA1_CARPA	51	37
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768378	DE	On-Demand	Anodyne	CACNA1B	28	40
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768378	DE	On-Demand	Anodyne	CAPNS1	45	32
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768378	DE	On-Demand	Anodyne	POL	0	41
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768378	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	34
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768379	DE	On-Demand	Anodyne	MME	57	38
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768379	DE	On-Demand	Anodyne	PAPA1_CARPA	51	37
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768379	DE	On-Demand	Anodyne	CACNA1B	28	40
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768379	DE	On-Demand	Anodyne	CAPNS1	45	32
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768379	DE	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450768379	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	34
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768380	DE	On-Demand	Anodyne	MME	57	38
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768380	DE	On-Demand	Anodyne	PAPA1_CARPA	51	37
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768380	DE	On-Demand	Anodyne	CACNA1B	28	40
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768380	DE	On-Demand	Anodyne	CAPNS1	45	32
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768380	DE	On-Demand	Anodyne	POL	0	41
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450768380	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	34
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450768389	FH	On-Demand	Anodyne	CCR1	41	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450768389	FH	On-Demand	Anodyne	AMP1_PLAFQ	19	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450768390	FH	On-Demand	Anodyne	CCR1	41	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450768390	FH	On-Demand	Anodyne	AMP1_PLAFQ	19	41
COc1cccc(OCCC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450768391	EG	On-Demand	Anodyne	HRH2	39	45
COc1cccc(OCCC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450768391	EG	On-Demand	Anodyne	MTNR1A	49	47
COc1cccc(OCCC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450768391	EG	On-Demand	Anodyne	MTNR1B	42	47
COc1cccc(OCCC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450768391	EG	On-Demand	Anodyne	TSPAN17	0	40
COc1cccc(OCCC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450768391	EG	On-Demand	Anodyne	CRTM	59	32
COc1cccc(OCCC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450768391	EG	On-Demand	Anodyne	PANK1	0	40
COc1cccc(OCCC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450768391	EG	On-Demand	Anodyne	PANK3	0	40
COc1cc(OC)c(Cn2nccc2NC(=O)CSC2CC2)c(OC)c1	ZINC000450768412	GF	On-Demand	Anodyne	ENPP1	40	31
COC(=O)CN1CCN(C(=O)c2ccc(C)c3c2CCC3)CC1	ZINC000450768440	DD	On-Demand	Anodyne	L3MBTL3	46	34
CCCOc1ccc(C(=O)Nc2cn(Cc3ccccc3)nn2)c(OC)c1	ZINC000450768447	FG	On-Demand	Anodyne	TSHR	63	35
CCCOc1ccc(C(=O)Nc2cn(Cc3ccccc3)nn2)c(OC)c1	ZINC000450768447	FG	On-Demand	Anodyne	PLA2G2A	50	34
CCCOc1ccc(C(=O)Nc2cn(Cc3ccccc3)nn2)c(OC)c1	ZINC000450768447	FG	On-Demand	Anodyne	LUCI_LUCLA	18	46
C=CCN(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450768449	CE	On-Demand	Mild	SHC	18	49
C=CCN(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450768449	CE	On-Demand	Mild	LSS	19	49
COc1ccc(NC(=O)[C@H](O)C2CCC2)cc1[N+](=O)[O-]	ZINC000450768464	CD	On-Demand	Bother	AADAC	0	42
COc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1[N+](=O)[O-]	ZINC000450768465	CD	On-Demand	Bother	AADAC	0	42
C[C@@H](OCCc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450768466	FF	On-Demand	Anodyne	SOAT1	27	43
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450768467	FF	On-Demand	Anodyne	SOAT1	27	43
C[C@H](OCCc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450768468	FF	On-Demand	Anodyne	SOAT1	27	43
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450768469	FF	On-Demand	Anodyne	SOAT1	27	43
CCN1C[C@H](Nc2cc(C(=O)NC3CC3)c3ccccc3n2)CC1=O	ZINC000450768473	ED	On-Demand	Anodyne	TNKS	49	30
CCN1C[C@@H](Nc2cc(C(=O)NC3CC3)c3ccccc3n2)CC1=O	ZINC000450768474	ED	On-Demand	Anodyne	TNKS	49	30
COC(=O)c1ccc(CN[C@H]2CCCC[C@H]2n2cccn2)cc1Cl	ZINC000450768478	EH	On-Demand	Anodyne	SSTR3	25	47
COC(=O)c1ccc(CN[C@@H]2CCCC[C@H]2n2cccn2)cc1Cl	ZINC000450768480	EH	On-Demand	Anodyne	SSTR3	25	47
COC(=O)c1ccc(CN[C@H]2CCCC[C@@H]2n2cccn2)cc1Cl	ZINC000450768482	EH	On-Demand	Anodyne	SSTR3	25	47
COC(=O)c1ccc(CN[C@@H]2CCCC[C@@H]2n2cccn2)cc1Cl	ZINC000450768484	EH	On-Demand	Anodyne	SSTR3	25	47
CO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450768496	CF	On-Demand	Anodyne	PDE3A	60	46
CO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450768496	CF	On-Demand	Anodyne	PDE3B	89	46
CO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450768497	CF	On-Demand	Anodyne	PDE3A	60	46
CO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450768497	CF	On-Demand	Anodyne	PDE3B	89	46
CO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450768499	CF	On-Demand	Anodyne	PDE3A	60	46
CO[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1C	ZINC000450768499	CF	On-Demand	Anodyne	PDE3B	89	46
CO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450768501	CF	On-Demand	Anodyne	PDE3A	60	46
CO[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C[C@H]1C	ZINC000450768501	CF	On-Demand	Anodyne	PDE3B	89	46
COCCC1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450768508	FF	On-Demand	Anodyne	DRD4	44	35
COCCC1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450768508	FF	On-Demand	Anodyne	HCN1	52	33
COCCC1(CNC(=O)c2cn(-c3cccc(OC)c3)nn2)CCCCC1	ZINC000450768508	FF	On-Demand	Anodyne	HCN4	49	33
COC(=O)[C@H](NC[C@@H]1CCCCC1(F)F)c1ccc(F)c(C)c1	ZINC000450768514	EH	On-Demand	Anodyne	LEF	45	36
COC(=O)[C@@H](NC[C@H]1CCCCC1(F)F)c1ccc(F)c(C)c1	ZINC000450768517	EH	On-Demand	Anodyne	LEF	45	36
COC(=O)[C@H](NC[C@H]1CCCCC1(F)F)c1ccc(F)c(C)c1	ZINC000450768518	EH	On-Demand	Anodyne	LEF	45	36
COC(=O)[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccc(F)c(C)c1	ZINC000450768519	EH	On-Demand	Anodyne	LEF	45	36
COC(=O)CN1CCN(C(=O)c2cnc(OC3CCOCC3)c(Cl)c2)CC1	ZINC000450768525	GD	On-Demand	Anodyne	LRRK2	31	42
CCC[C@@H](O)CN1CCC(c2c(F)cccc2F)CC1	ZINC000450768530	CG	On-Demand	Anodyne	VACHT_TETCF	0	41
CCC[C@@H](O)CN1CCC(c2c(F)cccc2F)CC1	ZINC000450768530	CG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	48
CCC[C@H](O)CN1CCC(c2c(F)cccc2F)CC1	ZINC000450768531	CG	On-Demand	Anodyne	VACHT_TETCF	0	41
CCC[C@H](O)CN1CCC(c2c(F)cccc2F)CC1	ZINC000450768531	CG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	48
CCCOc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)c(OC)c1	ZINC000450768532	GG	On-Demand	Anodyne	PTGER3	50	36
CCCOc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)c(OC)c1	ZINC000450768532	GG	On-Demand	Anodyne	TACR3	37	41
CCCOc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)c(OC)c1	ZINC000450768533	GG	On-Demand	Anodyne	PTGER3	50	36
CCCOc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)c(OC)c1	ZINC000450768533	GG	On-Demand	Anodyne	TACR3	37	41
CCOC(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450768540	FH	On-Demand	Bother	CACNA1C	29	40
CCOC(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450768540	FH	On-Demand	Bother	SLC27A4	58	38
CCOC(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450768541	FH	On-Demand	Bother	CACNA1C	29	40
CCOC(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450768541	FH	On-Demand	Bother	SLC27A4	58	38
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(=O)C2CC2)CC1	ZINC000450768554	FG	On-Demand	Anodyne	RBP4	57	35
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(=O)C2CC2)CC1	ZINC000450768554	FG	On-Demand	Anodyne	SFRP1	87	35
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(=O)C2CC2)CC1	ZINC000450768554	FG	On-Demand	Anodyne	WNT3	66	33
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(=O)C2CC2)CC1	ZINC000450768555	FG	On-Demand	Anodyne	RBP4	57	35
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(=O)C2CC2)CC1	ZINC000450768555	FG	On-Demand	Anodyne	SFRP1	87	35
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1(C(=O)C2CC2)CC1	ZINC000450768555	FG	On-Demand	Anodyne	WNT3	66	33
CO[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)CC1(C)C	ZINC000450768556	EE	On-Demand	Anodyne	HDAC1	29	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)CC1(C)C	ZINC000450768557	EE	On-Demand	Anodyne	HDAC1	29	42
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	HTR1A	22	44
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	ACHE	25	41
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	HTR2A	18	45
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	SLC6A1	48	33
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	DRD3	25	40
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	HTR7	30	44
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	HRH3	25	44
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	SIGMAR1	35	44
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	HTR5A	26	45
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	EBP	18	41
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	MMP9	15	40
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	MMP1	15	40
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	MCHR1	15	41
COc1ccc(CN2CCCN(CCCC(=O)c3ccccc3)CC2=O)cc1	ZINC000450768578	GG	On-Demand	Anodyne	CYP2J2	55	39
CCCNC(=O)c1ccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450768589	FH	On-Demand	Bother	HPGDS	15	40
CCCNC(=O)c1ccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1	ZINC000450768590	FH	On-Demand	Bother	HPGDS	15	40
Clc1cccc(Cl)c1N1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450768592	FG	On-Demand	Anodyne	DRD4	25	42
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000450768601	EG	On-Demand	Anodyne	PTGER4	18	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000450768602	EG	On-Demand	Anodyne	PTGER4	18	40
Cc1cc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c2ccccc2n1	ZINC000450768621	CF	On-Demand	Anodyne	METAP1	40	34
Cc1cc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c2ccccc2n1	ZINC000450768622	CF	On-Demand	Anodyne	METAP1	40	34
Cc1cc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c2ccccc2n1	ZINC000450768623	CF	On-Demand	Anodyne	METAP1	40	34
O=C(NC1CN(C(=O)c2cc(Cl)c(F)cc2Br)C1)C1CCC1	ZINC000450768630	GF	On-Demand	Anodyne	EPHX2	15	44
CNS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450768659	FD	On-Demand	Bother	BCL2L1	40	32
CNS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450768660	FD	On-Demand	Bother	BCL2L1	40	32
CNS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450768661	FD	On-Demand	Bother	BCL2L1	40	32
CNS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450768662	FD	On-Demand	Bother	BCL2L1	40	32
OC1(Cc2ccc(F)cc2)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450768674	GH	On-Demand	Anodyne	SIGMAR1	41	40
CNC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450768678	DD	On-Demand	Bother	TAAR1	18	45
CNC(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450768679	DD	On-Demand	Bother	TAAR1	18	45
CNC(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c([N+](=O)[O-])c1	ZINC000450768680	DD	On-Demand	Bother	TAAR1	18	45
CCOC(=O)c1ccc(CN2CCC([C@@H](C)NC(C)=O)CC2)nc1	ZINC000450768683	ED	On-Demand	Anodyne	SSTR5	46	38
CCOC(=O)c1ccc(CN2CCC([C@H](C)NC(C)=O)CC2)nc1	ZINC000450768684	ED	On-Demand	Anodyne	SSTR5	46	38
O=C(NCC(=O)N1CCOC[C@H]1[C@H]1CCCC1=O)Nc1cccc(Cl)c1	ZINC000450768689	GE	On-Demand	Anodyne	EPHX2	19	45
O=C(NCC(=O)N1CCOC[C@H]1[C@@H]1CCCC1=O)Nc1cccc(Cl)c1	ZINC000450768690	GE	On-Demand	Anodyne	EPHX2	19	45
O=C(NCC(=O)N1CCOC[C@@H]1[C@H]1CCCC1=O)Nc1cccc(Cl)c1	ZINC000450768691	GE	On-Demand	Anodyne	EPHX2	19	45
O=C(NCC(=O)N1CCOC[C@@H]1[C@@H]1CCCC1=O)Nc1cccc(Cl)c1	ZINC000450768692	GE	On-Demand	Anodyne	EPHX2	19	45
CC(C)c1nnc(SCn2cccn2)n1Cc1ccco1	ZINC000450768733	DF	On-Demand	Anodyne	HCRTR2	0	41
CC(CO)(CO)NC(=O)c1ccc(I)cc1F	ZINC000450768736	FC	On-Demand	Anodyne	MAP2K1	43	36
O=C(CCCN1CCn2ncnc2C1)c1ccccc1	ZINC000450768739	CD	On-Demand	Anodyne	HTR2A	16	50
O=C(CCCN1CCn2ncnc2C1)c1ccccc1	ZINC000450768739	CD	On-Demand	Anodyne	HTR5A	21	50
O=C(CCCN1CCn2ncnc2C1)c1ccccc1	ZINC000450768739	CD	On-Demand	Anodyne	CYP2J2	56	39
Cc1cc(-c2nc(C(=O)NC(C)(CO)CO)co2)ccn1	ZINC000450768747	CC	On-Demand	Anodyne	IRAK4	22	44
CCOCCCN1CC[C@H](NCc2ccc(C(=O)OC)c(Cl)c2)[C@H](C)C1	ZINC000450768768	GG	On-Demand	Anodyne	HTR4	48	36
CCOCCCN1CC[C@@H](NCc2ccc(C(=O)OC)c(Cl)c2)[C@H](C)C1	ZINC000450768769	GG	On-Demand	Anodyne	HTR4	48	36
CCOCCCN1CC[C@@H](NCc2ccc(C(=O)OC)c(Cl)c2)[C@@H](C)C1	ZINC000450768770	GG	On-Demand	Anodyne	HTR4	48	36
CCOCCCN1CC[C@H](NCc2ccc(C(=O)OC)c(Cl)c2)[C@@H](C)C1	ZINC000450768771	GG	On-Demand	Anodyne	HTR4	48	36
COC(=O)c1ccc(C(=O)CSc2nnc(C(C)C)n2Cc2ccco2)o1	ZINC000450768774	GG	On-Demand	Anodyne	HCRTR2	21	43
Cc1noc([C@@H]2CCN(c3cccc(C(=O)OC(C)(C)C)n3)C2)n1	ZINC000450768793	EF	On-Demand	Anodyne	ETHR	42	35
Cc1noc([C@H]2CCN(c3cccc(C(=O)OC(C)(C)C)n3)C2)n1	ZINC000450768794	EF	On-Demand	Anodyne	ETHR	42	35
CC(C)(CO)C(C)(C)NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450768804	EE	On-Demand	Anodyne	LPXC	0	40
FC1(Cc2ccc(Cl)cc2)CCN(c2ncccn2)CC1	ZINC000450768888	DH	On-Demand	Anodyne	AKT2	26	42
COCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450768894	DD	On-Demand	Anodyne	DRD4	40	31
COCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450768894	DD	On-Demand	Anodyne	HDAC1	0	42
COCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450768894	DD	On-Demand	Anodyne	HPGDS	28	40
COCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450768894	DD	On-Demand	Anodyne	PARE	42	38
COCCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450768895	DD	On-Demand	Anodyne	DRD4	40	31
COCCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450768895	DD	On-Demand	Anodyne	HDAC1	0	42
COCCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450768895	DD	On-Demand	Anodyne	HPGDS	28	40
COCCNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450768895	DD	On-Demand	Anodyne	PARE	42	38
COCCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450768896	DD	On-Demand	Anodyne	DRD4	40	31
COCCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450768896	DD	On-Demand	Anodyne	HDAC1	0	42
COCCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450768896	DD	On-Demand	Anodyne	HPGDS	28	40
COCCNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450768896	DD	On-Demand	Anodyne	PARE	42	38
COCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450768897	DD	On-Demand	Anodyne	DRD4	40	31
COCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450768897	DD	On-Demand	Anodyne	HDAC1	0	42
COCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450768897	DD	On-Demand	Anodyne	HPGDS	28	40
COCCNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450768897	DD	On-Demand	Anodyne	PARE	42	38
CO[C@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1C	ZINC000450768918	CF	On-Demand	Anodyne	PDE3A	51	38
CO[C@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1C	ZINC000450768918	CF	On-Demand	Anodyne	PDE3B	75	39
CO[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1C	ZINC000450768920	CF	On-Demand	Anodyne	PDE3A	51	38
CO[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1C	ZINC000450768920	CF	On-Demand	Anodyne	PDE3B	75	39
CO[C@H]1CCN(c2ncnc3cccc(F)c23)C[C@H]1C	ZINC000450768921	CF	On-Demand	Anodyne	PDE3A	51	38
CO[C@H]1CCN(c2ncnc3cccc(F)c23)C[C@H]1C	ZINC000450768921	CF	On-Demand	Anodyne	PDE3B	75	39
CO[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@H]1C	ZINC000450768922	CF	On-Demand	Anodyne	PDE3A	51	38
CO[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@H]1C	ZINC000450768922	CF	On-Demand	Anodyne	PDE3B	75	39
COc1ccccc1-n1cnc2cc(C(=O)N3CC(O)(CC#N)C3)ccc21	ZINC000450768939	FE	On-Demand	Mild	HPGD	56	66
CCN1C[C@H](Nc2ncnc3ccc(C)cc23)CC1=O	ZINC000450768950	CD	On-Demand	Anodyne	CD38	57	40
CCN1C[C@@H](Nc2ncnc3ccc(C)cc23)CC1=O	ZINC000450768953	CD	On-Demand	Anodyne	CD38	57	40
Cc1ccnc(OC2CCN(C(=O)Cc3cc4ccccc4s3)CC2)c1	ZINC000450768970	FI	On-Demand	Anodyne	HCRTR1	0	40
Cc1ccnc(OC2CCN(C(=O)Cc3cc4ccccc4s3)CC2)c1	ZINC000450768970	FI	On-Demand	Anodyne	HCRTR2	17	40
CCN1C[C@H](Nc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450768997	ED	On-Demand	Bother	TAAR1	17	40
CCN1C[C@@H](Nc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450768999	ED	On-Demand	Bother	TAAR1	17	40
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450769002	GF	On-Demand	Anodyne	SCD1	15	40
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450769002	GF	On-Demand	Anodyne	SCD	16	40
Cn1cnc(-c2ccc(NC(=O)[C@H](O)C3CCC3)cc2)n1	ZINC000450769005	CD	On-Demand	Anodyne	SCARB1	40	35
Cn1cnc(-c2ccc(NC(=O)[C@@H](O)C3CCC3)cc2)n1	ZINC000450769007	CD	On-Demand	Anodyne	SCARB1	40	35
CCC(CC)Oc1ccc(C(=O)NCCC(C)(C)O)cc1	ZINC000450769022	CG	On-Demand	Anodyne	KCNQ1	0	53
COc1ccc(Oc2ccc(C(=O)NCCC(C)(C)O)nc2)cc1	ZINC000450769023	EF	On-Demand	Anodyne	PROKR1	43	31
Cc1ccn(-c2ccccc2C(=O)N2Cc3ccccc3C3(CC3)C2)n1	ZINC000450769026	EH	On-Demand	Anodyne	AVPR2	26	45
Cc1ccn(-c2ccccc2C(=O)N2Cc3ccccc3C3(CC3)C2)n1	ZINC000450769026	EH	On-Demand	Anodyne	AVPR1A	24	42
Cc1ccn(-c2ccccc2C(=O)N2Cc3ccccc3C3(CC3)C2)n1	ZINC000450769026	EH	On-Demand	Anodyne	BCL2	0	44
COc1ccc(-c2noc(CN(CC(C)C)[C@H]3CCCc4cccnc43)n2)nn1	ZINC000450769034	GG	On-Demand	Anodyne	CXCR4	80	43
COc1ccc(-c2noc(CN(CC(C)C)[C@@H]3CCCc4cccnc43)n2)nn1	ZINC000450769046	GG	On-Demand	Anodyne	CXCR4	80	43
COc1ccc(Cn2nnnc2S[C@H](C)C(=O)C2CCOCC2)cc1	ZINC000450769073	FE	On-Demand	Anodyne	PROKR1	41	30
COc1ccc(Cn2nnnc2S[C@@H](C)C(=O)C2CCOCC2)cc1	ZINC000450769074	FE	On-Demand	Anodyne	PROKR1	41	30
CO[C@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc23)C[C@H]1C	ZINC000450769096	DG	On-Demand	Bother	PDE3B	54	33
COc1ccc(CNC(=O)CCN(C)[C@@H](C)C(=O)NC(C)(C)C)c(OC)c1	ZINC000450769100	GD	On-Demand	Anodyne	MTNR1A	50	40
COc1ccc(CNC(=O)CCN(C)[C@@H](C)C(=O)NC(C)(C)C)c(OC)c1	ZINC000450769100	GD	On-Demand	Anodyne	MTNR1B	42	40
COc1ccc(CNC(=O)CCN(C)[C@H](C)C(=O)NC(C)(C)C)c(OC)c1	ZINC000450769101	GD	On-Demand	Anodyne	MTNR1A	50	40
COc1ccc(CNC(=O)CCN(C)[C@H](C)C(=O)NC(C)(C)C)c(OC)c1	ZINC000450769101	GD	On-Demand	Anodyne	MTNR1B	42	40
CO[C@@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc23)C[C@H]1C	ZINC000450769102	DG	On-Demand	Bother	PDE3B	54	33
COc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1[N+](=O)[O-]	ZINC000450769103	DF	On-Demand	Bother	ENPP1	50	31
CO[C@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc23)C[C@@H]1C	ZINC000450769104	DG	On-Demand	Bother	PDE3B	54	33
CO[C@@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc23)C[C@@H]1C	ZINC000450769106	DG	On-Demand	Bother	PDE3B	54	33
COc1cccc2c(N3CC[C@H](OC)[C@H](C)C3)nccc12	ZINC000450769118	CG	On-Demand	Anodyne	PDE3A	30	44
COc1cccc2c(N3CC[C@@H](OC)[C@H](C)C3)nccc12	ZINC000450769119	CG	On-Demand	Anodyne	PDE3A	30	44
COc1cccc2c(N3CC[C@@H](OC)[C@@H](C)C3)nccc12	ZINC000450769120	CG	On-Demand	Anodyne	PDE3A	30	44
COc1cccc2c(N3CC[C@H](OC)[C@@H](C)C3)nccc12	ZINC000450769122	CG	On-Demand	Anodyne	PDE3A	30	44
Cc1sccc1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450769123	FI	On-Demand	Anodyne	RBP4	74	35
Cc1sccc1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450769123	FI	On-Demand	Anodyne	SFRP1	78	34
Cc1sccc1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450769123	FI	On-Demand	Anodyne	WNT3	40	32
Cc1sccc1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450769124	FI	On-Demand	Anodyne	RBP4	74	35
Cc1sccc1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450769124	FI	On-Demand	Anodyne	SFRP1	78	34
Cc1sccc1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450769124	FI	On-Demand	Anodyne	WNT3	40	32
C=CCN(C)CCCC(=O)c1ccccc1	ZINC000450769141	BF	On-Demand	Mild	THRA	24	42
C=CCN(C)CCCC(=O)c1ccccc1	ZINC000450769141	BF	On-Demand	Mild	LSS	74	47
C=CCN(C)CCCC(=O)c1ccccc1	ZINC000450769141	BF	On-Demand	Mild	CYP2J2	44	34
C[C@@H](C(=O)NC(C)(C)C)N(C)CCCC(=O)c1ccccc1	ZINC000450769142	DF	On-Demand	Anodyne	CACNA1B	25	42
C[C@H](C(=O)NC(C)(C)C)N(C)CCCC(=O)c1ccccc1	ZINC000450769143	DF	On-Demand	Anodyne	CACNA1B	25	42
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	MME	63	42
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	ANPEP	54	41
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	FCER2	47	34
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	PTGER3	49	37
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	CAPNS1	60	33
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	MMP2	29	41
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	MMP3	29	42
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	MMP8	47	39
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	MMP14	35	41
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	SOAT1	27	42
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	REN	15	40
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	CAPN1	58	41
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	MMP9	23	41
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	CAPN2	64	36
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	MMP7	53	42
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	MMP1	38	41
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	FPR1	47	34
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	NPR	49	39
CC(C)CC(CC(C)C)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769144	EH	On-Demand	Anodyne	GPR88	0	44
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	MME	63	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	ANPEP	54	41
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	FCER2	47	34
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	PTGER3	49	37
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	CAPNS1	60	33
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	MMP2	29	41
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	MMP3	29	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	MMP8	47	39
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	MMP14	35	41
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	SOAT1	27	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	REN	15	40
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	CAPN1	58	41
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	MMP9	23	41
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	CAPN2	64	36
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	MMP7	53	42
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	MMP1	38	41
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	FPR1	47	34
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	NPR	49	39
CC(C)CC(CC(C)C)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450769145	EH	On-Demand	Anodyne	GPR88	0	44
CC(C)(C)[C@@H](CO)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450769146	ED	On-Demand	Anodyne	CA2	23	42
CO[C@@H]1CCN(c2cc(N3CCSCC3)ncn2)C[C@H]1C	ZINC000450769177	DD	On-Demand	Anodyne	PDE3A	42	32
CO[C@H]1CCN(c2cc(N3CCSCC3)ncn2)C[C@H]1C	ZINC000450769179	DD	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(N3CCSCC3)ncn2)C[C@@H]1C	ZINC000450769180	DD	On-Demand	Anodyne	PDE3A	42	32
CO[C@H]1CCN(c2cc(N3CCSCC3)ncn2)C[C@@H]1C	ZINC000450769181	DD	On-Demand	Anodyne	PDE3A	42	32
COc1cc(CN(C)[C@H](C)C(=O)NC(C)(C)C)ccc1Cl	ZINC000450769183	DG	On-Demand	Anodyne	CAN2	0	40
COc1cc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)ccc1Cl	ZINC000450769186	DG	On-Demand	Anodyne	CAN2	0	40
CC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769190	GF	On-Demand	Anodyne	MTNR1A	30	44
CC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769190	GF	On-Demand	Anodyne	MTNR1B	0	44
CC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769190	GF	On-Demand	Anodyne	RBP4	48	35
CC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769190	GF	On-Demand	Anodyne	BIRC2	40	41
CC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769190	GF	On-Demand	Anodyne	SFRP1	113	36
CC(=O)N[C@H](C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769190	GF	On-Demand	Anodyne	WNT3	72	36
CC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769191	GF	On-Demand	Anodyne	MTNR1A	30	44
CC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769191	GF	On-Demand	Anodyne	MTNR1B	0	44
CC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769191	GF	On-Demand	Anodyne	RBP4	48	35
CC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769191	GF	On-Demand	Anodyne	BIRC2	40	41
CC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769191	GF	On-Demand	Anodyne	SFRP1	113	36
CC(=O)N[C@H](C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C(C)(C)C	ZINC000450769191	GF	On-Demand	Anodyne	WNT3	72	36
C[C@@H](O)CCCn1cnc2cc(-c3ccccc3)sc2c1=O	ZINC000450769235	DG	On-Demand	Anodyne	MCHR1	33	44
C[C@H](O)CCCn1cnc2cc(-c3ccccc3)sc2c1=O	ZINC000450769236	DG	On-Demand	Anodyne	MCHR1	33	44
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000450769264	FH	On-Demand	Anodyne	P2RX7	35	40
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000450769264	FH	On-Demand	Anodyne	EPHX2	22	43
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000450769265	FH	On-Demand	Anodyne	P2RX7	35	40
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000450769265	FH	On-Demand	Anodyne	EPHX2	22	43
COc1cc(CC(=O)NC(C)(C)C(C)(C)CO)ccc1O	ZINC000450769290	CD	On-Demand	Anodyne	CAN2	0	48
Cc1noc([C@H]2CCN(c3cnn(-c4ccc(F)cc4F)c(=O)c3Cl)C2)n1	ZINC000450769310	GF	On-Demand	Anodyne	PRCP	41	34
Cc1noc([C@@H]2CCN(c3cnn(-c4ccc(F)cc4F)c(=O)c3Cl)C2)n1	ZINC000450769311	GF	On-Demand	Anodyne	PRCP	41	34
O=C(NCCO)c1ccc(N2C[C@H]3CCCC[C@H]3C2)nn1	ZINC000450769319	CC	On-Demand	Anodyne	SCD1	39	43
O=C(NCCO)c1ccc(N2C[C@H]3CCCC[C@H]3C2)nn1	ZINC000450769319	CC	On-Demand	Anodyne	SCD	24	46
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1	ZINC000450769338	CD	On-Demand	Anodyne	PTGS2	42	36
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1	ZINC000450769338	CD	On-Demand	Anodyne	GPR119	19	46
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)cc1	ZINC000450769339	CD	On-Demand	Anodyne	PTGS2	42	36
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)cc1	ZINC000450769339	CD	On-Demand	Anodyne	GPR119	19	46
CS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1	ZINC000450769340	CD	On-Demand	Anodyne	PTGS2	42	36
CS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1	ZINC000450769340	CD	On-Demand	Anodyne	GPR119	19	46
Cc1nccc(N2CC[C@@H](c3cccc(Br)c3)C2)n1	ZINC000450769346	DH	On-Demand	Anodyne	SORD	53	39
Cc1nccc(N2CC[C@H](c3cccc(Br)c3)C2)n1	ZINC000450769347	DH	On-Demand	Anodyne	SORD	53	39
N#CCC1(O)CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450769385	FE	On-Demand	Mild	HRH4	15	45
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2cc3ccccc3s2)CC1	ZINC000450769400	GI	On-Demand	Anodyne	CCR8	31	42
CCN(CC)C(=O)CCC1CCN(C(=O)Cc2cc3ccccc3s2)CC1	ZINC000450769400	GI	On-Demand	Anodyne	ETHR	46	32
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	THRA	0	40
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	DRD2	35	47
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	DRD1	23	51
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	DRD4	27	47
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	HTR2A	33	54
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	HTR2C	24	61
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	ERG2	22	47
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	PRCP	22	40
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	PLD1	41	35
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	SLC18A3	0	48
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	HTR3B	0	47
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	CYP2J2	63	44
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769406	EG	On-Demand	Anodyne	AP2S1	0	47
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	THRA	0	40
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	DRD2	35	47
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	DRD1	23	51
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	DRD4	27	47
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	HTR2A	33	54
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	HTR2C	24	61
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	ERG2	22	47
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	PRCP	22	40
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	PLD1	41	35
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	SLC18A3	0	48
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	HTR3B	0	47
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	CYP2J2	63	44
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450769408	EG	On-Demand	Anodyne	AP2S1	0	47
FC(F)(F)c1ccccc1OCC1CCN(Cc2cnn[nH]2)CC1	ZINC000450769423	EG	On-Demand	Anodyne	HTR4	43	35
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2	ZINC000450769445	FI	On-Demand	Anodyne	KCNQ2	46	36
OC[C@H](C1CC1)[C@@H](Nc1cc(NCC2CC2)ncn1)C1CC1	ZINC000450769447	DF	On-Demand	Anodyne	GPR39	0	45
OC[C@H](C1CC1)[C@H](Nc1cc(NCC2CC2)ncn1)C1CC1	ZINC000450769448	DF	On-Demand	Anodyne	GPR39	0	45
OC[C@@H](C1CC1)[C@H](Nc1cc(NCC2CC2)ncn1)C1CC1	ZINC000450769449	DF	On-Demand	Anodyne	GPR39	0	45
OC[C@@H](C1CC1)[C@@H](Nc1cc(NCC2CC2)ncn1)C1CC1	ZINC000450769450	DF	On-Demand	Anodyne	GPR39	0	45
CC1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CCC(=O)CC1	ZINC000450769455	FH	On-Demand	Anodyne	RBP4	74	43
CC1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CCC(=O)CC1	ZINC000450769456	FH	On-Demand	Anodyne	RBP4	74	43
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2	ZINC000450769463	FI	On-Demand	Anodyne	KCNQ2	46	36
CC(C)OC(=O)[C@@H](Nc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000450769464	CF	On-Demand	Bother	PGR	0	40
CC(C)OC(=O)[C@@H](Nc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000450769464	CF	On-Demand	Bother	AR	0	40
COC(=O)[C@@H](NCc1ccc(Cl)c(OC)c1)c1ccc(F)c(C)c1	ZINC000450769512	FH	On-Demand	Anodyne	LEF	41	36
COC(=O)[C@H](NCc1ccc(Cl)c(OC)c1)c1ccc(F)c(C)c1	ZINC000450769514	FH	On-Demand	Anodyne	LEF	41	36
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	CHRM2	23	41
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	ACE	43	36
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	DRD4	26	42
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	OPRM1	16	41
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	DRD3	23	44
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	CHRM3	31	41
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	LTA4H	19	44
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	SIGMAR1	34	43
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	CCR3	29	40
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	EPHX2	23	44
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	MCHR1	21	41
CNC(=O)N[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769522	CD	On-Demand	Anodyne	BIRC2	78	40
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	CHRM2	23	41
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	ACE	43	36
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	DRD4	26	42
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	OPRM1	16	41
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	DRD3	23	44
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	CHRM3	31	41
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	LTA4H	19	44
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	SIGMAR1	34	43
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	CCR3	29	40
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	EPHX2	23	44
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	MCHR1	21	41
CNC(=O)N[C@H]1CCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450769525	CD	On-Demand	Anodyne	BIRC2	78	40
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	CHRM2	23	41
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	ACE	43	36
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	DRD4	26	42
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	OPRM1	16	41
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	DRD3	23	44
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	CHRM3	31	41
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	LTA4H	19	44
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	SIGMAR1	34	43
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	CCR3	29	40
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	EPHX2	23	44
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	MCHR1	21	41
CNC(=O)N[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769526	CD	On-Demand	Anodyne	BIRC2	78	40
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	CHRM2	23	41
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	ACE	43	36
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	DRD4	26	42
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	OPRM1	16	41
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	DRD3	23	44
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	CHRM3	31	41
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	LTA4H	19	44
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	SIGMAR1	34	43
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	CCR3	29	40
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	EPHX2	23	44
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	MCHR1	21	41
CNC(=O)N[C@H]1CCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450769527	CD	On-Demand	Anodyne	BIRC2	78	40
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nnc(C2CC2)o1	ZINC000450769530	EG	On-Demand	Anodyne	CCR2	44	35
CO[C@@H]1CCN(c2cc(N(C)c3ccccc3)ncn2)C[C@H]1C	ZINC000450769537	DG	On-Demand	Anodyne	PDE3A	41	34
CO[C@@H]1CCN(c2cc(N(C)c3ccccc3)ncn2)C[C@@H]1C	ZINC000450769539	DG	On-Demand	Anodyne	PDE3A	41	34
CO[C@H]1CCN(c2cc(N(C)c3ccccc3)ncn2)C[C@@H]1C	ZINC000450769540	DG	On-Demand	Anodyne	PDE3A	41	34
CO[C@H]1CCN(c2cc(N(C)c3ccccc3)ncn2)C[C@H]1C	ZINC000450769541	DG	On-Demand	Anodyne	PDE3A	41	34
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769548	FH	On-Demand	Anodyne	MTNR1A	30	40
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769548	FH	On-Demand	Anodyne	MTNR1B	0	43
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769548	FH	On-Demand	Anodyne	RBP4	67	37
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769548	FH	On-Demand	Anodyne	SFRP1	88	35
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769548	FH	On-Demand	Anodyne	WNT3	64	33
COc1cc(CC(=O)NCCC(C)(C)O)ccc1Cl	ZINC000450769551	CE	On-Demand	Anodyne	TRPV1	26	50
COc1cc(CC(=O)NCCC(C)(C)O)ccc1Cl	ZINC000450769551	CE	On-Demand	Anodyne	NCE103	34	54
COc1cc(CC(=O)NCCC(C)(C)O)ccc1Cl	ZINC000450769551	CE	On-Demand	Anodyne	CAN2	0	54
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769555	FH	On-Demand	Anodyne	MTNR1A	30	40
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769555	FH	On-Demand	Anodyne	MTNR1B	0	43
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769555	FH	On-Demand	Anodyne	RBP4	67	37
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769555	FH	On-Demand	Anodyne	SFRP1	88	35
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450769555	FH	On-Demand	Anodyne	WNT3	64	33
CO[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450769568	DI	On-Demand	Anodyne	PDE3A	44	35
CO[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450769568	DI	On-Demand	Anodyne	PDE3B	64	34
CO[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450769568	DI	On-Demand	Anodyne	LIPG	46	33
CO[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450769572	DI	On-Demand	Anodyne	PDE3A	44	35
CO[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450769572	DI	On-Demand	Anodyne	PDE3B	64	34
CO[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@H]1C	ZINC000450769572	DI	On-Demand	Anodyne	LIPG	46	33
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(Cl)cc3F)C2)CC1	ZINC000450769573	FF	On-Demand	Anodyne	PB2	0	43
CO[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450769575	DI	On-Demand	Anodyne	PDE3A	44	35
CO[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450769575	DI	On-Demand	Anodyne	PDE3B	64	34
CO[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450769575	DI	On-Demand	Anodyne	LIPG	46	33
CO[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450769577	DI	On-Demand	Anodyne	PDE3A	44	35
CO[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450769577	DI	On-Demand	Anodyne	PDE3B	64	34
CO[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C[C@@H]1C	ZINC000450769577	DI	On-Demand	Anodyne	LIPG	46	33
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(Cl)cc3F)C2)CC1	ZINC000450769578	FF	On-Demand	Anodyne	PB2	0	43
CC(F)(F)c1ccc(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)cn1	ZINC000450769579	GI	On-Demand	Anodyne	HPGDS	37	43
O=C(c1csc(Nc2cc(F)cc(F)c2)n1)N1CCC[C@@H]1CO	ZINC000450769604	EE	On-Demand	Anodyne	SPHK2	70	37
O=C(c1csc(Nc2cc(F)cc(F)c2)n1)N1CCC[C@@H]1CO	ZINC000450769604	EE	On-Demand	Anodyne	SPHK1	61	34
O=C(c1csc(Nc2cc(F)cc(F)c2)n1)N1CCC[C@@H]1CO	ZINC000450769604	EE	On-Demand	Anodyne	TRPC6	82	52
O=C(c1csc(Nc2cc(F)cc(F)c2)n1)N1CCC[C@@H]1CO	ZINC000450769604	EE	On-Demand	Anodyne	TRPC3	90	52
COc1cccc(-n2cc(C(=O)N[C@@H]3CCCO[C@H]3CC(C)C)nn2)c1	ZINC000450769612	FF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(-n2cc(C(=O)N[C@H]3CCCO[C@@H]3CC(C)C)nn2)c1	ZINC000450769613	FF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(-n2cc(C(=O)N[C@@H]3CCCO[C@@H]3CC(C)C)nn2)c1	ZINC000450769614	FF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(-n2cc(C(=O)N[C@H]3CCCO[C@H]3CC(C)C)nn2)c1	ZINC000450769617	FF	On-Demand	Anodyne	DRD4	40	31
O=C(c1cncc(Cl)c1)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450769638	EG	On-Demand	Anodyne	AVPR1A	0	42
O=C(c1cncc(Cl)c1)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450769640	EG	On-Demand	Anodyne	AVPR1A	0	42
COCCC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450769642	GF	On-Demand	Anodyne	SLC6A9	45	35
COCCC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450769642	GF	On-Demand	Anodyne	HCN1	52	32
COCCC1(CNC(=O)c2ccc(-n3nnnc3C)cc2F)CCCCC1	ZINC000450769642	GF	On-Demand	Anodyne	HCN4	50	32
CC(C)(C)[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450769647	CE	On-Demand	Anodyne	SELE	68	37
CC(C)(C)[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450769647	CE	On-Demand	Anodyne	ICAM1	65	37
CC(C)(C)[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450769647	CE	On-Demand	Anodyne	VCAM1	45	33
CCc1cccc(C(=O)NCCCCCS(C)(=O)=O)n1	ZINC000450769648	CD	On-Demand	Anodyne	PDE5A	25	48
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C[C@H]1C	ZINC000450769659	EE	On-Demand	Anodyne	PDE3B	41	35
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C[C@H]1C	ZINC000450769662	EE	On-Demand	Anodyne	PDE3B	41	35
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C[C@@H]1C	ZINC000450769664	EE	On-Demand	Anodyne	PDE3B	41	35
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C[C@@H]1C	ZINC000450769666	EE	On-Demand	Anodyne	PDE3B	41	35
CN(Cc1ccccc1)[C@@H](CNC(=O)Cc1ccc(O)c(F)c1)C1CC1	ZINC000450769683	FG	On-Demand	Anodyne	TRPV1	0	45
CN(Cc1ccccc1)[C@@H](CNC(=O)Cc1ccc(O)c(F)c1)C1CC1	ZINC000450769683	FG	On-Demand	Anodyne	NCE103	19	40
CN(Cc1ccccc1)[C@@H](CNC(=O)Cc1ccc(O)c(F)c1)C1CC1	ZINC000450769683	FG	On-Demand	Anodyne	CAN2	0	40
CN(Cc1ccccc1)[C@H](CNC(=O)Cc1ccc(O)c(F)c1)C1CC1	ZINC000450769685	FG	On-Demand	Anodyne	TRPV1	0	45
CN(Cc1ccccc1)[C@H](CNC(=O)Cc1ccc(O)c(F)c1)C1CC1	ZINC000450769685	FG	On-Demand	Anodyne	NCE103	19	40
CN(Cc1ccccc1)[C@H](CNC(=O)Cc1ccc(O)c(F)c1)C1CC1	ZINC000450769685	FG	On-Demand	Anodyne	CAN2	0	40
CC(=O)N1CCN(C(=O)C2CCN(c3ncnc4c(C)cccc34)CC2)CC1	ZINC000450769686	GD	On-Demand	Anodyne	LIMK2	21	42
CCc1cc(CCCN2CCC[C@H](C(=O)OC(C)(C)C)C2)on1	ZINC000450769713	DG	On-Demand	Anodyne	SLC6A1	66	35
CCc1cc(CCCN2CCC[C@@H](C(=O)OC(C)(C)C)C2)on1	ZINC000450769715	DG	On-Demand	Anodyne	SLC6A1	66	35
CO[C@@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450769729	EF	On-Demand	Bother	TAAR1	24	51
CO[C@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450769730	EF	On-Demand	Bother	TAAR1	24	51
CO[C@@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450769731	EF	On-Demand	Bother	TAAR1	24	51
CO[C@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450769732	EF	On-Demand	Bother	TAAR1	24	51
Cc1cc(C(F)(F)F)ccc1C(=O)NCCC(C)(C)O	ZINC000450769736	CF	On-Demand	Anodyne	PPARD	24	40
CCOC(=O)[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450769737	EF	On-Demand	Anodyne	ACE	22	40
CCOC(=O)[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450769737	EF	On-Demand	Anodyne	HRH3	0	42
CCOC(=O)[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450769737	EF	On-Demand	Anodyne	PREP	61	41
CO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1C	ZINC000450769739	EF	On-Demand	Anodyne	MMP13	17	41
CO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1C	ZINC000450769739	EF	On-Demand	Anodyne	ALK	18	43
CO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1C	ZINC000450769740	EF	On-Demand	Anodyne	MMP13	17	41
CO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1C	ZINC000450769740	EF	On-Demand	Anodyne	ALK	18	43
CO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H]1C	ZINC000450769741	EF	On-Demand	Anodyne	MMP13	17	41
CO[C@@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H]1C	ZINC000450769741	EF	On-Demand	Anodyne	ALK	18	43
CO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H]1C	ZINC000450769742	EF	On-Demand	Anodyne	MMP13	17	41
CO[C@H]1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H]1C	ZINC000450769742	EF	On-Demand	Anodyne	ALK	18	43
CNC(=O)c1ccc(N[C@@H](C(C)C)[C@@H](CO)C(C)C)c([N+](=O)[O-])c1	ZINC000450769748	EF	On-Demand	Bother	TAAR1	15	44
CNC(=O)c1ccc(N[C@@H](C(C)C)[C@H](CO)C(C)C)c([N+](=O)[O-])c1	ZINC000450769749	EF	On-Demand	Bother	TAAR1	15	44
CNC(=O)c1ccc(N[C@H](C(C)C)[C@H](CO)C(C)C)c([N+](=O)[O-])c1	ZINC000450769750	EF	On-Demand	Bother	TAAR1	15	44
CNC(=O)c1ccc(N[C@H](C(C)C)[C@@H](CO)C(C)C)c([N+](=O)[O-])c1	ZINC000450769751	EF	On-Demand	Bother	TAAR1	15	44
Cn1c(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)c2n(c1=O)CCCC2	ZINC000450769773	GG	On-Demand	Anodyne	UTS2R	45	31
Cn1c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)c2n(c1=O)CCCC2	ZINC000450769774	GG	On-Demand	Anodyne	UTS2R	45	31
Cn1c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)c2n(c1=O)CCCC2	ZINC000450769775	GG	On-Demand	Anodyne	UTS2R	45	31
Cn1c(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)c2n(c1=O)CCCC2	ZINC000450769776	GG	On-Demand	Anodyne	UTS2R	45	31
CCCc1cc(N[C@H](C(C)C)[C@H](CO)C(C)C)n2ncnc2n1	ZINC000450769798	DF	On-Demand	Anodyne	DHOD	0	41
CCCc1cc(N[C@H](C(C)C)[C@@H](CO)C(C)C)n2ncnc2n1	ZINC000450769799	DF	On-Demand	Anodyne	DHOD	0	41
CCCc1cc(N[C@@H](C(C)C)[C@@H](CO)C(C)C)n2ncnc2n1	ZINC000450769800	DF	On-Demand	Anodyne	DHOD	0	41
CCCc1cc(N[C@@H](C(C)C)[C@H](CO)C(C)C)n2ncnc2n1	ZINC000450769801	DF	On-Demand	Anodyne	DHOD	0	41
CSc1cccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c1	ZINC000450769815	GG	On-Demand	Anodyne	SCD1	18	41
CSc1cccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c1	ZINC000450769815	GG	On-Demand	Anodyne	SCD	18	41
CSc1cccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c1	ZINC000450769815	GG	On-Demand	Anodyne	SLC6A7	0	42
O=C(CCc1nc2cnccc2[nH]1)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450769816	FG	On-Demand	Anodyne	PARP3	22	40
O=C(CCc1nc2cnccc2[nH]1)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450769817	FG	On-Demand	Anodyne	PARP3	22	40
O=C(NC1CCC(c2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450769820	FH	On-Demand	Anodyne	SSTR5	30	41
O=C(NC1CCC(c2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450769820	FH	On-Demand	Anodyne	MAPK13	40	34
O=C(NC1CCC(c2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450769820	FH	On-Demand	Anodyne	FASN	31	47
O=C(NC1CCC(c2ccc(F)cc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450769820	FH	On-Demand	Anodyne	HPGDS	36	58
Cc1ccc(F)c(CC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450769821	DG	On-Demand	Anodyne	KCNK3	44	36
Cc1ccc(F)c(CC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450769821	DG	On-Demand	Anodyne	KCNK9	44	36
CC(C)[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450769830	GF	On-Demand	Bother	BCL2L1	73	37
CC(C)[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450769830	GF	On-Demand	Bother	BCL2	50	32
CC(C)[C@H](CO)[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450769831	GF	On-Demand	Bother	BCL2L1	73	37
CC(C)[C@H](CO)[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450769831	GF	On-Demand	Bother	BCL2	50	32
CC(C)[C@H](CO)[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450769832	GF	On-Demand	Bother	BCL2L1	73	37
CC(C)[C@H](CO)[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450769832	GF	On-Demand	Bother	BCL2	50	32
CC(C)[C@@H](CO)[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450769833	GF	On-Demand	Bother	BCL2L1	73	37
CC(C)[C@@H](CO)[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(C)C	ZINC000450769833	GF	On-Demand	Bother	BCL2	50	32
NC(=O)c1ccc(N2CC[C@@H](c3cccc(Br)c3)C2)nn1	ZINC000450769850	EE	On-Demand	Anodyne	SCD1	24	43
NC(=O)c1ccc(N2CC[C@H](c3cccc(Br)c3)C2)nn1	ZINC000450769851	EE	On-Demand	Anodyne	SCD1	24	43
CC(C)(CO)C(C)(C)NC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450769892	FF	On-Demand	Mild	TRPV4	41	31
COC(=O)c1ccc(CN2CCO[C@H](C(=O)C3CC3)C2)cc1Cl	ZINC000450769897	EE	On-Demand	Anodyne	DRD4	28	42
COC(=O)c1ccc(CN2CCO[C@H](C(=O)C3CC3)C2)cc1Cl	ZINC000450769897	EE	On-Demand	Anodyne	DRD3	16	40
COC(=O)c1ccc(CN2CCO[C@H](C(=O)C3CC3)C2)cc1Cl	ZINC000450769897	EE	On-Demand	Anodyne	HTR4	18	40
COC(=O)c1ccc(CN2CCO[C@H](C(=O)C3CC3)C2)cc1Cl	ZINC000450769897	EE	On-Demand	Anodyne	MCHR1	19	40
COC(=O)c1ccc(CN2CCO[C@@H](C(=O)C3CC3)C2)cc1Cl	ZINC000450769898	EE	On-Demand	Anodyne	DRD4	28	42
COC(=O)c1ccc(CN2CCO[C@@H](C(=O)C3CC3)C2)cc1Cl	ZINC000450769898	EE	On-Demand	Anodyne	DRD3	16	40
COC(=O)c1ccc(CN2CCO[C@@H](C(=O)C3CC3)C2)cc1Cl	ZINC000450769898	EE	On-Demand	Anodyne	HTR4	18	40
COC(=O)c1ccc(CN2CCO[C@@H](C(=O)C3CC3)C2)cc1Cl	ZINC000450769898	EE	On-Demand	Anodyne	MCHR1	19	40
Brc1cccc([C@H]2CCN(c3ccnc(N4CCOCC4)n3)C2)c1	ZINC000450769915	GG	On-Demand	Anodyne	PIK3CA	15	45
Brc1cccc([C@@H]2CCN(c3ccnc(N4CCOCC4)n3)C2)c1	ZINC000450769917	GG	On-Demand	Anodyne	PIK3CA	15	45
C[C@@H](C(=O)NC(C)(C)C)N(C)CCN(C)Cc1ccccc1	ZINC000450769919	DE	On-Demand	Anodyne	CACNA1B	31	45
C[C@@H](C(=O)NC(C)(C)C)N(C)CCN(C)Cc1ccccc1	ZINC000450769919	DE	On-Demand	Anodyne	COLA	54	34
C[C@@H](C(=O)NC(C)(C)C)N(C)CCN(C)Cc1ccccc1	ZINC000450769919	DE	On-Demand	Anodyne	ACE2	43	33
C[C@H](C(=O)NC(C)(C)C)N(C)CCN(C)Cc1ccccc1	ZINC000450769921	DE	On-Demand	Anodyne	CACNA1B	31	45
C[C@H](C(=O)NC(C)(C)C)N(C)CCN(C)Cc1ccccc1	ZINC000450769921	DE	On-Demand	Anodyne	COLA	54	34
C[C@H](C(=O)NC(C)(C)C)N(C)CCN(C)Cc1ccccc1	ZINC000450769921	DE	On-Demand	Anodyne	ACE2	43	33
C[C@@H](Sc1n[nH]c(C(C)(C)C)n1)C(=O)Nc1nccs1	ZINC000450769928	DF	On-Demand	Anodyne	MAP	0	41
C[C@@H](Sc1n[nH]c(C(C)(C)C)n1)C(=O)Nc1nccs1	ZINC000450769928	DF	On-Demand	Anodyne	MAP1	90	37
OC1(Cc2cccc(F)c2)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450769929	GH	On-Demand	Anodyne	SIGMAR1	34	47
C[C@H](Sc1n[nH]c(C(C)(C)C)n1)C(=O)Nc1nccs1	ZINC000450769930	DF	On-Demand	Anodyne	MAP	0	41
C[C@H](Sc1n[nH]c(C(C)(C)C)n1)C(=O)Nc1nccs1	ZINC000450769930	DF	On-Demand	Anodyne	MAP1	90	37
COc1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450769968	DF	On-Demand	Bother	AADAC	0	42
COC(=O)CN1CCN(C(=O)c2cc(OC)ccc2OC(F)(F)F)CC1	ZINC000450769979	GD	On-Demand	Anodyne	AKR1C2	46	34
CCc1cccc(C(=O)NC(C)(CO)CO)n1	ZINC000450770001	BC	On-Demand	Anodyne	PDE5A	22	46
CC[C@H]1Cc2ccccc2CN1CC1(C(=O)OC)CC1	ZINC000450770021	CF	On-Demand	Anodyne	ADAM9	63	35
CC[C@@H]1Cc2ccccc2CN1CC1(C(=O)OC)CC1	ZINC000450770023	CF	On-Demand	Anodyne	ADAM9	63	35
O=C(CC1CC(F)(F)C1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770024	FH	On-Demand	Anodyne	SFRP1	72	36
O=C(CC1CC(F)(F)C1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770024	FH	On-Demand	Anodyne	WNT3	44	32
O=C(CC1CC(F)(F)C1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770025	FH	On-Demand	Anodyne	SFRP1	72	36
O=C(CC1CC(F)(F)C1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770025	FH	On-Demand	Anodyne	WNT3	44	32
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770029	ED	On-Demand	Anodyne	SLC6A1	33	42
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770029	ED	On-Demand	Anodyne	ERBB2	28	41
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770029	ED	On-Demand	Anodyne	MMP2	0	41
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770029	ED	On-Demand	Anodyne	ADAM10	46	36
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770029	ED	On-Demand	Anodyne	NPBWR1	65	32
CO[C@@H]1CCN(c2ncnc(-n3cccn3)c2N)C[C@H]1C	ZINC000450770031	CD	On-Demand	Anodyne	PDE3A	41	33
CO[C@H]1CCN(c2ncnc(-n3cccn3)c2N)C[C@H]1C	ZINC000450770032	CD	On-Demand	Anodyne	PDE3A	41	33
CO[C@H]1CCN(c2ncnc(-n3cccn3)c2N)C[C@@H]1C	ZINC000450770033	CD	On-Demand	Anodyne	PDE3A	41	33
CO[C@@H]1CCN(c2ncnc(-n3cccn3)c2N)C[C@@H]1C	ZINC000450770034	CD	On-Demand	Anodyne	PDE3A	41	33
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770035	ED	On-Demand	Anodyne	SLC6A1	33	42
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770035	ED	On-Demand	Anodyne	ERBB2	28	41
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770035	ED	On-Demand	Anodyne	MMP2	0	41
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770035	ED	On-Demand	Anodyne	ADAM10	46	36
COC(=O)CN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770035	ED	On-Demand	Anodyne	NPBWR1	65	32
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770037	ED	On-Demand	Anodyne	SLC6A1	33	42
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770037	ED	On-Demand	Anodyne	ERBB2	28	41
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770037	ED	On-Demand	Anodyne	MMP2	0	41
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770037	ED	On-Demand	Anodyne	ADAM10	46	36
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450770037	ED	On-Demand	Anodyne	NPBWR1	65	32
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770039	ED	On-Demand	Anodyne	SLC6A1	33	42
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770039	ED	On-Demand	Anodyne	ERBB2	28	41
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770039	ED	On-Demand	Anodyne	MMP2	0	41
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770039	ED	On-Demand	Anodyne	ADAM10	46	36
COC(=O)CN1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450770039	ED	On-Demand	Anodyne	NPBWR1	65	32
COCCC1(CNC(=O)c2nnn(-c3cnn(C)c3)c2C)CCCCC1	ZINC000450770040	FE	On-Demand	Anodyne	HCN1	50	30
COCCC1(CNC(=O)c2nnn(-c3cnn(C)c3)c2C)CCCCC1	ZINC000450770040	FE	On-Demand	Anodyne	HCN4	47	30
O=C1CC[C@@H](CN2CCN(c3c(Cl)cccc3Cl)CC2)CCN1	ZINC000450770065	FG	On-Demand	Anodyne	DRD2	15	44
O=C1CC[C@H](CN2CCN(c3c(Cl)cccc3Cl)CC2)CCN1	ZINC000450770066	FG	On-Demand	Anodyne	DRD2	15	44
COCCC1(CNC(=O)c2cn(C)nc2COC)CCCCC1	ZINC000450770067	DE	On-Demand	Anodyne	HCN1	55	34
COCCC1(CNC(=O)c2cn(C)nc2COC)CCCCC1	ZINC000450770067	DE	On-Demand	Anodyne	HCN4	53	34
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450770081	FH	On-Demand	Anodyne	DRD4	17	41
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450770081	FH	On-Demand	Anodyne	LIPG	42	36
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450770081	FH	On-Demand	Anodyne	SFRP1	93	38
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450770081	FH	On-Demand	Anodyne	WNT3	70	33
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450770084	FH	On-Demand	Anodyne	DRD4	17	41
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450770084	FH	On-Demand	Anodyne	LIPG	42	36
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450770084	FH	On-Demand	Anodyne	SFRP1	93	38
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450770084	FH	On-Demand	Anodyne	WNT3	70	33
C=CCN(C)Cc1ccc(Cl)c(OC)c1	ZINC000450770085	BF	On-Demand	Mild	LSS	18	40
Cc1nnc2c3ccccc3c(N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)nn12	ZINC000450770094	GH	On-Demand	Bother	CREBBP	42	33
Cc1nnc2c3ccccc3c(N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)nn12	ZINC000450770094	GH	On-Demand	Bother	BRD9	53	33
Cc1nnc2c3ccccc3c(N3CCC[C@@H](c4ccc([N+](=O)[O-])cc4)C3)nn12	ZINC000450770095	GH	On-Demand	Bother	CREBBP	42	33
Cc1nnc2c3ccccc3c(N3CCC[C@@H](c4ccc([N+](=O)[O-])cc4)C3)nn12	ZINC000450770095	GH	On-Demand	Bother	BRD9	53	33
COCCC1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450770100	GH	On-Demand	Anodyne	NPPA	41	32
COCCC1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450770100	GH	On-Demand	Anodyne	HCN1	54	34
COCCC1(CNC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450770100	GH	On-Demand	Anodyne	HCN4	52	34
COCCC1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450770101	GH	On-Demand	Anodyne	NPPA	41	32
COCCC1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450770101	GH	On-Demand	Anodyne	HCN1	54	34
COCCC1(CNC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)CCCCC1	ZINC000450770101	GH	On-Demand	Anodyne	HCN4	52	34
CC(=O)c1ccc(CN2CCO[C@H](c3cccc(Cl)c3)C2)cc1	ZINC000450770106	EI	On-Demand	Anodyne	DRD4	36	45
CC(=O)c1ccc(CN2CCO[C@@H](c3cccc(Cl)c3)C2)cc1	ZINC000450770107	EI	On-Demand	Anodyne	DRD4	36	45
O=[N+]([O-])c1ccc([C@H]2CCCN(c3ncnc4c3ncn4C3CC3)C2)cc1	ZINC000450770117	FG	On-Demand	Bother	SLC29A1	60	38
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3ncnc4c3ncn4C3CC3)C2)cc1	ZINC000450770118	FG	On-Demand	Bother	SLC29A1	60	38
CO[C@H]1CCN(c2nc(C)c(S(N)(=O)=O)s2)C[C@H]1C	ZINC000450770124	DC	On-Demand	Anodyne	GYRB	47	37
CO[C@H]1CCN(c2nc(C)c(S(N)(=O)=O)s2)C[C@H]1C	ZINC000450770124	DC	On-Demand	Anodyne	PARE	65	37
CO[C@H]1CCN(c2nc(C)c(S(N)(=O)=O)s2)C[C@@H]1C	ZINC000450770132	DC	On-Demand	Anodyne	GYRB	47	37
CO[C@H]1CCN(c2nc(C)c(S(N)(=O)=O)s2)C[C@@H]1C	ZINC000450770132	DC	On-Demand	Anodyne	PARE	65	37
CO[C@@H]1CCN(c2nc(C)c(S(N)(=O)=O)s2)C[C@@H]1C	ZINC000450770134	DC	On-Demand	Anodyne	GYRB	47	37
CO[C@@H]1CCN(c2nc(C)c(S(N)(=O)=O)s2)C[C@@H]1C	ZINC000450770134	DC	On-Demand	Anodyne	PARE	65	37
CO[C@@H]1CCN(c2nc(C)c(S(N)(=O)=O)s2)C[C@H]1C	ZINC000450770136	DC	On-Demand	Anodyne	GYRB	47	37
CO[C@@H]1CCN(c2nc(C)c(S(N)(=O)=O)s2)C[C@H]1C	ZINC000450770136	DC	On-Demand	Anodyne	PARE	65	37
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770155	GI	On-Demand	Anodyne	TRPV1	18	45
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770155	GI	On-Demand	Anodyne	RBP4	48	32
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770155	GI	On-Demand	Anodyne	SCD1	23	40
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770155	GI	On-Demand	Anodyne	SFRP1	135	43
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770155	GI	On-Demand	Anodyne	SCD	25	40
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770155	GI	On-Demand	Anodyne	WNT3	88	37
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770155	GI	On-Demand	Anodyne	HPGDS	39	43
CC(F)(F)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770165	GI	On-Demand	Anodyne	TRPV1	18	45
CC(F)(F)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770165	GI	On-Demand	Anodyne	RBP4	48	32
CC(F)(F)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770165	GI	On-Demand	Anodyne	SCD1	23	40
CC(F)(F)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770165	GI	On-Demand	Anodyne	SFRP1	135	43
CC(F)(F)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770165	GI	On-Demand	Anodyne	SCD	25	40
CC(F)(F)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770165	GI	On-Demand	Anodyne	WNT3	88	37
CC(F)(F)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1	ZINC000450770165	GI	On-Demand	Anodyne	HPGDS	39	43
CCOC(=O)c1ccc(CSc2nnnn2Cc2ccc(OC)cc2)nc1	ZINC000450770171	GF	On-Demand	Anodyne	ALOX5AP	45	33
COc1cc(CC(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450770186	GD	On-Demand	Anodyne	DRD2	18	42
COc1cc(CC(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450770186	GD	On-Demand	Anodyne	DRD3	25	42
COc1cc(CC(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450770186	GD	On-Demand	Anodyne	TRPV1	32	60
COc1cc(CC(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450770186	GD	On-Demand	Anodyne	BCHE	18	41
COc1cc(CC(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450770186	GD	On-Demand	Anodyne	NCE103	32	44
COc1cc(CC(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450770186	GD	On-Demand	Anodyne	P96878_MYCTU	23	44
COc1cc(CC(=O)NCCCCN2C(=O)NC3(CCCC3)C2=O)ccc1O	ZINC000450770186	GD	On-Demand	Anodyne	CAN2	0	44
CCC(=O)CCCN1CCN(c2ccccc2)C(=O)C1	ZINC000450770215	CE	On-Demand	Anodyne	HTR7	48	37
Fc1ccc(-c2csc3ncnc(N4C[C@@H]5[C@@H](C4)[C@H]4C=C[C@H]5O4)c23)cc1	ZINC000450770221	FH	On-Demand	Anodyne	ADRB3	0	40
Fc1ccc(-c2csc3ncnc(N4C[C@@H]5[C@H]6C=C[C@@H](O6)[C@H]5C4)c23)cc1	ZINC000450770222	FH	On-Demand	Anodyne	ADRB3	0	40
Fc1ccc(-c2csc3ncnc(N4C[C@H]5[C@H]6C=C[C@@H](O6)[C@H]5C4)c23)cc1	ZINC000450770223	FH	On-Demand	Anodyne	ADRB3	0	40
CO[C@H]1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C[C@@H]1C	ZINC000450770233	EF	On-Demand	Anodyne	NPBWR1	53	43
CO[C@H]1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C[C@H]1C	ZINC000450770234	EF	On-Demand	Anodyne	NPBWR1	53	43
CO[C@@H]1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C[C@H]1C	ZINC000450770235	EF	On-Demand	Anodyne	NPBWR1	53	43
CO[C@@H]1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C[C@@H]1C	ZINC000450770236	EF	On-Demand	Anodyne	NPBWR1	53	43
CNC(=O)c1ccc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000450770237	FG	On-Demand	Anodyne	SCD1	46	41
CNC(=O)c1ccc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000450770237	FG	On-Demand	Anodyne	SCD	40	41
CC(=O)N1CCN(C(=O)C2CCN(c3noc(-c4ccccc4)n3)CC2)CC1	ZINC000450770242	GD	On-Demand	Anodyne	S1PR4	19	43
CC(=O)N1CCN(C(=O)C2CCN(c3noc(-c4ccccc4)n3)CC2)CC1	ZINC000450770242	GD	On-Demand	Anodyne	S1PR1	24	43
CC(=O)N1CCN(C(=O)C2CCN(c3noc(-c4ccccc4)n3)CC2)CC1	ZINC000450770242	GD	On-Demand	Anodyne	DGAT1	15	43
CNC(=O)c1ccc(N[C@H](C(=O)OC(C)C)C(C)C)c([N+](=O)[O-])c1	ZINC000450770258	EE	On-Demand	Bother	TAAR1	18	49
Cn1nc(-c2ccccc2)cc1C(=O)NCc1cc(COC(C)(C)C)on1	ZINC000450770271	FG	On-Demand	Anodyne	CTSV	48	33
OC[C@H](C1CC1)[C@@H](Nc1ccnc(-c2ccccc2)n1)C1CC1	ZINC000450770278	DF	On-Demand	Anodyne	PKNB	40	34
OC[C@@H](C1CC1)[C@H](Nc1ccnc(-c2ccccc2)n1)C1CC1	ZINC000450770280	DF	On-Demand	Anodyne	PKNB	40	34
OC[C@H](C1CC1)[C@H](Nc1ccnc(-c2ccccc2)n1)C1CC1	ZINC000450770283	DF	On-Demand	Anodyne	PKNB	40	34
OC[C@@H](C1CC1)[C@@H](Nc1ccnc(-c2ccccc2)n1)C1CC1	ZINC000450770285	DF	On-Demand	Anodyne	PKNB	40	34
CC(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000450770297	EH	On-Demand	Anodyne	SIGMAR1	40	48
CC(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000450770297	EH	On-Demand	Anodyne	CCR3	25	40
CC(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000450770297	EH	On-Demand	Anodyne	MLNR	40	38
CC(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000450770297	EH	On-Demand	Anodyne	MCHR2	41	36
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770298	GE	On-Demand	Bother	BDKRB1	0	49
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770298	GE	On-Demand	Bother	COLA	41	32
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770298	GE	On-Demand	Bother	BCL2L1	91	34
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770298	GE	On-Demand	Bother	BCL2	65	32
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770298	GE	On-Demand	Bother	BCL2L2	43	30
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770299	GE	On-Demand	Bother	BDKRB1	0	49
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770299	GE	On-Demand	Bother	COLA	41	32
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770299	GE	On-Demand	Bother	BCL2L1	91	34
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770299	GE	On-Demand	Bother	BCL2	65	32
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770299	GE	On-Demand	Bother	BCL2L2	43	30
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770300	GE	On-Demand	Bother	BDKRB1	0	49
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770300	GE	On-Demand	Bother	COLA	41	32
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770300	GE	On-Demand	Bother	BCL2L1	91	34
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770300	GE	On-Demand	Bother	BCL2	65	32
CN(C)S(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770300	GE	On-Demand	Bother	BCL2L2	43	30
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770301	GE	On-Demand	Bother	BDKRB1	0	49
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770301	GE	On-Demand	Bother	COLA	41	32
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770301	GE	On-Demand	Bother	BCL2L1	91	34
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770301	GE	On-Demand	Bother	BCL2	65	32
CN(C)S(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450770301	GE	On-Demand	Bother	BCL2L2	43	30
COc1ccc2nc(C)nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2c1	ZINC000450770304	DE	On-Demand	Anodyne	PDE3B	44	36
COc1ccc2nc(C)nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450770305	DE	On-Demand	Anodyne	PDE3B	44	36
COc1ccc2nc(C)nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450770306	DE	On-Demand	Anodyne	PDE3B	44	36
CO[C@H](COc1cc(C)ccc1C(N)=O)Cc1ccccc1	ZINC000450770312	CF	On-Demand	Anodyne	PDS	48	37
CO[C@@H](COc1cc(C)ccc1C(N)=O)Cc1ccccc1	ZINC000450770313	CF	On-Demand	Anodyne	PDS	48	37
CC(=O)c1cccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)c1	ZINC000450770319	EH	On-Demand	Anodyne	CHRM3	24	44
CC(=O)c1cccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)c1	ZINC000450770319	EH	On-Demand	Anodyne	SIGMAR1	42	42
CC(=O)c1cccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)c1	ZINC000450770319	EH	On-Demand	Anodyne	CCR3	58	44
CC(=O)c1cccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)c1	ZINC000450770319	EH	On-Demand	Anodyne	MCHR1	23	40
CC(=O)c1cccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)c1	ZINC000450770319	EH	On-Demand	Anodyne	MCHR2	73	39
CC(=O)c1cccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)c1	ZINC000450770319	EH	On-Demand	Anodyne	NPFFR1	40	33
COC(=O)c1csc(CN2CC[C@H](C)C[C@@H]2C(=O)OC)n1	ZINC000450770342	DD	On-Demand	Anodyne	TRPC6	49	38
COC(=O)c1csc(CN2CC[C@@H](C)C[C@H]2C(=O)OC)n1	ZINC000450770343	DD	On-Demand	Anodyne	TRPC6	49	38
COC(=O)c1csc(CN2CC[C@@H](C)C[C@@H]2C(=O)OC)n1	ZINC000450770345	DD	On-Demand	Anodyne	TRPC6	49	38
COC(=O)c1csc(CN2CC[C@H](C)C[C@H]2C(=O)OC)n1	ZINC000450770347	DD	On-Demand	Anodyne	TRPC6	49	38
Cc1ccc(CC(=O)Nc2cccc(CCCO)c2)c(Br)c1	ZINC000450770351	FH	On-Demand	Anodyne	KCNK3	40	35
Cc1ccc(CC(=O)Nc2cccc(CCCO)c2)c(Br)c1	ZINC000450770351	FH	On-Demand	Anodyne	KCNK9	40	35
CCC1(CC)CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450770354	CI	On-Demand	Anodyne	ACACA	54	39
CCC1(CC)CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450770354	CI	On-Demand	Anodyne	ACACB	42	36
CCC1(CC)CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450770354	CI	On-Demand	Anodyne	AKT1	0	41
CCC1(CC)CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450770354	CI	On-Demand	Anodyne	CCR8	26	40
N#Cc1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1C(F)(F)F	ZINC000450770357	DF	On-Demand	Mild	AR	66	50
N#Cc1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1C(F)(F)F	ZINC000450770359	DF	On-Demand	Mild	AR	66	50
N#Cc1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)cc1C(F)(F)F	ZINC000450770361	DF	On-Demand	Mild	AR	66	50
O=C(Cc1cc2ccccc2c(O)n1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450770362	GI	On-Demand	Anodyne	ETHR	43	35
CC(C)(C)C(=O)Nc1ccc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cn1	ZINC000450770379	GI	On-Demand	Anodyne	MTTP	77	49
CC(C)(C)C(=O)Nc1ccc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cn1	ZINC000450770379	GI	On-Demand	Anodyne	EPHX2	0	44
CC(C)(C)C(=O)Nc1ccc(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)cn1	ZINC000450770380	GI	On-Demand	Anodyne	MTTP	77	49
CC(C)(C)C(=O)Nc1ccc(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)cn1	ZINC000450770380	GI	On-Demand	Anodyne	EPHX2	0	44
CN(C)c1nc(N[C@H](C2CC2)[C@@H](CO)C2CC2)nc2ccccc12	ZINC000450770381	EF	On-Demand	Anodyne	ADRA2A	17	47
CN(C)c1nc(N[C@H](C2CC2)[C@H](CO)C2CC2)nc2ccccc12	ZINC000450770382	EF	On-Demand	Anodyne	ADRA2A	17	47
CN(C)c1nc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)nc2ccccc12	ZINC000450770383	EF	On-Demand	Anodyne	ADRA2A	17	47
CN(C)c1nc(N[C@@H](C2CC2)[C@H](CO)C2CC2)nc2ccccc12	ZINC000450770384	EF	On-Demand	Anodyne	ADRA2A	17	47
CC(C)(C)OCc1cc(CNC(=O)Cc2ccc(O)c(F)c2)no1	ZINC000450770385	EF	On-Demand	Anodyne	TRPV1	0	57
COc1cc(CC(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)ccc1Cl	ZINC000450770402	EF	On-Demand	Anodyne	OPRK1	0	48
COc1cc(CC(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)ccc1Cl	ZINC000450770402	EF	On-Demand	Anodyne	PDE6A	41	32
COc1cc(CC(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)ccc1Cl	ZINC000450770403	EF	On-Demand	Anodyne	OPRK1	0	48
COc1cc(CC(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)ccc1Cl	ZINC000450770403	EF	On-Demand	Anodyne	PDE6A	41	32
CCC1(CC)CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)CC1	ZINC000450770434	EG	On-Demand	Anodyne	DRD4	41	32
CCC1(CC)CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)CC1	ZINC000450770434	EG	On-Demand	Anodyne	CCKAR	26	42
O=C(CCCC(=O)C1CC1)Nc1cn(Cc2ccccc2)nn1	ZINC000450770448	DE	On-Demand	Anodyne	HDAC10	38	49
O=C(CCCC(=O)C1CC1)Nc1cn(Cc2ccccc2)nn1	ZINC000450770448	DE	On-Demand	Anodyne	HDAC1	25	52
O=C(CCCC(=O)C1CC1)Nc1cn(Cc2ccccc2)nn1	ZINC000450770448	DE	On-Demand	Anodyne	HDAC3	36	49
O=C(CCCC(=O)C1CC1)Nc1cn(Cc2ccccc2)nn1	ZINC000450770448	DE	On-Demand	Anodyne	HDAC6	35	52
O=C(CCCC(=O)C1CC1)Nc1cn(Cc2ccccc2)nn1	ZINC000450770448	DE	On-Demand	Anodyne	HDAC7	26	42
CCC[C@H](OC)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450770449	DE	On-Demand	Anodyne	GPR88	0	43
CCC[C@H](OC)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450770450	DE	On-Demand	Anodyne	GPR88	0	43
CCC[C@@H](OC)C(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450770451	DE	On-Demand	Anodyne	GPR88	0	43
CCC[C@@H](OC)C(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1	ZINC000450770452	DE	On-Demand	Anodyne	GPR88	0	43
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	MME	62	37
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	CTSB	30	41
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	PAPA1_CARPA	51	37
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	CYSP_TRYCR	40	35
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	CACNA1B	37	45
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	CAPNS1	46	33
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	CAPN2	44	32
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	ACE2	56	38
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	NPR	48	34
CO[C@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770455	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	35
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	MME	62	37
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	CTSB	30	41
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	PAPA1_CARPA	51	37
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	CYSP_TRYCR	40	35
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	CACNA1B	37	45
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	CAPNS1	46	33
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	CAPN2	44	32
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	ACE2	56	38
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	NPR	48	34
CO[C@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770456	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	35
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	MME	62	37
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	CTSB	30	41
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	PAPA1_CARPA	51	37
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	CYSP_TRYCR	40	35
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	CACNA1B	37	45
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	CAPNS1	46	33
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	CAPN2	44	32
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	ACE2	56	38
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	NPR	48	34
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770457	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	35
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	MME	62	37
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	CTSB	30	41
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	PAPA1_CARPA	51	37
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	CYSP_TRYCR	40	35
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	CACNA1B	37	45
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	CAPNS1	46	33
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	CAPN2	44	32
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	ACE2	56	38
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	NPR	48	34
CO[C@@H](Cc1ccccc1)CN(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770458	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	35
COC(=O)CN1CCN(Cc2cc(Cl)sc2Cl)CC1	ZINC000450770463	DE	On-Demand	Anodyne	KAT2B	0	47
CC(C)c1nnc(SCC[C@@H](C)O)n1Cc1ccco1	ZINC000450770465	CF	On-Demand	Anodyne	HCRTR2	20	40
CC(C)c1nnc(SCC[C@H](C)O)n1Cc1ccco1	ZINC000450770467	CF	On-Demand	Anodyne	HCRTR2	20	40
COc1ccc(NC(=O)c2cn(CC3CC3)nn2)cc1[N+](=O)[O-]	ZINC000450770476	DD	On-Demand	Bother	ENPP1	57	34
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450770482	FC	On-Demand	Anodyne	COLA	38	41
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450770482	FC	On-Demand	Anodyne	CPT1A	36	41
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450770482	FC	On-Demand	Anodyne	CPT2	46	40
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450770482	FC	On-Demand	Anodyne	PREP	119	51
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450770482	FC	On-Demand	Anodyne	SFRP1	54	45
COC(=O)CN1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1	ZINC000450770482	FC	On-Demand	Anodyne	WNT3	59	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(CO)CO	ZINC000450770499	CD	On-Demand	Anodyne	PPARA	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(CO)CO	ZINC000450770499	CD	On-Demand	Anodyne	SORT1	16	42
C[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]2CCCC[C@H]12	ZINC000450770500	EI	On-Demand	Anodyne	COLA	48	37
C[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]2CCCC[C@H]12	ZINC000450770500	EI	On-Demand	Anodyne	CPT1A	44	37
C[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]2CCCC[C@@H]12	ZINC000450770501	EI	On-Demand	Anodyne	COLA	48	37
C[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)[C@@H]2CCCC[C@@H]12	ZINC000450770501	EI	On-Demand	Anodyne	CPT1A	44	37
C[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)[C@H]2CCCC[C@H]12	ZINC000450770502	EI	On-Demand	Anodyne	COLA	48	37
C[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)[C@H]2CCCC[C@H]12	ZINC000450770502	EI	On-Demand	Anodyne	CPT1A	44	37
C[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)[C@H]2CCCC[C@@H]12	ZINC000450770503	EI	On-Demand	Anodyne	COLA	48	37
C[C@@H]1CN(C(=O)Cc2scnc2-c2ccccc2)[C@H]2CCCC[C@@H]12	ZINC000450770503	EI	On-Demand	Anodyne	CPT1A	44	37
CCN1C[C@H](Nc2ccc(S(=O)(=O)N3CCCC3)cn2)CC1=O	ZINC000450770511	EC	On-Demand	Anodyne	TGM2	27	41
COc1ccc(C)cc1CC(=O)NCCN1c2ccccc2NS1(=O)=O	ZINC000450770514	GD	On-Demand	Anodyne	TSHR	40	30
CCN1C[C@@H](Nc2ccc(S(=O)(=O)N3CCCC3)cn2)CC1=O	ZINC000450770515	EC	On-Demand	Anodyne	TGM2	27	41
CCOC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)nc1	ZINC000450770520	FF	On-Demand	Anodyne	SSTR5	41	37
CCOC(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)nc1	ZINC000450770520	FF	On-Demand	Anodyne	MLNR	41	36
COc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1[N+](=O)[O-]	ZINC000450770523	DD	On-Demand	Bother	QRFPR	40	33
COc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1[N+](=O)[O-]	ZINC000450770523	DD	On-Demand	Bother	ENPP1	55	32
COC(=O)c1csc(CN[C@H](CN2CCc3ccccc3C2)C(C)(C)C)n1	ZINC000450770528	GG	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1csc(CN[C@H](CN2CCc3ccccc3C2)C(C)(C)C)n1	ZINC000450770528	GG	On-Demand	Anodyne	TRPC6	17	40
COC(=O)c1csc(CN[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)n1	ZINC000450770530	GG	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1csc(CN[C@@H](CN2CCc3ccccc3C2)C(C)(C)C)n1	ZINC000450770530	GG	On-Demand	Anodyne	TRPC6	17	40
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CC(=O)N(CC)C1	ZINC000450770533	ED	On-Demand	Bother	CACNA1D	44	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CC(=O)N(CC)C1	ZINC000450770534	ED	On-Demand	Bother	CACNA1D	44	33
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(CO)CO)cc2)c1	ZINC000450770555	FD	On-Demand	Anodyne	E1	0	46
CC(C)(C)C(=O)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450770576	EG	On-Demand	Anodyne	HDAC10	28	48
CC(C)(C)C(=O)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450770576	EG	On-Demand	Anodyne	HDAC3	25	48
CC(C)(C)C(=O)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450770576	EG	On-Demand	Anodyne	HDAC6	22	50
CC(C)(C)C(=O)CCCC(=O)Nc1cn(Cc2ccccc2)nn1	ZINC000450770576	EG	On-Demand	Anodyne	HDAC7	22	42
COC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450770578	FE	On-Demand	Anodyne	RBP4	100	41
COC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450770578	FE	On-Demand	Anodyne	SFRP1	43	32
COC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450770578	FE	On-Demand	Anodyne	WNT3	45	32
CCCNC(=O)CN[C@H](CN1CCc2ccccc2C1)C(C)(C)C	ZINC000450770611	EF	On-Demand	Anodyne	NOD2	41	34
CCCNC(=O)CN[C@@H](CN1CCc2ccccc2C1)C(C)(C)C	ZINC000450770612	EF	On-Demand	Anodyne	NOD2	41	34
CCS(=O)(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450770620	GG	On-Demand	Anodyne	SIGMAR1	36	45
CCS(=O)(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450770620	GG	On-Demand	Anodyne	ADAM17	18	40
CCS(=O)(=O)c1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000450770620	GG	On-Demand	Anodyne	MCHR2	48	36
Cc1cccc(Cl)c1C(=O)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450770630	FE	On-Demand	Anodyne	CCR5	25	49
Cc1cccc(Cl)c1C(=O)N1CC(S(=O)(=O)NC2CCCC2)C1	ZINC000450770630	FE	On-Demand	Anodyne	CCR8	57	34
CCOC(=O)c1cnccc1N1CC[C@@H](c2nc(C)no2)C1	ZINC000450770637	DD	On-Demand	Anodyne	ETHR	51	35
CCOC(=O)c1cnccc1N1CC[C@H](c2nc(C)no2)C1	ZINC000450770638	DD	On-Demand	Anodyne	ETHR	51	35
CC(CO)(CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450770639	ED	On-Demand	Anodyne	AVPR1B	31	45
CC(CO)(CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450770639	ED	On-Demand	Anodyne	PDE6D	65	38
CC(CO)(CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450770639	ED	On-Demand	Anodyne	HDAC8	26	42
CC(CO)(CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450770639	ED	On-Demand	Anodyne	IMDH_CRYPV	37	58
CO[C@@H]1CCN(c2ccc([N+](=O)[O-])nc2)C[C@@H]1C	ZINC000450770641	CD	On-Demand	Bother	CHRNA3	23	57
CO[C@H]1CCN(c2ccc([N+](=O)[O-])nc2)C[C@H]1C	ZINC000450770643	CD	On-Demand	Bother	CHRNA3	23	57
CO[C@@H]1CCN(c2ccc([N+](=O)[O-])nc2)C[C@H]1C	ZINC000450770644	CD	On-Demand	Bother	CHRNA3	23	57
CO[C@H]1CCN(c2ccc([N+](=O)[O-])nc2)C[C@@H]1C	ZINC000450770646	CD	On-Demand	Bother	CHRNA3	23	57
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770655	GG	On-Demand	Anodyne	MTNR1A	30	40
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770655	GG	On-Demand	Anodyne	MTNR1B	0	40
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770655	GG	On-Demand	Anodyne	RBP4	72	34
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770655	GG	On-Demand	Anodyne	SFRP1	84	36
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770655	GG	On-Demand	Anodyne	HPGDS	36	41
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770656	GG	On-Demand	Anodyne	MTNR1A	30	40
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770656	GG	On-Demand	Anodyne	MTNR1B	0	40
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770656	GG	On-Demand	Anodyne	RBP4	72	34
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770656	GG	On-Demand	Anodyne	SFRP1	84	36
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cnc(C2CC2)nc1	ZINC000450770656	GG	On-Demand	Anodyne	HPGDS	36	41
COC(=O)[C@H](NC[C@@H]1CCNC(=O)CC1)c1ccc(F)c(C)c1	ZINC000450770657	DD	On-Demand	Anodyne	LEF	40	35
COC(=O)[C@@H](NC[C@@H]1CCNC(=O)CC1)c1ccc(F)c(C)c1	ZINC000450770658	DD	On-Demand	Anodyne	LEF	40	35
COC(=O)[C@H](NC[C@H]1CCNC(=O)CC1)c1ccc(F)c(C)c1	ZINC000450770659	DD	On-Demand	Anodyne	LEF	40	35
COC(=O)[C@@H](NC[C@H]1CCNC(=O)CC1)c1ccc(F)c(C)c1	ZINC000450770660	DD	On-Demand	Anodyne	LEF	40	35
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770661	GI	On-Demand	Anodyne	KCNQ2	50	37
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770661	GI	On-Demand	Anodyne	MTNR1A	31	43
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770661	GI	On-Demand	Anodyne	MTNR1B	0	43
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770661	GI	On-Demand	Anodyne	RBP4	47	34
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770661	GI	On-Demand	Anodyne	SFRP1	95	36
CC[C@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770661	GI	On-Demand	Anodyne	WNT3	59	36
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770662	GI	On-Demand	Anodyne	KCNQ2	50	37
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770662	GI	On-Demand	Anodyne	MTNR1A	31	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770662	GI	On-Demand	Anodyne	MTNR1B	0	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770662	GI	On-Demand	Anodyne	RBP4	47	34
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770662	GI	On-Demand	Anodyne	SFRP1	95	36
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770662	GI	On-Demand	Anodyne	WNT3	59	36
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770663	GI	On-Demand	Anodyne	KCNQ2	50	37
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770663	GI	On-Demand	Anodyne	MTNR1A	31	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770663	GI	On-Demand	Anodyne	MTNR1B	0	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770663	GI	On-Demand	Anodyne	RBP4	47	34
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770663	GI	On-Demand	Anodyne	SFRP1	95	36
CC[C@@H](CC(F)(F)F)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770663	GI	On-Demand	Anodyne	WNT3	59	36
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770664	GI	On-Demand	Anodyne	KCNQ2	50	37
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770664	GI	On-Demand	Anodyne	MTNR1A	31	43
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770664	GI	On-Demand	Anodyne	MTNR1B	0	43
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770664	GI	On-Demand	Anodyne	RBP4	47	34
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770664	GI	On-Demand	Anodyne	SFRP1	95	36
CC[C@H](CC(F)(F)F)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450770664	GI	On-Demand	Anodyne	WNT3	59	36
COCc1ccc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)o1	ZINC000450770671	EI	On-Demand	Anodyne	HTR2A	19	41
COCc1ccc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)o1	ZINC000450770671	EI	On-Demand	Anodyne	HTR3B	0	44
COCc1ccc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)o1	ZINC000450770671	EI	On-Demand	Anodyne	CYP2J2	47	33
COCc1ccc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)o1	ZINC000450770672	EI	On-Demand	Anodyne	HTR2A	19	41
COCc1ccc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)o1	ZINC000450770672	EI	On-Demand	Anodyne	HTR3B	0	44
COCc1ccc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)o1	ZINC000450770672	EI	On-Demand	Anodyne	CYP2J2	47	33
COCCC1(CNC(=O)c2cc3ccncc3s2)CCCCC1	ZINC000450770680	EI	On-Demand	Anodyne	SELE	49	38
COCCC1(CNC(=O)c2cc3ccncc3s2)CCCCC1	ZINC000450770680	EI	On-Demand	Anodyne	ICAM1	48	38
COCCC1(CNC(=O)c2cc3ccncc3s2)CCCCC1	ZINC000450770680	EI	On-Demand	Anodyne	VCAM1	50	36
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@H]1C	ZINC000450770694	FE	On-Demand	Anodyne	HTR3A	28	50
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@H]1C	ZINC000450770694	FE	On-Demand	Anodyne	HRH4	34	50
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H]1C	ZINC000450770695	FE	On-Demand	Anodyne	HTR3A	28	50
CO[C@@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H]1C	ZINC000450770695	FE	On-Demand	Anodyne	HRH4	34	50
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@H]1C	ZINC000450770696	FE	On-Demand	Anodyne	HTR3A	28	50
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@H]1C	ZINC000450770696	FE	On-Demand	Anodyne	HRH4	34	50
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H]1C	ZINC000450770697	FE	On-Demand	Anodyne	HTR3A	28	50
CO[C@H]1CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H]1C	ZINC000450770697	FE	On-Demand	Anodyne	HRH4	34	50
Cc1cc(C(=O)N2CCC[C@@]3(C2)OCc2ccccc23)nn1C(C)C	ZINC000450770698	EG	On-Demand	Anodyne	BCL2	0	41
Cc1cc(C(=O)N2CCC[C@]3(C2)OCc2ccccc23)nn1C(C)C	ZINC000450770699	EG	On-Demand	Anodyne	BCL2	0	41
Cc1nc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c2cc[nH]c2n1	ZINC000450770711	EH	On-Demand	Bother	SLC27A4	42	33
Cc1nc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c2cc[nH]c2n1	ZINC000450770712	EH	On-Demand	Bother	SLC27A4	42	33
Clc1cccc(Cl)c1N1CCN(Cc2cnns2)CC1	ZINC000450770715	EG	On-Demand	Anodyne	DRD4	20	42
CO[C@@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C[C@@H]1C	ZINC000450770750	FI	On-Demand	Anodyne	ADRB3	31	51
CO[C@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C[C@@H]1C	ZINC000450770751	FI	On-Demand	Anodyne	ADRB3	31	51
CO[C@@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C[C@H]1C	ZINC000450770752	FI	On-Demand	Anodyne	ADRB3	31	51
CO[C@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C[C@H]1C	ZINC000450770753	FI	On-Demand	Anodyne	ADRB3	31	51
CO[C@@H]1CCN(c2cc(C)ncn2)C[C@@H]1C	ZINC000450770754	BD	On-Demand	Anodyne	PDE3A	44	35
CO[C@H]1CCN(c2cc(C)ncn2)C[C@H]1C	ZINC000450770755	BD	On-Demand	Anodyne	PDE3A	44	35
CO[C@@H]1CCN(c2cc(C)ncn2)C[C@H]1C	ZINC000450770756	BD	On-Demand	Anodyne	PDE3A	44	35
CO[C@H]1CCN(c2cc(C)ncn2)C[C@@H]1C	ZINC000450770757	BD	On-Demand	Anodyne	PDE3A	44	35
CC(=O)c1ccc(CN(CCCOc2ccccc2)C2CCOCC2)cc1	ZINC000450770760	FI	On-Demand	Anodyne	LTA4H	41	38
CC(=O)c1ccc(CN(CCCOc2ccccc2)C2CCOCC2)cc1	ZINC000450770760	FI	On-Demand	Anodyne	MBTPS1	43	30
COc1cccc(-n2cc(C(=O)N3CCC(c4c(F)cccc4F)CC3)nn2)c1	ZINC000450770770	GH	On-Demand	Anodyne	CCKAR	25	41
O=C(Nc1cccc(CCCO)c1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450770773	FI	On-Demand	Anodyne	RBP4	66	35
CCOC(=O)c1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)on1	ZINC000450770778	FG	On-Demand	Anodyne	GYRB	0	43
CCOC(=O)c1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)on1	ZINC000450770778	FG	On-Demand	Anodyne	TPSAB1	32	41
CCOC(=O)c1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)on1	ZINC000450770778	FG	On-Demand	Anodyne	ETHR	40	35
Cn1nc(C(=O)N2CCC(c3c(F)cccc3F)CC2)c2c1CCCC2	ZINC000450770788	FH	On-Demand	Anodyne	L3MBTL3	48	36
OC[C@@H](C1CC1)[C@@H](Nc1ncnc2c1ncn2C1CC1)C1CC1	ZINC000450770803	DE	On-Demand	Anodyne	ADORA1	45	50
OC[C@@H](C1CC1)[C@@H](Nc1ncnc2c1ncn2C1CC1)C1CC1	ZINC000450770803	DE	On-Demand	Anodyne	Q4VQ11_PIG	43	40
OC[C@H](C1CC1)[C@@H](Nc1ncnc2c1ncn2C1CC1)C1CC1	ZINC000450770804	DE	On-Demand	Anodyne	ADORA1	45	50
OC[C@H](C1CC1)[C@@H](Nc1ncnc2c1ncn2C1CC1)C1CC1	ZINC000450770804	DE	On-Demand	Anodyne	Q4VQ11_PIG	43	40
OC[C@@H](C1CC1)[C@H](Nc1ncnc2c1ncn2C1CC1)C1CC1	ZINC000450770805	DE	On-Demand	Anodyne	ADORA1	45	50
OC[C@@H](C1CC1)[C@H](Nc1ncnc2c1ncn2C1CC1)C1CC1	ZINC000450770805	DE	On-Demand	Anodyne	Q4VQ11_PIG	43	40
OC[C@H](C1CC1)[C@H](Nc1ncnc2c1ncn2C1CC1)C1CC1	ZINC000450770806	DE	On-Demand	Anodyne	ADORA1	45	50
OC[C@H](C1CC1)[C@H](Nc1ncnc2c1ncn2C1CC1)C1CC1	ZINC000450770806	DE	On-Demand	Anodyne	Q4VQ11_PIG	43	40
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450770816	FE	On-Demand	Anodyne	PDE4D	15	42
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450770817	FE	On-Demand	Anodyne	PDE4D	15	42
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450770818	FE	On-Demand	Anodyne	PDE4D	15	42
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450770820	FE	On-Demand	Anodyne	PDE4D	15	42
COc1ccc(Cn2nnnc2S[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450770832	GE	On-Demand	Anodyne	MAP	0	42
COc1ccc(Cn2nnnc2S[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450770832	GE	On-Demand	Anodyne	MAP1	90	40
COc1ccc(Cn2nnnc2S[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450770833	GE	On-Demand	Anodyne	MAP	0	42
COc1ccc(Cn2nnnc2S[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450770833	GE	On-Demand	Anodyne	MAP1	90	40
CO[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@H]1C	ZINC000450770844	EF	On-Demand	Bother	L3MBTL3	26	42
CO[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@H]1C	ZINC000450770845	EF	On-Demand	Bother	L3MBTL3	26	42
CO[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@@H]1C	ZINC000450770846	EF	On-Demand	Bother	L3MBTL3	26	42
CO[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@@H]1C	ZINC000450770847	EF	On-Demand	Bother	L3MBTL3	26	42
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770860	ED	On-Demand	Anodyne	MME	41	35
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770860	ED	On-Demand	Anodyne	TIMP3	62	36
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770860	ED	On-Demand	Anodyne	CAPNS1	44	31
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770860	ED	On-Demand	Anodyne	REN	45	39
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770860	ED	On-Demand	Anodyne	YARS	44	41
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770860	ED	On-Demand	Anodyne	PSMB8	49	32
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770863	ED	On-Demand	Anodyne	MME	41	35
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770863	ED	On-Demand	Anodyne	TIMP3	62	36
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770863	ED	On-Demand	Anodyne	CAPNS1	44	31
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770863	ED	On-Demand	Anodyne	REN	45	39
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770863	ED	On-Demand	Anodyne	YARS	44	41
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770863	ED	On-Demand	Anodyne	PSMB8	49	32
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770864	ED	On-Demand	Anodyne	MME	41	35
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770864	ED	On-Demand	Anodyne	TIMP3	62	36
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770864	ED	On-Demand	Anodyne	CAPNS1	44	31
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770864	ED	On-Demand	Anodyne	REN	45	39
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770864	ED	On-Demand	Anodyne	YARS	44	41
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@@H]1CCCOC1	ZINC000450770864	ED	On-Demand	Anodyne	PSMB8	49	32
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770865	ED	On-Demand	Anodyne	MME	41	35
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770865	ED	On-Demand	Anodyne	TIMP3	62	36
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770865	ED	On-Demand	Anodyne	CAPNS1	44	31
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770865	ED	On-Demand	Anodyne	REN	45	39
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770865	ED	On-Demand	Anodyne	YARS	44	41
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)[C@H]1CCCOC1	ZINC000450770865	ED	On-Demand	Anodyne	PSMB8	49	32
CC(C)(O)CCNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450770867	EE	On-Demand	Anodyne	TRPC6	63	33
CC(C)(O)CCNC(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450770867	EE	On-Demand	Anodyne	TRPC3	48	33
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C	ZINC000450770868	EG	On-Demand	Anodyne	CCR2	29	42
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000450770870	EG	On-Demand	Anodyne	CCR2	29	42
COC(=O)CN1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3)cn2)CC1	ZINC000450770908	GE	On-Demand	Anodyne	FAAH	20	42
CCC(=O)CCCN1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450770912	CF	On-Demand	Anodyne	SLC6A1	79	36
CCC(=O)CCCN1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450770913	CF	On-Demand	Anodyne	SLC6A1	79	36
CO[C@@H]1CCN(c2nn3cc(C)nc3s2)C[C@H]1C	ZINC000450770915	CD	On-Demand	Anodyne	PARE	45	33
CO[C@H]1CCN(c2nn3cc(C)nc3s2)C[C@H]1C	ZINC000450770928	CD	On-Demand	Anodyne	PARE	45	33
CO[C@@H]1CCN(c2nn3cc(C)nc3s2)C[C@@H]1C	ZINC000450770929	CD	On-Demand	Anodyne	PARE	45	33
CO[C@H]1CCN(c2nn3cc(C)nc3s2)C[C@@H]1C	ZINC000450770930	CD	On-Demand	Anodyne	PARE	45	33
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	F2	40	38
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	CMA1	41	41
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	TRY1_BOVIN	55	37
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	CCR3	24	40
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	PREP	99	43
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	CFTR	61	42
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	FKBP12.6	0	42
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	RHOA	0	42
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	BRCA1	53	34
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450770940	FF	On-Demand	Anodyne	TMPRSS11D	55	35
CCCc1cc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)no1	ZINC000450771011	EE	On-Demand	Anodyne	TACR3	44	38
CCCc1cc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)no1	ZINC000450771012	EE	On-Demand	Anodyne	TACR3	44	38
N#CCC1(O)CN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450771017	FD	On-Demand	Mild	TRPV4	43	35
N#CCC1(O)CN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450771018	FD	On-Demand	Mild	TRPV4	43	35
COc1cccc(OCCC(=O)N2CCOC[C@H]2c2nc(C)no2)c1	ZINC000450771032	ED	On-Demand	Anodyne	COLA	108	49
COc1cccc(OCCC(=O)N2CCOC[C@H]2c2nc(C)no2)c1	ZINC000450771032	ED	On-Demand	Anodyne	CPT1A	79	49
COc1cccc(OCCC(=O)N2CCOC[C@@H]2c2nc(C)no2)c1	ZINC000450771033	ED	On-Demand	Anodyne	COLA	108	49
COc1cccc(OCCC(=O)N2CCOC[C@@H]2c2nc(C)no2)c1	ZINC000450771033	ED	On-Demand	Anodyne	CPT1A	79	49
CC(C)c1nccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)n1	ZINC000450771057	CD	On-Demand	Anodyne	SORD	123	49
CC(C)c1nccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)n1	ZINC000450771058	CD	On-Demand	Anodyne	SORD	123	49
CC(C)c1nccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)n1	ZINC000450771059	CD	On-Demand	Anodyne	SORD	123	49
Cc1ccnc(OC2CCN(C(=O)c3c(C)cccc3Cl)CC2)c1	ZINC000450771061	EI	On-Demand	Anodyne	HRH1	26	40
Cc1ccnc(OC2CCN(C(=O)c3c(C)cccc3Cl)CC2)c1	ZINC000450771061	EI	On-Demand	Anodyne	CCR3	35	40
Cc1ccnc(OC2CCN(C(=O)c3c(C)cccc3Cl)CC2)c1	ZINC000450771061	EI	On-Demand	Anodyne	CCR5	24	41
Cc1ccnc(OC2CCN(C(=O)c3c(C)cccc3Cl)CC2)c1	ZINC000450771061	EI	On-Demand	Anodyne	HCRTR2	17	42
CCN1C[C@@H](Nc2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1=O	ZINC000450771073	EF	On-Demand	Anodyne	PRNP	52	36
CCN1C[C@H](Nc2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1=O	ZINC000450771074	EF	On-Demand	Anodyne	PRNP	52	36
CN(C)c1nccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)n1	ZINC000450771077	CC	On-Demand	Anodyne	SORD	57	38
CN(C)c1nccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)n1	ZINC000450771088	CC	On-Demand	Anodyne	SORD	57	38
CN(C)c1nccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)n1	ZINC000450771090	CC	On-Demand	Anodyne	SORD	57	38
CC(C)OC(=O)[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450771102	FE	On-Demand	Bother	COLA	71	33
CO[C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C[C@H]1C	ZINC000450771133	EI	On-Demand	Anodyne	LIPG	45	34
CO[C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C[C@@H]1C	ZINC000450771134	EI	On-Demand	Anodyne	LIPG	45	34
CO[C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C[C@@H]1C	ZINC000450771135	EI	On-Demand	Anodyne	LIPG	45	34
CO[C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C[C@H]1C	ZINC000450771137	EI	On-Demand	Anodyne	LIPG	45	34
COc1ccc(-c2nnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c3ccccc23)cc1	ZINC000450771146	FH	On-Demand	Anodyne	SMO	41	39
COc1ccc(-c2nnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c3ccccc23)cc1	ZINC000450771149	FH	On-Demand	Anodyne	SMO	41	39
COc1ccc(-c2nnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c3ccccc23)cc1	ZINC000450771151	FH	On-Demand	Anodyne	SMO	41	39
COC(=O)CNC(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c([N+](=O)[O-])c1	ZINC000450771155	FC	On-Demand	Bother	TAAR1	20	44
COC(=O)CNC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450771157	FC	On-Demand	Bother	TAAR1	20	44
COC(=O)CNC(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450771158	FC	On-Demand	Bother	TAAR1	20	44
CS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450771185	FE	On-Demand	Bother	BDKRB1	21	40
CS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450771187	FE	On-Demand	Bother	BDKRB1	21	40
CS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450771189	FE	On-Demand	Bother	BDKRB1	21	40
CS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450771191	FE	On-Demand	Bother	BDKRB1	21	40
CCOc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450771192	FG	On-Demand	Anodyne	SSTR5	43	34
CCOc1cc(C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450771192	FG	On-Demand	Anodyne	SFRP1	56	32
CCOc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450771194	FG	On-Demand	Anodyne	SSTR5	43	34
CCOc1cc(C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)on1	ZINC000450771194	FG	On-Demand	Anodyne	SFRP1	56	32
CC(C)(C)OC(=O)c1cnc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1	ZINC000450771196	GH	On-Demand	Bother	SLC27A4	43	33
CC(C)(C)OC(=O)c1cnc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1	ZINC000450771197	GH	On-Demand	Bother	SLC27A4	43	33
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	CHRM1	19	44
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	DRD2	31	50
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	DRD4	36	49
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	HTR2A	23	50
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	HTR2C	24	50
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	SLC6A1	92	37
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	DRD3	21	41
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	HTR7	20	42
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	SIGMAR1	29	46
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	CCR5	16	45
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	MTNR1A	26	42
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	MTNR1B	17	42
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	MCHR1	23	50
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	CYP2J2	66	47
CNC(=O)N[C@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771206	CD	On-Demand	Anodyne	BIRC2	70	38
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	CHRM1	19	44
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	DRD2	31	50
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	DRD4	36	49
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	HTR2A	23	50
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	HTR2C	24	50
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	SLC6A1	92	37
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	DRD3	21	41
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	HTR7	20	42
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	SIGMAR1	29	46
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	CCR5	16	45
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	MTNR1A	26	42
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	MTNR1B	17	42
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	MCHR1	23	50
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	CYP2J2	66	47
CNC(=O)N[C@@H]1CCN(CCCC(=O)c2ccccc2)C1	ZINC000450771207	CD	On-Demand	Anodyne	BIRC2	70	38
COc1cc(CC(=O)NC[C@@H](C2CC2)N(C)Cc2ccccc2)ccc1O	ZINC000450771221	FF	On-Demand	Anodyne	TRPV1	46	58
COc1cc(CC(=O)NC[C@@H](C2CC2)N(C)Cc2ccccc2)ccc1O	ZINC000450771221	FF	On-Demand	Anodyne	NCE103	26	40
COc1cc(CC(=O)NC[C@@H](C2CC2)N(C)Cc2ccccc2)ccc1O	ZINC000450771221	FF	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)NC[C@H](C2CC2)N(C)Cc2ccccc2)ccc1O	ZINC000450771222	FF	On-Demand	Anodyne	TRPV1	46	58
COc1cc(CC(=O)NC[C@H](C2CC2)N(C)Cc2ccccc2)ccc1O	ZINC000450771222	FF	On-Demand	Anodyne	NCE103	26	40
COc1cc(CC(=O)NC[C@H](C2CC2)N(C)Cc2ccccc2)ccc1O	ZINC000450771222	FF	On-Demand	Anodyne	CAN2	0	40
CNC(=O)N[C@@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000450771227	EE	On-Demand	Anodyne	DRD4	22	44
CNC(=O)N[C@@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000450771227	EE	On-Demand	Anodyne	SIGMAR1	19	42
CNC(=O)N[C@@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000450771227	EE	On-Demand	Anodyne	CCR3	18	41
CNC(=O)N[C@@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000450771227	EE	On-Demand	Anodyne	MCHR1	23	40
CNC(=O)N[C@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000450771228	EE	On-Demand	Anodyne	DRD4	22	44
CNC(=O)N[C@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000450771228	EE	On-Demand	Anodyne	SIGMAR1	19	42
CNC(=O)N[C@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000450771228	EE	On-Demand	Anodyne	CCR3	18	41
CNC(=O)N[C@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000450771228	EE	On-Demand	Anodyne	MCHR1	23	40
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450771237	EF	On-Demand	Anodyne	HDAC1	0	44
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000450771238	EF	On-Demand	Anodyne	HDAC1	0	44
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450771239	EF	On-Demand	Anodyne	HDAC1	0	44
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCCN(C2CCC2)C1	ZINC000450771240	EF	On-Demand	Anodyne	HDAC1	0	44
O=C(NC1CC1)c1cc(SCc2cn(CC3CC3)nn2)nc2ccccc12	ZINC000450771242	GG	On-Demand	Anodyne	TNKS	60	34
COC(=O)[C@@H]1C[C@H](C)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450771272	GD	On-Demand	Anodyne	MTNR1A	46	35
COC(=O)[C@H]1C[C@H](C)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450771273	GD	On-Demand	Anodyne	MTNR1A	46	35
COC(=O)[C@H]1C[C@@H](C)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450771274	GD	On-Demand	Anodyne	MTNR1A	46	35
COC(=O)[C@@H]1C[C@@H](C)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450771275	GD	On-Demand	Anodyne	MTNR1A	46	35
Cc1[nH]c(C#N)cc1C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450771277	EG	On-Demand	Mild	FASN	42	37
CO[C@@H]1CCN(c2cc(N3CCC[C@@H](C)C3)ncn2)C[C@@H]1C	ZINC000450771298	DF	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(N3CCC[C@@H](C)C3)ncn2)C[C@@H]1C	ZINC000450771298	DF	On-Demand	Anodyne	PDE3B	62	32
CO[C@@H]1CCN(c2cc(N3CCC[C@@H](C)C3)ncn2)C[C@H]1C	ZINC000450771299	DF	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(N3CCC[C@@H](C)C3)ncn2)C[C@H]1C	ZINC000450771299	DF	On-Demand	Anodyne	PDE3B	62	32
CO[C@@H]1CCN(c2cc(N3CCC[C@H](C)C3)ncn2)C[C@H]1C	ZINC000450771300	DF	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(N3CCC[C@H](C)C3)ncn2)C[C@H]1C	ZINC000450771300	DF	On-Demand	Anodyne	PDE3B	62	32
CO[C@@H]1CCN(c2cc(N3CCC[C@H](C)C3)ncn2)C[C@@H]1C	ZINC000450771301	DF	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(N3CCC[C@H](C)C3)ncn2)C[C@@H]1C	ZINC000450771301	DF	On-Demand	Anodyne	PDE3B	62	32
CCOC(=O)[C@H](NC(=O)c1ccc2cnccc2c1)[C@H]1CCCOC1	ZINC000450771303	EE	On-Demand	Anodyne	AKT1	25	49
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450771305	GG	On-Demand	Anodyne	MLYCD	45	40
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450771305	GG	On-Demand	Anodyne	NPBWR1	24	42
CC(=O)CCCCCSc1nc2ccccc2c2nc(C)nn12	ZINC000450771307	EH	On-Demand	Anodyne	PDE10A	18	57
CCOC(=O)[C@H](NC(=O)c1ccc2cnccc2c1)[C@@H]1CCCOC1	ZINC000450771308	EE	On-Demand	Anodyne	AKT1	25	49
CCOC(=O)[C@@H](NC(=O)c1ccc2cnccc2c1)[C@H]1CCCOC1	ZINC000450771310	EE	On-Demand	Anodyne	AKT1	25	49
CCOC(=O)[C@@H](NC(=O)c1ccc2cnccc2c1)[C@@H]1CCCOC1	ZINC000450771312	EE	On-Demand	Anodyne	AKT1	25	49
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	KIT	15	48
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	TRPV1	17	44
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	UL80	17	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	ATF1	45	32
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	PPARD	22	43
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	FLT1	17	44
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	KDR	21	47
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	NR1H4	20	47
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	SORT1	16	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	MTTP	73	38
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	NFKB1	41	32
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	SLC1A1	19	44
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	SLC1A2	31	44
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	TEK	29	40
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	BTK	28	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	PSBA	0	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	KCNK3	114	45
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450771313	EI	On-Demand	Anodyne	KCNK9	82	39
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771327	EH	On-Demand	Anodyne	PRNP	60	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771327	EH	On-Demand	Anodyne	HDAC1	30	46
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771327	EH	On-Demand	Anodyne	P4HTM	0	50
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771327	EH	On-Demand	Anodyne	MCHR1	18	52
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771327	EH	On-Demand	Anodyne	DGAT1	46	41
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771328	EH	On-Demand	Anodyne	PRNP	60	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771328	EH	On-Demand	Anodyne	HDAC1	30	46
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771328	EH	On-Demand	Anodyne	P4HTM	0	50
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771328	EH	On-Demand	Anodyne	MCHR1	18	52
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771328	EH	On-Demand	Anodyne	DGAT1	46	41
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771330	EH	On-Demand	Anodyne	PRNP	60	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771330	EH	On-Demand	Anodyne	HDAC1	30	46
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771330	EH	On-Demand	Anodyne	P4HTM	0	50
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771330	EH	On-Demand	Anodyne	MCHR1	18	52
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1C	ZINC000450771330	EH	On-Demand	Anodyne	DGAT1	46	41
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771332	EH	On-Demand	Anodyne	PRNP	60	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771332	EH	On-Demand	Anodyne	HDAC1	30	46
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771332	EH	On-Demand	Anodyne	P4HTM	0	50
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771332	EH	On-Demand	Anodyne	MCHR1	18	52
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@@H]1C	ZINC000450771332	EH	On-Demand	Anodyne	DGAT1	46	41
COc1cc2nc(N3CC[C@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771343	ED	On-Demand	Anodyne	ADRA1D	17	53
COc1cc2nc(N3CC[C@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771343	ED	On-Demand	Anodyne	ADRA1B	47	53
COc1cc2nc(N3CC[C@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771343	ED	On-Demand	Anodyne	PDE3A	51	40
COc1cc2nc(N3CC[C@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771343	ED	On-Demand	Anodyne	CCR4	48	41
COc1cc2nc(N3CC[C@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771343	ED	On-Demand	Anodyne	PDE3B	76	40
COc1cc2nc(N3CC[C@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771343	ED	On-Demand	Anodyne	EHMT2	64	36
COc1cc2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771347	ED	On-Demand	Anodyne	ADRA1D	17	53
COc1cc2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771347	ED	On-Demand	Anodyne	ADRA1B	47	53
COc1cc2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771347	ED	On-Demand	Anodyne	PDE3A	51	40
COc1cc2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771347	ED	On-Demand	Anodyne	CCR4	48	41
COc1cc2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771347	ED	On-Demand	Anodyne	PDE3B	76	40
COc1cc2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450771347	ED	On-Demand	Anodyne	EHMT2	64	36
COc1cc2nc(N3CC[C@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771348	ED	On-Demand	Anodyne	ADRA1D	17	53
COc1cc2nc(N3CC[C@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771348	ED	On-Demand	Anodyne	ADRA1B	47	53
COc1cc2nc(N3CC[C@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771348	ED	On-Demand	Anodyne	PDE3A	51	40
COc1cc2nc(N3CC[C@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771348	ED	On-Demand	Anodyne	CCR4	48	41
COc1cc2nc(N3CC[C@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771348	ED	On-Demand	Anodyne	PDE3B	76	40
COc1cc2nc(N3CC[C@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771348	ED	On-Demand	Anodyne	EHMT2	64	36
COc1cc2nc(N3CC[C@@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771349	ED	On-Demand	Anodyne	ADRA1D	17	53
COc1cc2nc(N3CC[C@@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771349	ED	On-Demand	Anodyne	ADRA1B	47	53
COc1cc2nc(N3CC[C@@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771349	ED	On-Demand	Anodyne	PDE3A	51	40
COc1cc2nc(N3CC[C@@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771349	ED	On-Demand	Anodyne	CCR4	48	41
COc1cc2nc(N3CC[C@@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771349	ED	On-Demand	Anodyne	PDE3B	76	40
COc1cc2nc(N3CC[C@@H](OC)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450771349	ED	On-Demand	Anodyne	EHMT2	64	36
CCNC(=O)c1ccc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000450771361	GG	On-Demand	Anodyne	SCD1	61	44
CCNC(=O)c1ccc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000450771361	GG	On-Demand	Anodyne	SCD	51	44
CC(C)CN(Cc1nnc(C2CC2)s1)[C@H]1CCCc2cccnc21	ZINC000450771365	EI	On-Demand	Anodyne	CXCR4	86	50
CC(C)CN(Cc1nnc(C2CC2)s1)[C@@H]1CCCc2cccnc21	ZINC000450771366	EI	On-Demand	Anodyne	CXCR4	86	50
Cc1cccc(Cl)c1C(=O)Nc1cc(C2CCCC2)nn1C	ZINC000450771368	DI	On-Demand	Anodyne	TYK2	60	38
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450771396	GI	On-Demand	Anodyne	RBP4	21	40
COCCOC[C@@H](O)CN1CCN(c2ccccc2)C(=O)C1	ZINC000450771397	DC	On-Demand	Anodyne	ABCB1	54	37
COCCOC[C@@H](O)CN1CCN(c2ccccc2)C(=O)C1	ZINC000450771397	DC	On-Demand	Anodyne	HSP90AB1	40	42
COCCOC[C@H](O)CN1CCN(c2ccccc2)C(=O)C1	ZINC000450771398	DC	On-Demand	Anodyne	ABCB1	54	37
COCCOC[C@H](O)CN1CCN(c2ccccc2)C(=O)C1	ZINC000450771398	DC	On-Demand	Anodyne	HSP90AB1	40	42
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450771409	FG	On-Demand	Anodyne	PDE4D	15	43
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450771411	FG	On-Demand	Anodyne	PDE4D	15	43
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450771413	FG	On-Demand	Anodyne	PDE4D	15	43
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450771415	FG	On-Demand	Anodyne	PDE4D	15	43
CCCN(CCc1cccs1)C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450771454	CH	On-Demand	Anodyne	HTR5A	15	40
CCCN(CCc1cccs1)C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450771455	CH	On-Demand	Anodyne	HTR5A	15	40
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@]3(C2)OCc2ccccc23)n1	ZINC000450771464	FH	On-Demand	Anodyne	AVPR2	18	40
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@]3(C2)OCc2ccccc23)n1	ZINC000450771464	FH	On-Demand	Anodyne	AVPR1A	18	41
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450771465	FH	On-Demand	Anodyne	AVPR2	18	40
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@@]3(C2)OCc2ccccc23)n1	ZINC000450771465	FH	On-Demand	Anodyne	AVPR1A	18	41
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](OC)[C@@H](C)C3)c2c1	ZINC000450771466	FH	On-Demand	Anodyne	PDE3A	50	43
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](OC)[C@@H](C)C3)c2c1	ZINC000450771466	FH	On-Demand	Anodyne	PDE3B	73	43
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](OC)[C@@H](C)C3)c2c1	ZINC000450771467	FH	On-Demand	Anodyne	PDE3A	50	43
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](OC)[C@@H](C)C3)c2c1	ZINC000450771467	FH	On-Demand	Anodyne	PDE3B	73	43
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](OC)[C@H](C)C3)c2c1	ZINC000450771468	FH	On-Demand	Anodyne	PDE3A	50	43
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](OC)[C@H](C)C3)c2c1	ZINC000450771468	FH	On-Demand	Anodyne	PDE3B	73	43
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](OC)[C@H](C)C3)c2c1	ZINC000450771469	FH	On-Demand	Anodyne	PDE3A	50	43
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](OC)[C@H](C)C3)c2c1	ZINC000450771469	FH	On-Demand	Anodyne	PDE3B	73	43
CS(=O)(=O)CCCCCNC(=O)[C@H]1CCCCC1(F)F	ZINC000450771473	DE	On-Demand	Anodyne	MME	17	41
CS(=O)(=O)CCCCCNC(=O)[C@@H]1CCCCC1(F)F	ZINC000450771474	DE	On-Demand	Anodyne	MME	17	41
CO[C@H]1CCN(c2ccnc3ccncc23)C[C@H]1C	ZINC000450771483	CE	On-Demand	Anodyne	PDE3B	53	35
CO[C@@H]1CCN(c2ccnc3ccncc23)C[C@H]1C	ZINC000450771484	CE	On-Demand	Anodyne	PDE3B	53	35
CO[C@H]1CCN(c2ccnc3ccncc23)C[C@@H]1C	ZINC000450771485	CE	On-Demand	Anodyne	PDE3B	53	35
CO[C@@H]1CCN(c2ccnc3ccncc23)C[C@@H]1C	ZINC000450771486	CE	On-Demand	Anodyne	PDE3B	53	35
CC(C)c1nccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450771491	EH	On-Demand	Bother	SORD	101	38
CC(C)c1nccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000450771492	EH	On-Demand	Bother	SORD	101	38
CCn1cnc2c(N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)ncnc21	ZINC000450771499	FG	On-Demand	Bother	SLC29A1	62	42
CCn1cnc2c(N3CCC[C@@H](c4ccc([N+](=O)[O-])cc4)C3)ncnc21	ZINC000450771500	FG	On-Demand	Bother	SLC29A1	62	42
COC(=O)[C@H](NC[C@H]1COCCO1)c1ccc(F)c(C)c1	ZINC000450771501	CD	On-Demand	Anodyne	LEF	50	35
COC(=O)[C@@H](NC[C@H]1COCCO1)c1ccc(F)c(C)c1	ZINC000450771502	CD	On-Demand	Anodyne	LEF	50	35
COC(=O)[C@@H](NC[C@@H]1COCCO1)c1ccc(F)c(C)c1	ZINC000450771503	CD	On-Demand	Anodyne	LEF	50	35
COC(=O)[C@H](NC[C@@H]1COCCO1)c1ccc(F)c(C)c1	ZINC000450771504	CD	On-Demand	Anodyne	LEF	50	35
COc1ccc(CN2CCCN(CCN(C)Cc3ccccc3)CC2=O)cc1	ZINC000450771505	GF	On-Demand	Anodyne	ACHE	30	42
COc1ccc(CN2CCCN(CCN(C)Cc3ccccc3)CC2=O)cc1	ZINC000450771505	GF	On-Demand	Anodyne	HRH3	17	45
COc1ccc(CN2CCCN(CCN(C)Cc3ccccc3)CC2=O)cc1	ZINC000450771505	GF	On-Demand	Anodyne	SIGMAR1	41	49
CC(=O)CCCCCSc1nc2ccccc2n1C(F)F	ZINC000450771530	DJ	On-Demand	Anodyne	PTGDR2	16	49
CCc1cc2c(N3CC[C@@H](OC)C(C)(C)C3)ncnc2s1	ZINC000450771557	DH	On-Demand	Anodyne	PDE3A	43	34
CCc1cc2c(N3CC[C@@H](OC)C(C)(C)C3)ncnc2s1	ZINC000450771557	DH	On-Demand	Anodyne	PDE3B	64	34
CCc1cc2c(N3CC[C@H](OC)C(C)(C)C3)ncnc2s1	ZINC000450771558	DH	On-Demand	Anodyne	PDE3A	43	34
CCc1cc2c(N3CC[C@H](OC)C(C)(C)C3)ncnc2s1	ZINC000450771558	DH	On-Demand	Anodyne	PDE3B	64	34
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cn3nccc3nc1C)[C@@H]2C	ZINC000450771575	FG	On-Demand	Anodyne	HCRTR2	17	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cn3nccc3nc1C)[C@H]2C	ZINC000450771576	FG	On-Demand	Anodyne	HCRTR2	17	40
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cn3nccc3nc1C)[C@H]2C	ZINC000450771577	FG	On-Demand	Anodyne	HCRTR2	17	40
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cn3nccc3nc1C)[C@@H]2C	ZINC000450771578	FG	On-Demand	Anodyne	HCRTR2	17	40
COCc1cc([N+](=O)[O-])ccc1N[C@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450771616	DF	On-Demand	Bother	CACNA1D	41	32
COCc1cc([N+](=O)[O-])ccc1N[C@H](C1CC1)[C@H](CO)C1CC1	ZINC000450771617	DF	On-Demand	Bother	CACNA1D	41	32
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450771618	DF	On-Demand	Bother	CACNA1D	41	32
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C1CC1)[C@H](CO)C1CC1	ZINC000450771619	DF	On-Demand	Bother	CACNA1D	41	32
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450771632	GH	On-Demand	Anodyne	MC4R	34	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450771632	GH	On-Demand	Anodyne	PRCP	52	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450771632	GH	On-Demand	Anodyne	MC3R	30	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450771632	GH	On-Demand	Anodyne	MC5R	24	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@H](COCC2CC2)C1	ZINC000450771633	GH	On-Demand	Anodyne	MC4R	34	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@H](COCC2CC2)C1	ZINC000450771633	GH	On-Demand	Anodyne	PRCP	52	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@H](COCC2CC2)C1	ZINC000450771633	GH	On-Demand	Anodyne	MC3R	30	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCO[C@H](COCC2CC2)C1	ZINC000450771633	GH	On-Demand	Anodyne	MC5R	24	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450771634	GH	On-Demand	Anodyne	MC4R	34	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450771634	GH	On-Demand	Anodyne	PRCP	52	37
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450771634	GH	On-Demand	Anodyne	MC3R	30	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450771634	GH	On-Demand	Anodyne	MC5R	24	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@H](COCC2CC2)C1	ZINC000450771635	GH	On-Demand	Anodyne	MC4R	34	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@H](COCC2CC2)C1	ZINC000450771635	GH	On-Demand	Anodyne	PRCP	52	37
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@H](COCC2CC2)C1	ZINC000450771635	GH	On-Demand	Anodyne	MC3R	30	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCO[C@H](COCC2CC2)C1	ZINC000450771635	GH	On-Demand	Anodyne	MC5R	24	40
CC(C)NC(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c([N+](=O)[O-])c1	ZINC000450771644	EE	On-Demand	Bother	TAAR1	22	47
CC(C)NC(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450771645	EE	On-Demand	Bother	TAAR1	22	47
CC(C)NC(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450771646	EE	On-Demand	Bother	TAAR1	22	47
COC(=O)[C@@H]1C[C@H](C)CCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450771660	DE	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@@H]1C[C@H](C)CCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450771661	DE	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@@H]1C[C@H](C)CCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450771662	DE	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@@H]1C[C@H](C)CCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450771663	DE	On-Demand	Anodyne	SLC6A3	23	40
CC(C)(C#N)CNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450771670	DE	On-Demand	Mild	CACNA1I	15	45
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	HTR1A	18	59
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	DRD2	32	46
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	DRD1	22	53
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	DRD4	26	47
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	HTR2A	34	51
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	HTR2C	24	59
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	ADRA1B	16	42
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	ERG2	21	46
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	SIGMAR1	15	46
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	SLC18A3	15	42
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	HTR3B	0	53
O=C(CCCN1CCC(c2nnc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450771711	FH	On-Demand	Anodyne	CYP2J2	57	40
CC(C)[C@H](CO)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771774	DF	On-Demand	Anodyne	ADORA1	48	47
CC(C)[C@H](CO)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771774	DF	On-Demand	Anodyne	ADORA2A	25	44
CC(C)[C@H](CO)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771774	DF	On-Demand	Anodyne	ADORA3	53	41
CC(C)[C@H](CO)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771774	DF	On-Demand	Anodyne	Q4VQ11_PIG	51	40
CC(C)[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](CO)C(C)C	ZINC000450771775	DF	On-Demand	Anodyne	ADORA1	48	47
CC(C)[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](CO)C(C)C	ZINC000450771775	DF	On-Demand	Anodyne	ADORA2A	25	44
CC(C)[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](CO)C(C)C	ZINC000450771775	DF	On-Demand	Anodyne	ADORA3	53	41
CC(C)[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](CO)C(C)C	ZINC000450771775	DF	On-Demand	Anodyne	Q4VQ11_PIG	51	40
CC(C)[C@H](CO)[C@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771776	DF	On-Demand	Anodyne	ADORA1	48	47
CC(C)[C@H](CO)[C@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771776	DF	On-Demand	Anodyne	ADORA2A	25	44
CC(C)[C@H](CO)[C@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771776	DF	On-Demand	Anodyne	ADORA3	53	41
CC(C)[C@H](CO)[C@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771776	DF	On-Demand	Anodyne	Q4VQ11_PIG	51	40
CC(C)[C@@H](CO)[C@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771779	DF	On-Demand	Anodyne	ADORA1	48	47
CC(C)[C@@H](CO)[C@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771779	DF	On-Demand	Anodyne	ADORA2A	25	44
CC(C)[C@@H](CO)[C@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771779	DF	On-Demand	Anodyne	ADORA3	53	41
CC(C)[C@@H](CO)[C@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450771779	DF	On-Demand	Anodyne	Q4VQ11_PIG	51	40
CC(C)(O)CCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450771787	CD	On-Demand	Anodyne	EPHX2	21	41
CC(C)(O)CCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450771787	CD	On-Demand	Anodyne	GPBAR1	30	42
CC(C)(O)CCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450771788	CD	On-Demand	Anodyne	EPHX2	21	41
CC(C)(O)CCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450771788	CD	On-Demand	Anodyne	GPBAR1	30	42
CC(C)(O)CCNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450771808	DD	On-Demand	Anodyne	CA2	24	44
CC1(C)[C@H]2CC[C@@]1(C(=O)N1Cc3ccccc3C3(CC3)C1)C(=O)C2	ZINC000450771833	DG	On-Demand	Anodyne	OXTR	55	40
Cc1ccn2ncc(C(=O)N3Cc4ccccc4C4(CC4)C3)c2c1	ZINC000450771848	DG	On-Demand	Anodyne	EPHB3	32	45
CC(C)OC(=O)C[C@@H]1CCCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450771850	EG	On-Demand	Anodyne	SLC6A1	48	40
CC(C)OC(=O)C[C@@H]1CCCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450771851	EG	On-Demand	Anodyne	SLC6A1	48	40
CC(C)OC(=O)C[C@@H]1CCCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450771852	EG	On-Demand	Anodyne	SLC6A1	48	40
CC(C)OC(=O)C[C@@H]1CCCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450771853	EG	On-Demand	Anodyne	SLC6A1	48	40
CO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450771854	CG	On-Demand	Anodyne	GYRB	15	47
CO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450771854	CG	On-Demand	Anodyne	HTR1D	42	36
CO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450771854	CG	On-Demand	Anodyne	METAP1	43	36
CO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450771855	CG	On-Demand	Anodyne	GYRB	15	47
CO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450771855	CG	On-Demand	Anodyne	HTR1D	42	36
CO[C@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450771855	CG	On-Demand	Anodyne	METAP1	43	36
CO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450771856	CG	On-Demand	Anodyne	GYRB	15	47
CO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450771856	CG	On-Demand	Anodyne	HTR1D	42	36
CO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@H]1C	ZINC000450771856	CG	On-Demand	Anodyne	METAP1	43	36
CO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450771857	CG	On-Demand	Anodyne	GYRB	15	47
CO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450771857	CG	On-Demand	Anodyne	HTR1D	42	36
CO[C@@H]1CCN(c2cc(C)nc3ccccc23)C[C@@H]1C	ZINC000450771857	CG	On-Demand	Anodyne	METAP1	43	36
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771870	EG	On-Demand	Anodyne	RBP4	49	31
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771870	EG	On-Demand	Anodyne	SFRP1	88	33
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771870	EG	On-Demand	Anodyne	WNT3	41	32
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771871	EG	On-Demand	Anodyne	RBP4	49	31
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771871	EG	On-Demand	Anodyne	SFRP1	88	33
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771871	EG	On-Demand	Anodyne	WNT3	41	32
Cc1ccn2ncc(C(=O)NCCCCN3C(=O)NC4(CCCC4)C3=O)c2c1	ZINC000450771878	GE	On-Demand	Anodyne	EPHB3	33	43
COC(=O)c1nc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)sc1C	ZINC000450771899	FH	On-Demand	Bother	SLC27A4	51	35
COC(=O)c1nc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)sc1C	ZINC000450771900	FH	On-Demand	Bother	SLC27A4	51	35
O=C(c1cc(Cl)c2ccccc2n1)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450771904	GJ	On-Demand	Anodyne	AVPR1A	0	44
O=C(c1cc(Cl)c2ccccc2n1)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450771905	GJ	On-Demand	Anodyne	AVPR1A	0	44
CO[C@H]1CCN(c2ncnc3c2CCCCC3)C[C@H]1C	ZINC000450771909	CF	On-Demand	Anodyne	PDE3B	65	34
CO[C@@H]1CCN(c2ncnc3c2CCCCC3)C[C@H]1C	ZINC000450771910	CF	On-Demand	Anodyne	PDE3B	65	34
CO[C@@H]1CCN(c2ncnc3c2CCCCC3)C[C@@H]1C	ZINC000450771911	CF	On-Demand	Anodyne	PDE3B	65	34
CO[C@H]1CCN(c2ncnc3c2CCCCC3)C[C@@H]1C	ZINC000450771912	CF	On-Demand	Anodyne	PDE3B	65	34
CC[C@@H](CN(CC)C(=O)c1c(C2CC2)noc1C)c1ccccc1	ZINC000450771928	EJ	On-Demand	Anodyne	NPY2R	21	41
CC[C@H](CN(CC)C(=O)c1c(C2CC2)noc1C)c1ccccc1	ZINC000450771929	EJ	On-Demand	Anodyne	NPY2R	21	41
Cc1nc(C)n(CCCC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450771943	GG	On-Demand	Anodyne	MTNR1A	28	42
Cc1nc(C)n(CCCC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450771943	GG	On-Demand	Anodyne	MTNR1B	0	42
Cc1nc(C)n(CCCC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450771944	GG	On-Demand	Anodyne	MTNR1A	28	42
Cc1nc(C)n(CCCC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000450771944	GG	On-Demand	Anodyne	MTNR1B	0	42
COCCC1(CNC(=O)c2ccc(C3CC3)nc2C)CCCCC1	ZINC000450771947	EH	On-Demand	Anodyne	HCN1	55	34
COCCC1(CNC(=O)c2ccc(C3CC3)nc2C)CCCCC1	ZINC000450771947	EH	On-Demand	Anodyne	HCN4	53	34
CO[C@@H]1CCN(c2noc3ccc(Br)cc23)C[C@H]1C	ZINC000450771948	EG	On-Demand	Anodyne	PDE3B	42	32
CO[C@H]1CCN(c2noc3ccc(Br)cc23)C[C@@H]1C	ZINC000450771949	EG	On-Demand	Anodyne	PDE3B	42	32
CO[C@@H]1CCN(c2noc3ccc(Br)cc23)C[C@@H]1C	ZINC000450771950	EG	On-Demand	Anodyne	PDE3B	42	32
CO[C@H]1CCN(c2noc3ccc(Br)cc23)C[C@H]1C	ZINC000450771951	EG	On-Demand	Anodyne	HRH4	19	44
CO[C@H]1CCN(c2noc3ccc(Br)cc23)C[C@H]1C	ZINC000450771951	EG	On-Demand	Anodyne	PDE3B	42	32
CC(C)OC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771952	FH	On-Demand	Anodyne	MTNR1A	31	45
CC(C)OC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771952	FH	On-Demand	Anodyne	MTNR1B	0	45
CC(C)OC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771952	FH	On-Demand	Anodyne	RBP4	56	32
CC(C)OC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771952	FH	On-Demand	Anodyne	SFRP1	91	38
CC(C)OC(C)(C)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771952	FH	On-Demand	Anodyne	WNT3	65	38
CC(C)OC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771953	FH	On-Demand	Anodyne	MTNR1A	31	45
CC(C)OC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771953	FH	On-Demand	Anodyne	MTNR1B	0	45
CC(C)OC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771953	FH	On-Demand	Anodyne	RBP4	56	32
CC(C)OC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771953	FH	On-Demand	Anodyne	SFRP1	91	38
CC(C)OC(C)(C)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000450771953	FH	On-Demand	Anodyne	WNT3	65	38
CCc1cc(CCCN(CC(C)C)[C@H]2CCCc3cccnc32)on1	ZINC000450771987	EJ	On-Demand	Anodyne	CXCR4	87	47
CCc1cc(CCCN(CC(C)C)[C@@H]2CCCc3cccnc32)on1	ZINC000450771991	EJ	On-Demand	Anodyne	CXCR4	87	47
Clc1ccc(C2CCN(CCc3cscn3)CC2)cc1	ZINC000450772005	DI	On-Demand	Anodyne	SCN5A	42	35
CC(F)(F)C(C)(C)C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450772006	EI	On-Demand	Anodyne	RBP4	33	41
COc1cc(CN2CCC[C@@H]2c2csc(C)n2)ccc1Cl	ZINC000450772017	DI	On-Demand	Anodyne	HCRTR1	17	42
COc1cc(CN2CCC[C@@H]2c2csc(C)n2)ccc1Cl	ZINC000450772017	DI	On-Demand	Anodyne	SSTR5	44	36
CN1C(=O)C[C@@H](C(=O)NC[C@H](c2ccccc2)C(F)(F)F)[C@@H]1c1cccnc1	ZINC000450772038	GG	On-Demand	Anodyne	HSD17B2	85	39
CC(C)(C)OC(=O)[C@H]1CCCN(CC2CCC(=O)CC2)C1	ZINC000450772083	CF	On-Demand	Anodyne	SLC6A1	44	32
CC(C)(C)OC(=O)[C@@H]1CCCN(CC2CCC(=O)CC2)C1	ZINC000450772084	CF	On-Demand	Anodyne	SLC6A1	44	32
O=C1CCC[C@H]1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450772092	GG	On-Demand	Anodyne	PRCP	17	41
O=C1CCC[C@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450772096	GG	On-Demand	Anodyne	PRCP	17	41
O=C1CCC[C@@H]1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450772101	GG	On-Demand	Anodyne	PRCP	17	41
CC(=O)N[C@H](C)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450772105	DG	On-Demand	Anodyne	PRCP	21	41
CC(=O)N[C@@H](C)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450772107	DG	On-Demand	Anodyne	PRCP	21	41
CC(=O)N[C@@H](C)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450772109	DG	On-Demand	Anodyne	PRCP	21	41
CC(=O)N[C@H](C)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450772111	DG	On-Demand	Anodyne	PRCP	21	41
CC(=O)c1cccc(CN2CCN(c3cccc(F)c3)C(=O)C2)c1	ZINC000450772124	EF	On-Demand	Anodyne	CCR3	23	41
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	HTR1A	15	47
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	DRD2	26	54
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	DRD4	15	46
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	HTR2A	28	48
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	HTR7	26	46
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	PRCP	37	47
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	COLA	22	42
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	CPT1A	20	42
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	HTR3B	0	40
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	MCHR1	15	50
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	CYP2J2	67	48
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	SMO	54	37
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccccc1	ZINC000450772177	EH	On-Demand	Anodyne	ETHR	70	44
CO[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@H]1C	ZINC000450772204	FE	On-Demand	Anodyne	LRRK2	32	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450772208	GH	On-Demand	Anodyne	GHRHR	82	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@]2(C1)OCc1ccccc12	ZINC000450772208	GH	On-Demand	Anodyne	GHSR	21	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450772209	GH	On-Demand	Anodyne	GHRHR	82	39
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@]2(C1)OCc1ccccc12	ZINC000450772209	GH	On-Demand	Anodyne	GHSR	21	42
CO[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@H]1C	ZINC000450772213	FE	On-Demand	Anodyne	LRRK2	32	44
CO[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@@H]1C	ZINC000450772216	FE	On-Demand	Anodyne	LRRK2	32	44
COc1ccc(CN2CCCN(Cc3ccccc3OC3CC3)CC2=O)cc1	ZINC000450772217	GG	On-Demand	Anodyne	PDE4A	17	40
COc1ccc(CN2CCCN(Cc3ccccc3OC3CC3)CC2=O)cc1	ZINC000450772217	GG	On-Demand	Anodyne	SIGMAR1	19	40
COc1ccc(CN2CCCN(Cc3ccccc3OC3CC3)CC2=O)cc1	ZINC000450772217	GG	On-Demand	Anodyne	NOX4	18	41
COc1ccc(CN2CCCN(Cc3ccccc3OC3CC3)CC2=O)cc1	ZINC000450772217	GG	On-Demand	Anodyne	CYBB	36	40
COc1ccc(CN2CCCN(Cc3ccccc3OC3CC3)CC2=O)cc1	ZINC000450772217	GG	On-Demand	Anodyne	NOX1	44	41
COc1ccc(CN2CCCN(Cc3ccccc3OC3CC3)CC2=O)cc1	ZINC000450772217	GG	On-Demand	Anodyne	SLC5A4	44	34
COc1ccc(CN2CCCN(Cc3ccccc3OC3CC3)CC2=O)cc1	ZINC000450772217	GG	On-Demand	Anodyne	NOX5	50	41
CO[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@@H]1C	ZINC000450772219	FE	On-Demand	Anodyne	LRRK2	32	44
CC(C)(O)CCNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450772230	CE	On-Demand	Anodyne	KCNQ1	0	42
CC(C)(O)CCNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450772230	CE	On-Demand	Anodyne	EPHX2	23	42
C[C@@H](O)CCN1C(=O)N[C@@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450772235	EF	On-Demand	Anodyne	DNAE	25	40
C[C@H](O)CCN1C(=O)N[C@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450772237	EF	On-Demand	Anodyne	DNAE	25	40
C[C@H](O)CCN1C(=O)N[C@@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450772238	EF	On-Demand	Anodyne	DNAE	25	40
C[C@@H](O)CCN1C(=O)N[C@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450772239	EF	On-Demand	Anodyne	DNAE	25	40
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3ncnc4[nH]ccc34)C2)cc1	ZINC000450772259	DG	On-Demand	Bother	AKT2	41	42
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3ncnc4[nH]ccc34)C2)cc1	ZINC000450772259	DG	On-Demand	Bother	JAK3	17	53
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3ncnc4[nH]ccc34)C2)cc1	ZINC000450772259	DG	On-Demand	Bother	JAK2	15	41
O=[N+]([O-])c1ccc([C@@H]2CCCN(c3ncnc4[nH]ccc34)C2)cc1	ZINC000450772259	DG	On-Demand	Bother	AKT1	34	40
O=[N+]([O-])c1ccc([C@H]2CCCN(c3ncnc4[nH]ccc34)C2)cc1	ZINC000450772260	DG	On-Demand	Bother	AKT2	41	42
O=[N+]([O-])c1ccc([C@H]2CCCN(c3ncnc4[nH]ccc34)C2)cc1	ZINC000450772260	DG	On-Demand	Bother	JAK3	17	53
O=[N+]([O-])c1ccc([C@H]2CCCN(c3ncnc4[nH]ccc34)C2)cc1	ZINC000450772260	DG	On-Demand	Bother	JAK2	15	41
O=[N+]([O-])c1ccc([C@H]2CCCN(c3ncnc4[nH]ccc34)C2)cc1	ZINC000450772260	DG	On-Demand	Bother	AKT1	34	40
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450772278	EG	On-Demand	Anodyne	PDE3A	58	45
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450772278	EG	On-Demand	Anodyne	PDE3B	86	45
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450772280	EG	On-Demand	Anodyne	PDE3A	58	45
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450772280	EG	On-Demand	Anodyne	PDE3B	86	45
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450772282	EG	On-Demand	Anodyne	PDE3A	58	45
CO[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450772282	EG	On-Demand	Anodyne	PDE3B	86	45
CO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450772283	CG	On-Demand	Anodyne	HNMT	40	31
CO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450772283	CG	On-Demand	Anodyne	HTT	0	43
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450772284	EG	On-Demand	Anodyne	PDE3A	58	45
CO[C@H]1CCN(c2ncnc3cc(Br)ccc23)C[C@H]1C	ZINC000450772284	EG	On-Demand	Anodyne	PDE3B	86	45
CO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450772294	CG	On-Demand	Anodyne	HNMT	40	31
CO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450772294	CG	On-Demand	Anodyne	HTT	0	43
CO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450772295	CG	On-Demand	Anodyne	HNMT	40	31
CO[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450772295	CG	On-Demand	Anodyne	HTT	0	43
CO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450772297	CG	On-Demand	Anodyne	HNMT	40	31
CO[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450772297	CG	On-Demand	Anodyne	HTT	0	43
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	DRD4	34	46
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	DRD3	25	50
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	HTR4	55	39
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	SIGMAR1	28	46
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	SSTR5	52	39
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	CCR3	58	48
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	UTS2R	23	48
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	PDK1	47	36
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	CXCR3	36	40
CNC(=O)N[C@@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772307	ED	On-Demand	Anodyne	MCHR1	40	46
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	DRD4	34	46
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	DRD3	25	50
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	HTR4	55	39
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	SIGMAR1	28	46
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	SSTR5	52	39
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	CCR3	58	48
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	UTS2R	23	48
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	PDK1	47	36
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	CXCR3	36	40
CNC(=O)N[C@H]1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450772308	ED	On-Demand	Anodyne	MCHR1	40	46
COCCC1(CNC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CCCCC1	ZINC000450772349	GH	On-Demand	Anodyne	HCN1	51	32
COCCC1(CNC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CCCCC1	ZINC000450772349	GH	On-Demand	Anodyne	HCN4	49	32
COC(=O)c1nc(N2CC[C@@H](OC)[C@H](C)C2)sc1C	ZINC000450772352	CE	On-Demand	Anodyne	GYRB	0	48
COC(=O)c1nc(N2CC[C@@H](OC)[C@H](C)C2)sc1C	ZINC000450772352	CE	On-Demand	Anodyne	PARE	40	33
COC(=O)c1nc(N2CC[C@H](OC)[C@H](C)C2)sc1C	ZINC000450772353	CE	On-Demand	Anodyne	GYRB	0	48
COC(=O)c1nc(N2CC[C@H](OC)[C@H](C)C2)sc1C	ZINC000450772353	CE	On-Demand	Anodyne	PARE	40	33
COC(=O)c1nc(N2CC[C@@H](OC)[C@@H](C)C2)sc1C	ZINC000450772354	CE	On-Demand	Anodyne	GYRB	0	48
COC(=O)c1nc(N2CC[C@@H](OC)[C@@H](C)C2)sc1C	ZINC000450772354	CE	On-Demand	Anodyne	PARE	40	33
COC(=O)c1nc(N2CC[C@H](OC)[C@@H](C)C2)sc1C	ZINC000450772355	CE	On-Demand	Anodyne	GYRB	0	48
COC(=O)c1nc(N2CC[C@H](OC)[C@@H](C)C2)sc1C	ZINC000450772355	CE	On-Demand	Anodyne	PARE	40	33
CO[C@@H]1CCN(c2c(C)cnc3c(C)cccc23)C[C@H]1C	ZINC000450772356	CH	On-Demand	Anodyne	ATP4A	18	40
CO[C@@H]1CCN(c2c(C)cnc3c(C)cccc23)C[C@@H]1C	ZINC000450772357	CH	On-Demand	Anodyne	ATP4A	18	40
CO[C@H]1CCN(c2c(C)cnc3c(C)cccc23)C[C@@H]1C	ZINC000450772358	CH	On-Demand	Anodyne	ATP4A	18	40
CO[C@H]1CCN(c2c(C)cnc3c(C)cccc23)C[C@H]1C	ZINC000450772359	CH	On-Demand	Anodyne	ATP4A	18	40
COC(=O)[C@H]1C[C@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450772363	DF	On-Demand	Anodyne	PREP	24	40
COC(=O)[C@H]1C[C@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450772363	DF	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@H]1C[C@@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450772364	DF	On-Demand	Anodyne	PREP	24	40
COC(=O)[C@H]1C[C@@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450772364	DF	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@@H]1C[C@@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450772365	DF	On-Demand	Anodyne	PREP	24	40
COC(=O)[C@@H]1C[C@@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450772365	DF	On-Demand	Anodyne	CYP2J2	56	40
COC(=O)[C@@H]1C[C@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450772366	DF	On-Demand	Anodyne	PREP	24	40
COC(=O)[C@@H]1C[C@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450772366	DF	On-Demand	Anodyne	CYP2J2	56	40
O=C(c1cncc(Cl)c1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000450772379	EJ	On-Demand	Anodyne	UTS2R	45	32
O=C(c1cncc(Cl)c1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000450772380	EJ	On-Demand	Anodyne	UTS2R	45	32
O=C(c1cncc(Cl)c1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000450772381	EJ	On-Demand	Anodyne	UTS2R	45	32
O=C(c1cncc(Cl)c1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000450772382	EJ	On-Demand	Anodyne	UTS2R	45	32
CC(C)[C@H](CO)[C@@H](Nc1ncccc1[N+](=O)[O-])C(C)C	ZINC000450772387	CF	On-Demand	Bother	COLA	42	32
CC(C)[C@@H](CO)[C@H](Nc1ncccc1[N+](=O)[O-])C(C)C	ZINC000450772388	CF	On-Demand	Bother	COLA	42	32
CC(C)[C@H](CO)[C@H](Nc1ncccc1[N+](=O)[O-])C(C)C	ZINC000450772389	CF	On-Demand	Bother	COLA	42	32
CC(C)[C@H](Nc1ncccc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450772390	CF	On-Demand	Bother	COLA	42	32
COc1cccc(OCCC(=O)Nc2cc(C3CCCC3)nn2C)c1	ZINC000450772391	EG	On-Demand	Anodyne	MTNR1A	27	41
Cc1ccn2ncc(C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)c2c1	ZINC000450772410	DE	On-Demand	Anodyne	EPHB3	20	44
Cc1ccn2ncc(C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)c2c1	ZINC000450772411	DE	On-Demand	Anodyne	EPHB3	20	44
Cc1cc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)nn1C(C)C	ZINC000450772420	GF	On-Demand	Anodyne	NPBWR1	15	40
CC(C)CN(C[C@H]1C[C@H]2CC[C@H]1O2)[C@H]1CCCc2cccnc21	ZINC000450772422	DH	On-Demand	Anodyne	CXCR4	83	44
CC(C)CN(C[C@H]1C[C@H]2CC[C@H]1O2)[C@@H]1CCCc2cccnc21	ZINC000450772423	DH	On-Demand	Anodyne	CXCR4	83	44
CC(C)CN(C[C@@H]1C[C@H]2CC[C@H]1O2)[C@@H]1CCCc2cccnc21	ZINC000450772424	DH	On-Demand	Anodyne	CXCR4	83	44
CC(C)CN(C[C@@H]1C[C@H]2CC[C@H]1O2)[C@H]1CCCc2cccnc21	ZINC000450772425	DH	On-Demand	Anodyne	CXCR4	83	44
COC(=O)[C@@H]1C[C@@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450772427	DG	On-Demand	Anodyne	HTR3B	0	40
COC(=O)[C@@H]1C[C@@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450772427	DG	On-Demand	Anodyne	CYP2J2	49	34
COC(=O)[C@@H]1C[C@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450772428	DG	On-Demand	Anodyne	HTR3B	0	40
COC(=O)[C@@H]1C[C@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450772428	DG	On-Demand	Anodyne	CYP2J2	49	34
COC(=O)[C@H]1C[C@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450772429	DG	On-Demand	Anodyne	HTR3B	0	40
COC(=O)[C@H]1C[C@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450772429	DG	On-Demand	Anodyne	CYP2J2	49	34
COC(=O)[C@H]1C[C@@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450772430	DG	On-Demand	Anodyne	HTR3B	0	40
COC(=O)[C@H]1C[C@@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450772430	DG	On-Demand	Anodyne	CYP2J2	49	34
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450772443	CF	On-Demand	Mild	MTTP	42	35
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450772444	CF	On-Demand	Mild	MTTP	42	35
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450772445	CF	On-Demand	Mild	MTTP	42	35
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450772446	CF	On-Demand	Mild	MTTP	42	35
O=C(Nc1cccc(CCCO)c1)c1ccnn1CC(F)(F)F	ZINC000450772459	EF	On-Demand	Anodyne	FLT1	24	52
CC(C)(O)CCNC(=O)c1ccc(I)cc1F	ZINC000450772464	FE	On-Demand	Anodyne	MAP2K1	41	33
CO[C@@H]1CCN(c2cc(N3CCC[C@H](CO)C3)ncn2)C[C@H]1C	ZINC000450772471	DD	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(N3CCC[C@@H](CO)C3)ncn2)C[C@H]1C	ZINC000450772472	DD	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(N3CCC[C@@H](CO)C3)ncn2)C[C@@H]1C	ZINC000450772473	DD	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2cc(N3CCC[C@H](CO)C3)ncn2)C[C@@H]1C	ZINC000450772474	DD	On-Demand	Anodyne	PDE3A	42	32
CO[C@@H]1CCN(c2ccnc3cc(Br)ccc23)C[C@H]1C	ZINC000450772475	EH	On-Demand	Anodyne	PDE3A	42	33
CO[C@@H]1CCN(c2ccnc3cc(Br)ccc23)C[C@H]1C	ZINC000450772475	EH	On-Demand	Anodyne	PDE3B	41	34
CO[C@H]1CCN(c2ccnc3cc(Br)ccc23)C[C@H]1C	ZINC000450772476	EH	On-Demand	Anodyne	PDE3A	42	33
CO[C@H]1CCN(c2ccnc3cc(Br)ccc23)C[C@H]1C	ZINC000450772476	EH	On-Demand	Anodyne	PDE3B	41	34
CO[C@@H]1CCN(c2ccnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450772477	EH	On-Demand	Anodyne	PDE3A	42	33
CO[C@@H]1CCN(c2ccnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450772477	EH	On-Demand	Anodyne	PDE3B	41	34
CO[C@H]1CCN(c2ccnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450772478	EH	On-Demand	Anodyne	PDE3A	42	33
CO[C@H]1CCN(c2ccnc3cc(Br)ccc23)C[C@@H]1C	ZINC000450772478	EH	On-Demand	Anodyne	PDE3B	41	34
CC(=O)N1CCN(C(=O)C2CCN(c3nc(-c4ccccc4)cs3)CC2)CC1	ZINC000450772489	GF	On-Demand	Anodyne	P2RY12	51	37
CC(=O)N1CCN(C(=O)C2CCN(c3nc(-c4ccccc4)cs3)CC2)CC1	ZINC000450772489	GF	On-Demand	Anodyne	COLA	28	40
CC(=O)N1CCN(C(=O)C2CCN(c3nc(-c4ccccc4)cs3)CC2)CC1	ZINC000450772489	GF	On-Demand	Anodyne	CPT1A	26	40
CC(=O)N1CCN(C(=O)C2CCN(c3nc(-c4ccccc4)cs3)CC2)CC1	ZINC000450772489	GF	On-Demand	Anodyne	FAAH	0	51
CCN(C)C(=O)CNC(=O)c1cc2ccncc2s1	ZINC000450772512	CD	On-Demand	Anodyne	ICAM1	41	37
CCN(C)C(=O)CNC(=O)c1cc2ccncc2s1	ZINC000450772512	CD	On-Demand	Anodyne	VCAM1	45	32
CCOC(=O)[C@H]1CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450772517	CE	On-Demand	Anodyne	ACE	26	40
CCOC(=O)[C@H]1CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450772517	CE	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450772517	CE	On-Demand	Anodyne	POL	0	47
CCOC(=O)[C@H]1CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450772518	CE	On-Demand	Anodyne	ACE	26	40
CCOC(=O)[C@H]1CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450772518	CE	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450772518	CE	On-Demand	Anodyne	POL	0	47
CCOC(=O)[C@H]1CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450772519	CE	On-Demand	Anodyne	ACE	26	40
CCOC(=O)[C@H]1CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450772519	CE	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450772519	CE	On-Demand	Anodyne	POL	0	47
CCOC(=O)[C@H]1CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450772520	CE	On-Demand	Anodyne	ACE	26	40
CCOC(=O)[C@H]1CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450772520	CE	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450772520	CE	On-Demand	Anodyne	POL	0	47
CCN(C)C(=O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450772538	FE	On-Demand	Anodyne	AVPR1B	47	43
CCN(C)C(=O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450772538	FE	On-Demand	Anodyne	TSPO	55	39
CCN(C)C(=O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450772538	FE	On-Demand	Anodyne	PDE6D	72	38
CCN(C)C(=O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450772538	FE	On-Demand	Anodyne	HDAC8	28	43
CCN(C)C(=O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450772538	FE	On-Demand	Anodyne	HDAC6	22	43
CCN(C)C(=O)CNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450772538	FE	On-Demand	Anodyne	IMDH_CRYPV	36	54
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772539	GE	On-Demand	Bother	CACNA1C	60	38
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772539	GE	On-Demand	Bother	CACNA1D	91	38
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772539	GE	On-Demand	Bother	IRAK4	23	43
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772540	GE	On-Demand	Bother	CACNA1C	60	38
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772540	GE	On-Demand	Bother	CACNA1D	91	38
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772540	GE	On-Demand	Bother	IRAK4	23	43
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772541	GE	On-Demand	Bother	CACNA1C	60	38
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772541	GE	On-Demand	Bother	CACNA1D	91	38
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772541	GE	On-Demand	Bother	IRAK4	23	43
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772542	GE	On-Demand	Bother	CACNA1C	60	38
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772542	GE	On-Demand	Bother	CACNA1D	91	38
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450772542	GE	On-Demand	Bother	IRAK4	23	43
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450772551	GH	On-Demand	Anodyne	PRCP	42	35
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450772552	GH	On-Demand	Anodyne	PRCP	42	35
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450772553	GH	On-Demand	Anodyne	PRCP	42	35
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450772554	GH	On-Demand	Anodyne	PRCP	42	35
CO[C@@H]1CCN(c2ccc(C#N)cn2)C[C@@H]1C	ZINC000450772557	BD	On-Demand	Mild	SMO	0	44
CO[C@H]1CCN(c2ccc(C#N)cn2)C[C@@H]1C	ZINC000450772558	BD	On-Demand	Mild	SMO	0	44
CO[C@H]1CCN(c2ccc(C#N)cn2)C[C@H]1C	ZINC000450772559	BD	On-Demand	Mild	SMO	0	44
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450772578	GH	On-Demand	Anodyne	THRA	0	40
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450772578	GH	On-Demand	Anodyne	DRD4	0	43
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450772578	GH	On-Demand	Anodyne	PRCP	16	44
CC(=O)N[C@@H](C)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450772578	GH	On-Demand	Anodyne	CYP2J2	63	44
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450772579	GH	On-Demand	Anodyne	THRA	0	40
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450772579	GH	On-Demand	Anodyne	DRD4	0	43
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450772579	GH	On-Demand	Anodyne	PRCP	16	44
CC(=O)N[C@H](C)C1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450772579	GH	On-Demand	Anodyne	CYP2J2	63	44
CC(C)(C)NC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450772609	EF	On-Demand	Anodyne	HTR1A	30	48
CC(C)(C)NC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450772609	EF	On-Demand	Anodyne	DRD2	29	41
CC(C)(C)NC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450772609	EF	On-Demand	Anodyne	DRD1	23	47
CC(C)(C)NC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450772609	EF	On-Demand	Anodyne	DRD4	26	47
CC(C)(C)NC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450772609	EF	On-Demand	Anodyne	HTR2A	25	47
CC(C)(C)NC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450772609	EF	On-Demand	Anodyne	HTR7	50	50
CC(C)(C)NC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450772609	EF	On-Demand	Anodyne	SLC18A3	23	42
CC(C)(C)NC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450772609	EF	On-Demand	Anodyne	CYP2J2	67	50
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1nn(C)c3c1CCCC3)[C@H]2C	ZINC000450772610	FG	On-Demand	Anodyne	HCRTR2	23	41
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1nn(C)c3c1CCCC3)[C@H]2C	ZINC000450772611	FG	On-Demand	Anodyne	HCRTR2	23	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1nn(C)c3c1CCCC3)[C@@H]2C	ZINC000450772612	FG	On-Demand	Anodyne	HCRTR2	23	41
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1nn(C)c3c1CCCC3)[C@@H]2C	ZINC000450772613	FG	On-Demand	Anodyne	HCRTR2	23	41
CCS(=O)(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000450772636	GG	On-Demand	Anodyne	SIGMAR1	25	41
CCS(=O)(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000450772636	GG	On-Demand	Anodyne	MMP13	15	48
CCS(=O)(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000450772636	GG	On-Demand	Anodyne	ADAM17	21	48
Cn1nc(C(=O)Nc2cccc(CCCO)c2)c2c1CCCC2	ZINC000450772668	DE	On-Demand	Anodyne	KCNK3	43	31
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450772680	EE	On-Demand	Anodyne	NPBWR1	25	45
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450772682	FE	On-Demand	Anodyne	NPBWR1	26	47
CO[C@H](CSc1nc2ccccc2c2nc(C)nn12)Cc1ccccc1	ZINC000450772716	FH	On-Demand	Anodyne	PDE10A	19	59
CO[C@@H](CSc1nc2ccccc2c2nc(C)nn12)Cc1ccccc1	ZINC000450772717	FH	On-Demand	Anodyne	PDE10A	19	59
COc1ccc(-c2noc(CN3CCN(C4CC4)c4ccc(F)cc43)n2)nn1	ZINC000450772726	GF	On-Demand	Anodyne	SCD1	15	41
COc1ccc(-c2noc(CN3CCN(C4CC4)c4ccc(F)cc43)n2)nn1	ZINC000450772726	GF	On-Demand	Anodyne	SCD	24	41
CS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c(F)c1	ZINC000450772741	EE	On-Demand	Anodyne	GPR119	20	40
CS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c(F)c1	ZINC000450772742	EE	On-Demand	Anodyne	GPR119	20	40
CS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c(F)c1	ZINC000450772743	EE	On-Demand	Anodyne	GPR119	20	40
CS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c(F)c1	ZINC000450772744	EE	On-Demand	Anodyne	GPR119	20	40
Cn1ncc(Br)c1C(=O)Nc1cccc(CCCO)c1	ZINC000450772758	EE	On-Demand	Anodyne	HTR2A	18	40
Cn1ncc(Br)c1C(=O)Nc1cccc(CCCO)c1	ZINC000450772758	EE	On-Demand	Anodyne	FLT1	24	43
CO[C@@H]1CCN(c2ccc(C#N)cn2)C[C@H]1C	ZINC000450772760	BD	On-Demand	Mild	SMO	0	44
CO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450772765	CF	On-Demand	Anodyne	PDE3A	62	48
CO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450772765	CF	On-Demand	Anodyne	PDGFRB	32	42
CO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450772765	CF	On-Demand	Anodyne	PDE3B	91	48
CO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450772766	CF	On-Demand	Anodyne	PDE3A	62	48
CO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450772766	CF	On-Demand	Anodyne	PDGFRB	32	42
CO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@H]1C	ZINC000450772766	CF	On-Demand	Anodyne	PDE3B	91	48
CO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450772767	CF	On-Demand	Anodyne	PDE3A	62	48
CO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450772767	CF	On-Demand	Anodyne	PDGFRB	32	42
CO[C@@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450772767	CF	On-Demand	Anodyne	PDE3B	91	48
CO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450772768	CF	On-Demand	Anodyne	PDE3A	62	48
CO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450772768	CF	On-Demand	Anodyne	PDGFRB	32	42
CO[C@H]1CCN(c2ncnc3ccc(C)cc23)C[C@@H]1C	ZINC000450772768	CF	On-Demand	Anodyne	PDE3B	91	48
CO[C@@H]1CCN(c2nc3ccccc3cc2CO)C[C@@H]1C	ZINC000450772778	CF	On-Demand	Anodyne	PDE3B	48	36
CO[C@H]1CCN(c2nc3ccccc3cc2CO)C[C@@H]1C	ZINC000450772779	CF	On-Demand	Anodyne	PDE3B	48	36
CO[C@@H]1CCN(c2nc3ccccc3cc2CO)C[C@H]1C	ZINC000450772780	CF	On-Demand	Anodyne	PDE3B	48	36
CO[C@H]1CCN(c2nc3ccccc3cc2CO)C[C@H]1C	ZINC000450772781	CF	On-Demand	Anodyne	PDE3B	48	36
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(Cl)cn3)C2)CC1	ZINC000450772782	FF	On-Demand	Anodyne	SSTR3	22	40
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(Cl)cn3)C2)CC1	ZINC000450772782	FF	On-Demand	Anodyne	NPBWR1	48	36
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(Cl)cn3)C2)CC1	ZINC000450772783	FF	On-Demand	Anodyne	SSTR3	22	40
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(Cl)cn3)C2)CC1	ZINC000450772783	FF	On-Demand	Anodyne	NPBWR1	48	36
COc1ccc([N+](=O)[O-])c(N2CCC(C(=O)N3CCN(C(C)=O)CC3)CC2)c1	ZINC000450772785	GD	On-Demand	Bother	SSTR2	40	41
COc1ccc([N+](=O)[O-])c(N2CCC(C(=O)N3CCN(C(C)=O)CC3)CC2)c1	ZINC000450772785	GD	On-Demand	Bother	MTNR1B	15	44
COc1ccc([N+](=O)[O-])c(N2CCC(C(=O)N3CCN(C(C)=O)CC3)CC2)c1	ZINC000450772785	GD	On-Demand	Bother	SSTR1	55	43
COc1ccc([N+](=O)[O-])c(N2CCC(C(=O)N3CCN(C(C)=O)CC3)CC2)c1	ZINC000450772785	GD	On-Demand	Bother	TAAR1	22	48
O=C([C@@H]1CCN(c2ccccc2)C1)N1Cc2ccccc2C2(CC2)C1	ZINC000450772786	EH	On-Demand	Anodyne	HTR2A	0	42
O=C([C@@H]1CCN(c2ccccc2)C1)N1Cc2ccccc2C2(CC2)C1	ZINC000450772786	EH	On-Demand	Anodyne	HTR2B	0	42
O=C([C@H]1CCN(c2ccccc2)C1)N1Cc2ccccc2C2(CC2)C1	ZINC000450772787	EH	On-Demand	Anodyne	HTR2A	0	42
O=C([C@H]1CCN(c2ccccc2)C1)N1Cc2ccccc2C2(CC2)C1	ZINC000450772787	EH	On-Demand	Anodyne	HTR2B	0	42
CCC(=O)CCCN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450772789	CF	On-Demand	Anodyne	ETHR	63	47
O=c1c(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nccn1C(F)F	ZINC000450772794	FH	On-Demand	Anodyne	AKT2	23	40
O=c1c(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nccn1C(F)F	ZINC000450772794	FH	On-Demand	Anodyne	AKT1	0	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(C)(C)O	ZINC000450772818	DD	On-Demand	Anodyne	CAPN1	27	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCCC(C)(C)O	ZINC000450772818	DD	On-Demand	Anodyne	NPR	48	37
C/C=C\COc1cccc(CC(=O)NCCC(C)(C)O)c1	ZINC000450772832	CE	On-Demand	Anodyne	CRTM	43	38
C/C=C\COc1cccc(CC(=O)NCCC(C)(C)O)c1	ZINC000450772832	CE	On-Demand	Anodyne	CAN2	0	40
CC(C)(O)CCNC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450772833	ED	On-Demand	Mild	TRPV4	40	31
O=C1CCC(CN2CCC(COc3ccccc3C(F)(F)F)CC2)CC1	ZINC000450772877	FJ	On-Demand	Anodyne	SIGMAR1	28	51
COc1ccc2c(N3C[C@H]4CCCC[C@H]4C3)ncnc2c1F	ZINC000450772878	DG	On-Demand	Anodyne	PDE3A	48	38
OC1(Cc2ccc(F)cc2)CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450772886	FH	On-Demand	Anodyne	SIGMAR1	26	40
COc1ccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2c1F	ZINC000450772897	DE	On-Demand	Anodyne	PDE3A	44	35
COc1ccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2c1F	ZINC000450772897	DE	On-Demand	Anodyne	PDE3B	42	35
COc1ccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1F	ZINC000450772898	DE	On-Demand	Anodyne	PDE3A	44	35
COc1ccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1F	ZINC000450772898	DE	On-Demand	Anodyne	PDE3B	42	35
COc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1F	ZINC000450772899	DE	On-Demand	Anodyne	PDE3A	44	35
COc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1F	ZINC000450772899	DE	On-Demand	Anodyne	PDE3B	42	35
O=C(c1cnc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c(Cl)c1)N1CCCCC1	ZINC000450772901	FF	On-Demand	Anodyne	CXCR3	26	50
O=C(c1cnc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450772902	FF	On-Demand	Anodyne	CXCR3	26	50
O=C(c1cnc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450772903	FF	On-Demand	Anodyne	CXCR3	26	50
CC(C)OC(=O)[C@@H](Nc1ccc([N+](=O)[O-])cc1C#N)C(C)C	ZINC000450772938	DF	On-Demand	Mild	GRB7	0	43
COC(=O)c1ccc([C@@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772948	FG	On-Demand	Anodyne	ADRB1	22	43
COC(=O)c1ccc([C@@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772948	FG	On-Demand	Anodyne	ADRB3	31	40
COC(=O)c1ccc([C@@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772948	FG	On-Demand	Anodyne	ANPEP	40	31
COC(=O)c1ccc([C@@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772948	FG	On-Demand	Anodyne	CTSF	54	39
COC(=O)c1ccc([C@@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772948	FG	On-Demand	Anodyne	CTSS	15	40
COC(=O)c1ccc([C@@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772948	FG	On-Demand	Anodyne	POL	0	45
COC(=O)c1ccc([C@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772949	FG	On-Demand	Anodyne	ADRB1	22	43
COC(=O)c1ccc([C@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772949	FG	On-Demand	Anodyne	ADRB3	31	40
COC(=O)c1ccc([C@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772949	FG	On-Demand	Anodyne	ANPEP	40	31
COC(=O)c1ccc([C@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772949	FG	On-Demand	Anodyne	CTSF	54	39
COC(=O)c1ccc([C@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772949	FG	On-Demand	Anodyne	CTSS	15	40
COC(=O)c1ccc([C@H](NC[C@H](O)Cc2ccccc2)C(F)(F)F)cc1	ZINC000450772949	FG	On-Demand	Anodyne	POL	0	45
CCCc1cc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c2ccccc2n1	ZINC000450772952	DH	On-Demand	Anodyne	METAP1	40	34
CCCc1cc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c2ccccc2n1	ZINC000450772953	DH	On-Demand	Anodyne	METAP1	40	34
CCCc1cc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c2ccccc2n1	ZINC000450772954	DH	On-Demand	Anodyne	METAP1	40	34
CNS(=O)(=O)c1ccc(N[C@H](C(=O)OC(C)C)C(C)C)c([N+](=O)[O-])c1	ZINC000450772962	FD	On-Demand	Bother	COLA	60	31
CC[C@H]1[C@H](C)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450772975	EF	On-Demand	Anodyne	MTNR1A	51	36
CC[C@@H]1[C@H](C)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450772976	EF	On-Demand	Anodyne	MTNR1A	51	36
CC[C@@H]1[C@@H](C)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450772977	EF	On-Demand	Anodyne	MTNR1A	51	36
CC[C@H]1[C@@H](C)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450772978	EF	On-Demand	Anodyne	MTNR1A	51	36
COCCO[C@H]1COCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450772996	GF	On-Demand	Anodyne	RBP4	60	34
COCCO[C@H]1COCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450772997	GF	On-Demand	Anodyne	RBP4	60	34
COCCO[C@@H]1COCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450772998	GF	On-Demand	Anodyne	RBP4	60	34
COCCO[C@@H]1COCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450772999	GF	On-Demand	Anodyne	RBP4	60	34
Cc1sccc1C(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450773000	DI	On-Demand	Anodyne	L3MBTL3	46	36
Cc1csc(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)c1	ZINC000450773005	DI	On-Demand	Anodyne	MMP12	15	43
Cc1nc(C)n(CCCC(=O)N2CCC(c3c(F)cccc3F)CC2)n1	ZINC000450773007	FG	On-Demand	Anodyne	ETHR	64	35
Cc1cnc(CCCC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)o1	ZINC000450773008	FI	On-Demand	Anodyne	PREP	53	38
Cc1cnc(CCCC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)o1	ZINC000450773009	FI	On-Demand	Anodyne	PREP	53	38
Cc1cnc(CCCC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)o1	ZINC000450773010	FI	On-Demand	Anodyne	PREP	53	38
Cc1cnc(CCCC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)o1	ZINC000450773011	FI	On-Demand	Anodyne	PREP	53	38
COc1cc(Br)c(C(=O)Nc2cccc(CCCO)c2)cc1OC	ZINC000450773026	GH	On-Demand	Anodyne	F2R	0	42
COc1cc(Br)c(C(=O)Nc2cccc(CCCO)c2)cc1OC	ZINC000450773026	GH	On-Demand	Anodyne	TAAR1	20	40
COc1cc(Br)c(C(=O)Nc2cccc(CCCO)c2)cc1OC	ZINC000450773026	GH	On-Demand	Anodyne	ENPP1	68	33
COc1cc(Br)c(C(=O)Nc2cccc(CCCO)c2)cc1OC	ZINC000450773026	GH	On-Demand	Anodyne	KCNK3	95	49
COc1cc(Br)c(C(=O)Nc2cccc(CCCO)c2)cc1OC	ZINC000450773026	GH	On-Demand	Anodyne	KCNK9	78	49
CC(C)[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)[C@H](CO)C(C)C	ZINC000450773036	EG	On-Demand	Bother	PKM	32	42
CC(C)[C@@H](CO)[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C(C)C	ZINC000450773037	EG	On-Demand	Bother	PKM	32	42
CC(C)[C@H](CO)[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C(C)C	ZINC000450773038	EG	On-Demand	Bother	PKM	32	42
CC(C)[C@H](CO)[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C(C)C	ZINC000450773039	EG	On-Demand	Bother	PKM	32	42
Cc1cc2c(cc1NC(=O)C(C)(C)C1CCC1)OCO2	ZINC000450773061	CG	On-Demand	Anodyne	LDLR	0	40
CC(C)(O)CCNC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450773069	DF	On-Demand	Anodyne	ALPL	45	39
CO[C@H]1CCN(c2cc(C)nc(-c3cccnc3)n2)C[C@H]1C	ZINC000450773078	CF	On-Demand	Anodyne	ROS1	32	41
CO[C@@H]1CCN(c2cc(C)nc(-c3cccnc3)n2)C[C@H]1C	ZINC000450773079	CF	On-Demand	Anodyne	ROS1	32	41
CO[C@@H]1CCN(c2cc(C)nc(-c3cccnc3)n2)C[C@@H]1C	ZINC000450773080	CF	On-Demand	Anodyne	ROS1	32	41
CO[C@H]1CCN(c2cc(C)nc(-c3cccnc3)n2)C[C@@H]1C	ZINC000450773081	CF	On-Demand	Anodyne	ROS1	32	41
CO[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450773085	CF	On-Demand	Anodyne	PDE3A	54	41
CO[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450773085	CF	On-Demand	Anodyne	PDE3B	80	41
CO[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450773085	CF	On-Demand	Anodyne	SIRT3	52	32
CO[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450773085	CF	On-Demand	Anodyne	SIRT1	52	32
CO[C@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450773086	CF	On-Demand	Anodyne	PDE3A	54	41
CO[C@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450773086	CF	On-Demand	Anodyne	PDE3B	80	41
CO[C@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450773086	CF	On-Demand	Anodyne	SIRT3	52	32
CO[C@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450773086	CF	On-Demand	Anodyne	SIRT1	52	32
CO[C@@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450773087	CF	On-Demand	Anodyne	PDE3A	54	41
CO[C@@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450773087	CF	On-Demand	Anodyne	PDE3B	80	41
CO[C@@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450773087	CF	On-Demand	Anodyne	SIRT3	52	32
CO[C@@H]1CCN(c2ncnc3ccsc23)C[C@H]1C	ZINC000450773087	CF	On-Demand	Anodyne	SIRT1	52	32
CO[C@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450773088	CF	On-Demand	Anodyne	PDE3A	54	41
CO[C@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450773088	CF	On-Demand	Anodyne	PDE3B	80	41
CO[C@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450773088	CF	On-Demand	Anodyne	SIRT3	52	32
CO[C@H]1CCN(c2ncnc3ccsc23)C[C@@H]1C	ZINC000450773088	CF	On-Demand	Anodyne	SIRT1	52	32
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nc4ccc(F)cc4n3C)C2)CC1	ZINC000450773095	GE	On-Demand	Anodyne	CCR3	71	35
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nc4ccc(F)cc4n3C)C2)CC1	ZINC000450773095	GE	On-Demand	Anodyne	Q8MHZ5_SHEEP	59	38
CC(=O)N1CCCN(C[C@H]2CCCN(c3nc4ccc(F)cc4n3C)C2)CC1	ZINC000450773096	GE	On-Demand	Anodyne	CCR3	71	35
CC(=O)N1CCCN(C[C@H]2CCCN(c3nc4ccc(F)cc4n3C)C2)CC1	ZINC000450773096	GE	On-Demand	Anodyne	Q8MHZ5_SHEEP	59	38
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(C(F)(F)F)s3)C2)CC1	ZINC000450773140	GF	On-Demand	Anodyne	MLYCD	64	38
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(C(F)(F)F)s3)C2)CC1	ZINC000450773141	GF	On-Demand	Anodyne	MLYCD	64	38
CC(C)(C)c1ccc(C2CCN(c3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450773155	EG	On-Demand	Anodyne	SCD1	38	48
CO[C@H]1CCN(c2cc(N3CCCCC3)ncn2)C[C@@H]1C	ZINC000450773157	CE	On-Demand	Anodyne	PDE3A	43	33
CO[C@H]1CCN(c2cc(N3CCCCC3)ncn2)C[C@H]1C	ZINC000450773158	CE	On-Demand	Anodyne	PDE3A	43	33
CO[C@@H]1CCN(c2cc(N3CCCCC3)ncn2)C[C@@H]1C	ZINC000450773159	CE	On-Demand	Anodyne	PDE3A	43	33
NC(=O)CCc1nnc(SCC/C=C/c2ccccc2)n1Cc1ccco1	ZINC000450773162	GH	On-Demand	Anodyne	HCRTR2	19	41
NC(=O)CCc1nnc(SCC/C=C\c2ccccc2)n1Cc1ccco1	ZINC000450773163	GH	On-Demand	Anodyne	HCRTR2	19	41
COc1ccc(CNC(=O)CCN2CC[C@H]3CCC[C@@H]32)c(OC)c1	ZINC000450773164	EF	On-Demand	Anodyne	MTNR1A	47	35
COc1ccc(CNC(=O)CCN2CC[C@H]3CCC[C@H]32)c(OC)c1	ZINC000450773165	EF	On-Demand	Anodyne	MTNR1A	47	35
COc1ccc(CNC(=O)CCN2CC[C@@H]3CCC[C@H]32)c(OC)c1	ZINC000450773166	EF	On-Demand	Anodyne	MTNR1A	47	35
COc1ccc(CNC(=O)CCN2CC[C@@H]3CCC[C@@H]32)c(OC)c1	ZINC000450773167	EF	On-Demand	Anodyne	MTNR1A	47	35
COC(=O)c1coc(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450773168	FD	On-Demand	Anodyne	NPFFR1	46	35
COC(=O)c1coc(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450773169	FD	On-Demand	Anodyne	NPFFR1	46	35
CN1CC[C@@H]2CN(c3ncc(C#N)cc3Cl)C[C@@H]21	ZINC000450773176	CD	On-Demand	Mild	CHRNA3	37	40
CN1CC[C@@H]2CN(c3ncc(C#N)cc3Cl)C[C@@H]21	ZINC000450773176	CD	On-Demand	Mild	CXCR3	21	41
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000450773179	FF	On-Demand	Anodyne	ATP4A	19	48
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450773181	EH	On-Demand	Anodyne	UTS2R	46	33
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCC[C@H](OCC2CC2)C1	ZINC000450773182	EH	On-Demand	Anodyne	UTS2R	46	33
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450773183	EH	On-Demand	Anodyne	UTS2R	46	33
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCC[C@H](OCC2CC2)C1	ZINC000450773184	EH	On-Demand	Anodyne	UTS2R	46	33
COc1cc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)ccnc2cc1F	ZINC000450773199	DF	On-Demand	Anodyne	PDE3A	46	36
COc1cc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)ccnc2cc1F	ZINC000450773199	DF	On-Demand	Anodyne	KDR	47	34
COc1cc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)ccnc2cc1F	ZINC000450773199	DF	On-Demand	Anodyne	PDE3B	68	36
COc1cc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)ccnc2cc1F	ZINC000450773199	DF	On-Demand	Anodyne	MET	50	33
COC(=O)c1cc(Cl)cc(Cl)c1N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000450773204	EF	On-Demand	Anodyne	HTR3A	16	42
CC(F)(F)c1ccc(C(=O)N2CCC[C@H](OCC3CC3)C2)cn1	ZINC000450773215	DG	On-Demand	Anodyne	SFRP1	55	38
CC(F)(F)c1ccc(C(=O)N2CCC[C@H](OCC3CC3)C2)cn1	ZINC000450773215	DG	On-Demand	Anodyne	WNT3	41	31
CC(F)(F)c1ccc(C(=O)N2CCC[C@@H](OCC3CC3)C2)cn1	ZINC000450773216	DG	On-Demand	Anodyne	SFRP1	55	38
CC(F)(F)c1ccc(C(=O)N2CCC[C@@H](OCC3CC3)C2)cn1	ZINC000450773216	DG	On-Demand	Anodyne	WNT3	41	31
CCC1(CC)CN(CCCC(=O)c2ccccc2)CCS1(=O)=O	ZINC000450773237	EF	On-Demand	Anodyne	DRD2	29	43
CCC1(CC)CN(CCCC(=O)c2ccccc2)CCS1(=O)=O	ZINC000450773237	EF	On-Demand	Anodyne	SLC18A3	0	43
CCC1(CC)CN(CCCC(=O)c2ccccc2)CCS1(=O)=O	ZINC000450773237	EF	On-Demand	Anodyne	CYP2J2	59	42
CN1CC[C@@H]2CN(c3ccnc4ccc(Cl)cc34)C[C@@H]21	ZINC000450773238	CG	On-Demand	Anodyne	HNMT	40	31
Cc1nc2c3ccccc3nc(SC[C@H]3CCCC3(F)F)n2n1	ZINC000450773251	EI	On-Demand	Anodyne	PDE10A	16	54
Cc1nc2c3ccccc3nc(SC[C@@H]3CCCC3(F)F)n2n1	ZINC000450773254	EI	On-Demand	Anodyne	PDE10A	16	54
COc1cc(CC(=O)Nc2cccc(CCCO)c2)ccc1Cl	ZINC000450773273	EG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)Nc2cccc(CCCO)c2)ccc1Cl	ZINC000450773273	EG	On-Demand	Anodyne	NCE103	23	43
COc1cc(CC(=O)Nc2cccc(CCCO)c2)ccc1Cl	ZINC000450773273	EG	On-Demand	Anodyne	CAN2	0	43
COc1cc(CN2CC(S(=O)(=O)NC3CCCC3)C2)ccc1Cl	ZINC000450773314	FE	On-Demand	Anodyne	DRD4	20	41
COc1cc(CN2CC(S(=O)(=O)NC3CCCC3)C2)ccc1Cl	ZINC000450773314	FE	On-Demand	Anodyne	SSTR5	58	40
COCCO[C@@H]1COCC[C@H]1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450773317	FD	On-Demand	Anodyne	CAN2	0	41
COCCO[C@@H]1COCC[C@@H]1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450773318	FD	On-Demand	Anodyne	CAN2	0	41
COCCO[C@H]1COCC[C@@H]1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450773319	FD	On-Demand	Anodyne	CAN2	0	41
COCCO[C@H]1COCC[C@H]1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450773320	FD	On-Demand	Anodyne	CAN2	0	41
CC(C)[C@@H](CO)[C@H](Nc1ncnc2[nH]cnc12)C(C)C	ZINC000450773325	CE	On-Demand	Anodyne	AHK3	0	49
CC(C)[C@H](Nc1ncnc2[nH]cnc12)[C@H](CO)C(C)C	ZINC000450773326	CE	On-Demand	Anodyne	AHK3	0	49
CC(C)[C@H](CO)[C@@H](Nc1ncnc2[nH]cnc12)C(C)C	ZINC000450773327	CE	On-Demand	Anodyne	AHK3	0	49
CC(C)[C@H](CO)[C@H](Nc1ncnc2[nH]cnc12)C(C)C	ZINC000450773328	CE	On-Demand	Anodyne	AHK3	0	49
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450773341	EG	On-Demand	Anodyne	TSPO	16	40
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450773342	EG	On-Demand	Anodyne	TSPO	16	40
CCCc1cc(C(=O)N2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)no1	ZINC000450773382	EH	On-Demand	Anodyne	HCRTR2	0	41
CCCc1cc(C(=O)N2[C@@H](C)c3ccc(OC)cc3C[C@H]2C)no1	ZINC000450773383	EH	On-Demand	Anodyne	HCRTR2	0	41
CCCc1cc(C(=O)N2[C@@H](C)Cc3cc(OC)ccc3[C@H]2C)no1	ZINC000450773384	EH	On-Demand	Anodyne	HCRTR2	0	41
CCCc1cc(C(=O)N2[C@@H](C)Cc3cc(OC)ccc3[C@@H]2C)no1	ZINC000450773385	EH	On-Demand	Anodyne	HCRTR2	0	41
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450773386	FF	On-Demand	Anodyne	ATP4A	19	51
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1	ZINC000450773387	FF	On-Demand	Anodyne	ATP4A	19	51
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450773388	FF	On-Demand	Anodyne	ATP4A	19	51
CC(=O)N[C@H](C)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450773389	DG	On-Demand	Anodyne	SIGMAR1	19	46
CC(=O)N[C@H](C)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450773389	DG	On-Demand	Anodyne	P2RX7	15	41
CC(=O)N[C@@H](C)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450773390	DG	On-Demand	Anodyne	SIGMAR1	19	46
CC(=O)N[C@@H](C)C1CCN(Cc2c(C)cccc2Cl)CC1	ZINC000450773390	DG	On-Demand	Anodyne	P2RX7	15	41
CSc1cccc(C(=O)N2CCO[C@H](COCC3CC3)C2)c1	ZINC000450773391	DF	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CCO[C@@H](COCC3CC3)C2)c1	ZINC000450773392	DF	On-Demand	Anodyne	RHOA	0	40
O=C(NC1CC1)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450773393	FF	On-Demand	Bother	TAAR1	15	40
O=C(NC1CC1)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450773394	FF	On-Demand	Bother	TAAR1	15	40
O=C(NC1CC1)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450773395	FF	On-Demand	Bother	TAAR1	15	40
O=C(NC1CC1)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450773396	FF	On-Demand	Bother	TAAR1	15	40
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1ccc(N3CCC3)nc1)[C@H]2C	ZINC000450773397	FG	On-Demand	Anodyne	HCRTR2	29	44
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1ccc(N3CCC3)nc1)[C@H]2C	ZINC000450773398	FG	On-Demand	Anodyne	HCRTR2	29	44
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1ccc(N3CCC3)nc1)[C@@H]2C	ZINC000450773399	FG	On-Demand	Anodyne	HCRTR2	29	44
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1ccc(N3CCC3)nc1)[C@@H]2C	ZINC000450773400	FG	On-Demand	Anodyne	HCRTR2	29	44
CO[C@@H]1CCN(c2cc(N3CCCCC3)ncn2)C[C@H]1C	ZINC000450773421	CE	On-Demand	Anodyne	PDE3A	43	33
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ncc(-c4ccccc4)s3)C[C@H]21	ZINC000450773427	CG	On-Demand	Anodyne	MLYCD	51	34
FC1(F)CCCC[C@H]1CN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450773430	EH	On-Demand	Anodyne	ETHR	17	47
FC1(F)CCCC[C@@H]1CN1CCC(c2noc(C3CC3)n2)CC1	ZINC000450773431	EH	On-Demand	Anodyne	ETHR	17	47
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccnc4ccc(C)cc34)C2)CC1	ZINC000450773436	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	33
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccnc4ccc(C)cc34)C2)CC1	ZINC000450773437	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	33
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncc(-c4ccccc4)s3)C[C@H]12	ZINC000450773444	CG	On-Demand	Anodyne	MLYCD	51	34
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncc(-c4ccccc4)s3)C[C@@H]12	ZINC000450773445	CG	On-Demand	Anodyne	MLYCD	51	34
C[C@@H](O)CCN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450773454	EH	On-Demand	Anodyne	SLC6A3	21	42
C[C@@H](O)CCN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450773454	EH	On-Demand	Anodyne	HTR4	48	39
C[C@@H](O)CCN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450773454	EH	On-Demand	Anodyne	SIGMAR1	29	43
C[C@H](O)CCN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450773457	EH	On-Demand	Anodyne	SLC6A3	21	42
C[C@H](O)CCN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450773457	EH	On-Demand	Anodyne	HTR4	48	39
C[C@H](O)CCN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450773457	EH	On-Demand	Anodyne	SIGMAR1	29	43
O=C(c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)nc1)N1CCc2ccccc21	ZINC000450773458	FF	On-Demand	Anodyne	AVPR2	50	42
O=C(c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)nc1)N1CCc2ccccc21	ZINC000450773460	FF	On-Demand	Anodyne	AVPR2	50	42
O=C(c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)nc1)N1CCc2ccccc21	ZINC000450773462	FF	On-Demand	Anodyne	AVPR2	50	42
O=C(NC1CC1)c1cc(N[C@H](C2CC2)[C@@H](CO)C2CC2)nc2ccccc12	ZINC000450773496	FG	On-Demand	Anodyne	TNKS	56	31
O=C(NC1CC1)c1cc(N[C@@H](C2CC2)[C@H](CO)C2CC2)nc2ccccc12	ZINC000450773497	FG	On-Demand	Anodyne	TNKS	56	31
O=C(NC1CC1)c1cc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)nc2ccccc12	ZINC000450773499	FG	On-Demand	Anodyne	TNKS	56	31
O=C(NC1CC1)c1cc(N[C@H](C2CC2)[C@H](CO)C2CC2)nc2ccccc12	ZINC000450773501	FG	On-Demand	Anodyne	TNKS	56	31
CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCCOC1	ZINC000450773512	FD	On-Demand	Anodyne	TRPV1	32	45
CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)[C@@H]1CCCOC1	ZINC000450773513	FD	On-Demand	Anodyne	TRPV1	32	45
CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCCOC1	ZINC000450773514	FD	On-Demand	Anodyne	TRPV1	32	45
CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)[C@H]1CCCOC1	ZINC000450773515	FD	On-Demand	Anodyne	TRPV1	32	45
CCS(=O)(=O)c1ccc(CN2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450773530	FE	On-Demand	Anodyne	CMA1	23	40
CCS(=O)(=O)c1ccc(CN2CCN(c3ccccc3)C(=O)C2)cc1	ZINC000450773530	FE	On-Demand	Anodyne	CTSG	33	40
COc1ccc(Cn2nnnc2SC[C@H](O)CC#N)cc1	ZINC000450773531	DD	On-Demand	Mild	PROKR1	41	32
COc1ccc(OC(F)(F)F)c(C(=O)NCCC(C)(C)O)c1	ZINC000450773532	DE	On-Demand	Anodyne	MTNR1A	40	36
CC(C)(O)CCNC(=O)c1cc2ccncc2s1	ZINC000450773533	CE	On-Demand	Anodyne	VCAM1	45	33
CO[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450773534	CD	On-Demand	Bother	TAAR1	17	44
CO[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450773535	CD	On-Demand	Bother	TAAR1	17	44
CO[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450773536	CD	On-Demand	Bother	TAAR1	17	44
CO[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450773537	CD	On-Demand	Bother	TAAR1	17	44
CCOC(=O)[C@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450773538	FD	On-Demand	Anodyne	FKBP1A	24	43
CCOC(=O)[C@H]1CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450773538	FD	On-Demand	Anodyne	MTNR1A	44	35
CO[C@@H]1CCN(c2ncnc3sc4c(c23)CCC4)C[C@@H]1C	ZINC000450773557	DG	On-Demand	Anodyne	PDE3B	42	32
CO[C@H]1CCN(c2ncnc3sc4c(c23)CCC4)C[C@@H]1C	ZINC000450773558	DG	On-Demand	Anodyne	PDE3B	42	32
CO[C@H]1CCN(c2ncnc3sc4c(c23)CCC4)C[C@H]1C	ZINC000450773559	DG	On-Demand	Anodyne	PDE3B	42	32
COC(=O)c1coc(CN2CCC(c3ccc(Br)c(C)c3)CC2)n1	ZINC000450773560	GH	On-Demand	Anodyne	CARM1	55	32
COc1ccc(C(=O)N2CCC[C@H](OCC3CC3)C2)cc1S(C)(=O)=O	ZINC000450773563	FE	On-Demand	Anodyne	L3MBTL3	69	36
COc1ccc(C(=O)N2CCC[C@@H](OCC3CC3)C2)cc1S(C)(=O)=O	ZINC000450773564	FE	On-Demand	Anodyne	L3MBTL3	69	36
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCO	ZINC000450773587	CD	On-Demand	Anodyne	SLC6A1	64	36
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CCO	ZINC000450773587	CD	On-Demand	Anodyne	HTR3B	0	41
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCO	ZINC000450773588	CD	On-Demand	Anodyne	SLC6A1	64	36
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CCO	ZINC000450773588	CD	On-Demand	Anodyne	HTR3B	0	41
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450773598	EG	On-Demand	Anodyne	SFRP1	91	36
O=C(c1cccc(C(F)(F)F)n1)N1CCC[C@H](OCC2CC2)C1	ZINC000450773599	EG	On-Demand	Anodyne	SFRP1	91	36
COc1cccc2c1CCN(C(=O)C1(C)CCC(=O)CC1)C2	ZINC000450773624	DF	On-Demand	Anodyne	SSTR1	42	33
CC[C@]1(CO)CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450773641	CG	On-Demand	Anodyne	SIGMAR1	18	42
CC[C@]1(CO)CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450773641	CG	On-Demand	Anodyne	L3MBTL3	20	43
CC[C@@]1(CO)CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450773642	CG	On-Demand	Anodyne	SIGMAR1	18	42
CC[C@@]1(CO)CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450773642	CG	On-Demand	Anodyne	L3MBTL3	20	43
CCC(=O)C1(C(=O)Nc2cccc(CCCO)c2)CC1	ZINC000450773709	CE	On-Demand	Anodyne	SPHK1	16	45
COCCn1cc(N2C[C@@H](C(=O)Nc3cccc(CCCO)c3)CC2=O)cn1	ZINC000450773730	GD	On-Demand	Anodyne	INHA	20	41
COCCn1cc(N2C[C@H](C(=O)Nc3cccc(CCCO)c3)CC2=O)cn1	ZINC000450773731	GD	On-Demand	Anodyne	INHA	20	41
O=C(Cc1cc2ccccc2c(O)n1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000450773753	GJ	On-Demand	Anodyne	UTS2R	43	29
O=C(Cc1cc2ccccc2c(O)n1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000450773754	GJ	On-Demand	Anodyne	UTS2R	43	29
O=C(Cc1cc2ccccc2c(O)n1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000450773755	GJ	On-Demand	Anodyne	UTS2R	43	29
O=C(Cc1cc2ccccc2c(O)n1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000450773756	GJ	On-Demand	Anodyne	UTS2R	43	29
CO[C@@H]1CCN(c2ncnc3sc4c(c23)CCC4)C[C@H]1C	ZINC000450773760	DG	On-Demand	Anodyne	PDE3B	42	32
CCOC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000450773761	GE	On-Demand	Bother	CACNA1C	57	37
CCOC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000450773761	GE	On-Demand	Bother	CACNA1D	88	36
CCOC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000450773761	GE	On-Demand	Bother	IRAK4	24	40
CCOC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000450773762	GE	On-Demand	Bother	CACNA1C	57	37
CCOC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000450773762	GE	On-Demand	Bother	CACNA1D	88	36
CCOC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000450773762	GE	On-Demand	Bother	IRAK4	24	40
CCOC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000450773763	GE	On-Demand	Bother	CACNA1C	57	37
CCOC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000450773763	GE	On-Demand	Bother	CACNA1D	88	36
CCOC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000450773763	GE	On-Demand	Bother	IRAK4	24	40
CCOC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000450773764	GE	On-Demand	Bother	CACNA1C	57	37
CCOC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000450773764	GE	On-Demand	Bother	CACNA1D	88	36
CCOC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000450773764	GE	On-Demand	Bother	IRAK4	24	40
CC(C)OC(=O)C[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450773783	EG	On-Demand	Anodyne	SLC6A1	109	37
CC(C)OC(=O)C[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450773783	EG	On-Demand	Anodyne	SIGMAR1	26	41
CC(C)OC(=O)C[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450773783	EG	On-Demand	Anodyne	BIRC2	55	39
CC(C)OC(=O)C[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450773784	EG	On-Demand	Anodyne	SLC6A1	109	37
CC(C)OC(=O)C[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450773784	EG	On-Demand	Anodyne	SIGMAR1	26	41
CC(C)OC(=O)C[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450773784	EG	On-Demand	Anodyne	BIRC2	55	39
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1	ZINC000450773788	GE	On-Demand	Bother	MC4R	44	37
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCC(C)(C)O)cc2)c1	ZINC000450773792	FF	On-Demand	Anodyne	KCNQ1	0	46
Cc1cccc(CNC(=O)c2ccc(C(=O)NCCC(C)(C)O)cc2)c1	ZINC000450773792	FF	On-Demand	Anodyne	E1	0	46
CC(C)OC(=O)[C@@H](Nc1cnc(C#N)cn1)C(C)C	ZINC000450773817	CD	On-Demand	Mild	CHEK1	16	44
C[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(N)=O)C1	ZINC000450773868	CE	On-Demand	Anodyne	CYP2J2	58	41
C[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@H](C(N)=O)C1	ZINC000450773869	CE	On-Demand	Anodyne	CYP2J2	58	41
C[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H](C(N)=O)C1	ZINC000450773870	CE	On-Demand	Anodyne	CYP2J2	58	41
C[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H](C(N)=O)C1	ZINC000450773871	CE	On-Demand	Anodyne	CYP2J2	58	41
Cn1nc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1OC(F)F	ZINC000450773876	FD	On-Demand	Anodyne	PDE4D	16	45
CCOC(=O)[C@@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@H]1CCCOC1	ZINC000450773883	GE	On-Demand	Anodyne	P2RY12	55	38
Cn1nc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1OC(F)F	ZINC000450773884	FD	On-Demand	Anodyne	PDE4D	16	45
CCOC(=O)[C@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@@H]1CCCOC1	ZINC000450773885	GE	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)[C@@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@@H]1CCCOC1	ZINC000450773887	GE	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)[C@H](NC(=O)c1ccn(CCc2ccccc2)n1)[C@H]1CCCOC1	ZINC000450773889	GE	On-Demand	Anodyne	P2RY12	55	38
CC1(O)CC(C(=O)Nc2nc3ccc(I)cc3s2)C1	ZINC000450773890	GG	On-Demand	Anodyne	LCK	30	47
CC1(O)CC(C(=O)Nc2nc3ccc(I)cc3s2)C1	ZINC000450773890	GG	On-Demand	Anodyne	CSNK1D	45	41
CC1(O)CC(C(=O)Nc2nc3ccc(I)cc3s2)C1	ZINC000450773890	GG	On-Demand	Anodyne	PIK3CA	20	42
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	HTR1A	16	63
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	DRD2	39	63
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	DRD1	26	57
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	DRD4	30	63
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	HTR2A	25	63
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	HTR2C	20	57
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	HRH1	15	63
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	DRD3	17	57
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	DRD5	17	45
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	ERG2	29	63
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	SIGMAR1	16	58
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	UTS2R	0	44
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	SLC18A3	24	58
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	CYP2J2	61	43
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	NET	0	63
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccc(F)cc1	ZINC000450773893	FH	On-Demand	Anodyne	AP2S1	0	63
O=C(NC1CN(C(=O)c2cc(Cl)c(Br)cc2F)C1)C1CCC1	ZINC000450773894	GF	On-Demand	Anodyne	EPHX2	15	44
CCOC(=O)[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@@H]1CCCOC1	ZINC000450773896	GD	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@@H]1CCCOC1	ZINC000450773896	GD	On-Demand	Anodyne	THYX_PBCV1	0	42
CCOC(=O)[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@H]1CCCOC1	ZINC000450773898	GD	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@H]1CCCOC1	ZINC000450773898	GD	On-Demand	Anodyne	THYX_PBCV1	0	42
CCOC(=O)[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@@H]1CCCOC1	ZINC000450773900	GD	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@@H]1CCCOC1	ZINC000450773900	GD	On-Demand	Anodyne	THYX_PBCV1	0	42
CCOC(=O)[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@H]1CCCOC1	ZINC000450773902	GD	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)[C@H]1CCCOC1	ZINC000450773902	GD	On-Demand	Anodyne	THYX_PBCV1	0	42
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)nccc12	ZINC000450773916	GG	On-Demand	Anodyne	HTR1A	39	40
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)nccc12	ZINC000450773916	GG	On-Demand	Anodyne	ADRA1D	29	40
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)nccc12	ZINC000450773916	GG	On-Demand	Anodyne	ADRA1A	26	40
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)nccc12	ZINC000450773916	GG	On-Demand	Anodyne	ADRA1B	25	40
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)nccc12	ZINC000450773918	GG	On-Demand	Anodyne	HTR1A	39	40
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)nccc12	ZINC000450773918	GG	On-Demand	Anodyne	ADRA1D	29	40
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)nccc12	ZINC000450773918	GG	On-Demand	Anodyne	ADRA1A	26	40
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)nccc12	ZINC000450773918	GG	On-Demand	Anodyne	ADRA1B	25	40
CC[C@]1(O)CCN(CCN(C)Cc2ccccc2)C1	ZINC000450773923	CD	On-Demand	Anodyne	SIGMAR1	36	44
CC[C@@]1(O)CCN(CCN(C)Cc2ccccc2)C1	ZINC000450773925	CD	On-Demand	Anodyne	SIGMAR1	36	44
CO[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450773926	GF	On-Demand	Bother	CASP7	47	33
CO[C@H]1CCN(c2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450773928	GF	On-Demand	Bother	CASP7	47	33
CO[C@H]1CCN(c2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450773930	GF	On-Demand	Bother	CASP7	47	33
CO[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450773933	GF	On-Demand	Bother	CASP7	47	33
COc1ccc(CNC(=O)CCN(C)CC2(O)CCCCCC2)c(OC)c1	ZINC000450773945	GF	On-Demand	Anodyne	MTNR1A	55	42
COc1ccc(CNC(=O)CCN(C)CC2(O)CCCCCC2)c(OC)c1	ZINC000450773945	GF	On-Demand	Anodyne	MTNR1B	41	42
Cc1ccc(F)c(CSc2nnc(CCC(N)=O)n2Cc2ccco2)c1	ZINC000450773946	FG	On-Demand	Anodyne	HCRTR2	21	43
COc1cc(OC)nc(N[C@H](C2CC2)[C@H](CO)C2CC2)n1	ZINC000450773961	CD	On-Demand	Anodyne	ALS	43	30
COc1cc(OC)nc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)n1	ZINC000450773963	CD	On-Demand	Anodyne	ALS	43	30
COc1cc(OC)nc(N[C@@H](C2CC2)[C@H](CO)C2CC2)n1	ZINC000450773965	CD	On-Demand	Anodyne	ALS	43	30
CN1CC[C@@H]2CN(c3ccc(S(C)(=O)=O)cc3C(F)(F)F)C[C@@H]21	ZINC000450773966	EE	On-Demand	Anodyne	HSD11B1	19	40
COc1cc(OC)nc(N[C@H](C2CC2)[C@@H](CO)C2CC2)n1	ZINC000450773967	CD	On-Demand	Anodyne	ALS	43	30
COc1c(NC(=O)C(CC(C)C)CC(C)C)cccc1C(N)=O	ZINC000450774013	DG	On-Demand	Anodyne	ANPEP	31	41
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774014	DD	On-Demand	Anodyne	DRD2	34	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774014	DD	On-Demand	Anodyne	DRD1	23	51
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774014	DD	On-Demand	Anodyne	DRD4	23	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774014	DD	On-Demand	Anodyne	HTR2A	25	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774014	DD	On-Demand	Anodyne	HTR2C	22	54
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774014	DD	On-Demand	Anodyne	SLC18A3	0	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774014	DD	On-Demand	Anodyne	CYP2J2	54	39
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774016	DD	On-Demand	Anodyne	DRD2	34	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774016	DD	On-Demand	Anodyne	DRD1	23	51
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774016	DD	On-Demand	Anodyne	DRD4	23	52
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774016	DD	On-Demand	Anodyne	HTR2A	25	52
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774016	DD	On-Demand	Anodyne	HTR2C	22	54
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774016	DD	On-Demand	Anodyne	SLC18A3	0	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CCO	ZINC000450774016	DD	On-Demand	Anodyne	CYP2J2	54	39
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1C[C@@H](O)C2(CC2)C1	ZINC000450774020	EE	On-Demand	Bother	LIPG	45	32
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1C[C@H](O)C2(CC2)C1	ZINC000450774021	EE	On-Demand	Bother	LIPG	45	32
CCN1CCN(CCCC(=O)c2ccccc2)[C@@H](C)C1=O	ZINC000450774027	CE	On-Demand	Anodyne	CYP2J2	58	41
CCN1CCN(CCCC(=O)c2ccccc2)[C@H](C)C1=O	ZINC000450774028	CE	On-Demand	Anodyne	CYP2J2	58	41
C[C@H]1C[C@@]1(C#N)C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450774034	GG	On-Demand	Mild	CSNK1D	42	39
C[C@H]1C[C@@]1(C#N)C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450774034	GG	On-Demand	Mild	PIK3CA	0	40
C[C@@H]1C[C@]1(C#N)C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450774035	GG	On-Demand	Mild	CSNK1D	42	39
C[C@@H]1C[C@]1(C#N)C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450774035	GG	On-Demand	Mild	PIK3CA	0	40
C[C@@H]1C[C@@]1(C#N)C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450774036	GG	On-Demand	Mild	CSNK1D	42	39
C[C@@H]1C[C@@]1(C#N)C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450774036	GG	On-Demand	Mild	PIK3CA	0	40
C[C@H]1C[C@]1(C#N)C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450774037	GG	On-Demand	Mild	CSNK1D	42	39
C[C@H]1C[C@]1(C#N)C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450774037	GG	On-Demand	Mild	PIK3CA	0	40
O=C(c1nc2ccccc2nc1C1CC1)N1CCC(CCCO)CC1	ZINC000450774038	EG	On-Demand	Anodyne	AKR1C3	0	45
COC(=O)CN(CC[C@@H](C)O)Cc1ccc(C(F)(F)F)cc1	ZINC000450774054	DE	On-Demand	Anodyne	MLYCD	22	40
COC(=O)CN(CC[C@H](C)O)Cc1ccc(C(F)(F)F)cc1	ZINC000450774055	DE	On-Demand	Anodyne	MLYCD	22	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450774056	FF	On-Demand	Anodyne	RHODESAIN	0	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450774057	FF	On-Demand	Anodyne	RHODESAIN	0	45
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450774063	FF	On-Demand	Anodyne	NPBWR1	25	47
CC(C)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450774078	GF	On-Demand	Bother	COLA	78	34
CC(C)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450774078	GF	On-Demand	Bother	BCL2L1	72	34
CC(C)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450774078	GF	On-Demand	Bother	BCL2	54	32
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774079	GF	On-Demand	Bother	COLA	78	34
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774079	GF	On-Demand	Bother	BCL2L1	72	34
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774079	GF	On-Demand	Bother	BCL2	54	32
CC(C)[C@H](CO)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774080	GF	On-Demand	Bother	COLA	78	34
CC(C)[C@H](CO)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774080	GF	On-Demand	Bother	BCL2L1	72	34
CC(C)[C@H](CO)[C@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774080	GF	On-Demand	Bother	BCL2	54	32
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774081	GF	On-Demand	Bother	COLA	78	34
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774081	GF	On-Demand	Bother	BCL2L1	72	34
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C(C)C	ZINC000450774081	GF	On-Demand	Bother	BCL2	54	32
Cn1c(C#N)ccc1C(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000450774087	EH	On-Demand	Mild	UTS2R	42	28
Cn1c(C#N)ccc1C(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000450774088	EH	On-Demand	Mild	UTS2R	42	28
Cn1c(C#N)ccc1C(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000450774089	EH	On-Demand	Mild	UTS2R	42	28
Cn1c(C#N)ccc1C(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000450774090	EH	On-Demand	Mild	UTS2R	42	28
CC(=O)N[C@H](C(=O)N1CCC(c2c(F)cccc2F)CC1)C(C)(C)C	ZINC000450774094	FG	On-Demand	Anodyne	CCR1	44	42
Cc1ccc(F)c(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)c1	ZINC000450774126	EI	On-Demand	Anodyne	TACR1	17	45
Cc1ccc(F)c(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)c1	ZINC000450774126	EI	On-Demand	Anodyne	CCR2	27	40
Cc1ccc(F)c(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)c1	ZINC000450774127	EI	On-Demand	Anodyne	TACR1	17	45
Cc1ccc(F)c(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)c1	ZINC000450774127	EI	On-Demand	Anodyne	CCR2	27	40
O=C(CCCC(=O)C1CC1)Nc1cccc(CCCO)c1	ZINC000450774132	CF	On-Demand	Anodyne	HDAC3	44	40
O=C(CCCC(=O)C1CC1)Nc1cccc(CCCO)c1	ZINC000450774132	CF	On-Demand	Anodyne	HDAC6	36	42
O=C(CCCC(=O)C1CC1)Nc1cccc(CCCO)c1	ZINC000450774132	CF	On-Demand	Anodyne	PARP10	0	42
CC(C)[C@H](CO)[C@H](Nc1ncc([N+](=O)[O-])s1)C(C)C	ZINC000450774140	CF	On-Demand	Bother	MAPK9	15	45
CC(C)[C@H](Nc1ncc([N+](=O)[O-])s1)[C@H](CO)C(C)C	ZINC000450774141	CF	On-Demand	Bother	MAPK9	15	45
CC(C)[C@@H](CO)[C@H](Nc1ncc([N+](=O)[O-])s1)C(C)C	ZINC000450774142	CF	On-Demand	Bother	MAPK9	15	45
CC(C)[C@H](CO)[C@@H](Nc1ncc([N+](=O)[O-])s1)C(C)C	ZINC000450774143	CF	On-Demand	Bother	MAPK9	15	45
CC(=O)c1cn(CC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)nn1	ZINC000450774146	FF	On-Demand	Anodyne	UTS2R	45	32
CC(=O)c1cn(CC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)nn1	ZINC000450774147	FF	On-Demand	Anodyne	UTS2R	45	32
CC(=O)c1cn(CC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)nn1	ZINC000450774148	FF	On-Demand	Anodyne	UTS2R	45	32
CC(=O)c1cn(CC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)nn1	ZINC000450774149	FF	On-Demand	Anodyne	UTS2R	45	32
CO[C@H]1CCN(c2nc(-c3ccccc3)ns2)C[C@@H]1C	ZINC000450774177	CG	On-Demand	Anodyne	FAAH	16	48
CO[C@@H]1CCN(c2nc(-c3ccccc3)ns2)C[C@H]1C	ZINC000450774179	CG	On-Demand	Anodyne	FAAH	16	48
CO[C@@H]1CCN(c2nc(-c3ccccc3)ns2)C[C@@H]1C	ZINC000450774181	CG	On-Demand	Anodyne	FAAH	16	48
CO[C@H]1CCN(c2nc(-c3ccccc3)ns2)C[C@H]1C	ZINC000450774183	CG	On-Demand	Anodyne	FAAH	16	48
CCOC(=O)c1cc(N2C[C@@H]3CCN(C)[C@@H]3C2)ncc1Cl	ZINC000450774192	DE	On-Demand	Anodyne	IKBKB	43	34
CCOC(=O)[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)[C@H]1CCCOC1	ZINC000450774202	FD	On-Demand	Anodyne	MMP13	0	51
CCOC(=O)[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)[C@H]1CCCOC1	ZINC000450774204	FD	On-Demand	Anodyne	MMP13	0	51
COc1ccc(Nc2cc(N3C[C@@H]4CCN(C)[C@@H]4C3)ncn2)c(OC)c1	ZINC000450774206	FE	On-Demand	Anodyne	PDE3B	40	34
CCOC(=O)[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)[C@@H]1CCCOC1	ZINC000450774207	FD	On-Demand	Anodyne	MMP13	0	51
CCOC(=O)[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)[C@@H]1CCCOC1	ZINC000450774208	FD	On-Demand	Anodyne	MMP13	0	51
O=C(Cc1cc2ccccc2s1)N1CCC(CCCO)CC1	ZINC000450774209	DG	On-Demand	Anodyne	AKR1C3	0	41
CO[C@@H]1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)C[C@@H]1C	ZINC000450774244	EF	On-Demand	Anodyne	L3MBTL3	48	35
CO[C@@H]1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)C[C@H]1C	ZINC000450774245	EF	On-Demand	Anodyne	L3MBTL3	48	35
CO[C@H]1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)C[C@@H]1C	ZINC000450774246	EF	On-Demand	Anodyne	L3MBTL3	48	35
CO[C@H]1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)C[C@H]1C	ZINC000450774248	EF	On-Demand	Anodyne	L3MBTL3	48	35
CC(=O)c1ccc(N2C[C@H]3CCN(C)[C@H]3C2)nc1	ZINC000450774253	BD	On-Demand	Anodyne	HDAC1	0	40
CN(CCN1CC[C@@H]2CCC[C@H]21)Cc1ccccc1	ZINC000450774274	CF	On-Demand	Anodyne	SLC18A2	25	40
CN(CCN1CC[C@@H]2CCC[C@H]21)Cc1ccccc1	ZINC000450774274	CF	On-Demand	Anodyne	SIGMAR1	32	43
CN(CCN1CC[C@H]2CCC[C@H]21)Cc1ccccc1	ZINC000450774275	CF	On-Demand	Anodyne	SLC18A2	25	40
CN(CCN1CC[C@H]2CCC[C@H]21)Cc1ccccc1	ZINC000450774275	CF	On-Demand	Anodyne	SIGMAR1	32	43
CN(CCN1CC[C@@H]2CCC[C@@H]21)Cc1ccccc1	ZINC000450774276	CF	On-Demand	Anodyne	SLC18A2	25	40
CN(CCN1CC[C@@H]2CCC[C@@H]21)Cc1ccccc1	ZINC000450774276	CF	On-Demand	Anodyne	SIGMAR1	32	43
CN(CCN1CC[C@H]2CCC[C@@H]21)Cc1ccccc1	ZINC000450774277	CF	On-Demand	Anodyne	SLC18A2	25	40
CN(CCN1CC[C@H]2CCC[C@@H]21)Cc1ccccc1	ZINC000450774277	CF	On-Demand	Anodyne	SIGMAR1	32	43
CN1CC[C@@H]2CN(c3ccc(S(N)(=O)=O)cc3C(F)(F)F)C[C@@H]21	ZINC000450774291	ED	On-Demand	Anodyne	HSD11B1	0	40
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(C#N)cc3Cl)C2)CC1	ZINC000450774301	GE	On-Demand	Mild	CXCR3	30	40
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(C#N)cc3Cl)C2)CC1	ZINC000450774306	GE	On-Demand	Mild	CXCR3	30	40
CC(=O)c1cccc(CN(CCCOc2ccccc2)C2CCOCC2)c1	ZINC000450774308	FI	On-Demand	Anodyne	ACHE	0	44
CC(=O)c1cccc(CN(CCCOc2ccccc2)C2CCOCC2)c1	ZINC000450774308	FI	On-Demand	Anodyne	PPARA	30	42
CN1CC[C@@H]2CN(c3ccnc(Cc4ccccc4)n3)C[C@@H]21	ZINC000450774336	CE	On-Demand	Anodyne	SORD	42	38
O=C(c1cc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450774360	FG	On-Demand	Bother	L3MBTL1	0	41
O=C(c1cc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450774360	FG	On-Demand	Bother	L3MBTL3	19	41
O=C(c1cc(N[C@H](C2CC2)[C@H](CO)C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450774361	FG	On-Demand	Bother	L3MBTL1	0	41
O=C(c1cc(N[C@H](C2CC2)[C@H](CO)C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450774361	FG	On-Demand	Bother	L3MBTL3	19	41
O=C(c1cc(N[C@@H](C2CC2)[C@H](CO)C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450774362	FG	On-Demand	Bother	L3MBTL1	0	41
O=C(c1cc(N[C@@H](C2CC2)[C@H](CO)C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450774362	FG	On-Demand	Bother	L3MBTL3	19	41
O=C(c1cc(N[C@H](C2CC2)[C@@H](CO)C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450774363	FG	On-Demand	Bother	L3MBTL1	0	41
O=C(c1cc(N[C@H](C2CC2)[C@@H](CO)C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450774363	FG	On-Demand	Bother	L3MBTL3	19	41
COC(=O)C1(CNC(=O)C2(Cc3ccccc3)CCOCC2)CCOCC1	ZINC000450774384	GE	On-Demand	Anodyne	SLC12A5	51	38
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ncncc3-c3ccccc3)C[C@H]21	ZINC000450774420	CF	On-Demand	Anodyne	SLC9A1	0	46
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncncc3-c3ccccc3)C[C@H]12	ZINC000450774421	CF	On-Demand	Anodyne	SLC9A1	0	46
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncncc3-c3ccccc3)C[C@@H]12	ZINC000450774422	CF	On-Demand	Anodyne	SLC9A1	0	46
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3nc4ccccc4[nH]3)C[C@H]12	ZINC000450774428	CD	On-Demand	Anodyne	KCNN3	30	42
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3nc4ccccc4[nH]3)C[C@H]12	ZINC000450774428	CD	On-Demand	Anodyne	NPY5R	19	43
C1=C[C@H]2O[C@H]1[C@H]1CN(c3nc4ccccc4[nH]3)C[C@H]21	ZINC000450774429	CD	On-Demand	Anodyne	KCNN3	30	42
C1=C[C@H]2O[C@H]1[C@H]1CN(c3nc4ccccc4[nH]3)C[C@H]21	ZINC000450774429	CD	On-Demand	Anodyne	NPY5R	19	43
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3nc4ccccc4[nH]3)C[C@@H]12	ZINC000450774430	CD	On-Demand	Anodyne	KCNN3	30	42
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3nc4ccccc4[nH]3)C[C@@H]12	ZINC000450774430	CD	On-Demand	Anodyne	NPY5R	19	43
Nc1ncccc1CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774449	FH	On-Demand	Anodyne	HTR4	44	41
Nc1ncccc1CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774449	FH	On-Demand	Anodyne	SIGMAR1	19	44
Nc1ncccc1CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774449	FH	On-Demand	Anodyne	SCD	25	41
CC(C)OC(=O)[C@@H](Nc1ncnc2[nH]ccc12)C(C)C	ZINC000450774450	CE	On-Demand	Anodyne	ROCK2	32	41
CCC(=O)CCCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450774454	DF	On-Demand	Anodyne	DRD2	30	47
CCC(=O)CCCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450774454	DF	On-Demand	Anodyne	DRD1	0	47
CCC(=O)CCCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450774454	DF	On-Demand	Anodyne	DRD4	0	47
CCC(=O)CCCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450774454	DF	On-Demand	Anodyne	ERG2	22	47
CCC(=O)CCCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450774454	DF	On-Demand	Anodyne	UTS2R	0	43
CCC(=O)CCCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450774454	DF	On-Demand	Anodyne	SLC18A3	0	43
CCC(=O)CCCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450774454	DF	On-Demand	Anodyne	CYP2J2	45	34
CCC(=O)CCCN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450774454	DF	On-Demand	Anodyne	NET	0	47
O=C(c1cc2ccncc2s1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450774469	FJ	On-Demand	Anodyne	RBP4	21	41
CCOC(=O)c1cc(C(=O)Nc2cccc(CCCO)c2)[nH]c1C	ZINC000450774477	EF	On-Demand	Anodyne	KCNK3	47	35
CCOC(=O)c1cc(C(=O)Nc2cccc(CCCO)c2)[nH]c1C	ZINC000450774477	EF	On-Demand	Anodyne	KCNK9	57	35
Cc1ccn(CC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)n1	ZINC000450774495	DG	On-Demand	Anodyne	UTS2R	48	35
Cc1ccn(CC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)n1	ZINC000450774496	DG	On-Demand	Anodyne	UTS2R	48	35
Cc1ccn(CC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)n1	ZINC000450774497	DG	On-Demand	Anodyne	UTS2R	48	35
Cc1ccn(CC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)n1	ZINC000450774498	DG	On-Demand	Anodyne	UTS2R	48	35
Cc1cc(C)c2c(c1)CN(C(=O)Cc1ccccc1O[C@H]1CCOC1)CC2	ZINC000450774505	FH	On-Demand	Anodyne	CPT2	29	41
Cc1cc(C)c2c(c1)CN(C(=O)Cc1ccccc1O[C@@H]1CCOC1)CC2	ZINC000450774506	FH	On-Demand	Anodyne	CPT2	29	41
CC[S@](=O)CC(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450774508	DE	On-Demand	Anodyne	ETHR	42	32
CC[S@@](=O)CC(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450774509	DE	On-Demand	Anodyne	ETHR	42	32
O=C(Nc1cccc(CCCO)c1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450774516	FF	On-Demand	Anodyne	KCNK3	81	40
O=C(Nc1cccc(CCCO)c1)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450774516	FF	On-Demand	Anodyne	KCNK9	42	36
O=C(Nc1cccc(CCCO)c1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450774558	GF	On-Demand	Anodyne	CASR	36	42
O=C(Nc1cccc(CCCO)c1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450774558	GF	On-Demand	Anodyne	EPHX2	22	43
O=C(Nc1cccc(CCCO)c1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450774558	GF	On-Demand	Anodyne	KCNK3	53	34
CCc1c(C(=O)N[C@H]2CCOC[C@H]2OCCOC)oc2ccccc12	ZINC000450774559	EF	On-Demand	Anodyne	MMP12	0	44
CCc1c(C(=O)N[C@H]2CCOC[C@H]2OCCOC)oc2ccccc12	ZINC000450774559	EF	On-Demand	Anodyne	MMP7	0	44
CC(=O)N1CCN(C(=O)C2CCN(c3ncc(Cl)cc3Cl)CC2)CC1	ZINC000450774573	GE	On-Demand	Anodyne	P2RY12	27	41
CCOC(=O)[C@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)[C@@H]1CCCOC1	ZINC000450774590	GD	On-Demand	Anodyne	ESRRA	18	40
C[C@H](OCCc1ccccc1)C(=O)N1C[C@@H](O)C2(CC2)C1	ZINC000450774592	CD	On-Demand	Anodyne	GHRHR	45	32
C[C@@H](OCCc1ccccc1)C(=O)N1C[C@H](O)C2(CC2)C1	ZINC000450774593	CD	On-Demand	Anodyne	GHRHR	45	32
C[C@@H](OCCc1ccccc1)C(=O)N1C[C@@H](O)C2(CC2)C1	ZINC000450774594	CD	On-Demand	Anodyne	GHRHR	45	32
CCOC(=O)[C@@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)[C@@H]1CCCOC1	ZINC000450774595	GD	On-Demand	Anodyne	ESRRA	18	40
C[C@H](OCCc1ccccc1)C(=O)N1C[C@H](O)C2(CC2)C1	ZINC000450774596	CD	On-Demand	Anodyne	GHRHR	45	32
CCOC(=O)[C@@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)[C@H]1CCCOC1	ZINC000450774597	GD	On-Demand	Anodyne	ESRRA	18	40
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCC(CCCO)CC1	ZINC000450774598	GI	On-Demand	Anodyne	CACNA1I	50	36
CCOC(=O)[C@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)[C@H]1CCCOC1	ZINC000450774600	GD	On-Demand	Anodyne	ESRRA	18	40
CCCOc1ccc(C(=O)Nc2cc(OC(F)F)n(C)n2)c(OC)c1	ZINC000450774603	FE	On-Demand	Anodyne	LUCI_LUCLA	16	44
CC(=O)N1CCN(C(=O)C2CCN(c3ncccc3C(F)(F)F)CC2)CC1	ZINC000450774611	GE	On-Demand	Anodyne	MPL	24	40
CC(=O)N1CCN(C(=O)C2CCN(c3ncccc3C(F)(F)F)CC2)CC1	ZINC000450774611	GE	On-Demand	Anodyne	TRPV1	51	61
CC(=O)N1CCN(C(=O)C2CCN(c3ncccc3C(F)(F)F)CC2)CC1	ZINC000450774611	GE	On-Demand	Anodyne	P2RX7	43	36
CC(=O)N1CCN(C(=O)C2CCN(c3ncccc3C(F)(F)F)CC2)CC1	ZINC000450774611	GE	On-Demand	Anodyne	RBP4	56	37
CC(=O)N1CCN(C(=O)C2CCN(c3ncccc3C(F)(F)F)CC2)CC1	ZINC000450774611	GE	On-Demand	Anodyne	SFRP1	85	38
CC(=O)N1CCN(C(=O)C2CCN(c3ncccc3C(F)(F)F)CC2)CC1	ZINC000450774611	GE	On-Demand	Anodyne	WNT3	70	35
CCOC(=O)[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450774613	CF	On-Demand	Anodyne	DRD2	47	37
CCOC(=O)[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450774613	CF	On-Demand	Anodyne	AVPR1B	41	33
CCOC(=O)[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450774613	CF	On-Demand	Anodyne	HTR4	41	36
CCOC(=O)[C@H]1CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450774613	CF	On-Demand	Anodyne	SSTR5	44	42
COC(=O)c1csc(CN2CC[C@@H](C)C[C@@H]2C(N)=O)n1	ZINC000450774626	CD	On-Demand	Anodyne	TRPC6	50	39
COC(=O)c1csc(CN2CC[C@@H](C)C[C@H]2C(N)=O)n1	ZINC000450774635	CD	On-Demand	Anodyne	TRPC6	50	39
COC(=O)c1csc(CN2CC[C@H](C)C[C@@H]2C(N)=O)n1	ZINC000450774637	CD	On-Demand	Anodyne	TRPC6	50	39
COC(=O)c1csc(CN2CC[C@H](C)C[C@H]2C(N)=O)n1	ZINC000450774639	CD	On-Demand	Anodyne	TRPC6	50	39
COC(=O)C[C@@]1(NCc2ccc(Cl)c(OC)c2)CCOC1	ZINC000450774656	DE	On-Demand	Anodyne	PDE6A	40	30
COC(=O)C[C@]1(NCc2ccc(Cl)c(OC)c2)CCOC1	ZINC000450774657	DE	On-Demand	Anodyne	PDE6A	40	30
CC(=O)N1CCCN(C[C@@H]2CCCN(c3c(C)c(C)nc4ccccc34)C2)CC1	ZINC000450774659	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	66	34
CC(=O)N1CCCN(C[C@H]2CCCN(c3c(C)c(C)nc4ccccc34)C2)CC1	ZINC000450774660	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	66	34
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	DRD2	37	52
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	ADRA1D	23	44
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	ERG2	24	51
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	HTR7	27	51
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	SIGMAR1	29	51
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	SLC18A3	22	53
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	HTR3B	0	41
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	CYP2J2	63	45
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	NET	0	51
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccccc1	ZINC000450774673	CF	On-Demand	Anodyne	AP2S1	0	51
CCN(C)C(=O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450774680	EE	On-Demand	Anodyne	MTNR1A	35	42
CCN(C)C(=O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450774680	EE	On-Demand	Anodyne	MTNR1B	38	43
CCN(C)C(=O)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450774680	EE	On-Demand	Anodyne	ROCK2	41	35
CCOC(=O)c1cc(N2C[C@@H]3CCN(C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000450774689	DD	On-Demand	Bother	GYRB	0	40
CO[C@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@H]1C	ZINC000450774695	DG	On-Demand	Bother	SLC6A4	0	54
CO[C@@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@H]1C	ZINC000450774697	DG	On-Demand	Bother	SLC6A4	0	54
CO[C@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H]1C	ZINC000450774698	DG	On-Demand	Bother	SLC6A4	0	54
CO[C@@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H]1C	ZINC000450774699	DG	On-Demand	Bother	SLC6A4	0	54
CC[C@@H](O)CC(=O)N1CCc2c(cccc2OC)C1	ZINC000450774712	CD	On-Demand	Anodyne	SSTR1	42	34
CC[C@H](O)CC(=O)N1CCc2c(cccc2OC)C1	ZINC000450774714	CD	On-Demand	Anodyne	SSTR1	42	34
CC(C)(O)CCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450774729	EF	On-Demand	Anodyne	HDAC8	29	43
CC(C)(O)CCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450774729	EF	On-Demand	Anodyne	HDAC6	22	43
CC(C)(O)CCNC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450774729	EF	On-Demand	Anodyne	IMDH_CRYPV	36	56
COC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1Cl	ZINC000450774736	GH	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1Cl	ZINC000450774736	GH	On-Demand	Anodyne	SSTR5	60	37
COC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1Cl	ZINC000450774736	GH	On-Demand	Anodyne	PDK1	49	39
COC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1Cl	ZINC000450774736	GH	On-Demand	Anodyne	MCHR1	41	43
COC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1Cl	ZINC000450774736	GH	On-Demand	Anodyne	ETHR	58	39
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450774737	DF	On-Demand	Anodyne	REN	33	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450774739	DF	On-Demand	Anodyne	REN	33	41
FC1(Cc2ccc(Cl)cc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450774740	EH	On-Demand	Anodyne	AKT2	69	79
FC1(Cc2ccc(Cl)cc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450774740	EH	On-Demand	Anodyne	AKT3	46	45
FC1(Cc2ccc(Cl)cc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450774740	EH	On-Demand	Anodyne	ROCK2	37	40
FC1(Cc2ccc(Cl)cc2)CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450774740	EH	On-Demand	Anodyne	AKT1	40	55
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450774741	DF	On-Demand	Anodyne	REN	33	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450774742	DF	On-Demand	Anodyne	REN	33	41
O=S(=O)(NCC1CC1)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)nc1	ZINC000450774764	FD	On-Demand	Anodyne	NPY1R	41	35
O=S(=O)(NCC1CC1)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)nc1	ZINC000450774765	FD	On-Demand	Anodyne	NPY1R	41	35
O=S(=O)(NCC1CC1)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)nc1	ZINC000450774766	FD	On-Demand	Anodyne	NPY1R	41	35
O=S(=O)(NCC1CC1)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)nc1	ZINC000450774767	FD	On-Demand	Anodyne	NPY1R	41	35
CCc1c(C(=O)N[C@@H]2CCOC[C@H]2OCCOC)oc2ccccc12	ZINC000450774777	EF	On-Demand	Anodyne	MMP12	0	44
CCc1c(C(=O)N[C@@H]2CCOC[C@H]2OCCOC)oc2ccccc12	ZINC000450774777	EF	On-Demand	Anodyne	MMP7	0	44
CCc1c(C(=O)N[C@H]2CCOC[C@@H]2OCCOC)oc2ccccc12	ZINC000450774780	EF	On-Demand	Anodyne	MMP12	0	44
CCc1c(C(=O)N[C@H]2CCOC[C@@H]2OCCOC)oc2ccccc12	ZINC000450774780	EF	On-Demand	Anodyne	MMP7	0	44
CCc1c(C(=O)N[C@@H]2CCOC[C@@H]2OCCOC)oc2ccccc12	ZINC000450774782	EF	On-Demand	Anodyne	MMP12	0	44
CCc1c(C(=O)N[C@@H]2CCOC[C@@H]2OCCOC)oc2ccccc12	ZINC000450774782	EF	On-Demand	Anodyne	MMP7	0	44
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	FKBP1A	66	59
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	MMP13	36	47
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	CCR4	17	43
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	ITGA4	71	40
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	PREP	52	39
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	CAPNS1	23	46
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	MMP3	42	41
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	MMP8	28	42
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	CAPN1	20	52
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	MMP9	25	40
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	ST14	51	35
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	MMP7	46	41
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	MMP1	41	44
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	SFRP1	63	36
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	WNT3	57	34
O=C(Nc1cccc(CCCO)c1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450774827	GE	On-Demand	Anodyne	RHOA	0	42
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450774829	EG	On-Demand	Anodyne	INHA	29	40
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450774830	EG	On-Demand	Anodyne	INHA	29	40
COC(=O)c1coc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)n1	ZINC000450774838	EE	On-Demand	Anodyne	CACNA1G	15	55
CC(C)CCCC(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450774843	DI	On-Demand	Anodyne	SOAT1	16	41
CC(C)CCCC(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450774844	DI	On-Demand	Anodyne	SOAT1	16	41
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCO[C@H](COCC2CC2)C1	ZINC000450774859	GG	On-Demand	Anodyne	RBP4	87	40
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CCO[C@@H](COCC2CC2)C1	ZINC000450774862	GG	On-Demand	Anodyne	RBP4	87	40
O=C1CC[C@H](CCC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)N1	ZINC000450774863	EG	On-Demand	Anodyne	UTS2R	42	28
O=C1CC[C@H](CCC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)N1	ZINC000450774865	EG	On-Demand	Anodyne	UTS2R	42	28
O=C1CC[C@H](CCC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)N1	ZINC000450774866	EG	On-Demand	Anodyne	UTS2R	42	28
O=C1CC[C@H](CCC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)N1	ZINC000450774867	EG	On-Demand	Anodyne	UTS2R	42	28
COCCO[C@H]1COCC[C@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450774886	FF	On-Demand	Anodyne	CCR2	48	38
COCCO[C@H]1COCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450774891	FF	On-Demand	Anodyne	CCR2	48	38
COCCOC[C@H](O)CN1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450774892	DC	On-Demand	Anodyne	HSP90AB1	38	43
COCCO[C@@H]1COCC[C@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450774893	FF	On-Demand	Anodyne	CCR2	48	38
COCCO[C@@H]1COCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450774894	FF	On-Demand	Anodyne	CCR2	48	38
COCCOC[C@@H](O)CN1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450774901	DC	On-Demand	Anodyne	HSP90AB1	38	43
CC1(O)CC(C(=O)N2CCC(c3c(F)cccc3F)CC2)C1	ZINC000450774907	DF	On-Demand	Anodyne	PRCP	41	32
CC1(O)CC(C(=O)N2CCC(c3c(F)cccc3F)CC2)C1	ZINC000450774907	DF	On-Demand	Anodyne	L3MBTL3	51	38
O=C(Nc1cccc(CCCO)c1)c1cc2c([nH]1)CCCC2	ZINC000450774912	CG	On-Demand	Anodyne	KCNK3	40	34
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450774919	EE	On-Demand	Anodyne	ABCB1	49	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450774921	EE	On-Demand	Anodyne	ABCB1	49	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450774923	EE	On-Demand	Anodyne	ABCB1	49	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450774925	EE	On-Demand	Anodyne	ABCB1	49	41
CC(C)(O)CN(CCCC(=O)c1ccc(Br)cc1)C1CC1	ZINC000450774929	FH	On-Demand	Anodyne	LSS	22	40
CC(C)(O)CN(CCCC(=O)c1ccc(Br)cc1)C1CC1	ZINC000450774929	FH	On-Demand	Anodyne	CYP2J2	47	35
COc1cc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)ccc1Cl	ZINC000450774930	EG	On-Demand	Anodyne	DRD1	0	42
COc1cc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)ccc1Cl	ZINC000450774930	EG	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)ccc1Cl	ZINC000450774930	EG	On-Demand	Anodyne	SSTR5	50	38
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	DRD2	32	44
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	DRD4	27	50
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	HTR2A	33	51
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	HTR2C	28	64
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	SLC6A1	51	34
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	ERG2	22	45
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	CCR3	24	40
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	SLC18A3	23	43
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	CACNA1G	48	45
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774931	FF	On-Demand	Anodyne	WNT3A	45	32
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	DRD2	32	44
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	DRD4	27	50
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	HTR2A	33	51
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	HTR2C	28	64
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	SLC6A1	51	34
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	ERG2	22	45
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	CCR3	24	40
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	SLC18A3	23	43
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	CACNA1G	48	45
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450774932	FF	On-Demand	Anodyne	WNT3A	45	32
CC(=O)[C@@](C)(O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774960	FG	On-Demand	Anodyne	SIGMAR1	22	40
CC(=O)[C@@](C)(O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774960	FG	On-Demand	Anodyne	RBP4	46	32
CC(=O)[C@@](C)(O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774960	FG	On-Demand	Anodyne	SCD1	26	41
CC(=O)[C@@](C)(O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774960	FG	On-Demand	Anodyne	SCD	26	40
CC(=O)[C@](C)(O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774962	FG	On-Demand	Anodyne	SIGMAR1	22	40
CC(=O)[C@](C)(O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774962	FG	On-Demand	Anodyne	RBP4	46	32
CC(=O)[C@](C)(O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774962	FG	On-Demand	Anodyne	SCD1	26	41
CC(=O)[C@](C)(O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450774962	FG	On-Demand	Anodyne	SCD	26	40
Cc1cc(N[C@H](C(=O)OC(C)C)C(C)C)n2ncnc2n1	ZINC000450774963	CD	On-Demand	Anodyne	DHOD	0	47
CNC(=O)c1cccnc1N[C@@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450774964	CD	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	40
CNC(=O)c1cccnc1N[C@@H](C1CC1)[C@H](CO)C1CC1	ZINC000450774965	CD	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	40
CNC(=O)c1cccnc1N[C@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450774966	CD	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	40
CNC(=O)c1cccnc1N[C@H](C1CC1)[C@H](CO)C1CC1	ZINC000450774967	CD	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	40
CC(C)OC(=O)[C@@H](Nc1ccc2nnc(-c3ccccc3)n2n1)C(C)C	ZINC000450774968	FF	On-Demand	Anodyne	LRRK2	31	41
COc1ccc(F)cc1CNC(=O)[C@@H]1OCC[C@@H]1C	ZINC000450774978	CD	On-Demand	Anodyne	P2RX7	32	40
COCCn1c(SCc2nc(-c3ccc(OC)nn3)no2)nc(C)c1C	ZINC000450774979	GE	On-Demand	Anodyne	AXIN2	0	42
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCc1nnnn1C	ZINC000450774989	EC	On-Demand	Anodyne	MAP3K5	44	33
CCOCc1nc(C)c(C(=O)NCc2ccc(Br)cc2OC)s1	ZINC000450774997	GH	On-Demand	Anodyne	CHRM4	16	41
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450775002	FH	On-Demand	Anodyne	SLC6A1	48	34
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450775002	FH	On-Demand	Anodyne	EPHX2	23	42
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450775002	FH	On-Demand	Anodyne	CACNA1G	41	43
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450775002	FH	On-Demand	Anodyne	CACNA1I	42	35
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450775003	FH	On-Demand	Anodyne	SLC6A1	48	34
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450775003	FH	On-Demand	Anodyne	EPHX2	23	42
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450775003	FH	On-Demand	Anodyne	CACNA1G	41	43
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450775003	FH	On-Demand	Anodyne	CACNA1I	42	35
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775005	GF	On-Demand	Anodyne	GRIN2B	23	44
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775005	GF	On-Demand	Anodyne	P2RX7	90	41
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775005	GF	On-Demand	Anodyne	EPHX2	20	41
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775005	GF	On-Demand	Anodyne	PDE8B	56	32
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775005	GF	On-Demand	Anodyne	CACNA1G	36	40
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775005	GF	On-Demand	Anodyne	ALK	17	41
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775005	GF	On-Demand	Anodyne	ACKR3	64	34
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775006	GF	On-Demand	Anodyne	GRIN2B	23	44
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775006	GF	On-Demand	Anodyne	P2RX7	90	41
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775006	GF	On-Demand	Anodyne	EPHX2	20	41
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775006	GF	On-Demand	Anodyne	PDE8B	56	32
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775006	GF	On-Demand	Anodyne	CACNA1G	36	40
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775006	GF	On-Demand	Anodyne	ALK	17	41
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450775006	GF	On-Demand	Anodyne	ACKR3	64	34
CN1CC[C@@H]2CN(c3nc4ccccc4[nH]3)C[C@@H]21	ZINC000450775007	BD	On-Demand	Anodyne	NPY5R	0	40
CCc1cccc(C(=O)Nc2cc(Br)c(OC)cc2OC)n1	ZINC000450775017	FH	On-Demand	Anodyne	PDE5A	28	45
CCc1cccc(C(=O)Nc2cc(Br)c(OC)cc2OC)n1	ZINC000450775017	FH	On-Demand	Anodyne	GRM4	19	40
COc1ccc(F)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450775020	FG	On-Demand	Anodyne	ANPEP	39	53
COc1ccc(F)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450775020	FG	On-Demand	Anodyne	CTSK	21	41
COc1ccc(F)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450775020	FG	On-Demand	Anodyne	CTSL	24	40
COc1ccc(F)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450775020	FG	On-Demand	Anodyne	PPARD	17	41
COc1ccc(F)cc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450775020	FG	On-Demand	Anodyne	CTSS	28	40
CCOc1ccccc1N1C(=O)C(=O)N(CCCCCC(C)=O)C1=O	ZINC000450775025	EF	On-Demand	Anodyne	PPARG	0	43
CCCOc1ccc(C(=O)Nc2sc(CC)nc2C)c(OC)c1	ZINC000450775038	EI	On-Demand	Anodyne	LUCI_LUCLA	16	45
CN1CC[C@@H]2CN(c3ccc(C#N)cn3)C[C@@H]21	ZINC000450775048	BD	On-Demand	Mild	SMO	0	40
CCC(=O)C1(C(=O)NCc2ccc(Cl)cc2F)CC1	ZINC000450775051	CF	On-Demand	Anodyne	P2RX7	41	42
CCC(=O)C1(C(=O)NCc2ccc(Cl)cc2F)CC1	ZINC000450775051	CF	On-Demand	Anodyne	BDKRB1	0	43
CN1CC[C@@H]2CN(c3ccc(C#N)c(C(F)(F)F)c3)C[C@@H]21	ZINC000450775052	CF	On-Demand	Mild	AR	26	45
COc1cc(Br)ccc1CNC(=O)CCCC(=O)C(C)(C)C	ZINC000450775053	FH	On-Demand	Anodyne	TRPV1	28	46
C=C(C)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450775064	CE	On-Demand	Mild	CACNA1C	41	39
C=C(C)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450775064	CE	On-Demand	Mild	CACNA1D	69	39
CC(=O)[C@](C)(O)CN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450775065	DC	On-Demand	Anodyne	NPFFR1	48	34
CC(=O)[C@](C)(O)CN(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450775066	DC	On-Demand	Anodyne	NPFFR1	48	34
CC(=O)[C@@](C)(O)CN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450775067	DC	On-Demand	Anodyne	NPFFR1	48	34
CC(=O)[C@@](C)(O)CN(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450775068	DC	On-Demand	Anodyne	NPFFR1	48	34
CCNC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)nc1	ZINC000450775076	CC	On-Demand	Anodyne	HDAC1	22	41
CCNC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)nc1	ZINC000450775076	CC	On-Demand	Anodyne	HPGDS	27	40
CN1CC[C@@H]2CN(c3ncc(-c4ccccc4)s3)C[C@@H]21	ZINC000450775081	CF	On-Demand	Anodyne	LUCI_LUCLA	17	41
O=C(c1ccc(I)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450775083	FE	On-Demand	Anodyne	MAP2K1	17	40
O=C(c1ccc(I)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450775084	FE	On-Demand	Anodyne	MAP2K1	17	40
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1=O	ZINC000450775091	DE	On-Demand	Anodyne	DRD2	32	43
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1=O	ZINC000450775091	DE	On-Demand	Anodyne	CYP2J2	50	35
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1=O	ZINC000450775092	DE	On-Demand	Anodyne	DRD2	32	43
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1=O	ZINC000450775092	DE	On-Demand	Anodyne	CYP2J2	50	35
C=C(C)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450775118	BD	On-Demand	Mild	NCE103	28	42
C=C(C)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450775118	BD	On-Demand	Mild	P96878_MYCTU	18	40
C=C(C)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450775118	BD	On-Demand	Mild	CAN2	0	42
CC[C@]1(O)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450775126	CE	On-Demand	Anodyne	DRD2	33	47
CC[C@]1(O)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450775126	CE	On-Demand	Anodyne	DRD4	0	47
CC[C@]1(O)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450775126	CE	On-Demand	Anodyne	SLC18A3	0	50
CC[C@]1(O)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450775126	CE	On-Demand	Anodyne	CYP2J2	65	47
CC[C@@]1(O)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450775127	CE	On-Demand	Anodyne	DRD2	33	47
CC[C@@]1(O)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450775127	CE	On-Demand	Anodyne	DRD4	0	47
CC[C@@]1(O)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450775127	CE	On-Demand	Anodyne	SLC18A3	0	50
CC[C@@]1(O)CCN(CCCC(=O)c2ccccc2)C1	ZINC000450775127	CE	On-Demand	Anodyne	CYP2J2	65	47
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450775129	FD	On-Demand	Anodyne	TRPV1	23	43
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450775130	FD	On-Demand	Anodyne	TRPV1	23	43
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450775132	FD	On-Demand	Anodyne	TRPV1	23	43
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450775133	FD	On-Demand	Anodyne	TRPV1	23	43
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc([N+](=O)[O-])c(C#N)c3)C2)CC1	ZINC000450775154	GE	On-Demand	Mild	SSTR1	29	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc([N+](=O)[O-])c(C#N)c3)C2)CC1	ZINC000450775154	GE	On-Demand	Mild	SSTR3	28	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc([N+](=O)[O-])c(C#N)c3)C2)CC1	ZINC000450775156	GE	On-Demand	Mild	SSTR1	29	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc([N+](=O)[O-])c(C#N)c3)C2)CC1	ZINC000450775156	GE	On-Demand	Mild	SSTR3	28	41
CCOC(=O)c1cccnc1N1CCC[C@H](CN2CCCN(C(C)=O)CC2)C1	ZINC000450775174	GE	On-Demand	Anodyne	P2RY12	45	35
CCOC(=O)c1cccnc1N1CCC[C@@H](CN2CCCN(C(C)=O)CC2)C1	ZINC000450775176	GE	On-Demand	Anodyne	P2RY12	45	35
CC(C)(O)CCNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450775179	ED	On-Demand	Mild	AR	22	41
CC(C)(O)CCNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450775180	ED	On-Demand	Mild	AR	22	41
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450775181	GI	On-Demand	Bother	TAAR1	45	57
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450775183	GI	On-Demand	Bother	TAAR1	45	57
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000450775184	GI	On-Demand	Bother	TAAR1	45	57
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000450775185	GI	On-Demand	Bother	TAAR1	45	57
CN1CC[C@@H]2CN(c3ncncc3-c3ccccc3)C[C@@H]21	ZINC000450775200	CE	On-Demand	Anodyne	SLC9A1	0	50
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450775208	FG	On-Demand	Bother	LUXR	17	41
CC(C)C[C@H]1OCCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450775210	FG	On-Demand	Bother	LUXR	17	41
CC(C)C[C@H]1OCCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450775212	FG	On-Demand	Bother	LUXR	17	41
CN1CC[C@@H]2CN(c3ccc(C(F)(F)F)c(C#N)c3)C[C@@H]21	ZINC000450775214	CF	On-Demand	Mild	AR	24	42
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450775215	FG	On-Demand	Bother	LUXR	17	41
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450775224	GD	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450775226	GD	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450775228	GD	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450775230	GD	On-Demand	Bother	TAAR1	21	49
CCC(CC)Oc1ccc(C(=O)NCC(=O)N(C)CC)cc1	ZINC000450775232	DE	On-Demand	Anodyne	KCNQ1	0	40
Cn1ncc2c(N3CCC(F)(Cc4ccc(Cl)cc4)CC3)ncnc21	ZINC000450775242	FH	On-Demand	Anodyne	AKT2	46	44
Cn1ncc2c(N3CCC(F)(Cc4ccc(Cl)cc4)CC3)ncnc21	ZINC000450775242	FH	On-Demand	Anodyne	AKT3	36	41
CCOC(=O)[C@@H](NCCc1cscn1)c1ccc(OC)c(F)c1	ZINC000450775274	EF	On-Demand	Anodyne	BMP1	43	34
CCOC(=O)[C@H](NCCc1cscn1)c1ccc(OC)c(F)c1	ZINC000450775275	EF	On-Demand	Anodyne	BMP1	43	34
CC(F)(F)c1ccc(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)cn1	ZINC000450775276	FI	On-Demand	Anodyne	MTTP	37	42
CC(F)(F)c1ccc(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)cn1	ZINC000450775276	FI	On-Demand	Anodyne	EPHX2	23	45
CC(F)(F)c1ccc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cn1	ZINC000450775277	FI	On-Demand	Anodyne	MTTP	37	42
CC(F)(F)c1ccc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cn1	ZINC000450775277	FI	On-Demand	Anodyne	EPHX2	23	45
Cc1ccn2ncc(C(=O)N3CCC(c4c(F)cccc4F)CC3)c2c1	ZINC000450775308	FH	On-Demand	Anodyne	PRCP	42	31
Cc1ccn2ncc(C(=O)N3CCC(c4c(F)cccc4F)CC3)c2c1	ZINC000450775308	FH	On-Demand	Anodyne	EPHB3	25	43
CCOC(=O)c1ccc(CN(CC(C)C)[C@H]2CCCc3cccnc32)nc1	ZINC000450775334	FI	On-Demand	Anodyne	CXCR4	90	54
CCOC(=O)c1ccc(CN(CC(C)C)[C@@H]2CCCc3cccnc32)nc1	ZINC000450775335	FI	On-Demand	Anodyne	CXCR4	90	54
CC(C)(C#N)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450775336	CD	On-Demand	Mild	HPGDS	17	46
Fc1cc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2cc1F	ZINC000450775382	DE	On-Demand	Anodyne	PDE3A	43	32
Fc1cc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2cc1F	ZINC000450775382	DE	On-Demand	Anodyne	PDE3B	41	32
Fc1cc2ncnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2cc1F	ZINC000450775383	DE	On-Demand	Anodyne	PDE3A	43	32
Fc1cc2ncnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2cc1F	ZINC000450775383	DE	On-Demand	Anodyne	PDE3B	41	32
Fc1cc2ncnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2cc1F	ZINC000450775384	DE	On-Demand	Anodyne	PDE3A	43	32
Fc1cc2ncnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2cc1F	ZINC000450775384	DE	On-Demand	Anodyne	PDE3B	41	32
Cc1cc(C)c(C(=O)N2CC(NC(=O)C3CCC3)C2)cc1Br	ZINC000450775403	FF	On-Demand	Anodyne	EPHX2	25	44
Cc1nnc2c3ccccc3c(N3C[C@H]4CCN(C)[C@H]4C3)nn12	ZINC000450775421	DD	On-Demand	Anodyne	CREBBP	44	35
Cc1nnc2c3ccccc3c(N3C[C@H]4CCN(C)[C@H]4C3)nn12	ZINC000450775421	DD	On-Demand	Anodyne	BRD9	55	35
C[C@@H](CN(C)C[C@]1(O)CCN(Cc2ccccc2)C1)S(C)(=O)=O	ZINC000450775427	EC	On-Demand	Anodyne	NPFFR1	46	32
C[C@H](CN(C)C[C@]1(O)CCN(Cc2ccccc2)C1)S(C)(=O)=O	ZINC000450775434	EC	On-Demand	Anodyne	NPFFR1	46	32
O=C([C@@H](O)C1CCC1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450775438	EF	On-Demand	Anodyne	RBP4	57	38
C[C@@H](CN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1)S(C)(=O)=O	ZINC000450775439	EC	On-Demand	Anodyne	NPFFR1	46	32
C[C@H](CN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1)S(C)(=O)=O	ZINC000450775441	EC	On-Demand	Anodyne	NPFFR1	46	32
O=C([C@@H](O)C1CCC1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450775447	EF	On-Demand	Anodyne	RBP4	57	38
O=C([C@H](O)C1CCC1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450775450	EF	On-Demand	Anodyne	RBP4	57	38
O=C([C@H](O)C1CCC1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450775451	EF	On-Demand	Anodyne	RBP4	57	38
COc1ccc(F)cc1CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450775454	FG	On-Demand	Anodyne	PPARA	16	43
COc1ccc(F)cc1CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450775454	FG	On-Demand	Anodyne	GRIN2B	24	41
COc1ccc(F)cc1CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450775454	FG	On-Demand	Anodyne	PPARD	25	44
COc1ccc(F)cc1CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450775454	FG	On-Demand	Anodyne	EPHX2	0	41
COc1ccc(F)cc1CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450775454	FG	On-Demand	Anodyne	MT-ND1	19	48
COc1ccc(F)cc1CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450775454	FG	On-Demand	Anodyne	GCK	25	41
COc1ccc(F)cc1CNC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450775454	FG	On-Demand	Anodyne	CARM1	16	40
COC(=O)C(C)(C)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450775458	DD	On-Demand	Anodyne	HTR1A	15	42
COC(=O)C(C)(C)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450775458	DD	On-Demand	Anodyne	DRD2	17	42
COC(=O)C(C)(C)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450775458	DD	On-Demand	Anodyne	DRD4	42	33
COC(=O)C(C)(C)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450775458	DD	On-Demand	Anodyne	ACHE	20	43
COC(=O)C(C)(C)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450775458	DD	On-Demand	Anodyne	CHRM3	17	40
COC(=O)C(C)(C)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450775458	DD	On-Demand	Anodyne	FAAH	20	40
COC(=O)C(C)(C)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450775458	DD	On-Demand	Anodyne	CACNA1G	19	42
COC(=O)[C@]1(C)CCCN1Cc1ccccc1OC1CC1	ZINC000450775496	CF	On-Demand	Anodyne	HCN4	49	33
COC(=O)[C@@]1(C)CCCN1Cc1ccccc1OC1CC1	ZINC000450775498	CF	On-Demand	Anodyne	HCN4	49	33
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H]2C	ZINC000450775507	FH	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H]2C	ZINC000450775507	FH	On-Demand	Anodyne	MTNR1B	35	43
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H]2C	ZINC000450775508	FH	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H]2C	ZINC000450775508	FH	On-Demand	Anodyne	MTNR1B	35	43
COc1ccc2c(c1)C[C@@H](C)N(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H]2C	ZINC000450775510	FH	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc2c(c1)C[C@@H](C)N(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H]2C	ZINC000450775510	FH	On-Demand	Anodyne	MTNR1B	35	43
COc1ccc2c(c1)C[C@@H](C)N(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H]2C	ZINC000450775513	FH	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc2c(c1)C[C@@H](C)N(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H]2C	ZINC000450775513	FH	On-Demand	Anodyne	MTNR1B	35	43
COc1cc(CC(=O)Nc2cnc3c(c2)CCCC3)ccc1O	ZINC000450775522	DF	On-Demand	Anodyne	TRPV1	22	45
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450775529	GD	On-Demand	Anodyne	THYX_PBCV1	0	46
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450775532	GD	On-Demand	Anodyne	THYX_PBCV1	0	46
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450775534	GD	On-Demand	Anodyne	THYX_PBCV1	0	46
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450775535	GD	On-Demand	Anodyne	THYX_PBCV1	0	46
COCCOC[C@H](O)CN1CCc2c(Br)ccc(Cl)c2C1	ZINC000450775538	GE	On-Demand	Anodyne	HSP90AB1	35	41
COCCOC[C@@H](O)CN1CCc2c(Br)ccc(Cl)c2C1	ZINC000450775546	GE	On-Demand	Anodyne	HSP90AB1	35	41
COc1cccc(OCCC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450775550	GE	On-Demand	Anodyne	MMP13	39	42
COc1cccc(OCCC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450775550	GE	On-Demand	Anodyne	MTNR1A	72	46
COc1cccc(OCCC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450775550	GE	On-Demand	Anodyne	MTNR1B	68	46
COc1cccc(OCCC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450775550	GE	On-Demand	Anodyne	MMP3	19	42
COc1cccc(OCCC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450775550	GE	On-Demand	Anodyne	ROCK2	43	41
COc1cccc(OCCC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450775550	GE	On-Demand	Anodyne	IAP	0	42
COc1cccc(OCCC(=O)NCc2cccc(S(=O)(=O)N(C)C)c2)c1	ZINC000450775550	GE	On-Demand	Anodyne	PDS	47	43
CCOCc1nc(C)c(C(=O)NCc2cc(F)ccc2OC)s1	ZINC000450775588	EG	On-Demand	Anodyne	CHRM4	0	45
CCOCc1nc(C)c(C(=O)NCc2cc(F)ccc2OC)s1	ZINC000450775588	EG	On-Demand	Anodyne	PPARD	28	41
CCOCc1nc(C)c(C(=O)NCc2cc(F)ccc2OC)s1	ZINC000450775588	EG	On-Demand	Anodyne	SCD1	40	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(C(N)=O)cc3Cl)C2)CC1	ZINC000450775589	GD	On-Demand	Anodyne	P2RY12	28	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(C(N)=O)cc3Cl)C2)CC1	ZINC000450775589	GD	On-Demand	Anodyne	CXCR3	35	49
C[C@H](c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775597	GH	On-Demand	Anodyne	SIGMAR1	29	46
C[C@H](c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775597	GH	On-Demand	Anodyne	MLNR	53	38
C[C@H](c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775597	GH	On-Demand	Anodyne	S1PR5	35	42
C[C@H](c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775597	GH	On-Demand	Anodyne	CACNA1G	45	52
C[C@@H](c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775599	GH	On-Demand	Anodyne	SIGMAR1	29	46
C[C@@H](c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775599	GH	On-Demand	Anodyne	MLNR	53	38
C[C@@H](c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775599	GH	On-Demand	Anodyne	S1PR5	35	42
C[C@@H](c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775599	GH	On-Demand	Anodyne	CACNA1G	45	52
C[C@H](c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775602	GH	On-Demand	Anodyne	SIGMAR1	29	46
C[C@H](c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775602	GH	On-Demand	Anodyne	MLNR	53	38
C[C@H](c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775602	GH	On-Demand	Anodyne	S1PR5	35	42
C[C@H](c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775602	GH	On-Demand	Anodyne	CACNA1G	45	52
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(C(N)=O)cc3Cl)C2)CC1	ZINC000450775605	GD	On-Demand	Anodyne	P2RY12	28	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(C(N)=O)cc3Cl)C2)CC1	ZINC000450775605	GD	On-Demand	Anodyne	CXCR3	35	49
C[C@@H](c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775606	GH	On-Demand	Anodyne	SIGMAR1	29	46
C[C@@H](c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775606	GH	On-Demand	Anodyne	MLNR	53	38
C[C@@H](c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775606	GH	On-Demand	Anodyne	S1PR5	35	42
C[C@@H](c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1)C(F)(F)F	ZINC000450775606	GH	On-Demand	Anodyne	CACNA1G	45	52
CC[C@@H]1C[C@H]1C(=O)NCc1ccc(Cl)cc1F	ZINC000450775608	CG	On-Demand	Anodyne	P2RX7	70	44
CC[C@@H]1C[C@H]1C(=O)NCc1ccc(Cl)cc1F	ZINC000450775608	CG	On-Demand	Anodyne	EPHX2	15	40
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OCCO	ZINC000450775628	EE	On-Demand	Anodyne	P4HTM	0	41
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OCCO	ZINC000450775628	EE	On-Demand	Anodyne	HSPB1	0	46
COc1cc(Br)c(C(=O)Nc2cnc3c(c2)CCCC3)cc1OC	ZINC000450775632	GH	On-Demand	Anodyne	KCNK3	44	40
COc1cc(Br)c(C(=O)Nc2cnc3c(c2)CCCC3)cc1OC	ZINC000450775632	GH	On-Demand	Anodyne	KCNK9	34	40
COC(=O)c1sc2nc(C)nc(N3CC[C@@H](OC)[C@H](C)C3)c2c1C	ZINC000450775653	EF	On-Demand	Anodyne	PARE	40	32
COc1ccc2nc(C)nc(N3C[C@@H]4CCN(C)[C@@H]4C3)c2c1	ZINC000450775658	CE	On-Demand	Anodyne	PDE3B	45	36
COC(=O)c1sc2nc(C)nc(N3CC[C@H](OC)[C@@H](C)C3)c2c1C	ZINC000450775661	EF	On-Demand	Anodyne	PARE	40	32
C[C@H](c1ccc(CN2CCC[C@H]2CCO)cc1)C(F)(F)F	ZINC000450775662	DH	On-Demand	Anodyne	SLC18A2	48	33
C[C@H](c1ccc(CN2CCC[C@@H]2CCO)cc1)C(F)(F)F	ZINC000450775663	DH	On-Demand	Anodyne	SLC18A2	48	33
COC(=O)c1sc2nc(C)nc(N3CC[C@@H](OC)[C@@H](C)C3)c2c1C	ZINC000450775664	EF	On-Demand	Anodyne	PARE	40	32
C[C@@H](c1ccc(CN2CCC[C@@H]2CCO)cc1)C(F)(F)F	ZINC000450775665	DH	On-Demand	Anodyne	SLC18A2	48	33
COC(=O)c1sc2nc(C)nc(N3CC[C@H](OC)[C@H](C)C3)c2c1C	ZINC000450775666	EF	On-Demand	Anodyne	PARE	40	32
C[C@@H](c1ccc(CN2CCC[C@H]2CCO)cc1)C(F)(F)F	ZINC000450775667	DH	On-Demand	Anodyne	SLC18A2	48	33
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	HTR1A	15	57
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	DRD2	32	44
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	DRD1	20	47
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	DRD4	26	45
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	HTR2A	46	52
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	HTR2C	21	57
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	ADRA1B	15	42
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	ERG2	21	44
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	HTR3B	0	47
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	SMO	40	32
O=C(CCCN1CCC(c2noc(C3CC3)n2)CC1)c1ccc(F)cc1	ZINC000450775669	FH	On-Demand	Anodyne	ETHR	68	44
O=C(Nc1ccccc1)C1(NCCc2ccc(Cl)cc2)CC1	ZINC000450775672	DH	On-Demand	Anodyne	SPHK1	15	43
CC(=O)N1CCN(C(=O)C2CCN(c3nc4cc(C)ccc4o3)CC2)CC1	ZINC000450775675	FE	On-Demand	Anodyne	HCRTR1	38	46
CC(=O)N1CCN(C(=O)C2CCN(c3nc4cc(C)ccc4o3)CC2)CC1	ZINC000450775675	FE	On-Demand	Anodyne	HCRTR2	23	46
CC(=O)N1CCN(C(=O)C2CCN(c3nc4cc(C)ccc4o3)CC2)CC1	ZINC000450775675	FE	On-Demand	Anodyne	PTGES	38	45
CC(=O)N1CCN(C(=O)C2CCN(c3nc4cc(C)ccc4o3)CC2)CC1	ZINC000450775675	FE	On-Demand	Anodyne	NPBWR1	42	43
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4ccc(F)cc34)C2)CC1	ZINC000450775688	GG	On-Demand	Anodyne	DHODH	45	36
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4ccc(F)cc34)C2)CC1	ZINC000450775688	GG	On-Demand	Anodyne	CCR3	62	35
CC(=O)N1CCCN(C[C@@H]2CCCN(c3cc(C)nc4ccc(F)cc34)C2)CC1	ZINC000450775688	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	81	40
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4ccc(F)cc34)C2)CC1	ZINC000450775692	GG	On-Demand	Anodyne	DHODH	45	36
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4ccc(F)cc34)C2)CC1	ZINC000450775692	GG	On-Demand	Anodyne	CCR3	62	35
CC(=O)N1CCCN(C[C@H]2CCCN(c3cc(C)nc4ccc(F)cc34)C2)CC1	ZINC000450775692	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	81	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2CCO)c(OC)c1	ZINC000450775695	ED	On-Demand	Anodyne	DRD2	33	42
COc1ccc(CNC(=O)CCN2CCC[C@H]2CCO)c(OC)c1	ZINC000450775695	ED	On-Demand	Anodyne	MTNR1A	41	34
COc1ccc(CNC(=O)CCN2CCC[C@H]2CCO)c(OC)c1	ZINC000450775695	ED	On-Demand	Anodyne	ACKR3	67	35
COc1ccc(CNC(=O)CCN2CCC[C@@H]2CCO)c(OC)c1	ZINC000450775698	ED	On-Demand	Anodyne	DRD2	33	42
COc1ccc(CNC(=O)CCN2CCC[C@@H]2CCO)c(OC)c1	ZINC000450775698	ED	On-Demand	Anodyne	MTNR1A	41	34
COc1ccc(CNC(=O)CCN2CCC[C@@H]2CCO)c(OC)c1	ZINC000450775698	ED	On-Demand	Anodyne	ACKR3	67	35
CCN1C[C@H](Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CC1=O	ZINC000450775700	ED	On-Demand	Bother	TBXA2R	25	44
CCN1C[C@@H](Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CC1=O	ZINC000450775703	ED	On-Demand	Bother	TBXA2R	25	44
CCc1nc(C)c(NC(=O)Cc2ccc(C(=O)OC)cc2)s1	ZINC000450775750	DF	On-Demand	Anodyne	MAPK9	0	48
CCc1nc(C)c(NC(=O)Cc2ccc(C(=O)OC)cc2)s1	ZINC000450775750	DF	On-Demand	Anodyne	MAPK10	27	51
CCc1nc(C)c(NC(=O)Cc2ccc(C(=O)OC)cc2)s1	ZINC000450775750	DF	On-Demand	Anodyne	MAPK8	24	48
CCOC(=O)c1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)[nH]c1C	ZINC000450775763	GH	On-Demand	Anodyne	HRH4	25	43
CCOC(=O)c1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)[nH]c1C	ZINC000450775763	GH	On-Demand	Anodyne	TPSAB1	28	41
CCOC(=O)c1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)[nH]c1C	ZINC000450775763	GH	On-Demand	Anodyne	AKR1C3	17	42
CCOc1cc(C(=O)Nc2cccc(CCCO)c2)on1	ZINC000450775777	CE	On-Demand	Anodyne	INHA	19	40
CCN(Cc1cn(C)nn1)C(=O)CCOc1cccc(OC)c1	ZINC000450775778	DD	On-Demand	Anodyne	MTNR1A	17	40
CN1C(=O)C[C@@H](C(=O)Nc2cccc(CCCO)c2)[C@@H]1c1cccnc1	ZINC000450775780	FE	On-Demand	Anodyne	PTAFR	17	46
CC(C)(C)C(=O)CCCC(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000450775781	FI	On-Demand	Anodyne	ETHR	61	37
O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450775782	GH	On-Demand	Anodyne	MTTP	48	36
O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450775782	GH	On-Demand	Anodyne	SFRP1	53	34
O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450775783	GH	On-Demand	Anodyne	MTTP	48	36
O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450775783	GH	On-Demand	Anodyne	SFRP1	53	34
COc1cc(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775788	FI	On-Demand	Anodyne	ADRB1	20	41
COc1cc(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775788	FI	On-Demand	Anodyne	TRPV1	38	45
COc1cc(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775788	FI	On-Demand	Anodyne	P2RX7	17	41
COc1cc(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775788	FI	On-Demand	Anodyne	SLC6A9	0	40
COc1cc(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775788	FI	On-Demand	Anodyne	MTTP	42	38
COc1cc(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775789	FI	On-Demand	Anodyne	ADRB1	20	41
COc1cc(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775789	FI	On-Demand	Anodyne	TRPV1	38	45
COc1cc(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775789	FI	On-Demand	Anodyne	P2RX7	17	41
COc1cc(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775789	FI	On-Demand	Anodyne	SLC6A9	0	40
COc1cc(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)ccc1Cl	ZINC000450775789	FI	On-Demand	Anodyne	MTTP	42	38
O=C(CCc1nc2cnccc2[nH]1)Nc1cccc(CCCO)c1	ZINC000450775819	DE	On-Demand	Anodyne	HDAC3	39	41
O=C(CCc1nc2cnccc2[nH]1)Nc1cccc(CCCO)c1	ZINC000450775819	DE	On-Demand	Anodyne	HDAC6	27	41
CCC1(CC)CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450775824	CH	On-Demand	Anodyne	GNAI1	0	45
CCC1(CC)CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450775824	CH	On-Demand	Anodyne	GNAI3	0	43
CCC1(CC)CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450775824	CH	On-Demand	Anodyne	GNAO1	0	43
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775825	DF	On-Demand	Anodyne	MME	48	35
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775825	DF	On-Demand	Anodyne	ANPEP	87	33
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775825	DF	On-Demand	Anodyne	TIMP3	48	33
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775825	DF	On-Demand	Anodyne	MMP3	41	39
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775825	DF	On-Demand	Anodyne	AMP1_PLAFQ	40	38
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775825	DF	On-Demand	Anodyne	GPR142	63	38
CO[C@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775825	DF	On-Demand	Anodyne	PARP10	0	48
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775826	DF	On-Demand	Anodyne	MME	48	35
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775826	DF	On-Demand	Anodyne	ANPEP	87	33
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775826	DF	On-Demand	Anodyne	TIMP3	48	33
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775826	DF	On-Demand	Anodyne	MMP3	41	39
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775826	DF	On-Demand	Anodyne	AMP1_PLAFQ	40	38
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775826	DF	On-Demand	Anodyne	GPR142	63	38
CO[C@@H](Cc1ccccc1)C(=O)Nc1cccc(CCCO)c1	ZINC000450775826	DF	On-Demand	Anodyne	PARP10	0	48
COC(=O)[C@@H]1C[C@H](C)CCN1C[C@@H](Cc1ccccc1)OC	ZINC000450775843	DF	On-Demand	Anodyne	ACE	52	38
COC(=O)[C@@H]1C[C@H](C)CCN1C[C@H](Cc1ccccc1)OC	ZINC000450775844	DF	On-Demand	Anodyne	ACE	52	38
COC(=O)[C@@H]1C[C@@H](C)CCN1C[C@@H](Cc1ccccc1)OC	ZINC000450775845	DF	On-Demand	Anodyne	ACE	52	38
COC(=O)[C@@H]1C[C@@H](C)CCN1C[C@H](Cc1ccccc1)OC	ZINC000450775846	DF	On-Demand	Anodyne	ACE	52	38
COC(=O)c1coc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450775847	EG	On-Demand	Anodyne	SLC6A1	40	43
COC(=O)c1coc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450775847	EG	On-Demand	Anodyne	CCR1	42	38
COC(=O)c1coc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450775847	EG	On-Demand	Anodyne	MCHR1	24	40
COC(=O)c1coc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450775847	EG	On-Demand	Anodyne	MGEA5	25	40
CCCc1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)no1	ZINC000450775856	EH	On-Demand	Anodyne	ETHR	42	34
Cc1nc2c3ccccc3nc(SCc3cn(C)nc3C)n2n1	ZINC000450775859	DF	On-Demand	Anodyne	PDE10A	21	63
COc1c(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cccc1C(N)=O	ZINC000450775860	GH	On-Demand	Anodyne	RBP4	91	41
COC(=O)c1ccc(CN2CCN(CCO)[C@H](C)C2)cc1Cl	ZINC000450775864	ED	On-Demand	Anodyne	CCR1	38	40
COC(=O)c1ccc(CN2CCN(CCO)[C@@H](C)C2)cc1Cl	ZINC000450775865	ED	On-Demand	Anodyne	CCR1	38	40
COc1cccc(OCCC(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450775906	EF	On-Demand	Anodyne	MTNR1A	39	48
COc1cccc(OCCC(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450775906	EF	On-Demand	Anodyne	MTNR1B	36	45
COc1cccc(OCCC(=O)Nc2ccc(OCCO)c(C)c2)c1	ZINC000450775906	EF	On-Demand	Anodyne	ENPP1	56	37
CO[C@@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C[C@@H]1C	ZINC000450775920	DF	On-Demand	Anodyne	LRRK2	24	43
CO[C@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C[C@H]1C	ZINC000450775922	DF	On-Demand	Anodyne	LRRK2	24	43
C=CCNC(=O)c1ccc(N2C[C@H]3CCN(C)[C@H]3C2)nc1	ZINC000450775923	CD	On-Demand	Mild	HDAC1	17	40
CO[C@@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C[C@H]1C	ZINC000450775924	DF	On-Demand	Anodyne	LRRK2	24	43
CO[C@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C[C@@H]1C	ZINC000450775925	DF	On-Demand	Anodyne	LRRK2	24	43
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@H](OCC2CC2)C1	ZINC000450775959	EF	On-Demand	Anodyne	ERBB2	0	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@H](OCC2CC2)C1	ZINC000450775959	EF	On-Demand	Anodyne	ADAM10	33	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@H](OCC2CC2)C1	ZINC000450775959	EF	On-Demand	Anodyne	LIPG	34	43
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450775961	EF	On-Demand	Anodyne	ERBB2	0	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450775961	EF	On-Demand	Anodyne	ADAM10	33	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450775961	EF	On-Demand	Anodyne	LIPG	34	43
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H](OCC2CC2)C1	ZINC000450775964	EF	On-Demand	Anodyne	ERBB2	0	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H](OCC2CC2)C1	ZINC000450775964	EF	On-Demand	Anodyne	ADAM10	33	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H](OCC2CC2)C1	ZINC000450775964	EF	On-Demand	Anodyne	LIPG	34	43
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450775965	EF	On-Demand	Anodyne	ERBB2	0	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450775965	EF	On-Demand	Anodyne	ADAM10	33	41
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450775965	EF	On-Demand	Anodyne	LIPG	34	43
COC(=O)c1ccc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000450775996	FG	On-Demand	Anodyne	SCD1	41	37
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450775998	EF	On-Demand	Anodyne	PRNP	40	33
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450775998	EF	On-Demand	Anodyne	SCD1	52	48
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450775998	EF	On-Demand	Anodyne	SCD	26	41
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450776000	EF	On-Demand	Anodyne	PRNP	40	33
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450776000	EF	On-Demand	Anodyne	SCD1	52	48
CO[C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450776000	EF	On-Demand	Anodyne	SCD	26	41
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450776002	EF	On-Demand	Anodyne	PRNP	40	33
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450776002	EF	On-Demand	Anodyne	SCD1	52	48
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1C	ZINC000450776002	EF	On-Demand	Anodyne	SCD	26	41
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450776004	EF	On-Demand	Anodyne	PRNP	40	33
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450776004	EF	On-Demand	Anodyne	SCD1	52	48
CO[C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H]1C	ZINC000450776004	EF	On-Demand	Anodyne	SCD	26	41
FC(F)c1nccnc1N1CCC(F)(Cc2ccc(Cl)cc2)CC1	ZINC000450776014	FJ	On-Demand	Anodyne	AKT2	27	41
Cn1ccnc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)c1=O	ZINC000450776017	EF	On-Demand	Anodyne	AKT2	23	40
Cn1ccnc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)c1=O	ZINC000450776017	EF	On-Demand	Anodyne	AKT1	0	40
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncccc3Cl)C2)CC1	ZINC000450776061	FF	On-Demand	Anodyne	OPRK1	0	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncccc3Cl)C2)CC1	ZINC000450776061	FF	On-Demand	Anodyne	FAAH	25	43
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncccc3Cl)C2)CC1	ZINC000450776063	FF	On-Demand	Anodyne	OPRK1	0	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncccc3Cl)C2)CC1	ZINC000450776063	FF	On-Demand	Anodyne	FAAH	25	43
CO[C@@H]1CCN(c2cc(N3CCCC3)ncn2)C[C@H]1C	ZINC000450776065	CD	On-Demand	Anodyne	PDE3A	44	34
CO[C@H]1CCN(c2cc(N3CCCC3)ncn2)C[C@H]1C	ZINC000450776067	CD	On-Demand	Anodyne	PDE3A	44	34
CO[C@@H]1CCN(c2cc(N3CCCC3)ncn2)C[C@@H]1C	ZINC000450776069	CD	On-Demand	Anodyne	PDE3A	44	34
CO[C@H]1CCN(c2cc(N3CCCC3)ncn2)C[C@@H]1C	ZINC000450776071	CD	On-Demand	Anodyne	PDE3A	44	34
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nc4cccc(F)c4s3)C2)CC1	ZINC000450776073	GG	On-Demand	Anodyne	CCR3	44	35
CC(=O)N1CCCN(C[C@H]2CCCN(c3nc4cccc(F)c4s3)C2)CC1	ZINC000450776075	GG	On-Demand	Anodyne	CCR3	44	35
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(C#N)c([N+](=O)[O-])c3)C2)CC1	ZINC000450776076	GE	On-Demand	Mild	SSTR1	31	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc(C#N)c([N+](=O)[O-])c3)C2)CC1	ZINC000450776076	GE	On-Demand	Mild	SSTR3	28	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(C#N)c([N+](=O)[O-])c3)C2)CC1	ZINC000450776077	GE	On-Demand	Mild	SSTR1	31	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc(C#N)c([N+](=O)[O-])c3)C2)CC1	ZINC000450776077	GE	On-Demand	Mild	SSTR3	28	41
OC[C@H](C1CC1)[C@H](Nc1cc(N2CCCCC2)ncn1)C1CC1	ZINC000450776093	DF	On-Demand	Anodyne	PRCP	0	43
OC[C@@H](C1CC1)[C@H](Nc1cc(N2CCCCC2)ncn1)C1CC1	ZINC000450776094	DF	On-Demand	Anodyne	PRCP	0	43
OC[C@H](C1CC1)[C@@H](Nc1cc(N2CCCCC2)ncn1)C1CC1	ZINC000450776096	DF	On-Demand	Anodyne	PRCP	0	43
OC[C@@H](C1CC1)[C@@H](Nc1cc(N2CCCCC2)ncn1)C1CC1	ZINC000450776097	DF	On-Demand	Anodyne	PRCP	0	43
CO[C@H](Cc1ccccc1)CN(C)[C@H](CO)CC(C)C	ZINC000450776117	CF	On-Demand	Anodyne	CAPNS1	46	33
CO[C@H](Cc1ccccc1)CN(C)[C@@H](CO)CC(C)C	ZINC000450776118	CF	On-Demand	Anodyne	CAPNS1	46	33
CO[C@@H](Cc1ccccc1)CN(C)[C@H](CO)CC(C)C	ZINC000450776119	CF	On-Demand	Anodyne	CAPNS1	46	33
CO[C@@H](Cc1ccccc1)CN(C)[C@@H](CO)CC(C)C	ZINC000450776120	CF	On-Demand	Anodyne	CAPNS1	46	33
O=C(Nc1cccc(CCCO)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450776166	DG	On-Demand	Anodyne	MAPK1	28	40
O=C(Nc1cccc(CCCO)c1)[C@H]1CCN(c2ccccc2)C1	ZINC000450776166	DG	On-Demand	Anodyne	RHOA	0	44
O=C(Nc1cccc(CCCO)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450776167	DG	On-Demand	Anodyne	MAPK1	28	40
O=C(Nc1cccc(CCCO)c1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450776167	DG	On-Demand	Anodyne	RHOA	0	44
O=C(c1cc2n(n1)CCCC2)N1CCC(c2c(F)cccc2F)CC1	ZINC000450776203	EH	On-Demand	Anodyne	L3MBTL1	0	42
O=C(c1cc2n(n1)CCCC2)N1CCC(c2c(F)cccc2F)CC1	ZINC000450776203	EH	On-Demand	Anodyne	L3MBTL3	72	42
COc1cccc(OCCC(=O)NCC(C)(C)C#N)c1	ZINC000450776210	CE	On-Demand	Mild	DRD4	41	31
COc1cccc(OCCC(=O)NCC(C)(C)C#N)c1	ZINC000450776210	CE	On-Demand	Mild	MTNR1A	57	51
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450776212	GF	On-Demand	Anodyne	TRPC6	60	32
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450776212	GF	On-Demand	Anodyne	TRPC3	46	32
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450776213	GF	On-Demand	Anodyne	TRPC6	60	32
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450776213	GF	On-Demand	Anodyne	TRPC3	46	32
Cc1nc2c3ccccc3nc(SCc3ccn(CC(F)(F)F)n3)n2n1	ZINC000450776222	GH	On-Demand	Anodyne	PDE10A	19	63
CC(=O)N[C@H](C(=O)NC[C@@H](c1ccccc1)C(F)(F)F)C(C)(C)C	ZINC000450776227	EF	On-Demand	Anodyne	MMP3	22	43
CC(=O)N[C@H](C(=O)NC[C@@H](c1ccccc1)C(F)(F)F)C(C)(C)C	ZINC000450776227	EF	On-Demand	Anodyne	MTTP	42	34
CC(=O)N[C@H](C(=O)NC[C@@H](c1ccccc1)C(F)(F)F)C(C)(C)C	ZINC000450776227	EF	On-Demand	Anodyne	Q82323_9DELA	66	33
CC(=O)N[C@H](C(=O)NC[C@H](c1ccccc1)C(F)(F)F)C(C)(C)C	ZINC000450776228	EF	On-Demand	Anodyne	MMP3	22	43
CC(=O)N[C@H](C(=O)NC[C@H](c1ccccc1)C(F)(F)F)C(C)(C)C	ZINC000450776228	EF	On-Demand	Anodyne	MTTP	42	34
CC(=O)N[C@H](C(=O)NC[C@H](c1ccccc1)C(F)(F)F)C(C)(C)C	ZINC000450776228	EF	On-Demand	Anodyne	Q82323_9DELA	66	33
O=C(CCCC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21)C1CC1	ZINC000450776229	EI	On-Demand	Anodyne	UTS2R	44	30
O=C(CCCC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21)C1CC1	ZINC000450776229	EI	On-Demand	Anodyne	PREP	58	39
O=C(CCCC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21)C1CC1	ZINC000450776230	EI	On-Demand	Anodyne	UTS2R	44	30
O=C(CCCC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21)C1CC1	ZINC000450776230	EI	On-Demand	Anodyne	PREP	58	39
O=C(CCCC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21)C1CC1	ZINC000450776231	EI	On-Demand	Anodyne	UTS2R	44	30
O=C(CCCC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21)C1CC1	ZINC000450776231	EI	On-Demand	Anodyne	PREP	58	39
O=C(CCCC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21)C1CC1	ZINC000450776232	EI	On-Demand	Anodyne	UTS2R	44	30
O=C(CCCC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21)C1CC1	ZINC000450776232	EI	On-Demand	Anodyne	PREP	58	39
Cc1nc(C2CC2)ccc1C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450776255	EI	On-Demand	Anodyne	MTTP	87	37
Cc1nc(C2CC2)ccc1C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450776256	EI	On-Demand	Anodyne	MTTP	87	37
NC(=O)CCc1nnc(SCCc2ccc(Cl)cc2)n1Cc1ccco1	ZINC000450776279	GG	On-Demand	Anodyne	AGTR1	16	43
NC(=O)CCc1nnc(SCCc2ccc(Cl)cc2)n1Cc1ccco1	ZINC000450776279	GG	On-Demand	Anodyne	HCRTR2	0	45
CN1CC[C@@H]2CN(c3ccc(S(C)(=O)=O)cc3F)C[C@@H]21	ZINC000450776280	CD	On-Demand	Anodyne	SLC6A9	26	45
CN1CC[C@@H]2CN(c3ccc(S(C)(=O)=O)cc3F)C[C@@H]21	ZINC000450776280	CD	On-Demand	Anodyne	GPR119	27	44
CCC(CC)Oc1ccc(C(=O)Nc2cccc(C(N)=O)c2OC)cc1	ZINC000450776286	FH	On-Demand	Anodyne	NR1H4	0	42
CCC(CC)Oc1ccc(C(=O)Nc2cccc(C(N)=O)c2OC)cc1	ZINC000450776286	FH	On-Demand	Anodyne	HDAC1	15	42
CCC(CC)Oc1ccc(C(=O)Nc2cccc(C(N)=O)c2OC)cc1	ZINC000450776286	FH	On-Demand	Anodyne	SIRT2	41	39
CCC(CC)Oc1ccc(C(=O)Nc2cccc(C(N)=O)c2OC)cc1	ZINC000450776286	FH	On-Demand	Anodyne	PAGA	0	48
CCC(CC)Oc1ccc(C(=O)Nc2cccc(C(N)=O)c2OC)cc1	ZINC000450776286	FH	On-Demand	Anodyne	KCNK3	40	32
C[C@H](O)CCN(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450776298	CD	On-Demand	Anodyne	SIGMAR1	24	40
C[C@@H](O)CCN(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450776299	CD	On-Demand	Anodyne	SIGMAR1	24	40
C[C@H](O)CCN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450776300	CD	On-Demand	Anodyne	SIGMAR1	24	40
C[C@H](O)CCN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450776300	CD	On-Demand	Anodyne	NPFFR1	48	36
C[C@@H](O)CCN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450776301	CD	On-Demand	Anodyne	SIGMAR1	24	40
C[C@@H](O)CCN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450776301	CD	On-Demand	Anodyne	NPFFR1	48	36
CC[C@@]1(CO)CCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450776305	FH	On-Demand	Anodyne	DRD4	0	41
CC[C@@]1(CO)CCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450776305	FH	On-Demand	Anodyne	SLC18A3	22	41
CC[C@@]1(CO)CCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450776305	FH	On-Demand	Anodyne	CYP2J2	53	38
CC[C@]1(CO)CCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450776306	FH	On-Demand	Anodyne	DRD4	0	41
CC[C@]1(CO)CCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450776306	FH	On-Demand	Anodyne	SLC18A3	22	41
CC[C@]1(CO)CCCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450776306	FH	On-Demand	Anodyne	CYP2J2	53	38
COc1cccc2c1CCN(C(=O)c1ccc(N3CCC3)nc1)C2	ZINC000450776323	DE	On-Demand	Anodyne	SSTR1	43	44
C=C(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450776340	CF	On-Demand	Mild	TRPV1	34	46
C=C(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450776340	CF	On-Demand	Mild	NCE103	32	50
C=C(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450776340	CF	On-Demand	Mild	P96878_MYCTU	19	50
C=C(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450776340	CF	On-Demand	Mild	CAN2	0	50
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1Cc2ccccc2C2(CC2)C1	ZINC000450776364	FH	On-Demand	Anodyne	GHRHR	83	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1Cc2ccccc2C2(CC2)C1	ZINC000450776364	FH	On-Demand	Anodyne	GHSR	19	43
CN1CC[C@@H]2CN(c3ncccc3C(=O)N3CCc4ccccc43)C[C@@H]21	ZINC000450776374	EE	On-Demand	Anodyne	AVPR2	70	41
CN1CC[C@@H]2CN(c3ncccc3C(=O)N3CCc4ccccc43)C[C@@H]21	ZINC000450776374	EE	On-Demand	Anodyne	AVPR1A	32	40
CO[C@H]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H]1C	ZINC000450776387	DG	On-Demand	Bother	PDE3B	40	36
CO[C@@H]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H]1C	ZINC000450776389	DG	On-Demand	Bother	PDE3B	40	36
CO[C@H]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H]1C	ZINC000450776391	DG	On-Demand	Bother	PDE3B	40	36
CO[C@@H]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H]1C	ZINC000450776393	DG	On-Demand	Bother	PDE3B	40	36
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450776407	FG	On-Demand	Anodyne	SLC6A1	93	36
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450776407	FG	On-Demand	Anodyne	SFRP1	46	33
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450776407	FG	On-Demand	Anodyne	WNT3	41	33
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450776408	FG	On-Demand	Anodyne	SLC6A1	93	36
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450776408	FG	On-Demand	Anodyne	SFRP1	46	33
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC000450776408	FG	On-Demand	Anodyne	WNT3	41	33
CCNC(=O)c1ccc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)nc1	ZINC000450776419	GD	On-Demand	Anodyne	HPGDS	15	40
CCNC(=O)c1ccc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)nc1	ZINC000450776420	GD	On-Demand	Anodyne	HPGDS	15	40
CC1(C(=O)N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)CCC(=O)CC1	ZINC000450776425	FJ	On-Demand	Anodyne	QDPR	0	41
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776441	GG	On-Demand	Anodyne	HTR1A	64	42
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776441	GG	On-Demand	Anodyne	ADRA1D	48	42
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776441	GG	On-Demand	Anodyne	ADRA1A	42	42
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776441	GG	On-Demand	Anodyne	ADRA1B	39	42
COc1cccc2c(N3CCC[C@@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776441	GG	On-Demand	Anodyne	HTR7	42	36
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776442	GG	On-Demand	Anodyne	HTR1A	64	42
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776442	GG	On-Demand	Anodyne	ADRA1D	48	42
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776442	GG	On-Demand	Anodyne	ADRA1A	42	42
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776442	GG	On-Demand	Anodyne	ADRA1B	39	42
COc1cccc2c(N3CCC[C@H](CN4CCCN(C(C)=O)CC4)C3)ccnc12	ZINC000450776442	GG	On-Demand	Anodyne	HTR7	42	36
CCc1cc2c(N3CC[C@H](OC)[C@@H](C)C3)ncnc2s1	ZINC000450776445	CG	On-Demand	Anodyne	PDE3A	49	38
CCc1cc2c(N3CC[C@H](OC)[C@@H](C)C3)ncnc2s1	ZINC000450776445	CG	On-Demand	Anodyne	PDE3B	72	38
CCc1cc2c(N3CC[C@@H](OC)[C@@H](C)C3)ncnc2s1	ZINC000450776446	CG	On-Demand	Anodyne	PDE3A	49	38
CCc1cc2c(N3CC[C@@H](OC)[C@@H](C)C3)ncnc2s1	ZINC000450776446	CG	On-Demand	Anodyne	PDE3B	72	38
CCc1cc2c(N3CC[C@H](OC)[C@H](C)C3)ncnc2s1	ZINC000450776447	CG	On-Demand	Anodyne	PDE3A	49	38
CCc1cc2c(N3CC[C@H](OC)[C@H](C)C3)ncnc2s1	ZINC000450776447	CG	On-Demand	Anodyne	PDE3B	72	38
CCc1cc2c(N3CC[C@@H](OC)[C@H](C)C3)ncnc2s1	ZINC000450776448	CG	On-Demand	Anodyne	PDE3A	49	38
CCc1cc2c(N3CC[C@@H](OC)[C@H](C)C3)ncnc2s1	ZINC000450776448	CG	On-Demand	Anodyne	PDE3B	72	38
CCOC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1C)[C@@H]1CCCOC1	ZINC000450776454	FG	On-Demand	Anodyne	CCR2	41	38
CCOC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1C)[C@@H]1CCCOC1	ZINC000450776455	FG	On-Demand	Anodyne	CCR2	41	38
CCOC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1C)[C@H]1CCCOC1	ZINC000450776456	FG	On-Demand	Anodyne	CCR2	41	38
CCOC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1C)[C@H]1CCCOC1	ZINC000450776457	FG	On-Demand	Anodyne	CCR2	41	38
NC(=O)c1cc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)ccn1	ZINC000450776461	EG	On-Demand	Anodyne	AKT2	23	40
CCOC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@@H]1CCCOC1	ZINC000450776462	GG	On-Demand	Anodyne	RBP4	64	36
CCOC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@H]1CCCOC1	ZINC000450776463	GG	On-Demand	Anodyne	RBP4	64	36
CCOC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@@H]1CCCOC1	ZINC000450776464	GG	On-Demand	Anodyne	RBP4	64	36
CCOC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@H]1CCCOC1	ZINC000450776465	GG	On-Demand	Anodyne	RBP4	64	36
CC1CCN(C(=O)c2ccc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc2)CC1	ZINC000450776476	EE	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc2)CC1	ZINC000450776476	EE	On-Demand	Anodyne	L3MBTL3	50	40
CC1CCN(C(=O)c2ccc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc2)CC1	ZINC000450776477	EE	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc2)CC1	ZINC000450776477	EE	On-Demand	Anodyne	L3MBTL3	50	40
CC1CCN(C(=O)c2ccc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc2)CC1	ZINC000450776478	EE	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc2)CC1	ZINC000450776478	EE	On-Demand	Anodyne	L3MBTL3	50	40
FC(F)(F)c1cnc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)s1	ZINC000450776500	CF	On-Demand	Anodyne	MLYCD	65	40
FC(F)(F)c1cnc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)s1	ZINC000450776501	CF	On-Demand	Anodyne	MLYCD	65	40
FC(F)(F)c1cnc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)s1	ZINC000450776502	CF	On-Demand	Anodyne	MLYCD	65	40
CC(C)OC(=O)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450776505	DF	On-Demand	Anodyne	ADORA1	44	41
CC(C)OC(=O)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450776505	DF	On-Demand	Anodyne	ADORA2A	22	45
CC(C)OC(=O)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450776505	DF	On-Demand	Anodyne	P2RY1	50	40
CC(C)OC(=O)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450776505	DF	On-Demand	Anodyne	ADCY5	28	42
CC(C)OC(=O)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450776505	DF	On-Demand	Anodyne	ADORA3	59	37
CC(C)OC(=O)[C@@H](Nc1ncnc2c1ncn2C1CC1)C(C)C	ZINC000450776505	DF	On-Demand	Anodyne	OXGR1	85	36
CC(C)OC(=O)[C@@H](Nc1nc2ccc([N+](=O)[O-])cc2[nH]1)C(C)C	ZINC000450776515	DF	On-Demand	Bother	CACNA1D	47	32
CC(C)OC(=O)[C@@H](Nc1nc2ccc([N+](=O)[O-])cc2[nH]1)C(C)C	ZINC000450776515	DF	On-Demand	Bother	GRB7	0	42
COC(=O)c1cccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)c1Cl	ZINC000450776529	GH	On-Demand	Anodyne	SIGMAR1	20	42
COC(=O)c1cccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)c1Cl	ZINC000450776529	GH	On-Demand	Anodyne	CCR3	29	43
O=C(c1cccnc1N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1)N1CCc2ccccc21	ZINC000450776553	FF	On-Demand	Anodyne	GPBAR1	17	43
O=C(c1cccnc1N1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1)N1CCc2ccccc21	ZINC000450776554	FF	On-Demand	Anodyne	GPBAR1	17	43
O=C(c1cccnc1N1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1)N1CCc2ccccc21	ZINC000450776555	FF	On-Demand	Anodyne	GPBAR1	17	43
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncnc4sc5c(c34)CCCC5)C[C@H]12	ZINC000450776567	EF	On-Demand	Anodyne	RBP4	18	45
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ncnc4sc5c(c34)CCCC5)C[C@H]21	ZINC000450776568	EF	On-Demand	Anodyne	RBP4	18	45
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncnc4sc5c(c34)CCCC5)C[C@@H]12	ZINC000450776569	EF	On-Demand	Anodyne	RBP4	18	45
O=C(c1cncc(Cl)c1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450776579	EI	On-Demand	Anodyne	PRCP	45	33
O=C(c1cncc(Cl)c1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450776579	EI	On-Demand	Anodyne	SLC9A1	34	41
O=C(c1cncc(Cl)c1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450776579	EI	On-Demand	Anodyne	RBP4	23	40
O=C(c1cncc(Cl)c1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450776579	EI	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1cncc(Cl)c1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450776579	EI	On-Demand	Anodyne	L3MBTL3	55	40
CNC(=O)c1cccnc1N[C@@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450776587	CE	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	42
CNC(=O)c1cccnc1N[C@@H](C(C)C)[C@H](CO)C(C)C	ZINC000450776588	CE	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	42
CNC(=O)c1cccnc1N[C@H](C(C)C)[C@@H](CO)C(C)C	ZINC000450776589	CE	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	42
CNC(=O)c1cccnc1N[C@H](C(C)C)[C@H](CO)C(C)C	ZINC000450776590	CE	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	42
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450776614	EE	On-Demand	Anodyne	CTSV	47	32
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450776615	EE	On-Demand	Anodyne	CTSV	47	32
Cc1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)nn1C(C)C	ZINC000450776634	EI	On-Demand	Anodyne	SLC9A1	15	40
CC(=O)c1cccc(CSc2nnc(N3CCCCC3)n2Cc2ccco2)c1	ZINC000450776660	GI	On-Demand	Anodyne	HCRTR2	20	49
CCOc1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)on1	ZINC000450776662	EG	On-Demand	Anodyne	ETHR	41	35
CCC1(CC)CCN(C(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450776664	EH	On-Demand	Anodyne	THYX_PBCV1	0	45
CC(C)c1nccc(N2C[C@@H]3CCN(C)[C@@H]3C2)n1	ZINC000450776673	BD	On-Demand	Anodyne	SORD	66	39
Cc1nc2ccccc2c(N2C[C@H]3CCN(C)[C@H]3C2)c1C	ZINC000450776677	CF	On-Demand	Anodyne	ADRA2A	0	45
Cc1nc2ccccc2c(N2C[C@H]3CCN(C)[C@H]3C2)c1C	ZINC000450776677	CF	On-Demand	Anodyne	ADRA2B	24	41
Cc1nc2ccccc2c(N2C[C@H]3CCN(C)[C@H]3C2)c1C	ZINC000450776677	CF	On-Demand	Anodyne	ADRA2C	22	45
COc1cccc2c1CCN(C(=O)C1(Cc3cccc(Cl)c3)CC1)C2	ZINC000450776714	FI	On-Demand	Anodyne	CPT2	21	43
COc1cc2nc(N3C[C@@H]4CCN(C)[C@@H]4C3)nc(N)c2cc1OC	ZINC000450776726	ED	On-Demand	Anodyne	ADRA1D	15	49
COc1cc2nc(N3C[C@@H]4CCN(C)[C@@H]4C3)nc(N)c2cc1OC	ZINC000450776726	ED	On-Demand	Anodyne	ADRA1B	44	51
COc1cc2nc(N3C[C@@H]4CCN(C)[C@@H]4C3)nc(N)c2cc1OC	ZINC000450776726	ED	On-Demand	Anodyne	PDE3A	46	35
COc1cc2nc(N3C[C@@H]4CCN(C)[C@@H]4C3)nc(N)c2cc1OC	ZINC000450776726	ED	On-Demand	Anodyne	CCR4	51	42
COc1cc2nc(N3C[C@@H]4CCN(C)[C@@H]4C3)nc(N)c2cc1OC	ZINC000450776726	ED	On-Demand	Anodyne	PDE3B	69	35
COc1cc2nc(N3C[C@@H]4CCN(C)[C@@H]4C3)nc(N)c2cc1OC	ZINC000450776726	ED	On-Demand	Anodyne	EHMT2	70	37
CO[C@H]1CCN(c2ncc(C(=O)N(C)C)cc2Cl)C[C@@H]1C	ZINC000450776752	DE	On-Demand	Anodyne	CXCR3	32	40
CO[C@@H]1CCN(c2ncc(C(=O)N(C)C)cc2Cl)C[C@@H]1C	ZINC000450776754	DE	On-Demand	Anodyne	CXCR3	32	40
CO[C@H]1CCN(c2ncc(C(=O)N(C)C)cc2Cl)C[C@H]1C	ZINC000450776755	DE	On-Demand	Anodyne	CXCR3	32	40
CO[C@@H]1CCN(c2ncc(C(=O)N(C)C)cc2Cl)C[C@H]1C	ZINC000450776756	DE	On-Demand	Anodyne	CXCR3	32	40
CCOC(=O)c1c(N2C[C@@H]3CCN(C)[C@@H]3C2)nc2ccccc2c1C	ZINC000450776769	EF	On-Demand	Anodyne	HTR3A	18	40
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450776801	EG	On-Demand	Anodyne	MMP13	0	45
CC(C)C[C@H]1OCCC[C@H]1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450776803	EG	On-Demand	Anodyne	MMP13	0	45
CC(C)C[C@H]1OCCC[C@@H]1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450776804	EG	On-Demand	Anodyne	MMP13	0	45
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450776805	EG	On-Demand	Anodyne	MMP13	0	45
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(-c4ccccc4)s3)C2)CC1	ZINC000450776817	GH	On-Demand	Anodyne	P2RY12	20	40
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(-c4ccccc4)s3)C2)CC1	ZINC000450776817	GH	On-Demand	Anodyne	LUCI_LUCLA	18	42
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(-c4ccccc4)s3)C2)CC1	ZINC000450776817	GH	On-Demand	Anodyne	MLYCD	41	33
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ncc(-c4ccccc4)s3)C2)CC1	ZINC000450776817	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	57	33
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(-c4ccccc4)s3)C2)CC1	ZINC000450776818	GH	On-Demand	Anodyne	P2RY12	20	40
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(-c4ccccc4)s3)C2)CC1	ZINC000450776818	GH	On-Demand	Anodyne	LUCI_LUCLA	18	42
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(-c4ccccc4)s3)C2)CC1	ZINC000450776818	GH	On-Demand	Anodyne	MLYCD	41	33
CC(=O)N1CCCN(C[C@H]2CCCN(c3ncc(-c4ccccc4)s3)C2)CC1	ZINC000450776818	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	57	33
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450776843	FE	On-Demand	Anodyne	ACE	38	42
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450776844	FE	On-Demand	Anodyne	ACE	38	42
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450776845	FE	On-Demand	Anodyne	ACE	38	42
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450776846	FE	On-Demand	Anodyne	ACE	38	42
CC(C)(O)CCNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450776847	DD	On-Demand	Anodyne	PDE4D	15	41
CC(C)(O)CCNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450776848	DD	On-Demand	Anodyne	PDE4D	15	41
CCOC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)nc1	ZINC000450776861	CE	On-Demand	Anodyne	ENPP2	17	40
CCOC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)nc1	ZINC000450776862	CE	On-Demand	Anodyne	ENPP2	17	40
CCOC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)nc1	ZINC000450776863	CE	On-Demand	Anodyne	ENPP2	17	40
CCOC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)nc1	ZINC000450776864	CE	On-Demand	Anodyne	ENPP2	17	40
CC(C)OC(=O)[C@@H](Nc1ncnc2cc(F)c(F)cc12)C(C)C	ZINC000450776877	DG	On-Demand	Anodyne	EGFR	25	40
Cc1ccc(C(=O)Nc2cccc(CCCO)c2)c2c1CCC2	ZINC000450776914	DH	On-Demand	Anodyne	NR1H4	0	40
Cc1ccc(C(=O)Nc2cccc(CCCO)c2)c2c1CCC2	ZINC000450776914	DH	On-Demand	Anodyne	KCNK3	86	41
Cc1ccc(C(=O)Nc2cccc(CCCO)c2)c2c1CCC2	ZINC000450776914	DH	On-Demand	Anodyne	KCNK9	79	39
OC[C@H](C1CC1)[C@H](Nc1ccnc2cc(F)ccc12)C1CC1	ZINC000450776926	DH	On-Demand	Anodyne	HNMT	40	31
OC[C@@H](C1CC1)[C@H](Nc1ccnc2cc(F)ccc12)C1CC1	ZINC000450776927	DH	On-Demand	Anodyne	HNMT	40	31
OC[C@H](C1CC1)[C@@H](Nc1ccnc2cc(F)ccc12)C1CC1	ZINC000450776928	DH	On-Demand	Anodyne	HNMT	40	31
OC[C@@H](C1CC1)[C@@H](Nc1ccnc2cc(F)ccc12)C1CC1	ZINC000450776929	DH	On-Demand	Anodyne	HNMT	40	31
O=[N+]([O-])c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)cc1	ZINC000450776952	CF	On-Demand	Bother	PGR	0	46
O=[N+]([O-])c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)cc1	ZINC000450776952	CF	On-Demand	Bother	AR	0	46
O=[N+]([O-])c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)cc1	ZINC000450776958	CF	On-Demand	Bother	PGR	0	46
O=[N+]([O-])c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)cc1	ZINC000450776958	CF	On-Demand	Bother	AR	0	46
O=[N+]([O-])c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)cc1	ZINC000450776959	CF	On-Demand	Bother	PGR	0	46
O=[N+]([O-])c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)cc1	ZINC000450776959	CF	On-Demand	Bother	AR	0	46
O=[N+]([O-])c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)cc1	ZINC000450776961	CF	On-Demand	Bother	PGR	0	46
O=[N+]([O-])c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)cc1	ZINC000450776961	CF	On-Demand	Bother	AR	0	46
CC1CCN(C(=O)c2ccc(N[C@H](C(C)C)[C@@H](CO)C(C)C)nc2)CC1	ZINC000450776996	FH	On-Demand	Anodyne	L3MBTL3	41	32
CC1CCN(C(=O)c2ccc(N[C@@H](C(C)C)[C@@H](CO)C(C)C)nc2)CC1	ZINC000450776997	FH	On-Demand	Anodyne	L3MBTL3	41	32
CC1CCN(C(=O)c2ccc(N[C@@H](C(C)C)[C@H](CO)C(C)C)nc2)CC1	ZINC000450776999	FH	On-Demand	Anodyne	L3MBTL3	41	32
CC1CCN(C(=O)c2ccc(N[C@H](C(C)C)[C@H](CO)C(C)C)nc2)CC1	ZINC000450777001	FH	On-Demand	Anodyne	L3MBTL3	41	32
CCOc1cc(C(=O)N2[C@@H](C)c3ccc(OC)cc3C[C@H]2C)on1	ZINC000450777022	EG	On-Demand	Anodyne	HCRTR2	0	40
CCOc1cc(C(=O)N2[C@@H](C)Cc3cc(OC)ccc3[C@H]2C)on1	ZINC000450777024	EG	On-Demand	Anodyne	HCRTR2	0	40
CCOc1cc(C(=O)N2[C@@H](C)Cc3cc(OC)ccc3[C@@H]2C)on1	ZINC000450777026	EG	On-Demand	Anodyne	HCRTR2	0	40
CCOc1cc(C(=O)N2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)on1	ZINC000450777029	EG	On-Demand	Anodyne	HCRTR2	0	40
CCc1cccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)n1	ZINC000450777036	FE	On-Demand	Anodyne	MLYCD	42	37
CCc1cccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)n1	ZINC000450777036	FE	On-Demand	Anodyne	SCD1	24	41
CCc1cccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)n1	ZINC000450777036	FE	On-Demand	Anodyne	SCD	23	41
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cccc(CCCO)c2)c1	ZINC000450777037	FH	On-Demand	Anodyne	MTNR1A	31	40
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cccc(CCCO)c2)c1	ZINC000450777037	FH	On-Demand	Anodyne	MTNR1B	24	40
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cccc(CCCO)c2)c1	ZINC000450777037	FH	On-Demand	Anodyne	KCNK3	66	54
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cccc(CCCO)c2)c1	ZINC000450777037	FH	On-Demand	Anodyne	KCNK9	68	54
Cc1cc(F)c(CC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cc1F	ZINC000450777039	FI	On-Demand	Anodyne	TACR1	15	45
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncccc3OCc3ccccc3)C[C@H]12	ZINC000450777040	DG	On-Demand	Anodyne	PPIA	43	33
Cc1cc(F)c(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)cc1F	ZINC000450777041	FI	On-Demand	Anodyne	TACR1	15	45
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ncccc3OCc3ccccc3)C[C@H]21	ZINC000450777043	DG	On-Demand	Anodyne	PPIA	43	33
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncccc3OCc3ccccc3)C[C@@H]12	ZINC000450777044	DG	On-Demand	Anodyne	PPIA	43	33
Cc1ccc(F)c(CC(=O)N2CC(NC(=O)C3CCC3)C2)c1	ZINC000450777051	DD	On-Demand	Anodyne	EPHX2	27	41
CN1CC[C@@H]2CN(c3cc(NCC4CC4)ncn3)C[C@@H]21	ZINC000450777076	CD	On-Demand	Anodyne	GPR39	0	42
OC1(C(F)F)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450777097	CF	On-Demand	Anodyne	DRD4	0	52
OC1(C(F)F)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450777097	CF	On-Demand	Anodyne	SIGMAR1	28	45
OC1(C(F)F)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450777097	CF	On-Demand	Anodyne	CCR1	52	42
OC1(C(F)F)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450777097	CF	On-Demand	Anodyne	US28	0	42
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450777129	GG	On-Demand	Anodyne	CCKAR	43	33
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450777137	GG	On-Demand	Anodyne	CCKAR	43	33
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450777139	GG	On-Demand	Anodyne	CCKAR	43	33
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450777141	GG	On-Demand	Anodyne	CCKAR	43	33
CC(=O)N1CCN(C(=O)C2CCN(c3nc(-c4ccc(C)cc4)no3)CC2)CC1	ZINC000450777143	GD	On-Demand	Anodyne	GRM5	15	45
COc1cccc(Oc2ccc(C(=O)NCCC(C)(C)O)nc2)c1	ZINC000450777144	EF	On-Demand	Anodyne	DRD4	46	35
COc1cccc(Oc2ccc(C(=O)NCCC(C)(C)O)nc2)c1	ZINC000450777144	EF	On-Demand	Anodyne	RAF1	39	40
COc1cccc(Oc2ccc(C(=O)NCCC(C)(C)O)nc2)c1	ZINC000450777144	EF	On-Demand	Anodyne	MTNR1A	59	43
COc1cccc(Oc2ccc(C(=O)NCCC(C)(C)O)nc2)c1	ZINC000450777144	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	60	40
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc([N+](=O)[O-])c(C)c3)C2)CC1	ZINC000450777151	FF	On-Demand	Bother	SSTR3	27	41
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc([N+](=O)[O-])c(C)c3)C2)CC1	ZINC000450777153	FF	On-Demand	Bother	SSTR3	27	41
C[C@@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)C(=O)C1CCCCC1	ZINC000450777159	GG	On-Demand	Anodyne	ITK	18	42
C[C@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)C(=O)C1CCCCC1	ZINC000450777160	GG	On-Demand	Anodyne	ITK	18	42
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@@H](CO)C1CCOCC1	ZINC000450777161	FD	On-Demand	Anodyne	EPHX2	16	44
O=C(CNC(=O)Nc1cccc(Cl)c1)N[C@H](CO)C1CCOCC1	ZINC000450777162	FD	On-Demand	Anodyne	EPHX2	16	44
CCCOc1ccc(C(=O)Nc2cccc(C(N)=O)c2OC)c(OC)c1	ZINC000450777167	FF	On-Demand	Anodyne	SIRT2	40	38
CCCOc1ccc(C(=O)Nc2cccc(C(N)=O)c2OC)c(OC)c1	ZINC000450777167	FF	On-Demand	Anodyne	KCNK3	47	42
CCCOc1ccc(C(=O)Nc2cccc(C(N)=O)c2OC)c(OC)c1	ZINC000450777167	FF	On-Demand	Anodyne	KCNK9	36	42
O=C(CNC(=O)Nc1cccc(Cl)c1)Nc1cnc2c(c1)CCCC2	ZINC000450777175	FG	On-Demand	Anodyne	PPIA	23	41
CO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450777181	FE	On-Demand	Anodyne	HSD11B1	21	45
CO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450777181	FE	On-Demand	Anodyne	LIPG	40	32
C[C@H]1CN(Cc2ccccc2OC2CC2)CCN1CCO	ZINC000450777182	CD	On-Demand	Anodyne	SLC5A4	44	31
C[C@@H]1CN(Cc2ccccc2OC2CC2)CCN1CCO	ZINC000450777183	CD	On-Demand	Anodyne	SLC5A4	44	31
Cc1nc(-c2ccccn2)nc(N2C[C@H]3CCN(C)[C@H]3C2)c1C	ZINC000450777184	DE	On-Demand	Anodyne	METAP1	29	40
CO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450777185	FE	On-Demand	Anodyne	HSD11B1	21	45
CO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1C	ZINC000450777185	FE	On-Demand	Anodyne	LIPG	40	32
CO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450777187	FE	On-Demand	Anodyne	HSD11B1	21	45
CO[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450777187	FE	On-Demand	Anodyne	LIPG	40	32
CO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450777189	FE	On-Demand	Anodyne	HSD11B1	21	45
CO[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H]1C	ZINC000450777189	FE	On-Demand	Anodyne	LIPG	40	32
COc1ccc(Cn2nnnc2SCCN(C)Cc2ccccc2)cc1	ZINC000450777192	FF	On-Demand	Anodyne	NPBWR1	29	40
C[C@H](c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1)C(F)(F)F	ZINC000450777194	GJ	On-Demand	Anodyne	ETHR	54	41
C[C@@H](c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1)C(F)(F)F	ZINC000450777196	GJ	On-Demand	Anodyne	ETHR	54	41
CC(=O)c1ccc(CN2CCN(c3cccc(F)c3)C(=O)C2)cc1	ZINC000450777251	EF	On-Demand	Anodyne	NOD2	40	36
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc([N+](=O)[O-])nc3)C2)CC1	ZINC000450777259	FD	On-Demand	Bother	SSTR3	29	43
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc([N+](=O)[O-])nc3)C2)CC1	ZINC000450777260	FD	On-Demand	Bother	SSTR3	29	43
COc1cc(CN2CCN([C@H](C)c3nccs3)CC2)ccc1Cl	ZINC000450777263	FH	On-Demand	Anodyne	SSTR5	41	36
COc1cc(CN2CCN([C@@H](C)c3nccs3)CC2)ccc1Cl	ZINC000450777264	FH	On-Demand	Anodyne	SSTR5	41	36
Cc1sccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450777272	CG	On-Demand	Anodyne	KCNK3	85	38
Cc1nc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)ncc1[N+](=O)[O-]	ZINC000450777273	CD	On-Demand	Bother	PRKCQ	45	39
Cc1nc(N[C@H](C2CC2)[C@H](CO)C2CC2)ncc1[N+](=O)[O-]	ZINC000450777274	CD	On-Demand	Bother	PRKCQ	45	39
Cc1nc(N[C@H](C2CC2)[C@@H](CO)C2CC2)ncc1[N+](=O)[O-]	ZINC000450777275	CD	On-Demand	Bother	PRKCQ	45	39
Cc1nc(N[C@@H](C2CC2)[C@H](CO)C2CC2)ncc1[N+](=O)[O-]	ZINC000450777276	CD	On-Demand	Bother	PRKCQ	45	39
O=C(Nc1cccc(CCCO)c1)c1cccc2c1CCCC2	ZINC000450777322	DH	On-Demand	Anodyne	ALOX15	0	42
O=C(Nc1cccc(CCCO)c1)c1cccc2c1CCCC2	ZINC000450777322	DH	On-Demand	Anodyne	KCNK3	53	35
O=C(Nc1cccc(CCCO)c1)c1cccc2c1CCCC2	ZINC000450777322	DH	On-Demand	Anodyne	KCNK9	72	37
Oc1cc2c(nn1)CCN(CC/C=C/c1ccccc1)C2	ZINC000450777323	CF	On-Demand	Anodyne	SLC6A5	25	41
Oc1cc2c(nn1)CCN(CC/C=C\c1ccccc1)C2	ZINC000450777324	CF	On-Demand	Anodyne	SLC6A5	25	41
C[C@H](C(=O)NC(C)(C)C)N(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450777350	FH	On-Demand	Anodyne	GPR88	0	43
C[C@@H](C(=O)NC(C)(C)C)N(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450777351	FH	On-Demand	Anodyne	GPR88	0	43
CC(=O)c1ccc(CN2CCO[C@H](c3ccc(F)c(Br)c3)C2)cc1	ZINC000450777374	GI	On-Demand	Anodyne	DRD4	20	41
CC(=O)c1ccc(CN2CCO[C@@H](c3ccc(F)c(Br)c3)C2)cc1	ZINC000450777375	GI	On-Demand	Anodyne	DRD4	20	41
CCCCNc1cc(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)nc(N)n1	ZINC000450777403	DB	On-Demand	Anodyne	HRH4	49	51
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cnn(-c3ccncc3)c1)[C@H]2C	ZINC000450777419	FG	On-Demand	Anodyne	HCRTR2	27	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cnn(-c3ccncc3)c1)[C@H]2C	ZINC000450777420	FG	On-Demand	Anodyne	HCRTR2	27	41
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cnn(-c3ccncc3)c1)[C@@H]2C	ZINC000450777422	FG	On-Demand	Anodyne	HCRTR2	27	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cnn(-c3ccncc3)c1)[C@@H]2C	ZINC000450777423	FG	On-Demand	Anodyne	HCRTR2	27	41
O=C(c1cc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450777424	FE	On-Demand	Bother	L3MBTL3	15	41
O=C(c1cc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450777426	FE	On-Demand	Bother	L3MBTL3	15	41
O=C(c1cc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450777428	FE	On-Demand	Bother	L3MBTL3	15	41
O=C(NC1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777431	FG	On-Demand	Anodyne	MC4R	41	38
O=C(NC1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777431	FG	On-Demand	Anodyne	PRCP	47	37
O=C(NC1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777431	FG	On-Demand	Anodyne	MC3R	40	41
O=C(NC1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777431	FG	On-Demand	Anodyne	MC5R	28	41
O=C(NC1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777433	FG	On-Demand	Anodyne	MC4R	41	38
O=C(NC1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777433	FG	On-Demand	Anodyne	PRCP	47	37
O=C(NC1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777433	FG	On-Demand	Anodyne	MC3R	40	41
O=C(NC1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777433	FG	On-Demand	Anodyne	MC5R	28	41
O=C(NC1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777435	FG	On-Demand	Anodyne	MC4R	41	38
O=C(NC1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777435	FG	On-Demand	Anodyne	PRCP	47	37
O=C(NC1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777435	FG	On-Demand	Anodyne	MC3R	40	41
O=C(NC1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777435	FG	On-Demand	Anodyne	MC5R	28	41
O=C(NC1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777437	FG	On-Demand	Anodyne	MC4R	41	38
O=C(NC1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777437	FG	On-Demand	Anodyne	PRCP	47	37
O=C(NC1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777437	FG	On-Demand	Anodyne	MC3R	40	41
O=C(NC1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CCC1	ZINC000450777437	FG	On-Demand	Anodyne	MC5R	28	41
CC(=O)N[C@@H](C)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450777459	FI	On-Demand	Anodyne	SIGMAR1	36	44
CC(=O)N[C@@H](C)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450777459	FI	On-Demand	Anodyne	MCHR1	37	41
CC(=O)N[C@@H](C)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450777459	FI	On-Demand	Anodyne	CACNA1G	40	41
CC(=O)N[C@@H](C)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450777462	FI	On-Demand	Anodyne	SIGMAR1	36	44
CC(=O)N[C@@H](C)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450777462	FI	On-Demand	Anodyne	MCHR1	37	41
CC(=O)N[C@@H](C)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450777462	FI	On-Demand	Anodyne	CACNA1G	40	41
CC(=O)N[C@H](C)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450777463	FI	On-Demand	Anodyne	SIGMAR1	36	44
CC(=O)N[C@H](C)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450777463	FI	On-Demand	Anodyne	MCHR1	37	41
CC(=O)N[C@H](C)C1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450777463	FI	On-Demand	Anodyne	CACNA1G	40	41
CC(=O)N[C@H](C)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450777464	FI	On-Demand	Anodyne	SIGMAR1	36	44
CC(=O)N[C@H](C)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450777464	FI	On-Demand	Anodyne	MCHR1	37	41
CC(=O)N[C@H](C)C1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450777464	FI	On-Demand	Anodyne	CACNA1G	40	41
O=C1NC(=O)[C@H]2CN(c3ncnc4ccc(I)cc34)C[C@@H]12	ZINC000450777487	GC	On-Demand	Anodyne	PDE3B	57	31
Cc1nccc(N2C[C@H]3CCN(C)[C@H]3C2)n1	ZINC000450777527	BC	On-Demand	Anodyne	SORD	59	37
O=C(c1cc2c([nH]1)CCCC2)N1CCC[C@H](OCC2CC2)C1	ZINC000450777532	DF	On-Demand	Anodyne	AKR1C3	0	41
O=C(c1cc2c([nH]1)CCCC2)N1CCC[C@@H](OCC2CC2)C1	ZINC000450777533	DF	On-Demand	Anodyne	AKR1C3	0	41
O=C(CCCC(=O)N1CCC[C@H](OCC2CC2)C1)C1CC1	ZINC000450777541	CF	On-Demand	Anodyne	PREP	21	45
O=C(CCCC(=O)N1CCC[C@@H](OCC2CC2)C1)C1CC1	ZINC000450777542	CF	On-Demand	Anodyne	PREP	21	45
O=C1NC(=O)[C@H]2CN(c3cnn(Cc4ccccc4)c(=O)c3Cl)C[C@@H]12	ZINC000450777548	FC	On-Demand	Anodyne	NPBWR1	22	40
COc1c(NC(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)cccc1C(N)=O	ZINC000450777552	GF	On-Demand	Anodyne	NR1H4	15	45
COc1c(NC(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)cccc1C(N)=O	ZINC000450777552	GF	On-Demand	Anodyne	PAGA	0	41
CC(=O)CCCCCN1C(=O)N[C@@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450777592	FH	On-Demand	Anodyne	DNAE	54	32
CC(=O)CCCCCN1C(=O)N[C@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450777593	FH	On-Demand	Anodyne	DNAE	54	32
CC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450777626	EH	On-Demand	Anodyne	ACHE	19	43
CC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450777626	EH	On-Demand	Anodyne	MCHR1	23	40
CC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450777626	EH	On-Demand	Anodyne	SMO	51	33
CC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450777626	EH	On-Demand	Anodyne	ETHR	64	43
C/C=C\COc1cccc(CC(=O)N[C@H](C(=O)OCC)[C@H]2CCCOC2)c1	ZINC000450777638	GF	On-Demand	Anodyne	FAAH	19	40
C/C=C/COc1cccc(CC(=O)N[C@H](C(=O)OCC)[C@H]2CCCOC2)c1	ZINC000450777639	GF	On-Demand	Anodyne	FAAH	19	40
C/C=C/COc1cccc(CC(=O)N[C@H](C(=O)OCC)[C@@H]2CCCOC2)c1	ZINC000450777640	GF	On-Demand	Anodyne	FAAH	19	40
C/C=C\COc1cccc(CC(=O)N[C@H](C(=O)OCC)[C@@H]2CCCOC2)c1	ZINC000450777641	GF	On-Demand	Anodyne	FAAH	19	40
COC(=O)c1cccc(CN2CCC(c3noc(C4CC4)n3)CC2)c1Cl	ZINC000450777642	GH	On-Demand	Anodyne	SMO	44	33
COC(=O)c1cccc(CN2CCC(c3noc(C4CC4)n3)CC2)c1Cl	ZINC000450777642	GH	On-Demand	Anodyne	ETHR	58	37
CCCN(CCc1cccs1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450777656	FH	On-Demand	Anodyne	RORC	17	49
COC(=O)c1csc(CN(CC(C)C)[C@H]2CCCc3cccnc32)n1	ZINC000450777667	FH	On-Demand	Anodyne	CXCR4	83	47
COC(=O)c1csc(CN(CC(C)C)[C@@H]2CCCc3cccnc32)n1	ZINC000450777668	FH	On-Demand	Anodyne	CXCR4	83	47
CC(C)[C@H](Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F)[C@H](CO)C(C)C	ZINC000450777681	GG	On-Demand	Anodyne	CA2	40	41
CC(C)[C@H](Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F)[C@H](CO)C(C)C	ZINC000450777681	GG	On-Demand	Anodyne	CA4	41	38
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F)C(C)C	ZINC000450777682	GG	On-Demand	Anodyne	CA2	40	41
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F)C(C)C	ZINC000450777682	GG	On-Demand	Anodyne	CA4	41	38
CC(C)[C@H](CO)[C@H](Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F)C(C)C	ZINC000450777683	GG	On-Demand	Anodyne	CA2	40	41
CC(C)[C@H](CO)[C@H](Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F)C(C)C	ZINC000450777683	GG	On-Demand	Anodyne	CA4	41	38
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F)C(C)C	ZINC000450777684	GG	On-Demand	Anodyne	CA2	40	41
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F)C(C)C	ZINC000450777684	GG	On-Demand	Anodyne	CA4	41	38
Cc1ccnc(-c2noc(CSc3nnc(N4CCOCC4)n3C3CC3)n2)c1	ZINC000450777685	GE	On-Demand	Anodyne	TNKS2	15	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	MME	33	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	ANPEP	47	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	FCER2	45	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	CTSB	50	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	CTSK	67	52
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	CTSL	50	52
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	CAPNS1	58	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	MMP2	17	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	MMP3	37	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	CTSS	48	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	CAPN1	85	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	MMP9	17	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	CAPN2	112	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	MMP1	27	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	FPR1	73	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450777696	GI	On-Demand	Anodyne	NPR	77	38
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	MME	33	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	ANPEP	47	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	FCER2	45	32
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	CTSB	50	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	CTSK	67	52
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	CTSL	50	52
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	CAPNS1	58	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	MMP2	17	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	MMP3	37	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	CTSS	48	47
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	CAPN1	85	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	MMP9	17	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	CAPN2	112	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	MMP1	27	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	FPR1	73	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450777697	GI	On-Demand	Anodyne	NPR	77	38
COc1cc(OC)c(Cn2nccc2NC(=O)Cc2cn(C)nc2C)c(OC)c1	ZINC000450777722	GE	On-Demand	Anodyne	PDGFRB	32	45
COc1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)c([N+](=O)[O-])cc1F	ZINC000450777732	GI	On-Demand	Bother	L3MBTL1	0	43
COc1cc(C(=O)N2CCC(c3c(F)cccc3F)CC2)c([N+](=O)[O-])cc1F	ZINC000450777732	GI	On-Demand	Bother	L3MBTL3	19	43
C[C@H](CN1CCC(c2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450777735	DF	On-Demand	Anodyne	SLC6A1	43	36
C[C@H](CN1CCC(c2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450777735	DF	On-Demand	Anodyne	CCR1	47	43
C[C@@H](CN1CCC(c2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450777736	DF	On-Demand	Anodyne	SLC6A1	43	36
C[C@@H](CN1CCC(c2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450777736	DF	On-Demand	Anodyne	CCR1	47	43
CC(C)CN(CC[C@@H](C)O)[C@@H]1CCCc2cccnc21	ZINC000450777743	CG	On-Demand	Anodyne	CXCR4	93	51
CC(C)CN(CC[C@H](C)O)[C@@H]1CCCc2cccnc21	ZINC000450777744	CG	On-Demand	Anodyne	CXCR4	93	51
CC(C)CN(CC[C@H](C)O)[C@H]1CCCc2cccnc21	ZINC000450777745	CG	On-Demand	Anodyne	CXCR4	93	51
CC(C)CN(CC[C@@H](C)O)[C@H]1CCCc2cccnc21	ZINC000450777746	CG	On-Demand	Anodyne	CXCR4	93	51
NC(=O)c1ccc(CCC(=O)N2CCC(c3c(F)cccc3F)CC2)cc1	ZINC000450777759	FG	On-Demand	Anodyne	ETHR	58	36
COc1cccc2c1CCN(C(=O)[C@@]1(C)CCC[C@H]1C)C2	ZINC000450777775	CG	On-Demand	Anodyne	SSTR2	42	38
COc1cccc2c1CCN(C(=O)[C@@]1(C)CCC[C@H]1C)C2	ZINC000450777775	CG	On-Demand	Anodyne	SSTR1	46	34
COc1cccc2c1CCN(C(=O)[C@]1(C)CCC[C@H]1C)C2	ZINC000450777776	CG	On-Demand	Anodyne	SSTR2	42	38
COc1cccc2c1CCN(C(=O)[C@]1(C)CCC[C@H]1C)C2	ZINC000450777776	CG	On-Demand	Anodyne	SSTR1	46	34
COc1cccc2c1CCN(C(=O)[C@]1(C)CCC[C@@H]1C)C2	ZINC000450777777	CG	On-Demand	Anodyne	SSTR2	42	38
COc1cccc2c1CCN(C(=O)[C@]1(C)CCC[C@@H]1C)C2	ZINC000450777777	CG	On-Demand	Anodyne	SSTR1	46	34
COc1cccc2c1CCN(C(=O)[C@@]1(C)CCC[C@@H]1C)C2	ZINC000450777778	CG	On-Demand	Anodyne	SSTR2	42	38
COc1cccc2c1CCN(C(=O)[C@@]1(C)CCC[C@@H]1C)C2	ZINC000450777778	CG	On-Demand	Anodyne	SSTR1	46	34
CN(C)c1nccc(N2C[C@@H]3CCN(C)[C@@H]3C2)n1	ZINC000450777780	BC	On-Demand	Anodyne	SORD	52	38
COc1cc(CC(=O)N2CCC[C@H](OCC3CC3)C2)ccc1Cl	ZINC000450777782	EG	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CCC[C@H](OCC3CC3)C2)ccc1Cl	ZINC000450777782	EG	On-Demand	Anodyne	OPRK1	42	42
COc1cc(CC(=O)N2CCC[C@H](OCC3CC3)C2)ccc1Cl	ZINC000450777782	EG	On-Demand	Anodyne	HTR4	42	36
COc1cc(CC(=O)N2CCC[C@@H](OCC3CC3)C2)ccc1Cl	ZINC000450777783	EG	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CCC[C@@H](OCC3CC3)C2)ccc1Cl	ZINC000450777783	EG	On-Demand	Anodyne	OPRK1	42	42
COc1cc(CC(=O)N2CCC[C@@H](OCC3CC3)C2)ccc1Cl	ZINC000450777783	EG	On-Demand	Anodyne	HTR4	42	36
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@H](OCC3CC3)C2)n1	ZINC000450777797	EG	On-Demand	Anodyne	HCRTR1	23	40
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@H](OCC3CC3)C2)n1	ZINC000450777797	EG	On-Demand	Anodyne	HCRTR2	22	40
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@@H](OCC3CC3)C2)n1	ZINC000450777798	EG	On-Demand	Anodyne	HCRTR1	23	40
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@@H](OCC3CC3)C2)n1	ZINC000450777798	EG	On-Demand	Anodyne	HCRTR2	22	40
COc1cc2nc(N3C[C@H]4C(=O)NC(=O)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777803	EB	On-Demand	Anodyne	ADRA1D	18	49
COc1cc2nc(N3C[C@H]4C(=O)NC(=O)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777803	EB	On-Demand	Anodyne	ADRA1B	46	51
COc1cc2nc(N3C[C@H]4C(=O)NC(=O)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777803	EB	On-Demand	Anodyne	PDE3A	43	32
COc1cc2nc(N3C[C@H]4C(=O)NC(=O)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777803	EB	On-Demand	Anodyne	PDE3B	63	32
COc1cc2nc(N3C[C@H]4C(=O)NC(=O)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777803	EB	On-Demand	Anodyne	EHMT2	59	34
CC(=O)c1ccc(CN2CCC(O)(C(F)F)CC2)cc1	ZINC000450777804	CE	On-Demand	Anodyne	NPFFR1	43	36
CN1CC[C@@H]2CN(c3ccc(C#N)nc3)C[C@@H]21	ZINC000450777807	BD	On-Demand	Mild	CHRNA3	42	33
CN1CC[C@@H]2CN(c3ccc(C#N)nc3)C[C@@H]21	ZINC000450777807	BD	On-Demand	Mild	CHRNA4	31	41
CC[C@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777844	CF	On-Demand	Anodyne	DRD2	38	58
CC[C@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777844	CF	On-Demand	Anodyne	DRD1	0	58
CC[C@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777844	CF	On-Demand	Anodyne	DRD4	25	62
CC[C@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777844	CF	On-Demand	Anodyne	ERG2	27	58
CC[C@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777844	CF	On-Demand	Anodyne	SLC18A3	24	59
CC[C@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777844	CF	On-Demand	Anodyne	EBP	24	58
CC[C@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777844	CF	On-Demand	Anodyne	CYP2J2	57	40
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777845	CF	On-Demand	Anodyne	DRD2	38	58
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777845	CF	On-Demand	Anodyne	DRD1	0	58
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777845	CF	On-Demand	Anodyne	DRD4	25	62
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777845	CF	On-Demand	Anodyne	ERG2	27	58
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777845	CF	On-Demand	Anodyne	SLC18A3	24	59
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777845	CF	On-Demand	Anodyne	EBP	24	58
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450777845	CF	On-Demand	Anodyne	CYP2J2	57	40
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(Br)cc1	ZINC000450777851	GH	On-Demand	Anodyne	DRD2	33	52
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(Br)cc1	ZINC000450777851	GH	On-Demand	Anodyne	DRD1	17	45
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(Br)cc1	ZINC000450777851	GH	On-Demand	Anodyne	DRD4	22	52
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(Br)cc1	ZINC000450777851	GH	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(Br)cc1	ZINC000450777851	GH	On-Demand	Anodyne	HDAC8	18	40
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(Br)cc1	ZINC000450777851	GH	On-Demand	Anodyne	SLC18A3	33	48
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(Br)cc1	ZINC000450777851	GH	On-Demand	Anodyne	CYP2J2	54	38
COc1cc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777862	ED	On-Demand	Anodyne	ADRA1D	18	50
COc1cc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777862	ED	On-Demand	Anodyne	ADRA1A	15	55
COc1cc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777862	ED	On-Demand	Anodyne	ADRA1B	44	55
COc1cc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777862	ED	On-Demand	Anodyne	PDE3A	46	35
COc1cc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777862	ED	On-Demand	Anodyne	CCR4	43	40
COc1cc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777862	ED	On-Demand	Anodyne	PDPK1	35	41
COc1cc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777862	ED	On-Demand	Anodyne	PDE3B	68	35
COc1cc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777862	ED	On-Demand	Anodyne	EHMT2	82	42
COc1cc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc(N)c2cc1OC	ZINC000450777873	ED	On-Demand	Anodyne	ADRA1D	18	50
COc1cc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc(N)c2cc1OC	ZINC000450777873	ED	On-Demand	Anodyne	ADRA1A	15	55
COc1cc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc(N)c2cc1OC	ZINC000450777873	ED	On-Demand	Anodyne	ADRA1B	44	55
COc1cc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc(N)c2cc1OC	ZINC000450777873	ED	On-Demand	Anodyne	PDE3A	46	35
COc1cc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc(N)c2cc1OC	ZINC000450777873	ED	On-Demand	Anodyne	CCR4	43	40
COc1cc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc(N)c2cc1OC	ZINC000450777873	ED	On-Demand	Anodyne	PDPK1	35	41
COc1cc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc(N)c2cc1OC	ZINC000450777873	ED	On-Demand	Anodyne	PDE3B	68	35
COc1cc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nc(N)c2cc1OC	ZINC000450777873	ED	On-Demand	Anodyne	EHMT2	82	42
COc1cc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777874	ED	On-Demand	Anodyne	ADRA1D	18	50
COc1cc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777874	ED	On-Demand	Anodyne	ADRA1A	15	55
COc1cc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777874	ED	On-Demand	Anodyne	ADRA1B	44	55
COc1cc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777874	ED	On-Demand	Anodyne	PDE3A	46	35
COc1cc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777874	ED	On-Demand	Anodyne	CCR4	43	40
COc1cc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777874	ED	On-Demand	Anodyne	PDPK1	35	41
COc1cc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777874	ED	On-Demand	Anodyne	PDE3B	68	35
COc1cc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nc(N)c2cc1OC	ZINC000450777874	ED	On-Demand	Anodyne	EHMT2	82	42
C[C@@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)C1CCCCC1	ZINC000450777878	GH	On-Demand	Anodyne	ITK	20	42
C[C@H](Sc1nnc(-c2cccs2)n1CCC(N)=O)C(=O)C1CCCCC1	ZINC000450777879	GH	On-Demand	Anodyne	ITK	20	42
O=C1CCC[C@@H]1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450777899	GG	On-Demand	Anodyne	RBP4	74	36
O=C1CCC[C@H]1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450777900	GG	On-Demand	Anodyne	RBP4	74	36
O=C1CCC[C@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450777901	GG	On-Demand	Anodyne	RBP4	74	36
CCN(C)C(=O)CNC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450777917	FD	On-Demand	Anodyne	TACR3	59	32
CCN(C)C(=O)CNC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450777922	FD	On-Demand	Anodyne	TACR3	59	32
COc1cc(CC(=O)N2CCO[C@H](COCC3CC3)C2)ccc1O	ZINC000450777923	ED	On-Demand	Anodyne	RORC	49	36
COc1cc(CC(=O)N2CCO[C@@H](COCC3CC3)C2)ccc1O	ZINC000450777924	ED	On-Demand	Anodyne	RORC	49	36
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)CC1	ZINC000450777925	GD	On-Demand	Bother	SSTR2	23	41
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)CC1	ZINC000450777925	GD	On-Demand	Bother	SSTR1	41	37
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450777933	FE	On-Demand	Anodyne	OPRK1	37	45
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450777933	FE	On-Demand	Anodyne	ITGA4	28	40
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450777934	FE	On-Demand	Anodyne	OPRK1	37	45
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450777934	FE	On-Demand	Anodyne	ITGA4	28	40
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450777936	FE	On-Demand	Anodyne	OPRK1	37	45
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450777936	FE	On-Demand	Anodyne	ITGA4	28	40
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450777938	FE	On-Demand	Anodyne	OPRK1	37	45
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450777938	FE	On-Demand	Anodyne	ITGA4	28	40
CNC(=O)c1cccnc1N1CCC(F)(Cc2ccc(Cl)cc2)CC1	ZINC000450777985	FH	On-Demand	Anodyne	AKT3	41	37
CNC(=O)c1cccnc1N1CCC(F)(Cc2ccc(Cl)cc2)CC1	ZINC000450777985	FH	On-Demand	Anodyne	G2YM83_BOTF4	57	31
O=C(c1cccnc1N[C@@H](C1CC1)[C@H](CO)C1CC1)N1CCc2ccccc21	ZINC000450777998	GG	On-Demand	Anodyne	AVPR2	60	36
O=C(c1cccnc1N[C@@H](C1CC1)[C@@H](CO)C1CC1)N1CCc2ccccc21	ZINC000450778000	GG	On-Demand	Anodyne	AVPR2	60	36
O=C(c1cccnc1N[C@H](C1CC1)[C@@H](CO)C1CC1)N1CCc2ccccc21	ZINC000450778002	GG	On-Demand	Anodyne	AVPR2	60	36
CO[C@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@H]1C	ZINC000450778003	FG	On-Demand	Anodyne	AVPR2	46	40
O=C(c1cccnc1N[C@H](C1CC1)[C@H](CO)C1CC1)N1CCc2ccccc21	ZINC000450778004	GG	On-Demand	Anodyne	AVPR2	60	36
CO[C@@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@H]1C	ZINC000450778005	FG	On-Demand	Anodyne	AVPR2	46	40
CO[C@@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@@H]1C	ZINC000450778007	FG	On-Demand	Anodyne	AVPR2	46	40
CO[C@H]1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@@H]1C	ZINC000450778008	FG	On-Demand	Anodyne	AVPR2	46	40
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	HTR1A	15	50
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	DRD2	31	43
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	DRD4	17	47
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	HTR2A	29	48
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	HTR2C	22	50
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	SLC6A1	110	38
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	ERG2	19	43
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	HTR7	15	43
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	SIGMAR1	15	54
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	CCR3	71	41
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	SLC18A3	0	42
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	HTR3B	0	46
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	CYP2J2	51	36
CC(C)OC(=O)C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778022	EH	On-Demand	Anodyne	AP2S1	0	43
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	HTR1A	15	50
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	DRD2	31	43
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	DRD4	17	47
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	HTR2A	29	48
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	HTR2C	22	50
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	SLC6A1	110	38
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	ERG2	19	43
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	HTR7	15	43
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	SIGMAR1	15	54
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	CCR3	71	41
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	SLC18A3	0	42
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	HTR3B	0	46
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	CYP2J2	51	36
CC(C)OC(=O)C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450778023	EH	On-Demand	Anodyne	AP2S1	0	43
OC[C@H](C1CC1)[C@@H](Nc1cc(N2CCCC2)ncn1)C1CC1	ZINC000450778033	DE	On-Demand	Anodyne	PRCP	15	44
OC[C@H](C1CC1)[C@H](Nc1cc(N2CCCC2)ncn1)C1CC1	ZINC000450778034	DE	On-Demand	Anodyne	PRCP	15	44
OC[C@@H](C1CC1)[C@H](Nc1cc(N2CCCC2)ncn1)C1CC1	ZINC000450778035	DE	On-Demand	Anodyne	PRCP	15	44
OC[C@@H](C1CC1)[C@@H](Nc1cc(N2CCCC2)ncn1)C1CC1	ZINC000450778036	DE	On-Demand	Anodyne	PRCP	15	44
C[C@@]1(c2ccc(Cl)c(Cl)c2)NC(=O)N(CC2(C#N)CCC2)C1=O	ZINC000450778051	FG	On-Demand	Mild	SLC6A3	0	41
C[C@]1(c2ccc(Cl)c(Cl)c2)NC(=O)N(CC2(C#N)CCC2)C1=O	ZINC000450778052	FG	On-Demand	Mild	SLC6A3	0	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450778105	FI	On-Demand	Anodyne	HRH4	19	42
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450778105	FI	On-Demand	Anodyne	SLC9A1	40	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450778105	FI	On-Demand	Anodyne	RBP4	36	43
O=C(Nc1cccc(CCCO)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450778106	DG	On-Demand	Anodyne	KCNK9	42	33
O=C1CC[C@H](CCC(=O)N2CCC(c3c(F)cccc3F)CC2)N1	ZINC000450778184	EF	On-Demand	Anodyne	ETHR	54	36
O=C1CC[C@@H](CCC(=O)N2CCC(c3c(F)cccc3F)CC2)N1	ZINC000450778188	EF	On-Demand	Anodyne	ETHR	54	36
O=C([C@H]1CCN(c2ccccc2)C1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450778204	FI	On-Demand	Anodyne	MMP2	0	41
O=C([C@@H]1CCN(c2ccccc2)C1)N1CCC(c2c(F)cccc2F)CC1	ZINC000450778209	FI	On-Demand	Anodyne	MMP2	0	41
COc1cccc2c1CCN(C(=O)C1(Cc3ccccc3)CCOCC1)C2	ZINC000450778215	FH	On-Demand	Anodyne	AGTR2	51	33
COc1cccc2c1CCN(C(=O)C1(Cc3ccccc3)CCOCC1)C2	ZINC000450778215	FH	On-Demand	Anodyne	CPT2	21	47
COc1cccc2c1CCN(C(=O)C1(Cc3ccccc3)CCOCC1)C2	ZINC000450778215	FH	On-Demand	Anodyne	AKR1C3	21	46
COCCNC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)nc1	ZINC000450778221	DC	On-Demand	Anodyne	DRD4	41	32
COCCNC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)nc1	ZINC000450778221	DC	On-Demand	Anodyne	HPGDS	28	40
CC(=O)c1ccc(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450778224	FF	On-Demand	Anodyne	NPFFR1	52	36
CC(=O)c1ccc(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450778225	FF	On-Demand	Anodyne	NPFFR1	52	36
COc1cc(CN2CCN(CCO)[C@H](C)C2)ccc1Cl	ZINC000450778254	CD	On-Demand	Anodyne	CCR1	40	45
COc1cc(CN2CCN(CCO)[C@@H](C)C2)ccc1Cl	ZINC000450778257	CD	On-Demand	Anodyne	CCR1	40	45
COc1ccc(CNC(=O)CCN2CCC(O)(C(F)F)CC2)c(OC)c1	ZINC000450778270	FD	On-Demand	Anodyne	DRD4	41	31
COc1ccc(CNC(=O)CCN2CCC(O)(C(F)F)CC2)c(OC)c1	ZINC000450778270	FD	On-Demand	Anodyne	HTR7	29	42
COc1ccc(CNC(=O)CCN2CCC(O)(C(F)F)CC2)c(OC)c1	ZINC000450778270	FD	On-Demand	Anodyne	MTNR1A	57	41
COc1ccc(CNC(=O)CCN2CCC(O)(C(F)F)CC2)c(OC)c1	ZINC000450778270	FD	On-Demand	Anodyne	MTNR1B	46	41
COc1cc(CC(=O)Nc2cc(OC(F)F)n(C)n2)ccc1Cl	ZINC000450778272	EE	On-Demand	Anodyne	IMDH_CRYPV	23	47
CC(C)OC(C)(C)C(=O)N1CCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000450778280	FE	On-Demand	Anodyne	NPBWR1	15	40
Cc1nn(C)cc1CC(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000450778285	EF	On-Demand	Anodyne	P2RX7	27	40
Cc1nn(C)cc1CC(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000450778287	EF	On-Demand	Anodyne	P2RX7	27	40
C[C@H](c1csnn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450778301	DI	On-Demand	Anodyne	CCR1	40	36
CC(=O)N1CCCN(C[C@H]2CCCN(c3nccc4ccc(F)cc34)C2)CC1	ZINC000450778309	GG	On-Demand	Anodyne	CCR3	58	35
CC(=O)N1CCCN(C[C@H]2CCCN(c3nccc4ccc(F)cc34)C2)CC1	ZINC000450778309	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	36
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nccc4ccc(F)cc34)C2)CC1	ZINC000450778310	GG	On-Demand	Anodyne	CCR3	58	35
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nccc4ccc(F)cc34)C2)CC1	ZINC000450778310	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	36
COc1ccccc1-n1cnc2cc(C(=O)NCCC(C)(C)O)ccc21	ZINC000450778328	FF	On-Demand	Anodyne	DRD2	27	45
COc1ccccc1-n1cnc2cc(C(=O)NCCC(C)(C)O)ccc21	ZINC000450778328	FF	On-Demand	Anodyne	DRD1	0	42
COc1ccccc1-n1cnc2cc(C(=O)NCCC(C)(C)O)ccc21	ZINC000450778328	FF	On-Demand	Anodyne	DRD4	40	33
COc1ccccc1-n1cnc2cc(C(=O)NCCC(C)(C)O)ccc21	ZINC000450778328	FF	On-Demand	Anodyne	DRD3	38	42
COc1ccccc1-n1cnc2cc(C(=O)NCCC(C)(C)O)ccc21	ZINC000450778328	FF	On-Demand	Anodyne	CYSLTR1	44	34
COc1ccccc1-n1cnc2cc(C(=O)NCCC(C)(C)O)ccc21	ZINC000450778328	FF	On-Demand	Anodyne	PDGFRB	0	46
COc1ccccc1-n1cnc2cc(C(=O)NCCC(C)(C)O)ccc21	ZINC000450778328	FF	On-Demand	Anodyne	CPT1A	47	33
COc1ccccc1-n1cnc2cc(C(=O)NCCC(C)(C)O)ccc21	ZINC000450778328	FF	On-Demand	Anodyne	HPGD	47	57
CC(=O)N1CCN(C(=O)C2CCN(c3cccc(C(F)(F)F)n3)CC2)CC1	ZINC000450778341	GE	On-Demand	Anodyne	PRKCQ	0	40
CC(=O)N1CCN(C(=O)C2CCN(c3cccc(C(F)(F)F)n3)CC2)CC1	ZINC000450778341	GE	On-Demand	Anodyne	SFRP1	67	35
CC(=O)N1CCN(C(=O)C2CCN(c3cccc(C(F)(F)F)n3)CC2)CC1	ZINC000450778341	GE	On-Demand	Anodyne	WNT3	57	33
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@H]1C	ZINC000450778347	CD	On-Demand	Anodyne	GPR119	23	44
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@@H]1C	ZINC000450778348	CD	On-Demand	Anodyne	GPR119	23	44
CO[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@H]1C	ZINC000450778349	CD	On-Demand	Anodyne	GPR119	23	44
CO[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@@H]1C	ZINC000450778350	CD	On-Demand	Anodyne	GPR119	23	44
CCOC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCCOC1	ZINC000450778352	ED	On-Demand	Anodyne	HPGDS	29	44
CCOC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCCOC1	ZINC000450778353	ED	On-Demand	Anodyne	HPGDS	29	44
CCOC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H]1CCCOC1	ZINC000450778354	ED	On-Demand	Anodyne	HPGDS	29	44
CCOC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCCOC1	ZINC000450778355	ED	On-Demand	Anodyne	HPGDS	29	44
CO[C@@H]1CCN(c2ncnc3sccc23)C[C@@H]1C	ZINC000450778356	CF	On-Demand	Anodyne	PDE3A	51	38
CO[C@H]1CCN(c2ncnc3sccc23)C[C@H]1C	ZINC000450778357	CF	On-Demand	Anodyne	PDE3A	51	38
CO[C@@H]1CCN(c2ncnc3sccc23)C[C@H]1C	ZINC000450778358	CF	On-Demand	Anodyne	PDE3A	51	38
CO[C@H]1CCN(c2ncnc3sccc23)C[C@@H]1C	ZINC000450778359	CF	On-Demand	Anodyne	PDE3A	51	38
COc1ccc(CNC(=O)CCSc2nnnn2C(C)C)c(OC)c1	ZINC000450778367	FE	On-Demand	Anodyne	PDGFRB	42	41
COc1ccc(CNC(=O)CCSc2nnnn2C(C)C)c(OC)c1	ZINC000450778367	FE	On-Demand	Anodyne	MTNR1A	40	37
COc1ccc(CNC(=O)CCSc2nnnn2C(C)C)c(OC)c1	ZINC000450778367	FE	On-Demand	Anodyne	CSF1R	17	41
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc4ccc(F)cc4n3)C2)CC1	ZINC000450778393	GG	On-Demand	Anodyne	CCR3	93	37
CC(=O)N1CCCN(C[C@H]2CCCN(c3ccc4ccc(F)cc4n3)C2)CC1	ZINC000450778393	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	56	38
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc4ccc(F)cc4n3)C2)CC1	ZINC000450778394	GG	On-Demand	Anodyne	CCR3	93	37
CC(=O)N1CCCN(C[C@@H]2CCCN(c3ccc4ccc(F)cc4n3)C2)CC1	ZINC000450778394	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	56	38
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450778403	GH	On-Demand	Anodyne	RBP4	84	40
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450778403	GH	On-Demand	Anodyne	SCD1	24	43
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450778403	GH	On-Demand	Anodyne	SFRP1	23	47
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450778403	GH	On-Demand	Anodyne	SCD	20	43
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450778406	GH	On-Demand	Anodyne	RBP4	84	40
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450778406	GH	On-Demand	Anodyne	SCD1	24	43
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450778406	GH	On-Demand	Anodyne	SFRP1	23	47
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450778406	GH	On-Demand	Anodyne	SCD	20	43
CN1CCc2ncnc(N3CCC(F)(Cc4ccc(Cl)cc4)CC3)c2C1	ZINC000450778407	FH	On-Demand	Anodyne	AKT2	33	43
Cc1ccc(Br)cc1CC(=O)N1CC(NC(=O)C2CCC2)C1	ZINC000450778413	FE	On-Demand	Anodyne	EPHX2	22	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@H]1CCCN(C)C1=O)[C@@H]2C	ZINC000450778437	EE	On-Demand	Anodyne	FKBP1A	43	38
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@H]1CCCN(C)C1=O)[C@H]2C	ZINC000450778438	EE	On-Demand	Anodyne	FKBP1A	43	38
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@@H]1CCCN(C)C1=O)[C@H]2C	ZINC000450778439	EE	On-Demand	Anodyne	FKBP1A	43	38
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@@H]1CCCN(C)C1=O)[C@@H]2C	ZINC000450778440	EE	On-Demand	Anodyne	FKBP1A	43	38
O=[N+]([O-])c1ccc2nc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccc2c1	ZINC000450778441	DF	On-Demand	Bother	SLC6A4	0	48
O=[N+]([O-])c1ccc2nc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ccc2c1	ZINC000450778442	DF	On-Demand	Bother	SLC6A4	0	48
O=[N+]([O-])c1ccc2nc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccc2c1	ZINC000450778443	DF	On-Demand	Bother	SLC6A4	0	48
CC(=O)N[C@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778448	DG	On-Demand	Anodyne	SIGMAR1	39	48
CC(=O)N[C@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778448	DG	On-Demand	Anodyne	PRCP	27	45
CC(=O)N[C@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778448	DG	On-Demand	Anodyne	CCR1	49	39
CC(=O)N[C@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778448	DG	On-Demand	Anodyne	CCR5	23	40
CC(=O)N[C@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778448	DG	On-Demand	Anodyne	BIRC2	69	46
CC(=O)N[C@@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778449	DG	On-Demand	Anodyne	SIGMAR1	39	48
CC(=O)N[C@@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778449	DG	On-Demand	Anodyne	PRCP	27	45
CC(=O)N[C@@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778449	DG	On-Demand	Anodyne	CCR1	49	39
CC(=O)N[C@@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778449	DG	On-Demand	Anodyne	CCR5	23	40
CC(=O)N[C@@H](C)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450778449	DG	On-Demand	Anodyne	BIRC2	69	46
NS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450778464	FD	On-Demand	Bother	CA2	23	46
NS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450778465	FD	On-Demand	Bother	CA2	23	46
NS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450778466	FD	On-Demand	Bother	CA2	23	46
NS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450778467	FD	On-Demand	Bother	CA2	23	46
O=C(c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)nc1)N1CCc2ccccc21	ZINC000450778474	GG	On-Demand	Anodyne	AVPR2	111	41
O=C(c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)nc1)N1CCc2ccccc21	ZINC000450778474	GG	On-Demand	Anodyne	AVPR1A	65	41
O=C(c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)nc1)N1CCc2ccccc21	ZINC000450778475	GG	On-Demand	Anodyne	AVPR2	111	41
O=C(c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)nc1)N1CCc2ccccc21	ZINC000450778475	GG	On-Demand	Anodyne	AVPR1A	65	41
O=C(c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)nc1)N1CCc2ccccc21	ZINC000450778476	GG	On-Demand	Anodyne	AVPR2	111	41
O=C(c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)nc1)N1CCc2ccccc21	ZINC000450778476	GG	On-Demand	Anodyne	AVPR1A	65	41
O=C(c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)nc1)N1CCc2ccccc21	ZINC000450778477	GG	On-Demand	Anodyne	AVPR2	111	41
O=C(c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)nc1)N1CCc2ccccc21	ZINC000450778477	GG	On-Demand	Anodyne	AVPR1A	65	41
CN(CCN1CCC(O)(Cc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450778497	FG	On-Demand	Anodyne	SIGMAR1	50	48
CN(CCN1CCC(O)(Cc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450778497	FG	On-Demand	Anodyne	CCR5	21	40
CN(CCN1CCC(O)(Cc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450778497	FG	On-Demand	Anodyne	UTS2R	16	40
CN(CCN1CCC(O)(Cc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450778497	FG	On-Demand	Anodyne	TACR3	38	40
CN(CCN1CCC(O)(Cc2ccc(F)cc2)CC1)Cc1ccccc1	ZINC000450778497	FG	On-Demand	Anodyne	SLC12A5	40	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@@H](Cc1ccccc1)OC)[C@H]2C	ZINC000450778498	FH	On-Demand	Anodyne	AGTR2	48	34
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@@H](Cc1ccccc1)OC)[C@@H]2C	ZINC000450778499	FH	On-Demand	Anodyne	AGTR2	48	34
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@H](Cc1ccccc1)OC)[C@@H]2C	ZINC000450778500	FH	On-Demand	Anodyne	AGTR2	48	34
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@H](Cc1ccccc1)OC)[C@H]2C	ZINC000450778501	FH	On-Demand	Anodyne	AGTR2	48	34
C[C@@H](c1csnn1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450778502	DI	On-Demand	Anodyne	CCR1	40	36
COCCO[C@@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778503	GD	On-Demand	Bother	CACNA1C	48	35
COCCO[C@@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778503	GD	On-Demand	Bother	CACNA1D	76	34
COCCO[C@@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778503	GD	On-Demand	Bother	LUXR	17	41
COCCO[C@@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778504	GD	On-Demand	Bother	CACNA1C	48	35
COCCO[C@@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778504	GD	On-Demand	Bother	CACNA1D	76	34
COCCO[C@@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778504	GD	On-Demand	Bother	LUXR	17	41
COCCO[C@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778505	GD	On-Demand	Bother	CACNA1C	48	35
COCCO[C@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778505	GD	On-Demand	Bother	CACNA1D	76	34
COCCO[C@H]1COCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778505	GD	On-Demand	Bother	LUXR	17	41
COCCO[C@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778506	GD	On-Demand	Bother	CACNA1C	48	35
COCCO[C@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778506	GD	On-Demand	Bother	CACNA1D	76	34
COCCO[C@H]1COCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450778506	GD	On-Demand	Bother	LUXR	17	41
COc1cc(CC(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)ccc1O	ZINC000450778514	DD	On-Demand	Anodyne	TRPV1	44	50
COc1cc(CC(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)ccc1O	ZINC000450778514	DD	On-Demand	Anodyne	NCE103	26	46
COc1cc(CC(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)ccc1O	ZINC000450778515	DD	On-Demand	Anodyne	TRPV1	44	50
COc1cc(CC(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)ccc1O	ZINC000450778515	DD	On-Demand	Anodyne	NCE103	26	46
COc1cc(CN(C)[C@@H](CO)CC(C)C)ccc1Cl	ZINC000450778516	CG	On-Demand	Anodyne	TTR	0	40
COc1cc(CN(C)[C@H](CO)CC(C)C)ccc1Cl	ZINC000450778517	CG	On-Demand	Anodyne	TTR	0	40
COC(=O)c1ccc(CC(=O)N2CCC(c3c(F)cccc3F)CC2)cc1	ZINC000450778533	FH	On-Demand	Anodyne	ETHR	47	34
CC(C)[C@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450778534	FD	On-Demand	Bother	CA2	33	47
CC(C)[C@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])[C@H](CO)C(C)C	ZINC000450778534	FD	On-Demand	Bother	BDKRB1	0	40
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450778535	FD	On-Demand	Bother	CA2	33	47
CC(C)[C@@H](CO)[C@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450778535	FD	On-Demand	Bother	BDKRB1	0	40
CC(C)[C@H](CO)[C@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450778536	FD	On-Demand	Bother	CA2	33	47
CC(C)[C@H](CO)[C@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450778536	FD	On-Demand	Bother	BDKRB1	0	40
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450778537	FD	On-Demand	Bother	CA2	33	47
CC(C)[C@H](CO)[C@@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C(C)C	ZINC000450778537	FD	On-Demand	Bother	BDKRB1	0	40
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	DRD4	15	44
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	SLC6A1	38	41
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	ADRA1A	15	40
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	PRCP	21	41
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	CCR1	42	39
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	MCHR1	29	40
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	MGEA5	25	40
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	TRPC6	41	40
COC(=O)c1csc(CN2CCC(c3ccc(Cl)cc3)CC2)n1	ZINC000450778538	FH	On-Demand	Anodyne	TRPC3	27	40
Cc1ccc(NC(=O)c2ccc(N3C[C@H]4C(=O)NC(=O)[C@H]4C3)c([N+](=O)[O-])c2)cc1	ZINC000450778544	GD	On-Demand	Bother	TAAR1	36	48
CCN(C)C(=O)CNC(=O)c1ccc2cnccc2c1	ZINC000450778585	CD	On-Demand	Anodyne	AKT1	18	42
COC(=O)c1ccc(CN2CCC(O)(C(F)F)CC2)cc1Cl	ZINC000450778602	EF	On-Demand	Anodyne	NPFFR1	43	37
CCc1cccc(C(=O)Nc2cccc(CCCO)c2)n1	ZINC000450778607	CF	On-Demand	Anodyne	PDE5A	26	51
CCc1cccc(C(=O)Nc2cccc(CCCO)c2)n1	ZINC000450778607	CF	On-Demand	Anodyne	KCNK3	75	40
CCc1cccc(C(=O)Nc2cccc(CCCO)c2)n1	ZINC000450778607	CF	On-Demand	Anodyne	KCNK9	59	36
NC(=O)CCn1c(SCC(=O)CC[C@@H]2CCCCO2)nnc1-c1ccco1	ZINC000450778619	GE	On-Demand	Anodyne	PDE8B	17	42
NC(=O)CCn1c(SCC(=O)CC[C@H]2CCCCO2)nnc1-c1ccco1	ZINC000450778622	GE	On-Demand	Anodyne	PDE8B	17	42
COc1cc(-c2noc(CN(CC(C)C)[C@H]3CCCc4cccnc43)n2)ncn1	ZINC000450778627	GG	On-Demand	Anodyne	CXCR4	78	42
CCOC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)[C@H]1CCCOC1	ZINC000450778632	FE	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)[C@H]1CCCOC1	ZINC000450778632	FE	On-Demand	Anodyne	TIMP3	48	35
CCOC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)[C@H]1CCCOC1	ZINC000450778632	FE	On-Demand	Anodyne	REN	42	42
CCOC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)[C@@H]1CCCOC1	ZINC000450778633	FE	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)[C@@H]1CCCOC1	ZINC000450778633	FE	On-Demand	Anodyne	TIMP3	48	35
CCOC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)[C@@H]1CCCOC1	ZINC000450778633	FE	On-Demand	Anodyne	REN	42	42
COc1cc(-c2noc(CN(CC(C)C)[C@@H]3CCCc4cccnc43)n2)ncn1	ZINC000450778634	GG	On-Demand	Anodyne	CXCR4	78	42
CCOC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)[C@@H]1CCCOC1	ZINC000450778635	FE	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)[C@@H]1CCCOC1	ZINC000450778635	FE	On-Demand	Anodyne	TIMP3	48	35
CCOC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)[C@@H]1CCCOC1	ZINC000450778635	FE	On-Demand	Anodyne	REN	42	42
CCOC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)[C@H]1CCCOC1	ZINC000450778636	FE	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)[C@H]1CCCOC1	ZINC000450778636	FE	On-Demand	Anodyne	TIMP3	48	35
CCOC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)[C@H]1CCCOC1	ZINC000450778636	FE	On-Demand	Anodyne	REN	42	42
CCc1cccc(C(=O)Nc2ccnn2Cc2c(OC)cc(OC)cc2OC)n1	ZINC000450778637	GG	On-Demand	Anodyne	PDE5A	24	40
CC(=O)c1ccc(CN2CCC[C@@H](CC(=O)OC(C)C)C2)cc1	ZINC000450778639	DG	On-Demand	Anodyne	CCR3	30	40
CC(=O)c1ccc(CN2CCC[C@H](CC(=O)OC(C)C)C2)cc1	ZINC000450778640	DG	On-Demand	Anodyne	CCR3	30	40
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450778644	EG	On-Demand	Anodyne	P2RY12	65	32
Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450778645	EG	On-Demand	Anodyne	P2RY12	65	32
COc1cccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000450778648	CD	On-Demand	Bother	SSTR2	45	39
COc1cccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000450778648	CD	On-Demand	Bother	SSTR1	57	43
COC(=O)c1csc(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450778653	GD	On-Demand	Anodyne	SIGMAR1	33	40
COC(=O)c1csc(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450778653	GD	On-Demand	Anodyne	NPFFR1	47	35
COC(=O)c1csc(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450778654	GD	On-Demand	Anodyne	SIGMAR1	33	40
COC(=O)c1csc(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450778654	GD	On-Demand	Anodyne	NPFFR1	47	35
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(CCCO)c1	ZINC000450778659	DG	On-Demand	Anodyne	KCNK9	56	32
COc1c(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cccc1C(N)=O	ZINC000450778695	FE	On-Demand	Anodyne	PDE4D	17	43
COc1c(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cccc1C(N)=O	ZINC000450778697	FE	On-Demand	Anodyne	PDE4D	17	43
CCOC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)nc1	ZINC000450778707	FF	On-Demand	Anodyne	SMO	42	35
CCOC(=O)c1ccc(CN2CCC(c3noc(C4CC4)n3)CC2)nc1	ZINC000450778707	FF	On-Demand	Anodyne	ETHR	58	37
CCOC(=O)c1c(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)nc2ccccc2c1C	ZINC000450778712	FD	On-Demand	Anodyne	GABRA1	19	40
CCOC(=O)c1c(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)nc2ccccc2c1C	ZINC000450778712	FD	On-Demand	Anodyne	TSPO	20	42
CO[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450778714	CH	On-Demand	Anodyne	HRP1_PLAFA	46	33
CO[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450778714	CH	On-Demand	Anodyne	PDE3B	47	34
CO[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450778717	CH	On-Demand	Anodyne	HRP1_PLAFA	46	33
CO[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@H]1C	ZINC000450778717	CH	On-Demand	Anodyne	PDE3B	47	34
CO[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450778719	CH	On-Demand	Anodyne	PDE3B	47	34
CO[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450778720	CH	On-Demand	Anodyne	HRP1_PLAFA	46	33
CO[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C[C@@H]1C	ZINC000450778720	CH	On-Demand	Anodyne	PDE3B	47	34
C=CCOc1ccc(CC(=O)N[C@@H]2CCCO[C@H]2CC(C)C)cc1	ZINC000450778764	EH	On-Demand	Mild	PHZR	0	41
C=CCOc1ccc(CC(=O)N[C@H]2CCCO[C@H]2CC(C)C)cc1	ZINC000450778766	EH	On-Demand	Mild	PHZR	0	41
C=CCOc1ccc(CC(=O)N[C@H]2CCCO[C@@H]2CC(C)C)cc1	ZINC000450778767	EH	On-Demand	Mild	PHZR	0	41
C=CCOc1ccc(CC(=O)N[C@@H]2CCCO[C@@H]2CC(C)C)cc1	ZINC000450778768	EH	On-Demand	Mild	PHZR	0	41
CN(CC1CCC(=O)CC1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450778781	EE	On-Demand	Anodyne	NPFFR1	42	32
CN(CC1CCC(=O)CC1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450778782	EE	On-Demand	Anodyne	NPFFR1	42	32
CCOC(=O)c1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)nc1	ZINC000450778821	ED	On-Demand	Anodyne	P2RY12	51	46
CC1CCN(C(=O)c2ccc(N[C@H](C3CC3)[C@@H](CO)C3CC3)nc2)CC1	ZINC000450778832	FG	On-Demand	Anodyne	L3MBTL3	46	32
CC1CCN(C(=O)c2ccc(N[C@H](C3CC3)[C@@H](CO)C3CC3)nc2)CC1	ZINC000450778832	FG	On-Demand	Anodyne	TRPC6	40	34
CC1CCN(C(=O)c2ccc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)nc2)CC1	ZINC000450778833	FG	On-Demand	Anodyne	L3MBTL3	46	32
CC1CCN(C(=O)c2ccc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)nc2)CC1	ZINC000450778833	FG	On-Demand	Anodyne	TRPC6	40	34
CC1CCN(C(=O)c2ccc(N[C@@H](C3CC3)[C@H](CO)C3CC3)nc2)CC1	ZINC000450778834	FG	On-Demand	Anodyne	L3MBTL3	46	32
CC1CCN(C(=O)c2ccc(N[C@@H](C3CC3)[C@H](CO)C3CC3)nc2)CC1	ZINC000450778834	FG	On-Demand	Anodyne	TRPC6	40	34
CC1CCN(C(=O)c2ccc(N[C@H](C3CC3)[C@H](CO)C3CC3)nc2)CC1	ZINC000450778835	FG	On-Demand	Anodyne	L3MBTL3	46	32
CC1CCN(C(=O)c2ccc(N[C@H](C3CC3)[C@H](CO)C3CC3)nc2)CC1	ZINC000450778835	FG	On-Demand	Anodyne	TRPC6	40	34
COc1ccc(-c2csc3ncnc(N4C[C@@H]5[C@H]6C=C[C@@H](O6)[C@H]5C4)c23)cc1	ZINC000450778842	GH	On-Demand	Anodyne	ADRB3	28	42
COc1ccc(-c2csc3ncnc(N4C[C@H]5[C@H]6C=C[C@@H](O6)[C@H]5C4)c23)cc1	ZINC000450778843	GH	On-Demand	Anodyne	ADRB3	28	42
COc1ccc(-c2csc3ncnc(N4C[C@@H]5[C@@H](C4)[C@H]4C=C[C@H]5O4)c23)cc1	ZINC000450778844	GH	On-Demand	Anodyne	ADRB3	28	42
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cc1	ZINC000450778847	FE	On-Demand	Anodyne	FAAH	16	43
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cc1	ZINC000450778847	FE	On-Demand	Anodyne	RORC	53	32
CCc1cccc(C(=O)N2CC(NC(=O)C3CCC3)C2)n1	ZINC000450778856	CD	On-Demand	Anodyne	EPHX2	16	41
CC(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450778882	DG	On-Demand	Bother	TAAR1	16	42
CC(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450778883	DG	On-Demand	Bother	TAAR1	16	42
CC(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450778884	DG	On-Demand	Bother	TAAR1	16	42
CC(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450778885	DG	On-Demand	Bother	TAAR1	16	42
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCO[C@@H](COCC2CC2)C1	ZINC000450778886	GF	On-Demand	Bother	LIPG	52	40
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCO[C@H](COCC2CC2)C1	ZINC000450778887	GF	On-Demand	Bother	LIPG	52	40
O=C(c1cnc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c(Cl)c1)N1CCCCC1	ZINC000450778895	GH	On-Demand	Anodyne	L3MBTL3	40	35
O=C(c1cnc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c(Cl)c1)N1CCCCC1	ZINC000450778896	GH	On-Demand	Anodyne	L3MBTL3	40	35
O=C(c1cnc(N[C@H](C2CC2)[C@H](CO)C2CC2)c(Cl)c1)N1CCCCC1	ZINC000450778897	GH	On-Demand	Anodyne	L3MBTL3	40	35
O=C(c1cnc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c(Cl)c1)N1CCCCC1	ZINC000450778898	GH	On-Demand	Anodyne	L3MBTL3	40	35
CCc1cccc(C(=O)N2[C@@H](C)Cc3cc(OC)ccc3[C@@H]2C)n1	ZINC000450778900	DH	On-Demand	Anodyne	HCRTR2	0	42
CCc1cccc(C(=O)N2[C@@H](C)c3ccc(OC)cc3C[C@H]2C)n1	ZINC000450778901	DH	On-Demand	Anodyne	HCRTR2	0	42
Clc1ccc(C2CCN(Cc3cn(CC4CC4)nn3)CC2)cc1	ZINC000450778902	EH	On-Demand	Anodyne	DRD4	15	44
COc1ccc(-c2ccnc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)n2)cc1	ZINC000450778908	EG	On-Demand	Anodyne	MAPK1	41	39
COc1ccc(-c2ccnc(N[C@H](C3CC3)[C@H](CO)C3CC3)n2)cc1	ZINC000450778909	EG	On-Demand	Anodyne	MAPK1	41	39
COc1ccc(-c2ccnc(N[C@@H](C3CC3)[C@H](CO)C3CC3)n2)cc1	ZINC000450778910	EG	On-Demand	Anodyne	MAPK1	41	39
COc1ccc(-c2ccnc(N[C@H](C3CC3)[C@@H](CO)C3CC3)n2)cc1	ZINC000450778911	EG	On-Demand	Anodyne	MAPK1	41	39
O=C(c1cc2n(n1)CCCC2)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000450778914	EI	On-Demand	Anodyne	UTS2R	43	29
O=C(c1cc2n(n1)CCCC2)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000450778915	EI	On-Demand	Anodyne	UTS2R	43	29
O=C(c1cc2n(n1)CCCC2)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000450778916	EI	On-Demand	Anodyne	UTS2R	43	29
O=C(c1cc2n(n1)CCCC2)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000450778917	EI	On-Demand	Anodyne	UTS2R	43	29
C/C=C\COc1cccc(CC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450778926	EH	On-Demand	Anodyne	MTNR1B	16	41
C/C=C\COc1cccc(CC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450778926	EH	On-Demand	Anodyne	TSPAN17	0	41
C/C=C\COc1cccc(CC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450778926	EH	On-Demand	Anodyne	CRTM	60	38
C/C=C/COc1cccc(CC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450778927	EH	On-Demand	Anodyne	MTNR1B	16	41
C/C=C/COc1cccc(CC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450778927	EH	On-Demand	Anodyne	TSPAN17	0	41
C/C=C/COc1cccc(CC(=O)Nc2cccc(CCCO)c2)c1	ZINC000450778927	EH	On-Demand	Anodyne	CRTM	60	38
CC(C)Cn1cc(C(=O)Nc2cccc(CCCO)c2)c(C(F)F)n1	ZINC000450778947	FH	On-Demand	Anodyne	KCNK3	40	33
CN(CCN1CC(S(=O)(=O)NC2CCCC2)C1)Cc1ccccc1	ZINC000450778956	FD	On-Demand	Anodyne	SIGMAR1	22	41
O=C(Nc1cccc(CCCO)c1)c1cn(CCc2ccccc2)nn1	ZINC000450778972	FF	On-Demand	Anodyne	KCNK3	42	34
CCN(C)C(=O)CNC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450778980	DD	On-Demand	Anodyne	IRAK4	20	40
CCOC(=O)[C@@H](NC(=O)c1cnn2ccc(C)cc12)[C@H]1CCCOC1	ZINC000450778983	ED	On-Demand	Anodyne	EPHB3	26	42
CCOC(=O)[C@@H](NC(=O)c1cnn2ccc(C)cc12)[C@@H]1CCCOC1	ZINC000450778985	ED	On-Demand	Anodyne	EPHB3	26	42
CCOC(=O)[C@H](NC(=O)c1cnn2ccc(C)cc12)[C@@H]1CCCOC1	ZINC000450778986	ED	On-Demand	Anodyne	EPHB3	26	42
CCOC(=O)[C@H](NC(=O)c1cnn2ccc(C)cc12)[C@H]1CCCOC1	ZINC000450778987	ED	On-Demand	Anodyne	EPHB3	26	42
C[C@H](O)CCCN1C(=O)N[C@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450778989	EF	On-Demand	Anodyne	DNAE	44	43
C[C@@H](O)CCCN1C(=O)N[C@@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450778991	EF	On-Demand	Anodyne	DNAE	44	43
C[C@@H](O)CCCN1C(=O)N[C@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450778992	EF	On-Demand	Anodyne	DNAE	44	43
C[C@H](O)CCCN1C(=O)N[C@@](C)(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000450778994	EF	On-Demand	Anodyne	DNAE	44	43
COc1ccc(-c2noc(CN3CCC[C@@H](C(=O)OC(C)(C)C)C3)n2)nn1	ZINC000450779003	GE	On-Demand	Anodyne	SLC6A1	46	34
COc1ccc(-c2noc(CN3CCC[C@H](C(=O)OC(C)(C)C)C3)n2)nn1	ZINC000450779005	GE	On-Demand	Anodyne	SLC6A1	46	34
Cn1cc(-c2ccc(C(=O)NCCC(C)(C)O)o2)cn1	ZINC000450779007	CD	On-Demand	Anodyne	SCN10A	18	42
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)[C@H](C)C4)c23)cc1	ZINC000450779012	FI	On-Demand	Anodyne	PDE3A	47	39
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)[C@H](C)C4)c23)cc1	ZINC000450779012	FI	On-Demand	Anodyne	ADRB3	30	46
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)[C@H](C)C4)c23)cc1	ZINC000450779012	FI	On-Demand	Anodyne	PDE3B	45	39
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)[C@H](C)C4)c23)cc1	ZINC000450779015	FI	On-Demand	Anodyne	PDE3A	47	39
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)[C@H](C)C4)c23)cc1	ZINC000450779015	FI	On-Demand	Anodyne	ADRB3	30	46
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)[C@H](C)C4)c23)cc1	ZINC000450779015	FI	On-Demand	Anodyne	PDE3B	45	39
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)[C@@H](C)C4)c23)cc1	ZINC000450779018	FI	On-Demand	Anodyne	PDE3A	47	39
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)[C@@H](C)C4)c23)cc1	ZINC000450779018	FI	On-Demand	Anodyne	ADRB3	30	46
COc1ccc(-c2csc3ncnc(N4CC[C@H](OC)[C@@H](C)C4)c23)cc1	ZINC000450779018	FI	On-Demand	Anodyne	PDE3B	45	39
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)[C@@H](C)C4)c23)cc1	ZINC000450779020	FI	On-Demand	Anodyne	PDE3A	47	39
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)[C@@H](C)C4)c23)cc1	ZINC000450779020	FI	On-Demand	Anodyne	ADRB3	30	46
COc1ccc(-c2csc3ncnc(N4CC[C@@H](OC)[C@@H](C)C4)c23)cc1	ZINC000450779020	FI	On-Demand	Anodyne	PDE3B	45	39
COc1ccc(-c2noc(CSc3nnnn3C(C)C)n2)nn1	ZINC000450779046	ED	On-Demand	Anodyne	TNKS2	16	40
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450779055	FE	On-Demand	Anodyne	P2RY12	70	36
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450779056	FE	On-Demand	Anodyne	P2RY12	70	36
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450779057	FE	On-Demand	Anodyne	P2RY12	70	36
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450779058	FE	On-Demand	Anodyne	P2RY12	70	36
CCN1CCN(CCN(C)Cc2ccccc2)[C@@H](C)C1=O	ZINC000450779087	CD	On-Demand	Anodyne	SIGMAR1	17	45
CCN1CCN(CCN(C)Cc2ccccc2)[C@H](C)C1=O	ZINC000450779088	CD	On-Demand	Anodyne	SIGMAR1	17	45
CN1CCN(c2nc3ccccc3nc2N2C[C@H]3CCN(C)[C@H]3C2)CC1	ZINC000450779089	FD	On-Demand	Anodyne	HTR3A	30	52
CN1CCN(c2nc3ccccc3nc2N2C[C@H]3CCN(C)[C@H]3C2)CC1	ZINC000450779089	FD	On-Demand	Anodyne	HRH4	30	52
CCOc1cc2nccc(N3CC[C@@H](OC)[C@@H](C)C3)c2cc1OCC	ZINC000450779099	EH	On-Demand	Anodyne	PDE3A	44	42
CCOc1cc2nccc(N3CC[C@@H](OC)[C@@H](C)C3)c2cc1OCC	ZINC000450779099	EH	On-Demand	Anodyne	PDE3B	73	42
CCOc1cc2nccc(N3CC[C@H](OC)[C@H](C)C3)c2cc1OCC	ZINC000450779100	EH	On-Demand	Anodyne	PDE3A	44	42
CCOc1cc2nccc(N3CC[C@H](OC)[C@H](C)C3)c2cc1OCC	ZINC000450779100	EH	On-Demand	Anodyne	PDE3B	73	42
CCOc1cc2nccc(N3CC[C@H](OC)[C@@H](C)C3)c2cc1OCC	ZINC000450779101	EH	On-Demand	Anodyne	PDE3A	44	42
CCOc1cc2nccc(N3CC[C@H](OC)[C@@H](C)C3)c2cc1OCC	ZINC000450779101	EH	On-Demand	Anodyne	PDE3B	73	42
CCOc1cc2nccc(N3CC[C@@H](OC)[C@H](C)C3)c2cc1OCC	ZINC000450779102	EH	On-Demand	Anodyne	PDE3A	44	42
CCOc1cc2nccc(N3CC[C@@H](OC)[C@H](C)C3)c2cc1OCC	ZINC000450779102	EH	On-Demand	Anodyne	PDE3B	73	42
CCOC(=O)[C@@H](NC(=O)c1cccc(CC)n1)[C@@H]1CCCOC1	ZINC000450779103	DD	On-Demand	Anodyne	P2RY12	43	40
CCOC(=O)[C@H](NC(=O)c1cccc(CC)n1)[C@@H]1CCCOC1	ZINC000450779109	DD	On-Demand	Anodyne	P2RY12	43	40
CCOC(=O)[C@H](NC(=O)c1cccc(CC)n1)[C@H]1CCCOC1	ZINC000450779110	DD	On-Demand	Anodyne	P2RY12	43	40
CCOC(=O)[C@@H](NC(=O)c1cccc(CC)n1)[C@H]1CCCOC1	ZINC000450779111	DD	On-Demand	Anodyne	P2RY12	43	40
COc1ccc([N+](=O)[O-])c(N2CC[C@H](OC)[C@@H](C)C2)c1	ZINC000450779123	CE	On-Demand	Bother	TAAR1	18	45
COc1ccc([N+](=O)[O-])c(N2CC[C@@H](OC)[C@@H](C)C2)c1	ZINC000450779124	CE	On-Demand	Bother	TAAR1	18	45
COc1ccc([N+](=O)[O-])c(N2CC[C@@H](OC)[C@H](C)C2)c1	ZINC000450779126	CE	On-Demand	Bother	TAAR1	18	45
Cc1cncc(-c2nc(CN3CCN(CCO)[C@H](C)C3)no2)c1	ZINC000450779143	DC	On-Demand	Anodyne	ACOX1	32	43
Cc1cncc(-c2nc(CN3CCN(CCO)[C@@H](C)C3)no2)c1	ZINC000450779144	DC	On-Demand	Anodyne	ACOX1	32	43
COCCOC[C@@H](O)CN1CCC(c2ccc(Br)c(C)c2)CC1	ZINC000450779149	GF	On-Demand	Anodyne	VACHT_TETCF	0	42
COCCOC[C@@H](O)CN1CCC(c2ccc(Br)c(C)c2)CC1	ZINC000450779149	GF	On-Demand	Anodyne	HSP90AB1	37	42
COCCOC[C@@H](O)CN1CCC(c2ccc(Br)c(C)c2)CC1	ZINC000450779149	GF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
COCCOC[C@H](O)CN1CCC(c2ccc(Br)c(C)c2)CC1	ZINC000450779150	GF	On-Demand	Anodyne	VACHT_TETCF	0	42
COCCOC[C@H](O)CN1CCC(c2ccc(Br)c(C)c2)CC1	ZINC000450779150	GF	On-Demand	Anodyne	HSP90AB1	37	42
COCCOC[C@H](O)CN1CCC(c2ccc(Br)c(C)c2)CC1	ZINC000450779150	GF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
CN1CC[C@@H]2CN(c3ccnc(-c4ccccc4)n3)C[C@@H]21	ZINC000450779155	CE	On-Demand	Anodyne	SORD	43	38
COc1c(NC(=O)c2ccc(C)c3c2CCC3)cccc1C(N)=O	ZINC000450779169	DF	On-Demand	Anodyne	PAGA	0	41
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@H]2C(=O)NC(=O)[C@H]2C1	ZINC000450779171	FD	On-Demand	Anodyne	ATP4A	19	51
CCc1cccc(C(=O)N2[C@@H](C)Cc3cc(OC)ccc3[C@H]2C)n1	ZINC000450779175	DH	On-Demand	Anodyne	HCRTR2	0	42
CCc1cccc(C(=O)N2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)n1	ZINC000450779176	DH	On-Demand	Anodyne	HCRTR2	0	42
CCc1cc(N[C@H](C(=O)OC(C)C)C(C)C)n2ncnc2n1	ZINC000450779181	DE	On-Demand	Anodyne	DHOD	0	46
O=C(c1cnc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c(Cl)c1)N1CCOCC1	ZINC000450779222	GE	On-Demand	Anodyne	MAPK1	40	34
O=C(c1cnc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c(Cl)c1)N1CCOCC1	ZINC000450779222	GE	On-Demand	Anodyne	LRRK2	26	40
O=C(c1cnc(N[C@H](C2CC2)[C@H](CO)C2CC2)c(Cl)c1)N1CCOCC1	ZINC000450779223	GE	On-Demand	Anodyne	MAPK1	40	34
O=C(c1cnc(N[C@H](C2CC2)[C@H](CO)C2CC2)c(Cl)c1)N1CCOCC1	ZINC000450779223	GE	On-Demand	Anodyne	LRRK2	26	40
O=C(c1cnc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c(Cl)c1)N1CCOCC1	ZINC000450779224	GE	On-Demand	Anodyne	MAPK1	40	34
O=C(c1cnc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c(Cl)c1)N1CCOCC1	ZINC000450779224	GE	On-Demand	Anodyne	LRRK2	26	40
O=C(c1cnc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c(Cl)c1)N1CCOCC1	ZINC000450779225	GE	On-Demand	Anodyne	MAPK1	40	34
O=C(c1cnc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c(Cl)c1)N1CCOCC1	ZINC000450779225	GE	On-Demand	Anodyne	LRRK2	26	40
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncnc4scc(-c5ccccc5)c34)C[C@H]12	ZINC000450779247	EH	On-Demand	Anodyne	ADRB3	16	49
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ncnc4scc(-c5ccccc5)c34)C[C@H]21	ZINC000450779248	EH	On-Demand	Anodyne	ADRB3	16	49
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ncnc4scc(-c5ccccc5)c34)C[C@@H]12	ZINC000450779249	EH	On-Demand	Anodyne	ADRB3	16	49
COc1ccc(CNC(=O)CCN2CCC([C@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450779267	GD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC([C@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450779267	GD	On-Demand	Anodyne	HTR7	31	41
COc1ccc(CNC(=O)CCN2CCC([C@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450779267	GD	On-Demand	Anodyne	MTNR1A	78	41
COc1ccc(CNC(=O)CCN2CCC([C@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450779267	GD	On-Demand	Anodyne	MTNR1B	68	41
COc1ccc(CNC(=O)CCN2CCC([C@@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450779268	GD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC([C@@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450779268	GD	On-Demand	Anodyne	HTR7	31	41
COc1ccc(CNC(=O)CCN2CCC([C@@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450779268	GD	On-Demand	Anodyne	MTNR1A	78	41
COc1ccc(CNC(=O)CCN2CCC([C@@H](C)NC(C)=O)CC2)c(OC)c1	ZINC000450779268	GD	On-Demand	Anodyne	MTNR1B	68	41
COc1ccc([N+](=O)[O-])c(N2CC[C@H](OC)[C@H](C)C2)c1	ZINC000450779275	CE	On-Demand	Bother	TAAR1	18	45
CCOC(=O)[C@@H](NC(=O)Cc1scnc1-c1ccccc1)[C@@H]1CCCOC1	ZINC000450779291	GF	On-Demand	Anodyne	P2RY12	69	38
CCOC(=O)[C@H](NC(=O)Cc1scnc1-c1ccccc1)[C@@H]1CCCOC1	ZINC000450779292	GF	On-Demand	Anodyne	P2RY12	69	38
CCOC(=O)[C@H](NC(=O)Cc1scnc1-c1ccccc1)[C@H]1CCCOC1	ZINC000450779293	GF	On-Demand	Anodyne	P2RY12	69	38
CCOC(=O)[C@@H](NC(=O)Cc1scnc1-c1ccccc1)[C@H]1CCCOC1	ZINC000450779294	GF	On-Demand	Anodyne	P2RY12	69	38
C[C@H](OCCc1ccccc1)C(=O)N1Cc2ccccc2C2(CC2)C1	ZINC000450779300	EH	On-Demand	Anodyne	GHRHR	49	38
C[C@@H](OCCc1ccccc1)C(=O)N1Cc2ccccc2C2(CC2)C1	ZINC000450779301	EH	On-Demand	Anodyne	GHRHR	49	38
Cn1nc(-c2ccccc2)cc1C(=O)NCCC(C)(C)O	ZINC000450779302	CD	On-Demand	Anodyne	CTSV	50	34
CC(C)c1ccc(CC2CCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450779340	EG	On-Demand	Anodyne	GRIN2B	24	46
CC(C)c1ccc(CC2CCN(C[C@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450779340	EG	On-Demand	Anodyne	O19067_PIG	0	47
CC(C)c1ccc(CC2CCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450779344	EG	On-Demand	Anodyne	GRIN2B	24	46
CC(C)c1ccc(CC2CCN(C[C@@H](C)S(C)(=O)=O)CC2)cc1	ZINC000450779344	EG	On-Demand	Anodyne	O19067_PIG	0	47
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450779347	EG	On-Demand	Anodyne	ACE	45	38
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450779348	EG	On-Demand	Anodyne	ACE	45	38
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450779349	EG	On-Demand	Anodyne	ACE	45	38
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450779350	EG	On-Demand	Anodyne	ACE	45	38
CN1CC[C@@H]2CN(c3nc4c(F)cccc4o3)C[C@@H]21	ZINC000450779353	CE	On-Demand	Anodyne	HTR3A	20	40
C=C(C)CNC(=O)Cc1cc(C)ccc1F	ZINC000450779368	BE	On-Demand	Mild	P2RX7	27	42
CC[C@H]1C(=O)N(CC)CCN1CCCC(=O)c1ccccc1	ZINC000450779372	DF	On-Demand	Anodyne	CYP2J2	57	40
CC[C@@H]1C(=O)N(CC)CCN1CCCC(=O)c1ccccc1	ZINC000450779373	DF	On-Demand	Anodyne	CYP2J2	57	40
COc1ccc(-c2nnc(N3C[C@@H]4CCN(C)[C@@H]4C3)c3ccccc23)cc1	ZINC000450779376	FG	On-Demand	Anodyne	SMO	41	39
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779391	EF	On-Demand	Anodyne	GYRB	60	39
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779391	EF	On-Demand	Anodyne	DRD3	0	41
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779391	EF	On-Demand	Anodyne	ACACA	0	49
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779391	EF	On-Demand	Anodyne	ACACB	28	49
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779391	EF	On-Demand	Anodyne	TNKS	40	31
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779391	EF	On-Demand	Anodyne	PARE	51	39
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779392	EF	On-Demand	Anodyne	GYRB	60	39
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779392	EF	On-Demand	Anodyne	DRD3	0	41
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779392	EF	On-Demand	Anodyne	ACACA	0	49
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779392	EF	On-Demand	Anodyne	ACACB	28	49
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779392	EF	On-Demand	Anodyne	TNKS	40	31
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1C	ZINC000450779392	EF	On-Demand	Anodyne	PARE	51	39
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779393	EF	On-Demand	Anodyne	GYRB	60	39
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779393	EF	On-Demand	Anodyne	DRD3	0	41
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779393	EF	On-Demand	Anodyne	ACACA	0	49
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779393	EF	On-Demand	Anodyne	ACACB	28	49
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779393	EF	On-Demand	Anodyne	TNKS	40	31
CO[C@@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779393	EF	On-Demand	Anodyne	PARE	51	39
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779394	EF	On-Demand	Anodyne	GYRB	60	39
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779394	EF	On-Demand	Anodyne	DRD3	0	41
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779394	EF	On-Demand	Anodyne	ACACA	0	49
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779394	EF	On-Demand	Anodyne	ACACB	28	49
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779394	EF	On-Demand	Anodyne	TNKS	40	31
CO[C@H]1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H]1C	ZINC000450779394	EF	On-Demand	Anodyne	PARE	51	39
CC(=O)c1cccc(CN2CCN(c3ccccc3)C(=O)C2)c1	ZINC000450779403	DF	On-Demand	Anodyne	MGLL	0	40
CCc1cc(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c2ccccc2n1	ZINC000450779404	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	74	35
Cc1ccc(NC(=O)c2ccc(N3C[C@H]4CCN(C)[C@H]4C3)nc2)cc1	ZINC000450779405	EF	On-Demand	Anodyne	PRNP	63	41
Cc1ccc(NC(=O)c2ccc(N3C[C@H]4CCN(C)[C@H]4C3)nc2)cc1	ZINC000450779405	EF	On-Demand	Anodyne	HDAC1	30	44
Cc1ccc(NC(=O)c2ccc(N3C[C@H]4CCN(C)[C@H]4C3)nc2)cc1	ZINC000450779405	EF	On-Demand	Anodyne	DGAT1	44	38
CCc1cc(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c2ccccc2n1	ZINC000450779406	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	74	35
COC(=O)c1ccc(CN2CC[C@H]3CCC[C@@H]32)cc1Cl	ZINC000450779407	CH	On-Demand	Anodyne	OPRK1	26	44
COC(=O)c1ccc(CN2CC[C@H]3CCC[C@H]32)cc1Cl	ZINC000450779409	CH	On-Demand	Anodyne	OPRK1	26	44
COC(=O)c1ccc(CN2CC[C@@H]3CCC[C@H]32)cc1Cl	ZINC000450779412	CH	On-Demand	Anodyne	OPRK1	26	44
COC(=O)c1ccc(CN2CC[C@@H]3CCC[C@@H]32)cc1Cl	ZINC000450779414	CH	On-Demand	Anodyne	OPRK1	26	44
C=C(C)CNC(=O)[C@@](C)(Cc1ccc(OC)c(OC)c1)NC(C)=O	ZINC000450779416	ED	On-Demand	Mild	MT-ND1	25	40
CCOC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000450779419	FD	On-Demand	Anodyne	MTNR1A	35	41
CCOC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000450779419	FD	On-Demand	Anodyne	MTNR1B	35	41
CCOC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000450779420	FD	On-Demand	Anodyne	MTNR1A	35	41
CCOC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000450779420	FD	On-Demand	Anodyne	MTNR1B	35	41
CCOC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000450779421	FD	On-Demand	Anodyne	MTNR1A	35	41
CCOC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)[C@H]1CCCOC1	ZINC000450779421	FD	On-Demand	Anodyne	MTNR1B	35	41
CCOC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000450779423	FD	On-Demand	Anodyne	MTNR1A	35	41
CCOC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)[C@@H]1CCCOC1	ZINC000450779423	FD	On-Demand	Anodyne	MTNR1B	35	41
CC[C@]1(O)CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450779425	BE	On-Demand	Anodyne	MCHR2	42	33
CC[C@]1(O)CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450779425	BE	On-Demand	Anodyne	NPFFR1	44	33
CC[C@@]1(O)CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450779427	BE	On-Demand	Anodyne	MCHR2	42	33
CC[C@@]1(O)CCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450779427	BE	On-Demand	Anodyne	NPFFR1	44	33
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450779429	DG	On-Demand	Anodyne	AKR1C3	0	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450779429	DG	On-Demand	Anodyne	LIPG	23	42
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@H](OCC2CC2)C1	ZINC000450779430	DG	On-Demand	Anodyne	AKR1C3	0	41
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@H](OCC2CC2)C1	ZINC000450779430	DG	On-Demand	Anodyne	LIPG	23	42
C[C@H]1CC[C@@](CO)(N(C)CCCC(=O)c2ccc(F)cc2)C1	ZINC000450779440	DG	On-Demand	Anodyne	DRD2	29	41
C[C@@H]1CC[C@](CO)(N(C)CCCC(=O)c2ccc(F)cc2)C1	ZINC000450779441	DG	On-Demand	Anodyne	DRD2	29	41
C[C@H]1CC[C@](CO)(N(C)CCCC(=O)c2ccc(F)cc2)C1	ZINC000450779442	DG	On-Demand	Anodyne	DRD2	29	41
C[C@@H]1CC[C@@](CO)(N(C)CCCC(=O)c2ccc(F)cc2)C1	ZINC000450779443	DG	On-Demand	Anodyne	DRD2	29	41
COc1cc(CN2CC[C@H](C)C[C@H]2C(N)=O)ccc1Cl	ZINC000450779448	CE	On-Demand	Anodyne	HTR4	45	37
COc1cc(CN2CC[C@H](C)C[C@@H]2C(N)=O)ccc1Cl	ZINC000450779449	CE	On-Demand	Anodyne	HTR4	45	37
COc1cc(CN2CC[C@@H](C)C[C@H]2C(N)=O)ccc1Cl	ZINC000450779450	CE	On-Demand	Anodyne	HTR4	45	37
COc1cc(CN2CC[C@@H](C)C[C@@H]2C(N)=O)ccc1Cl	ZINC000450779451	CE	On-Demand	Anodyne	HTR4	45	37
C=C(C)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450779452	CE	On-Demand	Mild	CTSS	18	42
COCCOC[C@@H](O)CN1CCN(C2CC2)c2ccccc21	ZINC000450779454	DD	On-Demand	Anodyne	HSP90AB1	38	40
COCCOC[C@H](O)CN1CCN(C2CC2)c2ccccc21	ZINC000450779455	DD	On-Demand	Anodyne	HSP90AB1	38	40
C=C(C)CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450779471	DE	On-Demand	Mild	E1	0	44
CN1CCN(S(=O)(=O)c2ccc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)nc2)CC1	ZINC000450779480	GD	On-Demand	Anodyne	GCKR	74	33
CN1CCN(S(=O)(=O)c2ccc(N[C@H](C3CC3)[C@H](CO)C3CC3)nc2)CC1	ZINC000450779481	GD	On-Demand	Anodyne	GCKR	74	33
CN1CCN(S(=O)(=O)c2ccc(N[C@@H](C3CC3)[C@H](CO)C3CC3)nc2)CC1	ZINC000450779482	GD	On-Demand	Anodyne	GCKR	74	33
CN1CCN(S(=O)(=O)c2ccc(N[C@H](C3CC3)[C@@H](CO)C3CC3)nc2)CC1	ZINC000450779483	GD	On-Demand	Anodyne	GCKR	74	33
FC(F)(F)c1ccccc1OCC1CCN(C[C@H]2COCCO2)CC1	ZINC000450779484	FG	On-Demand	Anodyne	SIGMAR1	17	42
FC(F)(F)c1ccccc1OCC1CCN(C[C@@H]2COCCO2)CC1	ZINC000450779485	FG	On-Demand	Anodyne	SIGMAR1	17	42
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]2C	ZINC000450779519	FI	On-Demand	Anodyne	HCRTR2	31	44
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]2C	ZINC000450779520	FI	On-Demand	Anodyne	HCRTR2	31	44
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1ccc(C(C)(F)F)nc1)[C@@H]2C	ZINC000450779521	FI	On-Demand	Anodyne	HCRTR2	31	44
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1ccc(C(C)(F)F)nc1)[C@H]2C	ZINC000450779522	FI	On-Demand	Anodyne	HCRTR2	31	44
Cn1c(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)nc2ccccc21	ZINC000450779551	CD	On-Demand	Anodyne	HRH1	19	55
Cn1c(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)nc2ccccc21	ZINC000450779552	CD	On-Demand	Anodyne	HRH1	19	55
Cn1c(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)nc2ccccc21	ZINC000450779553	CD	On-Demand	Anodyne	HRH1	19	55
COc1ccc(CNC(=O)CCN2CCOC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450779584	FD	On-Demand	Anodyne	MTNR1A	45	37
COc1ccc(CNC(=O)CCN2CCOC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450779585	FD	On-Demand	Anodyne	MTNR1A	45	37
COc1ccc(CNC(=O)CCN2CCOC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450779586	FD	On-Demand	Anodyne	MTNR1A	45	37
COc1ccc(CNC(=O)CCN2CCOC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450779587	FD	On-Demand	Anodyne	MTNR1A	45	37
Clc1ccc(CCN2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450779591	EI	On-Demand	Anodyne	DRD4	16	49
Clc1ccc(CCN2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450779591	EI	On-Demand	Anodyne	SIGMAR1	18	42
Clc1ccc(CCN2CCC(c3noc(C4CC4)n3)CC2)cc1	ZINC000450779591	EI	On-Demand	Anodyne	PRCP	29	40
CCOC(=O)[C@H]1CCCN1Cc1ccccc1OC1CC1	ZINC000450779598	CF	On-Demand	Anodyne	FKBP1A	41	33
CO[C@@H]1CCN(c2nc(-c3ccccn3)nc(C)c2C)C[C@@H]1C	ZINC000450779607	DG	On-Demand	Anodyne	METAP1	36	40
CO[C@H]1CCN(c2nc(-c3ccccn3)nc(C)c2C)C[C@@H]1C	ZINC000450779608	DG	On-Demand	Anodyne	METAP1	36	40
CO[C@@H]1CCN(c2nc(-c3ccccn3)nc(C)c2C)C[C@H]1C	ZINC000450779609	DG	On-Demand	Anodyne	METAP1	36	40
CO[C@H]1CCN(c2nc(-c3ccccn3)nc(C)c2C)C[C@H]1C	ZINC000450779610	DG	On-Demand	Anodyne	METAP1	36	40
COC(=O)c1csc(CN2CCC[C@@H](C(=O)OC(C)(C)C)C2)n1	ZINC000450779618	EE	On-Demand	Anodyne	SLC6A1	51	38
COC(=O)c1csc(CN2CCC[C@H](C(=O)OC(C)(C)C)C2)n1	ZINC000450779619	EE	On-Demand	Anodyne	SLC6A1	51	38
CN1CC[C@@H]2CN(c3ccnc(C(=O)NCc4ccccc4)c3)C[C@@H]21	ZINC000450779637	EE	On-Demand	Anodyne	MMP13	24	41
O=C(CC1(O)CCC1)Nc1nc2ccc(I)cc2s1	ZINC000450779645	GG	On-Demand	Anodyne	CSNK1D	50	47
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450779651	CH	On-Demand	Anodyne	PDE3A	42	34
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450779651	CH	On-Demand	Anodyne	HRP1_PLAFA	104	37
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450779651	CH	On-Demand	Anodyne	HNMT	50	35
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450779651	CH	On-Demand	Anodyne	PDE3B	41	34
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450779653	CH	On-Demand	Anodyne	PDE3A	42	34
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450779653	CH	On-Demand	Anodyne	HRP1_PLAFA	104	37
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450779653	CH	On-Demand	Anodyne	HNMT	50	35
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@H]1C	ZINC000450779653	CH	On-Demand	Anodyne	PDE3B	41	34
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450779654	CH	On-Demand	Anodyne	PDE3A	42	34
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450779654	CH	On-Demand	Anodyne	HRP1_PLAFA	104	37
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450779654	CH	On-Demand	Anodyne	HNMT	50	35
CO[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450779654	CH	On-Demand	Anodyne	PDE3B	41	34
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450779656	CH	On-Demand	Anodyne	PDE3A	42	34
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450779656	CH	On-Demand	Anodyne	HRP1_PLAFA	104	37
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450779656	CH	On-Demand	Anodyne	HNMT	50	35
CO[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C[C@@H]1C	ZINC000450779656	CH	On-Demand	Anodyne	PDE3B	41	34
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450779657	FG	On-Demand	Anodyne	DRD2	33	48
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450779657	FG	On-Demand	Anodyne	DRD1	18	47
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450779657	FG	On-Demand	Anodyne	DRD4	0	51
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450779657	FG	On-Demand	Anodyne	HTR2A	18	47
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450779657	FG	On-Demand	Anodyne	HTR2C	15	53
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450779657	FG	On-Demand	Anodyne	ERG2	22	47
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450779657	FG	On-Demand	Anodyne	SLC18A3	0	51
CCC1(CC)CN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450779657	FG	On-Demand	Anodyne	CYP2J2	51	36
O=C(c1ccc(N2CCC2)nc1)N1CCC(CCCO)CC1	ZINC000450779661	DD	On-Demand	Anodyne	FASN	25	41
O=C(c1ccc(N2CCC2)nc1)N1CCC(CCCO)CC1	ZINC000450779661	DD	On-Demand	Anodyne	L3MBTL3	62	40
CC[C@]1(O)CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450779681	EG	On-Demand	Anodyne	DRD2	30	45
CC[C@]1(O)CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450779681	EG	On-Demand	Anodyne	DRD4	0	48
CC[C@]1(O)CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450779681	EG	On-Demand	Anodyne	SLC18A3	25	46
CC[C@]1(O)CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450779681	EG	On-Demand	Anodyne	CYP2J2	57	40
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450779683	EG	On-Demand	Anodyne	DRD2	30	45
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450779683	EG	On-Demand	Anodyne	DRD4	0	48
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450779683	EG	On-Demand	Anodyne	SLC18A3	25	46
CC[C@@]1(O)CCN(CCCC(=O)c2ccc(Br)cc2)C1	ZINC000450779683	EG	On-Demand	Anodyne	CYP2J2	57	40
CCOC(=O)[C@H](NC(=O)[C@H](O)C1CCC1)[C@@H]1CCCOC1	ZINC000450779699	CC	On-Demand	Anodyne	METAP2	0	40
CCOC(=O)[C@H](NC(=O)[C@@H](O)C1CCC1)[C@@H]1CCCOC1	ZINC000450779700	CC	On-Demand	Anodyne	METAP2	0	40
CCOC(=O)[C@H](NC(=O)[C@@H](O)C1CCC1)[C@H]1CCCOC1	ZINC000450779701	CC	On-Demand	Anodyne	METAP2	0	40
CCOC(=O)[C@H](NC(=O)[C@H](O)C1CCC1)[C@H]1CCCOC1	ZINC000450779702	CC	On-Demand	Anodyne	METAP2	0	40
O=C(NCCO)c1ccc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000450779707	GE	On-Demand	Anodyne	SCD1	62	50
O=C(NCCO)c1ccc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000450779707	GE	On-Demand	Anodyne	SCD	51	48
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(O)(C(F)F)CC1	ZINC000450779719	CE	On-Demand	Anodyne	OPRK1	0	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(O)(C(F)F)CC1	ZINC000450779721	CE	On-Demand	Anodyne	OPRK1	0	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(O)(C(F)F)CC1	ZINC000450779722	CE	On-Demand	Anodyne	OPRK1	0	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(O)(C(F)F)CC1	ZINC000450779723	CE	On-Demand	Anodyne	OPRK1	0	44
CN(CC1CC(F)(F)C1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450779741	DF	On-Demand	Anodyne	SIGMAR1	44	37
CN(CC1CC(F)(F)C1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450779742	DF	On-Demand	Anodyne	SIGMAR1	44	37
Cc1ccc(NC(=O)c2ccc(N3C[C@H]4CCN(C)[C@H]4C3)c([N+](=O)[O-])c2)cc1	ZINC000450779753	GG	On-Demand	Bother	AVPR2	26	40
Cc1ccc(NC(=O)c2ccc(N3C[C@H]4CCN(C)[C@H]4C3)c([N+](=O)[O-])c2)cc1	ZINC000450779753	GG	On-Demand	Bother	PRNP	46	36
Cc1ccc(NC(=O)c2ccc(N3C[C@H]4CCN(C)[C@H]4C3)c([N+](=O)[O-])c2)cc1	ZINC000450779753	GG	On-Demand	Bother	TAAR1	40	50
CN(C[C@@H]1CCC(F)(F)C1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450779755	EF	On-Demand	Anodyne	SIGMAR1	40	36
CN(C[C@@H]1CCC(F)(F)C1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450779756	EF	On-Demand	Anodyne	SIGMAR1	40	36
CN(C[C@H]1CCC(F)(F)C1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450779757	EF	On-Demand	Anodyne	SIGMAR1	40	36
CN(C[C@H]1CCC(F)(F)C1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450779758	EF	On-Demand	Anodyne	SIGMAR1	40	36
CC(=O)c1ccc(CN2CCN(CCO)[C@H](C)C2)cc1	ZINC000450779770	CD	On-Demand	Anodyne	MLNR	40	36
CC(=O)c1ccc(CN2CCN(CCO)[C@@H](C)C2)cc1	ZINC000450779771	CD	On-Demand	Anodyne	MLNR	40	36
CN1CC[C@@H]2CN(c3ncnc4cc(F)c(F)cc34)C[C@@H]21	ZINC000450779774	CE	On-Demand	Anodyne	PDE3A	48	36
COC(=O)c1csc(CN2CCCC[C@H](C)C2)n1	ZINC000450779780	CF	On-Demand	Anodyne	TRPC6	60	39
COC(=O)c1csc(CN2CCCC[C@H](C)C2)n1	ZINC000450779780	CF	On-Demand	Anodyne	TRPC3	42	39
COC(=O)c1csc(CN2CCCC[C@@H](C)C2)n1	ZINC000450779781	CF	On-Demand	Anodyne	TRPC6	60	39
COC(=O)c1csc(CN2CCCC[C@@H](C)C2)n1	ZINC000450779781	CF	On-Demand	Anodyne	TRPC3	42	39
Nc1ncccc1CN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450779794	DE	On-Demand	Anodyne	UTS2R	17	42
CC(=O)CCCCCSc1ncc(-c2ccc(F)cc2)o1	ZINC000450779810	DJ	On-Demand	Anodyne	FAAH	40	50
CS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(C(F)(F)F)c1	ZINC000450779827	FE	On-Demand	Anodyne	HSD11B1	20	40
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(C(F)(F)F)c1	ZINC000450779828	FE	On-Demand	Anodyne	HSD11B1	20	40
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c(C(F)(F)F)c1	ZINC000450779829	FE	On-Demand	Anodyne	HSD11B1	20	40
CC(=O)c1ccc(N[C@H](C(=O)OC(C)C)C(C)C)c([N+](=O)[O-])c1	ZINC000450779836	DG	On-Demand	Bother	TAAR1	17	48
CC(=O)c1ccc(N[C@H](C(=O)OC(C)C)C(C)C)c([N+](=O)[O-])c1	ZINC000450779836	DG	On-Demand	Bother	AKR1C3	16	49
COc1cc(CN2CCC(O)(C(F)F)CC2)ccc1Cl	ZINC000450779894	DF	On-Demand	Anodyne	SIGMAR1	27	40
COc1cc(CN2CCC(O)(C(F)F)CC2)ccc1Cl	ZINC000450779894	DF	On-Demand	Anodyne	SSTR5	42	35
CC1CCN(C(=O)c2ccc(N3C[C@@H]4CCN(C)[C@@H]4C3)nc2)CC1	ZINC000450779897	EE	On-Demand	Anodyne	L3MBTL1	0	42
CC1CCN(C(=O)c2ccc(N3C[C@@H]4CCN(C)[C@@H]4C3)nc2)CC1	ZINC000450779897	EE	On-Demand	Anodyne	L3MBTL3	51	42
Cc1ccc(C(=O)Nc2ccc(OCCO)c(C)c2)c(C(C)C)n1	ZINC000450779900	EG	On-Demand	Anodyne	KCNK3	40	34
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	DRD2	41	65
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	DRD1	28	56
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	DRD4	30	65
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	HRH2	0	65
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	HTR2A	25	59
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	DRD3	0	65
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	ERG2	30	65
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	SLC18A3	25	61
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	HTR3B	0	47
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	CYP2J2	55	39
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	NET	0	65
O=C(CCCN1CCC(O)(C(F)F)CC1)c1ccc(F)cc1	ZINC000450779909	DF	On-Demand	Anodyne	AP2S1	0	65
CCOC(=O)[C@H]1CCCN1CC1(C(=O)OC)CC1	ZINC000450779927	CC	On-Demand	Anodyne	FKBP12.6	0	42
COc1ccc(-c2noc(CSc3nnnn3C3CCCC3)n2)nn1	ZINC000450779933	FD	On-Demand	Anodyne	AXIN2	0	42
Cc1cncc(-c2nc(CN3CCN([C@@H](C)c4ccsc4)CC3)no2)c1	ZINC000450779936	FG	On-Demand	Anodyne	ACOX1	32	41
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779937	CE	On-Demand	Anodyne	SLC6A1	48	37
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779937	CE	On-Demand	Anodyne	HRH3	26	44
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779937	CE	On-Demand	Anodyne	CACNA1D	37	43
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779937	CE	On-Demand	Anodyne	SPHK2	50	34
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779937	CE	On-Demand	Anodyne	SPHK1	49	39
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779937	CE	On-Demand	Anodyne	DPP7	27	40
Cc1cncc(-c2nc(CN3CCN([C@H](C)c4ccsc4)CC3)no2)c1	ZINC000450779938	FG	On-Demand	Anodyne	ACOX1	32	41
CC(=O)N1CCN(C(=O)C2CCN(c3cccc(C)c3[N+](=O)[O-])CC2)CC1	ZINC000450779939	FD	On-Demand	Bother	SSTR2	46	38
CC(=O)N1CCN(C(=O)C2CCN(c3cccc(C)c3[N+](=O)[O-])CC2)CC1	ZINC000450779939	FD	On-Demand	Bother	SSTR1	58	40
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779940	CE	On-Demand	Anodyne	SLC6A1	48	37
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779940	CE	On-Demand	Anodyne	HRH3	26	44
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779940	CE	On-Demand	Anodyne	CACNA1D	37	43
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779940	CE	On-Demand	Anodyne	SPHK2	50	34
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779940	CE	On-Demand	Anodyne	SPHK1	49	39
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779940	CE	On-Demand	Anodyne	DPP7	27	40
CO[C@@H]1CCN(c2cnc3ccccc3n2)C[C@H]1C	ZINC000450779941	CE	On-Demand	Anodyne	PDE3A	24	41
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779942	CE	On-Demand	Anodyne	SLC6A1	48	37
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779942	CE	On-Demand	Anodyne	HRH3	26	44
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779942	CE	On-Demand	Anodyne	CACNA1D	37	43
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779942	CE	On-Demand	Anodyne	SPHK2	50	34
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779942	CE	On-Demand	Anodyne	SPHK1	49	39
C[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C(N)=O)C1	ZINC000450779942	CE	On-Demand	Anodyne	DPP7	27	40
CO[C@H]1CCN(c2cnc3ccccc3n2)C[C@@H]1C	ZINC000450779943	CE	On-Demand	Anodyne	PDE3A	24	41
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779944	CE	On-Demand	Anodyne	SLC6A1	48	37
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779944	CE	On-Demand	Anodyne	HRH3	26	44
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779944	CE	On-Demand	Anodyne	CACNA1D	37	43
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779944	CE	On-Demand	Anodyne	SPHK2	50	34
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779944	CE	On-Demand	Anodyne	SPHK1	49	39
C[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C(N)=O)C1	ZINC000450779944	CE	On-Demand	Anodyne	DPP7	27	40
CO[C@H]1CCN(c2cnc3ccccc3n2)C[C@H]1C	ZINC000450779945	CE	On-Demand	Anodyne	PDE3A	24	41
CO[C@@H]1CCN(c2cnc3ccccc3n2)C[C@@H]1C	ZINC000450779947	CE	On-Demand	Anodyne	PDE3A	24	41
Nc1ncccc1CN1CCc2c(Br)ccc(Cl)c2C1	ZINC000450779957	FH	On-Demand	Anodyne	BRS3	0	40
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	DRD2	32	44
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	DRD1	25	48
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	DRD4	22	46
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	HTR2A	21	56
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	HTR2C	16	48
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	DRD3	16	53
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	ERG2	20	44
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	HTR7	19	44
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	MC4R	41	39
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	SLC18A3	0	45
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	HTR3B	0	42
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	CYP2J2	49	35
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	NET	0	45
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	AP2S1	0	44
C[C@@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779962	FH	On-Demand	Anodyne	HPN	41	33
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	DRD2	32	44
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	DRD1	25	48
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	DRD4	22	46
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	HTR2A	21	56
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	HTR2C	16	48
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	DRD3	16	53
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	ERG2	20	44
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	HTR7	19	44
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	MC4R	41	39
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	SLC18A3	0	45
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	HTR3B	0	42
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	CYP2J2	49	35
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	NET	0	45
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	AP2S1	0	44
C[C@H](c1nccs1)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450779963	FH	On-Demand	Anodyne	HPN	41	33
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450779998	EG	On-Demand	Anodyne	CCR3	43	34
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450779999	EG	On-Demand	Anodyne	CCR3	43	34
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450780000	EG	On-Demand	Anodyne	CCR3	43	34
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450780002	EG	On-Demand	Anodyne	CCR3	43	34
CC(C)(O)CCNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450780023	ED	On-Demand	Anodyne	CA5B	30	40
CC(C)(O)CCNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450780023	ED	On-Demand	Anodyne	CA5A	29	40
CNS(=O)(=O)NCC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450780027	GD	On-Demand	Anodyne	KCNJ11	76	37
CNS(=O)(=O)NCC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000450780028	GD	On-Demand	Anodyne	KCNJ11	76	37
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450780035	GG	On-Demand	Anodyne	RBP4	59	35
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450780036	GG	On-Demand	Anodyne	RBP4	59	35
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450780037	GG	On-Demand	Anodyne	RBP4	59	35
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450780038	GG	On-Demand	Anodyne	RBP4	59	35
CC[C@@H](O)CC(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450780049	EH	On-Demand	Anodyne	QDPR	0	41
CC[C@H](O)CC(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000450780050	EH	On-Demand	Anodyne	QDPR	0	41
CCOC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)[C@H]1CCCOC1	ZINC000450780069	GD	On-Demand	Anodyne	PDE4D	16	41
CCOC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)[C@H]1CCCOC1	ZINC000450780069	GD	On-Demand	Anodyne	PDEC	0	41
CCOC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)[C@@H]1CCCOC1	ZINC000450780070	GD	On-Demand	Anodyne	PDE4D	16	41
CCOC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)[C@@H]1CCCOC1	ZINC000450780070	GD	On-Demand	Anodyne	PDEC	0	41
CCOC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)[C@@H]1CCCOC1	ZINC000450780071	GD	On-Demand	Anodyne	PDE4D	16	41
CCOC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)[C@@H]1CCCOC1	ZINC000450780071	GD	On-Demand	Anodyne	PDEC	0	41
CCOC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)[C@H]1CCCOC1	ZINC000450780072	GD	On-Demand	Anodyne	PDE4D	16	41
CCOC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)[C@H]1CCCOC1	ZINC000450780072	GD	On-Demand	Anodyne	PDEC	0	41
O=C1CC[C@H](CN2CCC(COc3ccccc3C(F)(F)F)CC2)CCN1	ZINC000450780111	GH	On-Demand	Anodyne	SIGMAR1	21	45
O=C1CC[C@@H](CN2CCC(COc3ccccc3C(F)(F)F)CC2)CCN1	ZINC000450780112	GH	On-Demand	Anodyne	SIGMAR1	21	45
CC[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1cc(F)cc(Br)c1	ZINC000450780119	GI	On-Demand	Anodyne	TRPV1	30	46
CC[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1cc(F)cc(Br)c1	ZINC000450780120	GI	On-Demand	Anodyne	TRPV1	30	46
CC(C)C[C@H](CO)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450780160	CE	On-Demand	Anodyne	AOC3	17	40
CC(C)C[C@H](CO)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450780161	CE	On-Demand	Anodyne	AOC3	17	40
CC(C)C[C@H](CO)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450780162	CE	On-Demand	Anodyne	AOC3	17	40
CC(C)C[C@H](CO)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450780163	CE	On-Demand	Anodyne	AOC3	17	40
C[C@@H]1CCO[C@@H]1C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450780170	GG	On-Demand	Anodyne	LCK	24	43
C[C@@H]1CCO[C@@H]1C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450780170	GG	On-Demand	Anodyne	CSNK1D	43	41
C[C@@H]1CCO[C@@H]1C(=O)Nc1nc2ccc(I)cc2s1	ZINC000450780170	GG	On-Demand	Anodyne	PIK3CA	0	40
COC(=O)c1ccc(CN2CCC([C@@H](C)NC(C)=O)CC2)cc1Cl	ZINC000450780174	FF	On-Demand	Anodyne	SIGMAR1	28	44
COC(=O)c1ccc(CN2CCC([C@@H](C)NC(C)=O)CC2)cc1Cl	ZINC000450780174	FF	On-Demand	Anodyne	SSTR5	47	38
COC(=O)c1ccc(CN2CCC([C@@H](C)NC(C)=O)CC2)cc1Cl	ZINC000450780174	FF	On-Demand	Anodyne	CCR3	28	40
COC(=O)c1ccc(CN2CCC([C@@H](C)NC(C)=O)CC2)cc1Cl	ZINC000450780174	FF	On-Demand	Anodyne	MCHR1	39	44
CC[C@H]1C(=O)N(CC)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450780175	GD	On-Demand	Anodyne	MTNR1A	54	36
CC[C@H]1C(=O)N(CC)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450780175	GD	On-Demand	Anodyne	MTNR1B	46	36
COC(=O)c1ccc(CN2CCC([C@H](C)NC(C)=O)CC2)cc1Cl	ZINC000450780176	FF	On-Demand	Anodyne	SIGMAR1	28	44
COC(=O)c1ccc(CN2CCC([C@H](C)NC(C)=O)CC2)cc1Cl	ZINC000450780176	FF	On-Demand	Anodyne	SSTR5	47	38
COC(=O)c1ccc(CN2CCC([C@H](C)NC(C)=O)CC2)cc1Cl	ZINC000450780176	FF	On-Demand	Anodyne	CCR3	28	40
COC(=O)c1ccc(CN2CCC([C@H](C)NC(C)=O)CC2)cc1Cl	ZINC000450780176	FF	On-Demand	Anodyne	MCHR1	39	44
CC[C@@H]1C(=O)N(CC)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450780177	GD	On-Demand	Anodyne	MTNR1A	54	36
CC[C@@H]1C(=O)N(CC)CCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450780177	GD	On-Demand	Anodyne	MTNR1B	46	36
O=C(NC1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1)C1CCC1	ZINC000450780187	EG	On-Demand	Anodyne	ERBB2	0	40
O=C(NC1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1)C1CCC1	ZINC000450780187	EG	On-Demand	Anodyne	EPHX2	31	48
C=C(C)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450780191	CG	On-Demand	Mild	PPARA	18	43
C=C(C)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450780191	CG	On-Demand	Mild	SORT1	15	42
C=C(C)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450780191	CG	On-Demand	Mild	CCR2	53	39
C=C(C)CNC(=O)Cc1cccc(OC/C=C\C)c1	ZINC000450780193	CF	On-Demand	Mild	MTNR1A	21	42
C=C(C)CNC(=O)Cc1cccc(OC/C=C\C)c1	ZINC000450780193	CF	On-Demand	Mild	TSPAN17	0	40
C=C(C)CNC(=O)Cc1cccc(OC/C=C\C)c1	ZINC000450780193	CF	On-Demand	Mild	CRTM	47	36
C=C(C)CNC(=O)Cc1cccc(OC/C=C/C)c1	ZINC000450780194	CF	On-Demand	Mild	MTNR1A	21	42
C=C(C)CNC(=O)Cc1cccc(OC/C=C/C)c1	ZINC000450780194	CF	On-Demand	Mild	TSPAN17	0	40
C=C(C)CNC(=O)Cc1cccc(OC/C=C/C)c1	ZINC000450780194	CF	On-Demand	Mild	CRTM	47	36
OC[C@@H](C1CC1)[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)C1CC1	ZINC000450780215	ED	On-Demand	Anodyne	PRCP	0	45
OC[C@@H](C1CC1)[C@@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)C1CC1	ZINC000450780217	ED	On-Demand	Anodyne	PRCP	0	45
OC[C@@H]1CCCN(c2cc(N[C@@H](C3CC3)[C@H](CO)C3CC3)ncn2)C1	ZINC000450780218	ED	On-Demand	Anodyne	PRCP	0	45
OC[C@@H]1CCCN(c2cc(N[C@H](C3CC3)[C@H](CO)C3CC3)ncn2)C1	ZINC000450780219	ED	On-Demand	Anodyne	PRCP	0	45
C=C(C)CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450780220	DE	On-Demand	Mild	AR	17	42
C=C(C)CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450780221	DE	On-Demand	Mild	AR	17	42
COc1cccc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)nccc12	ZINC000450780224	CE	On-Demand	Anodyne	PDE3A	46	38
COc1cccc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)nccc12	ZINC000450780224	CE	On-Demand	Anodyne	PDE3B	68	38
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450780227	EG	On-Demand	Anodyne	PREP	31	40
O=C([C@@H]1CCCCN1C1CCCC1)N1CCC[C@H](OCC2CC2)C1	ZINC000450780228	EG	On-Demand	Anodyne	PREP	31	40
O=C([C@H]1CCCCN1C1CCCC1)N1CCC[C@H](OCC2CC2)C1	ZINC000450780229	EG	On-Demand	Anodyne	PREP	31	40
O=C([C@H]1CCCCN1C1CCCC1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450780230	EG	On-Demand	Anodyne	PREP	31	40
CN1CC[C@@H]2CN(c3ncnc4ccc(I)cc34)C[C@@H]21	ZINC000450780249	GE	On-Demand	Anodyne	PDE3A	46	35
CN1CC[C@@H]2CN(c3ncnc4ccc(I)cc34)C[C@@H]21	ZINC000450780249	GE	On-Demand	Anodyne	PDE3B	69	35
CCS(=O)(=O)c1ccc(CN2CCC(O)(C(F)F)CC2)cc1	ZINC000450780270	EE	On-Demand	Anodyne	ADAM17	23	43
CC(C)(C)OC(=O)[C@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450780291	CD	On-Demand	Anodyne	SLC6A1	61	34
CC(C)(C)OC(=O)[C@@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450780292	CD	On-Demand	Anodyne	SLC6A1	61	34
CO[C@@H]1CCN(c2ccnc3ccc(Br)cc23)C[C@H]1C	ZINC000450780308	EH	On-Demand	Anodyne	PDE3B	47	33
CO[C@H]1CCN(c2ccnc3ccc(Br)cc23)C[C@H]1C	ZINC000450780309	EH	On-Demand	Anodyne	PDE3B	47	33
CO[C@@H]1CCN(c2ccnc3ccc(Br)cc23)C[C@@H]1C	ZINC000450780310	EH	On-Demand	Anodyne	PDE3B	47	33
CO[C@H]1CCN(c2ccnc3ccc(Br)cc23)C[C@@H]1C	ZINC000450780311	EH	On-Demand	Anodyne	PDE3B	47	33
CO[C@@H]1CCN(c2nc(CN(C)C)nc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450780325	GI	On-Demand	Anodyne	ADRB3	0	43
CO[C@@H]1CCN(c2nc(CN(C)C)nc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450780326	GI	On-Demand	Anodyne	ADRB3	0	43
CO[C@H]1CCN(c2nc(CN(C)C)nc3scc(-c4ccccc4)c23)C[C@H]1C	ZINC000450780327	GI	On-Demand	Anodyne	ADRB3	0	43
CO[C@H]1CCN(c2nc(CN(C)C)nc3scc(-c4ccccc4)c23)C[C@@H]1C	ZINC000450780328	GI	On-Demand	Anodyne	ADRB3	0	43
CO[C@@H]1CCN(c2cc(C#N)ccn2)C[C@@H]1C	ZINC000450780329	BD	On-Demand	Mild	MAP3K12	45	32
CO[C@H]1CCN(c2cc(C#N)ccn2)C[C@@H]1C	ZINC000450780330	BD	On-Demand	Mild	MAP3K12	45	32
CO[C@H]1CCN(c2cc(C#N)ccn2)C[C@H]1C	ZINC000450780331	BD	On-Demand	Mild	MAP3K12	45	32
CO[C@@H]1CCN(c2cc(C#N)ccn2)C[C@H]1C	ZINC000450780332	BD	On-Demand	Mild	MAP3K12	45	32
O=C1NC(=O)[C@H]2CN(c3ccc4cc([N+](=O)[O-])ccc4n3)C[C@@H]12	ZINC000450780375	DC	On-Demand	Bother	SLC6A4	0	53
CCC(=O)CCCN1CCC[C@](CC)(CO)C1	ZINC000450780376	BE	On-Demand	Anodyne	EBP	16	44
CCC(=O)CCCN1CCC[C@@](CC)(CO)C1	ZINC000450780377	BE	On-Demand	Anodyne	EBP	16	44
CC(=O)NC[C@H](CC(=O)N1CCC[C@H](OCC2CC2)C1)CC(C)C	ZINC000450780393	EF	On-Demand	Anodyne	RIR1_HHV11	54	33
CC(=O)NC[C@H](CC(=O)N1CCC[C@@H](OCC2CC2)C1)CC(C)C	ZINC000450780394	EF	On-Demand	Anodyne	RIR1_HHV11	54	33
COc1ccc(Oc2ccc(C(=O)N3CCC[C@H](OCC4CC4)C3)nc2)cc1	ZINC000450780417	GH	On-Demand	Anodyne	GRM3	15	42
COc1ccc(Oc2ccc(C(=O)N3CCC[C@@H](OCC4CC4)C3)nc2)cc1	ZINC000450780418	GH	On-Demand	Anodyne	GRM3	15	42
O=C1NC(=O)[C@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@@H]12	ZINC000450780421	ED	On-Demand	Bother	AR	17	56
COc1cc(CC(=O)Nc2cc(OC(F)F)n(C)n2)ccc1O	ZINC000450780429	ED	On-Demand	Anodyne	TRPV1	25	44
COc1cc(CC(=O)Nc2cc(OC(F)F)n(C)n2)ccc1O	ZINC000450780429	ED	On-Demand	Anodyne	NCE103	21	40
CN1CCN(c2nc3ccccc3nc2N2C[C@H]3C(=O)NC(=O)[C@H]3C2)CC1	ZINC000450780441	FC	On-Demand	Anodyne	HTR3A	23	53
CN1CCN(c2nc3ccccc3nc2N2C[C@H]3C(=O)NC(=O)[C@H]3C2)CC1	ZINC000450780441	FC	On-Demand	Anodyne	HRH4	28	53
CN1CC[C@@H]2CN(c3ccnc(N4CCOCC4)n3)C[C@@H]21	ZINC000450780445	CC	On-Demand	Anodyne	SORD	25	42
CNS(=O)(=O)NCC(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450780453	DB	On-Demand	Anodyne	ENPP1	40	30
COc1cc(Br)c(C(=O)N2CCC[C@@H](OCC3CC3)C2)cc1OC	ZINC000450780480	GG	On-Demand	Anodyne	HTR4	40	38
COc1cc(Br)c(C(=O)N2CCC[C@H](OCC3CC3)C2)cc1OC	ZINC000450780482	GG	On-Demand	Anodyne	HTR4	40	38
CCCNC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)nc1	ZINC000450780485	CD	On-Demand	Anodyne	HDAC1	20	40
CCCNC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)nc1	ZINC000450780485	CD	On-Demand	Anodyne	HPGDS	28	41
CC(=O)N[C@@H](C)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450780491	FF	On-Demand	Anodyne	SIGMAR1	38	41
CC(=O)N[C@@H](C)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450780491	FF	On-Demand	Anodyne	BIRC2	36	42
CC(=O)N[C@H](C)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450780496	FF	On-Demand	Anodyne	SIGMAR1	38	41
CC(=O)N[C@H](C)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450780496	FF	On-Demand	Anodyne	BIRC2	36	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C1CC1)[C@H](CO)C1CC1	ZINC000450780507	FD	On-Demand	Anodyne	CA2	42	49
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C1CC1)[C@H](CO)C1CC1	ZINC000450780507	FD	On-Demand	Anodyne	CA1	40	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C1CC1)[C@H](CO)C1CC1	ZINC000450780507	FD	On-Demand	Anodyne	CA4	42	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450780508	FD	On-Demand	Anodyne	CA2	42	49
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450780508	FD	On-Demand	Anodyne	CA1	40	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450780508	FD	On-Demand	Anodyne	CA4	42	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450780509	FD	On-Demand	Anodyne	CA2	42	49
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450780509	FD	On-Demand	Anodyne	CA1	40	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450780509	FD	On-Demand	Anodyne	CA4	42	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C1CC1)[C@H](CO)C1CC1	ZINC000450780510	FD	On-Demand	Anodyne	CA2	42	49
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C1CC1)[C@H](CO)C1CC1	ZINC000450780510	FD	On-Demand	Anodyne	CA1	40	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C1CC1)[C@H](CO)C1CC1	ZINC000450780510	FD	On-Demand	Anodyne	CA4	42	37
Clc1ccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ccnc2c1	ZINC000450780511	CG	On-Demand	Anodyne	HRP1_PLAFA	91	34
Clc1ccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ccnc2c1	ZINC000450780511	CG	On-Demand	Anodyne	HNMT	50	36
Clc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccnc2c1	ZINC000450780512	CG	On-Demand	Anodyne	HRP1_PLAFA	91	34
Clc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccnc2c1	ZINC000450780512	CG	On-Demand	Anodyne	HNMT	50	36
Clc1ccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccnc2c1	ZINC000450780513	CG	On-Demand	Anodyne	HRP1_PLAFA	91	34
Clc1ccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccnc2c1	ZINC000450780513	CG	On-Demand	Anodyne	HNMT	50	36
COc1cc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450780524	FI	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450780524	FI	On-Demand	Anodyne	SIGMAR1	25	42
COc1cc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450780524	FI	On-Demand	Anodyne	CCR1	38	41
COc1cc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)ccc1Cl	ZINC000450780524	FI	On-Demand	Anodyne	CACNA1G	25	42
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@H]1COc3ccccc3O1)[C@@H]2C	ZINC000450780537	FH	On-Demand	Anodyne	ADRA1B	15	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@H]1COc3ccccc3O1)[C@@H]2C	ZINC000450780537	FH	On-Demand	Anodyne	ADRA2B	19	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@H]1COc3ccccc3O1)[C@@H]2C	ZINC000450780537	FH	On-Demand	Anodyne	ADRA2C	15	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@H]1COc3ccccc3O1)[C@@H]2C	ZINC000450780537	FH	On-Demand	Anodyne	HCRTR2	0	44
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H]1COc3ccccc3O1)[C@@H]2C	ZINC000450780538	FH	On-Demand	Anodyne	ADRA1B	15	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H]1COc3ccccc3O1)[C@@H]2C	ZINC000450780538	FH	On-Demand	Anodyne	ADRA2B	19	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H]1COc3ccccc3O1)[C@@H]2C	ZINC000450780538	FH	On-Demand	Anodyne	ADRA2C	15	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H]1COc3ccccc3O1)[C@@H]2C	ZINC000450780538	FH	On-Demand	Anodyne	HCRTR2	0	44
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@H]1COc3ccccc3O1)[C@H]2C	ZINC000450780539	FH	On-Demand	Anodyne	ADRA1B	15	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@H]1COc3ccccc3O1)[C@H]2C	ZINC000450780539	FH	On-Demand	Anodyne	ADRA2B	19	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@H]1COc3ccccc3O1)[C@H]2C	ZINC000450780539	FH	On-Demand	Anodyne	ADRA2C	15	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@H]1COc3ccccc3O1)[C@H]2C	ZINC000450780539	FH	On-Demand	Anodyne	HCRTR2	0	44
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H]1COc3ccccc3O1)[C@H]2C	ZINC000450780540	FH	On-Demand	Anodyne	ADRA1B	15	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H]1COc3ccccc3O1)[C@H]2C	ZINC000450780540	FH	On-Demand	Anodyne	ADRA2B	19	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H]1COc3ccccc3O1)[C@H]2C	ZINC000450780540	FH	On-Demand	Anodyne	ADRA2C	15	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)C[C@@H]1COc3ccccc3O1)[C@H]2C	ZINC000450780540	FH	On-Demand	Anodyne	HCRTR2	0	44
CC(=O)N1CCCN(C[C@@H]2CCCN(c3nc4cccc(F)c4n3C)C2)CC1	ZINC000450780570	GE	On-Demand	Anodyne	CCR3	52	34
CC(=O)N1CCCN(C[C@H]2CCCN(c3nc4cccc(F)c4n3C)C2)CC1	ZINC000450780573	GE	On-Demand	Anodyne	CCR3	52	34
C[C@@H](O)CCN1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450780584	CD	On-Demand	Anodyne	SLC6A1	89	37
C[C@H](O)CCN1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450780586	CD	On-Demand	Anodyne	SLC6A1	89	37
C[C@H](O)CCN1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC000450780587	CD	On-Demand	Anodyne	SLC6A1	89	37
C[C@@H](O)CCN1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000450780589	CD	On-Demand	Anodyne	SLC6A1	89	37
CC(C)(C)NC(=O)N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450780590	FF	On-Demand	Anodyne	FAAH	18	40
COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](CN3CCCN(C(C)=O)CC3)C2)c1	ZINC000450780603	GE	On-Demand	Bother	TAAR1	20	42
COc1ccc([N+](=O)[O-])c(N2CCC[C@H](CN3CCCN(C(C)=O)CC3)C2)c1	ZINC000450780604	GE	On-Demand	Bother	TAAR1	20	42
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450780617	CF	On-Demand	Anodyne	SLC6A1	87	37
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450780617	CF	On-Demand	Anodyne	HRH3	0	43
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450780617	CF	On-Demand	Anodyne	PREP	65	45
CCOC(=O)[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450780617	CF	On-Demand	Anodyne	CYP2J2	59	43
CC(C)(C)OC(=O)[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450780618	DE	On-Demand	Anodyne	SLC6A1	40	32
CC(C)(C)OC(=O)[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450780619	DE	On-Demand	Anodyne	SLC6A1	40	32
CO[C@H]1CCN(c2nc(N3CC[C@@H](OC)[C@H](C)C3)nc3ccccc23)C[C@@H]1C	ZINC000450780638	GG	On-Demand	Anodyne	PDE3A	40	36
CO[C@H]1CCN(c2nc(N3CC[C@@H](OC)[C@H](C)C3)nc3ccccc23)C[C@@H]1C	ZINC000450780638	GG	On-Demand	Anodyne	PDE3B	59	36
CO[C@H]1CCN(c2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc3ccccc23)C[C@@H]1C	ZINC000450780639	GG	On-Demand	Anodyne	PDE3A	40	36
CO[C@H]1CCN(c2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc3ccccc23)C[C@@H]1C	ZINC000450780639	GG	On-Demand	Anodyne	PDE3B	59	36
CO[C@H]1CCN(c2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc3ccccc23)C[C@H]1C	ZINC000450780640	GG	On-Demand	Anodyne	PDE3A	40	36
CO[C@H]1CCN(c2nc(N3CC[C@@H](OC)[C@@H](C)C3)nc3ccccc23)C[C@H]1C	ZINC000450780640	GG	On-Demand	Anodyne	PDE3B	59	36
CO[C@H]1CCN(c2nc(N3CC[C@@H](OC)[C@H](C)C3)nc3ccccc23)C[C@H]1C	ZINC000450780641	GG	On-Demand	Anodyne	PDE3A	40	36
CO[C@H]1CCN(c2nc(N3CC[C@@H](OC)[C@H](C)C3)nc3ccccc23)C[C@H]1C	ZINC000450780641	GG	On-Demand	Anodyne	PDE3B	59	36
CCN(C)C(=O)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450780646	ED	On-Demand	Anodyne	PDE8B	47	33
CCN(C)C(=O)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450780647	ED	On-Demand	Anodyne	PDE8B	47	33
C[C@@H](c1nccs1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450780653	EH	On-Demand	Anodyne	SIGMAR1	15	42
C[C@@H](c1nccs1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450780653	EH	On-Demand	Anodyne	KCNJ1	15	40
C[C@H](c1nccs1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450780654	EH	On-Demand	Anodyne	SIGMAR1	15	42
C[C@H](c1nccs1)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450780654	EH	On-Demand	Anodyne	KCNJ1	15	40
CO[C@H]1CCN(c2nc(C(F)F)nc3ccccc23)C[C@@H]1C	ZINC000450780661	DG	On-Demand	Anodyne	PDE3B	48	36
CO[C@@H]1CCN(c2nc(C(F)F)nc3ccccc23)C[C@@H]1C	ZINC000450780662	DG	On-Demand	Anodyne	PDE3B	48	36
CO[C@H]1CCN(c2nc(C(F)F)nc3ccccc23)C[C@H]1C	ZINC000450780663	DG	On-Demand	Anodyne	PDE3B	48	36
CO[C@@H]1CCN(c2nc(C(F)F)nc3ccccc23)C[C@H]1C	ZINC000450780664	DG	On-Demand	Anodyne	PDE3B	48	36
CCOC(=O)[C@H]1CCCN1C[C@H]1CCCCN1C(C)C	ZINC000450780669	CE	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@H]1CCCN1C[C@@H]1CCCCN1C(C)C	ZINC000450780670	CE	On-Demand	Anodyne	FKBP12.6	0	43
CSc1cccc(C(=O)N2CCC[C@H](OCC3CC3)C2)c1	ZINC000450780683	DG	On-Demand	Anodyne	RHOA	0	45
CSc1cccc(C(=O)N2CCC[C@@H](OCC3CC3)C2)c1	ZINC000450780684	DG	On-Demand	Anodyne	RHOA	0	45
CCOC(=O)c1ccc(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)nc1	ZINC000450780685	GE	On-Demand	Anodyne	NPFFR1	47	35
CCOC(=O)c1ccc(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)nc1	ZINC000450780686	GE	On-Demand	Anodyne	NPFFR1	47	35
CN1CC[C@@H]2CN(c3nccc(C(F)F)n3)C[C@@H]21	ZINC000450780687	CD	On-Demand	Anodyne	SORD	42	34
CCCc1cc(C(=O)Nc2cccc(C(N)=O)c2OC)no1	ZINC000450780688	DD	On-Demand	Anodyne	G2YM83_BOTF4	57	33
CC[C@]1(CO)CCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780698	FE	On-Demand	Anodyne	MTNR1A	40	41
CC[C@]1(CO)CCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780698	FE	On-Demand	Anodyne	MTNR1B	37	41
CC[C@@]1(CO)CCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780699	FE	On-Demand	Anodyne	MTNR1A	40	41
CC[C@@]1(CO)CCCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780699	FE	On-Demand	Anodyne	MTNR1B	37	41
COc1c(NC(=O)c2cccc3c2CCCC3)cccc1C(N)=O	ZINC000450780704	DF	On-Demand	Anodyne	PAGA	0	42
COc1c(NC(=O)c2cccc3c2CCCC3)cccc1C(N)=O	ZINC000450780704	DF	On-Demand	Anodyne	G2YM83_BOTF4	48	36
CC[C@@]1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780716	ED	On-Demand	Anodyne	HTR7	25	40
CC[C@@]1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780716	ED	On-Demand	Anodyne	MTNR1A	50	36
CC[C@@]1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780716	ED	On-Demand	Anodyne	MTNR1B	34	42
CC[C@]1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780717	ED	On-Demand	Anodyne	HTR7	25	40
CC[C@]1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780717	ED	On-Demand	Anodyne	MTNR1A	50	36
CC[C@]1(O)CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450780717	ED	On-Demand	Anodyne	MTNR1B	34	42
CCC[C@@H](OC)C(=O)Nc1cccc(C(N)=O)c1OC	ZINC000450780731	CD	On-Demand	Anodyne	PARP10	0	41
CCC[C@H](OC)C(=O)Nc1cccc(C(N)=O)c1OC	ZINC000450780732	CD	On-Demand	Anodyne	PARP10	0	41
O=C(c1ccnc(OC(F)F)c1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450780741	EF	On-Demand	Anodyne	PDE4D	41	44
O=C(c1ccnc(OC(F)F)c1)N1CCC[C@H](OCC2CC2)C1	ZINC000450780742	EF	On-Demand	Anodyne	PDE4D	41	44
Cc1cnc2c(C)cccc2c1N1C[C@H]2CCN(C)[C@H]2C1	ZINC000450780751	CF	On-Demand	Anodyne	ATP4A	18	41
CCOC(=O)c1cc(C(=O)N2CCC[C@H](OCC3CC3)C2)[nH]c1C	ZINC000450780753	EF	On-Demand	Anodyne	AKR1C3	28	40
CCOC(=O)c1cc(C(=O)N2CCC[C@@H](OCC3CC3)C2)[nH]c1C	ZINC000450780754	EF	On-Demand	Anodyne	AKR1C3	28	40
CC(=O)c1cccc(CN2CCC(O)(C(F)F)CC2)c1	ZINC000450780756	CE	On-Demand	Anodyne	MCHR2	40	34
CC(=O)c1cccc(CN2CCC(O)(C(F)F)CC2)c1	ZINC000450780756	CE	On-Demand	Anodyne	CCR8	34	40
CC(=O)c1cccc(CN2CCC(O)(C(F)F)CC2)c1	ZINC000450780756	CE	On-Demand	Anodyne	NPFFR1	46	33
COc1cccc2c1CCN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C2	ZINC000450780757	FG	On-Demand	Anodyne	DRD4	41	33
COc1cccc2c1CCN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C2	ZINC000450780757	FG	On-Demand	Anodyne	COLA	58	42
COc1cccc2c1CCN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C2	ZINC000450780757	FG	On-Demand	Anodyne	CPT1A	49	35
COc1cccc2c1CCN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C2	ZINC000450780757	FG	On-Demand	Anodyne	CPT2	42	42
COc1cccc2c1CCN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C2	ZINC000450780757	FG	On-Demand	Anodyne	KCNK3	42	34
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC[C@H](OCC3CC3)C2)c1	ZINC000450780767	FH	On-Demand	Anodyne	LIPG	18	40
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC[C@@H](OCC3CC3)C2)c1	ZINC000450780768	FH	On-Demand	Anodyne	LIPG	18	40
CO[C@@H]1CCN(c2ccnc(C3CC3)n2)C[C@@H]1C	ZINC000450780785	BE	On-Demand	Anodyne	SORD	48	35
CO[C@H]1CCN(c2ccnc(C3CC3)n2)C[C@@H]1C	ZINC000450780786	BE	On-Demand	Anodyne	SORD	48	35
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450780787	GI	On-Demand	Anodyne	HRH4	20	42
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCC[C@@H](OCC2CC2)C1	ZINC000450780787	GI	On-Demand	Anodyne	AKR1C3	0	41
CO[C@H]1CCN(c2ccnc(C3CC3)n2)C[C@H]1C	ZINC000450780788	BE	On-Demand	Anodyne	SORD	48	35
CO[C@@H]1CCN(c2ccnc(C3CC3)n2)C[C@H]1C	ZINC000450780789	BE	On-Demand	Anodyne	SORD	48	35
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCC[C@H](OCC2CC2)C1	ZINC000450780790	GI	On-Demand	Anodyne	HRH4	20	42
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCC[C@H](OCC2CC2)C1	ZINC000450780790	GI	On-Demand	Anodyne	AKR1C3	0	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(OC(F)F)n(C)n1	ZINC000450780793	GE	On-Demand	Anodyne	MAP3K5	44	34
COC[C@H](CNC(=O)C1(Cc2cccc(Cl)c2)CC1)OC	ZINC000450780797	DE	On-Demand	Anodyne	PDS	40	33
COC[C@@H](CNC(=O)C1(Cc2cccc(Cl)c2)CC1)OC	ZINC000450780798	DE	On-Demand	Anodyne	PDS	40	33
CO[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@H]1C	ZINC000450780809	FC	On-Demand	Anodyne	GCKR	48	36
CO[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H]1C	ZINC000450780810	FC	On-Demand	Anodyne	GCKR	48	36
CO[C@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H]1C	ZINC000450780811	FC	On-Demand	Anodyne	GCKR	48	36
CO[C@H]1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@H]1C	ZINC000450780812	FC	On-Demand	Anodyne	GCKR	48	36
CCOC(=O)c1cccnc1N1CC[C@H](OC)[C@@H](C)C1	ZINC000450780813	CE	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)c1cccnc1N1CC[C@@H](OC)[C@H](C)C1	ZINC000450780814	CE	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)c1cccnc1N1CC[C@@H](OC)[C@@H](C)C1	ZINC000450780815	CE	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)c1cccnc1N1CC[C@H](OC)[C@H](C)C1	ZINC000450780816	CE	On-Demand	Anodyne	P2RY12	44	35
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(C#N)c(Cl)c3)CC2)CC1	ZINC000450780823	FE	On-Demand	Mild	PGR	23	42
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(C#N)c(Cl)c3)CC2)CC1	ZINC000450780823	FE	On-Demand	Mild	NR3C2	34	42
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(C#N)c(Cl)c3)CC2)CC1	ZINC000450780823	FE	On-Demand	Mild	AR	34	58
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(C#N)c(Cl)c3)CC2)CC1	ZINC000450780823	FE	On-Demand	Mild	SSTR1	60	37
CC(=O)N1CCN(C(=O)C2CCN(c3ccc(C#N)c(Cl)c3)CC2)CC1	ZINC000450780823	FE	On-Demand	Mild	CSF1R	17	40
CCOC(=O)[C@H](NC(=O)c1ocnc1-c1ccccc1)[C@@H]1CCCOC1	ZINC000450780857	FE	On-Demand	Anodyne	P2RY12	84	40
CCOC(=O)[C@H](NC(=O)c1ocnc1-c1ccccc1)[C@H]1CCCOC1	ZINC000450780858	FE	On-Demand	Anodyne	P2RY12	84	40
CCOC(=O)[C@@H](NC(=O)c1ocnc1-c1ccccc1)[C@H]1CCCOC1	ZINC000450780860	FE	On-Demand	Anodyne	P2RY12	84	40
CCOC(=O)[C@@H](NC(=O)c1ocnc1-c1ccccc1)[C@@H]1CCCOC1	ZINC000450780862	FE	On-Demand	Anodyne	P2RY12	84	40
O=C(N[C@@H](c1cccc2ccccc12)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450780863	EH	On-Demand	Anodyne	KCNJ11	85	42
O=C(N[C@@H](c1cccc2ccccc12)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450780865	EH	On-Demand	Anodyne	KCNJ11	85	42
O=C(N[C@H](c1cccc2ccccc12)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450780866	EH	On-Demand	Anodyne	KCNJ11	85	42
O=C(N[C@H](c1cccc2ccccc12)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450780867	EH	On-Demand	Anodyne	KCNJ11	85	42
COc1ccc(CNc2nnc(SC[C@H](O)CC#N)s2)cc1	ZINC000450780868	ED	On-Demand	Mild	PROKR1	43	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCS(=O)(=O)c2ccccc2C1	ZINC000450780892	GE	On-Demand	Anodyne	GHRHR	57	35
CNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450780914	DD	On-Demand	Bother	TAAR1	20	53
CNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450780916	DD	On-Demand	Bother	TAAR1	20	53
CNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450780917	DD	On-Demand	Bother	TAAR1	20	53
CNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450780919	DD	On-Demand	Bother	TAAR1	20	53
COC(=O)C1(CN2CCC(O)(Cc3ccc(F)cc3)CC2)CC1	ZINC000450780931	DE	On-Demand	Anodyne	UTS2R	15	41
CS(=O)(=O)c1ccc(N2C[C@H]3CCCC[C@H]3C2)c(C(F)(F)F)c1	ZINC000450780933	EH	On-Demand	Anodyne	PTGS2	21	44
CS(=O)(=O)c1ccc(N2C[C@H]3CCCC[C@H]3C2)c(C(F)(F)F)c1	ZINC000450780933	EH	On-Demand	Anodyne	HSD11B1	23	42
O=C(NCc1ccccc1CN1CC[C@H](O)C1)[C@H](O)C1CCC1	ZINC000450780934	DD	On-Demand	Anodyne	OPRK1	0	40
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)[C@H](O)C1CCC1	ZINC000450780935	DD	On-Demand	Anodyne	OPRK1	0	40
O=C(NCc1ccccc1CN1CC[C@H](O)C1)[C@@H](O)C1CCC1	ZINC000450780936	DD	On-Demand	Anodyne	OPRK1	0	40
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)[C@@H](O)C1CCC1	ZINC000450780937	DD	On-Demand	Anodyne	OPRK1	0	40
COCCOC[C@@H](O)CN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450780970	ED	On-Demand	Anodyne	HSP90AB1	36	43
COCCOC[C@H](O)CN1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450780971	ED	On-Demand	Anodyne	HSP90AB1	36	43
C[C@H]1CN(CCN(C)Cc2ccccc2)CCN1CCO	ZINC000450780983	CD	On-Demand	Anodyne	SIGMAR1	29	42
C[C@H]1CN(CCN(C)Cc2ccccc2)CCN1CCO	ZINC000450780983	CD	On-Demand	Anodyne	CCR5	15	41
C[C@@H]1CN(CCN(C)Cc2ccccc2)CCN1CCO	ZINC000450780984	CD	On-Demand	Anodyne	SIGMAR1	29	42
C[C@@H]1CN(CCN(C)Cc2ccccc2)CCN1CCO	ZINC000450780984	CD	On-Demand	Anodyne	CCR5	15	41
CN1CC[C@@H]2CN(c3ncnc4cc(Br)ccc34)C[C@@H]21	ZINC000450780996	EF	On-Demand	Anodyne	PDE3A	46	35
Cc1cccc(Cl)c1C(=O)N1CCC(CCCO)CC1	ZINC000450781010	CG	On-Demand	Anodyne	L3MBTL3	41	35
Cc1cc(C2CCN(Cc3cnns3)CC2)ccc1Br	ZINC000450781014	FH	On-Demand	Anodyne	MGEA5	25	40
CN(C[C@H]1CCCCC1(F)F)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781015	FG	On-Demand	Anodyne	SIGMAR1	48	38
CN(C[C@H]1CCCCC1(F)F)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781015	FG	On-Demand	Anodyne	CACNA1G	15	43
CN(C[C@H]1CCCCC1(F)F)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781015	FG	On-Demand	Anodyne	NPFFR1	40	33
CN(C[C@@H]1CCCCC1(F)F)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781016	FG	On-Demand	Anodyne	SIGMAR1	48	38
CN(C[C@@H]1CCCCC1(F)F)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781016	FG	On-Demand	Anodyne	CACNA1G	15	43
CN(C[C@@H]1CCCCC1(F)F)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781016	FG	On-Demand	Anodyne	NPFFR1	40	33
CN(C[C@@H]1CCCCC1(F)F)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781017	FG	On-Demand	Anodyne	SIGMAR1	48	38
CN(C[C@@H]1CCCCC1(F)F)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781017	FG	On-Demand	Anodyne	CACNA1G	15	43
CN(C[C@@H]1CCCCC1(F)F)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781017	FG	On-Demand	Anodyne	NPFFR1	40	33
CN(C[C@H]1CCCCC1(F)F)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781018	FG	On-Demand	Anodyne	SIGMAR1	48	38
CN(C[C@H]1CCCCC1(F)F)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781018	FG	On-Demand	Anodyne	CACNA1G	15	43
CN(C[C@H]1CCCCC1(F)F)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450781018	FG	On-Demand	Anodyne	NPFFR1	40	33
CN1CC[C@@H]2CN(c3nc4ccccc4n3C)C[C@@H]21	ZINC000450781022	CD	On-Demand	Anodyne	HRH1	21	56
CN1CC[C@@H]2CN(c3nc4ccccc4n3C)C[C@@H]21	ZINC000450781022	CD	On-Demand	Anodyne	GRM2	15	41
CCCOc1ccc(C(=O)N2CCC[C@H](OCC3CC3)C2)c(OC)c1	ZINC000450781033	EH	On-Demand	Anodyne	OXTR	25	41
CCCOc1ccc(C(=O)N2CCC[C@@H](OCC3CC3)C2)c(OC)c1	ZINC000450781034	EH	On-Demand	Anodyne	OXTR	25	41
Cc1cc(C#N)cc(N2C[C@H]3CCN(C)[C@H]3C2)n1	ZINC000450781037	BD	On-Demand	Mild	GPR119	18	42
COC(=O)c1cc(C#N)c(=O)n(CCCCc2ccc(Cl)c(Cl)c2)c1	ZINC000450781041	GH	On-Demand	Mild	HSP90AB1	41	32
COC(=O)c1cc(C#N)c(=O)n(CCCCc2ccc(Cl)c(Cl)c2)c1	ZINC000450781041	GH	On-Demand	Mild	DNAE	72	34
COC(=O)c1coc(CN2CCC(Cc3ccc(C(C)C)cc3)CC2)n1	ZINC000450781094	FI	On-Demand	Anodyne	CCR3	43	39
COC(=O)c1coc(CN2CCC(Cc3ccc(C(C)C)cc3)CC2)n1	ZINC000450781094	FI	On-Demand	Anodyne	MCHR1	18	44
CO[C@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C[C@@H]1C	ZINC000450781136	EI	On-Demand	Anodyne	PDE3A	51	44
CO[C@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C[C@@H]1C	ZINC000450781136	EI	On-Demand	Anodyne	PDE3B	51	44
CO[C@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C[C@H]1C	ZINC000450781137	EI	On-Demand	Anodyne	PDE3A	51	44
CO[C@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C[C@H]1C	ZINC000450781137	EI	On-Demand	Anodyne	PDE3B	51	44
CO[C@@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C[C@H]1C	ZINC000450781138	EI	On-Demand	Anodyne	PDE3A	51	44
CO[C@@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C[C@H]1C	ZINC000450781138	EI	On-Demand	Anodyne	PDE3B	51	44
CO[C@@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C[C@@H]1C	ZINC000450781139	EI	On-Demand	Anodyne	PDE3A	51	44
CO[C@@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C[C@@H]1C	ZINC000450781139	EI	On-Demand	Anodyne	PDE3B	51	44
COCc1nc(N2CC[C@H](OC)[C@H](C)C2)c2c(-c3ccccc3)csc2n1	ZINC000450781144	GI	On-Demand	Anodyne	ADRB3	0	40
COCc1nc(N2CC[C@@H](OC)[C@H](C)C2)c2c(-c3ccccc3)csc2n1	ZINC000450781145	GI	On-Demand	Anodyne	ADRB3	0	40
COCc1nc(N2CC[C@@H](OC)[C@@H](C)C2)c2c(-c3ccccc3)csc2n1	ZINC000450781146	GI	On-Demand	Anodyne	ADRB3	0	40
COCc1nc(N2CC[C@H](OC)[C@@H](C)C2)c2c(-c3ccccc3)csc2n1	ZINC000450781147	GI	On-Demand	Anodyne	ADRB3	0	40
CC(C)OC(=O)C[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450781171	FH	On-Demand	Anodyne	SLC6A1	67	32
CC(C)OC(=O)C[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450781171	FH	On-Demand	Anodyne	BIRC2	48	40
CC(C)OC(=O)C[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450781172	FH	On-Demand	Anodyne	SLC6A1	67	32
CC(C)OC(=O)C[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450781172	FH	On-Demand	Anodyne	BIRC2	48	40
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CC(NC(=O)C2CCC2)C1	ZINC000450781183	DE	On-Demand	Anodyne	EPHX2	19	41
Clc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1	ZINC000450781184	CF	On-Demand	Anodyne	PDE3B	61	35
Clc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1	ZINC000450781184	CF	On-Demand	Anodyne	HTT	0	42
Clc1ccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1	ZINC000450781185	CF	On-Demand	Anodyne	PDE3B	61	35
Clc1ccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1	ZINC000450781185	CF	On-Demand	Anodyne	HTT	0	42
Clc1ccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2c1	ZINC000450781186	CF	On-Demand	Anodyne	PDE3B	61	35
Clc1ccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2c1	ZINC000450781186	CF	On-Demand	Anodyne	HTT	0	42
COC(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1Cl	ZINC000450781214	GH	On-Demand	Anodyne	SIGMAR1	27	43
COC(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1Cl	ZINC000450781214	GH	On-Demand	Anodyne	ADAM17	15	43
COC(=O)c1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1Cl	ZINC000450781214	GH	On-Demand	Anodyne	MCHR2	45	37
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	DRD2	29	40
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	DRD4	38	43
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	ACHE	22	43
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	HRH1	25	48
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	HTR4	57	40
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	SIGMAR1	33	44
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	SSTR5	73	46
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	CCR3	40	42
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	MCHR1	43	47
COc1cc(CN2CCC([C@@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781252	DG	On-Demand	Anodyne	CCR8	24	41
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	DRD2	29	40
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	DRD4	38	43
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	ACHE	22	43
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	HRH1	25	48
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	HTR4	57	40
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	SIGMAR1	33	44
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	SSTR5	73	46
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	CCR3	40	42
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	MCHR1	43	47
COc1cc(CN2CCC([C@H](C)NC(C)=O)CC2)ccc1Cl	ZINC000450781253	DG	On-Demand	Anodyne	CCR8	24	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCO[C@H](COCC2CC2)C1	ZINC000450781254	FG	On-Demand	Anodyne	LIPG	53	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCO[C@@H](COCC2CC2)C1	ZINC000450781255	FG	On-Demand	Anodyne	LIPG	53	42
Brc1cncc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1	ZINC000450781273	CE	On-Demand	Anodyne	CHRNA3	15	47
Brc1cncc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1	ZINC000450781273	CE	On-Demand	Anodyne	CHRNA4	42	56
Brc1cncc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1	ZINC000450781274	CE	On-Demand	Anodyne	CHRNA3	15	47
Brc1cncc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1	ZINC000450781274	CE	On-Demand	Anodyne	CHRNA4	42	56
Cc1csc([C@@H]2COCCN2CCc2ccc(Cl)cc2)n1	ZINC000450781281	DH	On-Demand	Anodyne	SPHK2	60	36
Cc1csc([C@@H]2COCCN2CCc2ccc(Cl)cc2)n1	ZINC000450781281	DH	On-Demand	Anodyne	SPHK1	47	36
Cc1csc([C@H]2COCCN2CCc2ccc(Cl)cc2)n1	ZINC000450781282	DH	On-Demand	Anodyne	SPHK2	60	36
Cc1csc([C@H]2COCCN2CCc2ccc(Cl)cc2)n1	ZINC000450781282	DH	On-Demand	Anodyne	SPHK1	47	36
C=C(C)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450781286	BG	On-Demand	Mild	SCN9A	25	41
C=C(C)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450781287	BG	On-Demand	Mild	SCN9A	25	41
C=C(C)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450781288	BG	On-Demand	Mild	SCN9A	25	41
C=C(C)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450781289	BG	On-Demand	Mild	SCN9A	25	41
CCOC(=O)[C@@H](NC(=O)c1ccc(-c2ccncc2)c(F)c1)[C@@H]1CCCOC1	ZINC000450781316	GF	On-Demand	Anodyne	ROCK2	36	41
CCOC(=O)[C@@H](NC(=O)c1ccc(-c2ccncc2)c(F)c1)[C@H]1CCCOC1	ZINC000450781320	GF	On-Demand	Anodyne	ROCK2	36	41
CCOC(=O)[C@H](NC(=O)c1ccc(-c2ccncc2)c(F)c1)[C@H]1CCCOC1	ZINC000450781322	GF	On-Demand	Anodyne	ROCK2	36	41
CCOC(=O)[C@H](NC(=O)c1ccc(-c2ccncc2)c(F)c1)[C@@H]1CCCOC1	ZINC000450781323	GF	On-Demand	Anodyne	ROCK2	36	41
CC(C)(O)CCNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450781331	DE	On-Demand	Anodyne	TRPV1	17	42
CO[C@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@@H]1C	ZINC000450781336	FG	On-Demand	Anodyne	CXCR3	34	40
CO[C@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@@H]1C	ZINC000450781336	FG	On-Demand	Anodyne	L3MBTL3	42	33
CO[C@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@H]1C	ZINC000450781338	FG	On-Demand	Anodyne	CXCR3	34	40
CO[C@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@H]1C	ZINC000450781338	FG	On-Demand	Anodyne	L3MBTL3	42	33
CO[C@@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@H]1C	ZINC000450781340	FG	On-Demand	Anodyne	CXCR3	34	40
CO[C@@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@H]1C	ZINC000450781340	FG	On-Demand	Anodyne	L3MBTL3	42	33
CO[C@@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@@H]1C	ZINC000450781342	FG	On-Demand	Anodyne	CXCR3	34	40
CO[C@@H]1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@@H]1C	ZINC000450781342	FG	On-Demand	Anodyne	L3MBTL3	42	33
CN1CC[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C[C@@H]21	ZINC000450781347	FG	On-Demand	Anodyne	PRNP	52	44
CN1CC[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C[C@@H]21	ZINC000450781347	FG	On-Demand	Anodyne	HDAC1	33	43
CN1CC[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C[C@@H]21	ZINC000450781347	FG	On-Demand	Anodyne	CSF1R	22	40
CN1CC[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C[C@@H]21	ZINC000450781347	FG	On-Demand	Anodyne	TAAR1	36	46
CN1CC[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C[C@@H]21	ZINC000450781347	FG	On-Demand	Anodyne	HT1	0	50
CN1CC[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C[C@@H]21	ZINC000450781347	FG	On-Demand	Anodyne	KCNK3	59	40
CN1CC[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C[C@@H]21	ZINC000450781347	FG	On-Demand	Anodyne	KCNK9	35	40
CN1CC[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C[C@@H]21	ZINC000450781347	FG	On-Demand	Anodyne	LMGT2	0	50
C=C(C)CNC(=O)c1cccc2c1CCCC2	ZINC000450781372	BF	On-Demand	Mild	FABP4	46	36
COC(=O)CNC(=O)c1ccc(N2CC[C@H](OC)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450781379	FD	On-Demand	Bother	TAAR1	23	49
COC(=O)CNC(=O)c1ccc(N2CC[C@@H](OC)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450781380	FD	On-Demand	Bother	TAAR1	23	49
COC(=O)CNC(=O)c1ccc(N2CC[C@H](OC)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450781382	FD	On-Demand	Bother	TAAR1	23	49
COC(=O)CNC(=O)c1ccc(N2CC[C@@H](OC)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450781383	FD	On-Demand	Bother	TAAR1	23	49
COC(=O)c1csc(CN2CCC(c3noc(C4CC4)n3)CC2)n1	ZINC000450781390	EF	On-Demand	Anodyne	ETHR	57	39
CC(=O)c1cccc(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450781397	FF	On-Demand	Anodyne	NPFFR1	51	34
CC(=O)c1cccc(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450781398	FF	On-Demand	Anodyne	NPFFR1	51	34
CN1CC[C@@H]2CN(c3ncc(Cl)cn3)C[C@@H]21	ZINC000450781417	BD	On-Demand	Anodyne	GPR119	16	41
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450781418	FG	On-Demand	Anodyne	CETP	0	42
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450781418	FG	On-Demand	Anodyne	LIPG	56	41
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450781420	FG	On-Demand	Anodyne	CETP	0	42
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450781420	FG	On-Demand	Anodyne	LIPG	56	41
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450781421	FG	On-Demand	Anodyne	CETP	0	42
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450781421	FG	On-Demand	Anodyne	LIPG	56	41
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450781422	FG	On-Demand	Anodyne	CETP	0	42
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450781422	FG	On-Demand	Anodyne	LIPG	56	41
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	COLA	50	38
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	CPT1A	51	38
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	CPT2	44	38
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	PRNP	32	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	GRM4	23	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	HDAC1	31	45
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	MCHR1	16	46
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	TAAR1	44	45
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	DGAT1	37	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781430	FH	On-Demand	Anodyne	KCNK3	51	36
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	COLA	50	38
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	CPT1A	51	38
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	CPT2	44	38
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	PRNP	32	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	GRM4	23	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	HDAC1	31	45
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	MCHR1	16	46
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	TAAR1	44	45
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	DGAT1	37	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1C	ZINC000450781433	FH	On-Demand	Anodyne	KCNK3	51	36
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	COLA	50	38
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	CPT1A	51	38
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	CPT2	44	38
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	PRNP	32	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	GRM4	23	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	HDAC1	31	45
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	MCHR1	16	46
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	TAAR1	44	45
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	DGAT1	37	42
CO[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781435	FH	On-Demand	Anodyne	KCNK3	51	36
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	COLA	50	38
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	CPT1A	51	38
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	CPT2	44	38
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	PRNP	32	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	GRM4	23	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	HDAC1	31	45
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	MCHR1	16	46
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	TAAR1	44	45
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	DGAT1	37	42
CO[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H]1C	ZINC000450781437	FH	On-Demand	Anodyne	KCNK3	51	36
CC[C@@H](O)CC(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450781440	CD	On-Demand	Anodyne	ENPP1	51	32
CC[C@H](O)CC(=O)Nc1ccc(OCCO)c(C)c1	ZINC000450781441	CD	On-Demand	Anodyne	ENPP1	51	32
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450781467	GD	On-Demand	Anodyne	ESRRA	17	42
CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450781467	GD	On-Demand	Anodyne	CCKAR	52	34
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450781468	GD	On-Demand	Anodyne	ESRRA	17	42
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450781468	GD	On-Demand	Anodyne	CCKAR	52	34
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450781469	GD	On-Demand	Anodyne	ESRRA	17	42
CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450781469	GD	On-Demand	Anodyne	CCKAR	52	34
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450781470	GD	On-Demand	Anodyne	ESRRA	17	42
CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450781470	GD	On-Demand	Anodyne	CCKAR	52	34
Brc1cncc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1	ZINC000450781476	CE	On-Demand	Anodyne	CHRNA3	15	47
Brc1cncc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1	ZINC000450781476	CE	On-Demand	Anodyne	CHRNA4	42	56
COC(=O)c1ccc(CC(=O)N2[C@@H](C)c3ccc(OC)cc3C[C@H]2C)cc1	ZINC000450781478	FH	On-Demand	Anodyne	HCRTR2	0	40
COC(=O)c1ccc(CC(=O)N2[C@@H](C)Cc3cc(OC)ccc3[C@@H]2C)cc1	ZINC000450781479	FH	On-Demand	Anodyne	HCRTR2	0	40
COC(=O)c1ccc(CC(=O)N2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)cc1	ZINC000450781480	FH	On-Demand	Anodyne	HCRTR2	0	40
COC(=O)c1ccc(CC(=O)N2[C@@H](C)Cc3cc(OC)ccc3[C@H]2C)cc1	ZINC000450781481	FH	On-Demand	Anodyne	HCRTR2	0	40
CCc1nc(SCc2ccc(C(=O)OC)cc2Br)n[nH]1	ZINC000450781494	FG	On-Demand	Anodyne	METAP2	0	45
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccnc2cc1F	ZINC000450781506	DF	On-Demand	Anodyne	PDE3A	43	34
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccnc2cc1F	ZINC000450781506	DF	On-Demand	Anodyne	PDE3B	64	34
COc1cc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccnc2cc1F	ZINC000450781507	DF	On-Demand	Anodyne	PDE3A	43	34
COc1cc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ccnc2cc1F	ZINC000450781507	DF	On-Demand	Anodyne	PDE3B	64	34
COc1cc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ccnc2cc1F	ZINC000450781508	DF	On-Demand	Anodyne	PDE3A	43	34
COc1cc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ccnc2cc1F	ZINC000450781508	DF	On-Demand	Anodyne	PDE3B	64	34
CC(C)OC(=O)[C@@H](Nc1nc2ccccc2o1)C(C)C	ZINC000450781546	CG	On-Demand	Anodyne	ELANE	16	40
Cc1ccc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450781563	CE	On-Demand	Anodyne	PDE3B	65	34
Cc1ccc2ncnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2c1	ZINC000450781564	CE	On-Demand	Anodyne	PDE3B	65	34
Cc1ccc2ncnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450781565	CE	On-Demand	Anodyne	PDE3B	65	34
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450781572	FG	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450781572	FG	On-Demand	Anodyne	SIGMAR1	18	41
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450781572	FG	On-Demand	Anodyne	P2RX7	43	38
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000450781572	FG	On-Demand	Anodyne	EPHX2	20	42
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450781573	FG	On-Demand	Anodyne	VACHT_TETCF	0	41
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450781573	FG	On-Demand	Anodyne	SIGMAR1	18	41
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450781573	FG	On-Demand	Anodyne	P2RX7	43	38
Cc1cccc(Cl)c1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000450781573	FG	On-Demand	Anodyne	EPHX2	20	42
COc1c(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cccc1C(N)=O	ZINC000450781590	FE	On-Demand	Anodyne	F10	20	42
COc1c(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cccc1C(N)=O	ZINC000450781590	FE	On-Demand	Anodyne	HDAC1	28	48
O=C1NC(=O)[C@H]2CN(c3nc4ccccc4nc3N3CCOCC3)C[C@@H]12	ZINC000450781593	FC	On-Demand	Anodyne	PIK3CB	43	37
CC(C)CCCC(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450781594	CG	On-Demand	Anodyne	PREP	15	40
CC(C)CCCC(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450781595	CG	On-Demand	Anodyne	PREP	15	40
C=C(C)CNC(=O)C(CC(C)C)CC(C)C	ZINC000450781598	BG	On-Demand	Mild	MME	17	41
CN1CC[C@@H]2CN(c3ccnc(C4CC4)n3)C[C@@H]21	ZINC000450781604	BD	On-Demand	Anodyne	SORD	51	38
CN1CC[C@@H]2CN(c3ccc(C(=O)N4CCc5ccccc54)cn3)C[C@@H]21	ZINC000450781614	EE	On-Demand	Anodyne	AVPR1A	55	40
CC[C@]1(O)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450781615	CE	On-Demand	Anodyne	MCHR2	40	31
CC[C@]1(O)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450781615	CE	On-Demand	Anodyne	NPFFR1	41	37
CC[C@@]1(O)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450781616	CE	On-Demand	Anodyne	MCHR2	40	31
CC[C@@]1(O)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)C1	ZINC000450781616	CE	On-Demand	Anodyne	NPFFR1	41	37
COC(=O)c1cc(C#N)c(=O)n(Cc2ccc([C@@H](C)C(F)(F)F)cc2)c1	ZINC000450781629	FG	On-Demand	Mild	CTSF	41	30
COC(=O)c1cc(C#N)c(=O)n(Cc2ccc([C@H](C)C(F)(F)F)cc2)c1	ZINC000450781630	FG	On-Demand	Mild	CTSF	41	30
COc1ccc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)ncnc2c1F	ZINC000450781661	DD	On-Demand	Anodyne	PDE3A	47	37
COC(=O)c1ccc(CC(=O)N2CC(NC(=O)C3CCC3)C2)cc1	ZINC000450781692	ED	On-Demand	Anodyne	EPHX2	23	40
CCS(=O)(=O)c1ccc(CN(C)Cc2ccc(OCC(=O)OC)cc2)cc1	ZINC000450781707	GF	On-Demand	Anodyne	MMP13	48	38
CCS(=O)(=O)c1ccc(CN(C)Cc2ccc(OCC(=O)OC)cc2)cc1	ZINC000450781707	GF	On-Demand	Anodyne	LIMK2	23	40
FC(F)(F)c1ccccc1OCC1CCN(Cc2cnns2)CC1	ZINC000450781730	FH	On-Demand	Anodyne	SIGMAR1	20	45
COC(=O)c1csc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)n1	ZINC000450781739	FF	On-Demand	Anodyne	UTS2R	0	44
OC[C@H](C1CC1)[C@@H](Nc1nc2ccccc2nc1N1CCOCC1)C1CC1	ZINC000450781744	FE	On-Demand	Anodyne	PIK3CA	17	40
OC[C@@H](C1CC1)[C@@H](Nc1nc2ccccc2nc1N1CCOCC1)C1CC1	ZINC000450781745	FE	On-Demand	Anodyne	PIK3CA	17	40
OC[C@@H](C1CC1)[C@H](Nc1nc2ccccc2nc1N1CCOCC1)C1CC1	ZINC000450781746	FE	On-Demand	Anodyne	PIK3CA	17	40
OC[C@H](C1CC1)[C@H](Nc1nc2ccccc2nc1N1CCOCC1)C1CC1	ZINC000450781747	FE	On-Demand	Anodyne	PIK3CA	17	40
CCc1nc(SCc2cc(C)ccc2F)n[nH]1	ZINC000450781752	CG	On-Demand	Anodyne	METAP2	15	41
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1	ZINC000450781770	EG	On-Demand	Bother	LIPG	41	31
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450781771	EG	On-Demand	Bother	LIPG	41	31
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450781772	EG	On-Demand	Bother	LIPG	41	31
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450781791	EI	On-Demand	Anodyne	CACNA1B	45	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450781791	EI	On-Demand	Anodyne	LIPC	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450781791	EI	On-Demand	Anodyne	SLC6A9	18	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](OCC2CC2)C1	ZINC000450781791	EI	On-Demand	Anodyne	LIPG	62	55
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450781792	EI	On-Demand	Anodyne	CACNA1B	45	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450781792	EI	On-Demand	Anodyne	LIPC	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450781792	EI	On-Demand	Anodyne	SLC6A9	18	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](OCC2CC2)C1	ZINC000450781792	EI	On-Demand	Anodyne	LIPG	62	55
COc1cc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)ncnc2cc1F	ZINC000450781807	DD	On-Demand	Anodyne	PDE3A	60	45
COc1cc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)ncnc2cc1F	ZINC000450781807	DD	On-Demand	Anodyne	PDGFRB	68	41
COc1cc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)ncnc2cc1F	ZINC000450781807	DD	On-Demand	Anodyne	PDE3B	89	45
CCN(CC)CCCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450781812	FG	On-Demand	Anodyne	ENPP2	20	41
CCN(CC)CCCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450781812	FG	On-Demand	Anodyne	HPGDS	15	40
CCN(CC)CCCC1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450781812	FG	On-Demand	Anodyne	L3MBTL3	53	36
CN1CC[C@H]2CN(c3nc(N4C[C@H]5CCN(C)[C@H]5C4)nc4ccccc34)C[C@H]21	ZINC000450781814	GD	On-Demand	Anodyne	HTR3A	15	42
CC[C@@]1(CO)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450781842	CG	On-Demand	Anodyne	DRD2	30	42
CC[C@@]1(CO)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450781842	CG	On-Demand	Anodyne	SLC6A1	42	33
CC[C@]1(CO)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450781843	CG	On-Demand	Anodyne	DRD2	30	42
CC[C@]1(CO)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450781843	CG	On-Demand	Anodyne	SLC6A1	42	33
CN1CC[C@@H]2CN(c3ccnc(N4CCCCC4)n3)C[C@@H]21	ZINC000450781847	CD	On-Demand	Anodyne	SORD	51	43
COc1ccc(CNC(=O)CCN2CC[C@H](C)C[C@H]2C(N)=O)c(OC)c1	ZINC000450781867	FD	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(CNC(=O)CCN2CC[C@@H](C)C[C@H]2C(N)=O)c(OC)c1	ZINC000450781868	FD	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(CNC(=O)CCN2CC[C@@H](C)C[C@@H]2C(N)=O)c(OC)c1	ZINC000450781869	FD	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(CNC(=O)CCN2CC[C@H](C)C[C@@H]2C(N)=O)c(OC)c1	ZINC000450781870	FD	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cncc(Cl)c1)[C@H]2C	ZINC000450781879	EH	On-Demand	Anodyne	HCRTR2	0	52
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cncc(Cl)c1)[C@@H]2C	ZINC000450781880	EH	On-Demand	Anodyne	HCRTR2	0	52
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cncc(Cl)c1)[C@H]2C	ZINC000450781881	EH	On-Demand	Anodyne	HCRTR2	0	52
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cncc(Cl)c1)[C@@H]2C	ZINC000450781882	EH	On-Demand	Anodyne	HCRTR2	0	52
CCC(CC)Oc1ccc(C(=O)N2CC(NC(=O)C3CCC3)C2)cc1	ZINC000450781883	EF	On-Demand	Anodyne	EPHX2	19	46
CCC(CC)Oc1ccc(C(=O)N2CC(NC(=O)C3CCC3)C2)cc1	ZINC000450781883	EF	On-Demand	Anodyne	L3MBTL3	51	36
COc1c(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cccc1C(N)=O	ZINC000450781923	GE	On-Demand	Anodyne	FABH	0	41
COc1c(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cccc1C(N)=O	ZINC000450781923	GE	On-Demand	Anodyne	STAT6	49	34
COc1c(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)cccc1C(N)=O	ZINC000450781923	GE	On-Demand	Anodyne	BRPF1	0	43
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450781934	DF	On-Demand	Anodyne	PRCP	53	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450781934	DF	On-Demand	Anodyne	MC3R	46	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450781934	DF	On-Demand	Anodyne	MC5R	32	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450781934	DF	On-Demand	Anodyne	MC1R	33	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450781936	DF	On-Demand	Anodyne	PRCP	53	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450781936	DF	On-Demand	Anodyne	MC3R	46	42
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450781936	DF	On-Demand	Anodyne	MC5R	32	42
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1C[C@H](O)C2(CC2)C1	ZINC000450781936	DF	On-Demand	Anodyne	MC1R	33	40
Cc1ccc(NC(=O)c2ccc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c([N+](=O)[O-])c2)cc1	ZINC000450781937	GH	On-Demand	Bother	TAAR1	33	49
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450781938	DF	On-Demand	Anodyne	PRCP	53	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450781938	DF	On-Demand	Anodyne	MC3R	46	42
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450781938	DF	On-Demand	Anodyne	MC5R	32	42
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450781938	DF	On-Demand	Anodyne	MC1R	33	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450781939	DF	On-Demand	Anodyne	PRCP	53	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450781939	DF	On-Demand	Anodyne	MC3R	46	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450781939	DF	On-Demand	Anodyne	MC5R	32	42
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1C[C@@H](O)C2(CC2)C1	ZINC000450781939	DF	On-Demand	Anodyne	MC1R	33	40
Cc1ccc(NC(=O)c2ccc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c([N+](=O)[O-])c2)cc1	ZINC000450781943	GH	On-Demand	Bother	TAAR1	33	49
Cc1ccc(NC(=O)c2ccc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c([N+](=O)[O-])c2)cc1	ZINC000450781946	GH	On-Demand	Bother	TAAR1	33	49
CC(F)(F)CCOc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450781962	DD	On-Demand	Bother	S1PR4	0	41
CN(CC1(C#N)CCC1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782052	DE	On-Demand	Mild	SIGMAR1	27	43
CN(CC1(C#N)CCC1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782052	DE	On-Demand	Mild	NPFFR1	47	35
CN(CC1(C#N)CCC1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782053	DE	On-Demand	Mild	SIGMAR1	27	43
CN(CC1(C#N)CCC1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782053	DE	On-Demand	Mild	NPFFR1	47	35
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cc(OC(F)F)n(C)n1	ZINC000450782054	EH	On-Demand	Anodyne	SORT1	22	46
COc1ccc(CNC(=O)CCN2CCN(CCO)[C@@H](C)C2)c(OC)c1	ZINC000450782057	FC	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCN(CCO)[C@@H](C)C2)c(OC)c1	ZINC000450782057	FC	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CCN(CCO)[C@H](C)C2)c(OC)c1	ZINC000450782058	FC	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCN(CCO)[C@H](C)C2)c(OC)c1	ZINC000450782058	FC	On-Demand	Anodyne	HTR7	27	42
CC[C@]1(O)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450782061	CF	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@]1(O)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450782061	CF	On-Demand	Anodyne	CCR1	40	36
CC[C@@]1(O)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450782062	CF	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@@]1(O)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450782062	CF	On-Demand	Anodyne	CCR1	40	36
CC(C)C[C@@H](C)Sc1nnc(-c2cccs2)n1CCC(N)=O	ZINC000450782065	EG	On-Demand	Anodyne	LRRK2	0	43
CC(C)C[C@H](C)Sc1nnc(-c2cccs2)n1CCC(N)=O	ZINC000450782066	EG	On-Demand	Anodyne	LRRK2	0	43
COc1cccc(OCCC(=O)N[C@@H](CO)C2CCOCC2)c1	ZINC000450782087	DD	On-Demand	Anodyne	MTNR1A	34	44
COc1cccc(OCCC(=O)N[C@H](CO)C2CCOCC2)c1	ZINC000450782088	DD	On-Demand	Anodyne	MTNR1A	34	44
CN1CC[C@@H]2CN(c3ncc(Br)cc3C#N)C[C@@H]21	ZINC000450782104	DD	On-Demand	Mild	CHRNA3	22	41
CCC(CC)Oc1ccc(C(=O)Nc2cc(OC(F)F)n(C)n2)cc1	ZINC000450782109	FH	On-Demand	Anodyne	CPT1A	0	43
FC(F)(F)c1cccnc1N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1	ZINC000450782118	CE	On-Demand	Anodyne	TRPV1	29	46
FC(F)(F)c1cccnc1N1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450782119	CE	On-Demand	Anodyne	TRPV1	29	46
FC(F)(F)c1cccnc1N1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450782120	CE	On-Demand	Anodyne	TRPV1	29	46
CC(=O)N[C@H](C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450782122	DF	On-Demand	Anodyne	SIGMAR1	40	42
CC(=O)N[C@H](C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450782122	DF	On-Demand	Anodyne	SSTR5	40	35
CC(=O)N[C@H](C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450782122	DF	On-Demand	Anodyne	MCHR1	40	39
CC(=O)N[C@H](C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450782122	DF	On-Demand	Anodyne	NOD2	40	36
CC(=O)N[C@@H](C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450782123	DF	On-Demand	Anodyne	SIGMAR1	40	42
CC(=O)N[C@@H](C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450782123	DF	On-Demand	Anodyne	SSTR5	40	35
CC(=O)N[C@@H](C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450782123	DF	On-Demand	Anodyne	MCHR1	40	39
CC(=O)N[C@@H](C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450782123	DF	On-Demand	Anodyne	NOD2	40	36
COc1cccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)nccc12	ZINC000450782124	CF	On-Demand	Anodyne	PDE3B	54	34
COc1cccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nccc12	ZINC000450782125	CF	On-Demand	Anodyne	PDE3B	54	34
COc1cccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)nccc12	ZINC000450782126	CF	On-Demand	Anodyne	PDE3B	54	34
CN1CC[C@@H]2CN(c3ncccc3C(=O)N3CCCCC3)C[C@@H]21	ZINC000450782172	DD	On-Demand	Anodyne	L3MBTL3	56	35
O=C(NC1CN(C(=O)c2ccsc2Br)C1)C1CCC1	ZINC000450782184	EE	On-Demand	Anodyne	EPHX2	19	42
O=[N+]([O-])c1ccccc1N[C@@H](C1CC1)[C@H](CO)C1CC1	ZINC000450782197	CF	On-Demand	Bother	PQSD	0	40
O=[N+]([O-])c1ccccc1N[C@H](C1CC1)[C@H](CO)C1CC1	ZINC000450782198	CF	On-Demand	Bother	PQSD	0	40
O=[N+]([O-])c1ccccc1N[C@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450782199	CF	On-Demand	Bother	PQSD	0	40
O=[N+]([O-])c1ccccc1N[C@@H](C1CC1)[C@@H](CO)C1CC1	ZINC000450782201	CF	On-Demand	Bother	PQSD	0	40
C[C@@H]1CCCN(c2cc(N[C@H](C3CC3)[C@@H](CO)C3CC3)ncn2)C1	ZINC000450782207	EF	On-Demand	Anodyne	PRCP	0	48
C[C@@H]1CCCN(c2cc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)ncn2)C1	ZINC000450782208	EF	On-Demand	Anodyne	PRCP	0	48
C[C@@H]1CCCN(c2cc(N[C@@H](C3CC3)[C@H](CO)C3CC3)ncn2)C1	ZINC000450782209	EF	On-Demand	Anodyne	PRCP	0	48
C[C@@H]1CCCN(c2cc(N[C@H](C3CC3)[C@H](CO)C3CC3)ncn2)C1	ZINC000450782210	EF	On-Demand	Anodyne	PRCP	0	48
CC(=O)c1cccc(CN2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450782211	DF	On-Demand	Anodyne	TRY2_BOVIN	65	35
CC(=O)c1cccc(CN2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450782211	DF	On-Demand	Anodyne	FAAH	28	47
CC(=O)c1cccc(CN2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450782211	DF	On-Demand	Anodyne	MGLL	0	45
N#Cc1cnc2c(F)ccc(Cl)c2c1N1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450782221	EG	On-Demand	Mild	MAP3K8	53	32
COc1cc(OC)c2ncnc(N3C[C@H]4C(=O)NC(=O)[C@H]4C3)c2c1	ZINC000450782222	EC	On-Demand	Anodyne	PDE3A	47	38
CCOc1cc2nccc(N3C[C@@H]4CCN(C)[C@@H]4C3)c2cc1OCC	ZINC000450782232	EG	On-Demand	Anodyne	PDE3B	64	38
N#Cc1cnc2c(F)ccc(Cl)c2c1N1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450782235	EG	On-Demand	Mild	MAP3K8	53	32
N#Cc1cnc2c(F)ccc(Cl)c2c1N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1	ZINC000450782236	EG	On-Demand	Mild	MAP3K8	53	32
CN(CCCC(=O)c1ccccc1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782254	FG	On-Demand	Anodyne	SLC18A3	29	42
CN(CCCC(=O)c1ccccc1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782254	FG	On-Demand	Anodyne	CYP2J2	49	35
CN(CCCC(=O)c1ccccc1)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782254	FG	On-Demand	Anodyne	NPFFR1	53	36
CN(CCCC(=O)c1ccccc1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782256	FG	On-Demand	Anodyne	SLC18A3	29	42
CN(CCCC(=O)c1ccccc1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782256	FG	On-Demand	Anodyne	CYP2J2	49	35
CN(CCCC(=O)c1ccccc1)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782256	FG	On-Demand	Anodyne	NPFFR1	53	36
CN(C[C@H]1CCCC1(F)F)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782271	EF	For-Sale	Anodyne	NPFFR1	42	33
CN(C[C@H]1CCCC1(F)F)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782272	EF	For-Sale	Anodyne	NPFFR1	42	33
CN(C[C@@H]1CCCC1(F)F)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782273	EF	For-Sale	Anodyne	NPFFR1	42	33
CN(C[C@@H]1CCCC1(F)F)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782274	EF	For-Sale	Anodyne	NPFFR1	42	33
COC(=O)C1(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000450782278	ED	On-Demand	Anodyne	SIGMAR1	50	40
COC(=O)C1(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000450782278	ED	On-Demand	Anodyne	NPFFR1	55	37
COC(=O)C1(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000450782279	ED	On-Demand	Anodyne	SIGMAR1	50	40
COC(=O)C1(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000450782279	ED	On-Demand	Anodyne	NPFFR1	55	37
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@@H](OCC2CC2)C1	ZINC000450782306	FH	On-Demand	Bother	SLC6A9	19	40
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@@H](OCC2CC2)C1	ZINC000450782306	FH	On-Demand	Bother	LIPG	60	53
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@@H](OCC2CC2)C1	ZINC000450782306	FH	On-Demand	Bother	PPXII	0	41
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@H](OCC2CC2)C1	ZINC000450782307	FH	On-Demand	Bother	SLC6A9	19	40
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@H](OCC2CC2)C1	ZINC000450782307	FH	On-Demand	Bother	LIPG	60	53
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@H](OCC2CC2)C1	ZINC000450782307	FH	On-Demand	Bother	PPXII	0	41
O=C(NCC(=O)N1CCOCC2(CC2)C1)Nc1cccc(Cl)c1	ZINC000450782316	EE	On-Demand	Anodyne	EPHX2	22	44
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)CCN1CCO	ZINC000450782332	FE	On-Demand	Anodyne	CYP2J2	54	39
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)CCN1CCO	ZINC000450782333	FE	On-Demand	Anodyne	CYP2J2	54	39
CN(CCN1CCC(O)(C(F)F)CC1)Cc1ccccc1	ZINC000450782345	CE	On-Demand	Anodyne	SIGMAR1	56	48
CN1CC[C@@H]2CN(c3cnc(-c4ccccc4)cn3)C[C@@H]21	ZINC000450782351	CE	On-Demand	Anodyne	CHRNA7	0	51
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C(N)=O)C1	ZINC000450782362	DE	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C(N)=O)C1	ZINC000450782362	DE	On-Demand	Anodyne	CYP2J2	50	35
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(N)=O)C1	ZINC000450782370	DE	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(N)=O)C1	ZINC000450782370	DE	On-Demand	Anodyne	CYP2J2	50	35
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(N)=O)C1	ZINC000450782372	DE	On-Demand	Anodyne	DRD2	28	40
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C(N)=O)C1	ZINC000450782372	DE	On-Demand	Anodyne	CYP2J2	50	35
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C(N)=O)C1	ZINC000450782374	DE	On-Demand	Anodyne	DRD2	28	40
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C(N)=O)C1	ZINC000450782374	DE	On-Demand	Anodyne	CYP2J2	50	35
Cc1nccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)n1	ZINC000450782376	BD	On-Demand	Anodyne	SORD	59	37
Cc1nccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)n1	ZINC000450782378	BD	On-Demand	Anodyne	SORD	59	37
Cc1nccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)n1	ZINC000450782380	BD	On-Demand	Anodyne	SORD	59	37
FC(F)(F)c1ccccc1OCC1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450782391	GH	On-Demand	Anodyne	SIGMAR1	21	44
COc1ccc(CNC(=O)CCN2CCCC[C@H](C)C2)c(OC)c1	ZINC000450782396	EF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCCC[C@H](C)C2)c(OC)c1	ZINC000450782396	EF	On-Demand	Anodyne	MTNR1A	50	36
COc1ccc(CNC(=O)CCN2CCCC[C@H](C)C2)c(OC)c1	ZINC000450782396	EF	On-Demand	Anodyne	MTNR1B	42	36
COc1ccc(CNC(=O)CCN2CCCC[C@H](C)C2)c(OC)c1	ZINC000450782396	EF	On-Demand	Anodyne	EBP	41	48
COc1ccc(CNC(=O)CCN2CCCC[C@H](C)C2)c(OC)c1	ZINC000450782396	EF	On-Demand	Anodyne	RORC	43	39
COc1ccc(CNC(=O)CCN2CCCC[C@@H](C)C2)c(OC)c1	ZINC000450782397	EF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCCC[C@@H](C)C2)c(OC)c1	ZINC000450782397	EF	On-Demand	Anodyne	MTNR1A	50	36
COc1ccc(CNC(=O)CCN2CCCC[C@@H](C)C2)c(OC)c1	ZINC000450782397	EF	On-Demand	Anodyne	MTNR1B	42	36
COc1ccc(CNC(=O)CCN2CCCC[C@@H](C)C2)c(OC)c1	ZINC000450782397	EF	On-Demand	Anodyne	EBP	41	48
COc1ccc(CNC(=O)CCN2CCCC[C@@H](C)C2)c(OC)c1	ZINC000450782397	EF	On-Demand	Anodyne	RORC	43	39
CC(=O)N[C@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782448	DF	On-Demand	Anodyne	ACHE	27	46
CC(=O)N[C@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782448	DF	On-Demand	Anodyne	CHRM3	25	45
CC(=O)N[C@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782448	DF	On-Demand	Anodyne	SIGMAR1	38	43
CC(=O)N[C@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782448	DF	On-Demand	Anodyne	SSTR5	44	37
CC(=O)N[C@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782448	DF	On-Demand	Anodyne	TRY2_BOVIN	42	32
CC(=O)N[C@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782448	DF	On-Demand	Anodyne	CCR3	43	41
CC(=O)N[C@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782448	DF	On-Demand	Anodyne	MCHR1	40	40
CC(=O)N[C@@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782449	DF	On-Demand	Anodyne	ACHE	27	46
CC(=O)N[C@@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782449	DF	On-Demand	Anodyne	CHRM3	25	45
CC(=O)N[C@@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782449	DF	On-Demand	Anodyne	SIGMAR1	38	43
CC(=O)N[C@@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782449	DF	On-Demand	Anodyne	SSTR5	44	37
CC(=O)N[C@@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782449	DF	On-Demand	Anodyne	TRY2_BOVIN	42	32
CC(=O)N[C@@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782449	DF	On-Demand	Anodyne	CCR3	43	41
CC(=O)N[C@@H](C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450782449	DF	On-Demand	Anodyne	MCHR1	40	40
CC(=O)N[C@H](C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450782450	EH	On-Demand	Anodyne	DRD2	15	42
CC(=O)N[C@H](C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450782450	EH	On-Demand	Anodyne	DRD3	23	42
CC(=O)N[C@H](C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450782450	EH	On-Demand	Anodyne	SIGMAR1	19	42
CC(=O)N[C@H](C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450782450	EH	On-Demand	Anodyne	PRCP	25	40
CC(=O)N[C@@H](C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450782451	EH	On-Demand	Anodyne	DRD2	15	42
CC(=O)N[C@@H](C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450782451	EH	On-Demand	Anodyne	DRD3	23	42
CC(=O)N[C@@H](C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450782451	EH	On-Demand	Anodyne	SIGMAR1	19	42
CC(=O)N[C@@H](C)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450782451	EH	On-Demand	Anodyne	PRCP	25	40
Brc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1	ZINC000450782464	EF	On-Demand	Anodyne	PDE3A	41	31
Brc1ccc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1	ZINC000450782464	EF	On-Demand	Anodyne	PDE3B	40	31
Brc1ccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1	ZINC000450782465	EF	On-Demand	Anodyne	PDE3A	41	31
Brc1ccc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2c1	ZINC000450782465	EF	On-Demand	Anodyne	PDE3B	40	31
Brc1ccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2c1	ZINC000450782466	EF	On-Demand	Anodyne	PDE3A	41	31
Brc1ccc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2c1	ZINC000450782466	EF	On-Demand	Anodyne	PDE3B	40	31
CC[C@H](O)CC(=O)N[C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450782485	FH	On-Demand	Anodyne	ENV	41	32
CC[C@H](O)CC(=O)N[C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450782486	FH	On-Demand	Anodyne	ENV	41	32
CC[C@H](O)CC(=O)N[C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000450782487	FH	On-Demand	Anodyne	ENV	41	32
CC[C@H](O)CC(=O)N[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1	ZINC000450782488	FH	On-Demand	Anodyne	ENV	41	32
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H]2CCN(C)[C@H]2C1	ZINC000450782510	CD	On-Demand	Bother	SSTR2	32	41
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H]2CCN(C)[C@H]2C1	ZINC000450782510	CD	On-Demand	Bother	SSTR1	35	41
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@H]2CCN(C)[C@H]2C1	ZINC000450782510	CD	On-Demand	Bother	WDR5	34	40
COC(=O)c1csc(CN2CCN(C3CC3)c3ccccc32)n1	ZINC000450782512	EF	On-Demand	Anodyne	TRPC6	45	33
CC(C)(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450782535	FH	On-Demand	Anodyne	HDAC1	32	42
CC(C)(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450782535	FH	On-Demand	Anodyne	DGAT1	49	40
CC(C)(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450782535	FH	On-Demand	Anodyne	HPGDS	20	42
CC[C@]1(O)CCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450782553	BE	On-Demand	Anodyne	NPFFR1	41	35
CC[C@@]1(O)CCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450782554	BE	On-Demand	Anodyne	NPFFR1	41	35
C=C(C)CNC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450782560	CD	On-Demand	Mild	CA2	30	41
CSc1ccc2ncnc(N3C[C@@H]4CCN(C)[C@@H]4C3)c2c1	ZINC000450782573	DE	On-Demand	Anodyne	PDE3A	46	35
CSc1ccc2ncnc(N3C[C@@H]4CCN(C)[C@@H]4C3)c2c1	ZINC000450782573	DE	On-Demand	Anodyne	HTT	0	40
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H](C)C1=O	ZINC000450782574	FD	On-Demand	Anodyne	MTNR1A	54	37
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H](C)C1=O	ZINC000450782574	FD	On-Demand	Anodyne	MTNR1B	42	37
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H](C)C1=O	ZINC000450782575	FD	On-Demand	Anodyne	MTNR1A	54	37
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H](C)C1=O	ZINC000450782575	FD	On-Demand	Anodyne	MTNR1B	42	37
CO[C@@H](Cc1ccccc1)CN1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450782576	EE	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)CN1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450782577	EE	On-Demand	Anodyne	POL	0	41
CC(F)(F)c1ccc(C(=O)N2CC(NC(=O)C3CCC3)C2)cn1	ZINC000450782586	DD	On-Demand	Anodyne	EPHX2	22	45
CC(F)(F)c1ccc(C(=O)N2CC(NC(=O)C3CCC3)C2)cn1	ZINC000450782586	DD	On-Demand	Anodyne	SFRP1	44	38
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2cc1F	ZINC000450782607	DE	On-Demand	Anodyne	EGFR	22	40
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2cc1F	ZINC000450782607	DE	On-Demand	Anodyne	PDE3A	58	44
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2cc1F	ZINC000450782607	DE	On-Demand	Anodyne	PDGFRB	70	39
COc1cc2c(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2cc1F	ZINC000450782607	DE	On-Demand	Anodyne	PDE3B	85	44
COc1cc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2cc1F	ZINC000450782608	DE	On-Demand	Anodyne	EGFR	22	40
COc1cc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2cc1F	ZINC000450782608	DE	On-Demand	Anodyne	PDE3A	58	44
COc1cc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2cc1F	ZINC000450782608	DE	On-Demand	Anodyne	PDGFRB	70	39
COc1cc2c(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)ncnc2cc1F	ZINC000450782608	DE	On-Demand	Anodyne	PDE3B	85	44
COc1cc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2cc1F	ZINC000450782609	DE	On-Demand	Anodyne	EGFR	22	40
COc1cc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2cc1F	ZINC000450782609	DE	On-Demand	Anodyne	PDE3A	58	44
COc1cc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2cc1F	ZINC000450782609	DE	On-Demand	Anodyne	PDGFRB	70	39
COc1cc2c(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)ncnc2cc1F	ZINC000450782609	DE	On-Demand	Anodyne	PDE3B	85	44
N#Cc1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1Cl	ZINC000450782629	CF	On-Demand	Mild	AR	15	56
N#Cc1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1Cl	ZINC000450782630	CF	On-Demand	Mild	AR	15	56
N#Cc1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)cc1Cl	ZINC000450782631	CF	On-Demand	Mild	AR	15	56
C[C@H](CN1CCC(COc2ccccc2C(F)(F)F)CC1)S(C)(=O)=O	ZINC000450782664	GG	On-Demand	Anodyne	SIGMAR1	18	40
C[C@@H](CN1CCC(COc2ccccc2C(F)(F)F)CC1)S(C)(=O)=O	ZINC000450782665	GG	On-Demand	Anodyne	SIGMAR1	18	40
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@@H](C(N)=O)C1	ZINC000450782687	CD	On-Demand	Anodyne	PEPD	0	43
Cn1nc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)cc1OC(F)F	ZINC000450782726	GD	On-Demand	Anodyne	RORC	61	36
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	ACE	45	36
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	MME	55	38
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	PGC	44	33
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	PAPA1_CARPA	45	38
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	CYSP_TRYCR	49	37
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	TIMP3	68	38
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	CAPNS1	59	32
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	REN	40	35
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	PAM	0	42
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	CAPN1	53	38
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	CAPN2	44	35
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	ACE2	71	41
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	PPP2CA	0	40
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	GAG-PRO	59	35
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782790	DE	On-Demand	Anodyne	PSMB8	43	35
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	ACE	45	36
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	MME	55	38
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	PGC	44	33
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	PAPA1_CARPA	45	38
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	CYSP_TRYCR	49	37
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	TIMP3	68	38
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	CAPNS1	59	32
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	REN	40	35
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	PAM	0	42
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	CAPN1	53	38
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	CAPN2	44	35
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	ACE2	71	41
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	PPP2CA	0	40
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	GAG-PRO	59	35
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](C)NC(C)=O)CC1	ZINC000450782791	DE	On-Demand	Anodyne	PSMB8	43	35
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	ACE	45	36
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	MME	55	38
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	PGC	44	33
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	PAPA1_CARPA	45	38
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	CYSP_TRYCR	49	37
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	TIMP3	68	38
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	CAPNS1	59	32
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	REN	40	35
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	PAM	0	42
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	CAPN1	53	38
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	CAPN2	44	35
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	ACE2	71	41
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	PPP2CA	0	40
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	GAG-PRO	59	35
CO[C@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782792	DE	On-Demand	Anodyne	PSMB8	43	35
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	ACE	45	36
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	MME	55	38
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	PGC	44	33
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	PAPA1_CARPA	45	38
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	CYSP_TRYCR	49	37
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	TIMP3	68	38
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	CAPNS1	59	32
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	REN	40	35
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	PAM	0	42
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	CAPN1	53	38
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	CAPN2	44	35
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	ACE2	71	41
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	PPP2CA	0	40
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	GAG-PRO	59	35
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](C)NC(C)=O)CC1	ZINC000450782793	DE	On-Demand	Anodyne	PSMB8	43	35
NS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c(C(F)(F)F)c1	ZINC000450782794	GF	On-Demand	Anodyne	CA2	25	40
NS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c(C(F)(F)F)c1	ZINC000450782795	GF	On-Demand	Anodyne	CA2	25	40
NS(=O)(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c(C(F)(F)F)c1	ZINC000450782796	GF	On-Demand	Anodyne	CA2	25	40
NS(=O)(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c(C(F)(F)F)c1	ZINC000450782797	GF	On-Demand	Anodyne	CA2	25	40
Cc1nc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)cs1	ZINC000450782821	EI	On-Demand	Anodyne	HTR2A	22	42
Cc1nc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)cs1	ZINC000450782821	EI	On-Demand	Anodyne	HTR3B	0	46
Cc1nc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)cs1	ZINC000450782821	EI	On-Demand	Anodyne	CYP2J2	47	35
CCn1cnc2c(N[C@H](C3CC3)[C@H](CO)C3CC3)ncnc21	ZINC000450782823	DE	On-Demand	Anodyne	ADORA1	22	42
CCn1cnc2c(N[C@@H](C3CC3)[C@H](CO)C3CC3)ncnc21	ZINC000450782824	DE	On-Demand	Anodyne	ADORA1	22	42
CCn1cnc2c(N[C@H](C3CC3)[C@@H](CO)C3CC3)ncnc21	ZINC000450782825	DE	On-Demand	Anodyne	ADORA1	22	42
CCn1cnc2c(N[C@@H](C3CC3)[C@@H](CO)C3CC3)ncnc21	ZINC000450782826	DE	On-Demand	Anodyne	ADORA1	22	42
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1nn3c(c1C)OCCC3)[C@@H]2C	ZINC000450782832	FG	On-Demand	Anodyne	HCRTR2	21	40
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1nn3c(c1C)OCCC3)[C@H]2C	ZINC000450782833	FG	On-Demand	Anodyne	HCRTR2	21	40
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1nn3c(c1C)OCCC3)[C@H]2C	ZINC000450782834	FG	On-Demand	Anodyne	HCRTR2	21	40
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1nn3c(c1C)OCCC3)[C@@H]2C	ZINC000450782835	FG	On-Demand	Anodyne	HCRTR2	21	40
CSc1cccc(C(=O)N2CC(NC(=O)C3CCC3)C2)c1	ZINC000450782840	DE	On-Demand	Anodyne	RHOA	0	48
CSc1cccc(C(=O)N2CC(NC(=O)C3CCC3)C2)c1	ZINC000450782840	DE	On-Demand	Anodyne	L3MBTL1	0	40
CCCOc1ccc(C(=O)N2CCO[C@H](COCC3CC3)C2)c(OC)c1	ZINC000450782850	FF	On-Demand	Anodyne	OXTR	24	41
CCCOc1ccc(C(=O)N2CCO[C@@H](COCC3CC3)C2)c(OC)c1	ZINC000450782851	FF	On-Demand	Anodyne	OXTR	24	41
CCOC(=O)c1cccnc1N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1	ZINC000450782861	CD	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)c1cccnc1N1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450782862	CD	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)c1cccnc1N1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1	ZINC000450782863	CD	On-Demand	Anodyne	P2RY12	42	35
CS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(F)c1	ZINC000450782872	DD	On-Demand	Anodyne	SLC6A9	23	45
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(F)c1	ZINC000450782873	DD	On-Demand	Anodyne	SLC6A9	23	45
CS(=O)(=O)c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c(F)c1	ZINC000450782874	DD	On-Demand	Anodyne	SLC6A9	23	45
COc1cccc2c(N3C[C@@H]4CCN(C)[C@@H]4C3)cc(C)nc12	ZINC000450782889	CF	On-Demand	Anodyne	SSTR2	0	42
C=C(C)CNC(=O)c1ccc(OCCC)cc1OC	ZINC000450782890	CF	On-Demand	Mild	KCNA3	23	40
C=C(C)CNC(=O)c1ccc(OCCC)cc1OC	ZINC000450782890	CF	On-Demand	Mild	MTNR1B	24	41
C=C(C)CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450782907	CE	On-Demand	Mild	PDEC	0	40
C=C(C)CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450782908	CE	On-Demand	Mild	PDEC	0	40
O=C(Nc1nc2ccc(I)cc2s1)[C@@H]1CC1(F)F	ZINC000450782914	GG	On-Demand	Anodyne	LCK	22	43
O=C(Nc1nc2ccc(I)cc2s1)[C@@H]1CC1(F)F	ZINC000450782914	GG	On-Demand	Anodyne	CSNK1D	45	42
O=C(Nc1nc2ccc(I)cc2s1)[C@@H]1CC1(F)F	ZINC000450782914	GG	On-Demand	Anodyne	PIK3CA	0	42
O=C(Nc1nc2ccc(I)cc2s1)[C@H]1CC1(F)F	ZINC000450782915	GG	On-Demand	Anodyne	LCK	22	43
O=C(Nc1nc2ccc(I)cc2s1)[C@H]1CC1(F)F	ZINC000450782915	GG	On-Demand	Anodyne	CSNK1D	45	42
O=C(Nc1nc2ccc(I)cc2s1)[C@H]1CC1(F)F	ZINC000450782915	GG	On-Demand	Anodyne	PIK3CA	0	42
CC[C@]1(O)CCN(Cc2ccc(S(=O)(=O)CC)cc2)C1	ZINC000450782930	CD	On-Demand	Anodyne	ADAM17	22	40
CC[C@@]1(O)CCN(Cc2ccc(S(=O)(=O)CC)cc2)C1	ZINC000450782931	CD	On-Demand	Anodyne	ADAM17	22	40
O=C(c1c(Cl)cc(Cl)cc1Cl)N1CCC(CCCO)CC1	ZINC000450782932	FI	On-Demand	Anodyne	CACNA1I	46	36
O=C(c1c(Cl)cc(Cl)cc1Cl)N1CCC(CCCO)CC1	ZINC000450782932	FI	On-Demand	Anodyne	AKR1C3	16	47
COc1ccc(-c2ccnc(N3C[C@@H]4CCN(C)[C@@H]4C3)n2)cc1	ZINC000450782938	DE	On-Demand	Anodyne	DKK1	0	41
CCCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C(C)(C)C1=O	ZINC000450782940	GE	On-Demand	Anodyne	MTNR1A	48	43
CCCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C(C)(C)C1=O	ZINC000450782940	GE	On-Demand	Anodyne	MTNR1B	41	43
COc1cccc2c1CCN(C(=O)Cc1cc3ccccc3s1)C2	ZINC000450782949	EI	On-Demand	Anodyne	AKR1C3	15	45
CCC(=O)CCCN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782959	DE	On-Demand	Anodyne	NPFFR1	49	36
CCC(=O)CCCN(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782960	DE	On-Demand	Anodyne	NPFFR1	49	36
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@H](C(N)=O)C1	ZINC000450782961	FF	On-Demand	Anodyne	CYP2J2	50	35
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@@H](C(N)=O)C1	ZINC000450782962	FF	On-Demand	Anodyne	CYP2J2	50	35
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@@H](C(N)=O)C1	ZINC000450782963	FF	On-Demand	Anodyne	CYP2J2	50	35
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@H](C(N)=O)C1	ZINC000450782964	FF	On-Demand	Anodyne	CYP2J2	50	35
C[C@@H]1CC[C@@](CO)(N(C)CCCC(=O)c2ccccc2)C1	ZINC000450782986	CG	On-Demand	Anodyne	CYP2J2	48	34
C[C@H]1CC[C@@](CO)(N(C)CCCC(=O)c2ccccc2)C1	ZINC000450782987	CG	On-Demand	Anodyne	CYP2J2	48	34
C[C@@H]1CC[C@](CO)(N(C)CCCC(=O)c2ccccc2)C1	ZINC000450782988	CG	On-Demand	Anodyne	CYP2J2	48	34
C[C@H]1CC[C@](CO)(N(C)CCCC(=O)c2ccccc2)C1	ZINC000450782989	CG	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)c1ccc(CN2CCN(C(=O)NC(C)(C)C)CC2)cc1Cl	ZINC000450783007	FF	On-Demand	Anodyne	FAAH	20	40
Cc1ccc(C(=O)N2CC(NC(=O)C3CCC3)C2)c(Cl)c1Cl	ZINC000450783039	EG	On-Demand	Anodyne	EPHX2	23	47
O=C(NCc1ccccc1CN1CC[C@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783066	GH	On-Demand	Anodyne	DRD4	28	43
O=C(NCc1ccccc1CN1CC[C@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783066	GH	On-Demand	Anodyne	CHRM3	15	40
O=C(NCc1ccccc1CN1CC[C@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783066	GH	On-Demand	Anodyne	SIGMAR1	24	48
O=C(NCc1ccccc1CN1CC[C@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783066	GH	On-Demand	Anodyne	CCR3	42	38
O=C(NCc1ccccc1CN1CC[C@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783066	GH	On-Demand	Anodyne	MCHR1	34	43
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783067	GH	On-Demand	Anodyne	DRD4	28	43
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783067	GH	On-Demand	Anodyne	CHRM3	15	40
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783067	GH	On-Demand	Anodyne	SIGMAR1	24	48
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783067	GH	On-Demand	Anodyne	CCR3	42	38
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450783067	GH	On-Demand	Anodyne	MCHR1	34	43
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@H]1CCN(c3ccccc3)C1)[C@H]2C	ZINC000450783086	FI	On-Demand	Anodyne	MTNR1B	20	42
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@H]1CCN(c3ccccc3)C1)[C@@H]2C	ZINC000450783087	FI	On-Demand	Anodyne	MTNR1B	20	42
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@@H]1CCN(c3ccccc3)C1)[C@H]2C	ZINC000450783088	FI	On-Demand	Anodyne	MTNR1B	20	42
COc1ccc2c(c1)C[C@H](C)N(C(=O)[C@@H]1CCN(c3ccccc3)C1)[C@@H]2C	ZINC000450783089	FI	On-Demand	Anodyne	MTNR1B	20	42
O=C(CC[C@@H]1CCCCO1)CSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450783105	FG	On-Demand	Anodyne	L3MBTL3	44	34
O=C(CC[C@H]1CCCCO1)CSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450783106	FG	On-Demand	Anodyne	L3MBTL3	44	34
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450783107	GF	On-Demand	Mild	CSNK2A1	49	35
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450783107	GF	On-Demand	Mild	SSTR5	65	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450783107	GF	On-Demand	Mild	ITGA4	55	31
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450783107	GF	On-Demand	Mild	MLNR	51	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450783107	GF	On-Demand	Mild	CXCR3	26	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450783107	GF	On-Demand	Mild	MCHR1	33	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450783107	GF	On-Demand	Mild	HIVRT	0	43
COC(=O)C(C)(C)N1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450783112	GD	On-Demand	Bother	CACNA1C	43	36
COC(=O)C(C)(C)N1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450783112	GD	On-Demand	Bother	CACNA1D	64	33
COC(=O)C(C)(C)N1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450783112	GD	On-Demand	Bother	MGLL	0	40
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000450783118	FF	On-Demand	Anodyne	CACNA1B	40	39
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(N(C)C)n3)CC2)cc1	ZINC000450783122	GD	On-Demand	Anodyne	DRD4	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(N(C)C)n3)CC2)cc1	ZINC000450783122	GD	On-Demand	Anodyne	LTA4H	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(N(C)C)n3)CC2)cc1	ZINC000450783122	GD	On-Demand	Anodyne	SIGMAR1	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(N(C)C)n3)CC2)cc1	ZINC000450783122	GD	On-Demand	Anodyne	SSTR5	70	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(N(C)C)n3)CC2)cc1	ZINC000450783122	GD	On-Demand	Anodyne	MLNR	45	39
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(N(C)C)n3)CC2)cc1	ZINC000450783122	GD	On-Demand	Anodyne	MCHR1	55	42
CCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1CC	ZINC000450783124	GE	On-Demand	Anodyne	DRD4	16	42
CCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1CC	ZINC000450783124	GE	On-Demand	Anodyne	LTA4H	24	42
CCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1CC	ZINC000450783124	GE	On-Demand	Anodyne	SIGMAR1	24	40
CCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1CC	ZINC000450783124	GE	On-Demand	Anodyne	SSTR5	77	49
CCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1CC	ZINC000450783124	GE	On-Demand	Anodyne	MCHR1	41	43
CCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1CC	ZINC000450783124	GE	On-Demand	Anodyne	AXL	17	40
CCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1CC	ZINC000450783124	GE	On-Demand	Anodyne	MERTK	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C(N)=O)n3)CC2)cc1	ZINC000450783128	FD	On-Demand	Anodyne	LTA4H	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C(N)=O)n3)CC2)cc1	ZINC000450783128	FD	On-Demand	Anodyne	SIGMAR1	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C(N)=O)n3)CC2)cc1	ZINC000450783128	FD	On-Demand	Anodyne	SSTR5	76	45
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C(N)=O)n3)CC2)cc1	ZINC000450783128	FD	On-Demand	Anodyne	MCHR1	43	46
CC1(CSc2ccc(C(=O)N3CCCC3)cn2)CCC1	ZINC000450783132	CH	On-Demand	Anodyne	L3MBTL1	0	40
CC1(CSc2ccc(C(=O)N3CCCC3)cn2)CCC1	ZINC000450783132	CH	On-Demand	Anodyne	L3MBTL3	44	34
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)c([N+](=O)[O-])cn3)CC2)cc1	ZINC000450783135	GG	On-Demand	Bother	SIGMAR1	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)c([N+](=O)[O-])cn3)CC2)cc1	ZINC000450783135	GG	On-Demand	Bother	SSTR5	76	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)c([N+](=O)[O-])cn3)CC2)cc1	ZINC000450783135	GG	On-Demand	Bother	MCHR1	39	42
CCCOc1cccc(CSc2ccc(C(=O)N3CCCC3)cn2)c1	ZINC000450783138	FI	On-Demand	Anodyne	HRH2	31	43
CN(CCN1CC[C@H](n2cnc3c2CCCC3)C1)Cc1ccccc1	ZINC000450783139	EG	On-Demand	Anodyne	SIGMAR1	21	43
CN(CCN1CC[C@@H](n2cnc3c2CCCC3)C1)Cc1ccccc1	ZINC000450783140	EG	On-Demand	Anodyne	SIGMAR1	21	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	DRD4	22	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	ACHE	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	DHODH	0	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	KCNH2	15	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	LTA4H	26	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	TRPV1	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	SIGMAR1	26	50
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	SSTR5	77	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	MLNR	45	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	CCR2	46	50
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	SLC6A5	33	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	EPHX2	43	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	CXCR3	58	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	MCHR1	87	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	CACNA1G	32	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	AXL	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	MERTK	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	GPR119	0	60
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	TRPM8	46	36
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)cn3)CC2)cc1	ZINC000450783146	GI	On-Demand	Anodyne	NOD2	40	35
C[C@@H]1CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CC(=O)N1	ZINC000450783147	ED	On-Demand	Anodyne	AVPR2	51	40
C[C@H]1CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CC(=O)N1	ZINC000450783148	ED	On-Demand	Anodyne	AVPR2	51	40
CCOc1cc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)on1	ZINC000450783155	CE	On-Demand	Anodyne	PANC	54	36
CCOc1cc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)on1	ZINC000450783156	CE	On-Demand	Anodyne	PANC	54	36
CO[C@@H]1COCC[C@@H]1CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450783157	GE	On-Demand	Anodyne	CCR2	46	40
CO[C@@H]1COCC[C@H]1CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450783158	GE	On-Demand	Anodyne	CCR2	46	40
CO[C@@H]1COCC[C@H]1CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450783159	GE	On-Demand	Anodyne	CCR2	46	40
CO[C@@H]1COCC[C@@H]1CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450783160	GE	On-Demand	Anodyne	CCR2	46	40
Cc1ccc(NC(=O)c2ccc(N3CC(=O)N[C@H](C)C3)c([N+](=O)[O-])c2)cc1	ZINC000450783161	FE	On-Demand	Bother	TAAR1	39	50
Cc1ccc(NC(=O)c2ccc(N3CC(=O)N[C@@H](C)C3)c([N+](=O)[O-])c2)cc1	ZINC000450783162	FE	On-Demand	Bother	TAAR1	39	50
CCc1nnc2ccc(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)nn12	ZINC000450783170	GE	On-Demand	Anodyne	SSTR5	62	44
Cc1noc(-c2cccnc2N2CC(=O)N[C@H](C)C2)n1	ZINC000450783177	CC	On-Demand	Anodyne	ELANE	0	41
Cc1noc(-c2cccnc2N2CC(=O)N[C@@H](C)C2)n1	ZINC000450783178	CC	On-Demand	Anodyne	ELANE	0	41
CCC(CC)Oc1ccc(C(=O)N2CC(NC(=O)C3CC3)C2)cc1	ZINC000450783179	EF	On-Demand	Anodyne	L3MBTL3	45	35
C[C@H](C1CC1)n1cc(NC(=O)C(C)(C)C2CCC2)cn1	ZINC000450783183	CH	On-Demand	Anodyne	PANC	46	32
C[C@@H](C1CC1)n1cc(NC(=O)C(C)(C)C2CCC2)cn1	ZINC000450783184	CH	On-Demand	Anodyne	PANC	46	32
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	TSHR	44	33
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	ACHE	33	45
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	DRD3	0	43
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	LTA4H	21	42
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	SIGMAR1	36	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	PLD1	49	36
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	PLD2	42	35
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	MCHR1	35	43
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	NPFFR1	40	32
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4n3C)CC2)cc1	ZINC000450783187	GG	On-Demand	Anodyne	NOD2	40	34
Cc1cccc2c1C[C@@H](C(=O)Nc1cnn([C@H](C)C3CC3)c1)O2	ZINC000450783189	DG	On-Demand	Anodyne	PANC	41	35
Cc1cccc2c1C[C@@H](C(=O)Nc1cnn([C@@H](C)C3CC3)c1)O2	ZINC000450783190	DG	On-Demand	Anodyne	PANC	41	35
Cc1cccc2c1C[C@H](C(=O)Nc1cnn([C@H](C)C3CC3)c1)O2	ZINC000450783191	DG	On-Demand	Anodyne	PANC	41	35
Cc1cccc2c1C[C@H](C(=O)Nc1cnn([C@@H](C)C3CC3)c1)O2	ZINC000450783192	DG	On-Demand	Anodyne	PANC	41	35
CC[C@@H](O)CC(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450783193	CD	On-Demand	Anodyne	SLC1A2	43	35
CC[C@@H](O)CC(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450783193	CD	On-Demand	Anodyne	ENPP1	46	31
CC[C@H](O)CC(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450783194	CD	On-Demand	Anodyne	SLC1A2	43	35
CC[C@H](O)CC(=O)Nc1cccc(-c2ncn(C)n2)c1	ZINC000450783194	CD	On-Demand	Anodyne	ENPP1	46	31
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cn3)CC2)cc1	ZINC000450783199	EG	On-Demand	Anodyne	SIGMAR1	38	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cn3)CC2)cc1	ZINC000450783199	EG	On-Demand	Anodyne	SSTR5	66	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cn3)CC2)cc1	ZINC000450783199	EG	On-Demand	Anodyne	CCR3	84	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cn3)CC2)cc1	ZINC000450783199	EG	On-Demand	Anodyne	MLNR	65	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cn3)CC2)cc1	ZINC000450783199	EG	On-Demand	Anodyne	CXCR3	49	38
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cn3)CC2)cc1	ZINC000450783199	EG	On-Demand	Anodyne	MCHR1	59	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cn3)CC2)cc1	ZINC000450783199	EG	On-Demand	Anodyne	CACNA1G	31	40
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	DRD4	28	45
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	ACHE	17	40
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	LTA4H	29	42
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	SIGMAR1	24	43
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	SSTR5	79	43
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	CCR3	36	41
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	MLNR	50	42
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	MCHR1	51	42
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	AXL	28	42
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	TYRO3	37	42
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	MERTK	34	42
CNC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783200	GE	On-Demand	Anodyne	NOD2	40	36
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(OCCO)n3)CC2)cc1	ZINC000450783213	GD	On-Demand	Anodyne	LTA4H	25	42
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(OCCO)n3)CC2)cc1	ZINC000450783213	GD	On-Demand	Anodyne	SIGMAR1	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(OCCO)n3)CC2)cc1	ZINC000450783213	GD	On-Demand	Anodyne	SSTR5	82	45
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(OCCO)n3)CC2)cc1	ZINC000450783213	GD	On-Demand	Anodyne	CCR3	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(OCCO)n3)CC2)cc1	ZINC000450783213	GD	On-Demand	Anodyne	MCHR1	37	42
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	CHRM2	17	51
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	CHRM1	15	51
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	KCNH2	17	43
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	P2RY12	37	43
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	CHRM3	23	51
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	LTA4H	34	46
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	SIGMAR1	24	40
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	SSTR5	95	50
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	CCR3	33	46
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	UTS2R	21	41
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	MLNR	48	36
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	MCHR1	65	43
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	AXL	19	40
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	MERTK	19	40
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	NOD1	29	47
CCOC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450783220	GG	On-Demand	Anodyne	NOD2	46	47
NC(=O)c1cc([N+](=O)[O-])cn(CCCCc2ccc(Cl)c(Cl)c2)c1=O	ZINC000450783221	GG	On-Demand	Bother	DNAE	42	32
CCc1cc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c2ccccc2n1	ZINC000450783233	CG	On-Demand	Anodyne	METAP1	40	33
CCc1cc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c2ccccc2n1	ZINC000450783235	CG	On-Demand	Anodyne	METAP1	40	33
CC(C)OC(C)(C)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450783236	CF	On-Demand	Anodyne	ITK	45	33
CC(C)OC(C)(C)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450783236	CF	On-Demand	Anodyne	PANC	50	32
CC(C)OC(C)(C)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450783237	CF	On-Demand	Anodyne	ITK	45	33
CC(C)OC(C)(C)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450783237	CF	On-Demand	Anodyne	PANC	50	32
CCc1cc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c2ccccc2n1	ZINC000450783238	CG	On-Demand	Anodyne	METAP1	40	33
CC(=O)Nc1ccc(CN2CCC(N=c3c(C#N)c[nH]c4ccccc34)CC2)cc1	ZINC000450783239	GH	On-Demand	Mild	HTR1D	18	41
CC(=O)Nc1ccc(CN2CCC(N=c3c(C#N)c[nH]c4ccccc34)CC2)cc1	ZINC000450783239	GH	On-Demand	Mild	HTR1B	15	41
CC(=O)Nc1ccc(CN2CCC(N=c3c(C#N)c[nH]c4ccccc34)CC2)cc1	ZINC000450783239	GH	On-Demand	Mild	SIGMAR1	22	44
CC(=O)Nc1ccc(CN2CCC(N=c3c(C#N)c[nH]c4ccccc34)CC2)cc1	ZINC000450783239	GH	On-Demand	Mild	CCR2	0	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]cnc34)CC2)cc1	ZINC000450783245	FE	On-Demand	Anodyne	LTA4H	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]cnc34)CC2)cc1	ZINC000450783245	FE	On-Demand	Anodyne	SIGMAR1	21	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]cnc34)CC2)cc1	ZINC000450783245	FE	On-Demand	Anodyne	SSTR5	71	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]cnc34)CC2)cc1	ZINC000450783245	FE	On-Demand	Anodyne	MCHR1	35	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]cnc34)CC2)cc1	ZINC000450783245	FE	On-Demand	Anodyne	AXL	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]cnc34)CC2)cc1	ZINC000450783245	FE	On-Demand	Anodyne	MERTK	23	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	CHRM2	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	DRD2	15	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	TSHR	55	37
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	DRD4	42	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	ACHE	39	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	HRH1	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	DRD3	23	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	CHRM3	23	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	LTA4H	41	49
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	SIGMAR1	36	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	SSTR5	75	45
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	CCR3	43	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	TIMP3	40	31
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	CXCR3	32	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	MCHR1	64	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	TNKS	59	35
CC(=O)Nc1ccc(CN2CCC(Nc3nc(O)c4ccccc4n3)CC2)cc1	ZINC000450783254	GF	On-Demand	Anodyne	NOD2	40	35
CC(=O)N[C@@H](C)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450783258	DE	On-Demand	Anodyne	ACHE	22	41
CC(=O)N[C@@H](C)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450783258	DE	On-Demand	Anodyne	SIGMAR1	55	42
CC(=O)N[C@@H](C)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450783258	DE	On-Demand	Anodyne	CCR5	55	42
CC(=O)N[C@H](C)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450783260	DE	On-Demand	Anodyne	ACHE	22	41
CC(=O)N[C@H](C)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450783260	DE	On-Demand	Anodyne	SIGMAR1	55	42
CC(=O)N[C@H](C)C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450783260	DE	On-Demand	Anodyne	CCR5	55	42
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3nc(-c4ccccc4)ns3)C[C@H]12	ZINC000450783280	CF	On-Demand	Anodyne	FAAH	0	45
C1=C[C@H]2O[C@H]1[C@H]1CN(c3nc(-c4ccccc4)ns3)C[C@H]21	ZINC000450783282	CF	On-Demand	Anodyne	FAAH	0	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	ABL1	43	35
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	DRD4	24	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	ACHE	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	LTA4H	37	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	TRPV1	37	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	SIGMAR1	29	50
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	SSTR5	78	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	P2RY1	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	MLNR	46	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	CCR2	25	49
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	SLC6A5	28	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	MCHR1	67	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C(F)(F)F)CC2)cc1	ZINC000450783283	GI	On-Demand	Anodyne	SCD	18	41
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3nc(-c4ccccc4)ns3)C[C@@H]12	ZINC000450783284	CF	On-Demand	Anodyne	FAAH	0	45
COc1cc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)ccc1O	ZINC000450783303	DF	On-Demand	Anodyne	PDGFRB	26	47
COc1cc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)ccc1O	ZINC000450783303	DF	On-Demand	Anodyne	TRPV1	0	44
COc1cc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)ccc1O	ZINC000450783303	DF	On-Demand	Anodyne	PANC	45	32
COc1cc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)ccc1O	ZINC000450783304	DF	On-Demand	Anodyne	PDGFRB	26	47
COc1cc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)ccc1O	ZINC000450783304	DF	On-Demand	Anodyne	TRPV1	0	44
COc1cc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)ccc1O	ZINC000450783304	DF	On-Demand	Anodyne	PANC	45	32
Cc1ccc(C(=O)N2CC(NC(=O)C3CC3)C2)c(Cl)c1Cl	ZINC000450783305	EF	On-Demand	Anodyne	EPHX2	17	45
C[C@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450783315	EH	On-Demand	Anodyne	L3MBTL1	0	44
C[C@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450783315	EH	On-Demand	Anodyne	L3MBTL3	78	44
C[C@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450783315	EH	On-Demand	Anodyne	MBTD1	0	40
C[C@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450783315	EH	On-Demand	Anodyne	HPGD	44	40
CC[C@@H](O)CC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450783316	EF	On-Demand	Anodyne	RBP4	25	41
CC[C@H](O)CC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450783317	EF	On-Demand	Anodyne	RBP4	25	41
C[C@@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450783318	EH	On-Demand	Anodyne	L3MBTL1	0	44
C[C@@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450783318	EH	On-Demand	Anodyne	L3MBTL3	78	44
C[C@@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450783318	EH	On-Demand	Anodyne	MBTD1	0	40
C[C@@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)C1CCCCC1	ZINC000450783318	EH	On-Demand	Anodyne	HPGD	44	40
CC[C@@H](O)CC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000450783319	EF	On-Demand	Anodyne	RBP4	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc4ncnn34)CC2)cc1	ZINC000450783320	GE	On-Demand	Anodyne	CSNK2A1	59	38
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc4ncnn34)CC2)cc1	ZINC000450783320	GE	On-Demand	Anodyne	SIGMAR1	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc4ncnn34)CC2)cc1	ZINC000450783320	GE	On-Demand	Anodyne	SSTR5	76	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc4ncnn34)CC2)cc1	ZINC000450783320	GE	On-Demand	Anodyne	MCHR1	55	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc4ncnn34)CC2)cc1	ZINC000450783320	GE	On-Demand	Anodyne	DHOD	0	50
CC[C@H](O)CC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000450783321	EF	On-Demand	Anodyne	RBP4	25	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cc(F)ccc4o3)CC2)cc1	ZINC000450783329	GG	On-Demand	Anodyne	KCNH2	15	52
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cc(F)ccc4o3)CC2)cc1	ZINC000450783329	GG	On-Demand	Anodyne	SIGMAR1	26	42
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cc(F)ccc4o3)CC2)cc1	ZINC000450783329	GG	On-Demand	Anodyne	SSTR5	42	42
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cc(F)ccc4o3)CC2)cc1	ZINC000450783329	GG	On-Demand	Anodyne	CCR3	83	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cc(F)ccc4o3)CC2)cc1	ZINC000450783329	GG	On-Demand	Anodyne	MLNR	49	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cc(F)ccc4o3)CC2)cc1	ZINC000450783329	GG	On-Demand	Anodyne	MCHR1	37	42
COc1ccc2c(c1)C[C@@H](C)N(C(=O)C1CC(C)(O)C1)[C@@H]2C	ZINC000450783343	DF	On-Demand	Anodyne	HCRTR2	0	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)C1CC(C)(O)C1)[C@@H]2C	ZINC000450783345	DF	On-Demand	Anodyne	HCRTR2	0	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)C1CC(C)(O)C1)[C@H]2C	ZINC000450783348	DF	On-Demand	Anodyne	HCRTR2	0	41
Cc1sccc1C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450783349	CG	On-Demand	Anodyne	ITK	44	35
COc1ccc2c(c1)C[C@@H](C)N(C(=O)C1CC(C)(O)C1)[C@H]2C	ZINC000450783350	DF	On-Demand	Anodyne	HCRTR2	0	41
Cc1sccc1C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450783351	CG	On-Demand	Anodyne	ITK	44	35
CCc1cccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)n1	ZINC000450783353	CG	On-Demand	Anodyne	ITK	55	34
CCc1cccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)n1	ZINC000450783353	CG	On-Demand	Anodyne	PANC	52	35
CCc1cccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)n1	ZINC000450783355	CG	On-Demand	Anodyne	ITK	55	34
CCc1cccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)n1	ZINC000450783355	CG	On-Demand	Anodyne	PANC	52	35
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	DRD4	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	LTA4H	37	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	SSTR5	82	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	CCR3	44	39
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	UTS2R	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	MLNR	65	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	CXCR3	33	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	MCHR1	50	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(OC(F)F)cn3)CC2)cc1	ZINC000450783362	GH	On-Demand	Anodyne	NOD2	40	37
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450783393	ED	On-Demand	Anodyne	BIRC2	40	33
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450783394	ED	On-Demand	Anodyne	BIRC2	40	33
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450783395	ED	On-Demand	Anodyne	BIRC2	40	33
CO[C@H](Cc1ccccc1)CN1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450783396	ED	On-Demand	Anodyne	BIRC2	40	33
CO[C@@H]1CCC[C@H]1Nc1ncnc2ccc(C)cc12	ZINC000450783398	CF	On-Demand	Anodyne	CD38	64	45
CCOC(=O)c1cc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)[nH]c1C	ZINC000450783407	EF	On-Demand	Anodyne	ITK	46	32
CCOC(=O)c1cc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)[nH]c1C	ZINC000450783408	EF	On-Demand	Anodyne	ITK	46	32
Cc1nn(C)cc1CNC(=O)Cc1cc2ccccc2s1	ZINC000450783411	CF	On-Demand	Anodyne	P2RX7	56	42
CC(=O)C[C@@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450783414	GF	On-Demand	Anodyne	PDE6D	88	38
CC(=O)C[C@@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450783414	GF	On-Demand	Anodyne	IMDH_CRYPV	25	42
CC(=O)C[C@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450783415	GF	On-Demand	Anodyne	PDE6D	88	38
CC(=O)C[C@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450783415	GF	On-Demand	Anodyne	IMDH_CRYPV	25	42
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CC(NC(=O)C2CC2)C1	ZINC000450783416	CD	On-Demand	Anodyne	EPHX2	16	40
C[C@H](C1CC1)n1cc(NC(=O)C2(C(F)(F)F)CCC2)cn1	ZINC000450783419	DH	On-Demand	Anodyne	PANC	40	32
C[C@@H](C1CC1)n1cc(NC(=O)C2(C(F)(F)F)CCC2)cn1	ZINC000450783420	DH	On-Demand	Anodyne	PANC	40	32
CSc1cccc(C(=O)N2CC(NC(=O)C3CC3)C2)c1	ZINC000450783421	CD	On-Demand	Anodyne	RHOA	0	45
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	DRD4	18	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	LTA4H	24	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	SIGMAR1	21	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	SSTR5	79	45
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	MLNR	47	39
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	MAPK1	76	35
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	MCHR1	45	43
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	AXL	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	MERTK	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)F)n3)CC2)cc1	ZINC000450783431	GG	On-Demand	Anodyne	HIVRT	0	41
COC(=O)c1cccnc1SCCN(C)Cc1ccccc1	ZINC000450783436	DG	On-Demand	Anodyne	FAS	58	41
O=C(c1ccc(SCC[C@H]2CCOC2)nc1)N1CCCC1	ZINC000450783453	DF	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(SCC[C@H]2CCOC2)nc1)N1CCCC1	ZINC000450783453	DF	On-Demand	Anodyne	L3MBTL3	51	35
O=C(c1ccc(SCC[C@@H]2CCOC2)nc1)N1CCCC1	ZINC000450783454	DF	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(SCC[C@@H]2CCOC2)nc1)N1CCCC1	ZINC000450783454	DF	On-Demand	Anodyne	L3MBTL3	51	35
O=C(NC1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783462	FF	On-Demand	Anodyne	MC4R	24	40
O=C(NC1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783462	FF	On-Demand	Anodyne	MC3R	42	40
O=C(NC1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783462	FF	On-Demand	Anodyne	MC5R	30	40
O=C(NC1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783463	FF	On-Demand	Anodyne	MC4R	24	40
O=C(NC1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783463	FF	On-Demand	Anodyne	MC3R	42	40
O=C(NC1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783463	FF	On-Demand	Anodyne	MC5R	30	40
O=C(NC1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783464	FF	On-Demand	Anodyne	MC4R	24	40
O=C(NC1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783464	FF	On-Demand	Anodyne	MC3R	42	40
O=C(NC1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783464	FF	On-Demand	Anodyne	MC5R	30	40
O=C(NC1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783465	FF	On-Demand	Anodyne	MC4R	24	40
O=C(NC1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783465	FF	On-Demand	Anodyne	MC3R	42	40
O=C(NC1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1)C1CC1	ZINC000450783465	FF	On-Demand	Anodyne	MC5R	30	40
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)cn1	ZINC000450783466	FI	On-Demand	Anodyne	NAMPT	21	43
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450783468	GD	On-Demand	Anodyne	L3MBTL3	51	39
COC(=O)C(C)(C)N1CCN(C(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450783469	FD	On-Demand	Anodyne	TRPV1	42	50
COC(=O)C(C)(C)N1CCN(C(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450783469	FD	On-Demand	Anodyne	NCE103	25	40
COC(=O)C(C)(C)N1CCN(C(=O)Cc2ccc(O)c(OC)c2)CC1	ZINC000450783469	FD	On-Demand	Anodyne	CAN2	0	40
CCOc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450783470	FF	On-Demand	Anodyne	SSTR5	73	51
CCOc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450783470	FF	On-Demand	Anodyne	TIMP3	53	30
CCOc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450783470	FF	On-Demand	Anodyne	MCHR1	36	43
CCOc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450783470	FF	On-Demand	Anodyne	AXL	25	42
CCOc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450783470	FF	On-Demand	Anodyne	MERTK	25	42
CCOc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450783470	FF	On-Demand	Anodyne	NOD2	40	38
COC(=O)c1cccnc1SCCC(C)(F)F	ZINC000450783471	CG	On-Demand	Anodyne	FAS	34	44
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c1	ZINC000450783474	FI	On-Demand	Anodyne	KCNK3	27	42
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c1	ZINC000450783474	FI	On-Demand	Anodyne	KCNK9	32	43
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c1	ZINC000450783475	FI	On-Demand	Anodyne	KCNK3	27	42
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c1	ZINC000450783475	FI	On-Demand	Anodyne	KCNK9	32	43
O=C(c1ccc(SC[C@H]2C[C@H]3CC[C@H]2O3)nc1)N1CCCC1	ZINC000450783476	DF	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc(SC[C@H]2C[C@H]3CC[C@H]2O3)nc1)N1CCCC1	ZINC000450783476	DF	On-Demand	Anodyne	L3MBTL3	63	40
O=C(c1ccc(SC[C@@H]2C[C@H]3CC[C@H]2O3)nc1)N1CCCC1	ZINC000450783477	DF	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc(SC[C@@H]2C[C@H]3CC[C@H]2O3)nc1)N1CCCC1	ZINC000450783477	DF	On-Demand	Anodyne	L3MBTL3	63	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	CHRM2	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	TSHR	43	34
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	DRD4	42	47
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	ACHE	27	45
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	DRD3	0	47
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	CHRM3	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	LTA4H	37	46
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	SIGMAR1	33	44
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	SSTR5	91	48
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	CCR1	19	42
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	CCR3	41	42
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	FAAH	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	CXCR3	37	58
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	MCHR1	71	47
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	AXL	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	MERTK	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnc4ccccc4n3)CC2)cc1	ZINC000450783483	GH	On-Demand	Anodyne	NOD2	44	39
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4c(F)cccc4o3)CC2)cc1	ZINC000450783494	GG	On-Demand	Anodyne	SIGMAR1	27	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4c(F)cccc4o3)CC2)cc1	ZINC000450783494	GG	On-Demand	Anodyne	MCHR1	32	40
CCS(=O)(=O)c1ccc(CN2CCC([C@H](C)NC(C)=O)CC2)cc1	ZINC000450783509	FE	On-Demand	Anodyne	ACHE	16	42
CCS(=O)(=O)c1ccc(CN2CCC([C@H](C)NC(C)=O)CC2)cc1	ZINC000450783509	FE	On-Demand	Anodyne	SIGMAR1	30	40
CCS(=O)(=O)c1ccc(CN2CCC([C@H](C)NC(C)=O)CC2)cc1	ZINC000450783509	FE	On-Demand	Anodyne	RORC	49	33
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](C)NC(C)=O)CC2)cc1	ZINC000450783510	FE	On-Demand	Anodyne	ACHE	16	42
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](C)NC(C)=O)CC2)cc1	ZINC000450783510	FE	On-Demand	Anodyne	SIGMAR1	30	40
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](C)NC(C)=O)CC2)cc1	ZINC000450783510	FE	On-Demand	Anodyne	RORC	49	33
COC(=O)c1coc(CN2CCC(COc3ccccc3C(F)(F)F)CC2)n1	ZINC000450783512	GH	On-Demand	Anodyne	ACHE	15	40
COC(=O)c1coc(CN2CCC(COc3ccccc3C(F)(F)F)CC2)n1	ZINC000450783512	GH	On-Demand	Anodyne	HTR4	40	33
CC(=O)N[C@@H](C)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450783562	DF	On-Demand	Anodyne	SSTR5	42	33
CC(=O)N[C@@H](C)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450783562	DF	On-Demand	Anodyne	HCN1	40	31
CC(=O)N[C@@H](C)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450783562	DF	On-Demand	Anodyne	HCN4	40	31
CC(=O)N[C@H](C)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450783563	DF	On-Demand	Anodyne	SSTR5	42	33
CC(=O)N[C@H](C)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450783563	DF	On-Demand	Anodyne	HCN1	40	31
CC(=O)N[C@H](C)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450783563	DF	On-Demand	Anodyne	HCN4	40	31
O=C(c1cccc2c1CCCC2)N1CCO[C@H](COCC2CC2)C1	ZINC000450783582	EF	On-Demand	Anodyne	FABP4	45	35
O=C(c1cccc2c1CCCC2)N1CCO[C@@H](COCC2CC2)C1	ZINC000450783583	EF	On-Demand	Anodyne	FABP4	45	35
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c([N+](=O)[O-])c3)CC2)cc1	ZINC000450783599	GH	On-Demand	Mild	LTA4H	19	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c([N+](=O)[O-])c3)CC2)cc1	ZINC000450783599	GH	On-Demand	Mild	CSNK2A1	52	36
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c([N+](=O)[O-])c3)CC2)cc1	ZINC000450783599	GH	On-Demand	Mild	SIGMAR1	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c([N+](=O)[O-])c3)CC2)cc1	ZINC000450783599	GH	On-Demand	Mild	SSTR5	45	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c([N+](=O)[O-])c3)CC2)cc1	ZINC000450783599	GH	On-Demand	Mild	MLNR	40	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c([N+](=O)[O-])c3)CC2)cc1	ZINC000450783599	GH	On-Demand	Mild	MCHR1	33	42
COC(=O)C(C)(C)N1CCN(C(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450783600	GD	On-Demand	Anodyne	THYX_PBCV1	0	41
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	DRD4	24	43
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	PPIA	30	42
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	LTA4H	29	43
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	SIGMAR1	22	40
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	SSTR5	86	47
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	MLNR	43	40
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	MCHR1	45	43
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	AXL	30	42
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	TYRO3	37	42
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	MERTK	39	42
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	NOD1	26	42
CCOC(=O)c1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000450783601	GG	On-Demand	Anodyne	NOD2	42	42
COC(=O)c1ccc(C(=O)CSc2ccc(C(=O)N3CCCC3)cn2)o1	ZINC000450783602	FF	On-Demand	Anodyne	BDKRB1	0	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4s3)CC2)cc1	ZINC000450783603	GH	On-Demand	Anodyne	ACHE	23	43
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4s3)CC2)cc1	ZINC000450783603	GH	On-Demand	Anodyne	LTA4H	24	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4s3)CC2)cc1	ZINC000450783603	GH	On-Demand	Anodyne	SIGMAR1	29	42
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4s3)CC2)cc1	ZINC000450783603	GH	On-Demand	Anodyne	MCHR2	40	37
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4s3)CC2)cc1	ZINC000450783603	GH	On-Demand	Anodyne	NOD2	40	34
COC(=O)c1ccc(CN2CC[C@H](n3c(C)nc4c3CCCC4)C2)cc1Cl	ZINC000450783605	GH	On-Demand	Anodyne	CCR3	42	40
COC(=O)c1ccc(CN2CC[C@@H](n3c(C)nc4c3CCCC4)C2)cc1Cl	ZINC000450783606	GH	On-Demand	Anodyne	CCR3	42	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccn3)CC2)cc1	ZINC000450783619	EF	On-Demand	Mild	CSNK2A1	62	35
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccn3)CC2)cc1	ZINC000450783619	EF	On-Demand	Mild	SIGMAR1	27	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccn3)CC2)cc1	ZINC000450783619	EF	On-Demand	Mild	SSTR5	65	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccn3)CC2)cc1	ZINC000450783619	EF	On-Demand	Mild	CCR3	40	36
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccn3)CC2)cc1	ZINC000450783619	EF	On-Demand	Mild	PRKD1	50	33
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccn3)CC2)cc1	ZINC000450783619	EF	On-Demand	Mild	MLNR	45	46
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccn3)CC2)cc1	ZINC000450783619	EF	On-Demand	Mild	MCHR1	54	44
COCc1nc(=NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)s[nH]1	ZINC000450783626	GE	On-Demand	Anodyne	MCHR1	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4c3cnn4C)CC2)cc1	ZINC000450783627	GF	On-Demand	Anodyne	SSTR5	61	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4c3cnn4C)CC2)cc1	ZINC000450783627	GF	On-Demand	Anodyne	MCHR1	42	40
CC(=O)Nc1ccc(CN2CCC(Nc3c(C)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450783630	GH	On-Demand	Bother	DRD4	26	43
CC(=O)Nc1ccc(CN2CCC(Nc3c(C)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450783630	GH	On-Demand	Bother	ACHE	18	44
CC(=O)Nc1ccc(CN2CCC(Nc3c(C)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450783630	GH	On-Demand	Bother	LTA4H	20	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(C)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450783630	GH	On-Demand	Bother	SIGMAR1	26	44
CC(=O)Nc1ccc(CN2CCC(Nc3c(C)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450783630	GH	On-Demand	Bother	SSTR5	40	39
CC(=O)Nc1ccc(CN2CCC(Nc3c(C)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450783630	GH	On-Demand	Bother	MCHR1	38	43
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cn1	ZINC000450783634	FG	On-Demand	Anodyne	ITK	41	33
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cn1	ZINC000450783634	FG	On-Demand	Anodyne	PANC	52	33
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cn1	ZINC000450783635	FG	On-Demand	Anodyne	ITK	41	33
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cn1	ZINC000450783635	FG	On-Demand	Anodyne	PANC	52	33
Cc1ccc(F)c(CSc2ccc(C(=O)N3CCCC3)cn2)c1	ZINC000450783636	EI	On-Demand	Anodyne	HPGD	48	41
CC(C)c1nccc(N2CC(=O)N[C@H](C)C2)n1	ZINC000450783640	BC	On-Demand	Anodyne	SORD	61	37
CC(C)c1nccc(N2CC(=O)N[C@@H](C)C2)n1	ZINC000450783641	BC	On-Demand	Anodyne	SORD	61	37
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	DRD4	41	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	KCNH2	19	49
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	LTA4H	26	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	HRH3	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	SIGMAR1	31	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	SSTR5	87	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	CCR1	30	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	CCR3	75	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	MLNR	62	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	FAAH	22	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	CCR2	24	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	EPHX2	36	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	ERBB4	44	34
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	CXCR3	63	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	MCHR1	95	52
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	CACNA1G	30	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	AXL	32	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	TYRO3	31	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3F)CC2)cc1	ZINC000450783654	GH	On-Demand	Anodyne	MERTK	34	41
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783671	GG	On-Demand	Anodyne	MC4R	70	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783671	GG	On-Demand	Anodyne	PRCP	60	46
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783671	GG	On-Demand	Anodyne	MC3R	52	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783671	GG	On-Demand	Anodyne	MC5R	43	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783671	GG	On-Demand	Anodyne	MC1R	35	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783671	GG	On-Demand	Anodyne	NPBWR1	62	36
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783672	GG	On-Demand	Anodyne	MC4R	70	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783672	GG	On-Demand	Anodyne	PRCP	60	46
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783672	GG	On-Demand	Anodyne	MC3R	52	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783672	GG	On-Demand	Anodyne	MC5R	43	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783672	GG	On-Demand	Anodyne	MC1R	35	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783672	GG	On-Demand	Anodyne	NPBWR1	62	36
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783673	GG	On-Demand	Anodyne	MC4R	70	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783673	GG	On-Demand	Anodyne	PRCP	60	46
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783673	GG	On-Demand	Anodyne	MC3R	52	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783673	GG	On-Demand	Anodyne	MC5R	43	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783673	GG	On-Demand	Anodyne	MC1R	35	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783673	GG	On-Demand	Anodyne	NPBWR1	62	36
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783674	GG	On-Demand	Anodyne	MC4R	70	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783674	GG	On-Demand	Anodyne	PRCP	60	46
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783674	GG	On-Demand	Anodyne	MC3R	52	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783674	GG	On-Demand	Anodyne	MC5R	43	48
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783674	GG	On-Demand	Anodyne	MC1R	35	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450783674	GG	On-Demand	Anodyne	NPBWR1	62	36
CC(=O)Nc1ccc(CN2CCC(Nc3nncs3)CC2)cc1	ZINC000450783682	ED	On-Demand	Anodyne	LTA4H	24	44
CC(=O)Nc1ccc(CN2CCC(Nc3nncs3)CC2)cc1	ZINC000450783682	ED	On-Demand	Anodyne	SIGMAR1	25	42
CC(=O)Nc1ccc(CN2CCC(Nc3nncs3)CC2)cc1	ZINC000450783682	ED	On-Demand	Anodyne	SSTR5	65	46
CC(=O)Nc1ccc(CN2CCC(Nc3nncs3)CC2)cc1	ZINC000450783682	ED	On-Demand	Anodyne	CCR3	26	40
CC(=O)Nc1ccc(CN2CCC(Nc3nncs3)CC2)cc1	ZINC000450783682	ED	On-Demand	Anodyne	MLNR	34	40
CC(=O)Nc1ccc(CN2CCC(Nc3nncs3)CC2)cc1	ZINC000450783682	ED	On-Demand	Anodyne	MCHR1	40	43
COC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450783687	GD	On-Demand	Anodyne	DRD4	21	42
COC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450783687	GD	On-Demand	Anodyne	ACHE	16	41
COC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450783687	GD	On-Demand	Anodyne	LTA4H	23	44
COC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450783687	GD	On-Demand	Anodyne	SIGMAR1	23	41
COC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450783687	GD	On-Demand	Anodyne	SSTR5	78	48
COC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450783687	GD	On-Demand	Anodyne	MCHR1	43	44
COC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450783687	GD	On-Demand	Anodyne	NOD2	41	36
O=C(CC[C@@H]1CCC(=O)N1)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000450783693	GI	On-Demand	Anodyne	HDAC11	20	45
O=C(CC[C@H]1CCC(=O)N1)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000450783694	GI	On-Demand	Anodyne	HDAC11	20	45
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	ACHE	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	KCNH2	16	49
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	CHRM3	15	44
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	LTA4H	16	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	CSNK2A1	45	35
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	SIGMAR1	32	43
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	SSTR5	67	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	CCR3	66	43
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	MLNR	66	45
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	CCR2	19	44
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cc(C#N)cc3F)CC2)cc1	ZINC000450783696	GH	On-Demand	Mild	MCHR1	84	45
Cc1ccc(C(=O)N2CC(NC(=O)C3CCC3)C2)c2c1CCC2	ZINC000450783701	DE	On-Demand	Anodyne	L3MBTL3	40	32
O=[N+]([O-])c1ccc(N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)cc1C(F)(F)F	ZINC000450783715	EG	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1C(F)(F)F	ZINC000450783716	EG	On-Demand	Bother	AADAC	0	40
O=[N+]([O-])c1ccc(N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1C(F)(F)F	ZINC000450783717	EG	On-Demand	Bother	AADAC	0	40
OC[C@@H](C1CC1)[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)C1CC1	ZINC000450783720	EE	On-Demand	Anodyne	DHOD	0	50
OC[C@@H](C1CC1)[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C1CC1	ZINC000450783721	EE	On-Demand	Anodyne	DHOD	0	50
OC[C@H](C1CC1)[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)C1CC1	ZINC000450783722	EE	On-Demand	Anodyne	DHOD	0	50
OC[C@H](C1CC1)[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C1CC1	ZINC000450783723	EE	On-Demand	Anodyne	DHOD	0	50
CCc1nc(SCc2ccc(Cl)c(OC)c2)n[nH]1	ZINC000450783755	CG	On-Demand	Anodyne	METAP2	15	42
Cc1ccc(CC(=O)N2CC(NC(=O)C3CCC3)C2)c(Br)c1	ZINC000450783783	FE	On-Demand	Anodyne	EPHX2	24	43
COc1ccc2c(c1)C[C@@H](C)N(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]2C	ZINC000450783784	FG	On-Demand	Anodyne	HCRTR2	24	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)CCc1ccc(C(N)=O)cc1)[C@H]2C	ZINC000450783785	FG	On-Demand	Anodyne	HCRTR2	24	41
COc1ccc2c(c1)C[C@@H](C)N(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]2C	ZINC000450783786	FG	On-Demand	Anodyne	HCRTR2	24	41
COc1ccc2c(c1)C[C@H](C)N(C(=O)CCc1ccc(C(N)=O)cc1)[C@@H]2C	ZINC000450783787	FG	On-Demand	Anodyne	HCRTR2	24	41
CN1CCN(c2nc3ccccc3nc2N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)CC1	ZINC000450783798	FD	On-Demand	Anodyne	HTR3A	31	53
CN1CCN(c2nc3ccccc3nc2N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)CC1	ZINC000450783798	FD	On-Demand	Anodyne	HRH4	36	53
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H]2CCC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450783799	FD	On-Demand	Bother	TAAR1	19	42
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H]2CCC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450783800	FD	On-Demand	Bother	TAAR1	19	42
C[C@H](C1CC1)n1cc(NC(=O)c2cc(-c3ccccc3)nn2C)cn1	ZINC000450783801	EH	On-Demand	Anodyne	ITK	59	37
C[C@@H](C1CC1)n1cc(NC(=O)c2cc(-c3ccccc3)nn2C)cn1	ZINC000450783802	EH	On-Demand	Anodyne	ITK	59	37
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	ADORA1	48	59
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	SIGMAR1	15	40
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	SSTR5	75	47
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	CDK1	18	40
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	ADORA3	46	38
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	MCHR1	26	40
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	AXL	26	40
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	MERTK	24	40
CCn1cnc2c(NC3CCN(Cc4ccc(NC(C)=O)cc4)CC3)ncnc21	ZINC000450783808	GF	On-Demand	Anodyne	Q4VQ11_PIG	49	36
C[C@H](C1CC1)n1cc(NC(=O)[C@@]2(C#N)C[C@H]2C)cn1	ZINC000450783814	CE	On-Demand	Mild	ITK	48	34
C[C@H]1C[C@]1(C#N)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450783815	CE	On-Demand	Mild	ITK	48	34
C[C@H]1C[C@@]1(C#N)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450783816	CE	On-Demand	Mild	ITK	48	34
C[C@H](C1CC1)n1cc(NC(=O)[C@]2(C#N)C[C@H]2C)cn1	ZINC000450783817	CE	On-Demand	Mild	ITK	48	34
COc1ccccc1Oc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)nc1	ZINC000450783822	GI	On-Demand	Anodyne	ITK	46	34
COc1ccccc1Oc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)nc1	ZINC000450783822	GI	On-Demand	Anodyne	PANC	47	34
COc1ccccc1Oc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)nc1	ZINC000450783823	GI	On-Demand	Anodyne	ITK	46	34
COc1ccccc1Oc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)nc1	ZINC000450783823	GI	On-Demand	Anodyne	PANC	47	34
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	DRD2	18	41
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	TSHR	65	35
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	DRD4	36	41
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	ACHE	24	40
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	DRD3	0	46
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	LTA4H	18	43
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	SIGMAR1	28	45
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	SSTR5	73	47
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	CCR3	46	41
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	MLNR	42	39
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	MCHR1	42	48
COc1cccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1[N+](=O)[O-]	ZINC000450783834	GH	On-Demand	Bother	CCR8	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C#N)CC2)cc1	ZINC000450783841	EF	On-Demand	Mild	DRD4	23	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C#N)CC2)cc1	ZINC000450783841	EF	On-Demand	Mild	CSNK2A1	70	39
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C#N)CC2)cc1	ZINC000450783841	EF	On-Demand	Mild	SIGMAR1	28	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C#N)CC2)cc1	ZINC000450783841	EF	On-Demand	Mild	SSTR5	63	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C#N)CC2)cc1	ZINC000450783841	EF	On-Demand	Mild	MLNR	42	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C#N)CC2)cc1	ZINC000450783841	EF	On-Demand	Mild	MCHR1	40	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3C#N)CC2)cc1	ZINC000450783841	EF	On-Demand	Mild	NOD2	40	36
COC(=O)[C@@H](C)SCC/C=C/c1ccccc1	ZINC000450783842	CG	On-Demand	Anodyne	CACNA1B	43	33
COC(=O)[C@H](C)SCC/C=C\c1ccccc1	ZINC000450783843	CG	On-Demand	Anodyne	CACNA1B	43	33
COC(=O)[C@H](C)SCC/C=C/c1ccccc1	ZINC000450783844	CG	On-Demand	Anodyne	CACNA1B	43	33
COC(=O)[C@@H](C)SCC/C=C\c1ccccc1	ZINC000450783845	CG	On-Demand	Anodyne	CACNA1B	43	33
CC(=O)C[C@H]1COCCN1C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450783846	GF	On-Demand	Anodyne	CYP2D6	15	41
CC(=O)C[C@@H]1COCCN1C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450783847	GF	On-Demand	Anodyne	CYP2D6	15	41
CC(=O)C[C@H]1COCCN1C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450783848	GF	On-Demand	Anodyne	CYP2D6	15	41
CC(=O)C[C@@H]1COCCN1C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450783849	GF	On-Demand	Anodyne	CYP2D6	15	41
N#C[C@@H]1CC[C@@H](Sc2nc3cc(F)c(F)cc3[nH]2)C1	ZINC000450783874	CH	On-Demand	Mild	TXN	17	41
N#C[C@H]1CC[C@@H](Sc2nc3cc(F)c(F)cc3[nH]2)C1	ZINC000450783875	CH	On-Demand	Mild	TXN	17	41
N#C[C@@H]1CC[C@H](Sc2nc3cc(F)c(F)cc3[nH]2)C1	ZINC000450783876	CH	On-Demand	Mild	TXN	17	41
N#C[C@H]1CC[C@H](Sc2nc3cc(F)c(F)cc3[nH]2)C1	ZINC000450783877	CH	On-Demand	Mild	TXN	17	41
C[C@@H](C1CC1)n1cc(NC(=O)c2cccc(C#N)c2Br)cn1	ZINC000450783878	FH	On-Demand	Mild	ITK	45	36
C[C@H](C1CC1)n1cc(NC(=O)c2cccc(C#N)c2Br)cn1	ZINC000450783879	FH	On-Demand	Mild	ITK	45	36
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	EGFR	61	38
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	DRD4	20	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	KCNH2	15	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	ERBB2	50	38
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	PDGFRB	42	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	SSTR5	82	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	CCR2	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	ERBB4	58	35
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	MCHR1	65	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccc(C)cc34)CC2)cc1	ZINC000450783880	GH	On-Demand	Anodyne	CD38	57	42
COCc1nn(C)cc1C(=O)NCC1(c2ccc(F)cc2Cl)CCCC1	ZINC000450783883	GH	On-Demand	Anodyne	P2RX7	47	43
COCc1nn(C)cc1C(=O)NCC1(c2ccc(F)cc2Cl)CCCC1	ZINC000450783883	GH	On-Demand	Anodyne	SLC6A9	49	37
COCc1nn(C)cc1C(=O)NCC1(c2ccc(F)cc2Cl)CCCC1	ZINC000450783883	GH	On-Demand	Anodyne	HCN1	51	34
COCc1nn(C)cc1C(=O)NCC1(c2ccc(F)cc2Cl)CCCC1	ZINC000450783883	GH	On-Demand	Anodyne	HCN4	47	31
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3F)CC2)cc1	ZINC000450783884	FH	On-Demand	Mild	CSNK2A1	51	35
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3F)CC2)cc1	ZINC000450783884	FH	On-Demand	Mild	SIGMAR1	29	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3F)CC2)cc1	ZINC000450783884	FH	On-Demand	Mild	SSTR5	50	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3F)CC2)cc1	ZINC000450783884	FH	On-Demand	Mild	CCR3	56	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3F)CC2)cc1	ZINC000450783884	FH	On-Demand	Mild	MLNR	55	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3F)CC2)cc1	ZINC000450783884	FH	On-Demand	Mild	CCR2	16	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3F)CC2)cc1	ZINC000450783884	FH	On-Demand	Mild	MCHR1	67	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3F)CC2)cc1	ZINC000450783884	FH	On-Demand	Mild	HIVRT	0	46
C[C@H](C1CC1)n1cc(NC(=O)C(C)(C)C(C)(F)F)cn1	ZINC000450783885	CG	On-Demand	Anodyne	PANC	41	32
C[C@@H](C1CC1)n1cc(NC(=O)C(C)(C)C(C)(F)F)cn1	ZINC000450783886	CG	On-Demand	Anodyne	PANC	41	32
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	ACHE	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	LTA4H	31	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	SIGMAR1	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	SSTR5	79	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	CCR3	32	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	UTS2R	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	MLNR	67	39
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	CCR2	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	MCHR1	61	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(=O)N(C)C)cn3)CC2)cc1	ZINC000450783890	GF	On-Demand	Anodyne	NOD2	40	36
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4sccc34)CC2)cc1	ZINC000450783892	GH	On-Demand	Anodyne	DRD4	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4sccc34)CC2)cc1	ZINC000450783892	GH	On-Demand	Anodyne	LTA4H	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4sccc34)CC2)cc1	ZINC000450783892	GH	On-Demand	Anodyne	SIGMAR1	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4sccc34)CC2)cc1	ZINC000450783892	GH	On-Demand	Anodyne	SSTR5	68	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4sccc34)CC2)cc1	ZINC000450783892	GH	On-Demand	Anodyne	MCHR1	39	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4sccc34)CC2)cc1	ZINC000450783892	GH	On-Demand	Anodyne	AXL	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4sccc34)CC2)cc1	ZINC000450783892	GH	On-Demand	Anodyne	MERTK	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccn3)CC2)cc1	ZINC000450783893	EG	On-Demand	Anodyne	DRD4	28	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccn3)CC2)cc1	ZINC000450783893	EG	On-Demand	Anodyne	SIGMAR1	26	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccn3)CC2)cc1	ZINC000450783893	EG	On-Demand	Anodyne	SSTR5	69	47
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccn3)CC2)cc1	ZINC000450783893	EG	On-Demand	Anodyne	PRKD1	61	33
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccn3)CC2)cc1	ZINC000450783893	EG	On-Demand	Anodyne	MCHR1	54	46
CC(=O)Nc1ccc(CN2CCC(Nc3cccnc3C#N)CC2)cc1	ZINC000450783895	EF	On-Demand	Mild	DHODH	41	35
CC(=O)Nc1ccc(CN2CCC(Nc3cccnc3C#N)CC2)cc1	ZINC000450783895	EF	On-Demand	Mild	CSNK2A1	64	36
CC(=O)Nc1ccc(CN2CCC(Nc3cccnc3C#N)CC2)cc1	ZINC000450783895	EF	On-Demand	Mild	SIGMAR1	28	40
CC(=O)Nc1ccc(CN2CCC(Nc3cccnc3C#N)CC2)cc1	ZINC000450783895	EF	On-Demand	Mild	SSTR5	65	45
CC(=O)Nc1ccc(CN2CCC(Nc3cccnc3C#N)CC2)cc1	ZINC000450783895	EF	On-Demand	Mild	CCR3	49	37
CC(=O)Nc1ccc(CN2CCC(Nc3cccnc3C#N)CC2)cc1	ZINC000450783895	EF	On-Demand	Mild	MLNR	42	43
CC(=O)Nc1ccc(CN2CCC(Nc3cccnc3C#N)CC2)cc1	ZINC000450783895	EF	On-Demand	Mild	MCHR1	38	43
CN1CCN(c2nc3ccccc3nc2N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)CC1	ZINC000450783899	FD	On-Demand	Anodyne	HTR3A	31	53
CN1CCN(c2nc3ccccc3nc2N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)CC1	ZINC000450783899	FD	On-Demand	Anodyne	HRH4	36	53
CN1CCN(c2nc3ccccc3nc2N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)CC1	ZINC000450783900	FD	On-Demand	Anodyne	HTR3A	31	53
CN1CCN(c2nc3ccccc3nc2N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)CC1	ZINC000450783900	FD	On-Demand	Anodyne	HRH4	36	53
CCCc1cc(N[C@H](C2CC2)[C@H](CO)C2CC2)n2ncnc2n1	ZINC000450783908	DE	On-Demand	Anodyne	DHOD	0	41
CCCc1cc(N[C@H](C2CC2)[C@@H](CO)C2CC2)n2ncnc2n1	ZINC000450783909	DE	On-Demand	Anodyne	DHOD	0	41
CCCc1cc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)n2ncnc2n1	ZINC000450783910	DE	On-Demand	Anodyne	DHOD	0	41
CCCc1cc(N[C@@H](C2CC2)[C@H](CO)C2CC2)n2ncnc2n1	ZINC000450783911	DE	On-Demand	Anodyne	DHOD	0	41
CCOC(=O)c1ccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)nc1	ZINC000450783928	GH	On-Demand	Anodyne	MLNR	45	38
CCOC(=O)c1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)nc1	ZINC000450783929	GH	On-Demand	Anodyne	MLNR	45	38
C[C@]1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CC=CCC1	ZINC000450783970	FI	On-Demand	Anodyne	RBP4	86	42
C[C@@]1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CC=CCC1	ZINC000450783971	FI	On-Demand	Anodyne	RBP4	86	42
C[C@@]1(C(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)CC=CCC1	ZINC000450783972	FI	On-Demand	Anodyne	RBP4	86	42
C[C@]1(C(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)CC=CCC1	ZINC000450783973	FI	On-Demand	Anodyne	RBP4	86	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3C#N)CC2)cc1	ZINC000450783999	FH	On-Demand	Mild	LTA4H	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3C#N)CC2)cc1	ZINC000450783999	FH	On-Demand	Mild	CSNK2A1	74	37
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3C#N)CC2)cc1	ZINC000450783999	FH	On-Demand	Mild	SIGMAR1	33	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3C#N)CC2)cc1	ZINC000450783999	FH	On-Demand	Mild	SSTR5	51	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3C#N)CC2)cc1	ZINC000450783999	FH	On-Demand	Mild	CCR3	84	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3C#N)CC2)cc1	ZINC000450783999	FH	On-Demand	Mild	MLNR	57	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3C#N)CC2)cc1	ZINC000450783999	FH	On-Demand	Mild	CCR2	17	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3C#N)CC2)cc1	ZINC000450783999	FH	On-Demand	Mild	MCHR1	51	46
C[C@@H](C1CC1)n1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)cn1	ZINC000450784005	GG	On-Demand	Anodyne	RORC	42	39
C[C@H](C1CC1)n1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)cn1	ZINC000450784006	GG	On-Demand	Anodyne	RORC	42	39
O=C(NC1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1)C1CC1	ZINC000450784007	DE	On-Demand	Anodyne	EPHX2	28	46
O=C(NC1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1)C1CC1	ZINC000450784008	DE	On-Demand	Anodyne	EPHX2	28	46
O=C(NC1CN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1)C1CC1	ZINC000450784009	DE	On-Demand	Anodyne	EPHX2	28	46
O=C(NC1CN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1)C1CC1	ZINC000450784010	DE	On-Demand	Anodyne	EPHX2	28	46
C[C@@H](C1CC1)n1cc(NC(=O)c2ccn(CCc3ccccc3)n2)cn1	ZINC000450784015	EH	On-Demand	Anodyne	ITK	59	36
C[C@@H](C1CC1)n1cc(NC(=O)c2ccn(CCc3ccccc3)n2)cn1	ZINC000450784015	EH	On-Demand	Anodyne	PANC	56	41
C[C@H](C1CC1)n1cc(NC(=O)c2ccn(CCc3ccccc3)n2)cn1	ZINC000450784016	EH	On-Demand	Anodyne	ITK	59	36
C[C@H](C1CC1)n1cc(NC(=O)c2ccn(CCc3ccccc3)n2)cn1	ZINC000450784016	EH	On-Demand	Anodyne	PANC	56	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)n3)CC2)cc1	ZINC000450784018	EF	On-Demand	Anodyne	SIGMAR1	26	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)n3)CC2)cc1	ZINC000450784018	EF	On-Demand	Anodyne	SSTR5	68	47
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)n3)CC2)cc1	ZINC000450784018	EF	On-Demand	Anodyne	MAPK1	67	35
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)n3)CC2)cc1	ZINC000450784018	EF	On-Demand	Anodyne	MAPK8	34	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)n3)CC2)cc1	ZINC000450784018	EF	On-Demand	Anodyne	MCHR1	46	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)n3)CC2)cc1	ZINC000450784018	EF	On-Demand	Anodyne	AXL	26	41
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cn1	ZINC000450784034	DG	On-Demand	Anodyne	ITK	40	33
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cn1	ZINC000450784034	DG	On-Demand	Anodyne	PANC	44	33
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cn1	ZINC000450784035	DG	On-Demand	Anodyne	ITK	40	33
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(C(F)(F)F)[nH]2)cn1	ZINC000450784035	DG	On-Demand	Anodyne	PANC	44	33
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450784056	FG	On-Demand	Bother	SIGMAR1	24	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450784056	FG	On-Demand	Bother	SSTR5	61	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450784056	FG	On-Demand	Bother	MCHR1	30	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450784056	FG	On-Demand	Bother	ABHD6	0	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450784056	FG	On-Demand	Bother	KCNJ1	20	40
C[C@@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)Nc1nccs1	ZINC000450784069	FF	On-Demand	Anodyne	MAP1	82	36
C[C@H](Sc1ccc(C(=O)N2CCCC2)cn1)C(=O)Nc1nccs1	ZINC000450784070	FF	On-Demand	Anodyne	MAP1	82	36
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	DRD4	34	44
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	ACHE	21	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	KCNH2	15	47
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	LTA4H	31	44
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	CSNK2A1	45	35
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	SIGMAR1	28	44
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	SSTR5	85	49
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	CCR3	49	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	MLNR	44	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	CCR2	20	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	CXCR3	41	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	MCHR1	75	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)nc(C)n3)CC2)cc1	ZINC000450784071	FG	On-Demand	Anodyne	NOD2	40	35
COc1cc(CC(=O)N2CCOC[C@H]2CC(C)=O)ccc1Cl	ZINC000450784075	EE	On-Demand	Anodyne	OPRM1	16	44
COc1cc(CC(=O)N2CCOC[C@H]2CC(C)=O)ccc1Cl	ZINC000450784075	EE	On-Demand	Anodyne	OPRK1	49	44
COc1cc(CC(=O)N2CCOC[C@@H]2CC(C)=O)ccc1Cl	ZINC000450784076	EE	On-Demand	Anodyne	OPRM1	16	44
COc1cc(CC(=O)N2CCOC[C@@H]2CC(C)=O)ccc1Cl	ZINC000450784076	EE	On-Demand	Anodyne	OPRK1	49	44
CCOc1nc2ccc(C(=O)Nc3cnn([C@H](C)C4CC4)c3)cc2[nH]1	ZINC000450784086	EG	On-Demand	Anodyne	ITK	56	35
CCOc1nc2ccc(C(=O)Nc3cnn([C@H](C)C4CC4)c3)cc2[nH]1	ZINC000450784086	EG	On-Demand	Anodyne	PANC	49	33
CCOc1nc2ccc(C(=O)Nc3cnn([C@@H](C)C4CC4)c3)cc2[nH]1	ZINC000450784087	EG	On-Demand	Anodyne	ITK	56	35
CCOc1nc2ccc(C(=O)Nc3cnn([C@@H](C)C4CC4)c3)cc2[nH]1	ZINC000450784087	EG	On-Demand	Anodyne	PANC	49	33
CCS(=O)(=O)c1ccc(CSc2nnc(-c3sc(C)nc3C)o2)cc1	ZINC000450784088	GH	On-Demand	Anodyne	GSK3A	47	37
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	TSHR	41	32
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	DRD4	42	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	ACHE	25	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	DRD3	0	50
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	LTA4H	40	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	SSTR5	76	49
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	CCR3	48	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	MLNR	47	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	CXCR3	45	38
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	MCHR1	63	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	AXL	26	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	MERTK	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccn3)CC2)cc1	ZINC000450784089	EF	On-Demand	Anodyne	NOD2	43	38
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3C#N)CC2)cc1	ZINC000450784093	FG	On-Demand	Mild	CSNK2A1	64	36
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3C#N)CC2)cc1	ZINC000450784093	FG	On-Demand	Mild	SSTR5	57	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3C#N)CC2)cc1	ZINC000450784093	FG	On-Demand	Mild	HIVRT	0	43
Ic1ccc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450784107	GF	On-Demand	Anodyne	PDE3A	41	31
Ic1ccc2ncnc(N3C[C@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450784107	GF	On-Demand	Anodyne	PDE3B	61	31
Ic1ccc2ncnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450784108	GF	On-Demand	Anodyne	PDE3A	41	31
Ic1ccc2ncnc(N3C[C@@H]4[C@H]5C=C[C@@H](O5)[C@H]4C3)c2c1	ZINC000450784108	GF	On-Demand	Anodyne	PDE3B	61	31
Ic1ccc2ncnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2c1	ZINC000450784109	GF	On-Demand	Anodyne	PDE3A	41	31
Ic1ccc2ncnc(N3C[C@@H]4[C@@H](C3)[C@H]3C=C[C@H]4O3)c2c1	ZINC000450784109	GF	On-Demand	Anodyne	PDE3B	61	31
Cc1nnc2c3ccccc3c(N3C[C@H]4CCCC[C@H]4C3)nn12	ZINC000450784110	DG	On-Demand	Anodyne	CREBBP	46	35
Cc1nnc2c3ccccc3c(N3C[C@H]4CCCC[C@H]4C3)nn12	ZINC000450784110	DG	On-Demand	Anodyne	BRD9	58	37
C1=C[C@H]2O[C@H]1[C@H]1CN(c3ccnc(Cc4ccccc4)n3)C[C@H]21	ZINC000450784111	DE	On-Demand	Anodyne	SORD	47	40
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ccnc(Cc4ccccc4)n3)C[C@H]12	ZINC000450784112	DE	On-Demand	Anodyne	SORD	47	40
C1=C[C@H]2O[C@H]1[C@@H]1CN(c3ccnc(Cc4ccccc4)n3)C[C@@H]12	ZINC000450784113	DE	On-Demand	Anodyne	SORD	47	40
CC(C)OC(=O)[C@@H](Nc1ncccc1[N+](=O)[O-])C(C)C	ZINC000450784125	CE	On-Demand	Bother	COLA	44	35
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	TSHR	61	34
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	DRD4	28	44
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	ACHE	18	40
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	DRD3	16	41
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	LTA4H	27	43
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	SIGMAR1	26	41
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	SSTR5	88	51
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	CCR3	41	37
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	CCR2	15	40
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	PDK1	47	37
COc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784135	FE	On-Demand	Anodyne	MCHR1	65	45
CC(=O)[C@@](C)(O)CN1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450784157	DE	On-Demand	Anodyne	MC4R	40	34
CC(=O)[C@@](C)(O)CN1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450784159	DE	On-Demand	Anodyne	MC4R	40	34
CC(=O)[C@](C)(O)CN1CCO[C@@H](c2ccc(F)cc2Cl)C1	ZINC000450784161	DE	On-Demand	Anodyne	MC4R	40	34
CC(=O)[C@](C)(O)CN1CCO[C@H](c2ccc(F)cc2Cl)C1	ZINC000450784162	DE	On-Demand	Anodyne	MC4R	40	34
COc1cc(CN2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450784163	EF	On-Demand	Anodyne	SSTR5	59	38
COc1cc(CN2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450784163	EF	On-Demand	Anodyne	FAAH	22	42
COc1cc(CN2CCN(C(=O)NC(C)(C)C)CC2)ccc1Cl	ZINC000450784163	EF	On-Demand	Anodyne	MCHR1	25	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450784179	GG	On-Demand	Bother	LTA4H	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450784179	GG	On-Demand	Bother	SIGMAR1	18	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450784179	GG	On-Demand	Bother	SSTR5	61	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450784179	GG	On-Demand	Bother	MCHR1	38	41
O=C(c1ccc(SCc2cc(Cl)sc2Cl)nc1)N1CCCC1	ZINC000450784181	FJ	On-Demand	Anodyne	HPGD	41	40
CCS(=O)(=O)c1ccc(CN2CCCC[C@H](C)C2)cc1	ZINC000450784184	CG	On-Demand	Anodyne	HRH3	25	48
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H](C)C2)cc1	ZINC000450784193	CG	On-Demand	Anodyne	HRH3	25	48
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	TSHR	55	33
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	DRD4	25	43
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	DRD3	0	40
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	LTA4H	23	42
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	SIGMAR1	25	40
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	SSTR5	87	51
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	PDK1	40	36
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	MCHR1	65	44
COc1cc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450784194	FF	On-Demand	Anodyne	HIVRT	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(NC(=O)C2CCC2)C1	ZINC000450784195	EF	On-Demand	Anodyne	CACNA1B	48	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(NC(=O)C2CCC2)C1	ZINC000450784195	EF	On-Demand	Anodyne	EPHX2	22	43
Cc1ccc(Br)cc1CC(=O)N1CC(NC(=O)C2CC2)C1	ZINC000450784214	FE	On-Demand	Anodyne	EPHX2	21	40
CNC(=O)c1ccc(N[C@@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450784215	EE	On-Demand	Bother	TAAR1	17	43
CNC(=O)c1ccc(N[C@@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450784217	EE	On-Demand	Bother	TAAR1	17	43
CNC(=O)c1ccc(N[C@H](C2CC2)[C@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450784218	EE	On-Demand	Bother	TAAR1	17	43
CNC(=O)c1ccc(N[C@H](C2CC2)[C@@H](CO)C2CC2)c([N+](=O)[O-])c1	ZINC000450784219	EE	On-Demand	Bother	TAAR1	17	43
Cc1nn(C)cc1CSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450784223	DF	On-Demand	Anodyne	HPGD	46	41
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1ccsn1)[C@@H]2C	ZINC000450784235	DG	On-Demand	Anodyne	HCRTR2	0	42
COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1ccsn1)[C@H]2C	ZINC000450784236	DG	On-Demand	Anodyne	HCRTR2	0	42
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1ccsn1)[C@H]2C	ZINC000450784237	DG	On-Demand	Anodyne	HCRTR2	0	42
COc1ccc2c(c1)C[C@H](C)N(C(=O)c1ccsn1)[C@@H]2C	ZINC000450784238	DG	On-Demand	Anodyne	HCRTR2	0	42
C[C@@H](C1CC1)n1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cn1	ZINC000450784246	FG	On-Demand	Anodyne	ITK	46	33
C[C@@H](C1CC1)n1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cn1	ZINC000450784246	FG	On-Demand	Anodyne	PANC	54	37
C[C@H](C1CC1)n1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cn1	ZINC000450784247	FG	On-Demand	Anodyne	ITK	46	33
C[C@H](C1CC1)n1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cn1	ZINC000450784247	FG	On-Demand	Anodyne	PANC	54	37
C[C@@H](C1CC1)n1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cn1	ZINC000450784249	FG	On-Demand	Anodyne	ITK	46	33
C[C@@H](C1CC1)n1cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cn1	ZINC000450784249	FG	On-Demand	Anodyne	PANC	54	37
C[C@H](C1CC1)n1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cn1	ZINC000450784250	FG	On-Demand	Anodyne	ITK	46	33
C[C@H](C1CC1)n1cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cn1	ZINC000450784250	FG	On-Demand	Anodyne	PANC	54	37
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784261	GH	On-Demand	Bother	ACHE	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784261	GH	On-Demand	Bother	SIGMAR1	30	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784261	GH	On-Demand	Bother	SSTR5	63	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784261	GH	On-Demand	Bother	CCR3	84	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784261	GH	On-Demand	Bother	MLNR	55	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784261	GH	On-Demand	Bother	CCR2	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784261	GH	On-Demand	Bother	MCHR1	53	43
CCCOc1cccc(Cn2cccc(C(F)(F)F)c2=O)c1	ZINC000450784268	DH	On-Demand	Anodyne	UPP1	60	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]ccc34)CC2)cc1	ZINC000450784269	FF	On-Demand	Anodyne	SSTR5	62	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]ccc34)CC2)cc1	ZINC000450784269	FF	On-Demand	Anodyne	JAK3	25	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]ccc34)CC2)cc1	ZINC000450784269	FF	On-Demand	Anodyne	JAK1	73	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]ccc34)CC2)cc1	ZINC000450784269	FF	On-Demand	Anodyne	JAK2	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]ccc34)CC2)cc1	ZINC000450784269	FF	On-Demand	Anodyne	AKT1	34	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]ccc34)CC2)cc1	ZINC000450784269	FF	On-Demand	Anodyne	TYK2	0	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4[nH]ccc34)CC2)cc1	ZINC000450784269	FF	On-Demand	Anodyne	MCHR1	37	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	DRD4	16	43
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	LTA4H	28	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	SIGMAR1	23	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	SSTR5	83	47
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	MLNR	43	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	CCR2	17	47
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	MCHR1	59	43
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	AXL	26	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	TYRO3	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(F)(F)F)n3)CC2)cc1	ZINC000450784272	GH	On-Demand	Anodyne	MERTK	31	40
COc1cc(CSc2nnc(-c3sc(C)nc3C)o2)ccc1Cl	ZINC000450784274	FJ	On-Demand	Anodyne	GSK3B	17	47
COc1cc(CSc2nnc(-c3sc(C)nc3C)o2)ccc1Cl	ZINC000450784274	FJ	On-Demand	Anodyne	GSK3A	45	42
C[C@H](C1CC1)n1cc(NC(=O)c2ccsc2Br)cn1	ZINC000450784275	EH	On-Demand	Anodyne	ITK	43	34
C[C@@H](C1CC1)n1cc(NC(=O)c2ccsc2Br)cn1	ZINC000450784276	EH	On-Demand	Anodyne	ITK	43	34
CC(=O)Nc1ccc(CN2CCC(N=c3ccc(Cl)c(C#N)[nH]3)CC2)cc1	ZINC000450784279	GG	On-Demand	Mild	MCHR1	15	40
CO[C@H](Cc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784289	DG	On-Demand	Anodyne	TIMP3	58	33
CO[C@H](Cc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784289	DG	On-Demand	Anodyne	ITK	60	37
CO[C@H](Cc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784289	DG	On-Demand	Anodyne	PANC	49	37
CO[C@@H](Cc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784290	DG	On-Demand	Anodyne	TIMP3	58	33
CO[C@@H](Cc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784290	DG	On-Demand	Anodyne	ITK	60	37
CO[C@@H](Cc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784290	DG	On-Demand	Anodyne	PANC	49	37
CO[C@@H](Cc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784291	DG	On-Demand	Anodyne	TIMP3	58	33
CO[C@@H](Cc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784291	DG	On-Demand	Anodyne	ITK	60	37
CO[C@@H](Cc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784291	DG	On-Demand	Anodyne	PANC	49	37
CO[C@H](Cc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784292	DG	On-Demand	Anodyne	TIMP3	58	33
CO[C@H](Cc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784292	DG	On-Demand	Anodyne	ITK	60	37
CO[C@H](Cc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784292	DG	On-Demand	Anodyne	PANC	49	37
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	DRD2	29	40
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	DRD1	17	45
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	DRD4	22	50
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	HTR2A	27	49
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	HTR2C	22	52
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	SLC6A1	40	33
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	SLC18A3	16	41
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784296	FH	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	DRD2	29	40
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	DRD1	17	45
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	DRD4	22	50
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	HTR2A	27	49
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	HTR2C	22	52
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	SLC6A1	40	33
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	ERG2	19	40
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	SLC18A3	16	41
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccc(F)cc1	ZINC000450784297	FH	On-Demand	Anodyne	CYP2J2	52	37
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C#N)n3)CC2)cc1	ZINC000450784298	FF	On-Demand	Mild	CSNK2A1	65	36
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C#N)n3)CC2)cc1	ZINC000450784298	FF	On-Demand	Mild	SIGMAR1	25	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C#N)n3)CC2)cc1	ZINC000450784298	FF	On-Demand	Mild	MCHR1	50	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C#N)n3)CC2)cc1	ZINC000450784298	FF	On-Demand	Mild	HIVRT	0	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)c(C)n3)CC2)cc1	ZINC000450784303	FG	On-Demand	Anodyne	SIGMAR1	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)c(C)n3)CC2)cc1	ZINC000450784303	FG	On-Demand	Anodyne	SSTR5	66	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)c(C)n3)CC2)cc1	ZINC000450784303	FG	On-Demand	Anodyne	MCHR1	46	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)c(C)n3)CC2)cc1	ZINC000450784303	FG	On-Demand	Anodyne	AXL	39	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)c(C)n3)CC2)cc1	ZINC000450784303	FG	On-Demand	Anodyne	TYRO3	37	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)c(C)n3)CC2)cc1	ZINC000450784303	FG	On-Demand	Anodyne	MERTK	38	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)c(C)n3)CC2)cc1	ZINC000450784303	FG	On-Demand	Anodyne	HIVRT	0	41
O=C(c1ccc(SC[C@@H]2CCCCC2(F)F)nc1)N1CCCC1	ZINC000450784306	EI	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(SC[C@@H]2CCCCC2(F)F)nc1)N1CCCC1	ZINC000450784306	EI	On-Demand	Anodyne	L3MBTL3	67	41
O=C(c1ccc(SC[C@H]2CCCCC2(F)F)nc1)N1CCCC1	ZINC000450784307	EI	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(SC[C@H]2CCCCC2(F)F)nc1)N1CCCC1	ZINC000450784307	EI	On-Demand	Anodyne	L3MBTL3	67	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])s3)CC2)cc1	ZINC000450784321	GG	On-Demand	Bother	LTA4H	20	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])s3)CC2)cc1	ZINC000450784321	GG	On-Demand	Bother	SIGMAR1	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])s3)CC2)cc1	ZINC000450784321	GG	On-Demand	Bother	SSTR5	68	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])s3)CC2)cc1	ZINC000450784321	GG	On-Demand	Bother	MCHR1	26	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])s3)CC2)cc1	ZINC000450784321	GG	On-Demand	Bother	MGEA5	34	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(F)F)CC2)cc1	ZINC000450784323	GF	On-Demand	Anodyne	LTA4H	25	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(F)F)CC2)cc1	ZINC000450784323	GF	On-Demand	Anodyne	SSTR5	79	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(F)F)CC2)cc1	ZINC000450784323	GF	On-Demand	Anodyne	MLNR	41	38
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(F)F)CC2)cc1	ZINC000450784323	GF	On-Demand	Anodyne	MCHR1	41	43
CC(F)(F)CCSc1nc2cc(F)c(F)cc2[nH]1	ZINC000450784329	CH	On-Demand	Anodyne	CYP1A2	15	40
CC(F)(F)CCSc1nc2cc(F)c(F)cc2[nH]1	ZINC000450784329	CH	On-Demand	Anodyne	CYP2C19	16	40
C[C@@H]1CN(c2ncnc3cc(F)c(F)cc23)CC(=O)N1	ZINC000450784332	CD	On-Demand	Anodyne	PDE3A	46	34
C[C@H]1CN(c2ncnc3cc(F)c(F)cc23)CC(=O)N1	ZINC000450784333	CD	On-Demand	Anodyne	PDE3A	46	34
Cc1cc(C)c(C(=O)N2CC(NC(=O)C3CC3)C2)cc1Br	ZINC000450784342	FE	On-Demand	Anodyne	EPHX2	21	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4nc(N)ccc34)CC2)cc1	ZINC000450784352	GE	On-Demand	Anodyne	SIGMAR1	16	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4nc(N)ccc34)CC2)cc1	ZINC000450784352	GE	On-Demand	Anodyne	SSTR5	70	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4nc(N)ccc34)CC2)cc1	ZINC000450784352	GE	On-Demand	Anodyne	MCHR1	40	49
COc1ccc(Oc2ccc(C(=O)Nc3cnn([C@@H](C)C4CC4)c3)nc2)cc1	ZINC000450784360	GI	On-Demand	Anodyne	ITK	44	32
COc1ccc(Oc2ccc(C(=O)Nc3cnn([C@H](C)C4CC4)c3)nc2)cc1	ZINC000450784362	GI	On-Demand	Anodyne	ITK	44	32
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nncn4n3)CC2)cc1	ZINC000450784364	FD	On-Demand	Anodyne	DRD4	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nncn4n3)CC2)cc1	ZINC000450784364	FD	On-Demand	Anodyne	LTA4H	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nncn4n3)CC2)cc1	ZINC000450784364	FD	On-Demand	Anodyne	SIGMAR1	23	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nncn4n3)CC2)cc1	ZINC000450784364	FD	On-Demand	Anodyne	SSTR5	71	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nncn4n3)CC2)cc1	ZINC000450784364	FD	On-Demand	Anodyne	MLNR	36	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nncn4n3)CC2)cc1	ZINC000450784364	FD	On-Demand	Anodyne	MCHR1	42	41
CC(=O)Nc1ccc(CN2CCC(N=c3cc[nH]c4ccncc34)CC2)cc1	ZINC000450784365	GG	On-Demand	Anodyne	HTR1D	15	42
COc1cc2nc(N[C@H](C3CC3)[C@H](CO)C3CC3)nc(N)c2cc1OC	ZINC000450784373	FE	On-Demand	Anodyne	ADRA1B	42	37
COc1cc2nc(N[C@H](C3CC3)[C@H](CO)C3CC3)nc(N)c2cc1OC	ZINC000450784373	FE	On-Demand	Anodyne	PDPK1	43	33
COc1cc2nc(N[C@@H](C3CC3)[C@H](CO)C3CC3)nc(N)c2cc1OC	ZINC000450784378	FE	On-Demand	Anodyne	ADRA1B	42	37
COc1cc2nc(N[C@@H](C3CC3)[C@H](CO)C3CC3)nc(N)c2cc1OC	ZINC000450784378	FE	On-Demand	Anodyne	PDPK1	43	33
COc1cc2nc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)nc(N)c2cc1OC	ZINC000450784379	FE	On-Demand	Anodyne	ADRA1B	42	37
COc1cc2nc(N[C@@H](C3CC3)[C@@H](CO)C3CC3)nc(N)c2cc1OC	ZINC000450784379	FE	On-Demand	Anodyne	PDPK1	43	33
COc1cc2nc(N[C@H](C3CC3)[C@@H](CO)C3CC3)nc(N)c2cc1OC	ZINC000450784380	FE	On-Demand	Anodyne	ADRA1B	42	37
COc1cc2nc(N[C@H](C3CC3)[C@@H](CO)C3CC3)nc(N)c2cc1OC	ZINC000450784380	FE	On-Demand	Anodyne	PDPK1	43	33
Cc1ccc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(C(C)C)n1	ZINC000450784401	EH	On-Demand	Anodyne	KCNK3	94	41
Cc1ccc(C(=O)Nc2cccc(-c3ncn(C)n3)c2)c(C(C)C)n1	ZINC000450784401	EH	On-Demand	Anodyne	KCNK9	75	39
C[C@H](OCCc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784411	EG	On-Demand	Anodyne	TIMP3	47	31
C[C@H](OCCc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784411	EG	On-Demand	Anodyne	ITK	52	35
C[C@H](OCCc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784411	EG	On-Demand	Anodyne	PANC	48	37
C[C@H](OCCc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784418	EG	On-Demand	Anodyne	TIMP3	47	31
C[C@H](OCCc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784418	EG	On-Demand	Anodyne	ITK	52	35
C[C@H](OCCc1ccccc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784418	EG	On-Demand	Anodyne	PANC	48	37
C[C@@H](OCCc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784419	EG	On-Demand	Anodyne	TIMP3	47	31
C[C@@H](OCCc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784419	EG	On-Demand	Anodyne	ITK	52	35
C[C@@H](OCCc1ccccc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784419	EG	On-Demand	Anodyne	PANC	48	37
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H](C)OCCc2ccccc2)cn1	ZINC000450784421	EG	On-Demand	Anodyne	TIMP3	47	31
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H](C)OCCc2ccccc2)cn1	ZINC000450784421	EG	On-Demand	Anodyne	ITK	52	35
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H](C)OCCc2ccccc2)cn1	ZINC000450784421	EG	On-Demand	Anodyne	PANC	48	37
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1	ZINC000450784422	GH	On-Demand	Bother	DRD4	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1	ZINC000450784422	GH	On-Demand	Bother	LTA4H	18	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1	ZINC000450784422	GH	On-Demand	Bother	SIGMAR1	23	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1	ZINC000450784422	GH	On-Demand	Bother	SSTR5	66	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1	ZINC000450784422	GH	On-Demand	Bother	MLNR	43	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C)c3)CC2)cc1	ZINC000450784422	GH	On-Demand	Bother	MCHR1	43	42
CC(=O)Nc1ccc(CN2CCC(Nc3cnccc3C#N)CC2)cc1	ZINC000450784426	EF	On-Demand	Mild	CSNK2A1	93	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnccc3C#N)CC2)cc1	ZINC000450784426	EF	On-Demand	Mild	SSTR5	59	43
CC(=O)Nc1ccc(CN2CCC(Nc3cnccc3C#N)CC2)cc1	ZINC000450784426	EF	On-Demand	Mild	CCR3	43	35
CC(=O)Nc1ccc(CN2CCC(Nc3cnccc3C#N)CC2)cc1	ZINC000450784426	EF	On-Demand	Mild	MLNR	44	42
CC(=O)Nc1ccc(CN2CCC(Nc3cnccc3C#N)CC2)cc1	ZINC000450784426	EF	On-Demand	Mild	MCHR1	47	44
CC(=O)Nc1ccc(CN2CCC(Nc3cnccc3C#N)CC2)cc1	ZINC000450784426	EF	On-Demand	Mild	HIPK2	53	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784428	EG	On-Demand	Anodyne	PANC	45	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784430	EG	On-Demand	Anodyne	PANC	45	31
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	HTR1A	24	58
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	DRD2	42	57
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	DRD1	27	57
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	DRD4	23	52
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	HTR2A	31	56
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	HTR2C	25	58
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	HRH1	19	56
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	DRD3	21	52
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	DRD5	30	44
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	ERG2	27	56
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	HTR7	32	56
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	SIGMAR1	39	56
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	CCR1	26	40
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	CCR3	20	41
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	UTS2R	0	42
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	SLC18A3	24	58
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	ABCB1	17	56
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	CYP2J2	65	46
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	NET	0	56
O=C(CCCN1CCC(O)(Cc2ccc(F)cc2)CC1)c1ccccc1	ZINC000450784441	FH	On-Demand	Anodyne	AP2S1	0	56
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)s3)CC2)cc1	ZINC000450784451	EE	On-Demand	Anodyne	DRD4	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)s3)CC2)cc1	ZINC000450784451	EE	On-Demand	Anodyne	LTA4H	22	44
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)s3)CC2)cc1	ZINC000450784451	EE	On-Demand	Anodyne	SIGMAR1	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)s3)CC2)cc1	ZINC000450784451	EE	On-Demand	Anodyne	SSTR5	67	46
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)s3)CC2)cc1	ZINC000450784451	EE	On-Demand	Anodyne	MLNR	38	40
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)s3)CC2)cc1	ZINC000450784451	EE	On-Demand	Anodyne	MCHR1	44	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)s3)CC2)cc1	ZINC000450784451	EE	On-Demand	Anodyne	NOD2	41	34
O=c1c(C(F)(F)F)cccn1CCSCc1ccccc1	ZINC000450784460	DH	On-Demand	Anodyne	CACNA2D1	0	40
COCCn1cc(N2C[C@H](C(=O)Nc3cnn([C@@H](C)C4CC4)c3)CC2=O)cn1	ZINC000450784462	GD	On-Demand	Anodyne	PANC	40	31
COCCn1cc(N2C[C@@H](C(=O)Nc3cnn([C@H](C)C4CC4)c3)CC2=O)cn1	ZINC000450784464	GD	On-Demand	Anodyne	PANC	40	31
COCCn1cc(N2C[C@H](C(=O)Nc3cnn([C@H](C)C4CC4)c3)CC2=O)cn1	ZINC000450784465	GD	On-Demand	Anodyne	PANC	40	31
O=C1CCC(CN2CCC(O)(Cc3ccc(F)cc3)CC2)CC1	ZINC000450784518	DF	On-Demand	Anodyne	SIGMAR1	21	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC(NC(=O)C2CCC2)C1	ZINC000450784524	FD	On-Demand	Anodyne	RHODESAIN	0	41
CCn1cnc2c(N[C@H](C(=O)OC(C)C)C(C)C)ncnc21	ZINC000450784529	DE	On-Demand	Anodyne	P2RY1	16	40
CC(F)(F)C(C)(C)C(=O)NCc1ccc(Cl)cc1F	ZINC000450784543	CH	On-Demand	Anodyne	P2RX7	51	39
CN1CC[C@@H]2CN(c3c(C#N)cnc4c(F)ccc(Cl)c34)C[C@@H]21	ZINC000450784559	EG	On-Demand	Mild	MAP3K8	50	34
CN1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@@H]21	ZINC000450784561	DF	On-Demand	Bother	AADAC	0	41
COCCn1cc(N2C[C@@H](C(=O)Nc3cnn([C@@H](C)C4CC4)c3)CC2=O)cn1	ZINC000450784570	GD	On-Demand	Anodyne	PANC	40	31
CO[C@@H]1CCC[C@H]1Nc1ncnc2ccc(SC)cc12	ZINC000450784571	CG	On-Demand	Anodyne	CD38	54	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450784572	GG	On-Demand	Bother	DRD4	17	46
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450784572	GG	On-Demand	Bother	LTA4H	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450784572	GG	On-Demand	Bother	SIGMAR1	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450784572	GG	On-Demand	Bother	SSTR5	73	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450784572	GG	On-Demand	Bother	MCHR1	35	40
C[C@H](C1CC1)n1cc(NC(=O)[C@H]2CCC[C@H]2c2ccccc2)cn1	ZINC000450784576	DI	On-Demand	Anodyne	ITK	46	34
C[C@H](C1CC1)n1cc(NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)cn1	ZINC000450784577	DI	On-Demand	Anodyne	ITK	46	34
C[C@H](C1CC1)n1cc(NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)cn1	ZINC000450784578	DI	On-Demand	Anodyne	ITK	46	34
C[C@H](C1CC1)n1cc(NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)cn1	ZINC000450784579	DI	On-Demand	Anodyne	ITK	46	34
C[C@H](C1CC1)n1cc(NC(=O)c2ccn(CCn3cccn3)n2)cn1	ZINC000450784600	EE	On-Demand	Anodyne	ITK	53	33
C[C@H](C1CC1)n1cc(NC(=O)c2ccn(CCn3cccn3)n2)cn1	ZINC000450784600	EE	On-Demand	Anodyne	PANC	49	33
C[C@@H](C1CC1)n1cc(NC(=O)c2ccn(CCn3cccn3)n2)cn1	ZINC000450784601	EE	On-Demand	Anodyne	ITK	53	33
C[C@@H](C1CC1)n1cc(NC(=O)c2ccn(CCn3cccn3)n2)cn1	ZINC000450784601	EE	On-Demand	Anodyne	PANC	49	33
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	TSHR	55	34
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	DRD4	23	43
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	LTA4H	28	43
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	SIGMAR1	23	44
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	SSTR5	83	49
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	MCHR1	54	44
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	AXL	17	41
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	TYRO3	24	41
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	MERTK	27	41
COc1nc(C)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1C	ZINC000450784602	GG	On-Demand	Anodyne	NOD2	40	37
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3[N+](=O)[O-])CC2)cc1	ZINC000450784604	FG	On-Demand	Bother	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3[N+](=O)[O-])CC2)cc1	ZINC000450784604	FG	On-Demand	Bother	SSTR5	62	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3[N+](=O)[O-])CC2)cc1	ZINC000450784604	FG	On-Demand	Bother	MCHR1	31	44
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4o3)CC2)cc1	ZINC000450784605	FG	On-Demand	Anodyne	TSHR	44	34
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4o3)CC2)cc1	ZINC000450784605	FG	On-Demand	Anodyne	SSTR5	37	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4o3)CC2)cc1	ZINC000450784605	FG	On-Demand	Anodyne	TIMP3	40	31
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4o3)CC2)cc1	ZINC000450784605	FG	On-Demand	Anodyne	NOD2	42	37
Cc1nc([C@@H]2CCCN2Cc2ccn(CCc3ccccc3)n2)cs1	ZINC000450784607	FI	On-Demand	Anodyne	HRH3	0	40
O=C(C1=C(c2ccccc2)CCC1)N1CCC(CCCO)CC1	ZINC000450784611	DH	On-Demand	Anodyne	CHRM4	15	41
O=C(C1=C(c2ccccc2)CCC1)N1CCC(CCCO)CC1	ZINC000450784611	DH	On-Demand	Anodyne	CHRM5	28	41
O=C(C1=C(c2ccccc2)CCC1)N1CCC(CCCO)CC1	ZINC000450784611	DH	On-Demand	Anodyne	AKR1C3	15	41
CN(CCN1CCC[C@H](n2cnc(C(N)=O)n2)C1)Cc1ccccc1	ZINC000450784612	ED	On-Demand	Anodyne	SLC6A1	86	34
CN(CCN1CCC[C@@H](n2cnc(C(N)=O)n2)C1)Cc1ccccc1	ZINC000450784613	ED	On-Demand	Anodyne	SLC6A1	86	34
COC(=O)c1cccnc1SC[C@H](Cc1ccccc1)OC	ZINC000450784614	DG	On-Demand	Anodyne	PDS	46	33
COC(=O)c1cccnc1SC[C@H](Cc1ccccc1)OC	ZINC000450784614	DG	On-Demand	Anodyne	FAS	32	41
COC(=O)c1cccnc1SC[C@@H](Cc1ccccc1)OC	ZINC000450784615	DG	On-Demand	Anodyne	PDS	46	33
COC(=O)c1cccnc1SC[C@@H](Cc1ccccc1)OC	ZINC000450784615	DG	On-Demand	Anodyne	FAS	32	41
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)cn1	ZINC000450784616	FJ	On-Demand	Anodyne	NAMPT	21	41
COC(=O)c1cccnc1SCC1(OC)CCC1	ZINC000450784627	CF	On-Demand	Anodyne	FAS	22	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784629	GH	On-Demand	Bother	DRD4	24	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784629	GH	On-Demand	Bother	ACHE	18	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784629	GH	On-Demand	Bother	SIGMAR1	22	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784629	GH	On-Demand	Bother	SSTR5	61	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450784629	GH	On-Demand	Bother	MCHR1	44	43
C[C@@H](O)CCn1cccc(C(F)(F)F)c1=O	ZINC000450784637	BD	On-Demand	Anodyne	SLC16A1	45	31
COCCOC[C@@H](O)CN1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450784638	DC	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COCCOC[C@H](O)CN1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450784639	DC	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
C[C@H](O)CCn1cccc(C(F)(F)F)c1=O	ZINC000450784640	BD	On-Demand	Anodyne	SLC16A1	45	31
Cc1ccc(CC(=O)N2CC(NC(=O)C3CC3)C2)c(Br)c1	ZINC000450784644	FE	On-Demand	Anodyne	EPHX2	28	41
CCc1nc(C)c(NC(=O)Cc2ccc(Cl)c(OC)c2)s1	ZINC000450784651	DH	On-Demand	Anodyne	MAPK10	0	44
CCc1nc(C)c(NC(=O)Cc2ccc(Cl)c(OC)c2)s1	ZINC000450784651	DH	On-Demand	Anodyne	CAN2	0	40
Cc1cccc(Cl)c1CN1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450784658	EE	On-Demand	Anodyne	SLC6A1	50	38
Cc1cccc(Cl)c1CN1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450784661	EE	On-Demand	Anodyne	SLC6A1	50	38
Cc1nc2c(n1[C@H]1CCN(CCN(C)Cc3ccccc3)C1)CCCC2	ZINC000450784664	FG	On-Demand	Anodyne	SIGMAR1	17	41
Cc1nc2c(n1[C@@H]1CCN(CCN(C)Cc3ccccc3)C1)CCCC2	ZINC000450784665	FG	On-Demand	Anodyne	SIGMAR1	17	41
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(F)c3C#N)CC2)cc1	ZINC000450784667	FH	On-Demand	Mild	DHODH	46	35
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(F)c3C#N)CC2)cc1	ZINC000450784667	FH	On-Demand	Mild	CSNK2A1	48	35
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(F)c3C#N)CC2)cc1	ZINC000450784667	FH	On-Demand	Mild	SIGMAR1	31	44
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(F)c3C#N)CC2)cc1	ZINC000450784667	FH	On-Demand	Mild	SSTR5	41	39
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(F)c3C#N)CC2)cc1	ZINC000450784667	FH	On-Demand	Mild	CCR3	60	38
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(F)c3C#N)CC2)cc1	ZINC000450784667	FH	On-Demand	Mild	MLNR	56	43
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(F)c3C#N)CC2)cc1	ZINC000450784667	FH	On-Demand	Mild	MCHR1	56	43
COc1cc(CN2CC[C@H](n3c(C)nc4c3CCCC4)C2)ccc1Cl	ZINC000450784672	FI	On-Demand	Anodyne	SSTR5	51	38
COc1cc(CN2CC[C@H](n3c(C)nc4c3CCCC4)C2)ccc1Cl	ZINC000450784672	FI	On-Demand	Anodyne	CCR3	18	40
COc1cc(CN2CC[C@@H](n3c(C)nc4c3CCCC4)C2)ccc1Cl	ZINC000450784674	FI	On-Demand	Anodyne	SSTR5	51	38
COc1cc(CN2CC[C@@H](n3c(C)nc4c3CCCC4)C2)ccc1Cl	ZINC000450784674	FI	On-Demand	Anodyne	CCR3	18	40
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n2ncnc2n1	ZINC000450784675	GF	On-Demand	Anodyne	CSNK2A1	52	36
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n2ncnc2n1	ZINC000450784675	GF	On-Demand	Anodyne	SSTR5	76	46
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n2ncnc2n1	ZINC000450784675	GF	On-Demand	Anodyne	MCHR1	44	39
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n2ncnc2n1	ZINC000450784675	GF	On-Demand	Anodyne	DHOD	0	45
COC(=O)c1cccnc1SCC[C@@H](C)O	ZINC000450784676	BD	On-Demand	Anodyne	FAS	40	42
COC(=O)c1cccnc1SCC[C@H](C)O	ZINC000450784677	BD	On-Demand	Anodyne	FAS	40	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	DRD4	21	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	LTA4H	23	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	SIGMAR1	25	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	SSTR5	78	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	CCR3	26	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	UTS2R	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	CXCR3	34	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	MCHR1	51	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	AXL	36	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	TYRO3	38	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncncc3Cl)CC2)cc1	ZINC000450784678	FG	On-Demand	Anodyne	MERTK	38	44
CN(CCN1CCC[C@H]1CCO)Cc1ccccc1	ZINC000450784679	CD	On-Demand	Anodyne	SLC18A2	73	46
CN(CCN1CCC[C@H]1CCO)Cc1ccccc1	ZINC000450784679	CD	On-Demand	Anodyne	SIGMAR1	27	40
CN(CCN1CCC[C@H]1CCO)Cc1ccccc1	ZINC000450784679	CD	On-Demand	Anodyne	ACKR3	63	33
CN(CCN1CCC[C@@H]1CCO)Cc1ccccc1	ZINC000450784682	CD	On-Demand	Anodyne	SLC18A2	73	46
CN(CCN1CCC[C@@H]1CCO)Cc1ccccc1	ZINC000450784682	CD	On-Demand	Anodyne	SIGMAR1	27	40
CN(CCN1CCC[C@@H]1CCO)Cc1ccccc1	ZINC000450784682	CD	On-Demand	Anodyne	ACKR3	63	33
CC(=O)c1cccc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)c1	ZINC000450784685	DG	On-Demand	Anodyne	CXCR3	19	40
CC(=O)c1cccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)c1	ZINC000450784686	DG	On-Demand	Anodyne	CXCR3	19	40
CCS(=O)(=O)c1ccc(Cn2cccc(C(F)(F)F)c2=O)cc1	ZINC000450784687	EF	On-Demand	Anodyne	RORC	42	42
COc1ccc(CNC(=O)CCN(CC(C)(C)O)C2CC2)c(OC)c1	ZINC000450784696	FD	On-Demand	Anodyne	MTNR1A	51	37
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	DRD4	23	47
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	LTA4H	24	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	SIGMAR1	24	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	SSTR5	80	45
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	CCR3	26	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	CXCR3	28	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	MCHR1	47	43
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	AXL	22	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	TYRO3	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C)c3Cl)CC2)cc1	ZINC000450784697	FI	On-Demand	Anodyne	MERTK	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	DRD4	37	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	ACHE	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	DHODH	27	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	KCNH2	15	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	CHRM3	16	49
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	LTA4H	30	51
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	HRH3	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	SIGMAR1	37	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	SSTR5	59	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	CCR3	44	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	MLNR	61	59
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	CCR2	15	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	MCHR1	62	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	CACNA1G	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	NOD2	40	36
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3)CC2)cc1	ZINC000450784701	EH	On-Demand	Mild	HIVRT	0	40
CN1CC[C@@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@@H]21	ZINC000450784708	DF	On-Demand	Bother	LIPG	49	34
CC[C@@H](O)CC(=O)Nc1ncc(C2CCCCC2)s1	ZINC000450784710	CG	On-Demand	Anodyne	CDK5	39	46
CC[C@H](O)CC(=O)Nc1ncc(C2CCCCC2)s1	ZINC000450784711	CG	On-Demand	Anodyne	CDK5	39	46
CN1CC[C@@H]2CN(c3ncnc4c3oc3ccccc34)C[C@@H]21	ZINC000450784721	CF	On-Demand	Anodyne	HRH4	20	63
CN1CC[C@@H]2CN(c3ncnc4[nH]ccc34)C[C@@H]21	ZINC000450784722	BD	On-Demand	Anodyne	ROCK2	43	39
CN1CC[C@@H]2CN(c3ncnc4[nH]ccc34)C[C@@H]21	ZINC000450784722	BD	On-Demand	Anodyne	AKT1	38	49
CNS(=O)(=O)NCC(=O)Nc1ncc(C2CCCCC2)s1	ZINC000450784726	ED	On-Demand	Anodyne	CDK5	63	56
COC(=O)c1cccc(CS[C@@H]2C[C@@H]3CCCC[C@@H]3NC2=O)c1	ZINC000450784741	EG	On-Demand	Anodyne	LEPB	0	41
COC(=O)c1cccc(CS[C@@H]2C[C@H]3CCCC[C@H]3NC2=O)c1	ZINC000450784742	EG	On-Demand	Anodyne	LEPB	0	41
COC(=O)c1cccc(CS[C@@H]2C[C@@H]3CCCC[C@H]3NC2=O)c1	ZINC000450784743	EG	On-Demand	Anodyne	LEPB	0	41
COC(=O)c1cccc(CS[C@@H]2C[C@H]3CCCC[C@@H]3NC2=O)c1	ZINC000450784744	EG	On-Demand	Anodyne	LEPB	0	41
Cc1ccc(NC(=O)c2ccc(N3CC(=O)N[C@H](C)C3)nc2)cc1	ZINC000450784750	DD	On-Demand	Anodyne	PRNP	52	39
Cc1ccc(NC(=O)c2ccc(N3CC(=O)N[C@H](C)C3)nc2)cc1	ZINC000450784750	DD	On-Demand	Anodyne	HDAC1	29	48
Cc1ccc(NC(=O)c2ccc(N3CC(=O)N[C@@H](C)C3)nc2)cc1	ZINC000450784751	DD	On-Demand	Anodyne	PRNP	52	39
Cc1ccc(NC(=O)c2ccc(N3CC(=O)N[C@@H](C)C3)nc2)cc1	ZINC000450784751	DD	On-Demand	Anodyne	HDAC1	29	48
CCCOc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c(OC)c1	ZINC000450784760	EH	On-Demand	Anodyne	PDGFRB	29	40
CCCOc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c(OC)c1	ZINC000450784760	EH	On-Demand	Anodyne	FLT4	20	40
CCCOc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c(OC)c1	ZINC000450784761	EH	On-Demand	Anodyne	PDGFRB	29	40
CCCOc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c(OC)c1	ZINC000450784761	EH	On-Demand	Anodyne	FLT4	20	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4c(F)cccc4n3C)CC2)cc1	ZINC000450784762	GG	On-Demand	Anodyne	SIGMAR1	25	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4c(F)cccc4n3C)CC2)cc1	ZINC000450784762	GG	On-Demand	Anodyne	MCHR1	34	41
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450784763	GH	On-Demand	Mild	LTA4H	15	43
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450784763	GH	On-Demand	Mild	CSNK2A1	62	37
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450784763	GH	On-Demand	Mild	SIGMAR1	24	42
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450784763	GH	On-Demand	Mild	MCHR1	30	42
CO[C@@H]1CCC[C@H]1Nc1ncnc2[nH]ccc12	ZINC000450784764	BD	On-Demand	Anodyne	JAK2	27	49
CCCOc1cccc(Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)c1	ZINC000450784773	ED	On-Demand	Bother	UPP1	52	39
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	DRD4	25	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	KCNH2	19	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	SIGMAR1	31	49
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	SSTR5	54	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	MLNR	40	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	CCR2	16	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	MMP1	17	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	CACNA1G	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	MGLL	0	50
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	ABHD6	0	50
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	NOD2	46	33
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000450784775	FH	On-Demand	Bother	KCNJ1	27	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	CHRM2	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	DRD4	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	ACHE	17	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	CHRM3	17	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	LTA4H	30	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	SIGMAR1	27	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	SSTR5	69	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	CCR3	37	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	MLNR	47	37
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	CCR2	16	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	CXCR3	42	38
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	MCHR1	52	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	AXL	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(C)=O)cn3)CC2)cc1	ZINC000450784776	FG	On-Demand	Anodyne	NOD2	43	38
COC(=O)c1cccnc1SCc1cn(C)nc1C	ZINC000450784778	CE	On-Demand	Anodyne	FAS	19	40
Cc1nc(C)c(-c2nnc(SCc3ccc([C@@H](C)C(F)(F)F)cc3)o2)s1	ZINC000450784779	GK	On-Demand	Anodyne	GSK3B	17	40
Cc1nc(C)c(-c2nnc(SCc3ccc([C@@H](C)C(F)(F)F)cc3)o2)s1	ZINC000450784779	GK	On-Demand	Anodyne	GSK3A	48	38
Cc1nc(C)c(-c2nnc(SCc3ccc([C@H](C)C(F)(F)F)cc3)o2)s1	ZINC000450784780	GK	On-Demand	Anodyne	GSK3B	17	40
Cc1nc(C)c(-c2nnc(SCc3ccc([C@H](C)C(F)(F)F)cc3)o2)s1	ZINC000450784780	GK	On-Demand	Anodyne	GSK3A	48	38
Cc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c(Cl)c1Cl	ZINC000450784801	EJ	On-Demand	Anodyne	ITK	41	33
Cc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c(Cl)c1Cl	ZINC000450784802	EJ	On-Demand	Anodyne	ITK	41	33
C[C@@H](C1CC1)n1cc(NC(=O)c2cn(CCc3ccccc3)nn2)cn1	ZINC000450784812	FF	On-Demand	Anodyne	ITK	56	35
C[C@@H](C1CC1)n1cc(NC(=O)c2cn(CCc3ccccc3)nn2)cn1	ZINC000450784812	FF	On-Demand	Anodyne	PANC	56	41
C[C@H](C1CC1)n1cc(NC(=O)c2cn(CCc3ccccc3)nn2)cn1	ZINC000450784813	FF	On-Demand	Anodyne	ITK	56	35
C[C@H](C1CC1)n1cc(NC(=O)c2cn(CCc3ccccc3)nn2)cn1	ZINC000450784813	FF	On-Demand	Anodyne	PANC	56	41
C[C@@H]1CN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC(=O)N1	ZINC000450784814	EC	On-Demand	Bother	L3MBTL1	0	42
C[C@H]1CN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC(=O)N1	ZINC000450784815	EC	On-Demand	Bother	L3MBTL1	0	42
Cn1cnc(-c2cccc(NC(=O)[C@H](O)C3CCC3)c2)n1	ZINC000450784816	CD	On-Demand	Anodyne	SCARB1	43	36
Cn1cnc(-c2cccc(NC(=O)[C@@H](O)C3CCC3)c2)n1	ZINC000450784817	CD	On-Demand	Anodyne	SCARB1	43	36
O=C(C1=C(c2ccccc2)CCCC1)N1CCC(CCCO)CC1	ZINC000450784818	EI	On-Demand	Anodyne	CHRM2	17	46
O=C(C1=C(c2ccccc2)CCCC1)N1CCC(CCCO)CC1	ZINC000450784818	EI	On-Demand	Anodyne	CHRM4	20	41
O=C(C1=C(c2ccccc2)CCCC1)N1CCC(CCCO)CC1	ZINC000450784818	EI	On-Demand	Anodyne	CHRM5	32	41
O=C(C1=C(c2ccccc2)CCCC1)N1CCC(CCCO)CC1	ZINC000450784818	EI	On-Demand	Anodyne	CHRM3	15	41
O=C(C1=C(c2ccccc2)CCCC1)N1CCC(CCCO)CC1	ZINC000450784818	EI	On-Demand	Anodyne	AKR1C3	20	43
O=C(C1=C(c2ccccc2)CCCC1)N1CCC(CCCO)CC1	ZINC000450784818	EI	On-Demand	Anodyne	L3MBTL3	41	36
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	DRD4	22	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	LTA4H	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	CSNK2A1	100	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	SIGMAR1	21	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	SSTR5	77	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	CCR3	35	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	CCR2	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	MCHR1	55	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C#N)cc3Cl)CC2)cc1	ZINC000450784822	GH	On-Demand	Mild	HIPK2	53	40
N#C[C@H]1CC[C@@H](Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450784827	DG	On-Demand	Mild	L3MBTL1	0	45
N#C[C@H]1CC[C@@H](Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450784827	DG	On-Demand	Mild	L3MBTL3	52	36
CCN1C[C@H](Nc2nc(C)nc3ccc(OC)cc23)CC1=O	ZINC000450784842	DD	On-Demand	Anodyne	CCR4	15	44
CCN1C[C@@H](Nc2nc(C)nc3ccc(OC)cc23)CC1=O	ZINC000450784843	DD	On-Demand	Anodyne	CCR4	15	44
COc1ccc(F)cc1CNC(=O)CCCc1ncc(C)o1	ZINC000450784848	DF	On-Demand	Anodyne	PDGFRB	23	41
COc1ccc(F)cc1CNC(=O)CCCc1ncc(C)o1	ZINC000450784848	DF	On-Demand	Anodyne	GRIN2B	26	42
COc1ccc(F)cc1CNC(=O)CCCc1ncc(C)o1	ZINC000450784848	DF	On-Demand	Anodyne	P2RX7	46	43
CC(C)(O)CN(CCCC(=O)c1ccc(F)cc1)C1CC1	ZINC000450784854	CG	On-Demand	Anodyne	CYP2J2	48	36
O=C(CC1CC(F)(F)C1)NCc1ccc(Cl)cc1F	ZINC000450784858	CH	On-Demand	Anodyne	P2RX7	81	40
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784869	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784869	ED	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784869	ED	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784869	ED	On-Demand	Anodyne	MTNR1B	40	39
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784869	ED	On-Demand	Anodyne	EBP	33	40
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784870	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784870	ED	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784870	ED	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784870	ED	On-Demand	Anodyne	MTNR1B	40	39
COc1ccc(CNC(=O)CCN2CC[C@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784870	ED	On-Demand	Anodyne	EBP	33	40
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784871	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784871	ED	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784871	ED	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784871	ED	On-Demand	Anodyne	MTNR1B	40	39
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450784871	ED	On-Demand	Anodyne	EBP	33	40
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784872	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784872	ED	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784872	ED	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784872	ED	On-Demand	Anodyne	MTNR1B	40	39
COc1ccc(CNC(=O)CCN2CC[C@@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450784872	ED	On-Demand	Anodyne	EBP	33	40
COc1cc(NC2CCN([C@@H](C)c3ccc(S(C)(=O)=O)cc3)CC2)ncn1	ZINC000450784883	GF	On-Demand	Anodyne	GPR119	44	43
COc1cc(NC2CCN([C@H](C)c3ccc(S(C)(=O)=O)cc3)CC2)ncn1	ZINC000450784884	GF	On-Demand	Anodyne	GPR119	44	43
Cc1nn(C)cc1CC(=O)NCc1ccc(Cl)cc1F	ZINC000450784888	CE	On-Demand	Anodyne	CNR1	22	43
Cc1nn(C)cc1CC(=O)NCc1ccc(Cl)cc1F	ZINC000450784888	CE	On-Demand	Anodyne	P2RX7	101	52
Cc1nn(C)cc1CC(=O)NCc1ccc(Cl)cc1F	ZINC000450784888	CE	On-Demand	Anodyne	BDKRB1	22	40
COc1ccc(F)cc1CNC(=O)Cn1ccc(C)n1	ZINC000450784898	CD	On-Demand	Anodyne	P2RX7	61	46
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1	ZINC000450784899	GD	On-Demand	Anodyne	MLNR	40	35
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1	ZINC000450784899	GD	On-Demand	Anodyne	CACNA1G	43	52
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1	ZINC000450784900	GD	On-Demand	Anodyne	MLNR	40	35
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1	ZINC000450784900	GD	On-Demand	Anodyne	CACNA1G	43	52
COCCn1c(SCc2ccc(Cl)c(OC)c2)nc(C)c1C	ZINC000450784902	EI	On-Demand	Anodyne	CASR	22	41
OCC[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450784903	CE	On-Demand	Anodyne	SLC18A2	48	41
OCC[C@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450784903	CE	On-Demand	Anodyne	HRH3	0	40
OCC[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450784904	CE	On-Demand	Anodyne	SLC18A2	48	41
OCC[C@@H]1CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450784904	CE	On-Demand	Anodyne	HRH3	0	40
CC[C@@H]1C[C@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450784905	CE	On-Demand	Anodyne	GRIN2B	24	43
CC[C@@H]1C[C@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450784905	CE	On-Demand	Anodyne	P2RX7	42	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000450784907	EC	On-Demand	Anodyne	CA7	28	42
CCCCn1c(SCc2nc(-c3ccc(OC)nn3)no2)nc(C)c1C	ZINC000450784920	FG	On-Demand	Anodyne	AXIN2	0	42
Cc1ccc(Br)cc1CN1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450784922	GG	On-Demand	Anodyne	CACNA1G	37	41
Cc1ccc(Br)cc1CN1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450784923	GG	On-Demand	Anodyne	CACNA1G	37	41
CN1CC[C@@H]2CN(c3ccc(C(=O)N4CCOCC4)cc3[N+](=O)[O-])C[C@@H]21	ZINC000450784927	FD	On-Demand	Bother	L3MBTL1	0	43
CN1CC[C@@H]2CN(c3ccc(C(=O)N4CCOCC4)cc3[N+](=O)[O-])C[C@@H]21	ZINC000450784927	FD	On-Demand	Bother	L3MBTL3	47	43
N#C[C@H]1CC[C@H](Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450784928	DG	On-Demand	Mild	L3MBTL1	0	45
N#C[C@H]1CC[C@H](Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450784928	DG	On-Demand	Mild	L3MBTL3	52	36
N#C[C@@H]1CC[C@H](Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450784929	DG	On-Demand	Mild	L3MBTL1	0	45
N#C[C@@H]1CC[C@H](Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450784929	DG	On-Demand	Mild	L3MBTL3	52	36
N#C[C@@H]1CC[C@@H](Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450784930	DG	On-Demand	Mild	L3MBTL1	0	45
N#C[C@@H]1CC[C@@H](Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450784930	DG	On-Demand	Mild	L3MBTL3	52	36
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)cn1	ZINC000450784935	EI	On-Demand	Anodyne	NAMPT	19	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(C)C)s3)CC2)cc1	ZINC000450784939	FI	On-Demand	Anodyne	LTA4H	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(C)C)s3)CC2)cc1	ZINC000450784939	FI	On-Demand	Anodyne	SIGMAR1	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(C)C)s3)CC2)cc1	ZINC000450784939	FI	On-Demand	Anodyne	SSTR5	73	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(C)C)s3)CC2)cc1	ZINC000450784939	FI	On-Demand	Anodyne	CDK5	15	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(C)C)s3)CC2)cc1	ZINC000450784939	FI	On-Demand	Anodyne	MCHR1	39	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(C)C)s3)CC2)cc1	ZINC000450784939	FI	On-Demand	Anodyne	MGEA5	35	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	DRD4	33	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	ACHE	19	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	DRD3	0	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	SIGMAR1	32	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	SSTR5	69	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	CCR3	54	38
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	TACR3	42	32
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	MLNR	41	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	FAAH	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	CCR2	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	MCHR1	54	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	AXL	28	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	TYRO3	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	MERTK	27	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3Cl)CC2)cc1	ZINC000450784954	FH	On-Demand	Anodyne	NOD2	40	36
C[C@H]1CN(c2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3)cn2)CC(=O)N1	ZINC000450784957	GD	On-Demand	Anodyne	MLNR	15	46
C[C@H]1CN(c2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3)cn2)CC(=O)N1	ZINC000450784957	GD	On-Demand	Anodyne	PKM	30	40
C[C@@H]1CN(c2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3)cn2)CC(=O)N1	ZINC000450784958	GD	On-Demand	Anodyne	MLNR	15	46
C[C@@H]1CN(c2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3)cn2)CC(=O)N1	ZINC000450784958	GD	On-Demand	Anodyne	PKM	30	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nnc(C)n4n3)CC2)cc1	ZINC000450784959	GD	On-Demand	Anodyne	DRD4	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nnc(C)n4n3)CC2)cc1	ZINC000450784959	GD	On-Demand	Anodyne	LTA4H	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nnc(C)n4n3)CC2)cc1	ZINC000450784959	GD	On-Demand	Anodyne	SIGMAR1	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nnc(C)n4n3)CC2)cc1	ZINC000450784959	GD	On-Demand	Anodyne	SSTR5	63	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc4nnc(C)n4n3)CC2)cc1	ZINC000450784959	GD	On-Demand	Anodyne	MCHR1	39	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3C)CC2)cc1	ZINC000450784960	FG	On-Demand	Anodyne	DRD4	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3C)CC2)cc1	ZINC000450784960	FG	On-Demand	Anodyne	LTA4H	21	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3C)CC2)cc1	ZINC000450784960	FG	On-Demand	Anodyne	SIGMAR1	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3C)CC2)cc1	ZINC000450784960	FG	On-Demand	Anodyne	SSTR5	64	45
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3C)CC2)cc1	ZINC000450784960	FG	On-Demand	Anodyne	MCHR1	49	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3C)CC2)cc1	ZINC000450784960	FG	On-Demand	Anodyne	AXL	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3C)CC2)cc1	ZINC000450784960	FG	On-Demand	Anodyne	MERTK	18	41
CCSc1cccnc1C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784965	DH	On-Demand	Anodyne	ITK	58	37
CCSc1cccnc1C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450784965	DH	On-Demand	Anodyne	PANC	51	33
CCSc1cccnc1C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784966	DH	On-Demand	Anodyne	ITK	58	37
CCSc1cccnc1C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450784966	DH	On-Demand	Anodyne	PANC	51	33
COc1ccc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)c(Cl)c1OC	ZINC000450784967	FH	On-Demand	Anodyne	PDGFRB	27	42
COc1ccc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)c(Cl)c1OC	ZINC000450784967	FH	On-Demand	Anodyne	PANC	45	32
COc1ccc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)c(Cl)c1OC	ZINC000450784968	FH	On-Demand	Anodyne	PDGFRB	27	42
COc1ccc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)c(Cl)c1OC	ZINC000450784968	FH	On-Demand	Anodyne	PANC	45	32
CSc1cccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c1	ZINC000450784977	DH	On-Demand	Anodyne	ITK	53	36
CSc1cccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c1	ZINC000450784977	DH	On-Demand	Anodyne	MAPK10	18	44
CSc1cccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c1	ZINC000450784977	DH	On-Demand	Anodyne	PANC	45	32
CSc1cccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c1	ZINC000450784977	DH	On-Demand	Anodyne	KCNK3	68	35
CSc1cccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c1	ZINC000450784978	DH	On-Demand	Anodyne	ITK	53	36
CSc1cccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c1	ZINC000450784978	DH	On-Demand	Anodyne	MAPK10	18	44
CSc1cccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c1	ZINC000450784978	DH	On-Demand	Anodyne	PANC	45	32
CSc1cccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c1	ZINC000450784978	DH	On-Demand	Anodyne	KCNK3	68	35
COCCc1nc(=NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)s[nH]1	ZINC000450784979	GE	On-Demand	Anodyne	MCHR1	18	41
Cc1nn(C)cc1CC(=O)NCC1(c2ccc(F)cc2Cl)CCCC1	ZINC000450784991	FH	On-Demand	Anodyne	P2RX7	78	48
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccc(F)cc4n3C)CC2)cc1	ZINC000450784995	GG	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccc(F)cc4n3C)CC2)cc1	ZINC000450784995	GG	On-Demand	Anodyne	CCR3	82	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccc(F)cc4n3C)CC2)cc1	ZINC000450784995	GG	On-Demand	Anodyne	MLNR	47	39
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccc(F)cc4n3C)CC2)cc1	ZINC000450784995	GG	On-Demand	Anodyne	MCHR1	38	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccc(F)cc4n3C)CC2)cc1	ZINC000450784995	GG	On-Demand	Anodyne	ALK	36	41
Cc1cnc(CCCC(=O)NCC2(c3ccc(F)cc3Cl)CCCC2)o1	ZINC000450785000	GJ	On-Demand	Anodyne	P2RX7	40	38
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4[nH]ccc34)CC2)cc1	ZINC000450785006	GG	On-Demand	Anodyne	DRD4	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4[nH]ccc34)CC2)cc1	ZINC000450785006	GG	On-Demand	Anodyne	LTA4H	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4[nH]ccc34)CC2)cc1	ZINC000450785006	GG	On-Demand	Anodyne	SSTR5	61	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4[nH]ccc34)CC2)cc1	ZINC000450785006	GG	On-Demand	Anodyne	JAK1	41	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4[nH]ccc34)CC2)cc1	ZINC000450785006	GG	On-Demand	Anodyne	JAK2	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4[nH]ccc34)CC2)cc1	ZINC000450785006	GG	On-Demand	Anodyne	MCHR1	40	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4[nH]ccc34)CC2)cc1	ZINC000450785006	GG	On-Demand	Anodyne	AXL	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc4[nH]ccc34)CC2)cc1	ZINC000450785006	GG	On-Demand	Anodyne	MERTK	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)n3)CC2)cc1	ZINC000450785011	FE	On-Demand	Mild	LTA4H	30	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)n3)CC2)cc1	ZINC000450785011	FE	On-Demand	Mild	CSNK2A1	58	36
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)n3)CC2)cc1	ZINC000450785011	FE	On-Demand	Mild	SIGMAR1	26	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)n3)CC2)cc1	ZINC000450785011	FE	On-Demand	Mild	SSTR5	79	45
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)n3)CC2)cc1	ZINC000450785011	FE	On-Demand	Mild	MLNR	41	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)n3)CC2)cc1	ZINC000450785011	FE	On-Demand	Mild	MCHR1	47	41
CCCc1cc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)no1	ZINC000450785026	CG	On-Demand	Anodyne	PANC	53	34
CCCc1cc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)no1	ZINC000450785027	CG	On-Demand	Anodyne	PANC	53	34
C=CCN(C)C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450785093	CG	On-Demand	Mild	LSS	32	40
C=CCN(C)C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450785093	CG	On-Demand	Mild	ERG7	17	40
C=CCN(C)C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450785093	CG	On-Demand	Mild	CAS1	15	40
CC(=O)c1ccc(CN2CCC[C@H]2CCO)cc1	ZINC000450785103	BE	On-Demand	Anodyne	HRH3	0	40
CC(=O)c1ccc(CN2CCC[C@@H]2CCO)cc1	ZINC000450785104	BE	On-Demand	Anodyne	HRH3	0	40
CCN1C[C@@H](Nc2ccnc3c(Cl)cccc23)CC1=O	ZINC000450785105	CF	On-Demand	Anodyne	HRP1_PLAFA	69	35
CCN1C[C@H](Nc2ccnc3c(Cl)cccc23)CC1=O	ZINC000450785106	CF	On-Demand	Anodyne	HRP1_PLAFA	69	35
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C)s3)CC2)cc1	ZINC000450785109	FH	On-Demand	Anodyne	DRD4	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C)s3)CC2)cc1	ZINC000450785109	FH	On-Demand	Anodyne	LTA4H	21	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C)s3)CC2)cc1	ZINC000450785109	FH	On-Demand	Anodyne	SIGMAR1	23	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C)s3)CC2)cc1	ZINC000450785109	FH	On-Demand	Anodyne	SSTR5	66	45
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C)s3)CC2)cc1	ZINC000450785109	FH	On-Demand	Anodyne	MLNR	38	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)c(C)s3)CC2)cc1	ZINC000450785109	FH	On-Demand	Anodyne	MCHR1	42	44
CC(=O)Nc1ccc(CN2CCC(N=c3cc[nH]c4ccc(C)cc34)CC2)cc1	ZINC000450785113	GI	On-Demand	Anodyne	HTR1D	17	42
CC(=O)Nc1ccc(CN2CCC(N=c3cc[nH]c4ccc(C)cc34)CC2)cc1	ZINC000450785113	GI	On-Demand	Anodyne	HTR1B	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)s3)CC2)cc1	ZINC000450785118	FF	On-Demand	Anodyne	LTA4H	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)s3)CC2)cc1	ZINC000450785118	FF	On-Demand	Anodyne	SIGMAR1	23	40
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)s3)CC2)cc1	ZINC000450785118	FF	On-Demand	Anodyne	SSTR5	60	45
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)s3)CC2)cc1	ZINC000450785118	FF	On-Demand	Anodyne	MCHR1	36	41
COc1cc(Br)ccc1CNC(=O)Cc1cn(C)nc1C	ZINC000450785127	FE	On-Demand	Anodyne	PDGFRB	27	44
COc1cc(Br)ccc1CNC(=O)Cc1cn(C)nc1C	ZINC000450785127	FE	On-Demand	Anodyne	P2RX7	44	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	DRD4	38	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	ACHE	24	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	CHRM3	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	LTA4H	17	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	CSNK2A1	77	39
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	SIGMAR1	27	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	SSTR5	70	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	CCR3	46	39
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	MLNR	44	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	CCR2	22	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	CXCR3	47	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	MCHR1	69	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cc3C#N)CC2)cc1	ZINC000450785130	GI	On-Demand	Mild	CACNA1G	16	40
CO[C@@H]1CCC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450785154	DG	On-Demand	Bother	MAOA	15	52
CO[C@@H]1CCC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450785154	DG	On-Demand	Bother	MAOB	29	55
CN(C)CCNS(=O)(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450785160	GC	On-Demand	Bother	BCL2L1	84	34
CN(C)CCNS(=O)(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450785160	GC	On-Demand	Bother	BCL2	74	33
COC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785174	CE	On-Demand	Anodyne	DRD4	37	46
COC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785174	CE	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785174	CE	On-Demand	Anodyne	OPRK1	33	42
COC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785174	CE	On-Demand	Anodyne	HTR4	49	35
COC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785174	CE	On-Demand	Anodyne	SIGMAR1	31	42
COC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785174	CE	On-Demand	Anodyne	CCR3	46	40
COC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785174	CE	On-Demand	Anodyne	CXCR3	28	42
COC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785174	CE	On-Demand	Anodyne	MCHR1	35	45
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C)n3)CC2)cc1	ZINC000450785175	EE	On-Demand	Anodyne	DRD4	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C)n3)CC2)cc1	ZINC000450785175	EE	On-Demand	Anodyne	LTA4H	20	43
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C)n3)CC2)cc1	ZINC000450785175	EE	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C)n3)CC2)cc1	ZINC000450785175	EE	On-Demand	Anodyne	SSTR5	64	45
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C)n3)CC2)cc1	ZINC000450785175	EE	On-Demand	Anodyne	MCHR1	43	46
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C)n3)CC2)cc1	ZINC000450785175	EE	On-Demand	Anodyne	AXL	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(C)n3)CC2)cc1	ZINC000450785175	EE	On-Demand	Anodyne	MERTK	18	41
COC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785177	CE	On-Demand	Anodyne	DRD4	37	46
COC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785177	CE	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785177	CE	On-Demand	Anodyne	OPRK1	33	42
COC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785177	CE	On-Demand	Anodyne	HTR4	49	35
COC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785177	CE	On-Demand	Anodyne	SIGMAR1	31	42
COC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785177	CE	On-Demand	Anodyne	CCR3	46	40
COC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785177	CE	On-Demand	Anodyne	CXCR3	28	42
COC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)cc1Cl	ZINC000450785177	CE	On-Demand	Anodyne	MCHR1	35	45
COC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450785180	CE	On-Demand	Anodyne	DRD4	37	46
COC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450785180	CE	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450785180	CE	On-Demand	Anodyne	OPRK1	33	42
COC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450785180	CE	On-Demand	Anodyne	HTR4	49	35
COC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450785180	CE	On-Demand	Anodyne	SIGMAR1	31	42
COC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450785180	CE	On-Demand	Anodyne	CCR3	46	40
COC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450785180	CE	On-Demand	Anodyne	CXCR3	28	42
COC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1Cl	ZINC000450785180	CE	On-Demand	Anodyne	MCHR1	35	45
COC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1Cl	ZINC000450785184	CE	On-Demand	Anodyne	DRD4	37	46
COC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1Cl	ZINC000450785184	CE	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1Cl	ZINC000450785184	CE	On-Demand	Anodyne	OPRK1	33	42
COC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1Cl	ZINC000450785184	CE	On-Demand	Anodyne	HTR4	49	35
COC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1Cl	ZINC000450785184	CE	On-Demand	Anodyne	SIGMAR1	31	42
COC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1Cl	ZINC000450785184	CE	On-Demand	Anodyne	CCR3	46	40
COC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1Cl	ZINC000450785184	CE	On-Demand	Anodyne	CXCR3	28	42
COC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1Cl	ZINC000450785184	CE	On-Demand	Anodyne	MCHR1	35	45
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)o3)CC2)cc1	ZINC000450785186	FE	On-Demand	Anodyne	DRD4	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)o3)CC2)cc1	ZINC000450785186	FE	On-Demand	Anodyne	LTA4H	20	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)o3)CC2)cc1	ZINC000450785186	FE	On-Demand	Anodyne	SIGMAR1	22	40
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)o3)CC2)cc1	ZINC000450785186	FE	On-Demand	Anodyne	SSTR5	73	53
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)o3)CC2)cc1	ZINC000450785186	FE	On-Demand	Anodyne	CCR3	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C4CC4)o3)CC2)cc1	ZINC000450785186	FE	On-Demand	Anodyne	MCHR1	48	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(NC(=O)C2CC2)C1	ZINC000450785188	EE	On-Demand	Anodyne	CACNA1B	49	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(NC(=O)C2CC2)C1	ZINC000450785188	EE	On-Demand	Anodyne	CCR2	63	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(NC(=O)C2CC2)C1	ZINC000450785188	EE	On-Demand	Anodyne	EPHX2	21	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(NC(=O)C2CC2)C1	ZINC000450785188	EE	On-Demand	Anodyne	LIPG	44	34
C=CCC1(C(=O)Nc2sc(CC)nc2C)CCCC1	ZINC000450785198	CI	On-Demand	Mild	MME	0	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450785212	GE	On-Demand	Mild	ACHE	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450785212	GE	On-Demand	Mild	LTA4H	22	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450785212	GE	On-Demand	Mild	CSNK2A1	51	36
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450785212	GE	On-Demand	Mild	SIGMAR1	21	45
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450785212	GE	On-Demand	Mild	SSTR5	72	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C#N)c3[N+](=O)[O-])CC2)cc1	ZINC000450785212	GE	On-Demand	Mild	MCHR1	31	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@@H]3CC(C)=O)ccc21	ZINC000450785225	GF	On-Demand	Anodyne	HPGD	55	62
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@H]3CC(C)=O)ccc21	ZINC000450785226	GF	On-Demand	Anodyne	HPGD	55	62
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	TSHR	42	32
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	ACHE	32	43
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	DRD3	0	41
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	LTA4H	15	40
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	CSNK2A1	26	41
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	SIGMAR1	29	40
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	CCR3	44	38
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	MCHR1	32	41
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C#N)c4ccccc4[nH]3)CC2)cc1	ZINC000450785227	GH	On-Demand	Mild	MCHR2	46	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	DRD4	31	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	SIGMAR1	28	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	SSTR5	67	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	MLNR	37	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	MCHR1	56	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	AXL	48	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	TYRO3	58	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	MERTK	56	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	MGEA5	33	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cn3)CC2)cc1	ZINC000450785230	EF	On-Demand	Anodyne	NOD2	40	35
C=CCOc1ccc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1	ZINC000450785231	EH	On-Demand	Mild	PANC	45	32
C=CCOc1ccc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1	ZINC000450785232	EH	On-Demand	Mild	PANC	45	32
COC(=O)c1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785233	GE	On-Demand	Anodyne	DRD4	20	40
COC(=O)c1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785233	GE	On-Demand	Anodyne	LTA4H	26	42
COC(=O)c1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785233	GE	On-Demand	Anodyne	SIGMAR1	22	42
COC(=O)c1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785233	GE	On-Demand	Anodyne	SSTR5	85	47
COC(=O)c1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785233	GE	On-Demand	Anodyne	MCHR1	46	43
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450785234	FD	On-Demand	Anodyne	GHRHR	58	34
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450785234	FD	On-Demand	Anodyne	AMY2	44	30
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450785235	FD	On-Demand	Anodyne	GHRHR	58	34
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450785235	FD	On-Demand	Anodyne	AMY2	44	30
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	DRD3	0	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	SIGMAR1	31	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	SSTR5	67	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	MLNR	38	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	FAAH	23	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	CCR2	21	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	CXCR3	54	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	MCHR1	61	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	CACNA1G	18	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(Cl)cn3)CC2)cc1	ZINC000450785236	FH	On-Demand	Anodyne	AXL	23	42
COC(=O)C(C)(C)N1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450785241	FD	On-Demand	Anodyne	P2RY12	52	33
COC(=O)C(C)(C)N1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450785241	FD	On-Demand	Anodyne	TACR3	27	53
COC(=O)C(C)(C)N1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450785241	FD	On-Demand	Anodyne	CTSV	43	30
Cc1ccn(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)n1	ZINC000450785242	CD	On-Demand	Anodyne	PANC	40	30
Cc1ccn(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)n1	ZINC000450785243	CD	On-Demand	Anodyne	PANC	40	30
CC(C)[C@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785248	DD	On-Demand	Anodyne	PCSK5	42	34
CC(C)[C@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785248	DD	On-Demand	Anodyne	FURIN	44	34
CC(C)[C@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785248	DD	On-Demand	Anodyne	CAPN2	47	32
CC(C)[C@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785248	DD	On-Demand	Anodyne	AMP1_PLAFQ	47	39
CC(C)[C@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785248	DD	On-Demand	Anodyne	DAGLA	31	46
CC(C)[C@@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785249	DD	On-Demand	Anodyne	PCSK5	42	34
CC(C)[C@@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785249	DD	On-Demand	Anodyne	FURIN	44	34
CC(C)[C@@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785249	DD	On-Demand	Anodyne	CAPN2	47	32
CC(C)[C@@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785249	DD	On-Demand	Anodyne	AMP1_PLAFQ	47	39
CC(C)[C@@H](CCc1ccccc1)C(=O)NCc1nnnn1C	ZINC000450785249	DD	On-Demand	Anodyne	DAGLA	31	46
C[C@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H](C)N1CCO	ZINC000450785264	FE	On-Demand	Anodyne	HTR3A	41	36
C[C@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H](C)N1CCO	ZINC000450785264	FE	On-Demand	Anodyne	HTR4	35	41
C[C@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H](C)N1CCO	ZINC000450785264	FE	On-Demand	Anodyne	CNR2	27	43
C[C@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H](C)N1CCO	ZINC000450785264	FE	On-Demand	Anodyne	ACACB	28	49
C[C@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@@H](C)N1CCO	ZINC000450785264	FE	On-Demand	Anodyne	TNKS	49	31
COCc1cc([N+](=O)[O-])ccc1NC(COC)COC	ZINC000450785276	CD	On-Demand	Bother	CACNA1D	54	32
COc1cc(CC(=O)N[C@@H]2C[C@@H](O)C2(C)C)ccc1Cl	ZINC000450785293	CE	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N[C@@H]2C[C@@H](O)C2(C)C)ccc1Cl	ZINC000450785293	CE	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@@H]2C[C@@H](O)C2(C)C)ccc1Cl	ZINC000450785293	CE	On-Demand	Anodyne	CAN2	0	41
CCc1nc(C)c(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)s1	ZINC000450785294	GG	On-Demand	Anodyne	MAPK10	0	40
CCc1nc(C)c(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)s1	ZINC000450785294	GG	On-Demand	Anodyne	RORC	63	37
COc1cc(CC(=O)N[C@@H]2C[C@H](O)C2(C)C)ccc1Cl	ZINC000450785295	CE	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N[C@@H]2C[C@H](O)C2(C)C)ccc1Cl	ZINC000450785295	CE	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@@H]2C[C@H](O)C2(C)C)ccc1Cl	ZINC000450785295	CE	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@H]2C[C@@H](O)C2(C)C)ccc1Cl	ZINC000450785296	CE	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N[C@H]2C[C@@H](O)C2(C)C)ccc1Cl	ZINC000450785296	CE	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@H]2C[C@@H](O)C2(C)C)ccc1Cl	ZINC000450785296	CE	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@H]2C[C@H](O)C2(C)C)ccc1Cl	ZINC000450785297	CE	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N[C@H]2C[C@H](O)C2(C)C)ccc1Cl	ZINC000450785297	CE	On-Demand	Anodyne	NCE103	22	41
COc1cc(CC(=O)N[C@H]2C[C@H](O)C2(C)C)ccc1Cl	ZINC000450785297	CE	On-Demand	Anodyne	CAN2	0	41
CCOc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1Br	ZINC000450785302	FI	On-Demand	Anodyne	HTR2A	15	41
CCOc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1Br	ZINC000450785302	FI	On-Demand	Anodyne	PTGER1	38	44
CCOc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1Br	ZINC000450785302	FI	On-Demand	Anodyne	GRM4	41	38
CCOc1ccc(NC(=O)c2cc(C)n(C(C)C)n2)cc1Br	ZINC000450785302	FI	On-Demand	Anodyne	ENPP1	42	33
COCC(=O)N1CCc2cc(NC(=O)C(C)(C)C(C)(F)F)ccc21	ZINC000450785311	EF	On-Demand	Anodyne	NAMPT	0	41
COc1ccc(F)cc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450785314	GF	On-Demand	Anodyne	DRD2	16	41
COc1ccc(F)cc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450785314	GF	On-Demand	Anodyne	DRD3	21	41
COc1ccc(F)cc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450785314	GF	On-Demand	Anodyne	PPARA	15	42
COc1ccc(F)cc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450785314	GF	On-Demand	Anodyne	P2RX7	31	41
COc1ccc(F)cc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450785314	GF	On-Demand	Anodyne	PPARD	20	42
COc1ccc(F)cc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450785314	GF	On-Demand	Anodyne	MT-ND1	16	41
COc1ccc(F)cc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450785314	GF	On-Demand	Anodyne	ACKR3	40	33
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CC2(CCCC2)C1	ZINC000450785315	FI	On-Demand	Anodyne	HRH4	23	49
CC(C)C1(C)CCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)CC1	ZINC000450785318	EH	On-Demand	Anodyne	PDE4D	15	41
CC(C)C1(C)CCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)CC1	ZINC000450785319	EH	On-Demand	Anodyne	PDE4D	15	41
O=C(CC[C@@H]1CCC(=O)N1)NCc1ccc(Cl)cc1F	ZINC000450785321	CE	On-Demand	Anodyne	P2RX7	48	41
O=C(CC[C@H]1CCC(=O)N1)NCc1ccc(Cl)cc1F	ZINC000450785323	CE	On-Demand	Anodyne	P2RX7	48	41
COCC(COC)Nc1c(C)cnc2c(OC)cccc12	ZINC000450785339	CF	On-Demand	Anodyne	ATP4A	24	45
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)ccc21	ZINC000450785361	EG	On-Demand	Anodyne	NAMPT	30	44
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)ccc21	ZINC000450785362	EG	On-Demand	Anodyne	NAMPT	30	44
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)ccc21	ZINC000450785363	EG	On-Demand	Anodyne	NAMPT	30	44
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)ccc21	ZINC000450785364	EG	On-Demand	Anodyne	NAMPT	30	44
COCC(COC)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450785379	DD	On-Demand	Bother	BCL2L1	42	31
CC(=O)NC[C@H](CC(=O)Nc1nccc2sccc12)CC(C)C	ZINC000450785382	EG	On-Demand	Anodyne	HPN	46	32
COCC(=O)N1CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450785384	FG	On-Demand	Anodyne	DRD4	41	32
COCC(=O)N1CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450785384	FG	On-Demand	Anodyne	AVPR2	21	44
COCC(=O)N1CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450785384	FG	On-Demand	Anodyne	EIF2AK3	54	38
COCC(=O)N1CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450785384	FG	On-Demand	Anodyne	NOD1	27	40
COCC(=O)N1CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450785384	FG	On-Demand	Anodyne	NOD2	41	40
COCC(=O)N1CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450785384	FG	On-Demand	Anodyne	KCNK3	63	37
COCC(=O)N1CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450785384	FG	On-Demand	Anodyne	KCNK9	44	34
Cc1cc(N2CC(C)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450785401	CE	On-Demand	Bother	GYRB	0	46
Cc1cc(N2CC(C)(CO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450785401	CE	On-Demand	Bother	F2RL3	45	36
COc1cccc(OCCC(=O)N[C@H]2CCCN(C)[C@H]2C)c1	ZINC000450785412	DE	On-Demand	Anodyne	DRD4	45	34
COc1cccc(OCCC(=O)N[C@H]2CCCN(C)[C@H]2C)c1	ZINC000450785412	DE	On-Demand	Anodyne	MTNR1A	34	44
COc1cccc(OCCC(=O)N[C@H]2CCCN(C)[C@H]2C)c1	ZINC000450785412	DE	On-Demand	Anodyne	MTNR1B	39	40
COc1cccc(OCCC(=O)N[C@H]2CCCN(C)[C@H]2C)c1	ZINC000450785412	DE	On-Demand	Anodyne	CHRNA10	62	50
COc1cccc(OCCC(=O)N[C@H]2CCCN(C)[C@@H]2C)c1	ZINC000450785413	DE	On-Demand	Anodyne	DRD4	45	34
COc1cccc(OCCC(=O)N[C@H]2CCCN(C)[C@@H]2C)c1	ZINC000450785413	DE	On-Demand	Anodyne	MTNR1A	34	44
COc1cccc(OCCC(=O)N[C@H]2CCCN(C)[C@@H]2C)c1	ZINC000450785413	DE	On-Demand	Anodyne	MTNR1B	39	40
COc1cccc(OCCC(=O)N[C@H]2CCCN(C)[C@@H]2C)c1	ZINC000450785413	DE	On-Demand	Anodyne	CHRNA10	62	50
COc1cccc(OCCC(=O)N[C@@H]2CCCN(C)[C@@H]2C)c1	ZINC000450785414	DE	On-Demand	Anodyne	DRD4	45	34
COc1cccc(OCCC(=O)N[C@@H]2CCCN(C)[C@@H]2C)c1	ZINC000450785414	DE	On-Demand	Anodyne	MTNR1A	34	44
COc1cccc(OCCC(=O)N[C@@H]2CCCN(C)[C@@H]2C)c1	ZINC000450785414	DE	On-Demand	Anodyne	MTNR1B	39	40
COc1cccc(OCCC(=O)N[C@@H]2CCCN(C)[C@@H]2C)c1	ZINC000450785414	DE	On-Demand	Anodyne	CHRNA10	62	50
COc1cccc(OCCC(=O)N[C@@H]2CCCN(C)[C@H]2C)c1	ZINC000450785415	DE	On-Demand	Anodyne	DRD4	45	34
COc1cccc(OCCC(=O)N[C@@H]2CCCN(C)[C@H]2C)c1	ZINC000450785415	DE	On-Demand	Anodyne	MTNR1A	34	44
COc1cccc(OCCC(=O)N[C@@H]2CCCN(C)[C@H]2C)c1	ZINC000450785415	DE	On-Demand	Anodyne	MTNR1B	39	40
COc1cccc(OCCC(=O)N[C@@H]2CCCN(C)[C@H]2C)c1	ZINC000450785415	DE	On-Demand	Anodyne	CHRNA10	62	50
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CCO[C@@H](c2cccnc2)C1	ZINC000450785416	GH	On-Demand	Bother	CACNA1D	54	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CCO[C@H](c2cccnc2)C1	ZINC000450785417	GH	On-Demand	Bother	CACNA1D	54	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CCO[C@H](c2cccnc2)C1	ZINC000450785418	GH	On-Demand	Bother	CACNA1D	54	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CCO[C@@H](c2cccnc2)C1	ZINC000450785419	GH	On-Demand	Bother	CACNA1D	54	33
CC1(CO)CN(c2cnc3ccccc3n2)C1	ZINC000450785430	BD	On-Demand	Anodyne	SORD	27	49
CCOC(=O)c1ccc(N2CC(NC(=O)c3c[nH]c4nccc-4c3)C2)nc1	ZINC000450785431	FD	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1ccc(N2CC(NC(=O)c3c[nH]c4nccc-4c3)C2)nc1	ZINC000450785431	FD	On-Demand	Anodyne	SSTR5	40	37
C[C@@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC[C@H]1O	ZINC000450785461	FF	On-Demand	Anodyne	HRH4	29	49
C[C@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC[C@H]1O	ZINC000450785463	FF	On-Demand	Anodyne	HRH4	29	49
C[C@@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC[C@@H]1O	ZINC000450785464	FF	On-Demand	Anodyne	HRH4	29	49
C[C@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC[C@@H]1O	ZINC000450785465	FF	On-Demand	Anodyne	HRH4	29	49
COc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785510	FF	On-Demand	Anodyne	COLA	83	39
COc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785510	FF	On-Demand	Anodyne	CPT1A	70	39
COc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785510	FF	On-Demand	Anodyne	CPT2	49	39
COc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785510	FF	On-Demand	Anodyne	ITK	40	34
COc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785510	FF	On-Demand	Anodyne	CPT1B	66	37
COc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785510	FF	On-Demand	Anodyne	PANC	50	33
COc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785511	FF	On-Demand	Anodyne	COLA	83	39
COc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785511	FF	On-Demand	Anodyne	CPT1A	70	39
COc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785511	FF	On-Demand	Anodyne	CPT2	49	39
COc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785511	FF	On-Demand	Anodyne	ITK	40	34
COc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785511	FF	On-Demand	Anodyne	CPT1B	66	37
COc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1S(C)(=O)=O	ZINC000450785511	FF	On-Demand	Anodyne	PANC	50	33
Cc1nc(C)n(CCCC(=O)NCC2(c3ccc(F)cc3Cl)CCCC2)n1	ZINC000450785512	GI	On-Demand	Anodyne	P2RX7	43	38
C[C@H](C1CC1)n1cc(NC(=O)CCCC(=O)C2CC2)cn1	ZINC000450785525	CF	On-Demand	Anodyne	PANC	45	31
C[C@@H](C1CC1)n1cc(NC(=O)CCCC(=O)C2CC2)cn1	ZINC000450785526	CF	On-Demand	Anodyne	PANC	45	31
CO[C@@H]1CCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450785527	GD	On-Demand	Bother	BDKRB1	0	44
CO[C@@H]1CCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450785527	GD	On-Demand	Bother	BCL2L1	54	32
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450785535	GF	On-Demand	Bother	SIGMAR1	16	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450785535	GF	On-Demand	Bother	SSTR5	75	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450785535	GF	On-Demand	Bother	MCHR1	36	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450785535	GF	On-Demand	Bother	AXL	30	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450785535	GF	On-Demand	Bother	TYRO3	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(C)n3)CC2)cc1	ZINC000450785535	GF	On-Demand	Bother	MERTK	32	40
CC[C@@H]1C[C@H]1C(=O)N[C@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450785536	EG	On-Demand	Anodyne	NS3	54	32
CC[C@@H]1C[C@H]1C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450785537	EG	On-Demand	Anodyne	NS3	54	32
COC(=O)c1csc(CSc2ccc(C(=O)N3CCCC3)cn2)n1	ZINC000450785540	FF	On-Demand	Anodyne	TRPC6	44	33
CCS(=O)(=O)c1ccc(CSCc2cccc(C(=O)OC)c2)cc1	ZINC000450785551	FH	On-Demand	Anodyne	TRY2_BOVIN	44	32
CCS(=O)(=O)c1ccc(CSCc2cccc(C(=O)OC)c2)cc1	ZINC000450785551	FH	On-Demand	Anodyne	PTPRB	20	45
CCS(=O)(=O)c1ccc(CSCc2cccc(C(=O)OC)c2)cc1	ZINC000450785551	FH	On-Demand	Anodyne	RORC	62	39
COc1cc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)ccc1Cl	ZINC000450785575	EH	On-Demand	Anodyne	PDGFRB	28	47
COc1cc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)ccc1Cl	ZINC000450785575	EH	On-Demand	Anodyne	ITK	41	31
COc1cc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)ccc1Cl	ZINC000450785575	EH	On-Demand	Anodyne	FLT4	25	47
COc1cc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)ccc1Cl	ZINC000450785575	EH	On-Demand	Anodyne	PANC	50	34
COc1cc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)ccc1Cl	ZINC000450785576	EH	On-Demand	Anodyne	PDGFRB	28	47
COc1cc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)ccc1Cl	ZINC000450785576	EH	On-Demand	Anodyne	ITK	41	31
COc1cc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)ccc1Cl	ZINC000450785576	EH	On-Demand	Anodyne	FLT4	25	47
COc1cc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)ccc1Cl	ZINC000450785576	EH	On-Demand	Anodyne	PANC	50	34
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCN1C[C@@H]2CC[C@H](C1)O2	ZINC000450785592	FC	On-Demand	Anodyne	CA2	40	47
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCN1C[C@@H]2CC[C@H](C1)O2	ZINC000450785592	FC	On-Demand	Anodyne	CA7	42	38
COCC(COC)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450785593	EG	On-Demand	Anodyne	F10	29	40
COCC(COC)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450785593	EG	On-Demand	Anodyne	CPT1A	54	31
COCC(COC)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450785593	EG	On-Demand	Anodyne	CSF1R	27	44
COCC(COC)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450785593	EG	On-Demand	Anodyne	GCK	34	44
COCC(COC)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450785593	EG	On-Demand	Anodyne	LUCI_LUCLA	38	42
COCC(COC)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450785593	EG	On-Demand	Anodyne	TAAR1	33	50
COCC(COC)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450785593	EG	On-Demand	Anodyne	KCNK3	84	43
COCC(COC)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450785593	EG	On-Demand	Anodyne	KCNK9	80	43
Cc1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc(-c2cccnc2)n1	ZINC000450785597	ED	On-Demand	Anodyne	ROS1	56	45
COCC(COC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450785605	GE	On-Demand	Bother	BDKRB1	0	46
COCC(COC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450785605	GE	On-Demand	Bother	COLA	51	32
COCC(COC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450785605	GE	On-Demand	Bother	BCL2L1	123	40
COCC(COC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450785605	GE	On-Demand	Bother	BCL2	105	38
COCC(COC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450785605	GE	On-Demand	Bother	BCL2L2	51	35
COCC(COC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450785605	GE	On-Demand	Bother	LIMK2	44	38
CCOC(=O)c1c[nH]c2ccc(OC)cc2c1=NC(COC)COC	ZINC000450785606	ED	On-Demand	Anodyne	MTNR1A	18	41
C[C@H]1CN(c2ncnc3cccc(F)c23)C[C@@H](C)N1CCO	ZINC000450785607	DD	On-Demand	Anodyne	LIMK2	51	35
COCC(=O)N1CCc2cc(NC(=O)Cc3cc(C)ccc3F)ccc21	ZINC000450785632	FF	On-Demand	Anodyne	EIF2AK3	42	40
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	DRD4	40	45
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	ACHE	24	41
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	HRH1	0	40
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	DRD3	24	45
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	HTR4	55	40
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	SSTR5	59	38
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	CCR3	54	42
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	MCHR1	42	43
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	CACNA1G	45	46
COc1cc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785656	FF	On-Demand	Anodyne	CACNA1I	59	39
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	DRD4	40	45
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	ACHE	24	41
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	HRH1	0	40
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	DRD3	24	45
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	HTR4	55	40
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	SSTR5	59	38
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	CCR3	54	42
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	MCHR1	42	43
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	CACNA1G	45	46
COc1cc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450785657	FF	On-Demand	Anodyne	CACNA1I	59	39
C[C@H]1C[C@]1(C#N)C(=O)N[C@H](C)c1cc(Cl)ccc1Cl	ZINC000450785669	CH	On-Demand	Mild	SDH1	0	45
C=C(C)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450785671	CE	On-Demand	Mild	PDE8B	52	33
C=C(C)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450785672	CE	On-Demand	Mild	PDE8B	52	33
CCOC(=O)c1cc(C(=O)NCc2cc(F)ccc2OC)[nH]c1C	ZINC000450785676	EF	On-Demand	Anodyne	PPARD	20	43
C[C@@H](NC(=O)[C@]1(C#N)C[C@H]1C)c1cc(Cl)ccc1Cl	ZINC000450785678	CH	On-Demand	Mild	SDH1	0	45
C[C@H]1C[C@@]1(C#N)C(=O)N[C@H](C)c1cc(Cl)ccc1Cl	ZINC000450785680	CH	On-Demand	Mild	SDH1	0	45
C[C@@H](NC(=O)[C@@]1(C#N)C[C@H]1C)c1cc(Cl)ccc1Cl	ZINC000450785682	CH	On-Demand	Mild	SDH1	0	45
CCc1cccc(C(=O)NCc2nnnn2C)n1	ZINC000450785689	BC	On-Demand	Anodyne	DAGLA	15	40
CN(CCN1CCC[C@H]1c1nc(C(=O)NC2CC2)no1)Cc1ccccc1	ZINC000450785690	FE	On-Demand	Anodyne	CPT1A	42	40
CN(CCN1CCC[C@@H]1c1nc(C(=O)NC2CC2)no1)Cc1ccccc1	ZINC000450785691	FE	On-Demand	Anodyne	CPT1A	42	40
CC(C)CC(CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450785692	FG	On-Demand	Anodyne	CA2	25	48
CC(C)CC(CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450785692	FG	On-Demand	Anodyne	MME	0	60
CC(C)CC(CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450785692	FG	On-Demand	Anodyne	CA1	33	44
CC(C)CC(CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450785692	FG	On-Demand	Anodyne	CA7	19	64
CC(C)CC(CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450785692	FG	On-Demand	Anodyne	CA4	26	43
CC(C)CC(CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450785692	FG	On-Demand	Anodyne	CA14	15	52
CC(C)CC(CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450785692	FG	On-Demand	Anodyne	CA12	17	43
CC(C)CC(CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450785692	FG	On-Demand	Anodyne	P96878_MYCTU	46	40
COc1cc(CC(=O)N2CC3(CCCC3)C2)ccc1Cl	ZINC000450785707	CG	On-Demand	Anodyne	CCR1	31	40
COc1cc(CC(=O)N2CC3(CCCC3)C2)ccc1Cl	ZINC000450785707	CG	On-Demand	Anodyne	GHSR	16	41
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3C[C@H]3CC(C)C)ccc21	ZINC000450785721	EF	On-Demand	Anodyne	NAMPT	28	44
CCCOc1ccc(C(=O)N2CC3(CCCC3)C2)c(OC)c1	ZINC000450785727	DH	On-Demand	Anodyne	OXTR	0	40
CN1CC[C@@H]2CN(c3ccc(C(F)(F)F)cc3C#N)C[C@@H]21	ZINC000450785734	CF	On-Demand	Mild	LIPG	44	34
CC1(C)[C@H](O)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450785740	EG	On-Demand	Anodyne	RBP4	63	38
CC1(C)[C@@H](O)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450785741	EG	On-Demand	Anodyne	RBP4	63	38
CC1(C)[C@@H](O)C[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450785743	EG	On-Demand	Anodyne	RBP4	63	38
COc1ccc(F)cc1CNC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450785755	EG	On-Demand	Anodyne	GRIN2B	25	45
COc1ccc(F)cc1CNC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450785755	EG	On-Demand	Anodyne	P2RX7	54	48
COc1ccc(F)cc1CNC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000450785755	EG	On-Demand	Anodyne	ACKR3	64	34
COc1ccc(F)cc1CNC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450785756	EG	On-Demand	Anodyne	GRIN2B	25	45
COc1ccc(F)cc1CNC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450785756	EG	On-Demand	Anodyne	P2RX7	54	48
COc1ccc(F)cc1CNC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000450785756	EG	On-Demand	Anodyne	ACKR3	64	34
COc1ccc(F)cc1CNC(=O)CCCn1nc(C)nc1C	ZINC000450785758	DE	On-Demand	Anodyne	HTR7	23	42
COc1ccc(F)cc1CNC(=O)CCCn1nc(C)nc1C	ZINC000450785758	DE	On-Demand	Anodyne	P2RX7	54	43
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)nc1	ZINC000450785767	FD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)nc1	ZINC000450785768	FD	On-Demand	Anodyne	SSTR5	42	35
C[C@H](O)CN1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450785772	CD	On-Demand	Anodyne	O19067_PIG	0	41
Cn1nc(C(=O)NCc2ccc(Cl)cc2F)c2c1CCCC2	ZINC000450785776	DG	On-Demand	Anodyne	P2RX7	73	41
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCCC[C@H]2O)cc1	ZINC000450785777	DE	On-Demand	Anodyne	RORC	17	43
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C)C(=O)[C@@H]3C)ccc21	ZINC000450785787	GE	On-Demand	Anodyne	HTR1A	30	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C)C(=O)[C@@H]3C)ccc21	ZINC000450785787	GE	On-Demand	Anodyne	HPGD	55	65
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C)C(=O)[C@H]3C)ccc21	ZINC000450785788	GE	On-Demand	Anodyne	HTR1A	30	41
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C)C(=O)[C@H]3C)ccc21	ZINC000450785788	GE	On-Demand	Anodyne	HPGD	55	65
CCOC(=O)c1ccc(N2CC(NC(=O)CS(=O)(=O)C3CC3)C2)nc1	ZINC000450785817	FC	On-Demand	Anodyne	P2RY12	27	44
CC1(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CCC(=O)CC1	ZINC000450785828	FG	On-Demand	Anodyne	KCNQ1	0	41
CC1(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CCC(=O)CC1	ZINC000450785828	FG	On-Demand	Anodyne	SPHK1	39	41
c1ccc2oc(N3C[C@H](C4CC4)[C@@H]3C3CC3)nc2c1	ZINC000450785838	CG	On-Demand	Anodyne	HTR3A	15	55
c1ccc2oc(N3C[C@H](C4CC4)[C@H]3C3CC3)nc2c1	ZINC000450785839	CG	On-Demand	Anodyne	HTR3A	15	55
c1ccc2oc(N3C[C@@H](C4CC4)[C@H]3C3CC3)nc2c1	ZINC000450785840	CG	On-Demand	Anodyne	HTR3A	15	55
c1ccc2oc(N3C[C@@H](C4CC4)[C@@H]3C3CC3)nc2c1	ZINC000450785841	CG	On-Demand	Anodyne	HTR3A	15	55
COc1cccc(OCCC(=O)Nc2nc3c(s2)CN(C(C)C)CC3)c1	ZINC000450785852	GG	On-Demand	Anodyne	CSNK1D	21	41
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](O)[C@H](C)C2)cc1	ZINC000450785866	DG	On-Demand	Anodyne	SLC18A3	24	44
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](O)[C@H](C)C2)cc1	ZINC000450785867	DG	On-Demand	Anodyne	SLC18A3	24	44
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450785868	DG	On-Demand	Anodyne	SLC18A3	24	44
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450785869	DG	On-Demand	Anodyne	SLC18A3	24	44
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(F)F)s3)CC2)cc1	ZINC000450785889	GF	On-Demand	Anodyne	LTA4H	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(F)F)s3)CC2)cc1	ZINC000450785889	GF	On-Demand	Anodyne	SSTR5	70	43
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(F)F)s3)CC2)cc1	ZINC000450785889	GF	On-Demand	Anodyne	MCHR1	33	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)csc34)CC2)cc1	ZINC000450785896	GI	On-Demand	Anodyne	LTA4H	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)csc34)CC2)cc1	ZINC000450785896	GI	On-Demand	Anodyne	SIGMAR1	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)csc34)CC2)cc1	ZINC000450785896	GI	On-Demand	Anodyne	SSTR5	70	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)csc34)CC2)cc1	ZINC000450785896	GI	On-Demand	Anodyne	LPAR2	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)csc34)CC2)cc1	ZINC000450785896	GI	On-Demand	Anodyne	MCHR1	30	40
CC(=O)Nc1ccc(CN2CCC(Nc3c([N+](=O)[O-])ncn3C)CC2)cc1	ZINC000450785909	FE	On-Demand	Bother	SIGMAR1	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3c([N+](=O)[O-])ncn3C)CC2)cc1	ZINC000450785909	FE	On-Demand	Bother	SSTR5	60	42
CC(=O)Nc1ccc(CN2CCC(Nc3c([N+](=O)[O-])ncn3C)CC2)cc1	ZINC000450785909	FE	On-Demand	Bother	MCHR1	33	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)c(C)c3C#N)CC2)cc1	ZINC000450785910	GH	On-Demand	Mild	CSNK2A1	60	37
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)c(C)c3C#N)CC2)cc1	ZINC000450785910	GH	On-Demand	Mild	SIGMAR1	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)c(C)c3C#N)CC2)cc1	ZINC000450785910	GH	On-Demand	Mild	SSTR5	66	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)c(C)c3C#N)CC2)cc1	ZINC000450785910	GH	On-Demand	Mild	CXCR3	26	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)c(C)c3C#N)CC2)cc1	ZINC000450785910	GH	On-Demand	Mild	MCHR1	36	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)nc3)CC2)cc1	ZINC000450785913	EF	On-Demand	Mild	LTA4H	30	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)nc3)CC2)cc1	ZINC000450785913	EF	On-Demand	Mild	CSNK2A1	55	36
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)nc3)CC2)cc1	ZINC000450785913	EF	On-Demand	Mild	SIGMAR1	30	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)nc3)CC2)cc1	ZINC000450785913	EF	On-Demand	Mild	SSTR5	63	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)nc3)CC2)cc1	ZINC000450785913	EF	On-Demand	Mild	CCR3	36	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)nc3)CC2)cc1	ZINC000450785913	EF	On-Demand	Mild	MLNR	49	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)nc3)CC2)cc1	ZINC000450785913	EF	On-Demand	Mild	MCHR1	45	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)cccc34)CC2)cc1	ZINC000450785924	GH	On-Demand	Anodyne	DRD4	24	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)cccc34)CC2)cc1	ZINC000450785924	GH	On-Demand	Anodyne	LTA4H	20	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)cccc34)CC2)cc1	ZINC000450785924	GH	On-Demand	Anodyne	SIGMAR1	20	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)cccc34)CC2)cc1	ZINC000450785924	GH	On-Demand	Anodyne	SSTR5	73	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(C)cccc34)CC2)cc1	ZINC000450785924	GH	On-Demand	Anodyne	MCHR1	49	44
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)C)ncn3)CC2)cc1	ZINC000450785935	FH	On-Demand	Anodyne	SIGMAR1	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)C)ncn3)CC2)cc1	ZINC000450785935	FH	On-Demand	Anodyne	SSTR5	67	47
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)C)ncn3)CC2)cc1	ZINC000450785935	FH	On-Demand	Anodyne	MCHR1	45	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)(F)F)s3)CC2)cc1	ZINC000450785936	GI	On-Demand	Anodyne	LTA4H	32	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)(F)F)s3)CC2)cc1	ZINC000450785936	GI	On-Demand	Anodyne	SIGMAR1	23	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)(F)F)s3)CC2)cc1	ZINC000450785936	GI	On-Demand	Anodyne	SSTR5	81	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)(F)F)s3)CC2)cc1	ZINC000450785936	GI	On-Demand	Anodyne	MLNR	42	39
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)(F)F)s3)CC2)cc1	ZINC000450785936	GI	On-Demand	Anodyne	CCR2	17	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)(F)F)s3)CC2)cc1	ZINC000450785936	GI	On-Demand	Anodyne	MCHR1	48	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)(F)F)s3)CC2)cc1	ZINC000450785936	GI	On-Demand	Anodyne	MGEA5	35	42
COC1(CSc2nc3cc(F)c(F)cc3[nH]2)CCC1	ZINC000450785955	CH	On-Demand	Anodyne	CYP1A2	16	42
COC1(CSc2nc3cc(F)c(F)cc3[nH]2)CCC1	ZINC000450785955	CH	On-Demand	Anodyne	CYP2C19	17	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	DRD4	37	40
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	DRD3	0	46
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	CHRM3	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	LTA4H	22	48
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	CSNK2A1	66	39
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	SIGMAR1	35	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	SSTR5	59	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	CCR3	53	37
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	MLNR	54	45
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	CCR2	20	48
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	MCHR1	55	44
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	NOD2	42	36
CC(=O)Nc1ccc(CN2CCC(Nc3c(C#N)cccc3C#N)CC2)cc1	ZINC000450785956	FG	On-Demand	Mild	PFKFB3	49	35
C[C@H](C1CC1)n1cc(NC(=O)c2cc(Cl)c3ccccc3n2)cn1	ZINC000450785975	EI	On-Demand	Anodyne	ITK	55	36
C[C@@H](C1CC1)n1cc(NC(=O)c2cc(Cl)c3ccccc3n2)cn1	ZINC000450785978	EI	On-Demand	Anodyne	ITK	55	36
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3C#N)CC2)cc1	ZINC000450785979	FG	On-Demand	Mild	DRD4	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3C#N)CC2)cc1	ZINC000450785979	FG	On-Demand	Mild	LTA4H	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3C#N)CC2)cc1	ZINC000450785979	FG	On-Demand	Mild	CSNK2A1	82	38
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3C#N)CC2)cc1	ZINC000450785979	FG	On-Demand	Mild	SSTR5	54	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3C#N)CC2)cc1	ZINC000450785979	FG	On-Demand	Mild	MLNR	40	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3C#N)CC2)cc1	ZINC000450785979	FG	On-Demand	Mild	MCHR1	36	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3C#N)CC2)cc1	ZINC000450785979	FG	On-Demand	Mild	HIPK2	50	38
C=CCOc1ccc(CC(=O)N2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450785989	FD	On-Demand	Mild	GPR183	0	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(C)C)o3)CC2)cc1	ZINC000450785990	FF	On-Demand	Anodyne	LTA4H	16	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(C)C)o3)CC2)cc1	ZINC000450785990	FF	On-Demand	Anodyne	SSTR5	72	52
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(C)C)o3)CC2)cc1	ZINC000450785990	FF	On-Demand	Anodyne	MLNR	31	40
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(C)C)o3)CC2)cc1	ZINC000450785990	FF	On-Demand	Anodyne	MCHR1	46	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C)n3)CC2)cc1	ZINC000450785993	EF	On-Demand	Anodyne	TSHR	41	32
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C)n3)CC2)cc1	ZINC000450785993	EF	On-Demand	Anodyne	LTA4H	28	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C)n3)CC2)cc1	ZINC000450785993	EF	On-Demand	Anodyne	SIGMAR1	28	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C)n3)CC2)cc1	ZINC000450785993	EF	On-Demand	Anodyne	SSTR5	68	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C)n3)CC2)cc1	ZINC000450785993	EF	On-Demand	Anodyne	PRKD1	48	30
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C)n3)CC2)cc1	ZINC000450785993	EF	On-Demand	Anodyne	MLNR	36	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C)n3)CC2)cc1	ZINC000450785993	EF	On-Demand	Anodyne	MCHR1	47	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C)n3)CC2)cc1	ZINC000450785993	EF	On-Demand	Anodyne	NOD2	40	36
CCc1csc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785994	FH	On-Demand	Anodyne	DRD4	16	41
CCc1csc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785994	FH	On-Demand	Anodyne	LTA4H	19	42
CCc1csc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785994	FH	On-Demand	Anodyne	SIGMAR1	23	40
CCc1csc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785994	FH	On-Demand	Anodyne	SSTR5	69	47
CCc1csc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785994	FH	On-Demand	Anodyne	CXCR3	22	40
CCc1csc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450785994	FH	On-Demand	Anodyne	MCHR1	40	43
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NC(COC)COC	ZINC000450786003	ED	On-Demand	Bother	CACNA1C	51	38
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NC(COC)COC	ZINC000450786003	ED	On-Demand	Bother	CACNA1D	82	38
COCC(COC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450786022	FC	On-Demand	Anodyne	TGM2	20	41
COCC(COC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450786022	FC	On-Demand	Anodyne	GCKR	54	32
O=[N+]([O-])c1ccc(-c2csc(NCCN3C[C@@H]4CC[C@H](C3)O4)n2)cc1	ZINC000450786023	FE	On-Demand	Bother	MAOB	21	50
CCCNC(=O)c1ccc(N2CC(C)(CO)C2)nc1	ZINC000450786057	CD	On-Demand	Anodyne	HDAC1	26	41
COc1cccc(-n2cc(C(=O)N3CCN(C)C(=O)[C@H]3C)nn2)c1	ZINC000450786095	EC	On-Demand	Anodyne	DRD4	40	31
COc1cccc(-n2cc(C(=O)N3CCN(C)C(=O)[C@@H]3C)nn2)c1	ZINC000450786101	EC	On-Demand	Anodyne	DRD4	40	31
CC(C)C[C@@H](C)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450786127	CG	On-Demand	Anodyne	CHRNA2	41	42
CC(C)C[C@@H](C)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450786127	CG	On-Demand	Anodyne	CRTY	0	42
C[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1O	ZINC000450786128	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1O	ZINC000450786128	CE	On-Demand	Anodyne	SIGMAR1	44	44
CC(C)C[C@H](C)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450786133	CG	On-Demand	Anodyne	CHRNA2	41	42
CC(C)C[C@H](C)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450786133	CG	On-Demand	Anodyne	CRTY	0	42
C[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1O	ZINC000450786134	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1O	ZINC000450786134	CE	On-Demand	Anodyne	SIGMAR1	44	44
C[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1O	ZINC000450786139	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1O	ZINC000450786139	CE	On-Demand	Anodyne	SIGMAR1	44	44
C[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1O	ZINC000450786143	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1O	ZINC000450786143	CE	On-Demand	Anodyne	SIGMAR1	44	44
CCOC(=O)c1ccc(N2CC(NC(=O)C3(C)CCC(=O)CC3)C2)nc1	ZINC000450786165	FD	On-Demand	Anodyne	P2RY12	20	40
CN(CC1(O)CCCCCC1)C(=O)c1cc(Cl)c2ccccc2n1	ZINC000450786170	EI	On-Demand	Anodyne	TSPO	33	45
O=C(NCc1ccc(Cl)cc1F)c1cc2n(n1)CCCC2	ZINC000450786171	DF	On-Demand	Anodyne	CNR1	52	32
O=C(NCc1ccc(Cl)cc1F)c1cc2n(n1)CCCC2	ZINC000450786171	DF	On-Demand	Anodyne	P2RX7	62	37
CN1CC[C@@H]2CN(c3ccc(S(=O)(=O)N4CCOCC4)cc3[N+](=O)[O-])C[C@@H]21	ZINC000450786173	GC	On-Demand	Bother	DDIT3	0	40
O=C(Nc1ncc(C2CCCCC2)s1)[C@H](O)C1CCC1	ZINC000450786184	CG	On-Demand	Anodyne	CDK5	41	47
O=C(Nc1ncc(C2CCCCC2)s1)[C@@H](O)C1CCC1	ZINC000450786185	CG	On-Demand	Anodyne	CDK5	41	47
C[C@@H]1[C@H](NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CCCN1C	ZINC000450786195	DG	On-Demand	Anodyne	SLC6A1	22	40
C[C@@H]1[C@H](NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)CCCN1C	ZINC000450786195	DG	On-Demand	Anodyne	UTS2R	45	32
C[C@@H]1[C@H](NC(=O)[C@H]2CCC[C@H]2c2ccccc2)CCCN1C	ZINC000450786196	DG	On-Demand	Anodyne	SLC6A1	22	40
C[C@@H]1[C@H](NC(=O)[C@H]2CCC[C@H]2c2ccccc2)CCCN1C	ZINC000450786196	DG	On-Demand	Anodyne	UTS2R	45	32
C[C@@H]1[C@H](NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CCCN1C	ZINC000450786197	DG	On-Demand	Anodyne	SLC6A1	22	40
C[C@@H]1[C@H](NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)CCCN1C	ZINC000450786197	DG	On-Demand	Anodyne	UTS2R	45	32
C[C@@H]1[C@H](NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CCCN1C	ZINC000450786199	DG	On-Demand	Anodyne	SLC6A1	22	40
C[C@@H]1[C@H](NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CCCN1C	ZINC000450786199	DG	On-Demand	Anodyne	UTS2R	45	32
COc1cc(OC)c2ncc(C#N)c(N[C@@H]3CCO[C@H](c4ccncc4)C3)c2c1	ZINC000450786208	GH	On-Demand	Mild	SRC	41	37
COc1cc(OC)c2ncc(C#N)c(N[C@H]3CCO[C@H](c4ccncc4)C3)c2c1	ZINC000450786209	GH	On-Demand	Mild	SRC	41	37
COc1cc(OC)c2ncc(C#N)c(N[C@H]3CCO[C@@H](c4ccncc4)C3)c2c1	ZINC000450786210	GH	On-Demand	Mild	SRC	41	37
COc1cc(OC)c2ncc(C#N)c(N[C@@H]3CCO[C@@H](c4ccncc4)C3)c2c1	ZINC000450786212	GH	On-Demand	Mild	SRC	41	37
COc1cc(CN2CCC[C@H]2c2csc(C)n2)ccc1Cl	ZINC000450786226	DI	On-Demand	Anodyne	HCRTR1	17	42
COc1cc(CN2CCC[C@H]2c2csc(C)n2)ccc1Cl	ZINC000450786226	DI	On-Demand	Anodyne	SSTR5	44	36
CN1CC[C@@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)C[C@@H]21	ZINC000450786228	FH	On-Demand	Anodyne	ADRB3	0	42
COc1ccc(F)cc1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450786237	GF	On-Demand	Anodyne	PPARA	15	41
COc1ccc(F)cc1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450786237	GF	On-Demand	Anodyne	P2RX7	50	38
COc1ccc(F)cc1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450786237	GF	On-Demand	Anodyne	PPARD	19	41
COc1ccc(F)cc1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450786237	GF	On-Demand	Anodyne	CA9	22	43
COc1ccc(F)cc1CNC(=O)Cn1cc(C(C)=O)nn1	ZINC000450786255	DC	On-Demand	Anodyne	P2RX7	44	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786272	GH	On-Demand	Mild	ACHE	19	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786272	GH	On-Demand	Mild	CSNK2A1	60	37
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786272	GH	On-Demand	Mild	SIGMAR1	23	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786272	GH	On-Demand	Mild	SSTR5	47	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786272	GH	On-Demand	Mild	MCHR1	37	42
CCn1c(S[C@H](C)C(=O)C2CCCCC2)nc2ccsc2c1=O	ZINC000450786299	FI	On-Demand	Anodyne	PDE4B	0	53
CCn1c(S[C@H](C)C(=O)C2CCCCC2)nc2ccsc2c1=O	ZINC000450786299	FI	On-Demand	Anodyne	PDE7A	46	35
CCn1c(S[C@H](C)C(=O)C2CCCCC2)nc2ccsc2c1=O	ZINC000450786299	FI	On-Demand	Anodyne	KIF11	0	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786300	GF	On-Demand	Mild	CSNK2A1	80	38
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786300	GF	On-Demand	Mild	SIGMAR1	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786300	GF	On-Demand	Mild	SSTR5	70	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cc3C#N)CC2)cc1	ZINC000450786300	GF	On-Demand	Mild	MCHR1	40	44
CCn1c(S[C@@H](C)C(=O)C2CCCCC2)nc2ccsc2c1=O	ZINC000450786302	FI	On-Demand	Anodyne	PDE4B	0	53
CCn1c(S[C@@H](C)C(=O)C2CCCCC2)nc2ccsc2c1=O	ZINC000450786302	FI	On-Demand	Anodyne	PDE7A	46	35
CCn1c(S[C@@H](C)C(=O)C2CCCCC2)nc2ccsc2c1=O	ZINC000450786302	FI	On-Demand	Anodyne	KIF11	0	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(C)C)CC2)cc1	ZINC000450786309	GF	On-Demand	Anodyne	LTA4H	28	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(C)C)CC2)cc1	ZINC000450786309	GF	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(C)C)CC2)cc1	ZINC000450786309	GF	On-Demand	Anodyne	SSTR5	78	45
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(C)C)CC2)cc1	ZINC000450786309	GF	On-Demand	Anodyne	MCHR1	42	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(C)C)CC2)cc1	ZINC000450786309	GF	On-Demand	Anodyne	AXL	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3OC(C)C)CC2)cc1	ZINC000450786309	GF	On-Demand	Anodyne	MERTK	24	40
O=C(NC1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1)C1CC1	ZINC000450786326	EF	On-Demand	Anodyne	ERBB2	0	41
O=C(NC1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1)C1CC1	ZINC000450786326	EF	On-Demand	Anodyne	EPHX2	33	49
O=C(NC1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1)C1CC1	ZINC000450786326	EF	On-Demand	Anodyne	ADAM10	22	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]nc(C(C)(C)C)s3)CC2)cc1	ZINC000450786328	GG	On-Demand	Anodyne	ACHE	18	40
Cc1ccncc1CNc1cc(N2CCC[C@@H](C)C2)ncn1	ZINC000450786340	CG	On-Demand	Anodyne	PRCP	15	43
Cc1ccncc1CNc1cc(N2CCC[C@H](C)C2)ncn1	ZINC000450786342	CG	On-Demand	Anodyne	PRCP	15	43
CO[C@@H]1CCC[C@H]1Nc1nc(N(C)C)c2ccccc2n1	ZINC000450786343	CF	On-Demand	Anodyne	ADRA2A	0	54
CO[C@@H]1CCC[C@H]1Nc1nc(N(C)C)c2ccccc2n1	ZINC000450786343	CF	On-Demand	Anodyne	NPY2R	0	54
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	HTR1A	23	60
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	DRD2	39	53
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	DRD1	33	59
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	DRD4	22	48
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	HTR2A	31	56
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	HTR2C	25	60
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	DRD3	0	55
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	DRD5	22	48
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	ERG2	24	53
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	HTR7	30	53
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	MC4R	58	42
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	SIGMAR1	22	58
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	SLC18A3	22	54
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	ABCB1	23	53
C[C@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450786357	DD	On-Demand	Anodyne	CYP2J2	58	41
Cc1ccncc1CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450786358	ED	On-Demand	Anodyne	NAMPT	52	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(F)cccc34)CC2)cc1	ZINC000450786362	GH	On-Demand	Anodyne	DRD4	24	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(F)cccc34)CC2)cc1	ZINC000450786362	GH	On-Demand	Anodyne	LTA4H	20	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(F)cccc34)CC2)cc1	ZINC000450786362	GH	On-Demand	Anodyne	SIGMAR1	28	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(F)cccc34)CC2)cc1	ZINC000450786362	GH	On-Demand	Anodyne	SSTR5	78	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(F)cccc34)CC2)cc1	ZINC000450786362	GH	On-Demand	Anodyne	CCR3	48	36
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(F)cccc34)CC2)cc1	ZINC000450786362	GH	On-Demand	Anodyne	MLNR	57	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(F)cccc34)CC2)cc1	ZINC000450786362	GH	On-Demand	Anodyne	ERBB4	45	34
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c(F)cccc34)CC2)cc1	ZINC000450786362	GH	On-Demand	Anodyne	MCHR1	63	44
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	DRD4	26	41
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	ACHE	17	41
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	CHRM3	15	48
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	LTA4H	35	47
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	SIGMAR1	28	43
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	SSTR5	92	51
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	CCR3	38	40
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	UTS2R	19	40
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	MLNR	46	39
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	CCR2	16	43
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	CXCR3	34	40
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	MCHR1	64	46
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	AXL	30	42
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	TYRO3	29	42
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	MERTK	34	42
COC(=O)c1cnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450786369	GE	On-Demand	Anodyne	NOD2	43	37
COc1ccc(F)cc1CNC(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450786372	FG	On-Demand	Anodyne	P2RX7	84	50
COc1ccc(F)cc1CNC(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450786372	FG	On-Demand	Anodyne	PPARD	19	42
COc1ccc(F)cc1CNC(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450786372	FG	On-Demand	Anodyne	MT-ND1	15	40
COc1ccc(F)cc1CNC(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450786372	FG	On-Demand	Anodyne	KCNK3	24	42
CC[C@@H](Nc1ncc(C)s1)[C@@H](C)O	ZINC000450786374	BE	On-Demand	Anodyne	FDPS	15	50
C[C@H](C1CC1)n1cc(NC(=O)COc2ccc(C#N)c(Br)c2)cn1	ZINC000450786377	GH	On-Demand	Mild	PFKFB3	40	32
C[C@@H](C1CC1)n1cc(NC(=O)COc2ccc(C#N)c(Br)c2)cn1	ZINC000450786378	GH	On-Demand	Mild	PFKFB3	40	32
CC[C@@H](Nc1ncc(C)s1)[C@H](C)O	ZINC000450786379	BE	On-Demand	Anodyne	FDPS	15	50
CC[C@H](Nc1ncc(C)s1)[C@@H](C)O	ZINC000450786381	BE	On-Demand	Anodyne	FDPS	15	50
CC[C@H](Nc1ncc(C)s1)[C@H](C)O	ZINC000450786383	BE	On-Demand	Anodyne	FDPS	15	50
COCCn1c(SCc2nc(-c3cc(C)ccn3)no2)nc(C)c1C	ZINC000450786386	FG	On-Demand	Anodyne	TNKS2	15	40
COc1ccc(OC(F)(F)F)c(C(=O)N2CCN(C[C@H](C)O)CC2)c1	ZINC000450786410	FD	On-Demand	Anodyne	ABCB1	26	41
C[C@@H](C1CC1)n1cc(NC(=O)c2cc3cccnc3s2)cn1	ZINC000450786412	DH	On-Demand	Anodyne	ITK	49	34
C[C@H](C1CC1)n1cc(NC(=O)c2cc3cccnc3s2)cn1	ZINC000450786413	DH	On-Demand	Anodyne	ITK	49	34
CCOc1ccc(-c2nnn(CC3(C#N)CCC3)n2)cc1	ZINC000450786427	CE	On-Demand	Mild	CACNA2D2	40	31
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1	ZINC000450786433	FJ	On-Demand	Anodyne	RBP4	81	38
COC(=O)C(C)(C)N1CCN(C(=O)c2cnn3ccc(C)cc23)CC1	ZINC000450786434	ED	On-Demand	Anodyne	EPHB3	32	45
CCCOc1cccc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)c1	ZINC000450786444	EH	On-Demand	Anodyne	HRH2	29	42
CCCOc1cccc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)c1	ZINC000450786444	EH	On-Demand	Anodyne	HRH3	15	41
CCCOc1cccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)c1	ZINC000450786446	EH	On-Demand	Anodyne	HRH2	29	42
CCCOc1cccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)c1	ZINC000450786446	EH	On-Demand	Anodyne	HRH3	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450786447	GH	On-Demand	Anodyne	SLC6A9	22	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450786447	GH	On-Demand	Anodyne	SCD1	22	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450786447	GH	On-Demand	Anodyne	LIPG	46	32
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	LTA4H	25	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	SIGMAR1	26	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	SSTR5	65	46
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	PRKD1	43	32
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	CCR2	16	42
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	MCHR1	46	44
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	AXL	27	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	TYRO3	17	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnccn3)CC2)cc1	ZINC000450786452	ED	On-Demand	Anodyne	MERTK	27	41
C[C@@H](C1CC1)n1cc(NC(=O)c2cnc(C3CC3)nc2)cn1	ZINC000450786456	CF	On-Demand	Anodyne	PANC	40	31
C[C@H](C1CC1)n1cc(NC(=O)c2cnc(C3CC3)nc2)cn1	ZINC000450786457	CF	On-Demand	Anodyne	PANC	40	31
CC(=O)C[C@@H]1COCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450786462	FG	On-Demand	Anodyne	PRCP	43	34
CC(=O)C[C@@H]1COCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450786464	FG	On-Demand	Anodyne	PRCP	43	34
CC(=O)C[C@@H]1COCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450786465	FG	On-Demand	Anodyne	PRCP	43	34
CC(=O)C[C@@H]1COCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450786466	FG	On-Demand	Anodyne	PRCP	43	34
CC(C)(CC(=O)CSc1ccc(C(=O)N2CCCC2)cn1)C1CC1	ZINC000450786467	EH	On-Demand	Anodyne	L3MBTL1	0	41
CC(C)(CC(=O)CSc1ccc(C(=O)N2CCCC2)cn1)C1CC1	ZINC000450786467	EH	On-Demand	Anodyne	L3MBTL3	62	41
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)c(C)c3C#N)CC2)cc1	ZINC000450786470	GG	On-Demand	Mild	SSTR5	53	44
COCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786472	GE	On-Demand	Anodyne	TSHR	56	35
COCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786472	GE	On-Demand	Anodyne	DRD4	25	43
COCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786472	GE	On-Demand	Anodyne	DRD3	15	40
COCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786472	GE	On-Demand	Anodyne	LTA4H	23	42
COCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786472	GE	On-Demand	Anodyne	SIGMAR1	22	43
COCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786472	GE	On-Demand	Anodyne	SSTR5	86	50
COCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786472	GE	On-Demand	Anodyne	MCHR1	59	43
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	INSR	22	42
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	DRD4	24	41
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	DRD3	15	40
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	LTA4H	29	42
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	SIGMAR1	23	42
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	SSTR5	89	50
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	CCR3	33	40
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	PDK1	48	37
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	CXCR3	33	42
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	MCHR1	55	46
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	AXL	38	43
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	ALK	25	40
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	TYRO3	49	43
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	MERTK	44	43
COc1ncc(Cl)c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786474	GF	On-Demand	Anodyne	NOD2	40	38
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	TSHR	56	34
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	DRD3	15	44
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	LTA4H	19	43
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	SIGMAR1	39	40
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	CCR3	43	38
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	TIMP3	41	31
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	MCHR1	32	41
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	NPFFR1	42	33
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccccc4[nH]3)CC2)cc1	ZINC000450786475	FH	On-Demand	Anodyne	NOD2	41	36
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC(=O)N[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450786478	FC	On-Demand	Bother	TAAR1	17	42
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC(=O)N[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450786480	FC	On-Demand	Bother	TAAR1	17	42
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC(=O)N[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450786481	FC	On-Demand	Bother	TAAR1	17	42
CC1=C(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)CCC(C)(C)C1	ZINC000450786492	FH	On-Demand	Anodyne	RARA	32	42
CC1=C(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)CCC(C)(C)C1	ZINC000450786492	FH	On-Demand	Anodyne	EPHX2	17	54
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450786497	FG	On-Demand	Anodyne	RARA	18	42
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450786497	FG	On-Demand	Anodyne	ITGAL	41	32
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450786497	FG	On-Demand	Anodyne	COLA	0	40
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450786497	FG	On-Demand	Anodyne	CPT1A	29	44
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450786497	FG	On-Demand	Anodyne	EPHX2	20	58
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450786497	FG	On-Demand	Anodyne	BTK	46	36
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450786497	FG	On-Demand	Anodyne	KCNK3	78	34
CSc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450786497	FG	On-Demand	Anodyne	KCNK9	46	37
NC(=O)c1coc(CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000450786498	DF	On-Demand	Anodyne	SCN9A	0	41
NC(=O)c1coc(CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)c1	ZINC000450786499	DF	On-Demand	Anodyne	SCN9A	0	41
NC(=O)c1coc(CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000450786500	DF	On-Demand	Anodyne	SCN9A	0	41
NC(=O)c1coc(CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)c1	ZINC000450786501	DF	On-Demand	Anodyne	SCN9A	0	41
Cc1cccc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ncnc12	ZINC000450786517	DD	On-Demand	Anodyne	LIMK2	40	32
C[C@H]1CN(c2nc(-c3ccccc3F)cs2)C[C@@H](C)N1CCO	ZINC000450786531	EF	On-Demand	Anodyne	GABRA3	40	33
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1ccc(N2CCC2)nc1	ZINC000450786534	EF	On-Demand	Anodyne	SMO	0	41
COc1cccc(OCCC(=O)NCc2nnc(C3CCC3)n2C)c1	ZINC000450786545	EE	On-Demand	Anodyne	MTNR1A	38	41
COc1cccc(OCCC(=O)NCc2nnc(C3CCC3)n2C)c1	ZINC000450786545	EE	On-Demand	Anodyne	MTNR1B	40	36
Fc1ccc(-c2csc(N[C@H]3CC34CCOCC4)n2)cc1	ZINC000450786553	DH	On-Demand	Anodyne	MAOB	28	44
Fc1ccc(-c2csc(N[C@@H]3CC34CCOCC4)n2)cc1	ZINC000450786554	DH	On-Demand	Anodyne	MAOB	28	44
CCOC(=O)c1cc(C(=O)NCc2nc3cc(Cl)ccc3n2C)[nH]c1C	ZINC000450786562	FF	On-Demand	Anodyne	PYGL	50	36
C[C@H]1CN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C[C@@H](C)N1CCO	ZINC000450786568	ED	On-Demand	Bother	F2RL3	44	35
C[C@H]1CN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@@H](C)N1CCO	ZINC000450786584	GE	On-Demand	Anodyne	HSD11B1	20	43
C[C@@H]1CN(C(=O)c2ccc3scc(Br)c3c2)CC[C@H]1O	ZINC000450786585	FH	On-Demand	Anodyne	L3MBTL3	43	35
C[C@@H]1CN(C(=O)c2ccc3scc(Br)c3c2)CC[C@@H]1O	ZINC000450786586	FH	On-Demand	Anodyne	L3MBTL3	43	35
C[C@H]1CN(C(=O)c2ccc3scc(Br)c3c2)CC[C@H]1O	ZINC000450786587	FH	On-Demand	Anodyne	L3MBTL3	43	35
C[C@H]1CN(C(=O)c2ccc3scc(Br)c3c2)CC[C@@H]1O	ZINC000450786588	FH	On-Demand	Anodyne	L3MBTL3	43	35
COCC(COC)Nc1ncnc2cc(Br)ccc12	ZINC000450786600	EE	On-Demand	Anodyne	EGFR	52	42
COCC(COC)Nc1ncnc2cc(Br)ccc12	ZINC000450786600	EE	On-Demand	Anodyne	HTT	0	44
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450786609	GG	On-Demand	Anodyne	PFK	0	41
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450786609	GG	On-Demand	Anodyne	RORC	40	38
COCC(COC)Nc1ncccc1OCc1ccccc1	ZINC000450786614	DF	On-Demand	Anodyne	PPIA	56	44
O=C(c1ccc(I)cc1F)N1CC2(CCCC2)C1	ZINC000450786634	FG	On-Demand	Anodyne	MAP2K1	25	45
COCC(COC)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450786645	EC	On-Demand	Anodyne	TGM2	21	40
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	FKBP1A	36	46
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	CASP3	0	47
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	MMP13	22	41
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	CCR4	15	49
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	ITGA4	41	42
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	CAPNS1	20	41
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	MMP3	31	42
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	MMP8	22	40
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	MMP7	37	41
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	MMP1	29	42
CN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000450786670	FD	On-Demand	Anodyne	WNT3	43	32
CCn1nnc(C)c1C(=O)Nc1ccc(C)c(OCc2cccc(Cl)c2)c1	ZINC000450786671	GI	On-Demand	Anodyne	PTGER1	52	41
CCn1nnc(C)c1C(=O)Nc1ccc(C)c(OCc2cccc(Cl)c2)c1	ZINC000450786671	GI	On-Demand	Anodyne	GRM4	19	40
COc1ccc(Nc2nc(N3CC(C)(CO)C3)cc(N3CC(C)(CO)C3)n2)cc1	ZINC000450786696	GD	On-Demand	Anodyne	GALR2	66	46
COCC(COC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450786704	GC	On-Demand	Bother	BCL2L1	114	40
COCC(COC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450786704	GC	On-Demand	Bother	BCL2	96	40
COCC(COC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450786704	GC	On-Demand	Bother	BCL2L2	45	36
COCC(COC)Nc1ccnc2cc(F)ccc12	ZINC000450786705	CE	On-Demand	Anodyne	HNMT	43	30
CC1(CO)CN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450786740	CE	On-Demand	Anodyne	RBP4	19	45
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786762	ED	On-Demand	Anodyne	ACE	30	45
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786762	ED	On-Demand	Anodyne	ELANE	42	41
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786762	ED	On-Demand	Anodyne	PREP	71	47
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786762	ED	On-Demand	Anodyne	SFRP1	43	38
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786762	ED	On-Demand	Anodyne	WNT3	41	38
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786762	ED	On-Demand	Anodyne	BRCA1	44	31
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786762	ED	On-Demand	Anodyne	TMPRSS11D	51	33
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786767	ED	On-Demand	Anodyne	ACE	30	45
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786767	ED	On-Demand	Anodyne	ELANE	42	41
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786767	ED	On-Demand	Anodyne	PREP	71	47
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786767	ED	On-Demand	Anodyne	SFRP1	43	38
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786767	ED	On-Demand	Anodyne	WNT3	41	38
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786767	ED	On-Demand	Anodyne	BRCA1	44	31
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCCN1C	ZINC000450786767	ED	On-Demand	Anodyne	TMPRSS11D	51	33
COCC[C@H](Cc1ccco1)NC(=O)C1(C)CCC(=O)CC1	ZINC000450786769	DE	On-Demand	Anodyne	NPPA	44	34
CC[C@H](Nc1ccnc2cc(F)c(Cl)cc12)[C@@H](C)O	ZINC000450786770	CH	On-Demand	Anodyne	HRP1_PLAFA	21	42
CC[C@H](Nc1ccnc2cc(F)c(Cl)cc12)[C@@H](C)O	ZINC000450786770	CH	On-Demand	Anodyne	RBP_CHICK	0	42
COCC[C@@H](Cc1ccco1)NC(=O)C1(C)CCC(=O)CC1	ZINC000450786771	DE	On-Demand	Anodyne	NPPA	44	34
CC[C@@H](Nc1ccnc2cc(F)c(Cl)cc12)[C@@H](C)O	ZINC000450786772	CH	On-Demand	Anodyne	RBP_CHICK	0	42
CN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@@H]1CCCC[C@H]1O	ZINC000450786785	GE	On-Demand	Mild	PGR	0	42
CN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@@H]1CCCC[C@H]1O	ZINC000450786785	GE	On-Demand	Mild	NR3C2	40	44
CN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@@H]1CCCC[C@H]1O	ZINC000450786785	GE	On-Demand	Mild	AR	23	44
CN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@@H]1CCCC[C@H]1O	ZINC000450786786	GE	On-Demand	Mild	PGR	0	42
CN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@@H]1CCCC[C@H]1O	ZINC000450786786	GE	On-Demand	Mild	NR3C2	40	44
CN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)[C@@H]1CCCC[C@H]1O	ZINC000450786786	GE	On-Demand	Mild	AR	23	44
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC(=O)N[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450786791	FC	On-Demand	Bother	TAAR1	17	42
COC(=O)c1ccc(CC(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1	ZINC000450786797	EF	On-Demand	Anodyne	PANC	56	44
COC(=O)c1ccc(CC(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1	ZINC000450786798	EF	On-Demand	Anodyne	PANC	56	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	DRD3	0	45
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	LTA4H	23	45
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	SIGMAR1	30	45
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	SSTR5	75	49
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	CCR3	49	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	MLNR	38	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	CCR2	21	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	CXCR3	43	39
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	MCHR1	70	46
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	AXL	22	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)n3)CC2)cc1	ZINC000450786799	FG	On-Demand	Anodyne	NOD2	40	34
CC(=O)Nc1ccc(CN2CCC(N=c3nc(C4CC4)[nH]s3)CC2)cc1	ZINC000450786800	FF	On-Demand	Anodyne	MCHR1	24	40
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(-c3cnn(C)c3)o2)CC1	ZINC000450786801	FD	On-Demand	Anodyne	SCN10A	16	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000450786803	FD	On-Demand	Anodyne	PREP	24	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000450786804	FD	On-Demand	Anodyne	PREP	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	CHRM2	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	DRD2	15	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	TSHR	42	35
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	DRD4	47	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	ACHE	29	46
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	DRD3	0	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	CHRM3	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	LTA4H	35	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	SSTR5	82	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	CCR3	43	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	CXCR3	36	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	MCHR1	73	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	AXL	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	TYRO3	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	MERTK	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc4ccccc4nc3C)CC2)cc1	ZINC000450786822	GH	On-Demand	Anodyne	NOD2	44	38
CC(C)CCCC(=O)NCc1nnnn1C	ZINC000450786836	BC	On-Demand	Anodyne	DAGLA	18	44
CO[C@@H]1CCC[C@H]1Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450786837	DE	On-Demand	Anodyne	DHOD	0	49
O=C(NCc1ccc(Cl)cc1F)[C@H]1CC12CCSCC2	ZINC000450786840	DH	On-Demand	Anodyne	P2RX7	46	40
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CC12CCSCC2	ZINC000450786843	DH	On-Demand	Anodyne	P2RX7	46	40
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(F)F)o3)CC2)cc1	ZINC000450786855	FE	On-Demand	Anodyne	KCNH2	15	48
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(F)F)o3)CC2)cc1	ZINC000450786855	FE	On-Demand	Anodyne	LTA4H	16	41
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(F)F)o3)CC2)cc1	ZINC000450786855	FE	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(F)F)o3)CC2)cc1	ZINC000450786855	FE	On-Demand	Anodyne	SSTR5	77	51
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C(F)F)o3)CC2)cc1	ZINC000450786855	FE	On-Demand	Anodyne	MCHR1	43	42
CCN1C[C@H](Nc2ncnc3c(C)cccc23)CC1=O	ZINC000450786859	CD	On-Demand	Anodyne	JAK1	16	40
CCN1C[C@@H](Nc2ncnc3c(C)cccc23)CC1=O	ZINC000450786863	CD	On-Demand	Anodyne	JAK1	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	DRD4	18	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	ACHE	18	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	LTA4H	22	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	SSTR5	70	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	MLNR	42	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	CCR2	19	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	CXCR3	28	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000450786865	GF	On-Demand	Anodyne	MCHR1	54	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(N(C)C)n3)CC2)cc1	ZINC000450786867	FD	On-Demand	Anodyne	DRD4	17	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(N(C)C)n3)CC2)cc1	ZINC000450786867	FD	On-Demand	Anodyne	LTA4H	26	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(N(C)C)n3)CC2)cc1	ZINC000450786867	FD	On-Demand	Anodyne	SIGMAR1	23	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(N(C)C)n3)CC2)cc1	ZINC000450786867	FD	On-Demand	Anodyne	SSTR5	78	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(N(C)C)n3)CC2)cc1	ZINC000450786867	FD	On-Demand	Anodyne	MLNR	54	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(N(C)C)n3)CC2)cc1	ZINC000450786867	FD	On-Demand	Anodyne	MCHR1	58	44
CC(=O)Nc1ccc(CN2CCC(Nc3snc(C)c3C#N)CC2)cc1	ZINC000450786868	FG	On-Demand	Mild	SSTR5	41	41
CC(=O)Nc1ccc(CN2CCC(Nc3snc(C)c3C#N)CC2)cc1	ZINC000450786868	FG	On-Demand	Mild	MLNR	36	40
CCOC(=O)c1cc(C(=O)NCc2cc(F)ccc2OC)on1	ZINC000450786869	DD	On-Demand	Anodyne	GRIN2B	23	43
CCOC(=O)c1cc(C(=O)NCc2cc(F)ccc2OC)on1	ZINC000450786869	DD	On-Demand	Anodyne	P2RX7	45	42
CCOC(=O)c1cc(C(=O)NCc2cc(F)ccc2OC)on1	ZINC000450786869	DD	On-Demand	Anodyne	PPARD	22	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)cc1	ZINC000450786871	GD	On-Demand	Bother	SIGMAR1	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)cc1	ZINC000450786871	GD	On-Demand	Bother	SSTR5	71	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)cc1	ZINC000450786871	GD	On-Demand	Bother	CDK2	17	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)cc1	ZINC000450786871	GD	On-Demand	Bother	MCHR1	32	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)cc1	ZINC000450786871	GD	On-Demand	Bother	AXL	26	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)cc1	ZINC000450786871	GD	On-Demand	Bother	TYRO3	17	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)cc1	ZINC000450786871	GD	On-Demand	Bother	MERTK	30	42
COc1cc(Br)ccc1CNC(=O)CSC1CC1	ZINC000450786877	EF	On-Demand	Anodyne	QRFPR	42	36
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(I)cc2F)cn1	ZINC000450786878	GH	On-Demand	Anodyne	ITK	49	32
CCS(=O)(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450786879	FD	On-Demand	Anodyne	MMP13	25	43
CCS(=O)(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450786879	FD	On-Demand	Anodyne	ADAM17	27	43
CCS(=O)(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450786879	FD	On-Demand	Anodyne	PTPRB	48	34
CCS(=O)(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450786879	FD	On-Demand	Anodyne	MMP9	21	43
CCS(=O)(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450786879	FD	On-Demand	Anodyne	MMP1	15	43
CCS(=O)(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450786879	FD	On-Demand	Anodyne	RORC	46	32
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(I)cc2F)cn1	ZINC000450786881	GH	On-Demand	Anodyne	ITK	49	32
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])nc3)CC2)cc1	ZINC000450786882	FG	On-Demand	Bother	SIGMAR1	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])nc3)CC2)cc1	ZINC000450786882	FG	On-Demand	Bother	SSTR5	65	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])nc3)CC2)cc1	ZINC000450786882	FG	On-Demand	Bother	MLNR	36	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])nc3)CC2)cc1	ZINC000450786882	FG	On-Demand	Bother	MCHR1	35	44
COc1cc(CN2CCC[C@@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786883	ED	On-Demand	Anodyne	DRD3	0	47
COc1cc(CN2CCC[C@@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786883	ED	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC[C@@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786883	ED	On-Demand	Anodyne	HTR4	47	33
COc1cc(CN2CCC[C@@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786883	ED	On-Demand	Anodyne	SSTR5	47	44
COc1cc(CN2CCC[C@@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786883	ED	On-Demand	Anodyne	CCR3	41	42
COc1cc(CN2CCC[C@@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786883	ED	On-Demand	Anodyne	UTS2R	27	40
COc1cc(CN2CCC[C@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786885	ED	On-Demand	Anodyne	DRD3	0	47
COc1cc(CN2CCC[C@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786885	ED	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC[C@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786885	ED	On-Demand	Anodyne	HTR4	47	33
COc1cc(CN2CCC[C@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786885	ED	On-Demand	Anodyne	SSTR5	47	44
COc1cc(CN2CCC[C@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786885	ED	On-Demand	Anodyne	CCR3	41	42
COc1cc(CN2CCC[C@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450786885	ED	On-Demand	Anodyne	UTS2R	27	40
CC[C@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450786888	EE	On-Demand	Anodyne	PDS	44	36
CC[C@@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450786890	EE	On-Demand	Anodyne	PDS	44	36
CC[C@H](O)CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450786891	EE	On-Demand	Anodyne	PDS	44	36
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1	ZINC000450786892	EE	On-Demand	Anodyne	PDS	44	36
CC1(C)Cc2cccc(CSc3ccc(C(=O)N4CCCC4)cn3)c2O1	ZINC000450786893	FI	On-Demand	Anodyne	CCR8	23	47
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(-n4cccn4)n3)CC2)cc1	ZINC000450786895	GF	On-Demand	Anodyne	LTA4H	20	41
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(-n4cccn4)n3)CC2)cc1	ZINC000450786895	GF	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(-n4cccn4)n3)CC2)cc1	ZINC000450786895	GF	On-Demand	Anodyne	SSTR5	74	41
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(-n4cccn4)n3)CC2)cc1	ZINC000450786895	GF	On-Demand	Anodyne	MCHR1	40	42
CCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786907	FF	On-Demand	Anodyne	DRD4	18	41
CCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786907	FF	On-Demand	Anodyne	LTA4H	18	42
CCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786907	FF	On-Demand	Anodyne	SIGMAR1	24	41
CCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786907	FF	On-Demand	Anodyne	SSTR5	75	50
CCc1nc(C)cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450786907	FF	On-Demand	Anodyne	MCHR1	51	42
CCOCc1nc(C)c(C(=O)NCc2ccc(Cl)cc2F)s1	ZINC000450786908	EH	On-Demand	Anodyne	CHRM4	29	43
CCOCc1nc(C)c(C(=O)NCc2ccc(Cl)cc2F)s1	ZINC000450786908	EH	On-Demand	Anodyne	P2RX7	55	37
CCOCc1nc(C)c(C(=O)NCc2ccc(Cl)cc2F)s1	ZINC000450786908	EH	On-Demand	Anodyne	SCD1	41	41
CCOCc1nc(C)c(C(=O)NCc2ccc(Cl)cc2F)s1	ZINC000450786908	EH	On-Demand	Anodyne	SCD	31	41
COc1ccc(F)cc1CNC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450786912	CE	On-Demand	Mild	ACKR3	40	32
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450786914	EH	On-Demand	Anodyne	ITK	46	31
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450786914	EH	On-Demand	Anodyne	PANC	52	40
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450786915	EH	On-Demand	Anodyne	ITK	46	31
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450786915	EH	On-Demand	Anodyne	PANC	52	40
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cn1	ZINC000450786916	EH	On-Demand	Anodyne	ITK	46	31
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cn1	ZINC000450786916	EH	On-Demand	Anodyne	PANC	52	40
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450786917	EH	On-Demand	Anodyne	ITK	46	31
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450786917	EH	On-Demand	Anodyne	PANC	52	40
COc1ccc(F)cc1CNC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450786921	CE	On-Demand	Mild	ACKR3	40	32
CCc1cc(N[C@@H]2CCC[C@H]2OC)n2ncnc2n1	ZINC000450786923	CD	On-Demand	Anodyne	DHOD	0	47
COc1ccc(F)cc1CNC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450786924	CE	On-Demand	Mild	ACKR3	40	32
COc1ccc(F)cc1CNC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450786925	CE	On-Demand	Mild	ACKR3	40	32
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cc(C)ccc4o3)CC2)cc1	ZINC000450786934	GH	On-Demand	Anodyne	SSTR5	41	42
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cc(C)ccc4o3)CC2)cc1	ZINC000450786934	GH	On-Demand	Anodyne	CCR3	19	40
CCOC[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450786966	EG	On-Demand	Anodyne	AVPR1B	41	38
CCOC[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450786966	EG	On-Demand	Anodyne	CTRA_BOVIN	45	32
CCOC[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450786966	EG	On-Demand	Anodyne	HDAC8	26	41
CCOC[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450786966	EG	On-Demand	Anodyne	TACR3	48	34
CCOC[C@H](C)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450786966	EG	On-Demand	Anodyne	IMDH_CRYPV	35	53
Cc1ccn2ncc(C(=O)N3CCN(C[C@H](C)O)CC3)c2c1	ZINC000450786977	DC	On-Demand	Anodyne	EPHB3	25	43
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	DRD4	25	44
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	SIGMAR1	29	55
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	SSTR5	52	42
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	CCR3	20	43
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	PDK1	41	36
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	CXCR3	28	41
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	MCHR1	47	43
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	CACNA1G	21	40
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	CACNA1I	54	41
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	ADIPOR1	0	40
CC[C@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786978	FG	On-Demand	Anodyne	ADIPOR2	0	40
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	DRD4	25	44
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	SIGMAR1	29	55
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	SSTR5	52	42
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	CCR3	20	43
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	PDK1	41	36
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	CXCR3	28	41
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	MCHR1	47	43
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	CACNA1G	21	40
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	CACNA1I	54	41
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	ADIPOR1	0	40
CC[C@@H](O)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000450786979	FG	On-Demand	Anodyne	ADIPOR2	0	40
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450786980	CF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CC[C@H]1CCC[C@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450786981	CF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450786984	CF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450786986	CF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CCc1cc(N[C@@H]2CCO[C@H](c3cccnc3)C2)n2ncnc2n1	ZINC000450787010	DE	On-Demand	Anodyne	DHOD	0	42
CC(C)OCCCCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450787011	CE	On-Demand	Anodyne	HPGDS	29	46
CCc1cc(N[C@H]2CCO[C@H](c3cccnc3)C2)n2ncnc2n1	ZINC000450787013	DE	On-Demand	Anodyne	DHOD	0	42
CCn1c(SCC2(OC)CCC2)nc2ccsc2c1=O	ZINC000450787014	DG	On-Demand	Anodyne	PDE7A	19	47
CCc1cc(N[C@@H]2CCO[C@@H](c3cccnc3)C2)n2ncnc2n1	ZINC000450787015	DE	On-Demand	Anodyne	DHOD	0	42
CCc1cc(N[C@H]2CCO[C@@H](c3cccnc3)C2)n2ncnc2n1	ZINC000450787017	DE	On-Demand	Anodyne	DHOD	0	42
Cc1nc2ccccc2c(N2C[C@H](C)N(CCO)[C@H](C)C2)c1C	ZINC000450787022	DF	On-Demand	Anodyne	ADRA2A	0	44
Cc1nc2ccccc2c(N2C[C@H](C)N(CCO)[C@H](C)C2)c1C	ZINC000450787022	DF	On-Demand	Anodyne	ADRA2B	22	42
Cc1nc2ccccc2c(N2C[C@H](C)N(CCO)[C@H](C)C2)c1C	ZINC000450787022	DF	On-Demand	Anodyne	ADRA2C	22	44
O=C(NCc1ccc(Cl)cc1F)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450787036	GI	On-Demand	Anodyne	P2RX7	51	38
O=C(NCc1ccc(Cl)cc1F)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450787036	GI	On-Demand	Anodyne	EPHX2	17	45
O=C(NCc1ccc(Cl)cc1F)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450787036	GI	On-Demand	Anodyne	SCN10A	35	40
O=C(NCc1ccc(Cl)cc1F)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450787036	GI	On-Demand	Anodyne	CXCR3	25	42
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450787037	FF	On-Demand	Anodyne	RBP4	51	32
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450787039	FF	On-Demand	Anodyne	RBP4	51	32
CC[C@@H](Nc1ccc(C(=O)c2ccccc2C(=O)OC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450787047	GG	On-Demand	Bother	TAAR1	16	43
CC[C@H](Nc1ccc(C(=O)c2ccccc2C(=O)OC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450787049	GG	On-Demand	Bother	TAAR1	16	43
CC[C@@H](Nc1ccc(C(=O)c2ccccc2C(=O)OC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450787050	GG	On-Demand	Bother	TAAR1	16	43
CC[C@H](Nc1ccc(C(=O)c2ccccc2C(=O)OC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450787052	GG	On-Demand	Bother	TAAR1	16	43
CC(=O)c1cccc(CN2CCC[C@H]2CCO)c1	ZINC000450787058	BE	On-Demand	Anodyne	SLC18A2	46	36
CC(=O)c1cccc(CN2CCC[C@H]2CCO)c1	ZINC000450787058	BE	On-Demand	Anodyne	HRH3	0	42
CC(=O)c1cccc(CN2CCC[C@H]2CCO)c1	ZINC000450787058	BE	On-Demand	Anodyne	CCR3	19	40
CC(=O)c1cccc(CN2CCC[C@H]2CCO)c1	ZINC000450787058	BE	On-Demand	Anodyne	ACKR3	51	32
CC(=O)c1cccc(CN2CCC[C@@H]2CCO)c1	ZINC000450787063	BE	On-Demand	Anodyne	SLC18A2	46	36
CC(=O)c1cccc(CN2CCC[C@@H]2CCO)c1	ZINC000450787063	BE	On-Demand	Anodyne	HRH3	0	42
CC(=O)c1cccc(CN2CCC[C@@H]2CCO)c1	ZINC000450787063	BE	On-Demand	Anodyne	CCR3	19	40
CC(=O)c1cccc(CN2CCC[C@@H]2CCO)c1	ZINC000450787063	BE	On-Demand	Anodyne	ACKR3	51	32
COc1ccc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ncnc2c1F	ZINC000450787081	ED	On-Demand	Anodyne	PDE3A	42	35
COc1ccc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ncnc2c1F	ZINC000450787081	ED	On-Demand	Anodyne	PDE3B	62	35
COc1cc(OC)c(NC(=O)[C@H](C)Oc2ccccn2)cc1Br	ZINC000450787083	GG	On-Demand	Anodyne	GLMU	0	41
COc1cc(OC)c(NC(=O)[C@@H](C)Oc2ccccn2)cc1Br	ZINC000450787090	GG	On-Demand	Anodyne	GLMU	0	41
C=CCN(C)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450787091	BE	On-Demand	Mild	SLC6A1	46	32
C=CCN(C)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450787093	BE	On-Demand	Mild	SLC6A1	46	32
CC(=O)Nc1ncccc1NC(=O)c1nn(C)c2c1CCCC2	ZINC000450787096	DD	On-Demand	Anodyne	G2YM83_BOTF4	45	33
C[C@H]1CN(c2nccc(C(C)(C)C)n2)C[C@@H](C)N1CCO	ZINC000450787097	CD	On-Demand	Anodyne	SORD	60	35
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	DRD4	25	41
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	ACHE	25	43
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	CHRM3	17	45
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	CCR3	51	41
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	MLNR	32	40
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	MAPK1	32	41
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	CCR2	31	43
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	CACNA1G	44	47
CC(=O)c1cccc(CN2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787113	EE	On-Demand	Anodyne	CACNA1I	47	43
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	DRD4	25	41
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	ACHE	25	43
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	CHRM3	17	45
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	CCR3	51	41
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	MLNR	32	40
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	MAPK1	32	41
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	CCR2	31	43
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	CACNA1G	44	47
CC(=O)c1cccc(CN2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450787114	EE	On-Demand	Anodyne	CACNA1I	47	43
C[C@H]1CN(c2nccc(OCc3ccccc3)n2)C[C@@H](C)N1CCO	ZINC000450787138	ED	On-Demand	Anodyne	SORD	58	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](O)[C@@H](C)C1	ZINC000450787145	DF	On-Demand	Anodyne	CACNA1B	49	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](O)[C@@H](C)C1	ZINC000450787145	DF	On-Demand	Anodyne	LIPG	53	36
CCc1nc(C)c(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])s1	ZINC000450787147	FI	On-Demand	Bother	SORT1	16	43
O=C(NCc1ccc(Cl)cc1F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450787151	CG	On-Demand	Anodyne	P2RX7	77	43
O=C(NCc1ccc(Cl)cc1F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450787151	CG	On-Demand	Anodyne	EPHX2	16	43
O=C(NCc1ccc(Cl)cc1F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450787151	CG	On-Demand	Anodyne	CXCR3	15	41
COc1cc2c(N3CC4(CCOCC4)[C@@H]4CCC[C@@H]43)ncnc2cc1F	ZINC000450787152	FH	On-Demand	Anodyne	PDE3A	45	35
COc1cc2c(N3CC4(CCOCC4)[C@@H]4CCC[C@@H]43)ncnc2cc1F	ZINC000450787152	FH	On-Demand	Anodyne	PDE3B	67	35
Cc1cc(N2C[C@H]3CCN(C)[C@H]3C2)n2ncnc2n1	ZINC000450787157	CC	On-Demand	Anodyne	DHOD	0	41
C[C@@H]1CN(Cc2cc(CN3CC[C@@H](O)[C@H](C)C3)ccc2F)CC[C@@H]1O	ZINC000450787164	FE	On-Demand	Anodyne	SIGMAR1	26	42
C[C@@H]1CN(Cc2cc(CN3CC[C@@H](O)[C@H](C)C3)ccc2F)CC[C@@H]1O	ZINC000450787164	FE	On-Demand	Anodyne	MLNR	48	38
C[C@H](OCCc1ccccc1)C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450787168	FF	On-Demand	Anodyne	P2RY12	43	31
C[C@@H]1CN(Cc2ccc(F)c(CN3CC[C@H](O)[C@H](C)C3)c2)CC[C@@H]1O	ZINC000450787169	FE	On-Demand	Anodyne	SIGMAR1	26	42
C[C@@H]1CN(Cc2ccc(F)c(CN3CC[C@H](O)[C@H](C)C3)c2)CC[C@@H]1O	ZINC000450787169	FE	On-Demand	Anodyne	MLNR	48	38
C[C@@H](OCCc1ccccc1)C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450787170	FF	On-Demand	Anodyne	P2RY12	43	31
C[C@H]1CN(Cc2cc(CN3CC[C@@H](O)[C@H](C)C3)ccc2F)CC[C@@H]1O	ZINC000450787172	FE	On-Demand	Anodyne	SIGMAR1	26	42
C[C@H]1CN(Cc2cc(CN3CC[C@@H](O)[C@H](C)C3)ccc2F)CC[C@@H]1O	ZINC000450787172	FE	On-Demand	Anodyne	MLNR	48	38
C[C@H]1CN(Cc2cc(CN3CC[C@H](O)[C@H](C)C3)ccc2F)CC[C@@H]1O	ZINC000450787174	FE	On-Demand	Anodyne	SIGMAR1	26	42
C[C@H]1CN(Cc2cc(CN3CC[C@H](O)[C@H](C)C3)ccc2F)CC[C@@H]1O	ZINC000450787174	FE	On-Demand	Anodyne	MLNR	48	38
C[C@H](O)CN1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450787177	ED	On-Demand	Anodyne	SIGMAR1	26	40
COc1cc(CN2CCO[C@@H](CN(C)c3nccn(C)c3=O)C2)ccc1Cl	ZINC000450787185	GD	On-Demand	Anodyne	DRD4	20	53
COc1cc(CN2CCO[C@H](CN(C)c3nccn(C)c3=O)C2)ccc1Cl	ZINC000450787186	GD	On-Demand	Anodyne	DRD4	20	53
FC(F)(F)c1cc(N2C[C@@H](C3CC3)[C@@H]2C2CC2)n2ncnc2n1	ZINC000450787192	DF	On-Demand	Anodyne	DHOD	0	41
FC(F)(F)c1cc(N2C[C@@H](C3CC3)[C@H]2C2CC2)n2ncnc2n1	ZINC000450787194	DF	On-Demand	Anodyne	DHOD	0	41
FC(F)(F)c1cc(N2C[C@H](C3CC3)[C@@H]2C2CC2)n2ncnc2n1	ZINC000450787196	DF	On-Demand	Anodyne	DHOD	0	41
FC(F)(F)c1cc(N2C[C@H](C3CC3)[C@H]2C2CC2)n2ncnc2n1	ZINC000450787197	DF	On-Demand	Anodyne	DHOD	0	41
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccc(N4CCC4)nc3)C2)nc1	ZINC000450787199	GD	On-Demand	Anodyne	P2RY12	24	42
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccc(N4CCC4)nc3)C2)nc1	ZINC000450787199	GD	On-Demand	Anodyne	SSTR5	45	43
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccc(N4CCC4)nc3)C2)nc1	ZINC000450787199	GD	On-Demand	Anodyne	HDAC1	28	42
CCOC(=O)c1ccc(N2CC(NC(=O)c3ccc(N4CCC4)nc3)C2)nc1	ZINC000450787199	GD	On-Demand	Anodyne	HPGDS	35	52
COc1ccc(-c2csc3ncnc(N4C[C@@H]5CCN(C)[C@@H]5C4)c23)cc1	ZINC000450787202	FH	On-Demand	Anodyne	ADRB2	16	44
COc1ccc(-c2csc3ncnc(N4C[C@@H]5CCN(C)[C@@H]5C4)c23)cc1	ZINC000450787202	FH	On-Demand	Anodyne	ADRB3	15	50
CC[C@@H](Nc1ccnc2cc(F)c(Cl)cc12)[C@H](C)O	ZINC000450787204	CH	On-Demand	Anodyne	HRP1_PLAFA	21	42
CC[C@@H](Nc1ccnc2cc(F)c(Cl)cc12)[C@H](C)O	ZINC000450787204	CH	On-Demand	Anodyne	RBP_CHICK	0	42
CC(C)CN1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1=O	ZINC000450787217	FF	On-Demand	Bother	P2RX7	0	56
CC[C@H](Nc1ccnc2cc(F)c(Cl)cc12)[C@H](C)O	ZINC000450787222	CH	On-Demand	Anodyne	HRP1_PLAFA	21	42
CC[C@H](Nc1ccnc2cc(F)c(Cl)cc12)[C@H](C)O	ZINC000450787222	CH	On-Demand	Anodyne	RBP_CHICK	0	42
C[C@@H]1C(=O)N(C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450787228	CD	On-Demand	Anodyne	DRD2	31	44
C[C@H]1C(=O)N(C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450787230	CD	On-Demand	Anodyne	DRD2	31	44
CCOC(=O)c1ccc(N2CC(NC(=O)c3c(C)cccc3Cl)C2)nc1	ZINC000450787243	FF	On-Demand	Anodyne	P2RY12	27	47
C[C@@H]1C(=O)N(C)CCN1C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450787259	FD	On-Demand	Anodyne	TRPC6	99	49
C[C@@H]1C(=O)N(C)CCN1C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450787259	FD	On-Demand	Anodyne	TRPC3	94	49
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]1c1nc(C(=O)NC2CC2)no1	ZINC000450787260	FE	On-Demand	Anodyne	CPT1A	38	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]1c1nc(C(=O)NC2CC2)no1	ZINC000450787261	FE	On-Demand	Anodyne	CPT1A	38	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]1c1nc(C(=O)NC2CC2)no1	ZINC000450787262	FE	On-Demand	Anodyne	CPT1A	38	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H]1c1nc(C(=O)NC2CC2)no1	ZINC000450787263	FE	On-Demand	Anodyne	CPT1A	38	40
CC[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H](C)O	ZINC000450787264	DF	On-Demand	Bother	MAOB	25	53
C[C@H]1C(=O)N(C)CCN1C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450787265	FD	On-Demand	Anodyne	TRPC6	99	49
C[C@H]1C(=O)N(C)CCN1C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450787265	FD	On-Demand	Anodyne	TRPC3	94	49
CC[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H](C)O	ZINC000450787268	DF	On-Demand	Bother	MAOB	25	53
CC[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H](C)O	ZINC000450787270	DF	On-Demand	Bother	MAOB	25	53
CC[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H](C)O	ZINC000450787271	DF	On-Demand	Bother	MAOB	25	53
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc2nnc(C3CCC3)n2c1	ZINC000450787273	FJ	On-Demand	Anodyne	TRPV1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc2nnc(C3CCC3)n2c1	ZINC000450787273	FJ	On-Demand	Anodyne	MAPK13	29	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc2nnc(C3CCC3)n2c1	ZINC000450787273	FJ	On-Demand	Anodyne	MTTP	50	36
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc2nnc(C3CCC3)n2c1	ZINC000450787273	FJ	On-Demand	Anodyne	MCHR1	15	52
CC(F)(F)c1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cn1	ZINC000450787284	FE	On-Demand	Anodyne	TRPV1	21	44
CC(F)(F)c1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cn1	ZINC000450787284	FE	On-Demand	Anodyne	CYNT	35	44
CC(F)(F)c1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cn1	ZINC000450787284	FE	On-Demand	Anodyne	NAMPT	24	40
CC1(CO)CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450787285	CD	On-Demand	Anodyne	SCD1	37	43
c1ccc(COc2cccnc2NCCN2C[C@@H]3CC[C@H](C2)O3)cc1	ZINC000450787289	EF	On-Demand	Anodyne	PPIA	36	43
CSc1c(F)cc(NC(=O)CC2CC(F)(F)C2)cc1F	ZINC000450787292	DI	On-Demand	Anodyne	ENV	41	32
COCC(COC)Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450787298	ED	On-Demand	Anodyne	DRD3	18	41
COCC(COC)Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450787298	ED	On-Demand	Anodyne	CNR2	15	43
COCC(COC)Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450787298	ED	On-Demand	Anodyne	TACR2	16	41
COCC(COC)Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450787298	ED	On-Demand	Anodyne	ACACB	25	43
COCC(COC)Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450787298	ED	On-Demand	Anodyne	METG	43	30
COCC(COC)Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450787298	ED	On-Demand	Anodyne	TNKS	59	33
CSc1c(F)cc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)cc1F	ZINC000450787311	GI	On-Demand	Anodyne	PDE4D	16	40
COC(=O)CNC(=O)c1ccc(N2C[C@H](C)N(CCO)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450787313	GC	On-Demand	Bother	TAAR1	20	43
CSc1c(F)cc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1F	ZINC000450787314	GI	On-Demand	Anodyne	PDE4D	16	40
COc1ccc(-c2nnc(N3CC(C)(CO)C3)c3ccccc23)cc1	ZINC000450787319	EG	On-Demand	Anodyne	SMO	43	43
CCOC(=O)c1c[nH]c2ccc(C)cc2c1=N[C@@H]1CCO[C@@H](c2cccnc2)C1	ZINC000450787323	GH	On-Demand	Anodyne	PTAFR	30	43
CC(C)C1(C)CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450787324	CG	On-Demand	Anodyne	GNAI1	0	40
CCOC(=O)c1c[nH]c2ccc(C)cc2c1=N[C@H]1CCO[C@@H](c2cccnc2)C1	ZINC000450787326	GH	On-Demand	Anodyne	PTAFR	30	43
CCOC(=O)c1c[nH]c2ccc(C)cc2c1=N[C@@H]1CCO[C@H](c2cccnc2)C1	ZINC000450787328	GH	On-Demand	Anodyne	PTAFR	30	43
CCOC(=O)c1c[nH]c2ccc(C)cc2c1=N[C@H]1CCO[C@H](c2cccnc2)C1	ZINC000450787329	GH	On-Demand	Anodyne	PTAFR	30	43
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450787341	CD	On-Demand	Anodyne	NAMPT	30	40
CNC(=O)c1ccn([C@H]2CCCN(Cc3ccn(CCc4ccccc4)n3)C2)n1	ZINC000450787355	GF	On-Demand	Anodyne	BIRC2	41	38
CNC(=O)c1ccn([C@@H]2CCCN(Cc3ccn(CCc4ccccc4)n3)C2)n1	ZINC000450787356	GF	On-Demand	Anodyne	BIRC2	41	38
COCC(COC)Nc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1	ZINC000450787357	DD	On-Demand	Mild	F2RL3	44	34
CC[C@@H](Nc1ncnc2[nH]c3ccccc3c12)[C@H](C)O	ZINC000450787372	CF	On-Demand	Anodyne	UTS2R	30	47
CC[C@H](Nc1ncnc2[nH]c3ccccc3c12)[C@@H](C)O	ZINC000450787373	CF	On-Demand	Anodyne	UTS2R	30	47
CC[C@@H](Nc1ncnc2[nH]c3ccccc3c12)[C@@H](C)O	ZINC000450787374	CF	On-Demand	Anodyne	UTS2R	30	47
CC[C@H](Nc1ncnc2[nH]c3ccccc3c12)[C@H](C)O	ZINC000450787375	CF	On-Demand	Anodyne	UTS2R	30	47
COCC(=O)N1CCc2cc(NC(=O)c3ccsc3Br)ccc21	ZINC000450787386	GG	On-Demand	Anodyne	AVPR2	58	38
COCC(=O)N1CCc2cc(NC(=O)c3ccsc3Br)ccc21	ZINC000450787386	GG	On-Demand	Anodyne	NOS1	16	45
COCC(=O)N1CCc2cc(NC(=O)c3ccsc3Br)ccc21	ZINC000450787386	GG	On-Demand	Anodyne	NAMPT	32	45
CCC[C@@H](O)CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450787389	CE	On-Demand	Anodyne	CHRNA2	39	40
CCC[C@@H](O)CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450787389	CE	On-Demand	Anodyne	CRTY	0	40
CCC[C@H](O)CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450787390	CE	On-Demand	Anodyne	CHRNA2	39	40
CCC[C@H](O)CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450787390	CE	On-Demand	Anodyne	CRTY	0	40
CCNC(=O)c1ccc(NC(COC)COC)nc1	ZINC000450787393	CC	On-Demand	Anodyne	GCK	31	42
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450787399	ED	On-Demand	Anodyne	GHRHR	60	32
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450787399	ED	On-Demand	Anodyne	MME	49	42
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450787399	ED	On-Demand	Anodyne	TRY2_BOVIN	51	33
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450787399	ED	On-Demand	Anodyne	CTRB1	44	34
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450787399	ED	On-Demand	Anodyne	CAPN1	40	33
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450787399	ED	On-Demand	Anodyne	CAPN2	44	31
COC(=O)C(C)(C)N1CCN(C(=O)[C@H](Cc2ccccc2)OC)CC1	ZINC000450787399	ED	On-Demand	Anodyne	ACE2	52	33
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450787400	ED	On-Demand	Anodyne	GHRHR	60	32
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450787400	ED	On-Demand	Anodyne	MME	49	42
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450787400	ED	On-Demand	Anodyne	TRY2_BOVIN	51	33
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450787400	ED	On-Demand	Anodyne	CTRB1	44	34
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450787400	ED	On-Demand	Anodyne	CAPN1	40	33
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450787400	ED	On-Demand	Anodyne	CAPN2	44	31
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H](Cc2ccccc2)OC)CC1	ZINC000450787400	ED	On-Demand	Anodyne	ACE2	52	33
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	TSHR	48	32
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	DRD4	34	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	ACHE	31	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	KCNH2	16	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	LTA4H	37	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	SIGMAR1	32	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	SSTR5	88	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	P2RY1	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	CCR3	56	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	MLNR	58	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	FAAH	19	52
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	CCR2	39	52
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	SLC6A5	29	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	EPHX2	43	38
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	CXCR3	47	39
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	MCHR1	87	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	MCHR2	42	37
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	BRAF	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccnc(C(F)(F)F)c3)CC2)cc1	ZINC000450787406	GI	On-Demand	Anodyne	NOD2	40	35
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cccc(F)c4n3C)CC2)cc1	ZINC000450787407	GG	On-Demand	Anodyne	ACHE	18	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cccc(F)c4n3C)CC2)cc1	ZINC000450787407	GG	On-Demand	Anodyne	SIGMAR1	29	44
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cccc(F)c4n3C)CC2)cc1	ZINC000450787407	GG	On-Demand	Anodyne	CCR3	48	37
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cccc(F)c4n3C)CC2)cc1	ZINC000450787407	GG	On-Demand	Anodyne	MLNR	52	35
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	DRD4	16	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	SIGMAR1	27	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	SSTR5	78	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	MLNR	45	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	CXCR3	36	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	MCHR1	53	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	AXL	34	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	TYRO3	24	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C(F)F)cn3)CC2)cc1	ZINC000450787408	GG	On-Demand	Anodyne	MERTK	36	44
COC(=O)[C@H](C)S[C@H](C)CC(C)C	ZINC000450787409	BF	On-Demand	Anodyne	NPR	16	43
COC(=O)[C@@H](C)S[C@@H](C)CC(C)C	ZINC000450787410	BF	On-Demand	Anodyne	NPR	16	43
COC(=O)[C@H](C)S[C@@H](C)CC(C)C	ZINC000450787411	BF	On-Demand	Anodyne	NPR	16	43
COC(=O)[C@@H](C)S[C@H](C)CC(C)C	ZINC000450787412	BF	On-Demand	Anodyne	NPR	16	43
C[C@@H](C1CC1)n1cc(NC(=O)CCc2ccc3ccccc3c2O)cn1	ZINC000450787417	EI	On-Demand	Anodyne	ITK	40	30
C[C@H](C1CC1)n1cc(NC(=O)CCc2ccc3ccccc3c2O)cn1	ZINC000450787418	EI	On-Demand	Anodyne	ITK	40	30
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cn1	ZINC000450787421	DH	On-Demand	Anodyne	PANC	55	35
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cn1	ZINC000450787422	DH	On-Demand	Anodyne	PANC	55	35
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450787435	GG	On-Demand	Bother	LTA4H	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450787435	GG	On-Demand	Bother	SIGMAR1	18	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450787435	GG	On-Demand	Bother	SSTR5	57	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450787435	GG	On-Demand	Bother	MCHR1	35	41
CCS(=O)(=O)c1ccc(CS[C@@H](C)C(=O)OC)cc1	ZINC000450787438	DE	On-Demand	Anodyne	RORC	43	34
CCS(=O)(=O)c1ccc(CS[C@H](C)C(=O)OC)cc1	ZINC000450787439	DE	On-Demand	Anodyne	RORC	43	34
CC(=O)Nc1ccc(CN2CCC(Nc3nccn(C(F)F)c3=O)CC2)cc1	ZINC000450787446	GE	On-Demand	Anodyne	SIGMAR1	20	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccn(C(F)F)c3=O)CC2)cc1	ZINC000450787446	GE	On-Demand	Anodyne	SSTR5	73	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccn(C(F)F)c3=O)CC2)cc1	ZINC000450787446	GE	On-Demand	Anodyne	MCHR1	55	40
NC(=O)c1ncn([C@@H]2CCCN(Cc3ccn(CCc4ccccc4)n3)C2)n1	ZINC000450787448	GD	On-Demand	Anodyne	SLC6A1	40	31
NC(=O)c1ncn([C@H]2CCCN(Cc3ccn(CCc4ccccc4)n3)C2)n1	ZINC000450787449	GD	On-Demand	Anodyne	SLC6A1	40	31
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450787450	ED	On-Demand	Anodyne	SLC6A1	110	40
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450787450	ED	On-Demand	Anodyne	CYP2J2	55	39
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450787451	ED	On-Demand	Anodyne	SLC6A1	110	40
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450787451	ED	On-Demand	Anodyne	CYP2J2	55	39
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	LTA4H	24	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	SIGMAR1	31	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	SSTR5	68	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	MLNR	38	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	CCR2	19	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	CXCR3	47	39
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	MCHR1	61	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	AXL	37	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	TYRO3	41	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cn3)CC2)cc1	ZINC000450787462	FG	On-Demand	Anodyne	MERTK	35	44
COc1cccc(OCCC(=O)NCc2cn(C)nc2C)c1	ZINC000450787469	DD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)NCc2cn(C)nc2C)c1	ZINC000450787469	DD	On-Demand	Anodyne	PDGFRB	25	42
COc1cccc(OCCC(=O)NCc2cn(C)nc2C)c1	ZINC000450787469	DD	On-Demand	Anodyne	P2RX7	34	42
COc1cccc(OCCC(=O)NCc2cn(C)nc2C)c1	ZINC000450787469	DD	On-Demand	Anodyne	MTNR1B	49	42
O=C(c1ccc(SCC2CC(F)(F)C2)nc1)N1CCCC1	ZINC000450787470	DG	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(SCC2CC(F)(F)C2)nc1)N1CCCC1	ZINC000450787470	DG	On-Demand	Anodyne	L3MBTL3	54	35
C[C@@H]1CN(c2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])CC(=O)N1	ZINC000450787471	GD	On-Demand	Bother	CASP3	26	40
C[C@H]1CN(c2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])CC(=O)N1	ZINC000450787472	GD	On-Demand	Bother	CASP3	26	40
CCCOc1cccc(CSc2nnc(-c3sc(C)nc3C)o2)c1	ZINC000450787475	FJ	On-Demand	Anodyne	GSK3B	18	40
CCCOc1cccc(CSc2nnc(-c3sc(C)nc3C)o2)c1	ZINC000450787475	FJ	On-Demand	Anodyne	GSK3A	42	37
CCCOc1cccc(CSc2nnc(-c3sc(C)nc3C)o2)c1	ZINC000450787475	FJ	On-Demand	Anodyne	TERT	24	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3C#N)CC2)cc1	ZINC000450787480	GH	On-Demand	Mild	DRD4	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3C#N)CC2)cc1	ZINC000450787480	GH	On-Demand	Mild	LTA4H	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3C#N)CC2)cc1	ZINC000450787480	GH	On-Demand	Mild	CSNK2A1	66	37
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3C#N)CC2)cc1	ZINC000450787480	GH	On-Demand	Mild	SSTR5	69	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3C#N)CC2)cc1	ZINC000450787480	GH	On-Demand	Mild	MLNR	45	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3C#N)CC2)cc1	ZINC000450787480	GH	On-Demand	Mild	MCHR1	49	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccsc34)CC2)cc1	ZINC000450787486	GH	On-Demand	Anodyne	LTA4H	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccsc34)CC2)cc1	ZINC000450787486	GH	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4ccsc34)CC2)cc1	ZINC000450787486	GH	On-Demand	Anodyne	SSTR5	65	46
CS(=O)(=O)c1cccc(CSc2ccc(C(=O)N3CCCC3)cn2)c1	ZINC000450787492	GG	On-Demand	Anodyne	HPGD	42	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](O)[C@@H](C)C1	ZINC000450787499	DF	On-Demand	Anodyne	CACNA1B	49	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](O)[C@@H](C)C1	ZINC000450787499	DF	On-Demand	Anodyne	LIPG	53	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](O)[C@H](C)C1	ZINC000450787500	DF	On-Demand	Anodyne	CACNA1B	49	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](O)[C@H](C)C1	ZINC000450787500	DF	On-Demand	Anodyne	LIPG	53	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](O)[C@H](C)C1	ZINC000450787501	DF	On-Demand	Anodyne	CACNA1B	49	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](O)[C@H](C)C1	ZINC000450787501	DF	On-Demand	Anodyne	LIPG	53	36
NC(=O)c1coc(CNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450787508	FD	On-Demand	Anodyne	STAT6	46	34
C[C@@]1(CNC(=O)C2(C(=O)C3CC3)CC2)CCCN1Cc1ccccc1	ZINC000450787510	EF	On-Demand	Anodyne	NPFFR1	46	35
C[C@]1(CNC(=O)C2(C(=O)C3CC3)CC2)CCCN1Cc1ccccc1	ZINC000450787511	EF	On-Demand	Anodyne	NPFFR1	46	35
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450787512	FE	On-Demand	Anodyne	CACNA1G	39	42
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450787513	FE	On-Demand	Anodyne	CACNA1G	39	42
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450787514	FE	On-Demand	Anodyne	CACNA1G	39	42
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450787515	FE	On-Demand	Anodyne	CACNA1G	39	42
CC(F)(F)c1ccc(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)cn1	ZINC000450787518	FE	On-Demand	Anodyne	SFRP1	63	42
CC(F)(F)c1ccc(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)cn1	ZINC000450787518	FE	On-Demand	Anodyne	L3MBTL3	44	38
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)cn1	ZINC000450787519	FE	On-Demand	Anodyne	SFRP1	63	42
CC(F)(F)c1ccc(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)cn1	ZINC000450787519	FE	On-Demand	Anodyne	L3MBTL3	44	38
COc1cccc(OCCC(=O)NC[C@@H]2CCCCS2(=O)=O)c1	ZINC000450787520	ED	On-Demand	Anodyne	MTNR1A	38	45
COc1cccc(OCCC(=O)NC[C@H]2CCCCS2(=O)=O)c1	ZINC000450787521	ED	On-Demand	Anodyne	MTNR1A	38	45
Cc1nc(N2C[C@H](C)N(CCO)[C@H](C)C2)ccc1Br	ZINC000450787523	EE	On-Demand	Anodyne	SORD	42	35
C[C@H]1CN(c2ncccc2OCc2ccccc2)C[C@@H](C)N1CCO	ZINC000450787533	EF	On-Demand	Anodyne	PPIA	33	40
C[C@H]1CN(c2nc3ccccc3nc2N2CCOCC2)C[C@@H](C)N1CCO	ZINC000450787557	FD	On-Demand	Anodyne	PIK3CA	26	43
C[C@H]1CN(c2nc3ccccc3nc2N2CCOCC2)C[C@@H](C)N1CCO	ZINC000450787557	FD	On-Demand	Anodyne	PDE1B	0	41
C[C@H]1CN(c2nc3ccccc3nc2N2CCOCC2)C[C@@H](C)N1CCO	ZINC000450787557	FD	On-Demand	Anodyne	PIK3CD	55	38
CCCc1cc(C(=O)N(C)[C@@H]2CCCC[C@H]2O)no1	ZINC000450787558	CE	On-Demand	Anodyne	S1PR3	22	65
CC1(CO)CN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450787560	DG	On-Demand	Anodyne	ADRB3	0	50
Cc1cc(C)c(C(=O)N2CCC(Cn3cncn3)CC2)cc1Br	ZINC000450787588	GG	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C)c(C(=O)N2CCC(Cn3cncn3)CC2)cc1Br	ZINC000450787588	GG	On-Demand	Anodyne	L3MBTL3	19	43
CCOC(=O)C[C@@H](C)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450787608	DE	On-Demand	Anodyne	MTNR1A	34	47
CCOC(=O)C[C@@H](C)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450787608	DE	On-Demand	Anodyne	MTNR1B	40	43
CCOC(=O)C[C@H](C)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450787609	DE	On-Demand	Anodyne	MTNR1A	34	47
CCOC(=O)C[C@H](C)N(C)C(=O)CCOc1cccc(OC)c1	ZINC000450787609	DE	On-Demand	Anodyne	MTNR1B	40	43
Cc1cccc2c1C[C@@H](C(=O)Nc1ccc(C(=O)N3CCOCC3)c(F)c1)O2	ZINC000450787612	GF	On-Demand	Anodyne	EPHX2	17	52
Cc1cccc2c1C[C@H](C(=O)Nc1ccc(C(=O)N3CCOCC3)c(F)c1)O2	ZINC000450787613	GF	On-Demand	Anodyne	EPHX2	17	52
c1nc(N2C[C@H](C3CC3)[C@H]2C2CC2)c2cc[nH]c2n1	ZINC000450787614	CF	On-Demand	Anodyne	AKT2	40	43
c1nc(N2C[C@H](C3CC3)[C@H]2C2CC2)c2cc[nH]c2n1	ZINC000450787614	CF	On-Demand	Anodyne	AKT1	32	42
c1nc(N2C[C@H](C3CC3)[C@@H]2C2CC2)c2cc[nH]c2n1	ZINC000450787616	CF	On-Demand	Anodyne	AKT2	40	43
c1nc(N2C[C@H](C3CC3)[C@@H]2C2CC2)c2cc[nH]c2n1	ZINC000450787616	CF	On-Demand	Anodyne	AKT1	32	42
c1nc(N2C[C@@H](C3CC3)[C@H]2C2CC2)c2cc[nH]c2n1	ZINC000450787618	CF	On-Demand	Anodyne	AKT2	40	43
c1nc(N2C[C@@H](C3CC3)[C@H]2C2CC2)c2cc[nH]c2n1	ZINC000450787618	CF	On-Demand	Anodyne	AKT1	32	42
c1nc(N2C[C@@H](C3CC3)[C@@H]2C2CC2)c2cc[nH]c2n1	ZINC000450787621	CF	On-Demand	Anodyne	AKT2	40	43
c1nc(N2C[C@@H](C3CC3)[C@@H]2C2CC2)c2cc[nH]c2n1	ZINC000450787621	CF	On-Demand	Anodyne	AKT1	32	42
CC[S@](=O)CC(=O)Nc1ccc(C)c(OCc2cccc(Cl)c2)c1	ZINC000450787623	FH	On-Demand	Anodyne	PTGER1	41	43
CC[S@@](=O)CC(=O)Nc1ccc(C)c(OCc2cccc(Cl)c2)c1	ZINC000450787624	FH	On-Demand	Anodyne	PTGER1	41	43
CC1(CO)CN(c2c(C#N)cnc3c(F)ccc(Cl)c23)C1	ZINC000450787639	DF	On-Demand	Mild	MAP3K8	45	31
CC(=O)Nc1ncccc1NC(=O)C(CC(C)C)CC(C)C	ZINC000450787643	DH	On-Demand	Anodyne	ANPEP	23	40
CC(=O)N[C@H](C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1)C(C)(C)C	ZINC000450787644	GD	On-Demand	Anodyne	NPY2R	43	39
CC(=O)N[C@H](C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1)C(C)(C)C	ZINC000450787644	GD	On-Demand	Anodyne	EPHX2	16	58
CC1(CO)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450787654	CE	On-Demand	Anodyne	PDGFRB	30	40
CC1(CO)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450787654	CE	On-Demand	Anodyne	AKT1	27	42
CC1(CO)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450787654	CE	On-Demand	Anodyne	HTT	0	46
Cc1sccc1C(=O)N1CCN(CC(C)C)C(=O)C1	ZINC000450787656	CD	On-Demand	Anodyne	P2RX7	18	61
Cc1cccc(Cl)c1C(=O)Nc1nc2c(s1)CN(C(C)C)CC2	ZINC000450787666	EI	On-Demand	Anodyne	F10	17	45
CSc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450787670	EH	On-Demand	Anodyne	PRNP	51	40
CSc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450787670	EH	On-Demand	Anodyne	HDAC1	33	42
CSc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450787670	EH	On-Demand	Anodyne	DGAT1	38	41
CSc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450787670	EH	On-Demand	Anodyne	HPGDS	18	43
COC(=O)c1ccc([N+](=O)[O-])c(N2CC(C)(CO)C2)c1	ZINC000450787704	CD	On-Demand	Bother	CACNA1D	41	34
COCC(COC)Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450787739	GF	On-Demand	Anodyne	PDS	30	69
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1cnccc1C	ZINC000450787740	EG	On-Demand	Bother	CACNA1D	42	33
CC[C@@H](Nc1cc(NCC2CC2)ncn1)[C@H](C)O	ZINC000450787749	CD	On-Demand	Anodyne	GPR39	0	43
CC[C@H](Nc1cc(NCC2CC2)ncn1)[C@@H](C)O	ZINC000450787750	CD	On-Demand	Anodyne	GPR39	0	43
CC[C@@H](Nc1cc(NCC2CC2)ncn1)[C@@H](C)O	ZINC000450787759	CD	On-Demand	Anodyne	GPR39	0	43
COCC(=O)N1CCc2cc(NC(=O)c3ccnc(OC(F)F)c3)ccc21	ZINC000450787763	GE	On-Demand	Anodyne	EIF2AK3	46	38
CC[C@H](Nc1cc(NCC2CC2)ncn1)[C@H](C)O	ZINC000450787776	CD	On-Demand	Anodyne	GPR39	0	43
COc1ccc2c(c1)CN(c1ncnc3sc4c(c13)CCC4)CCO2	ZINC000450787787	FH	On-Demand	Anodyne	RBP4	18	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC2(CCCC2)C1	ZINC000450787792	DF	On-Demand	Anodyne	CCKBR	40	41
CC[C@@H](Nc1ncnc2cc(Cl)ccc12)[C@H](C)O	ZINC000450787840	CF	On-Demand	Anodyne	RBP_CHICK	0	43
CC[C@H](Nc1ncnc2cc(Cl)ccc12)[C@@H](C)O	ZINC000450787841	CF	On-Demand	Anodyne	RBP_CHICK	0	43
CC[C@H](Nc1ncnc2cc(Cl)ccc12)[C@H](C)O	ZINC000450787842	CF	On-Demand	Anodyne	RBP_CHICK	0	43
CC[C@@H](Nc1ncnc2cc(Cl)ccc12)[C@@H](C)O	ZINC000450787843	CF	On-Demand	Anodyne	RBP_CHICK	0	43
C[C@H]1CN(c2ncccc2C(F)(F)F)C[C@@H](C)N1CCO	ZINC000450787881	DD	On-Demand	Anodyne	TRPV1	34	49
CCc1cc(NCCN2C[C@@H]3CC[C@H](C2)O3)n2ncnc2n1	ZINC000450787883	DC	On-Demand	Anodyne	DHOD	0	47
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncccc2F)CC1	ZINC000450787886	GG	On-Demand	Anodyne	GPR119	25	43
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncccc2F)CC1	ZINC000450787890	GG	On-Demand	Anodyne	GPR119	25	43
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787905	GF	On-Demand	Anodyne	AKT2	16	47
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787905	GF	On-Demand	Anodyne	AKT3	18	47
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787905	GF	On-Demand	Anodyne	JAK1	50	37
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787905	GF	On-Demand	Anodyne	JAK2	16	41
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787905	GF	On-Demand	Anodyne	ROCK2	28	47
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787905	GF	On-Demand	Anodyne	AKT1	0	47
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787907	GF	On-Demand	Anodyne	AKT2	16	47
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787907	GF	On-Demand	Anodyne	AKT3	18	47
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787907	GF	On-Demand	Anodyne	JAK1	50	37
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787907	GF	On-Demand	Anodyne	JAK2	16	41
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787907	GF	On-Demand	Anodyne	ROCK2	28	47
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1	ZINC000450787907	GF	On-Demand	Anodyne	AKT1	0	47
CCS(=O)(=O)c1ccc(CN2CCN(C[C@H](C)O)CC2)cc1	ZINC000450787908	EC	On-Demand	Anodyne	RORC	43	32
COC(=O)[C@]1(C)CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450787910	EF	On-Demand	Anodyne	SLC12A5	63	38
C[C@H]1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H](C)N1CCO	ZINC000450787911	EE	On-Demand	Bother	SLC6A4	16	57
COC(=O)[C@@]1(C)CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450787913	EF	On-Demand	Anodyne	SLC12A5	63	38
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)ccc21	ZINC000450787917	EE	On-Demand	Anodyne	EIF2AK3	41	35
O=C(Nc1cc(CNC(=O)[C@H](O)C2CCC2)ccn1)[C@@H](O)C1CCC1	ZINC000450787944	EC	On-Demand	Anodyne	TYK2	47	35
O=C(NCc1ccnc(NC(=O)[C@@H](O)C2CCC2)c1)[C@@H](O)C1CCC1	ZINC000450787945	EC	On-Demand	Anodyne	TYK2	47	35
O=C(NCc1ccnc(NC(=O)[C@H](O)C2CCC2)c1)[C@H](O)C1CCC1	ZINC000450787946	EC	On-Demand	Anodyne	TYK2	47	35
O=C(NCc1ccnc(NC(=O)[C@H](O)C2CCC2)c1)[C@@H](O)C1CCC1	ZINC000450787947	EC	On-Demand	Anodyne	TYK2	47	35
CCOc1ccc(NC(=O)c2cnc(C3CC3)nc2)cc1Br	ZINC000450787960	FH	On-Demand	Anodyne	HTR2A	18	40
CCOc1ccc(NC(=O)c2cnc(C3CC3)nc2)cc1Br	ZINC000450787960	FH	On-Demand	Anodyne	P4HTM	0	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1nccc2sccc12	ZINC000450787964	EH	On-Demand	Anodyne	HPN	68	34
CCOc1ccc(NC(=O)c2c(C3CC3)noc2C)cc1Br	ZINC000450787968	FI	On-Demand	Anodyne	TYK2	40	33
CCOc1ccc(NC(=O)c2cc3n(n2)CCCC3)cc1Br	ZINC000450787971	FH	On-Demand	Anodyne	HTR2A	27	40
O=C(N[C@H]1CCn2ccnc2C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450787974	FF	On-Demand	Bother	LIPG	42	33
O=C(N[C@@H]1CCn2ccnc2C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450787975	FF	On-Demand	Bother	LIPG	42	33
COCC(COC)Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl	ZINC000450787982	GG	On-Demand	Anodyne	CRHR1	0	40
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ccc(C#N)cn2)CC1	ZINC000450787987	GE	On-Demand	Mild	GPR119	20	47
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ccc(C#N)cn2)CC1	ZINC000450787988	GE	On-Demand	Mild	GPR119	20	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	CHRM2	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	TSHR	48	33
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	DRD4	48	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	ACHE	30	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	CHRM3	31	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	SSTR5	75	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	CCR3	48	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	GRM4	34	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	MLNR	45	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	CXCR3	44	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	MCHR1	62	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	MGEA5	32	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	NOD2	44	39
CC(=O)Nc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000450787998	DG	On-Demand	Anodyne	GPR39	0	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	DRD4	32	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	ACHE	20	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	LTA4H	25	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	CSNK2A1	67	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	SIGMAR1	28	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	SSTR5	73	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	CCR3	54	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	UTS2R	20	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	MLNR	55	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	CCR2	25	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	CXCR3	38	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)c(Cl)c3)CC2)cc1	ZINC000450788003	GI	On-Demand	Mild	MCHR1	64	48
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ncn1	ZINC000450788032	FF	On-Demand	Anodyne	TSHR	61	33
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ncn1	ZINC000450788032	FF	On-Demand	Anodyne	PDGFRB	40	36
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ncn1	ZINC000450788032	FF	On-Demand	Anodyne	LTA4H	23	43
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ncn1	ZINC000450788032	FF	On-Demand	Anodyne	SIGMAR1	26	41
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ncn1	ZINC000450788032	FF	On-Demand	Anodyne	SSTR5	81	56
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ncn1	ZINC000450788032	FF	On-Demand	Anodyne	CCR3	44	37
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ncn1	ZINC000450788032	FF	On-Demand	Anodyne	MCHR1	50	44
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ncn1	ZINC000450788032	FF	On-Demand	Anodyne	NOD2	40	36
C[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788037	EH	On-Demand	Mild	ACACA	46	37
C[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788037	EH	On-Demand	Mild	CTSF	47	35
C[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788037	EH	On-Demand	Mild	MCHR1	34	44
Clc1cccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)c1	ZINC000450788039	DH	On-Demand	Anodyne	DRD4	21	45
Clc1cccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)c1	ZINC000450788039	DH	On-Demand	Anodyne	SIGMAR1	15	44
Clc1cccc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)c1	ZINC000450788040	DH	On-Demand	Anodyne	DRD4	21	45
Clc1cccc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)c1	ZINC000450788040	DH	On-Demand	Anodyne	SIGMAR1	15	44
COC(=O)C(C)(C)N1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)CC1	ZINC000450788045	GC	On-Demand	Anodyne	DRD4	41	33
COC(=O)C(C)(C)N1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)CC1	ZINC000450788045	GC	On-Demand	Anodyne	ESRRA	21	42
COC(=O)C(C)(C)N1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)CC1	ZINC000450788045	GC	On-Demand	Anodyne	CCKAR	32	47
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788046	EH	On-Demand	Mild	ACACA	46	37
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788046	EH	On-Demand	Mild	CTSF	47	35
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788046	EH	On-Demand	Mild	MCHR1	34	44
C[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788048	EH	On-Demand	Mild	ACACA	46	37
C[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788048	EH	On-Demand	Mild	CTSF	47	35
C[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788048	EH	On-Demand	Mild	MCHR1	34	44
CC(=O)Nc1ccc(CN2CCC(Nc3c([N+](=O)[O-])c(C)nn3C)CC2)cc1	ZINC000450788053	GF	On-Demand	Bother	SIGMAR1	19	42
CC(=O)Nc1ccc(CN2CCC(Nc3c([N+](=O)[O-])c(C)nn3C)CC2)cc1	ZINC000450788053	GF	On-Demand	Bother	SSTR5	48	41
CC(=O)Nc1ccc(CN2CCC(Nc3c([N+](=O)[O-])c(C)nn3C)CC2)cc1	ZINC000450788053	GF	On-Demand	Bother	MCHR1	30	41
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788054	EH	On-Demand	Mild	ACACA	46	37
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788054	EH	On-Demand	Mild	CTSF	47	35
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450788054	EH	On-Demand	Mild	MCHR1	34	44
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	DRD2	20	43
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	ACHE	23	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	DRD3	0	43
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	CHRM3	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	LTA4H	23	45
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	CSNK2A1	69	39
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	SIGMAR1	33	44
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	SSTR5	54	40
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	CCR3	50	41
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	MLNR	47	41
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	CCR2	20	45
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	CXCR3	40	39
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	MCHR1	59	43
CC(=O)Nc1ccc(CN2CCC(Nc3c(Cl)cccc3C#N)CC2)cc1	ZINC000450788061	GI	On-Demand	Mild	NOD2	40	34
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)n3)CC2)cc1	ZINC000450788064	EF	On-Demand	Mild	LTA4H	24	45
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)n3)CC2)cc1	ZINC000450788064	EF	On-Demand	Mild	CSNK2A1	68	37
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)n3)CC2)cc1	ZINC000450788064	EF	On-Demand	Mild	SIGMAR1	30	41
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)n3)CC2)cc1	ZINC000450788064	EF	On-Demand	Mild	CCR3	43	38
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)n3)CC2)cc1	ZINC000450788064	EF	On-Demand	Mild	MLNR	42	41
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)n3)CC2)cc1	ZINC000450788064	EF	On-Demand	Mild	MCHR1	53	46
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C#N)n3)CC2)cc1	ZINC000450788064	EF	On-Demand	Mild	NOD2	40	35
CN(CCN1CCN(c2cc(C3CC3)[nH]n2)CC1)Cc1ccccc1	ZINC000450788066	EF	On-Demand	Anodyne	DRD2	29	46
CN(CCN1CCN(c2cc(C3CC3)[nH]n2)CC1)Cc1ccccc1	ZINC000450788066	EF	On-Demand	Anodyne	SIGMAR1	28	43
CN(CCN1CCN(c2cc(C3CC3)[nH]n2)CC1)Cc1ccccc1	ZINC000450788066	EF	On-Demand	Anodyne	PKNB	47	38
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)s3)CC2)cc1	ZINC000450788069	EG	On-Demand	Anodyne	SIGMAR1	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)s3)CC2)cc1	ZINC000450788069	EG	On-Demand	Anodyne	SSTR5	67	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)s3)CC2)cc1	ZINC000450788069	EG	On-Demand	Anodyne	MCHR1	41	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)s3)CC2)cc1	ZINC000450788069	EG	On-Demand	Anodyne	MGEA5	37	44
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(OCC(C)C)n3)CC2)cc1	ZINC000450788071	GH	On-Demand	Anodyne	LTA4H	23	40
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(OCC(C)C)n3)CC2)cc1	ZINC000450788071	GH	On-Demand	Anodyne	SSTR5	81	44
CC(=O)Nc1ccc(CN2CCC(Nc3cncc(OCC(C)C)n3)CC2)cc1	ZINC000450788071	GH	On-Demand	Anodyne	MCHR1	34	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450788078	EI	On-Demand	Anodyne	ATF1	53	34
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450788078	EI	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450788078	EI	On-Demand	Anodyne	MTTP	52	35
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450788078	EI	On-Demand	Anodyne	NFKB1	49	34
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450788078	EI	On-Demand	Anodyne	PANC	45	33
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450788080	EI	On-Demand	Anodyne	ATF1	53	34
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450788080	EI	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450788080	EI	On-Demand	Anodyne	MTTP	52	35
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450788080	EI	On-Demand	Anodyne	NFKB1	49	34
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450788080	EI	On-Demand	Anodyne	PANC	45	33
COC(=O)C(C)(C)N1CCN(C(=O)c2ocnc2-c2ccccc2)CC1	ZINC000450788082	FE	On-Demand	Anodyne	SMO	27	40
NC(=O)c1ncn([C@@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)n1	ZINC000450788083	FF	On-Demand	Anodyne	SLC6A1	46	35
NC(=O)c1ncn([C@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)n1	ZINC000450788084	FF	On-Demand	Anodyne	SLC6A1	46	35
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3F)CC2)cc1	ZINC000450788088	FG	On-Demand	Anodyne	LTA4H	19	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3F)CC2)cc1	ZINC000450788088	FG	On-Demand	Anodyne	SIGMAR1	30	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3F)CC2)cc1	ZINC000450788088	FG	On-Demand	Anodyne	SSTR5	67	45
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3F)CC2)cc1	ZINC000450788088	FG	On-Demand	Anodyne	CCR3	40	39
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3F)CC2)cc1	ZINC000450788088	FG	On-Demand	Anodyne	MLNR	43	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3F)CC2)cc1	ZINC000450788088	FG	On-Demand	Anodyne	MCHR1	55	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3F)CC2)cc1	ZINC000450788088	FG	On-Demand	Anodyne	AXL	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)nc(C)c3F)CC2)cc1	ZINC000450788088	FG	On-Demand	Anodyne	MERTK	15	40
COC(=O)C(C)(C)N1CCN(C(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC000450788091	ED	On-Demand	Anodyne	HRH4	27	67
C[C@H](C1CC1)n1cc(NC(=O)CCCC(=O)C(C)(C)C)cn1	ZINC000450788095	DH	On-Demand	Anodyne	PANC	45	31
C[C@@H](C1CC1)n1cc(NC(=O)CCCC(=O)C(C)(C)C)cn1	ZINC000450788097	DH	On-Demand	Anodyne	PANC	45	31
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(C)c(Cl)c2Cl)CC1	ZINC000450788105	FG	On-Demand	Anodyne	P2RX7	45	44
COc1ccc(F)cc1CNC(=O)C1(CF)CCOCC1	ZINC000450788106	CE	On-Demand	Anodyne	PPARD	16	41
C[C@H](C1CC1)n1cc(NC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cn1	ZINC000450788107	DH	On-Demand	Anodyne	ITK	58	39
C[C@@H](C1CC1)n1cc(NC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cn1	ZINC000450788108	DH	On-Demand	Anodyne	ITK	58	39
COc1ccc(F)cc1CNC(=O)CCCC(C)C	ZINC000450788109	CG	On-Demand	Anodyne	GRIN2B	27	43
COc1ccc(F)cc1CNC(=O)CCCC(C)C	ZINC000450788109	CG	On-Demand	Anodyne	HTR7	19	43
COc1ccc(F)cc1CNC(=O)CCCC(C)C	ZINC000450788109	CG	On-Demand	Anodyne	TRPV1	17	42
COc1ccc(F)cc1CNC(=O)CCCC(C)C	ZINC000450788109	CG	On-Demand	Anodyne	P2RX7	48	40
COc1ccc(F)cc1CNC(=O)CCCC(C)C	ZINC000450788109	CG	On-Demand	Anodyne	PPARD	19	41
CC(=O)Nc1ccc(CN2CCC(N=c3nn[nH]n3-c3ccccc3)CC2)cc1	ZINC000450788112	GE	On-Demand	Anodyne	ACHE	25	42
CC(=O)Nc1ccc(CN2CCC(N=c3nn[nH]n3-c3ccccc3)CC2)cc1	ZINC000450788112	GE	On-Demand	Anodyne	DRD3	0	41
CC(=O)Nc1ccc(CN2CCC(N=c3nn[nH]n3-c3ccccc3)CC2)cc1	ZINC000450788112	GE	On-Demand	Anodyne	LTA4H	15	40
CC(=O)Nc1ccc(CN2CCC(N=c3nn[nH]n3-c3ccccc3)CC2)cc1	ZINC000450788112	GE	On-Demand	Anodyne	SIGMAR1	28	43
CC(=O)Nc1ccc(CN2CCC(N=c3nn[nH]n3-c3ccccc3)CC2)cc1	ZINC000450788112	GE	On-Demand	Anodyne	MCHR1	24	40
CC(=O)Nc1ccc(CN2CCC(N=c3nn[nH]n3-c3ccccc3)CC2)cc1	ZINC000450788112	GE	On-Demand	Anodyne	NOD2	41	35
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	DRD4	37	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	ACHE	18	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	DRD3	0	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	KCNH2	15	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	LTA4H	26	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	CSNK2A1	44	37
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	SIGMAR1	31	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	SSTR5	86	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	CCR1	19	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	CCR3	52	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	UTS2R	20	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	MLNR	45	39
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	FAAH	20	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	CCR2	26	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	EPHX2	30	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	CXCR3	59	49
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	MCHR1	76	51
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	CACNA1G	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	AXL	32	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	HIPK2	41	34
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	TYRO3	34	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(Cl)cc3Cl)CC2)cc1	ZINC000450788113	GI	On-Demand	Anodyne	MERTK	36	42
CC(=O)N[C@H](C(=O)NCc1ccc(Cl)cc1F)C(C)(C)C	ZINC000450788114	DF	On-Demand	Anodyne	TRPV1	67	36
CC(=O)N[C@H](C(=O)NCc1ccc(Cl)cc1F)C(C)(C)C	ZINC000450788114	DF	On-Demand	Anodyne	BDKRB1	0	42
O=C(c1ccc(SC[C@@H]2CCC(F)(F)C2)nc1)N1CCCC1	ZINC000450788127	EH	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(SC[C@@H]2CCC(F)(F)C2)nc1)N1CCCC1	ZINC000450788127	EH	On-Demand	Anodyne	L3MBTL3	67	41
O=C(c1ccc(SC[C@H]2CCC(F)(F)C2)nc1)N1CCCC1	ZINC000450788128	EH	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(SC[C@H]2CCC(F)(F)C2)nc1)N1CCCC1	ZINC000450788128	EH	On-Demand	Anodyne	L3MBTL3	67	41
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncccn2)CC1	ZINC000450788139	FF	On-Demand	Anodyne	GPR119	15	42
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncccn2)CC1	ZINC000450788140	FF	On-Demand	Anodyne	GPR119	15	42
CC(C)OC(C)(C)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450788149	EG	On-Demand	Anodyne	NPFFR1	48	37
CC(C)OC(C)(C)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450788149	EG	On-Demand	Anodyne	SLC12A5	47	33
CC(C)OC(C)(C)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450788150	EG	On-Demand	Anodyne	NPFFR1	48	37
CC(C)OC(C)(C)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450788150	EG	On-Demand	Anodyne	SLC12A5	47	33
C[C@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@@H](C)N1CCO	ZINC000450788155	ED	On-Demand	Anodyne	SORD	74	45
CN(C)CCNS(=O)(=O)c1ccc(N[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788156	GD	On-Demand	Bother	BDKRB1	0	41
CN(C)CCNS(=O)(=O)c1ccc(N[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788156	GD	On-Demand	Bother	BCL2L1	115	38
CN(C)CCNS(=O)(=O)c1ccc(N[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788156	GD	On-Demand	Bother	BCL2	98	35
CN(C)CCNS(=O)(=O)c1ccc(N[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788156	GD	On-Demand	Bother	BCL2L2	50	38
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788157	GD	On-Demand	Bother	BDKRB1	0	41
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788157	GD	On-Demand	Bother	BCL2L1	115	38
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788157	GD	On-Demand	Bother	BCL2	98	35
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788157	GD	On-Demand	Bother	BCL2L2	50	38
CCN(CC)S(=O)(=O)c1ccc(N[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788158	GF	On-Demand	Bother	BCL2L1	41	33
CCN(CC)S(=O)(=O)c1ccc(N[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788159	GF	On-Demand	Bother	BCL2L1	41	33
CC(=O)Nc1ncccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450788160	FF	On-Demand	Anodyne	G2YM83_BOTF4	67	34
Cc1nc(-c2ccc(OCCC[C@H](C)O)cc2)no1	ZINC000450788161	CF	On-Demand	Anodyne	PLA2G5	15	42
Cc1nc(-c2ccc(OCCC[C@@H](C)O)cc2)no1	ZINC000450788162	CF	On-Demand	Anodyne	PLA2G5	15	42
C[C@H]1CN(c2ccc(S(C)(=O)=O)cn2)C[C@@H](C)N1CCO	ZINC000450788166	DC	On-Demand	Anodyne	GPR119	15	41
CNS(=O)(=O)c1ccc(N2C[C@H](C)N(CCO)[C@H](C)C2)c(F)c1	ZINC000450788169	EC	On-Demand	Anodyne	SLC6A9	15	41
CN(C)CCNS(=O)(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450788172	FC	On-Demand	Bother	BDKRB1	0	43
CN(C)CCNS(=O)(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450788172	FC	On-Demand	Bother	BCL2L1	55	36
CN(C)CCNS(=O)(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450788172	FC	On-Demand	Bother	BCL2	60	32
CC(=O)Nc1ncccc1NC(=O)[C@H](O)C1CCC1	ZINC000450788174	CD	On-Demand	Anodyne	G2YM83_BOTF4	45	34
CC(=O)Nc1ncccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450788175	CD	On-Demand	Anodyne	G2YM83_BOTF4	45	34
C=CC(C)(C)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450788178	DG	On-Demand	Mild	NPFFR1	46	36
C=CC(C)(C)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450788179	DG	On-Demand	Mild	NPFFR1	46	36
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)c2cc3ccncc3s2)C1	ZINC000450788184	FE	On-Demand	Anodyne	NAMPT	18	51
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)c2cc3ccncc3s2)C1	ZINC000450788185	FE	On-Demand	Anodyne	NAMPT	18	51
CC(=O)Nc1ncccc1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450788187	GE	On-Demand	Anodyne	MAPK14	15	42
CCCc1cc(C(=O)Nc2cccnc2NC(C)=O)no1	ZINC000450788224	CE	On-Demand	Anodyne	G2YM83_BOTF4	71	36
COc1cc2nc(N[C@H]3CC34CCOCC4)nc(N)c2cc1OC	ZINC000450788225	EE	On-Demand	Anodyne	EHMT2	33	40
COc1cc2nc(N[C@@H]3CC34CCOCC4)nc(N)c2cc1OC	ZINC000450788226	EE	On-Demand	Anodyne	EHMT2	33	40
Cc1cnc(CCCC(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)o1	ZINC000450788228	GF	On-Demand	Anodyne	EPHX2	16	52
C[C@H]1C(=O)N(C)CCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450788229	FD	On-Demand	Mild	AR	20	41
CCOC[C@H](C)NC(=O)c1ocnc1-c1ccccc1	ZINC000450788231	CE	On-Demand	Anodyne	TACR3	42	34
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450788233	FD	On-Demand	Mild	AR	20	41
C[C@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450788234	FD	On-Demand	Mild	AR	20	41
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450788235	FD	On-Demand	Mild	AR	20	41
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H]2CCCN(C)[C@H]2C)c1	ZINC000450788238	EF	On-Demand	Anodyne	ACKR3	50	31
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H]2CCCN(C)[C@H]2C)c1	ZINC000450788239	EF	On-Demand	Anodyne	ACKR3	50	31
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H]2CCCN(C)[C@@H]2C)c1	ZINC000450788240	EF	On-Demand	Anodyne	ACKR3	50	31
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c1	ZINC000450788241	EF	On-Demand	Anodyne	ACKR3	50	31
Cc1ccc(NC(=O)c2ccc(N3CC(C)(CO)C3)c([N+](=O)[O-])c2)cc1	ZINC000450788248	FF	On-Demand	Bother	PRNP	45	34
Cc1ccc(NC(=O)c2ccc(N3CC(C)(CO)C3)c([N+](=O)[O-])c2)cc1	ZINC000450788248	FF	On-Demand	Bother	TAAR1	34	51
COc1cc(Br)c(C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1OC	ZINC000450788263	FF	On-Demand	Anodyne	DRD2	43	39
COc1cc(Br)c(C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1OC	ZINC000450788263	FF	On-Demand	Anodyne	HTR3A	28	40
COc1cc(Br)c(C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1OC	ZINC000450788263	FF	On-Demand	Anodyne	HTR4	53	42
COc1cc(Br)c(C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1OC	ZINC000450788265	FF	On-Demand	Anodyne	DRD2	43	39
COc1cc(Br)c(C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1OC	ZINC000450788265	FF	On-Demand	Anodyne	HTR3A	28	40
COc1cc(Br)c(C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1OC	ZINC000450788265	FF	On-Demand	Anodyne	HTR4	53	42
COc1cc(Br)c(C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1OC	ZINC000450788267	FF	On-Demand	Anodyne	DRD2	43	39
COc1cc(Br)c(C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1OC	ZINC000450788267	FF	On-Demand	Anodyne	HTR3A	28	40
COc1cc(Br)c(C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1OC	ZINC000450788267	FF	On-Demand	Anodyne	HTR4	53	42
COc1cc(Br)c(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1OC	ZINC000450788268	FF	On-Demand	Anodyne	DRD2	43	39
COc1cc(Br)c(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1OC	ZINC000450788268	FF	On-Demand	Anodyne	HTR3A	28	40
COc1cc(Br)c(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1OC	ZINC000450788268	FF	On-Demand	Anodyne	HTR4	53	42
CC1(CO)CN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C1	ZINC000450788286	DD	On-Demand	Anodyne	MRGPRX1	33	41
CC1(CO)CN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C1	ZINC000450788286	DD	On-Demand	Anodyne	NPBWR1	46	43
Cc1nn(C)cc1CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450788294	EE	On-Demand	Anodyne	NPFFR1	46	39
Cc1nn(C)cc1CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450788300	EE	On-Demand	Anodyne	NPFFR1	46	39
CCOC[C@H](C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450788321	DD	On-Demand	Anodyne	PDE4D	15	41
CCOC[C@H](C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450788323	DD	On-Demand	Anodyne	PDE4D	15	41
CCNC(=O)c1ccc(N2C[C@H](C)N(CCO)[C@H](C)C2)nn1	ZINC000450788334	DC	On-Demand	Anodyne	SCD1	43	42
COc1ccc(-c2noc(N3C[C@H](C)N(CCO)[C@H](C)C3)n2)cc1	ZINC000450788337	ED	On-Demand	Anodyne	S1PR1	15	41
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@@H](C)N1CCO	ZINC000450788349	DE	On-Demand	Anodyne	HRP1_PLAFA	50	32
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@@H](C)N1CCO	ZINC000450788349	DE	On-Demand	Anodyne	PDE3B	52	34
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@@H](C)N1CCO	ZINC000450788349	DE	On-Demand	Anodyne	HTT	0	43
CC(F)(F)C(C)(C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450788350	EE	On-Demand	Anodyne	CYNT	20	44
CC(F)(F)C(C)(C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450788350	EE	On-Demand	Anodyne	RORC	16	40
C[C@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)N1CCO	ZINC000450788379	EF	On-Demand	Bother	LIPG	46	36
N#Cc1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)cc1Cl	ZINC000450788381	CE	On-Demand	Mild	MAP3K8	27	43
COCC(=O)N1CCc2cc(NC(=O)c3cc(C)c(C(N)=O)cn3)ccc21	ZINC000450788382	FD	On-Demand	Anodyne	AVPR2	55	40
COCC(=O)N1CCc2cc(NC(=O)c3cc(C)c(C(N)=O)cn3)ccc21	ZINC000450788382	FD	On-Demand	Anodyne	EIF2AK3	76	39
C[C@H]1CN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C[C@@H](C)N1CCO	ZINC000450788388	GE	On-Demand	Anodyne	CXCR3	35	41
COCC(COC)Nc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450788390	DE	On-Demand	Mild	MAP3K8	50	32
CCOc1ccc(NC(=O)CCCn2nc(C)nc2C)cc1Br	ZINC000450788400	GG	On-Demand	Anodyne	ENPP1	62	35
COCC(COC)Nc1c(Cl)cc([N+](=O)[O-])cc1C(=O)OC	ZINC000450788401	EE	On-Demand	Bother	CACNA1D	61	35
COc1ccc(OC(F)(F)F)c(C(=O)N2CC3(CCCC3)C2)c1	ZINC000450788409	EH	On-Demand	Anodyne	EPHX2	26	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(C#N)cn3)CC2)cc1	ZINC000450788418	FE	On-Demand	Mild	LTA4H	28	43
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(C#N)cn3)CC2)cc1	ZINC000450788418	FE	On-Demand	Mild	CSNK2A1	62	35
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(C#N)cn3)CC2)cc1	ZINC000450788418	FE	On-Demand	Mild	SSTR5	73	43
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(C#N)cn3)CC2)cc1	ZINC000450788418	FE	On-Demand	Mild	MLNR	40	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(C#N)cn3)CC2)cc1	ZINC000450788418	FE	On-Demand	Mild	CHEK1	20	51
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(C#N)cn3)CC2)cc1	ZINC000450788418	FE	On-Demand	Mild	MCHR1	37	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(C#N)cn3)CC2)cc1	ZINC000450788418	FE	On-Demand	Mild	HIPK2	42	35
CC(=O)Nc1ccc(CN2CCC(N=c3cc[nH]c(C(N)=O)c3)CC2)cc1	ZINC000450788431	FD	On-Demand	Anodyne	MCHR1	31	40
CC[C@@H](Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450788439	ED	On-Demand	Bother	TAAR1	17	48
CC[C@H](Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450788440	ED	On-Demand	Bother	TAAR1	17	48
CC[C@@H](Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450788441	ED	On-Demand	Bother	TAAR1	17	48
CC[C@H](Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450788442	ED	On-Demand	Bother	TAAR1	17	48
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	DRD2	27	40
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	DRD4	0	50
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	HTR2A	26	49
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	HTR2C	23	49
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	SLC6A1	58	35
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	ERG2	19	40
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	CCR3	67	39
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	SLC18A3	0	40
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	HTR3B	0	45
NC(=O)c1ncn([C@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788475	FD	On-Demand	Anodyne	CYP2J2	48	34
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	DRD2	27	40
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	DRD4	0	50
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	HTR2A	26	49
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	HTR2C	23	49
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	SLC6A1	58	35
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	ERG2	19	40
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	CCR3	67	39
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	SLC18A3	0	40
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	HTR3B	0	45
NC(=O)c1ncn([C@@H]2CCCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450788477	FD	On-Demand	Anodyne	CYP2J2	48	34
COCC(=O)N1CCc2cc(NC(=O)c3ccc(C(F)(F)F)cc3C)ccc21	ZINC000450788487	GH	On-Demand	Anodyne	AVPR2	82	39
COCC(=O)N1CCc2cc(NC(=O)c3ccc(C(F)(F)F)cc3C)ccc21	ZINC000450788487	GH	On-Demand	Anodyne	MTTP	76	42
COCC(=O)N1CCc2cc(NC(=O)c3ccc(C(F)(F)F)cc3C)ccc21	ZINC000450788487	GH	On-Demand	Anodyne	LIPG	50	38
COCC(=O)N1CCc2cc(NC(=O)c3ccc(C(F)(F)F)cc3C)ccc21	ZINC000450788487	GH	On-Demand	Anodyne	SMO	25	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000450788489	FH	On-Demand	Bother	ACHE	21	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000450788489	FH	On-Demand	Bother	LTA4H	25	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000450788489	FH	On-Demand	Bother	SIGMAR1	38	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000450788489	FH	On-Demand	Bother	SSTR5	52	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000450788489	FH	On-Demand	Bother	CCR3	41	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000450788489	FH	On-Demand	Bother	MCHR1	41	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000450788489	FH	On-Demand	Bother	NOD2	41	35
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c3cnn4C)CC2)cc1	ZINC000450788498	GE	On-Demand	Anodyne	LTA4H	17	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c3cnn4C)CC2)cc1	ZINC000450788498	GE	On-Demand	Anodyne	SIGMAR1	17	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c3cnn4C)CC2)cc1	ZINC000450788498	GE	On-Demand	Anodyne	SSTR5	65	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4c3cnn4C)CC2)cc1	ZINC000450788498	GE	On-Demand	Anodyne	MCHR1	40	40
Cc1nc([C@@H]2CCCN2C(=O)c2cc3ccncc3s2)cs1	ZINC000450788505	EI	On-Demand	Anodyne	CPT1A	24	40
CC[C@H](Nc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450788506	FD	On-Demand	Bother	TAAR1	20	47
CC[C@H](Nc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450788507	FD	On-Demand	Bother	TAAR1	20	47
CC[C@H](Nc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450788509	FD	On-Demand	Bother	TAAR1	20	47
CC[C@H](Nc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450788511	FD	On-Demand	Bother	TAAR1	20	47
COCC(COC)Nc1cncc(OCc2cccc(Cl)c2)n1	ZINC000450788522	EF	On-Demand	Anodyne	MAOB	22	46
O=C(NC1CN(C(=O)c2ccsc2Br)C1)C1CC1	ZINC000450788523	ED	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(S(=O)(=O)c2ccc(NCCN3C[C@@H]4CC[C@H](C3)O4)nc2)CC1	ZINC000450788524	GB	On-Demand	Anodyne	GCKR	62	35
CO[C@@H]1CCC[C@H]1Nc1ncnc2ccc(I)cc12	ZINC000450788543	FG	On-Demand	Anodyne	CD38	65	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	DRD4	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	ACHE	23	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	LTA4H	29	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	SIGMAR1	28	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	SSTR5	88	51
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	CCR3	41	36
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	UTS2R	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	MCHR1	59	48
CC(=O)Nc1ccc(CN2CCC(Nc3cc(NCC4CC4)ncn3)CC2)cc1	ZINC000450788548	GG	On-Demand	Anodyne	CACNA1I	47	39
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	DRD4	26	46
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	ACHE	24	41
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	LTA4H	29	45
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	SIGMAR1	27	44
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	SSTR5	78	43
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	CCR3	46	40
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	MLNR	46	42
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	CCR2	25	51
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	CXCR3	34	41
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	MCHR1	71	48
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C(F)(F)F)n3)CC2)cc1	ZINC000450788558	GI	On-Demand	Anodyne	NOD2	40	34
CC(=O)c1cccc(CSc2ccc(C(=O)N3CCCC3)cn2)c1	ZINC000450788566	EH	On-Demand	Anodyne	HPGD	46	37
CCc1ncnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1F	ZINC000450788568	FG	On-Demand	Anodyne	SSTR5	66	47
CCc1ncnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1F	ZINC000450788568	FG	On-Demand	Anodyne	AXL	22	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cn3)CC2)cc1	ZINC000450788580	EE	On-Demand	Mild	LTA4H	18	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cn3)CC2)cc1	ZINC000450788580	EE	On-Demand	Mild	CSNK2A1	65	36
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cn3)CC2)cc1	ZINC000450788580	EE	On-Demand	Mild	SSTR5	62	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cn3)CC2)cc1	ZINC000450788580	EE	On-Demand	Mild	CCR3	34	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cn3)CC2)cc1	ZINC000450788580	EE	On-Demand	Mild	MLNR	43	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cn3)CC2)cc1	ZINC000450788580	EE	On-Demand	Mild	MCHR1	40	41
COCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)s1	ZINC000450788581	GE	On-Demand	Anodyne	LTA4H	26	42
COCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)s1	ZINC000450788581	GE	On-Demand	Anodyne	SIGMAR1	22	40
COCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)s1	ZINC000450788581	GE	On-Demand	Anodyne	SSTR5	67	47
COCc1nnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)s1	ZINC000450788581	GE	On-Demand	Anodyne	MCHR1	34	41
C[C@@H](O)CCSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450788591	CE	On-Demand	Anodyne	L3MBTL1	0	40
C[C@@H](O)CCSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450788591	CE	On-Demand	Anodyne	L3MBTL3	45	34
CC[C@@H](N=c1cc(C)[nH]c(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](C)O	ZINC000450788592	DE	On-Demand	Bother	GYRB	40	36
C[C@H](O)CCSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450788593	CE	On-Demand	Anodyne	L3MBTL1	0	40
C[C@H](O)CCSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450788593	CE	On-Demand	Anodyne	L3MBTL3	45	34
CC[C@H](N=c1cc(C)[nH]c(-c2ccc([N+](=O)[O-])cc2)n1)[C@H](C)O	ZINC000450788594	DE	On-Demand	Bother	GYRB	40	36
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	SIGMAR1	35	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	SSTR5	67	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	CCR3	65	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	MLNR	60	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	CXCR3	46	38
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	MCHR1	62	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	AXL	40	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	TYRO3	39	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	MERTK	37	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(F)cn3)CC2)cc1	ZINC000450788595	EF	On-Demand	Anodyne	NOD2	40	35
CC[C@H](N=c1cc(C)[nH]c(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](C)O	ZINC000450788596	DE	On-Demand	Bother	GYRB	40	36
CCn1ccnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1=O	ZINC000450788597	FD	On-Demand	Anodyne	DRD4	16	45
CCn1ccnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1=O	ZINC000450788597	FD	On-Demand	Anodyne	LTA4H	19	40
CCn1ccnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1=O	ZINC000450788597	FD	On-Demand	Anodyne	SIGMAR1	22	40
CCn1ccnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1=O	ZINC000450788597	FD	On-Demand	Anodyne	SSTR5	80	45
CCn1ccnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1=O	ZINC000450788597	FD	On-Demand	Anodyne	MCHR1	50	39
CCn1ccnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1=O	ZINC000450788597	FD	On-Demand	Anodyne	AXL	26	40
CCn1ccnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1=O	ZINC000450788597	FD	On-Demand	Anodyne	TYRO3	18	40
CCn1ccnc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1=O	ZINC000450788597	FD	On-Demand	Anodyne	MERTK	27	40
CC[C@@H](N=c1cc(C)[nH]c(-c2ccc([N+](=O)[O-])cc2)n1)[C@H](C)O	ZINC000450788598	DE	On-Demand	Bother	GYRB	40	36
COc1ccc2c(c1)CN(c1ncccc1C(F)(F)F)CCO2	ZINC000450788604	DH	On-Demand	Anodyne	TRPV1	28	41
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450788615	FF	On-Demand	Anodyne	ERBB2	22	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450788615	FF	On-Demand	Anodyne	NPBWR1	42	31
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450788617	FF	On-Demand	Anodyne	ERBB2	22	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450788617	FF	On-Demand	Anodyne	NPBWR1	42	31
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450788618	FF	On-Demand	Anodyne	ERBB2	22	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450788618	FF	On-Demand	Anodyne	NPBWR1	42	31
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450788620	FF	On-Demand	Anodyne	ERBB2	22	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450788620	FF	On-Demand	Anodyne	NPBWR1	42	31
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	TSHR	68	34
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	DRD4	35	47
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	ACHE	28	42
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	HRH1	15	45
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	DRD3	20	44
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	KCNH2	16	46
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	CHRM3	15	41
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	LTA4H	34	46
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	SIGMAR1	33	47
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	SSTR5	93	54
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	CCR3	55	38
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	TIMP3	47	34
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	MLNR	41	40
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	CCR2	23	42
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	PDK1	50	38
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	CXCR3	43	39
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	ALS	66	32
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	MCHR1	78	48
COc1cc(OC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450788635	GD	On-Demand	Anodyne	NOD2	41	39
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450788638	GG	On-Demand	Bother	SIGMAR1	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450788638	GG	On-Demand	Bother	SSTR5	78	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450788638	GG	On-Demand	Bother	MCHR1	47	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450788638	GG	On-Demand	Bother	AXL	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450788638	GG	On-Demand	Bother	TYRO3	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C)cc3[N+](=O)[O-])CC2)cc1	ZINC000450788638	GG	On-Demand	Bother	MERTK	30	40
CCCOc1ccc(C(=O)N2CCN(C(C)(C)C(=O)OC)CC2)c(OC)c1	ZINC000450788639	GE	On-Demand	Anodyne	OXTR	23	42
CCc1cccc(C(=O)N2CC(NC(=O)C3CC3)C2)n1	ZINC000450788640	CC	On-Demand	Anodyne	EPHX2	17	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4cccc(C)c4s3)CC2)cc1	ZINC000450788646	GI	On-Demand	Anodyne	MCHR1	15	40
CCOc1ccccc1N1C(=O)C(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450788687	FG	On-Demand	Anodyne	HCN1	43	34
CCOc1ccccc1N1C(=O)C(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450788687	FG	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1N1C(=O)C(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450788688	FG	On-Demand	Anodyne	HCN1	43	34
CCOc1ccccc1N1C(=O)C(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450788688	FG	On-Demand	Anodyne	HCN4	44	35
COC(=O)C(C)(C)N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450788701	DD	On-Demand	Anodyne	DRD4	23	41
COC(=O)C(C)(C)N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450788701	DD	On-Demand	Anodyne	CACNA1G	23	40
COC(=O)C(C)(C)N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450788701	DD	On-Demand	Anodyne	NOD2	41	36
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCc2ccc(Cl)cc2F)CC3)c1	ZINC000450788713	GH	On-Demand	Anodyne	P2RX7	109	41
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCc2ccc(Cl)cc2F)CC3)c1	ZINC000450788713	GH	On-Demand	Anodyne	EPHX2	28	45
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCc2ccc(Cl)cc2F)CC3)c1	ZINC000450788713	GH	On-Demand	Anodyne	PDE8B	40	31
Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCc2ccc(Cl)cc2F)CC3)c1	ZINC000450788720	GH	On-Demand	Anodyne	P2RX7	109	41
Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCc2ccc(Cl)cc2F)CC3)c1	ZINC000450788720	GH	On-Demand	Anodyne	EPHX2	28	45
Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCc2ccc(Cl)cc2F)CC3)c1	ZINC000450788720	GH	On-Demand	Anodyne	PDE8B	40	31
CCOC(=O)c1ccc(C#N)c(SC[C@H](Cc2ccccc2)OC)n1	ZINC000450788729	FG	On-Demand	Mild	CTRB_BOVIN	46	34
CCOC(=O)c1ccc(C#N)c(SC[C@@H](Cc2ccccc2)OC)n1	ZINC000450788732	FG	On-Demand	Mild	CTRB_BOVIN	46	34
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H]1CCO	ZINC000450788737	CD	On-Demand	Anodyne	SLC18A2	40	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]1CCO	ZINC000450788739	CD	On-Demand	Anodyne	SLC18A2	40	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]1CCO	ZINC000450788740	CD	On-Demand	Anodyne	SLC18A2	40	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]1CCO	ZINC000450788743	CD	On-Demand	Anodyne	SLC18A2	40	40
COc1cc(Br)ccc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450788753	GH	On-Demand	Anodyne	DRD4	20	44
COc1cc(Br)ccc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450788753	GH	On-Demand	Anodyne	DRD3	29	46
COc1cc(Br)ccc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450788753	GH	On-Demand	Anodyne	P2RX7	24	40
COc1cc(Br)ccc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450788753	GH	On-Demand	Anodyne	EPHX2	22	49
COc1cc(Br)ccc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450788753	GH	On-Demand	Anodyne	ALK	18	43
COc1cc(Br)ccc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450788756	GH	On-Demand	Anodyne	DRD4	20	44
COc1cc(Br)ccc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450788756	GH	On-Demand	Anodyne	DRD3	29	46
COc1cc(Br)ccc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450788756	GH	On-Demand	Anodyne	P2RX7	24	40
COc1cc(Br)ccc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450788756	GH	On-Demand	Anodyne	EPHX2	22	49
COc1cc(Br)ccc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450788756	GH	On-Demand	Anodyne	ALK	18	43
CC(C)OC(C)(C)C(=O)NCc1ccc(Cl)cc1F	ZINC000450788814	CG	On-Demand	Anodyne	TRPV1	44	34
CC(C)OC(C)(C)C(=O)NCc1ccc(Cl)cc1F	ZINC000450788814	CG	On-Demand	Anodyne	BDKRB1	24	44
COc1ccc(OC(F)(F)F)c(C(=O)NCc2nnnn2C)c1	ZINC000450788816	ED	On-Demand	Anodyne	GRIN2B	0	40
CC(C)Oc1c(F)cc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1F	ZINC000450788827	GJ	On-Demand	Anodyne	TIMP3	43	32
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	HTR1A	62	51
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	DRD2	49	46
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	DRD1	26	43
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	DRD4	49	43
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	HTR2A	37	48
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	HTR2C	27	50
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	SLC6A1	41	35
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	DRD3	44	53
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	DRD5	25	42
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccccc1	ZINC000450788835	EG	On-Demand	Anodyne	CYP2J2	61	43
CCOC(=O)c1cnc2ccccc2c1N1CC(C)(CO)C1	ZINC000450788841	DE	On-Demand	Anodyne	ADORA1	15	45
CC(C)CN1CCN(C(=O)Cc2ccc(O)c(F)c2)CC1=O	ZINC000450788851	DD	On-Demand	Anodyne	DPP4	16	48
Cc1ccn2ncc(C(=O)N3CCN(C)C(=O)[C@H]3C)c2c1	ZINC000450788852	CC	On-Demand	Anodyne	EPHB3	25	43
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H](C)N1CCO	ZINC000450788857	GF	On-Demand	Anodyne	CPT1A	45	33
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H](C)N1CCO	ZINC000450788857	GF	On-Demand	Anodyne	PRNP	40	43
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H](C)N1CCO	ZINC000450788857	GF	On-Demand	Anodyne	HDAC1	31	45
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H](C)N1CCO	ZINC000450788857	GF	On-Demand	Anodyne	TAAR1	39	46
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H](C)N1CCO	ZINC000450788857	GF	On-Demand	Anodyne	DGAT1	21	41
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@@H](C)N1CCO	ZINC000450788857	GF	On-Demand	Anodyne	KCNK3	53	39
Cc1ccn2ncc(C(=O)N3CCN(C)C(=O)[C@@H]3C)c2c1	ZINC000450788859	CC	On-Demand	Anodyne	EPHB3	25	43
CCOC[C@H](C)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450788862	CH	On-Demand	Anodyne	GPR88	0	40
CCC[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450788863	FH	On-Demand	Anodyne	NPY2R	42	38
CCC[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450788863	FH	On-Demand	Anodyne	CTSS	16	40
CCC[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450788864	FH	On-Demand	Anodyne	NPY2R	42	38
CCC[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450788864	FH	On-Demand	Anodyne	CTSS	16	40
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450788865	GG	On-Demand	Bother	CACNA1D	56	38
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450788865	GG	On-Demand	Bother	COLA	26	40
C[C@@]1(CNC(=O)c2ccsn2)CCCN1Cc1ccccc1	ZINC000450788867	DF	On-Demand	Anodyne	NPFFR1	40	35
C[C@@]1(CNC(=O)c2ccsn2)CCCN1Cc1ccccc1	ZINC000450788867	DF	On-Demand	Anodyne	HCN1	57	35
C[C@@]1(CNC(=O)c2ccsn2)CCCN1Cc1ccccc1	ZINC000450788867	DF	On-Demand	Anodyne	HCN4	49	32
C[C@]1(CNC(=O)c2ccsn2)CCCN1Cc1ccccc1	ZINC000450788869	DF	On-Demand	Anodyne	NPFFR1	40	35
C[C@]1(CNC(=O)c2ccsn2)CCCN1Cc1ccccc1	ZINC000450788869	DF	On-Demand	Anodyne	HCN1	57	35
C[C@]1(CNC(=O)c2ccsn2)CCCN1Cc1ccccc1	ZINC000450788869	DF	On-Demand	Anodyne	HCN4	49	32
Cn1c(CNC(=O)[C@@H]2C[C@H]2C(F)(F)F)nc2cc(Cl)ccc21	ZINC000450788888	EG	On-Demand	Anodyne	P2RX7	57	37
CC(C)NC(=O)c1ccc(N[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788891	EF	On-Demand	Bother	TAAR1	16	41
CC(C)NC(=O)c1ccc(N[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450788892	EF	On-Demand	Bother	TAAR1	16	41
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450788916	GG	On-Demand	Anodyne	LIMK2	48	43
CCOC[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450788920	CE	On-Demand	Anodyne	SELE	65	37
CCOC[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450788920	CE	On-Demand	Anodyne	ICAM1	48	32
CCOC[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450788920	CE	On-Demand	Anodyne	VCAM1	52	34
Cc1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)ccn1	ZINC000450788922	BD	On-Demand	Anodyne	SORD	48	33
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788923	GD	On-Demand	Anodyne	DRD4	31	44
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788923	GD	On-Demand	Anodyne	DRD3	0	43
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788923	GD	On-Demand	Anodyne	CHRM3	15	41
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788923	GD	On-Demand	Anodyne	SIGMAR1	40	46
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788923	GD	On-Demand	Anodyne	MCHR1	27	41
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788923	GD	On-Demand	Anodyne	BIRC2	38	40
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788923	GD	On-Demand	Anodyne	ADIPOR1	0	40
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788923	GD	On-Demand	Anodyne	ADIPOR2	0	40
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788924	GD	On-Demand	Anodyne	DRD4	31	44
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788924	GD	On-Demand	Anodyne	DRD3	0	43
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788924	GD	On-Demand	Anodyne	CHRM3	15	41
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788924	GD	On-Demand	Anodyne	SIGMAR1	40	46
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788924	GD	On-Demand	Anodyne	MCHR1	27	41
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788924	GD	On-Demand	Anodyne	BIRC2	38	40
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788924	GD	On-Demand	Anodyne	ADIPOR1	0	40
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450788924	GD	On-Demand	Anodyne	ADIPOR2	0	40
O=C(CC1(O)CCC1)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450788925	ED	On-Demand	Anodyne	EPHX2	20	58
COc1cccc(N2C[C@H](C)N(CCO)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000450788930	DD	On-Demand	Bother	HTR1A	20	40
CCOC[C@H](C)NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450788938	CE	On-Demand	Anodyne	P4HTM	0	40
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H](O)[C@H](C)C3)ccc21	ZINC000450788943	FF	On-Demand	Anodyne	HPGD	64	71
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H](O)[C@@H](C)C3)ccc21	ZINC000450788944	FF	On-Demand	Anodyne	HPGD	64	71
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H](O)[C@H](C)C3)ccc21	ZINC000450788945	FF	On-Demand	Anodyne	HPGD	64	71
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H](O)[C@@H](C)C3)ccc21	ZINC000450788946	FF	On-Demand	Anodyne	HPGD	64	71
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	DRD2	17	45
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	DRD4	35	44
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	ACHE	15	44
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	HRH1	19	43
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	DRD3	0	44
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	KCNH2	15	44
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	HTR4	49	39
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	SIGMAR1	30	48
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	SSTR5	79	43
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	CCR3	51	43
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	UTS2R	21	40
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	PDK1	49	38
COC(=O)c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788962	GD	On-Demand	Anodyne	MCHR1	51	51
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	DRD2	17	45
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	DRD4	35	44
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	ACHE	15	44
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	HRH1	19	43
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	DRD3	0	44
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	KCNH2	15	44
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	HTR4	49	39
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	SIGMAR1	30	48
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	SSTR5	79	43
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	CCR3	51	43
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	UTS2R	21	40
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	PDK1	49	38
COC(=O)c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1Cl	ZINC000450788963	GD	On-Demand	Anodyne	MCHR1	51	51
CCOC[C@H](C)NC(=O)c1cnn2ccc(C)cc12	ZINC000450788964	CD	On-Demand	Anodyne	EPHB3	35	50
C[C@@H](c1ccc(CSc2ccc(C(=O)N3CCCC3)cn2)cc1)C(F)(F)F	ZINC000450788980	GK	On-Demand	Anodyne	CXCR2	15	41
C[C@H](c1ccc(CSc2ccc(C(=O)N3CCCC3)cn2)cc1)C(F)(F)F	ZINC000450788981	GK	On-Demand	Anodyne	CXCR2	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)o3)CC2)cc1	ZINC000450788982	ED	On-Demand	Anodyne	LTA4H	23	44
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)o3)CC2)cc1	ZINC000450788982	ED	On-Demand	Anodyne	SIGMAR1	27	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)o3)CC2)cc1	ZINC000450788982	ED	On-Demand	Anodyne	SSTR5	78	55
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)o3)CC2)cc1	ZINC000450788982	ED	On-Demand	Anodyne	CCR3	30	42
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)o3)CC2)cc1	ZINC000450788982	ED	On-Demand	Anodyne	MLNR	34	40
CC(=O)Nc1ccc(CN2CCC(Nc3nnc(C)o3)CC2)cc1	ZINC000450788982	ED	On-Demand	Anodyne	MCHR1	50	43
C[C@H](C1CC1)n1cc(NC(=O)c2cccc(C(F)(F)F)n2)cn1	ZINC000450788983	DH	On-Demand	Anodyne	ITK	54	34
C[C@H](C1CC1)n1cc(NC(=O)c2cccc(C(F)(F)F)n2)cn1	ZINC000450788983	DH	On-Demand	Anodyne	PANC	49	33
C[C@@H](C1CC1)n1cc(NC(=O)c2cccc(C(F)(F)F)n2)cn1	ZINC000450788984	DH	On-Demand	Anodyne	ITK	54	34
C[C@@H](C1CC1)n1cc(NC(=O)c2cccc(C(F)(F)F)n2)cn1	ZINC000450788984	DH	On-Demand	Anodyne	PANC	49	33
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	DRD2	17	41
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	TSHR	65	36
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	DRD4	25	41
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	ACHE	21	43
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	DRD3	0	41
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	HTR4	24	40
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	LTA4H	21	44
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	SIGMAR1	23	43
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	SSTR5	84	50
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	CCR3	30	41
COc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450788985	GH	On-Demand	Bother	MCHR1	42	44
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(C#N)n2C)cn1	ZINC000450788989	CE	On-Demand	Mild	ITK	46	32
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(C#N)n2C)cn1	ZINC000450788990	CE	On-Demand	Mild	ITK	46	32
COC(=O)c1ccc(CC(=O)N2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450788995	FD	On-Demand	Anodyne	HRH3	0	44
COC(=O)c1ccc(CC(=O)N2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450788995	FD	On-Demand	Anodyne	PTPRB	15	40
COC(=O)c1ccc(CC(=O)N2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450788995	FD	On-Demand	Anodyne	KCNJ1	40	33
COC(=O)c1ccc(CC(=O)N2CCN(C(C)(C)C(=O)OC)CC2)cc1	ZINC000450788995	FD	On-Demand	Anodyne	GPR183	0	40
C[C@H]1CN(c2ncc(C(N)=O)cc2Cl)CC(=O)N1	ZINC000450788999	CC	On-Demand	Anodyne	CXCR3	32	48
COc1cc(CC(=O)N2CCC(C)(C(C)C)CC2)ccc1O	ZINC000450789000	DG	On-Demand	Anodyne	NCE103	22	46
COc1cc(CC(=O)N2CCC(C)(C(C)C)CC2)ccc1O	ZINC000450789000	DG	On-Demand	Anodyne	CAN2	0	46
C[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)CC(=O)N1	ZINC000450789004	CC	On-Demand	Anodyne	CXCR3	32	48
COC(=O)c1cccc(CSCCc2cscn2)c1	ZINC000450789010	CG	On-Demand	Anodyne	BMP1	47	34
COCC(=O)N1CCc2cc(NC(=O)C(C)(C)C3CCC3)ccc21	ZINC000450789012	EF	On-Demand	Anodyne	NAMPT	27	43
C[C@H](C1CC1)n1cc(NC(=O)c2cncc(Cl)c2)cn1	ZINC000450789041	CG	On-Demand	Anodyne	ITK	51	32
C[C@H](C1CC1)n1cc(NC(=O)c2cncc(Cl)c2)cn1	ZINC000450789041	CG	On-Demand	Anodyne	PANC	50	36
C[C@@H](C1CC1)n1cc(NC(=O)c2cncc(Cl)c2)cn1	ZINC000450789042	CG	On-Demand	Anodyne	ITK	51	32
C[C@@H](C1CC1)n1cc(NC(=O)c2cncc(Cl)c2)cn1	ZINC000450789042	CG	On-Demand	Anodyne	PANC	50	36
COCC(=O)N1CCc2cc(NC(=O)CCCc3ncc(C)o3)ccc21	ZINC000450789049	FE	On-Demand	Anodyne	EIF2AK3	43	36
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	ACHE	20	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	KCNH2	18	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	LTA4H	32	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	CSNK2A1	43	34
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	SSTR5	85	49
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	CCR3	40	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	UTS2R	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	MLNR	49	39
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	CXCR3	43	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	MCHR1	67	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	MERTK	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	NPFFR1	40	35
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)cn3)CC2)cc1	ZINC000450789054	FE	On-Demand	Anodyne	NOD2	42	37
COCC(COC)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450789063	CG	On-Demand	Anodyne	HNMT	44	31
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	DRD4	24	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	LTA4H	17	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	CSNK2A1	72	39
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	SIGMAR1	24	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	SSTR5	78	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	CCR3	52	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	ITGA4	60	34
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	UTS2R	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	MLNR	56	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	CCR2	18	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	CXCR3	39	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	MCHR1	63	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc(C#N)cc3Cl)CC2)cc1	ZINC000450789071	GH	On-Demand	Mild	HIPK2	51	38
CSc1cccc(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)c1	ZINC000450789074	EH	On-Demand	Anodyne	MAPK13	21	40
CSc1cccc(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)c1	ZINC000450789074	EH	On-Demand	Anodyne	KCNK3	42	33
CC(=O)Nc1ccc(CN2CCC(Nc3nn4cc(C)nc4s3)CC2)cc1	ZINC000450789076	GF	On-Demand	Anodyne	LTA4H	24	43
CC(=O)Nc1ccc(CN2CCC(Nc3nn4cc(C)nc4s3)CC2)cc1	ZINC000450789076	GF	On-Demand	Anodyne	SIGMAR1	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3nn4cc(C)nc4s3)CC2)cc1	ZINC000450789076	GF	On-Demand	Anodyne	SSTR5	86	49
CC(=O)Nc1ccc(CN2CCC(Nc3nn4cc(C)nc4s3)CC2)cc1	ZINC000450789076	GF	On-Demand	Anodyne	MCHR1	42	41
COC(=O)c1ccc(CSc2ccc(C(=O)N3CCCC3)cn2)cc1Cl	ZINC000450789087	GI	On-Demand	Anodyne	BDKRB1	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(C)c34)CC2)cc1	ZINC000450789088	GH	On-Demand	Anodyne	DRD4	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(C)c34)CC2)cc1	ZINC000450789088	GH	On-Demand	Anodyne	LTA4H	26	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(C)c34)CC2)cc1	ZINC000450789088	GH	On-Demand	Anodyne	SIGMAR1	21	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(C)c34)CC2)cc1	ZINC000450789088	GH	On-Demand	Anodyne	SSTR5	72	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(C)c34)CC2)cc1	ZINC000450789088	GH	On-Demand	Anodyne	MCHR1	50	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(C)c34)CC2)cc1	ZINC000450789088	GH	On-Demand	Anodyne	NOD2	42	36
CO[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450789089	DD	On-Demand	Bother	TBXA2R	18	40
COc1ccccc1-n1cnc2cc(C(=O)N3CC4(CCCC4)C3)ccc21	ZINC000450789093	FI	On-Demand	Anodyne	PDGFRB	0	44
COc1ccccc1-n1cnc2cc(C(=O)N3CC4(CCCC4)C3)ccc21	ZINC000450789093	FI	On-Demand	Anodyne	HPGD	64	75
COc1cc(OC)c2ncc(C#N)c(NCCN3C[C@@H]4CC[C@H](C3)O4)c2c1	ZINC000450789095	FE	On-Demand	Mild	SRC	72	37
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	DRD4	38	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	DRD3	0	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	SIGMAR1	36	47
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	SSTR5	70	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	CCR1	0	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	CCR3	61	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	MLNR	59	48
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	MCHR1	65	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	AXL	24	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	TYRO3	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	MERTK	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncccc3F)CC2)cc1	ZINC000450789097	EG	On-Demand	Anodyne	NOD2	41	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N1C[C@H](C)N(CCO)[C@H](C)C1	ZINC000450789103	FC	On-Demand	Anodyne	CA2	22	51
COc1cc(CC(=O)N2CCO[C@@H](c3ncon3)C2)ccc1Cl	ZINC000450789105	ED	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2CCO[C@H](c3ncon3)C2)ccc1Cl	ZINC000450789106	ED	On-Demand	Anodyne	OPRK1	37	40
COC(=O)C(C)(C)N1CCN(C(=O)C[C@H]2COc3ccccc3O2)CC1	ZINC000450789109	FD	On-Demand	Anodyne	ADRA1B	15	40
COC(=O)C(C)(C)N1CCN(C(=O)C[C@H]2COc3ccccc3O2)CC1	ZINC000450789109	FD	On-Demand	Anodyne	ADRA2B	20	41
COC(=O)C(C)(C)N1CCN(C(=O)C[C@@H]2COc3ccccc3O2)CC1	ZINC000450789110	FD	On-Demand	Anodyne	ADRA1B	15	40
COC(=O)C(C)(C)N1CCN(C(=O)C[C@@H]2COc3ccccc3O2)CC1	ZINC000450789110	FD	On-Demand	Anodyne	ADRA2B	20	41
C[C@H](C1CC1)n1cc(NC(=O)c2ccnc(OC(F)F)c2)cn1	ZINC000450789116	DG	On-Demand	Anodyne	ITK	43	34
C[C@H](C1CC1)n1cc(NC(=O)c2ccnc(OC(F)F)c2)cn1	ZINC000450789116	DG	On-Demand	Anodyne	PANC	52	34
C[C@@H](C1CC1)n1cc(NC(=O)c2ccnc(OC(F)F)c2)cn1	ZINC000450789117	DG	On-Demand	Anodyne	ITK	43	34
C[C@@H](C1CC1)n1cc(NC(=O)c2ccnc(OC(F)F)c2)cn1	ZINC000450789117	DG	On-Demand	Anodyne	PANC	52	34
COc1cccc(-n2cc(C(=O)Nc3cnn([C@H](C)C4CC4)c3)nn2)c1	ZINC000450789119	FF	On-Demand	Anodyne	DRD4	41	32
COc1cccc(-n2cc(C(=O)Nc3cnn([C@H](C)C4CC4)c3)nn2)c1	ZINC000450789119	FF	On-Demand	Anodyne	ITK	48	34
COc1cccc(-n2cc(C(=O)Nc3cnn([C@@H](C)C4CC4)c3)nn2)c1	ZINC000450789121	FF	On-Demand	Anodyne	DRD4	41	32
COc1cccc(-n2cc(C(=O)Nc3cnn([C@@H](C)C4CC4)c3)nn2)c1	ZINC000450789121	FF	On-Demand	Anodyne	ITK	48	34
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C#N)c3)CC2)cc1	ZINC000450789122	GH	On-Demand	Mild	ACHE	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C#N)c3)CC2)cc1	ZINC000450789122	GH	On-Demand	Mild	LTA4H	19	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C#N)c3)CC2)cc1	ZINC000450789122	GH	On-Demand	Mild	CSNK2A1	66	38
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C#N)c3)CC2)cc1	ZINC000450789122	GH	On-Demand	Mild	SIGMAR1	23	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C#N)c3)CC2)cc1	ZINC000450789122	GH	On-Demand	Mild	SSTR5	45	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C#N)c3)CC2)cc1	ZINC000450789122	GH	On-Demand	Mild	MLNR	41	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C#N)c3)CC2)cc1	ZINC000450789122	GH	On-Demand	Mild	MCHR1	33	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])c(C#N)c3)CC2)cc1	ZINC000450789122	GH	On-Demand	Mild	HIPK2	43	37
CC(=O)c1ccc(CSc2ccc(C(=O)N3CCCC3)cn2)cc1	ZINC000450789124	EH	On-Demand	Anodyne	L3MBTL1	0	40
CC(=O)c1ccc(CSc2ccc(C(=O)N3CCCC3)cn2)cc1	ZINC000450789124	EH	On-Demand	Anodyne	L3MBTL3	45	35
CCOc1ccc(NC(=O)CC2(O)CCC2)cc1Br	ZINC000450789136	EG	On-Demand	Anodyne	ENPP1	49	30
CCOc1ccc(NC(=O)CC2(O)CCC2)cc1Br	ZINC000450789136	EG	On-Demand	Anodyne	HCN1	40	31
CCOc1ccc(NC(=O)CC2(O)CCC2)cc1Br	ZINC000450789136	EG	On-Demand	Anodyne	HCN4	40	31
CC(C)C1(C)CCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450789149	DI	On-Demand	Anodyne	ACACA	40	33
C[C@@H](Oc1ccccn1)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450789169	FD	On-Demand	Anodyne	GRM4	26	43
C[C@@H](Oc1ccccn1)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450789169	FD	On-Demand	Anodyne	IMDH_CRYPV	33	44
C[C@@H](Oc1ccccn1)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450789169	FD	On-Demand	Anodyne	NAMPT	21	40
C[C@H](Oc1ccccn1)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450789170	FD	On-Demand	Anodyne	GRM4	26	43
C[C@H](Oc1ccccn1)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450789170	FD	On-Demand	Anodyne	IMDH_CRYPV	33	44
C[C@H](Oc1ccccn1)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450789170	FD	On-Demand	Anodyne	NAMPT	21	40
C[C@H](c1ccc(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)cc1)C(F)(F)F	ZINC000450789175	GH	On-Demand	Anodyne	CACNA1D	41	38
C[C@@H](c1ccc(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)cc1)C(F)(F)F	ZINC000450789176	GH	On-Demand	Anodyne	CACNA1D	41	38
CCOc1ccc(-c2nnn(Cc3cn(C)nc3C)n2)cc1	ZINC000450789177	CD	On-Demand	Anodyne	CACNA2D1	47	38
CC[C@@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789188	DE	On-Demand	Bother	TAAR1	16	42
CC[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789189	DE	On-Demand	Bother	TAAR1	16	42
CC[C@@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789190	DE	On-Demand	Bother	TAAR1	16	42
CC[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789191	DE	On-Demand	Bother	TAAR1	16	42
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789198	FD	On-Demand	Bother	BDKRB1	0	48
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789198	FD	On-Demand	Bother	BCL2L1	108	35
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789198	FD	On-Demand	Bother	BCL2	97	35
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789198	FD	On-Demand	Bother	BCL2L2	50	35
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789200	FD	On-Demand	Bother	BCL2L1	108	35
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789200	FD	On-Demand	Bother	BCL2	97	35
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789200	FD	On-Demand	Bother	BCL2L2	50	35
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789201	FD	On-Demand	Bother	BDKRB1	0	48
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789201	FD	On-Demand	Bother	BCL2L1	108	35
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789201	FD	On-Demand	Bother	BCL2	97	35
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450789201	FD	On-Demand	Bother	BCL2L2	50	35
C[C@@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@@H]1O	ZINC000450789202	DG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@@H]1O	ZINC000450789202	DG	On-Demand	Anodyne	ADAM10	23	42
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789203	FD	On-Demand	Bother	BDKRB1	0	48
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789203	FD	On-Demand	Bother	BCL2L1	108	35
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789203	FD	On-Demand	Bother	BCL2	97	35
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450789203	FD	On-Demand	Bother	BCL2L2	50	35
C[C@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@H]1O	ZINC000450789204	DG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@H]1O	ZINC000450789204	DG	On-Demand	Anodyne	ADAM10	23	42
C[C@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@@H]1O	ZINC000450789206	DG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@@H]1O	ZINC000450789206	DG	On-Demand	Anodyne	ADAM10	23	42
C[C@@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@H]1O	ZINC000450789207	DG	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@H]1O	ZINC000450789207	DG	On-Demand	Anodyne	ADAM10	23	42
COc1ccc(-c2noc(N3CC(C)(CO)C3)n2)cc1	ZINC000450789208	CD	On-Demand	Anodyne	AXIN2	0	41
Cc1nc([C@@H]2CCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)cs1	ZINC000450789240	FI	On-Demand	Anodyne	COLA	39	42
Cc1nc([C@@H]2CCCN2C(=O)Cc2ccc(OC(F)F)c(F)c2)cs1	ZINC000450789240	FI	On-Demand	Anodyne	CPT1A	37	42
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450789242	EF	On-Demand	Anodyne	HNMT	47	35
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450789244	EF	On-Demand	Anodyne	HNMT	47	35
Cc1ccc(C2CCN(C(=O)c3c(C)cccc3Cl)CC2)cn1	ZINC000450789253	EI	On-Demand	Anodyne	CCR1	30	44
Cc1ccc(C2CCN(C(=O)c3c(C)cccc3Cl)CC2)cn1	ZINC000450789253	EI	On-Demand	Anodyne	CCR5	28	42
Cc1ccc(C2CCN(C(=O)c3c(C)cccc3Cl)CC2)cn1	ZINC000450789253	EI	On-Demand	Anodyne	FASN	40	35
Cc1ccc(C2CCN(C(=O)c3c(C)cccc3Cl)CC2)cn1	ZINC000450789253	EI	On-Demand	Anodyne	L3MBTL3	48	34
COc1cccc2c(N3CC(=O)N[C@@H](C)C3)nccc12	ZINC000450789270	CD	On-Demand	Anodyne	PDE3A	41	34
COc1cccc2c(N3CC(=O)N[C@@H](C)C3)nccc12	ZINC000450789270	CD	On-Demand	Anodyne	PDE3B	62	34
COc1cccc2c(N3CC(=O)N[C@H](C)C3)nccc12	ZINC000450789272	CD	On-Demand	Anodyne	PDE3A	41	34
COc1cccc2c(N3CC(=O)N[C@H](C)C3)nccc12	ZINC000450789272	CD	On-Demand	Anodyne	PDE3B	62	34
Cc1cccc(Cl)c1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450789293	EI	On-Demand	Anodyne	TBXAS1	50	40
Cc1cccc(Cl)c1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450789293	EI	On-Demand	Anodyne	CCR5	27	41
Cc1cccc(Cl)c1C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450789293	EI	On-Demand	Anodyne	HMOX2	44	33
Cc1nc([C@@H]2CCCN2C(=O)c2cc(Cl)c3ccccc3n2)cs1	ZINC000450789305	FJ	On-Demand	Anodyne	CPT1A	41	39
CC1(CO)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450789308	DD	On-Demand	Anodyne	ACACA	0	48
CC1(CO)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450789308	DD	On-Demand	Anodyne	ACACB	27	48
CC1(CO)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450789308	DD	On-Demand	Anodyne	TNKS	56	31
CC(C)OCCCCNC(=O)[C@H](O)C1CCC1	ZINC000450789327	BD	On-Demand	Anodyne	EPHX2	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450789328	GE	On-Demand	Anodyne	RHODESAIN	0	41
CC(C)OCCCCNC(=O)[C@@H](O)C1CCC1	ZINC000450789329	BD	On-Demand	Anodyne	EPHX2	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450789330	GE	On-Demand	Anodyne	RHODESAIN	0	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450789333	FD	On-Demand	Anodyne	RHOA	0	40
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450789338	FD	On-Demand	Anodyne	RHOA	0	40
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)c2cc3cccnc3s2)C1	ZINC000450789343	FE	On-Demand	Anodyne	ETHR	41	32
CC(=O)c1ccc(C#N)c(N[C@H]2CCO[C@H](c3ccncc3)C2)c1	ZINC000450789344	DG	On-Demand	Mild	CSNK2A1	40	31
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)c2cc3cccnc3s2)C1	ZINC000450789345	FE	On-Demand	Anodyne	ETHR	41	32
CCOC[C@H](C)NC(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450789347	DD	On-Demand	Anodyne	DRD4	40	32
CC(=O)c1ccc(C#N)c(N[C@@H]2CCO[C@@H](c3ccncc3)C2)c1	ZINC000450789349	DG	On-Demand	Mild	CSNK2A1	40	31
CC(=O)c1ccc(C#N)c(N[C@@H]2CCO[C@H](c3ccncc3)C2)c1	ZINC000450789350	DG	On-Demand	Mild	CSNK2A1	40	31
CC(=O)c1ccc(C#N)c(N[C@H]2CCO[C@@H](c3ccncc3)C2)c1	ZINC000450789353	DG	On-Demand	Mild	CSNK2A1	40	31
CNC(=O)c1nn(C[C@@H]2CCCC2(F)F)c(=O)c2ccccc12	ZINC000450789369	DE	On-Demand	Anodyne	HRH1	36	41
CNC(=O)c1nn(C[C@@H]2CCCC2(F)F)c(=O)c2ccccc12	ZINC000450789369	DE	On-Demand	Anodyne	ADRA1B	20	41
CNC(=O)c1nn(C[C@H]2CCCC2(F)F)c(=O)c2ccccc12	ZINC000450789370	DE	On-Demand	Anodyne	HRH1	36	41
CNC(=O)c1nn(C[C@H]2CCCC2(F)F)c(=O)c2ccccc12	ZINC000450789370	DE	On-Demand	Anodyne	ADRA1B	20	41
C[C@]1(CNC(=O)CCc2ccc(C(N)=O)cc2)CCCN1Cc1ccccc1	ZINC000450789371	GF	On-Demand	Anodyne	NPFFR2	40	44
C[C@]1(CNC(=O)CCc2ccc(C(N)=O)cc2)CCCN1Cc1ccccc1	ZINC000450789371	GF	On-Demand	Anodyne	NPFFR1	63	44
C[C@]1(CNC(=O)CCc2ccc(C(N)=O)cc2)CCCN1Cc1ccccc1	ZINC000450789371	GF	On-Demand	Anodyne	SLC12A5	49	38
C[C@@]1(CNC(=O)CCc2ccc(C(N)=O)cc2)CCCN1Cc1ccccc1	ZINC000450789372	GF	On-Demand	Anodyne	NPFFR2	40	44
C[C@@]1(CNC(=O)CCc2ccc(C(N)=O)cc2)CCCN1Cc1ccccc1	ZINC000450789372	GF	On-Demand	Anodyne	NPFFR1	63	44
C[C@@]1(CNC(=O)CCc2ccc(C(N)=O)cc2)CCCN1Cc1ccccc1	ZINC000450789372	GF	On-Demand	Anodyne	SLC12A5	49	38
COC(=O)C(C)(C)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450789384	DD	On-Demand	Anodyne	PLK1	0	40
COC(=O)C(C)(C)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450789384	DD	On-Demand	Anodyne	CTRB1	40	34
COC(=O)C(C)(C)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450789384	DD	On-Demand	Anodyne	CYP2D6	25	41
COC(=O)C(C)(C)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450789384	DD	On-Demand	Anodyne	ABCB1	66	40
COC(=O)C(C)(C)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450789384	DD	On-Demand	Anodyne	CAPN2	44	31
COC(=O)C(C)(C)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450789384	DD	On-Demand	Anodyne	ACE2	46	33
COC(=O)C(C)(C)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450789389	FG	On-Demand	Anodyne	HTR1A	19	40
COC(=O)C(C)(C)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450789389	FG	On-Demand	Anodyne	DRD2	23	42
COC(=O)C(C)(C)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450789389	FG	On-Demand	Anodyne	DRD4	48	40
COc1cccc(OCCC(=O)N2Cc3ccccc3OC[C@@H]2C)c1	ZINC000450789406	EG	On-Demand	Anodyne	AGTR2	42	36
COc1cccc(OCCC(=O)N2Cc3ccccc3OC[C@@H]2C)c1	ZINC000450789406	EG	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(OCCC(=O)N2Cc3ccccc3OC[C@H]2C)c1	ZINC000450789408	EG	On-Demand	Anodyne	AGTR2	42	36
COc1cccc(OCCC(=O)N2Cc3ccccc3OC[C@H]2C)c1	ZINC000450789408	EG	On-Demand	Anodyne	MTNR1A	23	40
CCOC(=O)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)nc1	ZINC000450789426	CD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)nc1	ZINC000450789428	CD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](O)[C@H](C)C2)nc1	ZINC000450789430	CD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@@H](O)[C@@H](C)C2)nc1	ZINC000450789432	CD	On-Demand	Anodyne	SSTR5	42	35
COC(=O)[C@]1(C)CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450789438	CE	On-Demand	Anodyne	SLC12A5	59	35
COC(=O)[C@]1(C)CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450789440	CE	On-Demand	Anodyne	SLC12A5	59	35
COC(=O)[C@]1(C)CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450789442	CE	On-Demand	Anodyne	SLC12A5	59	35
COC(=O)[C@]1(C)CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450789444	CE	On-Demand	Anodyne	SLC12A5	59	35
C[C@@H]1CN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC[C@@H]1O	ZINC000450789446	DH	On-Demand	Anodyne	SIGMAR1	29	40
C[C@@H]1CN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC[C@H]1O	ZINC000450789448	DH	On-Demand	Anodyne	SIGMAR1	29	40
C[C@@H](c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1)C(F)(F)F	ZINC000450789450	DH	On-Demand	Anodyne	SIGMAR1	29	40
C[C@@H](c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1)C(F)(F)F	ZINC000450789452	DH	On-Demand	Anodyne	SIGMAR1	29	40
COc1ccc(F)cc1CNC(=O)c1nn(C)c2c1CCCC2	ZINC000450789453	DE	On-Demand	Anodyne	P2RX7	50	40
COc1ccc(F)cc1CNC(=O)c1nn(C)c2c1CCCC2	ZINC000450789453	DE	On-Demand	Anodyne	PPARD	23	42
COc1ccc(F)cc1CNC(=O)c1nn(C)c2c1CCCC2	ZINC000450789453	DE	On-Demand	Anodyne	ACKR3	59	33
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450789476	DF	On-Demand	Mild	FABP4	44	37
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450789476	DF	On-Demand	Mild	NPFFR1	48	37
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450789476	DF	On-Demand	Mild	SLC12A5	41	33
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450789478	DF	On-Demand	Mild	FABP4	44	37
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450789478	DF	On-Demand	Mild	NPFFR1	48	37
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450789478	DF	On-Demand	Mild	SLC12A5	41	33
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450789479	DF	On-Demand	Mild	FABP4	44	37
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450789479	DF	On-Demand	Mild	NPFFR1	48	37
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450789479	DF	On-Demand	Mild	SLC12A5	41	33
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450789480	DF	On-Demand	Mild	FABP4	44	37
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450789480	DF	On-Demand	Mild	NPFFR1	48	37
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450789480	DF	On-Demand	Mild	SLC12A5	41	33
C=CCOc1ccc(CC(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450789481	CE	On-Demand	Mild	MLNR	25	41
C=CCOc1ccc(CC(=O)N2CC[C@H](O)[C@H](C)C2)cc1	ZINC000450789482	CE	On-Demand	Mild	MLNR	25	41
C=CCOc1ccc(CC(=O)N2CC[C@@H](O)[C@H](C)C2)cc1	ZINC000450789483	CE	On-Demand	Mild	MLNR	25	41
C=CCOc1ccc(CC(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450789484	CE	On-Demand	Mild	MLNR	25	41
CC(C)CCCC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450789498	DE	On-Demand	Anodyne	F2R	26	45
CC[C@H](CC(F)(F)F)C(=O)NCc1ccc(Cl)cc1F	ZINC000450789502	DI	On-Demand	Anodyne	TRPV1	86	38
CC[C@H](CC(F)(F)F)C(=O)NCc1ccc(Cl)cc1F	ZINC000450789502	DI	On-Demand	Anodyne	P2RX7	52	36
CC[C@H](CC(F)(F)F)C(=O)NCc1ccc(Cl)cc1F	ZINC000450789502	DI	On-Demand	Anodyne	BDKRB1	0	40
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccc(Cl)cc1F	ZINC000450789503	DI	On-Demand	Anodyne	TRPV1	89	38
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccc(Cl)cc1F	ZINC000450789503	DI	On-Demand	Anodyne	P2RX7	66	41
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccc(Cl)cc1F	ZINC000450789503	DI	On-Demand	Anodyne	BDKRB1	0	40
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccc(Cl)cc1F	ZINC000450789503	DI	On-Demand	Anodyne	PPARD	16	42
CC(C)CCCC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450789505	DE	On-Demand	Anodyne	F2R	26	45
COc1cccc([C@@H]2C[C@H]2C(=O)NCc2nc3cc(Cl)ccc3n2C)c1	ZINC000450789512	FH	On-Demand	Anodyne	DRD4	42	35
CCC(=O)C1(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)CC1	ZINC000450789524	ED	On-Demand	Anodyne	EPHX2	17	56
CC[C@@H]1CCC[C@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450789530	CG	On-Demand	Anodyne	GRIN2B	30	45
CC[C@@H]1CCC[C@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450789530	CG	On-Demand	Anodyne	P2RX7	36	42
CC[C@H]1CCC[C@@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450789532	CG	On-Demand	Anodyne	GRIN2B	30	45
CC[C@H]1CCC[C@@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450789532	CG	On-Demand	Anodyne	P2RX7	36	42
CC[C@@H]1CCC[C@@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450789533	CG	On-Demand	Anodyne	GRIN2B	30	45
CC[C@@H]1CCC[C@@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450789533	CG	On-Demand	Anodyne	P2RX7	36	42
CC[C@H]1CCC[C@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450789534	CG	On-Demand	Anodyne	GRIN2B	30	45
CC[C@H]1CCC[C@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450789534	CG	On-Demand	Anodyne	P2RX7	36	42
COc1ccc(F)cc1CNC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450789536	CG	On-Demand	Anodyne	GRIN2B	33	43
COc1ccc(F)cc1CNC(=O)[C@@H]1C[C@H]1CC(C)C	ZINC000450789536	CG	On-Demand	Anodyne	TSPO	15	41
Cc1cncc(-c2nc(CN3CCN(C[C@H](C)O)CC3)no2)c1	ZINC000450789539	DC	On-Demand	Anodyne	ACOX1	41	46
Cc1ccc(NC(=O)c2ccc(N[C@H]3CC34CCOCC4)c([N+](=O)[O-])c2)cc1	ZINC000450789542	GI	On-Demand	Bother	TAAR1	21	40
Cc1ccc(NC(=O)c2ccc(N[C@@H]3CC34CCOCC4)c([N+](=O)[O-])c2)cc1	ZINC000450789546	GI	On-Demand	Bother	TAAR1	21	40
COc1cc(CN2CCC(Cn3cncn3)CC2)ccc1Cl	ZINC000450789551	DF	On-Demand	Anodyne	HRH1	0	43
COc1cc(CN2CCC(Cn3cncn3)CC2)ccc1Cl	ZINC000450789551	DF	On-Demand	Anodyne	SIGMAR1	25	40
COc1cc(CN2CCC(Cn3cncn3)CC2)ccc1Cl	ZINC000450789551	DF	On-Demand	Anodyne	SSTR5	66	42
COc1cc(CN2CCC(Cn3cncn3)CC2)ccc1Cl	ZINC000450789551	DF	On-Demand	Anodyne	CCR3	25	43
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789563	GG	On-Demand	Anodyne	ERBB2	27	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789563	GG	On-Demand	Anodyne	TACR1	28	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789563	GG	On-Demand	Anodyne	CCR5	23	40
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789563	GG	On-Demand	Anodyne	EPHX2	31	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789563	GG	On-Demand	Anodyne	ADAM10	33	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789563	GG	On-Demand	Anodyne	SFRP1	53	32
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789563	GG	On-Demand	Anodyne	WNT3	44	32
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789564	GG	On-Demand	Anodyne	ERBB2	27	41
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789564	GG	On-Demand	Anodyne	TACR1	28	41
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789564	GG	On-Demand	Anodyne	CCR5	23	40
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789564	GG	On-Demand	Anodyne	EPHX2	31	41
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789564	GG	On-Demand	Anodyne	ADAM10	33	41
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789564	GG	On-Demand	Anodyne	SFRP1	53	32
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450789564	GG	On-Demand	Anodyne	WNT3	44	32
CN(CCN1CCC([C@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789565	ED	On-Demand	Anodyne	CHRM1	24	42
CN(CCN1CCC([C@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789565	ED	On-Demand	Anodyne	DRD4	22	42
CN(CCN1CCC([C@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789565	ED	On-Demand	Anodyne	ACHE	22	41
CN(CCN1CCC([C@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789565	ED	On-Demand	Anodyne	SIGMAR1	57	43
CN(CCN1CCC([C@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789565	ED	On-Demand	Anodyne	CCR3	44	38
CN(CCN1CCC([C@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789565	ED	On-Demand	Anodyne	CCR5	57	42
CN(CCN1CCC([C@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789565	ED	On-Demand	Anodyne	BIRC2	37	40
CN(CCN1CCC([C@@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789566	ED	On-Demand	Anodyne	CHRM1	24	42
CN(CCN1CCC([C@@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789566	ED	On-Demand	Anodyne	DRD4	22	42
CN(CCN1CCC([C@@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789566	ED	On-Demand	Anodyne	ACHE	22	41
CN(CCN1CCC([C@@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789566	ED	On-Demand	Anodyne	SIGMAR1	57	43
CN(CCN1CCC([C@@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789566	ED	On-Demand	Anodyne	CCR3	44	38
CN(CCN1CCC([C@@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789566	ED	On-Demand	Anodyne	CCR5	57	42
CN(CCN1CCC([C@@H](O)C(=O)NC2CC2)CC1)Cc1ccccc1	ZINC000450789566	ED	On-Demand	Anodyne	BIRC2	37	40
Cc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)c2c1CCC2	ZINC000450789578	DH	On-Demand	Anodyne	PANC	50	35
Cc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)c2c1CCC2	ZINC000450789579	DH	On-Demand	Anodyne	PANC	50	35
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450789580	FD	On-Demand	Anodyne	ERBB2	0	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450789580	FD	On-Demand	Anodyne	MMP2	0	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450789581	FD	On-Demand	Anodyne	ERBB2	0	40
COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450789581	FD	On-Demand	Anodyne	MMP2	0	40
C=CC(C)(C)C(=O)Nc1cnn([C@@H](C)C2CC2)c1	ZINC000450789584	BG	On-Demand	Mild	PANC	40	30
C=CC(C)(C)C(=O)Nc1cnn([C@H](C)C2CC2)c1	ZINC000450789585	BG	On-Demand	Mild	PANC	40	30
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450789591	FD	On-Demand	Anodyne	DRD4	19	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450789591	FD	On-Demand	Anodyne	KCNH2	15	46
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450789591	FD	On-Demand	Anodyne	LTA4H	22	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450789591	FD	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450789591	FD	On-Demand	Anodyne	SSTR5	69	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450789591	FD	On-Demand	Anodyne	MLNR	37	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450789591	FD	On-Demand	Anodyne	MCHR1	48	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C(N)=O)nn3)CC2)cc1	ZINC000450789591	FD	On-Demand	Anodyne	NOD2	40	34
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	DRD4	30	43
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	DHODH	47	35
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	LTA4H	16	43
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	CSNK2A1	49	37
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	SIGMAR1	28	44
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	SSTR5	48	40
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	CCR3	51	35
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	MLNR	46	42
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	CCR2	18	43
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	MCHR1	53	44
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(Cl)c3C#N)CC2)cc1	ZINC000450789594	GI	On-Demand	Mild	CACNA1G	22	40
CCn1nnc(C)c1CSc1ncccc1C(=O)OC	ZINC000450789612	CE	On-Demand	Anodyne	FAS	26	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789613	GH	On-Demand	Bother	DRD4	19	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789613	GH	On-Demand	Bother	ACHE	16	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789613	GH	On-Demand	Bother	SIGMAR1	24	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789613	GH	On-Demand	Bother	SSTR5	53	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789613	GH	On-Demand	Bother	CCR2	16	45
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789613	GH	On-Demand	Bother	MCHR1	40	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789614	GH	On-Demand	Bother	DRD4	21	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789614	GH	On-Demand	Bother	SIGMAR1	22	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789614	GH	On-Demand	Bother	SSTR5	56	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789614	GH	On-Demand	Bother	MCHR1	43	43
COCc1nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)cc(OC)n1	ZINC000450789617	GF	On-Demand	Anodyne	TSHR	49	33
COCc1nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)cc(OC)n1	ZINC000450789617	GF	On-Demand	Anodyne	DRD4	21	42
COCc1nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)cc(OC)n1	ZINC000450789617	GF	On-Demand	Anodyne	LTA4H	19	41
COCc1nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)cc(OC)n1	ZINC000450789617	GF	On-Demand	Anodyne	SIGMAR1	20	42
COCc1nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)cc(OC)n1	ZINC000450789617	GF	On-Demand	Anodyne	SSTR5	89	51
COCc1nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)cc(OC)n1	ZINC000450789617	GF	On-Demand	Anodyne	MCHR1	53	43
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450789618	GD	On-Demand	Anodyne	DRD4	16	40
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450789618	GD	On-Demand	Anodyne	LTA4H	15	40
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450789618	GD	On-Demand	Anodyne	SIGMAR1	19	42
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450789618	GD	On-Demand	Anodyne	SSTR5	70	45
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450789618	GD	On-Demand	Anodyne	MCHR1	32	41
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450789618	GD	On-Demand	Anodyne	NOD2	41	36
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)CC1	ZINC000450789621	GD	On-Demand	Anodyne	BDKRB1	0	41
COC(=O)c1ccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)cc1Cl	ZINC000450789622	FH	On-Demand	Anodyne	CCR3	35	41
COC(=O)c1ccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)cc1Cl	ZINC000450789622	FH	On-Demand	Anodyne	MCHR1	17	42
COC(=O)c1ccc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)cc1Cl	ZINC000450789623	FH	On-Demand	Anodyne	CCR3	35	41
COC(=O)c1ccc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)cc1Cl	ZINC000450789623	FH	On-Demand	Anodyne	MCHR1	17	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	EGFR	44	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	ERBB2	56	38
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	LTA4H	24	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	SIGMAR1	27	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	SSTR5	78	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	CCR3	45	36
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	MLNR	58	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	ERBB4	52	34
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	MCHR1	62	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc4cccc(F)c34)CC2)cc1	ZINC000450789624	GH	On-Demand	Anodyne	NOD2	40	36
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	DRD4	27	44
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	ACHE	18	42
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	KCNH2	15	46
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	LTA4H	23	44
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	SIGMAR1	26	43
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	SSTR5	87	50
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	CCR3	41	38
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	TIMP3	46	30
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	MLNR	38	40
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	CCR2	18	42
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	CXCR3	42	39
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	MCHR1	70	44
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	AXL	24	41
CCc1cc(CC)nc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789625	GH	On-Demand	Anodyne	MERTK	29	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450789626	GH	On-Demand	Mild	UTS2R	17	40
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450789626	GH	On-Demand	Mild	MLNR	44	43
CC(=O)Nc1ccc(CN2CCC(Nc3ccc(C#N)cc3[N+](=O)[O-])CC2)cc1	ZINC000450789626	GH	On-Demand	Mild	MCHR1	34	42
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C(N)=O)cs3)CC2)cc1	ZINC000450789635	FD	On-Demand	Anodyne	DRD4	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C(N)=O)cs3)CC2)cc1	ZINC000450789635	FD	On-Demand	Anodyne	LTA4H	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C(N)=O)cs3)CC2)cc1	ZINC000450789635	FD	On-Demand	Anodyne	SSTR5	65	45
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C(N)=O)cs3)CC2)cc1	ZINC000450789635	FD	On-Demand	Anodyne	AOC3	22	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C(N)=O)cs3)CC2)cc1	ZINC000450789635	FD	On-Demand	Anodyne	MCHR1	44	46
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C(N)=O)cs3)CC2)cc1	ZINC000450789635	FD	On-Demand	Anodyne	TRPC6	70	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C(N)=O)cs3)CC2)cc1	ZINC000450789635	FD	On-Demand	Anodyne	TRPC3	54	40
CSc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789649	FG	On-Demand	Anodyne	LTA4H	15	41
CSc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789649	FG	On-Demand	Anodyne	SSTR5	61	43
CSc1cncc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)n1	ZINC000450789649	FG	On-Demand	Anodyne	MCHR1	33	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789650	GH	On-Demand	Mild	CSNK2A1	57	35
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789650	GH	On-Demand	Mild	SIGMAR1	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789650	GH	On-Demand	Mild	SSTR5	34	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789650	GH	On-Demand	Mild	MLNR	45	44
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)ccc3[N+](=O)[O-])CC2)cc1	ZINC000450789650	GH	On-Demand	Mild	MCHR1	35	42
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450789655	GH	On-Demand	Bother	DRD4	26	43
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450789655	GH	On-Demand	Bother	LTA4H	18	42
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450789655	GH	On-Demand	Bother	SIGMAR1	24	44
CC(=O)Nc1ccc(CN2CCC(Nc3cccc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450789655	GH	On-Demand	Bother	MCHR1	35	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cnc3C)CC2)cc1	ZINC000450789657	FF	On-Demand	Anodyne	DRD4	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cnc3C)CC2)cc1	ZINC000450789657	FF	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cnc3C)CC2)cc1	ZINC000450789657	FF	On-Demand	Anodyne	SSTR5	69	47
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cnc3C)CC2)cc1	ZINC000450789657	FF	On-Demand	Anodyne	MLNR	50	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cnc3C)CC2)cc1	ZINC000450789657	FF	On-Demand	Anodyne	MCHR1	47	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cnc3C)CC2)cc1	ZINC000450789657	FF	On-Demand	Anodyne	AXL	36	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cnc3C)CC2)cc1	ZINC000450789657	FF	On-Demand	Anodyne	TYRO3	39	44
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cnc3C)CC2)cc1	ZINC000450789657	FF	On-Demand	Anodyne	MERTK	35	44
CCS(=O)(=O)c1ccc(CSCc2ccc(C(=O)OC)cc2)cc1	ZINC000450789665	FH	On-Demand	Anodyne	PTPRB	20	41
CCS(=O)(=O)c1ccc(CSCc2ccc(C(=O)OC)cc2)cc1	ZINC000450789665	FH	On-Demand	Anodyne	RORC	53	36
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789668	GG	On-Demand	Bother	DRD4	16	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789668	GG	On-Demand	Bother	SIGMAR1	21	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789668	GG	On-Demand	Bother	SSTR5	76	43
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000450789668	GG	On-Demand	Bother	MCHR1	43	42
COC(=O)c1ccc(CSCCc2cscn2)cc1	ZINC000450789669	CG	On-Demand	Anodyne	BMP1	48	33
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cn1	ZINC000450789670	EG	On-Demand	Anodyne	MMP13	0	48
C[C@H](C1CC1)n1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cn1	ZINC000450789670	EG	On-Demand	Anodyne	PANC	42	33
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cn1	ZINC000450789671	EG	On-Demand	Anodyne	MMP13	0	48
C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(-c3cnn(C)c3)o2)cn1	ZINC000450789671	EG	On-Demand	Anodyne	PANC	42	33
COC(=O)C(C)(C)N1CCN(C(=O)c2cccc(SC)c2)CC1	ZINC000450789672	EE	On-Demand	Anodyne	GPR183	0	40
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450789676	FD	On-Demand	Anodyne	HRH3	0	41
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450789676	FD	On-Demand	Anodyne	MAPK1	20	40
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450789676	FD	On-Demand	Anodyne	EPHX2	21	44
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450789676	FD	On-Demand	Anodyne	TGM2	41	33
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450789676	FD	On-Demand	Anodyne	F13A1	72	43
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450789676	FD	On-Demand	Anodyne	NAMPT	47	36
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450789677	FD	On-Demand	Anodyne	HRH3	0	41
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450789677	FD	On-Demand	Anodyne	MAPK1	20	40
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450789677	FD	On-Demand	Anodyne	EPHX2	21	44
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450789677	FD	On-Demand	Anodyne	TGM2	41	33
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450789677	FD	On-Demand	Anodyne	F13A1	72	43
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450789677	FD	On-Demand	Anodyne	NAMPT	47	36
CCc1cc(NC(COC)COC)n2ncnc2n1	ZINC000450789685	CC	On-Demand	Anodyne	DHOD	0	52
CC1(C)[C@@H](O)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450789688	DD	On-Demand	Bother	CACNA1C	48	34
CC1(C)[C@@H](O)C[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450789688	DD	On-Demand	Bother	CACNA1D	81	34
CC1(C)[C@@H](O)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450789689	DD	On-Demand	Bother	CACNA1C	48	34
CC1(C)[C@@H](O)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450789689	DD	On-Demand	Bother	CACNA1D	81	34
CC1(C)[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000450789690	DD	On-Demand	Bother	CACNA1C	48	34
CC1(C)[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000450789690	DD	On-Demand	Bother	CACNA1D	81	34
CC1(C)[C@H](O)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450789691	DD	On-Demand	Bother	CACNA1C	48	34
CC1(C)[C@H](O)C[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450789691	DD	On-Demand	Bother	CACNA1D	81	34
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1C[C@H](O)C1(C)C	ZINC000450789692	DF	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1C[C@@H](O)C1(C)C	ZINC000450789693	DF	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1C[C@H](O)C1(C)C	ZINC000450789694	DF	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1C[C@@H](O)C1(C)C	ZINC000450789695	DF	On-Demand	Anodyne	SORT1	15	40
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC2(CCCC2)C1	ZINC000450789704	EH	On-Demand	Anodyne	MAP3K5	44	33
CCOc1ccc(NC(=O)Cc2cn(C)nc2C)cc1Br	ZINC000450789738	FG	On-Demand	Anodyne	HTR2A	19	41
CCOc1ccc(NC(=O)Cc2cn(C)nc2C)cc1Br	ZINC000450789738	FG	On-Demand	Anodyne	ENPP1	56	35
COCC(COC)Nc1nc(-c2ccccc2)c2ccccc2n1	ZINC000450789743	DF	On-Demand	Anodyne	TACR2	19	40
COCC(COC)Nc1nc(-c2ccccc2)c2ccccc2n1	ZINC000450789743	DF	On-Demand	Anodyne	TACR3	56	40
COCC(COC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450789748	FD	On-Demand	Bother	BCL2L1	96	41
COCC(COC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450789748	FD	On-Demand	Bother	BCL2	72	36
COCC(COC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450789748	FD	On-Demand	Bother	TAAR1	19	40
COCC(COC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450789748	FD	On-Demand	Bother	BCL2L2	44	32
COCC(COC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450789748	FD	On-Demand	Bother	LRRK2	20	41
COCC(COC)Nc1cnn(-c2ccc(Cl)cc2)c(=O)c1Cl	ZINC000450789754	FF	On-Demand	Anodyne	NPBWR1	51	37
FC(F)(F)c1ccnc(NCCN2C[C@@H]3CC[C@H](C2)O3)c1	ZINC000450789760	DE	On-Demand	Anodyne	MAP3K12	27	40
Clc1cccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc12	ZINC000450789762	DG	On-Demand	Anodyne	HRP1_PLAFA	59	35
Clc1cccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc12	ZINC000450789762	DG	On-Demand	Anodyne	HNMT	63	45
CCSc1cccnc1C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450789764	FE	On-Demand	Anodyne	GRM4	22	41
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@@H](O)C1CCC1	ZINC000450789785	EE	On-Demand	Anodyne	KCNQ1	0	44
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)[C@H](O)C1CCC1	ZINC000450789786	EE	On-Demand	Anodyne	KCNQ1	0	44
CC(C)NC(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450789788	DD	On-Demand	Bother	TAAR1	20	48
N#CCCCNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450789809	CG	On-Demand	Mild	CTSV	40	41
Cc1nc(-c2ccccn2)nc(N2CC(C)(CO)C2)c1C	ZINC000450789836	CD	On-Demand	Anodyne	METAP1	34	41
C[C@@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789852	EE	On-Demand	Anodyne	HRH2	27	44
C[C@@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789852	EE	On-Demand	Anodyne	CCKAR	25	40
C[C@@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789852	EE	On-Demand	Anodyne	CCR3	39	43
C[C@@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789852	EE	On-Demand	Anodyne	CCKBR	45	40
C[C@@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789852	EE	On-Demand	Anodyne	CCR2	29	41
C[C@@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789852	EE	On-Demand	Anodyne	EPHX2	24	47
C[C@@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789852	EE	On-Demand	Anodyne	CACNA1I	27	44
C[C@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789853	EE	On-Demand	Anodyne	HRH2	27	44
C[C@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789853	EE	On-Demand	Anodyne	CCKAR	25	40
C[C@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789853	EE	On-Demand	Anodyne	CCR3	39	43
C[C@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789853	EE	On-Demand	Anodyne	CCKBR	45	40
C[C@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789853	EE	On-Demand	Anodyne	CCR2	29	41
C[C@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789853	EE	On-Demand	Anodyne	EPHX2	24	47
C[C@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789853	EE	On-Demand	Anodyne	CACNA1I	27	44
C[C@@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789854	EE	On-Demand	Anodyne	HRH2	27	44
C[C@@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789854	EE	On-Demand	Anodyne	CCKAR	25	40
C[C@@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789854	EE	On-Demand	Anodyne	CCR3	39	43
C[C@@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789854	EE	On-Demand	Anodyne	CCKBR	45	40
C[C@@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789854	EE	On-Demand	Anodyne	CCR2	29	41
C[C@@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789854	EE	On-Demand	Anodyne	EPHX2	24	47
C[C@@H]1[C@@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789854	EE	On-Demand	Anodyne	CACNA1I	27	44
C[C@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789855	EE	On-Demand	Anodyne	HRH2	27	44
C[C@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789855	EE	On-Demand	Anodyne	CCKAR	25	40
C[C@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789855	EE	On-Demand	Anodyne	CCR3	39	43
C[C@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789855	EE	On-Demand	Anodyne	CCKBR	45	40
C[C@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789855	EE	On-Demand	Anodyne	CCR2	29	41
C[C@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789855	EE	On-Demand	Anodyne	EPHX2	24	47
C[C@H]1[C@H](NC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCN1C	ZINC000450789855	EE	On-Demand	Anodyne	CACNA1I	27	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc(N)c3Cl)CC2)cc1	ZINC000450789957	FF	On-Demand	Anodyne	SIGMAR1	23	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc(N)c3Cl)CC2)cc1	ZINC000450789957	FF	On-Demand	Anodyne	SSTR5	64	46
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc(N)c3Cl)CC2)cc1	ZINC000450789957	FF	On-Demand	Anodyne	AKT1	0	40
CC(=O)Nc1ccc(CN2CCC(Nc3ncnc(N)c3Cl)CC2)cc1	ZINC000450789957	FF	On-Demand	Anodyne	MCHR1	41	44
CC(C)(C)OC1CC(Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450789987	EH	On-Demand	Anodyne	L3MBTL1	0	42
CC(C)(C)OC1CC(Sc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000450789987	EH	On-Demand	Anodyne	L3MBTL3	49	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C#N)CC2)cc1	ZINC000450789989	FE	On-Demand	Mild	LTA4H	21	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C#N)CC2)cc1	ZINC000450789989	FE	On-Demand	Mild	CSNK2A1	40	35
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C#N)CC2)cc1	ZINC000450789989	FE	On-Demand	Mild	SIGMAR1	22	43
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C#N)CC2)cc1	ZINC000450789989	FE	On-Demand	Mild	SSTR5	75	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C#N)CC2)cc1	ZINC000450789989	FE	On-Demand	Mild	MLNR	45	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C#N)CC2)cc1	ZINC000450789989	FE	On-Demand	Mild	MCHR1	41	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C#N)CC2)cc1	ZINC000450789989	FE	On-Demand	Mild	AXL	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C#N)CC2)cc1	ZINC000450789989	FE	On-Demand	Mild	MERTK	17	40
O=C(CCCC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1)C1CC1	ZINC000450790006	ED	On-Demand	Anodyne	F2R	23	45
O=C(CCCC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1)C1CC1	ZINC000450790009	ED	On-Demand	Anodyne	F2R	23	45
CC[C@H](Nc1cc(-c2ccccc2)nc2ncnn12)[C@H](C)O	ZINC000450790052	CE	On-Demand	Anodyne	DHOD	0	41
CC[C@@H](Nc1cc(-c2ccccc2)nc2ncnn12)[C@@H](C)O	ZINC000450790055	CE	On-Demand	Anodyne	DHOD	0	41
CCOC(=O)c1cc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)on1	ZINC000450790056	GD	On-Demand	Anodyne	NPY2R	48	36
CCOC(=O)c1cc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)on1	ZINC000450790056	GD	On-Demand	Anodyne	EPHX2	15	52
CC[C@@H](Nc1cc(-c2ccccc2)nc2ncnn12)[C@H](C)O	ZINC000450790057	CE	On-Demand	Anodyne	DHOD	0	41
CC[C@H](Nc1cc(-c2ccccc2)nc2ncnn12)[C@@H](C)O	ZINC000450790059	CE	On-Demand	Anodyne	DHOD	0	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(N)c4cnn(C)c4n3)CC2)cc1	ZINC000450790061	GD	On-Demand	Anodyne	SSTR5	56	41
CC(=O)Nc1ccc(CN2CCC(Nc3nc(N)c4cnn(C)c4n3)CC2)cc1	ZINC000450790061	GD	On-Demand	Anodyne	MCHR1	36	43
CCn1cnc2c(NCc3cnccc3C)ncnc21	ZINC000450790062	CE	On-Demand	Anodyne	ADORA3	24	42
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	HTR1A	31	56
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	DRD2	35	50
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	DRD1	30	55
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	DRD4	28	55
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	HTR2A	34	58
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	HTR2C	25	56
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	HRH1	15	58
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	ADRA1B	15	46
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	DRD3	25	61
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	DRD5	19	48
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	ERG2	23	50
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	HTR7	35	50
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	SIGMAR1	18	55
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	NET	0	52
O=C(CCCN1CCN(c2cc(C3CC3)[nH]n2)CC1)c1ccc(F)cc1	ZINC000450790063	FG	On-Demand	Anodyne	AP2S1	0	50
CC[C@@H](Nc1nc(C)nc2scc(C)c12)[C@@H](C)O	ZINC000450790064	CF	On-Demand	Anodyne	UL26	47	32
CC[C@@H](Nc1nc(C)nc2scc(C)c12)[C@@H](C)O	ZINC000450790064	CF	On-Demand	Anodyne	SCAF_EBVB9	47	30
CC[C@H](Nc1nc(C)nc2scc(C)c12)[C@@H](C)O	ZINC000450790066	CF	On-Demand	Anodyne	UL26	47	32
CC[C@H](Nc1nc(C)nc2scc(C)c12)[C@@H](C)O	ZINC000450790066	CF	On-Demand	Anodyne	SCAF_EBVB9	47	30
CC[C@@H](Nc1nc(C)nc2scc(C)c12)[C@H](C)O	ZINC000450790068	CF	On-Demand	Anodyne	UL26	47	32
CC[C@@H](Nc1nc(C)nc2scc(C)c12)[C@H](C)O	ZINC000450790068	CF	On-Demand	Anodyne	SCAF_EBVB9	47	30
CC[C@H](Nc1nc(C)nc2scc(C)c12)[C@H](C)O	ZINC000450790072	CF	On-Demand	Anodyne	UL26	47	32
CC[C@H](Nc1nc(C)nc2scc(C)c12)[C@H](C)O	ZINC000450790072	CF	On-Demand	Anodyne	SCAF_EBVB9	47	30
Cc1nc(-c2ccc(OCC[C@@H](C)O)cc2)no1	ZINC000450790076	BE	On-Demand	Anodyne	PLA2G5	15	40
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	TSHR	55	33
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	DRD4	24	46
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	ACHE	16	43
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	AVPR1B	41	33
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	LTA4H	26	45
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	SIGMAR1	27	42
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	SSTR5	65	45
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	CCR3	44	36
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	MLNR	41	36
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	PDK1	46	36
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	MCHR1	49	45
COc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)c1	ZINC000450790078	GH	On-Demand	Bother	AKR1C2	43	39
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450790081	GH	On-Demand	Bother	ACHE	17	46
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450790081	GH	On-Demand	Bother	LTA4H	15	42
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450790081	GH	On-Demand	Bother	SIGMAR1	28	44
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450790081	GH	On-Demand	Bother	SSTR5	41	39
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450790081	GH	On-Demand	Bother	CCR3	48	40
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450790081	GH	On-Demand	Bother	MLNR	49	41
CC(=O)Nc1ccc(CN2CCC(Nc3c(F)cccc3[N+](=O)[O-])CC2)cc1	ZINC000450790081	GH	On-Demand	Bother	MCHR1	49	42
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450790089	ED	On-Demand	Anodyne	CCKAR	0	42
Cc1nc(-c2ccc(OCC[C@H](C)O)cc2)no1	ZINC000450790092	BE	On-Demand	Anodyne	PLA2G5	15	40
C[C@@]1(CNC(=O)c2cn(CC3CC3)nn2)CCCN1Cc1ccccc1	ZINC000450790094	FE	On-Demand	Anodyne	NPFFR1	46	35
C[C@@]1(CNC(=O)c2cn(CC3CC3)nn2)CCCN1Cc1ccccc1	ZINC000450790094	FE	On-Demand	Anodyne	HCN1	44	33
C[C@@]1(CNC(=O)c2cn(CC3CC3)nn2)CCCN1Cc1ccccc1	ZINC000450790094	FE	On-Demand	Anodyne	HCN4	42	33
C[C@]1(CNC(=O)c2cn(CC3CC3)nn2)CCCN1Cc1ccccc1	ZINC000450790095	FE	On-Demand	Anodyne	NPFFR1	46	35
C[C@]1(CNC(=O)c2cn(CC3CC3)nn2)CCCN1Cc1ccccc1	ZINC000450790095	FE	On-Demand	Anodyne	HCN1	44	33
C[C@]1(CNC(=O)c2cn(CC3CC3)nn2)CCCN1Cc1ccccc1	ZINC000450790095	FE	On-Demand	Anodyne	HCN4	42	33
CC1(O)CC(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)C1	ZINC000450790108	ED	On-Demand	Anodyne	EPHX2	22	60
CC1(O)CC(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)C1	ZINC000450790108	ED	On-Demand	Anodyne	LRRK2	28	41
CCN1CCN(CCCC(=O)c2ccccc2)C(C)(C)C1=O	ZINC000450790110	DF	On-Demand	Anodyne	DRD2	30	42
CCN1CCN(CCCC(=O)c2ccccc2)C(C)(C)C1=O	ZINC000450790110	DF	On-Demand	Anodyne	CYP2J2	54	39
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450790121	GH	On-Demand	Bother	SIGMAR1	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450790121	GH	On-Demand	Bother	SSTR5	67	43
CC(=O)Nc1ccc(CN2CCC(Nc3nc(C)cc(C)c3[N+](=O)[O-])CC2)cc1	ZINC000450790121	GH	On-Demand	Bother	MCHR1	47	41
COC(=O)c1ccc(CN2CCC[C@@H](n3cnc(C(N)=O)n3)C2)cc1Cl	ZINC000450790128	GD	On-Demand	Anodyne	DRD4	18	41
COC(=O)c1ccc(CN2CCC[C@@H](n3cnc(C(N)=O)n3)C2)cc1Cl	ZINC000450790128	GD	On-Demand	Anodyne	CCR3	56	39
COC(=O)c1ccc(CN2CCC[C@H](n3cnc(C(N)=O)n3)C2)cc1Cl	ZINC000450790132	GD	On-Demand	Anodyne	DRD4	18	41
COC(=O)c1ccc(CN2CCC[C@H](n3cnc(C(N)=O)n3)C2)cc1Cl	ZINC000450790132	GD	On-Demand	Anodyne	CCR3	56	39
Cn1c(CNC(=O)[C@H]2CCN(c3ccccc3)C2)nc2cc(Cl)ccc21	ZINC000450790150	FG	On-Demand	Anodyne	HTR7	28	42
Cn1c(CNC(=O)[C@H]2CCN(c3ccccc3)C2)nc2cc(Cl)ccc21	ZINC000450790150	FG	On-Demand	Anodyne	EPHX2	22	41
Cn1c(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)nc2cc(Cl)ccc21	ZINC000450790151	FG	On-Demand	Anodyne	HTR7	28	42
Cn1c(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)nc2cc(Cl)ccc21	ZINC000450790151	FG	On-Demand	Anodyne	EPHX2	22	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	TSHR	50	34
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	DRD4	44	35
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	DRD3	15	45
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	LTA4H	18	43
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	SIGMAR1	42	41
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	TIMP3	40	32
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	MLNR	45	37
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	MCHR1	37	40
CC(=O)Nc1ccc(CN2CCC(N=c3[nH]c4ccccc4[nH]3)CC2)cc1	ZINC000450790155	FG	On-Demand	Anodyne	NOD2	44	37
COC(=O)CNC(=O)c1ccc(N[C@@H]2CCC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000450790157	FD	On-Demand	Bother	TAAR1	19	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)cc1	ZINC000450790158	GE	On-Demand	Anodyne	ACHE	20	43
CC(=O)Nc1ccc(CN2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)cc1	ZINC000450790158	GE	On-Demand	Anodyne	LTA4H	23	43
CC(=O)Nc1ccc(CN2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)cc1	ZINC000450790158	GE	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)cc1	ZINC000450790158	GE	On-Demand	Anodyne	SSTR5	68	42
CC(=O)Nc1ccc(CN2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)cc1	ZINC000450790158	GE	On-Demand	Anodyne	CCR3	38	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)cc1	ZINC000450790158	GE	On-Demand	Anodyne	UTS2R	19	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)cc1	ZINC000450790158	GE	On-Demand	Anodyne	CCR2	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)cc1	ZINC000450790158	GE	On-Demand	Anodyne	MCHR1	51	42
CCOC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450790161	CE	On-Demand	Anodyne	MTNR1B	27	40
CCOC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450790161	CE	On-Demand	Anodyne	GPR88	0	46
CC(C)O[C@@]1(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)CCOC1	ZINC000450790162	GD	On-Demand	Anodyne	EPHX2	18	55
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ccc(Cl)cn2)CC1	ZINC000450790163	GH	On-Demand	Anodyne	GPR119	23	44
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ccc(Cl)cn2)CC1	ZINC000450790166	GH	On-Demand	Anodyne	GPR119	23	44
CCCc1cc(C(=O)NCc2ccc(Cl)cc2F)no1	ZINC000450790169	CG	On-Demand	Anodyne	P2RX7	53	42
CCCc1cc(C(=O)NCc2ccc(Cl)cc2F)no1	ZINC000450790169	CG	On-Demand	Anodyne	BDKRB1	22	41
CC(C)O[C@]1(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)CCOC1	ZINC000450790173	GD	On-Demand	Anodyne	EPHX2	18	55
COc1ccc(F)cc1CNC(=O)[C@H]1CCCCC1(F)F	ZINC000450790179	DG	On-Demand	Anodyne	GRIN2B	22	45
COc1ccc(F)cc1CNC(=O)[C@H]1CCCCC1(F)F	ZINC000450790179	DG	On-Demand	Anodyne	P2RX7	44	39
COc1ccc(F)cc1CNC(=O)[C@@H]1CCCCC1(F)F	ZINC000450790181	DG	On-Demand	Anodyne	GRIN2B	22	45
COc1ccc(F)cc1CNC(=O)[C@@H]1CCCCC1(F)F	ZINC000450790181	DG	On-Demand	Anodyne	P2RX7	44	39
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	DRD4	21	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	LTA4H	16	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	CSNK2A1	82	38
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	SIGMAR1	26	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	SSTR5	64	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	CCR3	45	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	MLNR	46	46
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	CCR2	17	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	MCHR1	57	44
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C#N)cc(C)n3)CC2)cc1	ZINC000450790207	FG	On-Demand	Mild	HIVRT	0	45
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CC1	ZINC000450790209	GC	On-Demand	Anodyne	COLA	43	35
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CC1	ZINC000450790209	GC	On-Demand	Anodyne	CPT1A	41	35
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CC1	ZINC000450790209	GC	On-Demand	Anodyne	CPT2	44	34
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(OC)c(S(C)(=O)=O)c2)CC1	ZINC000450790209	GC	On-Demand	Anodyne	L3MBTL3	50	35
C[C@H]1CN(c2nccc(C(F)F)n2)C[C@@H](C)N1CCO	ZINC000450790226	CD	On-Demand	Anodyne	SORD	66	39
CCOC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450790227	EG	On-Demand	Anodyne	GPR88	0	41
C[C@@]1(CNC(=O)C2(CF)CCOCC2)CCCN1Cc1ccccc1	ZINC000450790229	EF	On-Demand	Anodyne	NPFFR1	46	36
C[C@]1(CNC(=O)C2(CF)CCOCC2)CCCN1Cc1ccccc1	ZINC000450790230	EF	On-Demand	Anodyne	NPFFR1	46	36
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	DRD4	23	40
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	ACHE	17	41
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	CHRM3	15	46
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	LTA4H	28	45
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	SIGMAR1	21	42
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	SSTR5	88	48
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	CCR3	32	40
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	UTS2R	19	40
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	MLNR	50	37
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	CCR2	19	45
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	PDGFRA	26	42
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	CXCR3	45	44
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	TGFBR1	0	42
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	MCHR1	57	42
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	AXL	23	42
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	TYRO3	22	42
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	MERTK	26	42
CCNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC000450790234	GF	On-Demand	Anodyne	NOD2	44	39
COc1cccc(Oc2ccc(C(=O)Nc3cnn([C@@H](C)C4CC4)c3)nc2)c1	ZINC000450790239	GI	On-Demand	Anodyne	ITK	46	32
COc1cccc(Oc2ccc(C(=O)Nc3cnn([C@@H](C)C4CC4)c3)nc2)c1	ZINC000450790239	GI	On-Demand	Anodyne	MTNR1A	15	44
COc1cccc(Oc2ccc(C(=O)Nc3cnn([C@@H](C)C4CC4)c3)nc2)c1	ZINC000450790239	GI	On-Demand	Anodyne	MTNR1B	21	44
COc1cccc(Oc2ccc(C(=O)Nc3cnn([C@H](C)C4CC4)c3)nc2)c1	ZINC000450790240	GI	On-Demand	Anodyne	ITK	46	32
COc1cccc(Oc2ccc(C(=O)Nc3cnn([C@H](C)C4CC4)c3)nc2)c1	ZINC000450790240	GI	On-Demand	Anodyne	MTNR1A	15	44
COc1cccc(Oc2ccc(C(=O)Nc3cnn([C@H](C)C4CC4)c3)nc2)c1	ZINC000450790240	GI	On-Demand	Anodyne	MTNR1B	21	44
COC(=O)c1cccnc1SCc1cc(C(C)(C)C)on1	ZINC000450790241	DG	On-Demand	Anodyne	FLT3	39	40
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450790246	FH	On-Demand	Anodyne	CTSV	45	33
CC[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450790251	FG	On-Demand	Anodyne	NPY2R	56	42
CC[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450790252	FG	On-Demand	Anodyne	NPY2R	56	42
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	HTR1A	22	42
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	DRD2	31	40
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	TSHR	41	31
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	SLC6A1	37	41
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	DRD3	27	40
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	GRIN2B	26	45
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	P2RX7	51	43
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	EPHX2	24	43
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	CACNA1G	38	46
COc1ccc(F)cc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450790253	EF	On-Demand	Anodyne	ACKR3	68	36
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	HTR1A	22	42
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	DRD2	31	40
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	TSHR	41	31
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	SLC6A1	37	41
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	DRD3	27	40
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	GRIN2B	26	45
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	P2RX7	51	43
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	EPHX2	24	43
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	CACNA1G	38	46
COc1ccc(F)cc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450790256	EF	On-Demand	Anodyne	ACKR3	68	36
CO[C@@H]1CCC[C@H]1Nc1ncnc2cc(Cl)ccc12	ZINC000450790270	CG	On-Demand	Anodyne	EGFR	23	40
CO[C@@H]1CCC[C@H]1Nc1ncnc2cc(Cl)ccc12	ZINC000450790270	CG	On-Demand	Anodyne	FLT1	19	40
CCOC(=O)c1cc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)on1	ZINC000450790278	DE	On-Demand	Anodyne	PANC	54	35
CCOC(=O)c1cc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)on1	ZINC000450790280	DE	On-Demand	Anodyne	PANC	54	35
CC(=O)C[C@H]1COCCN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450790283	GF	On-Demand	Anodyne	CHRM3	15	43
CC(F)(F)c1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cn1	ZINC000450790284	GG	On-Demand	Anodyne	RARA	22	40
CC(F)(F)c1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cn1	ZINC000450790284	GG	On-Demand	Anodyne	MAPK14	16	41
CC(F)(F)c1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cn1	ZINC000450790284	GG	On-Demand	Anodyne	CPT1A	28	42
CC(F)(F)c1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cn1	ZINC000450790284	GG	On-Demand	Anodyne	EPHX2	22	56
CC(F)(F)c1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)cn1	ZINC000450790284	GG	On-Demand	Anodyne	BTK	49	43
CC(=O)N(C[C@H]1CCCN1CC/C=C\c1ccccc1)C1CC1	ZINC000450790286	DH	On-Demand	Anodyne	SLC6A1	41	45
CC(=O)N(C[C@H]1CCCN1CC/C=C\c1ccccc1)C1CC1	ZINC000450790286	DH	On-Demand	Anodyne	ACKR3	61	40
CC(=O)N(C[C@@H]1CCCN1CC/C=C/c1ccccc1)C1CC1	ZINC000450790287	DH	On-Demand	Anodyne	SLC6A1	41	45
CC(=O)N(C[C@@H]1CCCN1CC/C=C/c1ccccc1)C1CC1	ZINC000450790287	DH	On-Demand	Anodyne	ACKR3	61	40
CC(=O)N(C[C@@H]1CCCN1CC/C=C\c1ccccc1)C1CC1	ZINC000450790288	DH	On-Demand	Anodyne	SLC6A1	41	45
CC(=O)N(C[C@@H]1CCCN1CC/C=C\c1ccccc1)C1CC1	ZINC000450790288	DH	On-Demand	Anodyne	ACKR3	61	40
Cc1cc(C(=O)NCc2ccc(Cl)cc2F)nn1C(C)C	ZINC000450790292	DG	On-Demand	Anodyne	CNR1	27	40
Cc1cc(C(=O)NCc2ccc(Cl)cc2F)nn1C(C)C	ZINC000450790292	DG	On-Demand	Anodyne	P2RX7	73	47
CCOC(=O)c1cccnc1N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000450790293	CD	On-Demand	Anodyne	P2RY12	45	35
COc1ccc(C(=O)Nc2cnc3c(c2)CCCC3)cc1S(C)(=O)=O	ZINC000450790297	FF	On-Demand	Anodyne	COLA	87	45
COc1ccc(C(=O)Nc2cnc3c(c2)CCCC3)cc1S(C)(=O)=O	ZINC000450790297	FF	On-Demand	Anodyne	CPT1A	76	44
COc1ccc(C(=O)Nc2cnc3c(c2)CCCC3)cc1S(C)(=O)=O	ZINC000450790297	FF	On-Demand	Anodyne	CPT2	49	41
COc1ccc(C(=O)Nc2cnc3c(c2)CCCC3)cc1S(C)(=O)=O	ZINC000450790297	FF	On-Demand	Anodyne	CPT1B	78	42
COc1ccc(F)cc1CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450790306	FH	On-Demand	Anodyne	P2RX7	43	43
COc1ccc(F)cc1CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450790306	FH	On-Demand	Anodyne	PPARD	20	40
COc1ccc(F)cc1CNC(=O)c1cn(CC(C)C)nc1C(F)F	ZINC000450790306	FH	On-Demand	Anodyne	CARM1	20	41
CCN1C[C@H](Nc2c(C#N)cnc3c(OC)cc(OC)cc23)CC1=O	ZINC000450790308	EE	On-Demand	Mild	SRC	43	35
CCN1C[C@@H](Nc2c(C#N)cnc3c(OC)cc(OC)cc23)CC1=O	ZINC000450790309	EE	On-Demand	Mild	SRC	43	35
CCOc1ccccc1N1C(=O)C(=O)N(CCC[C@@H](C)O)C1=O	ZINC000450790310	DD	On-Demand	Anodyne	PPARG	0	41
CCOc1ccccc1N1C(=O)C(=O)N(CCC[C@H](C)O)C1=O	ZINC000450790311	DD	On-Demand	Anodyne	PPARG	0	41
CCc1nc(C)c(NC(=O)c2cn(-c3cccc(OC)c3)nn2)s1	ZINC000450790316	EF	On-Demand	Anodyne	DRD4	44	35
c1cc(NCCN2C[C@@H]3CC[C@H](C2)O3)c2sccc2n1	ZINC000450790332	CF	On-Demand	Anodyne	HRP1_PLAFA	73	34
c1cc(NCCN2C[C@@H]3CC[C@H](C2)O3)c2sccc2n1	ZINC000450790332	CF	On-Demand	Anodyne	HNMT	46	39
COC(=O)C(C)(C)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450790343	DF	On-Demand	Anodyne	DRD4	40	33
COC(=O)C(C)(C)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450790343	DF	On-Demand	Anodyne	DRD3	29	41
COC(=O)C(C)(C)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450790344	DF	On-Demand	Anodyne	DRD4	40	33
COC(=O)C(C)(C)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450790344	DF	On-Demand	Anodyne	DRD3	29	41
COCC(=O)N1CCc2cc(NC(=O)c3ccc(C(C)(F)F)nc3)ccc21	ZINC000450790348	GF	On-Demand	Anodyne	P4HTM	0	42
COCC(=O)N1CCc2cc(NC(=O)c3ccc(C(C)(F)F)nc3)ccc21	ZINC000450790348	GF	On-Demand	Anodyne	EIF2AK3	51	39
C[C@H]1CN(C[C@H](O)Cc2ccccc2)CC[C@H]1O	ZINC000450790352	BD	On-Demand	Anodyne	OPRK1	0	41
CC(C)(C)c1cc(CSc2n[nH]c(/C=C\c3ccccc3)n2)no1	ZINC000450790359	EJ	On-Demand	Anodyne	METAP2	0	41
CNC(=O)c1cc([N+](=O)[O-])ccc1NC(COC)COC	ZINC000450790361	CD	On-Demand	Bother	CACNA1D	60	34
CNC(=O)c1cc([N+](=O)[O-])ccc1NC(COC)COC	ZINC000450790361	CD	On-Demand	Bother	KCNMA1	20	42
CN(C)CCCNS(=O)(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450790371	GC	On-Demand	Bother	BDKRB1	0	45
CN(C)CCCNS(=O)(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450790371	GC	On-Demand	Bother	BCL2L1	84	37
CN(C)CCCNS(=O)(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450790371	GC	On-Demand	Bother	BCL2	71	32
CCOc1ccc(NC(=O)C2CC(C)(O)C2)cc1Br	ZINC000450790377	EF	On-Demand	Anodyne	TYK2	40	33
COc1ccc([N+](=O)[O-])c(N2CC(C)(CO)C2)c1	ZINC000450790416	CD	On-Demand	Bother	TAAR1	17	41
CNS(=O)(=O)c1ccc(N2CC(C)(CO)C2)c(F)c1	ZINC000450790417	CC	On-Demand	Anodyne	SLC6A9	0	43
COCC(COC)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450790426	ED	On-Demand	Anodyne	LRRK2	30	44
COC(=O)c1ccccc1C(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450790428	GE	On-Demand	Bother	TAAR1	19	43
CN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)[C@@H]1CCCC[C@H]1O	ZINC000450790429	EH	On-Demand	Anodyne	PRCP	49	36
CN(CC1CC(F)(F)C1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450790430	DG	On-Demand	Anodyne	CHRNA2	40	41
CN(CC1CC(F)(F)C1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450790430	DG	On-Demand	Anodyne	CRTY	0	41
CN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)[C@@H]1CCCC[C@H]1O	ZINC000450790431	EH	On-Demand	Anodyne	PRCP	49	36
CN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)[C@@H]1CCCC[C@H]1O	ZINC000450790432	EH	On-Demand	Anodyne	PRCP	49	36
CN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)[C@@H]1CCCC[C@H]1O	ZINC000450790433	EH	On-Demand	Anodyne	PRCP	49	36
COCC(COC)Nc1ncnc2cc(Cl)ccc12	ZINC000450790448	CE	On-Demand	Anodyne	FGFR1	0	43
COCC(COC)Nc1ncnc2cc(Cl)ccc12	ZINC000450790448	CE	On-Demand	Anodyne	FLT1	23	51
COCC(COC)Nc1ncnc2cc(Cl)ccc12	ZINC000450790448	CE	On-Demand	Anodyne	HNMT	43	30
COCC(COC)Nc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450790481	FD	On-Demand	Anodyne	CA2	17	48
COCC(COC)Nc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450790481	FD	On-Demand	Anodyne	CA4	18	48
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c1	ZINC000450790494	GE	On-Demand	Anodyne	MTNR1A	26	43
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c1	ZINC000450790494	GE	On-Demand	Anodyne	MTNR1B	29	43
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c1	ZINC000450790494	GE	On-Demand	Anodyne	ELOVL6	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c1	ZINC000450790494	GE	On-Demand	Anodyne	NAMPT	41	51
CC1(C)[C@@H](O)C[C@H]1NC(=O)c1cccc2c1CCCC2	ZINC000450790502	CE	On-Demand	Anodyne	FABP4	43	34
CCOC(=O)c1c(N2CC(C)(CO)C2)nc2ccccc2c1C	ZINC000450790516	DF	On-Demand	Anodyne	TSPO	18	42
CC(=O)C[C@@H]1COCCN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450790528	GF	On-Demand	Anodyne	CHRM3	15	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	DRD4	39	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	CHRM3	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	LTA4H	17	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	CSNK2A1	77	39
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	SIGMAR1	28	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	SSTR5	69	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	CCR1	40	38
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	CCR3	46	39
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	NOS2	15	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	MLNR	40	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	NOS3	16	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	CCR2	22	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	CXCR3	46	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(Cl)ccc3C#N)CC2)cc1	ZINC000450790529	GI	On-Demand	Mild	MCHR1	71	47
CCc1c(C(=O)Nc2cnn([C@H](C)C3CC3)c2)oc2ccccc12	ZINC000450790532	DI	On-Demand	Anodyne	ITK	48	34
CCc1c(C(=O)Nc2cnn([C@H](C)C3CC3)c2)oc2ccccc12	ZINC000450790532	DI	On-Demand	Anodyne	PANC	45	33
CCc1c(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)oc2ccccc12	ZINC000450790533	DI	On-Demand	Anodyne	ITK	48	34
CCc1c(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)oc2ccccc12	ZINC000450790533	DI	On-Demand	Anodyne	PANC	45	33
COc1ccc(-c2csc3ncnc(N4CC(=O)N[C@H](C)C4)c23)cc1	ZINC000450790539	FF	On-Demand	Anodyne	ADRB3	29	43
COc1ccc(-c2csc3ncnc(N4CC(=O)N[C@@H](C)C4)c23)cc1	ZINC000450790540	FF	On-Demand	Anodyne	ADRB3	29	43
O=C(c1ccc(SC[C@H]2CCCC2(F)F)nc1)N1CCCC1	ZINC000450790544	EH	On-Demand	Anodyne	L3MBTL1	0	42
O=C(c1ccc(SC[C@H]2CCCC2(F)F)nc1)N1CCCC1	ZINC000450790544	EH	On-Demand	Anodyne	L3MBTL3	70	42
O=C(c1ccc(SC[C@@H]2CCCC2(F)F)nc1)N1CCCC1	ZINC000450790545	EH	On-Demand	Anodyne	L3MBTL1	0	42
O=C(c1ccc(SC[C@@H]2CCCC2(F)F)nc1)N1CCCC1	ZINC000450790545	EH	On-Demand	Anodyne	L3MBTL3	70	42
COC(=O)C(C)(C)N1CCN(C(=O)CCc2ccc(C(N)=O)cc2)CC1	ZINC000450790546	FC	On-Demand	Anodyne	HRH3	0	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	DRD4	16	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	LTA4H	25	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	SIGMAR1	25	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	SSTR5	77	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	MLNR	49	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	MCHR1	55	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	AXL	24	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	TYRO3	17	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C(F)F)CC2)cc1	ZINC000450790550	GF	On-Demand	Anodyne	MERTK	32	41
CC(C)C[C@@H](C)Sc1ccc(C(=O)N2CCCC2)cn1	ZINC000450790551	CH	On-Demand	Anodyne	L3MBTL1	0	43
CC(C)C[C@@H](C)Sc1ccc(C(=O)N2CCCC2)cn1	ZINC000450790551	CH	On-Demand	Anodyne	L3MBTL3	64	37
CC(C)C[C@H](C)Sc1ccc(C(=O)N2CCCC2)cn1	ZINC000450790552	CH	On-Demand	Anodyne	L3MBTL1	0	43
CC(C)C[C@H](C)Sc1ccc(C(=O)N2CCCC2)cn1	ZINC000450790552	CH	On-Demand	Anodyne	L3MBTL3	64	37
CCOC(=O)c1ccc(CSc2nnc(-c3sc(C)nc3C)o2)nc1	ZINC000450790553	GH	On-Demand	Anodyne	ALOX15	55	36
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccc(F)cc4[nH]3)CC2)cc1	ZINC000450790557	GH	On-Demand	Anodyne	SIGMAR1	32	43
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccc(F)cc4[nH]3)CC2)cc1	ZINC000450790557	GH	On-Demand	Anodyne	CCR3	109	45
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccc(F)cc4[nH]3)CC2)cc1	ZINC000450790557	GH	On-Demand	Anodyne	MLNR	52	40
CC(=O)Nc1ccc(CN2CCC(N=c3ccc4ccc(F)cc4[nH]3)CC2)cc1	ZINC000450790557	GH	On-Demand	Anodyne	MCHR1	44	43
CO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450790560	EE	On-Demand	Bother	L3MBTL1	0	42
COc1cc(CN2CC[C@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450790563	EH	On-Demand	Anodyne	DRD4	20	43
COc1cc(CN2CC[C@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450790563	EH	On-Demand	Anodyne	SSTR5	57	38
COc1cc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450790564	EH	On-Demand	Anodyne	DRD4	20	43
COc1cc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450790564	EH	On-Demand	Anodyne	SSTR5	57	38
CNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450790566	GD	On-Demand	Anodyne	DRD4	19	42
CNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450790566	GD	On-Demand	Anodyne	LTA4H	19	42
CNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450790566	GD	On-Demand	Anodyne	SIGMAR1	20	41
CNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450790566	GD	On-Demand	Anodyne	SSTR5	66	44
CNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450790566	GD	On-Demand	Anodyne	MCHR1	41	42
CNC(=O)c1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1	ZINC000450790566	GD	On-Demand	Anodyne	NOD2	41	35
COC(=O)[C@@H](C)SCc1ccn(CCc2ccccc2)n1	ZINC000450790573	DF	On-Demand	Anodyne	FAS	20	40
COC(=O)[C@H](C)SCc1ccn(CCc2ccccc2)n1	ZINC000450790574	DF	On-Demand	Anodyne	FAS	20	40
COC(=O)C(C)(C)N1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450790575	FD	On-Demand	Anodyne	OPRK1	35	41
COC(=O)C(C)(C)N1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450790575	FD	On-Demand	Anodyne	CCR1	26	47
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ncn3)CC2)cc1	ZINC000450790577	EF	On-Demand	Anodyne	SIGMAR1	28	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ncn3)CC2)cc1	ZINC000450790577	EF	On-Demand	Anodyne	SSTR5	69	49
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C)ncn3)CC2)cc1	ZINC000450790577	EF	On-Demand	Anodyne	MCHR1	54	44
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccccc1	ZINC000450790600	EH	On-Demand	Anodyne	HTR2A	18	46
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccccc1	ZINC000450790600	EH	On-Demand	Anodyne	SLC6A1	120	40
O=C(CCCN1CC[C@@H](n2cnc3c2CCCC3)C1)c1ccccc1	ZINC000450790600	EH	On-Demand	Anodyne	CYP2J2	60	42
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccccc1	ZINC000450790601	EH	On-Demand	Anodyne	HTR2A	18	46
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccccc1	ZINC000450790601	EH	On-Demand	Anodyne	SLC6A1	120	40
O=C(CCCN1CC[C@H](n2cnc3c2CCCC3)C1)c1ccccc1	ZINC000450790601	EH	On-Demand	Anodyne	CYP2J2	60	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	DRD4	22	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	ACHE	19	44
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	LTA4H	21	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	CSNK2A1	72	38
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	SIGMAR1	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	SSTR5	66	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	CCR3	50	39
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	MLNR	40	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	CCR2	19	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	CXCR3	24	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	MCHR1	57	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	HIPK2	44	38
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(C)=O)ccc3C#N)CC2)cc1	ZINC000450790612	GH	On-Demand	Mild	NOD2	40	35
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	DRD4	19	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	ACHE	15	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	KCNH2	17	47
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	SIGMAR1	26	48
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	SSTR5	55	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	CCR3	43	42
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	MLNR	45	41
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	CCR2	17	44
CC(=O)Nc1ccc(CN2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1	ZINC000450790613	GH	On-Demand	Bother	MCHR1	48	42
CCn1c(SCCCCCC(C)=O)nc2ccsc2c1=O	ZINC000450790614	DH	On-Demand	Anodyne	PDE7A	19	46
CC(=O)Nc1ccc(CN2CCC(N=c3cc[nH]c4ccccc34)CC2)cc1	ZINC000450790620	FH	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1ccc(CN2CCC(N=c3cc[nH]c4ccccc34)CC2)cc1	ZINC000450790620	FH	On-Demand	Anodyne	CCR2	0	42
CC(=O)Nc1ccc(CN2CCC(N=c3cc[nH]c4ccccc34)CC2)cc1	ZINC000450790620	FH	On-Demand	Anodyne	NOD2	40	34
Cc1ccc(C2CCN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC2)cn1	ZINC000450790621	GH	On-Demand	Bother	SLC27A4	42	31
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450790626	FE	On-Demand	Bother	DRD4	15	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450790626	FE	On-Demand	Bother	LTA4H	21	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450790626	FE	On-Demand	Bother	SIGMAR1	25	45
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450790626	FE	On-Demand	Bother	SSTR5	76	44
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450790626	FE	On-Demand	Bother	MCHR1	38	42
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450790626	FE	On-Demand	Bother	AXL	29	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450790626	FE	On-Demand	Bother	TYRO3	18	41
CC(=O)Nc1ccc(CN2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)cc1	ZINC000450790626	FE	On-Demand	Bother	MERTK	34	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	CHRM2	15	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	DRD4	20	46
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	ACHE	17	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	KCNH2	17	47
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	CHRM3	21	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	LTA4H	26	44
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	SIGMAR1	25	49
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	SSTR5	81	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	PRKD1	62	37
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	MLNR	44	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	CCR2	63	55
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	SLC6A5	31	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	EPHX2	38	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	CXCR3	39	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	MCHR1	82	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	CACNA1I	15	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	BRAF	27	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(C(F)(F)F)ccn3)CC2)cc1	ZINC000450790628	GI	On-Demand	Anodyne	LIPG	48	32
COC(=O)c1cccc(CSCc2ccnc(OC)n2)c1	ZINC000450790631	DF	On-Demand	Anodyne	KDM5C	0	41
COc1cccc(OCCC(=O)N(CCO)Cc2ccc(C)cc2)c1	ZINC000450790635	EF	On-Demand	Anodyne	MTNR1A	23	43
COc1cccc(OCCC(=O)N(CCO)Cc2ccc(C)cc2)c1	ZINC000450790635	EF	On-Demand	Anodyne	ROCK2	30	42
COc1cccc(OCCC(=O)N(CCO)Cc2ccc(C)cc2)c1	ZINC000450790635	EF	On-Demand	Anodyne	HSD17B2	25	42
Cc1nc([C@@H]2CCCN2C(=O)c2ccc(C(C)(F)F)nc2)cs1	ZINC000450790636	EH	On-Demand	Anodyne	COLA	0	43
Cc1nc([C@@H]2CCCN2C(=O)c2ccc(C(C)(F)F)nc2)cs1	ZINC000450790636	EH	On-Demand	Anodyne	CPT1A	20	43
CCCc1cc(N[C@H](CC)[C@H](C)O)n2ncnc2n1	ZINC000450790637	CD	On-Demand	Anodyne	DHOD	0	44
CCCc1cc(N[C@@H](CC)[C@@H](C)O)n2ncnc2n1	ZINC000450790638	CD	On-Demand	Anodyne	DHOD	0	44
CCCc1cc(N[C@H](CC)[C@@H](C)O)n2ncnc2n1	ZINC000450790639	CD	On-Demand	Anodyne	DHOD	0	44
CCCc1cc(N[C@@H](CC)[C@H](C)O)n2ncnc2n1	ZINC000450790640	CD	On-Demand	Anodyne	DHOD	0	44
CSc1ccc2ncnc(N3CC(=O)N[C@H](C)C3)c2c1	ZINC000450790650	CD	On-Demand	Anodyne	PDE3A	44	33
CSc1ccc2ncnc(N3CC(=O)N[C@@H](C)C3)c2c1	ZINC000450790651	CD	On-Demand	Anodyne	PDE3A	44	33
C/C=C\COc1cccc(CC(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450790663	FI	On-Demand	Anodyne	COLA	120	46
C/C=C\COc1cccc(CC(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450790663	FI	On-Demand	Anodyne	CPT1A	113	46
C/C=C/COc1cccc(CC(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450790664	FI	On-Demand	Anodyne	COLA	120	46
C/C=C/COc1cccc(CC(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450790664	FI	On-Demand	Anodyne	CPT1A	113	46
Cc1ccncc1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450790679	EF	On-Demand	Bother	MAPK11	34	41
Cc1ccncc1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450790679	EF	On-Demand	Bother	MAPK14	45	41
Cc1ccncc1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450790679	EF	On-Demand	Bother	MAPK13	52	38
CC[C@H](Nc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl)[C@H](C)O	ZINC000450790688	FG	On-Demand	Anodyne	NPBWR1	40	37
CC(=O)N(C[C@H]1CCCN1CC/C=C/c1ccccc1)C1CC1	ZINC000450790689	DH	On-Demand	Anodyne	SLC6A1	41	45
CC(=O)N(C[C@H]1CCCN1CC/C=C/c1ccccc1)C1CC1	ZINC000450790689	DH	On-Demand	Anodyne	ACKR3	61	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H](O)[C@@H](C)C3)cc2)c1	ZINC000450790692	FF	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H](O)[C@@H](C)C3)cc2)c1	ZINC000450790692	FF	On-Demand	Anodyne	L3MBTL3	54	38
CC[C@@H](Nc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl)[C@H](C)O	ZINC000450790693	FG	On-Demand	Anodyne	NPBWR1	40	37
CC[C@H](Nc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl)[C@@H](C)O	ZINC000450790694	FG	On-Demand	Anodyne	NPBWR1	40	37
CC[C@@H](Nc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl)[C@@H](C)O	ZINC000450790695	FG	On-Demand	Anodyne	NPBWR1	40	37
Cc1nc([C@@H]2CCCN2C(=O)c2ccc(-c3cnn(C)c3)o2)cs1	ZINC000450790696	EG	On-Demand	Anodyne	TRPC6	44	32
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H](O)[C@@H](C)C3)cc2)c1	ZINC000450790697	FF	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H](O)[C@@H](C)C3)cc2)c1	ZINC000450790697	FF	On-Demand	Anodyne	L3MBTL3	54	38
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H](O)[C@H](C)C3)cc2)c1	ZINC000450790699	FF	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H](O)[C@H](C)C3)cc2)c1	ZINC000450790699	FF	On-Demand	Anodyne	L3MBTL3	54	38
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H](O)[C@H](C)C3)cc2)c1	ZINC000450790700	FF	On-Demand	Anodyne	CCKAR	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H](O)[C@H](C)C3)cc2)c1	ZINC000450790700	FF	On-Demand	Anodyne	L3MBTL3	54	38
C[C@H](c1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450790702	GI	On-Demand	Anodyne	AGTR1	15	43
C[C@H](c1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450790702	GI	On-Demand	Anodyne	TBXA2R	0	44
C[C@H](c1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450790702	GI	On-Demand	Anodyne	ALOX5AP	44	47
C[C@H](c1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450790702	GI	On-Demand	Anodyne	PDE6D	71	38
CSc1cccc(C(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450790706	DI	On-Demand	Anodyne	COLA	36	41
CSc1cccc(C(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450790706	DI	On-Demand	Anodyne	CPT1A	35	41
CSc1cccc(C(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450790706	DI	On-Demand	Anodyne	GRM5	0	43
C[C@@H](c1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450790712	GI	On-Demand	Anodyne	AGTR1	15	43
C[C@@H](c1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450790712	GI	On-Demand	Anodyne	TBXA2R	0	44
C[C@@H](c1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450790712	GI	On-Demand	Anodyne	ALOX5AP	44	47
C[C@@H](c1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1)C(F)(F)F	ZINC000450790712	GI	On-Demand	Anodyne	PDE6D	71	38
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2c2csc(C)n2)on1	ZINC000450790717	EF	On-Demand	Anodyne	COLA	61	40
CCOC(=O)c1cc(C(=O)N2CCC[C@H]2c2csc(C)n2)on1	ZINC000450790717	EF	On-Demand	Anodyne	CPT1A	43	39
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1cnn2ccc(C)cc12	ZINC000450790725	EG	On-Demand	Anodyne	EPHB3	25	44
COc1ccc2c(c1)CN(c1cccc(F)c1C(C)=O)CCO2	ZINC000450790730	DG	On-Demand	Anodyne	DRD4	43	33
C[C@H]1CN(c2noc(-c3ccccc3)n2)C[C@@H](C)N1CCO	ZINC000450790735	DD	On-Demand	Anodyne	S1PR1	15	40
C[C@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@H]1O	ZINC000450790745	FE	On-Demand	Anodyne	TRPC6	106	54
C[C@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@H]1O	ZINC000450790745	FE	On-Demand	Anodyne	TRPC3	100	54
C[C@@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@@H]1O	ZINC000450790748	FE	On-Demand	Anodyne	TRPC6	106	54
C[C@@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@@H]1O	ZINC000450790748	FE	On-Demand	Anodyne	TRPC3	100	54
C[C@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@@H]1O	ZINC000450790750	FE	On-Demand	Anodyne	TRPC6	106	54
C[C@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@@H]1O	ZINC000450790750	FE	On-Demand	Anodyne	TRPC3	100	54
CC[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)[C@@H](C)O	ZINC000450790751	CD	On-Demand	Anodyne	PRCP	18	48
C[C@@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@H]1O	ZINC000450790752	FE	On-Demand	Anodyne	TRPC6	106	54
C[C@@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@H]1O	ZINC000450790752	FE	On-Demand	Anodyne	TRPC3	100	54
Cc1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450790755	EE	On-Demand	Bother	F2RL3	44	35
CC[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)[C@H](C)O	ZINC000450790756	CD	On-Demand	Anodyne	PRCP	18	48
CC[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)[C@@H](C)O	ZINC000450790757	CD	On-Demand	Anodyne	PRCP	18	48
CC[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)[C@H](C)O	ZINC000450790758	CD	On-Demand	Anodyne	PRCP	18	48
C[C@H]1CN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@@H](C)N1CCO	ZINC000450790761	GD	On-Demand	Anodyne	HSD11B1	17	44
Brc1ccc2c(N[C@@H]3CC34CCOCC4)ncnc2c1	ZINC000450790782	EG	On-Demand	Anodyne	EGFR	29	42
Brc1ccc2c(N[C@H]3CC34CCOCC4)ncnc2c1	ZINC000450790783	EG	On-Demand	Anodyne	EGFR	29	42
CC(=O)Nc1ncccc1NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450790784	EF	On-Demand	Anodyne	BDKRB1	0	43
CC(=O)Nc1ncccc1NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450790785	EF	On-Demand	Anodyne	BDKRB1	0	43
c1ccc(-c2cc3c(N[C@H]4CC45CCOCC5)ncnc3s2)cc1	ZINC000450790799	EI	On-Demand	Anodyne	FDPS	15	45
c1ccc(-c2cc3c(N[C@@H]4CC45CCOCC5)ncnc3s2)cc1	ZINC000450790800	EI	On-Demand	Anodyne	FDPS	15	45
CCOc1cc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)on1	ZINC000450790801	EF	On-Demand	Anodyne	HCN1	44	34
CCOc1cc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)on1	ZINC000450790801	EF	On-Demand	Anodyne	HCN4	44	34
CCOc1cc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)on1	ZINC000450790802	EF	On-Demand	Anodyne	HCN1	44	34
CCOc1cc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)on1	ZINC000450790802	EF	On-Demand	Anodyne	HCN4	44	34
CC(C)c1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)ncn1	ZINC000450790805	CD	On-Demand	Anodyne	SORD	42	34
CCOC[C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450790808	CG	On-Demand	Anodyne	SORT1	15	40
C[C@H]1CN(c2nc3ccccc3n2C)C[C@@H](C)N1CCO	ZINC000450790812	CD	On-Demand	Anodyne	HRH1	22	54
CC(=O)N[C@H](C(=O)NCc1ccc(-c2ccccc2)c(C)c1)C(C)(C)C	ZINC000450790837	FH	On-Demand	Anodyne	PAPA1_CARPA	50	42
CC(=O)N[C@H](C(=O)NCc1ccc(-c2ccccc2)c(C)c1)C(C)(C)C	ZINC000450790837	FH	On-Demand	Anodyne	TPH1	41	35
CC(=O)N[C@H](C(=O)NCc1ccc(-c2ccccc2)c(C)c1)C(C)(C)C	ZINC000450790837	FH	On-Demand	Anodyne	MMP2	21	40
CC(=O)N[C@H](C(=O)NCc1ccc(-c2ccccc2)c(C)c1)C(C)(C)C	ZINC000450790837	FH	On-Demand	Anodyne	MMP3	28	50
CC(=O)N[C@H](C(=O)NCc1ccc(-c2ccccc2)c(C)c1)C(C)(C)C	ZINC000450790837	FH	On-Demand	Anodyne	AMP1_PLAFQ	42	35
CC(=O)N[C@H](C(=O)NCc1ccc(-c2ccccc2)c(C)c1)C(C)(C)C	ZINC000450790837	FH	On-Demand	Anodyne	VHL	45	36
CC1(C)[C@@H](O)C[C@@H]1NC(=O)c1cccc2c1CCCC2	ZINC000450790838	CE	On-Demand	Anodyne	FABP4	43	34
CC1(C)[C@H](O)C[C@H]1NC(=O)c1cccc2c1CCCC2	ZINC000450790839	CE	On-Demand	Anodyne	FABP4	43	34
CC1(C)[C@@H](NC(=O)c2cccc3c2CCCC3)C[C@H]1O	ZINC000450790840	CE	On-Demand	Anodyne	FABP4	43	34
COc1cc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)c([N+](=O)[O-])cc1F	ZINC000450790859	ED	On-Demand	Bother	ACKR3	50	31
COc1cc(C(=O)N[C@H]2CCCN(C)[C@H]2C)c([N+](=O)[O-])cc1F	ZINC000450790861	ED	On-Demand	Bother	ACKR3	50	31
COc1cc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)c([N+](=O)[O-])cc1F	ZINC000450790863	ED	On-Demand	Bother	ACKR3	50	31
COCC(COC)Nc1cncc(-n2nc(C)cc2C)n1	ZINC000450790864	CD	On-Demand	Anodyne	ADORA2A	15	40
COc1cc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)c([N+](=O)[O-])cc1F	ZINC000450790865	ED	On-Demand	Bother	ACKR3	50	31
CC(C)(C)c1cc(CSc2n[nH]c(/C=C/c3ccccc3)n2)no1	ZINC000450790891	EJ	On-Demand	Anodyne	METAP2	0	41
OCC[C@@H]1CCCN1Cc1ccccc1OC1CC1	ZINC000450790905	CF	On-Demand	Anodyne	SLC18A2	35	41
OCC[C@H]1CCCN1Cc1ccccc1OC1CC1	ZINC000450790906	CF	On-Demand	Anodyne	SLC18A2	35	41
CCc1nc(C)c(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)s1	ZINC000450790908	EH	On-Demand	Bother	CACNA1D	52	31
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC(C)(CO)C1	ZINC000450790910	CD	On-Demand	Bother	CACNA1D	40	31
CCc1nc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)s1	ZINC000450790920	EJ	On-Demand	Anodyne	SORT1	18	51
COCC(COC)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450790929	EF	On-Demand	Bother	BCL2L1	89	36
COCC(COC)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450790929	EF	On-Demand	Bother	BCL2	54	32
CCSc1cccnc1C(=O)Nc1sc(CC)nc1C	ZINC000450790934	DH	On-Demand	Anodyne	MAP1	81	39
CC1(CO)CN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450790935	EF	On-Demand	Bother	TAAR1	15	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790944	GE	On-Demand	Anodyne	MMP13	17	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790944	GE	On-Demand	Anodyne	CAPNS1	19	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790944	GE	On-Demand	Anodyne	MMP2	22	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790944	GE	On-Demand	Anodyne	MMP8	15	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790944	GE	On-Demand	Anodyne	CAPN1	23	41
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790944	GE	On-Demand	Anodyne	CAPN2	23	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790944	GE	On-Demand	Anodyne	LEF	46	36
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790946	GE	On-Demand	Anodyne	MMP13	17	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790946	GE	On-Demand	Anodyne	CAPNS1	19	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790946	GE	On-Demand	Anodyne	MMP2	22	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790946	GE	On-Demand	Anodyne	MMP8	15	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790946	GE	On-Demand	Anodyne	CAPN1	23	41
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790946	GE	On-Demand	Anodyne	CAPN2	23	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1	ZINC000450790946	GE	On-Demand	Anodyne	LEF	46	36
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790948	GE	On-Demand	Anodyne	MMP13	17	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790948	GE	On-Demand	Anodyne	CAPNS1	19	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790948	GE	On-Demand	Anodyne	MMP2	22	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790948	GE	On-Demand	Anodyne	MMP8	15	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790948	GE	On-Demand	Anodyne	CAPN1	23	41
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790948	GE	On-Demand	Anodyne	CAPN2	23	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790948	GE	On-Demand	Anodyne	LEF	46	36
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790949	DI	On-Demand	Anodyne	PRCP	49	37
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790949	DI	On-Demand	Anodyne	MC3R	45	39
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790950	GE	On-Demand	Anodyne	MMP13	17	42
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790950	GE	On-Demand	Anodyne	CAPNS1	19	46
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790950	GE	On-Demand	Anodyne	MMP2	22	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790950	GE	On-Demand	Anodyne	MMP8	15	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790950	GE	On-Demand	Anodyne	CAPN1	23	41
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790950	GE	On-Demand	Anodyne	CAPN2	23	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1	ZINC000450790950	GE	On-Demand	Anodyne	LEF	46	36
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790951	DI	On-Demand	Anodyne	MC4R	40	39
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790951	DI	On-Demand	Anodyne	PRCP	53	37
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790951	DI	On-Demand	Anodyne	MC3R	45	39
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C[C@@H]1CCC(F)(F)C1)CC2	ZINC000450790952	GI	On-Demand	Anodyne	TACR3	0	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790953	DI	On-Demand	Anodyne	PRCP	49	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790953	DI	On-Demand	Anodyne	MC3R	45	39
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790954	DI	On-Demand	Anodyne	MC4R	40	39
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790954	DI	On-Demand	Anodyne	PRCP	53	37
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC2(CCCC2)C1	ZINC000450790954	DI	On-Demand	Anodyne	MC3R	45	39
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C[C@H]1CCC(F)(F)C1)CC2	ZINC000450790956	GI	On-Demand	Anodyne	TACR3	0	40
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C[C@@H]1CCC(F)(F)C1)CC2	ZINC000450790959	GI	On-Demand	Anodyne	TACR3	0	40
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C[C@H]1CCC(F)(F)C1)CC2	ZINC000450790962	GI	On-Demand	Anodyne	TACR3	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](O)[C@H](C)C1	ZINC000450790970	CD	On-Demand	Anodyne	OPRK1	26	46
C[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)CC[C@@H]1O	ZINC000450790972	CD	On-Demand	Anodyne	OPRK1	26	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@H](O)[C@H](C)C1	ZINC000450790974	CD	On-Demand	Anodyne	OPRK1	26	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450790975	GD	On-Demand	Anodyne	ANPEP	27	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450790975	GD	On-Demand	Anodyne	ADAM17	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450790975	GD	On-Demand	Anodyne	CAPN1	21	41
C[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)CC[C@H]1O	ZINC000450790976	CD	On-Demand	Anodyne	OPRK1	26	46
CN1CC[C@@H]2CN(c3nnc(-c4ccccc4)s3)C[C@@H]21	ZINC000450790978	CE	On-Demand	Anodyne	HRH3	15	54
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C)CC2)cc1	ZINC000450790987	EE	On-Demand	Anodyne	DRD4	22	47
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C)CC2)cc1	ZINC000450790987	EE	On-Demand	Anodyne	SIGMAR1	28	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C)CC2)cc1	ZINC000450790987	EE	On-Demand	Anodyne	SSTR5	67	46
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C)CC2)cc1	ZINC000450790987	EE	On-Demand	Anodyne	MLNR	39	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C)CC2)cc1	ZINC000450790987	EE	On-Demand	Anodyne	MCHR1	49	43
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C)CC2)cc1	ZINC000450790987	EE	On-Demand	Anodyne	AXL	31	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C)CC2)cc1	ZINC000450790987	EE	On-Demand	Anodyne	TYRO3	25	42
CC(=O)Nc1ccc(CN2CCC(Nc3nccnc3C)CC2)cc1	ZINC000450790987	EE	On-Demand	Anodyne	MERTK	31	42
C[C@H](C1CC1)n1cc(NC(=O)c2cc3c(Br)cccc3cn2)cn1	ZINC000450790997	GI	On-Demand	Anodyne	ITK	42	32
C[C@@H](C1CC1)n1cc(NC(=O)c2cc3c(Br)cccc3cn2)cn1	ZINC000450790998	GI	On-Demand	Anodyne	ITK	42	32
CCCNC(=O)c1ccc(NC(COC)COC)nc1	ZINC000450791001	CD	On-Demand	Anodyne	EPHX2	18	40
COCC(COC)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450791004	EC	On-Demand	Bother	BDKRB1	0	53
COCC(COC)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450791004	EC	On-Demand	Bother	COLA	49	33
COCC(COC)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450791004	EC	On-Demand	Bother	BCL2L1	90	34
COCC(COC)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450791004	EC	On-Demand	Bother	BCL2	63	33
C[C@H]1CN(c2ccc(C#N)cn2)C[C@@H](C)N1CCO	ZINC000450791010	CC	On-Demand	Mild	SGPL1	0	44
C[C@H]1CN(c2ccc(C#N)cn2)C[C@@H](C)N1CCO	ZINC000450791010	CC	On-Demand	Mild	SMO	0	47
CC[C@@H](Nc1ncnc2cc(Br)ccc12)[C@H](C)O	ZINC000450791019	DF	On-Demand	Anodyne	EGFR	66	40
CC[C@@H](Nc1ncnc2cc(Br)ccc12)[C@H](C)O	ZINC000450791019	DF	On-Demand	Anodyne	ERBB4	24	40
CC[C@@H](Nc1ncnc2cc(Br)ccc12)[C@H](C)O	ZINC000450791019	DF	On-Demand	Anodyne	HTT	0	45
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@@H](C)O	ZINC000450791031	DF	On-Demand	Anodyne	EGFR	66	40
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@@H](C)O	ZINC000450791031	DF	On-Demand	Anodyne	ERBB4	24	40
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@@H](C)O	ZINC000450791031	DF	On-Demand	Anodyne	HTT	0	45
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@H](C)O	ZINC000450791035	DF	On-Demand	Anodyne	EGFR	66	40
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@H](C)O	ZINC000450791035	DF	On-Demand	Anodyne	ERBB4	24	40
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@H](C)O	ZINC000450791035	DF	On-Demand	Anodyne	HTT	0	45
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450791036	GD	On-Demand	Bother	TAAR1	22	47
CC[C@@H](Nc1ncnc2cc(Br)ccc12)[C@@H](C)O	ZINC000450791037	DF	On-Demand	Anodyne	EGFR	66	40
CC[C@@H](Nc1ncnc2cc(Br)ccc12)[C@@H](C)O	ZINC000450791037	DF	On-Demand	Anodyne	ERBB4	24	40
CC[C@@H](Nc1ncnc2cc(Br)ccc12)[C@@H](C)O	ZINC000450791037	DF	On-Demand	Anodyne	HTT	0	45
COCC(=O)N1CCc2cc(NC(=O)CC3CC(F)(F)C3)ccc21	ZINC000450791040	EF	On-Demand	Anodyne	NAMPT	0	40
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C)[nH]c4ccccc34)CC2)cc1	ZINC000450791041	GI	On-Demand	Anodyne	TSHR	55	33
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C)[nH]c4ccccc34)CC2)cc1	ZINC000450791041	GI	On-Demand	Anodyne	ACHE	26	44
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C)[nH]c4ccccc34)CC2)cc1	ZINC000450791041	GI	On-Demand	Anodyne	SIGMAR1	24	40
CC(=O)Nc1ccc(CN2CCC(N=c3cc(C)[nH]c4ccccc34)CC2)cc1	ZINC000450791041	GI	On-Demand	Anodyne	MCHR2	50	41
COC(=O)c1cccc(CSc2ccc(C(=O)N3CCCC3)cn2)c1Cl	ZINC000450791043	GI	On-Demand	Anodyne	BDKRB1	18	43
COC(=O)c1cccc(CSc2ccc(C(=O)N3CCCC3)cn2)c1Cl	ZINC000450791043	GI	On-Demand	Anodyne	CXCR2	0	50
COC(=O)[C@@H](C)NC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450791046	GD	On-Demand	Bother	TAAR1	22	47
CCN1C[C@H](Nc2c(C)cnc3c(OC)cccc23)CC1=O	ZINC000450791049	CF	On-Demand	Anodyne	ATP4A	17	42
CCN1C[C@@H](Nc2c(C)cnc3c(OC)cccc23)CC1=O	ZINC000450791053	CF	On-Demand	Anodyne	ATP4A	17	42
COC(=O)c1cccnc1SCC1(C)CCC1	ZINC000450791066	CG	On-Demand	Anodyne	FAS	20	40
O=C(Cc1ccccc1O[C@H]1CCOC1)NCc1ccc(Cl)cc1F	ZINC000450791090	FH	On-Demand	Anodyne	P2RX7	57	37
O=C(Cc1ccccc1O[C@H]1CCOC1)NCc1ccc(Cl)cc1F	ZINC000450791090	FH	On-Demand	Anodyne	PDE4D	16	40
O=C(Cc1ccccc1O[C@H]1CCOC1)NCc1ccc(Cl)cc1F	ZINC000450791090	FH	On-Demand	Anodyne	PDEC	0	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(C)(C)C)n3)CC2)cc1	ZINC000450791095	GH	On-Demand	Anodyne	DRD4	18	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(C)(C)C)n3)CC2)cc1	ZINC000450791095	GH	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(C)(C)C)n3)CC2)cc1	ZINC000450791095	GH	On-Demand	Anodyne	SSTR5	84	47
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(C)(C)C)n3)CC2)cc1	ZINC000450791095	GH	On-Demand	Anodyne	MCHR1	49	44
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(C)(C)C)n3)CC2)cc1	ZINC000450791095	GH	On-Demand	Anodyne	AXL	26	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(C)(C)C)n3)CC2)cc1	ZINC000450791095	GH	On-Demand	Anodyne	TYRO3	28	41
CC(=O)Nc1ccc(CN2CCC(Nc3nccc(C(C)(C)C)n3)CC2)cc1	ZINC000450791095	GH	On-Demand	Anodyne	MERTK	35	41
COCC(=O)N1CCc2cc(NC(=O)Cc3ccc(Cl)c(OC)c3)ccc21	ZINC000450791105	GG	On-Demand	Anodyne	PFK	0	40
COCC(=O)N1CCc2cc(NC(=O)Cc3ccc(Cl)c(OC)c3)ccc21	ZINC000450791105	GG	On-Demand	Anodyne	IMDH_CRYPV	17	42
COCC(=O)N1CCc2cc(NC(=O)Cc3ccc(Cl)c(OC)c3)ccc21	ZINC000450791105	GG	On-Demand	Anodyne	EIF2AK3	49	41
COC(=O)C(C)(C)N1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450791106	GF	On-Demand	Anodyne	BDKRB1	0	40
CCOC(=O)c1cc(NC(COC)COC)ncc1Cl	ZINC000450791107	DD	On-Demand	Anodyne	CACNA1C	46	33
CC(=O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450791108	FG	On-Demand	Anodyne	RBP4	55	35
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCc1ccc(Cl)cc1F	ZINC000450791109	FH	On-Demand	Anodyne	P2RX7	57	37
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCc1ccc(Cl)cc1F	ZINC000450791109	FH	On-Demand	Anodyne	PDE4D	16	40
O=C(Cc1ccccc1O[C@@H]1CCOC1)NCc1ccc(Cl)cc1F	ZINC000450791109	FH	On-Demand	Anodyne	PDEC	0	40
CC(=O)C[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450791110	FG	On-Demand	Anodyne	RBP4	55	35
C[C@H](C1CC1)n1cc(NC(=O)c2ccnn2CC(F)(F)F)cn1	ZINC000450791112	EF	On-Demand	Anodyne	PANC	51	34
C[C@@H](C1CC1)n1cc(NC(=O)c2ccnn2CC(F)(F)F)cn1	ZINC000450791113	EF	On-Demand	Anodyne	PANC	51	34
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	DRD4	24	42
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	ACHE	15	41
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	LTA4H	21	42
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	SIGMAR1	24	42
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	SSTR5	84	49
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	CCR3	37	40
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	MLNR	47	41
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	CXCR3	36	40
CCc1cc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc(C)n1	ZINC000450791125	FG	On-Demand	Anodyne	MCHR1	68	44
CC(F)(F)CCSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450791132	DG	On-Demand	Anodyne	L3MBTL3	41	33
CC(F)(F)CCSc1ccc(C(=O)N2CCCC2)cn1	ZINC000450791132	DG	On-Demand	Anodyne	HPGD	37	40
Cc1nc(C)c(-c2nnc(SCc3cc(Br)ccc3C)o2)s1	ZINC000450791136	GK	On-Demand	Anodyne	TERT	21	40
COc1ccc(CNC(=O)CCN2CCN(C)C(=O)[C@H]2C)c(OC)c1	ZINC000450791137	EC	On-Demand	Anodyne	MTNR1A	42	35
COc1ccc(CNC(=O)CCN2CCN(C)C(=O)[C@@H]2C)c(OC)c1	ZINC000450791144	EC	On-Demand	Anodyne	MTNR1A	42	35
COc1ccc(F)cc1CNC(=O)CCCC(=O)C1CC1	ZINC000450791145	CF	On-Demand	Anodyne	GRIN2B	29	44
COc1ccc(F)cc1CNC(=O)CCCC(=O)C1CC1	ZINC000450791145	CF	On-Demand	Anodyne	HTR7	28	46
COc1ccc(F)cc1CNC(=O)CCCC(=O)C1CC1	ZINC000450791145	CF	On-Demand	Anodyne	P2RX7	51	39
COc1ccc(F)cc1CNC(=O)CCCC(=O)C1CC1	ZINC000450791145	CF	On-Demand	Anodyne	ACKR3	45	32
Cc1cnc(CCCC(=O)NCc2ccc(Cl)cc2F)o1	ZINC000450791146	DG	On-Demand	Anodyne	P2RX7	32	40
Cc1cnc(CCCC(=O)NCc2ccc(Cl)cc2F)o1	ZINC000450791146	DG	On-Demand	Anodyne	SUCNR1	42	37
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791147	EF	On-Demand	Anodyne	SIGMAR1	27	49
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791147	EF	On-Demand	Anodyne	CCR2	24	40
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791147	EF	On-Demand	Anodyne	CXCR3	22	40
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791147	EF	On-Demand	Anodyne	CACNA1G	44	53
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791147	EF	On-Demand	Anodyne	CACNA1I	59	35
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791147	EF	On-Demand	Anodyne	GPBAR1	34	45
O=C(NCC(F)(F)F)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791147	EF	On-Demand	Anodyne	BIRC2	55	43
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791148	EF	On-Demand	Anodyne	SIGMAR1	27	49
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791148	EF	On-Demand	Anodyne	CCR2	24	40
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791148	EF	On-Demand	Anodyne	CXCR3	22	40
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791148	EF	On-Demand	Anodyne	CACNA1G	44	53
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791148	EF	On-Demand	Anodyne	CACNA1I	59	35
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791148	EF	On-Demand	Anodyne	GPBAR1	34	45
O=C(NCC(F)(F)F)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450791148	EF	On-Demand	Anodyne	BIRC2	55	43
CN1CC[C@@H]2CN(c3ncnc4cc(Cl)ccc34)C[C@@H]21	ZINC000450791151	CE	On-Demand	Anodyne	PDE3A	46	38
CN1CC[C@@H]2CN(c3ncnc4cc(Cl)ccc34)C[C@@H]21	ZINC000450791151	CE	On-Demand	Anodyne	HNMT	40	31
CN1CC[C@@H]2CN(c3ncnc4cc(Cl)ccc34)C[C@@H]21	ZINC000450791151	CE	On-Demand	Anodyne	PDE3B	69	38
CN1CC[C@@H]2CN(c3ncnc4cc(Cl)ccc34)C[C@@H]21	ZINC000450791151	CE	On-Demand	Anodyne	HTT	0	43
CO[C@@H]1CCC[C@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450791152	CD	On-Demand	Bother	PRKCQ	46	37
COc1ccc(F)cc1CNC(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450791176	CF	On-Demand	Anodyne	P2RX7	45	38
COc1ccc(F)cc1CNC(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450791177	CF	On-Demand	Anodyne	P2RX7	45	38
COc1ccc(F)cc1CNC(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450791178	CF	On-Demand	Anodyne	P2RX7	45	38
COc1ccc(F)cc1CNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450791179	CF	On-Demand	Anodyne	P2RX7	45	38
CN1CC[C@@H]2CN(c3ccc(S(C)(=O)=O)cc3)C[C@@H]21	ZINC000450791202	CD	On-Demand	Anodyne	GPR119	17	54
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450791203	GH	On-Demand	Anodyne	P2RX7	102	43
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450791203	GH	On-Demand	Anodyne	EPHX2	25	49
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450791203	GH	On-Demand	Anodyne	MDM2	17	40
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450791203	GH	On-Demand	Anodyne	PDE8B	52	32
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450791204	GH	On-Demand	Anodyne	P2RX7	102	43
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450791204	GH	On-Demand	Anodyne	EPHX2	25	49
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450791204	GH	On-Demand	Anodyne	MDM2	17	40
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450791204	GH	On-Demand	Anodyne	PDE8B	52	32
C[C@H]1CN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C[C@@H](C)N1CCO	ZINC000450791206	GE	On-Demand	Anodyne	ROS1	48	41
C[C@H]1CN(c2ccc(C#N)c(Cl)c2)C[C@@H](C)N1CCO	ZINC000450791223	CE	On-Demand	Mild	AR	19	42
Cc1cnc(CCCC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)o1	ZINC000450791226	FG	On-Demand	Anodyne	NPFFR1	43	35
Cc1cnc(CCCC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)o1	ZINC000450791229	FG	On-Demand	Anodyne	NPFFR1	43	35
CC(C)c1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc(C(C)C)n1	ZINC000450791230	DF	On-Demand	Anodyne	SORD	59	38
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450791243	GD	On-Demand	Anodyne	CACNA1G	36	42
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450791245	GD	On-Demand	Anodyne	CACNA1G	36	42
CC1CCN(C(=O)c2ccc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc2)CC1	ZINC000450791259	FD	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc2)CC1	ZINC000450791259	FD	On-Demand	Anodyne	L3MBTL3	55	40
Cc1cnc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc1C	ZINC000450791265	CC	On-Demand	Anodyne	SORD	42	33
CC(=O)CCCCCn1cnc2c(cnn2-c2cccc(C(F)(F)F)c2)c1=O	ZINC000450791278	GH	On-Demand	Anodyne	NPY5R	17	44
CC(=O)CCCCCn1cnc2c(cnn2-c2cccc(C(F)(F)F)c2)c1=O	ZINC000450791278	GH	On-Demand	Anodyne	GALR3	44	31
COc1ccc2c(c1)CN(c1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])CCO2	ZINC000450791279	GG	On-Demand	Bother	TAAR1	27	54
COc1cccc2c(N[C@H]3CC34CCOCC4)cc(C)nc12	ZINC000450791284	CH	On-Demand	Anodyne	BDKRB2	50	32
COc1cccc2c(N[C@@H]3CC34CCOCC4)cc(C)nc12	ZINC000450791285	CH	On-Demand	Anodyne	BDKRB2	50	32
C[C@]1(CNC(=O)[C@H]2CC2(F)F)CCCN1Cc1ccccc1	ZINC000450791306	DF	On-Demand	Anodyne	NPFFR1	46	36
C[C@]1(CNC(=O)[C@H]2CC2(F)F)CCCN1Cc1ccccc1	ZINC000450791306	DF	On-Demand	Anodyne	SLC12A5	59	37
C[C@]1(CNC(=O)[C@@H]2CC2(F)F)CCCN1Cc1ccccc1	ZINC000450791326	DF	On-Demand	Anodyne	NPFFR1	46	36
C[C@]1(CNC(=O)[C@@H]2CC2(F)F)CCCN1Cc1ccccc1	ZINC000450791326	DF	On-Demand	Anodyne	SLC12A5	59	37
C[C@@]1(CNC(=O)[C@@H]2CC2(F)F)CCCN1Cc1ccccc1	ZINC000450791328	DF	On-Demand	Anodyne	NPFFR1	46	36
C[C@@]1(CNC(=O)[C@@H]2CC2(F)F)CCCN1Cc1ccccc1	ZINC000450791328	DF	On-Demand	Anodyne	SLC12A5	59	37
C[C@@]1(CNC(=O)[C@H]2CC2(F)F)CCCN1Cc1ccccc1	ZINC000450791330	DF	On-Demand	Anodyne	NPFFR1	46	36
C[C@@]1(CNC(=O)[C@H]2CC2(F)F)CCCN1Cc1ccccc1	ZINC000450791330	DF	On-Demand	Anodyne	SLC12A5	59	37
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450791337	EE	On-Demand	Anodyne	APP	18	45
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450791337	EE	On-Demand	Anodyne	MMP1	22	46
CCC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450791338	EE	On-Demand	Anodyne	APP	18	45
CCC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450791338	EE	On-Demand	Anodyne	MMP1	22	46
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450791340	EE	On-Demand	Anodyne	APP	18	45
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450791340	EE	On-Demand	Anodyne	MMP1	22	46
CCC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450791342	EE	On-Demand	Anodyne	APP	18	45
CCC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450791342	EE	On-Demand	Anodyne	MMP1	22	46
CCc1cc(N[C@H]2CCc3nc(-c4ccc(F)cc4F)cn3C2)n2ncnc2n1	ZINC000450791343	GG	On-Demand	Anodyne	DHOD	0	46
O=C(c1nc2ccccc2nc1C1CC1)N1CCC(CCCn2ccnc2)CC1	ZINC000450791348	GI	On-Demand	Anodyne	TBXAS1	45	40
O=C(c1nc2ccccc2nc1C1CC1)N1CCC(CCCn2ccnc2)CC1	ZINC000450791348	GI	On-Demand	Anodyne	HMOX2	47	38
CCc1cc(N[C@@H]2CCc3nc(-c4ccc(F)cc4F)cn3C2)n2ncnc2n1	ZINC000450791350	GG	On-Demand	Anodyne	DHOD	0	46
CC(C)c1nccc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450791355	CD	On-Demand	Anodyne	SORD	91	50
C[C@H]1CN(c2nccc(-c3cnccn3)n2)C[C@@H](C)N1CCO	ZINC000450791358	DC	On-Demand	Anodyne	SORD	58	35
CCOC(=O)c1c[nH]c2ccccc2c1=N[C@H]1CCO[C@H](c2cccnc2)C1	ZINC000450791363	GH	On-Demand	Anodyne	PTAFR	31	42
CCOC(=O)c1c[nH]c2ccccc2c1=N[C@H]1CCO[C@@H](c2cccnc2)C1	ZINC000450791366	GH	On-Demand	Anodyne	PTAFR	31	42
CCOC(=O)c1c[nH]c2ccccc2c1=N[C@@H]1CCO[C@@H](c2cccnc2)C1	ZINC000450791369	GH	On-Demand	Anodyne	PTAFR	31	42
CCOC(=O)c1c[nH]c2ccccc2c1=N[C@@H]1CCO[C@H](c2cccnc2)C1	ZINC000450791372	GH	On-Demand	Anodyne	PTAFR	31	42
CC(=O)Nc1ncccc1NC(=O)CCCC(=O)C1CC1	ZINC000450791386	CE	On-Demand	Anodyne	BDKRB1	0	42
CC(=O)Nc1ncccc1NC(=O)CCCC(=O)C1CC1	ZINC000450791386	CE	On-Demand	Anodyne	MAP1	22	43
C[C@]1(CNC(=O)CC[C@H]2CCC(=O)N2)CCCN1Cc1ccccc1	ZINC000450791388	EE	On-Demand	Anodyne	NPFFR1	45	36
CC[C@H](N=c1cc(C)[nH]c2ccc(F)cc12)[C@H](C)O	ZINC000450791391	CF	On-Demand	Anodyne	MPO	53	31
C[C@@]1(CNC(=O)CC[C@H]2CCC(=O)N2)CCCN1Cc1ccccc1	ZINC000450791392	EE	On-Demand	Anodyne	NPFFR1	45	36
CC[C@@H](N=c1cc(C)[nH]c2ccc(F)cc12)[C@H](C)O	ZINC000450791393	CF	On-Demand	Anodyne	MPO	53	31
CC[C@H](N=c1cc(C)[nH]c2ccc(F)cc12)[C@@H](C)O	ZINC000450791394	CF	On-Demand	Anodyne	MPO	53	31
C[C@@]1(CNC(=O)CC[C@@H]2CCC(=O)N2)CCCN1Cc1ccccc1	ZINC000450791395	EE	On-Demand	Anodyne	NPFFR1	45	36
CC[C@@H](N=c1cc(C)[nH]c2ccc(F)cc12)[C@@H](C)O	ZINC000450791396	CF	On-Demand	Anodyne	MPO	53	31
COCC(COC)Nc1nccc(-c2ccc(OC)cc2)n1	ZINC000450791397	DE	On-Demand	Anodyne	CLK4	24	53
C[C@]1(CNC(=O)CC[C@@H]2CCC(=O)N2)CCCN1Cc1ccccc1	ZINC000450791398	EE	On-Demand	Anodyne	NPFFR1	45	36
CCN(C[C@@H](O)C(F)(F)F)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450791401	GF	On-Demand	Anodyne	TRPC6	52	32
CCN(C[C@@H](O)C(F)(F)F)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450791401	GF	On-Demand	Anodyne	TRPC3	46	32
CCN(C[C@H](O)C(F)(F)F)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450791408	GF	On-Demand	Anodyne	TRPC6	52	32
CCN(C[C@H](O)C(F)(F)F)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450791408	GF	On-Demand	Anodyne	TRPC3	46	32
C[C@H]1CN(c2ccnc(N(C)C)n2)C[C@@H](C)N1CCO	ZINC000450791416	CC	On-Demand	Anodyne	SORD	64	47
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2CC(C)C)cs1	ZINC000450791440	CH	On-Demand	Anodyne	COLA	18	40
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2CC(C)C)cs1	ZINC000450791440	CH	On-Demand	Anodyne	CPT1A	17	40
CCOC[C@H](C)NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450791446	CE	On-Demand	Anodyne	SDH1	0	40
COc1ccc2c(c1)CN(c1ccccc1[N+](=O)[O-])CCO2	ZINC000450791447	DG	On-Demand	Bother	TAAR1	17	45
CCOC[C@H](C)NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450791451	CE	On-Demand	Anodyne	SDH1	0	40
CNC(=O)c1ccc([C@@H]2CCCCN2Cc2ccc(Cl)c(OC)c2)n1C	ZINC000450791536	GH	On-Demand	Anodyne	DRD2	46	37
CNC(=O)c1ccc([C@H]2CCCCN2Cc2ccc(Cl)c(OC)c2)n1C	ZINC000450791538	GH	On-Demand	Anodyne	DRD2	46	37
CN1CCN(S(=O)(=O)c2ccc(N3CC(C)(CO)C3)c([N+](=O)[O-])c2)CC1	ZINC000450791539	GC	On-Demand	Bother	NOD2	18	40
COCC(COC)Nc1ncc([N+](=O)[O-])c(N)n1	ZINC000450791541	CB	On-Demand	Bother	PRKCQ	40	40
COCC(COC)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450791545	ED	On-Demand	Bother	TAAR1	19	53
COCC(COC)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450791554	CE	On-Demand	Anodyne	UTS2R	30	47
CN(CCN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)Cc1ccccc1	ZINC000450791556	FG	On-Demand	Anodyne	CHRNA2	40	41
CN(CCN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1)Cc1ccccc1	ZINC000450791556	FG	On-Demand	Anodyne	CRTY	0	41
C=C(C)CNC(=O)c1cccc(CC)n1	ZINC000450791578	BD	On-Demand	Mild	PDE5A	25	47
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)CC12CCC(CC1)C2	ZINC000450791580	DH	On-Demand	Anodyne	CHRNA2	39	40
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)CC12CCC(CC1)C2	ZINC000450791580	DH	On-Demand	Anodyne	CRTY	0	40
CCOc1nc2ccc(C(=O)Nc3ccc4c(c3)CCN4C(=O)COC)cc2[nH]1	ZINC000450791583	GF	On-Demand	Anodyne	AVPR2	17	40
CCOc1nc2ccc(C(=O)Nc3ccc4c(c3)CCN4C(=O)COC)cc2[nH]1	ZINC000450791583	GF	On-Demand	Anodyne	EIF2AK3	35	43
CCOc1nc2ccc(C(=O)Nc3ccc4c(c3)CCN4C(=O)COC)cc2[nH]1	ZINC000450791583	GF	On-Demand	Anodyne	NOD2	40	37
COCC(COC)N=c1cc(C)[nH]c2ccc(F)cc12	ZINC000450791584	CE	On-Demand	Anodyne	MPO	47	32
O=C(CCCN1CCC(Cn2cncn2)CC1)c1ccc(F)cc1	ZINC000450791585	EF	On-Demand	Anodyne	DRD2	30	45
O=C(CCCN1CCC(Cn2cncn2)CC1)c1ccc(F)cc1	ZINC000450791585	EF	On-Demand	Anodyne	DRD1	0	47
O=C(CCCN1CCC(Cn2cncn2)CC1)c1ccc(F)cc1	ZINC000450791585	EF	On-Demand	Anodyne	DRD4	24	46
O=C(CCCN1CCC(Cn2cncn2)CC1)c1ccc(F)cc1	ZINC000450791585	EF	On-Demand	Anodyne	HTR2A	29	52
O=C(CCCN1CCC(Cn2cncn2)CC1)c1ccc(F)cc1	ZINC000450791585	EF	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCC(Cn2cncn2)CC1)c1ccc(F)cc1	ZINC000450791585	EF	On-Demand	Anodyne	CYP2J2	57	40
CNC(=O)c1ccc(N2C[C@H](C)N(CCO)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450791590	EC	On-Demand	Bother	TAAR1	17	41
Cc1cc(N2C[C@H]3CCN(C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000450791596	CE	On-Demand	Bother	CHRNA7	16	42
CCOC(=O)c1ccc(C#N)c(S[C@H](C)C(=O)Nc2nccs2)n1	ZINC000450791597	FF	On-Demand	Mild	MAP1	79	37
CCOC(=O)c1ccc(C#N)c(S[C@@H](C)C(=O)Nc2nccs2)n1	ZINC000450791598	FF	On-Demand	Mild	MAP1	79	37
CN(Cc1ccccc1OC1CC1)[C@@H]1CCCC[C@H]1O	ZINC000450791600	CF	On-Demand	Anodyne	SLC5A4	52	33
CCOC(=O)c1ccc(C#N)c(SCC2(OC)CCC2)n1	ZINC000450791609	DF	On-Demand	Mild	HSP90AB1	40	31
CCOc1ccc(NC(=O)C(C)(C)OC(C)C)cc1Br	ZINC000450791624	EH	On-Demand	Anodyne	ENPP1	62	35
CCOc1ccc(NC(=O)C(C)(C)OC(C)C)cc1Br	ZINC000450791624	EH	On-Demand	Anodyne	KCNK3	46	42
CCOc1ccc(NC(=O)C(C)(C)OC(C)C)cc1Br	ZINC000450791624	EH	On-Demand	Anodyne	KCNK9	40	42
COC(=O)[C@@]1(C)CCCN1CC/C=C\c1ccccc1	ZINC000450791631	CG	On-Demand	Anodyne	SLC12A5	48	36
COC(=O)[C@]1(C)CCCN1CC/C=C/c1ccccc1	ZINC000450791632	CG	On-Demand	Anodyne	SLC12A5	48	36
CCCc1cc(NC(COC)COC)n2ncnc2n1	ZINC000450791633	CD	On-Demand	Anodyne	DHOD	0	44
COC(=O)[C@]1(C)CCCN1CC/C=C\c1ccccc1	ZINC000450791634	CG	On-Demand	Anodyne	SLC12A5	48	36
COC(=O)[C@@]1(C)CCCN1CC/C=C/c1ccccc1	ZINC000450791635	CG	On-Demand	Anodyne	SLC12A5	48	36
CCN1C[C@H](Nc2ncnc3c(F)cccc23)CC1=O	ZINC000450791664	CD	On-Demand	Anodyne	JAK1	17	40
CCN1C[C@@H](Nc2ncnc3c(F)cccc23)CC1=O	ZINC000450791665	CD	On-Demand	Anodyne	JAK1	17	40
CC(C)Cn1cc(C(=O)NCc2ccc(Cl)cc2F)c(C(F)F)n1	ZINC000450791666	FI	On-Demand	Anodyne	P2RX7	60	41
C[C@H](O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450791674	CE	On-Demand	Anodyne	SLC6A3	15	40
C[C@H](O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450791675	CE	On-Demand	Anodyne	SLC6A3	15	40
O=C(NCc1ccc(Cl)cc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450791689	GH	On-Demand	Anodyne	P2RX7	44	42
O=C(NCc1ccc(Cl)cc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450791689	GH	On-Demand	Anodyne	EPHX2	26	42
O=C(NCc1ccc(Cl)cc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450791689	GH	On-Demand	Anodyne	SCN10A	36	48
O=C(NCc1ccc(Cl)cc1F)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450791689	GH	On-Demand	Anodyne	AKR1C3	0	41
C=C(C)CNC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450791696	CF	On-Demand	Mild	GRIN2B	0	43
C=C(C)CNC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450791696	CF	On-Demand	Mild	AKR1C2	41	34
C=C(C)CNC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450791696	CF	On-Demand	Mild	KCNK3	20	41
C=C(C)CNC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450791696	CF	On-Demand	Mild	KCNK9	20	41
COc1ccc(F)cc1CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450791701	CF	On-Demand	Anodyne	GRIN2B	30	44
COc1ccc(F)cc1CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450791701	CF	On-Demand	Anodyne	P2RX7	40	41
CCCc1cc(N2CC(C)(CO)C2)c2ccccc2n1	ZINC000450791719	CG	On-Demand	Anodyne	METAP1	41	35
Cc1ccnc(N2C[C@H](C)N(CCO)[C@H](C)C2)c1	ZINC000450791725	BD	On-Demand	Anodyne	SORD	54	37
CC(=O)Nc1ncccc1NC(=O)C1CC(C)(O)C1	ZINC000450791743	CD	On-Demand	Anodyne	G2YM83_BOTF4	61	35
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	F2	49	41
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	FKBP1A	29	51
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	ITGA4	37	41
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	CAPNS1	22	44
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	MMP3	24	41
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	CAPN1	18	49
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	MMP1	26	41
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	SFRP1	94	34
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	WNT3	72	34
NC(=O)c1coc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1	ZINC000450791751	GC	On-Demand	Anodyne	TMPRSS11D	69	39
CC1(CO)CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450791760	CD	On-Demand	Anodyne	RBP4	20	47
COc1cc(CC(=O)N2CCN(CC(C)C)C(=O)C2)ccc1Cl	ZINC000450791765	EE	On-Demand	Anodyne	OPRK1	41	45
COc1cc(CC(=O)N2CCN(CC(C)C)C(=O)C2)ccc1Cl	ZINC000450791765	EE	On-Demand	Anodyne	CCR1	29	41
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(N2CCC2)nc1	ZINC000450791773	GF	On-Demand	Anodyne	HDAC1	0	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(N2CCC2)nc1	ZINC000450791773	GF	On-Demand	Anodyne	HPGDS	26	40
CC1(CO)CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450791783	DE	On-Demand	Anodyne	AVPR1A	29	40
CC(C)NC(=O)c1ccc(N[C@@H]2CCO[C@H](c3ccncc3)C2)c([N+](=O)[O-])c1	ZINC000450791785	GG	On-Demand	Bother	TAAR1	19	41
C[C@@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791786	EG	For-Sale	Anodyne	OPRM1	15	43
C[C@@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791786	EG	For-Sale	Anodyne	OPRK1	15	43
C[C@@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791786	EG	For-Sale	Anodyne	SLC6A9	40	34
C[C@@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791786	EG	For-Sale	Anodyne	SLC6A5	41	34
C[C@@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791786	EG	For-Sale	Anodyne	SLC12A5	42	35
C[C@@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791786	EG	For-Sale	Anodyne	HCN1	61	34
C[C@@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791786	EG	For-Sale	Anodyne	HCN4	48	31
CC(C)NC(=O)c1ccc(N[C@H]2CCO[C@H](c3ccncc3)C2)c([N+](=O)[O-])c1	ZINC000450791787	GG	On-Demand	Bother	TAAR1	19	41
C[C@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791788	EG	For-Sale	Anodyne	OPRM1	15	43
C[C@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791788	EG	For-Sale	Anodyne	OPRK1	15	43
C[C@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791788	EG	For-Sale	Anodyne	SLC6A9	40	34
C[C@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791788	EG	For-Sale	Anodyne	SLC6A5	41	34
C[C@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791788	EG	For-Sale	Anodyne	SLC12A5	42	35
C[C@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791788	EG	For-Sale	Anodyne	HCN1	61	34
C[C@]1(CNC(=O)c2cc(O)ccc2F)CCCN1Cc1ccccc1	ZINC000450791788	EG	For-Sale	Anodyne	HCN4	48	31
CC(C)NC(=O)c1ccc(N[C@H]2CCO[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1	ZINC000450791789	GG	On-Demand	Bother	TAAR1	19	41
CC(C)NC(=O)c1ccc(N[C@@H]2CCO[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1	ZINC000450791791	GG	On-Demand	Bother	TAAR1	19	41
COc1cc(OC)c2ncnc(N3CC(C)(CO)C3)c2c1	ZINC000450791808	CD	On-Demand	Anodyne	PDE3B	56	34
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	ACE	50	39
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	DRD4	24	42
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	DRD3	0	40
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	MME	57	37
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	PGC	43	30
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	SIGMAR1	32	43
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	TIMP3	61	37
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	ABCB1	29	42
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	CTSE	45	30
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	ACE2	47	33
CO[C@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791814	ED	On-Demand	Anodyne	BIRC2	43	37
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	ACE	50	39
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	DRD4	24	42
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	DRD3	0	40
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	MME	57	37
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	PGC	43	30
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	SIGMAR1	32	43
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	TIMP3	61	37
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	ABCB1	29	42
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	CTSE	45	30
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	ACE2	47	33
CO[C@@H](Cc1ccccc1)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791815	ED	On-Demand	Anodyne	BIRC2	43	37
Cc1ccn(-c2ccccc2C(=O)N2CCN(CC(C)C)C(=O)C2)n1	ZINC000450791816	EE	On-Demand	Anodyne	P2RX7	23	57
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	ACE	50	39
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	DRD4	24	42
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	DRD3	0	40
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	MME	57	37
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	PGC	43	30
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	SIGMAR1	32	43
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	TIMP3	61	37
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	ABCB1	29	42
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	CTSE	45	30
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	ACE2	47	33
CO[C@@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791817	ED	On-Demand	Anodyne	BIRC2	43	37
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	ACE	50	39
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	DRD4	24	42
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	DRD3	0	40
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	MME	57	37
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	PGC	43	30
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	SIGMAR1	32	43
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	TIMP3	61	37
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	ABCB1	29	42
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	CTSE	45	30
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	ACE2	47	33
CO[C@H](Cc1ccccc1)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791818	ED	On-Demand	Anodyne	BIRC2	43	37
Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc2)cc1	ZINC000450791822	FF	On-Demand	Anodyne	PRNP	55	41
Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc2)cc1	ZINC000450791822	FF	On-Demand	Anodyne	HDAC1	29	46
Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc2)cc1	ZINC000450791822	FF	On-Demand	Anodyne	P4HTM	0	48
C[C@H]1CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@@H](C)N1CCO	ZINC000450791831	GE	On-Demand	Anodyne	AVPR2	53	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791885	ED	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791885	ED	On-Demand	Anodyne	BIRC2	42	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791893	ED	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791893	ED	On-Demand	Anodyne	BIRC2	42	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791895	ED	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450791895	ED	On-Demand	Anodyne	BIRC2	42	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791896	ED	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450791896	ED	On-Demand	Anodyne	BIRC2	42	37
CC(C)OCCCCNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450791916	DH	On-Demand	Anodyne	LMGT2	0	42
Cc1ccncc1CNc1cc(N2CCCCC2)ncn1	ZINC000450791940	CF	On-Demand	Anodyne	GALR2	45	34
COc1ccc2c(c1)CN(c1cnn(C)c(=O)c1Cl)CCO2	ZINC000450791942	DD	On-Demand	Anodyne	NPBWR1	45	36
COCC(=O)N1CCc2cc(NC(=O)CC3(O)CCC3)ccc21	ZINC000450791953	DD	On-Demand	Anodyne	NAMPT	0	42
COc1cc2c(N3CCCC[C@@H]3CS(C)(=O)=O)ncnc2cc1F	ZINC000450791957	FE	On-Demand	Anodyne	PDE3A	49	37
COc1cc2c(N3CCCC[C@@H]3CS(C)(=O)=O)ncnc2cc1F	ZINC000450791957	FE	On-Demand	Anodyne	PDGFRB	54	35
COc1cc2c(N3CCCC[C@@H]3CS(C)(=O)=O)ncnc2cc1F	ZINC000450791957	FE	On-Demand	Anodyne	PDE3B	73	38
COc1cc2c(N3CCCC[C@H]3CS(C)(=O)=O)ncnc2cc1F	ZINC000450791961	FE	On-Demand	Anodyne	PDE3A	49	37
COc1cc2c(N3CCCC[C@H]3CS(C)(=O)=O)ncnc2cc1F	ZINC000450791961	FE	On-Demand	Anodyne	PDGFRB	54	35
COc1cc2c(N3CCCC[C@H]3CS(C)(=O)=O)ncnc2cc1F	ZINC000450791961	FE	On-Demand	Anodyne	PDE3B	73	38
CC[C@@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450791965	DE	On-Demand	Bother	TAAR1	18	50
CC[C@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450791967	DE	On-Demand	Bother	TAAR1	18	50
CC[C@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450791968	DE	On-Demand	Bother	TAAR1	18	50
CC[C@@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450791970	DE	On-Demand	Bother	TAAR1	18	50
Cc1ccncc1CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F	ZINC000450791972	EG	On-Demand	Anodyne	PTGS2	23	42
Cc1ccncc1CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F	ZINC000450791972	EG	On-Demand	Anodyne	PTK2	55	41
CCOC(=O)c1ccc(CSc2cccc(OC)c2)nc1	ZINC000450791985	DH	On-Demand	Anodyne	P2RY12	18	44
CCOC(=O)c1ccc(CSc2cccc(OC)c2)nc1	ZINC000450791985	DH	On-Demand	Anodyne	LTB4R	17	45
CCOC(=O)c1ccc(CSc2cccc(OC)c2)nc1	ZINC000450791985	DH	On-Demand	Anodyne	MTNR1A	19	44
CCOC(=O)c1ccc(CSc2cccc(OC)c2)nc1	ZINC000450791985	DH	On-Demand	Anodyne	MTNR1B	21	44
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3Cc4c(C)cccc4O3)ccc21	ZINC000450791992	FE	On-Demand	Anodyne	NAMPT	19	40
COCC(=O)N1CCc2cc(NC(=O)[C@H]3Cc4c(C)cccc4O3)ccc21	ZINC000450791994	FE	On-Demand	Anodyne	NAMPT	19	40
CS(=O)(=O)C[C@@H]1CCCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450791999	FE	On-Demand	Anodyne	SCD1	40	41
CS(=O)(=O)C[C@@H]1CCCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450791999	FE	On-Demand	Anodyne	SCD	32	41
CS(=O)(=O)C[C@H]1CCCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450792000	FE	On-Demand	Anodyne	SCD1	40	41
CS(=O)(=O)C[C@H]1CCCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450792000	FE	On-Demand	Anodyne	SCD	32	41
COc1ccc2c(c1)CN(c1ccc(C(=O)NC3CC3)cc1[N+](=O)[O-])CCO2	ZINC000450792042	GF	On-Demand	Bother	TAAR1	24	53
COCC(=O)N1CCc2cc(NC(=O)C3CC(C)(O)C3)ccc21	ZINC000450792054	DD	On-Demand	Anodyne	NAMPT	28	46
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3CCCCC3(F)F)ccc21	ZINC000450792055	FF	On-Demand	Anodyne	NAMPT	29	43
COc1cc(CC(=O)N2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450792056	ED	On-Demand	Anodyne	OPRM1	0	41
COc1cc(CC(=O)N2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450792056	ED	On-Demand	Anodyne	OPRK1	22	41
COc1cc(CC(=O)N2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450792056	ED	On-Demand	Anodyne	HTR4	45	34
COc1cc(CC(=O)N2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450792056	ED	On-Demand	Anodyne	CCR1	22	45
COc1cc(CC(=O)N2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450792056	ED	On-Demand	Anodyne	KCNJ1	43	38
COCC(=O)N1CCc2cc(NC(=O)[C@H]3CCCCC3(F)F)ccc21	ZINC000450792057	FF	On-Demand	Anodyne	NAMPT	29	43
COCC(COC)Nc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450792059	DG	On-Demand	Mild	SRC	41	36
COCC(COC)Nc1c(C#N)cnc2c(Cl)cc(C)cc12	ZINC000450792059	DG	On-Demand	Mild	MAP3K8	73	36
COCC(COC)Nc1ccc(C(C)=O)cn1	ZINC000450792078	BD	On-Demand	Anodyne	GCK	25	40
Cc1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc(C(C)C)n1	ZINC000450792080	CD	On-Demand	Anodyne	SORD	35	42
O=C(c1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450792094	GD	On-Demand	Bother	L3MBTL1	0	40
CC(C)NC(=O)c1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)c([N+](=O)[O-])c1	ZINC000450792095	FE	On-Demand	Bother	TAAR1	19	42
CCOc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1Br	ZINC000450792096	FH	On-Demand	Anodyne	GUAB	0	42
CCOc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1Br	ZINC000450792096	FH	On-Demand	Anodyne	GRM4	42	42
CCOc1ccc(NC(=O)[C@@H](C)Oc2ccccn2)cc1Br	ZINC000450792096	FH	On-Demand	Anodyne	IMDH_CRYPV	38	41
CCOc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1Br	ZINC000450792097	FH	On-Demand	Anodyne	GUAB	0	42
CCOc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1Br	ZINC000450792097	FH	On-Demand	Anodyne	GRM4	42	42
CCOc1ccc(NC(=O)[C@H](C)Oc2ccccn2)cc1Br	ZINC000450792097	FH	On-Demand	Anodyne	IMDH_CRYPV	38	41
COc1cc(Br)ccc1CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450792147	GG	On-Demand	Anodyne	MME	49	44
COc1cc(Br)ccc1CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450792147	GG	On-Demand	Anodyne	ANPEP	38	41
COc1cc(Br)ccc1CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450792147	GG	On-Demand	Anodyne	PAPA1_CARPA	46	34
COc1cc(Br)ccc1CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450792147	GG	On-Demand	Anodyne	AMP1_PLAFQ	62	42
COc1cc(Br)ccc1CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450792147	GG	On-Demand	Anodyne	PHES	0	40
COc1cc(Br)ccc1CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450792148	GG	On-Demand	Anodyne	MME	49	44
COc1cc(Br)ccc1CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450792148	GG	On-Demand	Anodyne	ANPEP	38	41
COc1cc(Br)ccc1CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450792148	GG	On-Demand	Anodyne	PAPA1_CARPA	46	34
COc1cc(Br)ccc1CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450792148	GG	On-Demand	Anodyne	AMP1_PLAFQ	62	42
COc1cc(Br)ccc1CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450792148	GG	On-Demand	Anodyne	PHES	0	40
COc1ccc(F)cc1CNC(=O)C(C)(C)C1CCC1	ZINC000450792157	CG	On-Demand	Anodyne	GRIN2B	37	42
COc1ccc(F)cc1CNC(=O)C(C)(C)C1CCC1	ZINC000450792157	CG	On-Demand	Anodyne	MT-ND1	16	43
COc1ccc(F)cc1CNC(=O)C(C)(C)C1CCC1	ZINC000450792157	CG	On-Demand	Anodyne	ACKR3	40	32
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C(C)(C)C1=O	ZINC000450792185	GD	On-Demand	Anodyne	MTNR1A	57	41
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C(C)(C)C1=O	ZINC000450792185	GD	On-Demand	Anodyne	MTNR1B	46	41
COc1ccc(F)cc1CNC(=O)CC1CC(F)(F)C1	ZINC000450792188	CF	On-Demand	Anodyne	GRIN2B	29	40
COc1ccc(F)cc1CNC(=O)CC1CC(F)(F)C1	ZINC000450792188	CF	On-Demand	Anodyne	P2RX7	53	40
CC(C)NC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450792189	ED	On-Demand	Bother	TAAR1	28	48
COc1ccc(F)cc1CNC(=O)C[C@H]1CSc2ccccc2O1	ZINC000450792190	EG	On-Demand	Anodyne	P2RX7	43	39
COc1ccc(F)cc1CNC(=O)C[C@@H]1CSc2ccccc2O1	ZINC000450792191	EG	On-Demand	Anodyne	P2RX7	43	39
OCC[C@H]1CCCN1CCc1c(Cl)cccc1Cl	ZINC000450792192	CG	On-Demand	Anodyne	SLC18A2	47	40
OCC[C@@H]1CCCN1CCc1c(Cl)cccc1Cl	ZINC000450792193	CG	On-Demand	Anodyne	SLC18A2	47	40
CCOC(=O)c1ccc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)nc1	ZINC000450792200	FE	On-Demand	Anodyne	SSTR5	41	35
COC(=O)C(C)(C)N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450792224	ED	On-Demand	Anodyne	ABCB1	40	35
COC(=O)C(C)(C)N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450792225	ED	On-Demand	Anodyne	ABCB1	40	35
C=CCN(C)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450792226	DE	On-Demand	Mild	NR3C2	17	40
C=CCN(C)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450792227	DE	On-Demand	Mild	NR3C2	17	40
COc1ccc(F)cc1CNC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450792228	CD	On-Demand	Anodyne	GRIN2B	30	42
COc1ccc(F)cc1CNC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450792228	CD	On-Demand	Anodyne	HTR7	16	40
COc1ccc(F)cc1CNC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450792228	CD	On-Demand	Anodyne	P2RX7	64	50
COc1ccc(F)cc1CNC(=O)CC[C@H]1CCC(=O)N1	ZINC000450792229	CD	On-Demand	Anodyne	GRIN2B	30	42
COc1ccc(F)cc1CNC(=O)CC[C@H]1CCC(=O)N1	ZINC000450792229	CD	On-Demand	Anodyne	HTR7	16	40
COc1ccc(F)cc1CNC(=O)CC[C@H]1CCC(=O)N1	ZINC000450792229	CD	On-Demand	Anodyne	P2RX7	64	50
CC1(CO)CN(c2nc(-c3ccccc3)ns2)C1	ZINC000450792255	CE	On-Demand	Anodyne	FAAH	0	49
CS[C@H](CNC(=O)c1ccc(N2CCC2)nc1)C(C)(C)C	ZINC000450792283	DF	On-Demand	Anodyne	HPGDS	16	44
CS[C@@H](CNC(=O)c1ccc(N2CCC2)nc1)C(C)(C)C	ZINC000450792284	DF	On-Demand	Anodyne	HPGDS	16	44
Nc1nc(N[C@H]2CCO[C@@H](c3ccncc3)C2)ncc1[N+](=O)[O-]	ZINC000450792303	DD	On-Demand	Bother	PRKCQ	43	36
Nc1nc(N[C@H]2CCO[C@H](c3ccncc3)C2)ncc1[N+](=O)[O-]	ZINC000450792304	DD	On-Demand	Bother	PRKCQ	43	36
Nc1nc(N[C@@H]2CCO[C@H](c3ccncc3)C2)ncc1[N+](=O)[O-]	ZINC000450792305	DD	On-Demand	Bother	PRKCQ	43	36
Nc1nc(N[C@@H]2CCO[C@@H](c3ccncc3)C2)ncc1[N+](=O)[O-]	ZINC000450792306	DD	On-Demand	Bother	PRKCQ	43	36
Cc1nc2ccnn2cc1C(=O)N1CCN(CC(C)C)C(=O)C1	ZINC000450792315	DC	On-Demand	Anodyne	P2RX7	0	57
Cc1c(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cnn1[C@@H]1CCOC1	ZINC000450792335	FH	On-Demand	Bother	AADAC	0	41
Cc1c(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cnn1[C@H]1CCOC1	ZINC000450792337	FH	On-Demand	Bother	AADAC	0	41
CCOC[C@H](C)NC(=O)c1ccc2cnccc2c1	ZINC000450792339	CE	On-Demand	Anodyne	AKT1	25	48
CCCOc1ccc(C(=O)Nc2cccnc2NC(C)=O)c(OC)c1	ZINC000450792351	EG	On-Demand	Anodyne	KCNK3	41	37
CCCOc1ccc(C(=O)Nc2cccnc2NC(C)=O)c(OC)c1	ZINC000450792351	EG	On-Demand	Anodyne	G2YM83_BOTF4	64	33
Cc1nc(-c2cccnc2)nc(N2C[C@H](C)N(CCO)[C@H](C)C2)c1C	ZINC000450792363	EE	On-Demand	Anodyne	ROS1	44	36
COc1cc(-c2noc(CN3CCC[C@H]3CN(C(C)=O)C3CC3)n2)ncn1	ZINC000450792366	FD	On-Demand	Anodyne	ACKR3	54	30
COc1cc(-c2noc(CN3CCC[C@@H]3CN(C(C)=O)C3CC3)n2)ncn1	ZINC000450792367	FD	On-Demand	Anodyne	ACKR3	54	30
C[C@]1(CNC(=O)c2ccn(CCn3cccn3)n2)CCCN1Cc1ccccc1	ZINC000450792378	GF	On-Demand	Anodyne	HCN1	72	35
C[C@]1(CNC(=O)c2ccn(CCn3cccn3)n2)CCCN1Cc1ccccc1	ZINC000450792378	GF	On-Demand	Anodyne	HCN4	50	32
C[C@@]1(CNC(=O)c2ccn(CCn3cccn3)n2)CCCN1Cc1ccccc1	ZINC000450792379	GF	On-Demand	Anodyne	HCN1	72	35
C[C@@]1(CNC(=O)c2ccn(CCn3cccn3)n2)CCCN1Cc1ccccc1	ZINC000450792379	GF	On-Demand	Anodyne	HCN4	50	32
Nc1nc(N[C@H]2CCO[C@@H](c3cccnc3)C2)ncc1[N+](=O)[O-]	ZINC000450792383	DD	On-Demand	Bother	PRKCQ	43	37
Nc1nc(N[C@H]2CCO[C@H](c3cccnc3)C2)ncc1[N+](=O)[O-]	ZINC000450792384	DD	On-Demand	Bother	PRKCQ	43	37
Nc1nc(N[C@@H]2CCO[C@H](c3cccnc3)C2)ncc1[N+](=O)[O-]	ZINC000450792385	DD	On-Demand	Bother	PRKCQ	43	37
Nc1nc(N[C@@H]2CCO[C@@H](c3cccnc3)C2)ncc1[N+](=O)[O-]	ZINC000450792386	DD	On-Demand	Bother	PRKCQ	43	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(Cn2cncn2)CC1	ZINC000450792395	FG	On-Demand	Anodyne	CACNA1B	41	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(Cn2cncn2)CC1	ZINC000450792395	FG	On-Demand	Anodyne	LIPG	43	35
CCOC[C@H](C)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450792420	CG	On-Demand	Anodyne	GPR88	0	40
CCOC[C@H](C)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450792421	CG	On-Demand	Anodyne	GPR88	0	40
CCOC[C@H](C)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450792422	CG	On-Demand	Anodyne	GPR88	0	40
CCOC[C@H](C)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450792423	CG	On-Demand	Anodyne	GPR88	0	40
Cc1cccc2ncnc(N3C[C@H](C)N(CCO)[C@H](C)C3)c12	ZINC000450792429	DD	On-Demand	Anodyne	LIMK2	61	35
C[C@@H]1CN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC[C@H]1O	ZINC000450792430	FD	On-Demand	Mild	AR	28	45
C[C@@H]1CN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC[C@@H]1O	ZINC000450792433	FD	On-Demand	Mild	AR	28	45
C[C@@H]1CN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC[C@@H]1O	ZINC000450792434	FD	On-Demand	Mild	AR	28	45
C[C@@H]1CN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC[C@H]1O	ZINC000450792435	FD	On-Demand	Mild	AR	28	45
O=C(CC1CC(F)(F)C1)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450792438	FF	On-Demand	Anodyne	ENV	40	32
c1ccc(-c2csc3ncnc(N[C@H]4CC45CCOCC5)c23)cc1	ZINC000450792447	EI	On-Demand	Anodyne	ADRB3	27	40
c1ccc(-c2csc3ncnc(N[C@@H]4CC45CCOCC5)c23)cc1	ZINC000450792449	EI	On-Demand	Anodyne	ADRB3	27	40
CCOC(=O)c1cc(C(=O)Nc2ccc3c(c2)CCN3C(=O)COC)on1	ZINC000450792459	FD	On-Demand	Anodyne	EIF2AK3	46	36
O=C(N[C@H]1CCn2ccnc2C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450792471	EG	On-Demand	Anodyne	RBP4	44	37
COCC(COC)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450792481	EE	On-Demand	Anodyne	NPBWR1	59	48
Clc1ccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc2c1	ZINC000450792482	DG	On-Demand	Anodyne	ANPEP	0	45
Clc1ccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc2c1	ZINC000450792482	DG	On-Demand	Anodyne	HRP1_PLAFA	145	55
Clc1ccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc2c1	ZINC000450792482	DG	On-Demand	Anodyne	BOTA	43	55
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@@H](C)O	ZINC000450792488	DE	On-Demand	Anodyne	TACR2	24	41
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@@H](C)O	ZINC000450792488	DE	On-Demand	Anodyne	TACR3	55	38
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@@H](C)O	ZINC000450792488	DE	On-Demand	Anodyne	TNKS	56	32
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@@H](C)O	ZINC000450792490	DE	On-Demand	Anodyne	TACR2	24	41
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@@H](C)O	ZINC000450792490	DE	On-Demand	Anodyne	TACR3	55	38
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@@H](C)O	ZINC000450792490	DE	On-Demand	Anodyne	TNKS	56	32
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@H](C)O	ZINC000450792492	DE	On-Demand	Anodyne	TACR2	24	41
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@H](C)O	ZINC000450792492	DE	On-Demand	Anodyne	TACR3	55	38
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@H](C)O	ZINC000450792492	DE	On-Demand	Anodyne	TNKS	56	32
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@H](C)O	ZINC000450792494	DE	On-Demand	Anodyne	TACR2	24	41
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@H](C)O	ZINC000450792494	DE	On-Demand	Anodyne	TACR3	55	38
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)[C@H](C)O	ZINC000450792494	DE	On-Demand	Anodyne	TNKS	56	32
COCCNC(=O)c1ccc(NC(COC)COC)nc1	ZINC000450792518	CC	On-Demand	Anodyne	EPHX2	0	42
O=C(c1ccc(Oc2ccc(Cl)cc2)cn1)N1CC2(CCCC2)C1	ZINC000450792519	EJ	On-Demand	Anodyne	FAAH	15	40
COCC(COC)Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450792520	DC	On-Demand	Bother	F2RL3	46	35
CCOC(=O)c1ccc(N2CCOc3ccc(OC)cc3C2)nc1	ZINC000450792530	EF	On-Demand	Anodyne	P2RY12	23	40
CC[C@@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)[C@@H](C)O	ZINC000450792548	GG	On-Demand	Anodyne	PDS	37	66
CC[C@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)[C@H](C)O	ZINC000450792549	GG	On-Demand	Anodyne	PDS	37	66
CC[C@@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)[C@H](C)O	ZINC000450792550	GG	On-Demand	Anodyne	PDS	37	66
CC[C@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)[C@@H](C)O	ZINC000450792551	GG	On-Demand	Anodyne	PDS	37	66
CCOc1ccc(-c2nnn(CC[C@H](C)O)n2)cc1	ZINC000450792561	CD	On-Demand	Anodyne	SCARB1	41	35
CCOc1ccc(-c2nnn(CC[C@@H](C)O)n2)cc1	ZINC000450792562	CD	On-Demand	Anodyne	SCARB1	41	35
Cc1nc([C@@H]2CCCN2C(=O)C[C@@H]2CSc3ccccc3O2)cs1	ZINC000450792572	FI	On-Demand	Anodyne	COLA	91	44
Cc1nc([C@@H]2CCCN2C(=O)C[C@@H]2CSc3ccccc3O2)cs1	ZINC000450792572	FI	On-Demand	Anodyne	CPT1A	86	44
Cc1nc([C@@H]2CCCN2C(=O)C[C@H]2CSc3ccccc3O2)cs1	ZINC000450792573	FI	On-Demand	Anodyne	COLA	91	44
Cc1nc([C@@H]2CCCN2C(=O)C[C@H]2CSc3ccccc3O2)cs1	ZINC000450792573	FI	On-Demand	Anodyne	CPT1A	86	44
C[C@H]1CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H](C)N1CCO	ZINC000450792577	GB	On-Demand	Anodyne	GCK	56	32
C[C@H]1CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H](C)N1CCO	ZINC000450792577	GB	On-Demand	Anodyne	GCKR	78	37
CCc1cccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)n1	ZINC000450792581	ED	On-Demand	Anodyne	PDE5A	26	41
CCc1cccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)n1	ZINC000450792581	ED	On-Demand	Anodyne	GRM4	32	43
O=C(N1CCC(CCCn2ccnc2)CC1)C1(Cc2ccccc2)CCOCC1	ZINC000450792582	GH	On-Demand	Anodyne	TBXAS1	46	42
COC(=O)CNC(=O)c1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)c([N+](=O)[O-])c1	ZINC000450792583	GC	On-Demand	Bother	TAAR1	19	42
Cc1ccc(CC(=O)N2CCC[C@H]2c2csc(C)n2)c(Br)c1	ZINC000450792586	GI	On-Demand	Anodyne	COLA	52	41
Cc1ccc(CC(=O)N2CCC[C@H]2c2csc(C)n2)c(Br)c1	ZINC000450792586	GI	On-Demand	Anodyne	CPT1A	50	41
CC1(C)[C@@H](NC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@H]1O	ZINC000450792588	EG	On-Demand	Anodyne	PRCP	46	35
CC1(C)[C@@H](NC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@H]1O	ZINC000450792591	EG	On-Demand	Anodyne	PRCP	46	35
CC1(C)[C@@H](NC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@H]1O	ZINC000450792593	EG	On-Demand	Anodyne	PRCP	46	35
CC1(C)[C@@H](NC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@H]1O	ZINC000450792595	EG	On-Demand	Anodyne	PRCP	46	35
CNC(=O)c1ccc([C@@H]2CCCCN2Cc2nc(-c3cc(C)ccn3)no2)n1C	ZINC000450792597	GF	On-Demand	Anodyne	COLA	42	41
CNC(=O)c1ccc([C@@H]2CCCCN2Cc2nc(-c3cc(C)ccn3)no2)n1C	ZINC000450792597	GF	On-Demand	Anodyne	CPT1A	42	41
CNC(=O)c1ccc([C@H]2CCCCN2Cc2nc(-c3cc(C)ccn3)no2)n1C	ZINC000450792598	GF	On-Demand	Anodyne	COLA	42	41
CNC(=O)c1ccc([C@H]2CCCCN2Cc2nc(-c3cc(C)ccn3)no2)n1C	ZINC000450792598	GF	On-Demand	Anodyne	CPT1A	42	41
CCOC(=O)c1cc(C(=O)Nc2ccn(Cc3ccc(OC)cc3)n2)[nH]c1C	ZINC000450792603	GE	On-Demand	Anodyne	PROKR1	48	32
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450792605	CF	On-Demand	Anodyne	FLT1	0	43
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450792605	CF	On-Demand	Anodyne	PDGFRA	46	38
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450792606	CF	On-Demand	Anodyne	FLT1	0	43
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450792606	CF	On-Demand	Anodyne	PDGFRA	46	38
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450792607	CF	On-Demand	Anodyne	FLT1	0	43
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450792607	CF	On-Demand	Anodyne	PDGFRA	46	38
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450792608	CF	On-Demand	Anodyne	FLT1	0	43
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450792608	CF	On-Demand	Anodyne	PDGFRA	46	38
C[C@H](O)CN1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450792618	FC	On-Demand	Anodyne	AKR1C3	25	40
COCC(COC)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450792628	EE	On-Demand	Anodyne	AVPR2	40	40
COCC(COC)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450792628	EE	On-Demand	Anodyne	AVPR1A	38	41
C[C@@H]1Cc2cccc(C(=O)Nc3ccc(S(=O)(=O)CCO)cc3)c2O1	ZINC000450792642	FE	On-Demand	Anodyne	MTTP	45	34
C[C@H]1Cc2cccc(C(=O)Nc3ccc(S(=O)(=O)CCO)cc3)c2O1	ZINC000450792643	FE	On-Demand	Anodyne	MTTP	45	34
CCN1C[C@@H](Nc2cc(C#N)ccc2C(F)(F)F)CC1=O	ZINC000450792673	CF	On-Demand	Mild	AR	26	40
CCN1C[C@H](Nc2cc(C#N)ccc2C(F)(F)F)CC1=O	ZINC000450792674	CF	On-Demand	Mild	AR	26	40
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792675	DH	On-Demand	Mild	ACACA	23	41
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792675	DH	On-Demand	Mild	CTSF	54	35
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792675	DH	On-Demand	Mild	ACACB	27	41
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792675	DH	On-Demand	Mild	MCHR1	25	42
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792675	DH	On-Demand	Mild	E1	0	40
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792675	DH	On-Demand	Mild	SUCNR1	28	41
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792676	DH	On-Demand	Mild	ACACA	23	41
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792676	DH	On-Demand	Mild	CTSF	59	35
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792676	DH	On-Demand	Mild	ACACB	27	41
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792676	DH	On-Demand	Mild	MCHR1	31	44
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792676	DH	On-Demand	Mild	E1	0	40
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792676	DH	On-Demand	Mild	SUCNR1	28	41
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792677	DH	On-Demand	Mild	ACACA	23	41
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792677	DH	On-Demand	Mild	CTSF	54	35
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792677	DH	On-Demand	Mild	ACACB	27	41
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792677	DH	On-Demand	Mild	MCHR1	25	42
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792677	DH	On-Demand	Mild	E1	0	40
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792677	DH	On-Demand	Mild	SUCNR1	28	41
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792678	DH	On-Demand	Mild	ACACA	23	41
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792678	DH	On-Demand	Mild	CTSF	59	35
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792678	DH	On-Demand	Mild	ACACB	27	41
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792678	DH	On-Demand	Mild	MCHR1	31	44
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792678	DH	On-Demand	Mild	E1	0	40
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000450792678	DH	On-Demand	Mild	SUCNR1	28	41
CCOC(=O)c1ccc(CN2CCC(Cn3cncn3)CC2)nc1	ZINC000450792683	ED	On-Demand	Anodyne	SSTR5	45	36
CCOC(=O)c1ccnc(N2CC(C)(CO)C2)c1[N+](=O)[O-]	ZINC000450792701	CC	On-Demand	Bother	SLC27A4	41	30
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC(C)(CO)C1	ZINC000450792707	EE	On-Demand	Anodyne	ATP4A	25	52
C[C@]1(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CC=CCC1	ZINC000450792711	EH	On-Demand	Anodyne	KCNQ1	0	44
C[C@]1(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CC=CCC1	ZINC000450792711	EH	On-Demand	Anodyne	SPHK1	39	42
C[C@@]1(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CC=CCC1	ZINC000450792713	EH	On-Demand	Anodyne	KCNQ1	0	44
C[C@@]1(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)CC=CCC1	ZINC000450792713	EH	On-Demand	Anodyne	SPHK1	39	42
O=C(NCC(F)(F)F)[C@@H]1CCN(CC2=CCCCC2)C1	ZINC000450792722	CE	On-Demand	Anodyne	CACNA1G	32	40
O=C(NCC(F)(F)F)[C@H]1CCN(CC2=CCCCC2)C1	ZINC000450792723	CE	On-Demand	Anodyne	CACNA1G	32	40
C[C@H](O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450792731	CD	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](O)CN1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450792732	CD	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450792733	CD	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](O)CN1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450792734	CD	On-Demand	Anodyne	SLC6A3	17	40
CC1(CO)CN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450792750	CD	On-Demand	Anodyne	LRRK2	29	41
C=CCN(C)C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450792759	CF	On-Demand	Mild	OPRK1	0	48
CC1(CO)CN(c2ccc(S(=O)(=O)NCC3CC3)cn2)C1	ZINC000450792779	DC	On-Demand	Anodyne	NPY2R	61	38
CC1(CO)CN(c2ncccc2C(=O)Nc2ccc(Br)cc2)C1	ZINC000450792780	GF	On-Demand	Anodyne	TRPV1	22	46
CC1(CO)CN(c2ncccc2C(=O)Nc2ccc(Br)cc2)C1	ZINC000450792780	GF	On-Demand	Anodyne	G2YM83_BOTF4	66	33
COc1ccc(F)cc1CNC(=O)c1cc2c([nH]1)CCCC2	ZINC000450792784	DF	On-Demand	Anodyne	PPARD	25	46
C[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@@H]1O	ZINC000450792796	EF	On-Demand	Anodyne	HRH1	28	41
C[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@@H]1O	ZINC000450792796	EF	On-Demand	Anodyne	HDAC8	48	44
C[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@@H]1O	ZINC000450792796	EF	On-Demand	Anodyne	HDAC6	34	46
C[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@@H]1O	ZINC000450792796	EF	On-Demand	Anodyne	IMDH_CRYPV	29	47
C[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@H]1O	ZINC000450792797	EF	On-Demand	Anodyne	HRH1	28	41
C[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@H]1O	ZINC000450792797	EF	On-Demand	Anodyne	HDAC8	48	44
C[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@H]1O	ZINC000450792797	EF	On-Demand	Anodyne	HDAC6	34	46
C[C@@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@H]1O	ZINC000450792797	EF	On-Demand	Anodyne	IMDH_CRYPV	29	47
C[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@H]1O	ZINC000450792799	EF	On-Demand	Anodyne	HRH1	28	41
C[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@H]1O	ZINC000450792799	EF	On-Demand	Anodyne	HDAC8	48	44
C[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@H]1O	ZINC000450792799	EF	On-Demand	Anodyne	HDAC6	34	46
C[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@H]1O	ZINC000450792799	EF	On-Demand	Anodyne	IMDH_CRYPV	29	47
C[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@@H]1O	ZINC000450792801	EF	On-Demand	Anodyne	HRH1	28	41
C[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@@H]1O	ZINC000450792801	EF	On-Demand	Anodyne	HDAC8	48	44
C[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@@H]1O	ZINC000450792801	EF	On-Demand	Anodyne	HDAC6	34	46
C[C@H]1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)CC[C@@H]1O	ZINC000450792801	EF	On-Demand	Anodyne	IMDH_CRYPV	29	47
CCN1C[C@H](Nc2nccc(C(F)F)n2)CC1=O	ZINC000450792808	CD	On-Demand	Anodyne	MAPK1	56	34
CCN1C[C@@H](Nc2nccc(C(F)F)n2)CC1=O	ZINC000450792809	CD	On-Demand	Anodyne	MAPK1	56	34
CCC(=O)C1(C(=O)NCc2cc(F)ccc2OC)CC1	ZINC000450792810	CE	On-Demand	Anodyne	PPARD	21	42
C=CCN(C)C(=O)C1(c2cccc(Cl)c2)CC(C)C1	ZINC000450792818	CH	On-Demand	Mild	SLC6A2	0	47
COC(=O)C(C)(C)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450792825	DE	On-Demand	Anodyne	DRD4	27	42
COC(=O)C(C)(C)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450792825	DE	On-Demand	Anodyne	HRP1_PLAFA	41	34
COC(=O)C(C)(C)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450792825	DE	On-Demand	Anodyne	SIGMAR1	24	47
COC(=O)C(C)(C)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450792825	DE	On-Demand	Anodyne	CACNA1G	30	42
COC(=O)C(C)(C)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450792825	DE	On-Demand	Anodyne	BIRC2	26	42
COC(=O)C(C)(C)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450792825	DE	On-Demand	Anodyne	KCNJ1	46	37
C[C@@H]1Cc2cccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)c(F)c3)c2O1	ZINC000450792849	GF	On-Demand	Anodyne	NPY2R	51	42
C[C@@H]1Cc2cccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)c(F)c3)c2O1	ZINC000450792849	GF	On-Demand	Anodyne	MTTP	50	34
C[C@@H]1Cc2cccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)c(F)c3)c2O1	ZINC000450792849	GF	On-Demand	Anodyne	EPHX2	15	53
C[C@H]1Cc2cccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)c(F)c3)c2O1	ZINC000450792850	GF	On-Demand	Anodyne	NPY2R	51	42
C[C@H]1Cc2cccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)c(F)c3)c2O1	ZINC000450792850	GF	On-Demand	Anodyne	MTTP	50	34
C[C@H]1Cc2cccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)c(F)c3)c2O1	ZINC000450792850	GF	On-Demand	Anodyne	EPHX2	15	53
CC(=O)Nc1ncccc1NC(=O)CCCC(C)C	ZINC000450792853	CF	On-Demand	Anodyne	BDKRB1	0	42
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](O)[C@@H](C)C1	ZINC000450792857	CD	On-Demand	Anodyne	ACE	44	37
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](O)[C@@H](C)C1	ZINC000450792857	CD	On-Demand	Anodyne	AMP1_PLAFQ	22	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](O)[C@H](C)C1	ZINC000450792858	CD	On-Demand	Anodyne	ACE	44	37
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](O)[C@H](C)C1	ZINC000450792858	CD	On-Demand	Anodyne	AMP1_PLAFQ	22	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](O)[C@@H](C)C1	ZINC000450792859	CD	On-Demand	Anodyne	ACE	44	37
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](O)[C@@H](C)C1	ZINC000450792859	CD	On-Demand	Anodyne	AMP1_PLAFQ	22	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](O)[C@H](C)C1	ZINC000450792860	CD	On-Demand	Anodyne	ACE	44	37
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](O)[C@H](C)C1	ZINC000450792860	CD	On-Demand	Anodyne	AMP1_PLAFQ	22	40
CCOC[C@H](C)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450792884	DH	On-Demand	Anodyne	MC3R	26	40
CCOC[C@H](C)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450792884	DH	On-Demand	Anodyne	MC5R	23	40
CCOC[C@H](C)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450792885	DH	On-Demand	Anodyne	MC4R	17	40
CCOC[C@H](C)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450792885	DH	On-Demand	Anodyne	MC3R	26	40
CCOC[C@H](C)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450792885	DH	On-Demand	Anodyne	MC5R	23	40
CCOC[C@H](C)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450792886	DH	On-Demand	Anodyne	MC4R	17	40
CCOC[C@H](C)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450792886	DH	On-Demand	Anodyne	MC3R	26	40
CCOC[C@H](C)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450792886	DH	On-Demand	Anodyne	MC5R	23	40
CCOC[C@H](C)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450792887	DH	On-Demand	Anodyne	MC3R	26	40
CCOC[C@H](C)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450792887	DH	On-Demand	Anodyne	MC5R	23	40
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450792894	GG	On-Demand	Anodyne	PPIA	15	40
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450792894	GG	On-Demand	Anodyne	LIMK2	17	41
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450792894	GG	On-Demand	Anodyne	PDS	55	39
Cn1c(CNC(=O)CCCC(=O)C2CC2)nc2cc(Cl)ccc21	ZINC000450792895	EF	On-Demand	Anodyne	HTR7	26	41
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1cccc(C(F)(F)F)n1	ZINC000450792902	FH	On-Demand	Anodyne	PDS	41	34
CCOCc1nc(C)c(C(=O)NCc2nc3cc(Cl)ccc3n2C)s1	ZINC000450792903	GG	On-Demand	Anodyne	SCD1	41	39
Cc1[nH]c(C#N)cc1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450792908	EF	On-Demand	Mild	HCN1	50	31
Cc1[nH]c(C#N)cc1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450792908	EF	On-Demand	Mild	HCN4	48	31
Cc1[nH]c(C#N)cc1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450792909	EF	On-Demand	Mild	HCN1	50	31
Cc1[nH]c(C#N)cc1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450792909	EF	On-Demand	Mild	HCN4	48	31
CCOC[C@H](C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450792928	CE	On-Demand	Anodyne	P2RY12	47	32
CCOC[C@H](C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450792929	CE	On-Demand	Anodyne	P2RY12	47	32
CCN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1=O	ZINC000450792930	FE	On-Demand	Bother	CACNA1D	55	33
O=C(CCCC(=O)C1CC1)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450792933	FE	On-Demand	Anodyne	EPHX2	25	58
Cc1nn(C)cc1CC(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450792934	EE	On-Demand	Anodyne	P2RX7	34	40
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450792941	GG	On-Demand	Anodyne	NPY2R	61	42
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450792941	GG	On-Demand	Anodyne	EPHX2	30	60
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450792942	GG	On-Demand	Anodyne	NPY2R	61	42
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450792942	GG	On-Demand	Anodyne	EPHX2	30	60
CCOC[C@H](C)NC(=O)c1cccc(CC)n1	ZINC000450792943	BD	On-Demand	Anodyne	PDE5A	27	42
CNC(=O)c1cccnc1NC(COC)COC	ZINC000450792951	CC	On-Demand	Anodyne	OSIGBA0132E09-OSIGBA0108L24.11	0	44
C[C@H]1CN(c2ccc(C(F)(F)F)cc2C#N)C[C@@H](C)N1CCO	ZINC000450792959	EE	On-Demand	Mild	LIPG	40	36
CN(C(=O)[C@H](O)C1CCC1)[C@@H](CNC(=O)[C@@H](O)C1CCC1)Cc1ccccc1	ZINC000450792961	GD	On-Demand	Anodyne	ACE	51	35
CN(C(=O)[C@H](O)C1CCC1)[C@@H](CNC(=O)[C@@H](O)C1CCC1)Cc1ccccc1	ZINC000450792961	GD	On-Demand	Anodyne	MME	76	38
CN(C(=O)[C@H](O)C1CCC1)[C@@H](CNC(=O)[C@@H](O)C1CCC1)Cc1ccccc1	ZINC000450792961	GD	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CN(C(=O)[C@H](O)C1CCC1)[C@H](CNC(=O)[C@@H](O)C1CCC1)Cc1ccccc1	ZINC000450792962	GD	On-Demand	Anodyne	ACE	51	35
CN(C(=O)[C@H](O)C1CCC1)[C@H](CNC(=O)[C@@H](O)C1CCC1)Cc1ccccc1	ZINC000450792962	GD	On-Demand	Anodyne	MME	76	38
CN(C(=O)[C@H](O)C1CCC1)[C@H](CNC(=O)[C@@H](O)C1CCC1)Cc1ccccc1	ZINC000450792962	GD	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CN(C(=O)[C@H](O)C1CCC1)[C@@H](CNC(=O)[C@H](O)C1CCC1)Cc1ccccc1	ZINC000450792963	GD	On-Demand	Anodyne	ACE	51	35
CN(C(=O)[C@H](O)C1CCC1)[C@@H](CNC(=O)[C@H](O)C1CCC1)Cc1ccccc1	ZINC000450792963	GD	On-Demand	Anodyne	MME	76	38
CN(C(=O)[C@H](O)C1CCC1)[C@@H](CNC(=O)[C@H](O)C1CCC1)Cc1ccccc1	ZINC000450792963	GD	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CN(C(=O)[C@H](O)C1CCC1)[C@H](CNC(=O)[C@H](O)C1CCC1)Cc1ccccc1	ZINC000450792964	GD	On-Demand	Anodyne	ACE	51	35
CN(C(=O)[C@H](O)C1CCC1)[C@H](CNC(=O)[C@H](O)C1CCC1)Cc1ccccc1	ZINC000450792964	GD	On-Demand	Anodyne	MME	76	38
CN(C(=O)[C@H](O)C1CCC1)[C@H](CNC(=O)[C@H](O)C1CCC1)Cc1ccccc1	ZINC000450792964	GD	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CN(CCC1=CCCCC1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450792979	DH	On-Demand	Anodyne	CHRNA2	39	40
CN(CCC1=CCCCC1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450792979	DH	On-Demand	Anodyne	CRTY	0	40
CCOc1ccc(NC(=O)CC[C@@H]2CCC(=O)N2)cc1Br	ZINC000450792984	FF	On-Demand	Anodyne	ENPP1	48	34
CCOc1ccc(NC(=O)CC[C@H]2CCC(=O)N2)cc1Br	ZINC000450792985	FF	On-Demand	Anodyne	ENPP1	48	34
COCc1cc(=NC(COC)COC)c2cc(F)ccc2[nH]1	ZINC000450792989	DE	On-Demand	Anodyne	MPO	40	33
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C[C@@H]1CCCCC1(F)F	ZINC000450792990	EH	On-Demand	Anodyne	CHRNA2	40	41
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C[C@@H]1CCCCC1(F)F	ZINC000450792990	EH	On-Demand	Anodyne	CRTY	0	41
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C[C@H]1CCCCC1(F)F	ZINC000450792991	EH	On-Demand	Anodyne	CHRNA2	40	41
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C[C@H]1CCCCC1(F)F	ZINC000450792991	EH	On-Demand	Anodyne	CRTY	0	41
Cc1ccc2ncnc(N3C[C@H](C)N(CCO)[C@H](C)C3)c2c1	ZINC000450792992	DD	On-Demand	Anodyne	PDE3B	62	33
CCOc1ccc(NC(=O)CCCC(=O)C2CC2)cc1Br	ZINC000450792994	FH	On-Demand	Anodyne	HDAC10	18	40
CCOc1ccc(NC(=O)CCCC(=O)C2CC2)cc1Br	ZINC000450792994	FH	On-Demand	Anodyne	HDAC3	21	42
CS(=O)(=O)C[C@@H]1CCCCN1c1cnc2cc(Cl)c(Cl)cc2n1	ZINC000450793002	FG	On-Demand	Anodyne	GLP1R	50	34
CS(=O)(=O)C[C@H]1CCCCN1c1cnc2cc(Cl)c(Cl)cc2n1	ZINC000450793003	FG	On-Demand	Anodyne	GLP1R	50	34
CC(F)(F)CCN1C(=O)C(=O)N(C2CCCCC2)C1=O	ZINC000450793011	CE	On-Demand	Anodyne	CACNA1D	0	42
Cc1ccc(F)c(CC(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450793012	DH	On-Demand	Anodyne	COLA	52	43
Cc1ccc(F)c(CC(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450793012	DH	On-Demand	Anodyne	CPT1A	48	43
Cc1ccc(F)c(CC(=O)N2CCC[C@H]2c2csc(C)n2)c1	ZINC000450793012	DH	On-Demand	Anodyne	TRPC3	43	35
COc1ccc2c(c1)CN(c1ccccn1)CCO2	ZINC000450793016	CE	On-Demand	Anodyne	EBP	28	47
CCN(CC)S(=O)(=O)c1ccc(NCc2cnccc2C)c([N+](=O)[O-])c1	ZINC000450793021	GF	On-Demand	Bother	BDKRB1	22	43
CCOc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1Br	ZINC000450793041	FI	On-Demand	Mild	HCN1	41	32
CCOc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1Br	ZINC000450793041	FI	On-Demand	Mild	HCN4	41	32
CCOc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1Br	ZINC000450793050	FI	On-Demand	Mild	HCN1	41	32
CCOc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1Br	ZINC000450793050	FI	On-Demand	Mild	HCN4	41	32
CC[C@@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793060	GD	On-Demand	Bother	BDKRB1	0	51
CC[C@@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793060	GD	On-Demand	Bother	BCL2L1	108	37
CC[C@@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793060	GD	On-Demand	Bother	BCL2	94	34
CC[C@@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793060	GD	On-Demand	Bother	BCL2L2	44	31
CC[C@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793062	GD	On-Demand	Bother	BDKRB1	0	51
CC[C@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793062	GD	On-Demand	Bother	BCL2L1	108	37
CC[C@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793062	GD	On-Demand	Bother	BCL2	94	34
CC[C@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793062	GD	On-Demand	Bother	BCL2L2	44	31
CC[C@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793063	GD	On-Demand	Bother	BDKRB1	0	51
CC[C@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793063	GD	On-Demand	Bother	BCL2L1	108	37
CC[C@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793063	GD	On-Demand	Bother	BCL2	94	34
CC[C@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793063	GD	On-Demand	Bother	BCL2L2	44	31
CC[C@@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793064	GD	On-Demand	Bother	BDKRB1	0	51
CC[C@@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793064	GD	On-Demand	Bother	BCL2L1	108	37
CC[C@@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793064	GD	On-Demand	Bother	BCL2	94	34
CC[C@@H](Nc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793064	GD	On-Demand	Bother	BCL2L2	44	31
COc1ccc2c(c1)CN(c1cc(C(=O)NC3CC3)c3ccccc3n1)CCO2	ZINC000450793067	GH	On-Demand	Anodyne	ACACB	23	41
COc1ccc2c(c1)CN(c1cc(C(=O)NC3CC3)c3ccccc3n1)CCO2	ZINC000450793067	GH	On-Demand	Anodyne	MCHR1	17	42
COc1ccc2c(c1)CN(c1cc(C(=O)NC3CC3)c3ccccc3n1)CCO2	ZINC000450793067	GH	On-Demand	Anodyne	TNKS	50	31
Cc1nc([C@@H]2CCCN2C(=O)Cc2ccc(O)c(F)c2)cs1	ZINC000450793069	DG	On-Demand	Anodyne	CPT1A	45	44
Cc1nc([C@@H]2CCCN2C(=O)Cc2ccc(O)c(F)c2)cs1	ZINC000450793069	DG	On-Demand	Anodyne	TRPC6	44	31
CCOc1ccc(NC(=O)c2cc3n(n2)CCC3)cc1Br	ZINC000450793070	FG	On-Demand	Anodyne	HTR2A	35	41
Cc1nc([C@H]2CCCN2C(=O)Cc2ccc(O)c(F)c2)cs1	ZINC000450793071	DG	On-Demand	Anodyne	CPT1A	45	44
Cc1nc([C@H]2CCCN2C(=O)Cc2ccc(O)c(F)c2)cs1	ZINC000450793071	DG	On-Demand	Anodyne	TRPC6	44	31
COCC(COC)Nc1ncnc2ccc(I)cc12	ZINC000450793076	FE	On-Demand	Anodyne	EGFR	28	43
COCC(COC)Nc1ncnc2ccc(I)cc12	ZINC000450793076	FE	On-Demand	Anodyne	CD38	60	41
COC(=O)c1csc(CSc2ccc(C(C)C)cc2)n1	ZINC000450793077	DI	On-Demand	Anodyne	FAS	40	38
CC(=O)CCCCCN1C(=O)C(=O)N(C2CCCCC2)C1=O	ZINC000450793078	DE	On-Demand	Anodyne	CACNA1D	18	40
Cc1ccncc1CNc1ncccc1C(=O)OC(C)C	ZINC000450793083	CF	On-Demand	Anodyne	BDKRB1	0	40
CC[C@@H](Nc1ncnc2ccc(I)cc12)[C@H](C)O	ZINC000450793134	FF	On-Demand	Anodyne	CD38	50	42
CC[C@H](Nc1ncnc2ccc(I)cc12)[C@@H](C)O	ZINC000450793135	FF	On-Demand	Anodyne	CD38	50	42
CC[C@H](Nc1ncnc2ccc(I)cc12)[C@H](C)O	ZINC000450793136	FF	On-Demand	Anodyne	CD38	50	42
CC[C@@H](Nc1ncnc2ccc(I)cc12)[C@@H](C)O	ZINC000450793137	FF	On-Demand	Anodyne	CD38	50	42
C[C@@H]1CCC[C@@]1(C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450793159	EH	On-Demand	Anodyne	KCNQ1	0	47
C[C@@H]1CCC[C@@]1(C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450793159	EH	On-Demand	Anodyne	SPHK1	45	43
C[C@H]1CCC[C@]1(C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450793160	EH	On-Demand	Anodyne	KCNQ1	0	47
C[C@H]1CCC[C@]1(C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450793160	EH	On-Demand	Anodyne	SPHK1	45	43
C[C@H]1CCC[C@@]1(C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450793161	EH	On-Demand	Anodyne	KCNQ1	0	47
C[C@H]1CCC[C@@]1(C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450793161	EH	On-Demand	Anodyne	SPHK1	45	43
C[C@@H]1CCC[C@]1(C)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450793162	EH	On-Demand	Anodyne	SPHK1	45	43
CC1(CO)CN(c2ncccc2OCc2ccccc2)C1	ZINC000450793192	CE	On-Demand	Anodyne	PPIA	47	38
CC(C)CN1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)CC1=O	ZINC000450793195	DD	On-Demand	Anodyne	P2RX7	0	57
CC1(CO)CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450793197	CE	On-Demand	Bother	LIPG	46	34
Cc1nnnn1-c1ccc(C(=O)N2CCN(CC(C)C)C(=O)C2)c(F)c1	ZINC000450793229	FD	On-Demand	Anodyne	P2RX7	19	48
CC(C)c1ncsc1C(=O)NCc1ccc(Cl)cc1F	ZINC000450793300	DH	On-Demand	Anodyne	P2RX7	56	42
C=CCN(C)C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450793303	CE	On-Demand	Mild	TACR3	45	33
C=CCN(C)C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450793304	CE	On-Demand	Mild	TACR3	45	33
CCN1C[C@@H](Nc2ccnc3cc(F)c(OC)cc23)CC1=O	ZINC000450793305	DE	On-Demand	Anodyne	HRP1_PLAFA	69	31
CCN1C[C@H](Nc2ccnc3cc(F)c(OC)cc23)CC1=O	ZINC000450793306	DE	On-Demand	Anodyne	HRP1_PLAFA	69	31
CC(C)(C)C(=O)CCCC(=O)NCc1ccc(Cl)cc1F	ZINC000450793307	DH	On-Demand	Anodyne	P2RX7	73	42
CC(C)(C)C(=O)CCCC(=O)NCc1ccc(Cl)cc1F	ZINC000450793307	DH	On-Demand	Anodyne	SUCNR1	46	37
CC[C@H]1CCC[C@@H]1C(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450793324	DH	On-Demand	Anodyne	SLC6A1	0	40
CC[C@@H]1CCC[C@H]1C(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450793325	DH	On-Demand	Anodyne	SLC6A1	0	40
CC[C@H]1CCC[C@H]1C(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450793326	DH	On-Demand	Anodyne	SLC6A1	0	40
CC[C@@H]1CCC[C@@H]1C(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450793328	DH	On-Demand	Anodyne	SLC6A1	0	40
O=C(Nc1ccc(C(=O)N2CCOCC2)c(F)c1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450793331	FE	On-Demand	Anodyne	EPHX2	28	64
Cc1ccc(Br)cc1CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450793333	GF	On-Demand	Anodyne	SIGMAR1	18	44
Cc1ccc(Br)cc1CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450793333	GF	On-Demand	Anodyne	SSTR5	41	37
Cc1ccc(Br)cc1CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450793334	GF	On-Demand	Anodyne	SIGMAR1	18	44
Cc1ccc(Br)cc1CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450793334	GF	On-Demand	Anodyne	SSTR5	41	37
Cc1ccn(CC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)n1	ZINC000450793338	EE	On-Demand	Anodyne	NPFFR1	54	39
Cc1ccn(CC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)n1	ZINC000450793340	EE	On-Demand	Anodyne	NPFFR1	54	39
CC[C@@H](CO)N(Cc1ccccc1)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450793344	GG	On-Demand	Anodyne	PDEC	0	41
CC[C@@H](CO)N(Cc1ccccc1)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450793345	GG	On-Demand	Anodyne	PDEC	0	41
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793351	EG	On-Demand	Anodyne	MC4R	25	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793351	EG	On-Demand	Anodyne	PRCP	61	46
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793351	EG	On-Demand	Anodyne	MC3R	50	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793351	EG	On-Demand	Anodyne	MC5R	35	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793351	EG	On-Demand	Anodyne	MC1R	34	41
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793352	EG	On-Demand	Anodyne	MC4R	25	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793352	EG	On-Demand	Anodyne	PRCP	61	46
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793352	EG	On-Demand	Anodyne	MC3R	50	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793352	EG	On-Demand	Anodyne	MC5R	35	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450793352	EG	On-Demand	Anodyne	MC1R	34	41
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793354	EG	On-Demand	Anodyne	MC4R	25	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793354	EG	On-Demand	Anodyne	PRCP	61	46
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793354	EG	On-Demand	Anodyne	MC3R	50	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793354	EG	On-Demand	Anodyne	MC5R	35	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793354	EG	On-Demand	Anodyne	MC1R	34	41
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793355	EG	On-Demand	Anodyne	MC4R	25	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793355	EG	On-Demand	Anodyne	PRCP	61	46
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793355	EG	On-Demand	Anodyne	MC3R	50	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793355	EG	On-Demand	Anodyne	MC5R	35	45
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450793355	EG	On-Demand	Anodyne	MC1R	34	41
C[C@H]1CN(c2ccnc(N3CCCCC3)n2)C[C@@H](C)N1CCO	ZINC000450793364	DD	On-Demand	Anodyne	SORD	70	50
CCSc1cccnc1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450793375	GG	On-Demand	Anodyne	NPY2R	67	37
CCSc1cccnc1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450793375	GG	On-Demand	Anodyne	EPHX2	17	52
CCOC[C@H](C)NC(=O)CCCC(C)C	ZINC000450793387	BE	On-Demand	Anodyne	NOD1	62	37
CCOC[C@H](C)NC(=O)c1ccc(I)cc1F	ZINC000450793421	FF	On-Demand	Anodyne	SDH1	0	40
CC(=O)Nc1ncccc1NC(=O)CC1CC(F)(F)C1	ZINC000450793429	CE	On-Demand	Anodyne	BDKRB1	0	45
CC(=O)Nc1ncccc1NC(=O)CC1CC(F)(F)C1	ZINC000450793429	CE	On-Demand	Anodyne	G2YM83_BOTF4	51	32
Cc1nc(Nc2cnn([C@H]3CCOC3)c2C)ncc1[N+](=O)[O-]	ZINC000450793431	DD	On-Demand	Bother	LRRK2	19	50
C[C@H]1CN(c2ccnc3cc(Cl)ccc23)C[C@@H](C)N1CCO	ZINC000450793437	DF	On-Demand	Anodyne	HRP1_PLAFA	99	38
C[C@H]1CN(c2ccnc3cc(Cl)ccc23)C[C@@H](C)N1CCO	ZINC000450793437	DF	On-Demand	Anodyne	HNMT	53	37
Cc1nc(Nc2cnn([C@@H]3CCOC3)c2C)ncc1[N+](=O)[O-]	ZINC000450793438	DD	On-Demand	Bother	LRRK2	19	50
COc1ccc(CNC(=O)CCSc2ccc(Cl)cn2)c(OC)c1	ZINC000450793439	FH	On-Demand	Anodyne	F10	49	32
COc1ccc(CNC(=O)CCSc2ccc(Cl)cn2)c(OC)c1	ZINC000450793439	FH	On-Demand	Anodyne	MTNR1A	47	39
CCn1c(NC(=O)[C@H](O)C2CCC2)nc2cc(F)ccc21	ZINC000450793440	CE	On-Demand	Anodyne	ITK	25	44
CCn1c(NC(=O)[C@@H](O)C2CCC2)nc2cc(F)ccc21	ZINC000450793442	CE	On-Demand	Anodyne	ITK	25	44
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450793464	FE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450793464	FE	On-Demand	Anodyne	EPHX2	19	40
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450793464	FE	On-Demand	Anodyne	CACNA1G	30	43
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450793464	FE	On-Demand	Anodyne	NPBWR1	45	31
CC(=O)CCCCCSc1nnc(C2CC2)n1-c1cccc(NC(C)=O)c1	ZINC000450793468	GI	On-Demand	Anodyne	HDAC10	16	40
CC(=O)CCCCCSc1nnc(C2CC2)n1-c1cccc(NC(C)=O)c1	ZINC000450793468	GI	On-Demand	Anodyne	HDAC3	21	40
C[C@H]1CN(c2ccccn2)C[C@@H](C)N1CCO	ZINC000450793481	BC	On-Demand	Anodyne	SORD	28	41
O=C(c1cccc2c1CCCC2)N1CC2(CCCC2)C1	ZINC000450793487	CH	On-Demand	Anodyne	FABP4	40	33
COCC(=O)N1CCc2cc(NC(=O)c3ccn(CCn4cccn4)n3)ccc21	ZINC000450793488	GD	On-Demand	Anodyne	EIF2AK3	43	36
CC1(C)[C@H](O)C[C@H]1NC(=O)COc1cccc(Br)c1C#N	ZINC000450793489	FD	On-Demand	Mild	EZH2	53	36
CC1(C)[C@@H](O)C[C@H]1NC(=O)COc1cccc(Br)c1C#N	ZINC000450793490	FD	On-Demand	Mild	EZH2	53	36
CC1(C)[C@@H](NC(=O)COc2cccc(Br)c2C#N)C[C@H]1O	ZINC000450793491	FD	On-Demand	Mild	EZH2	53	36
CC1(C)[C@@H](O)C[C@@H]1NC(=O)COc1cccc(Br)c1C#N	ZINC000450793492	FD	On-Demand	Mild	EZH2	53	36
COCC(COC)Nc1ccnc2cc(Br)ccc12	ZINC000450793519	EG	On-Demand	Anodyne	HNMT	43	30
CN1CC[C@@H]2CN(c3ccc4ccccc4n3)C[C@@H]21	ZINC000450793520	CE	On-Demand	Anodyne	HTR3A	33	41
CN1CC[C@@H]2CN(c3ccc4ccccc4n3)C[C@@H]21	ZINC000450793520	CE	On-Demand	Anodyne	PDE1B	0	43
CC(=O)c1cccc(CN2CCC(Cn3cncn3)CC2)c1	ZINC000450793522	CE	On-Demand	Anodyne	ACHE	35	49
CC(=O)c1cccc(CN2CCC(Cn3cncn3)CC2)c1	ZINC000450793522	CE	On-Demand	Anodyne	SIGMAR1	38	40
CC(=O)c1cccc(CN2CCC(Cn3cncn3)CC2)c1	ZINC000450793522	CE	On-Demand	Anodyne	SSTR5	41	32
CC(=O)c1cccc(CN2CCC(Cn3cncn3)CC2)c1	ZINC000450793522	CE	On-Demand	Anodyne	CCR3	41	47
COCC(=O)N1CCc2cc(NC(=O)Cc3ccc(O)c(F)c3)ccc21	ZINC000450793556	FE	On-Demand	Anodyne	EIF2AK3	55	41
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450793563	ED	On-Demand	Anodyne	F13A1	42	32
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450793563	ED	On-Demand	Anodyne	NAMPT	30	41
CS(=O)(=O)C[C@@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450793578	EF	On-Demand	Anodyne	COLA	65	35
CS(=O)(=O)C[C@@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450793578	EF	On-Demand	Anodyne	CPT1A	62	35
CS(=O)(=O)C[C@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450793580	EF	On-Demand	Anodyne	COLA	65	35
CS(=O)(=O)C[C@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450793580	EF	On-Demand	Anodyne	CPT1A	62	35
COC(=O)c1ccc(CC(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cc1	ZINC000450793582	FD	On-Demand	Anodyne	CDK2	0	45
C[C@@H](O)C[C@@H](C)NC(=O)Cc1cc2ccccc2s1	ZINC000450793619	CF	On-Demand	Anodyne	LTB4R	15	43
C[C@H](O)C[C@@H](C)NC(=O)Cc1cc2ccccc2s1	ZINC000450793620	CF	On-Demand	Anodyne	LTB4R	15	43
C[C@H](O)C[C@H](C)NC(=O)Cc1cc2ccccc2s1	ZINC000450793621	CF	On-Demand	Anodyne	LTB4R	15	43
C[C@@H](C[C@@H](C)O)NC(=O)Cc1cc2ccccc2s1	ZINC000450793622	CF	On-Demand	Anodyne	LTB4R	15	43
CCC(=O)c1ccc(N[C@H](CC)[C@H](C)O)c([N+](=O)[O-])c1	ZINC000450793623	CF	On-Demand	Bother	COLA	46	31
CCC(=O)c1ccc(N[C@@H](CC)[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000450793624	CF	On-Demand	Bother	COLA	46	31
CCC(=O)c1ccc(N[C@H](CC)[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000450793625	CF	On-Demand	Bother	COLA	46	31
CCC(=O)c1ccc(N[C@@H](CC)[C@H](C)O)c([N+](=O)[O-])c1	ZINC000450793626	CF	On-Demand	Bother	COLA	46	31
COc1cc(CC(=O)N2CCN(C)C(=O)[C@@H]2C)ccc1Cl	ZINC000450793647	DD	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCN(C)C(=O)[C@@H]2C)ccc1Cl	ZINC000450793647	DD	On-Demand	Anodyne	OPRK1	44	43
COc1cc(CC(=O)N2CCN(C)C(=O)[C@H]2C)ccc1Cl	ZINC000450793648	DD	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCN(C)C(=O)[C@H]2C)ccc1Cl	ZINC000450793648	DD	On-Demand	Anodyne	OPRK1	44	43
CC(C)c1nccc(N2CCCC[C@@H]2CS(C)(=O)=O)n1	ZINC000450793678	CE	On-Demand	Anodyne	SORD	47	37
CC(C)c1nccc(N2CCCC[C@H]2CS(C)(=O)=O)n1	ZINC000450793680	CE	On-Demand	Anodyne	SORD	47	37
Cc1ccc(C2CCN(C(=O)c3ccc(Br)cc3C#N)CC2)cn1	ZINC000450793697	GI	On-Demand	Mild	FASN	49	41
CC(F)(F)CCn1cnc2c(cnn2-c2cccc(C(F)(F)F)c2)c1=O	ZINC000450793698	FH	On-Demand	Anodyne	GALR3	56	30
CC(F)(F)CCn1cnc2c(cnn2-c2cccc(C(F)(F)F)c2)c1=O	ZINC000450793698	FH	On-Demand	Anodyne	Q9M629_MAIZE	41	30
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2c1cnn2-c1ccccc1	ZINC000450793702	FE	On-Demand	Anodyne	GPR119	19	40
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2c1cnn2-c1ccccc1	ZINC000450793703	FE	On-Demand	Anodyne	GPR119	19	40
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncncc2Cl)CC1	ZINC000450793715	GG	On-Demand	Anodyne	GPR119	19	41
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncncc2Cl)CC1	ZINC000450793718	GG	On-Demand	Anodyne	GPR119	19	41
COc1cccc(OCCC(=O)NCCCc2nc(-c3ccc(F)cc3)no2)c1	ZINC000450793756	GG	On-Demand	Anodyne	MTNR1A	76	43
COc1cccc(OCCC(=O)NCCCc2nc(-c3ccc(F)cc3)no2)c1	ZINC000450793756	GG	On-Demand	Anodyne	MTNR1B	69	43
CC(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450793775	EH	On-Demand	Anodyne	PRNP	52	43
CC(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450793775	EH	On-Demand	Anodyne	HDAC1	22	41
CC(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450793775	EH	On-Demand	Anodyne	GCK	34	40
CC(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450793775	EH	On-Demand	Anodyne	TAAR1	31	41
CC(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450793775	EH	On-Demand	Anodyne	DGAT1	42	39
CC(C)Oc1c(F)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450793775	EH	On-Demand	Anodyne	HPGDS	20	41
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450793776	EF	On-Demand	Anodyne	PRCP	48	37
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450793777	EF	On-Demand	Anodyne	PRCP	48	37
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450793778	EF	On-Demand	Anodyne	PRCP	48	37
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450793779	EF	On-Demand	Anodyne	PRCP	48	37
CC[C@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@H](C)O	ZINC000450793786	EF	On-Demand	Anodyne	AVPR2	28	42
CC[C@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@H](C)O	ZINC000450793786	EF	On-Demand	Anodyne	AVPR1A	35	42
CC[C@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@@H](C)O	ZINC000450793787	EF	On-Demand	Anodyne	AVPR2	28	42
CC[C@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@@H](C)O	ZINC000450793787	EF	On-Demand	Anodyne	AVPR1A	35	42
CC[C@@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@@H](C)O	ZINC000450793788	EF	On-Demand	Anodyne	AVPR2	28	42
CC[C@@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@@H](C)O	ZINC000450793788	EF	On-Demand	Anodyne	AVPR1A	35	42
CC[C@@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@H](C)O	ZINC000450793789	EF	On-Demand	Anodyne	AVPR2	28	42
CC[C@@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@H](C)O	ZINC000450793789	EF	On-Demand	Anodyne	AVPR1A	35	42
CC[C@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793792	EG	On-Demand	Bother	COLA	70	32
CC[C@@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450793793	EG	On-Demand	Bother	COLA	70	32
CC[C@@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793794	EG	On-Demand	Bother	COLA	70	32
CC[C@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450793795	EG	On-Demand	Bother	COLA	70	32
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450793797	FE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450793797	FE	On-Demand	Anodyne	CACNA1G	30	43
O=C(Cc1ccc(O)c(F)c1)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450793801	GE	On-Demand	Anodyne	EPHX2	20	60
CCCOc1ccc(C(=O)N2CC[C@H](O)[C@H](C)C2)c(OC)c1	ZINC000450793810	DE	On-Demand	Anodyne	GRM3	24	40
CCCOc1ccc(C(=O)N2CC[C@@H](O)[C@H](C)C2)c(OC)c1	ZINC000450793811	DE	On-Demand	Anodyne	GRM3	24	40
CCCOc1ccc(C(=O)N2CC[C@@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450793812	DE	On-Demand	Anodyne	GRM3	24	40
CCCOc1ccc(C(=O)N2CC[C@H](O)[C@@H](C)C2)c(OC)c1	ZINC000450793813	DE	On-Demand	Anodyne	GRM3	24	40
CC(=O)Nc1ncccc1NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450793819	DF	On-Demand	Anodyne	BDKRB1	0	43
CC(=O)Nc1ncccc1NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450793819	DF	On-Demand	Anodyne	G2YM83_BOTF4	59	33
CC(=O)Nc1ncccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450793823	GE	On-Demand	Anodyne	BDKRB1	0	40
CC(=O)Nc1ncccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450793823	GE	On-Demand	Anodyne	MAP1	21	41
CC(=O)Nc1ncccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450793823	GE	On-Demand	Anodyne	CA5B	60	36
CC(=O)Nc1ncccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450793823	GE	On-Demand	Anodyne	CA5A	69	36
CC(=O)Nc1ncccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450793823	GE	On-Demand	Anodyne	RORC	59	34
C[C@@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793846	FG	On-Demand	Anodyne	SIGMAR1	15	42
C[C@@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793846	FG	On-Demand	Anodyne	NCE103	22	41
C[C@@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793846	FG	On-Demand	Anodyne	P96878_MYCTU	17	41
C[C@@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793846	FG	On-Demand	Anodyne	NPFFR1	53	38
C[C@@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793846	FG	On-Demand	Anodyne	CAN2	0	41
C[C@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793847	FG	On-Demand	Anodyne	SIGMAR1	15	42
C[C@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793847	FG	On-Demand	Anodyne	NCE103	22	41
C[C@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793847	FG	On-Demand	Anodyne	P96878_MYCTU	17	41
C[C@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793847	FG	On-Demand	Anodyne	NPFFR1	53	38
C[C@]1(CNC(=O)Cc2ccc(O)c(F)c2)CCCN1Cc1ccccc1	ZINC000450793847	FG	On-Demand	Anodyne	CAN2	0	41
O=C(NC1CC1)[C@@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450793864	EE	On-Demand	Anodyne	CHRM3	19	40
O=C(NC1CC1)[C@@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450793864	EE	On-Demand	Anodyne	SIGMAR1	27	40
O=C(NC1CC1)[C@@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450793865	EE	On-Demand	Anodyne	CHRM3	19	40
O=C(NC1CC1)[C@@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450793865	EE	On-Demand	Anodyne	SIGMAR1	27	40
O=C(NC1CC1)[C@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450793866	EE	On-Demand	Anodyne	CHRM3	19	40
O=C(NC1CC1)[C@H](O)C1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450793866	EE	On-Demand	Anodyne	SIGMAR1	27	40
O=C(NC1CC1)[C@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450793868	EE	On-Demand	Anodyne	CHRM3	19	40
O=C(NC1CC1)[C@H](O)C1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450793868	EE	On-Demand	Anodyne	SIGMAR1	27	40
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC2(CCCC2)C1	ZINC000450793874	EH	On-Demand	Bother	PPXII	0	41
COCC(COC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450793878	GD	On-Demand	Bother	BCL2L1	102	35
COCC(COC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450793878	GD	On-Demand	Bother	BCL2	83	38
COCC(COC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450793878	GD	On-Demand	Bother	BCL2L2	47	33
CC(=O)Nc1ncccc1NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450793892	GG	On-Demand	Anodyne	TRPV1	20	50
CC(=O)Nc1ncccc1NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450793892	GG	On-Demand	Anodyne	MAP3K5	40	32
C=CCOc1ccc(CC(=O)N[C@@H](C)COCC)cc1	ZINC000450793894	CE	On-Demand	Mild	ACACA	46	36
CC(C)C1(C)CCN(C(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450793897	EG	On-Demand	Anodyne	THYX_PBCV1	0	45
C[C@]1(CNC(=O)CSC2CC2)CCCN1Cc1ccccc1	ZINC000450793912	DG	On-Demand	Anodyne	NPFFR1	54	40
C[C@@]1(CNC(=O)CSC2CC2)CCCN1Cc1ccccc1	ZINC000450793913	DG	On-Demand	Anodyne	NPFFR1	54	40
CC(C)OC(C)(C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450793917	FE	On-Demand	Anodyne	NPY2R	37	43
CC(C)OC(C)(C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450793917	FE	On-Demand	Anodyne	EPHX2	24	59
CNC(=O)c1ccn([C@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)n1	ZINC000450793921	FF	On-Demand	Anodyne	DRD3	0	44
CNC(=O)c1ccn([C@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)n1	ZINC000450793921	FF	On-Demand	Anodyne	CCR3	32	44
CNC(=O)c1ccn([C@@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)n1	ZINC000450793922	FF	On-Demand	Anodyne	DRD3	0	44
CNC(=O)c1ccn([C@@H]2CCCN(Cc3ccc(Cl)c(OC)c3)C2)n1	ZINC000450793922	FF	On-Demand	Anodyne	CCR3	32	44
COCC(COC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450793924	CE	On-Demand	Anodyne	FGFR1	0	50
COCC(COC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450793924	CE	On-Demand	Anodyne	FLT1	27	50
COCC(COC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450793924	CE	On-Demand	Anodyne	PDGFRA	45	37
COCC(COC)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450793926	DE	On-Demand	Bother	MAOB	29	51
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)[C@@H](C)O	ZINC000450793932	CD	On-Demand	Anodyne	ADORA1	46	48
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)[C@@H](C)O	ZINC000450793932	CD	On-Demand	Anodyne	ADORA3	43	32
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)[C@@H](C)O	ZINC000450793932	CD	On-Demand	Anodyne	OXGR1	64	32
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@@H](C)O	ZINC000450793933	CD	On-Demand	Anodyne	ADORA1	46	48
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@@H](C)O	ZINC000450793933	CD	On-Demand	Anodyne	ADORA3	43	32
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@@H](C)O	ZINC000450793933	CD	On-Demand	Anodyne	OXGR1	64	32
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)[C@H](C)O	ZINC000450793934	CD	On-Demand	Anodyne	ADORA1	46	48
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)[C@H](C)O	ZINC000450793934	CD	On-Demand	Anodyne	ADORA3	43	32
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)[C@H](C)O	ZINC000450793934	CD	On-Demand	Anodyne	OXGR1	64	32
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](C)O	ZINC000450793935	CD	On-Demand	Anodyne	ADORA1	46	48
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](C)O	ZINC000450793935	CD	On-Demand	Anodyne	ADORA3	43	32
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](C)O	ZINC000450793935	CD	On-Demand	Anodyne	OXGR1	64	32
CC1(CO)CN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450793951	CD	On-Demand	Bother	SLC6A4	15	54
Cc1ccc2ncnc(N3CC(C)(CO)C3)c2c1	ZINC000450793955	BD	On-Demand	Anodyne	PDGFRB	28	45
COc1cc(CC(=O)N(C)[C@@H]2CCCC[C@H]2O)ccc1Cl	ZINC000450793984	DF	On-Demand	Anodyne	OPRM1	24	61
COc1cc(CC(=O)N(C)[C@@H]2CCCC[C@H]2O)ccc1Cl	ZINC000450793984	DF	On-Demand	Anodyne	OPRK1	24	46
CCOc1ccc(NC(=O)c2nn(C)c3c2CCCC3)cc1Br	ZINC000450794001	GH	On-Demand	Anodyne	HTR2A	36	41
COCC[C@@H](Cc1ccco1)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450794023	FH	On-Demand	Anodyne	NPPA	44	34
COCC[C@H](Cc1ccco1)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450794024	FH	On-Demand	Anodyne	NPPA	44	34
C[C@H]1CN(c2ncnc3c2oc2ccccc23)C[C@@H](C)N1CCO	ZINC000450794028	EE	On-Demand	Anodyne	HRH4	17	60
Cc1ccc(F)c(CC(=O)N2CCN(CC(C)C)C(=O)C2)c1	ZINC000450794045	DE	On-Demand	Anodyne	DPP4	19	43
CC[C@@H](O)CC(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450794049	DF	On-Demand	Anodyne	CES2	20	43
CC[C@H](O)CC(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450794050	DF	On-Demand	Anodyne	CES2	20	43
CC[C@@H](O)CC(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450794051	DF	On-Demand	Anodyne	CES2	20	43
CC[C@H](O)CC(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000450794052	DF	On-Demand	Anodyne	CES2	20	43
Cc1ccc(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)c(Cl)c1Cl	ZINC000450794054	GJ	On-Demand	Anodyne	MAPK13	26	41
C[C@@H]1[C@@H](NC(=O)c2c(Cl)cc(Cl)cc2Cl)CCCN1C	ZINC000450794069	EH	On-Demand	Anodyne	CACNA1I	44	33
C[C@@H]1[C@H](NC(=O)c2c(Cl)cc(Cl)cc2Cl)CCCN1C	ZINC000450794074	EH	On-Demand	Anodyne	CACNA1I	44	33
C[C@H]1[C@H](NC(=O)c2c(Cl)cc(Cl)cc2Cl)CCCN1C	ZINC000450794076	EH	On-Demand	Anodyne	CACNA1I	44	33
C[C@H]1[C@@H](NC(=O)c2c(Cl)cc(Cl)cc2Cl)CCCN1C	ZINC000450794077	EH	On-Demand	Anodyne	CACNA1I	44	33
COc1cc2c(N3CC(C)(CO)C3)ccnc2cc1F	ZINC000450794079	CE	On-Demand	Anodyne	PDGFRB	15	40
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450794080	GD	On-Demand	Anodyne	F2	41	49
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450794080	GD	On-Demand	Anodyne	MMP13	21	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450794080	GD	On-Demand	Anodyne	TRY2_BOVIN	84	38
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450794080	GD	On-Demand	Anodyne	CAPNS1	19	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450794080	GD	On-Demand	Anodyne	MMP2	23	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450794080	GD	On-Demand	Anodyne	ST14	98	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450794080	GD	On-Demand	Anodyne	LEF	43	35
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450794080	GD	On-Demand	Anodyne	TMPRSS6	62	33
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450794081	GD	On-Demand	Anodyne	F2	41	49
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450794081	GD	On-Demand	Anodyne	MMP13	21	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450794081	GD	On-Demand	Anodyne	TRY2_BOVIN	84	38
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450794081	GD	On-Demand	Anodyne	CAPNS1	19	43
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450794081	GD	On-Demand	Anodyne	MMP2	23	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450794081	GD	On-Demand	Anodyne	ST14	98	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450794081	GD	On-Demand	Anodyne	LEF	43	35
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450794081	GD	On-Demand	Anodyne	TMPRSS6	62	33
CC1(CO)CN(c2cc(C#N)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450794104	CD	On-Demand	Mild	F2RL3	44	35
C[C@H](O)CN1CCN(C(=O)[C@@H](C)Oc2ccccn2)CC1	ZINC000450794129	CC	On-Demand	Anodyne	ABCB1	23	40
C[C@H](O)CN1CCN(C(=O)[C@H](C)Oc2ccccn2)CC1	ZINC000450794130	CC	On-Demand	Anodyne	ABCB1	23	40
CS(=O)(=O)C[C@@H]1CCCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450794141	ED	On-Demand	Anodyne	P2RY12	27	41
CS(=O)(=O)C[C@@H]1CCCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450794141	ED	On-Demand	Anodyne	CXCR3	29	41
CS(=O)(=O)C[C@H]1CCCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450794142	ED	On-Demand	Anodyne	P2RY12	27	41
CS(=O)(=O)C[C@H]1CCCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450794142	ED	On-Demand	Anodyne	CXCR3	29	41
CNC(=O)c1ccc(N2CCCC[C@@H]2CS(C)(=O)=O)c([N+](=O)[O-])c1	ZINC000450794143	FD	On-Demand	Bother	TAAR1	15	41
CNC(=O)c1ccc(N2CCCC[C@H]2CS(C)(=O)=O)c([N+](=O)[O-])c1	ZINC000450794144	FD	On-Demand	Bother	TAAR1	15	41
Cc1ccc(C2CCN(C(=O)C3(Cc4cccc(Cl)c4)CC3)CC2)cn1	ZINC000450794154	FJ	On-Demand	Anodyne	CCR1	39	44
COCc1cc([N+](=O)[O-])ccc1NCc1cnccc1C	ZINC000450794169	CG	On-Demand	Bother	CACNA1D	45	32
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cs1	ZINC000450794174	EI	On-Demand	Anodyne	CPT1A	42	42
CCN(C[C@@H](O)C(F)(F)F)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450794184	DD	On-Demand	Anodyne	TRPV1	26	44
CCN(C[C@H](O)C(F)(F)F)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450794190	DD	On-Demand	Anodyne	TRPV1	26	44
CC[C@@H](Nc1ncc(-c2ccccc2)s1)[C@H](C)O	ZINC000450794213	CG	On-Demand	Anodyne	FABK	0	44
C=CCN(C)C(=O)[C@@](C)(Cc1ccc(OC)c(OC)c1)NC(C)=O	ZINC000450794291	ED	On-Demand	Mild	MT-ND1	26	41
COc1ccc(F)cc1CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450794292	DF	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(F)cc1CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450794292	DF	On-Demand	Anodyne	P2RX7	48	48
COc1ccc(F)cc1CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000450794292	DF	On-Demand	Anodyne	CARM1	32	43
COC[C@@]1(C(=O)NCc2ccc(Cl)cc2F)CCOC1	ZINC000450794300	DE	On-Demand	Anodyne	BDKRB1	20	40
COC[C@]1(C(=O)NCc2ccc(Cl)cc2F)CCOC1	ZINC000450794301	DE	On-Demand	Anodyne	BDKRB1	20	40
COC(=O)c1ccc(CN(C)[C@@H]2CCCC[C@H]2O)cc1Cl	ZINC000450794311	DF	On-Demand	Anodyne	OPRK1	23	40
Clc1ccc(CCN2CCC(Cn3cncn3)CC2)cc1	ZINC000450794323	DF	On-Demand	Anodyne	SIGMAR1	24	48
Clc1ccc(CCN2CCC(Cn3cncn3)CC2)cc1	ZINC000450794323	DF	On-Demand	Anodyne	CYP51	0	44
COc1cc(OC)c(NC(=O)[C@@H]2Cc3c(C)cccc3O2)cc1Br	ZINC000450794334	GH	On-Demand	Anodyne	MT-ND4	55	35
COc1cc(OC)c(NC(=O)[C@H]2Cc3c(C)cccc3O2)cc1Br	ZINC000450794335	GH	On-Demand	Anodyne	MT-ND4	55	35
COc1ccc(F)cc1CNC(=O)C(C)(C)OC(C)C	ZINC000450794338	CF	On-Demand	Anodyne	PPARA	16	42
COc1ccc(F)cc1CNC(=O)C(C)(C)OC(C)C	ZINC000450794338	CF	On-Demand	Anodyne	PPARD	21	42
COc1ccc(F)cc1CNC(=O)C(C)(C)OC(C)C	ZINC000450794338	CF	On-Demand	Anodyne	MT-ND1	16	42
COc1ccc(F)cc1CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450794349	FF	On-Demand	Anodyne	P2RX7	52	41
COc1ccc(F)cc1CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450794349	FF	On-Demand	Anodyne	PDEC	0	52
COc1ccc(F)cc1CNC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450794349	FF	On-Demand	Anodyne	ACKR3	45	31
COc1ccc(F)cc1CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450794350	FF	On-Demand	Anodyne	P2RX7	52	41
COc1ccc(F)cc1CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450794350	FF	On-Demand	Anodyne	PDEC	0	52
COc1ccc(F)cc1CNC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450794350	FF	On-Demand	Anodyne	ACKR3	45	31
C[C@@H]1C(=O)N(C)CCN1CCc1ccc(Cl)cc1	ZINC000450794356	CE	On-Demand	Anodyne	HRH3	28	43
C[C@@H]1C(=O)N(C)CCN1CCc1ccc(Cl)cc1	ZINC000450794356	CE	On-Demand	Anodyne	CACNA1D	49	43
C[C@H]1C(=O)N(C)CCN1CCc1ccc(Cl)cc1	ZINC000450794357	CE	On-Demand	Anodyne	HRH3	28	43
C[C@H]1C(=O)N(C)CCN1CCc1ccc(Cl)cc1	ZINC000450794357	CE	On-Demand	Anodyne	CACNA1D	49	43
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncc(Cl)cn2)CC1	ZINC000450794368	GG	On-Demand	Anodyne	GPR119	17	45
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncc(Cl)cn2)CC1	ZINC000450794369	GG	On-Demand	Anodyne	GPR119	17	45
CCN(Cc1ccc(S(=O)(=O)CC)cc1)C[C@@H](O)C(F)(F)F	ZINC000450794372	EE	On-Demand	Anodyne	RORC	27	41
CCN(Cc1ccc(S(=O)(=O)CC)cc1)C[C@H](O)C(F)(F)F	ZINC000450794373	EE	On-Demand	Anodyne	RORC	27	41
COc1cc(CC(=O)NCc2nnnn2C)ccc1Cl	ZINC000450794378	CC	On-Demand	Anodyne	TRPV1	32	45
COc1cc(CC(=O)NCc2nnnn2C)ccc1Cl	ZINC000450794378	CC	On-Demand	Anodyne	NCE103	28	46
COc1cc(CC(=O)NCc2nnnn2C)ccc1Cl	ZINC000450794378	CC	On-Demand	Anodyne	CAN2	0	46
CC(=O)Nc1ncccc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450794408	DE	On-Demand	Anodyne	G2YM83_BOTF4	45	34
O=C(NC1CC1)[C@@H](O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450794412	FF	On-Demand	Anodyne	BIRC2	40	35
O=C(NC1CC1)[C@H](O)C1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450794413	FF	On-Demand	Anodyne	BIRC2	40	35
COc1cc(OC)c2ncc(C#N)c(Nc3cnn([C@H]4CCOC4)c3C)c2c1	ZINC000450794414	GG	On-Demand	Mild	SRC	94	43
COc1cc(OC)c2ncc(C#N)c(Nc3cnn([C@@H]4CCOC4)c3C)c2c1	ZINC000450794415	GG	On-Demand	Mild	SRC	94	43
CSc1ccc2ncnc(N3C[C@H](C)N(CCO)[C@H](C)C3)c2c1	ZINC000450794416	EE	On-Demand	Anodyne	HTT	0	40
COCc1nn(C)cc1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450794417	FE	On-Demand	Anodyne	HCN1	69	37
COCc1nn(C)cc1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450794417	FE	On-Demand	Anodyne	HCN4	50	33
COCc1nn(C)cc1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450794418	FE	On-Demand	Anodyne	HCN1	69	37
COCc1nn(C)cc1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450794418	FE	On-Demand	Anodyne	HCN4	50	33
CCC(=O)C1(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)CC1	ZINC000450794421	EF	On-Demand	Anodyne	NPFFR1	48	36
CCC(=O)C1(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)CC1	ZINC000450794421	EF	On-Demand	Anodyne	SLC12A5	45	33
CCC(=O)C1(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)CC1	ZINC000450794422	EF	On-Demand	Anodyne	NPFFR1	48	36
CCC(=O)C1(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)CC1	ZINC000450794422	EF	On-Demand	Anodyne	SLC12A5	45	33
Cc1cccc(Cl)c1CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450794434	EE	On-Demand	Anodyne	DRD4	18	42
Cc1cccc(Cl)c1CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450794434	EE	On-Demand	Anodyne	SIGMAR1	24	51
Cc1cccc(Cl)c1CN1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450794434	EE	On-Demand	Anodyne	P2RX7	17	41
Cc1cccc(Cl)c1CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450794438	EE	On-Demand	Anodyne	DRD4	18	42
Cc1cccc(Cl)c1CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450794438	EE	On-Demand	Anodyne	SIGMAR1	24	51
Cc1cccc(Cl)c1CN1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450794438	EE	On-Demand	Anodyne	P2RX7	17	41
COC(=O)c1ccc(CN2CCC[C@H]2CN(C(C)=O)C2CC2)cc1Cl	ZINC000450794439	FG	On-Demand	Anodyne	DRD2	45	39
COC(=O)c1ccc(CN2CCC[C@H]2CN(C(C)=O)C2CC2)cc1Cl	ZINC000450794439	FG	On-Demand	Anodyne	OPRK1	0	41
COC(=O)c1ccc(CN2CCC[C@@H]2CN(C(C)=O)C2CC2)cc1Cl	ZINC000450794440	FG	On-Demand	Anodyne	DRD2	45	39
COC(=O)c1ccc(CN2CCC[C@@H]2CN(C(C)=O)C2CC2)cc1Cl	ZINC000450794440	FG	On-Demand	Anodyne	OPRK1	0	41
CCCCNc1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc(N)n1	ZINC000450794443	DC	On-Demand	Anodyne	HRH4	33	41
COc1cc2c(N3C[C@H](C4CC4)[C@H]3C3CC3)ncnc2cc1F	ZINC000450794453	DG	On-Demand	Anodyne	PDE3A	54	41
COc1cc2c(N3C[C@H](C4CC4)[C@@H]3C3CC3)ncnc2cc1F	ZINC000450794454	DG	On-Demand	Anodyne	PDE3A	54	41
COc1cc2c(N3C[C@@H](C4CC4)[C@@H]3C3CC3)ncnc2cc1F	ZINC000450794456	DG	On-Demand	Anodyne	PDE3A	54	41
COc1cc2c(N3C[C@@H](C4CC4)[C@H]3C3CC3)ncnc2cc1F	ZINC000450794458	DG	On-Demand	Anodyne	PDE3A	54	41
CC1(CO)CN(c2ccc3c(Cl)c4c(nc3c2)CCCC4)C1	ZINC000450794466	DH	On-Demand	Anodyne	ACHE	44	38
O=C(NC1CC1)[C@@H](O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450794468	EE	On-Demand	Anodyne	O19067_PIG	0	40
O=C(NC1CC1)[C@H](O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450794469	EE	On-Demand	Anodyne	O19067_PIG	0	40
CCOC[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450794475	CE	On-Demand	Anodyne	OPRK1	0	42
CCOC[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450794475	CE	On-Demand	Anodyne	NCE103	25	41
CCOC[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450794475	CE	On-Demand	Anodyne	CAN2	0	41
CCc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)n1	ZINC000450794487	FF	On-Demand	Anodyne	NPY2R	49	33
CCc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)n1	ZINC000450794487	FF	On-Demand	Anodyne	JAK1	0	41
CCc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)n1	ZINC000450794487	FF	On-Demand	Anodyne	BTK	43	37
CCc1cccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)n1	ZINC000450794487	FF	On-Demand	Anodyne	STAT6	48	33
CC(=O)Nc1ncccc1NC(=O)C1=C(C)CC(C)(C)CC1	ZINC000450794500	DH	On-Demand	Anodyne	G2YM83_BOTF4	71	39
Cc1cc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)nn1C(C)C	ZINC000450794501	FH	On-Demand	Anodyne	HCN1	42	32
Cc1cc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)nn1C(C)C	ZINC000450794502	FH	On-Demand	Anodyne	HCN1	42	32
CO[C@@H]1COCC[C@H]1CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450794513	FF	On-Demand	Anodyne	NPFFR1	43	35
CO[C@@H]1COCC[C@@H]1CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450794514	FF	On-Demand	Anodyne	NPFFR1	43	35
CO[C@@H]1COCC[C@@H]1CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450794515	FF	On-Demand	Anodyne	NPFFR1	43	35
CO[C@@H]1COCC[C@H]1CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450794516	FF	On-Demand	Anodyne	NPFFR1	43	35
COC(=O)c1cc(C)nc(N2CC(C)(CO)C2)c1[N+](=O)[O-]	ZINC000450794522	CC	On-Demand	Bother	CACNA1D	60	34
CCc1cccc(C(=O)Nc2ccc3c(c2)CCN3C(=O)COC)n1	ZINC000450794531	EE	On-Demand	Anodyne	EIF2AK3	54	36
C[C@H]1CN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)C[C@@H](C)N1CCO	ZINC000450794532	GD	On-Demand	Anodyne	GCK	41	30
C[C@H]1CN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)C[C@@H](C)N1CCO	ZINC000450794532	GD	On-Demand	Anodyne	GCKR	72	35
COCC(COC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450794554	FG	On-Demand	Bother	TAAR1	27	54
Cc1ccn(-c2ccccc2C(=O)N(C)CC2(O)CCCCCC2)n1	ZINC000450794587	EG	On-Demand	Anodyne	HCN1	49	31
Cc1ccn(-c2ccccc2C(=O)N(C)CC2(O)CCCCCC2)n1	ZINC000450794587	EG	On-Demand	Anodyne	HCN4	47	31
C[C@H]1CN(c2cnc3ccccc3n2)C[C@@H](C)N1CCO	ZINC000450794588	CD	On-Demand	Anodyne	SORD	22	54
CC(C)CN1CCN(C(=O)c2cccc3c2O[C@H](C)C3)CC1=O	ZINC000450794596	DD	On-Demand	Anodyne	P2RX7	0	60
CC(C)CN1CCN(C(=O)c2cccc3c2O[C@@H](C)C3)CC1=O	ZINC000450794597	DD	On-Demand	Anodyne	P2RX7	0	60
C[C@H]1CN(c2cc(C#N)ccn2)C[C@@H](C)N1CCO	ZINC000450794607	CC	On-Demand	Mild	SORD	44	35
COCC(COC)N=c1cc[nH]c(C(=O)NCc2ccccc2)c1	ZINC000450794637	ED	On-Demand	Anodyne	PDS	49	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](c2n[nH]cc2CN2CCOCC2)C1	ZINC000450794639	GF	On-Demand	Anodyne	CASR	41	33
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](c2n[nH]cc2CN2CCOCC2)C1	ZINC000450794640	GF	On-Demand	Anodyne	CASR	41	33
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](c2n[nH]cc2CN2CCOCC2)C1	ZINC000450794641	GF	On-Demand	Anodyne	CASR	41	33
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](c2n[nH]cc2CN2CCOCC2)C1	ZINC000450794642	GF	On-Demand	Anodyne	CASR	41	33
COCC(COC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450794650	CD	On-Demand	Anodyne	EGFR	23	42
COCC(=O)N1CCc2cc(NC(=O)[C@@H](C)Oc3ccccn3)ccc21	ZINC000450794683	FE	On-Demand	Anodyne	IMDH_CRYPV	30	40
COCC(=O)N1CCc2cc(NC(=O)[C@@H](C)Oc3ccccn3)ccc21	ZINC000450794683	FE	On-Demand	Anodyne	EIF2AK3	78	39
COCC(=O)N1CCc2cc(NC(=O)[C@H](C)Oc3ccccn3)ccc21	ZINC000450794684	FE	On-Demand	Anodyne	IMDH_CRYPV	30	40
COCC(=O)N1CCc2cc(NC(=O)[C@H](C)Oc3ccccn3)ccc21	ZINC000450794684	FE	On-Demand	Anodyne	EIF2AK3	78	39
CC[C@H](Nc1ncc(-c2ccccc2)s1)[C@H](C)O	ZINC000450794685	CG	On-Demand	Anodyne	FABK	0	44
CC[C@H](Nc1ncc(-c2ccccc2)s1)[C@@H](C)O	ZINC000450794686	CG	On-Demand	Anodyne	FABK	0	44
CC[C@@H](Nc1ncc(-c2ccccc2)s1)[C@@H](C)O	ZINC000450794687	CG	On-Demand	Anodyne	FABK	0	44
Cc1cc(C)nc(N2CCN(C(=O)c3c(C)cccc3Cl)CC2)n1	ZINC000450794692	EG	On-Demand	Anodyne	SLC6A7	0	42
C[C@@H](O)C[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450794696	DD	On-Demand	Anodyne	F7	30	43
C[C@H](O)C[C@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450794697	DD	On-Demand	Anodyne	F7	30	43
C[C@@H](C[C@@H](C)O)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450794698	DD	On-Demand	Anodyne	F7	30	43
C[C@H](O)C[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450794699	DD	On-Demand	Anodyne	F7	30	43
C[C@H](O)C[C@@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450794708	CF	On-Demand	Anodyne	TIMP3	41	33
C[C@H](O)C[C@@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450794708	CF	On-Demand	Anodyne	LMGT2	0	43
C[C@@H](C[C@@H](C)O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450794709	CF	On-Demand	Anodyne	TIMP3	41	33
C[C@@H](C[C@@H](C)O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450794709	CF	On-Demand	Anodyne	LMGT2	0	43
C[C@H](O)C[C@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450794710	CF	On-Demand	Anodyne	TIMP3	41	33
C[C@H](O)C[C@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450794710	CF	On-Demand	Anodyne	LMGT2	0	43
C[C@@H](O)C[C@@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450794711	CF	On-Demand	Anodyne	TIMP3	41	33
C[C@@H](O)C[C@@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450794711	CF	On-Demand	Anodyne	LMGT2	0	43
Cc1ccc(C2CCN(C(=O)Cc3sccc3Br)CC2)cn1	ZINC000450794752	GI	On-Demand	Anodyne	ETHR	43	37
COc1ccc(Cn2ccc(NC(=O)c3cc(C)n(C(C)C)n3)n2)cc1	ZINC000450794764	FF	On-Demand	Anodyne	PROKR1	44	31
CCn1c(SCc2nc(C(=O)OC)cs2)nc2ccsc2c1=O	ZINC000450794771	FG	On-Demand	Anodyne	PDE7A	16	45
Cc1nc([C@@H]2CCCN2C(=O)c2ccc(C(F)(F)F)cc2C)cs1	ZINC000450794783	FJ	On-Demand	Anodyne	CPT1A	21	43
CCc1nc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)s1	ZINC000450794803	FF	On-Demand	Anodyne	COLA	77	36
CCc1nc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)s1	ZINC000450794803	FF	On-Demand	Anodyne	CPT1A	47	33
CCc1nc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)s1	ZINC000450794803	FF	On-Demand	Anodyne	CPT2	43	34
CCc1nc(C)c(NC(=O)c2ccc(OC)c(S(C)(=O)=O)c2)s1	ZINC000450794803	FF	On-Demand	Anodyne	CPT1B	73	35
COc1ccc(CNC(=O)CCN(C)[C@@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450794808	FD	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCN(C)[C@@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450794808	FD	On-Demand	Anodyne	MTNR1A	64	38
COc1ccc(CNC(=O)CCN(C)[C@@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450794808	FD	On-Demand	Anodyne	MTNR1B	51	38
C=C[C@@H]1OCC[C@H]1C(=O)NCc1ccc(Cl)cc1F	ZINC000450794810	CF	On-Demand	Mild	P2RX7	33	40
COc1ccc(F)cc1CNC(=O)c1nn2c(c1C)OCCC2	ZINC000450794811	DE	On-Demand	Anodyne	P2RX7	40	39
O=C(Nc1ccc(Oc2ccc(Cl)cc2)cn1)C1(CF)CCOCC1	ZINC000450794817	FI	On-Demand	Anodyne	MMP13	25	49
O=C(Nc1ccc(Oc2ccc(Cl)cc2)cn1)C1(CF)CCOCC1	ZINC000450794817	FI	On-Demand	Anodyne	MMP2	20	49
O=C(Nc1ccc(Oc2ccc(Cl)cc2)cn1)C1(CF)CCOCC1	ZINC000450794817	FI	On-Demand	Anodyne	MMP14	24	49
O=C(Nc1ccc(Oc2ccc(Cl)cc2)cn1)C1(CF)CCOCC1	ZINC000450794817	FI	On-Demand	Anodyne	MMP9	17	49
O=C(Nc1ccc(Oc2ccc(Cl)cc2)cn1)C1(CF)CCOCC1	ZINC000450794817	FI	On-Demand	Anodyne	MMP10	16	49
C[C@@H]1C(=O)N(C)CCN1CCCC(=O)c1ccccc1	ZINC000450794823	CD	On-Demand	Anodyne	HDAC8	18	40
C[C@@H]1C(=O)N(C)CCN1CCCC(=O)c1ccccc1	ZINC000450794823	CD	On-Demand	Anodyne	CYP2J2	59	42
C[C@H]1C(=O)N(C)CCN1CCCC(=O)c1ccccc1	ZINC000450794826	CD	On-Demand	Anodyne	HDAC8	18	40
C[C@H]1C(=O)N(C)CCN1CCCC(=O)c1ccccc1	ZINC000450794826	CD	On-Demand	Anodyne	CYP2J2	59	42
C/C=C\COc1cccc(CC(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450794835	GF	On-Demand	Anodyne	CACNA1G	30	40
C/C=C\COc1cccc(CC(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450794837	GF	On-Demand	Anodyne	CACNA1G	30	40
CCC[C@@H](O)CN1CCC[C@@H]1CCO	ZINC000450794839	BC	On-Demand	Anodyne	SLC18A2	45	37
CCC[C@H](O)CN1CCC[C@@H]1CCO	ZINC000450794841	BC	On-Demand	Anodyne	SLC18A2	45	37
CCC[C@H](O)CN1CCC[C@H]1CCO	ZINC000450794851	BC	On-Demand	Anodyne	SLC18A2	45	37
COCC[C@H](Cc1ccco1)NC(=O)[C@@]1(C)CC=CCC1	ZINC000450794852	CG	On-Demand	Anodyne	NPPA	42	33
COCC[C@H](Cc1ccco1)NC(=O)[C@]1(C)CC=CCC1	ZINC000450794853	CG	On-Demand	Anodyne	NPPA	42	33
COCC[C@@H](Cc1ccco1)NC(=O)[C@]1(C)CC=CCC1	ZINC000450794854	CG	On-Demand	Anodyne	NPPA	42	33
COCC[C@@H](Cc1ccco1)NC(=O)[C@@]1(C)CC=CCC1	ZINC000450794855	CG	On-Demand	Anodyne	NPPA	42	33
CCC[C@@H](O)CN1CCC[C@H]1CCO	ZINC000450794856	BC	On-Demand	Anodyne	SLC18A2	45	37
C[C@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@@H]1O	ZINC000450794862	FD	On-Demand	Mild	HTR1D	15	41
C[C@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@@H]1O	ZINC000450794862	FD	On-Demand	Mild	HTR1B	17	41
C[C@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@H]1O	ZINC000450794863	FD	On-Demand	Mild	HTR1D	15	41
C[C@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@H]1O	ZINC000450794863	FD	On-Demand	Mild	HTR1B	17	41
C[C@@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@H]1O	ZINC000450794865	FD	On-Demand	Mild	HTR1D	15	41
C[C@@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@H]1O	ZINC000450794865	FD	On-Demand	Mild	HTR1B	17	41
C[C@@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@@H]1O	ZINC000450794866	FD	On-Demand	Mild	HTR1D	15	41
C[C@@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@@H]1O	ZINC000450794866	FD	On-Demand	Mild	HTR1B	17	41
COc1cc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ccnc2cc1F	ZINC000450794871	EE	On-Demand	Anodyne	PDE3A	41	32
COc1cc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ccnc2cc1F	ZINC000450794871	EE	On-Demand	Anodyne	PDE3B	61	32
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450794874	CG	On-Demand	Anodyne	G2YM83_BOTF4	58	33
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450794876	CG	On-Demand	Anodyne	G2YM83_BOTF4	58	33
CCC[C@H]1CCC[C@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450794878	CG	On-Demand	Anodyne	G2YM83_BOTF4	58	33
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450794880	CG	On-Demand	Anodyne	G2YM83_BOTF4	58	33
Cc1ccc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ccnc2n1	ZINC000450794899	DD	On-Demand	Anodyne	SORD	40	32
Cc1ccc(F)c(CC(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450794901	EE	On-Demand	Anodyne	CACNA1G	33	40
Cc1ccc(F)c(CC(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c1	ZINC000450794903	EE	On-Demand	Anodyne	CACNA1G	33	40
CC[C@@H]1C[C@H]1C(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450794904	CF	On-Demand	Anodyne	SLC6A1	0	42
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	DRD4	34	42
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	CHRM3	17	42
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	SIGMAR1	35	48
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	SSTR5	48	37
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	CCR3	25	40
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	SLC6A5	28	41
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	MCHR1	50	43
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	CACNA1G	39	41
C[C@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794923	GG	On-Demand	Anodyne	BIRC2	42	33
CC1(CO)CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450794924	CD	On-Demand	Anodyne	HTT	0	40
C[C@@H]1C(=O)N(C)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450794925	EC	On-Demand	Anodyne	THYX_PBCV1	0	42
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	DRD4	34	42
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	CHRM3	17	42
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	SIGMAR1	35	48
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	SSTR5	48	37
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	CCR3	25	40
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	SLC6A5	28	41
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	MCHR1	50	43
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	CACNA1G	39	41
C[C@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794926	GG	On-Demand	Anodyne	BIRC2	42	33
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	DRD4	34	42
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	CHRM3	17	42
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	SIGMAR1	35	48
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	SSTR5	48	37
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	CCR3	25	40
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	SLC6A5	28	41
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	MCHR1	50	43
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	CACNA1G	39	41
C[C@@H](c1ccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794928	GG	On-Demand	Anodyne	BIRC2	42	33
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	DRD4	34	42
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	CHRM3	17	42
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	SIGMAR1	35	48
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	SSTR5	48	37
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	CCR3	25	40
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	SLC6A5	28	41
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	MCHR1	50	43
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	CACNA1G	39	41
C[C@@H](c1ccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)cc1)C(F)(F)F	ZINC000450794929	GG	On-Demand	Anodyne	BIRC2	42	33
C[C@H]1CN(c2nccc(Oc3ccccc3)n2)C[C@@H](C)N1CCO	ZINC000450794930	EE	On-Demand	Anodyne	SORD	63	38
C[C@H]1C(=O)N(C)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450794932	EC	On-Demand	Anodyne	THYX_PBCV1	0	42
COc1cc2nc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450794952	FC	On-Demand	Anodyne	ADRA1D	17	48
COc1cc2nc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450794952	FC	On-Demand	Anodyne	ADRA1B	47	48
COc1cc2nc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450794952	FC	On-Demand	Anodyne	CCR4	42	39
COc1cc2nc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450794952	FC	On-Demand	Anodyne	PDE3B	52	32
COc1cc2nc(N3C[C@H](C)N(CCO)[C@H](C)C3)nc(N)c2cc1OC	ZINC000450794952	FC	On-Demand	Anodyne	EHMT2	62	35
CCc1c(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)oc2ccccc12	ZINC000450794960	GH	On-Demand	Anodyne	NPY2R	42	35
CCc1c(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)oc2ccccc12	ZINC000450794960	GH	On-Demand	Anodyne	DGAT1	20	44
C[C@H]1CN(c2ncnc3cc(Br)ccc23)C[C@@H](C)N1CCO	ZINC000450794999	FE	On-Demand	Anodyne	PDE3B	52	33
CC(=O)Nc1ncccc1NC(=O)CCCC(=O)C(C)(C)C	ZINC000450795003	DF	On-Demand	Anodyne	BDKRB1	0	44
CC(=O)Nc1ncccc1NC(=O)CCCC(=O)C(C)(C)C	ZINC000450795003	DF	On-Demand	Anodyne	MAP1	24	42
Cc1cccc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450795004	BD	On-Demand	Anodyne	SORD	44	36
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H]3CCCC[C@H]3O)ccc21	ZINC000450795005	GG	On-Demand	Anodyne	HPGD	51	60
COc1ccccc1-n1cnc2cc(C(=O)N(C)[C@@H]3CCCC[C@H]3O)ccc21	ZINC000450795005	GG	On-Demand	Anodyne	ACKR3	51	32
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450795006	GG	On-Demand	Anodyne	GRIN2B	21	42
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450795006	GG	On-Demand	Anodyne	P2RX7	77	41
COc1ccc(F)cc1CNC(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450795006	GG	On-Demand	Anodyne	EPHX2	19	42
CC1(CO)CN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450795012	EG	On-Demand	Anodyne	ADRB3	0	44
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450795018	GG	On-Demand	Anodyne	GRIN2B	21	42
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450795018	GG	On-Demand	Anodyne	P2RX7	77	41
COc1ccc(F)cc1CNC(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450795018	GG	On-Demand	Anodyne	EPHX2	19	42
c1ccc(CCn2ccc(CN3CCC(Cn4cncn4)CC3)n2)cc1	ZINC000450795026	FF	On-Demand	Anodyne	SIGMAR1	32	40
COc1cc(OC)nc(N2CC(C)(CO)C2)n1	ZINC000450795033	BC	On-Demand	Anodyne	ALS	61	31
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](O)[C@@H](C)C1	ZINC000450795037	CD	On-Demand	Anodyne	DPP4	15	43
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](O)[C@@H](C)C1	ZINC000450795038	CD	On-Demand	Anodyne	DPP4	15	43
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](O)[C@H](C)C1	ZINC000450795040	CD	On-Demand	Anodyne	DPP4	15	43
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](O)[C@H](C)C1	ZINC000450795041	CD	On-Demand	Anodyne	DPP4	15	43
COC(=O)CNC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450795048	FC	On-Demand	Bother	TAAR1	23	47
CCOc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1Br	ZINC000450795062	GJ	On-Demand	Anodyne	TRPV1	18	47
CCOc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1Br	ZINC000450795062	GJ	On-Demand	Anodyne	P4HTM	0	49
CCOc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1Br	ZINC000450795062	GJ	On-Demand	Anodyne	KCNK3	38	40
CCOc1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)cc1Br	ZINC000450795062	GJ	On-Demand	Anodyne	KCNK9	37	40
CC(C)NC(=O)c1ccc(N2C[C@H](C)N(CCO)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450795087	FD	On-Demand	Bother	TAAR1	22	43
C[C@H]1CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H](C)N1CCO	ZINC000450795090	FD	On-Demand	Bother	TAAR1	15	43
COCC(COC)Nc1c(C#N)cnc2c(OC)cc(OC)cc12	ZINC000450795095	EE	On-Demand	Mild	SRC	31	41
COCC(COC)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450795108	EC	On-Demand	Anodyne	NPY2R	45	37
COCC(=O)N1CCc2cc(NC(=O)c3ccc(-c4cnn(C)c4)o3)ccc21	ZINC000450795127	GE	On-Demand	Anodyne	SCN10A	17	43
COCC(=O)N1CCc2cc(NC(=O)c3ccc(-c4cnn(C)c4)o3)ccc21	ZINC000450795127	GE	On-Demand	Anodyne	EIF2AK3	67	41
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)c1cccc2c1CCCC2	ZINC000450795131	FF	On-Demand	Anodyne	AVPR2	44	41
CCc1cccc(C(=O)NCc2cc(F)ccc2OC)n1	ZINC000450795136	CF	On-Demand	Anodyne	PDE5A	0	42
CCc1cccc(C(=O)NCc2cc(F)ccc2OC)n1	ZINC000450795136	CF	On-Demand	Anodyne	GRIN2B	27	43
CCc1cccc(C(=O)NCc2cc(F)ccc2OC)n1	ZINC000450795136	CF	On-Demand	Anodyne	P2RX7	40	40
CCc1cccc(C(=O)NCc2cc(F)ccc2OC)n1	ZINC000450795136	CF	On-Demand	Anodyne	PPARD	22	45
C[C@@H]1CN(Cc2ccccc2OC2CC2)CC[C@@H]1O	ZINC000450795146	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1CN(Cc2ccccc2OC2CC2)CC[C@@H]1O	ZINC000450795146	CE	On-Demand	Anodyne	SLC5A4	54	35
C[C@@H]1CN(Cc2ccccc2OC2CC2)CC[C@H]1O	ZINC000450795147	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1CN(Cc2ccccc2OC2CC2)CC[C@H]1O	ZINC000450795147	CE	On-Demand	Anodyne	SLC5A4	54	35
C[C@H]1CN(Cc2ccccc2OC2CC2)CC[C@H]1O	ZINC000450795148	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H]1CN(Cc2ccccc2OC2CC2)CC[C@H]1O	ZINC000450795148	CE	On-Demand	Anodyne	SLC5A4	54	35
C[C@H]1CN(Cc2ccccc2OC2CC2)CC[C@@H]1O	ZINC000450795149	CE	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H]1CN(Cc2ccccc2OC2CC2)CC[C@@H]1O	ZINC000450795149	CE	On-Demand	Anodyne	SLC5A4	54	35
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2C[C@@H](O)C2(C)C)cc1	ZINC000450795151	GD	On-Demand	Anodyne	MMP2	21	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2C[C@@H](O)C2(C)C)cc1	ZINC000450795151	GD	On-Demand	Anodyne	CAPN1	19	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]2C[C@@H](O)C2(C)C)cc1	ZINC000450795151	GD	On-Demand	Anodyne	LEF	48	36
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2C[C@@H](O)C2(C)C)cc1	ZINC000450795152	GD	On-Demand	Anodyne	MMP2	21	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2C[C@@H](O)C2(C)C)cc1	ZINC000450795152	GD	On-Demand	Anodyne	CAPN1	19	54
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@H]2C[C@@H](O)C2(C)C)cc1	ZINC000450795152	GD	On-Demand	Anodyne	LEF	48	36
COCC(COC)Nc1cc(N2CCCCC2)ncn1	ZINC000450795157	CD	On-Demand	Anodyne	GALR2	44	35
CCOc1ccc(NC(=O)[C@@]2(C#N)C[C@@H]2C)cc1Br	ZINC000450795164	DG	On-Demand	Mild	HCN4	40	30
CCOc1ccc(NC(=O)[C@@]2(C#N)C[C@@H]2C)cc1Br	ZINC000450795164	DG	On-Demand	Mild	KCNK3	32	40
CCOc1ccc(NC(=O)[C@@]2(C#N)C[C@@H]2C)cc1Br	ZINC000450795164	DG	On-Demand	Mild	KCNK9	24	40
CCOc1ccc(NC(=O)[C@]2(C#N)C[C@H]2C)cc1Br	ZINC000450795165	DG	On-Demand	Mild	HCN4	40	30
CCOc1ccc(NC(=O)[C@]2(C#N)C[C@H]2C)cc1Br	ZINC000450795165	DG	On-Demand	Mild	KCNK3	32	40
CCOc1ccc(NC(=O)[C@]2(C#N)C[C@H]2C)cc1Br	ZINC000450795165	DG	On-Demand	Mild	KCNK9	24	40
CCOc1ccc(NC(=O)[C@]2(C#N)C[C@@H]2C)cc1Br	ZINC000450795166	DG	On-Demand	Mild	HCN4	40	30
CCOc1ccc(NC(=O)[C@]2(C#N)C[C@@H]2C)cc1Br	ZINC000450795166	DG	On-Demand	Mild	KCNK3	32	40
CCOc1ccc(NC(=O)[C@]2(C#N)C[C@@H]2C)cc1Br	ZINC000450795166	DG	On-Demand	Mild	KCNK9	24	40
CCOc1ccc(NC(=O)[C@@]2(C#N)C[C@H]2C)cc1Br	ZINC000450795167	DG	On-Demand	Mild	HCN4	40	30
CCOc1ccc(NC(=O)[C@@]2(C#N)C[C@H]2C)cc1Br	ZINC000450795167	DG	On-Demand	Mild	KCNK3	32	40
CCOc1ccc(NC(=O)[C@@]2(C#N)C[C@H]2C)cc1Br	ZINC000450795167	DG	On-Demand	Mild	KCNK9	24	40
CN(C)S(=O)(=O)c1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)c([N+](=O)[O-])c1	ZINC000450795168	GD	On-Demand	Bother	BDKRB1	0	40
CN(C)S(=O)(=O)c1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)c([N+](=O)[O-])c1	ZINC000450795168	GD	On-Demand	Bother	BCL2L1	44	31
COCC(COC)Nc1nc2ccccc2nc1N1CCOCC1	ZINC000450795190	ED	On-Demand	Anodyne	PIK3CA	18	43
C[C@H]1CN(c2nc(-c3ccccc3)ns2)C[C@@H](C)N1CCO	ZINC000450795192	DE	On-Demand	Anodyne	FAAH	17	46
Cc1ccncc1CNc1ccc(S(=O)(=O)NCCC(C)C)cn1	ZINC000450795201	EE	On-Demand	Anodyne	TBXAS1	30	42
COc1cccc(OCCC(=O)N2CCN(c3nc(C)cc(C)n3)CC2)c1	ZINC000450795202	FE	On-Demand	Anodyne	HTR1A	19	44
COc1cccc(OCCC(=O)N2CCN(c3nc(C)cc(C)n3)CC2)c1	ZINC000450795202	FE	On-Demand	Anodyne	DRD4	45	35
COc1cccc(OCCC(=O)N2CCN(c3nc(C)cc(C)n3)CC2)c1	ZINC000450795202	FE	On-Demand	Anodyne	HTR1D	16	43
COc1cccc(OCCC(=O)N2CCN(c3nc(C)cc(C)n3)CC2)c1	ZINC000450795202	FE	On-Demand	Anodyne	HTR1B	15	44
COc1cccc(OCCC(=O)N2CCN(c3nc(C)cc(C)n3)CC2)c1	ZINC000450795202	FE	On-Demand	Anodyne	MTNR1A	18	42
COc1cccc(OCCC(=O)N2CCN(c3nc(C)cc(C)n3)CC2)c1	ZINC000450795202	FE	On-Demand	Anodyne	MTNR1B	25	44
COc1ccc2c(c1)CN(c1ncnc3[nH]cnc13)CCO2	ZINC000450795203	CD	On-Demand	Anodyne	AHK3	0	42
CC[C@@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)[C@H](C)O	ZINC000450795204	DF	On-Demand	Anodyne	L3MBTL3	58	33
CC[C@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)[C@@H](C)O	ZINC000450795205	DF	On-Demand	Anodyne	L3MBTL3	58	33
CC[C@@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)[C@@H](C)O	ZINC000450795206	DF	On-Demand	Anodyne	L3MBTL3	58	33
CC[C@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)[C@H](C)O	ZINC000450795207	DF	On-Demand	Anodyne	L3MBTL3	58	33
C[C@H]1CCC[C@@]1(C)C(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450795212	DH	On-Demand	Anodyne	TBXAS1	20	40
CC[C@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)[C@H](C)O	ZINC000450795251	FD	On-Demand	Bother	TBXA2R	27	40
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)[C@@H](C)O	ZINC000450795252	FD	On-Demand	Bother	TBXA2R	27	40
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)[C@H](C)O	ZINC000450795253	FD	On-Demand	Bother	TBXA2R	27	40
CC[C@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)[C@@H](C)O	ZINC000450795254	FD	On-Demand	Bother	TBXA2R	27	40
C[C@H](O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450795265	GD	On-Demand	Mild	HTR1D	16	45
C[C@H](O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450795265	GD	On-Demand	Mild	HTR1B	19	45
C[C@H](O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450795265	GD	On-Demand	Mild	GPR183	0	42
Cc1nc([C@@H]2CCCN2C(=O)c2cc3cccnc3s2)cs1	ZINC000450795268	EI	On-Demand	Anodyne	CPT1A	31	40
Cc1ccc(C2CCN(C(=O)Cc3cc4ccccc4s3)CC2)cn1	ZINC000450795271	FJ	On-Demand	Anodyne	CCR1	23	41
Cc1ccc(C2CCN(C(=O)Cc3cc4ccccc4s3)CC2)cn1	ZINC000450795271	FJ	On-Demand	Anodyne	ETHR	42	37
CCn1c(SC[C@H]2CCCC2(F)F)nc2ccsc2c1=O	ZINC000450795272	EI	On-Demand	Anodyne	PDE4B	15	50
CCn1c(SC[C@@H]2CCCC2(F)F)nc2ccsc2c1=O	ZINC000450795273	EI	On-Demand	Anodyne	PDE4B	15	50
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](C)O	ZINC000450795278	EC	On-Demand	Anodyne	TGM2	24	40
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](C)O	ZINC000450795278	EC	On-Demand	Anodyne	GCK	42	31
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](C)O	ZINC000450795278	EC	On-Demand	Anodyne	GCKR	40	35
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](C)O	ZINC000450795279	EC	On-Demand	Anodyne	TGM2	24	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](C)O	ZINC000450795279	EC	On-Demand	Anodyne	GCK	42	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](C)O	ZINC000450795279	EC	On-Demand	Anodyne	GCKR	40	35
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H](C)O	ZINC000450795280	EC	On-Demand	Anodyne	TGM2	24	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H](C)O	ZINC000450795280	EC	On-Demand	Anodyne	GCK	42	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H](C)O	ZINC000450795280	EC	On-Demand	Anodyne	GCKR	40	35
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H](C)O	ZINC000450795281	EC	On-Demand	Anodyne	TGM2	24	40
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H](C)O	ZINC000450795281	EC	On-Demand	Anodyne	GCK	42	31
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@@H](C)O	ZINC000450795281	EC	On-Demand	Anodyne	GCKR	40	35
CCn1c(S[C@H](C)c2csnn2)nc2ccsc2c1=O	ZINC000450795289	DG	On-Demand	Anodyne	PDE7A	17	50
CCn1c(S[C@@H](C)c2csnn2)nc2ccsc2c1=O	ZINC000450795290	DG	On-Demand	Anodyne	PDE7A	17	50
CSc1c(F)cc(NC(=O)CCCC(=O)C2CC2)cc1F	ZINC000450795301	DH	On-Demand	Anodyne	HDAC3	16	40
Cc1ccc2oc(N3C[C@@H](C4CC4)[C@@H]3C3CC3)nc2c1	ZINC000450795307	CH	On-Demand	Anodyne	HTR3A	16	57
Cc1ccc2oc(N3C[C@H](C4CC4)[C@@H]3C3CC3)nc2c1	ZINC000450795308	CH	On-Demand	Anodyne	HTR3A	16	57
Cc1ccc2oc(N3C[C@H](C4CC4)[C@H]3C3CC3)nc2c1	ZINC000450795309	CH	On-Demand	Anodyne	HTR3A	16	57
Cc1ccc2oc(N3C[C@@H](C4CC4)[C@H]3C3CC3)nc2c1	ZINC000450795310	CH	On-Demand	Anodyne	HTR3A	16	57
Cc1cccc(Cl)c1C(=O)Nc1cc(C)n([C@H](C)C2CC2)n1	ZINC000450795326	DH	On-Demand	Anodyne	JAK1	16	41
Cc1cccc(Cl)c1C(=O)Nc1cc(C)n([C@H](C)C2CC2)n1	ZINC000450795326	DH	On-Demand	Anodyne	TYK2	67	41
Cc1cccc(Cl)c1C(=O)Nc1cc(C)n([C@@H](C)C2CC2)n1	ZINC000450795327	DH	On-Demand	Anodyne	JAK1	16	41
Cc1cccc(Cl)c1C(=O)Nc1cc(C)n([C@@H](C)C2CC2)n1	ZINC000450795327	DH	On-Demand	Anodyne	TYK2	67	41
C[C@H]1CN(c2nc(-c3cccc(Cl)c3)no2)C[C@@H](C)N1CCO	ZINC000450795348	EE	On-Demand	Anodyne	GRM5	27	46
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC[C@@H]1O	ZINC000450795380	CF	On-Demand	Anodyne	SLC6A1	23	41
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC[C@@H]1O	ZINC000450795380	CF	On-Demand	Anodyne	ERBB2	0	42
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC[C@@H]1O	ZINC000450795380	CF	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC[C@H]1O	ZINC000450795382	CF	On-Demand	Anodyne	SLC6A1	23	41
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC[C@H]1O	ZINC000450795382	CF	On-Demand	Anodyne	ERBB2	0	42
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC[C@H]1O	ZINC000450795382	CF	On-Demand	Anodyne	VACHT_TETCF	0	41
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CCO[C@@H](c2ccncc2)C1	ZINC000450795383	GH	On-Demand	Bother	CACNA1D	47	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CCO[C@@H](c2ccncc2)C1	ZINC000450795383	GH	On-Demand	Bother	SLC27A4	43	33
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC[C@@H]1O	ZINC000450795384	CF	On-Demand	Anodyne	SLC6A1	23	41
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC[C@@H]1O	ZINC000450795384	CF	On-Demand	Anodyne	ERBB2	0	42
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC[C@@H]1O	ZINC000450795384	CF	On-Demand	Anodyne	VACHT_TETCF	0	41
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CCO[C@H](c2ccncc2)C1	ZINC000450795385	GH	On-Demand	Bother	CACNA1D	47	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CCO[C@H](c2ccncc2)C1	ZINC000450795385	GH	On-Demand	Bother	SLC27A4	43	33
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC[C@H]1O	ZINC000450795386	CF	On-Demand	Anodyne	SLC6A1	23	41
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC[C@H]1O	ZINC000450795386	CF	On-Demand	Anodyne	ERBB2	0	42
C[C@@H]1CN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC[C@H]1O	ZINC000450795386	CF	On-Demand	Anodyne	VACHT_TETCF	0	41
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CCO[C@H](c2ccncc2)C1	ZINC000450795387	GH	On-Demand	Bother	CACNA1D	47	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CCO[C@H](c2ccncc2)C1	ZINC000450795387	GH	On-Demand	Bother	SLC27A4	43	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CCO[C@@H](c2ccncc2)C1	ZINC000450795389	GH	On-Demand	Bother	CACNA1D	47	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CCO[C@@H](c2ccncc2)C1	ZINC000450795389	GH	On-Demand	Bother	SLC27A4	43	33
CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1O	ZINC000450795425	EE	On-Demand	Bother	CACNA1C	44	36
CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1O	ZINC000450795425	EE	On-Demand	Bother	CACNA1D	73	34
CC1(CO)CN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450795447	CD	On-Demand	Anodyne	SORD	63	37
COc1cc(OC)c2ncnc(N3C[C@H](C)N(CCO)[C@H](C)C3)c2c1	ZINC000450795453	ED	On-Demand	Anodyne	PDE3A	46	36
COc1cc(OC)c2ncnc(N3C[C@H](C)N(CCO)[C@H](C)C3)c2c1	ZINC000450795453	ED	On-Demand	Anodyne	PDE3B	67	36
C[C@@H]1CN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC[C@H]1O	ZINC000450795468	CD	On-Demand	Anodyne	L3MBTL3	40	33
C[C@@H]1CN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC[C@@H]1O	ZINC000450795469	CD	On-Demand	Anodyne	L3MBTL3	40	33
C[C@H]1CN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC[C@H]1O	ZINC000450795470	CD	On-Demand	Anodyne	L3MBTL3	40	33
C[C@H]1CN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC[C@@H]1O	ZINC000450795471	CD	On-Demand	Anodyne	L3MBTL3	40	33
CC[S@@](=O)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450795475	DD	On-Demand	Anodyne	NPFFR2	39	42
CC[S@@](=O)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450795475	DD	On-Demand	Anodyne	NPFFR1	61	42
CC[S@@](=O)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450795475	DD	On-Demand	Anodyne	SLC12A5	51	36
CC[S@](=O)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450795476	DD	On-Demand	Anodyne	NPFFR2	39	42
CC[S@](=O)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450795476	DD	On-Demand	Anodyne	NPFFR1	61	42
CC[S@](=O)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450795476	DD	On-Demand	Anodyne	SLC12A5	51	36
CC[S@@](=O)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450795477	DD	On-Demand	Anodyne	NPFFR2	39	42
CC[S@@](=O)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450795477	DD	On-Demand	Anodyne	NPFFR1	61	42
CC[S@@](=O)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450795477	DD	On-Demand	Anodyne	SLC12A5	51	36
CC[S@](=O)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450795478	DD	On-Demand	Anodyne	NPFFR2	39	42
CC[S@](=O)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450795478	DD	On-Demand	Anodyne	NPFFR1	61	42
CC[S@](=O)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450795478	DD	On-Demand	Anodyne	SLC12A5	51	36
COc1ccc(-c2nnc(N3C[C@H](C)N(CCO)[C@H](C)C3)c3ccccc23)cc1	ZINC000450795489	GG	On-Demand	Anodyne	SMO	53	52
C/C=C\COc1cccc(CC(=O)Nc2ccc3c(c2)CCN3C(=O)COC)c1	ZINC000450795576	GG	On-Demand	Anodyne	EIF2AK3	50	40
C/C=C/COc1cccc(CC(=O)Nc2ccc3c(c2)CCN3C(=O)COC)c1	ZINC000450795578	GG	On-Demand	Anodyne	EIF2AK3	50	40
CCN(CC)S(=O)(=O)c1ccc(NC(COC)COC)c([N+](=O)[O-])c1	ZINC000450795582	GD	On-Demand	Bother	BDKRB1	0	53
CCN(CC)S(=O)(=O)c1ccc(NC(COC)COC)c([N+](=O)[O-])c1	ZINC000450795582	GD	On-Demand	Bother	COLA	45	32
CCN(CC)S(=O)(=O)c1ccc(NC(COC)COC)c([N+](=O)[O-])c1	ZINC000450795582	GD	On-Demand	Bother	BCL2L1	67	32
CC(C)C1(C)CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450795591	CI	On-Demand	Anodyne	ACACA	52	39
CC(C)C1(C)CCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450795591	CI	On-Demand	Anodyne	ACACB	41	39
Cc1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)c2ccccc2n1	ZINC000450795594	CE	On-Demand	Anodyne	HTR1D	40	36
COCC(COC)Nc1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450795615	EH	On-Demand	Anodyne	ADRB3	24	47
CC[C@@H]1C[C@H]1C(=O)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000450795619	DE	On-Demand	Anodyne	NOS1	15	46
CC[C@@H]1C[C@H]1C(=O)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000450795619	DE	On-Demand	Anodyne	NAMPT	30	46
C=CC(C)(C)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000450795634	DE	On-Demand	Mild	EIF2AK3	56	36
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1c1nc(C(=O)NC2CC2)no1	ZINC000450795646	FE	On-Demand	Anodyne	CPT1A	49	41
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1c1nc(C(=O)NC2CC2)no1	ZINC000450795647	FE	On-Demand	Anodyne	CPT1A	49	41
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1c1nc(C(=O)NC2CC2)no1	ZINC000450795648	FE	On-Demand	Anodyne	CPT1A	49	41
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1c1nc(C(=O)NC2CC2)no1	ZINC000450795649	FE	On-Demand	Anodyne	CPT1A	49	41
COCC(COC)N=c1ccc(C(=O)Nc2ccccc2)n[nH]1	ZINC000450795654	DD	On-Demand	Anodyne	ATR	42	34
COCC(COC)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450795663	GG	On-Demand	Anodyne	NPBWR1	60	39
CCC[C@@H](O)CN1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450795665	CD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@H](O)CN1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450795670	CD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
COc1ccnc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450795681	CC	On-Demand	Anodyne	SORD	63	37
N#Cc1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)cc1C(F)(F)F	ZINC000450795694	EF	On-Demand	Mild	AR	50	40
c1ccc2nc(N3CCOCC3)c(NCCN3C[C@@H]4CC[C@H](C3)O4)nc2c1	ZINC000450795697	FD	On-Demand	Anodyne	PIK3CA	24	43
c1ccc2nc(N3CCOCC3)c(NCCN3C[C@@H]4CC[C@H](C3)O4)nc2c1	ZINC000450795697	FD	On-Demand	Anodyne	MTOR	21	43
c1ccc2nc(N3CCOCC3)c(NCCN3C[C@@H]4CC[C@H](C3)O4)nc2c1	ZINC000450795697	FD	On-Demand	Anodyne	TLR9	0	42
COCC(=O)N1CCc2cc(NC(=O)C(C)(C)OC(C)C)ccc21	ZINC000450795708	EE	On-Demand	Anodyne	EIF2AK3	56	36
COc1cc(Br)ccc1CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450795716	GH	On-Demand	Anodyne	CYSLTR1	52	33
COc1cc(Br)ccc1CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450795716	GH	On-Demand	Anodyne	PPARD	17	42
COc1cc(Br)ccc1CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450795716	GH	On-Demand	Anodyne	MT-ND1	17	41
COc1ccc(F)cc1CNC(=O)C1CC(C)(O)C1	ZINC000450795723	CD	On-Demand	Anodyne	GRIN2B	30	47
COc1ccc(F)cc1CNC(=O)C1CC(C)(O)C1	ZINC000450795723	CD	On-Demand	Anodyne	P2RX7	47	40
Cc1c(C(=O)NCc2ccc(Cl)cc2F)nn2c1OCCC2	ZINC000450795741	DF	On-Demand	Anodyne	CNR1	43	41
Cc1c(C(=O)NCc2ccc(Cl)cc2F)nn2c1OCCC2	ZINC000450795741	DF	On-Demand	Anodyne	CNR2	31	40
Cc1c(C(=O)NCc2ccc(Cl)cc2F)nn2c1OCCC2	ZINC000450795741	DF	On-Demand	Anodyne	P2RX7	58	37
C=CCN(C)C(=O)c1ccc(OC(CC)CC)cc1	ZINC000450795742	CH	On-Demand	Mild	LSS	52	42
CC(=O)c1ccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1	ZINC000450795743	GH	On-Demand	Anodyne	CDK1	19	40
CC(=O)c1ccc(CN(C)[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1	ZINC000450795743	GH	On-Demand	Anodyne	CDK4	0	40
CC(=O)c1ccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1	ZINC000450795744	GH	On-Demand	Anodyne	CDK1	19	40
CC(=O)c1ccc(CN(C)[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)cc1	ZINC000450795744	GH	On-Demand	Anodyne	CDK4	0	40
CCN1C[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1=O	ZINC000450795746	EE	On-Demand	Bother	MAOB	23	48
CCN1C[C@@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1=O	ZINC000450795747	EE	On-Demand	Bother	MAOB	23	48
C[C@H]1C(=O)N(C)CCN1CCN(C)Cc1ccccc1	ZINC000450795748	CD	On-Demand	Anodyne	SIGMAR1	21	47
C[C@@H]1C(=O)N(C)CCN1CCN(C)Cc1ccccc1	ZINC000450795751	CD	On-Demand	Anodyne	SIGMAR1	21	47
COc1cccc(OCCC(=O)N[C@H](C)C[C@H](C)O)c1	ZINC000450795777	CD	On-Demand	Anodyne	MTNR1A	47	45
COc1cccc(OCCC(=O)N[C@H](C)C[C@H](C)O)c1	ZINC000450795777	CD	On-Demand	Anodyne	MTNR1B	44	45
COc1cccc(OCCC(=O)N[C@@H](C)C[C@@H](C)O)c1	ZINC000450795778	CD	On-Demand	Anodyne	MTNR1A	47	45
COc1cccc(OCCC(=O)N[C@@H](C)C[C@@H](C)O)c1	ZINC000450795778	CD	On-Demand	Anodyne	MTNR1B	44	45
COc1cccc(OCCC(=O)N[C@@H](C)C[C@H](C)O)c1	ZINC000450795780	CD	On-Demand	Anodyne	MTNR1A	47	45
COc1cccc(OCCC(=O)N[C@@H](C)C[C@H](C)O)c1	ZINC000450795780	CD	On-Demand	Anodyne	MTNR1B	44	45
CC1(CO)CN(c2ncnc3ccc(I)cc23)C1	ZINC000450795781	FE	On-Demand	Anodyne	PDGFRB	28	40
COc1cccc(OCCC(=O)N[C@H](C)C[C@@H](C)O)c1	ZINC000450795782	CD	On-Demand	Anodyne	MTNR1A	47	45
COc1cccc(OCCC(=O)N[C@H](C)C[C@@H](C)O)c1	ZINC000450795782	CD	On-Demand	Anodyne	MTNR1B	44	45
C[C@@H](OCCc1ccccc1)C(=O)N(C)[C@@H]1CCCC[C@H]1O	ZINC000450795796	DE	On-Demand	Anodyne	AMY2	50	35
C[C@H](OCCc1ccccc1)C(=O)N(C)[C@@H]1CCCC[C@H]1O	ZINC000450795798	DE	On-Demand	Anodyne	AMY2	50	35
CNC(=O)c1ccc(N2C[C@@H]3CCN(C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450795803	DD	On-Demand	Bother	TAAR1	19	45
O=C([C@@H](O)C1CCC1)N1CCC(CCCn2ccnc2)CC1	ZINC000450795804	DE	On-Demand	Anodyne	TBXAS1	30	42
O=C([C@H](O)C1CCC1)N1CCC(CCCn2ccnc2)CC1	ZINC000450795805	DE	On-Demand	Anodyne	TBXAS1	30	42
CC[C@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)[C@@H](C)O	ZINC000450795806	GH	On-Demand	Anodyne	NPBWR1	44	38
CC[C@@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)[C@@H](C)O	ZINC000450795808	GH	On-Demand	Anodyne	NPBWR1	44	38
CC[C@@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)[C@H](C)O	ZINC000450795810	GH	On-Demand	Anodyne	NPBWR1	44	38
CC[C@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)[C@H](C)O	ZINC000450795812	GH	On-Demand	Anodyne	NPBWR1	44	38
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	HTR1A	38	59
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	DRD2	52	59
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	DRD1	36	56
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	DRD4	38	55
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	ADRA1D	22	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	HTR2A	38	56
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	HTR2C	25	55
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	ADRA1A	24	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	ADRA1B	17	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	DRD3	47	56
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	SLC6A3	15	45
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	ERG2	23	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	HTR7	41	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	SIGMAR1	21	55
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450795834	FE	On-Demand	Anodyne	CYP2J2	59	43
CCOc1ccc(-c2nnn(Cc3cccc(C)n3)n2)cc1	ZINC000450795850	CE	On-Demand	Anodyne	CACNA2D1	41	36
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H]1CCO	ZINC000450795882	CE	On-Demand	Anodyne	SLC18A2	97	44
CO[C@@H](Cc1ccccc1)CN1CCC[C@H]1CCO	ZINC000450795890	CE	On-Demand	Anodyne	SLC18A2	97	44
CO[C@H](Cc1ccccc1)CN1CCC[C@@H]1CCO	ZINC000450795893	CE	On-Demand	Anodyne	SLC18A2	97	44
CO[C@H](Cc1ccccc1)CN1CCC[C@H]1CCO	ZINC000450795899	CE	On-Demand	Anodyne	SLC18A2	97	44
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795917	CD	On-Demand	Anodyne	AKT2	42	40
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795917	CD	On-Demand	Anodyne	JAK3	24	41
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795917	CD	On-Demand	Anodyne	JAK1	68	38
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795917	CD	On-Demand	Anodyne	ROCK2	40	38
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795917	CD	On-Demand	Anodyne	AKT1	33	43
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795922	CD	On-Demand	Anodyne	AKT2	42	40
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795922	CD	On-Demand	Anodyne	JAK3	24	41
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795922	CD	On-Demand	Anodyne	JAK1	68	38
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795922	CD	On-Demand	Anodyne	ROCK2	40	38
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450795922	CD	On-Demand	Anodyne	AKT1	33	43
O=C(CC1(O)CCC1)NCc1ccc(Cl)cc1F	ZINC000450795935	CE	On-Demand	Anodyne	P2RX7	51	40
CN1CC[C@@H]2CN(c3ncnc4sc5c(c34)CCC5)C[C@@H]21	ZINC000450795940	DE	On-Demand	Anodyne	RBP4	18	43
CCCOc1ccc(C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)c(OC)c1	ZINC000450795943	GG	On-Demand	Anodyne	OXTR	23	41
CS(=O)(=O)C[C@@H]1CCCCN1c1nccc(OCc2ccccc2)n1	ZINC000450795952	FE	On-Demand	Anodyne	NOS2	17	41
CS(=O)(=O)C[C@H]1CCCCN1c1nccc(OCc2ccccc2)n1	ZINC000450795954	FE	On-Demand	Anodyne	NOS2	17	41
CC[C@@H](CO)N(Cc1ccccc1)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450795985	EF	On-Demand	Anodyne	TRPV1	0	46
CC[C@@H](CO)N(Cc1ccccc1)C(=O)Cc1ccc(O)c(OC)c1	ZINC000450795985	EF	On-Demand	Anodyne	NCE103	25	41
CC(C)C[C@@H]1C[C@H]1C(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450795996	DH	On-Demand	Anodyne	SLC6A1	0	41
C[C@H]1CN(c2cc(Br)ccn2)C[C@@H](C)N1CCO	ZINC000450796002	DD	On-Demand	Anodyne	SORD	51	37
CCOC[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450796006	CE	On-Demand	Anodyne	P2RY12	59	36
CCOC[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450796006	CE	On-Demand	Anodyne	CTSV	47	32
CCOC[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450796006	CE	On-Demand	Anodyne	AGER	0	42
C[C@H]1CN(c2ccnc(C3CC3)n2)C[C@@H](C)N1CCO	ZINC000450796008	CD	On-Demand	Anodyne	SORD	59	45
C[C@H]1CN(c2ccnc(N3CCOCC3)n2)C[C@@H](C)N1CCO	ZINC000450796026	DC	On-Demand	Anodyne	SORD	72	48
C[C@@]1(CNC(=O)CCCC(=O)C2CC2)CCCN1Cc1ccccc1	ZINC000450796036	EG	On-Demand	Anodyne	NPFFR1	52	38
C[C@]1(CNC(=O)CCCC(=O)C2CC2)CCCN1Cc1ccccc1	ZINC000450796037	EG	On-Demand	Anodyne	NPFFR1	52	38
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796057	EE	On-Demand	Anodyne	DRD4	19	40
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796057	EE	On-Demand	Anodyne	CHRM3	21	43
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796057	EE	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796057	EE	On-Demand	Anodyne	SSTR5	47	38
O=C(NC1CC1)[C@@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796057	EE	On-Demand	Anodyne	MCHR1	21	40
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796058	EE	On-Demand	Anodyne	DRD4	19	40
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796058	EE	On-Demand	Anodyne	CHRM3	21	43
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796058	EE	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796058	EE	On-Demand	Anodyne	SSTR5	47	38
O=C(NC1CC1)[C@H](O)C1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450796058	EE	On-Demand	Anodyne	MCHR1	21	40
CO[C@@H](COc1ccc(-c2noc(C)n2)cc1)Cc1ccccc1	ZINC000450796064	DH	On-Demand	Anodyne	PLA2G5	16	42
CO[C@H](COc1ccc(-c2noc(C)n2)cc1)Cc1ccccc1	ZINC000450796065	DH	On-Demand	Anodyne	PLA2G5	16	42
O=C(NC[C@H]1CCCCS1)c1ccc(N2CCC2)nc1	ZINC000450796068	CE	On-Demand	Anodyne	HPGDS	24	46
O=C(NC[C@@H]1CCCCS1)c1ccc(N2CCC2)nc1	ZINC000450796069	CE	On-Demand	Anodyne	HPGDS	24	46
CN1CCN(c2nc3ccccc3nc2NCCN2C[C@@H]3CC[C@H](C2)O3)CC1	ZINC000450796076	GD	On-Demand	Anodyne	HTR3A	30	46
CN1CCN(c2nc3ccccc3nc2NCCN2C[C@@H]3CC[C@H](C2)O3)CC1	ZINC000450796076	GD	On-Demand	Anodyne	HRH4	42	46
CN1CCN(c2nc3ccccc3nc2NCCN2C[C@@H]3CC[C@H](C2)O3)CC1	ZINC000450796076	GD	On-Demand	Anodyne	TLR9	0	45
C[C@H]1CN(c2nc3ccccc3o2)C[C@@H](C)N1CCO	ZINC000450796077	CD	On-Demand	Anodyne	SORD	22	41
COCC(COC)Nc1cc(NCC2CC2)ncn1	ZINC000450796087	CD	On-Demand	Anodyne	GPR39	0	46
O=C(NC1CC1)c1noc([C@@H]2CCCN2Cc2ccccc2OC2CC2)n1	ZINC000450796092	FF	On-Demand	Anodyne	COLA	34	40
O=C(NC1CC1)c1noc([C@H]2CCCN2Cc2ccccc2OC2CC2)n1	ZINC000450796093	FF	On-Demand	Anodyne	COLA	34	40
COCC(COC)Nc1cnn(Cc2ccccc2)c(=O)c1	ZINC000450796105	DD	On-Demand	Anodyne	NPBWR1	44	42
CC(C)C1(C)CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450796108	EH	On-Demand	Bother	CACNA1C	52	34
CC(C)C1(C)CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450796108	EH	On-Demand	Bother	CACNA1D	80	34
CC(C)C1(C)CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450796108	EH	On-Demand	Bother	MGLL	0	42
COCC(COC)N=c1c(C)c(C)[nH]c2ccccc12	ZINC000450796117	CE	On-Demand	Anodyne	VDR	41	32
COCC(=O)N1CCc2cc(NC(=O)c3cccc4c3O[C@H](C)C4)ccc21	ZINC000450796118	FF	On-Demand	Anodyne	AVPR2	62	35
COCC(=O)N1CCc2cc(NC(=O)c3cccc4c3O[C@H](C)C4)ccc21	ZINC000450796118	FF	On-Demand	Anodyne	MTTP	67	34
COCC(=O)N1CCc2cc(NC(=O)c3cccc4c3O[C@H](C)C4)ccc21	ZINC000450796118	FF	On-Demand	Anodyne	NAMPT	30	41
COCC(=O)N1CCc2cc(NC(=O)c3cccc4c3O[C@@H](C)C4)ccc21	ZINC000450796119	FF	On-Demand	Anodyne	AVPR2	62	35
COCC(=O)N1CCc2cc(NC(=O)c3cccc4c3O[C@@H](C)C4)ccc21	ZINC000450796119	FF	On-Demand	Anodyne	MTTP	67	34
COCC(=O)N1CCc2cc(NC(=O)c3cccc4c3O[C@@H](C)C4)ccc21	ZINC000450796119	FF	On-Demand	Anodyne	NAMPT	30	41
O=C(NC1CC1)c1noc([C@@H]2CCCN2CCc2c(Cl)cccc2Cl)n1	ZINC000450796121	GH	On-Demand	Anodyne	COLA	43	40
O=C(NC1CC1)c1noc([C@@H]2CCCN2CCc2c(Cl)cccc2Cl)n1	ZINC000450796121	GH	On-Demand	Anodyne	CPT1A	42	40
O=C(NC1CC1)c1noc([C@H]2CCCN2CCc2c(Cl)cccc2Cl)n1	ZINC000450796122	GH	On-Demand	Anodyne	COLA	43	40
O=C(NC1CC1)c1noc([C@H]2CCCN2CCc2c(Cl)cccc2Cl)n1	ZINC000450796122	GH	On-Demand	Anodyne	CPT1A	42	40
COCC(COC)Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450796141	EE	On-Demand	Anodyne	ROS1	45	41
Cc1ccnc(-c2noc(CN3CCC[C@H]3c3nc(C(=O)NC4CC4)no3)n2)c1	ZINC000450796146	GE	On-Demand	Anodyne	COLA	40	45
Cc1ccnc(-c2noc(CN3CCC[C@H]3c3nc(C(=O)NC4CC4)no3)n2)c1	ZINC000450796146	GE	On-Demand	Anodyne	CPT1A	39	45
Cc1ccnc(-c2noc(CN3CCC[C@@H]3c3nc(C(=O)NC4CC4)no3)n2)c1	ZINC000450796147	GE	On-Demand	Anodyne	COLA	40	45
Cc1ccnc(-c2noc(CN3CCC[C@@H]3c3nc(C(=O)NC4CC4)no3)n2)c1	ZINC000450796147	GE	On-Demand	Anodyne	CPT1A	39	45
O=S(=O)(NCC1CC1)c1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)nc1	ZINC000450796151	FC	On-Demand	Anodyne	NPY1R	42	35
O=S(=O)(NCC1CC1)c1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)nc1	ZINC000450796151	FC	On-Demand	Anodyne	NPY2R	63	35
CCOC(=O)c1c(C)c2ccccc2[nH]c1=N[C@H]1CCO[C@@H](c2cccnc2)C1	ZINC000450796179	GH	On-Demand	Anodyne	PTAFR	24	41
CCOC(=O)c1c(C)c2ccccc2[nH]c1=N[C@H]1CCO[C@H](c2cccnc2)C1	ZINC000450796181	GH	On-Demand	Anodyne	PTAFR	24	41
COCCNC(=O)c1ccc(NCCN2C[C@@H]3CC[C@H](C2)O3)nc1	ZINC000450796182	EC	On-Demand	Anodyne	IKBKB	15	41
CCOC(=O)c1c(C)c2ccccc2[nH]c1=N[C@@H]1CCO[C@H](c2cccnc2)C1	ZINC000450796183	GH	On-Demand	Anodyne	PTAFR	24	41
CCOC(=O)c1c(C)c2ccccc2[nH]c1=N[C@@H]1CCO[C@@H](c2cccnc2)C1	ZINC000450796184	GH	On-Demand	Anodyne	PTAFR	24	41
C/C=C\COc1cccc(CC(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c1	ZINC000450796189	GF	On-Demand	Anodyne	CA5B	29	40
C/C=C\COc1cccc(CC(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c1	ZINC000450796189	GF	On-Demand	Anodyne	CA5A	33	40
C/C=C\COc1cccc(CC(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c1	ZINC000450796189	GF	On-Demand	Anodyne	E1	0	42
C/C=C\COc1cccc(CC(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c1	ZINC000450796189	GF	On-Demand	Anodyne	RORC	49	39
CCOc1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1Br	ZINC000450796191	FH	On-Demand	Anodyne	KCNK3	38	42
CCOc1ccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)cc1Br	ZINC000450796191	FH	On-Demand	Anodyne	KCNK9	38	42
C[C@H]1[C@H](NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)CCCN1C	ZINC000450796204	ED	On-Demand	Anodyne	CHRNA2	44	45
C[C@H]1[C@@H](NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)CCCN1C	ZINC000450796205	ED	On-Demand	Anodyne	CHRNA2	44	45
C[C@@H]1[C@@H](NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)CCCN1C	ZINC000450796206	ED	On-Demand	Anodyne	CHRNA2	44	45
Cc1cnc(CCCC(=O)NCc2ccc(-c3ccccc3)c(C)c2)o1	ZINC000450796229	EJ	On-Demand	Anodyne	FAAH	48	35
Cc1cnc(CCCC(=O)NCc2ccc(-c3ccccc3)c(C)c2)o1	ZINC000450796229	EJ	On-Demand	Anodyne	SUCNR1	49	41
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C)C(=O)[C@@H]1C	ZINC000450796230	CC	On-Demand	Anodyne	ACE	44	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C)C(=O)[C@@H]1C	ZINC000450796231	CC	On-Demand	Anodyne	ACE	44	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(C)C(=O)[C@H]1C	ZINC000450796232	CC	On-Demand	Anodyne	ACE	44	41
CO[C@H](Cc1ccccc1)C(=O)N1CCN(C)C(=O)[C@H]1C	ZINC000450796233	CC	On-Demand	Anodyne	ACE	44	41
CC(C)O[C@@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450796244	GI	On-Demand	Anodyne	MMP13	17	42
CC(C)O[C@@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450796244	GI	On-Demand	Anodyne	MMP2	18	41
CC(C)O[C@@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450796244	GI	On-Demand	Anodyne	MMP14	17	41
CC(C)O[C@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450796245	GI	On-Demand	Anodyne	MMP13	17	42
CC(C)O[C@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450796245	GI	On-Demand	Anodyne	MMP2	18	41
CC(C)O[C@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450796245	GI	On-Demand	Anodyne	MMP14	17	41
Cc1cc(N2CC(C)(CO)C2)nc(-c2cccnc2)n1	ZINC000450796247	CD	On-Demand	Anodyne	ROS1	52	39
C[C@H](O)CN1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450796289	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
CC[C@H](Nc1ccc(S(N)(=O)=O)cn1)[C@@H](C)O	ZINC000450796375	CC	On-Demand	Anodyne	CA7	37	42
CC[C@H](Nc1ccc(S(N)(=O)=O)cn1)[C@H](C)O	ZINC000450796379	CC	On-Demand	Anodyne	CA7	37	42
CC[C@@H](Nc1ccc(S(N)(=O)=O)cn1)[C@H](C)O	ZINC000450796381	CC	On-Demand	Anodyne	CA7	37	42
CC[C@@H](Nc1ccc(S(N)(=O)=O)cn1)[C@@H](C)O	ZINC000450796382	CC	On-Demand	Anodyne	CA7	37	42
CCOC(=O)c1cc(C(=O)Nc2cccnc2NC(C)=O)[nH]c1C	ZINC000450796420	EE	On-Demand	Anodyne	G2YM83_BOTF4	43	31
Cc1cc(C)c(C(=O)N[C@@H]2CCn3ccnc3C2)cc1Br	ZINC000450796422	EG	On-Demand	Anodyne	MAPK13	40	32
Cc1cc(C)c(C(=O)N[C@H]2CCn3ccnc3C2)cc1Br	ZINC000450796428	EG	On-Demand	Anodyne	MAPK13	40	32
CC(C)(C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1)C1CCC1	ZINC000450796433	DE	On-Demand	Anodyne	F2R	19	40
CC(C)(C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1)C1CCC1	ZINC000450796435	DE	On-Demand	Anodyne	F2R	19	40
O=C(N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450796444	FG	On-Demand	Anodyne	EPHX2	38	43
CCn1c(S[C@@H]2C[C@H](C)CCC2=O)nc2ccsc2c1=O	ZINC000450796446	DG	On-Demand	Anodyne	PDE7A	18	48
CCn1c(S[C@H]2C[C@@H](C)CCC2=O)nc2ccsc2c1=O	ZINC000450796447	DG	On-Demand	Anodyne	PDE7A	18	48
O=C(N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450796448	FG	On-Demand	Anodyne	EPHX2	38	43
CCn1c(S[C@@H]2C[C@@H](C)CCC2=O)nc2ccsc2c1=O	ZINC000450796450	DG	On-Demand	Anodyne	PDE7A	18	48
CCn1c(S[C@H]2C[C@H](C)CCC2=O)nc2ccsc2c1=O	ZINC000450796452	DG	On-Demand	Anodyne	PDE7A	18	48
O=C(N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450796456	FG	On-Demand	Anodyne	EPHX2	38	43
O=C(N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450796463	FG	On-Demand	Anodyne	EPHX2	38	43
COc1cccc(OCCC(=O)NC[C@@H]2CCCCS2)c1	ZINC000450796467	DF	On-Demand	Anodyne	MTR1B_CHICK	0	42
COc1cccc(OCCC(=O)NC[C@@H]2CCCCS2)c1	ZINC000450796467	DF	On-Demand	Anodyne	MTNR1A	43	46
COc1cccc(OCCC(=O)NC[C@@H]2CCCCS2)c1	ZINC000450796467	DF	On-Demand	Anodyne	MTNR1B	42	37
COc1cccc(OCCC(=O)NC[C@H]2CCCCS2)c1	ZINC000450796469	DF	On-Demand	Anodyne	MTR1B_CHICK	0	42
COc1cccc(OCCC(=O)NC[C@H]2CCCCS2)c1	ZINC000450796469	DF	On-Demand	Anodyne	MTNR1A	43	46
COc1cccc(OCCC(=O)NC[C@H]2CCCCS2)c1	ZINC000450796469	DF	On-Demand	Anodyne	MTNR1B	42	37
CCOC[C@H](C)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450796472	CE	On-Demand	Anodyne	SDH1	0	43
C/C=C\COc1cccc(CC(=O)N[C@@H](C)COCC)c1	ZINC000450796474	CF	On-Demand	Anodyne	PDS	68	33
C/C=C/COc1cccc(CC(=O)N[C@@H](C)COCC)c1	ZINC000450796476	CF	On-Demand	Anodyne	PDS	68	33
CCN1C[C@@H](Nc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450796510	FC	On-Demand	Bother	BCL2L1	48	33
CCN1C[C@H](Nc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1=O	ZINC000450796513	FC	On-Demand	Bother	BCL2L1	48	33
COC[C@]1(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)CCOC1	ZINC000450796522	FD	On-Demand	Anodyne	EPHX2	26	54
COC[C@@]1(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)CCOC1	ZINC000450796523	FD	On-Demand	Anodyne	EPHX2	26	54
CN1CC[C@@H]2CN(c3ncnc4scc(-c5ccccc5)c34)C[C@@H]21	ZINC000450796525	EG	On-Demand	Anodyne	ADRB3	0	51
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCN(c2ccccc2)C1	ZINC000450796530	EH	On-Demand	Anodyne	F2	19	41
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCN(c2ccccc2)C1	ZINC000450796530	EH	On-Demand	Anodyne	MC4R	23	41
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCN(c2ccccc2)C1	ZINC000450796530	EH	On-Demand	Anodyne	P2RX7	94	48
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCN(c2ccccc2)C1	ZINC000450796530	EH	On-Demand	Anodyne	MAPK1	20	40
O=C(NCc1ccc(Cl)cc1F)[C@H]1CCN(c2ccccc2)C1	ZINC000450796530	EH	On-Demand	Anodyne	EPHX2	34	56
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCN(c2ccccc2)C1	ZINC000450796537	EH	On-Demand	Anodyne	F2	19	41
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCN(c2ccccc2)C1	ZINC000450796537	EH	On-Demand	Anodyne	MC4R	23	41
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCN(c2ccccc2)C1	ZINC000450796537	EH	On-Demand	Anodyne	P2RX7	94	48
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCN(c2ccccc2)C1	ZINC000450796537	EH	On-Demand	Anodyne	MAPK1	20	40
O=C(NCc1ccc(Cl)cc1F)[C@@H]1CCN(c2ccccc2)C1	ZINC000450796537	EH	On-Demand	Anodyne	EPHX2	34	56
CC[C@H](CC(F)(F)F)C(=O)Nc1cccnc1NC(C)=O	ZINC000450796538	DF	On-Demand	Anodyne	BDKRB1	0	40
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccnc1NC(C)=O	ZINC000450796539	DF	On-Demand	Anodyne	BDKRB1	0	40
CC(=O)N[C@H](C(=O)NC[C@]1(C)CCCN1Cc1ccccc1)C(C)(C)C	ZINC000450796551	FF	On-Demand	Anodyne	GAG-PRO	53	35
CC(=O)N[C@H](C(=O)NC[C@]1(C)CCCN1Cc1ccccc1)C(C)(C)C	ZINC000450796551	FF	On-Demand	Anodyne	Q82323_9DELA	65	30
CC(=O)N[C@H](C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1)C(C)(C)C	ZINC000450796552	FF	On-Demand	Anodyne	GAG-PRO	53	35
CC(=O)N[C@H](C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1)C(C)(C)C	ZINC000450796552	FF	On-Demand	Anodyne	Q82323_9DELA	65	30
CCOC[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450796553	FG	On-Demand	Anodyne	ANPEP	17	46
CCOC[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450796553	FG	On-Demand	Anodyne	PIN1	21	42
CCOC[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450796553	FG	On-Demand	Anodyne	PDS	43	40
CCOC[C@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450796556	CD	On-Demand	Anodyne	MMP13	17	43
CC(C)(C)C(=O)CCCC(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450796569	FE	On-Demand	Anodyne	F2R	23	44
CC(C)(C)C(=O)CCCC(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450796570	FE	On-Demand	Anodyne	F2R	23	44
C[C@]1(CNC(=O)CC2CC(F)(F)C2)CCCN1Cc1ccccc1	ZINC000450796574	EH	On-Demand	Anodyne	NPFFR1	50	39
C[C@@]1(CNC(=O)CC2CC(F)(F)C2)CCCN1Cc1ccccc1	ZINC000450796575	EH	On-Demand	Anodyne	NPFFR1	50	39
C[C@H]1CN(c2ccnc(-c3ccccc3)n2)C[C@@H](C)N1CCO	ZINC000450796576	DE	On-Demand	Anodyne	SORD	66	44
CN(C)S(=O)(=O)c1ccc(N[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450796580	FD	On-Demand	Bother	BCL2L1	71	34
CN(C)S(=O)(=O)c1ccc(N[C@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450796580	FD	On-Demand	Bother	BCL2	46	34
CN(C)S(=O)(=O)c1ccc(N[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450796581	FD	On-Demand	Bother	BCL2L1	71	34
CN(C)S(=O)(=O)c1ccc(N[C@@H]2CC23CCOCC3)c([N+](=O)[O-])c1	ZINC000450796581	FD	On-Demand	Bother	BCL2	46	34
O=C(NCC(F)(F)F)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450796617	GF	On-Demand	Anodyne	SLC6A1	44	32
O=C(NCC(F)(F)F)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450796617	GF	On-Demand	Anodyne	SIGMAR1	33	45
O=C(NCC(F)(F)F)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450796617	GF	On-Demand	Anodyne	CACNA1G	44	49
O=C(NCC(F)(F)F)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450796618	GF	On-Demand	Anodyne	SLC6A1	44	32
O=C(NCC(F)(F)F)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450796618	GF	On-Demand	Anodyne	SIGMAR1	33	45
O=C(NCC(F)(F)F)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450796618	GF	On-Demand	Anodyne	CACNA1G	44	49
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CCO)cc1	ZINC000450796628	CD	On-Demand	Anodyne	HRH3	0	50
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CCO)cc1	ZINC000450796628	CD	On-Demand	Anodyne	SPHK1	15	47
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2CCO)cc1	ZINC000450796628	CD	On-Demand	Anodyne	CASP7	46	34
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CCO)cc1	ZINC000450796629	CD	On-Demand	Anodyne	HRH3	0	50
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CCO)cc1	ZINC000450796629	CD	On-Demand	Anodyne	SPHK1	15	47
CCS(=O)(=O)c1ccc(CN2CCC[C@@H]2CCO)cc1	ZINC000450796629	CD	On-Demand	Anodyne	CASP7	46	34
O=C(CCCC(=O)C1CC1)NCc1ccc(Cl)cc1F	ZINC000450796630	CG	On-Demand	Anodyne	P2RX7	41	38
CN1CC[C@@H]2CN(c3ncc(C(=O)N4CCCCC4)cc3Cl)C[C@@H]21	ZINC000450796632	EF	On-Demand	Anodyne	CXCR3	34	40
CN1CC[C@@H]2CN(c3ncc(C(=O)N4CCCCC4)cc3Cl)C[C@@H]21	ZINC000450796632	EF	On-Demand	Anodyne	L3MBTL3	59	34
COc1ccc(CNC(=O)CCN2CCN(CC(C)C)C(=O)C2)c(OC)c1	ZINC000450796634	GD	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CCN(CC(C)C)C(=O)C2)c(OC)c1	ZINC000450796634	GD	On-Demand	Anodyne	MTNR1A	47	38
CCSc1cccnc1C(=O)NCc1cc(F)ccc1OC	ZINC000450796642	DG	On-Demand	Anodyne	GRIN2B	22	41
CCSc1cccnc1C(=O)NCc1cc(F)ccc1OC	ZINC000450796642	DG	On-Demand	Anodyne	P2RX7	33	40
CCSc1cccnc1C(=O)NCc1cc(F)ccc1OC	ZINC000450796642	DG	On-Demand	Anodyne	PPARD	25	43
O=C(Nc1ncc(C2CCCCC2)s1)c1c[nH]c2nccc-2c1	ZINC000450796643	EI	On-Demand	Anodyne	CDK5	57	47
COc1cccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)cc(C)nc12	ZINC000450796649	EF	On-Demand	Anodyne	CARM1	51	39
CC1(C)[C@@H](NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C[C@H]1O	ZINC000450796654	FD	On-Demand	Mild	AR	23	43
CC1(C)[C@H](O)C[C@H]1NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450796655	FD	On-Demand	Mild	AR	23	43
CC1(C)[C@H](O)C[C@H]1NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450796656	FD	On-Demand	Mild	AR	23	43
CC1(C)[C@@H](NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C[C@H]1O	ZINC000450796657	FD	On-Demand	Mild	AR	23	43
c1ccc(-c2csc(NCCN3C[C@@H]4CC[C@H](C3)O4)n2)cc1	ZINC000450796668	DF	On-Demand	Anodyne	MAOA	17	43
c1ccc(-c2csc(NCCN3C[C@@H]4CC[C@H](C3)O4)n2)cc1	ZINC000450796668	DF	On-Demand	Anodyne	MAOB	28	44
c1ccc(-c2csc(NCCN3C[C@@H]4CC[C@H](C3)O4)n2)cc1	ZINC000450796668	DF	On-Demand	Anodyne	SPHK2	43	31
c1ccc(-c2csc(NCCN3C[C@@H]4CC[C@H](C3)O4)n2)cc1	ZINC000450796668	DF	On-Demand	Anodyne	NPY5R	21	43
COc1cccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)c(C)cnc12	ZINC000450796670	EF	On-Demand	Anodyne	ADRA1B	42	35
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450796677	FE	On-Demand	Anodyne	CA7	16	49
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450796677	FE	On-Demand	Anodyne	CA14	15	53
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450796678	FE	On-Demand	Anodyne	CA7	16	49
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450796678	FE	On-Demand	Anodyne	CA14	15	53
COc1cc(CN2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)ccc1Cl	ZINC000450796679	GF	On-Demand	Anodyne	DRD2	46	37
COc1cc(CN2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)ccc1Cl	ZINC000450796679	GF	On-Demand	Anodyne	SSTR5	63	45
COc1cc(CN2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)ccc1Cl	ZINC000450796679	GF	On-Demand	Anodyne	PDK1	52	40
COc1cc(CN2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)ccc1Cl	ZINC000450796679	GF	On-Demand	Anodyne	MCHR1	21	44
COc1cc(CN2CCC[C@@H]2c2nc(C(=O)NC3CC3)no2)ccc1Cl	ZINC000450796680	GF	On-Demand	Anodyne	DRD2	46	37
COc1cc(CN2CCC[C@@H]2c2nc(C(=O)NC3CC3)no2)ccc1Cl	ZINC000450796680	GF	On-Demand	Anodyne	SSTR5	63	45
COc1cc(CN2CCC[C@@H]2c2nc(C(=O)NC3CC3)no2)ccc1Cl	ZINC000450796680	GF	On-Demand	Anodyne	PDK1	52	40
COc1cc(CN2CCC[C@@H]2c2nc(C(=O)NC3CC3)no2)ccc1Cl	ZINC000450796680	GF	On-Demand	Anodyne	MCHR1	21	44
CO[C@H]1COCC[C@@H]1CC(=O)N1CCC(C)(C(C)C)CC1	ZINC000450796705	CF	On-Demand	Anodyne	CCR2	29	40
CO[C@H]1COCC[C@H]1CC(=O)N1CCC(C)(C(C)C)CC1	ZINC000450796706	CF	On-Demand	Anodyne	CCR2	29	40
CO[C@@H]1COCC[C@@H]1CC(=O)N1CCC(C)(C(C)C)CC1	ZINC000450796707	CF	On-Demand	Anodyne	CCR2	29	40
CO[C@@H]1COCC[C@H]1CC(=O)N1CCC(C)(C(C)C)CC1	ZINC000450796708	CF	On-Demand	Anodyne	CCR2	29	40
CN(CC1=CCCCC1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450796709	CH	On-Demand	Anodyne	CHRNA2	40	41
CN(CC1=CCCCC1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450796709	CH	On-Demand	Anodyne	CRTY	0	41
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450796715	ED	On-Demand	Anodyne	CA2	51	39
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450796715	ED	On-Demand	Anodyne	CA1	42	38
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450796715	ED	On-Demand	Anodyne	CA4	42	37
COc1cccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc12	ZINC000450796717	DF	On-Demand	Anodyne	ADRA1D	45	35
COc1cccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc12	ZINC000450796717	DF	On-Demand	Anodyne	ADRA1B	51	36
COc1cccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc12	ZINC000450796717	DF	On-Demand	Anodyne	HNMT	44	41
C[C@H]1CN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H](C)N1CCO	ZINC000450796719	FG	On-Demand	Anodyne	ADRB2	19	49
C[C@H]1CN(c2ncnc3scc(-c4ccccc4)c23)C[C@@H](C)N1CCO	ZINC000450796719	FG	On-Demand	Anodyne	ADRB3	34	53
COc1cc2nc(CN3CCOCC3)n(CC[C@@H](C)O)c(=O)c2cc1OC	ZINC000450796721	GD	On-Demand	Anodyne	EHMT2	40	37
COc1cc2nc(CN3CCOCC3)n(CC[C@H](C)O)c(=O)c2cc1OC	ZINC000450796722	GD	On-Demand	Anodyne	EHMT2	40	37
O=C(N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450796732	FH	On-Demand	Anodyne	HPGDS	31	45
O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(N2CCC2)nc1	ZINC000450796733	FH	On-Demand	Anodyne	HPGDS	31	45
COc1cc(CC(=O)N(C)CC2(O)CCCCCC2)ccc1Cl	ZINC000450796755	EG	On-Demand	Anodyne	OPRK1	22	47
O=C(NC1CC1)c1noc([C@@H]2CCCN2CC/C=C\c2ccccc2)n1	ZINC000450796791	FG	On-Demand	Anodyne	COLA	56	42
O=C(NC1CC1)c1noc([C@@H]2CCCN2CC/C=C\c2ccccc2)n1	ZINC000450796791	FG	On-Demand	Anodyne	CPT1A	49	42
O=C(NC1CC1)c1noc([C@H]2CCCN2CC/C=C\c2ccccc2)n1	ZINC000450796793	FG	On-Demand	Anodyne	COLA	56	42
O=C(NC1CC1)c1noc([C@H]2CCCN2CC/C=C\c2ccccc2)n1	ZINC000450796793	FG	On-Demand	Anodyne	CPT1A	49	42
O=C(NC1CC1)c1noc([C@H]2CCCN2CC/C=C/c2ccccc2)n1	ZINC000450796796	FG	On-Demand	Anodyne	COLA	56	42
O=C(NC1CC1)c1noc([C@H]2CCCN2CC/C=C/c2ccccc2)n1	ZINC000450796796	FG	On-Demand	Anodyne	CPT1A	49	42
CO[C@H](Cc1ccccc1)C(=O)N1CCN(CC(C)C)C(=O)[C@@H]1C	ZINC000450796800	ED	On-Demand	Anodyne	BRCA1	44	31
CO[C@H](Cc1ccccc1)C(=O)N1CCN(CC(C)C)C(=O)[C@H]1C	ZINC000450796801	ED	On-Demand	Anodyne	BRCA1	44	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(CC(C)C)C(=O)[C@@H]1C	ZINC000450796802	ED	On-Demand	Anodyne	BRCA1	44	31
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(CC(C)C)C(=O)[C@H]1C	ZINC000450796803	ED	On-Demand	Anodyne	BRCA1	44	31
Cc1nc(-c2cccnc2)nc(N2CC(C)(CO)C2)c1C	ZINC000450796817	CD	On-Demand	Anodyne	ROS1	46	32
COc1cc2nc(N3CC(C)(CO)C3)nc(N)c2cc1OC	ZINC000450796822	DC	On-Demand	Anodyne	ADRA1D	17	48
COc1cc2nc(N3CC(C)(CO)C3)nc(N)c2cc1OC	ZINC000450796822	DC	On-Demand	Anodyne	ADRA1B	48	52
COc1cc2nc(N3CC(C)(CO)C3)nc(N)c2cc1OC	ZINC000450796822	DC	On-Demand	Anodyne	CCR4	40	37
COc1cc2nc(N3CC(C)(CO)C3)nc(N)c2cc1OC	ZINC000450796822	DC	On-Demand	Anodyne	PDPK1	41	37
COc1cc2nc(N3CC(C)(CO)C3)nc(N)c2cc1OC	ZINC000450796822	DC	On-Demand	Anodyne	EHMT2	59	35
C[C@H]1C(=O)N(C)CCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450796833	ED	On-Demand	Anodyne	PDE4D	15	40
C[C@@H]1C(=O)N(C)CCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450796834	ED	On-Demand	Anodyne	PDE4D	15	40
C[C@@H]1C(=O)N(C)CCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450796835	ED	On-Demand	Anodyne	PDE4D	15	40
C[C@H]1C(=O)N(C)CCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450796836	ED	On-Demand	Anodyne	PDE4D	15	40
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@H](O)CC)C2)nc1	ZINC000450796845	DC	On-Demand	Anodyne	P2RY12	23	41
CCOC(=O)c1ccc(N2CC(NC(=O)C[C@@H](O)CC)C2)nc1	ZINC000450796846	DC	On-Demand	Anodyne	P2RY12	23	41
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450796859	FD	On-Demand	Bother	BCL2L1	96	34
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450796859	FD	On-Demand	Bother	BCL2	75	38
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450796859	FD	On-Demand	Bother	BCL2L2	42	30
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450796859	FD	On-Demand	Bother	DDIT3	0	40
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450796860	FD	On-Demand	Bother	BCL2L1	96	34
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450796860	FD	On-Demand	Bother	BCL2	75	38
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450796860	FD	On-Demand	Bother	BCL2L2	42	30
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450796860	FD	On-Demand	Bother	DDIT3	0	40
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450796862	FD	On-Demand	Bother	BCL2L1	96	34
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450796862	FD	On-Demand	Bother	BCL2	75	38
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450796862	FD	On-Demand	Bother	BCL2L2	42	30
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450796862	FD	On-Demand	Bother	DDIT3	0	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450796863	FD	On-Demand	Bother	BCL2L1	96	34
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450796863	FD	On-Demand	Bother	BCL2	75	38
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450796863	FD	On-Demand	Bother	BCL2L2	42	30
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450796863	FD	On-Demand	Bother	DDIT3	0	40
CC[C@H](c1ccc(Cl)cc1Cl)N1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450796864	GH	On-Demand	Anodyne	CNR1	22	44
CC[C@H](c1ccc(Cl)cc1Cl)N1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450796867	GH	On-Demand	Anodyne	CNR1	22	44
CC[C@@H](c1ccc(Cl)cc1Cl)N1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450796868	GH	On-Demand	Anodyne	CNR1	22	44
CC[C@@H](c1ccc(Cl)cc1Cl)N1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450796871	GH	On-Demand	Anodyne	CNR1	22	44
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450796872	FH	On-Demand	Anodyne	MC3R	28	41
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450796872	FH	On-Demand	Anodyne	MC5R	22	41
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450796876	FH	On-Demand	Anodyne	MC3R	28	41
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450796876	FH	On-Demand	Anodyne	MC5R	22	41
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450796878	FH	On-Demand	Anodyne	MC3R	28	41
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450796878	FH	On-Demand	Anodyne	MC5R	22	41
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450796879	FH	On-Demand	Anodyne	MC3R	28	41
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450796879	FH	On-Demand	Anodyne	MC5R	22	41
Cc1ccc(C(=O)N2CC[C@@H](O)[C@@H](C)C2)c(Cl)c1Cl	ZINC000450796884	DG	On-Demand	Anodyne	P2RX7	25	42
Cc1ccc(C(=O)N2CC[C@H](O)[C@H](C)C2)c(Cl)c1Cl	ZINC000450796885	DG	On-Demand	Anodyne	P2RX7	25	42
Cc1ccc(C(=O)N2CC[C@@H](O)[C@H](C)C2)c(Cl)c1Cl	ZINC000450796887	DG	On-Demand	Anodyne	P2RX7	25	42
Cc1ccc(C(=O)N2CC[C@H](O)[C@@H](C)C2)c(Cl)c1Cl	ZINC000450796889	DG	On-Demand	Anodyne	P2RX7	25	42
CCCNC(=O)c1ccc(N[C@H](CC)[C@H](C)O)nc1	ZINC000450796934	CD	On-Demand	Anodyne	EPHX2	15	40
CCCNC(=O)c1ccc(N[C@@H](CC)[C@H](C)O)nc1	ZINC000450796935	CD	On-Demand	Anodyne	EPHX2	15	40
CCCNC(=O)c1ccc(N[C@@H](CC)[C@@H](C)O)nc1	ZINC000450796937	CD	On-Demand	Anodyne	EPHX2	15	40
CCCNC(=O)c1ccc(N[C@H](CC)[C@@H](C)O)nc1	ZINC000450796938	CD	On-Demand	Anodyne	EPHX2	15	40
C[C@H](OCCc1ccccc1)C(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450796939	FG	On-Demand	Anodyne	PLA2G4A	64	33
C[C@@H](OCCc1ccccc1)C(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450796941	FG	On-Demand	Anodyne	PLA2G4A	64	33
C[C@H]1CN(c2ncc(C(F)(F)F)s2)C[C@@H](C)N1CCO	ZINC000450796945	DE	On-Demand	Anodyne	MLYCD	56	36
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	ACE	39	42
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	MME	85	42
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	ANPEP	69	37
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	FCER2	48	33
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	BMP1	50	33
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	CTSB	50	41
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	PAPA1_CARPA	66	38
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	CYSP_TRYCR	46	37
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	CPA1	41	42
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	SLC15A1	0	41
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	TIMP3	65	35
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	CTRB1	31	40
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	CAPNS1	60	38
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	HLA-DRB1	45	34
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	CTSS	23	40
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	CAPN1	76	38
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	CAPN2	88	39
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	ACE2	69	42
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	FPR1	47	36
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	POL	0	43
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	NPR	52	33
CCOC[C@H](C)NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450796947	CD	On-Demand	Anodyne	AMP1_PLAFQ	46	36
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	ACE	39	42
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	MME	85	42
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	ANPEP	69	37
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	FCER2	48	33
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	BMP1	50	33
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	CTSB	50	41
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	PAPA1_CARPA	66	38
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	CYSP_TRYCR	46	37
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	CPA1	41	42
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	SLC15A1	0	41
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	TIMP3	65	35
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	CTRB1	31	40
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	CAPNS1	60	38
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	HLA-DRB1	45	34
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	CTSS	23	40
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	CAPN1	76	38
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	CAPN2	88	39
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	ACE2	69	42
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	FPR1	47	36
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	POL	0	43
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	NPR	52	33
CCOC[C@H](C)NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450796949	CD	On-Demand	Anodyne	AMP1_PLAFQ	46	36
COC(=O)c1ccc(CC(=O)N2CC[C@@H](O)[C@H](C)C2)cc1	ZINC000450796955	CD	On-Demand	Anodyne	GPR183	0	40
COC(=O)c1ccc(CC(=O)N2CC[C@H](O)[C@@H](C)C2)cc1	ZINC000450796956	CD	On-Demand	Anodyne	GPR183	0	40
COC(=O)c1ccc(CC(=O)N2CC[C@H](O)[C@H](C)C2)cc1	ZINC000450796957	CD	On-Demand	Anodyne	GPR183	0	40
COC(=O)c1ccc(CC(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1	ZINC000450796959	CD	On-Demand	Anodyne	GPR183	0	40
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2/C=C\c2cccs2)o1	ZINC000450796973	FJ	On-Demand	Anodyne	PREP	40	37
Cc1cnc(CCCC(=O)N2CCCCC[C@H]2/C=C/c2cccs2)o1	ZINC000450796975	FJ	On-Demand	Anodyne	PREP	40	37
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2/C=C/c2cccs2)o1	ZINC000450796976	FJ	On-Demand	Anodyne	PREP	40	37
Cc1cnc(CCCC(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)o1	ZINC000450796977	FJ	On-Demand	Anodyne	PREP	40	37
CCc1cc(NCc2cnccc2C)n2ncnc2n1	ZINC000450796978	CE	On-Demand	Anodyne	DHOD	0	51
CC(C)[C@H]1OCCC[C@@H]1Nc1ccnc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450796980	GD	On-Demand	Anodyne	SORD	57	33
CC(C)[C@@H]1OCCC[C@H]1Nc1ccnc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450796982	GD	On-Demand	Anodyne	SORD	57	33
CC(C)[C@H]1OCCC[C@H]1Nc1ccnc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450796983	GD	On-Demand	Anodyne	SORD	57	33
CC(C)[C@@H]1OCCC[C@@H]1Nc1ccnc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450796984	GD	On-Demand	Anodyne	SORD	57	33
COc1cccc(OCCC(=O)Nc2c(C)noc2C2CC2)c1	ZINC000450796985	DG	On-Demand	Anodyne	MTNR1A	28	41
COc1cccc(OCCC(=O)Nc2c(C)noc2C2CC2)c1	ZINC000450796985	DG	On-Demand	Anodyne	GPBAR1	0	40
CC(F)(F)c1ccc(C(=O)N2CCCCC[C@H]2/C=C/c2cccs2)cn1	ZINC000450796990	GK	On-Demand	Anodyne	SFRP1	46	37
CC(F)(F)c1ccc(C(=O)N2CCCCC[C@H]2/C=C\c2cccs2)cn1	ZINC000450796992	GK	On-Demand	Anodyne	SFRP1	46	37
CC(F)(F)c1ccc(C(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)cn1	ZINC000450796993	GK	On-Demand	Anodyne	SFRP1	46	37
CC(F)(F)c1ccc(C(=O)N2CCCCC[C@@H]2/C=C/c2cccs2)cn1	ZINC000450796994	GK	On-Demand	Anodyne	SFRP1	46	37
Cc1nc([C@@H]2CCCN2C(=O)CCCC(=O)C2CC2)cs1	ZINC000450796997	DG	On-Demand	Anodyne	CPT1A	81	45
NC(=O)c1coc(CNC(=O)[C@H]2CCCc3sc(Nc4ccccc4)nc32)c1	ZINC000450797000	GF	On-Demand	Anodyne	CYP2D6	15	42
NC(=O)c1coc(CNC(=O)[C@@H]2CCCc3sc(Nc4ccccc4)nc32)c1	ZINC000450797001	GF	On-Demand	Anodyne	CYP2D6	15	42
COCCNC(=O)c1ccc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc1	ZINC000450797021	EC	On-Demand	Anodyne	HDAC1	0	42
Cc1nc(C)n(CCCC(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)n1	ZINC000450797028	GD	On-Demand	Anodyne	EPHX2	16	52
CCOC[C@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450797046	CD	On-Demand	Anodyne	PROTEASE	15	42
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797054	EE	On-Demand	Anodyne	EPHX2	17	43
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797054	EE	On-Demand	Anodyne	CACNA1G	35	42
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797054	EE	On-Demand	Anodyne	BIRC8	40	32
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797055	EE	On-Demand	Anodyne	EPHX2	17	43
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797055	EE	On-Demand	Anodyne	CACNA1G	35	42
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797055	EE	On-Demand	Anodyne	BIRC8	40	32
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797056	EE	On-Demand	Anodyne	EPHX2	17	43
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797056	EE	On-Demand	Anodyne	CACNA1G	35	42
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797056	EE	On-Demand	Anodyne	BIRC8	40	32
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797057	EE	On-Demand	Anodyne	EPHX2	17	43
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797057	EE	On-Demand	Anodyne	CACNA1G	35	42
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797057	EE	On-Demand	Anodyne	BIRC8	40	32
CSc1cccc(C(=O)NCc2nnnn2C)c1	ZINC000450797058	CC	On-Demand	Anodyne	DAGLA	17	49
CN1CC[C@@H]2CN(c3ncnc4sc5c(c34)CCCC5)C[C@@H]21	ZINC000450797059	DF	On-Demand	Anodyne	RBP4	17	41
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	HTR1A	58	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	THRA	15	41
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	DRD2	52	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	DRD1	29	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	DRD4	44	35
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	HTR2A	35	42
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	HTR2C	28	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	SLC6A4	15	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	ADRA1A	29	40
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	HRH1	18	43
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	ADRA1B	17	40
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	DRD3	60	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	HTR7	73	56
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	SLC18A3	24	42
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	ABCB1	15	49
COC(=O)C(C)(C)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450797072	EE	On-Demand	Anodyne	CYP2J2	68	50
COc1ccc(F)cc1CNC(=O)[C@H]1CC12CCSCC2	ZINC000450797093	DF	On-Demand	Anodyne	P2RX7	49	39
COc1ccc(F)cc1CNC(=O)[C@@H]1CC12CCSCC2	ZINC000450797094	DF	On-Demand	Anodyne	P2RX7	49	39
CN1CC[C@@H]2CN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])C[C@@H]21	ZINC000450797095	ED	On-Demand	Bother	TAAR1	18	44
COc1ccc(F)cc1CNC(=O)c1c(C2CC2)noc1C	ZINC000450797100	DF	On-Demand	Anodyne	P2RX7	51	43
CC[C@H](CC(C)C)C(=O)NCc1cc(F)ccc1OC	ZINC000450797104	CH	On-Demand	Anodyne	ANPEP	32	48
CC[C@H](CC(C)C)C(=O)NCc1cc(F)ccc1OC	ZINC000450797104	CH	On-Demand	Anodyne	P2RX7	39	40
CC[C@H](CC(C)C)C(=O)NCc1cc(F)ccc1OC	ZINC000450797104	CH	On-Demand	Anodyne	PPARD	30	52
CC[C@@H](CC(C)C)C(=O)NCc1cc(F)ccc1OC	ZINC000450797105	CH	On-Demand	Anodyne	ANPEP	32	48
CC[C@@H](CC(C)C)C(=O)NCc1cc(F)ccc1OC	ZINC000450797105	CH	On-Demand	Anodyne	P2RX7	39	40
CC[C@@H](CC(C)C)C(=O)NCc1cc(F)ccc1OC	ZINC000450797105	CH	On-Demand	Anodyne	PPARD	30	52
COc1cc(CN2CCC[C@@H]2CCO)ccc1Cl	ZINC000450797116	CF	On-Demand	Anodyne	DRD2	48	41
COc1cc(CN2CCC[C@@H]2CCO)ccc1Cl	ZINC000450797116	CF	On-Demand	Anodyne	SLC18A2	50	37
COc1cc(CN2CCC[C@@H]2CCO)ccc1Cl	ZINC000450797116	CF	On-Demand	Anodyne	ACKR3	60	30
COc1cc(CN2CCC[C@H]2CCO)ccc1Cl	ZINC000450797117	CF	On-Demand	Anodyne	DRD2	48	41
COc1cc(CN2CCC[C@H]2CCO)ccc1Cl	ZINC000450797117	CF	On-Demand	Anodyne	SLC18A2	50	37
COc1cc(CN2CCC[C@H]2CCO)ccc1Cl	ZINC000450797117	CF	On-Demand	Anodyne	ACKR3	60	30
O=C(NCc1ccc(Cl)cc1F)C1(C(=O)C2CC2)CC1	ZINC000450797126	CF	On-Demand	Anodyne	P2RX7	33	41
C=CCN(C)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450797134	CH	On-Demand	Mild	PRCP	40	33
C=CCN(C)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450797135	CH	On-Demand	Mild	PRCP	40	33
C=CCN(C)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450797136	CH	On-Demand	Mild	PRCP	40	33
C=CCN(C)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450797137	CH	On-Demand	Mild	PRCP	40	33
O=C(NC1CC1)c1noc([C@@H]2CCCN2CC/C=C/c2ccccc2)n1	ZINC000450797147	FG	On-Demand	Anodyne	COLA	56	42
O=C(NC1CC1)c1noc([C@@H]2CCCN2CC/C=C/c2ccccc2)n1	ZINC000450797147	FG	On-Demand	Anodyne	CPT1A	49	42
Cc1ccn2ncc(C(=O)N3CCC(C)(C(C)C)CC3)c2c1	ZINC000450797148	CH	On-Demand	Anodyne	EPHB3	25	43
CCCOc1ccc(C(=O)Nc2ccc3c(c2)CCN3C(=O)COC)c(OC)c1	ZINC000450797155	GG	On-Demand	Anodyne	EIF2AK3	23	40
CCCOc1ccc(C(=O)Nc2ccc3c(c2)CCN3C(=O)COC)c(OC)c1	ZINC000450797155	GG	On-Demand	Anodyne	KCNK3	41	36
COc1ccc(-c2csc3ncnc(N4CC(C)(CO)C4)c23)cc1	ZINC000450797156	EG	On-Demand	Anodyne	ADRB3	0	46
C[C@@H]1[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)CCCN1C	ZINC000450797163	EF	On-Demand	Anodyne	SLC12A5	47	33
C[C@H]1[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)CCCN1C	ZINC000450797164	EF	On-Demand	Anodyne	SLC12A5	47	33
CC[C@@H](CC(C)C)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000450797165	EG	On-Demand	Anodyne	NAMPT	0	41
CC[C@H](CC(C)C)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000450797166	EG	On-Demand	Anodyne	NAMPT	0	41
C[C@@H]1[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)CCCN1C	ZINC000450797167	EF	On-Demand	Anodyne	SLC12A5	47	33
C[C@H]1[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)CCCN1C	ZINC000450797168	EF	On-Demand	Anodyne	SLC12A5	47	33
CCOC(=O)C[C@@H](C)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450797177	FE	On-Demand	Anodyne	BDKRB2	19	43
CCOC(=O)C[C@@H](C)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450797177	FE	On-Demand	Anodyne	CCKBR	18	41
CCOC(=O)C[C@@H](C)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450797177	FE	On-Demand	Anodyne	KCNK3	47	36
CCOC(=O)C[C@@H](C)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450797177	FE	On-Demand	Anodyne	KCNK9	44	36
CCOC(=O)C[C@H](C)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450797178	FE	On-Demand	Anodyne	BDKRB2	19	43
CCOC(=O)C[C@H](C)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450797178	FE	On-Demand	Anodyne	CCKBR	18	41
CCOC(=O)C[C@H](C)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450797178	FE	On-Demand	Anodyne	KCNK3	47	36
CCOC(=O)C[C@H](C)N(C)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450797178	FE	On-Demand	Anodyne	KCNK9	44	36
CC1(O)CC(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)C1	ZINC000450797190	EH	On-Demand	Anodyne	F10	31	42
CC1(O)CC(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)C1	ZINC000450797190	EH	On-Demand	Anodyne	TYK2	42	34
COCC(COC)Nc1cc(C)c([N+](=O)[O-])c(C(=O)OC)c1	ZINC000450797198	DD	On-Demand	Bother	CACNA1D	41	32
CCC(CC)Oc1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cc1	ZINC000450797243	GG	On-Demand	Anodyne	CA2	21	44
CCC(CC)Oc1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cc1	ZINC000450797243	GG	On-Demand	Anodyne	CA1	19	44
CCC(CC)Oc1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cc1	ZINC000450797243	GG	On-Demand	Anodyne	TRPV1	16	41
CCC(CC)Oc1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cc1	ZINC000450797243	GG	On-Demand	Anodyne	PRNP	54	33
CCC(CC)Oc1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cc1	ZINC000450797243	GG	On-Demand	Anodyne	CA9	15	44
CCC(CC)Oc1ccc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)cc1	ZINC000450797243	GG	On-Demand	Anodyne	E1	0	44
CCCOc1ccc(C(=O)N2CCN(CC(C)C)C(=O)C2)c(OC)c1	ZINC000450797253	EE	On-Demand	Anodyne	OXTR	24	42
COCC(COC)Nc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450797261	FF	On-Demand	Anodyne	NPBWR1	57	43
Cc1cc(N2CC(C)(CO)C2)nc(C(C)C)n1	ZINC000450797273	BD	On-Demand	Anodyne	SORD	33	40
C[C@H]1CN(c2ncc(C(=O)N(C)C)cc2Cl)C[C@@H](C)N1CCO	ZINC000450797274	ED	On-Demand	Anodyne	CXCR3	32	40
CCC[C@@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450797289	EF	On-Demand	Anodyne	MME	0	54
CCC[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450797290	EF	On-Demand	Anodyne	MME	0	54
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](O)C3CCC3)C2)nc1	ZINC000450797296	EC	On-Demand	Anodyne	P2RY12	22	42
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@H](O)C3CCC3)C2)nc1	ZINC000450797296	EC	On-Demand	Anodyne	SCARB1	53	38
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](O)C3CCC3)C2)nc1	ZINC000450797297	EC	On-Demand	Anodyne	P2RY12	22	42
CCOC(=O)c1ccc(N2CC(NC(=O)[C@H](O)C3CCC3)C2)nc1	ZINC000450797297	EC	On-Demand	Anodyne	SCARB1	53	38
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)CC1(C#N)CCC1	ZINC000450797303	CF	On-Demand	Mild	CHRNA2	39	40
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)CC1(C#N)CCC1	ZINC000450797303	CF	On-Demand	Mild	CRTY	0	40
COCC(COC)Nc1ncnc2sc(-c3ccccc3)cc12	ZINC000450797331	EG	On-Demand	Anodyne	EGFR	15	57
COCC(COC)Nc1ncnc2sc(-c3ccccc3)cc12	ZINC000450797331	EG	On-Demand	Anodyne	FDPS	18	52
C[C@@H]1CN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC[C@@H]1O	ZINC000450797333	CD	On-Demand	Anodyne	HRH3	21	40
C[C@@H]1CN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC[C@H]1O	ZINC000450797334	CD	On-Demand	Anodyne	HRH3	21	40
C[C@@H]1CN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC[C@H]1O	ZINC000450797336	CD	On-Demand	Anodyne	HRH3	21	40
C[C@@H]1CN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC[C@@H]1O	ZINC000450797338	CD	On-Demand	Anodyne	HRH3	21	40
COc1cc(CC(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797341	GE	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797341	GE	On-Demand	Anodyne	OPRK1	41	42
COc1cc(CC(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797341	GE	On-Demand	Anodyne	HTR4	43	36
COc1cc(CC(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797341	GE	On-Demand	Anodyne	CCR1	25	42
COc1cc(CC(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797341	GE	On-Demand	Anodyne	ITGA4	26	40
COc1cc(CC(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797341	GE	On-Demand	Anodyne	EPHX2	29	40
COCC(COC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450797345	EF	On-Demand	Anodyne	RARA	24	41
COCC(COC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450797345	EF	On-Demand	Anodyne	PRNP	64	34
COCC(COC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450797345	EF	On-Demand	Anodyne	GCK	37	41
COc1cc(CC(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797350	GE	On-Demand	Anodyne	OPRM1	0	42
COc1cc(CC(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797350	GE	On-Demand	Anodyne	OPRK1	41	42
COc1cc(CC(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797350	GE	On-Demand	Anodyne	HTR4	43	36
COc1cc(CC(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797350	GE	On-Demand	Anodyne	CCR1	25	42
COc1cc(CC(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797350	GE	On-Demand	Anodyne	ITGA4	26	40
COc1cc(CC(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)ccc1Cl	ZINC000450797350	GE	On-Demand	Anodyne	EPHX2	29	40
C[C@H]1CN(c2nccc(C(F)(F)F)n2)C[C@@H](C)N1CCO	ZINC000450797366	DD	On-Demand	Anodyne	SORD	59	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797371	GG	On-Demand	Anodyne	CACNA1B	50	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797371	GG	On-Demand	Anodyne	CCR2	57	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797371	GG	On-Demand	Anodyne	EPHX2	41	46
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797371	GG	On-Demand	Anodyne	LIPG	54	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450797371	GG	On-Demand	Anodyne	RHOA	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797374	GG	On-Demand	Anodyne	CACNA1B	50	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797374	GG	On-Demand	Anodyne	CCR2	57	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797374	GG	On-Demand	Anodyne	EPHX2	41	46
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797374	GG	On-Demand	Anodyne	LIPG	54	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450797374	GG	On-Demand	Anodyne	RHOA	0	41
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	DRD2	31	50
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	DRD4	55	49
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	ACHE	28	49
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	HRH1	28	52
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	DRD3	19	49
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	KCNH2	20	49
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	HTR4	72	49
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	CHRM3	17	40
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	SIGMAR1	34	49
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	SSTR5	95	52
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	CCR1	24	40
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	CCR3	57	47
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	BDKRB1	21	40
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	UTS2R	32	44
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	PDK1	52	40
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	MCHR1	57	54
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	CACNA1G	31	41
COc1cc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797380	FE	On-Demand	Anodyne	CCR8	28	45
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	DRD2	31	50
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	DRD4	55	49
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	ACHE	28	49
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	HRH1	28	52
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	DRD3	19	49
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	KCNH2	20	49
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	HTR4	72	49
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	CHRM3	17	40
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	SIGMAR1	34	49
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	SSTR5	95	52
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	CCR1	24	40
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	CCR3	57	47
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	BDKRB1	21	40
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	UTS2R	32	44
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	PDK1	52	40
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	MCHR1	57	54
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	CACNA1G	31	41
COc1cc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)ccc1Cl	ZINC000450797382	FE	On-Demand	Anodyne	CCR8	28	45
CCOc1ccc(NC(=O)CSC2CC2)cc1Br	ZINC000450797389	EH	On-Demand	Anodyne	QRFPR	45	38
CCOc1ccc(NC(=O)CSC2CC2)cc1Br	ZINC000450797389	EH	On-Demand	Anodyne	ENPP1	75	39
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450797401	CE	On-Demand	Anodyne	FGFR1	22	44
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450797401	CE	On-Demand	Anodyne	FLT1	25	42
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450797401	CE	On-Demand	Anodyne	FBP1	0	42
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450797401	CE	On-Demand	Anodyne	EPHA2	45	36
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450797402	CE	On-Demand	Anodyne	FGFR1	22	44
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450797402	CE	On-Demand	Anodyne	FLT1	25	42
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450797402	CE	On-Demand	Anodyne	FBP1	0	42
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450797402	CE	On-Demand	Anodyne	EPHA2	45	36
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450797403	CE	On-Demand	Anodyne	FGFR1	22	44
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450797403	CE	On-Demand	Anodyne	FLT1	25	42
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450797403	CE	On-Demand	Anodyne	FBP1	0	42
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](C)O	ZINC000450797403	CE	On-Demand	Anodyne	EPHA2	45	36
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450797404	CE	On-Demand	Anodyne	FGFR1	22	44
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450797404	CE	On-Demand	Anodyne	FLT1	25	42
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450797404	CE	On-Demand	Anodyne	FBP1	0	42
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)[C@@H](C)O	ZINC000450797404	CE	On-Demand	Anodyne	EPHA2	45	36
COC(=O)[C@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc2ccccc2c1	ZINC000450797406	ED	On-Demand	Anodyne	XIAP	26	42
COC(=O)[C@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc2ccccc2c1	ZINC000450797408	ED	On-Demand	Anodyne	XIAP	26	42
COC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc2ccccc2c1	ZINC000450797409	ED	On-Demand	Anodyne	XIAP	26	42
COC(=O)[C@@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc2ccccc2c1	ZINC000450797410	ED	On-Demand	Anodyne	XIAP	26	42
CCn1nnc(C)c1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450797413	EE	On-Demand	Anodyne	NPFFR1	47	35
CCOC(=O)c1ccc(CSc2nc3ccsc3c(=O)n2CC)nc1	ZINC000450797414	GG	On-Demand	Anodyne	PDE7A	15	41
CCOC(=O)c1ccc(CSc2nc3ccsc3c(=O)n2CC)nc1	ZINC000450797414	GG	On-Demand	Anodyne	KIF11	15	40
CCn1nnc(C)c1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450797415	EE	On-Demand	Anodyne	NPFFR1	47	35
CCN(C[C@@H](O)C(F)(F)F)C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450797441	EG	On-Demand	Anodyne	GPR88	0	43
CC(C)CCCC(=O)NCc1nc2cc(Cl)ccc2n1C	ZINC000450797442	DH	On-Demand	Anodyne	HTR7	23	40
Cc1nnc2c3ccccc3c(N3C[C@H](C)N(CCO)[C@H](C)C3)nn12	ZINC000450797457	ED	On-Demand	Anodyne	CREBBP	41	32
Cc1nnc2c3ccccc3c(N3C[C@H](C)N(CCO)[C@H](C)C3)nn12	ZINC000450797457	ED	On-Demand	Anodyne	BRD9	52	34
CC(C)[C@H]1OCCC[C@@H]1Nc1nccc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450797461	GD	On-Demand	Anodyne	SORD	62	39
CC(C)[C@@H]1OCCC[C@H]1Nc1nccc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450797462	GD	On-Demand	Anodyne	SORD	62	39
CC(C)[C@H]1OCCC[C@H]1Nc1nccc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450797463	GD	On-Demand	Anodyne	SORD	62	39
CC(C)[C@@H]1OCCC[C@@H]1Nc1nccc(N2C[C@H](C)N(CCO)[C@H](C)C2)n1	ZINC000450797464	GD	On-Demand	Anodyne	SORD	62	39
CCOC[C@H](C)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450797468	FG	On-Demand	Anodyne	PDGFRB	15	44
CCOC[C@H](C)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450797468	FG	On-Demand	Anodyne	CPT1A	44	30
CCOC[C@H](C)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450797468	FG	On-Demand	Anodyne	HPGD	45	55
Cc1cc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc(-c2ccccn2)n1	ZINC000450797473	ED	On-Demand	Anodyne	SORD	47	32
CCOC[C@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450797478	DF	On-Demand	Bother	PPXII	0	41
C[C@H]1CN(c2ncnc3[nH]ccc23)C[C@@H](C)N1CCO	ZINC000450797505	CC	On-Demand	Anodyne	AKT2	49	43
C[C@H]1CN(c2ncnc3[nH]ccc23)C[C@@H](C)N1CCO	ZINC000450797505	CC	On-Demand	Anodyne	AKT3	38	43
C[C@H]1CN(c2ncnc3[nH]ccc23)C[C@@H](C)N1CCO	ZINC000450797505	CC	On-Demand	Anodyne	ROCK2	44	43
C[C@H]1CN(c2ncnc3[nH]ccc23)C[C@@H](C)N1CCO	ZINC000450797505	CC	On-Demand	Anodyne	AKT1	24	43
C[C@H]1CN(c2ncnc3[nH]ccc23)C[C@@H](C)N1CCO	ZINC000450797505	CC	On-Demand	Anodyne	LIMK2	46	44
COc1cccc(SCCCCCC(C)=O)c1	ZINC000450797517	CH	On-Demand	Anodyne	MTNR1A	32	46
COc1cccc(SCCCCCC(C)=O)c1	ZINC000450797517	CH	On-Demand	Anodyne	MTNR1B	23	43
COc1cccc(SCCCCCC(C)=O)c1	ZINC000450797517	CH	On-Demand	Anodyne	CPG2	0	42
CC(C)OCCCCNC(=O)[C@]1(C)CCC[C@@H]1C	ZINC000450797524	CG	On-Demand	Anodyne	EPHX2	16	42
CC(C)OCCCCNC(=O)[C@@]1(C)CCC[C@H]1C	ZINC000450797525	CG	On-Demand	Anodyne	EPHX2	16	42
CC(C)OCCCCNC(=O)[C@]1(C)CCC[C@H]1C	ZINC000450797526	CG	On-Demand	Anodyne	EPHX2	16	42
CC(C)OCCCCNC(=O)[C@@]1(C)CCC[C@@H]1C	ZINC000450797527	CG	On-Demand	Anodyne	EPHX2	16	42
CN1CC[C@@H]2CN(c3ncnc4ccsc34)C[C@@H]21	ZINC000450797609	CD	On-Demand	Anodyne	SIRT3	50	32
CN1CC[C@@H]2CN(c3ncnc4ccsc34)C[C@@H]21	ZINC000450797609	CD	On-Demand	Anodyne	SIRT2	50	32
CN1CC[C@@H]2CN(c3ncnc4ccsc34)C[C@@H]21	ZINC000450797609	CD	On-Demand	Anodyne	SIRT1	50	32
O=C(NCC(F)(F)F)[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450797618	EG	On-Demand	Anodyne	SLC6A1	113	42
O=C(NCC(F)(F)F)[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450797618	EG	On-Demand	Anodyne	CACNA1G	40	42
O=C(NCC(F)(F)F)[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450797619	EG	On-Demand	Anodyne	SLC6A1	113	42
O=C(NCC(F)(F)F)[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450797619	EG	On-Demand	Anodyne	CACNA1G	40	42
O=C(NCC(F)(F)F)[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450797620	EG	On-Demand	Anodyne	SLC6A1	113	42
O=C(NCC(F)(F)F)[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450797620	EG	On-Demand	Anodyne	CACNA1G	40	42
O=C(NCC(F)(F)F)[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450797621	EG	On-Demand	Anodyne	SLC6A1	113	42
O=C(NCC(F)(F)F)[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450797621	EG	On-Demand	Anodyne	CACNA1G	40	42
CCc1nc(C)c(NC(=O)CCc2ccc(C(N)=O)cc2)s1	ZINC000450797624	DF	On-Demand	Anodyne	VIPR1	24	40
CC1(CO)CN(c2nc(-c3ccccn3)nc3c2CCC3)C1	ZINC000450797667	CD	On-Demand	Anodyne	METAP1	22	43
Cc1ccc(NC(=O)c2ccc(N3CC(C)(CO)C3)nc2)cc1	ZINC000450797675	DE	On-Demand	Anodyne	PRNP	67	40
Cc1ccc(NC(=O)c2ccc(N3CC(C)(CO)C3)nc2)cc1	ZINC000450797675	DE	On-Demand	Anodyne	HDAC1	22	44
Cc1ccc(NC(=O)c2ccc(N3CC(C)(CO)C3)nc2)cc1	ZINC000450797675	DE	On-Demand	Anodyne	P4HTM	0	54
COc1cc(CC(=O)N2CCN(C)C(=O)[C@@H]2C)ccc1O	ZINC000450797676	CC	On-Demand	Anodyne	TRPV1	0	44
COc1cc(CC(=O)N2CCN(C)C(=O)[C@H]2C)ccc1O	ZINC000450797678	CC	On-Demand	Anodyne	TRPV1	0	44
C[C@H]1C(=O)N(C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450797715	FD	On-Demand	Mild	TRPV4	40	30
C[C@@H]1C(=O)N(C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450797716	FD	On-Demand	Mild	TRPV4	40	30
c1ccc(CCn2ccc(CN3CCN(c4cc(C5CC5)[nH]n4)CC3)n2)cc1	ZINC000450797729	GG	On-Demand	Anodyne	DRD4	22	48
COCC[C@H](Cc1ccco1)NC(=O)[C@]1(C)CCC[C@H]1C	ZINC000450797764	CG	On-Demand	Anodyne	NPPA	44	35
COCC[C@H](Cc1ccco1)NC(=O)[C@@]1(C)CCC[C@H]1C	ZINC000450797765	CG	On-Demand	Anodyne	NPPA	44	35
COCC[C@H](Cc1ccco1)NC(=O)[C@]1(C)CCC[C@@H]1C	ZINC000450797766	CG	On-Demand	Anodyne	NPPA	44	35
COCC[C@H](Cc1ccco1)NC(=O)[C@@]1(C)CCC[C@@H]1C	ZINC000450797767	CG	On-Demand	Anodyne	NPPA	44	35
c1ccc(-c2nnc3ccc(N4C[C@H](C5CC5)[C@@H]4C4CC4)nn23)cc1	ZINC000450797769	EG	On-Demand	Anodyne	LRRK2	0	41
c1ccc(-c2nnc3ccc(N4C[C@@H](C5CC5)[C@@H]4C4CC4)nn23)cc1	ZINC000450797770	EG	On-Demand	Anodyne	LRRK2	0	41
c1ccc(-c2nnc3ccc(N4C[C@@H](C5CC5)[C@H]4C4CC4)nn23)cc1	ZINC000450797771	EG	On-Demand	Anodyne	LRRK2	0	41
c1ccc(-c2nnc3ccc(N4C[C@H](C5CC5)[C@H]4C4CC4)nn23)cc1	ZINC000450797772	EG	On-Demand	Anodyne	LRRK2	0	41
COC(=O)[C@]1(C)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450797787	DF	On-Demand	Anodyne	DRD2	31	45
COC(=O)[C@]1(C)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450797787	DF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@]1(C)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450797787	DF	On-Demand	Anodyne	SLC18A3	0	46
COC(=O)[C@]1(C)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450797787	DF	On-Demand	Anodyne	AP2S1	0	45
COC(=O)[C@@]1(C)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450797788	DF	On-Demand	Anodyne	DRD2	31	45
COC(=O)[C@@]1(C)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450797788	DF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@@]1(C)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450797788	DF	On-Demand	Anodyne	SLC18A3	0	46
COC(=O)[C@@]1(C)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450797788	DF	On-Demand	Anodyne	AP2S1	0	45
COCC(COC)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450797790	DE	On-Demand	Anodyne	PTR1	46	34
COCC(COC)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450797790	DE	On-Demand	Anodyne	L3MBTL1	0	40
COCC(COC)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450797790	DE	On-Demand	Anodyne	L3MBTL3	58	35
COCC(COC)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450797790	DE	On-Demand	Anodyne	TRPC6	40	36
Fc1ccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc2c1	ZINC000450797791	DF	On-Demand	Anodyne	HRP1_PLAFA	108	41
Fc1ccc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc2c1	ZINC000450797791	DF	On-Demand	Anodyne	HNMT	71	45
COCC(=O)N1CCc2cc(NC(=O)c3scnc3C(C)C)ccc21	ZINC000450797801	FG	On-Demand	Anodyne	NAMPT	0	40
CCOc1ccc(NC(=O)Cn2ccc(C)n2)cc1Br	ZINC000450797802	EF	On-Demand	Anodyne	ENPP1	49	30
CN1CC[C@@H]2CN(c3nc4ccccc4o3)C[C@@H]21	ZINC000450797805	BD	On-Demand	Anodyne	HTR3A	0	50
C[C@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@@H](C)N1CCO	ZINC000450797806	EE	On-Demand	Mild	AR	26	45
CNS(=O)(=O)c1ccc(NC(COC)COC)c([N+](=O)[O-])c1	ZINC000450797833	EC	On-Demand	Bother	BDKRB1	0	43
CC1(C)[C@H](O)C[C@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450797838	DE	On-Demand	Mild	EZH2	46	37
CC1(C)[C@@H](O)C[C@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450797839	DE	On-Demand	Mild	EZH2	46	37
CC1(C)[C@@H](O)C[C@@H]1NC(=O)c1cccc(C#N)c1Br	ZINC000450797840	DE	On-Demand	Mild	EZH2	46	37
CC1(C)[C@@H](NC(=O)c2cccc(C#N)c2Br)C[C@H]1O	ZINC000450797842	DE	On-Demand	Mild	EZH2	46	37
Cn1nc(C(=O)NCc2nc3cc(Cl)ccc3n2C)c2c1CCCC2	ZINC000450797851	FF	On-Demand	Anodyne	CNR1	52	32
CSc1ccc2ncnc(N[C@H]3CC34CCOCC4)c2c1	ZINC000450797853	DG	On-Demand	Anodyne	CD38	46	40
CSc1ccc2ncnc(N[C@@H]3CC34CCOCC4)c2c1	ZINC000450797854	DG	On-Demand	Anodyne	CD38	46	40
CCOC[C@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450797855	DE	On-Demand	Bother	CACNA1D	70	34
CCC(=O)c1ccc(NC(COC)COC)c([N+](=O)[O-])c1	ZINC000450797883	CE	On-Demand	Bother	TAAR1	17	44
C[C@H]1CN(c2cc(Cl)ccc2C#N)C[C@@H](C)N1CCO	ZINC000450797894	CE	On-Demand	Mild	NOS2	19	41
C[C@H]1CN(c2cc(Cl)ccc2C#N)C[C@@H](C)N1CCO	ZINC000450797894	CE	On-Demand	Mild	NOS3	17	41
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450797895	GH	On-Demand	Anodyne	ACACA	43	40
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450797895	GH	On-Demand	Anodyne	ACACB	18	40
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450797896	GH	On-Demand	Anodyne	ACACA	43	40
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450797896	GH	On-Demand	Anodyne	ACACB	18	40
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450797897	GH	On-Demand	Anodyne	ACACA	43	40
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC([C@H](O)C(=O)NC2CC2)CC1	ZINC000450797897	GH	On-Demand	Anodyne	ACACB	18	40
COCC(COC)Nc1ncnc2ccc(C)cc12	ZINC000450797898	CE	On-Demand	Anodyne	EGFR	24	40
COCC(COC)Nc1ncnc2ccc(C)cc12	ZINC000450797898	CE	On-Demand	Anodyne	CLK4	47	37
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450797899	GH	On-Demand	Anodyne	ACACA	43	40
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC([C@@H](O)C(=O)NC2CC2)CC1	ZINC000450797899	GH	On-Demand	Anodyne	ACACB	18	40
COc1cc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc2cc1F	ZINC000450797900	EF	On-Demand	Anodyne	HRP1_PLAFA	98	36
COc1cc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc2cc1F	ZINC000450797900	EF	On-Demand	Anodyne	HNMT	62	38
COc1cc2c(NCCN3C[C@@H]4CC[C@H](C3)O4)ccnc2cc1F	ZINC000450797900	EF	On-Demand	Anodyne	MET	51	32
COCC(=O)N1CCc2cc(NC(=O)[C@H]3Cc4cccc(C)c4O3)ccc21	ZINC000450797911	FE	On-Demand	Anodyne	NAMPT	28	41
COCC(=O)N1CCc2cc(NC(=O)[C@@H]3Cc4cccc(C)c4O3)ccc21	ZINC000450797913	FE	On-Demand	Anodyne	NAMPT	28	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC2(CCCC2)C1	ZINC000450797914	CI	On-Demand	Anodyne	CACNA1B	38	44
CCC(CC)Oc1ccc(C(=O)N2CCC(Cn3cncn3)CC2)cc1	ZINC000450797915	FG	On-Demand	Anodyne	L3MBTL3	58	36
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000450797925	FG	On-Demand	Anodyne	NPY2R	25	40
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc2c(c1)CCN2C(=O)COC	ZINC000450797927	FG	On-Demand	Anodyne	NPY2R	25	40
COCC(COC)Nc1ncnc2cc(F)c(F)cc12	ZINC000450797935	CD	On-Demand	Anodyne	EGFR	32	41
COCC(COC)Nc1ncnc2cc(F)c(F)cc12	ZINC000450797935	CD	On-Demand	Anodyne	FLT1	29	43
CCCc1cc(C(=O)Nc2ccc(OCC)c(Br)c2)no1	ZINC000450797944	FI	On-Demand	Anodyne	GRM4	30	40
CCOC[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450797954	CE	On-Demand	Anodyne	SDH1	0	42
CCOC[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450797954	CE	On-Demand	Anodyne	PAPA1_CARPA	40	31
CCOC[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450797954	CE	On-Demand	Anodyne	CAPNS1	47	33
CCOC[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450797954	CE	On-Demand	Anodyne	CAPN1	49	35
CCOC[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450797954	CE	On-Demand	Anodyne	CAPN2	84	36
CCOC[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450797954	CE	On-Demand	Anodyne	ACE2	55	36
CCOC[C@H](C)NC(=O)[C@H](C)OCCc1ccccc1	ZINC000450797954	CE	On-Demand	Anodyne	NPR	48	33
CCOC[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450797955	CE	On-Demand	Anodyne	SDH1	0	42
CCOC[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450797955	CE	On-Demand	Anodyne	PAPA1_CARPA	40	31
CCOC[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450797955	CE	On-Demand	Anodyne	CAPNS1	47	33
CCOC[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450797955	CE	On-Demand	Anodyne	CAPN1	49	35
CCOC[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450797955	CE	On-Demand	Anodyne	CAPN2	84	36
CCOC[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450797955	CE	On-Demand	Anodyne	ACE2	55	36
CCOC[C@H](C)NC(=O)[C@@H](C)OCCc1ccccc1	ZINC000450797955	CE	On-Demand	Anodyne	NPR	48	33
Cc1ccc(F)c(CC(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1	ZINC000450797959	FF	On-Demand	Anodyne	EPHX2	17	41
COCC(COC)Nc1cc(N2CCCC2)ncn1	ZINC000450797962	CD	On-Demand	Anodyne	GALR2	42	33
C[C@H]1CN(c2ccccc2[N+](=O)[O-])C[C@@H](C)N1CCO	ZINC000450797965	CD	On-Demand	Bother	PQSD	0	42
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)CSC2CC2)C1	ZINC000450797967	DD	On-Demand	Anodyne	F2R	0	42
O=C(NCC(F)(F)F)[C@H]1CCN(C(=O)CSC2CC2)C1	ZINC000450797968	DD	On-Demand	Anodyne	F2R	0	42
CNS(=O)(=O)c1ccc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc1	ZINC000450797975	EB	On-Demand	Anodyne	GCKR	16	40
C[C@H](O)CN1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450798003	GE	On-Demand	Anodyne	HRH4	33	54
C[C@H](O)CN1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CC1	ZINC000450798003	GE	On-Demand	Anodyne	AKR1C3	0	42
Cc1nc(N2CCCC[C@@H]2CS(C)(=O)=O)c2cc[nH]c2n1	ZINC000450798028	DD	On-Demand	Anodyne	JAK1	48	36
Cc1nc(N2CCCC[C@H]2CS(C)(=O)=O)c2cc[nH]c2n1	ZINC000450798029	DD	On-Demand	Anodyne	JAK1	48	36
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1)[C@@H](C)O	ZINC000450798046	CD	On-Demand	Anodyne	GALR1	40	35
CC[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1)[C@@H](C)O	ZINC000450798047	CD	On-Demand	Anodyne	GALR1	40	35
CC[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1)[C@H](C)O	ZINC000450798048	CD	On-Demand	Anodyne	GALR1	40	35
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1)[C@H](C)O	ZINC000450798049	CD	On-Demand	Anodyne	GALR1	40	35
CC[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)[C@H](C)O	ZINC000450798070	CD	On-Demand	Anodyne	DHOD	0	51
CC[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)[C@H](C)O	ZINC000450798071	CD	On-Demand	Anodyne	DHOD	0	51
CC[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)[C@@H](C)O	ZINC000450798072	CD	On-Demand	Anodyne	DHOD	0	51
CC[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)[C@@H](C)O	ZINC000450798073	CD	On-Demand	Anodyne	DHOD	0	51
CC[C@H](Nc1ccc(S(=O)(=O)NCC2CC2)cn1)[C@H](C)O	ZINC000450798078	DD	On-Demand	Anodyne	NPY2R	49	37
CC[C@@H](Nc1ccc(S(=O)(=O)NCC2CC2)cn1)[C@H](C)O	ZINC000450798079	DD	On-Demand	Anodyne	NPY2R	49	37
CC[C@H](Nc1ccc(S(=O)(=O)NCC2CC2)cn1)[C@@H](C)O	ZINC000450798080	DD	On-Demand	Anodyne	NPY2R	49	37
CC[C@@H](Nc1ccc(S(=O)(=O)NCC2CC2)cn1)[C@@H](C)O	ZINC000450798081	DD	On-Demand	Anodyne	NPY2R	49	37
CS(=O)(=O)C[C@H]1CCCCN1c1nc2ccccc2o1	ZINC000450798097	CE	On-Demand	Anodyne	HTR3A	0	50
CS(=O)(=O)C[C@@H]1CCCCN1c1nc2ccccc2o1	ZINC000450798098	CE	On-Demand	Anodyne	HTR3A	0	50
C[C@@H]1C(=O)N(C)CCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450798115	EE	On-Demand	Anodyne	NK-3	0	42
C[C@H]1C(=O)N(C)CCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450798116	EE	On-Demand	Anodyne	NK-3	0	42
CC1(CO)CN(c2ccnc(C(=O)NCc3ccccc3)c2)C1	ZINC000450798128	DD	On-Demand	Anodyne	MMP13	0	43
CCOC(=O)C[C@@H](C)N(C)C(=O)Cc1cc2ccccc2s1	ZINC000450798137	DG	On-Demand	Anodyne	LTB4R	0	43
CCOC(=O)C[C@H](C)N(C)C(=O)Cc1cc2ccccc2s1	ZINC000450798138	DG	On-Demand	Anodyne	LTB4R	0	43
COCC[C@@H](Cc1ccco1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450798148	FG	On-Demand	Anodyne	TIMP3	62	33
COCC[C@@H](Cc1ccco1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450798148	FG	On-Demand	Anodyne	NPPA	44	35
COCC[C@H](Cc1ccco1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450798149	FG	On-Demand	Anodyne	TIMP3	62	33
COCC[C@H](Cc1ccco1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450798149	FG	On-Demand	Anodyne	NPPA	44	35
C[C@@H]1C(=O)N(C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450798153	ED	On-Demand	Bother	CACNA1C	50	34
C[C@@H]1C(=O)N(C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450798153	ED	On-Demand	Bother	CACNA1D	81	34
C[C@H]1C(=O)N(C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450798154	ED	On-Demand	Bother	CACNA1C	50	34
C[C@H]1C(=O)N(C)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450798154	ED	On-Demand	Bother	CACNA1D	81	34
O=C(NC1CC1)c1noc([C@@H]2CCCN2Cc2ccc(Cl)cc2Cl)n1	ZINC000450798201	GH	On-Demand	Anodyne	CNR1	21	40
O=C(NC1CC1)c1noc([C@@H]2CCCN2Cc2ccc(Cl)cc2Cl)n1	ZINC000450798201	GH	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CC1)c1noc([C@@H]2CCCN2Cc2ccc(Cl)cc2Cl)n1	ZINC000450798201	GH	On-Demand	Anodyne	PDK1	25	42
O=C(NC1CC1)c1noc([C@H]2CCCN2Cc2ccc(Cl)cc2Cl)n1	ZINC000450798202	GH	On-Demand	Anodyne	CNR1	21	40
O=C(NC1CC1)c1noc([C@H]2CCCN2Cc2ccc(Cl)cc2Cl)n1	ZINC000450798202	GH	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CC1)c1noc([C@H]2CCCN2Cc2ccc(Cl)cc2Cl)n1	ZINC000450798202	GH	On-Demand	Anodyne	PDK1	25	42
COCC(=O)N1CCc2cc(NC(=O)C3CC(O)(CCC(C)(C)C)C3)ccc21	ZINC000450798204	GG	On-Demand	Anodyne	NAMPT	26	41
COCC(COC)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450798205	ED	On-Demand	Anodyne	HRH1	0	45
COCC(COC)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450798205	ED	On-Demand	Anodyne	HTR3A	25	50
COCC(COC)Nc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450798205	ED	On-Demand	Anodyne	HRH4	38	40
CCOc1ccc(NC(=O)Cn2cc(C(C)=O)nn2)cc1Br	ZINC000450798212	FE	On-Demand	Anodyne	ENPP1	69	36
C[C@H]1CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C[C@@H](C)N1CCO	ZINC000450798215	GD	On-Demand	Anodyne	CXCR3	34	40
COCC(COC)Nc1ncnc2cccc(F)c12	ZINC000450798217	CD	On-Demand	Anodyne	DYRK1A	44	32
C[C@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@@H](C)N1CCO	ZINC000450798230	DC	On-Demand	Anodyne	P2RY12	28	42
C[C@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@@H](C)N1CCO	ZINC000450798230	DC	On-Demand	Anodyne	CXCR3	33	52
Cn1cc(-c2ccc(C(=O)Nc3ccc(C(=O)N4CCOCC4)c(F)c3)o2)cn1	ZINC000450798235	GF	On-Demand	Anodyne	SCN10A	23	44
C[C@H]1CN(c2ccc(S(=O)(=O)N3CCCC3)cn2)C[C@@H](C)N1CCO	ZINC000450798240	FC	On-Demand	Anodyne	GCK	42	30
C[C@H]1CN(c2ccc(S(=O)(=O)N3CCCC3)cn2)C[C@@H](C)N1CCO	ZINC000450798240	FC	On-Demand	Anodyne	GCKR	64	36
COc1cccc(OCCC(=O)NCc2cnc(C)nc2O)c1	ZINC000450798252	DD	On-Demand	Anodyne	MTNR1A	66	42
COc1cccc(OCCC(=O)NCc2cnc(C)nc2O)c1	ZINC000450798252	DD	On-Demand	Anodyne	MTNR1B	54	42
Cc1cncc(-c2nc(CN3CCC[C@H]3c3nc(C(=O)NC4CC4)no3)no2)c1	ZINC000450798269	GE	On-Demand	Anodyne	SSTR5	28	40
Cc1cncc(-c2nc(CN3CCC[C@@H]3c3nc(C(=O)NC4CC4)no3)no2)c1	ZINC000450798272	GE	On-Demand	Anodyne	SSTR5	28	40
CC[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450798275	EE	On-Demand	Anodyne	MME	18	56
CC[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450798275	EE	On-Demand	Anodyne	CA1	15	44
CC[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450798275	EE	On-Demand	Anodyne	CA7	18	70
CCOc1nc2ccc(C(=O)N3CCC(Cn4cncn4)CC3)cc2[nH]1	ZINC000450798277	FE	On-Demand	Anodyne	GRIN2B	38	40
CCOc1nc2ccc(C(=O)N3CCC(Cn4cncn4)CC3)cc2[nH]1	ZINC000450798277	FE	On-Demand	Anodyne	CHEK2	25	40
CCOc1nc2ccc(C(=O)N3CCC(Cn4cncn4)CC3)cc2[nH]1	ZINC000450798277	FE	On-Demand	Anodyne	L3MBTL3	49	34
CC[C@@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450798279	EE	On-Demand	Anodyne	MME	18	56
CC[C@@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450798279	EE	On-Demand	Anodyne	CA1	15	44
CC[C@@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000450798279	EE	On-Demand	Anodyne	CA7	18	70
COc1cc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ncnc2cc1F	ZINC000450798319	ED	On-Demand	Anodyne	PDE3A	55	43
COc1cc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ncnc2cc1F	ZINC000450798319	ED	On-Demand	Anodyne	PDGFRB	70	41
COc1cc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)ncnc2cc1F	ZINC000450798319	ED	On-Demand	Anodyne	PDE3B	81	43
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CCOc1cccc(OC)c1	ZINC000450798325	FG	On-Demand	Anodyne	ACHE	22	40
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CCOc1cccc(OC)c1	ZINC000450798325	FG	On-Demand	Anodyne	MTNR1A	28	44
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CCOc1cccc(OC)c1	ZINC000450798325	FG	On-Demand	Anodyne	HSD17B2	15	41
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CCOc1cccc(OC)c1	ZINC000450798325	FG	On-Demand	Anodyne	PDS	65	41
COCC(COC)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450798327	CD	On-Demand	Bother	TAAR1	18	48
COCC(COC)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450798327	CD	On-Demand	Bother	AKR1C3	15	49
CC(F)(F)C(C)(C)C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450798351	FF	On-Demand	Anodyne	NPY2R	25	46
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	CACNA1H	20	40
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	DRD4	38	47
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	SIGMAR1	28	48
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	SSTR5	55	41
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	CCR3	27	43
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	UTS2R	19	42
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	CXCR3	46	40
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	MCHR1	48	48
CC1(C(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CCC(=O)CC1	ZINC000450798354	GI	On-Demand	Anodyne	CACNA1I	53	43
C[C@@H]1CCO[C@@H]1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450798366	DF	On-Demand	Anodyne	CACNA1G	17	41
C[C@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H](C)N1CCO	ZINC000450798372	GD	On-Demand	Anodyne	HRH1	0	51
C[C@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H](C)N1CCO	ZINC000450798372	GD	On-Demand	Anodyne	HTR3A	32	55
C[C@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@@H](C)N1CCO	ZINC000450798372	GD	On-Demand	Anodyne	HRH4	32	55
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450798385	EC	On-Demand	Anodyne	CA2	76	53
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450798385	EC	On-Demand	Anodyne	CA1	60	42
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450798385	EC	On-Demand	Anodyne	CA7	53	38
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450798385	EC	On-Demand	Anodyne	CA5B	53	38
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450798385	EC	On-Demand	Anodyne	CA4	71	44
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450798385	EC	On-Demand	Anodyne	CA5A	57	38
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450798385	EC	On-Demand	Anodyne	CA12	34	42
COCC(COC)Nc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450798385	EC	On-Demand	Anodyne	CA9	37	42
CCc1c(C(=O)Nc2ccc3c(c2)CCN3C(=O)COC)oc2ccccc12	ZINC000450798412	GH	On-Demand	Anodyne	EIF2AK3	20	41
CC(C)N1CCCC[C@H]1CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450798424	EG	On-Demand	Anodyne	CHRNA2	39	40
CC(C)N1CCCC[C@H]1CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450798424	EG	On-Demand	Anodyne	CRTY	0	40
CC(C)N1CCCC[C@@H]1CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450798428	EG	On-Demand	Anodyne	CHRNA2	39	40
CC(C)N1CCCC[C@@H]1CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450798428	EG	On-Demand	Anodyne	CRTY	0	40
COCC(=O)N1CCc2cc(NC(=O)CCCC(=O)C3CC3)ccc21	ZINC000450798432	EE	On-Demand	Anodyne	NOS1	15	45
COCC(=O)N1CCc2cc(NC(=O)CCCC(=O)C3CC3)ccc21	ZINC000450798432	EE	On-Demand	Anodyne	NAMPT	29	45
CC(C)(C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1)C1CCC1	ZINC000450798441	EG	On-Demand	Anodyne	CNR2	0	42
CC[C@@H](CO)N(Cc1ccccc1)C(=O)CCCc1ncc(C)o1	ZINC000450798449	EG	On-Demand	Anodyne	CES1D	43	31
C[C@@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)CC[C@@H]1O	ZINC000450798463	FE	On-Demand	Anodyne	HCRTR1	51	35
C[C@@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)CC[C@@H]1O	ZINC000450798463	FE	On-Demand	Anodyne	HCRTR2	52	35
C[C@@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)CC[C@H]1O	ZINC000450798465	FE	On-Demand	Anodyne	HCRTR1	51	35
C[C@@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)CC[C@H]1O	ZINC000450798465	FE	On-Demand	Anodyne	HCRTR2	52	35
C[C@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)CC[C@@H]1O	ZINC000450798467	FE	On-Demand	Anodyne	HCRTR1	51	35
C[C@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)CC[C@@H]1O	ZINC000450798467	FE	On-Demand	Anodyne	HCRTR2	52	35
C[C@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)CC[C@H]1O	ZINC000450798469	FE	On-Demand	Anodyne	HCRTR1	51	35
C[C@H]1CN(C(=O)c2ccccc2-n2cc(Br)cn2)CC[C@H]1O	ZINC000450798469	FE	On-Demand	Anodyne	HCRTR2	52	35
COc1cccc(-n2cc(C(=O)N3CCC(C)(C(C)C)CC3)nn2)c1	ZINC000450798471	EG	On-Demand	Anodyne	CCKAR	22	42
O=[N+]([O-])c1ccc(-c2csc(N[C@H]3CC34CCOCC4)n2)cc1	ZINC000450798472	EH	On-Demand	Bother	MAOB	0	49
COCC(COC)Nc1ncnc2c1ncn2C1CC1	ZINC000450798474	CD	On-Demand	Anodyne	ADORA1	39	46
O=[N+]([O-])c1ccc(-c2csc(N[C@@H]3CC34CCOCC4)n2)cc1	ZINC000450798475	EH	On-Demand	Bother	MAOB	0	49
Cc1onc(C2CC2)c1C(=O)NCc1ccc(Cl)cc1F	ZINC000450798478	DH	On-Demand	Anodyne	P2RX7	79	47
Cc1onc(C2CC2)c1C(=O)NCc1ccc(Cl)cc1F	ZINC000450798478	DH	On-Demand	Anodyne	BDKRB1	0	40
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC4(CCCC4)C3)cc2)c1	ZINC000450798499	FH	On-Demand	Anodyne	CHRM3	16	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC4(CCCC4)C3)cc2)c1	ZINC000450798499	FH	On-Demand	Anodyne	MMP13	17	46
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC4(CCCC4)C3)cc2)c1	ZINC000450798499	FH	On-Demand	Anodyne	CCKBR	41	34
C=C[C@@H]1OCC[C@H]1C(=O)NCc1cc(F)ccc1OC	ZINC000450798501	CE	On-Demand	Mild	GRIN2B	23	40
COCC(COC)Nc1ncnc2scc(-c3ccccc3)c12	ZINC000450798502	EG	On-Demand	Anodyne	ADRB3	0	43
COc1ccc(F)cc1CNC(=O)c1scnc1C(C)C	ZINC000450798518	DG	On-Demand	Anodyne	PPARD	23	44
COC(=O)[C@]1(C)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450798525	FD	On-Demand	Anodyne	MTNR1A	46	41
COC(=O)[C@]1(C)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450798525	FD	On-Demand	Anodyne	MTNR1B	35	41
COC(=O)[C@@]1(C)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450798526	FD	On-Demand	Anodyne	MTNR1A	46	41
COC(=O)[C@@]1(C)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450798526	FD	On-Demand	Anodyne	MTNR1B	35	41
CC[C@H](CC(F)(F)F)C(=O)NCc1ccc(Br)cc1OC	ZINC000450798535	FI	On-Demand	Anodyne	PPARA	19	45
CC[C@H](CC(F)(F)F)C(=O)NCc1ccc(Br)cc1OC	ZINC000450798535	FI	On-Demand	Anodyne	PPARD	23	43
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccc(Br)cc1OC	ZINC000450798536	FI	On-Demand	Anodyne	PPARA	19	45
CC[C@@H](CC(F)(F)F)C(=O)NCc1ccc(Br)cc1OC	ZINC000450798536	FI	On-Demand	Anodyne	PPARD	23	43
COc1ccc(F)cc1CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450798547	DG	On-Demand	Anodyne	GRIN2B	25	42
COc1ccc(F)cc1CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450798547	DG	On-Demand	Anodyne	PPARD	26	47
COc1ccc(F)cc1CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450798547	DG	On-Demand	Anodyne	MT-ND1	23	40
CN1CC[C@@H]2CN(c3nc(-c4ccccc4)ns3)C[C@@H]21	ZINC000450798557	CE	On-Demand	Anodyne	FAAH	0	47
COc1cc(CC(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)ccc1Cl	ZINC000450798558	FF	On-Demand	Anodyne	CCR1	24	45
CC[C@H](Nc1cc(N2CCC[C@@H](C)C2)ncn1)[C@H](C)O	ZINC000450798590	CE	On-Demand	Anodyne	PRCP	0	49
CC[C@H](Nc1cc(N2CCC[C@H](C)C2)ncn1)[C@H](C)O	ZINC000450798591	CE	On-Demand	Anodyne	PRCP	0	49
CC[C@H](Nc1cc(N2CCC[C@@H](C)C2)ncn1)[C@@H](C)O	ZINC000450798592	CE	On-Demand	Anodyne	PRCP	0	49
CC[C@H](Nc1cc(N2CCC[C@H](C)C2)ncn1)[C@@H](C)O	ZINC000450798593	CE	On-Demand	Anodyne	PRCP	0	49
CS(=O)(=O)C[C@H]1CCCCN1c1ccc(C#N)cn1	ZINC000450798600	CD	On-Demand	Mild	SGPL1	0	41
CS(=O)(=O)C[C@@H]1CCCCN1c1ccc(C#N)cn1	ZINC000450798602	CD	On-Demand	Mild	SGPL1	0	41
Cc1cc(C)nc(N2CCN(C(=O)Cc3scnc3-c3ccccc3)CC2)n1	ZINC000450798608	GG	On-Demand	Anodyne	SORD	24	40
Cc1cc(C)nc(N2CCN(C(=O)Cc3scnc3-c3ccccc3)CC2)n1	ZINC000450798608	GG	On-Demand	Anodyne	SLC6A7	0	44
CCN1C[C@@H](Nc2ncnc3ccc(SC)cc23)CC1=O	ZINC000450798613	DE	On-Demand	Anodyne	CD38	47	37
CCN1C[C@H](Nc2ncnc3ccc(SC)cc23)CC1=O	ZINC000450798614	DE	On-Demand	Anodyne	CD38	47	37
COc1cc(CN2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450798617	CD	On-Demand	Anodyne	DRD4	28	40
COc1cc(CN2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450798617	CD	On-Demand	Anodyne	OPRK1	15	41
COc1cc(CN2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450798617	CD	On-Demand	Anodyne	SIGMAR1	21	44
COc1cc(CN2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450798617	CD	On-Demand	Anodyne	SSTR5	43	36
COc1cc(CN2CCN(C[C@H](C)O)CC2)ccc1Cl	ZINC000450798617	CD	On-Demand	Anodyne	CACNA1G	24	46
CCN1C[C@@H](Nc2ncnc3cc(Br)ccc23)CC1=O	ZINC000450798619	EE	On-Demand	Anodyne	EGFR	62	37
CCN1C[C@H](Nc2ncnc3cc(Br)ccc23)CC1=O	ZINC000450798620	EE	On-Demand	Anodyne	EGFR	62	37
O=C(Cc1cc2ccccc2s1)N1CCC(CCCn2ccnc2)CC1	ZINC000450798624	FI	On-Demand	Anodyne	TBXAS1	50	49
O=C(Cc1cc2ccccc2s1)N1CCC(CCCn2ccnc2)CC1	ZINC000450798624	FI	On-Demand	Anodyne	HMOX1	15	40
O=C(Cc1cc2ccccc2s1)N1CCC(CCCn2ccnc2)CC1	ZINC000450798624	FI	On-Demand	Anodyne	HMOX2	49	40
CC[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)[C@H](C)O	ZINC000450798632	ED	On-Demand	Anodyne	LRRK2	28	42
CC[C@@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)[C@H](C)O	ZINC000450798633	ED	On-Demand	Anodyne	LRRK2	28	42
CC[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)[C@@H](C)O	ZINC000450798634	ED	On-Demand	Anodyne	LRRK2	28	42
CC[C@@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)[C@@H](C)O	ZINC000450798635	ED	On-Demand	Anodyne	LRRK2	28	42
CCc1cccc(C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)n1	ZINC000450798636	EE	On-Demand	Anodyne	PKNB	42	33
C=CCN(C)C(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450798640	DE	On-Demand	Mild	TACR3	58	34
C=CCN(C)C(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450798647	DE	On-Demand	Mild	TACR3	58	34
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nnnn1C	ZINC000450798696	CD	On-Demand	Anodyne	PPARA	17	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nnnn1C	ZINC000450798696	CD	On-Demand	Anodyne	PPARD	21	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCc1nnnn1C	ZINC000450798696	CD	On-Demand	Anodyne	SORT1	15	41
Cc1nc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)cs1	ZINC000450798702	EI	On-Demand	Anodyne	HTR2A	22	42
Cc1nc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)cs1	ZINC000450798702	EI	On-Demand	Anodyne	HTR3B	0	46
Cc1nc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)cs1	ZINC000450798702	EI	On-Demand	Anodyne	CYP2J2	47	35
CCCCn1c(S[C@H](C)C(=O)Nc2nccs2)nc(C)c1C	ZINC000450798703	EH	On-Demand	Anodyne	MAP	0	41
CCCCn1c(S[C@H](C)C(=O)Nc2nccs2)nc(C)c1C	ZINC000450798703	EH	On-Demand	Anodyne	MAP1	85	41
CCCCn1c(S[C@@H](C)C(=O)Nc2nccs2)nc(C)c1C	ZINC000450798704	EH	On-Demand	Anodyne	MAP	0	41
CCCCn1c(S[C@@H](C)C(=O)Nc2nccs2)nc(C)c1C	ZINC000450798704	EH	On-Demand	Anodyne	MAP1	85	41
C[C@H](O)CN1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450798707	DF	On-Demand	Anodyne	MC4R	30	42
C[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@@H](C)N1CCO	ZINC000450798737	DD	On-Demand	Anodyne	PDE3A	43	34
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(F)c1	ZINC000450798738	DE	On-Demand	Anodyne	EPHX2	17	59
CCc1cc(N[C@@H]2CC23CCOCC3)n2ncnc2n1	ZINC000450798739	CD	On-Demand	Anodyne	DHOD	0	45
CCc1cc(N[C@H]2CC23CCOCC3)n2ncnc2n1	ZINC000450798740	CD	On-Demand	Anodyne	DHOD	0	45
CC(C)NS(=O)(=O)c1cccnc1N1C[C@H](C)N(CCO)[C@H](C)C1	ZINC000450798741	FC	On-Demand	Anodyne	SORD	47	31
COc1ccc(-c2ccnc(N3C[C@H](C)N(CCO)[C@H](C)C3)n2)cc1	ZINC000450798744	EE	On-Demand	Anodyne	SORD	57	35
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	DRD4	32	48
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	ACHE	20	45
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	CHRM3	19	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	SIGMAR1	35	55
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	SSTR5	49	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	CCR3	37	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	C3AR1	42	38
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	PDK1	48	36
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	CXCR3	34	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	MCHR1	55	43
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	CACNA1G	21	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@@H](O)C1CCC1	ZINC000450798751	FG	On-Demand	Anodyne	CACNA1I	54	43
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	DRD4	32	48
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	ACHE	20	45
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	CHRM3	19	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	SIGMAR1	35	55
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	SSTR5	49	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	CCR3	37	41
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	C3AR1	42	38
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	PDK1	48	36
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	CXCR3	34	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	MCHR1	55	43
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	CACNA1G	21	40
O=C(NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)[C@H](O)C1CCC1	ZINC000450798752	FG	On-Demand	Anodyne	CACNA1I	54	43
CC(C)CN1CCN(C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)[C@H](C)C1=O	ZINC000450798781	GC	On-Demand	Anodyne	SLC16A1	80	34
CC(C)CN1CCN(C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)[C@@H](C)C1=O	ZINC000450798782	GC	On-Demand	Anodyne	SLC16A1	80	34
C[C@H]1CN(c2ccc3ccccc3n2)C[C@@H](C)N1CCO	ZINC000450798787	CE	On-Demand	Anodyne	HTR3A	33	45
C[C@H]1CN(c2ccc3ccccc3n2)C[C@@H](C)N1CCO	ZINC000450798787	CE	On-Demand	Anodyne	PDE1B	0	47
CNC(=O)c1ccn([C@@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)n1	ZINC000450798793	GG	On-Demand	Anodyne	SLC6A1	53	33
CNC(=O)c1ccn([C@@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)n1	ZINC000450798793	GG	On-Demand	Anodyne	BIRC2	51	33
CNC(=O)c1ccn([C@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)n1	ZINC000450798794	GG	On-Demand	Anodyne	SLC6A1	53	33
CNC(=O)c1ccn([C@H]2CCCN(CCc3c(Cl)cccc3Cl)C2)n1	ZINC000450798794	GG	On-Demand	Anodyne	BIRC2	51	33
COCC(=O)N1CCc2cc(NC(=O)c3ccnn3CC(F)(F)F)ccc21	ZINC000450798802	GE	On-Demand	Anodyne	EIF2AK3	54	36
COc1cc(CN2CCC[C@H]2CN(C(C)=O)C2CC2)ccc1Cl	ZINC000450798815	EG	On-Demand	Anodyne	DRD2	48	42
COc1cc(CN2CCC[C@H]2CN(C(C)=O)C2CC2)ccc1Cl	ZINC000450798815	EG	On-Demand	Anodyne	OPRK1	23	40
COc1cc(CN2CCC[C@H]2CN(C(C)=O)C2CC2)ccc1Cl	ZINC000450798815	EG	On-Demand	Anodyne	MBTPS1	42	33
COc1cc(CN2CCC[C@@H]2CN(C(C)=O)C2CC2)ccc1Cl	ZINC000450798816	EG	On-Demand	Anodyne	DRD2	48	42
COc1cc(CN2CCC[C@@H]2CN(C(C)=O)C2CC2)ccc1Cl	ZINC000450798816	EG	On-Demand	Anodyne	OPRK1	23	40
COc1cc(CN2CCC[C@@H]2CN(C(C)=O)C2CC2)ccc1Cl	ZINC000450798816	EG	On-Demand	Anodyne	MBTPS1	42	33
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](O)[C@@H](C)C1	ZINC000450798835	CD	On-Demand	Anodyne	ACE	48	37
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](O)[C@H](C)C1	ZINC000450798836	CD	On-Demand	Anodyne	ACE	48	37
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](O)[C@@H](C)C1	ZINC000450798837	CD	On-Demand	Anodyne	ACE	48	37
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](O)[C@H](C)C1	ZINC000450798838	CD	On-Demand	Anodyne	ACE	48	37
CCN(C[C@H](O)C(F)(F)F)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450798845	GG	On-Demand	Anodyne	CETP	0	49
CCN(C[C@H](O)C(F)(F)F)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450798845	GG	On-Demand	Anodyne	MTNR1B	19	40
CCN(C[C@@H](O)C(F)(F)F)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450798846	GG	On-Demand	Anodyne	CETP	0	49
CCN(C[C@@H](O)C(F)(F)F)C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450798846	GG	On-Demand	Anodyne	MTNR1B	19	40
CSc1cccc(C(=O)N2CCC(Cn3cncn3)CC2)c1	ZINC000450798851	DF	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CCC(Cn3cncn3)CC2)c1	ZINC000450798851	DF	On-Demand	Anodyne	L3MBTL3	45	32
C[C@H]1CN(c2cnc(-c3ccccc3)cn2)C[C@@H](C)N1CCO	ZINC000450798852	DE	On-Demand	Anodyne	CHRNA7	15	48
COC(=O)c1cccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)c1Cl	ZINC000450798853	GD	On-Demand	Anodyne	DRD4	22	47
COC(=O)c1cccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)c1Cl	ZINC000450798853	GD	On-Demand	Anodyne	SIGMAR1	21	42
COC(=O)c1cccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)c1Cl	ZINC000450798854	GD	On-Demand	Anodyne	DRD4	22	47
COC(=O)c1cccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)c1Cl	ZINC000450798854	GD	On-Demand	Anodyne	SIGMAR1	21	42
CC1(CO)CN(c2ccnc3ccc(Oc4ccccc4)cc23)C1	ZINC000450798860	DH	On-Demand	Anodyne	PDGFRB	20	47
CSc1cccc(C(=O)N2CCN(CC(C)C)C(=O)C2)c1	ZINC000450798868	DE	On-Demand	Anodyne	P2RX7	16	56
CCOC(=O)c1cc(C(=O)N[C@@H]2CCn3ccnc3C2)[nH]c1C	ZINC000450798930	DD	On-Demand	Anodyne	SSTR5	42	36
CCOC(=O)c1cc(NC(COC)COC)ccc1[N+](=O)[O-]	ZINC000450798932	DD	On-Demand	Bother	CACNA1C	46	38
CCC[C@H](OC)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450798936	DF	On-Demand	Anodyne	NPFFR1	48	36
CCC[C@@H](OC)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450798937	DF	On-Demand	Anodyne	NPFFR1	48	36
CCC[C@@H](OC)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000450798938	DF	On-Demand	Anodyne	NPFFR1	48	36
CCC[C@H](OC)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000450798939	DF	On-Demand	Anodyne	NPFFR1	48	36
COCC(COC)Nc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450798947	EE	On-Demand	Anodyne	AVPR2	47	37
CC[C@@H](O)CC(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450798951	DE	On-Demand	Anodyne	SPHK1	40	42
CC[C@H](O)CC(=O)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000450798952	DE	On-Demand	Anodyne	SPHK1	40	42
CCOC(=O)c1cc(C(=O)N[C@H]2CCn3ccnc3C2)[nH]c1C	ZINC000450798953	DD	On-Demand	Anodyne	SSTR5	42	36
O=C(NCc1ccc(Cl)cc1F)C1(CF)CCOCC1	ZINC000450798959	DF	On-Demand	Anodyne	P2RX7	30	40
CN1CC[C@@H]2CN(c3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000450798962	BD	On-Demand	Bother	SSTR1	28	43
Cc1nc([C@@H]2CCCN2C(=O)Cc2cc(Br)ccc2C)cs1	ZINC000450798973	GI	On-Demand	Anodyne	COLA	58	41
Cc1nc([C@@H]2CCCN2C(=O)Cc2cc(Br)ccc2C)cs1	ZINC000450798973	GI	On-Demand	Anodyne	CPT1A	56	41
C[C@@H](O)C[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450798974	CD	On-Demand	Anodyne	ENPP2	20	43
C[C@@H](O)C[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450798974	CD	On-Demand	Anodyne	HPGDS	18	45
C[C@H](O)C[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450798975	CD	On-Demand	Anodyne	ENPP2	20	43
C[C@H](O)C[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450798975	CD	On-Demand	Anodyne	HPGDS	18	45
C[C@H](O)C[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450798976	CD	On-Demand	Anodyne	ENPP2	20	43
C[C@H](O)C[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450798976	CD	On-Demand	Anodyne	HPGDS	18	45
C[C@@H](C[C@@H](C)O)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450798977	CD	On-Demand	Anodyne	ENPP2	20	43
C[C@@H](C[C@@H](C)O)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450798977	CD	On-Demand	Anodyne	HPGDS	18	45
Cc1ccncc1CNc1cc(N2CCOCC2)ncn1	ZINC000450798983	CD	On-Demand	Anodyne	EPHB4	59	35
Cc1ccncc1CNc1cc(N2CCOCC2)ncn1	ZINC000450798983	CD	On-Demand	Anodyne	SMG1	41	35
CC(=O)NC[C@H](CC(=O)NCc1ccc(Cl)cc1F)CC(C)C	ZINC000450798984	EG	On-Demand	Anodyne	P2RX7	46	39
Cc1nc(C)n(CCCC(=O)NCc2ccc(Cl)cc2F)n1	ZINC000450798986	DF	On-Demand	Anodyne	P2RX7	75	43
CN(C)C(=O)c1cnc(N2C[C@@H]3CCN(C)[C@@H]3C2)c(Cl)c1	ZINC000450798988	DD	On-Demand	Anodyne	CXCR3	33	41
CCC(=O)CCCN1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450798992	CD	On-Demand	Anodyne	CACNA1G	24	40
CCC(=O)CCCN1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450798994	CD	On-Demand	Anodyne	CACNA1G	24	40
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ccc(F)cn2)CC1	ZINC000450798995	GG	On-Demand	Anodyne	PTGS2	21	40
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ccc(F)cn2)CC1	ZINC000450798995	GG	On-Demand	Anodyne	GPR119	28	44
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ccc(F)cn2)CC1	ZINC000450798998	GG	On-Demand	Anodyne	PTGS2	21	40
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ccc(F)cn2)CC1	ZINC000450798998	GG	On-Demand	Anodyne	GPR119	28	44
COCC(=O)N1CCc2cc(NC(=O)c3ccc(C)c(Cl)c3Cl)ccc21	ZINC000450799009	GI	On-Demand	Anodyne	AVPR2	93	41
COCC(=O)N1CCc2cc(NC(=O)c3ccc(C)c(Cl)c3Cl)ccc21	ZINC000450799009	GI	On-Demand	Anodyne	AVPR1A	41	38
COc1ccc(-c2csc3ncnc(N4C[C@H](C)N(CCO)[C@H](C)C4)c23)cc1	ZINC000450799011	GG	On-Demand	Anodyne	ADRB2	17	47
COc1ccc(-c2csc3ncnc(N4C[C@H](C)N(CCO)[C@H](C)C4)c23)cc1	ZINC000450799011	GG	On-Demand	Anodyne	ADRB3	30	46
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2C[C@@H](O)C2(C)C)c(F)c1	ZINC000450799020	DC	On-Demand	Anodyne	MAPK13	48	32
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2C[C@H](O)C2(C)C)c(F)c1	ZINC000450799021	DC	On-Demand	Anodyne	MAPK13	48	32
Cc1nnnn1-c1ccc(C(=O)N[C@H]2C[C@@H](O)C2(C)C)c(F)c1	ZINC000450799022	DC	On-Demand	Anodyne	MAPK13	48	32
Cc1nnnn1-c1ccc(C(=O)N[C@H]2C[C@H](O)C2(C)C)c(F)c1	ZINC000450799023	DC	On-Demand	Anodyne	MAPK13	48	32
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450799025	GH	On-Demand	Anodyne	ADRB2	17	45
CS(=O)(=O)C[C@@H]1CCCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450799025	GH	On-Demand	Anodyne	ADRB3	31	46
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450799026	GH	On-Demand	Anodyne	ADRB2	17	45
CS(=O)(=O)C[C@H]1CCCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450799026	GH	On-Demand	Anodyne	ADRB3	31	46
O=C(c1ccc(N2CCC2)nc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450799027	FF	On-Demand	Anodyne	TBXAS1	17	40
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2Cc3cccc(C)c3O2)cs1	ZINC000450799047	EG	On-Demand	Anodyne	COLA	36	41
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2Cc3cccc(C)c3O2)cs1	ZINC000450799048	EG	On-Demand	Anodyne	COLA	36	41
COc1cc(OC)c2ncnc(N3CC(=O)N[C@H](C)C3)c2c1	ZINC000450799049	DC	On-Demand	Anodyne	PDE3A	48	38
COc1cc(OC)c2ncnc(N3CC(=O)N[C@H](C)C3)c2c1	ZINC000450799049	DC	On-Demand	Anodyne	PDE3B	71	38
COc1cc(OC)c2ncnc(N3CC(=O)N[C@@H](C)C3)c2c1	ZINC000450799051	DC	On-Demand	Anodyne	PDE3A	48	38
COc1cc(OC)c2ncnc(N3CC(=O)N[C@@H](C)C3)c2c1	ZINC000450799051	DC	On-Demand	Anodyne	PDE3B	71	38
Cc1ccc2oc(N3CCCC[C@@H]3CS(C)(=O)=O)nc2c1	ZINC000450799054	DF	On-Demand	Anodyne	HTR3A	0	54
Cc1ccc2oc(N3CCCC[C@H]3CS(C)(=O)=O)nc2c1	ZINC000450799056	DF	On-Demand	Anodyne	HTR3A	0	54
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799057	EH	On-Demand	Anodyne	PPIA	16	40
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799057	EH	On-Demand	Anodyne	F10	33	40
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799057	EH	On-Demand	Anodyne	GRM5	15	40
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799057	EH	On-Demand	Anodyne	CSF1R	25	41
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799057	EH	On-Demand	Anodyne	LUCI_LUCLA	30	41
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799057	EH	On-Demand	Anodyne	TAAR1	24	49
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799057	EH	On-Demand	Anodyne	KCNK3	104	42
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799057	EH	On-Demand	Anodyne	KCNK9	72	42
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799058	EH	On-Demand	Anodyne	PPIA	16	40
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799058	EH	On-Demand	Anodyne	F10	33	40
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799058	EH	On-Demand	Anodyne	GRM5	15	40
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799058	EH	On-Demand	Anodyne	CSF1R	25	41
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799058	EH	On-Demand	Anodyne	LUCI_LUCLA	30	41
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799058	EH	On-Demand	Anodyne	TAAR1	24	49
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799058	EH	On-Demand	Anodyne	KCNK3	104	42
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@@H](C)O	ZINC000450799058	EH	On-Demand	Anodyne	KCNK9	72	42
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799059	EH	On-Demand	Anodyne	PPIA	16	40
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799059	EH	On-Demand	Anodyne	F10	33	40
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799059	EH	On-Demand	Anodyne	GRM5	15	40
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799059	EH	On-Demand	Anodyne	CSF1R	25	41
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799059	EH	On-Demand	Anodyne	LUCI_LUCLA	30	41
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799059	EH	On-Demand	Anodyne	TAAR1	24	49
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799059	EH	On-Demand	Anodyne	KCNK3	104	42
CC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799059	EH	On-Demand	Anodyne	KCNK9	72	42
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799060	EH	On-Demand	Anodyne	PPIA	16	40
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799060	EH	On-Demand	Anodyne	F10	33	40
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799060	EH	On-Demand	Anodyne	GRM5	15	40
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799060	EH	On-Demand	Anodyne	CSF1R	25	41
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799060	EH	On-Demand	Anodyne	LUCI_LUCLA	30	41
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799060	EH	On-Demand	Anodyne	TAAR1	24	49
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799060	EH	On-Demand	Anodyne	KCNK3	104	42
CC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)[C@H](C)O	ZINC000450799060	EH	On-Demand	Anodyne	KCNK9	72	42
CCCc1cc(NCc2cnccc2C)n2ncnc2n1	ZINC000450799066	CE	On-Demand	Anodyne	DHOD	0	45
CCn1c(SC[C@H]2C[C@H]3CC[C@H]2O3)nc2ccsc2c1=O	ZINC000450799068	DG	On-Demand	Anodyne	PDE7A	18	46
CCn1c(SC[C@@H]2C[C@H]3CC[C@H]2O3)nc2ccsc2c1=O	ZINC000450799070	DG	On-Demand	Anodyne	PDE7A	18	46
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCc1ccc(Cl)cc1F	ZINC000450799073	CH	On-Demand	Anodyne	P2RX7	62	38
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCc1ccc(Cl)cc1F	ZINC000450799073	CH	On-Demand	Anodyne	CXCR3	15	41
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCc1ccc(Cl)cc1F	ZINC000450799074	CH	On-Demand	Anodyne	P2RX7	62	38
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCc1ccc(Cl)cc1F	ZINC000450799074	CH	On-Demand	Anodyne	CXCR3	15	41
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1ccc(Cl)cc1F	ZINC000450799075	CH	On-Demand	Anodyne	P2RX7	50	36
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1ccc(Cl)cc1F	ZINC000450799075	CH	On-Demand	Anodyne	CXCR3	15	41
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCc1ccc(Cl)cc1F	ZINC000450799076	CH	On-Demand	Anodyne	P2RX7	50	36
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCc1ccc(Cl)cc1F	ZINC000450799076	CH	On-Demand	Anodyne	CXCR3	15	41
CC(=O)c1cccc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)c1	ZINC000450799081	DF	On-Demand	Anodyne	CDK2	0	41
CC(=O)c1cccc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)c1	ZINC000450799081	DF	On-Demand	Anodyne	PROTEASE	0	41
CC(=O)c1cccc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)c1	ZINC000450799081	DF	On-Demand	Anodyne	PKNB	41	32
C=CCOc1ccc(CC(=O)Nc2sc(CC)nc2C)cc1	ZINC000450799086	DH	On-Demand	Mild	MAPK9	0	42
C=CCOc1ccc(CC(=O)Nc2sc(CC)nc2C)cc1	ZINC000450799086	DH	On-Demand	Mild	MAPK10	0	45
COc1ccc(F)cc1CNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450799106	GG	On-Demand	Anodyne	P2RX7	50	38
COc1ccc(F)cc1CNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450799106	GG	On-Demand	Anodyne	PDE4B	17	42
COc1ccc(F)cc1CNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450799106	GG	On-Demand	Anodyne	PDE4D	28	44
COc1ccc(F)cc1CNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450799106	GG	On-Demand	Anodyne	PDEC	0	45
COc1ccc(F)cc1CNC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450799106	GG	On-Demand	Anodyne	ACKR3	40	32
CN1CC[C@@H]2CN(c3nc(-c4cccc(Cl)c4)no3)C[C@@H]21	ZINC000450799108	DF	On-Demand	Anodyne	GRM5	27	45
COc1ccc(Cn2ccc(NC(=O)CCCc3ncc(C)o3)n2)cc1	ZINC000450799125	FF	On-Demand	Anodyne	HDAC7	29	41
CC(C)c1nccc(N2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)n1	ZINC000450799127	DG	On-Demand	Anodyne	SORD	44	33
Cc1ccncc1CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450799131	ED	On-Demand	Anodyne	NPY2R	45	36
CN(CCN(C)[C@@H]1CCCC[C@H]1O)Cc1ccccc1	ZINC000450799139	CE	On-Demand	Anodyne	AMY2	44	32
COc1ccc(F)cc1CNC(=O)CC1(O)CCC1	ZINC000450799145	CD	On-Demand	Anodyne	ENPP1	47	31
COc1ccc(F)cc1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450799146	CG	On-Demand	Anodyne	PPARA	15	42
COc1ccc(F)cc1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450799146	CG	On-Demand	Anodyne	GRIN2B	33	43
COc1ccc(F)cc1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450799146	CG	On-Demand	Anodyne	P2RX7	43	38
COc1ccc(F)cc1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450799146	CG	On-Demand	Anodyne	PPARD	22	42
COc1ccc(F)cc1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450799146	CG	On-Demand	Anodyne	MT-ND1	24	44
COc1ccc(F)cc1CNC(=O)C(C)(C)C(C)(F)F	ZINC000450799146	CG	On-Demand	Anodyne	CARM1	16	41
CN1CC[C@@H]2CN(c3ccnc4cc(Cl)ccc34)C[C@@H]21	ZINC000450799149	CG	On-Demand	Anodyne	HRP1_PLAFA	94	36
CN1CC[C@@H]2CN(c3ccnc4cc(Cl)ccc34)C[C@@H]21	ZINC000450799149	CG	On-Demand	Anodyne	HNMT	53	37
CC(=O)c1ccc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)cc1	ZINC000450799150	DF	On-Demand	Anodyne	CDK2	0	42
COc1ccc(F)cc1CNC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450799152	DG	On-Demand	Anodyne	GRIN2B	24	42
COc1ccc(F)cc1CNC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450799152	DG	On-Demand	Anodyne	P2RX7	37	44
COc1ccc(F)cc1CNC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450799152	DG	On-Demand	Anodyne	KCNA3	44	38
CCc1nc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)s1	ZINC000450799153	DG	On-Demand	Anodyne	ANPEP	41	32
CCc1nc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)s1	ZINC000450799153	DG	On-Demand	Anodyne	PAPA1_CARPA	42	33
CCc1nc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)s1	ZINC000450799153	DG	On-Demand	Anodyne	ACE2	47	36
CCc1nc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)s1	ZINC000450799153	DG	On-Demand	Anodyne	GPR142	59	32
CCc1nc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)s1	ZINC000450799154	DG	On-Demand	Anodyne	ANPEP	41	32
CCc1nc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)s1	ZINC000450799154	DG	On-Demand	Anodyne	PAPA1_CARPA	42	33
CCc1nc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)s1	ZINC000450799154	DG	On-Demand	Anodyne	ACE2	47	36
CCc1nc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)s1	ZINC000450799154	DG	On-Demand	Anodyne	GPR142	59	32
Cc1ccc2ncnc(N3C[C@H]4CCN(C)[C@H]4C3)c2c1	ZINC000450799155	CE	On-Demand	Anodyne	PDE3B	70	36
C=CCN(C)C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450799159	CD	On-Demand	Mild	LIMK2	40	42
CCS(=O)(=O)c1ccc(CN2CCC(Cn3cncn3)CC2)cc1	ZINC000450799160	ED	On-Demand	Anodyne	ACHE	15	40
COCC[C@H](Nc1ccc(S(C)(=O)=O)cc1)c1cccc(C(F)(F)F)c1	ZINC000450799161	GI	On-Demand	Anodyne	PTGS2	19	40
COCC[C@@H](Nc1ccc(S(C)(=O)=O)cc1)c1cccc(C(F)(F)F)c1	ZINC000450799162	GI	On-Demand	Anodyne	PTGS2	19	40
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450799172	EF	On-Demand	Anodyne	P2RY12	45	38
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450799172	EF	On-Demand	Anodyne	ENPP2	19	40
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450799172	EF	On-Demand	Anodyne	HPGDS	15	41
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450799173	EF	On-Demand	Anodyne	P2RY12	45	38
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450799173	EF	On-Demand	Anodyne	ENPP2	19	40
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450799173	EF	On-Demand	Anodyne	HPGDS	15	41
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN([C@H](C)CC(C)C)CC2	ZINC000450799178	EI	On-Demand	Anodyne	CCR5	16	43
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN([C@@H](C)CC(C)C)CC2	ZINC000450799179	EI	On-Demand	Anodyne	CCR5	16	43
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN([C@@H](C)CC(C)C)CC2	ZINC000450799180	EI	On-Demand	Anodyne	CCR5	16	43
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN([C@H](C)CC(C)C)CC2	ZINC000450799181	EI	On-Demand	Anodyne	CCR5	16	43
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450799182	CF	On-Demand	Anodyne	ACE	56	38
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450799182	CF	On-Demand	Anodyne	XIAP	29	42
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450799182	CF	On-Demand	Anodyne	BRCA1	61	33
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450799183	CF	On-Demand	Anodyne	ACE	56	38
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450799183	CF	On-Demand	Anodyne	XIAP	29	42
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450799183	CF	On-Demand	Anodyne	BRCA1	61	33
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450799184	CF	On-Demand	Anodyne	ACE	56	38
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450799184	CF	On-Demand	Anodyne	XIAP	29	42
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450799184	CF	On-Demand	Anodyne	BRCA1	61	33
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450799185	CF	On-Demand	Anodyne	ACE	56	38
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450799185	CF	On-Demand	Anodyne	XIAP	29	42
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450799185	CF	On-Demand	Anodyne	BRCA1	61	33
CC(F)(F)CCn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O	ZINC000450799186	EF	On-Demand	Bother	Q9M629_MAIZE	53	31
O[C@@H]1CC[C@@H]2CN(c3ccc4ccccc4n3)CC[C@H]2C1	ZINC000450799192	CG	On-Demand	Anodyne	PDE1B	0	43
O[C@@H]1CC[C@@H]2CN(c3ccc4ccccc4n3)CC[C@@H]2C1	ZINC000450799193	CG	On-Demand	Anodyne	PDE1B	0	43
O[C@@H]1CC[C@H]2CN(c3ccc4ccccc4n3)CC[C@H]2C1	ZINC000450799194	CG	On-Demand	Anodyne	PDE1B	0	43
O[C@@H]1CC[C@H]2CN(c3ccc4ccccc4n3)CC[C@@H]2C1	ZINC000450799195	CG	On-Demand	Anodyne	PDE1B	0	43
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1	ZINC000450799201	EH	On-Demand	Bother	LIPG	56	37
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]2C[C@H](O)CC[C@@H]2C1	ZINC000450799202	EH	On-Demand	Bother	LIPG	56	37
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]2C[C@H](O)CC[C@H]2C1	ZINC000450799203	EH	On-Demand	Bother	LIPG	56	37
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1	ZINC000450799204	EH	On-Demand	Bother	LIPG	56	37
COCC[C@H](Nc1cc(C)nc2ncnn12)c1cccc(C(F)(F)F)c1	ZINC000450799208	FH	On-Demand	Anodyne	DHOD	0	45
COCC[C@@H](Nc1cc(C)nc2ncnn12)c1cccc(C(F)(F)F)c1	ZINC000450799209	FH	On-Demand	Anodyne	DHOD	0	45
C[C@H]1CN(c2ccc(S(C)(=O)=O)cc2F)C[C@@H](C)N1CCO	ZINC000450799216	ED	On-Demand	Anodyne	SLC6A9	24	45
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799221	FG	On-Demand	Anodyne	ERBB2	26	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799221	FG	On-Demand	Anodyne	TACR1	28	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799221	FG	On-Demand	Anodyne	ADAM10	29	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799221	FG	On-Demand	Anodyne	SFRP1	44	31
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799221	FG	On-Demand	Anodyne	WNT3	43	31
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799223	FG	On-Demand	Anodyne	ERBB2	26	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799223	FG	On-Demand	Anodyne	TACR1	28	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799223	FG	On-Demand	Anodyne	ADAM10	29	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799223	FG	On-Demand	Anodyne	SFRP1	44	31
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450799223	FG	On-Demand	Anodyne	WNT3	43	31
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799224	FG	On-Demand	Anodyne	ERBB2	26	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799224	FG	On-Demand	Anodyne	TACR1	28	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799224	FG	On-Demand	Anodyne	ADAM10	29	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799224	FG	On-Demand	Anodyne	SFRP1	44	31
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799224	FG	On-Demand	Anodyne	WNT3	43	31
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799226	FG	On-Demand	Anodyne	ERBB2	26	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799226	FG	On-Demand	Anodyne	TACR1	28	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799226	FG	On-Demand	Anodyne	ADAM10	29	41
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799226	FG	On-Demand	Anodyne	SFRP1	44	31
O=C(NCC(F)(F)F)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450799226	FG	On-Demand	Anodyne	WNT3	43	31
Ic1ccc2ncnc(N[C@@H]3CC34CCOCC4)c2c1	ZINC000450799228	GG	On-Demand	Anodyne	CD38	51	42
Ic1ccc2ncnc(N[C@H]3CC34CCOCC4)c2c1	ZINC000450799229	GG	On-Demand	Anodyne	CD38	51	42
Cc1cc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)nn1C(C)C	ZINC000450799232	FF	On-Demand	Anodyne	PTGER1	15	40
Cc1cc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)nn1C(C)C	ZINC000450799232	FF	On-Demand	Anodyne	NPY2R	69	35
Cc1cc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)ncc1C(N)=O	ZINC000450799233	FE	On-Demand	Anodyne	NPFFR1	50	36
Cc1cc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)ncc1C(N)=O	ZINC000450799233	FE	On-Demand	Anodyne	HCN1	56	32
Cc1cc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)ncc1C(N)=O	ZINC000450799233	FE	On-Demand	Anodyne	HCN4	48	31
Cc1nc2ccnn2cc1C(=O)NCCCCCc1ccc(F)cc1	ZINC000450799234	EG	On-Demand	Anodyne	DDR1	51	38
Cc1cc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)ncc1C(N)=O	ZINC000450799235	FE	On-Demand	Anodyne	NPFFR1	50	36
Cc1cc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)ncc1C(N)=O	ZINC000450799235	FE	On-Demand	Anodyne	HCN1	56	32
Cc1cc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)ncc1C(N)=O	ZINC000450799235	FE	On-Demand	Anodyne	HCN4	48	31
CCOC[C@H](C)NC(=O)c1cc(Br)c(F)cc1O	ZINC000450799237	DE	On-Demand	Anodyne	SDH1	0	45
CC(C)(C)CCC1(O)CC(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)C1	ZINC000450799238	GE	On-Demand	Anodyne	F2R	0	40
CC(C)(C)CCC1(O)CC(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)C1	ZINC000450799239	GE	On-Demand	Anodyne	F2R	0	40
C[C@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H](C)N1CCO	ZINC000450799241	FD	On-Demand	Anodyne	SCD1	55	47
C[C@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@@H](C)N1CCO	ZINC000450799241	FD	On-Demand	Anodyne	SCD	45	47
C[C@H]1CN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@@H](C)N1CCO	ZINC000450799246	FD	On-Demand	Anodyne	PDS	49	33
COc1cccc(OCCC(=O)NC[C@H](SC)C(C)(C)C)c1	ZINC000450799281	EG	On-Demand	Anodyne	MTNR1A	49	50
COc1cccc(OCCC(=O)NC[C@H](SC)C(C)(C)C)c1	ZINC000450799281	EG	On-Demand	Anodyne	PDS	71	34
COc1cccc(OCCC(=O)NC[C@@H](SC)C(C)(C)C)c1	ZINC000450799292	EG	On-Demand	Anodyne	MTNR1A	49	50
COc1cccc(OCCC(=O)NC[C@@H](SC)C(C)(C)C)c1	ZINC000450799292	EG	On-Demand	Anodyne	PDS	71	34
Cc1cc(C)c(C(=O)N2CC[C@@H](O)[C@H](C)C2)cc1Br	ZINC000450799298	EF	On-Demand	Anodyne	L3MBTL3	19	45
Cc1cc(C)c(C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1Br	ZINC000450799300	EF	On-Demand	Anodyne	L3MBTL3	19	45
Cc1cc(C)c(C(=O)N2CC[C@H](O)[C@H](C)C2)cc1Br	ZINC000450799302	EF	On-Demand	Anodyne	L3MBTL3	19	45
Cc1cc(C)c(C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1Br	ZINC000450799305	EF	On-Demand	Anodyne	L3MBTL3	19	45
Cn1c(CNC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)nc2cc(Cl)ccc21	ZINC000450799331	FH	On-Demand	Anodyne	MDM2	41	32
COc1cccc2c(N3C[C@H](C)N(CCO)[C@H](C)C3)nccc12	ZINC000450799337	DE	On-Demand	Anodyne	PDE3B	40	34
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC[C@H]1O	ZINC000450799338	EF	On-Demand	Anodyne	PRCP	16	44
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC[C@@H]1O	ZINC000450799341	EF	On-Demand	Anodyne	PRCP	16	44
COC(=O)[C@@H](NC(=O)Cc1cn(C)nc1C)c1ccc(Cl)cc1Cl	ZINC000450799350	FF	On-Demand	Anodyne	DPP8	40	33
COC(=O)[C@H](NC(=O)Cc1cn(C)nc1C)c1ccc(Cl)cc1Cl	ZINC000450799352	FF	On-Demand	Anodyne	DPP8	40	33
CC(=O)c1cn(CC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)nn1	ZINC000450799364	FD	On-Demand	Anodyne	NPFFR1	55	40
CC(=O)c1cn(CC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)nn1	ZINC000450799366	FD	On-Demand	Anodyne	NPFFR1	55	40
CCOCc1nc(C)c(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)s1	ZINC000450799370	GH	On-Demand	Anodyne	SCD1	39	44
CCOCc1nc(C)c(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)s1	ZINC000450799370	GH	On-Demand	Anodyne	SCD	33	42
C[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[C@@H]1O	ZINC000450799373	EE	On-Demand	Bother	PPXII	0	41
CCOCc1nc(C)c(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)s1	ZINC000450799374	GH	On-Demand	Anodyne	SCD1	39	44
CCOCc1nc(C)c(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)s1	ZINC000450799374	GH	On-Demand	Anodyne	SCD	33	42
C[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[C@H]1O	ZINC000450799375	EE	On-Demand	Bother	PPXII	0	41
C[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[C@H]1O	ZINC000450799378	EE	On-Demand	Bother	PPXII	0	41
C[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[C@@H]1O	ZINC000450799380	EE	On-Demand	Bother	PPXII	0	41
CCOC[C@H](C)NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450799385	EG	On-Demand	Anodyne	ACACB	47	40
C[C@H]1CN(c2cncc(Br)c2)C[C@@H](C)N1CCO	ZINC000450799386	DD	On-Demand	Anodyne	CHRNA4	28	50
C[C@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799394	GE	On-Demand	Anodyne	CYP2D6	15	42
C[C@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799394	GE	On-Demand	Anodyne	TRPC6	52	33
C[C@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799394	GE	On-Demand	Anodyne	TRPC3	52	33
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799396	GE	On-Demand	Anodyne	CYP2D6	15	42
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799396	GE	On-Demand	Anodyne	TRPC6	52	33
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799396	GE	On-Demand	Anodyne	TRPC3	52	33
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799399	GE	On-Demand	Anodyne	CYP2D6	15	42
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799399	GE	On-Demand	Anodyne	TRPC6	52	33
C[C@@H]1C(=O)N(C)CCN1C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799399	GE	On-Demand	Anodyne	TRPC3	52	33
C[C@H]1C(=O)N(C)CCN1C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799401	GE	On-Demand	Anodyne	CYP2D6	15	42
C[C@H]1C(=O)N(C)CCN1C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799401	GE	On-Demand	Anodyne	TRPC6	52	33
C[C@H]1C(=O)N(C)CCN1C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450799401	GE	On-Demand	Anodyne	TRPC3	52	33
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	FKBP1A	23	49
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	MMP13	49	45
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	CCR4	0	45
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	ADAM17	45	39
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	ITGA4	42	43
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	CAPNS1	23	46
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	MMP2	22	40
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	MMP3	50	45
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	MMP8	30	41
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	CAPN1	19	50
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	MMP9	30	41
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	MMP7	60	45
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	MMP1	56	48
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	SFRP1	96	41
C[C@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799411	FD	On-Demand	Anodyne	WNT3	72	41
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	FKBP1A	23	49
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	MMP13	49	45
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	CCR4	0	45
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	ADAM17	45	39
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	ITGA4	42	43
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	CAPNS1	23	46
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	MMP2	22	40
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	MMP3	50	45
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	MMP8	30	41
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	CAPN1	19	50
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	MMP9	30	41
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	MMP7	60	45
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	MMP1	56	48
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	SFRP1	96	41
C[C@@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799412	FD	On-Demand	Anodyne	WNT3	72	41
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	FKBP1A	23	49
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	MMP13	49	45
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	CCR4	0	45
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	ADAM17	45	39
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	ITGA4	42	43
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	CAPNS1	23	46
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	MMP2	22	40
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	MMP3	50	45
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	MMP8	30	41
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	CAPN1	19	50
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	MMP9	30	41
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	MMP7	60	45
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	MMP1	56	48
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	SFRP1	96	41
C[C@@H]1[C@@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799413	FD	On-Demand	Anodyne	WNT3	72	41
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	FKBP1A	23	49
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	MMP13	49	45
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	CCR4	0	45
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	ADAM17	45	39
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	ITGA4	42	43
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	CAPNS1	23	46
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	MMP2	22	40
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	MMP3	50	45
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	MMP8	30	41
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	CAPN1	19	50
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	MMP9	30	41
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	MMP7	60	45
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	MMP1	56	48
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	SFRP1	96	41
C[C@H]1[C@H](NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CCCN1C	ZINC000450799414	FD	On-Demand	Anodyne	WNT3	72	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1CC12CCOCC2	ZINC000450799416	ED	On-Demand	Anodyne	CA2	26	43
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H]1CC12CCOCC2	ZINC000450799417	ED	On-Demand	Anodyne	CA2	26	43
COc1ccc2c(N3C[C@H](C4CC4)[C@H]3C3CC3)ncnc2c1F	ZINC000450799436	DG	On-Demand	Anodyne	PDE3B	42	32
COc1ccc2c(N3C[C@H](C4CC4)[C@@H]3C3CC3)ncnc2c1F	ZINC000450799437	DG	On-Demand	Anodyne	PDE3B	42	32
COc1ccc2c(N3C[C@@H](C4CC4)[C@@H]3C3CC3)ncnc2c1F	ZINC000450799438	DG	On-Demand	Anodyne	PDE3B	42	32
COc1ccc2c(N3C[C@@H](C4CC4)[C@H]3C3CC3)ncnc2c1F	ZINC000450799439	DG	On-Demand	Anodyne	PDE3B	42	32
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1OC	ZINC000450799447	GD	On-Demand	Anodyne	ACKR3	47	34
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1OC	ZINC000450799448	GD	On-Demand	Anodyne	ACKR3	47	34
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1OC	ZINC000450799449	GD	On-Demand	Anodyne	ACKR3	47	34
COc1ccc(C[C@@](C)(NC(C)=O)C(=O)N[C@H]2CCCN(C)[C@H]2C)cc1OC	ZINC000450799450	GD	On-Demand	Anodyne	ACKR3	47	34
COc1cc(CC(=O)N2CCN(CC(C)C)C(=O)[C@H]2C)ccc1O	ZINC000450799451	ED	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N2CCN(CC(C)C)C(=O)[C@@H]2C)ccc1O	ZINC000450799452	ED	On-Demand	Anodyne	TRPV1	0	40
COC[C@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450799457	FH	On-Demand	Anodyne	MMP13	19	42
COC[C@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450799457	FH	On-Demand	Anodyne	MMP2	18	44
COC[C@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450799457	FH	On-Demand	Anodyne	MMP14	17	44
COC[C@@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450799458	FH	On-Demand	Anodyne	MMP13	19	42
COC[C@@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450799458	FH	On-Demand	Anodyne	MMP2	18	44
COC[C@@]1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)CCOC1	ZINC000450799458	FH	On-Demand	Anodyne	MMP14	17	44
COc1cccc(OCCC(=O)N[C@H]2CCCN(Cc3nccn3C)C2=O)c1	ZINC000450799486	GD	On-Demand	Anodyne	F10	22	40
COc1cccc(OCCC(=O)N[C@@H]2CCCN(Cc3nccn3C)C2=O)c1	ZINC000450799489	GD	On-Demand	Anodyne	F10	22	40
FC(F)(F)c1nc2ccccc2n1CC[C@H]1CCOC1	ZINC000450799505	CG	On-Demand	Anodyne	HRH1	16	40
FC(F)(F)c1nc2ccccc2n1CC[C@@H]1CCOC1	ZINC000450799507	CG	On-Demand	Anodyne	HRH1	16	40
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450799521	FH	On-Demand	Bother	TAAR1	21	51
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450799521	FH	On-Demand	Bother	KLF10	0	40
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450799525	FH	On-Demand	Bother	TAAR1	21	51
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450799525	FH	On-Demand	Bother	KLF10	0	40
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450799526	FH	On-Demand	Bother	TAAR1	21	51
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450799526	FH	On-Demand	Bother	KLF10	0	40
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450799527	FH	On-Demand	Bother	TAAR1	21	51
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450799527	FH	On-Demand	Bother	KLF10	0	40
Cc1ccncc1CNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450799543	DG	On-Demand	Anodyne	BDKRB1	22	42
Cc1ccncc1CNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450799543	DG	On-Demand	Anodyne	L3MBTL3	40	31
Cc1ccncc1CNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450799543	DG	On-Demand	Anodyne	TRPC6	40	35
Cc1ccncc1CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450799563	GD	On-Demand	Bother	BDKRB1	0	45
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450799590	ED	On-Demand	Bother	BCL2L1	74	37
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450799590	ED	On-Demand	Bother	BCL2	41	31
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450799591	ED	On-Demand	Bother	BCL2L1	74	37
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450799591	ED	On-Demand	Bother	BCL2	41	31
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450799592	ED	On-Demand	Bother	BCL2L1	74	37
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450799592	ED	On-Demand	Bother	BCL2	41	31
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450799593	ED	On-Demand	Bother	BCL2L1	74	37
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450799593	ED	On-Demand	Bother	BCL2	41	31
CN1CC[C@@H]2CN(c3cc(C(=O)NC4CC4)c4ccccc4n3)C[C@@H]21	ZINC000450799602	EE	On-Demand	Anodyne	HTR3A	44	37
CN1CC[C@@H]2CN(c3cc(C(=O)NC4CC4)c4ccccc4n3)C[C@@H]21	ZINC000450799602	EE	On-Demand	Anodyne	ACACA	27	43
CN1CC[C@@H]2CN(c3cc(C(=O)NC4CC4)c4ccccc4n3)C[C@@H]21	ZINC000450799602	EE	On-Demand	Anodyne	ACACB	23	44
O=C(Nc1cnc2c(c1)CCCC2)c1c(Cl)cc(F)cc1Br	ZINC000450799611	GJ	On-Demand	Anodyne	TYK2	43	30
C=C[C@@H]1OCCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450799615	GD	On-Demand	Mild	BDKRB1	0	40
C=C[C@@H]1OCCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450799615	GD	On-Demand	Mild	BCL2L1	84	34
C=C[C@@H]1OCCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450799615	GD	On-Demand	Mild	BCL2	70	33
C=C[C@@H]1OCCC[C@H]1Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450799615	GD	On-Demand	Mild	BCL2L2	43	29
Clc1ccc(CCN2CCN(c3cncc4ncnn34)CC2)cc1	ZINC000450799619	EE	On-Demand	Anodyne	ABCB1A	45	31
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(Cc1cccc(Cl)c1)CC2	ZINC000450799620	GJ	On-Demand	Anodyne	CHRM3	15	41
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(Cc1cccc(Cl)c1)CC2	ZINC000450799620	GJ	On-Demand	Anodyne	SIGMAR1	21	42
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(Cc1cccc(Cl)c1)CC2	ZINC000450799621	GJ	On-Demand	Anodyne	CHRM3	15	41
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(Cc1cccc(Cl)c1)CC2	ZINC000450799621	GJ	On-Demand	Anodyne	SIGMAR1	21	42
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450799639	GF	On-Demand	Bother	CACNA1C	61	40
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450799639	GF	On-Demand	Bother	CACNA1D	89	40
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450799641	GF	On-Demand	Bother	CACNA1C	61	40
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450799641	GF	On-Demand	Bother	CACNA1D	89	40
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450799642	GF	On-Demand	Bother	CACNA1C	61	40
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450799642	GF	On-Demand	Bother	CACNA1D	89	40
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450799643	GF	On-Demand	Bother	CACNA1C	61	40
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450799643	GF	On-Demand	Bother	CACNA1D	89	40
CCOC(=O)c1cc(NC(=O)[C@@H]2CCC(=O)N2C)ccc1Sc1ccccc1	ZINC000450799652	GH	On-Demand	Anodyne	P2RX7	18	42
CCOC(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)nc1	ZINC000450799653	ED	On-Demand	Anodyne	SSTR5	41	33
CCOC(=O)c1cc(NC(=O)[C@H]2CCC(=O)N2C)ccc1Sc1ccccc1	ZINC000450799656	GH	On-Demand	Anodyne	P2RX7	18	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	ADORA1	137	61
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	SLC29A1	132	59
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	ADORA2A	48	56
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	ADORA2B	45	53
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	DNMT1	23	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	ADK	54	56
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	LOC100912604	0	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	AHCY	58	41
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	CDA	44	35
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	P2RX1	44	38
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	P2RY1	29	41
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	P2RY11	0	41
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	SMS	0	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	AMD1	22	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	SRM	0	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	IARS	0	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	ITPR1	53	38
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	NS5B	0	46
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	ADORA3	100	56
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	OXGR1	119	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	MTAP	0	44
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	AK	0	49
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	SETD7	0	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	PRMT1	0	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	RNASE1	43	34
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	DNMT3B	68	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	NADK	0	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	Q4VQ11_PIG	76	53
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	KMT2A	0	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	DOT1L	89	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	SUV39H1	0	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	METJ	0	44
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	SMYD2	0	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	EZH1	0	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	KMT5C	0	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	SETDB1	0	42
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	SETD2	0	40
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450799717	GC	On-Demand	Anodyne	DNPH1	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	ADORA1	137	61
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	SLC29A1	132	59
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	ADORA2A	48	56
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	ADORA2B	45	53
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	DNMT1	23	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	ADK	54	56
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	LOC100912604	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	AHCY	58	41
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	CDA	44	35
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	P2RX1	44	38
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	P2RY1	29	41
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	P2RY11	0	41
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	SMS	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	AMD1	22	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	SRM	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	IARS	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	ITPR1	53	38
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	NS5B	0	46
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	ADORA3	100	56
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	OXGR1	119	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	MTAP	0	44
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	AK	0	49
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	SETD7	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	PRMT1	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	RNASE1	43	34
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	DNMT3B	68	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	NADK	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	Q4VQ11_PIG	76	53
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	KMT2A	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	DOT1L	89	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	SUV39H1	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	METJ	0	44
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	SMYD2	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	EZH1	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	KMT5C	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	SETDB1	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	SETD2	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799721	GC	On-Demand	Anodyne	DNPH1	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	ADORA1	137	61
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	SLC29A1	132	59
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	ADORA2A	48	56
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	ADORA2B	45	53
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	DNMT1	23	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	ADK	54	56
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	LOC100912604	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	AHCY	58	41
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	CDA	44	35
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	P2RX1	44	38
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	P2RY1	29	41
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	P2RY11	0	41
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	SMS	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	AMD1	22	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	SRM	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	IARS	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	ITPR1	53	38
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	NS5B	0	46
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	ADORA3	100	56
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	OXGR1	119	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	MTAP	0	44
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	AK	0	49
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	SETD7	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	PRMT1	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	RNASE1	43	34
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	DNMT3B	68	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	NADK	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	Q4VQ11_PIG	76	53
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	KMT2A	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	DOT1L	89	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	SUV39H1	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	METJ	0	44
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	SMYD2	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	EZH1	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	KMT5C	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	SETDB1	0	42
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	SETD2	0	40
CC(C)[C@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]1C(C)C	ZINC000450799722	GC	On-Demand	Anodyne	DNPH1	0	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	ADORA1	137	61
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	SLC29A1	132	59
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	ADORA2A	48	56
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	ADORA2B	45	53
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	DNMT1	23	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	ADK	54	56
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	LOC100912604	0	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	AHCY	58	41
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	CDA	44	35
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	P2RX1	44	38
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	P2RY1	29	41
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	P2RY11	0	41
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	SMS	0	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	AMD1	22	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	SRM	0	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	IARS	0	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	ITPR1	53	38
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	NS5B	0	46
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	ADORA3	100	56
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	OXGR1	119	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	MTAP	0	44
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	AK	0	49
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	SETD7	0	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	PRMT1	0	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	RNASE1	43	34
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	DNMT3B	68	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	NADK	0	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	Q4VQ11_PIG	76	53
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	KMT2A	0	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	DOT1L	89	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	SUV39H1	0	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	METJ	0	44
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	SMYD2	0	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	EZH1	0	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	KMT5C	0	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	SETDB1	0	42
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	SETD2	0	40
CC(C)[C@@H]1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@@H]1C(C)C	ZINC000450799724	GC	On-Demand	Anodyne	DNPH1	0	40
COc1ccc(-c2noc(CSc3nnc4cc(C)nc(C)n34)n2)nn1	ZINC000450799733	FD	On-Demand	Anodyne	WNT3A	22	43
COc1ccc(-c2noc(CSc3nnc4cc(C)nc(C)n34)n2)nn1	ZINC000450799733	FD	On-Demand	Anodyne	AXIN2	0	45
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncc(F)cn2)CC1	ZINC000450799740	GF	On-Demand	Anodyne	GPR119	26	41
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncc(F)cn2)CC1	ZINC000450799741	GF	On-Demand	Anodyne	GPR119	26	41
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450799750	EH	On-Demand	Anodyne	LMCPB	0	44
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450799750	EH	On-Demand	Anodyne	XIAP	22	40
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450799761	EH	On-Demand	Anodyne	LMCPB	0	44
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450799761	EH	On-Demand	Anodyne	XIAP	22	40
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450799763	EH	On-Demand	Anodyne	LMCPB	0	44
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450799763	EH	On-Demand	Anodyne	XIAP	22	40
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450799765	EH	On-Demand	Anodyne	LMCPB	0	44
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450799765	EH	On-Demand	Anodyne	XIAP	22	40
CC1(CO)CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450799775	CE	On-Demand	Bother	AADAC	0	42
Fc1ccc(-c2csc3ncnc(N[C@H]4CC45CCOCC5)c23)cc1	ZINC000450799807	FI	On-Demand	Anodyne	ADRB3	0	44
Fc1ccc(-c2csc3ncnc(N[C@@H]4CC45CCOCC5)c23)cc1	ZINC000450799809	FI	On-Demand	Anodyne	ADRB3	0	44
COc1cc(OC)c(NC(=O)Cc2cn(C)nc2C)cc1Br	ZINC000450799826	FF	On-Demand	Anodyne	PDGFRB	15	45
COc1cccc2c(N[C@H]3CC34CCOCC4)c(C)cnc12	ZINC000450799833	CH	On-Demand	Anodyne	ATP4A	18	40
COc1cccc2c(N[C@@H]3CC34CCOCC4)c(C)cnc12	ZINC000450799836	CH	On-Demand	Anodyne	ATP4A	18	40
CCc1cc(N[C@@H]2CCO[C@H](c3ccncc3)C2)n2ncnc2n1	ZINC000450799837	DE	On-Demand	Anodyne	DHOD	0	44
O=C(NC[C@H]1CCCCS1)c1c(Cl)cc(Cl)cc1Cl	ZINC000450799839	EJ	On-Demand	Anodyne	CACNA1I	49	33
CCc1cc(N[C@H]2CCO[C@H](c3ccncc3)C2)n2ncnc2n1	ZINC000450799841	DE	On-Demand	Anodyne	DHOD	0	44
CCc1cc(N[C@@H]2CCO[C@@H](c3ccncc3)C2)n2ncnc2n1	ZINC000450799843	DE	On-Demand	Anodyne	DHOD	0	44
CCc1cc(N[C@H]2CCO[C@@H](c3ccncc3)C2)n2ncnc2n1	ZINC000450799845	DE	On-Demand	Anodyne	DHOD	0	44
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450799846	EG	On-Demand	Anodyne	P2RY12	53	34
O=C(NC[C@@H]1CCCCS1)c1c(Cl)cc(Cl)cc1Cl	ZINC000450799847	EJ	On-Demand	Anodyne	CACNA1I	49	33
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450799848	EG	On-Demand	Anodyne	P2RY12	53	34
N#Cc1ccc(OCC(=O)N2CCC(O)(C(F)F)CC2)cc1Br	ZINC000450799852	GE	On-Demand	Mild	HTR1B	17	42
N#Cc1ccc(OCC(=O)N2CCC(O)(C(F)F)CC2)cc1Br	ZINC000450799852	GE	On-Demand	Mild	TRPV4	45	36
Cc1cc(C)c(S(=O)(=O)N(C)Cc2cccc(C)n2)c(C)c1	ZINC000450799872	DG	On-Demand	Anodyne	NR3C1	15	41
Cc1ccc(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c2c1CCC2	ZINC000450799877	FF	On-Demand	Anodyne	L3MBTL3	51	35
Cc1ccc(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c2c1CCC2	ZINC000450799884	FF	On-Demand	Anodyne	L3MBTL3	51	35
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1cccc(SC)c1	ZINC000450799890	EH	On-Demand	Anodyne	PDS	50	33
CCOC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450799925	DG	On-Demand	Anodyne	GPR88	0	43
CC(=O)Nc1ncccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450799935	CE	On-Demand	Anodyne	BDKRB1	0	41
CC(=O)Nc1ncccc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450799935	CE	On-Demand	Anodyne	G2YM83_BOTF4	58	33
CC1(CO)CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450799946	DD	On-Demand	Bother	TAAR1	17	43
Cn1nnnc1CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450799953	FC	On-Demand	Mild	PGR	0	42
Cn1nnnc1CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450799953	FC	On-Demand	Mild	CYP2C19	0	42
COC(=O)c1ccc(CC(=O)N(C)[C@@H]2CCCC[C@H]2O)cc1	ZINC000450799961	DD	On-Demand	Anodyne	OPRK1	0	43
CC(C)c1nccc(N2CC(C)(CO)C2)n1	ZINC000450799962	BD	On-Demand	Anodyne	SORD	76	44
COc1cccc(N2CC(C)(CO)C2)c1[N+](=O)[O-]	ZINC000450799964	CD	On-Demand	Bother	HTR1A	18	40
Cn1nnnc1CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450799965	FC	On-Demand	Mild	PGR	0	42
Cn1nnnc1CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450799965	FC	On-Demand	Mild	CYP2C19	0	42
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000450800001	DF	On-Demand	Anodyne	MAPK13	40	35
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000450800001	DF	On-Demand	Anodyne	CCR2	41	39
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000450800001	DF	On-Demand	Anodyne	LIPG	43	33
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCn2ccnc2C1	ZINC000450800002	DF	On-Demand	Anodyne	MAPK13	40	35
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCn2ccnc2C1	ZINC000450800002	DF	On-Demand	Anodyne	CCR2	41	39
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCn2ccnc2C1	ZINC000450800002	DF	On-Demand	Anodyne	LIPG	43	33
COc1ccc2c(c1)CN(c1ncc(C(N)=O)cc1Cl)CCO2	ZINC000450800009	EE	On-Demand	Anodyne	P2RY12	28	45
CCN(C[C@@H](O)C(F)(F)F)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450800010	FH	On-Demand	Anodyne	RBP4	55	36
CCN(C[C@@H](O)C(F)(F)F)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450800010	FH	On-Demand	Anodyne	GPR88	0	41
COc1cccc(SCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450800011	FH	On-Demand	Anodyne	HTR7	16	40
COc1cccc(SCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450800011	FH	On-Demand	Anodyne	MTNR1A	76	55
COc1cccc(SCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450800011	FH	On-Demand	Anodyne	MTNR1B	70	49
COc1cccc(SCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450800011	FH	On-Demand	Anodyne	FAS	27	42
COc1cccc(SCCC(=O)NC(=O)NCCC(F)(F)F)c1	ZINC000450800025	FF	On-Demand	Anodyne	MTNR1A	53	42
COc1cccc(SCCC(=O)NC(=O)NCCC(F)(F)F)c1	ZINC000450800025	FF	On-Demand	Anodyne	MTNR1B	42	42
CC[C@H](N=c1cc[nH]c(C(=O)NCc2ccccc2)c1)[C@H](C)O	ZINC000450800032	DE	On-Demand	Anodyne	PDS	45	36
CC[C@H](N=c1cc[nH]c(C(=O)NCc2ccccc2)c1)[C@@H](C)O	ZINC000450800033	DE	On-Demand	Anodyne	PDS	45	36
CC[C@@H](N=c1cc[nH]c(C(=O)NCc2ccccc2)c1)[C@@H](C)O	ZINC000450800034	DE	On-Demand	Anodyne	PDS	45	36
CC[C@@H](N=c1cc[nH]c(C(=O)NCc2ccccc2)c1)[C@H](C)O	ZINC000450800035	DE	On-Demand	Anodyne	PDS	45	36
CC1(O)CC(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)C1	ZINC000450800045	DG	On-Demand	Mild	EZH2	51	42
CC1(O)CC(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)C1	ZINC000450800045	DG	On-Demand	Mild	PFKFB3	51	36
CCn1c(SC[C@H](Cc2ccccc2)OC)nc2ccsc2c1=O	ZINC000450800078	FH	On-Demand	Anodyne	PDE7A	16	49
CCn1c(SC[C@H](Cc2ccccc2)OC)nc2ccsc2c1=O	ZINC000450800078	FH	On-Demand	Anodyne	KIF11	17	43
C=C[C@@H]1OCCC[C@H]1Nc1ncnc2ccc(C)cc12	ZINC000450800084	CG	On-Demand	Mild	CD38	53	44
CCn1c(SC[C@@H](Cc2ccccc2)OC)nc2ccsc2c1=O	ZINC000450800085	FH	On-Demand	Anodyne	PDE7A	16	49
CCn1c(SC[C@@H](Cc2ccccc2)OC)nc2ccsc2c1=O	ZINC000450800085	FH	On-Demand	Anodyne	KIF11	17	43
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOc2ccc(OC)cc2C1	ZINC000450800086	GD	On-Demand	Anodyne	CA2	15	40
Cc1ccncc1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450800111	FE	On-Demand	Bother	BDKRB1	22	41
COC(=O)[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(Cl)cc1Cl	ZINC000450800112	EE	On-Demand	Anodyne	METAP2	18	43
COC(=O)[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(Cl)cc1Cl	ZINC000450800115	EE	On-Demand	Anodyne	METAP2	18	43
COC(=O)[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc(Cl)cc1Cl	ZINC000450800116	EE	On-Demand	Anodyne	METAP2	18	43
COC(=O)[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(Cl)cc1Cl	ZINC000450800119	EE	On-Demand	Anodyne	METAP2	18	43
CCCOc1ccc(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c(OC)c1	ZINC000450800157	GF	On-Demand	Anodyne	OXTR	25	41
CCCOc1ccc(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c(OC)c1	ZINC000450800159	GF	On-Demand	Anodyne	OXTR	25	41
Cc1cccc(CN2CCC([C@H](O)C(=O)NC3CC3)CC2)n1	ZINC000450800167	DD	On-Demand	Anodyne	MCHR1	22	40
Cc1cccc(CN2CCC([C@@H](O)C(=O)NC3CC3)CC2)n1	ZINC000450800183	DD	On-Demand	Anodyne	MCHR1	22	40
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCc1cc(C(N)=O)co1	ZINC000450800186	CD	On-Demand	Anodyne	F11	41	33
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450800197	GF	On-Demand	Anodyne	ESRRA	22	44
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1cn(-c2cccc(OC)c2)nn1	ZINC000450800197	GF	On-Demand	Anodyne	PDS	48	39
Cc1nc(C)n(CCCC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)n1	ZINC000450800207	FF	On-Demand	Anodyne	NPFFR1	44	35
Cc1nc(C)n(CCCC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)n1	ZINC000450800211	FF	On-Demand	Anodyne	NPFFR1	44	35
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	F2	60	38
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	ACE	46	41
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	OPRM1	24	42
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	OPRD1	0	42
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	CELA1	62	39
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	ELANE	82	45
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	HLA-DRB3	40	35
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	CMA1	41	38
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	CTRA_BOVIN	52	32
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	TRY1_BOVIN	84	36
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	NTSR1	42	31
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	CTSG	41	32
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	PREP	82	45
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	CELA2A	50	32
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	LGMN	73	41
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	TPP2	45	42
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	XIAP	77	46
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	BRCA1	73	39
CCOC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450800213	DD	On-Demand	Anodyne	TMPRSS11D	55	37
COc1ccc(CC(=O)NCc2cc(C(N)=O)co2)c(Cl)c1OC	ZINC000450800216	FD	On-Demand	Anodyne	CPT1A	43	30
COc1ccc(CC(=O)NCc2cc(C(N)=O)co2)c(Cl)c1OC	ZINC000450800216	FD	On-Demand	Anodyne	SLC9A1	55	32
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1	ZINC000450800239	GG	On-Demand	Anodyne	SLC18A3	20	41
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)cc1	ZINC000450800239	GG	On-Demand	Anodyne	L3MBTL3	49	36
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1	ZINC000450800242	GG	On-Demand	Anodyne	SLC18A3	20	41
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)cc1	ZINC000450800242	GG	On-Demand	Anodyne	L3MBTL3	49	36
O=C(c1ccc2cnccc2c1)N1CC[C@@H]2CCC[C@H]21	ZINC000450800246	CG	On-Demand	Anodyne	AKT1	17	40
O=C(c1ccc2cnccc2c1)N1CC[C@@H]2CCC[C@@H]21	ZINC000450800249	CG	On-Demand	Anodyne	AKT1	17	40
O=C(c1ccc2cnccc2c1)N1CC[C@H]2CCC[C@H]21	ZINC000450800252	CG	On-Demand	Anodyne	AKT1	17	40
O=C(c1ccc2cnccc2c1)N1CC[C@H]2CCC[C@@H]21	ZINC000450800255	CG	On-Demand	Anodyne	AKT1	17	40
C[C@H]1CN(c2ccc(C(=O)Nc3nncs3)cn2)C[C@@H](C)N1CCO	ZINC000450800260	FD	On-Demand	Anodyne	HDAC1	27	44
COC(=O)[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)c1ccc(Cl)cc1Cl	ZINC000450800265	GH	On-Demand	Anodyne	CNR1	27	42
COC(=O)[C@H](NC(=O)c1cc(C)n(C(C)C)n1)c1ccc(Cl)cc1Cl	ZINC000450800268	GH	On-Demand	Anodyne	CNR1	27	42
COCC[C@@H](Nc1cnn(C)c(=O)c1Cl)c1cccc(C(F)(F)F)c1	ZINC000450800276	GH	On-Demand	Anodyne	PDS	19	45
COCC[C@H](Nc1cnn(C)c(=O)c1Cl)c1cccc(C(F)(F)F)c1	ZINC000450800281	GH	On-Demand	Anodyne	PDS	19	45
O=C(NCCCCCc1ccc(F)cc1)c1cnc(C2CC2)nc1	ZINC000450800282	EH	On-Demand	Anodyne	CCR3	19	43
CNC(=O)c1nn(C[C@H]2CCCCC2(F)F)c(=O)c2ccccc12	ZINC000450800284	EF	On-Demand	Anodyne	ADRA1B	0	40
CNC(=O)c1nn(C[C@@H]2CCCCC2(F)F)c(=O)c2ccccc12	ZINC000450800285	EF	On-Demand	Anodyne	ADRA1B	0	40
COC(=O)[C@@H](NC(=O)c1nn(C)c2c1CCCC2)c1ccc(Cl)cc1Cl	ZINC000450800303	GG	On-Demand	Anodyne	CNR1	59	36
COC(=O)[C@H](NC(=O)c1nn(C)c2c1CCCC2)c1ccc(Cl)cc1Cl	ZINC000450800304	GG	On-Demand	Anodyne	CNR1	59	36
CC(=O)Nc1ncccc1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450800312	GF	On-Demand	Anodyne	G2YM83_BOTF4	69	39
CCOC[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450800316	EG	On-Demand	Anodyne	ACACA	55	41
CCOC[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450800316	EG	On-Demand	Anodyne	ACACB	29	43
CCOC[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450800316	EG	On-Demand	Anodyne	MTNR1A	26	40
CCOC[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450800316	EG	On-Demand	Anodyne	MTNR1B	30	46
C[C@H]1CN(c2cc(N(C)c3ccccc3)ncn2)C[C@@H](C)N1CCO	ZINC000450800325	EE	On-Demand	Anodyne	SORD	48	33
Cc1ccc2ncnc(N[C@H]3CC34CCOCC4)c2c1	ZINC000450800345	CF	On-Demand	Anodyne	CD38	57	41
Cc1ccc2ncnc(N[C@@H]3CC34CCOCC4)c2c1	ZINC000450800347	CF	On-Demand	Anodyne	CD38	57	41
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CC12CCOCC2	ZINC000450800361	EF	On-Demand	Bother	CACNA1D	44	33
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CC12CCOCC2	ZINC000450800368	EF	On-Demand	Bother	CACNA1D	44	33
C[C@H]1C(=O)N(C)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450800382	EE	On-Demand	Anodyne	RBP4	70	39
COC(=O)C(C)(C)N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450800420	EE	On-Demand	Anodyne	DRD4	19	41
COC(=O)[C@]1(C)CCCN1CCN(C)Cc1ccccc1	ZINC000450800435	CE	On-Demand	Anodyne	SLC12A5	69	40
COC(=O)[C@@]1(C)CCCN1CCN(C)Cc1ccccc1	ZINC000450800436	CE	On-Demand	Anodyne	SLC12A5	69	40
Cc1cccc(Cl)c1C(=O)Nc1cnc2c(c1)CCCC2	ZINC000450800448	DI	On-Demand	Anodyne	LCK	26	43
Cc1cccc(Cl)c1C(=O)Nc1cnc2c(c1)CCCC2	ZINC000450800448	DI	On-Demand	Anodyne	JAK1	0	43
Cc1cccc(Cl)c1C(=O)Nc1cnc2c(c1)CCCC2	ZINC000450800448	DI	On-Demand	Anodyne	GRM4	50	37
Cc1cccc(Cl)c1C(=O)Nc1cnc2c(c1)CCCC2	ZINC000450800448	DI	On-Demand	Anodyne	TYK2	68	41
Cc1cccc(Cl)c1C(=O)Nc1cnc2c(c1)CCCC2	ZINC000450800448	DI	On-Demand	Anodyne	KCNK3	45	36
COc1ccc(F)cc1CNC(=O)Cc1cn(C)nc1C	ZINC000450800450	CD	On-Demand	Anodyne	PDGFRB	20	41
COc1ccc(F)cc1CNC(=O)Cc1cn(C)nc1C	ZINC000450800450	CD	On-Demand	Anodyne	P2RX7	84	52
COc1ccc(F)cc1CNC(=O)Cc1cn(C)nc1C	ZINC000450800450	CD	On-Demand	Anodyne	CARM1	16	41
COc1ccc(F)cc1CNC(=O)[C@@H](C)Oc1ccccn1	ZINC000450800457	DE	On-Demand	Anodyne	GRIN2B	24	41
COc1ccc(F)cc1CNC(=O)[C@H](C)Oc1ccccn1	ZINC000450800458	DE	On-Demand	Anodyne	GRIN2B	24	41
C=CCN(C)C(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450800459	BD	On-Demand	Mild	PDF	82	42
C=CCN(C)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450800462	BF	On-Demand	Mild	SLC6A2	0	49
Cc1ccc(F)c(CC(=O)NCc2nnnn2C)c1	ZINC000450800466	CC	On-Demand	Anodyne	P2RX7	28	41
COC(=O)C(C)(C)N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450800480	ED	On-Demand	Anodyne	DRD4	41	33
COC(=O)C(C)(C)N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450800480	ED	On-Demand	Anodyne	ACHE	22	42
COC(=O)C(C)(C)N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450800480	ED	On-Demand	Anodyne	SIGMAR1	40	45
COC(=O)C(C)(C)N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450800480	ED	On-Demand	Anodyne	AMY2	54	32
COc1ccc(F)cc1CNC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450800481	DE	On-Demand	Anodyne	PPARD	20	40
COc1ccc(F)cc1CNC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450800481	DE	On-Demand	Anodyne	MT-ND1	15	41
Cn1nnnc1CNC(=O)CCc1ccc2ccccc2c1O	ZINC000450800488	DD	On-Demand	Anodyne	DAGLA	17	42
COCC[C@@H](Cc1ccco1)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450800497	FI	On-Demand	Anodyne	NPPA	40	31
Cn1cc(-c2ccc(C(=O)Nc3cnc4c(c3)CCCC4)o2)cn1	ZINC000450800499	DG	On-Demand	Anodyne	MMP13	17	46
COCC[C@H](Cc1ccco1)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450800501	FI	On-Demand	Anodyne	NPPA	40	31
CCOC[C@H](C)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450800530	EG	On-Demand	Anodyne	PYGL	54	37
CCOC(=O)c1cccnc1N1CC(C)(CO)C1	ZINC000450800534	CD	On-Demand	Anodyne	P2RY12	45	36
CC(=O)N[C@H](C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cn1)C(C)(C)C	ZINC000450800536	GI	On-Demand	Anodyne	ACACA	34	40
CC(=O)N[C@H](C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cn1)C(C)(C)C	ZINC000450800536	GI	On-Demand	Anodyne	ACACB	49	40
CC(=O)N[C@H](C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cn1)C(C)(C)C	ZINC000450800536	GI	On-Demand	Anodyne	GCK	15	42
CCc1nc(C)c(NC(=O)[C@@H](C)OCc2ccc(F)cc2)s1	ZINC000450800562	DH	On-Demand	Anodyne	ACAT	41	32
COC[C@@]1(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)CCOC1	ZINC000450800565	EE	On-Demand	Anodyne	NPFFR1	47	36
COC[C@@]1(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)CCOC1	ZINC000450800568	EE	On-Demand	Anodyne	NPFFR1	47	36
COC[C@]1(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)CCOC1	ZINC000450800570	EE	On-Demand	Anodyne	NPFFR1	47	36
CCc1nc(C)c(NC(=O)[C@H](C)OCc2ccc(F)cc2)s1	ZINC000450800571	DH	On-Demand	Anodyne	ACAT	41	32
COC[C@]1(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)CCOC1	ZINC000450800573	EE	On-Demand	Anodyne	NPFFR1	47	36
CCn1c(SCC[C@@H]2CCOC2)nc2ccsc2c1=O	ZINC000450800574	DF	On-Demand	Anodyne	PDE7A	18	54
CCn1c(SCC[C@H]2CCOC2)nc2ccsc2c1=O	ZINC000450800577	DF	On-Demand	Anodyne	PDE7A	18	54
CCn1c(SCC(=O)c2ccc(C(=O)OC)o2)nc2ccsc2c1=O	ZINC000450800580	GF	On-Demand	Anodyne	PDE7A	15	44
C[C@H]1CN(c2ccc(C(=O)NC3CCCC3)nn2)C[C@@H](C)N1CCO	ZINC000450800585	ED	On-Demand	Anodyne	SCD1	43	41
CCNC(=O)c1ccc(N2C[C@H](C)N(CCO)[C@H](C)C2)nc1	ZINC000450800610	DC	On-Demand	Anodyne	HDAC1	0	44
CC1(CO)CN(c2ncccc2C(=O)N2CCc3ccccc32)C1	ZINC000450800651	DE	On-Demand	Anodyne	AVPR2	50	38
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450800671	GE	On-Demand	Anodyne	P2RY12	46	33
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](C(=O)NCC(F)(F)F)C1	ZINC000450800671	GE	On-Demand	Anodyne	SFRP1	40	31
CCn1c(SCCC(C)(F)F)nc2ccsc2c1=O	ZINC000450800672	DH	On-Demand	Anodyne	PDE7A	18	48
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450800673	GE	On-Demand	Anodyne	P2RY12	46	33
Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](C(=O)NCC(F)(F)F)C1	ZINC000450800673	GE	On-Demand	Anodyne	SFRP1	40	31
COC(=O)c1cnc(Nc2cnn([C@@H]3CCOC3)c2C)nc1	ZINC000450800680	DD	On-Demand	Anodyne	LRRK2	25	47
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800684	EH	On-Demand	Anodyne	SLC6A1	70	33
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800684	EH	On-Demand	Anodyne	ADAM17	0	44
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800684	EH	On-Demand	Anodyne	COLA	81	49
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800684	EH	On-Demand	Anodyne	CPT1A	78	42
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800684	EH	On-Demand	Anodyne	PREP	47	32
O[C@@H]1CC[C@@H]2CN(c3ncc(C(F)(F)F)cc3Cl)CC[C@@H]2C1	ZINC000450800687	EH	On-Demand	Anodyne	CXCR3	17	42
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800689	EH	On-Demand	Anodyne	SLC6A1	70	33
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800689	EH	On-Demand	Anodyne	ADAM17	0	44
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800689	EH	On-Demand	Anodyne	COLA	81	49
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800689	EH	On-Demand	Anodyne	CPT1A	78	42
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cs1	ZINC000450800689	EH	On-Demand	Anodyne	PREP	47	32
O[C@@H]1CC[C@@H]2CN(c3ncc(C(F)(F)F)cc3Cl)CC[C@H]2C1	ZINC000450800691	EH	On-Demand	Anodyne	CXCR3	17	42
O[C@@H]1CC[C@H]2CN(c3ncc(C(F)(F)F)cc3Cl)CC[C@H]2C1	ZINC000450800694	EH	On-Demand	Anodyne	CXCR3	17	42
O[C@@H]1CC[C@H]2CN(c3ncc(C(F)(F)F)cc3Cl)CC[C@@H]2C1	ZINC000450800696	EH	On-Demand	Anodyne	CXCR3	17	42
O=C(N1CCC(CCCn2ccnc2)CC1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450800704	GJ	On-Demand	Anodyne	TBXAS1	41	41
COC(=O)c1cnc(Nc2cnn([C@H]3CCOC3)c2C)nc1	ZINC000450800709	DD	On-Demand	Anodyne	LRRK2	25	47
O=C(Nc1ccc(C(=O)N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)[nH]1	ZINC000450800714	GF	On-Demand	Anodyne	EPHX2	27	66
CNC(=O)c1ccc(OCC2=CCCCC2)cc1	ZINC000450800715	BF	On-Demand	Anodyne	MMP10	16	41
CCSc1cc(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)ccn1	ZINC000450800718	FG	On-Demand	Anodyne	PDE4D	15	41
CCSc1cc(CNC(=O)Cc2ccccc2O[C@H]2CCOC2)ccn1	ZINC000450800718	FG	On-Demand	Anodyne	PDEC	0	41
CCSc1cc(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccn1	ZINC000450800720	FG	On-Demand	Anodyne	PDE4D	15	41
CCSc1cc(CNC(=O)Cc2ccccc2O[C@@H]2CCOC2)ccn1	ZINC000450800720	FG	On-Demand	Anodyne	PDEC	0	41
c1ccc(-c2csc(N[C@H]3CC34CCOCC4)n2)cc1	ZINC000450800729	CH	On-Demand	Anodyne	MAOA	17	42
c1ccc(-c2csc(N[C@H]3CC34CCOCC4)n2)cc1	ZINC000450800729	CH	On-Demand	Anodyne	MAOB	26	42
c1ccc(-c2csc(N[C@@H]3CC34CCOCC4)n2)cc1	ZINC000450800730	CH	On-Demand	Anodyne	MAOA	17	42
c1ccc(-c2csc(N[C@@H]3CC34CCOCC4)n2)cc1	ZINC000450800730	CH	On-Demand	Anodyne	MAOB	26	42
CCC(CC)Oc1ccc(C(=O)Nc2cccnc2NC(C)=O)cc1	ZINC000450800736	EH	On-Demand	Anodyne	TRPV1	15	40
CCC(CC)Oc1ccc(C(=O)Nc2cccnc2NC(C)=O)cc1	ZINC000450800736	EH	On-Demand	Anodyne	PRNP	46	35
CCC(CC)Oc1ccc(C(=O)Nc2cccnc2NC(C)=O)cc1	ZINC000450800736	EH	On-Demand	Anodyne	G2YM83_BOTF4	65	35
CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1nn2c(c1C)OCCC2	ZINC000450800737	EE	On-Demand	Anodyne	HTR4	43	32
CCOC[C@H](C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450800767	CD	On-Demand	Anodyne	SDH1	0	40
C[C@H]1[C@H](NC(=O)c2ccc(N3CCC3)nc2)CCCN1C	ZINC000450800789	CD	On-Demand	Anodyne	HDAC1	26	40
C[C@H]1[C@H](NC(=O)c2ccc(N3CCC3)nc2)CCCN1C	ZINC000450800789	CD	On-Demand	Anodyne	HPGDS	31	50
C[C@H]1[C@@H](NC(=O)c2ccc(N3CCC3)nc2)CCCN1C	ZINC000450800794	CD	On-Demand	Anodyne	HDAC1	26	40
C[C@H]1[C@@H](NC(=O)c2ccc(N3CCC3)nc2)CCCN1C	ZINC000450800794	CD	On-Demand	Anodyne	HPGDS	31	50
C[C@@H]1[C@@H](NC(=O)c2ccc(N3CCC3)nc2)CCCN1C	ZINC000450800795	CD	On-Demand	Anodyne	HDAC1	26	40
C[C@@H]1[C@@H](NC(=O)c2ccc(N3CCC3)nc2)CCCN1C	ZINC000450800795	CD	On-Demand	Anodyne	HPGDS	31	50
C[C@@H]1[C@H](NC(=O)c2ccc(N3CCC3)nc2)CCCN1C	ZINC000450800796	CD	On-Demand	Anodyne	HDAC1	26	40
C[C@@H]1[C@H](NC(=O)c2ccc(N3CCC3)nc2)CCCN1C	ZINC000450800796	CD	On-Demand	Anodyne	HPGDS	31	50
Cc1cc(C)nc(N2CCN(C(=O)C3=C(c4ccccc4)CCC3)CC2)n1	ZINC000450800859	FG	On-Demand	Anodyne	SLC6A7	0	50
O=C(NCCc1ccc(F)c(F)c1F)c1ccc(N2CCC2)nc1	ZINC000450800866	EF	On-Demand	Anodyne	HPGDS	21	46
C=C[C@@H]1OCCC[C@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450800898	CD	On-Demand	Mild	PRKCQ	44	35
Cc1nc(N[C@@H]2CCc3c2ccc(F)c3Br)ncc1[N+](=O)[O-]	ZINC000450800905	FH	On-Demand	Bother	PRKCQ	32	40
Cc1nc(N[C@H]2CCc3c2ccc(F)c3Br)ncc1[N+](=O)[O-]	ZINC000450800906	FH	On-Demand	Bother	PRKCQ	32	40
CC[C@@H]1C[C@H]1C(=O)Nc1cccnc1NC(C)=O	ZINC000450800915	BE	On-Demand	Anodyne	G2YM83_BOTF4	58	33
CCOC[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450800916	DE	On-Demand	Anodyne	CAPNS1	47	33
CCOC[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450800916	DE	On-Demand	Anodyne	CAPN1	47	40
CCOC[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450800916	DE	On-Demand	Anodyne	CAPN2	71	36
c1ccc(COc2cccnc2N[C@H]2CC23CCOCC3)cc1	ZINC000450800922	DH	On-Demand	Anodyne	PPIA	37	45
c1ccc(COc2cccnc2N[C@@H]2CC23CCOCC3)cc1	ZINC000450800923	DH	On-Demand	Anodyne	PPIA	44	45
CCOC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450800924	DG	On-Demand	Anodyne	RBP4	67	45
CC1(CO)CN(c2ncncc2-c2ccccc2)C1	ZINC000450800940	CD	On-Demand	Anodyne	SLC9A1	15	47
CCN1C(=O)C[C@H](C(=O)N[C@H]2CCCN(C)[C@@H]2C)[C@H]1c1cccnc1	ZINC000450800950	ED	On-Demand	Anodyne	CHRNA2	41	42
CCN1C(=O)C[C@H](C(=O)N[C@@H]2CCCN(C)[C@H]2C)[C@H]1c1cccnc1	ZINC000450800951	ED	On-Demand	Anodyne	CHRNA2	41	42
CCN1C(=O)C[C@H](C(=O)N[C@@H]2CCCN(C)[C@@H]2C)[C@H]1c1cccnc1	ZINC000450800952	ED	On-Demand	Anodyne	CHRNA2	41	42
CCN1C(=O)C[C@H](C(=O)N[C@H]2CCCN(C)[C@H]2C)[C@H]1c1cccnc1	ZINC000450800953	ED	On-Demand	Anodyne	CHRNA2	41	42
COc1cc2c(N3CC(C)(CO)C3)ncnc2cc1F	ZINC000450800997	CD	On-Demand	Anodyne	PDE3A	52	39
COc1cc2c(N3CC(C)(CO)C3)ncnc2cc1F	ZINC000450800997	CD	On-Demand	Anodyne	PDGFRB	76	44
COc1cc2c(N3CC(C)(CO)C3)ncnc2cc1F	ZINC000450800997	CD	On-Demand	Anodyne	PDE3B	77	39
CCOC(=O)c1ccc(N2CC(NC(=O)Cc3cc4ccccc4s3)C2)nc1	ZINC000450801002	GG	On-Demand	Anodyne	P2RY12	33	43
CC(C)CN1CCN(C(=O)c2ccsc2Br)CC1=O	ZINC000450801005	EE	On-Demand	Anodyne	P2RX7	15	60
CC(C)CN1CCN(C(=O)c2cc(Br)c(F)cc2O)CC1=O	ZINC000450801020	FE	On-Demand	Anodyne	P2RX7	15	53
CCCOc1cccc(COc2ccc(C(=O)NC)cc2)c1	ZINC000450801061	CG	On-Demand	Anodyne	YOPH	0	43
CCSc1cc(CNC(=O)Cc2ccc(OC)c(OC)c2Cl)ccn1	ZINC000450801069	GH	On-Demand	Anodyne	PDE6A	44	35
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450801073	FG	On-Demand	Bother	CACNA1C	50	35
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450801073	FG	On-Demand	Bother	CACNA1D	81	35
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450801076	FG	On-Demand	Bother	CACNA1C	50	35
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450801076	FG	On-Demand	Bother	CACNA1D	81	35
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450801078	FG	On-Demand	Bother	CACNA1C	50	35
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450801078	FG	On-Demand	Bother	CACNA1D	81	35
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450801079	FG	On-Demand	Bother	CACNA1C	50	35
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450801079	FG	On-Demand	Bother	CACNA1D	81	35
CCCc1nc(C)c(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000450801105	FF	On-Demand	Bother	CACNA1D	80	36
CCCc1nc(C)c(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000450801108	FF	On-Demand	Bother	CACNA1D	80	36
C[C@@H](OCCc1ccccc1)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450801128	EE	On-Demand	Anodyne	GHRHR	58	35
C[C@H](OCCc1ccccc1)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450801130	EE	On-Demand	Anodyne	GHRHR	58	35
CNc1ccc(S(=O)(=O)N(C)C[C@H](Cc2ccccc2)OC)cc1[N+](=O)[O-]	ZINC000450801154	GF	On-Demand	Bother	COLA	69	32
CNc1ccc(S(=O)(=O)N(C)C[C@H](Cc2ccccc2)OC)cc1[N+](=O)[O-]	ZINC000450801154	GF	On-Demand	Bother	BCL2L1	50	34
CNc1ccc(S(=O)(=O)N(C)C[C@@H](Cc2ccccc2)OC)cc1[N+](=O)[O-]	ZINC000450801155	GF	On-Demand	Bother	COLA	69	32
CNc1ccc(S(=O)(=O)N(C)C[C@@H](Cc2ccccc2)OC)cc1[N+](=O)[O-]	ZINC000450801155	GF	On-Demand	Bother	BCL2L1	50	34
CC(=O)c1ccc(S(=O)(=O)N(CC[C@H](C)O)Cc2ccc(F)cc2)cc1	ZINC000450801177	GF	On-Demand	Anodyne	MMP8	26	46
CC(=O)c1ccc(S(=O)(=O)N(CC[C@H](C)O)Cc2ccc(F)cc2)cc1	ZINC000450801177	GF	On-Demand	Anodyne	MMP1	18	46
CC(=O)c1ccc(S(=O)(=O)N(CC[C@@H](C)O)Cc2ccc(F)cc2)cc1	ZINC000450801178	GF	On-Demand	Anodyne	MMP8	26	46
CC(=O)c1ccc(S(=O)(=O)N(CC[C@@H](C)O)Cc2ccc(F)cc2)cc1	ZINC000450801178	GF	On-Demand	Anodyne	MMP1	18	46
COCC[C@@H](Nc1nc(C(N)=O)cs1)c1cccc(C(F)(F)F)c1	ZINC000450801179	FF	On-Demand	Anodyne	SCD1	21	40
COCC[C@H](Nc1nc(C(N)=O)cs1)c1cccc(C(F)(F)F)c1	ZINC000450801181	FF	On-Demand	Anodyne	SCD1	21	40
Cc1cc(N2C[C@H]3CCN(C)[C@H]3C2)nc(-c2cccnc2)n1	ZINC000450801195	CD	On-Demand	Anodyne	ROS1	37	43
COc1ccnc(N2C[C@@H](C(C)C)[C@@H]2C(C)C)n1	ZINC000450801208	BF	On-Demand	Anodyne	SORD	40	31
COc1ccnc(N2C[C@H](C(C)C)[C@H]2C(C)C)n1	ZINC000450801209	BF	On-Demand	Anodyne	SORD	40	31
COc1ccnc(N2C[C@@H](C(C)C)[C@H]2C(C)C)n1	ZINC000450801210	BF	On-Demand	Anodyne	SORD	40	31
CCOc1nc2ccc(C(=O)NCc3nnnn3C)cc2[nH]1	ZINC000450801211	DC	On-Demand	Anodyne	DAGLA	15	41
COc1ccnc(N2C[C@H](C(C)C)[C@@H]2C(C)C)n1	ZINC000450801212	BF	On-Demand	Anodyne	SORD	40	31
COCC[C@@H](Nc1ncc([N+](=O)[O-])s1)c1cccc(C(F)(F)F)c1	ZINC000450801234	FI	On-Demand	Bother	SCD1	0	41
COCC[C@H](Nc1ncc([N+](=O)[O-])s1)c1cccc(C(F)(F)F)c1	ZINC000450801236	FI	On-Demand	Bother	SCD1	0	41
CNc1ccc(S(=O)(=O)N(C)CCC2CCOCC2)cc1[N+](=O)[O-]	ZINC000450801237	FE	On-Demand	Bother	BCL2L1	66	33
CNc1ccc(S(=O)(=O)N(C)CCC2CCOCC2)cc1[N+](=O)[O-]	ZINC000450801237	FE	On-Demand	Bother	BCL2	44	32
CN1CC[C@@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]21	ZINC000450801251	CC	On-Demand	Bother	TAAR1	17	44
CC[C@H](CC(F)(F)F)C(=O)NCc1cc(F)ccc1OC	ZINC000450801259	DG	On-Demand	Anodyne	P2RX7	40	37
CC[C@H](CC(F)(F)F)C(=O)NCc1cc(F)ccc1OC	ZINC000450801259	DG	On-Demand	Anodyne	PPARD	31	51
CC[C@H](CC(F)(F)F)C(=O)NCc1cc(F)ccc1OC	ZINC000450801259	DG	On-Demand	Anodyne	CARM1	27	40
CCS(=O)(=O)c1ccc(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)cc1	ZINC000450801284	GE	On-Demand	Anodyne	CACNA1D	42	37
O=C(Cc1sccc1Br)N1CCC(CCCn2ccnc2)CC1	ZINC000450801289	GH	On-Demand	Anodyne	TBXAS1	41	39
CC[C@@H](CC(F)(F)F)C(=O)NCc1cc(F)ccc1OC	ZINC000450801297	DG	On-Demand	Anodyne	P2RX7	40	37
CC[C@@H](CC(F)(F)F)C(=O)NCc1cc(F)ccc1OC	ZINC000450801297	DG	On-Demand	Anodyne	PPARD	31	51
CC[C@@H](CC(F)(F)F)C(=O)NCc1cc(F)ccc1OC	ZINC000450801297	DG	On-Demand	Anodyne	CARM1	27	40
O=C(c1c[nH]c2nccc-2c1)N1CCC(CCCn2ccnc2)CC1	ZINC000450801298	EG	On-Demand	Anodyne	TBXAS1	30	41
CCN1C[C@H](Nc2ncnc3cc(F)c(OC)cc23)CC1=O	ZINC000450801302	DD	On-Demand	Anodyne	FLT1	24	40
CCN1C[C@H](Nc2ncnc3cc(F)c(OC)cc23)CC1=O	ZINC000450801302	DD	On-Demand	Anodyne	EPHA2	45	34
CCN1C[C@@H](Nc2ncnc3cc(F)c(OC)cc23)CC1=O	ZINC000450801306	DD	On-Demand	Anodyne	FLT1	24	40
CCN1C[C@@H](Nc2ncnc3cc(F)c(OC)cc23)CC1=O	ZINC000450801306	DD	On-Demand	Anodyne	EPHA2	45	34
CNC(=O)c1ccc(N2CCOc3ccc(OC)cc3C2)c([N+](=O)[O-])c1	ZINC000450801317	FE	On-Demand	Bother	TAAR1	26	56
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801336	CD	On-Demand	Anodyne	DRD2	19	40
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801336	CD	On-Demand	Anodyne	ACHE	21	41
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801336	CD	On-Demand	Anodyne	SLC6A1	80	35
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801336	CD	On-Demand	Anodyne	OPRM1	15	46
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801336	CD	On-Demand	Anodyne	OPRD1	15	46
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801336	CD	On-Demand	Anodyne	HRH3	15	44
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801336	CD	On-Demand	Anodyne	SIGMAR1	70	48
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801336	CD	On-Demand	Anodyne	CCR5	44	41
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801337	CD	On-Demand	Anodyne	DRD2	19	40
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801337	CD	On-Demand	Anodyne	ACHE	21	41
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801337	CD	On-Demand	Anodyne	SLC6A1	80	35
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801337	CD	On-Demand	Anodyne	OPRM1	15	46
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801337	CD	On-Demand	Anodyne	OPRD1	15	46
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801337	CD	On-Demand	Anodyne	HRH3	15	44
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801337	CD	On-Demand	Anodyne	SIGMAR1	70	48
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1O	ZINC000450801337	CD	On-Demand	Anodyne	CCR5	44	41
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801338	CD	On-Demand	Anodyne	DRD2	19	40
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801338	CD	On-Demand	Anodyne	ACHE	21	41
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801338	CD	On-Demand	Anodyne	SLC6A1	80	35
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801338	CD	On-Demand	Anodyne	OPRM1	15	46
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801338	CD	On-Demand	Anodyne	OPRD1	15	46
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801338	CD	On-Demand	Anodyne	HRH3	15	44
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801338	CD	On-Demand	Anodyne	SIGMAR1	70	48
C[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801338	CD	On-Demand	Anodyne	CCR5	44	41
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801340	CD	On-Demand	Anodyne	DRD2	19	40
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801340	CD	On-Demand	Anodyne	ACHE	21	41
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801340	CD	On-Demand	Anodyne	SLC6A1	80	35
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801340	CD	On-Demand	Anodyne	OPRM1	15	46
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801340	CD	On-Demand	Anodyne	OPRD1	15	46
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801340	CD	On-Demand	Anodyne	HRH3	15	44
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801340	CD	On-Demand	Anodyne	SIGMAR1	70	48
C[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1O	ZINC000450801340	CD	On-Demand	Anodyne	CCR5	44	41
O=C(Nc1cnc2c(c1)CCCC2)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450801348	FI	On-Demand	Bother	ATF1	46	35
O=C(Nc1cnc2c(c1)CCCC2)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450801348	FI	On-Demand	Bother	SORT1	15	47
O=C(Nc1cnc2c(c1)CCCC2)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450801348	FI	On-Demand	Bother	NFKB1	42	35
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(Cl)cc1F	ZINC000450801349	GH	On-Demand	Anodyne	TRPV1	56	37
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(Cl)cc1F	ZINC000450801349	GH	On-Demand	Anodyne	P2RX7	66	39
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(Cl)cc1F	ZINC000450801349	GH	On-Demand	Anodyne	EPHX2	15	43
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(Cl)cc1F	ZINC000450801349	GH	On-Demand	Anodyne	CA9	16	48
O=C(Cc1ccc(S(=O)(=O)CC2CC2)cc1)NCc1ccc(Cl)cc1F	ZINC000450801349	GH	On-Demand	Anodyne	RORC	44	38
C[C@@H]1C(=O)N(C)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450801350	FF	On-Demand	Anodyne	CYP2J2	50	36
C[C@H]1C(=O)N(C)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450801351	FF	On-Demand	Anodyne	CYP2J2	50	36
COC(=O)C(C)(C)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450801352	EE	On-Demand	Anodyne	DRD4	44	39
COC(=O)C(C)(C)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450801352	EE	On-Demand	Anodyne	ACHE	17	47
COC(=O)C(C)(C)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450801352	EE	On-Demand	Anodyne	HRH1	18	43
COC(=O)C(C)(C)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450801352	EE	On-Demand	Anodyne	DRD3	23	41
COC(=O)C(C)(C)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450801352	EE	On-Demand	Anodyne	HTR4	49	34
COC(=O)C(C)(C)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450801352	EE	On-Demand	Anodyne	SSTR5	48	41
COC(=O)C(C)(C)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450801352	EE	On-Demand	Anodyne	CCR1	40	37
COC(=O)C(C)(C)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450801352	EE	On-Demand	Anodyne	MCHR1	30	44
COC(=O)c1ccc(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)cc1Cl	ZINC000450801355	GF	On-Demand	Anodyne	CACNA1D	29	41
COC(=O)c1ccc(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)cc1Cl	ZINC000450801355	GF	On-Demand	Anodyne	Q9FYV8_MAIZE	44	39
CCN(C[C@@H](O)C(F)(F)F)C(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450801356	DD	On-Demand	Anodyne	PDF	66	33
COC(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)cc1Cl	ZINC000450801358	FE	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)c1ccc(CN2CCN(C(C)(C)C(=O)OC)CC2)cc1Cl	ZINC000450801358	FE	On-Demand	Anodyne	MCHR1	25	41
CCN(C[C@H](O)C(F)(F)F)C(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450801359	DD	On-Demand	Anodyne	PDF	66	33
COc1cc(Br)ccc1CNC(=O)C[C@H]1COc2ccccc2O1	ZINC000450801361	GG	On-Demand	Anodyne	ADRA1B	16	45
COc1cc(Br)ccc1CNC(=O)C[C@H]1COc2ccccc2O1	ZINC000450801361	GG	On-Demand	Anodyne	ADRA2B	17	45
CCOC(=O)c1ccc2c(c1)n(C[C@@H](C)S(C)(=O)=O)c(=O)n2CC	ZINC000450801365	FD	On-Demand	Anodyne	HPD	30	43
COc1cc(Br)ccc1CNC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450801366	GG	On-Demand	Anodyne	ADRA1B	16	45
COc1cc(Br)ccc1CNC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450801366	GG	On-Demand	Anodyne	ADRA2B	17	45
CCOC(=O)c1ccc2c(c1)n(C[C@H](C)S(C)(=O)=O)c(=O)n2CC	ZINC000450801368	FD	On-Demand	Anodyne	HPD	30	43
O=C1C(=O)N(C2CCCCC2)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450801372	EG	On-Demand	Anodyne	CACNA1C	39	55
O=C1C(=O)N(C2CCCCC2)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450801372	EG	On-Demand	Anodyne	CACNA1D	110	55
C[C@H](O)C[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450801373	DE	On-Demand	Anodyne	TIMP3	60	34
C[C@H](O)C[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450801374	DE	On-Demand	Anodyne	TIMP3	60	34
C[C@@H](O)C[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450801376	DE	On-Demand	Anodyne	TIMP3	60	34
C[C@@H](C[C@@H](C)O)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450801377	DE	On-Demand	Anodyne	TIMP3	60	34
COc1ccc(CC(=O)N2CCC[C@H]2c2csc(C)n2)c(Cl)c1OC	ZINC000450801398	GI	On-Demand	Anodyne	COLA	50	42
COc1ccc(CC(=O)N2CCC[C@H]2c2csc(C)n2)c(Cl)c1OC	ZINC000450801398	GI	On-Demand	Anodyne	CPT1A	47	42
Cc1ccc(Br)cc1CN1CCN(C[C@H](C)O)CC1	ZINC000450801401	EE	On-Demand	Anodyne	IGF1R	15	42
COc1ccc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c(Cl)c1OC	ZINC000450801402	GI	On-Demand	Anodyne	COLA	50	42
COc1ccc(CC(=O)N2CCC[C@@H]2c2csc(C)n2)c(Cl)c1OC	ZINC000450801402	GI	On-Demand	Anodyne	CPT1A	47	42
Clc1ccc2c(N[C@@H]3CCO[C@H](c4ccncc4)C3)ccnc2c1	ZINC000450801436	EJ	On-Demand	Anodyne	HRP1_PLAFA	117	37
Clc1ccc2c(N[C@@H]3CCO[C@H](c4ccncc4)C3)ccnc2c1	ZINC000450801436	EJ	On-Demand	Anodyne	HNMT	52	37
Clc1ccc2c(N[C@@H]3CCO[C@@H](c4ccncc4)C3)ccnc2c1	ZINC000450801437	EJ	On-Demand	Anodyne	HRP1_PLAFA	117	37
Clc1ccc2c(N[C@@H]3CCO[C@@H](c4ccncc4)C3)ccnc2c1	ZINC000450801437	EJ	On-Demand	Anodyne	HNMT	52	37
Clc1ccc2c(N[C@H]3CCO[C@@H](c4ccncc4)C3)ccnc2c1	ZINC000450801438	EJ	On-Demand	Anodyne	HRP1_PLAFA	117	37
Clc1ccc2c(N[C@H]3CCO[C@@H](c4ccncc4)C3)ccnc2c1	ZINC000450801438	EJ	On-Demand	Anodyne	HNMT	52	37
Clc1ccc2c(N[C@H]3CCO[C@H](c4ccncc4)C3)ccnc2c1	ZINC000450801439	EJ	On-Demand	Anodyne	HRP1_PLAFA	117	37
Clc1ccc2c(N[C@H]3CCO[C@H](c4ccncc4)C3)ccnc2c1	ZINC000450801439	EJ	On-Demand	Anodyne	HNMT	52	37
CC1(CO)CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450801479	EH	On-Demand	Anodyne	SIRT3	73	33
CC1(CO)CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450801479	EH	On-Demand	Anodyne	SIRT2	62	32
CC1(CO)CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450801479	EH	On-Demand	Anodyne	SIRT1	53	32
CC(C)c1nccc(N2C[C@@H](C3CC3)[C@H]2C2CC2)n1	ZINC000450801488	CG	On-Demand	Anodyne	SORD	52	36
CC(C)c1nccc(N2C[C@H](C3CC3)[C@@H]2C2CC2)n1	ZINC000450801489	CG	On-Demand	Anodyne	SORD	52	36
CC(C)c1nccc(N2C[C@H](C3CC3)[C@H]2C2CC2)n1	ZINC000450801490	CG	On-Demand	Anodyne	SORD	52	36
CC(C)c1nccc(N2C[C@@H](C3CC3)[C@@H]2C2CC2)n1	ZINC000450801491	CG	On-Demand	Anodyne	SORD	52	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(C)C(=O)[C@@H]1C	ZINC000450801506	DE	On-Demand	Anodyne	CACNA1B	40	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(C)C(=O)[C@@H]1C	ZINC000450801506	DE	On-Demand	Anodyne	LIPG	42	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(C)C(=O)[C@H]1C	ZINC000450801507	DE	On-Demand	Anodyne	CACNA1B	40	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(C)C(=O)[C@H]1C	ZINC000450801507	DE	On-Demand	Anodyne	LIPG	42	33
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450801508	FC	On-Demand	Bother	TAAR1	18	46
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC(C)(CO)C2)c([N+](=O)[O-])c1	ZINC000450801509	FC	On-Demand	Bother	TAAR1	18	46
O=C(N[C@@H](c1cccc(F)c1F)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450801515	DF	On-Demand	Anodyne	CES2	20	42
O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450801516	DF	On-Demand	Anodyne	CES2	20	42
O=C(N[C@@H](c1cccc(F)c1F)C(F)(F)F)[C@@H](O)C1CCC1	ZINC000450801517	DF	On-Demand	Anodyne	CES2	20	42
O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)[C@H](O)C1CCC1	ZINC000450801518	DF	On-Demand	Anodyne	CES2	20	42
CCS(=O)(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2cccnc2)cc1	ZINC000450801533	GE	On-Demand	Anodyne	AVPR1B	20	41
COc1cc(C)nc(N2CCC[C@@H]2C(N)=O)n1	ZINC000450801543	BC	On-Demand	Anodyne	ALS	56	31
O=C(N1C[C@@H]2CC[C@H](O)[C@H]2C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450801586	DF	On-Demand	Anodyne	SLC6A9	42	34
O=C(N1C[C@@H]2CC[C@@H](O)[C@H]2C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450801588	DF	On-Demand	Anodyne	SLC6A9	42	34
O=C(N1C[C@H]2[C@@H](O)CC[C@H]2C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450801590	DF	On-Demand	Anodyne	SLC6A9	42	34
O=C(N1C[C@H]2[C@H](O)CC[C@H]2C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450801592	DF	On-Demand	Anodyne	SLC6A9	42	34
COC(=O)c1ccc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)cc1Cl	ZINC000450801599	FG	On-Demand	Anodyne	MCHR1	23	43
COC(=O)c1ccc(CC(=O)N2CCC(O)(C(F)F)CC2)cc1	ZINC000450801603	ED	On-Demand	Anodyne	HRH3	16	43
CC(C)CN1CCN(CCCC(=O)c2ccccc2)CC1=O	ZINC000450801608	DE	On-Demand	Anodyne	DRD2	30	51
CC(C)CN1CCN(CCCC(=O)c2ccccc2)CC1=O	ZINC000450801608	DE	On-Demand	Anodyne	HTR7	34	46
CC(C)CN1CCN(CCCC(=O)c2ccccc2)CC1=O	ZINC000450801608	DE	On-Demand	Anodyne	CYP2J2	57	41
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)c1cc2n(n1)CCCC2	ZINC000450801612	EF	On-Demand	Anodyne	P2RY12	56	32
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)c1cc2n(n1)CCCC2	ZINC000450801613	EF	On-Demand	Anodyne	P2RY12	56	32
COc1cc(OC)c(NC(=O)CCCC(=O)C(C)(C)C)cc1Br	ZINC000450801627	GI	On-Demand	Anodyne	GLMU	0	41
COc1ccc(F)cc1CNC(=O)c1cc2n(n1)CCCC2	ZINC000450801632	DE	On-Demand	Anodyne	P2RX7	52	40
COC(=O)c1ccc(CN2CCC[C@@H]2CCO)cc1Cl	ZINC000450801684	CE	On-Demand	Anodyne	DRD2	51	41
COC(=O)c1ccc(CN2CCC[C@@H]2CCO)cc1Cl	ZINC000450801684	CE	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CCC[C@@H]2CCO)cc1Cl	ZINC000450801684	CE	On-Demand	Anodyne	OPRK1	24	42
COC(=O)c1ccc(CN2CCC[C@H]2CCO)cc1Cl	ZINC000450801685	CE	On-Demand	Anodyne	DRD2	51	41
COC(=O)c1ccc(CN2CCC[C@H]2CCO)cc1Cl	ZINC000450801685	CE	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1ccc(CN2CCC[C@H]2CCO)cc1Cl	ZINC000450801685	CE	On-Demand	Anodyne	OPRK1	24	42
CCc1nc(C)c(NC(=O)Cc2ccc(O)c(OC)c2)s1	ZINC000450801689	DF	On-Demand	Anodyne	TRPV1	28	48
CCc1nc(C)c(NC(=O)Cc2ccc(O)c(OC)c2)s1	ZINC000450801689	DF	On-Demand	Anodyne	MAPK9	0	40
CCc1nc(C)c(NC(=O)Cc2ccc(O)c(OC)c2)s1	ZINC000450801689	DF	On-Demand	Anodyne	MAPK10	0	45
CCc1nc(C)c(NC(=O)Cc2ccc(O)c(OC)c2)s1	ZINC000450801689	DF	On-Demand	Anodyne	NCE103	27	41
CCc1nc(C)c(NC(=O)Cc2ccc(O)c(OC)c2)s1	ZINC000450801689	DF	On-Demand	Anodyne	CAN2	0	41
Cc1ccc(C2CCN(C(=O)c3ccc(C)nc3C(C)C)CC2)cn1	ZINC000450801700	EI	On-Demand	Anodyne	FASN	44	37
COc1cc2c(N3CC(=O)N[C@H](C)C3)ncnc2cc1F	ZINC000450801718	CD	On-Demand	Anodyne	PDGFRB	45	37
COc1cc2c(N3CC(=O)N[C@@H](C)C3)ncnc2cc1F	ZINC000450801719	CD	On-Demand	Anodyne	PDGFRB	45	37
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@H](C)O)CC3)ccc21	ZINC000450801765	GE	On-Demand	Anodyne	HTR1A	61	43
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@H](C)O)CC3)ccc21	ZINC000450801765	GE	On-Demand	Anodyne	DRD2	45	43
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@H](C)O)CC3)ccc21	ZINC000450801765	GE	On-Demand	Anodyne	ADRA1D	40	39
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@H](C)O)CC3)ccc21	ZINC000450801765	GE	On-Demand	Anodyne	DRD3	51	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@H](C)O)CC3)ccc21	ZINC000450801765	GE	On-Demand	Anodyne	PDGFRB	23	42
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@H](C)O)CC3)ccc21	ZINC000450801765	GE	On-Demand	Anodyne	PLK1	68	34
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@H](C)O)CC3)ccc21	ZINC000450801765	GE	On-Demand	Anodyne	HPGD	63	73
CCn1c(SCc2nc(C(=O)OC)co2)nc2ccsc2c1=O	ZINC000450801787	FF	On-Demand	Anodyne	PDE7A	15	45
CO[C@H](Cc1ccccc1)C(=O)N(C)[C@@H]1CCCC[C@H]1O	ZINC000450801795	CE	On-Demand	Anodyne	AMY2	45	32
CO[C@@H](Cc1ccccc1)C(=O)N(C)[C@@H]1CCCC[C@H]1O	ZINC000450801796	CE	On-Demand	Anodyne	AMY2	45	32
CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CC(C)(CO)C2)nc1	ZINC000450801797	FE	On-Demand	Anodyne	RORC	17	41
Cc1cc(N2CC(C)(CO)C2)nc(-c2ccccn2)n1	ZINC000450801808	CD	On-Demand	Anodyne	METAP1	46	40
Cc1nc2ccnn2cc1C(=O)N1CCN(C)C(=O)[C@@H]1C	ZINC000450801815	CC	On-Demand	Anodyne	HCRTR1	44	34
Cc1nc2ccnn2cc1C(=O)N1CCN(C)C(=O)[C@H]1C	ZINC000450801816	CC	On-Demand	Anodyne	HCRTR1	44	34
CCOC(=O)c1ccc(N2CC(NC(=O)CNS(=O)(=O)NC)C2)nc1	ZINC000450801821	FA	On-Demand	Anodyne	P2RY12	27	43
CC1(CO)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450801827	DE	On-Demand	Anodyne	PDGFRB	28	40
CN(C(=O)Cc1ccc(OC(F)F)c(F)c1)[C@@H]1CCCC[C@H]1O	ZINC000450801832	EF	On-Demand	Anodyne	OPRK1	0	43
CC1(CO)CN(c2nc(-c3ccccc3)c3ccccc3n2)C1	ZINC000450801838	DG	On-Demand	Anodyne	TACR3	44	33
COc1ccc(OC(F)(F)F)c(C(=O)N2CCN(CC(C)C)C(=O)C2)c1	ZINC000450801865	FF	On-Demand	Anodyne	P2RX7	0	53
COc1ccc(OC(F)(F)F)c(C(=O)N2CCN(CC(C)C)C(=O)C2)c1	ZINC000450801865	FF	On-Demand	Anodyne	SLC6A9	26	41
CC1(CO)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450801866	GE	On-Demand	Bother	BCL2L1	45	36
CC1(CO)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450801866	GE	On-Demand	Bother	LIMK2	45	35
CC1(CO)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450801866	GE	On-Demand	Bother	MGAT2	0	40
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801883	FH	On-Demand	Anodyne	MC4R	39	43
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801883	FH	On-Demand	Anodyne	PRCP	53	40
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801883	FH	On-Demand	Anodyne	MC3R	51	43
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801883	FH	On-Demand	Anodyne	MC5R	36	43
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801885	FH	On-Demand	Anodyne	MC4R	39	43
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801885	FH	On-Demand	Anodyne	PRCP	53	40
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801885	FH	On-Demand	Anodyne	MC3R	51	43
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801885	FH	On-Demand	Anodyne	MC5R	36	43
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801886	FH	On-Demand	Anodyne	MC4R	39	43
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801886	FH	On-Demand	Anodyne	PRCP	53	40
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801886	FH	On-Demand	Anodyne	MC3R	51	43
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801886	FH	On-Demand	Anodyne	MC5R	36	43
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801887	FH	On-Demand	Anodyne	MC4R	39	43
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801887	FH	On-Demand	Anodyne	PRCP	53	40
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801887	FH	On-Demand	Anodyne	MC3R	51	43
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450801887	FH	On-Demand	Anodyne	MC5R	36	43
CCS(=O)(=O)c1ccc(Cn2cc(C(=O)OC)cc([N+](=O)[O-])c2=O)cc1	ZINC000450801891	GD	On-Demand	Bother	RORC	46	33
CCSc1cc(CNC(=O)[C@H]2CCN(c3ccccc3)C2)ccn1	ZINC000450801901	EG	On-Demand	Anodyne	GPBAR1	23	41
CCSc1cc(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)ccn1	ZINC000450801902	EG	On-Demand	Anodyne	GPBAR1	23	41
CC(C)CN1CCN(C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)CC1=O	ZINC000450801922	GC	On-Demand	Anodyne	SLC16A1	56	35
C=C[C@@H]1OCCC[C@H]1Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450801926	FE	On-Demand	Mild	L3MBTL3	24	42
Cc1cc(C(=O)NCCCCCc2ccc(F)cc2)ncc1C(N)=O	ZINC000450801927	EF	On-Demand	Anodyne	SCNN1A	51	32
CC(=O)c1cn(CC(=O)NCCCCCc2ccc(F)cc2)nn1	ZINC000450801931	EE	On-Demand	Anodyne	SCNN1A	42	35
CC(=O)c1cn(CC(=O)NCCCCCc2ccc(F)cc2)nn1	ZINC000450801931	EE	On-Demand	Anodyne	PLA2G7	22	46
CC(C)[C@@H]1CN(c2ccc(C#N)cn2)[C@@H]1C(C)C	ZINC000450801957	BG	On-Demand	Mild	SGPL1	0	44
CC(C)[C@H]1CN(c2ccc(C#N)cn2)[C@H]1C(C)C	ZINC000450801958	BG	On-Demand	Mild	SGPL1	0	44
CC(C)[C@H]1CN(c2ccc(C#N)cn2)[C@@H]1C(C)C	ZINC000450801959	BG	On-Demand	Mild	SGPL1	0	44
CC(C)[C@H]1[C@H](C(C)C)CN1c1ccc(C#N)cn1	ZINC000450801960	BG	On-Demand	Mild	SGPL1	0	44
O=C(c1csc(Nc2cc(F)cc(F)c2)n1)N1CCC(O)(C(F)F)CC1	ZINC000450801965	GF	On-Demand	Anodyne	TRPC6	85	46
O=C(c1csc(Nc2cc(F)cc(F)c2)n1)N1CCC(O)(C(F)F)CC1	ZINC000450801965	GF	On-Demand	Anodyne	TRPC3	63	46
CC(C)OC(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450801981	CE	On-Demand	Anodyne	PLA2G4B	42	35
CC(C)OC(=O)c1ccc(OCC[C@H](C)O)cc1	ZINC000450801982	CE	On-Demand	Anodyne	PLA2G4B	42	35
Cc1ccncc1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450802015	FE	On-Demand	Bother	LRRK2	19	41
CS(=O)(=O)C[C@H]1CCCCN1c1ccc(C(F)(F)F)cn1	ZINC000450802018	DF	On-Demand	Anodyne	CXCR3	0	46
CS(=O)(=O)C[C@@H]1CCCCN1c1ccc(C(F)(F)F)cn1	ZINC000450802019	DF	On-Demand	Anodyne	CXCR3	0	46
Cc1nc([C@@H]2CCCN2C(=O)C(CC(C)C)CC(C)C)cs1	ZINC000450802020	DJ	On-Demand	Anodyne	ADAM17	31	49
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@H](C)O	ZINC000450802024	DG	On-Demand	Anodyne	PRNP	60	33
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@H](C)O	ZINC000450802024	DG	On-Demand	Anodyne	P4HTM	0	52
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@@H](C)O	ZINC000450802025	DG	On-Demand	Anodyne	PRNP	60	33
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@@H](C)O	ZINC000450802025	DG	On-Demand	Anodyne	P4HTM	0	52
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@@H](C)O	ZINC000450802026	DG	On-Demand	Anodyne	PRNP	60	33
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@@H](C)O	ZINC000450802026	DG	On-Demand	Anodyne	P4HTM	0	52
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@H](C)O	ZINC000450802027	DG	On-Demand	Anodyne	PRNP	60	33
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@H](C)O	ZINC000450802027	DG	On-Demand	Anodyne	P4HTM	0	52
Cc1ccncc1CNc1nc(-c2ccccn2)nc2c1CCC2	ZINC000450802028	DF	On-Demand	Anodyne	METAP1	29	40
COc1cccc(SCCC(C)(F)F)c1	ZINC000450802044	BH	On-Demand	Anodyne	MTNR1B	15	41
CC[C@H](O)CC(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450802045	CE	On-Demand	Anodyne	TBXAS1	27	41
CC[C@@H](O)CC(=O)N1CCC(CCCn2ccnc2)CC1	ZINC000450802046	CE	On-Demand	Anodyne	TBXAS1	27	41
CC[C@@H](Nc1ncc(C#N)cc1Cl)[C@@H](C)O	ZINC000450802048	BE	On-Demand	Mild	IRAK4	15	41
CC[C@@H](Nc1ncc(C#N)cc1Cl)[C@H](C)O	ZINC000450802049	BE	On-Demand	Mild	IRAK4	15	41
CC[C@H](Nc1ncc(C#N)cc1Cl)[C@@H](C)O	ZINC000450802050	BE	On-Demand	Mild	IRAK4	15	41
CC[C@H](Nc1ncc(C#N)cc1Cl)[C@H](C)O	ZINC000450802051	BE	On-Demand	Mild	IRAK4	15	41
C[C@H](O)CN1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450802070	ED	On-Demand	Anodyne	P2RY12	45	35
C[C@H](O)CN1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450802070	ED	On-Demand	Anodyne	P2RX3	22	45
CC[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)[C@H](C)O	ZINC000450802083	CD	On-Demand	Anodyne	PRCP	17	41
CC[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)[C@H](C)O	ZINC000450802084	CD	On-Demand	Anodyne	PRCP	17	41
CC[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)[C@@H](C)O	ZINC000450802085	CD	On-Demand	Anodyne	PRCP	17	41
CC[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)[C@@H](C)O	ZINC000450802086	CD	On-Demand	Anodyne	PRCP	17	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCN(C)C(=O)[C@@H]3C)cc2)c1	ZINC000450802095	GE	On-Demand	Anodyne	CHRM3	15	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCN(C)C(=O)[C@H]3C)cc2)c1	ZINC000450802096	GE	On-Demand	Anodyne	CHRM3	15	43
CN(C(=O)c1csc(Nc2cc(F)cc(F)c2)n1)[C@@H]1CCCC[C@H]1O	ZINC000450802121	FF	On-Demand	Anodyne	TRPC6	70	41
CN(C(=O)c1csc(Nc2cc(F)cc(F)c2)n1)[C@@H]1CCCC[C@H]1O	ZINC000450802121	FF	On-Demand	Anodyne	TRPC3	55	41
Cc1cc(CNC(=O)[C@@H]2CCCN(C)C2=O)ccc1-c1ccccc1	ZINC000450802150	EG	On-Demand	Anodyne	TMPRSS11D	47	33
Cc1cc(CNC(=O)[C@H]2CCCN(C)C2=O)ccc1-c1ccccc1	ZINC000450802151	EG	On-Demand	Anodyne	TMPRSS11D	47	33
NC(=O)[C@H]1CCCN1c1ncnc2cc(F)c(F)cc12	ZINC000450802195	CD	On-Demand	Anodyne	SIRT3	43	34
CC[C@@]1(CO)CCCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000450802200	DF	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)c1ccc(C#N)n1C	ZINC000450802206	DE	On-Demand	Mild	CTRB_BOVIN	49	36
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)c1ccc(C#N)n1C	ZINC000450802207	DE	On-Demand	Mild	CTRB_BOVIN	49	36
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCCC[C@@H](C)O	ZINC000450802222	FE	On-Demand	Bother	SLC5A1	22	49
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCCC[C@H](C)O	ZINC000450802223	FE	On-Demand	Bother	SLC5A1	22	49
CCSc1cc(CNC(=O)c2cccc(C(F)(F)F)n2)ccn1	ZINC000450802234	EH	On-Demand	Anodyne	MMP13	15	46
CCSc1cc(CNC(=O)c2cccc(C(F)(F)F)n2)ccn1	ZINC000450802234	EH	On-Demand	Anodyne	CARM1	60	36
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCC2=CCCCC2)C1=O	ZINC000450802240	EG	On-Demand	Bother	CACNA1D	46	30
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCC2=CCCCC2)C1=O	ZINC000450802241	EG	On-Demand	Bother	CACNA1D	46	30
COc1cccc(OCCC(=O)N2C[C@H]3[C@H](O)CC[C@H]3C2)c1	ZINC000450802242	DD	On-Demand	Anodyne	MTNR1A	22	43
COc1cccc(OCCC(=O)N2C[C@H]3[C@@H](O)CC[C@H]3C2)c1	ZINC000450802243	DD	On-Demand	Anodyne	MTNR1A	22	43
COc1cccc(OCCC(=O)N2C[C@@H]3CC[C@H](O)[C@H]3C2)c1	ZINC000450802244	DD	On-Demand	Anodyne	MTNR1A	22	43
COc1cccc(OCCC(=O)N2C[C@@H]3CC[C@@H](O)[C@H]3C2)c1	ZINC000450802245	DD	On-Demand	Anodyne	MTNR1A	22	43
C=C[C@@H]1OCCC[C@H]1Nc1ncnc2ccc(SC)cc12	ZINC000450802261	DG	On-Demand	Mild	CD38	47	42
COCC[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1	ZINC000450802266	GH	On-Demand	Bother	TAAR1	22	45
COCC[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1	ZINC000450802267	GH	On-Demand	Bother	TAAR1	22	45
CCC(=O)C1(C(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)CC1	ZINC000450802268	EI	On-Demand	Anodyne	E1	0	44
CCC(=O)C1(C(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)CC1	ZINC000450802269	EI	On-Demand	Anodyne	E1	0	44
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1O[C@@H]1C[C@@H](C)CCC1=O	ZINC000450802288	GG	On-Demand	Bother	SLC27A4	44	32
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1O[C@H]1C[C@@H](C)CCC1=O	ZINC000450802289	GG	On-Demand	Bother	SLC27A4	44	32
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1O[C@@H]1C[C@H](C)CCC1=O	ZINC000450802290	GG	On-Demand	Bother	SLC27A4	44	32
CC1(CO)CN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450802295	CD	On-Demand	Anodyne	SORD	58	47
CCOC(=O)c1ccc(N2CC(NC(=O)CCOc3cccc(OC)c3)C2)nc1	ZINC000450802303	GE	On-Demand	Anodyne	P2RY12	28	43
CCOC(=O)c1ccc(N2CC(NC(=O)CCOc3cccc(OC)c3)C2)nc1	ZINC000450802303	GE	On-Demand	Anodyne	MTNR1A	23	46
CCOC(=O)c1ccc(N2CC(NC(=O)CCOc3cccc(OC)c3)C2)nc1	ZINC000450802303	GE	On-Demand	Anodyne	MTNR1B	26	46
CC1(CO)CN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450802304	CE	On-Demand	Anodyne	GRM5	27	45
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@H](C)[C@H](C)C2)cs1	ZINC000450802308	DI	On-Demand	Anodyne	COLA	22	41
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)cs1	ZINC000450802309	DI	On-Demand	Anodyne	COLA	22	41
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@H](C)[C@@H](C)C2)cs1	ZINC000450802310	DI	On-Demand	Anodyne	COLA	22	41
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)cs1	ZINC000450802311	DI	On-Demand	Anodyne	COLA	22	41
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)cs1	ZINC000450802311	DI	On-Demand	Anodyne	CPT1A	20	41
Cc1cc(N2CCCC[C@H]2CS(C)(=O)=O)nc(-c2ccccn2)n1	ZINC000450802312	EE	On-Demand	Anodyne	METAP1	16	40
Cc1cc(N2CCCC[C@@H]2CS(C)(=O)=O)nc(-c2ccccn2)n1	ZINC000450802313	EE	On-Demand	Anodyne	METAP1	16	40
CC[C@@H](Nc1ccnc2cc(F)ccc12)[C@@H](C)O	ZINC000450802319	BF	On-Demand	Anodyne	HRP1_PLAFA	17	41
CC[C@@H](Nc1ccnc2cc(F)ccc12)[C@@H](C)O	ZINC000450802319	BF	On-Demand	Anodyne	RBP_CHICK	0	41
CC[C@H](Nc1ccnc2cc(F)ccc12)[C@H](C)O	ZINC000450802321	BF	On-Demand	Anodyne	HRP1_PLAFA	17	41
CC[C@H](Nc1ccnc2cc(F)ccc12)[C@H](C)O	ZINC000450802321	BF	On-Demand	Anodyne	RBP_CHICK	0	41
CC[C@@H](Nc1ccnc2cc(F)ccc12)[C@H](C)O	ZINC000450802323	BF	On-Demand	Anodyne	HRP1_PLAFA	17	41
CC[C@@H](Nc1ccnc2cc(F)ccc12)[C@H](C)O	ZINC000450802323	BF	On-Demand	Anodyne	RBP_CHICK	0	41
CC[C@H](Nc1ccnc2cc(F)ccc12)[C@@H](C)O	ZINC000450802325	BF	On-Demand	Anodyne	HRP1_PLAFA	17	41
CC[C@H](Nc1ccnc2cc(F)ccc12)[C@@H](C)O	ZINC000450802325	BF	On-Demand	Anodyne	RBP_CHICK	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCN(C[C@H](C)O)CC3)cc2)c1	ZINC000450802326	GE	On-Demand	Anodyne	CHRM3	17	46
Cn1nc(-c2ccccc2)cc1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450802334	GF	On-Demand	Anodyne	TACR3	21	49
Cn1nc(-c2ccccc2)cc1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1	ZINC000450802334	GF	On-Demand	Anodyne	PKNB	41	43
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC[C@@H]1O	ZINC000450802361	EG	On-Demand	Anodyne	RBP4	73	41
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC[C@@H]1O	ZINC000450802361	EG	On-Demand	Anodyne	SFRP1	59	32
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC[C@@H]1O	ZINC000450802361	EG	On-Demand	Anodyne	WNT3	49	30
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC[C@H]1O	ZINC000450802362	EG	On-Demand	Anodyne	RBP4	73	41
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC[C@H]1O	ZINC000450802362	EG	On-Demand	Anodyne	SFRP1	59	32
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC[C@H]1O	ZINC000450802362	EG	On-Demand	Anodyne	WNT3	49	30
Cc1ccncc1CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450802368	GD	On-Demand	Bother	NAMPT	33	41
Cc1ccncc1CNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450802388	DE	On-Demand	Anodyne	PRCP	15	43
Cc1ccncc1CNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450802389	DE	On-Demand	Anodyne	PRCP	15	43
Cc1nc(N2CCCC[C@@H]2CS(C)(=O)=O)ccc1C#N	ZINC000450802400	CD	On-Demand	Mild	AR	16	42
Cc1nc(N2CCCC[C@H]2CS(C)(=O)=O)ccc1C#N	ZINC000450802401	CD	On-Demand	Mild	AR	16	42
Cc1ccc(CN(CCO)C(=O)CNC(=O)Nc2cccc(Cl)c2)cc1	ZINC000450802402	GF	On-Demand	Anodyne	PYGL	21	46
C[C@@]1(C(=O)N2CCC(CCCn3ccnc3)CC2)CC=CCC1	ZINC000450802416	DH	On-Demand	Anodyne	TBXAS1	20	40
CCS(=O)(=O)c1ccc(CSc2cccc(OC)c2)cc1	ZINC000450802419	DH	On-Demand	Anodyne	MTNR1A	16	47
CCS(=O)(=O)c1ccc(CSc2cccc(OC)c2)cc1	ZINC000450802419	DH	On-Demand	Anodyne	MTNR1B	19	40
CCOC(=O)c1ccc(N2CC(NC(=O)[C@@]3(C)CC=CCC3)C2)nc1	ZINC000450802424	EE	On-Demand	Anodyne	P2RY12	21	43
CCOC(=O)c1ccc(N2CC(NC(=O)[C@]3(C)CC=CCC3)C2)nc1	ZINC000450802427	EE	On-Demand	Anodyne	P2RY12	21	43
Cc1ccc2ncnc(N3C[C@@H](C4CC4)[C@H]3C3CC3)c2c1	ZINC000450802466	CH	On-Demand	Anodyne	PDE3B	57	31
Cc1ccc2ncnc(N3C[C@H](C4CC4)[C@H]3C3CC3)c2c1	ZINC000450802467	CH	On-Demand	Anodyne	PDE3B	57	31
Cc1ccc2ncnc(N3C[C@@H](C4CC4)[C@@H]3C3CC3)c2c1	ZINC000450802468	CH	On-Demand	Anodyne	PDE3B	57	31
Cc1ccc2ncnc(N3C[C@H](C4CC4)[C@@H]3C3CC3)c2c1	ZINC000450802469	CH	On-Demand	Anodyne	PDE3B	57	31
Cc1cc(N2C[C@@H](C3CC3)[C@H]2C2CC2)n2ncnc2n1	ZINC000450802477	CE	On-Demand	Anodyne	DHOD	0	44
Cc1cc(N2C[C@@H](C3CC3)[C@@H]2C2CC2)n2ncnc2n1	ZINC000450802478	CE	On-Demand	Anodyne	DHOD	0	44
Cc1cc(N2C[C@H](C3CC3)[C@@H]2C2CC2)n2ncnc2n1	ZINC000450802479	CE	On-Demand	Anodyne	DHOD	0	44
Cc1cc(N2C[C@H](C3CC3)[C@H]2C2CC2)n2ncnc2n1	ZINC000450802480	CE	On-Demand	Anodyne	DHOD	0	44
CC1(CO)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450802481	EF	On-Demand	Anodyne	CPT1A	54	32
CC1(CO)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450802481	EF	On-Demand	Anodyne	PRNP	47	48
CC1(CO)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450802481	EF	On-Demand	Anodyne	HDAC1	36	43
CC1(CO)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450802481	EF	On-Demand	Anodyne	BACE1	0	40
CC1(CO)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450802481	EF	On-Demand	Anodyne	TAAR1	38	48
CC1(CO)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450802481	EF	On-Demand	Anodyne	KCNK3	71	38
CC1(CO)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450802481	EF	On-Demand	Anodyne	KCNK9	41	41
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1O[C@H]1C[C@H](C)CCC1=O	ZINC000450802491	GG	On-Demand	Bother	SLC27A4	44	32
Cc1ccnc(N2C[C@H](C(C)C)[C@H]2C(C)C)n1	ZINC000450802494	BF	On-Demand	Anodyne	SORD	26	43
Cc1ccnc(N2C[C@H](C(C)C)[C@@H]2C(C)C)n1	ZINC000450802495	BF	On-Demand	Anodyne	SORD	26	43
Cc1ccnc(N2C[C@@H](C(C)C)[C@H]2C(C)C)n1	ZINC000450802496	BF	On-Demand	Anodyne	SORD	26	43
Cc1ccnc(N2C[C@@H](C(C)C)[C@@H]2C(C)C)n1	ZINC000450802497	BF	On-Demand	Anodyne	SORD	26	43
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450802517	FF	On-Demand	Anodyne	TRPV1	29	51
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450802517	FF	On-Demand	Anodyne	NCE103	26	41
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450802517	FF	On-Demand	Anodyne	CAN2	0	41
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450802518	FF	On-Demand	Anodyne	TRPV1	29	51
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450802518	FF	On-Demand	Anodyne	NCE103	26	41
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450802518	FF	On-Demand	Anodyne	CAN2	0	41
O=C(NCCCCCc1ccc(F)cc1)c1cnn(-c2ccncc2)c1	ZINC000450802522	FH	On-Demand	Anodyne	TBXAS1	0	41
O=C(NCCCCCc1ccc(F)cc1)c1cnn(-c2ccncc2)c1	ZINC000450802522	FH	On-Demand	Anodyne	PTAFR	20	43
O=C(NCCCCCc1ccc(F)cc1)c1cnn(-c2ccncc2)c1	ZINC000450802522	FH	On-Demand	Anodyne	PLA2G7	18	41
O=C(NCCCCCc1ccc(F)cc1)c1ccc2nccnc2n1	ZINC000450802532	EG	On-Demand	Anodyne	SCNN1A	47	32
O=C([C@H]1CCC[C@@H]1c1ccccc1)N1CCC(O)(C(F)F)CC1	ZINC000450802536	DG	On-Demand	Anodyne	PREP	18	41
O=C([C@H]1CCC[C@H]1c1ccccc1)N1CCC(O)(C(F)F)CC1	ZINC000450802537	DG	On-Demand	Anodyne	PREP	18	41
O=C([C@@H]1CCC[C@@H]1c1ccccc1)N1CCC(O)(C(F)F)CC1	ZINC000450802538	DG	On-Demand	Anodyne	PREP	18	41
O=C([C@@H]1CCC[C@H]1c1ccccc1)N1CCC(O)(C(F)F)CC1	ZINC000450802539	DG	On-Demand	Anodyne	PREP	18	41
CNC(=O)c1ccc(OCC(=O)CC(C)(C)C2CC2)cc1	ZINC000450802545	CF	On-Demand	Anodyne	PLA2G4B	70	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450802557	EG	On-Demand	Anodyne	CACNA1B	42	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450802557	EG	On-Demand	Anodyne	CCR5	28	42
Cc1nn(C)cc1CC(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450802590	EH	On-Demand	Anodyne	HTR2A	21	41
Cc1nn(C)cc1CC(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450802590	EH	On-Demand	Anodyne	E1	0	50
CSc1ccc2ncnc(N3CC(C)(CO)C3)c2c1	ZINC000450802601	CE	On-Demand	Anodyne	PDGFRB	23	41
CSc1ccc2ncnc(N3CC(C)(CO)C3)c2c1	ZINC000450802601	CE	On-Demand	Anodyne	HTT	0	43
CC1(CO)CN(c2cnc3cc(Cl)c(Cl)cc3n2)C1	ZINC000450802621	CF	On-Demand	Anodyne	SORD	20	50
CS[C@H](CNC(=O)c1c(C)cccc1Cl)C(C)(C)C	ZINC000450802631	CI	On-Demand	Anodyne	ECR	41	39
CS[C@@H](CNC(=O)c1c(C)cccc1Cl)C(C)(C)C	ZINC000450802632	CI	On-Demand	Anodyne	ECR	41	39
COCC[C@@H](Cc1ccco1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450802634	EE	On-Demand	Anodyne	HPGDS	17	41
COCC[C@H](Cc1ccco1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450802635	EE	On-Demand	Anodyne	HPGDS	17	41
C[C@H](O)CN1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450802674	DD	On-Demand	Anodyne	ABCB1	45	36
C[C@H](O)CN1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450802675	DD	On-Demand	Anodyne	ABCB1	45	36
COCC[C@@H](Cc1ccco1)NC(=O)[C@H](O)C1CCC1	ZINC000450802686	CD	On-Demand	Anodyne	NPPA	41	33
COCC[C@@H](Cc1ccco1)NC(=O)[C@@H](O)C1CCC1	ZINC000450802688	CD	On-Demand	Anodyne	NPPA	41	33
COCC[C@H](Cc1ccco1)NC(=O)[C@@H](O)C1CCC1	ZINC000450802689	CD	On-Demand	Anodyne	NPPA	41	33
COc1ccc(CNC(=O)CCSc2nc3ccccc3nc2C)c(OC)c1	ZINC000450802691	GH	On-Demand	Anodyne	MTNR1A	58	38
COc1ccc(CNC(=O)CCSc2nc3ccccc3nc2C)c(OC)c1	ZINC000450802691	GH	On-Demand	Anodyne	MTNR1B	55	38
COc1ccc(CNC(=O)CCSc2nc3ccccc3nc2C)c(OC)c1	ZINC000450802691	GH	On-Demand	Anodyne	TNKS	45	32
Cc1cc(C)nc(N2CCN(C(=O)c3ccc(C)nc3C(C)C)CC2)n1	ZINC000450802692	FF	On-Demand	Anodyne	SLC6A7	0	43
COCC[C@H](Cc1ccco1)NC(=O)[C@H](O)C1CCC1	ZINC000450802694	CD	On-Demand	Anodyne	NPPA	41	33
CCc1cc2c(NCc3cnccc3C)ncnc2s1	ZINC000450802698	CH	On-Demand	Anodyne	CLK4	49	36
C[C@H](O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802699	FE	On-Demand	Anodyne	MC4R	94	45
C[C@H](O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802699	FE	On-Demand	Anodyne	PRCP	58	40
C[C@H](O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802699	FE	On-Demand	Anodyne	MC5R	15	45
C[C@H](O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802701	FE	On-Demand	Anodyne	MC4R	94	45
C[C@H](O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802701	FE	On-Demand	Anodyne	PRCP	58	40
C[C@H](O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802701	FE	On-Demand	Anodyne	MC5R	15	45
C[C@H](O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802703	FE	On-Demand	Anodyne	MC4R	94	45
C[C@H](O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802703	FE	On-Demand	Anodyne	PRCP	58	40
C[C@H](O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802703	FE	On-Demand	Anodyne	MC5R	15	45
C[C@H](O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802706	FE	On-Demand	Anodyne	MC4R	94	45
C[C@H](O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802706	FE	On-Demand	Anodyne	PRCP	58	40
C[C@H](O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450802706	FE	On-Demand	Anodyne	MC5R	15	45
CSc1c(F)cc(NC(=O)[C@@H]2CCC(=O)N2C)cc1F	ZINC000450802708	DE	On-Demand	Anodyne	P2RX7	18	46
CSc1c(F)cc(NC(=O)[C@H]2CCC(=O)N2C)cc1F	ZINC000450802710	DE	On-Demand	Anodyne	P2RX7	18	46
Cc1nc([C@@H]2CCCN2C(=O)CCCC(=O)C(C)(C)C)cs1	ZINC000450802711	DH	On-Demand	Anodyne	COLA	48	44
Cc1nc([C@@H]2CCCN2C(=O)CCCC(=O)C(C)(C)C)cs1	ZINC000450802711	DH	On-Demand	Anodyne	CPT1A	48	44
COc1ccc2c(c1)CN(c1ccc(S(=O)(=O)N3CCCC3)cn1)CCO2	ZINC000450802727	GE	On-Demand	Anodyne	PKM	42	49
CCn1c(SC2CC(OC(C)(C)C)C2)nc2ccsc2c1=O	ZINC000450802739	EH	On-Demand	Anodyne	PDE7A	26	48
CC[C@H](Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)[C@@H](C)O	ZINC000450802740	FF	On-Demand	Anodyne	MTNN	40	32
CC[C@H](Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)[C@@H](C)O	ZINC000450802740	FF	On-Demand	Anodyne	MGAT1	43	30
CC[C@H](Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)[C@H](C)O	ZINC000450802741	FF	On-Demand	Anodyne	MTNN	40	32
CC[C@H](Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)[C@H](C)O	ZINC000450802741	FF	On-Demand	Anodyne	MGAT1	43	30
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)[C@@H](C)O	ZINC000450802742	FF	On-Demand	Anodyne	MTNN	40	32
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)[C@@H](C)O	ZINC000450802742	FF	On-Demand	Anodyne	MGAT1	43	30
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)[C@H](C)O	ZINC000450802743	FF	On-Demand	Anodyne	MTNN	40	32
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1)[C@H](C)O	ZINC000450802743	FF	On-Demand	Anodyne	MGAT1	43	30
COc1cc(CC(=O)N2CCC[C@H]2c2csc(C)n2)ccc1Cl	ZINC000450802758	FI	On-Demand	Anodyne	OPRM1	0	46
COc1cc(CC(=O)N2CCC[C@H]2c2csc(C)n2)ccc1Cl	ZINC000450802758	FI	On-Demand	Anodyne	OPRK1	49	46
COc1cc(CC(=O)N2CCC[C@H]2c2csc(C)n2)ccc1Cl	ZINC000450802758	FI	On-Demand	Anodyne	HCRTR1	17	43
COc1cc(CC(=O)N2CCC[C@H]2c2csc(C)n2)ccc1Cl	ZINC000450802758	FI	On-Demand	Anodyne	COLA	67	46
COc1cc(CC(=O)N2CCC[C@H]2c2csc(C)n2)ccc1Cl	ZINC000450802758	FI	On-Demand	Anodyne	CPT1A	63	46
CN1CCC[C@@H](C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)C1=O	ZINC000450802768	EG	On-Demand	Mild	PFKFB3	68	39
CN1CCC[C@H](C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)C1=O	ZINC000450802769	EG	On-Demand	Mild	PFKFB3	68	39
Cc1nn(C)cc1CC(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450802814	EH	On-Demand	Anodyne	HTR2A	21	41
Cc1nn(C)cc1CC(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450802814	EH	On-Demand	Anodyne	E1	0	50
CNC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450802817	BD	On-Demand	Anodyne	SLC2A1	0	42
CNC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450802817	BD	On-Demand	Anodyne	HT1	0	42
CNC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450802817	BD	On-Demand	Anodyne	LMGT2	0	42
CNC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450802818	BD	On-Demand	Anodyne	SLC2A1	0	42
CNC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450802818	BD	On-Demand	Anodyne	HT1	0	42
CNC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450802818	BD	On-Demand	Anodyne	LMGT2	0	42
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CCC(O)(C(F)F)CC1	ZINC000450802829	GG	On-Demand	Anodyne	HRH4	30	52
O=C(Cc1ccc(O)c(F)c1)NCCCCCc1ccc(F)cc1	ZINC000450802841	EH	On-Demand	Anodyne	LIPC	0	45
O=C(Cc1ccc(O)c(F)c1)NCCCCCc1ccc(F)cc1	ZINC000450802841	EH	On-Demand	Anodyne	GRIA1	56	35
O=C(Cc1ccc(O)c(F)c1)NCCCCCc1ccc(F)cc1	ZINC000450802841	EH	On-Demand	Anodyne	LEF	48	34
O=C(Cc1ccc(O)c(F)c1)NCCCCCc1ccc(F)cc1	ZINC000450802841	EH	On-Demand	Anodyne	NCE103	29	47
O=C(Cc1ccc(O)c(F)c1)NCCCCCc1ccc(F)cc1	ZINC000450802841	EH	On-Demand	Anodyne	P96878_MYCTU	15	46
O=C(Cc1ccc(O)c(F)c1)NCCCCCc1ccc(F)cc1	ZINC000450802841	EH	On-Demand	Anodyne	CAN2	0	47
CCCOc1ccc(C(=O)N2CC[C@@H]3CCC[C@@H]32)c(OC)c1	ZINC000450802843	DG	On-Demand	Anodyne	OXTR	23	40
CCCOc1ccc(C(=O)N2CC[C@H]3CCC[C@@H]32)c(OC)c1	ZINC000450802844	DG	On-Demand	Anodyne	OXTR	23	40
CCCOc1ccc(C(=O)N2CC[C@H]3CCC[C@H]32)c(OC)c1	ZINC000450802845	DG	On-Demand	Anodyne	OXTR	23	40
CCCOc1ccc(C(=O)N2CC[C@@H]3CCC[C@H]32)c(OC)c1	ZINC000450802846	DG	On-Demand	Anodyne	OXTR	23	40
CNC(=O)c1ccc(OC[C@H]2CCCC2(F)F)cc1	ZINC000450802853	CF	On-Demand	Anodyne	KCNQ1	0	47
CNC(=O)c1ccc(OC[C@@H]2CCCC2(F)F)cc1	ZINC000450802854	CF	On-Demand	Anodyne	KCNQ1	0	47
Cn1c(C(=O)NCCCCCc2ccc(F)cc2)c2n(c1=O)CCCC2	ZINC000450802863	FF	On-Demand	Anodyne	PLD2	44	34
CC(=O)CCCCCN1C(=O)[C@H](c2ccccc2)N(Cc2ccccc2)C1=O	ZINC000450802868	GI	On-Demand	Anodyne	POL	0	44
CC(=O)CCCCCN1C(=O)[C@@H](c2ccccc2)N(Cc2ccccc2)C1=O	ZINC000450802869	GI	On-Demand	Anodyne	POL	0	44
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2nnc(C3CC3)s2)C1=O	ZINC000450802872	FE	On-Demand	Bother	CACNA1D	49	32
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2nnc(C3CC3)s2)C1=O	ZINC000450802873	FE	On-Demand	Bother	CACNA1D	49	32
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(Cc1ccccc1Cl)CC2	ZINC000450802898	GJ	On-Demand	Anodyne	TACR3	25	43
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(Cc1ccccc1Cl)CC2	ZINC000450802899	GJ	On-Demand	Anodyne	TACR3	25	43
CCOCc1nc(C)c(C(=O)NCc2ccnc(SCC)c2)s1	ZINC000450802913	FG	On-Demand	Anodyne	SCD1	44	41
Cc1ccncc1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450802919	EG	On-Demand	Bother	TAAR1	18	45
COc1ccc(Cn2ccc(NC(=O)CCCC(=O)C3CC3)n2)cc1	ZINC000450802922	EE	On-Demand	Anodyne	HDAC1	15	43
COc1ccc(Cn2ccc(NC(=O)CCCC(=O)C3CC3)n2)cc1	ZINC000450802922	EE	On-Demand	Anodyne	HDAC7	31	43
CCN(C[C@@H](O)C(F)(F)F)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450802923	FH	On-Demand	Anodyne	GPR88	0	50
CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450802929	GE	On-Demand	Anodyne	PIK3CD	15	40
CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450802929	GE	On-Demand	Anodyne	PIK3CB	25	40
CCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450802930	GE	On-Demand	Anodyne	PIK3CD	15	40
CCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450802930	GE	On-Demand	Anodyne	PIK3CB	25	40
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@H](C)O	ZINC000450802935	DF	On-Demand	Anodyne	GALR1	40	34
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@H](C)O	ZINC000450802935	DF	On-Demand	Anodyne	NPBWR1	42	41
CC[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@@H](C)O	ZINC000450802936	DF	On-Demand	Anodyne	GALR1	40	34
CC[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@@H](C)O	ZINC000450802936	DF	On-Demand	Anodyne	NPBWR1	42	41
CC[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@H](C)O	ZINC000450802937	DF	On-Demand	Anodyne	GALR1	40	34
CC[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@H](C)O	ZINC000450802937	DF	On-Demand	Anodyne	NPBWR1	42	41
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@@H](C)O	ZINC000450802938	DF	On-Demand	Anodyne	GALR1	40	34
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@@H](C)O	ZINC000450802938	DF	On-Demand	Anodyne	NPBWR1	42	41
COc1ccc(CC(=O)N2CCN(C[C@H](C)O)CC2)c(Cl)c1OC	ZINC000450802962	FD	On-Demand	Anodyne	SLC9A1	44	31
CC[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450802986	FE	On-Demand	Bother	BDKRB1	27	52
CC[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450802986	FE	On-Demand	Bother	COLA	84	35
CC[C@@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450802987	FE	On-Demand	Bother	BDKRB1	27	52
CC[C@@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450802987	FE	On-Demand	Bother	COLA	84	35
CC[C@@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450802988	FE	On-Demand	Bother	BDKRB1	27	52
CC[C@@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450802988	FE	On-Demand	Bother	COLA	84	35
CC[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450802989	FE	On-Demand	Bother	BDKRB1	27	52
CC[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450802989	FE	On-Demand	Bother	COLA	84	35
CC[C@@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803002	DD	On-Demand	Bother	COLA	53	32
CC[C@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803003	DD	On-Demand	Bother	COLA	53	32
CC[C@@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803004	DD	On-Demand	Bother	COLA	53	32
CC[C@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803005	DD	On-Demand	Bother	COLA	53	32
CC[C@]1(CO)CCCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450803014	GH	On-Demand	Anodyne	HRH4	21	45
CC[C@@]1(CO)CCCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450803015	GH	On-Demand	Anodyne	HRH4	21	45
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)[C@H](O)C1CCC1	ZINC000450803023	CE	On-Demand	Anodyne	METAP2	23	43
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)[C@@H](O)C1CCC1	ZINC000450803024	CE	On-Demand	Anodyne	METAP2	23	43
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)[C@H](O)C1CCC1	ZINC000450803026	CE	On-Demand	Anodyne	METAP2	23	43
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)[C@@H](O)C1CCC1	ZINC000450803027	CE	On-Demand	Anodyne	METAP2	23	43
Cc1nc(C)n(CCCC(=O)NCCCCCc2ccc(F)cc2)n1	ZINC000450803053	EG	On-Demand	Anodyne	PLA2G7	27	41
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	DRD3	21	42
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	INHA	68	34
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	CNR2	32	42
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	TRPV1	24	49
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	MTNR1A	25	59
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	MTNR1B	24	59
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	GRIA1	44	32
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	SLC6A5	21	40
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	LEF	50	38
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	NCE103	39	53
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	P96878_MYCTU	27	53
COc1cc(CC(=O)NCCCCCc2ccc(F)cc2)ccc1O	ZINC000450803060	EH	On-Demand	Anodyne	CAN2	0	53
COC(=O)c1csc(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)n1	ZINC000450803108	GD	On-Demand	Bother	CACNA1C	65	40
COC(=O)c1csc(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)n1	ZINC000450803108	GD	On-Demand	Bother	CACNA1D	98	40
COC(=O)c1csc(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)n1	ZINC000450803110	GD	On-Demand	Bother	CACNA1C	65	40
COC(=O)c1csc(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)n1	ZINC000450803110	GD	On-Demand	Bother	CACNA1D	98	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450803126	DD	On-Demand	Anodyne	GHRHR	55	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450803126	DD	On-Demand	Anodyne	SLC12A5	64	35
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450803127	DD	On-Demand	Anodyne	GHRHR	55	32
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450803127	DD	On-Demand	Anodyne	SLC12A5	64	35
CC(C)CCCC(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450803159	CG	On-Demand	Anodyne	CPT1A	77	43
CC(C)CCCC(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450803161	CG	On-Demand	Anodyne	CPT1A	77	43
CC(C)(C)CCC1(O)CC(C(=O)N2CCCCC[C@H]2c2ncon2)C1	ZINC000450803210	EG	On-Demand	Anodyne	COLA	59	35
CC(C)(C)CCC1(O)CC(C(=O)N2CCCCC[C@H]2c2ncon2)C1	ZINC000450803210	EG	On-Demand	Anodyne	CPT1A	45	35
CC(C)(C)CCC1(O)CC(C(=O)N2CCCCC[C@@H]2c2ncon2)C1	ZINC000450803211	EG	On-Demand	Anodyne	COLA	59	35
CC(C)(C)CCC1(O)CC(C(=O)N2CCCCC[C@@H]2c2ncon2)C1	ZINC000450803211	EG	On-Demand	Anodyne	CPT1A	45	35
O=C(Cc1scnc1-c1ccccc1)N1CCC(CCCn2ccnc2)CC1	ZINC000450803216	GI	On-Demand	Anodyne	TBXAS1	38	42
CCc1cccc(C(=O)N2CCC[C@H]2c2csc(C)n2)n1	ZINC000450803217	DG	On-Demand	Anodyne	ADAM17	21	42
CCc1cccc(C(=O)N2CCC[C@H]2c2csc(C)n2)n1	ZINC000450803217	DG	On-Demand	Anodyne	COLA	41	39
COc1ccc2c(c1)CN(c1ncnc3ccc(C)cc13)CCO2	ZINC000450803218	DG	On-Demand	Anodyne	PDE3B	71	40
CC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450803219	EE	On-Demand	Anodyne	APP	16	41
CC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450803219	EE	On-Demand	Anodyne	MMP1	23	46
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450803220	EE	On-Demand	Anodyne	APP	16	41
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450803220	EE	On-Demand	Anodyne	MMP1	23	46
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450803221	EE	On-Demand	Anodyne	APP	16	41
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450803221	EE	On-Demand	Anodyne	MMP1	23	46
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450803222	EE	On-Demand	Anodyne	APP	16	41
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2nccn2C)C1=O	ZINC000450803222	EE	On-Demand	Anodyne	MMP1	23	46
CC[C@@H](Nc1ncnc2ccc(C)cc12)[C@H](C)O	ZINC000450803227	BF	On-Demand	Anodyne	HTT	0	40
CC[C@H](Nc1ncnc2ccc(C)cc12)[C@H](C)O	ZINC000450803228	BF	On-Demand	Anodyne	HTT	0	40
CC[C@H](Nc1ncnc2ccc(C)cc12)[C@@H](C)O	ZINC000450803229	BF	On-Demand	Anodyne	HTT	0	40
CC[C@@H](Nc1ncnc2ccc(C)cc12)[C@@H](C)O	ZINC000450803230	BF	On-Demand	Anodyne	HTT	0	40
COC(=O)[C@H](NC(=O)CC1CC(F)(F)C1)c1ccc(Cl)cc1Cl	ZINC000450803245	FH	On-Demand	Anodyne	SDH1	0	40
COC(=O)[C@@H](NC(=O)CC1CC(F)(F)C1)c1ccc(Cl)cc1Cl	ZINC000450803246	FH	On-Demand	Anodyne	SDH1	0	40
CC[C@@H](Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl)[C@H](C)O	ZINC000450803255	GH	On-Demand	Anodyne	CNR1	41	39
CC[C@H](Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl)[C@@H](C)O	ZINC000450803256	GH	On-Demand	Anodyne	CNR1	41	39
CC[C@H](Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl)[C@H](C)O	ZINC000450803257	GH	On-Demand	Anodyne	CNR1	41	39
CC[C@@H](Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl)[C@@H](C)O	ZINC000450803258	GH	On-Demand	Anodyne	CNR1	41	39
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450803323	GG	On-Demand	Anodyne	CA2	18	44
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450803323	GG	On-Demand	Anodyne	CTRB_BOVIN	48	36
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450803324	GG	On-Demand	Anodyne	CA2	18	44
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450803324	GG	On-Demand	Anodyne	CTRB_BOVIN	48	36
C[C@H](O)CN1CCN(C(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450803331	CC	On-Demand	Anodyne	OPRK1	0	42
C[C@H](O)CN1CCN(C(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450803331	CC	On-Demand	Anodyne	KCNJ1	47	36
C[C@H](O)CN1CCN(C(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450803331	CC	On-Demand	Anodyne	GPR183	0	40
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CC2=CCCCC2)C1=O	ZINC000450803333	EF	On-Demand	Bother	CACNA1D	53	31
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CC2=CCCCC2)C1=O	ZINC000450803334	EF	On-Demand	Bother	CACNA1D	53	31
CC[C@H](O)CC(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450803335	FH	On-Demand	Anodyne	CCR5	44	34
CC[C@H](O)CC(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450803335	FH	On-Demand	Anodyne	HSD17B2	0	41
CC[C@H](O)CC(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450803335	FH	On-Demand	Anodyne	GPR88	0	40
CC[C@H](O)CC(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450803336	FH	On-Demand	Anodyne	CCR5	44	34
CC[C@H](O)CC(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450803336	FH	On-Demand	Anodyne	HSD17B2	0	41
CC[C@H](O)CC(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450803336	FH	On-Demand	Anodyne	GPR88	0	40
CC[C@H](O)CC(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450803337	FH	On-Demand	Anodyne	CCR5	44	34
CC[C@H](O)CC(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450803337	FH	On-Demand	Anodyne	HSD17B2	0	41
CC[C@H](O)CC(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1	ZINC000450803337	FH	On-Demand	Anodyne	GPR88	0	40
CC[C@H](O)CC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450803338	FH	On-Demand	Anodyne	CCR5	44	34
CC[C@H](O)CC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450803338	FH	On-Demand	Anodyne	HSD17B2	0	41
CC[C@H](O)CC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1	ZINC000450803338	FH	On-Demand	Anodyne	GPR88	0	40
CC[C@]1(CO)CCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450803354	EF	On-Demand	Anodyne	TACR1	0	43
CC[C@]1(CO)CCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450803354	EF	On-Demand	Anodyne	CCR1	29	40
CC[C@@]1(CO)CCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450803357	EF	On-Demand	Anodyne	TACR1	0	43
CC[C@@]1(CO)CCCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450803357	EF	On-Demand	Anodyne	CCR1	29	40
C[C@@H](Sc1nnnn1CCN(C)C)C(=O)Nc1nccs1	ZINC000450803385	EC	On-Demand	Anodyne	MAP1	74	36
C[C@H](Sc1nnnn1CCN(C)C)C(=O)Nc1nccs1	ZINC000450803386	EC	On-Demand	Anodyne	MAP1	74	36
COCC[C@H](Nc1cc(N2CCOCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450803387	GH	On-Demand	Anodyne	SMG1	24	41
COCC[C@@H](Nc1cc(N2CCOCC2)ncn1)c1cccc(C(F)(F)F)c1	ZINC000450803388	GH	On-Demand	Anodyne	SMG1	24	41
C[C@@H]1CN(C(=O)[C@H]2CCN(c3ccccc3)C2)CCN1CCO	ZINC000450803418	DD	On-Demand	Anodyne	SLC6A1	49	32
C[C@@H]1CN(C(=O)[C@H]2CCN(c3ccccc3)C2)CCN1CCO	ZINC000450803418	DD	On-Demand	Anodyne	HRH3	27	41
C[C@H]1CN(C(=O)[C@H]2CCN(c3ccccc3)C2)CCN1CCO	ZINC000450803419	DD	On-Demand	Anodyne	SLC6A1	49	32
C[C@H]1CN(C(=O)[C@H]2CCN(c3ccccc3)C2)CCN1CCO	ZINC000450803419	DD	On-Demand	Anodyne	HRH3	27	41
C[C@@H]1CN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CCN1CCO	ZINC000450803420	DD	On-Demand	Anodyne	SLC6A1	49	32
C[C@@H]1CN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CCN1CCO	ZINC000450803420	DD	On-Demand	Anodyne	HRH3	27	41
C[C@H]1CN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CCN1CCO	ZINC000450803421	DD	On-Demand	Anodyne	SLC6A1	49	32
C[C@H]1CN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CCN1CCO	ZINC000450803421	DD	On-Demand	Anodyne	HRH3	27	41
CN(C)S(=O)(=O)N[C@H](CNc1ncnc2[nH]ccc12)C1CCCC1	ZINC000450803427	FC	On-Demand	Anodyne	JAK3	22	46
CN(C)S(=O)(=O)N[C@H](CNc1ncnc2[nH]ccc12)C1CCCC1	ZINC000450803427	FC	On-Demand	Anodyne	JAK1	49	36
CN(C)S(=O)(=O)N[C@H](CNc1ncnc2[nH]ccc12)C1CCCC1	ZINC000450803427	FC	On-Demand	Anodyne	JAK2	25	40
CN(C)S(=O)(=O)N[C@@H](CNc1ncnc2[nH]ccc12)C1CCCC1	ZINC000450803428	FC	On-Demand	Anodyne	JAK3	22	46
CN(C)S(=O)(=O)N[C@@H](CNc1ncnc2[nH]ccc12)C1CCCC1	ZINC000450803428	FC	On-Demand	Anodyne	JAK1	49	36
CN(C)S(=O)(=O)N[C@@H](CNc1ncnc2[nH]ccc12)C1CCCC1	ZINC000450803428	FC	On-Demand	Anodyne	JAK2	25	40
CS(=O)(=O)N1CC(CNC(=O)c2cc3ccncc3s2)C1	ZINC000450803445	EC	On-Demand	Anodyne	NAMPT	29	51
CCS(=O)(=O)C1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450803446	EE	On-Demand	Bother	AADAC	0	42
CS(=O)(=O)N1CC(CNC(=O)c2cc(Cl)c(F)cc2Br)C1	ZINC000450803465	GD	On-Demand	Anodyne	CACNA1I	40	30
CCS(=O)(=O)C1CN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C1	ZINC000450803466	EC	On-Demand	Bother	TAAR1	18	43
CC(=O)c1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)nc1	ZINC000450803481	GG	On-Demand	Anodyne	STAT6	58	36
CC(=O)c1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)nc1	ZINC000450803481	GG	On-Demand	Anodyne	HCN1	76	44
CC(=O)c1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)nc1	ZINC000450803481	GG	On-Demand	Anodyne	HCN4	51	33
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1	ZINC000450803482	DH	On-Demand	Mild	LIPG	56	39
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H]2C[C@H](O)CC[C@@H]2C1	ZINC000450803483	DH	On-Demand	Mild	LIPG	56	39
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H]2C[C@H](O)CC[C@H]2C1	ZINC000450803484	DH	On-Demand	Mild	LIPG	56	39
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1	ZINC000450803485	DH	On-Demand	Mild	LIPG	56	39
CCCOc1ccc(C(=O)N2CCN(CCO)[C@@H](C)C2)c(OC)c1	ZINC000450803489	ED	On-Demand	Anodyne	OXTR	0	42
CCCOc1ccc(C(=O)N2CCN(CCO)[C@H](C)C2)c(OC)c1	ZINC000450803490	ED	On-Demand	Anodyne	OXTR	0	42
CN(C)S(=O)(=O)N[C@@H](CNc1ccccc1[N+](=O)[O-])C1CCCC1	ZINC000450803505	FD	On-Demand	Bother	COLA	66	35
CN(C)S(=O)(=O)N[C@H](CNc1ccccc1[N+](=O)[O-])C1CCCC1	ZINC000450803506	FD	On-Demand	Bother	COLA	66	35
O=C(CCCC(=O)C1CC1)Nc1ccccc1-c1cn[nH]c1	ZINC000450803512	CG	On-Demand	Anodyne	ROCK2	49	38
Cn1c(C#N)ccc1C(=O)NCCCCCc1ccc(F)cc1	ZINC000450803520	DG	On-Demand	Mild	LIPG	15	40
Cc1ccc(C(=O)N2CCC(O)(C(F)F)CC2)c(Cl)c1Cl	ZINC000450803527	EH	On-Demand	Anodyne	P2RX7	34	42
CNc1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)c(OC)c2)cc1[N+](=O)[O-]	ZINC000450803538	GG	On-Demand	Bother	BDKRB1	23	43
C[C@@H](O)CCCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803539	DD	On-Demand	Bother	CACNA1C	44	36
C[C@@H](O)CCCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803539	DD	On-Demand	Bother	CACNA1D	81	35
C[C@H](O)CCCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803540	DD	On-Demand	Bother	CACNA1C	44	36
C[C@H](O)CCCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803540	DD	On-Demand	Bother	CACNA1D	81	35
C[C@@H](O)CCCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803541	DD	On-Demand	Bother	CACNA1C	44	36
C[C@@H](O)CCCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803541	DD	On-Demand	Bother	CACNA1D	81	35
C[C@H](O)CCCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803543	DD	On-Demand	Bother	CACNA1C	44	36
C[C@H](O)CCCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803543	DD	On-Demand	Bother	CACNA1D	81	35
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803544	GF	On-Demand	Bother	COLA	91	35
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803544	GF	On-Demand	Bother	MTNN	46	36
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803544	GF	On-Demand	Bother	BCL2L1	109	38
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803544	GF	On-Demand	Bother	BCL2	95	38
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803544	GF	On-Demand	Bother	BCL2L2	43	33
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803544	GF	On-Demand	Bother	LIMK2	42	36
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803546	GF	On-Demand	Bother	COLA	91	35
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803546	GF	On-Demand	Bother	MTNN	46	36
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803546	GF	On-Demand	Bother	BCL2L1	109	38
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803546	GF	On-Demand	Bother	BCL2	95	38
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803546	GF	On-Demand	Bother	BCL2L2	43	33
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803546	GF	On-Demand	Bother	LIMK2	42	36
O=S(=O)(c1cccnc1)N(CCc1ccc(Cl)cc1)C1CC1	ZINC000450803547	EG	On-Demand	Anodyne	TBXAS1	31	42
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803548	GF	On-Demand	Bother	COLA	91	35
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803548	GF	On-Demand	Bother	MTNN	46	36
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803548	GF	On-Demand	Bother	BCL2L1	109	38
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803548	GF	On-Demand	Bother	BCL2	95	38
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803548	GF	On-Demand	Bother	BCL2L2	43	33
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803548	GF	On-Demand	Bother	LIMK2	42	36
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803550	GF	On-Demand	Bother	COLA	91	35
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803550	GF	On-Demand	Bother	MTNN	46	36
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803550	GF	On-Demand	Bother	BCL2L1	109	38
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803550	GF	On-Demand	Bother	BCL2	95	38
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803550	GF	On-Demand	Bother	BCL2L2	43	33
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803550	GF	On-Demand	Bother	LIMK2	42	36
Cc1ccn(CC(=O)NCCCCCc2ccc(F)cc2)n1	ZINC000450803558	DF	On-Demand	Anodyne	PLA2G7	19	46
Cc1ccn(CC(=O)NCCCCCc2ccc(F)cc2)n1	ZINC000450803558	DF	On-Demand	Anodyne	HDAC7	18	42
CC(=O)N[C@H](C(=O)NCCCCCc1ccc(F)cc1)C(C)(C)C	ZINC000450803559	EG	On-Demand	Anodyne	SCNN1A	48	34
CC(=O)N[C@H](C(=O)NCCCCCc1ccc(F)cc1)C(C)(C)C	ZINC000450803559	EG	On-Demand	Anodyne	SDH1	0	41
CC(=O)N[C@H](C(=O)NCCCCCc1ccc(F)cc1)C(C)(C)C	ZINC000450803559	EG	On-Demand	Anodyne	MMP3	32	40
CC(=O)N[C@H](C(=O)NCCCCCc1ccc(F)cc1)C(C)(C)C	ZINC000450803559	EG	On-Demand	Anodyne	LEF	71	44
CC(=O)N[C@H](C(=O)NCCCCCc1ccc(F)cc1)C(C)(C)C	ZINC000450803559	EG	On-Demand	Anodyne	BIRC2	23	40
COc1cccc(OCCC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450803578	FG	On-Demand	Anodyne	CYP19A1	15	43
COc1cccc(OCCC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450803578	FG	On-Demand	Anodyne	TBXAS1	52	51
COc1cccc(OCCC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450803578	FG	On-Demand	Anodyne	HMOX2	28	47
COc1cccc(OCCC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450803578	FG	On-Demand	Anodyne	CYP24A1	31	41
COc1cccc(OCCC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450803578	FG	On-Demand	Anodyne	QPCT	28	41
COc1cccc(OCCC(=O)N2CCC(CCCn3ccnc3)CC2)c1	ZINC000450803578	FG	On-Demand	Anodyne	CYP27B1	47	41
CC(F)(F)CCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803589	EE	On-Demand	Bother	CACNA1C	43	36
CC(F)(F)CCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803589	EE	On-Demand	Bother	CACNA1D	70	36
CC(F)(F)CCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803590	EE	On-Demand	Bother	CACNA1C	43	36
CC(F)(F)CCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803590	EE	On-Demand	Bother	CACNA1D	70	36
CCNC(=O)c1ccc(N[C@@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803603	GI	On-Demand	Anodyne	MTTP	35	41
CCNC(=O)c1ccc(N[C@@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803603	GI	On-Demand	Anodyne	CCR2	50	36
CCNC(=O)c1ccc(N[C@@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803603	GI	On-Demand	Anodyne	EPHX2	0	42
CCNC(=O)c1ccc(N[C@@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803603	GI	On-Demand	Anodyne	GCK	24	40
CCNC(=O)c1ccc(N[C@@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803603	GI	On-Demand	Anodyne	SCD1	26	41
CCNC(=O)c1ccc(N[C@@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803603	GI	On-Demand	Anodyne	PDS	40	35
CCNC(=O)c1ccc(N[C@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803605	GI	On-Demand	Anodyne	MTTP	35	41
CCNC(=O)c1ccc(N[C@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803605	GI	On-Demand	Anodyne	CCR2	50	36
CCNC(=O)c1ccc(N[C@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803605	GI	On-Demand	Anodyne	EPHX2	0	42
CCNC(=O)c1ccc(N[C@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803605	GI	On-Demand	Anodyne	GCK	24	40
CCNC(=O)c1ccc(N[C@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803605	GI	On-Demand	Anodyne	SCD1	26	41
CCNC(=O)c1ccc(N[C@H](CCOC)c2cccc(C(F)(F)F)c2)nc1	ZINC000450803605	GI	On-Demand	Anodyne	PDS	40	35
CCc1nc(C)c(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)o1	ZINC000450803610	DE	On-Demand	Bother	MIF	16	40
CC[C@@H](Nc1ncnc2scc(-c3ccccc3)c12)[C@@H](C)O	ZINC000450803615	DH	On-Demand	Anodyne	ADRB3	28	43
CC[C@H](Nc1ncnc2scc(-c3ccccc3)c12)[C@H](C)O	ZINC000450803616	DH	On-Demand	Anodyne	ADRB3	28	43
CC[C@H](Nc1ncnc2scc(-c3ccccc3)c12)[C@@H](C)O	ZINC000450803617	DH	On-Demand	Anodyne	ADRB3	28	43
CC[C@@H](Nc1ncnc2scc(-c3ccccc3)c12)[C@H](C)O	ZINC000450803618	DH	On-Demand	Anodyne	ADRB3	28	43
CCC(CC)Oc1ccc(C(=O)N2CCN(C[C@H](C)O)CC2)cc1	ZINC000450803634	EE	On-Demand	Anodyne	HRH3	15	49
CCC(CC)Oc1ccc(C(=O)N2CCN(C[C@H](C)O)CC2)cc1	ZINC000450803634	EE	On-Demand	Anodyne	ABCB1	18	41
CC[C@H](Nc1ncnc2scc(-c3ccc(OC)cc3)c12)[C@@H](C)O	ZINC000450803637	EH	On-Demand	Anodyne	ADRB3	25	41
CC[C@@H](Nc1ncnc2scc(-c3ccc(OC)cc3)c12)[C@@H](C)O	ZINC000450803639	EH	On-Demand	Anodyne	ADRB3	25	41
CC[C@H](Nc1ncnc2scc(-c3ccc(OC)cc3)c12)[C@H](C)O	ZINC000450803642	EH	On-Demand	Anodyne	ADRB3	25	41
CC[C@@H](Nc1ncnc2scc(-c3ccc(OC)cc3)c12)[C@H](C)O	ZINC000450803644	EH	On-Demand	Anodyne	ADRB3	25	41
CC[C@@H](Nc1cncc(SCc2ccccc2)n1)[C@H](C)O	ZINC000450803651	DG	On-Demand	Anodyne	CX3CR1	46	36
CC[C@H](Nc1cncc(SCc2ccccc2)n1)[C@H](C)O	ZINC000450803652	DG	On-Demand	Anodyne	CX3CR1	46	36
CC[C@H](Nc1cncc(SCc2ccccc2)n1)[C@@H](C)O	ZINC000450803653	DG	On-Demand	Anodyne	CX3CR1	46	36
CC[C@@H](Nc1cncc(SCc2ccccc2)n1)[C@@H](C)O	ZINC000450803654	DG	On-Demand	Anodyne	CX3CR1	46	36
O=C1C(=O)N(C2CCCCC2)C(=O)N1CC/C=C\c1ccccc1	ZINC000450803669	EG	On-Demand	Anodyne	CACNA1C	0	43
O=C1C(=O)N(C2CCCCC2)C(=O)N1CC/C=C\c1ccccc1	ZINC000450803669	EG	On-Demand	Anodyne	CACNA1D	26	43
O=C1C(=O)N(C2CCCCC2)C(=O)N1CC/C=C/c1ccccc1	ZINC000450803670	EG	On-Demand	Anodyne	CACNA1C	0	43
O=C1C(=O)N(C2CCCCC2)C(=O)N1CC/C=C/c1ccccc1	ZINC000450803670	EG	On-Demand	Anodyne	CACNA1D	26	43
Cc1cc(C)nc(N2CCN(C(=O)[C@@H](O)C3CCC3)CC2)n1	ZINC000450803685	DC	On-Demand	Anodyne	SORD	22	42
CC(C)[C@@H]1CN(c2ccnc(C3CC3)n2)[C@@H]1C(C)C	ZINC000450803686	CG	On-Demand	Anodyne	SORD	45	32
CC(C)[C@H]1CN(c2ccnc(C3CC3)n2)[C@H]1C(C)C	ZINC000450803687	CG	On-Demand	Anodyne	SORD	45	32
CC(C)[C@H]1CN(c2ccnc(C3CC3)n2)[C@@H]1C(C)C	ZINC000450803688	CG	On-Demand	Anodyne	SORD	45	32
CC(C)[C@H]1[C@H](C(C)C)CN1c1ccnc(C2CC2)n1	ZINC000450803689	CG	On-Demand	Anodyne	SORD	45	32
Cc1cc(C)nc(N2CCN(C(=O)[C@H](O)C3CCC3)CC2)n1	ZINC000450803691	DC	On-Demand	Anodyne	SORD	22	42
CCn1nnc(C)c1CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803696	FD	On-Demand	Bother	CACNA1C	48	36
CCn1nnc(C)c1CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803696	FD	On-Demand	Bother	CACNA1D	76	34
CCn1nnc(C)c1CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803698	FD	On-Demand	Bother	CACNA1C	48	36
CCn1nnc(C)c1CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803698	FD	On-Demand	Bother	CACNA1D	76	34
Cc1ccc(C(=O)NCC2CN(S(C)(=O)=O)C2)c(Cl)c1Cl	ZINC000450803724	FD	On-Demand	Anodyne	CACNA1I	41	33
C[C@H]1CN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CCN1CCO	ZINC000450803725	EE	On-Demand	Anodyne	SLC6A7	0	41
C[C@@H]1CN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CCN1CCO	ZINC000450803726	EE	On-Demand	Anodyne	SLC6A7	0	41
CCc1cccc(C(=O)N2CCCCC[C@H]2c2ncon2)n1	ZINC000450803727	DF	On-Demand	Anodyne	COLA	113	43
CCc1cccc(C(=O)N2CCCCC[C@H]2c2ncon2)n1	ZINC000450803727	DF	On-Demand	Anodyne	CPT1A	97	40
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2ncon2)n1	ZINC000450803728	DF	On-Demand	Anodyne	COLA	113	43
CCc1cccc(C(=O)N2CCCCC[C@@H]2c2ncon2)n1	ZINC000450803728	DF	On-Demand	Anodyne	CPT1A	97	40
O[C@@H]1CC[C@@H]2CN(c3ncncc3-c3ccccc3)CC[C@@H]2C1	ZINC000450803733	DG	On-Demand	Anodyne	SLC9A1	20	51
O[C@@H]1CC[C@@H]2CN(c3ncncc3-c3ccccc3)CC[C@H]2C1	ZINC000450803734	DG	On-Demand	Anodyne	SLC9A1	20	51
O[C@@H]1CC[C@H]2CN(c3ncncc3-c3ccccc3)CC[C@@H]2C1	ZINC000450803735	DG	On-Demand	Anodyne	SLC9A1	20	51
O[C@@H]1CC[C@H]2CN(c3ncncc3-c3ccccc3)CC[C@H]2C1	ZINC000450803736	DG	On-Demand	Anodyne	SLC9A1	20	51
Cc1cc(NC[C@@H](NS(=O)(=O)N(C)C)C2CCCC2)n2ncnc2n1	ZINC000450803763	FC	On-Demand	Anodyne	DHOD	0	45
Cc1cc(NC[C@H](NS(=O)(=O)N(C)C)C2CCCC2)n2ncnc2n1	ZINC000450803764	FC	On-Demand	Anodyne	DHOD	0	45
COc1cccc(OCCC(=O)N(C)C[C@H]2CC=CCC2)c1	ZINC000450803807	DG	On-Demand	Anodyne	MTNR1A	22	42
COc1cccc(OCCC(=O)N(C)C[C@@H]2CC=CCC2)c1	ZINC000450803808	DG	On-Demand	Anodyne	MTNR1A	22	42
CCOCc1nc(C)c(C(=O)NCCCCCc2ccc(F)cc2)s1	ZINC000450803828	FI	On-Demand	Anodyne	SCD1	27	48
CCOCc1nc(C)c(C(=O)NCCCCCc2ccc(F)cc2)s1	ZINC000450803828	FI	On-Demand	Anodyne	SCD	29	48
C[C@@H]1CN(c2ncnc3cc(Br)ccc23)CC(=O)N1	ZINC000450803855	DD	On-Demand	Anodyne	PDE3A	44	33
C[C@H]1CN(c2ncnc3cc(Br)ccc23)CC(=O)N1	ZINC000450803856	DD	On-Demand	Anodyne	PDE3A	44	33
Cc1ccncc1CNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450803862	GG	On-Demand	Bother	NAMPT	33	41
CCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450803868	EE	On-Demand	Anodyne	CTSV	43	29
CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450803869	EE	On-Demand	Anodyne	CTSV	43	29
O=C(Cc1cc2ccccc2c(O)n1)NCCCCCc1ccc(F)cc1	ZINC000450803871	FI	On-Demand	Anodyne	BCHE	40	37
C[C@H](O)CN1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450803875	EE	On-Demand	Anodyne	MC4R	38	43
C[C@H](O)CN1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450803875	EE	On-Demand	Anodyne	UTS2R	46	33
C[C@H](O)CN1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450803875	EE	On-Demand	Anodyne	SLC18A3	16	40
C[C@H](O)CN1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450803875	EE	On-Demand	Anodyne	SSTR3	99	32
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2cnccc2C)c([N+](=O)[O-])c1	ZINC000450803889	FE	On-Demand	Bother	TAAR1	20	46
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2cnccc2C)c([N+](=O)[O-])c1	ZINC000450803897	FE	On-Demand	Bother	TAAR1	20	46
CC(=O)CCCCCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803907	EF	On-Demand	Bother	CACNA1C	54	37
CC(=O)CCCCCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450803908	EF	On-Demand	Bother	CACNA1C	54	37
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803913	FE	On-Demand	Bother	BCL2L1	52	31
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803913	FE	On-Demand	Bother	BCL2	45	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803915	FE	On-Demand	Bother	BCL2L1	52	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450803915	FE	On-Demand	Bother	BCL2	45	31
C=C[C@@H]1OCCC[C@H]1Nc1nccc(C(F)F)n1	ZINC000450803917	CF	On-Demand	Mild	MAPK1	40	32
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803918	FE	On-Demand	Bother	BCL2L1	52	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803918	FE	On-Demand	Bother	BCL2	45	31
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803920	FE	On-Demand	Bother	BCL2L1	52	31
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450803920	FE	On-Demand	Bother	BCL2	45	31
Cc1nc([C@@H]2CCCN2C(=O)c2ccc(-c3ccncc3)c(F)c2)cs1	ZINC000450803959	FJ	On-Demand	Anodyne	CPT1A	23	41
Cc1nc([C@@H]2CCCN2C(=O)c2ccc(-c3ccncc3)c(F)c2)cs1	ZINC000450803959	FJ	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
COc1ccc(Cn2ccc(NC(=O)CCCn3nc(C)nc3C)n2)cc1	ZINC000450803977	FD	On-Demand	Anodyne	HDAC7	26	41
Cc1ccncc1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450803979	EF	On-Demand	Anodyne	STAT6	54	38
Cc1ccncc1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450803979	EF	On-Demand	Anodyne	LRRK2	24	44
Cc1ccncc1CNc1ncccc1S(=O)(=O)N1CCCCC1	ZINC000450803980	EF	On-Demand	Anodyne	NAMPT	28	41
Cc1ccc(C2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)cn1	ZINC000450803998	EG	On-Demand	Anodyne	FASN	50	54
Cc1ccc(C2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)cn1	ZINC000450803998	EG	On-Demand	Anodyne	L3MBTL1	0	42
Cc1ccc(C2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)cn1	ZINC000450803998	EG	On-Demand	Anodyne	L3MBTL3	43	42
Cc1ccc(C2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)cn1	ZINC000450803998	EG	On-Demand	Anodyne	SLC6A7	0	42
CCn1cnc2c(N[C@@H](CCOC)c3cccc(C(F)(F)F)c3)ncnc21	ZINC000450804007	GI	On-Demand	Anodyne	CDK1	16	41
CCn1cnc2c(N[C@H](CCOC)c3cccc(C(F)(F)F)c3)ncnc21	ZINC000450804008	GI	On-Demand	Anodyne	CDK1	16	41
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nn1	ZINC000450804023	FF	On-Demand	Anodyne	SCD1	34	42
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nn1	ZINC000450804023	FF	On-Demand	Anodyne	SCD	25	41
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nn1	ZINC000450804024	FF	On-Demand	Anodyne	SCD1	34	42
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nn1	ZINC000450804024	FF	On-Demand	Anodyne	SCD	25	41
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nn1	ZINC000450804025	FF	On-Demand	Anodyne	SCD1	34	42
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nn1	ZINC000450804025	FF	On-Demand	Anodyne	SCD	25	41
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nn1	ZINC000450804026	FF	On-Demand	Anodyne	SCD1	34	42
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nn1	ZINC000450804026	FF	On-Demand	Anodyne	SCD	25	41
C[C@@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CCN1CCO	ZINC000450804033	GD	On-Demand	Mild	HTR1B	17	43
C[C@H]1CN(C(=O)COc2ccc(C#N)c(Br)c2)CCN1CCO	ZINC000450804034	GD	On-Demand	Mild	HTR1B	17	43
Cc1ccc(F)c(CC(=O)N2CCCCC[C@H]2c2ncon2)c1	ZINC000450804051	DG	On-Demand	Anodyne	CPT1A	77	40
Cc1ccc(F)c(CC(=O)N2CCCCC[C@@H]2c2ncon2)c1	ZINC000450804052	DG	On-Demand	Anodyne	CPT1A	77	40
CC(C)[C@H]1CCN1c1ccc(C#N)c([N+](=O)[O-])c1	ZINC000450804053	BF	On-Demand	Mild	AR	28	43
CC(C)[C@@H]1CCN1c1ccc(C#N)c([N+](=O)[O-])c1	ZINC000450804054	BF	On-Demand	Mild	AR	28	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ncncc2Cl)C1	ZINC000450804089	DG	On-Demand	Anodyne	CXCR3	23	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncncc2Cl)C1	ZINC000450804090	DG	On-Demand	Anodyne	CXCR3	23	41
Cc1cnc(C)c(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450804091	DG	On-Demand	Anodyne	SIGMAR1	22	40
Cc1cnc(C)c(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450804092	DG	On-Demand	Anodyne	SIGMAR1	22	40
O=C(N[C@H]1CCCN(c2cccnc2)C1=O)[C@@H](O)C1CCC1	ZINC000450804106	DC	On-Demand	Anodyne	C3AR1	43	39
O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)[C@@H](O)C1CCC1	ZINC000450804109	DC	On-Demand	Anodyne	C3AR1	43	39
O=C(N[C@H]1CCCN(c2cccnc2)C1=O)[C@H](O)C1CCC1	ZINC000450804111	DC	On-Demand	Anodyne	C3AR1	43	39
O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)[C@H](O)C1CCC1	ZINC000450804114	DC	On-Demand	Anodyne	C3AR1	43	39
CCS(=O)(=O)c1ccc(COc2cc([N+](=O)[O-])ccc2C)cc1	ZINC000450804122	EG	On-Demand	Bother	CYP19A1	0	62
Cc1ccc([N+](=O)[O-])cc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450804133	CF	On-Demand	Bother	CYP19A1	15	40
Cc1ccc([N+](=O)[O-])cc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450804134	CF	On-Demand	Bother	CYP19A1	15	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cc2C#N)C1	ZINC000450804169	FF	On-Demand	Mild	SGPL1	0	46
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cc2C#N)C1	ZINC000450804170	FF	On-Demand	Mild	SGPL1	0	46
CC(=O)CCCCCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450804173	EK	On-Demand	Anodyne	GSK3B	17	43
CC(=O)CCCCCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450804173	EK	On-Demand	Anodyne	GSK3A	48	43
CC(=O)CCCCCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450804173	EK	On-Demand	Anodyne	ALOX15	64	48
C[C@@H](Sc1nnc(C(C)(C)C)o1)C(=O)Nc1nccs1	ZINC000450804176	DF	On-Demand	Anodyne	MAP	0	40
C[C@@H](Sc1nnc(C(C)(C)C)o1)C(=O)Nc1nccs1	ZINC000450804176	DF	On-Demand	Anodyne	MAP1	93	40
C[C@H](Sc1nnc(C(C)(C)C)o1)C(=O)Nc1nccs1	ZINC000450804177	DF	On-Demand	Anodyne	MAP	0	40
C[C@H](Sc1nnc(C(C)(C)C)o1)C(=O)Nc1nccs1	ZINC000450804177	DF	On-Demand	Anodyne	MAP1	93	40
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1F	ZINC000450804181	CG	On-Demand	Bother	THRA	22	43
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1F	ZINC000450804181	CG	On-Demand	Bother	CYP19A1	15	44
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1F	ZINC000450804181	CG	On-Demand	Bother	S1PR4	18	55
COCCN1C(=O)CCc2cc(NC(=O)C(C)(C)OC(C)C)ccc21	ZINC000450804189	EF	On-Demand	Anodyne	NAMPT	0	44
CC(C)[C@@H]1C[C@H]1CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450804200	DD	On-Demand	Bother	CA2	27	41
COCCN1C(=O)CCc2cc(NC(=O)c3cn4nccc4nc3C)ccc21	ZINC000450804203	GE	On-Demand	Anodyne	DDR1	47	35
CC[C@@]1(O)CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450804213	EG	On-Demand	Anodyne	RBP4	72	40
N#Cc1cc(NC(=O)CC2(O)CCC2)ccc1Oc1ccccc1	ZINC000450804239	DH	On-Demand	Mild	PFKFB3	40	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450804256	CI	On-Demand	Anodyne	CACNA1B	48	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450804256	CI	On-Demand	Anodyne	LIPG	54	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450804260	CI	On-Demand	Anodyne	CACNA1B	48	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450804260	CI	On-Demand	Anodyne	LIPG	54	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450804261	CI	On-Demand	Anodyne	CACNA1B	48	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450804261	CI	On-Demand	Anodyne	LIPG	54	39
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450804262	CI	On-Demand	Anodyne	CACNA1B	48	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450804262	CI	On-Demand	Anodyne	LIPG	54	39
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)Cc1cc2ccccc2c(O)n1	ZINC000450804296	FG	On-Demand	Anodyne	CCR3	0	43
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)Cc1cc2ccccc2c(O)n1	ZINC000450804297	FG	On-Demand	Anodyne	CCR3	0	43
CNS(=O)(=O)NCC(=O)N1C[C@H](C)C[C@@H]1c1cccc(OC)c1	ZINC000450804307	EC	On-Demand	Anodyne	DRD4	42	32
CNS(=O)(=O)NCC(=O)N1C[C@@H](C)C[C@H]1c1cccc(OC)c1	ZINC000450804308	EC	On-Demand	Anodyne	DRD4	42	32
CNS(=O)(=O)NCC(=O)N1C[C@H](C)C[C@H]1c1cccc(OC)c1	ZINC000450804309	EC	On-Demand	Anodyne	DRD4	42	32
CNS(=O)(=O)NCC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(OC)c1	ZINC000450804310	EC	On-Demand	Anodyne	DRD4	42	32
CO[C@@H]1COCC[C@@H]1CC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC000450804328	FH	On-Demand	Mild	PFKFB3	44	33
CO[C@@H]1COCC[C@H]1CC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC000450804333	FH	On-Demand	Mild	PFKFB3	44	33
CO[C@H]1COCC[C@@H]1CC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC000450804335	FH	On-Demand	Mild	PFKFB3	44	33
CO[C@H]1COCC[C@H]1CC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC000450804338	FH	On-Demand	Mild	PFKFB3	44	33
Cc1nc(C)n(CCCC(=O)N2CCC[C@H]2c2csc(C)n2)n1	ZINC000450804346	EF	On-Demand	Anodyne	COLA	54	41
Cc1nc(C)n(CCCC(=O)N2CCC[C@H]2c2csc(C)n2)n1	ZINC000450804346	EF	On-Demand	Anodyne	CPT1A	55	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)[C@H](C)O	ZINC000450804348	DD	On-Demand	Anodyne	GCKR	58	32
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)[C@@H](C)O	ZINC000450804350	DD	On-Demand	Anodyne	GCKR	58	32
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)[C@H](C)O	ZINC000450804352	DD	On-Demand	Anodyne	GCKR	58	32
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)[C@@H](C)O	ZINC000450804354	DD	On-Demand	Anodyne	GCKR	58	32
CS(=O)(=O)C[C@@H]1CCCCN1c1ncc(C(F)(F)F)cc1Cl	ZINC000450804362	FG	On-Demand	Anodyne	CXCR3	17	45
CS(=O)(=O)C[C@H]1CCCCN1c1ncc(C(F)(F)F)cc1Cl	ZINC000450804364	FG	On-Demand	Anodyne	CXCR3	17	45
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cn1	ZINC000450804379	GF	On-Demand	Anodyne	NPY2R	21	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cn1	ZINC000450804379	GF	On-Demand	Anodyne	CDK2	0	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cn1	ZINC000450804379	GF	On-Demand	Anodyne	PKNB	51	37
CC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450804393	CE	On-Demand	Bother	TAAR1	15	45
CC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450804394	CE	On-Demand	Bother	TAAR1	15	45
CC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450804395	CE	On-Demand	Bother	TAAR1	15	45
CC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450804396	CE	On-Demand	Bother	TAAR1	15	45
COc1cc(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)ccc1Cl	ZINC000450804397	FF	On-Demand	Anodyne	CACNA1C	0	44
COc1cc(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)ccc1Cl	ZINC000450804397	FF	On-Demand	Anodyne	CACNA1D	51	44
Cc1ccn2ncc(C(=O)N3CCN(CCO)[C@H](C)C3)c2c1	ZINC000450804417	DC	On-Demand	Anodyne	EPHB3	18	40
Cc1ccn2ncc(C(=O)N3CCN(CCO)[C@@H](C)C3)c2c1	ZINC000450804418	DC	On-Demand	Anodyne	EPHB3	18	40
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc2)CC1	ZINC000450804423	GD	On-Demand	Anodyne	GCK	47	32
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc2)CC1	ZINC000450804423	GD	On-Demand	Anodyne	GCKR	77	35
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc2)CC1	ZINC000450804424	GD	On-Demand	Anodyne	GCK	47	32
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc2)CC1	ZINC000450804424	GD	On-Demand	Anodyne	GCKR	77	35
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc2)CC1	ZINC000450804425	GD	On-Demand	Anodyne	GCK	47	32
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc2)CC1	ZINC000450804425	GD	On-Demand	Anodyne	GCKR	77	35
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc2)CC1	ZINC000450804426	GD	On-Demand	Anodyne	GCK	47	32
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc2)CC1	ZINC000450804426	GD	On-Demand	Anodyne	GCKR	77	35
COc1cccc(OCCC(=O)N2CC(F)C2)c1	ZINC000450804464	CD	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CC(F)C2)c1	ZINC000450804464	CD	On-Demand	Anodyne	MTNR1A	30	48
COc1cccc(OCCC(=O)N2CC(F)C2)c1	ZINC000450804464	CD	On-Demand	Anodyne	MTNR1B	37	40
COc1cccc(OCCC(=O)N2CC(F)C2)c1	ZINC000450804464	CD	On-Demand	Anodyne	CHRNA10	18	40
CS(=O)(=O)N1CC(CNC(=O)c2ccc3cnccc3c2)C1	ZINC000450804484	DC	On-Demand	Anodyne	AKT1	0	44
CS(=O)(=O)N1CC(CNC(=O)c2ccc3cnccc3c2)C1	ZINC000450804484	DC	On-Demand	Anodyne	CACNA1I	41	32
CS(=O)(=O)N1CC(CNC(=O)c2ccc3cnccc3c2)C1	ZINC000450804484	DC	On-Demand	Anodyne	NAMPT	50	35
CCOC(=O)c1ccc(CSc2nc3ccc(C)cc3c(=O)n2C)nc1	ZINC000450804487	FG	On-Demand	Anodyne	HPD	55	36
CCS(=O)(=O)C1CN(c2ncnc3ccsc23)C1	ZINC000450804488	CD	On-Demand	Anodyne	SIRT2	52	34
CCc1cccc(C(=O)NCc2ccncc2C)n1	ZINC000450804518	CE	On-Demand	Anodyne	SCN10A	23	42
C[C@H]1CN(Cc2ccccc2)CCN(c2cnn(C)c(=O)c2Cl)C1	ZINC000450804527	EE	On-Demand	Anodyne	DRD2	17	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnn(C)c(=O)c2Cl)C1	ZINC000450804528	EE	On-Demand	Anodyne	DRD2	17	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450804549	DG	On-Demand	Anodyne	AKT2	51	38
C[C@H]1CN(Cc2ccccc2)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450804549	DG	On-Demand	Anodyne	SORD	65	35
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450804550	DG	On-Demand	Anodyne	AKT2	51	38
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450804550	DG	On-Demand	Anodyne	SORD	65	35
Cc1cnccc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450804552	EE	On-Demand	Anodyne	SCN10A	33	45
Cc1cnccc1CNC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450804552	EE	On-Demand	Anodyne	STAT6	56	35
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450804555	FF	On-Demand	Anodyne	MLNR	44	38
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450804555	FF	On-Demand	Anodyne	HDAC1	0	45
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450804555	FF	On-Demand	Anodyne	SGPL1	0	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450804555	FF	On-Demand	Anodyne	SMO	26	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450804556	FF	On-Demand	Anodyne	MLNR	44	38
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450804556	FF	On-Demand	Anodyne	HDAC1	0	45
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450804556	FF	On-Demand	Anodyne	SGPL1	0	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450804556	FF	On-Demand	Anodyne	SMO	26	41
COC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nn1	ZINC000450804557	EE	On-Demand	Anodyne	DRD2	18	42
COC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nn1	ZINC000450804557	EE	On-Demand	Anodyne	SCD1	41	39
COC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nn1	ZINC000450804558	EE	On-Demand	Anodyne	DRD2	18	42
COC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nn1	ZINC000450804558	EE	On-Demand	Anodyne	SCD1	41	39
CCOC(=O)c1nn(-c2ccccc2)cc1OCc1nnc(C(C)C)s1	ZINC000450804567	FH	On-Demand	Anodyne	SLC5A1	25	42
CCOC(=O)c1nn(-c2ccccc2)cc1OCc1nnc(C(C)C)s1	ZINC000450804567	FH	On-Demand	Anodyne	SLC5A2	26	42
O=C(CNC(=O)Nc1cccc(Cl)c1)NCCCn1ccnn1	ZINC000450804589	ED	On-Demand	Anodyne	HRH2	30	44
Cc1nnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)s1	ZINC000450804595	DF	On-Demand	Anodyne	SIGMAR1	30	40
Cc1nnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)s1	ZINC000450804596	DF	On-Demand	Anodyne	SIGMAR1	30	40
CCS(=O)(=O)c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450804601	FE	On-Demand	Anodyne	MAOB	46	34
CCS(=O)(=O)c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450804601	FE	On-Demand	Anodyne	NR1H3	63	36
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450804604	FH	On-Demand	Anodyne	NAMPT	0	43
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450804605	FH	On-Demand	Anodyne	NAMPT	0	43
CC[C@@H](O)CC(=O)Nc1nc(Cc2ccccc2)cs1	ZINC000450804624	CF	On-Demand	Anodyne	PDE5A	0	51
CC[C@H](O)CC(=O)Nc1nc(Cc2ccccc2)cs1	ZINC000450804625	CF	On-Demand	Anodyne	PDE5A	0	51
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450804628	EH	On-Demand	Anodyne	UTS2R	49	35
CC[C@@]1(CO)CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450804629	EH	On-Demand	Anodyne	UTS2R	49	35
CC(C)OC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450804637	DF	On-Demand	Anodyne	FIMH	15	40
O[C@@H]1CC[C@H]2CN(c3ncnc4sc5c(c34)CCC5)CC[C@@H]2C1	ZINC000450804641	EG	On-Demand	Anodyne	RBP4	18	42
O[C@@H]1CC[C@@H]2CN(c3ncnc4sc5c(c34)CCC5)CC[C@@H]2C1	ZINC000450804642	EG	On-Demand	Anodyne	RBP4	18	42
O[C@@H]1CC[C@H]2CN(c3ncnc4sc5c(c34)CCC5)CC[C@H]2C1	ZINC000450804643	EG	On-Demand	Anodyne	RBP4	18	42
O[C@@H]1CC[C@@H]2CN(c3ncnc4sc5c(c34)CCC5)CC[C@H]2C1	ZINC000450804644	EG	On-Demand	Anodyne	RBP4	18	42
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804661	EG	On-Demand	Anodyne	ACE	22	40
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804661	EG	On-Demand	Anodyne	MMP1	23	44
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804661	EG	On-Demand	Anodyne	BIRC2	51	35
CCC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804662	EG	On-Demand	Anodyne	ACE	22	40
CCC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804662	EG	On-Demand	Anodyne	MMP1	23	44
CCC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804662	EG	On-Demand	Anodyne	BIRC2	51	35
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804663	EG	On-Demand	Anodyne	ACE	22	40
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804663	EG	On-Demand	Anodyne	MMP1	23	44
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804663	EG	On-Demand	Anodyne	BIRC2	51	35
CCC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804664	EG	On-Demand	Anodyne	ACE	22	40
CCC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804664	EG	On-Demand	Anodyne	MMP1	23	44
CCC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450804664	EG	On-Demand	Anodyne	BIRC2	51	35
O[C@@H]1CC[C@H]2CN(c3ccccn3)CC[C@@H]2C1	ZINC000450804677	BE	On-Demand	Anodyne	AVPR1A	0	42
O[C@@H]1CC[C@@H]2CN(c3ccccn3)CC[C@@H]2C1	ZINC000450804678	BE	On-Demand	Anodyne	AVPR1A	0	42
O[C@@H]1CC[C@H]2CN(c3ccccn3)CC[C@H]2C1	ZINC000450804679	BE	On-Demand	Anodyne	AVPR1A	0	42
O[C@@H]1CC[C@@H]2CN(c3ccccn3)CC[C@H]2C1	ZINC000450804680	BE	On-Demand	Anodyne	AVPR1A	0	42
CC(=O)N[C@H](C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O)C(C)(C)C	ZINC000450804684	FD	On-Demand	Anodyne	BIRC2	66	51
CC(=O)N[C@H](C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O)C(C)(C)C	ZINC000450804685	FD	On-Demand	Anodyne	BIRC2	66	51
Cc1ccc(C(=O)N2CCN(C[C@H](C)O)CC2)c(Cl)c1Cl	ZINC000450804732	EE	On-Demand	Anodyne	P2RX7	36	44
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC(O)(C(F)F)CC2)c1	ZINC000450804733	FF	On-Demand	Anodyne	EPHX2	30	40
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CC2(C#N)CCC2)C1=O	ZINC000450804735	EE	On-Demand	Mild	CACNA1D	45	33
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CC2(C#N)CCC2)C1=O	ZINC000450804736	EE	On-Demand	Mild	CACNA1D	45	33
COCC[C@H](Nc1cncc(OCCO)n1)c1cccc(C(F)(F)F)c1	ZINC000450804738	FG	On-Demand	Anodyne	SCD1	0	41
C[C@H](O)CN1CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450804740	CC	On-Demand	Anodyne	GNAI1	0	41
C[C@H](O)CN1CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450804740	CC	On-Demand	Anodyne	GNAI3	0	40
C[C@H](O)CN1CCN(C(=O)CCCC(=O)C2CC2)CC1	ZINC000450804740	CC	On-Demand	Anodyne	GNAO1	0	40
CC(F)(F)c1ccc(C(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cn1	ZINC000450804745	FF	On-Demand	Anodyne	SFRP1	21	40
COc1ccc2c(c1)CN(c1cc(C)nc(-c3cccnc3)n1)CCO2	ZINC000450804794	EG	On-Demand	Anodyne	CYP11B2	43	40
COc1ccc2c(c1)CN(c1cc(C)nc(-c3cccnc3)n1)CCO2	ZINC000450804794	EG	On-Demand	Anodyne	ROS1	44	46
CC[C@@H](CC(F)(F)F)C(=O)N1CCC[C@H]1c1csc(C)n1	ZINC000450804795	DI	On-Demand	Anodyne	ADAM17	0	44
CC[C@H](CC(F)(F)F)C(=O)N1CCC[C@H]1c1csc(C)n1	ZINC000450804796	DI	On-Demand	Anodyne	ADAM17	0	44
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804805	GK	On-Demand	Anodyne	PRCP	48	36
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804805	GK	On-Demand	Anodyne	GRM5	15	40
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804805	GK	On-Demand	Anodyne	TRPC6	42	41
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804805	GK	On-Demand	Anodyne	TRPC3	29	41
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804806	GK	On-Demand	Anodyne	PRCP	48	36
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804806	GK	On-Demand	Anodyne	GRM5	15	40
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804806	GK	On-Demand	Anodyne	TRPC6	42	41
Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804806	GK	On-Demand	Anodyne	TRPC3	29	41
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804807	GK	On-Demand	Anodyne	PRCP	48	36
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804807	GK	On-Demand	Anodyne	GRM5	15	40
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804807	GK	On-Demand	Anodyne	TRPC6	42	41
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804807	GK	On-Demand	Anodyne	TRPC3	29	41
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804808	GK	On-Demand	Anodyne	PRCP	48	36
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804808	GK	On-Demand	Anodyne	GRM5	15	40
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804808	GK	On-Demand	Anodyne	TRPC6	42	41
Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cs1	ZINC000450804808	GK	On-Demand	Anodyne	TRPC3	29	41
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](C)O	ZINC000450804812	ED	On-Demand	Anodyne	GCKR	50	32
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](C)O	ZINC000450804812	ED	On-Demand	Anodyne	NAMPT	25	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](C)O	ZINC000450804813	ED	On-Demand	Anodyne	GCKR	50	32
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](C)O	ZINC000450804813	ED	On-Demand	Anodyne	NAMPT	25	40
COc1ccc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ncnc2c1F	ZINC000450804834	EF	On-Demand	Anodyne	PDE3A	50	39
COc1ccc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ncnc2c1F	ZINC000450804835	EF	On-Demand	Anodyne	PDE3A	50	39
COc1ccc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ncnc2c1F	ZINC000450804836	EF	On-Demand	Anodyne	PDE3A	50	39
COc1ccc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ncnc2c1F	ZINC000450804837	EF	On-Demand	Anodyne	PDE3A	50	39
CCOc1nc2ccc(C(=O)NCC3CN(S(C)(=O)=O)C3)cc2[nH]1	ZINC000450804855	FC	On-Demand	Anodyne	HTR4	27	42
CCOc1nc2ccc(C(=O)NCC3CN(S(C)(=O)=O)C3)cc2[nH]1	ZINC000450804855	FC	On-Demand	Anodyne	CACNA1I	42	37
CS(=O)(=O)N1CC(CNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450804862	GC	On-Demand	Anodyne	CACNA1I	62	34
CS(=O)(=O)N1CC(CNC(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000450804880	GD	On-Demand	Anodyne	CACNA1I	40	30
CC(C)[C@H]1CCN1c1ncnc2cc(F)c(F)cc12	ZINC000450804903	CG	On-Demand	Anodyne	PDE3A	44	34
CC(C)[C@H]1CCN1c1ncnc2cc(F)c(F)cc12	ZINC000450804903	CG	On-Demand	Anodyne	PDE3B	64	34
CC(C)[C@@H]1CCN1c1ncnc2cc(F)c(F)cc12	ZINC000450804904	CG	On-Demand	Anodyne	PDE3A	44	34
CC(C)[C@@H]1CCN1c1ncnc2cc(F)c(F)cc12	ZINC000450804904	CG	On-Demand	Anodyne	PDE3B	64	34
CCS(=O)(=O)C1CN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000450804912	FE	On-Demand	Anodyne	PTGS2	17	41
CCS(=O)(=O)C1CN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000450804912	FE	On-Demand	Anodyne	CYP11B2	40	38
COCC[C@@H](Nc1cncc(OCCO)n1)c1cccc(C(F)(F)F)c1	ZINC000450804914	FG	On-Demand	Anodyne	SCD1	0	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2F)C1	ZINC000450804915	CG	On-Demand	Anodyne	DRD2	23	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2F)C1	ZINC000450804915	CG	On-Demand	Anodyne	DRD4	49	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2F)C1	ZINC000450804915	CG	On-Demand	Anodyne	DRD3	24	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2F)C1	ZINC000450804915	CG	On-Demand	Anodyne	SIGMAR1	38	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2F)C1	ZINC000450804916	CG	On-Demand	Anodyne	DRD2	23	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2F)C1	ZINC000450804916	CG	On-Demand	Anodyne	DRD4	49	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2F)C1	ZINC000450804916	CG	On-Demand	Anodyne	DRD3	24	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2F)C1	ZINC000450804916	CG	On-Demand	Anodyne	SIGMAR1	38	40
CC[C@@]1(CO)CCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450804919	EF	On-Demand	Anodyne	RIR1_HHV11	51	37
CC[C@]1(CO)CCCN(C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)C1	ZINC000450804921	EF	On-Demand	Anodyne	RIR1_HHV11	51	37
COC(=O)c1cnc(NC[C@@H]2C[C@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000450804926	CE	On-Demand	Bother	PRKCQ	43	36
Cc1ccnc(-c2noc(CSc3nnnn3CCN(C)C)n2)c1	ZINC000450804927	ED	On-Demand	Anodyne	TNKS2	15	41
Cc1nnc2c3ccccc3c(N3CCN(Cc4ccccc4)C[C@H](C)C3)nn12	ZINC000450804947	GH	On-Demand	Anodyne	CREBBP	42	32
Cc1nnc2c3ccccc3c(N3CCN(Cc4ccccc4)C[C@H](C)C3)nn12	ZINC000450804947	GH	On-Demand	Anodyne	BRD9	53	32
Cc1nnc2c3ccccc3c(N3CCN(Cc4ccccc4)C[C@@H](C)C3)nn12	ZINC000450804952	GH	On-Demand	Anodyne	CREBBP	42	32
Cc1nnc2c3ccccc3c(N3CCN(Cc4ccccc4)C[C@@H](C)C3)nn12	ZINC000450804952	GH	On-Demand	Anodyne	BRD9	53	32
CS(=O)(=O)c1cccc(OC[C@@H]2CCCC2(F)F)c1	ZINC000450804955	CF	On-Demand	Anodyne	CHRNA10	53	36
CS(=O)(=O)c1cccc(OC[C@H]2CCCC2(F)F)c1	ZINC000450804957	CF	On-Demand	Anodyne	CHRNA10	53	36
O=S(=O)(c1ccccc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450804959	FG	On-Demand	Anodyne	GRM5	0	43
O=S(=O)(c1ccccc1)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450804959	FG	On-Demand	Anodyne	MAL12	0	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cn2)C1	ZINC000450804976	EE	On-Demand	Bother	MGLL	0	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cn2)C1	ZINC000450804976	EE	On-Demand	Bother	SGPL1	0	45
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cn2)C1	ZINC000450804976	EE	On-Demand	Bother	ABHD6	0	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cn2)C1	ZINC000450804977	EE	On-Demand	Bother	MGLL	0	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cn2)C1	ZINC000450804977	EE	On-Demand	Bother	SGPL1	0	45
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cn2)C1	ZINC000450804977	EE	On-Demand	Bother	ABHD6	0	41
Cc1nn(C)cc1COc1cccc(S(C)(=O)=O)c1	ZINC000450804978	CD	On-Demand	Anodyne	NR1H2	22	42
Cc1cc(C)nc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450804979	DG	On-Demand	Anodyne	DRD2	25	43
Cc1cc(C)nc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450804979	DG	On-Demand	Anodyne	DRD4	44	37
Cc1cc(C)nc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450804979	DG	On-Demand	Anodyne	DNAB	0	41
Cc1cc(C)nc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450804980	DG	On-Demand	Anodyne	DRD2	25	43
Cc1cc(C)nc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450804980	DG	On-Demand	Anodyne	DRD4	44	37
Cc1cc(C)nc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450804980	DG	On-Demand	Anodyne	DNAB	0	41
CCS(=O)(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)cc1	ZINC000450804982	FG	On-Demand	Anodyne	SIGMAR1	30	40
CCS(=O)(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)cc1	ZINC000450804982	FG	On-Demand	Anodyne	SLC18A3	16	44
CCS(=O)(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)cc1	ZINC000450804983	FG	On-Demand	Anodyne	SIGMAR1	30	40
CCS(=O)(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)cc1	ZINC000450804983	FG	On-Demand	Anodyne	SLC18A3	16	44
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@H]3CC(C)C)ccc21	ZINC000450804993	EG	On-Demand	Anodyne	NAMPT	30	46
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@@H](C)O	ZINC000450805000	ED	On-Demand	Anodyne	GCKR	50	32
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@@H](C)O	ZINC000450805000	ED	On-Demand	Anodyne	NAMPT	25	40
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@@H](C)O	ZINC000450805001	ED	On-Demand	Anodyne	GCKR	50	32
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@@H](C)O	ZINC000450805001	ED	On-Demand	Anodyne	NAMPT	25	40
Cc1nc([C@@H]2CCCN2C(=O)c2ccc3cnccc3c2)cs1	ZINC000450805002	DH	On-Demand	Anodyne	COLA	50	43
Cc1nc([C@@H]2CCCN2C(=O)c2ccc3cnccc3c2)cs1	ZINC000450805002	DH	On-Demand	Anodyne	CPT1A	49	43
CNc1ccc(S(=O)(=O)N(C)CC2(OC)CCC2)cc1[N+](=O)[O-]	ZINC000450805009	ED	On-Demand	Bother	BDKRB1	23	43
CC(=O)c1cccc(CN(C2CC2)S(=O)(=O)c2cccnc2)c1	ZINC000450805040	EF	On-Demand	Anodyne	PTGER2	17	43
COC(=O)CNC(=O)c1ccc(NC[C@@H]2C[C@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000450805067	EE	On-Demand	Bother	TAAR1	17	41
CC[C@@]1(O)CCN(C(=O)c2ccc(I)cc2F)C1	ZINC000450805069	FE	On-Demand	Anodyne	MAP2K1	25	49
CC[C@]1(O)CCN(C(=O)c2ccc(I)cc2F)C1	ZINC000450805070	FE	On-Demand	Anodyne	MAP2K1	25	49
C[C@H]1CN(Cc2ccccc2)CCN(c2nccc(C#N)c2[N+](=O)[O-])C1	ZINC000450805080	FF	On-Demand	Mild	SGPL1	0	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2nccc(C#N)c2[N+](=O)[O-])C1	ZINC000450805081	FF	On-Demand	Mild	SGPL1	0	41
C[C@H](C[S@](C)=O)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450805084	DF	On-Demand	Anodyne	ACE2	45	35
C[C@H](C[S@@](C)=O)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450805085	DF	On-Demand	Anodyne	ACE2	45	35
C[C@@H](C[S@@](C)=O)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450805086	DF	On-Demand	Anodyne	ACE2	45	35
C[C@@H](C[S@](C)=O)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450805087	DF	On-Demand	Anodyne	ACE2	45	35
COc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)ncn1	ZINC000450805093	DE	On-Demand	Anodyne	DRD2	25	40
COc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)ncn1	ZINC000450805093	DE	On-Demand	Anodyne	DRD4	48	40
COc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)ncn1	ZINC000450805093	DE	On-Demand	Anodyne	DRD3	35	40
COc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)ncn1	ZINC000450805095	DE	On-Demand	Anodyne	DRD2	25	40
COc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)ncn1	ZINC000450805095	DE	On-Demand	Anodyne	DRD4	48	40
COc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)ncn1	ZINC000450805095	DE	On-Demand	Anodyne	DRD3	35	40
COc1cccc(OCCC(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450805103	ED	On-Demand	Anodyne	DRD4	44	34
COc1cccc(OCCC(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450805103	ED	On-Demand	Anodyne	HRH2	45	39
COc1cccc(OCCC(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450805103	ED	On-Demand	Anodyne	MTNR1A	67	43
COc1cccc(OCCC(=O)NCCc2nnc3n2CCCC3)c1	ZINC000450805103	ED	On-Demand	Anodyne	MTNR1B	60	39
COc1ccc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c(C)nc2c1	ZINC000450805110	EF	On-Demand	Anodyne	PDE3B	43	35
COc1ccc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c(C)nc2c1	ZINC000450805111	EF	On-Demand	Anodyne	PDE3B	43	35
COc1ccc2nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c(C)nc2c1	ZINC000450805112	EF	On-Demand	Anodyne	PDE3B	43	35
COc1ccc2nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c(C)nc2c1	ZINC000450805114	EF	On-Demand	Anodyne	PDE3B	43	35
CC(C)[C@@H]1C[C@H]1CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450805123	CF	On-Demand	Anodyne	DHOD	0	54
Cc1nnnn1-c1ccc(C(=O)NCCCCCc2ccc(F)cc2)c(F)c1	ZINC000450805127	GG	On-Demand	Anodyne	F9	24	44
CC[C@@H](Nc1ccnc2cc(Br)ccc12)[C@@H](C)O	ZINC000450805135	DH	On-Demand	Anodyne	RBP_CHICK	0	41
CC[C@H](Nc1ccnc2cc(Br)ccc12)[C@H](C)O	ZINC000450805138	DH	On-Demand	Anodyne	RBP_CHICK	0	41
CC[C@@H](Nc1ccnc2cc(Br)ccc12)[C@H](C)O	ZINC000450805140	DH	On-Demand	Anodyne	RBP_CHICK	0	41
CC[C@H](Nc1ccnc2cc(Br)ccc12)[C@@H](C)O	ZINC000450805142	DH	On-Demand	Anodyne	RBP_CHICK	0	41
CC[C@]1(O)CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450805143	FF	On-Demand	Anodyne	TRPC6	81	43
CC[C@]1(O)CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450805143	FF	On-Demand	Anodyne	TRPC3	61	43
CC[C@@]1(O)CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450805145	FF	On-Demand	Anodyne	TRPC6	81	43
CC[C@@]1(O)CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)C1	ZINC000450805145	FF	On-Demand	Anodyne	TRPC3	61	43
Cc1cnccc1CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450805153	DH	On-Demand	Anodyne	PPARA	0	45
Cc1cnccc1CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450805153	DH	On-Demand	Anodyne	PPARD	26	48
CC(C)[C@@H]1C[C@H]1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450805165	EF	On-Demand	Anodyne	LRRK2	27	40
CC[C@H](O)CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450805167	CC	On-Demand	Anodyne	GALR1	54	39
CC[C@H](O)CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450805167	CC	On-Demand	Anodyne	GHRL	46	35
CC[C@@H](O)CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450805169	CC	On-Demand	Anodyne	GALR1	54	39
CC[C@@H](O)CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1	ZINC000450805169	CC	On-Demand	Anodyne	GHRL	46	35
CC[C@H](O)CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450805172	CC	On-Demand	Anodyne	GALR1	54	39
CC[C@H](O)CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450805172	CC	On-Demand	Anodyne	GHRL	46	35
Cc1ccc(C(=O)N2CC[C@H]3CCC[C@H]32)c2c1CCC2	ZINC000450805178	CG	On-Demand	Anodyne	L3MBTL3	41	33
Cc1ccc(C(=O)N2CC[C@H]3CCC[C@@H]32)c2c1CCC2	ZINC000450805180	CG	On-Demand	Anodyne	L3MBTL3	41	33
Cc1ccc(C(=O)N2CC[C@@H]3CCC[C@@H]32)c2c1CCC2	ZINC000450805182	CG	On-Demand	Anodyne	L3MBTL3	41	33
Cc1ccc(C(=O)N2CC[C@@H]3CCC[C@H]32)c2c1CCC2	ZINC000450805183	CG	On-Demand	Anodyne	L3MBTL3	41	33
COC(=O)c1ccc(CC(=O)N2CC[C@@H]3CCC[C@H]32)cc1	ZINC000450805187	CE	On-Demand	Anodyne	OPRK1	27	40
COC(=O)c1ccc(CC(=O)N2CC[C@H]3CCC[C@@H]32)cc1	ZINC000450805188	CE	On-Demand	Anodyne	OPRK1	27	40
COC(=O)c1ccc(CC(=O)N2CC[C@H]3CCC[C@H]32)cc1	ZINC000450805191	CE	On-Demand	Anodyne	OPRK1	27	40
COC(=O)c1ccc(CC(=O)N2CC[C@@H]3CCC[C@@H]32)cc1	ZINC000450805193	CE	On-Demand	Anodyne	OPRK1	27	40
O=C(c1cccc2c1CCCC2)N1CC[C@H]2CCC[C@@H]21	ZINC000450805195	CH	On-Demand	Anodyne	FABP4	44	33
CCCCc1c(C)nc2nc(S[C@H](C)C(=O)Nc3nccs3)nn2c1C	ZINC000450805221	GH	On-Demand	Anodyne	MAP1	49	40
CCCCc1c(C)nc2nc(S[C@@H](C)C(=O)Nc3nccs3)nn2c1C	ZINC000450805230	GH	On-Demand	Anodyne	MAP1	49	40
COc1cccc(Oc2ccc(C(=O)NCC3CN(S(C)(=O)=O)C3)nc2)c1	ZINC000450805234	GD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(Oc2ccc(C(=O)NCC3CN(S(C)(=O)=O)C3)nc2)c1	ZINC000450805234	GD	On-Demand	Anodyne	MTNR1B	25	41
Cc1ccncc1CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450805241	ED	On-Demand	Anodyne	TGM2	26	40
Cc1ccncc1CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450805241	ED	On-Demand	Anodyne	NAMPT	53	44
OCc1ccnc(N2CCCc3ccccc3CC2)n1	ZINC000450805249	CD	On-Demand	Anodyne	SORD	43	34
COC(=O)c1csc(CN2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450805252	GI	On-Demand	Anodyne	COLA	74	41
COC(=O)c1csc(CN2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450805252	GI	On-Demand	Anodyne	CPT1A	71	41
COC(=O)c1csc(CN2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450805253	GI	On-Demand	Anodyne	COLA	74	41
COC(=O)c1csc(CN2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450805253	GI	On-Demand	Anodyne	CPT1A	71	41
O=C(N[C@H]1CCC[C@@H]1CCO)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450805254	EG	On-Demand	Anodyne	RBP4	67	37
O=C(N[C@@H]1CCC[C@H]1CCO)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450805255	EG	On-Demand	Anodyne	RBP4	67	37
O=C(N[C@H]1CCC[C@H]1CCO)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450805257	EG	On-Demand	Anodyne	RBP4	67	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCCc2ccccc2CC1	ZINC000450805268	FE	On-Demand	Anodyne	CA2	27	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCCc2ccccc2CC1	ZINC000450805268	FE	On-Demand	Anodyne	CA1	25	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCCc2ccccc2CC1	ZINC000450805268	FE	On-Demand	Anodyne	CA7	43	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCCc2ccccc2CC1	ZINC000450805268	FE	On-Demand	Anodyne	CA14	29	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCCc2ccccc2CC1	ZINC000450805268	FE	On-Demand	Anodyne	CA12	22	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCCc2ccccc2CC1	ZINC000450805268	FE	On-Demand	Anodyne	CA9	22	46
CS(=O)(=O)N1CC(CNC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450805300	FD	On-Demand	Anodyne	HSPB1	0	41
COCCOC[C@@H](O)CN1CCOc2c1cccc2C(C)(C)C	ZINC000450805319	DE	On-Demand	Anodyne	HSP90AB1	42	48
COCCOC[C@H](O)CN1CCOc2c1cccc2C(C)(C)C	ZINC000450805322	DE	On-Demand	Anodyne	HSP90AB1	42	48
C[C@H](O)CN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450805333	DE	On-Demand	Anodyne	MC4R	36	43
C[C@H](O)CN1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450805335	DE	On-Demand	Anodyne	MC4R	36	43
C[C@H](O)CN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450805337	DE	On-Demand	Anodyne	MC4R	36	43
C[C@H](O)CN1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450805339	DE	On-Demand	Anodyne	MC4R	36	43
Cc1nc([C@@H]2CCCN2C(=O)CC2CC(F)(F)C2)cs1	ZINC000450805350	DH	On-Demand	Anodyne	COLA	34	40
Cc1nc([C@@H]2CCCN2C(=O)CC2CC(F)(F)C2)cs1	ZINC000450805350	DH	On-Demand	Anodyne	CPT1A	33	40
COc1cc(OC)c2ncnc(N3CC[C@@H]3C(C)C)c2c1	ZINC000450805352	CF	On-Demand	Anodyne	PDE3B	68	37
COc1cc(OC)c2ncnc(N3CC[C@H]3C(C)C)c2c1	ZINC000450805355	CF	On-Demand	Anodyne	PDE3B	68	37
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450805360	GF	On-Demand	Bother	BCL2L1	52	31
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450805360	GF	On-Demand	Bother	BCL2	45	31
COCCN(CC1=CCCCC1)Cc1cccnc1	ZINC000450805363	CG	On-Demand	Anodyne	NR1D1	42	39
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450805364	GF	On-Demand	Bother	BCL2L1	52	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450805364	GF	On-Demand	Bother	BCL2	45	31
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450805366	GF	On-Demand	Bother	BCL2L1	52	31
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@@H](C)O	ZINC000450805366	GF	On-Demand	Bother	BCL2	45	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450805368	GF	On-Demand	Bother	BCL2L1	52	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])[C@H](C)O	ZINC000450805368	GF	On-Demand	Bother	BCL2	45	31
CCOC(=O)c1ccc(CN2CCC[C@H](C(C)C)C2)nc1	ZINC000450805371	CG	On-Demand	Anodyne	SSTR5	41	36
CCOC(=O)c1ccc(CN2CCC[C@@H](C(C)C)C2)nc1	ZINC000450805374	CG	On-Demand	Anodyne	SSTR5	41	36
COc1ccc2c(c1)CN(c1ccc(S(C)(=O)=O)cc1)CCO2	ZINC000450805379	EE	On-Demand	Anodyne	PTGS2	21	41
CC(F)(F)CCN1C(=O)CN(CCc2ccccc2)C1=O	ZINC000450805384	CF	On-Demand	Anodyne	CACNA1D	42	36
CCS(=O)(=O)c1ccc(CN(C)[C@H]2CCCC[C@H]2C)cc1	ZINC000450805392	DG	On-Demand	Anodyne	RORC	15	40
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCCC[C@H]2C)cc1	ZINC000450805393	DG	On-Demand	Anodyne	RORC	15	40
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000450805394	DG	On-Demand	Anodyne	RORC	15	40
CCS(=O)(=O)c1ccc(CN(C)[C@H]2CCCC[C@@H]2C)cc1	ZINC000450805395	DG	On-Demand	Anodyne	RORC	15	40
COCCN(Cc1cccnc1)Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450805396	EG	On-Demand	Anodyne	NR1D1	44	39
Cc1nnc2c3ccccc3c(N3CCCc4ccccc4CC3)nn12	ZINC000450805402	EH	On-Demand	Anodyne	CREBBP	47	36
Cc1nnc2c3ccccc3c(N3CCCc4ccccc4CC3)nn12	ZINC000450805402	EH	On-Demand	Anodyne	BRD9	59	36
C[C@H]1CN(CC(C)(C)O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805403	EF	On-Demand	Anodyne	DRD2	30	41
C[C@H]1CN(CC(C)(C)O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805403	EF	On-Demand	Anodyne	DRD4	0	47
C[C@H]1CN(CC(C)(C)O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805403	EF	On-Demand	Anodyne	SLC18A3	0	42
C[C@H]1CN(CC(C)(C)O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805403	EF	On-Demand	Anodyne	CYP2J2	55	41
C[C@@H]1CN(CC(C)(C)O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805404	EF	On-Demand	Anodyne	DRD2	30	41
C[C@@H]1CN(CC(C)(C)O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805404	EF	On-Demand	Anodyne	DRD4	0	47
C[C@@H]1CN(CC(C)(C)O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805404	EF	On-Demand	Anodyne	SLC18A3	0	42
C[C@@H]1CN(CC(C)(C)O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805404	EF	On-Demand	Anodyne	CYP2J2	55	41
COc1ccc(CNC(=O)CCN2CCCN(C(=O)C3CC3)CC2)c(OC)c1	ZINC000450805409	GD	On-Demand	Anodyne	HTR1A	24	41
COc1ccc(CNC(=O)CCN2CCCN(C(=O)C3CC3)CC2)c(OC)c1	ZINC000450805409	GD	On-Demand	Anodyne	DRD2	24	42
COc1ccc(CNC(=O)CCN2CCCN(C(=O)C3CC3)CC2)c(OC)c1	ZINC000450805409	GD	On-Demand	Anodyne	DRD4	43	33
COc1ccc(CNC(=O)CCN2CCCN(C(=O)C3CC3)CC2)c(OC)c1	ZINC000450805409	GD	On-Demand	Anodyne	HTR7	35	42
COc1ccc(CNC(=O)CCN2CCCN(C(=O)C3CC3)CC2)c(OC)c1	ZINC000450805409	GD	On-Demand	Anodyne	MTNR1A	57	42
COc1ccc(CNC(=O)CCN2CCCN(C(=O)C3CC3)CC2)c(OC)c1	ZINC000450805409	GD	On-Demand	Anodyne	MTNR1B	53	53
COc1ccc(CNC(=O)CCN2CCCN(C(=O)C3CC3)CC2)c(OC)c1	ZINC000450805409	GD	On-Demand	Anodyne	EBP	41	41
O=C(c1cccc2c1CCCC2)N1CC[C@H]2CCC[C@H]21	ZINC000450805427	CH	On-Demand	Anodyne	FABP4	44	33
O=C(c1cccc2c1CCCC2)N1CC[C@@H]2CCC[C@H]21	ZINC000450805428	CH	On-Demand	Anodyne	FABP4	44	33
O=C(c1cccc2c1CCCC2)N1CC[C@@H]2CCC[C@@H]21	ZINC000450805429	CH	On-Demand	Anodyne	FABP4	44	33
COc1ccc(CNC(=O)CCn2nccc2[N+](=O)[O-])c(OC)c1	ZINC000450805433	ED	On-Demand	Bother	PDGFRB	30	40
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCC1CC(F)(F)C1	ZINC000450805459	GG	On-Demand	Bother	SLC27A4	43	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450805461	EE	On-Demand	Anodyne	GHRHR	59	32
CCSc1cc(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)ccn1	ZINC000450805472	GG	On-Demand	Anodyne	NAMPT	56	42
O=C(CCCN(CCO)C1CCOCC1)c1ccccc1	ZINC000450805509	CE	On-Demand	Anodyne	CYP2J2	48	34
COC(=O)c1csc(CN2CCN(c3ncnc4sc(C)cc34)CC2)n1	ZINC000450805522	GF	On-Demand	Anodyne	PDGFRB	44	37
COC(=O)c1csc(CN2CCN(c3ncnc4sc(C)cc34)CC2)n1	ZINC000450805522	GF	On-Demand	Anodyne	SIRT3	56	33
COC(=O)c1csc(CN2CCN(c3ncnc4sc(C)cc34)CC2)n1	ZINC000450805522	GF	On-Demand	Anodyne	SIRT2	43	33
COC(=O)[C@@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805534	DD	On-Demand	Anodyne	DRD2	34	40
COC(=O)[C@@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805534	DD	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805534	DD	On-Demand	Anodyne	SLC18A3	0	41
COC(=O)[C@@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805534	DD	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805534	DD	On-Demand	Anodyne	ACKR3	41	35
COC(=O)[C@@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805535	DD	On-Demand	Anodyne	DRD2	34	40
COC(=O)[C@@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805535	DD	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805535	DD	On-Demand	Anodyne	SLC18A3	0	41
COC(=O)[C@@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805535	DD	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805535	DD	On-Demand	Anodyne	ACKR3	41	35
COC(=O)[C@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805536	DD	On-Demand	Anodyne	DRD2	34	40
COC(=O)[C@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805536	DD	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805536	DD	On-Demand	Anodyne	SLC18A3	0	41
COC(=O)[C@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805536	DD	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805536	DD	On-Demand	Anodyne	ACKR3	41	35
COC(=O)[C@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805537	DD	On-Demand	Anodyne	DRD2	34	40
COC(=O)[C@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805537	DD	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805537	DD	On-Demand	Anodyne	SLC18A3	0	41
COC(=O)[C@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805537	DD	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450805537	DD	On-Demand	Anodyne	ACKR3	41	35
COc1cc(CC(=O)N2CCC(O)(C(F)F)CC2)ccc1Cl	ZINC000450805560	EF	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2CCC(O)(C(F)F)CC2)ccc1Cl	ZINC000450805560	EF	On-Demand	Anodyne	TACR1	0	40
COc1cc(CC(=O)N2CCC(O)(C(F)F)CC2)ccc1Cl	ZINC000450805560	EF	On-Demand	Anodyne	CCR1	22	45
COC1(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)CCC1	ZINC000450805561	ED	On-Demand	Bother	CACNA1C	52	36
COC1(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)CCC1	ZINC000450805561	ED	On-Demand	Bother	CACNA1D	83	35
COC1(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)CCC1	ZINC000450805562	ED	On-Demand	Bother	CACNA1C	52	36
COC1(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)CCC1	ZINC000450805562	ED	On-Demand	Bother	CACNA1D	83	35
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	DRD2	18	44
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	DRD3	30	44
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	PTAFR	16	45
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	CNR2	32	40
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	CPT1B	40	36
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	PTGDR	23	40
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	PTGDR2	16	40
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	LEF	47	37
COc1ccc(C(=O)NCCCCCc2ccc(F)cc2)cc1S(C)(=O)=O	ZINC000450805566	GG	On-Demand	Anodyne	AP2S1	0	43
Cc1ccn(-c2ccccc2C(=O)N2CCC(O)(C(F)F)CC2)n1	ZINC000450805597	EE	On-Demand	Anodyne	AVPR2	21	41
CC[C@@H](O)CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450805603	CC	On-Demand	Anodyne	GALR1	54	39
CC[C@@H](O)CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1	ZINC000450805603	CC	On-Demand	Anodyne	GHRL	46	35
O[C@@H]1CC[C@@H]2CN(c3ccc(Cl)cn3)CC[C@H]2C1	ZINC000450805635	CF	On-Demand	Anodyne	NPBWR1	44	34
O[C@@H]1CC[C@H]2CN(c3ccc(Cl)cn3)CC[C@H]2C1	ZINC000450805637	CF	On-Demand	Anodyne	NPBWR1	44	34
O[C@@H]1CC[C@@H]2CN(c3ccc(Cl)cn3)CC[C@@H]2C1	ZINC000450805639	CF	On-Demand	Anodyne	NPBWR1	44	34
O[C@@H]1CC[C@H]2CN(c3ccc(Cl)cn3)CC[C@@H]2C1	ZINC000450805641	CF	On-Demand	Anodyne	NPBWR1	44	34
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(CNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450805662	FD	On-Demand	Anodyne	SDH1	0	43
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(CNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450805662	FD	On-Demand	Anodyne	PROC	54	36
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(CNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450805662	FD	On-Demand	Anodyne	MLX	0	41
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450805663	FD	On-Demand	Anodyne	SDH1	0	43
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450805663	FD	On-Demand	Anodyne	PROC	54	36
C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450805663	FD	On-Demand	Anodyne	MLX	0	41
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(CNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450805664	FD	On-Demand	Anodyne	SDH1	0	43
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(CNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450805664	FD	On-Demand	Anodyne	PROC	54	36
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(CNC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450805664	FD	On-Demand	Anodyne	MLX	0	41
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450805665	FD	On-Demand	Anodyne	SDH1	0	43
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450805665	FD	On-Demand	Anodyne	PROC	54	36
C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(CNC(=O)[C@H](O)C2CCC2)cc1	ZINC000450805665	FD	On-Demand	Anodyne	MLX	0	41
CCOC(=O)c1nn(-c2ccccc2)cc1OCCC(C)(F)F	ZINC000450805688	DG	On-Demand	Anodyne	DGAT1	16	44
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)ccc21	ZINC000450805692	FH	On-Demand	Anodyne	NOS1	15	49
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)ccc21	ZINC000450805692	FH	On-Demand	Anodyne	NAMPT	31	49
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)ccc21	ZINC000450805694	FH	On-Demand	Anodyne	NOS1	15	49
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)ccc21	ZINC000450805694	FH	On-Demand	Anodyne	NAMPT	31	49
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)ccc21	ZINC000450805696	FH	On-Demand	Anodyne	NOS1	15	49
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)ccc21	ZINC000450805696	FH	On-Demand	Anodyne	NAMPT	31	49
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)ccc21	ZINC000450805698	FH	On-Demand	Anodyne	NOS1	15	49
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)ccc21	ZINC000450805698	FH	On-Demand	Anodyne	NAMPT	31	49
CCOc1cc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)ncn1	ZINC000450805699	GF	On-Demand	Anodyne	HCN1	55	42
CCOc1cc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)ncn1	ZINC000450805699	GF	On-Demand	Anodyne	HCN4	42	32
Cc1ccnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)n1	ZINC000450805707	BD	On-Demand	Anodyne	SORD	16	41
Cc1ccnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)n1	ZINC000450805709	BD	On-Demand	Anodyne	SORD	16	41
Cc1ccnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)n1	ZINC000450805711	BD	On-Demand	Anodyne	SORD	16	41
Cc1ccnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)n1	ZINC000450805712	BD	On-Demand	Anodyne	SORD	16	41
CC[C@H](CC(C)C)C(=O)NCc1ccncc1C	ZINC000450805713	BG	On-Demand	Anodyne	ANPEP	29	42
CC[C@@H](CC(C)C)C(=O)NCc1ccncc1C	ZINC000450805714	BG	On-Demand	Anodyne	ANPEP	29	42
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450805716	GF	On-Demand	Bother	ACHE	18	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450805716	GF	On-Demand	Bother	SIGMAR1	20	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450805716	GF	On-Demand	Bother	CXCR3	16	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450805716	GF	On-Demand	Bother	TAAR1	19	45
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450805717	GF	On-Demand	Bother	ACHE	18	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450805717	GF	On-Demand	Bother	SIGMAR1	20	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450805717	GF	On-Demand	Bother	CXCR3	16	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450805717	GF	On-Demand	Bother	TAAR1	19	45
CCCc1nc(C)c(COc2cccc(S(C)(=O)=O)c2)o1	ZINC000450805727	DF	On-Demand	Anodyne	NR1H3	48	37
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ccnc2cc1F	ZINC000450805728	EG	On-Demand	Anodyne	PDE3A	47	36
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ccnc2cc1F	ZINC000450805728	EG	On-Demand	Anodyne	PDE3B	69	36
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ccnc2cc1F	ZINC000450805730	EG	On-Demand	Anodyne	PDE3A	47	36
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ccnc2cc1F	ZINC000450805730	EG	On-Demand	Anodyne	PDE3B	69	36
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ccnc2cc1F	ZINC000450805733	EG	On-Demand	Anodyne	PDE3A	47	36
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ccnc2cc1F	ZINC000450805733	EG	On-Demand	Anodyne	PDE3B	69	36
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ccnc2cc1F	ZINC000450805735	EG	On-Demand	Anodyne	PDE3A	47	36
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ccnc2cc1F	ZINC000450805735	EG	On-Demand	Anodyne	PDE3B	69	36
CCc1nc(C)c(COc2cccc(S(C)(=O)=O)c2)o1	ZINC000450805746	CF	On-Demand	Anodyne	NR1H3	56	39
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)CC1	ZINC000450805757	GE	On-Demand	Anodyne	HTR3A	26	51
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)CC1	ZINC000450805757	GE	On-Demand	Anodyne	HRH4	18	51
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)CC1	ZINC000450805758	GE	On-Demand	Anodyne	HTR3A	26	51
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)CC1	ZINC000450805758	GE	On-Demand	Anodyne	HRH4	18	51
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)CC1	ZINC000450805759	GE	On-Demand	Anodyne	HTR3A	26	51
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)CC1	ZINC000450805759	GE	On-Demand	Anodyne	HRH4	18	51
COc1cc(CC(=O)NCc2ccncc2C)ccc1Cl	ZINC000450805761	DF	On-Demand	Anodyne	TRPV1	39	46
COc1cc(CC(=O)NCc2ccncc2C)ccc1Cl	ZINC000450805761	DF	On-Demand	Anodyne	P2RX7	55	40
COc1cc(CC(=O)NCc2ccncc2C)ccc1Cl	ZINC000450805761	DF	On-Demand	Anodyne	NCE103	26	44
COc1cc(CC(=O)NCc2ccncc2C)ccc1Cl	ZINC000450805761	DF	On-Demand	Anodyne	CAN2	0	44
C[C@H]1CN(Cc2ccccc2)CCN(c2ccnc(N(C)C)n2)C1	ZINC000450805762	EF	On-Demand	Anodyne	SORD	58	35
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccnc(N(C)C)n2)C1	ZINC000450805763	EF	On-Demand	Anodyne	SORD	58	35
COC1(CSc2nnc(-c3ccc4ccccc4c3)o2)CCC1	ZINC000450805773	EJ	On-Demand	Anodyne	GSK3B	19	45
COC1(CSc2nnc(-c3ccc4ccccc4c3)o2)CCC1	ZINC000450805773	EJ	On-Demand	Anodyne	GSK3A	50	45
COC1(CSc2nnc(-c3ccc4ccccc4c3)o2)CCC1	ZINC000450805773	EJ	On-Demand	Anodyne	ALOX15	46	43
COC1(CSc2nnc(-c3ccc4ccccc4c3)o2)CCC1	ZINC000450805773	EJ	On-Demand	Anodyne	TERT	23	40
COCCN1C(=O)CCc2cc(NC(=O)c3ccc(C(F)(F)F)[nH]3)ccc21	ZINC000450805778	GG	On-Demand	Anodyne	NAMPT	0	42
Cc1ccc(F)c(CCNc2cc(N3CCC[C@H]3CO)ncn2)c1	ZINC000450805779	EF	On-Demand	Anodyne	PRCP	0	41
Cc1ccc(F)c(CCNc2cc(N3CCC[C@@H]3CO)ncn2)c1	ZINC000450805780	EF	On-Demand	Anodyne	PRCP	0	41
C[C@H](O)CCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450805781	DG	On-Demand	Anodyne	PLA2G4B	45	33
C[C@H](O)CCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450805781	DG	On-Demand	Anodyne	MMP9	22	42
C[C@H](O)CCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450805781	DG	On-Demand	Anodyne	ADAMTS4	44	36
C[C@@H](O)CCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450805782	DG	On-Demand	Anodyne	PLA2G4B	45	33
C[C@@H](O)CCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450805782	DG	On-Demand	Anodyne	MMP9	22	42
C[C@@H](O)CCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450805782	DG	On-Demand	Anodyne	ADAMTS4	44	36
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450805789	FG	On-Demand	Anodyne	DRD2	18	54
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450805789	FG	On-Demand	Anodyne	DRD4	43	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450805789	FG	On-Demand	Anodyne	SIGMAR1	31	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450805789	FG	On-Demand	Anodyne	SLC18A3	19	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450805790	FG	On-Demand	Anodyne	DRD2	18	54
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450805790	FG	On-Demand	Anodyne	DRD4	43	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450805790	FG	On-Demand	Anodyne	SIGMAR1	31	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450805790	FG	On-Demand	Anodyne	SLC18A3	19	42
Cc1cnccc1CNC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450805791	CE	On-Demand	Anodyne	P2RX7	51	37
COC(=O)c1ccc(CSc2nnc(C(C)(C)C)o2)cc1Cl	ZINC000450805792	EI	On-Demand	Anodyne	GSK3A	37	46
CCC[C@@H](CC(C)C)C(=O)NCc1ccncc1C	ZINC000450805795	CG	On-Demand	Anodyne	ANPEP	22	40
CCC[C@H](CC(C)C)C(=O)NCc1ccncc1C	ZINC000450805796	CG	On-Demand	Anodyne	ANPEP	22	40
C[C@]1(CO)CCC[C@@H]1NCc1ccccc1OC1CC1	ZINC000450805814	CF	On-Demand	Anodyne	TACR1	0	41
C[C@]1(CO)CCC[C@H]1NCc1ccccc1OC1CC1	ZINC000450805815	CF	On-Demand	Anodyne	TACR1	0	41
C[C@@]1(CO)CCC[C@@H]1NCc1ccccc1OC1CC1	ZINC000450805816	CF	On-Demand	Anodyne	TACR1	0	41
C[C@@]1(CO)CCC[C@H]1NCc1ccccc1OC1CC1	ZINC000450805817	CF	On-Demand	Anodyne	TACR1	0	41
CC[C@@H](O)CC(=O)NCCCc1ccc(Br)cc1OC	ZINC000450805818	EF	On-Demand	Anodyne	MTNR1B	32	41
CC[C@H](O)CC(=O)NCCCc1ccc(Br)cc1OC	ZINC000450805819	EF	On-Demand	Anodyne	MTNR1B	32	41
COc1ccc(CNC(=O)CCN(C2CCCC2)[C@@H](C)CO)c(OC)c1	ZINC000450805847	FE	On-Demand	Anodyne	MTNR1A	61	39
COc1ccc(CNC(=O)CCN(C2CCCC2)[C@@H](C)CO)c(OC)c1	ZINC000450805847	FE	On-Demand	Anodyne	MTNR1B	47	39
COc1ccc(CNC(=O)CCN(C2CCCC2)[C@H](C)CO)c(OC)c1	ZINC000450805848	FE	On-Demand	Anodyne	MTNR1A	61	39
COc1ccc(CNC(=O)CCN(C2CCCC2)[C@H](C)CO)c(OC)c1	ZINC000450805848	FE	On-Demand	Anodyne	MTNR1B	47	39
CCc1cc(CCCN(CCOC)Cc2cccnc2)on1	ZINC000450805864	DF	On-Demand	Anodyne	NR1D1	41	34
O=C(N[C@@H]1CCC[C@@H]1CCO)[C@@H]1CCN(c2ccccc2)C1	ZINC000450805865	DE	On-Demand	Anodyne	SLC6A1	44	32
O=C(N[C@@H]1CCC[C@@H]1CCO)[C@H]1CCN(c2ccccc2)C1	ZINC000450805866	DE	On-Demand	Anodyne	SLC6A1	44	32
O=C(N[C@@H]1CCC[C@H]1CCO)[C@H]1CCN(c2ccccc2)C1	ZINC000450805867	DE	On-Demand	Anodyne	SLC6A1	44	32
O=C(N[C@@H]1CCC[C@H]1CCO)[C@@H]1CCN(c2ccccc2)C1	ZINC000450805868	DE	On-Demand	Anodyne	SLC6A1	44	32
Cc1cc(C2CCN(C(=O)c3ccc(C#N)n3C)CC2)ccc1Br	ZINC000450805871	GH	On-Demand	Mild	FASN	43	36
C[C@H](c1ccc(CN2C(=O)CN(c3ccccc3)C2=O)cc1)C(F)(F)F	ZINC000450805889	FI	On-Demand	Anodyne	CMA1	15	40
C[C@H](c1ccc(CN2C(=O)CN(c3ccccc3)C2=O)cc1)C(F)(F)F	ZINC000450805889	FI	On-Demand	Anodyne	CTSG	20	40
C[C@@H](c1ccc(CN2C(=O)CN(c3ccccc3)C2=O)cc1)C(F)(F)F	ZINC000450805890	FI	On-Demand	Anodyne	CMA1	15	40
C[C@@H](c1ccc(CN2C(=O)CN(c3ccccc3)C2=O)cc1)C(F)(F)F	ZINC000450805890	FI	On-Demand	Anodyne	CTSG	20	40
COc1ccc(CNC(=O)CCSc2ccc(O)cc2)c(OC)c1	ZINC000450805891	EG	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCSc2ccc(O)cc2)c(OC)c1	ZINC000450805891	EG	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@]2(C)CO)c(OC)c1	ZINC000450805892	FD	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@]2(C)CO)c(OC)c1	ZINC000450805892	FD	On-Demand	Anodyne	MTNR1B	40	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@]2(C)CO)c(OC)c1	ZINC000450805893	FD	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@]2(C)CO)c(OC)c1	ZINC000450805893	FD	On-Demand	Anodyne	MTNR1B	40	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@]2(C)CO)c(OC)c1	ZINC000450805894	FD	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@]2(C)CO)c(OC)c1	ZINC000450805894	FD	On-Demand	Anodyne	MTNR1B	40	37
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@]2(C)CO)c(OC)c1	ZINC000450805895	FD	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@]2(C)CO)c(OC)c1	ZINC000450805895	FD	On-Demand	Anodyne	MTNR1B	40	37
Cc1cc(N2C[C@@H](C(C)C)[C@H]2C(C)C)n2ncnc2n1	ZINC000450805907	CF	On-Demand	Anodyne	DHOD	0	44
Cc1cc(N2C[C@@H](C(C)C)[C@@H]2C(C)C)n2ncnc2n1	ZINC000450805908	CF	On-Demand	Anodyne	DHOD	0	44
Cc1cc(N2C[C@H](C(C)C)[C@@H]2C(C)C)n2ncnc2n1	ZINC000450805909	CF	On-Demand	Anodyne	DHOD	0	44
Cc1cc(N2C[C@H](C(C)C)[C@H]2C(C)C)n2ncnc2n1	ZINC000450805910	CF	On-Demand	Anodyne	DHOD	0	44
CCSc1cc(CNC(=O)c2cccc(CC)n2)ccn1	ZINC000450805911	DG	On-Demand	Anodyne	MMP13	15	41
O=C(c1ccc(I)cc1F)N1CCC(O)(C(F)F)CC1	ZINC000450805923	GF	On-Demand	Anodyne	MAP2K1	24	44
CC(=O)CCCCCSc1nnc(N2CCOCC2)n1C	ZINC000450805937	DD	On-Demand	Anodyne	PAOX	19	42
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	MAOB	18	43
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	LTA4H	21	41
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	PTGER3	47	38
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	ACACA	21	41
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	SLC15A1	0	40
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	ACACB	28	41
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	SLC6A5	37	46
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	ACE2	21	41
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	MMP10	25	42
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	ADAMTS4	48	41
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	CYP26A1	30	41
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	FFAR1	44	46
CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450805961	EI	On-Demand	Anodyne	ADCYAP1R1	41	35
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	MAOB	18	43
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	LTA4H	21	41
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	PTGER3	47	38
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	ACACA	21	41
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	SLC15A1	0	40
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	ACACB	28	41
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	SLC6A5	37	46
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	ACE2	21	41
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	MMP10	25	42
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	ADAMTS4	48	41
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	CYP26A1	30	41
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	FFAR1	44	46
CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450805962	EI	On-Demand	Anodyne	ADCYAP1R1	41	35
CC(C)OC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450805972	CH	On-Demand	Anodyne	PLA2G4B	42	36
COCC[C@H](Nc1cc(=O)n2ccccc2n1)c1cccc(C(F)(F)F)c1	ZINC000450805981	GH	On-Demand	Anodyne	GALR3	43	30
COCC[C@@H](Nc1cc(=O)n2ccccc2n1)c1cccc(C(F)(F)F)c1	ZINC000450805982	GH	On-Demand	Anodyne	GALR3	43	30
CCSc1cc(CNC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)ccn1	ZINC000450805983	CG	On-Demand	Anodyne	NOS2	47	32
CCSc1cc(CNC(=O)C[C@@H]2CC[C@H]3C[C@H]23)ccn1	ZINC000450805984	CG	On-Demand	Anodyne	NOS2	47	32
CCSc1cc(CNC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)ccn1	ZINC000450805985	CG	On-Demand	Anodyne	NOS2	47	32
CCSc1cc(CNC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)ccn1	ZINC000450805986	CG	On-Demand	Anodyne	NOS2	47	32
CNC(=O)c1ccc(OCc2cccc3c2OC(C)(C)C3)cc1	ZINC000450805988	DG	On-Demand	Anodyne	G2YM83_BOTF4	21	41
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cn(CC3CC3)nn2)C1=O	ZINC000450805995	FD	On-Demand	Bother	CACNA1D	61	35
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(Cc2cn(CC3CC3)nn2)C1=O	ZINC000450805996	FD	On-Demand	Bother	CACNA1D	61	35
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)CC1	ZINC000450806001	GE	On-Demand	Anodyne	HTR3A	26	51
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)CC1	ZINC000450806001	GE	On-Demand	Anodyne	HRH4	18	51
O=C(c1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450806009	FF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450806009	FF	On-Demand	Bother	L3MBTL3	34	43
O=C(c1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450806010	FF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450806010	FF	On-Demand	Bother	L3MBTL3	34	43
O=C(c1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450806011	FF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450806011	FF	On-Demand	Bother	L3MBTL3	34	43
O=C(c1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450806012	FF	On-Demand	Bother	L3MBTL1	0	43
O=C(c1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450806012	FF	On-Demand	Bother	L3MBTL3	34	43
COc1cccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c1[N+](=O)[O-]	ZINC000450806017	DF	On-Demand	Bother	SSTR1	51	41
COc1cccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c1[N+](=O)[O-]	ZINC000450806018	DF	On-Demand	Bother	SSTR1	51	41
COc1cccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000450806019	DF	On-Demand	Bother	SSTR1	51	41
COc1cccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000450806020	DF	On-Demand	Bother	SSTR1	51	41
CC(C)(C)C(=O)CCCC(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450806033	DG	On-Demand	Anodyne	CPT1A	80	43
CC(C)(C)C(=O)CCCC(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450806034	DG	On-Demand	Anodyne	CPT1A	80	43
C[C@H]1CN(C(=O)c2cn(CCc3ccccc3)nn2)CCN1CCO	ZINC000450806050	EC	On-Demand	Anodyne	THYX_PBCV1	0	42
C[C@@H]1CN(C(=O)c2cn(CCc3ccccc3)nn2)CCN1CCO	ZINC000450806051	EC	On-Demand	Anodyne	THYX_PBCV1	0	42
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1)N1CCCC1	ZINC000450806063	FD	On-Demand	Anodyne	GCK	46	31
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1)N1CCCC1	ZINC000450806063	FD	On-Demand	Anodyne	GCKR	74	34
COCCN(Cc1cccnc1)CC1(C#N)CCC1	ZINC000450806064	CE	On-Demand	Mild	NR1D1	40	40
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1)N1CCCC1	ZINC000450806065	FD	On-Demand	Anodyne	GCK	46	31
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1)N1CCCC1	ZINC000450806065	FD	On-Demand	Anodyne	GCKR	74	34
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1)N1CCCC1	ZINC000450806066	FD	On-Demand	Anodyne	GCK	46	31
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1)N1CCCC1	ZINC000450806066	FD	On-Demand	Anodyne	GCKR	74	34
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1)N1CCCC1	ZINC000450806069	FD	On-Demand	Anodyne	GCK	46	31
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1)N1CCCC1	ZINC000450806069	FD	On-Demand	Anodyne	GCKR	74	34
O=C([C@@H](O)C1CCC1)N1CCCCC[C@@H]1c1ncon1	ZINC000450806072	CD	On-Demand	Anodyne	COLA	49	37
O=C([C@@H](O)C1CCC1)N1CCCCC[C@@H]1c1ncon1	ZINC000450806072	CD	On-Demand	Anodyne	CPT1A	44	36
O=C([C@H](O)C1CCC1)N1CCCCC[C@H]1c1ncon1	ZINC000450806075	CD	On-Demand	Anodyne	COLA	49	37
O=C([C@H](O)C1CCC1)N1CCCCC[C@H]1c1ncon1	ZINC000450806075	CD	On-Demand	Anodyne	CPT1A	44	36
O=C([C@@H](O)C1CCC1)N1CCCCC[C@H]1c1ncon1	ZINC000450806077	CD	On-Demand	Anodyne	COLA	49	37
O=C([C@@H](O)C1CCC1)N1CCCCC[C@H]1c1ncon1	ZINC000450806077	CD	On-Demand	Anodyne	CPT1A	44	36
O=C([C@H](O)C1CCC1)N1CCCCC[C@@H]1c1ncon1	ZINC000450806078	CD	On-Demand	Anodyne	COLA	49	37
O=C([C@H](O)C1CCC1)N1CCCCC[C@@H]1c1ncon1	ZINC000450806078	CD	On-Demand	Anodyne	CPT1A	44	36
CCS(=O)(=O)C1CN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C1	ZINC000450806097	GF	On-Demand	Anodyne	SMO	47	53
COC(=O)CCSc1ncccc1NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450806098	FG	On-Demand	Anodyne	CCKAR	0	49
COCCN(CCc1cscn1)Cc1cccnc1	ZINC000450806099	CE	On-Demand	Anodyne	NR1D1	43	36
CC(C)[C@@H]1CCCN(CCc2cscn2)C1	ZINC000450806105	BG	On-Demand	Anodyne	BIRC2	41	34
CC(C)[C@H]1CCCN(CCc2cscn2)C1	ZINC000450806107	BG	On-Demand	Anodyne	BIRC2	41	34
CCS(=O)(=O)C1CN(c2ccccc2[N+](=O)[O-])C1	ZINC000450806122	CD	On-Demand	Bother	COLA	55	32
CCCN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1=O	ZINC000450806174	GE	On-Demand	Bother	CACNA1D	52	33
CCc1cc(N2CCCc3ccccc3CC2)n2ncnc2n1	ZINC000450806185	DF	On-Demand	Anodyne	DHOD	0	46
Cc1cnccc1CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450806201	CF	On-Demand	Anodyne	EPHX2	0	41
c1ccc(N2CCCc3ccccc3CC2)nc1	ZINC000450806211	BG	On-Demand	Anodyne	DRD4	29	40
c1ccc(N2CCCc3ccccc3CC2)nc1	ZINC000450806211	BG	On-Demand	Anodyne	EBP	28	42
CC[C@H]1C(=O)N(CC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450806215	EE	On-Demand	Anodyne	OPRM1	15	41
CC[C@H]1C(=O)N(CC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450806215	EE	On-Demand	Anodyne	OPRK1	44	42
CC[C@@H]1C(=O)N(CC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450806217	EE	On-Demand	Anodyne	OPRM1	15	41
CC[C@@H]1C(=O)N(CC)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450806217	EE	On-Demand	Anodyne	OPRK1	44	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2nnc(C(F)(F)F)s2)C1	ZINC000450806221	FH	On-Demand	Anodyne	DRD4	20	40
C[C@H]1CN(Cc2ccccc2)CCN(c2nnc(C(F)(F)F)s2)C1	ZINC000450806222	FH	On-Demand	Anodyne	DRD4	20	40
CC(C)(CC(=O)COc1cccc(S(C)(=O)=O)c1)C1CC1	ZINC000450806226	DF	On-Demand	Anodyne	NR1H3	60	37
COCCN1C(=O)CCc2cc(NC(=O)[C@@]3(C#N)C[C@@H]3C)ccc21	ZINC000450806231	EE	On-Demand	Mild	NAMPT	23	44
COCCN1C(=O)CCc2cc(NC(=O)[C@@]3(C#N)C[C@H]3C)ccc21	ZINC000450806232	EE	On-Demand	Mild	NAMPT	23	44
COCCN1C(=O)CCc2cc(NC(=O)[C@]3(C#N)C[C@@H]3C)ccc21	ZINC000450806233	EE	On-Demand	Mild	NAMPT	23	44
COCCN1C(=O)CCc2cc(NC(=O)[C@]3(C#N)C[C@H]3C)ccc21	ZINC000450806234	EE	On-Demand	Mild	NAMPT	23	44
COc1cc2nc(N3CCC[C@@]4(CCS(=O)(=O)C4)C3)nc(N)c2cc1OC	ZINC000450806238	GD	On-Demand	Anodyne	ADRA1B	41	49
COc1cc2nc(N3CCC[C@@]4(CCS(=O)(=O)C4)C3)nc(N)c2cc1OC	ZINC000450806238	GD	On-Demand	Anodyne	PDE3B	52	33
COc1cc2nc(N3CCC[C@@]4(CCS(=O)(=O)C4)C3)nc(N)c2cc1OC	ZINC000450806238	GD	On-Demand	Anodyne	EHMT2	58	42
COc1cc2nc(N3CCC[C@]4(CCS(=O)(=O)C4)C3)nc(N)c2cc1OC	ZINC000450806239	GD	On-Demand	Anodyne	ADRA1B	41	49
COc1cc2nc(N3CCC[C@]4(CCS(=O)(=O)C4)C3)nc(N)c2cc1OC	ZINC000450806239	GD	On-Demand	Anodyne	PDE3B	52	33
COc1cc2nc(N3CCC[C@]4(CCS(=O)(=O)C4)C3)nc(N)c2cc1OC	ZINC000450806239	GD	On-Demand	Anodyne	EHMT2	58	42
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450806278	GF	On-Demand	Bother	CXCR3	31	40
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450806279	GF	On-Demand	Bother	CXCR3	31	40
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450806281	FH	On-Demand	Anodyne	NOS1	15	45
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450806281	FH	On-Demand	Anodyne	NAMPT	31	49
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450806282	FH	On-Demand	Anodyne	NOS1	15	45
CCC[C@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450806282	FH	On-Demand	Anodyne	NAMPT	31	49
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450806283	FH	On-Demand	Anodyne	NOS1	15	45
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450806283	FH	On-Demand	Anodyne	NAMPT	31	49
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450806284	FH	On-Demand	Anodyne	NOS1	15	45
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450806284	FH	On-Demand	Anodyne	NAMPT	31	49
CCN1CCN(C(=O)Cc2ccc(O)c(OC)c2)[C@H](C)C1=O	ZINC000450806288	DD	On-Demand	Anodyne	TRPV1	0	45
CCN1CCN(C(=O)Cc2ccc(O)c(OC)c2)[C@@H](C)C1=O	ZINC000450806289	DD	On-Demand	Anodyne	TRPV1	0	45
COCC[C@@H](Nc1ncnc2[nH]cnc12)c1cccc(C(F)(F)F)c1	ZINC000450806301	FH	On-Demand	Anodyne	AHK3	0	44
COCC[C@H](Nc1ncnc2[nH]cnc12)c1cccc(C(F)(F)F)c1	ZINC000450806302	FH	On-Demand	Anodyne	AHK3	0	44
NC(=O)[C@H]1CCCN1c1ncnc2cccc(F)c12	ZINC000450806303	CD	On-Demand	Anodyne	SIRT3	41	32
NC(=O)[C@H]1CCCN1c1ncnc2cccc(F)c12	ZINC000450806303	CD	On-Demand	Anodyne	SIRT1	41	32
COc1cc(-c2noc(CSc3nnc4cc(C)nc(C)n34)n2)ncn1	ZINC000450806324	FD	On-Demand	Anodyne	AXIN2	0	42
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)Cc2scnc2-c2ccccc2)c1	ZINC000450806342	GJ	On-Demand	Anodyne	COLA	47	35
COc1cccc([C@@H]2C[C@H](C)CN2C(=O)Cc2scnc2-c2ccccc2)c1	ZINC000450806342	GJ	On-Demand	Anodyne	CPT1A	44	35
COc1cccc([C@H]2C[C@H](C)CN2C(=O)Cc2scnc2-c2ccccc2)c1	ZINC000450806343	GJ	On-Demand	Anodyne	COLA	47	35
COc1cccc([C@H]2C[C@H](C)CN2C(=O)Cc2scnc2-c2ccccc2)c1	ZINC000450806343	GJ	On-Demand	Anodyne	CPT1A	44	35
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)Cc2scnc2-c2ccccc2)c1	ZINC000450806344	GJ	On-Demand	Anodyne	COLA	47	35
COc1cccc([C@H]2C[C@@H](C)CN2C(=O)Cc2scnc2-c2ccccc2)c1	ZINC000450806344	GJ	On-Demand	Anodyne	CPT1A	44	35
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)Cc2scnc2-c2ccccc2)c1	ZINC000450806345	GJ	On-Demand	Anodyne	COLA	47	35
COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)Cc2scnc2-c2ccccc2)c1	ZINC000450806345	GJ	On-Demand	Anodyne	CPT1A	44	35
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450806356	ED	On-Demand	Bother	CACNA1C	57	36
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450806356	ED	On-Demand	Bother	CACNA1D	89	36
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450806357	ED	On-Demand	Bother	CACNA1C	57	36
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450806357	ED	On-Demand	Bother	CACNA1D	89	36
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450806358	ED	On-Demand	Bother	CACNA1C	57	36
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450806358	ED	On-Demand	Bother	CACNA1D	89	36
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450806359	ED	On-Demand	Bother	CACNA1C	57	36
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2C[C@H]3CC[C@H]2O3)C1=O	ZINC000450806359	ED	On-Demand	Bother	CACNA1D	89	36
O=C([C@@H]1CCCC[C@@H]1c1ccccc1)N1CCC(O)(C(F)F)CC1	ZINC000450806369	EH	On-Demand	Anodyne	PREP	19	41
CCOC(=O)[C@H](CCC(C)(C)C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450806371	EF	On-Demand	Anodyne	TRPV1	27	48
CCOC(=O)[C@@H](CCC(C)(C)C)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450806372	EF	On-Demand	Anodyne	TRPV1	27	48
C=C[C@@H]1OCCC[C@H]1Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450806373	EF	On-Demand	Mild	TAAR1	16	40
NC(=O)[C@H]1CCCN1c1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450806384	CC	On-Demand	Bother	TXN	18	46
CO[C@@H]1COCC[C@@H]1CC(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450806393	FH	On-Demand	Anodyne	E1	0	46
CO[C@@H]1COCC[C@@H]1CC(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450806394	FH	On-Demand	Anodyne	E1	0	46
CO[C@@H]1COCC[C@H]1CC(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450806395	FH	On-Demand	Anodyne	E1	0	46
CO[C@@H]1COCC[C@H]1CC(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450806396	FH	On-Demand	Anodyne	E1	0	46
CO[C@@H](CN[C@H](C)c1nc2ccccc2n1C(F)F)Cc1ccccc1	ZINC000450806409	FI	On-Demand	Anodyne	ALOX5AP	30	42
CO[C@@H](CN[C@@H](C)c1nc2ccccc2n1C(F)F)Cc1ccccc1	ZINC000450806410	FI	On-Demand	Anodyne	ALOX5AP	30	42
CO[C@H](CN[C@@H](C)c1nc2ccccc2n1C(F)F)Cc1ccccc1	ZINC000450806411	FI	On-Demand	Anodyne	ALOX5AP	30	42
CO[C@H](CN[C@H](C)c1nc2ccccc2n1C(F)F)Cc1ccccc1	ZINC000450806412	FI	On-Demand	Anodyne	ALOX5AP	30	42
COCCO[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450806413	CF	On-Demand	Anodyne	SLC6A1	27	49
COCCO[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450806413	CF	On-Demand	Anodyne	SIGMAR1	24	44
COCCO[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450806414	CF	On-Demand	Anodyne	SLC6A1	27	49
COCCO[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450806414	CF	On-Demand	Anodyne	SIGMAR1	24	44
C=CCNC(=O)c1ccc(N2CCCc3ccccc3CC2)nc1	ZINC000450806428	DF	On-Demand	Mild	HPGDS	20	43
CC(=O)c1ccc(N2CCCc3ccccc3CC2)nc1	ZINC000450806465	CG	On-Demand	Anodyne	HPGDS	15	40
CS(=O)(=O)c1cccc(CN2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)c1	ZINC000450806527	GI	On-Demand	Anodyne	COLA	23	41
CS(=O)(=O)c1cccc(CN2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)c1	ZINC000450806527	GI	On-Demand	Anodyne	CPT1A	22	41
CS(=O)(=O)c1cccc(CN2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)c1	ZINC000450806528	GI	On-Demand	Anodyne	COLA	23	41
CS(=O)(=O)c1cccc(CN2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)c1	ZINC000450806528	GI	On-Demand	Anodyne	CPT1A	22	41
CCCc1nc(C)c(COc2cc(C(=O)OC)ccc2[N+](=O)[O-])o1	ZINC000450806538	EG	On-Demand	Bother	GSTM2	52	37
COc1cc(CC(=O)N2CCCCC[C@H]2c2ncon2)ccc1Cl	ZINC000450806539	EG	On-Demand	Anodyne	OPRM1	0	47
COc1cc(CC(=O)N2CCCCC[C@H]2c2ncon2)ccc1Cl	ZINC000450806539	EG	On-Demand	Anodyne	OPRK1	24	46
COc1cc(CC(=O)N2CCCCC[C@H]2c2ncon2)ccc1Cl	ZINC000450806539	EG	On-Demand	Anodyne	PRCP	31	43
COc1cc(CC(=O)N2CCCCC[C@H]2c2ncon2)ccc1Cl	ZINC000450806539	EG	On-Demand	Anodyne	COLA	121	41
COc1cc(CC(=O)N2CCCCC[C@H]2c2ncon2)ccc1Cl	ZINC000450806539	EG	On-Demand	Anodyne	CPT1A	103	41
COc1cc(CC(=O)N2CCCCC[C@@H]2c2ncon2)ccc1Cl	ZINC000450806540	EG	On-Demand	Anodyne	OPRM1	0	47
COc1cc(CC(=O)N2CCCCC[C@@H]2c2ncon2)ccc1Cl	ZINC000450806540	EG	On-Demand	Anodyne	OPRK1	24	46
COc1cc(CC(=O)N2CCCCC[C@@H]2c2ncon2)ccc1Cl	ZINC000450806540	EG	On-Demand	Anodyne	PRCP	31	43
COc1cc(CC(=O)N2CCCCC[C@@H]2c2ncon2)ccc1Cl	ZINC000450806540	EG	On-Demand	Anodyne	COLA	121	41
COc1cc(CC(=O)N2CCCCC[C@@H]2c2ncon2)ccc1Cl	ZINC000450806540	EG	On-Demand	Anodyne	CPT1A	103	41
O=C(CCCC(=O)N1CC[C@@H]2CCC[C@@H]21)C1CC1	ZINC000450806560	BF	On-Demand	Anodyne	PREP	27	41
O=C(CCCC(=O)N1CC[C@H]2CCC[C@H]21)C1CC1	ZINC000450806561	BF	On-Demand	Anodyne	PREP	27	41
O=C(CCCC(=O)N1CC[C@@H]2CCC[C@H]21)C1CC1	ZINC000450806562	BF	On-Demand	Anodyne	PREP	27	41
O=C(CCCC(=O)N1CC[C@H]2CCC[C@@H]21)C1CC1	ZINC000450806563	BF	On-Demand	Anodyne	PREP	27	41
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)[C@@H](O)C2CCC2)c1	ZINC000450806607	FH	On-Demand	Anodyne	HSD17B2	0	42
COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)[C@H](O)C2CCC2)c1	ZINC000450806608	FH	On-Demand	Anodyne	HSD17B2	0	42
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)[C@@H](O)C2CCC2)c1	ZINC000450806609	FH	On-Demand	Anodyne	HSD17B2	0	42
COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)[C@H](O)C2CCC2)c1	ZINC000450806610	FH	On-Demand	Anodyne	HSD17B2	0	42
NC(=O)c1ccc(CCC(=O)NCCCCCc2ccc(F)cc2)cc1	ZINC000450806611	FG	On-Demand	Anodyne	SCNN1A	50	36
NC(=O)c1ccc(CCC(=O)NCCCCCc2ccc(F)cc2)cc1	ZINC000450806611	FG	On-Demand	Anodyne	SCN5A	0	41
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC(C)C)cc2)cc1	ZINC000450806614	FH	On-Demand	Anodyne	MMP13	37	46
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC(C)C)cc2)cc1	ZINC000450806614	FH	On-Demand	Anodyne	ADAM17	46	37
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC(C)C)cc2)cc1	ZINC000450806614	FH	On-Demand	Anodyne	MMP2	28	43
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC(C)C)cc2)cc1	ZINC000450806614	FH	On-Demand	Anodyne	MMP14	26	46
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC(C)C)cc2)cc1	ZINC000450806614	FH	On-Demand	Anodyne	MMP9	28	40
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC(C)C)cc2)cc1	ZINC000450806614	FH	On-Demand	Anodyne	ACR	16	40
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC(C)C)cc2)cc1	ZINC000450806614	FH	On-Demand	Anodyne	ADAMTS4	70	47
C[C@@H](CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O)S(C)(=O)=O	ZINC000450806615	FC	On-Demand	Bother	CACNA1D	68	31
C[C@H](CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O)S(C)(=O)=O	ZINC000450806616	FC	On-Demand	Bother	CACNA1D	68	31
C[C@@H](CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O)S(C)(=O)=O	ZINC000450806617	FC	On-Demand	Bother	CACNA1D	68	31
C[C@H](CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O)S(C)(=O)=O	ZINC000450806618	FC	On-Demand	Bother	CACNA1D	68	31
Cc1nccc(N2C[C@@H](C(C)C)[C@H]2C(C)C)n1	ZINC000450806626	BF	On-Demand	Anodyne	SORD	68	37
Cc1nccc(N2C[C@@H](C(C)C)[C@@H]2C(C)C)n1	ZINC000450806627	BF	On-Demand	Anodyne	SORD	68	37
Cc1nccc(N2C[C@H](C(C)C)[C@@H]2C(C)C)n1	ZINC000450806628	BF	On-Demand	Anodyne	SORD	68	37
Cc1nccc(N2C[C@H](C(C)C)[C@H]2C(C)C)n1	ZINC000450806629	BF	On-Demand	Anodyne	SORD	68	37
CC(=O)N[C@H](C(=O)N(C)CC1(O)CCCCCC1)C(C)(C)C	ZINC000450806633	DE	On-Demand	Anodyne	PDF	50	35
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2CCCC2(F)F)C1=O	ZINC000450806638	FF	On-Demand	Bother	CACNA1D	81	35
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@H]2CCCC2(F)F)C1=O	ZINC000450806639	FF	On-Demand	Bother	CACNA1D	81	35
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2CCCC2(F)F)C1=O	ZINC000450806640	FF	On-Demand	Bother	CACNA1D	81	35
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(C[C@@H]2CCCC2(F)F)C1=O	ZINC000450806641	FF	On-Demand	Bother	CACNA1D	81	35
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@H](O)CC[C@@H]5C4)c23)cc1	ZINC000450806651	GI	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@H](O)CC[C@@H]5C4)c23)cc1	ZINC000450806651	GI	On-Demand	Anodyne	ADRB3	17	52
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@H](O)CC[C@@H]5C4)c23)cc1	ZINC000450806651	GI	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@@H](O)CC[C@H]5C4)c23)cc1	ZINC000450806652	GI	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@@H](O)CC[C@H]5C4)c23)cc1	ZINC000450806652	GI	On-Demand	Anodyne	ADRB3	17	52
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@@H](O)CC[C@H]5C4)c23)cc1	ZINC000450806652	GI	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@H](O)CC[C@H]5C4)c23)cc1	ZINC000450806653	GI	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@H](O)CC[C@H]5C4)c23)cc1	ZINC000450806653	GI	On-Demand	Anodyne	ADRB3	17	52
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@H](O)CC[C@H]5C4)c23)cc1	ZINC000450806653	GI	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@@H](O)CC[C@@H]5C4)c23)cc1	ZINC000450806654	GI	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@@H](O)CC[C@@H]5C4)c23)cc1	ZINC000450806654	GI	On-Demand	Anodyne	ADRB3	17	52
COc1ccc(-c2csc3ncnc(N4CC[C@@H]5C[C@@H](O)CC[C@@H]5C4)c23)cc1	ZINC000450806654	GI	On-Demand	Anodyne	PDE3B	50	34
Cc1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)s1	ZINC000450806698	DG	On-Demand	Anodyne	DRD4	29	41
Cc1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)s1	ZINC000450806698	DG	On-Demand	Anodyne	SIGMAR1	22	40
Cc1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)s1	ZINC000450806703	DG	On-Demand	Anodyne	DRD4	29	41
Cc1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)s1	ZINC000450806703	DG	On-Demand	Anodyne	SIGMAR1	22	40
CNc1ccc(S(=O)(=O)N(C)Cc2nnc(C(C)C)s2)cc1[N+](=O)[O-]	ZINC000450806709	GE	On-Demand	Bother	BDKRB1	0	40
CNc1ccc(S(=O)(=O)N(C)Cc2nnc(C(C)C)s2)cc1[N+](=O)[O-]	ZINC000450806709	GE	On-Demand	Bother	COLA	67	34
C=CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450806712	FF	On-Demand	Mild	HDAC1	23	47
C=CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450806715	FF	On-Demand	Mild	HDAC1	23	47
C[C@H]1CN(Cc2ccccc2)CCN(c2nccc(CO)n2)C1	ZINC000450806735	DD	On-Demand	Anodyne	SORD	54	39
C[C@@H]1CN(Cc2ccccc2)CCN(c2nccc(CO)n2)C1	ZINC000450806737	DD	On-Demand	Anodyne	SORD	54	39
CC[C@]1(CO)CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450806758	FH	On-Demand	Anodyne	MC4R	34	42
CC[C@]1(CO)CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450806758	FH	On-Demand	Anodyne	PRCP	50	38
CC[C@]1(CO)CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450806758	FH	On-Demand	Anodyne	MC3R	44	42
CC[C@]1(CO)CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450806758	FH	On-Demand	Anodyne	MC5R	31	42
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450806762	FH	On-Demand	Anodyne	MC4R	34	42
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450806762	FH	On-Demand	Anodyne	PRCP	50	38
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450806762	FH	On-Demand	Anodyne	MC3R	44	42
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450806762	FH	On-Demand	Anodyne	MC5R	31	42
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450806766	FH	On-Demand	Anodyne	MC4R	34	42
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450806766	FH	On-Demand	Anodyne	PRCP	50	38
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450806766	FH	On-Demand	Anodyne	MC3R	44	42
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450806766	FH	On-Demand	Anodyne	MC5R	31	42
COC(=O)c1coc(CN2CCN(c3ncnc4sc(C)cc34)CC2)n1	ZINC000450806768	FE	On-Demand	Anodyne	SIRT3	41	32
CC[C@]1(CO)CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450806770	FH	On-Demand	Anodyne	MC4R	34	42
CC[C@]1(CO)CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450806770	FH	On-Demand	Anodyne	PRCP	50	38
CC[C@]1(CO)CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450806770	FH	On-Demand	Anodyne	MC3R	44	42
CC[C@]1(CO)CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450806770	FH	On-Demand	Anodyne	MC5R	31	42
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nn1	ZINC000450806771	ED	On-Demand	Anodyne	SCD1	47	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nn1	ZINC000450806771	ED	On-Demand	Anodyne	SCD	38	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nn1	ZINC000450806774	ED	On-Demand	Anodyne	SCD1	47	41
CNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nn1	ZINC000450806774	ED	On-Demand	Anodyne	SCD	38	41
CC(C)O[C@@]1(C(=O)NCCCCCc2ccc(F)cc2)CCOC1	ZINC000450806777	EG	On-Demand	Anodyne	LEF	45	38
CC(C)O[C@]1(C(=O)NCCCCCc2ccc(F)cc2)CCOC1	ZINC000450806779	EG	On-Demand	Anodyne	LEF	45	38
CNS(=O)(=O)NCC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450806782	GC	On-Demand	Anodyne	CNR1	0	45
CNS(=O)(=O)NCC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450806782	GC	On-Demand	Anodyne	CNR2	0	48
CNS(=O)(=O)NCC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450806782	GC	On-Demand	Anodyne	EPHX2	28	41
COCC[C@@H](Nc1ncc(S(N)(=O)=O)s1)c1cccc(C(F)(F)F)c1	ZINC000450806787	GF	On-Demand	Anodyne	SCD1	0	41
COCC[C@H](Nc1ncc(S(N)(=O)=O)s1)c1cccc(C(F)(F)F)c1	ZINC000450806793	GF	On-Demand	Anodyne	SCD1	0	41
COCCN1C(=O)CCc2cc(NC(=O)CCc3nc4cnccc4[nH]3)ccc21	ZINC000450806795	GE	On-Demand	Anodyne	ENPP1	41	33
CCc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CCOC)n1	ZINC000450806808	FF	On-Demand	Anodyne	NAMPT	0	45
COc1ccc(CNC(=O)CCN[C@H]2CCCC2(C)C)c(OC)c1	ZINC000450806809	EF	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCN[C@@H]2CCCC2(C)C)c(OC)c1	ZINC000450806811	EF	On-Demand	Anodyne	MTNR1A	49	36
COCCN1C(=O)CCc2cc(NC(=O)c3scnc3C(C)C)ccc21	ZINC000450806833	FG	On-Demand	Anodyne	NAMPT	25	45
C[C@H]1CN(Cc2ccccc2)CCN(c2c(C#N)cccc2C#N)C1	ZINC000450806840	EG	On-Demand	Mild	SIGMAR1	32	41
COC[C@H](C)n1ccc(NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)n1	ZINC000450806843	GF	On-Demand	Anodyne	DRD4	41	32
COC[C@H](C)n1ccc(NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)n1	ZINC000450806843	GF	On-Demand	Anodyne	MTNR1B	18	41
COC[C@H](C)n1ccc(NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)n1	ZINC000450806843	GF	On-Demand	Anodyne	GCK	52	51
C[C@@H]1CN(Cc2ccccc2)CCN(c2c(C#N)cccc2C#N)C1	ZINC000450806844	EG	On-Demand	Mild	SIGMAR1	32	41
COC[C@@H](C)n1ccc(NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)n1	ZINC000450806845	GF	On-Demand	Anodyne	DRD4	41	32
COC[C@@H](C)n1ccc(NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)n1	ZINC000450806845	GF	On-Demand	Anodyne	MTNR1B	18	41
COC[C@@H](C)n1ccc(NC(=O)c2ccc(Oc3cccc(OC)c3)cn2)n1	ZINC000450806845	GF	On-Demand	Anodyne	GCK	52	51
CCC[C@@H](O)CN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450806859	DE	On-Demand	Anodyne	SIRT3	48	31
CCC[C@H](O)CN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450806863	DE	On-Demand	Anodyne	SIRT3	48	31
CC[C@]1(O)CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450806865	CD	On-Demand	Anodyne	GNAI1	0	40
CNC(=O)c1cccnc1N1CCCc2ccccc2CC1	ZINC000450806866	CE	On-Demand	Anodyne	G2YM83_BOTF4	46	35
COC(=O)c1ccc(CN2C[C@H](F)C[C@@H]2CO)cc1Cl	ZINC000450806867	DE	On-Demand	Anodyne	ITGA4	46	35
COC(=O)c1ccc(CN2C[C@H](F)C[C@H]2CO)cc1Cl	ZINC000450806868	DE	On-Demand	Anodyne	ITGA4	46	35
COC(=O)c1ccc(CN2C[C@@H](F)C[C@H]2CO)cc1Cl	ZINC000450806869	DE	On-Demand	Anodyne	ITGA4	46	35
COC(=O)c1ccc(CN2C[C@@H](F)C[C@@H]2CO)cc1Cl	ZINC000450806870	DE	On-Demand	Anodyne	ITGA4	46	35
CC[C@@]1(O)CCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450806875	CD	On-Demand	Anodyne	GNAI1	0	40
CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@H](C)C1=O	ZINC000450806882	DD	On-Demand	Anodyne	OPRM1	0	41
CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@H](C)C1=O	ZINC000450806882	DD	On-Demand	Anodyne	OPRK1	42	41
CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C)C1=O	ZINC000450806888	DD	On-Demand	Anodyne	OPRM1	0	41
CCN1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)[C@@H](C)C1=O	ZINC000450806888	DD	On-Demand	Anodyne	OPRK1	42	41
Cc1cnccc1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450806893	FE	On-Demand	Anodyne	CA5B	26	40
Cc1cnccc1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450806893	FE	On-Demand	Anodyne	CA5A	25	40
Cc1cnccc1CNC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450806893	FE	On-Demand	Anodyne	NAMPT	103	39
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@@H]2C[C@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000450806898	FF	On-Demand	Bother	TAAR1	17	42
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@@H]2C[C@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000450806899	FF	On-Demand	Bother	TAAR1	17	42
Cn1cc(-c2ccc(C(=O)N3CCCCC[C@@H]3c3ncon3)o2)cn1	ZINC000450806901	EF	On-Demand	Anodyne	COLA	52	37
Cn1cc(-c2ccc(C(=O)N3CCCCC[C@H]3c3ncon3)o2)cn1	ZINC000450806902	EF	On-Demand	Anodyne	COLA	52	37
COc1ccnc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)n1	ZINC000450806919	GE	On-Demand	Anodyne	EPHB4	50	40
COc1cccc(-n2cc(C(=O)N3CCN(CCO)[C@H](C)C3)nn2)c1	ZINC000450806931	EC	On-Demand	Anodyne	DRD4	40	31
COc1cccc(-n2cc(C(=O)N3CCN(CCO)[C@@H](C)C3)nn2)c1	ZINC000450806932	EC	On-Demand	Anodyne	DRD4	40	31
CC(C)[C@H]1CCN1c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000450806937	BF	On-Demand	Mild	AR	20	45
CC(C)[C@@H]1CCN1c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000450806938	BF	On-Demand	Mild	AR	20	45
CC(C)[C@H]1CCN1c1cnc2ccccc2n1	ZINC000450806939	BF	On-Demand	Anodyne	SORD	24	47
CC(C)[C@@H]1CCN1c1cnc2ccccc2n1	ZINC000450806940	BF	On-Demand	Anodyne	SORD	24	47
N#Cc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc1Cl	ZINC000450806949	CG	On-Demand	Mild	NR3C2	24	40
N#Cc1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc1Cl	ZINC000450806950	CG	On-Demand	Mild	NR3C2	24	40
N#Cc1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc1Cl	ZINC000450806951	CG	On-Demand	Mild	NR3C2	24	40
N#Cc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc1Cl	ZINC000450806952	CG	On-Demand	Mild	NR3C2	24	40
c1ccc2c(c1)CCCN(c1cc(N3CCOCC3)ncn1)CC2	ZINC000450807005	DE	On-Demand	Anodyne	SMG1	41	33
CC(=O)c1cccc(CN2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450807052	DE	On-Demand	Anodyne	HRH3	25	40
CC(=O)c1cccc(CN2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450807052	DE	On-Demand	Anodyne	SIGMAR1	29	41
CC(=O)c1cccc(CN2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450807052	DE	On-Demand	Anodyne	TRY2_BOVIN	48	32
CC(=O)c1cccc(CN2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450807052	DE	On-Demand	Anodyne	CCR3	22	42
CC(=O)c1cccc(CN2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450807052	DE	On-Demand	Anodyne	PREP	42	41
CC(=O)c1cccc(CN2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450807052	DE	On-Demand	Anodyne	FAAH	23	45
CC(=O)c1cccc(CN2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450807052	DE	On-Demand	Anodyne	MGLL	0	45
CCOC(=O)c1ccnc(N2CCCc3ccccc3CC2)c1[N+](=O)[O-]	ZINC000450807057	FG	On-Demand	Bother	P2RY12	43	35
COC(=O)CCSc1ncccc1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450807066	GI	On-Demand	Anodyne	SORT1	20	40
COC(=O)CCSc1ncccc1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450807066	GI	On-Demand	Anodyne	MTTP	48	34
COc1ccc(CNC(=O)CCN2C[C@@H](F)C[C@H]2CO)c(OC)c1	ZINC000450807068	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2C[C@H](F)C[C@H]2CO)c(OC)c1	ZINC000450807069	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2C[C@@H](F)C[C@@H]2CO)c(OC)c1	ZINC000450807070	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2C[C@H](F)C[C@@H]2CO)c(OC)c1	ZINC000450807071	ED	On-Demand	Anodyne	MTNR1A	43	35
CC(=O)CCCCCSc1ccc(C#N)cc1	ZINC000450807072	BH	On-Demand	Mild	THRB	0	41
CS(=O)(=O)c1ccc(N2CCCc3ccccc3CC2)cc1	ZINC000450807077	DG	On-Demand	Anodyne	PTGS2	49	40
CS(=O)(=O)c1ccc(N2CCCc3ccccc3CC2)cc1	ZINC000450807077	DG	On-Demand	Anodyne	AKR1C3	23	44
N#Cc1nc(N2CCC[C@@H]2C(N)=O)ccc1C(F)(F)F	ZINC000450807082	CD	On-Demand	Mild	ERG	0	40
COC[C@@H](C)n1ccc(NC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450807102	EE	On-Demand	Anodyne	TACR3	19	41
COC[C@@H](C)n1ccc(NC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450807102	EE	On-Demand	Anodyne	CTSV	48	34
COC[C@@H](C)n1ccc(NC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450807102	EE	On-Demand	Anodyne	GCK	29	40
COC[C@H](C)n1ccc(NC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450807105	EE	On-Demand	Anodyne	TACR3	19	41
COC[C@H](C)n1ccc(NC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450807105	EE	On-Demand	Anodyne	CTSV	48	34
COC[C@H](C)n1ccc(NC(=O)c2cc(-c3ccccc3)nn2C)n1	ZINC000450807105	EE	On-Demand	Anodyne	GCK	29	40
COCC[C@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450807110	GF	On-Demand	Anodyne	TNIK	15	40
COCC[C@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450807110	GF	On-Demand	Anodyne	SMG1	18	40
COCC[C@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450807110	GF	On-Demand	Anodyne	MAP3K12	15	41
COCC[C@@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450807112	GF	On-Demand	Anodyne	TNIK	15	40
COCC[C@@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450807112	GF	On-Demand	Anodyne	SMG1	18	40
COCC[C@@H](Nc1ccnc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000450807112	GF	On-Demand	Anodyne	MAP3K12	15	41
COc1ccc(CNC(=O)CCn2cnc3ccc(C)cc3c2=O)c(OC)c1	ZINC000450807141	GE	On-Demand	Anodyne	PDGFRB	41	45
COc1ccc(CNC(=O)CCn2cnc3ccc(C)cc3c2=O)c(OC)c1	ZINC000450807141	GE	On-Demand	Anodyne	MTNR1A	28	41
COc1ccc(CNC(=O)CCn2cnc3ccc(C)cc3c2=O)c(OC)c1	ZINC000450807141	GE	On-Demand	Anodyne	MTNR1B	21	41
COc1ccc(CNC(=O)CCn2cnc3ccc(C)cc3c2=O)c(OC)c1	ZINC000450807141	GE	On-Demand	Anodyne	CSF1R	16	44
Cc1cnc(CCCC(=O)NCCCCCc2ccc(F)cc2)o1	ZINC000450807143	EH	On-Demand	Anodyne	PLA2G7	25	40
Cc1cnc(CCCC(=O)NCCCCCc2ccc(F)cc2)o1	ZINC000450807143	EH	On-Demand	Anodyne	FAAH	53	42
Cc1cnc(CCCC(=O)NCCCCCc2ccc(F)cc2)o1	ZINC000450807143	EH	On-Demand	Anodyne	CES1D	57	33
Cc1[nH]c(C#N)cc1C(=O)NCCCCCc1ccc(F)cc1	ZINC000450807164	DG	On-Demand	Mild	CNR2	28	41
Cc1[nH]c(C#N)cc1C(=O)NCCCCCc1ccc(F)cc1	ZINC000450807164	DG	On-Demand	Mild	LEF	42	35
CC1(O)CC(C(=O)NCCCCCc2ccc(F)cc2)C1	ZINC000450807170	CF	On-Demand	Anodyne	SCNN1A	45	34
O=C(CCc1nc2cnccc2[nH]1)NCCCCCc1ccc(F)cc1	ZINC000450807172	FH	On-Demand	Anodyne	PLA2G7	15	41
O=C(CCc1nc2cnccc2[nH]1)NCCCCCc1ccc(F)cc1	ZINC000450807172	FH	On-Demand	Anodyne	CYSP_TRYCR	0	42
CCCOc1ccc(C(=O)N2CCC(O)(C(F)F)CC2)c(OC)c1	ZINC000450807184	EF	On-Demand	Anodyne	OXTR	23	42
Cc1cnc(CCCC(=O)Nc2nnc(Cc3ccc(Cl)cc3)s2)o1	ZINC000450807205	GI	On-Demand	Anodyne	GLS	0	40
COC(=O)c1ccc([N+](=O)[O-])c(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450807218	GF	On-Demand	Bother	SIGMAR1	18	40
COC(=O)c1ccc([N+](=O)[O-])c(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450807219	GF	On-Demand	Bother	SIGMAR1	18	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450807220	EF	On-Demand	Bother	SIGMAR1	21	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450807221	EF	On-Demand	Bother	SIGMAR1	21	40
CC(C)NC(=O)c1ccc(N2CCC[C@@]3(CCS(=O)(=O)C3)C2)c([N+](=O)[O-])c1	ZINC000450807228	GE	On-Demand	Bother	CCKBR	53	33
CC(C)NC(=O)c1ccc(N2CCC[C@@]3(CCS(=O)(=O)C3)C2)c([N+](=O)[O-])c1	ZINC000450807228	GE	On-Demand	Bother	TAAR1	32	47
CC(C)NC(=O)c1ccc(N2CCC[C@]3(CCS(=O)(=O)C3)C2)c([N+](=O)[O-])c1	ZINC000450807229	GE	On-Demand	Bother	CCKBR	53	33
CC(C)NC(=O)c1ccc(N2CCC[C@]3(CCS(=O)(=O)C3)C2)c([N+](=O)[O-])c1	ZINC000450807229	GE	On-Demand	Bother	TAAR1	32	47
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450807238	GG	On-Demand	Anodyne	PTGS2	22	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450807238	GG	On-Demand	Anodyne	SIGMAR1	21	44
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450807238	GG	On-Demand	Anodyne	SLC6A9	23	47
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450807239	GG	On-Demand	Anodyne	PTGS2	22	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450807239	GG	On-Demand	Anodyne	SIGMAR1	21	44
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450807239	GG	On-Demand	Anodyne	SLC6A9	23	47
CC(=O)c1cccc(CSc2nnc(C(C)(C)C)o2)c1	ZINC000450807244	CH	On-Demand	Anodyne	GSK3B	16	52
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(Cl)c(C#N)n2)C1	ZINC000450807245	EH	On-Demand	Mild	SIGMAR1	15	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(Cl)c(C#N)n2)C1	ZINC000450807246	EH	On-Demand	Mild	SIGMAR1	15	40
Cc1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c(C(C)C)n1	ZINC000450807265	GI	On-Demand	Anodyne	P2RX7	15	40
Cc1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c(C(C)C)n1	ZINC000450807265	GI	On-Demand	Anodyne	NR1H4	0	40
Cc1ccc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)c(C(C)C)n1	ZINC000450807265	GI	On-Demand	Anodyne	EPHX2	22	40
COCCNC(=O)c1ccc(NC[C@@H]2C[C@H]2C(C)C)nc1	ZINC000450807270	CE	On-Demand	Anodyne	IKBKB	0	45
Cc1ccc(CC(=O)NCc2ccncc2C)c(Br)c1	ZINC000450807283	EG	On-Demand	Anodyne	P2RX7	43	47
CCCN1CCN(C(=O)c2cn(CCc3ccccc3)nn2)C(C)(C)C1=O	ZINC000450807300	FD	On-Demand	Anodyne	THYX_PBCV1	0	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCN(CCO)[C@H](C)C3)cc2)c1	ZINC000450807351	GE	On-Demand	Anodyne	CHRM3	15	41
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCN(CCO)[C@@H](C)C3)cc2)c1	ZINC000450807352	GE	On-Demand	Anodyne	CHRM3	15	41
COC[C@H](C)n1ccc(NC(=O)c2cc(OC)ccc2OC(F)(F)F)n1	ZINC000450807384	FF	On-Demand	Anodyne	KCNK3	20	40
COC[C@H](C)n1ccc(NC(=O)c2cc(OC)ccc2OC(F)(F)F)n1	ZINC000450807384	FF	On-Demand	Anodyne	KCNK9	25	40
COC[C@@H](C)n1ccc(NC(=O)c2cc(OC)ccc2OC(F)(F)F)n1	ZINC000450807386	FF	On-Demand	Anodyne	KCNK3	20	40
COC[C@@H](C)n1ccc(NC(=O)c2cc(OC)ccc2OC(F)(F)F)n1	ZINC000450807386	FF	On-Demand	Anodyne	KCNK9	25	40
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	HTR1A	40	52
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	DRD2	32	46
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	DRD4	32	47
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	HTR2A	29	49
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	HTR2C	25	51
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	DRD3	25	40
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	HTR7	58	54
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	SIGMAR1	28	45
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	HTR3B	0	42
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	ABCB1	53	40
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	CYP2J2	67	48
C[C@@H](O)CN1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450807410	CD	On-Demand	Anodyne	NET	0	40
O=C(c1cccnc1N1CCCc2ccccc2CC1)N1CCCCC1	ZINC000450807418	EH	On-Demand	Anodyne	LIPA	46	34
O=C(c1cccnc1N1CCCc2ccccc2CC1)N1CCCCC1	ZINC000450807418	EH	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)[C@@H]1[C@H](O)CCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450807425	DD	On-Demand	Anodyne	SLC6A3	21	43
COC(=O)[C@@H]1[C@H](O)CCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450807426	DD	On-Demand	Anodyne	SLC6A3	21	43
COC(=O)[C@@H]1[C@H](O)CCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450807427	DD	On-Demand	Anodyne	SLC6A3	21	43
COC(=O)[C@@H]1[C@H](O)CCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450807428	DD	On-Demand	Anodyne	SLC6A3	21	43
COCCO[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807436	CF	On-Demand	Anodyne	DRD4	25	42
COCCO[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807436	CF	On-Demand	Anodyne	HRH1	0	40
COCCO[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807436	CF	On-Demand	Anodyne	DRD3	0	42
COCCO[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807436	CF	On-Demand	Anodyne	HTR4	44	33
COCCO[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807436	CF	On-Demand	Anodyne	CCR3	32	41
COCCO[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807436	CF	On-Demand	Anodyne	UTS2R	33	42
COCCO[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807437	CF	On-Demand	Anodyne	DRD4	25	42
COCCO[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807437	CF	On-Demand	Anodyne	HRH1	0	40
COCCO[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807437	CF	On-Demand	Anodyne	DRD3	0	42
COCCO[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807437	CF	On-Demand	Anodyne	HTR4	44	33
COCCO[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807437	CF	On-Demand	Anodyne	CCR3	32	41
COCCO[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450807437	CF	On-Demand	Anodyne	UTS2R	33	42
C[C@@H](O)CN1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450807446	CD	On-Demand	Anodyne	SIGMAR1	30	50
C[C@@H](O)CN1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450807446	CD	On-Demand	Anodyne	O19067_PIG	0	41
C[C@@H](O)CN1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450807446	CD	On-Demand	Anodyne	KCNJ1	33	46
COCCN(CCc1ccc(Cl)cc1)Cc1cccnc1	ZINC000450807453	DG	On-Demand	Anodyne	NR1D1	51	47
Cc1ccc(F)c(CN[C@H](C)c2nc3ccccc3n2C(F)F)c1	ZINC000450807489	EJ	On-Demand	Anodyne	ALOX5AP	27	40
Cc1ccc(F)c(CN[C@@H](C)c2nc3ccccc3n2C(F)F)c1	ZINC000450807490	EJ	On-Demand	Anodyne	ALOX5AP	27	40
COc1cc(CC(=O)N[C@@H]2CCC[C@H]2CCO)ccc1Cl	ZINC000450807498	DF	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)N[C@H]2CCC[C@H]2CCO)ccc1Cl	ZINC000450807499	DF	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)N[C@H]2CCC[C@@H]2CCO)ccc1Cl	ZINC000450807500	DF	On-Demand	Anodyne	CAN2	0	42
CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCc1cn(C)nc1C	ZINC000450807509	GF	On-Demand	Bother	CTRB1	26	41
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCC2CCOCC2)C1=O	ZINC000450807516	EE	On-Demand	Bother	CACNA1D	52	32
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCC2CCOCC2)C1=O	ZINC000450807517	EE	On-Demand	Bother	CACNA1D	52	32
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C[C@H]1CCCCC1(F)F)CC2	ZINC000450807525	GJ	On-Demand	Anodyne	TACR3	15	40
CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C[C@@H]1CCCCC1(F)F)CC2	ZINC000450807526	GJ	On-Demand	Anodyne	TACR3	15	40
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C[C@@H]1CCCCC1(F)F)CC2	ZINC000450807527	GJ	On-Demand	Anodyne	TACR3	15	40
CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C[C@H]1CCCCC1(F)F)CC2	ZINC000450807528	GJ	On-Demand	Anodyne	TACR3	15	40
COC(=O)[C@@H](NC(=O)c1cc2n(n1)CCCC2)c1ccc(Cl)cc1Cl	ZINC000450807538	GG	On-Demand	Anodyne	CNR1	54	33
COC(=O)[C@H](NC(=O)c1cc2n(n1)CCCC2)c1ccc(Cl)cc1Cl	ZINC000450807539	GG	On-Demand	Anodyne	CNR1	54	33
CC(C)OC(C)(C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450807546	ED	On-Demand	Anodyne	BIRC2	53	35
CC(C)OC(C)(C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450807547	ED	On-Demand	Anodyne	BIRC2	53	35
CC[C@@]1(CO)CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450807552	FH	On-Demand	Anodyne	RBP4	74	44
COc1cccc(OCCC(=O)NCCc2ccc(F)c(F)c2F)c1	ZINC000450807553	FG	On-Demand	Anodyne	MTNR1A	96	44
COc1cccc(OCCC(=O)NCCc2ccc(F)c(F)c2F)c1	ZINC000450807553	FG	On-Demand	Anodyne	MTNR1B	71	41
COCC[C@@H](Nc1ncc(Cl)cn1)c1cccc(C(F)(F)F)c1	ZINC000450807555	EI	On-Demand	Anodyne	PDS	42	34
COc1cc(CC(=O)N[C@@H]2CCC[C@@H]2CCO)ccc1Cl	ZINC000450807556	DF	On-Demand	Anodyne	CAN2	0	42
COCC[C@H](Nc1ncc(Cl)cn1)c1cccc(C(F)(F)F)c1	ZINC000450807559	EI	On-Demand	Anodyne	PDS	42	34
COCC[C@@H](N=c1ccc2ncc([N+](=O)[O-])n2[nH]1)c1cccc(C(F)(F)F)c1	ZINC000450807560	GG	On-Demand	Bother	GALR3	42	29
COCC[C@H](N=c1ccc2ncc([N+](=O)[O-])n2[nH]1)c1cccc(C(F)(F)F)c1	ZINC000450807561	GG	On-Demand	Bother	GALR3	42	29
C=CCOc1ccc(CC(=O)N2CCC(O)(C(F)F)CC2)cc1	ZINC000450807563	EE	On-Demand	Mild	GPR183	0	41
CCSc1cc(CNC(=O)Cc2ccc(Cl)c(OC)c2)ccn1	ZINC000450807569	FH	On-Demand	Anodyne	PDE5A	23	41
CCSc1cc(CNC(=O)Cc2ccc(Cl)c(OC)c2)ccn1	ZINC000450807569	FH	On-Demand	Anodyne	TRPV1	26	45
CCSc1cc(CNC(=O)Cc2ccc(Cl)c(OC)c2)ccn1	ZINC000450807569	FH	On-Demand	Anodyne	P2RX7	18	40
CCSc1cc(CNC(=O)Cc2ccc(Cl)c(OC)c2)ccn1	ZINC000450807569	FH	On-Demand	Anodyne	PDE6A	44	35
CCSc1cc(CNC(=O)Cc2ccc(Cl)c(OC)c2)ccn1	ZINC000450807569	FH	On-Demand	Anodyne	NCE103	20	41
CCSc1cc(CNC(=O)Cc2ccc(Cl)c(OC)c2)ccn1	ZINC000450807569	FH	On-Demand	Anodyne	CAN2	0	41
COC(=O)[C@@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(Cl)cc1Cl	ZINC000450807599	FF	On-Demand	Anodyne	CNR1	51	32
COC(=O)[C@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(Cl)cc1Cl	ZINC000450807601	FF	On-Demand	Anodyne	CNR1	51	32
CCOC(=O)c1ccc(CSc2ccccc2C)nc1	ZINC000450807609	CH	On-Demand	Anodyne	P2RY12	20	40
CCC(=O)C1(C(=O)Nc2ccc3c(c2)CCC(=O)N3CCOC)CC1	ZINC000450807626	EE	On-Demand	Anodyne	NAMPT	16	44
CN1CCc2ncnc(N3CCCc4ccccc4CC3)c2C1	ZINC000450807637	DE	On-Demand	Anodyne	DRD5	43	40
COC(=O)[C@@H]1[C@H](O)CCCN1CC/C=C/c1ccccc1	ZINC000450807639	CE	On-Demand	Anodyne	SLC6A1	58	32
COC(=O)[C@@H]1[C@H](O)CCCN1CC/C=C/c1ccccc1	ZINC000450807639	CE	On-Demand	Anodyne	ACKR3	52	35
COC(=O)[C@@H]1[C@@H](O)CCCN1CC/C=C/c1ccccc1	ZINC000450807641	CE	On-Demand	Anodyne	SLC6A1	58	32
COC(=O)[C@@H]1[C@@H](O)CCCN1CC/C=C/c1ccccc1	ZINC000450807641	CE	On-Demand	Anodyne	ACKR3	52	35
COC(=O)[C@@H]1[C@@H](O)CCCN1CC/C=C\c1ccccc1	ZINC000450807642	CE	On-Demand	Anodyne	SLC6A1	58	32
COC(=O)[C@@H]1[C@@H](O)CCCN1CC/C=C\c1ccccc1	ZINC000450807642	CE	On-Demand	Anodyne	ACKR3	52	35
COC(=O)[C@@H]1[C@H](O)CCCN1CC/C=C\c1ccccc1	ZINC000450807645	CE	On-Demand	Anodyne	SLC6A1	58	32
COC(=O)[C@@H]1[C@H](O)CCCN1CC/C=C\c1ccccc1	ZINC000450807645	CE	On-Demand	Anodyne	ACKR3	52	35
CCn1nnc(C)c1COc1ccc([N+](=O)[O-])cc1F	ZINC000450807648	CE	On-Demand	Bother	F2RL3	44	32
COc1cc2c(N3CC[C@@H]3C(C)C)ncnc2cc1F	ZINC000450807653	CG	On-Demand	Anodyne	PDE3A	57	44
COc1cc2c(N3CC[C@@H]3C(C)C)ncnc2cc1F	ZINC000450807653	CG	On-Demand	Anodyne	PDGFRB	58	42
COc1cc2c(N3CC[C@@H]3C(C)C)ncnc2cc1F	ZINC000450807653	CG	On-Demand	Anodyne	PDE3B	83	44
Cc1ccc(F)c(CCNc2ccnc3c2cnn3C)c1	ZINC000450807656	CG	On-Demand	Anodyne	HNMT	46	32
C[C@H]1CN(Cc2ccccc2)CCN(c2cncc(C(=O)N(C)C)n2)C1	ZINC000450807658	FE	On-Demand	Anodyne	MLNR	43	34
C[C@@H]1CN(Cc2ccccc2)CCN(c2cncc(C(=O)N(C)C)n2)C1	ZINC000450807660	FE	On-Demand	Anodyne	MLNR	43	34
Cc1cnccc1CNC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450807663	EH	On-Demand	Anodyne	PRCP	49	35
Cc1cnccc1CNC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450807663	EH	On-Demand	Anodyne	P2RX7	72	44
COc1cc2c(N3CC[C@H]3C(C)C)ncnc2cc1F	ZINC000450807666	CG	On-Demand	Anodyne	PDE3A	57	44
COc1cc2c(N3CC[C@H]3C(C)C)ncnc2cc1F	ZINC000450807666	CG	On-Demand	Anodyne	PDGFRB	58	42
COc1cc2c(N3CC[C@H]3C(C)C)ncnc2cc1F	ZINC000450807666	CG	On-Demand	Anodyne	PDE3B	83	44
C[C@@H](CO)N(CCN(C)Cc1ccccc1)C1CCCC1	ZINC000450807669	CF	On-Demand	Anodyne	SLC18A2	41	39
C[C@@H](CO)N(CCN(C)Cc1ccccc1)C1CCCC1	ZINC000450807669	CF	On-Demand	Anodyne	GALR1	44	32
C[C@@H](CO)N(CCN(C)Cc1ccccc1)C1CCCC1	ZINC000450807669	CF	On-Demand	Anodyne	AMY2	46	31
Cc1cnccc1CNC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450807670	EH	On-Demand	Anodyne	PRCP	49	35
Cc1cnccc1CNC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450807670	EH	On-Demand	Anodyne	P2RX7	72	44
C[C@H](CO)N(CCN(C)Cc1ccccc1)C1CCCC1	ZINC000450807671	CF	On-Demand	Anodyne	SLC18A2	41	39
C[C@H](CO)N(CCN(C)Cc1ccccc1)C1CCCC1	ZINC000450807671	CF	On-Demand	Anodyne	GALR1	44	32
C[C@H](CO)N(CCN(C)Cc1ccccc1)C1CCCC1	ZINC000450807671	CF	On-Demand	Anodyne	AMY2	46	31
Cc1cnccc1CNC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450807674	EH	On-Demand	Anodyne	PRCP	49	35
Cc1cnccc1CNC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450807674	EH	On-Demand	Anodyne	P2RX7	72	44
Cc1cnccc1CNC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450807679	EH	On-Demand	Anodyne	PRCP	49	35
Cc1cnccc1CNC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450807679	EH	On-Demand	Anodyne	P2RX7	72	44
CC1(C)CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)O1	ZINC000450807698	EH	On-Demand	Anodyne	RBP4	68	37
COC[C@@H](C)n1ccc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)n1	ZINC000450807701	EE	On-Demand	Anodyne	GCK	42	39
COC[C@H](C)n1ccc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)n1	ZINC000450807702	EE	On-Demand	Anodyne	GCK	42	39
COCCN1C(=O)CCc2cc(NC(=O)c3cn(CC4CC4)nn3)ccc21	ZINC000450807731	FD	On-Demand	Anodyne	NAMPT	0	42
Cc1ccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c2c1	ZINC000450807733	CF	On-Demand	Anodyne	PDE3A	51	38
Cc1ccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c2c1	ZINC000450807733	CF	On-Demand	Anodyne	PDE3B	75	38
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	HTR1A	23	60
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	DRD2	39	53
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	DRD1	33	59
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	DRD4	22	48
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	HTR2A	31	56
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	HTR2C	25	60
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	DRD3	0	55
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	DRD5	22	48
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	ERG2	24	53
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	HTR7	30	53
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	MC4R	58	42
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	SIGMAR1	22	58
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	SLC18A3	22	54
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	ABCB1	23	53
C[C@@H](O)CN1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450807734	DD	On-Demand	Anodyne	CYP2J2	58	41
Cc1ccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c2c1	ZINC000450807736	CF	On-Demand	Anodyne	PDE3A	51	38
Cc1ccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c2c1	ZINC000450807736	CF	On-Demand	Anodyne	PDE3B	75	38
COC(=O)c1ccc(N2CCCc3ccccc3CC2)nn1	ZINC000450807737	CE	On-Demand	Anodyne	SCD1	48	39
Cc1ccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c2c1	ZINC000450807740	CF	On-Demand	Anodyne	PDE3A	51	38
Cc1ccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c2c1	ZINC000450807740	CF	On-Demand	Anodyne	PDE3B	75	38
Cc1ccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c2c1	ZINC000450807743	CF	On-Demand	Anodyne	PDE3A	51	38
Cc1ccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c2c1	ZINC000450807743	CF	On-Demand	Anodyne	PDE3B	75	38
O=C1NCCN(C(=O)c2ccc(N3CCC3)nc2)[C@H]1Cc1ccccc1	ZINC000450807748	FD	On-Demand	Anodyne	HDAC1	0	42
O=C1NCCN(C(=O)c2ccc(N3CCC3)nc2)[C@H]1Cc1ccccc1	ZINC000450807748	FD	On-Demand	Anodyne	SMO	0	40
O=C1NCCN(C(=O)c2ccc(N3CCC3)nc2)[C@@H]1Cc1ccccc1	ZINC000450807752	FD	On-Demand	Anodyne	HDAC1	0	42
O=C1NCCN(C(=O)c2ccc(N3CCC3)nc2)[C@@H]1Cc1ccccc1	ZINC000450807752	FD	On-Demand	Anodyne	SMO	0	40
COc1cccc(OCCC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)c1	ZINC000450807770	FE	On-Demand	Anodyne	SIGMAR1	17	40
COc1cccc(OCCC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)c1	ZINC000450807770	FE	On-Demand	Anodyne	BRS3	26	40
C[C@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCN1CCO	ZINC000450807785	GE	On-Demand	Anodyne	HRH4	32	50
C[C@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCN1CCO	ZINC000450807785	GE	On-Demand	Anodyne	AKR1C3	0	42
C[C@@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCN1CCO	ZINC000450807786	GE	On-Demand	Anodyne	HRH4	32	50
C[C@@H]1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)CCN1CCO	ZINC000450807786	GE	On-Demand	Anodyne	AKR1C3	0	42
COc1cccc(OCCC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)c1	ZINC000450807788	FE	On-Demand	Anodyne	SIGMAR1	17	40
COc1cccc(OCCC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)c1	ZINC000450807788	FE	On-Demand	Anodyne	BRS3	26	40
COCc1nc(OC)cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450807789	FF	On-Demand	Anodyne	SIGMAR1	20	42
COCc1nc(OC)cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450807790	FF	On-Demand	Anodyne	SIGMAR1	20	42
COCCN1C(=O)CCc2cc(NC(=O)C(C)(C)C(C)(F)F)ccc21	ZINC000450807824	FG	On-Demand	Anodyne	NAMPT	0	45
CC(C)c1nccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)n1	ZINC000450807860	CF	On-Demand	Anodyne	SORD	69	41
CC(C)c1nccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)n1	ZINC000450807861	CF	On-Demand	Anodyne	SORD	69	41
CC(C)c1nccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)n1	ZINC000450807862	CF	On-Demand	Anodyne	SORD	69	41
CC(C)c1nccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)n1	ZINC000450807863	CF	On-Demand	Anodyne	SORD	69	41
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@H]1c1ncon1)CC(C)C	ZINC000450807880	FF	On-Demand	Anodyne	COLA	82	39
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@H]1c1ncon1)CC(C)C	ZINC000450807880	FF	On-Demand	Anodyne	CPT1A	57	39
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@@H]1c1ncon1)CC(C)C	ZINC000450807882	FF	On-Demand	Anodyne	COLA	82	39
CC(=O)NC[C@H](CC(=O)N1CCCCC[C@@H]1c1ncon1)CC(C)C	ZINC000450807882	FF	On-Demand	Anodyne	CPT1A	57	39
Cc1ccc(F)c(CCNc2ccc(S(C)(=O)=O)cc2F)c1	ZINC000450807887	EG	On-Demand	Anodyne	PTGS2	18	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807888	FG	On-Demand	Anodyne	HTR1A	15	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807888	FG	On-Demand	Anodyne	DRD2	17	56
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807888	FG	On-Demand	Anodyne	PTGS2	23	47
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807888	FG	On-Demand	Anodyne	SIGMAR1	33	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807888	FG	On-Demand	Anodyne	SLC18A3	17	44
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807889	FG	On-Demand	Anodyne	HTR1A	15	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807889	FG	On-Demand	Anodyne	DRD2	17	56
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807889	FG	On-Demand	Anodyne	PTGS2	23	47
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807889	FG	On-Demand	Anodyne	SIGMAR1	33	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450807889	FG	On-Demand	Anodyne	SLC18A3	17	44
CCC(CC)Oc1ccc(C(=O)N[C@@H]2CCC[C@H]2CCO)cc1	ZINC000450807942	DH	On-Demand	Anodyne	SSTR3	25	43
CCC(CC)Oc1ccc(C(=O)N[C@H]2CCC[C@@H]2CCO)cc1	ZINC000450807943	DH	On-Demand	Anodyne	SSTR3	26	43
CCC(CC)Oc1ccc(C(=O)N[C@H]2CCC[C@H]2CCO)cc1	ZINC000450807944	DH	On-Demand	Anodyne	SSTR3	25	43
CCC(CC)Oc1ccc(C(=O)N[C@@H]2CCC[C@@H]2CCO)cc1	ZINC000450807945	DH	On-Demand	Anodyne	SSTR3	26	43
CCOC(=O)c1ccc(CN2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)nc1	ZINC000450807946	FH	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1ccc(CN2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)nc1	ZINC000450807947	FH	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1ccc(CN2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)nc1	ZINC000450807948	FH	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1ccc(CN2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)nc1	ZINC000450807949	FH	On-Demand	Anodyne	P2RY12	21	40
CNS(=O)(=O)NCC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450808003	GC	On-Demand	Anodyne	HTR1D	41	37
CNS(=O)(=O)NCC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450808003	GC	On-Demand	Anodyne	HTR1B	30	41
CNS(=O)(=O)NCC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450808003	GC	On-Demand	Anodyne	NQO2	28	44
CNS(=O)(=O)NCC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450808003	GC	On-Demand	Anodyne	MPO	64	42
CNS(=O)(=O)NCC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450808003	GC	On-Demand	Anodyne	MTNR1A	17	50
CNS(=O)(=O)NCC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450808003	GC	On-Demand	Anodyne	ABCG2	24	40
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4Cl)cs3)CC[C@H]2C1	ZINC000450808004	EI	On-Demand	Anodyne	SPHK2	42	44
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4Cl)cs3)CC[C@H]2C1	ZINC000450808004	EI	On-Demand	Anodyne	SPHK1	26	44
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4Cl)cs3)CC[C@@H]2C1	ZINC000450808005	EI	On-Demand	Anodyne	SPHK2	42	44
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4Cl)cs3)CC[C@@H]2C1	ZINC000450808005	EI	On-Demand	Anodyne	SPHK1	26	44
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4Cl)cs3)CC[C@H]2C1	ZINC000450808006	EI	On-Demand	Anodyne	SPHK2	42	44
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4Cl)cs3)CC[C@H]2C1	ZINC000450808006	EI	On-Demand	Anodyne	SPHK1	26	44
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4Cl)cs3)CC[C@@H]2C1	ZINC000450808007	EI	On-Demand	Anodyne	SPHK2	42	44
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4Cl)cs3)CC[C@@H]2C1	ZINC000450808007	EI	On-Demand	Anodyne	SPHK1	26	44
CCc1nc(C)c(COc2cc(C(=O)OC)ccc2[N+](=O)[O-])o1	ZINC000450808009	DF	On-Demand	Bother	GSTM2	54	38
CC(C)[C@@H]1CCN1c1nc2c(F)cccc2o1	ZINC000450808038	BG	On-Demand	Anodyne	HTR3A	0	45
CC(C)[C@H]1CCN1c1nc2c(F)cccc2o1	ZINC000450808041	BG	On-Demand	Anodyne	HTR3A	0	45
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@@H]2CCC[C@H]21	ZINC000450808044	DI	On-Demand	Anodyne	PRCP	47	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@@H]2CCC[C@@H]21	ZINC000450808049	DI	On-Demand	Anodyne	PRCP	47	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@H]2CCC[C@@H]21	ZINC000450808051	DI	On-Demand	Anodyne	PRCP	47	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC[C@H]2CCC[C@H]21	ZINC000450808053	DI	On-Demand	Anodyne	PRCP	47	37
CC(=O)CCCCCOc1ccccc1I	ZINC000450808062	EH	On-Demand	Anodyne	THRA	0	41
CC(=O)CCCCCOc1ccccc1I	ZINC000450808062	EH	On-Demand	Anodyne	THRB	0	41
CC(=O)CCCCCOc1ccccc1I	ZINC000450808062	EH	On-Demand	Anodyne	ACR	23	40
CC(C)Cc1ncnc(N2CCC[C@@H]2C(N)=O)c1I	ZINC000450808067	FD	On-Demand	Anodyne	TRHR	64	36
N#Cc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc1C(F)(F)F	ZINC000450808079	DH	On-Demand	Mild	AR	25	47
N#Cc1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc1C(F)(F)F	ZINC000450808081	DH	On-Demand	Mild	AR	61	56
N#Cc1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc1C(F)(F)F	ZINC000450808082	DH	On-Demand	Mild	AR	25	47
N#Cc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc1C(F)(F)F	ZINC000450808083	DH	On-Demand	Mild	AR	61	56
C=C[C@@H]1OCCC[C@H]1Nc1cc(CC)nc2ncnn12	ZINC000450808086	CD	On-Demand	Mild	DHOD	0	44
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450808101	DF	On-Demand	Anodyne	NPY1R	0	42
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC(O)(C(F)F)CC1	ZINC000450808109	FF	On-Demand	Bother	SLC6A9	24	41
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC(O)(C(F)F)CC1	ZINC000450808109	FF	On-Demand	Bother	PPXII	0	42
O=C(c1ccnc(OC(F)F)c1)N1CCCCC[C@@H]1c1ncon1	ZINC000450808119	EF	On-Demand	Anodyne	COLA	77	36
O=C(c1ccnc(OC(F)F)c1)N1CCCCC[C@@H]1c1ncon1	ZINC000450808119	EF	On-Demand	Anodyne	CPT1A	57	36
O=C(c1ccnc(OC(F)F)c1)N1CCCCC[C@H]1c1ncon1	ZINC000450808121	EF	On-Demand	Anodyne	COLA	77	36
O=C(c1ccnc(OC(F)F)c1)N1CCCCC[C@H]1c1ncon1	ZINC000450808121	EF	On-Demand	Anodyne	CPT1A	57	36
COC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(Cl)cc1Cl	ZINC000450808124	GG	On-Demand	Anodyne	CNR1	50	31
COC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(Cl)cc1Cl	ZINC000450808130	GG	On-Demand	Anodyne	CNR1	50	31
COc1ccc(Nc2cc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ncn2)c(OC)c1	ZINC000450808145	GG	On-Demand	Anodyne	PDE3A	40	35
COc1ccc(Nc2cc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ncn2)c(OC)c1	ZINC000450808145	GG	On-Demand	Anodyne	PDE3B	56	35
COc1ccc(Nc2cc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ncn2)c(OC)c1	ZINC000450808147	GG	On-Demand	Anodyne	PDE3A	40	35
COc1ccc(Nc2cc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ncn2)c(OC)c1	ZINC000450808147	GG	On-Demand	Anodyne	PDE3B	56	35
CCOC(=O)c1cc(C(=O)NCCCCCc2ccc(F)cc2)on1	ZINC000450808149	EG	On-Demand	Anodyne	LEF	44	37
CNc1ccc(S(=O)(=O)N(C)CCC[C@H](C)O)cc1[N+](=O)[O-]	ZINC000450808157	ED	On-Demand	Bother	COLA	63	34
CNc1ccc(S(=O)(=O)N(C)CCC[C@H](C)O)cc1[N+](=O)[O-]	ZINC000450808157	ED	On-Demand	Bother	BCL2L1	63	32
CNc1ccc(S(=O)(=O)N(C)CCC[C@@H](C)O)cc1[N+](=O)[O-]	ZINC000450808158	ED	On-Demand	Bother	COLA	63	34
CNc1ccc(S(=O)(=O)N(C)CCC[C@@H](C)O)cc1[N+](=O)[O-]	ZINC000450808158	ED	On-Demand	Bother	BCL2L1	63	32
CNC(=O)c1ccc(OC[C@H]2CCC(F)(F)C2)cc1	ZINC000450808174	CF	On-Demand	Anodyne	KCNQ1	0	41
CNC(=O)c1ccc(OC[C@@H]2CCC(F)(F)C2)cc1	ZINC000450808175	CF	On-Demand	Anodyne	KCNQ1	0	41
CC(=O)c1ccc(S(=O)(=O)N(CCC[C@H](C)O)Cc2ccc(F)cc2)cc1	ZINC000450808180	GG	On-Demand	Anodyne	MMP8	19	43
CC(=O)c1ccc(S(=O)(=O)N(CCC[C@@H](C)O)Cc2ccc(F)cc2)cc1	ZINC000450808181	GG	On-Demand	Anodyne	MMP8	19	43
NC(=O)[C@H]1CCCN1c1ncnc2cccc(I)c12	ZINC000450808187	FD	On-Demand	Anodyne	SIRT3	40	30
NC(=O)[C@H]1CCCN1c1ncnc2cccc(I)c12	ZINC000450808187	FD	On-Demand	Anodyne	SIRT1	40	30
Cc1ccc(C(=O)NCCc2ccc(F)c(F)c2F)c(C(C)C)n1	ZINC000450808188	EH	On-Demand	Anodyne	P2RX7	15	46
O=C(C1CC1)N1CCCN(CC/C=C/c2ccccc2)CC1	ZINC000450808202	CG	On-Demand	Anodyne	NMUR2	0	44
O=C(C1CC1)N1CCCN(CC/C=C/c2ccccc2)CC1	ZINC000450808202	CG	On-Demand	Anodyne	NMUR1	0	44
O=C(C1CC1)N1CCCN(CC/C=C\c2ccccc2)CC1	ZINC000450808203	CG	On-Demand	Anodyne	NMUR2	0	44
O=C(C1CC1)N1CCCN(CC/C=C\c2ccccc2)CC1	ZINC000450808203	CG	On-Demand	Anodyne	NMUR1	0	44
C[C@@H](O)CN1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450808208	ED	On-Demand	Anodyne	SIGMAR1	26	40
COCc1nc(NCCc2cc(C)ccc2F)cc(OC)n1	ZINC000450808226	DF	On-Demand	Anodyne	PTGDR	0	40
Cc1cnccc1CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450808233	DF	On-Demand	Anodyne	ANPEP	38	46
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1c[nH]c2nccc-2c1	ZINC000450808254	FG	On-Demand	Anodyne	MTOR	42	36
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1c[nH]c2nccc-2c1	ZINC000450808254	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCS(=O)(=O)c1ccc(CN2CCN(C[C@@H](C)O)CC2)cc1	ZINC000450808258	EC	On-Demand	Anodyne	RORC	43	32
COC[C@H](C)n1ccc(NC(=O)c2cccc(C#N)c2Br)n1	ZINC000450808267	FE	On-Demand	Mild	GCK	27	40
COC[C@@H](C)n1ccc(NC(=O)c2cccc(C#N)c2Br)n1	ZINC000450808276	FE	On-Demand	Mild	GCK	27	40
CC[C@]1(O)CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450808279	FE	On-Demand	Mild	HTR1B	15	40
CC[C@]1(O)CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450808279	FE	On-Demand	Mild	TRPV4	46	36
CC[C@@]1(O)CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450808281	FE	On-Demand	Mild	HTR1B	15	40
CC[C@@]1(O)CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450808281	FE	On-Demand	Mild	TRPV4	46	36
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450808294	EE	On-Demand	Anodyne	DRD2	29	44
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450808294	EE	On-Demand	Anodyne	DRD4	51	38
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450808294	EE	On-Demand	Anodyne	DRD3	32	40
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450808294	EE	On-Demand	Anodyne	CACNA1C	45	36
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450808294	EE	On-Demand	Anodyne	SIGMAR1	42	38
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450808295	EE	On-Demand	Anodyne	DRD2	29	44
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450808295	EE	On-Demand	Anodyne	DRD4	51	38
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450808295	EE	On-Demand	Anodyne	DRD3	32	40
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450808295	EE	On-Demand	Anodyne	CACNA1C	45	36
COC(=O)c1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450808295	EE	On-Demand	Anodyne	SIGMAR1	42	38
CCNC(=O)c1ccc(N2CCCc3ccccc3CC2)nc1	ZINC000450808296	DF	On-Demand	Anodyne	HDAC1	0	40
CCNC(=O)c1ccc(N2CCCc3ccccc3CC2)nc1	ZINC000450808296	DF	On-Demand	Anodyne	NOD2	41	35
C[C@H]1CN(Cc2ccccc2)CCN(c2cnccn2)C1	ZINC000450808304	CE	On-Demand	Anodyne	DRD2	0	45
C[C@H]1CN(Cc2ccccc2)CCN(c2cnccn2)C1	ZINC000450808304	CE	On-Demand	Anodyne	DRD4	24	41
C[C@H]1CN(Cc2ccccc2)CCN(c2cnccn2)C1	ZINC000450808304	CE	On-Demand	Anodyne	DRD3	0	45
C[C@H]1CN(Cc2ccccc2)CCN(c2cnccn2)C1	ZINC000450808304	CE	On-Demand	Anodyne	SIGMAR1	23	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnccn2)C1	ZINC000450808307	CE	On-Demand	Anodyne	DRD2	0	45
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnccn2)C1	ZINC000450808307	CE	On-Demand	Anodyne	DRD4	24	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnccn2)C1	ZINC000450808307	CE	On-Demand	Anodyne	DRD3	0	45
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnccn2)C1	ZINC000450808307	CE	On-Demand	Anodyne	SIGMAR1	23	41
C[C@H]1CN(Cc2ccccc2)CCN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450808310	GG	On-Demand	Anodyne	HTR1A	21	44
C[C@H]1CN(Cc2ccccc2)CCN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450808310	GG	On-Demand	Anodyne	DRD2	24	42
C[C@H]1CN(Cc2ccccc2)CCN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450808310	GG	On-Demand	Anodyne	DRD4	62	38
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450808311	GG	On-Demand	Anodyne	HTR1A	21	44
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450808311	GG	On-Demand	Anodyne	DRD2	24	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450808311	GG	On-Demand	Anodyne	DRD4	62	38
Cc1ccc([N+](=O)[O-])cc1OCc1cc(C(C)(C)C)on1	ZINC000450808347	CH	On-Demand	Bother	CYP19A1	15	42
COC(=O)[C@H]1[C@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808355	GC	On-Demand	Anodyne	MTNR1A	60	37
COC(=O)[C@H]1[C@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808355	GC	On-Demand	Anodyne	MTNR1B	50	37
COC(=O)[C@H]1[C@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808355	GC	On-Demand	Anodyne	ACKR3	65	33
COC(=O)[C@H]1[C@@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808356	GC	On-Demand	Anodyne	MTNR1A	60	37
COC(=O)[C@H]1[C@@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808356	GC	On-Demand	Anodyne	MTNR1B	50	37
COC(=O)[C@H]1[C@@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808356	GC	On-Demand	Anodyne	ACKR3	65	33
COC(=O)[C@@H]1[C@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808357	GC	On-Demand	Anodyne	MTNR1A	60	37
COC(=O)[C@@H]1[C@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808357	GC	On-Demand	Anodyne	MTNR1B	50	37
COC(=O)[C@@H]1[C@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808357	GC	On-Demand	Anodyne	ACKR3	65	33
COC(=O)[C@@H]1[C@@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808359	GC	On-Demand	Anodyne	MTNR1A	60	37
COC(=O)[C@@H]1[C@@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808359	GC	On-Demand	Anodyne	MTNR1B	50	37
COC(=O)[C@@H]1[C@@H](O)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450808359	GC	On-Demand	Anodyne	ACKR3	65	33
CC[C@@H](CC(C)C)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450808367	EH	On-Demand	Anodyne	NAMPT	24	46
CC[C@H](CC(C)C)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450808368	EH	On-Demand	Anodyne	NAMPT	24	46
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)ccc21	ZINC000450808372	FF	On-Demand	Anodyne	NAMPT	31	47
C[C@H]1CN(Cc2ccccc2)CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450808373	FF	On-Demand	Bother	DRD4	40	36
C[C@H]1CN(Cc2ccccc2)CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450808373	FF	On-Demand	Bother	SIGMAR1	22	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450808374	FF	On-Demand	Bother	DRD4	40	36
C[C@@H]1CN(Cc2ccccc2)CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450808374	FF	On-Demand	Bother	SIGMAR1	22	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450808375	FE	On-Demand	Anodyne	PIK3CA	17	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450808375	FE	On-Demand	Anodyne	SORD	57	37
C[C@H]1CN(Cc2ccccc2)CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450808376	FE	On-Demand	Anodyne	PIK3CA	17	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450808376	FE	On-Demand	Anodyne	SORD	57	37
C[C@@H](c1ccc(CSc2nnc(C(C)(C)C)o2)cc1)C(F)(F)F	ZINC000450808382	EK	On-Demand	Anodyne	GSK3A	48	38
C[C@H](c1ccc(CSc2nnc(C(C)(C)C)o2)cc1)C(F)(F)F	ZINC000450808383	EK	On-Demand	Anodyne	GSK3A	48	38
Cc1cc(NC(=O)c2c(C)cccc2Cl)ccc1-n1nnnc1C(C)C	ZINC000450808387	FI	On-Demand	Anodyne	TYK2	45	35
Cc1ccc([N+](=O)[O-])cc1OCC1CC(F)(F)C1	ZINC000450808391	CG	On-Demand	Bother	CYP19A1	15	46
CC[C@]1(O)CCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450808399	CE	On-Demand	Anodyne	GHRHR	55	32
CC[C@@]1(O)CCN(C(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450808400	CE	On-Demand	Anodyne	GHRHR	55	32
COc1ccc(Nc2cc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ncn2)c(OC)c1	ZINC000450808409	GG	On-Demand	Anodyne	PDE3A	40	35
COc1ccc(Nc2cc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ncn2)c(OC)c1	ZINC000450808409	GG	On-Demand	Anodyne	PDE3B	56	35
COc1ccc(Nc2cc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ncn2)c(OC)c1	ZINC000450808411	GG	On-Demand	Anodyne	PDE3A	40	35
COc1ccc(Nc2cc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ncn2)c(OC)c1	ZINC000450808411	GG	On-Demand	Anodyne	PDE3B	56	35
COc1cc(CC(=O)N2CC[C@@H]3CCC[C@H]32)ccc1Cl	ZINC000450808414	CG	On-Demand	Anodyne	OPRM1	0	52
COc1cc(CC(=O)N2CC[C@@H]3CCC[C@H]32)ccc1Cl	ZINC000450808414	CG	On-Demand	Anodyne	OPRK1	22	51
COc1cc(CC(=O)N2CC[C@@H]3CCC[C@H]32)ccc1Cl	ZINC000450808414	CG	On-Demand	Anodyne	MTNR1B	26	41
COc1cc(CC(=O)N2CC[C@@H]3CCC[C@@H]32)ccc1Cl	ZINC000450808415	CG	On-Demand	Anodyne	OPRM1	0	52
COc1cc(CC(=O)N2CC[C@@H]3CCC[C@@H]32)ccc1Cl	ZINC000450808415	CG	On-Demand	Anodyne	OPRK1	22	51
COc1cc(CC(=O)N2CC[C@@H]3CCC[C@@H]32)ccc1Cl	ZINC000450808415	CG	On-Demand	Anodyne	MTNR1B	26	41
COc1cc(CC(=O)N2CC[C@H]3CCC[C@@H]32)ccc1Cl	ZINC000450808416	CG	On-Demand	Anodyne	OPRM1	0	52
COc1cc(CC(=O)N2CC[C@H]3CCC[C@@H]32)ccc1Cl	ZINC000450808416	CG	On-Demand	Anodyne	OPRK1	22	51
COc1cc(CC(=O)N2CC[C@H]3CCC[C@@H]32)ccc1Cl	ZINC000450808416	CG	On-Demand	Anodyne	MTNR1B	26	41
COc1cc(CC(=O)N2CC[C@H]3CCC[C@H]32)ccc1Cl	ZINC000450808417	CG	On-Demand	Anodyne	OPRM1	0	52
COc1cc(CC(=O)N2CC[C@H]3CCC[C@H]32)ccc1Cl	ZINC000450808417	CG	On-Demand	Anodyne	OPRK1	22	51
COc1cc(CC(=O)N2CC[C@H]3CCC[C@H]32)ccc1Cl	ZINC000450808417	CG	On-Demand	Anodyne	MTNR1B	26	41
COC[C@H](C)n1ccc(NC(=O)Cc2ccc(OC(F)F)c(F)c2)n1	ZINC000450808418	FE	On-Demand	Anodyne	GCK	19	42
COC[C@@H](C)n1ccc(NC(=O)Cc2ccc(OC(F)F)c(F)c2)n1	ZINC000450808420	FE	On-Demand	Anodyne	GCK	19	42
CC[C@H](CC(F)(F)F)C(=O)Nc1ccccc1-c1cn[nH]c1	ZINC000450808438	DH	On-Demand	Anodyne	ROCK2	42	38
Cc1cccc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ncnc12	ZINC000450808446	CF	On-Demand	Anodyne	PDE3B	59	32
Cc1cccc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ncnc12	ZINC000450808447	CF	On-Demand	Anodyne	PDE3B	59	32
Cc1cccc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ncnc12	ZINC000450808448	CF	On-Demand	Anodyne	PDE3B	59	32
Cc1cccc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ncnc12	ZINC000450808449	CF	On-Demand	Anodyne	PDE3B	59	32
COc1ccc(CNC(=O)CCSc2ccc(C)cn2)c(OC)c1	ZINC000450808476	EG	On-Demand	Anodyne	MTNR1A	51	39
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	HTR1A	91	49
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	DRD2	72	48
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	DRD1	26	42
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	DRD4	52	48
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	HTR2A	58	48
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	HTR2C	31	43
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	SLC6A4	15	42
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	HRH1	15	48
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	DRD3	55	48
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	P2RY12	20	50
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	PDGFRB	43	36
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	HTR7	92	47
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	SIGMAR1	15	48
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	ABCC1	45	33
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	SIRT3	60	38
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	SIRT2	43	38
Cc1cc2c(N3CCN(CCCC(=O)c4ccccc4)CC3)ncnc2s1	ZINC000450808479	GH	On-Demand	Anodyne	CYP2J2	55	40
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc(-c2cccnc2)n1	ZINC000450808497	DF	On-Demand	Anodyne	ROS1	32	43
COCC[C@H](Nc1ncnc2c1ncn2C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450808499	GI	On-Demand	Anodyne	ADORA1	26	40
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc(-c2cccnc2)n1	ZINC000450808500	DF	On-Demand	Anodyne	ROS1	32	43
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc(-c2cccnc2)n1	ZINC000450808501	DF	On-Demand	Anodyne	ROS1	32	43
COCC[C@@H](Nc1ncnc2c1ncn2C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450808502	GI	On-Demand	Anodyne	ADORA1	26	40
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc(-c2cccnc2)n1	ZINC000450808503	DF	On-Demand	Anodyne	ROS1	32	43
COCC[C@H](Nc1ncc(C(N)=O)cc1Cl)c1cccc(C(F)(F)F)c1	ZINC000450808504	GI	On-Demand	Anodyne	SCD1	23	40
COCC[C@H](Nc1ncc(C(N)=O)cc1Cl)c1cccc(C(F)(F)F)c1	ZINC000450808504	GI	On-Demand	Anodyne	ADCYAP1R1	42	35
COCC[C@@H](Nc1ncc(C(N)=O)cc1Cl)c1cccc(C(F)(F)F)c1	ZINC000450808506	GI	On-Demand	Anodyne	SCD1	23	40
COCC[C@@H](Nc1ncc(C(N)=O)cc1Cl)c1cccc(C(F)(F)F)c1	ZINC000450808506	GI	On-Demand	Anodyne	ADCYAP1R1	42	35
NC(=O)c1cccc(N2CCCc3ccccc3CC2)c1[N+](=O)[O-]	ZINC000450808521	EF	On-Demand	Bother	AVPR2	18	41
N#Cc1cccc(C(=O)N2CCCCC[C@@H]2c2ncon2)c1Br	ZINC000450808535	GG	On-Demand	Mild	COLA	74	44
N#Cc1cccc(C(=O)N2CCCCC[C@@H]2c2ncon2)c1Br	ZINC000450808535	GG	On-Demand	Mild	CPT1A	71	44
N#Cc1cccc(C(=O)N2CCCCC[C@H]2c2ncon2)c1Br	ZINC000450808539	GG	On-Demand	Mild	COLA	74	44
N#Cc1cccc(C(=O)N2CCCCC[C@H]2c2ncon2)c1Br	ZINC000450808539	GG	On-Demand	Mild	CPT1A	71	44
N#Cc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cn1	ZINC000450808542	CD	On-Demand	Mild	CHRNA4	25	40
N#Cc1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cn1	ZINC000450808543	CD	On-Demand	Mild	CHRNA4	25	40
N#Cc1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cn1	ZINC000450808546	CD	On-Demand	Mild	CHRNA4	25	40
N#Cc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cn1	ZINC000450808549	CD	On-Demand	Mild	CHRNA4	25	40
COc1cc(C(=O)NCCCCCc2ccc(F)cc2)c([N+](=O)[O-])cc1F	ZINC000450808556	GI	On-Demand	Bother	CNR2	30	41
COc1cc(C(=O)NCCCCCc2ccc(F)cc2)c([N+](=O)[O-])cc1F	ZINC000450808556	GI	On-Demand	Bother	LEF	45	36
O=C(c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450808563	GG	On-Demand	Anodyne	CXCR3	28	51
O=C(c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450808563	GG	On-Demand	Anodyne	L3MBTL3	49	35
O=C(c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450808565	GG	On-Demand	Anodyne	CXCR3	28	51
O=C(c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450808565	GG	On-Demand	Anodyne	L3MBTL3	49	35
O=C(c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450808568	GG	On-Demand	Anodyne	CXCR3	28	51
O=C(c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450808568	GG	On-Demand	Anodyne	L3MBTL3	49	35
O=C(c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450808571	GG	On-Demand	Anodyne	CXCR3	28	51
O=C(c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(Cl)c1)N1CCCCC1	ZINC000450808571	GG	On-Demand	Anodyne	L3MBTL3	49	35
Cc1cc2c(N3CCN(CC[C@@H](C)O)CC3)ncnc2s1	ZINC000450808572	DD	On-Demand	Anodyne	SIRT3	44	36
Cc1cc2c(N3CCN(CC[C@H](C)O)CC3)ncnc2s1	ZINC000450808575	DD	On-Demand	Anodyne	SIRT3	44	36
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCC[C@H]3CCO)cc2)c1	ZINC000450808581	GG	On-Demand	Anodyne	MMP13	0	47
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCC[C@H]3CCO)cc2)c1	ZINC000450808581	GG	On-Demand	Anodyne	PRKCD	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCC[C@H]3CCO)cc2)c1	ZINC000450808581	GG	On-Demand	Anodyne	SSTR3	31	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCC[C@@H]3CCO)cc2)c1	ZINC000450808583	GG	On-Demand	Anodyne	MMP13	0	47
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCC[C@@H]3CCO)cc2)c1	ZINC000450808583	GG	On-Demand	Anodyne	PRKCD	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCC[C@@H]3CCO)cc2)c1	ZINC000450808583	GG	On-Demand	Anodyne	SSTR3	31	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCC[C@H]3CCO)cc2)c1	ZINC000450808585	GG	On-Demand	Anodyne	MMP13	0	47
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCC[C@H]3CCO)cc2)c1	ZINC000450808585	GG	On-Demand	Anodyne	PRKCD	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@H]3CCC[C@H]3CCO)cc2)c1	ZINC000450808585	GG	On-Demand	Anodyne	SSTR3	31	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCC[C@@H]3CCO)cc2)c1	ZINC000450808587	GG	On-Demand	Anodyne	MMP13	0	47
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCC[C@@H]3CCO)cc2)c1	ZINC000450808587	GG	On-Demand	Anodyne	PRKCD	0	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N[C@@H]3CCC[C@@H]3CCO)cc2)c1	ZINC000450808587	GG	On-Demand	Anodyne	SSTR3	31	44
CC[C@@]1(O)CCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450808610	CE	On-Demand	Anodyne	GHRHR	55	32
CC[C@]1(O)CCN(C(=O)[C@H](C)OCCc2ccccc2)C1	ZINC000450808615	CE	On-Demand	Anodyne	GHRHR	55	32
COCCN(Cc1ccc([C@H](C)C(F)(F)F)cc1)Cc1cccnc1	ZINC000450808621	FI	On-Demand	Anodyne	NR1D1	46	39
COCCN(Cc1ccc([C@@H](C)C(F)(F)F)cc1)Cc1cccnc1	ZINC000450808624	FI	On-Demand	Anodyne	NR1D1	46	39
O=C(C1CC1)N1CCCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450808625	FF	On-Demand	Anodyne	PREP	36	40
CC[C@@]1(CO)CCCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)C1	ZINC000450808631	EE	On-Demand	Anodyne	RIR1_HHV11	43	34
CC[C@]1(CO)CCCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)C1	ZINC000450808633	EE	On-Demand	Anodyne	RIR1_HHV11	43	34
CNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450808677	CF	On-Demand	Anodyne	THRA	43	47
CNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450808677	CF	On-Demand	Anodyne	P2RY12	23	42
CNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450808677	CF	On-Demand	Anodyne	THRB	22	47
CNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450808677	CF	On-Demand	Anodyne	KCNQ1	0	48
CNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450808677	CF	On-Demand	Anodyne	CYSLTR2	46	33
CNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450808677	CF	On-Demand	Anodyne	SAT1	0	44
CNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450808677	CF	On-Demand	Anodyne	PLA2G4B	90	43
CNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450808677	CF	On-Demand	Anodyne	ACR	33	44
CN1CCC[C@@H](C(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)C1=O	ZINC000450808692	EG	On-Demand	Anodyne	BIRC3	42	35
CN1CCC[C@@H](C(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)C1=O	ZINC000450808692	EG	On-Demand	Anodyne	BIRC2	46	35
Cc1cncc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450808693	CF	On-Demand	Anodyne	DRD2	0	41
Cc1cncc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450808693	CF	On-Demand	Anodyne	SIGMAR1	25	40
Cc1cncc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450808694	CF	On-Demand	Anodyne	DRD2	0	41
Cc1cncc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450808694	CF	On-Demand	Anodyne	SIGMAR1	25	40
CNC(=O)c1cccnc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450808695	EE	On-Demand	Anodyne	CXCR3	30	43
CNC(=O)c1cccnc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450808697	EE	On-Demand	Anodyne	CXCR3	30	43
CN1CCC[C@@H](C(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)C1=O	ZINC000450808700	EG	On-Demand	Anodyne	BIRC3	42	35
CN1CCC[C@@H](C(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)C1=O	ZINC000450808700	EG	On-Demand	Anodyne	BIRC2	46	35
CN1CCC[C@H](C(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)C1=O	ZINC000450808702	EG	On-Demand	Anodyne	BIRC3	42	35
CN1CCC[C@H](C(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)C1=O	ZINC000450808702	EG	On-Demand	Anodyne	BIRC2	46	35
CN1CCC[C@H](C(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)C1=O	ZINC000450808704	EG	On-Demand	Anodyne	BIRC3	42	35
CN1CCC[C@H](C(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)C1=O	ZINC000450808704	EG	On-Demand	Anodyne	BIRC2	46	35
O=C(CCCC(=O)C1CC1)Nc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450808727	FH	On-Demand	Anodyne	GLS	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808728	FD	On-Demand	Anodyne	DRD4	41	38
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808728	FD	On-Demand	Anodyne	ACHE	16	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808728	FD	On-Demand	Anodyne	DRD3	41	39
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808728	FD	On-Demand	Anodyne	SCD1	65	51
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808728	FD	On-Demand	Anodyne	SCD	53	46
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808729	FD	On-Demand	Anodyne	DRD4	41	38
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808729	FD	On-Demand	Anodyne	ACHE	16	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808729	FD	On-Demand	Anodyne	DRD3	41	39
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808729	FD	On-Demand	Anodyne	SCD1	65	51
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450808729	FD	On-Demand	Anodyne	SCD	53	46
COCCN1C(=O)CCc2cc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)ccc21	ZINC000450808737	GE	On-Demand	Anodyne	NAMPT	0	42
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	ADORA1	125	70
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	SLC29A1	108	54
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	P2RY12	52	42
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	ADORA2A	59	63
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	ADORA2B	27	57
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	GAPC	0	42
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	ADK	68	54
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	AK3	0	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	AHCY	51	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	P2RX4	34	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	P2RX1	45	39
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	P2RY1	36	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	P2RY11	0	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	IARS	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	ITPR1	52	38
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	AK2	0	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	NS5B	0	45
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	ADORA3	114	62
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	OXGR1	113	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	MTAP	0	43
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	QARS	0	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	IMPDH2	44	35
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	AT1	0	40
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	AK	0	48
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	SETD7	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	PRMT1	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	RNASE1	46	35
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	MBTA	0	47
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	DNMT3B	81	44
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	NADK	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	PANC	38	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	Q4VQ11_PIG	86	62
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	GPR17	57	43
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	SAE1	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	DOT1L	82	46
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	METJ	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	NAE1	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	UBA6	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	UBA7	0	41
CC(C)[C@@H]1C[C@H]1CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000450808745	FC	On-Demand	Anodyne	SETD2	0	41
CNS(=O)(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450808772	FD	On-Demand	Anodyne	SMO	24	41
CNS(=O)(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450808773	FD	On-Demand	Anodyne	SMO	24	41
COCCN1C(=O)CCc2cc(NC(=O)CC3(O)CCC3)ccc21	ZINC000450808780	ED	On-Demand	Anodyne	NAMPT	24	45
CC[C@]1(O)CCN(C(=O)Cc2ccc(O)c(OC)c2)C1	ZINC000450808784	CD	On-Demand	Anodyne	TRPV1	19	44
CC[C@@]1(O)CCN(C(=O)Cc2ccc(O)c(OC)c2)C1	ZINC000450808785	CD	On-Demand	Anodyne	TRPV1	19	44
CC(C)c1ncsc1C(=O)Nc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450808792	GJ	On-Demand	Anodyne	MAP1	41	37
CC(C)c1ncsc1C(=O)Nc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450808792	GJ	On-Demand	Anodyne	U38	0	54
CC[C@]1(O)CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C1	ZINC000450808794	DD	On-Demand	Anodyne	ESRRA	17	40
CC[C@@]1(O)CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C1	ZINC000450808795	DD	On-Demand	Anodyne	ESRRA	17	40
CCc1cc(CCCSc2nnc(-c3ccc4ccccc4c3)o2)on1	ZINC000450808796	FK	On-Demand	Anodyne	GSK3A	44	37
CC[C@]1(O)CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450808797	CE	On-Demand	Anodyne	TACR1	0	43
CC[C@]1(O)CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450808797	CE	On-Demand	Anodyne	CCR1	27	40
CC[C@@]1(O)CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450808798	CE	On-Demand	Anodyne	TACR1	0	43
CC[C@@]1(O)CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450808798	CE	On-Demand	Anodyne	CCR1	27	40
O=[N+]([O-])c1ncn(CCCCc2ccc(Cl)c(Cl)c2)n1	ZINC000450808804	DH	On-Demand	Bother	DNAE	40	30
O=C(N[C@H]1CCC[C@H]1CCO)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450808834	FF	On-Demand	Anodyne	TRPC6	58	36
O=C(N[C@H]1CCC[C@H]1CCO)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450808834	FF	On-Demand	Anodyne	TRPC3	50	36
O=C(N[C@@H]1CCC[C@H]1CCO)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450808835	FF	On-Demand	Anodyne	TRPC6	58	36
O=C(N[C@@H]1CCC[C@H]1CCO)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450808835	FF	On-Demand	Anodyne	TRPC3	50	36
O=C(N[C@@H]1CCC[C@@H]1CCO)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450808836	FF	On-Demand	Anodyne	TRPC6	58	36
O=C(N[C@@H]1CCC[C@@H]1CCO)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450808836	FF	On-Demand	Anodyne	TRPC3	50	36
O=C(N[C@H]1CCC[C@@H]1CCO)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450808837	FF	On-Demand	Anodyne	TRPC6	58	36
O=C(N[C@H]1CCC[C@@H]1CCO)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450808837	FF	On-Demand	Anodyne	TRPC3	50	36
C[C@H](c1ccccc1)[C@H](O)CN1CCCN(C(=O)C2CC2)CC1	ZINC000450808844	DE	On-Demand	Anodyne	NMUR2	0	52
C[C@H](c1ccccc1)[C@H](O)CN1CCCN(C(=O)C2CC2)CC1	ZINC000450808844	DE	On-Demand	Anodyne	NMUR1	0	52
C[C@@H](c1ccccc1)[C@H](O)CN1CCCN(C(=O)C2CC2)CC1	ZINC000450808845	DE	On-Demand	Anodyne	NMUR2	0	52
C[C@@H](c1ccccc1)[C@H](O)CN1CCCN(C(=O)C2CC2)CC1	ZINC000450808845	DE	On-Demand	Anodyne	NMUR1	0	52
C[C@H](c1ccccc1)[C@@H](O)CN1CCCN(C(=O)C2CC2)CC1	ZINC000450808846	DE	On-Demand	Anodyne	NMUR2	0	52
C[C@H](c1ccccc1)[C@@H](O)CN1CCCN(C(=O)C2CC2)CC1	ZINC000450808846	DE	On-Demand	Anodyne	NMUR1	0	52
C[C@@H](c1ccccc1)[C@@H](O)CN1CCCN(C(=O)C2CC2)CC1	ZINC000450808847	DE	On-Demand	Anodyne	NMUR2	0	52
C[C@@H](c1ccccc1)[C@@H](O)CN1CCCN(C(=O)C2CC2)CC1	ZINC000450808847	DE	On-Demand	Anodyne	NMUR1	0	52
COCCN(Cc1cccnc1)Cc1cccc(C)n1	ZINC000450808869	CE	On-Demand	Anodyne	NR1D1	46	41
COC(=O)CCSc1ncccc1NC(=O)Cc1cn(C)nc1C	ZINC000450808889	ED	On-Demand	Anodyne	FAS	44	36
Cc1nc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c2cc[nH]c2n1	ZINC000450808903	CE	On-Demand	Anodyne	JAK1	30	41
c1ccc2c(c1)CCCN(c1ncnc3[nH]ccc13)CC2	ZINC000450808904	CF	On-Demand	Anodyne	AKT2	55	52
c1ccc2c(c1)CCCN(c1ncnc3[nH]ccc13)CC2	ZINC000450808904	CF	On-Demand	Anodyne	AKT3	31	47
c1ccc2c(c1)CCCN(c1ncnc3[nH]ccc13)CC2	ZINC000450808904	CF	On-Demand	Anodyne	ROCK2	46	47
c1ccc2c(c1)CCCN(c1ncnc3[nH]ccc13)CC2	ZINC000450808904	CF	On-Demand	Anodyne	AKT1	24	45
Cc1nc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c2cc[nH]c2n1	ZINC000450808906	CE	On-Demand	Anodyne	JAK1	30	41
Cc1nc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c2cc[nH]c2n1	ZINC000450808907	CE	On-Demand	Anodyne	JAK1	30	41
Cc1nc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c2cc[nH]c2n1	ZINC000450808908	CE	On-Demand	Anodyne	JAK1	30	41
CC[C@H](O)CC(=O)NCCn1c2ccccc2c2ccccc21	ZINC000450808979	DG	On-Demand	Anodyne	CNR1	23	41
CC[C@@H](O)CC(=O)NCCn1c2ccccc2c2ccccc21	ZINC000450808982	DG	On-Demand	Anodyne	CNR1	23	41
C=C[C@@H]1OCCC[C@H]1Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450808986	CH	On-Demand	Mild	AR	33	42
CSc1cccc(C(=O)N2CCN(CCO)[C@H](C)C2)c1	ZINC000450808989	CD	On-Demand	Anodyne	RHOA	0	41
CSc1cccc(C(=O)N2CCN(CCO)[C@@H](C)C2)c1	ZINC000450808990	CD	On-Demand	Anodyne	RHOA	0	41
CN(C)c1nccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)n1	ZINC000450808996	CD	On-Demand	Anodyne	SORD	40	33
CN(C)c1nccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)n1	ZINC000450808999	CD	On-Demand	Anodyne	SORD	40	33
CN(C)c1nccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)n1	ZINC000450809001	CD	On-Demand	Anodyne	SORD	40	33
CN(C)c1nccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)n1	ZINC000450809002	CD	On-Demand	Anodyne	SORD	40	33
COC(=O)CNC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450809026	GD	On-Demand	Bother	TAAR1	21	47
COC(=O)CNC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450809027	GD	On-Demand	Bother	TAAR1	21	47
COC(=O)CNC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450809028	GD	On-Demand	Bother	TAAR1	21	47
COC(=O)CNC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450809029	GD	On-Demand	Bother	TAAR1	21	47
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CCC(O)(C(F)F)CC1	ZINC000450809035	GG	On-Demand	Anodyne	PDE6D	91	39
O=C(Cn1c(-c2ccccc2)nc2ccccc21)N1CCC(O)(C(F)F)CC1	ZINC000450809035	GG	On-Demand	Anodyne	IMDH_CRYPV	31	47
CC(C)OC(=O)c1ccc(OCC(=O)CC[C@@H]2CCCCO2)cc1	ZINC000450809040	EH	On-Demand	Anodyne	PLA2G4B	72	34
CC(C)OC(=O)c1ccc(OCC(=O)CC[C@H]2CCCCO2)cc1	ZINC000450809041	EH	On-Demand	Anodyne	PLA2G4B	72	34
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450809047	GF	On-Demand	Anodyne	CCR1	26	40
C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N1CCC(O)(C(F)F)CC1	ZINC000450809047	GF	On-Demand	Anodyne	CCKBR	41	34
COCC[C@H](Nc1ccc(C(N)=O)cn1)c1cccc(C(F)(F)F)c1	ZINC000450809054	FG	On-Demand	Anodyne	SCD1	28	44
COCC[C@@H](Nc1ccc(C(N)=O)cn1)c1cccc(C(F)(F)F)c1	ZINC000450809055	FG	On-Demand	Anodyne	SCD1	28	44
Cc1nc2cncc(N3CCN(CCc4ccc(Cl)cc4)CC3)n2n1	ZINC000450809056	FE	On-Demand	Anodyne	ABCC1	61	35
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	ACE	55	41
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	FKBP1A	44	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	SLC18A2	54	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	PREP	53	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	AMY2	46	33
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	DPP7	15	43
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	XIAP	38	47
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	BIRC2	49	34
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@H]21	ZINC000450809083	CG	On-Demand	Anodyne	BRCA1	52	32
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	ACE	55	41
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	FKBP1A	44	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	SLC18A2	54	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	PREP	53	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	AMY2	46	33
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	DPP7	15	43
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	XIAP	38	47
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	BIRC2	49	34
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@@H]21	ZINC000450809084	CG	On-Demand	Anodyne	BRCA1	52	32
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	ACE	55	41
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	FKBP1A	44	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	SLC18A2	54	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	PREP	53	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	AMY2	46	33
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	DPP7	15	43
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	XIAP	38	47
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	BIRC2	49	34
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H]2CCC[C@H]21	ZINC000450809085	CG	On-Demand	Anodyne	BRCA1	52	32
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	ACE	55	41
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	FKBP1A	44	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	SLC18A2	54	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	PREP	53	38
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	AMY2	46	33
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	DPP7	15	43
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	XIAP	38	47
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	BIRC2	49	34
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809086	CG	On-Demand	Anodyne	BRCA1	52	32
O=C(CC[C@@H]1CCCCO1)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450809100	GJ	On-Demand	Anodyne	GSK3A	43	36
O=C(CC[C@@H]1CCCCO1)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450809100	GJ	On-Demand	Anodyne	ALOX15	48	45
O=C(CC[C@H]1CCCCO1)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450809103	GJ	On-Demand	Anodyne	GSK3A	43	36
O=C(CC[C@H]1CCCCO1)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450809103	GJ	On-Demand	Anodyne	ALOX15	48	45
CC1(C)CC[C@H](CNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)O1	ZINC000450809117	DH	On-Demand	Anodyne	SCN9A	0	42
CC1(C)CC[C@H](CNC(=O)[C@H]2CCC[C@H]2c2ccccc2)O1	ZINC000450809118	DH	On-Demand	Anodyne	SCN9A	0	42
CC1(C)CC[C@H](CNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)O1	ZINC000450809119	DH	On-Demand	Anodyne	SCN9A	0	42
CC1(C)CC[C@H](CNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)O1	ZINC000450809120	DH	On-Demand	Anodyne	SCN9A	0	42
C[C@H]1CN(Cc2ccccc2)CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450809142	GG	On-Demand	Bother	F2RL3	44	32
C[C@H]1CN(Cc2ccccc2)CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450809142	GG	On-Demand	Bother	MGLL	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450809142	GG	On-Demand	Bother	ABHD6	0	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450809143	GG	On-Demand	Bother	F2RL3	44	32
C[C@@H]1CN(Cc2ccccc2)CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450809143	GG	On-Demand	Bother	MGLL	0	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450809143	GG	On-Demand	Bother	ABHD6	0	40
Cc1cnccc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450809148	CF	On-Demand	Anodyne	EPHX2	27	42
Cc1cnccc1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450809148	CF	On-Demand	Anodyne	GPBAR1	0	40
Cc1cnccc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450809149	CF	On-Demand	Anodyne	EPHX2	27	42
Cc1cnccc1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450809149	CF	On-Demand	Anodyne	GPBAR1	0	40
Cc1cccc2c1O[C@H](C(=O)Nc1cc3c(cc1F)NC(=O)CC3)C2	ZINC000450809155	EF	On-Demand	Anodyne	PKM	41	42
Cc1cccc2c1O[C@@H](C(=O)Nc1cc3c(cc1F)NC(=O)CC3)C2	ZINC000450809156	EF	On-Demand	Anodyne	PKM	41	42
Cc1nsc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450809160	DF	On-Demand	Anodyne	SIGMAR1	20	40
Cc1nsc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450809161	DF	On-Demand	Anodyne	SIGMAR1	20	40
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2C[C@H]2C(C)C)n1	ZINC000450809167	CE	On-Demand	Bother	PRKCQ	43	35
COC(=O)c1cccc(CSc2nnc(C(C)(C)C)o2)c1Cl	ZINC000450809181	EI	On-Demand	Anodyne	ALOX15	62	36
Cc1ccc(F)c(CN2C(=O)N[C@@](C)(c3ccc(S(C)(=O)=O)cc3)C2=O)c1	ZINC000450809187	GF	On-Demand	Anodyne	PTGS2	30	40
Cc1ccc(F)c(CN2C(=O)N[C@](C)(c3ccc(S(C)(=O)=O)cc3)C2=O)c1	ZINC000450809188	GF	On-Demand	Anodyne	PTGS2	30	40
CCc1nc(C)c(COc2ccc([N+](=O)[O-])cc2F)o1	ZINC000450809193	CG	On-Demand	Bother	S1PR4	0	52
COc1cc(OC)c2ncnc(N3CCC[C@@]4(CCS(=O)(=O)C4)C3)c2c1	ZINC000450809197	GE	On-Demand	Anodyne	PDE3A	44	35
COc1cc(OC)c2ncnc(N3CCC[C@@]4(CCS(=O)(=O)C4)C3)c2c1	ZINC000450809197	GE	On-Demand	Anodyne	PDE3B	65	35
COc1cc(OC)c2ncnc(N3CCC[C@]4(CCS(=O)(=O)C4)C3)c2c1	ZINC000450809198	GE	On-Demand	Anodyne	PDE3A	44	35
COc1cc(OC)c2ncnc(N3CCC[C@]4(CCS(=O)(=O)C4)C3)c2c1	ZINC000450809198	GE	On-Demand	Anodyne	PDE3B	65	35
C[C@]1(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)CC=CCC1	ZINC000450809200	EH	On-Demand	Anodyne	EPHX2	29	40
O=C(c1cnc(N2CCCc3ccccc3CC2)c(Cl)c1)N1CCOCC1	ZINC000450809201	GG	On-Demand	Anodyne	P2RY12	30	40
O=C(c1cnc(N2CCCc3ccccc3CC2)c(Cl)c1)N1CCOCC1	ZINC000450809201	GG	On-Demand	Anodyne	AKR1C3	32	44
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(C)C)C2)cc1	ZINC000450809233	DG	On-Demand	Anodyne	HRH3	19	44
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(C)C)C2)cc1	ZINC000450809234	DG	On-Demand	Anodyne	HRH3	19	44
Cc1cc(C2CCN(C(=O)c3cc(C#N)[nH]c3C)CC2)ccc1Br	ZINC000450809236	GI	On-Demand	Mild	FASN	48	43
O=C1CN(CCc2ccccc2)C(=O)N1CC1=CCCCC1	ZINC000450809263	CF	On-Demand	Anodyne	CACNA1C	0	40
O=C1CN(CCc2ccccc2)C(=O)N1CC1=CCCCC1	ZINC000450809263	CF	On-Demand	Anodyne	CACNA1D	43	40
CCc1c(C(=O)NCC2CN(S(C)(=O)=O)C2)oc2ccccc12	ZINC000450809322	ED	On-Demand	Anodyne	HTR4	41	37
CC(C)CC(CC(C)C)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450809342	DI	On-Demand	Anodyne	COLA	73	38
CC(C)CC(CC(C)C)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450809342	DI	On-Demand	Anodyne	CPT1A	63	37
CC(C)CC(CC(C)C)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450809343	DI	On-Demand	Anodyne	COLA	73	38
CC(C)CC(CC(C)C)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450809343	DI	On-Demand	Anodyne	CPT1A	70	38
CN(C)S(=O)(=O)N[C@@H](CNc1ncnc2c1ncn2C1CC1)C1CCCC1	ZINC000450809346	GD	On-Demand	Anodyne	ADORA1	46	39
CN(C)S(=O)(=O)N[C@H](CNc1ncnc2c1ncn2C1CC1)C1CCCC1	ZINC000450809347	GD	On-Demand	Anodyne	ADORA1	46	39
CS(=O)(=O)N1CC(CNC(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450809348	GD	On-Demand	Anodyne	AVPR1B	50	48
CS(=O)(=O)N1CC(CNC(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450809348	GD	On-Demand	Anodyne	PDE6D	91	39
CS(=O)(=O)N1CC(CNC(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450809348	GD	On-Demand	Anodyne	IMDH_CRYPV	34	51
CS(=O)(=O)N1CC(CNC(=O)c2ccc(Oc3ccc(Cl)cc3)cn2)C1	ZINC000450809353	GE	On-Demand	Anodyne	CACNA1I	45	33
COc1ccc2c(N3CC[C@@H]3C(C)C)ncnc2c1F	ZINC000450809380	CG	On-Demand	Anodyne	PDE3A	43	33
COc1ccc2c(N3CC[C@@H]3C(C)C)ncnc2c1F	ZINC000450809380	CG	On-Demand	Anodyne	PDE3B	64	33
COc1ccc2c(N3CC[C@H]3C(C)C)ncnc2c1F	ZINC000450809381	CG	On-Demand	Anodyne	PDE3A	43	33
COc1ccc2c(N3CC[C@H]3C(C)C)ncnc2c1F	ZINC000450809381	CG	On-Demand	Anodyne	PDE3B	64	33
CCS(=O)(=O)C1CN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450809396	DD	On-Demand	Anodyne	SORD	54	39
O=C(NCCCCCc1ccc(F)cc1)c1ccsn1	ZINC000450809413	CG	On-Demand	Anodyne	Q76353_9HIV1	0	40
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H]3C(N)=O)c([N+](=O)[O-])c2)cc1	ZINC000450809426	FF	On-Demand	Bother	AVPR2	32	41
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H]3C(N)=O)c([N+](=O)[O-])c2)cc1	ZINC000450809426	FF	On-Demand	Bother	TAAR1	35	49
CCC(=O)C1(C(=O)NCCCCCc2ccc(F)cc2)CC1	ZINC000450809438	DG	On-Demand	Anodyne	LIPG	15	41
COC[C@]1(C(=O)NCCCCCc2ccc(F)cc2)CCOC1	ZINC000450809439	DF	On-Demand	Anodyne	LEF	41	38
COC[C@@]1(C(=O)NCCCCCc2ccc(F)cc2)CCOC1	ZINC000450809440	DF	On-Demand	Anodyne	LEF	41	38
CNc1ccc(S(=O)(=O)N(C)Cc2cc(C)ccc2F)cc1[N+](=O)[O-]	ZINC000450809446	FF	On-Demand	Bother	COLA	58	35
CNc1ccc(S(=O)(=O)N(C)CCC(C)(F)F)cc1[N+](=O)[O-]	ZINC000450809452	EE	On-Demand	Bother	BDKRB1	24	46
Cc1cc(N[C@@H]2CCc3c2ccc(F)c3Br)n2ncnc2n1	ZINC000450809453	FG	On-Demand	Anodyne	DHOD	0	51
Cc1cc(N[C@H]2CCc3c2ccc(F)c3Br)n2ncnc2n1	ZINC000450809454	FG	On-Demand	Anodyne	DHOD	0	51
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@H]2CCC[C@@H]21	ZINC000450809456	DG	On-Demand	Anodyne	PREP	42	34
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@H]2CCC[C@@H]21	ZINC000450809456	DG	On-Demand	Anodyne	BIRC2	17	42
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@@H]2CCC[C@H]21	ZINC000450809457	DG	On-Demand	Anodyne	PREP	42	34
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@@H]2CCC[C@H]21	ZINC000450809457	DG	On-Demand	Anodyne	BIRC2	17	42
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@H]2CCC[C@H]21	ZINC000450809458	DG	On-Demand	Anodyne	PREP	42	34
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@H]2CCC[C@H]21	ZINC000450809458	DG	On-Demand	Anodyne	BIRC2	17	42
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809459	DG	On-Demand	Anodyne	PREP	42	34
O=C(c1ccn(CCc2ccccc2)n1)N1CC[C@@H]2CCC[C@@H]21	ZINC000450809459	DG	On-Demand	Anodyne	BIRC2	17	42
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]4CCC[C@H]43)cc2)c1	ZINC000450809460	FH	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]4CCC[C@H]43)cc2)c1	ZINC000450809460	FH	On-Demand	Anodyne	MMP13	19	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]4CCC[C@@H]43)cc2)c1	ZINC000450809461	FH	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]4CCC[C@@H]43)cc2)c1	ZINC000450809461	FH	On-Demand	Anodyne	MMP13	19	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]4CCC[C@@H]43)cc2)c1	ZINC000450809462	FH	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H]4CCC[C@@H]43)cc2)c1	ZINC000450809462	FH	On-Demand	Anodyne	MMP13	19	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]4CCC[C@H]43)cc2)c1	ZINC000450809463	FH	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H]4CCC[C@H]43)cc2)c1	ZINC000450809463	FH	On-Demand	Anodyne	MMP13	19	44
O=C(c1cccc2c1CCCC2)N1CCC(O)(C(F)F)CC1	ZINC000450809487	DF	On-Demand	Anodyne	FABP4	41	33
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450809494	EF	On-Demand	Anodyne	MMP1	27	46
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450809494	EF	On-Demand	Anodyne	BIRC2	42	35
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450809495	EF	On-Demand	Anodyne	MMP1	27	46
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450809495	EF	On-Demand	Anodyne	BIRC2	42	35
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450809496	EF	On-Demand	Anodyne	MMP1	27	46
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450809496	EF	On-Demand	Anodyne	BIRC2	42	35
CC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450809497	EF	On-Demand	Anodyne	MMP1	27	46
CC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000450809497	EF	On-Demand	Anodyne	BIRC2	42	35
Cc1cncc(-c2nc(CN3CCN(C[C@@H](C)O)CC3)no2)c1	ZINC000450809502	DC	On-Demand	Anodyne	ACOX1	41	46
Cc1cc2c(N3CCN(CC4CC(F)(F)C4)CC3)ncnc2s1	ZINC000450809503	EG	On-Demand	Anodyne	SIRT3	40	31
C[C@@]1(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)CC=CCC1	ZINC000450809535	EH	On-Demand	Anodyne	EPHX2	29	40
C[C@H](C[S@@](C)=O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450809558	DF	On-Demand	Anodyne	TIMP3	47	34
C[C@H](C[S@@](C)=O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450809558	DF	On-Demand	Anodyne	LMGT2	0	42
C[C@H](C[S@](C)=O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450809560	DF	On-Demand	Anodyne	TIMP3	47	34
C[C@H](C[S@](C)=O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450809560	DF	On-Demand	Anodyne	LMGT2	0	42
C[C@@H](C[S@@](C)=O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450809561	DF	On-Demand	Anodyne	TIMP3	47	34
C[C@@H](C[S@@](C)=O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450809561	DF	On-Demand	Anodyne	LMGT2	0	42
C[C@@H](C[S@](C)=O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450809562	DF	On-Demand	Anodyne	TIMP3	47	34
C[C@@H](C[S@](C)=O)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450809562	DF	On-Demand	Anodyne	LMGT2	0	42
COc1ccc(CNC(=O)CCN2[C@@H](C)CC(O)C[C@@H]2C)c(OC)c1	ZINC000450809577	FD	On-Demand	Anodyne	MTNR1A	64	38
COc1ccc(CNC(=O)CCN2[C@@H](C)CC(O)C[C@@H]2C)c(OC)c1	ZINC000450809577	FD	On-Demand	Anodyne	MTNR1B	50	38
COc1ccc(CNC(=O)CCN2[C@@H](C)C[C@H](O)C[C@H]2C)c(OC)c1	ZINC000450809578	FD	On-Demand	Anodyne	MTNR1A	64	38
COc1ccc(CNC(=O)CCN2[C@@H](C)C[C@H](O)C[C@H]2C)c(OC)c1	ZINC000450809578	FD	On-Demand	Anodyne	MTNR1B	50	38
COc1ccc(CNC(=O)CCN2[C@H](C)CC(O)C[C@H]2C)c(OC)c1	ZINC000450809579	FD	On-Demand	Anodyne	MTNR1A	64	38
COc1ccc(CNC(=O)CCN2[C@H](C)CC(O)C[C@H]2C)c(OC)c1	ZINC000450809579	FD	On-Demand	Anodyne	MTNR1B	50	38
Cc1nc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c2cc[nH]c2n1	ZINC000450809582	EG	On-Demand	Anodyne	DRD4	16	41
Cc1nc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c2cc[nH]c2n1	ZINC000450809584	EG	On-Demand	Anodyne	DRD4	16	41
CC(C)C[C@@H](C)N1CCCN(C(=O)C2CC2)CC1	ZINC000450809605	CE	On-Demand	Anodyne	NMUR2	0	47
CC(C)C[C@@H](C)N1CCCN(C(=O)C2CC2)CC1	ZINC000450809605	CE	On-Demand	Anodyne	NMUR1	0	47
CC(C)C[C@H](C)N1CCCN(C(=O)C2CC2)CC1	ZINC000450809606	CE	On-Demand	Anodyne	NMUR2	0	47
CC(C)C[C@H](C)N1CCCN(C(=O)C2CC2)CC1	ZINC000450809606	CE	On-Demand	Anodyne	NMUR1	0	47
O=C(C1CC1)N1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450809624	EG	On-Demand	Anodyne	HRH3	25	41
O=C(C1CC1)N1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450809624	EG	On-Demand	Anodyne	NMUR2	0	44
O=C(C1CC1)N1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450809624	EG	On-Demand	Anodyne	NMUR1	0	44
COC[C@H](C)n1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)n1	ZINC000450809639	FE	On-Demand	Anodyne	GCK	26	43
COC[C@@H](C)n1ccc(NC(=O)c2ccn(CCc3ccccc3)n2)n1	ZINC000450809640	FE	On-Demand	Anodyne	GCK	26	43
Cc1ccc(F)c(CCNc2cc(C)nc3ncnn23)c1	ZINC000450809653	CF	On-Demand	Anodyne	DHOD	0	56
CC[C@]1(O)CCN(C(=O)c2ccc(C)c(Cl)c2Cl)C1	ZINC000450809654	DG	On-Demand	Anodyne	P2RX7	15	41
CC[C@@]1(O)CCN(C(=O)c2ccc(C)c(Cl)c2Cl)C1	ZINC000450809655	DG	On-Demand	Anodyne	P2RX7	15	41
COc1ccc(OC(F)(F)F)c(C(=O)NCc2ccncc2C)c1	ZINC000450809663	EG	On-Demand	Anodyne	GRIN2B	0	45
COc1ccc(OC(F)(F)F)c(C(=O)NCc2ccncc2C)c1	ZINC000450809663	EG	On-Demand	Anodyne	PPARD	38	43
COc1ccc(OC(F)(F)F)c(C(=O)NCc2ccncc2C)c1	ZINC000450809663	EG	On-Demand	Anodyne	SCN10A	37	44
CC(C)CC(CC(C)C)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	ZINC000450809685	EI	On-Demand	Anodyne	PKM	38	41
CC1=C(C(=O)Nc2cc3c(cc2F)NC(=O)CC3)CCC(C)(C)C1	ZINC000450809693	EI	On-Demand	Anodyne	PKM	38	41
CCS(=O)(=O)C1CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450809708	ED	On-Demand	Anodyne	GRM4	24	41
CCS(=O)(=O)C1CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450809708	ED	On-Demand	Anodyne	SCD1	43	48
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000450809768	DH	On-Demand	Anodyne	LIPC	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000450809768	DH	On-Demand	Anodyne	LIPG	43	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450809769	DH	On-Demand	Anodyne	LIPC	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450809769	DH	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450809769	DH	On-Demand	Anodyne	CCR2	54	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450809769	DH	On-Demand	Anodyne	LIPG	43	40
COC(=O)c1ccc([N+](=O)[O-])c(OCCCCCC(C)=O)c1	ZINC000450809770	DF	On-Demand	Bother	THRA	27	46
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)ccn1	ZINC000450809771	BE	On-Demand	Anodyne	HRH4	15	40
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)ccn1	ZINC000450809772	BE	On-Demand	Anodyne	HRH4	15	40
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)ccn1	ZINC000450809773	BE	On-Demand	Anodyne	HRH4	15	40
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)ccn1	ZINC000450809774	BE	On-Demand	Anodyne	HRH4	15	40
Cc1ccc(CC(=O)N2CCCCC[C@H]2c2ncon2)c(Br)c1	ZINC000450809796	GH	On-Demand	Anodyne	COLA	111	43
Cc1ccc(CC(=O)N2CCCCC[C@H]2c2ncon2)c(Br)c1	ZINC000450809796	GH	On-Demand	Anodyne	CPT1A	107	43
Cc1ccc(CC(=O)N2CCCCC[C@@H]2c2ncon2)c(Br)c1	ZINC000450809797	GH	On-Demand	Anodyne	COLA	111	43
Cc1ccc(CC(=O)N2CCCCC[C@@H]2c2ncon2)c(Br)c1	ZINC000450809797	GH	On-Demand	Anodyne	CPT1A	107	43
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc1C(F)(F)F	ZINC000450809804	EH	On-Demand	Bother	AADAC	0	41
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc1C(F)(F)F	ZINC000450809805	EH	On-Demand	Bother	AADAC	0	41
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc1C(F)(F)F	ZINC000450809806	EH	On-Demand	Bother	AADAC	0	41
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc1C(F)(F)F	ZINC000450809807	EH	On-Demand	Bother	AADAC	0	41
O=C(NCCCCCc1ccc(F)cc1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450809808	DH	On-Demand	Anodyne	SCNN1A	63	36
COc1cccc(OCCC(=O)N2C[C@@H](C)C[C@@H]2c2cccc(OC)c2)c1	ZINC000450809810	FI	On-Demand	Anodyne	MTNR1A	24	43
COc1cccc(OCCC(=O)N2C[C@@H](C)C[C@@H]2c2cccc(OC)c2)c1	ZINC000450809810	FI	On-Demand	Anodyne	MTNR1B	31	43
COc1cccc(OCCC(=O)N2C[C@H](C)C[C@H]2c2cccc(OC)c2)c1	ZINC000450809811	FI	On-Demand	Anodyne	MTNR1A	24	43
COc1cccc(OCCC(=O)N2C[C@H](C)C[C@H]2c2cccc(OC)c2)c1	ZINC000450809811	FI	On-Demand	Anodyne	MTNR1B	31	43
COc1cccc(OCCC(=O)N2C[C@H](C)C[C@@H]2c2cccc(OC)c2)c1	ZINC000450809812	FI	On-Demand	Anodyne	MTNR1A	24	43
COc1cccc(OCCC(=O)N2C[C@H](C)C[C@@H]2c2cccc(OC)c2)c1	ZINC000450809812	FI	On-Demand	Anodyne	MTNR1B	31	43
COc1cccc(OCCC(=O)N2C[C@@H](C)C[C@H]2c2cccc(OC)c2)c1	ZINC000450809813	FI	On-Demand	Anodyne	MTNR1A	24	43
COc1cccc(OCCC(=O)N2C[C@@H](C)C[C@H]2c2cccc(OC)c2)c1	ZINC000450809813	FI	On-Demand	Anodyne	MTNR1B	31	43
CCSc1cc(CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)ccn1	ZINC000450809835	FG	On-Demand	Anodyne	ANPEP	31	40
O[C@@H]1CC[C@@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC[C@@H]2C1	ZINC000450809857	GI	On-Demand	Anodyne	ADRB2	15	50
O[C@@H]1CC[C@@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC[C@@H]2C1	ZINC000450809857	GI	On-Demand	Anodyne	ADRB3	15	50
O[C@@H]1CC[C@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC[C@@H]2C1	ZINC000450809858	GI	On-Demand	Anodyne	ADRB2	15	50
O[C@@H]1CC[C@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC[C@@H]2C1	ZINC000450809858	GI	On-Demand	Anodyne	ADRB3	15	50
O[C@@H]1CC[C@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC[C@H]2C1	ZINC000450809859	GI	On-Demand	Anodyne	ADRB2	15	50
O[C@@H]1CC[C@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC[C@H]2C1	ZINC000450809859	GI	On-Demand	Anodyne	ADRB3	15	50
O[C@@H]1CC[C@@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC[C@H]2C1	ZINC000450809860	GI	On-Demand	Anodyne	ADRB2	15	50
O[C@@H]1CC[C@@H]2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC[C@H]2C1	ZINC000450809860	GI	On-Demand	Anodyne	ADRB3	15	50
O=C(NCC(=O)N1C[C@@H]2CC[C@H](O)[C@H]2C1)Nc1cccc(Cl)c1	ZINC000450809865	ED	On-Demand	Anodyne	EPHX2	20	54
O=C(NCC(=O)N1C[C@H]2[C@@H](O)CC[C@H]2C1)Nc1cccc(Cl)c1	ZINC000450809866	ED	On-Demand	Anodyne	EPHX2	20	54
O=C(NCC(=O)N1C[C@@H]2CC[C@@H](O)[C@H]2C1)Nc1cccc(Cl)c1	ZINC000450809867	ED	On-Demand	Anodyne	EPHX2	20	54
O=C(NCC(=O)N1C[C@H]2[C@H](O)CC[C@H]2C1)Nc1cccc(Cl)c1	ZINC000450809868	ED	On-Demand	Anodyne	EPHX2	20	54
CC[C@]1(CO)CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450809869	DH	On-Demand	Anodyne	UTS2R	49	35
CC[C@]1(CO)CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450809869	DH	On-Demand	Anodyne	EPHX2	16	42
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450809870	DH	On-Demand	Anodyne	UTS2R	49	35
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450809870	DH	On-Demand	Anodyne	EPHX2	16	42
CC[C@]1(CO)CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450809871	DH	On-Demand	Anodyne	UTS2R	49	35
CC[C@]1(CO)CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450809871	DH	On-Demand	Anodyne	EPHX2	16	42
CC[C@]1(CO)CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450809872	DH	On-Demand	Anodyne	UTS2R	49	35
Cc1ccc2ncn(CC3=CCCCC3)c(=O)c2c1	ZINC000450809886	CG	On-Demand	Anodyne	SCD1	0	42
CNC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450809887	BE	On-Demand	Anodyne	PLA2G4B	53	38
O=C1CN(c2ccccc2)C(=O)N1CC1=CCCCC1	ZINC000450809911	CF	On-Demand	Anodyne	CMA1	24	43
COC[C@@H](C)n1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)n1	ZINC000450809923	FE	On-Demand	Anodyne	RARA	15	46
COC[C@@H](C)n1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)n1	ZINC000450809923	FE	On-Demand	Anodyne	GCK	49	48
COC[C@H](C)n1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)n1	ZINC000450809924	FE	On-Demand	Anodyne	RARA	15	46
COC[C@H](C)n1ccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)n1	ZINC000450809924	FE	On-Demand	Anodyne	GCK	49	48
O=C(CCCN1C[C@@H](F)C[C@H]1CO)c1ccc(Br)cc1	ZINC000450809932	EF	On-Demand	Anodyne	CYP2J2	43	31
O=C(CCCN1C[C@H](F)C[C@H]1CO)c1ccc(Br)cc1	ZINC000450809933	EF	On-Demand	Anodyne	CYP2J2	43	31
O=C(CCCN1C[C@@H](F)C[C@@H]1CO)c1ccc(Br)cc1	ZINC000450809934	EF	On-Demand	Anodyne	CYP2J2	43	31
O=C(CCCN1C[C@H](F)C[C@@H]1CO)c1ccc(Br)cc1	ZINC000450809935	EF	On-Demand	Anodyne	CYP2J2	43	31
COCCN(Cc1cccnc1)Cc1nnc(C2CC2)s1	ZINC000450809938	DE	On-Demand	Anodyne	NR1D1	45	39
COc1cc(N2CCCc3ccccc3CC2)ncn1	ZINC000450809941	CE	On-Demand	Anodyne	DRD5	41	44
COC[C@@H](C)n1ccc(NC(=O)c2cccc(C(F)(F)F)n2)n1	ZINC000450809942	EE	On-Demand	Anodyne	CARM1	46	32
COC[C@H](C)n1ccc(NC(=O)c2cccc(C(F)(F)F)n2)n1	ZINC000450809943	EE	On-Demand	Anodyne	CARM1	46	32
C[C@H](c1ccccc1)[C@H](O)CN[C@H]1CCCC1(C)C	ZINC000450809946	CG	On-Demand	Anodyne	UGT2B7	64	48
C[C@H](c1ccccc1)[C@H](O)CN[C@@H]1CCCC1(C)C	ZINC000450809947	CG	On-Demand	Anodyne	UGT2B7	64	48
C[C@H](c1ccccc1)[C@@H](O)CN[C@H]1CCCC1(C)C	ZINC000450809948	CG	On-Demand	Anodyne	UGT2B7	64	48
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(C)C	ZINC000450809949	CG	On-Demand	Anodyne	UGT2B7	64	48
COCCN(CC/C=C/c1ccccc1)Cc1cccnc1	ZINC000450809979	CH	On-Demand	Anodyne	NR1D1	40	37
COCCN(CC/C=C\c1ccccc1)Cc1cccnc1	ZINC000450809980	CH	On-Demand	Anodyne	NR1D1	40	37
COc1cc(CN[C@H](C)c2nc3ccccc3n2C(F)F)ccc1Cl	ZINC000450809981	FJ	On-Demand	Anodyne	ALOX5AP	40	41
COc1cc(CN[C@@H](C)c2nc3ccccc3n2C(F)F)ccc1Cl	ZINC000450809982	FJ	On-Demand	Anodyne	ALOX5AP	40	41
COC(=O)c1ccc(CSc2nnc(OC(C)C)s2)cc1Cl	ZINC000450810000	FI	On-Demand	Anodyne	PTPRG	0	42
CNC(=O)c1ccc(NC[C@@H]2C[C@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000450810002	CF	On-Demand	Bother	TAAR1	16	41
CC[C@H]1C(=O)N(CC)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450810018	DD	On-Demand	Anodyne	EPHB3	25	42
CC[C@@H]1C(=O)N(CC)CCN1C(=O)c1cnn2ccc(C)cc12	ZINC000450810019	DD	On-Demand	Anodyne	EPHB3	25	42
COCCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450810021	FH	On-Demand	Anodyne	DRD4	40	31
COCCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450810021	FH	On-Demand	Anodyne	NAMPT	0	44
COCCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450810021	FH	On-Demand	Anodyne	KCNK3	77	39
COCCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450810021	FH	On-Demand	Anodyne	KCNK9	40	34
COCCN1C(=O)CCc2cc(NC(=O)c3cccc(SC)c3)ccc21	ZINC000450810021	FH	On-Demand	Anodyne	BRPF1	0	45
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450810026	FG	On-Demand	Anodyne	DRD4	44	35
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450810026	FG	On-Demand	Anodyne	ACHE	15	43
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450810026	FG	On-Demand	Anodyne	HDAC1	26	49
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450810026	FG	On-Demand	Anodyne	PLD2	46	33
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450810026	FG	On-Demand	Anodyne	CXCR3	33	40
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450810026	FG	On-Demand	Anodyne	MCHR1	15	40
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450810026	FG	On-Demand	Anodyne	SGPL1	0	41
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450810027	FG	On-Demand	Anodyne	DRD4	44	35
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450810027	FG	On-Demand	Anodyne	ACHE	15	43
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450810027	FG	On-Demand	Anodyne	HDAC1	26	49
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450810027	FG	On-Demand	Anodyne	PLD2	46	33
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450810027	FG	On-Demand	Anodyne	CXCR3	33	40
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450810027	FG	On-Demand	Anodyne	MCHR1	15	40
CCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450810027	FG	On-Demand	Anodyne	SGPL1	0	41
COCCN1C(=O)CCc2cc(NC(=O)C3(C(=O)C4CC4)CC3)ccc21	ZINC000450810028	FE	On-Demand	Anodyne	NAMPT	27	45
COC(=O)c1cc(C)nc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000450810036	GG	On-Demand	Bother	CACNA1C	44	37
COC(=O)c1cc(C)nc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000450810036	GG	On-Demand	Bother	CACNA1D	59	37
COC(=O)c1cc(C)nc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450810037	GG	On-Demand	Bother	CACNA1C	44	37
COC(=O)c1cc(C)nc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450810037	GG	On-Demand	Bother	CACNA1D	59	37
Cc1nccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)n1	ZINC000450810040	BD	On-Demand	Anodyne	SORD	42	35
Cc1nccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)n1	ZINC000450810042	BD	On-Demand	Anodyne	SORD	42	35
Cc1nccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)n1	ZINC000450810044	BD	On-Demand	Anodyne	SORD	42	35
Cc1nccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)n1	ZINC000450810046	BD	On-Demand	Anodyne	SORD	42	35
CN(C[C@@H]1CC=CCC1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450810048	EG	On-Demand	Anodyne	PYGL	30	43
CN(C[C@@H]1CC=CCC1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450810048	EG	On-Demand	Anodyne	PSBA	0	45
NC(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450810049	EF	On-Demand	Bother	TAAR1	22	41
CN(C[C@H]1CC=CCC1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450810050	EG	On-Demand	Anodyne	PYGL	30	43
CN(C[C@H]1CC=CCC1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450810050	EG	On-Demand	Anodyne	PSBA	0	45
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H](O)C1CCC1	ZINC000450810051	FF	On-Demand	Anodyne	HTR1A	32	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H](O)C1CCC1	ZINC000450810051	FF	On-Demand	Anodyne	HTR1D	88	40
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H](O)C1CCC1	ZINC000450810051	FF	On-Demand	Anodyne	HTR1B	65	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H](O)C1CCC1	ZINC000450810051	FF	On-Demand	Anodyne	SLC6A4	0	46
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H](O)C1CCC1	ZINC000450810051	FF	On-Demand	Anodyne	MPO	73	39
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@@H](O)C1CCC1	ZINC000450810051	FF	On-Demand	Anodyne	MTNR1A	22	47
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H](O)C1CCC1	ZINC000450810053	FF	On-Demand	Anodyne	HTR1A	32	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H](O)C1CCC1	ZINC000450810053	FF	On-Demand	Anodyne	HTR1D	88	40
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H](O)C1CCC1	ZINC000450810053	FF	On-Demand	Anodyne	HTR1B	65	42
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H](O)C1CCC1	ZINC000450810053	FF	On-Demand	Anodyne	SLC6A4	0	46
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H](O)C1CCC1	ZINC000450810053	FF	On-Demand	Anodyne	MPO	73	39
O=C(NCCc1c[nH]c2ccc(Br)cc12)[C@H](O)C1CCC1	ZINC000450810053	FF	On-Demand	Anodyne	MTNR1A	22	47
O=C(CNC(=O)Nc1cccc(Cl)c1)Nc1ncn(C2CCCCC2)n1	ZINC000450810060	GG	On-Demand	Anodyne	GRM5	16	46
O=C(CNC(=O)Nc1cccc(Cl)c1)Nc1ncn(C2CCCCC2)n1	ZINC000450810060	GG	On-Demand	Anodyne	EPHX2	19	56
O=C(CNC(=O)Nc1cccc(Cl)c1)Nc1ncn(C2CCCCC2)n1	ZINC000450810060	GG	On-Demand	Anodyne	MCHR1	25	41
COc1cc(CC(=O)NC[C@H]2CCC(C)(C)O2)ccc1Cl	ZINC000450810066	DF	On-Demand	Anodyne	NCE103	22	42
COc1cc(CC(=O)NC[C@H]2CCC(C)(C)O2)ccc1Cl	ZINC000450810066	DF	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)NC[C@@H]2CCC(C)(C)O2)ccc1Cl	ZINC000450810067	DF	On-Demand	Anodyne	NCE103	22	42
COc1cc(CC(=O)NC[C@@H]2CCC(C)(C)O2)ccc1Cl	ZINC000450810067	DF	On-Demand	Anodyne	CAN2	0	42
C[C@H]1CN(Cc2ccccc2)CCN(c2cncc(C(N)=O)n2)C1	ZINC000450810075	ED	On-Demand	Anodyne	NPFFR1	43	33
C[C@@H]1CN(Cc2ccccc2)CCN(c2cncc(C(N)=O)n2)C1	ZINC000450810076	ED	On-Demand	Anodyne	NPFFR1	43	33
CCc1cc(NC[C@@H]2C[C@H]2C(C)C)n2ncnc2n1	ZINC000450810083	CE	On-Demand	Anodyne	DHOD	0	52
NS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(C(F)(F)F)c1	ZINC000450810098	GE	On-Demand	Anodyne	HSD11B1	21	41
NS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(C(F)(F)F)c1	ZINC000450810100	GE	On-Demand	Anodyne	HSD11B1	21	41
NS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(C(F)(F)F)c1	ZINC000450810101	GE	On-Demand	Anodyne	HSD11B1	21	41
NS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(C(F)(F)F)c1	ZINC000450810102	GE	On-Demand	Anodyne	HSD11B1	21	41
COc1ccc(-c2nnc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c3ccccc23)cc1	ZINC000450810103	GI	On-Demand	Anodyne	SMO	46	52
COc1ccnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450810104	DE	On-Demand	Anodyne	DRD2	16	44
COc1ccnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450810104	DE	On-Demand	Anodyne	DRD3	27	44
COc1ccnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450810104	DE	On-Demand	Anodyne	SIGMAR1	20	40
COc1ccnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450810105	DE	On-Demand	Anodyne	DRD2	16	44
COc1ccnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450810105	DE	On-Demand	Anodyne	DRD3	27	44
COc1ccnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450810105	DE	On-Demand	Anodyne	SIGMAR1	20	40
COc1ccc(-c2nnc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c3ccccc23)cc1	ZINC000450810109	GI	On-Demand	Anodyne	SMO	46	52
COc1ccc(-c2nnc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c3ccccc23)cc1	ZINC000450810110	GI	On-Demand	Anodyne	SMO	46	52
COc1ccc(-c2nnc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c3ccccc23)cc1	ZINC000450810111	GI	On-Demand	Anodyne	SMO	46	52
CC(C)[C@@H]1C[C@H]1CNc1ncccc1[N+](=O)[O-]	ZINC000450810167	BF	On-Demand	Bother	PRKCQ	43	36
C=CCOc1ccc(CC(=O)N2CCN(CCO)[C@@H](C)C2)cc1	ZINC000450810182	DD	On-Demand	Mild	GPR183	0	40
C=CCOc1ccc(CC(=O)N2CCN(CCO)[C@H](C)C2)cc1	ZINC000450810183	DD	On-Demand	Mild	GPR183	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc3nnc(C(F)(F)F)n3n2)C1	ZINC000450810207	GG	On-Demand	Anodyne	AR	15	63
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc3nnc(C(F)(F)F)n3n2)C1	ZINC000450810208	GG	On-Demand	Anodyne	AR	15	63
COCCN(Cc1cccnc1)Cc1c(C)cccc1Cl	ZINC000450810230	DH	On-Demand	Anodyne	NR1D1	44	38
Cc1nccc(N2CCCc3ccccc3CC2)n1	ZINC000450810232	CF	On-Demand	Anodyne	SORD	69	38
COC[C@@H](C)n1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC000450810235	FE	On-Demand	Bother	CACNA1C	49	36
COC[C@@H](C)n1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC000450810235	FE	On-Demand	Bother	CACNA1D	77	36
COC[C@@H](C)n1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC000450810235	FE	On-Demand	Bother	GCK	17	49
COC[C@H](C)n1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC000450810236	FE	On-Demand	Bother	CACNA1C	49	36
COC[C@H](C)n1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC000450810236	FE	On-Demand	Bother	CACNA1D	77	36
COC[C@H](C)n1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n1	ZINC000450810236	FE	On-Demand	Bother	GCK	17	49
CCS(=O)(=O)c1ccccc1N1CCCc2ccccc2CC1	ZINC000450810272	EG	On-Demand	Anodyne	KCNQ2	55	32
COC(=O)[C@@H]1[C@@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810289	CD	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@@H]1[C@@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810289	CD	On-Demand	Anodyne	HRH3	41	47
COC(=O)[C@@H]1[C@@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810289	CD	On-Demand	Anodyne	CCR1	41	38
COC(=O)[C@@H]1[C@@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810289	CD	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@@H]1[C@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810290	CD	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@@H]1[C@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810290	CD	On-Demand	Anodyne	HRH3	41	47
COC(=O)[C@@H]1[C@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810290	CD	On-Demand	Anodyne	CCR1	41	38
COC(=O)[C@@H]1[C@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810290	CD	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@H]1[C@@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810291	CD	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@H]1[C@@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810291	CD	On-Demand	Anodyne	HRH3	41	47
COC(=O)[C@H]1[C@@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810291	CD	On-Demand	Anodyne	CCR1	41	38
COC(=O)[C@H]1[C@@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810291	CD	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@H]1[C@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810292	CD	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@H]1[C@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810292	CD	On-Demand	Anodyne	HRH3	41	47
COC(=O)[C@H]1[C@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810292	CD	On-Demand	Anodyne	CCR1	41	38
COC(=O)[C@H]1[C@H](O)CCCN1CCc1ccc(Cl)cc1	ZINC000450810292	CD	On-Demand	Anodyne	BIRC2	36	40
Cc1ccc2ncn(Cc3ccc([C@@H](C)C(F)(F)F)cc3)c(=O)c2c1	ZINC000450810319	EI	On-Demand	Anodyne	AGTR1	20	40
Cc1ccc2ncn(Cc3ccc([C@@H](C)C(F)(F)F)cc3)c(=O)c2c1	ZINC000450810319	EI	On-Demand	Anodyne	MMP13	15	47
Cc1ccc2ncn(Cc3ccc([C@@H](C)C(F)(F)F)cc3)c(=O)c2c1	ZINC000450810319	EI	On-Demand	Anodyne	SCD1	18	48
Cc1ccc2ncn(Cc3ccc([C@@H](C)C(F)(F)F)cc3)c(=O)c2c1	ZINC000450810319	EI	On-Demand	Anodyne	SCD	34	44
Cc1ccc2ncn(Cc3ccc([C@H](C)C(F)(F)F)cc3)c(=O)c2c1	ZINC000450810320	EI	On-Demand	Anodyne	AGTR1	20	40
Cc1ccc2ncn(Cc3ccc([C@H](C)C(F)(F)F)cc3)c(=O)c2c1	ZINC000450810320	EI	On-Demand	Anodyne	MMP13	15	47
Cc1ccc2ncn(Cc3ccc([C@H](C)C(F)(F)F)cc3)c(=O)c2c1	ZINC000450810320	EI	On-Demand	Anodyne	SCD1	18	48
Cc1ccc2ncn(Cc3ccc([C@H](C)C(F)(F)F)cc3)c(=O)c2c1	ZINC000450810320	EI	On-Demand	Anodyne	SCD	34	44
COCC[C@H](Nc1ccc(C(C)=O)cn1)c1cccc(C(F)(F)F)c1	ZINC000450810321	FI	On-Demand	Anodyne	GCK	24	40
COCC[C@H](Nc1ccc(C(C)=O)cn1)c1cccc(C(F)(F)F)c1	ZINC000450810321	FI	On-Demand	Anodyne	SCD1	27	42
COCC[C@@H](Nc1ccc(C(C)=O)cn1)c1cccc(C(F)(F)F)c1	ZINC000450810322	FI	On-Demand	Anodyne	GCK	24	40
COCC[C@@H](Nc1ccc(C(C)=O)cn1)c1cccc(C(F)(F)F)c1	ZINC000450810322	FI	On-Demand	Anodyne	SCD1	27	42
CC[C@@]1(CO)CCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450810323	GH	On-Demand	Anodyne	HPGD	62	70
CC[C@]1(CO)CCCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450810324	GH	On-Demand	Anodyne	HPGD	62	70
CC[C@H](O)CC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(OC)c1	ZINC000450810331	CF	On-Demand	Anodyne	RORC	35	41
CC[C@H](O)CC(=O)N1C[C@H](C)C[C@H]1c1cccc(OC)c1	ZINC000450810332	CF	On-Demand	Anodyne	RORC	35	41
CC[C@H](O)CC(=O)N1C[C@H](C)C[C@@H]1c1cccc(OC)c1	ZINC000450810333	CF	On-Demand	Anodyne	RORC	35	41
CC[C@H](O)CC(=O)N1C[C@@H](C)C[C@H]1c1cccc(OC)c1	ZINC000450810334	CF	On-Demand	Anodyne	RORC	35	41
O=C(CCC(=O)N1CC[C@H]2CCC[C@@H]21)c1cccc([N+](=O)[O-])c1	ZINC000450810344	DF	On-Demand	Bother	MGLL	0	40
O=C(CCC(=O)N1CC[C@H]2CCC[C@H]21)c1cccc([N+](=O)[O-])c1	ZINC000450810345	DF	On-Demand	Bother	MGLL	0	40
O=C(CCC(=O)N1CC[C@@H]2CCC[C@H]21)c1cccc([N+](=O)[O-])c1	ZINC000450810346	DF	On-Demand	Bother	MGLL	0	40
O=C(CCC(=O)N1CC[C@@H]2CCC[C@@H]21)c1cccc([N+](=O)[O-])c1	ZINC000450810347	DF	On-Demand	Bother	MGLL	0	40
CC[S@@](=O)CC(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450810356	EG	On-Demand	Anodyne	E1	0	52
CC[S@](=O)CC(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450810357	EG	On-Demand	Anodyne	E1	0	52
CC[S@](=O)CC(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450810358	EG	On-Demand	Anodyne	E1	0	52
CC[S@@](=O)CC(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450810359	EG	On-Demand	Anodyne	E1	0	52
CNC(=O)c1ccc(OCC(=O)CC[C@@H]2CCCCO2)cc1	ZINC000450810363	DE	On-Demand	Anodyne	PLA2G4B	66	35
CNC(=O)c1ccc(OCC(=O)CC[C@H]2CCCCO2)cc1	ZINC000450810364	DE	On-Demand	Anodyne	PLA2G4B	66	35
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncc(C(N)=O)cc1Cl	ZINC000450810378	CF	On-Demand	Anodyne	CXCR3	22	41
CC(C)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)[C@@H]1C(C)C	ZINC000450810379	CF	On-Demand	Anodyne	CXCR3	22	41
CC(C)[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)[C@@H]1C(C)C	ZINC000450810380	CF	On-Demand	Anodyne	CXCR3	22	41
CC(C)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)[C@H]1C(C)C	ZINC000450810381	CF	On-Demand	Anodyne	CXCR3	22	41
CC(C)[C@H]1CN(c2ncnc3[nH]ccc23)[C@@H]1C(C)C	ZINC000450810397	CG	On-Demand	Anodyne	AKT1	33	41
CC(C)[C@H]1CN(c2ncnc3[nH]ccc23)[C@H]1C(C)C	ZINC000450810398	CG	On-Demand	Anodyne	AKT1	33	41
CC(C)[C@@H]1CN(c2ncnc3[nH]ccc23)[C@@H]1C(C)C	ZINC000450810399	CG	On-Demand	Anodyne	AKT1	33	41
CC(C)[C@H]1[C@H](C(C)C)CN1c1ncnc2[nH]ccc12	ZINC000450810400	CG	On-Demand	Anodyne	AKT1	33	41
C[C@@H](CO)N(Cc1ccn(CCc2ccccc2)n1)C1CCCC1	ZINC000450810403	EG	On-Demand	Anodyne	SLC18A2	43	36
C[C@H](CO)N(Cc1ccn(CCc2ccccc2)n1)C1CCCC1	ZINC000450810404	EG	On-Demand	Anodyne	SLC18A2	43	36
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	DRD2	34	48
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	DRD1	27	58
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	DRD4	26	51
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	HTR2A	38	53
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	HTR2C	31	63
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	SLC6A1	53	37
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	HRH3	29	41
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	CHRNA7	23	41
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CCCN(C(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450810405	EF	On-Demand	Anodyne	CYP2J2	57	40
COc1cc(Br)ccc1CCCNC(=O)[C@@H](O)C1CCC1	ZINC000450810410	FF	On-Demand	Anodyne	MTNR1B	28	42
COc1cc(Br)ccc1CCCNC(=O)[C@H](O)C1CCC1	ZINC000450810411	FF	On-Demand	Anodyne	MTNR1B	28	42
COc1ccc(CNC(=O)CCN(C)CC2(O)CCOCC2)c(OC)c1	ZINC000450810448	FD	On-Demand	Anodyne	MTNR1A	45	35
COC(=O)c1coc(CN2CCC[C@@H](C(C)C)C2)n1	ZINC000450810451	CE	On-Demand	Anodyne	BIRC2	40	34
COC(=O)c1coc(CN2CCC[C@H](C(C)C)C2)n1	ZINC000450810453	CE	On-Demand	Anodyne	BIRC2	40	34
C[C@@H](O)CN1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450810455	CE	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H](O)CN1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450810457	CE	On-Demand	Anodyne	SLC6A3	15	40
O[C@@H]1CC[C@H]2CN(c3ncccc3C(F)(F)F)CC[C@@H]2C1	ZINC000450810465	DG	On-Demand	Anodyne	TRPV1	31	45
O[C@@H]1CC[C@@H]2CN(c3ncccc3C(F)(F)F)CC[C@@H]2C1	ZINC000450810467	DG	On-Demand	Anodyne	TRPV1	31	45
O[C@@H]1CC[C@@H]2CN(c3ncccc3C(F)(F)F)CC[C@H]2C1	ZINC000450810469	DG	On-Demand	Anodyne	TRPV1	31	45
O[C@@H]1CC[C@H]2CN(c3ncccc3C(F)(F)F)CC[C@H]2C1	ZINC000450810470	DG	On-Demand	Anodyne	TRPV1	31	45
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(CCO)[C@@H](C)C3)ccc21	ZINC000450810514	GE	On-Demand	Anodyne	HPGD	58	66
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(CCO)[C@H](C)C3)ccc21	ZINC000450810515	GE	On-Demand	Anodyne	HPGD	58	66
O=C(NC1CC1)c1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc2ccccc12	ZINC000450810522	FG	On-Demand	Anodyne	ACACB	21	43
O=C(NC1CC1)c1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc2ccccc12	ZINC000450810523	FG	On-Demand	Anodyne	ACACB	21	43
O=C(NC1CC1)c1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc2ccccc12	ZINC000450810524	FG	On-Demand	Anodyne	ACACB	21	43
O=C(NC1CC1)c1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc2ccccc12	ZINC000450810525	FG	On-Demand	Anodyne	ACACB	21	43
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCN1CCO	ZINC000450810594	FE	On-Demand	Anodyne	RBP4	92	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810601	CG	On-Demand	Anodyne	DRD2	24	51
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810601	CG	On-Demand	Anodyne	DRD4	35	44
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810601	CG	On-Demand	Anodyne	DRD3	24	44
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810601	CG	On-Demand	Anodyne	AVPR1A	0	49
C[C@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810601	CG	On-Demand	Anodyne	SMO	26	44
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810602	CG	On-Demand	Anodyne	DRD2	24	51
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810602	CG	On-Demand	Anodyne	DRD4	35	44
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810602	CG	On-Demand	Anodyne	DRD3	24	44
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810602	CG	On-Demand	Anodyne	AVPR1A	0	49
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccccn2)C1	ZINC000450810602	CG	On-Demand	Anodyne	SMO	26	44
Cc1nc(C(C)C)oc1COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810617	FJ	On-Demand	Anodyne	ADAMTS4	45	42
COc1cccc(OCCC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)c1	ZINC000450810618	FE	On-Demand	Anodyne	MTNR1B	15	44
COc1cccc(OCCC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)c1	ZINC000450810618	FE	On-Demand	Anodyne	VCP	39	42
COc1cccc(OCCC(=O)N[C@H]2CCCN(c3cccnc3)C2=O)c1	ZINC000450810619	FE	On-Demand	Anodyne	MTNR1B	15	44
COc1cccc(OCCC(=O)N[C@H]2CCCN(c3cccnc3)C2=O)c1	ZINC000450810619	FE	On-Demand	Anodyne	VCP	39	42
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cn1	ZINC000450810620	GG	On-Demand	Anodyne	PKM	39	42
c1ccc2cc(-c3nnc(SC[C@H]4C[C@H]5CC[C@H]4O5)o3)ccc2c1	ZINC000450810625	EJ	On-Demand	Anodyne	GSK3A	46	38
c1ccc2cc(-c3nnc(SC[C@@H]4C[C@H]5CC[C@H]4O5)o3)ccc2c1	ZINC000450810626	EJ	On-Demand	Anodyne	GSK3A	46	38
Cc1ccc(F)c(CCNc2ccc(S(C)(=O)=O)cc2)c1	ZINC000450810628	DG	On-Demand	Anodyne	PTGS2	30	43
C[C@H]1CN(Cc2ccccc2)CCN(c2nccc(C(F)(F)F)n2)C1	ZINC000450810641	FG	On-Demand	Anodyne	RBP4	16	48
C[C@@H]1CN(Cc2ccccc2)CCN(c2nccc(C(F)(F)F)n2)C1	ZINC000450810642	FG	On-Demand	Anodyne	RBP4	16	48
CC[C@@H]1C(=O)N(CC)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450810654	DD	On-Demand	Anodyne	TRPV1	0	44
CC[C@H]1C(=O)N(CC)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450810655	DD	On-Demand	Anodyne	TRPV1	0	44
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nn1	ZINC000450810657	FE	On-Demand	Anodyne	SCD1	62	46
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nn1	ZINC000450810657	FE	On-Demand	Anodyne	SCD	52	44
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nn1	ZINC000450810658	FE	On-Demand	Anodyne	SCD1	62	46
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nn1	ZINC000450810658	FE	On-Demand	Anodyne	SCD	52	44
C[C@H]1CN(Cc2ccccc2)CCN(c2nnc(C3CC3)s2)C1	ZINC000450810664	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2nnc(C3CC3)s2)C1	ZINC000450810665	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3Cc4c(C)cccc4O3)ccc21	ZINC000450810667	GF	On-Demand	Anodyne	NAMPT	25	46
COCCN1C(=O)CCc2cc(NC(=O)[C@H]3Cc4c(C)cccc4O3)ccc21	ZINC000450810668	GF	On-Demand	Anodyne	NAMPT	25	46
O=C(CC[C@H]1CCCCO1)COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810671	GH	On-Demand	Anodyne	COLA	125	39
O=C(CC[C@H]1CCCCO1)COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810671	GH	On-Demand	Anodyne	CPT1A	115	39
O=C(CC[C@H]1CCCCO1)COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810671	GH	On-Demand	Anodyne	CPT2	40	33
O=C(CC[C@H]1CCCCO1)COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810671	GH	On-Demand	Anodyne	PLA2G4B	62	34
O=C(CC[C@@H]1CCCCO1)COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810672	GH	On-Demand	Anodyne	COLA	125	39
O=C(CC[C@@H]1CCCCO1)COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810672	GH	On-Demand	Anodyne	CPT1A	115	39
O=C(CC[C@@H]1CCCCO1)COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810672	GH	On-Demand	Anodyne	CPT2	40	33
O=C(CC[C@@H]1CCCCO1)COc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450810672	GH	On-Demand	Anodyne	PLA2G4B	62	34
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@]3(CCS(=O)(=O)C3)C2)c1	ZINC000450810690	FD	On-Demand	Bother	TAAR1	19	41
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@@]3(CCS(=O)(=O)C3)C2)c1	ZINC000450810691	FD	On-Demand	Bother	TAAR1	19	41
CC(C)[C@@H]1C[C@H]1CNc1cc(N2CCC[C@H]2CO)ncn1	ZINC000450810692	CE	On-Demand	Anodyne	PRCP	0	41
CC(C)[C@@H]1C[C@H]1CNc1cc(N2CCC[C@@H]2CO)ncn1	ZINC000450810693	CE	On-Demand	Anodyne	PRCP	0	41
CNC(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450810702	BD	On-Demand	Anodyne	HT1	0	40
CNC(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450810702	BD	On-Demand	Anodyne	LMGT2	0	40
CNC(=O)c1ccc(OCC[C@H](C)O)cc1	ZINC000450810703	BD	On-Demand	Anodyne	HT1	0	40
CNC(=O)c1ccc(OCC[C@H](C)O)cc1	ZINC000450810703	BD	On-Demand	Anodyne	LMGT2	0	40
CC[C@]1(CO)CCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450810704	GH	On-Demand	Anodyne	CHRM3	15	41
CC[C@@]1(CO)CCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450810705	GH	On-Demand	Anodyne	CHRM3	15	41
Cc1nn(C)cc1CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450810716	ED	On-Demand	Bother	CACNA1C	50	33
Cc1nn(C)cc1CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450810716	ED	On-Demand	Bother	CACNA1D	79	33
Cc1nn(C)cc1CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450810717	ED	On-Demand	Bother	CACNA1C	50	33
Cc1nn(C)cc1CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000450810717	ED	On-Demand	Bother	CACNA1D	79	33
COCC[C@H](Nc1cc(COC)nc2ncnn12)c1cccc(C(F)(F)F)c1	ZINC000450810718	GG	On-Demand	Anodyne	DHOD	0	46
COCC[C@@H](Nc1cc(COC)nc2ncnn12)c1cccc(C(F)(F)F)c1	ZINC000450810719	GG	On-Demand	Anodyne	DHOD	0	46
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]4CCC[C@H]43)ccc21	ZINC000450810729	FI	On-Demand	Anodyne	HPGD	59	68
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]4CCC[C@H]43)ccc21	ZINC000450810730	FI	On-Demand	Anodyne	HPGD	59	68
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@H]4CCC[C@@H]43)ccc21	ZINC000450810731	FI	On-Demand	Anodyne	HPGD	59	68
COc1ccccc1-n1cnc2cc(C(=O)N3CC[C@@H]4CCC[C@@H]43)ccc21	ZINC000450810732	FI	On-Demand	Anodyne	HPGD	59	68
CC(C)[C@H]1[C@H](C(C)C)CN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450810734	EG	On-Demand	Anodyne	DHOD	0	40
CC(C)[C@@H]1CN(c2cc(C(F)(F)F)nc3ncnn23)[C@@H]1C(C)C	ZINC000450810735	EG	On-Demand	Anodyne	DHOD	0	40
CC(C)[C@H]1CN(c2cc(C(F)(F)F)nc3ncnn23)[C@H]1C(C)C	ZINC000450810736	EG	On-Demand	Anodyne	DHOD	0	40
CC(C)[C@H]1CN(c2cc(C(F)(F)F)nc3ncnn23)[C@@H]1C(C)C	ZINC000450810737	EG	On-Demand	Anodyne	DHOD	0	40
COC(=O)[C@@H](NC(=O)c1nn2c(c1C)OCCC2)c1ccc(Cl)cc1Cl	ZINC000450810742	GF	On-Demand	Anodyne	CNR1	48	30
COC(=O)[C@H](NC(=O)c1nn2c(c1C)OCCC2)c1ccc(Cl)cc1Cl	ZINC000450810743	GF	On-Demand	Anodyne	CNR1	48	30
O=C(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450810749	GE	On-Demand	Bother	L3MBTL1	0	42
O=C(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450810749	GE	On-Demand	Bother	L3MBTL3	34	42
O=C(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450810750	GE	On-Demand	Bother	L3MBTL1	0	42
O=C(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450810750	GE	On-Demand	Bother	L3MBTL3	34	42
O=C(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450810751	GE	On-Demand	Bother	L3MBTL1	0	42
O=C(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450810751	GE	On-Demand	Bother	L3MBTL3	34	42
O=C(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450810752	GE	On-Demand	Bother	L3MBTL1	0	42
O=C(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450810752	GE	On-Demand	Bother	L3MBTL3	34	42
COCC[C@H](Nc1ncc(C(=O)OC)cn1)c1cccc(C(F)(F)F)c1	ZINC000450810774	FG	On-Demand	Anodyne	SCD1	28	42
COCC[C@@H](Nc1ncc(C(=O)OC)cn1)c1cccc(C(F)(F)F)c1	ZINC000450810775	FG	On-Demand	Anodyne	SCD1	28	42
Cc1ccn2ncc(C(=O)N3CC[C@@H]4CCC[C@H]43)c2c1	ZINC000450810776	CF	On-Demand	Anodyne	EPHB3	25	43
Cc1ccn2ncc(C(=O)N3CC[C@@H]4CCC[C@@H]43)c2c1	ZINC000450810777	CF	On-Demand	Anodyne	EPHB3	25	43
Cc1ccn2ncc(C(=O)N3CC[C@H]4CCC[C@@H]43)c2c1	ZINC000450810778	CF	On-Demand	Anodyne	EPHB3	25	43
Cc1ccn2ncc(C(=O)N3CC[C@H]4CCC[C@H]43)c2c1	ZINC000450810779	CF	On-Demand	Anodyne	EPHB3	25	43
CC(=O)CCCCCOc1ccc(C(=O)OC(C)C)cc1	ZINC000450810783	CH	On-Demand	Anodyne	SAT1	0	41
CC(=O)CCCCCOc1ccc(C(=O)OC(C)C)cc1	ZINC000450810783	CH	On-Demand	Anodyne	PLA2G4B	87	42
CC(=O)CCCCCOc1ccc(C(=O)OC(C)C)cc1	ZINC000450810783	CH	On-Demand	Anodyne	ACR	32	41
CCS(=O)(=O)c1ccc(CN(C2CCCC2)[C@@H](C)CO)cc1	ZINC000450810895	EF	On-Demand	Anodyne	RORC	18	43
CCS(=O)(=O)c1ccc(CN(C2CCCC2)[C@H](C)CO)cc1	ZINC000450810896	EF	On-Demand	Anodyne	RORC	18	43
CC(F)(F)c1ccc(C(=O)N2CCCCC[C@@H]2c2ncon2)cn1	ZINC000450810908	EG	On-Demand	Anodyne	COLA	59	41
CC(F)(F)c1ccc(C(=O)N2CCCCC[C@@H]2c2ncon2)cn1	ZINC000450810908	EG	On-Demand	Anodyne	CPT1A	57	41
CC(F)(F)c1ccc(C(=O)N2CCCCC[C@H]2c2ncon2)cn1	ZINC000450810909	EG	On-Demand	Anodyne	COLA	59	41
CC(F)(F)c1ccc(C(=O)N2CCCCC[C@H]2c2ncon2)cn1	ZINC000450810909	EG	On-Demand	Anodyne	CPT1A	57	41
COc1cc(CC(=O)N2CCN(CCO)[C@H](C)C2)ccc1O	ZINC000450810916	DC	On-Demand	Anodyne	RORC	42	34
COc1cc(CC(=O)N2CCN(CCO)[C@@H](C)C2)ccc1O	ZINC000450810917	DC	On-Demand	Anodyne	RORC	42	34
COC(=O)c1ccc([N+](=O)[O-])c(OCc2oc(C(C)C)nc2C)c1	ZINC000450810918	EG	On-Demand	Bother	GSTM2	53	36
CCS(=O)(=O)C1CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450810964	DD	On-Demand	Anodyne	PDE3B	65	35
CCCOc1ccc(C(=O)N2CCCCC[C@H]2c2ncon2)c(OC)c1	ZINC000450810975	FH	On-Demand	Anodyne	COLA	93	38
CCCOc1ccc(C(=O)N2CCCCC[C@H]2c2ncon2)c(OC)c1	ZINC000450810975	FH	On-Demand	Anodyne	CPT1A	77	38
CCCOc1ccc(C(=O)N2CCCCC[C@@H]2c2ncon2)c(OC)c1	ZINC000450810976	FH	On-Demand	Anodyne	COLA	93	38
CCCOc1ccc(C(=O)N2CCCCC[C@@H]2c2ncon2)c(OC)c1	ZINC000450810976	FH	On-Demand	Anodyne	CPT1A	77	38
CO[C@H](CN[C@@H]1CCC[C@@]1(C)CO)Cc1ccccc1	ZINC000450811012	CE	On-Demand	Anodyne	TIMP3	47	37
CO[C@H](CN[C@@H]1CCC[C@]1(C)CO)Cc1ccccc1	ZINC000450811013	CE	On-Demand	Anodyne	TIMP3	47	37
CO[C@H](CN[C@H]1CCC[C@@]1(C)CO)Cc1ccccc1	ZINC000450811014	CE	On-Demand	Anodyne	TIMP3	47	37
CO[C@H](CN[C@H]1CCC[C@]1(C)CO)Cc1ccccc1	ZINC000450811015	CE	On-Demand	Anodyne	TIMP3	47	37
COC(=O)CNC(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450811018	GE	On-Demand	Bother	DRD2	15	40
COC(=O)CNC(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450811018	GE	On-Demand	Bother	DRD4	43	35
COC(=O)CNC(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450811018	GE	On-Demand	Bother	AVPR2	27	41
COC(=O)CNC(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450811018	GE	On-Demand	Bother	DRD3	25	40
COC(=O)CNC(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450811018	GE	On-Demand	Bother	TAAR1	43	53
CC(F)(F)CCN1C(=O)CN(c2ccccc2)C1=O	ZINC000450811019	CF	On-Demand	Anodyne	CMA1	23	42
COC(=O)c1coc(CN2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450811033	FH	On-Demand	Anodyne	COLA	88	38
COC(=O)c1coc(CN2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450811033	FH	On-Demand	Anodyne	CPT1A	74	36
COC(=O)c1coc(CN2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450811034	FH	On-Demand	Anodyne	COLA	88	38
COC(=O)c1coc(CN2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450811034	FH	On-Demand	Anodyne	CPT1A	74	36
C[C@@H](O)CN1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450811043	CD	On-Demand	Anodyne	SLC6A3	17	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCN(C[C@@H](C)O)CC1	ZINC000450811044	CD	On-Demand	Anodyne	SLC6A3	17	40
C[C@@H](O)CN1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450811045	CD	On-Demand	Anodyne	SLC6A3	17	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCN(C[C@@H](C)O)CC1	ZINC000450811046	CD	On-Demand	Anodyne	SLC6A3	17	40
Cc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)ncn1	ZINC000450811087	CF	On-Demand	Anodyne	DRD2	0	41
Cc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)ncn1	ZINC000450811087	CF	On-Demand	Anodyne	SIGMAR1	33	40
Cc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)ncn1	ZINC000450811089	CF	On-Demand	Anodyne	DRD2	0	41
Cc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)ncn1	ZINC000450811089	CF	On-Demand	Anodyne	SIGMAR1	33	40
O[C@@H]1CC[C@@H]2CN(c3ncnc4sc5c(c34)CCCC5)CC[C@H]2C1	ZINC000450811094	EH	On-Demand	Anodyne	RBP4	17	41
O[C@@H]1CC[C@H]2CN(c3ncnc4sc5c(c34)CCCC5)CC[C@@H]2C1	ZINC000450811096	EH	On-Demand	Anodyne	RBP4	17	41
O[C@@H]1CC[C@H]2CN(c3ncnc4sc5c(c34)CCCC5)CC[C@H]2C1	ZINC000450811097	EH	On-Demand	Anodyne	RBP4	17	41
O[C@@H]1CC[C@@H]2CN(c3ncnc4sc5c(c34)CCCC5)CC[C@@H]2C1	ZINC000450811098	EH	On-Demand	Anodyne	RBP4	17	41
O=C(CC1(O)CCC1)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450811099	DH	On-Demand	Anodyne	E1	0	49
O=C(CC1(O)CCC1)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000450811100	DH	On-Demand	Anodyne	E1	0	49
COCC[C@H](Nc1ccc(C(=O)N(C)C)cn1)c1cccc(C(F)(F)F)c1	ZINC000450811134	GH	On-Demand	Anodyne	SCD1	27	43
COCC[C@@H](Nc1ccc(C(=O)N(C)C)cn1)c1cccc(C(F)(F)F)c1	ZINC000450811136	GH	On-Demand	Anodyne	SCD1	27	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc([N+](=O)[O-])cn2)C1	ZINC000450811149	EF	On-Demand	Bother	SIGMAR1	15	45
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc([N+](=O)[O-])cn2)C1	ZINC000450811150	EF	On-Demand	Bother	SIGMAR1	15	45
CC(C)(C(=O)Nc1cc2c(cc1F)NC(=O)CC2)C1CCC1	ZINC000450811151	DG	On-Demand	Anodyne	PKM	42	43
O=C(NCCCCCc1ccc(F)cc1)c1cn(CC2CC2)nn1	ZINC000450811172	EF	On-Demand	Anodyne	CCR3	40	33
COC[C@@H](C)n1ccc(NC(=O)c2cn(-c3cccc(OC)c3)nn2)n1	ZINC000450811182	FD	On-Demand	Anodyne	DRD4	44	36
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450811184	FF	On-Demand	Anodyne	DRD4	40	32
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450811184	FF	On-Demand	Anodyne	HDAC1	27	49
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450811184	FF	On-Demand	Anodyne	CXCR3	33	43
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450811184	FF	On-Demand	Anodyne	SGPL1	0	42
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450811184	FF	On-Demand	Anodyne	SMO	22	40
COC[C@H](C)n1ccc(NC(=O)c2cn(-c3cccc(OC)c3)nn2)n1	ZINC000450811185	FD	On-Demand	Anodyne	DRD4	44	36
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450811186	FF	On-Demand	Anodyne	DRD4	40	32
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450811186	FF	On-Demand	Anodyne	HDAC1	27	49
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450811186	FF	On-Demand	Anodyne	CXCR3	33	43
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450811186	FF	On-Demand	Anodyne	SGPL1	0	42
CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450811186	FF	On-Demand	Anodyne	SMO	22	40
CCc1nc(C)c(COc2cc([N+](=O)[O-])ccc2C)o1	ZINC000450811188	CG	On-Demand	Bother	CYP19A1	15	42
CC(C)[C@@H]1C[C@H]1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450811191	EF	On-Demand	Bother	COLA	42	34
Cc1nn(C)cc1CC(=O)NCCCCCc1ccc(F)cc1	ZINC000450811216	DF	On-Demand	Anodyne	PLA2G7	30	43
Cc1nn(C)cc1CC(=O)NCCCCCc1ccc(F)cc1	ZINC000450811216	DF	On-Demand	Anodyne	P2RX7	52	40
Cc1nn(C)cc1CC(=O)NCCCCCc1ccc(F)cc1	ZINC000450811216	DF	On-Demand	Anodyne	LEF	45	33
CCCc1nc(C)c(COc2cc([N+](=O)[O-])ccc2C)o1	ZINC000450811247	CH	On-Demand	Bother	CYP19A1	15	40
CC[C@@]1(O)CCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450811249	CD	On-Demand	Anodyne	TIMP3	47	31
CC[C@@]1(O)CCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450811251	CD	On-Demand	Anodyne	TIMP3	47	31
CC[C@]1(O)CCN(C(=O)[C@H](Cc2ccccc2)OC)C1	ZINC000450811253	CD	On-Demand	Anodyne	TIMP3	47	31
CC[C@]1(O)CCN(C(=O)[C@@H](Cc2ccccc2)OC)C1	ZINC000450811254	CD	On-Demand	Anodyne	TIMP3	47	31
O=C(NCCCCCc1ccc(F)cc1)c1cn(-c2cccnc2)nn1	ZINC000450811257	FF	On-Demand	Anodyne	TBXAS1	23	42
O=C(NCCCCCc1ccc(F)cc1)c1cn(-c2cccnc2)nn1	ZINC000450811257	FF	On-Demand	Anodyne	PTAFR	25	44
O[C@@H]1CC[C@@H]2CN(c3ccnc4cc(Cl)ccc34)CC[C@H]2C1	ZINC000450811262	DH	On-Demand	Anodyne	HRP1_PLAFA	48	33
O[C@@H]1CC[C@@H]2CN(c3ccnc4cc(Cl)ccc34)CC[C@H]2C1	ZINC000450811262	DH	On-Demand	Anodyne	HNMT	48	34
O[C@@H]1CC[C@H]2CN(c3ccnc4cc(Cl)ccc34)CC[C@H]2C1	ZINC000450811263	DH	On-Demand	Anodyne	HRP1_PLAFA	48	33
O[C@@H]1CC[C@H]2CN(c3ccnc4cc(Cl)ccc34)CC[C@H]2C1	ZINC000450811263	DH	On-Demand	Anodyne	HNMT	48	34
O[C@@H]1CC[C@@H]2CN(c3ccnc4cc(Cl)ccc34)CC[C@@H]2C1	ZINC000450811265	DH	On-Demand	Anodyne	HRP1_PLAFA	48	33
O[C@@H]1CC[C@@H]2CN(c3ccnc4cc(Cl)ccc34)CC[C@@H]2C1	ZINC000450811265	DH	On-Demand	Anodyne	HNMT	48	34
O[C@@H]1CC[C@H]2CN(c3ccnc4cc(Cl)ccc34)CC[C@@H]2C1	ZINC000450811267	DH	On-Demand	Anodyne	HRP1_PLAFA	48	33
O[C@@H]1CC[C@H]2CN(c3ccnc4cc(Cl)ccc34)CC[C@@H]2C1	ZINC000450811267	DH	On-Demand	Anodyne	HNMT	48	34
CC[C@@]1(CO)CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450811269	GH	On-Demand	Anodyne	PDE6D	80	38
CC[C@@]1(CO)CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450811269	GH	On-Demand	Anodyne	HDAC8	33	41
CC[C@@]1(CO)CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450811269	GH	On-Demand	Anodyne	HDAC6	23	41
CC[C@@]1(CO)CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450811269	GH	On-Demand	Anodyne	IMDH_CRYPV	29	45
CC[C@]1(CO)CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450811271	GH	On-Demand	Anodyne	PDE6D	80	38
CC[C@]1(CO)CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450811271	GH	On-Demand	Anodyne	HDAC8	33	41
CC[C@]1(CO)CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450811271	GH	On-Demand	Anodyne	HDAC6	23	41
CC[C@]1(CO)CCCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450811271	GH	On-Demand	Anodyne	IMDH_CRYPV	29	45
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811286	DE	On-Demand	Anodyne	DRD4	40	36
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811286	DE	On-Demand	Anodyne	CXCR3	27	47
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811286	DE	On-Demand	Anodyne	SGPL1	0	46
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811286	DE	On-Demand	Anodyne	SMO	24	52
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811286	DE	On-Demand	Anodyne	NPFFR1	43	34
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811287	DE	On-Demand	Anodyne	DRD4	40	36
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811287	DE	On-Demand	Anodyne	CXCR3	27	47
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811287	DE	On-Demand	Anodyne	SGPL1	0	46
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811287	DE	On-Demand	Anodyne	SMO	24	52
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450811287	DE	On-Demand	Anodyne	NPFFR1	43	34
C[C@H](c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1)C(F)(F)F	ZINC000450811297	FI	On-Demand	Anodyne	NR1H3	85	41
C[C@H](c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1)C(F)(F)F	ZINC000450811297	FI	On-Demand	Anodyne	ADAMTS4	48	40
C[C@H](c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1)C(F)(F)F	ZINC000450811297	FI	On-Demand	Anodyne	NR1H2	58	41
C[C@H](c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1)C(F)(F)F	ZINC000450811297	FI	On-Demand	Anodyne	FFAR1	42	36
C[C@@H](c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1)C(F)(F)F	ZINC000450811298	FI	On-Demand	Anodyne	NR1H3	85	41
C[C@@H](c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1)C(F)(F)F	ZINC000450811298	FI	On-Demand	Anodyne	ADAMTS4	48	40
C[C@@H](c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1)C(F)(F)F	ZINC000450811298	FI	On-Demand	Anodyne	NR1H2	58	41
C[C@@H](c1ccc(COc2cccc(S(C)(=O)=O)c2)cc1)C(F)(F)F	ZINC000450811298	FI	On-Demand	Anodyne	FFAR1	42	36
CCc1nc(C)c(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000450811311	FE	On-Demand	Bother	CACNA1C	43	33
CCc1nc(C)c(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000450811311	FE	On-Demand	Bother	CACNA1D	66	32
CCc1nc(C)c(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000450811312	FE	On-Demand	Bother	CACNA1C	43	33
CCc1nc(C)c(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000450811312	FE	On-Demand	Bother	CACNA1D	66	32
CC(C)OC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450811323	CF	On-Demand	Anodyne	PLA2G4B	63	38
CC(C)OC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450811329	CF	On-Demand	Anodyne	PLA2G4B	63	38
COC(=O)[C@H](NCc1ccc(Cl)c(OC)c1)C1CC1	ZINC000450811333	CE	On-Demand	Anodyne	PDE6A	40	33
COC(=O)[C@@H](NCc1ccc(Cl)c(OC)c1)C1CC1	ZINC000450811334	CE	On-Demand	Anodyne	PDE6A	40	33
O[C@@H]1CC[C@@H]2CN(c3ncnc4scc(-c5ccccc5)c34)CC[C@@H]2C1	ZINC000450811343	FI	On-Demand	Anodyne	ADRB3	33	51
O[C@@H]1CC[C@@H]2CN(c3ncnc4scc(-c5ccccc5)c34)CC[C@H]2C1	ZINC000450811344	FI	On-Demand	Anodyne	ADRB3	33	51
O[C@@H]1CC[C@H]2CN(c3ncnc4scc(-c5ccccc5)c34)CC[C@@H]2C1	ZINC000450811345	FI	On-Demand	Anodyne	ADRB3	33	51
O[C@@H]1CC[C@H]2CN(c3ncnc4scc(-c5ccccc5)c34)CC[C@H]2C1	ZINC000450811346	FI	On-Demand	Anodyne	ADRB3	33	51
N#Cc1ccc(N2C[C@H](C(=O)N3CCC(O)(C(F)F)CC3)CC2=O)cc1Cl	ZINC000450811365	GE	On-Demand	Mild	AR	15	41
N#Cc1ccc(N2C[C@@H](C(=O)N3CCC(O)(C(F)F)CC3)CC2=O)cc1Cl	ZINC000450811369	GE	On-Demand	Mild	AR	15	41
CCc1cccc(C(=O)Nc2cccnc2SCCC(=O)OC)n1	ZINC000450811383	EF	On-Demand	Anodyne	PDE5A	25	42
CCc1cccc(C(=O)Nc2cccnc2SCCC(=O)OC)n1	ZINC000450811383	EF	On-Demand	Anodyne	G2YM83_BOTF4	64	35
COC(=O)CCSc1ncccc1NC(=O)CCc1nc2cnccc2[nH]1	ZINC000450811396	GF	On-Demand	Anodyne	ENPP1	42	34
COC(=O)[C@H]1[C@@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811402	DD	On-Demand	Anodyne	DRD2	50	41
COC(=O)[C@H]1[C@@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811402	DD	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@H]1[C@@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811402	DD	On-Demand	Anodyne	HTR4	45	36
COC(=O)[C@H]1[C@@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811402	DD	On-Demand	Anodyne	SSTR5	39	41
COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811403	DD	On-Demand	Anodyne	DRD2	50	41
COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811403	DD	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811403	DD	On-Demand	Anodyne	HTR4	45	36
COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811403	DD	On-Demand	Anodyne	SSTR5	39	41
COC(=O)[C@@H]1[C@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811404	DD	On-Demand	Anodyne	DRD2	50	41
COC(=O)[C@@H]1[C@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811404	DD	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@@H]1[C@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811404	DD	On-Demand	Anodyne	HTR4	45	36
COC(=O)[C@@H]1[C@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811404	DD	On-Demand	Anodyne	SSTR5	39	41
COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811405	DD	On-Demand	Anodyne	DRD2	50	41
COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811405	DD	On-Demand	Anodyne	DRD3	0	40
COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811405	DD	On-Demand	Anodyne	HTR4	45	36
COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450811405	DD	On-Demand	Anodyne	SSTR5	39	41
COC[C@@H](C)n1ccc(NC(=O)c2ccnc(OC(F)F)c2)n1	ZINC000450811408	ED	On-Demand	Anodyne	GCK	45	41
COC[C@H](C)n1ccc(NC(=O)c2ccnc(OC(F)F)c2)n1	ZINC000450811409	ED	On-Demand	Anodyne	GCK	45	41
CO[C@H](CSc1ccc(O)cc1)Cc1ccccc1	ZINC000450811410	CH	On-Demand	Anodyne	FCER2	15	42
CO[C@@H](CSc1ccc(O)cc1)Cc1ccccc1	ZINC000450811411	CH	On-Demand	Anodyne	FCER2	15	42
COc1cccc(OCCC(=O)Nc2ncn(C(C)(C)C)n2)c1	ZINC000450811412	DE	On-Demand	Anodyne	MTNR1A	31	45
COc1cccc(OCCC(=O)Nc2ncn(C(C)(C)C)n2)c1	ZINC000450811412	DE	On-Demand	Anodyne	MTNR1B	30	40
COC(=O)c1cccc(CN2C[C@H](F)C[C@@H]2CO)c1Cl	ZINC000450811434	DE	On-Demand	Anodyne	ITGA4	42	31
COC(=O)c1cccc(CN2C[C@H](F)C[C@H]2CO)c1Cl	ZINC000450811435	DE	On-Demand	Anodyne	ITGA4	42	31
COC(=O)c1cccc(CN2C[C@@H](F)C[C@H]2CO)c1Cl	ZINC000450811436	DE	On-Demand	Anodyne	ITGA4	42	31
COC(=O)c1cccc(CN2C[C@@H](F)C[C@@H]2CO)c1Cl	ZINC000450811437	DE	On-Demand	Anodyne	ITGA4	42	31
COC[C@H](C)n1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)n1	ZINC000450811438	DE	On-Demand	Anodyne	GCK	47	42
COC[C@@H](C)n1ccc(NC(=O)c2ccc(C(C)(F)F)nc2)n1	ZINC000450811439	DE	On-Demand	Anodyne	GCK	47	42
COc1ccc(CC(=O)N2CCCCC[C@@H]2c2ncon2)c(Cl)c1OC	ZINC000450811455	GG	On-Demand	Anodyne	COLA	112	41
COc1ccc(CC(=O)N2CCCCC[C@@H]2c2ncon2)c(Cl)c1OC	ZINC000450811455	GG	On-Demand	Anodyne	CPT1A	105	41
COc1ccc(CC(=O)N2CCCCC[C@H]2c2ncon2)c(Cl)c1OC	ZINC000450811456	GG	On-Demand	Anodyne	COLA	112	41
COc1ccc(CC(=O)N2CCCCC[C@H]2c2ncon2)c(Cl)c1OC	ZINC000450811456	GG	On-Demand	Anodyne	CPT1A	105	41
CCS(=O)(=O)C1CN(c2cc(C(C)(C)C)nc(C(C)(C)C)n2)C1	ZINC000450811476	EF	On-Demand	Anodyne	DRD3	18	40
COc1cc(CC(=O)N[C@@H]2CCc3ccc(C(C)C)cc32)ccc1O	ZINC000450811478	EH	On-Demand	Anodyne	TRPV1	26	43
COc1cc(CC(=O)N[C@@H]2CCc3ccc(C(C)C)cc32)ccc1O	ZINC000450811478	EH	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)N[C@@H]2CCc3ccc(C(C)C)cc32)ccc1O	ZINC000450811478	EH	On-Demand	Anodyne	SLC22A3	0	40
COc1cc(CC(=O)N[C@H]2CCc3ccc(C(C)C)cc32)ccc1O	ZINC000450811479	EH	On-Demand	Anodyne	TRPV1	26	43
COc1cc(CC(=O)N[C@H]2CCc3ccc(C(C)C)cc32)ccc1O	ZINC000450811479	EH	On-Demand	Anodyne	CAN2	0	42
COc1cc(CC(=O)N[C@H]2CCc3ccc(C(C)C)cc32)ccc1O	ZINC000450811479	EH	On-Demand	Anodyne	SLC22A3	0	40
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2ncon2)on1	ZINC000450811496	ED	On-Demand	Anodyne	COLA	100	42
CCOC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2ncon2)on1	ZINC000450811496	ED	On-Demand	Anodyne	CPT1A	82	39
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2ncon2)on1	ZINC000450811497	ED	On-Demand	Anodyne	COLA	100	42
CCOC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2ncon2)on1	ZINC000450811497	ED	On-Demand	Anodyne	CPT1A	82	39
CS(=O)(=O)N1CC(CNC(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450811498	EC	On-Demand	Anodyne	CACNA1I	40	34
CCNC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nn1	ZINC000450811504	DD	On-Demand	Anodyne	SCD1	47	44
CCNC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nn1	ZINC000450811504	DD	On-Demand	Anodyne	SCD	23	41
CCNC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nn1	ZINC000450811505	DD	On-Demand	Anodyne	SCD1	47	44
CCNC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nn1	ZINC000450811505	DD	On-Demand	Anodyne	SCD	23	41
CCNC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nn1	ZINC000450811506	DD	On-Demand	Anodyne	SCD1	47	44
CCNC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nn1	ZINC000450811506	DD	On-Demand	Anodyne	SCD	23	41
CCNC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nn1	ZINC000450811507	DD	On-Demand	Anodyne	SCD1	47	44
CCNC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nn1	ZINC000450811507	DD	On-Demand	Anodyne	SCD	23	41
CSc1ccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c2c1	ZINC000450811508	EG	On-Demand	Anodyne	PDE3A	49	37
CSc1ccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c2c1	ZINC000450811508	EG	On-Demand	Anodyne	PDE3B	73	37
CSc1ccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c2c1	ZINC000450811509	EG	On-Demand	Anodyne	PDE3A	49	37
CSc1ccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c2c1	ZINC000450811509	EG	On-Demand	Anodyne	PDE3B	73	37
CSc1ccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c2c1	ZINC000450811510	EG	On-Demand	Anodyne	PDE3A	49	37
CSc1ccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c2c1	ZINC000450811510	EG	On-Demand	Anodyne	PDE3B	73	37
CSc1ccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c2c1	ZINC000450811511	EG	On-Demand	Anodyne	PDE3A	49	37
CSc1ccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c2c1	ZINC000450811511	EG	On-Demand	Anodyne	PDE3B	73	37
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c2c1	ZINC000450811516	GH	On-Demand	Anodyne	PDE3A	42	37
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c2c1	ZINC000450811516	GH	On-Demand	Anodyne	PDE3B	61	37
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c2c1	ZINC000450811517	GH	On-Demand	Anodyne	PDE3A	42	37
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c2c1	ZINC000450811517	GH	On-Demand	Anodyne	PDE3B	61	37
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c2c1	ZINC000450811518	GH	On-Demand	Anodyne	PDE3A	42	37
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c2c1	ZINC000450811518	GH	On-Demand	Anodyne	PDE3B	61	37
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c2c1	ZINC000450811519	GH	On-Demand	Anodyne	PDE3A	42	37
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c2c1	ZINC000450811519	GH	On-Demand	Anodyne	PDE3B	61	37
COC(=O)c1nc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)sc1C	ZINC000450811532	DE	On-Demand	Anodyne	GYRB	0	40
COC(=O)c1nc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)sc1C	ZINC000450811532	DE	On-Demand	Anodyne	PARE	48	33
COC(=O)c1nc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)sc1C	ZINC000450811533	DE	On-Demand	Anodyne	GYRB	0	40
COC(=O)c1nc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)sc1C	ZINC000450811533	DE	On-Demand	Anodyne	PARE	48	33
COC(=O)c1nc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)sc1C	ZINC000450811534	DE	On-Demand	Anodyne	GYRB	0	40
COC(=O)c1nc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)sc1C	ZINC000450811534	DE	On-Demand	Anodyne	PARE	48	33
COC(=O)c1nc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)sc1C	ZINC000450811535	DE	On-Demand	Anodyne	GYRB	0	40
COC(=O)c1nc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)sc1C	ZINC000450811535	DE	On-Demand	Anodyne	PARE	48	33
O[C@@H]1CC[C@H]2CN(c3nc4ccccc4[nH]3)CC[C@@H]2C1	ZINC000450811541	CF	On-Demand	Anodyne	KCNN3	23	43
O[C@@H]1CC[C@@H]2CN(c3nc4ccccc4[nH]3)CC[C@@H]2C1	ZINC000450811542	CF	On-Demand	Anodyne	KCNN3	23	43
O[C@@H]1CC[C@H]2CN(c3nc4ccccc4[nH]3)CC[C@H]2C1	ZINC000450811543	CF	On-Demand	Anodyne	KCNN3	23	43
O[C@@H]1CC[C@@H]2CN(c3nc4ccccc4[nH]3)CC[C@H]2C1	ZINC000450811544	CF	On-Demand	Anodyne	KCNN3	23	43
CSc1ccc2ncnc(N3CC[C@H]3C(C)C)c2c1	ZINC000450811545	CH	On-Demand	Anodyne	PDE3A	40	32
CSc1ccc2ncnc(N3CC[C@H]3C(C)C)c2c1	ZINC000450811545	CH	On-Demand	Anodyne	PDE3B	59	32
CSc1ccc2ncnc(N3CC[C@@H]3C(C)C)c2c1	ZINC000450811546	CH	On-Demand	Anodyne	PDE3A	40	32
CSc1ccc2ncnc(N3CC[C@@H]3C(C)C)c2c1	ZINC000450811546	CH	On-Demand	Anodyne	PDE3B	59	32
COCc1cc(NCCc2cc(C)ccc2F)n2ncnc2n1	ZINC000450811560	DE	On-Demand	Anodyne	DHOD	0	40
CC[C@H]1C(=O)N(CC)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450811561	FD	On-Demand	Anodyne	THYX_PBCV1	0	42
CC[C@@H]1C(=O)N(CC)CCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450811562	FD	On-Demand	Anodyne	THYX_PBCV1	0	42
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	LTA4H	38	41
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	HRH3	17	41
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	MMP13	38	47
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	MMP2	26	47
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	PLA2G4B	103	42
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	FAAH	24	41
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	MMP9	27	47
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	MMP12	20	47
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	ACR	25	41
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	MMP1	21	42
CC(=O)CCCCCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450811568	EI	On-Demand	Anodyne	NAMPT	31	41
Cc1ccn(CC(=O)Nc2cc3c(cc2F)NC(=O)CC3)n1	ZINC000450811570	DD	On-Demand	Anodyne	PKM	40	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	ZINC000450811574	GG	On-Demand	Anodyne	PKM	34	40
Cc1nccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450811585	CF	On-Demand	Anodyne	DRD2	0	41
Cc1nccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450811585	CF	On-Demand	Anodyne	SIGMAR1	23	40
Cc1nccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450811585	CF	On-Demand	Anodyne	SORD	41	32
Cc1nccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450811586	CF	On-Demand	Anodyne	DRD2	0	41
Cc1nccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450811586	CF	On-Demand	Anodyne	SIGMAR1	23	40
Cc1nccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450811586	CF	On-Demand	Anodyne	SORD	41	32
O=C1NCCN(C(=O)[C@@H](O)C2CCC2)[C@@H]1Cc1ccccc1	ZINC000450811587	DC	On-Demand	Anodyne	GALR1	49	35
O=C1NCCN(C(=O)[C@@H](O)C2CCC2)[C@@H]1Cc1ccccc1	ZINC000450811587	DC	On-Demand	Anodyne	GHRL	45	34
O=C1NCCN(C(=O)[C@@H](O)C2CCC2)[C@H]1Cc1ccccc1	ZINC000450811588	DC	On-Demand	Anodyne	GALR1	49	35
O=C1NCCN(C(=O)[C@@H](O)C2CCC2)[C@H]1Cc1ccccc1	ZINC000450811588	DC	On-Demand	Anodyne	GHRL	45	34
O=C1NCCN(C(=O)[C@H](O)C2CCC2)[C@@H]1Cc1ccccc1	ZINC000450811589	DC	On-Demand	Anodyne	GALR1	49	35
O=C1NCCN(C(=O)[C@H](O)C2CCC2)[C@@H]1Cc1ccccc1	ZINC000450811589	DC	On-Demand	Anodyne	GHRL	45	34
O=C1NCCN(C(=O)[C@H](O)C2CCC2)[C@H]1Cc1ccccc1	ZINC000450811590	DC	On-Demand	Anodyne	GALR1	49	35
O=C1NCCN(C(=O)[C@H](O)C2CCC2)[C@H]1Cc1ccccc1	ZINC000450811590	DC	On-Demand	Anodyne	GHRL	45	34
COC(=O)CNC(=O)c1ccc(NCCc2cc(C)ccc2F)c([N+](=O)[O-])c1	ZINC000450811591	GF	On-Demand	Bother	TAAR1	16	43
C[C@H]1CN(Cc2ccccc2)CCN(c2nccn(C3CC3)c2=O)C1	ZINC000450811598	EF	On-Demand	Anodyne	DRD3	0	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2nccn(C3CC3)c2=O)C1	ZINC000450811599	EF	On-Demand	Anodyne	DRD3	0	41
Cc1cnccc1CNC(=O)C(CC(C)C)CC(C)C	ZINC000450811603	CH	On-Demand	Anodyne	ANPEP	37	44
CC[C@@]1(O)CCN(C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000450811614	CE	On-Demand	Anodyne	GPR88	0	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000450811619	FE	On-Demand	Bother	CXCR3	22	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000450811620	FE	On-Demand	Bother	CXCR3	22	42
CCCOc1cccc(CSc2nnc(C(C)(C)C)o2)c1	ZINC000450811632	DI	On-Demand	Anodyne	TERT	0	40
Cc1ccc([N+](=O)[O-])cc1OCCC(C)(F)F	ZINC000450811647	BG	On-Demand	Bother	CYP19A1	17	44
Cc1ccc([N+](=O)[O-])cc1OCCC(C)(F)F	ZINC000450811647	BG	On-Demand	Bother	S1PR4	0	44
COC(=O)[C@@H]1[C@H](O)CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450811672	ED	On-Demand	Anodyne	PREP	47	34
COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450811673	ED	On-Demand	Anodyne	PREP	47	34
COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450811674	ED	On-Demand	Anodyne	PREP	47	34
COC(=O)[C@H]1[C@@H](O)CCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450811675	ED	On-Demand	Anodyne	PREP	47	34
COCCN(Cc1cccnc1)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450811681	DF	On-Demand	Anodyne	KCNA5	39	46
COCCN(Cc1cccnc1)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450811682	DF	On-Demand	Anodyne	KCNA5	39	46
COCCN(Cc1cccnc1)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450811683	DF	On-Demand	Anodyne	KCNA5	39	46
COCCN(Cc1cccnc1)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450811684	DF	On-Demand	Anodyne	KCNA5	39	46
CS(=O)(=O)c1ccc(N2CCCc3ccccc3CC2)c(F)c1	ZINC000450811689	EG	On-Demand	Anodyne	SLC6A9	33	55
COc1ccc(CNC(=O)CCN(CCO)C2CCOCC2)c(OC)c1	ZINC000450811690	FD	On-Demand	Anodyne	MTNR1A	43	40
COCCN(Cc1cccnc1)Cc1ccc(Cl)c(OC)c1	ZINC000450811691	DG	On-Demand	Anodyne	NR1D1	48	43
CC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)cc1	ZINC000450811711	FH	On-Demand	Anodyne	P2RY12	19	45
CC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)cc1	ZINC000450811711	FH	On-Demand	Anodyne	PDGFRB	52	36
CC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)cc1	ZINC000450811711	FH	On-Demand	Anodyne	ABCC1	51	36
CC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)cc1	ZINC000450811711	FH	On-Demand	Anodyne	AKT1	29	41
CC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)cc1	ZINC000450811711	FH	On-Demand	Anodyne	SIRT3	51	35
CCOC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)nc1	ZINC000450811716	GF	On-Demand	Anodyne	P2RY12	51	42
CCOC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)nc1	ZINC000450811716	GF	On-Demand	Anodyne	PDGFRB	44	47
CCOC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)nc1	ZINC000450811716	GF	On-Demand	Anodyne	SIRT3	71	34
CCOC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)nc1	ZINC000450811716	GF	On-Demand	Anodyne	SIRT2	55	34
CCOC(=O)c1ccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)nc1	ZINC000450811716	GF	On-Demand	Anodyne	SIRT1	45	34
c1ccc2c(c1)CCCN(c1ccnc(C3CC3)n1)CC2	ZINC000450811747	CG	On-Demand	Anodyne	SORD	42	34
COC[C@H](C)n1ccc(NC(=O)c2cc(OC)c(OC)cc2Br)n1	ZINC000450811761	GF	On-Demand	Anodyne	GCK	31	42
COC[C@@H](C)n1ccc(NC(=O)c2cc(OC)c(OC)cc2Br)n1	ZINC000450811762	GF	On-Demand	Anodyne	GCK	31	42
CCOC(=O)c1ccc(CN2CCCN(C(=O)C3CC3)CC2)nc1	ZINC000450811809	ED	On-Demand	Anodyne	SSTR5	41	34
C[C@@]1(CO)CCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450811813	CD	On-Demand	Anodyne	TIMP3	42	33
C[C@@]1(CO)CCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450811814	CD	On-Demand	Anodyne	TIMP3	42	33
N#Cc1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1	ZINC000450811820	CD	On-Demand	Mild	SMO	16	42
N#Cc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1	ZINC000450811821	CD	On-Demand	Mild	SMO	16	42
N#Cc1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1	ZINC000450811823	CD	On-Demand	Mild	SMO	16	42
N#Cc1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1	ZINC000450811825	CD	On-Demand	Mild	SMO	16	42
CCS(=O)(=O)C1CN(c2cc(C(F)(F)F)nc3ncnn23)C1	ZINC000450811846	EC	On-Demand	Anodyne	DHOD	0	40
C[C@@H](NCc1ccc([C@@H](C)C(F)(F)F)cc1)c1nc2ccccc2n1C(F)F	ZINC000450811850	GK	On-Demand	Anodyne	ALOX5AP	39	44
C[C@H](NCc1ccc([C@@H](C)C(F)(F)F)cc1)c1nc2ccccc2n1C(F)F	ZINC000450811855	GK	On-Demand	Anodyne	ALOX5AP	39	44
C[C@@H](c1ccc(CN[C@H](C)c2nc3ccccc3n2C(F)F)cc1)C(F)(F)F	ZINC000450811858	GK	On-Demand	Anodyne	ALOX5AP	39	44
C[C@H](NCc1ccc([C@H](C)C(F)(F)F)cc1)c1nc2ccccc2n1C(F)F	ZINC000450811860	GK	On-Demand	Anodyne	ALOX5AP	39	44
COC[C@H](C)n1ccc(NC(=O)c2ccc(Oc3ccc(OC)cc3)cn2)n1	ZINC000450811874	GF	On-Demand	Anodyne	GCK	46	48
COC[C@H](C)n1ccc(NC(=O)c2ccc(Oc3ccc(OC)cc3)cn2)n1	ZINC000450811874	GF	On-Demand	Anodyne	NPBWR1	44	32
COC[C@@H](C)n1ccc(NC(=O)c2ccc(Oc3ccc(OC)cc3)cn2)n1	ZINC000450811876	GF	On-Demand	Anodyne	GCK	46	48
COC[C@@H](C)n1ccc(NC(=O)c2ccc(Oc3ccc(OC)cc3)cn2)n1	ZINC000450811876	GF	On-Demand	Anodyne	NPBWR1	44	32
COC[C@@H](C)n1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)n1	ZINC000450811890	EE	On-Demand	Anodyne	IMDH_CRYPV	17	43
COc1cccc(OCCC(=O)N[C@]2(C)CCO[C@H]2C)c1	ZINC000450811895	CE	On-Demand	Anodyne	MTNR1A	35	44
COC[C@H](C)n1ccc(NC(=O)Cc2ccc(Cl)c(OC)c2)n1	ZINC000450811896	EE	On-Demand	Anodyne	IMDH_CRYPV	17	43
COc1cccc(OCCC(=O)N[C@@]2(C)CCO[C@H]2C)c1	ZINC000450811898	CE	On-Demand	Anodyne	MTNR1A	35	44
COc1cccc(OCCC(=O)N[C@]2(C)CCO[C@@H]2C)c1	ZINC000450811899	CE	On-Demand	Anodyne	MTNR1A	35	44
COc1cccc(OCCC(=O)N[C@@]2(C)CCO[C@@H]2C)c1	ZINC000450811900	CE	On-Demand	Anodyne	MTNR1A	35	44
O=C(Nc1nncs1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1	ZINC000450811901	FE	On-Demand	Anodyne	HDAC1	25	40
O=C(Nc1nncs1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1	ZINC000450811903	FE	On-Demand	Anodyne	HDAC1	25	40
O=C(Nc1nncs1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1	ZINC000450811905	FE	On-Demand	Anodyne	HDAC1	25	40
FC(F)(F)c1ccc(N2CCCc3ccccc3CC2)nn1	ZINC000450811907	DG	On-Demand	Anodyne	SCD1	22	40
O=C(Nc1nncs1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1	ZINC000450811908	FE	On-Demand	Anodyne	HDAC1	25	40
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	DRD4	44	39
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	ACHE	23	48
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	HRH1	0	42
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	OPRK1	47	41
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	AVPR1B	44	36
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	HTR4	55	36
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	SIGMAR1	29	40
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	SSTR5	61	44
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	CCR3	28	41
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	MCHR1	30	43
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	NOX1	49	35
COc1cc(CN2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450811918	DF	On-Demand	Anodyne	NOX5	46	35
COC[C@@H](C)n1ccc(=NC(=O)Cc2ccc(O)c(OC)c2)[nH]1	ZINC000450811921	DD	On-Demand	Anodyne	TRPV1	0	41
COC[C@H](C)n1ccc(=NC(=O)Cc2ccc(O)c(OC)c2)[nH]1	ZINC000450811922	DD	On-Demand	Anodyne	TRPV1	0	41
CCS(=O)(=O)c1ccc(Cn2cc([N+](=O)[O-])cc(C(=O)OC)c2=O)cc1	ZINC000450811925	GD	On-Demand	Bother	CACNA1D	41	32
CCS(=O)(=O)c1ccc(Cn2cc([N+](=O)[O-])cc(C(=O)OC)c2=O)cc1	ZINC000450811925	GD	On-Demand	Bother	RORC	56	33
COCCN1C(=O)CCc2cc(NC(=O)CC3CC(F)(F)C3)ccc21	ZINC000450811981	FF	On-Demand	Anodyne	NAMPT	25	45
CC[C@]1(O)CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450811982	DG	On-Demand	Anodyne	CACNA1B	40	43
CC[C@@]1(O)CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450811983	DG	On-Demand	Anodyne	CACNA1B	40	43
NS(=O)(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450811986	FE	On-Demand	Bother	CA14	15	43
Cc1ccc(F)c(CC(=O)NCc2ccncc2C)c1	ZINC000450811990	CF	On-Demand	Anodyne	P2RX7	33	43
CCC(=O)C1(C(=O)Nc2cc3c(cc2F)NC(=O)CC3)CC1	ZINC000450812006	DE	On-Demand	Anodyne	PKM	36	41
CC[C@]1(O)CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450812008	FG	On-Demand	Anodyne	PDGFRB	15	41
CC[C@]1(O)CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450812008	FG	On-Demand	Anodyne	HPGD	60	69
CC[C@@]1(O)CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450812009	FG	On-Demand	Anodyne	PDGFRB	15	41
CC[C@@]1(O)CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450812009	FG	On-Demand	Anodyne	HPGD	60	69
Cc1cnccc1CNC(=O)CCc1cccc(F)c1Br	ZINC000450812013	FH	On-Demand	Anodyne	P2RX7	32	41
Cc1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450812020	EG	On-Demand	Bother	SGPL1	0	40
Cc1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450812021	EG	On-Demand	Bother	SGPL1	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc3nncn3n2)C1	ZINC000450812028	DE	On-Demand	Anodyne	SIGMAR1	20	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc3nncn3n2)C1	ZINC000450812029	DE	On-Demand	Anodyne	SIGMAR1	20	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812049	EH	On-Demand	Mild	DRD4	43	38
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812049	EH	On-Demand	Mild	SIGMAR1	21	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812049	EH	On-Demand	Mild	CXCR3	35	48
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812049	EH	On-Demand	Mild	SGPL1	0	48
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812049	EH	On-Demand	Mild	SMO	22	47
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812050	EH	On-Demand	Mild	DRD4	43	38
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812050	EH	On-Demand	Mild	SIGMAR1	21	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812050	EH	On-Demand	Mild	CXCR3	35	48
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812050	EH	On-Demand	Mild	SGPL1	0	48
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450812050	EH	On-Demand	Mild	SMO	22	47
COC[C@@H](C)n1ccc(NC(=O)c2cccc(SC)c2)n1	ZINC000450812073	DE	On-Demand	Anodyne	GCK	37	44
COC[C@H](C)n1ccc(NC(=O)c2cccc(SC)c2)n1	ZINC000450812074	DE	On-Demand	Anodyne	GCK	37	44
COCCO[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450812075	EE	On-Demand	Anodyne	SIGMAR1	25	46
COCCO[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450812076	EE	On-Demand	Anodyne	SIGMAR1	25	46
COC(=O)[C@@H](NCC/C=C/c1ccccc1)C1CC1	ZINC000450812087	CF	On-Demand	Anodyne	CACNA1B	46	35
COC(=O)[C@H](NCC/C=C/c1ccccc1)C1CC1	ZINC000450812088	CF	On-Demand	Anodyne	CACNA1B	46	35
COC(=O)[C@H](NCC/C=C\c1ccccc1)C1CC1	ZINC000450812089	CF	On-Demand	Anodyne	CACNA1B	46	35
COC(=O)[C@@H](NCC/C=C\c1ccccc1)C1CC1	ZINC000450812090	CF	On-Demand	Anodyne	CACNA1B	46	35
COC[C@@H](C)n1ccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)n1	ZINC000450812092	GE	On-Demand	Anodyne	GCK	41	42
COC[C@H](C)n1ccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)n1	ZINC000450812093	GE	On-Demand	Anodyne	GCK	41	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCC[C@@H]1CCO	ZINC000450812104	EE	On-Demand	Anodyne	CAPN2	40	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCC[C@@H]1CCO	ZINC000450812105	EE	On-Demand	Anodyne	CAPN2	40	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCC[C@H]1CCO	ZINC000450812106	EE	On-Demand	Anodyne	CAPN2	40	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCC[C@H]1CCO	ZINC000450812107	EE	On-Demand	Anodyne	CAPN2	40	34
COC[C@@H](C)n1ccc(NC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])n1	ZINC000450812123	FD	On-Demand	Bother	GCK	25	42
COC[C@H](C)n1ccc(NC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])n1	ZINC000450812124	FD	On-Demand	Bother	GCK	25	42
O=C(N[C@@H]1CCC[C@@H]1CCO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450812133	FG	On-Demand	Anodyne	PYGL	52	39
O=C(N[C@H]1CCC[C@H]1CCO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450812134	FG	On-Demand	Anodyne	PYGL	52	39
O=C(N[C@@H]1CCC[C@H]1CCO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450812135	FG	On-Demand	Anodyne	PYGL	52	39
O=C(N[C@H]1CCC[C@@H]1CCO)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450812136	FG	On-Demand	Anodyne	PYGL	52	39
COCCOC[C@@H](O)CN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450812145	FD	On-Demand	Anodyne	ACOX1	63	32
COCCOC[C@@H](O)CN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450812145	FD	On-Demand	Anodyne	HSP90AB1	38	40
COCCOC[C@@H](O)CN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450812145	FD	On-Demand	Anodyne	SIRT3	42	33
COCCOC[C@H](O)CN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450812146	FD	On-Demand	Anodyne	ACOX1	63	32
COCCOC[C@H](O)CN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450812146	FD	On-Demand	Anodyne	HSP90AB1	38	40
COCCOC[C@H](O)CN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450812146	FD	On-Demand	Anodyne	SIRT3	42	33
C[C@H]1OCC[C@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450812192	CD	On-Demand	Anodyne	HPGDS	16	42
C[C@H]1OCC[C@@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450812193	CD	On-Demand	Anodyne	HPGDS	16	42
C[C@@H]1OCC[C@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450812194	CD	On-Demand	Anodyne	HPGDS	16	42
C[C@@H]1OCC[C@@]1(C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450812195	CD	On-Demand	Anodyne	HPGDS	16	42
Cc1ccc2oc(N3CC[C@@H]3C(C)C)nc2c1	ZINC000450812200	BG	On-Demand	Anodyne	HTR3A	24	64
Cc1ccc2oc(N3CC[C@@H]3C(C)C)nc2c1	ZINC000450812200	BG	On-Demand	Anodyne	CHRNA7	16	47
Cc1ccc2oc(N3CC[C@H]3C(C)C)nc2c1	ZINC000450812201	BG	On-Demand	Anodyne	HTR3A	24	64
Cc1ccc2oc(N3CC[C@H]3C(C)C)nc2c1	ZINC000450812201	BG	On-Demand	Anodyne	CHRNA7	16	47
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450812211	FI	On-Demand	Anodyne	COLA	61	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450812211	FI	On-Demand	Anodyne	CPT1A	60	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450812212	FI	On-Demand	Anodyne	COLA	61	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450812212	FI	On-Demand	Anodyne	CPT1A	60	38
Cc1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1	ZINC000450812225	BD	On-Demand	Anodyne	GPR119	25	42
Cc1cnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1	ZINC000450812226	BD	On-Demand	Anodyne	GPR119	25	42
Cc1cnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1	ZINC000450812227	BD	On-Demand	Anodyne	GPR119	25	42
Cc1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1	ZINC000450812228	BD	On-Demand	Anodyne	GPR119	25	42
c1ccc2cc(-c3nnc(SCC[C@H]4CCOC4)o3)ccc2c1	ZINC000450812263	EI	On-Demand	Anodyne	GSK3B	19	42
c1ccc2cc(-c3nnc(SCC[C@H]4CCOC4)o3)ccc2c1	ZINC000450812263	EI	On-Demand	Anodyne	GSK3A	48	42
c1ccc2cc(-c3nnc(SCC[C@H]4CCOC4)o3)ccc2c1	ZINC000450812263	EI	On-Demand	Anodyne	TERT	23	43
c1ccc2cc(-c3nnc(SCC[C@@H]4CCOC4)o3)ccc2c1	ZINC000450812264	EI	On-Demand	Anodyne	GSK3B	19	42
c1ccc2cc(-c3nnc(SCC[C@@H]4CCOC4)o3)ccc2c1	ZINC000450812264	EI	On-Demand	Anodyne	GSK3A	48	42
c1ccc2cc(-c3nnc(SCC[C@@H]4CCOC4)o3)ccc2c1	ZINC000450812264	EI	On-Demand	Anodyne	TERT	23	43
C/C=C\COc1cccc(CC(=O)N[C@H]2CCCC[C@@H]2O)c1	ZINC000450812271	DF	On-Demand	Anodyne	FAAH	15	40
CC[C@]1(O)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450812273	EG	On-Demand	Anodyne	MC4R	36	42
CC[C@]1(O)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450812273	EG	On-Demand	Anodyne	PRCP	50	38
CC[C@]1(O)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450812273	EG	On-Demand	Anodyne	MC3R	47	42
CC[C@]1(O)CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450812273	EG	On-Demand	Anodyne	MC5R	33	42
CC[C@]1(O)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450812274	EG	On-Demand	Anodyne	MC4R	36	42
CC[C@]1(O)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450812274	EG	On-Demand	Anodyne	PRCP	50	38
CC[C@]1(O)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450812274	EG	On-Demand	Anodyne	MC3R	47	42
CC[C@]1(O)CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450812274	EG	On-Demand	Anodyne	MC5R	33	42
CC[C@]1(O)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450812275	EG	On-Demand	Anodyne	MC4R	36	42
CC[C@]1(O)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450812275	EG	On-Demand	Anodyne	PRCP	50	38
CC[C@]1(O)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450812275	EG	On-Demand	Anodyne	MC3R	47	42
CC[C@]1(O)CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450812275	EG	On-Demand	Anodyne	MC5R	33	42
CC[C@]1(O)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450812276	EG	On-Demand	Anodyne	MC4R	36	42
CC[C@]1(O)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450812276	EG	On-Demand	Anodyne	PRCP	50	38
CC[C@]1(O)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450812276	EG	On-Demand	Anodyne	MC3R	47	42
CC[C@]1(O)CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450812276	EG	On-Demand	Anodyne	MC5R	33	42
Cc1ccc([N+](=O)[O-])cc1OCc1nnc(C2CC2)s1	ZINC000450812277	CG	On-Demand	Bother	CYP19A1	15	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450812296	FE	On-Demand	Anodyne	SIGMAR1	16	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450812296	FE	On-Demand	Anodyne	GPR119	18	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450812296	FE	On-Demand	Anodyne	SMO	23	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450812297	FE	On-Demand	Anodyne	SIGMAR1	16	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450812297	FE	On-Demand	Anodyne	GPR119	18	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450812297	FE	On-Demand	Anodyne	SMO	23	41
Cc1nn(C)cc1CC(=O)Nc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450812304	FG	On-Demand	Anodyne	GLS	0	43
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CCCCC3(F)F)ccc21	ZINC000450812305	FG	On-Demand	Anodyne	NOS1	15	47
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3CCCCC3(F)F)ccc21	ZINC000450812305	FG	On-Demand	Anodyne	NAMPT	32	47
COCCN1C(=O)CCc2cc(NC(=O)[C@H]3CCCCC3(F)F)ccc21	ZINC000450812306	FG	On-Demand	Anodyne	NOS1	15	47
COCCN1C(=O)CCc2cc(NC(=O)[C@H]3CCCCC3(F)F)ccc21	ZINC000450812306	FG	On-Demand	Anodyne	NAMPT	32	47
COC[C@@H](C)n1ccc(=NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)[nH]1	ZINC000450812308	FG	On-Demand	Anodyne	RBP4	44	33
C[C@H]1CN(Cc2ccccc2)CCN(c2nc(O)c3ccccc3n2)C1	ZINC000450812313	EG	On-Demand	Anodyne	DRD4	27	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2nc(O)c3ccccc3n2)C1	ZINC000450812315	EG	On-Demand	Anodyne	DRD4	27	43
Oc1nc(N2CCCc3ccccc3CC2)nc2ccccc12	ZINC000450812318	DG	On-Demand	Anodyne	HTR3A	15	46
CCCOc1ccc(C(=O)N2CC[C@@](O)(CC)C2)c(OC)c1	ZINC000450812322	DE	On-Demand	Anodyne	OXTR	15	40
CCCOc1ccc(C(=O)N2CC[C@](O)(CC)C2)c(OC)c1	ZINC000450812323	DE	On-Demand	Anodyne	OXTR	15	40
Cc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n2ncnc2n1	ZINC000450812328	EE	On-Demand	Anodyne	DHOD	0	42
Cc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n2ncnc2n1	ZINC000450812329	EE	On-Demand	Anodyne	DHOD	0	42
FC1(F)CC(CSc2nnc(-c3ccc4ccccc4c3)o2)C1	ZINC000450812334	EK	On-Demand	Anodyne	GSK3B	17	40
FC1(F)CC(CSc2nnc(-c3ccc4ccccc4c3)o2)C1	ZINC000450812334	EK	On-Demand	Anodyne	GSK3A	48	40
FC1(F)CC(CSc2nnc(-c3ccc4ccccc4c3)o2)C1	ZINC000450812334	EK	On-Demand	Anodyne	ALOX15	24	45
FC1(F)CC(CSc2nnc(-c3ccc4ccccc4c3)o2)C1	ZINC000450812334	EK	On-Demand	Anodyne	TERT	23	41
CCC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450812363	EG	On-Demand	Anodyne	BIRC2	44	35
CCC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450812364	EG	On-Demand	Anodyne	BIRC2	44	35
CCC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450812366	EG	On-Demand	Anodyne	BIRC2	44	35
CCC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450812368	EG	On-Demand	Anodyne	BIRC2	44	35
CC(=O)c1cccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450812376	FH	On-Demand	Anodyne	HTR1A	22	44
CC(=O)c1cccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450812376	FH	On-Demand	Anodyne	DRD2	16	44
CC(=O)c1cccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450812376	FH	On-Demand	Anodyne	P2RY12	20	49
CC(=O)c1cccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450812376	FH	On-Demand	Anodyne	RBP4	16	44
CC(=O)c1cccc(CN2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450812376	FH	On-Demand	Anodyne	SIRT3	44	36
Cc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc(C)n1	ZINC000450812379	DG	On-Demand	Anodyne	SIGMAR1	31	40
Cc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc(C)n1	ZINC000450812381	DG	On-Demand	Anodyne	SIGMAR1	31	40
CN(C)C(=O)c1cnc(N2CCCc3ccccc3CC2)c(Cl)c1	ZINC000450812386	EG	On-Demand	Anodyne	P2RY12	28	41
Cc1cncc(-c2nc(CN3CCN(CC(C)(C)O)C[C@@H]3C)no2)c1	ZINC000450812403	ED	On-Demand	Anodyne	ACOX1	26	40
Cc1cncc(-c2nc(CN3CCN(CC(C)(C)O)C[C@H]3C)no2)c1	ZINC000450812404	ED	On-Demand	Anodyne	ACOX1	26	40
C[C@@H](O)CCSc1ncccc1[N+](=O)[O-]	ZINC000450812428	BD	On-Demand	Bother	COLA	75	36
C[C@H](O)CCSc1ncccc1[N+](=O)[O-]	ZINC000450812429	BD	On-Demand	Bother	COLA	75	36
COC(=O)CCSc1ncccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450812453	FF	On-Demand	Anodyne	HDAC1	25	42
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCCCC[C@H]1c1ncon1	ZINC000450812464	EG	On-Demand	Anodyne	COLA	47	36
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCCCC[C@@H]1c1ncon1	ZINC000450812465	EG	On-Demand	Anodyne	COLA	47	36
CCS(=O)(=O)C1CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450812474	DC	On-Demand	Anodyne	P2RY12	36	51
CCS(=O)(=O)C1CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450812474	DC	On-Demand	Anodyne	CXCR3	31	47
CCS(=O)(=O)C1CN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450812523	FF	On-Demand	Anodyne	ADRB3	32	49
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(F)c1	ZINC000450812535	EE	On-Demand	Anodyne	SLC6A9	32	45
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(F)c1	ZINC000450812536	EE	On-Demand	Anodyne	SLC6A9	32	45
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(F)c1	ZINC000450812537	EE	On-Demand	Anodyne	SLC6A9	32	45
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(F)c1	ZINC000450812538	EE	On-Demand	Anodyne	SLC6A9	32	45
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCN1CCO	ZINC000450812543	FE	On-Demand	Anodyne	PRCP	16	40
Cc1cc(C2CCN(C(=O)c3cnn4c3CCC4)CC2)ccc1Br	ZINC000450812574	GH	On-Demand	Anodyne	FASN	41	34
CCOC(=O)[C@H]1CCN(Cc2ccc(S(=O)(=O)CC)cc2)c2ccccc21	ZINC000450812578	GH	On-Demand	Anodyne	APP	40	33
CCOC(=O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)CC)cc2)c2ccccc21	ZINC000450812579	GH	On-Demand	Anodyne	APP	40	33
C[C@@H](CNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])N(C)C	ZINC000450812594	FE	On-Demand	Bother	BDKRB1	23	44
COC(=O)[C@@H]1[C@@H](O)CCCN1CCc1c(Cl)cccc1Cl	ZINC000450812609	EF	On-Demand	Anodyne	PREP	24	40
COC(=O)[C@@H]1[C@H](O)CCCN1CCc1c(Cl)cccc1Cl	ZINC000450812610	EF	On-Demand	Anodyne	PREP	24	40
COC(=O)[C@H]1[C@@H](O)CCCN1CCc1c(Cl)cccc1Cl	ZINC000450812611	EF	On-Demand	Anodyne	PREP	24	40
COC(=O)[C@H]1[C@H](O)CCCN1CCc1c(Cl)cccc1Cl	ZINC000450812612	EF	On-Demand	Anodyne	PREP	24	40
CCS(=O)(=O)c1ccc(CN(CCOC)Cc2cccnc2)cc1	ZINC000450812637	EF	On-Demand	Anodyne	NR1D1	49	43
CC(C)OC(C)(C)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	ZINC000450812662	DF	On-Demand	Anodyne	PKM	36	42
CC(C)c1nnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)s1	ZINC000450812667	EH	On-Demand	Anodyne	DRD4	19	40
CC(C)c1nnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)s1	ZINC000450812668	EH	On-Demand	Anodyne	DRD4	19	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450812679	GG	On-Demand	Anodyne	P2RY12	30	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450812679	GG	On-Demand	Anodyne	MLNR	53	37
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450812679	GG	On-Demand	Anodyne	CXCR3	43	52
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450812680	GG	On-Demand	Anodyne	P2RY12	30	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450812680	GG	On-Demand	Anodyne	MLNR	53	37
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450812680	GG	On-Demand	Anodyne	CXCR3	43	52
Cc1ccnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000450812684	EG	On-Demand	Bother	SGPL1	0	41
Cc1ccnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450812685	EG	On-Demand	Bother	SGPL1	0	41
CC(=O)c1ccc(CSc2nnc(C(C)(C)C)o2)cc1	ZINC000450812686	CH	On-Demand	Anodyne	GSK3A	38	41
C[C@H]1CN(Cc2ccccc2)CCN(c2nc3c(c(O)nc(=O)n3C)n2C)C1	ZINC000450812687	GD	On-Demand	Anodyne	DPP4	0	45
C[C@@H]1CN(Cc2ccccc2)CCN(c2nc3c(c(O)nc(=O)n3C)n2C)C1	ZINC000450812688	GD	On-Demand	Anodyne	DPP4	0	45
N#Cc1ccc(N2C[C@@H](C(=O)N[C@H]3CCCC[C@@H]3O)CC2=O)cc1Cl	ZINC000450812694	FD	On-Demand	Mild	NR3C2	28	41
Cc1ccc([N+](=O)[O-])cc1OCc1cn(C)nc1C	ZINC000450812695	CF	On-Demand	Bother	CYP19A1	0	49
Cc1ccc([N+](=O)[O-])cc1OCc1cn(C)nc1C	ZINC000450812695	CF	On-Demand	Bother	F2RL3	45	33
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1	ZINC000450812703	EH	On-Demand	Mild	HTR1A	20	45
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1	ZINC000450812703	EH	On-Demand	Mild	DRD2	28	45
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1	ZINC000450812703	EH	On-Demand	Mild	DRD4	56	41
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1	ZINC000450812703	EH	On-Demand	Mild	ACHE	20	40
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1	ZINC000450812703	EH	On-Demand	Mild	DRD3	20	41
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1	ZINC000450812704	EH	On-Demand	Mild	HTR1A	20	45
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1	ZINC000450812704	EH	On-Demand	Mild	DRD2	28	45
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1	ZINC000450812704	EH	On-Demand	Mild	DRD4	56	41
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1	ZINC000450812704	EH	On-Demand	Mild	ACHE	20	40
CC(=O)c1ccc(C#N)c(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1	ZINC000450812704	EH	On-Demand	Mild	DRD3	20	41
Cc1ccnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450812711	CF	On-Demand	Anodyne	SLC6A7	0	43
Cc1ccnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450812712	CF	On-Demand	Anodyne	SLC6A7	0	43
CC[C@]1(O)CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450812721	EF	On-Demand	Anodyne	CCR8	39	46
CC[C@@]1(O)CCN(C(=O)c2ccc(Oc3ccccc3OC)cn2)C1	ZINC000450812722	EF	On-Demand	Anodyne	CCR8	39	46
Cc1ccc(F)c(CCNc2cc(N3CCC[C@H](CO)C3)ncn2)c1	ZINC000450812730	EF	On-Demand	Anodyne	PRCP	0	46
Cc1ccc(F)c(CCNc2cc(N3CCC[C@@H](CO)C3)ncn2)c1	ZINC000450812731	EF	On-Demand	Anodyne	PRCP	0	46
COCCN1C(=O)CCc2cc(NC(=O)c3cccc4c3O[C@@H](C)C4)ccc21	ZINC000450812749	GG	On-Demand	Anodyne	MTTP	65	34
COCCN1C(=O)CCc2cc(NC(=O)c3cccc4c3O[C@@H](C)C4)ccc21	ZINC000450812749	GG	On-Demand	Anodyne	NAMPT	28	44
COCCN1C(=O)CCc2cc(NC(=O)c3cccc4c3O[C@H](C)C4)ccc21	ZINC000450812750	GG	On-Demand	Anodyne	MTTP	65	34
COCCN1C(=O)CCc2cc(NC(=O)c3cccc4c3O[C@H](C)C4)ccc21	ZINC000450812750	GG	On-Demand	Anodyne	NAMPT	28	44
NC(=O)c1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)nn1	ZINC000450812757	GC	On-Demand	Anodyne	STAT6	68	38
NC(=O)c1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)nn1	ZINC000450812757	GC	On-Demand	Anodyne	HCN1	53	39
NC(=O)c1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)nn1	ZINC000450812757	GC	On-Demand	Anodyne	HCN4	46	30
O[C@@H]1CC[C@H]2CN(c3ncnc4ccsc34)CC[C@@H]2C1	ZINC000450812758	CF	On-Demand	Anodyne	SIRT3	50	33
O[C@@H]1CC[C@H]2CN(c3ncnc4ccsc34)CC[C@@H]2C1	ZINC000450812758	CF	On-Demand	Anodyne	SIRT2	51	33
O[C@@H]1CC[C@H]2CN(c3ncnc4ccsc34)CC[C@@H]2C1	ZINC000450812758	CF	On-Demand	Anodyne	SIRT1	50	33
O[C@@H]1CC[C@@H]2CN(c3ncnc4ccsc34)CC[C@@H]2C1	ZINC000450812759	CF	On-Demand	Anodyne	SIRT3	50	33
O[C@@H]1CC[C@@H]2CN(c3ncnc4ccsc34)CC[C@@H]2C1	ZINC000450812759	CF	On-Demand	Anodyne	SIRT2	51	33
O[C@@H]1CC[C@@H]2CN(c3ncnc4ccsc34)CC[C@@H]2C1	ZINC000450812759	CF	On-Demand	Anodyne	SIRT1	50	33
O[C@@H]1CC[C@@H]2CN(c3ncnc4ccsc34)CC[C@H]2C1	ZINC000450812760	CF	On-Demand	Anodyne	SIRT3	50	33
O[C@@H]1CC[C@@H]2CN(c3ncnc4ccsc34)CC[C@H]2C1	ZINC000450812760	CF	On-Demand	Anodyne	SIRT2	51	33
O[C@@H]1CC[C@@H]2CN(c3ncnc4ccsc34)CC[C@H]2C1	ZINC000450812760	CF	On-Demand	Anodyne	SIRT1	50	33
O[C@@H]1CC[C@H]2CN(c3ncnc4ccsc34)CC[C@H]2C1	ZINC000450812761	CF	On-Demand	Anodyne	SIRT3	50	33
O[C@@H]1CC[C@H]2CN(c3ncnc4ccsc34)CC[C@H]2C1	ZINC000450812761	CF	On-Demand	Anodyne	SIRT2	51	33
O[C@@H]1CC[C@H]2CN(c3ncnc4ccsc34)CC[C@H]2C1	ZINC000450812761	CF	On-Demand	Anodyne	SIRT1	50	33
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc2)cc1	ZINC000450812775	FH	On-Demand	Anodyne	PRNP	59	39
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc2)cc1	ZINC000450812775	FH	On-Demand	Anodyne	HDAC1	28	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc2)cc1	ZINC000450812775	FH	On-Demand	Anodyne	P4HTM	0	48
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc2)cc1	ZINC000450812776	FH	On-Demand	Anodyne	PRNP	59	39
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc2)cc1	ZINC000450812776	FH	On-Demand	Anodyne	HDAC1	28	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc2)cc1	ZINC000450812776	FH	On-Demand	Anodyne	P4HTM	0	48
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc2)cc1	ZINC000450812777	FH	On-Demand	Anodyne	PRNP	59	39
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc2)cc1	ZINC000450812777	FH	On-Demand	Anodyne	HDAC1	28	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc2)cc1	ZINC000450812777	FH	On-Demand	Anodyne	P4HTM	0	48
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc2)cc1	ZINC000450812778	FH	On-Demand	Anodyne	PRNP	59	39
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc2)cc1	ZINC000450812778	FH	On-Demand	Anodyne	HDAC1	28	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc2)cc1	ZINC000450812778	FH	On-Demand	Anodyne	P4HTM	0	48
N#Cc1ccnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c1	ZINC000450812787	CD	On-Demand	Mild	MAP3K12	44	31
N#Cc1ccnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c1	ZINC000450812788	CD	On-Demand	Mild	MAP3K12	44	31
N#Cc1ccnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c1	ZINC000450812789	CD	On-Demand	Mild	MAP3K12	44	31
N#Cc1ccnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c1	ZINC000450812790	CD	On-Demand	Mild	MAP3K12	44	31
O=[N+]([O-])c1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)cn1	ZINC000450812791	GF	On-Demand	Bother	STAT6	52	34
O[C@@H]1CC[C@H]2CN(c3ncnc4[nH]ccc34)CC[C@@H]2C1	ZINC000450812828	CD	On-Demand	Anodyne	AKT2	45	48
O[C@@H]1CC[C@H]2CN(c3ncnc4[nH]ccc34)CC[C@@H]2C1	ZINC000450812828	CD	On-Demand	Anodyne	JAK1	41	38
O[C@@H]1CC[C@H]2CN(c3ncnc4[nH]ccc34)CC[C@@H]2C1	ZINC000450812828	CD	On-Demand	Anodyne	AKT1	22	42
O[C@@H]1CC[C@@H]2CN(c3ncnc4[nH]ccc34)CC[C@@H]2C1	ZINC000450812829	CD	On-Demand	Anodyne	AKT2	45	48
O[C@@H]1CC[C@@H]2CN(c3ncnc4[nH]ccc34)CC[C@@H]2C1	ZINC000450812829	CD	On-Demand	Anodyne	JAK1	41	38
O[C@@H]1CC[C@@H]2CN(c3ncnc4[nH]ccc34)CC[C@@H]2C1	ZINC000450812829	CD	On-Demand	Anodyne	AKT1	22	42
O[C@@H]1CC[C@@H]2CN(c3ncnc4[nH]ccc34)CC[C@H]2C1	ZINC000450812830	CD	On-Demand	Anodyne	AKT2	45	48
O[C@@H]1CC[C@@H]2CN(c3ncnc4[nH]ccc34)CC[C@H]2C1	ZINC000450812830	CD	On-Demand	Anodyne	JAK1	41	38
O[C@@H]1CC[C@@H]2CN(c3ncnc4[nH]ccc34)CC[C@H]2C1	ZINC000450812830	CD	On-Demand	Anodyne	AKT1	22	42
O[C@@H]1CC[C@H]2CN(c3ncnc4[nH]ccc34)CC[C@H]2C1	ZINC000450812831	CD	On-Demand	Anodyne	AKT2	45	48
O[C@@H]1CC[C@H]2CN(c3ncnc4[nH]ccc34)CC[C@H]2C1	ZINC000450812831	CD	On-Demand	Anodyne	JAK1	41	38
O[C@@H]1CC[C@H]2CN(c3ncnc4[nH]ccc34)CC[C@H]2C1	ZINC000450812831	CD	On-Demand	Anodyne	AKT1	22	42
Cc1ccc(Br)cc1CC(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450812834	GH	On-Demand	Anodyne	COLA	113	41
Cc1ccc(Br)cc1CC(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450812834	GH	On-Demand	Anodyne	CPT1A	109	41
Cc1ccc(Br)cc1CC(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450812835	GH	On-Demand	Anodyne	COLA	113	41
Cc1ccc(Br)cc1CC(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450812835	GH	On-Demand	Anodyne	CPT1A	109	41
CC(C)(C)OC(=O)c1cccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)n1	ZINC000450812846	EG	On-Demand	Anodyne	HSD11B1	17	40
CC(C)(C)OC(=O)c1cccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)n1	ZINC000450812847	EG	On-Demand	Anodyne	HSD11B1	17	40
CC(C)(C)OC(=O)c1cccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)n1	ZINC000450812848	EG	On-Demand	Anodyne	HSD11B1	17	40
CC(C)(C)OC(=O)c1cccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)n1	ZINC000450812849	EG	On-Demand	Anodyne	HSD11B1	17	40
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](O)[C@H]2C(=O)OC)cc1	ZINC000450812856	EC	On-Demand	Anodyne	HRH3	0	46
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](O)[C@H]2C(=O)OC)cc1	ZINC000450812856	EC	On-Demand	Anodyne	RORC	52	33
CCS(=O)(=O)c1ccc(CN2CCC[C@H](O)[C@H]2C(=O)OC)cc1	ZINC000450812857	EC	On-Demand	Anodyne	HRH3	0	46
CCS(=O)(=O)c1ccc(CN2CCC[C@H](O)[C@H]2C(=O)OC)cc1	ZINC000450812857	EC	On-Demand	Anodyne	RORC	52	33
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](O)[C@@H]2C(=O)OC)cc1	ZINC000450812858	EC	On-Demand	Anodyne	HRH3	0	46
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](O)[C@@H]2C(=O)OC)cc1	ZINC000450812858	EC	On-Demand	Anodyne	RORC	52	33
CCS(=O)(=O)c1ccc(CN2CCC[C@H](O)[C@@H]2C(=O)OC)cc1	ZINC000450812859	EC	On-Demand	Anodyne	HRH3	0	46
CCS(=O)(=O)c1ccc(CN2CCC[C@H](O)[C@@H]2C(=O)OC)cc1	ZINC000450812859	EC	On-Demand	Anodyne	RORC	52	33
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H]3CCC[C@H]3CCO)ccc21	ZINC000450812873	GG	On-Demand	Anodyne	PLK1	42	36
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H]3CCC[C@H]3CCO)ccc21	ZINC000450812873	GG	On-Demand	Anodyne	HPGD	48	57
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H]3CCC[C@H]3CCO)ccc21	ZINC000450812873	GG	On-Demand	Anodyne	ACKR3	45	32
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H]3CCC[C@@H]3CCO)ccc21	ZINC000450812874	GG	On-Demand	Anodyne	PLK1	42	36
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H]3CCC[C@@H]3CCO)ccc21	ZINC000450812874	GG	On-Demand	Anodyne	HPGD	48	57
COc1ccccc1-n1cnc2cc(C(=O)N[C@@H]3CCC[C@@H]3CCO)ccc21	ZINC000450812874	GG	On-Demand	Anodyne	ACKR3	45	32
COc1ccccc1-n1cnc2cc(C(=O)N[C@H]3CCC[C@H]3CCO)ccc21	ZINC000450812875	GG	On-Demand	Anodyne	PLK1	42	36
COc1ccccc1-n1cnc2cc(C(=O)N[C@H]3CCC[C@H]3CCO)ccc21	ZINC000450812875	GG	On-Demand	Anodyne	HPGD	48	57
COc1ccccc1-n1cnc2cc(C(=O)N[C@H]3CCC[C@H]3CCO)ccc21	ZINC000450812875	GG	On-Demand	Anodyne	ACKR3	45	32
COc1ccccc1-n1cnc2cc(C(=O)N[C@H]3CCC[C@@H]3CCO)ccc21	ZINC000450812876	GG	On-Demand	Anodyne	PLK1	42	36
COc1ccccc1-n1cnc2cc(C(=O)N[C@H]3CCC[C@@H]3CCO)ccc21	ZINC000450812876	GG	On-Demand	Anodyne	HPGD	48	57
COc1ccccc1-n1cnc2cc(C(=O)N[C@H]3CCC[C@@H]3CCO)ccc21	ZINC000450812876	GG	On-Demand	Anodyne	ACKR3	45	32
COc1cc(CSC)ccc1Cl	ZINC000450812880	BG	On-Demand	Anodyne	TTR	0	40
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	HTR1A	16	51
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	DRD2	34	52
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	DRD1	25	48
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	DRD4	24	49
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	HTR2A	29	49
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	HTR2C	17	47
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	DRD3	27	49
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	ERG2	20	42
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	HTR7	25	42
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	SLC18A3	0	45
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	CYP2J2	50	36
COCc1noc(CN2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450812899	GE	On-Demand	Anodyne	AP2S1	0	42
FC(F)(F)c1cc(N2CCCc3ccccc3CC2)n2ncnc2n1	ZINC000450812911	EG	On-Demand	Anodyne	DHOD	0	47
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	THRA	0	40
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	DRD2	36	44
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	DRD1	26	47
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	DRD4	0	51
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	HRH2	0	45
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	HTR2A	35	52
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	HTR2C	28	58
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	SLC6A1	50	36
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	CCR3	33	40
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	SLC18A3	0	45
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	HTR3B	0	47
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	CYP2J2	58	41
COCCO[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812916	DF	On-Demand	Anodyne	AP2S1	0	44
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	THRA	0	40
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	DRD2	36	44
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	DRD1	26	47
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	DRD4	0	51
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	HRH2	0	45
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	HTR2A	35	52
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	HTR2C	28	58
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	SLC6A1	50	36
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	CCR3	33	40
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	SLC18A3	0	45
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	HTR3B	0	47
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	CYP2J2	58	41
COCCO[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450812917	DF	On-Demand	Anodyne	AP2S1	0	44
COCCN(Cc1cccnc1)Cc1cc(Br)ccc1C	ZINC000450812933	EH	On-Demand	Anodyne	NR1D1	44	40
C[C@H]1CN(Cc2ccccc2)CCN(c2cnn(C)c(=O)c2Br)C1	ZINC000450812958	GF	On-Demand	Anodyne	DRD2	19	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnn(C)c(=O)c2Br)C1	ZINC000450812959	GF	On-Demand	Anodyne	DRD2	19	40
CO[C@@H](CSc1cccs1)Cc1ccccc1	ZINC000450812965	CI	On-Demand	Anodyne	VM1B1_BOTAS	0	43
CO[C@H](CSc1cccs1)Cc1ccccc1	ZINC000450812966	CI	On-Demand	Anodyne	VM1B1_BOTAS	0	43
COc1cccc(OCCC(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c1	ZINC000450812967	GH	On-Demand	Anodyne	MTNR1A	17	40
COc1cccc(OCCC(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)c1	ZINC000450812967	GH	On-Demand	Anodyne	MTNR1B	22	41
Cc1ccc([N+](=O)[O-])cc1OCc1ccn(CC(F)(F)F)n1	ZINC000450812974	DG	On-Demand	Bother	CYP19A1	15	40
CC[C@]1(O)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450813000	EG	On-Demand	Anodyne	HDAC8	31	40
CC[C@]1(O)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450813000	EG	On-Demand	Anodyne	HDAC6	22	40
CC[C@]1(O)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450813000	EG	On-Demand	Anodyne	IMDH_CRYPV	29	46
CC[C@@]1(O)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450813001	EG	On-Demand	Anodyne	HDAC8	31	40
CC[C@@]1(O)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450813001	EG	On-Demand	Anodyne	HDAC6	22	40
CC[C@@]1(O)CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450813001	EG	On-Demand	Anodyne	IMDH_CRYPV	29	46
COc1cccc(-n2cc(C(=O)NC[C@@H]3CCC(C)(C)O3)nn2)c1	ZINC000450813005	ED	On-Demand	Anodyne	DRD4	42	34
COc1cccc(-n2cc(C(=O)NC[C@H]3CCC(C)(C)O3)nn2)c1	ZINC000450813006	ED	On-Demand	Anodyne	DRD4	42	34
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450813013	DF	On-Demand	Anodyne	NPPA	41	33
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000450813014	DF	On-Demand	Anodyne	NPPA	41	33
C[C@H]1CN(Cc2ccccc2)CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450813018	DE	On-Demand	Anodyne	DRD4	48	36
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450813019	DE	On-Demand	Anodyne	DRD4	48	36
Cc1cnccc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450813024	CG	On-Demand	Anodyne	DRD2	0	41
Cc1cnccc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450813024	CG	On-Demand	Anodyne	DRD3	0	41
Cc1cnccc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450813025	CG	On-Demand	Anodyne	DRD2	0	41
Cc1cnccc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450813025	CG	On-Demand	Anodyne	DRD3	0	41
COc1cc(CSc2nnc(C(C)(C)C)o2)ccc1Cl	ZINC000450813034	DI	On-Demand	Anodyne	GSK3B	15	46
COc1cc(CSc2nnc(C(C)(C)C)o2)ccc1Cl	ZINC000450813034	DI	On-Demand	Anodyne	GSK3A	40	39
COc1cc(CSc2nnc(C(C)(C)C)o2)ccc1Cl	ZINC000450813034	DI	On-Demand	Anodyne	TERT	0	40
CO[C@H](COc1ccc([N+](=O)[O-])cc1F)Cc1ccccc1	ZINC000450813044	DG	On-Demand	Bother	F2RL3	47	35
CO[C@@H](COc1ccc([N+](=O)[O-])cc1F)Cc1ccccc1	ZINC000450813045	DG	On-Demand	Bother	F2RL3	47	35
CC1(C)CC[C@@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)O1	ZINC000450813046	EF	On-Demand	Bother	CACNA1D	49	32
CC1(C)CC[C@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)O1	ZINC000450813047	EF	On-Demand	Bother	CACNA1D	49	32
CC(C)[C@H]1CCN1c1nc2ccccc2s1	ZINC000450813065	BH	On-Demand	Anodyne	SLC11A2	24	41
CC(C)[C@@H]1CCN1c1nc2ccccc2s1	ZINC000450813066	BH	On-Demand	Anodyne	SLC11A2	24	41
CC(C)c1ccc2c(c1)[C@@H](NC(=O)CCc1ccc(C(N)=O)cc1)CC2	ZINC000450813092	FH	On-Demand	Anodyne	LUXR	45	36
CC(C)c1ccc2c(c1)[C@H](NC(=O)CCc1ccc(C(N)=O)cc1)CC2	ZINC000450813093	FH	On-Demand	Anodyne	LUXR	45	36
CCS(=O)(=O)c1ccc(CN(C)CC2(c3ccccc3)CC2)cc1	ZINC000450813106	EH	On-Demand	Anodyne	RORC	20	40
COC(=O)C1(CN2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)CC1	ZINC000450813113	EH	On-Demand	Anodyne	COLA	101	37
COC(=O)C1(CN2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)CC1	ZINC000450813113	EH	On-Demand	Anodyne	CPT1A	98	37
COC(=O)C1(CN2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)CC1	ZINC000450813114	EH	On-Demand	Anodyne	COLA	101	37
COC(=O)C1(CN2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)CC1	ZINC000450813114	EH	On-Demand	Anodyne	CPT1A	98	37
CCOC(=O)c1ccnc(N2CC(S(=O)(=O)CC)C2)c1[N+](=O)[O-]	ZINC000450813120	EC	On-Demand	Bother	P2RY12	30	40
CCS(=O)(=O)c1ccc(CN2CCCN(C(=O)C3CC3)CC2)cc1	ZINC000450813173	FD	On-Demand	Anodyne	HRH3	31	41
CCS(=O)(=O)c1ccc(CN2CCCN(C(=O)C3CC3)CC2)cc1	ZINC000450813173	FD	On-Demand	Anodyne	SIGMAR1	20	44
O[C@@H]1CC[C@H]2CN(c3nc(-c4cccc(Cl)c4)no3)CC[C@H]2C1	ZINC000450813176	EG	On-Demand	Anodyne	GRM5	28	46
O[C@@H]1CC[C@@H]2CN(c3nc(-c4cccc(Cl)c4)no3)CC[C@H]2C1	ZINC000450813177	EG	On-Demand	Anodyne	GRM5	28	46
O[C@@H]1CC[C@H]2CN(c3nc(-c4cccc(Cl)c4)no3)CC[C@@H]2C1	ZINC000450813178	EG	On-Demand	Anodyne	GRM5	28	46
O[C@@H]1CC[C@@H]2CN(c3nc(-c4cccc(Cl)c4)no3)CC[C@@H]2C1	ZINC000450813179	EG	On-Demand	Anodyne	GRM5	28	46
CNC(=O)c1ccc(N2CC[C@@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000450813203	CE	On-Demand	Bother	TAAR1	19	42
CNC(=O)c1ccc(N2CC[C@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000450813205	CE	On-Demand	Bother	TAAR1	19	42
COCCO[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450813223	CF	On-Demand	Anodyne	SLC6A1	51	34
COCCO[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450813225	CF	On-Demand	Anodyne	SLC6A1	51	34
COCCO[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450813227	CF	On-Demand	Anodyne	SLC6A1	51	34
COCCO[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450813229	CF	On-Demand	Anodyne	SLC6A1	51	34
COC(=O)c1ccoc1CN1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450813274	FI	On-Demand	Anodyne	COLA	65	35
COC(=O)c1ccoc1CN1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450813274	FI	On-Demand	Anodyne	CPT1A	63	35
COC(=O)c1ccoc1CN1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450813275	FI	On-Demand	Anodyne	COLA	65	35
COC(=O)c1ccoc1CN1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450813275	FI	On-Demand	Anodyne	CPT1A	63	35
Cc1cc(N2CCCc3ccccc3CC2)n2ncnc2n1	ZINC000450813279	CE	On-Demand	Anodyne	DHOD	0	51
CNC(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450813281	EF	On-Demand	Bother	AVPR2	26	45
CNC(=O)c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1	ZINC000450813281	EF	On-Demand	Bother	TAAR1	33	46
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(Cl)cn2)C1	ZINC000450813282	DG	On-Demand	Anodyne	DRD2	22	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(Cl)cn2)C1	ZINC000450813282	DG	On-Demand	Anodyne	DRD3	24	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(Cl)cn2)C1	ZINC000450813282	DG	On-Demand	Anodyne	SIGMAR1	37	44
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(Cl)cn2)C1	ZINC000450813284	DG	On-Demand	Anodyne	DRD2	22	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(Cl)cn2)C1	ZINC000450813284	DG	On-Demand	Anodyne	DRD3	24	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(Cl)cn2)C1	ZINC000450813284	DG	On-Demand	Anodyne	SIGMAR1	37	44
Cc1cnccc1CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450813285	FF	On-Demand	Mild	P2RX7	50	39
Cc1cnccc1CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450813288	FF	On-Demand	Mild	P2RX7	50	39
CC(=O)N[C@H](C(=O)Nc1nnc(Cc2ccc(Cl)cc2)s1)C(C)(C)C	ZINC000450813294	GG	On-Demand	Anodyne	MMP3	15	40
CC(=O)N[C@H](C(=O)Nc1nnc(Cc2ccc(Cl)cc2)s1)C(C)(C)C	ZINC000450813294	GG	On-Demand	Anodyne	FFAR2	31	42
Cc1nnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1C	ZINC000450813301	DE	On-Demand	Anodyne	SIGMAR1	24	40
Cc1nnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1C	ZINC000450813303	DE	On-Demand	Anodyne	SIGMAR1	24	40
CCn1nnc(C)c1COc1cc([N+](=O)[O-])ccc1C	ZINC000450813305	CE	On-Demand	Bother	CYP19A1	15	44
CS(=O)(=O)c1cccc(OCC2CC(F)(F)C2)c1	ZINC000450813307	CF	On-Demand	Anodyne	NR1H3	48	36
CS(=O)(=O)c1cccc(OCC2CC(F)(F)C2)c1	ZINC000450813307	CF	On-Demand	Anodyne	CHRNA10	42	34
COC(=O)CCSc1ncccc1NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450813312	FG	On-Demand	Anodyne	G2YM83_BOTF4	79	43
COC(=O)CCSc1ncccc1NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450813313	FG	On-Demand	Anodyne	G2YM83_BOTF4	79	43
COc1cc(CN2CCN(C[C@@H](C)O)CC2)ccc1Cl	ZINC000450813316	CD	On-Demand	Anodyne	DRD4	28	40
COc1cc(CN2CCN(C[C@@H](C)O)CC2)ccc1Cl	ZINC000450813316	CD	On-Demand	Anodyne	SSTR5	43	36
COc1cc(CN2CCN(C[C@@H](C)O)CC2)ccc1Cl	ZINC000450813316	CD	On-Demand	Anodyne	CACNA1G	24	46
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)ccc21	ZINC000450813317	GG	On-Demand	Anodyne	DRD4	42	32
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)ccc21	ZINC000450813317	GG	On-Demand	Anodyne	NOS1	15	47
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)ccc21	ZINC000450813317	GG	On-Demand	Anodyne	NAMPT	31	47
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3C[C@H]3c3cccc(OC)c3)ccc21	ZINC000450813317	GG	On-Demand	Anodyne	BRPF1	0	41
O=C1NCCN(C(=O)CS(=O)(=O)C2CC2)[C@H]1Cc1ccccc1	ZINC000450813378	EC	On-Demand	Anodyne	GALR1	44	32
O=C1NCCN(C(=O)CS(=O)(=O)C2CC2)[C@H]1Cc1ccccc1	ZINC000450813378	EC	On-Demand	Anodyne	GHRL	43	32
O=C1NCCN(C(=O)CS(=O)(=O)C2CC2)[C@@H]1Cc1ccccc1	ZINC000450813380	EC	On-Demand	Anodyne	GALR1	44	32
O=C1NCCN(C(=O)CS(=O)(=O)C2CC2)[C@@H]1Cc1ccccc1	ZINC000450813380	EC	On-Demand	Anodyne	GHRL	43	32
C[C@H](O)CCSc1nccn1-c1ccc(C(=O)NCc2cccs2)cc1	ZINC000450813406	GH	On-Demand	Anodyne	PYGM	30	43
C[C@@H](O)CCSc1nccn1-c1ccc(C(=O)NCc2cccs2)cc1	ZINC000450813407	GH	On-Demand	Anodyne	PYGM	30	43
Cc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)ccn1	ZINC000450813408	CG	On-Demand	Anodyne	DRD2	0	43
Cc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)ccn1	ZINC000450813409	CG	On-Demand	Anodyne	DRD2	0	43
CC(=O)c1ccc(S(C)(=O)=O)c(N2CCCc3ccccc3CC2)c1	ZINC000450813410	FG	On-Demand	Anodyne	AKR1C3	48	37
O=C(CC1CC(F)(F)C1)Nc1nnc(Cc2ccc(Cl)cc2)s1	ZINC000450813411	FI	On-Demand	Anodyne	GLS	0	40
COCc1cc(NC[C@@H]2C[C@H]2C(C)C)n2ncnc2n1	ZINC000450813419	CD	On-Demand	Anodyne	DHOD	0	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813420	DF	On-Demand	Anodyne	AKT2	55	47
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813420	DF	On-Demand	Anodyne	AKT3	36	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813420	DF	On-Demand	Anodyne	JAK3	22	56
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813420	DF	On-Demand	Anodyne	ROCK2	43	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813420	DF	On-Demand	Anodyne	AKT1	25	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813420	DF	On-Demand	Anodyne	TYK2	0	56
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813420	DF	On-Demand	Anodyne	LIMK2	29	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813421	DF	On-Demand	Anodyne	AKT2	55	47
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813421	DF	On-Demand	Anodyne	AKT3	36	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813421	DF	On-Demand	Anodyne	JAK3	22	56
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813421	DF	On-Demand	Anodyne	ROCK2	43	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813421	DF	On-Demand	Anodyne	AKT1	25	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813421	DF	On-Demand	Anodyne	TYK2	0	56
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450813421	DF	On-Demand	Anodyne	LIMK2	29	42
CCOC(=O)c1nn(-c2ccccc2)cc1OCCC[C@@H](C)O	ZINC000450813422	DF	On-Demand	Anodyne	ADORA3	0	40
CCOC(=O)c1nn(-c2ccccc2)cc1OCCC[C@@H](C)O	ZINC000450813422	DF	On-Demand	Anodyne	SLC5A1	26	44
CCOC(=O)c1nn(-c2ccccc2)cc1OCCC[C@@H](C)O	ZINC000450813422	DF	On-Demand	Anodyne	SLC5A2	28	44
CCOC(=O)c1nn(-c2ccccc2)cc1OCCC[C@H](C)O	ZINC000450813423	DF	On-Demand	Anodyne	ADORA3	0	40
CCOC(=O)c1nn(-c2ccccc2)cc1OCCC[C@H](C)O	ZINC000450813423	DF	On-Demand	Anodyne	SLC5A1	26	44
CCOC(=O)c1nn(-c2ccccc2)cc1OCCC[C@H](C)O	ZINC000450813423	DF	On-Demand	Anodyne	SLC5A2	28	44
CCc1cc(NCCc2cc(C)ccc2F)n2ncnc2n1	ZINC000450813436	CF	On-Demand	Anodyne	DHOD	0	51
Fc1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)nc1	ZINC000450813452	FG	On-Demand	Anodyne	STAT6	57	32
CC(=O)N[C@H](C(=O)Nc1cc2c(cc1F)NC(=O)CC2)C(C)(C)C	ZINC000450813455	EE	On-Demand	Anodyne	PKM	33	41
COCCN1C(=O)CCc2cc(NC(=O)[C@@H]3Cc4cccc(C)c4O3)ccc21	ZINC000450813470	GF	On-Demand	Anodyne	NAMPT	28	45
COCCN1C(=O)CCc2cc(NC(=O)[C@H]3Cc4cccc(C)c4O3)ccc21	ZINC000450813471	GF	On-Demand	Anodyne	NAMPT	28	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1	ZINC000450813492	GH	On-Demand	Anodyne	HDAC1	28	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1	ZINC000450813492	GH	On-Demand	Anodyne	TAAR1	33	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1	ZINC000450813492	GH	On-Demand	Anodyne	DGAT1	19	42
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1	ZINC000450813493	GH	On-Demand	Anodyne	HDAC1	28	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1	ZINC000450813493	GH	On-Demand	Anodyne	TAAR1	33	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1	ZINC000450813493	GH	On-Demand	Anodyne	DGAT1	19	42
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1	ZINC000450813494	GH	On-Demand	Anodyne	HDAC1	28	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1	ZINC000450813494	GH	On-Demand	Anodyne	TAAR1	33	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1	ZINC000450813494	GH	On-Demand	Anodyne	DGAT1	19	42
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1	ZINC000450813495	GH	On-Demand	Anodyne	HDAC1	28	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1	ZINC000450813495	GH	On-Demand	Anodyne	TAAR1	33	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1	ZINC000450813495	GH	On-Demand	Anodyne	DGAT1	19	42
CS(=O)(=O)N1CC(CNC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450813510	EC	On-Demand	Anodyne	EPHX2	31	42
CS(=O)(=O)N1CC(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450813511	EC	On-Demand	Anodyne	EPHX2	31	42
C[C@H]1CN(C(=O)c2cccc3c2CCCC3)CCN1CCO	ZINC000450813512	DD	On-Demand	Anodyne	FABP4	43	35
C[C@@H]1CN(C(=O)c2cccc3c2CCCC3)CCN1CCO	ZINC000450813513	DD	On-Demand	Anodyne	FABP4	43	35
Cc1ccc2ncnc(NC[C@H](NS(=O)(=O)N(C)C)C3CCCC3)c2c1	ZINC000450813519	GD	On-Demand	Anodyne	CLK4	45	38
Cc1ccc2ncnc(NC[C@H](NS(=O)(=O)N(C)C)C3CCCC3)c2c1	ZINC000450813519	GD	On-Demand	Anodyne	CD38	48	34
Cc1ccc2ncnc(NC[C@@H](NS(=O)(=O)N(C)C)C3CCCC3)c2c1	ZINC000450813520	GD	On-Demand	Anodyne	CLK4	45	38
Cc1ccc2ncnc(NC[C@@H](NS(=O)(=O)N(C)C)C3CCCC3)c2c1	ZINC000450813520	GD	On-Demand	Anodyne	CD38	48	34
CC(C)[C@H]1CCN1c1nc2ccccc2o1	ZINC000450813527	BG	On-Demand	Anodyne	HTR3A	17	43
CC(C)[C@H]1CCN1c1nc2ccccc2o1	ZINC000450813527	BG	On-Demand	Anodyne	CHRNA7	15	40
CC(C)[C@H]1CCN1c1nc2ccccc2o1	ZINC000450813527	BG	On-Demand	Anodyne	SORD	17	45
CC(C)[C@@H]1CCN1c1nc2ccccc2o1	ZINC000450813528	BG	On-Demand	Anodyne	HTR3A	27	60
CC(C)[C@@H]1CCN1c1nc2ccccc2o1	ZINC000450813528	BG	On-Demand	Anodyne	CHRNA7	15	40
CC(C)[C@@H]1CCN1c1nc2ccccc2o1	ZINC000450813528	BG	On-Demand	Anodyne	SORD	17	45
O[C@@H]1CC[C@H]2CN(c3nnc(-c4ccccc4)s3)CC[C@@H]2C1	ZINC000450813535	DG	On-Demand	Anodyne	HRH3	15	55
O[C@@H]1CC[C@@H]2CN(c3nnc(-c4ccccc4)s3)CC[C@@H]2C1	ZINC000450813536	DG	On-Demand	Anodyne	HRH3	15	55
O[C@@H]1CC[C@@H]2CN(c3nnc(-c4ccccc4)s3)CC[C@H]2C1	ZINC000450813537	DG	On-Demand	Anodyne	HRH3	15	55
O[C@@H]1CC[C@H]2CN(c3nnc(-c4ccccc4)s3)CC[C@H]2C1	ZINC000450813538	DG	On-Demand	Anodyne	HRH3	15	55
CC[C@@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813548	EF	On-Demand	Anodyne	HTR1A	0	44
CC[C@@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813548	EF	On-Demand	Anodyne	HTR1B	30	43
CC[C@@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813548	EF	On-Demand	Anodyne	NQO2	23	46
CC[C@@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813548	EF	On-Demand	Anodyne	MPO	73	43
CC[C@@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813548	EF	On-Demand	Anodyne	MTNR1A	22	52
CC[C@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813549	EF	On-Demand	Anodyne	HTR1A	0	44
CC[C@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813549	EF	On-Demand	Anodyne	HTR1B	30	43
CC[C@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813549	EF	On-Demand	Anodyne	NQO2	23	46
CC[C@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813549	EF	On-Demand	Anodyne	MPO	73	43
CC[C@H](O)CC(=O)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450813549	EF	On-Demand	Anodyne	MTNR1A	22	52
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450813552	EG	On-Demand	Bother	GYRB	0	51
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450813553	EG	On-Demand	Bother	GYRB	0	51
c1cncc(-c2cn3nc(N4CCCc5ccccc5CC4)sc3n2)c1	ZINC000450813580	FH	On-Demand	Anodyne	CYP11B2	50	42
c1ccc2c(c1)CCCN(c1ccnc(N3CCOCC3)n1)CC2	ZINC000450813599	DE	On-Demand	Anodyne	SORD	47	39
c1ccc2c(c1)CCCN(c1ccnc(N3CCOCC3)n1)CC2	ZINC000450813599	DE	On-Demand	Anodyne	SMG1	43	34
CCOC(=O)c1ccc(CN2CC[C@H](OCCOC)C2)nc1	ZINC000450813602	DD	On-Demand	Anodyne	SSTR5	31	40
CCOC(=O)c1ccc(CN2CC[C@@H](OCCOC)C2)nc1	ZINC000450813603	DD	On-Demand	Anodyne	SSTR5	31	40
COc1cc(CN2CCN(CC(C)(C)O)C[C@H]2C)ccc1Cl	ZINC000450813609	EF	On-Demand	Anodyne	CCR1	32	40
COc1cc(CN2CCN(CC(C)(C)O)C[C@@H]2C)ccc1Cl	ZINC000450813610	EF	On-Demand	Anodyne	CCR1	32	40
Fc1ccc(N2CCCc3ccccc3CC2)nc1	ZINC000450813612	CG	On-Demand	Anodyne	SLC27A1	25	42
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCC[C@@H]1CCO	ZINC000450813615	DG	On-Demand	Anodyne	CCR2	33	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCC[C@H]1CCO	ZINC000450813616	DG	On-Demand	Anodyne	CCR2	33	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCC[C@@H]1CCO	ZINC000450813617	DG	On-Demand	Anodyne	CCR2	33	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCC[C@H]1CCO	ZINC000450813618	DG	On-Demand	Anodyne	CCR2	33	40
COC(=O)[C@@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450813648	GE	On-Demand	Anodyne	HDAC8	19	41
COC(=O)[C@@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450813648	GE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450813649	GE	On-Demand	Anodyne	HDAC8	19	41
COC(=O)[C@@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450813649	GE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450813650	GE	On-Demand	Anodyne	HDAC8	19	41
COC(=O)[C@H]1[C@H](O)CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450813650	GE	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450813651	GE	On-Demand	Anodyne	HDAC8	19	41
COC(=O)[C@H]1[C@@H](O)CCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450813651	GE	On-Demand	Anodyne	CYP2J2	49	35
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450813654	EG	On-Demand	Bother	GYRB	0	51
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450813655	EG	On-Demand	Bother	GYRB	0	51
CC[C@]1(O)CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450813665	FD	On-Demand	Mild	AR	17	41
CC[C@@]1(O)CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450813666	FD	On-Demand	Mild	AR	17	41
CC[C@@]1(O)CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450813667	FD	On-Demand	Mild	AR	17	41
CC[C@]1(O)CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450813668	FD	On-Demand	Mild	AR	17	41
Cc1cc([N+](=O)[O-])cnc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450813682	EG	On-Demand	Bother	SGPL1	0	46
Cc1cc([N+](=O)[O-])cnc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450813683	EG	On-Demand	Bother	SGPL1	0	46
CCN1CCN(C(=O)[C@@H](Cc2ccccc2)OC)[C@@H](C)C1=O	ZINC000450813706	DD	On-Demand	Anodyne	ACE	43	35
CCN1CCN(C(=O)[C@@H](Cc2ccccc2)OC)[C@@H](C)C1=O	ZINC000450813706	DD	On-Demand	Anodyne	BRCA1	44	32
CCN1CCN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](C)C1=O	ZINC000450813707	DD	On-Demand	Anodyne	ACE	43	35
CCN1CCN(C(=O)[C@H](Cc2ccccc2)OC)[C@H](C)C1=O	ZINC000450813707	DD	On-Demand	Anodyne	BRCA1	44	32
CCN1CCN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](C)C1=O	ZINC000450813708	DD	On-Demand	Anodyne	ACE	43	35
CCN1CCN(C(=O)[C@@H](Cc2ccccc2)OC)[C@H](C)C1=O	ZINC000450813708	DD	On-Demand	Anodyne	BRCA1	44	32
CCN1CCN(C(=O)[C@H](Cc2ccccc2)OC)[C@@H](C)C1=O	ZINC000450813710	DD	On-Demand	Anodyne	ACE	43	35
CCN1CCN(C(=O)[C@H](Cc2ccccc2)OC)[C@@H](C)C1=O	ZINC000450813710	DD	On-Demand	Anodyne	BRCA1	44	32
CCS(=O)(=O)c1ccccc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450813724	FG	On-Demand	Anodyne	DRD2	17	43
CCS(=O)(=O)c1ccccc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450813724	FG	On-Demand	Anodyne	DRD4	39	43
CCS(=O)(=O)c1ccccc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450813724	FG	On-Demand	Anodyne	SIGMAR1	28	40
CCS(=O)(=O)c1ccccc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450813725	FG	On-Demand	Anodyne	DRD2	17	43
CCS(=O)(=O)c1ccccc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450813725	FG	On-Demand	Anodyne	DRD4	39	43
CCS(=O)(=O)c1ccccc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450813725	FG	On-Demand	Anodyne	SIGMAR1	28	40
CC(F)(F)CCOc1cccc(S(C)(=O)=O)c1	ZINC000450813726	CF	On-Demand	Anodyne	NR1H2	38	41
CCCc1nc(C)c(COc2ccc([N+](=O)[O-])cc2F)o1	ZINC000450813730	CH	On-Demand	Bother	S1PR4	15	53
C[C@H](Sc1nnc(C(C)(C)C)o1)C(=O)C1CCCCC1	ZINC000450813731	CH	On-Demand	Anodyne	PIP	0	42
C[C@@H](Sc1nnc(C(C)(C)C)o1)C(=O)C1CCCCC1	ZINC000450813732	CH	On-Demand	Anodyne	PIP	0	42
CCOC(=O)c1cc(C(=O)NC[C@H]2CCC(C)(C)O2)on1	ZINC000450813738	CD	On-Demand	Anodyne	GNRHR	20	40
CCOC(=O)c1cc(C(=O)NC[C@@H]2CCC(C)(C)O2)on1	ZINC000450813740	CD	On-Demand	Anodyne	GNRHR	20	40
CC(C)[C@@H]1CCN1c1nc(-c2ccccn2)nc2c1CCC2	ZINC000450813745	CG	On-Demand	Anodyne	METAP1	18	41
CC(C)[C@H]1CCN1c1nc(-c2ccccn2)nc2c1CCC2	ZINC000450813747	CG	On-Demand	Anodyne	METAP1	18	41
Cc1nnc2c3ccccc3c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nn12	ZINC000450813766	EF	On-Demand	Anodyne	CREBBP	41	33
Cc1nnc2c3ccccc3c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nn12	ZINC000450813766	EF	On-Demand	Anodyne	BRD9	52	33
Cc1nnc2c3ccccc3c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nn12	ZINC000450813768	EF	On-Demand	Anodyne	CREBBP	41	33
Cc1nnc2c3ccccc3c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nn12	ZINC000450813768	EF	On-Demand	Anodyne	BRD9	52	33
Cc1nnc2c3ccccc3c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nn12	ZINC000450813769	EF	On-Demand	Anodyne	CREBBP	41	33
Cc1nnc2c3ccccc3c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nn12	ZINC000450813769	EF	On-Demand	Anodyne	BRD9	52	33
Cc1nnc2c3ccccc3c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nn12	ZINC000450813770	EF	On-Demand	Anodyne	CREBBP	41	33
Cc1nnc2c3ccccc3c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nn12	ZINC000450813770	EF	On-Demand	Anodyne	BRD9	52	33
CCS(=O)(=O)C1CN(c2ncnc3[nH]ccc23)C1	ZINC000450813789	CC	On-Demand	Anodyne	AKT2	51	46
CCS(=O)(=O)C1CN(c2ncnc3[nH]ccc23)C1	ZINC000450813789	CC	On-Demand	Anodyne	AKT3	39	42
CCS(=O)(=O)C1CN(c2ncnc3[nH]ccc23)C1	ZINC000450813789	CC	On-Demand	Anodyne	JAK3	22	55
CCS(=O)(=O)C1CN(c2ncnc3[nH]ccc23)C1	ZINC000450813789	CC	On-Demand	Anodyne	JAK1	45	37
CCS(=O)(=O)C1CN(c2ncnc3[nH]ccc23)C1	ZINC000450813789	CC	On-Demand	Anodyne	ROCK2	44	44
CCS(=O)(=O)C1CN(c2ncnc3[nH]ccc23)C1	ZINC000450813789	CC	On-Demand	Anodyne	AKT1	24	42
CCS(=O)(=O)C1CN(c2ccc(C(F)(F)F)cn2)C1	ZINC000450813795	CD	On-Demand	Anodyne	CXCR3	30	40
COc1ccc(CC(=O)NCc2ccncc2C)c(Cl)c1OC	ZINC000450813798	EF	On-Demand	Anodyne	P2RX7	44	39
N=c1[nH]c(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)ncc1[N+](=O)[O-]	ZINC000450813800	CC	On-Demand	Bother	CHRNA3	15	42
CC1CC(C(=O)Nc2cc3c(cc2F)NC(=O)CC3)(c2cccc(Cl)c2)C1	ZINC000450813801	GJ	On-Demand	Anodyne	PKM	39	40
N=c1[nH]c(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)ncc1[N+](=O)[O-]	ZINC000450813803	CC	On-Demand	Bother	CHRNA3	15	42
N=c1[nH]c(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)ncc1[N+](=O)[O-]	ZINC000450813804	CC	On-Demand	Bother	CHRNA3	15	42
N=c1[nH]c(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)ncc1[N+](=O)[O-]	ZINC000450813806	CC	On-Demand	Bother	CHRNA3	15	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(F)cn2)C1	ZINC000450813807	DF	On-Demand	Anodyne	DRD2	0	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(F)cn2)C1	ZINC000450813807	DF	On-Demand	Anodyne	DRD4	42	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(F)cn2)C1	ZINC000450813807	DF	On-Demand	Anodyne	DRD3	0	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(F)cn2)C1	ZINC000450813807	DF	On-Demand	Anodyne	SIGMAR1	36	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(F)cn2)C1	ZINC000450813813	DF	On-Demand	Anodyne	DRD2	0	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(F)cn2)C1	ZINC000450813813	DF	On-Demand	Anodyne	DRD4	42	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(F)cn2)C1	ZINC000450813813	DF	On-Demand	Anodyne	DRD3	0	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(F)cn2)C1	ZINC000450813813	DF	On-Demand	Anodyne	SIGMAR1	36	41
Cc1cnccc1CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450813815	CH	On-Demand	Anodyne	SCN9A	0	40
Cc1cnccc1CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450813817	CH	On-Demand	Anodyne	SCN9A	0	40
Cc1cnccc1CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450813818	CH	On-Demand	Anodyne	SCN9A	0	40
Cc1cnccc1CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450813819	CH	On-Demand	Anodyne	SCN9A	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(F)cn2)C1	ZINC000450813832	CG	On-Demand	Anodyne	DRD2	0	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(F)cn2)C1	ZINC000450813834	CG	On-Demand	Anodyne	DRD2	0	43
COc1cccc(OCCC(=O)NCCCn2ccnn2)c1	ZINC000450813849	DD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)NCCCn2ccnn2)c1	ZINC000450813849	DD	On-Demand	Anodyne	HRH2	45	40
COc1cccc(OCCC(=O)NCCCn2ccnn2)c1	ZINC000450813849	DD	On-Demand	Anodyne	MTNR1A	64	41
COc1cccc(OCCC(=O)NCCCn2ccnn2)c1	ZINC000450813849	DD	On-Demand	Anodyne	MTNR1B	46	42
CCS(=O)(=O)c1ccc(N2CCCc3ccccc3CC2)cc1	ZINC000450813876	EG	On-Demand	Anodyne	AKR1C3	0	42
N#Cc1ccc(N2CCCc3ccccc3CC2)nc1	ZINC000450813894	CF	On-Demand	Mild	SMO	22	50
Cc1cc2c(N3CCN(CCc4cscn4)CC3)ncnc2s1	ZINC000450813900	EF	On-Demand	Anodyne	ABCC1	73	37
COC[C@@H](C)n1ccc(NC(=O)c2cc(Br)c(F)cc2O)n1	ZINC000450813912	FE	On-Demand	Anodyne	GCK	28	42
COC[C@H](C)n1ccc(NC(=O)c2cc(Br)c(F)cc2O)n1	ZINC000450813913	FE	On-Demand	Anodyne	GCK	28	42
Cc1ccnc(N2CCCc3ccccc3CC2)n1	ZINC000450813941	CF	On-Demand	Anodyne	SLC6A7	0	47
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4)ns3)CC[C@@H]2C1	ZINC000450813956	DG	On-Demand	Anodyne	FAAH	17	48
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4)ns3)CC[C@@H]2C1	ZINC000450813957	DG	On-Demand	Anodyne	FAAH	17	48
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4)ns3)CC[C@H]2C1	ZINC000450813958	DG	On-Demand	Anodyne	FAAH	17	48
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4)ns3)CC[C@H]2C1	ZINC000450813959	DG	On-Demand	Anodyne	FAAH	17	48
CCS(=O)(=O)C1CN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450813960	ED	On-Demand	Anodyne	PDE3A	47	37
CCS(=O)(=O)C1CN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450813960	ED	On-Demand	Anodyne	PDE3B	69	37
NC(=O)c1cncc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)n1	ZINC000450813973	GD	On-Demand	Anodyne	STAT6	67	39
CCS(=O)(=O)C1CN(c2ncnc3c(F)c(OC)ccc23)C1	ZINC000450813995	ED	On-Demand	Anodyne	PDE3A	43	34
CCS(=O)(=O)C1CN(c2ncnc3c(F)c(OC)ccc23)C1	ZINC000450813995	ED	On-Demand	Anodyne	PDE3B	64	34
CCS(=O)(=O)C1CN(c2cc(C)nc(-c3cccnc3)n2)C1	ZINC000450813996	DD	On-Demand	Anodyne	ROS1	40	42
CCS(=O)(=O)C1CN(c2ncnc3ccc(SC)cc23)C1	ZINC000450813997	DD	On-Demand	Anodyne	PDE3B	62	34
Cn1c(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc2ccccc21	ZINC000450814006	CF	On-Demand	Anodyne	HRH1	30	43
Cn1c(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc2ccccc21	ZINC000450814007	CF	On-Demand	Anodyne	HRH1	30	43
Cn1c(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc2ccccc21	ZINC000450814008	CF	On-Demand	Anodyne	HRH1	30	43
Cn1c(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc2ccccc21	ZINC000450814009	CF	On-Demand	Anodyne	HRH1	30	43
Cc1nc(NC[C@@H](NS(=O)(=O)N(C)C)C2CCCC2)ncc1[N+](=O)[O-]	ZINC000450814026	FC	On-Demand	Bother	PRKCQ	41	34
Cc1nc(NC[C@H](NS(=O)(=O)N(C)C)C2CCCC2)ncc1[N+](=O)[O-]	ZINC000450814027	FC	On-Demand	Bother	PRKCQ	41	34
Fc1cccnc1NCC1(N2CCN(c3ccccc3)CC2)CCOCC1	ZINC000450814040	FG	On-Demand	Anodyne	STAT6	43	34
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CCO	ZINC000450814045	FE	On-Demand	Anodyne	MC4R	47	41
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CCO	ZINC000450814045	FE	On-Demand	Anodyne	PRCP	55	40
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CCO	ZINC000450814046	FE	On-Demand	Anodyne	MC4R	47	41
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CCO	ZINC000450814046	FE	On-Demand	Anodyne	PRCP	55	40
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CCO	ZINC000450814047	FE	On-Demand	Anodyne	MC4R	47	41
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CCO	ZINC000450814047	FE	On-Demand	Anodyne	PRCP	55	40
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CCO	ZINC000450814048	FE	On-Demand	Anodyne	MC4R	47	41
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CCO	ZINC000450814048	FE	On-Demand	Anodyne	PRCP	55	40
O[C@@H]1CC[C@@H]2CN(c3ncc(-c4ccccc4)s3)CC[C@H]2C1	ZINC000450814049	DH	On-Demand	Anodyne	LUCI_LUCLA	18	42
O[C@@H]1CC[C@@H]2CN(c3ncc(-c4ccccc4)s3)CC[C@@H]2C1	ZINC000450814050	DH	On-Demand	Anodyne	LUCI_LUCLA	18	42
O[C@@H]1CC[C@H]2CN(c3ncc(-c4ccccc4)s3)CC[C@H]2C1	ZINC000450814051	DH	On-Demand	Anodyne	LUCI_LUCLA	18	42
O[C@@H]1CC[C@H]2CN(c3ncc(-c4ccccc4)s3)CC[C@@H]2C1	ZINC000450814052	DH	On-Demand	Anodyne	LUCI_LUCLA	18	42
CCCN1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C(C)(C)C1=O	ZINC000450814091	FD	On-Demand	Anodyne	DRD4	40	31
CCCN1CCN(C(=O)c2cn(-c3cccc(OC)c3)nn2)C(C)(C)C1=O	ZINC000450814091	FD	On-Demand	Anodyne	ESRRA	20	40
Cc1ccc([N+](=O)[O-])cc1OCc1oc(C(C)C)nc1C	ZINC000450814092	CH	On-Demand	Bother	CYP19A1	15	41
CC(C)(C)c1cc(CSc2nnc(-c3ccc4ccccc4c3)o2)no1	ZINC000450814102	FK	On-Demand	Anodyne	GSK3B	19	43
CC(C)(C)c1cc(CSc2nnc(-c3ccc4ccccc4c3)o2)no1	ZINC000450814102	FK	On-Demand	Anodyne	GSK3A	53	43
CC[C@@]1(O)CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450814128	FF	On-Demand	Anodyne	CHRM3	16	43
CC[C@]1(O)CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450814129	FF	On-Demand	Anodyne	CHRM3	16	43
Cc1cccc2c1C[C@@H](C(=O)Nc1cc3c(cc1F)NC(=O)CC3)O2	ZINC000450814134	EF	On-Demand	Anodyne	PKM	38	41
Cc1cccc2c1C[C@H](C(=O)Nc1cc3c(cc1F)NC(=O)CC3)O2	ZINC000450814135	EF	On-Demand	Anodyne	PKM	38	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814136	FF	On-Demand	Anodyne	DRD4	43	36
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814136	FF	On-Demand	Anodyne	P2RY12	32	49
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814136	FF	On-Demand	Anodyne	CHEK2	22	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814136	FF	On-Demand	Anodyne	CXCR3	44	66
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814136	FF	On-Demand	Anodyne	SGPL1	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814136	FF	On-Demand	Anodyne	NPFFR1	40	35
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814137	FF	On-Demand	Anodyne	DRD4	43	36
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814137	FF	On-Demand	Anodyne	P2RY12	32	49
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814137	FF	On-Demand	Anodyne	CHEK2	22	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814137	FF	On-Demand	Anodyne	CXCR3	44	66
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814137	FF	On-Demand	Anodyne	SGPL1	0	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450814137	FF	On-Demand	Anodyne	NPFFR1	40	35
COCCN(Cc1cccnc1)C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450814139	CE	On-Demand	Anodyne	NR1D1	41	37
COCCN(Cc1cccnc1)C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450814141	CE	On-Demand	Anodyne	NR1D1	41	37
CC(=O)CCCCCn1nc(-c2ccccc2)ccc1=O	ZINC000450814148	CG	On-Demand	Anodyne	CES1D	44	31
CCOC(=O)c1ccc(CSc2nnc(C(C)(C)C)o2)nc1	ZINC000450814156	DG	On-Demand	Anodyne	ALOX15	42	36
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000450814158	CE	On-Demand	Anodyne	TIMP3	63	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450814160	CE	On-Demand	Anodyne	TIMP3	63	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000450814161	CE	On-Demand	Anodyne	TIMP3	63	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450814163	CE	On-Demand	Anodyne	TIMP3	63	37
COC[C@H](C)n1ccc(NC(=O)c2ccc(Oc3ccccc3OC)cn2)n1	ZINC000450814185	GF	On-Demand	Anodyne	GCK	41	44
COC[C@H](C)n1ccc(NC(=O)c2ccc(Oc3ccccc3OC)cn2)n1	ZINC000450814185	GF	On-Demand	Anodyne	PTK2B	22	40
COC[C@@H](C)n1ccc(NC(=O)c2ccc(Oc3ccccc3OC)cn2)n1	ZINC000450814186	GF	On-Demand	Anodyne	GCK	41	44
COC[C@@H](C)n1ccc(NC(=O)c2ccc(Oc3ccccc3OC)cn2)n1	ZINC000450814186	GF	On-Demand	Anodyne	PTK2B	22	40
Cc1cc2c(N3CCN(CC4CCC(=O)CC4)CC3)ncnc2s1	ZINC000450814189	EF	On-Demand	Anodyne	SIRT3	50	33
COC[C@H](C)n1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)n1	ZINC000450814240	FD	On-Demand	Anodyne	GCK	20	41
COC[C@@H](C)n1ccc(NC(=O)c2cn(CCc3ccccc3)nn2)n1	ZINC000450814241	FD	On-Demand	Anodyne	GCK	20	41
COCCN(CCC[C@@H](C)O)Cc1cccnc1	ZINC000450814242	CD	On-Demand	Anodyne	NR1D1	42	36
COCCN(CCC[C@H](C)O)Cc1cccnc1	ZINC000450814243	CD	On-Demand	Anodyne	NR1D1	42	36
CCC(=O)CCCN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450814244	EF	On-Demand	Anodyne	SIRT3	64	40
CCC(=O)CCCN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450814244	EF	On-Demand	Anodyne	SIRT2	47	40
CCC(=O)CCCN1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450814244	EF	On-Demand	Anodyne	SIRT1	43	40
COC(=O)c1coc(CN(C)[C@]2(c3ccccc3)CCCCC2=O)n1	ZINC000450814245	EF	On-Demand	Anodyne	NPPA	43	37
COC(=O)c1coc(CN(C)[C@@]2(c3ccccc3)CCCCC2=O)n1	ZINC000450814246	EF	On-Demand	Anodyne	NPPA	43	37
CCS(=O)(=O)C1CN(c2nc(-c3ccccc3)c3ccccc3n2)C1	ZINC000450814281	FF	On-Demand	Anodyne	TACR3	47	34
O=C(c1cccnc1N1CC[C@@H]2C[C@H](O)CC[C@H]2C1)N1CCc2ccccc21	ZINC000450814299	GG	On-Demand	Anodyne	AVPR2	37	42
O=C(c1cccnc1N1CC[C@@H]2C[C@H](O)CC[C@H]2C1)N1CCc2ccccc21	ZINC000450814299	GG	On-Demand	Anodyne	GPBAR1	25	41
O=C(c1cccnc1N1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)N1CCc2ccccc21	ZINC000450814300	GG	On-Demand	Anodyne	AVPR2	37	42
O=C(c1cccnc1N1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)N1CCc2ccccc21	ZINC000450814300	GG	On-Demand	Anodyne	GPBAR1	25	41
O=C(c1cccnc1N1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1)N1CCc2ccccc21	ZINC000450814301	GG	On-Demand	Anodyne	AVPR2	37	42
O=C(c1cccnc1N1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1)N1CCc2ccccc21	ZINC000450814301	GG	On-Demand	Anodyne	GPBAR1	25	41
O=C(c1cccnc1N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1)N1CCc2ccccc21	ZINC000450814302	GG	On-Demand	Anodyne	AVPR2	37	42
O=C(c1cccnc1N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1)N1CCc2ccccc21	ZINC000450814302	GG	On-Demand	Anodyne	GPBAR1	25	41
Cc1cc(C#N)nc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)n1	ZINC000450814336	CD	On-Demand	Mild	GPR119	20	45
Cc1cc(C#N)nc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)n1	ZINC000450814337	CD	On-Demand	Mild	GPR119	20	45
Cc1cc(C#N)nc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)n1	ZINC000450814338	CD	On-Demand	Mild	GPR119	20	45
Cc1cc(C#N)nc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)n1	ZINC000450814339	CD	On-Demand	Mild	GPR119	20	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(CCO)[C@H](C)C1	ZINC000450814345	EE	On-Demand	Anodyne	LIPG	49	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(CCO)[C@@H](C)C1	ZINC000450814346	EE	On-Demand	Anodyne	LIPG	49	36
O=C(Cc1ccc(O)c(F)c1)N1CCCCC[C@@H]1c1ncon1	ZINC000450814353	DF	On-Demand	Anodyne	OPRK1	25	41
O=C(Cc1ccc(O)c(F)c1)N1CCCCC[C@@H]1c1ncon1	ZINC000450814353	DF	On-Demand	Anodyne	COLA	111	43
O=C(Cc1ccc(O)c(F)c1)N1CCCCC[C@@H]1c1ncon1	ZINC000450814353	DF	On-Demand	Anodyne	CPT1A	94	43
C[C@@H](CO)N(Cc1ccccc1OC1CC1)C1CCCC1	ZINC000450814370	CG	On-Demand	Anodyne	SLC5A4	53	36
C[C@H](CO)N(Cc1ccccc1OC1CC1)C1CCCC1	ZINC000450814371	CG	On-Demand	Anodyne	SLC5A4	53	36
COC[C@@H](C)n1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)n1	ZINC000450814374	FD	On-Demand	Anodyne	GCK	62	42
COC[C@H](C)n1ccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)n1	ZINC000450814375	FD	On-Demand	Anodyne	GCK	62	42
CCC(CC)(CCSc1nncn1[C@@H](C)c1ccccc1)C(=O)OC	ZINC000450814392	FI	On-Demand	Anodyne	CYP26A1	42	36
CCC(CC)(CCSc1nncn1[C@H](C)c1ccccc1)C(=O)OC	ZINC000450814393	FI	On-Demand	Anodyne	CYP26A1	42	36
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(S(N)(=O)=O)cn2)C1	ZINC000450814427	FD	On-Demand	Anodyne	SMO	23	52
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(S(N)(=O)=O)cn2)C1	ZINC000450814428	FD	On-Demand	Anodyne	SMO	23	52
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000450814449	FF	On-Demand	Bother	SGPL1	0	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000450814451	FF	On-Demand	Bother	SGPL1	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450814456	ED	On-Demand	Anodyne	SCD1	38	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450814458	ED	On-Demand	Anodyne	SCD1	38	40
COCc1noc(CN2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450814461	FE	On-Demand	Anodyne	SSTR5	50	38
CC(F)(F)CCOc1ccc([N+](=O)[O-])cc1F	ZINC000450814466	BG	On-Demand	Bother	CYP19A1	15	42
CC(F)(F)CCOc1ccc([N+](=O)[O-])cc1F	ZINC000450814466	BG	On-Demand	Bother	S1PR4	0	58
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450814467	GE	On-Demand	Anodyne	CTSK	21	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450814467	GE	On-Demand	Anodyne	CTSL	22	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450814467	GE	On-Demand	Anodyne	SCN9A	0	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450814468	GE	On-Demand	Anodyne	CTSK	21	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450814468	GE	On-Demand	Anodyne	CTSL	22	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450814468	GE	On-Demand	Anodyne	SCN9A	0	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2nc(C(N)=O)cs2)C1	ZINC000450814476	EE	On-Demand	Anodyne	PTGER1	31	42
C[C@H]1CN(Cc2ccccc2)CCN(c2nc(C(N)=O)cs2)C1	ZINC000450814477	EE	On-Demand	Anodyne	PTGER1	31	42
Cc1ccnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1	ZINC000450814480	CG	On-Demand	Anodyne	DRD2	0	40
Cc1ccnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1	ZINC000450814481	CG	On-Demand	Anodyne	DRD2	0	40
O=C(N[C@H]1CCCC[C@@H]1O)[C@H]1CCN(c2ccccc2)C1	ZINC000450814482	CD	On-Demand	Anodyne	VACHT_TETCF	0	40
O=C(N[C@H]1CCCC[C@@H]1O)[C@H]1CCN(c2ccccc2)C1	ZINC000450814482	CD	On-Demand	Anodyne	EPHX2	26	43
COC1(CN2C(=O)CN(c3ccccc3)C2=O)CCC1	ZINC000450814485	CE	On-Demand	Anodyne	CMA1	22	40
O=C(N[C@H]1CCCC[C@@H]1O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450814489	CD	On-Demand	Anodyne	VACHT_TETCF	0	40
O=C(N[C@H]1CCCC[C@@H]1O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450814489	CD	On-Demand	Anodyne	EPHX2	26	43
COC(=O)c1csc(COc2cc(C)c(Cl)c(C)c2)n1	ZINC000450814491	DH	On-Demand	Anodyne	PPARD	24	42
CCN1CCN(C(=O)c2cccc3c2CCCC3)[C@H](C)C1=O	ZINC000450814495	DE	On-Demand	Anodyne	FABP4	44	36
CCN1CCN(C(=O)c2cccc3c2CCCC3)[C@@H](C)C1=O	ZINC000450814496	DE	On-Demand	Anodyne	FABP4	44	36
CC(C)[C@@H]1C[C@H]1CNc1cc(C#N)ccn1	ZINC000450814498	BF	On-Demand	Mild	MAP3K12	44	33
C[C@@H]1CN(Cc2ccccc2)CCN(c2nnc(C(F)F)o2)C1	ZINC000450814510	DF	On-Demand	Anodyne	DRD4	17	40
C[C@H]1CN(Cc2ccccc2)CCN(c2nnc(C(F)F)o2)C1	ZINC000450814511	DF	On-Demand	Anodyne	DRD4	17	40
Cc1ccc(F)c(CCNc2ccc(S(N)(=O)=O)cc2S(C)(=O)=O)c1	ZINC000450814516	GD	On-Demand	Anodyne	CA2	35	41
Cc1ccc(F)c(CCNc2ccc(S(N)(=O)=O)cc2S(C)(=O)=O)c1	ZINC000450814516	GD	On-Demand	Anodyne	CA1	35	41
Cc1ccc(F)c(CCNc2ccc(S(N)(=O)=O)cc2S(C)(=O)=O)c1	ZINC000450814516	GD	On-Demand	Anodyne	CA4	29	41
Cc1ccc(F)c(CCNc2ccc(S(N)(=O)=O)cc2S(C)(=O)=O)c1	ZINC000450814516	GD	On-Demand	Anodyne	CA12	15	40
CC(F)(F)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450814518	EH	On-Demand	Anodyne	CA7	15	43
CC(F)(F)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450814518	EH	On-Demand	Anodyne	MMP13	17	46
CC(F)(F)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450814518	EH	On-Demand	Anodyne	SFRP1	71	35
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	HTR1A	31	42
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	DRD2	47	42
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	DRD1	0	42
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	DRD4	68	46
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	ACHE	20	44
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	DRD3	72	42
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	HDAC1	24	47
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	CXCR3	31	43
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	MCHR1	16	41
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450814527	GE	On-Demand	Anodyne	SGPL1	0	40
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	HTR1A	31	42
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	DRD2	47	42
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	DRD1	0	42
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	DRD4	68	46
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	ACHE	20	44
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	DRD3	72	42
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	HDAC1	24	47
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	CXCR3	31	43
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	MCHR1	16	41
COCCNC(=O)c1ccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450814528	GE	On-Demand	Anodyne	SGPL1	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450814532	GH	On-Demand	Anodyne	HTR1A	15	44
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450814532	GH	On-Demand	Anodyne	DRD2	19	43
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450814532	GH	On-Demand	Anodyne	SLC6A1	50	32
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450814532	GH	On-Demand	Anodyne	CXCR3	21	45
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450814533	GH	On-Demand	Anodyne	HTR1A	15	44
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450814533	GH	On-Demand	Anodyne	DRD2	19	43
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450814533	GH	On-Demand	Anodyne	SLC6A1	50	32
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450814533	GH	On-Demand	Anodyne	CXCR3	21	45
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450814543	FF	On-Demand	Mild	SGPL1	0	42
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450814543	FF	On-Demand	Mild	SMO	0	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450814544	FF	On-Demand	Mild	SGPL1	0	42
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C#N)cc2[N+](=O)[O-])C1	ZINC000450814544	FF	On-Demand	Mild	SMO	0	41
CC[C@@H]1C[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CCOC	ZINC000450814549	DF	On-Demand	Anodyne	NAMPT	32	49
C[C@H]1CN(Cc2ccccc2)CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450814551	FG	On-Demand	Mild	DRD4	32	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450814552	FG	On-Demand	Mild	DRD4	32	40
O=C(Cc1ccc(O)c(F)c1)N1CCCCC[C@H]1c1ncon1	ZINC000450814554	DF	On-Demand	Anodyne	OPRK1	25	41
O=C(Cc1ccc(O)c(F)c1)N1CCCCC[C@H]1c1ncon1	ZINC000450814554	DF	On-Demand	Anodyne	COLA	111	43
O=C(Cc1ccc(O)c(F)c1)N1CCCCC[C@H]1c1ncon1	ZINC000450814554	DF	On-Demand	Anodyne	CPT1A	94	43
O[C@@H]1CC[C@H]2CN(c3cncc(Br)c3)CC[C@H]2C1	ZINC000450814560	DF	On-Demand	Anodyne	CHRNA3	47	59
O[C@@H]1CC[C@@H]2CN(c3cncc(Br)c3)CC[C@@H]2C1	ZINC000450814561	DF	On-Demand	Anodyne	CHRNA3	47	59
O[C@@H]1CC[C@@H]2CN(c3cncc(Br)c3)CC[C@H]2C1	ZINC000450814562	DF	On-Demand	Anodyne	CHRNA3	47	59
O[C@@H]1CC[C@H]2CN(c3cncc(Br)c3)CC[C@@H]2C1	ZINC000450814563	DF	On-Demand	Anodyne	CHRNA3	47	59
N#Cc1cc(Br)cnc1N1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1	ZINC000450814573	EF	On-Demand	Mild	CHRNA3	23	42
N#Cc1cc(Br)cnc1N1CC[C@@H]2C[C@H](O)CC[C@@H]2C1	ZINC000450814574	EF	On-Demand	Mild	CHRNA3	23	42
N#Cc1cc(Br)cnc1N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1	ZINC000450814575	EF	On-Demand	Mild	CHRNA3	23	42
N#Cc1cc(Br)cnc1N1CC[C@@H]2C[C@H](O)CC[C@H]2C1	ZINC000450814576	EF	On-Demand	Mild	CHRNA3	23	42
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CN(S(C)(=O)=O)C1	ZINC000450814609	FD	On-Demand	Anodyne	CACNA1B	46	34
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CN(S(C)(=O)=O)C1	ZINC000450814609	FD	On-Demand	Anodyne	CCR2	54	37
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CN(S(C)(=O)=O)C1	ZINC000450814609	FD	On-Demand	Anodyne	EPHX2	16	40
CCS(=O)(=O)C1CN(c2nc(C)c(C#N)cc2Cl)C1	ZINC000450814636	CD	On-Demand	Mild	P2RY12	25	41
Cc1cc(C#N)cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)n1	ZINC000450814637	CE	On-Demand	Mild	GPR119	20	42
Cc1cc(C#N)cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)n1	ZINC000450814638	CE	On-Demand	Mild	GPR119	20	42
Cc1cc(C#N)cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)n1	ZINC000450814639	CE	On-Demand	Mild	GPR119	20	42
Cc1cc(C#N)cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)n1	ZINC000450814640	CE	On-Demand	Mild	GPR119	20	42
C[C@H]1CN(CC(C)(C)O)CCN1CCc1ccc(Cl)cc1	ZINC000450814659	DF	On-Demand	Anodyne	HRH3	29	41
C[C@@H]1CN(CC(C)(C)O)CCN1CCc1ccc(Cl)cc1	ZINC000450814660	DF	On-Demand	Anodyne	HRH3	29	41
Cc1ccc(Br)cc1CN1CCN(C[C@@H](C)O)CC1	ZINC000450814707	EE	On-Demand	Anodyne	IGF1R	15	42
OC[C@H]1C[C@@H](F)CN1Cc1ccccc1OC1CC1	ZINC000450814709	CE	On-Demand	Anodyne	SLC5A4	55	35
OC[C@@H]1C[C@@H](F)CN1Cc1ccccc1OC1CC1	ZINC000450814710	CE	On-Demand	Anodyne	SLC5A4	55	35
OC[C@H]1C[C@H](F)CN1Cc1ccccc1OC1CC1	ZINC000450814711	CE	On-Demand	Anodyne	SLC5A4	55	35
OC[C@@H]1C[C@H](F)CN1Cc1ccccc1OC1CC1	ZINC000450814712	CE	On-Demand	Anodyne	SLC5A4	55	35
COC[C@@H](C)n1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)n1	ZINC000450814865	GD	On-Demand	Anodyne	GCK	46	43
COC[C@H](C)n1ccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)n1	ZINC000450814866	GD	On-Demand	Anodyne	GCK	46	43
CNS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1	ZINC000450814870	EC	On-Demand	Anodyne	GCKR	29	43
CNS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1	ZINC000450814872	EC	On-Demand	Anodyne	GCKR	29	43
CNS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1	ZINC000450814873	EC	On-Demand	Anodyne	GCKR	29	43
CNS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1	ZINC000450814875	EC	On-Demand	Anodyne	GCKR	29	43
O=[N+]([O-])c1cnc(N2CCCc3ccccc3CC2)s1	ZINC000450814893	CG	On-Demand	Bother	MLYCD	40	38
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@H]2c2ncon2)c1	ZINC000450814903	FH	On-Demand	Anodyne	COLA	139	44
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@H]2c2ncon2)c1	ZINC000450814903	FH	On-Demand	Anodyne	CPT1A	120	44
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@H]2c2ncon2)c1	ZINC000450814903	FH	On-Demand	Anodyne	CPT2	42	34
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@@H]2c2ncon2)c1	ZINC000450814905	FH	On-Demand	Anodyne	COLA	139	44
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@@H]2c2ncon2)c1	ZINC000450814905	FH	On-Demand	Anodyne	CPT1A	120	44
C/C=C\COc1cccc(CC(=O)N2CCCCC[C@@H]2c2ncon2)c1	ZINC000450814905	FH	On-Demand	Anodyne	CPT2	42	34
CNC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450814923	ED	On-Demand	Bother	TAAR1	17	43
CNC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450814926	ED	On-Demand	Bother	TAAR1	17	43
CN(C)c1nccc(N2CCCc3ccccc3CC2)n1	ZINC000450814927	CF	On-Demand	Anodyne	SORD	60	35
CNC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450814929	ED	On-Demand	Bother	TAAR1	17	43
CNC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450814932	ED	On-Demand	Bother	TAAR1	17	43
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H]2C[C@H](O)CC[C@@H]2C1	ZINC000450814961	GG	On-Demand	Anodyne	ATP4A	18	47
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1	ZINC000450814962	GG	On-Demand	Anodyne	ATP4A	18	47
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H]2C[C@H](O)CC[C@H]2C1	ZINC000450814963	GG	On-Demand	Anodyne	ATP4A	18	47
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1	ZINC000450814965	GG	On-Demand	Anodyne	ATP4A	18	47
CCS(=O)(=O)C1CN(c2ncc(C#N)cc2Cl)C1	ZINC000450814967	CD	On-Demand	Mild	P2RY12	20	40
CCS(=O)(=O)C1CN(c2nc(-c3ccccc3)ns2)C1	ZINC000450814969	DD	On-Demand	Anodyne	FAAH	0	45
COCCN1C(=O)CCc2cc(NC(=O)CCCC(=O)C3CC3)ccc21	ZINC000450814972	FF	On-Demand	Anodyne	NAMPT	31	47
COCCN1C(=O)CCc2cc(NC(=O)C(C)(C)C3CCC3)ccc21	ZINC000450814976	EG	On-Demand	Anodyne	NAMPT	31	47
CN(C)C(=O)c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(Cl)c1	ZINC000450815008	EE	On-Demand	Anodyne	CXCR3	32	40
CN(C)C(=O)c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(Cl)c1	ZINC000450815009	EE	On-Demand	Anodyne	CXCR3	32	40
CN(C)C(=O)c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(Cl)c1	ZINC000450815011	EE	On-Demand	Anodyne	CXCR3	32	40
CN(C)C(=O)c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(Cl)c1	ZINC000450815012	EE	On-Demand	Anodyne	CXCR3	32	40
COc1ccc(-c2ccnc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)n2)cc1	ZINC000450815013	EG	On-Demand	Anodyne	DKK1	0	41
COc1ccc(-c2ccnc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)n2)cc1	ZINC000450815014	EG	On-Demand	Anodyne	DKK1	0	41
COc1ccc(-c2ccnc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)n2)cc1	ZINC000450815015	EG	On-Demand	Anodyne	DKK1	0	41
COc1ccc(-c2ccnc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)n2)cc1	ZINC000450815016	EG	On-Demand	Anodyne	DKK1	0	41
C[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1CCO	ZINC000450815022	FD	On-Demand	Bother	LIPG	49	35
C[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1CCO	ZINC000450815023	FD	On-Demand	Bother	LIPG	49	35
CCS(=O)(=O)C1CN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450815028	EC	On-Demand	Bother	P2RY12	28	41
CC(C)[C@H]1CCN1c1nc(-c2ccccc2)ns1	ZINC000450815029	CG	On-Demand	Anodyne	FAAH	0	45
CC(C)[C@@H]1CCN1c1nc(-c2ccccc2)ns1	ZINC000450815030	CG	On-Demand	Anodyne	FAAH	0	45
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(Cl)ccc34)CC[C@@H]2C1	ZINC000450815035	DG	On-Demand	Anodyne	PDE3A	27	40
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(Cl)ccc34)CC[C@@H]2C1	ZINC000450815035	DG	On-Demand	Anodyne	PDE3B	71	39
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(Cl)ccc34)CC[C@H]2C1	ZINC000450815036	DG	On-Demand	Anodyne	PDE3A	27	40
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(Cl)ccc34)CC[C@H]2C1	ZINC000450815036	DG	On-Demand	Anodyne	PDE3B	71	39
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(Cl)ccc34)CC[C@H]2C1	ZINC000450815037	DG	On-Demand	Anodyne	PDE3A	27	40
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(Cl)ccc34)CC[C@H]2C1	ZINC000450815037	DG	On-Demand	Anodyne	PDE3B	71	39
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(Cl)ccc34)CC[C@@H]2C1	ZINC000450815038	DG	On-Demand	Anodyne	PDE3A	27	40
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(Cl)ccc34)CC[C@@H]2C1	ZINC000450815038	DG	On-Demand	Anodyne	PDE3B	71	39
CC(C)[C@H]1CCN1c1ncnc2cc(Cl)ccc12	ZINC000450815048	CH	On-Demand	Anodyne	PDE3A	43	35
CC(C)[C@H]1CCN1c1ncnc2cc(Cl)ccc12	ZINC000450815048	CH	On-Demand	Anodyne	HNMT	45	32
CC(C)[C@H]1CCN1c1ncnc2cc(Cl)ccc12	ZINC000450815048	CH	On-Demand	Anodyne	PDE3B	64	35
CC(C)[C@H]1CCN1c1ncnc2cc(Cl)ccc12	ZINC000450815048	CH	On-Demand	Anodyne	HTT	0	42
CC(C)[C@@H]1CCN1c1ncnc2cc(Cl)ccc12	ZINC000450815049	CH	On-Demand	Anodyne	PDE3A	43	35
CC(C)[C@@H]1CCN1c1ncnc2cc(Cl)ccc12	ZINC000450815049	CH	On-Demand	Anodyne	HNMT	45	32
CC(C)[C@@H]1CCN1c1ncnc2cc(Cl)ccc12	ZINC000450815049	CH	On-Demand	Anodyne	PDE3B	64	35
CC(C)[C@@H]1CCN1c1ncnc2cc(Cl)ccc12	ZINC000450815049	CH	On-Demand	Anodyne	HTT	0	42
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4)cs3)CC[C@H]2C1	ZINC000450815058	DH	On-Demand	Anodyne	SPHK2	40	32
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4)cs3)CC[C@H]2C1	ZINC000450815058	DH	On-Demand	Anodyne	SPHK1	32	41
O[C@@H]1CC[C@@H]2CN(c3nc(-c4ccccc4)cs3)CC[C@@H]2C1	ZINC000450815059	DH	On-Demand	Anodyne	SPHK2	40	32
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4)cs3)CC[C@H]2C1	ZINC000450815060	DH	On-Demand	Anodyne	SPHK2	40	32
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4)cs3)CC[C@H]2C1	ZINC000450815060	DH	On-Demand	Anodyne	SPHK1	32	41
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4)cs3)CC[C@@H]2C1	ZINC000450815061	DH	On-Demand	Anodyne	SPHK2	40	32
O[C@@H]1CC[C@H]2CN(c3nc(-c4ccccc4)cs3)CC[C@@H]2C1	ZINC000450815061	DH	On-Demand	Anodyne	SPHK1	32	41
O=[N+]([O-])c1ccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)cc1	ZINC000450815077	GG	On-Demand	Bother	NMBR	48	33
CC(C)[C@@H]1CCN1c1ccnc(Cc2ccccc2)n1	ZINC000450815078	CG	On-Demand	Anodyne	SORD	41	32
CC(C)[C@H]1CCN1c1ccnc(Cc2ccccc2)n1	ZINC000450815079	CG	On-Demand	Anodyne	SORD	41	32
CCCCNc1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc(N)n1	ZINC000450815085	DE	On-Demand	Anodyne	HRH4	51	43
CCCCNc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc(N)n1	ZINC000450815086	DE	On-Demand	Anodyne	HRH4	51	43
CCCCNc1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc(N)n1	ZINC000450815087	DE	On-Demand	Anodyne	HRH4	51	43
CCCCNc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc(N)n1	ZINC000450815088	DE	On-Demand	Anodyne	HRH4	51	43
C[C@@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CCN1CCO	ZINC000450815095	GD	On-Demand	Anodyne	TRPC6	84	45
C[C@@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CCN1CCO	ZINC000450815095	GD	On-Demand	Anodyne	TRPC3	64	45
C[C@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CCN1CCO	ZINC000450815096	GD	On-Demand	Anodyne	TRPC6	84	45
C[C@H]1CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CCN1CCO	ZINC000450815096	GD	On-Demand	Anodyne	TRPC3	64	45
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450815099	CE	On-Demand	Anodyne	COLA	78	38
CCC[C@H](OC)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450815099	CE	On-Demand	Anodyne	CPT1A	53	38
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450815100	CE	On-Demand	Anodyne	COLA	78	38
CCC[C@@H](OC)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450815100	CE	On-Demand	Anodyne	CPT1A	53	38
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450815101	CE	On-Demand	Anodyne	COLA	78	38
CCC[C@H](OC)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450815101	CE	On-Demand	Anodyne	CPT1A	53	38
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450815102	CE	On-Demand	Anodyne	COLA	78	38
CCC[C@@H](OC)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450815102	CE	On-Demand	Anodyne	CPT1A	53	38
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450815113	GF	On-Demand	Anodyne	COLA	62	44
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450815113	GF	On-Demand	Anodyne	CPT1A	60	44
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450815114	GF	On-Demand	Anodyne	COLA	62	44
CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450815114	GF	On-Demand	Anodyne	CPT1A	60	44
CCOc1cncc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)n1	ZINC000450815130	GF	On-Demand	Anodyne	HCN1	52	41
CCOc1cncc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)n1	ZINC000450815130	GF	On-Demand	Anodyne	HCN4	43	33
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCCC[C@@H]1c1ncon1	ZINC000450815132	FG	On-Demand	Anodyne	COLA	106	41
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCCC[C@@H]1c1ncon1	ZINC000450815132	FG	On-Demand	Anodyne	CPT1A	90	41
COc1ccc(C(=O)NC[C@H]2CCC(C)(C)O2)cc1S(C)(=O)=O	ZINC000450815133	ED	On-Demand	Anodyne	COLA	49	32
COc1ccc(C(=O)NC[C@H]2CCC(C)(C)O2)cc1S(C)(=O)=O	ZINC000450815133	ED	On-Demand	Anodyne	CPT1B	40	31
COc1ccc(C(=O)NC[C@@H]2CCC(C)(C)O2)cc1S(C)(=O)=O	ZINC000450815134	ED	On-Demand	Anodyne	COLA	49	32
COc1ccc(C(=O)NC[C@@H]2CCC(C)(C)O2)cc1S(C)(=O)=O	ZINC000450815134	ED	On-Demand	Anodyne	CPT1B	40	31
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCCC[C@H]1c1ncon1	ZINC000450815136	FG	On-Demand	Anodyne	COLA	106	41
O=C(Cc1ccc(OC(F)F)c(F)c1)N1CCCCC[C@H]1c1ncon1	ZINC000450815136	FG	On-Demand	Anodyne	CPT1A	90	41
N#Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)ccc1C(F)(F)F	ZINC000450815138	DH	On-Demand	Mild	AR	15	46
N#Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)ccc1C(F)(F)F	ZINC000450815139	DH	On-Demand	Mild	AR	20	46
N#Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)ccc1C(F)(F)F	ZINC000450815140	DH	On-Demand	Mild	AR	20	46
N#Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)ccc1C(F)(F)F	ZINC000450815141	DH	On-Demand	Mild	AR	20	46
CC(F)(F)C(C)(C)C(=O)Nc1cc2c(cc1F)NC(=O)CC2	ZINC000450815142	DG	On-Demand	Anodyne	PKM	42	47
Cc1ccc(F)c(CCNc2ccc(C(=O)N3CCS(=O)(=O)CC3)cn2)c1	ZINC000450815145	GD	On-Demand	Anodyne	BDKRB1	24	44
CC(=O)CCCCCOc1cccc(S(C)(=O)=O)c1	ZINC000450815152	CF	On-Demand	Anodyne	THRA	25	42
CC(=O)CCCCCOc1cccc(S(C)(=O)=O)c1	ZINC000450815152	CF	On-Demand	Anodyne	P2RY12	0	40
CC(=O)CCCCCOc1cccc(S(C)(=O)=O)c1	ZINC000450815152	CF	On-Demand	Anodyne	MTNR1B	23	42
CC(=O)CCCCCOc1cccc(S(C)(=O)=O)c1	ZINC000450815152	CF	On-Demand	Anodyne	PLA2G4B	63	39
Cc1ccc(F)c(CCNc2ncnc3c2cnn3C)c1	ZINC000450815155	CE	On-Demand	Anodyne	ABL1	41	39
Cc1cccc(N2CCN(Cc3ccccc3)C[C@H](C)C2)n1	ZINC000450815169	CG	On-Demand	Anodyne	DRD2	0	42
Cc1cccc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)n1	ZINC000450815170	CG	On-Demand	Anodyne	DRD2	0	42
Cc1nccnc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450815176	CF	On-Demand	Anodyne	DRD2	0	42
Cc1nccnc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450815176	CF	On-Demand	Anodyne	DRD3	0	41
Cc1nccnc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000450815176	CF	On-Demand	Anodyne	SIGMAR1	26	41
Cc1nccnc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450815177	CF	On-Demand	Anodyne	DRD2	0	42
Cc1nccnc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450815177	CF	On-Demand	Anodyne	DRD3	0	41
Cc1nccnc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000450815177	CF	On-Demand	Anodyne	SIGMAR1	26	41
COCCN1C(=O)CCc2cc(NC(=O)c3ccc(-c4cnn(C)c4)o3)ccc21	ZINC000450815181	GF	On-Demand	Anodyne	SCN10A	17	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450815191	GG	On-Demand	Bother	ABCC1	16	41
C[C@H]1CN(Cc2ccccc2)CCN(c2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450815191	GG	On-Demand	Bother	ABCB1A	23	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450815192	GG	On-Demand	Bother	ABCC1	16	41
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncnc3cccc([N+](=O)[O-])c23)C1	ZINC000450815192	GG	On-Demand	Bother	ABCB1A	23	41
Cc1ccc(F)c(CCNc2cc(C(F)(F)F)nc3ncnn23)c1	ZINC000450815197	EG	On-Demand	Anodyne	DHOD	0	52
CCN1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)[C@@H](C)C1=O	ZINC000450815203	GE	On-Demand	Anodyne	TRPC6	91	47
CCN1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)[C@@H](C)C1=O	ZINC000450815203	GE	On-Demand	Anodyne	TRPC3	86	47
CCN1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)[C@H](C)C1=O	ZINC000450815204	GE	On-Demand	Anodyne	TRPC6	91	47
CCN1CCN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)[C@H](C)C1=O	ZINC000450815204	GE	On-Demand	Anodyne	TRPC3	86	47
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450815211	DF	On-Demand	Anodyne	MMP1	23	40
CC[C@H](CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450815211	DF	On-Demand	Anodyne	BIRC2	41	36
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450815212	DF	On-Demand	Anodyne	MMP1	23	40
CC[C@@H](CC(C)C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000450815212	DF	On-Demand	Anodyne	BIRC2	41	36
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450815213	DF	On-Demand	Anodyne	MMP1	23	40
CC[C@@H](CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450815213	DF	On-Demand	Anodyne	BIRC2	41	36
CC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450815214	DF	On-Demand	Anodyne	MMP1	23	40
CC[C@H](CC(C)C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000450815214	DF	On-Demand	Anodyne	BIRC2	41	36
C[C@@H]1CN(Cc2ccccc2)CCN(c2cc(N3CCCC3)ncn2)C1	ZINC000450815228	FG	On-Demand	Anodyne	DRD2	0	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cc(N3CCCC3)ncn2)C1	ZINC000450815228	FG	On-Demand	Anodyne	SIGMAR1	28	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cc(N3CCCC3)ncn2)C1	ZINC000450815228	FG	On-Demand	Anodyne	PRCP	27	46
C[C@H]1CN(Cc2ccccc2)CCN(c2cc(N3CCCC3)ncn2)C1	ZINC000450815229	FG	On-Demand	Anodyne	DRD2	0	40
C[C@H]1CN(Cc2ccccc2)CCN(c2cc(N3CCCC3)ncn2)C1	ZINC000450815229	FG	On-Demand	Anodyne	SIGMAR1	28	40
C[C@H]1CN(Cc2ccccc2)CCN(c2cc(N3CCCC3)ncn2)C1	ZINC000450815229	FG	On-Demand	Anodyne	PRCP	27	46
Cc1cccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c12	ZINC000450815238	CF	On-Demand	Anodyne	PDE3B	52	32
Cc1cccc2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c12	ZINC000450815239	CF	On-Demand	Anodyne	PDE3B	52	32
Cc1cccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c12	ZINC000450815240	CF	On-Demand	Anodyne	PDE3B	52	32
Cc1cccc2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c12	ZINC000450815241	CF	On-Demand	Anodyne	PDE3B	52	32
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@@H]2C1	ZINC000450815246	FG	On-Demand	Anodyne	PDE3A	48	36
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@@H]2C1	ZINC000450815246	FG	On-Demand	Anodyne	PDE3B	70	36
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@H]2C1	ZINC000450815247	FG	On-Demand	Anodyne	PDE3A	48	36
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@H]2C1	ZINC000450815247	FG	On-Demand	Anodyne	PDE3B	70	36
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@H]2C1	ZINC000450815248	FG	On-Demand	Anodyne	PDE3A	48	36
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@H]2C1	ZINC000450815248	FG	On-Demand	Anodyne	PDE3B	70	36
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@@H]2C1	ZINC000450815249	FG	On-Demand	Anodyne	PDE3A	48	36
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(Br)ccc34)CC[C@@H]2C1	ZINC000450815249	FG	On-Demand	Anodyne	PDE3B	70	36
CC(C)c1nccc(N2CC[C@@H]2C(C)C)n1	ZINC000450815254	BF	On-Demand	Anodyne	SORD	102	41
CC(C)c1nccc(N2CC[C@H]2C(C)C)n1	ZINC000450815255	BF	On-Demand	Anodyne	SORD	102	41
COc1ccc2nc(C)nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c2c1	ZINC000450815260	EF	On-Demand	Anodyne	PDE3B	64	39
COc1ccc2nc(C)nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c2c1	ZINC000450815261	EF	On-Demand	Anodyne	PDE3B	64	39
COc1ccc2nc(C)nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c2c1	ZINC000450815262	EF	On-Demand	Anodyne	PDE3B	64	39
COc1ccc2nc(C)nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c2c1	ZINC000450815263	EF	On-Demand	Anodyne	PDE3B	64	39
COc1cc(CC(=O)N2CCN(CCO)[C@H](C)C2)ccc1Cl	ZINC000450815264	ED	On-Demand	Anodyne	OPRK1	35	43
COc1cc(CC(=O)N2CCN(CCO)[C@H](C)C2)ccc1Cl	ZINC000450815264	ED	On-Demand	Anodyne	CCR1	27	42
COc1cc(CC(=O)N2CCN(CCO)[C@@H](C)C2)ccc1Cl	ZINC000450815265	ED	On-Demand	Anodyne	OPRK1	35	43
COc1cc(CC(=O)N2CCN(CCO)[C@@H](C)C2)ccc1Cl	ZINC000450815265	ED	On-Demand	Anodyne	CCR1	27	42
Cc1ccc(C(=O)N2CCN(CCO)[C@H](C)C2)c(Cl)c1Cl	ZINC000450815312	EE	On-Demand	Anodyne	P2RX7	24	44
Cc1ccc(C(=O)N2CCN(CCO)[C@@H](C)C2)c(Cl)c1Cl	ZINC000450815313	EE	On-Demand	Anodyne	P2RX7	24	44
CCn1nnc(C)c1COc1cccc(S(C)(=O)=O)c1	ZINC000450815334	CD	On-Demand	Anodyne	NR1H3	50	37
Cc1ccc(F)c(CCNc2ncc(C(=O)N3CCOCC3)cc2Cl)c1	ZINC000450815335	GG	On-Demand	Anodyne	BDKRB1	15	40
Cc1ccc(F)c(CCNc2ncc(C(=O)N3CCOCC3)cc2Cl)c1	ZINC000450815335	GG	On-Demand	Anodyne	LRRK2	32	41
CC(C)[C@@H]1C[C@H]1CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450815337	DE	On-Demand	Bother	VCP	26	41
CC[C@]1(O)CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450815338	FG	On-Demand	Anodyne	HRH4	25	49
CC[C@@]1(O)CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450815339	FG	On-Demand	Anodyne	HRH4	25	49
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2S(C)(=O)=O)C1	ZINC000450815340	FE	On-Demand	Anodyne	DRD4	24	52
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2S(C)(=O)=O)C1	ZINC000450815341	FE	On-Demand	Anodyne	DRD4	24	52
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccn2)C1	ZINC000450815352	CE	On-Demand	Anodyne	DRD2	33	48
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccn2)C1	ZINC000450815352	CE	On-Demand	Anodyne	DRD1	0	48
C[C@H]1CN(Cc2ccccc2)CCN(c2ncccn2)C1	ZINC000450815352	CE	On-Demand	Anodyne	DRD3	33	48
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccn2)C1	ZINC000450815353	CE	On-Demand	Anodyne	DRD2	33	48
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccn2)C1	ZINC000450815353	CE	On-Demand	Anodyne	DRD1	0	48
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccn2)C1	ZINC000450815353	CE	On-Demand	Anodyne	DRD3	33	48
Cc1nnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)o1	ZINC000450815355	CE	On-Demand	Anodyne	SIGMAR1	36	40
Cc1nnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)o1	ZINC000450815356	CE	On-Demand	Anodyne	SIGMAR1	36	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cc(N3CCOCC3)ncn2)C1	ZINC000450815357	FE	On-Demand	Anodyne	DRD4	40	41
C[C@H]1CN(Cc2ccccc2)CCN(c2cc(N3CCOCC3)ncn2)C1	ZINC000450815358	FE	On-Demand	Anodyne	DRD4	40	41
C[C@@H](OCCc1ccccc1)C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000450815359	DF	On-Demand	Anodyne	TIMP3	47	35
C[C@H](OCCc1ccccc1)C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000450815360	DF	On-Demand	Anodyne	TIMP3	47	35
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450815361	DF	On-Demand	Anodyne	TIMP3	47	35
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000450815362	DF	On-Demand	Anodyne	TIMP3	47	35
CC[C@H](O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815398	EE	On-Demand	Anodyne	SLC1A1	48	34
CC[C@H](O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815398	EE	On-Demand	Anodyne	SLC1A3	56	34
CC[C@H](O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815398	EE	On-Demand	Anodyne	EPHX2	26	42
CC[C@H](O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815398	EE	On-Demand	Anodyne	SLC1A2	49	34
CC[C@@H](O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815399	EE	On-Demand	Anodyne	SLC1A1	48	34
CC[C@@H](O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815399	EE	On-Demand	Anodyne	SLC1A3	56	34
CC[C@@H](O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815399	EE	On-Demand	Anodyne	EPHX2	26	42
CC[C@@H](O)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815399	EE	On-Demand	Anodyne	SLC1A2	49	34
C[C@H]1CN(Cc2ccccc2)CCN(c2ccnc3ccncc23)C1	ZINC000450815427	EH	On-Demand	Anodyne	DRD4	23	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2ccnc3ccncc23)C1	ZINC000450815428	EH	On-Demand	Anodyne	DRD4	23	40
CCS(=O)(=O)C1CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450815434	DD	On-Demand	Anodyne	RBP4	19	48
OCc1ccnc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)n1	ZINC000450815441	GD	On-Demand	Anodyne	EPHB4	56	34
CCS(=O)(=O)C1CN(c2nc3ccccc3o2)C1	ZINC000450815446	CD	On-Demand	Anodyne	CTSS	16	41
CCOCc1nc(C)c(C(=O)N2CCCCC[C@@H]2c2ncon2)s1	ZINC000450815448	FG	On-Demand	Anodyne	COLA	73	37
CCOCc1nc(C)c(C(=O)N2CCCCC[C@@H]2c2ncon2)s1	ZINC000450815448	FG	On-Demand	Anodyne	CPT1A	65	37
CCOCc1nc(C)c(C(=O)N2CCCCC[C@H]2c2ncon2)s1	ZINC000450815449	FG	On-Demand	Anodyne	COLA	73	37
CCOCc1nc(C)c(C(=O)N2CCCCC[C@H]2c2ncon2)s1	ZINC000450815449	FG	On-Demand	Anodyne	CPT1A	65	37
Cc1cc(C)c(C(=O)N2CCCCC[C@H]2c2ncon2)cc1Br	ZINC000450815454	GI	On-Demand	Anodyne	COLA	46	37
Cc1cc(C)c(C(=O)N2CCCCC[C@H]2c2ncon2)cc1Br	ZINC000450815454	GI	On-Demand	Anodyne	CPT1A	44	37
Cc1cc(C)c(C(=O)N2CCCCC[C@@H]2c2ncon2)cc1Br	ZINC000450815455	GI	On-Demand	Anodyne	COLA	46	37
Cc1cc(C)c(C(=O)N2CCCCC[C@@H]2c2ncon2)cc1Br	ZINC000450815455	GI	On-Demand	Anodyne	CPT1A	44	37
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(F)c(F)cc34)CC[C@@H]2C1	ZINC000450815461	DF	On-Demand	Anodyne	PDE3A	49	38
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(F)c(F)cc34)CC[C@@H]2C1	ZINC000450815461	DF	On-Demand	Anodyne	PDE3B	72	37
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(F)c(F)cc34)CC[C@@H]2C1	ZINC000450815462	DF	On-Demand	Anodyne	PDE3A	49	38
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(F)c(F)cc34)CC[C@@H]2C1	ZINC000450815462	DF	On-Demand	Anodyne	PDE3B	72	37
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(F)c(F)cc34)CC[C@H]2C1	ZINC000450815463	DF	On-Demand	Anodyne	PDE3A	49	38
O[C@@H]1CC[C@@H]2CN(c3ncnc4cc(F)c(F)cc34)CC[C@H]2C1	ZINC000450815463	DF	On-Demand	Anodyne	PDE3B	72	37
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(F)c(F)cc34)CC[C@H]2C1	ZINC000450815464	DF	On-Demand	Anodyne	PDE3A	49	38
O[C@@H]1CC[C@H]2CN(c3ncnc4cc(F)c(F)cc34)CC[C@H]2C1	ZINC000450815464	DF	On-Demand	Anodyne	PDE3B	72	37
CS(=O)(=O)N1CC(CNC(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450815513	EC	On-Demand	Anodyne	TRPV1	58	34
CC(C)[C@H]1CCN1c1nc2cc(F)ccc2o1	ZINC000450815532	BG	On-Demand	Anodyne	HTR3A	22	63
CC(C)[C@H]1CCN1c1nc2cc(F)ccc2o1	ZINC000450815532	BG	On-Demand	Anodyne	CHRNA7	15	63
CC(C)[C@@H]1CCN1c1nc2cc(F)ccc2o1	ZINC000450815533	BG	On-Demand	Anodyne	HTR3A	22	63
CC(C)[C@@H]1CCN1c1nc2cc(F)ccc2o1	ZINC000450815533	BG	On-Demand	Anodyne	CHRNA7	15	63
CCN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1=O	ZINC000450815534	ED	On-Demand	Bother	CACNA1D	48	32
CCN1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1=O	ZINC000450815535	ED	On-Demand	Bother	CACNA1D	48	32
CC(C)[C@@H]1CCN1c1ccc(C(F)(F)F)cn1	ZINC000450815544	BG	On-Demand	Anodyne	CXCR3	22	40
CC(C)[C@H]1CCN1c1ccc(C(F)(F)F)cn1	ZINC000450815548	BG	On-Demand	Anodyne	CXCR3	22	40
CC(C)(CC(=O)COc1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000450815553	CH	On-Demand	Bother	SLC27A4	51	33
COCCN1C(=O)CCc2cc(NC(=O)C3CC(C)(O)C3)ccc21	ZINC000450815555	ED	On-Demand	Anodyne	NAMPT	30	48
CCOCc1nc(C)c(C(=O)NCc2ccncc2C)s1	ZINC000450815557	DF	On-Demand	Anodyne	SCD1	40	39
Cc1ccc2ncnc(N3CC[C@H]3C(C)C)c2c1	ZINC000450815561	BG	On-Demand	Anodyne	PDE3A	43	33
Cc1ccc2ncnc(N3CC[C@H]3C(C)C)c2c1	ZINC000450815561	BG	On-Demand	Anodyne	PDE3B	64	33
Cc1ccc2ncnc(N3CC[C@H]3C(C)C)c2c1	ZINC000450815561	BG	On-Demand	Anodyne	HTT	0	40
Cc1ccc2ncnc(N3CC[C@@H]3C(C)C)c2c1	ZINC000450815562	BG	On-Demand	Anodyne	PDE3A	43	33
Cc1ccc2ncnc(N3CC[C@@H]3C(C)C)c2c1	ZINC000450815562	BG	On-Demand	Anodyne	PDE3B	64	33
Cc1ccc2ncnc(N3CC[C@@H]3C(C)C)c2c1	ZINC000450815562	BG	On-Demand	Anodyne	HTT	0	40
COC(=O)c1ccc([N+](=O)[O-])c(OC[C@H](Cc2ccccc2)OC)c1	ZINC000450815576	EG	On-Demand	Bother	PDS	48	34
COC(=O)c1ccc([N+](=O)[O-])c(OC[C@@H](Cc2ccccc2)OC)c1	ZINC000450815578	EG	On-Demand	Bother	PDS	48	34
CS(=O)(=O)c1cccc(OCc2ccn(CC(F)(F)F)n2)c1	ZINC000450815581	EE	On-Demand	Anodyne	NR1H3	41	38
CS(=O)(=O)c1cccc(OCc2ccn(CC(F)(F)F)n2)c1	ZINC000450815581	EE	On-Demand	Anodyne	NR1H2	24	44
O=C(Nc1ccccc1-c1cn[nH]c1)[C@@H](O)C1CCC1	ZINC000450815596	CE	On-Demand	Anodyne	ROCK2	50	38
O=C(Nc1ccccc1-c1cn[nH]c1)[C@H](O)C1CCC1	ZINC000450815598	CE	On-Demand	Anodyne	ROCK2	50	38
COCCN1C(=O)CCc2cc(NC(=O)c3cc4cccnc4s3)ccc21	ZINC000450815601	GG	On-Demand	Anodyne	NOS1	16	47
COCCN1C(=O)CCc2cc(NC(=O)c3cc4cccnc4s3)ccc21	ZINC000450815601	GG	On-Demand	Anodyne	NAMPT	32	47
CC[C@H]1C(=O)N(CC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450815603	FE	On-Demand	Bother	CACNA1D	53	32
CC[C@@H]1C(=O)N(CC)CCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450815605	FE	On-Demand	Bother	CACNA1D	53	32
Cc1cc(N2CCN(Cc3ccccc3)C[C@H](C)C2)ncc1[N+](=O)[O-]	ZINC000450815609	EG	On-Demand	Bother	SGPL1	0	40
Cc1cc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000450815611	EG	On-Demand	Bother	SGPL1	0	40
C[C@@H](O)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815612	DH	On-Demand	Anodyne	GSK3B	18	40
C[C@@H](O)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815612	DH	On-Demand	Anodyne	GSK3A	50	40
C[C@@H](O)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815612	DH	On-Demand	Anodyne	ALOX15	49	47
C[C@@H](O)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815612	DH	On-Demand	Anodyne	TERT	26	41
C[C@H](O)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815614	DH	On-Demand	Anodyne	GSK3B	18	40
C[C@H](O)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815614	DH	On-Demand	Anodyne	GSK3A	50	40
C[C@H](O)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815614	DH	On-Demand	Anodyne	ALOX15	49	47
C[C@H](O)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815614	DH	On-Demand	Anodyne	TERT	26	41
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	ABL1	46	41
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	CNR1	0	48
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	CNR2	24	51
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	LCK	35	44
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	P2RX7	18	42
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	NR1H4	0	40
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	EPHX2	38	48
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	TYK2	54	36
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	MCHR1	18	43
Cc1cccc(Cl)c1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1	ZINC000450815620	GI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
CS(=O)(=O)c1cccc(OC[C@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450815635	CE	On-Demand	Anodyne	CHRNA10	40	31
CS(=O)(=O)c1cccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)c1	ZINC000450815636	CE	On-Demand	Anodyne	CHRNA10	40	31
CC[C@@]1(O)CCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450815664	EE	On-Demand	Anodyne	CCR1	46	42
CC[C@]1(O)CCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000450815665	EE	On-Demand	Anodyne	CCR1	46	42
CC(F)(F)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815677	DK	On-Demand	Anodyne	GSK3B	19	43
CC(F)(F)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815677	DK	On-Demand	Anodyne	GSK3A	50	40
CC(F)(F)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815677	DK	On-Demand	Anodyne	ALOX15	51	49
CC(F)(F)CCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000450815677	DK	On-Demand	Anodyne	TERT	26	41
O[C@@H]1CC[C@H]2CN(c3ccnc(Cc4ccccc4)n3)CC[C@@H]2C1	ZINC000450815711	DG	On-Demand	Anodyne	SORD	33	40
O[C@@H]1CC[C@@H]2CN(c3ccnc(Cc4ccccc4)n3)CC[C@@H]2C1	ZINC000450815712	DG	On-Demand	Anodyne	SORD	33	40
O[C@@H]1CC[C@H]2CN(c3ccnc(Cc4ccccc4)n3)CC[C@H]2C1	ZINC000450815713	DG	On-Demand	Anodyne	SORD	33	40
O[C@@H]1CC[C@@H]2CN(c3ccnc(Cc4ccccc4)n3)CC[C@H]2C1	ZINC000450815714	DG	On-Demand	Anodyne	SORD	33	40
CCS(=O)(=O)C1CN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450815717	GG	On-Demand	Anodyne	ADRB3	29	48
CCOc1nc2ccc(C(=O)N3CC[C@@](O)(CC)C3)cc2[nH]1	ZINC000450815726	DD	On-Demand	Anodyne	ACACA	45	40
CCOc1nc2ccc(C(=O)N3CC[C@@](O)(CC)C3)cc2[nH]1	ZINC000450815726	DD	On-Demand	Anodyne	ACACB	39	40
CCOc1nc2ccc(C(=O)N3CC[C@](O)(CC)C3)cc2[nH]1	ZINC000450815727	DD	On-Demand	Anodyne	ACACA	45	40
CCOc1nc2ccc(C(=O)N3CC[C@](O)(CC)C3)cc2[nH]1	ZINC000450815727	DD	On-Demand	Anodyne	ACACB	39	40
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450815728	DF	On-Demand	Anodyne	MMP13	30	43
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450815728	DF	On-Demand	Anodyne	MMP2	24	43
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450815728	DF	On-Demand	Anodyne	MMP9	24	43
C[C@@H](O)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450815728	DF	On-Demand	Anodyne	ADAMTS4	47	37
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450815729	DF	On-Demand	Anodyne	MMP13	30	43
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450815729	DF	On-Demand	Anodyne	MMP2	24	43
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450815729	DF	On-Demand	Anodyne	MMP9	24	43
C[C@H](O)CCOc1ccc(S(=O)(=O)c2ccccc2)cc1	ZINC000450815729	DF	On-Demand	Anodyne	ADAMTS4	47	37
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1C[C@H]1C(C)C	ZINC000450815752	ED	On-Demand	Anodyne	CA2	43	49
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1C[C@H]1C(C)C	ZINC000450815752	ED	On-Demand	Anodyne	CA1	41	38
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1C[C@H]1C(C)C	ZINC000450815752	ED	On-Demand	Anodyne	CA4	47	39
O=C(c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450815755	GG	On-Demand	Bother	AVPR2	18	41
O=C(c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450815755	GG	On-Demand	Bother	SLC6A9	0	43
O=C(c1ccc(N2CCCc3ccccc3CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450815755	GG	On-Demand	Bother	AKR1C3	0	45
Cc1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450815762	CF	On-Demand	Anodyne	DRD2	0	43
Cc1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450815762	CF	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1cnc(N2CCN(Cc3ccccc3)C[C@H](C)C2)nc1	ZINC000450815762	CF	On-Demand	Anodyne	SIGMAR1	34	43
Cc1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450815763	CF	On-Demand	Anodyne	DRD2	0	43
Cc1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450815763	CF	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1cnc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)nc1	ZINC000450815763	CF	On-Demand	Anodyne	SIGMAR1	34	43
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c2ccccc2n1	ZINC000450815782	CH	On-Demand	Anodyne	HTR1D	41	34
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c2ccccc2n1	ZINC000450815784	CH	On-Demand	Anodyne	HTR1D	41	34
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c2ccccc2n1	ZINC000450815785	CH	On-Demand	Anodyne	HTR1D	41	34
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c2ccccc2n1	ZINC000450815788	CH	On-Demand	Anodyne	HTR1D	41	34
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc1	ZINC000450815790	DE	On-Demand	Anodyne	GPR119	22	53
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc1	ZINC000450815792	DE	On-Demand	Anodyne	GPR119	22	53
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc1	ZINC000450815794	DE	On-Demand	Anodyne	GPR119	22	53
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc1	ZINC000450815796	DE	On-Demand	Anodyne	GPR119	22	53
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@@H](O)C1CCC1	ZINC000450815797	EE	On-Demand	Anodyne	EPHX2	33	40
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)[C@H](O)C1CCC1	ZINC000450815799	EE	On-Demand	Anodyne	EPHX2	33	40
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(C(F)(F)F)c1	ZINC000450815805	GG	On-Demand	Anodyne	HSD11B1	22	42
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(C(F)(F)F)c1	ZINC000450815805	GG	On-Demand	Anodyne	GPR119	31	42
COc1cc(CC(=O)NC[C@H]2CCC(C)(C)O2)ccc1O	ZINC000450815807	CE	On-Demand	Anodyne	TRPV1	37	51
COc1cc(CC(=O)NC[C@H]2CCC(C)(C)O2)ccc1O	ZINC000450815807	CE	On-Demand	Anodyne	NCE103	33	43
COc1cc(CC(=O)NC[C@H]2CCC(C)(C)O2)ccc1O	ZINC000450815807	CE	On-Demand	Anodyne	P96878_MYCTU	22	43
COc1cc(CC(=O)NC[C@H]2CCC(C)(C)O2)ccc1O	ZINC000450815807	CE	On-Demand	Anodyne	CAN2	0	43
COc1cc(CC(=O)NC[C@@H]2CCC(C)(C)O2)ccc1O	ZINC000450815808	CE	On-Demand	Anodyne	TRPV1	37	51
COc1cc(CC(=O)NC[C@@H]2CCC(C)(C)O2)ccc1O	ZINC000450815808	CE	On-Demand	Anodyne	NCE103	33	43
COc1cc(CC(=O)NC[C@@H]2CCC(C)(C)O2)ccc1O	ZINC000450815808	CE	On-Demand	Anodyne	P96878_MYCTU	22	43
COc1cc(CC(=O)NC[C@@H]2CCC(C)(C)O2)ccc1O	ZINC000450815808	CE	On-Demand	Anodyne	CAN2	0	43
CCC(=O)C1(C(=O)Nc2nnc(Cc3ccc(Cl)cc3)s2)CC1	ZINC000450815809	EG	On-Demand	Anodyne	MME	0	40
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(C(F)(F)F)c1	ZINC000450815811	GG	On-Demand	Anodyne	HSD11B1	22	42
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(C(F)(F)F)c1	ZINC000450815811	GG	On-Demand	Anodyne	GPR119	31	42
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(C(F)(F)F)c1	ZINC000450815812	GG	On-Demand	Anodyne	HSD11B1	22	42
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(C(F)(F)F)c1	ZINC000450815812	GG	On-Demand	Anodyne	GPR119	31	42
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(C(F)(F)F)c1	ZINC000450815813	GG	On-Demand	Anodyne	HSD11B1	22	42
CS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(C(F)(F)F)c1	ZINC000450815813	GG	On-Demand	Anodyne	GPR119	31	42
O=C(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1)N1CCc2ccccc21	ZINC000450815835	GG	On-Demand	Anodyne	AVPR2	63	44
O=C(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1)N1CCc2ccccc21	ZINC000450815837	GG	On-Demand	Anodyne	AVPR2	63	44
O=C(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1)N1CCc2ccccc21	ZINC000450815839	GG	On-Demand	Anodyne	AVPR2	63	44
O=C(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1)N1CCc2ccccc21	ZINC000450815841	GG	On-Demand	Anodyne	AVPR2	49	44
CC(=O)CCCCCOc1cc([N+](=O)[O-])ccc1C	ZINC000450815853	CG	On-Demand	Bother	S1PR4	0	40
CC[C@@]1(O)CCN(C(=O)[C@@H](C)Oc2ccccn2)C1	ZINC000450815864	CD	On-Demand	Anodyne	S1PR2	15	41
CC[C@]1(O)CCN(C(=O)[C@H](C)Oc2ccccn2)C1	ZINC000450815865	CD	On-Demand	Anodyne	S1PR2	15	41
CC[C@]1(O)CCN(C(=O)[C@@H](C)Oc2ccccn2)C1	ZINC000450815866	CD	On-Demand	Anodyne	S1PR2	15	41
CC[C@@]1(O)CCN(C(=O)[C@H](C)Oc2ccccn2)C1	ZINC000450815867	CD	On-Demand	Anodyne	S1PR2	15	41
O=C(c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(Cl)c1)N1CCOCC1	ZINC000450815874	GE	On-Demand	Anodyne	CXCR3	28	43
O=C(c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(Cl)c1)N1CCOCC1	ZINC000450815875	GE	On-Demand	Anodyne	CXCR3	28	43
O=C(c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(Cl)c1)N1CCOCC1	ZINC000450815876	GE	On-Demand	Anodyne	CXCR3	28	43
O=C(c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(Cl)c1)N1CCOCC1	ZINC000450815877	GE	On-Demand	Anodyne	CXCR3	28	43
CCS(=O)(=O)C1CN(c2ncnc3ccc(C)cc23)C1	ZINC000450815928	CD	On-Demand	Anodyne	PDE3B	64	35
CCS(=O)(=O)C1CN(c2ncnc3ccc(C)cc23)C1	ZINC000450815928	CD	On-Demand	Anodyne	HTT	0	43
CCC(CC)Oc1ccc(C(=O)NCC2CN(S(C)(=O)=O)C2)cc1	ZINC000450815929	FD	On-Demand	Anodyne	CACNA1I	42	36
CCS(=O)(=O)C1CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450815938	FE	On-Demand	Anodyne	PDE3B	63	34
O=C(NCCc1nnc2n1CCCC2)c1c(Cl)cc(Cl)cc1Cl	ZINC000450815943	FH	On-Demand	Anodyne	CNR1	51	31
CC(C)[C@H]1CCN1c1ccc(S(C)(=O)=O)cn1	ZINC000450815969	CD	On-Demand	Anodyne	GPR119	32	41
CC(C)[C@@H]1CCN1c1ccc(S(C)(=O)=O)cn1	ZINC000450815970	CD	On-Demand	Anodyne	GPR119	32	41
Cc1ccc2nc(S[C@@H](C)C(=O)Nc3nccs3)n(C)c(=O)c2c1	ZINC000450815973	FF	On-Demand	Anodyne	MAP1	50	32
Cc1ccc2nc(S[C@H](C)C(=O)Nc3nccs3)n(C)c(=O)c2c1	ZINC000450815974	FF	On-Demand	Anodyne	MAP1	50	32
CC(C)[C@@H]1CCN1c1cc(-c2ccccc2)nc2ncnn12	ZINC000450815996	CG	On-Demand	Anodyne	DHOD	0	40
CC(C)[C@H]1CCN1c1cc(-c2ccccc2)nc2ncnn12	ZINC000450815997	CG	On-Demand	Anodyne	DHOD	0	40
CC(C)O[C@]1(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)CCOC1	ZINC000450816007	GD	On-Demand	Anodyne	NPFFR1	42	31
CC(C)O[C@]1(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)CCOC1	ZINC000450816008	GD	On-Demand	Anodyne	NPFFR1	42	31
CC(C)O[C@@]1(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)CCOC1	ZINC000450816009	GD	On-Demand	Anodyne	NPFFR1	42	31
CC(C)O[C@@]1(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)CCOC1	ZINC000450816010	GD	On-Demand	Anodyne	NPFFR1	42	31
CC(C)(C(=O)NCC1(CCO)CC1)c1cccc2ccccc12	ZINC000450816012	DG	On-Demand	Anodyne	KCNJ11	42	33
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	DRD2	33	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	DRD1	0	50
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	DRD4	0	49
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	HTR2A	24	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	HTR2C	23	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	SLC18A3	0	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	HTR3B	0	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	CYP2J2	58	43
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816013	EF	On-Demand	Anodyne	AP2S1	0	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	DRD2	33	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	DRD1	0	50
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	DRD4	0	49
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	HTR2A	24	52
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	HTR2C	23	52
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	SLC18A3	0	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	HTR3B	0	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	CYP2J2	58	43
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1CC(C)(C)O	ZINC000450816014	EF	On-Demand	Anodyne	AP2S1	0	44
Cc1ccc(C(=O)NCC2(CCO)CC2)c2c1CCC2	ZINC000450816021	CE	On-Demand	Anodyne	HCN4	50	33
Cc1ncc([N+](=O)[O-])n1CCC(C)(F)F	ZINC000450816022	BE	On-Demand	Bother	TYMS	0	48
CC(=O)CCCCCn1c([N+](=O)[O-])cnc1C	ZINC000450816025	BE	On-Demand	Bother	TYMS	0	42
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cc2cccnc2s1	ZINC000450816031	GG	On-Demand	Anodyne	NPFFR1	53	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cc2cccnc2s1	ZINC000450816032	GG	On-Demand	Anodyne	NPFFR1	53	34
COC(=O)c1ccc(CC(=O)NCC2(CCO)CC2)cc1	ZINC000450816038	CD	On-Demand	Anodyne	NPFFR1	21	41
CCC1(CC)CN(C(=O)c2ccc(C)c(Cl)c2Cl)CCS1(=O)=O	ZINC000450816044	GH	On-Demand	Anodyne	P2RX7	0	41
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(CCO)CC3)cc2)c1	ZINC000450816047	FF	On-Demand	Anodyne	CHRM3	15	43
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CCO)CC1	ZINC000450816055	CD	On-Demand	Anodyne	CTSV	44	30
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CCO)CC1	ZINC000450816055	CD	On-Demand	Anodyne	HCN1	48	30
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CCO)CC1	ZINC000450816055	CD	On-Demand	Anodyne	HCN4	46	30
O=C(CCSCc1cccc(Cl)c1)NC(=O)NCCC(F)(F)F	ZINC000450816056	FH	On-Demand	Anodyne	CACNA2D1	25	46
CCCCc1nc(-c2ccc(OCc3nc(C(=O)OC)co3)cc2)no1	ZINC000450816059	FG	On-Demand	Anodyne	SPHK1	37	41
CCc1cc(N2CC(c3cccc(Cl)c3)C2)n2ncnc2n1	ZINC000450816075	DF	On-Demand	Anodyne	DHOD	0	40
CC(=O)[C@](C)(O)CN[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450816092	EG	On-Demand	Anodyne	RBP4	74	38
CC(=O)[C@](C)(O)CN[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450816093	EG	On-Demand	Anodyne	RBP4	74	38
CC(=O)[C@](C)(O)CN[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000450816094	EG	On-Demand	Anodyne	RBP4	74	38
CC(=O)[C@](C)(O)CN[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000450816095	EG	On-Demand	Anodyne	RBP4	74	38
COC(=O)C[C@@](C)(NC[C@@H]1CCC(F)(F)C1)c1cccc(OC)c1	ZINC000450816096	EG	On-Demand	Anodyne	CHRM3	15	42
COC(=O)C[C@](C)(NC[C@@H]1CCC(F)(F)C1)c1cccc(OC)c1	ZINC000450816097	EG	On-Demand	Anodyne	CHRM3	15	42
COC(=O)C[C@](C)(NC[C@H]1CCC(F)(F)C1)c1cccc(OC)c1	ZINC000450816098	EG	On-Demand	Anodyne	CHRM3	15	42
COC(=O)C[C@@](C)(NC[C@H]1CCC(F)(F)C1)c1cccc(OC)c1	ZINC000450816099	EG	On-Demand	Anodyne	CHRM3	15	42
CCS(=O)(=O)C1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450816109	EE	On-Demand	Bother	LIPG	43	35
CC(C)[C@@H]1CCN1c1ccnc(-c2ccccc2)n1	ZINC000450816132	CG	On-Demand	Anodyne	SORD	56	41
CC(C)[C@H]1CCN1c1ccnc(-c2ccccc2)n1	ZINC000450816133	CG	On-Demand	Anodyne	SORD	56	41
CC(C)[C@@H]1CCN1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450816170	CG	On-Demand	Anodyne	LRRK2	38	44
CC(C)[C@H]1CCN1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450816171	CG	On-Demand	Anodyne	LRRK2	38	44
CCS(=O)(=O)C1CN(c2nc(C(F)(F)F)ccc2C#N)C1	ZINC000450816181	DD	On-Demand	Mild	P2RY12	35	40
CCS(=O)(=O)C1CN(c2ncnc3c2cnn3-c2ccccc2)C1	ZINC000450816201	ED	On-Demand	Anodyne	GPR119	19	42
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450816206	GF	On-Demand	Anodyne	NPFFR1	47	34
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450816207	GF	On-Demand	Anodyne	NPFFR1	47	34
CC[S@@](=O)CC(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450816208	EC	On-Demand	Anodyne	NPFFR1	54	38
CO[C@@H]1CN(c2cc(NCC3CC3)ncn2)C[C@H]1O	ZINC000450816222	CC	On-Demand	Anodyne	GPR39	0	42
CC[S@](=O)CC(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450816223	EC	On-Demand	Anodyne	NPFFR1	54	38
CC[S@](=O)CC(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450816224	EC	On-Demand	Anodyne	NPFFR1	54	38
CC[S@@](=O)CC(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450816225	EC	On-Demand	Anodyne	NPFFR1	54	38
Cc1sccc1C(=O)NCC1(CCO)CC1	ZINC000450816228	BD	On-Demand	Anodyne	HCN1	52	33
Cc1sccc1C(=O)NCC1(CCO)CC1	ZINC000450816228	BD	On-Demand	Anodyne	HCN4	50	33
COC(=O)c1nc(N2C[C@@H](O)[C@H](OC)C2)sc1C	ZINC000450816279	CC	On-Demand	Anodyne	GYRB	0	44
CCOC(=O)c1cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450816304	GE	On-Demand	Anodyne	NPFFR1	54	37
CCOC(=O)c1cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)[nH]c1C	ZINC000450816305	GE	On-Demand	Anodyne	NPFFR1	54	37
Cc1ncc([N+](=O)[O-])n1CCC1=CCCCC1	ZINC000450816318	BF	On-Demand	Bother	TYMS	0	40
CO[C@@H]1CN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C[C@H]1O	ZINC000450816344	ED	On-Demand	Anodyne	ROS1	37	45
CCn1nnc(C)c1CSc1nnc(Cc2cccc(OC)c2)o1	ZINC000450816350	EF	On-Demand	Anodyne	PTK2	26	58
CCn1nnc(C)c1CSc1nnc(Cc2cccc(OC)c2)o1	ZINC000450816350	EF	On-Demand	Anodyne	CPB	0	45
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cccc(C#N)c1Br	ZINC000450816357	FF	On-Demand	Mild	CCR3	0	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cccc(C#N)c1Br	ZINC000450816362	FF	On-Demand	Mild	CCR3	0	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cccc(C#N)c1Br	ZINC000450816363	FF	On-Demand	Mild	CCR3	0	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cccc(C#N)c1Br	ZINC000450816364	FF	On-Demand	Mild	CCR3	0	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450816365	FE	On-Demand	Bother	CCR3	18	43
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450816366	FE	On-Demand	Bother	CCR3	18	43
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450816367	FE	On-Demand	Bother	CCR3	18	43
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450816368	FE	On-Demand	Bother	CCR3	18	43
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450816369	GF	On-Demand	Anodyne	HLA-DRB1	42	34
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450816369	GF	On-Demand	Anodyne	CTRB_BOVIN	47	36
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450816369	GF	On-Demand	Anodyne	DERP1	0	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450816370	GF	On-Demand	Anodyne	HLA-DRB1	42	34
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450816370	GF	On-Demand	Anodyne	CTRB_BOVIN	47	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450816370	GF	On-Demand	Anodyne	DERP1	0	40
CCS(=O)(=O)C1CN(c2ccc(C#N)c(C)n2)C1	ZINC000450816408	CC	On-Demand	Mild	P2RY12	20	40
CC(C)[C@@H]1CCN1c1nccc(Oc2ccccc2)n1	ZINC000450816423	CH	On-Demand	Anodyne	SORD	41	34
CC(C)[C@H]1CCN1c1nccc(Oc2ccccc2)n1	ZINC000450816424	CH	On-Demand	Anodyne	SORD	41	34
CCc1cc(NC[C@H](NS(=O)(=O)N(C)C)C2CCCC2)n2ncnc2n1	ZINC000450816442	GD	On-Demand	Anodyne	DHOD	0	44
CCc1cc(NC[C@@H](NS(=O)(=O)N(C)C)C2CCCC2)n2ncnc2n1	ZINC000450816443	GD	On-Demand	Anodyne	DHOD	0	44
CC(C)[C@H]1CCN1c1ncnc2cc(Br)ccc12	ZINC000450816456	DH	On-Demand	Anodyne	PDE3A	42	33
CC(C)[C@H]1CCN1c1ncnc2cc(Br)ccc12	ZINC000450816456	DH	On-Demand	Anodyne	PDE3B	62	33
CC(C)[C@@H]1CCN1c1ncnc2cc(Br)ccc12	ZINC000450816457	DH	On-Demand	Anodyne	PDE3A	42	33
CC(C)[C@@H]1CCN1c1ncnc2cc(Br)ccc12	ZINC000450816457	DH	On-Demand	Anodyne	PDE3B	62	33
COC(=O)c1n[nH]c2c1CN(c1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])CC2	ZINC000450816511	GD	On-Demand	Bother	TAAR1	22	44
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450816512	FE	On-Demand	Anodyne	P2RY12	125	35
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450816513	FE	On-Demand	Anodyne	P2RY12	125	35
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450816514	FE	On-Demand	Anodyne	P2RY12	125	35
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450816515	FE	On-Demand	Anodyne	P2RY12	125	35
COc1cccc(Cc2nnc(SCCC(C)(F)F)o2)c1	ZINC000450816527	DH	On-Demand	Anodyne	PTK2	0	52
COc1cccc(Cc2nnc(SCCC(C)(F)F)o2)c1	ZINC000450816527	DH	On-Demand	Anodyne	CPB	0	47
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450816536	GE	On-Demand	Anodyne	MMP2	15	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450816536	GE	On-Demand	Anodyne	RORC	29	43
CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450816537	GE	On-Demand	Anodyne	MMP2	15	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450816537	GE	On-Demand	Anodyne	RORC	29	43
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450816538	GE	On-Demand	Anodyne	MMP2	15	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450816538	GE	On-Demand	Anodyne	RORC	29	43
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450816539	GE	On-Demand	Anodyne	MMP2	15	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450816539	GE	On-Demand	Anodyne	RORC	29	43
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450816540	EE	On-Demand	Anodyne	PDEC	0	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450816541	EE	On-Demand	Anodyne	PDEC	0	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450816542	EE	On-Demand	Anodyne	PDEC	0	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450816543	EE	On-Demand	Anodyne	PDEC	0	41
COC(=O)c1n[nH]c2c1CN(c1ccc(S(C)(=O)=O)cc1F)CC2	ZINC000450816555	FD	On-Demand	Anodyne	SLC6A9	30	43
CCn1c(C)nnc1SCC(=O)c1ccc(C(=O)OC)o1	ZINC000450816556	DD	On-Demand	Anodyne	SLC27A1	45	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450816557	DD	On-Demand	Anodyne	PROTEASE	0	42
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450816558	DD	On-Demand	Anodyne	PROTEASE	0	42
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450816559	DD	On-Demand	Anodyne	PROTEASE	0	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450816560	DD	On-Demand	Anodyne	PROTEASE	0	42
COC(=O)c1n[nH]c2c1CN(c1ccnc(C(C)C)n1)CC2	ZINC000450816575	DD	On-Demand	Anodyne	SORD	48	36
CO[C@@H]1CN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1O	ZINC000450816576	EF	On-Demand	Anodyne	ADRB3	34	53
Cc1nn(C)cc1CSc1nnc(Cc2c(F)cccc2Cl)o1	ZINC000450816581	FH	On-Demand	Anodyne	PTK2	0	40
COC(=O)c1n[nH]c2c1CN(c1nccc3cc(C(F)(F)F)ccc13)CC2	ZINC000450816583	GG	On-Demand	Anodyne	TRPV1	15	42
O=C([C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)N1CC[C@H]2CCC[C@@H]21	ZINC000450816620	DI	On-Demand	Anodyne	TRPM8	43	34
CCO[C@@H]1C[C@@](NCc2c(C)cccc2Cl)(C(=O)OC)C1(C)C	ZINC000450816624	EG	On-Demand	Anodyne	EIF2AK1	42	39
CCO[C@H]1C[C@@](NCc2c(C)cccc2Cl)(C(=O)OC)C1(C)C	ZINC000450816625	EG	On-Demand	Anodyne	EIF2AK1	42	39
CCO[C@@H]1C[C@](NCc2c(C)cccc2Cl)(C(=O)OC)C1(C)C	ZINC000450816626	EG	On-Demand	Anodyne	EIF2AK1	42	39
CCO[C@H]1C[C@](NCc2c(C)cccc2Cl)(C(=O)OC)C1(C)C	ZINC000450816627	EG	On-Demand	Anodyne	EIF2AK1	42	39
Cc1ccc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c2c1CCC2	ZINC000450816630	GG	On-Demand	Anodyne	NPFFR1	52	37
CCS(=O)(=O)C1CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450816636	ED	On-Demand	Anodyne	PDE3A	57	45
CCS(=O)(=O)C1CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450816636	ED	On-Demand	Anodyne	PDGFRB	67	40
CCS(=O)(=O)C1CN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450816636	ED	On-Demand	Anodyne	PDE3B	83	45
Cc1ccc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c2c1CCC2	ZINC000450816638	GG	On-Demand	Anodyne	NPFFR1	52	37
COC1(Cn2c([N+](=O)[O-])cnc2C)CCC1	ZINC000450816660	BD	On-Demand	Bother	TYMS	35	41
CC(C)[C@H]1CCN1c1ncnc2sc3c(c12)CCC3	ZINC000450816675	CG	On-Demand	Anodyne	RBP4	17	42
CC(C)[C@@H]1CCN1c1ncnc2sc3c(c12)CCC3	ZINC000450816678	CG	On-Demand	Anodyne	RBP4	17	42
CCC(=O)CCCN1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450816679	DI	On-Demand	Anodyne	CYP2J2	48	35
O=C(c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1)N1CCCCC1	ZINC000450816685	GJ	On-Demand	Anodyne	P2RY12	26	42
O=C(c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1)N1CCCCC1	ZINC000450816685	GJ	On-Demand	Anodyne	GRM5	21	44
O=C(c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1)N1CCCCC1	ZINC000450816685	GJ	On-Demand	Anodyne	CXCR3	28	49
O=C(c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1)N1CCCCC1	ZINC000450816685	GJ	On-Demand	Anodyne	HPGD	42	47
O=C(c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1)N1CCCCC1	ZINC000450816685	GJ	On-Demand	Anodyne	SLC6A7	0	42
CCCOc1ccc(C(=O)Nc2ncccc2NC(C)=O)c(OC)c1	ZINC000450816709	EG	On-Demand	Anodyne	KCNK3	41	37
CC(C)[C@H]1CCN1c1ncnc2c1oc1ccccc12	ZINC000450816715	CH	On-Demand	Anodyne	HRH4	18	60
CC(C)[C@@H]1CCN1c1ncnc2c1oc1ccccc12	ZINC000450816716	CH	On-Demand	Anodyne	HRH4	18	60
CC1(C)CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1O	ZINC000450816717	DF	On-Demand	Anodyne	SIGMAR1	41	37
CC1(C)CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1O	ZINC000450816719	DF	On-Demand	Anodyne	SIGMAR1	41	37
CCC1(CC)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCS1(=O)=O	ZINC000450816727	GE	On-Demand	Anodyne	CPT2	41	35
CCC1(CC)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCS1(=O)=O	ZINC000450816727	GE	On-Demand	Anodyne	PREP	119	59
CCC1(CC)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCS1(=O)=O	ZINC000450816727	GE	On-Demand	Anodyne	SFRP1	42	39
CCC1(CC)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2)CCS1(=O)=O	ZINC000450816727	GE	On-Demand	Anodyne	WNT3	49	39
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816744	FE	On-Demand	Anodyne	ADRA1D	19	52
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816744	FE	On-Demand	Anodyne	ADRA1A	15	52
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816744	FE	On-Demand	Anodyne	ADRA1B	46	52
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816744	FE	On-Demand	Anodyne	PDE3A	45	34
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816744	FE	On-Demand	Anodyne	CCR4	50	44
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816744	FE	On-Demand	Anodyne	PDE3B	67	34
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816744	FE	On-Demand	Anodyne	EHMT2	70	43
O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCC1(CCO)CC1	ZINC000450816748	EF	On-Demand	Anodyne	IMDH_CRYPV	34	53
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816753	FE	On-Demand	Anodyne	ADRA1D	19	52
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816753	FE	On-Demand	Anodyne	ADRA1A	15	52
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816753	FE	On-Demand	Anodyne	ADRA1B	46	52
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816753	FE	On-Demand	Anodyne	PDE3A	45	34
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816753	FE	On-Demand	Anodyne	CCR4	50	44
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816753	FE	On-Demand	Anodyne	PDE3B	67	34
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc(N)c2cc1OC	ZINC000450816753	FE	On-Demand	Anodyne	EHMT2	70	43
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816755	FE	On-Demand	Anodyne	ADRA1D	19	52
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816755	FE	On-Demand	Anodyne	ADRA1A	15	52
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816755	FE	On-Demand	Anodyne	ADRA1B	46	52
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816755	FE	On-Demand	Anodyne	PDE3A	45	34
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816755	FE	On-Demand	Anodyne	CCR4	50	44
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816755	FE	On-Demand	Anodyne	PDE3B	67	34
COc1cc2nc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816755	FE	On-Demand	Anodyne	EHMT2	70	43
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816756	FE	On-Demand	Anodyne	ADRA1D	19	52
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816756	FE	On-Demand	Anodyne	ADRA1A	15	52
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816756	FE	On-Demand	Anodyne	ADRA1B	46	52
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816756	FE	On-Demand	Anodyne	PDE3A	45	34
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816756	FE	On-Demand	Anodyne	CCR4	50	44
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816756	FE	On-Demand	Anodyne	PDE3B	67	34
COc1cc2nc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc(N)c2cc1OC	ZINC000450816756	FE	On-Demand	Anodyne	EHMT2	70	43
CC(C)c1ncsc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450816761	FF	On-Demand	Anodyne	NPFFR1	49	34
CCS(=O)(=O)C1CN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450816763	ED	On-Demand	Anodyne	LRRK2	0	42
CC(C)c1ncsc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450816765	FF	On-Demand	Anodyne	NPFFR1	49	34
CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc2)CC1	ZINC000450816766	FF	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nc2)CC1	ZINC000450816766	FF	On-Demand	Anodyne	L3MBTL3	50	37
CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc2)CC1	ZINC000450816768	FF	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nc2)CC1	ZINC000450816768	FF	On-Demand	Anodyne	L3MBTL3	50	37
CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc2)CC1	ZINC000450816770	FF	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nc2)CC1	ZINC000450816770	FF	On-Demand	Anodyne	L3MBTL3	50	37
COC(=O)c1ccc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450816771	GE	On-Demand	Anodyne	SIGMAR1	40	46
COC(=O)c1ccc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450816771	GE	On-Demand	Anodyne	CCR5	22	46
COC(=O)c1ccc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450816771	GE	On-Demand	Anodyne	NPFFR2	40	36
COC(=O)c1ccc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450816771	GE	On-Demand	Anodyne	NPFFR1	62	47
CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc2)CC1	ZINC000450816772	FF	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nc2)CC1	ZINC000450816772	FF	On-Demand	Anodyne	L3MBTL3	50	37
COC(=O)c1ccc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450816773	GE	On-Demand	Anodyne	SIGMAR1	40	46
COC(=O)c1ccc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450816773	GE	On-Demand	Anodyne	CCR5	22	46
COC(=O)c1ccc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450816773	GE	On-Demand	Anodyne	NPFFR2	40	36
COC(=O)c1ccc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450816773	GE	On-Demand	Anodyne	NPFFR1	62	47
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@H](C)N(C)C)c([N+](=O)[O-])c1	ZINC000450816782	FD	On-Demand	Bother	BDKRB1	0	40
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@H](C)N(C)C)c([N+](=O)[O-])c1	ZINC000450816783	FD	On-Demand	Bother	BDKRB1	0	40
O=C(CCCN1C[C@@H](F)C[C@H]1CO)c1ccc(F)cc1	ZINC000450816788	CE	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1C[C@@H](F)C[C@H]1CO)c1ccc(F)cc1	ZINC000450816788	CE	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1C[C@@H](F)C[C@H]1CO)c1ccc(F)cc1	ZINC000450816788	CE	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@@H](F)C[C@H]1CO)c1ccc(F)cc1	ZINC000450816788	CE	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@H](F)C[C@H]1CO)c1ccc(F)cc1	ZINC000450816789	CE	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1C[C@H](F)C[C@H]1CO)c1ccc(F)cc1	ZINC000450816789	CE	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1C[C@H](F)C[C@H]1CO)c1ccc(F)cc1	ZINC000450816789	CE	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@H](F)C[C@H]1CO)c1ccc(F)cc1	ZINC000450816789	CE	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@@H](F)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450816790	CE	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1C[C@@H](F)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450816790	CE	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1C[C@@H](F)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450816790	CE	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@@H](F)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450816790	CE	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@H](F)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450816791	CE	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1C[C@H](F)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450816791	CE	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1C[C@H](F)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450816791	CE	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@H](F)C[C@@H]1CO)c1ccc(F)cc1	ZINC000450816791	CE	On-Demand	Anodyne	CYP2J2	44	31
COC(=O)c1ccc(C(=O)Cn2c([N+](=O)[O-])cnc2C)o1	ZINC000450816802	CD	On-Demand	Bother	TYMS	35	40
CC(=O)c1ccc(CN(C)CC[C@@H]2CCCO2)cc1	ZINC000450816804	CF	On-Demand	Anodyne	OXTR	26	41
CC(=O)c1ccc(CN(C)CC[C@@H]2CCCO2)cc1	ZINC000450816804	CF	On-Demand	Anodyne	AVPR1A	0	41
CC(=O)c1ccc(CN(C)CC[C@H]2CCCO2)cc1	ZINC000450816805	CF	On-Demand	Anodyne	OXTR	26	41
CC(=O)c1ccc(CN(C)CC[C@H]2CCCO2)cc1	ZINC000450816805	CF	On-Demand	Anodyne	AVPR1A	0	41
CO[C@@H]1CN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C[C@H]1O	ZINC000450816810	ED	On-Demand	Anodyne	NPBWR1	59	45
CO[C@@H]1CN(c2nc(-c3cccc(Cl)c3)no2)C[C@H]1O	ZINC000450816811	CD	On-Demand	Anodyne	GRM5	29	47
CO[C@@H]1CN(c2ccnc(N[C@H]3CCCO[C@@H]3C(C)C)n2)C[C@H]1O	ZINC000450816819	ED	On-Demand	Anodyne	SORD	48	34
CO[C@@H]1CN(c2ccnc(N[C@@H]3CCCO[C@@H]3C(C)C)n2)C[C@H]1O	ZINC000450816820	ED	On-Demand	Anodyne	SORD	48	34
CO[C@@H]1CN(c2ccnc(N[C@@H]3CCCO[C@H]3C(C)C)n2)C[C@H]1O	ZINC000450816821	ED	On-Demand	Anodyne	SORD	48	34
CO[C@@H]1CN(c2ccnc(N[C@H]3CCCO[C@H]3C(C)C)n2)C[C@H]1O	ZINC000450816822	ED	On-Demand	Anodyne	SORD	48	34
CO[C@@H]1CN(c2ccnc(C(=O)NCc3ccccc3)c2)C[C@H]1O	ZINC000450816854	ED	On-Demand	Anodyne	MMP13	0	41
COC(=O)c1n[nH]c2c1CN(c1cc(C)nc3ccccc13)CC2	ZINC000450816859	DF	On-Demand	Anodyne	ADAM17	55	33
COc1cc(-c2noc(CSc3nnc(C(C)C)n3C)n2)ncn1	ZINC000450816860	EE	On-Demand	Anodyne	AXIN2	0	41
CCOc1cc2nccc(N3CCc4[nH]nc(C(=O)OC)c4C3)c2cc1OCC	ZINC000450816861	GG	On-Demand	Anodyne	PDGFRB	43	39
CC1(C)CCN(c2ccnc3cc(Cl)ccc23)CC[S@@]1=O	ZINC000450816867	DH	On-Demand	Anodyne	HRP1_PLAFA	96	36
CC1(C)CCN(c2ccnc3cc(Cl)ccc23)CC[S@@]1=O	ZINC000450816867	DH	On-Demand	Anodyne	HNMT	49	34
CC1(C)CCN(c2ccnc3cc(Cl)ccc23)CC[S@]1=O	ZINC000450816868	DH	On-Demand	Anodyne	HRP1_PLAFA	96	36
CC1(C)CCN(c2ccnc3cc(Cl)ccc23)CC[S@]1=O	ZINC000450816868	DH	On-Demand	Anodyne	HNMT	49	34
CO[C@@H]1CN(c2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450816869	GC	On-Demand	Bother	CASP7	41	36
COC(=O)C1(CNC(=O)Cc2scnc2-c2ccccc2)CCCCC1	ZINC000450816885	FH	On-Demand	Anodyne	HCN1	50	32
COC(=O)C1(CNC(=O)Cc2scnc2-c2ccccc2)CCCCC1	ZINC000450816885	FH	On-Demand	Anodyne	HCN4	48	32
COC(=O)c1n[nH]c2c1CN(c1ncnc3cc(F)c(F)cc13)CC2	ZINC000450816886	ED	On-Demand	Anodyne	PDGFRB	54	44
CCc1cc(NC2(Cc3ccc(F)cc3)CC2)n2ncnc2n1	ZINC000450816887	DG	On-Demand	Anodyne	DHOD	0	48
CO[C@@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1O	ZINC000450816888	ED	On-Demand	Anodyne	PRNP	55	39
CO[C@@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1O	ZINC000450816888	ED	On-Demand	Anodyne	HDAC1	29	44
CO[C@@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C[C@H]1O	ZINC000450816888	ED	On-Demand	Anodyne	DGAT1	41	37
CN(CCCC(=O)c1ccc(F)cc1)CC[C@@H]1CCCO1	ZINC000450816901	CG	On-Demand	Anodyne	OXTR	23	40
CN(CCCC(=O)c1ccc(F)cc1)CC[C@@H]1CCCO1	ZINC000450816901	CG	On-Demand	Anodyne	AVPR1A	0	40
CN(CCCC(=O)c1ccc(F)cc1)CC[C@H]1CCCO1	ZINC000450816902	CG	On-Demand	Anodyne	OXTR	23	40
CN(CCCC(=O)c1ccc(F)cc1)CC[C@H]1CCCO1	ZINC000450816902	CG	On-Demand	Anodyne	AVPR1A	0	40
O=C(CNC(=O)Nc1cccc(Cl)c1)NCCc1nnc2n1CCCC2	ZINC000450816910	GD	On-Demand	Anodyne	HRH2	31	43
CCS(=O)(=O)C1CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450816920	DD	On-Demand	Anodyne	PDE3A	43	35
CCS(=O)(=O)C1CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450816920	DD	On-Demand	Anodyne	HRP1_PLAFA	64	32
CCS(=O)(=O)C1CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450816920	DD	On-Demand	Anodyne	PDE3B	63	35
CCS(=O)(=O)C1CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450816920	DD	On-Demand	Anodyne	AKT1	22	41
CC1(C)CC[C@@H](CNC(=O)c2ccc(-c3ccncc3)c(F)c2)O1	ZINC000450816930	EH	On-Demand	Anodyne	MAPK14	18	43
CC1(C)CC[C@@H](CNC(=O)c2ccc(-c3ccncc3)c(F)c2)O1	ZINC000450816930	EH	On-Demand	Anodyne	HSPB1	0	40
CC1(C)CC[C@H](CNC(=O)c2ccc(-c3ccncc3)c(F)c2)O1	ZINC000450816931	EH	On-Demand	Anodyne	MAPK14	18	43
CC1(C)CC[C@H](CNC(=O)c2ccc(-c3ccncc3)c(F)c2)O1	ZINC000450816931	EH	On-Demand	Anodyne	HSPB1	0	40
O=C(c1cccnc1N1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)N1CCCCC1	ZINC000450816932	EF	On-Demand	Anodyne	L3MBTL3	42	39
O=C(c1cccnc1N1CC[C@@H]2C[C@@H](O)CC[C@H]2C1)N1CCCCC1	ZINC000450816933	EF	On-Demand	Anodyne	L3MBTL3	42	39
O=C(c1cccnc1N1CC[C@@H]2C[C@H](O)CC[C@H]2C1)N1CCCCC1	ZINC000450816934	EF	On-Demand	Anodyne	L3MBTL3	42	39
O=C(c1cccnc1N1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1)N1CCCCC1	ZINC000450816935	EF	On-Demand	Anodyne	L3MBTL3	42	39
O=C(CS(=O)(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450816942	GE	On-Demand	Anodyne	HTR1A	28	43
O=C(CS(=O)(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450816942	GE	On-Demand	Anodyne	ACHE	31	42
O=C(CS(=O)(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450816942	GE	On-Demand	Anodyne	HTR1D	63	43
O=C(CS(=O)(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450816942	GE	On-Demand	Anodyne	HTR1B	47	43
O=C(CS(=O)(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450816942	GE	On-Demand	Anodyne	NQO2	17	42
O=C(CS(=O)(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450816942	GE	On-Demand	Anodyne	MPO	72	40
O=C(CS(=O)(=O)C1CC1)NCCc1c[nH]c2ccc(Br)cc12	ZINC000450816942	GE	On-Demand	Anodyne	MTNR1A	17	47
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450816974	DG	On-Demand	Anodyne	COLA	55	36
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450816974	DG	On-Demand	Anodyne	CPT1A	49	35
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450816975	DG	On-Demand	Anodyne	COLA	55	36
CC[C@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450816975	DG	On-Demand	Anodyne	CPT1A	49	35
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450816976	DG	On-Demand	Anodyne	COLA	55	36
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000450816976	DG	On-Demand	Anodyne	CPT1A	49	35
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450816977	DG	On-Demand	Anodyne	COLA	55	36
CC[C@@H](CC(F)(F)F)C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000450816977	DG	On-Demand	Anodyne	CPT1A	49	35
CO[C@@H]1CN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C[C@H]1O	ZINC000450817029	ED	On-Demand	Anodyne	HSD11B1	0	42
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450817037	GE	On-Demand	Mild	AR	15	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450817038	GE	On-Demand	Mild	AR	15	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450817039	GE	On-Demand	Mild	AR	15	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450817040	GE	On-Demand	Mild	AR	15	41
CC(C)C[C@@H]1C[C@H]1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450817063	EF	On-Demand	Anodyne	NPFFR1	46	32
CC(C)C[C@@H]1C[C@H]1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450817064	EF	On-Demand	Anodyne	NPFFR1	46	32
CCn1c(C)nnc1SCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450817072	FE	On-Demand	Anodyne	PDGFRB	34	41
CCn1c(C)nnc1SCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450817072	FE	On-Demand	Anodyne	MTNR1A	42	37
C[C@H](N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F)c1csnn1	ZINC000450817081	EJ	On-Demand	Anodyne	RBP4	40	33
C[C@H](N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1csnn1	ZINC000450817082	EJ	On-Demand	Anodyne	RBP4	40	33
C[C@H](N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F)c1csnn1	ZINC000450817083	EJ	On-Demand	Anodyne	RBP4	40	33
C[C@H](N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1csnn1	ZINC000450817084	EJ	On-Demand	Anodyne	RBP4	40	33
C[C@@H](O)CCOc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	ZINC000450817118	CG	On-Demand	Bother	S1PR4	0	40
C[C@H](O)CCOc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	ZINC000450817119	CG	On-Demand	Bother	S1PR4	0	40
CS(=O)(=O)c1cccc(CS[C@@H]2CCCc3ccccc32)c1	ZINC000450817121	EI	On-Demand	Anodyne	HTR6	42	39
CS(=O)(=O)c1cccc(CS[C@H]2CCCc3ccccc32)c1	ZINC000450817127	EI	On-Demand	Anodyne	HTR6	42	39
O=C(CCCN1C[C@@H](F)C[C@H]1CO)c1ccccc1	ZINC000450817129	CE	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1C[C@H](F)C[C@H]1CO)c1ccccc1	ZINC000450817131	CE	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1C[C@@H](F)C[C@@H]1CO)c1ccccc1	ZINC000450817133	CE	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1C[C@H](F)C[C@@H]1CO)c1ccccc1	ZINC000450817135	CE	On-Demand	Anodyne	CYP2J2	51	36
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450817136	DF	On-Demand	Anodyne	GPR88	0	47
Cc1ccn(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450817137	ED	On-Demand	Anodyne	NPFFR1	46	32
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450817138	DF	On-Demand	Anodyne	GPR88	0	47
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450817139	DF	On-Demand	Anodyne	GPR88	0	47
Cc1ccn(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450817141	ED	On-Demand	Anodyne	NPFFR1	46	32
Cc1ccn(-c2ccccc2C(=O)NCC2(CCO)CC2)n1	ZINC000450817157	CE	On-Demand	Anodyne	HCN1	55	34
Cc1ccn(-c2ccccc2C(=O)NCC2(CCO)CC2)n1	ZINC000450817157	CE	On-Demand	Anodyne	HCN4	53	34
O=C(CS(=O)(=O)C1CC1)NC[C@H](O)CCc1ccccc1	ZINC000450817176	DC	On-Demand	Anodyne	ACE	42	36
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)Cc1ccc(O)c(F)c1	ZINC000450817179	FE	On-Demand	Anodyne	SIGMAR1	25	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)Cc1ccc(O)c(F)c1	ZINC000450817179	FE	On-Demand	Anodyne	NPFFR1	49	33
O=C(CS(=O)(=O)C1CC1)NC[C@@H](O)CCc1ccccc1	ZINC000450817180	DC	On-Demand	Anodyne	ACE	42	36
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)Cc1ccc(O)c(F)c1	ZINC000450817181	FE	On-Demand	Anodyne	SIGMAR1	25	41
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)Cc1ccc(O)c(F)c1	ZINC000450817181	FE	On-Demand	Anodyne	NPFFR1	49	33
CCCCc1nc(-c2ccc(OCCC[C@@H](C)O)cc2)no1	ZINC000450817183	DH	On-Demand	Anodyne	ACACA	25	57
CCCCc1nc(-c2ccc(OCCC[C@@H](C)O)cc2)no1	ZINC000450817183	DH	On-Demand	Anodyne	SPHK1	31	41
CCCCc1nc(-c2ccc(OCCC[C@@H](C)O)cc2)no1	ZINC000450817183	DH	On-Demand	Anodyne	PLA2G5	22	45
CO[C@@H]1CN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C[C@H]1O	ZINC000450817185	EC	On-Demand	Anodyne	HSD11B1	0	42
CCCCc1nc(-c2ccc(OCCC[C@H](C)O)cc2)no1	ZINC000450817186	DH	On-Demand	Anodyne	ACACA	25	57
CCCCc1nc(-c2ccc(OCCC[C@H](C)O)cc2)no1	ZINC000450817186	DH	On-Demand	Anodyne	SPHK1	31	41
CCCCc1nc(-c2ccc(OCCC[C@H](C)O)cc2)no1	ZINC000450817186	DH	On-Demand	Anodyne	PLA2G5	22	45
CCOc1cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)on1	ZINC000450817197	FD	On-Demand	Anodyne	NPFFR1	48	35
CCOc1cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)on1	ZINC000450817198	FD	On-Demand	Anodyne	NPFFR1	48	35
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cn1	ZINC000450817211	CD	On-Demand	Bother	CHRNA4	27	63
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cn1	ZINC000450817212	CD	On-Demand	Bother	CHRNA4	27	63
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cn1	ZINC000450817213	CD	On-Demand	Bother	CHRNA4	27	63
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cn1	ZINC000450817214	CD	On-Demand	Bother	CHRNA4	27	63
N#Cc1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(Cl)c1	ZINC000450817215	CF	On-Demand	Mild	CXCR3	20	40
N#Cc1cnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(Cl)c1	ZINC000450817216	CF	On-Demand	Mild	CXCR3	20	40
N#Cc1cnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(Cl)c1	ZINC000450817217	CF	On-Demand	Mild	CXCR3	20	40
N#Cc1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(Cl)c1	ZINC000450817218	CF	On-Demand	Mild	CXCR3	20	40
CN(C[C@@H]1CC=CCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450817243	EG	On-Demand	Bother	SLC27A4	49	32
CN(C[C@H]1CC=CCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450817244	EG	On-Demand	Bother	SLC27A4	49	32
CC[C@@H]1C[C@H]1C(=O)NCc1ncccc1NC(=O)[C@@H]1C[C@H]1CC	ZINC000450817253	DF	On-Demand	Anodyne	G2YM83_BOTF4	45	34
O=C(CC[C@@H]1CCCCO1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000450817303	EF	On-Demand	Bother	COLA	0	42
O=C(CC[C@H]1CCCCO1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000450817304	EF	On-Demand	Bother	COLA	0	42
CNS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(F)c1	ZINC000450817316	ED	On-Demand	Anodyne	SLC6A9	17	41
CNS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(F)c1	ZINC000450817317	ED	On-Demand	Anodyne	SLC6A9	17	41
CNS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(F)c1	ZINC000450817318	ED	On-Demand	Anodyne	SLC6A9	17	41
CNS(=O)(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(F)c1	ZINC000450817319	ED	On-Demand	Anodyne	SLC6A9	17	41
O[C@@H]1CC[C@@H]2CN(c3nc4ccccc4nc3N3CCOCC3)CC[C@@H]2C1	ZINC000450817333	FE	On-Demand	Anodyne	PIK3CA	23	40
O[C@@H]1CC[C@@H]2CN(c3nc4ccccc4nc3N3CCOCC3)CC[C@H]2C1	ZINC000450817334	FE	On-Demand	Anodyne	PIK3CA	23	40
O[C@@H]1CC[C@H]2CN(c3nc4ccccc4nc3N3CCOCC3)CC[C@@H]2C1	ZINC000450817337	FE	On-Demand	Anodyne	PIK3CA	23	40
O[C@@H]1CC[C@H]2CN(c3nc4ccccc4nc3N3CCOCC3)CC[C@H]2C1	ZINC000450817339	FE	On-Demand	Anodyne	PIK3CA	23	40
COC(=O)C1(CNC(=O)CCOc2cccc(OC)c2)CCCCC1	ZINC000450817341	EF	On-Demand	Anodyne	MTNR1A	49	44
COC(=O)C1(CNC(=O)CCOc2cccc(OC)c2)CCCCC1	ZINC000450817341	EF	On-Demand	Anodyne	MTNR1B	41	39
COC(=O)c1n[nH]c2c1CN(c1ncnc3ccsc13)CC2	ZINC000450817345	DD	On-Demand	Anodyne	SIRT1	50	32
CO[C@@H]1CN(c2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450817349	GD	On-Demand	Bother	CASP7	41	36
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@@H](O)CCc1ccccc1	ZINC000450817353	GF	On-Demand	Anodyne	ADRB2	18	40
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@@H](O)CCc1ccccc1	ZINC000450817353	GF	On-Demand	Anodyne	ADRB1	31	41
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@@H](O)CCc1ccccc1	ZINC000450817353	GF	On-Demand	Anodyne	PPIA	27	42
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@@H](O)CCc1ccccc1	ZINC000450817353	GF	On-Demand	Anodyne	ADRB3	24	42
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@@H](O)CCc1ccccc1	ZINC000450817353	GF	On-Demand	Anodyne	PTGER3	16	41
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@H](O)CCc1ccccc1	ZINC000450817354	GF	On-Demand	Anodyne	ADRB2	18	40
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@H](O)CCc1ccccc1	ZINC000450817354	GF	On-Demand	Anodyne	ADRB1	31	41
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@H](O)CCc1ccccc1	ZINC000450817354	GF	On-Demand	Anodyne	PPIA	27	42
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@H](O)CCc1ccccc1	ZINC000450817354	GF	On-Demand	Anodyne	ADRB3	24	42
O=C(CNC(=O)Nc1cccc(Cl)c1)NC[C@H](O)CCc1ccccc1	ZINC000450817354	GF	On-Demand	Anodyne	PTGER3	16	41
CCn1c(C)nnc1SCc1cccc(C(C)=O)c1	ZINC000450817373	CG	On-Demand	Anodyne	SLC27A1	45	39
CCOC(=O)[C@H](C)[C@H](C)NC(=O)CCCC(C)C	ZINC000450817376	CF	On-Demand	Anodyne	Q6UB75_PIG	0	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)CCCC(C)C	ZINC000450817376	CF	On-Demand	Anodyne	NOD1	91	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)CCCC(C)C	ZINC000450817377	CF	On-Demand	Anodyne	Q6UB75_PIG	0	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)CCCC(C)C	ZINC000450817377	CF	On-Demand	Anodyne	NOD1	91	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)CCCC(C)C	ZINC000450817378	CF	On-Demand	Anodyne	Q6UB75_PIG	0	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)CCCC(C)C	ZINC000450817378	CF	On-Demand	Anodyne	NOD1	91	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)CCCC(C)C	ZINC000450817379	CF	On-Demand	Anodyne	Q6UB75_PIG	0	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)CCCC(C)C	ZINC000450817379	CF	On-Demand	Anodyne	NOD1	91	41
CO[C@@H]1CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C[C@H]1O	ZINC000450817385	FG	On-Demand	Anodyne	MCHR1	31	41
CO[C@@H]1CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C[C@H]1O	ZINC000450817385	FG	On-Demand	Anodyne	SIRT3	57	30
CO[C@@H]1CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C[C@H]1O	ZINC000450817385	FG	On-Demand	Anodyne	SIRT2	62	30
CO[C@@H]1CN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C[C@H]1O	ZINC000450817385	FG	On-Demand	Anodyne	SIRT1	49	30
CN(CCCC(=O)c1ccccc1)CC[C@@H]1CCCO1	ZINC000450817387	CG	On-Demand	Anodyne	OXTR	25	40
CN(CCCC(=O)c1ccccc1)CC[C@@H]1CCCO1	ZINC000450817387	CG	On-Demand	Anodyne	MGLL	0	43
CN(CCCC(=O)c1ccccc1)CC[C@H]1CCCO1	ZINC000450817388	CG	On-Demand	Anodyne	OXTR	25	40
CN(CCCC(=O)c1ccccc1)CC[C@H]1CCCO1	ZINC000450817388	CG	On-Demand	Anodyne	MGLL	0	43
COc1ccccc1-n1cnc2cc(C(=O)NCC3(CCO)CC3)ccc21	ZINC000450817410	FF	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1-n1cnc2cc(C(=O)NCC3(CCO)CC3)ccc21	ZINC000450817410	FF	On-Demand	Anodyne	CPT1A	46	33
COc1ccccc1-n1cnc2cc(C(=O)NCC3(CCO)CC3)ccc21	ZINC000450817410	FF	On-Demand	Anodyne	HCN1	52	33
COc1ccccc1-n1cnc2cc(C(=O)NCC3(CCO)CC3)ccc21	ZINC000450817410	FF	On-Demand	Anodyne	HCN4	50	33
COc1ccccc1-n1cnc2cc(C(=O)NCC3(CCO)CC3)ccc21	ZINC000450817410	FF	On-Demand	Anodyne	HPGD	46	56
C[C@@H](S[C@@H]1CCCc2ccccc21)C(=O)Nc1nccs1	ZINC000450817411	DI	On-Demand	Anodyne	MAP1	114	36
C[C@@H](S[C@@H]1CCCc2ccccc21)C(=O)Nc1nccs1	ZINC000450817411	DI	On-Demand	Anodyne	GCK	19	41
C[C@H](S[C@H]1CCCc2ccccc21)C(=O)Nc1nccs1	ZINC000450817412	DI	On-Demand	Anodyne	MAP1	114	36
C[C@H](S[C@H]1CCCc2ccccc21)C(=O)Nc1nccs1	ZINC000450817412	DI	On-Demand	Anodyne	GCK	22	41
C[C@@H](S[C@H]1CCCc2ccccc21)C(=O)Nc1nccs1	ZINC000450817413	DI	On-Demand	Anodyne	MAP1	114	36
C[C@@H](S[C@H]1CCCc2ccccc21)C(=O)Nc1nccs1	ZINC000450817413	DI	On-Demand	Anodyne	GCK	22	41
C[C@H](S[C@@H]1CCCc2ccccc21)C(=O)Nc1nccs1	ZINC000450817414	DI	On-Demand	Anodyne	MAP1	114	36
C[C@H](S[C@@H]1CCCc2ccccc21)C(=O)Nc1nccs1	ZINC000450817414	DI	On-Demand	Anodyne	GCK	19	41
CCOC(=O)c1cccnc1N1CC(c2cccc(Cl)c2)C1	ZINC000450817424	DH	On-Demand	Anodyne	P2RY12	50	44
CCOC(=O)c1cccnc1N1CC(c2cccc(Cl)c2)C1	ZINC000450817424	DH	On-Demand	Anodyne	CACNA1B	29	41
CC(=O)c1cccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)c1	ZINC000450817426	EJ	On-Demand	Anodyne	DRD2	15	40
CC(=O)c1cccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)c1	ZINC000450817426	EJ	On-Demand	Anodyne	SSTR5	45	36
CC(=O)c1cccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)c1	ZINC000450817426	EJ	On-Demand	Anodyne	MCHR1	32	40
O=C(c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1)N1CCOCC1	ZINC000450817433	GG	On-Demand	Anodyne	P2RY12	25	41
O=C(c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1)N1CCOCC1	ZINC000450817433	GG	On-Demand	Anodyne	CXCR3	28	41
O=C(c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1)N1CCOCC1	ZINC000450817433	GG	On-Demand	Anodyne	AKR1C3	0	43
COc1cc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)ccc1O	ZINC000450817434	GE	On-Demand	Anodyne	OPRK1	0	42
COc1cc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)ccc1O	ZINC000450817434	GE	On-Demand	Anodyne	SIGMAR1	33	42
COc1cc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)ccc1O	ZINC000450817434	GE	On-Demand	Anodyne	CCR5	17	41
COc1cc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)ccc1O	ZINC000450817434	GE	On-Demand	Anodyne	NPFFR1	47	35
COc1cc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1O	ZINC000450817435	GE	On-Demand	Anodyne	OPRK1	0	42
COc1cc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1O	ZINC000450817435	GE	On-Demand	Anodyne	SIGMAR1	33	42
COc1cc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1O	ZINC000450817435	GE	On-Demand	Anodyne	CCR5	17	41
COc1cc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1O	ZINC000450817435	GE	On-Demand	Anodyne	NPFFR1	47	35
O=C(NCC1(CCO)CC1)c1cc(Cl)c(Br)cc1F	ZINC000450817436	FG	On-Demand	Anodyne	SLC6A9	44	36
O=C(NCC1(CCO)CC1)c1cn(CCc2ccccc2)nn1	ZINC000450817446	DD	On-Demand	Anodyne	NPFFR2	22	42
O=C(NCC1(CCO)CC1)c1cn(CCc2ccccc2)nn1	ZINC000450817446	DD	On-Demand	Anodyne	NPFFR1	39	42
O=C(NCC1(CCO)CC1)c1cn(CCc2ccccc2)nn1	ZINC000450817446	DD	On-Demand	Anodyne	HCN1	49	31
O=C(NCC1(CCO)CC1)c1cn(CCc2ccccc2)nn1	ZINC000450817446	DD	On-Demand	Anodyne	HCN4	47	31
C=CCn1nnnc1SCc1nc(-c2ccc(OC)nn2)no1	ZINC000450817465	ED	On-Demand	Mild	AXIN2	0	41
Cc1ncc([N+](=O)[O-])n1CCc1c(Cl)cccc1Cl	ZINC000450817467	DH	On-Demand	Bother	TYMS	0	46
Cc1ncc([N+](=O)[O-])n1CCc1c(Cl)cccc1Cl	ZINC000450817467	DH	On-Demand	Bother	FABH	0	42
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)C(C)(C)C1CCC1	ZINC000450817468	EF	On-Demand	Anodyne	ACHE	28	42
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)C(C)(C)C1CCC1	ZINC000450817468	EF	On-Demand	Anodyne	NPFFR1	46	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C(C)(C)C1CCC1	ZINC000450817469	EF	On-Demand	Anodyne	ACHE	28	42
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C(C)(C)C1CCC1	ZINC000450817469	EF	On-Demand	Anodyne	NPFFR1	46	34
CCOc1nc2ccc(C(=O)NCC3(CCO)CC3)cc2[nH]1	ZINC000450817470	DD	On-Demand	Anodyne	HCN1	41	32
CCOc1nc2ccc(C(=O)NCC3(CCO)CC3)cc2[nH]1	ZINC000450817470	DD	On-Demand	Anodyne	HCN4	41	32
COC(=O)c1ccccc1C(=O)c1ccc(NC[C@H](C)N(C)C)c([N+](=O)[O-])c1	ZINC000450817481	GF	On-Demand	Bother	COLA	70	32
COC(=O)c1ccccc1C(=O)c1ccc(NC[C@H](C)N(C)C)c([N+](=O)[O-])c1	ZINC000450817481	GF	On-Demand	Bother	TAAR1	16	43
COCCNC(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)nc1	ZINC000450817485	EF	On-Demand	Anodyne	DRD4	44	35
CCS(=O)(=O)c1ccc(CN(CCO)CCCOC)cc1	ZINC000450817500	DD	On-Demand	Anodyne	RORC	16	43
CC[C@@H]1CCC[C@@H]1C(=O)NCc1ncccc1NC(=O)[C@H]1CCC[C@H]1CC	ZINC000450817506	FI	On-Demand	Anodyne	G2YM83_BOTF4	58	35
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccnc1CNC(=O)[C@H]1CCC[C@H]1CC	ZINC000450817507	FI	On-Demand	Anodyne	G2YM83_BOTF4	58	35
CC[C@H]1CCC[C@H]1C(=O)Nc1cccnc1CNC(=O)[C@H]1CCC[C@H]1CC	ZINC000450817508	FI	On-Demand	Anodyne	G2YM83_BOTF4	58	35
CC[C@@H]1CCC[C@@H]1C(=O)NCc1ncccc1NC(=O)[C@@H]1CCC[C@H]1CC	ZINC000450817509	FI	On-Demand	Anodyne	G2YM83_BOTF4	58	35
CC(C)[C@@H]1CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450817514	CF	On-Demand	Anodyne	PRNP	46	36
CC(C)[C@@H]1CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450817514	CF	On-Demand	Anodyne	SCD1	45	47
CC(C)[C@@H]1CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450817514	CF	On-Demand	Anodyne	SCD	25	40
CC(C)[C@H]1CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450817515	CF	On-Demand	Anodyne	PRNP	46	36
CC(C)[C@H]1CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450817515	CF	On-Demand	Anodyne	SCD1	45	47
CC(C)[C@H]1CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450817515	CF	On-Demand	Anodyne	SCD	25	40
CSc1cccc(C(=O)N2CCCCC[C@H]2c2ncon2)c1	ZINC000450817526	DH	On-Demand	Anodyne	COLA	102	39
CSc1cccc(C(=O)N2CCCCC[C@H]2c2ncon2)c1	ZINC000450817526	DH	On-Demand	Anodyne	CPT1A	99	39
CSc1cccc(C(=O)N2CCCCC[C@H]2c2ncon2)c1	ZINC000450817526	DH	On-Demand	Anodyne	PREP	26	42
CSc1cccc(C(=O)N2CCCCC[C@H]2c2ncon2)c1	ZINC000450817526	DH	On-Demand	Anodyne	GRM5	0	46
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2ncon2)c1	ZINC000450817527	DH	On-Demand	Anodyne	COLA	102	39
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2ncon2)c1	ZINC000450817527	DH	On-Demand	Anodyne	CPT1A	73	39
CSc1cccc(C(=O)N2CCCCC[C@@H]2c2ncon2)c1	ZINC000450817527	DH	On-Demand	Anodyne	GRM5	0	46
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1)N1CCCCC1	ZINC000450817551	GE	On-Demand	Anodyne	GCK	46	30
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)nc1)N1CCCCC1	ZINC000450817551	GE	On-Demand	Anodyne	GCKR	68	34
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1)N1CCCCC1	ZINC000450817552	GE	On-Demand	Anodyne	GCK	46	30
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)nc1)N1CCCCC1	ZINC000450817552	GE	On-Demand	Anodyne	GCKR	68	34
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1)N1CCCCC1	ZINC000450817553	GE	On-Demand	Anodyne	GCK	46	30
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)nc1)N1CCCCC1	ZINC000450817553	GE	On-Demand	Anodyne	GCKR	68	34
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1)N1CCCCC1	ZINC000450817554	GE	On-Demand	Anodyne	GCK	46	30
O=S(=O)(c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)nc1)N1CCCCC1	ZINC000450817554	GE	On-Demand	Anodyne	GCKR	68	34
CC(C)[C@H]1CCN1c1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450817563	DH	On-Demand	Anodyne	CYP11B2	44	36
CC(C)[C@@H]1CCN1c1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450817564	DH	On-Demand	Anodyne	CYP11B2	44	36
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc(C#N)n1	ZINC000450817565	CE	On-Demand	Mild	GPR119	19	41
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc(C#N)n1	ZINC000450817566	CE	On-Demand	Mild	GPR119	19	41
Cc1cc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc(C#N)n1	ZINC000450817567	CE	On-Demand	Mild	GPR119	19	41
Cc1cc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc(C#N)n1	ZINC000450817568	CE	On-Demand	Mild	GPR119	19	41
COc1cccc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nccc12	ZINC000450817570	DG	On-Demand	Anodyne	PDE3A	28	41
COc1cccc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)nccc12	ZINC000450817570	DG	On-Demand	Anodyne	PDE3B	70	39
COc1cccc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nccc12	ZINC000450817571	DG	On-Demand	Anodyne	PDE3A	28	41
COc1cccc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)nccc12	ZINC000450817571	DG	On-Demand	Anodyne	PDE3B	70	39
COc1cccc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nccc12	ZINC000450817572	DG	On-Demand	Anodyne	PDE3A	28	41
COc1cccc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)nccc12	ZINC000450817572	DG	On-Demand	Anodyne	PDE3B	70	39
COc1cccc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nccc12	ZINC000450817574	DG	On-Demand	Anodyne	PDE3A	28	41
COc1cccc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)nccc12	ZINC000450817574	DG	On-Demand	Anodyne	PDE3B	70	39
CCS(=O)(=O)C1CN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450817579	GF	On-Demand	Anodyne	ADRB2	15	44
CCS(=O)(=O)C1CN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450817579	GF	On-Demand	Anodyne	ADRB3	28	43
CCS(=O)(=O)C1CN(c2cc(C#N)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450817588	ED	On-Demand	Mild	F2RL3	43	30
CO[C@@H]1CN(c2noc(-c3ccccc3)n2)C[C@H]1O	ZINC000450817630	CC	On-Demand	Anodyne	LUCI_PHOPE	21	40
CCn1c(C)nnc1SCC/C=C\c1ccccc1	ZINC000450817631	CH	On-Demand	Anodyne	SLC27A1	40	32
CCn1c(C)nnc1SCC/C=C/c1ccccc1	ZINC000450817632	CH	On-Demand	Anodyne	SLC27A1	40	32
CO[C@@H]1CN(c2ncc(C(F)(F)F)s2)C[C@H]1O	ZINC000450817635	CD	On-Demand	Anodyne	MLYCD	61	40
COC(=O)c1n[nH]c2c1CN(c1ncnc3cccc(C)c13)CC2	ZINC000450817638	DE	On-Demand	Anodyne	LIMK2	40	32
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(Br)cc1C#N	ZINC000450817639	FF	On-Demand	Mild	SDH1	0	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(Br)cc1C#N	ZINC000450817639	FF	On-Demand	Mild	CTRB_BOVIN	46	34
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(Br)cc1C#N	ZINC000450817640	FF	On-Demand	Mild	SDH1	0	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(Br)cc1C#N	ZINC000450817640	FF	On-Demand	Mild	CTRB_BOVIN	46	34
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(Br)cc1C#N	ZINC000450817641	FF	On-Demand	Mild	SDH1	0	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(Br)cc1C#N	ZINC000450817641	FF	On-Demand	Mild	CTRB_BOVIN	46	34
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(Br)cc1C#N	ZINC000450817642	FF	On-Demand	Mild	SDH1	0	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(Br)cc1C#N	ZINC000450817642	FF	On-Demand	Mild	CTRB_BOVIN	46	34
CO[C@@H]1CN(c2ncc(-c3ccccc3)s2)C[C@H]1O	ZINC000450817670	CE	On-Demand	Anodyne	LUCI_LUCLA	17	43
CO[C@@H]1CN(c2nc(-c3cccnc3)nc(C)c2C)C[C@H]1O	ZINC000450817684	DD	On-Demand	Anodyne	ROS1	37	40
C=CCCN(C)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450817685	CE	On-Demand	Mild	RORC	17	40
COC(=O)C1(CNC(=O)c2ccc(C)nc2C(C)C)CCCCC1	ZINC000450817689	EG	On-Demand	Anodyne	HCN1	40	35
COC(=O)C1(CNC(=O)c2ccc(C)nc2C(C)C)CCCCC1	ZINC000450817689	EG	On-Demand	Anodyne	HCN4	52	37
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)C1(C(=O)C2CC2)CC1	ZINC000450817725	FD	On-Demand	Anodyne	NPFFR1	51	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C1(C(=O)C2CC2)CC1	ZINC000450817726	FD	On-Demand	Anodyne	NPFFR1	51	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450817728	EF	On-Demand	Anodyne	NPFFR1	42	32
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450817729	EF	On-Demand	Anodyne	NPFFR1	42	32
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450817730	EF	On-Demand	Anodyne	NPFFR1	42	32
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450817731	EF	On-Demand	Anodyne	NPFFR1	42	32
COCCOC[C@@H](O)CNC(C)(C)CC1CCCCCC1	ZINC000450817747	DF	On-Demand	Anodyne	ADRB2	46	46
COCCOC[C@@H](O)CNC(C)(C)CC1CCCCCC1	ZINC000450817747	DF	On-Demand	Anodyne	ADRB1	32	46
COCCOC[C@H](O)CNC(C)(C)CC1CCCCCC1	ZINC000450817748	DF	On-Demand	Anodyne	ADRB2	46	46
COCCOC[C@H](O)CNC(C)(C)CC1CCCCCC1	ZINC000450817748	DF	On-Demand	Anodyne	ADRB1	32	46
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(C#N)n1C	ZINC000450817766	FD	On-Demand	Mild	NPFFR1	47	33
O[C@@H]1CC[C@H]2CN(c3ncccc3OCc3ccccc3)CC[C@@H]2C1	ZINC000450817772	EH	On-Demand	Anodyne	PPIA	44	35
O[C@@H]1CC[C@H]2CN(c3ncccc3OCc3ccccc3)CC[C@H]2C1	ZINC000450817773	EH	On-Demand	Anodyne	PPIA	44	35
O[C@@H]1CC[C@@H]2CN(c3ncccc3OCc3ccccc3)CC[C@@H]2C1	ZINC000450817774	EH	On-Demand	Anodyne	PPIA	44	35
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(C#N)n1C	ZINC000450817775	FD	On-Demand	Mild	NPFFR1	47	33
O[C@@H]1CC[C@@H]2CN(c3ncccc3OCc3ccccc3)CC[C@H]2C1	ZINC000450817776	EH	On-Demand	Anodyne	PPIA	44	35
CCc1cccc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450817778	FE	On-Demand	Anodyne	NPFFR1	56	36
CCc1cccc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000450817780	FE	On-Demand	Anodyne	NPFFR1	56	36
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CCCCC1(F)F	ZINC000450817781	FF	On-Demand	Anodyne	SIGMAR1	40	36
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CCCCC1(F)F	ZINC000450817781	FF	On-Demand	Anodyne	NPFFR1	46	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CCCCC1(F)F	ZINC000450817782	FF	On-Demand	Anodyne	SIGMAR1	40	36
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CCCCC1(F)F	ZINC000450817782	FF	On-Demand	Anodyne	NPFFR1	46	34
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CCCCC1(F)F	ZINC000450817783	FF	On-Demand	Anodyne	SIGMAR1	40	36
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CCCCC1(F)F	ZINC000450817783	FF	On-Demand	Anodyne	NPFFR1	46	34
CO[C@@H]1CN(c2nc(-c3ccccc3)cs2)C[C@H]1O	ZINC000450817785	CE	On-Demand	Anodyne	EGFR	0	44
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CCCCC1(F)F	ZINC000450817791	FF	On-Demand	Anodyne	SIGMAR1	40	36
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CCCCC1(F)F	ZINC000450817791	FF	On-Demand	Anodyne	NPFFR1	46	34
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCCCC[C@H]2c2ncon2)cn1	ZINC000450817792	FG	On-Demand	Anodyne	COLA	52	36
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCCCC[C@H]2c2ncon2)cn1	ZINC000450817792	FG	On-Demand	Anodyne	CPT1A	47	34
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCCCC[C@@H]2c2ncon2)cn1	ZINC000450817794	FG	On-Demand	Anodyne	COLA	52	36
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCCCC[C@@H]2c2ncon2)cn1	ZINC000450817794	FG	On-Demand	Anodyne	CPT1A	47	34
COc1cc(OC)c2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)c2c1	ZINC000450817801	EF	On-Demand	Anodyne	PDE3A	54	42
COc1cc(OC)c2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)c2c1	ZINC000450817802	EF	On-Demand	Anodyne	PDE3A	54	42
COc1cc(OC)c2ncnc(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)c2c1	ZINC000450817803	EF	On-Demand	Anodyne	PDE3A	54	42
COc1cc(OC)c2ncnc(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)c2c1	ZINC000450817804	EF	On-Demand	Anodyne	PDE3A	54	42
Cc1ccc(F)c(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450817824	FF	On-Demand	Anodyne	SIGMAR1	24	40
Cc1ccc(F)c(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450817824	FF	On-Demand	Anodyne	NPFFR1	45	32
Cc1ccc(F)c(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450817826	FF	On-Demand	Anodyne	SIGMAR1	24	40
Cc1ccc(F)c(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450817826	FF	On-Demand	Anodyne	NPFFR1	45	32
CCS(=O)(=O)C1CN(c2cnc3cc(Cl)c(Cl)cc3n2)C1	ZINC000450817847	EF	On-Demand	Anodyne	GLP1R	57	39
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ncnc2cc1F	ZINC000450817851	EF	On-Demand	Anodyne	PDE3A	64	48
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ncnc2cc1F	ZINC000450817851	EF	On-Demand	Anodyne	PDGFRB	68	41
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)ncnc2cc1F	ZINC000450817851	EF	On-Demand	Anodyne	PDE3B	94	48
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ncnc2cc1F	ZINC000450817855	EF	On-Demand	Anodyne	PDE3A	64	48
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ncnc2cc1F	ZINC000450817855	EF	On-Demand	Anodyne	PDGFRB	68	41
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@H]4C3)ncnc2cc1F	ZINC000450817855	EF	On-Demand	Anodyne	PDE3B	94	48
Cc1csc([C@H]2COCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450817858	GI	On-Demand	Anodyne	RBP4	62	35
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ncnc2cc1F	ZINC000450817859	EF	On-Demand	Anodyne	PDE3A	64	48
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ncnc2cc1F	ZINC000450817859	EF	On-Demand	Anodyne	PDGFRB	68	41
COc1cc2c(N3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)ncnc2cc1F	ZINC000450817859	EF	On-Demand	Anodyne	PDE3B	94	48
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ncnc2cc1F	ZINC000450817862	EF	On-Demand	Anodyne	PDE3A	64	48
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ncnc2cc1F	ZINC000450817862	EF	On-Demand	Anodyne	PDGFRB	68	41
COc1cc2c(N3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)ncnc2cc1F	ZINC000450817862	EF	On-Demand	Anodyne	PDE3B	94	48
O[C@@H]1CC[C@@H]2CN(c3cc(C(F)(F)F)ccn3)CC[C@H]2C1	ZINC000450817879	DG	On-Demand	Anodyne	LIPG	45	32
O[C@@H]1CC[C@H]2CN(c3cc(C(F)(F)F)ccn3)CC[C@H]2C1	ZINC000450817882	DG	On-Demand	Anodyne	LIPG	45	32
O[C@@H]1CC[C@@H]2CN(c3cc(C(F)(F)F)ccn3)CC[C@@H]2C1	ZINC000450817885	DG	On-Demand	Anodyne	LIPG	45	32
O[C@@H]1CC[C@H]2CN(c3cc(C(F)(F)F)ccn3)CC[C@@H]2C1	ZINC000450817887	DG	On-Demand	Anodyne	LIPG	45	32
COc1cccc(Cc2nnc(SCc3ccn(CC(F)(F)F)n3)o2)c1	ZINC000450817892	GH	On-Demand	Anodyne	PTK2	0	49
Cc1nn(C)cc1CC(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450817921	FD	On-Demand	Anodyne	NPFFR1	42	32
Cc1nn(C)cc1CC(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450817922	FD	On-Demand	Anodyne	NPFFR1	42	32
CC(C)[C@H]1CCN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450817932	CE	On-Demand	Anodyne	DHOD	0	42
CC(C)[C@@H]1CCN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450817939	CE	On-Demand	Anodyne	DHOD	0	42
CN(CC[C@@H]1CCCO1)CCN(C)Cc1ccccc1	ZINC000450817947	CF	On-Demand	Anodyne	OXTR	25	45
CN(CC[C@@H]1CCCO1)CCN(C)Cc1ccccc1	ZINC000450817947	CF	On-Demand	Anodyne	AVPR1A	0	45
CN(CC[C@H]1CCCO1)CCN(C)Cc1ccccc1	ZINC000450817948	CF	On-Demand	Anodyne	OXTR	25	45
CN(CC[C@H]1CCCO1)CCN(C)Cc1ccccc1	ZINC000450817948	CF	On-Demand	Anodyne	AVPR1A	0	45
CO[C@@H]1CN(c2nc3cccc(C)c3s2)C[C@H]1O	ZINC000450817950	CD	On-Demand	Anodyne	PARE	15	42
COc1cccc(Cc2nnc(SCc3nnc(C4CC4)s3)o2)c1	ZINC000450817963	FH	On-Demand	Anodyne	CPB	0	46
CNS(=O)(=O)NCC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450817971	DB	On-Demand	Anodyne	MMP8	15	46
CNS(=O)(=O)NCC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450817972	DB	On-Demand	Anodyne	MMP8	15	46
COC(=O)c1n[nH]c2c1CN(c1cc([N+](=O)[O-])ccc1C(C)=O)CC2	ZINC000450817977	ED	On-Demand	Bother	CACNA1D	47	32
O=C(NC[C@@H]1CC12CCOCC2)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450817987	FH	On-Demand	Anodyne	RBP4	52	32
O=C(NC[C@H]1CC12CCOCC2)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450817988	FH	On-Demand	Anodyne	RBP4	52	32
COC(=O)c1ccc([N+](=O)[O-])c(OCc2cn(C)nc2C)c1	ZINC000450818021	DE	On-Demand	Bother	CACNA1D	40	32
CCS(=O)(=O)C1CN(c2nc(C)ccc2C#N)C1	ZINC000450818024	CC	On-Demand	Mild	P2RY12	22	42
C=CCCN(C)CCN(C)Cc1ccccc1	ZINC000450818028	BF	On-Demand	Mild	G6PC	50	30
O=[N+]([O-])c1cnc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)nc1	ZINC000450818029	GE	On-Demand	Bother	STAT6	47	34
CNS(=O)(=O)c1ccc(N2CCc3[nH]nc(C(=O)OC)c3C2)c(F)c1	ZINC000450818035	FC	On-Demand	Anodyne	SLC6A9	0	44
CS(=O)(=O)N1CC(CNC(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450818067	EC	On-Demand	Anodyne	CACNA1I	43	34
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H](O)C1CCC1	ZINC000450818100	CC	On-Demand	Anodyne	METAP2	28	46
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H](O)C1CCC1	ZINC000450818102	CC	On-Demand	Anodyne	METAP2	28	46
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H](O)C1CCC1	ZINC000450818103	CC	On-Demand	Anodyne	METAP2	28	46
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H](O)C1CCC1	ZINC000450818105	CC	On-Demand	Anodyne	METAP2	28	46
C[C@H](O)CCN1C(=O)N[C@](C)(CCc2ccc3c(c2)OCO3)C1=O	ZINC000450818127	ED	On-Demand	Anodyne	SCN9A	25	42
C[C@@H](O)CCN1C(=O)N[C@@](C)(CCc2ccc3c(c2)OCO3)C1=O	ZINC000450818128	ED	On-Demand	Anodyne	SCN9A	25	42
C[C@H](O)CCN1C(=O)N[C@@](C)(CCc2ccc3c(c2)OCO3)C1=O	ZINC000450818129	ED	On-Demand	Anodyne	SCN9A	25	42
C[C@@H](O)CCN1C(=O)N[C@](C)(CCc2ccc3c(c2)OCO3)C1=O	ZINC000450818130	ED	On-Demand	Anodyne	SCN9A	25	42
CCn1c(C)nnc1SCCN(C)Cc1ccccc1	ZINC000450818131	CF	On-Demand	Anodyne	SLC27A1	41	35
CC(=O)Nc1cccnc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450818172	DE	On-Demand	Anodyne	NPY5R	15	42
O[C@@H]1CC[C@@H]2CN(c3ncc(C(F)(F)F)s3)CC[C@H]2C1	ZINC000450818188	DG	On-Demand	Anodyne	MLYCD	29	40
O[C@@H]1CC[C@H]2CN(c3ncc(C(F)(F)F)s3)CC[C@@H]2C1	ZINC000450818189	DG	On-Demand	Anodyne	MLYCD	29	40
O[C@@H]1CC[C@H]2CN(c3ncc(C(F)(F)F)s3)CC[C@H]2C1	ZINC000450818190	DG	On-Demand	Anodyne	MLYCD	29	40
O[C@@H]1CC[C@@H]2CN(c3ncc(C(F)(F)F)s3)CC[C@@H]2C1	ZINC000450818191	DG	On-Demand	Anodyne	MLYCD	29	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450818193	EE	On-Demand	Anodyne	CTSV	47	33
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450818193	EE	On-Demand	Anodyne	AGER	0	44
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450818195	EE	On-Demand	Anodyne	CTSV	47	33
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450818195	EE	On-Demand	Anodyne	AGER	0	44
Cc1cccc(Cl)c1C(=O)NCCc1nnc2n1CCCC2	ZINC000450818197	DF	On-Demand	Anodyne	DRD4	41	33
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450818198	EE	On-Demand	Anodyne	CTSV	47	33
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450818198	EE	On-Demand	Anodyne	AGER	0	44
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450818200	EE	On-Demand	Anodyne	CTSV	47	33
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450818200	EE	On-Demand	Anodyne	AGER	0	44
COc1ccc(-c2nnc(N3C[C@@H](O)[C@H](OC)C3)c3ccccc23)cc1	ZINC000450818201	FF	On-Demand	Anodyne	SMO	48	42
COc1ccc(-c2noc(=O)n2CC[C@@H](C)O)cc1OC	ZINC000450818211	CD	On-Demand	Anodyne	PDEB1	0	40
COc1ccc(-c2noc(=O)n2CC[C@H](C)O)cc1OC	ZINC000450818212	CD	On-Demand	Anodyne	PDEB1	0	40
CCc1cc(CCCSc2nnc(Cc3cccc(OC)c3)o2)on1	ZINC000450818217	FH	On-Demand	Anodyne	CPB	0	44
CS(=O)(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)cc1	ZINC000450818228	DG	On-Demand	Anodyne	PTGS2	36	42
C[C@@H](CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])N(C)C	ZINC000450818232	GF	On-Demand	Bother	COLA	103	36
C[C@@H](CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])N(C)C	ZINC000450818232	GF	On-Demand	Bother	MTNN	83	41
C[C@@H](CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])N(C)C	ZINC000450818232	GF	On-Demand	Bother	BCL2L1	100	37
C[C@@H](CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])N(C)C	ZINC000450818232	GF	On-Demand	Bother	BCL2	87	36
C[C@@H](CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])N(C)C	ZINC000450818232	GF	On-Demand	Bother	MCL1	0	40
C[C@@H](CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])N(C)C	ZINC000450818232	GF	On-Demand	Bother	LIMK2	50	38
CC(=O)Nc1cccnc1NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450818239	GG	On-Demand	Anodyne	TRPV1	20	53
CC(=O)Nc1cccnc1NC(=O)[C@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000450818239	GG	On-Demand	Anodyne	MAP3K5	40	32
CCCNC(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)nc1	ZINC000450818256	EG	On-Demand	Anodyne	HDAC1	0	40
CSc1cccc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450818265	FG	On-Demand	Anodyne	NPFFR1	52	35
CSc1cccc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450818266	FG	On-Demand	Anodyne	NPFFR1	52	35
O=C(NCC1(CCO)CC1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450818282	FF	On-Demand	Anodyne	PYGL	54	37
C[C@@H](CNc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])N(C)C	ZINC000450818287	GF	On-Demand	Bother	BDKRB1	23	44
Cc1cccc(Cl)c1Cn1c([N+](=O)[O-])cnc1C	ZINC000450818301	CG	On-Demand	Bother	FABH	0	40
C[C@H](Nc1ncccc1C(=O)N1CCCCC1)C(=O)NCCc1ccccc1	ZINC000450818318	GF	On-Demand	Anodyne	PREP	21	40
C[C@H](Nc1ncccc1C(=O)N1CCCCC1)C(=O)NCCc1ccccc1	ZINC000450818318	GF	On-Demand	Anodyne	DPP7	38	41
C[C@H](Nc1ncccc1C(=O)N1CCCCC1)C(=O)NCCc1ccccc1	ZINC000450818318	GF	On-Demand	Anodyne	SCD	15	40
C[C@H](Nc1ncccc1C(=O)N1CCCCC1)C(=O)NCCc1ccccc1	ZINC000450818318	GF	On-Demand	Anodyne	Q6PRC7_IXORI	16	43
Cc1cc(C)c(C#N)c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450818326	DF	On-Demand	Mild	MAPK9	0	43
Cc1cc(C)c(C#N)c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450818326	DF	On-Demand	Mild	AMP1_PLAFQ	26	40
C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)C(=O)NCCc1ccccc1	ZINC000450818327	GF	On-Demand	Bother	AMP1_PLAFQ	27	41
COC(=O)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450818328	ED	On-Demand	Anodyne	FAAH	48	45
COC(=O)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450818328	ED	On-Demand	Anodyne	CES1	33	41
COC(=O)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450818328	ED	On-Demand	Anodyne	CAPN2	41	38
COC(=O)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450818328	ED	On-Demand	Anodyne	NPR	43	38
COC(=O)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450818328	ED	On-Demand	Anodyne	AMP1_PLAFQ	32	44
CCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nn1	ZINC000450818341	EC	On-Demand	Anodyne	AMP1_PLAFQ	30	42
CCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nn1	ZINC000450818341	EC	On-Demand	Anodyne	SCD1	16	40
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@H]2CCC[C@@H]21	ZINC000450818343	DI	On-Demand	Anodyne	RBP4	74	43
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@H]2CCC[C@H]21	ZINC000450818344	DI	On-Demand	Anodyne	RBP4	92	43
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@H]2CCC[C@H]21	ZINC000450818344	DI	On-Demand	Anodyne	WNT3	40	31
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@@H]2CCC[C@H]21	ZINC000450818345	DI	On-Demand	Anodyne	RBP4	92	43
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@@H]2CCC[C@H]21	ZINC000450818345	DI	On-Demand	Anodyne	WNT3	40	31
O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N1CC[C@@H]2CCC[C@@H]21	ZINC000450818346	DI	On-Demand	Anodyne	RBP4	74	43
CCc1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450818355	DD	On-Demand	Anodyne	AMP1_PLAFQ	27	44
Cc1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450818356	EG	On-Demand	Bother	AMP1_PLAFQ	27	41
COc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450818360	DD	On-Demand	Anodyne	MTNR1A	29	41
COc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450818360	DD	On-Demand	Anodyne	MTNR1B	27	41
COc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450818360	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	42
CC(C)NC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450818365	FF	On-Demand	Bother	TAAR1	22	46
CC(C)NC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450818366	FF	On-Demand	Bother	TAAR1	22	46
CC(C)NC(=O)c1ccc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450818367	FF	On-Demand	Bother	TAAR1	22	46
CC(C)NC(=O)c1ccc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000450818368	FF	On-Demand	Bother	TAAR1	22	46
NC(=O)c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(Cl)c1	ZINC000450818378	DD	On-Demand	Anodyne	CXCR3	33	49
NC(=O)c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(Cl)c1	ZINC000450818379	DD	On-Demand	Anodyne	CXCR3	33	49
NC(=O)c1cnc(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(Cl)c1	ZINC000450818381	DD	On-Demand	Anodyne	CXCR3	33	49
NC(=O)c1cnc(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(Cl)c1	ZINC000450818384	DD	On-Demand	Anodyne	CXCR3	33	49
CCCc1cc(C(=O)NCc2ncccc2NC(=O)c2cc(CCC)on2)no1	ZINC000450818387	GG	On-Demand	Anodyne	G2YM83_BOTF4	69	37
CCOC(=O)c1cnn(Cc2ccn(CCc3ccccc3)n2)c1C(F)F	ZINC000450818392	FG	On-Demand	Anodyne	ADORA1	0	41
COc1ccc(-c2noc(=O)n2C[C@H](Cc2ccccc2)OC)cc1OC	ZINC000450818393	FF	On-Demand	Anodyne	PDEB1	0	40
COc1ccc(-c2noc(=O)n2C[C@@H](Cc2ccccc2)OC)cc1OC	ZINC000450818396	FF	On-Demand	Anodyne	PDEB1	0	40
Cc1ccc2oc(NC[C@H](NS(=O)(=O)N(C)C)C3CCCC3)nc2c1	ZINC000450818398	FD	On-Demand	Anodyne	FBP1	18	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450818399	FD	On-Demand	Anodyne	CA2	29	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450818400	FD	On-Demand	Anodyne	CA2	29	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450818401	FD	On-Demand	Anodyne	CA2	29	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450818402	FD	On-Demand	Anodyne	CA2	29	41
Cc1ccc2oc(NC[C@@H](NS(=O)(=O)N(C)C)C3CCCC3)nc2c1	ZINC000450818405	FD	On-Demand	Anodyne	FBP1	18	42
CC1(C)CC[C@H](CNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)O1	ZINC000450818407	FE	On-Demand	Anodyne	CACNA1I	57	35
CC1(C)CC[C@@H](CNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)O1	ZINC000450818408	FE	On-Demand	Anodyne	CACNA1I	57	35
CCOc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450818414	FG	On-Demand	Bother	GSTM2	43	35
CCOc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450818414	FG	On-Demand	Bother	COLA	57	33
CCS(=O)(=O)C1CN(c2ccnc(C(C)C)n2)C1	ZINC000450818415	CD	On-Demand	Anodyne	SORD	106	43
C[C@H](N=c1[nH]ncs1)C(=O)NCCc1ccccc1	ZINC000450818418	CD	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CNC(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450818419	ED	On-Demand	Anodyne	ANPEP	24	42
CNC(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450818419	ED	On-Demand	Anodyne	AMP1_PLAFQ	27	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H](CC)CC(C)C	ZINC000450818439	CF	On-Demand	Anodyne	NPR	16	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H](CC)CC(C)C	ZINC000450818440	CF	On-Demand	Anodyne	NPR	16	42
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H](CC)CC(C)C	ZINC000450818442	CF	On-Demand	Anodyne	NPR	16	42
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H](CC)CC(C)C	ZINC000450818443	CF	On-Demand	Anodyne	NPR	16	42
COc1cc2c(N3C[C@@H](O)[C@H](OC)C3)ccnc2cc1F	ZINC000450818445	CD	On-Demand	Anodyne	PDE3A	46	36
COc1cc2c(N3C[C@@H](O)[C@H](OC)C3)ccnc2cc1F	ZINC000450818445	CD	On-Demand	Anodyne	PDE3B	68	36
CC(F)(F)CCOc1ccc(F)cc1[N+](=O)[O-]	ZINC000450818447	BG	On-Demand	Bother	S1PR4	0	44
COC(=O)c1n[nH]c2c1CN(c1cccc(C)c1[N+](=O)[O-])CC2	ZINC000450818461	DD	On-Demand	Bother	CACNA1D	61	32
Cc1nc2ccccc2c(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c1C	ZINC000450818465	DH	On-Demand	Anodyne	ADRA2B	0	41
Cc1nc2ccccc2c(N2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c1C	ZINC000450818465	DH	On-Demand	Anodyne	ADRA2C	15	41
Cc1nc2ccccc2c(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c1C	ZINC000450818468	DH	On-Demand	Anodyne	ADRA2B	0	41
Cc1nc2ccccc2c(N2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c1C	ZINC000450818468	DH	On-Demand	Anodyne	ADRA2C	0	41
Cc1nc2ccccc2c(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c1C	ZINC000450818471	DH	On-Demand	Anodyne	ADRA2B	0	41
Cc1nc2ccccc2c(N2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c1C	ZINC000450818471	DH	On-Demand	Anodyne	ADRA2C	15	41
Cc1nc2ccccc2c(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c1C	ZINC000450818474	DH	On-Demand	Anodyne	ADRA2B	0	41
Cc1nc2ccccc2c(N2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c1C	ZINC000450818474	DH	On-Demand	Anodyne	ADRA2C	15	41
CC(C)c1n[nH]c(=N[C@@H](C)C(=O)NCCc2ccccc2)o1	ZINC000450818479	DD	On-Demand	Anodyne	AMP1_PLAFQ	27	42
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450818480	FF	On-Demand	Bother	COLA	60	34
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450818480	FF	On-Demand	Bother	AMP1_PLAFQ	27	41
CC(C)OC(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450818491	FF	On-Demand	Anodyne	AMP1_PLAFQ	31	43
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1[N+](=O)[O-]	ZINC000450818495	ED	On-Demand	Bother	COLA	64	34
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1[N+](=O)[O-]	ZINC000450818495	ED	On-Demand	Bother	PRKCQ	0	41
COc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncn1	ZINC000450818504	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	42
COc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncn1	ZINC000450818504	DD	On-Demand	Anodyne	CARM1	45	31
C[C@@H]1C(=O)NCCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450818506	FF	On-Demand	Anodyne	CYP2J2	47	33
C[C@H]1C(=O)NCCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450818507	FF	On-Demand	Anodyne	CYP2J2	47	33
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450818536	DD	On-Demand	Anodyne	MMP13	0	42
CNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450818537	FE	On-Demand	Bother	COLA	58	35
CNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450818537	FE	On-Demand	Bother	TAAR1	18	43
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450818538	DD	On-Demand	Anodyne	MMP13	0	42
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450818540	DD	On-Demand	Anodyne	MMP13	0	42
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450818541	DD	On-Demand	Anodyne	MMP13	0	42
CO[C@@H]1CN(c2ccc(S(=O)(=O)NCC3CC3)cn2)C[C@H]1O	ZINC000450818544	EB	On-Demand	Anodyne	NPY2R	53	37
CCn1c(C)nnc1SCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450818564	EG	On-Demand	Anodyne	SLC27A1	41	37
COc1ccc2c(N3C[C@@H](O)[C@H](OC)C3)ncnc2c1F	ZINC000450818579	CC	On-Demand	Anodyne	PDE3A	45	36
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cn(CC2CC2)nn1	ZINC000450818584	FD	On-Demand	Anodyne	NPFFR1	48	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cn(CC2CC2)nn1	ZINC000450818585	FD	On-Demand	Anodyne	NPFFR1	48	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450818587	FE	On-Demand	Anodyne	NPFFR1	46	33
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450818588	FE	On-Demand	Anodyne	NPFFR1	46	33
Cc1csc([C@@H]2COCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)n1	ZINC000450818591	GI	On-Demand	Anodyne	PRCP	53	36
Cc1csc([C@@H]2COCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)n1	ZINC000450818592	GI	On-Demand	Anodyne	PRCP	53	36
Cc1csc([C@@H]2COCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)n1	ZINC000450818593	GI	On-Demand	Anodyne	PRCP	53	36
Cc1csc([C@@H]2COCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)n1	ZINC000450818594	GI	On-Demand	Anodyne	PRCP	53	36
CC(=O)Nc1cccnc1NC(=O)c1ccc(C)c2c1CCC2	ZINC000450818598	DG	On-Demand	Anodyne	G2YM83_BOTF4	63	37
CC[C@H](CC(F)(F)F)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450818601	FG	On-Demand	Anodyne	NPFFR1	47	36
CC[C@@H](CC(F)(F)F)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450818602	FG	On-Demand	Anodyne	NPFFR1	47	36
CC[C@H](CC(F)(F)F)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450818603	FG	On-Demand	Anodyne	NPFFR1	47	36
CC[C@@H](CC(F)(F)F)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450818604	FG	On-Demand	Anodyne	NPFFR1	47	36
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cncc(Cl)c1	ZINC000450818605	FE	On-Demand	Anodyne	TACR2	40	38
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cncc(Cl)c1	ZINC000450818605	FE	On-Demand	Anodyne	NPFFR1	52	36
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cncc(Cl)c1	ZINC000450818606	FE	On-Demand	Anodyne	TACR2	40	38
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cncc(Cl)c1	ZINC000450818606	FE	On-Demand	Anodyne	NPFFR1	52	36
COc1cc(CN2CCN(CC(C)(C)O)[C@H](C)C2)ccc1Cl	ZINC000450818617	EF	On-Demand	Anodyne	CCR1	38	44
COc1cc(CN2CCN(CC(C)(C)O)[C@@H](C)C2)ccc1Cl	ZINC000450818618	EF	On-Demand	Anodyne	CCR1	38	44
OC[C@H]1C[C@@H](F)CN1CCc1ccc(Cl)cc1	ZINC000450818658	CE	On-Demand	Anodyne	SPHK2	71	40
OC[C@H]1C[C@@H](F)CN1CCc1ccc(Cl)cc1	ZINC000450818658	CE	On-Demand	Anodyne	SPHK1	31	40
OC[C@@H]1C[C@@H](F)CN1CCc1ccc(Cl)cc1	ZINC000450818659	CE	On-Demand	Anodyne	SPHK2	71	40
OC[C@@H]1C[C@@H](F)CN1CCc1ccc(Cl)cc1	ZINC000450818659	CE	On-Demand	Anodyne	SPHK1	31	40
OC[C@H]1C[C@H](F)CN1CCc1ccc(Cl)cc1	ZINC000450818660	CE	On-Demand	Anodyne	SPHK2	71	40
OC[C@H]1C[C@H](F)CN1CCc1ccc(Cl)cc1	ZINC000450818660	CE	On-Demand	Anodyne	SPHK1	31	40
OC[C@@H]1C[C@H](F)CN1CCc1ccc(Cl)cc1	ZINC000450818661	CE	On-Demand	Anodyne	SPHK2	71	40
OC[C@@H]1C[C@H](F)CN1CCc1ccc(Cl)cc1	ZINC000450818661	CE	On-Demand	Anodyne	SPHK1	31	40
CCOC(=O)c1ccc(Cn2c([N+](=O)[O-])cnc2C)nc1	ZINC000450818663	CD	On-Demand	Bother	TYMS	32	40
CO[C@@H]1CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450818692	GD	On-Demand	Bother	GHSR	0	40
CO[C@@H]1CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450818692	GD	On-Demand	Bother	BCL2L1	68	33
CO[C@@H]1CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450818692	GD	On-Demand	Bother	BCL2	62	33
O=S(=O)(NCC1CC1)c1ccc(NCCC2(CO)CC2)nc1	ZINC000450818700	EC	On-Demand	Anodyne	NPY1R	43	35
O=S(=O)(NCC1CC1)c1ccc(NCCC2(CO)CC2)nc1	ZINC000450818700	EC	On-Demand	Anodyne	NPY2R	62	37
O[C@H]1CCCC[C@@H]1CNc1cncc(-c2ccccc2)n1	ZINC000450818703	CG	On-Demand	Anodyne	VCP	50	38
Cc1nnc(N[C@@H](C)C(=O)NCCc2ccccc2)c(C#N)c1C	ZINC000450818705	DE	On-Demand	Mild	AMP1_PLAFQ	26	40
CO[C@@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@H]1O	ZINC000450818706	EC	On-Demand	Anodyne	HTR3A	23	57
CO[C@@H]1CN(c2nc3ccccc3nc2N2CCN(C)CC2)C[C@H]1O	ZINC000450818706	EC	On-Demand	Anodyne	HRH4	31	57
COCCN1CCCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450818712	EE	On-Demand	Anodyne	NOX1	56	38
COCCN1CCCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450818712	EE	On-Demand	Anodyne	NOX5	54	38
C[C@H](Nc1ccc(I)cn1)C(=O)NCCc1ccccc1	ZINC000450818714	GF	On-Demand	Anodyne	AMP1_PLAFQ	32	44
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450818724	FG	On-Demand	Anodyne	ACACB	41	38
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450818726	FG	On-Demand	Anodyne	ACACB	41	38
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450818727	FG	On-Demand	Anodyne	ACACB	41	38
COc1cccc(N[C@@H](C)C(=O)NCCc2ccccc2)c1[N+](=O)[O-]	ZINC000450818728	EF	On-Demand	Bother	ANPEP	23	40
COc1cccc(N[C@@H](C)C(=O)NCCc2ccccc2)c1[N+](=O)[O-]	ZINC000450818728	EF	On-Demand	Bother	AMP1_PLAFQ	27	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450818729	FG	On-Demand	Anodyne	ACACB	41	38
COCCc1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450818730	ED	On-Demand	Anodyne	AMP1_PLAFQ	26	41
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1[N+](=O)[O-]	ZINC000450818736	EE	On-Demand	Bother	AMP1_PLAFQ	22	40
C[C@]1(C(=O)NC[C@H](O)CCc2ccccc2)CC=CCC1	ZINC000450818744	CF	On-Demand	Anodyne	SDH1	0	43
C[C@@]1(C(=O)NC[C@@H](O)CCc2ccccc2)CC=CCC1	ZINC000450818745	CF	On-Demand	Anodyne	SDH1	0	43
C[C@@]1(C(=O)NC[C@H](O)CCc2ccccc2)CC=CCC1	ZINC000450818746	CF	On-Demand	Anodyne	SDH1	0	43
C[C@]1(C(=O)NC[C@@H](O)CCc2ccccc2)CC=CCC1	ZINC000450818747	CF	On-Demand	Anodyne	SDH1	0	43
C[C@H](Nc1ccc(C(N)=O)nn1)C(=O)NCCc1ccccc1	ZINC000450818750	DC	On-Demand	Anodyne	BRS3	22	41
C[C@H](Nc1ccc(C(N)=O)nn1)C(=O)NCCc1ccccc1	ZINC000450818750	DC	On-Demand	Anodyne	AMP1_PLAFQ	38	44
COC(=O)c1n[nH]c2c1CN(c1ncnc3cc(F)c(OC)cc13)CC2	ZINC000450818753	FD	On-Demand	Anodyne	PDE3A	47	36
COC(=O)c1n[nH]c2c1CN(c1ncnc3cc(F)c(OC)cc13)CC2	ZINC000450818753	FD	On-Demand	Anodyne	PDGFRB	83	44
COC(=O)c1n[nH]c2c1CN(c1ncnc3cc(F)c(OC)cc13)CC2	ZINC000450818753	FD	On-Demand	Anodyne	PDE3B	45	35
COC(=O)c1n[nH]c2c1CN(c1ncnc3cc(F)c(OC)cc13)CC2	ZINC000450818753	FD	On-Demand	Anodyne	PDGFRA	17	42
CC(C)c1nc(N[C@@H](C)C(=O)NCCc2ccccc2)nc(N(C)C)n1	ZINC000450818756	FD	On-Demand	Anodyne	AMP1_PLAFQ	26	41
OCC1(CCNc2ncnc3ccc(I)cc23)CC1	ZINC000450818757	FE	On-Demand	Anodyne	CLK4	55	36
OCC1(CCNc2ncnc3ccc(I)cc23)CC1	ZINC000450818757	FE	On-Demand	Anodyne	CD38	47	44
Cc1nc(-c2cccnc2)nc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C	ZINC000450818761	GF	On-Demand	Anodyne	TBXAS1	27	41
Cc1nc(-c2cccnc2)nc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C	ZINC000450818761	GF	On-Demand	Anodyne	PTAFR	22	40
Cc1nc(-c2cccnc2)nc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C	ZINC000450818761	GF	On-Demand	Anodyne	KCNA5	15	43
Cc1nc(-c2cccnc2)nc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C	ZINC000450818761	GF	On-Demand	Anodyne	PDE4B	15	40
Cc1nc(-c2cccnc2)nc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C	ZINC000450818761	GF	On-Demand	Anodyne	BRS3	23	40
NC(=O)c1ncc(Br)cc1NC[C@H]1CCCC[C@@H]1O	ZINC000450818767	ED	On-Demand	Anodyne	SYK	50	37
CO[C@@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1O	ZINC000450818768	DC	On-Demand	Anodyne	SCD1	40	48
CO[C@@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1O	ZINC000450818773	CD	On-Demand	Anodyne	PDE3A	51	38
CO[C@@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1O	ZINC000450818773	CD	On-Demand	Anodyne	PDE3B	75	38
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NCCC1(CO)CC1	ZINC000450818774	GF	On-Demand	Bother	BCL2L1	19	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc2cnccc2c1	ZINC000450818779	DF	On-Demand	Anodyne	AKT1	24	47
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc2cnccc2c1	ZINC000450818780	DF	On-Demand	Anodyne	AKT1	24	47
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc2cnccc2c1	ZINC000450818781	DF	On-Demand	Anodyne	AKT1	24	47
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc2cnccc2c1	ZINC000450818782	DF	On-Demand	Anodyne	AKT1	24	47
C[C@H](N=c1nc(C(C)(C)C)[nH]s1)C(=O)NCCc1ccccc1	ZINC000450818784	EE	On-Demand	Anodyne	AMP1_PLAFQ	27	43
CCS(=O)(=O)c1ccc(CN2C[C@@H]3CCC[C@@H]3[C@@H]2C(=O)OC)cc1	ZINC000450818785	FE	On-Demand	Anodyne	RORC	45	32
CCS(=O)(=O)c1ccc(CN2C[C@@H]3CCC[C@H]3[C@H]2C(=O)OC)cc1	ZINC000450818786	FE	On-Demand	Anodyne	RORC	45	32
CCS(=O)(=O)c1ccc(CN2C[C@@H]3CCC[C@H]3[C@@H]2C(=O)OC)cc1	ZINC000450818787	FE	On-Demand	Anodyne	RORC	45	32
CCS(=O)(=O)c1ccc(CN2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)OC)cc1	ZINC000450818788	FE	On-Demand	Anodyne	RORC	45	32
COc1nccc(CN2C(=O)N[C@@](C)(CCc3ccc4c(c3)OCO4)C2=O)n1	ZINC000450818789	GD	On-Demand	Anodyne	NOS2	50	31
COc1nccc(CN2C(=O)N[C@](C)(CCc3ccc4c(c3)OCO4)C2=O)n1	ZINC000450818790	GD	On-Demand	Anodyne	NOS2	50	31
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@@H](O)[C@H](OC)C1	ZINC000450818793	ED	On-Demand	Anodyne	ATP4A	19	52
COC(=O)c1n[nH]c2c1CN(c1nc(-c3cccc(Cl)c3)no1)CC2	ZINC000450818798	FE	On-Demand	Anodyne	GRM5	22	41
C[C@H](Nc1cccc(C(=O)OC(C)(C)C)n1)C(=O)NCCc1ccccc1	ZINC000450818803	FG	On-Demand	Anodyne	POL	0	42
C[C@H](Nc1cccc(C(=O)OC(C)(C)C)n1)C(=O)NCCc1ccccc1	ZINC000450818803	FG	On-Demand	Anodyne	AMP1_PLAFQ	26	40
COc1ccc(-c2noc(=O)n2CC(=O)CC[C@@H]2CCCCO2)cc1OC	ZINC000450818810	GE	On-Demand	Anodyne	OXTR	0	40
COc1ccc(-c2noc(=O)n2CC(=O)CC[C@H]2CCCCO2)cc1OC	ZINC000450818811	GE	On-Demand	Anodyne	OXTR	0	40
COc1cc(OC)c2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450818820	GF	On-Demand	Anodyne	NQO2	24	40
COc1cc(OC)c2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450818820	GF	On-Demand	Anodyne	MTNR1A	84	41
COc1cc(OC)c2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450818820	GF	On-Demand	Anodyne	MTNR1B	71	41
COc1cc(OC)c2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450818820	GF	On-Demand	Anodyne	PDE6A	44	33
CC(C)NC(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450818834	DE	On-Demand	Bother	TAAR1	17	42
COC(=O)Cc1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450818843	GE	On-Demand	Bother	GSTM2	49	36
COC(=O)Cc1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450818843	GE	On-Demand	Bother	COLA	95	35
CCc1ncnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1F	ZINC000450818849	DE	On-Demand	Anodyne	AMP1_PLAFQ	33	41
COc1cc2[nH]c(=N[C@@H](C)C(=O)NCCc3ccccc3)nc(N)c2cc1OC	ZINC000450818851	GD	On-Demand	Anodyne	CNR2	24	40
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)nc(C(C)C)n1	ZINC000450818861	EE	On-Demand	Anodyne	ANPEP	22	43
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)nc(C(C)C)n1	ZINC000450818861	EE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
C[C@H](Nc1ncc([N+](=O)[O-])s1)C(=O)NCCc1ccccc1	ZINC000450818862	DE	On-Demand	Bother	AMP1_PLAFQ	26	40
COc1cc(COc2ccc(-c3noc([C@@H]4CCCO4)n3)cc2)ccc1Cl	ZINC000450818865	GJ	On-Demand	Anodyne	CPT1A	26	40
COc1cc(COc2ccc(-c3noc([C@H]4CCCO4)n3)cc2)ccc1Cl	ZINC000450818866	GJ	On-Demand	Anodyne	CPT1A	26	40
C[C@H](N=c1[nH]n2cc(C3CCCC3)nc2s1)C(=O)NCCc1ccccc1	ZINC000450818867	GG	On-Demand	Anodyne	ACE	46	36
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450818873	EE	On-Demand	Bother	COLA	59	32
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450818873	EE	On-Demand	Bother	GSTP1	41	38
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450818873	EE	On-Demand	Bother	AMP1_PLAFQ	26	40
C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450818878	GE	On-Demand	Bother	NQO2	17	42
C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450818878	GE	On-Demand	Bother	BDKRB1	0	46
C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450818878	GE	On-Demand	Bother	COLA	111	38
C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450818878	GE	On-Demand	Bother	BCL2L1	89	35
C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450818878	GE	On-Demand	Bother	BCL2	68	34
C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450818878	GE	On-Demand	Bother	BCL2L2	44	31
CSc1ccc2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450818879	FH	On-Demand	Anodyne	HTT	0	40
Cc1ncc([N+](=O)[O-])n1CCc1ccc(Cl)cc1	ZINC000450818896	CF	On-Demand	Bother	FABH	0	44
CCS(=O)(=O)c1ccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)cc1	ZINC000450818901	GI	On-Demand	Anodyne	SSTR5	55	40
Cc1nsc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C#N	ZINC000450818909	DE	On-Demand	Mild	AMP1_PLAFQ	31	43
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Br	ZINC000450818910	FG	On-Demand	Anodyne	ANPEP	27	44
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Br	ZINC000450818910	FG	On-Demand	Anodyne	AMP1_PLAFQ	39	44
Cc1ncc[nH]c1=N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450818916	CD	On-Demand	Anodyne	AMP1_PLAFQ	27	42
CCn1c(C)nnc1SCc1nc(-c2cc(C)ccn2)no1	ZINC000450818927	DF	On-Demand	Anodyne	WNT3A	22	42
CCn1c(C)nnc1SCc1nc(-c2cc(C)ccn2)no1	ZINC000450818927	DF	On-Demand	Anodyne	AXIN2	0	44
CC(C)c1nnc(CN2CCCCC(C)(C)C2)s1	ZINC000450818928	CH	On-Demand	Anodyne	EBP	17	40
CN(C)CCNS(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450818950	GD	On-Demand	Bother	BDKRB1	0	51
CN(C)CCNS(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450818950	GD	On-Demand	Bother	BCL2L1	101	36
CN(C)CCNS(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450818950	GD	On-Demand	Bother	BCL2	90	34
CN(C)CCNS(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450818950	GD	On-Demand	Bother	BCL2L2	48	36
CCC(=O)CCCN1CCCCC(C)(C)C1	ZINC000450818953	BG	On-Demand	Anodyne	EBP	25	59
COC(=O)C[C@](C)(NCc1cccc(S(C)(=O)=O)c1)c1cccc(OC)c1	ZINC000450818965	GF	On-Demand	Anodyne	MMP13	19	44
COC(=O)C[C@@](C)(NCc1cccc(S(C)(=O)=O)c1)c1cccc(OC)c1	ZINC000450818966	GF	On-Demand	Anodyne	MMP13	19	44
CCC[C@H](OC)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450818968	ED	On-Demand	Anodyne	NPFFR1	50	37
CCC[C@@H](OC)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450818969	ED	On-Demand	Anodyne	NPFFR1	50	37
CCC[C@@H](OC)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450818970	ED	On-Demand	Anodyne	NPFFR1	50	37
CCC[C@H](OC)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450818971	ED	On-Demand	Anodyne	NPFFR1	50	37
CCN(CC)S(=O)(=O)c1ccc(NC[C@H](C)N(C)C)c([N+](=O)[O-])c1	ZINC000450818975	FD	On-Demand	Bother	BDKRB1	0	59
CCN(CC)S(=O)(=O)c1ccc(NC[C@H](C)N(C)C)c([N+](=O)[O-])c1	ZINC000450818975	FD	On-Demand	Bother	COLA	76	37
COc1ccc(-c2noc(=O)n2CCN(C)Cc2ccccc2)cc1OC	ZINC000450818988	FF	On-Demand	Anodyne	ACHE	17	47
C[C@H](Nc1ccc(S(C)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450818996	ED	On-Demand	Anodyne	AMP1_PLAFQ	27	42
C[C@H]1C(=O)NCCCN1CCN(C)Cc1ccccc1	ZINC000450819005	CD	On-Demand	Anodyne	GHRL	70	36
C[C@@H]1C(=O)NCCCN1CCN(C)Cc1ccccc1	ZINC000450819006	CD	On-Demand	Anodyne	GHRL	70	36
C[C@@H](CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)N(C)C	ZINC000450819016	EB	On-Demand	Anodyne	TGM2	19	41
CC(=O)c1ccc(OCC[C@@H](C)O)c(F)c1	ZINC000450819017	BE	On-Demand	Anodyne	THRA	0	43
CC(=O)c1ccc(OCC[C@H](C)O)c(F)c1	ZINC000450819018	BE	On-Demand	Anodyne	THRA	0	43
CC(C)C[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450819021	DF	On-Demand	Anodyne	DRD2	30	43
CC(C)C[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450819021	DF	On-Demand	Anodyne	DRD4	0	42
CC(C)C[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450819021	DF	On-Demand	Anodyne	SLC18A3	0	41
CC(C)C[C@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450819021	DF	On-Demand	Anodyne	CYP2J2	47	33
CO[C@H](Cc1ccccc1)CN1CCCNC(=O)[C@@H]1C	ZINC000450819022	CD	On-Demand	Anodyne	GHRL	45	33
CC(C)C[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450819023	DF	On-Demand	Anodyne	DRD2	30	43
CC(C)C[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450819023	DF	On-Demand	Anodyne	DRD4	0	42
CC(C)C[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450819023	DF	On-Demand	Anodyne	SLC18A3	0	41
CC(C)C[C@@H]1C(=O)NCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450819023	DF	On-Demand	Anodyne	CYP2J2	47	33
CO[C@@H](Cc1ccccc1)CN1CCCNC(=O)[C@H]1C	ZINC000450819030	CD	On-Demand	Anodyne	GHRL	45	33
CO[C@H](Cc1ccccc1)CN1CCCNC(=O)[C@H]1C	ZINC000450819034	CD	On-Demand	Anodyne	GHRL	45	33
CO[C@@H](Cc1ccccc1)CN1CCCNC(=O)[C@@H]1C	ZINC000450819035	CD	On-Demand	Anodyne	GHRL	45	33
Cc1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450819041	CD	On-Demand	Anodyne	ANPEP	22	45
Cc1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450819041	CD	On-Demand	Anodyne	AMP1_PLAFQ	31	45
C[C@@H](c1ccc(Oc2ccccc2)cc1)N(C)CCCCO	ZINC000450819047	CI	On-Demand	Anodyne	LTA4H	22	41
C[C@@H](c1ccc(Oc2ccccc2)cc1)N(C)CCCCO	ZINC000450819047	CI	On-Demand	Anodyne	TAAR1	16	45
C[C@H](c1ccc(Oc2ccccc2)cc1)N(C)CCCCO	ZINC000450819048	CI	On-Demand	Anodyne	LTA4H	22	41
C[C@H](c1ccc(Oc2ccccc2)cc1)N(C)CCCCO	ZINC000450819048	CI	On-Demand	Anodyne	TAAR1	16	45
CC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450819053	DE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450819063	DG	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450819064	DG	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450819065	DG	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450819066	DG	On-Demand	Anodyne	GPR88	0	40
COC(=O)C1(CNC(=O)c2nc3ccccc3nc2C2CC2)CCCCC1	ZINC000450819078	FG	On-Demand	Anodyne	HCN1	54	33
COC(=O)C1(CNC(=O)c2nc3ccccc3nc2C2CC2)CCCCC1	ZINC000450819078	FG	On-Demand	Anodyne	HCN4	52	33
CSc1cncc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819094	DE	On-Demand	Anodyne	AMP1_PLAFQ	27	42
CO[C@@H]1CN(c2ncccc2C(=O)Nc2ccc(Br)cc2)C[C@H]1O	ZINC000450819102	GE	On-Demand	Anodyne	TRPV1	23	45
CC(=O)CCCCCn1cc(C#N)c(=O)c2cc(Cl)ccc21	ZINC000450819106	DH	On-Demand	Mild	CPT1A	40	37
CC(C)c1nnc(COc2ccc(-c3noc(C4CC4)n3)cc2)s1	ZINC000450819118	EI	On-Demand	Anodyne	ETHR	48	37
COCc1nn(C)cc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819119	FD	On-Demand	Anodyne	NPFFR1	51	36
COCc1nn(C)cc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819120	FD	On-Demand	Anodyne	NPFFR1	51	36
CC(C)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)s1	ZINC000450819123	DG	On-Demand	Anodyne	AMP1_PLAFQ	32	43
CC(C)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)s1	ZINC000450819123	DG	On-Demand	Anodyne	CES1D	44	31
Cc1nc(C)c(C)c(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450819148	DD	On-Demand	Anodyne	AMP1_PLAFQ	27	42
Cc1ncc([N+](=O)[O-])n1Cc1ccn(CCc2ccccc2)n1	ZINC000450819153	DF	On-Demand	Bother	TYMS	0	41
CCN(CC)S(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450819155	FE	On-Demand	Bother	BDKRB1	25	48
CCN(CC)S(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450819155	FE	On-Demand	Bother	BCL2L1	18	40
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450819156	GF	On-Demand	Anodyne	NPFFR1	45	32
Cc1[nH]ccc(=N[C@@H](C)C(=O)NCCc2ccccc2)c1Cl	ZINC000450819157	DF	On-Demand	Anodyne	AMP1_PLAFQ	30	42
COc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450819166	EF	On-Demand	Bother	COLA	85	34
CCOc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncn1	ZINC000450819171	DE	On-Demand	Anodyne	CAPN2	43	37
CCOc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncn1	ZINC000450819171	DE	On-Demand	Anodyne	AMP1_PLAFQ	34	42
CCOc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncn1	ZINC000450819171	DE	On-Demand	Anodyne	PDS	47	36
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCCC1(CO)CC1	ZINC000450819175	EE	On-Demand	Bother	CACNA1D	50	34
COC(=O)c1n[nH]c2c1CN(c1ncnc3ccc(C)cc13)CC2	ZINC000450819192	DE	On-Demand	Anodyne	PDGFRB	38	40
COc1ccc(-c2noc(=O)n2Cc2cc(C(C)(C)C)on2)cc1OC	ZINC000450819199	FF	On-Demand	Anodyne	PDEB1	0	40
COC(=O)c1n[nH]c2c1CN(c1ncnc3c(F)cccc13)CC2	ZINC000450819226	ED	On-Demand	Anodyne	ABCC1	30	40
CO[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1O	ZINC000450819229	CD	On-Demand	Anodyne	SORD	46	41
CCCc1nc(C)c(CSc2nnc(Cc3cccc(OC)c3)o2)o1	ZINC000450819245	FI	On-Demand	Anodyne	CPB	0	47
COC(=O)c1csc(COc2ccc(-c3noc([C@@H]4CCCO4)n3)cc2)n1	ZINC000450819266	GG	On-Demand	Anodyne	COLA	43	41
COC(=O)c1csc(COc2ccc(-c3noc([C@@H]4CCCO4)n3)cc2)n1	ZINC000450819266	GG	On-Demand	Anodyne	CPT1A	38	41
COC(=O)c1csc(COc2ccc(-c3noc([C@@H]4CCCO4)n3)cc2)n1	ZINC000450819266	GG	On-Demand	Anodyne	ETHR	41	33
COc1ccc(CNC(=O)CCN(C)CC[C@@H]2CCCO2)c(OC)c1	ZINC000450819271	FE	On-Demand	Anodyne	NQO2	33	41
COc1ccc(CNC(=O)CCN(C)CC[C@@H]2CCCO2)c(OC)c1	ZINC000450819271	FE	On-Demand	Anodyne	MTNR1A	46	37
COc1ccc(CNC(=O)CCN(C)CC[C@H]2CCCO2)c(OC)c1	ZINC000450819272	FE	On-Demand	Anodyne	NQO2	33	41
COc1ccc(CNC(=O)CCN(C)CC[C@H]2CCCO2)c(OC)c1	ZINC000450819272	FE	On-Demand	Anodyne	MTNR1A	46	37
COC(=O)c1csc(COc2ccc(-c3noc([C@H]4CCCO4)n3)cc2)n1	ZINC000450819274	GG	On-Demand	Anodyne	COLA	43	41
COC(=O)c1csc(COc2ccc(-c3noc([C@H]4CCCO4)n3)cc2)n1	ZINC000450819274	GG	On-Demand	Anodyne	CPT1A	38	41
COC(=O)c1csc(COc2ccc(-c3noc([C@H]4CCCO4)n3)cc2)n1	ZINC000450819274	GG	On-Demand	Anodyne	ETHR	41	33
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450819279	EG	On-Demand	Anodyne	ROCK2	33	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450819281	EG	On-Demand	Anodyne	ROCK2	33	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450819282	EG	On-Demand	Anodyne	ROCK2	33	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450819283	EG	On-Demand	Anodyne	ROCK2	33	41
N#CC1(COc2ccc(-c3noc(C4CC4)n3)cc2)CCC1	ZINC000450819295	CH	On-Demand	Mild	ETHR	42	37
CC(F)(F)CCOc1cc(F)ccc1F	ZINC000450819298	BG	On-Demand	Anodyne	SDH1	0	42
Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819299	EF	On-Demand	Bother	AMP1_PLAFQ	26	40
Cc1cc(C)n(-c2cncc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)n1	ZINC000450819300	FE	On-Demand	Anodyne	ADORA2A	36	40
C[C@H](Nc1ccc(C(F)(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450819301	EG	On-Demand	Anodyne	CCR3	23	40
C[C@H](Nc1ccc(C(F)(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450819301	EG	On-Demand	Anodyne	AMP1_PLAFQ	31	42
C[C@H](Nc1ccc(C(F)(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450819301	EG	On-Demand	Anodyne	MLYCD	25	43
C[C@H](Nc1ccc(C(F)(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450819301	EG	On-Demand	Anodyne	CARM1	58	36
C[C@H](Nc1ccc(C(F)(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450819301	EG	On-Demand	Anodyne	CCL2	0	41
C[C@H](Nc1ccc(C(F)(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450819301	EG	On-Demand	Anodyne	PDS	36	42
O=[N+]([O-])c1ccc(NCCC2(CO)CC2)c(S(=O)(=O)N2CCCC2)c1	ZINC000450819303	FD	On-Demand	Bother	TBXA2R	18	40
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA2	88	52
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA1	68	52
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA7	48	49
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA5B	60	52
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA4	66	47
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA5A	62	52
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA14	42	47
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA12	48	48
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	CA9	49	48
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	AMP1_PLAFQ	30	41
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	NCE103	33	50
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	MTCA1	22	41
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)NCCc1ccccc1	ZINC000450819307	EC	On-Demand	Anodyne	P96878_MYCTU	32	41
C[C@H](Nc1cnn(C)c(=O)c1Br)C(=O)NCCc1ccccc1	ZINC000450819310	GD	On-Demand	Anodyne	ANPEP	15	43
C[C@H](Nc1cnn(C)c(=O)c1Br)C(=O)NCCc1ccccc1	ZINC000450819310	GD	On-Demand	Anodyne	AMP1_PLAFQ	31	43
COC(=O)c1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1C	ZINC000450819312	ED	On-Demand	Anodyne	AMP1_PLAFQ	30	40
C[C@H](Nc1ncncc1Br)C(=O)NCCc1ccccc1	ZINC000450819316	EE	On-Demand	Anodyne	ANPEP	22	45
C[C@H](Nc1ncncc1Br)C(=O)NCCc1ccccc1	ZINC000450819316	EE	On-Demand	Anodyne	AMP1_PLAFQ	33	45
Cc1nc(-c2ccccn2)nc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C	ZINC000450819324	GF	On-Demand	Anodyne	METAP1	83	55
COCCN1CCCN(Cc2c(C)cccc2Cl)CC1=O	ZINC000450819325	DE	On-Demand	Anodyne	NOX5	45	33
Cc1cc(C(F)(F)F)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819335	FF	On-Demand	Anodyne	TRPV1	60	39
Cc1cc(C(F)(F)F)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819335	FF	On-Demand	Anodyne	AMP1_PLAFQ	30	40
Cc1cc(C(F)(F)F)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819335	FF	On-Demand	Anodyne	CARM1	74	38
Cc1cc(C(F)(F)F)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819335	FF	On-Demand	Anodyne	PETD	0	40
COCc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)cc(OC)n1	ZINC000450819342	ED	On-Demand	Anodyne	CTSB	26	41
COCc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)cc(OC)n1	ZINC000450819342	ED	On-Demand	Anodyne	CAPNS1	47	33
COCc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)cc(OC)n1	ZINC000450819342	ED	On-Demand	Anodyne	CAPN1	55	41
COCc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)cc(OC)n1	ZINC000450819342	ED	On-Demand	Anodyne	CAPN2	79	41
COCc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)cc(OC)n1	ZINC000450819342	ED	On-Demand	Anodyne	ALS	48	30
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450819345	GF	On-Demand	Anodyne	NPFFR1	45	32
CC(=O)Nc1nnc(S[C@H](C)C(=O)Nc2nccs2)s1	ZINC000450819346	EE	On-Demand	Anodyne	MAP	0	41
CC(=O)Nc1nnc(S[C@H](C)C(=O)Nc2nccs2)s1	ZINC000450819346	EE	On-Demand	Anodyne	MAP1	106	39
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450819347	GF	On-Demand	Anodyne	NPFFR1	45	32
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450819348	GF	On-Demand	Anodyne	NPFFR1	45	32
CC(=O)Nc1nnc(S[C@@H](C)C(=O)Nc2nccs2)s1	ZINC000450819352	EE	On-Demand	Anodyne	MAP	0	41
CC(=O)Nc1nnc(S[C@@H](C)C(=O)Nc2nccs2)s1	ZINC000450819352	EE	On-Demand	Anodyne	MAP1	106	39
C[C@H](Nc1ncnc2[nH]cnc12)C(=O)NCCc1ccccc1	ZINC000450819357	DD	On-Demand	Anodyne	AMP1_PLAFQ	33	41
COc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Br	ZINC000450819358	GE	On-Demand	Anodyne	ANPEP	28	43
COc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Br	ZINC000450819358	GE	On-Demand	Anodyne	MMP3	21	41
COc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Br	ZINC000450819358	GE	On-Demand	Anodyne	CAPN1	26	40
COc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Br	ZINC000450819358	GE	On-Demand	Anodyne	CAPN2	49	40
COc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Br	ZINC000450819358	GE	On-Demand	Anodyne	AMP1_PLAFQ	35	43
CC(F)(F)CCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450819359	CI	On-Demand	Anodyne	GRM5	0	41
CC(F)(F)CCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450819359	CI	On-Demand	Anodyne	ETHR	59	44
C[C@H](Nc1ncc(C(=O)N(C)C)cc1Cl)C(=O)NCCc1ccccc1	ZINC000450819362	FF	On-Demand	Anodyne	PSMB5	17	40
COc1ccccc1Oc1ccc(C(=O)NCC2(CCO)CC2)nc1	ZINC000450819367	EF	On-Demand	Anodyne	HCN1	65	39
COc1ccccc1Oc1ccc(C(=O)NCC2(CCO)CC2)nc1	ZINC000450819367	EF	On-Demand	Anodyne	HCN4	55	37
COC(=O)c1csc(COc2ccc(C(C)=O)cc2C)n1	ZINC000450819373	DG	On-Demand	Anodyne	PPARD	24	42
CC(=O)c1cccc(CN2CCN(c3c(C#N)c(C)nn3C)CC2)c1	ZINC000450819374	EE	On-Demand	Mild	HTR1A	18	45
Cc1csc(=O)n1CCc1ccc(Cl)cc1	ZINC000450819377	CG	On-Demand	Anodyne	RGS4	0	40
CCOC(=O)c1ccc(CN2CC[C@H](O)C(C)(C)C2)nc1	ZINC000450819383	CD	On-Demand	Anodyne	SSTR5	28	40
CCOC(=O)c1ccc(CN2CC[C@@H](O)C(C)(C)C2)nc1	ZINC000450819384	CD	On-Demand	Anodyne	SSTR5	28	40
COc1cc(Br)c(C(=O)NCC2(CCO)CC2)cc1OC	ZINC000450819387	FE	On-Demand	Anodyne	KCNA3	43	37
COc1cc(Br)c(C(=O)NCC2(CCO)CC2)cc1OC	ZINC000450819387	FE	On-Demand	Anodyne	HCN1	58	37
COc1cc(Br)c(C(=O)NCC2(CCO)CC2)cc1OC	ZINC000450819387	FE	On-Demand	Anodyne	HCN4	50	35
CCOC(=O)c1ccc(CSc2nnc(-c3c(C)cc(C)cc3C)o2)nc1	ZINC000450819391	GJ	On-Demand	Anodyne	ALOX15	43	36
Cc1cc(=NCCC2(CO)CC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450819394	EE	On-Demand	Bother	GYRB	40	37
Cc1cccc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819397	CF	On-Demand	Anodyne	ANPEP	44	33
Cc1cccc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819397	CF	On-Demand	Anodyne	MTNR1A	25	42
Cc1cccc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819397	CF	On-Demand	Anodyne	MTNR1B	43	42
Cc1cccc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819397	CF	On-Demand	Anodyne	AMP1_PLAFQ	40	46
CO[C@H](COc1cc(C)ccc1NC(C)=O)Cc1ccccc1	ZINC000450819407	DH	On-Demand	Anodyne	EPHX1	0	43
CO[C@H](COc1cc(C)ccc1NC(C)=O)Cc1ccccc1	ZINC000450819407	DH	On-Demand	Anodyne	PDS	67	39
CO[C@@H](COc1cc(C)ccc1NC(C)=O)Cc1ccccc1	ZINC000450819409	DH	On-Demand	Anodyne	EPHX1	0	43
CO[C@@H](COc1cc(C)ccc1NC(C)=O)Cc1ccccc1	ZINC000450819409	DH	On-Demand	Anodyne	PDS	67	39
Cc1ccc(Cn2c([N+](=O)[O-])cnc2C)c(Br)c1	ZINC000450819415	DG	On-Demand	Bother	TYMS	0	40
CO[C@H](Cc1ccccc1)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819436	GE	On-Demand	Anodyne	SIGMAR1	41	37
CO[C@H](Cc1ccccc1)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819436	GE	On-Demand	Anodyne	NPFFR1	49	36
CO[C@H](Cc1ccccc1)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819437	GE	On-Demand	Anodyne	SIGMAR1	41	37
CO[C@H](Cc1ccccc1)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819437	GE	On-Demand	Anodyne	NPFFR1	49	36
CO[C@@H](Cc1ccccc1)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819438	GE	On-Demand	Anodyne	SIGMAR1	41	37
CO[C@@H](Cc1ccccc1)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819438	GE	On-Demand	Anodyne	NPFFR1	49	36
CO[C@@H](Cc1ccccc1)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819439	GE	On-Demand	Anodyne	SIGMAR1	41	37
CO[C@@H](Cc1ccccc1)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819439	GE	On-Demand	Anodyne	NPFFR1	49	36
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(C)(C)O	ZINC000450819441	DE	On-Demand	Anodyne	SLC6A1	54	34
C[C@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(C)(C)O	ZINC000450819441	DE	On-Demand	Anodyne	CYP2J2	67	49
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(C)(C)O	ZINC000450819442	DE	On-Demand	Anodyne	SLC6A1	54	34
C[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1CC(C)(C)O	ZINC000450819442	DE	On-Demand	Anodyne	CYP2J2	67	49
COC(=O)c1coc(CN[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450819443	FH	On-Demand	Anodyne	RBP4	50	32
COC(=O)c1coc(CN[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450819444	FH	On-Demand	Anodyne	RBP4	50	32
COC(=O)c1coc(CN[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450819445	FH	On-Demand	Anodyne	RBP4	50	32
COC(=O)c1coc(CN[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450819446	FH	On-Demand	Anodyne	RBP4	50	32
C[C@@H](Sc1nnc(N2CCCC2)s1)C(=O)C1CCCCC1	ZINC000450819447	EH	On-Demand	Anodyne	HRH3	15	41
C[C@H](Sc1nnc(N2CCCC2)s1)C(=O)C1CCCCC1	ZINC000450819448	EH	On-Demand	Anodyne	HRH3	15	41
N#Cc1cccc(C(=O)NCC2(CCO)CC2)c1Br	ZINC000450819459	DE	On-Demand	Mild	HCN1	49	30
N#Cc1cccc(C(=O)NCC2(CCO)CC2)c1Br	ZINC000450819459	DE	On-Demand	Mild	HCN4	47	30
C[C@@H](c1ccccc1)[C@H](O)CN(C)CC1(CO)CC1	ZINC000450819460	CD	On-Demand	Anodyne	AOC3	17	40
C[C@H](c1ccccc1)[C@@H](O)CN(C)CC1(CO)CC1	ZINC000450819461	CD	On-Demand	Anodyne	AOC3	17	40
C[C@H](c1ccccc1)[C@H](O)CN(C)CC1(CO)CC1	ZINC000450819462	CD	On-Demand	Anodyne	AOC3	17	40
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CC1(CO)CC1	ZINC000450819463	CD	On-Demand	Anodyne	AOC3	17	40
Cc1cccc2nc(C3CCN(CC4CCC(=O)CC4)CC3)oc12	ZINC000450819464	EI	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	31
O=C(c1cccnc1N1CC(c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000450819465	FH	On-Demand	Anodyne	FAAH	24	45
O=C(c1cccnc1N1CC(c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000450819465	FH	On-Demand	Anodyne	HPGD	32	43
O=C(c1cccnc1N1CC(c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000450819465	FH	On-Demand	Anodyne	SLC6A7	0	42
Cc1nc(NC2(Cc3ccc(F)cc3)CC2)ncc1[N+](=O)[O-]	ZINC000450819488	DG	On-Demand	Bother	PRKCQ	29	42
COC(=O)c1n[nH]c2c1CN(c1cc(C)nc3ccc([N+](=O)[O-])cc13)CC2	ZINC000450819489	FF	On-Demand	Bother	CACNA1D	47	31
COC(=O)c1n[nH]c2c1CN(c1cc(C)nc3ccc([N+](=O)[O-])cc13)CC2	ZINC000450819489	FF	On-Demand	Bother	CTRB1	28	42
COC(=O)c1n[nH]c2c1CN(c1ncnc3ccc(SC)cc13)CC2	ZINC000450819490	FE	On-Demand	Anodyne	PDGFRB	51	44
CO[C@@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1O	ZINC000450819495	ED	On-Demand	Anodyne	DRD3	0	40
CO[C@@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1O	ZINC000450819495	ED	On-Demand	Anodyne	ACACB	26	45
CO[C@@H]1CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C[C@H]1O	ZINC000450819495	ED	On-Demand	Anodyne	TNKS	51	32
COC(=O)C1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450819504	DH	On-Demand	Anodyne	HCN1	52	32
COC(=O)C1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450819504	DH	On-Demand	Anodyne	HCN4	49	32
CO[C@@H]1CN(c2ncnc3ccc(I)cc23)C[C@H]1O	ZINC000450819514	FD	On-Demand	Anodyne	PDE3A	49	37
CO[C@@H]1CN(c2ncnc3ccc(I)cc23)C[C@H]1O	ZINC000450819514	FD	On-Demand	Anodyne	PDGFRB	30	42
CO[C@@H]1CN(c2ncnc3ccc(I)cc23)C[C@H]1O	ZINC000450819514	FD	On-Demand	Anodyne	PDE3B	72	37
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819515	GG	On-Demand	Anodyne	PRSS1	16	43
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819515	GG	On-Demand	Anodyne	F10	17	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819515	GG	On-Demand	Anodyne	ANPEP	17	46
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819515	GG	On-Demand	Anodyne	ROCK2	17	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819515	GG	On-Demand	Anodyne	PIN1	20	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819515	GG	On-Demand	Anodyne	CTRB_BOVIN	55	34
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819516	GG	On-Demand	Anodyne	PRSS1	16	43
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819516	GG	On-Demand	Anodyne	F10	17	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819516	GG	On-Demand	Anodyne	ANPEP	17	46
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819516	GG	On-Demand	Anodyne	ROCK2	17	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819516	GG	On-Demand	Anodyne	PIN1	20	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819516	GG	On-Demand	Anodyne	CTRB_BOVIN	55	34
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819517	GG	On-Demand	Anodyne	PRSS1	16	43
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819517	GG	On-Demand	Anodyne	F10	17	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819517	GG	On-Demand	Anodyne	ANPEP	17	46
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819517	GG	On-Demand	Anodyne	ROCK2	17	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819517	GG	On-Demand	Anodyne	PIN1	20	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819517	GG	On-Demand	Anodyne	CTRB_BOVIN	55	34
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819518	GG	On-Demand	Anodyne	PRSS1	16	43
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819518	GG	On-Demand	Anodyne	F10	17	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819518	GG	On-Demand	Anodyne	ANPEP	17	46
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819518	GG	On-Demand	Anodyne	ROCK2	17	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819518	GG	On-Demand	Anodyne	PIN1	20	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450819518	GG	On-Demand	Anodyne	CTRB_BOVIN	55	34
COC(=O)c1n[nH]c2c1CN(c1ncnc3[nH]ccc13)CC2	ZINC000450819545	CD	On-Demand	Anodyne	AKT2	45	43
COC(=O)c1n[nH]c2c1CN(c1ncnc3[nH]ccc13)CC2	ZINC000450819545	CD	On-Demand	Anodyne	AKT3	37	43
COC(=O)c1n[nH]c2c1CN(c1ncnc3[nH]ccc13)CC2	ZINC000450819545	CD	On-Demand	Anodyne	AKT1	25	43
CC(=O)c1cccc(CN(C)CC[C@@H]2CCCO2)c1	ZINC000450819551	CF	On-Demand	Anodyne	OXTR	25	41
CC(=O)c1cccc(CN(C)CC[C@@H]2CCCO2)c1	ZINC000450819551	CF	On-Demand	Anodyne	AVPR1A	0	41
CC(=O)c1cccc(CN(C)CC[C@H]2CCCO2)c1	ZINC000450819552	CF	On-Demand	Anodyne	OXTR	25	41
CC(=O)c1cccc(CN(C)CC[C@H]2CCCO2)c1	ZINC000450819552	CF	On-Demand	Anodyne	AVPR1A	0	41
COC(=O)C1(CNC(=O)c2c[nH]c3nccc-3c2)CCCCC1	ZINC000450819555	DE	On-Demand	Anodyne	HCN1	50	31
COC(=O)C1(CNC(=O)c2c[nH]c3nccc-3c2)CCCCC1	ZINC000450819555	DE	On-Demand	Anodyne	HCN4	48	31
COc1cccc(Cc2nnc(SCc3cn(CC4CC4)nn3)o2)c1	ZINC000450819556	FF	On-Demand	Anodyne	PTK2	0	51
COc1cccc(Cc2nnc(SCc3cn(CC4CC4)nn3)o2)c1	ZINC000450819556	FF	On-Demand	Anodyne	CPB	0	47
COc1cccc(Cc2nnc(SCC[C@H](C)O)o2)c1	ZINC000450819575	CF	On-Demand	Anodyne	CPB	0	46
COc1cccc(Cc2nnc(SCC[C@@H](C)O)o2)c1	ZINC000450819576	CF	On-Demand	Anodyne	CPB	0	46
COc1cc(C)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819587	DD	On-Demand	Anodyne	EDNRA	0	40
COc1cc(C)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819587	DD	On-Demand	Anodyne	ALS	77	33
COc1cc(C)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819587	DD	On-Demand	Anodyne	AMP1_PLAFQ	30	41
COCc1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450819596	DD	On-Demand	Anodyne	AMP1_PLAFQ	27	42
C[C@H](Nc1ccccc1S(C)(=O)=O)C(=O)NCCc1ccccc1	ZINC000450819598	EE	On-Demand	Anodyne	MME	41	37
C[C@H](Nc1ccccc1S(C)(=O)=O)C(=O)NCCc1ccccc1	ZINC000450819598	EE	On-Demand	Anodyne	MMP3	44	38
C[C@H](Nc1ccccc1S(C)(=O)=O)C(=O)NCCc1ccccc1	ZINC000450819598	EE	On-Demand	Anodyne	AMP1_PLAFQ	36	46
C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)C(=O)NCCc1ccccc1	ZINC000450819607	GG	On-Demand	Bother	COLA	74	33
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450819608	EG	On-Demand	Bother	NPR	35	42
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450819608	EG	On-Demand	Bother	AMP1_PLAFQ	27	41
COC(=O)CNC(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450819609	FD	On-Demand	Bother	TAAR1	20	45
COC[C@H](Cc1ccccc1)N(C)Cc1ccc(C(C)=O)cc1	ZINC000450819610	DH	On-Demand	Anodyne	PAPA1_CARPA	41	33
COC[C@@H](Cc1ccccc1)N(C)Cc1ccc(C(C)=O)cc1	ZINC000450819611	DH	On-Demand	Anodyne	PAPA1_CARPA	41	33
C[C@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)NCCc1ccccc1	ZINC000450819616	DE	On-Demand	Bother	NPR	36	45
C[C@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)NCCc1ccccc1	ZINC000450819616	DE	On-Demand	Bother	AMP1_PLAFQ	26	41
COc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)cc1[N+](=O)[O-]	ZINC000450819620	FF	On-Demand	Bother	COLA	54	37
COCCN1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1=O	ZINC000450819622	GF	On-Demand	Anodyne	CYP2J2	47	34
C[C@H](Nc1nc2cccc(F)c2n1C)C(=O)NCCc1ccccc1	ZINC000450819624	EE	On-Demand	Anodyne	MTNR1B	31	41
C[C@H](Nc1nc2cccc(F)c2n1C)C(=O)NCCc1ccccc1	ZINC000450819624	EE	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](Nc1ccnc(N2CCCCC2)n1)C(=O)NCCc1ccccc1	ZINC000450819627	FE	On-Demand	Anodyne	NOS2	73	35
C[C@H](Nc1ccnc(N2CCCCC2)n1)C(=O)NCCc1ccccc1	ZINC000450819627	FE	On-Demand	Anodyne	AMP1_PLAFQ	37	43
C[C@H](Nc1ccnc(N2CCCCC2)n1)C(=O)NCCc1ccccc1	ZINC000450819627	FE	On-Demand	Anodyne	GPBAR1	26	54
CN(C)S(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450819635	ED	On-Demand	Bother	BDKRB1	25	46
Cc1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1C	ZINC000450819637	CE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
Cc1cnc(C)c(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450819645	CD	On-Demand	Anodyne	AMP1_PLAFQ	34	43
CCc1nnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1CC	ZINC000450819647	ED	On-Demand	Anodyne	AMP1_PLAFQ	31	43
C[C@@H](O)CCCOc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1	ZINC000450819648	DG	On-Demand	Anodyne	CPT1A	29	40
C[C@@H](O)CCCOc1ccc(-c2noc([C@H]3CCCO3)n2)cc1	ZINC000450819649	DG	On-Demand	Anodyne	CPT1A	29	40
C[C@H](O)CCCOc1ccc(-c2noc([C@H]3CCCO3)n2)cc1	ZINC000450819650	DG	On-Demand	Anodyne	CPT1A	29	40
C[C@H](O)CCCOc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1	ZINC000450819651	DG	On-Demand	Anodyne	CPT1A	29	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCCC1(CO)CC1	ZINC000450819657	GD	On-Demand	Bother	BCL2L1	42	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCCC1(CO)CC1	ZINC000450819657	GD	On-Demand	Bother	BCL2	30	41
C[C@H](Nc1nccnc1OC(F)F)C(=O)NCCc1ccccc1	ZINC000450819662	ED	On-Demand	Anodyne	ANPEP	17	41
C[C@H](Nc1nccnc1OC(F)F)C(=O)NCCc1ccccc1	ZINC000450819662	ED	On-Demand	Anodyne	AMP1_PLAFQ	27	41
C[C@H](Nc1cnc(C#N)cn1)C(=O)NCCc1ccccc1	ZINC000450819668	CD	On-Demand	Mild	SDH1	0	43
C[C@H](Nc1cnc(C#N)cn1)C(=O)NCCc1ccccc1	ZINC000450819668	CD	On-Demand	Mild	AMP1_PLAFQ	27	42
CCOC(=O)c1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)cc(C(C)(C)C)[nH]1	ZINC000450819670	GF	On-Demand	Anodyne	CAPN2	54	37
CCOC(=O)c1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)cc(C(C)(C)C)[nH]1	ZINC000450819670	GF	On-Demand	Anodyne	NPR	44	31
CCn1c(C)nnc1SCc1ccc(C(C)=O)cc1	ZINC000450819707	CG	On-Demand	Anodyne	SLC27A1	46	38
CCn1c(C)nnc1SCc1cccc(C(=O)OC)c1Cl	ZINC000450819720	EG	On-Demand	Anodyne	SLC27A1	43	41
CCCc1cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)no1	ZINC000450819726	FE	On-Demand	Anodyne	NPFFR1	51	36
CCCc1cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)no1	ZINC000450819727	FE	On-Demand	Anodyne	NPFFR1	51	36
O=C(NCC1(CCO)CC1)c1ccn(CCc2ccccc2)n1	ZINC000450819739	DE	On-Demand	Anodyne	NPFFR1	24	40
O=C(NCC1(CCO)CC1)c1ccn(CCc2ccccc2)n1	ZINC000450819739	DE	On-Demand	Anodyne	HCN1	53	33
O=C(NCC1(CCO)CC1)c1ccn(CCc2ccccc2)n1	ZINC000450819739	DE	On-Demand	Anodyne	HCN4	51	33
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)CCCC(=O)C1CC1	ZINC000450819744	CD	On-Demand	Anodyne	NOD1	63	38
CCOC(=O)[C@H](C)[C@H](C)NC(=O)CCCC(=O)C1CC1	ZINC000450819745	CD	On-Demand	Anodyne	NOD1	63	38
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)CCCC(=O)C1CC1	ZINC000450819746	CD	On-Demand	Anodyne	NOD1	63	38
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)CCCC(=O)C1CC1	ZINC000450819747	CD	On-Demand	Anodyne	NOD1	63	38
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)C(C)(C)C(C)(F)F	ZINC000450819789	FF	On-Demand	Anodyne	NPFFR1	49	36
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450819790	DD	On-Demand	Anodyne	ENPP2	19	43
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450819790	DD	On-Demand	Anodyne	HPGDS	15	42
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C(C)(C)C(C)(F)F	ZINC000450819791	FF	On-Demand	Anodyne	NPFFR1	49	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450819792	DD	On-Demand	Anodyne	ENPP2	19	43
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450819792	DD	On-Demand	Anodyne	HPGDS	15	42
CC[C@@H]1C[C@H]1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819793	DE	On-Demand	Anodyne	NPFFR1	49	36
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450819794	DD	On-Demand	Anodyne	ENPP2	19	43
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450819794	DD	On-Demand	Anodyne	HPGDS	15	42
CC[C@@H]1C[C@H]1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819795	DE	On-Demand	Anodyne	NPFFR1	49	36
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450819796	DD	On-Demand	Anodyne	ENPP2	19	43
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450819796	DD	On-Demand	Anodyne	HPGDS	15	42
O=C(Cc1sccc1Br)NC[C@H](O)CCc1ccccc1	ZINC000450819798	FG	On-Demand	Anodyne	AMP1_PLAFQ	43	37
O=C(Cc1sccc1Br)NC[C@@H](O)CCc1ccccc1	ZINC000450819800	FG	On-Demand	Anodyne	AMP1_PLAFQ	43	37
CCOC(=O)c1cc(N2CCc3[nH]nc(C(=O)OC)c3C2)ncc1Cl	ZINC000450819821	FD	On-Demand	Anodyne	IKBKB	52	35
COc1ccc2nc(C)nc(N3C[C@@H](O)[C@H](OC)C3)c2c1	ZINC000450819835	CD	On-Demand	Anodyne	PDE3B	49	38
CCC1(CC)CN(C(=O)Cc2ccc(O)c(OC)c2)CCS1(=O)=O	ZINC000450819847	FD	On-Demand	Anodyne	TRPV1	0	42
Cc1ccc(C(=O)NCC2(CCO)CC2)c(Cl)c1Cl	ZINC000450819849	DG	On-Demand	Anodyne	SLC6A9	51	35
Cc1ccc(C(=O)NCC2(CCO)CC2)c(Cl)c1Cl	ZINC000450819849	DG	On-Demand	Anodyne	HCN1	49	30
Cc1ccc(C(=O)NCC2(CCO)CC2)c(Cl)c1Cl	ZINC000450819849	DG	On-Demand	Anodyne	HCN4	47	30
COc1ccc(OC(F)(F)F)c(C(=O)NCC2(CCO)CC2)c1	ZINC000450819850	EE	On-Demand	Anodyne	HCN1	50	32
COc1ccc(OC(F)(F)F)c(C(=O)NCC2(CCO)CC2)c1	ZINC000450819850	EE	On-Demand	Anodyne	HCN4	48	32
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000450819863	DI	On-Demand	Bother	THRA	24	45
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000450819863	DI	On-Demand	Bother	S1PR4	0	42
CC(=O)Nc1cccnc1NC(=O)c1cccc2c1CCCC2	ZINC000450819872	DG	On-Demand	Anodyne	G2YM83_BOTF4	82	46
CC[C@@H]1CCC[C@@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450819873	CF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CC[C@H]1CCC[C@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450819874	CF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CC[C@H]1CCC[C@@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450819875	CF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CC[C@@H]1CCC[C@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450819876	CF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
Cc1csc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450819879	EF	On-Demand	Anodyne	TACR3	43	34
Cc1csc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450819879	EF	On-Demand	Anodyne	NPFFR1	56	35
Cc1csc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450819880	EF	On-Demand	Anodyne	TACR3	43	34
Cc1csc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1	ZINC000450819880	EF	On-Demand	Anodyne	NPFFR1	56	35
CC(C)C[C@H]1C(=O)NCCN1CCCC(=O)c1ccccc1	ZINC000450819881	DE	On-Demand	Anodyne	CYP2J2	54	38
CC(C)C[C@@H]1C(=O)NCCN1CCCC(=O)c1ccccc1	ZINC000450819882	DE	On-Demand	Anodyne	CYP2J2	54	38
COC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nn1	ZINC000450819887	EC	On-Demand	Anodyne	ANPEP	22	43
COC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nn1	ZINC000450819887	EC	On-Demand	Anodyne	AMP1_PLAFQ	31	43
Cc1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1C#N	ZINC000450819893	DD	On-Demand	Mild	ANPEP	19	42
Cc1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1C#N	ZINC000450819893	DD	On-Demand	Mild	AMP1_PLAFQ	27	42
COCCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450819894	FD	On-Demand	Anodyne	EPHX2	0	42
COCCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450819894	FD	On-Demand	Anodyne	GCK	29	43
CCS(=O)(=O)c1ccc(CN(C)[C@H](COC)Cc2ccccc2)cc1	ZINC000450819904	FG	On-Demand	Anodyne	RORC	19	41
CCS(=O)(=O)c1ccc(CN(C)[C@@H](COC)Cc2ccccc2)cc1	ZINC000450819905	FG	On-Demand	Anodyne	RORC	19	41
C[C@H](Nc1ccnc(N2CCOCC2)n1)C(=O)NCCc1ccccc1	ZINC000450819907	FC	On-Demand	Anodyne	PIK3CA	25	41
C[C@H](Nc1ccnc(N2CCOCC2)n1)C(=O)NCCc1ccccc1	ZINC000450819907	FC	On-Demand	Anodyne	NOS2	67	33
C[C@H](Nc1ccnc(N2CCOCC2)n1)C(=O)NCCc1ccccc1	ZINC000450819907	FC	On-Demand	Anodyne	AMP1_PLAFQ	29	40
C[C@H](Nc1ccnc(N2CCOCC2)n1)C(=O)NCCc1ccccc1	ZINC000450819907	FC	On-Demand	Anodyne	GPBAR1	15	46
COc1nc(C)cc(NCCC2(CO)CC2)n1	ZINC000450819910	BC	On-Demand	Anodyne	PTGDR	40	36
CCOC(=O)c1cnn(CCSCc2ccccc2)c1C(F)F	ZINC000450819914	EH	On-Demand	Anodyne	ADORA1	0	42
Cc1cc(C#N)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450819919	DD	On-Demand	Mild	AMP1_PLAFQ	26	40
CCS(=O)(=O)c1ccccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450819920	FF	On-Demand	Anodyne	MMP3	45	37
CCS(=O)(=O)c1ccccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450819920	FF	On-Demand	Anodyne	CAPN1	48	41
CCS(=O)(=O)c1ccccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450819920	FF	On-Demand	Anodyne	ACE2	40	33
CCS(=O)(=O)c1ccccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450819920	FF	On-Demand	Anodyne	AMP1_PLAFQ	39	45
C[C@H](Nc1nccnc1C#N)C(=O)NCCc1ccccc1	ZINC000450819921	CD	On-Demand	Mild	SDH1	0	41
C[C@H](Nc1nccnc1C#N)C(=O)NCCc1ccccc1	ZINC000450819921	CD	On-Demand	Mild	CTSK	35	40
C[C@H](Nc1nccnc1C#N)C(=O)NCCc1ccccc1	ZINC000450819921	CD	On-Demand	Mild	AMP1_PLAFQ	30	43
CC(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450819922	CE	On-Demand	Bother	TAAR1	15	41
OCC1(CCNc2ccnc3cc(F)ccc23)CC1	ZINC000450819927	CF	On-Demand	Anodyne	HRP1_PLAFA	90	36
C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819947	FD	On-Demand	Anodyne	ACE	49	42
C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819947	FD	On-Demand	Anodyne	SLC18A2	45	35
C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819947	FD	On-Demand	Anodyne	MME	20	42
C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819947	FD	On-Demand	Anodyne	PRCP	0	43
C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819947	FD	On-Demand	Anodyne	NOS2	42	33
C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819947	FD	On-Demand	Anodyne	XIAP	27	43
C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819947	FD	On-Demand	Anodyne	BIRC2	50	37
C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819947	FD	On-Demand	Anodyne	ACKR3	42	32
C[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819948	FD	On-Demand	Anodyne	ACE	49	42
C[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819948	FD	On-Demand	Anodyne	SLC18A2	45	35
C[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819948	FD	On-Demand	Anodyne	MME	20	42
C[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819948	FD	On-Demand	Anodyne	PRCP	0	43
C[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819948	FD	On-Demand	Anodyne	NOS2	42	33
C[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819948	FD	On-Demand	Anodyne	XIAP	27	43
C[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819948	FD	On-Demand	Anodyne	BIRC2	50	37
C[C@H](Nc1cc(N2CCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450819948	FD	On-Demand	Anodyne	ACKR3	42	32
CCC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450819962	FG	On-Demand	Bother	COLA	78	36
CC(C)[C@H]1OCC[C@@H]1CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450819965	DH	On-Demand	Anodyne	SCN9A	0	42
CC(C)[C@H]1OCC[C@@H]1CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450819966	DH	On-Demand	Anodyne	SCN9A	0	42
CC(C)[C@H]1OCC[C@@H]1CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450819967	DH	On-Demand	Anodyne	SCN9A	0	42
CC(C)[C@H]1OCC[C@@H]1CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450819968	DH	On-Demand	Anodyne	SCN9A	0	42
CNS(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450819969	ED	On-Demand	Bother	BCL2L1	22	41
CCc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)nc(-c2ccccn2)n1	ZINC000450819970	GF	On-Demand	Anodyne	METAP1	38	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450819987	EE	On-Demand	Anodyne	IRAK4	21	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450819988	EE	On-Demand	Anodyne	IRAK4	21	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450819989	EE	On-Demand	Anodyne	IRAK4	21	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450819990	EE	On-Demand	Anodyne	IRAK4	21	41
O=C(NC[C@H](O)CCc1ccccc1)[C@@H](O)C1CCC1	ZINC000450819991	CD	On-Demand	Anodyne	SLC18A2	46	40
O=C(NC[C@H](O)CCc1ccccc1)[C@@H](O)C1CCC1	ZINC000450819991	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	35
O=C(NC[C@H](O)CCc1ccccc1)[C@@H](O)C1CCC1	ZINC000450819991	CD	On-Demand	Anodyne	BIRC2	34	40
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H](O)C1CCC1	ZINC000450819992	CD	On-Demand	Anodyne	SLC18A2	46	40
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H](O)C1CCC1	ZINC000450819992	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	35
O=C(NC[C@@H](O)CCc1ccccc1)[C@@H](O)C1CCC1	ZINC000450819992	CD	On-Demand	Anodyne	BIRC2	34	40
O=C(NC[C@H](O)CCc1ccccc1)[C@H](O)C1CCC1	ZINC000450819993	CD	On-Demand	Anodyne	SLC18A2	46	40
O=C(NC[C@H](O)CCc1ccccc1)[C@H](O)C1CCC1	ZINC000450819993	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	35
O=C(NC[C@H](O)CCc1ccccc1)[C@H](O)C1CCC1	ZINC000450819993	CD	On-Demand	Anodyne	BIRC2	34	40
O=C(NC[C@@H](O)CCc1ccccc1)[C@H](O)C1CCC1	ZINC000450819994	CD	On-Demand	Anodyne	SLC18A2	46	40
O=C(NC[C@@H](O)CCc1ccccc1)[C@H](O)C1CCC1	ZINC000450819994	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	35
O=C(NC[C@@H](O)CCc1ccccc1)[C@H](O)C1CCC1	ZINC000450819994	CD	On-Demand	Anodyne	BIRC2	34	40
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1C[C@H](Cc1ccccc1)OC	ZINC000450820001	DF	On-Demand	Anodyne	ACE	42	41
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1C[C@@H](Cc1ccccc1)OC	ZINC000450820002	DF	On-Demand	Anodyne	ACE	42	41
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C[C@@H](Cc1ccccc1)OC	ZINC000450820003	DF	On-Demand	Anodyne	ACE	42	41
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C[C@H](Cc1ccccc1)OC	ZINC000450820004	DF	On-Demand	Anodyne	ACE	42	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450820009	DE	On-Demand	Anodyne	ACE	36	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450820009	DE	On-Demand	Anodyne	P2RY12	66	34
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450820010	DE	On-Demand	Anodyne	ACE	36	42
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450820010	DE	On-Demand	Anodyne	P2RY12	66	34
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450820011	DE	On-Demand	Anodyne	ACE	36	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450820011	DE	On-Demand	Anodyne	P2RY12	66	34
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450820012	DE	On-Demand	Anodyne	ACE	36	42
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450820012	DE	On-Demand	Anodyne	P2RY12	66	34
COC(=O)c1n[nH]c2c1CN(c1nc(N)c3cc(OC)c(OC)cc3n1)CC2	ZINC000450820014	GD	On-Demand	Anodyne	ADRA1D	19	50
COC(=O)c1n[nH]c2c1CN(c1nc(N)c3cc(OC)c(OC)cc3n1)CC2	ZINC000450820014	GD	On-Demand	Anodyne	ADRA1A	15	54
COC(=O)c1n[nH]c2c1CN(c1nc(N)c3cc(OC)c(OC)cc3n1)CC2	ZINC000450820014	GD	On-Demand	Anodyne	ADRA1B	46	50
COC(=O)c1n[nH]c2c1CN(c1nc(N)c3cc(OC)c(OC)cc3n1)CC2	ZINC000450820014	GD	On-Demand	Anodyne	DRTS_TRYCR	45	33
COC(=O)c1n[nH]c2c1CN(c1ncc(C(N)=O)cc1Cl)CC2	ZINC000450820015	EC	On-Demand	Anodyne	P2RY12	29	44
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@@H](O)[C@H](OC)C2)c([N+](=O)[O-])c1	ZINC000450820028	FC	On-Demand	Bother	TAAR1	18	43
COC(=O)[C@@H](C)NC(=O)c1ccc(N2C[C@@H](O)[C@H](OC)C2)c([N+](=O)[O-])c1	ZINC000450820029	FC	On-Demand	Bother	TAAR1	18	43
C[C@@H]1CCC[C@]1(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450820030	CF	On-Demand	Anodyne	SDH1	0	41
C[C@@H]1CCC[C@]1(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450820031	CF	On-Demand	Anodyne	SDH1	0	41
C[C@@H]1CCC[C@@]1(C)C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450820032	CF	On-Demand	Anodyne	SDH1	0	41
C[C@@H]1CCC[C@@]1(C)C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450820033	CF	On-Demand	Anodyne	SDH1	0	41
CC1(C)CCN(c2ccc(C(F)(F)F)cn2)CC[S@@]1=O	ZINC000450820054	DF	On-Demand	Anodyne	ADAM33	0	44
CC1(C)CCN(c2ccc(C(F)(F)F)cn2)CC[S@]1=O	ZINC000450820055	DF	On-Demand	Anodyne	ADAM33	0	44
CC[C@H](CC(C)C)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820086	EG	On-Demand	Anodyne	NPFFR1	47	35
CC[C@@H](CC(C)C)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820087	EG	On-Demand	Anodyne	NPFFR1	47	35
CC[C@@H](CC(C)C)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820088	EG	On-Demand	Anodyne	NPFFR1	47	35
CC[C@H](CC(C)C)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820089	EG	On-Demand	Anodyne	NPFFR1	47	35
CN(C)C(=O)c1cnc(N2CC(c3cccc(Cl)c3)C2)c(Cl)c1	ZINC000450820095	FH	On-Demand	Anodyne	P2RY12	25	41
C[C@H](OCCc1ccccc1)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820101	GF	On-Demand	Anodyne	NPFFR1	46	35
C[C@@H](OCCc1ccccc1)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820102	GF	On-Demand	Anodyne	NPFFR1	46	35
C[C@H](OCCc1ccccc1)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820103	GF	On-Demand	Anodyne	NPFFR1	46	35
C[C@@H](OCCc1ccccc1)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820104	GF	On-Demand	Anodyne	NPFFR1	46	35
Cc1cc(N2CC(c3cccc(Cl)c3)C2)n2ncnc2n1	ZINC000450820111	CF	On-Demand	Anodyne	DHOD	0	42
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cc(O)ccc1F	ZINC000450820124	FE	For-Sale	Anodyne	SIGMAR1	25	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cc(O)ccc1F	ZINC000450820124	FE	For-Sale	Anodyne	NPFFR1	53	36
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cc(O)ccc1F	ZINC000450820125	FE	For-Sale	Anodyne	SIGMAR1	25	41
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cc(O)ccc1F	ZINC000450820125	FE	For-Sale	Anodyne	NPFFR1	53	36
COc1cc(Cn2c([N+](=O)[O-])cnc2C)ccc1Cl	ZINC000450820126	CF	On-Demand	Bother	FABH	0	42
Cc1cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)nn1C(C)C	ZINC000450820131	FE	On-Demand	Anodyne	NPFFR1	49	33
Cc1cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)nn1C(C)C	ZINC000450820132	FE	On-Demand	Anodyne	NPFFR1	49	33
CCC[C@@H](O)CN1CCCCC(C)(C)C1	ZINC000450820139	BF	On-Demand	Anodyne	EBP	17	46
CCC[C@H](O)CN1CCCCC(C)(C)C1	ZINC000450820140	BF	On-Demand	Anodyne	EBP	17	46
CC(C)CCCC(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820142	EF	On-Demand	Anodyne	NPFFR1	50	35
CC(C)CCCC(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820143	EF	On-Demand	Anodyne	NPFFR1	50	35
COCCOC[C@H](O)CN[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450820166	CD	On-Demand	Anodyne	ADRB1	18	44
COCCOC[C@H](O)CN[C@H]1CCC[C@H]1c1ccccc1	ZINC000450820167	CD	On-Demand	Anodyne	ADRB1	18	44
COCCOC[C@H](O)CN[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450820168	CD	On-Demand	Anodyne	ADRB1	18	44
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccc(C(F)(F)F)n1	ZINC000450820169	GF	On-Demand	Anodyne	NPFFR1	50	33
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccc(C(F)(F)F)n1	ZINC000450820170	GF	On-Demand	Anodyne	NPFFR1	50	33
CCOC(=O)[C@@H](C)N(Cc1ccc(S(=O)(=O)CC)cc1)C1CC1	ZINC000450820194	EE	On-Demand	Anodyne	RORC	19	41
CCOC(=O)[C@H](C)N(Cc1ccc(S(=O)(=O)CC)cc1)C1CC1	ZINC000450820195	EE	On-Demand	Anodyne	RORC	19	41
C[C@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)NCCc1ccccc1	ZINC000450820200	DE	On-Demand	Bother	NPR	36	41
C[C@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)NCCc1ccccc1	ZINC000450820200	DE	On-Demand	Bother	AMP1_PLAFQ	27	42
NS(=O)(=O)c1ccc(NCCC2(CO)CC2)c(C(F)(F)F)c1	ZINC000450820205	ED	On-Demand	Anodyne	CA2	40	36
COc1cc2c(N3C[C@@H](O)[C@H](OC)C3)ncnc2cc1F	ZINC000450820233	CC	On-Demand	Anodyne	PDE3A	60	45
COc1cc2c(N3C[C@@H](O)[C@H](OC)C3)ncnc2cc1F	ZINC000450820233	CC	On-Demand	Anodyne	PDGFRB	69	43
COc1cc2c(N3C[C@@H](O)[C@H](OC)C3)ncnc2cc1F	ZINC000450820233	CC	On-Demand	Anodyne	PDE3B	88	45
CCCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820235	FE	On-Demand	Anodyne	ANPEP	28	40
CCCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820235	FE	On-Demand	Anodyne	NPR	42	37
CCCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820235	FE	On-Demand	Anodyne	AMP1_PLAFQ	26	40
Cc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820238	EG	On-Demand	Bother	CACNA1C	40	36
Cc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820238	EG	On-Demand	Bother	CACNA1D	66	38
Cc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820238	EG	On-Demand	Bother	CCR3	0	41
Cc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820238	EG	On-Demand	Bother	NPR	36	45
Cc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820238	EG	On-Demand	Bother	AMP1_PLAFQ	27	41
C[C@H](Nc1ncc(C(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450820242	DF	On-Demand	Anodyne	FAAH	55	36
C[C@H](Nc1ncc(C(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450820242	DF	On-Demand	Anodyne	CES1	41	35
C[C@H](Nc1ncc(C(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450820242	DF	On-Demand	Anodyne	AMP1_PLAFQ	35	45
C[C@H](Nc1ncc(C(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450820242	DF	On-Demand	Anodyne	CES1D	45	32
COC(=O)c1n[nH]c2c1CN(c1ccnc3cc(F)c(OC)cc13)CC2	ZINC000450820249	FE	On-Demand	Anodyne	PDGFRB	30	41
COC(=O)c1n[nH]c2c1CN(c1ccnc3cc(F)c(OC)cc13)CC2	ZINC000450820249	FE	On-Demand	Anodyne	MET	53	35
COc1cc(CN2CCN(c3c(C#N)c(C)nn3C)CC2)ccc1Cl	ZINC000450820252	FF	On-Demand	Mild	DRD1	0	42
COc1cc(CN2CCN(c3c(C#N)c(C)nn3C)CC2)ccc1Cl	ZINC000450820252	FF	On-Demand	Mild	CCR1	24	40
COCCN1CCCN(Cc2ccc(C(C)=O)cc2)CC1=O	ZINC000450820264	DD	On-Demand	Anodyne	NOD2	42	38
COC(=O)c1coc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450820266	EF	On-Demand	Anodyne	COLA	43	42
COC(=O)c1coc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450820266	EF	On-Demand	Anodyne	CPT1A	30	42
COC(=O)c1coc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450820266	EF	On-Demand	Anodyne	ETHR	42	36
C[C@H](Nc1ccc(Br)cn1)C(=O)NCCc1ccccc1	ZINC000450820268	EG	On-Demand	Anodyne	AMP1_PLAFQ	40	47
COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450820281	GD	On-Demand	Anodyne	MTNR1A	45	37
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450820282	GD	On-Demand	Anodyne	MTNR1A	45	37
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	HTR1A	22	50
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	DRD2	34	45
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	DRD1	30	54
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	DRD4	28	53
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	HTR2A	23	45
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	HTR7	30	45
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	SLC18A3	0	44
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	CYP2J2	49	36
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1C#N	ZINC000450820283	FF	On-Demand	Mild	AP2S1	0	45
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450820284	GD	On-Demand	Anodyne	MTNR1A	45	37
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1Br	ZINC000450820285	FG	On-Demand	Anodyne	ANPEP	28	45
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1Br	ZINC000450820285	FG	On-Demand	Anodyne	AMP1_PLAFQ	33	45
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450820286	GD	On-Demand	Anodyne	MTNR1A	45	37
CC(=O)Nc1nnc(SCc2ccn(CCc3ccccc3)n2)s1	ZINC000450820308	FG	On-Demand	Anodyne	Q91H74_9FLAV	0	40
COc1cccc(Cc2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450820311	EG	On-Demand	Anodyne	PTK2	24	54
COc1cccc(Cc2nnc(SCc3cn(C)nc3C)o2)c1	ZINC000450820311	EG	On-Demand	Anodyne	CPB	0	47
CCOC(=O)c1cccnc1N1CCc2[nH]nc(C(=O)OC)c2C1	ZINC000450820313	ED	On-Demand	Anodyne	P2RY12	45	37
Cc1ccc2oc(N[C@@H](C)C(=O)NCCc3ccccc3)nc2c1	ZINC000450820319	DF	On-Demand	Anodyne	ANPEP	24	40
Cc1ccc2oc(N[C@@H](C)C(=O)NCCc3ccccc3)nc2c1	ZINC000450820319	DF	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450820337	GE	On-Demand	Bother	COLA	92	37
COC(=O)c1n[nH]c2c1CN(c1ncc(C(F)(F)F)s1)CC2	ZINC000450820344	EE	On-Demand	Anodyne	MLYCD	60	37
C[C@H](N=c1cc[nH]cc1Br)C(=O)NCCc1ccccc1	ZINC000450820355	EE	On-Demand	Anodyne	ANPEP	24	45
C[C@H](N=c1cc[nH]cc1Br)C(=O)NCCc1ccccc1	ZINC000450820355	EE	On-Demand	Anodyne	AMP1_PLAFQ	33	45
CC(=O)CCCCCOc1cc(F)ccc1F	ZINC000450820356	BG	On-Demand	Anodyne	THRA	30	40
CC(=O)CCCCCOc1cc(F)ccc1F	ZINC000450820356	BG	On-Demand	Anodyne	THRB	0	40
CC(=O)CCCCCOc1cc(F)ccc1F	ZINC000450820356	BG	On-Demand	Anodyne	SDH1	0	41
CCc1nc(C)cc(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450820360	DD	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](Nc1ncccc1Cl)C(=O)NCCc1ccccc1	ZINC000450820361	DF	On-Demand	Anodyne	ANPEP	29	44
C[C@H](Nc1ncccc1Cl)C(=O)NCCc1ccccc1	ZINC000450820361	DF	On-Demand	Anodyne	AMP1_PLAFQ	35	44
C[C@H](Nc1ncccc1Cl)C(=O)NCCc1ccccc1	ZINC000450820361	DF	On-Demand	Anodyne	CAN2	0	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NCCC1(CO)CC1	ZINC000450820374	GE	On-Demand	Bother	BCL2L1	19	41
COC[C@@H](COc1cc(C)ccc1NC(C)=O)c1ccc(Br)cc1	ZINC000450820375	GJ	On-Demand	Anodyne	EPHX1	0	43
COC[C@H](COc1cc(C)ccc1NC(C)=O)c1ccc(Br)cc1	ZINC000450820376	GJ	On-Demand	Anodyne	EPHX1	0	43
Cc1ccc(NC(=O)c2ccc(NCCC3(CO)CC3)c([N+](=O)[O-])c2)cc1	ZINC000450820380	FH	On-Demand	Bother	TAAR1	20	46
Cc1ccc(NC(=O)c2ccc(NCCC3(CO)CC3)c([N+](=O)[O-])c2)cc1	ZINC000450820380	FH	On-Demand	Bother	MCL1	0	47
Clc1cccc(C2CN(c3cc(N4CCCC4)ncn3)C2)c1	ZINC000450820388	DG	On-Demand	Anodyne	PRCP	30	40
Cc1ccc(NC(=O)c2ccc(NC[C@H](C)N(C)C)c([N+](=O)[O-])c2)cc1	ZINC000450820415	FH	On-Demand	Bother	TAAR1	21	52
CCn1cnc2c(NC[C@H](C)N(C)C)ncnc21	ZINC000450820454	BD	On-Demand	Anodyne	ADORA1	20	43
O=C(NCC1(CCO)CC1)c1cccc2c1CCCC2	ZINC000450820458	CE	On-Demand	Anodyne	HCN1	58	37
O=C(NCC1(CCO)CC1)c1cccc2c1CCCC2	ZINC000450820458	CE	On-Demand	Anodyne	HCN4	52	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCCC(=O)C(C)(C)C	ZINC000450820459	FF	On-Demand	Anodyne	NPFFR1	47	33
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCCC(=O)C(C)(C)C	ZINC000450820460	FF	On-Demand	Anodyne	NPFFR1	47	33
CCC(=O)C1(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000450820467	ED	On-Demand	Anodyne	NPFFR1	50	37
CCC(=O)C1(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000450820468	ED	On-Demand	Anodyne	NPFFR1	50	37
CC(=O)Nc1cccnc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450820471	GE	On-Demand	Anodyne	CA5B	59	35
CC(=O)Nc1cccnc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450820471	GE	On-Demand	Anodyne	CA5A	67	35
CC(=O)Nc1cccnc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450820471	GE	On-Demand	Anodyne	RORC	59	34
C[C@@H]1Cc2cccc(C(=O)NCC3(CCO)CC3)c2O1	ZINC000450820475	CD	On-Demand	Anodyne	HCN1	64	36
C[C@@H]1Cc2cccc(C(=O)NCC3(CCO)CC3)c2O1	ZINC000450820475	CD	On-Demand	Anodyne	HCN4	53	34
C[C@H]1Cc2cccc(C(=O)NCC3(CCO)CC3)c2O1	ZINC000450820477	CD	On-Demand	Anodyne	HCN1	64	36
C[C@H]1Cc2cccc(C(=O)NCC3(CCO)CC3)c2O1	ZINC000450820477	CD	On-Demand	Anodyne	HCN4	53	34
CCCCc1nc(-c2ccc(OCC[C@@H](C)O)cc2)no1	ZINC000450820483	CG	On-Demand	Anodyne	ACACA	25	57
CCCCc1nc(-c2ccc(OCC[C@H](C)O)cc2)no1	ZINC000450820485	CG	On-Demand	Anodyne	ACACA	25	57
COC(=O)c1n[nH]c2c1CN(c1ccc(C#N)c(C(F)(F)F)c1)CC2	ZINC000450820490	FF	On-Demand	Mild	AR	48	41
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccnn1CC(F)(F)F	ZINC000450820491	GE	On-Demand	Anodyne	NPFFR1	46	33
CC(=O)CCCCCn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000450820493	DG	On-Demand	Bother	F2RL3	44	33
CO[C@@H]1CN(c2ccc3nnc(-c4ccccc4)n3n2)C[C@H]1O	ZINC000450820504	DC	On-Demand	Anodyne	LRRK2	28	44
CO[C@@H]1CN(c2nc(-c3ccc(F)cc3)cs2)C[C@H]1O	ZINC000450820528	CE	On-Demand	Anodyne	EGFR	0	44
CO[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1O	ZINC000450820568	CD	On-Demand	Anodyne	PDE3A	49	41
CO[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1O	ZINC000450820568	CD	On-Demand	Anodyne	PDGFRB	32	42
CO[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1O	ZINC000450820568	CD	On-Demand	Anodyne	HRP1_PLAFA	47	31
CO[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1O	ZINC000450820568	CD	On-Demand	Anodyne	PDE3B	73	41
CO[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1O	ZINC000450820568	CD	On-Demand	Anodyne	HTT	0	43
COC(=O)C1(CNC(=O)c2ccc(N3CCC3)nc2)CCCCC1	ZINC000450820576	EE	On-Demand	Anodyne	HCN1	53	32
COC(=O)C1(CNC(=O)c2ccc(N3CCC3)nc2)CCCCC1	ZINC000450820576	EE	On-Demand	Anodyne	HCN4	51	32
C[C@H](Nc1ncc(F)cn1)C(=O)NCCc1ccccc1	ZINC000450820589	CD	On-Demand	Anodyne	MME	40	38
C[C@H](Nc1ncc(F)cn1)C(=O)NCCc1ccccc1	ZINC000450820589	CD	On-Demand	Anodyne	FAAH	46	34
C[C@H](Nc1ncc(F)cn1)C(=O)NCCc1ccccc1	ZINC000450820589	CD	On-Demand	Anodyne	AMP1_PLAFQ	37	47
C[C@H](Nc1ncc(F)cn1)C(=O)NCCc1ccccc1	ZINC000450820589	CD	On-Demand	Anodyne	CES1D	43	31
Cc1nc2ccccc2nc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820602	EG	On-Demand	Anodyne	MTNR1B	35	43
Cc1nc2ccccc2nc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820602	EG	On-Demand	Anodyne	AMP1_PLAFQ	42	45
Cc1cc([N+](=O)[O-])cnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820605	EE	On-Demand	Bother	NPR	31	41
CC(=O)CCCCCOc1ccc(C(C)=O)cc1F	ZINC000450820610	CH	On-Demand	Anodyne	THRA	42	55
CC(=O)CCCCCOc1ccc(C(C)=O)cc1F	ZINC000450820610	CH	On-Demand	Anodyne	THRB	24	55
CC(=O)CCCCCOc1ccc(C(C)=O)cc1F	ZINC000450820610	CH	On-Demand	Anodyne	GRM2	18	45
CCOC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820612	EE	On-Demand	Anodyne	CACNA1C	45	35
CCOC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820612	EE	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820612	EE	On-Demand	Anodyne	CAPN1	45	39
CCOC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820612	EE	On-Demand	Anodyne	CAPN2	80	39
CCOC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820612	EE	On-Demand	Anodyne	NPR	61	35
CCOC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450820612	EE	On-Demand	Anodyne	AMP1_PLAFQ	33	42
CO[C@H](COc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1)Cc1ccccc1	ZINC000450820615	GI	On-Demand	Anodyne	COLA	44	43
CO[C@H](COc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1)Cc1ccccc1	ZINC000450820615	GI	On-Demand	Anodyne	CPT1A	37	43
CO[C@@H](COc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1)Cc1ccccc1	ZINC000450820616	GI	On-Demand	Anodyne	COLA	44	43
CO[C@@H](COc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1)Cc1ccccc1	ZINC000450820616	GI	On-Demand	Anodyne	CPT1A	37	43
CO[C@H](COc1ccc(-c2noc([C@H]3CCCO3)n2)cc1)Cc1ccccc1	ZINC000450820617	GI	On-Demand	Anodyne	COLA	44	43
CO[C@H](COc1ccc(-c2noc([C@H]3CCCO3)n2)cc1)Cc1ccccc1	ZINC000450820617	GI	On-Demand	Anodyne	CPT1A	37	43
CO[C@@H](COc1ccc(-c2noc([C@H]3CCCO3)n2)cc1)Cc1ccccc1	ZINC000450820618	GI	On-Demand	Anodyne	COLA	44	43
CO[C@@H](COc1ccc(-c2noc([C@H]3CCCO3)n2)cc1)Cc1ccccc1	ZINC000450820618	GI	On-Demand	Anodyne	CPT1A	37	43
COC(=O)c1coc(COc2ccc(-c3noc([C@@H]4CCCO4)n3)cc2)n1	ZINC000450820620	FF	On-Demand	Anodyne	COLA	40	42
COC(=O)c1coc(COc2ccc(-c3noc([C@H]4CCCO4)n3)cc2)n1	ZINC000450820621	FF	On-Demand	Anodyne	COLA	40	42
O=[N+]([O-])c1ccc(NC[C@H]2CCCC[C@@H]2O)nc1NC[C@H]1CCCC[C@@H]1O	ZINC000450820622	GE	On-Demand	Bother	PRKCQ	46	38
COC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1OC	ZINC000450820625	FD	On-Demand	Anodyne	ANPEP	22	42
COC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1OC	ZINC000450820625	FD	On-Demand	Anodyne	AMP1_PLAFQ	27	42
C[C@@H](O)CCOc1ccc(-c2noc([C@H]3CCCO3)n2)cc1	ZINC000450820627	DF	On-Demand	Anodyne	COLA	40	40
C[C@@H](O)CCOc1ccc(-c2noc([C@H]3CCCO3)n2)cc1	ZINC000450820627	DF	On-Demand	Anodyne	CPT1A	29	40
C[C@H](O)CCOc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1	ZINC000450820628	DF	On-Demand	Anodyne	COLA	40	40
C[C@H](O)CCOc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1	ZINC000450820628	DF	On-Demand	Anodyne	CPT1A	29	40
C[C@@H](O)CCOc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1	ZINC000450820629	DF	On-Demand	Anodyne	COLA	40	40
C[C@@H](O)CCOc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1	ZINC000450820629	DF	On-Demand	Anodyne	CPT1A	29	40
C[C@H](O)CCOc1ccc(-c2noc([C@H]3CCCO3)n2)cc1	ZINC000450820630	DF	On-Demand	Anodyne	COLA	40	40
C[C@H](O)CCOc1ccc(-c2noc([C@H]3CCCO3)n2)cc1	ZINC000450820630	DF	On-Demand	Anodyne	CPT1A	29	40
CC(=O)Nc1nnc(S[C@H](C)CC(C)C)s1	ZINC000450820642	CG	On-Demand	Anodyne	CAHX_FLABI	0	41
CC(=O)Nc1nnc(S[C@@H](C)CC(C)C)s1	ZINC000450820643	CG	On-Demand	Anodyne	CAHX_FLABI	0	41
CC(C)c1noc(-c2ccnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2)n1	ZINC000450820655	GG	On-Demand	Anodyne	KDM4E	21	44
OCC1(CCNc2ncnc3scc(-c4ccc(F)cc4)c23)CC1	ZINC000450820656	EI	On-Demand	Anodyne	ADRB3	21	49
C[C@H](Nc1nc2c(F)cccc2n1C)C(=O)NCCc1ccccc1	ZINC000450820657	EE	On-Demand	Anodyne	ANPEP	16	40
C[C@H](Nc1nc2c(F)cccc2n1C)C(=O)NCCc1ccccc1	ZINC000450820657	EE	On-Demand	Anodyne	AMP1_PLAFQ	30	40
C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450820660	EF	On-Demand	Bother	COLA	80	35
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)NCCc1ccccc1	ZINC000450820665	FC	On-Demand	Anodyne	CA2	28	43
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)NCCc1ccccc1	ZINC000450820665	FC	On-Demand	Anodyne	CA1	27	43
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)NCCc1ccccc1	ZINC000450820665	FC	On-Demand	Anodyne	CA7	22	43
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)NCCc1ccccc1	ZINC000450820665	FC	On-Demand	Anodyne	CA5B	34	43
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)NCCc1ccccc1	ZINC000450820665	FC	On-Demand	Anodyne	CA4	22	41
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)NCCc1ccccc1	ZINC000450820665	FC	On-Demand	Anodyne	CA5A	33	43
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)NCCc1ccccc1	ZINC000450820665	FC	On-Demand	Anodyne	AMP1_PLAFQ	31	43
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)NCCc1ccccc1	ZINC000450820665	FC	On-Demand	Anodyne	NCE103	22	41
C[C@H](N=c1ccnc(N(C)C)[nH]1)C(=O)NCCc1ccccc1	ZINC000450820670	DD	On-Demand	Anodyne	AMP1_PLAFQ	37	43
CCOC(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820671	EE	On-Demand	Anodyne	PPIA	31	52
CCOC(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820671	EE	On-Demand	Anodyne	CAPN1	42	39
CCOC(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820671	EE	On-Demand	Anodyne	CAPN2	78	39
CCOC(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820671	EE	On-Demand	Anodyne	NPR	48	38
CCOC(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820671	EE	On-Demand	Anodyne	AMP1_PLAFQ	33	42
O=C(NC[C@@H](O)CCc1ccccc1)c1ccc(N2CCC2)nc1	ZINC000450820691	EE	On-Demand	Anodyne	HDAC1	32	45
O=C(NC[C@@H](O)CCc1ccccc1)c1ccc(N2CCC2)nc1	ZINC000450820691	EE	On-Demand	Anodyne	SMO	0	42
O=C(NC[C@@H](O)CCc1ccccc1)c1ccc(N2CCC2)nc1	ZINC000450820691	EE	On-Demand	Anodyne	HPGDS	0	41
O=C(NC[C@H](O)CCc1ccccc1)c1ccc(N2CCC2)nc1	ZINC000450820692	EE	On-Demand	Anodyne	HDAC1	22	45
O=C(NC[C@H](O)CCc1ccccc1)c1ccc(N2CCC2)nc1	ZINC000450820692	EE	On-Demand	Anodyne	HPGDS	24	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccnn1CC(F)(F)F	ZINC000450820694	GE	On-Demand	Anodyne	NPFFR1	46	33
CO[C@@H]1CN(c2nc(CN(C)C)nc3scc(-c4ccccc4)c23)C[C@H]1O	ZINC000450820709	GF	On-Demand	Anodyne	ADRB3	24	42
COC[C@@]1(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)CCOC1	ZINC000450820719	FD	On-Demand	Anodyne	NPFFR1	45	35
COC[C@]1(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)CCOC1	ZINC000450820720	FD	On-Demand	Anodyne	NPFFR1	45	35
COC[C@@]1(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)CCOC1	ZINC000450820722	FD	On-Demand	Anodyne	NPFFR1	45	35
COC[C@]1(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)CCOC1	ZINC000450820724	FD	On-Demand	Anodyne	NPFFR1	45	35
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820730	DF	On-Demand	Anodyne	SELE	73	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820730	DF	On-Demand	Anodyne	ICAM1	70	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820730	DF	On-Demand	Anodyne	VCAM1	52	34
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820732	DF	On-Demand	Anodyne	SELE	73	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820732	DF	On-Demand	Anodyne	ICAM1	70	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820732	DF	On-Demand	Anodyne	VCAM1	52	34
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820734	DF	On-Demand	Anodyne	SELE	73	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820734	DF	On-Demand	Anodyne	ICAM1	70	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820734	DF	On-Demand	Anodyne	VCAM1	52	34
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820735	DF	On-Demand	Anodyne	SELE	73	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820735	DF	On-Demand	Anodyne	ICAM1	70	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cc2ccncc2s1	ZINC000450820735	DF	On-Demand	Anodyne	VCAM1	52	34
CO[C@@H]1CN(c2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)C[C@H]1O	ZINC000450820742	FE	On-Demand	Anodyne	NPBWR1	48	41
CO[C@@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1O	ZINC000450820746	EE	On-Demand	Anodyne	CPT1A	44	36
CO[C@@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1O	ZINC000450820746	EE	On-Demand	Anodyne	PRNP	40	44
CO[C@@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1O	ZINC000450820746	EE	On-Demand	Anodyne	TAAR1	43	46
CO[C@@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1O	ZINC000450820746	EE	On-Demand	Anodyne	KCNK3	58	40
CO[C@@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C[C@H]1O	ZINC000450820746	EE	On-Demand	Anodyne	KCNK9	40	40
Cc1ncc([N+](=O)[O-])n1CC[C@@H]1CCOC1	ZINC000450820756	BD	On-Demand	Bother	TYMS	39	44
Cc1ncc([N+](=O)[O-])n1CC[C@H]1CCOC1	ZINC000450820760	BD	On-Demand	Bother	TYMS	39	44
CC(C)OC(C)(C)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820777	EE	On-Demand	Anodyne	NPFFR1	47	33
CC(C)OC(C)(C)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450820783	EE	On-Demand	Anodyne	NPFFR1	47	33
CNC(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)nn1	ZINC000450820784	DE	On-Demand	Anodyne	SCD1	40	40
CCc1cc(N2CCc3[nH]nc(C(=O)OC)c3C2)c2ccccc2n1	ZINC000450820803	EF	On-Demand	Anodyne	METAP1	41	39
C=CCC1(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)CCCC1	ZINC000450820830	FG	On-Demand	Mild	NPFFR1	48	35
C=CCC1(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)CCCC1	ZINC000450820831	FG	On-Demand	Mild	NPFFR1	48	35
CO[C@H](Cc1ccccc1)Cn1c([N+](=O)[O-])cnc1C	ZINC000450820847	CE	On-Demand	Bother	FABH	0	49
CO[C@@H](Cc1ccccc1)Cn1c([N+](=O)[O-])cnc1C	ZINC000450820849	CE	On-Demand	Bother	FABH	0	49
C[C@@H](SC[C@H]1CCN(S(C)(=O)=O)C1)c1ccc(OC(F)(F)F)cc1	ZINC000450820859	GH	On-Demand	Anodyne	EPHX2	17	42
C[C@H](SC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccc(OC(F)(F)F)cc1	ZINC000450820860	GH	On-Demand	Anodyne	EPHX2	17	42
C[C@H](SC[C@H]1CCN(S(C)(=O)=O)C1)c1ccc(OC(F)(F)F)cc1	ZINC000450820861	GH	On-Demand	Anodyne	EPHX2	17	42
C[C@@H](SC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccc(OC(F)(F)F)cc1	ZINC000450820862	GH	On-Demand	Anodyne	EPHX2	17	42
COC(=O)C[C@](C)(NC[C@H](O)Cc1ccccc1)c1cccc(OC)c1	ZINC000450820865	FF	On-Demand	Anodyne	SOAT1	0	48
COC(=O)C[C@](C)(NC[C@H](O)Cc1ccccc1)c1cccc(OC)c1	ZINC000450820865	FF	On-Demand	Anodyne	POL	0	43
COC(=O)C[C@](C)(NC[C@H](O)Cc1ccccc1)c1cccc(OC)c1	ZINC000450820865	FF	On-Demand	Anodyne	PLM1_PLAFA	40	43
COC(=O)C[C@](C)(NC[C@H](O)Cc1ccccc1)c1cccc(OC)c1	ZINC000450820865	FF	On-Demand	Anodyne	PDS	66	37
COC(=O)C[C@@](C)(NC[C@H](O)Cc1ccccc1)c1cccc(OC)c1	ZINC000450820866	FF	On-Demand	Anodyne	SOAT1	0	48
COC(=O)C[C@@](C)(NC[C@H](O)Cc1ccccc1)c1cccc(OC)c1	ZINC000450820866	FF	On-Demand	Anodyne	POL	0	43
COC(=O)C[C@@](C)(NC[C@H](O)Cc1ccccc1)c1cccc(OC)c1	ZINC000450820866	FF	On-Demand	Anodyne	PLM1_PLAFA	40	43
COC(=O)C[C@@](C)(NC[C@H](O)Cc1ccccc1)c1cccc(OC)c1	ZINC000450820866	FF	On-Demand	Anodyne	PDS	66	37
CC(F)(F)CCOc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000450820871	CI	On-Demand	Bother	S1PR4	0	46
COc1cccc(-n2cc(C(=O)NCC3(CCO)CC3)nn2)c1	ZINC000450820881	DD	On-Demand	Anodyne	DRD4	44	35
O=C(Nc1cccc(Cl)c1)c1ccc(=NCCC2(CO)CC2)[nH]c1	ZINC000450820891	EF	On-Demand	Anodyne	KCNK3	56	36
Cc1cncc(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450820894	CD	On-Demand	Anodyne	AMP1_PLAFQ	30	43
COC(=O)[C@H]1C[C@H](O)CN1Cc1ccccc1OC1CC1	ZINC000450820898	CD	On-Demand	Anodyne	SLC5A4	51	33
COC(=O)[C@@H]1C[C@H](O)CN1Cc1ccccc1OC1CC1	ZINC000450820899	CD	On-Demand	Anodyne	SLC5A4	51	33
COC(=O)[C@H]1C[C@@H](O)CN1Cc1ccccc1OC1CC1	ZINC000450820900	CD	On-Demand	Anodyne	SLC5A4	51	33
Cc1cc(C)n(-c2ccc(N[C@@H](C)C(=O)NCCc3ccccc3)nn2)n1	ZINC000450820905	FD	On-Demand	Anodyne	CARM1	37	41
COCCN1CCCN(CCCC(=O)c2ccccc2)CC1=O	ZINC000450820908	DD	On-Demand	Anodyne	SLC6A1	55	36
COCCN1CCCN(CCCC(=O)c2ccccc2)CC1=O	ZINC000450820908	DD	On-Demand	Anodyne	HTR5A	30	49
COCCN1CCCN(CCCC(=O)c2ccccc2)CC1=O	ZINC000450820908	DD	On-Demand	Anodyne	CYP2J2	55	39
CCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450820909	DF	On-Demand	Anodyne	THRA	0	41
CCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450820909	DF	On-Demand	Anodyne	DRD2	35	53
CCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450820909	DF	On-Demand	Anodyne	DRD4	0	45
CCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450820909	DF	On-Demand	Anodyne	THRB	0	40
CCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450820909	DF	On-Demand	Anodyne	SLC18A3	0	46
CCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450820909	DF	On-Demand	Anodyne	CYP2J2	52	37
CCCc1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450820910	DE	On-Demand	Anodyne	AMP1_PLAFQ	27	43
C[C@@H](O)CCCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450820915	CG	On-Demand	Anodyne	COLA	42	41
C[C@@H](O)CCCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450820915	CG	On-Demand	Anodyne	CPT1A	30	41
C[C@H](O)CCCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450820916	CG	On-Demand	Anodyne	COLA	42	41
C[C@H](O)CCCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450820916	CG	On-Demand	Anodyne	CPT1A	30	41
C[C@H](Nc1nccn(C2CC2)c1=O)C(=O)NCCc1ccccc1	ZINC000450820918	ED	On-Demand	Anodyne	ACE	44	37
C[C@H](Nc1nccn(C2CC2)c1=O)C(=O)NCCc1ccccc1	ZINC000450820918	ED	On-Demand	Anodyne	CASP3	62	35
C[C@H](Nc1nccn(C2CC2)c1=O)C(=O)NCCc1ccccc1	ZINC000450820918	ED	On-Demand	Anodyne	CASP8	60	35
C[C@H](Nc1nccn(C2CC2)c1=O)C(=O)NCCc1ccccc1	ZINC000450820918	ED	On-Demand	Anodyne	BIRC2	49	33
FC1(F)CC(COc2ccc(-c3noc(C4CC4)n3)cc2)C1	ZINC000450820919	DI	On-Demand	Anodyne	ETHR	42	37
COc1cc(OC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820920	ED	On-Demand	Anodyne	MTNR1A	51	40
COc1cc(OC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820920	ED	On-Demand	Anodyne	MTNR1B	44	40
COc1cc(OC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820920	ED	On-Demand	Anodyne	ACE2	40	33
COc1cc(OC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820920	ED	On-Demand	Anodyne	ALS	87	37
COc1cc(OC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820920	ED	On-Demand	Anodyne	NPR	58	40
COc1cc(OC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820920	ED	On-Demand	Anodyne	AMP1_PLAFQ	42	44
Cc1cccc2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c12	ZINC000450820923	EG	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](N=c1[nH]c(C(F)(F)F)cs1)C(=O)NCCc1ccccc1	ZINC000450820925	EF	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CC(=O)c1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1C	ZINC000450820927	EE	On-Demand	Anodyne	AMP1_PLAFQ	30	42
COc1ccc(-c2noc(COc3ccc(-c4noc(C5CC5)n4)cc3)n2)nn1	ZINC000450820944	GG	On-Demand	Anodyne	COLA	28	41
COc1ccc(-c2noc(COc3ccc(-c4noc(C5CC5)n4)cc3)n2)nn1	ZINC000450820944	GG	On-Demand	Anodyne	CPT1A	23	41
C[C@H](Nc1cc(N2CCCCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450820945	FF	On-Demand	Anodyne	KCNQ2	44	33
C[C@H](Nc1cc(N2CCCCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450820945	FF	On-Demand	Anodyne	AMP1_PLAFQ	37	41
C[C@H](Nc1cc(N2CCCCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450820945	FF	On-Demand	Anodyne	BIRC2	48	38
COc1nc(C)cc(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450820954	DD	On-Demand	Anodyne	ANPEP	22	40
COc1nc(C)cc(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450820954	DD	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](Nc1nnc(Cc2ccc(F)cc2)s1)C(=O)NCCc1ccccc1	ZINC000450820957	GF	On-Demand	Anodyne	MME	21	41
C[C@H](Nc1nnc(Cc2ccc(F)cc2)s1)C(=O)NCCc1ccccc1	ZINC000450820957	GF	On-Demand	Anodyne	AMP1_PLAFQ	26	40
Cc1cc(C)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820960	CE	On-Demand	Anodyne	MTNR1A	33	41
Cc1cc(C)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820960	CE	On-Demand	Anodyne	MTNR1B	46	41
Cc1cc(C)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450820960	CE	On-Demand	Anodyne	AMP1_PLAFQ	41	47
FC1(F)CCC[C@@H]1COc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450820961	DI	On-Demand	Anodyne	COLA	41	39
FC1(F)CCC[C@@H]1COc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450820961	DI	On-Demand	Anodyne	ETHR	47	37
FC1(F)CCC[C@H]1COc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450820962	DI	On-Demand	Anodyne	COLA	41	39
FC1(F)CCC[C@H]1COc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450820962	DI	On-Demand	Anodyne	ETHR	47	37
Cc1ccn2ncc(C(=O)N[C@H]3CCO[C@@H]3c3cnn(C)c3C)c2c1	ZINC000450820970	ED	On-Demand	Anodyne	EPHB3	36	49
Cc1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450820977	EE	On-Demand	Bother	COLA	70	34
Cc1cc(Br)cnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820979	FG	On-Demand	Anodyne	ANPEP	25	44
Cc1cc(Br)cnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450820979	FG	On-Demand	Anodyne	AMP1_PLAFQ	36	44
Nc1nc(NC2(Cc3ccc(F)cc3)CC2)ncc1[N+](=O)[O-]	ZINC000450820991	DE	On-Demand	Bother	PRKCQ	43	44
COc1cc(OC)c2ncnc(N3C[C@@H](O)[C@H](OC)C3)c2c1	ZINC000450820992	DC	On-Demand	Anodyne	PDE3A	49	39
COc1cc(OC)c2ncnc(N3C[C@@H](O)[C@H](OC)C3)c2c1	ZINC000450820992	DC	On-Demand	Anodyne	PDE3B	72	39
COC(=O)c1n[nH]c2c1CN(c1ccc(C(=O)NC3CC3)cc1[N+](=O)[O-])CC2	ZINC000450821021	GD	On-Demand	Bother	TAAR1	19	42
Cc1cccc(Cl)c1C(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450821024	DG	On-Demand	Anodyne	CXCL8	53	36
Cc1cccc(Cl)c1C(=O)NC[C@H](O)CCc1ccccc1	ZINC000450821025	DG	On-Demand	Anodyne	CXCL8	53	36
C=CCCN(C)CCCC(=O)c1ccc(F)cc1	ZINC000450821030	BG	On-Demand	Mild	LSS	43	48
COc1cccc(Cc2nnc(SCc3oc(C(C)C)nc3C)o2)c1	ZINC000450821037	FI	On-Demand	Anodyne	CPB	0	47
CCc1nc(C)c(CSc2nnc(Cc3cccc(OC)c3)o2)o1	ZINC000450821056	EH	On-Demand	Anodyne	CPB	0	48
COC(=O)c1n[nH]c2c1CN(c1cc([N+](=O)[O-])ccc1S(N)(=O)=O)CC2	ZINC000450821071	GC	On-Demand	Bother	CACNA1D	59	32
COC(=O)c1n[nH]c2c1CN(c1ncnc3cc(Cl)ccc13)CC2	ZINC000450821080	EE	On-Demand	Anodyne	PDGFRB	58	38
COC(=O)c1n[nH]c2c1CN(c1ncnc3cc(Cl)ccc13)CC2	ZINC000450821080	EE	On-Demand	Anodyne	HRP1_PLAFA	41	35
Cc1ncc([N+](=O)[O-])n1Cc1nnc(C(C)C)s1	ZINC000450821086	CE	On-Demand	Bother	TYMS	34	44
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450821088	GG	On-Demand	Anodyne	OPRK1	16	41
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450821088	GG	On-Demand	Anodyne	SIGMAR1	44	36
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450821088	GG	On-Demand	Anodyne	NPFFR1	47	37
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450821089	GG	On-Demand	Anodyne	OPRK1	16	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450821089	GG	On-Demand	Anodyne	SIGMAR1	44	36
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450821089	GG	On-Demand	Anodyne	NPFFR1	47	37
CN(CCCC(=O)c1ccc(F)cc1)CC1(CO)CC1	ZINC000450821095	CE	On-Demand	Anodyne	DRD2	29	40
CN(CCCC(=O)c1ccc(F)cc1)CC1(CO)CC1	ZINC000450821095	CE	On-Demand	Anodyne	DRD4	0	43
CN(CCCC(=O)c1ccc(F)cc1)CC1(CO)CC1	ZINC000450821095	CE	On-Demand	Anodyne	SLC18A3	0	41
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2c2ccccc2)c(OC)c1	ZINC000450821119	GH	On-Demand	Anodyne	TACR1	36	43
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2c2ccccc2)c(OC)c1	ZINC000450821119	GH	On-Demand	Anodyne	MTNR1A	81	39
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2c2ccccc2)c(OC)c1	ZINC000450821119	GH	On-Demand	Anodyne	MTNR1B	68	39
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2c2ccccc2)c(OC)c1	ZINC000450821120	GH	On-Demand	Anodyne	TACR1	36	43
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2c2ccccc2)c(OC)c1	ZINC000450821120	GH	On-Demand	Anodyne	MTNR1A	81	39
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2c2ccccc2)c(OC)c1	ZINC000450821120	GH	On-Demand	Anodyne	MTNR1B	68	39
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2c2ccccc2)c(OC)c1	ZINC000450821121	GH	On-Demand	Anodyne	TACR1	36	43
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2c2ccccc2)c(OC)c1	ZINC000450821121	GH	On-Demand	Anodyne	MTNR1A	81	39
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2c2ccccc2)c(OC)c1	ZINC000450821121	GH	On-Demand	Anodyne	MTNR1B	68	39
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2c2ccccc2)c(OC)c1	ZINC000450821122	GH	On-Demand	Anodyne	TACR1	36	43
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2c2ccccc2)c(OC)c1	ZINC000450821122	GH	On-Demand	Anodyne	MTNR1A	81	39
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2c2ccccc2)c(OC)c1	ZINC000450821122	GH	On-Demand	Anodyne	MTNR1B	68	39
COc1ccc(CNC(=O)CCN(C)CC2(CO)CC2)c(OC)c1	ZINC000450821147	ED	On-Demand	Anodyne	MTNR1A	51	35
CCCOc1cccc(Cn2c([N+](=O)[O-])cnc2C)c1	ZINC000450821148	CF	On-Demand	Bother	FABH	0	43
CCS(=O)(=O)c1ccc(CN2CCCCC(C)(C)C2)cc1	ZINC000450821159	DG	On-Demand	Anodyne	ADAM17	21	44
N#Cc1ccc(OCC(=O)NCC2(CCO)CC2)cc1Br	ZINC000450821169	FD	On-Demand	Mild	TRPV4	41	31
CN(C)c1nccc(N2CC(c3cccc(Cl)c3)C2)n1	ZINC000450821175	CF	On-Demand	Anodyne	SORD	42	36
CC(=O)Nc1cccnc1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450821176	GF	On-Demand	Anodyne	G2YM83_BOTF4	59	37
CC(=O)CCCCCn1c(-c2ccccc2)noc1=O	ZINC000450821177	CF	On-Demand	Anodyne	FAAH	47	36
C[C@H](N=c1[nH]ccnc1C(F)F)C(=O)NCCc1ccccc1	ZINC000450821191	DD	On-Demand	Anodyne	AMP1_PLAFQ	22	40
Cc1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)s1	ZINC000450821192	CF	On-Demand	Anodyne	AMP1_PLAFQ	32	44
C[C@H]1CCCN(c2cc(N[C@@H](C)C(=O)NCCc3ccccc3)ncn2)C1	ZINC000450821193	FF	On-Demand	Anodyne	ACE	61	40
C[C@H]1CCCN(c2cc(N[C@@H](C)C(=O)NCCc3ccccc3)ncn2)C1	ZINC000450821193	FF	On-Demand	Anodyne	MME	23	44
C[C@H]1CCCN(c2cc(N[C@@H](C)C(=O)NCCc3ccccc3)ncn2)C1	ZINC000450821193	FF	On-Demand	Anodyne	XPNPEP1	0	41
C[C@H]1CCCN(c2cc(N[C@@H](C)C(=O)NCCc3ccccc3)ncn2)C1	ZINC000450821193	FF	On-Demand	Anodyne	PRCP	24	46
C[C@H]1CCCN(c2cc(N[C@@H](C)C(=O)NCCc3ccccc3)ncn2)C1	ZINC000450821193	FF	On-Demand	Anodyne	XPNPEP2	0	41
C[C@H]1CCCN(c2cc(N[C@@H](C)C(=O)NCCc3ccccc3)ncn2)C1	ZINC000450821193	FF	On-Demand	Anodyne	XIAP	58	45
C[C@H](Nc1cc(N2CCC[C@@H](C)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821194	FF	On-Demand	Anodyne	ACE	61	40
C[C@H](Nc1cc(N2CCC[C@@H](C)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821194	FF	On-Demand	Anodyne	MME	23	44
C[C@H](Nc1cc(N2CCC[C@@H](C)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821194	FF	On-Demand	Anodyne	XPNPEP1	0	41
C[C@H](Nc1cc(N2CCC[C@@H](C)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821194	FF	On-Demand	Anodyne	PRCP	24	46
C[C@H](Nc1cc(N2CCC[C@@H](C)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821194	FF	On-Demand	Anodyne	XPNPEP2	0	41
C[C@H](Nc1cc(N2CCC[C@@H](C)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821194	FF	On-Demand	Anodyne	XIAP	58	45
C[C@@H]1C(=O)NCCCN1CCCC(=O)c1ccccc1	ZINC000450821203	CD	On-Demand	Anodyne	DRD2	27	41
C[C@@H]1C(=O)NCCCN1CCCC(=O)c1ccccc1	ZINC000450821203	CD	On-Demand	Anodyne	CYP2J2	54	39
C[C@H]1C(=O)NCCCN1CCCC(=O)c1ccccc1	ZINC000450821204	CD	On-Demand	Anodyne	DRD2	27	41
C[C@H]1C(=O)NCCCN1CCCC(=O)c1ccccc1	ZINC000450821204	CD	On-Demand	Anodyne	CYP2J2	54	39
C[C@H](Nc1cc(C(F)(F)F)ccn1)C(=O)NCCc1ccccc1	ZINC000450821208	EG	On-Demand	Anodyne	AMP1_PLAFQ	30	41
C[C@H](Nc1cc(C(F)(F)F)ccn1)C(=O)NCCc1ccccc1	ZINC000450821208	EG	On-Demand	Anodyne	CARM1	70	36
C[C@H](Nc1cc(C(F)(F)F)ccn1)C(=O)NCCc1ccccc1	ZINC000450821208	EG	On-Demand	Anodyne	KDM4E	23	47
C[C@H](Nc1cc(C(F)(F)F)ccn1)C(=O)NCCc1ccccc1	ZINC000450821208	EG	On-Demand	Anodyne	CCL2	0	40
C[C@H](Nc1cc(C(F)(F)F)ccn1)C(=O)NCCc1ccccc1	ZINC000450821208	EG	On-Demand	Anodyne	PDS	47	48
CCOC(=O)c1sc2ncnc(NCCC3(CO)CC3)c2c1C	ZINC000450821220	EF	On-Demand	Anodyne	MKNK2	19	40
CC(=O)Nc1nnc(SCCN(C)Cc2ccccc2)s1	ZINC000450821221	DF	On-Demand	Anodyne	GLS	0	41
CC(C)NS(=O)(=O)c1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821231	GD	On-Demand	Anodyne	AMP1_PLAFQ	23	42
C[C@@H]1C(=O)NCCCN1CC/C=C/c1ccccc1	ZINC000450821232	CE	On-Demand	Anodyne	GHRL	58	35
C[C@H]1C(=O)NCCCN1CC/C=C\c1ccccc1	ZINC000450821233	CE	On-Demand	Anodyne	GHRL	58	35
C[C@H]1C(=O)NCCCN1CC/C=C/c1ccccc1	ZINC000450821234	CE	On-Demand	Anodyne	GHRL	58	35
C[C@@H]1C(=O)NCCCN1CC/C=C\c1ccccc1	ZINC000450821235	CE	On-Demand	Anodyne	GHRL	58	35
O=C(NC1CC1)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450821238	DE	On-Demand	Bother	TAAR1	15	41
Cc1csc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc12	ZINC000450821242	EG	On-Demand	Anodyne	LPAR2	23	47
CCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821250	ED	On-Demand	Anodyne	ANPEP	22	41
CCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821250	ED	On-Demand	Anodyne	EPHX2	0	41
CCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821250	ED	On-Demand	Anodyne	AMP1_PLAFQ	30	41
CCNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821250	ED	On-Demand	Anodyne	GCK	22	40
O[C@H]1CCCC[C@@H]1CNc1cnc(-c2ccccc2)cn1	ZINC000450821252	CG	On-Demand	Anodyne	TPH1	30	43
O[C@H]1CCCC[C@@H]1CNc1cnc(-c2ccccc2)cn1	ZINC000450821252	CG	On-Demand	Anodyne	VCP	40	36
C[C@H](Nc1ccc2nnc(C(F)(F)F)n2n1)C(=O)NCCc1ccccc1	ZINC000450821253	GD	On-Demand	Anodyne	CARM1	74	35
Cc1nn(C)c(N2CCN(CCN(C)Cc3ccccc3)CC2)c1C#N	ZINC000450821262	FD	On-Demand	Mild	SIGMAR1	16	40
CCc1nc(C)c(COc2ccc(OC)cc2C(N)=O)o1	ZINC000450821264	CE	On-Demand	Anodyne	SLC22A12	46	38
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)nc(N(C)C)n1	ZINC000450821265	EC	On-Demand	Anodyne	ANPEP	15	42
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)nc(N(C)C)n1	ZINC000450821265	EC	On-Demand	Anodyne	AMP1_PLAFQ	30	42
Brc1ccccc1C1CCN(CCc2cscn2)CC1	ZINC000450821272	FI	On-Demand	Anodyne	SCN5A	42	34
Cc1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821274	CD	On-Demand	Anodyne	MME	39	40
Cc1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821274	CD	On-Demand	Anodyne	SDH1	0	40
Cc1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821274	CD	On-Demand	Anodyne	FAAH	51	40
Cc1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821274	CD	On-Demand	Anodyne	AMP1_PLAFQ	44	48
Cc1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450821274	CD	On-Demand	Anodyne	CES1D	44	31
CN(C)c1nccc(N2CC(c3ccc(Cl)cc3)C2)n1	ZINC000450821282	CF	On-Demand	Anodyne	SORD	42	37
C[C@H](Nc1ncnc2c1cnn2C)C(=O)NCCc1ccccc1	ZINC000450821283	DD	On-Demand	Anodyne	ABL1	35	44
C[C@H](Nc1ncnc2c1cnn2C)C(=O)NCCc1ccccc1	ZINC000450821283	DD	On-Demand	Anodyne	SRC	0	47
COC(=O)C1(CN[C@@H](C)c2ccc(Br)cc2OC)CC1	ZINC000450821296	EG	On-Demand	Anodyne	SDH1	0	52
COC(=O)C1(CN[C@H](C)c2ccc(Br)cc2OC)CC1	ZINC000450821298	EG	On-Demand	Anodyne	SDH1	0	52
CN1[C@H]2CC[C@H]1CC(N=c1[nH]c3cccc(F)c3n1C)C2	ZINC000450821300	CE	On-Demand	Anodyne	GLRA1	43	36
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(F)c(Cl)cc13)C2	ZINC000450821330	DI	On-Demand	Anodyne	HRP1_PLAFA	115	37
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(F)c(Cl)cc13)C2	ZINC000450821330	DI	On-Demand	Anodyne	HNMT	56	37
Clc1cccc(C2CN(c3ccnc(N4CCOCC4)n3)C2)c1	ZINC000450821342	EF	On-Demand	Anodyne	SMG1	44	44
COc1ccc(OCCSCc2nc(-c3ccc(OC)nn3)no2)cc1	ZINC000450821349	FF	On-Demand	Anodyne	AXIN2	0	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450821371	DG	On-Demand	Anodyne	PYGL	17	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450821371	DG	On-Demand	Anodyne	PYGM	32	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450821373	DG	On-Demand	Anodyne	PYGL	17	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450821373	DG	On-Demand	Anodyne	PYGM	32	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450821375	DG	On-Demand	Anodyne	PYGL	17	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450821375	DG	On-Demand	Anodyne	PYGM	32	41
COC(=O)c1ccc(CN2CCc3ncsc3C2)cc1Cl	ZINC000450821377	DG	On-Demand	Anodyne	ABCG2	27	40
O=S(=O)(NCC(F)(F)F)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450821399	GF	On-Demand	Anodyne	SFRP1	99	43
O=S(=O)(NCC(F)(F)F)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450821399	GF	On-Demand	Anodyne	WNT3	58	36
O=S(=O)(NCC(F)(F)F)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450821401	GF	On-Demand	Anodyne	SFRP1	99	43
O=S(=O)(NCC(F)(F)F)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450821401	GF	On-Demand	Anodyne	WNT3	58	36
COC(=O)c1n[nH]c2c1CN(c1nc(-c3ccccc3)ns1)CC2	ZINC000450821422	EE	On-Demand	Anodyne	FAAH	19	52
COC(=O)c1ccc(CN(C)CC[C@H]2CCCO2)cc1Cl	ZINC000450821438	DG	On-Demand	Anodyne	OXTR	22	42
COC(=O)c1ccc(CN(C)CC[C@@H]2CCCO2)cc1Cl	ZINC000450821439	DG	On-Demand	Anodyne	OXTR	22	42
COC(=O)c1n[nH]c2c1CN(c1ncnc3sc4c(c13)CCCC4)CC2	ZINC000450821452	FF	On-Demand	Anodyne	RBP4	17	41
COC(=O)c1n[nH]c2c1CN(c1cccc(OC)c1[N+](=O)[O-])CC2	ZINC000450821461	ED	On-Demand	Bother	HTR1A	20	40
COC(=O)c1n[nH]c2c1CN(c1cccc(OC)c1[N+](=O)[O-])CC2	ZINC000450821461	ED	On-Demand	Bother	ADRA1D	21	40
CCOc1cc2nccc(N3C[C@@H](O)[C@H](OC)C3)c2cc1OCC	ZINC000450821468	EE	On-Demand	Anodyne	PDE3B	66	39
CCOC(=O)c1ccc(CN(C)CC[C@@H]2CCCO2)nc1	ZINC000450821471	CE	On-Demand	Anodyne	OXTR	25	40
CCOC(=O)c1ccc(CN(C)CC[C@@H]2CCCO2)nc1	ZINC000450821471	CE	On-Demand	Anodyne	AVPR1A	0	40
CCOC(=O)c1ccc(CN(C)CC[C@H]2CCCO2)nc1	ZINC000450821472	CE	On-Demand	Anodyne	OXTR	25	40
CCOC(=O)c1ccc(CN(C)CC[C@H]2CCCO2)nc1	ZINC000450821472	CE	On-Demand	Anodyne	AVPR1A	0	40
CO[C@@H]1CN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450821475	EE	On-Demand	Bother	TAAR1	17	42
C[C@@H](CNc1nc2ccccc2nc1NS(=O)(=O)c1ccccc1)N(C)C	ZINC000450821486	GE	On-Demand	Anodyne	PRTN3	44	32
Cc1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)n1CC(=O)N(C)C	ZINC000450821488	GH	On-Demand	Anodyne	PLA2G7	61	36
Cc1nnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)n1CC(=O)N(C)C	ZINC000450821489	GH	On-Demand	Anodyne	PLA2G7	61	36
O=C(NCC1(CCO)CC1)c1ccccc1-n1cc(Br)cn1	ZINC000450821490	FF	On-Demand	Anodyne	HCN1	57	35
O=C(NCC1(CCO)CC1)c1ccccc1-n1cc(Br)cn1	ZINC000450821490	FF	On-Demand	Anodyne	HCN4	52	34
COc1cc(CC(=O)NCC2(CCO)CC2)ccc1Cl	ZINC000450821523	CE	On-Demand	Anodyne	TRPV1	27	45
COc1cc(CC(=O)NCC2(CCO)CC2)ccc1Cl	ZINC000450821523	CE	On-Demand	Anodyne	NCE103	26	45
COc1cc(CC(=O)NCC2(CCO)CC2)ccc1Cl	ZINC000450821523	CE	On-Demand	Anodyne	CAN2	0	45
C[C@H](Nc1cc(NCC2CC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821532	EE	On-Demand	Anodyne	AMP1_PLAFQ	37	41
C[C@H](Nc1cc(NCC2CC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821532	EE	On-Demand	Anodyne	VCP	60	38
C[C@H](Nc1cc(NCC2CC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450821532	EE	On-Demand	Anodyne	GPR39	0	46
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCC1(CO)CC1	ZINC000450821533	EC	On-Demand	Anodyne	CA2	55	53
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCC1(CO)CC1	ZINC000450821533	EC	On-Demand	Anodyne	CA1	47	39
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCC1(CO)CC1	ZINC000450821533	EC	On-Demand	Anodyne	CA7	44	37
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCC1(CO)CC1	ZINC000450821533	EC	On-Demand	Anodyne	CA4	54	38
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCC1(CO)CC1	ZINC000450821533	EC	On-Demand	Anodyne	CA5A	41	37
CC(C)Cc1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450821535	EE	On-Demand	Anodyne	ANPEP	24	45
CC(C)Cc1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450821535	EE	On-Demand	Anodyne	AMP1_PLAFQ	38	45
C[C@H](Nc1ccc(OC(F)F)cn1)C(=O)NCCc1ccccc1	ZINC000450821537	EF	On-Demand	Anodyne	AMP1_PLAFQ	30	40
OC[C@H]1CCCN1c1cc(NCCC2(CO)CC2)ncn1	ZINC000450821539	CD	On-Demand	Anodyne	PRCP	19	40
OC[C@@H]1CCCN1c1cc(NCCC2(CO)CC2)ncn1	ZINC000450821540	CD	On-Demand	Anodyne	PRCP	19	40
COC[C@H](Cc1ccccc1)N(C)CC1(C(=O)OC)CC1	ZINC000450821542	CE	On-Demand	Anodyne	TIMP3	56	36
COC[C@@H](Cc1ccccc1)N(C)CC1(C(=O)OC)CC1	ZINC000450821544	CE	On-Demand	Anodyne	TIMP3	56	36
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1Br	ZINC000450821547	FG	On-Demand	Anodyne	ANPEP	34	46
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1Br	ZINC000450821547	FG	On-Demand	Anodyne	AMP1_PLAFQ	37	46
COc1ccc(CNC(=O)CCN2CC[C@H](O)C(C)(C)C2)c(OC)c1	ZINC000450821548	FD	On-Demand	Anodyne	HTR7	26	40
COc1ccc(CNC(=O)CCN2CC[C@H](O)C(C)(C)C2)c(OC)c1	ZINC000450821548	FD	On-Demand	Anodyne	MTNR1A	57	38
COc1ccc(CNC(=O)CCN2CC[C@H](O)C(C)(C)C2)c(OC)c1	ZINC000450821548	FD	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN2CC[C@@H](O)C(C)(C)C2)c(OC)c1	ZINC000450821550	FD	On-Demand	Anodyne	HTR7	26	40
COc1ccc(CNC(=O)CCN2CC[C@@H](O)C(C)(C)C2)c(OC)c1	ZINC000450821550	FD	On-Demand	Anodyne	MTNR1A	57	38
COc1ccc(CNC(=O)CCN2CC[C@@H](O)C(C)(C)C2)c(OC)c1	ZINC000450821550	FD	On-Demand	Anodyne	MTNR1B	46	38
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450821563	GF	On-Demand	Anodyne	NPFFR1	46	33
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450821564	GF	On-Demand	Anodyne	NPFFR1	46	33
COCCN1CCCN(CCN(C)Cc2ccccc2)CC1=O	ZINC000450821570	DD	On-Demand	Anodyne	SIGMAR1	20	45
COC(=O)c1ccc(CN2CCCNC(=O)[C@@H]2C)cc1Cl	ZINC000450821598	DD	On-Demand	Anodyne	Q9FYV8_MAIZE	43	39
COC(=O)c1ccc(CN2CCCNC(=O)[C@H]2C)cc1Cl	ZINC000450821599	DD	On-Demand	Anodyne	Q9FYV8_MAIZE	43	39
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821608	FF	On-Demand	Bother	CACNA1C	41	39
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821608	FF	On-Demand	Bother	CACNA1D	75	39
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821608	FF	On-Demand	Bother	COLA	44	33
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821608	FF	On-Demand	Bother	NPR	36	43
Cc1ncc([N+](=O)[O-])n1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450821609	BD	On-Demand	Bother	TYMS	36	41
Cc1ncc([N+](=O)[O-])n1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450821611	BD	On-Demand	Bother	TYMS	36	41
CC(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450821630	EI	On-Demand	Anodyne	CPT1A	49	43
CC(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450821630	EI	On-Demand	Anodyne	NR1H4	56	38
CC(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450821630	EI	On-Demand	Anodyne	GYS1	49	38
CC(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450821630	EI	On-Demand	Anodyne	GRM5	29	40
CC(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450821630	EI	On-Demand	Anodyne	FFAR1	53	37
CC(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450821630	EI	On-Demand	Anodyne	SMO	40	36
CC(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450821630	EI	On-Demand	Anodyne	ETHR	51	39
CCSc1cccnc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450821631	GF	On-Demand	Anodyne	NPFFR1	48	34
CCSc1cccnc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450821632	GF	On-Demand	Anodyne	NPFFR1	48	34
Cc1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450821634	EG	On-Demand	Bother	BDKRB1	0	40
Cc1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450821634	EG	On-Demand	Bother	AMP1_PLAFQ	27	41
C[C@H](Nc1ncccc1F)C(=O)NCCc1ccccc1	ZINC000450821647	CE	On-Demand	Anodyne	AMP1_PLAFQ	35	44
CCOC(=O)c1ccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)nc1	ZINC000450821651	GI	On-Demand	Anodyne	SSTR5	48	41
CC(=O)c1ccc(OCCC[C@@H](C)O)c(F)c1	ZINC000450821661	BF	On-Demand	Anodyne	THRA	0	45
CC(=O)c1ccc(OCCC[C@@H](C)O)c(F)c1	ZINC000450821661	BF	On-Demand	Anodyne	GRM2	18	47
CC(=O)c1ccc(OCCC[C@H](C)O)c(F)c1	ZINC000450821662	BF	On-Demand	Anodyne	THRA	0	45
CC(=O)c1ccc(OCCC[C@H](C)O)c(F)c1	ZINC000450821662	BF	On-Demand	Anodyne	GRM2	18	47
CCCc1cc(NCCC2(CO)CC2)n2ncnc2n1	ZINC000450821666	CD	On-Demand	Anodyne	DHOD	0	46
C[C@H](N=c1nc(C2CC2)[nH]s1)C(=O)NCCc1ccccc1	ZINC000450821668	DD	On-Demand	Anodyne	AMP1_PLAFQ	23	41
C[C@H](Nc1ncc(Br)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450821669	GF	On-Demand	Bother	COLA	98	36
C[C@H](Nc1ncc(Br)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450821669	GF	On-Demand	Bother	AMP1_PLAFQ	27	41
C[C@H](Nc1cnn(C)c(=O)c1Cl)C(=O)NCCc1ccccc1	ZINC000450821670	ED	On-Demand	Anodyne	AMP1_PLAFQ	30	41
O=[N+]([O-])c1cccc2ncnc(NC[C@H]3CCCC[C@@H]3O)c12	ZINC000450821671	DD	On-Demand	Bother	PRKCQ	43	34
C[C@H](Nc1ncc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450821672	DE	On-Demand	Anodyne	SCNN1A	25	40
C[C@H](Nc1ncc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450821672	DE	On-Demand	Anodyne	FAAH	46	36
C[C@H](Nc1ncc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450821672	DE	On-Demand	Anodyne	CAPN1	41	40
C[C@H](Nc1ncc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450821672	DE	On-Demand	Anodyne	CAPN2	73	40
C[C@H](Nc1ncc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450821672	DE	On-Demand	Anodyne	AMP1_PLAFQ	47	47
C[C@H](Nc1ncc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450821672	DE	On-Demand	Anodyne	CES1D	52	31
COC(=O)c1n[nH]c2c1CN(c1nc(O)c3cc([N+](=O)[O-])ccc3n1)CC2	ZINC000450821696	FD	On-Demand	Bother	CTRB1	27	43
COC(=O)C1(CNC(=O)C2(Cc3ccccc3)CCOCC2)CCCCC1	ZINC000450821708	FG	On-Demand	Anodyne	SLC12A5	60	38
COC(=O)c1n[nH]c2c1CN(c1ncccc1OCc1ccccc1)CC2	ZINC000450821717	FF	On-Demand	Anodyne	PPIA	40	39
CO[C@@H]1CN(c2cc(C)nc3ccc(F)cc23)C[C@H]1O	ZINC000450821724	CD	On-Demand	Anodyne	DHODH	43	35
Cc1ccnn1-c1ccccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450821762	CE	On-Demand	Anodyne	KCNQ2	64	38
Cc1ccnn1-c1ccccc1NC(=O)[C@H](O)C1CCC1	ZINC000450821764	CE	On-Demand	Anodyne	KCNQ2	64	38
COC(=O)c1n[nH]c2c1CN(c1ccc(Cl)cn1)CC2	ZINC000450821773	CD	On-Demand	Anodyne	NPBWR1	44	33
CO[C@@H]1CN(c2ncnc3scc(-c4ccc(F)cc4)c23)C[C@H]1O	ZINC000450821777	EF	On-Demand	Anodyne	ADRB3	31	51
C=CCCN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450821785	DE	On-Demand	Mild	MTNR1A	56	38
CO[C@@H]1CN(c2cc(C)nc(-c3cccnc3)n2)C[C@H]1O	ZINC000450821786	CD	On-Demand	Anodyne	ROS1	48	49
CC(=O)c1cccc(CN2C(=O)N[C@](C)(CCc3ccc4c(c3)OCO4)C2=O)c1	ZINC000450821807	GG	On-Demand	Anodyne	SCN9A	26	42
CC(=O)c1cccc(CN2C(=O)N[C@@](C)(CCc3ccc4c(c3)OCO4)C2=O)c1	ZINC000450821808	GG	On-Demand	Anodyne	SCN9A	26	42
CCc1cc(CCCN(CC)Cc2c[nH]c3ccccc23)on1	ZINC000450821812	DI	On-Demand	Anodyne	MPO	16	42
CC(F)(F)CCOc1ccc2c(c1)CCCC2=O	ZINC000450821830	CH	On-Demand	Anodyne	MAOB	15	59
Cc1ccccc1-c1noc(=O)n1CC1CC(F)(F)C1	ZINC000450821855	CF	On-Demand	Anodyne	Q8MHZ5_SHEEP	57	33
COC(=O)COc1ccc(N(C)C(=O)c2c(C3CC3)noc2C)cc1	ZINC000450821856	EF	On-Demand	Anodyne	GPBAR1	30	42
CCn1ccnc1[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450821871	EI	On-Demand	Bother	AADAC	0	50
CCn1ccnc1[C@H](C)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450821872	EI	On-Demand	Bother	AADAC	0	50
COc1cccc(OCCC(=O)N(C)C2CCC(NC(C)=O)CC2)c1	ZINC000450821877	EE	On-Demand	Anodyne	MTNR1A	38	50
Cc1cccc([N+](=O)[O-])c1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821886	EG	On-Demand	Bother	COLA	92	38
Cc1cccc([N+](=O)[O-])c1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821886	EG	On-Demand	Bother	AMP1_PLAFQ	27	42
Cc1cccc([N+](=O)[O-])c1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821886	EG	On-Demand	Bother	ACAT	0	46
C[C@H](Nc1ccc(F)cn1)C(=O)NCCc1ccccc1	ZINC000450821889	CE	On-Demand	Anodyne	AMP1_PLAFQ	32	44
CCCN1CCCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450821896	GD	On-Demand	Anodyne	MTNR1A	51	42
CCCN1CCCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450821896	GD	On-Demand	Anodyne	MTNR1B	42	41
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Cl	ZINC000450821901	GG	On-Demand	Anodyne	ADORA1	0	42
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Cl	ZINC000450821901	GG	On-Demand	Anodyne	CACNA1C	41	39
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Cl	ZINC000450821901	GG	On-Demand	Anodyne	CAPNS1	44	32
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Cl	ZINC000450821901	GG	On-Demand	Anodyne	HLA-DRB1	51	37
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Cl	ZINC000450821901	GG	On-Demand	Anodyne	CAPN1	52	41
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Cl	ZINC000450821901	GG	On-Demand	Anodyne	CAPN2	89	41
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1Cl	ZINC000450821901	GG	On-Demand	Anodyne	NPR	54	38
CC(C)Oc1nccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821903	ED	On-Demand	Anodyne	ANPEP	22	43
CC(C)Oc1nccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450821903	ED	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CCCOc1cccc(CSc2nnc(NC(C)=O)s2)c1	ZINC000450821904	DH	On-Demand	Anodyne	ACACA	39	42
Cc1cn2nc(N[C@@H](C)C(=O)NCCc3ccccc3)sc2n1	ZINC000450821917	ED	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](Nc1nnc(C(F)F)s1)C(=O)NCCc1ccccc1	ZINC000450821920	EE	On-Demand	Anodyne	ANPEP	19	43
C[C@H](Nc1nnc(C(F)F)s1)C(=O)NCCc1ccccc1	ZINC000450821920	EE	On-Demand	Anodyne	AMP1_PLAFQ	30	43
COCCN1CCCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1=O	ZINC000450821923	FD	On-Demand	Anodyne	NOX5	44	33
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C#N	ZINC000450821925	DE	On-Demand	Mild	AMP1_PLAFQ	26	40
CCc1cc(CC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450821929	EE	On-Demand	Anodyne	MTNR1A	35	42
CCc1cc(CC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450821929	EE	On-Demand	Anodyne	MTNR1B	49	42
CCc1cc(CC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450821929	EE	On-Demand	Anodyne	CAPN2	46	38
CCc1cc(CC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450821929	EE	On-Demand	Anodyne	ACE2	41	34
CCc1cc(CC)nc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450821929	EE	On-Demand	Anodyne	AMP1_PLAFQ	40	46
COc1ccc(CNC(=O)CCN2CCc3ncsc3C2)c(OC)c1	ZINC000450821935	FE	On-Demand	Anodyne	HTR7	27	40
C[C@H](Nc1nccn2c(C3CC3)nnc12)C(=O)NCCc1ccccc1	ZINC000450821940	FD	On-Demand	Anodyne	CASP3	41	31
C[C@H](Nc1nccc(CO)n1)C(=O)NCCc1ccccc1	ZINC000450821957	DD	On-Demand	Anodyne	ANPEP	22	43
C[C@H](Nc1nccc(CO)n1)C(=O)NCCc1ccccc1	ZINC000450821957	DD	On-Demand	Anodyne	AMP1_PLAFQ	30	43
CC(=O)CCCCCOc1ccc(C(C)=O)cc1C	ZINC000450821965	CH	On-Demand	Anodyne	GRM2	24	49
CC(=O)CCCCCOc1ccc(C(C)=O)cc1C	ZINC000450821965	CH	On-Demand	Anodyne	PLA2G4B	57	36
COc1ccc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc2c1F	ZINC000450821984	FF	On-Demand	Anodyne	PDE6A	41	31
C[C@H](Nc1ccc([N+](=O)[O-])cc1OC(F)F)C(=O)NCCc1ccccc1	ZINC000450821995	GG	On-Demand	Bother	CCR3	0	40
C[C@H](Nc1ccc([N+](=O)[O-])cc1OC(F)F)C(=O)NCCc1ccccc1	ZINC000450821995	GG	On-Demand	Bother	KCNMA1	18	40
C[C@H](Nc1ccc([N+](=O)[O-])cc1OC(F)F)C(=O)NCCc1ccccc1	ZINC000450821995	GG	On-Demand	Bother	NPR	30	41
Clc1ccc(CCN2CCC([C@@H]3CCCO3)CC2)cc1	ZINC000450822006	CH	On-Demand	Anodyne	SIGMAR1	28	46
Clc1ccc(CCN2CCC([C@@H]3CCCO3)CC2)cc1	ZINC000450822006	CH	On-Demand	Anodyne	L3MBTL3	25	40
Clc1ccc(CCN2CCC([C@H]3CCCO3)CC2)cc1	ZINC000450822007	CH	On-Demand	Anodyne	SIGMAR1	28	46
Clc1ccc(CCN2CCC([C@H]3CCCO3)CC2)cc1	ZINC000450822007	CH	On-Demand	Anodyne	L3MBTL3	25	40
CCOc1cncc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450822015	DE	On-Demand	Anodyne	CAPN2	54	38
CCOc1cncc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450822015	DE	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	THRA	0	45
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	LTA4H	24	40
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	THRB	0	45
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	HRH3	41	41
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	MMP13	51	42
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	ADAM17	49	41
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	MMP2	19	40
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	MMP3	39	42
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	MMP8	16	44
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	PLA2G4B	73	35
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	EPHX2	15	46
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	MMP7	50	42
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	MMP1	48	42
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	F13A1	48	40
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	PSMB2	46	34
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	PSMB1	40	34
CC(=O)CCCCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450822016	FG	On-Demand	Anodyne	NAMPT	26	40
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(F)ccc13)C2	ZINC000450822022	CG	On-Demand	Anodyne	HRP1_PLAFA	98	35
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(F)ccc13)C2	ZINC000450822022	CG	On-Demand	Anodyne	HNMT	46	34
CC(C)c1nnc2c(N[C@@H](C)C(=O)NCCc3ccccc3)nccn12	ZINC000450822029	FD	On-Demand	Anodyne	CASP3	42	33
Cc1ccc2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450822031	EG	On-Demand	Anodyne	SDH1	0	40
Cc1ccc2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450822031	EG	On-Demand	Anodyne	AMP1_PLAFQ	26	40
Cc1ccc2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450822031	EG	On-Demand	Anodyne	CLK4	50	38
Cc1ccc2ncnc(N[C@@H](C)C(=O)NCCc3ccccc3)c2c1	ZINC000450822031	EG	On-Demand	Anodyne	HTT	0	40
CCOC(=O)c1ccc(CSc2cccc(C)c2)nc1	ZINC000450822073	CH	On-Demand	Anodyne	P2RY12	20	41
CCOC(=O)c1ccc(CSc2cccc(C)c2)nc1	ZINC000450822073	CH	On-Demand	Anodyne	ELANE	17	40
O=C([C@H](O)C1CCC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822074	EG	On-Demand	Anodyne	CACNA1B	50	38
O=C([C@@H](O)C1CCC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822075	EG	On-Demand	Anodyne	CACNA1B	50	38
O=C([C@H](O)C1CCC1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822076	EG	On-Demand	Anodyne	CACNA1B	50	38
O=C([C@@H](O)C1CCC1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822077	EG	On-Demand	Anodyne	CACNA1B	50	38
Cc1ccc(Br)cc1Cn1c([N+](=O)[O-])cnc1C	ZINC000450822087	DG	On-Demand	Bother	TYMS	0	40
CC(=O)c1cn(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)nn1	ZINC000450822089	FC	On-Demand	Anodyne	NPFFR1	47	33
CC(=O)c1cn(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)nn1	ZINC000450822090	FC	On-Demand	Anodyne	NPFFR1	47	33
C=CCOc1ccc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450822097	GF	On-Demand	Mild	CCR5	19	40
C=CCOc1ccc(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450822097	GF	On-Demand	Mild	NPFFR1	46	33
C=CCOc1ccc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450822098	GF	On-Demand	Mild	CCR5	19	40
C=CCOc1ccc(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1	ZINC000450822098	GF	On-Demand	Mild	NPFFR1	46	33
CCOC(=O)c1cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)on1	ZINC000450822117	GD	On-Demand	Anodyne	SIGMAR1	17	40
CCOC(=O)c1cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)on1	ZINC000450822117	GD	On-Demand	Anodyne	NPFFR1	53	37
CCOC(=O)c1cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)on1	ZINC000450822118	GD	On-Demand	Anodyne	SIGMAR1	17	40
CCOC(=O)c1cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)on1	ZINC000450822118	GD	On-Demand	Anodyne	NPFFR1	53	37
CC[C@@H]1C[C@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450822127	BE	On-Demand	Anodyne	G2YM83_BOTF4	57	33
C[C@@H](CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])N(C)C	ZINC000450822128	FC	On-Demand	Bother	BDKRB1	0	43
C[C@@H](CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])N(C)C	ZINC000450822128	FC	On-Demand	Bother	BCL2L1	91	33
C[C@@H](CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])N(C)C	ZINC000450822128	FC	On-Demand	Bother	BCL2	56	37
CC(=O)Nc1cccnc1NC(=O)CC1CC(F)(F)C1	ZINC000450822133	CE	On-Demand	Anodyne	BDKRB1	0	40
CC(=O)Nc1cccnc1NC(=O)CC1CC(F)(F)C1	ZINC000450822133	CE	On-Demand	Anodyne	G2YM83_BOTF4	51	32
C[C@@H](O)CCSCc1cccc(Cl)c1	ZINC000450822139	BG	On-Demand	Anodyne	CACNA2D1	26	40
C[C@H](O)CCSCc1cccc(Cl)c1	ZINC000450822140	BG	On-Demand	Anodyne	CACNA2D1	26	40
O=C(NCC1(CCO)CC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450822158	FE	On-Demand	Anodyne	TRPC6	60	32
O=C(NCC1(CCO)CC1)c1csc(Nc2cc(F)cc(F)c2)n1	ZINC000450822158	FE	On-Demand	Anodyne	TRPC3	46	32
CO[C@@H]1CN(c2ncnc3c(C)cccc23)C[C@H]1O	ZINC000450822197	CD	On-Demand	Anodyne	PDE3B	48	31
COC(=O)c1n[nH]c2c1CN(c1ncccc1Cl)CC2	ZINC000450822203	CD	On-Demand	Anodyne	TRPV1	15	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450822206	CE	On-Demand	Anodyne	NOD1	58	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450822207	CE	On-Demand	Anodyne	NOD1	58	36
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450822208	CE	On-Demand	Anodyne	NOD1	58	36
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)CCCC(=O)C(C)(C)C	ZINC000450822209	CE	On-Demand	Anodyne	NOD1	58	36
CC(=O)CCCCCn1cc(C#N)c(=O)c2ccccc21	ZINC000450822214	CG	On-Demand	Mild	CNR1	26	53
CC(=O)CCCCCn1cc(C#N)c(=O)c2ccccc21	ZINC000450822214	CG	On-Demand	Mild	CNR2	23	41
CCn1c(C)nnc1SC[C@H](Cc1ccccc1)OC	ZINC000450822233	CF	On-Demand	Anodyne	SLC27A1	41	34
CCn1c(C)nnc1SC[C@@H](Cc1ccccc1)OC	ZINC000450822234	CF	On-Demand	Anodyne	SLC27A1	41	34
CO[C@@H]1CN(c2nc(-c3ccccc3)ns2)C[C@H]1O	ZINC000450822242	CD	On-Demand	Anodyne	FAAH	17	49
COC(=O)c1n[nH]c2c1CN(c1cc(C)nc(-c3cccnc3)n1)CC2	ZINC000450822247	FD	On-Demand	Anodyne	ROS1	48	36
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(I)cc1F	ZINC000450822248	GF	On-Demand	Anodyne	MAP2K1	46	39
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(I)cc1F	ZINC000450822249	GF	On-Demand	Anodyne	MAP2K1	46	39
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(I)cc1F	ZINC000450822250	GF	On-Demand	Anodyne	MAP2K1	46	39
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(I)cc1F	ZINC000450822251	GF	On-Demand	Anodyne	MAP2K1	46	39
CO[C@@H]1CN(c2nc3ccccc3nc2N2CCC(C)CC2)C[C@H]1O	ZINC000450822273	EE	On-Demand	Anodyne	PDE1B	0	41
CC(C)c1ccc(-c2nnc(S[C@H](C)C(=O)Nc3nccs3)o2)cc1	ZINC000450822294	FI	On-Demand	Anodyne	MAP1	86	35
CC(C)c1ccc(-c2nnc(S[C@H](C)C(=O)Nc3nccs3)o2)cc1	ZINC000450822294	FI	On-Demand	Anodyne	FFAR2	23	47
CC(C)c1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3nccs3)o2)cc1	ZINC000450822295	FI	On-Demand	Anodyne	MAP1	86	35
CC(C)c1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3nccs3)o2)cc1	ZINC000450822295	FI	On-Demand	Anodyne	FFAR2	23	47
COC(=O)[C@H]1CCN(Cc2ccccc2OC2CC2)[C@@H]1C	ZINC000450822325	CF	On-Demand	Anodyne	SLC5A4	51	33
COC(=O)[C@@H]1CCN(Cc2ccccc2OC2CC2)[C@@H]1C	ZINC000450822327	CF	On-Demand	Anodyne	SLC5A4	51	33
COC(=O)[C@@H]1CCN(Cc2ccccc2OC2CC2)[C@H]1C	ZINC000450822329	CF	On-Demand	Anodyne	SLC5A4	51	33
COC(=O)[C@H]1CCN(Cc2ccccc2OC2CC2)[C@H]1C	ZINC000450822331	CF	On-Demand	Anodyne	SLC5A4	51	33
CSc1cccc(C(=O)N2CC[C@H](n3c(C)nc4c3CCCC4)C2)c1	ZINC000450822393	FH	On-Demand	Anodyne	L3MBTL1	0	41
CSc1cccc(C(=O)N2CC[C@H](n3c(C)nc4c3CCCC4)C2)c1	ZINC000450822393	FH	On-Demand	Anodyne	L3MBTL3	46	41
Cc1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450822400	DH	On-Demand	Anodyne	COLA	42	40
Cc1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450822400	DH	On-Demand	Anodyne	CPT1A	34	40
C[C@H](Nc1ncnc(N)c1Cl)C(=O)NCCc1ccccc1	ZINC000450822402	DD	On-Demand	Anodyne	SCNN1A	29	40
C[C@H](Nc1ncnc(N)c1Cl)C(=O)NCCc1ccccc1	ZINC000450822402	DD	On-Demand	Anodyne	ANPEP	46	33
C[C@H](Nc1ncnc(N)c1Cl)C(=O)NCCc1ccccc1	ZINC000450822402	DD	On-Demand	Anodyne	LAP3	43	34
C[C@H](Nc1ncnc(N)c1Cl)C(=O)NCCc1ccccc1	ZINC000450822402	DD	On-Demand	Anodyne	AMP1_PLAFQ	41	42
CSc1cccc(C(=O)N2CC[C@@H](n3c(C)nc4c3CCCC4)C2)c1	ZINC000450822403	FH	On-Demand	Anodyne	L3MBTL1	0	41
CSc1cccc(C(=O)N2CC[C@@H](n3c(C)nc4c3CCCC4)C2)c1	ZINC000450822403	FH	On-Demand	Anodyne	L3MBTL3	46	41
COc1ccccc1Cc1nnc(SCC2(OC)CCC2)o1	ZINC000450822414	DG	On-Demand	Anodyne	PTK2	15	47
COC(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)[C@H]1C	ZINC000450822428	CF	On-Demand	Anodyne	SLC6A1	53	43
COC(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)[C@H]1C	ZINC000450822428	CF	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)[C@H]1C	ZINC000450822431	CF	On-Demand	Anodyne	SLC6A1	53	43
COC(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)[C@H]1C	ZINC000450822431	CF	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)[C@@H]1C	ZINC000450822433	CF	On-Demand	Anodyne	SLC6A1	53	43
COC(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)[C@@H]1C	ZINC000450822433	CF	On-Demand	Anodyne	SLC6A3	26	45
COC(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)[C@@H]1C	ZINC000450822435	CF	On-Demand	Anodyne	SLC6A1	53	43
COC(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)[C@@H]1C	ZINC000450822435	CF	On-Demand	Anodyne	SLC6A3	26	45
CC1(C)CCN(c2ncnc3cc(Cl)ccc23)CC[S@@]1=O	ZINC000450822437	DG	On-Demand	Anodyne	HTT	0	45
C[C@H](N=c1nc(C(C)(C)C)o[nH]1)C(=O)NCCc1ccccc1	ZINC000450822438	DD	On-Demand	Anodyne	AMP1_PLAFQ	34	43
CS(=O)(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450822439	FH	On-Demand	Anodyne	COLA	43	39
CS(=O)(=O)c1cccc(COc2ccc(-c3noc(C4CC4)n3)cc2)c1	ZINC000450822439	FH	On-Demand	Anodyne	GRM5	24	43
CC1(C)CCN(c2ncnc3cc(Cl)ccc23)CC[S@]1=O	ZINC000450822441	DG	On-Demand	Anodyne	HTT	0	45
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA2	44	46
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA1	44	46
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA7	33	46
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA5B	47	46
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA4	36	42
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA5A	48	46
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA14	27	40
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA12	28	45
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	CA9	34	41
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	AMP1_PLAFQ	30	41
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1S(N)(=O)=O	ZINC000450822442	FC	On-Demand	Anodyne	NCE103	25	45
COCCOC[C@@H](O)CN[C@@H](C)c1ccc(Br)cc1OC	ZINC000450822454	FE	On-Demand	Anodyne	ADRB2	25	54
COCCOC[C@H](O)CN[C@H](C)c1ccc(Br)cc1OC	ZINC000450822455	FE	On-Demand	Anodyne	ADRB2	25	54
COCCOC[C@H](O)CN[C@@H](C)c1ccc(Br)cc1OC	ZINC000450822456	FE	On-Demand	Anodyne	ADRB2	25	54
COCCOC[C@@H](O)CN[C@H](C)c1ccc(Br)cc1OC	ZINC000450822458	FE	On-Demand	Anodyne	ADRB2	25	54
C[C@H](Nc1ccc(C(=O)NC2CCCC2)nn1)C(=O)NCCc1ccccc1	ZINC000450822465	GD	On-Demand	Anodyne	ACE	42	38
C[C@H](Nc1ccc(C(=O)NC2CCCC2)nn1)C(=O)NCCc1ccccc1	ZINC000450822465	GD	On-Demand	Anodyne	CNR2	21	40
C[C@H](Nc1ccc(C(=O)NC2CCCC2)nn1)C(=O)NCCc1ccccc1	ZINC000450822465	GD	On-Demand	Anodyne	XIAP	27	41
C[C@H](Nc1ccc(C(=O)NC2CCCC2)nn1)C(=O)NCCc1ccccc1	ZINC000450822465	GD	On-Demand	Anodyne	BIRC2	53	38
CCS(=O)(=O)c1ccc(COc2ccc(C(C)=O)cc2C)cc1	ZINC000450822476	EH	On-Demand	Anodyne	ADAMTS4	30	42
CCS(=O)(=O)c1ccc(COc2ccc(C(C)=O)cc2C)cc1	ZINC000450822476	EH	On-Demand	Anodyne	RORC	48	33
CCS(=O)(=O)c1ccc(COc2ccc(C(C)=O)cc2C)cc1	ZINC000450822476	EH	On-Demand	Anodyne	KLK_PIG	43	35
CC[C@H]1CN(CC)CCN1c1ccnc(Cc2ccccc2)n1	ZINC000450822482	DF	On-Demand	Anodyne	SGPL1	0	40
CC[C@@H]1CN(CC)CCN1c1ccnc(Cc2ccccc2)n1	ZINC000450822486	DF	On-Demand	Anodyne	SGPL1	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](n2c(C)nc3c2CCCC3)C1	ZINC000450822489	GI	On-Demand	Anodyne	L3MBTL3	46	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](n2c(C)nc3c2CCCC3)C1	ZINC000450822499	GI	On-Demand	Anodyne	L3MBTL3	46	38
CCOC(=O)[C@@H](C)N(Cc1ccccc1OC1CC1)C1CC1	ZINC000450822500	DG	On-Demand	Anodyne	SLC6A2	15	41
CCOC(=O)[C@H](C)N(Cc1ccccc1OC1CC1)C1CC1	ZINC000450822505	DG	On-Demand	Anodyne	SLC6A2	15	41
CC1CCN(C(=O)c2ccc(=NCCC3(CO)CC3)[nH]c2)CC1	ZINC000450822508	DD	On-Demand	Anodyne	L3MBTL3	52	35
CN1[C@H]2CC[C@H]1CC(N=c1[nH]c3ccc(F)cc3n1C)C2	ZINC000450822512	CE	On-Demand	Anodyne	CHRM1	15	42
CN1[C@H]2CC[C@H]1CC(N=c1[nH]c3ccc(F)cc3n1C)C2	ZINC000450822512	CE	On-Demand	Anodyne	SLC6A3	17	42
CC(=O)c1ccc(CSc2nnc(-c3c(C)cc(C)cc3C)o2)cc1	ZINC000450822519	FK	On-Demand	Anodyne	GSK3B	17	47
CC(=O)c1ccc(CSc2nnc(-c3c(C)cc(C)cc3C)o2)cc1	ZINC000450822519	FK	On-Demand	Anodyne	GSK3A	54	47
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCCC1(CO)CC1	ZINC000450822525	GF	On-Demand	Bother	BCL2L1	49	43
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCCC1(CO)CC1	ZINC000450822525	GF	On-Demand	Bother	BCL2	41	43
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCCC1(CO)CC1	ZINC000450822525	GF	On-Demand	Bother	MCL1	0	46
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCCC1(CO)CC1	ZINC000450822525	GF	On-Demand	Bother	LIMK2	42	33
C[C@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)NCCc1ccccc1	ZINC000450822526	DD	On-Demand	Bother	CCR3	0	41
C[C@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)NCCc1ccccc1	ZINC000450822526	DD	On-Demand	Bother	NPR	37	42
C[C@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)NCCc1ccccc1	ZINC000450822526	DD	On-Demand	Bother	AMP1_PLAFQ	31	43
C[C@H](Nc1cc(N2CCOCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450822540	FD	On-Demand	Anodyne	ADK	29	44
C[C@H](Nc1cc(N2CCOCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450822540	FD	On-Demand	Anodyne	PIK3CB	48	38
C[C@H](Nc1nc2ccccc2n1C)C(=O)NCCc1ccccc1	ZINC000450822541	DE	On-Demand	Anodyne	MTNR1B	38	42
C[C@H](Nc1nc2ccccc2n1C)C(=O)NCCc1ccccc1	ZINC000450822541	DE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
COc1cc(Cn2c(C)csc2=O)ccc1Cl	ZINC000450822543	CF	On-Demand	Anodyne	RGS4	0	41
Cc1cc(C#N)cc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450822566	DE	On-Demand	Mild	SDH1	0	42
Cc1cc(C#N)cc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450822566	DE	On-Demand	Mild	AMP1_PLAFQ	27	41
C[C@H](Nc1nc(C(N)=O)cs1)C(=O)NCCc1ccccc1	ZINC000450822567	DC	On-Demand	Anodyne	CAPN2	52	37
C[C@H](Nc1nc(C(N)=O)cs1)C(=O)NCCc1ccccc1	ZINC000450822567	DC	On-Demand	Anodyne	AMP1_PLAFQ	30	42
CN1[C@H]2CC[C@H]1CC(Nc1ncnc3sc4c(c13)CCCC4)C2	ZINC000450822575	EH	On-Demand	Anodyne	IRAK4	18	61
C[C@H](Nc1ncc(Cl)cc1F)C(=O)NCCc1ccccc1	ZINC000450822581	DG	On-Demand	Anodyne	METAP1	40	37
C[C@H](Nc1ncc(Cl)cc1F)C(=O)NCCc1ccccc1	ZINC000450822581	DG	On-Demand	Anodyne	BRS3	23	40
C[C@H](Nc1ncc(Cl)cc1F)C(=O)NCCc1ccccc1	ZINC000450822581	DG	On-Demand	Anodyne	AMP1_PLAFQ	38	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](CO)C1	ZINC000450822582	BD	On-Demand	Anodyne	SLC6A1	0	40
C[C@@H](c1ccccc1)[C@H](O)CN1CC[C@@H](CO)C1	ZINC000450822587	BD	On-Demand	Anodyne	SLC6A1	0	40
C[C@H](Nc1ncc(C(F)(F)F)s1)C(=O)NCCc1ccccc1	ZINC000450822591	EG	On-Demand	Anodyne	AMP1_PLAFQ	26	41
C[C@H](Nc1ncc(C(F)(F)F)s1)C(=O)NCCc1ccccc1	ZINC000450822591	EG	On-Demand	Anodyne	CARM1	43	36
C[C@H](Nc1ncc(C(F)(F)F)s1)C(=O)NCCc1ccccc1	ZINC000450822591	EG	On-Demand	Anodyne	PDS	27	40
C[C@H](Nc1cncc(C(=O)N(C)C)n1)C(=O)NCCc1ccccc1	ZINC000450822593	ED	On-Demand	Anodyne	AMP1_PLAFQ	26	41
COC(=O)c1cnc(N2CC(c3cccc(Cl)c3)C2)nc1	ZINC000450822604	DF	On-Demand	Anodyne	SLC6A7	0	42
C[C@H](Nc1cc(Br)ccn1)C(=O)NCCc1ccccc1	ZINC000450822606	EG	On-Demand	Anodyne	AMP1_PLAFQ	37	46
C[C@H](Nc1cc(Br)ccn1)C(=O)NCCc1ccccc1	ZINC000450822606	EG	On-Demand	Anodyne	KDM4E	22	47
CCn1cnc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc21	ZINC000450822609	EE	On-Demand	Anodyne	ADORA1	30	47
CCn1cnc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc21	ZINC000450822609	EE	On-Demand	Anodyne	ADORA3	43	40
CC(C)NC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450822616	GF	On-Demand	Bother	COLA	64	34
CC(C)NC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450822616	GF	On-Demand	Bother	BCL2L1	50	32
CC(C)NC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450822616	GF	On-Demand	Bother	TAAR1	20	47
CO[C@H](COc1ccc(C(C)=O)cc1F)Cc1ccccc1	ZINC000450822617	DH	On-Demand	Anodyne	PDS	63	34
CO[C@@H](COc1ccc(C(C)=O)cc1F)Cc1ccccc1	ZINC000450822618	DH	On-Demand	Anodyne	PDS	63	34
Cc1cc(N2CC(c3ccc(Cl)cc3)C2)n2ncnc2n1	ZINC000450822634	CF	On-Demand	Anodyne	DHOD	0	50
Cc1ccc(C(=O)NCC[C@H]2CCOC2)cc1C(=O)NCC[C@@H]1CCOC1	ZINC000450822637	FE	On-Demand	Anodyne	MAPK14	18	51
Cc1ccc(C(=O)NCC[C@@H]2CCOC2)cc1C(=O)NCC[C@@H]1CCOC1	ZINC000450822643	FE	On-Demand	Anodyne	MAPK14	18	51
Cc1ccc(C(=O)NCC[C@H]2CCOC2)cc1C(=O)NCC[C@H]1CCOC1	ZINC000450822644	FE	On-Demand	Anodyne	MAPK14	18	51
Cc1ccc(C(=O)NCC[C@@H]2CCOC2)cc1C(=O)NCC[C@H]1CCOC1	ZINC000450822645	FE	On-Demand	Anodyne	MAPK14	18	51
CCOC(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)nc1	ZINC000450822647	DF	On-Demand	Anodyne	SSTR5	43	35
CCOC(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)nc1	ZINC000450822648	DF	On-Demand	Anodyne	SSTR5	43	35
CCOC(=O)c1c[nH]ccc1=N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450822655	ED	On-Demand	Anodyne	CAPN2	63	38
CCOC(=O)c1c[nH]ccc1=N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450822655	ED	On-Demand	Anodyne	AMP1_PLAFQ	29	41
O=C(c1c[nH]c2nccc-2c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822667	FI	On-Demand	Anodyne	HSD11B1	0	42
O=C(c1c[nH]c2nccc-2c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822667	FI	On-Demand	Anodyne	CACNA1B	40	33
O=C(c1c[nH]c2nccc-2c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822667	FI	On-Demand	Anodyne	CCR2	56	38
O=C(c1c[nH]c2nccc-2c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822667	FI	On-Demand	Anodyne	RBP4	21	44
O=C(c1c[nH]c2nccc-2c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822667	FI	On-Demand	Anodyne	MAP3K12	44	44
O=C(c1c[nH]c2nccc-2c1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822667	FI	On-Demand	Anodyne	SLC6A7	0	41
O=C(c1c[nH]c2nccc-2c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822668	FI	On-Demand	Anodyne	HSD11B1	0	42
O=C(c1c[nH]c2nccc-2c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822668	FI	On-Demand	Anodyne	CACNA1B	40	33
O=C(c1c[nH]c2nccc-2c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822668	FI	On-Demand	Anodyne	CCR2	56	38
O=C(c1c[nH]c2nccc-2c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822668	FI	On-Demand	Anodyne	RBP4	21	44
O=C(c1c[nH]c2nccc-2c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822668	FI	On-Demand	Anodyne	MAP3K12	44	44
O=C(c1c[nH]c2nccc-2c1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450822668	FI	On-Demand	Anodyne	SLC6A7	0	41
CCOC(=O)c1nc(=NC2C[C@@H]3CC[C@H](C2)N3C)cc(C(C)(C)C)[nH]1	ZINC000450822670	EE	On-Demand	Anodyne	GLRA1	44	38
CS(=O)(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)c(F)c1	ZINC000450822676	EG	On-Demand	Anodyne	PTGS2	40	40
CS(=O)(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)c(F)c1	ZINC000450822676	EG	On-Demand	Anodyne	SLC6A9	23	45
CS(=O)(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)c(F)c1	ZINC000450822676	EG	On-Demand	Anodyne	GPR119	22	41
COc1cccc(Cc2nnc(SCC3=CCCCC3)o2)c1	ZINC000450822686	DI	On-Demand	Anodyne	PTK2	0	50
COc1cccc(Cc2nnc(SCC3=CCCCC3)o2)c1	ZINC000450822686	DI	On-Demand	Anodyne	CPB	0	46
COC(=O)c1n[nH]c2c1CN(c1ncnc3cc(Br)ccc13)CC2	ZINC000450822689	GE	On-Demand	Anodyne	PDGFRB	55	44
CO[C@@H]1CN(c2ccc(C(=O)NC3CCCC3)nn2)C[C@H]1O	ZINC000450822706	DC	On-Demand	Anodyne	SCD1	33	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450822719	FH	On-Demand	Anodyne	CACNA1C	15	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450822719	FH	On-Demand	Anodyne	RBP4	60	44
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450822720	FH	On-Demand	Anodyne	CACNA1C	15	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450822720	FH	On-Demand	Anodyne	RBP4	60	44
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450822721	FH	On-Demand	Anodyne	CACNA1C	15	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450822721	FH	On-Demand	Anodyne	RBP4	60	44
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450822727	GE	On-Demand	Anodyne	NPFFR1	46	33
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450822728	GE	On-Demand	Anodyne	NPFFR1	46	33
CO[C@@H]1CN(c2cnn(-c3ccc(Cl)cc3)c(=O)c2Cl)C[C@H]1O	ZINC000450822766	FD	On-Demand	Anodyne	NPBWR1	42	35
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)C1(C(F)(F)F)CCC1	ZINC000450822786	FF	On-Demand	Anodyne	NPFFR1	53	37
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)C1(C(F)(F)F)CCC1	ZINC000450822788	FF	On-Demand	Anodyne	NPFFR1	53	37
COc1cc(CN2CCn3c(nn(CC(=O)N(C)C)c3=O)C2)ccc1Cl	ZINC000450822798	GC	On-Demand	Anodyne	AVPR1B	40	32
COCCOC[C@@H](O)CN1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450822801	EE	On-Demand	Anodyne	HSP90AB1	34	41
COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCC(=O)c1ccccc1	ZINC000450822806	DF	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCCC(=O)c1ccccc1	ZINC000450822807	DF	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCCC(=O)c1ccccc1	ZINC000450822808	DF	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCCC(=O)c1ccccc1	ZINC000450822809	DF	On-Demand	Anodyne	CYP2J2	51	36
COCCOC[C@H](O)CN1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450822810	EE	On-Demand	Anodyne	HSP90AB1	34	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccc2c1CCCC2	ZINC000450822816	GG	On-Demand	Anodyne	FABP4	53	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccc2c1CCCC2	ZINC000450822816	GG	On-Demand	Anodyne	SIGMAR1	29	40
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccc2c1CCCC2	ZINC000450822816	GG	On-Demand	Anodyne	NPFFR1	53	36
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccc2c1CCCC2	ZINC000450822817	GG	On-Demand	Anodyne	FABP4	53	41
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccc2c1CCCC2	ZINC000450822817	GG	On-Demand	Anodyne	SIGMAR1	29	40
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccc2c1CCCC2	ZINC000450822817	GG	On-Demand	Anodyne	NPFFR1	53	36
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450822818	GH	On-Demand	Anodyne	NPFFR1	43	32
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CC1(F)F	ZINC000450822819	DD	On-Demand	Anodyne	NPFFR1	48	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CC1(F)F	ZINC000450822820	DD	On-Demand	Anodyne	NPFFR1	48	34
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CC1(F)F	ZINC000450822821	DD	On-Demand	Anodyne	NPFFR1	48	34
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CC1(F)F	ZINC000450822822	DD	On-Demand	Anodyne	NPFFR1	48	34
O=C(NCC1(CCO)CC1)c1ccc(I)cc1F	ZINC000450822826	FE	On-Demand	Anodyne	SLC6A9	44	33
O=C(NCC1(CCO)CC1)c1ccc(I)cc1F	ZINC000450822826	FE	On-Demand	Anodyne	MAP2K1	55	35
CCS(=O)(=O)c1ccc(CN[C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450822830	EH	On-Demand	Anodyne	GRIA4	21	51
CCS(=O)(=O)c1ccc(CN[C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450822832	EH	On-Demand	Anodyne	GRIA4	21	51
CCS(=O)(=O)c1ccc(CN[C@@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000450822834	EH	On-Demand	Anodyne	GRIA4	21	51
CCS(=O)(=O)c1ccc(CN[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000450822836	EH	On-Demand	Anodyne	GRIA4	21	51
Cc1ccnc(-c2noc(CSc3nnc(N)n3C(C)C)n2)c1	ZINC000450822891	EE	On-Demand	Anodyne	TNKS2	17	44
CC1(C)CCN(c2ncc(C(N)=O)cc2Cl)CC[S@@]1=O	ZINC000450822894	DD	On-Demand	Anodyne	P2RY12	28	42
CC1(C)CCN(c2ncc(C(N)=O)cc2Cl)CC[S@@]1=O	ZINC000450822894	DD	On-Demand	Anodyne	CXCR3	29	43
CC1(C)CCN(c2ncc(C(N)=O)cc2Cl)CC[S@]1=O	ZINC000450822896	DD	On-Demand	Anodyne	P2RY12	28	42
CC1(C)CCN(c2ncc(C(N)=O)cc2Cl)CC[S@]1=O	ZINC000450822896	DD	On-Demand	Anodyne	CXCR3	29	43
CN(CCN1CC(=O)N(C)[C@@H]1c1ccccc1)Cc1ccccc1	ZINC000450822914	DF	On-Demand	Anodyne	HSD17B2	43	38
CN(CCN1CC(=O)N(C)[C@H]1c1ccccc1)Cc1ccccc1	ZINC000450822916	DF	On-Demand	Anodyne	HSD17B2	43	38
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450822924	FE	On-Demand	Mild	TRPV1	23	46
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450822924	FE	On-Demand	Mild	SLC9A1	16	40
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450822924	FE	On-Demand	Mild	NCE103	20	41
CC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450822963	FF	On-Demand	Bother	AMP1_PLAFQ	26	40
C[C@H](Nc1ncccc1Br)C(=O)NCCc1ccccc1	ZINC000450822972	EG	On-Demand	Anodyne	AMP1_PLAFQ	40	47
COc1cc(CN2CC(=O)N(C)[C@H]2c2ccccc2)ccc1Cl	ZINC000450822984	EG	On-Demand	Anodyne	HCRTR1	31	40
COc1cc(CN2CC(=O)N(C)[C@@H]2c2ccccc2)ccc1Cl	ZINC000450822987	EG	On-Demand	Anodyne	HCRTR1	31	40
C[C@H](Nc1nccc(C(C)(C)C)n1)C(=O)NCCc1ccccc1	ZINC000450823001	EF	On-Demand	Anodyne	AMP1_PLAFQ	27	42
Cc1ccc(NC(=O)c2c(C)cccc2Cl)cc1-c1nnnn1C1CC1	ZINC000450823016	FI	On-Demand	Anodyne	JAK1	0	41
Cc1ccc(NC(=O)c2c(C)cccc2Cl)cc1-c1nnnn1C1CC1	ZINC000450823016	FI	On-Demand	Anodyne	TYK2	64	41
C[C@H](Nc1ncccc1S(C)(=O)=O)C(=O)NCCc1ccccc1	ZINC000450823050	ED	On-Demand	Anodyne	AMP1_PLAFQ	30	42
OCC1(CCNc2ncccc2OCc2ccccc2)CC1	ZINC000450823062	CG	On-Demand	Anodyne	PPIA	41	50
C[C@H](CCNC(=O)c1c(Cl)cc(F)cc1Br)N1CCCCC1	ZINC000450823065	GI	On-Demand	Anodyne	CCR5	38	42
C[C@@H](CCNC(=O)c1c(Cl)cc(F)cc1Br)N1CCCCC1	ZINC000450823093	GI	On-Demand	Anodyne	CCR5	38	42
CCOC(=O)c1ccc(CSc2nnc(C)n2CC)nc1	ZINC000450823097	DE	On-Demand	Anodyne	SLC27A1	42	45
COC(=O)c1n[nH]c2c1CN(c1nc(-c3cccnc3)nc(C)c1C)CC2	ZINC000450823119	FE	On-Demand	Anodyne	ROS1	55	32
CO[C@@H]1CN(c2cc(N3C[C@@H](O)[C@H](OC)C3)nc(-c3ccccc3)n2)C[C@H]1O	ZINC000450823122	GC	On-Demand	Anodyne	P2RY12	45	33
COC(=O)[C@H]1C[C@H](O)CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450823131	FC	On-Demand	Anodyne	MTNR1A	42	36
COC(=O)[C@H]1C[C@@H](O)CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450823134	FC	On-Demand	Anodyne	MTNR1A	42	36
COC(=O)[C@@H]1C[C@H](O)CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450823137	FC	On-Demand	Anodyne	MTNR1A	42	36
OCC1(CCNc2ncnc3scc(-c4ccccc4)c23)CC1	ZINC000450823141	EH	On-Demand	Anodyne	ADRB3	26	43
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)nc(C2CC2)n1	ZINC000450823142	DE	On-Demand	Anodyne	OPRM1	15	40
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)nc(C2CC2)n1	ZINC000450823142	DE	On-Demand	Anodyne	AMP1_PLAFQ	30	40
CC(=O)c1ccc(OCCC[C@@H](C)O)c(C)c1	ZINC000450823151	BF	On-Demand	Anodyne	THRA	0	44
CC(=O)c1ccc(OCCC[C@@H](C)O)c(C)c1	ZINC000450823151	BF	On-Demand	Anodyne	GRM2	21	48
CC(=O)c1ccc(OCCC[C@H](C)O)c(C)c1	ZINC000450823155	BF	On-Demand	Anodyne	THRA	0	44
CC(=O)c1ccc(OCCC[C@H](C)O)c(C)c1	ZINC000450823155	BF	On-Demand	Anodyne	GRM2	21	48
COc1cc(Cn2cnc3c(N(C)C)ncnc32)ccc1Cl	ZINC000450823157	DF	On-Demand	Anodyne	SLC29A1	37	41
COc1cccc(OCCC(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)c1	ZINC000450823161	GG	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc(OCCC(=O)Nc2ccc(C)c(-c3nnnn3C3CC3)c2)c1	ZINC000450823161	GG	On-Demand	Anodyne	MTNR1B	21	40
CN1[C@H]2CC[C@H]1CC(Nc1ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c1)C2	ZINC000450823169	FF	On-Demand	Bother	L3MBTL1	0	44
CN1[C@H]2CC[C@H]1CC(Nc1ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c1)C2	ZINC000450823169	FF	On-Demand	Bother	L3MBTL3	51	44
CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1cc2ccccc2c(O)n1	ZINC000450823178	EE	On-Demand	Anodyne	CCR3	15	41
C[C@H](Nc1cc(N2CCCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450823180	GD	On-Demand	Anodyne	ACE	42	40
C[C@H](Nc1cc(N2CCCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450823180	GD	On-Demand	Anodyne	SLC18A2	40	35
C[C@H](Nc1cc(N2CCCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450823180	GD	On-Demand	Anodyne	MME	17	40
C[C@H](Nc1cc(N2CCCC[C@@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450823180	GD	On-Demand	Anodyne	XIAP	21	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)Cc1cc2ccccc2c(O)n1	ZINC000450823181	EE	On-Demand	Anodyne	CCR3	15	41
C[C@H](Nc1cc(N2CCCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450823182	GD	On-Demand	Anodyne	ACE	42	40
C[C@H](Nc1cc(N2CCCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450823182	GD	On-Demand	Anodyne	SLC18A2	40	35
C[C@H](Nc1cc(N2CCCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450823182	GD	On-Demand	Anodyne	MME	17	40
C[C@H](Nc1cc(N2CCCC[C@H]2CO)ncn1)C(=O)NCCc1ccccc1	ZINC000450823182	GD	On-Demand	Anodyne	XIAP	21	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)Cc1cc2ccccc2c(O)n1	ZINC000450823183	EE	On-Demand	Anodyne	CCR3	15	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1cc2ccccc2c(O)n1	ZINC000450823186	EE	On-Demand	Anodyne	CCR3	15	41
C[C@H](Nc1cncc(C(N)=O)n1)C(=O)NCCc1ccccc1	ZINC000450823195	DC	On-Demand	Anodyne	AMP1_PLAFQ	30	42
COc1ccc(-c2noc(N3C[C@@H](O)[C@H](OC)C3)n2)cc1	ZINC000450823196	CC	On-Demand	Anodyne	S1PR1	15	41
COc1ccc(-c2noc(N3C[C@@H](O)[C@H](OC)C3)n2)cc1	ZINC000450823196	CC	On-Demand	Anodyne	LUCI_PHOPE	15	40
COc1cc(CN2CC[C@@H](C)[C@@H](OC)C2)ccc1Cl	ZINC000450823216	CG	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1csc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)n1	ZINC000450823219	GI	On-Demand	Anodyne	GSK3B	0	47
COC(=O)c1csc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)n1	ZINC000450823219	GI	On-Demand	Anodyne	GSK3A	35	46
COc1cc(CN2CC[C@@H](C)[C@H](OC)C2)ccc1Cl	ZINC000450823220	CG	On-Demand	Anodyne	DRD3	0	41
COc1cc(CN2CC[C@H](C)[C@@H](OC)C2)ccc1Cl	ZINC000450823223	CG	On-Demand	Anodyne	DRD3	0	41
COc1cc(CN2CC[C@H](C)[C@H](OC)C2)ccc1Cl	ZINC000450823226	CG	On-Demand	Anodyne	DRD3	0	41
CCOC(=O)c1cc(NC2C[C@@H]3CC[C@H](C2)N3C)ncc1Cl	ZINC000450823228	DF	On-Demand	Anodyne	HTR4	22	42
CCOC(=O)c1cc(NC2C[C@@H]3CC[C@H](C2)N3C)ncc1Cl	ZINC000450823228	DF	On-Demand	Anodyne	GLRA1	44	35
CCCc1nc(C)c(CSc2nnc(Cc3ccccc3OC)o2)o1	ZINC000450823231	FI	On-Demand	Anodyne	PTK2	0	48
CC[C@@H](c1ccccc1)c1nnc(S[C@@H](C)C(=O)Nc2nccs2)o1	ZINC000450823242	FI	On-Demand	Anodyne	MAP	0	41
CC[C@@H](c1ccccc1)c1nnc(S[C@@H](C)C(=O)Nc2nccs2)o1	ZINC000450823242	FI	On-Demand	Anodyne	MAP1	98	41
CC[C@H](c1ccccc1)c1nnc(S[C@H](C)C(=O)Nc2nccs2)o1	ZINC000450823244	FI	On-Demand	Anodyne	MAP	0	41
CC[C@H](c1ccccc1)c1nnc(S[C@H](C)C(=O)Nc2nccs2)o1	ZINC000450823244	FI	On-Demand	Anodyne	MAP1	98	41
CC[C@H](c1ccccc1)c1nnc(S[C@@H](C)C(=O)Nc2nccs2)o1	ZINC000450823246	FI	On-Demand	Anodyne	MAP	0	41
CC[C@H](c1ccccc1)c1nnc(S[C@@H](C)C(=O)Nc2nccs2)o1	ZINC000450823246	FI	On-Demand	Anodyne	MAP1	98	41
CCCN1CCCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450823248	DF	On-Demand	Anodyne	NOX1	61	38
CCCN1CCCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450823248	DF	On-Demand	Anodyne	NOX5	60	38
COc1cccc(Cc2nnc(SCCN(C)Cc3ccccc3)o2)c1	ZINC000450823249	FH	On-Demand	Anodyne	PTK2	0	51
COc1cccc(Cc2nnc(SCCN(C)Cc3ccccc3)o2)c1	ZINC000450823249	FH	On-Demand	Anodyne	CPB	0	47
CC[C@@H](c1ccccc1)c1nnc(S[C@H](C)C(=O)Nc2nccs2)o1	ZINC000450823250	FI	On-Demand	Anodyne	MAP	0	41
CC[C@@H](c1ccccc1)c1nnc(S[C@H](C)C(=O)Nc2nccs2)o1	ZINC000450823250	FI	On-Demand	Anodyne	MAP1	98	41
Cc1nn(C)c(N2CCN(CCc3ccc(Cl)cc3)CC2)c1C#N	ZINC000450823253	EF	On-Demand	Mild	ABCC1	62	37
CNS(=O)(=O)c1ccc(N2C[C@@H](O)[C@H](OC)C2)c(F)c1	ZINC000450823257	DB	On-Demand	Anodyne	SLC6A9	18	42
Cc1ccc2ncnc(N3CC[S@](=O)C(C)(C)CC3)c2c1	ZINC000450823272	DF	On-Demand	Anodyne	PDGFRB	22	45
Cc1ccc2ncnc(N3CC[S@](=O)C(C)(C)CC3)c2c1	ZINC000450823272	DF	On-Demand	Anodyne	HTT	0	41
Cc1ccc2ncnc(N3CC[S@@](=O)C(C)(C)CC3)c2c1	ZINC000450823283	DF	On-Demand	Anodyne	PDGFRB	22	45
Cc1ccc2ncnc(N3CC[S@@](=O)C(C)(C)CC3)c2c1	ZINC000450823283	DF	On-Demand	Anodyne	HTT	0	41
CN1[C@H]2CC[C@H]1CC(Nc1ncc(C(N)=O)cc1Cl)C2	ZINC000450823285	CD	On-Demand	Anodyne	GLRA1	43	38
CCOC(=O)CSc1cncc(N2CC(c3ccc(Cl)cc3)C2)n1	ZINC000450823295	FG	On-Demand	Anodyne	SLC6A1	0	44
COc1cc(OC)nc(N2CC(c3cccc(Cl)c3)C2)n1	ZINC000450823301	DF	On-Demand	Anodyne	ALS	68	35
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450823322	CG	On-Demand	Anodyne	CYP2J2	60	43
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450823323	CG	On-Demand	Anodyne	CYP2J2	60	43
C[C@H]1[C@@H](C)O[C@H](C)CN1CCCC(=O)c1ccccc1	ZINC000450823324	CG	On-Demand	Anodyne	CYP2J2	60	43
C[C@@H]1CN(CCCC(=O)c2ccccc2)[C@H](C)[C@@H](C)O1	ZINC000450823326	CG	On-Demand	Anodyne	CYP2J2	60	43
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	CA2	26	42
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	NQO2	15	45
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	CA1	26	42
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	CA7	16	42
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	TRPV1	92	40
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	CA5B	34	42
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	CA4	26	42
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	CA5A	34	42
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	CA9	19	42
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c(F)c1	ZINC000450823329	GD	On-Demand	Anodyne	LEF	51	35
CN(C)c1nc(NC2C[C@@H]3CC[C@H](C2)N3C)nc2ccccc12	ZINC000450823343	DE	On-Demand	Anodyne	ADRA2A	20	53
COC(=O)c1cnc(N2CC(c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1	ZINC000450823374	EG	On-Demand	Bother	CACNA1D	52	33
C=CC(C)(C)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450823388	DE	On-Demand	Mild	NPFFR1	48	34
C=CC(C)(C)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450823389	DE	On-Demand	Mild	NPFFR1	48	34
CC1CCN(C(=O)c2ccc(N3CC(c4cccc(Cl)c4)C3)nc2)CC1	ZINC000450823408	FI	On-Demand	Anodyne	GRM5	18	46
CC1CCN(C(=O)c2ccc(N3CC(c4cccc(Cl)c4)C3)nc2)CC1	ZINC000450823408	FI	On-Demand	Anodyne	SLC6A7	0	40
Cc1sccc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450823414	EF	On-Demand	Anodyne	NPFFR1	53	37
Cc1sccc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450823415	EF	On-Demand	Anodyne	NPFFR1	53	37
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccnc(OC(F)F)c1	ZINC000450823416	GE	On-Demand	Anodyne	NPFFR1	40	32
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1ccnc(OC(F)F)c1	ZINC000450823417	GE	On-Demand	Anodyne	NPFFR1	40	32
COc1cccc(Oc2ccc(C(=O)NCC3(CCO)CC3)nc2)c1	ZINC000450823426	EF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(Oc2ccc(C(=O)NCC3(CCO)CC3)nc2)c1	ZINC000450823426	EF	On-Demand	Anodyne	MTNR1A	37	42
COc1cccc(Oc2ccc(C(=O)NCC3(CCO)CC3)nc2)c1	ZINC000450823426	EF	On-Demand	Anodyne	MTNR1B	36	42
Cc1cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)ncc1C(N)=O	ZINC000450823445	GD	On-Demand	Anodyne	NPFFR1	54	36
Cc1cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)ncc1C(N)=O	ZINC000450823446	GD	On-Demand	Anodyne	NPFFR1	54	36
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CC[C@@H]1CCC(=O)N1	ZINC000450823450	FD	On-Demand	Anodyne	SIGMAR1	41	35
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CC[C@@H]1CCC(=O)N1	ZINC000450823451	FD	On-Demand	Anodyne	SIGMAR1	41	35
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CC[C@H]1CCC(=O)N1	ZINC000450823452	FD	On-Demand	Anodyne	SIGMAR1	41	35
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CC[C@H]1CCC(=O)N1	ZINC000450823453	FD	On-Demand	Anodyne	SIGMAR1	41	35
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CC1CC(F)(F)C1	ZINC000450823454	FF	On-Demand	Anodyne	TACR3	41	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CC1CC(F)(F)C1	ZINC000450823454	FF	On-Demand	Anodyne	NPFFR1	46	33
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CC1CC(F)(F)C1	ZINC000450823455	FF	On-Demand	Anodyne	TACR3	41	34
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CC1CC(F)(F)C1	ZINC000450823455	FF	On-Demand	Anodyne	NPFFR1	46	33
CCS(=O)(=O)c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1	ZINC000450823476	DE	On-Demand	Anodyne	LOC100281352	0	43
CCS(=O)(=O)c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1	ZINC000450823476	DE	On-Demand	Anodyne	ZM.86993	0	43
CCS(=O)(=O)c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1	ZINC000450823477	DE	On-Demand	Anodyne	LOC100281352	0	43
CCS(=O)(=O)c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1	ZINC000450823477	DE	On-Demand	Anodyne	ZM.86993	0	43
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CC12CCSCC2	ZINC000450823479	FF	On-Demand	Anodyne	NPFFR1	46	34
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CC12CCSCC2	ZINC000450823480	FF	On-Demand	Anodyne	NPFFR1	46	34
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CC12CCSCC2	ZINC000450823481	FF	On-Demand	Anodyne	NPFFR1	46	34
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@H]1CC12CCSCC2	ZINC000450823482	FF	On-Demand	Anodyne	NPFFR1	46	34
CO[C@@H]1CN(c2ccnc(C(C)C)n2)C[C@H]1O	ZINC000450823502	BC	On-Demand	Anodyne	SORD	68	40
CO[C@@H]1CN(c2cnn(Cc3ccccc3)c(=O)c2)C[C@H]1O	ZINC000450823506	DC	On-Demand	Anodyne	NPBWR1	45	41
CC(=O)c1ccc(CN2C(=O)N[C@](C)(CCc3ccc4c(c3)OCO4)C2=O)cc1	ZINC000450823512	GG	On-Demand	Anodyne	SCN9A	26	40
CC(=O)c1ccc(CN2C(=O)N[C@@](C)(CCc3ccc4c(c3)OCO4)C2=O)cc1	ZINC000450823513	GG	On-Demand	Anodyne	SCN9A	26	40
COC(=O)c1n[nH]c2c1CN(c1ncnc3sc4c(c13)CCC4)CC2	ZINC000450823530	FE	On-Demand	Anodyne	RBP4	18	43
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450823532	FG	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450823533	FG	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450823534	FG	On-Demand	Anodyne	GPR88	0	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823541	EE	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823541	EE	On-Demand	Anodyne	HLA-DRB1	52	35
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823541	EE	On-Demand	Anodyne	CAPN1	40	36
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823541	EE	On-Demand	Anodyne	CAPN2	64	36
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823542	EE	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823542	EE	On-Demand	Anodyne	HLA-DRB1	52	35
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823542	EE	On-Demand	Anodyne	CAPN1	40	36
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823542	EE	On-Demand	Anodyne	CAPN2	64	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823543	EE	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823543	EE	On-Demand	Anodyne	HLA-DRB1	52	35
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823543	EE	On-Demand	Anodyne	CAPN1	40	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823543	EE	On-Demand	Anodyne	CAPN2	64	36
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823544	EE	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823544	EE	On-Demand	Anodyne	HLA-DRB1	52	35
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823544	EE	On-Demand	Anodyne	CAPN1	40	36
CCOC(=O)[C@H](C)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450823544	EE	On-Demand	Anodyne	CAPN2	64	36
CO[C@@H]1CN(c2ccnc(-c3ccccc3)n2)C[C@H]1O	ZINC000450823545	CD	On-Demand	Anodyne	SORD	51	42
COC(=O)C1(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCCC1	ZINC000450823576	GF	On-Demand	Anodyne	ACAT	0	45
COC(=O)C1(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCCC1	ZINC000450823576	GF	On-Demand	Anodyne	NPFFR1	41	36
COCc1cc([N+](=O)[O-])ccc1NCCC1(CO)CC1	ZINC000450823590	CE	On-Demand	Bother	CACNA1D	60	32
C[C@H](Nc1nccc(C(F)F)n1)C(=O)NCCc1ccccc1	ZINC000450823594	DF	On-Demand	Anodyne	AMP1_PLAFQ	30	43
COc1cc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc2cc1F	ZINC000450823603	FF	On-Demand	Anodyne	EGFR	58	45
COc1cc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc2cc1F	ZINC000450823603	FF	On-Demand	Anodyne	ERBB2	29	45
COc1cc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc2cc1F	ZINC000450823603	FF	On-Demand	Anodyne	AURKA	41	36
COc1cc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc2cc1F	ZINC000450823603	FF	On-Demand	Anodyne	EPHA2	43	33
COc1cc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc2cc1F	ZINC000450823603	FF	On-Demand	Anodyne	GLMU	0	42
O=C(NC1CC1)c1cc(NCCC2(CO)CC2)nc2ccccc12	ZINC000450823604	EE	On-Demand	Anodyne	METG	46	33
O=C(NC1CC1)c1cc(NCCC2(CO)CC2)nc2ccccc12	ZINC000450823604	EE	On-Demand	Anodyne	TNKS	57	31
C[C@H](Nc1ccccn1)C(=O)NCCc1ccccc1	ZINC000450823612	CE	On-Demand	Anodyne	SDH1	0	40
C[C@H](Nc1ccccn1)C(=O)NCCc1ccccc1	ZINC000450823612	CE	On-Demand	Anodyne	MTNR1B	32	41
C[C@H](Nc1ccccn1)C(=O)NCCc1ccccc1	ZINC000450823612	CE	On-Demand	Anodyne	CES1	44	34
C[C@H](Nc1ccccn1)C(=O)NCCc1ccccc1	ZINC000450823612	CE	On-Demand	Anodyne	AMP1_PLAFQ	44	48
Cc1n[nH]c(=N[C@@H](C)C(=O)NCCc2ccccc2)s1	ZINC000450823613	CD	On-Demand	Anodyne	AMP1_PLAFQ	30	43
COc1nccc(COc2ccc(-c3noc([C@@H]4CCCO4)n3)cc2)n1	ZINC000450823620	FF	On-Demand	Anodyne	COLA	22	40
COc1nccc(COc2ccc(-c3noc([C@H]4CCCO4)n3)cc2)n1	ZINC000450823621	FF	On-Demand	Anodyne	COLA	22	40
C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)C(=O)NCCc1ccccc1	ZINC000450823622	FG	On-Demand	Mild	CARM1	42	35
Cc1c[nH]ccc1=N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450823644	CD	On-Demand	Anodyne	AMP1_PLAFQ	31	43
COc1ncc(Cl)c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450823647	ED	On-Demand	Anodyne	DYRK1A	15	40
COc1ncc(Cl)c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450823647	ED	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CC(=O)Nc1nnc(SCCC(C)(F)F)s1	ZINC000450823652	CF	On-Demand	Anodyne	CAHX_FLABI	0	43
CC(=O)c1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)cc1	ZINC000450823674	EI	On-Demand	Anodyne	CPT1A	40	43
CC(=O)c1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)cc1	ZINC000450823674	EI	On-Demand	Anodyne	GRM5	15	41
CC(=O)c1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)cc1	ZINC000450823674	EI	On-Demand	Anodyne	S1PR1	16	42
CC(=O)c1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)cc1	ZINC000450823674	EI	On-Demand	Anodyne	SPHK1	19	43
CC(=O)c1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)cc1	ZINC000450823674	EI	On-Demand	Anodyne	S1PR5	36	42
CC(=O)c1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)cc1	ZINC000450823674	EI	On-Demand	Anodyne	NS5B	0	42
CC(=O)c1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)cc1	ZINC000450823674	EI	On-Demand	Anodyne	ETHR	51	39
CC(=O)c1ccc(S(C)(=O)=O)c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450823675	GE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CN(C)c1ncnc2c1ncn2CCc1ccc(Cl)cc1	ZINC000450823680	DF	On-Demand	Anodyne	SLC29A1	26	41
CNC(=O)c1cc([N+](=O)[O-])ccc1NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000450823685	DD	On-Demand	Bother	GLRA1	40	31
C[C@H](Nc1c(C#N)c(=O)n(C)c(=O)n1C)C(=O)NCCc1ccccc1	ZINC000450823695	FC	On-Demand	Mild	AMP1_PLAFQ	23	42
CC(C)c1nnc(N[C@@H](C)C(=O)NCCc2ccccc2)s1	ZINC000450823703	DE	On-Demand	Anodyne	AMP1_PLAFQ	35	45
C[C@H](Nc1ccnc(C(F)(F)F)c1)C(=O)NCCc1ccccc1	ZINC000450823721	EG	On-Demand	Anodyne	AMP1_PLAFQ	31	42
C[C@H](Nc1ccnc(C(F)(F)F)c1)C(=O)NCCc1ccccc1	ZINC000450823721	EG	On-Demand	Anodyne	CARM1	81	38
C[C@H](Nc1ccnc(C(F)(F)F)c1)C(=O)NCCc1ccccc1	ZINC000450823721	EG	On-Demand	Anodyne	KDM4E	22	45
C[C@H](Nc1ccnc(C(F)(F)F)c1)C(=O)NCCc1ccccc1	ZINC000450823721	EG	On-Demand	Anodyne	PDS	28	40
COc1cc([N+](=O)[O-])ccc1OCC[C@@H]1CCOC1	ZINC000450823726	CE	On-Demand	Bother	KCNMA1	19	40
COc1cc([N+](=O)[O-])ccc1OCC[C@H]1CCOC1	ZINC000450823735	CE	On-Demand	Bother	KCNMA1	19	40
FC(F)(F)Cn1ccc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450823741	FH	On-Demand	Anodyne	ETHR	40	41
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	DRD4	29	43
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	ACHE	22	48
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	LTA4H	18	41
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	SIGMAR1	32	43
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	SSTR5	45	36
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	CCR3	25	40
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	SLC6A5	30	41
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	MCHR1	39	40
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	CACNA1G	30	40
CC(=O)c1ccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)cc1	ZINC000450823742	GD	On-Demand	Anodyne	SFRP1	58	36
CC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)c(C)c1	ZINC000450823743	CI	On-Demand	Anodyne	RAF1	15	41
CC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)c(C)c1	ZINC000450823743	CI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
CN(CCN1CCc2ncsc2C1)Cc1ccccc1	ZINC000450823744	CF	On-Demand	Anodyne	SIGMAR1	23	48
CN1[C@H]2CC[C@H]1CC(Nc1cc(N3CCCCC3)ncn1)C2	ZINC000450823745	DF	On-Demand	Anodyne	HRH4	16	51
COc1nccc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450823748	DF	On-Demand	Anodyne	COLA	24	41
C[C@H](c1ccc(CSc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450823750	FK	On-Demand	Anodyne	PTGS2	43	46
C[C@H](c1ccc(CSc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450823750	FK	On-Demand	Anodyne	CTSF	55	38
C[C@@H](c1ccc(CSc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450823751	FK	On-Demand	Anodyne	PTGS2	43	46
C[C@@H](c1ccc(CSc2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F	ZINC000450823751	FK	On-Demand	Anodyne	CTSF	55	38
COc1ccc(OCc2oc(C(C)C)nc2C)c(C(N)=O)c1	ZINC000450823756	DF	On-Demand	Anodyne	P2RX3	17	41
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(C(F)(F)F)ccc13)C2	ZINC000450823784	EI	On-Demand	Anodyne	HRP1_PLAFA	76	33
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(C(F)(F)F)ccc13)C2	ZINC000450823784	EI	On-Demand	Anodyne	HNMT	42	33
COc1cc(OC)cc(N(C)C[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000450823791	DG	On-Demand	Anodyne	AOC3	36	43
COc1cc(OC)cc(N(C)C[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450823793	DG	On-Demand	Anodyne	AOC3	36	43
COc1cc(OC)cc(N(C)C[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000450823794	DG	On-Demand	Anodyne	AOC3	36	43
COc1cc(OC)cc(N(C)C[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000450823795	DG	On-Demand	Anodyne	AOC3	36	43
COC(=O)c1cnc(N2CC(c3ccc(Cl)cc3)C2)nc1	ZINC000450823833	DF	On-Demand	Anodyne	SLC6A1	45	39
CO[C@@H]1CN(Cc2ccccc2OC2CC2)CC[C@H]1C	ZINC000450823836	CG	On-Demand	Anodyne	SLC5A4	43	32
Cc1nc2c(n1[C@@H]1CCN(C(=O)c3cccc4c3CCCC4)C1)CCCC2	ZINC000450823837	FI	On-Demand	Anodyne	L3MBTL3	54	36
CO[C@H]1CN(Cc2ccccc2OC2CC2)CC[C@H]1C	ZINC000450823838	CG	On-Demand	Anodyne	SLC5A4	43	32
Cc1nc2c(n1[C@H]1CCN(C(=O)c3cccc4c3CCCC4)C1)CCCC2	ZINC000450823840	FI	On-Demand	Anodyne	L3MBTL3	54	36
CO[C@H]1CN(Cc2ccccc2OC2CC2)CC[C@@H]1C	ZINC000450823841	CG	On-Demand	Anodyne	SLC5A4	43	32
CO[C@@H]1CN(Cc2ccccc2OC2CC2)CC[C@@H]1C	ZINC000450823843	CG	On-Demand	Anodyne	SLC5A4	43	32
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2cccc(C(N)=O)c2)C1=O	ZINC000450823850	GD	On-Demand	Anodyne	F11	41	33
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@](C)(c2cccc(C(N)=O)c2)C1=O	ZINC000450823852	GD	On-Demand	Anodyne	F11	41	33
CO[C@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2cccc(C(N)=O)c2)C1=O	ZINC000450823854	GD	On-Demand	Anodyne	F11	41	33
CO[C@@H](Cc1ccccc1)CN1C(=O)N[C@@](C)(c2cccc(C(N)=O)c2)C1=O	ZINC000450823856	GD	On-Demand	Anodyne	F11	41	33
COC(=O)CC1(NCc2ccc(Cl)c(OC)c2)CCS(=O)(=O)CC1	ZINC000450823877	GD	On-Demand	Anodyne	PDE6A	41	31
CS(=O)(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)c(C(F)(F)F)c1	ZINC000450823888	GI	On-Demand	Anodyne	HSD11B1	20	40
COc1cc(CN2CC[C@](O)(C(N)=O)C2)ccc1Cl	ZINC000450823895	CC	On-Demand	Anodyne	TACR1	22	42
COc1cc(CN2CC[C@](O)(C(N)=O)C2)ccc1Cl	ZINC000450823895	CC	On-Demand	Anodyne	TACR2	25	42
COc1cc(CN2CC[C@](O)(C(N)=O)C2)ccc1Cl	ZINC000450823895	CC	On-Demand	Anodyne	NPFFR1	43	35
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]([C@@H](C)O)C1	ZINC000450823897	DG	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]([C@@H](C)O)C1	ZINC000450823897	DG	On-Demand	Anodyne	CYP2J2	49	35
COc1cc(CN2CC[C@@](O)(C(N)=O)C2)ccc1Cl	ZINC000450823898	CC	On-Demand	Anodyne	TACR1	22	42
COc1cc(CN2CC[C@@](O)(C(N)=O)C2)ccc1Cl	ZINC000450823898	CC	On-Demand	Anodyne	TACR2	25	42
COc1cc(CN2CC[C@@](O)(C(N)=O)C2)ccc1Cl	ZINC000450823898	CC	On-Demand	Anodyne	NPFFR1	43	35
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]([C@@H](C)O)C1	ZINC000450823900	DG	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]([C@@H](C)O)C1	ZINC000450823900	DG	On-Demand	Anodyne	CYP2J2	49	35
C[C@H](O)[C@H]1C[C@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450823902	DG	On-Demand	Anodyne	DRD2	28	40
C[C@H](O)[C@H]1C[C@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450823902	DG	On-Demand	Anodyne	CYP2J2	49	35
C[C@H](O)[C@@H]1C[C@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450823905	DG	On-Demand	Anodyne	DRD2	28	40
C[C@H](O)[C@@H]1C[C@H](C)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450823905	DG	On-Demand	Anodyne	CYP2J2	49	35
CCCOc1ccc(C(=O)N2CCC[C@@H](n3cnc(C(N)=O)n3)C2)c(OC)c1	ZINC000450823908	GD	On-Demand	Anodyne	OXTR	22	40
CCCOc1ccc(C(=O)N2CCC[C@H](n3cnc(C(N)=O)n3)C2)c(OC)c1	ZINC000450823909	GD	On-Demand	Anodyne	OXTR	22	40
CCC(CC)(CCSc1nnc(Cc2cccc(F)c2)o1)C(=O)OC	ZINC000450823959	FI	On-Demand	Anodyne	PTK2	0	43
COc1cc([N+](=O)[O-])ccc1OCCC(C)(F)F	ZINC000450823967	CG	On-Demand	Bother	S1PR4	0	43
CO[C@@H](Cc1ccccc1)CN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450823971	DF	On-Demand	Anodyne	HSD17B2	78	39
CO[C@@H](Cc1ccccc1)CN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450823972	DF	On-Demand	Anodyne	HSD17B2	78	39
CO[C@H](Cc1ccccc1)CN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450823973	DF	On-Demand	Anodyne	HSD17B2	78	39
CO[C@H](Cc1ccccc1)CN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450823974	DF	On-Demand	Anodyne	HSD17B2	78	39
CCC[C@@H]1CCC[C@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450824010	CG	On-Demand	Anodyne	G2YM83_BOTF4	52	33
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450824011	CG	On-Demand	Anodyne	G2YM83_BOTF4	52	33
CCC[C@H]1CCC[C@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450824012	CG	On-Demand	Anodyne	G2YM83_BOTF4	52	33
CCC[C@H]1CCC[C@@H]1C(=O)Nc1ncccc1NC(C)=O	ZINC000450824013	CG	On-Demand	Anodyne	G2YM83_BOTF4	52	33
CC[C@@H]1CCC[C@@H]1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824015	EF	On-Demand	Anodyne	NPFFR1	49	36
CC[C@@H]1CCC[C@H]1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824016	EF	On-Demand	Anodyne	NPFFR1	49	36
CC[C@@H]1CCC[C@H]1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824017	EF	On-Demand	Anodyne	NPFFR1	49	36
CC[C@@H]1CCC[C@@H]1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824018	EF	On-Demand	Anodyne	NPFFR1	49	36
CCOC(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)nc1	ZINC000450824028	DH	On-Demand	Anodyne	P2RY12	33	46
C[C@@H](CNc1ncnc2ccc(I)cc12)N(C)C	ZINC000450824030	FE	On-Demand	Anodyne	EGFR	28	40
C[C@@H](CNc1ncnc2ccc(I)cc12)N(C)C	ZINC000450824030	FE	On-Demand	Anodyne	CLK4	65	35
C[C@@H](CNc1ncnc2ccc(I)cc12)N(C)C	ZINC000450824030	FE	On-Demand	Anodyne	CD38	61	38
CC(=O)c1ccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)cc1	ZINC000450824049	EJ	On-Demand	Anodyne	ACHE	21	42
CC(=O)c1ccc(CN2CCC(c3nc4cccc(C)c4o3)CC2)cc1	ZINC000450824049	EJ	On-Demand	Anodyne	MCHR1	30	43
C[C@@H]1C[C@]1(C#N)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824050	ED	On-Demand	Mild	TACR3	65	36
C[C@@H]1C[C@]1(C#N)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824050	ED	On-Demand	Mild	NPFFR1	52	35
C[C@@H]1C[C@]1(C#N)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824051	ED	On-Demand	Mild	TACR3	65	36
C[C@@H]1C[C@]1(C#N)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824051	ED	On-Demand	Mild	NPFFR1	52	35
C[C@@H]1C[C@@]1(C#N)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824052	ED	On-Demand	Mild	TACR3	65	36
C[C@@H]1C[C@@]1(C#N)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824052	ED	On-Demand	Mild	NPFFR1	52	35
C[C@@H]1C[C@@]1(C#N)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824053	ED	On-Demand	Mild	TACR3	65	36
C[C@@H]1C[C@@]1(C#N)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450824053	ED	On-Demand	Mild	NPFFR1	52	35
O=C(NCC1(CCO)CC1)c1cc(Cl)c(F)cc1Br	ZINC000450824058	FG	On-Demand	Anodyne	SLC6A9	46	40
Cc1ncc([N+](=O)[O-])n1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450824059	DH	On-Demand	Bother	TYMS	0	47
Cc1ncc([N+](=O)[O-])n1Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450824059	DH	On-Demand	Bother	FABH	0	40
Cc1ncc([N+](=O)[O-])n1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450824060	DH	On-Demand	Bother	TYMS	0	47
Cc1ncc([N+](=O)[O-])n1Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450824060	DH	On-Demand	Bother	FABH	0	40
Clc1cccc(C2CN(c3cc(N4CCOCC4)ncn3)C2)c1	ZINC000450824067	EF	On-Demand	Anodyne	SMG1	37	42
COc1ccc(CNC(=O)CCN2CCN(CC(C)(C)O)[C@@H](C)C2)c(OC)c1	ZINC000450824071	GD	On-Demand	Anodyne	HTR7	26	41
COc1ccc(CNC(=O)CCN2CCN(CC(C)(C)O)[C@H](C)C2)c(OC)c1	ZINC000450824072	GD	On-Demand	Anodyne	HTR7	26	41
C[C@H](OCCc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450824073	CD	On-Demand	Anodyne	TIMP3	54	34
C[C@H](OCCc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450824073	CD	On-Demand	Anodyne	CAPN2	48	31
C[C@@H](OCCc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450824074	CD	On-Demand	Anodyne	TIMP3	54	34
C[C@@H](OCCc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450824074	CD	On-Demand	Anodyne	CAPN2	48	31
CCC[C@H](O)CN1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450824082	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
CCC[C@@H](O)CN1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450824083	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
CO[C@@H]1CN(c2ncnc3c2oc2ccccc23)C[C@H]1O	ZINC000450824095	CD	On-Demand	Anodyne	HRH4	17	63
COC(=O)c1n[nH]c2c1CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])CC2	ZINC000450824102	EC	On-Demand	Bother	TAAR1	17	42
COC(=O)c1n[nH]c2c1CN(c1ccccn1)CC2	ZINC000450824141	CD	On-Demand	Anodyne	DRD4	28	40
CC(F)(F)CCn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000450824151	CF	On-Demand	Bother	F2RL3	44	32
COC(=O)c1n[nH]c2c1CN(c1cc(C(=O)NC3CC3)c3ccccc3n1)CC2	ZINC000450824160	GE	On-Demand	Anodyne	ACACA	0	40
COC(=O)c1n[nH]c2c1CN(c1cc(C(=O)NC3CC3)c3ccccc3n1)CC2	ZINC000450824160	GE	On-Demand	Anodyne	ACACB	23	40
C/C=C\COc1cccc(CC(=O)N[C@H](C)[C@@H](C)C(=O)OCC)c1	ZINC000450824173	EF	On-Demand	Anodyne	PDS	47	31
C/C=C\COc1cccc(CC(=O)N[C@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450824174	EF	On-Demand	Anodyne	PDS	47	31
C/C=C/COc1cccc(CC(=O)N[C@H](C)[C@H](C)C(=O)OCC)c1	ZINC000450824175	EF	On-Demand	Anodyne	PDS	47	31
CO[C@@H]1CN(c2ncnc3sc(-c4ccccc4)cc23)C[C@H]1O	ZINC000450824179	EF	On-Demand	Anodyne	PDE3B	41	38
COC(=O)c1n[nH]c2c1CN(c1ncnc3c(OC)cc(OC)cc13)CC2	ZINC000450824190	FD	On-Demand	Anodyne	PDGFRB	40	35
Cc1ccn(-c2ccc(N[C@@H](C)C(=O)NCCc3ccccc3)nn2)n1	ZINC000450824194	FD	On-Demand	Anodyne	AMP1_PLAFQ	19	41
OCC1(CCNc2ccnc3cc(Br)ccc23)CC1	ZINC000450824198	DH	On-Demand	Anodyne	HRP1_PLAFA	90	36
COc1ccc(-c2noc(CSc3nnc(N(C)C)n3C(C)C)n2)nn1	ZINC000450824199	GE	On-Demand	Anodyne	TNKS2	16	40
COc1ccc(-c2noc(CSc3nnc(N(C)C)n3C(C)C)n2)nn1	ZINC000450824199	GE	On-Demand	Anodyne	AXIN2	0	43
O=C(c1ccc(NCCC2(CO)CC2)nc1)N1CCc2ccccc21	ZINC000450824201	EE	On-Demand	Anodyne	AVPR2	79	41
O=C(c1ccc(NCCC2(CO)CC2)nc1)N1CCc2ccccc21	ZINC000450824201	EE	On-Demand	Anodyne	AVPR1A	55	44
CO[C@H](C)c1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450824202	ED	On-Demand	Anodyne	AMP1_PLAFQ	26	41
CO[C@@H](C)c1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)s[nH]1	ZINC000450824203	ED	On-Demand	Anodyne	AMP1_PLAFQ	26	41
CCS(=O)(=O)c1ccc(COc2cc(C)ccc2NC(C)=O)cc1	ZINC000450824211	EG	On-Demand	Anodyne	RORC	60	34
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450824214	FD	On-Demand	Anodyne	CA2	18	41
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450824214	FD	On-Demand	Anodyne	CA1	20	40
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450824214	FD	On-Demand	Anodyne	CA5B	24	40
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450824214	FD	On-Demand	Anodyne	CA5A	22	40
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450824214	FD	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nc1	ZINC000450824214	FD	On-Demand	Anodyne	LIMK2	43	33
CCn1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1=O	ZINC000450824217	DC	On-Demand	Anodyne	CASP3	65	38
CCn1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1=O	ZINC000450824217	DC	On-Demand	Anodyne	CASP8	65	38
CCn1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1=O	ZINC000450824217	DC	On-Demand	Anodyne	AMP1_PLAFQ	26	40
N#Cc1cnc2c(F)cc(F)cc2c1NCCC1(CO)CC1	ZINC000450824220	DF	On-Demand	Mild	MAP3K8	70	34
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncn1	ZINC000450824221	CD	On-Demand	Anodyne	AMP1_PLAFQ	35	44
COC(=O)c1cccc(CN2CCN(c3c(C#N)c(C)nn3C)CC2)c1Cl	ZINC000450824229	GE	On-Demand	Mild	DRD4	40	31
COC(=O)c1cccc(CN2CCN(c3c(C#N)c(C)nn3C)CC2)c1Cl	ZINC000450824229	GE	On-Demand	Mild	MT-CYB	40	30
C[C@H](Nc1ncccc1I)C(=O)NCCc1ccccc1	ZINC000450824232	GF	On-Demand	Anodyne	AMP1_PLAFQ	32	44
OCC1(CCNc2ncnc3[nH]ccc23)CC1	ZINC000450824233	BC	On-Demand	Anodyne	JAK1	17	41
COc1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450824234	EF	On-Demand	Bother	MTNR1A	30	42
COc1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450824234	EF	On-Demand	Bother	MTNR1B	58	41
COc1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450824234	EF	On-Demand	Bother	AKR1C2	47	44
C[S@](=O)c1nncn1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450824236	EG	On-Demand	Anodyne	DNAE	41	32
C[S@@](=O)c1nncn1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450824237	EG	On-Demand	Anodyne	DNAE	41	32
CC1CCN(C(=O)c2ccc(N[C@@H](C)C(=O)NCCc3ccccc3)nc2)CC1	ZINC000450824243	GG	On-Demand	Anodyne	OPRM1	15	42
CCc1cc(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]c(C)n1	ZINC000450824245	DD	On-Demand	Anodyne	AMP1_PLAFQ	27	41
CCCN1CCCN(CCN(C)Cc2ccccc2)CC1=O	ZINC000450824248	DE	On-Demand	Anodyne	SIGMAR1	24	48
Cc1nc(C)c(F)c(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450824255	DD	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](Nc1c([N+](=O)[O-])ncn1C)C(=O)NCCc1ccccc1	ZINC000450824259	DD	On-Demand	Bother	AMP1_PLAFQ	26	40
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450824262	FD	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@H](C)NC(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450824263	FD	On-Demand	Bother	TAAR1	20	44
C[C@H](Nc1nccc(C#N)n1)C(=O)NCCc1ccccc1	ZINC000450824271	CD	On-Demand	Mild	SDH1	0	40
C[C@H](Nc1nccc(C#N)n1)C(=O)NCCc1ccccc1	ZINC000450824271	CD	On-Demand	Mild	AMP1_PLAFQ	26	41
C[C@H](N=c1cc[nH]cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450824274	DD	On-Demand	Bother	COLA	65	35
C[C@H](N=c1cc[nH]cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450824274	DD	On-Demand	Bother	AMP1_PLAFQ	22	40
CN=c1[nH]c(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]c2ccccc12	ZINC000450824276	ED	On-Demand	Anodyne	SSTR4	34	40
CN=c1[nH]c(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]c2ccccc12	ZINC000450824276	ED	On-Demand	Anodyne	SSTR5	23	40
CN=c1[nH]c(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]c2ccccc12	ZINC000450824276	ED	On-Demand	Anodyne	BRS3	23	42
CN=c1[nH]c(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]c2ccccc12	ZINC000450824276	ED	On-Demand	Anodyne	AMP1_PLAFQ	33	43
COc1ccccc1SCC(=O)CC(C)(C)C1CC1	ZINC000450824282	CI	On-Demand	Anodyne	MTNR1B	18	44
C[C@@H](S[C@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824284	DI	On-Demand	Anodyne	MAP	0	47
C[C@@H](S[C@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824284	DI	On-Demand	Anodyne	MAP1	122	47
C[C@@H](S[C@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824284	DI	On-Demand	Anodyne	GCK	19	42
C[C@@H](S[C@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824284	DI	On-Demand	Anodyne	FFAR2	33	55
C[C@H](S[C@@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824287	DI	On-Demand	Anodyne	MAP	0	47
C[C@H](S[C@@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824287	DI	On-Demand	Anodyne	MAP1	122	47
C[C@H](S[C@@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824287	DI	On-Demand	Anodyne	GCK	19	42
C[C@H](S[C@@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824287	DI	On-Demand	Anodyne	FFAR2	33	55
C[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450824289	DI	On-Demand	Anodyne	MAP	0	47
C[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450824289	DI	On-Demand	Anodyne	MAP1	122	47
C[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450824289	DI	On-Demand	Anodyne	GCK	22	42
C[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccc(F)cc1	ZINC000450824289	DI	On-Demand	Anodyne	FFAR2	33	55
CCc1cc(NCCC2(CO)CC2)n2ncnc2n1	ZINC000450824290	CD	On-Demand	Anodyne	DHOD	0	49
C[C@H](S[C@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824291	DI	On-Demand	Anodyne	MAP	0	47
C[C@H](S[C@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824291	DI	On-Demand	Anodyne	MAP1	122	47
C[C@H](S[C@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824291	DI	On-Demand	Anodyne	GCK	22	42
C[C@H](S[C@H](C)c1ccc(F)cc1)C(=O)Nc1nccs1	ZINC000450824291	DI	On-Demand	Anodyne	FFAR2	33	55
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(Br)ccc13)C2	ZINC000450824305	EI	On-Demand	Anodyne	HRP1_PLAFA	101	35
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3cc(Br)ccc13)C2	ZINC000450824305	EI	On-Demand	Anodyne	HNMT	53	34
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	CACNA1B	40	34
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	SLC9A1	42	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	FASN	26	42
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	CCR2	50	38
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	RBP4	23	45
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	MLYCD	38	42
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	SFRP1	18	47
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	HPGDS	15	41
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	HPGD	24	41
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824306	GH	On-Demand	Anodyne	MAP3K12	40	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	CACNA1B	40	34
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	SLC9A1	42	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	FASN	26	42
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	CCR2	50	38
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	RBP4	23	45
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	MLYCD	38	42
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	SFRP1	18	47
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	HPGDS	15	41
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	HPGD	24	41
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450824307	GH	On-Demand	Anodyne	MAP3K12	40	40
CN1[C@H]2CC[C@H]1CC(N=c1[nH]c(-c3ccccc3F)cs1)C2	ZINC000450824309	DG	On-Demand	Anodyne	GLRA1	44	34
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450824310	GD	On-Demand	Anodyne	CCR3	90	32
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450824311	GD	On-Demand	Anodyne	CCR3	90	32
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450824312	GD	On-Demand	Anodyne	CCR3	90	32
C[C@H](OCc1ccc(F)cc1)C(=O)N1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450824313	GD	On-Demand	Anodyne	CCR3	90	32
CN(CCCC(=O)c1ccc(Br)cc1)[C@@H]1CC[C@@H](O)CC1	ZINC000450824318	FH	On-Demand	Anodyne	SHC	45	46
CN(CCCC(=O)c1ccc(Br)cc1)[C@@H]1CC[C@@H](O)CC1	ZINC000450824318	FH	On-Demand	Anodyne	HDAC8	19	45
CN(CCCC(=O)c1ccc(Br)cc1)[C@@H]1CC[C@@H](O)CC1	ZINC000450824318	FH	On-Demand	Anodyne	LSS	27	54
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450824320	DG	On-Demand	Anodyne	FASN	43	49
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450824320	DG	On-Demand	Anodyne	L3MBTL3	42	34
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450824320	DG	On-Demand	Anodyne	HPGD	35	43
Cc1cccc([C@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450824321	DG	On-Demand	Anodyne	FASN	43	49
Cc1cccc([C@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450824321	DG	On-Demand	Anodyne	L3MBTL3	42	34
Cc1cccc([C@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450824321	DG	On-Demand	Anodyne	HPGD	35	43
COc1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)c(C(N)=O)c1	ZINC000450824337	FI	On-Demand	Anodyne	MAOB	16	41
COc1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)c(C(N)=O)c1	ZINC000450824337	FI	On-Demand	Anodyne	FFAR1	34	41
COc1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)c(C(N)=O)c1	ZINC000450824337	FI	On-Demand	Anodyne	PDEB1	0	41
COc1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)c(C(N)=O)c1	ZINC000450824338	FI	On-Demand	Anodyne	MAOB	16	41
COc1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)c(C(N)=O)c1	ZINC000450824338	FI	On-Demand	Anodyne	FFAR1	34	41
COc1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)c(C(N)=O)c1	ZINC000450824338	FI	On-Demand	Anodyne	PDEB1	0	41
CCNC(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)nn1	ZINC000450824346	DE	On-Demand	Anodyne	SCD1	46	44
CN1[C@H]2CC[C@H]1CC(N=c1ccc3ccc(Cl)cc3[nH]1)C2	ZINC000450824356	DG	On-Demand	Anodyne	SLC6A1	34	41
CN1[C@H]2CC[C@H]1CC(N=c1ccc3ccc(Cl)cc3[nH]1)C2	ZINC000450824356	DG	On-Demand	Anodyne	SLC6A3	22	41
Cc1cccc([C@@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450824378	FI	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1cccc([C@@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450824378	FI	On-Demand	Anodyne	CCR5	27	40
Cc1cccc([C@@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450824378	FI	On-Demand	Anodyne	LIPE	15	40
Cc1cccc([C@@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450824378	FI	On-Demand	Anodyne	SLC12A5	56	34
Cc1cccc([C@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450824379	FI	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1cccc([C@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450824379	FI	On-Demand	Anodyne	CCR5	27	40
Cc1cccc([C@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450824379	FI	On-Demand	Anodyne	LIPE	15	40
Cc1cccc([C@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450824379	FI	On-Demand	Anodyne	SLC12A5	56	34
C[C@@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824382	EJ	On-Demand	Anodyne	CACNA1B	47	36
C[C@@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824382	EJ	On-Demand	Anodyne	CCR2	58	46
C[C@@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824382	EJ	On-Demand	Anodyne	RBP4	23	41
C[C@@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824383	EJ	On-Demand	Anodyne	CACNA1B	47	36
C[C@@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824383	EJ	On-Demand	Anodyne	CCR2	58	46
C[C@@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824383	EJ	On-Demand	Anodyne	RBP4	23	41
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H]2C)nc1	ZINC000450824386	DD	On-Demand	Anodyne	PTR1	47	35
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H]2C)nc1	ZINC000450824387	DD	On-Demand	Anodyne	PTR1	47	35
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H]2C)nc1	ZINC000450824388	DD	On-Demand	Anodyne	PTR1	47	35
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H]2C)nc1	ZINC000450824389	DD	On-Demand	Anodyne	PTR1	47	35
C[C@]1(c2cccc(C(N)=O)c2)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450824393	FE	On-Demand	Anodyne	F11	42	33
C[C@@]1(c2cccc(C(N)=O)c2)NC(=O)N(C[C@H]2CCCCC2(F)F)C1=O	ZINC000450824394	FE	On-Demand	Anodyne	F11	42	33
C[C@@]1(c2cccc(C(N)=O)c2)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450824395	FE	On-Demand	Anodyne	F11	42	33
C[C@]1(c2cccc(C(N)=O)c2)NC(=O)N(C[C@@H]2CCCCC2(F)F)C1=O	ZINC000450824396	FE	On-Demand	Anodyne	F11	42	33
C[C@H]1CCCN(c2cc(NC[C@H]3CCCC[C@@H]3O)ncn2)C1	ZINC000450824401	DF	On-Demand	Anodyne	PRCP	0	46
COc1ccc(CNC(=O)CCN2CCc3nn[nH]c3C2)c(OC)c1	ZINC000450824432	EC	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCc3nn[nH]c3C2)c(OC)c1	ZINC000450824432	EC	On-Demand	Anodyne	HTR7	30	41
COC(=O)c1ncn(Cc2ccn(CCc3ccccc3)n2)n1	ZINC000450824439	DD	On-Demand	Anodyne	FAS	29	45
Fc1ccccc1Cc1nnc(SCC2=CCCCC2)o1	ZINC000450824450	DI	On-Demand	Anodyne	PTK2	0	47
CC(C)c1ccc(-c2nnc(SCC[C@H]3CCOC3)o2)cc1	ZINC000450824456	DI	On-Demand	Anodyne	TYMS	0	44
CC(C)c1ccc(-c2nnc(SCC[C@@H]3CCOC3)o2)cc1	ZINC000450824457	DI	On-Demand	Anodyne	TYMS	0	44
COc1cc(OC)cc(N(C)Cc2cccc(C(C)=O)c2)c1	ZINC000450824458	CH	On-Demand	Anodyne	HSD17B2	34	43
COC(=O)c1csc(CSc2nnc(Cc3ccccc3OC)o2)n1	ZINC000450824473	GG	On-Demand	Anodyne	PTK2	0	45
COc1ccc(CNC(=O)CCN2CC(C)(C)OC(C)(C)C2)c(OC)c1	ZINC000450824484	FF	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCN2CC(C)(C)OC(C)(C)C2)c(OC)c1	ZINC000450824484	FF	On-Demand	Anodyne	MTNR1A	56	37
COc1ccc(CNC(=O)CCN2CC(C)(C)OC(C)(C)C2)c(OC)c1	ZINC000450824484	FF	On-Demand	Anodyne	MTNR1B	41	40
Cc1cc(N2CCCC[C@H]2c2ccc(Cl)cc2)n2ncnc2n1	ZINC000450824518	EH	On-Demand	Anodyne	DHOD	0	48
Cc1cc(N2CCCC[C@@H]2c2ccc(Cl)cc2)n2ncnc2n1	ZINC000450824519	EH	On-Demand	Anodyne	DHOD	0	48
CCN(Cc1c[nH]c2ccccc12)CC1CC(F)(F)C1	ZINC000450824524	CI	On-Demand	Anodyne	MPO	17	48
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(Cc2c(C)cccc2Cl)C1	ZINC000450824530	GG	On-Demand	Anodyne	SLC6A1	63	38
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(Cc2c(C)cccc2Cl)C1	ZINC000450824531	GG	On-Demand	Anodyne	SLC6A1	63	38
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCCC(=O)C1CC1	ZINC000450824553	FE	On-Demand	Anodyne	SIGMAR1	42	38
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCCC(=O)C1CC1	ZINC000450824553	FE	On-Demand	Anodyne	CYP2J2	42	30
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCCC(=O)C1CC1	ZINC000450824553	FE	On-Demand	Anodyne	NPFFR1	46	33
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCCC(=O)C1CC1	ZINC000450824557	FE	On-Demand	Anodyne	SIGMAR1	42	38
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCCC(=O)C1CC1	ZINC000450824557	FE	On-Demand	Anodyne	CYP2J2	42	30
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCCC(=O)C1CC1	ZINC000450824557	FE	On-Demand	Anodyne	NPFFR1	46	33
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450824574	GD	On-Demand	Anodyne	NPFFR2	38	41
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450824574	GD	On-Demand	Anodyne	NPFFR1	61	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450824575	GD	On-Demand	Anodyne	NPFFR2	38	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CCc1ccc(C(N)=O)cc1	ZINC000450824575	GD	On-Demand	Anodyne	NPFFR1	61	41
COc1ccnc(CN[C@H]2CCC[C@@H]2c2ccccc2)n1	ZINC000450824585	CF	On-Demand	Anodyne	KDM1A	16	45
COc1ccnc(CN[C@H]2CCC[C@H]2c2ccccc2)n1	ZINC000450824587	CF	On-Demand	Anodyne	KDM1A	16	45
COc1ccnc(CN[C@@H]2CCC[C@@H]2c2ccccc2)n1	ZINC000450824588	CF	On-Demand	Anodyne	KDM1A	16	45
Cc1cccc(Cl)c1C(=O)NCC1(CO)CCC1	ZINC000450824589	CF	On-Demand	Anodyne	ACAT	0	41
COc1ccnc(CN[C@@H]2CCC[C@H]2c2ccccc2)n1	ZINC000450824590	CF	On-Demand	Anodyne	KDM1A	16	45
CC[C@@]1(C)CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450824593	CG	On-Demand	Anodyne	SSTR5	40	36
CC[C@]1(C)CN(Cc2ccc(Cl)c(OC)c2)CCO1	ZINC000450824594	CG	On-Demand	Anodyne	SSTR5	40	36
COCCOc1ccc(C#N)cc1NC(=O)c1cc2n(n1)CCCC2	ZINC000450824595	EE	On-Demand	Mild	PDGFRB	17	43
Cc1cncc(-c2nc(CN3CCN(CC(C)(C)O)[C@@H](C)C3)no2)c1	ZINC000450824603	ED	On-Demand	Anodyne	ACOX1	32	43
Cc1cncc(-c2nc(CN3CCN(CC(C)(C)O)[C@H](C)C3)no2)c1	ZINC000450824604	ED	On-Demand	Anodyne	ACOX1	32	43
CC(=O)Nc1cccnc1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450824606	CE	On-Demand	Anodyne	G2YM83_BOTF4	52	33
Cc1nc2c(n1[C@@H]1CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C1)CCCC2	ZINC000450824626	GG	On-Demand	Anodyne	L3MBTL3	41	35
Cc1nc2c(n1[C@H]1CCN(C(=O)[C@H]3CCN(c4ccccc4)C3)C1)CCCC2	ZINC000450824627	GG	On-Demand	Anodyne	L3MBTL3	41	35
Cc1nc2c(n1[C@H]1CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C1)CCCC2	ZINC000450824628	GG	On-Demand	Anodyne	L3MBTL3	41	35
Cc1nc2c(n1[C@@H]1CCN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C1)CCCC2	ZINC000450824631	GG	On-Demand	Anodyne	L3MBTL3	41	35
CCN(Cc1c[nH]c2ccccc12)CC1CCC(=O)CC1	ZINC000450824632	CH	On-Demand	Anodyne	MC4R	37	41
CCN(Cc1c[nH]c2ccccc12)CC1CCC(=O)CC1	ZINC000450824632	CH	On-Demand	Anodyne	SSTR3	15	44
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(Cc2ccccc2OC2CC2)C1	ZINC000450824636	GF	On-Demand	Anodyne	HCN1	50	32
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(Cc2ccccc2OC2CC2)C1	ZINC000450824636	GF	On-Demand	Anodyne	HCN4	49	32
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(Cc2ccccc2OC2CC2)C1	ZINC000450824637	GF	On-Demand	Anodyne	HCN1	50	32
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(Cc2ccccc2OC2CC2)C1	ZINC000450824637	GF	On-Demand	Anodyne	HCN4	49	32
COC(=O)C1(CN2CCCCC(C)(C)C2)CC1	ZINC000450824644	BE	On-Demand	Anodyne	EBP	20	44
CCC(CC)(CCn1c([N+](=O)[O-])cnc1C)C(=O)OC	ZINC000450824650	CE	On-Demand	Bother	FABH	0	41
Cc1ncc([N+](=O)[O-])n1CCc1cscn1	ZINC000450824654	BD	On-Demand	Bother	TYMS	36	42
COC(=O)c1n[nH]c2c1CN(c1nc3ccccc3s1)CC2	ZINC000450824655	DE	On-Demand	Anodyne	BCL2L1	56	38
CCc1cccc(C(=O)NCC2(CCO)CC2)n1	ZINC000450824661	BD	On-Demand	Anodyne	HCN1	49	31
CCc1cccc(C(=O)NCC2(CCO)CC2)n1	ZINC000450824661	BD	On-Demand	Anodyne	HCN4	47	31
FC(F)(F)c1cc(N2CC(c3cccc(Cl)c3)C2)n2ncnc2n1	ZINC000450824670	FG	On-Demand	Anodyne	DHOD	0	40
CCN(c1ccccc1)S(=O)(=O)c1ccc(NC[C@H](C)N(C)C)nc1	ZINC000450824678	FE	On-Demand	Anodyne	PRSS1	17	41
O=C(NC1CC1)c1ccc(N2CC(c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1	ZINC000450824682	FH	On-Demand	Bother	TAAR1	20	41
CCC1(CC)CN(C(=O)c2cn(-c3cccc(OC)c3)nn2)CCS1(=O)=O	ZINC000450824684	GD	On-Demand	Anodyne	ESRRA	18	40
C[C@@]1(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO[C@@H]1C1CC1	ZINC000450824690	FH	On-Demand	Anodyne	RBP4	67	36
C[C@@]1(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO[C@H]1C1CC1	ZINC000450824691	FH	On-Demand	Anodyne	RBP4	67	36
C[C@]1(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO[C@H]1C1CC1	ZINC000450824692	FH	On-Demand	Anodyne	RBP4	67	36
C[C@]1(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO[C@@H]1C1CC1	ZINC000450824693	FH	On-Demand	Anodyne	RBP4	67	36
CCOC(=O)c1ccnc(N2CC(c3cccc(Cl)c3)C2)c1[N+](=O)[O-]	ZINC000450824698	FG	On-Demand	Bother	CACNA1C	48	37
CCOC(=O)c1ccnc(N2CC(c3cccc(Cl)c3)C2)c1[N+](=O)[O-]	ZINC000450824698	FG	On-Demand	Bother	P2RY12	40	37
CCOC(=O)c1ccnc(N2CC(c3cccc(Cl)c3)C2)c1[N+](=O)[O-]	ZINC000450824698	FG	On-Demand	Bother	CACNA1D	80	36
NC(=O)c1ccc(=O)n(CCCCc2ccc(Cl)c(Cl)c2)n1	ZINC000450824705	EF	On-Demand	Anodyne	DNAE	41	31
CO[C@@H]1CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450824708	GB	On-Demand	Bother	BDKRB1	0	40
CO[C@@H]1CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450824708	GB	On-Demand	Bother	BCL2L1	92	34
CO[C@@H]1CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450824708	GB	On-Demand	Bother	BCL2	81	34
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824717	FG	On-Demand	Anodyne	ACACA	57	42
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824717	FG	On-Demand	Anodyne	ACACB	28	42
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824717	FG	On-Demand	Anodyne	MTNR1A	29	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824717	FG	On-Demand	Anodyne	MTNR1B	34	45
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824718	FG	On-Demand	Anodyne	ACACA	57	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824718	FG	On-Demand	Anodyne	ACACB	28	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824718	FG	On-Demand	Anodyne	MTNR1A	29	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824718	FG	On-Demand	Anodyne	MTNR1B	34	45
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824719	FG	On-Demand	Anodyne	ACACA	57	42
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824719	FG	On-Demand	Anodyne	ACACB	28	42
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824719	FG	On-Demand	Anodyne	MTNR1A	29	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824719	FG	On-Demand	Anodyne	MTNR1B	34	45
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824720	FG	On-Demand	Anodyne	ACACA	57	42
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824720	FG	On-Demand	Anodyne	ACACB	28	42
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824720	FG	On-Demand	Anodyne	MTNR1A	29	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450824720	FG	On-Demand	Anodyne	MTNR1B	34	45
O=C(CC[C@H]1CCCCO1)COc1nc(-c2ccccc2Cl)no1	ZINC000450824723	FH	On-Demand	Anodyne	OXTR	0	43
O=C(CC[C@H]1CCCCO1)COc1nc(-c2ccccc2Cl)no1	ZINC000450824723	FH	On-Demand	Anodyne	COLA	59	38
O=C(CC[C@H]1CCCCO1)COc1nc(-c2ccccc2Cl)no1	ZINC000450824723	FH	On-Demand	Anodyne	CPT1A	49	37
O=C(CC[C@@H]1CCCCO1)COc1nc(-c2ccccc2Cl)no1	ZINC000450824724	FH	On-Demand	Anodyne	OXTR	0	43
O=C(CC[C@@H]1CCCCO1)COc1nc(-c2ccccc2Cl)no1	ZINC000450824724	FH	On-Demand	Anodyne	COLA	59	38
O=C(CC[C@@H]1CCCCO1)COc1nc(-c2ccccc2Cl)no1	ZINC000450824724	FH	On-Demand	Anodyne	CPT1A	49	37
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450824730	FH	On-Demand	Anodyne	GPR88	0	44
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450824731	FH	On-Demand	Anodyne	GPR88	0	44
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450824732	FH	On-Demand	Anodyne	GPR88	0	44
CCn1c(C)nnc1SCc1ccc(C(=O)OC)cc1Br	ZINC000450824752	FG	On-Demand	Anodyne	SLC27A1	47	43
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	HMGCR	24	40
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	MME	43	38
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	ANPEP	49	36
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	SDH1	0	40
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	CAPN2	47	33
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	LAP3	44	36
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	40
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	PSMB5	40	38
CC[C@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824756	CD	On-Demand	Anodyne	PDS	42	35
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	HMGCR	24	40
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	MME	43	38
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	ANPEP	49	36
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	SDH1	0	40
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	CAPN2	47	33
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	LAP3	44	36
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	40
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	PSMB5	40	38
CC[C@@H](O)CC(=O)NC[C@@H](O)CCc1ccccc1	ZINC000450824757	CD	On-Demand	Anodyne	PDS	42	35
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	HMGCR	24	40
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	MME	43	38
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	ANPEP	49	36
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	SDH1	0	40
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	CAPN2	47	33
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	LAP3	44	36
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	40
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	PSMB5	40	38
CC[C@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824758	CD	On-Demand	Anodyne	PDS	42	35
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	HMGCR	24	40
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	MME	43	38
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	ANPEP	49	36
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	SDH1	0	40
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	CAPN2	47	33
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	LAP3	44	36
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	40
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	PSMB5	40	38
CC[C@@H](O)CC(=O)NC[C@H](O)CCc1ccccc1	ZINC000450824759	CD	On-Demand	Anodyne	PDS	42	35
C[C@@H](Sc1nnc(CCC2CCCCC2)o1)C(=O)Nc1nccs1	ZINC000450824773	FI	On-Demand	Anodyne	MAP1	70	37
C[C@H](Sc1nnc(CCC2CCCCC2)o1)C(=O)Nc1nccs1	ZINC000450824774	FI	On-Demand	Anodyne	MAP1	70	37
CO[C@@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450824776	FE	On-Demand	Bother	PRNP	43	33
CO[C@@H]1CN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450824776	FE	On-Demand	Bother	TAAR1	43	52
CCOC(=O)[C@@H](C)N(CCCC(=O)c1ccc(F)cc1)C1CC1	ZINC000450824797	DG	On-Demand	Anodyne	THRA	43	34
CCOC(=O)[C@H](C)N(CCCC(=O)c1ccc(F)cc1)C1CC1	ZINC000450824798	DG	On-Demand	Anodyne	THRA	43	34
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	CA2	31	46
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	CA1	30	45
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	CA7	23	45
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	CA5B	34	45
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	CA4	25	46
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	CA5A	33	45
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	MMP2	27	40
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	MMP3	46	36
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	CAPN2	40	37
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	CA12	22	43
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	AMP1_PLAFQ	35	45
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	NCE103	24	49
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	LIMK2	40	37
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)cc1	ZINC000450824802	FF	On-Demand	Anodyne	RORC	50	43
C[C@H](Nc1nccc(C(F)(F)F)n1)C(=O)NCCc1ccccc1	ZINC000450824808	EF	On-Demand	Anodyne	AMP1_PLAFQ	26	41
C[C@H](Nc1nccc(C(F)(F)F)n1)C(=O)NCCc1ccccc1	ZINC000450824808	EF	On-Demand	Anodyne	CARM1	49	36
C[C@H](Nc1nccn(C)c1=O)C(=O)NCCc1ccccc1	ZINC000450824813	DC	On-Demand	Anodyne	CASP3	61	39
C[C@H](Nc1nccn(C)c1=O)C(=O)NCCc1ccccc1	ZINC000450824813	DC	On-Demand	Anodyne	CASP8	60	39
C[C@H](Nc1nccn(C)c1=O)C(=O)NCCc1ccccc1	ZINC000450824813	DC	On-Demand	Anodyne	AMP1_PLAFQ	30	42
CCc1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450824814	DE	On-Demand	Anodyne	MME	41	40
CCc1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450824814	DE	On-Demand	Anodyne	MTNR1A	18	40
CCc1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450824814	DE	On-Demand	Anodyne	MTNR1B	34	40
CCc1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450824814	DE	On-Demand	Anodyne	CAPN2	59	38
CCc1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450824814	DE	On-Demand	Anodyne	AMP1_PLAFQ	38	43
C[C@H](Nc1ccc(C(=O)NCCO)nn1)C(=O)NCCc1ccccc1	ZINC000450824816	FB	On-Demand	Anodyne	ANPEP	22	42
C[C@H](Nc1ccc(C(=O)NCCO)nn1)C(=O)NCCc1ccccc1	ZINC000450824816	FB	On-Demand	Anodyne	AMP1_PLAFQ	27	42
C[C@H](Nc1nnc(Cc2ccccc2)s1)C(=O)NCCc1ccccc1	ZINC000450824817	FF	On-Demand	Anodyne	AMP1_PLAFQ	31	43
C[C@H](Nc1nnc(-c2ccon2)s1)C(=O)NCCc1ccccc1	ZINC000450824819	ED	On-Demand	Anodyne	AMP1_PLAFQ	22	40
Cc1cccc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc12	ZINC000450824828	EG	On-Demand	Anodyne	ANPEP	23	40
Cc1cccc2c(N[C@@H](C)C(=O)NCCc3ccccc3)ncnc12	ZINC000450824828	EG	On-Demand	Anodyne	AMP1_PLAFQ	33	40
C[C@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824832	EJ	On-Demand	Anodyne	CACNA1B	47	36
C[C@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824832	EJ	On-Demand	Anodyne	CCR2	58	46
C[C@]1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824832	EJ	On-Demand	Anodyne	RBP4	23	41
C[C@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824838	EJ	On-Demand	Anodyne	CACNA1B	47	36
C[C@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824838	EJ	On-Demand	Anodyne	CCR2	58	46
C[C@]1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC=CCC1	ZINC000450824838	EJ	On-Demand	Anodyne	RBP4	23	41
COC(=O)C1(Cn2nnc(-c3ccc(F)c(C)c3)n2)CCCC1	ZINC000450824844	DF	On-Demand	Anodyne	SCARB1	46	36
CNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nn1	ZINC000450824854	EC	On-Demand	Anodyne	ANPEP	25	43
CNC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)nn1	ZINC000450824854	EC	On-Demand	Anodyne	AMP1_PLAFQ	30	43
CO[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1C	ZINC000450824857	DF	On-Demand	Anodyne	SIGMAR1	32	40
CO[C@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1C	ZINC000450824858	DF	On-Demand	Anodyne	SIGMAR1	32	40
CO[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@@H]1C	ZINC000450824859	DF	On-Demand	Anodyne	SIGMAR1	32	40
CO[C@@H]1CN(Cc2ccn(CCc3ccccc3)n2)CC[C@H]1C	ZINC000450824860	DF	On-Demand	Anodyne	SIGMAR1	32	40
C[C@H](Nc1cccc(C(F)(F)F)n1)C(=O)NCCc1ccccc1	ZINC000450824864	EG	On-Demand	Anodyne	TRPV1	53	38
C[C@H](Nc1cccc(C(F)(F)F)n1)C(=O)NCCc1ccccc1	ZINC000450824864	EG	On-Demand	Anodyne	AMP1_PLAFQ	38	43
C[C@H](Nc1cccc(C(F)(F)F)n1)C(=O)NCCc1ccccc1	ZINC000450824864	EG	On-Demand	Anodyne	CARM1	85	41
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1Cl	ZINC000450824865	DG	On-Demand	Anodyne	METAP1	32	40
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1Cl	ZINC000450824865	DG	On-Demand	Anodyne	AMP1_PLAFQ	34	43
Cc1cc(C)cc([C@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C2)c1	ZINC000450824866	DH	On-Demand	Anodyne	HSD11B1	0	41
Cc1cc(C)cc([C@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C2)c1	ZINC000450824866	DH	On-Demand	Anodyne	L3MBTL3	48	34
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C2)c1	ZINC000450824867	DH	On-Demand	Anodyne	HSD11B1	0	41
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C2)c1	ZINC000450824867	DH	On-Demand	Anodyne	L3MBTL3	55	34
COC(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1Cl	ZINC000450824868	EH	On-Demand	Anodyne	DRD4	38	40
COC(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1Cl	ZINC000450824868	EH	On-Demand	Anodyne	HTR4	46	38
COC(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1Cl	ZINC000450824868	EH	On-Demand	Anodyne	SIGMAR1	29	42
COC(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1Cl	ZINC000450824868	EH	On-Demand	Anodyne	SSTR5	61	38
COC(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1Cl	ZINC000450824868	EH	On-Demand	Anodyne	CCR3	36	40
COC(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1Cl	ZINC000450824868	EH	On-Demand	Anodyne	MCHR1	49	46
COC(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1Cl	ZINC000450824868	EH	On-Demand	Anodyne	CACNA1I	40	40
COC(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1Cl	ZINC000450824869	EH	On-Demand	Anodyne	DRD4	38	40
COC(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1Cl	ZINC000450824869	EH	On-Demand	Anodyne	HTR4	46	38
COC(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1Cl	ZINC000450824869	EH	On-Demand	Anodyne	SIGMAR1	29	42
COC(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1Cl	ZINC000450824869	EH	On-Demand	Anodyne	SSTR5	61	38
COC(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1Cl	ZINC000450824869	EH	On-Demand	Anodyne	CCR3	36	40
COC(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1Cl	ZINC000450824869	EH	On-Demand	Anodyne	MCHR1	49	46
COC(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1Cl	ZINC000450824869	EH	On-Demand	Anodyne	CACNA1I	40	40
CC(=O)Nc1nnc(SCc2c(C)cccc2Cl)s1	ZINC000450824881	DH	On-Demand	Anodyne	ABL1	15	54
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450824886	FD	On-Demand	Bother	GSTM2	50	35
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450824886	FD	On-Demand	Bother	COLA	48	33
CCS(=O)(=O)c1ccccc1N1CC(c2cccc(Cl)c2)C1	ZINC000450824898	EH	On-Demand	Anodyne	MDM2	59	32
CN1[C@H]2CC[C@H]1CC(Nc1ncc(-c3ccccc3)s1)C2	ZINC000450824927	CH	On-Demand	Anodyne	SLC6A1	24	46
CN1[C@H]2CC[C@H]1CC(Nc1ncc(-c3ccccc3)s1)C2	ZINC000450824927	CH	On-Demand	Anodyne	SLC6A3	20	40
Cc1cc(=N[C@@H](C)C(=O)NCCc2ccccc2)cc[nH]1	ZINC000450824929	CD	On-Demand	Anodyne	AMP1_PLAFQ	44	47
COc1cc(-c2noc(COc3ccc(-c4noc(C5CC5)n4)cc3)n2)ncn1	ZINC000450824931	GG	On-Demand	Anodyne	COLA	31	40
COc1cc(-c2noc(COc3ccc(-c4noc(C5CC5)n4)cc3)n2)ncn1	ZINC000450824931	GG	On-Demand	Anodyne	CPT1A	25	40
O=C(Cc1sccc1Br)NCCCNc1cccc(F)c1	ZINC000450824932	FH	On-Demand	Anodyne	TBK1	17	49
C[C@@H]1C(=O)NCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450824947	CD	On-Demand	Anodyne	DRD2	30	44
C[C@@H]1C(=O)NCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450824947	CD	On-Demand	Anodyne	CYP2J2	47	34
CSc1ccc2ncnc(NC3C[C@@H]4CC[C@H](C3)N4C)c2c1	ZINC000450824948	DG	On-Demand	Anodyne	CD38	65	41
C[C@H]1C(=O)NCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450824949	CD	On-Demand	Anodyne	DRD2	30	44
C[C@H]1C(=O)NCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450824949	CD	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN2CCc3ncsc3C2)cc1	ZINC000450824972	CF	On-Demand	Anodyne	NOD2	44	38
Cc1cc(-c2nnn(C[C@@H](C)S(C)(=O)=O)n2)ccc1F	ZINC000450824983	CD	On-Demand	Anodyne	SCARB1	40	32
Cc1cccc(Cl)c1CN1CCc2nn[nH]c2C1	ZINC000450825003	CE	On-Demand	Anodyne	EIF2AK1	40	34
CSc1ccc2ncnc(N3CC[S@@](=O)C(C)(C)CC3)c2c1	ZINC000450825012	EG	On-Demand	Anodyne	HTT	0	41
CSc1ccc2ncnc(N3CC[S@](=O)C(C)(C)CC3)c2c1	ZINC000450825013	EG	On-Demand	Anodyne	HTT	0	41
COC(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H]1C	ZINC000450825018	FD	On-Demand	Anodyne	MTNR1A	60	37
COC(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H]1C	ZINC000450825018	FD	On-Demand	Anodyne	MTNR1B	49	37
COC(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H]1C	ZINC000450825019	FD	On-Demand	Anodyne	MTNR1A	60	37
COC(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H]1C	ZINC000450825019	FD	On-Demand	Anodyne	MTNR1B	49	37
COC(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H]1C	ZINC000450825020	FD	On-Demand	Anodyne	MTNR1A	60	37
COC(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H]1C	ZINC000450825020	FD	On-Demand	Anodyne	MTNR1B	49	37
COC(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H]1C	ZINC000450825021	FD	On-Demand	Anodyne	MTNR1A	60	37
COC(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H]1C	ZINC000450825021	FD	On-Demand	Anodyne	MTNR1B	49	37
OC[C@H]1CCCN(c2cc(NC[C@H]3CCCC[C@@H]3O)ncn2)C1	ZINC000450825022	DD	On-Demand	Anodyne	PRCP	0	43
CC(=O)CCCCCSc1nnc(-c2ccc(C(C)C)cc2)o1	ZINC000450825024	EK	On-Demand	Anodyne	TYMS	0	48
CC1(C)CCN(c2ccnc(Cc3ccccc3)n2)CC[S@]1=O	ZINC000450825033	EF	On-Demand	Anodyne	SORD	37	41
CC1(C)CCN(c2ccnc(Cc3ccccc3)n2)CC[S@@]1=O	ZINC000450825034	EF	On-Demand	Anodyne	SORD	37	41
Fc1cccc(Cc2nnc(SCC3=CCCCC3)o2)c1	ZINC000450825035	DI	On-Demand	Anodyne	PTK2	0	48
CC(C)c1nnc(CN2CC(=O)N(C)[C@@H]2c2ccccc2)s1	ZINC000450825043	DF	On-Demand	Anodyne	HSD17B2	60	32
CC(C)c1nnc(CN2CC(=O)N(C)[C@H]2c2ccccc2)s1	ZINC000450825044	DF	On-Demand	Anodyne	HSD17B2	60	32
CC1(C)CCN(c2ncc(C(F)(F)F)s2)CC[S@@]1=O	ZINC000450825065	DF	On-Demand	Anodyne	MLYCD	68	43
CC1(C)CCN(c2ncc(C(F)(F)F)s2)CC[S@]1=O	ZINC000450825066	DF	On-Demand	Anodyne	MLYCD	68	43
Clc1ccc(CCCCN2CCc3nn[nH]c3C2)cc1Cl	ZINC000450825067	EG	On-Demand	Anodyne	SIGMAR1	22	50
Clc1ccc(CCCCN2CCc3nn[nH]c3C2)cc1Cl	ZINC000450825067	EG	On-Demand	Anodyne	CHRNA6	0	41
CC(=O)CCCCCn1c(-c2ccccn2)noc1=O	ZINC000450825091	CE	On-Demand	Anodyne	FAAH	43	42
CO[C@@H]1CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C[C@H]1O	ZINC000450825120	ED	On-Demand	Anodyne	AVPR2	43	43
COC[C@@H](Cn1c([N+](=O)[O-])cnc1C)c1ccc(Br)cc1	ZINC000450825121	FG	On-Demand	Bother	FABH	0	42
COC[C@H](Cn1c([N+](=O)[O-])cnc1C)c1ccc(Br)cc1	ZINC000450825129	FG	On-Demand	Bother	FABH	0	42
CCC(CC)Oc1ccc(C(=O)Nc2ncccc2NC(C)=O)cc1	ZINC000450825134	EH	On-Demand	Anodyne	PRNP	44	33
CO[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H]1O	ZINC000450825145	DD	On-Demand	Anodyne	PDE3A	49	37
CO[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H]1O	ZINC000450825145	DD	On-Demand	Anodyne	PDGFRB	31	42
CO[C@@H]1CN(c2ncnc3cc(Br)ccc23)C[C@H]1O	ZINC000450825145	DD	On-Demand	Anodyne	PDE3B	72	37
CC(=O)c1ccc(Cn2c3c(sc2=O)CCCC3)cc1	ZINC000450825159	CG	On-Demand	Anodyne	FABP4	37	43
COC(=O)c1csc(CN[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450825162	GI	On-Demand	Anodyne	RBP4	45	34
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450825163	EG	On-Demand	Anodyne	CCR3	0	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450825163	EG	On-Demand	Anodyne	MTTP	47	35
COC(=O)c1csc(CN[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450825164	GI	On-Demand	Anodyne	RBP4	45	34
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450825165	EG	On-Demand	Anodyne	CCR3	0	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450825165	EG	On-Demand	Anodyne	MTTP	47	35
COC(=O)c1csc(CN[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450825166	GI	On-Demand	Anodyne	RBP4	45	34
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450825167	EG	On-Demand	Anodyne	CCR3	0	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450825167	EG	On-Demand	Anodyne	MTTP	47	35
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450825168	EG	On-Demand	Anodyne	CCR3	0	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450825168	EG	On-Demand	Anodyne	MTTP	47	35
COC(=O)c1csc(CN[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450825169	GI	On-Demand	Anodyne	RBP4	45	34
COc1ccc(-c2csc3ncnc(N4C[C@@H](O)[C@H](OC)C4)c23)cc1	ZINC000450825177	FF	On-Demand	Anodyne	ADRB3	29	45
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	F2	58	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	ACE	44	44
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	FKBP1A	48	48
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	OPRM1	18	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	CELA1	48	35
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	ELANE	76	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	MMP13	63	44
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	TRY1_BOVIN	74	35
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	CCR4	0	44
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	ADAM17	46	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	ITGA4	53	52
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	CAPNS1	27	55
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	MMP2	29	42
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	MMP3	69	44
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	MMP8	35	42
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	LGMN	69	36
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	CAPN1	26	57
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	MMP9	33	43
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	MMP12	17	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	CASP7	46	34
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	MMP7	75	44
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	TPP2	41	38
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	MMP1	65	47
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	XIAP	69	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	SFRP1	50	35
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	WNT3	55	35
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825199	GD	On-Demand	Anodyne	BRCA1	61	33
CCOC(=O)COc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450825200	GH	On-Demand	Anodyne	LTA4H	35	41
CCOC(=O)COc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450825200	GH	On-Demand	Anodyne	TIMP3	73	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	F2	58	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	ACE	44	44
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	FKBP1A	48	48
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	OPRM1	18	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	CELA1	48	35
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	ELANE	76	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	MMP13	63	44
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	TRY1_BOVIN	74	35
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	CCR4	0	44
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	ADAM17	46	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	ITGA4	53	52
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	CAPNS1	27	55
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	MMP2	29	42
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	MMP3	69	44
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	MMP8	35	42
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	LGMN	69	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	CAPN1	26	57
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	MMP9	33	43
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	MMP12	17	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	CASP7	46	34
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	MMP7	75	44
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	TPP2	41	38
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	MMP1	65	47
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	XIAP	69	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	SFRP1	50	35
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	WNT3	55	35
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450825202	GD	On-Demand	Anodyne	BRCA1	61	33
CCc1nc(C)c(Cn2c([N+](=O)[O-])cnc2C)o1	ZINC000450825210	CE	On-Demand	Bother	TYMS	35	41
CCc1cc(N[C@@H](C)c2nccn2CC)n2ncnc2n1	ZINC000450825221	CE	On-Demand	Anodyne	DHOD	0	52
COC(=O)c1n[nH]c2c1CN(c1cc(C)nc3ccc(F)cc13)CC2	ZINC000450825226	EF	On-Demand	Anodyne	DHODH	50	36
CNC(=O)c1ccc(N2CCc3[nH]nc(C(=O)OC)c3C2)c([N+](=O)[O-])c1	ZINC000450825229	FD	On-Demand	Bother	TAAR1	20	43
CCc1cc(N[C@H](C)c2nccn2CC)n2ncnc2n1	ZINC000450825232	CE	On-Demand	Anodyne	DHOD	0	52
C[C@@H]1C[C@@H](Nc2ncnc3ccc(I)cc23)c2nccn21	ZINC000450825245	GH	On-Demand	Anodyne	CD38	60	39
C[C@@H]1C[C@H](Nc2ncnc3ccc(I)cc23)c2nccn21	ZINC000450825250	GH	On-Demand	Anodyne	CD38	60	39
C[C@H]1C[C@@H](Nc2ncnc3ccc(I)cc23)c2nccn21	ZINC000450825252	GH	On-Demand	Anodyne	CD38	60	39
C[C@H]1C[C@H](Nc2ncnc3ccc(I)cc23)c2nccn21	ZINC000450825254	GH	On-Demand	Anodyne	CD38	60	39
CCOC(=O)COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450825276	FE	On-Demand	Anodyne	PRNP	61	41
CCOC(=O)COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450825276	FE	On-Demand	Anodyne	HDAC1	22	40
CCOC(=O)COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450825276	FE	On-Demand	Anodyne	MCHR1	21	41
CCOC(=O)COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450825276	FE	On-Demand	Anodyne	DGAT1	49	41
CCOC(=O)COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450825276	FE	On-Demand	Anodyne	HPGDS	18	40
CCOC(=O)COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450825276	FE	On-Demand	Anodyne	NOD2	42	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825277	EF	On-Demand	Anodyne	TIMP3	67	35
CCOC(=O)[C@H](C)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825277	EF	On-Demand	Anodyne	CAPNS1	43	31
CCOC(=O)[C@H](C)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825277	EF	On-Demand	Anodyne	CAPN2	57	34
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825279	EF	On-Demand	Anodyne	TIMP3	67	35
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825279	EF	On-Demand	Anodyne	CAPNS1	43	31
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825279	EF	On-Demand	Anodyne	CAPN2	57	34
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825281	EF	On-Demand	Anodyne	TIMP3	67	35
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825281	EF	On-Demand	Anodyne	CAPNS1	43	31
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825281	EF	On-Demand	Anodyne	CAPN2	57	34
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825284	EF	On-Demand	Anodyne	TIMP3	67	35
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825284	EF	On-Demand	Anodyne	CAPNS1	43	31
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450825284	EF	On-Demand	Anodyne	CAPN2	57	34
CCn1ccnc1[C@@H](C)Nc1cc(C)nc(-c2cccnc2)n1	ZINC000450825291	DF	On-Demand	Anodyne	ROS1	40	36
CCn1ccnc1[C@H](C)Nc1cc(C)nc(-c2cccnc2)n1	ZINC000450825293	DF	On-Demand	Anodyne	ROS1	40	36
CO[C@@H]1CN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450825297	DC	On-Demand	Bother	TAAR1	23	45
CC(=O)Nc1cccnc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450825332	FF	On-Demand	Anodyne	G2YM83_BOTF4	52	32
CCCOc1ccc(C(=O)NCC2(CCO)CC2)c(OC)c1	ZINC000450825335	DE	On-Demand	Anodyne	KCNA3	40	42
CCCOc1ccc(C(=O)NCC2(CCO)CC2)c(OC)c1	ZINC000450825335	DE	On-Demand	Anodyne	HCN1	57	36
CCCOc1ccc(C(=O)NCC2(CCO)CC2)c(OC)c1	ZINC000450825335	DE	On-Demand	Anodyne	HCN4	54	36
CO[C@@H](Cc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450825340	CD	On-Demand	Anodyne	MME	59	36
CO[C@@H](Cc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450825340	CD	On-Demand	Anodyne	TIMP3	67	36
CO[C@@H](Cc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450825340	CD	On-Demand	Anodyne	AMP1_PLAFQ	51	35
CCn1ccnc1[C@H](C)Nc1ncnc2cc(Cl)ccc12	ZINC000450825344	DH	On-Demand	Anodyne	HRP1_PLAFA	17	40
CCn1ccnc1[C@H](C)Nc1ncnc2cc(Cl)ccc12	ZINC000450825344	DH	On-Demand	Anodyne	RBP_CHICK	0	40
CCn1ccnc1[C@@H](C)Nc1ncnc2cc(Cl)ccc12	ZINC000450825345	DH	On-Demand	Anodyne	HRP1_PLAFA	17	40
CCn1ccnc1[C@@H](C)Nc1ncnc2cc(Cl)ccc12	ZINC000450825345	DH	On-Demand	Anodyne	RBP_CHICK	0	40
CO[C@H](Cc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450825346	CD	On-Demand	Anodyne	MME	59	36
CO[C@H](Cc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450825346	CD	On-Demand	Anodyne	TIMP3	67	36
CO[C@H](Cc1ccccc1)C(=O)NCC1(CCO)CC1	ZINC000450825346	CD	On-Demand	Anodyne	AMP1_PLAFQ	51	35
C[C@@H](O)CCCOc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000450825353	CG	On-Demand	Bother	S1PR4	0	44
C[C@H](O)CCCOc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000450825354	CG	On-Demand	Bother	S1PR4	0	44
C[C@H](c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825360	DH	On-Demand	Anodyne	SIGMAR1	26	40
C[C@H](c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825360	DH	On-Demand	Anodyne	LOC100281352	0	41
C[C@H](c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825360	DH	On-Demand	Anodyne	ZM.86993	0	41
C[C@H](c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825362	DH	On-Demand	Anodyne	SIGMAR1	26	40
C[C@H](c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825362	DH	On-Demand	Anodyne	LOC100281352	0	41
C[C@H](c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825362	DH	On-Demand	Anodyne	ZM.86993	0	41
C[C@@H](c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825364	DH	On-Demand	Anodyne	SIGMAR1	26	40
C[C@@H](c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825364	DH	On-Demand	Anodyne	LOC100281352	0	41
C[C@@H](c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825364	DH	On-Demand	Anodyne	ZM.86993	0	41
C[C@@H](c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825365	DH	On-Demand	Anodyne	SIGMAR1	26	40
C[C@@H](c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825365	DH	On-Demand	Anodyne	LOC100281352	0	41
C[C@@H](c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1)C(F)(F)F	ZINC000450825365	DH	On-Demand	Anodyne	ZM.86993	0	41
CC[C@@H](O)CC(=O)Nc1ccc(C)c(-c2nnnn2C2CC2)c1	ZINC000450825369	DE	On-Demand	Anodyne	SLC1A2	42	32
CC[C@H](O)CC(=O)Nc1ccc(C)c(-c2nnnn2C2CC2)c1	ZINC000450825370	DE	On-Demand	Anodyne	SLC1A2	42	32
COc1cc(CC(=O)NC[C@H]2CC23CCOCC3)ccc1Cl	ZINC000450825371	DF	On-Demand	Anodyne	NCE103	23	44
COc1cc(CC(=O)NC[C@H]2CC23CCOCC3)ccc1Cl	ZINC000450825371	DF	On-Demand	Anodyne	CAN2	0	44
COc1cc(CC(=O)NC[C@@H]2CC23CCOCC3)ccc1Cl	ZINC000450825372	DF	On-Demand	Anodyne	NCE103	23	44
COc1cc(CC(=O)NC[C@@H]2CC23CCOCC3)ccc1Cl	ZINC000450825372	DF	On-Demand	Anodyne	CAN2	0	44
CC(=O)c1cccc(COc2ccc3c(c2)CCCC3=O)c1	ZINC000450825374	CH	On-Demand	Anodyne	MAOA	25	68
CC(=O)c1cccc(COc2ccc3c(c2)CCCC3=O)c1	ZINC000450825374	CH	On-Demand	Anodyne	MAOB	63	68
CC(=O)c1cccc(COc2ccc3c(c2)CCCC3=O)c1	ZINC000450825374	CH	On-Demand	Anodyne	ADAMTS4	29	50
CC(=O)c1cccc(COc2ccc3c(c2)CCCC3=O)c1	ZINC000450825374	CH	On-Demand	Anodyne	FFAR1	40	35
CC(=O)c1ccc(OCCC(C)(F)F)c(C)c1	ZINC000450825397	BH	On-Demand	Anodyne	THRA	0	42
CC(C)[C@H]1OCC[C@@H]1CNC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450825399	DF	On-Demand	Anodyne	MTNR1B	40	37
CC(=O)c1ccc(OCCC(C)(F)F)c(F)c1	ZINC000450825400	BG	On-Demand	Anodyne	THRA	0	43
CC(=O)c1ccc(CN(C)CCCCO)cc1	ZINC000450825401	BE	On-Demand	Anodyne	LTA4H	26	44
O=C(c1cccnc1NCCC1(CO)CC1)N1CCc2ccccc21	ZINC000450825402	EF	On-Demand	Anodyne	AVPR2	42	35
Cc1cc(-c2nnn(C[C@H](C)S(C)(=O)=O)n2)ccc1F	ZINC000450825404	CD	On-Demand	Anodyne	SCARB1	40	32
Cc1cccc([C@@H]2CCN(C(=O)c3nc4ccccc4nc3C3CC3)C2)c1	ZINC000450825426	FI	On-Demand	Anodyne	HPGD	18	45
Cc1cccc([C@H]2CCN(C(=O)c3nc4ccccc4nc3C3CC3)C2)c1	ZINC000450825427	FI	On-Demand	Anodyne	HPGD	18	45
NS(=O)(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)c(C(F)(F)F)c1	ZINC000450825429	GH	On-Demand	Anodyne	HSD11B1	18	40
COc1cccc(OCCC(=O)NCCCNc2cccc(F)c2)c1	ZINC000450825432	EG	On-Demand	Anodyne	HRH2	29	43
COc1cccc(OCCC(=O)NCCCNc2cccc(F)c2)c1	ZINC000450825432	EG	On-Demand	Anodyne	MTNR1A	64	41
COc1cccc(OCCC(=O)NCCCNc2cccc(F)c2)c1	ZINC000450825432	EG	On-Demand	Anodyne	MTNR1B	52	45
COc1cccc(OCCC(=O)NCCCNc2cccc(F)c2)c1	ZINC000450825432	EG	On-Demand	Anodyne	ICMT	29	40
COc1cccc(OCCC(=O)NCCCNc2cccc(F)c2)c1	ZINC000450825432	EG	On-Demand	Anodyne	TBK1	28	57
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450825433	GE	On-Demand	Anodyne	MMP13	65	38
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450825433	GE	On-Demand	Anodyne	ADAM17	57	38
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450825433	GE	On-Demand	Anodyne	MMP3	53	38
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450825433	GE	On-Demand	Anodyne	TGM2	40	33
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450825433	GE	On-Demand	Anodyne	MMP7	56	38
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450825433	GE	On-Demand	Anodyne	MMP1	58	38
COC(=O)c1coc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450825433	GE	On-Demand	Anodyne	F13A1	43	36
CN1[C@H]2CC[C@H]1CC(Nc1cnn(Cc3ccccc3)c(=O)c1Cl)C2	ZINC000450825440	FF	On-Demand	Anodyne	SLC6A1	32	40
CN1[C@H]2CC[C@H]1CC(Nc1cnn(Cc3ccccc3)c(=O)c1Cl)C2	ZINC000450825440	FF	On-Demand	Anodyne	SLC6A3	23	40
CN1[C@H]2CC[C@H]1CC(Nc1cnn(Cc3ccccc3)c(=O)c1Cl)C2	ZINC000450825440	FF	On-Demand	Anodyne	NPBWR1	30	40
CC[C@](C)(O)CN(Cc1ccccc1)Cc1cn(CC2CC2)nn1	ZINC000450825442	EF	On-Demand	Anodyne	HSP90AB1	17	40
CC[C@@](C)(O)CN(Cc1ccccc1)Cc1cn(CC2CC2)nn1	ZINC000450825443	EF	On-Demand	Anodyne	HSP90AB1	17	40
C[C@H](Nc1ccc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450825458	DF	On-Demand	Anodyne	ANPEP	31	44
C[C@H](Nc1ccc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450825458	DF	On-Demand	Anodyne	METAP1	46	39
C[C@H](Nc1ccc(Cl)cn1)C(=O)NCCc1ccccc1	ZINC000450825458	DF	On-Demand	Anodyne	AMP1_PLAFQ	42	44
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1C#N	ZINC000450825460	DD	On-Demand	Mild	AMP1_PLAFQ	26	41
Cc1nc(N[C@@H](C)C(=O)NCCc2ccccc2)sc1C	ZINC000450825461	DF	On-Demand	Anodyne	AMP1_PLAFQ	35	44
C[C@H](Nc1cncc(Br)c1)C(=O)NCCc1ccccc1	ZINC000450825463	EG	On-Demand	Anodyne	ANPEP	31	46
C[C@H](Nc1cncc(Br)c1)C(=O)NCCc1ccccc1	ZINC000450825463	EG	On-Demand	Anodyne	AMP1_PLAFQ	37	46
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	ANPEP	21	41
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	BMP1	45	38
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	CTSL	17	40
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	CAPNS1	45	33
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	HLA-DRB1	57	39
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	CAPN1	58	41
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	CAPN2	91	41
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	NPR	63	33
CCOC(=O)c1csc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825466	ED	On-Demand	Anodyne	AMP1_PLAFQ	33	41
COCc1nc(C)cc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825474	ED	On-Demand	Anodyne	CAPNS1	40	32
COCc1nc(C)cc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825474	ED	On-Demand	Anodyne	CAPN1	47	39
COCc1nc(C)cc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825474	ED	On-Demand	Anodyne	CAPN2	67	39
COCc1nc(C)cc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825474	ED	On-Demand	Anodyne	AMP1_PLAFQ	26	40
O=C(NCCCNc1cccc(F)c1)C1(Cc2ccccc2)CCOCC1	ZINC000450825481	FH	On-Demand	Anodyne	ICMT	41	39
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825489	CD	On-Demand	Anodyne	MTNR1B	29	40
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450825489	CD	On-Demand	Anodyne	AMP1_PLAFQ	35	44
C[C@H](Nc1nnc(C(C)(C)C)s1)C(=O)NCCc1ccccc1	ZINC000450825501	EE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
COC(=O)[C@@H]1C[C@H](O)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450825504	DD	On-Demand	Anodyne	DRD4	0	44
COC(=O)[C@H]1C[C@H](O)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450825506	DD	On-Demand	Anodyne	DRD4	0	44
COC(=O)[C@H]1C[C@@H](O)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450825508	DD	On-Demand	Anodyne	DRD4	0	44
CCc1cc(=N[C@@H](C)C(=O)NCCc2ccccc2)cc[nH]1	ZINC000450825539	CE	On-Demand	Anodyne	AMP1_PLAFQ	32	44
C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450825542	GG	On-Demand	Bother	COLA	72	34
C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450825542	GG	On-Demand	Bother	CARM1	59	36
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(Br)cc1	ZINC000450825544	GI	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(Br)cc1	ZINC000450825544	GI	On-Demand	Anodyne	HTR2A	17	43
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(Br)cc1	ZINC000450825544	GI	On-Demand	Anodyne	HTR2C	17	48
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(Br)cc1	ZINC000450825544	GI	On-Demand	Anodyne	CYP2J2	64	45
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	ANPEP	19	40
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	NQO2	20	40
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	COLA	15	40
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	MTNR1A	63	40
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	MTNR1B	58	37
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	MMP3	27	42
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	MMP9	20	42
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	CAPN2	17	41
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	SPHK1	26	41
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	MMP1	20	42
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	AMP1_PLAFQ	26	40
COc1ccc(-c2noc(N[C@@H](C)C(=O)NCCc3ccccc3)n2)cc1	ZINC000450825545	FE	On-Demand	Anodyne	LUCI_PHOPE	34	40
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(Br)cc1	ZINC000450825546	GI	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(Br)cc1	ZINC000450825546	GI	On-Demand	Anodyne	HTR2A	17	43
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(Br)cc1	ZINC000450825546	GI	On-Demand	Anodyne	HTR2C	17	48
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(Br)cc1	ZINC000450825546	GI	On-Demand	Anodyne	CYP2J2	64	45
CC(=O)c1ccc(C#N)c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450825551	EF	On-Demand	Mild	SDH1	0	40
CC(=O)c1ccc(C#N)c(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450825551	EF	On-Demand	Mild	AMP1_PLAFQ	35	44
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	ADORA1	91	51
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	SLC29A1	30	41
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	ADORA2A	29	48
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	CDK1	28	41
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	ADORA3	113	51
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	OXGR1	93	39
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	AANAT	43	30
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	DNMT3B	61	43
C[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NCCc1ccccc1	ZINC000450825552	FE	On-Demand	Anodyne	DOT1L	54	39
COc1cc(CC(=O)N2CCC[C@@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450825558	GD	On-Demand	Anodyne	OPRK1	22	40
COc1cc(CC(=O)N2CCC[C@@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450825558	GD	On-Demand	Anodyne	CCR1	32	40
COc1cc(CC(=O)N2CCC[C@H](n3cnc(C(N)=O)n3)C2)ccc1Cl	ZINC000450825559	GD	On-Demand	Anodyne	CCR1	32	40
CC[C@@H](O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825561	DG	On-Demand	Anodyne	CACNA1B	56	37
CC[C@@H](O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825561	DG	On-Demand	Anodyne	SLC9A1	39	41
CC[C@@H](O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825561	DG	On-Demand	Anodyne	LIPG	50	35
CC[C@@H](O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825561	DG	On-Demand	Anodyne	ETHR	40	35
CC[C@H](O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825563	DG	On-Demand	Anodyne	CACNA1B	56	37
CC[C@H](O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825563	DG	On-Demand	Anodyne	SLC9A1	39	41
CC[C@H](O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825563	DG	On-Demand	Anodyne	LIPG	50	35
CC[C@H](O)CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825563	DG	On-Demand	Anodyne	ETHR	40	35
CC[C@H](O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825564	DG	On-Demand	Anodyne	CACNA1B	56	37
CC[C@H](O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825564	DG	On-Demand	Anodyne	SLC9A1	39	41
CC[C@H](O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825564	DG	On-Demand	Anodyne	LIPG	50	35
CC[C@H](O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825564	DG	On-Demand	Anodyne	ETHR	40	35
CC[C@@H](O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825565	DG	On-Demand	Anodyne	CACNA1B	56	37
CC[C@@H](O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825565	DG	On-Demand	Anodyne	SLC9A1	39	41
CC[C@@H](O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825565	DG	On-Demand	Anodyne	LIPG	50	35
CC[C@@H](O)CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450825565	DG	On-Demand	Anodyne	ETHR	40	35
O=C(CCCN1CCc2ncsc2C1)c1ccc(F)cc1	ZINC000450825575	DG	On-Demand	Anodyne	DRD2	30	45
O=C(CCCN1CCc2ncsc2C1)c1ccc(F)cc1	ZINC000450825575	DG	On-Demand	Anodyne	CYP2J2	47	33
OC[C@@H]1CCCN(c2cc(NCCC3(CO)CC3)ncn2)C1	ZINC000450825578	DD	On-Demand	Anodyne	PRCP	0	40
OC[C@H]1CCCN(c2cc(NCCC3(CO)CC3)ncn2)C1	ZINC000450825580	DD	On-Demand	Anodyne	PRCP	0	40
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCCC(=O)c1ccc(F)cc1	ZINC000450825591	EG	On-Demand	Anodyne	DRD4	0	43
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCCC(=O)c1ccc(F)cc1	ZINC000450825592	EG	On-Demand	Anodyne	DRD4	0	43
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCCC(=O)c1ccc(F)cc1	ZINC000450825593	EG	On-Demand	Anodyne	DRD4	0	43
COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCC(=O)c1ccc(F)cc1	ZINC000450825594	EG	On-Demand	Anodyne	DRD4	0	43
CCCNC(=O)c1ccc(N2C[C@@H](O)[C@H](OC)C2)nc1	ZINC000450825596	CC	On-Demand	Anodyne	HDAC1	0	41
COC(=O)c1n[nH]c2c1CN(c1ncccc1C(F)(F)F)CC2	ZINC000450825637	EE	On-Demand	Anodyne	TRPV1	40	45
CCC[C@H](CC(C)C)C(=O)N[C@H](C)[C@H](C)C(=O)OCC	ZINC000450825638	CG	On-Demand	Anodyne	NPR	16	41
CCC[C@H](CC(C)C)C(=O)N[C@@H](C)[C@@H](C)C(=O)OCC	ZINC000450825639	CG	On-Demand	Anodyne	NPR	16	41
CCC[C@H](CC(C)C)C(=O)N[C@@H](C)[C@H](C)C(=O)OCC	ZINC000450825640	CG	On-Demand	Anodyne	NPR	16	41
CCC[C@H](CC(C)C)C(=O)N[C@H](C)[C@@H](C)C(=O)OCC	ZINC000450825641	CG	On-Demand	Anodyne	NPR	16	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cccc2c1CCCC2	ZINC000450825695	DF	On-Demand	Anodyne	CCR3	0	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cccc2c1CCCC2	ZINC000450825697	DF	On-Demand	Anodyne	CCR3	0	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cccc2c1CCCC2	ZINC000450825698	DF	On-Demand	Anodyne	CCR3	0	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cccc2c1CCCC2	ZINC000450825699	DF	On-Demand	Anodyne	CCR3	0	41
CCc1cc(CCCSc2nnc(-c3ccc(C(C)C)cc3)o2)on1	ZINC000450825707	FK	On-Demand	Anodyne	TYMS	0	44
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450825715	EG	On-Demand	Anodyne	TIMP3	63	36
CCOC(=O)[C@H](C)[C@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450825717	EG	On-Demand	Anodyne	TIMP3	63	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450825719	EG	On-Demand	Anodyne	TIMP3	63	36
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450825720	EG	On-Demand	Anodyne	TIMP3	63	36
COc1ccccc1Cc1nnc(SCC2=CCCCC2)o1	ZINC000450825754	DI	On-Demand	Anodyne	PTK2	23	49
CCC(CC)(CCSc1nnc(Cc2ccccc2F)o1)C(=O)OC	ZINC000450825765	FI	On-Demand	Anodyne	PTK2	0	41
CC[C@@H]1CN(CC)CCN1c1ncc(C#N)cc1Cl	ZINC000450825784	CF	On-Demand	Mild	CXCR3	15	49
CC[C@H]1CN(CC)CCN1c1ncc(C#N)cc1Cl	ZINC000450825785	CF	On-Demand	Mild	CXCR3	15	49
Cc1ccc(C(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)c2c1CCC2	ZINC000450825788	EH	On-Demand	Anodyne	L3MBTL3	70	39
Cc1ccc(C(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)c2c1CCC2	ZINC000450825789	EH	On-Demand	Anodyne	L3MBTL3	70	39
COc1cc([N+](=O)[O-])ccc1OC[C@H](Cc1ccccc1)OC	ZINC000450825795	DG	On-Demand	Bother	CYP19A1	15	42
COc1cc([N+](=O)[O-])ccc1OC[C@@H](Cc1ccccc1)OC	ZINC000450825796	DG	On-Demand	Bother	CYP19A1	15	42
Cc1ccn2ncc(C(=O)NCC3(CCO)CC3)c2c1	ZINC000450825808	CD	On-Demand	Anodyne	EPHB3	36	52
Cc1ccn2ncc(C(=O)NCC3(CCO)CC3)c2c1	ZINC000450825808	CD	On-Demand	Anodyne	HCN1	49	31
Cc1ccn2ncc(C(=O)NCC3(CCO)CC3)c2c1	ZINC000450825808	CD	On-Demand	Anodyne	HCN4	47	31
COc1cc(CC(=O)N2CCOC[C@H]2c2nc(C)cs2)ccc1Cl	ZINC000450825831	FG	On-Demand	Anodyne	OPRK1	41	41
COc1cccc(OCCC(=O)NCC2(CO)CCC2)c1	ZINC000450825835	CD	On-Demand	Anodyne	MTNR1A	47	42
COc1cccc(OCCC(=O)NCC2(CO)CCC2)c1	ZINC000450825835	CD	On-Demand	Anodyne	MTNR1B	45	39
COc1cc(CC(=O)N2CCOC[C@@H]2c2nc(C)cs2)ccc1Cl	ZINC000450825839	FG	On-Demand	Anodyne	OPRK1	41	41
CC(F)(F)CCn1c(-c2ccccc2)noc1=O	ZINC000450825841	CF	On-Demand	Anodyne	GRM7	64	34
CNC(=O)c1cccnc1N1CC(c2cccc(Cl)c2)C1	ZINC000450825845	DF	On-Demand	Anodyne	G2YM83_BOTF4	53	35
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CSC1CC1	ZINC000450825852	ED	On-Demand	Anodyne	SIGMAR1	46	41
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)CSC1CC1	ZINC000450825852	ED	On-Demand	Anodyne	NPFFR1	47	34
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CSC1CC1	ZINC000450825853	ED	On-Demand	Anodyne	SIGMAR1	46	41
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)CSC1CC1	ZINC000450825853	ED	On-Demand	Anodyne	NPFFR1	47	34
CCS(=O)(=O)c1ccc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1	ZINC000450825877	GH	On-Demand	Bother	CYP19A1	16	51
CC(=O)N[C@H](C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1)C(C)(C)C	ZINC000450825880	GD	On-Demand	Anodyne	NPFFR1	48	34
CC(=O)N[C@H](C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1)C(C)(C)C	ZINC000450825882	GD	On-Demand	Anodyne	NPFFR1	48	34
COC(=O)COc1ccc(N(C)C(=O)c2ccc(C3CC3)nc2C)cc1	ZINC000450825892	FG	On-Demand	Anodyne	MLNR	25	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)cc1	ZINC000450825893	GI	On-Demand	Anodyne	L3MBTL1	0	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)cc1	ZINC000450825893	GI	On-Demand	Anodyne	L3MBTL3	61	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)cc1	ZINC000450825894	GI	On-Demand	Anodyne	L3MBTL1	0	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)cc1	ZINC000450825894	GI	On-Demand	Anodyne	L3MBTL3	61	40
CCc1cc(CCCn2c([N+](=O)[O-])cnc2C)on1	ZINC000450825906	CE	On-Demand	Bother	TYMS	36	41
COC(=O)c1ccc(CN2CCN(CC(C)(C)O)[C@H](C)C2)cc1Cl	ZINC000450825928	FE	On-Demand	Anodyne	DRD4	32	42
COC(=O)c1ccc(CN2CCN(CC(C)(C)O)[C@@H](C)C2)cc1Cl	ZINC000450825929	FE	On-Demand	Anodyne	DRD4	32	42
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000450825953	FE	On-Demand	Bother	NPR	38	40
CC(=O)c1cccc(CSc2nnc(-c3c(C)cc(C)cc3C)o2)c1	ZINC000450825957	FK	On-Demand	Anodyne	GSK3B	18	47
CC(=O)c1cccc(CSc2nnc(-c3c(C)cc(C)cc3C)o2)c1	ZINC000450825957	FK	On-Demand	Anodyne	GSK3A	51	44
Cc1[nH]c(C#N)cc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450825962	FD	On-Demand	Mild	NPFFR1	50	34
Cc1[nH]c(C#N)cc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450825965	FD	On-Demand	Mild	NPFFR1	50	34
CN1CCN(S(=O)(=O)c2ccc(NCCC3(CO)CC3)c([N+](=O)[O-])c2)CC1	ZINC000450825969	GD	On-Demand	Bother	BCL2L1	21	41
CN1CCN(S(=O)(=O)c2ccc(NCCC3(CO)CC3)c([N+](=O)[O-])c2)CC1	ZINC000450825969	GD	On-Demand	Bother	BCL2	16	41
CC(C)c1nccc(N2CC(c3cccc(Cl)c3)C2)n1	ZINC000450825970	CH	On-Demand	Anodyne	SORD	60	39
Cc1cc(F)c(CC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1F	ZINC000450825986	GF	On-Demand	Anodyne	NPFFR1	45	32
COc1nc(C)nc(N[C@@H](C)C(=O)NCCc2ccccc2)c1C	ZINC000450825988	EE	On-Demand	Anodyne	AMP1_PLAFQ	27	41
Cc1cc(F)c(CC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1F	ZINC000450825991	GF	On-Demand	Anodyne	NPFFR1	45	32
Cc1cc(=N[C@@H](C)C(=O)NCCc2ccccc2)cc(C#N)[nH]1	ZINC000450825992	DD	On-Demand	Mild	AMP1_PLAFQ	31	42
Cc1cccc(N[C@@H](C)C(=O)NCCc2ccccc2)c1[N+](=O)[O-]	ZINC000450825994	EG	On-Demand	Bother	AMP1_PLAFQ	27	42
OC[C@H]1C[C@H](F)CN1Cc1ccn(CCc2ccccc2)n1	ZINC000450826001	DE	On-Demand	Anodyne	SPHK2	48	32
OC[C@H]1C[C@@H](F)CN1Cc1ccn(CCc2ccccc2)n1	ZINC000450826003	DE	On-Demand	Anodyne	SPHK2	48	32
OC[C@@H]1C[C@H](F)CN1Cc1ccn(CCc2ccccc2)n1	ZINC000450826004	DE	On-Demand	Anodyne	SPHK2	48	32
OC[C@@H]1C[C@@H](F)CN1Cc1ccn(CCc2ccccc2)n1	ZINC000450826005	DE	On-Demand	Anodyne	SPHK2	48	32
C[C@H](Nc1cc(N2CCCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826015	EE	On-Demand	Anodyne	MME	24	41
C[C@H](Nc1cc(N2CCCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826015	EE	On-Demand	Anodyne	KCNQ2	55	33
C[C@H](Nc1cc(N2CCCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826015	EE	On-Demand	Anodyne	AMP1_PLAFQ	37	41
C[C@H](Nc1cc(N2CCCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826015	EE	On-Demand	Anodyne	XIAP	22	42
C[C@H](Nc1cc(N2CCCC2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826015	EE	On-Demand	Anodyne	BIRC2	43	37
COc1cc(CN[C@H]2CCCC[C@H]2n2cc(CO)nn2)ccc1Cl	ZINC000450826016	FF	On-Demand	Anodyne	SSTR3	0	44
C[C@H](Nc1ccc2nncn2n1)C(=O)NCCc1ccccc1	ZINC000450826018	DC	On-Demand	Anodyne	AMP1_PLAFQ	26	41
C[C@H](Nc1ncccc1C(F)(F)F)C(=O)NCCc1ccccc1	ZINC000450826020	EG	On-Demand	Anodyne	AMP1_PLAFQ	27	42
C[C@H](Nc1ncccc1C(F)(F)F)C(=O)NCCc1ccccc1	ZINC000450826020	EG	On-Demand	Anodyne	CARM1	47	35
CC(C)c1nc(=N[C@@H](C)C(=O)NCCc2ccccc2)o[nH]1	ZINC000450826027	DD	On-Demand	Anodyne	AMP1_PLAFQ	39	44
COC(=O)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450826028	FD	On-Demand	Bother	GSTM2	41	34
COC(=O)c1cnc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450826028	FD	On-Demand	Bother	COLA	62	34
CC(C)(CC(=O)COc1cc(F)ccc1F)C1CC1	ZINC000450826037	CH	On-Demand	Anodyne	SDH1	0	41
OCC1(CCNc2ncnc3sc(-c4ccccc4)cc23)CC1	ZINC000450826042	EH	On-Demand	Anodyne	FDPS	15	40
C[C@H](Nc1nc(-c2cccnc2)nc2c1CCC2)C(=O)NCCc1ccccc1	ZINC000450826048	GF	On-Demand	Anodyne	PDE4B	18	44
C[C@H](Nc1nc(-c2cccnc2)nc2c1CCC2)C(=O)NCCc1ccccc1	ZINC000450826048	GF	On-Demand	Anodyne	BRS3	21	41
Cc1nn(C)c(N[C@@H](C)C(=O)NCCc2ccccc2)c1[N+](=O)[O-]	ZINC000450826058	ED	On-Demand	Bother	AMP1_PLAFQ	22	40
COC(=O)c1ccccc1C(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450826071	GG	On-Demand	Bother	TAAR1	17	42
O=C(c1cccnc1N1CC(c2ccc(Cl)cc2)C1)N1CCCCC1	ZINC000450826073	FH	On-Demand	Anodyne	SCN2A	17	40
O=C(c1cccnc1N1CC(c2ccc(Cl)cc2)C1)N1CCCCC1	ZINC000450826073	FH	On-Demand	Anodyne	FAAH	32	45
O=C(c1cccnc1N1CC(c2ccc(Cl)cc2)C1)N1CCCCC1	ZINC000450826073	FH	On-Demand	Anodyne	SLC6A7	0	44
Cc1ccc(C#N)c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450826074	DE	On-Demand	Mild	SDH1	0	40
Cc1ccc(C#N)c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450826074	DE	On-Demand	Mild	AMP1_PLAFQ	26	41
C[C@H](Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450826077	GE	On-Demand	Bother	COLA	56	35
C[C@H](N=c1[nH]nc(C(F)F)o1)C(=O)NCCc1ccccc1	ZINC000450826078	DD	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	MME	53	41
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	ANPEP	40	33
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	SDH1	0	40
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	CPA1	23	40
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	SLC15A1	0	41
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	BRS3	23	41
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	MTNR1A	28	44
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	MTNR1B	45	44
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	CES1	52	34
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	CAPN2	54	38
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	ACE2	42	35
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	POL	0	47
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	NPR	45	40
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	AMP1_PLAFQ	56	51
C[C@H](Nc1ncccn1)C(=O)NCCc1ccccc1	ZINC000450826080	CD	On-Demand	Anodyne	CES1D	43	31
COC(=O)c1cncc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450826087	ED	On-Demand	Anodyne	AMP1_PLAFQ	27	41
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826098	DH	On-Demand	Anodyne	DRD2	34	48
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826098	DH	On-Demand	Anodyne	DRD1	24	51
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826098	DH	On-Demand	Anodyne	DRD4	28	49
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826098	DH	On-Demand	Anodyne	HTR2A	37	55
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826098	DH	On-Demand	Anodyne	HTR2C	27	63
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826098	DH	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826098	DH	On-Demand	Anodyne	SLC18A3	0	47
O=C(CCCN1CCC([C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826098	DH	On-Demand	Anodyne	CYP2J2	64	45
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826099	DH	On-Demand	Anodyne	DRD2	34	48
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826099	DH	On-Demand	Anodyne	DRD1	24	51
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826099	DH	On-Demand	Anodyne	DRD4	28	49
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826099	DH	On-Demand	Anodyne	HTR2A	37	55
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826099	DH	On-Demand	Anodyne	HTR2C	27	63
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826099	DH	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826099	DH	On-Demand	Anodyne	SLC18A3	0	47
O=C(CCCN1CCC([C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000450826099	DH	On-Demand	Anodyne	CYP2J2	64	45
COc1ccc(C2(CNC(=O)[C@@H](O)C3CCC3)CCC2)cc1	ZINC000450826105	DE	On-Demand	Anodyne	KCNA3	39	41
COc1ccc(C2(CNC(=O)[C@@H](O)C3CCC3)CCC2)cc1	ZINC000450826105	DE	On-Demand	Anodyne	MTNR1A	22	44
COc1ccc(C2(CNC(=O)[C@@H](O)C3CCC3)CCC2)cc1	ZINC000450826105	DE	On-Demand	Anodyne	ACAT	0	52
COc1ccc(C2(CNC(=O)[C@H](O)C3CCC3)CCC2)cc1	ZINC000450826106	DE	On-Demand	Anodyne	KCNA3	39	41
COc1ccc(C2(CNC(=O)[C@H](O)C3CCC3)CCC2)cc1	ZINC000450826106	DE	On-Demand	Anodyne	MTNR1A	22	44
COc1ccc(C2(CNC(=O)[C@H](O)C3CCC3)CCC2)cc1	ZINC000450826106	DE	On-Demand	Anodyne	ACAT	0	52
C[C@H](Nc1ncccc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450826111	DE	On-Demand	Bother	PPIA	39	40
C[C@H](Nc1ncccc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450826111	DE	On-Demand	Bother	AMP1_PLAFQ	26	41
C[C@H](Nc1ncc(Br)cn1)C(=O)NCCc1ccccc1	ZINC000450826116	EE	On-Demand	Anodyne	MME	40	38
C[C@H](Nc1ncc(Br)cn1)C(=O)NCCc1ccccc1	ZINC000450826116	EE	On-Demand	Anodyne	ANPEP	41	50
C[C@H](Nc1ncc(Br)cn1)C(=O)NCCc1ccccc1	ZINC000450826116	EE	On-Demand	Anodyne	FAAH	45	36
C[C@H](Nc1ncc(Br)cn1)C(=O)NCCc1ccccc1	ZINC000450826116	EE	On-Demand	Anodyne	AMP1_PLAFQ	49	50
C[C@H](Nc1ncc(Br)cn1)C(=O)NCCc1ccccc1	ZINC000450826116	EE	On-Demand	Anodyne	CES1D	44	32
O=S(=O)(c1ccc(NCCC2(CO)CC2)nc1)N1CCCCC1	ZINC000450826121	ED	On-Demand	Anodyne	NAMPT	23	40
CCOC(=O)[C@H](CC)N(Cc1ccc(S(=O)(=O)CC)cc1)C1CC1	ZINC000450826122	FF	On-Demand	Anodyne	RORC	18	40
CCOC(=O)[C@@H](CC)N(Cc1ccc(S(=O)(=O)CC)cc1)C1CC1	ZINC000450826123	FF	On-Demand	Anodyne	RORC	18	40
C[C@H](N=c1c(Br)c[nH]cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450826124	GE	On-Demand	Bother	ANPEP	16	41
C[C@H](N=c1c(Br)c[nH]cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450826124	GE	On-Demand	Bother	COLA	98	36
C[C@H](N=c1c(Br)c[nH]cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450826124	GE	On-Demand	Bother	AMP1_PLAFQ	30	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450826135	GD	On-Demand	Anodyne	RHODESAIN	0	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450826136	GD	On-Demand	Anodyne	RHODESAIN	0	40
CCOC(=O)c1c[nH]c2ccccc2c1=NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000450826139	EF	On-Demand	Anodyne	SLC6A1	36	40
CCOC(=O)c1c[nH]c2ccccc2c1=NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000450826139	EF	On-Demand	Anodyne	GLRA1	56	42
O=C1NC(C2CC2)(C2CC2)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450826158	DF	On-Demand	Anodyne	CACNA1C	25	42
O=C1NC(C2CC2)(C2CC2)C(=O)N1CCc1ccc(Cl)cc1	ZINC000450826158	DF	On-Demand	Anodyne	CACNA1D	76	45
CO[C@@H]1CN(c2c(C)cnc3c(C)cccc23)C[C@H]1O	ZINC000450826174	CE	On-Demand	Anodyne	ATP4A	18	40
COC(=O)c1n[nH]c2c1CN(c1cnn(Cc3ccccc3)c(=O)c1Cl)CC2	ZINC000450826189	GE	On-Demand	Anodyne	MRGPRX1	38	41
COc1ccc(-c2nc(S[C@H](C)C(=O)C3CCCCC3)n[nH]2)c(OC)c1	ZINC000450826197	GI	On-Demand	Anodyne	PDE7A	43	34
COc1ccc(-c2nc(S[C@@H](C)C(=O)C3CCCCC3)n[nH]2)c(OC)c1	ZINC000450826205	GI	On-Demand	Anodyne	PDE7A	43	34
COC(=O)c1n[nH]c2c1CN(c1nc3ccc(OC)cc3nc1C)CC2	ZINC000450826211	FE	On-Demand	Anodyne	DRD4	40	31
CCCOc1cccc(CSc2nnc(Cc3cccc(OC)c3)o2)c1	ZINC000450826225	FJ	On-Demand	Anodyne	CPB	0	52
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826238	EF	On-Demand	Anodyne	TRPV1	34	40
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826238	EF	On-Demand	Anodyne	NCE103	28	41
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826238	EF	On-Demand	Anodyne	CAN2	0	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826239	EF	On-Demand	Anodyne	TRPV1	34	40
CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826239	EF	On-Demand	Anodyne	NCE103	28	41
CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826239	EF	On-Demand	Anodyne	CAN2	0	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826240	EF	On-Demand	Anodyne	TRPV1	34	40
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826240	EF	On-Demand	Anodyne	NCE103	28	41
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826240	EF	On-Demand	Anodyne	CAN2	0	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826241	EF	On-Demand	Anodyne	TRPV1	34	40
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826241	EF	On-Demand	Anodyne	NCE103	28	41
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450826241	EF	On-Demand	Anodyne	CAN2	0	41
CO[C@@H]1CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@H]1O	ZINC000450826246	DC	On-Demand	Bother	MAPK13	41	33
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cc2n(n1)CCCC2	ZINC000450826264	CD	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cc2n(n1)CCCC2	ZINC000450826265	CD	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cc2n(n1)CCCC2	ZINC000450826266	CD	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cc2n(n1)CCCC2	ZINC000450826267	CD	On-Demand	Anodyne	P2RY12	46	36
COC(=O)c1n[nH]c2c1CN(c1nn3c(C)nnc3c3ccccc13)CC2	ZINC000450826268	FD	On-Demand	Anodyne	CREBBP	44	35
COC(=O)c1n[nH]c2c1CN(c1nn3c(C)nnc3c3ccccc13)CC2	ZINC000450826268	FD	On-Demand	Anodyne	BRD9	56	35
CC1(C)CCN(c2ncnc3scc(-c4ccccc4)c23)CC[S@]1=O	ZINC000450826290	FI	On-Demand	Anodyne	ADRB3	31	49
CC1(C)CCN(c2ncnc3scc(-c4ccccc4)c23)CC[S@@]1=O	ZINC000450826292	FI	On-Demand	Anodyne	ADRB3	31	49
CCO[C@@H]1C[C@@](CO)(NC[C@@H](Cc2ccccc2)OC)C1(C)C	ZINC000450826301	DE	On-Demand	Anodyne	TIMP3	56	33
CCO[C@@H]1C[C@@](CO)(NC[C@H](Cc2ccccc2)OC)C1(C)C	ZINC000450826302	DE	On-Demand	Anodyne	TIMP3	56	33
CCO[C@@H]1C[C@](CO)(NC[C@H](Cc2ccccc2)OC)C1(C)C	ZINC000450826304	DE	On-Demand	Anodyne	TIMP3	56	33
CCO[C@@H]1C[C@](CO)(NC[C@@H](Cc2ccccc2)OC)C1(C)C	ZINC000450826305	DE	On-Demand	Anodyne	TIMP3	56	33
CC(C)c1ccc(-c2nnc(SCC[C@@H](C)O)o2)cc1	ZINC000450826366	CH	On-Demand	Anodyne	TYMS	0	50
CC(C)c1ccc(-c2nnc(SCC[C@H](C)O)o2)cc1	ZINC000450826367	CH	On-Demand	Anodyne	TYMS	0	50
CC(C)c1ccc(-c2nnc(SCC[C@H](C)O)o2)cc1	ZINC000450826367	CH	On-Demand	Anodyne	GSK3A	41	39
CCS(=O)(=O)c1ccc(CSc2nnc(-c3ccc(C)cc3C)o2)cc1	ZINC000450826382	GI	On-Demand	Anodyne	GSK3A	52	38
CCS(=O)(=O)c1ccc(CSc2nnc(-c3ccc(C)cc3C)o2)cc1	ZINC000450826382	GI	On-Demand	Anodyne	TERT	25	47
CCNC(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)nc1	ZINC000450826389	DG	On-Demand	Anodyne	HDAC1	22	41
CCN(CC)S(=O)(=O)c1ccc(NC[C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450826390	GF	On-Demand	Bother	BDKRB1	24	45
Nc1ncccc1CN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000450826399	GF	On-Demand	Anodyne	PTGDR2	17	52
Nc1ncccc1CN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000450826399	GF	On-Demand	Anodyne	GPR183	0	40
CCCOc1cccc(Cn2c(C)csc2=O)c1	ZINC000450826440	CG	On-Demand	Anodyne	UPP1	44	39
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA2	30	47
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	PTGS2	25	47
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA1	32	46
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA7	23	43
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CTSF	41	36
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	COLA	46	33
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA5B	34	46
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA4	23	47
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA5A	34	46
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA14	23	40
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	MMP3	44	37
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA12	24	44
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	CA9	24	40
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	AMP1_PLAFQ	36	46
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	NCE103	25	50
C[C@H](Nc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000450826441	EE	On-Demand	Anodyne	LIMK2	40	38
C[C@H](N=c1cc[nH]cc1Cl)C(=O)NCCc1ccccc1	ZINC000450826444	DE	On-Demand	Anodyne	ANPEP	23	43
C[C@H](N=c1cc[nH]cc1Cl)C(=O)NCCc1ccccc1	ZINC000450826444	DE	On-Demand	Anodyne	AMP1_PLAFQ	34	43
CCOC(=O)[C@@H](C)N(C[C@H](Cc1ccccc1)OC)C1CC1	ZINC000450826448	DF	On-Demand	Anodyne	TIMP3	45	33
CCOC(=O)[C@@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CC1	ZINC000450826449	DF	On-Demand	Anodyne	TIMP3	45	33
CCOC(=O)[C@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CC1	ZINC000450826450	DF	On-Demand	Anodyne	TIMP3	45	33
CCOC(=O)[C@H](C)N(C[C@H](Cc1ccccc1)OC)C1CC1	ZINC000450826451	DF	On-Demand	Anodyne	TIMP3	45	33
COc1ccc(-c2csc3ncnc(NCCC4(CO)CC4)c23)cc1	ZINC000450826452	FH	On-Demand	Anodyne	ADRB3	22	41
C[C@H](Nc1nc(-c2ccccn2)nc2c1CCC2)C(=O)NCCc1ccccc1	ZINC000450826457	GF	On-Demand	Anodyne	METAP1	55	45
C[C@H](Nc1nc(-c2ccccn2)nc2c1CCC2)C(=O)NCCc1ccccc1	ZINC000450826457	GF	On-Demand	Anodyne	BCHE	51	33
OCC1(CCNc2ccnc3cc(C(F)(F)F)ccc23)CC1	ZINC000450826476	DH	On-Demand	Anodyne	HRP1_PLAFA	78	34
CSc1cccc(C(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)c1	ZINC000450826478	EH	On-Demand	Anodyne	L3MBTL1	0	41
CSc1cccc(C(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)c1	ZINC000450826478	EH	On-Demand	Anodyne	L3MBTL3	59	41
CCOC(=O)c1ccc(CN2CCN(c3c(C#N)c(C)nn3C)CC2)nc1	ZINC000450826486	FD	On-Demand	Mild	P2RY12	47	41
CSc1cccc(C(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)c1	ZINC000450826488	EH	On-Demand	Anodyne	L3MBTL1	0	41
CSc1cccc(C(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)c1	ZINC000450826488	EH	On-Demand	Anodyne	L3MBTL3	59	41
C[C@H](Nc1ccc(C(=O)N(C)C)cn1)C(=O)NCCc1ccccc1	ZINC000450826492	ED	On-Demand	Anodyne	AMP1_PLAFQ	27	42
COC(=O)COc1ccc(N(C)C(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450826498	FE	On-Demand	Anodyne	MLNR	40	40
CO[C@@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1O	ZINC000450826510	CD	On-Demand	Anodyne	PDE3A	48	37
CO[C@@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1O	ZINC000450826510	CD	On-Demand	Anodyne	PDGFRB	28	43
CO[C@@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1O	ZINC000450826510	CD	On-Demand	Anodyne	PDE3B	72	37
CO[C@@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1O	ZINC000450826510	CD	On-Demand	Anodyne	HTT	0	40
CCN(Cc1nc(C(=O)OC)cs1)Cc1c[nH]c2ccccc12	ZINC000450826526	EG	On-Demand	Anodyne	TACR1	40	40
CCN(Cc1nc(C(=O)OC)cs1)Cc1c[nH]c2ccccc12	ZINC000450826526	EG	On-Demand	Anodyne	GHSR	56	35
C[C@H](Nc1ccc(C(F)(F)F)nn1)C(=O)NCCc1ccccc1	ZINC000450826535	EE	On-Demand	Anodyne	ANPEP	17	43
C[C@H](Nc1ccc(C(F)(F)F)nn1)C(=O)NCCc1ccccc1	ZINC000450826535	EE	On-Demand	Anodyne	AMP1_PLAFQ	30	43
C[C@H](Nc1ccc(C(F)(F)F)nn1)C(=O)NCCc1ccccc1	ZINC000450826535	EE	On-Demand	Anodyne	CARM1	71	39
Cc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncc1[N+](=O)[O-]	ZINC000450826537	EE	On-Demand	Bother	COLA	71	34
CN(C)C(=O)Cn1nc2n(c1=O)CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450826540	GC	On-Demand	Anodyne	DRD2	29	40
CN(C)C(=O)Cn1nc2n(c1=O)CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450826540	GC	On-Demand	Anodyne	DRD4	0	40
CN(C)C(=O)Cn1nc2n(c1=O)CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450826540	GC	On-Demand	Anodyne	HTR2A	17	46
CN(C)C(=O)Cn1nc2n(c1=O)CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450826540	GC	On-Demand	Anodyne	SLC18A3	0	40
CN(C)C(=O)Cn1nc2n(c1=O)CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450826540	GC	On-Demand	Anodyne	HTR3B	0	44
COCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450826547	ED	On-Demand	Anodyne	DRD2	32	43
COCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450826547	ED	On-Demand	Anodyne	DRD1	0	49
COCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450826547	ED	On-Demand	Anodyne	DRD4	0	43
COCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450826547	ED	On-Demand	Anodyne	SLC18A3	0	44
COCCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450826547	ED	On-Demand	Anodyne	CYP2J2	47	34
COc1cc(CC(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)ccc1O	ZINC000450826553	FE	On-Demand	Anodyne	RORC	43	35
COc1cc(CC(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)ccc1O	ZINC000450826558	FE	On-Demand	Anodyne	RORC	43	35
COc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])cc1F	ZINC000450826570	FF	On-Demand	Bother	COLA	54	36
OCC1(CCNc2nc(-c3ccccn3)nc3c2CCC3)CC1	ZINC000450826572	DE	On-Demand	Anodyne	METAP1	27	42
CNC(=O)c1ccc(NC2(Cc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1	ZINC000450826581	EG	On-Demand	Bother	TAAR1	17	42
C[C@H](N=c1cncc[nH]1)C(=O)NCCc1ccccc1	ZINC000450826583	CD	On-Demand	Anodyne	BRS3	24	42
C[C@H](N=c1cncc[nH]1)C(=O)NCCc1ccccc1	ZINC000450826583	CD	On-Demand	Anodyne	AMP1_PLAFQ	31	43
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)NCCc1ccccc1	ZINC000450826599	EE	On-Demand	Anodyne	ANPEP	18	43
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)NCCc1ccccc1	ZINC000450826599	EE	On-Demand	Anodyne	AMP1_PLAFQ	30	43
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)NCCc1ccccc1	ZINC000450826599	EE	On-Demand	Anodyne	CARM1	48	37
CCOC(=O)[C@H](C)[C@@H](C)NC(=O)c1cccc(CC)n1	ZINC000450826638	CD	On-Demand	Anodyne	PDE5A	28	42
CCOC(=O)[C@H](C)[C@H](C)NC(=O)c1cccc(CC)n1	ZINC000450826640	CD	On-Demand	Anodyne	PDE5A	28	42
CCOC(=O)[C@@H](C)[C@H](C)NC(=O)c1cccc(CC)n1	ZINC000450826641	CD	On-Demand	Anodyne	PDE5A	28	42
CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)c1cccc(CC)n1	ZINC000450826643	CD	On-Demand	Anodyne	PDE5A	28	42
CC(=O)NC1CCC(N(C)C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450826662	GE	On-Demand	Anodyne	PYGL	28	45
CC(=O)NC1CCC(N(C)C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450826662	GE	On-Demand	Anodyne	EPHX2	18	48
CC(=O)NC1CCC(N(C)C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450826662	GE	On-Demand	Anodyne	PSBA	0	43
O=C(NCCCNc1cccc(F)c1)c1ccc(N2CCC2)nc1	ZINC000450826667	EF	On-Demand	Anodyne	TBK1	33	42
O=C(NCCCNc1cccc(F)c1)c1ccc(N2CCC2)nc1	ZINC000450826667	EF	On-Demand	Anodyne	DGAT1	25	42
O=C(NCCCNc1cccc(F)c1)c1ccc(N2CCC2)nc1	ZINC000450826667	EF	On-Demand	Anodyne	HPGDS	28	43
CC(F)(F)CCn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O	ZINC000450826670	DF	On-Demand	Bother	F2RL3	43	31
C[C@H](Nc1ccc(S(=O)(=O)C(C)(C)C)nc1)C(=O)NCCc1ccccc1	ZINC000450826690	GF	On-Demand	Anodyne	AMP1_PLAFQ	26	40
COC(=O)c1csc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450826696	FG	On-Demand	Anodyne	COLA	47	41
COC(=O)c1csc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450826696	FG	On-Demand	Anodyne	CPT1A	32	41
COC(=O)c1csc(COc2ccc(-c3noc(C4CC4)n3)cc2)n1	ZINC000450826696	FG	On-Demand	Anodyne	ETHR	52	38
CC[C@@H]1CN(CC)CCN1c1ccc(C#N)cn1	ZINC000450826699	BD	On-Demand	Mild	SMO	0	43
CC[C@H]1CN(CC)CCN1c1ccc(C#N)cn1	ZINC000450826700	BD	On-Demand	Mild	SMO	0	43
CN(C)C(=O)c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1	ZINC000450826712	FH	On-Demand	Anodyne	P2RY12	25	40
CN(C)C(=O)c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1	ZINC000450826712	FH	On-Demand	Anodyne	CXCR3	35	41
CC1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCC(=O)CC1	ZINC000450826724	FI	On-Demand	Anodyne	CACNA1B	50	38
CC1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCC(=O)CC1	ZINC000450826724	FI	On-Demand	Anodyne	CCR2	70	46
CC1(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CCC(=O)CC1	ZINC000450826724	FI	On-Demand	Anodyne	RBP4	26	41
C[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)NCCc1ccccc1	ZINC000450826729	GE	On-Demand	Anodyne	DHOD	0	48
C[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)NCCc1ccccc1	ZINC000450826729	GE	On-Demand	Anodyne	CARM1	81	40
CCOC(=O)[C@H](C)N(CCCC(=O)c1ccccc1)C1CC1	ZINC000450826730	DG	On-Demand	Anodyne	AMY2	47	32
CCOC(=O)[C@H](C)N(CCCC(=O)c1ccccc1)C1CC1	ZINC000450826730	DG	On-Demand	Anodyne	CYP2J2	48	34
CCOC(=O)[C@@H](C)N(CCCC(=O)c1ccccc1)C1CC1	ZINC000450826731	DG	On-Demand	Anodyne	AMY2	47	32
CCOC(=O)[C@@H](C)N(CCCC(=O)c1ccccc1)C1CC1	ZINC000450826731	DG	On-Demand	Anodyne	CYP2J2	48	34
CCS(=O)(=O)c1ccc(CSc2nnc(NC(C)=O)s2)cc1	ZINC000450826734	FF	On-Demand	Anodyne	CAHX_FLABI	0	42
Cc1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450826735	EE	On-Demand	Bother	COLA	59	32
Cc1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450826735	EE	On-Demand	Bother	GSTP1	41	38
Cc1ccc([N+](=O)[O-])c(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450826735	EE	On-Demand	Bother	AMP1_PLAFQ	26	40
CC(=O)c1ccc(OCC[C@H](C)O)c(C)c1	ZINC000450826739	BE	On-Demand	Anodyne	THRA	0	42
CC(=O)c1ccc(OCC[C@H](C)O)c(C)c1	ZINC000450826739	BE	On-Demand	Anodyne	GRM2	16	46
CC(=O)c1ccc(OCC[C@@H](C)O)c(C)c1	ZINC000450826740	BE	On-Demand	Anodyne	THRA	0	42
CC(=O)c1ccc(OCC[C@@H](C)O)c(C)c1	ZINC000450826740	BE	On-Demand	Anodyne	GRM2	16	46
CC1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCC(=O)CC1	ZINC000450826743	FI	On-Demand	Anodyne	CACNA1B	50	38
CC1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCC(=O)CC1	ZINC000450826743	FI	On-Demand	Anodyne	CCR2	70	46
CC1(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CCC(=O)CC1	ZINC000450826743	FI	On-Demand	Anodyne	RBP4	26	41
O=C(NCCO)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nn1	ZINC000450826757	ED	On-Demand	Anodyne	SCD1	46	52
O=C(NCCO)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nn1	ZINC000450826757	ED	On-Demand	Anodyne	SCD	39	48
CNC(=O)c1cccnc1N1CC(c2ccc(Cl)cc2)C1	ZINC000450826763	DF	On-Demand	Anodyne	G2YM83_BOTF4	59	34
CO[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)CC[C@@H]1C	ZINC000450826775	CF	On-Demand	Anodyne	OPRK1	0	40
CO[C@@H]1CN(C[C@H](O)[C@@H](C)c2ccccc2)CC[C@@H]1C	ZINC000450826776	CF	On-Demand	Anodyne	OPRK1	0	40
CO[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)CC[C@H]1C	ZINC000450826777	CF	On-Demand	Anodyne	OPRK1	0	40
CO[C@@H]1CN(C[C@H](O)[C@@H](C)c2ccccc2)CC[C@H]1C	ZINC000450826778	CF	On-Demand	Anodyne	OPRK1	0	40
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450826790	EG	On-Demand	Anodyne	EPHX2	32	44
CC(C)(C)[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450826790	EG	On-Demand	Anodyne	CACNA1I	34	46
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450826791	EG	On-Demand	Anodyne	EPHX2	32	44
CC(C)(C)[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450826791	EG	On-Demand	Anodyne	CACNA1I	34	46
CN1[C@H]2CC[C@H]1CC(Nc1ncnc3cc(F)c(F)cc13)C2	ZINC000450826795	DF	On-Demand	Anodyne	CD38	43	37
CC[C@@]1(C)CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450826802	CG	On-Demand	Anodyne	THRA	0	40
CC[C@@]1(C)CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450826802	CG	On-Demand	Anodyne	DRD2	29	41
CC[C@@]1(C)CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450826802	CG	On-Demand	Anodyne	SLC18A3	0	43
CC[C@]1(C)CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450826803	CG	On-Demand	Anodyne	THRA	0	40
CC[C@]1(C)CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450826803	CG	On-Demand	Anodyne	DRD2	29	41
CC[C@]1(C)CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450826803	CG	On-Demand	Anodyne	SLC18A3	0	43
CC(F)(F)CCSc1nnc(Cc2cccc(F)c2)o1	ZINC000450826815	DH	On-Demand	Anodyne	PTK2	0	50
C[C@H]1CN(C[C@H](O)Cc2ccccc2)C[C@@H](CO)O1	ZINC000450826830	CC	On-Demand	Anodyne	VACHT_TETCF	0	42
N#CC1(CN2CCN(C(=O)COc3ccc(Cl)cc3Cl)CC2)CCC1	ZINC000450826844	GG	On-Demand	Mild	PTGDR2	27	45
CCn1nnc(C)c1CSc1nnc(Cc2ccccc2OC)o1	ZINC000450826890	EF	On-Demand	Anodyne	PTK2	27	57
COCCOC[C@H](O)CN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450826893	DC	On-Demand	Anodyne	HSD17B2	87	35
COCCOC[C@@H](O)CN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450826894	DC	On-Demand	Anodyne	HSD17B2	87	35
COCCOC[C@@H](O)CN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450826895	DC	On-Demand	Anodyne	HSD17B2	87	35
COCCOC[C@H](O)CN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450826896	DC	On-Demand	Anodyne	HSD17B2	87	35
C[C@H](Nc1nccn(C(F)F)c1=O)C(=O)NCCc1ccccc1	ZINC000450826919	ED	On-Demand	Anodyne	CASP3	84	41
C[C@H](Nc1nccn(C(F)F)c1=O)C(=O)NCCc1ccccc1	ZINC000450826919	ED	On-Demand	Anodyne	CASP8	75	41
C[C@H](Nc1nccn(C(F)F)c1=O)C(=O)NCCc1ccccc1	ZINC000450826919	ED	On-Demand	Anodyne	CASP1	42	41
C[C@H](Nc1nccn(C(F)F)c1=O)C(=O)NCCc1ccccc1	ZINC000450826919	ED	On-Demand	Anodyne	CAPN2	40	41
C[C@H](Nc1nccn(C(F)F)c1=O)C(=O)NCCc1ccccc1	ZINC000450826919	ED	On-Demand	Anodyne	CASP7	50	40
C[C@H](Nc1nccn(C(F)F)c1=O)C(=O)NCCc1ccccc1	ZINC000450826919	ED	On-Demand	Anodyne	AMP1_PLAFQ	22	40
C[C@H](Nc1cnnc(O)c1Cl)C(=O)NCCc1ccccc1	ZINC000450826920	DD	On-Demand	Anodyne	ANPEP	25	45
C[C@H](Nc1cnnc(O)c1Cl)C(=O)NCCc1ccccc1	ZINC000450826920	DD	On-Demand	Anodyne	AMP1_PLAFQ	36	45
C[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450826921	GF	On-Demand	Bother	BCL2L1	45	35
C[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])C(=O)NCCc1ccccc1	ZINC000450826921	GF	On-Demand	Bother	TAAR1	18	41
C[C@H](N=c1nc(C(F)(F)F)[nH]s1)C(=O)NCCc1ccccc1	ZINC000450826922	EE	On-Demand	Anodyne	AMP1_PLAFQ	23	42
CC(C)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ncn1	ZINC000450826923	DF	On-Demand	Anodyne	AMP1_PLAFQ	35	43
CC(C)c1nccc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450826928	DE	On-Demand	Anodyne	MTNR1B	28	42
CC(C)c1nccc(N[C@@H](C)C(=O)NCCc2ccccc2)n1	ZINC000450826928	DE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450826933	FF	On-Demand	Bother	COLA	81	35
CC(=O)c1ccc(N[C@@H](C)C(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000450826933	FF	On-Demand	Bother	AMP1_PLAFQ	26	40
C[C@H](O)CCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450826936	CF	On-Demand	Anodyne	COLA	43	41
C[C@H](O)CCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450826936	CF	On-Demand	Anodyne	CPT1A	30	41
C[C@H](O)CCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450826936	CF	On-Demand	Anodyne	ETHR	49	37
C[C@@H](O)CCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450826937	CF	On-Demand	Anodyne	COLA	43	41
C[C@@H](O)CCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450826937	CF	On-Demand	Anodyne	CPT1A	30	41
C[C@@H](O)CCOc1ccc(-c2noc(C3CC3)n2)cc1	ZINC000450826937	CF	On-Demand	Anodyne	ETHR	49	37
Cc1cc(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]c(C)n1	ZINC000450826940	CD	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450826949	GF	On-Demand	Bother	GSTM2	46	38
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450826949	GF	On-Demand	Bother	COLA	53	32
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450826949	GF	On-Demand	Bother	CAPN2	44	36
CCOC(=O)c1cc(N[C@@H](C)C(=O)NCCc2ccccc2)ccc1[N+](=O)[O-]	ZINC000450826949	GF	On-Demand	Bother	NPR	50	38
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	HTR1A	59	48
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	DRD2	44	47
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	DRD1	23	42
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	DRD4	44	47
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	HTR2A	37	47
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	HTR2C	24	44
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	DRD3	45	47
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	HTR7	65	48
Cc1nn(C)c(N2CCN(CCCC(=O)c3ccccc3)CC2)c1C#N	ZINC000450826950	FE	On-Demand	Mild	CYP2J2	56	42
C[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826961	GD	On-Demand	Anodyne	ACE	48	42
C[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826961	GD	On-Demand	Anodyne	MME	19	42
C[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826961	GD	On-Demand	Anodyne	PRCP	22	45
C[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826961	GD	On-Demand	Anodyne	XIAP	31	42
C[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826961	GD	On-Demand	Anodyne	ALK	16	42
C[C@H](Nc1cc(N2CCC[C@@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826961	GD	On-Demand	Anodyne	BIRC2	57	39
C[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826962	GD	On-Demand	Anodyne	ACE	48	42
C[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826962	GD	On-Demand	Anodyne	MME	19	42
C[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826962	GD	On-Demand	Anodyne	PRCP	22	45
C[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826962	GD	On-Demand	Anodyne	XIAP	31	42
C[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826962	GD	On-Demand	Anodyne	ALK	16	42
C[C@H](Nc1cc(N2CCC[C@H](CO)C2)ncn1)C(=O)NCCc1ccccc1	ZINC000450826962	GD	On-Demand	Anodyne	BIRC2	57	39
O=C(c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450826972	ED	On-Demand	Bother	BCL2L1	22	40
NS(=O)(=O)c1ccc(NCCC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000450826973	DC	On-Demand	Bother	CA2	32	44
C[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C(=O)NCCc1ccccc1	ZINC000450826982	GE	On-Demand	Bother	COLA	61	34
C[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C(=O)NCCc1ccccc1	ZINC000450826982	GE	On-Demand	Bother	NPR	30	42
COCc1cc(N[C@@H](C)C(=O)NCCc2ccccc2)n2ncnc2n1	ZINC000450826987	FD	On-Demand	Anodyne	DHOD	0	40
Cc1nccc(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450826993	CD	On-Demand	Anodyne	MTNR1B	22	44
Cc1nccc(=N[C@@H](C)C(=O)NCCc2ccccc2)[nH]1	ZINC000450826993	CD	On-Demand	Anodyne	AMP1_PLAFQ	31	43
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	CA2	27	44
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	NQO2	15	41
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	CA1	28	44
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	CA7	19	44
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	TRPV1	101	43
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	CA5B	38	44
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	CA4	26	41
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	CA5A	39	44
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	CA9	19	41
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NCCc1ccccc1	ZINC000450827012	FE	On-Demand	Anodyne	AMP1_PLAFQ	27	41
C[C@H](Nc1ncncc1Cl)C(=O)NCCc1ccccc1	ZINC000450827013	DE	On-Demand	Anodyne	AMP1_PLAFQ	34	43
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450827016	CF	On-Demand	Anodyne	AMP1_PLAFQ	32	44
Cc1ccnc(N[C@@H](C)C(=O)NCCc2ccccc2)c1	ZINC000450827016	CF	On-Demand	Anodyne	KDM4E	23	48
CC[C@@H](C)n1c(S[C@H](C)C(=O)Nc2nccs2)nnc1-c1ccccc1	ZINC000450827052	GI	On-Demand	Anodyne	MAP	0	41
CC[C@@H](C)n1c(S[C@H](C)C(=O)Nc2nccs2)nnc1-c1ccccc1	ZINC000450827052	GI	On-Demand	Anodyne	MAP1	114	39
CC[C@@H](C)n1c(S[C@@H](C)C(=O)Nc2nccs2)nnc1-c1ccccc1	ZINC000450827053	GI	On-Demand	Anodyne	MAP	0	41
CC[C@@H](C)n1c(S[C@@H](C)C(=O)Nc2nccs2)nnc1-c1ccccc1	ZINC000450827053	GI	On-Demand	Anodyne	MAP1	114	39
CC[C@H](C)n1c(S[C@H](C)C(=O)Nc2nccs2)nnc1-c1ccccc1	ZINC000450827054	GI	On-Demand	Anodyne	MAP	0	41
CC[C@H](C)n1c(S[C@H](C)C(=O)Nc2nccs2)nnc1-c1ccccc1	ZINC000450827054	GI	On-Demand	Anodyne	MAP1	114	39
CC[C@H](C)n1c(S[C@@H](C)C(=O)Nc2nccs2)nnc1-c1ccccc1	ZINC000450827055	GI	On-Demand	Anodyne	MAP	0	41
CC[C@H](C)n1c(S[C@@H](C)C(=O)Nc2nccs2)nnc1-c1ccccc1	ZINC000450827055	GI	On-Demand	Anodyne	MAP1	114	39
C[C@@H](CCNC(=O)CNC(=O)Nc1cccc(Cl)c1)N1CCCCC1	ZINC000450827075	FF	On-Demand	Anodyne	HRH2	42	49
C[C@H](CCNC(=O)CNC(=O)Nc1cccc(Cl)c1)N1CCCCC1	ZINC000450827079	FF	On-Demand	Anodyne	HRH2	42	49
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450827084	GE	On-Demand	Anodyne	LIPG	44	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450827084	GE	On-Demand	Anodyne	MAP3K12	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450827086	GE	On-Demand	Anodyne	LIPG	44	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450827086	GE	On-Demand	Anodyne	MAP3K12	15	41
COCCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450827087	FG	On-Demand	Mild	HCRTR2	15	46
COCCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450827087	FG	On-Demand	Mild	PDEB1	0	40
COCCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450827087	FG	On-Demand	Mild	EZH2	50	36
O=S1(=O)CCCN1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450827130	DG	On-Demand	Anodyne	DNAE	41	31
COc1ccc(CNC(=O)CCN(C)[C@@H]2CC[C@@H](O)CC2)c(OC)c1	ZINC000450827149	FD	On-Demand	Anodyne	MTNR1A	68	38
COc1ccc(CNC(=O)CCN(C)[C@@H]2CC[C@@H](O)CC2)c(OC)c1	ZINC000450827149	FD	On-Demand	Anodyne	MTNR1B	53	36
Clc1ccc(C2CN(c3ccnc(N4CCCCC4)n3)C2)cc1	ZINC000450827151	EH	On-Demand	Anodyne	SORD	55	40
O=C(NC1CC1)c1ccc(N2CC(c3ccc(Cl)cc3)C2)c([N+](=O)[O-])c1	ZINC000450827153	FH	On-Demand	Bother	MAPK13	42	33
COc1ccccc1SCCCCCC(C)=O	ZINC000450827168	CH	On-Demand	Anodyne	MTNR1B	16	60
COc1cc(CN2CC[C@H](C)[C@@H]2CO)ccc1Cl	ZINC000450827174	CF	On-Demand	Anodyne	DRD2	15	40
COc1cc(CN2CC[C@H](C)[C@H]2CO)ccc1Cl	ZINC000450827176	CF	On-Demand	Anodyne	DRD2	15	40
COc1cc(CN2CC[C@@H](C)[C@@H]2CO)ccc1Cl	ZINC000450827177	CF	On-Demand	Anodyne	DRD2	15	40
COc1cc(CN2CC[C@@H](C)[C@H]2CO)ccc1Cl	ZINC000450827179	CF	On-Demand	Anodyne	DRD2	15	40
Cc1cc(C)cc([C@@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450827198	GJ	On-Demand	Anodyne	SLC12A5	60	35
CCN(CC[C@@H](C)O)Cc1c[nH]c2ccccc12	ZINC000450827201	BF	On-Demand	Anodyne	TACR1	40	37
CCN(CC[C@@H](C)O)Cc1c[nH]c2ccccc12	ZINC000450827201	BF	On-Demand	Anodyne	MPO	15	47
CCN(CC[C@@H](C)O)Cc1c[nH]c2ccccc12	ZINC000450827201	BF	On-Demand	Anodyne	MMP14	44	37
CCN(CC[C@H](C)O)Cc1c[nH]c2ccccc12	ZINC000450827202	BF	On-Demand	Anodyne	TACR1	40	37
CCN(CC[C@H](C)O)Cc1c[nH]c2ccccc12	ZINC000450827202	BF	On-Demand	Anodyne	MPO	15	47
CCN(CC[C@H](C)O)Cc1c[nH]c2ccccc12	ZINC000450827202	BF	On-Demand	Anodyne	MMP14	44	37
CC(=O)c1cccc(Cn2c3c(sc2=O)CCCC3)c1	ZINC000450827203	CG	On-Demand	Anodyne	FABP4	49	43
Cc1cc(C)cc([C@H]2CCN(C(=O)C3(Cc4ccccc4)CCOCC3)C2)c1	ZINC000450827204	GJ	On-Demand	Anodyne	SLC12A5	60	35
COc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)ccc1O	ZINC000450827205	FE	On-Demand	Anodyne	OPRK1	35	40
COc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)ccc1O	ZINC000450827205	FE	On-Demand	Anodyne	ITGA4	16	40
COc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)ccc1O	ZINC000450827205	FE	On-Demand	Anodyne	MBTPS1	48	34
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)ccc1O	ZINC000450827207	FE	On-Demand	Anodyne	OPRK1	35	40
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)ccc1O	ZINC000450827207	FE	On-Demand	Anodyne	ITGA4	16	40
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)ccc1O	ZINC000450827207	FE	On-Demand	Anodyne	MBTPS1	48	34
C[C@H](O)CCOc1ccc2c(c1)CCCC2=O	ZINC000450827212	BE	On-Demand	Anodyne	MAOA	15	55
C[C@@H](O)CCOc1ccc2c(c1)CCCC2=O	ZINC000450827213	BE	On-Demand	Anodyne	MAOA	15	55
O=C(c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1)N1CCOCC1	ZINC000450827219	GG	On-Demand	Anodyne	P2RY12	26	41
O=C(c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1)N1CCOCC1	ZINC000450827219	GG	On-Demand	Anodyne	CXCR3	37	47
O=C(c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1)N1CCOCC1	ZINC000450827219	GG	On-Demand	Anodyne	AKR1C3	26	48
O=C(c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1)N1CCOCC1	ZINC000450827219	GG	On-Demand	Anodyne	LRRK2	21	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC[C@H]1CCCC[C@@H]1O	ZINC000450827226	GF	On-Demand	Bother	EPHX2	16	43
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC[C@H]1CCCC[C@@H]1O	ZINC000450827226	GF	On-Demand	Bother	DDIT3	0	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827248	DF	On-Demand	Anodyne	DRD2	32	43
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827248	DF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827248	DF	On-Demand	Anodyne	SLC6A1	39	43
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827248	DF	On-Demand	Anodyne	SLC18A3	0	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827248	DF	On-Demand	Anodyne	HTR3B	0	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827248	DF	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827249	DF	On-Demand	Anodyne	DRD2	32	43
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827249	DF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827249	DF	On-Demand	Anodyne	SLC6A1	39	43
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827249	DF	On-Demand	Anodyne	SLC18A3	0	42
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827249	DF	On-Demand	Anodyne	HTR3B	0	42
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450827249	DF	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827250	DF	On-Demand	Anodyne	DRD2	32	43
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827250	DF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827250	DF	On-Demand	Anodyne	SLC6A1	39	43
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827250	DF	On-Demand	Anodyne	SLC18A3	0	42
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827250	DF	On-Demand	Anodyne	HTR3B	0	42
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827250	DF	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827251	DF	On-Demand	Anodyne	DRD2	32	43
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827251	DF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827251	DF	On-Demand	Anodyne	SLC6A1	39	43
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827251	DF	On-Demand	Anodyne	SLC18A3	0	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827251	DF	On-Demand	Anodyne	HTR3B	0	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450827251	DF	On-Demand	Anodyne	CYP2J2	51	36
CC1(C)CCN(c2ncnc3sc4c(c23)CCCC4)CC[S@]1=O	ZINC000450827254	EG	On-Demand	Anodyne	RBP4	18	43
CC1(C)CCN(c2ncnc3sc4c(c23)CCCC4)CC[S@@]1=O	ZINC000450827255	EG	On-Demand	Anodyne	RBP4	18	43
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C	ZINC000450827262	CF	On-Demand	Anodyne	DRD2	35	48
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C	ZINC000450827262	CF	On-Demand	Anodyne	SLC6A1	24	42
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C	ZINC000450827262	CF	On-Demand	Anodyne	DRD3	0	48
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C	ZINC000450827262	CF	On-Demand	Anodyne	HTR4	44	34
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C	ZINC000450827263	CF	On-Demand	Anodyne	DRD2	35	48
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C	ZINC000450827263	CF	On-Demand	Anodyne	SLC6A1	24	42
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C	ZINC000450827263	CF	On-Demand	Anodyne	DRD3	0	48
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@H]1C	ZINC000450827263	CF	On-Demand	Anodyne	HTR4	44	34
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C	ZINC000450827264	CF	On-Demand	Anodyne	DRD2	35	48
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C	ZINC000450827264	CF	On-Demand	Anodyne	SLC6A1	24	42
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C	ZINC000450827264	CF	On-Demand	Anodyne	DRD3	0	48
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C	ZINC000450827264	CF	On-Demand	Anodyne	HTR4	44	34
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C	ZINC000450827265	CF	On-Demand	Anodyne	DRD2	35	48
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C	ZINC000450827265	CF	On-Demand	Anodyne	SLC6A1	24	42
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C	ZINC000450827265	CF	On-Demand	Anodyne	DRD3	0	48
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)[C@@H]1C	ZINC000450827265	CF	On-Demand	Anodyne	HTR4	44	34
O=C(COc1ccc(Cl)cc1Cl)N1CCN(Cc2cnn[nH]2)CC1	ZINC000450827270	FD	On-Demand	Anodyne	CCR1	17	46
O=C(COc1ccc(Cl)cc1Cl)N1CCN(Cc2cnn[nH]2)CC1	ZINC000450827270	FD	On-Demand	Anodyne	ALPL	39	40
CC1(C)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)CC[S@]1=O	ZINC000450827292	GI	On-Demand	Anodyne	ADRB3	0	40
CC1(C)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)CC[S@@]1=O	ZINC000450827293	GI	On-Demand	Anodyne	ADRB3	0	40
COC(=O)c1ccc(C(=O)CSc2nnc(-c3ccc(C(C)C)cc3)o2)o1	ZINC000450827313	GI	On-Demand	Anodyne	TYMS	0	44
COC(=O)c1ccc(C(=O)CSc2nnc(-c3ccc(C(C)C)cc3)o2)o1	ZINC000450827313	GI	On-Demand	Anodyne	GSK3B	15	46
COC(=O)c1ccc(C(=O)CSc2nnc(-c3ccc(C(C)C)cc3)o2)o1	ZINC000450827313	GI	On-Demand	Anodyne	GSK3A	41	46
CN1[C@H]2CC[C@H]1CC(Nc1cccc(C(=O)OC(C)(C)C)n1)C2	ZINC000450827331	DG	On-Demand	Anodyne	GLRA1	50	38
CCS(=O)(=O)c1ccc(CSCCOc2ccc(OC)cc2)cc1	ZINC000450827391	FH	On-Demand	Anodyne	MMP2	15	40
CCS(=O)(=O)c1ccc(CSCCOc2ccc(OC)cc2)cc1	ZINC000450827391	FH	On-Demand	Anodyne	MMP3	17	40
N#CC1(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)CCC1	ZINC000450827414	EF	On-Demand	Mild	MMP13	24	43
N#CC1(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)CCC1	ZINC000450827414	EF	On-Demand	Mild	ADAM17	38	43
N#CC1(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)CCC1	ZINC000450827414	EF	On-Demand	Mild	TRPV4	43	34
O=C(CC[C@H]1CCCCO1)COc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450827458	GG	On-Demand	Anodyne	COLA	85	36
O=C(CC[C@H]1CCCCO1)COc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450827458	GG	On-Demand	Anodyne	CPT1A	79	36
O=C(CC[C@H]1CCCCO1)COc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450827458	GG	On-Demand	Anodyne	EPHX2	16	44
CC(C)c1nnc(CSc2ccc(S(C)(=O)=O)cc2)s1	ZINC000450827459	EG	On-Demand	Anodyne	PTGS2	17	40
O=C(CC[C@@H]1CCCCO1)COc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450827460	GG	On-Demand	Anodyne	COLA	85	36
O=C(CC[C@@H]1CCCCO1)COc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450827460	GG	On-Demand	Anodyne	CPT1A	79	36
O=C(CC[C@@H]1CCCCO1)COc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450827460	GG	On-Demand	Anodyne	EPHX2	16	44
CCn1ccnc1[C@H](C)Nc1ccccc1[N+](=O)[O-]	ZINC000450827481	CF	On-Demand	Bother	COLA	40	32
CCn1ccnc1[C@@H](C)Nc1ccccc1[N+](=O)[O-]	ZINC000450827482	CF	On-Demand	Bother	COLA	40	32
CCc1cccc(C(=O)Nc2cc(C#N)ccc2OCCOC)n1	ZINC000450827488	EF	On-Demand	Mild	PDE5A	26	41
CCN(Cc1ccc(C(C)=O)cc1)Cc1c[nH]c2ccccc12	ZINC000450827491	DI	On-Demand	Anodyne	TACR1	29	47
CCN(Cc1ccc(C(C)=O)cc1)Cc1c[nH]c2ccccc12	ZINC000450827491	DI	On-Demand	Anodyne	MC4R	39	41
CCN(Cc1ccc(C(C)=O)cc1)Cc1c[nH]c2ccccc12	ZINC000450827491	DI	On-Demand	Anodyne	MPO	17	44
CCN(Cc1ccc(C(C)=O)cc1)Cc1c[nH]c2ccccc12	ZINC000450827491	DI	On-Demand	Anodyne	HDAC8	0	47
CCN(Cc1ccc(C(C)=O)cc1)Cc1c[nH]c2ccccc12	ZINC000450827491	DI	On-Demand	Anodyne	MMP14	41	33
CCN(Cc1ccc(C(C)=O)cc1)Cc1c[nH]c2ccccc12	ZINC000450827491	DI	On-Demand	Anodyne	HDAC3	16	47
CCN(Cc1ccc(C(C)=O)cc1)Cc1c[nH]c2ccccc12	ZINC000450827491	DI	On-Demand	Anodyne	SSTR3	33	42
CCN(Cc1ccc(C(C)=O)cc1)Cc1c[nH]c2ccccc12	ZINC000450827491	DI	On-Demand	Anodyne	GHSR	51	36
CCN(Cc1c[nH]c2ccccc12)CC1(C(=O)OC)CC1	ZINC000450827498	CF	On-Demand	Anodyne	TACR1	48	43
CCN(Cc1c[nH]c2ccccc12)CC1(C(=O)OC)CC1	ZINC000450827498	CF	On-Demand	Anodyne	CCKAR	45	37
CCN(Cc1c[nH]c2ccccc12)CC1(C(=O)OC)CC1	ZINC000450827498	CF	On-Demand	Anodyne	NMBR	67	33
CCN(Cc1c[nH]c2ccccc12)CC1(C(=O)OC)CC1	ZINC000450827498	CF	On-Demand	Anodyne	MMP14	54	35
CCN(Cc1c[nH]c2ccccc12)CC1(C(=O)OC)CC1	ZINC000450827498	CF	On-Demand	Anodyne	GRPR	45	32
CCN(Cc1c[nH]c2ccccc12)CC1(C(=O)OC)CC1	ZINC000450827498	CF	On-Demand	Anodyne	ECE1	45	36
CCN(Cc1c[nH]c2ccccc12)CC1(C(=O)OC)CC1	ZINC000450827498	CF	On-Demand	Anodyne	CCKBR	51	36
CCN(Cc1c[nH]c2ccccc12)CC1(C(=O)OC)CC1	ZINC000450827498	CF	On-Demand	Anodyne	GHSR	50	39
Cc1nn(C)cc1CSc1ccc(S(C)(=O)=O)cc1	ZINC000450827502	CE	On-Demand	Anodyne	PTGS2	21	45
CC(=O)c1cccc(CN2CC[C@H](C)C[C@@H]2[C@@H](C)O)c1	ZINC000450827503	CF	On-Demand	Anodyne	CCR3	19	41
CC(=O)c1cccc(CN2CC[C@H](C)C[C@H]2[C@H](C)O)c1	ZINC000450827504	CF	On-Demand	Anodyne	CCR3	19	41
CC(=O)c1cccc(CN2CC[C@H](C)C[C@H]2[C@@H](C)O)c1	ZINC000450827505	CF	On-Demand	Anodyne	CCR3	19	41
CC(=O)c1cccc(CN2CC[C@H](C)C[C@@H]2[C@H](C)O)c1	ZINC000450827506	CF	On-Demand	Anodyne	CCR3	19	41
CC(=O)c1cccc(Cn2nc(C(C)(C)C)ccc2=O)c1	ZINC000450827526	CF	On-Demand	Anodyne	CTSV	43	31
CC(=O)c1ccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)cc1	ZINC000450827527	FK	On-Demand	Anodyne	TYMS	0	47
CC(=O)c1ccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)cc1	ZINC000450827527	FK	On-Demand	Anodyne	GSK3B	20	52
CC(=O)c1ccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)cc1	ZINC000450827527	FK	On-Demand	Anodyne	GSK3A	61	52
CC(=O)c1ccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)cc1	ZINC000450827527	FK	On-Demand	Anodyne	ALOX15	27	40
c1ccc2c(N3CCN(CC[C@H]4CCOC4)CC3)cncc2c1	ZINC000450827562	DF	On-Demand	Anodyne	DRD2	15	46
c1ccc2c(N3CCN(CC[C@@H]4CCOC4)CC3)cncc2c1	ZINC000450827563	DF	On-Demand	Anodyne	DRD2	15	46
CCc1nc(C)c(CSc2nnc(Cc3ccccc3F)o2)o1	ZINC000450827586	EH	On-Demand	Anodyne	PTK2	0	46
Nc1ncccc1CN1CCCC2(CCCCC2)CC1	ZINC000450827591	CH	On-Demand	Anodyne	CCR8	30	42
COC(=O)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)[C@@H]1C	ZINC000450827602	EF	On-Demand	Anodyne	SLC6A1	0	44
COC(=O)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1C	ZINC000450827603	EF	On-Demand	Anodyne	SLC6A1	0	44
COC(=O)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)[C@@H]1C	ZINC000450827604	EF	On-Demand	Anodyne	SLC6A1	0	44
COC(=O)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1C	ZINC000450827605	EF	On-Demand	Anodyne	SLC6A1	0	44
COc1ccccc1Cc1nnc(SCc2nnc(C3CC3)s2)o1	ZINC000450827608	FH	On-Demand	Anodyne	PTK2	0	47
CCOC(=O)c1cnccc1N1CC(c2ccc(Cl)cc2)C1	ZINC000450827631	DH	On-Demand	Anodyne	SLC6A1	22	41
C[C@@H](SCc1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1	ZINC000450827642	DI	On-Demand	Anodyne	PTGS2	19	41
C[C@H](SCc1cccc(S(C)(=O)=O)c1)c1ccc(F)cc1	ZINC000450827643	DI	On-Demand	Anodyne	PTGS2	24	41
Cc1cc(C#N)cc(N2CC(c3cccc(Cl)c3)C2)n1	ZINC000450827646	CH	On-Demand	Mild	GRM5	16	45
CC[C@](C)(O)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450827648	GH	On-Demand	Anodyne	RORC	44	51
CC[C@@](C)(O)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450827649	GH	On-Demand	Anodyne	RORC	44	51
CCOC(=O)c1ccnc(N2CC(c3ccc(Cl)cc3)C2)c1[N+](=O)[O-]	ZINC000450827661	FG	On-Demand	Bother	SLC27A4	49	32
COc1ccc(-c2nc(S[C@H](C)C(=O)Nc3nccs3)n[nH]2)c(OC)c1	ZINC000450827679	GG	On-Demand	Anodyne	MAP1	58	38
COc1ccc(-c2nc(S[C@@H](C)C(=O)Nc3nccs3)n[nH]2)c(OC)c1	ZINC000450827680	GG	On-Demand	Anodyne	MAP1	58	38
CNS(=O)(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)c(F)c1	ZINC000450827691	FF	On-Demand	Anodyne	F10	15	41
COc1cccc(OCCC(=O)N2CC[C@H](C(C)(C)C)C2)c1	ZINC000450827692	DG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)N2CC[C@H](C(C)(C)C)C2)c1	ZINC000450827692	DG	On-Demand	Anodyne	MTNR1A	26	43
COc1cccc(OCCC(=O)N2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450827693	DG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)N2CC[C@@H](C(C)(C)C)C2)c1	ZINC000450827693	DG	On-Demand	Anodyne	MTNR1A	26	43
COc1cccc2c(NC3C[C@@H]4CC[C@H](C3)N4C)c(C)cnc12	ZINC000450827710	DH	On-Demand	Anodyne	ATP4A	29	41
CC[C@@]1(CO)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450827711	FD	On-Demand	Anodyne	MTNR1A	52	42
CC[C@@]1(CO)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450827711	FD	On-Demand	Anodyne	MTNR1B	44	42
CC[C@]1(CO)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450827712	FD	On-Demand	Anodyne	MTNR1A	52	42
CC[C@]1(CO)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450827712	FD	On-Demand	Anodyne	MTNR1B	44	42
COCCOc1ccc(C#N)cc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450827721	FG	On-Demand	Mild	CTRB_BOVIN	44	33
COC(=O)COc1ccc(N(C)C(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450827766	GG	On-Demand	Anodyne	PDE6A	43	35
CCn1ccnc1[C@H](C)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450827788	DG	On-Demand	Anodyne	EGFR	41	41
CCn1ccnc1[C@H](C)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450827788	DG	On-Demand	Anodyne	EPHA2	44	33
CCn1ccnc1[C@@H](C)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450827789	DG	On-Demand	Anodyne	EGFR	41	41
CCn1ccnc1[C@@H](C)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450827789	DG	On-Demand	Anodyne	EPHA2	44	33
CCN(Cc1nc(C(=O)OC)co1)Cc1c[nH]c2ccccc12	ZINC000450827814	DF	On-Demand	Anodyne	TACR1	40	39
CCN(Cc1nc(C(=O)OC)co1)Cc1c[nH]c2ccccc12	ZINC000450827814	DF	On-Demand	Anodyne	GHSR	49	33
O=[N+]([O-])c1ccc(NC[C@H]2CCCC[C@@H]2O)c(S(=O)(=O)N2CCCC2)c1	ZINC000450827848	GE	On-Demand	Bother	TBXA2R	19	41
O=[N+]([O-])c1ccc(NC[C@H]2CCCC[C@@H]2O)c(S(=O)(=O)N2CCCC2)c1	ZINC000450827848	GE	On-Demand	Bother	EPHX2	19	49
Fc1cccc(Cc2nnc(SCc3cn(CC4CC4)nn3)o2)c1	ZINC000450827850	EG	On-Demand	Anodyne	PTK2	22	48
CC(=O)[C@@](C)(O)CN(C)CCOc1ccc(C(F)(F)F)cc1	ZINC000450827853	DE	On-Demand	Anodyne	FDPS	24	40
CC(=O)[C@](C)(O)CN(C)CCOc1ccc(C(F)(F)F)cc1	ZINC000450827854	DE	On-Demand	Anodyne	FDPS	24	40
CC(C)c1ccc(-c2nnc(SCC(=O)CC[C@H]3CCCCO3)o2)cc1	ZINC000450827874	FJ	On-Demand	Anodyne	TYMS	0	43
CC(C)c1ccc(-c2nnc(SCC(=O)CC[C@@H]3CCCCO3)o2)cc1	ZINC000450827875	FJ	On-Demand	Anodyne	TYMS	0	43
CCOCCOCCN(C)Cc1cccc(C(C)=O)c1	ZINC000450827894	CE	On-Demand	Anodyne	ACHE	0	45
CCCc1nc(C)c(CSc2nnc(-c3ccc(C(C)C)cc3)o2)o1	ZINC000450827908	FK	On-Demand	Anodyne	TYMS	0	45
CCCc1nc(C)c(CSc2nnc(-c3ccc(C(C)C)cc3)o2)o1	ZINC000450827908	FK	On-Demand	Anodyne	GSK3A	40	37
O=C(N1CCOCC2(CCOCC2)C1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450827913	FG	On-Demand	Anodyne	AKR1C3	0	41
O=C(c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1)N1CCCCC1	ZINC000450827970	GJ	On-Demand	Anodyne	P2RY12	27	42
O=C(c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1)N1CCCCC1	ZINC000450827970	GJ	On-Demand	Anodyne	CXCR3	37	41
O=C(c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1)N1CCCCC1	ZINC000450827970	GJ	On-Demand	Anodyne	HPGD	33	43
O=C(c1cnc(N2CC(c3ccc(Cl)cc3)C2)c(Cl)c1)N1CCCCC1	ZINC000450827970	GJ	On-Demand	Anodyne	SLC6A7	0	41
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2)c2nc[nH]n2)c(OC)c1	ZINC000450827988	GE	On-Demand	Anodyne	MTNR1A	54	38
COc1ccc(CNC(=O)CCN[C@@H](c2ccccc2)c2nc[nH]n2)c(OC)c1	ZINC000450827988	GE	On-Demand	Anodyne	MTNR1B	43	36
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2)c2nc[nH]n2)c(OC)c1	ZINC000450827989	GE	On-Demand	Anodyne	MTNR1A	54	38
COc1ccc(CNC(=O)CCN[C@H](c2ccccc2)c2nc[nH]n2)c(OC)c1	ZINC000450827989	GE	On-Demand	Anodyne	MTNR1B	43	36
COc1ccc(CNC(=O)CCN(C)CC2(N(C)C)CCC2)c(OC)c1	ZINC000450828001	FE	On-Demand	Anodyne	MTNR1A	63	44
COc1ccc(CNC(=O)CCN(C)CC2(N(C)C)CCC2)c(OC)c1	ZINC000450828001	FE	On-Demand	Anodyne	MTNR1B	48	44
Clc1ccc(CCN2CCc3ncsc3C2)cc1	ZINC000450828008	CG	On-Demand	Anodyne	DHCR7	0	45
CCN(Cc1c[nH]c2ccccc12)C[C@@H](C)S(C)(=O)=O	ZINC000450828022	CE	On-Demand	Anodyne	MMP14	45	35
CCN(Cc1c[nH]c2ccccc12)C[C@@H](C)S(C)(=O)=O	ZINC000450828022	CE	On-Demand	Anodyne	SLC15A2	0	40
CCN(Cc1c[nH]c2ccccc12)C[C@H](C)S(C)(=O)=O	ZINC000450828023	CE	On-Demand	Anodyne	MMP14	45	35
CCN(Cc1c[nH]c2ccccc12)C[C@H](C)S(C)(=O)=O	ZINC000450828023	CE	On-Demand	Anodyne	SLC15A2	0	40
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H]1CC12CCOCC2	ZINC000450828060	DE	On-Demand	Anodyne	TIMP3	47	31
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1CC12CCOCC2	ZINC000450828061	DE	On-Demand	Anodyne	TIMP3	47	31
CO[C@H](Cc1ccccc1)C(=O)NC[C@H]1CC12CCOCC2	ZINC000450828062	DE	On-Demand	Anodyne	TIMP3	47	31
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H]1CC12CCOCC2	ZINC000450828063	DE	On-Demand	Anodyne	TIMP3	47	31
O=C(NC[C@@H]1CC12CCOCC2)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450828071	FE	On-Demand	Anodyne	CACNA1I	51	31
O=C(NC[C@H]1CC12CCOCC2)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450828072	FE	On-Demand	Anodyne	CACNA1I	51	31
CCOC(=O)COc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450828074	CD	On-Demand	Anodyne	LTA4H	28	40
CCOC(=O)COc1ccc(NC(=O)C[C@H](O)CC)cc1	ZINC000450828074	CD	On-Demand	Anodyne	SLC1A2	51	39
CCOC(=O)COc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450828075	CD	On-Demand	Anodyne	LTA4H	28	40
CCOC(=O)COc1ccc(NC(=O)C[C@@H](O)CC)cc1	ZINC000450828075	CD	On-Demand	Anodyne	SLC1A2	51	39
CCCOc1ccc(C(=O)N2CC[C@H](n3c(C)nc4c3CCCC4)C2)c(OC)c1	ZINC000450828106	GH	On-Demand	Anodyne	OXTR	27	42
CCCOc1ccc(C(=O)N2CC[C@@H](n3c(C)nc4c3CCCC4)C2)c(OC)c1	ZINC000450828107	GH	On-Demand	Anodyne	OXTR	27	42
CCCOc1cccc(Cn2c(=O)oc3cc(S(=O)(=O)N(C)C)ccc32)c1	ZINC000450828110	GF	On-Demand	Anodyne	MIF	18	44
C[C@H](CCNC(=O)c1c(Cl)cc(Cl)cc1Cl)N1CCCCC1	ZINC000450828117	FJ	On-Demand	Anodyne	CCR5	28	49
C[C@H](CCNC(=O)c1c(Cl)cc(Cl)cc1Cl)N1CCCCC1	ZINC000450828117	FJ	On-Demand	Anodyne	CACNA1I	35	41
C[C@@H](CCNC(=O)c1c(Cl)cc(Cl)cc1Cl)N1CCCCC1	ZINC000450828118	FJ	On-Demand	Anodyne	CCR5	28	49
C[C@@H](CCNC(=O)c1c(Cl)cc(Cl)cc1Cl)N1CCCCC1	ZINC000450828118	FJ	On-Demand	Anodyne	CACNA1I	35	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](n2cnc3c2CCCC3)C1	ZINC000450828120	GI	On-Demand	Anodyne	CACNA1B	42	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](n2cnc3c2CCCC3)C1	ZINC000450828120	GI	On-Demand	Anodyne	LIPG	45	32
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](n2cnc3c2CCCC3)C1	ZINC000450828120	GI	On-Demand	Anodyne	L3MBTL3	48	38
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@@H]1C	ZINC000450828150	FG	On-Demand	Anodyne	HDAC8	18	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@@H]1C	ZINC000450828150	FG	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@@H]1C	ZINC000450828151	FG	On-Demand	Anodyne	HDAC8	18	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@@H]1C	ZINC000450828151	FG	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@H]1C	ZINC000450828152	FG	On-Demand	Anodyne	HDAC8	18	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@H]1C	ZINC000450828152	FG	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@H]1C	ZINC000450828153	FG	On-Demand	Anodyne	HDAC8	18	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)[C@H]1C	ZINC000450828153	FG	On-Demand	Anodyne	CYP2J2	51	36
Cc1nc(C(C)C)oc1CSc1nnc(-c2ccc(C(C)C)cc2)o1	ZINC000450828162	FK	On-Demand	Anodyne	TYMS	0	45
Cc1nc(C(C)C)oc1CSc1nnc(-c2ccc(C(C)C)cc2)o1	ZINC000450828162	FK	On-Demand	Anodyne	GSK3B	17	42
Cc1nc(C(C)C)oc1CSc1nnc(-c2ccc(C(C)C)cc2)o1	ZINC000450828162	FK	On-Demand	Anodyne	GSK3A	45	40
Cc1nc(-c2ccccn2)nc(NC[C@H]2CCCC[C@@H]2O)c1C	ZINC000450828180	DF	On-Demand	Anodyne	METAP1	38	43
CCc1nc(C)c(CSc2nnc(Cc3cccc(F)c3)o2)o1	ZINC000450828186	EH	On-Demand	Anodyne	PTK2	0	48
COC1(CSc2nnc(-c3ccc(C(C)C)cc3)o2)CCC1	ZINC000450828187	DJ	On-Demand	Anodyne	TYMS	0	42
COC1(CSc2nnc(-c3ccc(C(C)C)cc3)o2)CCC1	ZINC000450828187	DJ	On-Demand	Anodyne	GSK3B	0	41
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450828202	GD	On-Demand	Bother	TAAR1	20	42
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000450828203	GD	On-Demand	Bother	TAAR1	20	42
COc1ccc(OCCC(C)(F)F)c(C(N)=O)c1	ZINC000450828227	CE	On-Demand	Anodyne	AKR1C2	45	35
CC(C)(C)[C@@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450828244	EH	On-Demand	Anodyne	CYP2J2	46	33
CC(C)(C)[C@H]1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450828245	EH	On-Demand	Anodyne	CYP2J2	46	33
O=C(CCCN1CCc2ncsc2C1)c1ccccc1	ZINC000450828261	CG	On-Demand	Anodyne	HTR5A	30	52
O=C(CCCN1CCc2ncsc2C1)c1ccccc1	ZINC000450828261	CG	On-Demand	Anodyne	CYP2J2	55	39
COc1ccc(OC[C@H](Cc2ccccc2)OC)c(C(N)=O)c1	ZINC000450828267	DE	On-Demand	Anodyne	ABCB1	33	41
COc1ccc(OC[C@H](Cc2ccccc2)OC)c(C(N)=O)c1	ZINC000450828267	DE	On-Demand	Anodyne	AKR1C2	49	35
COc1ccc(OC[C@H](Cc2ccccc2)OC)c(C(N)=O)c1	ZINC000450828267	DE	On-Demand	Anodyne	PDS	54	34
COc1ccc(OC[C@@H](Cc2ccccc2)OC)c(C(N)=O)c1	ZINC000450828268	DE	On-Demand	Anodyne	ABCB1	33	41
COc1ccc(OC[C@@H](Cc2ccccc2)OC)c(C(N)=O)c1	ZINC000450828268	DE	On-Demand	Anodyne	AKR1C2	49	35
COc1ccc(OC[C@@H](Cc2ccccc2)OC)c(C(N)=O)c1	ZINC000450828268	DE	On-Demand	Anodyne	PDS	54	34
COc1cccc2c(NC3C[C@@H]4CC[C@H](C3)N4C)cc(C)nc12	ZINC000450828286	DH	On-Demand	Anodyne	HTR3A	26	45
O=C(CS(=O)(=O)C1CC1)NCCCNc1cccc(F)c1	ZINC000450828290	DD	On-Demand	Anodyne	TBK1	21	41
Cc1cccc([C@H]2CCN(C(=O)c3ccc(Br)cc3C#N)C2)c1	ZINC000450828306	FI	On-Demand	Mild	FASN	40	34
Cc1cccc([C@H]2CCN(C(=O)c3ccc(Br)cc3C#N)C2)c1	ZINC000450828306	FI	On-Demand	Mild	HPGD	17	42
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(Br)cc3C#N)C2)c1	ZINC000450828307	FI	On-Demand	Mild	FASN	40	34
Cc1cccc([C@@H]2CCN(C(=O)c3ccc(Br)cc3C#N)C2)c1	ZINC000450828307	FI	On-Demand	Mild	HPGD	17	42
CCCOc1cccc(COc2ccc(OC)cc2C(N)=O)c1	ZINC000450828313	DG	On-Demand	Anodyne	MAOB	36	44
CCCOc1cccc(COc2ccc(OC)cc2C(N)=O)c1	ZINC000450828313	DG	On-Demand	Anodyne	PLK1	28	47
CCCOc1cccc(COc2ccc(OC)cc2C(N)=O)c1	ZINC000450828313	DG	On-Demand	Anodyne	MTNR1A	38	41
CCCOc1cccc(COc2ccc(OC)cc2C(N)=O)c1	ZINC000450828313	DG	On-Demand	Anodyne	ABCB1	23	45
COc1ccc(C2(CNC(=O)CS(=O)(=O)C3CC3)CCC2)cc1	ZINC000450828314	ED	On-Demand	Anodyne	KCNA3	39	40
COc1ccc(C2(CNC(=O)CS(=O)(=O)C3CC3)CCC2)cc1	ZINC000450828314	ED	On-Demand	Anodyne	MTNR1A	23	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](n2cnc3c2CCCC3)C1	ZINC000450828321	GI	On-Demand	Anodyne	CACNA1B	42	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](n2cnc3c2CCCC3)C1	ZINC000450828321	GI	On-Demand	Anodyne	LIPG	45	32
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](n2cnc3c2CCCC3)C1	ZINC000450828321	GI	On-Demand	Anodyne	L3MBTL3	48	38
Cc1ccccc1-c1noc(=O)n1C[C@@H]1CCC(F)(F)C1	ZINC000450828357	CG	On-Demand	Anodyne	Q8MHZ5_SHEEP	57	33
CCS(=O)(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1	ZINC000450828372	EF	On-Demand	Anodyne	HRH3	16	40
CCS(=O)(=O)c1ccc(CN2CCC([C@H]3CCCO3)CC2)cc1	ZINC000450828372	EF	On-Demand	Anodyne	SIGMAR1	19	40
CCS(=O)(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1	ZINC000450828373	EF	On-Demand	Anodyne	HRH3	16	40
CCS(=O)(=O)c1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1	ZINC000450828373	EF	On-Demand	Anodyne	SIGMAR1	19	40
Cc1ccccc1-c1noc(=O)n1C[C@H]1CCC(F)(F)C1	ZINC000450828375	CG	On-Demand	Anodyne	Q8MHZ5_SHEEP	57	33
COc1ccc(OCCC[C@@H](C)O)c(C(N)=O)c1	ZINC000450828377	CD	On-Demand	Anodyne	MTNR1B	24	41
COc1ccc(OCCC[C@@H](C)O)c(C(N)=O)c1	ZINC000450828377	CD	On-Demand	Anodyne	AKR1C2	40	33
COc1ccc(OCCC[C@H](C)O)c(C(N)=O)c1	ZINC000450828379	CD	On-Demand	Anodyne	MTNR1B	24	41
COc1ccc(OCCC[C@H](C)O)c(C(N)=O)c1	ZINC000450828379	CD	On-Demand	Anodyne	AKR1C2	40	33
O=C(NCCO)c1ccc(N2CC(c3cccc(Cl)c3)C2)nn1	ZINC000450828387	ED	On-Demand	Anodyne	SCD1	46	52
O=C(NCCO)c1ccc(N2CC(c3cccc(Cl)c3)C2)nn1	ZINC000450828387	ED	On-Demand	Anodyne	SCD	39	47
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450828389	GF	On-Demand	Anodyne	MMP13	66	38
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450828389	GF	On-Demand	Anodyne	ADAM17	66	38
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450828389	GF	On-Demand	Anodyne	MMP3	51	38
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450828389	GF	On-Demand	Anodyne	TGM2	40	33
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450828389	GF	On-Demand	Anodyne	MMP7	52	38
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450828389	GF	On-Demand	Anodyne	MMP1	62	38
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450828389	GF	On-Demand	Anodyne	F13A1	42	36
COC(=O)c1csc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)n1	ZINC000450828389	GF	On-Demand	Anodyne	NAMPT	28	41
CCCc1cc(N[C@H](C)c2nccn2CC)n2ncnc2n1	ZINC000450828399	CE	On-Demand	Anodyne	DHOD	0	44
CCCc1cc(N[C@@H](C)c2nccn2CC)n2ncnc2n1	ZINC000450828401	CE	On-Demand	Anodyne	DHOD	0	44
C[C@H](SCC1CCCCC1)C(=O)Nc1nccs1	ZINC000450828407	CH	On-Demand	Anodyne	MAP	0	44
C[C@H](SCC1CCCCC1)C(=O)Nc1nccs1	ZINC000450828407	CH	On-Demand	Anodyne	MAP1	125	44
C[C@H](SCC1CCCCC1)C(=O)Nc1nccs1	ZINC000450828407	CH	On-Demand	Anodyne	GCK	29	52
C[C@@H](SCC1CCCCC1)C(=O)Nc1nccs1	ZINC000450828408	CH	On-Demand	Anodyne	MAP	0	44
C[C@@H](SCC1CCCCC1)C(=O)Nc1nccs1	ZINC000450828408	CH	On-Demand	Anodyne	MAP1	125	44
C[C@@H](SCC1CCCCC1)C(=O)Nc1nccs1	ZINC000450828408	CH	On-Demand	Anodyne	GCK	29	52
CCC(=O)CCCN1CCC([C@@H]2CCCO2)CC1	ZINC000450828410	CF	On-Demand	Anodyne	CYP2J2	47	34
CCC(=O)CCCN1CCC([C@H]2CCCO2)CC1	ZINC000450828411	CF	On-Demand	Anodyne	CYP2J2	47	34
COCCOc1ccc(C#N)cc1NC(=O)CCCC(=O)C1CC1	ZINC000450828419	EF	On-Demand	Mild	PDEB1	0	40
CC[C@@H]1CN(CC)CCN1c1ncnc2[nH]ccc12	ZINC000450828422	CD	On-Demand	Anodyne	AKT2	46	44
CC[C@H]1CN(CC)CCN1c1ncnc2[nH]ccc12	ZINC000450828424	CD	On-Demand	Anodyne	AKT2	46	44
C[C@@H](Sc1ccc(S(C)(=O)=O)cc1)C(=O)C1CCOCC1	ZINC000450828426	EF	On-Demand	Anodyne	O49150_SOLTU	44	35
C[C@H](Sc1ccc(S(C)(=O)=O)cc1)C(=O)C1CCOCC1	ZINC000450828429	EF	On-Demand	Anodyne	O49150_SOLTU	44	35
CC(C)c1ccc(-c2nnc(SCC3CC(F)(F)C3)o2)cc1	ZINC000450828449	DJ	On-Demand	Anodyne	TYMS	0	46
CC(C)c1ccc(-c2nnc(SCC3CC(F)(F)C3)o2)cc1	ZINC000450828449	DJ	On-Demand	Anodyne	GSK3A	40	36
CC(=O)CCCCCSc1ccc(S(C)(=O)=O)cc1	ZINC000450828458	DG	On-Demand	Anodyne	LOX1.1	47	38
CC(=O)CCCCCSc1ccc(S(C)(=O)=O)cc1	ZINC000450828458	DG	On-Demand	Anodyne	O49150_SOLTU	52	38
CN1[C@H]2CC[C@H]1CC(N=c1[nH]c3ccccc3cc1CO)C2	ZINC000450828461	CE	On-Demand	Anodyne	GLRA1	55	47
COc1ccc(OCc2cc(C(C)(C)C)on2)c(C(N)=O)c1	ZINC000450828464	DF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
CCCOc1cccc(CN2CC[C@@](O)(C(N)=O)C2)c1	ZINC000450828472	CC	On-Demand	Anodyne	HRH2	37	44
CCCOc1cccc(CN2CC[C@@](O)(C(N)=O)C2)c1	ZINC000450828472	CC	On-Demand	Anodyne	NPFFR1	44	37
CCCOc1cccc(CN2CC[C@](O)(C(N)=O)C2)c1	ZINC000450828474	CC	On-Demand	Anodyne	HRH2	37	44
CCCOc1cccc(CN2CC[C@](O)(C(N)=O)C2)c1	ZINC000450828474	CC	On-Demand	Anodyne	NPFFR1	44	37
CCCOc1cccc(CSc2nnc(Cc3cccs3)o2)c1	ZINC000450828476	EJ	On-Demand	Anodyne	PTK2	0	46
CCCOc1cccc(CSc2nnc(Cc3cccs3)o2)c1	ZINC000450828476	EJ	On-Demand	Anodyne	CPB	0	46
COC(=O)[C@@H](C)NC(=O)c1ccc(NC2C[C@@H]3CC[C@H](C2)N3C)c([N+](=O)[O-])c1	ZINC000450828483	GD	On-Demand	Bother	GLRA1	40	30
COC(=O)[C@@H](C)NC(=O)c1ccc(NC2C[C@@H]3CC[C@H](C2)N3C)c([N+](=O)[O-])c1	ZINC000450828483	GD	On-Demand	Bother	TAAR1	20	41
COC(=O)[C@H](C)NC(=O)c1ccc(NC2C[C@@H]3CC[C@H](C2)N3C)c([N+](=O)[O-])c1	ZINC000450828485	GD	On-Demand	Bother	GLRA1	40	30
COC(=O)[C@H](C)NC(=O)c1ccc(NC2C[C@@H]3CC[C@H](C2)N3C)c([N+](=O)[O-])c1	ZINC000450828485	GD	On-Demand	Bother	TAAR1	20	41
Cc1nn(C)cc1CSc1nnc(Cc2ccccc2F)o1	ZINC000450828515	DG	On-Demand	Anodyne	PTK2	25	51
CC(C)c1noc([C@@H](NC(=O)c2ccc(-c3cnn(C)c3)o2)C2CCOCC2)n1	ZINC000450828538	GG	On-Demand	Anodyne	MMP13	0	42
CC(C)c1noc([C@H](NC(=O)c2ccc(-c3cnn(C)c3)o2)C2CCOCC2)n1	ZINC000450828539	GG	On-Demand	Anodyne	MMP13	0	42
C[C@@H](O)CCCN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450828551	CD	On-Demand	Anodyne	HSD17B2	127	41
C[C@@H](O)CCCN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450828554	CD	On-Demand	Anodyne	HSD17B2	127	41
C[C@H](O)CCCN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450828556	CD	On-Demand	Anodyne	HSD17B2	127	41
C[C@H](O)CCCN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450828558	CD	On-Demand	Anodyne	HSD17B2	127	41
C[C@H]1[C@@H](C)O[C@H](C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450828559	CG	On-Demand	Anodyne	DRD2	29	43
C[C@H]1[C@@H](C)O[C@H](C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450828559	CG	On-Demand	Anodyne	DRD4	0	46
C[C@H]1[C@@H](C)O[C@H](C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450828559	CG	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1[C@@H](C)O[C@H](C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450828559	CG	On-Demand	Anodyne	CYP2J2	52	37
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450828560	CG	On-Demand	Anodyne	DRD2	29	43
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450828560	CG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450828560	CG	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C	ZINC000450828560	CG	On-Demand	Anodyne	CYP2J2	52	37
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)[C@@H](C)O1	ZINC000450828561	CG	On-Demand	Anodyne	DRD2	29	43
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)[C@@H](C)O1	ZINC000450828561	CG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)[C@@H](C)O1	ZINC000450828561	CG	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)[C@H](C)[C@@H](C)O1	ZINC000450828561	CG	On-Demand	Anodyne	CYP2J2	52	37
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450828562	CG	On-Demand	Anodyne	DRD2	29	43
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450828562	CG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450828562	CG	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H]1O[C@H](C)CN(CCCC(=O)c2ccc(F)cc2)[C@H]1C	ZINC000450828562	CG	On-Demand	Anodyne	CYP2J2	52	37
CN1[C@H]2CC[C@H]1CC(Nc1ccc(C(=O)c3ccccc3)cc1[N+](=O)[O-])C2	ZINC000450828566	FH	On-Demand	Bother	GLRA1	45	34
COc1cc(CN2CCCN([C@H](C)CO)CC2)ccc1Cl	ZINC000450828586	DE	On-Demand	Anodyne	SIGMAR1	20	40
COc1cc(CN2CCCN([C@@H](C)CO)CC2)ccc1Cl	ZINC000450828587	DE	On-Demand	Anodyne	SIGMAR1	20	40
COc1ccc(C2(CNC(=O)Cc3scnc3-c3ccccc3)CCC2)cc1	ZINC000450828621	GJ	On-Demand	Anodyne	KCNA3	49	41
COc1ccc(C2(CNC(=O)Cc3scnc3-c3ccccc3)CCC2)cc1	ZINC000450828621	GJ	On-Demand	Anodyne	ACAT	0	50
COc1cc(CC(=O)N2CC[C@H](n3c(C)nc4c3CCCC4)C2)ccc1Cl	ZINC000450828626	GH	On-Demand	Anodyne	OPRK1	39	41
CCc1cc(=NC2C[C@@H]3CC[C@H](C2)N3C)c2ccccc2[nH]1	ZINC000450828635	CG	On-Demand	Anodyne	GLRA1	45	40
COc1cc(CC(=O)N2CC[C@@H](n3c(C)nc4c3CCCC4)C2)ccc1Cl	ZINC000450828640	GH	On-Demand	Anodyne	OPRK1	39	41
COC(=O)c1csc(CN2CCN(c3cncc4ccccc34)CC2)n1	ZINC000450828663	FF	On-Demand	Anodyne	HTR1A	28	42
C[C@@H](CO)N1CCCN(CCN(C)Cc2ccccc2)CC1	ZINC000450828664	DD	On-Demand	Anodyne	SIGMAR1	29	50
C[C@H](CO)N1CCCN(CCN(C)Cc2ccccc2)CC1	ZINC000450828665	DD	On-Demand	Anodyne	SIGMAR1	29	50
COC(=O)c1cccc(CN2CC(=O)N(C)[C@H]2c2ccccc2)c1Cl	ZINC000450828682	FG	On-Demand	Anodyne	P2RX7	42	40
COC(=O)c1cccc(CN2CC(=O)N(C)[C@@H]2c2ccccc2)c1Cl	ZINC000450828683	FG	On-Demand	Anodyne	P2RX7	42	40
COc1ccccc1Cc1nnc(SCc2cn(CC3CC3)nn2)o1	ZINC000450828684	FF	On-Demand	Anodyne	PTK2	23	49
COc1cc(CN2C[C@H](C)O[C@@H](CO)C2)ccc1Cl	ZINC000450828693	CD	On-Demand	Anodyne	DRD4	18	46
COc1cc(CN2C[C@H](C)O[C@H](CO)C2)ccc1Cl	ZINC000450828694	CD	On-Demand	Anodyne	DRD4	18	46
COc1cc(CN2C[C@@H](CO)O[C@H](C)C2)ccc1Cl	ZINC000450828695	CD	On-Demand	Anodyne	DRD4	18	46
COc1cc(CN2C[C@@H](C)O[C@@H](CO)C2)ccc1Cl	ZINC000450828696	CD	On-Demand	Anodyne	DRD4	18	46
CCN1CCCN(Cc2c(C)cccc2Cl)CC1=O	ZINC000450828718	CF	On-Demand	Anodyne	NOX1	49	33
CCN1CCCN(Cc2c(C)cccc2Cl)CC1=O	ZINC000450828718	CF	On-Demand	Anodyne	NOX5	46	33
C[C@@H](CCNC(=O)c1ccc(N2CCC2)nc1)N1CCCCC1	ZINC000450828733	DE	On-Demand	Anodyne	HPGDS	21	47
C[C@H](CCNC(=O)c1ccc(N2CCC2)nc1)N1CCCCC1	ZINC000450828734	DE	On-Demand	Anodyne	HPGDS	21	47
COc1cc2nc(N3CC[S@@](=O)C(C)(C)CC3)nc(N)c2cc1OC	ZINC000450828762	FD	On-Demand	Anodyne	ADRA1D	18	49
COc1cc2nc(N3CC[S@@](=O)C(C)(C)CC3)nc(N)c2cc1OC	ZINC000450828762	FD	On-Demand	Anodyne	ADRA1B	44	53
COc1cc2nc(N3CC[S@@](=O)C(C)(C)CC3)nc(N)c2cc1OC	ZINC000450828762	FD	On-Demand	Anodyne	CCR4	42	39
COc1cc2nc(N3CC[S@@](=O)C(C)(C)CC3)nc(N)c2cc1OC	ZINC000450828762	FD	On-Demand	Anodyne	EHMT2	66	41
COc1cc2nc(N3CC[S@](=O)C(C)(C)CC3)nc(N)c2cc1OC	ZINC000450828768	FD	On-Demand	Anodyne	ADRA1D	18	49
COc1cc2nc(N3CC[S@](=O)C(C)(C)CC3)nc(N)c2cc1OC	ZINC000450828768	FD	On-Demand	Anodyne	ADRA1B	44	53
COc1cc2nc(N3CC[S@](=O)C(C)(C)CC3)nc(N)c2cc1OC	ZINC000450828768	FD	On-Demand	Anodyne	CCR4	42	39
COc1cc2nc(N3CC[S@](=O)C(C)(C)CC3)nc(N)c2cc1OC	ZINC000450828768	FD	On-Demand	Anodyne	EHMT2	66	41
CN1[C@H]2CC[C@H]1CC(Nc1cnn(-c3ccc(Cl)cc3)c(=O)c1Cl)C2	ZINC000450828772	GH	On-Demand	Anodyne	SLC6A1	45	44
O=C(NCC1(CO)CCC1)c1cccnc1-n1cc(Br)cn1	ZINC000450828774	FD	On-Demand	Anodyne	HCN1	54	33
O=C(NCC1(CO)CCC1)c1cccnc1-n1cc(Br)cn1	ZINC000450828774	FD	On-Demand	Anodyne	HCN4	50	32
Cc1ccc(C(=O)NCC2(CO)CCC2)cc1C(=O)NCC1(CO)CCC1	ZINC000450828793	FD	On-Demand	Anodyne	MAPK14	15	41
Cc1ccc(C(=O)NCC2(CO)CCC2)cc1C(=O)NCC1(CO)CCC1	ZINC000450828793	FD	On-Demand	Anodyne	HCN1	49	30
Cc1ccc(C(=O)NCC2(CO)CCC2)cc1C(=O)NCC1(CO)CCC1	ZINC000450828793	FD	On-Demand	Anodyne	HCN4	47	30
COC1(CSc2nnc(Cc3ccccc3F)o2)CCC1	ZINC000450828800	DG	On-Demand	Anodyne	PTK2	16	41
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)nc1	ZINC000450828856	GJ	On-Demand	Anodyne	TYMS	0	45
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)nc1	ZINC000450828856	GJ	On-Demand	Anodyne	GSK3A	45	43
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)nc1	ZINC000450828856	GJ	On-Demand	Anodyne	ALOX15	47	43
Cc1ccnn1-c1ccccc1NC(=O)CC[C@H]1CCC(=O)N1	ZINC000450828888	DE	On-Demand	Anodyne	KCNQ2	41	34
CC[C@@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828897	CG	On-Demand	Anodyne	THRA	0	41
CC[C@@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828897	CG	On-Demand	Anodyne	DRD2	33	48
CC[C@@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828897	CG	On-Demand	Anodyne	DRD1	0	48
CC[C@@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828897	CG	On-Demand	Anodyne	DRD4	0	52
CC[C@@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828897	CG	On-Demand	Anodyne	ERG2	22	48
CC[C@@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828897	CG	On-Demand	Anodyne	SLC18A3	0	52
CC[C@@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828897	CG	On-Demand	Anodyne	CYP2J2	55	39
CC[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828898	CG	On-Demand	Anodyne	THRA	0	41
CC[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828898	CG	On-Demand	Anodyne	DRD2	33	48
CC[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828898	CG	On-Demand	Anodyne	DRD1	0	48
CC[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828898	CG	On-Demand	Anodyne	DRD4	0	52
CC[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828898	CG	On-Demand	Anodyne	ERG2	22	48
CC[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828898	CG	On-Demand	Anodyne	SLC18A3	0	52
CC[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)CCO1	ZINC000450828898	CG	On-Demand	Anodyne	CYP2J2	55	39
COc1ccc(CNC(=O)CCN2CCC([C@@H]3CCCO3)CC2)c(OC)c1	ZINC000450828910	GF	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC([C@@H]3CCCO3)CC2)c(OC)c1	ZINC000450828910	GF	On-Demand	Anodyne	HTR7	29	40
COc1ccc(CNC(=O)CCN2CCC([C@H]3CCCO3)CC2)c(OC)c1	ZINC000450828911	GF	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC([C@H]3CCCO3)CC2)c(OC)c1	ZINC000450828911	GF	On-Demand	Anodyne	HTR7	29	40
COc1ccc(OCCSC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000450828915	EE	On-Demand	Anodyne	MMP7	28	40
COc1ccc(OCCSC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000450828916	EE	On-Demand	Anodyne	MMP7	28	40
Cc1ccnn1-c1ccccc1NC(=O)CC[C@@H]1CCC(=O)N1	ZINC000450828921	DE	On-Demand	Anodyne	KCNQ2	41	34
COC1(CSc2ccc(S(C)(=O)=O)cc2)CCC1	ZINC000450828922	CF	On-Demand	Anodyne	PTGS2	20	43
COc1cc(CC(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450828923	FG	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450828923	FG	On-Demand	Anodyne	OPRK1	42	41
COc1cc(CC(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450828923	FG	On-Demand	Anodyne	CCR1	24	40
COc1cc(CC(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450828924	FG	On-Demand	Anodyne	OPRM1	0	40
COc1cc(CC(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450828924	FG	On-Demand	Anodyne	OPRK1	42	41
COc1cc(CC(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)ccc1Cl	ZINC000450828924	FG	On-Demand	Anodyne	CCR1	24	40
O=C(c1cc(N2CC(c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450828949	GI	On-Demand	Bother	L3MBTL1	0	40
COC(=O)c1ncn(C[C@@H](Cc2ccccc2)OC)n1	ZINC000450828951	CD	On-Demand	Anodyne	MME	47	34
COC(=O)c1ncn(C[C@@H](Cc2ccccc2)OC)n1	ZINC000450828951	CD	On-Demand	Anodyne	CYSP_TRYCR	42	34
COC(=O)c1ncn(C[C@@H](Cc2ccccc2)OC)n1	ZINC000450828951	CD	On-Demand	Anodyne	CAPN1	46	34
COC(=O)c1ncn(C[C@@H](Cc2ccccc2)OC)n1	ZINC000450828951	CD	On-Demand	Anodyne	CAPN2	54	31
COC(=O)c1ccc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)cc1	ZINC000450828952	GE	On-Demand	Anodyne	ITGA4	45	35
COC(=O)c1ccc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)cc1	ZINC000450828952	GE	On-Demand	Anodyne	MBTPS1	45	33
COC(=O)c1ncn(C[C@H](Cc2ccccc2)OC)n1	ZINC000450828953	CD	On-Demand	Anodyne	MME	47	34
COC(=O)c1ncn(C[C@H](Cc2ccccc2)OC)n1	ZINC000450828953	CD	On-Demand	Anodyne	CYSP_TRYCR	42	34
COC(=O)c1ncn(C[C@H](Cc2ccccc2)OC)n1	ZINC000450828953	CD	On-Demand	Anodyne	CAPN1	46	34
COC(=O)c1ncn(C[C@H](Cc2ccccc2)OC)n1	ZINC000450828953	CD	On-Demand	Anodyne	CAPN2	54	31
COC(=O)c1ccc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)cc1	ZINC000450828954	GE	On-Demand	Anodyne	ITGA4	45	35
COC(=O)c1ccc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)cc1	ZINC000450828954	GE	On-Demand	Anodyne	MBTPS1	45	33
FC(F)(F)c1nnc(N2CCCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450828965	GH	On-Demand	Anodyne	SCD1	31	45
FC(F)(F)c1nnc(N2CCCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450828965	GH	On-Demand	Anodyne	SCD	19	45
O=C(c1cccc2c1CCCC2)N1CC[C@H](n2cnc3c2CCCC3)C1	ZINC000450828975	EH	On-Demand	Anodyne	L3MBTL3	59	38
OCCN(Cc1ccccc1OC1CC1)C1CCC1	ZINC000450828980	CF	On-Demand	Anodyne	SLC5A4	52	33
O=C(c1cccc2c1CCCC2)N1CC[C@@H](n2cnc3c2CCCC3)C1	ZINC000450828985	EH	On-Demand	Anodyne	L3MBTL3	59	38
CS(=O)(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)c(F)c1	ZINC000450829014	EG	On-Demand	Anodyne	PTGS2	25	40
CS(=O)(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)c(F)c1	ZINC000450829014	EG	On-Demand	Anodyne	SLC6A9	0	42
CCC(CC)Oc1ccc(C(=O)NC[C@@H]2CC23CCOCC3)cc1	ZINC000450829045	EH	On-Demand	Anodyne	KCNQ1	0	44
CCC(CC)Oc1ccc(C(=O)NC[C@H]2CC23CCOCC3)cc1	ZINC000450829047	EH	On-Demand	Anodyne	KCNQ1	0	44
Cc1ccccc1-c1noc(=O)n1C[C@H]1CCCC1(F)F	ZINC000450829072	CG	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	31
Cc1ccccc1-c1noc(=O)n1C[C@@H]1CCCC1(F)F	ZINC000450829073	CG	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	31
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	ACE	43	39
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	SSTR2	40	34
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	MME	29	46
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	PGC	57	33
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	PFDN6	0	40
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	SCN9A	22	43
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	REN	47	37
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	FPR1	42	35
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829080	GE	On-Demand	Anodyne	POL	0	40
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	ACE	43	39
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	SSTR2	40	34
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	MME	29	46
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	PGC	57	33
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	PFDN6	0	40
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	SCN9A	22	43
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	REN	47	37
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	FPR1	42	35
CC(C)[C@@H](C(=O)OC(C)(C)C)N1CC[C@H](NC[C@H](O)Cc2ccccc2)C1=O	ZINC000450829082	GE	On-Demand	Anodyne	POL	0	40
CCOC(=O)c1ccc(CSc2nnc(Cc3ccccc3OC)o2)nc1	ZINC000450829099	GH	On-Demand	Anodyne	PTK2	0	46
CN1CCN(c2nc3ccccc3nc2NC2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450829117	FE	On-Demand	Anodyne	HTR3A	44	49
CN1CCN(c2nc3ccccc3nc2NC2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450829117	FE	On-Demand	Anodyne	HRH4	27	49
COC[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@H](C)O1	ZINC000450829129	FG	On-Demand	Anodyne	CYP2J2	52	36
COC[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)O1	ZINC000450829131	FG	On-Demand	Anodyne	CYP2J2	52	36
COC[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)O1	ZINC000450829132	FG	On-Demand	Anodyne	CYP2J2	52	36
COC[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@H](C)O1	ZINC000450829134	FG	On-Demand	Anodyne	CYP2J2	52	36
COC1(CSc2nnc(Cc3cccc(F)c3)o2)CCC1	ZINC000450829135	DG	On-Demand	Anodyne	PTK2	15	43
COc1nccc(CSc2nnc(Cc3ccccc3OC)o2)n1	ZINC000450829139	EF	On-Demand	Anodyne	PTK2	0	49
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829141	CF	On-Demand	Anodyne	THRA	0	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829141	CF	On-Demand	Anodyne	DRD4	0	41
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829141	CF	On-Demand	Anodyne	SLC6A1	45	34
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829141	CF	On-Demand	Anodyne	SLC6A3	30	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829141	CF	On-Demand	Anodyne	PREP	24	42
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829141	CF	On-Demand	Anodyne	CYP2J2	59	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829143	CF	On-Demand	Anodyne	THRA	0	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829143	CF	On-Demand	Anodyne	DRD4	0	41
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829143	CF	On-Demand	Anodyne	SLC6A1	45	34
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829143	CF	On-Demand	Anodyne	SLC6A3	30	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829143	CF	On-Demand	Anodyne	PREP	24	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829143	CF	On-Demand	Anodyne	CYP2J2	59	42
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829145	CF	On-Demand	Anodyne	THRA	0	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829145	CF	On-Demand	Anodyne	DRD4	0	41
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829145	CF	On-Demand	Anodyne	SLC6A1	45	34
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829145	CF	On-Demand	Anodyne	SLC6A3	30	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829145	CF	On-Demand	Anodyne	PREP	24	42
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]1C	ZINC000450829145	CF	On-Demand	Anodyne	CYP2J2	59	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829148	CF	On-Demand	Anodyne	THRA	0	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829148	CF	On-Demand	Anodyne	DRD4	0	41
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829148	CF	On-Demand	Anodyne	SLC6A1	45	34
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829148	CF	On-Demand	Anodyne	SLC6A3	30	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829148	CF	On-Demand	Anodyne	PREP	24	42
COC(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)[C@H]1C	ZINC000450829148	CF	On-Demand	Anodyne	CYP2J2	59	42
C[C@@]1(c2cccc(C(N)=O)c2)NC(=O)N(CC2CC(F)(F)C2)C1=O	ZINC000450829151	ED	In-Stock	Anodyne	F11	42	34
C[C@]1(c2cccc(C(N)=O)c2)NC(=O)N(CC2CC(F)(F)C2)C1=O	ZINC000450829154	ED	In-Stock	Anodyne	F11	42	34
CC(C)c1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450829156	GJ	On-Demand	Anodyne	TYMS	0	42
CC(C)c1ccc(-c2nnc(SCc3ccn(CC(F)(F)F)n3)o2)cc1	ZINC000450829156	GJ	On-Demand	Anodyne	GSK3A	40	37
CCCOc1cccc(Cn2cnc(C(=O)OC)n2)c1	ZINC000450829182	CD	On-Demand	Anodyne	HRH2	30	42
CCc1nc(C)c(CSc2nnc(-c3ccc(C(C)C)cc3)o2)o1	ZINC000450829194	EK	On-Demand	Anodyne	TYMS	0	46
CCc1nc(C)c(CSc2nnc(-c3ccc(C(C)C)cc3)o2)o1	ZINC000450829194	EK	On-Demand	Anodyne	GSK3B	15	41
CCc1nc(C)c(CSc2nnc(-c3ccc(C(C)C)cc3)o2)o1	ZINC000450829194	EK	On-Demand	Anodyne	GSK3A	42	39
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[S@@](=O)C(C)(C)CC1	ZINC000450829214	GG	On-Demand	Anodyne	ATP4A	19	49
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[S@](=O)C(C)(C)CC1	ZINC000450829215	GG	On-Demand	Anodyne	ATP4A	19	49
COC(=O)c1cnc(NC2C[C@@H]3CC[C@H](C2)N3C)nc1	ZINC000450829261	CD	On-Demand	Anodyne	GLRA1	51	44
COc1ccc(CNC(=O)CCN(CCO)C2CCC2)c(OC)c1	ZINC000450829295	ED	On-Demand	Anodyne	MTNR1A	52	35
COc1cccc(CSCCC(=O)NC(=O)NCCC(F)(F)F)c1	ZINC000450829303	FG	On-Demand	Anodyne	CACNA2D1	0	49
COc1cccc(CSCCC(=O)NC(=O)NCCC(F)(F)F)c1	ZINC000450829303	FG	On-Demand	Anodyne	MTNR1A	50	37
COc1cccc(CSCCC(=O)NC(=O)NCCC(F)(F)F)c1	ZINC000450829303	FG	On-Demand	Anodyne	MTNR1B	43	41
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(Cc2cccc(C)n2)C1	ZINC000450829322	FD	On-Demand	Anodyne	PDE8A	0	40
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(Cc2cccc(C)n2)C1	ZINC000450829326	FD	On-Demand	Anodyne	PDE8A	0	40
CCS(=O)(=O)c1ccc(CSCc2cccc(OC)c2)cc1	ZINC000450829339	EH	On-Demand	Anodyne	MMP13	17	43
CCS(=O)(=O)c1ccc(CSCc2cccc(OC)c2)cc1	ZINC000450829339	EH	On-Demand	Anodyne	MTNR1A	24	40
CCS(=O)(=O)c1ccc(CSCc2cccc(OC)c2)cc1	ZINC000450829339	EH	On-Demand	Anodyne	MTNR1B	23	40
CCC[C@]1(C)C(=O)NCCN1CCCC(=O)c1ccccc1	ZINC000450829352	DF	On-Demand	Anodyne	DRD2	28	43
CCC[C@]1(C)C(=O)NCCN1CCCC(=O)c1ccccc1	ZINC000450829352	DF	On-Demand	Anodyne	CYP2J2	51	37
CCC[C@@]1(C)C(=O)NCCN1CCCC(=O)c1ccccc1	ZINC000450829354	DF	On-Demand	Anodyne	DRD2	28	43
CCC[C@@]1(C)C(=O)NCCN1CCCC(=O)c1ccccc1	ZINC000450829354	DF	On-Demand	Anodyne	CYP2J2	51	37
COC(=O)COc1ccc(N(C)C(=O)[C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1	ZINC000450829361	EG	On-Demand	Anodyne	FASN	45	42
COC(=O)COc1ccc(N(C)C(=O)[C@@H]2CC[C@@H](C)[C@H](C)C2)cc1	ZINC000450829363	EG	On-Demand	Anodyne	FASN	45	42
COC(=O)COc1ccc(N(C)C(=O)[C@@H]2CC[C@H](C)[C@H](C)C2)cc1	ZINC000450829365	EG	On-Demand	Anodyne	FASN	45	42
COC(=O)COc1ccc(N(C)C(=O)[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1	ZINC000450829366	EG	On-Demand	Anodyne	FASN	45	42
CC(=O)CCCCCOc1nc(C)no1	ZINC000450829406	BD	On-Demand	Anodyne	PLA2G4B	40	30
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450829409	EH	On-Demand	Anodyne	FASN	44	51
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450829409	EH	On-Demand	Anodyne	L3MBTL1	0	40
Cc1cc(C)cc([C@@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450829409	EH	On-Demand	Anodyne	L3MBTL3	58	40
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450829419	EH	On-Demand	Anodyne	FASN	44	51
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450829419	EH	On-Demand	Anodyne	L3MBTL1	0	40
Cc1cc(C)cc([C@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)c1	ZINC000450829419	EH	On-Demand	Anodyne	L3MBTL3	58	40
CNS(=O)(=O)NCC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450829425	EC	On-Demand	Anodyne	ACAT	0	49
C[C@H](SCn1cccn1)c1ccc(Cl)cc1	ZINC000450829426	CH	On-Demand	Anodyne	CYP51	0	40
C[C@@H](SCn1cccn1)c1ccc(Cl)cc1	ZINC000450829427	CH	On-Demand	Anodyne	CYP51	0	40
CCOC(=O)c1cccnc1N1CC(c2ccc(Cl)cc2)C1	ZINC000450829446	DH	On-Demand	Anodyne	P2RY12	47	39
CN(c1ccc(S(=O)(=O)NCC2CC2)cn1)[C@H](CO)CC(C)(C)C	ZINC000450829447	FE	On-Demand	Anodyne	NPY1R	40	33
CN(c1ccc(S(=O)(=O)NCC2CC2)cn1)[C@@H](CO)CC(C)(C)C	ZINC000450829450	FE	On-Demand	Anodyne	NPY1R	40	33
COc1ccc(OCC2(C#N)CCC2)c(C(N)=O)c1	ZINC000450829452	CD	On-Demand	Mild	PDEB1	0	40
CCCc1nc(C)c(CSc2nnc(Cc3cccc(F)c3)o2)o1	ZINC000450829468	EI	On-Demand	Anodyne	PTK2	15	46
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	DRD4	48	51
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	ACHE	23	43
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	SLC6A1	0	49
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	DRD3	27	51
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	HTR3A	0	45
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	HTR4	57	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	SIGMAR1	33	43
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	SSTR5	60	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	CCR3	43	45
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	UTS2R	32	40
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	MLNR	40	34
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	CXCR3	25	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	MCHR1	35	46
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829493	DF	On-Demand	Anodyne	CCR8	24	40
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	DRD4	48	51
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	ACHE	23	43
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	SLC6A1	0	49
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	DRD3	27	51
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	HTR3A	0	45
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	HTR4	57	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	SIGMAR1	33	43
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	SSTR5	60	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	CCR3	43	45
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	UTS2R	32	40
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	MLNR	40	34
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	CXCR3	25	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	MCHR1	35	46
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829494	DF	On-Demand	Anodyne	CCR8	24	40
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	DRD4	48	51
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	ACHE	23	43
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	SLC6A1	0	49
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	DRD3	27	51
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	HTR3A	0	45
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	HTR4	57	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	SIGMAR1	33	43
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	SSTR5	60	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	CCR3	43	45
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	UTS2R	32	40
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	MLNR	40	34
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	CXCR3	25	41
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	MCHR1	35	46
COC(=O)[C@@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1C	ZINC000450829495	DF	On-Demand	Anodyne	CCR8	24	40
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	DRD4	48	51
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	ACHE	23	43
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	SLC6A1	0	49
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	DRD3	27	51
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	HTR3A	0	45
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	HTR4	57	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	SIGMAR1	33	43
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	SSTR5	60	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	CCR3	43	45
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	UTS2R	32	40
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	MLNR	40	34
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	CXCR3	25	41
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	MCHR1	35	46
COC(=O)[C@H]1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450829496	DF	On-Demand	Anodyne	CCR8	24	40
O=c1c(Cl)c(NC[C@H]2CCCC[C@@H]2O)cnn1-c1ccc(F)cc1F	ZINC000450829504	FG	On-Demand	Anodyne	MAPK14	16	44
COc1cc(CN2C(=O)NC3(CCOCC3)C2=O)ccc1Cl	ZINC000450829527	DD	On-Demand	Anodyne	PDE7A	0	40
COc1cccc(N2CC[S@](=O)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000450829555	DE	On-Demand	Bother	ADRA1D	27	40
COc1cccc(N2CC[S@](=O)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000450829555	DE	On-Demand	Bother	ADRA1B	26	40
COc1cccc(N2CC[S@@](=O)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000450829557	DE	On-Demand	Bother	ADRA1D	27	40
COc1cccc(N2CC[S@@](=O)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000450829557	DE	On-Demand	Bother	ADRA1B	26	40
Cc1ccnc(-c2noc(CSc3nnc(-c4ccc(C(C)C)cc4)o3)n2)c1	ZINC000450829584	GJ	On-Demand	Anodyne	TYMS	0	44
Cc1ccnc(-c2noc(CSc3nnc(-c4ccc(C(C)C)cc4)o3)n2)c1	ZINC000450829584	GJ	On-Demand	Anodyne	TNKS2	15	40
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@]1=O	ZINC000450829605	FI	On-Demand	Anodyne	PRKCD	22	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@]1=O	ZINC000450829605	FI	On-Demand	Anodyne	PRKCE	20	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@]1=O	ZINC000450829605	FI	On-Demand	Anodyne	PRKCH	23	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@]1=O	ZINC000450829605	FI	On-Demand	Anodyne	PRKCA	19	40
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@]1=O	ZINC000450829605	FI	On-Demand	Anodyne	PRKCB	27	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@]1=O	ZINC000450829605	FI	On-Demand	Anodyne	PRKCQ	17	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@@]1=O	ZINC000450829607	FI	On-Demand	Anodyne	PRKCD	22	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@@]1=O	ZINC000450829607	FI	On-Demand	Anodyne	PRKCE	20	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@@]1=O	ZINC000450829607	FI	On-Demand	Anodyne	PRKCH	23	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@@]1=O	ZINC000450829607	FI	On-Demand	Anodyne	PRKCA	19	40
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@@]1=O	ZINC000450829607	FI	On-Demand	Anodyne	PRKCB	27	42
CC1(C)CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC[S@@]1=O	ZINC000450829607	FI	On-Demand	Anodyne	PRKCQ	17	42
COC(=O)COc1ccc(N(C)C(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450829629	GH	On-Demand	Anodyne	PPARA	18	45
COC(=O)COc1ccc(N(C)C(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450829629	GH	On-Demand	Anodyne	PPARD	59	49
CC(C)(CC(=O)Cn1c(-c2ccc([N+](=O)[O-])cc2)noc1=O)C1CC1	ZINC000450829630	EF	On-Demand	Bother	SLC27A4	49	33
COc1ccc(CNC(=O)CCN2CC(C)(C)OC3(CCCC3)C2)c(OC)c1	ZINC000450829651	GG	On-Demand	Anodyne	MTNR1A	37	41
COc1ccc(CNC(=O)CCN2CC(C)(C)OC3(CCCC3)C2)c(OC)c1	ZINC000450829651	GG	On-Demand	Anodyne	MTNR1B	29	41
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829668	EE	On-Demand	Anodyne	HRH3	45	41
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829668	EE	On-Demand	Anodyne	MMP13	53	44
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829668	EE	On-Demand	Anodyne	ADAM17	45	44
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829668	EE	On-Demand	Anodyne	MMP3	40	44
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829668	EE	On-Demand	Anodyne	MMP7	53	42
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829668	EE	On-Demand	Anodyne	MMP1	48	42
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829668	EE	On-Demand	Anodyne	PSMB2	46	35
C[C@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829668	EE	On-Demand	Anodyne	PSMB1	41	40
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829669	EE	On-Demand	Anodyne	HRH3	45	41
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829669	EE	On-Demand	Anodyne	MMP13	53	44
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829669	EE	On-Demand	Anodyne	ADAM17	45	44
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829669	EE	On-Demand	Anodyne	MMP3	40	44
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829669	EE	On-Demand	Anodyne	MMP7	53	42
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829669	EE	On-Demand	Anodyne	MMP1	48	42
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829669	EE	On-Demand	Anodyne	PSMB2	46	35
C[C@@H](O)CCCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450829669	EE	On-Demand	Anodyne	PSMB1	41	40
CN1[C@H]2CC[C@H]1CC(N=c1[nH]c(-c3ccccc3)cs1)C2	ZINC000450829670	CG	On-Demand	Anodyne	GLRA1	42	32
Cc1ccc(C(=O)NCCCNc2cccc(F)c2)c(C(C)C)n1	ZINC000450829673	EH	On-Demand	Anodyne	TBK1	17	42
COc1ccc(C2(CNC(=O)C3(Cc4ccccc4)CCOCC3)CCC2)cc1	ZINC000450829675	GI	On-Demand	Anodyne	KCNA3	48	43
COc1ccc(C2(CNC(=O)C3(Cc4ccccc4)CCOCC3)CCC2)cc1	ZINC000450829675	GI	On-Demand	Anodyne	ICMT	18	41
COc1ccc(C2(CNC(=O)C3(Cc4ccccc4)CCOCC3)CCC2)cc1	ZINC000450829675	GI	On-Demand	Anodyne	ACAT	0	53
COc1ccc(C2(CNC(=O)C3(Cc4ccccc4)CCOCC3)CCC2)cc1	ZINC000450829675	GI	On-Demand	Anodyne	SLC12A5	30	40
C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c2nccn21	ZINC000450829682	EH	On-Demand	Bother	AADAC	0	44
C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c2nccn21	ZINC000450829684	EH	On-Demand	Bother	AADAC	0	44
C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c2nccn21	ZINC000450829686	EH	On-Demand	Bother	AADAC	0	44
C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c2nccn21	ZINC000450829688	EH	On-Demand	Bother	AADAC	0	44
COc1ccc(OCC[C@@H]2CCOC2)c(C(N)=O)c1	ZINC000450829712	CD	On-Demand	Anodyne	PDEC	0	40
COc1ccc(OCC[C@H]2CCOC2)c(C(N)=O)c1	ZINC000450829714	CD	On-Demand	Anodyne	PDEC	0	40
CC(=O)CCCCCOc1ccc2c(c1)CCCC2=O	ZINC000450829716	CH	On-Demand	Anodyne	PLA2G4B	54	33
CN(CCCC(=O)c1ccc(F)cc1)[C@@H]1CC[C@@H](O)CC1	ZINC000450829720	CG	On-Demand	Anodyne	DRD4	0	43
Cc1[nH]c2ccccc2c(=NC2C[C@@H]3CC[C@H](C2)N3C)c1C	ZINC000450829730	CG	On-Demand	Anodyne	GLRA1	43	37
CCS(=O)(=O)c1ccc(COc2ccc([N+](=O)[O-])cc2OC)cc1	ZINC000450829747	FF	On-Demand	Bother	CYP19A1	0	57
CN1[C@H]2CC[C@H]1CC(Nc1ccc(C(=O)N3CCc4ccccc43)cn1)C2	ZINC000450829748	FG	On-Demand	Anodyne	AVPR2	107	44
CN1[C@H]2CC[C@H]1CC(Nc1ccc(C(=O)N3CCc4ccccc43)cn1)C2	ZINC000450829748	FG	On-Demand	Anodyne	AVPR1A	73	44
CN1[C@H]2CC[C@H]1CC(Nc1ccc(C(=O)N3CCc4ccccc43)cn1)C2	ZINC000450829748	FG	On-Demand	Anodyne	GLRA1	42	37
CN(c1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](CO)CC(C)(C)C	ZINC000450829755	FE	On-Demand	Anodyne	GCK	50	31
CN(c1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](CO)CC(C)(C)C	ZINC000450829755	FE	On-Demand	Anodyne	GCKR	47	32
CN(c1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@@H](CO)CC(C)(C)C	ZINC000450829758	FE	On-Demand	Anodyne	GCK	50	31
CN(c1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@@H](CO)CC(C)(C)C	ZINC000450829758	FE	On-Demand	Anodyne	GCKR	47	32
COc1ccc(OCCSCc2nc(-c3cc(C)ccn3)no2)cc1	ZINC000450829791	FH	On-Demand	Anodyne	WNT3A	21	40
COc1ccc(OCCSCc2nc(-c3cc(C)ccn3)no2)cc1	ZINC000450829791	FH	On-Demand	Anodyne	AXIN2	0	41
CN1[C@H]2CC[C@H]1CC(Nc1c(C#N)cccc1C#N)C2	ZINC000450829794	CE	On-Demand	Mild	SLC6A3	15	40
CN1[C@H]2CC[C@H]1CC(Nc1c(C#N)cccc1C#N)C2	ZINC000450829794	CE	On-Demand	Mild	GLRA1	42	32
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	MMP26	0	40
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	MMP13	56	49
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	TRY2_BOVIN	67	37
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	ADAM17	66	45
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	MMP15	0	40
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	MMP16	0	40
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	MMP3	40	39
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	GYS1	46	38
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	EPHX2	15	45
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	PKM	19	40
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	ACR	19	41
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	TGM2	45	38
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	MMP7	50	39
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	ADAMTS4	54	45
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	MMP1	58	44
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	F13A1	69	38
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	FFAR1	40	35
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	AKR1C3	53	37
CC(=O)c1cccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450829808	FH	On-Demand	Anodyne	NAMPT	33	44
COC(=O)c1coc(CN2CCC[C@]2(CO)Cc2ccccc2)n1	ZINC000450829837	EE	On-Demand	Anodyne	SLC12A5	68	39
COC(=O)c1coc(CN2CCC[C@@]2(CO)Cc2ccccc2)n1	ZINC000450829838	EE	On-Demand	Anodyne	SLC12A5	68	39
COC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)O1	ZINC000450829841	FD	On-Demand	Anodyne	MTNR1A	58	36
COC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)O1	ZINC000450829841	FD	On-Demand	Anodyne	MTNR1B	46	35
COC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)O1	ZINC000450829842	FD	On-Demand	Anodyne	MTNR1A	58	36
COC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)O1	ZINC000450829842	FD	On-Demand	Anodyne	MTNR1B	46	35
COC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H](C)O1	ZINC000450829844	FD	On-Demand	Anodyne	MTNR1A	58	36
COC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H](C)O1	ZINC000450829844	FD	On-Demand	Anodyne	MTNR1B	46	35
COC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H](C)O1	ZINC000450829845	FD	On-Demand	Anodyne	MTNR1A	58	36
COC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H](C)O1	ZINC000450829845	FD	On-Demand	Anodyne	MTNR1B	46	35
COc1cc(CN2CCC([C@@H]3CCCO3)CC2)ccc1Cl	ZINC000450829854	DH	On-Demand	Anodyne	DRD4	28	40
COc1cc(CN2CCC([C@H]3CCCO3)CC2)ccc1Cl	ZINC000450829855	DH	On-Demand	Anodyne	DRD4	34	44
COc1cc(CN2CCC([C@H]3CCCO3)CC2)ccc1Cl	ZINC000450829855	DH	On-Demand	Anodyne	SSTR5	65	41
COc1cc(CN2CCC([C@H]3CCCO3)CC2)ccc1Cl	ZINC000450829855	DH	On-Demand	Anodyne	MCHR1	17	44
CN(c1cc(NCC2CC2)ncn1)[C@@H](CO)CC(C)(C)C	ZINC000450829878	CF	On-Demand	Anodyne	GPR39	0	40
CN(c1cc(NCC2CC2)ncn1)[C@H](CO)CC(C)(C)C	ZINC000450829879	CF	On-Demand	Anodyne	GPR39	0	40
C[C@@H](c1ccc(CN2CC[C@@](O)(C(N)=O)C2)cc1)C(F)(F)F	ZINC000450829888	DD	On-Demand	Anodyne	NPFFR1	46	33
C[C@@H](c1ccc(CN2CC[C@](O)(C(N)=O)C2)cc1)C(F)(F)F	ZINC000450829890	DD	On-Demand	Anodyne	NPFFR1	46	33
C[C@H](c1ccc(CN2CC[C@](O)(C(N)=O)C2)cc1)C(F)(F)F	ZINC000450829892	DD	On-Demand	Anodyne	NPFFR1	46	33
C[C@H](c1ccc(CN2CC[C@@](O)(C(N)=O)C2)cc1)C(F)(F)F	ZINC000450829894	DD	On-Demand	Anodyne	NPFFR1	46	33
COC(=O)c1coc(CN2CCc3c(cccc3C(C)C)C2)n1	ZINC000450829897	DG	On-Demand	Anodyne	NOD2	40	36
CCCCNc1cc(N2CC[S@@](=O)C(C)(C)CC2)nc(N)n1	ZINC000450829912	ED	On-Demand	Anodyne	HRH4	22	43
CCCCNc1cc(N2CC[S@](=O)C(C)(C)CC2)nc(N)n1	ZINC000450829914	ED	On-Demand	Anodyne	HRH4	22	43
COc1ccc(CNC(=O)CCN2CC[C@H](C(F)(F)F)C2(C)C)c(OC)c1	ZINC000450829956	GG	On-Demand	Anodyne	MTNR1A	41	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C(F)(F)F)C2(C)C)c(OC)c1	ZINC000450829957	GG	On-Demand	Anodyne	MTNR1A	41	36
O=S(=O)(c1cccnc1NC[C@H]1CCCC[C@@H]1O)N1CCCCC1	ZINC000450829965	FE	On-Demand	Anodyne	EPHX2	21	42
Cc1cccc(CN2CCN(c3cncc4ccccc34)CC2)n1	ZINC000450829969	DG	On-Demand	Anodyne	HTR1B	31	40
COc1ccc(OCC[C@@H](C)O)c(C(N)=O)c1	ZINC000450830021	BC	On-Demand	Anodyne	AKR1C2	41	33
COc1ccc(OCC[C@H](C)O)c(C(N)=O)c1	ZINC000450830022	BC	On-Demand	Anodyne	AKR1C2	41	33
CS(=O)(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)cc1	ZINC000450830027	DG	On-Demand	Anodyne	PTGS2	32	45
O=C(CCCN1CCc2ncsc2C1)c1ccc(Br)cc1	ZINC000450830046	FH	On-Demand	Anodyne	CYP2J2	47	33
COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000450830069	FG	On-Demand	Bother	SLC6A3	17	41
COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000450830069	FG	On-Demand	Bother	GLRA1	42	31
CCCNC(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nc1	ZINC000450830077	EG	On-Demand	Anodyne	SLC6A1	0	42
CCCNC(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nc1	ZINC000450830077	EG	On-Demand	Anodyne	HDAC1	0	42
COc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)ccc1Cl	ZINC000450830085	GG	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)ccc1Cl	ZINC000450830085	GG	On-Demand	Anodyne	OPRK1	44	40
COc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)ccc1Cl	ZINC000450830085	GG	On-Demand	Anodyne	ITGA4	17	40
COc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)ccc1Cl	ZINC000450830085	GG	On-Demand	Anodyne	MBTPS1	59	35
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)ccc1Cl	ZINC000450830087	GG	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)ccc1Cl	ZINC000450830087	GG	On-Demand	Anodyne	OPRK1	44	40
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)ccc1Cl	ZINC000450830087	GG	On-Demand	Anodyne	ITGA4	17	40
COc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)ccc1Cl	ZINC000450830087	GG	On-Demand	Anodyne	MBTPS1	59	35
Cc1cccc(Cl)c1CN1CCC(NS(=O)(=O)NCC(F)(F)F)CC1	ZINC000450830089	GF	On-Demand	Anodyne	SFRP1	49	36
CCOC(=O)COc1ccc(NC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450830142	GH	On-Demand	Anodyne	PRNP	22	40
CCOC(=O)COc1ccc(NC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450830142	GH	On-Demand	Anodyne	MCHR1	18	41
CCOC(=O)COc1ccc(NC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450830142	GH	On-Demand	Anodyne	ATR	47	33
CC[C@@]1(C)CN(CCC(=O)NCc2ccc(OC)cc2OC)CCO1	ZINC000450830165	FE	On-Demand	Anodyne	MTNR1A	55	39
CC[C@@]1(C)CN(CCC(=O)NCc2ccc(OC)cc2OC)CCO1	ZINC000450830165	FE	On-Demand	Anodyne	MTNR1B	43	39
CC[C@]1(C)CN(CCC(=O)NCc2ccc(OC)cc2OC)CCO1	ZINC000450830166	FE	On-Demand	Anodyne	MTNR1A	55	39
CC[C@]1(C)CN(CCC(=O)NCc2ccc(OC)cc2OC)CCO1	ZINC000450830166	FE	On-Demand	Anodyne	MTNR1B	43	39
CC[C@H]1CN(CC)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450830202	EF	On-Demand	Anodyne	SCD1	35	43
CC[C@@H]1CN(CC)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450830203	EF	On-Demand	Anodyne	SCD1	35	43
Cc1ccc(C)c(CS[C@H](C)C(=O)Nc2nccs2)c1	ZINC000450830215	DI	On-Demand	Anodyne	MAP1	116	39
CC[C@@]1(C)CN(CCN(C)Cc2ccccc2)CCO1	ZINC000450830228	CF	On-Demand	Anodyne	SIGMAR1	19	43
Cc1ccc(C)c(CS[C@@H](C)C(=O)Nc2nccs2)c1	ZINC000450830229	DI	On-Demand	Anodyne	MAP1	116	39
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)[C@@H]1CO	ZINC000450830262	CE	On-Demand	Anodyne	SPHK2	43	31
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)[C@@H]1CO	ZINC000450830264	CE	On-Demand	Anodyne	SPHK2	43	31
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1CO	ZINC000450830266	CE	On-Demand	Anodyne	SPHK2	43	31
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)[C@H]1CO	ZINC000450830267	CE	On-Demand	Anodyne	SPHK2	43	31
COc1ccc(C[C@]2(C)NC(=O)N(Cc3ccc(C(C)=O)cc3)C2=O)cc1	ZINC000450830272	FF	On-Demand	Anodyne	PROKR1	44	31
COc1ccc(C[C@@]2(C)NC(=O)N(Cc3ccc(C(C)=O)cc3)C2=O)cc1	ZINC000450830273	FF	On-Demand	Anodyne	PROKR1	44	31
COC(=O)COc1ccc(N(C)C(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450830284	FF	On-Demand	Anodyne	COLA	86	40
COC(=O)COc1ccc(N(C)C(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450830284	FF	On-Demand	Anodyne	CPT1A	73	37
COC(=O)COc1ccc(N(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450830285	FF	On-Demand	Anodyne	COLA	86	40
COC(=O)COc1ccc(N(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450830285	FF	On-Demand	Anodyne	CPT1A	73	37
CN(CCSc1ccc(S(C)(=O)=O)cc1)Cc1ccccc1	ZINC000450830290	EG	On-Demand	Anodyne	RORC	20	44
CCC[C@H](O)CN1CC[C@H](C)[C@@H]1CO	ZINC000450830301	BC	On-Demand	Anodyne	GBA2	40	30
CCC[C@H](O)CN1CC[C@H](C)[C@H]1CO	ZINC000450830302	BC	On-Demand	Anodyne	GBA2	40	30
CCC[C@H](O)CN1CC[C@@H](C)[C@H]1CO	ZINC000450830303	BC	On-Demand	Anodyne	GBA2	40	30
CCC[C@H](O)CN1CC[C@@H](C)[C@@H]1CO	ZINC000450830304	BC	On-Demand	Anodyne	GBA2	40	30
OCC1(CCNc2ccnc3c(Cl)cccc23)CC1	ZINC000450830311	CG	On-Demand	Anodyne	HRP1_PLAFA	40	34
OCC1(CCNc2ccnc3c(Cl)cccc23)CC1	ZINC000450830311	CG	On-Demand	Anodyne	HNMT	52	36
COC(=O)c1csc(CN2CCc3cc(Cl)ccc3C2)n1	ZINC000450830314	DG	On-Demand	Anodyne	ABCB1B	40	31
COC(=O)c1csc(CN2CCc3cc(Cl)ccc3C2)n1	ZINC000450830314	DG	On-Demand	Anodyne	NOD1	30	40
COC(=O)c1csc(CN2CCc3cc(Cl)ccc3C2)n1	ZINC000450830314	DG	On-Demand	Anodyne	NOD2	44	40
COC(=O)c1csc(CN2CCc3cc(Cl)ccc3C2)n1	ZINC000450830314	DG	On-Demand	Anodyne	TRPC6	40	38
CC(C)c1nccc(N2CC[S@](=O)C(C)(C)CC2)n1	ZINC000450830326	CE	On-Demand	Anodyne	SORD	60	37
CC(C)c1nccc(N2CC[S@@](=O)C(C)(C)CC2)n1	ZINC000450830327	CE	On-Demand	Anodyne	SORD	60	37
Cc1ccc(-c2nnc(SCc3cn(C)nc3C)o2)c(C)c1	ZINC000450830342	DH	On-Demand	Anodyne	TERT	25	40
COc1ccc(CNC(=O)CCN2CCCN([C@@H](C)CO)CC2)c(OC)c1	ZINC000450830347	GD	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCCN([C@@H](C)CO)CC2)c(OC)c1	ZINC000450830347	GD	On-Demand	Anodyne	HTR7	33	44
COc1ccc(CNC(=O)CCN2CCCN([C@@H](C)CO)CC2)c(OC)c1	ZINC000450830347	GD	On-Demand	Anodyne	MTNR1A	43	37
COc1ccc(CNC(=O)CCN2CCCN([C@H](C)CO)CC2)c(OC)c1	ZINC000450830348	GD	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCCN([C@H](C)CO)CC2)c(OC)c1	ZINC000450830348	GD	On-Demand	Anodyne	HTR7	33	44
COc1ccc(CNC(=O)CCN2CCCN([C@H](C)CO)CC2)c(OC)c1	ZINC000450830348	GD	On-Demand	Anodyne	MTNR1A	43	37
CC1(C)CCN(c2ncccc2C(F)(F)F)CC[S@@]1=O	ZINC000450830354	DF	On-Demand	Anodyne	TRPV1	30	44
CC1(C)CCN(c2ncccc2C(F)(F)F)CC[S@]1=O	ZINC000450830355	DF	On-Demand	Anodyne	TRPV1	30	44
CC(F)(F)CCSc1nnc(Cc2ccccc2F)o1	ZINC000450830361	DH	On-Demand	Anodyne	PTK2	23	48
CC1(C)CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC[S@]1=O	ZINC000450830376	GD	On-Demand	Bother	SLC6A9	0	43
CC1(C)CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC[S@@]1=O	ZINC000450830377	GD	On-Demand	Bother	SLC6A9	0	43
COc1cccc2c(N3CC[S@@](=O)C(C)(C)CC3)ccnc12	ZINC000450830382	DF	On-Demand	Anodyne	ADRA1B	15	40
COc1cccc2c(N3CC[S@](=O)C(C)(C)CC3)ccnc12	ZINC000450830383	DF	On-Demand	Anodyne	ADRA1B	15	40
Cc1cc(=NC[C@H]2CCCC[C@@H]2O)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450830388	EF	On-Demand	Bother	GYRB	40	36
COC(=O)c1csc(CSc2nnc(-c3ccc(C)cc3C)o2)n1	ZINC000450830402	FH	On-Demand	Anodyne	ALOX15	48	35
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C)cc3C)o2)nc1	ZINC000450830405	FI	On-Demand	Anodyne	ALOX15	62	36
C[C@@H](CO)N1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450830408	GF	On-Demand	Anodyne	CYP2J2	53	38
C[C@H](CO)N1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450830409	GF	On-Demand	Anodyne	CYP2J2	53	38
C[C@@H](O)CCN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000450830410	FE	On-Demand	Anodyne	ALPL	39	43
C[C@@H](O)CCN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000450830410	FE	On-Demand	Anodyne	PTGDR2	28	50
C[C@H](O)CCN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000450830411	FE	On-Demand	Anodyne	ALPL	39	43
C[C@H](O)CCN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000450830411	FE	On-Demand	Anodyne	PTGDR2	28	50
CN(c1ncc(C(F)(F)F)s1)[C@@H](CO)CC(C)(C)C	ZINC000450830424	CG	On-Demand	Anodyne	MLYCD	17	40
CN(c1ncc(C(F)(F)F)s1)[C@H](CO)CC(C)(C)C	ZINC000450830425	CG	On-Demand	Anodyne	MLYCD	17	40
O=C(NCCCNc1ccccc1F)c1ccc(N2CCC2)nc1	ZINC000450830427	EF	On-Demand	Anodyne	DRD3	34	41
O=C(NCCCNc1ccccc1F)c1ccc(N2CCC2)nc1	ZINC000450830427	EF	On-Demand	Anodyne	HDAC1	23	41
O=C(NCCCNc1ccccc1F)c1ccc(N2CCC2)nc1	ZINC000450830427	EF	On-Demand	Anodyne	DGAT1	31	41
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H]2CO)c(OC)c1	ZINC000450830451	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H]2CO)c(OC)c1	ZINC000450830451	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H]2CO)c(OC)c1	ZINC000450830453	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H]2CO)c(OC)c1	ZINC000450830453	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H]2CO)c(OC)c1	ZINC000450830454	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H]2CO)c(OC)c1	ZINC000450830454	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H]2CO)c(OC)c1	ZINC000450830456	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H]2CO)c(OC)c1	ZINC000450830456	ED	On-Demand	Anodyne	MTNR1A	43	35
C[C@@H]1CCN(CCN(C)Cc2ccccc2)[C@@H]([C@@H](C)O)C1	ZINC000450830478	CF	On-Demand	Anodyne	SIGMAR1	17	41
C[C@@H]1CCN(CCN(C)Cc2ccccc2)[C@H]([C@@H](C)O)C1	ZINC000450830479	CF	On-Demand	Anodyne	SIGMAR1	17	41
C[C@H](O)[C@@H]1C[C@H](C)CCN1CCN(C)Cc1ccccc1	ZINC000450830480	CF	On-Demand	Anodyne	SIGMAR1	17	41
C[C@H](O)[C@H]1C[C@H](C)CCN1CCN(C)Cc1ccccc1	ZINC000450830481	CF	On-Demand	Anodyne	SIGMAR1	17	41
COc1ccc(-c2ccnc(NCCC3(CO)CC3)n2)cc1	ZINC000450830490	CF	On-Demand	Anodyne	CLK4	26	54
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H]1CC12CCOCC2	ZINC000450830501	EH	On-Demand	Anodyne	CCR2	41	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CC12CCOCC2	ZINC000450830502	EH	On-Demand	Anodyne	CCR2	41	35
COc1cccc(OCCC(=O)NCCCNc2ccccc2F)c1	ZINC000450830510	EG	On-Demand	Anodyne	DRD4	43	34
COc1cccc(OCCC(=O)NCCCNc2ccccc2F)c1	ZINC000450830510	EG	On-Demand	Anodyne	HRH2	22	41
COc1cccc(OCCC(=O)NCCCNc2ccccc2F)c1	ZINC000450830510	EG	On-Demand	Anodyne	MTNR1B	56	44
COc1cccc(OCCC(=O)NCCCNc2ccccc2F)c1	ZINC000450830510	EG	On-Demand	Anodyne	TBK1	24	43
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)nc1	ZINC000450830514	DD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)nc1	ZINC000450830514	DD	On-Demand	Anodyne	PTR1	45	33
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)nc1	ZINC000450830515	DD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)nc1	ZINC000450830515	DD	On-Demand	Anodyne	PTR1	45	33
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)nc1	ZINC000450830516	DD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)nc1	ZINC000450830516	DD	On-Demand	Anodyne	PTR1	45	33
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)nc1	ZINC000450830518	DD	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)nc1	ZINC000450830518	DD	On-Demand	Anodyne	PTR1	45	33
COC(=O)c1csc(CN2CC[C@H](C)C[C@@H]2[C@@H](C)O)n1	ZINC000450830520	CD	On-Demand	Anodyne	TRPC6	47	37
COC(=O)c1csc(CN2CC[C@H](C)C[C@@H]2[C@H](C)O)n1	ZINC000450830523	CD	On-Demand	Anodyne	TRPC6	47	37
COC(=O)c1csc(CN2CC[C@H](C)C[C@H]2[C@H](C)O)n1	ZINC000450830524	CD	On-Demand	Anodyne	TRPC6	47	37
COC(=O)c1csc(CN2CC[C@H](C)C[C@H]2[C@@H](C)O)n1	ZINC000450830527	CD	On-Demand	Anodyne	TRPC6	47	37
OCC1(CCNc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450830548	CH	On-Demand	Anodyne	HRP1_PLAFA	101	37
OCC1(CCNc2ccnc3cc(F)c(Cl)cc23)CC1	ZINC000450830548	CH	On-Demand	Anodyne	HNMT	59	39
CC[C@@H]1CN(CC)CCN1c1ccnc(C(C)C)n1	ZINC000450830558	CF	On-Demand	Anodyne	SORD	53	36
CC[C@H]1CN(CC)CCN1c1ccnc(C(C)C)n1	ZINC000450830560	CF	On-Demand	Anodyne	SORD	53	36
Cc1ccc(C(=O)N2CC[C@H](n3c(C)nc4c3CCCC4)C2)c2c1CCC2	ZINC000450830589	FH	On-Demand	Anodyne	L3MBTL3	56	39
Cc1ccc(C(=O)N2CC[C@@H](n3c(C)nc4c3CCCC4)C2)c2c1CCC2	ZINC000450830592	FH	On-Demand	Anodyne	L3MBTL3	56	39
COC(=O)c1coc(CN2CCc3cc(Br)ccc3C2)n1	ZINC000450830614	FF	On-Demand	Anodyne	ABCB1	0	44
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N[C@@H]1COC[C@H]1O	ZINC000450830619	GD	On-Demand	Bother	DDIT3	0	41
Fc1ccccc1Cc1nnc(SCc2cn(CC3CC3)nn2)o1	ZINC000450830625	EG	On-Demand	Anodyne	PTK2	23	47
C[C@@H](CO)N1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450830630	CE	On-Demand	Anodyne	SIGMAR1	22	46
C[C@H](CO)N1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450830631	CE	On-Demand	Anodyne	SIGMAR1	22	46
CC1(C)CCN(c2ncnc3sc4c(c23)CCC4)CC[S@]1=O	ZINC000450830652	EF	On-Demand	Anodyne	RBP4	19	45
CC1(C)CCN(c2ncnc3sc4c(c23)CCC4)CC[S@@]1=O	ZINC000450830653	EF	On-Demand	Anodyne	RBP4	19	45
Fc1cccc(Cc2nnc(SCc3ccn(CC(F)(F)F)n3)o2)c1	ZINC000450830656	FH	On-Demand	Anodyne	PTK2	0	48
O=C1NC2(CCOCC2)C(=O)N1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450830676	FG	On-Demand	Anodyne	DNAE	54	36
CCN1CCCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450830677	CE	On-Demand	Anodyne	NOX1	63	39
CCN1CCCN(Cc2ccc(Cl)c(OC)c2)CC1=O	ZINC000450830677	CE	On-Demand	Anodyne	NOX5	61	39
CCOC(=O)c1cc(N2CC[S@](=O)C(C)(C)CC2)ccc1[N+](=O)[O-]	ZINC000450830699	FF	On-Demand	Bother	GYRB	0	41
CCOC(=O)c1cc(N2CC[S@@](=O)C(C)(C)CC2)ccc1[N+](=O)[O-]	ZINC000450830700	FF	On-Demand	Bother	GYRB	0	41
CN(CCN1CCc2nn[nH]c2C1)Cc1ccccc1	ZINC000450830707	CD	On-Demand	Anodyne	SIGMAR1	21	54
FC(F)(F)c1nnc(N2CCCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450830717	GH	On-Demand	Anodyne	SIGMAR1	16	46
FC(F)(F)c1nnc(N2CCCN(CCc3ccc(Cl)cc3)CC2)s1	ZINC000450830717	GH	On-Demand	Anodyne	ABCC1	44	38
COCCC(=O)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450830721	EF	On-Demand	Anodyne	DRD4	46	38
CC[C@]1(C)CN(CCN(C)Cc2ccccc2)CCO1	ZINC000450830740	CF	On-Demand	Anodyne	SIGMAR1	19	43
COc1ccc(CNC(=O)CCn2nnc(-c3ccc(F)c(C)c3)n2)c(OC)c1	ZINC000450830742	GF	On-Demand	Anodyne	PDGFRB	30	40
COc1ccc(CNC(=O)CCn2nnc(-c3ccc(F)c(C)c3)n2)c(OC)c1	ZINC000450830742	GF	On-Demand	Anodyne	P2RX7	27	40
CN1[C@H]2CC[C@H]1CC(Nc1ncccc1OCc1ccccc1)C2	ZINC000450830744	DH	On-Demand	Anodyne	PPIA	46	45
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830748	EF	On-Demand	Anodyne	DRD4	35	42
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830748	EF	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830748	EF	On-Demand	Anodyne	SIGMAR1	26	42
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830748	EF	On-Demand	Anodyne	CCR3	36	40
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830748	EF	On-Demand	Anodyne	MLNR	42	33
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830748	EF	On-Demand	Anodyne	MCHR1	31	45
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830749	EF	On-Demand	Anodyne	DRD4	35	42
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830749	EF	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830749	EF	On-Demand	Anodyne	SIGMAR1	26	42
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830749	EF	On-Demand	Anodyne	CCR3	36	40
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830749	EF	On-Demand	Anodyne	MLNR	42	33
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830749	EF	On-Demand	Anodyne	MCHR1	31	45
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830750	EF	On-Demand	Anodyne	DRD4	35	42
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830750	EF	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830750	EF	On-Demand	Anodyne	SIGMAR1	26	42
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830750	EF	On-Demand	Anodyne	CCR3	36	40
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830750	EF	On-Demand	Anodyne	MLNR	42	33
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)cc1Cl	ZINC000450830750	EF	On-Demand	Anodyne	MCHR1	31	45
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830751	EF	On-Demand	Anodyne	DRD4	35	42
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830751	EF	On-Demand	Anodyne	DRD3	0	46
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830751	EF	On-Demand	Anodyne	SIGMAR1	26	42
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830751	EF	On-Demand	Anodyne	CCR3	36	40
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830751	EF	On-Demand	Anodyne	MLNR	42	33
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)cc1Cl	ZINC000450830751	EF	On-Demand	Anodyne	MCHR1	31	45
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3c(Cl)cccc13)C2	ZINC000450830759	DH	On-Demand	Anodyne	HRP1_PLAFA	57	35
CN1[C@H]2CC[C@H]1CC(Nc1ccnc3c(Cl)cccc13)C2	ZINC000450830759	DH	On-Demand	Anodyne	HNMT	46	35
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450830772	GF	On-Demand	Mild	PDE4D	16	41
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450830772	GF	On-Demand	Mild	PDEC	0	41
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450830773	GF	On-Demand	Mild	PDE4D	16	41
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450830773	GF	On-Demand	Mild	PDEC	0	41
Cc1ccnn1-c1ccccc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450830774	DH	On-Demand	Anodyne	KCNQ2	56	34
CN1[C@H]2CC[C@H]1CC(Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-])C2	ZINC000450830784	FD	On-Demand	Bother	BDKRB1	0	40
CCN(Cc1cccc(S(C)(=O)=O)c1)c1cccc(O)c1	ZINC000450830812	DF	On-Demand	Anodyne	HSD17B2	25	43
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450830817	FD	On-Demand	Anodyne	PREP	43	35
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@@H](n2cnc(C(N)=O)n2)C1	ZINC000450830819	FD	On-Demand	Anodyne	PREP	43	35
C[C@H](OCCc1ccccc1)C(=O)N1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450830821	FD	On-Demand	Anodyne	PREP	43	35
C[C@@H](OCCc1ccccc1)C(=O)N1CCC[C@H](n2cnc(C(N)=O)n2)C1	ZINC000450830823	FD	On-Demand	Anodyne	PREP	43	35
COC(=O)c1csc(CNC(C)(C)c2ccc(OC(F)(F)F)cc2)n1	ZINC000450830836	FH	On-Demand	Anodyne	SCN10A	31	40
N#Cc1ccc(OCC(=O)NC[C@H]2CC23CCOCC3)cc1Br	ZINC000450830850	GF	On-Demand	Mild	TRPV4	41	31
N#Cc1ccc(OCC(=O)NC[C@@H]2CC23CCOCC3)cc1Br	ZINC000450830852	GF	On-Demand	Mild	TRPV4	41	31
CN1[C@H]2CC[C@H]1CC(N=c1cnc(C(=O)OC(C)(C)C)c[nH]1)C2	ZINC000450830867	DD	On-Demand	Anodyne	GLRA1	45	37
CCc1cc(NC2C[C@@H]3CC[C@H](C2)N3C)n2ncnc2n1	ZINC000450830886	CD	On-Demand	Anodyne	DHOD	0	48
Cc1cccc(CN[C@H]2CCN([C@@H](C(=O)OC(C)(C)C)C(C)C)C2=O)n1	ZINC000450830988	FE	On-Demand	Anodyne	PDE8B	43	35
Cc1cccc(CN[C@@H]2CCN([C@@H](C(=O)OC(C)(C)C)C(C)C)C2=O)n1	ZINC000450830989	FE	On-Demand	Anodyne	PDE8B	43	35
Cc1cccc(CN[C@H]2CCN([C@H](C(=O)OC(C)(C)C)C(C)C)C2=O)n1	ZINC000450830990	FE	On-Demand	Anodyne	PDE8B	43	35
Cc1cccc(CN[C@@H]2CCN([C@H](C(=O)OC(C)(C)C)C(C)C)C2=O)n1	ZINC000450830991	FE	On-Demand	Anodyne	PDE8B	43	35
COCCOc1ccc(C#N)cc1NC(=O)CC1(O)CCC1	ZINC000450830994	DD	On-Demand	Mild	PDGFRB	15	43
CCN(Cc1c[nH]c2ccccc12)C[C@](C)(O)C(C)=O	ZINC000450830999	CE	On-Demand	Anodyne	TACR1	40	39
CCN(Cc1c[nH]c2ccccc12)C[C@](C)(O)C(C)=O	ZINC000450830999	CE	On-Demand	Anodyne	NMBR	43	31
CCN(Cc1c[nH]c2ccccc12)C[C@](C)(O)C(C)=O	ZINC000450830999	CE	On-Demand	Anodyne	GHSR	42	38
CCN(Cc1c[nH]c2ccccc12)C[C@@](C)(O)C(C)=O	ZINC000450831000	CE	On-Demand	Anodyne	TACR1	40	39
CCN(Cc1c[nH]c2ccccc12)C[C@@](C)(O)C(C)=O	ZINC000450831000	CE	On-Demand	Anodyne	NMBR	43	31
CCN(Cc1c[nH]c2ccccc12)C[C@@](C)(O)C(C)=O	ZINC000450831000	CE	On-Demand	Anodyne	GHSR	42	38
CCS(=O)(=O)c1ccc(CSc2cc3c(cc2Cl)OCCO3)cc1	ZINC000450831024	GI	On-Demand	Anodyne	PKM	31	40
CC(C)c1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450831062	DJ	On-Demand	Anodyne	TYMS	0	48
COc1ccccc1Cc1nnc(SCCCCCC(C)=O)o1	ZINC000450831066	EH	On-Demand	Anodyne	PTK2	0	47
NC(=O)[C@]1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)C1	ZINC000450831073	EE	On-Demand	Anodyne	SIGMAR1	25	46
NC(=O)[C@@]1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)C1	ZINC000450831074	EE	On-Demand	Anodyne	SIGMAR1	25	46
CCCc1nc(C)c(CSc2nnc(Cc3ccccc3F)o2)o1	ZINC000450831075	EI	On-Demand	Anodyne	PTK2	19	44
CCC[C@H](O)CN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450831078	CD	On-Demand	Anodyne	HSD17B2	124	40
CCC[C@@H](O)CN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450831079	CD	On-Demand	Anodyne	HSD17B2	124	40
CCC[C@@H](O)CN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450831080	CD	On-Demand	Anodyne	HSD17B2	124	40
CCC[C@H](O)CN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450831081	CD	On-Demand	Anodyne	HSD17B2	124	40
COc1ccccc1Cc1nnc(SCC[C@H]2CCOC2)o1	ZINC000450831088	DG	On-Demand	Anodyne	PTK2	15	46
COc1ccccc1Cc1nnc(SCC[C@@H]2CCOC2)o1	ZINC000450831089	DG	On-Demand	Anodyne	PTK2	15	46
CNS(=O)(=O)c1ccc(N(C)[C@@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450831145	FD	On-Demand	Bother	COLA	63	32
CNS(=O)(=O)c1ccc(N(C)[C@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1	ZINC000450831146	FD	On-Demand	Bother	COLA	63	32
COCCC(=O)N1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450831160	FD	On-Demand	Anodyne	OPRK1	22	43
COCCC(=O)N1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450831160	FD	On-Demand	Anodyne	HTR4	27	40
COCCC(=O)N1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450831160	FD	On-Demand	Anodyne	FAAH	18	40
Cc1cccc([C@H]2CCN(C(=O)Cc3scnc3-c3ccccc3)C2)c1	ZINC000450831185	FJ	On-Demand	Anodyne	MGEA5	23	40
COC(=O)CN(CCc1cscn1)Cc1cccc(Br)c1	ZINC000450831192	FG	On-Demand	Anodyne	BMP1	52	34
COCCC(=O)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450831193	EE	On-Demand	Anodyne	HTR4	49	37
COCCC(=O)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450831193	EE	On-Demand	Anodyne	CCR1	31	42
COCCC(=O)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450831193	EE	On-Demand	Anodyne	MGLL	0	41
COCCC(=O)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450831193	EE	On-Demand	Anodyne	ABHD6	0	41
Cc1cccc([C@@H]2CCN(C(=O)Cc3scnc3-c3ccccc3)C2)c1	ZINC000450831195	FJ	On-Demand	Anodyne	MGEA5	23	40
O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N1CC(c2ccc(Cl)cc2)C1	ZINC000450831206	GH	On-Demand	Bother	DRD4	21	40
Clc1ccc(C2CN(c3cc(N4CCOCC4)ncn3)C2)cc1	ZINC000450831229	EF	On-Demand	Anodyne	ADK	31	42
CCC(=O)CCCN1CCCC2(CCCC2)C1	ZINC000450831291	BG	On-Demand	Anodyne	EBP	18	49
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	DRD2	16	46
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	DRD4	30	41
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	ACHE	26	43
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	CHRM3	25	41
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	SSTR5	48	39
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	CCR3	51	42
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	CXCR3	20	40
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	MCHR1	42	40
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	CACNA1G	32	40
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	SFRP1	90	38
CC(=O)c1cccc(CN2CCC(NS(=O)(=O)NCC(F)(F)F)CC2)c1	ZINC000450831293	GD	On-Demand	Anodyne	WNT3	46	34
FC(F)(F)c1cc(N2CC(c3ccc(Cl)cc3)C2)n2ncnc2n1	ZINC000450831298	FG	On-Demand	Anodyne	DHOD	0	42
CNC(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nn1	ZINC000450831299	DE	On-Demand	Anodyne	SCD1	37	41
C[C@@H]1CCN(Cc2ccccc2OC2CC2)[C@@H]([C@@H](C)O)C1	ZINC000450831322	CG	On-Demand	Anodyne	SLC5A4	52	33
C[C@@H]1CCN(Cc2ccccc2OC2CC2)[C@H]([C@@H](C)O)C1	ZINC000450831323	CG	On-Demand	Anodyne	SLC5A4	52	33
C[C@H](O)[C@H]1C[C@H](C)CCN1Cc1ccccc1OC1CC1	ZINC000450831324	CG	On-Demand	Anodyne	SLC5A4	52	33
C[C@H](O)[C@@H]1C[C@H](C)CCN1Cc1ccccc1OC1CC1	ZINC000450831325	CG	On-Demand	Anodyne	SLC5A4	52	33
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450831341	GF	On-Demand	Anodyne	DRD4	18	41
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450831341	GF	On-Demand	Anodyne	SLC6A1	46	32
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450831341	GF	On-Demand	Anodyne	BIRC2	56	42
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450831342	GF	On-Demand	Anodyne	DRD4	18	41
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450831342	GF	On-Demand	Anodyne	SLC6A1	46	32
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450831342	GF	On-Demand	Anodyne	BIRC2	56	42
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](n3c(C)nc4c3CCCC4)C2)cc1	ZINC000450831371	GJ	On-Demand	Anodyne	L3MBTL3	62	39
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](n3c(C)nc4c3CCCC4)C2)cc1	ZINC000450831372	GJ	On-Demand	Anodyne	L3MBTL3	62	39
CC[C@@H]1CN(CC)CCN1c1ccc(C(F)(F)F)cn1	ZINC000450831378	CG	On-Demand	Anodyne	CXCR3	29	51
CC[C@H]1CN(CC)CCN1c1ccc(C(F)(F)F)cn1	ZINC000450831379	CG	On-Demand	Anodyne	CXCR3	29	51
Cc1cccc(Cl)c1C(=O)NCC[C@H](C)N1CCCCC1	ZINC000450831403	DH	On-Demand	Anodyne	DRD4	42	34
Cc1cccc(Cl)c1C(=O)NCC[C@H](C)N1CCCCC1	ZINC000450831403	DH	On-Demand	Anodyne	CCR5	39	49
Cc1cccc(Cl)c1C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450831404	DH	On-Demand	Anodyne	DRD4	42	34
Cc1cccc(Cl)c1C(=O)NCC[C@@H](C)N1CCCCC1	ZINC000450831404	DH	On-Demand	Anodyne	CCR5	39	49
CC(=O)CCCCCSc1nnc(Cc2cccc(F)c2)o1	ZINC000450831425	DI	On-Demand	Anodyne	PTK2	0	45
CC(=O)CCCCCSc1nnc(-c2ccc(C)cc2C)o1	ZINC000450831440	DJ	On-Demand	Anodyne	ALOX15	49	31
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@H]1C	ZINC000450831449	CD	On-Demand	Anodyne	ACE	40	34
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@H]1C	ZINC000450831449	CD	On-Demand	Anodyne	SLC6A3	26	43
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@H]1C	ZINC000450831449	CD	On-Demand	Anodyne	SLC18A2	41	37
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@H]1C	ZINC000450831449	CD	On-Demand	Anodyne	MME	43	34
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@H]1C	ZINC000450831449	CD	On-Demand	Anodyne	VACHT_TETCF	0	42
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@@H]1C	ZINC000450831450	CD	On-Demand	Anodyne	ACE	40	34
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@@H]1C	ZINC000450831450	CD	On-Demand	Anodyne	SLC6A3	26	43
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@@H]1C	ZINC000450831450	CD	On-Demand	Anodyne	SLC18A2	41	37
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@@H]1C	ZINC000450831450	CD	On-Demand	Anodyne	MME	43	34
COC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@@H]1C	ZINC000450831450	CD	On-Demand	Anodyne	VACHT_TETCF	0	42
CC(=O)CCCCCSc1nnc(Cc2ccccc2F)o1	ZINC000450831464	DI	On-Demand	Anodyne	PTK2	0	46
O=C1CCC(CN2CCN(C(=O)COc3ccc(Cl)cc3Cl)CC2)CC1	ZINC000450831465	GG	On-Demand	Anodyne	HRH1	15	41
O=C1CCC(CN2CCN(C(=O)COc3ccc(Cl)cc3Cl)CC2)CC1	ZINC000450831465	GG	On-Demand	Anodyne	CCR1	22	45
O=C1CCC(CN2CCN(C(=O)COc3ccc(Cl)cc3Cl)CC2)CC1	ZINC000450831465	GG	On-Demand	Anodyne	CCR3	15	41
NC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450831490	GF	On-Demand	Anodyne	CYP2J2	44	31
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450831491	GF	On-Demand	Anodyne	CYP2J2	44	31
NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450831492	GF	On-Demand	Anodyne	CYP2J2	44	31
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450831493	GF	On-Demand	Anodyne	CYP2J2	44	31
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[S@@](=O)C(C)(C)CC1	ZINC000450831507	DF	On-Demand	Bother	WDR5	34	41
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[S@](=O)C(C)(C)CC1	ZINC000450831508	DF	On-Demand	Bother	WDR5	34	41
Cc1cc(-c2nnn(C[C@H]3CCCC3(F)F)n2)ccc1F	ZINC000450831523	CG	On-Demand	Anodyne	SCARB1	41	34
Cc1cc(-c2nnn(C[C@@H]3CCCC3(F)F)n2)ccc1F	ZINC000450831524	CG	On-Demand	Anodyne	SCARB1	41	34
COCCC(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450831558	DE	On-Demand	Anodyne	DRD2	15	43
COCCC(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450831558	DE	On-Demand	Anodyne	HTR4	15	40
COCCC(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450831558	DE	On-Demand	Anodyne	HRH3	15	46
COCCC(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450831558	DE	On-Demand	Anodyne	SIGMAR1	22	45
COCCC(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450831558	DE	On-Demand	Anodyne	LSS	15	40
COCCC(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450831558	DE	On-Demand	Anodyne	CACNA1G	25	41
COCCC(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450831558	DE	On-Demand	Anodyne	KCNJ1	78	37
COC(=O)c1csc(CSCc2cccc(OC)c2)n1	ZINC000450831562	DG	On-Demand	Anodyne	ROCK1	38	42
COC(=O)c1csc(CSCc2cccc(OC)c2)n1	ZINC000450831562	DG	On-Demand	Anodyne	FAS	29	42
COC(=O)c1coc(CN2CCc3cc(C)ccc3C2)n1	ZINC000450831580	CE	On-Demand	Anodyne	NOD2	40	36
Cc1ccc(NC(=O)c2ccc(N[C@@H]3COC[C@H]3O)c([N+](=O)[O-])c2)cc1	ZINC000450831588	FE	On-Demand	Bother	TAAR1	23	43
CNC(=O)c1cccnc1NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000450831594	CD	On-Demand	Anodyne	GLRA1	47	39
COC(=O)c1cc(C)nc(N2CC(c3ccc(Cl)cc3)C2)c1[N+](=O)[O-]	ZINC000450831596	FG	On-Demand	Bother	CACNA1D	41	35
COC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@H](C)O1	ZINC000450831598	CF	On-Demand	Anodyne	DRD4	17	48
COC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H](C)O1	ZINC000450831599	CF	On-Demand	Anodyne	DRD4	17	48
COC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@H](C)O1	ZINC000450831600	CF	On-Demand	Anodyne	DRD4	17	48
COC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H](C)O1	ZINC000450831602	CF	On-Demand	Anodyne	DRD4	17	48
COc1cc(CC(=O)N2CCO[C@H](c3nnc(C(C)C)o3)C2)ccc1Cl	ZINC000450831648	GF	On-Demand	Anodyne	OPRK1	36	41
COc1cc(CC(=O)N2CCO[C@@H](c3nnc(C(C)C)o3)C2)ccc1Cl	ZINC000450831651	GF	On-Demand	Anodyne	OPRK1	36	41
COC(=O)C1(CN2CCC[C@]2(CO)Cc2ccccc2)CC1	ZINC000450831655	DE	On-Demand	Anodyne	SLC12A5	80	46
COC(=O)C1(CN2CCC[C@@]2(CO)Cc2ccccc2)CC1	ZINC000450831657	DE	On-Demand	Anodyne	SLC12A5	80	46
CN(c1ccnc(N2CCOCC2)n1)[C@@H](CO)CC(C)(C)C	ZINC000450831675	DD	On-Demand	Anodyne	EPHB4	77	35
CN(c1ccnc(N2CCOCC2)n1)[C@H](CO)CC(C)(C)C	ZINC000450831677	DD	On-Demand	Anodyne	EPHB4	77	35
Cc1cc(Cl)c2ncc(C#N)c(NCCC3(CO)CC3)c2c1	ZINC000450831693	DH	On-Demand	Mild	MAP3K8	98	40
Cc1cc(N[C@H](C)Cc2cnn(C)c2)n2ncnc2n1	ZINC000450831699	CD	On-Demand	Anodyne	DHOD	0	46
Cc1cc(N[C@@H](C)Cc2cnn(C)c2)n2ncnc2n1	ZINC000450831700	CD	On-Demand	Anodyne	DHOD	0	46
Cn1cc(-c2ccc(C(=O)N3CC[C@H](n4cnc5c4CCCC5)C3)o2)cn1	ZINC000450831731	FF	On-Demand	Anodyne	MAP3K7	47	33
Cn1cc(-c2ccc(C(=O)N3CC[C@@H](n4cnc5c4CCCC5)C3)o2)cn1	ZINC000450831732	FF	On-Demand	Anodyne	MAP3K7	47	33
C[C@@H](CCNC(=O)C1(Cc2ccccc2)CCOCC1)N1CCCCC1	ZINC000450831747	FG	On-Demand	Anodyne	SLC12A5	40	35
C[C@H](CCNC(=O)C1(Cc2ccccc2)CCOCC1)N1CCCCC1	ZINC000450831748	FG	On-Demand	Anodyne	SLC12A5	40	35
CC[C@@H]1C[C@H]1C(=O)Nc1ccccc1-n1nccc1C	ZINC000450831751	CG	On-Demand	Anodyne	KCNQ2	67	34
CC[C@@H]1CN(CC)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450831788	DF	On-Demand	Anodyne	PDE3A	52	41
CC[C@@H]1CN(CC)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450831788	DF	On-Demand	Anodyne	PDGFRB	56	35
CC[C@@H]1CN(CC)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450831788	DF	On-Demand	Anodyne	PDE3B	77	41
CC[C@@H]1CN(CC)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450831788	DF	On-Demand	Anodyne	HTT	0	42
CC[C@H]1CN(CC)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450831789	DF	On-Demand	Anodyne	PDE3A	52	41
CC[C@H]1CN(CC)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450831789	DF	On-Demand	Anodyne	PDGFRB	56	35
CC[C@H]1CN(CC)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450831789	DF	On-Demand	Anodyne	PDE3B	77	41
CC[C@H]1CN(CC)CCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450831789	DF	On-Demand	Anodyne	HTT	0	42
COc1cc([N+](=O)[O-])ccc1OCc1cn(C)nc1C	ZINC000450831790	CE	On-Demand	Bother	CYP19A1	15	42
C[C@@H](O)CCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000450831796	FG	On-Demand	Anodyne	COLA	43	40
C[C@@H](O)CCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000450831796	FG	On-Demand	Anodyne	CPT1A	32	40
C[C@H](O)CCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000450831797	FG	On-Demand	Anodyne	COLA	43	40
C[C@H](O)CCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000450831797	FG	On-Demand	Anodyne	CPT1A	32	40
C[C@@H](O)CCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000450831798	FG	On-Demand	Anodyne	COLA	43	40
C[C@@H](O)CCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000450831798	FG	On-Demand	Anodyne	CPT1A	32	40
C[C@H](O)CCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000450831799	FG	On-Demand	Anodyne	COLA	43	40
C[C@H](O)CCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000450831799	FG	On-Demand	Anodyne	CPT1A	32	40
C[C@@H]1CN(Cc2ccccc2OC2CC2)C[C@@H](CO)O1	ZINC000450831823	CD	On-Demand	Anodyne	SLC5A4	60	33
C[C@@H]1CN(Cc2ccccc2OC2CC2)C[C@H](CO)O1	ZINC000450831824	CD	On-Demand	Anodyne	SLC5A4	60	33
C[C@H]1CN(Cc2ccccc2OC2CC2)C[C@H](CO)O1	ZINC000450831825	CD	On-Demand	Anodyne	SLC5A4	60	33
C[C@H]1CN(Cc2ccccc2OC2CC2)C[C@@H](CO)O1	ZINC000450831826	CD	On-Demand	Anodyne	SLC5A4	60	33
COc1ccccc1Cc1nnc(SCc2cn(C)nc2C)o1	ZINC000450831837	EG	On-Demand	Anodyne	PTK2	25	54
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	HTR1A	50	48
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	DRD2	47	48
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	DRD1	16	48
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	DRD4	27	48
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	HTR2A	27	48
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	HTR2C	15	43
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	HRH1	16	48
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	DRD3	36	48
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	HTR7	67	48
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)c1ccccc1	ZINC000450831841	GH	On-Demand	Anodyne	MLYCD	40	37
CC(=O)c1ccc(CN2CCCN([C@@H](C)CO)CC2)cc1	ZINC000450831848	CD	On-Demand	Anodyne	HRH3	17	55
CC(=O)c1ccc(CN2CCCN([C@H](C)CO)CC2)cc1	ZINC000450831849	CD	On-Demand	Anodyne	HRH3	17	55
COC(=O)[C@@H]1CCN(CCN(C)Cc2ccccc2)[C@@H]1C	ZINC000450831886	CE	On-Demand	Anodyne	ACHE	0	40
COC(=O)[C@@H]1CCN(CCN(C)Cc2ccccc2)[C@@H]1C	ZINC000450831886	CE	On-Demand	Anodyne	SLC6A1	45	43
COC(=O)[C@@H]1CCN(CCN(C)Cc2ccccc2)[C@H]1C	ZINC000450831887	CE	On-Demand	Anodyne	ACHE	0	40
COC(=O)[C@@H]1CCN(CCN(C)Cc2ccccc2)[C@H]1C	ZINC000450831887	CE	On-Demand	Anodyne	SLC6A1	45	43
COC(=O)[C@H]1CCN(CCN(C)Cc2ccccc2)[C@H]1C	ZINC000450831888	CE	On-Demand	Anodyne	ACHE	0	40
COC(=O)[C@H]1CCN(CCN(C)Cc2ccccc2)[C@H]1C	ZINC000450831888	CE	On-Demand	Anodyne	SLC6A1	45	43
COC(=O)[C@H]1CCN(CCN(C)Cc2ccccc2)[C@@H]1C	ZINC000450831889	CE	On-Demand	Anodyne	ACHE	0	40
COC(=O)[C@H]1CCN(CCN(C)Cc2ccccc2)[C@@H]1C	ZINC000450831889	CE	On-Demand	Anodyne	SLC6A1	45	43
CCN1CCCN(CCc2ccc(Cl)cc2)CC1=O	ZINC000450831895	CE	On-Demand	Anodyne	SIGMAR1	18	44
CCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450831900	DE	On-Demand	Anodyne	DRD2	35	48
CCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450831900	DE	On-Demand	Anodyne	HTR3B	0	44
CCN1CCCN(CCCC(=O)c2ccc(F)cc2)CC1=O	ZINC000450831900	DE	On-Demand	Anodyne	CYP2J2	53	38
COC(=O)[C@H]1CCN(Cc2c(C)cccc2Cl)[C@@H]1C	ZINC000450831903	CG	On-Demand	Anodyne	SLC6A1	23	42
COC(=O)[C@@H]1CCN(Cc2c(C)cccc2Cl)[C@H]1C	ZINC000450831904	CG	On-Demand	Anodyne	SLC6A1	23	42
COC(=O)[C@H]1CCN(Cc2c(C)cccc2Cl)[C@H]1C	ZINC000450831905	CG	On-Demand	Anodyne	SLC6A1	23	42
COC(=O)[C@@H]1CCN(Cc2c(C)cccc2Cl)[C@@H]1C	ZINC000450831906	CG	On-Demand	Anodyne	SLC6A1	23	42
COc1ccc(CNC(=O)CCN2CC(=O)N(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450831909	GE	On-Demand	Anodyne	HTR7	26	41
COc1ccc(CNC(=O)CCN2CC(=O)N(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450831909	GE	On-Demand	Anodyne	MTNR1A	65	36
COc1ccc(CNC(=O)CCN2CC(=O)N(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450831909	GE	On-Demand	Anodyne	MTNR1B	58	36
COc1ccc(CNC(=O)CCN2CC(=O)N(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450831910	GE	On-Demand	Anodyne	HTR7	26	41
COc1ccc(CNC(=O)CCN2CC(=O)N(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450831910	GE	On-Demand	Anodyne	MTNR1A	65	36
COc1ccc(CNC(=O)CCN2CC(=O)N(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450831910	GE	On-Demand	Anodyne	MTNR1B	58	36
CN(CCN1CCCN(c2nnc(C(F)(F)F)s2)CC1)Cc1ccccc1	ZINC000450831913	GG	On-Demand	Anodyne	SIGMAR1	19	44
CCOC(=O)c1ccc(CSc2nnc(-c3sccc3C)o2)nc1	ZINC000450831927	FH	On-Demand	Anodyne	ALOX15	47	35
Cc1cc(N[C@H]2CCc3cc(F)c(F)c(F)c32)n2ncnc2n1	ZINC000450831934	DF	On-Demand	Anodyne	DHOD	0	57
Cc1cc(N[C@@H]2CCc3cc(F)c(F)c(F)c32)n2ncnc2n1	ZINC000450831935	DF	On-Demand	Anodyne	DHOD	0	57
OCC1(CCNc2ncnc3cc(Br)ccc23)CC1	ZINC000450831939	DE	On-Demand	Anodyne	EGFR	65	41
CC(C)c1nccc(N2CC(c3ccc(Cl)cc3)C2)n1	ZINC000450831968	CH	On-Demand	Anodyne	SORD	69	39
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	FOLH1	28	48
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	MME	20	40
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	ANPEP	29	44
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	SDH1	0	55
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	KCNA3	39	44
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	MTNR1B	30	47
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	ABCB1	43	42
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	SLC6A5	30	44
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	AMP1_PLAFQ	35	44
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	CRTM	43	38
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	PTGES	0	40
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	HCN1	74	37
C[C@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831994	EH	On-Demand	Anodyne	HCN4	51	35
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	FOLH1	28	48
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	MME	20	40
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	ANPEP	29	44
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	SDH1	0	55
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	KCNA3	39	44
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	MTNR1B	30	47
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	ABCB1	43	42
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	SLC6A5	30	44
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	AMP1_PLAFQ	35	44
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	CRTM	43	38
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	PTGES	0	40
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	HCN1	74	37
C[C@@H](O)CCCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450831996	EH	On-Demand	Anodyne	HCN4	51	35
Cc1cccc([C@@H]2CCN(C(=O)[C@]3(C)CCC[C@@H]3C)C2)c1	ZINC000450831999	CI	On-Demand	Anodyne	ADAM10	17	44
Cc1cccc([C@@H]2CCN(C(=O)[C@@]3(C)CCC[C@H]3C)C2)c1	ZINC000450832001	CI	On-Demand	Anodyne	ADAM10	17	44
Cc1cccc([C@@H]2CCN(C(=O)[C@]3(C)CCC[C@H]3C)C2)c1	ZINC000450832003	CI	On-Demand	Anodyne	ADAM10	17	44
Cc1cccc([C@@H]2CCN(C(=O)[C@@]3(C)CCC[C@@H]3C)C2)c1	ZINC000450832005	CI	On-Demand	Anodyne	ADAM10	17	44
COCCNC(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nc1	ZINC000450832033	EF	On-Demand	Anodyne	SLC6A1	25	41
COCCNC(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nc1	ZINC000450832033	EF	On-Demand	Anodyne	HDAC1	0	41
CN1[C@H]2CC[C@H]1CC(Nc1cc(=O)n3ccccc3n1)C2	ZINC000450832040	CD	On-Demand	Anodyne	GLRA1	49	36
COc1ccc(CNC(=O)CCSc2ccccc2OC)c(OC)c1	ZINC000450832042	FH	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCSc2ccccc2OC)c(OC)c1	ZINC000450832042	FH	On-Demand	Anodyne	MTNR1A	70	42
COc1ccc(CNC(=O)CCSc2ccccc2OC)c(OC)c1	ZINC000450832042	FH	On-Demand	Anodyne	MTNR1B	64	36
Clc1ccc(C2CN(c3ccnc(N4CCOCC4)n3)C2)cc1	ZINC000450832050	EF	On-Demand	Anodyne	SMG1	36	42
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450832053	EG	On-Demand	Anodyne	ADAM17	22	42
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450832053	EG	On-Demand	Anodyne	PKM	27	43
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450832053	EG	On-Demand	Anodyne	AKR1C3	27	46
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450832053	EG	On-Demand	Anodyne	PSMB2	45	35
CC(F)(F)CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000450832053	EG	On-Demand	Anodyne	PSMB1	37	41
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	DRD2	35	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	DRD1	22	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	DRD4	27	50
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	HRH2	0	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	HTR2A	33	52
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	HTR2C	27	57
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	SLC6A1	42	35
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	DRD3	0	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	SLC18A3	0	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	HTR3B	0	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832070	DF	On-Demand	Anodyne	AP2S1	0	46
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	HRH3	24	47
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	MMP13	70	43
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	ADAM17	73	45
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	MMP3	45	41
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	MMP14	15	42
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	EPHX2	17	54
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	TGM2	46	37
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	MMP7	61	41
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	ADAMTS4	50	53
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	MMP1	68	45
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	F13A1	65	39
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	PSMB2	40	36
CC(=O)c1ccc(COc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1	ZINC000450832071	FH	On-Demand	Anodyne	NAMPT	32	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	DRD2	35	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	DRD1	22	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	DRD4	27	50
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	HRH2	0	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	HTR2A	33	52
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	HTR2C	27	57
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	SLC6A1	42	35
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	DRD3	0	46
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	SLC18A3	0	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	HTR3B	0	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832072	DF	On-Demand	Anodyne	AP2S1	0	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	DRD2	35	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	DRD1	22	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	DRD4	27	50
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	HRH2	0	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	HTR2A	33	52
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	HTR2C	27	57
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	SLC6A1	42	35
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	DRD3	0	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	SLC18A3	0	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	HTR3B	0	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450832074	DF	On-Demand	Anodyne	AP2S1	0	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	DRD2	35	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	DRD1	22	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	DRD4	27	50
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	HRH2	0	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	HTR2A	33	52
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	HTR2C	27	57
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	SLC6A1	42	35
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	DRD3	0	46
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	SLC18A3	0	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	HTR3B	0	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1C	ZINC000450832075	DF	On-Demand	Anodyne	AP2S1	0	46
COc1cccc(CSCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450832115	GH	On-Demand	Anodyne	CACNA2D1	0	52
COc1cccc(CSCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450832115	GH	On-Demand	Anodyne	PDGFRB	35	40
COc1cccc(CSCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450832115	GH	On-Demand	Anodyne	MTNR1A	87	43
COc1cccc(CSCCC(=O)NCc2ccc(OC)cc2OC)c1	ZINC000450832115	GH	On-Demand	Anodyne	MTNR1B	80	43
COCCOc1ccc(C#N)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450832139	FE	On-Demand	Mild	PDGFRB	18	45
COCCOc1ccc(C#N)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450832139	FE	On-Demand	Mild	SLC9A1	46	33
COCCOc1ccc(C#N)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450832139	FE	On-Demand	Mild	HDAC1	25	41
COCCOc1ccc(C#N)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450832139	FE	On-Demand	Mild	FASN	37	54
CCOC(=O)c1ccc(CSc2ccc(S(C)(=O)=O)cc2)nc1	ZINC000450832151	FF	On-Demand	Anodyne	LOX1.1	40	38
CCOC(=O)c1ccc(CSc2ccc(S(C)(=O)=O)cc2)nc1	ZINC000450832151	FF	On-Demand	Anodyne	O49150_SOLTU	46	38
COCCOc1ccc(C#N)cc1NC(=O)CCc1nc2cnccc2[nH]1	ZINC000450832179	FE	On-Demand	Mild	ENPP1	43	42
O=C1CCCc2cc(OCc3nc(COc4ccc(F)cc4)no3)ccc21	ZINC000450832193	FH	On-Demand	Anodyne	MAOB	19	63
CCOC(=O)COc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450832194	DD	On-Demand	Anodyne	EPHX2	30	54
CCOC(=O)COc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450832194	DD	On-Demand	Anodyne	METAP2	24	48
CCOC(=O)COc1ccc(NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450832195	DD	On-Demand	Anodyne	EPHX2	30	54
CCOC(=O)COc1ccc(NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450832195	DD	On-Demand	Anodyne	METAP2	24	48
CCN1CCCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450832235	FD	On-Demand	Anodyne	MTNR1A	56	41
CCN1CCCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450832235	FD	On-Demand	Anodyne	MTNR1B	45	40
NC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCCC(=O)c1ccc(F)cc1	ZINC000450832240	DE	On-Demand	Anodyne	CYP2J2	44	31
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCCC(=O)c1ccc(F)cc1	ZINC000450832241	DE	On-Demand	Anodyne	CYP2J2	44	31
NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCC(=O)c1ccc(F)cc1	ZINC000450832242	DE	On-Demand	Anodyne	CYP2J2	44	31
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCCC(=O)c1ccc(F)cc1	ZINC000450832243	DE	On-Demand	Anodyne	CYP2J2	44	31
COC(=O)c1coc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)n1	ZINC000450832262	FH	On-Demand	Anodyne	TYMS	0	42
COC(=O)c1coc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)n1	ZINC000450832262	FH	On-Demand	Anodyne	GSK3B	0	45
COC(=O)c1coc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)n1	ZINC000450832262	FH	On-Demand	Anodyne	GSK3A	37	44
Fc1ccccc1Cc1nnc(SCc2ccn(CC(F)(F)F)n2)o1	ZINC000450832269	FH	On-Demand	Anodyne	PTK2	23	47
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H]2C)cc1	ZINC000450832279	ED	On-Demand	Anodyne	SLC6A1	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H]2C)cc1	ZINC000450832280	ED	On-Demand	Anodyne	SLC6A1	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H]2C)cc1	ZINC000450832281	ED	On-Demand	Anodyne	SLC6A1	0	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H]2C)cc1	ZINC000450832282	ED	On-Demand	Anodyne	SLC6A1	0	40
CCCOc1cccc(CN2C(=O)N[C@@](C)(c3cccc(C(N)=O)c3)C2=O)c1	ZINC000450832305	GF	On-Demand	Anodyne	HRH2	32	42
CCCOc1cccc(CN2C(=O)N[C@](C)(c3cccc(C(N)=O)c3)C2=O)c1	ZINC000450832306	GF	On-Demand	Anodyne	HRH2	32	42
COc1cc2c(N3CC[S@@](=O)C(C)(C)CC3)ncnc2cc1F	ZINC000450832313	EF	On-Demand	Anodyne	PDE3A	51	38
COc1cc2c(N3CC[S@@](=O)C(C)(C)CC3)ncnc2cc1F	ZINC000450832313	EF	On-Demand	Anodyne	PDGFRB	70	42
COc1cc2c(N3CC[S@](=O)C(C)(C)CC3)ncnc2cc1F	ZINC000450832314	EF	On-Demand	Anodyne	PDE3A	51	38
COc1cc2c(N3CC[S@](=O)C(C)(C)CC3)ncnc2cc1F	ZINC000450832314	EF	On-Demand	Anodyne	PDGFRB	70	42
O=C(c1ccc(NC[C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450832315	FE	On-Demand	Bother	L3MBTL3	42	44
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H]2C)cc1Cl	ZINC000450832318	EF	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H]2C)cc1Cl	ZINC000450832319	EF	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H]2C)cc1Cl	ZINC000450832320	EF	On-Demand	Anodyne	SLC6A1	0	41
CCc1cc(N2CC(c3ccc(Cl)cc3)C2)n2ncnc2n1	ZINC000450832347	DF	On-Demand	Anodyne	DHOD	0	40
CCN(CCc1c(Cl)cccc1Cl)CC(N)=O	ZINC000450832353	CE	On-Demand	Anodyne	MBTPS1	15	42
COC(=O)CNC(=O)c1ccc(N[C@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450832365	GD	On-Demand	Bother	TAAR1	18	42
COC(=O)CNC(=O)c1ccc(N[C@@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450832367	GD	On-Demand	Bother	TAAR1	18	42
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832386	DF	On-Demand	Anodyne	DRD2	31	41
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832386	DF	On-Demand	Anodyne	DRD4	0	49
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832386	DF	On-Demand	Anodyne	ERG2	28	41
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832386	DF	On-Demand	Anodyne	SLC18A3	0	44
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832386	DF	On-Demand	Anodyne	CYP2J2	52	36
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832387	DF	On-Demand	Anodyne	DRD2	31	41
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832387	DF	On-Demand	Anodyne	DRD4	0	49
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832387	DF	On-Demand	Anodyne	ERG2	28	41
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832387	DF	On-Demand	Anodyne	SLC18A3	0	44
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832387	DF	On-Demand	Anodyne	CYP2J2	52	36
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832388	DF	On-Demand	Anodyne	DRD2	31	41
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832388	DF	On-Demand	Anodyne	DRD4	0	49
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832388	DF	On-Demand	Anodyne	ERG2	28	41
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832388	DF	On-Demand	Anodyne	SLC18A3	0	44
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450832388	DF	On-Demand	Anodyne	CYP2J2	52	36
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832389	DF	On-Demand	Anodyne	DRD2	31	41
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832389	DF	On-Demand	Anodyne	DRD4	0	49
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832389	DF	On-Demand	Anodyne	ERG2	28	41
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832389	DF	On-Demand	Anodyne	SLC18A3	0	44
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)O1	ZINC000450832389	DF	On-Demand	Anodyne	CYP2J2	52	36
CS(=O)(=O)c1ccc(NCCC2(CO)CC2)c(C(F)(F)F)c1	ZINC000450832394	EF	On-Demand	Anodyne	SFRP1	42	32
COC(=O)c1cc(C)nc(N2CC(c3cccc(Cl)c3)C2)c1[N+](=O)[O-]	ZINC000450832448	FG	On-Demand	Bother	CACNA1D	72	36
CN1[C@H]2CC[C@H]1CC(Nc1ncnc3cc(Br)ccc13)C2	ZINC000450832455	EG	On-Demand	Anodyne	EGFR	59	42
CN1[C@H]2CC[C@H]1CC(Nc1ncnc3cc(Br)ccc13)C2	ZINC000450832455	EG	On-Demand	Anodyne	CD38	44	38
CC(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)nc1	ZINC000450832482	CH	On-Demand	Anodyne	SLC6A7	0	40
CN(CCN1CCc2c(ncn(C)c2=O)C1)Cc1ccccc1	ZINC000450832483	DD	On-Demand	Anodyne	SIGMAR1	17	48
Cc1cc(N(C)[C@H](CO)CC(C)(C)C)nc(-c2cccnc2)n1	ZINC000450832487	DG	On-Demand	Anodyne	ROS1	41	33
Cc1cc(N(C)[C@@H](CO)CC(C)(C)C)nc(-c2cccnc2)n1	ZINC000450832489	DG	On-Demand	Anodyne	ROS1	41	33
CN(CCc1ccc(Cl)cc1)[C@@H]1CC[C@@H](O)CC1	ZINC000450832490	CG	On-Demand	Anodyne	C5AR1	28	56
COC(=O)c1csc(CN2CCc3cc(C)ccc3C2)n1	ZINC000450832494	DF	On-Demand	Anodyne	ABCB1B	56	35
COC(=O)c1csc(CN2CCc3cc(C)ccc3C2)n1	ZINC000450832494	DF	On-Demand	Anodyne	NOD2	43	38
COC(=O)c1csc(CN2CCc3cc(C)ccc3C2)n1	ZINC000450832494	DF	On-Demand	Anodyne	TRPC6	40	39
COC(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)C[C@@H]1C	ZINC000450832506	CG	On-Demand	Anodyne	SLC6A1	29	48
COC(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)C[C@H]1C	ZINC000450832507	CG	On-Demand	Anodyne	SLC6A1	29	48
COC(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)C[C@@H]1C	ZINC000450832508	CG	On-Demand	Anodyne	SLC6A1	29	48
COC(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)C[C@H]1C	ZINC000450832509	CG	On-Demand	Anodyne	SLC6A1	29	48
COC(=O)c1csc(CN2C(=O)N[C@](C)(Cc3ccc(OC)cc3)C2=O)n1	ZINC000450832519	GD	On-Demand	Anodyne	PROKR1	43	30
COC(=O)c1csc(CN2C(=O)N[C@@](C)(Cc3ccc(OC)cc3)C2=O)n1	ZINC000450832520	GD	On-Demand	Anodyne	PROKR1	43	30
CCc1cc(N[C@@H]2C[C@H](C)n3ccnc32)n2ncnc2n1	ZINC000450832541	CE	On-Demand	Anodyne	DHOD	0	44
CCc1cc(N[C@H]2C[C@@H](C)n3ccnc32)n2ncnc2n1	ZINC000450832542	CE	On-Demand	Anodyne	DHOD	0	44
CCc1cc(N[C@@H]2C[C@@H](C)n3ccnc32)n2ncnc2n1	ZINC000450832543	CE	On-Demand	Anodyne	DHOD	0	44
CCc1cc(N[C@H]2C[C@H](C)n3ccnc32)n2ncnc2n1	ZINC000450832544	CE	On-Demand	Anodyne	DHOD	0	44
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1c[nH]c2ccccc12	ZINC000450832561	GH	On-Demand	Anodyne	TACR1	41	44
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1c[nH]c2ccccc12	ZINC000450832561	GH	On-Demand	Anodyne	NQO2	15	40
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1c[nH]c2ccccc12	ZINC000450832561	GH	On-Demand	Anodyne	BCHE	15	40
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1c[nH]c2ccccc12	ZINC000450832561	GH	On-Demand	Anodyne	MTNR1A	50	47
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1c[nH]c2ccccc12	ZINC000450832561	GH	On-Demand	Anodyne	MTNR1B	41	40
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1c[nH]c2ccccc12	ZINC000450832561	GH	On-Demand	Anodyne	GRPR	58	34
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1c[nH]c2ccccc12	ZINC000450832561	GH	On-Demand	Anodyne	CCKBR	46	37
CCN(CCC(=O)NCc1ccc(OC)cc1OC)Cc1c[nH]c2ccccc12	ZINC000450832561	GH	On-Demand	Anodyne	GHSR	42	47
COC(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H]2C)cc1Cl	ZINC000450832621	EF	On-Demand	Anodyne	SLC6A1	0	41
CCOC(=O)c1cccnc1N1CC[S@](=O)C(C)(C)CC1	ZINC000450832622	DD	On-Demand	Anodyne	P2RY12	43	34
CCOC(=O)c1cccnc1N1CC[S@@](=O)C(C)(C)CC1	ZINC000450832623	DD	On-Demand	Anodyne	P2RY12	43	34
C[C@@H](Sc1cc2c(cc1Cl)OCCO2)C(=O)Nc1nccs1	ZINC000450832637	FH	On-Demand	Anodyne	MAP1	86	36
C[C@H](Sc1cc2c(cc1Cl)OCCO2)C(=O)Nc1nccs1	ZINC000450832638	FH	On-Demand	Anodyne	MAP1	86	36
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832639	CF	On-Demand	Anodyne	SLC6A1	103	57
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832639	CF	On-Demand	Anodyne	SLC6A4	27	52
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832639	CF	On-Demand	Anodyne	SLC6A3	40	52
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832639	CF	On-Demand	Anodyne	HRH3	0	45
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832639	CF	On-Demand	Anodyne	CACNA1D	40	37
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832640	CF	On-Demand	Anodyne	SLC6A1	103	57
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832640	CF	On-Demand	Anodyne	SLC6A4	27	52
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832640	CF	On-Demand	Anodyne	SLC6A3	40	52
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832640	CF	On-Demand	Anodyne	HRH3	0	45
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832640	CF	On-Demand	Anodyne	CACNA1D	40	37
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832641	CF	On-Demand	Anodyne	SLC6A1	103	57
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832641	CF	On-Demand	Anodyne	SLC6A4	27	52
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832641	CF	On-Demand	Anodyne	SLC6A3	40	52
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832641	CF	On-Demand	Anodyne	HRH3	0	45
COC(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H]1C	ZINC000450832641	CF	On-Demand	Anodyne	CACNA1D	40	37
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832642	CF	On-Demand	Anodyne	SLC6A1	103	57
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832642	CF	On-Demand	Anodyne	SLC6A4	27	52
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832642	CF	On-Demand	Anodyne	SLC6A3	40	52
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832642	CF	On-Demand	Anodyne	HRH3	0	45
COC(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H]1C	ZINC000450832642	CF	On-Demand	Anodyne	CACNA1D	40	37
CC1(C)CCN(c2nc(-c3ccccc3)ns2)CC[S@@]1=O	ZINC000450832643	DF	On-Demand	Anodyne	FAAH	0	48
CC1(C)CCN(c2nc(-c3ccccc3)ns2)CC[S@]1=O	ZINC000450832644	DF	On-Demand	Anodyne	FAAH	0	48
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@](O)(C(N)=O)C1	ZINC000450832658	EE	On-Demand	Anodyne	OPRK1	16	44
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@](O)(C(N)=O)C1	ZINC000450832659	EE	On-Demand	Anodyne	OPRK1	16	44
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@@](O)(C(N)=O)C1	ZINC000450832660	EE	On-Demand	Anodyne	OPRK1	16	44
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@@](O)(C(N)=O)C1	ZINC000450832661	EE	On-Demand	Anodyne	OPRK1	16	44
CCc1nc(C)c(COc2cccc(F)c2F)o1	ZINC000450832673	CG	On-Demand	Anodyne	NMT1	18	40
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCCC(=O)c1ccccc1	ZINC000450832675	DE	On-Demand	Anodyne	CYP2J2	51	36
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCCC(=O)c1ccccc1	ZINC000450832676	DE	On-Demand	Anodyne	CYP2J2	51	36
NC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCCC(=O)c1ccccc1	ZINC000450832677	DE	On-Demand	Anodyne	CYP2J2	51	36
NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCC(=O)c1ccccc1	ZINC000450832678	DE	On-Demand	Anodyne	CYP2J2	51	36
Cc1nn(C)cc1CSc1nnc(-c2ccc(C(C)C)cc2)o1	ZINC000450832684	EI	On-Demand	Anodyne	TYMS	28	48
Cc1nn(C)cc1CSc1nnc(-c2ccc(C(C)C)cc2)o1	ZINC000450832684	EI	On-Demand	Anodyne	GSK3A	47	39
Cc1nn(C)cc1CSc1nnc(-c2ccc(C(C)C)cc2)o1	ZINC000450832684	EI	On-Demand	Anodyne	TERT	27	43
Cc1nn(C)cc1CN1CCN(c2cncc3ccccc23)CC1	ZINC000450832688	DF	On-Demand	Anodyne	DRD1	0	47
Cc1nn(C)cc1CN1CCN(c2cncc3ccccc23)CC1	ZINC000450832688	DF	On-Demand	Anodyne	DRD4	36	47
CC(C)c1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1	ZINC000450832700	FK	On-Demand	Anodyne	TYMS	0	44
CC(C)c1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1	ZINC000450832700	FK	On-Demand	Anodyne	GSK3B	17	42
CC(C)c1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1	ZINC000450832700	FK	On-Demand	Anodyne	GSK3A	48	42
Cc1nn(C)cc1CSc1nnc(Cc2cccc(F)c2)o1	ZINC000450832702	DG	On-Demand	Anodyne	PTK2	25	52
CC[C@@H](c1ccccc1)c1nnc(SCCCCCC(C)=O)o1	ZINC000450832705	EJ	On-Demand	Anodyne	HDA106	0	41
CC[C@@H](c1ccccc1)c1nnc(SCCCCCC(C)=O)o1	ZINC000450832705	EJ	On-Demand	Anodyne	HD1B	0	41
CC[C@H](c1ccccc1)c1nnc(SCCCCCC(C)=O)o1	ZINC000450832706	EJ	On-Demand	Anodyne	HDA106	0	41
CC[C@H](c1ccccc1)c1nnc(SCCCCCC(C)=O)o1	ZINC000450832706	EJ	On-Demand	Anodyne	HD1B	0	41
COC(=O)CNC(=O)c1ccc(N2CC[S@@](=O)C(C)(C)CC2)c([N+](=O)[O-])c1	ZINC000450832710	GD	On-Demand	Bother	TAAR1	23	45
COC(=O)CNC(=O)c1ccc(N2CC[S@](=O)C(C)(C)CC2)c([N+](=O)[O-])c1	ZINC000450832711	GD	On-Demand	Bother	TAAR1	23	45
CC1(C)CCN(c2ncc(-c3ccccc3)s2)CC[S@@]1=O	ZINC000450832713	DH	On-Demand	Anodyne	LUCI_LUCLA	17	41
CC1(C)CCN(c2ncc(-c3ccccc3)s2)CC[S@]1=O	ZINC000450832714	DH	On-Demand	Anodyne	LUCI_LUCLA	17	41
CN1[C@H]2CC[C@H]1CC(Nc1ccc(C(=O)N3CCOCC3)cc1[N+](=O)[O-])C2	ZINC000450832722	FE	On-Demand	Bother	HRH3	16	42
CN1[C@H]2CC[C@H]1CC(Nc1ccc(C(=O)N3CCOCC3)cc1[N+](=O)[O-])C2	ZINC000450832722	FE	On-Demand	Bother	L3MBTL3	46	44
COc1cccc(OCCC(=O)NCC[C@@H]2CCOC2)c1	ZINC000450832731	CE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)NCC[C@@H]2CCOC2)c1	ZINC000450832731	CE	On-Demand	Anodyne	NQO2	36	44
COc1cccc(OCCC(=O)NCC[C@@H]2CCOC2)c1	ZINC000450832731	CE	On-Demand	Anodyne	MTNR1A	69	42
COc1cccc(OCCC(=O)NCC[C@H]2CCOC2)c1	ZINC000450832732	CE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)NCC[C@H]2CCOC2)c1	ZINC000450832732	CE	On-Demand	Anodyne	NQO2	36	44
COc1cccc(OCCC(=O)NCC[C@H]2CCOC2)c1	ZINC000450832732	CE	On-Demand	Anodyne	MTNR1A	69	42
C[C@@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832733	EJ	On-Demand	Anodyne	MAP	0	48
C[C@@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832733	EJ	On-Demand	Anodyne	MAP1	121	48
C[C@@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832733	EJ	On-Demand	Anodyne	GCK	23	41
C[C@@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832733	EJ	On-Demand	Anodyne	FFAR2	42	70
C[C@H](S[C@@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832734	EJ	On-Demand	Anodyne	MAP	0	48
C[C@H](S[C@@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832734	EJ	On-Demand	Anodyne	MAP1	121	48
C[C@H](S[C@@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832734	EJ	On-Demand	Anodyne	GCK	23	41
C[C@H](S[C@@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832734	EJ	On-Demand	Anodyne	FFAR2	42	70
C[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccc(Cl)cc1	ZINC000450832735	EJ	On-Demand	Anodyne	MAP	0	48
C[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccc(Cl)cc1	ZINC000450832735	EJ	On-Demand	Anodyne	MAP1	121	48
C[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccc(Cl)cc1	ZINC000450832735	EJ	On-Demand	Anodyne	GCK	23	41
C[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccc(Cl)cc1	ZINC000450832735	EJ	On-Demand	Anodyne	FFAR2	42	70
C[C@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832736	EJ	On-Demand	Anodyne	MAP	0	48
C[C@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832736	EJ	On-Demand	Anodyne	MAP1	121	48
C[C@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832736	EJ	On-Demand	Anodyne	GCK	23	41
C[C@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1nccs1	ZINC000450832736	EJ	On-Demand	Anodyne	FFAR2	42	70
Cc1cccc([C@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C2)c1	ZINC000450832744	DG	On-Demand	Anodyne	MAP3K12	34	41
Cc1cccc([C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C2)c1	ZINC000450832745	DG	On-Demand	Anodyne	MAP3K12	34	41
COc1cccc(CSCc2cn(CC3CC3)nn2)c1	ZINC000450832777	CG	On-Demand	Anodyne	FIMH	20	43
O=S(=O)(c1ccc(OCC2CC(F)(F)C2)cc1)N1CCCCC1	ZINC000450832783	EG	On-Demand	Anodyne	ADAM17	26	41
C[C@H]1Cc2cccc(C(=O)N3CCC[C@H](n4cnc(C(N)=O)n4)C3)c2O1	ZINC000450832788	FD	On-Demand	Anodyne	PARP1	0	51
C[C@@H]1Cc2cccc(C(=O)N3CCC[C@@H](n4cnc(C(N)=O)n4)C3)c2O1	ZINC000450832790	FD	On-Demand	Anodyne	PARP1	0	51
C[C@H]1Cc2cccc(C(=O)N3CCC[C@@H](n4cnc(C(N)=O)n4)C3)c2O1	ZINC000450832791	FD	On-Demand	Anodyne	PARP1	0	51
C[C@@H]1Cc2cccc(C(=O)N3CCC[C@H](n4cnc(C(N)=O)n4)C3)c2O1	ZINC000450832793	FD	On-Demand	Anodyne	PARP1	0	51
CS(=O)(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)c(C(F)(F)F)c1	ZINC000450832797	GI	On-Demand	Anodyne	NR1H3	40	37
CC(C)n1ccc(=O)nc1S[C@H](C)C(=O)Nc1nccs1	ZINC000450832821	DE	On-Demand	Anodyne	MAP1	102	36
CC(C)n1ccc(=O)nc1S[C@@H](C)C(=O)Nc1nccs1	ZINC000450832822	DE	On-Demand	Anodyne	MAP1	102	36
CCCc1cc(N[C@@H]2CCc3cc(F)c(F)c(F)c32)n2ncnc2n1	ZINC000450832846	EH	On-Demand	Anodyne	DHOD	0	41
CN1[C@H]2CC[C@H]1CC(Nc1ncnc3scc(-c4ccccc4)c13)C2	ZINC000450832847	FI	On-Demand	Anodyne	ADRB3	29	50
CCCc1cc(N[C@H]2CCc3cc(F)c(F)c(F)c32)n2ncnc2n1	ZINC000450832848	EH	On-Demand	Anodyne	DHOD	0	41
COc1ccc(CNC(=O)CCN2CCc3cc(C)ccc3C2)c(OC)c1	ZINC000450832858	FG	On-Demand	Anodyne	DRD4	42	35
COc1ccc(CNC(=O)CCN2CCc3cc(C)ccc3C2)c(OC)c1	ZINC000450832858	FG	On-Demand	Anodyne	HTR7	35	47
COc1ccc(CNC(=O)CCN2CCc3cc(C)ccc3C2)c(OC)c1	ZINC000450832858	FG	On-Demand	Anodyne	ABCB1B	61	40
COc1ccc(CNC(=O)CCN2CCc3cc(C)ccc3C2)c(OC)c1	ZINC000450832858	FG	On-Demand	Anodyne	MTNR1A	45	39
COc1ccc(CNC(=O)CCN2CCc3cc(C)ccc3C2)c(OC)c1	ZINC000450832858	FG	On-Demand	Anodyne	ABCB1	24	41
CC(=O)CCCCCOc1ccc(C(C)=O)c(F)c1	ZINC000450832870	CH	On-Demand	Anodyne	SHC	26	47
CC(=O)CCCCCOc1ccc(C(C)=O)c(F)c1	ZINC000450832870	CH	On-Demand	Anodyne	PLA2G4B	73	36
CC(=O)CCCCCOc1ccc(C(C)=O)c(F)c1	ZINC000450832870	CH	On-Demand	Anodyne	LSS	28	44
O=S(=O)(c1ccc(N[C@H]2CCc3cc(F)c(F)c(F)c32)nc1)N1CCCC1	ZINC000450832877	GG	On-Demand	Anodyne	TGM2	21	46
O=S(=O)(c1ccc(N[C@@H]2CCc3cc(F)c(F)c(F)c32)nc1)N1CCCC1	ZINC000450832878	GG	On-Demand	Anodyne	TGM2	21	46
CC(=O)CCCCCn1c(=O)oc2cc(S(=O)(=O)N(C)C)ccc21	ZINC000450832908	FD	On-Demand	Anodyne	TSPO	15	41
CC[C@H](CC(F)(F)F)C(=O)Nc1ccccc1-n1nccc1C	ZINC000450832910	EI	On-Demand	Anodyne	KCNQ2	57	38
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccccc1-n1nccc1C	ZINC000450832912	EI	On-Demand	Anodyne	KCNQ2	57	38
COC(=O)c1cccc(COc2nc(C)no2)c1Cl	ZINC000450832913	CE	On-Demand	Anodyne	MT-CYB	51	32
CCCOc1ccc(C(=O)NC[C@@H]2CC23CCOCC3)c(OC)c1	ZINC000450832927	EG	On-Demand	Anodyne	KCNQ1	0	40
CCCOc1ccc(C(=O)NC[C@H]2CC23CCOCC3)c(OC)c1	ZINC000450832928	EG	On-Demand	Anodyne	KCNQ1	0	40
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)c2nccn2CC)c([N+](=O)[O-])c1	ZINC000450832931	GG	On-Demand	Bother	BDKRB1	23	45
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)c2nccn2CC)c([N+](=O)[O-])c1	ZINC000450832931	GG	On-Demand	Bother	COLA	47	32
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)c2nccn2CC)c([N+](=O)[O-])c1	ZINC000450832941	GG	On-Demand	Bother	BDKRB1	23	45
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)c2nccn2CC)c([N+](=O)[O-])c1	ZINC000450832941	GG	On-Demand	Bother	COLA	47	32
CCC(CC)(CCSc1ccc(S(C)(=O)=O)cc1)C(=O)OC	ZINC000450832953	EH	On-Demand	Anodyne	LOX1.1	45	34
CCC(CC)(CCSc1ccc(S(C)(=O)=O)cc1)C(=O)OC	ZINC000450832953	EH	On-Demand	Anodyne	O49150_SOLTU	48	34
CCN(Cc1cn(CC2CC2)nn1)Cc1c[nH]c2ccccc12	ZINC000450832988	DG	On-Demand	Anodyne	HSP90AB1	0	44
COc1cc([N+](=O)[O-])ccc1OCCCCCC(C)=O	ZINC000450832992	CG	On-Demand	Bother	THRA	0	44
COc1cc([N+](=O)[O-])ccc1OCCCCCC(C)=O	ZINC000450832992	CG	On-Demand	Bother	S1PR4	0	40
CC(C)(CC(=O)CSc1ccc(S(C)(=O)=O)cc1)C1CC1	ZINC000450833013	EH	On-Demand	Anodyne	O49150_SOLTU	42	34
Cc1ccnn1-c1ccccc1NC(=O)CCCC(=O)C1CC1	ZINC000450833018	DG	On-Demand	Anodyne	KCNQ2	54	36
CC(C)(C)c1cc(COc2ccc3c(c2)CCCC3=O)no1	ZINC000450833019	CI	On-Demand	Anodyne	MAOB	18	56
COC(=O)[C@H]1CCN(Cc2ccc(C(C)=O)cc2)[C@@H]1C	ZINC000450833022	CE	On-Demand	Anodyne	SLC6A1	27	42
COC(=O)[C@@H]1CCN(Cc2ccc(C(C)=O)cc2)[C@@H]1C	ZINC000450833023	CE	On-Demand	Anodyne	SLC6A1	27	42
COC(=O)[C@H]1CCN(Cc2ccc(C(C)=O)cc2)[C@H]1C	ZINC000450833024	CE	On-Demand	Anodyne	SLC6A1	27	42
COC(=O)[C@@H]1CCN(Cc2ccc(C(C)=O)cc2)[C@H]1C	ZINC000450833025	CE	On-Demand	Anodyne	SLC6A1	27	42
CCS(=O)(=O)c1ccc(CN2CCN(c3cncc4ccccc34)CC2)cc1	ZINC000450833030	GG	On-Demand	Anodyne	HTR1A	24	45
CCS(=O)(=O)c1ccc(CN2CCN(c3cncc4ccccc34)CC2)cc1	ZINC000450833030	GG	On-Demand	Anodyne	DRD2	23	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cncc4ccccc34)CC2)cc1	ZINC000450833030	GG	On-Demand	Anodyne	DRD3	15	40
CCS(=O)(=O)c1ccc(CN2CCN(c3cncc4ccccc34)CC2)cc1	ZINC000450833030	GG	On-Demand	Anodyne	HTR7	36	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cncc4ccccc34)CC2)cc1	ZINC000450833030	GG	On-Demand	Anodyne	HTR6	17	43
CC(C)NC(=O)c1ccc(N2CC[S@@](=O)C(C)(C)CC2)c([N+](=O)[O-])c1	ZINC000450833032	FE	On-Demand	Bother	TAAR1	28	48
CC(C)NC(=O)c1ccc(N2CC[S@](=O)C(C)(C)CC2)c([N+](=O)[O-])c1	ZINC000450833033	FE	On-Demand	Bother	TAAR1	28	48
Cc1nc(C(C)C)oc1COc1cccc(F)c1F	ZINC000450833041	CH	On-Demand	Anodyne	NMT1	17	40
CCOC(=O)c1c(N2CC[S@@](=O)C(C)(C)CC2)nc2ccccc2c1C	ZINC000450833053	FG	On-Demand	Anodyne	HTR3A	17	40
CCOC(=O)c1c(N2CC[S@](=O)C(C)(C)CC2)nc2ccccc2c1C	ZINC000450833054	FG	On-Demand	Anodyne	HTR3A	17	40
CC1(C)CCN(c2ncnc3cc(F)c(F)cc23)CC[S@]1=O	ZINC000450833055	EF	On-Demand	Anodyne	PDGFRB	23	41
CC1(C)CCN(c2ncnc3cc(F)c(F)cc23)CC[S@@]1=O	ZINC000450833056	EF	On-Demand	Anodyne	PDGFRB	23	41
CNC(=O)c1ccc(N2CC[S@@](=O)C(C)(C)CC2)c([N+](=O)[O-])c1	ZINC000450833087	ED	On-Demand	Bother	TAAR1	19	45
CNC(=O)c1ccc(N2CC[S@](=O)C(C)(C)CC2)c([N+](=O)[O-])c1	ZINC000450833091	ED	On-Demand	Bother	TAAR1	19	45
COC(=O)c1ccc([N+](=O)[O-])c(N2CC(c3cccc(Cl)c3)C2)n1	ZINC000450833105	EG	On-Demand	Bother	CACNA1D	62	33
CC(=O)c1cccc(CN2CCc3cc(C)ccc3C2)c1	ZINC000450833120	CH	On-Demand	Anodyne	DRD4	22	43
CC(=O)c1cccc(CN2CCc3cc(C)ccc3C2)c1	ZINC000450833120	CH	On-Demand	Anodyne	AKR1C3	40	47
CC(=O)c1cccc(CN2CCc3cc(C)ccc3C2)c1	ZINC000450833120	CH	On-Demand	Anodyne	NOD1	31	41
CC(=O)c1cccc(CN2CCc3cc(C)ccc3C2)c1	ZINC000450833120	CH	On-Demand	Anodyne	NOD2	48	41
CC[C@H](c1ccccc1)c1nnc(SCc2cccc(C(C)=O)c2)o1	ZINC000450833134	FK	On-Demand	Anodyne	GSK3A	30	44
COc1cc(OC)c2ncc(C#N)c(NCCC3(CO)CC3)c2c1	ZINC000450833136	EF	On-Demand	Mild	SRC	57	35
CC[C@@H](c1ccccc1)c1nnc(SCc2cccc(C(C)=O)c2)o1	ZINC000450833137	FK	On-Demand	Anodyne	GSK3A	30	44
CN1[C@H]2CC[C@H]1CC(Nc1ncnc3sc4ccccc4c13)C2	ZINC000450833172	DH	On-Demand	Anodyne	IRAK4	21	64
CN1[C@H]2CC[C@H]1CC(Nc1cc(Br)cnc1C(N)=O)C2	ZINC000450833191	ED	On-Demand	Anodyne	SYK	47	33
CN1[C@H]2CC[C@H]1CC(Nc1cc(Br)cnc1C(N)=O)C2	ZINC000450833191	ED	On-Demand	Anodyne	GLRA1	42	34
O=S(=O)(NCC(F)(F)F)NC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450833200	GE	On-Demand	Anodyne	SIGMAR1	25	47
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450833203	GH	On-Demand	Anodyne	DRD4	0	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450833203	GH	On-Demand	Anodyne	HTR2A	15	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450833203	GH	On-Demand	Anodyne	HTR2C	15	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450833203	GH	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450833205	GH	On-Demand	Anodyne	DRD4	0	40
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450833205	GH	On-Demand	Anodyne	HTR2A	15	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450833205	GH	On-Demand	Anodyne	HTR2C	15	44
COC(=O)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450833205	GH	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450833207	GH	On-Demand	Anodyne	DRD4	0	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450833207	GH	On-Demand	Anodyne	HTR2A	15	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450833207	GH	On-Demand	Anodyne	HTR2C	15	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@H]1C	ZINC000450833207	GH	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450833209	GH	On-Demand	Anodyne	DRD4	0	40
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450833209	GH	On-Demand	Anodyne	HTR2A	15	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450833209	GH	On-Demand	Anodyne	HTR2C	15	44
COC(=O)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C[C@@H]1C	ZINC000450833209	GH	On-Demand	Anodyne	CYP2J2	57	41
COC(=O)[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)[C@H]1C	ZINC000450833215	CE	On-Demand	Anodyne	ACE	42	36
COC(=O)[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)[C@H]1C	ZINC000450833215	CE	On-Demand	Anodyne	SLC6A1	35	42
COC(=O)[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)[C@H]1C	ZINC000450833215	CE	On-Demand	Anodyne	MME	44	35
COC(=O)[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)[C@@H]1C	ZINC000450833217	CE	On-Demand	Anodyne	ACE	42	36
COC(=O)[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)[C@@H]1C	ZINC000450833217	CE	On-Demand	Anodyne	SLC6A1	35	42
COC(=O)[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)[C@@H]1C	ZINC000450833217	CE	On-Demand	Anodyne	MME	44	35
COC(=O)[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)[C@H]1C	ZINC000450833219	CE	On-Demand	Anodyne	ACE	42	36
COC(=O)[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)[C@H]1C	ZINC000450833219	CE	On-Demand	Anodyne	SLC6A1	35	42
COC(=O)[C@@H]1CCN(C[C@@H](Cc2ccccc2)OC)[C@H]1C	ZINC000450833219	CE	On-Demand	Anodyne	MME	44	35
COC(=O)[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)[C@@H]1C	ZINC000450833220	CE	On-Demand	Anodyne	ACE	42	36
COC(=O)[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)[C@@H]1C	ZINC000450833220	CE	On-Demand	Anodyne	SLC6A1	35	42
COC(=O)[C@@H]1CCN(C[C@H](Cc2ccccc2)OC)[C@@H]1C	ZINC000450833220	CE	On-Demand	Anodyne	MME	44	35
COC(=O)C1(CN2CC(=O)N(C)[C@@H]2c2ccccc2)CC1	ZINC000450833226	CD	On-Demand	Anodyne	HSD17B2	57	33
COC(=O)C1(CN2CC(=O)N(C)[C@H]2c2ccccc2)CC1	ZINC000450833228	CD	On-Demand	Anodyne	HSD17B2	57	33
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@H](OC)C2)c(OC)c1	ZINC000450833250	FE	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@@H](OC)C2)c(OC)c1	ZINC000450833251	FE	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2CC[C@H](C)[C@@H](OC)C2)c(OC)c1	ZINC000450833252	FE	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[C@H](OC)C2)c(OC)c1	ZINC000450833253	FE	On-Demand	Anodyne	MTNR1A	47	36
CCOC(=O)c1ccc(CSCc2cccc(OC)c2)nc1	ZINC000450833257	DH	On-Demand	Anodyne	P2RY12	18	43
CCOC(=O)c1ccc(CSCc2cccc(OC)c2)nc1	ZINC000450833257	DH	On-Demand	Anodyne	LTB4R	17	42
CCOC(=O)c1ccc(CSCc2cccc(OC)c2)nc1	ZINC000450833257	DH	On-Demand	Anodyne	ROCK2	41	35
Cc1nn(C)cc1COc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450833262	FH	On-Demand	Anodyne	KCNA3	22	40
Cc1nn(C)cc1COc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450833262	FH	On-Demand	Anodyne	SLC6A5	26	40
Cc1nn(C)cc1COc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450833262	FH	On-Demand	Anodyne	HCN1	51	41
Cc1nn(C)cc1COc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450833262	FH	On-Demand	Anodyne	HCN4	40	31
CN(CCOc1nc(C(C)(C)C)no1)Cc1ccccc1	ZINC000450833284	CF	On-Demand	Anodyne	ACHE	0	43
COC(=O)CN(CC[C@@H](C)O)Cc1cccc(Br)c1	ZINC000450833289	EE	On-Demand	Anodyne	PTGES	19	49
COC(=O)CN(CC[C@H](C)O)Cc1cccc(Br)c1	ZINC000450833290	EE	On-Demand	Anodyne	PTGES	19	49
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	HTR1A	24	55
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	THRA	0	41
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	DRD2	38	49
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	DRD1	38	55
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	DRD4	27	55
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	HTR2A	31	48
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	HTR2C	26	55
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	DRD3	32	47
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	DRD5	22	45
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	ERG2	23	49
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	THRB	0	41
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	HTR7	37	46
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	SLC18A3	0	50
COCCC(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450833294	ED	On-Demand	Anodyne	CYP2J2	54	39
O=[N+]([O-])c1ccc(-c2csc(NCCC3(CO)CC3)n2)cc1	ZINC000450833299	DF	On-Demand	Bother	MAOB	15	50
C[C@H](OCc1ccc(F)cc1)C(=O)N(C)c1ccc(N2CCOCC2)nc1	ZINC000450833344	FF	On-Demand	Anodyne	DGAT1	29	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N(C)c1ccc(N2CCOCC2)nc1	ZINC000450833345	FF	On-Demand	Anodyne	DGAT1	29	42
COCCOc1ccc(C#N)cc1NC(=O)c1nn(C)c2c1CCCC2	ZINC000450833370	FE	On-Demand	Mild	PDGFRB	15	40
COCCOc1ccc(C#N)cc1NC(=O)c1nn(C)c2c1CCCC2	ZINC000450833370	FE	On-Demand	Mild	SLC9A1	19	40
C[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@@H]([C@@H](C)O)C1	ZINC000450833386	CG	On-Demand	Anodyne	Q8WSF8_APLCA	43	35
C[C@H](O)[C@H]1C[C@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450833387	CG	On-Demand	Anodyne	Q8WSF8_APLCA	43	35
C[C@@H]1CCN(CCCC(=O)c2ccccc2)[C@H]([C@@H](C)O)C1	ZINC000450833388	CG	On-Demand	Anodyne	Q8WSF8_APLCA	43	35
C[C@H](O)[C@@H]1C[C@H](C)CCN1CCCC(=O)c1ccccc1	ZINC000450833389	CG	On-Demand	Anodyne	Q8WSF8_APLCA	43	35
COc1cccc(OCCC(=O)NCCC2CCC(OC)CC2)c1	ZINC000450833403	EG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)NCCC2CCC(OC)CC2)c1	ZINC000450833403	EG	On-Demand	Anodyne	NQO2	41	44
COc1cccc(OCCC(=O)NCCC2CCC(OC)CC2)c1	ZINC000450833403	EG	On-Demand	Anodyne	MTNR1A	78	41
COc1cccc(OCCC(=O)NCCC2CCC(OC)CC2)c1	ZINC000450833403	EG	On-Demand	Anodyne	MTNR1B	54	37
COc1cccc(OCCC(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c1	ZINC000450833405	EG	On-Demand	Anodyne	GPBAR1	0	43
COc1cccc(OCCC(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)c1	ZINC000450833410	EG	On-Demand	Anodyne	GPBAR1	0	43
COc1cccc(OCCC(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)c1	ZINC000450833411	EG	On-Demand	Anodyne	GPBAR1	0	43
COC(=O)C1(CSc2ccc(S(C)(=O)=O)cc2)CCCC1	ZINC000450833412	EF	On-Demand	Anodyne	LOX1.1	49	37
COC(=O)C1(CSc2ccc(S(C)(=O)=O)cc2)CCCC1	ZINC000450833412	EF	On-Demand	Anodyne	O49150_SOLTU	52	37
COc1cccc(OCCC(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c1	ZINC000450833413	EG	On-Demand	Anodyne	GPBAR1	0	43
O=C(CNC(=O)Nc1cccc(Cl)c1)NCC1(CO)CCC1	ZINC000450833414	ED	On-Demand	Anodyne	NPFFR1	54	36
CCC(C)(C)OCc1ccccc1NC(=O)c1cncc(Cl)c1	ZINC000450833431	EJ	On-Demand	Anodyne	SCN10A	59	40
O=C(NC[C@@H]1CC12CCOCC2)c1ccc(I)cc1F	ZINC000450833432	GF	On-Demand	Anodyne	MAP2K1	45	31
O=C(NC[C@H]1CC12CCOCC2)c1ccc(I)cc1F	ZINC000450833433	GF	On-Demand	Anodyne	MAP2K1	45	31
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450833460	FG	On-Demand	Mild	PDE5A	21	42
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450833460	FG	On-Demand	Mild	MAPK9	0	40
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450833460	FG	On-Demand	Mild	NCE103	16	41
COCCOc1ccc(C#N)cc1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450833460	FG	On-Demand	Mild	CAN2	0	41
COC1CCC(CCNC(=O)c2c(C)cccc2Cl)CC1	ZINC000450833475	DH	On-Demand	Anodyne	DRD4	42	34
O[C@@H]1CCCC[C@H]1CNc1cncc(-c2ccccc2)n1	ZINC000450833496	CG	On-Demand	Anodyne	VCP	50	38
Cc1nc(NC2CCc3ccccc3CC2)ncc1[N+](=O)[O-]	ZINC000450833520	CG	On-Demand	Bother	PRKCQ	23	45
CC(=O)c1cccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)c1	ZINC000450833527	FK	On-Demand	Anodyne	TYMS	0	44
CC(=O)c1cccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)c1	ZINC000450833527	FK	On-Demand	Anodyne	GSK3B	22	55
CC(=O)c1cccc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)c1	ZINC000450833527	FK	On-Demand	Anodyne	GSK3A	60	48
C[C@H](c1ccccc1)[C@@H](O)CN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450833542	DF	On-Demand	Anodyne	HSD17B2	32	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450833543	DF	On-Demand	Anodyne	HSD17B2	32	40
C[C@H](c1ccccc1)[C@H](O)CN1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000450833544	DF	On-Demand	Anodyne	HSD17B2	32	40
C[C@H](c1ccccc1)[C@H](O)CN1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000450833545	DF	On-Demand	Anodyne	HSD17B2	32	40
O=C1NC2(CCSCC2)C(=O)N1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450833550	GI	On-Demand	Anodyne	DNAE	55	32
COC(=O)c1ncn(CCCCc2ccc(Cl)c(Cl)c2)n1	ZINC000450833572	EG	On-Demand	Anodyne	TPSAB1	44	35
COC(=O)c1ncn(CCCCc2ccc(Cl)c(Cl)c2)n1	ZINC000450833572	EG	On-Demand	Anodyne	DNAE	71	35
C[C@H](O)CCCN1CCC[C@]1(CO)Cc1ccccc1	ZINC000450833573	CE	On-Demand	Anodyne	SLC12A5	49	34
C[C@@H](O)CCCN1CCC[C@]1(CO)Cc1ccccc1	ZINC000450833574	CE	On-Demand	Anodyne	SLC12A5	49	34
C[C@H](O)CCCN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000450833575	CE	On-Demand	Anodyne	SLC12A5	49	34
C[C@@H](O)CCCN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000450833577	CE	On-Demand	Anodyne	SLC12A5	49	34
CC1(C)CCN(c2ncncc2-c2ccccc2)CC[S@]1=O	ZINC000450833590	DF	On-Demand	Anodyne	SLC9A1	0	47
CC1(C)CCN(c2ncncc2-c2ccccc2)CC[S@@]1=O	ZINC000450833591	DF	On-Demand	Anodyne	SLC9A1	0	47
COc1ccccc1Cc1nnc(SCCC(C)(F)F)o1	ZINC000450833599	DH	On-Demand	Anodyne	PTK2	23	51
Fc1cccc(OCC2CC(F)(F)C2)c1F	ZINC000450833600	BG	On-Demand	Anodyne	CHRNA10	15	51
C[C@H](O)CCCN1CCN(c2cncc3ccccc23)CC1	ZINC000450833604	CF	On-Demand	Anodyne	DRD2	58	42
C[C@H](O)CCCN1CCN(c2cncc3ccccc23)CC1	ZINC000450833604	CF	On-Demand	Anodyne	HTR2A	44	44
C[C@H](O)CCCN1CCN(c2cncc3ccccc23)CC1	ZINC000450833604	CF	On-Demand	Anodyne	DRD3	48	42
C[C@H](O)CCCN1CCN(c2cncc3ccccc23)CC1	ZINC000450833604	CF	On-Demand	Anodyne	HTR7	84	43
C[C@@H](O)CCCN1CCN(c2cncc3ccccc23)CC1	ZINC000450833605	CF	On-Demand	Anodyne	DRD2	58	42
C[C@@H](O)CCCN1CCN(c2cncc3ccccc23)CC1	ZINC000450833605	CF	On-Demand	Anodyne	HTR2A	44	44
C[C@@H](O)CCCN1CCN(c2cncc3ccccc23)CC1	ZINC000450833605	CF	On-Demand	Anodyne	DRD3	48	42
C[C@@H](O)CCCN1CCN(c2cncc3ccccc23)CC1	ZINC000450833605	CF	On-Demand	Anodyne	HTR7	84	43
CCc1nc(C)c(CSc2nnc(Cc3ccccc3OC)o2)o1	ZINC000450833606	EH	On-Demand	Anodyne	PTK2	0	49
CC(C)N1CCCC[C@H]1CN1CCC[C@]1(CO)Cc1ccccc1	ZINC000450833623	EG	On-Demand	Anodyne	SLC12A5	49	36
CC(C)N1CCCC[C@@H]1CN1CCC[C@]1(CO)Cc1ccccc1	ZINC000450833624	EG	On-Demand	Anodyne	SLC12A5	49	36
CC(C)N1CCCC[C@@H]1CN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000450833628	EG	On-Demand	Anodyne	SLC12A5	49	36
CC(C)N1CCCC[C@H]1CN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000450833631	EG	On-Demand	Anodyne	SLC12A5	49	36
COCc1cc(N[C@@H]2CCc3cc(F)c(F)c(F)c32)n2ncnc2n1	ZINC000450833647	EF	On-Demand	Anodyne	DHOD	0	41
CC1CCN(C(=O)c2ccc(N3CC(c4ccc(Cl)cc4)C3)nc2)CC1	ZINC000450833648	FI	On-Demand	Anodyne	FASN	32	43
CC1CCN(C(=O)c2ccc(N3CC(c4ccc(Cl)cc4)C3)nc2)CC1	ZINC000450833648	FI	On-Demand	Anodyne	L3MBTL3	42	33
CC1CCN(C(=O)c2ccc(N3CC(c4ccc(Cl)cc4)C3)nc2)CC1	ZINC000450833648	FI	On-Demand	Anodyne	NPBWR1	45	35
CC1CCN(C(=O)c2ccc(N3CC(c4ccc(Cl)cc4)C3)nc2)CC1	ZINC000450833648	FI	On-Demand	Anodyne	TRPC6	33	41
CC1CCN(C(=O)c2ccc(N3CC(c4ccc(Cl)cc4)C3)nc2)CC1	ZINC000450833648	FI	On-Demand	Anodyne	TRPC3	17	41
COCc1cc(N[C@H]2CCc3cc(F)c(F)c(F)c32)n2ncnc2n1	ZINC000450833650	EF	On-Demand	Anodyne	DHOD	0	41
OCCN(Cc1ccn(CCc2ccccc2)n1)C1CCC1	ZINC000450833652	CE	On-Demand	Anodyne	SLC18A2	42	40
CCn1nnc(C)c1COc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450833662	GH	On-Demand	Anodyne	SLC6A5	26	40
CCn1nnc(C)c1COc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450833662	GH	On-Demand	Anodyne	HCN1	55	38
CCn1nnc(C)c1COc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450833662	GH	On-Demand	Anodyne	HCN4	41	33
COc1ccc(CNC(=O)CCN2C[C@H](C)O[C@@H](C)[C@@H]2C)c(OC)c1	ZINC000450833674	FE	On-Demand	Anodyne	MTNR1A	47	36
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450833675	GD	On-Demand	Bother	TAAR1	18	41
COc1ccc(CNC(=O)CCN2C[C@H](C)O[C@H](C)[C@H]2C)c(OC)c1	ZINC000450833677	FE	On-Demand	Anodyne	MTNR1A	47	36
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450833678	GD	On-Demand	Bother	TAAR1	18	41
COc1ccc(CNC(=O)CCN2C[C@H](C)O[C@H](C)[C@@H]2C)c(OC)c1	ZINC000450833680	FE	On-Demand	Anodyne	MTNR1A	47	36
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450833681	GD	On-Demand	Bother	TAAR1	18	41
COc1ccc(CNC(=O)CCN2C[C@H](C)O[C@@H](C)[C@H]2C)c(OC)c1	ZINC000450833682	FE	On-Demand	Anodyne	MTNR1A	47	36
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450833683	GD	On-Demand	Bother	TAAR1	18	41
CCS(=O)(=O)c1ccc(CSc2nnc(-c3sccc3C)o2)cc1	ZINC000450833690	GI	On-Demand	Anodyne	GSK3A	48	37
CO[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1C	ZINC000450833788	CE	On-Demand	Anodyne	SIGMAR1	54	42
CO[C@@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1C	ZINC000450833789	CE	On-Demand	Anodyne	SIGMAR1	54	42
CO[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@@H]1C	ZINC000450833790	CE	On-Demand	Anodyne	SIGMAR1	54	42
CO[C@H]1CN(CCN(C)Cc2ccccc2)CC[C@H]1C	ZINC000450833791	CE	On-Demand	Anodyne	SIGMAR1	54	42
CN1[C@H]2CC[C@H]1CC(Nc1nccc(C(F)F)n1)C2	ZINC000450833797	CE	On-Demand	Anodyne	MAPK1	49	33
CN1[C@H]2CC[C@H]1CC(Nc1ncnc3ccc(I)cc13)C2	ZINC000450833831	GG	On-Demand	Anodyne	CD38	74	43
CCn1ccnc1[C@H](C)Nc1cc(C)nc2ncnn12	ZINC000450833856	CD	On-Demand	Anodyne	DHOD	0	48
CCn1ccnc1[C@@H](C)Nc1cc(C)nc2ncnn12	ZINC000450833857	CD	On-Demand	Anodyne	DHOD	0	48
C[C@@H](O)CCN1CCC(c2ccccc2Br)CC1	ZINC000450833858	DG	On-Demand	Anodyne	CCR5	48	42
C[C@H](O)CCN1CCC(c2ccccc2Br)CC1	ZINC000450833867	DG	On-Demand	Anodyne	CCR5	48	42
COc1cc(CN2CCc3ncsc3C2)ccc1Cl	ZINC000450833876	CG	On-Demand	Anodyne	ABCB1	0	41
O=C(NCCCNc1cccc(F)c1)[C@@H](O)C1CCC1	ZINC000450833877	CD	On-Demand	Anodyne	TBK1	28	48
O=C(NCCCNc1cccc(F)c1)[C@H](O)C1CCC1	ZINC000450833878	CD	On-Demand	Anodyne	TBK1	28	48
CN1[C@H]2CC[C@H]1CC(N=c1[nH]nc(Cc3ccc(Cl)cc3)s1)C2	ZINC000450833879	EG	On-Demand	Anodyne	SLC6A1	44	39
CCn1ccnc1[C@H](C)Nc1ncnc2c(C)csc12	ZINC000450833900	CG	On-Demand	Anodyne	LPAR2	23	46
CCn1ccnc1[C@@H](C)Nc1ncnc2c(C)csc12	ZINC000450833901	CG	On-Demand	Anodyne	LPAR2	23	46
NC(=O)c1ncc(Br)cc1NC[C@@H]1CCCC[C@H]1O	ZINC000450833921	ED	On-Demand	Anodyne	SYK	50	37
CCOC(=O)c1csc([C@@H]2CCCN2C[C@@H](Cc2ccccc2)OC)n1	ZINC000450833925	FH	On-Demand	Anodyne	TRY1_BOVIN	15	43
CCOC(=O)c1csc([C@H]2CCCN2C[C@H](Cc2ccccc2)OC)n1	ZINC000450833926	FH	On-Demand	Anodyne	TRY1_BOVIN	15	43
CCOC(=O)c1csc([C@H]2CCCN2C[C@@H](Cc2ccccc2)OC)n1	ZINC000450833927	FH	On-Demand	Anodyne	TRY1_BOVIN	15	43
CCOC(=O)c1csc([C@@H]2CCCN2C[C@H](Cc2ccccc2)OC)n1	ZINC000450833928	FH	On-Demand	Anodyne	TRY1_BOVIN	15	43
Cc1ccc(F)c(CC(=O)N(C)c2ccc(N3CCOCC3)nc2)c1	ZINC000450833933	EF	On-Demand	Anodyne	AKR1C3	0	42
Cc1ccc(F)c(CC(=O)N(C)c2ccc(N3CCOCC3)nc2)c1	ZINC000450833933	EF	On-Demand	Anodyne	DGAT1	39	41
COc1ccc(CNC(=O)CCN(C)C2(CO)CCOCC2)c(OC)c1	ZINC000450833967	FD	On-Demand	Anodyne	MTNR1A	43	40
CN(CCCC(=O)c1ccccc1)C1(CO)CCOCC1	ZINC000450833969	CE	On-Demand	Anodyne	CYP2J2	47	34
CN(c1ncnc2[nH]cnc12)[C@@H](CO)CC(C)(C)C	ZINC000450834027	CD	On-Demand	Anodyne	AHK3	0	40
CN(c1ncnc2[nH]cnc12)[C@H](CO)CC(C)(C)C	ZINC000450834028	CD	On-Demand	Anodyne	AHK3	0	40
C[C@@H](Cc1cnn(C)c1)Nc1ncnc2cc(Cl)ccc12	ZINC000450834031	DG	On-Demand	Anodyne	HNMT	45	31
C[C@H](Cc1cnn(C)c1)Nc1ncnc2cc(Cl)ccc12	ZINC000450834032	DG	On-Demand	Anodyne	HNMT	45	31
Cc1nc(N[C@@H]2CCc3cc(F)c(F)c(F)c32)ncc1[N+](=O)[O-]	ZINC000450834033	DG	On-Demand	Bother	PRKCQ	26	42
Cc1nc(N[C@H]2CCc3cc(F)c(F)c(F)c32)ncc1[N+](=O)[O-]	ZINC000450834034	DG	On-Demand	Bother	PRKCQ	26	42
CCCOc1cccc(COc2nc(C(C)C)no2)c1	ZINC000450834074	CH	On-Demand	Anodyne	DRTS_LEIMA	44	36
COC(=O)c1csc(CN2CCc3cc(Br)ccc3C2)n1	ZINC000450834075	FG	On-Demand	Anodyne	ABCB1	0	45
COC(=O)c1csc(CN2CCc3cc(Br)ccc3C2)n1	ZINC000450834075	FG	On-Demand	Anodyne	NOD2	41	38
CCc1cc(N[C@@H]2CCc3cc(F)c(F)c(F)c32)n2ncnc2n1	ZINC000450834094	EG	On-Demand	Anodyne	DHOD	0	44
CCc1cc(N[C@H]2CCc3cc(F)c(F)c(F)c32)n2ncnc2n1	ZINC000450834095	EG	On-Demand	Anodyne	DHOD	0	44
COCCC(=O)N1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450834105	DE	On-Demand	Anodyne	GPR183	0	40
COCCC(=O)N1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450834107	DE	On-Demand	Anodyne	GPR183	0	40
CCCOc1cccc(Cn2nc(C(C)(C)C)ccc2=O)c1	ZINC000450834108	DG	On-Demand	Anodyne	SQLE	41	32
COc1cccc2c(NCCC3(CO)CC3)ccnc12	ZINC000450834109	CF	On-Demand	Anodyne	ADRA1B	0	46
COC(=O)c1coc(CSc2nnc(-c3ccc(C)cc3C)o2)n1	ZINC000450834172	EG	On-Demand	Anodyne	ALOX15	50	33
CCNC(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nc1	ZINC000450834185	DG	On-Demand	Anodyne	CXCR3	27	41
COc1ccccc1Cc1nnc(SCc2ccn(CC(F)(F)F)n2)o1	ZINC000450834186	GH	On-Demand	Anodyne	PTK2	23	48
COc1cccc(CSCCC(C)(F)F)c1	ZINC000450834209	BH	On-Demand	Anodyne	CACNA2D1	0	52
CN1[C@H]2CC[C@H]1CC(Nc1cc(C(F)F)nc3ccc(Cl)cc13)C2	ZINC000450834224	FJ	On-Demand	Anodyne	SLC6A1	21	42
CCOC(=O)c1cnccc1N1CC(c2cccc(Cl)c2)C1	ZINC000450834249	DH	On-Demand	Anodyne	P2RY12	34	41
CCOC(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nc1	ZINC000450834261	DH	On-Demand	Anodyne	P2RY12	28	44
COc1ccc(C2(CNC(=O)[C@@]3(C)CC=CCC3)CCC2)cc1	ZINC000450834266	DH	On-Demand	Anodyne	KCNA3	42	35
COc1ccc(C2(CNC(=O)[C@@]3(C)CC=CCC3)CCC2)cc1	ZINC000450834266	DH	On-Demand	Anodyne	MTNR1A	18	43
COc1ccc(C2(CNC(=O)[C@]3(C)CC=CCC3)CCC2)cc1	ZINC000450834268	DH	On-Demand	Anodyne	KCNA3	42	35
COc1ccc(C2(CNC(=O)[C@]3(C)CC=CCC3)CCC2)cc1	ZINC000450834268	DH	On-Demand	Anodyne	MTNR1A	18	43
CO[C@@H](Cc1ccccc1)CN(CCO)C1CCC1	ZINC000450834269	CE	On-Demand	Anodyne	SLC18A2	53	35
CO[C@H](Cc1ccccc1)CN(CCO)C1CCC1	ZINC000450834271	CE	On-Demand	Anodyne	SLC18A2	53	35
Cc1ccc(NC(=O)c2ccc(NC3C[C@@H]4CC[C@H](C3)N4C)c([N+](=O)[O-])c2)cc1	ZINC000450834282	GI	On-Demand	Bother	TAAR1	23	43
CCS(=O)(=O)c1ccc(CN(CCO)C2CCC2)cc1	ZINC000450834298	CD	On-Demand	Anodyne	RORC	18	44
CC[C@H](O)CC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450834310	CE	On-Demand	Anodyne	MTNR1A	24	46
CC[C@H](O)CC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450834310	CE	On-Demand	Anodyne	ACAT	0	53
CC[C@@H](O)CC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450834311	CE	On-Demand	Anodyne	MTNR1A	24	46
CC[C@@H](O)CC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000450834311	CE	On-Demand	Anodyne	ACAT	0	53
COc1cnc(NC2C[C@@H]3CC[C@H](C2)N3C)nc1NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000450834313	GD	On-Demand	Anodyne	CCR4	15	42
COc1cnc(NC2C[C@@H]3CC[C@H](C2)N3C)nc1NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000450834313	GD	On-Demand	Anodyne	EHMT2	42	33
CC[C@@H]1CN(CC)CCN1c1ncnc2cc(F)c(F)cc12	ZINC000450834334	DF	On-Demand	Anodyne	HTT	0	47
CC[C@H]1CN(CC)CCN1c1ncnc2cc(F)c(F)cc12	ZINC000450834335	DF	On-Demand	Anodyne	HTT	0	47
COC(=O)COc1ccc(N(C)C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450834345	FG	On-Demand	Anodyne	GPR88	0	49
CC[C@@H]1CN(CC)CCN1c1nc2cc(F)ccc2o1	ZINC000450834357	CF	On-Demand	Anodyne	HTR3A	0	56
CC[C@H]1CN(CC)CCN1c1nc2cc(F)ccc2o1	ZINC000450834358	CF	On-Demand	Anodyne	HTR3A	0	56
CCN(Cc1ccc(S(=O)(=O)CC)cc1)Cc1c[nH]c2ccccc12	ZINC000450834381	FH	On-Demand	Anodyne	TACR1	15	43
CCN(Cc1ccc(S(=O)(=O)CC)cc1)Cc1c[nH]c2ccccc12	ZINC000450834381	FH	On-Demand	Anodyne	ALOX15	29	46
CCN(Cc1ccc(S(=O)(=O)CC)cc1)Cc1c[nH]c2ccccc12	ZINC000450834381	FH	On-Demand	Anodyne	RORC	25	45
C[C@H]1CCCN(c2cc(NC[C@@H]3CCCC[C@H]3O)ncn2)C1	ZINC000450834425	DF	On-Demand	Anodyne	PRCP	0	46
C[C@H](SCCCNc1ncccn1)C(=O)Nc1nccs1	ZINC000450834434	DE	On-Demand	Anodyne	MAP	0	44
C[C@H](SCCCNc1ncccn1)C(=O)Nc1nccs1	ZINC000450834434	DE	On-Demand	Anodyne	MAP1	132	43
C[C@@H](SCCCNc1ncccn1)C(=O)Nc1nccs1	ZINC000450834435	DE	On-Demand	Anodyne	MAP	0	44
C[C@@H](SCCCNc1ncccn1)C(=O)Nc1nccs1	ZINC000450834435	DE	On-Demand	Anodyne	MAP1	132	43
COc1ccccc1-c1csc(C2CCN(CC[C@H](C)O)CC2)n1	ZINC000450834436	EH	On-Demand	Anodyne	HTR1A	26	41
COc1ccccc1-c1csc(C2CCN(CC[C@H](C)O)CC2)n1	ZINC000450834436	EH	On-Demand	Anodyne	CARM1	56	38
COc1ccccc1-c1csc(C2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450834437	EH	On-Demand	Anodyne	HTR1A	26	41
COc1ccccc1-c1csc(C2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450834437	EH	On-Demand	Anodyne	CARM1	56	38
CCc1cccc(C(=O)N(C)c2ccc(N3CCOCC3)nc2)n1	ZINC000450834446	EE	On-Demand	Anodyne	PIK3CB	45	33
CCc1cccc(C(=O)N(C)c2ccc(N3CCOCC3)nc2)n1	ZINC000450834446	EE	On-Demand	Anodyne	DGAT1	37	43
CCNC(=O)c1ccc(N2CC(c3ccc(Cl)cc3)C2)nn1	ZINC000450834477	DE	On-Demand	Anodyne	SCD1	44	45
COc1ccc(OCc2cn(C)nc2C)c(C(N)=O)c1	ZINC000450834497	CD	On-Demand	Anodyne	GSG2	46	34
COC1CCC(CCNC(=O)Cc2cc3ccccc3s2)CC1	ZINC000450834548	EI	On-Demand	Anodyne	AROQ	27	40
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)c1ccc(N2CCOCC2)nc1	ZINC000450834562	GH	On-Demand	Anodyne	DGAT1	27	41
COC(=O)c1ccc(CN2CCc3nn[nH]c3C2)cc1Cl	ZINC000450834614	DD	On-Demand	Anodyne	ABCG2	18	40
CC[C@H](c1ccccc1)c1nnc(SCc2ccc(C(C)=O)cc2)o1	ZINC000450834615	FK	On-Demand	Anodyne	GSK3A	32	44
CC[C@@H](c1ccccc1)c1nnc(SCc2ccc(C(C)=O)cc2)o1	ZINC000450834616	FK	On-Demand	Anodyne	GSK3A	32	44
COC(=O)c1csc(CN2CCC[C@]2(CO)Cc2ccccc2)n1	ZINC000450834629	EE	On-Demand	Anodyne	SLC12A5	56	37
COC(=O)c1csc(CN2CCC[C@@]2(CO)Cc2ccccc2)n1	ZINC000450834631	EE	On-Demand	Anodyne	SLC12A5	56	37
CC(C)c1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)o2)cc1	ZINC000450834645	FI	On-Demand	Anodyne	GSK3A	42	35
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCC[C@@H](C)O)cc1	ZINC000450834651	FH	On-Demand	Anodyne	CCR2	0	45
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCC[C@@H](C)O)cc1	ZINC000450834651	FH	On-Demand	Anodyne	PTGDR2	39	41
CO[C@H](CSc1nnc(Cc2cccc(F)c2)o1)Cc1ccccc1	ZINC000450834658	FI	On-Demand	Anodyne	PTK2	0	45
CO[C@@H](CSc1nnc(Cc2cccc(F)c2)o1)Cc1ccccc1	ZINC000450834659	FI	On-Demand	Anodyne	PTK2	0	45
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCC[C@H](C)O)cc1	ZINC000450834663	FH	On-Demand	Anodyne	CCR2	0	45
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCC[C@H](C)O)cc1	ZINC000450834663	FH	On-Demand	Anodyne	PTGDR2	39	41
COc1cc(OC)c2ncnc(N3CC[S@](=O)C(C)(C)CC3)c2c1	ZINC000450834676	EE	On-Demand	Anodyne	PDE3B	56	33
COc1cc(OC)c2ncnc(N3CC[S@@](=O)C(C)(C)CC3)c2c1	ZINC000450834677	EE	On-Demand	Anodyne	PDE3B	56	33
Fc1cccc(OC[C@H]2CCCC2(F)F)c1F	ZINC000450834697	BH	On-Demand	Anodyne	CHRNA10	15	53
Fc1cccc(OC[C@@H]2CCCC2(F)F)c1F	ZINC000450834698	BH	On-Demand	Anodyne	CHRNA10	15	53
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450834703	FH	On-Demand	Anodyne	KCNA3	34	44
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450834703	FH	On-Demand	Anodyne	ABCB1	20	42
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450834703	FH	On-Demand	Anodyne	CRTM	40	37
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450834703	FH	On-Demand	Anodyne	HCN1	43	34
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@@H]1CCOC1	ZINC000450834703	FH	On-Demand	Anodyne	HCN4	40	31
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450834706	FH	On-Demand	Anodyne	KCNA3	34	44
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450834706	FH	On-Demand	Anodyne	ABCB1	20	42
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450834706	FH	On-Demand	Anodyne	CRTM	40	37
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450834706	FH	On-Demand	Anodyne	HCN1	43	34
O=C(NCCCc1ccccc1)c1ccccc1OCC[C@H]1CCOC1	ZINC000450834706	FH	On-Demand	Anodyne	HCN4	40	31
COC(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)[C@H]1C	ZINC000450834716	CE	On-Demand	Anodyne	SLC6A1	27	42
COC(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)[C@H]1C	ZINC000450834716	CE	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)[C@H]1C	ZINC000450834717	CE	On-Demand	Anodyne	SLC6A1	27	42
COC(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)[C@H]1C	ZINC000450834717	CE	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)[C@@H]1C	ZINC000450834718	CE	On-Demand	Anodyne	SLC6A1	27	42
COC(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)[C@@H]1C	ZINC000450834718	CE	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)[C@@H]1C	ZINC000450834719	CE	On-Demand	Anodyne	SLC6A1	27	42
COC(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)[C@@H]1C	ZINC000450834719	CE	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)c1ncn(Cc2cccc3c2OC(C)(C)C3)n1	ZINC000450834720	CD	On-Demand	Anodyne	CCR8	17	45
CCS(=O)(=O)c1ccc(COc2ccc3c(c2)CCCC3=O)cc1	ZINC000450834816	EH	On-Demand	Anodyne	MAOB	45	70
COC(=O)c1cnc(N2CCCC[C@H]2c2ccc(Cl)cc2)nc1	ZINC000450834832	EH	On-Demand	Anodyne	SLC6A1	46	37
COC(=O)c1cnc(N2CCCC[C@@H]2c2ccc(Cl)cc2)nc1	ZINC000450834833	EH	On-Demand	Anodyne	SLC6A1	46	37
CCS(=O)(=O)c1ccc(Cn2cnc3c(N(C)C)ncnc32)cc1	ZINC000450834853	ED	On-Demand	Anodyne	SLC29A1	45	42
COC(=O)c1coc(CN2CCN(c3cncc4ccccc34)CC2)n1	ZINC000450834882	FE	On-Demand	Anodyne	HTR1A	43	39
COC(=O)c1coc(CN2CCN(c3cncc4ccccc34)CC2)n1	ZINC000450834882	FE	On-Demand	Anodyne	DRD3	48	39
COC(=O)c1coc(CN2CCN(c3cncc4ccccc34)CC2)n1	ZINC000450834882	FE	On-Demand	Anodyne	HTR7	40	38
CCN1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1=O	ZINC000450834891	FF	On-Demand	Anodyne	THRA	0	40
CCN1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1=O	ZINC000450834891	FF	On-Demand	Anodyne	CYP2J2	53	38
C[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H](CO)O1	ZINC000450834895	CD	On-Demand	Anodyne	SIGMAR1	19	40
C[C@H]1CN(CCN(C)Cc2ccccc2)C[C@H](CO)O1	ZINC000450834896	CD	On-Demand	Anodyne	SIGMAR1	19	40
C[C@H]1CN(CCN(C)Cc2ccccc2)C[C@@H](CO)O1	ZINC000450834897	CD	On-Demand	Anodyne	SIGMAR1	19	40
C[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@@H](CO)O1	ZINC000450834898	CD	On-Demand	Anodyne	SIGMAR1	19	40
CO[C@H](CSc1nnc(Cc2ccccc2F)o1)Cc1ccccc1	ZINC000450834917	FI	On-Demand	Anodyne	PTK2	22	41
CO[C@@H](CSc1nnc(Cc2ccccc2F)o1)Cc1ccccc1	ZINC000450834918	FI	On-Demand	Anodyne	PTK2	22	41
CC(=O)[C@@](C)(O)CN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000450834931	GD	On-Demand	Anodyne	PTGDR2	19	44
CC(=O)[C@](C)(O)CN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000450834932	GD	On-Demand	Anodyne	PTGDR2	19	44
OC[C@H]1CCCN(c2cc(NC[C@@H]3CCCC[C@H]3O)ncn2)C1	ZINC000450834944	DD	On-Demand	Anodyne	PRCP	0	43
COc1cc([N+](=O)[O-])ccc1OCC1CC(F)(F)C1	ZINC000450835018	CG	On-Demand	Bother	CYP19A1	15	44
COCCOC[C@H](O)CN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000450835027	DD	On-Demand	Anodyne	SLC12A5	48	36
O=C(NC[C@@H]1CC12CCOCC2)[C@@H]1CCN(c2ccccc2)C1	ZINC000450835035	DE	On-Demand	Anodyne	SCN9A	39	40
O=C(NC[C@@H]1CC12CCOCC2)[C@H]1CCN(c2ccccc2)C1	ZINC000450835036	DE	On-Demand	Anodyne	SCN9A	39	40
O=C(NC[C@H]1CC12CCOCC2)[C@@H]1CCN(c2ccccc2)C1	ZINC000450835037	DE	On-Demand	Anodyne	SCN9A	39	40
O=C(NC[C@H]1CC12CCOCC2)[C@H]1CCN(c2ccccc2)C1	ZINC000450835038	DE	On-Demand	Anodyne	SCN9A	39	40
COCCOC[C@H](O)CN1CCC[C@]1(CO)Cc1ccccc1	ZINC000450835049	DD	On-Demand	Anodyne	SLC12A5	48	36
COCCOC[C@@H](O)CN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000450835051	DD	On-Demand	Anodyne	SLC12A5	48	36
COCCOC[C@@H](O)CN1CCC[C@]1(CO)Cc1ccccc1	ZINC000450835053	DD	On-Demand	Anodyne	SLC12A5	48	36
COCCC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450835061	GC	On-Demand	Anodyne	HTR1A	28	41
COCCC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450835061	GC	On-Demand	Anodyne	DRD2	28	41
COCCC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450835061	GC	On-Demand	Anodyne	DRD4	46	35
COCCC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450835061	GC	On-Demand	Anodyne	DRD3	46	38
COCCC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450835061	GC	On-Demand	Anodyne	HTR7	36	45
COCCC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450835061	GC	On-Demand	Anodyne	MTNR1A	54	37
COCCC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450835061	GC	On-Demand	Anodyne	MTNR1B	44	38
COCCC(=O)N1CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450835061	GC	On-Demand	Anodyne	SLC9A1	57	33
CC(=O)c1ccc(CN2CCc3cc(C)ccc3C2)cc1	ZINC000450835062	CH	On-Demand	Anodyne	DRD4	24	43
CC(=O)c1ccc(CN2CCc3cc(C)ccc3C2)cc1	ZINC000450835062	CH	On-Demand	Anodyne	NOD1	37	47
CC(=O)c1ccc(CN2CCc3cc(C)ccc3C2)cc1	ZINC000450835062	CH	On-Demand	Anodyne	NOD2	56	47
COc1cccc2c(NCCC3(CO)CC3)c(C)cnc12	ZINC000450835096	CG	On-Demand	Anodyne	ATP4A	23	45
CCN1CN(CCN(C)Cc2ccccc2)CC1=O	ZINC000450835130	CD	On-Demand	Anodyne	SIGMAR1	19	44
CCOC(=O)COc1ccc(NC(=O)CNS(=O)(=O)NC)cc1	ZINC000450835137	EB	On-Demand	Anodyne	CA2	19	43
CCOC(=O)COc1ccc(NC(=O)CNS(=O)(=O)NC)cc1	ZINC000450835137	EB	On-Demand	Anodyne	CA12	21	43
CCOC(=O)COc1ccc(NC(=O)CNS(=O)(=O)NC)cc1	ZINC000450835137	EB	On-Demand	Anodyne	CA9	21	43
CCOC(=O)COc1ccc(NC(=O)CNS(=O)(=O)NC)cc1	ZINC000450835137	EB	On-Demand	Anodyne	NCE103	18	43
Cc1nc2c(n1[C@@H]1CCN(C(=O)[C@H](C)OCCc3ccccc3)C1)CCCC2	ZINC000450835175	GG	On-Demand	Anodyne	CCR5	35	40
Cc1nc2c(n1[C@H]1CCN(C(=O)[C@H](C)OCCc3ccccc3)C1)CCCC2	ZINC000450835177	GG	On-Demand	Anodyne	CCR5	35	40
Cc1nc2c(n1[C@H]1CCN(C(=O)[C@@H](C)OCCc3ccccc3)C1)CCCC2	ZINC000450835178	GG	On-Demand	Anodyne	CCR5	35	40
Cc1nc2c(n1[C@@H]1CCN(C(=O)[C@@H](C)OCCc3ccccc3)C1)CCCC2	ZINC000450835179	GG	On-Demand	Anodyne	CCR5	35	40
CN(c1cnn(Cc2ccccc2)c(=O)c1Cl)[C@H](CO)CC(C)(C)C	ZINC000450835184	FG	On-Demand	Anodyne	NPBWR1	42	42
CN(c1cnn(Cc2ccccc2)c(=O)c1Cl)[C@@H](CO)CC(C)(C)C	ZINC000450835185	FG	On-Demand	Anodyne	NPBWR1	42	42
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	HTR1A	50	49
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	THRA	0	43
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	DRD2	47	45
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	DRD1	30	44
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	DRD4	42	33
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	HTR2A	30	46
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	HTR2C	24	47
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	SLC6A1	45	34
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	DRD3	51	44
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	THRB	0	43
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	HTR7	70	56
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	SIGMAR1	28	46
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	SLC18A3	24	42
COCCC(=O)N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450835198	DD	On-Demand	Anodyne	CYP2J2	63	45
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@@H](C)C2)cc1	ZINC000450835280	EE	On-Demand	Anodyne	MMP13	23	41
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)OC)[C@H](C)C2)cc1	ZINC000450835281	EE	On-Demand	Anodyne	MMP13	23	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@H](C)C2)cc1	ZINC000450835282	EE	On-Demand	Anodyne	MMP13	23	41
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)OC)[C@@H](C)C2)cc1	ZINC000450835283	EE	On-Demand	Anodyne	MMP13	23	41
CCOC(=O)c1ccc(CN2CCc3cc(Cl)ccc3C2)nc1	ZINC000450835284	EG	On-Demand	Anodyne	P2RY12	31	42
CCOC(=O)c1ccc(CN2CCc3cc(Cl)ccc3C2)nc1	ZINC000450835284	EG	On-Demand	Anodyne	NOD1	31	48
CCOC(=O)c1ccc(CN2CCc3cc(Cl)ccc3C2)nc1	ZINC000450835284	EG	On-Demand	Anodyne	NOD2	47	48
CC[C@H]1CN(CC)CCN1c1ncnc2ccc(C)cc12	ZINC000450835293	CF	On-Demand	Anodyne	HTT	0	51
CC[C@@H]1CN(CC)CCN1c1ncnc2ccc(C)cc12	ZINC000450835295	CF	On-Demand	Anodyne	HTT	0	51
CCc1cc(CCCn2c(-c3cccnc3)noc2=O)on1	ZINC000450835346	DE	On-Demand	Anodyne	CYP2A6	24	42
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450835367	FJ	On-Demand	Anodyne	HTR1A	61	39
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450835367	FJ	On-Demand	Anodyne	DRD2	48	41
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450835367	FJ	On-Demand	Anodyne	DRD3	48	37
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450835367	FJ	On-Demand	Anodyne	ILES	15	42
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450835367	FJ	On-Demand	Anodyne	HTR7	53	39
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450835367	FJ	On-Demand	Anodyne	IARS	0	42
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450835367	FJ	On-Demand	Anodyne	CTPA	0	40
OCC1(CCNc2ccnc3cc(F)c(Br)cc23)CC1	ZINC000450835372	EH	On-Demand	Anodyne	HRP1_PLAFA	96	35
OCC1(CCNc2ccnc3cc(F)c(Br)cc23)CC1	ZINC000450835372	EH	On-Demand	Anodyne	HNMT	52	37
Cc1cc(N(C)[C@@H](CO)CC(C)(C)C)n2ncnc2n1	ZINC000450835410	CD	On-Demand	Anodyne	DHOD	0	45
Cc1cc(N(C)[C@H](CO)CC(C)(C)C)n2ncnc2n1	ZINC000450835411	CD	On-Demand	Anodyne	DHOD	0	45
Cn1cnc2c(c1=O)CCN(CCCCc1ccc(Cl)c(Cl)c1)C2	ZINC000450835412	FG	On-Demand	Anodyne	SIGMAR1	24	48
Cn1cnc2c(c1=O)CCN(CCCCc1ccc(Cl)c(Cl)c1)C2	ZINC000450835412	FG	On-Demand	Anodyne	DNAE	58	34
CC[C@@H]1CN(CC)CCN1c1ncnc2c(F)cccc12	ZINC000450835429	CF	On-Demand	Anodyne	ABCC1	47	34
CCC(C)(C)OCc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450835430	FK	On-Demand	Anodyne	GPR88	0	40
CC[C@H]1CN(CC)CCN1c1ncnc2c(F)cccc12	ZINC000450835431	CF	On-Demand	Anodyne	ABCC1	47	34
O=C(NCC1(CO)CCC1)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450835474	ED	On-Demand	Bother	NMBR	54	33
CCN(CC)S(=O)(=O)c1ccc(NC[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450835484	GF	On-Demand	Bother	BDKRB1	24	45
CC[C@@H](O)CC(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450835503	DD	On-Demand	Anodyne	KCNQ2	61	34
CC[C@H](O)CC(=O)Nc1cccc2c1CCN2C(=O)COC	ZINC000450835504	DD	On-Demand	Anodyne	KCNQ2	61	34
C[C@@H](Sc1nc(O)cc(C(F)(F)F)n1)C(=O)Nc1nccs1	ZINC000450835524	FF	On-Demand	Anodyne	MAP1	67	35
C[C@H](Sc1nc(O)cc(C(F)(F)F)n1)C(=O)Nc1nccs1	ZINC000450835525	FF	On-Demand	Anodyne	MAP1	67	35
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450835533	GE	On-Demand	Bother	BDKRB1	0	46
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450835534	GE	On-Demand	Bother	BDKRB1	0	46
O=C(NCCCc1ccccc1)c1ccccc1OCc1nnc(C2CC2)s1	ZINC000450835551	GI	On-Demand	Anodyne	KCNA3	40	45
O=C(NCCCc1ccccc1)c1ccccc1OCc1nnc(C2CC2)s1	ZINC000450835551	GI	On-Demand	Anodyne	SLC6A5	26	40
O=C(NCCCc1ccccc1)c1ccccc1OCc1nnc(C2CC2)s1	ZINC000450835551	GI	On-Demand	Anodyne	HCN1	52	38
Cc1nnc2c3ccccc3c(N(C)[C@@H](CO)CC(C)(C)C)nn12	ZINC000450835619	EF	On-Demand	Anodyne	CECR2	0	42
Cc1nnc2c3ccccc3c(N(C)[C@H](CO)CC(C)(C)C)nn12	ZINC000450835620	EF	On-Demand	Anodyne	CECR2	0	42
Fc1cc2c(c(F)c1F)[C@H](Nc1cc(C(F)(F)F)nc3ncnn13)CC2	ZINC000450835625	FH	On-Demand	Anodyne	DHOD	0	47
Fc1cc2c(c(F)c1F)[C@@H](Nc1cc(C(F)(F)F)nc3ncnn13)CC2	ZINC000450835627	FH	On-Demand	Anodyne	DHOD	0	47
CCC(=O)CCCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000450835638	GI	On-Demand	Anodyne	COLA	64	43
CCC(=O)CCCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000450835638	GI	On-Demand	Anodyne	CPT1A	59	43
CCC(=O)CCCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000450835638	GI	On-Demand	Anodyne	GRM5	0	42
CCC(=O)CCCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000450835640	GI	On-Demand	Anodyne	COLA	64	43
CCC(=O)CCCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000450835640	GI	On-Demand	Anodyne	CPT1A	59	43
CCC(=O)CCCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000450835640	GI	On-Demand	Anodyne	GRM5	0	42
C[C@@H](O)CCCNC(C)(C)Cc1ccc(C(F)(F)F)cc1	ZINC000450835647	DH	On-Demand	Anodyne	ADRB2	0	42
C[C@@H](O)CCCNC(C)(C)Cc1ccc(C(F)(F)F)cc1	ZINC000450835647	DH	On-Demand	Anodyne	ADRB1	0	42
C[C@H](O)CCCNC(C)(C)Cc1ccc(C(F)(F)F)cc1	ZINC000450835648	DH	On-Demand	Anodyne	ADRB2	0	42
C[C@H](O)CCCNC(C)(C)Cc1ccc(C(F)(F)F)cc1	ZINC000450835648	DH	On-Demand	Anodyne	ADRB1	0	42
C[C@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450835655	ED	On-Demand	Anodyne	GCK	51	38
C[C@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450835655	ED	On-Demand	Anodyne	GCKR	43	31
C[C@@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450835656	ED	On-Demand	Anodyne	GCK	51	38
C[C@@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450835656	ED	On-Demand	Anodyne	GCKR	43	31
CCn1ccnc1[C@@H](C)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450835683	EF	On-Demand	Anodyne	DHOD	0	51
CCn1ccnc1[C@H](C)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450835684	EF	On-Demand	Anodyne	DHOD	0	51
CC[C@@H]1CN(CC)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450835685	CD	On-Demand	Anodyne	P2RY12	27	48
CC[C@@H]1CN(CC)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450835685	CD	On-Demand	Anodyne	CXCR3	36	46
CC[C@H]1CN(CC)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450835686	CD	On-Demand	Anodyne	P2RY12	27	48
CC[C@H]1CN(CC)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450835686	CD	On-Demand	Anodyne	CXCR3	36	46
CCOC(=O)c1ccc(CN(CC)Cc2c[nH]c3ccccc23)nc1	ZINC000450835687	EH	On-Demand	Anodyne	TACR1	30	40
CCOC(=O)c1ccc(CN(CC)Cc2c[nH]c3ccccc23)nc1	ZINC000450835687	EH	On-Demand	Anodyne	MC5R	41	30
CCOC(=O)c1ccc(CN(CC)Cc2c[nH]c3ccccc23)nc1	ZINC000450835687	EH	On-Demand	Anodyne	GRPR	48	35
CCOC(=O)c1ccc(CN(CC)Cc2c[nH]c3ccccc23)nc1	ZINC000450835687	EH	On-Demand	Anodyne	GHSR	43	35
CCOC(=O)c1ccc(CN(CC)Cc2c[nH]c3ccccc23)nc1	ZINC000450835687	EH	On-Demand	Anodyne	TDP1	0	41
CCn1ccnc1[C@@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450835701	FE	On-Demand	Bother	COLA	51	32
CCn1ccnc1[C@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450835702	FE	On-Demand	Bother	COLA	51	32
CC(=O)c1ccc(COc2ccc3c(c2)CCCC3=O)cc1	ZINC000450835705	CH	On-Demand	Anodyne	MAOA	24	70
CC(=O)c1ccc(COc2ccc3c(c2)CCCC3=O)cc1	ZINC000450835705	CH	On-Demand	Anodyne	MAOB	23	41
COc1cc(CC(=O)N2CCOC[C@H]2c2nnc(C(C)C)o2)ccc1Cl	ZINC000450835737	GF	On-Demand	Anodyne	OPRK1	38	40
COc1cc(CC(=O)N2CCOC[C@@H]2c2nnc(C(C)C)o2)ccc1Cl	ZINC000450835738	GF	On-Demand	Anodyne	OPRK1	38	40
C[C@@H](SCCCc1ccccc1)C(=O)Nc1nccs1	ZINC000450835742	DH	On-Demand	Anodyne	ADAM17	0	40
C[C@@H](SCCCc1ccccc1)C(=O)Nc1nccs1	ZINC000450835742	DH	On-Demand	Anodyne	MAP1	139	52
C[C@@H](SCCCc1ccccc1)C(=O)Nc1nccs1	ZINC000450835742	DH	On-Demand	Anodyne	MMP3	27	40
C[C@H](SCCCc1ccccc1)C(=O)Nc1nccs1	ZINC000450835743	DH	On-Demand	Anodyne	ADAM17	0	40
C[C@H](SCCCc1ccccc1)C(=O)Nc1nccs1	ZINC000450835743	DH	On-Demand	Anodyne	MAP1	139	52
C[C@H](SCCCc1ccccc1)C(=O)Nc1nccs1	ZINC000450835743	DH	On-Demand	Anodyne	MMP3	27	40
c1ccc(CCCSCC[C@@H]2CCOC2)cc1	ZINC000450835792	CH	On-Demand	Anodyne	SLC18A2	32	40
c1ccc(CCCSCC[C@H]2CCOC2)cc1	ZINC000450835793	CH	On-Demand	Anodyne	SLC18A2	32	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC[C@@H]1CCCC[C@H]1O	ZINC000450835796	GF	On-Demand	Bother	EPHX2	16	43
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC[C@@H]1CCCC[C@H]1O	ZINC000450835796	GF	On-Demand	Bother	DDIT3	0	42
COC(=O)c1cc(OC[C@H](Cc2ccccc2)OC)ccc1[N+](=O)[O-]	ZINC000450835814	EG	On-Demand	Bother	PDS	74	44
COC(=O)c1cc(OC[C@@H](Cc2ccccc2)OC)ccc1[N+](=O)[O-]	ZINC000450835815	EG	On-Demand	Bother	PDS	74	44
COC(=O)C1(CNC(C)(C)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000450835834	EG	On-Demand	Anodyne	EPHX2	40	38
COC(=O)c1ccc(CN2CCc3c(ncn(C)c3=O)C2)cc1Cl	ZINC000450835839	ED	On-Demand	Anodyne	ABCG2	26	40
COC(=O)c1ccc(CN2CCc3c(ncn(C)c3=O)C2)cc1Cl	ZINC000450835839	ED	On-Demand	Anodyne	NOD2	40	34
CCOC(=O)c1ccc(CN2CCc3cc(C)ccc3C2)nc1	ZINC000450835866	DG	On-Demand	Anodyne	NOD1	29	48
CCOC(=O)c1ccc(CN2CCc3cc(C)ccc3C2)nc1	ZINC000450835866	DG	On-Demand	Anodyne	NOD2	46	48
COCCC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450835878	GF	On-Demand	Anodyne	THRA	0	41
COCCC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450835878	GF	On-Demand	Anodyne	DRD1	20	41
COCCC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450835878	GF	On-Demand	Anodyne	DRD4	17	41
COCCC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450835878	GF	On-Demand	Anodyne	HTR2A	15	41
COCCC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450835878	GF	On-Demand	Anodyne	DRD3	26	41
COCCC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450835878	GF	On-Demand	Anodyne	THRB	0	41
COCCC(=O)N1CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450835878	GF	On-Demand	Anodyne	CYP2J2	54	39
CCS(=O)(=O)c1ccc(CSc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000450835910	FG	On-Demand	Anodyne	PTGS2	16	40
CCCOc1cccc(CSc2ccc(S(C)(=O)=O)cc2)c1	ZINC000450835925	EI	On-Demand	Anodyne	UPP1	15	40
CN1CCN(S(=O)(=O)c2ccc(N(C)[C@H](CO)CC(C)(C)C)nc2)CC1	ZINC000450835950	GD	On-Demand	Anodyne	GCK	57	32
CN1CCN(S(=O)(=O)c2ccc(N(C)[C@H](CO)CC(C)(C)C)nc2)CC1	ZINC000450835950	GD	On-Demand	Anodyne	GCKR	69	32
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450835962	GG	On-Demand	Anodyne	SLC6A1	134	37
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450835963	GG	On-Demand	Anodyne	SLC6A1	134	37
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450835964	GG	On-Demand	Anodyne	SLC6A1	134	37
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450835965	GG	On-Demand	Anodyne	SLC6A1	134	37
CN1CCN(S(=O)(=O)c2ccc(N(C)[C@@H](CO)CC(C)(C)C)nc2)CC1	ZINC000450835966	GD	On-Demand	Anodyne	GCK	57	32
CN1CCN(S(=O)(=O)c2ccc(N(C)[C@@H](CO)CC(C)(C)C)nc2)CC1	ZINC000450835966	GD	On-Demand	Anodyne	GCKR	69	32
COc1cc([N+](=O)[O-])ccc1OCC(=O)CC(C)(C)C1CC1	ZINC000450835980	DG	On-Demand	Bother	SLC27A4	48	31
COc1cc([N+](=O)[O-])ccc1OCC(=O)CC(C)(C)C1CC1	ZINC000450835980	DG	On-Demand	Bother	ABHD6	0	43
CCC(=O)CCCN1CCc2cc(C)ccc2C1	ZINC000450836008	BG	On-Demand	Anodyne	CHRNA6	0	47
C[C@H](O)CN(C[C@H](O)[C@H](C)c1ccccc1)[C@@H](C)CO	ZINC000450836028	CD	On-Demand	Anodyne	AOC3	20	40
C[C@H](O)CN(C[C@H](O)[C@H](C)c1ccccc1)[C@H](C)CO	ZINC000450836029	CD	On-Demand	Anodyne	AOC3	20	40
C[C@H](O)CN(C[C@H](O)[C@@H](C)c1ccccc1)[C@H](C)CO	ZINC000450836030	CD	On-Demand	Anodyne	AOC3	20	40
C[C@H](O)CN(C[C@H](O)[C@@H](C)c1ccccc1)[C@@H](C)CO	ZINC000450836031	CD	On-Demand	Anodyne	AOC3	20	40
COC1CCC(CCNC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450836034	FG	On-Demand	Anodyne	CACNA1I	21	41
CCc1nc(C2CCN(CCc3ccc(Cl)cc3)CC2)n[nH]1	ZINC000450836058	DG	On-Demand	Anodyne	DRD4	18	52
CCc1nc(C2CCN(CCc3ccc(Cl)cc3)CC2)n[nH]1	ZINC000450836058	DG	On-Demand	Anodyne	SIGMAR1	21	44
CCc1nc(C2CCN(CCc3ccc(Cl)cc3)CC2)n[nH]1	ZINC000450836058	DG	On-Demand	Anodyne	AKT2	47	35
CCC[C@@H](O)CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450836098	CD	On-Demand	Anodyne	DRD4	17	45
CCC[C@@H](O)CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450836098	CD	On-Demand	Anodyne	ABCB1	42	40
CCC[C@H](O)CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450836099	CD	On-Demand	Anodyne	DRD4	17	45
CCC[C@H](O)CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450836099	CD	On-Demand	Anodyne	ABCB1	42	40
CCC[C@H](O)CN1CCO[C@H](COc2ccccc2)C1	ZINC000450836100	CD	On-Demand	Anodyne	DRD4	17	45
CCC[C@H](O)CN1CCO[C@H](COc2ccccc2)C1	ZINC000450836100	CD	On-Demand	Anodyne	ABCB1	42	40
CCC[C@@H](O)CN1CCO[C@H](COc2ccccc2)C1	ZINC000450836101	CD	On-Demand	Anodyne	DRD4	17	45
CCC[C@@H](O)CN1CCO[C@H](COc2ccccc2)C1	ZINC000450836101	CD	On-Demand	Anodyne	ABCB1	42	40
C/C=C\COc1cccc(CC(=O)N(C)c2ccc(N3CCOCC3)nc2)c1	ZINC000450836113	GG	On-Demand	Anodyne	DGAT1	26	41
CCC(C)(C)OCc1ccccc1NC(=O)c1cnn2ccc(C)cc12	ZINC000450836115	FJ	On-Demand	Anodyne	PIM1	56	34
CCC(C)(C)OCc1ccccc1NC(=O)c1cnn2ccc(C)cc12	ZINC000450836115	FJ	On-Demand	Anodyne	EPHB3	47	61
CCC(C)(C)OCc1ccccc1NC(=O)c1cnn2ccc(C)cc12	ZINC000450836115	FJ	On-Demand	Anodyne	PIM3	54	32
CCN(CC)CCOCCNC(=O)c1cccc(SC)c1	ZINC000450836131	DE	On-Demand	Anodyne	DRD4	40	30
COCCOC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836136	EC	On-Demand	Anodyne	DRD4	44	34
COCCOC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836136	EC	On-Demand	Anodyne	DRD3	22	41
COCCOC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836136	EC	On-Demand	Anodyne	CYP2D6	0	40
COCCOC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836136	EC	On-Demand	Anodyne	ABCB1	53	44
COCCOC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836136	EC	On-Demand	Anodyne	HSP90AB1	50	55
COCCOC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836137	EC	On-Demand	Anodyne	DRD4	44	34
COCCOC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836137	EC	On-Demand	Anodyne	DRD3	22	41
COCCOC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836137	EC	On-Demand	Anodyne	CYP2D6	0	40
COCCOC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836137	EC	On-Demand	Anodyne	ABCB1	53	44
COCCOC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450836137	EC	On-Demand	Anodyne	HSP90AB1	50	55
CNC(=O)c1ccc(N[C@@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450836141	DD	On-Demand	Bother	TAAR1	15	40
CNC(=O)c1ccc(N[C@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450836143	DD	On-Demand	Bother	TAAR1	15	40
C[C@H](Cc1cnn(C)c1)Nc1ncc([N+](=O)[O-])s1	ZINC000450836150	CD	On-Demand	Bother	MAPK8	15	44
C[C@@H](Cc1cnn(C)c1)Nc1ncc([N+](=O)[O-])s1	ZINC000450836153	CD	On-Demand	Bother	MAPK8	15	44
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450836166	FI	On-Demand	Anodyne	ADRB3	40	36
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450836166	FI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCCc1cc(C(=O)Nc2cccc(C(F)F)c2Cl)no1	ZINC000450836169	DI	On-Demand	Anodyne	ACAT	0	45
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450836171	FI	On-Demand	Anodyne	ADRB3	40	36
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)cs2)CC1	ZINC000450836171	FI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
Cc1cccc(Cl)c1C(=O)N1CCC(C)(CN2CCN(C)CC2)CC1	ZINC000450836193	FG	On-Demand	Anodyne	CCR5	34	44
CC(=O)c1ccc(CN2CC3(CCOCC3)c3ccccc32)cc1	ZINC000450836200	DH	On-Demand	Anodyne	SLC18A3	0	40
CCc1nc(C2CCN(CCN(C)Cc3ccccc3)CC2)n[nH]1	ZINC000450836210	EF	On-Demand	Anodyne	SIGMAR1	30	41
CCc1nc(C2CCN(CCN(C)Cc3ccccc3)CC2)n[nH]1	ZINC000450836210	EF	On-Demand	Anodyne	AKT2	39	40
Cn1cnc2c(c1=O)CCN(CCc1c(Cl)cccc1Cl)C2	ZINC000450836281	EF	On-Demand	Anodyne	ADRA2A	28	41
Cn1cnc2c(c1=O)CCN(CCc1c(Cl)cccc1Cl)C2	ZINC000450836281	EF	On-Demand	Anodyne	ADRA2B	36	41
Cn1cnc2c(c1=O)CCN(CCc1c(Cl)cccc1Cl)C2	ZINC000450836281	EF	On-Demand	Anodyne	ADRA2C	18	41
O=C(NCCCc1ccccc1)c1ccccc1OC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450836283	FH	On-Demand	Anodyne	KCNA3	32	43
O=C(NCCCc1ccccc1)c1ccccc1OC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450836284	FH	On-Demand	Anodyne	KCNA3	32	43
COc1ccc(-c2noc(N(C)[C@@H](CO)CC(C)(C)C)n2)cc1	ZINC000450836289	DF	On-Demand	Anodyne	LUCI_PHOPE	28	43
COc1ccc(-c2noc(N(C)[C@H](CO)CC(C)(C)C)n2)cc1	ZINC000450836290	DF	On-Demand	Anodyne	LUCI_PHOPE	28	43
COC(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450836291	GD	On-Demand	Anodyne	HTR7	25	41
COC(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450836291	GD	On-Demand	Anodyne	MTNR1A	45	35
COC(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450836293	GD	On-Demand	Anodyne	HTR7	25	41
COC(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450836293	GD	On-Demand	Anodyne	MTNR1A	45	35
CCN(Cc1c[nH]c2ccccc12)C[C@H](O)COCCOC	ZINC000450836294	DE	On-Demand	Anodyne	TACR1	36	42
COC(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450836295	GD	On-Demand	Anodyne	HTR7	25	41
COC(=O)[C@@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450836295	GD	On-Demand	Anodyne	MTNR1A	45	35
CCN(Cc1c[nH]c2ccccc12)C[C@@H](O)COCCOC	ZINC000450836296	DE	On-Demand	Anodyne	TACR1	36	42
COC(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450836298	GD	On-Demand	Anodyne	HTR7	25	41
COC(=O)[C@H]1CCN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H]1C	ZINC000450836298	GD	On-Demand	Anodyne	MTNR1A	45	35
Cc1ccc(C(=O)NCC[C@H](C)N2CCCCC2)c(C(C)C)n1	ZINC000450836373	DH	On-Demand	Anodyne	CCR5	39	42
Cc1ccc(C(=O)NCC[C@@H](C)N2CCCCC2)c(C(C)C)n1	ZINC000450836382	DH	On-Demand	Anodyne	CCR5	39	42
CCN(Cc1cccc(C(C)=O)c1)Cc1c[nH]c2ccccc12	ZINC000450836387	DI	On-Demand	Anodyne	TACR1	31	44
CCN(Cc1cccc(C(C)=O)c1)Cc1c[nH]c2ccccc12	ZINC000450836387	DI	On-Demand	Anodyne	MC4R	41	41
CCN(Cc1cccc(C(C)=O)c1)Cc1c[nH]c2ccccc12	ZINC000450836387	DI	On-Demand	Anodyne	MPO	19	47
CCN(Cc1cccc(C(C)=O)c1)Cc1c[nH]c2ccccc12	ZINC000450836387	DI	On-Demand	Anodyne	MMP14	56	32
CCN(Cc1cccc(C(C)=O)c1)Cc1c[nH]c2ccccc12	ZINC000450836387	DI	On-Demand	Anodyne	MMP11	53	32
CCN(Cc1cccc(C(C)=O)c1)Cc1c[nH]c2ccccc12	ZINC000450836387	DI	On-Demand	Anodyne	GHSR	48	35
CCN(Cc1cccc(C(C)=O)c1)Cc1c[nH]c2ccccc12	ZINC000450836387	DI	On-Demand	Anodyne	CFTR	24	40
Cc1ccnn1-c1ccccc1NC(=O)CC1CC(F)(F)C1	ZINC000450836388	DH	On-Demand	Anodyne	KCNQ2	42	34
CC(=O)CCCCCn1c(-c2cccnc2)noc1=O	ZINC000450836390	CE	On-Demand	Anodyne	TBXAS1	30	48
CC(=O)CCCCCn1c(-c2cccnc2)noc1=O	ZINC000450836390	CE	On-Demand	Anodyne	CYP2E1	40	39
CC(=O)CCCCCn1c(-c2cccnc2)noc1=O	ZINC000450836390	CE	On-Demand	Anodyne	CYP2A6	40	39
CN(C)S(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)CC(C)(C)C1CC1	ZINC000450836421	GE	On-Demand	Anodyne	TSPO	17	44
Cc1nc(C(C)C)oc1COc1ccc2c(c1)CCCC2=O	ZINC000450836430	CI	On-Demand	Anodyne	MAOB	18	53
COCCOC[C@@H](O)CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450836491	EC	On-Demand	Anodyne	HSP90AB1	40	43
COCCOC[C@H](O)CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450836492	EC	On-Demand	Anodyne	HSP90AB1	40	43
COCCOC[C@@H](O)CN1CCO[C@H](COc2ccccc2)C1	ZINC000450836493	EC	On-Demand	Anodyne	HSP90AB1	40	43
COCCOC[C@H](O)CN1CCO[C@H](COc2ccccc2)C1	ZINC000450836494	EC	On-Demand	Anodyne	HSP90AB1	40	43
O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[C@H]2O)nc1NC[C@@H]1CCCC[C@H]1O	ZINC000450836545	GE	On-Demand	Bother	PRKCQ	46	38
CCCOc1cccc(CSc2ncnc3[nH]cnc23)c1	ZINC000450836549	DG	On-Demand	Anodyne	AHK3	0	41
O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[C@H]2O)c(S(=O)(=O)N2CCCC2)c1	ZINC000450836554	GE	On-Demand	Bother	TBXA2R	19	41
O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[C@H]2O)c(S(=O)(=O)N2CCCC2)c1	ZINC000450836554	GE	On-Demand	Bother	EPHX2	19	49
CSc1cccc(C(=O)N(C)c2ccc(N3CCOCC3)nc2)c1	ZINC000450836598	EF	On-Demand	Anodyne	DGAT1	36	40
C=CCN(CCOC)Cc1ccccc1OC1CC1	ZINC000450836606	CF	On-Demand	Mild	SLC5A4	43	31
Cc1ccc2oc(N3CCOC[C@H]3c3ccc(F)cc3)nc2c1	ZINC000450836633	DH	On-Demand	Anodyne	HTR3A	0	53
Cc1ccc2oc(N3CCOC[C@@H]3c3ccc(F)cc3)nc2c1	ZINC000450836636	DH	On-Demand	Anodyne	HTR3A	0	53
CCOC(=O)c1ccc(N(C)[C@@H](CO)CC(C)(C)C)nc1	ZINC000450836674	CE	On-Demand	Anodyne	RXRA	40	34
CCOC(=O)c1ccc(N(C)[C@H](CO)CC(C)(C)C)nc1	ZINC000450836675	CE	On-Demand	Anodyne	RXRA	40	34
C[C@@H](Sc1ccc(S(C)(=O)=O)cc1)C(=O)C1CCCCC1	ZINC000450836685	EH	On-Demand	Anodyne	O49150_SOLTU	50	36
C[C@H](Sc1ccc(S(C)(=O)=O)cc1)C(=O)C1CCCCC1	ZINC000450836687	EH	On-Demand	Anodyne	O49150_SOLTU	50	36
COc1cccc(OCCC(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450836703	EF	On-Demand	Anodyne	DRD4	46	35
COc1cccc(OCCC(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450836703	EF	On-Demand	Anodyne	HRH2	48	45
COc1cccc(OCCC(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450836703	EF	On-Demand	Anodyne	AVPR1B	36	40
COc1cccc(OCCC(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450836703	EF	On-Demand	Anodyne	CCR5	17	43
COc1cccc(OCCC(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450836703	EF	On-Demand	Anodyne	MTNR1A	83	48
COc1cccc(OCCC(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000450836703	EF	On-Demand	Anodyne	MTNR1B	82	48
COc1cccc(OCCC(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450836704	EF	On-Demand	Anodyne	DRD4	46	35
COc1cccc(OCCC(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450836704	EF	On-Demand	Anodyne	HRH2	48	45
COc1cccc(OCCC(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450836704	EF	On-Demand	Anodyne	AVPR1B	36	40
COc1cccc(OCCC(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450836704	EF	On-Demand	Anodyne	CCR5	17	43
COc1cccc(OCCC(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450836704	EF	On-Demand	Anodyne	MTNR1A	83	48
COc1cccc(OCCC(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000450836704	EF	On-Demand	Anodyne	MTNR1B	82	48
CS(=O)(=O)c1cccc(Cn2c3c(sc2=O)CCCC3)c1	ZINC000450836707	DE	On-Demand	Anodyne	RGS4	0	40
CS(=O)(=O)c1cccc(Cn2c3c(sc2=O)CCCC3)c1	ZINC000450836707	DE	On-Demand	Anodyne	RGS8	0	40
COc1cc2nc(N(C)[C@@H](CO)CC(C)(C)C)nc(N)c2cc1OC	ZINC000450836721	EE	On-Demand	Anodyne	ADRA1D	16	44
COc1cc2nc(N(C)[C@@H](CO)CC(C)(C)C)nc(N)c2cc1OC	ZINC000450836721	EE	On-Demand	Anodyne	ADRA1B	41	44
COc1cc2nc(N(C)[C@@H](CO)CC(C)(C)C)nc(N)c2cc1OC	ZINC000450836721	EE	On-Demand	Anodyne	PDPK1	40	36
COc1cc2nc(N(C)[C@H](CO)CC(C)(C)C)nc(N)c2cc1OC	ZINC000450836725	EE	On-Demand	Anodyne	ADRA1D	16	44
COc1cc2nc(N(C)[C@H](CO)CC(C)(C)C)nc(N)c2cc1OC	ZINC000450836725	EE	On-Demand	Anodyne	ADRA1B	41	44
COc1cc2nc(N(C)[C@H](CO)CC(C)(C)C)nc(N)c2cc1OC	ZINC000450836725	EE	On-Demand	Anodyne	PDPK1	40	36
Cc1ccnn1-c1ccccc1NC(=O)CC1(O)CCC1	ZINC000450836774	CE	On-Demand	Anodyne	KCNQ2	62	38
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H]2COC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450836781	FC	On-Demand	Bother	TAAR1	17	41
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H]2COC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450836782	FC	On-Demand	Bother	TAAR1	17	41
C[C@H](O)CCn1nc(-c2ccc(F)cc2)ccc1=O	ZINC000450836791	CD	On-Demand	Anodyne	HMGCR	47	33
C[C@@H](O)CCn1nc(-c2ccc(F)cc2)ccc1=O	ZINC000450836793	CD	On-Demand	Anodyne	HMGCR	47	33
CN(c1ccc(S(=O)(=O)N2CCCC2)cn1)[C@H](CO)CC(C)(C)C	ZINC000450836795	FE	On-Demand	Anodyne	GCK	55	31
CN(c1ccc(S(=O)(=O)N2CCCC2)cn1)[C@H](CO)CC(C)(C)C	ZINC000450836795	FE	On-Demand	Anodyne	GCKR	59	33
CN(c1ccc(S(=O)(=O)N2CCCC2)cn1)[C@@H](CO)CC(C)(C)C	ZINC000450836796	FE	On-Demand	Anodyne	GCK	55	31
CN(c1ccc(S(=O)(=O)N2CCCC2)cn1)[C@@H](CO)CC(C)(C)C	ZINC000450836796	FE	On-Demand	Anodyne	GCKR	59	33
CCCOc1ccc(C(=O)N2CC[C@H](n3cnc4c3CCCC4)C2)c(OC)c1	ZINC000450836854	GH	On-Demand	Anodyne	OXTR	30	45
CCCOc1ccc(C(=O)N2CC[C@@H](n3cnc4c3CCCC4)C2)c(OC)c1	ZINC000450836857	GH	On-Demand	Anodyne	OXTR	30	45
COCCNC(=O)c1c[nH]nc1[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450836859	GE	On-Demand	Anodyne	SLC6A1	120	35
COCCNC(=O)c1c[nH]nc1[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450836861	GE	On-Demand	Anodyne	SLC6A1	120	35
CCCOc1ccc(C(=O)N(C)c2ccc(OCC(=O)OC)cc2)c(OC)c1	ZINC000450836874	GG	On-Demand	Anodyne	PLA2G4B	69	38
CCn1ccnc1[C@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450836906	EH	On-Demand	Anodyne	EGFR	56	37
CCn1ccnc1[C@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450836906	EH	On-Demand	Anodyne	HTT	0	41
CCn1ccnc1[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450836908	EH	On-Demand	Anodyne	EGFR	56	37
CCn1ccnc1[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450836908	EH	On-Demand	Anodyne	HTT	0	41
Clc1ccccc1-c1nnc(SCC[C@@H]2CCOC2)o1	ZINC000450836909	DH	On-Demand	Anodyne	ALOX15	0	40
Clc1ccccc1-c1nnc(SCC[C@@H]2CCOC2)o1	ZINC000450836909	DH	On-Demand	Anodyne	TERT	0	40
Clc1ccccc1-c1nnc(SCC[C@H]2CCOC2)o1	ZINC000450836911	DH	On-Demand	Anodyne	ALOX15	18	40
Clc1ccccc1-c1nnc(SCC[C@H]2CCOC2)o1	ZINC000450836911	DH	On-Demand	Anodyne	TERT	0	40
CCCNC(=O)c1ccc(N[C@H](C)Cc2cnn(C)c2)nc1	ZINC000450836940	DD	On-Demand	Anodyne	GCGR	21	42
CCCNC(=O)c1ccc(N[C@@H](C)Cc2cnn(C)c2)nc1	ZINC000450836943	DD	On-Demand	Anodyne	GCGR	21	42
CC(C)C[C@@H](C)Sc1ccc(S(C)(=O)=O)cc1	ZINC000450836953	CH	On-Demand	Anodyne	O49150_SOLTU	43	36
COC(=O)c1cccc(COc2nc(C(C)C)no2)c1Cl	ZINC000450836963	DG	On-Demand	Anodyne	MT-CYB	43	30
CC(C)C[C@H](C)Sc1ccc(S(C)(=O)=O)cc1	ZINC000450836973	CH	On-Demand	Anodyne	O49150_SOLTU	43	36
COC(=O)c1ccc(CC(=O)N2CC[C@@H](n3c(C)nc4c3CCCC4)C2)cc1	ZINC000450836977	GF	On-Demand	Anodyne	L3MBTL3	44	33
COC(=O)c1ccc(CC(=O)N2CC[C@H](n3c(C)nc4c3CCCC4)C2)cc1	ZINC000450836979	GF	On-Demand	Anodyne	L3MBTL3	44	33
CCC[C@H](O)CN1CCC[C@]1(CO)Cc1ccccc1	ZINC000450837000	CE	On-Demand	Anodyne	SLC12A5	40	34
CCC[C@@H](O)CN1CCC[C@]1(CO)Cc1ccccc1	ZINC000450837001	CE	On-Demand	Anodyne	SLC12A5	40	34
CCC[C@H](O)CN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000450837003	CE	On-Demand	Anodyne	SLC12A5	40	34
CCC[C@@H](O)CN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000450837005	CE	On-Demand	Anodyne	SLC12A5	40	34
COCCOC[C@@H](O)CN1CCc2cc(C)ccc2C1	ZINC000450837022	CD	On-Demand	Anodyne	ABCB1	40	39
COCCOC[C@@H](O)CN1CCc2cc(C)ccc2C1	ZINC000450837022	CD	On-Demand	Anodyne	HSP90AB1	36	41
COCCOC[C@H](O)CN1CCc2cc(C)ccc2C1	ZINC000450837024	CD	On-Demand	Anodyne	ABCB1	40	39
COCCOC[C@H](O)CN1CCc2cc(C)ccc2C1	ZINC000450837024	CD	On-Demand	Anodyne	HSP90AB1	36	41
Cn1nccc1[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1	ZINC000450837025	FH	On-Demand	Bother	AADAC	0	41
CCC(=O)CCCN1CCc2cc(Cl)ccc2C1	ZINC000450837026	CG	On-Demand	Anodyne	CHRNA6	0	45
Cn1nccc1[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1	ZINC000450837029	FH	On-Demand	Bother	AADAC	0	41
Cn1nccc1[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1	ZINC000450837031	FH	On-Demand	Bother	AADAC	0	41
Cn1nccc1[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1	ZINC000450837033	FH	On-Demand	Bother	AADAC	0	41
COc1ccc(-c2ccnc(N[C@H](C)Cc3cnn(C)c3)n2)cc1	ZINC000450837039	DF	On-Demand	Anodyne	CLK4	24	46
COc1ccc(-c2ccnc(N[C@@H](C)Cc3cnn(C)c3)n2)cc1	ZINC000450837040	DF	On-Demand	Anodyne	CLK4	24	46
CCN(Cc1c[nH]c2ccccc12)C[C@@H]1CCNC(=O)CC1	ZINC000450837052	CF	On-Demand	Anodyne	MC4R	46	38
CCN(Cc1c[nH]c2ccccc12)C[C@@H]1CCNC(=O)CC1	ZINC000450837052	CF	On-Demand	Anodyne	TACR2	55	42
CCN(Cc1c[nH]c2ccccc12)C[C@H]1CCNC(=O)CC1	ZINC000450837054	CF	On-Demand	Anodyne	MC4R	46	38
CCN(Cc1c[nH]c2ccccc12)C[C@H]1CCNC(=O)CC1	ZINC000450837054	CF	On-Demand	Anodyne	TACR2	55	42
CC(C)c1cccc2c1CCN(CC[C@@H](C)O)C2	ZINC000450837064	BF	On-Demand	Anodyne	CHRNA6	0	40
CC(C)c1cccc2c1CCN(CC[C@H](C)O)C2	ZINC000450837066	BF	On-Demand	Anodyne	CHRNA6	0	40
O=[N+]([O-])c1ccc(-c2csc(N[C@@H]3COC[C@H]3O)n2)cc1	ZINC000450837069	DD	On-Demand	Bother	MAOB	26	53
C[C@H](Cc1cnn(C)c1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450837099	EE	On-Demand	Bother	MAPK13	41	33
C[C@@H](Cc1cnn(C)c1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450837100	EE	On-Demand	Bother	MAPK13	41	33
CN(c1ccc(C(=O)N2CCc3ccccc32)cn1)[C@@H](CO)CC(C)(C)C	ZINC000450837101	FH	On-Demand	Anodyne	AVPR2	47	35
CN(c1ccc(C(=O)N2CCc3ccccc32)cn1)[C@H](CO)CC(C)(C)C	ZINC000450837102	FH	On-Demand	Anodyne	AVPR2	47	35
CNC(=O)c1ccc(N2CCOC[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1	ZINC000450837176	FF	On-Demand	Bother	TAAR1	16	44
CNC(=O)c1ccc(N2CCOC[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1	ZINC000450837177	FF	On-Demand	Bother	TAAR1	16	44
Cc1nc(-c2ccccn2)nc(NC[C@@H]2CCCC[C@H]2O)c1C	ZINC000450837181	DF	On-Demand	Anodyne	METAP1	38	43
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450837199	GD	On-Demand	Bother	TAAR1	20	42
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450837200	GD	On-Demand	Bother	TAAR1	20	42
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@H](O)C2CCC2)C1	ZINC000450837211	CE	On-Demand	Anodyne	CHRNA2	41	42
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@H](O)C2CCC2)C1	ZINC000450837211	CE	On-Demand	Anodyne	CRTY	0	42
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H](O)C2CCC2)C1	ZINC000450837212	CE	On-Demand	Anodyne	CHRNA2	41	42
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H](O)C2CCC2)C1	ZINC000450837212	CE	On-Demand	Anodyne	CRTY	0	42
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H](O)C2CCC2)C1	ZINC000450837213	CE	On-Demand	Anodyne	CHRNA2	41	42
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@H](O)C2CCC2)C1	ZINC000450837213	CE	On-Demand	Anodyne	CRTY	0	42
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H](O)C2CCC2)C1	ZINC000450837214	CE	On-Demand	Anodyne	CHRNA2	41	42
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H](O)C2CCC2)C1	ZINC000450837214	CE	On-Demand	Anodyne	CRTY	0	42
CN(C(=O)[C@H]1CCN(c2ccccc2)C1)c1ccc(N2CCOCC2)nc1	ZINC000450837215	FE	On-Demand	Anodyne	DGAT1	41	39
CN(C(=O)[C@@H]1CCN(c2ccccc2)C1)c1ccc(N2CCOCC2)nc1	ZINC000450837216	FE	On-Demand	Anodyne	DGAT1	41	39
Fc1ccc([C@@H]2COCCN2c2ncnc3sc4c(c23)CCC4)cc1	ZINC000450837218	FH	On-Demand	Anodyne	RBP4	17	42
Fc1ccc([C@H]2COCCN2c2ncnc3sc4c(c23)CCC4)cc1	ZINC000450837219	FH	On-Demand	Anodyne	RBP4	17	42
COC(=O)[C@@H]1CCN(Cc2c(C)cccc2Cl)C[C@H]1C	ZINC000450837239	CG	On-Demand	Anodyne	DRD3	0	41
COC(=O)[C@H]1CCN(Cc2c(C)cccc2Cl)C[C@H]1C	ZINC000450837240	CG	On-Demand	Anodyne	DRD3	0	41
COC(=O)[C@@H]1CCN(Cc2c(C)cccc2Cl)C[C@@H]1C	ZINC000450837241	CG	On-Demand	Anodyne	DRD3	0	41
COC(=O)[C@H]1CCN(Cc2c(C)cccc2Cl)C[C@@H]1C	ZINC000450837242	CG	On-Demand	Anodyne	DRD3	0	41
CCCOc1cccc2c(NCCC3(CO)CC3)ccnc12	ZINC000450837251	DH	On-Demand	Anodyne	KCNN3	15	45
COCCC(=O)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450837254	DD	On-Demand	Anodyne	FAAH	23	41
CCS(=O)(=O)c1ccc(CN2CCC[C@@]2(CO)Cc2ccccc2)cc1	ZINC000450837270	FG	On-Demand	Anodyne	SLC12A5	52	39
CCS(=O)(=O)c1ccc(CN2CCC[C@]2(CO)Cc2ccccc2)cc1	ZINC000450837271	FG	On-Demand	Anodyne	SLC12A5	52	39
CN(c1ccccc1[N+](=O)[O-])[C@@H](CO)CC(C)(C)C	ZINC000450837278	CF	On-Demand	Bother	COLA	78	36
CN(c1ccccc1[N+](=O)[O-])[C@@H](CO)CC(C)(C)C	ZINC000450837278	CF	On-Demand	Bother	PQSD	0	40
CN(c1ccccc1[N+](=O)[O-])[C@H](CO)CC(C)(C)C	ZINC000450837279	CF	On-Demand	Bother	COLA	78	36
CN(c1ccccc1[N+](=O)[O-])[C@H](CO)CC(C)(C)C	ZINC000450837279	CF	On-Demand	Bother	PQSD	0	40
CCC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450837340	CE	On-Demand	Anodyne	DRD4	42	32
CCC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450837340	CE	On-Demand	Anodyne	DRD3	0	44
CCC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450837340	CE	On-Demand	Anodyne	ABCB1	45	41
CCC[C@@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450837340	CE	On-Demand	Anodyne	HSP90AB1	38	42
CCC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450837341	CE	On-Demand	Anodyne	DRD4	42	32
CCC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450837341	CE	On-Demand	Anodyne	DRD3	0	44
CCC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450837341	CE	On-Demand	Anodyne	ABCB1	45	41
CCC[C@H](O)CN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450837341	CE	On-Demand	Anodyne	HSP90AB1	38	42
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450837357	EG	On-Demand	Anodyne	SLC12A5	90	45
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450837358	EG	On-Demand	Anodyne	SLC12A5	90	45
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450837359	EG	On-Demand	Anodyne	SLC12A5	90	45
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450837360	EG	On-Demand	Anodyne	SLC12A5	90	45
COC(=O)[C@@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837370	DF	On-Demand	Anodyne	MME	45	35
COC(=O)[C@@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837370	DF	On-Demand	Anodyne	TIMP3	47	37
COC(=O)[C@@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837370	DF	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837370	DF	On-Demand	Anodyne	CAPNS1	57	33
COC(=O)[C@@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837370	DF	On-Demand	Anodyne	ACE2	41	34
COC(=O)[C@@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837371	DF	On-Demand	Anodyne	MME	45	35
COC(=O)[C@@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837371	DF	On-Demand	Anodyne	TIMP3	47	37
COC(=O)[C@@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837371	DF	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837371	DF	On-Demand	Anodyne	CAPNS1	57	33
COC(=O)[C@@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837371	DF	On-Demand	Anodyne	ACE2	41	34
COC(=O)[C@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837372	DF	On-Demand	Anodyne	MME	45	35
COC(=O)[C@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837372	DF	On-Demand	Anodyne	TIMP3	47	37
COC(=O)[C@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837372	DF	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837372	DF	On-Demand	Anodyne	CAPNS1	57	33
COC(=O)[C@H](C)N(C[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837372	DF	On-Demand	Anodyne	ACE2	41	34
COC(=O)[C@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837373	DF	On-Demand	Anodyne	MME	45	35
COC(=O)[C@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837373	DF	On-Demand	Anodyne	TIMP3	47	37
COC(=O)[C@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837373	DF	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837373	DF	On-Demand	Anodyne	CAPNS1	57	33
COC(=O)[C@H](C)N(C[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450837373	DF	On-Demand	Anodyne	ACE2	41	34
CCc1nc(C2CCN(Cc3ccc(S(=O)(=O)CC)cc3)CC2)n[nH]1	ZINC000450837400	FF	On-Demand	Anodyne	ADORA2B	45	37
C[C@@H]1C[C@H](c2cccnc2)N(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450837421	FG	On-Demand	Anodyne	NAMPT	47	37
C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450837422	FG	On-Demand	Anodyne	NAMPT	47	37
C[C@H]1C[C@@H](c2cccnc2)N(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450837423	FG	On-Demand	Anodyne	NAMPT	47	37
C[C@H]1C[C@H](c2cccnc2)N(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450837424	FG	On-Demand	Anodyne	NAMPT	47	37
CN(C(=O)c1cc(-c2ccccc2)nn1C)c1ccc(N2CCOCC2)nc1	ZINC000450837426	GF	On-Demand	Anodyne	ADK	46	42
CN(C(=O)c1cc(-c2ccccc2)nn1C)c1ccc(N2CCOCC2)nc1	ZINC000450837426	GF	On-Demand	Anodyne	DGAT1	42	42
O[C@@H]1CCCC[C@H]1CNc1cnc(-c2ccccc2)cn1	ZINC000450837511	CG	On-Demand	Anodyne	TPH1	30	43
O[C@@H]1CCCC[C@H]1CNc1cnc(-c2ccccc2)cn1	ZINC000450837511	CG	On-Demand	Anodyne	VCP	40	36
CCOC(=O)c1csc([C@@H]2CCCN2CCCC(=O)c2ccccc2)n1	ZINC000450837517	FI	On-Demand	Anodyne	SLC6A1	43	31
CCOC(=O)c1csc([C@@H]2CCCN2CCCC(=O)c2ccccc2)n1	ZINC000450837517	FI	On-Demand	Anodyne	CYP2J2	50	36
CCOC(=O)c1csc([C@H]2CCCN2CCCC(=O)c2ccccc2)n1	ZINC000450837518	FI	On-Demand	Anodyne	SLC6A1	43	31
CCOC(=O)c1csc([C@H]2CCCN2CCCC(=O)c2ccccc2)n1	ZINC000450837518	FI	On-Demand	Anodyne	CYP2J2	50	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C)Cc1cnn(C)c1	ZINC000450837522	FC	On-Demand	Anodyne	CA2	37	43
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C)Cc1cnn(C)c1	ZINC000450837523	FC	On-Demand	Anodyne	CA2	37	43
COc1cc(CN2CCc3c(ncn(C)c3=O)C2)ccc1Cl	ZINC000450837545	DE	On-Demand	Anodyne	SSTR5	40	35
COc1cc(CN2CCc3c(ncn(C)c3=O)C2)ccc1Cl	ZINC000450837545	DE	On-Demand	Anodyne	ABCB1B	45	33
CN(c1ncnc2[nH]ccc12)[C@H](CO)CC(C)(C)C	ZINC000450837565	CE	On-Demand	Anodyne	JAK3	21	49
CN(c1ncnc2[nH]ccc12)[C@@H](CO)CC(C)(C)C	ZINC000450837566	CE	On-Demand	Anodyne	JAK3	21	49
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	FOLH1	28	48
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	ANPEP	29	44
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	SDH1	0	55
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	KCNA3	33	44
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	MTNR1B	30	47
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	ABCB1	41	42
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	AMP1_PLAFQ	35	44
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	CRTM	42	38
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	PTGES	0	40
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	HCN1	64	37
C[C@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837567	EG	On-Demand	Anodyne	HCN4	51	35
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	FOLH1	28	48
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	ANPEP	29	44
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	SDH1	0	55
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	KCNA3	33	44
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	MTNR1B	30	47
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	ABCB1	41	42
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	AMP1_PLAFQ	35	44
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	CRTM	42	38
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	PTGES	0	40
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	HCN1	64	37
C[C@@H](O)CCOc1ccccc1C(=O)NCCCc1ccccc1	ZINC000450837568	EG	On-Demand	Anodyne	HCN4	51	35
C[C@@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450837572	FE	On-Demand	Anodyne	GCKR	48	34
C[C@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450837573	FE	On-Demand	Anodyne	GCKR	48	34
OC[C@@]1(Cc2ccccc2)CCCN1CC1CC(F)(F)C1	ZINC000450837578	CG	On-Demand	Anodyne	SLC12A5	40	34
OC[C@]1(Cc2ccccc2)CCCN1CC1CC(F)(F)C1	ZINC000450837579	CG	On-Demand	Anodyne	SLC12A5	40	34
COC(=O)c1coc(CN2CCc3cc(Cl)ccc3C2)n1	ZINC000450837605	DF	On-Demand	Anodyne	NOD2	41	38
COC1CCC(CCNC(=O)c2c(Cl)cc(Cl)cc2Cl)CC1	ZINC000450837644	FJ	On-Demand	Anodyne	CACNA1I	50	39
COc1ccc(CNC(=O)CCN2CCSCC[C@@H]2C)c(OC)c1	ZINC000450837649	FF	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(CNC(=O)CCN2CCSCC[C@H]2C)c(OC)c1	ZINC000450837668	FF	On-Demand	Anodyne	MTNR1A	41	35
CCOC(=O)c1ccc(CN(C2CCC2)[C@H](C)C(=O)OC)nc1	ZINC000450837669	DE	On-Demand	Anodyne	SCARB1	50	37
CCOC(=O)c1ccc(CN(C2CCC2)[C@@H](C)C(=O)OC)nc1	ZINC000450837671	DE	On-Demand	Anodyne	SCARB1	50	37
COC(=O)c1csc(CN2CCO[C@H](COc3ccccc3)C2)n1	ZINC000450837678	EE	On-Demand	Anodyne	ADRB3	18	40
COC(=O)c1csc(CN2CCO[C@H](COc3ccccc3)C2)n1	ZINC000450837678	EE	On-Demand	Anodyne	COLA	31	42
CCC(C)(C)OCc1ccccc1NC(=O)Cc1ccc(O)c(OC)c1	ZINC000450837679	FI	On-Demand	Anodyne	TRPV1	40	50
CC(C)CC(CC(C)C)C(=O)N(C)c1ccc(N2CCOCC2)nc1	ZINC000450837680	EH	On-Demand	Anodyne	ADK	41	38
COC(=O)c1csc(CN2CCO[C@@H](COc3ccccc3)C2)n1	ZINC000450837693	EE	On-Demand	Anodyne	ADRB3	18	40
COC(=O)c1csc(CN2CCO[C@@H](COc3ccccc3)C2)n1	ZINC000450837693	EE	On-Demand	Anodyne	COLA	31	42
CCC(C)(C)OCc1ccccc1NC(=O)CCOc1cccc(OC)c1	ZINC000450837723	FJ	On-Demand	Anodyne	MTNR1A	39	42
CCC(C)(C)OCc1ccccc1NC(=O)CCOc1cccc(OC)c1	ZINC000450837723	FJ	On-Demand	Anodyne	MTNR1B	39	49
CS(=O)(=O)c1ccc(NC2CCc3ccccc3CC2)c(F)c1	ZINC000450837735	EH	On-Demand	Anodyne	GPR119	27	40
CCC(C)(C)OCc1ccccc1NC(=O)c1cc2n(n1)CCCC2	ZINC000450837758	EI	On-Demand	Anodyne	KCNQ2	55	33
COc1cc(CC(=O)N(C)c2ccc(N3CCOCC3)nc2)ccc1Cl	ZINC000450837759	GF	On-Demand	Anodyne	PDE5A	19	41
COc1cc(CC(=O)N(C)c2ccc(N3CCOCC3)nc2)ccc1Cl	ZINC000450837759	GF	On-Demand	Anodyne	OPRK1	32	44
CCC(C)(C)OCc1ccccc1NC(=O)Cc1ccc(C(=O)OC)cc1	ZINC000450837771	FI	On-Demand	Anodyne	MAPK10	0	44
CS(=O)(=O)c1ccc(NC2CCc3ccccc3CC2)cc1	ZINC000450837779	DG	On-Demand	Anodyne	PTGS2	30	44
O=[N+]([O-])c1cccc2ncnc(NC[C@@H]3CCCC[C@H]3O)c12	ZINC000450837816	DD	On-Demand	Bother	PRKCQ	43	34
CCS(=O)(=O)c1ccc(CN2CCc3cc(Cl)ccc3C2)cc1	ZINC000450837823	EH	On-Demand	Anodyne	MLNR	22	42
CCS(=O)(=O)c1ccc(CN2CCc3cc(Cl)ccc3C2)cc1	ZINC000450837823	EH	On-Demand	Anodyne	AKR1C3	17	41
CCS(=O)(=O)c1ccc(CN2CCc3cc(Cl)ccc3C2)cc1	ZINC000450837823	EH	On-Demand	Anodyne	NOD1	30	44
CCS(=O)(=O)c1ccc(CN2CCc3cc(Cl)ccc3C2)cc1	ZINC000450837823	EH	On-Demand	Anodyne	NOD2	44	38
CCS(=O)(=O)c1ccc(CN2CCc3cc(C)ccc3C2)cc1	ZINC000450837847	EG	On-Demand	Anodyne	NOD1	29	40
CCS(=O)(=O)c1ccc(CN2CCc3cc(C)ccc3C2)cc1	ZINC000450837847	EG	On-Demand	Anodyne	NOD2	45	40
CCS(=O)(=O)c1ccc(CN2CCc3cc(Br)ccc3C2)cc1	ZINC000450837861	GH	On-Demand	Anodyne	NOD2	44	37
COCCC(=O)N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450837876	FD	On-Demand	Anodyne	SIGMAR1	27	43
COCCC(=O)N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450837876	FD	On-Demand	Anodyne	FAAH	22	40
CC(=O)c1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1F	ZINC000450837900	CF	On-Demand	Anodyne	SHC	23	44
CC(=O)c1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1F	ZINC000450837901	CF	On-Demand	Anodyne	SHC	23	44
C[C@@H](Cc1cnn(C)c1)Nc1ncnc2cc(Br)ccc12	ZINC000450837929	EG	On-Demand	Anodyne	EGFR	43	40
C[C@H](Cc1cnn(C)c1)Nc1ncnc2cc(Br)ccc12	ZINC000450837930	EG	On-Demand	Anodyne	EGFR	43	40
CCOC(=O)c1cn(Cc2ccn(CCc3ccccc3)n2)nc1C(F)(F)F	ZINC000450837931	GH	On-Demand	Anodyne	P2RY12	23	40
C[C@H]1CCSCCN1CCN(C)Cc1ccccc1	ZINC000450837935	CF	On-Demand	Anodyne	HRH3	24	40
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1CC1(C#N)CCC1	ZINC000450837936	EG	On-Demand	Mild	SLC12A5	98	49
C[C@H](Cc1cnn(C)c1)Nc1ccnc2cc(Cl)ccc12	ZINC000450837955	DH	On-Demand	Anodyne	HRP1_PLAFA	136	53
C[C@H](Cc1cnn(C)c1)Nc1ccnc2cc(Cl)ccc12	ZINC000450837955	DH	On-Demand	Anodyne	HNMT	67	44
C[C@H](Cc1cnn(C)c1)Nc1ccnc2cc(Cl)ccc12	ZINC000450837955	DH	On-Demand	Anodyne	BOTA	18	43
C[C@@H](Cc1cnn(C)c1)Nc1ccnc2cc(Cl)ccc12	ZINC000450837956	DH	On-Demand	Anodyne	HRP1_PLAFA	103	53
C[C@@H](Cc1cnn(C)c1)Nc1ccnc2cc(Cl)ccc12	ZINC000450837956	DH	On-Demand	Anodyne	HNMT	67	44
Cc1nn2c(SCc3ccc([C@@H](C)C(F)(F)F)cc3)n[nH]c2nc1=O	ZINC000450837957	FG	On-Demand	Anodyne	PLA2G7	42	35
Cc1nn2c(SCc3ccc([C@H](C)C(F)(F)F)cc3)n[nH]c2nc1=O	ZINC000450837958	FG	On-Demand	Anodyne	PLA2G7	42	35
COCCC(=O)N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450837965	DD	On-Demand	Anodyne	HRH3	19	45
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1CC1(C#N)CCC1	ZINC000450837967	EG	On-Demand	Mild	SLC12A5	98	49
C[C@@H]1CCSCCN1CCN(C)Cc1ccccc1	ZINC000450837969	CF	On-Demand	Anodyne	HRH3	24	40
COC(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C[C@@H]1C	ZINC000450837977	DE	On-Demand	Anodyne	SLC6A3	26	40
COC(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C[C@@H]1C	ZINC000450837978	DE	On-Demand	Anodyne	SLC6A3	26	40
COC(=O)[C@@H]1CCN(C[C@H](O)[C@H](C)c2ccccc2)C[C@H]1C	ZINC000450837979	DE	On-Demand	Anodyne	SLC6A3	26	40
COC(=O)[C@@H]1CCN(C[C@H](O)[C@@H](C)c2ccccc2)C[C@H]1C	ZINC000450837980	DE	On-Demand	Anodyne	SLC6A3	26	40
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCCC[C@H](C)O)cc1	ZINC000450838022	GH	On-Demand	Anodyne	SLC9A1	15	41
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCCC[C@H](C)O)cc1	ZINC000450838022	GH	On-Demand	Anodyne	CCR2	15	44
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCCC[C@H](C)O)cc1	ZINC000450838022	GH	On-Demand	Anodyne	PTGDR2	39	41
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCCC[C@@H](C)O)cc1	ZINC000450838027	GH	On-Demand	Anodyne	SLC9A1	15	41
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCCC[C@@H](C)O)cc1	ZINC000450838027	GH	On-Demand	Anodyne	CCR2	15	44
Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OCCC[C@@H](C)O)cc1	ZINC000450838027	GH	On-Demand	Anodyne	PTGDR2	39	41
CN(C(=O)Cc1cc2ccccc2s1)c1ccc(N2CCOCC2)nc1	ZINC000450838038	FG	On-Demand	Anodyne	PRKDC	51	34
CN(C(=O)Cc1cc2ccccc2s1)c1ccc(N2CCOCC2)nc1	ZINC000450838038	FG	On-Demand	Anodyne	PIK3CB	58	35
CN(C(=O)Cc1cc2ccccc2s1)c1ccc(N2CCOCC2)nc1	ZINC000450838038	FG	On-Demand	Anodyne	DGAT1	40	41
CCOC(=O)c1csc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450838064	GI	On-Demand	Anodyne	HTR2A	15	40
CCOC(=O)c1csc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450838067	GI	On-Demand	Anodyne	HTR2A	15	40
C[C@H](Cc1cnn(C)c1)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450838081	FF	On-Demand	Anodyne	NPBWR1	30	40
C[C@@H](Cc1cnn(C)c1)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450838082	FF	On-Demand	Anodyne	NPBWR1	30	40
O=c1c(Cl)c(NC[C@@H]2CCCC[C@H]2O)cnn1-c1ccc(F)cc1F	ZINC000450838091	FG	On-Demand	Anodyne	MAPK14	16	44
COC(=O)c1csc(CN2CCc3c(cccc3C(C)C)C2)n1	ZINC000450838093	EH	On-Demand	Anodyne	NOD2	42	38
CC(C)c1nnc(COc2ccccc2C(=O)NCCCc2ccccc2)s1	ZINC000450838095	GJ	On-Demand	Anodyne	KCNA3	21	40
CC(C)c1nnc(COc2ccccc2C(=O)NCCCc2ccccc2)s1	ZINC000450838095	GJ	On-Demand	Anodyne	SLC6A5	27	42
CC(C)c1nnc(COc2ccccc2C(=O)NCCCc2ccccc2)s1	ZINC000450838095	GJ	On-Demand	Anodyne	HCN1	59	39
CCC(C)(C)OCc1ccccc1NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450838121	GI	On-Demand	Anodyne	MMP14	43	32
CCC(C)(C)OCc1ccccc1NC(=O)c1cn(CCc2ccccc2)nn1	ZINC000450838121	GI	On-Demand	Anodyne	MMP11	51	32
CCOC(=O)c1csc([C@@H]2CCCN2Cc2nc(-c3cc(C)ccn3)no2)n1	ZINC000450838124	GG	On-Demand	Anodyne	COLA	43	38
CCOC(=O)c1csc([C@@H]2CCCN2Cc2nc(-c3cc(C)ccn3)no2)n1	ZINC000450838124	GG	On-Demand	Anodyne	CPT1A	42	38
CCOC(=O)c1csc([C@H]2CCCN2Cc2nc(-c3cc(C)ccn3)no2)n1	ZINC000450838127	GG	On-Demand	Anodyne	COLA	43	38
CCOC(=O)c1csc([C@H]2CCCN2Cc2nc(-c3cc(C)ccn3)no2)n1	ZINC000450838127	GG	On-Demand	Anodyne	CPT1A	42	38
COc1ccc(F)c(N2CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450838130	EG	On-Demand	Anodyne	SLC18A2	15	40
COc1ccc(F)c(N2CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450838133	EG	On-Demand	Anodyne	SLC18A2	15	40
CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450838145	FI	On-Demand	Anodyne	KCNQ2	55	33
CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450838145	FI	On-Demand	Anodyne	PRNP	46	40
CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450838145	FI	On-Demand	Anodyne	HDAC1	47	49
CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450838145	FI	On-Demand	Anodyne	HPGDS	18	40
N#CC1(COc2ccccc2C(=O)NCCCc2ccccc2)CCC1	ZINC000450838152	EI	On-Demand	Mild	CTSK	23	41
N#CC1(COc2ccccc2C(=O)NCCCc2ccccc2)CCC1	ZINC000450838152	EI	On-Demand	Mild	KCNA3	36	45
N#CC1(COc2ccccc2C(=O)NCCCc2ccccc2)CCC1	ZINC000450838152	EI	On-Demand	Mild	CRTM	40	36
N#CC1(COc2ccccc2C(=O)NCCCc2ccccc2)CCC1	ZINC000450838152	EI	On-Demand	Mild	HCN1	65	37
N#CC1(COc2ccccc2C(=O)NCCCc2ccccc2)CCC1	ZINC000450838152	EI	On-Demand	Mild	HCN4	54	35
Cc1ccc2c(N[C@H](C)Cc3cnn(C)c3)c(C#N)cnc2c1Br	ZINC000450838203	GH	On-Demand	Mild	MAP3K8	25	42
CNC(=O)C[C@@H](C)Nc1nccc2c([N+](=O)[O-])cccc12	ZINC000450838234	CE	On-Demand	Bother	COLA	46	31
CNC(=O)C[C@H](C)Nc1nccc2c([N+](=O)[O-])cccc12	ZINC000450838235	CE	On-Demand	Bother	COLA	46	31
O=C(CCCN1CC(=O)N(CC(F)(F)F)C1)c1ccc(Br)cc1	ZINC000450838236	GG	On-Demand	Anodyne	CYP2J2	51	36
O=C(NCC(F)F)[C@@H]1CCCCN1c1nccc(OCc2ccccc2)n1	ZINC000450838239	GF	On-Demand	Anodyne	FKBP1A	45	37
O=C(NCC(F)F)[C@@H]1CCCCN1c1nccc(OCc2ccccc2)n1	ZINC000450838239	GF	On-Demand	Anodyne	PREP	40	35
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2ccsc12	ZINC000450838241	EE	On-Demand	Anodyne	SIRT3	51	35
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2ccsc12	ZINC000450838241	EE	On-Demand	Anodyne	SIRT2	52	35
COc1ccc(CNC(=O)CCN2CC(C)(C)OC[C@@H]2C)c(OC)c1	ZINC000450838253	FE	On-Demand	Anodyne	MTNR1A	54	39
COc1ccc(CNC(=O)CCN2CC(C)(C)OC[C@@H]2C)c(OC)c1	ZINC000450838253	FE	On-Demand	Anodyne	MTNR1B	40	39
COC(=O)[C@@H](C)CSCc1ccn(CCc2ccccc2)n1	ZINC000450838264	DG	On-Demand	Anodyne	CYSP_TRYCR	46	33
COC(=O)[C@@H](C)CSCc1ccn(CCc2ccccc2)n1	ZINC000450838264	DG	On-Demand	Anodyne	FAS	27	41
COC(=O)[C@H](C)CSCc1ccn(CCc2ccccc2)n1	ZINC000450838265	DG	On-Demand	Anodyne	CYSP_TRYCR	46	33
COC(=O)[C@H](C)CSCc1ccn(CCc2ccccc2)n1	ZINC000450838265	DG	On-Demand	Anodyne	FAS	27	41
CCSCc1ccc(Nc2ncnc3c2cnn3C)cc1	ZINC000450838286	CG	On-Demand	Anodyne	ABL1	24	40
CSc1cccc(C(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)c1	ZINC000450838312	FH	On-Demand	Anodyne	CCR2	47	43
CSc1cccc(C(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)c1	ZINC000450838312	FH	On-Demand	Anodyne	CACNA1I	50	39
CSc1cccc(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)c1	ZINC000450838313	FH	On-Demand	Anodyne	CCR2	47	43
CSc1cccc(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)c1	ZINC000450838313	FH	On-Demand	Anodyne	CACNA1I	50	39
CCCc1nc(C)c(COc2ccc(C(=O)NCC)cc2)o1	ZINC000450838319	DG	On-Demand	Anodyne	KCNQ1	0	40
COc1cc2c(NCCC3(CO)CC3)ccnc2cc1F	ZINC000450838355	CF	On-Demand	Anodyne	HRP1_PLAFA	76	31
COc1cc2c(NCCC3(CO)CC3)ccnc2cc1F	ZINC000450838355	CF	On-Demand	Anodyne	FGFR2	47	39
COc1cc2c(NCCC3(CO)CC3)ccnc2cc1F	ZINC000450838355	CF	On-Demand	Anodyne	FLT1	0	42
COc1cc2c(NCCC3(CO)CC3)ccnc2cc1F	ZINC000450838355	CF	On-Demand	Anodyne	HNMT	47	33
CCN(CC)CCOCCNC(=O)[C@H]1CCC(=O)N1C	ZINC000450838373	CC	On-Demand	Anodyne	P2RX7	19	45
CCN(CC)CCOCCNC(=O)[C@@H]1CCC(=O)N1C	ZINC000450838374	CC	On-Demand	Anodyne	P2RX7	19	45
C=CCN(CCCC(=O)c1ccc(F)cc1)CCOC	ZINC000450838402	CF	On-Demand	Mild	LSS	42	46
O=C(NCCCc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450838405	GH	On-Demand	Anodyne	KCNA3	34	42
O=C(NCCCc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450838405	GH	On-Demand	Anodyne	HCN1	54	37
O=C(NCCCc1ccccc1)c1ccccc1OCc1cn(CC2CC2)nn1	ZINC000450838405	GH	On-Demand	Anodyne	HCN4	42	33
CC(C)NC(=O)c1ccc(N[C@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450838418	EF	On-Demand	Bother	TAAR1	19	43
CC(C)NC(=O)c1ccc(N[C@@H](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000450838419	EF	On-Demand	Bother	TAAR1	16	43
CC1CCN(C(=O)c2ccc(N[C@H]3CCc4cc(F)c(F)c(F)c43)nc2)CC1	ZINC000450838430	GI	On-Demand	Anodyne	BDKRB1	20	40
CC1CCN(C(=O)c2ccc(N[C@@H]3CCc4cc(F)c(F)c(F)c43)nc2)CC1	ZINC000450838431	GI	On-Demand	Anodyne	BDKRB1	20	40
COC1CCC(CCNC(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450838455	FH	On-Demand	Anodyne	TIMP3	65	35
Cc1ccc2c(N[C@@H](C)Cc3cnn(C)c3)c(C#N)cnc2c1Br	ZINC000450838461	GH	On-Demand	Mild	MAP3K8	25	42
C[C@@H](Sc1nnc(-c2ccccc2Cl)o1)C(=O)C1CCCCC1	ZINC000450838462	FK	On-Demand	Anodyne	ALOX15	22	41
C[C@H](Sc1nnc(-c2ccccc2Cl)o1)C(=O)C1CCCCC1	ZINC000450838463	FK	On-Demand	Anodyne	ALOX15	22	41
CO[C@@H](Cc1ccccc1)CN1C(=O)CN(C2CCCC2)C1=O	ZINC000450838470	DE	On-Demand	Anodyne	CACNA1D	23	43
COC(=O)[C@H](C)N(CCCC(=O)c1ccccc1)C1CCC1	ZINC000450838471	DG	On-Demand	Anodyne	AMY2	48	33
COC(=O)[C@H](C)N(CCCC(=O)c1ccccc1)C1CCC1	ZINC000450838471	DG	On-Demand	Anodyne	CYP2J2	45	32
COC(=O)[C@@H](C)N(CCCC(=O)c1ccccc1)C1CCC1	ZINC000450838472	DG	On-Demand	Anodyne	AMY2	48	33
COC(=O)[C@@H](C)N(CCCC(=O)c1ccccc1)C1CCC1	ZINC000450838472	DG	On-Demand	Anodyne	CYP2J2	45	32
CO[C@H](Cc1ccccc1)CN1C(=O)CN(C2CCCC2)C1=O	ZINC000450838477	DE	On-Demand	Anodyne	CACNA1D	23	43
CCC(CC)Oc1ccc(C(=O)N(C)c2ccc(N3CCOCC3)nc2)cc1	ZINC000450838478	GH	On-Demand	Anodyne	DGAT1	25	41
CC(C)c1nccc(N2CCOC[C@H]2c2ccc(F)cc2)n1	ZINC000450838485	DG	On-Demand	Anodyne	SORD	74	35
CC(C)c1nccc(N2CCOC[C@@H]2c2ccc(F)cc2)n1	ZINC000450838486	DG	On-Demand	Anodyne	SORD	74	35
CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450838493	GK	On-Demand	Anodyne	F10	28	41
CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450838493	GK	On-Demand	Anodyne	GCK	22	42
O=S(=O)(c1cccnc1NC[C@@H]1CCCC[C@H]1O)N1CCCCC1	ZINC000450838498	FE	On-Demand	Anodyne	EPHX2	21	42
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1CC1CCC(=O)CC1	ZINC000450838524	EG	On-Demand	Anodyne	AMY2	45	31
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1CC1CCC(=O)CC1	ZINC000450838524	EG	On-Demand	Anodyne	SLC12A5	99	51
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1CC1CCC(=O)CC1	ZINC000450838525	EG	On-Demand	Anodyne	AMY2	45	31
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1CC1CCC(=O)CC1	ZINC000450838525	EG	On-Demand	Anodyne	SLC12A5	99	51
CCC(=O)CCCN1CCO[C@H](COc2ccccc2)C1	ZINC000450838536	CF	On-Demand	Anodyne	CYP2J2	47	33
CCC(=O)CCCN1CCO[C@@H](COc2ccccc2)C1	ZINC000450838537	CF	On-Demand	Anodyne	CYP2J2	47	33
CCc1cc(CCCN2CCC(c3noc(-c4ccccc4OC)n3)CC2)on1	ZINC000450838538	GI	On-Demand	Anodyne	DRD2	25	42
CCc1cc(CCCN2CCC(c3noc(-c4ccccc4OC)n3)CC2)on1	ZINC000450838538	GI	On-Demand	Anodyne	DRD4	19	42
CCc1cc(CCCN2CCC(c3noc(-c4ccccc4OC)n3)CC2)on1	ZINC000450838538	GI	On-Demand	Anodyne	DRD3	25	40
CCc1cc(CCCN2CCC(c3noc(-c4ccccc4OC)n3)CC2)on1	ZINC000450838538	GI	On-Demand	Anodyne	CARM1	47	37
CCOCc1nc(C)c(C(=O)Nc2c(C)noc2-c2ccccc2)s1	ZINC000450838539	FI	On-Demand	Anodyne	HSP90AB1	15	40
CC(=O)CCCCCn1nnnc1-c1ccccn1	ZINC000450838546	CD	On-Demand	Anodyne	FAAH	38	41
COc1ccccc1-c1csc(C2CCN(C[C@H](C)S(C)(=O)=O)CC2)n1	ZINC000450838562	GG	On-Demand	Anodyne	ILES	25	44
CC(=O)c1ccc(CN2CCNC(=O)[C@H]2c2ccc(OC(F)(F)F)cc2)cc1	ZINC000450838568	GG	On-Demand	Anodyne	GCGR	41	38
CC(=O)c1ccc(CN2CCNC(=O)[C@@H]2c2ccc(OC(F)(F)F)cc2)cc1	ZINC000450838569	GG	On-Demand	Anodyne	GCGR	41	38
COc1ccccc1-c1csc(C2CCN(C[C@@H](C)S(C)(=O)=O)CC2)n1	ZINC000450838570	GG	On-Demand	Anodyne	ILES	25	44
CCN1CN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450838583	EC	On-Demand	Anodyne	MTNR1A	58	36
CCN1CN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450838583	EC	On-Demand	Anodyne	MTNR1B	41	39
CCC(C)(C)OCc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450838588	FJ	On-Demand	Anodyne	KCNQ2	45	36
CCN(CC)CCOCCNC(=O)C(C)(C)C(C)(F)F	ZINC000450838595	CE	On-Demand	Anodyne	Q8WMX0_BOVIN	0	40
CCC(C)(C)OCc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450838599	FJ	On-Demand	Anodyne	KCNQ2	45	36
COC(=O)Cn1ncc2c(=O)n(CCc3c(Cl)cccc3Cl)cnc21	ZINC000450838600	GE	On-Demand	Anodyne	NPBWR1	54	35
COC(=O)Cn1ncc2c(=O)n(CCc3c(Cl)cccc3Cl)cnc21	ZINC000450838600	GE	On-Demand	Anodyne	Q9M629_MAIZE	52	34
O=C(CCCN1CCO[C@H](COc2ccccc2)C1)c1ccccc1	ZINC000450838606	EG	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CCO[C@H](COc2ccccc2)C1)c1ccccc1	ZINC000450838606	EG	On-Demand	Anodyne	SLC6A1	57	36
O=C(CCCN1CCO[C@H](COc2ccccc2)C1)c1ccccc1	ZINC000450838606	EG	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCCN1CCO[C@@H](COc2ccccc2)C1)c1ccccc1	ZINC000450838607	EG	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CCO[C@@H](COc2ccccc2)C1)c1ccccc1	ZINC000450838607	EG	On-Demand	Anodyne	SLC6A1	57	36
O=C(CCCN1CCO[C@@H](COc2ccccc2)C1)c1ccccc1	ZINC000450838607	EG	On-Demand	Anodyne	CYP2J2	58	41
O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCC2)nc1	ZINC000450838616	GD	On-Demand	Bother	HPGDS	15	41
CCOC(=O)C[C@H](C)SC[C@@H](Cc1ccccc1)OC	ZINC000450838627	CG	On-Demand	Anodyne	CTSB	17	40
CCOC(=O)C[C@H](C)SC[C@@H](Cc1ccccc1)OC	ZINC000450838627	CG	On-Demand	Anodyne	CYSP_TRYCR	33	42
CCOC(=O)C[C@H](C)SC[C@@H](Cc1ccccc1)OC	ZINC000450838627	CG	On-Demand	Anodyne	PDS	41	34
CCOC(=O)C[C@@H](C)SC[C@H](Cc1ccccc1)OC	ZINC000450838628	CG	On-Demand	Anodyne	CTSB	17	40
CCOC(=O)C[C@@H](C)SC[C@H](Cc1ccccc1)OC	ZINC000450838628	CG	On-Demand	Anodyne	CYSP_TRYCR	33	42
CCOC(=O)C[C@@H](C)SC[C@H](Cc1ccccc1)OC	ZINC000450838628	CG	On-Demand	Anodyne	PDS	41	34
CCOC(=O)C[C@@H](C)SC[C@@H](Cc1ccccc1)OC	ZINC000450838629	CG	On-Demand	Anodyne	CTSB	17	40
CCOC(=O)C[C@@H](C)SC[C@@H](Cc1ccccc1)OC	ZINC000450838629	CG	On-Demand	Anodyne	CYSP_TRYCR	33	42
CCOC(=O)C[C@@H](C)SC[C@@H](Cc1ccccc1)OC	ZINC000450838629	CG	On-Demand	Anodyne	PDS	41	34
CCOC(=O)C[C@H](C)SC[C@H](Cc1ccccc1)OC	ZINC000450838630	CG	On-Demand	Anodyne	CTSB	17	40
CCOC(=O)C[C@H](C)SC[C@H](Cc1ccccc1)OC	ZINC000450838630	CG	On-Demand	Anodyne	CYSP_TRYCR	33	42
CCOC(=O)C[C@H](C)SC[C@H](Cc1ccccc1)OC	ZINC000450838630	CG	On-Demand	Anodyne	PDS	41	34
CCNC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)cc1	ZINC000450838635	DG	On-Demand	Anodyne	KCNQ1	0	42
CCNC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)cc1	ZINC000450838635	DG	On-Demand	Anodyne	FLT3	45	40
CCN(Cc1ccc(S(=O)(=O)CC)cc1)c1cccc(O)c1	ZINC000450838641	DG	On-Demand	Anodyne	HSD17B2	17	41
CCN(Cc1ccc(S(=O)(=O)CC)cc1)c1cccc(O)c1	ZINC000450838641	DG	On-Demand	Anodyne	RORC	43	35
CCc1cc(CCCN2CCc3cc(C)ccc3C2)on1	ZINC000450838648	CH	On-Demand	Anodyne	CHRNA6	0	40
COC(=O)[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C[C@H]1C	ZINC000450838659	EH	On-Demand	Anodyne	SLC6A1	0	47
COC(=O)[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C[C@H]1C	ZINC000450838659	EH	On-Demand	Anodyne	MLNR	59	38
COC(=O)[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C[C@H]1C	ZINC000450838659	EH	On-Demand	Anodyne	CACNA1G	40	38
COC(=O)[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C[C@@H]1C	ZINC000450838665	EH	On-Demand	Anodyne	SLC6A1	0	47
COC(=O)[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C[C@@H]1C	ZINC000450838665	EH	On-Demand	Anodyne	MLNR	59	38
COC(=O)[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C[C@@H]1C	ZINC000450838665	EH	On-Demand	Anodyne	CACNA1G	40	38
COC(=O)[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@@H]1C	ZINC000450838667	EH	On-Demand	Anodyne	SLC6A1	0	47
COC(=O)[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@@H]1C	ZINC000450838667	EH	On-Demand	Anodyne	MLNR	59	38
COC(=O)[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@@H]1C	ZINC000450838667	EH	On-Demand	Anodyne	CACNA1G	40	38
Cc1cc(N2CCCC[C@H]2C(=O)NCC(F)F)nc(-c2ccncc2)n1	ZINC000450838668	FF	On-Demand	Anodyne	NOS2	26	42
COC(=O)[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@H]1C	ZINC000450838669	EH	On-Demand	Anodyne	SLC6A1	0	47
COC(=O)[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@H]1C	ZINC000450838669	EH	On-Demand	Anodyne	MLNR	59	38
COC(=O)[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@H]1C	ZINC000450838669	EH	On-Demand	Anodyne	CACNA1G	40	38
O=C(NCC(F)F)[C@@H]1CCCCN1c1cc(-c2ccccc2)nc2ncnn12	ZINC000450838674	GF	On-Demand	Anodyne	COLA	40	35
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)CCOC)CC2)cc1	ZINC000450838686	FD	On-Demand	Anodyne	MMP13	22	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)CCOC)CC2)cc1	ZINC000450838686	FD	On-Demand	Anodyne	ADAM17	23	40
CCS(=O)(=O)c1ccc(CN2CCN(C(=O)CCOC)CC2)cc1	ZINC000450838686	FD	On-Demand	Anodyne	ABHD6	0	40
CC(C)[C@H]1CN(CCN(C)Cc2ccccc2)CCN1C	ZINC000450838701	CE	On-Demand	Anodyne	SIGMAR1	28	44
CC(C)[C@@H]1CN(CCN(C)Cc2ccccc2)CCN1C	ZINC000450838703	CE	On-Demand	Anodyne	SIGMAR1	28	44
CCCN(CCC)S(=O)(=O)N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450838721	GE	On-Demand	Anodyne	SIGMAR1	18	41
CCc1nc(C)c(COc2ccccc2C(=O)NCCCc2ccccc2)o1	ZINC000450838725	GI	On-Demand	Anodyne	MTNR1B	43	40
CCc1nc(C)c(COc2ccccc2C(=O)NCCCc2ccccc2)o1	ZINC000450838725	GI	On-Demand	Anodyne	SLC6A5	26	40
CCc1nc(C)c(COc2ccccc2C(=O)NCCCc2ccccc2)o1	ZINC000450838725	GI	On-Demand	Anodyne	HCN1	52	36
COc1ccc(C(=O)NC2(Cc3ccccc3)CCCC2)cc1S(C)(=O)=O	ZINC000450838726	GG	On-Demand	Anodyne	COLA	69	36
COc1ccc(C(=O)NC2(Cc3ccccc3)CCCC2)cc1S(C)(=O)=O	ZINC000450838726	GG	On-Demand	Anodyne	CPT1A	64	36
COc1ccc(C(=O)NC2(Cc3ccccc3)CCCC2)cc1S(C)(=O)=O	ZINC000450838726	GG	On-Demand	Anodyne	CPT2	40	32
COc1ccc(C(=O)NC2(Cc3ccccc3)CCCC2)cc1S(C)(=O)=O	ZINC000450838726	GG	On-Demand	Anodyne	CPT1B	57	35
O=C1CN(C2CCCC2)C(=O)N1CC/C=C\c1ccccc1	ZINC000450838850	CG	On-Demand	Anodyne	CACNA1D	28	40
O=C1CN(C2CCCC2)C(=O)N1CC/C=C/c1ccccc1	ZINC000450838851	CG	On-Demand	Anodyne	CACNA1D	28	40
Cc1cc(=NC[C@@H]2CCCC[C@H]2O)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450838868	EF	On-Demand	Bother	GYRB	40	36
CN(C(=O)[C@@H]1C[C@@]1(C)c1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000450838885	FF	On-Demand	Anodyne	DGAT1	35	41
CCS(=O)(=O)c1ccc(CN(CCC(F)(F)F)Cc2ccccc2)cc1	ZINC000450838906	GI	On-Demand	Anodyne	RORC	45	55
CCC(C)(C)OCc1ccccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450838909	DG	On-Demand	Anodyne	KCNQ2	43	32
CCC(C)(C)OCc1ccccc1NC(=O)[C@H](O)C1CCC1	ZINC000450838910	DG	On-Demand	Anodyne	KCNQ2	43	32
COC1CCC(CCNC(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450838913	EI	On-Demand	Anodyne	TIMP3	73	39
CCC(C)(C)OCc1ccccc1NC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450838914	GK	On-Demand	Anodyne	IRAK4	22	44
FC1(F)CCC[C@@H]1CSc1nnc(-c2ccccc2Cl)o1	ZINC000450838921	EJ	On-Demand	Anodyne	ALOX15	46	38
FC1(F)CCC[C@H]1CSc1nnc(-c2ccccc2Cl)o1	ZINC000450838922	EJ	On-Demand	Anodyne	ALOX15	46	38
CCCc1nc(C)c(CSc2nnc(-c3ccccc3Cl)o2)o1	ZINC000450838929	EJ	On-Demand	Anodyne	TERT	0	42
CCCc1nc(C)c(CSc2nnc(-c3ccccc3Cl)o2)o1	ZINC000450838929	EJ	On-Demand	Anodyne	CPB	0	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450838932	FJ	On-Demand	Anodyne	ANPEP	33	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450838932	FJ	On-Demand	Anodyne	CAPN1	29	43
C[C@H](Cc1cnn(C)c1)Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450838962	FF	On-Demand	Anodyne	ROS1	54	39
C[C@@H](Cc1cnn(C)c1)Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450838963	FF	On-Demand	Anodyne	ROS1	54	39
COc1cc(CC(=O)N(C)C[C@@H](C)c2nn[nH]n2)ccc1Cl	ZINC000450838990	DD	On-Demand	Anodyne	OPRK1	0	50
COc1cc(CC(=O)N(C)C[C@H](C)c2nn[nH]n2)ccc1Cl	ZINC000450838991	DD	On-Demand	Anodyne	OPRK1	0	50
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	HTR1A	27	41
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	DRD2	29	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	DRD1	0	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	DRD4	42	41
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	DRD3	22	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	AVPR1B	44	36
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	HTR7	28	46
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	SIGMAR1	18	44
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	MMP13	18	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	HTR6	15	46
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	ADAM17	25	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	MMP9	17	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)cc1	ZINC000450839015	GF	On-Demand	Anodyne	MMP1	15	43
COC(=O)c1coc(CN2CCN(c3cc(OC)ccc3F)CC2)n1	ZINC000450839019	ED	On-Demand	Anodyne	DRD4	44	34
O=C(NCCCc1ccccc1)c1ccccc1OC[C@H]1COCCO1	ZINC000450839045	FF	On-Demand	Anodyne	KCNA3	31	43
O=C(NCCCc1ccccc1)c1ccccc1OC[C@H]1COCCO1	ZINC000450839045	FF	On-Demand	Anodyne	MGLL	0	41
O=C(NCCCc1ccccc1)c1ccccc1OC[C@H]1COCCO1	ZINC000450839045	FF	On-Demand	Anodyne	CRTM	40	36
O=C(NCCCc1ccccc1)c1ccccc1OC[C@H]1COCCO1	ZINC000450839045	FF	On-Demand	Anodyne	HCN1	42	32
O=C(NCCCc1ccccc1)c1ccccc1OC[C@H]1COCCO1	ZINC000450839045	FF	On-Demand	Anodyne	HCN4	42	32
O=C(NCCCc1ccccc1)c1ccccc1OC[C@@H]1COCCO1	ZINC000450839046	FF	On-Demand	Anodyne	KCNA3	31	43
O=C(NCCCc1ccccc1)c1ccccc1OC[C@@H]1COCCO1	ZINC000450839046	FF	On-Demand	Anodyne	MGLL	0	41
O=C(NCCCc1ccccc1)c1ccccc1OC[C@@H]1COCCO1	ZINC000450839046	FF	On-Demand	Anodyne	CRTM	40	36
O=C(NCCCc1ccccc1)c1ccccc1OC[C@@H]1COCCO1	ZINC000450839046	FF	On-Demand	Anodyne	HCN1	42	32
O=C(NCCCc1ccccc1)c1ccccc1OC[C@@H]1COCCO1	ZINC000450839046	FF	On-Demand	Anodyne	HCN4	42	32
COC(=O)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@H]1C	ZINC000450839053	EF	On-Demand	Anodyne	SIGMAR1	42	39
COC(=O)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@@H]1C	ZINC000450839054	EF	On-Demand	Anodyne	SIGMAR1	42	39
COC(=O)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@@H]1C	ZINC000450839055	EF	On-Demand	Anodyne	SIGMAR1	42	39
COC(=O)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C[C@H]1C	ZINC000450839056	EF	On-Demand	Anodyne	SIGMAR1	42	39
C[C@H](Cc1cnn(C)c1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450839066	EG	On-Demand	Bother	AADAC	0	48
C[C@@H](Cc1cnn(C)c1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450839067	EG	On-Demand	Bother	AADAC	0	48
CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC(N)=O	ZINC000450839106	DC	On-Demand	Anodyne	MTNR1A	51	38
CCN(CC)CCNC(=O)c1ccc(OCc2cn(C)nc2C)cc1	ZINC000450839129	EE	On-Demand	Anodyne	KCNQ1	0	56
CNC(=O)C[C@@H](C)Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1	ZINC000450839144	DE	On-Demand	Bother	COLA	47	32
CNC(=O)C[C@H](C)Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1	ZINC000450839145	DE	On-Demand	Bother	COLA	47	32
O=C(NC[C@H]1CCc2nccn2C1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450839155	FG	On-Demand	Anodyne	RBP4	56	39
COc1cc(CC(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)ccc1O	ZINC000450839165	GF	On-Demand	Anodyne	TRPV1	0	46
COc1cc(CC(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)ccc1O	ZINC000450839166	GF	On-Demand	Anodyne	TRPV1	0	46
CCNC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450839194	CD	On-Demand	Anodyne	KCNQ1	0	49
CCNC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450839194	CD	On-Demand	Anodyne	PLA2G4B	75	39
CCNC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450839195	CD	On-Demand	Anodyne	KCNQ1	0	49
CCNC(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450839195	CD	On-Demand	Anodyne	PLA2G4B	75	39
CCNC(=O)c1ccc(OCC2(C#N)CCC2)cc1	ZINC000450839211	CF	On-Demand	Mild	KCNQ1	0	41
COC(=O)Cn1ncc2c(=O)n(CCc3ccc(Cl)cc3)cnc21	ZINC000450839232	ED	On-Demand	Anodyne	Q9M629_MAIZE	52	32
Cn1cc([C@@H]2CSCCN2CCCC(=O)c2ccc(F)cc2)cn1	ZINC000450839241	EG	On-Demand	Anodyne	DRD4	0	40
Cn1cc([C@@H]2CSCCN2CCCC(=O)c2ccc(F)cc2)cn1	ZINC000450839241	EG	On-Demand	Anodyne	SLC18A3	0	40
Cn1cc([C@H]2CSCCN2CCCC(=O)c2ccc(F)cc2)cn1	ZINC000450839242	EG	On-Demand	Anodyne	DRD4	0	40
Cn1cc([C@H]2CSCCN2CCCC(=O)c2ccc(F)cc2)cn1	ZINC000450839242	EG	On-Demand	Anodyne	SLC18A3	0	40
CCN(CC)CCOCCNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450839284	ED	On-Demand	Anodyne	AMY2	42	37
CCN(CC)CCOCCNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450839285	ED	On-Demand	Anodyne	AMY2	42	37
CCC(C)(C)OCc1ccccc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450839297	EJ	On-Demand	Anodyne	KCNQ2	44	33
CCC(C)(C)OCc1ccccc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450839298	FJ	On-Demand	Anodyne	MME	61	43
CCC(C)(C)OCc1ccccc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450839298	FJ	On-Demand	Anodyne	PAPA1_CARPA	55	34
CCC(C)(C)OCc1ccccc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450839298	FJ	On-Demand	Anodyne	CTSL	20	41
CCC(C)(C)OCc1ccccc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450839298	FJ	On-Demand	Anodyne	TIMP3	49	31
CCC(C)(C)OCc1ccccc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450839299	FJ	On-Demand	Anodyne	MME	61	43
CCC(C)(C)OCc1ccccc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450839299	FJ	On-Demand	Anodyne	PAPA1_CARPA	55	34
CCC(C)(C)OCc1ccccc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450839299	FJ	On-Demand	Anodyne	CTSL	20	41
CCC(C)(C)OCc1ccccc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450839299	FJ	On-Demand	Anodyne	TIMP3	49	31
COC(=O)c1ccc(CN2C(=O)CN(C3CCCC3)C2=O)cc1Cl	ZINC000450839323	FF	On-Demand	Anodyne	OPRK1	0	41
CCN(CC)CCOCCNC(=O)C[C@H]1COc2ccccc2O1	ZINC000450839331	ED	On-Demand	Anodyne	ADRA2B	19	41
CCN(CC)CCOCCNC(=O)C[C@H]1COc2ccccc2O1	ZINC000450839331	ED	On-Demand	Anodyne	ADRA2C	15	41
CCN(CC)CCOCCNC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450839332	ED	On-Demand	Anodyne	ADRA2B	19	41
CCN(CC)CCOCCNC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450839332	ED	On-Demand	Anodyne	ADRA2C	15	41
CCN(CC)CCOCCNC(=O)[C@@H]1CC12CCSCC2	ZINC000450839345	DD	On-Demand	Anodyne	EPHX2	0	42
CCN(CC)CCOCCNC(=O)[C@H]1CC12CCSCC2	ZINC000450839346	DD	On-Demand	Anodyne	EPHX2	0	42
COc1ccc(F)c(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450839347	EG	On-Demand	Anodyne	HTR1A	38	44
COc1ccc(F)c(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450839347	EG	On-Demand	Anodyne	DRD2	47	41
COc1ccc(F)c(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450839347	EG	On-Demand	Anodyne	DRD4	51	39
COc1ccc(F)c(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450839347	EG	On-Demand	Anodyne	AVPR1B	40	32
COc1ccc(F)c(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450839347	EG	On-Demand	Anodyne	SIGMAR1	26	42
COc1ccc(F)c(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450839347	EG	On-Demand	Anodyne	MCHR1	28	41
COc1ccc(F)c(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450839347	EG	On-Demand	Anodyne	ABHD6	0	40
COc1ccc(CNC(=O)CCN2C[C@H](C)S(=O)[C@@H](C)C2)c(OC)c1	ZINC000450839354	FD	On-Demand	Anodyne	MTNR1A	74	40
COc1ccc(CNC(=O)CCN2C[C@H](C)S(=O)[C@@H](C)C2)c(OC)c1	ZINC000450839354	FD	On-Demand	Anodyne	MTNR1B	59	40
COc1ccc(CNC(=O)CCN2C[C@H](C)[S@@](=O)[C@H](C)C2)c(OC)c1	ZINC000450839355	FD	On-Demand	Anodyne	MTNR1A	74	40
COc1ccc(CNC(=O)CCN2C[C@H](C)[S@@](=O)[C@H](C)C2)c(OC)c1	ZINC000450839355	FD	On-Demand	Anodyne	MTNR1B	59	40
COc1ccc(CNC(=O)CCN2C[C@@H](C)S(=O)[C@H](C)C2)c(OC)c1	ZINC000450839356	FD	On-Demand	Anodyne	MTNR1A	74	40
COc1ccc(CNC(=O)CCN2C[C@@H](C)S(=O)[C@H](C)C2)c(OC)c1	ZINC000450839356	FD	On-Demand	Anodyne	MTNR1B	59	40
CCc1nc(C2CCN(Cc3c(C)cccc3Cl)CC2)n[nH]1	ZINC000450839358	DH	On-Demand	Anodyne	AKT2	46	33
Cn1nccc1[C@H]1C[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450839379	GF	On-Demand	Bother	MAPK13	41	35
Cn1nccc1[C@@H]1C[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450839380	GF	On-Demand	Bother	MAPK13	41	35
Cn1nccc1[C@@H]1C[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450839381	GF	On-Demand	Bother	MAPK13	41	35
Cn1nccc1[C@H]1C[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450839382	GF	On-Demand	Bother	MAPK13	41	35
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCc2ccccc2CC1	ZINC000450839395	FF	On-Demand	Bother	TBXA2R	18	43
Cc1ccc(NC(=O)c2ccc(N[C@@H](C)Cc3cnn(C)c3)nc2)cc1	ZINC000450839420	EG	On-Demand	Anodyne	PRNP	55	33
Cc1ccc(NC(=O)c2ccc(N[C@@H](C)Cc3cnn(C)c3)nc2)cc1	ZINC000450839420	EG	On-Demand	Anodyne	P4HTM	0	46
Cc1ccc(NC(=O)c2ccc(N[C@H](C)Cc3cnn(C)c3)nc2)cc1	ZINC000450839421	EG	On-Demand	Anodyne	PRNP	55	33
Cc1ccc(NC(=O)c2ccc(N[C@H](C)Cc3cnn(C)c3)nc2)cc1	ZINC000450839421	EG	On-Demand	Anodyne	P4HTM	0	46
O=C(Cc1ccc(O)c(F)c1)NC1(Cc2ccccc2)CCCC1	ZINC000450839425	EH	On-Demand	Anodyne	CAN2	0	40
C[C@@H](OCCc1ccccc1)C(=O)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450839429	GG	On-Demand	Anodyne	CARM1	40	35
C[C@H](OCCc1ccccc1)C(=O)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450839430	GG	On-Demand	Anodyne	CARM1	40	35
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450839431	GG	On-Demand	Anodyne	CARM1	40	35
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450839432	GG	On-Demand	Anodyne	CARM1	40	35
COc1ccc(C[C@@H](CO)CNc2ncnc3[nH]ccc23)cc1Br	ZINC000450839439	GE	On-Demand	Anodyne	PDE6A	42	33
COc1ccc(C[C@H](CO)CNc2ncnc3[nH]ccc23)cc1Br	ZINC000450839440	GE	On-Demand	Anodyne	PDE6A	42	33
CCN(CC(=O)OC(C)(C)C)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450839477	GG	On-Demand	Anodyne	CCR5	34	41
Cc1cc(N2CCOC[C@H]2c2ccc(F)cc2)n2ncnc2n1	ZINC000450839478	DE	On-Demand	Anodyne	DHOD	0	44
CCN(CC(=O)OC(C)(C)C)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450839479	GG	On-Demand	Anodyne	CCR5	34	41
Cc1cc(N2CCOC[C@@H]2c2ccc(F)cc2)n2ncnc2n1	ZINC000450839480	DE	On-Demand	Anodyne	DHOD	0	44
CCN(CC(=O)OC(C)(C)C)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450839481	GG	On-Demand	Anodyne	CCR5	34	41
CCN(CC(=O)OC(C)(C)C)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450839483	GG	On-Demand	Anodyne	CCR5	34	41
CS(=O)(=O)N1CC[C@H](CSCCCc2ccccc2)C1	ZINC000450839484	DF	On-Demand	Anodyne	SIGMAR1	17	42
C[C@@H](O)CCN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450839485	GG	On-Demand	Anodyne	PRCP	23	43
C[C@@H](O)CCN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450839485	GG	On-Demand	Anodyne	SMO	58	41
C[C@@H](O)CCN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450839485	GG	On-Demand	Anodyne	ETHR	54	45
C[C@H](O)CCN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450839486	GG	On-Demand	Anodyne	PRCP	23	43
C[C@H](O)CCN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450839486	GG	On-Demand	Anodyne	SMO	58	41
C[C@H](O)CCN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450839486	GG	On-Demand	Anodyne	ETHR	54	45
CS(=O)(=O)N1CC[C@@H](CSCCCc2ccccc2)C1	ZINC000450839498	DF	On-Demand	Anodyne	SIGMAR1	17	42
COC(=O)c1csc(CSCCCc2ccccc2)n1	ZINC000450839508	DH	On-Demand	Anodyne	FAAH	30	44
COC(=O)c1csc(CSCCCc2ccccc2)n1	ZINC000450839508	DH	On-Demand	Anodyne	CES1	32	41
CN(C(=O)c1ccc(C(C)(F)F)nc1)c1ccc(N2CCOCC2)nc1	ZINC000450839513	FF	On-Demand	Anodyne	HPGDS	19	44
N#Cc1ccc(OCC(=O)N[C@]2(CO)CCOC2)cc1Br	ZINC000450839570	FC	On-Demand	Mild	TRPV4	40	30
CCC(C)(C)OCc1ccccc1NC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450839571	FI	On-Demand	Anodyne	HCAR2	19	42
N#Cc1ccc(OCC(=O)N[C@@]2(CO)CCOC2)cc1Br	ZINC000450839573	FC	On-Demand	Mild	TRPV4	40	30
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	F2	55	39
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	FKBP1A	36	44
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	ELANE	40	35
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	TACR1	15	40
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	TRY1_BOVIN	45	36
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	PREP	68	46
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	AMY2	42	37
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	TPP2	41	38
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	XIAP	35	40
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	BRCA1	51	32
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450839609	FD	On-Demand	Anodyne	TMPRSS11D	65	35
COC(=O)c1coc(CSCCCc2ccccc2)n1	ZINC000450839616	CG	On-Demand	Anodyne	FAAH	40	42
COC(=O)c1coc(CSCCCc2ccccc2)n1	ZINC000450839616	CG	On-Demand	Anodyne	CES1	46	42
CC(=O)CCCCCn1cc(-c2ccccc2)cn1	ZINC000450839617	CH	On-Demand	Anodyne	HDAC1	23	40
CC(=O)CCCCCn1cc(-c2ccccc2)cn1	ZINC000450839617	CH	On-Demand	Anodyne	FAAH	51	35
CC(=O)c1cccc(CN2CCO[C@H](COc3ccccc3)C2)c1	ZINC000450839631	EG	On-Demand	Anodyne	DRD4	34	54
CC(=O)c1cccc(CN2CCO[C@@H](COc3ccccc3)C2)c1	ZINC000450839632	EG	On-Demand	Anodyne	DRD4	34	54
C[C@@H](Cc1cnn(C)c1)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450839638	DH	On-Demand	Anodyne	HRP1_PLAFA	71	39
C[C@@H](Cc1cnn(C)c1)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450839638	DH	On-Demand	Anodyne	HNMT	46	32
C[C@H](Cc1cnn(C)c1)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450839639	DH	On-Demand	Anodyne	HRP1_PLAFA	48	39
C[C@H](Cc1cnn(C)c1)Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450839639	DH	On-Demand	Anodyne	HNMT	46	32
Cc1ccnc(NC2CCc3ccccc3CC2)n1	ZINC000450839662	CG	On-Demand	Anodyne	MAPK8	28	45
CCN(CC)CCOCCNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450839663	GD	On-Demand	Anodyne	PDE8B	47	33
CCN(CC)CCOCCNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450839664	GD	On-Demand	Anodyne	PDE8B	47	33
CCOC(=O)c1ccc(CN2CCC(c3n[nH]c(CC)n3)CC2)nc1	ZINC000450839668	EE	On-Demand	Anodyne	SSTR5	42	35
COc1cc(OC)c2ncc(C#N)c(N[C@H](C)Cc3cnn(C)c3)c2c1	ZINC000450839679	FF	On-Demand	Mild	SRC	61	33
COc1cc(OC)c2ncc(C#N)c(N[C@@H](C)Cc3cnn(C)c3)c2c1	ZINC000450839680	FF	On-Demand	Mild	SRC	61	33
CCN(CC)CCOCCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450839681	DD	On-Demand	Anodyne	HPGDS	16	42
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1Cc1nnc(C2CC2)s1	ZINC000450839702	FH	On-Demand	Anodyne	SLC12A5	86	44
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1Cc1nnc(C2CC2)s1	ZINC000450839703	FH	On-Demand	Anodyne	SLC12A5	86	44
CN(CCCC(=O)c1ccc(F)cc1)C1(CO)CCOCC1	ZINC000450839735	DE	On-Demand	Anodyne	DRD2	29	41
CNC(=O)C[C@@H](C)Nc1nc(C(F)(F)F)nc2ccc(OC)cc12	ZINC000450839784	EE	On-Demand	Anodyne	MTNR1A	40	35
CNC(=O)C[C@H](C)Nc1nc(C(F)(F)F)nc2ccc(OC)cc12	ZINC000450839786	EE	On-Demand	Anodyne	MTNR1A	40	35
CC1(O)CC(C(=O)NC2(Cc3ccccc3)CCCC2)C1	ZINC000450839788	CF	On-Demand	Anodyne	SLC12A5	40	34
O=C(c1ccc(NC[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450839789	FE	On-Demand	Bother	L3MBTL3	42	44
O=C(NC1(Cc2ccccc2)CCCC1)c1cc2n(n1)CCCC2	ZINC000450839799	DH	On-Demand	Anodyne	SLC12A5	42	32
CCc1nc(C)cc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450839829	DE	On-Demand	Anodyne	NOS2	19	40
CC(=O)c1cccc(CN2CCN(C)[C@H](C(C)C)C2)c1	ZINC000450839831	CF	On-Demand	Anodyne	TRY2_BOVIN	52	34
CC(=O)c1cccc(CN2CCN(C)[C@@H](C(C)C)C2)c1	ZINC000450839833	CF	On-Demand	Anodyne	TRY2_BOVIN	52	34
O=C(NCC(F)F)[C@@H]1CCCCN1c1nc2ccccc2s1	ZINC000450839879	EG	On-Demand	Anodyne	PRSS3	0	40
O=C(NCC(F)F)[C@@H]1CCCCN1c1nc2ccccc2s1	ZINC000450839879	EG	On-Demand	Anodyne	TRY1_BOVIN	57	39
COc1cccc(OCCC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)c1	ZINC000450839883	GE	On-Demand	Anodyne	DRD4	44	33
COc1cccc(OCCC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)c1	ZINC000450839883	GE	On-Demand	Anodyne	MTNR1A	16	40
COc1cccc(OCCC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)c1	ZINC000450839883	GE	On-Demand	Anodyne	MTNR1B	21	40
COc1cccc(OCCC(=O)N2CCC(C)(CN3CCN(C)CC3)CC2)c1	ZINC000450839883	GE	On-Demand	Anodyne	EPHX2	18	41
CCc1cc(N[C@H](C)CC(=O)NC)n2ncnc2n1	ZINC000450839919	CC	On-Demand	Anodyne	DHOD	0	47
CCc1cc(N[C@@H](C)CC(=O)NC)n2ncnc2n1	ZINC000450839920	CC	On-Demand	Anodyne	DHOD	0	47
CS[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1N1CCCC1	ZINC000450839924	GE	On-Demand	Anodyne	EPHX2	17	48
CS[C@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1N1CCCC1	ZINC000450839925	GE	On-Demand	Anodyne	EPHX2	17	48
CS[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@H]1N1CCCC1	ZINC000450839926	GE	On-Demand	Anodyne	EPHX2	17	48
CS[C@@H]1CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C[C@@H]1N1CCCC1	ZINC000450839927	GE	On-Demand	Anodyne	EPHX2	17	48
Nc1ncccc1CN1CCO[C@H](COc2ccccc2)C1	ZINC000450839928	CD	On-Demand	Anodyne	DRD4	15	45
Nc1ncccc1CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450839929	CD	On-Demand	Anodyne	DRD4	15	45
CCN(CC)CCOCCNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450839933	EG	On-Demand	Anodyne	PPARA	17	42
CCN(CC)CCOCCNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450839933	EG	On-Demand	Anodyne	PPARD	21	42
CCN(CC)CCOCCNC(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450839966	DE	On-Demand	Anodyne	AMY2	42	39
O=C(Nc1cccc(C(F)F)c1Cl)c1ccc(N2CCC2)nc1	ZINC000450839971	EI	On-Demand	Anodyne	HDAC1	26	42
O=C(Nc1cccc(C(F)F)c1Cl)c1ccc(N2CCC2)nc1	ZINC000450839971	EI	On-Demand	Anodyne	HPGDS	25	43
CN(C(=O)CCCC(=O)C1CC1)c1ccc(N2CCOCC2)nc1	ZINC000450840085	EE	On-Demand	Anodyne	AKR1C3	16	43
COC(=O)Cn1ncc2c(=O)n(Cc3ccc(Cl)c(OC)c3)cnc21	ZINC000450840086	FD	On-Demand	Anodyne	SCD1	0	45
COC(=O)Cn1ncc2c(=O)n(Cc3ccc(Cl)c(OC)c3)cnc21	ZINC000450840086	FD	On-Demand	Anodyne	SCD	0	42
COC(=O)Cn1ncc2c(=O)n(Cc3ccc(Cl)c(OC)c3)cnc21	ZINC000450840086	FD	On-Demand	Anodyne	NPBWR1	52	39
COC(=O)Cn1ncc2c(=O)n(Cc3ccc(Cl)c(OC)c3)cnc21	ZINC000450840086	FD	On-Demand	Anodyne	Q9M629_MAIZE	48	34
CCC1(CNc2ncnc3scc(-c4ccc(F)cc4)c23)COC1	ZINC000450840141	EI	On-Demand	Anodyne	ADRB3	19	44
CC(C)OCCNC(=O)C1=C(c2ccccc2)CCC1	ZINC000450840146	CG	On-Demand	Anodyne	DHODH	15	40
N#Cc1cccc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450840150	CD	On-Demand	Mild	ERG	0	42
CCOC(=O)C[C@@H](C)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450840192	DF	On-Demand	Anodyne	MAP	0	50
CCOC(=O)C[C@@H](C)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450840192	DF	On-Demand	Anodyne	MAP1	125	50
CCOC(=O)C[C@H](C)S[C@H](C)C(=O)Nc1nccs1	ZINC000450840193	DF	On-Demand	Anodyne	MAP	0	50
CCOC(=O)C[C@H](C)S[C@H](C)C(=O)Nc1nccs1	ZINC000450840193	DF	On-Demand	Anodyne	MAP1	125	50
CCOC(=O)C[C@H](C)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450840194	DF	On-Demand	Anodyne	MAP	0	50
CCOC(=O)C[C@H](C)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450840194	DF	On-Demand	Anodyne	MAP1	125	50
CCOC(=O)C[C@@H](C)S[C@H](C)C(=O)Nc1nccs1	ZINC000450840195	DF	On-Demand	Anodyne	MAP	0	50
CCOC(=O)C[C@@H](C)S[C@H](C)C(=O)Nc1nccs1	ZINC000450840195	DF	On-Demand	Anodyne	MAP1	125	50
COC(=O)c1cccc(CN2CC(=O)N(CC(F)(F)F)C2)c1Cl	ZINC000450840212	FE	On-Demand	Anodyne	P2RX7	40	36
CNC(=O)C[C@@H](C)Nc1ncc(C#N)cc1Cl	ZINC000450840223	CD	On-Demand	Mild	IRAK4	15	43
COC(=O)c1ccc(CN[C@H]2CCCc3c(O)cccc32)cc1Cl	ZINC000450840228	EH	On-Demand	Anodyne	CCL2	0	40
COC(=O)c1ccc(CN[C@@H]2CCCc3c(O)cccc32)cc1Cl	ZINC000450840229	EH	On-Demand	Anodyne	CCL2	0	40
C[C@H](O)CCN1CCO[C@@H](COc2ccccc2)C1	ZINC000450840306	CD	On-Demand	Anodyne	CHRNA10	45	42
C[C@@H](O)CCN1CCO[C@H](COc2ccccc2)C1	ZINC000450840307	CD	On-Demand	Anodyne	CHRNA10	45	42
C[C@@H](O)CCN1CCO[C@@H](COc2ccccc2)C1	ZINC000450840308	CD	On-Demand	Anodyne	CHRNA10	45	42
C[C@H](O)CCN1CCO[C@H](COc2ccccc2)C1	ZINC000450840309	CD	On-Demand	Anodyne	CHRNA10	45	42
CC(C)(C)OC1CC(Sc2nnc(-c3ccccc3Cl)o2)C1	ZINC000450840310	EJ	On-Demand	Anodyne	ALOX15	20	40
O[C@@H](CN[C@H](c1ccc(F)cc1)C(F)(F)F)Cc1ccccc1	ZINC000450840384	EH	On-Demand	Anodyne	CTSF	47	36
COCC(=O)N1CCc2c(NC(=O)[C@@H](O)C3CCC3)cccc21	ZINC000450840400	DD	On-Demand	Anodyne	KCNQ2	55	35
COCC(=O)N1CCc2c(NC(=O)[C@H](O)C3CCC3)cccc21	ZINC000450840401	DD	On-Demand	Anodyne	KCNQ2	55	35
COc1cc2c(N3CCOC[C@H]3c3ccc(F)cc3)ncnc2cc1F	ZINC000450840409	FG	On-Demand	Anodyne	PDE3A	49	37
COc1cc2c(N3CCOC[C@H]3c3ccc(F)cc3)ncnc2cc1F	ZINC000450840409	FG	On-Demand	Anodyne	PDGFRB	45	35
COc1cc2c(N3CCOC[C@H]3c3ccc(F)cc3)ncnc2cc1F	ZINC000450840409	FG	On-Demand	Anodyne	PDE3B	72	37
COc1cc2c(N3CCOC[C@@H]3c3ccc(F)cc3)ncnc2cc1F	ZINC000450840410	FG	On-Demand	Anodyne	PDE3A	49	37
COc1cc2c(N3CCOC[C@@H]3c3ccc(F)cc3)ncnc2cc1F	ZINC000450840410	FG	On-Demand	Anodyne	PDGFRB	45	35
COc1cc2c(N3CCOC[C@@H]3c3ccc(F)cc3)ncnc2cc1F	ZINC000450840410	FG	On-Demand	Anodyne	PDE3B	72	37
COC(=O)C1(CN[C@H](c2ccc(F)cc2)C(F)(F)F)CC1	ZINC000450840419	DF	On-Demand	Anodyne	CTSK	28	41
CCS(=O)(=O)c1ccc(CN[C@H](c2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450840423	GI	On-Demand	Anodyne	CTSF	50	32
CCS(=O)(=O)c1ccc(CN[C@H](c2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450840423	GI	On-Demand	Anodyne	RORC	58	39
CNC(=O)C[C@H](C)Nc1ncc(C#N)cc1Cl	ZINC000450840424	CD	On-Demand	Mild	IRAK4	15	43
CCNC(=O)c1ccc(OCC(=O)CC(C)(C)C2CC2)cc1	ZINC000450840425	DG	On-Demand	Anodyne	KCNQ1	0	41
CCNC(=O)c1ccc(OCC(=O)CC(C)(C)C2CC2)cc1	ZINC000450840425	DG	On-Demand	Anodyne	PLA2G4B	80	40
Cn1ncc2c(NC[C@@H](CO)Cc3cc(Br)ccc3F)ncnc21	ZINC000450840426	GF	On-Demand	Anodyne	ABL1	34	45
Cn1ncc2c(NC[C@@H](CO)Cc3cc(Br)ccc3F)ncnc21	ZINC000450840426	GF	On-Demand	Anodyne	SRC	0	45
Cn1ncc2c(NC[C@H](CO)Cc3cc(Br)ccc3F)ncnc21	ZINC000450840427	GF	On-Demand	Anodyne	ABL1	34	45
Cn1ncc2c(NC[C@H](CO)Cc3cc(Br)ccc3F)ncnc21	ZINC000450840427	GF	On-Demand	Anodyne	SRC	0	45
CCC1(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])COC1	ZINC000450840430	EH	On-Demand	Bother	TAAR1	20	46
O=C(NCC(F)F)[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450840475	GG	On-Demand	Bother	SFRP1	73	35
O=C(NCC(F)F)[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450840475	GG	On-Demand	Bother	WNT3	74	35
N#Cc1ccc(N2CCCC[C@H]2C(=O)NCC(F)F)c([N+](=O)[O-])c1	ZINC000450840478	EE	On-Demand	Mild	ERG	0	40
Cc1ccc(C(=O)NCCOC(C)C)cc1C(=O)NCCOC(C)C	ZINC000450840481	FE	On-Demand	Anodyne	KIT	15	43
Cc1ccc(C(=O)NCCOC(C)C)cc1C(=O)NCCOC(C)C	ZINC000450840481	FE	On-Demand	Anodyne	MAPK14	26	43
Cc1ccc(C(=O)NCCOC(C)C)cc1C(=O)NCCOC(C)C	ZINC000450840481	FE	On-Demand	Anodyne	F3	66	33
CNC(=O)C[C@H](C)Nc1ncnc2ccc(C)cc12	ZINC000450840482	CD	On-Demand	Anodyne	CD38	46	40
CNC(=O)C[C@@H](C)Nc1ncnc2ccc(C)cc12	ZINC000450840483	CD	On-Demand	Anodyne	CD38	46	40
O=C(NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450840484	GI	On-Demand	Anodyne	SCN9A	0	41
O=C(NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450840485	GI	On-Demand	Anodyne	SCN9A	0	41
O=C(NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450840486	GI	On-Demand	Anodyne	SCN9A	0	41
O=C(NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450840487	GI	On-Demand	Anodyne	SCN9A	0	41
COc1cc(CN2C[C@H](OC)[C@@H](OC)C2)ccc1Cl	ZINC000450840492	CE	On-Demand	Anodyne	DRD4	18	45
COc1cc(CN2C[C@H](OC)[C@H](OC)C2)ccc1Cl	ZINC000450840493	CE	On-Demand	Anodyne	DRD4	18	45
COc1cc(CN2C[C@@H](OC)[C@H](OC)C2)ccc1Cl	ZINC000450840494	CE	On-Demand	Anodyne	DRD4	18	45
CCC1(CNc2ncnc3scc(-c4ccccc4)c23)COC1	ZINC000450840510	EI	On-Demand	Anodyne	ADRB3	27	40
COCCN(C)S(=O)(=O)[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450840521	GD	On-Demand	Anodyne	SLC6A1	84	35
COCCN(C)S(=O)(=O)[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450840521	GD	On-Demand	Anodyne	SIGMAR1	22	41
COCCN(C)S(=O)(=O)[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450840522	GD	On-Demand	Anodyne	SLC6A1	84	35
COCCN(C)S(=O)(=O)[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450840522	GD	On-Demand	Anodyne	SIGMAR1	22	41
CC(=O)c1cccc(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)c1	ZINC000450840544	DI	On-Demand	Anodyne	ACHE	21	41
CC(=O)c1cccc(CN2CC[C@@H](C(F)(F)F)C(C)(C)C2)c1	ZINC000450840545	DI	On-Demand	Anodyne	ACHE	21	41
CCN(CC)CCOCCNC(=O)Cc1ccc(O)c(F)c1	ZINC000450840546	DD	On-Demand	Anodyne	NCE103	25	48
COC1(CSc2nnc(-c3ccccc3Cl)o2)CCC1	ZINC000450840561	DI	On-Demand	Anodyne	ALOX15	50	37
C[C@H](Cc1cnn(C)c1)Nc1ccnc2cc(F)ccc12	ZINC000450840572	CG	On-Demand	Anodyne	HNMT	50	32
C[C@@H](Cc1cnn(C)c1)Nc1ccnc2cc(F)ccc12	ZINC000450840573	CG	On-Demand	Anodyne	HNMT	50	32
C[C@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450840593	FD	On-Demand	Bother	BDKRB1	0	46
C[C@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450840593	FD	On-Demand	Bother	BCL2L1	68	33
C[C@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450840593	FD	On-Demand	Bother	BCL2	50	31
C[C@@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450840594	FD	On-Demand	Bother	BDKRB1	0	46
C[C@@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450840594	FD	On-Demand	Bother	BCL2L1	68	33
C[C@@H](Cc1cnn(C)c1)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450840594	FD	On-Demand	Bother	BCL2	50	31
COc1cc2c(N[C@@H](C)Cc3cnn(C)c3)ncnc2cc1F	ZINC000450840597	DF	On-Demand	Anodyne	EGFR	38	41
COc1cc2c(N[C@H](C)Cc3cnn(C)c3)ncnc2cc1F	ZINC000450840598	DF	On-Demand	Anodyne	EGFR	38	41
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCc2ccccc2CC1	ZINC000450840599	FG	On-Demand	Bother	TBXA2R	21	45
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1Cc1nnc(C(C)C)s1	ZINC000450840606	FH	On-Demand	Anodyne	SLC12A5	90	45
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1Cc1nnc(C(C)C)s1	ZINC000450840607	FH	On-Demand	Anodyne	SLC12A5	90	45
CCS(=O)(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450840621	GF	On-Demand	Anodyne	DRD4	19	58
CCS(=O)(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450840621	GF	On-Demand	Anodyne	CASP3	48	36
CCS(=O)(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450840621	GF	On-Demand	Anodyne	MMP13	16	40
CCS(=O)(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450840621	GF	On-Demand	Anodyne	ADAM17	21	40
CCS(=O)(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450840621	GF	On-Demand	Anodyne	CASP7	45	36
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450840622	GF	On-Demand	Anodyne	DRD4	19	58
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450840622	GF	On-Demand	Anodyne	CASP3	48	36
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450840622	GF	On-Demand	Anodyne	MMP13	16	40
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450840622	GF	On-Demand	Anodyne	ADAM17	21	40
CCS(=O)(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450840622	GF	On-Demand	Anodyne	CASP7	45	36
C[C@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)[S@@]1=O	ZINC000450840623	CF	On-Demand	Anodyne	SLC6A1	0	40
C[C@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)[S@@]1=O	ZINC000450840623	CF	On-Demand	Anodyne	HRH3	0	40
C[C@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)[S@@]1=O	ZINC000450840623	CF	On-Demand	Anodyne	CACNA1D	51	43
COCC(=O)N1CCc2c(NC(=O)CCOc3cccc(OC)c3)cccc21	ZINC000450840629	GF	On-Demand	Anodyne	DRD4	44	35
COCC(=O)N1CCc2c(NC(=O)CCOc3cccc(OC)c3)cccc21	ZINC000450840629	GF	On-Demand	Anodyne	CYSLTR2	43	31
COCC(=O)N1CCc2c(NC(=O)CCOc3cccc(OC)c3)cccc21	ZINC000450840629	GF	On-Demand	Anodyne	MTNR1A	23	40
COCC(=O)N1CCc2c(NC(=O)CCOc3cccc(OC)c3)cccc21	ZINC000450840629	GF	On-Demand	Anodyne	MTNR1B	27	42
COC(=O)Cn1ncc2c(=O)n(Cc3c(C)cccc3Cl)cnc21	ZINC000450840656	ED	On-Demand	Anodyne	NPBWR1	54	43
CC[C@H](CC(F)(F)F)C(=O)N(C)c1ccc(N2CCOCC2)nc1	ZINC000450840703	EF	On-Demand	Anodyne	DGAT1	40	37
CC[C@@H](CC(F)(F)F)C(=O)N(C)c1ccc(N2CCOCC2)nc1	ZINC000450840704	EF	On-Demand	Anodyne	DGAT1	40	37
C=CCN(CCOC)Cc1ccc(C(C)=O)cc1	ZINC000450840713	BF	On-Demand	Mild	SHC	22	40
C=CCN(CCOC)Cc1ccc(C(C)=O)cc1	ZINC000450840713	BF	On-Demand	Mild	LSS	40	40
Cc1ccn(CC(=O)NC2(Cc3ccccc3)CCCC2)n1	ZINC000450840742	CF	On-Demand	Anodyne	SLC12A5	47	38
CN(CCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1)Cc1ccccc1	ZINC000450840745	GF	On-Demand	Anodyne	DRD2	20	43
CN(CCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1)Cc1ccccc1	ZINC000450840745	GF	On-Demand	Anodyne	ACHE	31	41
CN(CCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1)Cc1ccccc1	ZINC000450840745	GF	On-Demand	Anodyne	DRD3	16	41
CN(CCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1)Cc1ccccc1	ZINC000450840745	GF	On-Demand	Anodyne	LTA4H	33	42
CN(CCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1)Cc1ccccc1	ZINC000450840745	GF	On-Demand	Anodyne	SIGMAR1	58	42
CN(CCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1)Cc1ccccc1	ZINC000450840745	GF	On-Demand	Anodyne	CCR5	55	43
CN(CCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1)Cc1ccccc1	ZINC000450840745	GF	On-Demand	Anodyne	AMY2	45	32
CN(CCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1)Cc1ccccc1	ZINC000450840745	GF	On-Demand	Anodyne	CYP2J2	46	33
Cc1cc(N2CCCC[C@H]2C(=O)NCC(F)F)nc(C2CC2)n1	ZINC000450840762	DE	On-Demand	Anodyne	NOS2	17	42
CC(=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)cc1	ZINC000450840804	GI	On-Demand	Anodyne	S1PR4	24	46
CC(=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)cc1	ZINC000450840804	GI	On-Demand	Anodyne	S1PR1	16	46
CC(=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)cc1	ZINC000450840804	GI	On-Demand	Anodyne	S1PR5	39	41
C[C@H]1CN(CCc2ccc(Cl)cc2)C[C@H](C)S1=O	ZINC000450840809	CF	On-Demand	Anodyne	SLC6A1	0	40
C[C@H]1CN(CCc2ccc(Cl)cc2)C[C@H](C)S1=O	ZINC000450840809	CF	On-Demand	Anodyne	HRH3	0	40
C[C@H]1CN(CCc2ccc(Cl)cc2)C[C@H](C)S1=O	ZINC000450840809	CF	On-Demand	Anodyne	CACNA1D	51	43
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450840811	GG	On-Demand	Anodyne	TRPV1	74	34
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)S1=O	ZINC000450840812	CF	On-Demand	Anodyne	SLC6A1	0	40
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)S1=O	ZINC000450840812	CF	On-Demand	Anodyne	HRH3	0	40
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)S1=O	ZINC000450840812	CF	On-Demand	Anodyne	CACNA1D	51	43
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450840825	GG	On-Demand	Anodyne	TRPV1	74	34
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450840827	GG	On-Demand	Anodyne	TRPV1	74	34
COC(=O)c1csc(CN2CCN(c3cc(OC)ccc3F)CC2)n1	ZINC000450840830	FE	On-Demand	Anodyne	DRD4	44	34
COC(=O)c1csc(CN2CCN(c3cc(OC)ccc3F)CC2)n1	ZINC000450840830	FE	On-Demand	Anodyne	HTR7	20	40
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450840832	GG	On-Demand	Anodyne	TRPV1	74	34
Cn1cc(-c2ccc(C(=O)NC3(Cc4ccccc4)CCCC3)o2)cn1	ZINC000450840853	EH	On-Demand	Anodyne	NPPA	42	33
COc1ccc(C[C@H](CO)CNc2ncc(C)c(C)n2)cc1Br	ZINC000450840854	GG	On-Demand	Anodyne	P2RX2	42	41
COc1ccc(C[C@H](CO)CNc2ncc(C)c(C)n2)cc1Br	ZINC000450840854	GG	On-Demand	Anodyne	P2RX3	39	41
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(CCc2cscn2)n1	ZINC000450840862	FE	On-Demand	Anodyne	BMP1	49	36
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(CCc2cscn2)n1	ZINC000450840862	FE	On-Demand	Anodyne	SOAT1	18	47
COc1ccc(C[C@@H](CO)CNc2ncc(C)c(C)n2)cc1Br	ZINC000450840863	GG	On-Demand	Anodyne	P2RX2	42	41
COc1ccc(C[C@@H](CO)CNc2ncc(C)c(C)n2)cc1Br	ZINC000450840863	GG	On-Demand	Anodyne	P2RX3	39	41
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(CCc2cscn2)n1	ZINC000450840865	FE	On-Demand	Anodyne	BMP1	49	36
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(CCc2cscn2)n1	ZINC000450840865	FE	On-Demand	Anodyne	SOAT1	18	47
O=C(NC1(Cc2ccccc2)CCCC1)c1ccc(N2CCC2)nc1	ZINC000450840876	EH	On-Demand	Anodyne	HDAC1	23	44
O=C(NC1(Cc2ccccc2)CCCC1)c1ccc(N2CCC2)nc1	ZINC000450840876	EH	On-Demand	Anodyne	SMO	0	45
O=C(NC1(Cc2ccccc2)CCCC1)c1ccc(N2CCC2)nc1	ZINC000450840876	EH	On-Demand	Anodyne	HPGDS	19	44
O=C(NC1(Cc2ccccc2)CCCC1)c1ccc(N2CCC2)nc1	ZINC000450840876	EH	On-Demand	Anodyne	SLC12A5	47	34
COc1cc(CN2CCSC[C@H](C)C2)ccc1Cl	ZINC000450840887	CH	On-Demand	Anodyne	DRD4	17	44
COc1cc(CN2CCSC[C@@H](C)C2)ccc1Cl	ZINC000450840888	CH	On-Demand	Anodyne	DRD4	17	44
CN(Cc1nnn(CCSCc2ccccc2)n1)C(=O)c1ccccc1	ZINC000450840912	FF	On-Demand	Anodyne	DAGLA	31	40
Cc1ccc2ncnc(N3CCCC[C@H]3C(=O)NCC(F)F)c2c1	ZINC000450840915	EF	On-Demand	Anodyne	PDGFRB	21	40
COC(=O)[C@H](C)N(Cc1ccn(CC(F)(F)F)n1)C1CCC1	ZINC000450840930	DE	On-Demand	Anodyne	SCARB1	42	32
COC(=O)[C@@H](C)N(Cc1ccn(CC(F)(F)F)n1)C1CCC1	ZINC000450840932	DE	On-Demand	Anodyne	SCARB1	42	32
CCC1(CNc2ccc(-n3ncc(Cl)c(Cl)c3=O)cc2Cl)COC1	ZINC000450840940	GI	On-Demand	Anodyne	NPBWR1	47	37
CCNC(=O)c1ccc(OC[C@H]2CCCCC2(F)F)cc1	ZINC000450840948	CH	On-Demand	Anodyne	KCNQ1	0	53
CCNC(=O)c1ccc(OC[C@@H]2CCCCC2(F)F)cc1	ZINC000450840949	CH	On-Demand	Anodyne	KCNQ1	0	53
Cc1ccccc1-n1ncc2c(=O)n(CC[C@@H](C)O)cnc21	ZINC000450840963	CD	On-Demand	Anodyne	GCK	20	40
CCOC(=O)c1csc([C@@H]2CCCN2Cc2ccc(Cl)c(OC)c2)n1	ZINC000450840970	GI	On-Demand	Anodyne	SSTR5	38	40
CCOC(=O)c1csc([C@H]2CCCN2Cc2ccc(Cl)c(OC)c2)n1	ZINC000450840971	GI	On-Demand	Anodyne	SSTR5	38	40
Cc1ccccc1-n1ncc2c(=O)n(CC[C@H](C)O)cnc21	ZINC000450840973	CD	On-Demand	Anodyne	GCK	20	40
N#Cc1ccnc(NC2CCc3ccccc3CC2)c1	ZINC000450840988	CG	On-Demand	Mild	PKD2	0	43
CCn1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)cn1	ZINC000450841003	EG	On-Demand	Anodyne	DRD2	30	42
CCn1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)cn1	ZINC000450841003	EG	On-Demand	Anodyne	DRD4	0	46
CCn1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)cn1	ZINC000450841003	EG	On-Demand	Anodyne	SLC18A3	0	43
CCn1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)cn1	ZINC000450841003	EG	On-Demand	Anodyne	CYP2J2	51	36
CCn1cc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)cn1	ZINC000450841005	EG	On-Demand	Anodyne	DRD2	30	42
CCn1cc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)cn1	ZINC000450841005	EG	On-Demand	Anodyne	DRD4	0	46
CCn1cc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)cn1	ZINC000450841005	EG	On-Demand	Anodyne	SLC18A3	0	43
CCn1cc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)cn1	ZINC000450841005	EG	On-Demand	Anodyne	CYP2J2	51	36
COc1ccc(F)c(N2CCN(CC3(C#N)CCC3)CC2)c1	ZINC000450841007	DF	On-Demand	Mild	DRD4	41	31
COC(=O)c1cc(OCCCCCC(C)=O)ccc1[N+](=O)[O-]	ZINC000450841014	DF	On-Demand	Bother	P2RY12	25	41
COC(=O)c1cc(OCCCCCC(C)=O)ccc1[N+](=O)[O-]	ZINC000450841014	DF	On-Demand	Bother	PLA2G4B	55	40
CCN(CC)CCOCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450841027	EE	On-Demand	Anodyne	P2RY12	61	34
CCN(CC)CCOCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450841027	EE	On-Demand	Anodyne	CTSV	44	31
CCN(CC)CCOCCNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450841027	EE	On-Demand	Anodyne	AGER	0	50
CCC(C)(C)OCc1ccccc1NC(=O)c1c[nH]c2nccc-2c1	ZINC000450841033	EI	On-Demand	Anodyne	SMO	19	44
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1Cc1nc(C(=O)OC)co1	ZINC000450841051	FF	On-Demand	Anodyne	SLC12A5	86	48
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1Cc1nc(C(=O)OC)co1	ZINC000450841052	FF	On-Demand	Anodyne	SLC12A5	86	48
CC(=O)c1cccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)c1	ZINC000450841148	GI	On-Demand	Anodyne	S1PR4	16	40
COc1cc(Cn2nnc([C@H](NC(=O)c3ccccc3)C(C)C)n2)ccc1Cl	ZINC000450841217	GH	On-Demand	Anodyne	SOAT1	21	43
COc1cc(Cn2nnc([C@@H](NC(=O)c3ccccc3)C(C)C)n2)ccc1Cl	ZINC000450841218	GH	On-Demand	Anodyne	SOAT1	21	43
CO[C@H]1CN(Cc2ccccc2OC2CC2)C[C@@H]1OC	ZINC000450841241	CE	On-Demand	Anodyne	SLC5A4	44	31
CO[C@@H]1CN(Cc2ccccc2OC2CC2)C[C@H]1OC	ZINC000450841243	CE	On-Demand	Anodyne	SLC5A4	44	31
COc1cc2c(N3CCCC[C@H]3C(=O)NCC(F)F)ncnc2cc1F	ZINC000450841244	FF	On-Demand	Anodyne	PDE3A	46	36
COc1cc2c(N3CCCC[C@H]3C(=O)NCC(F)F)ncnc2cc1F	ZINC000450841244	FF	On-Demand	Anodyne	PDGFRB	69	41
COc1cc2c(N3CCCC[C@H]3C(=O)NCC(F)F)ncnc2cc1F	ZINC000450841244	FF	On-Demand	Anodyne	PDE3B	68	35
CCN(CC)CCNC(=O)c1ccc(OCc2cccc(C(C)=O)c2)cc1	ZINC000450841254	FH	On-Demand	Anodyne	DRD4	41	31
CCN(CC)CCNC(=O)c1ccc(OCc2cccc(C(C)=O)c2)cc1	ZINC000450841254	FH	On-Demand	Anodyne	KCNQ1	0	57
CCN(CC)CCNC(=O)c1ccc(OCc2cccc(C(C)=O)c2)cc1	ZINC000450841254	FH	On-Demand	Anodyne	GYS1	21	41
Cc1nccc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450841259	CD	On-Demand	Anodyne	ERG	0	40
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450841274	GD	On-Demand	Bother	BCL2L1	42	35
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450841276	GD	On-Demand	Bother	BCL2L1	42	35
O=C(NCC(=O)N1CCN2CCOC[C@@H]2C1)Nc1cccc(Cl)c1	ZINC000450841292	FD	On-Demand	Anodyne	CASR	0	44
O=C(NCC(=O)N1CCN2CCOC[C@@H]2C1)Nc1cccc(Cl)c1	ZINC000450841292	FD	On-Demand	Anodyne	EPHX2	32	46
Cc1cc(C(F)(F)F)nc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450841300	FF	On-Demand	Anodyne	GPBAR1	0	41
Cc1cc(C(F)(F)F)nc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450841300	FF	On-Demand	Anodyne	WNT3	45	33
Cc1cc(C(F)(F)F)nc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450841300	FF	On-Demand	Anodyne	ERG	0	41
CCCc1cc(C(=O)N2CCC[C@@H](C)c3ccccc32)no1	ZINC000450841305	CI	On-Demand	Anodyne	AVPR2	25	41
CCCc1cc(C(=O)N2CCC[C@H](C)c3ccccc32)no1	ZINC000450841306	CI	On-Demand	Anodyne	AVPR2	25	41
O=C(NCC(=O)N1CCN2CCOC[C@H]2C1)Nc1cccc(Cl)c1	ZINC000450841308	FD	On-Demand	Anodyne	CASR	0	44
O=C(NCC(=O)N1CCN2CCOC[C@H]2C1)Nc1cccc(Cl)c1	ZINC000450841308	FD	On-Demand	Anodyne	EPHX2	32	46
CCC1(CNc2cc(OC)ccc2[N+](=O)[O-])COC1	ZINC000450841310	CE	On-Demand	Bother	TAAR1	17	40
C[C@@H](Cc1cnn(C)c1)Nc1ccc(C#N)cc1Br	ZINC000450841328	DG	On-Demand	Mild	BAZ2B	0	40
C[C@@H](Cc1cnn(C)c1)Nc1ccc(C#N)cc1Br	ZINC000450841328	DG	On-Demand	Mild	BAZ2A	0	40
C[C@H](Cc1cnn(C)c1)Nc1ccc(C#N)cc1Br	ZINC000450841331	DG	On-Demand	Mild	BAZ2B	0	40
C[C@H](Cc1cnn(C)c1)Nc1ccc(C#N)cc1Br	ZINC000450841331	DG	On-Demand	Mild	BAZ2A	0	40
Cc1cc(NCc2nn(C)cc2I)n2ncnc2n1	ZINC000450841341	FD	On-Demand	Anodyne	DHOD	0	52
CCC1(CN=c2c([N+](=O)[O-])c[nH]c3ccccc23)COC1	ZINC000450841380	CE	On-Demand	Bother	NMBR	61	33
CCS(=O)(=O)c1ccc(CS[C@H](C)CC(=O)OC)cc1	ZINC000450841382	DF	On-Demand	Anodyne	RORC	42	33
CCS(=O)(=O)c1ccc(CS[C@@H](C)CC(=O)OC)cc1	ZINC000450841386	DF	On-Demand	Anodyne	RORC	42	33
COc1ccc(C[C@@H](CO)CNc2ncc(Cl)cn2)cc1Br	ZINC000450841392	GF	On-Demand	Anodyne	P2RX2	59	43
COc1ccc(C[C@@H](CO)CNc2ncc(Cl)cn2)cc1Br	ZINC000450841392	GF	On-Demand	Anodyne	P2RX3	47	43
COc1ccc(C[C@H](CO)CNc2ncc(Cl)cn2)cc1Br	ZINC000450841393	GF	On-Demand	Anodyne	P2RX2	59	43
COc1ccc(C[C@H](CO)CNc2ncc(Cl)cn2)cc1Br	ZINC000450841393	GF	On-Demand	Anodyne	P2RX3	47	43
O=C(NCC(F)F)[C@@H]1CCCCN1c1ccnc(C2CC2)n1	ZINC000450841405	DE	On-Demand	Anodyne	NOS2	20	40
Cc1csc(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)c1	ZINC000450841417	EG	On-Demand	Anodyne	CACNA1I	40	34
Cc1csc(C(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)c1	ZINC000450841418	EG	On-Demand	Anodyne	CACNA1I	40	34
COC(=O)CCN(CC[C@@H](C)O)Cc1cccc(Br)c1	ZINC000450841470	EF	On-Demand	Anodyne	PTGES	0	46
COC(=O)CCN(CC[C@H](C)O)Cc1cccc(Br)c1	ZINC000450841471	EF	On-Demand	Anodyne	PTGES	0	46
CCC1(CNc2ccc(C#N)c(C(F)(F)F)c2)COC1	ZINC000450841486	CG	On-Demand	Mild	AR	56	41
COC(=O)c1coc(Cn2nnc(C3(NC(=O)c4ccccc4)CCCC3)n2)n1	ZINC000450841505	GD	On-Demand	Anodyne	NPPA	43	37
COc1ccccc1CS[C@H]1CC[C@H](C#N)C1	ZINC000450841546	BH	On-Demand	Mild	QRFPR	43	39
COc1ccccc1CS[C@@H]1CC[C@@H](C#N)C1	ZINC000450841547	BH	On-Demand	Mild	QRFPR	43	39
COc1ccccc1CS[C@@H]1CC[C@H](C#N)C1	ZINC000450841548	BH	On-Demand	Mild	QRFPR	43	39
COc1ccccc1CS[C@H]1CC[C@@H](C#N)C1	ZINC000450841549	BH	On-Demand	Mild	QRFPR	43	39
C=CC[C@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450841558	CD	On-Demand	Mild	CTSV	49	34
C=CC[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450841559	CD	On-Demand	Mild	CTSV	49	34
C[C@H]1CCCN(C(=O)c2cc3n(n2)CCCC3)c2ccccc21	ZINC000450841576	DH	On-Demand	Anodyne	AVPR2	46	40
C[C@@H]1CCCN(C(=O)c2cc3n(n2)CCCC3)c2ccccc21	ZINC000450841577	DH	On-Demand	Anodyne	AVPR2	37	40
CCC1(CNc2ccc(C(=O)NC)cc2[N+](=O)[O-])COC1	ZINC000450841585	CD	On-Demand	Bother	DRTS_TOXGO	15	44
CCC1(CNc2ccc(C(=O)NC)cc2[N+](=O)[O-])COC1	ZINC000450841585	CD	On-Demand	Bother	TAAR1	19	48
COC(=O)c1ccc(CN[C@H]2CCC[C@@H]2C)cc1Cl	ZINC000450841605	CG	On-Demand	Anodyne	SSTR3	0	49
COC(=O)c1ccc(CN[C@@H]2CCC[C@@H]2C)cc1Cl	ZINC000450841606	CG	On-Demand	Anodyne	SSTR3	0	49
COC(=O)c1ccc(CN[C@@H]2CCC[C@H]2C)cc1Cl	ZINC000450841607	CG	On-Demand	Anodyne	SSTR3	0	49
COC(=O)c1ccc(CN[C@H]2CCC[C@H]2C)cc1Cl	ZINC000450841608	CG	On-Demand	Anodyne	SSTR3	0	49
CC(=O)c1cccc(Cn2nnc([C@@H](NC(=O)c3ccccc3)C(C)C)n2)c1	ZINC000450841625	GG	On-Demand	Anodyne	SOAT1	17	45
COc1ccc(F)c(N2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450841636	EE	On-Demand	Anodyne	ADRB1	20	47
COc1ccc(F)c(N2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450841636	EE	On-Demand	Anodyne	DRD1	15	42
COc1ccc(F)c(N2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450841636	EE	On-Demand	Anodyne	DRD3	16	47
CCC1(CNc2cnn(Cc3ccccc3)c(=O)c2Cl)COC1	ZINC000450841648	EF	On-Demand	Anodyne	NPBWR1	43	42
CCC[C@H]1CCCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450841665	CG	On-Demand	Anodyne	HPGDS	15	43
CCC[C@@H]1CCCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450841666	CG	On-Demand	Anodyne	HPGDS	15	43
CCc1ccc(OCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450841667	CH	On-Demand	Bother	S1PR4	17	42
O=C(NC[C@@H]1CCc2nccn2C1)c1ccnc(OC(F)F)c1	ZINC000450841669	DD	On-Demand	Anodyne	CACNA1I	43	34
O=C(NC[C@H]1CCc2nccn2C1)c1ccnc(OC(F)F)c1	ZINC000450841670	DD	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCC(F)F)[C@@H]1CCCCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450841697	GG	On-Demand	Bother	LIPG	41	31
Cc1cc(OCc2ccccc2)nc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450841701	GG	On-Demand	Anodyne	FKBP1A	49	38
COc1ccc(CC(=O)N[C@]2(CO)CCOC2)c(Cl)c1OC	ZINC000450841720	ED	On-Demand	Anodyne	PDE6A	40	31
COc1ccc(CC(=O)N[C@@]2(CO)CCOC2)c(Cl)c1OC	ZINC000450841722	ED	On-Demand	Anodyne	PDE6A	40	31
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450841727	FF	On-Demand	Anodyne	RBP4	17	44
CCN(CC)CCNC(=O)c1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450841729	EF	On-Demand	Anodyne	KCNQ1	0	53
CCN(CC)CCNC(=O)c1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450841731	EF	On-Demand	Anodyne	KCNQ1	0	53
COCCN(C)S(=O)(=O)[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450841734	FE	On-Demand	Anodyne	SLC6A1	119	36
COCCN(C)S(=O)(=O)[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450841735	FE	On-Demand	Anodyne	SLC6A1	119	36
COCCN(C)S(=O)(=O)[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450841736	FE	On-Demand	Anodyne	SLC6A1	119	36
COCCN(C)S(=O)(=O)[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450841737	FE	On-Demand	Anodyne	SLC6A1	119	36
O=C(Cc1ccccc1O[C@H]1CCOC1)NC1(Cc2ccccc2)CCCC1	ZINC000450841750	GI	On-Demand	Anodyne	PDE4D	15	43
O=C(Cc1ccccc1O[C@H]1CCOC1)NC1(Cc2ccccc2)CCCC1	ZINC000450841750	GI	On-Demand	Anodyne	PDEC	0	43
O=C(Cc1ccccc1O[C@@H]1CCOC1)NC1(Cc2ccccc2)CCCC1	ZINC000450841753	GI	On-Demand	Anodyne	PDE4D	15	43
O=C(Cc1ccccc1O[C@@H]1CCOC1)NC1(Cc2ccccc2)CCCC1	ZINC000450841753	GI	On-Demand	Anodyne	PDEC	0	43
CCc1nc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n[nH]1	ZINC000450841758	DF	On-Demand	Anodyne	DRD4	34	40
CCc1nc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n[nH]1	ZINC000450841758	DF	On-Demand	Anodyne	AKT2	46	38
CC(C)(C)c1cc(COc2ccccc2NC(=O)COc2ccccc2)no1	ZINC000450841771	GJ	On-Demand	Anodyne	RAF1	19	46
CC(C)(C)c1cc(COc2ccccc2NC(=O)COc2ccccc2)no1	ZINC000450841771	GJ	On-Demand	Anodyne	FLT3	43	40
CCc1ccc(OCCCCCC(C)=O)c([N+](=O)[O-])c1	ZINC000450841779	CH	On-Demand	Bother	THRA	24	52
CCc1ccc(OCCCCCC(C)=O)c([N+](=O)[O-])c1	ZINC000450841779	CH	On-Demand	Bother	THRB	17	52
CCc1ccc(OCCCCCC(C)=O)c([N+](=O)[O-])c1	ZINC000450841779	CH	On-Demand	Bother	PLA2G4B	21	46
CCN(CC)CCOCCNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450841780	EG	On-Demand	Anodyne	AMY2	45	40
CCN(CC)CCOCCNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450841782	EG	On-Demand	Anodyne	AMY2	45	40
CCN(CC)CCOCCNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450841783	EG	On-Demand	Anodyne	AMY2	45	40
CCN(CC)CCOCCNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450841786	EG	On-Demand	Anodyne	AMY2	45	40
C[C@@H]1c2nncn2CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450841793	DE	On-Demand	Anodyne	DRD2	27	41
C[C@@H]1c2nncn2CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450841793	DE	On-Demand	Anodyne	CYP2J2	45	32
C[C@H]1c2nncn2CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450841794	DE	On-Demand	Anodyne	DRD2	27	41
C[C@H]1c2nncn2CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450841794	DE	On-Demand	Anodyne	CYP2J2	45	32
CC(=O)c1cccc(Cn2nnc([C@H](NC(=O)c3ccccc3)C(C)C)n2)c1	ZINC000450841826	GG	On-Demand	Anodyne	SOAT1	17	45
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2CCO)c(OC)c1	ZINC000450841829	FD	On-Demand	Anodyne	NQO2	30	40
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2CCO)c(OC)c1	ZINC000450841829	FD	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2CCO)c(OC)c1	ZINC000450841829	FD	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2CCO)c(OC)c1	ZINC000450841829	FD	On-Demand	Anodyne	MTNR1B	52	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2CCO)c(OC)c1	ZINC000450841830	FD	On-Demand	Anodyne	NQO2	30	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2CCO)c(OC)c1	ZINC000450841830	FD	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2CCO)c(OC)c1	ZINC000450841830	FD	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2CCO)c(OC)c1	ZINC000450841830	FD	On-Demand	Anodyne	MTNR1B	52	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2CCO)c(OC)c1	ZINC000450841831	FD	On-Demand	Anodyne	NQO2	30	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2CCO)c(OC)c1	ZINC000450841831	FD	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2CCO)c(OC)c1	ZINC000450841831	FD	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2CCO)c(OC)c1	ZINC000450841831	FD	On-Demand	Anodyne	MTNR1B	52	37
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2CCO)c(OC)c1	ZINC000450841832	FD	On-Demand	Anodyne	NQO2	30	40
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2CCO)c(OC)c1	ZINC000450841832	FD	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2CCO)c(OC)c1	ZINC000450841832	FD	On-Demand	Anodyne	MTNR1A	65	38
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2CCO)c(OC)c1	ZINC000450841832	FD	On-Demand	Anodyne	MTNR1B	52	37
CO[C@@H](Cc1ccccc1)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450841839	GF	On-Demand	Anodyne	PGC	41	32
CO[C@@H](Cc1ccccc1)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450841839	GF	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450841840	GF	On-Demand	Anodyne	PGC	41	32
CO[C@H](Cc1ccccc1)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450841840	GF	On-Demand	Anodyne	POL	0	40
CC(=O)[C@](C)(O)CN[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1	ZINC000450841849	ED	On-Demand	Anodyne	ADRA1D	40	37
CC(=O)[C@](C)(O)CN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000450841850	ED	On-Demand	Anodyne	ADRA1D	40	37
CC(=O)[C@](C)(O)CN[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000450841851	ED	On-Demand	Anodyne	ADRA1D	40	37
CC(=O)[C@](C)(O)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1	ZINC000450841852	ED	On-Demand	Anodyne	ADRA1D	40	37
Cc1cnc(CCCC(=O)N2CCC[C@H](C)c3ccccc32)o1	ZINC000450841854	DI	On-Demand	Anodyne	PREP	42	35
Cc1cnc(CCCC(=O)N2CCC[C@@H](C)c3ccccc32)o1	ZINC000450841855	DI	On-Demand	Anodyne	PREP	42	35
C[C@@H](O)CCCOc1ccc([N+](=O)[O-])cc1Br	ZINC000450841859	DF	On-Demand	Bother	S1PR4	0	41
C[C@H](O)CCCOc1ccc([N+](=O)[O-])cc1Br	ZINC000450841860	DF	On-Demand	Bother	S1PR4	0	41
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(Cc2cc(C(C)(C)C)on2)n1	ZINC000450841874	GG	On-Demand	Anodyne	FLT3	17	40
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(Cc2cc(C(C)(C)C)on2)n1	ZINC000450841875	GG	On-Demand	Anodyne	FLT3	17	40
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	DRD2	18	40
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	ACHE	28	44
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	HRH1	17	42
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	AVPR1B	42	34
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	HTR4	47	41
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	SIGMAR1	26	43
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	SSTR5	71	42
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	CCR3	24	40
COc1cc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)ccc1Cl	ZINC000450841880	GH	On-Demand	Anodyne	MCHR1	38	43
CCOC(=O)c1sc2ncnc(NCC3(CC)COC3)c2c1C	ZINC000450841917	EG	On-Demand	Anodyne	MKNK2	18	40
CCc1cc(CCCN(CCc2ccccc2)Cc2cccnc2)on1	ZINC000450841961	EI	On-Demand	Anodyne	NR1D1	42	34
CCCc1ncc(CNc2ccc(C(=O)Nc3ccc(C)cc3)cn2)o1	ZINC000450841969	FI	On-Demand	Anodyne	P4HTM	0	46
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	HTR1A	87	48
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	DRD2	73	47
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	DRD1	47	42
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	DRD4	52	47
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	ADRA1D	52	41
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	HTR2A	61	42
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	HTR2C	30	40
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	ADRA1A	46	38
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	DRD3	69	42
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	HTR7	91	47
CCC(=O)CCCN1CCN(c2cc(OC)ccc2F)CC1	ZINC000450841998	DF	On-Demand	Anodyne	AP2S1	0	40
CC(C)c1ccccc1NC(=O)CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000450842007	EH	On-Demand	Anodyne	ACAT	0	42
CC(C)c1ccccc1NC(=O)CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000450842009	EH	On-Demand	Anodyne	ACAT	0	42
CCc1nc(C2CCN(C[C@H](Cc3ccccc3)OC)CC2)n[nH]1	ZINC000450842010	EF	On-Demand	Anodyne	AKT2	41	34
CCc1nc(C2CCN(C[C@@H](Cc3ccccc3)OC)CC2)n[nH]1	ZINC000450842011	EF	On-Demand	Anodyne	AKT2	41	34
CC(C)c1ccccc1NC(=O)CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000450842012	EH	On-Demand	Anodyne	ACAT	0	42
CC(C)c1ccccc1NC(=O)CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000450842015	EH	On-Demand	Anodyne	ACAT	0	42
COC(=O)c1coc(CN(CCc2ccccc2)Cc2cccnc2)n1	ZINC000450842017	FG	On-Demand	Anodyne	FAAH	17	46
CCc1cccc(C(=O)NCCOCCN(CC)CC)n1	ZINC000450842100	CD	On-Demand	Anodyne	PDE5A	22	49
O=C(CCCN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1)c1ccccc1	ZINC000450842108	GI	On-Demand	Anodyne	CYP2J2	55	40
CC(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450842110	EG	On-Demand	Anodyne	DRD4	38	56
CC(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450842110	EG	On-Demand	Anodyne	LTA4H	32	41
CC(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450842110	EG	On-Demand	Anodyne	HRH3	24	59
CC(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450842110	EG	On-Demand	Anodyne	SIGMAR1	35	46
CC(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450842110	EG	On-Demand	Anodyne	ITGA4	47	34
CC(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450842110	EG	On-Demand	Anodyne	PTGDR	44	33
CC(=O)c1ccc(CN2CCO[C@H](COc3ccccc3)C2)cc1	ZINC000450842110	EG	On-Demand	Anodyne	NOD2	40	37
CC(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450842112	EG	On-Demand	Anodyne	DRD4	38	56
CC(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450842112	EG	On-Demand	Anodyne	LTA4H	32	41
CC(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450842112	EG	On-Demand	Anodyne	HRH3	24	59
CC(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450842112	EG	On-Demand	Anodyne	SIGMAR1	35	46
CC(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450842112	EG	On-Demand	Anodyne	ITGA4	47	34
CC(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450842112	EG	On-Demand	Anodyne	PTGDR	44	33
CC(=O)c1ccc(CN2CCO[C@@H](COc3ccccc3)C2)cc1	ZINC000450842112	EG	On-Demand	Anodyne	NOD2	40	37
CC(F)(F)CCSc1nnc(-c2ccccc2Cl)o1	ZINC000450842143	DJ	On-Demand	Anodyne	ALOX15	61	36
CC(F)(F)CCSc1nnc(-c2ccccc2Cl)o1	ZINC000450842143	DJ	On-Demand	Anodyne	TERT	0	40
CC(F)(F)CCSc1nnc(-c2ccccc2Cl)o1	ZINC000450842143	DJ	On-Demand	Anodyne	CPB	0	40
CC(F)(F)CCSc1nnc(-c2ccccc2Cl)o1	ZINC000450842143	DJ	On-Demand	Anodyne	CYP73A16	20	44
CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450842164	EG	On-Demand	Anodyne	SCN9A	0	41
CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450842165	EG	On-Demand	Anodyne	SCN9A	0	41
CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450842166	EG	On-Demand	Anodyne	SCN9A	0	41
CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450842168	EG	On-Demand	Anodyne	SCN9A	0	41
C[C@@H](Cc1cnn(C)c1)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450842169	FG	On-Demand	Anodyne	AVPR2	61	39
C[C@@H](Cc1cnn(C)c1)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450842169	FG	On-Demand	Anodyne	AVPR1A	45	42
C[C@H](Cc1cnn(C)c1)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450842171	FG	On-Demand	Anodyne	AVPR2	61	39
C[C@H](Cc1cnn(C)c1)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450842171	FG	On-Demand	Anodyne	AVPR1A	45	42
COC(=O)C1(CN2CCNC(=O)[C@H]2c2ccc(OC(F)(F)F)cc2)CC1	ZINC000450842172	FE	On-Demand	Anodyne	EPHX2	43	35
COC(=O)C1(CN2CCNC(=O)[C@@H]2c2ccc(OC(F)(F)F)cc2)CC1	ZINC000450842173	FE	On-Demand	Anodyne	EPHX2	43	35
CCC1(CNc2ncccc2OCc2ccccc2)COC1	ZINC000450842199	CG	On-Demand	Anodyne	PPIA	40	48
CNC(=O)[C@H]1CCC[C@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450842206	DE	On-Demand	Anodyne	SSTR3	22	46
CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450842218	DE	On-Demand	Anodyne	SSTR3	22	46
CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450842219	DE	On-Demand	Anodyne	SSTR3	22	46
CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450842220	DE	On-Demand	Anodyne	SSTR3	22	46
CCC[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450842232	EJ	On-Demand	Anodyne	COLA	121	41
CCC[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450842232	EJ	On-Demand	Anodyne	CPT1A	113	41
CCC[C@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450842232	EJ	On-Demand	Anodyne	CPT2	43	34
CCC[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450842233	EJ	On-Demand	Anodyne	COLA	121	41
CCC[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450842233	EJ	On-Demand	Anodyne	CPT1A	113	41
CCC[C@@H]1CCCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450842233	EJ	On-Demand	Anodyne	CPT2	43	34
CCNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450842239	CF	On-Demand	Anodyne	THRA	53	45
CCNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450842239	CF	On-Demand	Anodyne	P2RY12	29	43
CCNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450842239	CF	On-Demand	Anodyne	THRB	28	45
CCNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450842239	CF	On-Demand	Anodyne	KCNQ1	0	55
CCNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450842239	CF	On-Demand	Anodyne	CYSLTR2	45	32
CCNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450842239	CF	On-Demand	Anodyne	SAT1	0	41
CCNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450842239	CF	On-Demand	Anodyne	PLA2G4B	92	45
CCNC(=O)c1ccc(OCCCCCC(C)=O)cc1	ZINC000450842239	CF	On-Demand	Anodyne	ACR	32	41
COc1cc(-c2noc(CSCc3ccccc3OC)n2)ncn1	ZINC000450842246	EF	On-Demand	Anodyne	LUCI_PHOPE	21	40
NC(=O)c1ccc(CCC(=O)NC2(Cc3ccccc3)CCCC2)cc1	ZINC000450842250	FG	On-Demand	Anodyne	VIPR1	22	41
NC(=O)c1ccc(CCC(=O)NC2(Cc3ccccc3)CCCC2)cc1	ZINC000450842250	FG	On-Demand	Anodyne	NPFFR1	49	37
NC(=O)c1ccc(CCC(=O)NC2(Cc3ccccc3)CCCC2)cc1	ZINC000450842250	FG	On-Demand	Anodyne	SLC12A5	46	38
C=CCC1(CNc2cc(C)nc3ncnn23)CCCC1	ZINC000450842259	CF	On-Demand	Mild	DHOD	0	51
CCCN(CCC)S(=O)(=O)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450842267	GD	On-Demand	Anodyne	VACHT_TETCF	0	45
CCCN(CCC)S(=O)(=O)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450842267	GD	On-Demand	Anodyne	ABCB1	61	36
CCOCc1nc(C)c(C(=O)NC[C@H]2CCc3nccn3C2)s1	ZINC000450842268	EE	On-Demand	Anodyne	SCD1	25	42
CCOCc1nc(C)c(C(=O)NC[C@@H]2CCc3nccn3C2)s1	ZINC000450842269	EE	On-Demand	Anodyne	SCD1	25	42
CC(C)OC(C)(C)C(=O)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450842270	EF	On-Demand	Anodyne	CACNA1I	45	34
CC(C)OC(C)(C)C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1	ZINC000450842271	EF	On-Demand	Anodyne	CACNA1I	45	34
Cc1cc(N2CCCC[C@H]2C(=O)NCC(F)F)nc(-c2cccnc2)n1	ZINC000450842277	FF	On-Demand	Anodyne	NOS2	16	40
CCOC(=O)C[C@H](C)SCC[C@@H](C)O	ZINC000450842283	BD	On-Demand	Anodyne	METAP2	0	40
CCOC(=O)C[C@@H](C)SCC[C@H](C)O	ZINC000450842284	BD	On-Demand	Anodyne	METAP2	0	40
CCOC(=O)C[C@H](C)SCC[C@H](C)O	ZINC000450842285	BD	On-Demand	Anodyne	METAP2	0	40
CCOC(=O)C[C@@H](C)SCC[C@@H](C)O	ZINC000450842286	BD	On-Demand	Anodyne	METAP2	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450842299	GG	On-Demand	Anodyne	AMY2	45	31
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450842300	GG	On-Demand	Anodyne	AMY2	45	31
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450842301	GG	On-Demand	Anodyne	AMY2	45	31
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450842302	GG	On-Demand	Anodyne	AMY2	45	31
Cc1cc(F)c(CC(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)cc1F	ZINC000450842325	GG	On-Demand	Anodyne	TRPV1	75	34
CCCc1ncc(CNc2ccc(S(=O)(=O)N(CC)CC)cc2[N+](=O)[O-])o1	ZINC000450842349	GG	On-Demand	Bother	BDKRB1	21	41
COc1ccc(CNC(=O)CCN[C@@]2(C)CCO[C@@H]2C)c(OC)c1	ZINC000450842363	ED	On-Demand	Anodyne	MTNR1A	49	39
COc1ccc(CNC(=O)CCN[C@]2(C)CCO[C@@H]2C)c(OC)c1	ZINC000450842366	ED	On-Demand	Anodyne	MTNR1A	49	39
COc1ccc(CNC(=O)CCN[C@]2(C)CCO[C@H]2C)c(OC)c1	ZINC000450842368	ED	On-Demand	Anodyne	MTNR1A	49	39
COc1ccc(CNC(=O)CCN[C@@]2(C)CCO[C@H]2C)c(OC)c1	ZINC000450842371	ED	On-Demand	Anodyne	MTNR1A	49	39
CC(C)(C)c1cc(Cn2nnc(C3(NC(=O)c4ccccc4)CCCC3)n2)no1	ZINC000450842422	GG	On-Demand	Anodyne	FLT3	20	40
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CC(N)=O)nc2)c1	ZINC000450842425	EE	On-Demand	Anodyne	RAF1	27	41
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CC(N)=O)nc2)c1	ZINC000450842425	EE	On-Demand	Anodyne	MTNR1A	22	42
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CC(N)=O)nc2)c1	ZINC000450842425	EE	On-Demand	Anodyne	MTNR1B	24	42
C[C@@H](O)CCOc1ccc([N+](=O)[O-])cc1Br	ZINC000450842442	CF	On-Demand	Bother	S1PR4	0	42
C[C@H](O)CCOc1ccc([N+](=O)[O-])cc1Br	ZINC000450842446	CF	On-Demand	Bother	S1PR4	0	42
CC(=O)c1cccc(CN2CC[C@@H](C)C(F)(F)C2)c1	ZINC000450842481	CG	On-Demand	Anodyne	ACHE	16	41
CC(=O)c1cccc(CN2CC[C@@H](C)C(F)(F)C2)c1	ZINC000450842481	CG	On-Demand	Anodyne	CHRM3	23	41
CC(=O)c1cccc(CN2CC[C@H](C)C(F)(F)C2)c1	ZINC000450842482	CG	On-Demand	Anodyne	ACHE	16	41
CC(=O)c1cccc(CN2CC[C@H](C)C(F)(F)C2)c1	ZINC000450842482	CG	On-Demand	Anodyne	CHRM3	23	41
CCc1ncc(CNc2ccc(S(=O)(=O)N(CC)CC)cc2[N+](=O)[O-])o1	ZINC000450842484	GF	On-Demand	Bother	BDKRB1	22	42
CCOC(=O)c1ccc(CN2CC[C@@H](C)C(F)(F)C2)nc1	ZINC000450842505	CF	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CC[C@H](C)C(F)(F)C2)nc1	ZINC000450842506	CF	On-Demand	Anodyne	SSTR5	42	35
C[C@@H](Cc1cnn(C)c1)Nc1ncccc1OCc1ccccc1	ZINC000450842563	DG	On-Demand	Anodyne	PPIA	38	46
C[C@H](Cc1cnn(C)c1)Nc1ncccc1OCc1ccccc1	ZINC000450842564	DG	On-Demand	Anodyne	PPIA	38	46
CC(C)CCCC(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450842573	CK	On-Demand	Anodyne	ACAT	0	42
COc1ccc(F)c(N2CCN(C[C@](C)(O)C(C)=O)CC2)c1	ZINC000450842594	DD	On-Demand	Anodyne	DRD4	46	36
COc1ccc(F)c(N2CCN(C[C@@](C)(O)C(C)=O)CC2)c1	ZINC000450842595	DD	On-Demand	Anodyne	DRD4	46	36
COc1ccccc1-c1nc(C2CCN(CC[C@@H](C)O)CC2)no1	ZINC000450842596	EF	On-Demand	Anodyne	CARM1	57	38
COc1ccccc1-c1nc(C2CCN(CC[C@@H](C)O)CC2)no1	ZINC000450842596	EF	On-Demand	Anodyne	LUCI_PHOPE	31	40
COc1ccccc1-c1nc(C2CCN(CC[C@H](C)O)CC2)no1	ZINC000450842597	EF	On-Demand	Anodyne	CARM1	57	38
COc1ccccc1-c1nc(C2CCN(CC[C@H](C)O)CC2)no1	ZINC000450842597	EF	On-Demand	Anodyne	LUCI_PHOPE	31	40
COC(=O)[C@@H](C)N(Cc1ccccc1OC1CC1)C1CCC1	ZINC000450842617	DG	On-Demand	Anodyne	TSPO	15	50
COC(=O)[C@H](C)N(Cc1ccccc1OC1CC1)C1CCC1	ZINC000450842618	DG	On-Demand	Anodyne	TSPO	15	50
Cc1cc(F)c(CC(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)cc1F	ZINC000450842626	GG	On-Demand	Anodyne	TRPV1	75	34
COC(=O)c1csc(CN2CCC(N(C)CC(=O)OC(C)(C)C)CC2)n1	ZINC000450842636	GE	On-Demand	Anodyne	TRPC6	45	33
CO[C@@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842644	GG	On-Demand	Anodyne	CTRA_BOVIN	17	42
CO[C@@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842644	GG	On-Demand	Anodyne	FCER2	44	35
CO[C@@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842644	GG	On-Demand	Anodyne	CTRB1	42	39
CO[C@@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842644	GG	On-Demand	Anodyne	CAPNS1	46	31
CO[C@@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842644	GG	On-Demand	Anodyne	SOAT1	16	44
CO[C@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842645	GG	On-Demand	Anodyne	CTRA_BOVIN	17	42
CO[C@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842645	GG	On-Demand	Anodyne	FCER2	44	35
CO[C@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842645	GG	On-Demand	Anodyne	CTRB1	42	39
CO[C@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842645	GG	On-Demand	Anodyne	CAPNS1	46	31
CO[C@H](Cc1ccccc1)Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842645	GG	On-Demand	Anodyne	SOAT1	16	44
CO[C@@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842646	GG	On-Demand	Anodyne	CTRA_BOVIN	17	42
CO[C@@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842646	GG	On-Demand	Anodyne	FCER2	44	35
CO[C@@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842646	GG	On-Demand	Anodyne	CTRB1	42	39
CO[C@@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842646	GG	On-Demand	Anodyne	CAPNS1	46	31
CO[C@@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842646	GG	On-Demand	Anodyne	SOAT1	16	44
CO[C@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842647	GG	On-Demand	Anodyne	CTRA_BOVIN	17	42
CO[C@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842647	GG	On-Demand	Anodyne	FCER2	44	35
CO[C@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842647	GG	On-Demand	Anodyne	CTRB1	42	39
CO[C@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842647	GG	On-Demand	Anodyne	CAPNS1	46	31
CO[C@H](Cc1ccccc1)Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450842647	GG	On-Demand	Anodyne	SOAT1	16	44
CNC(=O)[C@@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450842648	FD	On-Demand	Anodyne	MTNR1A	65	39
CNC(=O)[C@@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450842648	FD	On-Demand	Anodyne	MTNR1B	50	36
CNC(=O)[C@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450842649	FD	On-Demand	Anodyne	MTNR1A	65	39
CNC(=O)[C@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450842649	FD	On-Demand	Anodyne	MTNR1B	50	36
CNC(=O)[C@@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450842650	FD	On-Demand	Anodyne	MTNR1A	65	39
CNC(=O)[C@@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450842650	FD	On-Demand	Anodyne	MTNR1B	50	36
CNC(=O)[C@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450842651	FD	On-Demand	Anodyne	MTNR1A	65	39
CNC(=O)[C@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450842651	FD	On-Demand	Anodyne	MTNR1B	50	36
CCC1(CNc2ccnc3cc(Br)ccc23)COC1	ZINC000450842652	DH	On-Demand	Anodyne	HRP1_PLAFA	60	32
CCC1(CNc2ccnc3cc(Br)ccc23)COC1	ZINC000450842652	DH	On-Demand	Anodyne	HNMT	48	34
CCC1(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])COC1	ZINC000450842653	DE	On-Demand	Bother	TAAR1	18	45
CO[C@H](Cc1ccccc1)Cn1nnc(CN(C)C(=O)c2ccccc2)n1	ZINC000450842668	FE	On-Demand	Anodyne	FCER2	44	34
CO[C@H](Cc1ccccc1)Cn1nnc(CN(C)C(=O)c2ccccc2)n1	ZINC000450842668	FE	On-Demand	Anodyne	CAPNS1	43	30
CO[C@@H](Cc1ccccc1)Cn1nnc(CN(C)C(=O)c2ccccc2)n1	ZINC000450842671	FE	On-Demand	Anodyne	FCER2	44	34
CO[C@@H](Cc1ccccc1)Cn1nnc(CN(C)C(=O)c2ccccc2)n1	ZINC000450842671	FE	On-Demand	Anodyne	CAPNS1	43	30
COc1ccc(Cc2nnc(SCc3ccc(C(C)=O)cc3)o2)cc1OC	ZINC000450842706	GI	On-Demand	Anodyne	GSK3A	31	42
COc1ccc(Cc2nnc(SCc3ccc(C(C)=O)cc3)o2)cc1OC	ZINC000450842706	GI	On-Demand	Anodyne	PTK2	0	42
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1Br	ZINC000450842709	EH	On-Demand	Bother	THRA	25	43
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1Br	ZINC000450842709	EH	On-Demand	Bother	S1PR4	0	40
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1Br	ZINC000450842709	EH	On-Demand	Bother	ACR	30	42
CCC1(CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])COC1	ZINC000450842721	FH	On-Demand	Bother	TAAR1	26	53
Cn1nc(-c2ccccc2)cc1C(=O)NC(C)(C)CC(N)=O	ZINC000450842722	DD	On-Demand	Anodyne	CTSV	49	34
CC(F)(F)c1ccc(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)cn1	ZINC000450842724	GG	On-Demand	Anodyne	CACNA1I	59	37
CC(F)(F)c1ccc(C(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)cn1	ZINC000450842725	GG	On-Demand	Anodyne	CACNA1I	59	37
O=C(NCC(F)F)[C@@H]1CCCCN1c1ccc(C(F)(F)F)cn1	ZINC000450842740	EF	On-Demand	Anodyne	CNR2	16	58
CC(C)c1cnc(S[C@H](C)C(=O)Nc2nccs2)n1C(C)C	ZINC000450842780	EI	On-Demand	Anodyne	MAP	0	41
CC(C)c1cnc(S[C@H](C)C(=O)Nc2nccs2)n1C(C)C	ZINC000450842780	EI	On-Demand	Anodyne	MAP1	93	37
COC(=O)C1(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)CC1	ZINC000450842786	FG	On-Demand	Anodyne	COLA	46	37
CNC(=O)C[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450842787	CD	On-Demand	Anodyne	ADORA1	44	46
CNC(=O)C[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450842787	CD	On-Demand	Anodyne	ADCY5	29	43
CNC(=O)C[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450842787	CD	On-Demand	Anodyne	ADORA3	78	42
CNC(=O)C[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450842787	CD	On-Demand	Anodyne	OXGR1	83	35
CC(C)c1cnc(S[C@@H](C)C(=O)Nc2nccs2)n1C(C)C	ZINC000450842788	EI	On-Demand	Anodyne	MAP	0	41
CC(C)c1cnc(S[C@@H](C)C(=O)Nc2nccs2)n1C(C)C	ZINC000450842788	EI	On-Demand	Anodyne	MAP1	93	37
CNC(=O)C[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450842789	CD	On-Demand	Anodyne	ADORA1	44	46
CNC(=O)C[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450842789	CD	On-Demand	Anodyne	ADCY5	29	43
CNC(=O)C[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450842789	CD	On-Demand	Anodyne	ADORA3	78	42
CNC(=O)C[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000450842789	CD	On-Demand	Anodyne	OXGR1	83	35
O=C(CCCN1CC(=O)N(CC(F)(F)F)C1)c1ccccc1	ZINC000450842792	DE	On-Demand	Anodyne	DRD2	31	42
O=C(CCCN1CC(=O)N(CC(F)(F)F)C1)c1ccccc1	ZINC000450842792	DE	On-Demand	Anodyne	CYP2J2	59	42
CCC1(CNc2ncc([N+](=O)[O-])c(C)n2)COC1	ZINC000450842793	CD	On-Demand	Bother	PRKCQ	41	35
CCn1nnc(C)c1CSc1nnc(Cc2ccc(OC)c(OC)c2)o1	ZINC000450842820	GF	On-Demand	Anodyne	PTK2	24	43
N#Cc1c(F)cccc1N1CCCC[C@H]1C(=O)NCC(F)F	ZINC000450842848	DE	On-Demand	Mild	LGMN	43	34
CCc1ncc(CNc2ccc(C#N)c(C(F)(F)F)c2)o1	ZINC000450842862	CH	On-Demand	Mild	AR	46	40
CNC(=O)C[C@@H](C)N=c1[nH]c2ccccc2cc1[N+](=O)[O-]	ZINC000450842870	CD	On-Demand	Bother	COLA	42	30
CCCc1ncc(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)o1	ZINC000450842871	EI	On-Demand	Bother	AADAC	0	44
Oc1nccc2c1CN(CC/C=C/c1ccccc1)CC2	ZINC000450842873	CG	On-Demand	Anodyne	SLC6A5	20	40
Oc1nccc2c1CN(CC/C=C\c1ccccc1)CC2	ZINC000450842874	CG	On-Demand	Anodyne	SLC6A5	20	40
FC1(F)CC(CSc2nnc(-c3cccc4ccccc34)o2)C1	ZINC000450842898	EK	On-Demand	Anodyne	ALOX15	67	46
CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450842916	FG	On-Demand	Anodyne	CCR2	44	35
COc1ccc(F)c(N2CCN(CC[C@@H](C)O)CC2)c1	ZINC000450842928	CD	On-Demand	Anodyne	HTR1A	48	44
COc1ccc(F)c(N2CCN(CC[C@@H](C)O)CC2)c1	ZINC000450842928	CD	On-Demand	Anodyne	DRD2	42	42
COc1ccc(F)c(N2CCN(CC[C@@H](C)O)CC2)c1	ZINC000450842928	CD	On-Demand	Anodyne	DRD4	49	38
COc1ccc(F)c(N2CCN(CC[C@@H](C)O)CC2)c1	ZINC000450842928	CD	On-Demand	Anodyne	HTR2A	24	41
COc1ccc(F)c(N2CCN(CC[C@@H](C)O)CC2)c1	ZINC000450842928	CD	On-Demand	Anodyne	DRD3	41	37
COc1ccc(F)c(N2CCN(CC[C@H](C)O)CC2)c1	ZINC000450842929	CD	On-Demand	Anodyne	HTR1A	48	44
COc1ccc(F)c(N2CCN(CC[C@H](C)O)CC2)c1	ZINC000450842929	CD	On-Demand	Anodyne	DRD2	42	42
COc1ccc(F)c(N2CCN(CC[C@H](C)O)CC2)c1	ZINC000450842929	CD	On-Demand	Anodyne	DRD4	49	38
COc1ccc(F)c(N2CCN(CC[C@H](C)O)CC2)c1	ZINC000450842929	CD	On-Demand	Anodyne	HTR2A	24	41
COc1ccc(F)c(N2CCN(CC[C@H](C)O)CC2)c1	ZINC000450842929	CD	On-Demand	Anodyne	DRD3	41	37
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450842930	EK	On-Demand	Anodyne	G2YM83_BOTF4	46	34
COC(=O)[C@H](C)N(C[C@@H](O)[C@@H](C)c1ccccc1)C1CCC1	ZINC000450842942	DF	On-Demand	Anodyne	AMY2	45	32
COC(=O)[C@H](C)N(C[C@@H](O)[C@H](C)c1ccccc1)C1CCC1	ZINC000450842943	DF	On-Demand	Anodyne	AMY2	45	32
COC(=O)[C@H](C)N(C[C@H](O)[C@H](C)c1ccccc1)C1CCC1	ZINC000450842944	DF	On-Demand	Anodyne	AMY2	45	32
COC(=O)[C@H](C)N(C[C@H](O)[C@@H](C)c1ccccc1)C1CCC1	ZINC000450842945	DF	On-Demand	Anodyne	AMY2	45	32
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)[S@@]1=O	ZINC000450842964	CE	On-Demand	Anodyne	DRD2	30	42
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)[S@@]1=O	ZINC000450842964	CE	On-Demand	Anodyne	DRD4	0	50
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)[S@@]1=O	ZINC000450842964	CE	On-Demand	Anodyne	SLC6A1	44	34
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)[S@@]1=O	ZINC000450842964	CE	On-Demand	Anodyne	CHRNA4	0	53
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)[S@@]1=O	ZINC000450842964	CE	On-Demand	Anodyne	SLC18A3	0	42
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)[S@@]1=O	ZINC000450842964	CE	On-Demand	Anodyne	CYP2J2	65	45
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@H](C)S1=O	ZINC000450842965	CE	On-Demand	Anodyne	DRD2	30	42
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@H](C)S1=O	ZINC000450842965	CE	On-Demand	Anodyne	DRD4	0	50
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@H](C)S1=O	ZINC000450842965	CE	On-Demand	Anodyne	SLC6A1	44	34
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@H](C)S1=O	ZINC000450842965	CE	On-Demand	Anodyne	CHRNA4	0	53
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@H](C)S1=O	ZINC000450842965	CE	On-Demand	Anodyne	SLC18A3	0	42
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@H](C)S1=O	ZINC000450842965	CE	On-Demand	Anodyne	CYP2J2	65	45
C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)S1=O	ZINC000450842966	CE	On-Demand	Anodyne	DRD2	30	42
C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)S1=O	ZINC000450842966	CE	On-Demand	Anodyne	DRD4	0	50
C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)S1=O	ZINC000450842966	CE	On-Demand	Anodyne	SLC6A1	44	34
C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)S1=O	ZINC000450842966	CE	On-Demand	Anodyne	CHRNA4	0	53
C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)S1=O	ZINC000450842966	CE	On-Demand	Anodyne	SLC18A3	0	42
C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@H](C)S1=O	ZINC000450842966	CE	On-Demand	Anodyne	CYP2J2	65	45
CCC1(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)COC1	ZINC000450843043	ED	On-Demand	Anodyne	NPY2R	47	34
C[C@H](O)CCCN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000450843097	DD	On-Demand	Anodyne	ADRA1D	49	37
C[C@H](O)CCCN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000450843097	DD	On-Demand	Anodyne	ADRA1A	41	37
C[C@H](O)CCCN[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1	ZINC000450843098	DD	On-Demand	Anodyne	ADRA1D	49	37
C[C@H](O)CCCN[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1	ZINC000450843098	DD	On-Demand	Anodyne	ADRA1A	41	37
C[C@H](O)CCCN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1	ZINC000450843099	DD	On-Demand	Anodyne	ADRA1D	49	37
C[C@H](O)CCCN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1	ZINC000450843099	DD	On-Demand	Anodyne	ADRA1A	41	37
C[C@H](O)CCCN[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000450843100	DD	On-Demand	Anodyne	ADRA1D	49	37
C[C@H](O)CCCN[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000450843100	DD	On-Demand	Anodyne	ADRA1A	41	37
CC(C)c1nnc(CN(CCc2ccccc2)Cc2cccnc2)s1	ZINC000450843132	FI	On-Demand	Anodyne	NR1D1	46	37
CCCc1cc(NCc2cnc(CCC)o2)n2ncnc2n1	ZINC000450843139	DF	On-Demand	Anodyne	DHOD	0	43
CNC(=O)C[C@H](C)N=c1[nH]c2ccccc2cc1[N+](=O)[O-]	ZINC000450843195	CD	On-Demand	Bother	COLA	42	30
N#C[C@@H](CCc1ccccc1)C(=O)N[C@@]1(CO)CCOC1	ZINC000450843197	CD	On-Demand	Mild	CTSS	18	40
N#C[C@H](CCc1ccccc1)C(=O)N[C@@]1(CO)CCOC1	ZINC000450843200	CD	On-Demand	Mild	CTSS	18	40
N#C[C@H](CCc1ccccc1)C(=O)N[C@]1(CO)CCOC1	ZINC000450843201	CD	On-Demand	Mild	CTSS	18	40
N#C[C@@H](CCc1ccccc1)C(=O)N[C@]1(CO)CCOC1	ZINC000450843202	CD	On-Demand	Mild	CTSS	18	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H]1CCc2nccn2C1	ZINC000450843212	EG	On-Demand	Anodyne	CCR2	45	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@H]1CCc2nccn2C1	ZINC000450843212	EG	On-Demand	Anodyne	LIPG	43	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCc2nccn2C1	ZINC000450843214	EG	On-Demand	Anodyne	CCR2	45	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCc2nccn2C1	ZINC000450843214	EG	On-Demand	Anodyne	LIPG	43	35
CCc1ncc(CNc2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])o1	ZINC000450843224	GE	On-Demand	Bother	TAAR1	15	41
CCc1ncc(CNc2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])o1	ZINC000450843226	GE	On-Demand	Bother	TAAR1	15	41
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)CCN1C	ZINC000450843230	FH	On-Demand	Anodyne	CYP2J2	54	39
CC(C)[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)CCN1C	ZINC000450843231	FH	On-Demand	Anodyne	CYP2J2	54	39
CCN(CC)CCNC(=O)c1ccc(O[C@H]2C[C@H](C)CCC2=O)cc1	ZINC000450843249	EF	On-Demand	Anodyne	KCNQ1	0	50
CCN(CC)CCNC(=O)c1ccc(O[C@@H]2C[C@H](C)CCC2=O)cc1	ZINC000450843250	EF	On-Demand	Anodyne	KCNQ1	0	50
CCN(CC)CCNC(=O)c1ccc(O[C@@H]2C[C@@H](C)CCC2=O)cc1	ZINC000450843251	EF	On-Demand	Anodyne	KCNQ1	0	50
CCN(CC)CCNC(=O)c1ccc(O[C@H]2C[C@@H](C)CCC2=O)cc1	ZINC000450843252	EF	On-Demand	Anodyne	KCNQ1	0	50
Cc1cc(CNC(=O)c2ccc(N3CCC3)nc2)ccc1Cl	ZINC000450843260	DG	On-Demand	Anodyne	CXCR3	29	44
Cc1cc(CNC(=O)c2ccc(N3CCC3)nc2)ccc1Cl	ZINC000450843260	DG	On-Demand	Anodyne	NAMPT	44	36
N#Cc1nc(N2CCCC[C@H]2C(=O)NCC(F)F)ccc1Cl	ZINC000450843275	EE	On-Demand	Mild	ERG	0	41
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	HTR1A	22	48
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	DRD1	16	48
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	DRD4	0	48
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	HTR2A	20	48
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	HTR2C	17	48
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	SLC6A1	121	38
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	DRD3	17	48
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	HTR7	28	44
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	SIGMAR1	24	54
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843282	GH	On-Demand	Anodyne	CYP2J2	66	49
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	HTR1A	22	48
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	DRD1	16	48
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	DRD4	0	48
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	HTR2A	20	48
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	HTR2C	17	48
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	SLC6A1	121	38
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	DRD3	17	48
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	HTR7	28	44
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	SIGMAR1	24	54
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450843283	GH	On-Demand	Anodyne	CYP2J2	66	49
Cc1cc(C#N)nc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450843294	DD	On-Demand	Mild	GPBAR1	25	41
C[C@@H]1CCO[C@@H]1C(=O)NC1(Cc2ccccc2)CCCC1	ZINC000450843303	CG	On-Demand	Anodyne	SLC12A5	46	34
COc1ccc(C[C@@H](CO)CNc2ccc(C(N)=O)nn2)cc1Br	ZINC000450843304	GD	On-Demand	Anodyne	TRPV1	33	41
COc1ccc(C[C@H](CO)CNc2ccc(C(N)=O)nn2)cc1Br	ZINC000450843305	GD	On-Demand	Anodyne	TRPV1	33	41
CC(C)OCCNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450843314	CG	On-Demand	Anodyne	LMGT2	0	43
CC(F)(F)c1ccc(C(=O)NC[C@H]2CCc3nccn3C2)cn1	ZINC000450843320	DE	On-Demand	Anodyne	CACNA1I	50	33
CC(F)(F)c1ccc(C(=O)NC[C@@H]2CCc3nccn3C2)cn1	ZINC000450843321	DE	On-Demand	Anodyne	CACNA1I	50	33
C[C@@H]1CSCCN(CCN(C)Cc2ccccc2)C1	ZINC000450843323	CF	On-Demand	Anodyne	SIGMAR1	22	43
C[C@H]1CSCCN(CCN(C)Cc2ccccc2)C1	ZINC000450843324	CF	On-Demand	Anodyne	SIGMAR1	22	43
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2C)c(OC)c1	ZINC000450843340	DE	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@@H]2C)c(OC)c1	ZINC000450843340	DE	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2C)c(OC)c1	ZINC000450843341	DE	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCN[C@H]2CCC[C@H]2C)c(OC)c1	ZINC000450843341	DE	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2C)c(OC)c1	ZINC000450843342	DE	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2C)c(OC)c1	ZINC000450843342	DE	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2C)c(OC)c1	ZINC000450843343	DE	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@@H]2C)c(OC)c1	ZINC000450843343	DE	On-Demand	Anodyne	MTNR1B	46	38
CCOC(=O)c1ccc(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)nc1	ZINC000450843394	EH	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)c1ccc(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)nc1	ZINC000450843394	EH	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1ccc(CN2CC[C@@H](C(F)(F)F)C(C)(C)C2)nc1	ZINC000450843396	EH	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)c1ccc(CN2CC[C@@H](C(F)(F)F)C(C)(C)C2)nc1	ZINC000450843396	EH	On-Demand	Anodyne	SSTR5	42	34
COC(=O)c1coc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)n1	ZINC000450843398	GG	On-Demand	Anodyne	NPPA	33	40
O=C(Nc1cccc(C(F)F)c1Cl)[C@@H]1CCN(c2ccccc2)C1	ZINC000450843420	FJ	On-Demand	Anodyne	KCNQ2	50	35
O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CCN(c2ccccc2)C1	ZINC000450843421	FJ	On-Demand	Anodyne	KCNQ2	50	35
CCc1nc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n[nH]1	ZINC000450843457	EG	On-Demand	Anodyne	DRD2	34	44
CCc1nc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n[nH]1	ZINC000450843457	EG	On-Demand	Anodyne	DRD1	25	49
CCc1nc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n[nH]1	ZINC000450843457	EG	On-Demand	Anodyne	DRD4	0	42
CCc1nc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n[nH]1	ZINC000450843457	EG	On-Demand	Anodyne	HTR2A	39	52
CCc1nc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n[nH]1	ZINC000450843457	EG	On-Demand	Anodyne	HTR2C	26	57
CCc1nc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n[nH]1	ZINC000450843457	EG	On-Demand	Anodyne	SLC18A3	0	45
CCc1nc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n[nH]1	ZINC000450843457	EG	On-Demand	Anodyne	HTR3B	0	47
CCc1nc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n[nH]1	ZINC000450843457	EG	On-Demand	Anodyne	CYP2J2	61	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843466	GF	On-Demand	Anodyne	OPRK1	30	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843466	GF	On-Demand	Anodyne	CCR5	37	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843466	GF	On-Demand	Anodyne	AMY2	45	31
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843468	GF	On-Demand	Anodyne	OPRK1	30	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843468	GF	On-Demand	Anodyne	CCR5	37	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843468	GF	On-Demand	Anodyne	AMY2	45	31
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843471	GF	On-Demand	Anodyne	OPRK1	30	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843471	GF	On-Demand	Anodyne	CCR5	37	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843471	GF	On-Demand	Anodyne	AMY2	45	31
C[C@H](c1ccccc1)[C@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843473	GF	On-Demand	Anodyne	OPRK1	30	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843473	GF	On-Demand	Anodyne	CCR5	37	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000450843473	GF	On-Demand	Anodyne	AMY2	45	31
Cc1cc(C(=O)N2CCC[C@H](C)c3ccccc32)nn1C(C)C	ZINC000450843481	DI	On-Demand	Anodyne	AVPR2	24	44
Cc1cc(C(=O)N2CCC[C@@H](C)c3ccccc32)nn1C(C)C	ZINC000450843488	DI	On-Demand	Anodyne	AVPR2	28	44
Cc1nc(-c2ccccn2)nc(N[C@H](C)Cc2cnn(C)c2)c1C	ZINC000450843496	DE	On-Demand	Anodyne	METAP1	59	41
Cc1nc(-c2ccccn2)nc(N[C@@H](C)Cc2cnn(C)c2)c1C	ZINC000450843497	DE	On-Demand	Anodyne	METAP1	59	41
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1Cc1nc(C(=O)OC)cs1	ZINC000450843503	GG	On-Demand	Anodyne	SLC12A5	86	47
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1Cc1nc(C(=O)OC)cs1	ZINC000450843504	GG	On-Demand	Anodyne	SLC12A5	86	47
CCCc1ncc(CNc2ccc(C(=O)NC)cc2[N+](=O)[O-])o1	ZINC000450843547	DF	On-Demand	Bother	DRTS_TOXGO	15	44
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCO[C@@H]1c1nccn1C	ZINC000450843582	DG	On-Demand	Anodyne	CAPN2	15	41
CCCc1ncc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)o1	ZINC000450843622	FF	On-Demand	Anodyne	LRRK2	28	40
Cc1ccnc(-c2noc(CSc3ncc(C(C)C)n3C(C)C)n2)c1	ZINC000450843624	FJ	On-Demand	Anodyne	TNKS2	15	40
CC(=O)c1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)cc1	ZINC000450843675	FH	On-Demand	Anodyne	KCNQ1	0	41
CC(F)(F)CCOc1ccc([N+](=O)[O-])cc1Br	ZINC000450843684	DH	On-Demand	Bother	S1PR4	0	43
CCC(=O)c1ccc(NCC2(CC)COC2)c([N+](=O)[O-])c1	ZINC000450843710	CG	On-Demand	Bother	TAAR1	17	44
COc1cc(CC(=O)NC[C@H]2CCc3nccn3C2)ccc1Cl	ZINC000450843732	EE	On-Demand	Anodyne	CCR3	22	43
COc1cc(CC(=O)NC[C@@H]2CCc3nccn3C2)ccc1Cl	ZINC000450843733	EE	On-Demand	Anodyne	CCR3	22	43
CNC(=O)C[C@@H](C)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450843734	CD	On-Demand	Anodyne	FLT1	24	43
CNC(=O)C[C@H](C)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450843735	CD	On-Demand	Anodyne	FLT1	24	43
C[C@H](O)CCCOc1ccccc1NC(=O)COc1ccccc1	ZINC000450843748	EG	On-Demand	Anodyne	PLA2G4B	44	32
C[C@@H](O)CCCOc1ccccc1NC(=O)COc1ccccc1	ZINC000450843749	EG	On-Demand	Anodyne	PLA2G4B	44	32
CCC1(CNc2ccc(C(C)=O)cc2[N+](=O)[O-])COC1	ZINC000450843757	CF	On-Demand	Bother	TAAR1	18	48
CNC(=O)C[C@@H](C)Nc1cc(C)c([N+](=O)[O-])cc1C(F)(F)F	ZINC000450843760	DF	On-Demand	Bother	AADAC	0	40
CNC(=O)C[C@H](C)Nc1cc(C)c([N+](=O)[O-])cc1C(F)(F)F	ZINC000450843761	DF	On-Demand	Bother	AADAC	0	40
COc1ccc(CNC(=O)CCN(C)Cc2ccc(F)cc2C)c(OC)c1	ZINC000450843776	FG	On-Demand	Anodyne	GRIN2B	0	43
COc1ccc(CNC(=O)CCN(C)Cc2ccc(F)cc2C)c(OC)c1	ZINC000450843776	FG	On-Demand	Anodyne	P2RX7	41	42
COc1ccc(CNC(=O)CCN(C)Cc2ccc(F)cc2C)c(OC)c1	ZINC000450843776	FG	On-Demand	Anodyne	MTNR1A	45	36
Cc1nc(N2CCCC[C@H]2C(=O)NCC(F)F)ccc1C#N	ZINC000450843785	DE	On-Demand	Mild	NR3C2	31	40
Cc1nc(N2CCCC[C@H]2C(=O)NCC(F)F)ccc1C#N	ZINC000450843785	DE	On-Demand	Mild	GPBAR1	22	40
Cc1nc(N2CCCC[C@H]2C(=O)NCC(F)F)ccc1C#N	ZINC000450843785	DE	On-Demand	Mild	ERG	0	43
COc1ccc(F)c(N2CCN(CCc3cscn3)CC2)c1	ZINC000450843796	DF	On-Demand	Anodyne	DRD4	42	32
COc1ccc(F)c(N2CCN(CCc3cscn3)CC2)c1	ZINC000450843796	DF	On-Demand	Anodyne	ABCC1	71	37
COc1ccccc1-c1nc(C2CCN(Cc3cn(CC4CC4)nn3)CC2)no1	ZINC000450843801	GG	On-Demand	Anodyne	ADRB1	18	41
COc1cccc(OCCC(=O)NCc2ccc3c(c2)C(=O)NCC3)c1	ZINC000450843843	FE	On-Demand	Anodyne	MTNR1A	40	42
COc1cccc(OCCC(=O)NCc2ccc3c(c2)C(=O)NCC3)c1	ZINC000450843843	FE	On-Demand	Anodyne	MTNR1B	43	42
COc1cccc(OCCC(=O)NCc2ccc3c(c2)C(=O)NCC3)c1	ZINC000450843843	FE	On-Demand	Anodyne	ROCK2	40	35
CNC(=O)C[C@@H](C)Nc1ncnc2c(OC)cc(OC)cc12	ZINC000450843851	DD	On-Demand	Anodyne	PDE6A	42	32
CNC(=O)C[C@H](C)Nc1ncnc2c(OC)cc(OC)cc12	ZINC000450843853	DD	On-Demand	Anodyne	PDE6A	42	32
CC(=O)c1ccc(CN2CCC[C@H](N(C)CC(=O)OC(C)(C)C)CC2)cc1	ZINC000450843855	FH	On-Demand	Anodyne	ACHE	17	42
CC(=O)c1ccc(CN2CCC[C@H](N(C)CC(=O)OC(C)(C)C)CC2)cc1	ZINC000450843855	FH	On-Demand	Anodyne	LTA4H	18	49
COC(=O)[C@@H](C)N(Cc1cn(CC2CC2)nn1)C1CCC1	ZINC000450843863	CD	On-Demand	Anodyne	SCARB1	49	35
COC(=O)[C@H](C)N(Cc1cn(CC2CC2)nn1)C1CCC1	ZINC000450843864	CD	On-Demand	Anodyne	SCARB1	49	35
CC(=O)c1ccc(CN2CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC2)cc1	ZINC000450843866	FH	On-Demand	Anodyne	ACHE	17	42
CC(=O)c1ccc(CN2CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC2)cc1	ZINC000450843866	FH	On-Demand	Anodyne	LTA4H	18	49
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1CC[C@@H](C)O	ZINC000450843881	DE	On-Demand	Anodyne	SLC12A5	101	52
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1CC[C@H](C)O	ZINC000450843882	DE	On-Demand	Anodyne	SLC12A5	101	52
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1CC[C@@H](C)O	ZINC000450843883	DE	On-Demand	Anodyne	SLC12A5	101	52
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1CC[C@H](C)O	ZINC000450843885	DE	On-Demand	Anodyne	SLC12A5	101	52
CS[C@H]1CN(C(=O)c2c(C)cccc2Cl)C[C@H]1N1CCCC1	ZINC000450843892	EG	On-Demand	Anodyne	L3MBTL3	51	35
CS[C@H]1CN(C(=O)c2c(C)cccc2Cl)C[C@@H]1N1CCCC1	ZINC000450843893	EG	On-Demand	Anodyne	L3MBTL3	51	35
CS[C@@H]1CN(C(=O)c2c(C)cccc2Cl)C[C@H]1N1CCCC1	ZINC000450843894	EG	On-Demand	Anodyne	L3MBTL3	51	35
CS[C@@H]1CN(C(=O)c2c(C)cccc2Cl)C[C@@H]1N1CCCC1	ZINC000450843895	EG	On-Demand	Anodyne	L3MBTL3	51	35
CCC(=O)c1ccc(NCc2cnc(CC)o2)c(S(N)(=O)=O)c1	ZINC000450843932	EE	On-Demand	Anodyne	CA13	35	42
O=C(Cc1ccc(O)c(F)c1)N[C@H]1CCO[C@@H]1c1cccnc1	ZINC000450843940	DE	On-Demand	Anodyne	CHRNA7	29	44
COc1ccc(CNC(=O)CCN2CCc3ccnc(O)c3C2)c(OC)c1	ZINC000450843955	FD	On-Demand	Anodyne	PDGFRB	34	41
COc1ccc(CNC(=O)CCN2CCc3ccnc(O)c3C2)c(OC)c1	ZINC000450843955	FD	On-Demand	Anodyne	CSF1R	15	41
COc1ccccc1CSCC[C@H](C)O	ZINC000450843975	BF	On-Demand	Anodyne	CACNA2D1	26	64
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CC(N)=O)ccc21	ZINC000450843979	FE	On-Demand	Anodyne	CPT1A	48	33
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CC(N)=O)ccc21	ZINC000450843979	FE	On-Demand	Anodyne	PLK1	65	39
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CC(N)=O)ccc21	ZINC000450843979	FE	On-Demand	Anodyne	HPGD	47	57
COc1ccccc1CSCC[C@@H](C)O	ZINC000450843980	BF	On-Demand	Anodyne	CACNA2D1	26	64
CCn1nnc(C)c1Cn1nnc([C@@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450843983	FD	On-Demand	Anodyne	SOAT1	18	46
CCn1nnc(C)c1Cn1nnc([C@H](NC(=O)c2ccccc2)C(C)C)n1	ZINC000450843988	FD	On-Demand	Anodyne	SOAT1	18	46
COC(=O)c1csc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450843990	GE	On-Demand	Anodyne	ADRA1D	41	35
COC(=O)c1csc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450843990	GE	On-Demand	Anodyne	ADRA1A	40	36
COC(=O)c1csc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450843991	GE	On-Demand	Anodyne	ADRA1D	41	35
COC(=O)c1csc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450843991	GE	On-Demand	Anodyne	ADRA1A	40	36
COC(=O)c1csc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450843993	GE	On-Demand	Anodyne	ADRA1D	41	35
COC(=O)c1csc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450843993	GE	On-Demand	Anodyne	ADRA1A	40	36
COC(=O)c1csc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450843994	GE	On-Demand	Anodyne	ADRA1D	41	35
COC(=O)c1csc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450843994	GE	On-Demand	Anodyne	ADRA1A	40	36
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(CCC(C)(F)F)n1	ZINC000450843996	EF	On-Demand	Anodyne	SOAT1	22	51
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(CCC(C)(F)F)n1	ZINC000450843998	EF	On-Demand	Anodyne	SOAT1	22	51
COC(=O)c1coc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450844015	FD	On-Demand	Anodyne	ADRA1D	43	35
COC(=O)c1coc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450844015	FD	On-Demand	Anodyne	ADRA1A	40	36
COC(=O)c1coc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450844018	FD	On-Demand	Anodyne	ADRA1D	43	35
COC(=O)c1coc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450844018	FD	On-Demand	Anodyne	ADRA1A	40	36
COC(=O)c1coc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450844019	FD	On-Demand	Anodyne	ADRA1D	43	35
COC(=O)c1coc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450844019	FD	On-Demand	Anodyne	ADRA1A	40	36
COC(=O)c1coc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450844020	FD	On-Demand	Anodyne	ADRA1D	43	35
COC(=O)c1coc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450844020	FD	On-Demand	Anodyne	ADRA1A	40	36
C=CCC1(CNc2ncc([N+](=O)[O-])c(C)n2)CCCC1	ZINC000450844021	CG	On-Demand	Mild	PRKCQ	44	35
CC(=O)CCCCCSc1n[nH]c(-c2ccccn2)n1	ZINC000450844042	CG	On-Demand	Anodyne	FAAH	28	43
Oc1nccc2c1CN(CCc1ccc(Cl)cc1)CC2	ZINC000450844083	CG	On-Demand	Anodyne	DHCR7	0	51
CCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)COC1	ZINC000450844098	EC	On-Demand	Anodyne	CA2	51	50
CCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)COC1	ZINC000450844098	EC	On-Demand	Anodyne	CA1	45	40
CCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)COC1	ZINC000450844098	EC	On-Demand	Anodyne	CA7	43	38
CCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)COC1	ZINC000450844098	EC	On-Demand	Anodyne	CA4	45	40
CCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)COC1	ZINC000450844098	EC	On-Demand	Anodyne	CA5A	41	37
CCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)COC1	ZINC000450844098	EC	On-Demand	Anodyne	CA12	23	43
CCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)COC1	ZINC000450844098	EC	On-Demand	Anodyne	CA9	29	43
COc1ccc(CNC(=O)CCN2CC[C@@H](C)C(F)(F)C2)c(OC)c1	ZINC000450844113	FF	On-Demand	Anodyne	MTNR1A	45	35
COc1ccc(CNC(=O)CCN2CC[C@H](C)C(F)(F)C2)c(OC)c1	ZINC000450844114	FF	On-Demand	Anodyne	MTNR1A	45	35
CCCc1ncc(CNc2ccc(C#N)c(C(F)(F)F)c2)o1	ZINC000450844116	DI	On-Demand	Mild	AR	45	43
CCC1(CNc2ccc(C(=O)c3ccccc3C(=O)OC)cc2[N+](=O)[O-])COC1	ZINC000450844133	GG	On-Demand	Bother	TAAR1	21	45
CCC1(CNc2ccnc3cc(C(F)(F)F)ccc23)COC1	ZINC000450844164	DI	On-Demand	Anodyne	HRP1_PLAFA	44	34
CCC1(CNc2ccnc3cc(C(F)(F)F)ccc23)COC1	ZINC000450844164	DI	On-Demand	Anodyne	HNMT	42	32
CCC1(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])COC1	ZINC000450844213	DF	On-Demand	Bother	TAAR1	19	48
CCc1cc(CCCn2nnc(C3(NC(=O)c4ccccc4)CCCC3)n2)on1	ZINC000450844222	GG	On-Demand	Anodyne	SOAT1	18	42
CCC[C@H]1CCCCN1C(=O)c1ccc(C2CC2)nc1C	ZINC000450844228	CI	On-Demand	Anodyne	HCRTR1	16	42
CCC[C@H]1CCCCN1C(=O)c1ccc(C2CC2)nc1C	ZINC000450844228	CI	On-Demand	Anodyne	HCRTR2	0	42
CCC[C@@H]1CCCCN1C(=O)c1ccc(C2CC2)nc1C	ZINC000450844229	CI	On-Demand	Anodyne	HCRTR1	16	42
CCC[C@@H]1CCCCN1C(=O)c1ccc(C2CC2)nc1C	ZINC000450844229	CI	On-Demand	Anodyne	HCRTR2	0	42
Cc1cnc(CCCC(=O)NC2(Cc3ccccc3)CCCC2)o1	ZINC000450844231	EH	On-Demand	Anodyne	FAAH	40	34
Cc1cnc(CCCC(=O)NC2(Cc3ccccc3)CCCC2)o1	ZINC000450844231	EH	On-Demand	Anodyne	CES1D	44	31
O=C(CCCN1CC2(CCOCC2)c2ccccc21)c1ccccc1	ZINC000450844237	EI	On-Demand	Anodyne	CYP2J2	48	34
COc1ccc(CNC(=O)CCN[C@H]2CCCc3c(O)cccc32)c(OC)c1	ZINC000450844267	GG	On-Demand	Anodyne	MTNR1A	70	39
COc1ccc(CNC(=O)CCN[C@H]2CCCc3c(O)cccc32)c(OC)c1	ZINC000450844267	GG	On-Demand	Anodyne	MTNR1B	61	39
COc1ccc(CNC(=O)CCN[C@H]2CCCc3c(O)cccc32)c(OC)c1	ZINC000450844267	GG	On-Demand	Anodyne	C5AR1	25	40
COc1ccc(CNC(=O)CCN[C@@H]2CCCc3c(O)cccc32)c(OC)c1	ZINC000450844270	GG	On-Demand	Anodyne	MTNR1A	70	39
COc1ccc(CNC(=O)CCN[C@@H]2CCCc3c(O)cccc32)c(OC)c1	ZINC000450844270	GG	On-Demand	Anodyne	MTNR1B	61	39
COc1ccc(CNC(=O)CCN[C@@H]2CCCc3c(O)cccc32)c(OC)c1	ZINC000450844270	GG	On-Demand	Anodyne	C5AR1	25	40
COc1ccc(C[C@@H](CO)CNc2ncncc2Cl)cc1Br	ZINC000450844331	GF	On-Demand	Anodyne	PDE6A	43	33
COc1ccc(C[C@H](CO)CNc2ncncc2Cl)cc1Br	ZINC000450844332	GF	On-Demand	Anodyne	PDE6A	43	33
CCc1nc(C)c(CSc2nnc(-c3ccccc3Cl)o2)o1	ZINC000450844401	EJ	On-Demand	Anodyne	ALOX15	40	33
CCc1nc(C)c(CSc2nnc(-c3ccccc3Cl)o2)o1	ZINC000450844401	EJ	On-Demand	Anodyne	TERT	0	43
CCc1nc(C)c(CSc2nnc(-c3ccccc3Cl)o2)o1	ZINC000450844401	EJ	On-Demand	Anodyne	CPB	0	42
COCCOC[C@@H](O)CN1CCNC(=O)[C@H]1c1ccc(OC(F)(F)F)cc1	ZINC000450844422	GD	On-Demand	Anodyne	HSP90AB1	31	43
COCCOC[C@H](O)CN1CCNC(=O)[C@@H]1c1ccc(OC(F)(F)F)cc1	ZINC000450844424	GD	On-Demand	Anodyne	HSP90AB1	31	43
COCCOC[C@H](O)CN1CCNC(=O)[C@H]1c1ccc(OC(F)(F)F)cc1	ZINC000450844426	GD	On-Demand	Anodyne	HSP90AB1	31	43
COCCOC[C@@H](O)CN1CCNC(=O)[C@@H]1c1ccc(OC(F)(F)F)cc1	ZINC000450844428	GD	On-Demand	Anodyne	HSP90AB1	31	43
CC(=O)CCCCCSc1nnc(-c2ccccc2Cl)o1	ZINC000450844453	DJ	On-Demand	Anodyne	ALOX15	65	39
CC(=O)CCCCCSc1nnc(-c2ccccc2Cl)o1	ZINC000450844453	DJ	On-Demand	Anodyne	CPB	0	45
CCSCc1ccc(Nc2cc(COC)nc3ncnn23)cc1	ZINC000450844461	EG	On-Demand	Anodyne	DHOD	0	54
COC(=O)[C@H](C)CSCc1ccc(Cl)c(OC)c1	ZINC000450844483	CG	On-Demand	Anodyne	CACNA2D1	23	40
COC(=O)[C@H](C)CSCc1ccc(Cl)c(OC)c1	ZINC000450844483	CG	On-Demand	Anodyne	LTA4H	36	42
CCOC(=O)c1ccc(CN2CCc3ccnc(O)c3C2)nc1	ZINC000450844484	DD	On-Demand	Anodyne	NOD1	25	43
CCOC(=O)c1ccc(CN2CCc3ccnc(O)c3C2)nc1	ZINC000450844484	DD	On-Demand	Anodyne	NOD2	40	43
COC(=O)[C@@H](C)CSCc1ccc(Cl)c(OC)c1	ZINC000450844485	CG	On-Demand	Anodyne	CACNA2D1	23	40
COC(=O)[C@@H](C)CSCc1ccc(Cl)c(OC)c1	ZINC000450844485	CG	On-Demand	Anodyne	LTA4H	36	42
CCCc1ncc(CNc2ccc(C#N)c(Cl)c2)o1	ZINC000450844489	CH	On-Demand	Mild	MAP3K8	55	35
CCC1(CNc2ccnc3cc(F)c(OC)cc23)COC1	ZINC000450844531	CG	On-Demand	Anodyne	FLT1	0	42
OCC[C@@H]1CCC[C@@H]1NCc1ccn(CCc2ccccc2)n1	ZINC000450844537	DF	On-Demand	Anodyne	SLC18A2	44	40
OCC[C@H]1CCC[C@H]1NCc1ccn(CCc2ccccc2)n1	ZINC000450844538	DF	On-Demand	Anodyne	SLC18A2	44	40
OCC[C@H]1CCC[C@@H]1NCc1ccn(CCc2ccccc2)n1	ZINC000450844539	DF	On-Demand	Anodyne	SLC18A2	44	40
OCC[C@@H]1CCC[C@H]1NCc1ccn(CCc2ccccc2)n1	ZINC000450844540	DF	On-Demand	Anodyne	SLC18A2	44	40
COc1ccc(CNC(=O)CCN[C@@H]2CCO[C@H]2c2ccccc2)c(OC)c1	ZINC000450844544	GF	On-Demand	Anodyne	MTNR1A	79	38
COc1ccc(CNC(=O)CCN[C@@H]2CCO[C@H]2c2ccccc2)c(OC)c1	ZINC000450844544	GF	On-Demand	Anodyne	MTNR1B	66	36
CCN1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)CC1=O	ZINC000450844559	ED	On-Demand	Anodyne	SLC12A5	43	33
COc1ccc(Cc2nnc(SCc3cc(C)ccc3F)o2)cc1OC	ZINC000450844583	FI	On-Demand	Anodyne	PTK2	0	40
COc1ccc(CNC(=O)CCN2CCS[C@@H](C)CC2)c(OC)c1	ZINC000450844632	FF	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCS[C@@H](C)CC2)c(OC)c1	ZINC000450844632	FF	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CCS[C@@H](C)CC2)c(OC)c1	ZINC000450844632	FF	On-Demand	Anodyne	MTNR1A	41	35
COc1ccc(CNC(=O)CCN2CCS[C@H](C)CC2)c(OC)c1	ZINC000450844633	FF	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCS[C@H](C)CC2)c(OC)c1	ZINC000450844633	FF	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CCS[C@H](C)CC2)c(OC)c1	ZINC000450844633	FF	On-Demand	Anodyne	MTNR1A	41	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000450844642	FE	On-Demand	Anodyne	MME	30	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000450844642	FE	On-Demand	Anodyne	TIMP3	81	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000450844643	FE	On-Demand	Anodyne	MME	30	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000450844643	FE	On-Demand	Anodyne	TIMP3	81	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000450844644	FE	On-Demand	Anodyne	MME	30	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000450844644	FE	On-Demand	Anodyne	TIMP3	81	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000450844645	FE	On-Demand	Anodyne	MME	30	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000450844645	FE	On-Demand	Anodyne	TIMP3	81	36
CCS(=O)(=O)c1ccc(CN(CCO)Cc2cccc(F)c2)cc1	ZINC000450844646	FF	On-Demand	Anodyne	RORC	33	43
C[C@H]1CCN(CCN(C)Cc2ccccc2)CCS1	ZINC000450844657	CF	On-Demand	Anodyne	SIGMAR1	23	40
C[C@@H]1CCN(CCN(C)Cc2ccccc2)CCS1	ZINC000450844658	CF	On-Demand	Anodyne	SIGMAR1	23	40
CCc1nc(C2CCN(CC/C=C\c3ccccc3)CC2)n[nH]1	ZINC000450844687	DH	On-Demand	Anodyne	AKT2	49	36
CCc1nc(C2CCN(CC/C=C/c3ccccc3)CC2)n[nH]1	ZINC000450844688	DH	On-Demand	Anodyne	AKT2	49	36
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1Cc1cn(CC2CC2)nn1	ZINC000450844691	FF	On-Demand	Anodyne	SLC12A5	85	43
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1Cc1cn(CC2CC2)nn1	ZINC000450844692	FF	On-Demand	Anodyne	SLC12A5	85	43
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C[C@H]1COCCO1	ZINC000450844693	EE	On-Demand	Anodyne	SLC12A5	93	47
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C[C@@H]1COCCO1	ZINC000450844694	EE	On-Demand	Anodyne	SLC12A5	93	47
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C[C@@H]1COCCO1	ZINC000450844695	EE	On-Demand	Anodyne	SLC12A5	93	47
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C[C@H]1COCCO1	ZINC000450844696	EE	On-Demand	Anodyne	SLC12A5	93	47
CCS(=O)(=O)c1ccc(CN2CCc3ccnc(O)c3C2)cc1	ZINC000450844723	EE	On-Demand	Anodyne	NOD2	42	37
CCc1ncc(CNc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])o1	ZINC000450844727	GD	On-Demand	Bother	BDKRB1	0	44
Cc1cc(C(=O)Nc2cccc(C(F)F)c2Cl)nn1C(C)C	ZINC000450844735	EJ	On-Demand	Anodyne	NPY5R	15	41
CCc1nc(C2CCN(Cc3ccc(C(=O)OC)c(Cl)c3)CC2)n[nH]1	ZINC000450844772	FG	On-Demand	Anodyne	SIGMAR1	21	40
CCc1nc(C2CCN(Cc3ccc(C(=O)OC)c(Cl)c3)CC2)n[nH]1	ZINC000450844772	FG	On-Demand	Anodyne	SSTR5	58	35
CCc1nc(C2CCN(Cc3ccc(C(=O)OC)c(Cl)c3)CC2)n[nH]1	ZINC000450844772	FG	On-Demand	Anodyne	AKT2	44	36
CCc1nc(C2CCN(Cc3ccc(C(=O)OC)c(Cl)c3)CC2)n[nH]1	ZINC000450844772	FG	On-Demand	Anodyne	MCHR1	38	43
Cc1nnc(-c2cccc(C#N)c2)n1CC(=O)NCCCN1CCCCCC1=O	ZINC000450844785	GE	On-Demand	Mild	AVPR1B	43	38
CCN(CC)CCNC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)cc1	ZINC000450844878	FH	On-Demand	Anodyne	KCNQ1	0	56
CCN(CC)CCNC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)cc1	ZINC000450844878	FH	On-Demand	Anodyne	RAF1	15	42
CCN(CC)CCNC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)cc1	ZINC000450844878	FH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
Cc1ccccc1-n1ncc2c(=O)n(CCC(C)(F)F)cnc21	ZINC000450844890	DF	On-Demand	Anodyne	Q9M629_MAIZE	53	31
CCNC(=O)c1ccc(OC[C@H]2CCCC2(F)F)cc1	ZINC000450844895	CG	On-Demand	Anodyne	KCNQ1	0	53
CCNC(=O)c1ccc(OC[C@@H]2CCCC2(F)F)cc1	ZINC000450844896	CG	On-Demand	Anodyne	KCNQ1	0	53
O=C([C@H](O)C1CCC1)N1CCO[C@@H](CCc2ccccc2)C1	ZINC000450844929	DE	On-Demand	Anodyne	SLC18A2	48	39
O=C([C@H](O)C1CCC1)N1CCO[C@@H](CCc2ccccc2)C1	ZINC000450844929	DE	On-Demand	Anodyne	MGLL	0	40
O=C([C@H](O)C1CCC1)N1CCO[C@H](CCc2ccccc2)C1	ZINC000450844930	DE	On-Demand	Anodyne	SLC18A2	48	39
O=C([C@H](O)C1CCC1)N1CCO[C@H](CCc2ccccc2)C1	ZINC000450844930	DE	On-Demand	Anodyne	MGLL	0	40
O=C([C@@H](O)C1CCC1)N1CCO[C@@H](CCc2ccccc2)C1	ZINC000450844931	DE	On-Demand	Anodyne	SLC18A2	48	39
O=C([C@@H](O)C1CCC1)N1CCO[C@@H](CCc2ccccc2)C1	ZINC000450844931	DE	On-Demand	Anodyne	MGLL	0	40
O=C([C@@H](O)C1CCC1)N1CCO[C@H](CCc2ccccc2)C1	ZINC000450844932	DE	On-Demand	Anodyne	SLC18A2	48	39
O=C([C@@H](O)C1CCC1)N1CCO[C@H](CCc2ccccc2)C1	ZINC000450844932	DE	On-Demand	Anodyne	MGLL	0	40
COc1cc(CC(=O)N2CCC[C@H](C)c3ccccc32)ccc1O	ZINC000450844977	EH	On-Demand	Anodyne	DRD4	17	40
COc1cc(CC(=O)N2CCC[C@H](C)c3ccccc32)ccc1O	ZINC000450844977	EH	On-Demand	Anodyne	AVPR2	18	40
COc1cc(CC(=O)N2CCC[C@H](C)c3ccccc32)ccc1O	ZINC000450844977	EH	On-Demand	Anodyne	RORC	47	38
COc1cc(CC(=O)N2CCC[C@@H](C)c3ccccc32)ccc1O	ZINC000450844978	EH	On-Demand	Anodyne	DRD4	17	40
COc1cc(CC(=O)N2CCC[C@@H](C)c3ccccc32)ccc1O	ZINC000450844978	EH	On-Demand	Anodyne	AVPR2	18	40
COc1cc(CC(=O)N2CCC[C@@H](C)c3ccccc32)ccc1O	ZINC000450844978	EH	On-Demand	Anodyne	RORC	47	38
CCCOc1cccc(Cn2cc(S(=O)(=O)N(C)C)cn2)c1	ZINC000450845027	DD	On-Demand	Anodyne	SQLE	42	35
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000450845030	FD	On-Demand	Anodyne	FKBP12.6	0	44
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000450845031	FD	On-Demand	Anodyne	FKBP12.6	0	44
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000450845032	FD	On-Demand	Anodyne	FKBP12.6	0	44
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000450845033	FD	On-Demand	Anodyne	FKBP12.6	0	44
CCS(=O)(=O)c1ccc(CN2CCS[C@H](C)CC2)cc1	ZINC000450845046	DF	On-Demand	Anodyne	HRH3	15	45
CCS(=O)(=O)c1ccc(CN2CCS[C@@H](C)CC2)cc1	ZINC000450845047	DF	On-Demand	Anodyne	HRH3	15	45
c1ccc(CCN(Cc2cccnc2)C[C@H]2COCCO2)cc1	ZINC000450845052	DF	On-Demand	Anodyne	NR1D1	42	34
c1ccc(CCN(Cc2cccnc2)C[C@@H]2COCCO2)cc1	ZINC000450845053	DF	On-Demand	Anodyne	NR1D1	42	34
COC(=O)c1ccc(CN(Cc2ccc(F)cc2)C2CCOCC2)cc1Cl	ZINC000450845066	GI	On-Demand	Anodyne	ACAT	0	44
O=[N+]([O-])c1cnc(NC2CCc3ccccc3CC2)nc1	ZINC000450845107	CF	On-Demand	Bother	PRKCQ	25	41
COC1(CSc2nnc(-c3cccc4ccccc34)o2)CCC1	ZINC000450845130	EJ	On-Demand	Anodyne	ALOX15	71	55
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450845138	FJ	On-Demand	Anodyne	CXCL8	46	37
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450845138	FJ	On-Demand	Anodyne	ACAT	0	40
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450845144	FJ	On-Demand	Anodyne	CXCL8	46	37
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450845144	FJ	On-Demand	Anodyne	ACAT	0	40
C[C@@H]1CCN(CCCC(=O)c2ccccc2)CC1(F)F	ZINC000450845184	CH	On-Demand	Anodyne	DRD2	31	45
C[C@@H]1CCN(CCCC(=O)c2ccccc2)CC1(F)F	ZINC000450845184	CH	On-Demand	Anodyne	SLC6A1	50	37
C[C@@H]1CCN(CCCC(=O)c2ccccc2)CC1(F)F	ZINC000450845184	CH	On-Demand	Anodyne	HTR3B	0	41
C[C@@H]1CCN(CCCC(=O)c2ccccc2)CC1(F)F	ZINC000450845184	CH	On-Demand	Anodyne	CYP2J2	69	49
C[C@H]1CCN(CCCC(=O)c2ccccc2)CC1(F)F	ZINC000450845186	CH	On-Demand	Anodyne	DRD2	31	45
C[C@H]1CCN(CCCC(=O)c2ccccc2)CC1(F)F	ZINC000450845186	CH	On-Demand	Anodyne	SLC6A1	50	37
C[C@H]1CCN(CCCC(=O)c2ccccc2)CC1(F)F	ZINC000450845186	CH	On-Demand	Anodyne	HTR3B	0	41
C[C@H]1CCN(CCCC(=O)c2ccccc2)CC1(F)F	ZINC000450845186	CH	On-Demand	Anodyne	CYP2J2	69	49
CCC1(CNc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])COC1	ZINC000450845205	GD	On-Demand	Bother	BDKRB1	0	47
CCC1(CNc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])COC1	ZINC000450845205	GD	On-Demand	Bother	BCL2L1	62	37
CCC1(CNc2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])COC1	ZINC000450845205	GD	On-Demand	Bother	BCL2	45	31
COc1cc(CN[C@@H]2CCC[C@H]2CCO)ccc1Cl	ZINC000450845211	CF	On-Demand	Anodyne	SSTR3	0	47
COc1cc(CN[C@H]2CCC[C@H]2CCO)ccc1Cl	ZINC000450845214	CF	On-Demand	Anodyne	SSTR3	0	47
COc1cc(CN[C@H]2CCC[C@@H]2CCO)ccc1Cl	ZINC000450845218	CF	On-Demand	Anodyne	SSTR3	0	47
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1CCCC(=O)CC	ZINC000450845221	EG	On-Demand	Anodyne	SLC12A5	99	50
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1CCCC(=O)CC	ZINC000450845222	EG	On-Demand	Anodyne	SLC12A5	99	50
COc1cc(CN[C@@H]2CCC[C@@H]2CCO)ccc1Cl	ZINC000450845223	CF	On-Demand	Anodyne	SSTR3	0	47
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1Cc1ccn(CC(F)(F)F)n1	ZINC000450845275	GH	On-Demand	Anodyne	SLC12A5	93	46
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1Cc1ccn(CC(F)(F)F)n1	ZINC000450845276	GH	On-Demand	Anodyne	SLC12A5	93	46
COC(=O)c1cccc(CN2C(=O)C[C@H](Cc3ccc(F)cc3)C2=O)c1Cl	ZINC000450845314	GG	On-Demand	Anodyne	CCR3	30	42
COC(=O)c1cccc(CN2C(=O)C[C@@H](Cc3ccc(F)cc3)C2=O)c1Cl	ZINC000450845315	GG	On-Demand	Anodyne	CCR3	30	42
COc1cc(CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)ccc1Cl	ZINC000450845322	FI	On-Demand	Anodyne	SSTR3	17	44
COc1cc(CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)ccc1Cl	ZINC000450845323	FI	On-Demand	Anodyne	SSTR3	17	44
COc1cc(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)ccc1Cl	ZINC000450845324	FI	On-Demand	Anodyne	SSTR3	17	44
COc1cc(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)ccc1Cl	ZINC000450845325	FI	On-Demand	Anodyne	SSTR3	17	44
O=C(NCC(F)F)[C@@H]1CCCCN1c1nc(-c2ccccc2)ns1	ZINC000450845331	FF	On-Demand	Anodyne	FAAH	0	44
COc1ccc(C[C@@H](CO)CNc2ncc(C)cn2)cc1Br	ZINC000450845336	FF	On-Demand	Anodyne	P2RX2	43	42
COc1ccc(C[C@@H](CO)CNc2ncc(C)cn2)cc1Br	ZINC000450845336	FF	On-Demand	Anodyne	P2RX3	40	42
COc1ccc(C[C@H](CO)CNc2ncc(C)cn2)cc1Br	ZINC000450845337	FF	On-Demand	Anodyne	P2RX2	43	42
COc1ccc(C[C@H](CO)CNc2ncc(C)cn2)cc1Br	ZINC000450845337	FF	On-Demand	Anodyne	P2RX3	40	42
CSc1cccc(C(=O)NC[C@H]2CCc3nccn3C2)c1	ZINC000450845346	DF	On-Demand	Anodyne	CACNA1I	44	39
CSc1cccc(C(=O)NC[C@@H]2CCc3nccn3C2)c1	ZINC000450845347	DF	On-Demand	Anodyne	CACNA1I	44	39
C[C@H]1COC(C)(C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450845361	CG	On-Demand	Anodyne	DRD2	29	42
C[C@H]1COC(C)(C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450845361	CG	On-Demand	Anodyne	DRD4	0	43
C[C@H]1COC(C)(C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450845361	CG	On-Demand	Anodyne	SLC18A3	0	44
C[C@H]1COC(C)(C)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450845361	CG	On-Demand	Anodyne	CYP2J2	48	35
CC[C@H](O)CC(=O)NC1(Cc2ccccc2)CCCC1	ZINC000450845369	CF	On-Demand	Anodyne	ACAT	0	52
CC[C@H](O)CC(=O)NC1(Cc2ccccc2)CCCC1	ZINC000450845369	CF	On-Demand	Anodyne	SLC12A5	40	36
CC[C@@H](O)CC(=O)NC1(Cc2ccccc2)CCCC1	ZINC000450845370	CF	On-Demand	Anodyne	ACAT	0	52
CC[C@@H](O)CC(=O)NC1(Cc2ccccc2)CCCC1	ZINC000450845370	CF	On-Demand	Anodyne	SLC12A5	40	36
CC(C)OC(C)(C)C(=O)NC[C@H]1CCc2nccn2C1	ZINC000450845374	CD	On-Demand	Anodyne	CACNA1I	41	31
CC(C)OC(C)(C)C(=O)NC[C@@H]1CCc2nccn2C1	ZINC000450845375	CD	On-Demand	Anodyne	CACNA1I	41	31
CS(=O)(=O)N1CCc2c(NC(=O)[C@@H](O)C3CCC3)cccc21	ZINC000450845411	DD	On-Demand	Anodyne	KCNQ2	52	34
CS(=O)(=O)N1CCc2c(NC(=O)[C@H](O)C3CCC3)cccc21	ZINC000450845412	DD	On-Demand	Anodyne	KCNQ2	52	34
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@@H](CCc2ccccc2)C1	ZINC000450845453	FF	On-Demand	Anodyne	SMO	24	42
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@H](CCc2ccccc2)C1	ZINC000450845454	FF	On-Demand	Anodyne	SMO	24	42
CCC1(CNc2ncccc2C(=O)OC(C)C)COC1	ZINC000450845471	CE	On-Demand	Anodyne	G2YM83_BOTF4	44	32
C=CC[C@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450845481	BD	On-Demand	Mild	PDE5A	24	45
C=CC[C@@H](CO)NC(=O)c1cccc(CC)n1	ZINC000450845482	BD	On-Demand	Mild	PDE5A	24	45
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	ADORA1	161	65
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	SLC29A1	134	59
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	P2RY12	44	42
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	ADORA2A	54	63
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	ADORA2B	22	56
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	GAPC	0	43
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	ADK	57	53
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	AK3	0	40
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	AHCY	56	40
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	P2RX4	34	40
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	P2RX1	45	38
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	P2RY1	33	40
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	AMD1	17	44
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	ITPR1	51	37
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	P2RY2	18	40
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	AK2	0	40
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	NS5B	0	44
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	ADORA3	126	63
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	OXGR1	116	40
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	MTAP	0	44
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	AK	0	46
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	RNASE1	43	33
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	MBTA	0	41
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	DNMT3B	72	42
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	Q4VQ11_PIG	87	63
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	GPR17	45	45
C=CCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450845503	GC	On-Demand	Mild	DOT1L	87	42
C[C@H]1CCCN(C(=O)c2nn(C)c3c2CCCC3)c2ccccc21	ZINC000450845508	DH	On-Demand	Anodyne	AVPR2	44	41
C[C@@H]1CCCN(C(=O)c2nn(C)c3c2CCCC3)c2ccccc21	ZINC000450845509	DH	On-Demand	Anodyne	AVPR2	44	41
Cc1cnc(CCCC(=O)Nc2c(C)noc2-c2ccccc2)o1	ZINC000450845539	EH	On-Demand	Anodyne	FAAH	44	35
Cc1cnc(CCCC(=O)Nc2c(C)noc2-c2ccccc2)o1	ZINC000450845539	EH	On-Demand	Anodyne	CES1D	44	32
CC[C@@H](O)CC(=O)NCc1ccc(Cl)c(C)c1	ZINC000450845541	CE	On-Demand	Anodyne	P2RX7	31	45
CC[C@H](O)CC(=O)NCc1ccc(Cl)c(C)c1	ZINC000450845542	CE	On-Demand	Anodyne	P2RX7	31	45
CCc1ncc(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)o1	ZINC000450845553	ED	On-Demand	Anodyne	CA2	45	50
CCc1ncc(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)o1	ZINC000450845553	ED	On-Demand	Anodyne	CA1	40	36
CCc1ncc(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)o1	ZINC000450845553	ED	On-Demand	Anodyne	CA4	44	35
Cc1cccc(CN(Cc2ccc(F)cc2)C2CCOCC2)n1	ZINC000450845561	DH	On-Demand	Anodyne	ACAT	0	44
C[C@H]1CN(CCN(C)Cc2ccccc2)C[C@H](C)S1=O	ZINC000450845641	CD	On-Demand	Anodyne	SIGMAR1	42	48
Cc1cc(CNC(=O)CS(=O)(=O)C2CC2)ccc1Cl	ZINC000450845648	DD	On-Demand	Anodyne	P2RX7	24	43
C[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@@H](C)S1=O	ZINC000450845649	CD	On-Demand	Anodyne	SIGMAR1	42	48
C[C@H]1CN(CCN(C)Cc2ccccc2)C[C@@H](C)[S@@]1=O	ZINC000450845650	CD	On-Demand	Anodyne	SIGMAR1	42	48
Cc1cc(Cl)c2ncc(C#N)c(N[C@H](C)Cc3cnn(C)c3)c2c1	ZINC000450845659	EH	On-Demand	Mild	SRC	43	32
Cc1cc(Cl)c2ncc(C#N)c(N[C@H](C)Cc3cnn(C)c3)c2c1	ZINC000450845659	EH	On-Demand	Mild	MAP3K8	99	52
Cc1cc(Cl)c2ncc(C#N)c(N[C@@H](C)Cc3cnn(C)c3)c2c1	ZINC000450845661	EH	On-Demand	Mild	SRC	43	32
Cc1cc(Cl)c2ncc(C#N)c(N[C@@H](C)Cc3cnn(C)c3)c2c1	ZINC000450845661	EH	On-Demand	Mild	MAP3K8	99	52
CCc1ncc(CNc2ncnc3c(F)c(OC)ccc23)o1	ZINC000450845668	DE	On-Demand	Anodyne	PDE6A	43	33
COC(=O)[C@H](C)N(CCN(C)Cc1ccccc1)C1CCC1	ZINC000450845675	DF	On-Demand	Anodyne	ACHE	0	42
COC(=O)[C@H](C)N(CCN(C)Cc1ccccc1)C1CCC1	ZINC000450845675	DF	On-Demand	Anodyne	AMY2	48	34
COC(=O)[C@@H](C)N(CCN(C)Cc1ccccc1)C1CCC1	ZINC000450845677	DF	On-Demand	Anodyne	ACHE	0	42
COC(=O)[C@@H](C)N(CCN(C)Cc1ccccc1)C1CCC1	ZINC000450845677	DF	On-Demand	Anodyne	AMY2	48	34
CCCc1ncc(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)o1	ZINC000450845716	FD	On-Demand	Anodyne	CA2	42	46
COc1ccc(CNC(=O)CCn2cc(S(=O)(=O)N(C)C)cn2)c(OC)c1	ZINC000450845718	GC	On-Demand	Anodyne	PDGFRB	48	42
COc1ccc(CNC(=O)CCn2cc(S(=O)(=O)N(C)C)cn2)c(OC)c1	ZINC000450845718	GC	On-Demand	Anodyne	MTNR1A	40	39
COc1ccc(CNC(=O)CCn2cc(S(=O)(=O)N(C)C)cn2)c(OC)c1	ZINC000450845718	GC	On-Demand	Anodyne	CSF1R	20	42
O=C(NC[C@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccnc(OC(F)F)c1	ZINC000450845726	GF	On-Demand	Anodyne	CACNA1I	56	36
O=C(NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccnc(OC(F)F)c1	ZINC000450845727	GF	On-Demand	Anodyne	CACNA1I	56	36
CC(=O)c1ccc(CN2CCN(C)[C@H](C(C)C)C2)cc1	ZINC000450845748	CF	On-Demand	Anodyne	MLNR	41	34
CC(=O)c1ccc(CN2CCN(C)[C@@H](C(C)C)C2)cc1	ZINC000450845749	CF	On-Demand	Anodyne	MLNR	41	34
O=C(NCC(F)F)[C@@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450845755	FG	On-Demand	Anodyne	COLA	96	42
O=C(NCC(F)F)[C@@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450845755	FG	On-Demand	Anodyne	CPT1A	88	42
O=C(NCC(F)F)[C@@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450845755	FG	On-Demand	Anodyne	CPT2	42	36
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2c1ncn2C1CC1	ZINC000450845802	FD	On-Demand	Anodyne	ADCY5	26	40
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2c1ncn2C1CC1	ZINC000450845802	FD	On-Demand	Anodyne	OXGR1	83	33
OCCN(Cc1cccc(Br)c1)C[C@H](O)Cc1ccccc1	ZINC000450845810	FF	On-Demand	Anodyne	VACHT_TETCF	0	45
CNC(=O)C[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450845814	DE	On-Demand	Anodyne	EGFR	50	40
CNC(=O)C[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450845814	DE	On-Demand	Anodyne	HTT	0	40
CNC(=O)C[C@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450845819	DE	On-Demand	Anodyne	EGFR	50	40
CNC(=O)C[C@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450845819	DE	On-Demand	Anodyne	HTT	0	40
CNC(=O)C[C@@H](C)N=c1cc(C)[nH]c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450845821	ED	On-Demand	Bother	GYRB	44	39
CNC(=O)C[C@H](C)N=c1cc(C)[nH]c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450845828	ED	On-Demand	Bother	GYRB	44	39
CCN(CC)CCNC(=O)c1ccc(OCC2(C#N)CCC2)cc1	ZINC000450845833	EF	On-Demand	Mild	KCNQ1	0	56
Cn1ncc(Br)c1C(=O)NC1(Cc2ccccc2)CCCC1	ZINC000450845849	FG	On-Demand	Anodyne	SLC12A5	52	35
C[C@H]1CCCN(C(=O)C2CC(C)(O)C2)c2ccccc21	ZINC000450845853	CG	On-Demand	Anodyne	L3MBTL3	40	33
C[C@@H]1CCCN(C(=O)C2CC(C)(O)C2)c2ccccc21	ZINC000450845856	CG	On-Demand	Anodyne	L3MBTL3	40	33
Cc1ccc(F)c(CC(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)c1	ZINC000450845859	FG	On-Demand	Anodyne	TRPV1	49	34
Cc1ccc(F)c(CC(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)c1	ZINC000450845862	FG	On-Demand	Anodyne	TRPV1	49	34
CCS(=O)(=O)c1ccc(Cn2nnc(CN(C)C(=O)c3ccccc3)n2)cc1	ZINC000450845869	GD	On-Demand	Anodyne	LIMK2	51	45
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@@H](C)c3ccccc32)c(F)c1	ZINC000450845871	FH	On-Demand	Anodyne	AVPR2	41	37
Cc1nnnn1-c1ccc(C(=O)N2CCC[C@H](C)c3ccccc32)c(F)c1	ZINC000450845872	FH	On-Demand	Anodyne	AVPR2	41	37
CC[C@@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845873	EF	On-Demand	Anodyne	NQO2	29	40
CC[C@@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845873	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
CC[C@@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845873	EF	On-Demand	Anodyne	MTNR1A	56	39
CC[C@@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845874	EF	On-Demand	Anodyne	NQO2	29	40
CC[C@@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845874	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
CC[C@@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845874	EF	On-Demand	Anodyne	MTNR1A	56	39
CC[C@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845875	EF	On-Demand	Anodyne	NQO2	29	40
CC[C@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845875	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
CC[C@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845875	EF	On-Demand	Anodyne	MTNR1A	56	39
CC[C@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845876	EF	On-Demand	Anodyne	NQO2	29	40
CC[C@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845876	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
CC[C@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450845876	EF	On-Demand	Anodyne	MTNR1A	56	39
COc1ccccc1CS[C@@H]1C[C@@H]2CCCC[C@@H]2NC1=O	ZINC000450845877	DG	On-Demand	Anodyne	QRFPR	41	37
COc1ccccc1CS[C@@H]1C[C@H]2CCCC[C@@H]2NC1=O	ZINC000450845878	DG	On-Demand	Anodyne	QRFPR	41	37
COc1ccccc1CS[C@@H]1C[C@@H]2CCCC[C@H]2NC1=O	ZINC000450845879	DG	On-Demand	Anodyne	QRFPR	41	37
COc1ccccc1CS[C@@H]1C[C@H]2CCCC[C@H]2NC1=O	ZINC000450845880	DG	On-Demand	Anodyne	QRFPR	41	37
C[C@@H]1CC[C@@H](N(CCO)Cc2ccccc2OC2CC2)C1	ZINC000450845881	CG	On-Demand	Anodyne	SLC5A4	52	34
C[C@H]1CC[C@@H](N(CCO)Cc2ccccc2OC2CC2)C1	ZINC000450845882	CG	On-Demand	Anodyne	SLC5A4	52	34
C[C@H]1CC[C@H](N(CCO)Cc2ccccc2OC2CC2)C1	ZINC000450845883	CG	On-Demand	Anodyne	SLC5A4	52	34
C[C@@H]1CC[C@H](N(CCO)Cc2ccccc2OC2CC2)C1	ZINC000450845884	CG	On-Demand	Anodyne	SLC5A4	52	34
CCc1cc(NCc2nn(C)cc2I)n2ncnc2n1	ZINC000450845894	GD	On-Demand	Anodyne	DHOD	0	50
O=C(CC[C@@H]1CCCCO1)CSc1nnc(-c2cccc3ccccc23)o1	ZINC000450845969	GJ	On-Demand	Anodyne	ALOX15	70	52
O=C(CC[C@H]1CCCCO1)CSc1nnc(-c2cccc3ccccc23)o1	ZINC000450845970	GJ	On-Demand	Anodyne	ALOX15	70	52
CCCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450845973	DF	On-Demand	Anodyne	EGFR	38	46
CCCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450845973	DF	On-Demand	Anodyne	ERBB2	18	43
CCCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450845973	DF	On-Demand	Anodyne	FGFR1	19	41
CCCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450845973	DF	On-Demand	Anodyne	FLT1	29	41
CCCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450845973	DF	On-Demand	Anodyne	FBP1	17	43
CCCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450845973	DF	On-Demand	Anodyne	EPHA2	46	36
CCN(CC(F)F)C(=O)C1=C(c2ccccc2)CCC1	ZINC000450846009	CH	On-Demand	Anodyne	TSPO	25	42
COC(=O)C1(CN2CCN(c3cc(OC)ccc3F)CC2)CC1	ZINC000450846038	DD	On-Demand	Anodyne	DRD4	48	37
CCc1cc(CCCN2CCO[C@H](COc3ccccc3)C2)on1	ZINC000450846063	EF	On-Demand	Anodyne	DRD4	17	41
CCc1cc(CCCN2CCO[C@@H](COc3ccccc3)C2)on1	ZINC000450846064	EF	On-Demand	Anodyne	DRD4	17	41
O=C1CCC(CN2CCO[C@@H](COc3ccccc3)C2)CC1	ZINC000450846065	DF	On-Demand	Anodyne	SIGMAR1	17	50
O=C1CCC(CN2CCO[C@H](COc3ccccc3)C2)CC1	ZINC000450846066	DF	On-Demand	Anodyne	SIGMAR1	17	50
COC(=O)C1(CN2CCO[C@H](COc3ccccc3)C2)CC1	ZINC000450846073	DD	On-Demand	Anodyne	ITGA4	45	32
COC(=O)C1(CN2CCO[C@@H](COc3ccccc3)C2)CC1	ZINC000450846074	DD	On-Demand	Anodyne	ITGA4	45	32
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C[C@@H]1CCNC(=O)CC1	ZINC000450846079	FF	On-Demand	Anodyne	SLC12A5	92	46
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C[C@H]1CCNC(=O)CC1	ZINC000450846080	FF	On-Demand	Anodyne	SLC12A5	92	46
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C[C@@H]1CCNC(=O)CC1	ZINC000450846081	FF	On-Demand	Anodyne	SLC12A5	92	46
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C[C@H]1CCNC(=O)CC1	ZINC000450846082	FF	On-Demand	Anodyne	SLC12A5	92	46
CS[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)C[C@H]1N1CCCC1	ZINC000450846083	ED	On-Demand	Anodyne	L3MBTL3	53	38
CS[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)C[C@@H]1N1CCCC1	ZINC000450846084	ED	On-Demand	Anodyne	L3MBTL3	53	38
CS[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)C[C@H]1N1CCCC1	ZINC000450846085	ED	On-Demand	Anodyne	L3MBTL3	53	38
CS[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)C[C@@H]1N1CCCC1	ZINC000450846086	ED	On-Demand	Anodyne	L3MBTL3	53	38
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	HTR1A	24	50
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	DRD2	28	40
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	DRD4	23	45
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	HTR2A	26	44
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	HTR2C	22	52
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	HRH1	28	44
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	HTR7	41	48
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	AKT2	40	35
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	HTR3B	0	41
CCc1nc(C2CCN(CCCC(=O)c3ccccc3)CC2)n[nH]1	ZINC000450846101	EG	On-Demand	Anodyne	CYP2J2	68	50
CCC1(CNc2ccc(CC(=O)OC)cc2[N+](=O)[O-])COC1	ZINC000450846146	DE	On-Demand	Bother	TAAR1	15	40
CCN(CC)CCOCCNC(=O)c1cc2ccncc2s1	ZINC000450846155	DE	On-Demand	Anodyne	SELE	42	34
CCN(CC)CCOCCNC(=O)c1cc2ccncc2s1	ZINC000450846155	DE	On-Demand	Anodyne	VCAM1	40	34
CCC1(CNc2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)COC1	ZINC000450846169	FH	On-Demand	Anodyne	NPBWR1	43	40
CCCc1cc(NCC2(CC)COC2)n2ncnc2n1	ZINC000450846182	CD	On-Demand	Anodyne	DHOD	0	44
CCC1(CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)COC1	ZINC000450846189	DF	On-Demand	Bother	MAOB	21	50
CCC1(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])COC1	ZINC000450846247	CD	On-Demand	Bother	TAAR1	17	45
O=C(NC[C@H]1CCc2nccn2C1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450846253	GD	On-Demand	Anodyne	CACNA1I	60	33
O=C(NC[C@@H]1CCc2nccn2C1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450846254	GD	On-Demand	Anodyne	CACNA1I	60	33
CCNC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450846265	EF	On-Demand	Anodyne	CA2	34	41
CCNC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450846265	EF	On-Demand	Anodyne	ADAM17	41	38
CCNC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450846265	EF	On-Demand	Anodyne	MMP2	22	40
CCNC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450846265	EF	On-Demand	Anodyne	MMP14	22	44
CCNC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450846265	EF	On-Demand	Anodyne	MMP9	24	40
CCNC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450846265	EF	On-Demand	Anodyne	MMP10	27	44
CCNC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450846265	EF	On-Demand	Anodyne	ADAMTS4	68	45
CCNC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450846265	EF	On-Demand	Anodyne	MMP1	25	41
CCN(CC)CCNC(=O)c1ccc(OCc2oc(C(C)C)nc2C)cc1	ZINC000450846267	FH	On-Demand	Anodyne	KCNQ1	0	53
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450846300	EC	On-Demand	Bother	BDKRB1	0	48
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450846300	EC	On-Demand	Bother	COLA	81	36
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450846300	EC	On-Demand	Bother	BCL2L1	41	32
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450846300	EC	On-Demand	Bother	BCL2	41	30
CCCc1ncc(CNc2ncnc3cc(F)c(F)cc23)o1	ZINC000450846304	DF	On-Demand	Anodyne	EGFR	20	41
CCCc1ncc(CNc2ncnc3cc(F)c(F)cc23)o1	ZINC000450846304	DF	On-Demand	Anodyne	CLK4	57	37
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450846308	EC	On-Demand	Bother	BDKRB1	0	48
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450846308	EC	On-Demand	Bother	COLA	81	36
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450846308	EC	On-Demand	Bother	BCL2L1	41	32
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450846308	EC	On-Demand	Bother	BCL2	41	30
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3cccc4ccccc34)o2)C1	ZINC000450846370	EJ	On-Demand	Anodyne	ALOX15	60	43
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3cccc4ccccc34)o2)C1	ZINC000450846372	EJ	On-Demand	Anodyne	ALOX15	60	43
CCC1(CNc2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])COC1	ZINC000450846373	GG	On-Demand	Bother	BCL2L1	52	35
CCC1(CNc2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])COC1	ZINC000450846373	GG	On-Demand	Bother	BCL2	45	36
CCC1(CNc2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])COC1	ZINC000450846373	GG	On-Demand	Bother	MGAT1	47	39
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3cccc4ccccc34)o2)C1	ZINC000450846375	EJ	On-Demand	Anodyne	ALOX15	60	43
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3cccc4ccccc34)o2)C1	ZINC000450846376	EJ	On-Demand	Anodyne	ALOX15	60	43
Cn1ccnc1[C@H]1OCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450846402	GG	On-Demand	Anodyne	RBP4	82	39
COC(=O)c1csc(CN2CC[C@@H](C)C(F)(F)C2)n1	ZINC000450846422	CE	On-Demand	Anodyne	TRPC6	45	34
COC(=O)c1csc(CN2CC[C@H](C)C(F)(F)C2)n1	ZINC000450846423	CE	On-Demand	Anodyne	TRPC6	45	34
C[C@H]1CCCN(C(=O)c2c3n(c(=O)n2C)CCCC3)c2ccccc21	ZINC000450846456	EG	On-Demand	Anodyne	AVPR2	32	40
C[C@@H]1CCCN(C(=O)c2c3n(c(=O)n2C)CCCC3)c2ccccc21	ZINC000450846457	EG	On-Demand	Anodyne	AVPR2	32	40
CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc(Cl)c(OC)c1	ZINC000450846459	CE	On-Demand	Anodyne	SSTR3	22	49
CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(Cl)c(OC)c1	ZINC000450846460	CE	On-Demand	Anodyne	SSTR3	22	49
CNC(=O)[C@H]1CCC[C@H]1NCc1ccc(Cl)c(OC)c1	ZINC000450846461	CE	On-Demand	Anodyne	SSTR3	22	49
CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(Cl)c(OC)c1	ZINC000450846462	CE	On-Demand	Anodyne	SSTR3	22	49
CCOC(=O)c1cc(C(=O)N2CCC[C@@H](C)c3ccccc32)on1	ZINC000450846470	EG	On-Demand	Anodyne	AVPR2	26	41
CCOC(=O)c1cc(C(=O)N2CCC[C@H](C)c3ccccc32)on1	ZINC000450846472	EG	On-Demand	Anodyne	AVPR2	26	41
C[C@H](O)CCN1C(=O)C[C@@H](Cc2ccc(F)cc2)C1=O	ZINC000450846518	CD	On-Demand	Anodyne	CCR3	42	31
C[C@H](O)CCN1C(=O)C[C@H](Cc2ccc(F)cc2)C1=O	ZINC000450846519	CD	On-Demand	Anodyne	CCR3	42	31
C[C@@H](O)CCN1C(=O)C[C@H](Cc2ccc(F)cc2)C1=O	ZINC000450846521	CD	On-Demand	Anodyne	CCR3	42	31
C[C@@H](O)CCN1C(=O)C[C@@H](Cc2ccc(F)cc2)C1=O	ZINC000450846522	CD	On-Demand	Anodyne	CCR3	42	31
CC(C)N(C)c1cnn([C@H]2CCCN(CCc3ccc(Cl)cc3)C2)c(=O)c1	ZINC000450846547	GH	On-Demand	Anodyne	BIRC2	74	43
CC(C)N(C)c1cnn([C@@H]2CCCN(CCc3ccc(Cl)cc3)C2)c(=O)c1	ZINC000450846548	GH	On-Demand	Anodyne	BIRC2	74	43
CC(C)(CC(=O)CSc1nnc(-c2ccccc2Cl)o1)C1CC1	ZINC000450846557	FJ	On-Demand	Anodyne	ALOX15	55	38
CC(C)(CC(=O)CSc1nnc(-c2ccccc2Cl)o1)C1CC1	ZINC000450846557	FJ	On-Demand	Anodyne	CPB	0	46
CC(=O)c1ccc(Cn2nnc([C@@H](NC(=O)c3ccccc3)C(C)C)n2)cc1	ZINC000450846567	GG	On-Demand	Anodyne	SOAT1	17	46
CC(=O)c1ccc(Cn2nnc([C@H](NC(=O)c3ccccc3)C(C)C)n2)cc1	ZINC000450846570	GG	On-Demand	Anodyne	SOAT1	17	46
COc1ccc(F)c(N2CCN(CC3CC(F)(F)C3)CC2)c1	ZINC000450846585	DG	On-Demand	Anodyne	DRD4	42	33
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)S1=O	ZINC000450846590	FG	On-Demand	Anodyne	DRD4	0	43
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)S1=O	ZINC000450846590	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)S1=O	ZINC000450846590	FG	On-Demand	Anodyne	CYP2J2	56	39
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@H](C)S1=O	ZINC000450846591	FG	On-Demand	Anodyne	DRD4	0	43
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@H](C)S1=O	ZINC000450846591	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@H](C)S1=O	ZINC000450846591	FG	On-Demand	Anodyne	CYP2J2	56	39
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)[S@@]1=O	ZINC000450846592	FG	On-Demand	Anodyne	DRD4	0	43
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)[S@@]1=O	ZINC000450846592	FG	On-Demand	Anodyne	HDAC8	18	41
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)[S@@]1=O	ZINC000450846592	FG	On-Demand	Anodyne	CYP2J2	56	39
COc1ccccc1-c1nc(C2CCN([C@@H](C)CC(C)C)CC2)no1	ZINC000450846602	EI	On-Demand	Anodyne	LUCI_PHOPE	32	41
COc1ccccc1-c1nc(C2CCN([C@H](C)CC(C)C)CC2)no1	ZINC000450846603	EI	On-Demand	Anodyne	LUCI_PHOPE	32	41
COc1ccc(CNC(=O)CCN2C[C@@H](C)[C@H](CO)C2)c(OC)c1	ZINC000450846613	ED	On-Demand	Anodyne	MTNR1A	43	34
COc1cc(CC(=O)NC(C)(C)CC(N)=O)ccc1Cl	ZINC000450846639	CD	On-Demand	Anodyne	NCE103	29	45
COc1cc(CC(=O)NC(C)(C)CC(N)=O)ccc1Cl	ZINC000450846639	CD	On-Demand	Anodyne	CAN2	0	45
COc1cc(CN2CCc3ccnc(O)c3C2)ccc1Cl	ZINC000450846673	DG	On-Demand	Anodyne	NOD2	40	37
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)CC1(F)F	ZINC000450846676	CF	On-Demand	Anodyne	VACHT_TETCF	0	49
C[C@H]1CCN(C[C@H](O)Cc2ccccc2)CC1(F)F	ZINC000450846676	CF	On-Demand	Anodyne	SLC18A3	0	40
C[C@@H]1CCN(C[C@H](O)Cc2ccccc2)CC1(F)F	ZINC000450846677	CF	On-Demand	Anodyne	VACHT_TETCF	0	49
C[C@@H]1CCN(C[C@H](O)Cc2ccccc2)CC1(F)F	ZINC000450846677	CF	On-Demand	Anodyne	SLC18A3	0	40
CC(C)(CC(N)=O)NC(=O)c1cc2ccncc2s1	ZINC000450846679	CD	On-Demand	Anodyne	SELE	79	35
CC(C)(CC(N)=O)NC(=O)c1cc2ccncc2s1	ZINC000450846679	CD	On-Demand	Anodyne	ICAM1	58	34
CC(C)(CC(N)=O)NC(=O)c1cc2ccncc2s1	ZINC000450846679	CD	On-Demand	Anodyne	VCAM1	43	31
CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450846689	GH	On-Demand	Anodyne	RBP4	81	37
CC(=O)c1ccc(CN2CCc3c(ncn3-c3ccc(C)cc3)C2)cc1	ZINC000450846732	EH	On-Demand	Anodyne	NOD2	43	36
O=C(NCC(F)F)[C@@H]1CCCCN1c1nc2ccccc2o1	ZINC000450846762	DF	In-Stock	Anodyne	HTR3A	18	45
COc1ccc(CNC(=O)CCN2C[C@H](OC)[C@H](OC)C2)c(OC)c1	ZINC000450846765	FD	On-Demand	Anodyne	PDGFRB	29	40
COc1ccc(CNC(=O)CCN2C[C@H](OC)[C@H](OC)C2)c(OC)c1	ZINC000450846765	FD	On-Demand	Anodyne	HTR7	26	41
COc1ccc(CNC(=O)CCN2C[C@H](OC)[C@H](OC)C2)c(OC)c1	ZINC000450846765	FD	On-Demand	Anodyne	MTNR1A	78	39
COc1ccc(CNC(=O)CCN2C[C@H](OC)[C@H](OC)C2)c(OC)c1	ZINC000450846765	FD	On-Demand	Anodyne	MTNR1B	65	39
COc1ccc(CNC(=O)CCN2C[C@@H](OC)[C@H](OC)C2)c(OC)c1	ZINC000450846766	FD	On-Demand	Anodyne	PDGFRB	29	40
COc1ccc(CNC(=O)CCN2C[C@@H](OC)[C@H](OC)C2)c(OC)c1	ZINC000450846766	FD	On-Demand	Anodyne	HTR7	26	41
COc1ccc(CNC(=O)CCN2C[C@@H](OC)[C@H](OC)C2)c(OC)c1	ZINC000450846766	FD	On-Demand	Anodyne	MTNR1A	78	39
COc1ccc(CNC(=O)CCN2C[C@@H](OC)[C@H](OC)C2)c(OC)c1	ZINC000450846766	FD	On-Demand	Anodyne	MTNR1B	65	39
COc1ccc(CNC(=O)CCN2C[C@H](OC)[C@@H](OC)C2)c(OC)c1	ZINC000450846767	FD	On-Demand	Anodyne	PDGFRB	29	40
COc1ccc(CNC(=O)CCN2C[C@H](OC)[C@@H](OC)C2)c(OC)c1	ZINC000450846767	FD	On-Demand	Anodyne	HTR7	26	41
COc1ccc(CNC(=O)CCN2C[C@H](OC)[C@@H](OC)C2)c(OC)c1	ZINC000450846767	FD	On-Demand	Anodyne	MTNR1A	78	39
COc1ccc(CNC(=O)CCN2C[C@H](OC)[C@@H](OC)C2)c(OC)c1	ZINC000450846767	FD	On-Demand	Anodyne	MTNR1B	65	39
CO[C@H]1CN(CCN(C)Cc2ccccc2)C[C@@H]1OC	ZINC000450846768	CD	On-Demand	Anodyne	SIGMAR1	22	43
CO[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1OC	ZINC000450846769	CD	On-Demand	Anodyne	SIGMAR1	22	43
CO[C@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1OC	ZINC000450846770	CD	On-Demand	Anodyne	SIGMAR1	22	43
CCN(CC)CCNC(=O)c1ccc(OCC[C@H](C)O)cc1	ZINC000450846771	DD	On-Demand	Anodyne	ERG2	16	40
CCN(CC)CCNC(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450846772	DD	On-Demand	Anodyne	ERG2	16	40
CCOC(=O)c1ccc(CN2CCN(C)[C@H](C(C)C)C2)nc1	ZINC000450846777	DE	On-Demand	Anodyne	P2RY12	33	40
CCOC(=O)c1ccc(CN2CCN(C)[C@@H](C(C)C)C2)nc1	ZINC000450846778	DE	On-Demand	Anodyne	P2RY12	33	40
COc1nccc(CSc2nnc(Cc3ccc(OC)c(OC)c3)o2)n1	ZINC000450846800	FF	On-Demand	Anodyne	Q9XSW7_PIG	0	45
CC(C)c1nccc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450846815	DE	On-Demand	Anodyne	SORD	74	34
CCOC(=O)c1cccnc1NCC1(CC)COC1	ZINC000450846858	CE	On-Demand	Anodyne	G2YM83_BOTF4	51	33
CCOCc1nc(C)c(C(=O)N2CCC[C@@H](C)c3ccccc32)s1	ZINC000450846859	EJ	On-Demand	Anodyne	AVPR2	16	40
CCOCc1nc(C)c(C(=O)N2CCC[C@H](C)c3ccccc32)s1	ZINC000450846860	EJ	On-Demand	Anodyne	AVPR2	16	40
CCC(=O)CCCN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1	ZINC000450846866	FH	On-Demand	Anodyne	CYP2J2	46	34
C[C@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)c2ccccc21	ZINC000450846888	DH	On-Demand	Anodyne	AVPR2	45	44
C[C@@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)c2ccccc21	ZINC000450846889	DH	On-Demand	Anodyne	AVPR2	36	43
C=CC[C@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450846922	CD	On-Demand	Mild	MTNR1A	35	46
C=CC[C@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450846922	CD	On-Demand	Mild	MTNR1B	34	40
C=CC[C@@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450846923	CD	On-Demand	Mild	MTNR1A	35	46
C=CC[C@@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450846923	CD	On-Demand	Mild	MTNR1B	34	40
CCc1nc(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n[nH]1	ZINC000450846927	FG	On-Demand	Anodyne	DRD4	15	43
CCc1nc(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n[nH]1	ZINC000450846927	FG	On-Demand	Anodyne	AKT2	45	36
CCN(CC)CCOCCNC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450846947	FF	On-Demand	Anodyne	AMY2	40	36
C=CCOc1ccc(CC(=O)N[C@H]2CCO[C@@H]2c2nccn2C)cc1	ZINC000450846974	EE	On-Demand	Mild	TRAR	40	31
C=CCOc1ccc(CC(=O)N[C@H]2CCO[C@@H]2c2nccn2C)cc1	ZINC000450846974	EE	On-Demand	Mild	PHZR	0	41
CCN(CC)CCOCCNC(=O)C(C)(C)C1CCC1	ZINC000450846980	CE	On-Demand	Anodyne	AMY2	44	40
O=C(N[C@H]1CCO[C@@H]1c1cccnc1)c1ccc2c(c1)OC(F)(F)O2	ZINC000450846995	EF	On-Demand	Anodyne	CHRNA7	17	42
CCc1ncc(CNc2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])o1	ZINC000450847023	FD	On-Demand	Bother	TAAR1	17	42
CCS(=O)(=O)c1ccc(CN(C)C/C(C)=C/c2ccccc2)cc1	ZINC000450847039	EI	On-Demand	Anodyne	RORC	28	41
CCS(=O)(=O)c1ccc(CN(C)C/C(C)=C\c2ccccc2)cc1	ZINC000450847041	EI	On-Demand	Anodyne	RORC	28	41
Cc1csc2c(N[C@@H](C)Cc3cnn(C)c3)ncnc12	ZINC000450847055	CF	On-Demand	Anodyne	LPAR2	26	52
Cc1csc2c(N[C@H](C)Cc3cnn(C)c3)ncnc12	ZINC000450847056	CF	On-Demand	Anodyne	LPAR2	26	52
CC(C)N1CCCC[C@H]1CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450847058	EG	On-Demand	Anodyne	CHRNA10	50	43
CC(C)N1CCCC[C@H]1CN1CCO[C@H](COc2ccccc2)C1	ZINC000450847059	EG	On-Demand	Anodyne	CHRNA10	50	43
CC(C)N1CCCC[C@@H]1CN1CCO[C@H](COc2ccccc2)C1	ZINC000450847060	EG	On-Demand	Anodyne	CHRNA10	50	43
CC(C)N1CCCC[C@@H]1CN1CCO[C@@H](COc2ccccc2)C1	ZINC000450847061	EG	On-Demand	Anodyne	CHRNA10	50	43
CNC(=O)[C@H]1CCC[C@@H]1NCCc1ccc(Cl)cc1	ZINC000450847117	CE	On-Demand	Anodyne	SLC6A1	0	41
CNC(=O)[C@@H]1CCC[C@@H]1NCCc1ccc(Cl)cc1	ZINC000450847118	CE	On-Demand	Anodyne	SLC6A1	0	41
CNC(=O)[C@H]1CCC[C@H]1NCCc1ccc(Cl)cc1	ZINC000450847120	CE	On-Demand	Anodyne	SLC6A1	0	41
CNC(=O)[C@@H]1CCC[C@H]1NCCc1ccc(Cl)cc1	ZINC000450847121	CE	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](O)CCCN1C(=O)C[C@H](Cc2ccc(F)cc2)C1=O	ZINC000450847123	CD	On-Demand	Anodyne	CCR3	43	31
C[C@@H](O)CCCN1C(=O)C[C@@H](Cc2ccc(F)cc2)C1=O	ZINC000450847128	CD	On-Demand	Anodyne	CCR3	43	31
C[C@H](O)CCCN1C(=O)C[C@@H](Cc2ccc(F)cc2)C1=O	ZINC000450847129	CD	On-Demand	Anodyne	CCR3	43	31
C[C@@H](O)CCCN1C(=O)C[C@H](Cc2ccc(F)cc2)C1=O	ZINC000450847130	CD	On-Demand	Anodyne	CCR3	43	31
CC(C)(CC(N)=O)NC(=O)c1ccc2cnccc2c1	ZINC000450847153	CD	On-Demand	Anodyne	AKT1	18	41
C=CC[C@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450847187	CD	On-Demand	Mild	CAN2	0	40
C=CC[C@@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450847188	CD	On-Demand	Mild	NCE103	19	40
CCc1cc(NCC2(CC)COC2)n2ncnc2n1	ZINC000450847209	CD	On-Demand	Anodyne	DHOD	0	50
OC[C@H](CNc1ncnc2[nH]ccc12)Cc1cc(Br)ccc1F	ZINC000450847241	GF	On-Demand	Anodyne	AKT1	40	31
OC[C@@H](CNc1ncnc2[nH]ccc12)Cc1cc(Br)ccc1F	ZINC000450847242	GF	On-Demand	Anodyne	AKT1	40	31
O=C(Nc1ccccc1)c1ccc(N2CCCC[C@H]2C(=O)NCC(F)F)nn1	ZINC000450847245	GE	On-Demand	Anodyne	SCD1	56	44
O=C(Nc1ccccc1)c1ccc(N2CCCC[C@H]2C(=O)NCC(F)F)nn1	ZINC000450847245	GE	On-Demand	Anodyne	SCD	49	44
CNC(=O)C[C@@H](C)Nc1ncnc2c(F)c(OC)ccc12	ZINC000450847248	CD	On-Demand	Anodyne	PDE6A	41	31
CNC(=O)C[C@H](C)Nc1ncnc2c(F)c(OC)ccc12	ZINC000450847249	CD	On-Demand	Anodyne	PDE6A	41	31
C[C@H]1COC(C)(C)CN1CCCC(=O)c1ccccc1	ZINC000450847250	CG	On-Demand	Anodyne	CYP2J2	56	40
CCN(CC(=O)OC(C)(C)C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450847257	FH	On-Demand	Anodyne	ACHE	17	44
CCCc1cc(N[C@H](C)CC(=O)NC)n2ncnc2n1	ZINC000450847289	CD	On-Demand	Anodyne	DHOD	0	40
CCCc1cc(N[C@@H](C)CC(=O)NC)n2ncnc2n1	ZINC000450847290	CD	On-Demand	Anodyne	DHOD	0	40
CNC(=O)C[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450847311	FG	On-Demand	Bother	TAAR1	20	50
CNC(=O)C[C@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450847312	FG	On-Demand	Bother	TAAR1	20	50
CO[C@H]1CN(C[C@H](O)Cc2ccccc2)C[C@@H]1OC	ZINC000450847313	CC	On-Demand	Anodyne	SLC18A2	43	35
CO[C@H]1CN(C[C@H](O)Cc2ccccc2)C[C@@H]1OC	ZINC000450847313	CC	On-Demand	Anodyne	VACHT_TETCF	0	48
CCc1ncc(CNc2c(C#N)cnc3c(OC)cc(OC)cc23)o1	ZINC000450847336	EG	On-Demand	Mild	SRC	72	36
COc1ccc(Cc2nnc(SCc3cn(C)nc3C)o2)cc1OC	ZINC000450847344	FG	On-Demand	Anodyne	PTK2	22	42
CCOC(=O)c1ccc(CN(C)C/C(C)=C/c2ccccc2)nc1	ZINC000450847345	DH	On-Demand	Anodyne	ACKR3	44	34
CCOC(=O)c1ccc(CN(C)C/C(C)=C\c2ccccc2)nc1	ZINC000450847346	DH	On-Demand	Anodyne	ACKR3	44	34
COc1ccc(CNC(=O)CCN[C@@H]2CCO[C@H]2C2CC2)c(OC)c1	ZINC000450847356	ED	On-Demand	Anodyne	NQO2	29	40
COc1ccc(CNC(=O)CCN[C@@H]2CCO[C@H]2C2CC2)c(OC)c1	ZINC000450847356	ED	On-Demand	Anodyne	MTNR1A	55	40
COc1ccc(CNC(=O)CCN[C@H]2CCO[C@H]2C2CC2)c(OC)c1	ZINC000450847357	ED	On-Demand	Anodyne	NQO2	29	40
COc1ccc(CNC(=O)CCN[C@H]2CCO[C@H]2C2CC2)c(OC)c1	ZINC000450847357	ED	On-Demand	Anodyne	MTNR1A	55	40
COc1ccc(CNC(=O)CCN[C@H]2CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450847358	ED	On-Demand	Anodyne	NQO2	29	40
COc1ccc(CNC(=O)CCN[C@H]2CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450847358	ED	On-Demand	Anodyne	MTNR1A	55	40
COc1ccc(CNC(=O)CCN[C@@H]2CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450847359	ED	On-Demand	Anodyne	NQO2	29	40
COc1ccc(CNC(=O)CCN[C@@H]2CCO[C@@H]2C2CC2)c(OC)c1	ZINC000450847359	ED	On-Demand	Anodyne	MTNR1A	55	40
Cn1cc(I)c(CNc2ncnc3c2ncn3C2CC2)n1	ZINC000450847367	GE	On-Demand	Anodyne	ADORA1	48	39
Cn1cc(I)c(CNc2ncnc3c2ncn3C2CC2)n1	ZINC000450847367	GE	On-Demand	Anodyne	ADORA2A	0	44
Cn1cc(I)c(CNc2ncnc3c2ncn3C2CC2)n1	ZINC000450847367	GE	On-Demand	Anodyne	ADORA3	55	41
CCc1ncc(CNc2ncnc3c(OC)cc(OC)cc23)o1	ZINC000450847371	DE	On-Demand	Anodyne	PDE6A	44	33
Cc1cc(-c2nc(C(=O)NC(C)(C)CC(N)=O)co2)ccn1	ZINC000450847398	DD	On-Demand	Anodyne	IRAK4	23	46
CCC1(CNc2ncnc3ccc(I)cc23)COC1	ZINC000450847402	FE	On-Demand	Anodyne	DYRK1A	23	40
CCC1(CNc2ncnc3ccc(I)cc23)COC1	ZINC000450847402	FE	On-Demand	Anodyne	CLK1	18	40
CCC1(CNc2ncnc3ccc(I)cc23)COC1	ZINC000450847402	FE	On-Demand	Anodyne	CLK2	27	40
CCC1(CNc2ncnc3ccc(I)cc23)COC1	ZINC000450847402	FE	On-Demand	Anodyne	CLK4	65	35
CCC1(CNc2ncnc3ccc(I)cc23)COC1	ZINC000450847402	FE	On-Demand	Anodyne	CD38	52	36
CCC1(CNc2ncnc3ccc(I)cc23)COC1	ZINC000450847402	FE	On-Demand	Anodyne	DYRK1B	17	40
CC(C)N(C)c1cnn([C@H]2CCCN(CCCC(=O)c3ccccc3)C2)c(=O)c1	ZINC000450847407	GG	On-Demand	Anodyne	SLC6A1	116	39
CC(C)N(C)c1cnn([C@H]2CCCN(CCCC(=O)c3ccccc3)C2)c(=O)c1	ZINC000450847407	GG	On-Demand	Anodyne	CYP2J2	53	37
CC(C)N(C)c1cnn([C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)c(=O)c1	ZINC000450847409	GG	On-Demand	Anodyne	SLC6A1	116	39
CC(C)N(C)c1cnn([C@@H]2CCCN(CCCC(=O)c3ccccc3)C2)c(=O)c1	ZINC000450847409	GG	On-Demand	Anodyne	CYP2J2	53	37
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(CCN(C)Cc2ccccc2)n1	ZINC000450847415	GF	On-Demand	Anodyne	SOAT1	22	49
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(CCN(C)Cc2ccccc2)n1	ZINC000450847418	GF	On-Demand	Anodyne	SOAT1	22	49
CCC1(CNc2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])COC1	ZINC000450847419	FD	On-Demand	Bother	TAAR1	22	48
COC(=O)c1ccc(CN[C@@H]2CCO[C@H]2C2CC2)cc1Cl	ZINC000450847432	DF	On-Demand	Anodyne	SSTR3	0	43
COC(=O)c1ccc(CN[C@H]2CCO[C@H]2C2CC2)cc1Cl	ZINC000450847434	DF	On-Demand	Anodyne	SSTR3	0	43
COC(=O)c1ccc(CN[C@@H]2CCO[C@@H]2C2CC2)cc1Cl	ZINC000450847436	DF	On-Demand	Anodyne	SSTR3	0	43
COC(=O)c1ccc(CN[C@H]2CCO[C@@H]2C2CC2)cc1Cl	ZINC000450847437	DF	On-Demand	Anodyne	SSTR3	0	43
C[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)c2ccccc21	ZINC000450847452	EJ	On-Demand	Anodyne	AVPR2	47	43
C[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)c2ccccc21	ZINC000450847452	EJ	On-Demand	Anodyne	AVPR1A	16	41
C[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)c2ccccc21	ZINC000450847452	EJ	On-Demand	Anodyne	SFRP1	67	40
C[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)c2ccccc21	ZINC000450847452	EJ	On-Demand	Anodyne	WNT3	54	33
C[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)c2ccccc21	ZINC000450847453	EJ	On-Demand	Anodyne	AVPR2	47	43
C[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)c2ccccc21	ZINC000450847453	EJ	On-Demand	Anodyne	AVPR1A	16	41
C[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)c2ccccc21	ZINC000450847453	EJ	On-Demand	Anodyne	SFRP1	67	40
C[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)c2ccccc21	ZINC000450847453	EJ	On-Demand	Anodyne	WNT3	54	33
C=CC[C@@H](CO)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450847463	DF	On-Demand	Mild	RBP4	54	37
CCC1(CNc2ccnc3cc(F)ccc23)COC1	ZINC000450847478	CG	On-Demand	Anodyne	HRP1_PLAFA	60	32
Cc1cc(CNC(=O)C2(Cc3ccccc3)CCOCC2)ccc1Cl	ZINC000450847491	FI	On-Demand	Anodyne	NR3C2	17	41
Cc1cc(CNC(=O)C2(Cc3ccccc3)CCOCC2)ccc1Cl	ZINC000450847491	FI	On-Demand	Anodyne	GNRHR	0	42
CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)C(CC(C)C)CC(C)C	ZINC000450847505	EH	On-Demand	Anodyne	CAPN2	15	40
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	HTR1A	52	46
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	DRD2	59	47
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	DRD4	55	42
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	HRH2	26	40
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	HTR1D	23	40
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	HTR1B	22	40
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	HTR2A	25	42
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	DRD3	46	46
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	HTR7	39	43
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	SIGMAR1	28	40
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	FAAH	24	42
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	ABCB1	33	43
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	MGLL	0	40
COc1ccc(F)c(N2CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450847532	EG	On-Demand	Anodyne	ABHD6	0	40
CCC(=O)c1ccc(N[C@H](C)Cc2cnn(C)c2)c(S(N)(=O)=O)c1	ZINC000450847559	FD	On-Demand	Anodyne	CA13	43	39
CCC(=O)c1ccc(N[C@@H](C)Cc2cnn(C)c2)c(S(N)(=O)=O)c1	ZINC000450847560	FD	On-Demand	Anodyne	CA13	43	39
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1CCc1cscn1	ZINC000450847563	EG	On-Demand	Anodyne	SLC12A5	95	48
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1CCc1cscn1	ZINC000450847564	EG	On-Demand	Anodyne	SLC12A5	95	48
CCc1nc(C2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)CC2)n[nH]1	ZINC000450847567	FI	On-Demand	Anodyne	AKT2	50	38
CCc1nc(C2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)CC2)n[nH]1	ZINC000450847568	FI	On-Demand	Anodyne	AKT2	50	38
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)cn1	ZINC000450847569	GJ	On-Demand	Anodyne	G2YM83_BOTF4	52	32
CCc1cc(N[C@@H](C)Cc2cnn(C)c2)n2ncnc2n1	ZINC000450847575	CD	On-Demand	Anodyne	DHOD	0	46
CCc1cc(N[C@H](C)Cc2cnn(C)c2)n2ncnc2n1	ZINC000450847576	CD	On-Demand	Anodyne	DHOD	0	46
C[C@H]1CN(C[C@H](O)Cc2ccccc2)C[C@H](C)S1=O	ZINC000450847609	CD	On-Demand	Anodyne	ANPEP	43	30
C[C@H]1CN(C[C@H](O)Cc2ccccc2)C[C@H](C)S1=O	ZINC000450847609	CD	On-Demand	Anodyne	VACHT_TETCF	0	44
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	FKBP1A	48	56
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	MMP13	50	42
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	ADAM17	41	39
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	ITGA4	40	44
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	AMY2	41	37
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	CAPNS1	22	44
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	MMP3	56	42
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	CAPN1	18	47
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	MMP7	68	42
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	MMP1	55	45
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	SFRP1	47	33
CCN(CC)CCOCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450847610	GD	On-Demand	Anodyne	WNT3	53	33
CCOC(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)nc1	ZINC000450847619	FF	On-Demand	Anodyne	DRD4	53	33
CCOC(=O)c1ccc(CN2CCN(c3cc(OC)ccc3F)CC2)nc1	ZINC000450847619	FF	On-Demand	Anodyne	P2RY12	34	43
COC(=O)c1ccc(CN2C[C@H](OC)[C@@H](OC)C2)cc1Cl	ZINC000450847640	DD	On-Demand	Anodyne	OPRK1	30	40
COC(=O)c1ccc(CN2C[C@@H](OC)[C@H](OC)C2)cc1Cl	ZINC000450847641	DD	On-Demand	Anodyne	OPRK1	30	40
O=C(CCCN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1)c1ccc(F)cc1	ZINC000450847698	GI	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1)c1ccc(F)cc1	ZINC000450847698	GI	On-Demand	Anodyne	SLC18A3	0	40
O=C(CCCN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1)c1ccc(F)cc1	ZINC000450847698	GI	On-Demand	Anodyne	CYP2J2	48	35
C=CC[C@H](CO)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450847711	CF	On-Demand	Mild	GPR88	0	40
C=CC[C@H](CO)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450847713	CF	On-Demand	Mild	GPR88	0	40
C=CC[C@H](CO)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450847714	CF	On-Demand	Mild	GPR88	0	40
C=CC[C@H](CO)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450847715	CF	On-Demand	Mild	GPR88	0	40
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2sc3c(c12)CCCC3	ZINC000450847723	GG	On-Demand	Anodyne	RBP4	16	42
CCCOc1cccc(Cn2nnc(CN(C)C(=O)c3ccccc3)n2)c1	ZINC000450847750	FF	On-Demand	Anodyne	TSPAN17	0	40
N#Cc1ccc(N2CCCC[C@H]2C(=O)NCC(F)F)nc1	ZINC000450847751	CD	On-Demand	Mild	GPBAR1	23	42
N#Cc1ccc(N2CCCC[C@H]2C(=O)NCC(F)F)nc1	ZINC000450847751	CD	On-Demand	Mild	ERG	0	45
CCC1(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])COC1	ZINC000450847753	ED	On-Demand	Bother	BDKRB1	23	42
CCC(CC)Oc1ccc(C(=O)NC[C@@H]2CCc3nccn3C2)cc1	ZINC000450847798	EG	On-Demand	Anodyne	CACNA1I	43	32
CCC(CC)Oc1ccc(C(=O)NC[C@H]2CCc3nccn3C2)cc1	ZINC000450847799	EG	On-Demand	Anodyne	CACNA1I	43	32
CCOc1nc2ccc(C(=O)NC[C@H]3CCc4nccn4C3)cc2[nH]1	ZINC000450847802	EE	On-Demand	Anodyne	CACNA1I	44	37
CCOc1nc2ccc(C(=O)NC[C@@H]3CCc4nccn4C3)cc2[nH]1	ZINC000450847804	EE	On-Demand	Anodyne	CACNA1I	44	37
COc1ccc(CNC(=O)CCN(CCO)[C@@H]2CC[C@H](C)C2)c(OC)c1	ZINC000450847817	FE	On-Demand	Anodyne	MTNR1A	44	38
COc1ccc(CNC(=O)CCN(CCO)[C@@H]2CC[C@@H](C)C2)c(OC)c1	ZINC000450847818	FE	On-Demand	Anodyne	MTNR1A	44	38
COc1ccc(CNC(=O)CCN(CCO)[C@H]2CC[C@H](C)C2)c(OC)c1	ZINC000450847819	FE	On-Demand	Anodyne	MTNR1A	44	38
COc1ccc(CNC(=O)CCN(CCO)[C@H]2CC[C@@H](C)C2)c(OC)c1	ZINC000450847820	FE	On-Demand	Anodyne	MTNR1A	44	38
Cc1ccc(F)c(Cn2nnc([C@H](NC(=O)c3ccccc3)C(C)C)n2)c1	ZINC000450847828	FG	On-Demand	Anodyne	SOAT1	16	44
Cc1ccc(F)c(Cn2nnc([C@@H](NC(=O)c3ccccc3)C(C)C)n2)c1	ZINC000450847830	FG	On-Demand	Anodyne	SOAT1	16	44
Cn1ccnc1[C@H]1OCC[C@@H]1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450847845	GD	On-Demand	Anodyne	MAPK13	42	30
c1ccc2c(-c3nnc(SCC[C@H]4CCOC4)o3)cccc2c1	ZINC000450847864	EI	On-Demand	Anodyne	ALOX15	63	47
c1ccc2c(-c3nnc(SCC[C@@H]4CCOC4)o3)cccc2c1	ZINC000450847865	EI	On-Demand	Anodyne	ALOX15	63	47
CC(C)CC(CC(C)C)C(=O)N[C@H]1CCO[C@@H]1c1cccnc1	ZINC000450847889	DH	On-Demand	Anodyne	CAPN2	20	42
C[C@H](O)CCCN(CCc1ccccc1)Cc1cccnc1	ZINC000450847897	CG	On-Demand	Anodyne	NR1D1	42	34
C[C@@H](O)CCCN(CCc1ccccc1)Cc1cccnc1	ZINC000450847898	CG	On-Demand	Anodyne	NR1D1	42	34
CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450847925	FF	On-Demand	Anodyne	SSTR5	41	35
C[C@@H](Cc1cnn(C)c1)Nc1ncnc2ccc(I)cc12	ZINC000450847940	GG	On-Demand	Anodyne	CD38	42	33
C[C@H](Cc1cnn(C)c1)Nc1ncnc2ccc(I)cc12	ZINC000450847941	GG	On-Demand	Anodyne	CD38	42	33
CC(=O)c1ccc(C#N)c(N[C@@H]2CCO[C@@H](c3ccnn3C)C2)c1	ZINC000450847962	DF	On-Demand	Mild	CSNK2A1	46	31
CC(=O)c1ccc(C#N)c(N[C@H]2CCO[C@@H](c3ccnn3C)C2)c1	ZINC000450847963	DF	On-Demand	Mild	CSNK2A1	46	31
CC(=O)c1ccc(C#N)c(N[C@@H]2CCO[C@H](c3ccnn3C)C2)c1	ZINC000450847964	DF	On-Demand	Mild	CSNK2A1	46	31
CC(=O)c1ccc(C#N)c(N[C@H]2CCO[C@H](c3ccnn3C)C2)c1	ZINC000450847965	DF	On-Demand	Mild	CSNK2A1	46	31
COCCOC[C@H](O)CN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1	ZINC000450848069	GE	On-Demand	Anodyne	NPPA	26	41
COCCOC[C@@H](O)CN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1	ZINC000450848070	GE	On-Demand	Anodyne	NPPA	26	41
CCN1CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1=O	ZINC000450848074	CE	On-Demand	Anodyne	CHRM4	15	41
CCN1CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1=O	ZINC000450848074	CE	On-Demand	Anodyne	CHRM5	39	44
C=CC[C@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450848075	CC	On-Demand	Mild	HPGDS	15	43
C=CC[C@@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450848076	CC	On-Demand	Mild	HPGDS	15	43
COc1ccc(Cc2nnc(SCc3cccc(C(C)=O)c3)o2)cc1OC	ZINC000450848077	GI	On-Demand	Anodyne	GSK3B	0	50
COc1ccc(Cc2nnc(SCc3cccc(C(C)=O)c3)o2)cc1OC	ZINC000450848077	GI	On-Demand	Anodyne	PTK2	0	43
COc1ccc(Cc2nnc(SCc3cccc(C(C)=O)c3)o2)cc1OC	ZINC000450848077	GI	On-Demand	Anodyne	ENPP1	40	31
Cn1cc(I)c(CNc2ccc(S(C)(=O)=O)cc2)n1	ZINC000450848079	GE	On-Demand	Anodyne	GHSR	19	41
CCC1(CNc2ncc([N+](=O)[O-])s2)COC1	ZINC000450848097	BD	On-Demand	Bother	MAPK9	15	42
CNC(=O)[C@H]1CCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450848109	CD	On-Demand	Anodyne	MME	41	35
CNC(=O)[C@H]1CCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450848109	CD	On-Demand	Anodyne	POL	0	45
CNC(=O)[C@H]1CCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450848110	CD	On-Demand	Anodyne	MME	41	35
CNC(=O)[C@H]1CCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450848110	CD	On-Demand	Anodyne	POL	0	45
CCc1ncc(CNc2ccc(S(C)(=O)=O)cc2)o1	ZINC000450848133	CE	On-Demand	Anodyne	GHSR	15	41
COC(=O)c1ccc(CC(=O)NC(C)(C)CC(N)=O)cc1	ZINC000450848138	CC	On-Demand	Anodyne	ACR	47	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)CC(N)=O	ZINC000450848167	DE	On-Demand	Anodyne	SORT1	15	40
CCCc1ncc(CNc2ncccc2OCc2ccccc2)o1	ZINC000450848173	DI	On-Demand	Anodyne	PPIA	43	40
CO[C@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@@H]1OC	ZINC000450848179	CD	On-Demand	Anodyne	MLNR	50	36
CO[C@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@@H]1OC	ZINC000450848179	CD	On-Demand	Anodyne	NOD2	41	37
CO[C@@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@H]1OC	ZINC000450848181	CD	On-Demand	Anodyne	MLNR	50	36
CO[C@@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@H]1OC	ZINC000450848181	CD	On-Demand	Anodyne	NOD2	41	37
CC(C)[C@@H]1CN(CCc2ccc(Cl)cc2)CCN1C	ZINC000450848204	CG	On-Demand	Anodyne	SIGMAR1	21	43
CC(C)[C@@H]1CN(CCc2ccc(Cl)cc2)CCN1C	ZINC000450848204	CG	On-Demand	Anodyne	BIRC2	34	41
CC(C)[C@H]1CN(CCc2ccc(Cl)cc2)CCN1C	ZINC000450848205	CG	On-Demand	Anodyne	SIGMAR1	21	43
CC(C)[C@H]1CN(CCc2ccc(Cl)cc2)CCN1C	ZINC000450848205	CG	On-Demand	Anodyne	BIRC2	34	41
OCCN(Cc1cccc(F)c1)Cc1ccccc1OC1CC1	ZINC000450848252	DG	On-Demand	Anodyne	SLC5A4	54	37
CCC(CC)Oc1ccc(C(=O)N[C@]2(CO)CCOC2)cc1	ZINC000450848270	DE	On-Demand	Anodyne	ADAMTS1	0	40
CCC(CC)Oc1ccc(C(=O)N[C@@]2(CO)CCOC2)cc1	ZINC000450848273	DE	On-Demand	Anodyne	ADAMTS1	0	40
CC(=O)CCCCCn1nnc(C2(NC(=O)c3ccccc3)CCCC2)n1	ZINC000450848333	FG	On-Demand	Anodyne	SOAT1	18	40
O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450848366	GJ	On-Demand	Anodyne	ACE	26	40
O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450848366	GJ	On-Demand	Anodyne	PREP	46	47
O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450848366	GJ	On-Demand	Anodyne	LGMN	40	34
O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450848366	GJ	On-Demand	Anodyne	CFTR	46	37
O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450848366	GJ	On-Demand	Anodyne	XIAP	31	40
O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450848366	GJ	On-Demand	Anodyne	TMPRSS11D	46	32
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)S1=O	ZINC000450848370	DF	On-Demand	Anodyne	DRD2	36	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)S1=O	ZINC000450848370	DF	On-Demand	Anodyne	DRD1	0	50
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)S1=O	ZINC000450848370	DF	On-Demand	Anodyne	DRD4	23	57
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)S1=O	ZINC000450848370	DF	On-Demand	Anodyne	HTR2A	27	52
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)S1=O	ZINC000450848370	DF	On-Demand	Anodyne	ERG2	22	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)S1=O	ZINC000450848370	DF	On-Demand	Anodyne	SLC18A3	0	51
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)S1=O	ZINC000450848370	DF	On-Demand	Anodyne	CYP2J2	56	39
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)S1=O	ZINC000450848373	DF	On-Demand	Anodyne	DRD2	36	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)S1=O	ZINC000450848373	DF	On-Demand	Anodyne	DRD1	0	50
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)S1=O	ZINC000450848373	DF	On-Demand	Anodyne	DRD4	23	57
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)S1=O	ZINC000450848373	DF	On-Demand	Anodyne	HTR2A	27	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)S1=O	ZINC000450848373	DF	On-Demand	Anodyne	ERG2	22	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)S1=O	ZINC000450848373	DF	On-Demand	Anodyne	SLC18A3	0	51
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)S1=O	ZINC000450848373	DF	On-Demand	Anodyne	CYP2J2	56	39
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450848374	DF	On-Demand	Anodyne	DRD2	36	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450848374	DF	On-Demand	Anodyne	DRD1	0	50
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450848374	DF	On-Demand	Anodyne	DRD4	23	57
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450848374	DF	On-Demand	Anodyne	HTR2A	27	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450848374	DF	On-Demand	Anodyne	ERG2	22	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450848374	DF	On-Demand	Anodyne	SLC18A3	0	51
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450848374	DF	On-Demand	Anodyne	CYP2J2	56	39
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1Cc1cnns1	ZINC000450848375	EF	On-Demand	Anodyne	SLC12A5	93	47
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1Cc1cnns1	ZINC000450848377	EF	On-Demand	Anodyne	SLC12A5	93	47
CCCc1cc(N[C@H](C)Cc2cnn(C)c2)n2ncnc2n1	ZINC000450848413	CD	On-Demand	Anodyne	DHOD	0	40
CCCc1cc(N[C@@H](C)Cc2cnn(C)c2)n2ncnc2n1	ZINC000450848414	CD	On-Demand	Anodyne	DHOD	0	40
C[C@@H](Cc1cnn(C)c1)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450848420	DG	On-Demand	Mild	AR	51	41
C[C@H](Cc1cnn(C)c1)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450848421	DG	On-Demand	Mild	AR	51	41
Cc1cc(N[C@H](C)Cc2cnn(C)c2)nc(-c2cccnc2)n1	ZINC000450848424	DE	On-Demand	Anodyne	ROS1	61	40
Cc1cc(N[C@@H](C)Cc2cnn(C)c2)nc(-c2cccnc2)n1	ZINC000450848425	DE	On-Demand	Anodyne	ROS1	61	40
CC(=O)CCCCCn1cnc(-c2ccccc2)n1	ZINC000450848432	CG	On-Demand	Anodyne	FAAH	48	36
CC(=O)CCCCCn1cnc(-c2ccccc2)n1	ZINC000450848432	CG	On-Demand	Anodyne	CES1	41	37
COc1ccc(F)c(N2CCN(C[C@@H]3CCNC(=O)CC3)CC2)c1	ZINC000450848435	ED	On-Demand	Anodyne	DRD4	43	33
COc1ccc(F)c(N2CCN(C[C@H]3CCNC(=O)CC3)CC2)c1	ZINC000450848436	ED	On-Demand	Anodyne	DRD4	43	33
CCn1cc([C@@H]2CN(Cc3ccc(Cl)c(OC)c3)CCO2)cn1	ZINC000450848437	EG	On-Demand	Anodyne	SSTR5	42	36
CCn1cc([C@H]2CN(Cc3ccc(Cl)c(OC)c3)CCO2)cn1	ZINC000450848438	EG	On-Demand	Anodyne	SSTR5	42	36
CN(Cc1nnn(CC(=O)CC[C@@H]2CCCCO2)n1)C(=O)c1ccccc1	ZINC000450848467	FD	On-Demand	Anodyne	SCARB1	43	36
CN(Cc1nnn(CC(=O)CC[C@H]2CCCCO2)n1)C(=O)c1ccccc1	ZINC000450848468	FD	On-Demand	Anodyne	SCARB1	43	36
COc1ccc(F)c(N2CCN(Cc3cccnc3N)CC2)c1	ZINC000450848486	DE	On-Demand	Anodyne	DRD4	41	31
COc1ccc(F)c(N2CCN(Cc3cccnc3N)CC2)c1	ZINC000450848486	DE	On-Demand	Anodyne	DRD3	28	42
CC(=O)CCCCCOc1ccc(C#N)c(F)c1	ZINC000450848493	BG	On-Demand	Mild	P2RY12	24	41
CC(=O)CCCCCOc1ccc(C#N)c(F)c1	ZINC000450848493	BG	On-Demand	Mild	SHC	24	43
CC(=O)CCCCCOc1ccc(C#N)c(F)c1	ZINC000450848493	BG	On-Demand	Mild	PLA2G4B	74	38
CC(=O)CCCCCOc1ccc(C#N)c(F)c1	ZINC000450848493	BG	On-Demand	Mild	LSS	30	40
CCCc1nc(C)c(COc2ccc([N+](=O)[O-])cc2Br)o1	ZINC000450848505	FI	On-Demand	Bother	S1PR4	0	40
O=C(CCCN1CCc2ccnc(O)c2C1)c1ccc(Br)cc1	ZINC000450848536	GH	On-Demand	Anodyne	CYP2J2	46	33
COC(=O)c1coc(CN(Cc2ccc(F)cc2)C2CCOCC2)n1	ZINC000450848549	EF	On-Demand	Anodyne	ACAT	41	38
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)Cc2cccnc2)cc1	ZINC000450848554	GI	On-Demand	Anodyne	TBXAS1	41	36
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)Cc2cccnc2)cc1	ZINC000450848554	GI	On-Demand	Anodyne	RORC	29	50
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)Cc2cccnc2)cc1	ZINC000450848554	GI	On-Demand	Anodyne	NAMPT	32	41
CCS(=O)(=O)c1ccc(CN(CCc2ccccc2)Cc2cccnc2)cc1	ZINC000450848554	GI	On-Demand	Anodyne	NR1D1	49	41
CCCc1ncc(CNc2cc(CC)nc3ncnn23)o1	ZINC000450848559	CE	On-Demand	Anodyne	DHOD	0	48
CC(=O)CCCCCn1ccsc1=O	ZINC000450848565	BE	On-Demand	Anodyne	PAOX	40	42
CCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450848575	DE	On-Demand	Anodyne	EGFR	35	47
CCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450848575	DE	On-Demand	Anodyne	ERBB2	16	42
CCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450848575	DE	On-Demand	Anodyne	FGFR1	19	40
CCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450848575	DE	On-Demand	Anodyne	FLT1	28	40
CCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450848575	DE	On-Demand	Anodyne	FBP1	16	42
CCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450848575	DE	On-Demand	Anodyne	EPHA2	45	36
CCc1ncc(CNc2ncnc3cc(F)c(OC)cc23)o1	ZINC000450848575	DE	On-Demand	Anodyne	CLK4	43	36
CCc1ncc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])o1	ZINC000450848585	EF	On-Demand	Bother	TAAR1	15	41
CCCOc1cccc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1	ZINC000450848601	FD	On-Demand	Anodyne	PDE5A	18	42
CCCOc1cccc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1	ZINC000450848601	FD	On-Demand	Anodyne	HRH2	32	44
CCCOc1cccc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1	ZINC000450848601	FD	On-Demand	Anodyne	ADORA2B	46	37
CCCOc1cccc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1	ZINC000450848601	FD	On-Demand	Anodyne	UPP1	16	41
CCc1ncc(CNc2ncnc3ccc(SC)cc23)o1	ZINC000450848625	DF	On-Demand	Anodyne	DYRK1A	23	42
CCc1ncc(CNc2ncnc3ccc(SC)cc23)o1	ZINC000450848625	DF	On-Demand	Anodyne	CLK2	27	42
CCc1ncc(CNc2ncnc3ccc(SC)cc23)o1	ZINC000450848625	DF	On-Demand	Anodyne	CLK4	71	43
CCc1ncc(CNc2ncnc3ccc(SC)cc23)o1	ZINC000450848625	DF	On-Demand	Anodyne	DYRK1B	29	42
CCc1nc(C)c(COc2ccc(C(=O)NCCN(CC)CC)cc2)o1	ZINC000450848633	FG	On-Demand	Anodyne	KCNQ1	0	54
CC(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848640	CF	On-Demand	Anodyne	DRD2	28	41
CC(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848640	CF	On-Demand	Anodyne	DRD4	24	44
CC(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848640	CF	On-Demand	Anodyne	SLC6A1	83	39
CC(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848640	CF	On-Demand	Anodyne	HTR7	26	47
CC(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848640	CF	On-Demand	Anodyne	ABCB1	0	44
CC(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848640	CF	On-Demand	Anodyne	CYP2J2	63	45
CC(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848644	CF	On-Demand	Anodyne	DRD2	28	41
CC(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848644	CF	On-Demand	Anodyne	DRD4	24	44
CC(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848644	CF	On-Demand	Anodyne	SLC6A1	83	39
CC(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848644	CF	On-Demand	Anodyne	HTR7	26	47
CC(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848644	CF	On-Demand	Anodyne	ABCB1	0	44
CC(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCN1C	ZINC000450848644	CF	On-Demand	Anodyne	CYP2J2	63	45
CN(CCN1CC(=O)N(CC(F)(F)F)C1)Cc1ccccc1	ZINC000450848665	DD	On-Demand	Anodyne	SIGMAR1	16	41
C[C@@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)c1nccs1	ZINC000450848701	FF	On-Demand	Anodyne	F7	25	40
C[C@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)c1nccs1	ZINC000450848702	FF	On-Demand	Anodyne	F7	25	40
CCN1CCN(C(=O)c2c(C)cccc2Cl)CC1=O	ZINC000450848703	CD	On-Demand	Anodyne	P2RX7	25	40
Cc1ccnc(N2CCCC[C@H]2C(=O)NCC(F)F)n1	ZINC000450848707	CD	On-Demand	Anodyne	GPBAR1	16	45
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450848715	GH	On-Demand	Anodyne	SMO	56	36
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450848715	GH	On-Demand	Anodyne	ETHR	50	39
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450848716	GH	On-Demand	Anodyne	SMO	56	36
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3Br)no2)CC1	ZINC000450848716	GH	On-Demand	Anodyne	ETHR	50	39
CCSCc1ccc(Nc2cc(C)nc3ncnn23)cc1	ZINC000450848717	CG	On-Demand	Anodyne	DHOD	0	76
Cn1cc(I)c(CNc2cc(N3CCCC3)ncn2)n1	ZINC000450848742	GE	On-Demand	Anodyne	HRH4	15	50
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(CC[C@@H]2CCOC2)n1	ZINC000450848793	EE	On-Demand	Anodyne	SOAT1	16	46
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(CC[C@H]2CCOC2)n1	ZINC000450848798	EE	On-Demand	Anodyne	SOAT1	16	46
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(CC[C@H]2CCOC2)n1	ZINC000450848799	EE	On-Demand	Anodyne	SOAT1	16	46
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(CC[C@@H]2CCOC2)n1	ZINC000450848801	EE	On-Demand	Anodyne	SOAT1	16	46
CCc1nc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n[nH]1	ZINC000450848834	DF	On-Demand	Anodyne	DRD4	28	41
CCc1nc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n[nH]1	ZINC000450848834	DF	On-Demand	Anodyne	SIGMAR1	27	41
CCc1nc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n[nH]1	ZINC000450848834	DF	On-Demand	Anodyne	AKT2	47	38
C[C@H](Cc1cnn(C)c1)Nc1ccnc2cc(Br)ccc12	ZINC000450848867	EH	On-Demand	Anodyne	HRP1_PLAFA	40	38
C[C@H](Cc1cnn(C)c1)Nc1ccnc2cc(Br)ccc12	ZINC000450848867	EH	On-Demand	Anodyne	HNMT	49	31
C[C@@H](Cc1cnn(C)c1)Nc1ccnc2cc(Br)ccc12	ZINC000450848868	EH	On-Demand	Anodyne	HRP1_PLAFA	40	38
C[C@@H](Cc1cnn(C)c1)Nc1ccnc2cc(Br)ccc12	ZINC000450848868	EH	On-Demand	Anodyne	HNMT	49	31
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1CO	ZINC000450848879	CE	On-Demand	Anodyne	SLC6A1	0	43
CCc1ccc([C@@H]2CN(Cc3ccc(C(C)=O)cc3)CCO2)cc1	ZINC000450848885	DI	On-Demand	Anodyne	DRD4	18	40
CCc1ccc([C@H]2CN(Cc3ccc(C(C)=O)cc3)CCO2)cc1	ZINC000450848886	DI	On-Demand	Anodyne	DRD4	18	40
CCc1nc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n[nH]1	ZINC000450848913	EG	On-Demand	Anodyne	DRD4	30	40
CCc1nc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n[nH]1	ZINC000450848913	EG	On-Demand	Anodyne	DRD3	0	42
CCc1nc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n[nH]1	ZINC000450848913	EG	On-Demand	Anodyne	AKT2	45	38
CCc1nc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n[nH]1	ZINC000450848913	EG	On-Demand	Anodyne	AKT1	23	40
FC(F)c1ccnc(NC2CCc3ccccc3CC2)n1	ZINC000450848914	CH	On-Demand	Anodyne	MAPK1	50	33
CC(=O)CCCCCSc1nnc(-c2cccc3ccccc23)o1	ZINC000450848938	EK	On-Demand	Anodyne	ALOX15	82	51
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCO[C@@H]1c1cccnc1	ZINC000450848959	FH	On-Demand	Anodyne	CCR2	22	41
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)CCS1	ZINC000450848961	DG	On-Demand	Anodyne	SIGMAR1	43	40
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)CCS1	ZINC000450848962	DG	On-Demand	Anodyne	SIGMAR1	43	40
CC(C)(CC(N)=O)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450848991	FD	On-Demand	Mild	AR	15	43
CC(C)(CC(N)=O)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450848992	FD	On-Demand	Mild	AR	15	43
C=CC[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450849015	CD	On-Demand	Mild	FPR1	42	33
C=CC[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450849016	CD	On-Demand	Mild	FPR1	42	33
CCc1ncc(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])o1	ZINC000450849017	FE	On-Demand	Bother	BDKRB1	21	40
CCCc1ncc(CNc2ccnc3cc(Cl)ccc23)o1	ZINC000450849032	DI	On-Demand	Anodyne	HRP1_PLAFA	113	42
CCCc1ncc(CNc2ccnc3cc(Cl)ccc23)o1	ZINC000450849032	DI	On-Demand	Anodyne	HNMT	60	43
CCCc1ncc(CNc2ccnc3cc(Cl)ccc23)o1	ZINC000450849032	DI	On-Demand	Anodyne	BOTA	22	49
CCCc1ncc(CNc2ccnc3cc(Cl)ccc23)o1	ZINC000450849032	DI	On-Demand	Anodyne	RBP_CHICK	0	41
COC(=O)c1ccc(CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1Cl	ZINC000450849114	GI	On-Demand	Anodyne	SSTR3	21	46
COC(=O)c1ccc(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1Cl	ZINC000450849115	GI	On-Demand	Anodyne	SSTR3	21	46
COC(=O)c1ccc(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1Cl	ZINC000450849116	GI	On-Demand	Anodyne	SSTR3	21	46
COC(=O)c1ccc(CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1Cl	ZINC000450849117	GI	On-Demand	Anodyne	SSTR3	21	46
O=C(NCC(F)F)[C@@H]1CCCCN1c1nccc(C(F)(F)F)n1	ZINC000450849129	EE	On-Demand	Anodyne	GPBAR1	15	44
O=C(NCC(F)F)[C@@H]1CCCCN1c1cnc2ccccc2n1	ZINC000450849158	DE	On-Demand	Anodyne	HCRTR1	15	41
c1cnc(NC2CCc3ccccc3CC2)nc1	ZINC000450849248	BF	On-Demand	Anodyne	MAPK8	0	43
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1CO	ZINC000450849250	CE	On-Demand	Anodyne	DRD2	31	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1CO	ZINC000450849250	CE	On-Demand	Anodyne	DRD4	0	55
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1CO	ZINC000450849250	CE	On-Demand	Anodyne	SLC18A3	0	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1CO	ZINC000450849250	CE	On-Demand	Anodyne	CYP2J2	53	38
CCC1(CNc2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])COC1	ZINC000450849283	FD	On-Demand	Bother	TAAR1	22	48
CCC1(CNc2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])COC1	ZINC000450849284	FD	On-Demand	Bother	TAAR1	19	48
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccc3Cl)o2)C1	ZINC000450849305	DI	On-Demand	Anodyne	RTT109	0	41
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccc3Cl)o2)C1	ZINC000450849307	DI	On-Demand	Anodyne	RTT109	0	41
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccc3Cl)o2)C1	ZINC000450849308	DI	On-Demand	Anodyne	RTT109	0	41
OCC[C@H]1CCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450849309	CD	On-Demand	Anodyne	SLC18A2	55	41
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccc3Cl)o2)C1	ZINC000450849310	DI	On-Demand	Anodyne	RTT109	0	41
OCC[C@H]1CCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450849311	CD	On-Demand	Anodyne	SLC18A2	55	41
CCC(=O)CCCN1CCNC(=O)[C@@H]1c1ccc(OC(F)(F)F)cc1	ZINC000450849315	FF	On-Demand	Anodyne	EPHX2	23	40
CCC(=O)CCCN1CCNC(=O)[C@H]1c1ccc(OC(F)(F)F)cc1	ZINC000450849316	FF	On-Demand	Anodyne	EPHX2	23	40
CCN(CC)CCOCCNC(=O)c1cnn2ccc(C)cc12	ZINC000450849347	DD	On-Demand	Anodyne	EPHB3	33	47
C=CC[C@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450849396	CE	On-Demand	Mild	PIN1	26	41
C=CC[C@@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450849398	CE	On-Demand	Mild	PIN1	26	41
CCC1(CNc2ccc(S(C)(=O)=O)cc2F)COC1	ZINC000450849405	CE	On-Demand	Anodyne	GPR119	17	43
C=CC[C@H](CO)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450849417	CD	On-Demand	Mild	MMP13	15	42
C=CC[C@@H](CO)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450849418	CD	On-Demand	Mild	MMP13	15	42
COc1cc(CN2CCS[C@H](C)CC2)ccc1Cl	ZINC000450849441	CH	On-Demand	Anodyne	DRD4	33	40
COc1cc(CN2CCS[C@H](C)CC2)ccc1Cl	ZINC000450849441	CH	On-Demand	Anodyne	UTS2R	26	40
COc1cc(CN2CCS[C@@H](C)CC2)ccc1Cl	ZINC000450849442	CH	On-Demand	Anodyne	DRD4	33	40
COc1cc(CN2CCS[C@@H](C)CC2)ccc1Cl	ZINC000450849442	CH	On-Demand	Anodyne	UTS2R	26	40
CCc1ncc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)o1	ZINC000450849451	FE	On-Demand	Anodyne	LRRK2	32	40
CCc1ncc(CNc2ccc(C(=O)NC)cc2[N+](=O)[O-])o1	ZINC000450849466	DE	On-Demand	Bother	DRTS_TOXGO	16	47
CCS(=O)(=O)c1ccc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)cc1	ZINC000450849467	GC	On-Demand	Anodyne	ADORA2B	50	40
COc1cc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)ccc1Cl	ZINC000450849475	FD	On-Demand	Anodyne	ADORA2B	44	36
COc1cc(CN2CCN(S(=O)(=O)c3cc[nH]n3)CC2)ccc1Cl	ZINC000450849475	FD	On-Demand	Anodyne	SSTR5	46	37
CCc1cc(NCc2cnc(CC)o2)n2ncnc2n1	ZINC000450849512	CD	On-Demand	Anodyne	DHOD	0	51
C[C@@H]1CC[C@H](NC(=O)c2c[nH]c3nccc-3c2)C[C@H]1C	ZINC000450849535	CG	On-Demand	Anodyne	MAPK13	52	30
C[C@@H]1CC[C@@H](NC(=O)c2c[nH]c3nccc-3c2)C[C@H]1C	ZINC000450849536	CG	On-Demand	Anodyne	MAPK13	52	30
C[C@H]1C[C@@H](NC(=O)c2c[nH]c3nccc-3c2)CC[C@H]1C	ZINC000450849537	CG	On-Demand	Anodyne	MAPK13	52	30
C[C@H]1C[C@H](NC(=O)c2c[nH]c3nccc-3c2)CC[C@H]1C	ZINC000450849538	CG	On-Demand	Anodyne	MAPK13	52	30
C[C@@H]1CCCN(C(=O)c2cncc(Cl)c2)c2ccccc21	ZINC000450849544	DI	On-Demand	Anodyne	AVPR2	53	49
C[C@@H]1CCCN(C(=O)c2cncc(Cl)c2)c2ccccc21	ZINC000450849544	DI	On-Demand	Anodyne	AVPR1A	16	43
C[C@@H]1CCCN(C(=O)c2cncc(Cl)c2)c2ccccc21	ZINC000450849544	DI	On-Demand	Anodyne	GPBAR1	53	39
C[C@H]1CCCN(C(=O)c2cncc(Cl)c2)c2ccccc21	ZINC000450849545	DI	On-Demand	Anodyne	AVPR2	50	49
C[C@H]1CCCN(C(=O)c2cncc(Cl)c2)c2ccccc21	ZINC000450849545	DI	On-Demand	Anodyne	AVPR1A	16	43
C[C@@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)c2ccccc21	ZINC000450849558	EJ	On-Demand	Anodyne	SFRP1	43	33
C[C@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)c2ccccc21	ZINC000450849559	EJ	On-Demand	Anodyne	SFRP1	43	33
CCC1(CNc2ncnc3cc(Br)ccc23)COC1	ZINC000450849562	DF	On-Demand	Anodyne	EGFR	79	41
CCC1(CNc2ncnc3cc(Br)ccc23)COC1	ZINC000450849562	DF	On-Demand	Anodyne	FBP1	15	41
CCC1(CNc2ncnc3cc(Br)ccc23)COC1	ZINC000450849562	DF	On-Demand	Anodyne	ERBB4	24	41
CCC1(CNc2ncnc3cc(Br)ccc23)COC1	ZINC000450849562	DF	On-Demand	Anodyne	MKNK1	15	40
COc1ccccc1CS[C@@H](C)C(=O)Nc1nccs1	ZINC000450849585	DG	On-Demand	Anodyne	MAP1	136	49
COc1ccccc1CS[C@H](C)C(=O)Nc1nccs1	ZINC000450849586	DG	On-Demand	Anodyne	MAP	0	55
COc1ccccc1CS[C@H](C)C(=O)Nc1nccs1	ZINC000450849586	DG	On-Demand	Anodyne	MAP1	136	49
COc1nccc(Cn2nnc([C@@H](NC(=O)c3ccccc3)C(C)C)n2)n1	ZINC000450849591	FD	On-Demand	Anodyne	SOAT1	19	44
COc1nccc(Cn2nnc([C@H](NC(=O)c3ccccc3)C(C)C)n2)n1	ZINC000450849592	FD	On-Demand	Anodyne	SOAT1	19	44
N#Cc1cc(N2CCCC[C@H]2C(=O)NCC(F)F)nc2ccc([N+](=O)[O-])cc12	ZINC000450849607	GF	On-Demand	Mild	ERG	0	40
CNC(=O)C[C@@H](C)Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450849624	ED	On-Demand	Anodyne	KCNA5	30	42
CNC(=O)C[C@H](C)Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450849626	ED	On-Demand	Anodyne	KCNA5	30	42
CC(C)N(C)c1cnn([C@@H]2CCCN(CC/C=C\c3ccccc3)C2)c(=O)c1	ZINC000450849629	GH	On-Demand	Anodyne	SLC6A1	43	33
CC(C)N(C)c1cnn([C@@H]2CCCN(CC/C=C/c3ccccc3)C2)c(=O)c1	ZINC000450849631	GH	On-Demand	Anodyne	SLC6A1	43	33
CC(C)N(C)c1cnn([C@H]2CCCN(CC/C=C/c3ccccc3)C2)c(=O)c1	ZINC000450849632	GH	On-Demand	Anodyne	SLC6A1	43	33
CC(C)N(C)c1cnn([C@H]2CCCN(CC/C=C\c3ccccc3)C2)c(=O)c1	ZINC000450849633	GH	On-Demand	Anodyne	SLC6A1	43	33
CNC(=O)C[C@@H](C)N=c1[nH]c(C)nc2ccc(OC)cc12	ZINC000450849658	CD	On-Demand	Anodyne	MTNR1A	42	35
CNC(=O)C[C@H](C)N=c1[nH]c(C)nc2ccc(OC)cc12	ZINC000450849659	CD	On-Demand	Anodyne	MTNR1A	42	35
CCC1(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)COC1	ZINC000450849678	DG	On-Demand	Bother	AADAC	0	47
COC(=O)C[C@H](C)SCc1ccn(CCc2ccccc2)n1	ZINC000450849694	DG	On-Demand	Anodyne	FAS	20	40
COC(=O)C[C@@H](C)SCc1ccn(CCc2ccccc2)n1	ZINC000450849695	DG	On-Demand	Anodyne	FAS	20	40
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450849702	DD	On-Demand	Anodyne	AKT2	49	43
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450849702	DD	On-Demand	Anodyne	AKT3	42	40
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450849702	DD	On-Demand	Anodyne	JAK3	22	42
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450849702	DD	On-Demand	Anodyne	JAK1	45	39
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450849702	DD	On-Demand	Anodyne	ROCK2	44	40
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450849702	DD	On-Demand	Anodyne	AKT1	29	44
CCOc1nc2ccc(C(=O)N[C@]3(CO)CCOC3)cc2[nH]1	ZINC000450849718	DC	On-Demand	Anodyne	MMP7	0	42
CCOc1nc2ccc(C(=O)N[C@]3(CO)CCOC3)cc2[nH]1	ZINC000450849718	DC	On-Demand	Anodyne	ADAMTS1	0	42
CCOc1nc2ccc(C(=O)N[C@@]3(CO)CCOC3)cc2[nH]1	ZINC000450849719	DC	On-Demand	Anodyne	MMP7	0	42
CCOc1nc2ccc(C(=O)N[C@@]3(CO)CCOC3)cc2[nH]1	ZINC000450849719	DC	On-Demand	Anodyne	ADAMTS1	0	42
CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1CC1(C(=O)OC)CC1	ZINC000450849726	EF	On-Demand	Anodyne	SLC12A5	101	55
CCOC(=O)[C@]1(Cc2ccccc2)CCCN1CC1(C(=O)OC)CC1	ZINC000450849727	EF	On-Demand	Anodyne	SLC12A5	101	55
CC(C)(CC(=O)COc1ccc(C#N)c(F)c1)C1CC1	ZINC000450849728	CG	On-Demand	Mild	TRPV4	46	40
COC(=O)CCN(CCc1cscn1)Cc1cccc(Br)c1	ZINC000450849729	GH	On-Demand	Anodyne	BMP1	41	32
COc1cccc(OCCC(=O)Nc2ccc(C)nc2O)c1	ZINC000450849737	DF	On-Demand	Anodyne	MTNR1A	36	40
COc1cccc(OCCC(=O)Nc2ccc(C)nc2O)c1	ZINC000450849737	DF	On-Demand	Anodyne	MTNR1B	35	46
COC(=O)c1cnc(NC2CCc3ccccc3CC2)nc1	ZINC000450849753	CF	On-Demand	Anodyne	MTR1B_CHICK	0	40
C[C@@H](O)CCN1CC2(CCC2)c2ccccc21	ZINC000450849760	BF	On-Demand	Anodyne	SLC18A3	24	40
C[C@H](O)CCN1CC2(CCC2)c2ccccc21	ZINC000450849761	BF	On-Demand	Anodyne	SLC18A3	24	40
CCc1cc(CCCN2CCN(c3cc(OC)ccc3F)CC2)on1	ZINC000450849775	EG	On-Demand	Anodyne	HTR1A	30	40
CCc1cc(CCCN2CCN(c3cc(OC)ccc3F)CC2)on1	ZINC000450849775	EG	On-Demand	Anodyne	DRD2	28	40
CCc1cc(CCCN2CCN(c3cc(OC)ccc3F)CC2)on1	ZINC000450849775	EG	On-Demand	Anodyne	DRD3	35	51
COc1ccc(F)c(N2CCN(CC3CCC(=O)CC3)CC2)c1	ZINC000450849795	DF	On-Demand	Anodyne	HTR1A	25	46
COc1ccc(F)c(N2CCN(CC3CCC(=O)CC3)CC2)c1	ZINC000450849795	DF	On-Demand	Anodyne	DRD4	46	36
CN(CCCC(=O)c1ccccc1)Cc1cccc2[nH]ccc12	ZINC000450849808	DI	On-Demand	Anodyne	HPGDS	20	40
CC(=O)c1ccc(CN2CC[C@@H](C)C(F)(F)C2)cc1	ZINC000450849821	CG	On-Demand	Anodyne	SIGMAR1	31	43
CC(=O)c1ccc(CN2CC[C@H](C)C(F)(F)C2)cc1	ZINC000450849823	CG	On-Demand	Anodyne	SIGMAR1	31	43
c1ccc(CCN(Cc2cccnc2)C[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450849825	DH	On-Demand	Anodyne	NR1D1	42	33
COc1ccc(F)c(N2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450849828	ED	On-Demand	Anodyne	DRD4	42	32
COc1ccc(F)c(N2CCN(C[C@@H](C)S(C)(=O)=O)CC2)c1	ZINC000450849828	ED	On-Demand	Anodyne	HTR7	22	44
COc1ccc(F)c(N2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450849829	ED	On-Demand	Anodyne	DRD4	42	32
COc1ccc(F)c(N2CCN(C[C@H](C)S(C)(=O)=O)CC2)c1	ZINC000450849829	ED	On-Demand	Anodyne	HTR7	22	44
c1ccc(CCN(Cc2cccnc2)C[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450849831	DH	On-Demand	Anodyne	NR1D1	42	33
COC(=O)c1ccc(CN2CCS[C@H](C)CC2)cc1Cl	ZINC000450849878	DG	On-Demand	Anodyne	DRD4	36	41
COC(=O)c1ccc(CN2CCS[C@H](C)CC2)cc1Cl	ZINC000450849878	DG	On-Demand	Anodyne	HTR4	43	34
COC(=O)c1ccc(CN2CCS[C@H](C)CC2)cc1Cl	ZINC000450849878	DG	On-Demand	Anodyne	SIGMAR1	31	43
COC(=O)c1ccc(CN2CCS[C@H](C)CC2)cc1Cl	ZINC000450849878	DG	On-Demand	Anodyne	SSTR5	44	36
COC(=O)c1ccc(CN2CCS[C@H](C)CC2)cc1Cl	ZINC000450849878	DG	On-Demand	Anodyne	MCHR1	39	46
COC(=O)c1ccc(CN2CCS[C@@H](C)CC2)cc1Cl	ZINC000450849879	DG	On-Demand	Anodyne	DRD4	36	41
COC(=O)c1ccc(CN2CCS[C@@H](C)CC2)cc1Cl	ZINC000450849879	DG	On-Demand	Anodyne	HTR4	43	34
COC(=O)c1ccc(CN2CCS[C@@H](C)CC2)cc1Cl	ZINC000450849879	DG	On-Demand	Anodyne	SIGMAR1	31	43
COC(=O)c1ccc(CN2CCS[C@@H](C)CC2)cc1Cl	ZINC000450849879	DG	On-Demand	Anodyne	SSTR5	44	36
COC(=O)c1ccc(CN2CCS[C@@H](C)CC2)cc1Cl	ZINC000450849879	DG	On-Demand	Anodyne	MCHR1	39	46
COC(=O)c1csc(CN(Cc2ccc(F)cc2)C2CCOCC2)n1	ZINC000450849889	FG	On-Demand	Anodyne	ACAT	17	43
CCCN(CC(=O)OC(C)(C)C)C(=O)Cc1scnc1-c1ccccc1	ZINC000450849893	FH	On-Demand	Anodyne	TSPO	30	41
COc1ccc(CNC(=O)CCN(C)Cc2cccc3[nH]ccc23)c(OC)c1	ZINC000450849903	GG	On-Demand	Anodyne	MTNR1A	63	41
COc1ccc(CNC(=O)CCN(C)Cc2cccc3[nH]ccc23)c(OC)c1	ZINC000450849903	GG	On-Demand	Anodyne	MTNR1B	56	38
CCCc1cc(NCc2nn(C)cc2I)n2ncnc2n1	ZINC000450849930	GE	On-Demand	Anodyne	DHOD	0	42
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(C[C@H](C)S(C)(=O)=O)n1	ZINC000450849940	FD	On-Demand	Anodyne	SOAT1	18	47
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(C[C@H](C)S(C)(=O)=O)n1	ZINC000450849941	FD	On-Demand	Anodyne	SOAT1	18	47
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(C[C@@H](C)S(C)(=O)=O)n1	ZINC000450849942	FD	On-Demand	Anodyne	SOAT1	18	47
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(C[C@@H](C)S(C)(=O)=O)n1	ZINC000450849943	FD	On-Demand	Anodyne	SOAT1	18	47
C[C@H]1C[C@@H](NC(=O)c2ccc(N3CCC3)nc2)CC[C@H]1C	ZINC000450849944	CF	On-Demand	Anodyne	HDAC1	26	40
C[C@H]1C[C@@H](NC(=O)c2ccc(N3CCC3)nc2)CC[C@H]1C	ZINC000450849944	CF	On-Demand	Anodyne	HPGDS	34	55
C[C@H]1C[C@@H](NC(=O)c2ccc(N3CCC3)nc2)CC[C@H]1C	ZINC000450849944	CF	On-Demand	Anodyne	NPBWR1	52	35
C[C@@H]1CC[C@H](NC(=O)c2ccc(N3CCC3)nc2)C[C@H]1C	ZINC000450849945	CF	On-Demand	Anodyne	HDAC1	26	40
C[C@@H]1CC[C@H](NC(=O)c2ccc(N3CCC3)nc2)C[C@H]1C	ZINC000450849945	CF	On-Demand	Anodyne	HPGDS	34	55
C[C@@H]1CC[C@H](NC(=O)c2ccc(N3CCC3)nc2)C[C@H]1C	ZINC000450849945	CF	On-Demand	Anodyne	NPBWR1	52	35
C[C@@H]1CC[C@@H](NC(=O)c2ccc(N3CCC3)nc2)C[C@H]1C	ZINC000450849946	CF	On-Demand	Anodyne	HDAC1	26	40
C[C@@H]1CC[C@@H](NC(=O)c2ccc(N3CCC3)nc2)C[C@H]1C	ZINC000450849946	CF	On-Demand	Anodyne	HPGDS	34	55
C[C@@H]1CC[C@@H](NC(=O)c2ccc(N3CCC3)nc2)C[C@H]1C	ZINC000450849946	CF	On-Demand	Anodyne	NPBWR1	52	35
C[C@H]1C[C@H](NC(=O)c2ccc(N3CCC3)nc2)CC[C@H]1C	ZINC000450849947	CF	On-Demand	Anodyne	HDAC1	26	40
C[C@H]1C[C@H](NC(=O)c2ccc(N3CCC3)nc2)CC[C@H]1C	ZINC000450849947	CF	On-Demand	Anodyne	HPGDS	34	55
C[C@H]1C[C@H](NC(=O)c2ccc(N3CCC3)nc2)CC[C@H]1C	ZINC000450849947	CF	On-Demand	Anodyne	NPBWR1	52	35
COc1ccc(CNC(=O)CCSCc2ccccc2OC)c(OC)c1	ZINC000450849990	GH	On-Demand	Anodyne	HTR7	20	41
COc1ccc(CNC(=O)CCSCc2ccccc2OC)c(OC)c1	ZINC000450849990	GH	On-Demand	Anodyne	MTNR1A	85	40
COc1ccc(CNC(=O)CCSCc2ccccc2OC)c(OC)c1	ZINC000450849990	GH	On-Demand	Anodyne	MTNR1B	76	40
COc1ccc(CNC(=O)CCSCc2ccccc2OC)c(OC)c1	ZINC000450849990	GH	On-Demand	Anodyne	IAP	0	40
COc1ccc(CNC(=O)CCSCc2ccccc2OC)c(OC)c1	ZINC000450849990	GH	On-Demand	Anodyne	KCNK3	18	40
C=CC[C@H](CO)NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450849995	ED	On-Demand	Mild	MAPK1	44	36
C=CC[C@@H](CO)NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450849996	ED	On-Demand	Mild	MAPK1	44	36
CC(=O)c1ccc(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1	ZINC000450850028	DI	On-Demand	Anodyne	ACHE	17	45
CC(=O)c1ccc(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1	ZINC000450850028	DI	On-Demand	Anodyne	SIGMAR1	27	41
CC(=O)c1ccc(CN2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1	ZINC000450850029	DI	On-Demand	Anodyne	ACHE	17	45
CC(=O)c1ccc(CN2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1	ZINC000450850029	DI	On-Demand	Anodyne	SIGMAR1	27	41
CCOC(=O)c1cn(C[C@@H](Cc2ccccc2)OC)nc1C(F)(F)F	ZINC000450850049	FG	On-Demand	Anodyne	CTRC	41	32
CCOC(=O)c1cn(C[C@H](Cc2ccccc2)OC)nc1C(F)(F)F	ZINC000450850050	FG	On-Demand	Anodyne	CTRC	41	32
CCN(CC)CCNC(=O)c1ccc(OCc2ccc(C(C)=O)cc2)cc1	ZINC000450850093	FH	On-Demand	Anodyne	KCNQ1	0	63
CCN(CC)CCNC(=O)c1ccc(OCc2ccc(C(C)=O)cc2)cc1	ZINC000450850093	FH	On-Demand	Anodyne	SLC6A5	38	40
CCC(C)(C)OCc1ccccc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450850103	DF	On-Demand	Anodyne	P2RX7	32	48
CCC(C)(C)OCc1ccccc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450850104	DF	On-Demand	Anodyne	P2RX7	32	48
CCS(=O)(=O)c1ccc(CSC[C@@H](C)C(=O)OC)cc1	ZINC000450850110	DF	On-Demand	Anodyne	LTA4H	40	48
CCS(=O)(=O)c1ccc(CSC[C@@H](C)C(=O)OC)cc1	ZINC000450850110	DF	On-Demand	Anodyne	RORC	46	34
CCS(=O)(=O)c1ccc(CSC[C@H](C)C(=O)OC)cc1	ZINC000450850111	DF	On-Demand	Anodyne	LTA4H	40	48
CCS(=O)(=O)c1ccc(CSC[C@H](C)C(=O)OC)cc1	ZINC000450850111	DF	On-Demand	Anodyne	RORC	46	34
N#Cc1nc(N2CCCC[C@H]2C(=O)NCC(F)F)ccc1C(F)(F)F	ZINC000450850112	FF	On-Demand	Mild	GPBAR1	22	44
N#Cc1nc(N2CCCC[C@H]2C(=O)NCC(F)F)ccc1C(F)(F)F	ZINC000450850112	FF	On-Demand	Mild	WNT3	40	31
N#Cc1nc(N2CCCC[C@H]2C(=O)NCC(F)F)ccc1C(F)(F)F	ZINC000450850112	FF	On-Demand	Mild	ERG	0	47
CCNC(=O)c1ccc(OCc2oc(C(C)C)nc2C)cc1	ZINC000450850120	DG	On-Demand	Anodyne	HSP90AB1	29	41
CC(C)(CC(N)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450850121	FE	On-Demand	Anodyne	AVPR1B	38	43
CC(C)(CC(N)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450850121	FE	On-Demand	Anodyne	PDE6D	81	39
CC(C)(CC(N)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450850121	FE	On-Demand	Anodyne	HDAC8	22	40
CC(C)(CC(N)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450850121	FE	On-Demand	Anodyne	IMDH_CRYPV	37	55
CC(F)(F)CCSc1nnc(-c2cccc3ccccc23)o1	ZINC000450850122	DK	On-Demand	Anodyne	ALOX15	80	48
CC(F)(F)CCSc1nnc(-c2cccc3ccccc23)o1	ZINC000450850122	DK	On-Demand	Anodyne	TERT	0	52
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450850128	EC	On-Demand	Bother	BDKRB1	0	40
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450850128	EC	On-Demand	Bother	COLA	65	32
Cc1nnc(-c2cccc(C#N)c2)n1C[C@H]1CCCCC1(F)F	ZINC000450850130	DH	On-Demand	Mild	MCHR1	17	41
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450850131	EC	On-Demand	Bother	BDKRB1	0	40
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450850131	EC	On-Demand	Bother	COLA	65	32
CNC(=O)C[C@@H](C)Nc1ncnc2ccc(I)cc12	ZINC000450850139	FE	On-Demand	Anodyne	EGFR	27	42
CNC(=O)C[C@@H](C)Nc1ncnc2ccc(I)cc12	ZINC000450850139	FE	On-Demand	Anodyne	CD38	64	42
CNC(=O)C[C@H](C)Nc1ncnc2ccc(I)cc12	ZINC000450850140	FE	On-Demand	Anodyne	EGFR	27	42
CNC(=O)C[C@H](C)Nc1ncnc2ccc(I)cc12	ZINC000450850140	FE	On-Demand	Anodyne	CD38	64	42
CCNC(=O)c1ccc(OCC[C@H](C)O)cc1	ZINC000450850141	BD	On-Demand	Anodyne	KCNQ1	0	47
CCNC(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450850142	BD	On-Demand	Anodyne	KCNQ1	0	47
CCn1cc([C@@H]2C[S@](=O)CCN2CCCC(=O)c2ccccc2)cn1	ZINC000450850173	FF	On-Demand	Anodyne	CYP2J2	49	35
CCn1cc([C@@H]2C[S@@](=O)CCN2CCCC(=O)c2ccccc2)cn1	ZINC000450850174	FF	On-Demand	Anodyne	CYP2J2	49	35
CCn1cc([C@H]2C[S@@](=O)CCN2CCCC(=O)c2ccccc2)cn1	ZINC000450850175	FF	On-Demand	Anodyne	CYP2J2	49	35
CCn1cc([C@H]2C[S@](=O)CCN2CCCC(=O)c2ccccc2)cn1	ZINC000450850176	FF	On-Demand	Anodyne	CYP2J2	49	35
N#Cc1ccc(OCC(=O)NC[C@H]2CCc3nccn3C2)cc1Br	ZINC000450850199	GE	On-Demand	Mild	TRPV4	41	32
N#Cc1ccc(OCC(=O)NC[C@@H]2CCc3nccn3C2)cc1Br	ZINC000450850201	GE	On-Demand	Mild	TRPV4	41	32
CCNC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450850202	CF	On-Demand	Anodyne	KCNQ1	0	55
CCNC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450850202	CF	On-Demand	Anodyne	PLA2G4B	64	39
O=C(CCCN1CCc2ccnc(O)c2C1)c1ccc(F)cc1	ZINC000450850208	DF	On-Demand	Anodyne	DRD2	32	45
O=C(CCCN1CCc2ccnc(O)c2C1)c1ccc(F)cc1	ZINC000450850208	DF	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCc2ccnc(O)c2C1)c1ccc(F)cc1	ZINC000450850208	DF	On-Demand	Anodyne	SLC18A3	0	48
O=C(CCCN1CCc2ccnc(O)c2C1)c1ccc(F)cc1	ZINC000450850208	DF	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCc2ccnc(O)c2C1)c1ccc(F)cc1	ZINC000450850208	DF	On-Demand	Anodyne	CYP2J2	46	33
O=C(NCC(F)F)[C@@H]1CCCCN1c1ccnc(Cc2ccccc2)n1	ZINC000450850232	FF	On-Demand	Anodyne	TRY1_BOVIN	59	34
CCC1(CNc2ccnc3cc(F)c(Cl)cc23)COC1	ZINC000450850339	CH	On-Demand	Anodyne	HRP1_PLAFA	58	36
CCC1(CNc2ccnc3cc(F)c(Cl)cc23)COC1	ZINC000450850339	CH	On-Demand	Anodyne	HNMT	44	34
C[C@@H]1CCCN(C(=O)c2cc3n(n2)CCC3)c2ccccc21	ZINC000450850398	CG	On-Demand	Anodyne	AVPR2	25	41
C[C@H]1CCCN(C(=O)c2cc3n(n2)CCC3)c2ccccc21	ZINC000450850399	CG	On-Demand	Anodyne	AVPR2	25	41
CC(=O)[C@](C)(O)CN[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000450850409	DD	On-Demand	Anodyne	SLC6A1	46	34
CC(=O)[C@](C)(O)CN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000450850411	DD	On-Demand	Anodyne	SLC6A1	46	34
CC(=O)[C@](C)(O)CN[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000450850412	DD	On-Demand	Anodyne	SLC6A1	46	34
CC(=O)[C@](C)(O)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000450850413	DD	On-Demand	Anodyne	SLC6A1	46	34
COc1ccc(-c2noc(CSc3ncc(C(C)C)n3C(C)C)n2)nn1	ZINC000450850442	FH	On-Demand	Anodyne	AXIN2	0	41
CCN1CCN(C(=O)c2c(Cl)cc(F)cc2Br)CC1=O	ZINC000450850457	FF	On-Demand	Anodyne	P2RX7	23	53
C[C@@H]1CCCN(C(=O)c2c[nH]c3nccc-3c2)c2ccccc21	ZINC000450850469	DI	On-Demand	Anodyne	AVPR2	43	43
C[C@H]1CCCN(C(=O)c2c[nH]c3nccc-3c2)c2ccccc21	ZINC000450850471	DI	On-Demand	Anodyne	AVPR2	43	43
c1ccc2c(-c3nnc(SC[C@H]4C[C@H]5CC[C@H]4O5)o3)cccc2c1	ZINC000450850487	EJ	On-Demand	Anodyne	ALOX15	62	46
c1ccc2c(-c3nnc(SC[C@@H]4C[C@H]5CC[C@H]4O5)o3)cccc2c1	ZINC000450850488	EJ	On-Demand	Anodyne	ALOX15	62	46
C[C@H]1N(C(=O)C2(Cc3ccccc3)CCOCC2)CCC12CCOCC2	ZINC000450850511	FG	On-Demand	Anodyne	SLC12A5	45	33
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(CC[C@H](C)O)n1	ZINC000450850512	DD	On-Demand	Anodyne	SOAT1	23	54
C[C@@H]1N(C(=O)C2(Cc3ccccc3)CCOCC2)CCC12CCOCC2	ZINC000450850513	FG	On-Demand	Anodyne	SLC12A5	45	33
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(CC[C@H](C)O)n1	ZINC000450850514	DD	On-Demand	Anodyne	SOAT1	23	54
CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(CC[C@@H](C)O)n1	ZINC000450850516	DD	On-Demand	Anodyne	SOAT1	23	54
CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(CC[C@@H](C)O)n1	ZINC000450850518	DD	On-Demand	Anodyne	SOAT1	23	54
C=CC[C@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450850520	CF	On-Demand	Mild	SORT1	15	40
C=CC[C@@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450850534	CF	On-Demand	Mild	SORT1	15	40
CCS(=O)(=O)c1ccc(Cn2ccsc2=O)cc1	ZINC000450850535	CD	On-Demand	Anodyne	RORC	40	33
C[C@@H](O)CCn1nnc(C2(NC(=O)c3ccccc3)CCCC2)n1	ZINC000450850563	ED	On-Demand	Anodyne	CCKBR	44	32
C[C@H](O)CCn1nnc(C2(NC(=O)c3ccccc3)CCCC2)n1	ZINC000450850564	ED	On-Demand	Anodyne	CCKBR	44	32
CS(=O)(=O)c1ccc(N2CCCC[C@H]2C(=O)NCC(F)F)c([N+](=O)[O-])c1	ZINC000450850621	GD	On-Demand	Bother	WNT3	40	31
CCC1(CNc2c(C)cnc3c(OC)cccc23)COC1	ZINC000450850648	CG	On-Demand	Anodyne	ATP4A	23	45
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450850650	GE	On-Demand	Bother	BCL2L1	42	35
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450850651	GE	On-Demand	Bother	BCL2L1	42	35
O=C(NCC(F)F)[C@@H]1CCCCN1c1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450850652	FF	On-Demand	Bother	SMO	41	35
CC(C)(CC(=O)COc1ccccc1NC(=O)COc1ccccc1)C1CC1	ZINC000450850655	GI	On-Demand	Anodyne	LUXN	0	42
CNC(=O)C[C@@H](C)Nc1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450850656	DF	On-Demand	Bother	AADAC	0	40
CNC(=O)C[C@H](C)Nc1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450850657	DF	On-Demand	Bother	AADAC	0	40
CCN(CC)S(=O)(=O)c1ccc(NCC2(CC)COC2)c([N+](=O)[O-])c1	ZINC000450850702	FE	On-Demand	Bother	BDKRB1	23	45
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	DRD2	35	47
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	DRD1	26	52
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	HRH2	0	47
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	HTR2A	28	50
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	HTR2C	24	55
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	HTR3B	0	47
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	CYP2J2	54	39
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	NET	0	48
CC(C)[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850703	DG	On-Demand	Anodyne	AP2S1	0	47
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	DRD2	35	47
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	DRD1	26	52
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	HRH2	0	47
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	HTR2A	28	50
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	HTR2C	24	55
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	HTR3B	0	47
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	CYP2J2	54	39
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	NET	0	48
CC(C)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCN1C	ZINC000450850704	DG	On-Demand	Anodyne	AP2S1	0	47
c1ccc(CCN(Cc2cccnc2)Cc2nnc(C3CC3)s2)cc1	ZINC000450850722	FI	On-Demand	Anodyne	NR1D1	44	35
CCc1ncc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)o1	ZINC000450850724	ED	On-Demand	Anodyne	NPY2R	42	36
CCCNC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)nc1	ZINC000450850820	EG	On-Demand	Anodyne	DRD4	47	36
COC(=O)c1ccc(-c2nnn(Cc3cn(CC4CC4)nn3)n2)cc1	ZINC000450850821	ED	On-Demand	Anodyne	SCARB1	52	41
CO[C@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850826	CF	On-Demand	Anodyne	FCER2	65	43
CO[C@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850826	CF	On-Demand	Anodyne	PAPA1_CARPA	43	34
CO[C@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850826	CF	On-Demand	Anodyne	CYSP_TRYCR	48	40
CO[C@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850826	CF	On-Demand	Anodyne	CAPNS1	44	32
CO[C@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850826	CF	On-Demand	Anodyne	PDS	40	34
CO[C@@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850827	CF	On-Demand	Anodyne	FCER2	65	43
CO[C@@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850827	CF	On-Demand	Anodyne	PAPA1_CARPA	43	34
CO[C@@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850827	CF	On-Demand	Anodyne	CYSP_TRYCR	48	40
CO[C@@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850827	CF	On-Demand	Anodyne	CAPNS1	44	32
CO[C@@H](CSCC(=O)OC(C)C)Cc1ccccc1	ZINC000450850827	CF	On-Demand	Anodyne	PDS	40	34
CCc1cc(=N[C@H](C)CC(=O)NC)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450850847	ED	On-Demand	Bother	GYRB	43	38
CCc1cc(=N[C@@H](C)CC(=O)NC)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450850849	ED	On-Demand	Bother	GYRB	43	38
CCC1(CNc2ccnc3cc(Cl)ccc23)COC1	ZINC000450850914	CH	On-Demand	Anodyne	HRP1_PLAFA	121	45
CCC1(CNc2ccnc3cc(Cl)ccc23)COC1	ZINC000450850914	CH	On-Demand	Anodyne	HNMT	72	48
CCC1(CNc2ccnc3cc(Cl)ccc23)COC1	ZINC000450850914	CH	On-Demand	Anodyne	BOTA	41	53
CCC1(CNc2ccnc3cc(Cl)ccc23)COC1	ZINC000450850914	CH	On-Demand	Anodyne	RBP_CHICK	0	44
Cc1ccc2oc(N[C@@H]3CCO[C@H](c4cccs4)C3)nc2c1	ZINC000450850937	DH	On-Demand	Anodyne	SSTR5	42	32
Cc1ccc2oc(N[C@H]3CCO[C@@H](c4cccs4)C3)nc2c1	ZINC000450850939	DH	On-Demand	Anodyne	SSTR5	42	32
Cc1ccc2oc(N[C@H]3CCO[C@H](c4cccs4)C3)nc2c1	ZINC000450850940	DH	On-Demand	Anodyne	SSTR5	42	32
COC(=O)c1cnc(N[C@@H]2C[C@H]2c2cccc(OC)c2)nc1	ZINC000450850959	CE	On-Demand	Anodyne	KDM1A	16	40
COC(=O)c1ccc(=O)n(CCCCc2ccc(Cl)c(Cl)c2)n1	ZINC000450851035	FG	On-Demand	Anodyne	DNAE	70	35
COC(=O)C1(CN(C)C/C(C)=C\c2ccccc2)CC1	ZINC000450851047	CF	On-Demand	Anodyne	TLR4	21	40
COC(=O)C1(CN(C)C/C(C)=C\c2ccccc2)CC1	ZINC000450851047	CF	On-Demand	Anodyne	ACKR3	40	37
COC(=O)C1(CN(C)C/C(C)=C/c2ccccc2)CC1	ZINC000450851048	CF	On-Demand	Anodyne	TLR4	21	40
COC(=O)C1(CN(C)C/C(C)=C/c2ccccc2)CC1	ZINC000450851048	CF	On-Demand	Anodyne	ACKR3	40	37
CCS(=O)(=O)c1ccc(CN2CCn3c(cc4cc(Cl)ccc43)C2)cc1	ZINC000450851050	GI	On-Demand	Anodyne	RORC	40	37
O=C(N1CCO[C@H](C2CCCCC2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450851073	FH	On-Demand	Anodyne	SLC12A5	62	37
O=C(N1CCO[C@@H](C2CCCCC2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450851074	FH	On-Demand	Anodyne	SLC12A5	62	37
CC1(C)C[C@@H](O)CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450851096	DH	On-Demand	Anodyne	LUCI_LUCLA	32	44
CC1(C)C[C@@H](O)CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450851096	DH	On-Demand	Anodyne	MLYCD	41	34
CC1(C)C[C@H](O)CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450851098	DH	On-Demand	Anodyne	LUCI_LUCLA	32	44
CC1(C)C[C@H](O)CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450851098	DH	On-Demand	Anodyne	MLYCD	41	34
COc1cc(CN(C)CCCNC(=O)C2CCC2)ccc1Cl	ZINC000450851105	DG	On-Demand	Anodyne	STK17B	40	34
COc1cc(CN(C)CCCNC(=O)C2CCC2)ccc1Cl	ZINC000450851105	DG	On-Demand	Anodyne	TBK1	59	39
Cc1cc(NC[C@H](CO)Cc2cc(Br)ccc2F)n2ncnc2n1	ZINC000450851112	GF	On-Demand	Anodyne	DHOD	0	47
Cc1cc(NC[C@@H](CO)Cc2cc(Br)ccc2F)n2ncnc2n1	ZINC000450851116	GF	On-Demand	Anodyne	DHOD	0	47
CN(CCCNC(=O)C1CCC1)CCc1ccc(Cl)cc1	ZINC000450851145	DG	On-Demand	Anodyne	TBK1	60	39
COC(=O)c1ccc(-c2nnn(CCC(C)(F)F)n2)cc1	ZINC000450851148	CE	On-Demand	Anodyne	SCARB1	41	35
CCN(CC)CCNC(=O)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450851150	EF	On-Demand	Anodyne	KCNQ1	0	60
CCN(CC)CCNC(=O)c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450851153	EF	On-Demand	Anodyne	KCNQ1	0	60
COC(=O)c1ccc(CC(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)cc1	ZINC000450851167	GF	On-Demand	Anodyne	CACNA1I	43	38
COC(=O)c1ccc(CC(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)cc1	ZINC000450851168	GF	On-Demand	Anodyne	CACNA1I	43	38
CCC1(CNc2ccc([N+](=O)[O-])cc2)COC1	ZINC000450851199	BE	On-Demand	Bother	NMBR	54	32
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450851227	FG	On-Demand	Anodyne	AKT3	50	35
O=C(NCC(F)F)[C@@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450851227	FG	On-Demand	Anodyne	HNMT	43	33
CCNC(=O)c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450851228	CE	On-Demand	Anodyne	GRIN2B	0	42
CCNC(=O)c1ccc(OCC[C@H]2CCOC2)cc1	ZINC000450851228	CE	On-Demand	Anodyne	KCNQ1	0	46
CCNC(=O)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450851229	CE	On-Demand	Anodyne	GRIN2B	0	42
CCNC(=O)c1ccc(OCC[C@@H]2CCOC2)cc1	ZINC000450851229	CE	On-Demand	Anodyne	KCNQ1	0	46
CC(=O)c1cccc(CN2CCc3cccc(C)c3C2)c1	ZINC000450851236	CH	On-Demand	Anodyne	NOD2	46	39
COC(=O)c1ccc(-c2nnn(C[C@@H]3CCN(S(C)(=O)=O)C3)n2)cc1	ZINC000450851243	FC	On-Demand	Anodyne	SCARB1	48	35
COC(=O)c1ccc(-c2nnn(C[C@H]3CCN(S(C)(=O)=O)C3)n2)cc1	ZINC000450851245	FC	On-Demand	Anodyne	SCARB1	48	35
O[C@@H](CN[C@@H](c1ccc(F)cc1)C(F)(F)F)Cc1ccccc1	ZINC000450851257	EH	On-Demand	Anodyne	CTSF	47	36
CCCc1ncc(CNc2c(C#N)cnc3c(OC)cc(OC)cc23)o1	ZINC000450851262	FH	On-Demand	Mild	SRC	67	35
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C(C)C)C2)c(OC)c1	ZINC000450851272	FD	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C(C)C)C2)c(OC)c1	ZINC000450851272	FD	On-Demand	Anodyne	HTR7	27	41
COc1ccc(CNC(=O)CCN2CCN(C)[C@@H](C(C)C)C2)c(OC)c1	ZINC000450851272	FD	On-Demand	Anodyne	MTNR1A	46	37
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C(C)C)C2)c(OC)c1	ZINC000450851275	FD	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C(C)C)C2)c(OC)c1	ZINC000450851275	FD	On-Demand	Anodyne	HTR7	27	41
COc1ccc(CNC(=O)CCN2CCN(C)[C@H](C(C)C)C2)c(OC)c1	ZINC000450851275	FD	On-Demand	Anodyne	MTNR1A	46	37
CC(=O)c1cccc(CSc2nnc(CCCc3ccccc3)o2)c1	ZINC000450851276	FJ	On-Demand	Anodyne	GSK3A	32	42
CC(=O)c1cccc(CSc2nnc(CCCc3ccccc3)o2)c1	ZINC000450851276	FJ	On-Demand	Anodyne	FAAH	47	36
CC(=O)c1cccc(CSc2nnc(CCCc3ccccc3)o2)c1	ZINC000450851276	FJ	On-Demand	Anodyne	CES1	55	34
N#Cc1ccc(C(F)(F)F)nc1N1CCCC[C@H]1C(=O)NCC(F)F	ZINC000450851278	FF	On-Demand	Mild	ERG	0	41
O=C(NC[C@@H]1CCc2nccn2C1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450851280	GG	On-Demand	Anodyne	PYGL	43	33
O=C(NC[C@H]1CCc2nccn2C1)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450851282	GG	On-Demand	Anodyne	PYGL	43	33
CC(=O)c1cccc(CN2CCC[C@H](N(C)CC(=O)OC(C)(C)C)CC2)c1	ZINC000450851324	FH	On-Demand	Anodyne	ACHE	23	41
CC(=O)c1cccc(CN2CCC[C@H](N(C)CC(=O)OC(C)(C)C)CC2)c1	ZINC000450851324	FH	On-Demand	Anodyne	MCHR1	23	40
CC(=O)c1cccc(CN2CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC2)c1	ZINC000450851326	FH	On-Demand	Anodyne	ACHE	23	41
CC(=O)c1cccc(CN2CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC2)c1	ZINC000450851326	FH	On-Demand	Anodyne	MCHR1	23	40
CC1(C)C[C@@H](O)CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1	ZINC000450851342	FH	On-Demand	Bother	SLC12A5	56	34
CC1(C)C[C@H](O)CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1	ZINC000450851343	FH	On-Demand	Bother	SLC12A5	56	34
CCOC(=O)c1ccc(CN(C)Cc2ccc(F)c(Cl)c2)nc1	ZINC000450851357	EH	On-Demand	Anodyne	P2RY12	24	41
COc1cccc([C@@H]2C[C@H]2Nc2cc(C(C)=O)ccc2C#N)c1	ZINC000450851364	DH	On-Demand	Mild	TAAR1	28	42
COc1ccc(C[C@@H](CO)CNc2ncc(F)cn2)cc1Br	ZINC000450851374	FE	On-Demand	Anodyne	P2RX2	42	41
COc1ccc(C[C@@H](CO)CNc2ncc(F)cn2)cc1Br	ZINC000450851374	FE	On-Demand	Anodyne	P2RX3	39	41
COc1ccc(C[C@H](CO)CNc2ncc(F)cn2)cc1Br	ZINC000450851377	FE	On-Demand	Anodyne	P2RX2	42	41
COc1ccc(C[C@H](CO)CNc2ncc(F)cn2)cc1Br	ZINC000450851377	FE	On-Demand	Anodyne	P2RX3	39	41
COc1ccccc1-c1noc(C2CCN([C@@H](C)CC(C)C)CC2)n1	ZINC000450851411	EI	On-Demand	Anodyne	LUCI_PHOPE	31	44
COc1ccccc1-c1noc(C2CCN([C@@H](C)CC(C)C)CC2)n1	ZINC000450851411	EI	On-Demand	Anodyne	SMO	58	46
COc1ccccc1-c1noc(C2CCN([C@@H](C)CC(C)C)CC2)n1	ZINC000450851411	EI	On-Demand	Anodyne	ETHR	54	43
COc1ccccc1-c1noc(C2CCN([C@H](C)CC(C)C)CC2)n1	ZINC000450851412	EI	On-Demand	Anodyne	LUCI_PHOPE	31	44
COc1ccccc1-c1noc(C2CCN([C@H](C)CC(C)C)CC2)n1	ZINC000450851412	EI	On-Demand	Anodyne	SMO	58	46
COc1ccccc1-c1noc(C2CCN([C@H](C)CC(C)C)CC2)n1	ZINC000450851412	EI	On-Demand	Anodyne	ETHR	54	43
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	DRD2	20	42
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	DRD4	43	44
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	ACHE	19	47
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	HRH1	19	43
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	DRD3	26	42
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	HTR4	19	47
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	SIGMAR1	35	42
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	SSTR5	85	44
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	CCR3	18	40
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	MCHR1	29	44
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	CCR8	19	40
COc1cc(CN2CCC(c3ccncc3)CC2)ccc1Cl	ZINC000450851414	DI	On-Demand	Anodyne	CARM1	54	32
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851421	FG	On-Demand	Anodyne	THRA	0	41
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851421	FG	On-Demand	Anodyne	DRD1	15	42
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851421	FG	On-Demand	Anodyne	DRD4	0	42
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851421	FG	On-Demand	Anodyne	HTR2A	21	45
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851421	FG	On-Demand	Anodyne	HTR2C	18	54
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851421	FG	On-Demand	Anodyne	SLC18A3	0	40
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851421	FG	On-Demand	Anodyne	CYP2J2	64	45
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851422	FG	On-Demand	Anodyne	THRA	0	41
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851422	FG	On-Demand	Anodyne	DRD1	15	42
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851422	FG	On-Demand	Anodyne	DRD4	0	42
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851422	FG	On-Demand	Anodyne	HTR2A	21	45
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851422	FG	On-Demand	Anodyne	HTR2C	18	54
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851422	FG	On-Demand	Anodyne	SLC18A3	0	40
C[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851422	FG	On-Demand	Anodyne	CYP2J2	64	45
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851423	FG	On-Demand	Anodyne	THRA	0	41
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851423	FG	On-Demand	Anodyne	DRD1	15	42
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851423	FG	On-Demand	Anodyne	DRD4	0	42
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851423	FG	On-Demand	Anodyne	HTR2A	21	45
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851423	FG	On-Demand	Anodyne	HTR2C	18	54
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851423	FG	On-Demand	Anodyne	SLC18A3	0	40
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@]1=O	ZINC000450851423	FG	On-Demand	Anodyne	CYP2J2	64	45
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851424	FG	On-Demand	Anodyne	THRA	0	41
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851424	FG	On-Demand	Anodyne	DRD1	15	42
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851424	FG	On-Demand	Anodyne	DRD4	0	42
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851424	FG	On-Demand	Anodyne	HTR2A	21	45
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851424	FG	On-Demand	Anodyne	HTR2C	18	54
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851424	FG	On-Demand	Anodyne	SLC18A3	0	40
C[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)CC[S@@]1=O	ZINC000450851424	FG	On-Demand	Anodyne	CYP2J2	64	45
CC1(C)COC[C@H]1Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450851432	GI	On-Demand	Anodyne	NPBWR1	42	36
CC1(C)COC[C@@H]1Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450851433	GI	On-Demand	Anodyne	NPBWR1	42	36
CC(C)N1CCCC[C@H]1CN1CCC(c2ncccc2Cl)CC1	ZINC000450851438	EI	On-Demand	Anodyne	OPRL1	15	42
CC(C)N1CCCC[C@@H]1CN1CCC(c2ncccc2Cl)CC1	ZINC000450851439	EI	On-Demand	Anodyne	OPRL1	15	42
C[C@H]1CC2(CCC2)CN1CCCC(=O)c1ccccc1	ZINC000450851440	CH	On-Demand	Anodyne	CYP2J2	52	38
C[C@@H]1CC2(CCC2)CN1CCCC(=O)c1ccccc1	ZINC000450851441	CH	On-Demand	Anodyne	CYP2J2	52	38
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	DRD2	27	52
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	DRD4	48	38
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	ACHE	33	46
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	F10	22	41
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	CHRM3	24	47
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	VACHT_TETCF	0	43
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	SIGMAR1	48	42
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	SSTR5	44	35
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	CCR3	38	42
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	CXCR3	26	40
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	MCHR1	51	45
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	CCR8	33	41
CC(=O)c1cccc(CN2CCC(c3ccncc3)CC2)c1	ZINC000450851471	CH	On-Demand	Anodyne	MGEA5	27	42
COc1ccccc1-c1noc(C2CCN(Cc3cnns3)CC2)n1	ZINC000450851486	FF	On-Demand	Anodyne	LUCI_PHOPE	30	42
COc1ccccc1-c1noc(C2CCN(Cc3cnns3)CC2)n1	ZINC000450851486	FF	On-Demand	Anodyne	SMO	52	42
COc1ccccc1-c1noc(C2CCN(Cc3cnns3)CC2)n1	ZINC000450851486	FF	On-Demand	Anodyne	ETHR	52	37
CCc1cccc(C(=O)N[C@H]2CCO[C@H](c3cncn3C)C2)n1	ZINC000450851508	DE	On-Demand	Anodyne	INHA	71	34
CCc1cccc(C(=O)N[C@@H]2CCO[C@H](c3cncn3C)C2)n1	ZINC000450851509	DE	On-Demand	Anodyne	INHA	71	34
CCc1cccc(C(=O)N[C@@H]2CCO[C@@H](c3cncn3C)C2)n1	ZINC000450851510	DE	On-Demand	Anodyne	INHA	71	34
CCc1cccc(C(=O)N[C@H]2CCO[C@@H](c3cncn3C)C2)n1	ZINC000450851511	DE	On-Demand	Anodyne	INHA	71	34
Cc1cc(NC[C@@H](CO)Cc2ccc(C)c(Br)c2)n2ncnc2n1	ZINC000450851512	GF	On-Demand	Anodyne	DHOD	0	48
Cc1cc(NC[C@H](CO)Cc2ccc(C)c(Br)c2)n2ncnc2n1	ZINC000450851513	GF	On-Demand	Anodyne	DHOD	0	48
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450851514	GC	On-Demand	Bother	BCL2L1	99	34
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450851514	GC	On-Demand	Bother	BCL2	75	37
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450851514	GC	On-Demand	Bother	BCL2L2	42	30
CNC(=O)C[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450851514	GC	On-Demand	Bother	DDIT3	0	41
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450851515	GC	On-Demand	Bother	BCL2L1	99	34
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450851515	GC	On-Demand	Bother	BCL2	75	37
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450851515	GC	On-Demand	Bother	BCL2L2	42	30
CNC(=O)C[C@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450851515	GC	On-Demand	Bother	DDIT3	0	41
O=C(NCC(F)F)[C@@H]1CCCCN1c1ccc(C(F)(F)F)nn1	ZINC000450851516	EE	On-Demand	Anodyne	WNT3	50	33
COc1cc(CC(=O)N[C@]2(CO)CCOC2)ccc1Cl	ZINC000450851517	CD	On-Demand	Anodyne	PDE6A	40	31
COc1cc(CC(=O)N[C@]2(CO)CCOC2)ccc1Cl	ZINC000450851517	CD	On-Demand	Anodyne	NCE103	22	40
COc1cc(CC(=O)N[C@]2(CO)CCOC2)ccc1Cl	ZINC000450851517	CD	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@@]2(CO)CCOC2)ccc1Cl	ZINC000450851518	CD	On-Demand	Anodyne	PDE6A	40	31
COc1cc(CC(=O)N[C@@]2(CO)CCOC2)ccc1Cl	ZINC000450851518	CD	On-Demand	Anodyne	NCE103	22	40
COc1cc(CC(=O)N[C@@]2(CO)CCOC2)ccc1Cl	ZINC000450851518	CD	On-Demand	Anodyne	CAN2	0	40
CCS(=O)(=O)c1ccc(CN[C@@H](c2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450851538	GI	On-Demand	Anodyne	CTSF	50	32
CCS(=O)(=O)c1ccc(CN[C@@H](c2ccc(F)cc2)C(F)(F)F)cc1	ZINC000450851538	GI	On-Demand	Anodyne	RORC	58	39
CCN(CC)CCNC(=O)c1ccc(OCc2nnc(C3CC3)s2)cc1	ZINC000450851569	FG	On-Demand	Anodyne	KCNQ1	0	53
COC(=O)c1ccc(-c2nnn(C[C@@H]3COCCO3)n2)cc1	ZINC000450851612	DC	On-Demand	Anodyne	SCARB1	46	35
COC(=O)c1ccc(-c2nnn(C[C@H]3COCCO3)n2)cc1	ZINC000450851613	DC	On-Demand	Anodyne	SCARB1	46	35
CNC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)c([N+](=O)[O-])c1	ZINC000450851679	EF	On-Demand	Bother	TAAR1	29	51
COc1cc(CN2CCC[C@H](N(C)C)CC2)ccc1Cl	ZINC000450851696	CG	On-Demand	Anodyne	HRH1	0	41
COc1cc(CN2CCC[C@H](N(C)C)CC2)ccc1Cl	ZINC000450851696	CG	On-Demand	Anodyne	DRD3	22	40
COc1cc(CN2CCC[C@H](N(C)C)CC2)ccc1Cl	ZINC000450851696	CG	On-Demand	Anodyne	OPRK1	23	40
COc1cc(CN2CCC[C@H](N(C)C)CC2)ccc1Cl	ZINC000450851696	CG	On-Demand	Anodyne	AVPR1B	44	37
COc1cc(CN2CCC[C@@H](N(C)C)CC2)ccc1Cl	ZINC000450851697	CG	On-Demand	Anodyne	HRH1	0	41
COc1cc(CN2CCC[C@@H](N(C)C)CC2)ccc1Cl	ZINC000450851697	CG	On-Demand	Anodyne	DRD3	22	40
COc1cc(CN2CCC[C@@H](N(C)C)CC2)ccc1Cl	ZINC000450851697	CG	On-Demand	Anodyne	OPRK1	23	40
COc1cc(CN2CCC[C@@H](N(C)C)CC2)ccc1Cl	ZINC000450851697	CG	On-Demand	Anodyne	AVPR1B	44	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](N(C)C)CC1	ZINC000450851705	CF	On-Demand	Anodyne	OPRK1	22	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](N(C)C)CC1	ZINC000450851706	CF	On-Demand	Anodyne	OPRK1	22	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](N(C)C)CC1	ZINC000450851707	CF	On-Demand	Anodyne	OPRK1	22	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](N(C)C)CC1	ZINC000450851708	CF	On-Demand	Anodyne	OPRK1	22	40
Cc1ccc(Br)cc1CN(C)CCCNC(=O)C1CCC1	ZINC000450851710	FG	On-Demand	Anodyne	TBK1	68	36
Cc1ccc(Br)cc1CN(C)CCCNC(=O)C1CCC1	ZINC000450851710	FG	On-Demand	Anodyne	MTNR1C	0	41
COc1cccc([C@@H]2C[C@@H](Nc3ccnc(C)n3)C2)c1	ZINC000450851735	CG	On-Demand	Anodyne	EBP	15	44
C[C@@H](c1csnn1)N(C)CCCNC(=O)C1CCC1	ZINC000450851747	CD	On-Demand	Anodyne	TBK1	41	33
C[C@H](c1csnn1)N(C)CCCNC(=O)C1CCC1	ZINC000450851748	CD	On-Demand	Anodyne	TBK1	41	33
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)CC(=O)NC)c([N+](=O)[O-])c1	ZINC000450851793	FD	On-Demand	Bother	BDKRB1	0	49
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)CC(=O)NC)c([N+](=O)[O-])c1	ZINC000450851794	FD	On-Demand	Bother	BDKRB1	0	49
O=C(CCCN1CC(=O)N(CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450851795	EE	On-Demand	Anodyne	DRD2	34	45
O=C(CCCN1CC(=O)N(CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450851795	EE	On-Demand	Anodyne	CYP2J2	52	37
COc1ccccc1-c1noc(C2CCN(CC3(C#N)CCC3)CC2)n1	ZINC000450851814	FH	On-Demand	Mild	SMO	51	40
COc1ccccc1-c1noc(C2CCN(CC3(C#N)CCC3)CC2)n1	ZINC000450851814	FH	On-Demand	Mild	ETHR	44	36
CCC1(CNc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])COC1	ZINC000450851818	ED	On-Demand	Bother	TAAR1	16	41
CC1(C)COC[C@H]1Nc1ncnc2ccc(I)cc12	ZINC000450851820	FG	On-Demand	Anodyne	CD38	66	38
CC1(C)COC[C@@H]1Nc1ncnc2ccc(I)cc12	ZINC000450851821	FG	On-Demand	Anodyne	CD38	66	38
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	HTR1A	33	48
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	DRD2	45	55
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	DRD1	21	43
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	DRD4	47	47
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	HTR2A	42	48
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	HTR2C	29	54
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	SLC6A1	63	37
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	HRH1	28	47
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	DRD3	33	47
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	HTR7	34	44
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	SIGMAR1	31	53
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	PRCP	42	43
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	FAAH	29	40
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	HTR3B	0	40
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	MCHR1	18	51
O=C(CCCN1CCC(c2ncccc2Cl)CC1)c1ccccc1	ZINC000450851824	EJ	On-Demand	Anodyne	CYP2J2	65	46
CC(C)NC(=O)c1ccc(N[C@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450851828	DF	On-Demand	Bother	TAAR1	17	42
CC(C)NC(=O)c1ccc(N[C@@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450851829	DF	On-Demand	Bother	TAAR1	17	42
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	HTR1A	24	44
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	DRD2	22	44
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	DRD3	18	40
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	PDGFRB	40	40
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	HTR7	34	42
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	PRCP	30	45
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	MTNR1A	52	36
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	MTNR1B	42	36
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	CSF1R	20	40
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	MCHR1	40	39
COc1ccc(CNC(=O)CCN2CCC(c3ccncc3)CC2)c(OC)c1	ZINC000450851835	GF	On-Demand	Anodyne	CARM1	59	34
CC1(C)C[C@@H](O)CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450851836	CD	On-Demand	Anodyne	AKT2	19	42
CC1(C)C[C@H](O)CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450851837	CD	On-Demand	Anodyne	AKT2	19	42
O=C(NC[C@H]1CCc2nc(C(F)(F)F)cn2C1)c1cncc(Cl)c1	ZINC000450851846	FF	On-Demand	Anodyne	CACNA1I	54	38
O=C(NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)c1cncc(Cl)c1	ZINC000450851848	FF	On-Demand	Anodyne	CACNA1I	54	38
CCCOc1cccc(CS[C@@H](C)[C@@H](C)O)c1	ZINC000450851857	CG	On-Demand	Anodyne	PLA2G4B	22	40
CCCOc1cccc(CS[C@@H](C)[C@@H](C)O)c1	ZINC000450851857	CG	On-Demand	Anodyne	PDS	51	32
CCCOc1cccc(CS[C@H](C)[C@H](C)O)c1	ZINC000450851862	CG	On-Demand	Anodyne	PLA2G4B	22	40
CCCOc1cccc(CS[C@H](C)[C@H](C)O)c1	ZINC000450851862	CG	On-Demand	Anodyne	PDS	51	32
CCCOc1cccc(CS[C@@H](C)[C@H](C)O)c1	ZINC000450851864	CG	On-Demand	Anodyne	PLA2G4B	22	40
CCCOc1cccc(CS[C@@H](C)[C@H](C)O)c1	ZINC000450851864	CG	On-Demand	Anodyne	PDS	51	32
CCCOc1cccc(CS[C@H](C)[C@@H](C)O)c1	ZINC000450851866	CG	On-Demand	Anodyne	PLA2G4B	22	40
CCCOc1cccc(CS[C@H](C)[C@@H](C)O)c1	ZINC000450851866	CG	On-Demand	Anodyne	PDS	51	32
Cc1ccn2ncc(C(=O)NC[C@H]3CCc4nc(C(F)(F)F)cn4C3)c2c1	ZINC000450851872	GF	On-Demand	Anodyne	EPHB3	32	43
Cc1ccn2ncc(C(=O)NC[C@@H]3CCc4nc(C(F)(F)F)cn4C3)c2c1	ZINC000450851873	GF	On-Demand	Anodyne	EPHB3	32	43
COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450851880	GE	On-Demand	Anodyne	DRD4	17	41
COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450851880	GE	On-Demand	Anodyne	AVPR1B	42	35
COCCN(C)S(=O)(=O)[C@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450851880	GE	On-Demand	Anodyne	UTS2R	27	42
COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450851882	GE	On-Demand	Anodyne	DRD4	17	41
COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450851882	GE	On-Demand	Anodyne	AVPR1B	42	35
COCCN(C)S(=O)(=O)[C@@H]1CCCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450851882	GE	On-Demand	Anodyne	UTS2R	27	42
CCNC(=O)c1ccc(OC[C@@H]2CCC(F)(F)C2)cc1	ZINC000450851887	CG	On-Demand	Anodyne	KCNQ1	0	46
CCNC(=O)c1ccc(OC[C@H]2CCC(F)(F)C2)cc1	ZINC000450851888	CG	On-Demand	Anodyne	KCNQ1	0	46
CCOC(=O)c1ccc(CN(C)CCCNC(=O)C2CCC2)nc1	ZINC000450851891	ED	On-Demand	Anodyne	TBK1	82	38
CN(C)[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450851897	EG	On-Demand	Anodyne	DRD2	0	42
CN(C)[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450851897	EG	On-Demand	Anodyne	SIGMAR1	48	44
CN(C)[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450851900	EG	On-Demand	Anodyne	DRD2	0	42
CN(C)[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450851900	EG	On-Demand	Anodyne	SIGMAR1	48	44
COc1ccc(Br)c(CN(C)CC2CCC(=O)CC2)c1	ZINC000450851918	EH	On-Demand	Anodyne	CYP27A1	0	43
CCOC(=O)c1ccc(CN2CCC(c3ccncc3)CC2)nc1	ZINC000450851919	EG	On-Demand	Anodyne	SSTR5	47	38
CCOC(=O)c1ccc(CN2CCC(c3ccncc3)CC2)nc1	ZINC000450851919	EG	On-Demand	Anodyne	MGEA5	25	40
Cc1cncc(-c2nc(CN(C)CCCNC(=O)C3CCC3)no2)c1	ZINC000450851920	EE	On-Demand	Anodyne	TBK1	69	35
CCc1cc(CCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)on1	ZINC000450851934	GI	On-Demand	Anodyne	DRD2	24	42
CCc1cc(CCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)on1	ZINC000450851934	GI	On-Demand	Anodyne	DRD4	17	42
CCc1cc(CCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)on1	ZINC000450851934	GI	On-Demand	Anodyne	DRD3	23	42
CCc1cc(CCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)on1	ZINC000450851934	GI	On-Demand	Anodyne	CARM1	47	37
CCc1cc(CCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)on1	ZINC000450851934	GI	On-Demand	Anodyne	SMO	35	41
CCc1cc(CCCN2CCC(c3nc(-c4ccccc4OC)no3)CC2)on1	ZINC000450851934	GI	On-Demand	Anodyne	ETHR	49	35
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450851949	EI	On-Demand	Anodyne	OPRL1	27	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450851951	EI	On-Demand	Anodyne	OPRL1	27	40
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450851952	EI	On-Demand	Anodyne	OPRL1	27	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450851954	EI	On-Demand	Anodyne	OPRL1	27	40
COc1ccccc1-n1cnc2cc(C(=O)N[C@]3(CO)CCOC3)ccc21	ZINC000450851958	FD	On-Demand	Anodyne	PDGFRB	0	44
COc1ccccc1-n1cnc2cc(C(=O)N[C@]3(CO)CCOC3)ccc21	ZINC000450851958	FD	On-Demand	Anodyne	CPT1A	45	32
COc1ccccc1-n1cnc2cc(C(=O)N[C@]3(CO)CCOC3)ccc21	ZINC000450851958	FD	On-Demand	Anodyne	HPGD	43	54
COc1ccccc1-n1cnc2cc(C(=O)N[C@@]3(CO)CCOC3)ccc21	ZINC000450851960	FD	On-Demand	Anodyne	PDGFRB	0	44
COc1ccccc1-n1cnc2cc(C(=O)N[C@@]3(CO)CCOC3)ccc21	ZINC000450851960	FD	On-Demand	Anodyne	CPT1A	45	32
COc1ccccc1-n1cnc2cc(C(=O)N[C@@]3(CO)CCOC3)ccc21	ZINC000450851960	FD	On-Demand	Anodyne	HPGD	43	54
COCCN(C)S(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450851962	FE	On-Demand	Anodyne	BIRC2	35	41
COCCN(C)S(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450851967	FE	On-Demand	Anodyne	BIRC2	35	41
CCCN(CCC)S(=O)(=O)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450851983	GE	On-Demand	Anodyne	ACHE	18	40
CCCN(CCC)S(=O)(=O)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450851983	GE	On-Demand	Anodyne	SIGMAR1	21	45
CCCN(CCC)S(=O)(=O)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450851983	GE	On-Demand	Anodyne	TRY2_BOVIN	51	35
CCCN(CCC)S(=O)(=O)N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450851983	GE	On-Demand	Anodyne	MGLL	0	43
CSc1ccc2ncnc(N[C@H]3CCO[C@@H](c4cccs4)C3)c2c1	ZINC000450852023	FJ	On-Demand	Anodyne	CD38	94	45
CSc1ccc2ncnc(N[C@H]3CCO[C@H](c4cccs4)C3)c2c1	ZINC000450852024	FJ	On-Demand	Anodyne	CD38	94	45
CSc1ccc2ncnc(N[C@@H]3CCO[C@H](c4cccs4)C3)c2c1	ZINC000450852025	FJ	On-Demand	Anodyne	CD38	94	45
COC(=O)c1ccc(-c2nnn(Cc3nnc(C4CC4)s3)n2)cc1	ZINC000450852044	ED	On-Demand	Anodyne	SCARB1	47	38
CCOC(=O)c1csc(C2CCN(CCN(C)Cc3ccccc3)CC2)n1	ZINC000450852091	GH	On-Demand	Anodyne	CCR5	45	36
CN(CCCNC(=O)C1CCC1)Cc1ccn(CC(F)(F)F)n1	ZINC000450852100	EE	On-Demand	Anodyne	TBK1	66	35
COc1ccccc1-c1noc(C2CCN(CC3CC(F)(F)C3)CC2)n1	ZINC000450852113	FH	On-Demand	Anodyne	LUCI_PHOPE	29	42
COc1ccccc1-c1noc(C2CCN(CC3CC(F)(F)C3)CC2)n1	ZINC000450852113	FH	On-Demand	Anodyne	SMO	53	42
COc1ccccc1-c1noc(C2CCN(CC3CC(F)(F)C3)CC2)n1	ZINC000450852113	FH	On-Demand	Anodyne	ETHR	50	37
C(=C/c1ccccc1)\CCN1CCC(c2ccncc2)CC1	ZINC000450852136	CI	On-Demand	Anodyne	PRCP	22	43
C(=C\c1ccccc1)\CCN1CCC(c2ccncc2)CC1	ZINC000450852137	CI	On-Demand	Anodyne	PRCP	22	43
Cc1cccc(Cl)c1CN(C)CCCNC(=O)C1CCC1	ZINC000450852140	DG	On-Demand	Anodyne	TBK1	45	36
Cc1cccc(Cl)c1CN(C)CCCNC(=O)C1CCC1	ZINC000450852140	DG	On-Demand	Anodyne	MTNR1C	0	42
CN(CCCNC(=O)C1CCC1)CCCC(=O)c1ccc(Br)cc1	ZINC000450852155	GH	On-Demand	Anodyne	TBK1	52	36
CN(CCN1CCC(c2ccncc2)CC1)Cc1ccccc1	ZINC000450852156	DG	On-Demand	Anodyne	DRD2	26	49
CN(CCN1CCC(c2ccncc2)CC1)Cc1ccccc1	ZINC000450852156	DG	On-Demand	Anodyne	VACHT_TETCF	0	40
CN(CCN1CCC(c2ccncc2)CC1)Cc1ccccc1	ZINC000450852156	DG	On-Demand	Anodyne	PRCP	25	45
CN(CCN1CCC(c2ccncc2)CC1)Cc1ccccc1	ZINC000450852156	DG	On-Demand	Anodyne	CCR5	45	42
CN(CCN1CCC(c2ccncc2)CC1)Cc1ccccc1	ZINC000450852156	DG	On-Demand	Anodyne	CARM1	44	31
CCCNC(=O)c1ccc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)nc1	ZINC000450852177	EH	On-Demand	Anodyne	DRD4	47	36
CCCNC(=O)c1ccc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)nc1	ZINC000450852177	EH	On-Demand	Anodyne	TYRO3	15	41
CCOC(=O)c1csc(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450852178	GI	On-Demand	Anodyne	DRD4	17	43
CCOC(=O)c1csc(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450852178	GI	On-Demand	Anodyne	HTR2A	21	43
CCOC(=O)c1csc(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450852178	GI	On-Demand	Anodyne	HTR2C	15	45
CCOC(=O)c1csc(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450852178	GI	On-Demand	Anodyne	HRH1	23	40
CCOC(=O)c1csc(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450852178	GI	On-Demand	Anodyne	HTR7	15	43
CCOC(=O)c1csc(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450852178	GI	On-Demand	Anodyne	SIGMAR1	15	46
CCOC(=O)c1csc(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450852178	GI	On-Demand	Anodyne	MCHR1	18	49
CCOC(=O)c1csc(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450852178	GI	On-Demand	Anodyne	CYP2J2	63	46
Cc1cc(N2CC[C@H](O)CC(C)(C)C2)c2cc(F)ccc2n1	ZINC000450852179	DH	On-Demand	Anodyne	DHODH	49	38
Cc1cc(N2CC[C@@H](O)CC(C)(C)C2)c2cc(F)ccc2n1	ZINC000450852180	DH	On-Demand	Anodyne	DHODH	49	38
CCS(=O)(=O)c1ccc(CN(C)Cc2cc(C)ccc2C)cc1	ZINC000450852187	EH	On-Demand	Anodyne	RORC	25	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000450852189	EH	On-Demand	Anodyne	LIPG	46	36
COc1ccc(C[C@@H](CO)CNc2cnc(C#N)cn2)cc1Br	ZINC000450852213	GE	On-Demand	Mild	CHEK1	15	41
COc1ccc(C[C@H](CO)CNc2cnc(C#N)cn2)cc1Br	ZINC000450852214	GE	On-Demand	Mild	CHEK1	15	41
Cc1cc(N2CCCC[C@H]2C(=O)NCC(F)F)nc(C)n1	ZINC000450852217	CD	On-Demand	Anodyne	ERG	0	42
O=C(N[C@H](CC(F)(F)F)c1ccc(Br)cc1)[C@H](O)C1CCC1	ZINC000450852220	GH	On-Demand	Anodyne	SDH1	0	41
O=C(N[C@H](CC(F)(F)F)c1ccc(Br)cc1)[C@@H](O)C1CCC1	ZINC000450852221	GH	On-Demand	Anodyne	SDH1	0	41
O=C(N[C@@H](CC(F)(F)F)c1ccc(Br)cc1)[C@H](O)C1CCC1	ZINC000450852222	GH	On-Demand	Anodyne	SDH1	0	41
O=C(N[C@@H](CC(F)(F)F)c1ccc(Br)cc1)[C@@H](O)C1CCC1	ZINC000450852223	GH	On-Demand	Anodyne	SDH1	0	41
CCOc1cc(C(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)on1	ZINC000450852224	FE	On-Demand	Anodyne	CACNA1I	49	35
CCOc1cc(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)on1	ZINC000450852225	FE	On-Demand	Anodyne	CACNA1I	49	35
CC(C)OCCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450852246	CD	On-Demand	Anodyne	HPGDS	29	46
CS(=O)(=O)c1ccc(N2CCCC[C@H]2C(=O)NCC(F)F)nc1	ZINC000450852267	ED	On-Demand	Anodyne	WNT3	41	32
CC(C)[C@H]1CN(C[C@H](O)Cc2ccccc2)CCN1C	ZINC000450852272	CD	On-Demand	Anodyne	VACHT_TETCF	0	45
CC(C)[C@@H]1CN(C[C@H](O)Cc2ccccc2)CCN1C	ZINC000450852273	CD	On-Demand	Anodyne	VACHT_TETCF	0	45
CCCc1ncc(CNc2nc3ccccc3cc2[N+](=O)[O-])o1	ZINC000450852335	DG	On-Demand	Bother	PRKCQ	41	33
CCc1cc(N[C@@H]2CCO[C@@H](c3ccccn3)C2)n2ncnc2n1	ZINC000450852343	DE	On-Demand	Anodyne	DHOD	0	46
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000450852390	EH	On-Demand	Anodyne	LIPG	46	36
CC(=O)c1cccc(CN(C)CCCNC(=O)C2CCC2)c1	ZINC000450852395	DF	On-Demand	Anodyne	ACHE	0	41
CC(=O)c1cccc(CN(C)CCCNC(=O)C2CCC2)c1	ZINC000450852395	DF	On-Demand	Anodyne	TBK1	47	37
CC(=O)c1cccc(CN(C)CCCNC(=O)C2CCC2)c1	ZINC000450852395	DF	On-Demand	Anodyne	MTNR1C	0	42
CO[C@H](Cc1ccccc1)CN(C)CCCNC(=O)C1CCC1	ZINC000450852396	DE	On-Demand	Anodyne	AMY2	44	30
CO[C@@H](Cc1ccccc1)CN(C)CCCNC(=O)C1CCC1	ZINC000450852397	DE	On-Demand	Anodyne	AMY2	44	30
COc1cccc([C@@H]2C[C@@H](Nc3ncc([N+](=O)[O-])cc3C(N)=O)C2)c1	ZINC000450852409	EE	On-Demand	Bother	CACNA1D	72	34
CC1(C)C[C@@H](O)CCN(c2ncncc2-c2ccccc2)C1	ZINC000450852442	CG	On-Demand	Anodyne	SLC9A1	0	51
CC1(C)C[C@H](O)CCN(c2ncncc2-c2ccccc2)C1	ZINC000450852443	CG	On-Demand	Anodyne	SLC9A1	0	51
CCS(=O)(=O)c1ccc(CSC[C@H](C)CO)cc1	ZINC000450852450	CE	On-Demand	Anodyne	LTA4H	33	41
CCS(=O)(=O)c1ccc(CSC[C@@H](C)CO)cc1	ZINC000450852451	CE	On-Demand	Anodyne	LTA4H	33	41
O=C(N[C@H]1CCCO[C@@H]1c1ccncc1)c1cc(Cl)c2ccccc2n1	ZINC000450852452	FH	On-Demand	Anodyne	SSTR3	23	46
COc1ccccc1-c1noc(C2CCN(CC3=CCCCC3)CC2)n1	ZINC000450852460	FI	On-Demand	Anodyne	LUCI_PHOPE	28	41
COc1ccccc1-c1noc(C2CCN(CC3=CCCCC3)CC2)n1	ZINC000450852460	FI	On-Demand	Anodyne	SMO	50	41
COc1ccccc1-c1noc(C2CCN(CC3=CCCCC3)CC2)n1	ZINC000450852460	FI	On-Demand	Anodyne	ETHR	48	36
COC(=O)c1ccc(C(=O)CSc2nnc(CCCc3ccccc3)o2)o1	ZINC000450852463	GH	On-Demand	Anodyne	FAAH	66	47
COC(=O)c1ccc(C(=O)CSc2nnc(CCCc3ccccc3)o2)o1	ZINC000450852463	GH	On-Demand	Anodyne	CES1	56	44
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852504	EG	On-Demand	Anodyne	ADRB3	42	37
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852504	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852504	EG	On-Demand	Anodyne	LUCI_PHOPE	28	41
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852504	EG	On-Demand	Anodyne	SMO	56	45
CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852504	EG	On-Demand	Anodyne	ETHR	52	38
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852505	EG	On-Demand	Anodyne	ADRB3	42	37
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852505	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852505	EG	On-Demand	Anodyne	LUCI_PHOPE	28	41
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852505	EG	On-Demand	Anodyne	SMO	56	45
CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450852505	EG	On-Demand	Anodyne	ETHR	52	38
CNC(=O)C[C@@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450852517	FD	On-Demand	Bother	TBXA2R	27	41
CNC(=O)C[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450852518	FD	On-Demand	Bother	TBXA2R	27	41
COC(=O)c1csc(CN(C)CCCNC(=O)C2CCC2)n1	ZINC000450852519	ED	On-Demand	Anodyne	TBK1	69	36
COc1ccc2nc(C)nc(N3CC[C@@H](O)CC(C)(C)C3)c2c1	ZINC000450852524	DF	On-Demand	Anodyne	PDE3B	43	35
COc1ccc2nc(C)nc(N3CC[C@H](O)CC(C)(C)C3)c2c1	ZINC000450852525	DF	On-Demand	Anodyne	PDE3B	43	35
COCCNC(=O)c1ccc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)nc1	ZINC000450852540	FF	On-Demand	Anodyne	DRD4	47	36
COCCNC(=O)c1ccc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)nc1	ZINC000450852540	FF	On-Demand	Anodyne	ROCK2	40	36
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	THRA	0	42
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	DRD2	38	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	DRD1	24	52
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	DRD4	29	50
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	HRH2	0	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	HTR2A	39	56
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	HTR2C	28	68
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	ERG2	23	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	SLC18A3	0	50
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	HTR3B	0	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	CYP2J2	65	46
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852559	DF	On-Demand	Anodyne	AP2S1	0	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	THRA	0	42
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	DRD2	38	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	DRD1	24	52
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	DRD4	29	50
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	HRH2	0	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	HTR2A	39	56
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	HTR2C	28	68
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	ERG2	23	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	SLC18A3	0	50
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	HTR3B	0	49
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	CYP2J2	65	46
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852560	DF	On-Demand	Anodyne	AP2S1	0	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	THRA	0	42
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	DRD2	38	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	DRD1	24	52
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	DRD4	29	50
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	HRH2	0	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	HTR2A	39	56
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	HTR2C	28	68
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	ERG2	23	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	SLC18A3	0	50
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	HTR3B	0	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	CYP2J2	65	46
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@]1=O	ZINC000450852561	DF	On-Demand	Anodyne	AP2S1	0	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	THRA	0	42
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	DRD2	38	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	DRD1	24	52
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	DRD4	29	50
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	HRH2	0	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	HTR2A	39	56
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	HTR2C	28	68
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	ERG2	23	49
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	SLC18A3	0	50
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CC[S@@]1=O	ZINC000450852562	DF	On-Demand	Anodyne	CYP2J2	65	46
CCNC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450852569	DE	On-Demand	Anodyne	CA14	18	40
CCNC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450852569	DE	On-Demand	Anodyne	FIMH	15	40
C[C@@H](c1ccc(CN(C)CCCNC(=O)C2CCC2)cc1)C(F)(F)F	ZINC000450852572	FI	On-Demand	Anodyne	TBK1	40	40
C[C@H](c1ccc(CN(C)CCCNC(=O)C2CCC2)cc1)C(F)(F)F	ZINC000450852573	FI	On-Demand	Anodyne	TBK1	40	40
CN(C)c1nc(N2CC[C@@H](O)CC(C)(C)C2)nc2ccccc12	ZINC000450852574	DF	On-Demand	Anodyne	ADRA2A	0	40
CN(C)c1nc(N2CC[C@H](O)CC(C)(C)C2)nc2ccccc12	ZINC000450852575	DF	On-Demand	Anodyne	ADRA2A	0	40
CNC(=O)C[C@@H](C)Nc1nc(C)nc2scc(C)c12	ZINC000450852613	CE	On-Demand	Anodyne	UL26	91	34
CNC(=O)C[C@@H](C)Nc1nc(C)nc2scc(C)c12	ZINC000450852613	CE	On-Demand	Anodyne	SCAF_EBVB9	77	32
CNC(=O)C[C@H](C)Nc1nc(C)nc2scc(C)c12	ZINC000450852622	CE	On-Demand	Anodyne	UL26	91	34
CNC(=O)C[C@H](C)Nc1nc(C)nc2scc(C)c12	ZINC000450852622	CE	On-Demand	Anodyne	SCAF_EBVB9	77	32
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cc3S(C)(=O)=O)C2)c1	ZINC000450852636	GG	On-Demand	Bother	TBXA2R	17	42
CCN(CC)CCNC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450852641	EG	On-Demand	Anodyne	KCNQ1	0	69
COc1cccc(OCCC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)c1	ZINC000450852653	GE	On-Demand	Anodyne	DRD4	44	35
COc1cccc(OCCC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)c1	ZINC000450852653	GE	On-Demand	Anodyne	MTNR1A	25	42
COc1cccc(OCCC(=O)Nc2cccc3c2CCN3S(C)(=O)=O)c1	ZINC000450852653	GE	On-Demand	Anodyne	MTNR1B	30	42
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)sc2c1	ZINC000450852657	FG	On-Demand	Anodyne	LCK	22	40
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)sc2c1	ZINC000450852657	FG	On-Demand	Anodyne	CSNK1D	36	44
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)sc2c1	ZINC000450852657	FG	On-Demand	Anodyne	FABK	0	42
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)sc2c1	ZINC000450852657	FG	On-Demand	Anodyne	PORCN	0	42
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)sc2c1	ZINC000450852660	FG	On-Demand	Anodyne	LCK	22	40
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)sc2c1	ZINC000450852660	FG	On-Demand	Anodyne	CSNK1D	36	44
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)sc2c1	ZINC000450852660	FG	On-Demand	Anodyne	FABK	0	42
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)sc2c1	ZINC000450852660	FG	On-Demand	Anodyne	PORCN	0	42
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)sc2c1	ZINC000450852662	FG	On-Demand	Anodyne	LCK	22	40
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)sc2c1	ZINC000450852662	FG	On-Demand	Anodyne	CSNK1D	36	44
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)sc2c1	ZINC000450852662	FG	On-Demand	Anodyne	FABK	0	42
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)sc2c1	ZINC000450852662	FG	On-Demand	Anodyne	PORCN	0	42
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)sc2c1	ZINC000450852666	FG	On-Demand	Anodyne	LCK	22	40
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)sc2c1	ZINC000450852666	FG	On-Demand	Anodyne	CSNK1D	36	44
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)sc2c1	ZINC000450852666	FG	On-Demand	Anodyne	FABK	0	42
Cc1ccc2nc(NC(=O)CN[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)sc2c1	ZINC000450852666	FG	On-Demand	Anodyne	PORCN	0	42
COC(=O)c1ccc(-c2nnn(CC[C@@H](C)O)n2)cc1	ZINC000450852697	CC	On-Demand	Anodyne	SCARB1	53	39
COC(=O)c1ccc(-c2nnn(CC[C@H](C)O)n2)cc1	ZINC000450852705	CC	On-Demand	Anodyne	SCARB1	53	39
CO[C@H]1CN(Cc2cccc(C(C)=O)c2)C[C@@H]1OC	ZINC000450852713	CD	On-Demand	Anodyne	LEPB	0	40
CO[C@@H]1CN(Cc2cccc(C(C)=O)c2)C[C@H]1OC	ZINC000450852714	CD	On-Demand	Anodyne	LEPB	0	40
CO[C@H]1CN(CCc2ccc(Cl)cc2)C[C@@H]1OC	ZINC000450852720	CE	On-Demand	Anodyne	KCNA5	0	42
CO[C@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1OC	ZINC000450852721	CE	On-Demand	Anodyne	KCNA5	0	42
CO[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1OC	ZINC000450852722	CE	On-Demand	Anodyne	KCNA5	0	42
CCN(CC(=O)OC(C)(C)C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450852726	FH	On-Demand	Anodyne	ACHE	23	42
O=C(CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)Nc1cccc(C(F)(F)F)c1	ZINC000450852778	FH	On-Demand	Anodyne	CCR2	43	38
O=C(CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)Nc1cccc(C(F)(F)F)c1	ZINC000450852779	FH	On-Demand	Anodyne	CCR2	43	38
O=C(CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)Nc1cccc(C(F)(F)F)c1	ZINC000450852780	FH	On-Demand	Anodyne	CCR2	43	38
O=C(CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)Nc1cccc(C(F)(F)F)c1	ZINC000450852781	FH	On-Demand	Anodyne	CCR2	43	38
C[C@@H](Nc1ccc2nnnn2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450852808	DC	On-Demand	Anodyne	TPP2	56	36
C[C@H](Nc1ccc2nnnn2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450852809	DC	On-Demand	Anodyne	TPP2	56	36
C[C@H](Nc1ccc2nnnn2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450852810	DC	On-Demand	Anodyne	TPP2	56	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc2nnnn2n1	ZINC000450852811	DC	On-Demand	Anodyne	TPP2	56	36
O=C(C1=C(c2ccccc2)CCC1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450852813	FF	On-Demand	Anodyne	SLC6A7	0	48
COc1cccc(OCCC(=O)N[C@@](C)(CO)C2CCCCC2)c1	ZINC000450852826	EF	On-Demand	Anodyne	AMY2	46	33
COc1cccc(OCCC(=O)N[C@@](C)(CO)C2CCCCC2)c1	ZINC000450852826	EF	On-Demand	Anodyne	MTNR1A	44	44
COc1cccc(OCCC(=O)N[C@](C)(CO)C2CCCCC2)c1	ZINC000450852827	EF	On-Demand	Anodyne	AMY2	46	33
COc1cccc(OCCC(=O)N[C@](C)(CO)C2CCCCC2)c1	ZINC000450852827	EF	On-Demand	Anodyne	MTNR1A	44	44
CN(C)CC1(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCC1	ZINC000450852841	FF	On-Demand	Anodyne	ACAT	0	42
CN(C)CC1(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCC1	ZINC000450852841	FF	On-Demand	Anodyne	NPFFR1	47	34
CN(C)CC1(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCC1	ZINC000450852841	FF	On-Demand	Anodyne	PSBA	0	46
CCc1ncnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1F	ZINC000450852843	EF	On-Demand	Anodyne	TPP2	35	41
CCc1ncnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1F	ZINC000450852844	EF	On-Demand	Anodyne	TPP2	35	41
CCc1ncnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1F	ZINC000450852845	EF	On-Demand	Anodyne	TPP2	35	41
CCc1ncnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1F	ZINC000450852846	EF	On-Demand	Anodyne	TPP2	35	41
CCCNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450852863	FF	On-Demand	Anodyne	TPP2	70	44
CCCNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450852864	FF	On-Demand	Anodyne	TPP2	70	44
CCCNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450852865	FF	On-Demand	Anodyne	TPP2	70	44
CCCNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450852866	FF	On-Demand	Anodyne	TPP2	70	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852871	FG	On-Demand	Anodyne	ADRB3	16	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852871	FG	On-Demand	Anodyne	LTA4H	35	44
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852871	FG	On-Demand	Anodyne	MTNR1A	37	52
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852871	FG	On-Demand	Anodyne	MTNR1B	33	47
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852871	FG	On-Demand	Anodyne	NPY5R	25	45
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852871	FG	On-Demand	Anodyne	PLAU	44	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852871	FG	On-Demand	Anodyne	ACR	25	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852872	FG	On-Demand	Anodyne	ADRB3	16	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852872	FG	On-Demand	Anodyne	LTA4H	35	44
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852872	FG	On-Demand	Anodyne	MTNR1A	37	52
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852872	FG	On-Demand	Anodyne	MTNR1B	33	47
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852872	FG	On-Demand	Anodyne	NPY5R	25	45
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852872	FG	On-Demand	Anodyne	PLAU	44	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)CCOc2cccc(OC)c2)cc1	ZINC000450852872	FG	On-Demand	Anodyne	ACR	25	42
CCNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450852873	FF	On-Demand	Anodyne	TPP2	70	40
CCNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450852874	FF	On-Demand	Anodyne	TPP2	70	40
CCNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450852875	FF	On-Demand	Anodyne	TPP2	70	40
CCNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450852877	FF	On-Demand	Anodyne	TPP2	70	40
CC[C@@H](CC(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1	ZINC000450852903	DH	On-Demand	Anodyne	CAPN1	41	44
CC[C@@H](CC(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1	ZINC000450852903	DH	On-Demand	Anodyne	CAPN2	57	37
Cc1ccc(C(=O)N2CCN(c3ccnc(C)n3)CC2)c(C(C)C)n1	ZINC000450852939	EF	On-Demand	Anodyne	SORD	41	35
Cc1ccc(C(=O)N2CCN(c3ccnc(C)n3)CC2)c(C(C)C)n1	ZINC000450852939	EF	On-Demand	Anodyne	SLC6A7	0	42
O=C(CCCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852945	EG	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852945	EG	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852945	EG	On-Demand	Anodyne	HTR2A	26	49
O=C(CCCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852945	EG	On-Demand	Anodyne	HTR2C	23	54
O=C(CCCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852945	EG	On-Demand	Anodyne	SLC6A1	84	36
O=C(CCCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852945	EG	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852945	EG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC[C@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852945	EG	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852946	EG	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852946	EG	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852946	EG	On-Demand	Anodyne	HTR2A	26	49
O=C(CCCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852946	EG	On-Demand	Anodyne	HTR2C	23	54
O=C(CCCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852946	EG	On-Demand	Anodyne	SLC6A1	84	36
O=C(CCCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852946	EG	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852946	EG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852946	EG	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852947	EG	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852947	EG	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852947	EG	On-Demand	Anodyne	HTR2A	26	49
O=C(CCCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852947	EG	On-Demand	Anodyne	HTR2C	23	54
O=C(CCCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852947	EG	On-Demand	Anodyne	SLC6A1	84	36
O=C(CCCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852947	EG	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852947	EG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852947	EG	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852948	EG	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852948	EG	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852948	EG	On-Demand	Anodyne	HTR2A	26	49
O=C(CCCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852948	EG	On-Demand	Anodyne	HTR2C	23	54
O=C(CCCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852948	EG	On-Demand	Anodyne	SLC6A1	84	36
O=C(CCCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852948	EG	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852948	EG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(F)cc1	ZINC000450852948	EG	On-Demand	Anodyne	CYP2J2	54	38
CN(Cc1cc(Cl)ccc1F)CC1CCC(=O)CC1	ZINC000450852958	CH	On-Demand	Anodyne	NOS2	17	41
CN(Cc1cc(Cl)ccc1F)CC1CCC(=O)CC1	ZINC000450852958	CH	On-Demand	Anodyne	NOS3	18	40
CCOC(=O)c1ccc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450852964	EE	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450852965	EE	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450852966	EE	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)c1ccc(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450852967	EE	On-Demand	Anodyne	SSTR5	42	35
CO[C@H](C1CC1)[C@H](C)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450852980	DE	On-Demand	Anodyne	DHOD	0	47
CO[C@H](C1CC1)[C@@H](C)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450852981	DE	On-Demand	Anodyne	DHOD	0	47
CO[C@@H](C1CC1)[C@@H](C)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450852982	DE	On-Demand	Anodyne	DHOD	0	47
CO[C@@H](C1CC1)[C@H](C)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450852983	DE	On-Demand	Anodyne	DHOD	0	47
COc1cccc([C@@H]2C[C@@H](Nc3cc([N+](=O)[O-])ccc3S(N)(=O)=O)C2)c1	ZINC000450852985	GF	On-Demand	Bother	CACNA1D	64	34
COc1cccc([C@@H]2C[C@@H](Nc3cc([N+](=O)[O-])ccc3S(N)(=O)=O)C2)c1	ZINC000450852985	GF	On-Demand	Bother	CA14	19	43
CC[C@@H](C)N1CCN(c2cnc3cc(F)c(F)cc3n2)CC1	ZINC000450852992	DF	On-Demand	Anodyne	SORD	40	41
CC[C@H](C)N1CCN(c2cnc3cc(F)c(F)cc3n2)CC1	ZINC000450852993	DF	On-Demand	Anodyne	SORD	40	41
C[C@@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450853017	FG	On-Demand	Anodyne	HRH3	15	40
C[C@@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450853017	FG	On-Demand	Anodyne	CYP2J2	51	36
C[C@@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450853018	FG	On-Demand	Anodyne	HRH3	15	40
C[C@@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450853018	FG	On-Demand	Anodyne	CYP2J2	51	36
C[C@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450853019	FG	On-Demand	Anodyne	HRH3	15	40
C[C@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450853019	FG	On-Demand	Anodyne	CYP2J2	51	36
C[C@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450853020	FG	On-Demand	Anodyne	HRH3	15	40
C[C@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450853020	FG	On-Demand	Anodyne	CYP2J2	51	36
COCCOC[C@@H](O)CN1CCc2cccc(C)c2C1	ZINC000450853027	CD	On-Demand	Anodyne	ABCB1	42	35
COCCOC[C@H](O)CN1CCc2cccc(C)c2C1	ZINC000450853028	CD	On-Demand	Anodyne	ABCB1	42	35
CCN(CC)S(=O)(=O)c1ccc(N[C@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450853031	FE	On-Demand	Bother	BDKRB1	17	40
CCN(CC)S(=O)(=O)c1ccc(N[C@@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450853032	FE	On-Demand	Bother	BDKRB1	17	40
COc1ccccc1-c1noc(C2CCN(C[C@@H]3CCNC(=O)CC3)CC2)n1	ZINC000450853040	GF	On-Demand	Anodyne	CARM1	45	35
COc1ccccc1-c1noc(C2CCN(C[C@@H]3CCNC(=O)CC3)CC2)n1	ZINC000450853040	GF	On-Demand	Anodyne	SMO	48	41
COc1ccccc1-c1noc(C2CCN(C[C@@H]3CCNC(=O)CC3)CC2)n1	ZINC000450853040	GF	On-Demand	Anodyne	ETHR	48	35
COc1ccccc1-c1noc(C2CCN(C[C@H]3CCNC(=O)CC3)CC2)n1	ZINC000450853041	GF	On-Demand	Anodyne	CARM1	45	35
COc1ccccc1-c1noc(C2CCN(C[C@H]3CCNC(=O)CC3)CC2)n1	ZINC000450853041	GF	On-Demand	Anodyne	SMO	48	41
COc1ccccc1-c1noc(C2CCN(C[C@H]3CCNC(=O)CC3)CC2)n1	ZINC000450853041	GF	On-Demand	Anodyne	ETHR	48	35
COc1cc2c(N3CC[C@@H](O)CC(C)(C)C3)ncnc2cc1F	ZINC000450853043	DF	On-Demand	Anodyne	PDE3A	59	44
COc1cc2c(N3CC[C@@H](O)CC(C)(C)C3)ncnc2cc1F	ZINC000450853043	DF	On-Demand	Anodyne	PDGFRB	66	40
COc1cc2c(N3CC[C@@H](O)CC(C)(C)C3)ncnc2cc1F	ZINC000450853043	DF	On-Demand	Anodyne	PDE3B	86	44
COc1cc2c(N3CC[C@H](O)CC(C)(C)C3)ncnc2cc1F	ZINC000450853044	DF	On-Demand	Anodyne	PDE3A	59	44
COc1cc2c(N3CC[C@H](O)CC(C)(C)C3)ncnc2cc1F	ZINC000450853044	DF	On-Demand	Anodyne	PDGFRB	66	40
COc1cc2c(N3CC[C@H](O)CC(C)(C)C3)ncnc2cc1F	ZINC000450853044	DF	On-Demand	Anodyne	PDE3B	86	44
CN(C)[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450853048	DH	On-Demand	Anodyne	HRH3	19	41
CN(C)[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450853048	DH	On-Demand	Anodyne	SIGMAR1	32	45
CN(C)[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450853048	DH	On-Demand	Anodyne	NPY1R	28	45
CN(C)[C@H]1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450853049	DH	On-Demand	Anodyne	HRH3	19	41
CN(C)[C@H]1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450853049	DH	On-Demand	Anodyne	SIGMAR1	32	45
CN(C)[C@H]1CCCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450853049	DH	On-Demand	Anodyne	NPY1R	28	45
CC1(C)COC[C@@H]1Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450853060	GD	On-Demand	Bother	DDIT3	0	40
CC1(C)COC[C@H]1Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450853061	GD	On-Demand	Bother	DDIT3	0	40
CCOC(=O)c1csc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450853076	FH	On-Demand	Anodyne	SSTR5	42	34
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450853172	EG	On-Demand	Anodyne	AVPR2	25	42
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450853172	EG	On-Demand	Anodyne	AVPR1A	35	42
CC[C@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@H](O)CC	ZINC000450853174	EG	On-Demand	Anodyne	AVPR2	25	42
CC[C@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)[C@H](O)CC	ZINC000450853174	EG	On-Demand	Anodyne	AVPR1A	35	42
CCCc1nc(C)c(COc2ccc(Br)cc2[N+](=O)[O-])o1	ZINC000450853175	FI	On-Demand	Bother	S1PR4	0	40
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450853176	EG	On-Demand	Anodyne	AVPR2	25	42
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450853176	EG	On-Demand	Anodyne	AVPR1A	35	42
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450853178	EG	On-Demand	Anodyne	AVPR2	25	42
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450853178	EG	On-Demand	Anodyne	AVPR1A	35	42
CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450853179	GH	On-Demand	Anodyne	CCR2	61	42
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000450853210	GH	On-Demand	Anodyne	HCN1	42	32
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000450853210	GH	On-Demand	Anodyne	HCN4	42	32
C[C@@H](Nc1cncc(C(N)=O)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853226	ED	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1cncc(C(N)=O)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853227	ED	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1cncc(C(N)=O)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450853228	ED	On-Demand	Anodyne	TPP2	71	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cncc(C(N)=O)n1	ZINC000450853229	ED	On-Demand	Anodyne	TPP2	71	41
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450853232	FE	On-Demand	Bother	BCL2L1	76	37
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450853232	FE	On-Demand	Bother	BCL2	53	33
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450853233	FE	On-Demand	Bother	BCL2L1	76	37
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450853233	FE	On-Demand	Bother	BCL2	53	33
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450853234	FE	On-Demand	Bother	BCL2L1	76	37
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450853234	FE	On-Demand	Bother	BCL2	53	33
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450853235	FE	On-Demand	Bother	BCL2L1	76	37
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450853235	FE	On-Demand	Bother	BCL2	53	33
COc1cccc(OCCC(=O)N2CCN(c3ncc(F)cn3)CC2)c1	ZINC000450853236	FD	On-Demand	Anodyne	DRD4	43	32
COc1cccc(OCCC(=O)N2CCN(c3ncc(F)cn3)CC2)c1	ZINC000450853236	FD	On-Demand	Anodyne	SLC6A7	0	41
COc1cccc(OCCC(=O)NCc2nc3ccccc3n2C2CC2)c1	ZINC000450853252	FG	On-Demand	Anodyne	HTR7	18	40
COc1cccc(OCCC(=O)NCc2nc3ccccc3n2C2CC2)c1	ZINC000450853252	FG	On-Demand	Anodyne	MTNR1A	52	40
COc1cccc(OCCC(=O)NCc2nc3ccccc3n2C2CC2)c1	ZINC000450853252	FG	On-Demand	Anodyne	MTNR1B	42	40
COc1cccc(OCCC(=O)NCc2nc3ccccc3n2C2CC2)c1	ZINC000450853252	FG	On-Demand	Anodyne	FPR2	34	46
C[C@@](CO)(NC(=O)c1ccn(CCc2ccccc2)n1)C1CCCCC1	ZINC000450853253	FG	On-Demand	Anodyne	AMY2	47	33
C[C@](CO)(NC(=O)c1ccn(CCc2ccccc2)n1)C1CCCCC1	ZINC000450853254	FG	On-Demand	Anodyne	AMY2	47	33
COc1cc(CC(=O)Nc2cncnc2N(C)C)ccc1Cl	ZINC000450853255	DE	On-Demand	Anodyne	PDE6A	43	34
COc1ccc(CNC(=O)CCN(C)Cc2cc(C)ccc2F)c(OC)c1	ZINC000450853280	FG	On-Demand	Anodyne	MTNR1A	44	35
Cc1cccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450853281	CG	On-Demand	Anodyne	ACE	17	41
Cc1cccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450853281	CG	On-Demand	Anodyne	TPP2	64	40
Cc1cccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450853282	CG	On-Demand	Anodyne	ACE	17	41
Cc1cccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450853282	CG	On-Demand	Anodyne	TPP2	64	40
Cc1cccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450853283	CG	On-Demand	Anodyne	ACE	17	41
Cc1cccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450853283	CG	On-Demand	Anodyne	TPP2	64	40
Cc1cccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450853284	CG	On-Demand	Anodyne	ACE	17	41
Cc1cccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450853284	CG	On-Demand	Anodyne	TPP2	64	40
CC[C@@H](C)N1CCN(c2ccc(S(C)(=O)=O)cn2)CC1	ZINC000450853293	CD	On-Demand	Anodyne	GPR119	15	41
CC[C@H](C)N1CCN(c2ccc(S(C)(=O)=O)cn2)CC1	ZINC000450853294	CD	On-Demand	Anodyne	GPR119	15	41
CC[C@@H](C)N1CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450853302	DG	On-Demand	Anodyne	PDE3A	43	34
CC[C@@H](C)N1CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450853302	DG	On-Demand	Anodyne	PDGFRB	60	44
CC[C@@H](C)N1CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450853302	DG	On-Demand	Anodyne	PDE3B	63	34
CC[C@@H](C)N1CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450853302	DG	On-Demand	Anodyne	HTT	0	52
CC[C@H](C)N1CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450853303	DG	On-Demand	Anodyne	PDE3A	43	34
CC[C@H](C)N1CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450853303	DG	On-Demand	Anodyne	PDGFRB	60	44
CC[C@H](C)N1CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450853303	DG	On-Demand	Anodyne	PDE3B	63	34
CC[C@H](C)N1CCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450853303	DG	On-Demand	Anodyne	HTT	0	52
CN(CCCNC(=O)C1CCC1)Cc1cn(CC2CC2)nn1	ZINC000450853321	DD	On-Demand	Anodyne	TBK1	67	36
CN(C)[C@@H]1CCCN(CC/C=C\c2ccccc2)CC1	ZINC000450853324	CH	On-Demand	Anodyne	SLC6A1	56	35
CN(C)[C@@H]1CCCN(CC/C=C/c2ccccc2)CC1	ZINC000450853326	CH	On-Demand	Anodyne	SLC6A1	56	35
CN(C)[C@H]1CCCN(CC/C=C/c2ccccc2)CC1	ZINC000450853327	CH	On-Demand	Anodyne	SLC6A1	56	35
CN(C)[C@H]1CCCN(CC/C=C\c2ccccc2)CC1	ZINC000450853328	CH	On-Demand	Anodyne	SLC6A1	56	35
COc1ccccc1-c1noc(C2CCN(C[C@H]3CCC(F)(F)C3)CC2)n1	ZINC000450853331	GI	On-Demand	Anodyne	LUCI_PHOPE	22	40
COc1ccccc1-c1noc(C2CCN(C[C@H]3CCC(F)(F)C3)CC2)n1	ZINC000450853331	GI	On-Demand	Anodyne	SMO	51	41
COc1ccccc1-c1noc(C2CCN(C[C@H]3CCC(F)(F)C3)CC2)n1	ZINC000450853331	GI	On-Demand	Anodyne	ETHR	48	35
COc1ccccc1-c1noc(C2CCN(C[C@@H]3CCC(F)(F)C3)CC2)n1	ZINC000450853334	GI	On-Demand	Anodyne	LUCI_PHOPE	22	40
COc1ccccc1-c1noc(C2CCN(C[C@@H]3CCC(F)(F)C3)CC2)n1	ZINC000450853334	GI	On-Demand	Anodyne	SMO	51	41
COc1ccccc1-c1noc(C2CCN(C[C@@H]3CCC(F)(F)C3)CC2)n1	ZINC000450853334	GI	On-Demand	Anodyne	ETHR	48	35
CC[C@@H](C)N1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450853379	DD	On-Demand	Bother	P2RY12	24	40
CC[C@H](C)N1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450853381	DD	On-Demand	Bother	P2RY12	24	40
Cc1cccc(Cl)c1CN[C@@H](CO)C(C)(C)C	ZINC000450853383	CG	On-Demand	Anodyne	EIF2AK1	41	34
COc1ccc(CNC(=O)CCN[C@H]2CCOC[C@@H]2C)c(OC)c1	ZINC000450853396	ED	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCN[C@H]2CCOC[C@@H]2C)c(OC)c1	ZINC000450853396	ED	On-Demand	Anodyne	MTNR1B	40	33
COc1ccc(CNC(=O)CCN[C@H]2CCOC[C@H]2C)c(OC)c1	ZINC000450853397	ED	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCN[C@H]2CCOC[C@H]2C)c(OC)c1	ZINC000450853397	ED	On-Demand	Anodyne	MTNR1B	40	33
COc1ccc(CNC(=O)CCN[C@@H]2CCOC[C@H]2C)c(OC)c1	ZINC000450853398	ED	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCN[C@@H]2CCOC[C@H]2C)c(OC)c1	ZINC000450853398	ED	On-Demand	Anodyne	MTNR1B	40	33
COc1ccc(CNC(=O)CCN[C@@H]2CCOC[C@@H]2C)c(OC)c1	ZINC000450853399	ED	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc(CNC(=O)CCN[C@@H]2CCOC[C@@H]2C)c(OC)c1	ZINC000450853399	ED	On-Demand	Anodyne	MTNR1B	40	33
CCc1cc(CCCN(C)CCCNC(=O)C2CCC2)on1	ZINC000450853405	DE	On-Demand	Anodyne	TBK1	75	36
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cc3C#N)C2)c1	ZINC000450853406	DH	On-Demand	Mild	CACNA1D	40	34
Cc1ccnc(-c2noc(CN(C)CCCNC(=O)C3CCC3)n2)c1	ZINC000450853434	EE	On-Demand	Anodyne	TBK1	73	36
CC1(C)C[C@@H](O)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450853442	FH	On-Demand	Anodyne	PRNP	55	42
CC1(C)C[C@@H](O)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450853442	FH	On-Demand	Anodyne	HDAC1	31	42
CC1(C)C[C@@H](O)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450853442	FH	On-Demand	Anodyne	TAAR1	35	44
CC1(C)C[C@@H](O)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450853442	FH	On-Demand	Anodyne	KCNK3	44	38
CC1(C)C[C@H](O)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450853443	FH	On-Demand	Anodyne	PRNP	55	42
CC1(C)C[C@H](O)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450853443	FH	On-Demand	Anodyne	HDAC1	31	42
CC1(C)C[C@H](O)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450853443	FH	On-Demand	Anodyne	TAAR1	35	44
CC1(C)C[C@H](O)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450853443	FH	On-Demand	Anodyne	KCNK3	44	38
CCOC(=O)c1cc(N[C@@H]2COCC2(C)C)ccc1[N+](=O)[O-]	ZINC000450853455	DF	On-Demand	Bother	CACNA1D	58	34
CCOC(=O)c1cc(N[C@H]2COCC2(C)C)ccc1[N+](=O)[O-]	ZINC000450853456	DF	On-Demand	Bother	CACNA1D	58	34
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](O)CC(C)(C)C1	ZINC000450853457	FG	On-Demand	Anodyne	ATP4A	18	47
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](O)CC(C)(C)C1	ZINC000450853458	FG	On-Demand	Anodyne	ATP4A	18	47
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853491	FC	On-Demand	Anodyne	TGM2	22	40
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853491	FC	On-Demand	Anodyne	GCK	43	32
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853491	FC	On-Demand	Anodyne	GCKR	42	35
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853492	FC	On-Demand	Anodyne	TGM2	22	40
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853492	FC	On-Demand	Anodyne	GCK	43	32
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853492	FC	On-Demand	Anodyne	GCKR	42	35
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853493	FC	On-Demand	Anodyne	TGM2	22	40
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853493	FC	On-Demand	Anodyne	GCK	43	32
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450853493	FC	On-Demand	Anodyne	GCKR	42	35
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](O)CC	ZINC000450853494	FC	On-Demand	Anodyne	TGM2	22	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](O)CC	ZINC000450853494	FC	On-Demand	Anodyne	GCK	43	32
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)[C@H](O)CC	ZINC000450853494	FC	On-Demand	Anodyne	GCKR	42	35
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc[nH]1	ZINC000450853501	CF	On-Demand	Anodyne	ACE	17	40
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc[nH]1	ZINC000450853501	CF	On-Demand	Anodyne	TPP2	58	38
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc[nH]1	ZINC000450853502	CF	On-Demand	Anodyne	ACE	17	40
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc[nH]1	ZINC000450853502	CF	On-Demand	Anodyne	TPP2	58	38
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc[nH]1	ZINC000450853503	CF	On-Demand	Anodyne	ACE	17	40
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc[nH]1	ZINC000450853503	CF	On-Demand	Anodyne	TPP2	58	38
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc[nH]1	ZINC000450853504	CF	On-Demand	Anodyne	ACE	17	40
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc[nH]1	ZINC000450853504	CF	On-Demand	Anodyne	TPP2	58	38
C[C@@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853507	FD	On-Demand	Anodyne	TPP2	66	37
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450853508	FD	On-Demand	Anodyne	TPP2	66	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(S(N)(=O)=O)s1	ZINC000450853509	FD	On-Demand	Anodyne	TPP2	66	37
C[C@H](Nc1ncc(S(N)(=O)=O)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853510	FD	On-Demand	Anodyne	TPP2	66	37
CCOC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450853513	FG	On-Demand	Anodyne	TPP2	71	39
CCOC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450853514	FG	On-Demand	Anodyne	TPP2	71	39
CCOC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450853515	FG	On-Demand	Anodyne	TPP2	71	39
CCOC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450853516	FG	On-Demand	Anodyne	TPP2	71	39
O=C(C1=C(c2ccccc2)CCCC1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450853520	FG	On-Demand	Anodyne	SLC6A7	0	48
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853522	FD	On-Demand	Anodyne	TPP2	70	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450853523	FD	On-Demand	Anodyne	TPP2	70	39
C[C@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450853524	FD	On-Demand	Anodyne	TPP2	70	39
C[C@@H](Nc1ccc(S(N)(=O)=O)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853525	FD	On-Demand	Anodyne	TPP2	70	39
Cc1ccc(C(C)(C)NC(=O)c2cc(Cl)c(F)cc2Br)cn1	ZINC000450853534	GJ	On-Demand	Anodyne	IMPDH2	15	51
C[C@H](N=c1cc[nH]c2ccncc12)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450853558	EF	On-Demand	Anodyne	TPP2	57	39
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000450853559	GH	On-Demand	Anodyne	HCN1	42	32
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000450853559	GH	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000450853560	GH	On-Demand	Anodyne	HCN1	42	32
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000450853560	GH	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000450853561	GH	On-Demand	Anodyne	HCN1	42	32
CCOc1ccccc1[C@H](CC)NC(=O)CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000450853561	GH	On-Demand	Anodyne	HCN4	42	32
C[C@H](N=c1cc[nH]c2ccncc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853563	EF	On-Demand	Anodyne	TPP2	57	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1cc[nH]c2ccncc12	ZINC000450853566	EF	On-Demand	Anodyne	TPP2	57	39
C[C@@H](N=c1cc[nH]c2ccncc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853568	EF	On-Demand	Anodyne	TPP2	57	39
C[C@](CO)(NC(=O)Cc1ccccc1O[C@H]1CCOC1)C1CCCCC1	ZINC000450853576	FF	On-Demand	Anodyne	AMY2	44	31
C[C@](CO)(NC(=O)Cc1ccccc1O[C@H]1CCOC1)C1CCCCC1	ZINC000450853576	FF	On-Demand	Anodyne	PDEC	0	41
C[C@@](CO)(NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C1CCCCC1	ZINC000450853578	FF	On-Demand	Anodyne	AMY2	44	31
C[C@@](CO)(NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C1CCCCC1	ZINC000450853578	FF	On-Demand	Anodyne	PDEC	0	41
C[C@@](CO)(NC(=O)Cc1ccccc1O[C@H]1CCOC1)C1CCCCC1	ZINC000450853580	FF	On-Demand	Anodyne	AMY2	44	31
C[C@@](CO)(NC(=O)Cc1ccccc1O[C@H]1CCOC1)C1CCCCC1	ZINC000450853580	FF	On-Demand	Anodyne	PDEC	0	41
C[C@](CO)(NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C1CCCCC1	ZINC000450853582	FF	On-Demand	Anodyne	AMY2	44	31
C[C@](CO)(NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C1CCCCC1	ZINC000450853582	FF	On-Demand	Anodyne	PDEC	0	41
CSCc1ccccc1NC(=O)c1cc2c([nH]1)CCCC2	ZINC000450853619	DI	On-Demand	Anodyne	CCKAR	30	55
C[C@H](N=c1cc[nH]c(C(N)=O)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853620	DD	On-Demand	Anodyne	TPP2	57	38
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1cc[nH]c(C(N)=O)c1	ZINC000450853621	DD	On-Demand	Anodyne	TPP2	57	38
C[C@H](N=c1cc[nH]c(C(N)=O)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450853623	DD	On-Demand	Anodyne	TPP2	57	38
CC(F)(F)CCOc1ccc(Br)cc1[N+](=O)[O-]	ZINC000450853650	DH	On-Demand	Bother	S1PR4	0	49
COC(=O)c1ccc(-c2nnn(C[C@@H](C)S(C)(=O)=O)n2)cc1	ZINC000450853669	DC	On-Demand	Anodyne	SCARB1	51	39
COC(=O)c1ccc(-c2nnn(C[C@H](C)S(C)(=O)=O)n2)cc1	ZINC000450853670	DC	On-Demand	Anodyne	SCARB1	51	39
Cc1ccc2ncnc(N[C@H]3CCO[C@H](c4cccs4)C3)c2c1	ZINC000450853683	EI	On-Demand	Anodyne	CD38	98	46
Cc1ccc2ncnc(N[C@@H]3CCO[C@H](c4cccs4)C3)c2c1	ZINC000450853684	EI	On-Demand	Anodyne	CD38	98	46
Cc1ccc2ncnc(N[C@H]3CCO[C@@H](c4cccs4)C3)c2c1	ZINC000450853685	EI	On-Demand	Anodyne	CD38	98	46
FC(F)c1ccnc(N[C@H]2CCO[C@@H](c3cccs3)C2)n1	ZINC000450853686	DH	On-Demand	Anodyne	MAPK1	50	33
FC(F)c1ccnc(N[C@@H]2CCO[C@H](c3cccs3)C2)n1	ZINC000450853687	DH	On-Demand	Anodyne	MAPK1	50	33
FC(F)c1ccnc(N[C@H]2CCO[C@H](c3cccs3)C2)n1	ZINC000450853688	DH	On-Demand	Anodyne	MAPK1	50	33
COc1cccc([C@@H]2C[C@@H](Nc3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])C2)c1	ZINC000450853709	GH	On-Demand	Bother	MAPK14	21	44
COc1cccc([C@@H]2C[C@@H](Nc3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])C2)c1	ZINC000450853709	GH	On-Demand	Bother	TAAR1	35	50
COc1cc2c(N[C@@H]3COCC3(C)C)ncnc2cc1F	ZINC000450853713	CF	On-Demand	Anodyne	EGFR	23	44
COc1cc2c(N[C@@H]3COCC3(C)C)ncnc2cc1F	ZINC000450853713	CF	On-Demand	Anodyne	FGFR1	0	43
COc1cc2c(N[C@@H]3COCC3(C)C)ncnc2cc1F	ZINC000450853713	CF	On-Demand	Anodyne	FLT1	24	45
COc1cc2c(N[C@@H]3COCC3(C)C)ncnc2cc1F	ZINC000450853713	CF	On-Demand	Anodyne	EPHA2	47	37
COc1cc2c(N[C@H]3COCC3(C)C)ncnc2cc1F	ZINC000450853714	CF	On-Demand	Anodyne	EGFR	23	44
COc1cc2c(N[C@H]3COCC3(C)C)ncnc2cc1F	ZINC000450853714	CF	On-Demand	Anodyne	FGFR1	0	43
COc1cc2c(N[C@H]3COCC3(C)C)ncnc2cc1F	ZINC000450853714	CF	On-Demand	Anodyne	FLT1	24	45
COc1cc2c(N[C@H]3COCC3(C)C)ncnc2cc1F	ZINC000450853714	CF	On-Demand	Anodyne	EPHA2	47	37
CC(=O)CCCCCSc1ncc[nH]1	ZINC000450853728	BF	On-Demand	Anodyne	HDA106	0	45
C[C@@H](O)CCN1CCC(c2ccncc2)CC1	ZINC000450853729	BE	On-Demand	Anodyne	PRCP	25	43
C[C@@H](O)CCN1CCC(c2ccncc2)CC1	ZINC000450853729	BE	On-Demand	Anodyne	SLC18A3	20	44
C[C@H](O)CCN1CCC(c2ccncc2)CC1	ZINC000450853730	BE	On-Demand	Anodyne	PRCP	25	43
C[C@H](O)CCN1CCC(c2ccncc2)CC1	ZINC000450853730	BE	On-Demand	Anodyne	SLC18A3	20	44
C[C@@H]1CCS(=O)(=O)CCN1CCc1ccc(Cl)cc1	ZINC000450853755	DE	On-Demand	Anodyne	HRH3	49	53
C[C@H]1CCS(=O)(=O)CCN1CCc1ccc(Cl)cc1	ZINC000450853756	DE	On-Demand	Anodyne	HRH3	49	53
CCc1cc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)n2ncnc2n1	ZINC000450853761	DG	On-Demand	Anodyne	DHOD	0	48
CCO[C@H]1COCC[C@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450853774	DD	On-Demand	Anodyne	MTNR1A	26	42
CCO[C@H]1COCC[C@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450853774	DD	On-Demand	Anodyne	MTNR1B	24	42
CCO[C@H]1COCC[C@@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450853775	DD	On-Demand	Anodyne	MTNR1A	26	42
CCO[C@H]1COCC[C@@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450853775	DD	On-Demand	Anodyne	MTNR1B	24	42
CCO[C@@H]1COCC[C@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450853776	DD	On-Demand	Anodyne	MTNR1A	26	42
CCO[C@@H]1COCC[C@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450853776	DD	On-Demand	Anodyne	MTNR1B	24	42
CCO[C@@H]1COCC[C@@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450853777	DD	On-Demand	Anodyne	MTNR1A	26	42
CCO[C@@H]1COCC[C@@H]1NC(=O)CCOc1cccc(OC)c1	ZINC000450853777	DD	On-Demand	Anodyne	MTNR1B	24	42
CCC[C@@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450853779	CD	On-Demand	Anodyne	GNAI1	0	41
CCC[C@@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450853779	CD	On-Demand	Anodyne	GNAI3	0	41
CCC[C@@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450853779	CD	On-Demand	Anodyne	GNAO1	0	41
CCC[C@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450853780	CD	On-Demand	Anodyne	GNAI1	0	41
CCC[C@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450853780	CD	On-Demand	Anodyne	GNAI3	0	41
CCC[C@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450853780	CD	On-Demand	Anodyne	GNAO1	0	41
CCS(=O)(=O)c1ccc(CSCC(=O)C(C)(C)C)cc1	ZINC000450853803	DG	On-Demand	Anodyne	RORC	44	33
CCC[C@@H](CC(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1	ZINC000450853828	DI	On-Demand	Anodyne	CAPN1	40	40
CCC[C@@H](CC(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1	ZINC000450853828	DI	On-Demand	Anodyne	CAPN2	54	36
CN(CC1(O)CCC1)C(=O)Cc1cc2ccccc2s1	ZINC000450853850	CF	On-Demand	Anodyne	AROQ	23	41
C[C@H](NCc1ccn(CC(F)(F)F)n1)c1cccc(OCc2ccccc2)c1	ZINC000450853883	GJ	On-Demand	Anodyne	PDS	44	35
C[C@@H](NCc1ccn(CC(F)(F)F)n1)c1cccc(OCc2ccccc2)c1	ZINC000450853884	GJ	On-Demand	Anodyne	PDS	44	35
C[C@@H](N=c1cc[nH]c(C(N)=O)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853890	DD	On-Demand	Anodyne	TPP2	57	38
COc1cccc(-n2cc(C(=O)NC(C)(C)c3ccc(C)nc3)nn2)c1	ZINC000450853910	FF	On-Demand	Anodyne	ESRRA	18	42
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450853914	FD	On-Demand	Bother	TAAR1	17	46
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450853915	FD	On-Demand	Bother	TAAR1	17	46
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450853916	FD	On-Demand	Bother	TAAR1	17	46
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450853917	FD	On-Demand	Bother	TAAR1	17	46
Cc1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1C#N	ZINC000450853938	DE	On-Demand	Mild	DRD4	22	40
Cc1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1C#N	ZINC000450853938	DE	On-Demand	Mild	TPP2	68	39
Cc1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1C#N	ZINC000450853939	DE	On-Demand	Mild	DRD4	22	40
Cc1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1C#N	ZINC000450853939	DE	On-Demand	Mild	TPP2	68	39
Cc1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1C#N	ZINC000450853940	DE	On-Demand	Mild	DRD4	22	40
Cc1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1C#N	ZINC000450853940	DE	On-Demand	Mild	TPP2	68	39
Cc1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1C#N	ZINC000450853941	DE	On-Demand	Mild	DRD4	22	40
Cc1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1C#N	ZINC000450853941	DE	On-Demand	Mild	TPP2	68	39
CC(=O)CCCCCn1nnnc1CCCc1ccccc1	ZINC000450853946	DF	On-Demand	Anodyne	FAAH	69	54
CC(=O)CCCCCn1nnnc1CCCc1ccccc1	ZINC000450853946	DF	On-Demand	Anodyne	CES1	62	39
CC(=O)CCCCCn1nnnc1CCCc1ccccc1	ZINC000450853946	DF	On-Demand	Anodyne	DAGLA	31	47
CC(=O)CCCCCn1nnnc1CCCc1ccccc1	ZINC000450853946	DF	On-Demand	Anodyne	CES1D	56	34
CC[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[C@H](O)CC	ZINC000450853947	DD	On-Demand	Bother	TBXA2R	30	41
CC[C@H](O)[C@H](CC)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450853948	DD	On-Demand	Bother	TBXA2R	30	41
CC[C@H](O)[C@@H](CC)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450853949	DD	On-Demand	Bother	TBXA2R	30	41
CC[C@@H](O)[C@@H](CC)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450853950	DD	On-Demand	Bother	TBXA2R	30	41
C[C@@H](Nc1ccc(S(C)(=O)=O)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853963	FE	On-Demand	Anodyne	TPP2	64	36
C[C@H](Nc1ccc(S(C)(=O)=O)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450853964	FE	On-Demand	Anodyne	TPP2	64	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(S(C)(=O)=O)cn1	ZINC000450853965	FE	On-Demand	Anodyne	TPP2	64	36
C[C@H](Nc1ccc(S(C)(=O)=O)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450853966	FE	On-Demand	Anodyne	TPP2	64	36
C[C@@](CO)(NC(=O)c1cn(CCc2ccccc2)nn1)C1CCCCC1	ZINC000450853978	FF	On-Demand	Anodyne	AMY2	44	31
C[C@](CO)(NC(=O)c1cn(CCc2ccccc2)nn1)C1CCCCC1	ZINC000450853979	FF	On-Demand	Anodyne	AMY2	44	31
FC1(F)CC[C@@H](CN2CCC(c3ncccc3Cl)CC2)C1	ZINC000450854010	DI	On-Demand	Anodyne	OPRL1	16	46
FC1(F)CC[C@@H](CN2CCC(c3ncccc3Cl)CC2)C1	ZINC000450854010	DI	On-Demand	Anodyne	TACR3	43	31
FC1(F)CC[C@H](CN2CCC(c3ncccc3Cl)CC2)C1	ZINC000450854011	DI	On-Demand	Anodyne	OPRL1	16	46
FC1(F)CC[C@H](CN2CCC(c3ncccc3Cl)CC2)C1	ZINC000450854011	DI	On-Demand	Anodyne	TACR3	43	31
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCS(=O)(=O)C1	ZINC000450854014	EE	On-Demand	Anodyne	DRD2	32	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCS(=O)(=O)C1	ZINC000450854014	EE	On-Demand	Anodyne	HTR2A	25	52
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCS(=O)(=O)C1	ZINC000450854014	EE	On-Demand	Anodyne	HTR3B	0	44
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CCS(=O)(=O)C1	ZINC000450854014	EE	On-Demand	Anodyne	CYP2J2	53	38
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCS(=O)(=O)C1	ZINC000450854015	EE	On-Demand	Anodyne	DRD2	32	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCS(=O)(=O)C1	ZINC000450854015	EE	On-Demand	Anodyne	HTR2A	25	52
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCS(=O)(=O)C1	ZINC000450854015	EE	On-Demand	Anodyne	HTR3B	0	44
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CCS(=O)(=O)C1	ZINC000450854015	EE	On-Demand	Anodyne	CYP2J2	53	38
C[C@@H]1CC[S@@](=O)CCN1CCN(C)Cc1ccccc1	ZINC000450854018	CD	On-Demand	Anodyne	SIGMAR1	18	40
C[C@H]1CC[S@@](=O)CCN1CCN(C)Cc1ccccc1	ZINC000450854019	CD	On-Demand	Anodyne	SIGMAR1	18	40
C[C@@H]1CC[S@](=O)CCN1CCN(C)Cc1ccccc1	ZINC000450854020	CD	On-Demand	Anodyne	SIGMAR1	18	40
C[C@H]1CC[S@](=O)CCN1CCN(C)Cc1ccccc1	ZINC000450854021	CD	On-Demand	Anodyne	SIGMAR1	18	40
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	DRD2	26	47
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	DRD4	56	40
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	ACHE	34	44
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	HRH1	16	44
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	CHRM3	21	40
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	HRH3	17	47
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	SIGMAR1	39	42
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	SSTR5	45	39
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	CCR3	42	44
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	CXCR3	30	42
CC(=O)c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1	ZINC000450854031	EI	On-Demand	Anodyne	MCHR1	44	42
COc1ccccc1-c1noc(C2CCN(CCc3cscn3)CC2)n1	ZINC000450854032	FH	On-Demand	Anodyne	CARM1	55	37
COc1ccccc1-c1noc(C2CCN(CCc3cscn3)CC2)n1	ZINC000450854032	FH	On-Demand	Anodyne	SMO	48	43
COc1ccccc1-c1noc(C2CCN(CCc3cscn3)CC2)n1	ZINC000450854032	FH	On-Demand	Anodyne	ETHR	50	35
CCc1cc2c(N[C@H]3CCO[C@H](c4cccs4)C3)ncnc2s1	ZINC000450854081	EJ	On-Demand	Anodyne	CD38	42	39
CCc1cc2c(N[C@@H]3CCO[C@H](c4cccs4)C3)ncnc2s1	ZINC000450854082	EJ	On-Demand	Anodyne	CD38	42	39
CCc1cc2c(N[C@H]3CCO[C@@H](c4cccs4)C3)ncnc2s1	ZINC000450854083	EJ	On-Demand	Anodyne	CD38	42	39
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)Cc2ccc(C(=O)OC)cc2)cn1	ZINC000450854103	FE	On-Demand	Anodyne	PANC	46	39
Cc1cccc(Cl)c1CN[C@@H]1Cc2cccc(O)c2C1	ZINC000450854116	CH	On-Demand	Anodyne	EIF2AK1	40	35
Cc1cccc(Cl)c1CN[C@H]1Cc2cccc(O)c2C1	ZINC000450854130	CH	On-Demand	Anodyne	EIF2AK1	40	35
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)n1	ZINC000450854131	FG	On-Demand	Bother	CACNA1D	46	35
COC(=O)c1ccc(-c2nnn(C[C@H]3CCCC3(F)F)n2)cc1	ZINC000450854152	DF	On-Demand	Anodyne	SCARB1	51	39
COC(=O)c1ccc(-c2nnn(C[C@@H]3CCCC3(F)F)n2)cc1	ZINC000450854153	DF	On-Demand	Anodyne	SCARB1	51	39
CC[C@H](C)N1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)CC1	ZINC000450854170	FG	On-Demand	Anodyne	P2RY12	33	48
CC[C@@H](C)N1CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)CC1	ZINC000450854172	FG	On-Demand	Anodyne	P2RY12	33	48
COC(=O)c1ccc(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854174	FG	On-Demand	Anodyne	DRD4	22	40
COC(=O)c1ccc(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854174	FG	On-Demand	Anodyne	CCR3	38	40
COC(=O)c1ccc(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854174	FG	On-Demand	Anodyne	MCHR1	28	40
COC(=O)c1ccc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854177	FG	On-Demand	Anodyne	DRD4	22	40
COC(=O)c1ccc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854177	FG	On-Demand	Anodyne	CCR3	38	40
COC(=O)c1ccc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854177	FG	On-Demand	Anodyne	MCHR1	28	40
COC(=O)c1ccc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854179	FG	On-Demand	Anodyne	DRD4	22	40
COC(=O)c1ccc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854179	FG	On-Demand	Anodyne	CCR3	38	40
COC(=O)c1ccc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854179	FG	On-Demand	Anodyne	MCHR1	28	40
COC(=O)c1ccc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854182	FG	On-Demand	Anodyne	DRD4	22	40
COC(=O)c1ccc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854182	FG	On-Demand	Anodyne	CCR3	38	40
COC(=O)c1ccc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450854182	FG	On-Demand	Anodyne	MCHR1	28	40
C[C@H](Nc1ncc(C#N)cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854264	EG	On-Demand	Mild	TPP2	63	34
CC[C@H](C)N1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450854268	FE	On-Demand	Anodyne	P2RY12	32	46
CC[C@H](C)N1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450854268	FE	On-Demand	Anodyne	CXCR3	26	40
CC[C@H](C)N1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450854268	FE	On-Demand	Anodyne	LRRK2	27	40
CC[C@@H](C)N1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450854269	FE	On-Demand	Anodyne	P2RY12	32	46
CC[C@@H](C)N1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450854269	FE	On-Demand	Anodyne	CXCR3	26	40
CC[C@@H](C)N1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450854269	FE	On-Demand	Anodyne	LRRK2	27	40
CC[C@H](C)N1CCN(c2cncc(-c3ccccc3)n2)CC1	ZINC000450854270	CG	On-Demand	Anodyne	SORD	60	42
CC[C@@H](C)N1CCN(c2cncc(-c3ccccc3)n2)CC1	ZINC000450854271	CG	On-Demand	Anodyne	SORD	60	42
CC[C@H](C)N1CCN(c2nccc(Oc3ccccc3)n2)CC1	ZINC000450854272	DG	On-Demand	Anodyne	SORD	82	44
CC[C@@H](C)N1CCN(c2nccc(Oc3ccccc3)n2)CC1	ZINC000450854273	DG	On-Demand	Anodyne	SORD	82	44
CO[C@H](C1CC1)[C@@H](C)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450854274	DE	On-Demand	Anodyne	LRRK2	37	45
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(C#N)cc1Cl	ZINC000450854275	EG	On-Demand	Mild	TPP2	63	34
C[C@H](Nc1ncc(C#N)cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854276	EG	On-Demand	Mild	TPP2	63	34
CO[C@H](C1CC1)[C@H](C)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450854277	DE	On-Demand	Anodyne	LRRK2	37	45
C[C@@H](Nc1ncc(C#N)cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854278	EG	On-Demand	Mild	TPP2	63	34
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450854279	DE	On-Demand	Anodyne	LRRK2	37	45
CO[C@@H](C1CC1)[C@H](C)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450854281	DE	On-Demand	Anodyne	LRRK2	37	45
CC[C@@H](O)CC(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450854284	FF	On-Demand	Anodyne	PRSS2	47	33
CC[C@H](O)CC(=O)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450854286	FF	On-Demand	Anodyne	PRSS2	47	33
C[C@@H](O)CCSCc1cccc(OC(F)F)c1	ZINC000450854293	CG	On-Demand	Anodyne	CACNA2D1	42	52
CC[C@@H](C)N1CCN(c2nc3ccccc3nc2C)CC1	ZINC000450854305	CF	On-Demand	Anodyne	HTR3A	16	42
C[C@H](O)CCSCc1cccc(OC(F)F)c1	ZINC000450854306	CG	On-Demand	Anodyne	CACNA2D1	42	52
CC[C@H](C)N1CCN(c2nc3ccccc3nc2C)CC1	ZINC000450854307	CF	On-Demand	Anodyne	HTR3A	16	42
COc1ccccc1C1(CNC(=O)CS(=O)(=O)C2CC2)CCC1	ZINC000450854322	ED	On-Demand	Anodyne	KCNA3	44	43
CC[C@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)[C@H](O)CC	ZINC000450854336	GH	On-Demand	Anodyne	PDS	37	66
CC[C@H](O)[C@H](CC)Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450854337	GH	On-Demand	Anodyne	PDS	37	66
CC[C@H](O)[C@@H](CC)Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450854338	GH	On-Demand	Anodyne	PDS	37	66
CC[C@@H](O)[C@@H](CC)Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450854339	GH	On-Demand	Anodyne	PDS	37	66
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]c(C2CC2)n1	ZINC000450854365	EF	On-Demand	Anodyne	TPP2	66	40
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]c(C2CC2)n1	ZINC000450854366	EF	On-Demand	Anodyne	TPP2	66	40
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]c(C2CC2)n1	ZINC000450854367	EF	On-Demand	Anodyne	TPP2	66	40
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]c(C2CC2)n1	ZINC000450854368	EF	On-Demand	Anodyne	TPP2	66	40
C[C@@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854373	EC	On-Demand	Anodyne	ACE	16	40
C[C@@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854373	EC	On-Demand	Anodyne	DRD4	22	40
C[C@@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854373	EC	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854374	EC	On-Demand	Anodyne	ACE	16	40
C[C@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854374	EC	On-Demand	Anodyne	DRD4	22	40
C[C@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854374	EC	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854375	EC	On-Demand	Anodyne	ACE	16	40
C[C@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854375	EC	On-Demand	Anodyne	DRD4	22	40
C[C@H](Nc1ccc(C(N)=O)nn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854375	EC	On-Demand	Anodyne	TPP2	71	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C(N)=O)nn1	ZINC000450854376	EC	On-Demand	Anodyne	ACE	16	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C(N)=O)nn1	ZINC000450854376	EC	On-Demand	Anodyne	DRD4	22	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C(N)=O)nn1	ZINC000450854376	EC	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1ccc2nnc(C(C)(C)C)n2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854377	GF	On-Demand	Anodyne	TPP2	53	34
C[C@H](Nc1ccc2nnc(C(C)(C)C)n2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854378	GF	On-Demand	Anodyne	TPP2	53	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc2nnc(C(C)(C)C)n2n1	ZINC000450854379	GF	On-Demand	Anodyne	TPP2	53	34
C[C@@H](Nc1ccc2nnc(C(C)(C)C)n2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854380	GF	On-Demand	Anodyne	TPP2	53	34
C[C@H](Nc1ccc(C(=O)N(C)C)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854381	FF	On-Demand	Anodyne	TPP2	41	35
C[C@H](Nc1ccc(C(=O)N(C)C)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854382	FF	On-Demand	Anodyne	TPP2	41	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C(=O)N(C)C)cn1	ZINC000450854383	FF	On-Demand	Anodyne	TPP2	41	35
C[C@@H](Nc1ccc(C(=O)N(C)C)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854384	FF	On-Demand	Anodyne	TPP2	41	35
CC(=O)c1ccc2cc(OCCC[C@@H](C)O)ccc2c1	ZINC000450854385	CH	On-Demand	Anodyne	PLA2G4B	55	33
CC(=O)c1ccc2cc(OCCC[C@H](C)O)ccc2c1	ZINC000450854386	CH	On-Demand	Anodyne	PLA2G4B	55	33
CSCc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450854387	EI	On-Demand	Anodyne	KCNQ2	65	37
CSCc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450854388	EI	On-Demand	Anodyne	KCNQ2	65	37
COc1cccc([C@@H]2C[C@@H](Nc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1	ZINC000450854393	EG	On-Demand	Bother	TAAR1	28	49
COc1ccc(Br)c(CN(C)C[C@H]2CCNC(=O)CC2)c1	ZINC000450854406	FF	On-Demand	Anodyne	CYP27A1	0	40
COc1ccc(Br)c(CN(C)C[C@@H]2CCNC(=O)CC2)c1	ZINC000450854407	FF	On-Demand	Anodyne	CYP27A1	0	40
CC1(C)COC[C@H]1Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450854411	GH	On-Demand	Anodyne	PDS	15	65
CC1(C)COC[C@@H]1Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl	ZINC000450854412	GH	On-Demand	Anodyne	PDS	15	65
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCO[C@@H]1c1ccncc1	ZINC000450854444	FI	On-Demand	Anodyne	MTTP	45	35
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCO[C@@H]1c1ccncc1	ZINC000450854444	FI	On-Demand	Anodyne	CCR2	47	43
CC1(C)C[C@@H](O)CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450854460	FE	On-Demand	Anodyne	CXCR3	26	41
CC1(C)C[C@H](O)CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450854461	FE	On-Demand	Anodyne	CXCR3	26	41
COc1ccc(CNC(=O)CCN2CC[C@H](C)S(=O)(=O)CC2)c(OC)c1	ZINC000450854462	GD	On-Demand	Anodyne	HTR7	28	41
COc1ccc(CNC(=O)CCN2CC[C@H](C)S(=O)(=O)CC2)c(OC)c1	ZINC000450854462	GD	On-Demand	Anodyne	MTNR1A	41	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C)S(=O)(=O)CC2)c(OC)c1	ZINC000450854463	GD	On-Demand	Anodyne	HTR7	28	41
COc1ccc(CNC(=O)CCN2CC[C@@H](C)S(=O)(=O)CC2)c(OC)c1	ZINC000450854463	GD	On-Demand	Anodyne	MTNR1A	41	36
CCS(=O)(=O)c1ccc(CN2CCC[C@H](N(C)C)CC2)cc1	ZINC000450854473	DE	On-Demand	Anodyne	HRH3	28	48
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](N(C)C)CC2)cc1	ZINC000450854474	DE	On-Demand	Anodyne	HRH3	28	48
C[C@](CO)(NC(=O)CCc1ccc2ccccc2c1O)C1CCCCC1	ZINC000450854504	FH	On-Demand	Anodyne	AMY2	43	29
C[C@@](CO)(NC(=O)CCc1ccc2ccccc2c1O)C1CCCCC1	ZINC000450854505	FH	On-Demand	Anodyne	AMY2	43	29
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450854506	ED	On-Demand	Anodyne	GCKR	65	34
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450854507	ED	On-Demand	Anodyne	GCKR	65	34
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)[C@H](O)CC	ZINC000450854508	ED	On-Demand	Anodyne	GCKR	65	34
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450854509	ED	On-Demand	Anodyne	GCKR	65	34
C[C@H](Nc1cnc(C(=O)OC(C)(C)C)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854528	GF	On-Demand	Anodyne	TPP2	63	36
C[C@H](Nc1cnc(C(=O)OC(C)(C)C)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854529	GF	On-Demand	Anodyne	TPP2	63	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cnc(C(=O)OC(C)(C)C)cn1	ZINC000450854530	GF	On-Demand	Anodyne	TPP2	63	36
C[C@@H](Nc1cnc(C(=O)OC(C)(C)C)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854531	GF	On-Demand	Anodyne	TPP2	63	36
C[C@H](Nc1nccc(CO)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854532	DD	On-Demand	Anodyne	TPP2	71	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nccc(CO)n1	ZINC000450854533	DD	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1nccc(CO)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854534	DD	On-Demand	Anodyne	TPP2	71	41
C[C@@H](Nc1nccc(CO)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854535	DD	On-Demand	Anodyne	TPP2	71	41
COCCC(C)(C)CNC(=O)c1c(C)cccc1Cl	ZINC000450854542	CG	On-Demand	Anodyne	ECR	50	40
COCCC(C)(C)CNC(=O)c1c(C)cccc1Cl	ZINC000450854542	CG	On-Demand	Anodyne	E3UJZ5_SPOLI	47	40
C[C@@H](Nc1ncc([N+](=O)[O-])s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854564	EF	On-Demand	Bother	TPP2	62	35
C[C@H](Nc1ncc([N+](=O)[O-])s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854566	EF	On-Demand	Bother	TPP2	62	35
Cn1cc(-c2ccc(C(=O)NC[C@@H]3CCO[C@H]3c3ccc(F)cc3)o2)cn1	ZINC000450854567	FG	On-Demand	Anodyne	MMP13	0	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc([N+](=O)[O-])s1	ZINC000450854568	EF	On-Demand	Bother	TPP2	62	35
C[C@H](Nc1ncc([N+](=O)[O-])s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854569	EF	On-Demand	Bother	TPP2	62	35
C[C@@H](Nc1ncnc2[nH]cnc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854594	DE	On-Demand	Anodyne	TPP2	36	40
C[C@H](Nc1ncnc2[nH]cnc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854595	DE	On-Demand	Anodyne	TPP2	36	40
C[C@H](Nc1ncnc2[nH]cnc12)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854596	DE	On-Demand	Anodyne	TPP2	36	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncnc2[nH]cnc12	ZINC000450854597	DE	On-Demand	Anodyne	TPP2	36	40
CC[C@H](O)[C@@H](CC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450854617	CG	On-Demand	Anodyne	FLT1	0	42
CC[C@H](O)[C@@H](CC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450854617	CG	On-Demand	Anodyne	PDGFRA	45	36
CC[C@@H](O)[C@@H](CC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450854618	CG	On-Demand	Anodyne	FLT1	0	42
CC[C@@H](O)[C@@H](CC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450854618	CG	On-Demand	Anodyne	PDGFRA	45	36
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450854619	CG	On-Demand	Anodyne	FLT1	0	42
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450854619	CG	On-Demand	Anodyne	PDGFRA	45	36
CC[C@H](O)[C@H](CC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450854620	CG	On-Demand	Anodyne	FLT1	0	42
CC[C@H](O)[C@H](CC)Nc1ccnc2cc(F)c(OC)cc12	ZINC000450854620	CG	On-Demand	Anodyne	PDGFRA	45	36
Cc1cnc(C2CCN(CCN(C)Cc3ccccc3)CC2)s1	ZINC000450854662	EH	On-Demand	Anodyne	SIGMAR1	29	42
CC[C@@H](C)N1CCN(c2nccc(CO)n2)CC1	ZINC000450854672	CC	On-Demand	Anodyne	SORD	85	47
CC[C@H](C)N1CCN(c2nccc(CO)n2)CC1	ZINC000450854675	CC	On-Demand	Anodyne	SORD	85	47
Cc1cnc(C2CCN(Cc3ccccc3OC3CC3)CC2)s1	ZINC000450854688	EI	On-Demand	Anodyne	SCN5A	65	34
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H]2c2cccc(OC)c2)n1	ZINC000450854731	EF	On-Demand	Bother	CACNA1D	46	35
O=C(CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)NCC1(c2ccccc2)CCOCC1	ZINC000450854736	GF	On-Demand	Anodyne	KCNA3	40	35
O=C(CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)NCC1(c2ccccc2)CCOCC1	ZINC000450854736	GF	On-Demand	Anodyne	ACAT	0	40
O=C(CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)NCC1(c2ccccc2)CCOCC1	ZINC000450854737	GF	On-Demand	Anodyne	KCNA3	40	35
O=C(CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)NCC1(c2ccccc2)CCOCC1	ZINC000450854737	GF	On-Demand	Anodyne	ACAT	0	40
O=C(CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)NCC1(c2ccccc2)CCOCC1	ZINC000450854738	GF	On-Demand	Anodyne	KCNA3	40	35
O=C(CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)NCC1(c2ccccc2)CCOCC1	ZINC000450854738	GF	On-Demand	Anodyne	ACAT	0	40
O=C(CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)NCC1(c2ccccc2)CCOCC1	ZINC000450854739	GF	On-Demand	Anodyne	KCNA3	40	35
O=C(CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)NCC1(c2ccccc2)CCOCC1	ZINC000450854739	GF	On-Demand	Anodyne	ACAT	0	40
COC(=O)c1csc(CN2CCc3cccc(C)c3C2)n1	ZINC000450854806	DF	On-Demand	Anodyne	NOD1	29	40
COC(=O)c1csc(CN2CCc3cccc(C)c3C2)n1	ZINC000450854806	DF	On-Demand	Anodyne	NOD2	44	40
COC(=O)c1csc(CN2CCc3cccc(C)c3C2)n1	ZINC000450854806	DF	On-Demand	Anodyne	TRPC6	32	40
CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450854829	DC	On-Demand	Anodyne	HPGDS	16	43
CCOC(=O)[C@](C)(O)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450854830	DC	On-Demand	Anodyne	HPGDS	16	43
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)C2)c1	ZINC000450854832	GI	On-Demand	Bother	TAAR1	22	42
COc1cccc([C@@H]2C[C@@H](Nc3ccc(C(=O)NCCO)nn3)C2)c1	ZINC000450854841	EC	On-Demand	Anodyne	DRD4	43	32
COc1cccc([C@@H]2C[C@@H](Nc3ncc([N+](=O)[O-])c(C)n3)C2)c1	ZINC000450854843	DG	On-Demand	Bother	PRKCQ	22	45
COc1ccccc1-c1noc(C2CCN(C[C@](C)(O)C(C)=O)CC2)n1	ZINC000450854880	FE	On-Demand	Anodyne	LUCI_PHOPE	22	40
COc1ccccc1-c1noc(C2CCN(C[C@](C)(O)C(C)=O)CC2)n1	ZINC000450854880	FE	On-Demand	Anodyne	SMO	59	47
COc1ccccc1-c1noc(C2CCN(C[C@](C)(O)C(C)=O)CC2)n1	ZINC000450854880	FE	On-Demand	Anodyne	ETHR	68	43
COc1ccccc1-c1noc(C2CCN(C[C@@](C)(O)C(C)=O)CC2)n1	ZINC000450854881	FE	On-Demand	Anodyne	LUCI_PHOPE	22	40
COc1ccccc1-c1noc(C2CCN(C[C@@](C)(O)C(C)=O)CC2)n1	ZINC000450854881	FE	On-Demand	Anodyne	SMO	59	47
COc1ccccc1-c1noc(C2CCN(C[C@@](C)(O)C(C)=O)CC2)n1	ZINC000450854881	FE	On-Demand	Anodyne	ETHR	68	43
COc1ccc(CC(=O)Nc2cncnc2N(C)C)c(Cl)c1OC	ZINC000450854902	FE	On-Demand	Anodyne	PDE6A	42	34
CC(=O)c1cccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)c1	ZINC000450854904	FH	On-Demand	Mild	HTR1A	25	53
CC(=O)c1cccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)c1	ZINC000450854904	FH	On-Demand	Mild	DRD2	35	53
CC(=O)c1cccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)c1	ZINC000450854904	FH	On-Demand	Mild	DRD1	0	44
CC(=O)c1cccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)c1	ZINC000450854904	FH	On-Demand	Mild	DRD4	52	44
CC(=O)c1cccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)c1	ZINC000450854904	FH	On-Demand	Mild	CXCR3	29	40
CCS(=O)(=O)c1ccc(CN(C)Cc2ccc(F)c(C)c2)cc1	ZINC000450854905	EH	On-Demand	Anodyne	LEF	62	37
CC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450854906	FH	On-Demand	Bother	TPP2	55	35
CC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450854907	FH	On-Demand	Bother	TPP2	55	35
CC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450854908	FH	On-Demand	Bother	TPP2	55	35
CC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450854909	FH	On-Demand	Bother	TPP2	55	35
CC[C@H](O)[C@H](CC)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450854910	EE	On-Demand	Anodyne	LRRK2	28	42
CC[C@H](O)[C@@H](CC)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450854911	EE	On-Demand	Anodyne	LRRK2	28	42
CC[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)[C@H](O)CC	ZINC000450854912	EE	On-Demand	Anodyne	LRRK2	28	42
CC[C@@H](O)[C@@H](CC)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450854913	EE	On-Demand	Anodyne	LRRK2	28	42
CC[C@@H](O)[C@@H](CC)Nc1cc(COC)nc2ncnn12	ZINC000450854923	CD	On-Demand	Anodyne	DHOD	0	42
CC[C@H](O)[C@@H](CC)Nc1cc(COC)nc2ncnn12	ZINC000450854924	CD	On-Demand	Anodyne	DHOD	0	42
CC[C@H](O)[C@H](CC)Nc1cc(COC)nc2ncnn12	ZINC000450854925	CD	On-Demand	Anodyne	DHOD	0	42
CC[C@H](Nc1cc(COC)nc2ncnn12)[C@H](O)CC	ZINC000450854926	CD	On-Demand	Anodyne	DHOD	0	42
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncnc2nc(N)ccc12	ZINC000450854937	EE	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1ncnc2nc(N)ccc12)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854938	EE	On-Demand	Anodyne	TPP2	71	41
C[C@@H](Nc1ncnc2nc(N)ccc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854939	EE	On-Demand	Anodyne	TPP2	71	41
CCS(=O)(=O)c1ccc(CSCc2cccc(OC(F)F)c2)cc1	ZINC000450854944	FJ	On-Demand	Anodyne	RORC	35	42
CC(=O)c1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450854945	FH	On-Demand	Bother	TPP2	52	33
CC(=O)c1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450854946	FH	On-Demand	Bother	TPP2	52	33
CC(=O)c1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450854947	FH	On-Demand	Bother	TPP2	52	33
CC(=O)c1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450854948	FH	On-Demand	Bother	TPP2	52	33
C[C@@](CO)(NC(=O)Cc1ccc(O)c(F)c1)C1CCCCC1	ZINC000450854950	DF	On-Demand	Anodyne	CAN2	0	42
C[C@](CO)(NC(=O)Cc1ccc(O)c(F)c1)C1CCCCC1	ZINC000450854951	DF	On-Demand	Anodyne	CAN2	0	42
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854956	FG	On-Demand	Bother	DRD4	21	43
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854956	FG	On-Demand	Bother	TPP2	61	33
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854957	FG	On-Demand	Bother	DRD4	21	43
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854957	FG	On-Demand	Bother	TPP2	61	33
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854958	FG	On-Demand	Bother	DRD4	21	43
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854958	FG	On-Demand	Bother	TPP2	61	33
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc([N+](=O)[O-])cc1Cl	ZINC000450854959	FG	On-Demand	Bother	DRD4	21	43
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc([N+](=O)[O-])cc1Cl	ZINC000450854959	FG	On-Demand	Bother	TPP2	61	33
CC[C@@H](O)CC(=O)Nc1ccccc1CSC	ZINC000450854968	CF	On-Demand	Anodyne	KCNQ2	54	34
CC[C@H](O)CC(=O)Nc1ccccc1CSC	ZINC000450854969	CF	On-Demand	Anodyne	KCNQ2	54	34
C[C@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854975	DH	On-Demand	Anodyne	ACE	17	40
C[C@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854975	DH	On-Demand	Anodyne	DRD4	24	44
C[C@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854975	DH	On-Demand	Anodyne	TPP2	66	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncccc1Cl	ZINC000450854976	DH	On-Demand	Anodyne	DRD4	24	44
C[C@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854977	DH	On-Demand	Anodyne	ACE	17	40
C[C@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854977	DH	On-Demand	Anodyne	DRD4	24	44
C[C@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450854977	DH	On-Demand	Anodyne	TPP2	66	37
C[C@@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854978	DH	On-Demand	Anodyne	ACE	17	40
C[C@@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854978	DH	On-Demand	Anodyne	DRD4	24	44
C[C@@H](Nc1ncccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450854978	DH	On-Demand	Anodyne	TPP2	66	37
CC[C@@H](O)[C@@H](CC)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450854980	DE	On-Demand	Anodyne	DHOD	0	51
CC[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)[C@H](O)CC	ZINC000450854981	DE	On-Demand	Anodyne	DHOD	0	51
CC[C@H](O)[C@@H](CC)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450854982	DE	On-Demand	Anodyne	DHOD	0	51
CC[C@H](O)[C@H](CC)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450854983	DE	On-Demand	Anodyne	DHOD	0	51
Cc1cc(C#N)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450854986	DG	On-Demand	Mild	TPP2	60	38
Cc1cc(C#N)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450854987	DG	On-Demand	Mild	TPP2	60	38
Cc1cc(C#N)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450854988	DG	On-Demand	Mild	TPP2	60	38
Cc1cc(C#N)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450854989	DG	On-Demand	Mild	TPP2	60	38
CCNC(=O)c1ccc(N2CCN([C@H](C)CC)CC2)nc1	ZINC000450854995	CD	On-Demand	Anodyne	PRNP	46	44
CCNC(=O)c1ccc(N2CCN([C@@H](C)CC)CC2)nc1	ZINC000450854996	CD	On-Demand	Anodyne	PRNP	46	44
CC[C@@H](C)N1CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450855073	DF	On-Demand	Anodyne	PDE3A	55	43
CC[C@@H](C)N1CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450855073	DF	On-Demand	Anodyne	PDGFRB	83	47
CC[C@@H](C)N1CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450855073	DF	On-Demand	Anodyne	PDE3B	81	43
CC[C@@H](C)N1CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450855073	DF	On-Demand	Anodyne	HTT	0	45
CC[C@H](C)N1CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450855074	DF	On-Demand	Anodyne	PDE3A	55	43
CC[C@H](C)N1CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450855074	DF	On-Demand	Anodyne	PDGFRB	83	47
CC[C@H](C)N1CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450855074	DF	On-Demand	Anodyne	PDE3B	81	43
CC[C@H](C)N1CCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450855074	DF	On-Demand	Anodyne	HTT	0	45
Cc1nccc(N2CCN(C(=O)c3c(Cl)cc(Cl)cc3Cl)CC2)n1	ZINC000450855081	GH	On-Demand	Anodyne	SORD	75	42
CC[C@H](C)N1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CC1	ZINC000450855088	FF	On-Demand	Anodyne	MRGPRX1	35	43
CC[C@H](C)N1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CC1	ZINC000450855088	FF	On-Demand	Anodyne	NPBWR1	48	41
CC[C@@H](C)N1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CC1	ZINC000450855089	FF	On-Demand	Anodyne	MRGPRX1	35	43
CC[C@@H](C)N1CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CC1	ZINC000450855089	FF	On-Demand	Anodyne	NPBWR1	48	41
CN(CC/C=C/c1ccccc1)CCCNC(=O)C1CCC1	ZINC000450855095	DG	On-Demand	Anodyne	TBK1	48	35
CN(CC/C=C\c1ccccc1)CCCNC(=O)C1CCC1	ZINC000450855096	DG	On-Demand	Anodyne	TBK1	48	35
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@](=O)C1	ZINC000450855100	DE	On-Demand	Anodyne	DRD2	32	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@](=O)C1	ZINC000450855100	DE	On-Demand	Anodyne	HTR2A	25	53
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@](=O)C1	ZINC000450855100	DE	On-Demand	Anodyne	HTR2C	22	53
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@](=O)C1	ZINC000450855100	DE	On-Demand	Anodyne	CYP2J2	53	38
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@@](=O)C1	ZINC000450855101	DE	On-Demand	Anodyne	DRD2	32	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@@](=O)C1	ZINC000450855101	DE	On-Demand	Anodyne	HTR2A	25	53
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@@](=O)C1	ZINC000450855101	DE	On-Demand	Anodyne	HTR2C	22	53
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@@](=O)C1	ZINC000450855101	DE	On-Demand	Anodyne	CYP2J2	53	38
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@@](=O)C1	ZINC000450855102	DE	On-Demand	Anodyne	DRD2	32	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@@](=O)C1	ZINC000450855102	DE	On-Demand	Anodyne	HTR2A	25	53
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@@](=O)C1	ZINC000450855102	DE	On-Demand	Anodyne	HTR2C	22	53
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@@](=O)C1	ZINC000450855102	DE	On-Demand	Anodyne	CYP2J2	53	38
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@](=O)C1	ZINC000450855103	DE	On-Demand	Anodyne	DRD2	32	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@](=O)C1	ZINC000450855103	DE	On-Demand	Anodyne	HTR2A	25	53
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@](=O)C1	ZINC000450855103	DE	On-Demand	Anodyne	HTR2C	22	53
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC[S@](=O)C1	ZINC000450855103	DE	On-Demand	Anodyne	CYP2J2	53	38
CN(C)[C@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450855109	CG	On-Demand	Anodyne	ADRA1B	0	40
CN(C)[C@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450855109	CG	On-Demand	Anodyne	HRH3	25	40
CN(C)[C@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450855109	CG	On-Demand	Anodyne	NPY1R	32	46
CN(C)[C@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450855109	CG	On-Demand	Anodyne	CACNA1D	31	40
CN(C)[C@@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450855110	CG	On-Demand	Anodyne	ADRA1B	0	40
CN(C)[C@@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450855110	CG	On-Demand	Anodyne	HRH3	25	40
CN(C)[C@@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450855110	CG	On-Demand	Anodyne	NPY1R	32	46
CN(C)[C@@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450855110	CG	On-Demand	Anodyne	CACNA1D	31	40
CC1(C)C[C@H](O)CCN(c2nc(-c3ccccc3Cl)cs2)C1	ZINC000450855144	EI	On-Demand	Anodyne	SPHK2	23	42
CC1(C)C[C@H](O)CCN(c2nc(-c3ccccc3Cl)cs2)C1	ZINC000450855144	EI	On-Demand	Anodyne	SPHK1	22	42
CC1(C)C[C@@H](O)CCN(c2nc(-c3ccccc3Cl)cs2)C1	ZINC000450855145	EI	On-Demand	Anodyne	SPHK2	23	42
CC1(C)C[C@@H](O)CCN(c2nc(-c3ccccc3Cl)cs2)C1	ZINC000450855145	EI	On-Demand	Anodyne	SPHK1	22	42
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	HTR1A	15	43
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	DRD2	35	45
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	DRD1	0	43
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	DRD4	58	42
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	ACHE	35	42
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	DRD3	25	40
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	SIGMAR1	41	43
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	SSTR5	63	36
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	CCR3	29	41
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	MCHR1	32	44
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	LUCI_PHOPE	22	40
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	SMO	59	47
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	MBTPS1	41	33
COc1ccccc1-c1noc(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)n1	ZINC000450855149	GI	On-Demand	Anodyne	ETHR	61	41
COc1cc(OC)c2ncnc(N3CC[C@@H](O)CC(C)(C)C3)c2c1	ZINC000450855167	EF	On-Demand	Anodyne	PDE3A	49	39
COc1cc(OC)c2ncnc(N3CC[C@H](O)CC(C)(C)C3)c2c1	ZINC000450855168	EF	On-Demand	Anodyne	PDE3A	49	39
COC(=O)c1csc(CN2CCC(c3ccncc3)CC2)n1	ZINC000450855175	DF	On-Demand	Anodyne	MGEA5	26	42
COC(=O)c1csc(CN2CCC(c3ccncc3)CC2)n1	ZINC000450855175	DF	On-Demand	Anodyne	TRPC6	45	34
C[C@@H](O)CCN1CCC(c2ncccc2Cl)CC1	ZINC000450855183	CF	On-Demand	Anodyne	OPRL1	0	43
C[C@H](O)CCN1CCC(c2ncccc2Cl)CC1	ZINC000450855184	CF	On-Demand	Anodyne	OPRL1	0	43
CC(C)c1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncn1	ZINC000450855205	DG	On-Demand	Anodyne	TPP2	69	39
CC(C)c1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncn1	ZINC000450855206	DG	On-Demand	Anodyne	TPP2	69	39
CC(C)c1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncn1	ZINC000450855207	DG	On-Demand	Anodyne	TPP2	69	39
CC(C)c1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncn1	ZINC000450855208	DG	On-Demand	Anodyne	TPP2	69	39
C[C@H](N=c1ccc(Cl)c(C#N)[nH]1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855211	EF	On-Demand	Mild	DRD4	26	42
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1ccc(Cl)c(C#N)[nH]1	ZINC000450855212	EF	On-Demand	Mild	DRD4	26	42
C[C@H](N=c1ccc(Cl)c(C#N)[nH]1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450855213	EF	On-Demand	Mild	DRD4	26	42
C[C@@H](N=c1ccc(Cl)c(C#N)[nH]1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855214	EF	On-Demand	Mild	DRD4	26	42
C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855219	FE	On-Demand	Bother	TPP2	55	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000450855220	FE	On-Demand	Bother	TPP2	55	35
C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450855221	FE	On-Demand	Bother	TPP2	55	35
C[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855222	FE	On-Demand	Bother	TPP2	55	35
COc1ccccc1C1(CNC(=O)[C@@]2(C)CC=CCC2)CCC1	ZINC000450855230	DH	On-Demand	Anodyne	KCNA3	47	39
COc1ccccc1C1(CNC(=O)[C@@]2(C)CC=CCC2)CCC1	ZINC000450855230	DH	On-Demand	Anodyne	MTNR1A	17	40
COc1ccccc1C1(CNC(=O)[C@]2(C)CC=CCC2)CCC1	ZINC000450855231	DH	On-Demand	Anodyne	KCNA3	40	39
COc1ccccc1C1(CNC(=O)[C@]2(C)CC=CCC2)CCC1	ZINC000450855231	DH	On-Demand	Anodyne	MTNR1A	17	40
C[C@H](Nc1c(C#N)c(=O)n(C)c(=O)n1C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855232	FC	On-Demand	Mild	TPP2	54	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1c(C#N)c(=O)n(C)c(=O)n1C	ZINC000450855236	FC	On-Demand	Mild	TPP2	54	35
C[C@H](Nc1c(C#N)c(=O)n(C)c(=O)n1C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450855238	FC	On-Demand	Mild	TPP2	54	35
C[C@@H](Nc1c(C#N)c(=O)n(C)c(=O)n1C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855240	FC	On-Demand	Mild	TPP2	54	35
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450855243	GF	On-Demand	Bother	BCL2L1	54	31
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450855243	GF	On-Demand	Bother	BCL2	48	31
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450855244	GF	On-Demand	Bother	BCL2L1	54	31
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450855244	GF	On-Demand	Bother	BCL2	48	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450855246	GF	On-Demand	Bother	BCL2L1	54	31
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450855246	GF	On-Demand	Bother	BCL2	48	31
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450855247	GF	On-Demand	Bother	BCL2L1	54	31
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450855247	GF	On-Demand	Bother	BCL2	48	31
COC(=O)c1ccccc1OCCN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000450855262	EF	On-Demand	Anodyne	HCN4	49	32
COC(=O)c1ccccc1OCCN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000450855265	EF	On-Demand	Anodyne	HCN4	49	32
COC(=O)c1ccccc1OCCN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000450855267	EF	On-Demand	Anodyne	HCN4	49	32
COC(=O)c1ccccc1OCCN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000450855269	EF	On-Demand	Anodyne	HCN4	49	32
Cc1ccc(C(C)(C)NC(=O)Cc2ccc(O)c(F)c2)cn1	ZINC000450855286	DF	On-Demand	Anodyne	CAN2	0	43
CCCc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n2ncnc2n1	ZINC000450855293	FF	On-Demand	Anodyne	TPP2	35	40
CCCc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n2ncnc2n1	ZINC000450855295	FF	On-Demand	Anodyne	TPP2	35	40
CCCc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n2ncnc2n1	ZINC000450855296	FF	On-Demand	Anodyne	TPP2	35	40
CCCc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n2ncnc2n1	ZINC000450855298	FF	On-Demand	Anodyne	TPP2	35	40
CC[C@H](O)[C@H](CC)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450855299	CG	On-Demand	Anodyne	UTS2R	29	44
CC[C@@H](O)[C@@H](CC)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450855305	CG	On-Demand	Anodyne	UTS2R	29	44
CC[C@H](Nc1ncnc2[nH]c3ccccc3c12)[C@H](O)CC	ZINC000450855306	CG	On-Demand	Anodyne	UTS2R	29	44
CC[C@H](O)[C@@H](CC)Nc1ncnc2[nH]c3ccccc3c12	ZINC000450855307	CG	On-Demand	Anodyne	UTS2R	29	44
COc1ccccc1C1(CNC(=O)C2(Cc3ccccc3)CCOCC2)CCC1	ZINC000450855322	GI	On-Demand	Anodyne	KCNA3	47	43
COc1ccccc1C1(CNC(=O)C2(Cc3ccccc3)CCOCC2)CCC1	ZINC000450855322	GI	On-Demand	Anodyne	ACAT	0	51
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc(N(C)C)n1	ZINC000450855337	ED	On-Demand	Anodyne	TPP2	60	38
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc(N(C)C)n1	ZINC000450855338	ED	On-Demand	Anodyne	TPP2	60	38
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc(N(C)C)n1	ZINC000450855339	ED	On-Demand	Anodyne	TPP2	60	38
COc1cccc([C@@H]2C[C@H]2Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)c1	ZINC000450855369	GH	On-Demand	Bother	TAAR1	22	42
CC[C@H](C)N1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1	ZINC000450855449	GC	On-Demand	Anodyne	GCK	25	44
CC[C@@H](C)N1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1	ZINC000450855450	GC	On-Demand	Anodyne	GCK	25	44
CCc1cc(N2CCN([C@@H](C)CC)CC2)nc(-c2ccncc2)n1	ZINC000450855470	EG	On-Demand	Anodyne	SORD	33	40
CCc1cc(N2CCN([C@H](C)CC)CC2)nc(-c2ccncc2)n1	ZINC000450855471	EG	On-Demand	Anodyne	SORD	33	40
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450855488	GJ	On-Demand	Anodyne	CCR2	57	36
CN(Cc1cn(CC2CC2)nn1)Cc1cc(Cl)ccc1F	ZINC000450855489	DG	On-Demand	Anodyne	NOS3	18	41
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H](c2cccc(OC)c2)C1	ZINC000450855500	FG	On-Demand	Bother	CACNA1C	47	35
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H](c2cccc(OC)c2)C1	ZINC000450855500	FG	On-Demand	Bother	CACNA1D	80	35
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H](c2cccc(OC)c2)C1	ZINC000450855500	FG	On-Demand	Bother	KCNMA1	19	42
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H](c2cccc(OC)c2)C1	ZINC000450855500	FG	On-Demand	Bother	AKR1C2	15	40
CN(Cc1ccc(F)c(Cl)c1)CC1CCC(=O)CC1	ZINC000450855509	CH	On-Demand	Anodyne	SLC6A9	0	41
COc1cc(CC(=O)N[C@H]2CCCO[C@@H]2c2ccncc2)ccc1Cl	ZINC000450855515	FG	On-Demand	Anodyne	OPRK1	32	40
COc1cc(CC(=O)N[C@H]2CCCO[C@@H]2c2ccncc2)ccc1Cl	ZINC000450855515	FG	On-Demand	Anodyne	SSTR3	20	45
CN(CCCNC(=O)C1CCC1)CCCC(=O)c1ccccc1	ZINC000450855526	DF	On-Demand	Anodyne	CYP2J2	45	32
CN(CCCNC(=O)C1CCC1)CCCC(=O)c1ccccc1	ZINC000450855526	DF	On-Demand	Anodyne	TBK1	67	35
COC(=O)c1cc(C)nc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)c1[N+](=O)[O-]	ZINC000450855527	FG	On-Demand	Bother	CACNA1D	63	36
COc1ccc(CNC(=O)CCN[C@H]2Cc3cccc(O)c3C2)c(OC)c1	ZINC000450855548	FE	On-Demand	Anodyne	MTNR1A	90	39
COc1ccc(CNC(=O)CCN[C@H]2Cc3cccc(O)c3C2)c(OC)c1	ZINC000450855548	FE	On-Demand	Anodyne	MTNR1B	82	39
COc1ccc(CNC(=O)CCN[C@@H]2Cc3cccc(O)c3C2)c(OC)c1	ZINC000450855549	FE	On-Demand	Anodyne	MTNR1A	90	39
COc1ccc(CNC(=O)CCN[C@@H]2Cc3cccc(O)c3C2)c(OC)c1	ZINC000450855549	FE	On-Demand	Anodyne	MTNR1B	82	39
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc(N(C)C)n1	ZINC000450855590	ED	On-Demand	Anodyne	TPP2	60	38
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1C#N	ZINC000450855591	DG	On-Demand	Mild	TPP2	55	35
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1C#N	ZINC000450855592	DG	On-Demand	Mild	TPP2	55	35
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1C#N	ZINC000450855593	DG	On-Demand	Mild	TPP2	55	35
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1C#N	ZINC000450855594	DG	On-Demand	Mild	TPP2	55	35
C[C@@H](Nc1ccccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855601	CF	On-Demand	Anodyne	ACE	19	43
C[C@@H](Nc1ccccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855601	CF	On-Demand	Anodyne	TPP2	69	39
C[C@H](Nc1ccccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855602	CF	On-Demand	Anodyne	ACE	19	43
C[C@H](Nc1ccccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855602	CF	On-Demand	Anodyne	TPP2	69	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccccn1	ZINC000450855603	CF	On-Demand	Anodyne	ACE	19	43
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccccn1	ZINC000450855603	CF	On-Demand	Anodyne	TPP2	69	39
C[C@H](Nc1ccccn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450855604	CF	On-Demand	Anodyne	ACE	19	43
C[C@H](Nc1ccccn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450855604	CF	On-Demand	Anodyne	TPP2	69	39
Cc1nnc2c(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)nccn12	ZINC000450855610	ED	On-Demand	Anodyne	TPP2	55	34
Cc1nnc2c(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nccn12	ZINC000450855611	ED	On-Demand	Anodyne	TPP2	55	34
Cc1nnc2c(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nccn12	ZINC000450855612	ED	On-Demand	Anodyne	TPP2	55	34
Cc1nnc2c(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)nccn12	ZINC000450855613	ED	On-Demand	Anodyne	TPP2	55	34
COC(=O)c1ccc(C(=O)Cn2nnnc2CCCc2ccccc2)o1	ZINC000450855614	FE	On-Demand	Anodyne	FAAH	68	47
COC(=O)c1ccc(C(=O)Cn2nnnc2CCCc2ccccc2)o1	ZINC000450855614	FE	On-Demand	Anodyne	CES1	57	44
Cc1nccc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]1	ZINC000450855626	CD	On-Demand	Anodyne	TPP2	66	39
Cc1nccc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]1	ZINC000450855627	CD	On-Demand	Anodyne	TPP2	66	39
Cc1nccc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]1	ZINC000450855628	CD	On-Demand	Anodyne	TPP2	66	39
Cc1nccc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]1	ZINC000450855629	CD	On-Demand	Anodyne	TPP2	66	39
CC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450855642	DG	On-Demand	Anodyne	TPP2	67	39
CC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450855643	DG	On-Demand	Anodyne	TPP2	67	39
CC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450855644	DG	On-Demand	Anodyne	TPP2	67	39
CC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450855645	DG	On-Demand	Anodyne	TPP2	67	39
C[C@H](N=c1[nH]ccn2cnnc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855656	DD	On-Demand	Anodyne	TPP2	54	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1[nH]ccn2cnnc12	ZINC000450855657	DD	On-Demand	Anodyne	TPP2	54	36
C[C@H](N=c1[nH]ccn2cnnc12)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450855658	DD	On-Demand	Anodyne	TPP2	54	36
C[C@@H](N=c1[nH]ccn2cnnc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855659	DD	On-Demand	Anodyne	TPP2	54	36
C[C@H](Nc1ccc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855669	CF	On-Demand	Anodyne	DRD4	23	44
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(F)cn1	ZINC000450855670	CF	On-Demand	Anodyne	DRD4	23	44
C[C@H](Nc1ccc(F)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450855671	CF	On-Demand	Anodyne	DRD4	23	44
C[C@@H](Nc1ccc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450855672	CF	On-Demand	Anodyne	DRD4	23	44
CCS(=O)(=O)c1ccc(CN2CCc3cccc(C)c3C2)cc1	ZINC000450855695	EG	On-Demand	Anodyne	NOD1	30	41
CCS(=O)(=O)c1ccc(CN2CCc3cccc(C)c3C2)cc1	ZINC000450855695	EG	On-Demand	Anodyne	NOD2	47	41
C[C@@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855707	DF	On-Demand	Anodyne	DRD2	28	41
C[C@@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855707	DF	On-Demand	Anodyne	DRD4	0	44
C[C@@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855707	DF	On-Demand	Anodyne	SLC18A3	0	42
C[C@@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855707	DF	On-Demand	Anodyne	CYP2J2	51	36
C[C@@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855708	DF	On-Demand	Anodyne	DRD2	28	41
C[C@@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855708	DF	On-Demand	Anodyne	DRD4	0	44
C[C@@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855708	DF	On-Demand	Anodyne	SLC18A3	0	42
C[C@@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855708	DF	On-Demand	Anodyne	CYP2J2	51	36
C[C@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855709	DF	On-Demand	Anodyne	DRD2	28	41
C[C@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855709	DF	On-Demand	Anodyne	DRD4	0	44
C[C@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855709	DF	On-Demand	Anodyne	SLC18A3	0	42
C[C@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855709	DF	On-Demand	Anodyne	CYP2J2	51	36
C[C@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855710	DF	On-Demand	Anodyne	DRD2	28	41
C[C@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855710	DF	On-Demand	Anodyne	DRD4	0	44
C[C@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855710	DF	On-Demand	Anodyne	SLC18A3	0	42
C[C@H]1CC[S@](=O)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450855710	DF	On-Demand	Anodyne	CYP2J2	51	36
COc1ccc(CNC(=O)CCN2CCS(=O)(=O)CC[C@@H]2C)c(OC)c1	ZINC000450855714	GD	On-Demand	Anodyne	MTNR1A	49	37
COc1ccc(CNC(=O)CCN2CCS(=O)(=O)CC[C@H]2C)c(OC)c1	ZINC000450855715	GD	On-Demand	Anodyne	MTNR1A	49	37
COc1ccc(CNC(=O)CCS[C@H](C)C(C)C)c(OC)c1	ZINC000450855717	EG	On-Demand	Anodyne	MTNR1A	62	43
COc1ccc(CNC(=O)CCS[C@@H](C)C(C)C)c(OC)c1	ZINC000450855718	EG	On-Demand	Anodyne	MTNR1A	62	43
CC1(C)C[C@H](O)CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450855727	EH	On-Demand	Anodyne	RBP4	17	41
CC1(C)C[C@@H](O)CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450855729	EH	On-Demand	Anodyne	RBP4	17	41
CCOC(=O)c1ccnc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)c1[N+](=O)[O-]	ZINC000450855761	FH	On-Demand	Bother	CACNA1C	52	36
CC[C@@H](C)N1CCN(c2nc3ccccc3n2C)CC1	ZINC000450855775	CE	On-Demand	Anodyne	HRH1	29	47
CC[C@@H](C)N1CCN(c2nc3ccccc3n2C)CC1	ZINC000450855775	CE	On-Demand	Anodyne	GRM2	0	44
CC[C@H](C)N1CCN(c2nc3ccccc3n2C)CC1	ZINC000450855776	CE	On-Demand	Anodyne	HRH1	29	47
CC[C@H](C)N1CCN(c2nc3ccccc3n2C)CC1	ZINC000450855776	CE	On-Demand	Anodyne	GRM2	0	44
COc1ccc(CNC(=O)CCN2CC3(CCC3)C[C@@H]2C)c(OC)c1	ZINC000450855786	EF	On-Demand	Anodyne	MTNR1A	30	42
COc1ccc(CNC(=O)CCN2CC3(CCC3)C[C@@H]2C)c(OC)c1	ZINC000450855786	EF	On-Demand	Anodyne	MTNR1B	28	40
COc1ccc(CNC(=O)CCN2CC3(CCC3)C[C@H]2C)c(OC)c1	ZINC000450855788	EF	On-Demand	Anodyne	MTNR1A	30	42
COc1ccc(CNC(=O)CCN2CC3(CCC3)C[C@H]2C)c(OC)c1	ZINC000450855788	EF	On-Demand	Anodyne	MTNR1B	28	40
CCOC(=O)[C@H](CC)SCC[C@@H](C)O	ZINC000450855797	BD	On-Demand	Anodyne	METAP2	0	43
CCOC(=O)[C@@H](CC)SCC[C@H](C)O	ZINC000450855798	BD	On-Demand	Anodyne	METAP2	0	43
CCOC(=O)[C@H](CC)SCC[C@H](C)O	ZINC000450855799	BD	On-Demand	Anodyne	METAP2	0	43
CC1(C)COC[C@@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450855801	GG	On-Demand	Bother	BCL2L1	60	34
CC1(C)COC[C@@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450855801	GG	On-Demand	Bother	BCL2	49	35
CC1(C)COC[C@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450855802	GG	On-Demand	Bother	BCL2L1	60	34
CC1(C)COC[C@H]1Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450855802	GG	On-Demand	Bother	BCL2	49	35
CCOC(=O)[C@@H](CC)SCC[C@@H](C)O	ZINC000450855803	BD	On-Demand	Anodyne	METAP2	0	43
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450855812	EF	On-Demand	Bother	TAAR1	18	50
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450855813	EF	On-Demand	Bother	TAAR1	18	50
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450855814	EF	On-Demand	Bother	TAAR1	18	50
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450855815	EF	On-Demand	Bother	TAAR1	18	50
CC[C@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855827	FE	On-Demand	Anodyne	PIK3CA	25	49
CC[C@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855827	FE	On-Demand	Anodyne	PIK3CD	36	40
CC[C@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855827	FE	On-Demand	Anodyne	MTOR	16	40
CC[C@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855827	FE	On-Demand	Anodyne	PIK3CB	34	44
CC[C@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855827	FE	On-Demand	Anodyne	PIK3C2B	15	40
CC[C@@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855830	FE	On-Demand	Anodyne	PIK3CA	25	49
CC[C@@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855830	FE	On-Demand	Anodyne	PIK3CD	36	40
CC[C@@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855830	FE	On-Demand	Anodyne	MTOR	16	40
CC[C@@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855830	FE	On-Demand	Anodyne	PIK3CB	34	44
CC[C@@H](C)N1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000450855830	FE	On-Demand	Anodyne	PIK3C2B	15	40
COC(=O)c1coc(CN2CCC(c3nc(-c4ccccc4OC)no3)CC2)n1	ZINC000450855833	GF	On-Demand	Anodyne	PRCP	16	40
COC(=O)c1coc(CN2CCC(c3nc(-c4ccccc4OC)no3)CC2)n1	ZINC000450855833	GF	On-Demand	Anodyne	SMO	58	44
COC(=O)c1coc(CN2CCC(c3nc(-c4ccccc4OC)no3)CC2)n1	ZINC000450855833	GF	On-Demand	Anodyne	ETHR	54	38
COc1ccccc1-c1noc(C2CCN([C@H](C)c3csnn3)CC2)n1	ZINC000450855835	FH	On-Demand	Anodyne	SMO	46	44
COc1ccccc1-c1noc(C2CCN([C@H](C)c3csnn3)CC2)n1	ZINC000450855835	FH	On-Demand	Anodyne	ETHR	43	37
CC[C@@H](C)N1CCN(c2nccc(C(C)(C)C)n2)CC1	ZINC000450855836	CF	On-Demand	Anodyne	SORD	42	38
COc1ccccc1-c1noc(C2CCN([C@@H](C)c3csnn3)CC2)n1	ZINC000450855837	FH	On-Demand	Anodyne	SMO	46	44
COc1ccccc1-c1noc(C2CCN([C@@H](C)c3csnn3)CC2)n1	ZINC000450855837	FH	On-Demand	Anodyne	ETHR	43	37
CC[C@H](C)N1CCN(c2nccc(C(C)(C)C)n2)CC1	ZINC000450855840	CF	On-Demand	Anodyne	SORD	42	38
O[C@H]([C@H]1CCCN(CC/C=C/c2ccccc2)C1)C(F)(F)F	ZINC000450855866	DH	On-Demand	Anodyne	SLC6A1	112	40
O[C@H]([C@@H]1CCCN(CC/C=C/c2ccccc2)C1)C(F)(F)F	ZINC000450855867	DH	On-Demand	Anodyne	SLC6A1	112	40
O[C@H]([C@@H]1CCCN(CC/C=C\c2ccccc2)C1)C(F)(F)F	ZINC000450855868	DH	On-Demand	Anodyne	SLC6A1	112	40
O[C@H]([C@H]1CCCN(CC/C=C\c2ccccc2)C1)C(F)(F)F	ZINC000450855869	DH	On-Demand	Anodyne	SLC6A1	112	40
CN(Cc1cc(Cl)ccc1F)CC1CC(F)(F)C1	ZINC000450855893	CH	On-Demand	Anodyne	NOS2	16	40
CN(Cc1cc(Cl)ccc1F)CC1CC(F)(F)C1	ZINC000450855893	CH	On-Demand	Anodyne	NOS3	15	40
CC[C@H](C)N1CCN(c2cnc(-c3ccccc3)cn2)CC1	ZINC000450855895	CG	On-Demand	Anodyne	SORD	51	42
CC[C@@H](C)N1CCN(c2cnc(-c3ccccc3)cn2)CC1	ZINC000450855896	CG	On-Demand	Anodyne	SORD	51	42
CC[C@@H](C)N1CCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450855900	EF	On-Demand	Anodyne	PDGFRB	52	38
CC[C@@H](C)N1CCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450855900	EF	On-Demand	Anodyne	PDE3B	67	36
CC[C@H](C)N1CCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450855901	EF	On-Demand	Anodyne	PDGFRB	52	38
CC[C@H](C)N1CCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450855901	EF	On-Demand	Anodyne	PDE3B	67	36
COc1cccc([C@@H]2C[C@H]2Nc2ccc(C(=O)NCCO)nn2)c1	ZINC000450855935	EC	On-Demand	Anodyne	DRD4	43	32
COCCNC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)nc1	ZINC000450855937	EE	On-Demand	Anodyne	DRD4	47	36
COc1cccc([C@@H]2C[C@H]2Nc2ncccn2)c1	ZINC000450855986	BE	On-Demand	Anodyne	EBP	16	42
COc1cccc([C@@H]2C[C@H]2Nc2ncccn2)c1	ZINC000450855986	BE	On-Demand	Anodyne	KDM1A	18	42
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]c(C)n1	ZINC000450855994	DE	On-Demand	Anodyne	TPP2	67	39
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]c(C)n1	ZINC000450855995	DE	On-Demand	Anodyne	TPP2	67	39
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]c(C)n1	ZINC000450855996	DE	On-Demand	Anodyne	TPP2	67	39
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]c(C)n1	ZINC000450855997	DE	On-Demand	Anodyne	TPP2	67	39
C[C@@H](Nc1ccc([N+](=O)[O-])c(N)c1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856001	FG	On-Demand	Bother	TPP2	56	35
C[C@H](Nc1ccc([N+](=O)[O-])c(N)c1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856002	FG	On-Demand	Bother	TPP2	56	35
C[C@H](Nc1ccc([N+](=O)[O-])c(N)c1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450856003	FG	On-Demand	Bother	TPP2	56	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])c(N)c1F	ZINC000450856004	FG	On-Demand	Bother	TPP2	56	35
C[C@@H](Nc1ccc(C#N)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856017	FG	On-Demand	Mild	TPP2	51	32
C[C@H](Nc1ccc(C#N)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856018	FG	On-Demand	Mild	TPP2	51	32
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000450856019	FG	On-Demand	Mild	TPP2	51	32
C[C@H](Nc1ccc(C#N)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450856020	FG	On-Demand	Mild	TPP2	51	32
COCc1nc(C)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450856021	EE	On-Demand	Anodyne	DRD4	22	40
COCc1nc(C)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450856021	EE	On-Demand	Anodyne	TPP2	67	39
COCc1nc(C)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450856022	EE	On-Demand	Anodyne	DRD4	22	40
COCc1nc(C)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450856022	EE	On-Demand	Anodyne	TPP2	67	39
COCc1nc(C)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450856023	EE	On-Demand	Anodyne	DRD4	22	40
COCc1nc(C)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450856023	EE	On-Demand	Anodyne	TPP2	67	39
COCc1nc(C)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450856024	EE	On-Demand	Anodyne	DRD4	22	40
COCc1nc(C)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450856024	EE	On-Demand	Anodyne	TPP2	67	39
C[C@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856027	FD	On-Demand	Bother	TPP2	51	33
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000450856028	FD	On-Demand	Bother	TPP2	51	33
C[C@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450856029	FD	On-Demand	Bother	TPP2	51	33
C[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856030	FD	On-Demand	Bother	TPP2	51	33
CSCc1ccccc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450856042	DH	On-Demand	Anodyne	KCNQ2	60	34
O=C(Cn1nnnc1CCCc1ccccc1)NCCCN1CCCCCC1=O	ZINC000450856054	GD	On-Demand	Anodyne	TYRO3	23	44
COCc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n2ncnc2n1	ZINC000450856067	FE	On-Demand	Anodyne	TPP2	62	36
COCc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n2ncnc2n1	ZINC000450856068	FE	On-Demand	Anodyne	TPP2	62	36
COCc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n2ncnc2n1	ZINC000450856069	FE	On-Demand	Anodyne	TPP2	62	36
COCc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n2ncnc2n1	ZINC000450856070	FE	On-Demand	Anodyne	TPP2	62	36
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cncnc1N(C)C	ZINC000450856073	DG	On-Demand	Anodyne	ATF1	45	34
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cncnc1N(C)C	ZINC000450856073	DG	On-Demand	Anodyne	NFKB1	42	34
CCn1nccc1[C@@H]1OCC[C@H]1CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450856074	GG	On-Demand	Anodyne	PDE5A	15	42
Cc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n2ncnc2n1	ZINC000450856082	EE	On-Demand	Anodyne	DHOD	0	52
Cc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n2ncnc2n1	ZINC000450856083	EE	On-Demand	Anodyne	DHOD	0	52
Cc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n2ncnc2n1	ZINC000450856084	EE	On-Demand	Anodyne	DHOD	0	52
Cc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n2ncnc2n1	ZINC000450856085	EE	On-Demand	Anodyne	DHOD	0	52
Cc1cccc(Cl)c1C(=O)NCC1(CN(C)C)CCCC1	ZINC000450856086	DH	On-Demand	Anodyne	SLC6A9	20	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cnn(Cc2ccccc2)c(=O)c1	ZINC000450856088	GG	On-Demand	Anodyne	ACE	34	42
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cnn(Cc2ccccc2)c(=O)c1	ZINC000450856088	GG	On-Demand	Anodyne	DRD4	26	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cnn(Cc2ccccc2)c(=O)c1	ZINC000450856088	GG	On-Demand	Anodyne	TPP2	63	35
C[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856089	GG	On-Demand	Anodyne	ACE	34	42
C[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856089	GG	On-Demand	Anodyne	DRD4	26	41
C[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856089	GG	On-Demand	Anodyne	TPP2	63	35
CC(C)c1nccc(N2CC[C@@H](O)CC(C)(C)C2)n1	ZINC000450856124	CF	On-Demand	Anodyne	SORD	66	42
CC(C)c1nccc(N2CC[C@H](O)CC(C)(C)C2)n1	ZINC000450856125	CF	On-Demand	Anodyne	SORD	66	42
COc1cccc([C@@H]2C[C@@H](Nc3ncccn3)C2)c1	ZINC000450856141	CF	On-Demand	Anodyne	EBP	18	49
CN(CCCNC(=O)C1CCC1)Cc1ccccc1OC1CC1	ZINC000450856147	DF	On-Demand	Anodyne	ACHE	0	46
CN(CCCNC(=O)C1CCC1)Cc1ccccc1OC1CC1	ZINC000450856147	DF	On-Demand	Anodyne	MTNR1A	24	40
CN(CCCNC(=O)C1CCC1)Cc1ccccc1OC1CC1	ZINC000450856147	DF	On-Demand	Anodyne	TBK1	45	36
COc1cc(CN2CC[C@H](C)[S@](=O)CC2)ccc1Cl	ZINC000450856148	DF	On-Demand	Anodyne	DRD4	43	39
COc1cc(CN2CC[C@H](C)[S@](=O)CC2)ccc1Cl	ZINC000450856148	DF	On-Demand	Anodyne	SSTR5	73	42
COc1cc(CN2CC[C@H](C)[S@](=O)CC2)ccc1Cl	ZINC000450856148	DF	On-Demand	Anodyne	MCHR1	23	43
COc1cc(CN2CC[C@@H](C)[S@](=O)CC2)ccc1Cl	ZINC000450856149	DF	On-Demand	Anodyne	DRD4	43	39
COc1cc(CN2CC[C@@H](C)[S@](=O)CC2)ccc1Cl	ZINC000450856149	DF	On-Demand	Anodyne	SSTR5	73	42
COc1cc(CN2CC[C@@H](C)[S@](=O)CC2)ccc1Cl	ZINC000450856149	DF	On-Demand	Anodyne	MCHR1	23	43
COc1cc(CN2CC[C@H](C)[S@@](=O)CC2)ccc1Cl	ZINC000450856150	DF	On-Demand	Anodyne	DRD4	43	39
COc1cc(CN2CC[C@H](C)[S@@](=O)CC2)ccc1Cl	ZINC000450856150	DF	On-Demand	Anodyne	SSTR5	73	42
COc1cc(CN2CC[C@H](C)[S@@](=O)CC2)ccc1Cl	ZINC000450856150	DF	On-Demand	Anodyne	MCHR1	23	43
COc1cc(CN2CC[C@@H](C)[S@@](=O)CC2)ccc1Cl	ZINC000450856151	DF	On-Demand	Anodyne	DRD4	43	39
COc1cc(CN2CC[C@@H](C)[S@@](=O)CC2)ccc1Cl	ZINC000450856151	DF	On-Demand	Anodyne	SSTR5	73	42
COc1cc(CN2CC[C@@H](C)[S@@](=O)CC2)ccc1Cl	ZINC000450856151	DF	On-Demand	Anodyne	MCHR1	23	43
CCc1cc(N2CCN([C@H](C)CC)CC2)ccn1	ZINC000450856208	BF	On-Demand	Anodyne	SORD	35	42
CCc1cc(N2CCN([C@@H](C)CC)CC2)ccn1	ZINC000450856209	BF	On-Demand	Anodyne	SORD	35	42
CC[C@H](C)N1CCN(c2ncncc2-c2ccccc2)CC1	ZINC000450856217	CG	On-Demand	Anodyne	SLC9A1	0	49
CC[C@@H](C)N1CCN(c2ncncc2-c2ccccc2)CC1	ZINC000450856218	CG	On-Demand	Anodyne	SLC9A1	0	49
CO[C@H](C1CC1)[C@@H](C)Nc1ncnc2ccc(C)cc12	ZINC000450856267	CG	On-Demand	Anodyne	CD38	41	37
CO[C@@H](C1CC1)[C@@H](C)Nc1ncnc2ccc(C)cc12	ZINC000450856268	CG	On-Demand	Anodyne	CD38	41	37
CO[C@H](C1CC1)[C@H](C)Nc1ncnc2ccc(C)cc12	ZINC000450856269	CG	On-Demand	Anodyne	CD38	41	37
CO[C@@H](C1CC1)[C@H](C)Nc1ncnc2ccc(C)cc12	ZINC000450856270	CG	On-Demand	Anodyne	CD38	41	37
CC[C@H](C)N1CCN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450856278	FE	On-Demand	Anodyne	GCK	18	43
CC[C@@H](C)N1CCN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450856279	FE	On-Demand	Anodyne	GCK	18	43
C[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450856290	GG	On-Demand	Anodyne	ACE	34	42
C[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450856290	GG	On-Demand	Anodyne	DRD4	26	41
C[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450856290	GG	On-Demand	Anodyne	TPP2	63	35
C[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856291	GG	On-Demand	Anodyne	ACE	34	42
C[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856291	GG	On-Demand	Anodyne	DRD4	26	41
C[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856291	GG	On-Demand	Anodyne	TPP2	63	35
COC(=O)c1coc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)n1	ZINC000450856314	FE	On-Demand	Mild	DRD1	15	40
COC(=O)c1coc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)n1	ZINC000450856314	FE	On-Demand	Mild	DRD4	22	40
Cc1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450856316	DG	On-Demand	Anodyne	TPP2	67	37
Cc1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450856317	DG	On-Demand	Anodyne	TPP2	67	37
Cc1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450856318	DG	On-Demand	Anodyne	TPP2	67	37
Cc1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450856319	DG	On-Demand	Anodyne	TPP2	67	37
C[C@H](OCCc1ccccc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450856347	EG	On-Demand	Anodyne	ACE	35	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450856347	EG	On-Demand	Anodyne	AMY2	58	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450856347	EG	On-Demand	Anodyne	REN	46	36
C[C@H](OCCc1ccccc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450856347	EG	On-Demand	Anodyne	BIRC2	43	36
C[C@H](OCCc1ccccc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450856348	EG	On-Demand	Anodyne	ACE	35	40
C[C@H](OCCc1ccccc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450856348	EG	On-Demand	Anodyne	AMY2	58	40
C[C@H](OCCc1ccccc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450856348	EG	On-Demand	Anodyne	REN	46	36
C[C@H](OCCc1ccccc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450856348	EG	On-Demand	Anodyne	BIRC2	43	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450856349	EG	On-Demand	Anodyne	ACE	35	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450856349	EG	On-Demand	Anodyne	AMY2	58	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450856349	EG	On-Demand	Anodyne	REN	46	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450856349	EG	On-Demand	Anodyne	BIRC2	43	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450856350	EG	On-Demand	Anodyne	ACE	35	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450856350	EG	On-Demand	Anodyne	AMY2	58	40
C[C@@H](OCCc1ccccc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450856350	EG	On-Demand	Anodyne	REN	46	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450856350	EG	On-Demand	Anodyne	BIRC2	43	36
Cc1cc(C)n(-c2ccc(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)nn2)n1	ZINC000450856351	GE	On-Demand	Anodyne	TPP2	58	35
Cc1cc(C)n(-c2ccc(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nn2)n1	ZINC000450856352	GE	On-Demand	Anodyne	TPP2	58	35
Cc1cc(C)n(-c2ccc(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nn2)n1	ZINC000450856353	GE	On-Demand	Anodyne	TPP2	58	35
Cc1cc(C)n(-c2ccc(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)nn2)n1	ZINC000450856354	GE	On-Demand	Anodyne	TPP2	58	35
CC(F)(F)CCSc1nnc(-c2cc3ccccc3o2)o1	ZINC000450856355	DJ	On-Demand	Anodyne	ALOX15	40	33
CO[C@H](COc1cc(F)cc(F)c1C(C)=O)Cc1ccccc1	ZINC000450856387	DH	On-Demand	Anodyne	PDS	62	36
CO[C@@H](COc1cc(F)cc(F)c1C(C)=O)Cc1ccccc1	ZINC000450856388	DH	On-Demand	Anodyne	PDS	45	32
CC(C)OC(=O)CS[C@H](C)C(=O)Nc1nccs1	ZINC000450856430	CE	On-Demand	Anodyne	MAP	0	44
CC(C)OC(=O)CS[C@H](C)C(=O)Nc1nccs1	ZINC000450856430	CE	On-Demand	Anodyne	MAP1	129	44
CC(C)OC(=O)CS[C@@H](C)C(=O)Nc1nccs1	ZINC000450856431	CE	On-Demand	Anodyne	MAP	0	44
CC(C)OC(=O)CS[C@@H](C)C(=O)Nc1nccs1	ZINC000450856431	CE	On-Demand	Anodyne	MAP1	129	44
COc1cccc([C@@H]2C[C@H]2Nc2nccc(C#N)c2[N+](=O)[O-])c1	ZINC000450856444	DE	On-Demand	Mild	SYK	15	43
COC(=O)c1ccc(-c2nnn(C[C@H]3CCC(F)(F)C3)n2)cc1	ZINC000450856459	DF	On-Demand	Anodyne	SCARB1	50	39
COC(=O)c1ccc(-c2nnn(C[C@@H]3CCC(F)(F)C3)n2)cc1	ZINC000450856460	DF	On-Demand	Anodyne	SCARB1	50	39
CCCc1ncc(CNc2c(C#N)cnc3c(Cl)cc(C)cc23)o1	ZINC000450856469	EJ	On-Demand	Mild	SRC	53	34
CCCc1ncc(CNc2c(C#N)cnc3c(Cl)cc(C)cc23)o1	ZINC000450856469	EJ	On-Demand	Mild	MAP3K8	113	44
CCOC(=O)[C@@](C)(O)CNC(=O)c1c(C)cccc1Cl	ZINC000450856487	CD	On-Demand	Anodyne	ECR	40	38
CCOC(=O)[C@](C)(O)CNC(=O)c1c(C)cccc1Cl	ZINC000450856488	CD	On-Demand	Anodyne	ECR	40	38
CC1(C)C[C@H](O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450856496	FG	On-Demand	Anodyne	PDE3A	45	34
CC1(C)C[C@H](O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450856496	FG	On-Demand	Anodyne	PDE3B	66	34
CC1(C)C[C@@H](O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450856497	FG	On-Demand	Anodyne	PDE3A	45	34
CC1(C)C[C@@H](O)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450856497	FG	On-Demand	Anodyne	PDE3B	66	34
CCOC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)nc1	ZINC000450856517	FH	On-Demand	Anodyne	P2RY12	29	41
COc1ccccc1-c1noc(C2CCN(C[C@H]3COCCO3)CC2)n1	ZINC000450856520	FE	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc(C2CCN(C[C@H]3COCCO3)CC2)n1	ZINC000450856520	FE	On-Demand	Anodyne	SMO	51	44
COc1ccccc1-c1noc(C2CCN(C[C@H]3COCCO3)CC2)n1	ZINC000450856520	FE	On-Demand	Anodyne	ETHR	50	36
COc1ccccc1-c1noc(C2CCN(C[C@@H]3COCCO3)CC2)n1	ZINC000450856521	FE	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccccc1-c1noc(C2CCN(C[C@@H]3COCCO3)CC2)n1	ZINC000450856521	FE	On-Demand	Anodyne	SMO	51	44
COc1ccccc1-c1noc(C2CCN(C[C@@H]3COCCO3)CC2)n1	ZINC000450856521	FE	On-Demand	Anodyne	ETHR	50	36
COc1cc(-c2noc(CN(C)CCCNC(=O)C3CCC3)n2)ncn1	ZINC000450856526	FD	On-Demand	Anodyne	TBK1	62	33
CCS(=O)(=O)c1ccc(CN(C)CCCNC(=O)C2CCC2)cc1	ZINC000450856533	FE	On-Demand	Anodyne	TBK1	50	42
CCS(=O)(=O)c1ccc(CN(C)CCCNC(=O)C2CCC2)cc1	ZINC000450856533	FE	On-Demand	Anodyne	RORC	20	45
COc1cccc([C@@H]2C[C@@H](Nc3ccc(C(C)=O)cn3)C2)c1	ZINC000450856575	CH	On-Demand	Anodyne	ROCK2	41	38
O=C1CCC(CN2CCC(c3ncccc3Cl)CC2)CC1	ZINC000450856591	DH	On-Demand	Anodyne	OPRL1	15	55
COC(=O)c1coc(CSc2nnc(CCCc3ccccc3)o2)n1	ZINC000450856592	FG	On-Demand	Anodyne	FAAH	30	42
COC(=O)c1coc(CSc2nnc(CCCc3ccccc3)o2)n1	ZINC000450856592	FG	On-Demand	Anodyne	CES1	38	41
CC[C@@H](C)N1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450856613	DF	On-Demand	Anodyne	PDE3A	45	35
CC[C@@H](C)N1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450856613	DF	On-Demand	Anodyne	PDGFRB	67	43
CC[C@@H](C)N1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450856613	DF	On-Demand	Anodyne	PDE3B	66	35
CC[C@@H](C)N1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450856613	DF	On-Demand	Anodyne	HTT	0	49
CC[C@H](C)N1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450856614	DF	On-Demand	Anodyne	PDE3A	45	35
CC[C@H](C)N1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450856614	DF	On-Demand	Anodyne	PDGFRB	67	43
CC[C@H](C)N1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450856614	DF	On-Demand	Anodyne	PDE3B	66	35
CC[C@H](C)N1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450856614	DF	On-Demand	Anodyne	HTT	0	49
O[C@@H]([C@H]1CCCN(CCc2c(Cl)cccc2Cl)C1)C(F)(F)F	ZINC000450856665	FI	On-Demand	Anodyne	SLC6A1	60	34
O[C@H]([C@H]1CCCN(CCc2c(Cl)cccc2Cl)C1)C(F)(F)F	ZINC000450856666	FI	On-Demand	Anodyne	SLC6A1	60	34
O[C@H]([C@@H]1CCCN(CCc2c(Cl)cccc2Cl)C1)C(F)(F)F	ZINC000450856667	FI	On-Demand	Anodyne	SLC6A1	60	34
O[C@@H]([C@@H]1CCCN(CCc2c(Cl)cccc2Cl)C1)C(F)(F)F	ZINC000450856668	FI	On-Demand	Anodyne	SLC6A1	60	34
COc1cc(CC(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)ccc1Cl	ZINC000450856669	GH	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)ccc1Cl	ZINC000450856669	GH	On-Demand	Anodyne	NCE103	20	40
COc1cc(CC(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)ccc1Cl	ZINC000450856669	GH	On-Demand	Anodyne	MBTPS1	48	31
COc1cc(CC(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)ccc1Cl	ZINC000450856669	GH	On-Demand	Anodyne	CAN2	0	40
CCc1cc(N[C@H](C)[C@@H](OC)C2CC2)n2ncnc2n1	ZINC000450856676	CD	On-Demand	Anodyne	DHOD	0	46
CCc1cc(N[C@H](C)[C@H](OC)C2CC2)n2ncnc2n1	ZINC000450856677	CD	On-Demand	Anodyne	DHOD	0	46
CCc1cc(N[C@@H](C)[C@@H](OC)C2CC2)n2ncnc2n1	ZINC000450856678	CD	On-Demand	Anodyne	DHOD	0	46
CCc1cc(N[C@@H](C)[C@H](OC)C2CC2)n2ncnc2n1	ZINC000450856679	CD	On-Demand	Anodyne	DHOD	0	46
Cc1cn2nc(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)sc2n1	ZINC000450856691	EE	On-Demand	Anodyne	TPP2	58	37
Cc1cn2nc(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)sc2n1	ZINC000450856692	EE	On-Demand	Anodyne	TPP2	58	37
Cc1cn2nc(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)sc2n1	ZINC000450856693	EE	On-Demand	Anodyne	TPP2	58	37
Cc1cn2nc(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)sc2n1	ZINC000450856694	EE	On-Demand	Anodyne	TPP2	58	37
CSCc1ccccc1NC(=O)[C@H](O)C1CCC1	ZINC000450856733	CF	On-Demand	Anodyne	KCNQ2	51	33
CSCc1ccccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450856734	CF	On-Demand	Anodyne	KCNQ2	51	33
c1coc([C@H]2N(c3ncnc4[nH]ccc34)CC23CCC3)c1	ZINC000450856763	CG	On-Demand	Anodyne	AKT2	28	40
c1coc([C@H]2N(c3ncnc4[nH]ccc34)CC23CCC3)c1	ZINC000450856763	CG	On-Demand	Anodyne	AKT1	29	42
c1coc([C@@H]2N(c3ncnc4[nH]ccc34)CC23CCC3)c1	ZINC000450856764	CG	On-Demand	Anodyne	AKT2	28	40
c1coc([C@@H]2N(c3ncnc4[nH]ccc34)CC23CCC3)c1	ZINC000450856764	CG	On-Demand	Anodyne	AKT1	29	42
C[C@@H](Nc1ccc2nnc(C(F)(F)F)n2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856780	GE	On-Demand	Anodyne	TPP2	57	35
C[C@H](Nc1ccc2nnc(C(F)(F)F)n2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450856781	GE	On-Demand	Anodyne	TPP2	57	35
C[C@H](Nc1ccc2nnc(C(F)(F)F)n2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450856782	GE	On-Demand	Anodyne	TPP2	57	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc2nnc(C(F)(F)F)n2n1	ZINC000450856783	GE	On-Demand	Anodyne	TPP2	57	35
COc1cc(CC(=O)N[C@](C)(CO)C2CCCCC2)ccc1O	ZINC000450856789	DE	On-Demand	Anodyne	NCE103	25	41
COc1cc(CC(=O)N[C@](C)(CO)C2CCCCC2)ccc1O	ZINC000450856789	DE	On-Demand	Anodyne	CAN2	0	41
CCCc1ncc(CNc2ccc(C(=O)CC)cc2S(N)(=O)=O)o1	ZINC000450856797	FE	On-Demand	Anodyne	CA6	19	40
CCCc1ncc(CNc2ccc(C(=O)CC)cc2S(N)(=O)=O)o1	ZINC000450856797	FE	On-Demand	Anodyne	CA7	19	43
CCCc1ncc(CNc2ccc(C(=O)CC)cc2S(N)(=O)=O)o1	ZINC000450856797	FE	On-Demand	Anodyne	CA13	39	43
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450856904	FH	On-Demand	Anodyne	THRA	0	40
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450856904	FH	On-Demand	Anodyne	DRD4	0	43
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450856904	FH	On-Demand	Anodyne	CYP2J2	64	46
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450856906	FH	On-Demand	Anodyne	THRA	0	40
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450856906	FH	On-Demand	Anodyne	DRD4	0	43
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450856906	FH	On-Demand	Anodyne	CYP2J2	64	46
CC1(C)C[C@H](O)CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450856908	EI	On-Demand	Anodyne	LIPG	41	31
CC1(C)C[C@@H](O)CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450856909	EI	On-Demand	Anodyne	LIPG	41	31
Brc1ccc2c(N[C@@H]3CCO[C@H](c4cccs4)C3)ncnc2c1	ZINC000450856926	GJ	On-Demand	Anodyne	CD38	49	42
Brc1ccc2c(N[C@H]3CCO[C@@H](c4cccs4)C3)ncnc2c1	ZINC000450856929	GJ	On-Demand	Anodyne	CD38	49	42
Brc1ccc2c(N[C@H]3CCO[C@H](c4cccs4)C3)ncnc2c1	ZINC000450856931	GJ	On-Demand	Anodyne	CD38	49	42
CC[C@H](C)N1CCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450856954	DE	On-Demand	Anodyne	SORD	84	50
CC[C@@H](C)N1CCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450856955	DE	On-Demand	Anodyne	SORD	84	50
Cc1cccc(Cl)c1CN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450856973	DH	On-Demand	Anodyne	SLC6A1	49	37
Cc1cccc(Cl)c1CN1CCC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450856974	DH	On-Demand	Anodyne	SLC6A1	49	37
Cc1cccc(Cl)c1CN1CCC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450856975	DH	On-Demand	Anodyne	SLC6A1	49	37
Cc1cccc(Cl)c1CN1CCC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450856976	DH	On-Demand	Anodyne	SLC6A1	49	37
CCOC(=O)[C@@](C)(O)CNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450856992	FC	On-Demand	Anodyne	CACNA1I	15	44
CCOC(=O)[C@](C)(O)CNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450856999	FC	On-Demand	Anodyne	CACNA1I	15	44
CO[C@H](C1CC1)[C@@H](C)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450857048	FE	On-Demand	Anodyne	LRRK2	34	43
CO[C@@H](C1CC1)[C@@H](C)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450857050	FE	On-Demand	Anodyne	LRRK2	34	43
CO[C@H](C1CC1)[C@H](C)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450857053	FE	On-Demand	Anodyne	LRRK2	34	43
CO[C@@H](C1CC1)[C@H](C)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450857055	FE	On-Demand	Anodyne	LRRK2	34	43
CC[C@H](C)N1CCN(c2cc(C)nc(-c3ccccn3)n2)CC1	ZINC000450857065	DF	On-Demand	Anodyne	METAP1	41	35
CC[C@H](C)N1CCN(c2cc(C)nc(-c3ccccn3)n2)CC1	ZINC000450857065	DF	On-Demand	Anodyne	SORD	65	41
CC[C@@H](C)N1CCN(c2cc(C)nc(-c3ccccn3)n2)CC1	ZINC000450857066	DF	On-Demand	Anodyne	METAP1	41	35
CC[C@@H](C)N1CCN(c2cc(C)nc(-c3ccccn3)n2)CC1	ZINC000450857066	DF	On-Demand	Anodyne	SORD	65	41
COCCSCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450857074	DE	On-Demand	Anodyne	CYP1B1	23	40
COCCSCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450857074	DE	On-Demand	Anodyne	MTR1B_CHICK	0	40
COCCSCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450857074	DE	On-Demand	Anodyne	MTNR1A	65	39
CC[C@@H](C)N1CCN(c2nc3cccc(F)c3n2C)CC1	ZINC000450857076	CF	On-Demand	Anodyne	HRH1	0	41
CC[C@H](C)N1CCN(c2nc3cccc(F)c3n2C)CC1	ZINC000450857077	CF	On-Demand	Anodyne	HRH1	0	41
COc1cc(CC(=O)N[C@@](C)(CO)C2CCCCC2)ccc1O	ZINC000450857090	DE	On-Demand	Anodyne	NCE103	25	41
COc1cc(CC(=O)N[C@@](C)(CO)C2CCCCC2)ccc1O	ZINC000450857090	DE	On-Demand	Anodyne	CAN2	0	41
C[C@@H](N=c1cc[nH]c(C#N)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857091	DE	On-Demand	Mild	TPP2	54	35
C[C@H](N=c1cc[nH]c(C#N)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857092	DE	On-Demand	Mild	TPP2	54	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1cc[nH]c(C#N)c1	ZINC000450857093	DE	On-Demand	Mild	TPP2	54	35
C[C@H](N=c1cc[nH]c(C#N)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857094	DE	On-Demand	Mild	TPP2	54	35
Cc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857095	DF	On-Demand	Anodyne	ACE	23	43
Cc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857095	DF	On-Demand	Anodyne	DRD4	25	40
Cc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857095	DF	On-Demand	Anodyne	TPP2	73	42
Cc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857096	DF	On-Demand	Anodyne	ACE	23	43
Cc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857096	DF	On-Demand	Anodyne	DRD4	25	40
Cc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857096	DF	On-Demand	Anodyne	TPP2	73	42
Cc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857097	DF	On-Demand	Anodyne	ACE	23	43
Cc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857097	DF	On-Demand	Anodyne	DRD4	25	40
Cc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857097	DF	On-Demand	Anodyne	TPP2	73	42
Cc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857098	DF	On-Demand	Anodyne	ACE	23	43
Cc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857098	DF	On-Demand	Anodyne	DRD4	25	40
Cc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857098	DF	On-Demand	Anodyne	TPP2	73	42
C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857113	ED	On-Demand	Bother	TPP2	68	38
C[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857114	ED	On-Demand	Bother	TPP2	68	38
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc([N+](=O)[O-])c(N)n1	ZINC000450857115	ED	On-Demand	Bother	TPP2	68	38
C[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857116	ED	On-Demand	Bother	TPP2	68	38
Cc1ccc(C(C)(C)NC(=O)c2ccc(C(F)(F)F)cc2C)cn1	ZINC000450857125	EI	On-Demand	Anodyne	SORT1	16	41
Cc1ccc(C(C)(C)NC(=O)c2ccc(C(F)(F)F)cc2C)cn1	ZINC000450857125	EI	On-Demand	Anodyne	IMPDH2	15	51
C[C@H](Nc1cnc(C#N)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857178	DE	On-Demand	Mild	TPP2	41	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cnc(C#N)cn1	ZINC000450857179	DE	On-Demand	Mild	TPP2	41	34
C[C@H](Nc1cnc(C#N)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857180	DE	On-Demand	Mild	TPP2	41	34
C[C@@H](Nc1cnc(C#N)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857181	DE	On-Demand	Mild	TPP2	41	34
CN(CCCNC(=O)C1CCC1)Cc1ccn(CCc2ccccc2)n1	ZINC000450857242	FF	On-Demand	Anodyne	TBK1	50	35
CO[C@H](C1CC1)[C@@H](C)Nc1cc(N2CCC[C@H]2CO)ncn1	ZINC000450857291	DD	On-Demand	Anodyne	PRCP	0	41
CO[C@H](C1CC1)[C@H](C)Nc1cc(N2CCC[C@@H]2CO)ncn1	ZINC000450857292	DD	On-Demand	Anodyne	PRCP	0	41
CO[C@H](C1CC1)[C@@H](C)Nc1cc(N2CCC[C@@H]2CO)ncn1	ZINC000450857293	DD	On-Demand	Anodyne	PRCP	0	41
CO[C@H](C1CC1)[C@H](C)Nc1cc(N2CCC[C@H]2CO)ncn1	ZINC000450857294	DD	On-Demand	Anodyne	PRCP	0	41
CCOC(=O)CC(=O)CSCC[C@@H](C)O	ZINC000450857297	BD	On-Demand	Anodyne	METAP2	23	43
CCOC(=O)CC(=O)CSCC[C@H](C)O	ZINC000450857298	BD	On-Demand	Anodyne	METAP2	23	43
COc1cc(CN2C[C@@H](O)[C@H](O)C2)ccc1Cl	ZINC000450857303	CC	On-Demand	Anodyne	SSTR5	43	37
COc1cc(CN2C[C@@H](O)[C@H](O)C2)ccc1Cl	ZINC000450857303	CC	On-Demand	Anodyne	UTS2R	24	40
COc1cc(CN2C[C@H](O)[C@H](O)C2)ccc1Cl	ZINC000450857304	CC	On-Demand	Anodyne	SSTR5	43	37
COc1cc(CN2C[C@H](O)[C@H](O)C2)ccc1Cl	ZINC000450857304	CC	On-Demand	Anodyne	UTS2R	24	40
COc1cc(CN2C[C@H](O)[C@@H](O)C2)ccc1Cl	ZINC000450857305	CC	On-Demand	Anodyne	SSTR5	43	37
COc1cc(CN2C[C@H](O)[C@@H](O)C2)ccc1Cl	ZINC000450857305	CC	On-Demand	Anodyne	UTS2R	24	40
CC[C@@H](C)N1CCN(c2nc(C)cc(C(F)(F)F)n2)CC1	ZINC000450857306	DF	On-Demand	Anodyne	SORD	25	46
CC[C@H](C)N1CCN(c2nc(C)cc(C(F)(F)F)n2)CC1	ZINC000450857307	DF	On-Demand	Anodyne	SORD	25	46
CCOC(=O)CC(=O)CSCc1ccc(S(=O)(=O)CC)cc1	ZINC000450857345	EE	On-Demand	Anodyne	RORC	46	33
CC[C@@H](C)N1CCN(c2ccc(C(=O)NCCO)nn2)CC1	ZINC000450857361	DC	On-Demand	Anodyne	SCD1	54	50
CC[C@@H](C)N1CCN(c2ccc(C(=O)NCCO)nn2)CC1	ZINC000450857361	DC	On-Demand	Anodyne	SCD	44	48
CC[C@H](C)N1CCN(c2ccc(C(=O)NCCO)nn2)CC1	ZINC000450857362	DC	On-Demand	Anodyne	SCD1	54	50
CC[C@H](C)N1CCN(c2ccc(C(=O)NCCO)nn2)CC1	ZINC000450857362	DC	On-Demand	Anodyne	SCD	44	48
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450857367	ED	On-Demand	Anodyne	NPY1R	40	32
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450857369	ED	On-Demand	Anodyne	NPY1R	40	32
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450857371	ED	On-Demand	Anodyne	NPY1R	40	32
CO[C@H](C1CC1)[C@H](C)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450857373	ED	On-Demand	Anodyne	NPY1R	40	32
CCOC(=O)c1ccc(CN2CCC(c3ncc(C)s3)CC2)nc1	ZINC000450857380	EG	On-Demand	Anodyne	SSTR5	31	42
C[C@H](N=c1[nH]nc(C(F)F)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857403	EF	On-Demand	Anodyne	TPP2	54	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1[nH]nc(C(F)F)s1	ZINC000450857406	EF	On-Demand	Anodyne	TPP2	54	35
COc1cccc([C@@H]2C[C@H]2Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c1	ZINC000450857410	FF	On-Demand	Bother	TBXA2R	0	42
C[C@H](N=c1[nH]nc(C(F)F)s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857411	EF	On-Demand	Anodyne	TPP2	54	35
C[C@@H](N=c1[nH]nc(C(F)F)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857414	EF	On-Demand	Anodyne	TPP2	54	35
CCN1C(=O)CCc2cc(NC(=O)[C@@H](O)C3CCC3)ccc21	ZINC000450857425	DE	On-Demand	Anodyne	NAMPT	27	44
C[C@@](CO)(NC(=O)Cc1scnc1-c1ccccc1)C1CCCCC1	ZINC000450857433	FH	On-Demand	Anodyne	AMY2	45	30
C[C@](CO)(NC(=O)Cc1scnc1-c1ccccc1)C1CCCCC1	ZINC000450857434	FH	On-Demand	Anodyne	AMY2	45	30
CCc1cc(N[C@@H]2C[C@H]2c2cccc(OC)c2)n2ncnc2n1	ZINC000450857435	DF	On-Demand	Anodyne	DHOD	0	48
C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857443	FH	On-Demand	Mild	TPP2	55	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000450857447	FH	On-Demand	Mild	TPP2	55	35
C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857448	FH	On-Demand	Mild	TPP2	55	35
C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857449	FH	On-Demand	Mild	TPP2	55	35
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857450	CF	On-Demand	Anodyne	ACE	15	40
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857450	CF	On-Demand	Anodyne	TPP2	69	39
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857451	CF	On-Demand	Anodyne	ACE	15	40
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450857451	CF	On-Demand	Anodyne	TPP2	69	39
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857452	CF	On-Demand	Anodyne	ACE	15	40
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857452	CF	On-Demand	Anodyne	TPP2	69	39
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857453	CF	On-Demand	Anodyne	ACE	15	40
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450857453	CF	On-Demand	Anodyne	TPP2	69	39
C[C@@H](SCc1cccc(OC(F)F)c1)C(=O)Nc1nccs1	ZINC000450857478	EI	On-Demand	Anodyne	MAP	0	40
C[C@@H](SCc1cccc(OC(F)F)c1)C(=O)Nc1nccs1	ZINC000450857478	EI	On-Demand	Anodyne	MAP1	109	40
C[C@H](SCc1cccc(OC(F)F)c1)C(=O)Nc1nccs1	ZINC000450857482	EI	On-Demand	Anodyne	MAP	0	40
C[C@H](SCc1cccc(OC(F)F)c1)C(=O)Nc1nccs1	ZINC000450857482	EI	On-Demand	Anodyne	MAP1	109	40
CCOC(=O)c1ccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)nc1	ZINC000450857534	GG	On-Demand	Mild	P2RY12	60	44
c1csc([C@@H]2C[C@H](Nc3ncnc4ccccc34)CCO2)c1	ZINC000450857546	DI	On-Demand	Anodyne	CD38	60	43
c1csc([C@H]2C[C@H](Nc3ncnc4ccccc34)CCO2)c1	ZINC000450857550	DI	On-Demand	Anodyne	CD38	60	43
c1csc([C@H]2C[C@@H](Nc3ncnc4ccccc34)CCO2)c1	ZINC000450857553	DI	On-Demand	Anodyne	CD38	60	43
COc1ccccc1C1(CNC(=O)[C@@H](O)C2CCC2)CCC1	ZINC000450857577	DE	On-Demand	Anodyne	KCNA3	44	45
COc1ccccc1C1(CNC(=O)[C@@H](O)C2CCC2)CCC1	ZINC000450857577	DE	On-Demand	Anodyne	ACAT	0	54
COc1ccccc1C1(CNC(=O)[C@@H](O)C2CCC2)CCC1	ZINC000450857577	DE	On-Demand	Anodyne	HCN1	41	35
COc1ccccc1C1(CNC(=O)[C@@H](O)C2CCC2)CCC1	ZINC000450857577	DE	On-Demand	Anodyne	HCN4	41	35
COc1ccccc1C1(CNC(=O)[C@H](O)C2CCC2)CCC1	ZINC000450857578	DE	On-Demand	Anodyne	KCNA3	44	45
COc1ccccc1C1(CNC(=O)[C@H](O)C2CCC2)CCC1	ZINC000450857578	DE	On-Demand	Anodyne	ACAT	0	54
COc1ccccc1C1(CNC(=O)[C@H](O)C2CCC2)CCC1	ZINC000450857578	DE	On-Demand	Anodyne	HCN1	41	35
COc1ccccc1C1(CNC(=O)[C@H](O)C2CCC2)CCC1	ZINC000450857578	DE	On-Demand	Anodyne	HCN4	41	35
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[S@](=O)CC2)c(OC)c1	ZINC000450857591	FD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[S@](=O)CC2)c(OC)c1	ZINC000450857591	FD	On-Demand	Anodyne	HTR7	31	41
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[S@](=O)CC2)c(OC)c1	ZINC000450857591	FD	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[S@](=O)CC2)c(OC)c1	ZINC000450857591	FD	On-Demand	Anodyne	MTNR1B	40	36
COc1ccc(CNC(=O)CCN2CC[C@H](C)[S@](=O)CC2)c(OC)c1	ZINC000450857592	FD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CC[C@H](C)[S@](=O)CC2)c(OC)c1	ZINC000450857592	FD	On-Demand	Anodyne	HTR7	31	41
COc1ccc(CNC(=O)CCN2CC[C@H](C)[S@](=O)CC2)c(OC)c1	ZINC000450857592	FD	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2CC[C@H](C)[S@](=O)CC2)c(OC)c1	ZINC000450857592	FD	On-Demand	Anodyne	MTNR1B	40	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[S@@](=O)CC2)c(OC)c1	ZINC000450857593	FD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[S@@](=O)CC2)c(OC)c1	ZINC000450857593	FD	On-Demand	Anodyne	HTR7	31	41
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[S@@](=O)CC2)c(OC)c1	ZINC000450857593	FD	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C)[S@@](=O)CC2)c(OC)c1	ZINC000450857593	FD	On-Demand	Anodyne	MTNR1B	40	36
COc1ccc(CNC(=O)CCN2CC[C@H](C)[S@@](=O)CC2)c(OC)c1	ZINC000450857594	FD	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CC[C@H](C)[S@@](=O)CC2)c(OC)c1	ZINC000450857594	FD	On-Demand	Anodyne	HTR7	31	41
COc1ccc(CNC(=O)CCN2CC[C@H](C)[S@@](=O)CC2)c(OC)c1	ZINC000450857594	FD	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2CC[C@H](C)[S@@](=O)CC2)c(OC)c1	ZINC000450857594	FD	On-Demand	Anodyne	MTNR1B	40	36
O=C1CC[C@@H](CN2CCC(c3ncccc3Cl)CC2)CCN1	ZINC000450857596	DF	On-Demand	Anodyne	OPRL1	0	51
O=C1CC[C@H](CN2CCC(c3ncccc3Cl)CC2)CCN1	ZINC000450857597	DF	On-Demand	Anodyne	OPRL1	0	51
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1C[C@@H](c2cccc(OC)c2)C1	ZINC000450857602	GE	On-Demand	Anodyne	CA2	26	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1C[C@@H](c2cccc(OC)c2)C1	ZINC000450857602	GE	On-Demand	Anodyne	CA1	27	41
C[C@@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccccc1	ZINC000450857605	CE	On-Demand	Anodyne	HRH3	22	45
C[C@@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccccc1	ZINC000450857605	CE	On-Demand	Anodyne	CYP2J2	59	42
C[C@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccccc1	ZINC000450857606	CE	On-Demand	Anodyne	HRH3	22	45
C[C@H]1CC[S@@](=O)CCN1CCCC(=O)c1ccccc1	ZINC000450857606	CE	On-Demand	Anodyne	CYP2J2	59	42
C[C@@H]1CC[S@](=O)CCN1CCCC(=O)c1ccccc1	ZINC000450857607	CE	On-Demand	Anodyne	HRH3	22	45
C[C@@H]1CC[S@](=O)CCN1CCCC(=O)c1ccccc1	ZINC000450857607	CE	On-Demand	Anodyne	CYP2J2	59	42
C[C@H]1CC[S@](=O)CCN1CCCC(=O)c1ccccc1	ZINC000450857608	CE	On-Demand	Anodyne	HRH3	22	45
C[C@H]1CC[S@](=O)CCN1CCCC(=O)c1ccccc1	ZINC000450857608	CE	On-Demand	Anodyne	CYP2J2	59	42
CC1(C)C[C@@H](O)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450857635	CD	On-Demand	Anodyne	CXCR3	32	44
CC1(C)C[C@H](O)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450857636	CD	On-Demand	Anodyne	CXCR3	32	44
CC(=O)c1ccc(CN(C)CCCNC(=O)C2CCC2)cc1	ZINC000450857639	DF	On-Demand	Anodyne	TBK1	64	43
CC(=O)c1ccc(CN(C)CCCNC(=O)C2CCC2)cc1	ZINC000450857639	DF	On-Demand	Anodyne	MTNR1C	0	40
COC(=O)c1ccc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)nn1	ZINC000450857641	DE	On-Demand	Anodyne	ROCK2	41	35
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450857649	CG	On-Demand	Bother	CACNA1C	48	36
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1	ZINC000450857649	CG	On-Demand	Bother	CACNA1D	81	36
COc1ccccc1-c1noc(C2CCN(Cc3cccnc3N)CC2)n1	ZINC000450857656	FG	On-Demand	Anodyne	SMO	43	40
COc1ccccc1-c1noc(C2CCN(Cc3cccnc3N)CC2)n1	ZINC000450857656	FG	On-Demand	Anodyne	ETHR	48	35
CNC(=O)c1cccnc1N1CC[C@@H](O)CC(C)(C)C1	ZINC000450857672	CD	On-Demand	Anodyne	G2YM83_BOTF4	52	34
CNC(=O)c1cccnc1N1CC[C@H](O)CC(C)(C)C1	ZINC000450857673	CD	On-Demand	Anodyne	G2YM83_BOTF4	52	34
COc1ccc(-c2csc3ncnc(N4CC[C@H](O)CC(C)(C)C4)c23)cc1	ZINC000450857678	GI	On-Demand	Anodyne	ADRB2	17	47
COc1ccc(-c2csc3ncnc(N4CC[C@H](O)CC(C)(C)C4)c23)cc1	ZINC000450857678	GI	On-Demand	Anodyne	ADRB3	17	53
COc1ccc(-c2csc3ncnc(N4CC[C@@H](O)CC(C)(C)C4)c23)cc1	ZINC000450857679	GI	On-Demand	Anodyne	ADRB2	17	47
COc1ccc(-c2csc3ncnc(N4CC[C@@H](O)CC(C)(C)C4)c23)cc1	ZINC000450857679	GI	On-Demand	Anodyne	ADRB3	17	53
COc1cccc([C@@H]2C[C@@H](Nc3cc([N+](=O)[O-])cc(S(N)(=O)=O)c3)C2)c1	ZINC000450857686	GF	On-Demand	Bother	CA14	25	43
CN(CCCNC(=O)C1CCC1)CCc1cscn1	ZINC000450857687	CD	On-Demand	Anodyne	TBK1	75	36
CCN1C(=O)CCc2cc(NC(=O)[C@H](O)C3CCC3)ccc21	ZINC000450857691	DE	On-Demand	Anodyne	NAMPT	27	44
COc1cccc(-n2cc(C(=O)N[C@@](C)(CO)C3CCCCC3)nn2)c1	ZINC000450857695	FE	On-Demand	Anodyne	DRD4	40	33
COc1cccc(-n2cc(C(=O)N[C@](C)(CO)C3CCCCC3)nn2)c1	ZINC000450857696	FE	On-Demand	Anodyne	DRD4	40	33
Cc1nccc(N2CCN(C(=O)Cc3scnc3-c3ccccc3)CC2)n1	ZINC000450857698	GF	On-Demand	Anodyne	SORD	64	37
COCCNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450857705	GE	On-Demand	Anodyne	TPP2	63	36
COCCNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450857707	GE	On-Demand	Anodyne	TPP2	63	36
COCCNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450857709	GE	On-Demand	Anodyne	TPP2	63	36
COCCNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450857712	GE	On-Demand	Anodyne	TPP2	63	36
CC(=O)CCCCCSc1nnc(CCc2ccccc2)o1	ZINC000450857713	DI	On-Demand	Anodyne	FAAH	64	42
CC(=O)CCCCCSc1nnc(CCc2ccccc2)o1	ZINC000450857713	DI	On-Demand	Anodyne	CES1	61	42
CC(=O)CCCCCSc1nnc(CCc2ccccc2)o1	ZINC000450857713	DI	On-Demand	Anodyne	CES1D	55	32
COC(=O)c1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)sc1C	ZINC000450857714	FE	On-Demand	Anodyne	TPP2	63	36
COC(=O)c1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)sc1C	ZINC000450857715	FE	On-Demand	Anodyne	TPP2	63	36
COC(=O)c1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)sc1C	ZINC000450857716	FE	On-Demand	Anodyne	TPP2	63	36
COC(=O)c1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)sc1C	ZINC000450857717	FE	On-Demand	Anodyne	TPP2	63	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccnn1C	ZINC000450857722	GE	On-Demand	Anodyne	CAPN2	42	36
CCc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n2ncnc2n1	ZINC000450857739	FE	On-Demand	Anodyne	TPP2	73	42
CCc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n2ncnc2n1	ZINC000450857740	FE	On-Demand	Anodyne	TPP2	73	42
CCc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n2ncnc2n1	ZINC000450857741	FE	On-Demand	Anodyne	TPP2	73	42
CCc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n2ncnc2n1	ZINC000450857742	FE	On-Demand	Anodyne	TPP2	73	42
Cc1nnc2ccc(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)nn12	ZINC000450857748	ED	On-Demand	Anodyne	TPP2	56	35
Cc1nnc2ccc(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nn12	ZINC000450857749	ED	On-Demand	Anodyne	TPP2	56	35
Cc1nnc2ccc(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nn12	ZINC000450857750	ED	On-Demand	Anodyne	TPP2	56	35
Cc1nnc2ccc(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)nn12	ZINC000450857751	ED	On-Demand	Anodyne	TPP2	56	35
CN(C)CC1(CNC(=O)c2ccc(N3CCC3)nc2)CCCC1	ZINC000450857754	DE	On-Demand	Anodyne	HCN1	48	30
CN(C)CC1(CNC(=O)c2ccc(N3CCC3)nc2)CCCC1	ZINC000450857754	DE	On-Demand	Anodyne	HCN4	46	30
COC(=O)c1csc(Cn2nnnc2CCCc2ccccc2)n1	ZINC000450857755	EE	On-Demand	Anodyne	FAAH	21	47
C[C@H](Nc1cc(=O)n2ccccc2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857756	EE	On-Demand	Anodyne	TPP2	64	36
C[C@H](Nc1cc(=O)n2ccccc2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857759	EE	On-Demand	Anodyne	TPP2	64	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cc(=O)n2ccccc2n1	ZINC000450857760	EE	On-Demand	Anodyne	TPP2	64	36
C[C@@H](Nc1cc(=O)n2ccccc2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857761	EE	On-Demand	Anodyne	TPP2	64	36
CC(C)c1noc(-c2ccnc(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)c2)n1	ZINC000450857762	GI	On-Demand	Anodyne	TPP2	52	33
CC(C)c1noc(-c2ccnc(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)c2)n1	ZINC000450857763	GI	On-Demand	Anodyne	TPP2	52	33
CC(C)c1noc(-c2ccnc(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)c2)n1	ZINC000450857764	GI	On-Demand	Anodyne	TPP2	52	33
CC(C)c1noc(-c2ccnc(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)c2)n1	ZINC000450857765	GI	On-Demand	Anodyne	TPP2	52	33
CCCOc1cccc(CS[C@H](C)C(C)=O)c1	ZINC000450857781	CH	On-Demand	Anodyne	PLA2G4B	54	44
CCCOc1cccc(CS[C@H](C)C(C)=O)c1	ZINC000450857781	CH	On-Demand	Anodyne	TSPAN17	0	41
CCCOc1cccc(CS[C@H](C)C(C)=O)c1	ZINC000450857781	CH	On-Demand	Anodyne	PDS	71	35
CCCOc1cccc(CS[C@@H](C)C(C)=O)c1	ZINC000450857782	CH	On-Demand	Anodyne	PLA2G4B	54	44
CCCOc1cccc(CS[C@@H](C)C(C)=O)c1	ZINC000450857782	CH	On-Demand	Anodyne	TSPAN17	0	41
CCCOc1cccc(CS[C@@H](C)C(C)=O)c1	ZINC000450857782	CH	On-Demand	Anodyne	PDS	71	35
CC[C@@H](C)N1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450857787	FE	On-Demand	Anodyne	HSD11B1	21	42
CC[C@H](C)N1CCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450857788	FE	On-Demand	Anodyne	HSD11B1	21	42
Cc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncc1[N+](=O)[O-]	ZINC000450857789	EG	On-Demand	Bother	TPP2	61	34
Cc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncc1[N+](=O)[O-]	ZINC000450857791	EG	On-Demand	Bother	TPP2	61	34
Cc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000450857794	EG	On-Demand	Bother	TPP2	61	34
Cc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000450857796	EG	On-Demand	Bother	TPP2	61	34
CCc1cccc(C(=O)N[C@@](C)(CO)C2CCCCC2)n1	ZINC000450857800	CF	On-Demand	Anodyne	AMY2	46	33
CCc1cccc(C(=O)N[C@](C)(CO)C2CCCCC2)n1	ZINC000450857802	CF	On-Demand	Anodyne	AMY2	46	33
C[C@@H](Nc1ncc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857818	DE	On-Demand	Anodyne	DRD4	24	43
C[C@H](Nc1ncc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857821	DE	On-Demand	Anodyne	DRD4	24	43
C[C@H](Nc1ncc(F)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857823	DE	On-Demand	Anodyne	DRD4	24	43
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(F)cn1	ZINC000450857825	DE	On-Demand	Anodyne	DRD4	24	43
C[C@@H](Nc1ncc(Br)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857835	FG	On-Demand	Anodyne	ACE	17	41
C[C@@H](Nc1ncc(Br)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857835	FG	On-Demand	Anodyne	TPP2	68	39
C[C@H](Nc1ncc(Br)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857836	FG	On-Demand	Anodyne	ACE	17	41
C[C@H](Nc1ncc(Br)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857836	FG	On-Demand	Anodyne	TPP2	68	39
C[C@H](Nc1ncc(Br)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857837	FG	On-Demand	Anodyne	ACE	17	41
C[C@H](Nc1ncc(Br)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857837	FG	On-Demand	Anodyne	TPP2	68	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(Br)cn1	ZINC000450857838	FG	On-Demand	Anodyne	ACE	17	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(Br)cn1	ZINC000450857838	FG	On-Demand	Anodyne	TPP2	68	39
C[C@H](Nc1cncc(-n2cccn2)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450857839	EE	On-Demand	Anodyne	TPP2	65	38
C[C@H](Nc1cncc(-n2cccn2)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857841	EE	On-Demand	Anodyne	TPP2	65	38
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cncc(-n2cccn2)n1	ZINC000450857843	EE	On-Demand	Anodyne	TPP2	65	38
C[C@@H](Nc1cncc(-n2cccn2)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450857844	EE	On-Demand	Anodyne	TPP2	65	38
COC(=O)CNC(=O)c1ccc(N[C@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450857862	FD	On-Demand	Bother	TAAR1	18	50
COC(=O)CNC(=O)c1ccc(N[C@@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450857863	FD	On-Demand	Bother	TAAR1	18	50
COC(=O)CNC(=O)c1ccc(N[C@@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450857864	FD	On-Demand	Bother	TAAR1	18	50
COC(=O)CNC(=O)c1ccc(N[C@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450857865	FD	On-Demand	Bother	TAAR1	18	50
COc1cccc([C@@H]2C[C@H]2Nc2ccc([N+](=O)[O-])c(C(C)=O)c2)c1	ZINC000450857889	EH	On-Demand	Bother	TAAR1	29	41
COc1cccc([C@@H]2C[C@H]2Nc2ccc(C(C)=O)cc2[N+](=O)[O-])c1	ZINC000450857896	EH	On-Demand	Bother	TAAR1	34	50
COc1cccc([C@@H]2C[C@H]2Nc2ccc(C(C)=O)cc2[N+](=O)[O-])c1	ZINC000450857896	EH	On-Demand	Bother	AKR1C3	15	50
COc1cccc([C@@H]2C[C@H]2Nc2ccc(C(C)=O)cc2[N+](=O)[O-])c1	ZINC000450857896	EH	On-Demand	Bother	AKR1C2	15	41
COC(=O)c1ccc(-c2nnn(C[C@H](Cc3ccccc3)OC)n2)cc1	ZINC000450857926	FE	On-Demand	Anodyne	SCARB1	47	39
COC(=O)c1ccc(-c2nnn(C[C@@H](Cc3ccccc3)OC)n2)cc1	ZINC000450857927	FE	On-Demand	Anodyne	SCARB1	47	39
CCCc1ncc(CNc2ccnc3cc(F)c(Cl)cc23)o1	ZINC000450857971	DJ	On-Demand	Anodyne	HRP1_PLAFA	53	31
CC1(C)C[C@H](O)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450857982	FG	On-Demand	Anodyne	AVPR2	57	37
CC1(C)C[C@H](O)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450857982	FG	On-Demand	Anodyne	AVPR1A	47	43
CC1(C)C[C@@H](O)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450857984	FG	On-Demand	Anodyne	AVPR2	57	37
CC1(C)C[C@@H](O)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450857984	FG	On-Demand	Anodyne	AVPR1A	47	43
COc1ccccc1-c1noc(C2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)n1	ZINC000450857986	FG	On-Demand	Anodyne	SMO	42	40
COc1ccccc1-c1noc(C2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)n1	ZINC000450857986	FG	On-Demand	Anodyne	ETHR	43	35
COc1ccccc1-c1noc(C2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)n1	ZINC000450857989	FG	On-Demand	Anodyne	SMO	42	40
COc1ccccc1-c1noc(C2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)n1	ZINC000450857989	FG	On-Demand	Anodyne	ETHR	43	35
Cc1noc(C[C@@H](NCCc2ccc(Cl)cc2)c2ccccc2)n1	ZINC000450858017	EI	On-Demand	Anodyne	METAP1	50	43
Cc1noc(C[C@H](NCCc2ccc(Cl)cc2)c2ccccc2)n1	ZINC000450858018	EI	On-Demand	Anodyne	METAP1	50	43
CC1(C)COC[C@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450858025	DG	On-Demand	Anodyne	EGFR	42	37
CC1(C)COC[C@@H]1Nc1ncnc2cc(Br)ccc12	ZINC000450858026	DG	On-Demand	Anodyne	EGFR	42	37
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858030	EE	On-Demand	Anodyne	DRD2	35	48
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858030	EE	On-Demand	Anodyne	DRD1	24	51
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858030	EE	On-Demand	Anodyne	HTR2C	24	63
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858030	EE	On-Demand	Anodyne	ERG2	22	48
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858030	EE	On-Demand	Anodyne	HTR3B	0	48
C[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858030	EE	On-Demand	Anodyne	CYP2J2	63	45
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858031	EE	On-Demand	Anodyne	DRD2	35	48
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858031	EE	On-Demand	Anodyne	DRD1	24	51
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858031	EE	On-Demand	Anodyne	HTR2C	24	63
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858031	EE	On-Demand	Anodyne	ERG2	22	48
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858031	EE	On-Demand	Anodyne	HTR3B	0	48
C[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450858031	EE	On-Demand	Anodyne	CYP2J2	63	45
CNC(=O)c1ccc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)c([N+](=O)[O-])c1	ZINC000450858039	FG	On-Demand	Bother	TAAR1	29	51
COc1ccc(-c2nnc(N3CC[C@H](O)CC(C)(C)C3)c3ccccc23)cc1	ZINC000450858044	GI	On-Demand	Anodyne	SMO	43	52
COc1ccc(-c2nnc(N3CC[C@@H](O)CC(C)(C)C3)c3ccccc23)cc1	ZINC000450858045	GI	On-Demand	Anodyne	SMO	43	52
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](O)CC(C)(C)C3)c([N+](=O)[O-])c2)cc1	ZINC000450858046	GI	On-Demand	Bother	TAAR1	36	51
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](O)CC(C)(C)C3)c([N+](=O)[O-])c2)cc1	ZINC000450858047	GI	On-Demand	Bother	TAAR1	36	51
C[C@H](S[C@@H](C)[C@@H](C)O)C(=O)Nc1nccs1	ZINC000450858048	CD	On-Demand	Anodyne	MAP	0	46
C[C@H](S[C@@H](C)[C@@H](C)O)C(=O)Nc1nccs1	ZINC000450858048	CD	On-Demand	Anodyne	MAP1	124	44
C[C@H](S[C@@H](C)[C@H](C)O)C(=O)Nc1nccs1	ZINC000450858049	CD	On-Demand	Anodyne	MAP	0	46
C[C@H](S[C@@H](C)[C@H](C)O)C(=O)Nc1nccs1	ZINC000450858049	CD	On-Demand	Anodyne	MAP1	124	44
C[C@H](S[C@H](C)[C@@H](C)O)C(=O)Nc1nccs1	ZINC000450858050	CD	On-Demand	Anodyne	MAP	0	46
C[C@H](S[C@H](C)[C@@H](C)O)C(=O)Nc1nccs1	ZINC000450858050	CD	On-Demand	Anodyne	MAP1	124	44
C[C@H](S[C@H](C)[C@H](C)O)C(=O)Nc1nccs1	ZINC000450858051	CD	On-Demand	Anodyne	MAP	0	46
C[C@H](S[C@H](C)[C@H](C)O)C(=O)Nc1nccs1	ZINC000450858051	CD	On-Demand	Anodyne	MAP1	124	44
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)CC[S@@]1=O	ZINC000450858088	EE	On-Demand	Anodyne	SIGMAR1	43	39
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)CC[S@@]1=O	ZINC000450858089	EE	On-Demand	Anodyne	SIGMAR1	43	39
C[C@H](N=c1nc(C(F)(F)F)[nH]s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858097	FF	On-Demand	Anodyne	TPP2	55	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1nc(C(F)(F)F)[nH]s1	ZINC000450858098	FF	On-Demand	Anodyne	TPP2	55	36
C[C@H](N=c1nc(C(F)(F)F)[nH]s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858099	FF	On-Demand	Anodyne	TPP2	55	36
C[C@@H](N=c1nc(C(F)(F)F)[nH]s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858100	FF	On-Demand	Anodyne	TPP2	55	36
COc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450858109	FG	On-Demand	Bother	TPP2	52	32
COc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450858110	FG	On-Demand	Bother	TPP2	52	32
COc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450858111	FG	On-Demand	Bother	TPP2	52	32
COc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450858112	FG	On-Demand	Bother	TPP2	52	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858113	FF	On-Demand	Anodyne	PRNP	61	43
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858113	FF	On-Demand	Anodyne	HDAC1	23	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858113	FF	On-Demand	Anodyne	P4HTM	0	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858113	FF	On-Demand	Anodyne	DGAT1	46	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858113	FF	On-Demand	Anodyne	NOD2	41	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858114	FF	On-Demand	Anodyne	PRNP	61	43
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858114	FF	On-Demand	Anodyne	HDAC1	23	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858114	FF	On-Demand	Anodyne	P4HTM	0	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858114	FF	On-Demand	Anodyne	DGAT1	46	38
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450858114	FF	On-Demand	Anodyne	NOD2	41	36
COC(=O)c1coc(Cn2nnnc2CCCc2ccccc2)n1	ZINC000450858115	ED	On-Demand	Anodyne	FAAH	27	51
CCOC(=O)c1ccc(CN(CC2CCC2)C(C)C)nc1	ZINC000450858116	CG	On-Demand	Anodyne	SCARB1	41	32
C[C@@H](Nc1nccc(C(F)(F)F)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858121	FG	On-Demand	Anodyne	TPP2	58	37
C[C@H](Nc1nccc(C(F)(F)F)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858122	FG	On-Demand	Anodyne	TPP2	58	37
C[C@H](Nc1nccc(C(F)(F)F)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858123	FG	On-Demand	Anodyne	TPP2	58	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nccc(C(F)(F)F)n1	ZINC000450858124	FG	On-Demand	Anodyne	TPP2	58	37
Cc1ccc(C(C)(C)NC(=O)c2ccc(I)cc2F)cn1	ZINC000450858127	GH	On-Demand	Anodyne	IMPDH2	0	57
C[C@H](Nc1ncccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858133	CE	On-Demand	Anodyne	ACE	23	44
C[C@H](Nc1ncccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858133	CE	On-Demand	Anodyne	DRD4	25	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncccn1	ZINC000450858134	CE	On-Demand	Anodyne	ACE	23	44
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncccn1	ZINC000450858134	CE	On-Demand	Anodyne	DRD4	25	40
C[C@H](Nc1ncccn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858135	CE	On-Demand	Anodyne	ACE	23	44
C[C@H](Nc1ncccn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858135	CE	On-Demand	Anodyne	DRD4	25	40
C[C@@H](Nc1ncccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858136	CE	On-Demand	Anodyne	ACE	23	44
C[C@@H](Nc1ncccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858136	CE	On-Demand	Anodyne	DRD4	25	40
CCn1nccc1[C@@H]1OCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450858150	FF	On-Demand	Anodyne	CCR5	52	34
COc1cc(CN[C@H]2CCCC[C@@H]2NS(C)(=O)=O)ccc1Cl	ZINC000450858162	EE	On-Demand	Anodyne	SSTR3	20	49
COc1cc(CN[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)ccc1Cl	ZINC000450858163	EE	On-Demand	Anodyne	SSTR3	20	49
COc1cc(CN[C@H]2CCCC[C@H]2NS(C)(=O)=O)ccc1Cl	ZINC000450858165	EE	On-Demand	Anodyne	SSTR3	20	49
COc1cc(CN[C@@H]2CCCC[C@H]2NS(C)(=O)=O)ccc1Cl	ZINC000450858167	EE	On-Demand	Anodyne	SSTR3	20	49
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450858185	ED	On-Demand	Bother	BDKRB1	23	42
CC[C@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450858187	ED	On-Demand	Bother	BDKRB1	23	42
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450858188	ED	On-Demand	Bother	BDKRB1	23	42
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450858189	ED	On-Demand	Bother	BDKRB1	23	42
CNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nn1	ZINC000450858190	ED	On-Demand	Anodyne	TPP2	59	38
CNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nn1	ZINC000450858193	ED	On-Demand	Anodyne	TPP2	59	38
CNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nn1	ZINC000450858195	ED	On-Demand	Anodyne	TPP2	59	38
CNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nn1	ZINC000450858197	ED	On-Demand	Anodyne	TPP2	59	38
Cn1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]2CO)cn1	ZINC000450858198	EE	On-Demand	Anodyne	DRD2	30	42
Cn1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]2CO)cn1	ZINC000450858198	EE	On-Demand	Anodyne	CYP2J2	46	33
CO[C@@H](C1CC1)[C@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450858207	CD	On-Demand	Bother	PRKCQ	40	39
CO[C@H](C1CC1)[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450858208	CD	On-Demand	Bother	PRKCQ	40	39
CO[C@H](C1CC1)[C@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450858209	CD	On-Demand	Bother	PRKCQ	40	39
CO[C@@H](C1CC1)[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450858210	CD	On-Demand	Bother	PRKCQ	40	39
CCOC(=O)c1ccnc(N2CCN([C@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000450858244	EE	On-Demand	Bother	P2RY12	40	36
CCOC(=O)c1ccnc(N2CCN([C@@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000450858245	EE	On-Demand	Bother	P2RY12	40	36
CCC(CC)(CCSCC(=O)C(C)(C)C)C(=O)OC	ZINC000450858253	CH	On-Demand	Anodyne	EST1_PIG	40	35
COC(=O)c1cn(C2CCN(C(=O)C3=C(c4ccccc4)CCC3)CC2)nn1	ZINC000450858258	GF	On-Demand	Anodyne	CHRM5	27	40
COC(=O)c1cn(C2CCN(C(=O)C3=C(c4ccccc4)CCC3)CC2)nn1	ZINC000450858258	GF	On-Demand	Anodyne	L3MBTL3	46	33
CCNC(=O)c1ccc(N2CCN([C@H](C)CC)CC2)nn1	ZINC000450858259	CD	On-Demand	Anodyne	SCD1	52	46
CCNC(=O)c1ccc(N2CCN([C@@H](C)CC)CC2)nn1	ZINC000450858260	CD	On-Demand	Anodyne	SCD1	52	46
CC[C@@H](C)N1CCN(c2ncnc3c(F)cccc23)CC1	ZINC000450858269	CF	On-Demand	Anodyne	ABCC1	74	39
CC[C@@H](C)N1CCN(c2ncnc3c(F)cccc23)CC1	ZINC000450858269	CF	On-Demand	Anodyne	ABCB1A	41	33
CC[C@H](C)N1CCN(c2ncnc3c(F)cccc23)CC1	ZINC000450858270	CF	On-Demand	Anodyne	ABCC1	74	39
CC[C@H](C)N1CCN(c2ncnc3c(F)cccc23)CC1	ZINC000450858270	CF	On-Demand	Anodyne	ABCB1A	41	33
CC[C@@H](C)N1CCN(c2cc(-n3cccn3)nc(N)n2)CC1	ZINC000450858273	DC	On-Demand	Anodyne	HRH4	27	41
CC[C@H](C)N1CCN(c2cc(-n3cccn3)nc(N)n2)CC1	ZINC000450858274	DC	On-Demand	Anodyne	HRH4	27	41
COc1cc(CC(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)ccc1O	ZINC000450858289	FF	On-Demand	Anodyne	TRPV1	31	48
COc1cc(CC(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)ccc1O	ZINC000450858289	FF	On-Demand	Anodyne	NCE103	30	41
COc1cc(CC(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)ccc1O	ZINC000450858289	FF	On-Demand	Anodyne	CAN2	0	41
C[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)CC[S@]1=O	ZINC000450858290	EE	On-Demand	Anodyne	SIGMAR1	43	39
C[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)CC[S@]1=O	ZINC000450858291	EE	On-Demand	Anodyne	SIGMAR1	43	39
CCOC(=O)c1ccc(CN2CCc3cccc(C)c3C2)nc1	ZINC000450858293	DG	On-Demand	Anodyne	P2RY12	24	41
CCOC(=O)c1ccc(CN2CCc3cccc(C)c3C2)nc1	ZINC000450858293	DG	On-Demand	Anodyne	NOD1	29	48
CCOC(=O)c1ccc(CN2CCc3cccc(C)c3C2)nc1	ZINC000450858293	DG	On-Demand	Anodyne	NOD2	46	48
CCOC(=O)c1csc(C2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450858295	GI	On-Demand	Anodyne	SIGMAR1	15	41
CC1(C)COC[C@H]1Nc1ncnc2cc(Cl)ccc12	ZINC000450858297	CG	On-Demand	Anodyne	HRP1_PLAFA	43	31
CC1(C)COC[C@@H]1Nc1ncnc2cc(Cl)ccc12	ZINC000450858298	CG	On-Demand	Anodyne	HRP1_PLAFA	43	31
CN(CCCNC(=O)C1CCC1)Cc1nnc(C2CC2)s1	ZINC000450858305	DE	On-Demand	Anodyne	TBK1	64	38
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)c2ccc(C(C)(F)F)nc2)cn1	ZINC000450858345	FG	On-Demand	Anodyne	PANC	49	31
COC(=O)c1ccc(-c2nnn(Cc3oc(C(C)C)nc3C)n2)cc1	ZINC000450858361	EF	On-Demand	Anodyne	SCARB1	42	36
COC(=O)c1ccc(-c2nnn(CC3(C#N)CCC3)n2)cc1	ZINC000450858381	CD	On-Demand	Mild	SCARB1	43	35
COC(=O)c1csc(CSc2nnc(CCCc3ccccc3)o2)n1	ZINC000450858384	GH	On-Demand	Anodyne	FAAH	32	41
COC(=O)c1csc(CSc2nnc(CCCc3ccccc3)o2)n1	ZINC000450858384	GH	On-Demand	Anodyne	CES1	33	41
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)c2cccnc2O1	ZINC000450858390	FI	On-Demand	Anodyne	PRCP	47	37
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)c2cccnc2O1	ZINC000450858391	FI	On-Demand	Anodyne	PRCP	47	37
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)c2cccnc2O1	ZINC000450858392	FI	On-Demand	Anodyne	PRCP	47	37
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)c2cccnc2O1	ZINC000450858393	FI	On-Demand	Anodyne	PRCP	47	37
CCOC(=O)[C@H](CC)S[C@H](C)C(=O)Nc1nccs1	ZINC000450858407	DF	On-Demand	Anodyne	MAP	0	48
CCOC(=O)[C@H](CC)S[C@H](C)C(=O)Nc1nccs1	ZINC000450858407	DF	On-Demand	Anodyne	ADAM17	0	45
CCOC(=O)[C@H](CC)S[C@H](C)C(=O)Nc1nccs1	ZINC000450858407	DF	On-Demand	Anodyne	MAP1	130	48
CCOC(=O)[C@@H](CC)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450858408	DF	On-Demand	Anodyne	MAP	0	48
CCOC(=O)[C@@H](CC)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450858408	DF	On-Demand	Anodyne	ADAM17	0	45
CCOC(=O)[C@@H](CC)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450858408	DF	On-Demand	Anodyne	MAP1	130	48
CCOC(=O)[C@H](CC)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450858409	DF	On-Demand	Anodyne	MAP	0	48
CCOC(=O)[C@H](CC)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450858409	DF	On-Demand	Anodyne	ADAM17	0	45
CCOC(=O)[C@H](CC)S[C@@H](C)C(=O)Nc1nccs1	ZINC000450858409	DF	On-Demand	Anodyne	MAP1	130	48
CCOC(=O)[C@@H](CC)S[C@H](C)C(=O)Nc1nccs1	ZINC000450858410	DF	On-Demand	Anodyne	MAP	0	48
CCOC(=O)[C@@H](CC)S[C@H](C)C(=O)Nc1nccs1	ZINC000450858410	DF	On-Demand	Anodyne	ADAM17	0	45
CCOC(=O)[C@@H](CC)S[C@H](C)C(=O)Nc1nccs1	ZINC000450858410	DF	On-Demand	Anodyne	MAP1	130	48
COc1cccc(OCCC(=O)N(C)CC2(O)CCC2)c1	ZINC000450858411	CD	On-Demand	Anodyne	MTNR1A	32	45
CC[C@H](C)N1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CC1	ZINC000450858412	FG	On-Demand	Anodyne	AVPR2	45	41
CC[C@@H](C)N1CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CC1	ZINC000450858413	FG	On-Demand	Anodyne	AVPR2	45	41
CC(C)(CC(=O)CSc1nnc(-c2cc3ccccc3o2)o1)C1CC1	ZINC000450858431	FJ	On-Demand	Anodyne	ALOX15	50	33
CC[C@@H](C)N1CCN(c2cnn(-c3ccc(F)cc3F)c(=O)c2Cl)CC1	ZINC000450858440	GG	On-Demand	Anodyne	NPY2R	43	36
C[C@H](Nc1ccc(C(N)=O)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858449	DD	On-Demand	Anodyne	TPP2	68	38
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C(N)=O)cn1	ZINC000450858450	DD	On-Demand	Anodyne	TPP2	68	38
C[C@H](Nc1ccc(C(N)=O)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858451	DD	On-Demand	Anodyne	TPP2	68	38
C[C@@H](Nc1ccc(C(N)=O)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858452	DD	On-Demand	Anodyne	TPP2	68	38
CCC(=O)CCCN(C)Cc1ccc(F)c(C)c1	ZINC000450858463	CG	On-Demand	Anodyne	LEF	50	41
CC[C@H](C)N1CCN(c2cnn(-c3ccc(F)cc3F)c(=O)c2Cl)CC1	ZINC000450858478	GG	On-Demand	Anodyne	NPY2R	43	36
CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450858488	GH	On-Demand	Anodyne	ADAM17	34	40
CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)c1cc(Cl)c2ccccc2n1	ZINC000450858488	GH	On-Demand	Anodyne	SSTR3	20	41
COc1ccc(CNC(=O)CCN2CCC[C@H](N(C)C)CC2)c(OC)c1	ZINC000450858555	FE	On-Demand	Anodyne	DRD2	25	40
COc1ccc(CNC(=O)CCN2CCC[C@H](N(C)C)CC2)c(OC)c1	ZINC000450858555	FE	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC[C@H](N(C)C)CC2)c(OC)c1	ZINC000450858555	FE	On-Demand	Anodyne	HTR4	51	37
COc1ccc(CNC(=O)CCN2CCC[C@H](N(C)C)CC2)c(OC)c1	ZINC000450858555	FE	On-Demand	Anodyne	HTR7	30	41
COc1ccc(CNC(=O)CCN2CCC[C@H](N(C)C)CC2)c(OC)c1	ZINC000450858555	FE	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN2CCC[C@H](N(C)C)CC2)c(OC)c1	ZINC000450858555	FE	On-Demand	Anodyne	MTNR1B	46	36
COc1ccc(CNC(=O)CCN2CCC[C@H](N(C)C)CC2)c(OC)c1	ZINC000450858555	FE	On-Demand	Anodyne	EBP	36	40
COc1ccc(CNC(=O)CCN2CCC[C@H](N(C)C)CC2)c(OC)c1	ZINC000450858555	FE	On-Demand	Anodyne	ACKR3	43	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](N(C)C)CC2)c(OC)c1	ZINC000450858556	FE	On-Demand	Anodyne	DRD2	25	40
COc1ccc(CNC(=O)CCN2CCC[C@@H](N(C)C)CC2)c(OC)c1	ZINC000450858556	FE	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC[C@@H](N(C)C)CC2)c(OC)c1	ZINC000450858556	FE	On-Demand	Anodyne	HTR4	51	37
COc1ccc(CNC(=O)CCN2CCC[C@@H](N(C)C)CC2)c(OC)c1	ZINC000450858556	FE	On-Demand	Anodyne	HTR7	30	41
COc1ccc(CNC(=O)CCN2CCC[C@@H](N(C)C)CC2)c(OC)c1	ZINC000450858556	FE	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](N(C)C)CC2)c(OC)c1	ZINC000450858556	FE	On-Demand	Anodyne	MTNR1B	46	36
COc1ccc(CNC(=O)CCN2CCC[C@@H](N(C)C)CC2)c(OC)c1	ZINC000450858556	FE	On-Demand	Anodyne	EBP	36	40
COc1ccc(CNC(=O)CCN2CCC[C@@H](N(C)C)CC2)c(OC)c1	ZINC000450858556	FE	On-Demand	Anodyne	ACKR3	43	36
CCOC(=O)c1cc(N2CC[C@@H](O)CC(C)(C)C2)ncc1Cl	ZINC000450858560	EF	On-Demand	Anodyne	PARE	40	33
CCOC(=O)c1cc(N2CC[C@H](O)CC(C)(C)C2)ncc1Cl	ZINC000450858561	EF	On-Demand	Anodyne	PARE	40	33
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450858576	EF	On-Demand	Bother	TAAR1	19	52
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450858577	EF	On-Demand	Bother	TAAR1	19	52
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450858579	EF	On-Demand	Bother	TAAR1	19	52
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450858580	EF	On-Demand	Bother	TAAR1	19	52
CN(C)S(=O)(=O)c1ccc(NCCN2CCC(O)CC2)c([N+](=O)[O-])c1	ZINC000450858605	FC	On-Demand	Bother	BDKRB1	0	42
CN(C)S(=O)(=O)c1ccc(NCCN2CCC(O)CC2)c([N+](=O)[O-])c1	ZINC000450858605	FC	On-Demand	Bother	BCL2L1	92	35
CN(C)S(=O)(=O)c1ccc(NCCN2CCC(O)CC2)c([N+](=O)[O-])c1	ZINC000450858605	FC	On-Demand	Bother	BCL2	67	33
Cc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncn1	ZINC000450858632	CF	On-Demand	Anodyne	ACE	17	40
Cc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncn1	ZINC000450858632	CF	On-Demand	Anodyne	TPP2	71	39
Cc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncn1	ZINC000450858633	CF	On-Demand	Anodyne	ACE	17	40
Cc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncn1	ZINC000450858633	CF	On-Demand	Anodyne	TPP2	71	39
Cc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncn1	ZINC000450858634	CF	On-Demand	Anodyne	ACE	17	40
Cc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncn1	ZINC000450858634	CF	On-Demand	Anodyne	TPP2	71	39
Cc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncn1	ZINC000450858635	CF	On-Demand	Anodyne	ACE	17	40
Cc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncn1	ZINC000450858635	CF	On-Demand	Anodyne	TPP2	71	39
Cc1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450858653	CF	On-Demand	Anodyne	DRD4	24	42
Cc1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450858655	CF	On-Demand	Anodyne	DRD4	24	42
Cc1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450858657	CF	On-Demand	Anodyne	DRD4	24	42
Cc1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450858659	CF	On-Demand	Anodyne	DRD4	24	42
Cc1cc(F)c(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)cc1F	ZINC000450858687	EG	On-Demand	Anodyne	CPT1A	40	34
Cc1cc(F)c(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)cc1F	ZINC000450858689	EG	On-Demand	Anodyne	CPT1A	40	34
COC(=O)c1csc(CN[C@H](CC(F)(F)F)c2ccccc2C)n1	ZINC000450858691	FI	On-Demand	Anodyne	CTSA	48	33
COC(=O)c1csc(CN[C@@H](CC(F)(F)F)c2ccccc2C)n1	ZINC000450858692	FI	On-Demand	Anodyne	CTSA	48	33
CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450858748	GG	On-Demand	Anodyne	DRD2	15	40
CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450858748	GG	On-Demand	Anodyne	HRH1	21	44
CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450858748	GG	On-Demand	Anodyne	HTR4	56	38
CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450858748	GG	On-Demand	Anodyne	SSTR5	82	44
CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450858748	GG	On-Demand	Anodyne	CCR3	31	41
CCOC(=O)c1n[nH]c(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450858748	GG	On-Demand	Anodyne	MCHR1	25	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cnn(C)c2)on1	ZINC000450858756	ED	On-Demand	Anodyne	COLA	58	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cnn(C)c2)on1	ZINC000450858756	ED	On-Demand	Anodyne	CPT1A	51	34
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cnn(C)c2)on1	ZINC000450858757	ED	On-Demand	Anodyne	COLA	58	41
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cnn(C)c2)on1	ZINC000450858757	ED	On-Demand	Anodyne	CPT1A	51	34
COc1ccc(CNC(=O)CCN2CCCC[C@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450858763	GD	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN2CCCC[C@@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450858764	GD	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c(Cl)c1OC	ZINC000450858765	GG	On-Demand	Anodyne	COLA	46	37
COc1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c(Cl)c1OC	ZINC000450858765	GG	On-Demand	Anodyne	CPT1A	44	37
COc1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c(Cl)c1OC	ZINC000450858766	GG	On-Demand	Anodyne	COLA	46	37
COc1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c(Cl)c1OC	ZINC000450858766	GG	On-Demand	Anodyne	CPT1A	44	37
COC(=O)c1coc(CN2CCc3cccc(C)c3C2)n1	ZINC000450858798	CE	On-Demand	Anodyne	NOD2	42	38
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	HTR1A	19	43
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	DRD2	37	45
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	DRD1	0	43
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	DRD4	55	43
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	ACHE	33	42
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	HRH1	20	41
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	DRD3	24	43
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	SIGMAR1	31	43
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	PRCP	18	40
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	SSTR5	67	37
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	CCR3	43	41
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	MCHR1	33	43
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	CCR8	29	42
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	SMO	56	45
COc1ccccc1-c1noc(C2CCN(Cc3cccc(C(C)=O)c3)CC2)n1	ZINC000450858836	GI	On-Demand	Anodyne	ETHR	59	40
CC(=O)c1ccc(Cn2nnnc2CCCc2ccccc2)cc1	ZINC000450858852	DG	On-Demand	Anodyne	FAAH	26	56
CC(=O)c1ccc(Cn2nnnc2CCCc2ccccc2)cc1	ZINC000450858852	DG	On-Demand	Anodyne	DAGLA	34	42
C[C@@H](Nc1ncnc(N)c1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858857	EE	On-Demand	Anodyne	TPP2	71	39
C[C@H](Nc1ncnc(N)c1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858858	EE	On-Demand	Anodyne	TPP2	71	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncnc(N)c1Cl	ZINC000450858859	EE	On-Demand	Anodyne	TPP2	71	39
C[C@H](Nc1ncnc(N)c1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858860	EE	On-Demand	Anodyne	TPP2	71	39
CSCc1ccccc1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450858877	GH	On-Demand	Anodyne	HDAC1	0	41
CSCc1ccccc1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450858877	GH	On-Demand	Anodyne	FABH	0	40
CSCc1ccccc1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450858877	GH	On-Demand	Anodyne	DGAT1	20	40
C[C@@H](Nc1nccc(C(F)F)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858898	EG	On-Demand	Anodyne	TPP2	61	39
C[C@H](Nc1nccc(C(F)F)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858900	EG	On-Demand	Anodyne	TPP2	61	39
CCOC(=O)c1ccc(CN2CCC[C@H](N(C)C)CC2)nc1	ZINC000450858901	DE	On-Demand	Anodyne	SSTR5	33	42
CCOC(=O)c1ccc(CN2CCC[C@@H](N(C)C)CC2)nc1	ZINC000450858902	DE	On-Demand	Anodyne	SSTR5	33	42
C[C@H](Nc1nccc(C(F)F)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858903	EG	On-Demand	Anodyne	TPP2	61	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nccc(C(F)F)n1	ZINC000450858905	EG	On-Demand	Anodyne	TPP2	61	39
CC[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H](O)CC	ZINC000450858907	DG	On-Demand	Bother	MAOB	23	53
CC[C@H](O)[C@H](CC)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450858911	DG	On-Demand	Bother	MAOB	23	53
CC[C@H](O)[C@@H](CC)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450858912	DG	On-Demand	Bother	MAOB	23	53
CC[C@@H](O)[C@@H](CC)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450858913	DG	On-Demand	Bother	MAOB	23	53
C[C@@H](Nc1cnn(C)c(=O)c1Br)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858966	GE	On-Demand	Anodyne	ACE	19	40
C[C@@H](Nc1cnn(C)c(=O)c1Br)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858966	GE	On-Demand	Anodyne	TPP2	59	36
C[C@H](Nc1cnn(C)c(=O)c1Br)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858968	GE	On-Demand	Anodyne	ACE	19	40
C[C@H](Nc1cnn(C)c(=O)c1Br)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450858968	GE	On-Demand	Anodyne	TPP2	59	36
C[C@H](Nc1cnn(C)c(=O)c1Br)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858971	GE	On-Demand	Anodyne	ACE	19	40
C[C@H](Nc1cnn(C)c(=O)c1Br)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450858971	GE	On-Demand	Anodyne	TPP2	59	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cnn(C)c(=O)c1Br	ZINC000450858972	GE	On-Demand	Anodyne	ACE	19	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cnn(C)c(=O)c1Br	ZINC000450858972	GE	On-Demand	Anodyne	TPP2	59	36
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450858990	DF	On-Demand	Anodyne	L3MBTL3	55	33
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450858992	DF	On-Demand	Anodyne	L3MBTL3	55	33
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450858994	DF	On-Demand	Anodyne	L3MBTL3	55	33
CC[C@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)[C@H](O)CC	ZINC000450858996	DF	On-Demand	Anodyne	L3MBTL3	55	33
COC(=O)c1ccc(-c2nnn(C[C@@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450859008	DD	On-Demand	Anodyne	SCARB1	46	36
COC(=O)c1ccc(-c2nnn(C[C@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450859010	DD	On-Demand	Anodyne	SCARB1	46	36
C[C@@H](Nc1nc2c(c(O)nc(=O)n2C)n1C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450859040	GC	On-Demand	Anodyne	TPP2	58	36
C[C@H](Nc1nc2c(c(O)nc(=O)n2C)n1C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450859045	GC	On-Demand	Anodyne	TPP2	58	36
COc1cccc([C@@H]2C[C@H]2Nc2ccc([N+](=O)[O-])cn2)c1	ZINC000450859046	CF	On-Demand	Bother	CACNA1D	76	36
C[C@H](Nc1nc2c(c(O)nc(=O)n2C)n1C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450859049	GC	On-Demand	Anodyne	TPP2	58	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nc2c(c(O)nc(=O)n2C)n1C	ZINC000450859051	GC	On-Demand	Anodyne	TPP2	58	36
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859053	DG	On-Demand	Anodyne	EGFR	54	42
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859053	DG	On-Demand	Anodyne	ERBB4	25	43
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859053	DG	On-Demand	Anodyne	HTT	0	45
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859055	DG	On-Demand	Anodyne	EGFR	54	42
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859055	DG	On-Demand	Anodyne	ERBB4	25	43
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859055	DG	On-Demand	Anodyne	HTT	0	45
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@H](O)CC	ZINC000450859057	DG	On-Demand	Anodyne	EGFR	54	42
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@H](O)CC	ZINC000450859057	DG	On-Demand	Anodyne	ERBB4	25	43
CC[C@H](Nc1ncnc2cc(Br)ccc12)[C@H](O)CC	ZINC000450859057	DG	On-Demand	Anodyne	HTT	0	45
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859059	DG	On-Demand	Anodyne	EGFR	54	42
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859059	DG	On-Demand	Anodyne	ERBB4	25	43
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(Br)ccc12	ZINC000450859059	DG	On-Demand	Anodyne	HTT	0	45
CC[C@@H](C)N1CCN(c2cccc(C(F)(F)F)n2)CC1	ZINC000450859064	CG	On-Demand	Anodyne	SORD	27	42
CC[C@H](C)N1CCN(c2cccc(C(F)(F)F)n2)CC1	ZINC000450859066	CG	On-Demand	Anodyne	SORD	27	42
CCc1cc(CCCn2nnc(-c3ccc(C(=O)OC)cc3)n2)on1	ZINC000450859071	EE	On-Demand	Anodyne	SCARB1	43	33
CC[C@H](C)N1CCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000450859104	DF	On-Demand	Anodyne	SORD	101	49
CC[C@@H](C)N1CCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000450859106	DF	On-Demand	Anodyne	SORD	101	49
O=C(NC[C@@H]1CCO[C@H]1c1ccc(F)cc1)c1cncc(Cl)c1	ZINC000450859107	EG	On-Demand	Anodyne	CACNA1I	41	33
Cc1ccc(C)c(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c1	ZINC000450859110	EF	On-Demand	Anodyne	ADRB2	0	60
Cc1ccc(C)c(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c1	ZINC000450859112	EF	On-Demand	Anodyne	ADRB2	0	60
Cc1ccc(C)c(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c1	ZINC000450859114	EF	On-Demand	Anodyne	ADRB2	0	60
Cc1ccc(C)c(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c1	ZINC000450859115	EF	On-Demand	Anodyne	ADRB2	0	60
CC[C@@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859170	CF	On-Demand	Bother	HTR1A	65	43
CC[C@@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859170	CF	On-Demand	Bother	DRD2	58	43
CC[C@@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859170	CF	On-Demand	Bother	DRD1	0	40
CC[C@@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859170	CF	On-Demand	Bother	ADRA1D	65	42
CC[C@@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859170	CF	On-Demand	Bother	HTR2A	28	40
CC[C@@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859170	CF	On-Demand	Bother	ADRA1A	47	39
CC[C@@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859170	CF	On-Demand	Bother	DRD3	41	39
CC[C@@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859170	CF	On-Demand	Bother	HTR7	44	39
CC[C@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859171	CF	On-Demand	Bother	HTR1A	65	43
CC[C@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859171	CF	On-Demand	Bother	DRD2	58	43
CC[C@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859171	CF	On-Demand	Bother	DRD1	0	40
CC[C@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859171	CF	On-Demand	Bother	ADRA1D	65	42
CC[C@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859171	CF	On-Demand	Bother	HTR2A	28	40
CC[C@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859171	CF	On-Demand	Bother	ADRA1A	47	39
CC[C@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859171	CF	On-Demand	Bother	DRD3	41	39
CC[C@H](C)N1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450859171	CF	On-Demand	Bother	HTR7	44	39
CC[C@H](C)N1CCN(c2nccc(-c3ccc(OC)cc3)n2)CC1	ZINC000450859182	EG	On-Demand	Anodyne	DKK1	0	40
CC[C@@H](C)N1CCN(c2nccc(-c3ccc(OC)cc3)n2)CC1	ZINC000450859183	EG	On-Demand	Anodyne	DKK1	0	40
CCOC(=O)c1ccc(CN(C)Cc2cc(Cl)ccc2F)nc1	ZINC000450859185	EH	On-Demand	Anodyne	P2RY12	23	40
COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)c1cccc(SC)c1	ZINC000450859236	EC	On-Demand	Anodyne	PREP	17	47
COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)c1cccc(SC)c1	ZINC000450859237	EC	On-Demand	Anodyne	PREP	17	47
COC(=O)c1coc(CN2CCCC[C@H]2c2cccc(Cl)c2)n1	ZINC000450859274	EH	On-Demand	Anodyne	COLA	42	38
COC(=O)c1coc(CN2CCCC[C@H]2c2cccc(Cl)c2)n1	ZINC000450859274	EH	On-Demand	Anodyne	CPT1A	41	38
COC(=O)c1coc(CN2CCCC[C@@H]2c2cccc(Cl)c2)n1	ZINC000450859275	EH	On-Demand	Anodyne	COLA	42	38
COC(=O)c1coc(CN2CCCC[C@@H]2c2cccc(Cl)c2)n1	ZINC000450859275	EH	On-Demand	Anodyne	CPT1A	41	38
Oc1cccc2c1C[C@@H](NCC/C=C\c1ccccc1)C2	ZINC000450859290	CH	On-Demand	Anodyne	SLC6A5	29	40
Oc1cccc2c1C[C@H](NCC/C=C\c1ccccc1)C2	ZINC000450859291	CH	On-Demand	Anodyne	SLC6A5	29	40
Oc1cccc2c1C[C@H](NCC/C=C/c1ccccc1)C2	ZINC000450859292	CH	On-Demand	Anodyne	SLC6A5	29	40
Oc1cccc2c1C[C@@H](NCC/C=C/c1ccccc1)C2	ZINC000450859293	CH	On-Demand	Anodyne	SLC6A5	29	40
CC1(C)C[C@@H](O)CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450859309	EH	On-Demand	Anodyne	PPIA	44	34
CC1(C)C[C@@H](O)CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450859309	EH	On-Demand	Anodyne	SLC12A5	56	34
CC1(C)C[C@H](O)CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450859310	EH	On-Demand	Anodyne	PPIA	44	34
CC1(C)C[C@H](O)CCN(c2ncccc2OCc2ccccc2)C1	ZINC000450859310	EH	On-Demand	Anodyne	SLC12A5	56	34
CN(C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450859315	CG	On-Demand	Anodyne	DRD4	24	49
CN(C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450859315	CG	On-Demand	Anodyne	HRH3	22	45
CN(C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450859315	CG	On-Demand	Anodyne	SLC18A3	0	42
CN(C)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450859315	CG	On-Demand	Anodyne	HTR3B	0	44
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450859316	CG	On-Demand	Anodyne	DRD4	24	49
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450859316	CG	On-Demand	Anodyne	HRH3	22	45
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450859316	CG	On-Demand	Anodyne	SLC18A3	0	42
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450859316	CG	On-Demand	Anodyne	HTR3B	0	44
CCC(=O)CCCN1CCC(c2ncccc2Cl)CC1	ZINC000450859325	CH	On-Demand	Anodyne	CYP2J2	48	34
CC(C)OC[C@H](CO)N(C)CCN(C)Cc1ccccc1	ZINC000450859338	CD	On-Demand	Anodyne	ACHE	15	43
CC(C)OC[C@@H](CO)N(C)CCN(C)Cc1ccccc1	ZINC000450859339	CD	On-Demand	Anodyne	ACHE	15	43
CN(C(=O)[C@@H](NC(N)=O)C(C)(C)C)C1CC(O)C1	ZINC000450859340	CC	On-Demand	Anodyne	PDF	40	32
CN(C(=O)[C@H](NC(N)=O)C(C)(C)C)C1CC(O)C1	ZINC000450859341	CC	On-Demand	Anodyne	PDF	40	32
CCOC(=O)c1csc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450859348	GI	On-Demand	Anodyne	HRH1	21	44
CCOC(=O)c1csc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450859348	GI	On-Demand	Anodyne	HTR4	49	38
CCOC(=O)c1csc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450859348	GI	On-Demand	Anodyne	SSTR5	81	44
CCOC(=O)c1csc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450859348	GI	On-Demand	Anodyne	CCR3	33	44
CCOC(=O)c1csc(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450859348	GI	On-Demand	Anodyne	MCHR1	22	43
COC(=O)C1(CN2CCC(c3nc(-c4ccccc4OC)no3)CC2)CC1	ZINC000450859349	FF	On-Demand	Anodyne	CACNA1C	0	41
COC(=O)C1(CN2CCC(c3nc(-c4ccccc4OC)no3)CC2)CC1	ZINC000450859349	FF	On-Demand	Anodyne	SMO	62	46
COC(=O)C1(CN2CCC(c3nc(-c4ccccc4OC)no3)CC2)CC1	ZINC000450859349	FF	On-Demand	Anodyne	ETHR	60	40
COc1ccccc1-c1noc(C2CCN(C[C@@H](C)S(C)(=O)=O)CC2)n1	ZINC000450859361	GE	On-Demand	Anodyne	PRCP	15	41
COc1ccccc1-c1noc(C2CCN(C[C@@H](C)S(C)(=O)=O)CC2)n1	ZINC000450859361	GE	On-Demand	Anodyne	LUCI_PHOPE	28	41
COc1ccccc1-c1noc(C2CCN(C[C@@H](C)S(C)(=O)=O)CC2)n1	ZINC000450859361	GE	On-Demand	Anodyne	SMO	55	45
COc1ccccc1-c1noc(C2CCN(C[C@@H](C)S(C)(=O)=O)CC2)n1	ZINC000450859361	GE	On-Demand	Anodyne	ETHR	51	38
COc1ccccc1-c1noc(C2CCN(C[C@H](C)S(C)(=O)=O)CC2)n1	ZINC000450859362	GE	On-Demand	Anodyne	PRCP	15	41
COc1ccccc1-c1noc(C2CCN(C[C@H](C)S(C)(=O)=O)CC2)n1	ZINC000450859362	GE	On-Demand	Anodyne	LUCI_PHOPE	28	41
COc1ccccc1-c1noc(C2CCN(C[C@H](C)S(C)(=O)=O)CC2)n1	ZINC000450859362	GE	On-Demand	Anodyne	SMO	55	45
COc1ccccc1-c1noc(C2CCN(C[C@H](C)S(C)(=O)=O)CC2)n1	ZINC000450859362	GE	On-Demand	Anodyne	ETHR	51	38
C=CCNC(=O)c1ccc(N[C@@H]2C[C@@H](c3cccc(OC)c3)C2)nc1	ZINC000450859366	EG	On-Demand	Mild	DRD4	41	31
Clc1cccnc1C1CCN(CCc2cscn2)CC1	ZINC000450859370	DH	On-Demand	Anodyne	SCN5A	40	36
CCS(=O)(=O)c1ccc(CN2CCC(c3ccncc3)CC2)cc1	ZINC000450859377	EG	On-Demand	Anodyne	SIGMAR1	25	42
CCS(=O)(=O)c1ccc(CN2CCC(c3ccncc3)CC2)cc1	ZINC000450859377	EG	On-Demand	Anodyne	SSTR5	29	41
CC(C)c1nccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450859394	DF	On-Demand	Anodyne	TPP2	67	39
CC(C)c1nccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450859395	DF	On-Demand	Anodyne	TPP2	67	39
CC(C)c1nccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450859396	DF	On-Demand	Anodyne	TPP2	67	39
CC(C)c1nccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450859397	DF	On-Demand	Anodyne	TPP2	67	39
COc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450859403	EF	On-Demand	Anodyne	DRD4	21	40
COc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450859403	EF	On-Demand	Anodyne	TPP2	61	39
COc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450859404	EF	On-Demand	Anodyne	DRD4	21	40
COc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450859404	EF	On-Demand	Anodyne	TPP2	61	39
COc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450859405	EF	On-Demand	Anodyne	DRD4	21	40
COc1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450859405	EF	On-Demand	Anodyne	TPP2	61	39
COc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450859406	EF	On-Demand	Anodyne	DRD4	21	40
COc1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450859406	EF	On-Demand	Anodyne	TPP2	61	39
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450859413	GI	On-Demand	Anodyne	TIMP3	58	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450859413	GI	On-Demand	Anodyne	PLAU	41	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450859414	GI	On-Demand	Anodyne	TIMP3	58	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)c2nc3ccccc3nc2C2CC2)cc1	ZINC000450859414	GI	On-Demand	Anodyne	PLAU	41	34
Cc1cncc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]1	ZINC000450859421	CD	On-Demand	Anodyne	TPP2	66	39
Cc1cncc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]1	ZINC000450859422	CD	On-Demand	Anodyne	TPP2	66	39
Cc1cncc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]1	ZINC000450859423	CD	On-Demand	Anodyne	TPP2	66	39
Cc1cncc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]1	ZINC000450859424	CD	On-Demand	Anodyne	TPP2	66	39
Cc1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450859425	EG	On-Demand	Bother	TPP2	61	34
Cc1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450859426	EG	On-Demand	Bother	TPP2	61	34
Cc1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450859427	EG	On-Demand	Bother	TPP2	61	34
Cc1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450859428	EG	On-Demand	Bother	TPP2	61	34
Cc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c(C(C)C)n1	ZINC000450859433	EE	On-Demand	Anodyne	HCRTR1	44	43
Cc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c(C(C)C)n1	ZINC000450859433	EE	On-Demand	Anodyne	HCRTR2	28	43
Cc1ccc(C(=O)N2CCN(c3ncc(F)cn3)CC2)c(C(C)C)n1	ZINC000450859433	EE	On-Demand	Anodyne	SLC6A7	0	41
CC(=O)c1cccc(Cn2nnnc2CCCc2ccccc2)c1	ZINC000450859459	DG	On-Demand	Anodyne	PROTEASE	0	46
CC(=O)c1cccc(Cn2nnnc2CCCc2ccccc2)c1	ZINC000450859459	DG	On-Demand	Anodyne	DAGLA	30	41
COc1cccc(OCCC(=O)NC(C)(C)c2ccc(C)nc2)c1	ZINC000450859465	EG	On-Demand	Anodyne	MTNR1A	26	44
CC[C@H](Nc1cc(-c2ccccc2)nc2ncnn12)[C@H](O)CC	ZINC000450859477	DF	On-Demand	Anodyne	DHOD	0	41
CC[C@H](O)[C@@H](CC)Nc1cc(-c2ccccc2)nc2ncnn12	ZINC000450859478	DF	On-Demand	Anodyne	DHOD	0	41
CC[C@@H](O)[C@@H](CC)Nc1cc(-c2ccccc2)nc2ncnn12	ZINC000450859479	DF	On-Demand	Anodyne	DHOD	0	41
CC[C@H](O)[C@H](CC)Nc1cc(-c2ccccc2)nc2ncnn12	ZINC000450859480	DF	On-Demand	Anodyne	DHOD	0	41
CC[C@H](O)[C@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859487	FG	On-Demand	Anodyne	EGFR	23	40
CC[C@H](O)[C@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859487	FG	On-Demand	Anodyne	ERBB4	22	40
CC[C@H](O)[C@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859487	FG	On-Demand	Anodyne	CD38	70	39
CC[C@@H](O)[C@@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859488	FG	On-Demand	Anodyne	EGFR	23	40
CC[C@@H](O)[C@@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859488	FG	On-Demand	Anodyne	ERBB4	22	40
CC[C@@H](O)[C@@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859488	FG	On-Demand	Anodyne	CD38	70	39
CC[C@H](Nc1ncnc2ccc(I)cc12)[C@H](O)CC	ZINC000450859489	FG	On-Demand	Anodyne	EGFR	23	40
CC[C@H](Nc1ncnc2ccc(I)cc12)[C@H](O)CC	ZINC000450859489	FG	On-Demand	Anodyne	ERBB4	22	40
CC[C@H](Nc1ncnc2ccc(I)cc12)[C@H](O)CC	ZINC000450859489	FG	On-Demand	Anodyne	CD38	70	39
CC[C@H](C)N1CCN(c2nccc(C(F)F)n2)CC1	ZINC000450859490	CE	On-Demand	Anodyne	SORD	71	42
CC[C@@H](C)N1CCN(c2nccc(C(F)F)n2)CC1	ZINC000450859491	CE	On-Demand	Anodyne	SORD	71	42
CC[C@@H](C)N1CCN(c2ncccc2C(=O)NC)CC1	ZINC000450859500	CD	On-Demand	Anodyne	PRNP	42	36
CC[C@H](C)N1CCN(c2ncccc2C(=O)NC)CC1	ZINC000450859501	CD	On-Demand	Anodyne	PRNP	42	36
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCO[C@@H]1c1nccn1C	ZINC000450859643	FG	On-Demand	Anodyne	CCR2	28	41
COc1cccc([C@@H]2C[C@H]2Nc2ncccc2F)c1	ZINC000450859686	CG	On-Demand	Anodyne	KDM1A	17	40
OCC1(Cc2ccccc2)CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450859729	EG	On-Demand	Anodyne	NPFFR1	31	40
Cn1cc([C@@H]2CCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000450859759	FG	On-Demand	Bother	CACNA1C	48	33
Cn1cc([C@@H]2CCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000450859759	FG	On-Demand	Bother	CACNA1D	67	33
Cn1cc([C@@H]2CCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000450859759	FG	On-Demand	Bother	COLA	90	47
Cn1cc([C@@H]2CCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000450859759	FG	On-Demand	Bother	CPT1A	82	47
Cn1cc([C@H]2CCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000450859760	FG	On-Demand	Bother	CACNA1C	48	33
Cn1cc([C@H]2CCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000450859760	FG	On-Demand	Bother	CACNA1D	67	33
Cn1cc([C@H]2CCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000450859760	FG	On-Demand	Bother	COLA	90	47
Cn1cc([C@H]2CCCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000450859760	FG	On-Demand	Bother	CPT1A	82	47
C[C@@H]1CC(C)(C)C[C@](CO)(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450859779	GG	On-Demand	Bother	CACNA1C	44	35
C[C@@H]1CC(C)(C)C[C@](CO)(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450859779	GG	On-Demand	Bother	CACNA1D	75	33
C[C@H]1CC(C)(C)C[C@](CO)(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450859781	GG	On-Demand	Bother	CACNA1C	44	35
C[C@H]1CC(C)(C)C[C@](CO)(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450859781	GG	On-Demand	Bother	CACNA1D	75	33
C[C@@H]1CC(C)(C)C[C@@](CO)(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450859784	GG	On-Demand	Bother	CACNA1C	44	35
C[C@@H]1CC(C)(C)C[C@@](CO)(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450859784	GG	On-Demand	Bother	CACNA1D	75	33
C[C@H]1CC(C)(C)C[C@@](CO)(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450859786	GG	On-Demand	Bother	CACNA1C	44	35
C[C@H]1CC(C)(C)C[C@@](CO)(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450859786	GG	On-Demand	Bother	CACNA1D	75	33
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cc3S(N)(=O)=O)C2)c1	ZINC000450859814	GF	On-Demand	Bother	TBXA2R	15	42
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cc3S(N)(=O)=O)C2)c1	ZINC000450859814	GF	On-Demand	Bother	CACNA1D	64	34
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])cc3S(N)(=O)=O)C2)c1	ZINC000450859814	GF	On-Demand	Bother	CA14	19	43
CCc1cc(N[C@H]2COCC2(C)C)n2ncnc2n1	ZINC000450859819	CD	On-Demand	Anodyne	DHOD	0	46
CCc1cc(N[C@@H]2COCC2(C)C)n2ncnc2n1	ZINC000450859820	CD	On-Demand	Anodyne	DHOD	0	46
CCC(CC)Oc1ccc(C(=O)N[C@H]2CCCO[C@@H]2c2ccncc2)cc1	ZINC000450859832	FI	On-Demand	Anodyne	SSTR3	27	43
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)c2cccnc2O1	ZINC000450859841	FI	On-Demand	Anodyne	RBP4	68	36
COc1ccc(CNC(=O)CCN2CCc3cccc(C)c3C2)c(OC)c1	ZINC000450859842	FG	On-Demand	Anodyne	DRD4	46	36
COc1ccc(CNC(=O)CCN2CCc3cccc(C)c3C2)c(OC)c1	ZINC000450859842	FG	On-Demand	Anodyne	DRD3	15	41
COc1ccc(CNC(=O)CCN2CCc3cccc(C)c3C2)c(OC)c1	ZINC000450859842	FG	On-Demand	Anodyne	CYSLTR1	50	34
COc1ccc(CNC(=O)CCN2CCc3cccc(C)c3C2)c(OC)c1	ZINC000450859842	FG	On-Demand	Anodyne	HTR7	32	41
COc1ccc(CNC(=O)CCN2CCc3cccc(C)c3C2)c(OC)c1	ZINC000450859842	FG	On-Demand	Anodyne	ABCB1B	54	35
COc1ccc(CNC(=O)CCN2CCc3cccc(C)c3C2)c(OC)c1	ZINC000450859842	FG	On-Demand	Anodyne	MTNR1A	45	39
CSc1ccc2ncnc(N3CC[C@@H](O)CC(C)(C)C3)c2c1	ZINC000450859847	DG	On-Demand	Anodyne	PDE3A	44	34
CSc1ccc2ncnc(N3CC[C@@H](O)CC(C)(C)C3)c2c1	ZINC000450859847	DG	On-Demand	Anodyne	PDE3B	66	34
CSc1ccc2ncnc(N3CC[C@@H](O)CC(C)(C)C3)c2c1	ZINC000450859847	DG	On-Demand	Anodyne	SIRT3	50	31
CSc1ccc2ncnc(N3CC[C@@H](O)CC(C)(C)C3)c2c1	ZINC000450859847	DG	On-Demand	Anodyne	SIRT1	50	31
CSc1ccc2ncnc(N3CC[C@@H](O)CC(C)(C)C3)c2c1	ZINC000450859847	DG	On-Demand	Anodyne	HTT	0	41
CSc1ccc2ncnc(N3CC[C@H](O)CC(C)(C)C3)c2c1	ZINC000450859848	DG	On-Demand	Anodyne	PDE3A	44	34
CSc1ccc2ncnc(N3CC[C@H](O)CC(C)(C)C3)c2c1	ZINC000450859848	DG	On-Demand	Anodyne	PDE3B	66	34
CSc1ccc2ncnc(N3CC[C@H](O)CC(C)(C)C3)c2c1	ZINC000450859848	DG	On-Demand	Anodyne	SIRT3	50	31
CSc1ccc2ncnc(N3CC[C@H](O)CC(C)(C)C3)c2c1	ZINC000450859848	DG	On-Demand	Anodyne	SIRT1	50	31
CSc1ccc2ncnc(N3CC[C@H](O)CC(C)(C)C3)c2c1	ZINC000450859848	DG	On-Demand	Anodyne	HTT	0	41
CC[C@H](O)[C@@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859858	FG	On-Demand	Anodyne	EGFR	23	40
CC[C@H](O)[C@@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859858	FG	On-Demand	Anodyne	ERBB4	22	40
CC[C@H](O)[C@@H](CC)Nc1ncnc2ccc(I)cc12	ZINC000450859858	FG	On-Demand	Anodyne	CD38	70	39
Cc1ccn2ncc(C(=O)NC(C)(C)c3ccc(C)nc3)c2c1	ZINC000450859868	DG	On-Demand	Anodyne	EPHB3	35	50
CCc1cccc(C(=O)Nc2ccccc2CSC)n1	ZINC000450859871	CH	On-Demand	Anodyne	PLA2G7	30	43
CN(CCCNC(=O)C1CCC1)CCCC(=O)c1ccc(F)cc1	ZINC000450859909	EG	On-Demand	Anodyne	TBK1	62	38
CC(=O)c1ccc(CSc2nnc(CCCc3ccccc3)o2)cc1	ZINC000450859920	FJ	On-Demand	Anodyne	GSK3A	34	44
CC(=O)c1ccc(CSc2nnc(CCCc3ccccc3)o2)cc1	ZINC000450859920	FJ	On-Demand	Anodyne	FAAH	47	37
CC(=O)c1ccc(CSc2nnc(CCCc3ccccc3)o2)cc1	ZINC000450859920	FJ	On-Demand	Anodyne	CES1	49	34
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	HTR1A	26	65
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	DRD2	50	78
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	DRD1	28	52
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	DRD4	30	58
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	ADRA1D	25	41
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	HTR2A	55	58
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	HTR2C	29	65
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	ADRA1A	29	41
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	HRH1	19	58
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	ADRA1B	25	49
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	DRD3	20	58
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	ERG2	23	49
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	HTR1F	31	41
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	HTR7	34	49
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	SIGMAR1	28	60
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	PRCP	34	56
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	CCR3	35	41
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	SLC18A3	31	53
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	HTR3B	0	49
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	MCHR1	33	60
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	48
O=C(CCCN1CCC(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000450859922	EI	On-Demand	Anodyne	CYP2J2	61	43
COc1cccc([C@@H]2C[C@@H](Nc3ccc([N+](=O)[O-])c(C(C)=O)c3)C2)c1	ZINC000450859927	EI	On-Demand	Bother	TAAR1	26	42
O=C(Cc1scnc1-c1ccccc1)N1CCN(c2ncc(F)cn2)CC1	ZINC000450859930	GF	On-Demand	Anodyne	SLC6A7	0	40
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc(-c2ccncc2)[nH]1	ZINC000450859936	FG	On-Demand	Anodyne	TPP2	55	36
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc(-c2ccncc2)[nH]1	ZINC000450859937	FG	On-Demand	Anodyne	TPP2	55	36
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc(-c2ccncc2)[nH]1	ZINC000450859938	FG	On-Demand	Anodyne	TPP2	55	36
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc(-c2ccncc2)[nH]1	ZINC000450859939	FG	On-Demand	Anodyne	TPP2	55	36
COc1cc(CC(=O)N[C@](C)(CO)C2CCCCC2)ccc1Cl	ZINC000450859940	EG	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N[C@](C)(CO)C2CCCCC2)ccc1Cl	ZINC000450859940	EG	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)N[C@@](C)(CO)C2CCCCC2)ccc1Cl	ZINC000450859941	EG	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)N[C@@](C)(CO)C2CCCCC2)ccc1Cl	ZINC000450859941	EG	On-Demand	Anodyne	CAN2	0	40
Cc1ccc(C(C)(C)NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)cn1	ZINC000450859961	GG	On-Demand	Mild	AR	18	41
Cc1ccc(C(C)(C)NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)cn1	ZINC000450859962	GG	On-Demand	Mild	AR	18	41
CO[C@H](C)c1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450859964	EE	On-Demand	Anodyne	TPP2	54	36
CO[C@H](C)c1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450859965	EE	On-Demand	Anodyne	TPP2	54	36
CO[C@H](C)c1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450859966	EE	On-Demand	Anodyne	TPP2	54	36
CO[C@H](C)c1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450859967	EE	On-Demand	Anodyne	TPP2	54	36
CCc1cc(CCCN2CCN(c3ccc(C#N)cc3Cl)CC2)on1	ZINC000450859974	FH	On-Demand	Mild	DRD3	17	43
C[C@@H](Nc1ccnc(C2CC2)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450859975	DF	On-Demand	Anodyne	TPP2	67	39
C[C@H](Nc1ccnc(C2CC2)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450859976	DF	On-Demand	Anodyne	TPP2	67	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccnc(C2CC2)n1	ZINC000450859977	DF	On-Demand	Anodyne	TPP2	67	39
C[C@H](Nc1ccnc(C2CC2)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450859978	DF	On-Demand	Anodyne	TPP2	67	39
CC(C)c1n[nH]c(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450859985	EF	On-Demand	Anodyne	TPP2	55	36
CC(C)c1n[nH]c(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450859986	EF	On-Demand	Anodyne	TPP2	55	36
CC(C)c1n[nH]c(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450859987	EF	On-Demand	Anodyne	TPP2	55	36
CC(C)c1n[nH]c(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450859988	EF	On-Demand	Anodyne	TPP2	55	36
CC[C@@H](C)N1CCN(c2nn3c(C)nnc3c3ccccc23)CC1	ZINC000450859992	DF	On-Demand	Anodyne	CREBBP	44	35
CC[C@@H](C)N1CCN(c2nn3c(C)nnc3c3ccccc23)CC1	ZINC000450859992	DF	On-Demand	Anodyne	BRD9	56	35
CC[C@H](C)N1CCN(c2nn3c(C)nnc3c3ccccc23)CC1	ZINC000450859993	DF	On-Demand	Anodyne	CREBBP	44	35
CC[C@H](C)N1CCN(c2nn3c(C)nnc3c3ccccc23)CC1	ZINC000450859993	DF	On-Demand	Anodyne	BRD9	56	35
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450860009	EH	On-Demand	Anodyne	PRNP	48	32
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450860009	EH	On-Demand	Anodyne	P4HTM	0	48
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450860010	EH	On-Demand	Anodyne	PRNP	48	32
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450860010	EH	On-Demand	Anodyne	P4HTM	0	48
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450860011	EH	On-Demand	Anodyne	PRNP	48	32
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450860011	EH	On-Demand	Anodyne	P4HTM	0	48
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450860012	EH	On-Demand	Anodyne	PRNP	48	32
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450860012	EH	On-Demand	Anodyne	P4HTM	0	48
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860024	GE	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860024	GE	On-Demand	Bother	EEF1A1	0	40
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860024	GE	On-Demand	Bother	EEF1A2	0	40
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860025	GE	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860025	GE	On-Demand	Bother	EEF1A1	0	40
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860025	GE	On-Demand	Bother	EEF1A2	0	40
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860026	GE	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860026	GE	On-Demand	Bother	EEF1A1	0	40
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860026	GE	On-Demand	Bother	EEF1A2	0	40
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860027	GE	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860027	GE	On-Demand	Bother	EEF1A1	0	40
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450860027	GE	On-Demand	Bother	EEF1A2	0	40
CC[C@@H](C)N1CCN(c2nc3ccc(F)cc3n2C)CC1	ZINC000450860038	CF	On-Demand	Anodyne	HRH1	0	42
CC[C@H](C)N1CCN(c2nc3ccc(F)cc3n2C)CC1	ZINC000450860039	CF	On-Demand	Anodyne	HRH1	0	42
CCOC(=O)c1ccc(CN2CC[C@H](CC(F)(F)F)C2)nc1	ZINC000450860051	DG	On-Demand	Anodyne	SSTR5	43	37
CCOC(=O)c1ccc(CN2CC[C@@H](CC(F)(F)F)C2)nc1	ZINC000450860052	DG	On-Demand	Anodyne	SSTR5	43	37
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860064	EG	On-Demand	Anodyne	PTGER3	49	36
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860064	EG	On-Demand	Anodyne	ACE2	28	44
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860064	EG	On-Demand	Anodyne	PHES	0	40
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860064	EG	On-Demand	Anodyne	FFAR1	41	40
CC(=O)[C@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860064	EG	On-Demand	Anodyne	PDS	77	38
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860065	EG	On-Demand	Anodyne	PTGER3	49	36
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860065	EG	On-Demand	Anodyne	ACE2	28	44
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860065	EG	On-Demand	Anodyne	PHES	0	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860065	EG	On-Demand	Anodyne	FFAR1	41	40
CC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860065	EG	On-Demand	Anodyne	PDS	77	38
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860066	EG	On-Demand	Anodyne	PTGER3	49	36
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860066	EG	On-Demand	Anodyne	ACE2	28	44
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860066	EG	On-Demand	Anodyne	PHES	0	40
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860066	EG	On-Demand	Anodyne	FFAR1	41	40
CC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860066	EG	On-Demand	Anodyne	PDS	77	38
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860067	EG	On-Demand	Anodyne	PTGER3	49	36
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860067	EG	On-Demand	Anodyne	ACE2	28	44
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860067	EG	On-Demand	Anodyne	PHES	0	40
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860067	EG	On-Demand	Anodyne	FFAR1	41	40
CC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000450860067	EG	On-Demand	Anodyne	PDS	77	38
CC[C@@H](C)N1CCN(c2ccc(S(=O)(=O)NC)cc2F)CC1	ZINC000450860086	ED	On-Demand	Anodyne	NPY2R	68	39
CC[C@@H](C)N1CCN(c2ccc(S(=O)(=O)NC)cc2F)CC1	ZINC000450860086	ED	On-Demand	Anodyne	SLC6A9	22	46
CC[C@H](C)N1CCN(c2ccc(S(=O)(=O)NC)cc2F)CC1	ZINC000450860087	ED	On-Demand	Anodyne	NPY2R	68	39
CC[C@H](C)N1CCN(c2ccc(S(=O)(=O)NC)cc2F)CC1	ZINC000450860087	ED	On-Demand	Anodyne	SLC6A9	22	46
C=CCNC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)nc1	ZINC000450860095	DF	On-Demand	Mild	DRD4	41	31
C=CCNC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)nc1	ZINC000450860095	DF	On-Demand	Mild	KDM1A	15	40
Clc1ccc2c(N[C@@H]3CCO[C@@H](c4ccccn4)C3)ccnc2c1	ZINC000450860096	EJ	On-Demand	Anodyne	HRP1_PLAFA	119	37
Clc1ccc2c(N[C@@H]3CCO[C@@H](c4ccccn4)C3)ccnc2c1	ZINC000450860096	EJ	On-Demand	Anodyne	HNMT	52	36
CSCc1ccccc1NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000450860116	DI	On-Demand	Anodyne	G2YM83_BOTF4	62	38
CSCc1ccccc1NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450860118	DI	On-Demand	Anodyne	G2YM83_BOTF4	62	38
COCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450860123	ED	On-Demand	Anodyne	DRD4	23	40
COCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450860123	ED	On-Demand	Anodyne	TPP2	57	37
COCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450860126	ED	On-Demand	Anodyne	DRD4	23	40
COCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450860126	ED	On-Demand	Anodyne	TPP2	57	37
COCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450860129	ED	On-Demand	Anodyne	DRD4	23	40
COCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450860129	ED	On-Demand	Anodyne	TPP2	57	37
COCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450860133	ED	On-Demand	Anodyne	DRD4	23	40
COCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450860133	ED	On-Demand	Anodyne	TPP2	57	37
COc1ccc(CNC(=O)CCN(C)[C@@H]2CC[C@@H](C)C2)c(OC)c1	ZINC000450860159	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN(C)[C@@H]2CC[C@@H](C)C2)c(OC)c1	ZINC000450860159	EF	On-Demand	Anodyne	MTNR1A	48	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCO[C@@H]1c1cnn(C)c1	ZINC000450860160	FG	On-Demand	Anodyne	CCR2	48	42
COc1ccc(CNC(=O)CCN(C)[C@@H]2CC[C@H](C)C2)c(OC)c1	ZINC000450860161	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN(C)[C@@H]2CC[C@H](C)C2)c(OC)c1	ZINC000450860161	EF	On-Demand	Anodyne	MTNR1A	48	37
COc1ccc(CNC(=O)CCN(C)[C@H]2CC[C@H](C)C2)c(OC)c1	ZINC000450860163	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN(C)[C@H]2CC[C@H](C)C2)c(OC)c1	ZINC000450860163	EF	On-Demand	Anodyne	MTNR1A	48	37
COc1ccc(CNC(=O)CCN(C)[C@H]2CC[C@@H](C)C2)c(OC)c1	ZINC000450860164	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
COc1ccc(CNC(=O)CCN(C)[C@H]2CC[C@@H](C)C2)c(OC)c1	ZINC000450860164	EF	On-Demand	Anodyne	MTNR1A	48	37
c1ccc(CCn2ccc(CN3CCC(c4ccncc4)CC3)n2)cc1	ZINC000450860178	EH	On-Demand	Anodyne	DRD2	0	49
c1ccc(CCn2ccc(CN3CCC(c4ccncc4)CC3)n2)cc1	ZINC000450860178	EH	On-Demand	Anodyne	DRD4	25	49
c1ccc(CCn2ccc(CN3CCC(c4ccncc4)CC3)n2)cc1	ZINC000450860178	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
c1ccc(CCn2ccc(CN3CCC(c4ccncc4)CC3)n2)cc1	ZINC000450860178	EH	On-Demand	Anodyne	SIGMAR1	50	48
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450860190	EF	On-Demand	Bother	CACNA1D	81	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	NR3C2	16	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	MME	53	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	TACR2	26	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	TIMP3	87	41
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	CAPNS1	49	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	NPY5R	20	40
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	CAPN2	42	34
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	PLAU	42	35
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860209	GI	On-Demand	Anodyne	PSMB8	63	38
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	NR3C2	16	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	MME	53	42
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	TACR2	26	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	TIMP3	87	41
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	CAPNS1	49	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	NPY5R	20	40
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	CAPN2	42	34
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	PLAU	42	35
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1	ZINC000450860210	GI	On-Demand	Anodyne	PSMB8	63	38
CC1(C)C[C@@H](O)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450860213	FI	On-Demand	Anodyne	ADRB2	15	51
CC1(C)C[C@@H](O)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450860213	FI	On-Demand	Anodyne	ADRB3	34	53
CC1(C)C[C@H](O)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450860216	FI	On-Demand	Anodyne	ADRB2	15	51
CC1(C)C[C@H](O)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450860216	FI	On-Demand	Anodyne	ADRB3	34	53
CCCOc1ccc(C(=O)NC(C)(C)c2ccc(C)nc2)c(OC)c1	ZINC000450860265	EH	On-Demand	Anodyne	LUCI_LUCLA	16	43
CCOC(=O)c1csc(C2CCN(CC/C=C\c3ccccc3)CC2)n1	ZINC000450860268	FJ	On-Demand	Anodyne	CACNA1B	40	36
CCOC(=O)c1csc(C2CCN(CC/C=C/c3ccccc3)CC2)n1	ZINC000450860270	FJ	On-Demand	Anodyne	CACNA1B	40	36
COc1ccccc1-c1noc(C2CCN(Cc3cnn[nH]3)CC2)n1	ZINC000450860279	EE	On-Demand	Anodyne	LUCI_PHOPE	28	40
COc1ccccc1-c1noc(C2CCN(Cc3cnn[nH]3)CC2)n1	ZINC000450860279	EE	On-Demand	Anodyne	SMO	47	41
COc1ccccc1-c1noc(C2CCN(Cc3cnn[nH]3)CC2)n1	ZINC000450860279	EE	On-Demand	Anodyne	ETHR	48	35
CC1(C)C[C@H](O)CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450860298	GH	On-Demand	Anodyne	SCD1	18	40
CC1(C)C[C@H](O)CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450860298	GH	On-Demand	Anodyne	SCD	15	40
CC1(C)C[C@@H](O)CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450860300	GH	On-Demand	Anodyne	SCD1	18	40
CC1(C)C[C@@H](O)CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000450860300	GH	On-Demand	Anodyne	SCD	15	40
COc1cccc([C@@H]2C[C@@H](Nc3ccccn3)C2)c1	ZINC000450860303	CG	On-Demand	Anodyne	EBP	19	52
CCC[C@@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450860305	CG	On-Demand	Anodyne	OPRL1	0	41
CCC[C@@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450860305	CG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
CCC[C@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450860306	CG	On-Demand	Anodyne	OPRL1	0	41
CCC[C@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450860306	CG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	DRD2	23	41
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	DRD4	56	41
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	ACHE	27	46
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	LTA4H	22	41
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	HRH3	27	49
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	SIGMAR1	40	41
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	SSTR5	44	36
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	CCR3	31	41
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	CXCR3	34	43
CC(=O)c1ccc(CN2CCC(c3ncccc3Cl)CC2)cc1	ZINC000450860311	EI	On-Demand	Anodyne	MCHR1	35	41
CS(=O)(=O)N[C@H]1CCCC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450860319	ED	On-Demand	Anodyne	CAPN2	44	31
CS(=O)(=O)N[C@H]1CCCC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450860323	ED	On-Demand	Anodyne	CAPN2	44	31
COCCOC[C@@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450860330	ED	On-Demand	Anodyne	HSP90AB1	38	40
COCCOC[C@H](O)CN1CCC(c2ncccc2Cl)CC1	ZINC000450860334	ED	On-Demand	Anodyne	HSP90AB1	38	40
COC(=O)c1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450860343	EE	On-Demand	Anodyne	TPP2	66	37
COC(=O)c1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450860345	EE	On-Demand	Anodyne	TPP2	66	37
COC(=O)c1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450860348	EE	On-Demand	Anodyne	TPP2	66	37
COC(=O)c1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450860349	EE	On-Demand	Anodyne	TPP2	66	37
COc1cc2c(N[C@@H]3C[C@H](OC(C)(C)C)[C@@H]3n3cccn3)ncnc2cc1F	ZINC000450860351	GH	On-Demand	Anodyne	EGFR	29	43
COc1cc2c(N[C@@H]3C[C@H](OC(C)(C)C)[C@@H]3n3cccn3)ncnc2cc1F	ZINC000450860351	GH	On-Demand	Anodyne	PDE3B	48	31
COc1cc2c(N[C@@H]3C[C@@H](OC(C)(C)C)[C@@H]3n3cccn3)ncnc2cc1F	ZINC000450860356	GH	On-Demand	Anodyne	EGFR	29	43
COc1cc2c(N[C@@H]3C[C@@H](OC(C)(C)C)[C@@H]3n3cccn3)ncnc2cc1F	ZINC000450860356	GH	On-Demand	Anodyne	PDE3B	48	31
COc1cc2c(N[C@@H]3C[C@H](OC(C)(C)C)[C@H]3n3cccn3)ncnc2cc1F	ZINC000450860359	GH	On-Demand	Anodyne	EGFR	29	43
COc1cc2c(N[C@@H]3C[C@H](OC(C)(C)C)[C@H]3n3cccn3)ncnc2cc1F	ZINC000450860359	GH	On-Demand	Anodyne	PDE3B	48	31
COc1cc2c(N[C@@H]3C[C@@H](OC(C)(C)C)[C@H]3n3cccn3)ncnc2cc1F	ZINC000450860362	GH	On-Demand	Anodyne	EGFR	29	43
COc1cc2c(N[C@@H]3C[C@@H](OC(C)(C)C)[C@H]3n3cccn3)ncnc2cc1F	ZINC000450860362	GH	On-Demand	Anodyne	PDE3B	48	31
C[C@H](c1ccccc1)[C@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450860364	DE	On-Demand	Anodyne	AMY2	44	30
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450860367	DE	On-Demand	Anodyne	AMY2	44	30
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450860370	DE	On-Demand	Anodyne	AMY2	44	30
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCCNC(=O)C1CCC1	ZINC000450860374	DE	On-Demand	Anodyne	AMY2	44	30
COc1ccccc1-c1noc(C2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450860377	EF	On-Demand	Anodyne	PRCP	22	41
COc1ccccc1-c1noc(C2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450860377	EF	On-Demand	Anodyne	ALK	25	41
COc1ccccc1-c1noc(C2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450860377	EF	On-Demand	Anodyne	CARM1	57	38
COc1ccccc1-c1noc(C2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450860377	EF	On-Demand	Anodyne	LUCI_PHOPE	30	43
COc1ccccc1-c1noc(C2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450860377	EF	On-Demand	Anodyne	SMO	59	47
COc1ccccc1-c1noc(C2CCN(CC[C@@H](C)O)CC2)n1	ZINC000450860377	EF	On-Demand	Anodyne	ETHR	55	43
CC(C)c1nccc(N2CC3(CCC3)[C@@H]2c2ccco2)n1	ZINC000450860380	CH	On-Demand	Anodyne	SORD	50	30
COc1ccccc1-c1noc(C2CCN(CC[C@H](C)O)CC2)n1	ZINC000450860381	EF	On-Demand	Anodyne	PRCP	22	41
COc1ccccc1-c1noc(C2CCN(CC[C@H](C)O)CC2)n1	ZINC000450860381	EF	On-Demand	Anodyne	ALK	25	41
COc1ccccc1-c1noc(C2CCN(CC[C@H](C)O)CC2)n1	ZINC000450860381	EF	On-Demand	Anodyne	CARM1	57	38
COc1ccccc1-c1noc(C2CCN(CC[C@H](C)O)CC2)n1	ZINC000450860381	EF	On-Demand	Anodyne	LUCI_PHOPE	30	43
COc1ccccc1-c1noc(C2CCN(CC[C@H](C)O)CC2)n1	ZINC000450860381	EF	On-Demand	Anodyne	SMO	59	47
COc1ccccc1-c1noc(C2CCN(CC[C@H](C)O)CC2)n1	ZINC000450860381	EF	On-Demand	Anodyne	ETHR	55	43
CC(C)c1nccc(N2CC3(CCC3)[C@H]2c2ccco2)n1	ZINC000450860384	CH	On-Demand	Anodyne	SORD	50	30
CSCc1ccccc1NC(=O)c1cc2n(n1)CCCC2	ZINC000450860393	DG	On-Demand	Anodyne	KCNQ2	69	34
CCS(=O)(=O)c1ccc(CN2CCCC[C@H](S(C)(=O)=O)C2)cc1	ZINC000450860415	FD	On-Demand	Anodyne	HRH3	18	42
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H](S(C)(=O)=O)C2)cc1	ZINC000450860416	FD	On-Demand	Anodyne	HRH3	18	42
Cc1ccc(C(C)(C)NC(=O)c2cn3nccc3nc2C)cn1	ZINC000450860427	DE	On-Demand	Anodyne	DDR1	46	34
C[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860436	GF	On-Demand	Anodyne	TPP2	53	34
C[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860436	GF	On-Demand	Anodyne	DHOD	0	44
C[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860438	GF	On-Demand	Anodyne	TPP2	53	34
C[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860438	GF	On-Demand	Anodyne	DHOD	0	44
C[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450860441	GF	On-Demand	Anodyne	TPP2	53	34
C[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450860441	GF	On-Demand	Anodyne	DHOD	0	44
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450860444	GF	On-Demand	Anodyne	TPP2	53	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450860444	GF	On-Demand	Anodyne	DHOD	0	44
C[C@@H](Nc1ccc(C#N)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860446	DE	On-Demand	Mild	TPP2	63	36
C[C@H](Nc1ccc(C#N)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860447	DE	On-Demand	Mild	TPP2	63	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C#N)cn1	ZINC000450860449	DE	On-Demand	Mild	TPP2	63	36
C[C@H](Nc1ccc(C#N)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450860451	DE	On-Demand	Mild	TPP2	63	36
COC(=O)c1csc(CN2CCC(CO)(Cc3ccccc3)CC2)n1	ZINC000450860467	FF	On-Demand	Anodyne	SIGMAR1	26	42
COC(=O)c1csc(CN2CCC(CO)(Cc3ccccc3)CC2)n1	ZINC000450860467	FF	On-Demand	Anodyne	NPFFR1	57	42
C[C@@H](O)CCN1CCCC[C@H]1c1cccc(Cl)c1	ZINC000450860480	CH	On-Demand	Anodyne	SLC6A1	21	43
C[C@@H](O)CCN1CCCC[C@H]1c1cccc(Cl)c1	ZINC000450860480	CH	On-Demand	Anodyne	ADAM17	30	43
C[C@@H](O)CCN1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000450860481	CH	On-Demand	Anodyne	SLC6A1	21	43
C[C@@H](O)CCN1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000450860481	CH	On-Demand	Anodyne	ADAM17	30	43
C[C@H](O)CCN1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000450860482	CH	On-Demand	Anodyne	SLC6A1	21	43
C[C@H](O)CCN1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000450860482	CH	On-Demand	Anodyne	ADAM17	30	43
C[C@H](O)CCN1CCCC[C@H]1c1cccc(Cl)c1	ZINC000450860483	CH	On-Demand	Anodyne	SLC6A1	21	43
C[C@H](O)CCN1CCCC[C@H]1c1cccc(Cl)c1	ZINC000450860483	CH	On-Demand	Anodyne	ADAM17	30	43
COc1ccc(CNC(=O)CCN2C[C@H](O)[C@@H](O)C2)c(OC)c1	ZINC000450860497	DB	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2C[C@H](O)[C@@H](O)C2)c(OC)c1	ZINC000450860497	DB	On-Demand	Anodyne	HTR7	29	42
COc1ccc(CNC(=O)CCN2C[C@H](O)[C@@H](O)C2)c(OC)c1	ZINC000450860497	DB	On-Demand	Anodyne	MTNR1A	66	38
COc1ccc(CNC(=O)CCN2C[C@H](O)[C@@H](O)C2)c(OC)c1	ZINC000450860497	DB	On-Demand	Anodyne	MTNR1B	55	41
COc1ccc(CNC(=O)CCN2C[C@H](O)[C@H](O)C2)c(OC)c1	ZINC000450860498	DB	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2C[C@H](O)[C@H](O)C2)c(OC)c1	ZINC000450860498	DB	On-Demand	Anodyne	HTR7	29	42
COc1ccc(CNC(=O)CCN2C[C@H](O)[C@H](O)C2)c(OC)c1	ZINC000450860498	DB	On-Demand	Anodyne	MTNR1A	66	38
COc1ccc(CNC(=O)CCN2C[C@H](O)[C@H](O)C2)c(OC)c1	ZINC000450860498	DB	On-Demand	Anodyne	MTNR1B	55	41
COc1ccc(CNC(=O)CCN2C[C@@H](O)[C@H](O)C2)c(OC)c1	ZINC000450860499	DB	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2C[C@@H](O)[C@H](O)C2)c(OC)c1	ZINC000450860499	DB	On-Demand	Anodyne	HTR7	29	42
COc1ccc(CNC(=O)CCN2C[C@@H](O)[C@H](O)C2)c(OC)c1	ZINC000450860499	DB	On-Demand	Anodyne	MTNR1A	66	38
COc1ccc(CNC(=O)CCN2C[C@@H](O)[C@H](O)C2)c(OC)c1	ZINC000450860499	DB	On-Demand	Anodyne	MTNR1B	55	41
CC[C@@H](C)N1CCN(c2cc(Br)ccn2)CC1	ZINC000450860505	CF	On-Demand	Anodyne	SORD	47	38
CC[C@H](C)N1CCN(c2cc(Br)ccn2)CC1	ZINC000450860506	CF	On-Demand	Anodyne	SORD	47	38
CC[C@H](CC(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450860508	DI	On-Demand	Anodyne	CAPN1	18	40
CC[C@H](CC(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450860508	DI	On-Demand	Anodyne	CAPN2	18	40
CC[C@@H](CC(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450860509	DI	On-Demand	Anodyne	CAPN1	18	40
CC[C@@H](CC(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450860509	DI	On-Demand	Anodyne	CAPN2	18	40
CO[C@H](C1CC1)[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1	ZINC000450860516	EG	On-Demand	Bother	L3MBTL1	0	42
CO[C@H](C1CC1)[C@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1	ZINC000450860517	EG	On-Demand	Bother	L3MBTL1	0	42
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1	ZINC000450860518	EG	On-Demand	Bother	L3MBTL1	0	42
CO[C@@H](C1CC1)[C@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1	ZINC000450860519	EG	On-Demand	Bother	L3MBTL1	0	42
CC1(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)CCC(=O)CC1	ZINC000450860533	GH	On-Demand	Anodyne	PRSS2	45	31
CCOc1cccc(N2CCN([C@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000450860540	DF	On-Demand	Bother	HTR1A	25	41
CCOc1cccc(N2CCN([C@@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000450860541	DF	On-Demand	Bother	HTR1A	25	41
CO[C@H](CSCC(=O)C(C)(C)C)Cc1ccccc1	ZINC000450860551	CH	On-Demand	Anodyne	CYSP_TRYCR	49	40
CO[C@H](CSCC(=O)C(C)(C)C)Cc1ccccc1	ZINC000450860551	CH	On-Demand	Anodyne	BLAIMP-1	0	40
CO[C@@H](CSCC(=O)C(C)(C)C)Cc1ccccc1	ZINC000450860552	CH	On-Demand	Anodyne	CYSP_TRYCR	49	40
CO[C@@H](CSCC(=O)C(C)(C)C)Cc1ccccc1	ZINC000450860552	CH	On-Demand	Anodyne	BLAIMP-1	0	40
COc1cc2c(N[C@@H](C)[C@@H](OC)C3CC3)ncnc2cc1F	ZINC000450860553	DG	On-Demand	Anodyne	EGFR	32	43
COc1cc2c(N[C@@H](C)[C@@H](OC)C3CC3)ncnc2cc1F	ZINC000450860553	DG	On-Demand	Anodyne	FLT1	24	41
COc1cc2c(N[C@@H](C)[C@@H](OC)C3CC3)ncnc2cc1F	ZINC000450860553	DG	On-Demand	Anodyne	EPHA2	44	35
COc1cc2c(N[C@H](C)[C@H](OC)C3CC3)ncnc2cc1F	ZINC000450860554	DG	On-Demand	Anodyne	EGFR	32	43
COc1cc2c(N[C@H](C)[C@H](OC)C3CC3)ncnc2cc1F	ZINC000450860554	DG	On-Demand	Anodyne	FLT1	24	41
COc1cc2c(N[C@H](C)[C@H](OC)C3CC3)ncnc2cc1F	ZINC000450860554	DG	On-Demand	Anodyne	EPHA2	44	35
COc1cc2c(N[C@H](C)[C@@H](OC)C3CC3)ncnc2cc1F	ZINC000450860555	DG	On-Demand	Anodyne	EGFR	32	43
COc1cc2c(N[C@H](C)[C@@H](OC)C3CC3)ncnc2cc1F	ZINC000450860555	DG	On-Demand	Anodyne	FLT1	24	41
COc1cc2c(N[C@H](C)[C@@H](OC)C3CC3)ncnc2cc1F	ZINC000450860555	DG	On-Demand	Anodyne	EPHA2	44	35
COc1cc2c(N[C@@H](C)[C@H](OC)C3CC3)ncnc2cc1F	ZINC000450860556	DG	On-Demand	Anodyne	EGFR	32	43
COc1cc2c(N[C@@H](C)[C@H](OC)C3CC3)ncnc2cc1F	ZINC000450860556	DG	On-Demand	Anodyne	FLT1	24	41
COc1cc2c(N[C@@H](C)[C@H](OC)C3CC3)ncnc2cc1F	ZINC000450860556	DG	On-Demand	Anodyne	EPHA2	44	35
CO[C@H](C1CC1)[C@@H](C)Nc1cc(NCC2CC2)ncn1	ZINC000450860573	CF	On-Demand	Anodyne	GPR39	0	42
CO[C@H](C1CC1)[C@H](C)Nc1cc(NCC2CC2)ncn1	ZINC000450860574	CF	On-Demand	Anodyne	GPR39	0	42
CO[C@@H](C1CC1)[C@@H](C)Nc1cc(NCC2CC2)ncn1	ZINC000450860575	CF	On-Demand	Anodyne	GPR39	0	42
CO[C@@H](C1CC1)[C@H](C)Nc1cc(NCC2CC2)ncn1	ZINC000450860576	CF	On-Demand	Anodyne	GPR39	0	42
COC(=O)c1cn(C2CCN(C(=O)c3c(C)cccc3Cl)CC2)nn1	ZINC000450860581	FF	On-Demand	Anodyne	CCR5	24	44
COC(=O)c1cn(C2CCN(C(=O)c3c(C)cccc3Cl)CC2)nn1	ZINC000450860581	FF	On-Demand	Anodyne	L3MBTL3	49	33
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450860596	FH	On-Demand	Anodyne	HTR1A	44	36
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450860596	FH	On-Demand	Anodyne	DRD2	46	44
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450860596	FH	On-Demand	Anodyne	DRD1	0	41
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450860596	FH	On-Demand	Anodyne	HTR7	54	38
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450860596	FH	On-Demand	Anodyne	PRCP	27	43
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450860596	FH	On-Demand	Anodyne	CYP2J2	49	35
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450860596	FH	On-Demand	Anodyne	SMO	58	46
CCC(=O)CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450860596	FH	On-Demand	Anodyne	ETHR	69	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](O)CC(C)(C)C3)nc2)cc1	ZINC000450860638	FH	On-Demand	Anodyne	PRNP	60	39
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](O)CC(C)(C)C3)nc2)cc1	ZINC000450860638	FH	On-Demand	Anodyne	HDAC1	30	43
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](O)CC(C)(C)C3)nc2)cc1	ZINC000450860638	FH	On-Demand	Anodyne	P4HTM	0	49
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](O)CC(C)(C)C3)nc2)cc1	ZINC000450860641	FH	On-Demand	Anodyne	PRNP	60	39
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](O)CC(C)(C)C3)nc2)cc1	ZINC000450860641	FH	On-Demand	Anodyne	HDAC1	30	43
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](O)CC(C)(C)C3)nc2)cc1	ZINC000450860641	FH	On-Demand	Anodyne	P4HTM	0	49
CSc1ccc2ncnc(N[C@@H]3COCC3(C)C)c2c1	ZINC000450860653	CG	On-Demand	Anodyne	CD38	62	38
CSc1ccc2ncnc(N[C@H]3COCC3(C)C)c2c1	ZINC000450860655	CG	On-Demand	Anodyne	CD38	62	38
Cc1ccc2ncnc(N[C@@H]3COCC3(C)C)c2c1	ZINC000450860677	CF	On-Demand	Anodyne	CD38	64	38
Cc1ccc2ncnc(N[C@H]3COCC3(C)C)c2c1	ZINC000450860679	CF	On-Demand	Anodyne	CD38	64	38
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	HTR1A	23	65
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	DRD2	36	49
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	DRD1	24	54
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	HTR2A	38	56
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	HTR2C	29	65
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	SLC6A1	72	36
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	ERG2	23	49
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	SIGMAR1	22	49
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	HTR3B	0	52
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	CYP2J2	64	46
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	NET	0	54
CN(C)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860690	DG	On-Demand	Anodyne	AP2S1	0	49
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	HTR1A	23	65
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	DRD2	36	49
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	DRD1	24	54
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	HTR2A	38	56
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	HTR2C	29	65
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	SLC6A1	72	36
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	ERG2	23	49
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	SIGMAR1	22	49
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	HTR3B	0	52
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	CYP2J2	64	46
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	NET	0	54
CN(C)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450860691	DG	On-Demand	Anodyne	AP2S1	0	49
NC(=O)N1CCN2C(=O)N(CCc3ccc(Cl)cc3)C(=O)[C@H]2C1	ZINC000450860707	EC	On-Demand	Anodyne	CACNA1D	53	39
NC(=O)N1CCN2C(=O)N(CCc3ccc(Cl)cc3)C(=O)[C@@H]2C1	ZINC000450860714	EC	On-Demand	Anodyne	CACNA1D	53	39
COC(=O)c1nc(N2CC[C@H](O)CC(C)(C)C2)sc1C	ZINC000450860715	CE	On-Demand	Anodyne	GYRB	0	41
COC(=O)c1nc(N2CC[C@H](O)CC(C)(C)C2)sc1C	ZINC000450860715	CE	On-Demand	Anodyne	PARE	66	41
COC(=O)c1nc(N2CC[C@@H](O)CC(C)(C)C2)sc1C	ZINC000450860717	CE	On-Demand	Anodyne	GYRB	0	41
COC(=O)c1nc(N2CC[C@@H](O)CC(C)(C)C2)sc1C	ZINC000450860717	CE	On-Demand	Anodyne	PARE	66	41
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-]	ZINC000450860724	FD	On-Demand	Bother	TAAR1	17	46
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-]	ZINC000450860726	FD	On-Demand	Bother	TAAR1	17	46
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-]	ZINC000450860727	FD	On-Demand	Bother	TAAR1	17	46
CC[C@H](Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450860728	FD	On-Demand	Bother	TAAR1	17	46
c1coc([C@@H]2N(c3ncnc4sc5c(c34)CCC5)CC23CCC3)c1	ZINC000450860729	EJ	On-Demand	Anodyne	RBP4	16	40
c1coc([C@H]2N(c3ncnc4sc5c(c34)CCC5)CC23CCC3)c1	ZINC000450860730	EJ	On-Demand	Anodyne	RBP4	16	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450860744	EG	On-Demand	Anodyne	AMY2	46	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450860745	EG	On-Demand	Anodyne	AMY2	46	31
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450860746	EG	On-Demand	Anodyne	AMY2	46	31
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450860747	EG	On-Demand	Anodyne	AMY2	46	31
C[C@H](N=c1cncc[nH]1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860765	CD	On-Demand	Anodyne	DRD4	22	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1cncc[nH]1	ZINC000450860766	CD	On-Demand	Anodyne	DRD4	22	40
C[C@H](N=c1cncc[nH]1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450860767	CD	On-Demand	Anodyne	DRD4	22	40
C[C@@H](N=c1cncc[nH]1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860768	CD	On-Demand	Anodyne	DRD4	22	40
COc1ccc(CNC(=O)CCN(CC2CCC2)C(C)C)c(OC)c1	ZINC000450860774	EG	On-Demand	Anodyne	MTNR1A	49	38
C[C@@H](Nc1ccc(C(F)(F)F)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860775	FF	On-Demand	Anodyne	DRD4	22	41
C[C@@H](Nc1ccc(C(F)(F)F)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860775	FF	On-Demand	Anodyne	TPP2	57	36
C[C@H](Nc1ccc(C(F)(F)F)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860776	FF	On-Demand	Anodyne	DRD4	22	41
C[C@H](Nc1ccc(C(F)(F)F)nn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450860776	FF	On-Demand	Anodyne	TPP2	57	36
C[C@H](Nc1ccc(C(F)(F)F)nn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450860777	FF	On-Demand	Anodyne	DRD4	22	41
C[C@H](Nc1ccc(C(F)(F)F)nn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450860777	FF	On-Demand	Anodyne	TPP2	57	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C(F)(F)F)nn1	ZINC000450860778	FF	On-Demand	Anodyne	DRD4	22	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C(F)(F)F)nn1	ZINC000450860778	FF	On-Demand	Anodyne	TPP2	57	36
CC[C@@H](C)N1CCN(c2ccc(C(=O)Nc3nncs3)cn2)CC1	ZINC000450860794	EE	On-Demand	Anodyne	PRNP	51	43
CC[C@H](C)N1CCN(c2ccc(C(=O)Nc3nncs3)cn2)CC1	ZINC000450860795	EE	On-Demand	Anodyne	PRNP	51	43
Cn1cc([C@@H]2CCCCN2C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cn1	ZINC000450860801	GI	On-Demand	Anodyne	PRCP	48	37
Cn1cc([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cn1	ZINC000450860809	GI	On-Demand	Anodyne	PRCP	48	37
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cn1	ZINC000450860810	GI	On-Demand	Anodyne	PRCP	48	37
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cn1	ZINC000450860811	GI	On-Demand	Anodyne	PRCP	48	37
CCc1cc(N2CCN([C@H](C)CC)CC2)nc(C)n1	ZINC000450860820	CE	On-Demand	Anodyne	SORD	23	41
CCc1cc(N2CCN([C@@H](C)CC)CC2)nc(C)n1	ZINC000450860821	CE	On-Demand	Anodyne	SORD	23	41
CCS(=O)(=O)c1ccc(CN(C)Cc2cc(Cl)ccc2F)cc1	ZINC000450860822	FH	On-Demand	Anodyne	RORC	24	41
COCc1nc(NCCN2CCC(O)CC2)cc(OC)n1	ZINC000450860833	CC	On-Demand	Anodyne	P2RX2	16	41
CC[C@@H](C)N1CCN(c2cc(N3CCC[C@H](CO)C3)ncn2)CC1	ZINC000450860864	ED	On-Demand	Anodyne	PRCP	0	40
CC[C@H](C)N1CCN(c2cc(N3CCC[C@H](CO)C3)ncn2)CC1	ZINC000450860866	ED	On-Demand	Anodyne	PRCP	0	40
CC[C@@H](C)N1CCN(c2cc(N3CCC[C@@H](CO)C3)ncn2)CC1	ZINC000450860868	ED	On-Demand	Anodyne	PRCP	0	40
CC[C@H](C)N1CCN(c2cc(N3CCC[C@@H](CO)C3)ncn2)CC1	ZINC000450860870	ED	On-Demand	Anodyne	PRCP	0	40
CCOC(=O)CC(=O)CSCCC(C)(F)F	ZINC000450860893	CE	On-Demand	Anodyne	EST1_PIG	43	38
CO[C@H](C1CC1)[C@@H](C)Nc1nc(N(C)C)c2ccccc2n1	ZINC000450860931	DE	On-Demand	Anodyne	ADRA2A	17	47
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc(C#N)[nH]1	ZINC000450860932	DE	On-Demand	Mild	TPP2	52	33
CO[C@@H](C1CC1)[C@@H](C)Nc1nc(N(C)C)c2ccccc2n1	ZINC000450860933	DE	On-Demand	Anodyne	ADRA2A	17	47
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc(C#N)[nH]1	ZINC000450860934	DE	On-Demand	Mild	TPP2	52	33
CO[C@H](C1CC1)[C@H](C)Nc1nc(N(C)C)c2ccccc2n1	ZINC000450860935	DE	On-Demand	Anodyne	ADRA2A	17	47
CO[C@@H](C1CC1)[C@H](C)Nc1nc(N(C)C)c2ccccc2n1	ZINC000450860936	DE	On-Demand	Anodyne	ADRA2A	17	47
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc(C#N)[nH]1	ZINC000450860937	DE	On-Demand	Mild	TPP2	52	33
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc(C#N)[nH]1	ZINC000450860940	DE	On-Demand	Mild	TPP2	52	33
COC(=O)c1ccc(-c2nnn(CCCCCC(C)=O)n2)cc1	ZINC000450860953	DE	On-Demand	Anodyne	SCARB1	41	34
CCCc1ncc(CNc2ncnc3c(F)c(OC)ccc23)o1	ZINC000450860993	DF	On-Demand	Anodyne	PDE6A	44	34
CC[C@@H](C)N1CCN(c2ncccc2C(F)(F)F)CC1	ZINC000450861024	CG	On-Demand	Anodyne	TRPV1	36	50
CC[C@@H](C)N1CCN(c2ncccc2C(F)(F)F)CC1	ZINC000450861024	CG	On-Demand	Anodyne	RBP4	16	43
CC[C@H](C)N1CCN(c2ncccc2C(F)(F)F)CC1	ZINC000450861032	CG	On-Demand	Anodyne	TRPV1	36	50
CC[C@H](C)N1CCN(c2ncccc2C(F)(F)F)CC1	ZINC000450861032	CG	On-Demand	Anodyne	RBP4	16	43
CCC(CC)Oc1ccc(C(=O)N[C@H]2CCCO[C@@H]2c2cnn(CC)c2)cc1	ZINC000450861046	GI	On-Demand	Anodyne	PANC	44	31
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	DRD2	33	47
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	DRD1	19	49
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	DRD4	26	53
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	HRH2	0	47
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	HTR2A	39	54
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	HTR2C	29	61
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	SLC6A1	42	35
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	ERG2	23	47
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	SIGMAR1	23	57
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	CCR3	40	43
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	SLC18A3	17	47
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	HTR3B	0	47
O=C(CCCN1CC[C@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861048	DI	On-Demand	Anodyne	CYP2J2	61	43
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	DRD2	33	47
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	DRD1	19	49
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	DRD4	26	53
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	HRH2	0	47
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	HTR2A	39	54
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	HTR2C	29	61
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	SLC6A1	42	35
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	ERG2	23	47
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	SIGMAR1	23	57
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	CCR3	40	43
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	SLC18A3	17	47
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	HTR3B	0	47
O=C(CCCN1CC[C@@H](CC(F)(F)F)C1)c1ccc(F)cc1	ZINC000450861049	DI	On-Demand	Anodyne	CYP2J2	61	43
CC[C@@H](C)N1CCN(c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000450861065	CF	On-Demand	Bother	TAAR1	17	40
COc1cc(CN2CC[C@@H](C)S(=O)(=O)CC2)ccc1Cl	ZINC000450861094	DE	On-Demand	Anodyne	ACHE	15	40
COc1cc(CN2CC[C@@H](C)S(=O)(=O)CC2)ccc1Cl	ZINC000450861094	DE	On-Demand	Anodyne	SSTR5	63	40
COc1cc(CN2CC[C@@H](C)S(=O)(=O)CC2)ccc1Cl	ZINC000450861094	DE	On-Demand	Anodyne	MCHR1	20	45
COc1cc(CN2CC[C@H](C)S(=O)(=O)CC2)ccc1Cl	ZINC000450861095	DE	On-Demand	Anodyne	ACHE	15	40
COc1cc(CN2CC[C@H](C)S(=O)(=O)CC2)ccc1Cl	ZINC000450861095	DE	On-Demand	Anodyne	SSTR5	63	40
COc1cc(CN2CC[C@H](C)S(=O)(=O)CC2)ccc1Cl	ZINC000450861095	DE	On-Demand	Anodyne	MCHR1	20	45
CCCc1cc(N[C@H](CC)[C@@H](O)CC)n2ncnc2n1	ZINC000450861136	CE	On-Demand	Anodyne	DHOD	0	43
CCCc1cc(N[C@@H](CC)[C@H](O)CC)n2ncnc2n1	ZINC000450861137	CE	On-Demand	Anodyne	DHOD	0	43
CCCc1cc(N[C@@H](CC)[C@@H](O)CC)n2ncnc2n1	ZINC000450861138	CE	On-Demand	Anodyne	DHOD	0	43
CCCc1cc(N[C@H](CC)[C@H](O)CC)n2ncnc2n1	ZINC000450861141	CE	On-Demand	Anodyne	DHOD	0	43
C[C@@H](Nc1ccc([N+](=O)[O-])cc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861153	FG	On-Demand	Mild	DRD4	21	45
C[C@@H](Nc1ccc([N+](=O)[O-])cc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861153	FG	On-Demand	Mild	TPP2	53	34
C[C@H](Nc1ccc([N+](=O)[O-])cc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861155	FG	On-Demand	Mild	DRD4	21	45
C[C@H](Nc1ccc([N+](=O)[O-])cc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861155	FG	On-Demand	Mild	TPP2	53	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])cc1C#N	ZINC000450861157	FG	On-Demand	Mild	DRD4	21	45
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])cc1C#N	ZINC000450861157	FG	On-Demand	Mild	TPP2	53	34
C[C@H](Nc1ccc([N+](=O)[O-])cc1C#N)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450861159	FG	On-Demand	Mild	DRD4	21	45
C[C@H](Nc1ccc([N+](=O)[O-])cc1C#N)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450861159	FG	On-Demand	Mild	TPP2	53	34
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450861161	ED	On-Demand	Anodyne	NPY2R	49	37
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450861163	ED	On-Demand	Anodyne	NPY2R	49	37
CN(C)CCNS(=O)(=O)c1ccc(N[C@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450861164	GD	On-Demand	Bother	BDKRB1	0	42
CN(C)CCNS(=O)(=O)c1ccc(N[C@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450861164	GD	On-Demand	Bother	BCL2L1	93	35
CN(C)CCNS(=O)(=O)c1ccc(N[C@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450861164	GD	On-Demand	Bother	BCL2	77	32
CN(C)CCNS(=O)(=O)c1ccc(N[C@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450861164	GD	On-Demand	Bother	BCL2L2	48	35
CC[C@H](Nc1ccc(S(=O)(=O)NCC2CC2)cn1)[C@H](O)CC	ZINC000450861165	ED	On-Demand	Anodyne	NPY2R	49	37
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450861166	GD	On-Demand	Bother	BDKRB1	0	42
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450861166	GD	On-Demand	Bother	BCL2L1	93	35
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450861166	GD	On-Demand	Bother	BCL2	77	32
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2COCC2(C)C)c([N+](=O)[O-])c1	ZINC000450861166	GD	On-Demand	Bother	BCL2L2	48	35
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450861167	ED	On-Demand	Anodyne	NPY2R	49	37
CN(CCCNC(=O)C1CCC1)Cc1cccnc1N	ZINC000450861168	CD	On-Demand	Anodyne	TBK1	80	39
CCS(=O)(=O)c1ccc(CN(C)Cc2ccc(F)c(Cl)c2)cc1	ZINC000450861187	FH	On-Demand	Anodyne	RORC	42	35
COc1cccc([C@@H]2C[C@@H](Nc3cc(C(C)=O)ccc3S(C)(=O)=O)C2)c1	ZINC000450861188	FH	On-Demand	Anodyne	TAAR1	22	41
CCS(=O)(=O)c1ccc(CN[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1	ZINC000450861194	FD	On-Demand	Anodyne	SSTR3	0	41
CCS(=O)(=O)c1ccc(CN[C@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1	ZINC000450861196	FD	On-Demand	Anodyne	SSTR3	0	41
COCCOC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861198	GD	On-Demand	Anodyne	ADRB3	46	38
COCCOC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861198	GD	On-Demand	Anodyne	HSP90AB1	35	42
COCCOC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861198	GD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
COCCOC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861198	GD	On-Demand	Anodyne	SMO	59	47
COCCOC[C@@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861198	GD	On-Demand	Anodyne	ETHR	51	37
CCS(=O)(=O)c1ccc(CN[C@@H]2CCCC[C@H]2NS(C)(=O)=O)cc1	ZINC000450861199	FD	On-Demand	Anodyne	SSTR3	0	41
CCS(=O)(=O)c1ccc(CN[C@H]2CCCC[C@H]2NS(C)(=O)=O)cc1	ZINC000450861200	FD	On-Demand	Anodyne	SSTR3	0	41
COCCOC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861201	GD	On-Demand	Anodyne	ADRB3	46	38
COCCOC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861201	GD	On-Demand	Anodyne	HSP90AB1	35	42
COCCOC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861201	GD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	41
COCCOC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861201	GD	On-Demand	Anodyne	SMO	59	47
COCCOC[C@H](O)CN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000450861201	GD	On-Demand	Anodyne	ETHR	51	37
C[C@@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861206	FG	On-Demand	Mild	DRD4	20	40
C[C@@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861206	FG	On-Demand	Mild	TPP2	52	33
C[C@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861208	FG	On-Demand	Mild	DRD4	20	40
C[C@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861208	FG	On-Demand	Mild	TPP2	52	33
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])c(C#N)c1	ZINC000450861210	FG	On-Demand	Mild	DRD4	20	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])c(C#N)c1	ZINC000450861210	FG	On-Demand	Mild	TPP2	52	33
FC1(F)CC(CN2CCC(c3ncccc3Cl)CC2)C1	ZINC000450861211	DH	On-Demand	Anodyne	OPRL1	15	50
C[C@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450861212	FG	On-Demand	Mild	DRD4	20	40
C[C@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450861212	FG	On-Demand	Mild	TPP2	52	33
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861231	DG	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861231	DG	On-Demand	Anodyne	PRCP	25	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861231	DG	On-Demand	Anodyne	CCR5	29	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861231	DG	On-Demand	Anodyne	SLC18A3	29	53
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861231	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861232	DG	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861232	DG	On-Demand	Anodyne	PRCP	25	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861232	DG	On-Demand	Anodyne	CCR5	29	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861232	DG	On-Demand	Anodyne	SLC18A3	29	53
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861232	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861234	DG	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861234	DG	On-Demand	Anodyne	PRCP	25	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861234	DG	On-Demand	Anodyne	CCR5	29	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861234	DG	On-Demand	Anodyne	SLC18A3	29	53
C[C@H](c1ccccc1)[C@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861234	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861236	DG	On-Demand	Anodyne	VACHT_TETCF	0	45
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861236	DG	On-Demand	Anodyne	PRCP	25	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861236	DG	On-Demand	Anodyne	CCR5	29	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861236	DG	On-Demand	Anodyne	SLC18A3	29	53
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(c2ccncc2)CC1	ZINC000450861236	DG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
C[C@@H]1CN(CCc2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000450861237	DE	On-Demand	Anodyne	SLC6A1	19	40
C[C@@H]1CN(CCc2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000450861237	DE	On-Demand	Anodyne	SIGMAR1	15	44
C[C@@H]1CN(CCc2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000450861237	DE	On-Demand	Anodyne	CACNA1D	33	40
C[C@H]1CN(CCc2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000450861239	DE	On-Demand	Anodyne	SLC6A1	19	40
C[C@H]1CN(CCc2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000450861239	DE	On-Demand	Anodyne	SIGMAR1	15	44
C[C@H]1CN(CCc2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000450861239	DE	On-Demand	Anodyne	CACNA1D	33	40
C[C@@H](Oc1ccccn1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450861253	DE	On-Demand	Anodyne	AMY2	48	33
C[C@@H](Oc1ccccn1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450861256	DE	On-Demand	Anodyne	AMY2	48	33
C[C@H](Oc1ccccn1)C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450861257	DE	On-Demand	Anodyne	AMY2	48	33
C[C@H](Oc1ccccn1)C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450861258	DE	On-Demand	Anodyne	AMY2	48	33
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861267	GD	On-Demand	Bother	BDKRB1	0	48
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861267	GD	On-Demand	Bother	BCL2L1	109	35
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861267	GD	On-Demand	Bother	BCL2	97	34
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861267	GD	On-Demand	Bother	BCL2L2	49	35
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861268	GD	On-Demand	Bother	BDKRB1	0	48
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861268	GD	On-Demand	Bother	BCL2L1	109	35
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861268	GD	On-Demand	Bother	BCL2	97	34
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861268	GD	On-Demand	Bother	BCL2L2	49	35
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861269	GD	On-Demand	Bother	BDKRB1	0	48
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861269	GD	On-Demand	Bother	BCL2L1	109	35
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861269	GD	On-Demand	Bother	BCL2	97	34
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450861269	GD	On-Demand	Bother	BCL2L2	49	35
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450861270	GD	On-Demand	Bother	BDKRB1	0	48
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450861270	GD	On-Demand	Bother	BCL2L1	109	35
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450861270	GD	On-Demand	Bother	BCL2	97	34
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450861270	GD	On-Demand	Bother	BCL2L2	49	35
CCCOc1ccc(C(=O)Nc2ccccc2CSC)c(OC)c1	ZINC000450861286	EJ	On-Demand	Anodyne	LUCI_LUCLA	15	41
CCCOc1ccc(C(=O)Nc2ccccc2CSC)c(OC)c1	ZINC000450861286	EJ	On-Demand	Anodyne	KCNK3	49	39
CC[C@H](C)N1CCN(c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000450861290	CF	On-Demand	Bother	TAAR1	17	40
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450861302	FH	On-Demand	Anodyne	AVPR2	92	40
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450861302	FH	On-Demand	Anodyne	AVPR1A	53	40
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450861303	FH	On-Demand	Anodyne	AVPR2	92	40
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450861303	FH	On-Demand	Anodyne	AVPR1A	53	40
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450861304	FH	On-Demand	Anodyne	AVPR2	92	40
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450861304	FH	On-Demand	Anodyne	AVPR1A	53	40
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450861305	FH	On-Demand	Anodyne	AVPR2	92	40
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450861305	FH	On-Demand	Anodyne	AVPR1A	53	40
CC[C@@H](C)N1CCN(c2ncnc3c(F)c(OC)ccc23)CC1	ZINC000450861320	DF	On-Demand	Anodyne	PDGFRB	47	36
CC[C@@H](C)N1CCN(c2ncnc3c(F)c(OC)ccc23)CC1	ZINC000450861320	DF	On-Demand	Anodyne	PDE3B	53	33
CC[C@H](C)N1CCN(c2ncnc3c(F)c(OC)ccc23)CC1	ZINC000450861321	DF	On-Demand	Anodyne	PDGFRB	47	36
CC[C@H](C)N1CCN(c2ncnc3c(F)c(OC)ccc23)CC1	ZINC000450861321	DF	On-Demand	Anodyne	PDE3B	53	33
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)cc(F)c2)c(OC)c1	ZINC000450861330	GG	On-Demand	Anodyne	PDGFRB	33	41
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)cc(F)c2)c(OC)c1	ZINC000450861330	GG	On-Demand	Anodyne	GRIN2B	0	45
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)cc(F)c2)c(OC)c1	ZINC000450861330	GG	On-Demand	Anodyne	BMP1	19	40
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)cc(F)c2)c(OC)c1	ZINC000450861330	GG	On-Demand	Anodyne	P2RX7	17	40
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)cc(F)c2)c(OC)c1	ZINC000450861330	GG	On-Demand	Anodyne	MTNR1A	63	38
COc1ccc(CNC(=O)CCN(C)Cc2cc(F)cc(F)c2)c(OC)c1	ZINC000450861330	GG	On-Demand	Anodyne	MTNR1B	53	37
CC[C@@H](C)N1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450861354	FG	On-Demand	Anodyne	HSD11B1	21	42
CC[C@@H](C)N1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450861354	FG	On-Demand	Anodyne	SLC6A9	43	41
CC[C@H](C)N1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450861355	FG	On-Demand	Anodyne	HSD11B1	21	42
CC[C@H](C)N1CCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450861355	FG	On-Demand	Anodyne	SLC6A9	43	41
CC[C@H](C)N1CCN(c2nc(-c3ccccn3)nc(C)c2C)CC1	ZINC000450861357	EG	On-Demand	Anodyne	METAP1	44	42
CC[C@@H](C)N1CCN(c2nc(-c3ccccn3)nc(C)c2C)CC1	ZINC000450861358	EG	On-Demand	Anodyne	METAP1	44	42
CN(CCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)Cc1ccccc1	ZINC000450861453	FH	On-Demand	Anodyne	SIGMAR1	19	40
CN(CCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)Cc1ccccc1	ZINC000450861454	FH	On-Demand	Anodyne	SIGMAR1	19	40
Cc1ccn(-c2ccccc2C(=O)N2CCc3c(ncn(C)c3=O)C2)n1	ZINC000450861462	ED	On-Demand	Anodyne	AVPR2	15	40
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1	ZINC000450861477	GI	On-Demand	Anodyne	RBP4	80	39
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1	ZINC000450861477	GI	On-Demand	Anodyne	SFRP1	45	32
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1	ZINC000450861477	GI	On-Demand	Anodyne	WNT3	49	32
Cn1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1	ZINC000450861478	GI	On-Demand	Anodyne	RBP4	80	39
Cn1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1	ZINC000450861478	GI	On-Demand	Anodyne	SFRP1	45	32
Cn1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1	ZINC000450861478	GI	On-Demand	Anodyne	WNT3	49	32
CC1(C)C[C@H](O)CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450861500	EE	On-Demand	Anodyne	HDAC1	27	42
CC1(C)C[C@@H](O)CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450861501	EE	On-Demand	Anodyne	HDAC1	27	42
CCC(=O)CCCN(C)CCCNC(=O)C1CCC1	ZINC000450861502	CD	On-Demand	Anodyne	GNAI1	0	43
CCC(=O)CCCN(C)CCCNC(=O)C1CCC1	ZINC000450861502	CD	On-Demand	Anodyne	GNAI3	0	43
CCC(=O)CCCN(C)CCCNC(=O)C1CCC1	ZINC000450861502	CD	On-Demand	Anodyne	GNAO1	0	43
CC(=O)c1ccc(CN2CCc3cccc(C)c3C2)cc1	ZINC000450861506	CH	On-Demand	Anodyne	FABI	51	35
CC(=O)c1ccc(CN2CCc3cccc(C)c3C2)cc1	ZINC000450861506	CH	On-Demand	Anodyne	FABP4	40	35
CC(=O)c1ccc(CN2CCc3cccc(C)c3C2)cc1	ZINC000450861506	CH	On-Demand	Anodyne	NOD1	37	47
CC(=O)c1ccc(CN2CCc3cccc(C)c3C2)cc1	ZINC000450861506	CH	On-Demand	Anodyne	NOD2	56	47
COc1cccc([C@@H]2C[C@H]2Nc2ncc(C)cc2[N+](=O)[O-])c1	ZINC000450861511	CG	On-Demand	Bother	PRKCQ	0	42
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)Cc2ccc(Cl)c(OC)c2)cn1	ZINC000450861523	GG	On-Demand	Anodyne	PDE5A	29	44
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)Cc2ccc(Cl)c(OC)c2)cn1	ZINC000450861523	GG	On-Demand	Anodyne	P2RX7	22	41
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)Cc2ccc(Cl)c(OC)c2)cn1	ZINC000450861523	GG	On-Demand	Anodyne	SSTR3	15	42
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@@H](O)CC(C)(C)C2)c([N+](=O)[O-])c1	ZINC000450861534	GD	On-Demand	Bother	TAAR1	18	46
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@H](O)CC(C)(C)C2)c([N+](=O)[O-])c1	ZINC000450861535	GD	On-Demand	Bother	TAAR1	18	46
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@H](O)CC(C)(C)C2)c([N+](=O)[O-])c1	ZINC000450861537	GD	On-Demand	Bother	TAAR1	18	46
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@@H](O)CC(C)(C)C2)c([N+](=O)[O-])c1	ZINC000450861539	GD	On-Demand	Bother	TAAR1	18	46
CC1(C)C[C@H](O)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450861541	GG	On-Demand	Anodyne	PDE3A	45	34
CC1(C)C[C@H](O)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450861541	GG	On-Demand	Anodyne	PDE3B	66	34
CC1(C)C[C@@H](O)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450861543	GG	On-Demand	Anodyne	PDE3A	45	34
CC1(C)C[C@@H](O)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450861543	GG	On-Demand	Anodyne	PDE3B	66	34
C[C@H](CN1CCC(c2ccncc2)CC1)S(C)(=O)=O	ZINC000450861546	CD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
C[C@@H](CN1CCC(c2ccncc2)CC1)S(C)(=O)=O	ZINC000450861547	CD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COC(=O)c1ccc(-c2nnn(CC(=O)CC(C)(C)C3CC3)n2)cc1	ZINC000450861554	EF	On-Demand	Anodyne	SCARB1	52	41
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861598	GD	On-Demand	Bother	BCL2L1	95	34
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861598	GD	On-Demand	Bother	BCL2	76	38
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861598	GD	On-Demand	Bother	DDIT3	0	40
C[C@H]1CC[S@](=O)CCN1C[C@H](O)Cc1ccccc1	ZINC000450861599	CD	On-Demand	Anodyne	VACHT_TETCF	0	40
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861600	GD	On-Demand	Bother	BCL2L1	95	34
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861600	GD	On-Demand	Bother	BCL2	76	38
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861600	GD	On-Demand	Bother	DDIT3	0	40
C[C@H]1CC[S@@](=O)CCN1C[C@H](O)Cc1ccccc1	ZINC000450861601	CD	On-Demand	Anodyne	VACHT_TETCF	0	40
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861603	GD	On-Demand	Bother	BCL2L1	95	34
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861603	GD	On-Demand	Bother	BCL2	76	38
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450861603	GD	On-Demand	Bother	DDIT3	0	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450861607	GD	On-Demand	Bother	BCL2L1	95	34
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450861607	GD	On-Demand	Bother	BCL2	76	38
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450861607	GD	On-Demand	Bother	DDIT3	0	40
CC1(C)C[C@@H](O)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450861644	DF	On-Demand	Anodyne	PDE3A	46	35
CC1(C)C[C@@H](O)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450861644	DF	On-Demand	Anodyne	PDE3B	68	35
CC1(C)C[C@H](O)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450861648	DF	On-Demand	Anodyne	PDE3A	46	35
CC1(C)C[C@H](O)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450861648	DF	On-Demand	Anodyne	PDE3B	68	35
C[C@H](SC[C@H](O)CO)c1ccc(Oc2ccccc2)cc1	ZINC000450861655	DH	On-Demand	Anodyne	ACACA	34	40
C[C@H](SC[C@H](O)CO)c1ccc(Oc2ccccc2)cc1	ZINC000450861655	DH	On-Demand	Anodyne	TAAR1	17	46
COc1ccccc1[C@@H](C)SCc1nc(-c2cc(C)ccn2)no1	ZINC000450861656	EI	On-Demand	Anodyne	LUCI_PHOPE	21	40
COc1ccccc1[C@H](C)SCc1nc(-c2cc(C)ccn2)no1	ZINC000450861657	EI	On-Demand	Anodyne	LUCI_PHOPE	21	40
C[C@@H](SC[C@@H](O)CO)c1ccc(Oc2ccccc2)cc1	ZINC000450861659	DH	On-Demand	Anodyne	ACACA	34	40
C[C@@H](SC[C@@H](O)CO)c1ccc(Oc2ccccc2)cc1	ZINC000450861659	DH	On-Demand	Anodyne	TAAR1	17	46
C[C@@H](SC[C@H](O)CO)c1ccc(Oc2ccccc2)cc1	ZINC000450861662	DH	On-Demand	Anodyne	ACACA	34	40
C[C@H](SC[C@@H](O)CO)c1ccc(Oc2ccccc2)cc1	ZINC000450861664	DH	On-Demand	Anodyne	ACACA	34	40
C[C@H](SC[C@@H](O)CO)c1ccc(Oc2ccccc2)cc1	ZINC000450861664	DH	On-Demand	Anodyne	TAAR1	17	46
CCOC(=O)[C@@](C)(O)CNC(=O)CCOc1cccc(OC)c1	ZINC000450861690	EC	On-Demand	Anodyne	MTNR1A	47	44
CCOC(=O)[C@@](C)(O)CNC(=O)CCOc1cccc(OC)c1	ZINC000450861690	EC	On-Demand	Anodyne	MTNR1B	46	44
CCOC(=O)[C@](C)(O)CNC(=O)CCOc1cccc(OC)c1	ZINC000450861693	EC	On-Demand	Anodyne	MTNR1A	47	44
CCOC(=O)[C@](C)(O)CNC(=O)CCOc1cccc(OC)c1	ZINC000450861693	EC	On-Demand	Anodyne	MTNR1B	46	44
C[C@@](CO)(NC(=O)Cc1cc2ccccc2c(O)n1)C1CCCCC1	ZINC000450861723	EF	On-Demand	Anodyne	AMY2	42	29
C[C@](CO)(NC(=O)Cc1cc2ccccc2c(O)n1)C1CCCCC1	ZINC000450861724	EF	On-Demand	Anodyne	AMY2	42	29
CC(=O)c1ccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)cc1	ZINC000450861726	FH	On-Demand	Mild	DRD2	25	41
CC(=O)c1ccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)cc1	ZINC000450861726	FH	On-Demand	Mild	DRD4	44	44
CC(=O)c1ccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)cc1	ZINC000450861726	FH	On-Demand	Mild	NPY2R	24	46
CC(=O)c1ccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)cc1	ZINC000450861726	FH	On-Demand	Mild	PREP	0	40
CC(=O)c1ccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)cc1	ZINC000450861726	FH	On-Demand	Mild	CXCR3	28	41
CC(=O)c1ccc(CN2CCN(c3ccc(C#N)cc3Cl)CC2)cc1	ZINC000450861726	FH	On-Demand	Mild	CSF1R	22	41
CCC[C@]1(CO)CCCN1CCN(C)Cc1ccccc1	ZINC000450861733	CF	On-Demand	Anodyne	SIGMAR1	15	40
CCC[C@@]1(CO)CCCN1CCN(C)Cc1ccccc1	ZINC000450861735	CF	On-Demand	Anodyne	SIGMAR1	15	40
CC[C@H](O)[C@@H](CC)Nc1ncc(C)s1	ZINC000450861739	BE	On-Demand	Anodyne	FDPS	15	50
CC[C@H](Nc1ncc(C)s1)[C@H](O)CC	ZINC000450861741	BE	On-Demand	Anodyne	FDPS	15	50
CC[C@H](O)[C@H](CC)Nc1ncc(C)s1	ZINC000450861742	BE	On-Demand	Anodyne	FDPS	15	50
CC[C@@H](O)[C@@H](CC)Nc1ncc(C)s1	ZINC000450861743	BE	On-Demand	Anodyne	FDPS	15	50
C[C@H](Nc1ncccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861759	CF	On-Demand	Anodyne	ACE	17	40
C[C@H](Nc1ncccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861759	CF	On-Demand	Anodyne	TPP2	66	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncccc1F	ZINC000450861760	CF	On-Demand	Anodyne	ACE	17	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncccc1F	ZINC000450861760	CF	On-Demand	Anodyne	TPP2	66	37
C[C@H](Nc1ncccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450861761	CF	On-Demand	Anodyne	ACE	17	40
C[C@H](Nc1ncccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450861761	CF	On-Demand	Anodyne	TPP2	66	37
C[C@@H](Nc1ncccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861762	CF	On-Demand	Anodyne	ACE	17	40
C[C@@H](Nc1ncccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861762	CF	On-Demand	Anodyne	TPP2	66	37
O=C(c1ccc(N2CCC2)nc1)N1CCc2c1cccc2C(F)(F)F	ZINC000450861780	EH	On-Demand	Anodyne	SCD1	23	43
O=C(c1ccc(N2CCC2)nc1)N1CCc2c1cccc2C(F)(F)F	ZINC000450861780	EH	On-Demand	Anodyne	SCD	20	43
O=C(c1ccc(N2CCC2)nc1)N1CCc2c1cccc2C(F)(F)F	ZINC000450861780	EH	On-Demand	Anodyne	HPGDS	15	40
CC(=O)c1ccc2cc(OCc3nnc(C(C)C)s3)ccc2c1	ZINC000450861785	EJ	On-Demand	Anodyne	NR1H4	45	38
CC[C@@H](C)N1CCN(c2ncc(C(=O)N(C)C)cc2Cl)CC1	ZINC000450861810	DE	On-Demand	Anodyne	P2RY12	30	46
CC[C@H](C)N1CCN(c2ncc(C(=O)N(C)C)cc2Cl)CC1	ZINC000450861811	DE	On-Demand	Anodyne	P2RY12	30	46
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450861819	GF	On-Demand	Bother	BDKRB1	24	45
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450861820	GF	On-Demand	Bother	BDKRB1	24	45
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450861821	GF	On-Demand	Bother	BDKRB1	24	45
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450861822	GF	On-Demand	Bother	BDKRB1	24	45
COc1nccc(CSc2nnc(CCc3ccccc3)o2)n1	ZINC000450861839	EF	On-Demand	Anodyne	PTK2	0	40
COc1cc(CN2CC[C@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861843	DI	On-Demand	Anodyne	DRD4	30	43
COc1cc(CN2CC[C@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861843	DI	On-Demand	Anodyne	ACHE	25	41
COc1cc(CN2CC[C@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861843	DI	On-Demand	Anodyne	DRD3	0	43
COc1cc(CN2CC[C@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861843	DI	On-Demand	Anodyne	HTR4	28	40
COc1cc(CN2CC[C@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861843	DI	On-Demand	Anodyne	SSTR5	54	39
COc1cc(CN2CC[C@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861843	DI	On-Demand	Anodyne	CCR3	23	40
COc1cc(CN2CC[C@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861843	DI	On-Demand	Anodyne	UTS2R	35	42
COc1cc(CN2CC[C@@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861844	DI	On-Demand	Anodyne	DRD4	30	43
COc1cc(CN2CC[C@@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861844	DI	On-Demand	Anodyne	ACHE	25	41
COc1cc(CN2CC[C@@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861844	DI	On-Demand	Anodyne	DRD3	0	43
COc1cc(CN2CC[C@@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861844	DI	On-Demand	Anodyne	HTR4	28	40
COc1cc(CN2CC[C@@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861844	DI	On-Demand	Anodyne	SSTR5	54	39
COc1cc(CN2CC[C@@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861844	DI	On-Demand	Anodyne	CCR3	23	40
COc1cc(CN2CC[C@@H](CC(F)(F)F)C2)ccc1Cl	ZINC000450861844	DI	On-Demand	Anodyne	UTS2R	35	42
COCCSCc1cccc(C(C)=O)c1	ZINC000450861845	BF	On-Demand	Anodyne	CACNA2D1	29	43
COc1cc2c(N[C@H](C)[C@@H](OC)C3CC3)ccnc2cc1F	ZINC000450861858	DH	On-Demand	Anodyne	FLT1	0	41
COc1cc2c(N[C@@H](C)[C@H](OC)C3CC3)ccnc2cc1F	ZINC000450861859	DH	On-Demand	Anodyne	FLT1	0	41
COc1cc2c(N[C@@H](C)[C@@H](OC)C3CC3)ccnc2cc1F	ZINC000450861860	DH	On-Demand	Anodyne	FLT1	0	41
COc1cc2c(N[C@H](C)[C@H](OC)C3CC3)ccnc2cc1F	ZINC000450861861	DH	On-Demand	Anodyne	FLT1	0	41
Cc1nccc(N2CCN(C(=O)Cc3cc4ccccc4s3)CC2)n1	ZINC000450861867	FF	On-Demand	Anodyne	SORD	65	39
CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@H]1c1nccn1C	ZINC000450861890	GG	On-Demand	Anodyne	PRCP	53	40
CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@H]1c1nccn1C	ZINC000450861890	GG	On-Demand	Anodyne	MC3R	44	39
CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@H]1c1nccn1C	ZINC000450861891	GG	On-Demand	Anodyne	PRCP	53	40
CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@H]1c1nccn1C	ZINC000450861891	GG	On-Demand	Anodyne	MC3R	44	39
CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@@H]1c1nccn1C	ZINC000450861892	GG	On-Demand	Anodyne	PRCP	53	40
CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C[C@@H]1c1nccn1C	ZINC000450861892	GG	On-Demand	Anodyne	MC3R	44	39
CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@@H]1c1nccn1C	ZINC000450861893	GG	On-Demand	Anodyne	PRCP	53	40
CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C[C@@H]1c1nccn1C	ZINC000450861893	GG	On-Demand	Anodyne	MC3R	44	39
C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861925	GG	On-Demand	Bother	TPP2	61	34
C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450861926	GG	On-Demand	Bother	TPP2	61	34
C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc12)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450861927	GG	On-Demand	Bother	TPP2	61	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncnc2sc([N+](=O)[O-])cc12	ZINC000450861928	GG	On-Demand	Bother	TPP2	61	34
CCOC(=O)c1csc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450861933	FF	On-Demand	Anodyne	TPP2	74	42
CCOC(=O)c1csc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450861933	FF	On-Demand	Anodyne	TRPC6	51	32
CCOC(=O)c1csc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450861933	FF	On-Demand	Anodyne	TRPC3	45	31
CCOC(=O)c1csc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450861934	FF	On-Demand	Anodyne	TPP2	74	42
CCOC(=O)c1csc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450861934	FF	On-Demand	Anodyne	TRPC6	51	32
CCOC(=O)c1csc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450861934	FF	On-Demand	Anodyne	TRPC3	45	31
CCOC(=O)c1csc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450861935	FF	On-Demand	Anodyne	TPP2	74	42
CCOC(=O)c1csc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450861935	FF	On-Demand	Anodyne	TRPC6	51	32
CCOC(=O)c1csc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450861935	FF	On-Demand	Anodyne	TRPC3	45	31
CCOC(=O)c1csc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450861936	FF	On-Demand	Anodyne	TPP2	74	42
CCOC(=O)c1csc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450861936	FF	On-Demand	Anodyne	TRPC6	51	32
CCOC(=O)c1csc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450861936	FF	On-Demand	Anodyne	TRPC3	45	31
CC(C)N(CC[C@@H](C)O)C[C@H](O)COc1ccccc1	ZINC000450861949	CD	On-Demand	Anodyne	ADRB2	24	49
CC(C)N(CC[C@@H](C)O)C[C@H](O)COc1ccccc1	ZINC000450861949	CD	On-Demand	Anodyne	GRIN1	23	43
CC(C)N(CC[C@@H](C)O)C[C@H](O)COc1ccccc1	ZINC000450861949	CD	On-Demand	Anodyne	SLC22A3	0	41
CC(C)N(CC[C@H](C)O)C[C@H](O)COc1ccccc1	ZINC000450861950	CD	On-Demand	Anodyne	ADRB2	24	49
CC(C)N(CC[C@H](C)O)C[C@H](O)COc1ccccc1	ZINC000450861950	CD	On-Demand	Anodyne	GRIN1	23	43
CC(C)N(CC[C@H](C)O)C[C@H](O)COc1ccccc1	ZINC000450861950	CD	On-Demand	Anodyne	SLC22A3	0	41
CC(C)N(CC[C@@H](C)O)C[C@@H](O)COc1ccccc1	ZINC000450861951	CD	On-Demand	Anodyne	ADRB2	24	49
CC(C)N(CC[C@@H](C)O)C[C@@H](O)COc1ccccc1	ZINC000450861951	CD	On-Demand	Anodyne	GRIN1	23	43
CC(C)N(CC[C@@H](C)O)C[C@@H](O)COc1ccccc1	ZINC000450861951	CD	On-Demand	Anodyne	ABCB1	24	50
CC(C)N(CC[C@@H](C)O)C[C@@H](O)COc1ccccc1	ZINC000450861951	CD	On-Demand	Anodyne	SLC22A3	0	41
CC(C)N(CC[C@H](C)O)C[C@@H](O)COc1ccccc1	ZINC000450861952	CD	On-Demand	Anodyne	ADRB2	24	49
CC(C)N(CC[C@H](C)O)C[C@@H](O)COc1ccccc1	ZINC000450861952	CD	On-Demand	Anodyne	GRIN1	23	43
CC(C)N(CC[C@H](C)O)C[C@@H](O)COc1ccccc1	ZINC000450861952	CD	On-Demand	Anodyne	ABCB1	24	50
CC(C)N(CC[C@H](C)O)C[C@@H](O)COc1ccccc1	ZINC000450861952	CD	On-Demand	Anodyne	SLC22A3	0	41
COC(=O)c1ccc(CN[C@@H](CC(F)(F)F)c2ccccc2C)cc1Cl	ZINC000450861958	GK	On-Demand	Anodyne	CTSA	44	35
COC(=O)c1ccc(CN[C@H](CC(F)(F)F)c2ccccc2C)cc1Cl	ZINC000450861960	GK	On-Demand	Anodyne	CTSA	44	35
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)cc1	ZINC000450861961	EF	On-Demand	Anodyne	OPRK1	24	40
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)cc1	ZINC000450861961	EF	On-Demand	Anodyne	COLA	81	45
COC(=O)c1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)cc1	ZINC000450861961	EF	On-Demand	Anodyne	CPT1A	75	45
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)cc1	ZINC000450861963	EF	On-Demand	Anodyne	OPRK1	24	40
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)cc1	ZINC000450861963	EF	On-Demand	Anodyne	COLA	81	45
COC(=O)c1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)cc1	ZINC000450861963	EF	On-Demand	Anodyne	CPT1A	75	45
Cc1cc(N2CC3(CCC3)[C@@H]2c2ccco2)n2ncnc2n1	ZINC000450862034	CF	On-Demand	Anodyne	DHOD	0	43
Cc1cc(N2CC3(CCC3)[C@H]2c2ccco2)n2ncnc2n1	ZINC000450862042	CF	On-Demand	Anodyne	DHOD	0	43
C[C@@H](Nc1cncc(C(=O)N(C)C)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862043	FD	On-Demand	Anodyne	TPP2	60	38
C[C@H](Nc1cncc(C(=O)N(C)C)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862044	FD	On-Demand	Anodyne	TPP2	60	38
CC(=O)c1cccc(CN2CC[C@@H](C)S(=O)(=O)CC2)c1	ZINC000450862045	CD	On-Demand	Anodyne	ACHE	25	45
CC(=O)c1cccc(CN2CC[C@@H](C)S(=O)(=O)CC2)c1	ZINC000450862045	CD	On-Demand	Anodyne	CHRM3	22	44
CC(=O)c1cccc(CN2CC[C@@H](C)S(=O)(=O)CC2)c1	ZINC000450862045	CD	On-Demand	Anodyne	SIGMAR1	36	40
CC(=O)c1cccc(CN2CC[C@@H](C)S(=O)(=O)CC2)c1	ZINC000450862045	CD	On-Demand	Anodyne	CCR3	32	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cncc(C(=O)N(C)C)n1	ZINC000450862046	FD	On-Demand	Anodyne	TPP2	60	38
CC(=O)c1cccc(CN2CC[C@H](C)S(=O)(=O)CC2)c1	ZINC000450862047	CD	On-Demand	Anodyne	ACHE	25	45
CC(=O)c1cccc(CN2CC[C@H](C)S(=O)(=O)CC2)c1	ZINC000450862047	CD	On-Demand	Anodyne	CHRM3	22	44
CC(=O)c1cccc(CN2CC[C@H](C)S(=O)(=O)CC2)c1	ZINC000450862047	CD	On-Demand	Anodyne	SIGMAR1	36	40
CC(=O)c1cccc(CN2CC[C@H](C)S(=O)(=O)CC2)c1	ZINC000450862047	CD	On-Demand	Anodyne	CCR3	32	41
C[C@H](Nc1cncc(C(=O)N(C)C)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450862049	FD	On-Demand	Anodyne	TPP2	60	38
COc1ccc(-c2ccnc(N3CC[C@H](O)CC(C)(C)C3)n2)cc1	ZINC000450862089	EG	On-Demand	Anodyne	DKK1	0	44
COc1ccc(-c2ccnc(N3CC[C@@H](O)CC(C)(C)C3)n2)cc1	ZINC000450862091	EG	On-Demand	Anodyne	DKK1	0	44
CS(=O)(=O)c1cccc(CSCc2cccc(OC(F)F)c2)c1	ZINC000450862099	FI	On-Demand	Anodyne	NR1H3	44	34
CC1(C)COC[C@H]1Nc1nc(C(N)=O)cs1	ZINC000450862101	BD	On-Demand	Anodyne	TRPC3	41	32
CC1(C)COC[C@@H]1Nc1nc(C(N)=O)cs1	ZINC000450862110	BD	On-Demand	Anodyne	TRPC3	41	32
Cc1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1C	ZINC000450862147	DF	On-Demand	Anodyne	TPP2	68	39
Cc1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1C	ZINC000450862150	DF	On-Demand	Anodyne	TPP2	68	39
Cc1cnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1C	ZINC000450862152	DF	On-Demand	Anodyne	TPP2	68	39
Cc1cnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1C	ZINC000450862155	DF	On-Demand	Anodyne	TPP2	68	39
C[C@@H](Nc1cnnc(O)c1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862157	EF	On-Demand	Anodyne	TPP2	67	38
C[C@H](Nc1cnnc(O)c1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450862159	EF	On-Demand	Anodyne	TPP2	67	38
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cnnc(O)c1Cl	ZINC000450862161	EF	On-Demand	Anodyne	TPP2	67	38
C[C@H](Nc1cnnc(O)c1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862163	EF	On-Demand	Anodyne	TPP2	67	38
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450862176	DF	On-Demand	Bother	TAAR1	18	49
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450862177	DF	On-Demand	Bother	TAAR1	18	49
CC[C@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450862178	DF	On-Demand	Bother	TAAR1	18	49
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450862179	DF	On-Demand	Bother	TAAR1	18	49
Cc1cccc(Cl)c1C(=O)NCc1nc2ccccc2n1C1CC1	ZINC000450862183	EI	On-Demand	Anodyne	PDE6D	40	34
COC(=O)c1ccc(CN[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1Cl	ZINC000450862184	FE	On-Demand	Anodyne	SSTR3	27	49
COC(=O)c1ccc(CN[C@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1Cl	ZINC000450862185	FE	On-Demand	Anodyne	SSTR3	27	49
COC(=O)c1ccc(CN[C@@H]2CCCC[C@H]2NS(C)(=O)=O)cc1Cl	ZINC000450862186	FE	On-Demand	Anodyne	SSTR3	27	49
COC(=O)c1ccc(CN[C@H]2CCCC[C@H]2NS(C)(=O)=O)cc1Cl	ZINC000450862187	FE	On-Demand	Anodyne	SSTR3	27	49
CSCc1ccccc1NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450862188	GI	On-Demand	Mild	PGR	22	40
CSCc1ccccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450862189	GI	On-Demand	Mild	PGR	22	40
CCc1nn(C)c(N[C@@H]2C[C@H]2c2cccc(OC)c2)c1[N+](=O)[O-]	ZINC000450862232	DF	On-Demand	Bother	KDM1A	15	42
COC(=O)CNC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)c([N+](=O)[O-])c1	ZINC000450862237	GE	On-Demand	Bother	DRD4	42	32
COC(=O)CNC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)c([N+](=O)[O-])c1	ZINC000450862237	GE	On-Demand	Bother	TAAR1	33	49
COc1cccc([C@@H]2C[C@H]2Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1	ZINC000450862241	FG	On-Demand	Bother	MAPK14	15	44
COc1cccc([C@@H]2C[C@H]2Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1	ZINC000450862241	FG	On-Demand	Bother	TAAR1	29	49
O=C(CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)NCC1(c2ccccc2)CC1	ZINC000450862248	FF	On-Demand	Anodyne	ACAT	0	42
O=C(CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)NCC1(c2ccccc2)CC1	ZINC000450862249	FF	On-Demand	Anodyne	ACAT	0	42
O=C(CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)NCC1(c2ccccc2)CC1	ZINC000450862250	FF	On-Demand	Anodyne	ACAT	0	42
O=C(CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)NCC1(c2ccccc2)CC1	ZINC000450862251	FF	On-Demand	Anodyne	ACAT	0	42
CN(CCCNC(=O)C1CCC1)CCN(C)Cc1ccccc1	ZINC000450862297	DE	On-Demand	Anodyne	LTA4H	26	41
CN(CCCNC(=O)C1CCC1)CCN(C)Cc1ccccc1	ZINC000450862297	DE	On-Demand	Anodyne	AMY2	44	30
CN(CCCNC(=O)C1CCC1)CCN(C)Cc1ccccc1	ZINC000450862297	DE	On-Demand	Anodyne	MTNR1A	24	41
CN(CCCNC(=O)C1CCC1)CCN(C)Cc1ccccc1	ZINC000450862297	DE	On-Demand	Anodyne	MTNR1B	30	40
CN(CCCNC(=O)C1CCC1)CCN(C)Cc1ccccc1	ZINC000450862297	DE	On-Demand	Anodyne	TBK1	66	42
CN(CCCNC(=O)C1CCC1)CCN(C)Cc1ccccc1	ZINC000450862297	DE	On-Demand	Anodyne	MTNR1C	0	40
COc1ccccc1-c1noc(C2CCN(Cc3cn(CC4CC4)nn3)CC2)n1	ZINC000450862337	GG	On-Demand	Anodyne	SMO	30	41
COc1ccccc1-c1noc(C2CCN(Cc3cn(CC4CC4)nn3)CC2)n1	ZINC000450862337	GG	On-Demand	Anodyne	ETHR	41	33
CC(F)(F)c1ccc(C(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)cn1	ZINC000450862384	FH	On-Demand	Anodyne	PANC	44	34
O=C([C@@H](O)C1CCC1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450862391	FF	On-Demand	Anodyne	PRSS2	43	30
O=C([C@@H](O)C1CCC1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450862391	FF	On-Demand	Anodyne	HRH3	0	40
O=C([C@H](O)C1CCC1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450862392	FF	On-Demand	Anodyne	PRSS2	43	30
O=C([C@H](O)C1CCC1)N1CCC(Oc2cccc(Br)c2)CC1	ZINC000450862392	FF	On-Demand	Anodyne	HRH3	0	40
CC[C@@H](C)N1CCN(c2nc(-c3ccccc3)ns2)CC1	ZINC000450862423	DG	On-Demand	Anodyne	FAAH	19	51
CC[C@H](C)N1CCN(c2nc(-c3ccccc3)ns2)CC1	ZINC000450862424	DG	On-Demand	Anodyne	FAAH	19	51
CO[C@H]1C[C@@H](N(C)c2ncnc3[nH]ccc23)C12CCC2	ZINC000450862434	CE	On-Demand	Anodyne	JAK3	22	63
CO[C@@H]1C[C@H](N(C)c2ncnc3[nH]ccc23)C12CCC2	ZINC000450862435	CE	On-Demand	Anodyne	JAK3	22	63
CO[C@H]1C[C@H](N(C)c2ncnc3[nH]ccc23)C12CCC2	ZINC000450862436	CE	On-Demand	Anodyne	JAK3	22	63
CO[C@@H]1C[C@@H](N(C)c2ncnc3[nH]ccc23)C12CCC2	ZINC000450862437	CE	On-Demand	Anodyne	JAK3	22	63
CC[C@@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862442	DG	On-Demand	Anodyne	PDE3A	43	35
CC[C@@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862442	DG	On-Demand	Anodyne	PDGFRB	63	43
CC[C@@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862442	DG	On-Demand	Anodyne	AKT2	45	42
CC[C@@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862442	DG	On-Demand	Anodyne	HNMT	41	32
CC[C@@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862442	DG	On-Demand	Anodyne	PDE3B	64	35
CC[C@@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862442	DG	On-Demand	Anodyne	AKT1	31	40
CC[C@@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862442	DG	On-Demand	Anodyne	HTT	0	59
CC[C@@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862442	DG	On-Demand	Anodyne	AKT1S1	0	41
CC[C@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862443	DG	On-Demand	Anodyne	PDE3A	43	35
CC[C@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862443	DG	On-Demand	Anodyne	PDGFRB	63	43
CC[C@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862443	DG	On-Demand	Anodyne	AKT2	45	42
CC[C@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862443	DG	On-Demand	Anodyne	HNMT	41	32
CC[C@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862443	DG	On-Demand	Anodyne	PDE3B	64	35
CC[C@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862443	DG	On-Demand	Anodyne	AKT1	31	40
CC[C@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862443	DG	On-Demand	Anodyne	HTT	0	59
CC[C@H](C)N1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450862443	DG	On-Demand	Anodyne	AKT1S1	0	41
CC(F)(F)CCSCC(=O)C(C)(C)C	ZINC000450862446	BG	On-Demand	Anodyne	CES1	29	47
CC(F)(F)CCSCC(=O)C(C)(C)C	ZINC000450862446	BG	On-Demand	Anodyne	EST1_PIG	54	47
CC(F)(F)CCSCC(=O)C(C)(C)C	ZINC000450862446	BG	On-Demand	Anodyne	Q9GPG0_MANSE	0	43
CC(F)(F)CCSCC(=O)C(C)(C)C	ZINC000450862446	BG	On-Demand	Anodyne	EST5_RAT	0	43
C[C@@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862455	EE	On-Demand	Bother	DRD4	21	44
C[C@@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862455	EE	On-Demand	Bother	TPP2	65	37
C[C@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862456	EE	On-Demand	Bother	DRD4	21	44
C[C@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862456	EE	On-Demand	Bother	TPP2	65	37
C[C@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450862457	EE	On-Demand	Bother	DRD4	21	44
C[C@H](Nc1ncc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450862457	EE	On-Demand	Bother	TPP2	65	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc([N+](=O)[O-])cn1	ZINC000450862458	EE	On-Demand	Bother	DRD4	21	44
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc([N+](=O)[O-])cn1	ZINC000450862458	EE	On-Demand	Bother	TPP2	65	37
Cc1ccn(-c2ccc(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)nn2)n1	ZINC000450862486	FE	On-Demand	Anodyne	TPP2	55	34
Cc1ccn(-c2ccc(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nn2)n1	ZINC000450862487	FE	On-Demand	Anodyne	TPP2	55	34
Cc1ccn(-c2ccc(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)nn2)n1	ZINC000450862488	FE	On-Demand	Anodyne	TPP2	55	34
Cc1ccn(-c2ccc(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nn2)n1	ZINC000450862489	FE	On-Demand	Anodyne	TPP2	55	34
COCCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450862497	ED	On-Demand	Anodyne	TPP2	56	38
COCCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450862498	ED	On-Demand	Anodyne	TPP2	56	38
COCCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450862499	ED	On-Demand	Anodyne	TPP2	56	38
COCCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450862500	ED	On-Demand	Anodyne	TPP2	56	38
CC[C@H](O)[C@H](CC)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450862501	DE	On-Demand	Anodyne	LRRK2	28	41
CC[C@H](O)[C@@H](CC)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450862502	DE	On-Demand	Anodyne	LRRK2	28	41
CC[C@H](Nc1ccc2nnc(-c3ccccc3)n2n1)[C@H](O)CC	ZINC000450862503	DE	On-Demand	Anodyne	LRRK2	28	41
CC[C@@H](O)[C@@H](CC)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450862504	DE	On-Demand	Anodyne	LRRK2	28	41
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450862507	CC	On-Demand	Anodyne	CA2	41	38
CC[C@H](O)[C@H](CC)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450862508	CC	On-Demand	Anodyne	CA2	41	38
CC[C@H](Nc1ccc(S(N)(=O)=O)cn1)[C@H](O)CC	ZINC000450862509	CC	On-Demand	Anodyne	CA2	41	38
CC[C@H](O)[C@@H](CC)Nc1ccc(S(N)(=O)=O)cn1	ZINC000450862510	CC	On-Demand	Anodyne	CA2	41	38
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862516	CF	On-Demand	Anodyne	EGFR	22	42
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862516	CF	On-Demand	Anodyne	FGFR1	0	44
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862516	CF	On-Demand	Anodyne	PIK3R1	0	41
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862516	CF	On-Demand	Anodyne	FLT1	24	42
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862516	CF	On-Demand	Anodyne	FBP1	0	45
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862516	CF	On-Demand	Anodyne	EPHA2	45	36
CC[C@H](O)[C@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862516	CF	On-Demand	Anodyne	MKNK1	22	43
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862517	CF	On-Demand	Anodyne	EGFR	22	42
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862517	CF	On-Demand	Anodyne	FGFR1	0	44
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862517	CF	On-Demand	Anodyne	PIK3R1	0	41
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862517	CF	On-Demand	Anodyne	FLT1	24	42
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862517	CF	On-Demand	Anodyne	FBP1	0	45
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862517	CF	On-Demand	Anodyne	EPHA2	45	36
CC[C@@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862517	CF	On-Demand	Anodyne	MKNK1	22	43
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450862518	CF	On-Demand	Anodyne	EGFR	22	42
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450862518	CF	On-Demand	Anodyne	FGFR1	0	44
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450862518	CF	On-Demand	Anodyne	PIK3R1	0	41
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450862518	CF	On-Demand	Anodyne	FLT1	24	42
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450862518	CF	On-Demand	Anodyne	FBP1	0	45
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450862518	CF	On-Demand	Anodyne	EPHA2	45	36
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)[C@H](O)CC	ZINC000450862518	CF	On-Demand	Anodyne	MKNK1	22	43
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862519	CF	On-Demand	Anodyne	EGFR	22	42
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862519	CF	On-Demand	Anodyne	FGFR1	0	44
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862519	CF	On-Demand	Anodyne	PIK3R1	0	41
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862519	CF	On-Demand	Anodyne	FLT1	24	42
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862519	CF	On-Demand	Anodyne	FBP1	0	45
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862519	CF	On-Demand	Anodyne	EPHA2	45	36
CC[C@H](O)[C@@H](CC)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450862519	CF	On-Demand	Anodyne	MKNK1	22	43
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)sc1S(N)(=O)=O	ZINC000450862545	GD	On-Demand	Anodyne	TPP2	62	39
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)sc1S(N)(=O)=O	ZINC000450862546	GD	On-Demand	Anodyne	TPP2	62	39
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)sc1S(N)(=O)=O	ZINC000450862547	GD	On-Demand	Anodyne	TPP2	62	39
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)sc1S(N)(=O)=O	ZINC000450862548	GD	On-Demand	Anodyne	TPP2	62	39
Cn1cc([C@@H]2CCCCN2C(=O)CCc2cccc(F)c2Br)cn1	ZINC000450862593	GI	On-Demand	Anodyne	COLA	86	37
Cn1cc([C@@H]2CCCCN2C(=O)CCc2cccc(F)c2Br)cn1	ZINC000450862593	GI	On-Demand	Anodyne	CPT1A	81	37
Cn1cc([C@H]2CCCCN2C(=O)CCc2cccc(F)c2Br)cn1	ZINC000450862594	GI	On-Demand	Anodyne	COLA	86	37
Cn1cc([C@H]2CCCCN2C(=O)CCc2cccc(F)c2Br)cn1	ZINC000450862594	GI	On-Demand	Anodyne	CPT1A	81	37
OCC1(Cc2ccccc2)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450862620	GH	On-Demand	Anodyne	NPFFR2	19	40
OCC1(Cc2ccccc2)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450862620	GH	On-Demand	Anodyne	NPFFR1	31	40
COc1ccc(C2(NCc3c(C)cccc3Cl)CCOCC2)cc1F	ZINC000450862623	FJ	On-Demand	Anodyne	EIF2AK1	46	37
COC(=O)c1csc(CN(C[C@H](O)COc2ccccc2)C(C)C)n1	ZINC000450862624	FF	On-Demand	Anodyne	ADRB2	34	41
COC(=O)c1csc(CN(C[C@H](O)COc2ccccc2)C(C)C)n1	ZINC000450862624	FF	On-Demand	Anodyne	ADRB3	48	40
COC(=O)c1csc(CN(C[C@H](O)COc2ccccc2)C(C)C)n1	ZINC000450862624	FF	On-Demand	Anodyne	ABCB1	0	43
COC(=O)c1csc(CN(C[C@@H](O)COc2ccccc2)C(C)C)n1	ZINC000450862625	FF	On-Demand	Anodyne	ADRB2	34	41
COC(=O)c1csc(CN(C[C@@H](O)COc2ccccc2)C(C)C)n1	ZINC000450862625	FF	On-Demand	Anodyne	ADRB3	48	40
COC(=O)c1csc(CN(C[C@@H](O)COc2ccccc2)C(C)C)n1	ZINC000450862625	FF	On-Demand	Anodyne	ABCB1	0	43
OC1CCN(CCNc2ncnc3cc(Br)ccc23)CC1	ZINC000450862641	FD	On-Demand	Anodyne	EGFR	64	44
OC1CCN(CCNc2ncnc3cc(Br)ccc23)CC1	ZINC000450862641	FD	On-Demand	Anodyne	HNMT	40	31
NC(=O)c1ccnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c1[N+](=O)[O-]	ZINC000450862655	FF	On-Demand	Bother	PARP1	31	44
NC(=O)c1ccnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c1[N+](=O)[O-]	ZINC000450862656	FF	On-Demand	Bother	PARP1	31	44
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccnc(N(C)C)n2)C1	ZINC000450862657	DD	On-Demand	Anodyne	SORD	40	33
C[C@H]1CN(CC(F)(F)F)CCN(c2ccnc(N(C)C)n2)C1	ZINC000450862658	DD	On-Demand	Anodyne	SORD	40	33
CC[C@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862670	CF	On-Demand	Anodyne	PDE3A	44	35
CC[C@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862670	CF	On-Demand	Anodyne	PDGFRB	65	46
CC[C@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862670	CF	On-Demand	Anodyne	AKT3	26	42
CC[C@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862670	CF	On-Demand	Anodyne	PDE3B	65	35
CC[C@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862670	CF	On-Demand	Anodyne	AKT1	0	51
CC[C@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862670	CF	On-Demand	Anodyne	HTT	0	54
CC[C@@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862672	CF	On-Demand	Anodyne	PDE3A	44	35
CC[C@@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862672	CF	On-Demand	Anodyne	PDGFRB	65	46
CC[C@@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862672	CF	On-Demand	Anodyne	AKT3	26	42
CC[C@@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862672	CF	On-Demand	Anodyne	PDE3B	65	35
CC[C@@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862672	CF	On-Demand	Anodyne	AKT1	0	51
CC[C@@H](C)N1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450862672	CF	On-Demand	Anodyne	HTT	0	54
COc1ccc(CNC(=O)CCN(C)Cc2cc(C(C)(C)C)n[nH]2)c(OC)c1	ZINC000450862694	GF	On-Demand	Anodyne	PDGFRB	30	43
COc1ccc(CNC(=O)CCN(C)Cc2cc(C(C)(C)C)n[nH]2)c(OC)c1	ZINC000450862694	GF	On-Demand	Anodyne	MT-ND1	18	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450862726	GH	On-Demand	Anodyne	ANPEP	26	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450862726	GH	On-Demand	Anodyne	CAPN1	33	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450862726	GH	On-Demand	Anodyne	CAPN2	22	44
CC[C@@H](C)N1CCN(c2ncnc3c(C)csc23)CC1	ZINC000450862727	CF	On-Demand	Anodyne	LPAR2	20	44
CC[C@H](C)N1CCN(c2ncnc3c(C)csc23)CC1	ZINC000450862728	CF	On-Demand	Anodyne	LPAR2	20	44
O=[N+]([O-])c1ccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)cn1	ZINC000450862735	DH	On-Demand	Bother	PRCP	41	37
O=[N+]([O-])c1ccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)cn1	ZINC000450862735	DH	On-Demand	Bother	KCNN3	32	46
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)cn1	ZINC000450862737	DH	On-Demand	Bother	PRCP	41	37
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)cn1	ZINC000450862737	DH	On-Demand	Bother	KCNN3	32	46
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(S(N)(=O)=O)cn2)C1	ZINC000450862747	FD	On-Demand	Anodyne	GCKR	57	35
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(S(N)(=O)=O)cn2)C1	ZINC000450862752	FD	On-Demand	Anodyne	GCKR	57	35
CCC[C@@H](O)CN1CCC(c2ncc(C)s2)CC1	ZINC000450862759	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
CCC[C@H](O)CN1CCC(c2ncc(C)s2)CC1	ZINC000450862761	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
COC(=O)c1coc(CSc2nnc(CCc3ccccc3)o2)n1	ZINC000450862788	EF	On-Demand	Anodyne	FAAH	17	48
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450862801	FE	On-Demand	Anodyne	P2RY12	28	41
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450862801	FE	On-Demand	Anodyne	CXCR3	44	57
C[C@H]1CN(CC(F)(F)F)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450862806	FE	On-Demand	Anodyne	P2RY12	28	41
C[C@H]1CN(CC(F)(F)F)CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450862806	FE	On-Demand	Anodyne	CXCR3	44	57
CCOC(=O)[C@H](CC)SC[C@@H](Cc1ccccc1)OC	ZINC000450862807	CG	On-Demand	Anodyne	CTSB	17	40
CCOC(=O)[C@H](CC)SC[C@@H](Cc1ccccc1)OC	ZINC000450862807	CG	On-Demand	Anodyne	CTRB_BOVIN	48	38
CCOC(=O)[C@H](CC)SC[C@@H](Cc1ccccc1)OC	ZINC000450862807	CG	On-Demand	Anodyne	PDS	54	37
CCOC(=O)[C@H](CC)SC[C@H](Cc1ccccc1)OC	ZINC000450862809	CG	On-Demand	Anodyne	CTSB	17	40
CCOC(=O)[C@H](CC)SC[C@H](Cc1ccccc1)OC	ZINC000450862809	CG	On-Demand	Anodyne	CTRB_BOVIN	48	38
CCOC(=O)[C@H](CC)SC[C@H](Cc1ccccc1)OC	ZINC000450862809	CG	On-Demand	Anodyne	PDS	54	37
CCOC(=O)[C@@H](CC)SC[C@@H](Cc1ccccc1)OC	ZINC000450862811	CG	On-Demand	Anodyne	CTSB	17	40
CCOC(=O)[C@@H](CC)SC[C@@H](Cc1ccccc1)OC	ZINC000450862811	CG	On-Demand	Anodyne	CTRB_BOVIN	48	38
CCOC(=O)[C@@H](CC)SC[C@@H](Cc1ccccc1)OC	ZINC000450862811	CG	On-Demand	Anodyne	PDS	54	37
CCOC(=O)[C@@H](CC)SC[C@H](Cc1ccccc1)OC	ZINC000450862813	CG	On-Demand	Anodyne	CTSB	17	40
CCOC(=O)[C@@H](CC)SC[C@H](Cc1ccccc1)OC	ZINC000450862813	CG	On-Demand	Anodyne	CTRB_BOVIN	48	38
CCOC(=O)[C@@H](CC)SC[C@H](Cc1ccccc1)OC	ZINC000450862813	CG	On-Demand	Anodyne	PDS	54	37
CC(C)(CC(=O)Cn1sc2ccccc2c1=O)C1CC1	ZINC000450862839	CG	On-Demand	Anodyne	CASP3	35	43
CC(C)(CC(=O)Cn1sc2ccccc2c1=O)C1CC1	ZINC000450862839	CG	On-Demand	Anodyne	MPI	0	42
CC(C)(CC(=O)Cn1sc2ccccc2c1=O)C1CC1	ZINC000450862839	CG	On-Demand	Anodyne	SRTA	0	50
CC[C@@H](C)N1CCN(c2ccnc(C(N)=O)c2)CC1	ZINC000450862857	CD	On-Demand	Anodyne	CHEK1	41	31
CC[C@H](C)N1CCN(c2ccnc(C(N)=O)c2)CC1	ZINC000450862874	CD	On-Demand	Anodyne	CHEK1	41	31
CN(CCN1CC[C@@H](CC(F)(F)F)C1)Cc1ccccc1	ZINC000450862884	DG	On-Demand	Anodyne	ACHE	29	42
CN(CCN1CC[C@@H](CC(F)(F)F)C1)Cc1ccccc1	ZINC000450862884	DG	On-Demand	Anodyne	SIGMAR1	59	42
CN(CCN1CC[C@H](CC(F)(F)F)C1)Cc1ccccc1	ZINC000450862891	DG	On-Demand	Anodyne	ACHE	29	42
CN(CCN1CC[C@H](CC(F)(F)F)C1)Cc1ccccc1	ZINC000450862891	DG	On-Demand	Anodyne	SIGMAR1	59	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450862893	DE	On-Demand	Anodyne	TIMP3	68	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450862894	DE	On-Demand	Anodyne	TIMP3	68	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450862895	DE	On-Demand	Anodyne	TIMP3	68	36
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450862896	DE	On-Demand	Anodyne	TIMP3	68	36
C[C@@H](Nc1ccnc(N(C)C)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862897	ED	On-Demand	Anodyne	TPP2	67	39
C[C@H](Nc1ccnc(N(C)C)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450862898	ED	On-Demand	Anodyne	TPP2	67	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccnc(N(C)C)n1	ZINC000450862899	ED	On-Demand	Anodyne	TPP2	67	39
C[C@H](Nc1ccnc(N(C)C)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450862900	ED	On-Demand	Anodyne	TPP2	67	39
CSCc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450862922	GH	On-Demand	Anodyne	CA7	19	40
CSCc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450862922	GH	On-Demand	Anodyne	CA5B	58	40
CSCc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450862922	GH	On-Demand	Anodyne	CA5A	66	40
CSCc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450862922	GH	On-Demand	Anodyne	E1	0	40
CSCc1ccccc1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450862922	GH	On-Demand	Anodyne	RORC	60	36
CCNC(=O)c1ccc(N2CCC(CCN3CCOCC3)CC2)nn1	ZINC000450862929	ED	On-Demand	Anodyne	SCD1	50	44
CCNC(=O)c1ccc(N2CCC(CCN3CCOCC3)CC2)nn1	ZINC000450862929	ED	On-Demand	Anodyne	SCD	40	44
CC[C@H](Nc1ncnc2ccc(C)cc12)[C@H](O)CC	ZINC000450862952	CF	On-Demand	Anodyne	HTT	0	40
CC[C@H](O)[C@H](CC)Nc1ncnc2ccc(C)cc12	ZINC000450862953	CF	On-Demand	Anodyne	HTT	0	40
CC[C@H](O)[C@@H](CC)Nc1ncnc2ccc(C)cc12	ZINC000450862955	CF	On-Demand	Anodyne	HTT	0	40
CC[C@@H](O)[C@@H](CC)Nc1ncnc2ccc(C)cc12	ZINC000450862956	CF	On-Demand	Anodyne	HTT	0	40
Cn1cc([C@@H]2CN(CCc3ccc(Cl)cc3)C[C@H]2CO)cn1	ZINC000450862975	DE	On-Demand	Anodyne	SLC6A1	18	43
Cc1cccc2c1C[C@@H](C(=O)N[C@@](C)(CO)C1CCCCC1)O2	ZINC000450862983	DF	On-Demand	Anodyne	AMY2	45	31
Cc1cccc2c1C[C@H](C(=O)N[C@](C)(CO)C1CCCCC1)O2	ZINC000450862985	DF	On-Demand	Anodyne	AMY2	45	31
Cc1cccc2c1C[C@H](C(=O)N[C@@](C)(CO)C1CCCCC1)O2	ZINC000450862987	DF	On-Demand	Anodyne	AMY2	45	31
Cc1cccc2c1C[C@@H](C(=O)N[C@](C)(CO)C1CCCCC1)O2	ZINC000450862989	DF	On-Demand	Anodyne	AMY2	45	31
C[C@@H](N=c1nc(C2CC2)[nH]s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863000	EF	On-Demand	Anodyne	TPP2	58	39
C[C@H](N=c1nc(C2CC2)[nH]s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863003	EF	On-Demand	Anodyne	TPP2	58	39
C[C@H](N=c1nc(C2CC2)[nH]s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863004	EF	On-Demand	Anodyne	TPP2	58	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1nc(C2CC2)[nH]s1	ZINC000450863006	EF	On-Demand	Anodyne	TPP2	58	39
C[C@@H](Nc1ccc2nnc(C(F)F)n2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863034	FE	On-Demand	Anodyne	TPP2	54	34
COc1cccc([C@@H]2C[C@H]2Nc2ncc([N+](=O)[O-])cc2C#N)c1	ZINC000450863044	DF	On-Demand	Mild	SYK	0	43
CCCc1ncc(CNc2nccc(-c3ccc(OC)cc3)n2)o1	ZINC000450863052	DH	On-Demand	Anodyne	CLK4	26	53
CC(=O)c1[nH]c(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)sc1C	ZINC000450863087	EF	On-Demand	Anodyne	TPP2	53	34
CC(=O)c1[nH]c(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)sc1C	ZINC000450863088	EF	On-Demand	Anodyne	TPP2	53	34
CC(=O)c1[nH]c(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)sc1C	ZINC000450863089	EF	On-Demand	Anodyne	TPP2	53	34
CC(=O)c1[nH]c(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)sc1C	ZINC000450863090	EF	On-Demand	Anodyne	TPP2	53	34
C[C@H](Nc1ncc(Br)cc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863101	GG	On-Demand	Mild	TPP2	60	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(Br)cc1C#N	ZINC000450863102	GG	On-Demand	Mild	TPP2	60	34
C[C@H](Nc1ncc(Br)cc1C#N)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863103	GG	On-Demand	Mild	TPP2	60	34
C[C@@H](Nc1ncc(Br)cc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863104	GG	On-Demand	Mild	TPP2	60	34
COc1ccc2nc(C)[nH]c(=NCCN3CCC(O)CC3)c2c1	ZINC000450863147	DD	On-Demand	Anodyne	CARM1	44	32
CC[C@H](C)N1CCN(c2ncccc2C(=O)N2CCc3ccccc32)CC1	ZINC000450863175	FG	On-Demand	Anodyne	AVPR2	41	37
CC[C@@H](C)N1CCN(c2ncccc2C(=O)N2CCc3ccccc32)CC1	ZINC000450863176	FG	On-Demand	Anodyne	AVPR2	41	37
COc1ccc(CNC(=O)CCN2CC[C@H](CC(F)(F)F)C2)c(OC)c1	ZINC000450863184	FF	On-Demand	Anodyne	CACNA1I	52	34
COc1ccc(CNC(=O)CCN2CC[C@@H](CC(F)(F)F)C2)c(OC)c1	ZINC000450863185	FF	On-Demand	Anodyne	CACNA1I	52	34
C[C@H](Nc1ccc2nnc(C(F)F)n2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863188	FE	On-Demand	Anodyne	TPP2	54	34
C[C@H](Nc1ccc2nnc(C(F)F)n2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863191	FE	On-Demand	Anodyne	TPP2	54	34
CC[C@H]1CN(C(=O)c2ccc(N3CCC3)nc2)CCN1Cc1ccccc1	ZINC000450863192	FG	On-Demand	Anodyne	HDAC1	0	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc2nnc(C(F)F)n2n1	ZINC000450863193	FE	On-Demand	Anodyne	TPP2	54	34
CC[C@@H]1CN(C(=O)c2ccc(N3CCC3)nc2)CCN1Cc1ccccc1	ZINC000450863194	FG	On-Demand	Anodyne	HDAC1	0	41
C[C@H](c1ccc(Oc2ccccc2)cc1)N1C[C@H](O)[C@@H](O)C1	ZINC000450863213	CF	On-Demand	Anodyne	ACACA	27	43
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1C[C@H](O)[C@H](O)C1	ZINC000450863215	CF	On-Demand	Anodyne	ACACA	27	43
C[C@H](c1ccc(Oc2ccccc2)cc1)N1C[C@@H](O)[C@H](O)C1	ZINC000450863217	CF	On-Demand	Anodyne	ACACA	27	43
C[C@H](c1ccc(Oc2ccccc2)cc1)N1C[C@H](O)[C@H](O)C1	ZINC000450863219	CF	On-Demand	Anodyne	ACACA	27	43
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@H](O)CC	ZINC000450863236	EH	On-Demand	Anodyne	PRNP	59	33
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)[C@H](O)CC	ZINC000450863236	EH	On-Demand	Anodyne	P4HTM	0	52
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450863238	EH	On-Demand	Anodyne	PRNP	59	33
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450863238	EH	On-Demand	Anodyne	P4HTM	0	52
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450863240	EH	On-Demand	Anodyne	PRNP	59	33
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450863240	EH	On-Demand	Anodyne	P4HTM	0	52
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450863241	EH	On-Demand	Anodyne	PRNP	59	33
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450863241	EH	On-Demand	Anodyne	P4HTM	0	52
CCN1C(=O)CCc2cc(NC(=O)c3c(C)cccc3Cl)ccc21	ZINC000450863242	EI	On-Demand	Anodyne	TYK2	55	35
O[C@H]([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863249	DH	On-Demand	Anodyne	HRH3	18	40
O[C@H]([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863249	DH	On-Demand	Anodyne	SIGMAR1	18	41
O[C@H]([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863249	DH	On-Demand	Anodyne	BIRC2	57	51
O[C@@H]([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863251	DH	On-Demand	Anodyne	HRH3	18	40
O[C@@H]([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863251	DH	On-Demand	Anodyne	SIGMAR1	18	41
O[C@@H]([C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863251	DH	On-Demand	Anodyne	BIRC2	57	51
O[C@@H]([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863253	DH	On-Demand	Anodyne	HRH3	18	40
O[C@@H]([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863253	DH	On-Demand	Anodyne	SIGMAR1	18	41
O[C@@H]([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863253	DH	On-Demand	Anodyne	BIRC2	57	51
O[C@H]([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863255	DH	On-Demand	Anodyne	HRH3	18	40
O[C@H]([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863255	DH	On-Demand	Anodyne	SIGMAR1	18	41
O[C@H]([C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(F)(F)F	ZINC000450863255	DH	On-Demand	Anodyne	BIRC2	57	51
C[C@@H](Nc1ncc(C(=O)N(C)C)cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863258	GG	On-Demand	Anodyne	TPP2	62	34
C[C@H](Nc1ncc(C(=O)N(C)C)cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863260	GG	On-Demand	Anodyne	TPP2	62	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(C(=O)N(C)C)cc1Cl	ZINC000450863263	GG	On-Demand	Anodyne	TPP2	62	34
C[C@H](Nc1ncc(C(=O)N(C)C)cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863265	GG	On-Demand	Anodyne	TPP2	62	34
C[C@H](Nc1ncccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863267	EF	On-Demand	Bother	DRD4	20	41
C[C@H](Nc1ncccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863267	EF	On-Demand	Bother	TPP2	55	35
C[C@@H](NC[C@@H]1CCNC(=O)CC1)c1cccc(OCc2ccccc2)c1	ZINC000450863268	FH	On-Demand	Anodyne	GRM1	0	41
C[C@@H](NC[C@H]1CCNC(=O)CC1)c1cccc(OCc2ccccc2)c1	ZINC000450863269	FH	On-Demand	Anodyne	GRM1	0	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncccc1[N+](=O)[O-]	ZINC000450863270	EF	On-Demand	Bother	DRD4	20	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncccc1[N+](=O)[O-]	ZINC000450863270	EF	On-Demand	Bother	TPP2	55	35
C[C@H](Nc1ncccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863272	EF	On-Demand	Bother	DRD4	20	41
C[C@H](Nc1ncccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863272	EF	On-Demand	Bother	TPP2	55	35
C[C@@H](Nc1ncccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863273	EF	On-Demand	Bother	DRD4	20	41
C[C@@H](Nc1ncccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863273	EF	On-Demand	Bother	TPP2	55	35
CC[C@@H](C)N1CCN(c2cc(NCC3CC3)ncn2)CC1	ZINC000450863294	CE	On-Demand	Anodyne	GPR39	0	43
CCc1nc(C)c(CSc2ccc(Br)cc2[N+](=O)[O-])o1	ZINC000450863295	FJ	On-Demand	Bother	GSTM2	47	35
CC[C@H](C)N1CCN(c2cc(NCC3CC3)ncn2)CC1	ZINC000450863296	CE	On-Demand	Anodyne	GPR39	0	43
C[C@@H](Nc1nc(O)c2cnn(C)c2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863329	FD	On-Demand	Anodyne	TPP2	56	36
C[C@H](Nc1nc(O)c2cnn(C)c2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863331	FD	On-Demand	Anodyne	TPP2	56	36
C[C@H](Nc1nc(O)c2cnn(C)c2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863333	FD	On-Demand	Anodyne	TPP2	56	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nc(O)c2cnn(C)c2n1	ZINC000450863335	FD	On-Demand	Anodyne	TPP2	56	36
CC[C@H](O)[C@@H](CC)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450863337	DE	On-Demand	Bother	TAAR1	15	40
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450863338	DE	On-Demand	Bother	TAAR1	15	40
CC[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450863339	DE	On-Demand	Bother	TAAR1	15	40
CC[C@H](O)[C@H](CC)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450863340	DE	On-Demand	Bother	TAAR1	15	40
C[C@@H](Nc1ncccc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863341	DF	On-Demand	Mild	TPP2	56	36
C[C@H](Nc1ncccc1C#N)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863342	DF	On-Demand	Mild	TPP2	56	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncccc1C#N	ZINC000450863343	DF	On-Demand	Mild	TPP2	56	36
C[C@H](Nc1ncccc1C#N)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863344	DF	On-Demand	Mild	TPP2	56	36
Cc1cccc(C)c1[C@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450863364	DG	On-Demand	Anodyne	PRNP	26	41
Cc1cccc(C)c1[C@@H](C)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450863366	DG	On-Demand	Anodyne	PRNP	26	41
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(S(=O)(=O)C(C)(C)C)nc2)C1	ZINC000450863373	GF	On-Demand	Anodyne	GCKR	41	33
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(S(=O)(=O)C(C)(C)C)nc2)C1	ZINC000450863374	GF	On-Demand	Anodyne	GCKR	41	33
CCCC[C@H](NC(=O)C1(C(=O)CC)CC1)C(=O)OC	ZINC000450863375	CD	On-Demand	Anodyne	NOD1	50	32
CCCC[C@@H](NC(=O)C1(C(=O)CC)CC1)C(=O)OC	ZINC000450863376	CD	On-Demand	Anodyne	NOD1	50	32
Cc1cccc(CN2CCC(Oc3ncccc3C)CC2)n1	ZINC000450863381	CG	On-Demand	Anodyne	SCN9A	22	56
Cc1cccc(CN2CCC(Oc3ncccc3C)CC2)n1	ZINC000450863381	CG	On-Demand	Anodyne	SCN5A	47	44
C[C@@H](Sc1ncc(C(C)(C)C)o1)C(=O)Nc1nccs1	ZINC000450863385	DH	On-Demand	Anodyne	MAP1	96	38
C[C@H](Sc1ncc(C(C)(C)C)o1)C(=O)Nc1nccs1	ZINC000450863386	DH	On-Demand	Anodyne	MAP1	96	38
C[C@H](Sc1ncc(C(C)(C)C)o1)C(=O)Nc1nccs1	ZINC000450863386	DH	On-Demand	Anodyne	FFAR2	15	42
CCN(CCC1CC1)C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450863396	DG	On-Demand	Anodyne	CACNA1I	27	40
COC(=O)C1(CN2CCN(c3cccc4cnccc34)C[C@@H]2C)CC1	ZINC000450863406	EF	On-Demand	Anodyne	P2RX7	32	44
COC(=O)C1(CN2CCN(c3cccc4cnccc34)C[C@H]2C)CC1	ZINC000450863407	EF	On-Demand	Anodyne	P2RX7	32	44
Cc1cnccc1OC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450863443	FG	On-Demand	Anodyne	SCN5A	42	33
COc1ccc(CNC(=O)CCN2CCC3(CC2)CCN(C)C3=O)c(OC)c1	ZINC000450863457	GD	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCC3(CC2)CCN(C)C3=O)c(OC)c1	ZINC000450863457	GD	On-Demand	Anodyne	HTR7	33	43
COc1ccc(CNC(=O)CCN2CCC3(CC2)CCN(C)C3=O)c(OC)c1	ZINC000450863457	GD	On-Demand	Anodyne	MTNR1A	55	41
COc1ccc(CNC(=O)CCN2CCC3(CC2)CCN(C)C3=O)c(OC)c1	ZINC000450863457	GD	On-Demand	Anodyne	MTNR1B	42	41
COC(=O)c1ccc(CN2CCC(CO)(OC)CC2)cc1Cl	ZINC000450863472	EE	On-Demand	Anodyne	NPFFR1	46	39
COC(=O)c1ccc(-c2nnn(C[C@H]3CCCCC3(F)F)n2)cc1	ZINC000450863498	EF	On-Demand	Anodyne	SCARB1	53	41
COC(=O)c1ccc(-c2nnn(C[C@@H]3CCCCC3(F)F)n2)cc1	ZINC000450863499	EF	On-Demand	Anodyne	SCARB1	53	41
CC(=O)CCCCCN(C#N)c1ccccc1	ZINC000450863556	BG	On-Demand	Anodyne	KDM4A	0	40
CC(=O)CCCCCN(C#N)c1ccccc1	ZINC000450863556	BG	On-Demand	Anodyne	KDM4C	0	40
CN(CCN1CCCC12CCC2)Cc1ccccc1	ZINC000450863593	CG	On-Demand	Anodyne	SIGMAR1	23	44
Cn1cc([C@@H]2CCCCN2C(=O)CCCC(=O)C(C)(C)C)cn1	ZINC000450863604	DG	On-Demand	Anodyne	COLA	56	33
Cn1cc([C@@H]2CCCCN2C(=O)CCCC(=O)C(C)(C)C)cn1	ZINC000450863604	DG	On-Demand	Anodyne	CPT1A	55	33
Cn1cc([C@H]2CCCCN2C(=O)CCCC(=O)C(C)(C)C)cn1	ZINC000450863605	DG	On-Demand	Anodyne	COLA	56	33
Cn1cc([C@H]2CCCCN2C(=O)CCCC(=O)C(C)(C)C)cn1	ZINC000450863605	DG	On-Demand	Anodyne	CPT1A	55	33
O=C(NCC(=O)N1CCn2c(O)nnc2C1)Nc1cccc(Cl)c1	ZINC000450863620	FC	On-Demand	Anodyne	P2RX7	23	40
O=C(NCC(=O)N1CCn2c(O)nnc2C1)Nc1cccc(Cl)c1	ZINC000450863620	FC	On-Demand	Anodyne	PRMT3	24	40
CSCc1ccccc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450863669	CE	On-Demand	Anodyne	P2RX7	37	54
CSCc1ccccc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450863671	CE	On-Demand	Anodyne	P2RX7	37	54
COc1cccc(OCCC(=O)NCC2(CN(C)C)CCCC2)c1	ZINC000450863674	EF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)NCC2(CN(C)C)CCCC2)c1	ZINC000450863674	EF	On-Demand	Anodyne	MTNR1A	45	42
COc1cccc(OCCC(=O)NCC2(CN(C)C)CCCC2)c1	ZINC000450863674	EF	On-Demand	Anodyne	MTNR1B	42	39
C[C@@](CO)(NC(=O)[C@H]1CCN(c2ccccc2)C1)C1CCCCC1	ZINC000450863696	EF	On-Demand	Anodyne	AMY2	50	34
C[C@](CO)(NC(=O)[C@H]1CCN(c2ccccc2)C1)C1CCCCC1	ZINC000450863698	EF	On-Demand	Anodyne	AMY2	50	34
C[C@](CO)(NC(=O)[C@@H]1CCN(c2ccccc2)C1)C1CCCCC1	ZINC000450863700	EF	On-Demand	Anodyne	AMY2	50	34
C[C@@](CO)(NC(=O)[C@@H]1CCN(c2ccccc2)C1)C1CCCCC1	ZINC000450863702	EF	On-Demand	Anodyne	AMY2	50	34
CC(=O)[C@@H](C)SCC/C=C\c1ccccc1	ZINC000450863703	BH	On-Demand	Anodyne	NA	0	40
CC(=O)[C@@H](C)SCC/C=C\c1ccccc1	ZINC000450863703	BH	On-Demand	Anodyne	GRIK1	29	41
CC(=O)[C@@H](C)SCC/C=C/c1ccccc1	ZINC000450863705	BH	On-Demand	Anodyne	NA	0	40
CC(=O)[C@@H](C)SCC/C=C/c1ccccc1	ZINC000450863705	BH	On-Demand	Anodyne	GRIK1	29	41
CC(=O)[C@H](C)SCC/C=C\c1ccccc1	ZINC000450863710	BH	On-Demand	Anodyne	NA	0	40
CC(=O)[C@H](C)SCC/C=C\c1ccccc1	ZINC000450863710	BH	On-Demand	Anodyne	GRIK1	29	41
CC(=O)[C@H](C)SCC/C=C/c1ccccc1	ZINC000450863711	BH	On-Demand	Anodyne	NA	0	40
CC(=O)[C@H](C)SCC/C=C/c1ccccc1	ZINC000450863711	BH	On-Demand	Anodyne	GRIK1	29	41
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450863712	EG	On-Demand	Anodyne	L3MBTL1	0	40
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450863712	EG	On-Demand	Anodyne	L3MBTL3	59	34
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450863714	EG	On-Demand	Anodyne	L3MBTL1	0	40
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450863714	EG	On-Demand	Anodyne	L3MBTL3	59	34
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450863716	EG	On-Demand	Anodyne	L3MBTL1	0	40
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450863716	EG	On-Demand	Anodyne	L3MBTL3	59	34
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450863730	EG	On-Demand	Anodyne	L3MBTL1	0	40
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450863730	EG	On-Demand	Anodyne	L3MBTL3	59	34
CC[C@H](C)N1CCN(c2ccnc3ccccc23)CC1	ZINC000450863743	CG	On-Demand	Anodyne	SORD	48	38
C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863744	GG	On-Demand	Bother	TPP2	51	32
CC[C@@H](C)N1CCN(c2ccnc3ccccc23)CC1	ZINC000450863745	CG	On-Demand	Anodyne	SORD	48	38
C[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450863749	GG	On-Demand	Bother	TPP2	51	32
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000450863750	GG	On-Demand	Bother	TPP2	51	32
C[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450863751	GG	On-Demand	Bother	TPP2	51	32
Cc1ccc(C(C)(C)NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1	ZINC000450863759	FJ	On-Demand	Anodyne	RBP4	83	44
CSCc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450863766	DG	On-Demand	Anodyne	KCNQ2	70	34
CSCc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450863766	DG	On-Demand	Anodyne	PRNP	46	41
CSCc1ccccc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450863766	DG	On-Demand	Anodyne	HDAC1	37	49
CCC(=O)c1ccc(N[C@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450863792	DG	On-Demand	Bother	TAAR1	17	46
CCC(=O)c1ccc(N[C@@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450863793	DG	On-Demand	Bother	TAAR1	17	46
CCC(=O)c1ccc(N[C@@H](C)[C@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450863794	DG	On-Demand	Bother	TAAR1	17	46
CCC(=O)c1ccc(N[C@H](C)[C@@H](OC)C2CC2)c([N+](=O)[O-])c1	ZINC000450863795	DG	On-Demand	Bother	TAAR1	17	46
NC(=O)N1CCN2C(=O)N(CCCCc3ccc(Cl)c(Cl)c3)C(=O)[C@@H]2C1	ZINC000450863829	GE	On-Demand	Anodyne	DNAE	60	32
NC(=O)N1CCN2C(=O)N(CCCCc3ccc(Cl)c(Cl)c3)C(=O)[C@H]2C1	ZINC000450863830	GE	On-Demand	Anodyne	DNAE	60	32
Cc1cc(C#N)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450863831	DE	On-Demand	Mild	TPP2	58	36
Cc1cc(C#N)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450863832	DE	On-Demand	Mild	TPP2	58	36
Cc1cc(C#N)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450863833	DE	On-Demand	Mild	TPP2	58	36
Cc1cc(C#N)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450863834	DE	On-Demand	Mild	TPP2	58	36
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450863835	EE	On-Demand	Anodyne	GCKR	40	36
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450863835	EE	On-Demand	Anodyne	NAMPT	24	40
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450863836	EE	On-Demand	Anodyne	GCKR	40	36
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450863836	EE	On-Demand	Anodyne	NAMPT	24	40
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450863838	EE	On-Demand	Anodyne	GCKR	40	36
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450863838	EE	On-Demand	Anodyne	NAMPT	24	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](O)CC	ZINC000450863840	EE	On-Demand	Anodyne	GCKR	40	36
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)[C@H](O)CC	ZINC000450863840	EE	On-Demand	Anodyne	NAMPT	24	40
CCN(CCC1CC1)C(=O)c1ccc(N2CCC2)nc1	ZINC000450863859	CF	On-Demand	Anodyne	HPGDS	15	43
CCN(CCC1CC1)C(=O)c1ccc(N2CCC2)nc1	ZINC000450863859	CF	On-Demand	Anodyne	ACKR3	50	31
N#Cc1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450863860	DH	On-Demand	Mild	SMO	0	46
COc1cccc2c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)nccc12	ZINC000450863861	FH	On-Demand	Anodyne	PDE3B	49	32
COc1cccc2c(N3CCN(CC(F)(F)F)C[C@H](C)C3)nccc12	ZINC000450863862	FH	On-Demand	Anodyne	PDE3B	49	32
CCCC[C@@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC	ZINC000450863886	CE	On-Demand	Anodyne	CTSK	22	43
CCCC[C@@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC	ZINC000450863886	CE	On-Demand	Anodyne	NOD1	70	34
CCCC[C@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC	ZINC000450863888	CE	On-Demand	Anodyne	CTSK	22	43
CCCC[C@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC	ZINC000450863888	CE	On-Demand	Anodyne	NOD1	70	34
COC(=O)c1ccc(-c2nnn(CC[C@@H]3CCOC3)n2)cc1	ZINC000450863923	DD	On-Demand	Anodyne	SCARB1	50	37
COC(=O)c1ccc(-c2nnn(CC[C@H]3CCOC3)n2)cc1	ZINC000450863925	DD	On-Demand	Anodyne	SCARB1	50	37
CCCc1nc(C)c(Cn2sc3ccccc3c2=O)o1	ZINC000450863948	CG	On-Demand	Anodyne	CASP7	43	37
CCCC[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC	ZINC000450863950	CC	On-Demand	Anodyne	METAP2	0	40
CCCC[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC	ZINC000450863950	CC	On-Demand	Anodyne	NOD1	53	31
CCCC[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC	ZINC000450863951	CC	On-Demand	Anodyne	METAP2	0	40
CCCC[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC	ZINC000450863951	CC	On-Demand	Anodyne	NOD1	53	31
CCCC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC	ZINC000450863953	CC	On-Demand	Anodyne	METAP2	0	40
CCCC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC	ZINC000450863953	CC	On-Demand	Anodyne	NOD1	53	31
CCCC[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC	ZINC000450863955	CC	On-Demand	Anodyne	METAP2	0	40
CCCC[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC	ZINC000450863955	CC	On-Demand	Anodyne	NOD1	53	31
Nc1nc(N[C@@H]2CCO[C@@H](c3ccccn3)C2)ncc1[N+](=O)[O-]	ZINC000450863977	DD	On-Demand	Bother	PRKCQ	44	40
COc1ccc(CNC(=O)CCN2CCC(CO)(OC)CC2)c(OC)c1	ZINC000450863982	FD	On-Demand	Anodyne	DRD4	41	31
COc1ccc(CNC(=O)CCN2CCC(CO)(OC)CC2)c(OC)c1	ZINC000450863982	FD	On-Demand	Anodyne	HTR7	29	44
COc1ccc(CNC(=O)CCN2CCC(CO)(OC)CC2)c(OC)c1	ZINC000450863982	FD	On-Demand	Anodyne	MTNR1A	49	36
O=C(Nc1ccccc1)c1ccc(SC2CCC(C(F)(F)F)CC2)nn1	ZINC000450864028	GJ	On-Demand	Anodyne	SCD1	16	43
O=C(Nc1ccccc1)c1ccc(SC2CCC(C(F)(F)F)CC2)nn1	ZINC000450864028	GJ	On-Demand	Anodyne	SCD	15	43
COC1(CO)CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450864041	CE	On-Demand	Anodyne	SLC5A4	52	34
Cc1cccnc1OC1CCN(CC2(C#N)CCC2)CC1	ZINC000450864051	CF	On-Demand	Mild	SCN5A	43	32
Cc1nnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450864057	DE	On-Demand	Anodyne	ACE	17	40
Cc1nnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450864057	DE	On-Demand	Anodyne	TPP2	60	38
Cc1nnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450864058	DE	On-Demand	Anodyne	ACE	17	40
Cc1nnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450864058	DE	On-Demand	Anodyne	TPP2	60	38
Cc1nnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450864059	DE	On-Demand	Anodyne	ACE	17	40
Cc1nnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450864059	DE	On-Demand	Anodyne	TPP2	60	38
Cc1nnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450864060	DE	On-Demand	Anodyne	ACE	17	40
Cc1nnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450864060	DE	On-Demand	Anodyne	TPP2	60	38
C[C@H](Nc1ncnc2c1cnn2C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864061	EE	On-Demand	Anodyne	TPP2	64	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncnc2c1cnn2C	ZINC000450864062	EE	On-Demand	Anodyne	TPP2	64	36
C[C@H](Nc1ncnc2c1cnn2C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864063	EE	On-Demand	Anodyne	TPP2	64	36
C[C@@H](Nc1ncnc2c1cnn2C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864064	EE	On-Demand	Anodyne	TPP2	64	36
COC(=O)[C@H](C)Cc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450864066	ED	On-Demand	Anodyne	TIMP3	42	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1	ZINC000450864067	ED	On-Demand	Anodyne	TIMP3	42	32
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000450864070	CG	On-Demand	Anodyne	ACE	17	40
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000450864070	CG	On-Demand	Anodyne	DRD4	23	42
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000450864070	CG	On-Demand	Anodyne	TPP2	66	37
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000450864071	CG	On-Demand	Anodyne	ACE	17	40
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000450864071	CG	On-Demand	Anodyne	DRD4	23	42
Cc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000450864071	CG	On-Demand	Anodyne	TPP2	66	37
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000450864072	CG	On-Demand	Anodyne	ACE	17	40
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000450864072	CG	On-Demand	Anodyne	DRD4	23	42
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000450864072	CG	On-Demand	Anodyne	TPP2	66	37
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000450864073	CG	On-Demand	Anodyne	ACE	17	40
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000450864073	CG	On-Demand	Anodyne	DRD4	23	42
Cc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000450864073	CG	On-Demand	Anodyne	TPP2	66	37
Cc1cc(C)n(-c2cncc(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)n2)n1	ZINC000450864130	GG	On-Demand	Anodyne	TPP2	66	36
Cc1cc(C)n(-c2cncc(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)n2)n1	ZINC000450864135	GG	On-Demand	Anodyne	TPP2	66	36
Cc1cc(C)n(-c2cncc(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)n2)n1	ZINC000450864137	GG	On-Demand	Anodyne	TPP2	66	36
Cc1cc(C)n(-c2cncc(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)n2)n1	ZINC000450864139	GG	On-Demand	Anodyne	TPP2	66	36
CO[C@@H](C1CC1)[C@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450864167	EH	On-Demand	Anodyne	EGFR	41	39
COCc1nnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450864168	ED	On-Demand	Anodyne	TPP2	58	36
CO[C@H](C1CC1)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450864169	EH	On-Demand	Anodyne	EGFR	41	39
CO[C@H](C1CC1)[C@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450864171	EH	On-Demand	Anodyne	EGFR	41	39
CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864172	FF	On-Demand	Bother	TPP2	70	39
COCc1nnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s1	ZINC000450864173	ED	On-Demand	Anodyne	TPP2	58	36
CO[C@@H](C1CC1)[C@@H](C)Nc1ncnc2cc(Br)ccc12	ZINC000450864174	EH	On-Demand	Anodyne	EGFR	41	39
COCc1nnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450864176	ED	On-Demand	Anodyne	TPP2	58	36
CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864177	FF	On-Demand	Bother	TPP2	70	39
COCc1nnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s1	ZINC000450864179	ED	On-Demand	Anodyne	TPP2	58	36
CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864180	FF	On-Demand	Bother	TPP2	70	39
CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864184	FF	On-Demand	Bother	TPP2	70	39
COC(=O)c1coc(CN(C[C@H](O)COc2ccccc2)C(C)C)n1	ZINC000450864187	EE	On-Demand	Anodyne	ABCB1	15	43
Cc1cnc(C2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)s1	ZINC000450864188	EH	On-Demand	Anodyne	SLC18A3	15	41
COC(=O)c1coc(CN(C[C@@H](O)COc2ccccc2)C(C)C)n1	ZINC000450864190	EE	On-Demand	Anodyne	ABCB1	15	43
Cc1cnc(C2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)s1	ZINC000450864191	EH	On-Demand	Anodyne	SLC18A3	15	41
Cc1cnc(C2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)s1	ZINC000450864193	EH	On-Demand	Anodyne	SLC18A3	15	41
Cc1cnc(C2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)s1	ZINC000450864194	EH	On-Demand	Anodyne	SLC18A3	15	41
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ccc1C#N	ZINC000450864243	DE	On-Demand	Mild	TPP2	60	39
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ccc1C#N	ZINC000450864244	DE	On-Demand	Mild	TPP2	60	39
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1C#N	ZINC000450864246	DE	On-Demand	Mild	TPP2	60	39
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1C#N	ZINC000450864248	DE	On-Demand	Mild	TPP2	60	39
CCc1cc(N2CCN([C@@H](C)CC)CC2)nc(-c2ccccn2)n1	ZINC000450864291	EG	On-Demand	Anodyne	METAP1	40	35
CCc1cc(N2CCN([C@H](C)CC)CC2)nc(-c2ccccn2)n1	ZINC000450864293	EG	On-Demand	Anodyne	METAP1	40	35
CSc1cccc(C(=O)N2CCCC[C@H]2c2cnn(C)c2)c1	ZINC000450864299	DH	On-Demand	Anodyne	PREP	27	41
CSc1cccc(C(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1	ZINC000450864301	DH	On-Demand	Anodyne	PREP	21	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450864344	EF	On-Demand	Anodyne	BIRC2	32	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450864345	EF	On-Demand	Anodyne	BIRC2	32	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450864346	EF	On-Demand	Anodyne	BIRC2	32	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450864347	EF	On-Demand	Anodyne	BIRC2	32	41
CCc1nc(C)c(Cn2sc3ccccc3c2=O)o1	ZINC000450864356	CF	On-Demand	Anodyne	CASP7	48	39
COC(=O)c1cccc(N2CC(=O)N(CCSCc3ccccc3)C2=O)c1	ZINC000450864363	GG	On-Demand	Anodyne	CTSG	15	49
CC(=O)CCCCCn1sc2ccccc2c1=O	ZINC000450864371	CG	On-Demand	Anodyne	CASP3	0	50
CC(=O)CCCCCn1sc2ccccc2c1=O	ZINC000450864371	CG	On-Demand	Anodyne	MPI	0	41
CC(=O)CCCCCn1sc2ccccc2c1=O	ZINC000450864371	CG	On-Demand	Anodyne	CASP7	38	44
CC(=O)CCCCCn1sc2ccccc2c1=O	ZINC000450864371	CG	On-Demand	Anodyne	SRTA	0	53
CC(=O)CCCCCn1sc2ccccc2c1=O	ZINC000450864371	CG	On-Demand	Anodyne	PHOSPHO1	0	40
Cc1nc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450864374	EG	On-Demand	Bother	PRCP	42	36
Cc1nc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450864374	EG	On-Demand	Bother	KCNN3	25	47
Cc1nc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450864375	EG	On-Demand	Bother	PRCP	42	36
Cc1nc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450864375	EG	On-Demand	Bother	KCNN3	25	47
Cc1cccnc1OC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450864381	FG	On-Demand	Anodyne	SCN9A	0	44
Cc1cccnc1OC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450864381	FG	On-Demand	Anodyne	SCN5A	85	39
O=[N+]([O-])c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)s1	ZINC000450864408	EH	On-Demand	Bother	KCNN3	28	45
O=[N+]([O-])c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)s1	ZINC000450864410	EH	On-Demand	Bother	KCNN3	28	45
CCC(CC)(CCn1sc2ccccc2c1=O)C(=O)OC	ZINC000450864441	DG	On-Demand	Anodyne	CASP3	36	45
CCC(CC)(CCn1sc2ccccc2c1=O)C(=O)OC	ZINC000450864441	DG	On-Demand	Anodyne	MPI	0	44
CCC(CC)(CCn1sc2ccccc2c1=O)C(=O)OC	ZINC000450864441	DG	On-Demand	Anodyne	CASP7	25	41
CCC(CC)(CCn1sc2ccccc2c1=O)C(=O)OC	ZINC000450864441	DG	On-Demand	Anodyne	SRTA	0	45
CCC(CC)(CCn1sc2ccccc2c1=O)C(=O)OC	ZINC000450864441	DG	On-Demand	Anodyne	PHOSPHO1	0	44
CNS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450864489	FD	On-Demand	Anodyne	TPP2	63	35
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450864497	FD	On-Demand	Anodyne	TPP2	63	35
CNS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450864499	FD	On-Demand	Anodyne	TPP2	63	35
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450864501	FD	On-Demand	Anodyne	TPP2	63	35
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]c(-c2ccccn2)n1	ZINC000450864509	FG	On-Demand	Anodyne	TPP2	63	36
Cc1cc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]c(-c2ccccn2)n1	ZINC000450864511	FG	On-Demand	Anodyne	TPP2	63	36
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]c(-c2ccccn2)n1	ZINC000450864513	FG	On-Demand	Anodyne	TPP2	63	36
Cc1cc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]c(-c2ccccn2)n1	ZINC000450864515	FG	On-Demand	Anodyne	TPP2	63	36
COc1cc(CN2CCC(c3ncc(C)s3)CC2)ccc1Cl	ZINC000450864549	EI	On-Demand	Anodyne	DRD4	31	45
COc1cc(CN2CCC(c3ncc(C)s3)CC2)ccc1Cl	ZINC000450864549	EI	On-Demand	Anodyne	HRH1	18	44
COc1cc(CN2CCC(c3ncc(C)s3)CC2)ccc1Cl	ZINC000450864549	EI	On-Demand	Anodyne	SSTR5	77	44
C[C@@H](Sc1nnc(CCc2ccccc2)o1)C(=O)Nc1nccs1	ZINC000450864618	FG	On-Demand	Anodyne	MAP	0	47
C[C@@H](Sc1nnc(CCc2ccccc2)o1)C(=O)Nc1nccs1	ZINC000450864618	FG	On-Demand	Anodyne	MAP1	105	47
C[C@H](Sc1nnc(CCc2ccccc2)o1)C(=O)Nc1nccs1	ZINC000450864620	FG	On-Demand	Anodyne	MAP	0	47
C[C@H](Sc1nnc(CCc2ccccc2)o1)C(=O)Nc1nccs1	ZINC000450864620	FG	On-Demand	Anodyne	MAP1	105	47
Cc1ccc(C(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)cn1	ZINC000450864654	FG	On-Demand	Anodyne	IMDH_CRYPV	53	37
CCS(=O)(=O)c1ccc(CN(CC2CCC2)C(C)C)cc1	ZINC000450864657	DG	On-Demand	Anodyne	RORC	18	40
Cc1ccc(C(C)(C)NC(=O)c2ccc(-n3nnnc3C)cc2F)cn1	ZINC000450864672	FE	On-Demand	Anodyne	IMPDH2	17	54
CCCc1cc(=O)n2nc(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)sc2n1	ZINC000450864676	GE	On-Demand	Anodyne	TPP2	87	45
CCCc1cc(=O)n2nc(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)sc2n1	ZINC000450864679	GE	On-Demand	Anodyne	TPP2	87	45
CCCc1cc(=O)n2nc(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)sc2n1	ZINC000450864681	GE	On-Demand	Anodyne	TPP2	87	45
CCCc1cc(=O)n2nc(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)sc2n1	ZINC000450864684	GE	On-Demand	Anodyne	TPP2	87	45
COc1nc(C)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450864695	ED	On-Demand	Anodyne	DRD4	21	40
COc1nc(C)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450864695	ED	On-Demand	Anodyne	TPP2	58	37
COc1nc(C)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450864696	ED	On-Demand	Anodyne	DRD4	21	40
COc1nc(C)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450864696	ED	On-Demand	Anodyne	TPP2	58	37
COc1nc(C)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450864699	ED	On-Demand	Anodyne	DRD4	21	40
COc1nc(C)cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450864699	ED	On-Demand	Anodyne	TPP2	58	37
COc1nc(C)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450864700	ED	On-Demand	Anodyne	DRD4	21	40
COc1nc(C)cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450864700	ED	On-Demand	Anodyne	TPP2	58	37
O=C(NC[C@@H]1CCO[C@H]1c1ccc(F)cc1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450864716	FH	On-Demand	Anodyne	CACNA1G	30	40
O=C(NC[C@@H]1CCO[C@H]1c1ccc(F)cc1)[C@H]1CCN(c2ccccc2)C1	ZINC000450864717	FH	On-Demand	Anodyne	CACNA1G	30	40
CC[C@@H](C)N1CCN(c2ncnc3c2oc2ccccc23)CC1	ZINC000450864722	DG	On-Demand	Anodyne	HRH4	18	69
CC[C@H](C)N1CCN(c2ncnc3c2oc2ccccc23)CC1	ZINC000450864723	DG	On-Demand	Anodyne	HRH4	18	69
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	HTR1A	19	63
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	DRD2	41	59
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	DRD1	20	59
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	DRD4	29	59
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	HTR2A	36	60
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	HTR2C	18	59
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	DRD3	21	59
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	SLC6A3	15	45
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	ERG2	26	55
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	HTR7	33	59
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	SIGMAR1	46	60
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	CCR3	15	44
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	NPFFR2	18	40
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	SLC18A3	25	60
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	CYP2J2	61	43
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	NET	0	55
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	NPFFR1	23	40
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000450864791	FI	On-Demand	Anodyne	AP2S1	0	55
C[C@@H](SCCN(C)C)C(=O)Nc1nccs1	ZINC000450864798	CD	On-Demand	Anodyne	MAP	0	47
C[C@@H](SCCN(C)C)C(=O)Nc1nccs1	ZINC000450864798	CD	On-Demand	Anodyne	MAP1	133	46
C[C@H](SCCN(C)C)C(=O)Nc1nccs1	ZINC000450864799	CD	On-Demand	Anodyne	MAP	0	47
C[C@H](SCCN(C)C)C(=O)Nc1nccs1	ZINC000450864799	CD	On-Demand	Anodyne	MAP1	133	46
CCCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450864825	EF	On-Demand	Anodyne	TPP2	38	41
CCCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450864826	EF	On-Demand	Anodyne	TPP2	38	41
CCCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450864827	EF	On-Demand	Anodyne	TPP2	38	41
CCCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450864828	EF	On-Demand	Anodyne	TPP2	38	41
COC(=O)C1(CN[C@H](CC(F)(F)F)c2ccccc2C)CC1	ZINC000450864841	DH	On-Demand	Anodyne	CTSA	52	34
COC(=O)C1(CN[C@@H](CC(F)(F)F)c2ccccc2C)CC1	ZINC000450864842	DH	On-Demand	Anodyne	CTSA	52	34
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	HTR1A	26	66
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	THRA	0	40
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	DRD2	37	53
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	DRD1	34	56
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	DRD4	23	49
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	ADRA1D	22	44
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	HTR2A	46	70
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	HTR2C	31	66
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	DRD3	22	59
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	ERG2	24	53
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	THRB	0	40
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	SIGMAR1	22	61
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	CCR3	40	40
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	SLC18A3	0	51
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	HTR3B	0	50
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	CYP2J2	67	47
CCS(=O)(=O)C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450864851	EF	On-Demand	Anodyne	AP2S1	0	53
Cc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450864865	DE	On-Demand	Anodyne	TPP2	59	39
Cc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450864866	DE	On-Demand	Anodyne	TPP2	59	39
Cc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450864867	DE	On-Demand	Anodyne	TPP2	59	39
Cc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450864868	DE	On-Demand	Anodyne	TPP2	59	39
C[C@@H](N=c1[nH]nc(C2CC2)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864872	EF	On-Demand	Anodyne	TPP2	54	36
C[C@H](N=c1[nH]nc(C2CC2)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864873	EF	On-Demand	Anodyne	TPP2	54	36
C[C@H](N=c1[nH]nc(C2CC2)s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864874	EF	On-Demand	Anodyne	TPP2	54	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1[nH]nc(C2CC2)s1	ZINC000450864875	EF	On-Demand	Anodyne	TPP2	54	36
CC[C@H](O)[C@@H](CC)Nc1cc(NCC2CC2)ncn1	ZINC000450864882	CE	On-Demand	Anodyne	GPR39	0	43
CC[C@H](Nc1cc(NCC2CC2)ncn1)[C@H](O)CC	ZINC000450864883	CE	On-Demand	Anodyne	GPR39	0	43
CC[C@H](O)[C@H](CC)Nc1cc(NCC2CC2)ncn1	ZINC000450864884	CE	On-Demand	Anodyne	GPR39	0	43
CC[C@@H](O)[C@@H](CC)Nc1cc(NCC2CC2)ncn1	ZINC000450864885	CE	On-Demand	Anodyne	GPR39	0	43
COCCC(C)(C)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450864900	CE	On-Demand	Anodyne	HPGDS	18	44
C[C@H](N=c1cc[nH]cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864917	DF	On-Demand	Anodyne	DRD4	25	41
C[C@H](N=c1cc[nH]cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864917	DF	On-Demand	Anodyne	TPP2	63	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1cc[nH]cc1Cl	ZINC000450864918	DF	On-Demand	Anodyne	DRD4	25	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1cc[nH]cc1Cl	ZINC000450864918	DF	On-Demand	Anodyne	TPP2	63	37
C[C@H](N=c1cc[nH]cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864919	DF	On-Demand	Anodyne	DRD4	25	41
C[C@H](N=c1cc[nH]cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864919	DF	On-Demand	Anodyne	TPP2	63	37
C[C@@H](N=c1cc[nH]cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864920	DF	On-Demand	Anodyne	DRD4	25	41
C[C@@H](N=c1cc[nH]cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864920	DF	On-Demand	Anodyne	TPP2	63	37
C[C@@H](Nc1ccc(C#N)nc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864921	DF	On-Demand	Mild	TPP2	64	36
C[C@H](Nc1ccc(C#N)nc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864922	DF	On-Demand	Mild	TPP2	64	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C#N)nc1	ZINC000450864923	DF	On-Demand	Mild	TPP2	64	36
C[C@H](Nc1ccc(C#N)nc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864924	DF	On-Demand	Mild	TPP2	64	36
Cc1nc(C)c(F)c(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450864934	EE	On-Demand	Anodyne	DRD4	25	41
Cc1nc(C)c(F)c(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450864934	EE	On-Demand	Anodyne	TPP2	60	38
Cc1nc(C)c(F)c(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450864936	EE	On-Demand	Anodyne	DRD4	25	41
Cc1nc(C)c(F)c(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450864936	EE	On-Demand	Anodyne	TPP2	60	38
CCS(=O)(=O)c1ccc(CSc2nnc(CCc3ccccc3)o2)cc1	ZINC000450864937	GH	On-Demand	Anodyne	GSK3A	40	40
CCS(=O)(=O)c1ccc(CSc2nnc(CCc3ccccc3)o2)cc1	ZINC000450864937	GH	On-Demand	Anodyne	PTK2	23	40
Cc1nc(C)c(F)c(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450864938	EE	On-Demand	Anodyne	DRD4	25	41
Cc1nc(C)c(F)c(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450864938	EE	On-Demand	Anodyne	TPP2	60	38
Cc1nc(C)c(F)c(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450864940	EE	On-Demand	Anodyne	DRD4	25	41
Cc1nc(C)c(F)c(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450864940	EE	On-Demand	Anodyne	TPP2	60	38
COc1ccc(CNC(=O)CCn2cnc3cccc(F)c3c2=O)c(OC)c1	ZINC000450864946	GE	On-Demand	Anodyne	PDGFRB	43	40
COc1ccc(CNC(=O)CCn2cnc3cccc(F)c3c2=O)c(OC)c1	ZINC000450864946	GE	On-Demand	Anodyne	CSF1R	17	40
C[C@@H](Nc1cccc(C#N)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864952	DF	On-Demand	Mild	TPP2	59	38
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](CC(F)(F)F)C1	ZINC000450864953	DG	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](Nc1cccc(C#N)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864954	DF	On-Demand	Mild	TPP2	59	38
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](CC(F)(F)F)C1	ZINC000450864955	DG	On-Demand	Anodyne	SLC6A3	17	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cccc(C#N)n1	ZINC000450864956	DF	On-Demand	Mild	TPP2	59	38
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](CC(F)(F)F)C1	ZINC000450864957	DG	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](CC(F)(F)F)C1	ZINC000450864958	DG	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](Nc1cccc(C#N)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864959	DF	On-Demand	Mild	TPP2	59	38
C[C@@H](Nc1cc(C#N)ccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864961	DF	On-Demand	Mild	TPP2	63	36
C[C@H](Nc1cc(C#N)ccn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450864963	DF	On-Demand	Mild	TPP2	63	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cc(C#N)ccn1	ZINC000450864966	DF	On-Demand	Mild	TPP2	63	36
C[C@H](Nc1cc(C#N)ccn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450864968	DF	On-Demand	Mild	TPP2	63	36
CCOC(=O)c1ccnc(N[C@@H]2C[C@H]2c2cccc(OC)c2)c1[N+](=O)[O-]	ZINC000450865019	FG	On-Demand	Bother	CACNA1C	52	36
CCOC(=O)c1ccnc(N[C@@H]2C[C@H]2c2cccc(OC)c2)c1[N+](=O)[O-]	ZINC000450865019	FG	On-Demand	Bother	CACNA1D	82	36
COc1cccc([C@@H]2C[C@H]2Nc2ncc([N+](=O)[O-])cc2C(N)=O)c1	ZINC000450865021	EE	On-Demand	Bother	CACNA1C	40	35
COc1cccc([C@@H]2C[C@H]2Nc2ncc([N+](=O)[O-])cc2C(N)=O)c1	ZINC000450865021	EE	On-Demand	Bother	CACNA1D	72	35
CCc1cc(N[C@@H]2CCO[C@H](c3cccs3)C2)n2ncnc2n1	ZINC000450865033	EG	On-Demand	Anodyne	DHOD	0	43
CCc1cc(N[C@H]2CCO[C@@H](c3cccs3)C2)n2ncnc2n1	ZINC000450865036	EG	On-Demand	Anodyne	DHOD	0	43
CCc1cc(N[C@H]2CCO[C@H](c3cccs3)C2)n2ncnc2n1	ZINC000450865038	EG	On-Demand	Anodyne	DHOD	0	43
CO[C@@H](C1CC1)[C@H](C)Nc1ncnc2[nH]ccc12	ZINC000450865052	BE	On-Demand	Anodyne	JAK3	17	42
CO[C@H](C1CC1)[C@@H](C)Nc1ncnc2[nH]ccc12	ZINC000450865054	BE	On-Demand	Anodyne	JAK3	17	42
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)Cc2ccc(O)c(OC)c2)cn1	ZINC000450865055	FE	On-Demand	Anodyne	TRPV1	21	43
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)Cc2ccc(O)c(OC)c2)cn1	ZINC000450865055	FE	On-Demand	Anodyne	SSTR5	47	33
CO[C@H](C1CC1)[C@H](C)Nc1ncnc2[nH]ccc12	ZINC000450865056	BE	On-Demand	Anodyne	JAK3	17	42
CO[C@@H](C1CC1)[C@@H](C)Nc1ncnc2[nH]ccc12	ZINC000450865058	BE	On-Demand	Anodyne	JAK3	17	42
CC[C@@H](C)N1CCN(c2ccnc(C(C)C)n2)CC1	ZINC000450865110	CF	On-Demand	Anodyne	SORD	77	46
CC[C@H](C)N1CCN(c2ccnc(C(C)C)n2)CC1	ZINC000450865112	CF	On-Demand	Anodyne	SORD	77	46
COc1cccc([C@@H]2C[C@H]2Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])c1	ZINC000450865122	GG	On-Demand	Bother	HRH3	20	40
COc1cccc([C@@H]2C[C@H]2Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])c1	ZINC000450865122	GG	On-Demand	Bother	TAAR1	23	48
COCCS[C@H](C)C(=O)Nc1nccs1	ZINC000450865126	BD	On-Demand	Anodyne	MAP	0	54
COCCS[C@@H](C)C(=O)Nc1nccs1	ZINC000450865127	BD	On-Demand	Anodyne	MAP	0	54
COC(=O)c1csc(CN2CCC(Oc3ncccc3C)CC2)n1	ZINC000450865175	EF	On-Demand	Anodyne	SCN9A	0	40
COC(=O)c1csc(CN2CCC(Oc3ncccc3C)CC2)n1	ZINC000450865175	EF	On-Demand	Anodyne	SCN5A	78	38
CN(CCN1CCC2(CC1)CCN(C)C2=O)Cc1ccccc1	ZINC000450865178	DE	On-Demand	Anodyne	SIGMAR1	49	48
Cc1nc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ccc1[N+](=O)[O-]	ZINC000450865184	EH	On-Demand	Bother	PRCP	42	37
Cc1nc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ccc1[N+](=O)[O-]	ZINC000450865184	EH	On-Demand	Bother	KCNN3	32	47
Cc1nc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ccc1[N+](=O)[O-]	ZINC000450865185	EH	On-Demand	Bother	PRCP	42	37
Cc1nc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ccc1[N+](=O)[O-]	ZINC000450865185	EH	On-Demand	Bother	KCNN3	32	47
Cc1cc(N2CC(c3cccc(C(F)(F)F)c3)C2)n2ncnc2n1	ZINC000450865206	EG	On-Demand	Anodyne	DHOD	0	42
Cc1nc(C(C)C)oc1COc1ccc(Br)cc1C#N	ZINC000450865212	EI	On-Demand	Mild	XDH	58	39
Cc1cccc(Cl)c1CN1CCC2(CC1)CCN(C)C2=O	ZINC000450865241	DG	On-Demand	Anodyne	OPRL1	15	44
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	DRD2	33	44
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	DRD1	0	48
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	DRD4	23	53
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	HTR2A	31	56
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	HTR2C	29	58
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	SLC6A1	95	39
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	CCR3	24	40
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	SLC18A3	0	45
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	HTR3B	0	47
CS(=O)(=O)[C@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865269	EF	On-Demand	Anodyne	CYP2J2	55	39
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	DRD2	33	44
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	DRD1	0	48
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	DRD4	23	53
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	HTR2A	31	56
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	HTR2C	29	58
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	SLC6A1	95	39
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	CCR3	24	40
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	SLC18A3	0	45
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	HTR3B	0	47
CS(=O)(=O)[C@@H]1CCCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450865270	EF	On-Demand	Anodyne	CYP2J2	55	39
COc1cc(CC(=O)N[C@]2(CO)C[C@H](C)CC(C)(C)C2)ccc1O	ZINC000450865275	EF	On-Demand	Anodyne	TRPV1	25	43
COc1cc(CC(=O)N[C@@]2(CO)C[C@@H](C)CC(C)(C)C2)ccc1O	ZINC000450865276	EF	On-Demand	Anodyne	TRPV1	25	43
COc1cc(CC(=O)N[C@]2(CO)C[C@@H](C)CC(C)(C)C2)ccc1O	ZINC000450865277	EF	On-Demand	Anodyne	TRPV1	25	43
COc1cc(CC(=O)N[C@@]2(CO)C[C@H](C)CC(C)(C)C2)ccc1O	ZINC000450865278	EF	On-Demand	Anodyne	TRPV1	25	43
CCS(=O)(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450865304	DF	On-Demand	Anodyne	DRD4	26	42
CCS(=O)(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450865304	DF	On-Demand	Anodyne	SLC6A1	0	42
CCS(=O)(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450865304	DF	On-Demand	Anodyne	SIGMAR1	35	48
CCS(=O)(=O)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450865304	DF	On-Demand	Anodyne	KCNJ1	32	41
Cc1ccc(C(=O)N2CCN(C)[C@@H](c3nccn3C)C2)c(Cl)c1Cl	ZINC000450865354	FG	On-Demand	Anodyne	P2RX7	25	40
CCOC(=O)c1cn(CCC[C@@H](C)O)c2cc(Br)ccc2c1=O	ZINC000450865357	GG	On-Demand	Anodyne	CNR1	0	47
CCOC(=O)c1cn(CCC[C@@H](C)O)c2cc(Br)ccc2c1=O	ZINC000450865357	GG	On-Demand	Anodyne	CNR2	23	47
CCOC(=O)c1cn(CCC[C@H](C)O)c2cc(Br)ccc2c1=O	ZINC000450865358	GG	On-Demand	Anodyne	CNR1	0	47
CCOC(=O)c1cn(CCC[C@H](C)O)c2cc(Br)ccc2c1=O	ZINC000450865358	GG	On-Demand	Anodyne	CNR2	23	47
C[C@](CO)(NC(=O)CNC(=O)Nc1cccc(Cl)c1)C1CCCCC1	ZINC000450865366	FF	On-Demand	Anodyne	CCKAR	24	45
C[C@@](CO)(NC(=O)CNC(=O)Nc1cccc(Cl)c1)C1CCCCC1	ZINC000450865367	FF	On-Demand	Anodyne	CCKAR	24	45
CCOC(=O)c1cn(C[C@@H]2COCCO2)c2cc(Br)ccc2c1=O	ZINC000450865374	GE	On-Demand	Anodyne	CNR2	15	49
CCOC(=O)c1cn(C[C@H]2COCCO2)c2cc(Br)ccc2c1=O	ZINC000450865375	GE	On-Demand	Anodyne	CNR2	15	49
COc1cc(CC(=O)NC(C)(C)c2ccc(C)nc2)ccc1Cl	ZINC000450865376	EH	On-Demand	Anodyne	TRPV1	39	45
COc1cc(CC(=O)NC(C)(C)c2ccc(C)nc2)ccc1Cl	ZINC000450865376	EH	On-Demand	Anodyne	CAN2	0	41
C[C@@H](Nc1ncncc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865378	DF	On-Demand	Anodyne	DRD4	24	40
C[C@@H](Nc1ncncc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865378	DF	On-Demand	Anodyne	TPP2	65	36
C[C@H](Nc1ncncc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865379	DF	On-Demand	Anodyne	DRD4	24	40
C[C@H](Nc1ncncc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865379	DF	On-Demand	Anodyne	TPP2	65	36
C[C@H](Nc1ncncc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450865380	DF	On-Demand	Anodyne	DRD4	24	40
C[C@H](Nc1ncncc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450865380	DF	On-Demand	Anodyne	TPP2	65	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncncc1Cl	ZINC000450865381	DF	On-Demand	Anodyne	DRD4	24	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncncc1Cl	ZINC000450865381	DF	On-Demand	Anodyne	TPP2	65	36
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1	ZINC000450865382	FG	On-Demand	Anodyne	ACE	22	41
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1	ZINC000450865382	FG	On-Demand	Anodyne	DRD4	24	40
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1	ZINC000450865382	FG	On-Demand	Anodyne	TPP2	71	42
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1	ZINC000450865383	FG	On-Demand	Anodyne	ACE	22	41
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1	ZINC000450865383	FG	On-Demand	Anodyne	DRD4	24	40
CCS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1	ZINC000450865383	FG	On-Demand	Anodyne	TPP2	71	42
CCS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1	ZINC000450865384	FG	On-Demand	Anodyne	ACE	22	41
CCS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1	ZINC000450865384	FG	On-Demand	Anodyne	DRD4	24	40
CCS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1	ZINC000450865384	FG	On-Demand	Anodyne	TPP2	71	42
CCS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1	ZINC000450865385	FG	On-Demand	Anodyne	ACE	22	41
CCS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1	ZINC000450865385	FG	On-Demand	Anodyne	DRD4	24	40
CCS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1	ZINC000450865385	FG	On-Demand	Anodyne	TPP2	71	42
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450865386	EG	On-Demand	Anodyne	AMY2	47	33
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@](C)(CO)C1CCCCC1	ZINC000450865386	EG	On-Demand	Anodyne	CTSV	44	31
Cn1nc(-c2ccccc2)cc1C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450865387	EG	On-Demand	Anodyne	AMY2	47	33
Cn1nc(-c2ccccc2)cc1C(=O)N[C@](C)(CO)C1CCCCC1	ZINC000450865387	EG	On-Demand	Anodyne	CTSV	44	31
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450865415	EG	On-Demand	Bother	TPP2	60	38
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450865416	EG	On-Demand	Bother	TPP2	60	38
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450865417	EG	On-Demand	Bother	TPP2	60	38
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450865418	EG	On-Demand	Bother	TPP2	60	38
Cc1ccc(F)c(CN[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c1	ZINC000450865419	DE	On-Demand	Anodyne	SSTR3	23	40
Cc1ccc(F)c(CN[C@H]2CCCC[C@@H]2NS(C)(=O)=O)c1	ZINC000450865420	DE	On-Demand	Anodyne	SSTR3	23	40
Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c1	ZINC000450865421	DE	On-Demand	Anodyne	SSTR3	23	40
Cc1ccc(F)c(CN[C@H]2CCCC[C@H]2NS(C)(=O)=O)c1	ZINC000450865422	DE	On-Demand	Anodyne	SSTR3	23	40
FC(F)(F)C[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450865437	CI	On-Demand	Anodyne	SIGMAR1	16	44
CC[C@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)[C@H](O)CC	ZINC000450865445	GI	On-Demand	Anodyne	NPBWR1	44	36
CC[C@H](O)[C@H](CC)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450865446	GI	On-Demand	Anodyne	NPBWR1	44	36
CC[C@H](O)[C@@H](CC)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450865447	GI	On-Demand	Anodyne	NPBWR1	44	36
CC[C@@H](O)[C@@H](CC)Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl	ZINC000450865448	GI	On-Demand	Anodyne	NPBWR1	44	36
CSCc1ccccc1NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450865451	FH	On-Demand	Anodyne	PDEC	0	40
CSCc1ccccc1NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450865452	FH	On-Demand	Anodyne	PDEC	0	40
FC(F)(F)C[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450865460	CI	On-Demand	Anodyne	SIGMAR1	16	44
FC(F)(F)C[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450865461	CI	On-Demand	Anodyne	SIGMAR1	16	44
FC(F)(F)C[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450865463	CI	On-Demand	Anodyne	SIGMAR1	16	44
Cc1nccc(N2CCN(C(=O)[C@@H](O)C3CCC3)CC2)n1	ZINC000450865465	CC	On-Demand	Anodyne	SORD	51	38
Cc1nccc(N2CCN(C(=O)[C@H](O)C3CCC3)CC2)n1	ZINC000450865467	CC	On-Demand	Anodyne	SORD	51	38
CC[C@@H](C)N1CCN(c2nc(C(F)F)nc3ccccc23)CC1	ZINC000450865486	DG	On-Demand	Anodyne	SORD	42	40
CC[C@H](C)N1CCN(c2nc(C(F)F)nc3ccccc23)CC1	ZINC000450865487	DG	On-Demand	Anodyne	SORD	42	40
CCOCCSCc1cccc(C(C)=O)c1	ZINC000450865488	BG	On-Demand	Anodyne	CACNA2D1	25	40
CC[C@@H](C)N1CCN(c2nc3cc(F)ccc3o2)CC1	ZINC000450865495	CF	On-Demand	Anodyne	SORD	17	40
CC[C@H](C)N1CCN(c2nc3cc(F)ccc3o2)CC1	ZINC000450865496	CF	On-Demand	Anodyne	SORD	17	40
COc1ccc(-c2noc(N[C@@H](C)[C@H](OC)C3CC3)n2)cc1	ZINC000450865505	DE	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc(-c2noc(N[C@@H](C)[C@@H](OC)C3CC3)n2)cc1	ZINC000450865506	DE	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc(-c2noc(N[C@H](C)[C@@H](OC)C3CC3)n2)cc1	ZINC000450865507	DE	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc(-c2noc(N[C@H](C)[C@H](OC)C3CC3)n2)cc1	ZINC000450865508	DE	On-Demand	Anodyne	LUCI_PHOPE	21	41
CCn1nnc(C)c1CSc1nnc(CCc2ccccc2)o1	ZINC000450865516	EG	On-Demand	Anodyne	PTK2	26	41
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)c2cc(Cl)c3ccccc3n2)cn1	ZINC000450865519	GH	On-Demand	Anodyne	SSTR3	21	43
COC(=O)c1cccc(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)c1Cl	ZINC000450865546	FG	On-Demand	Anodyne	SLC6A1	64	33
COC(=O)c1cccc(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)c1Cl	ZINC000450865546	FG	On-Demand	Anodyne	BIRC2	42	36
COC(=O)c1cccc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)c1Cl	ZINC000450865547	FG	On-Demand	Anodyne	SLC6A1	64	33
COC(=O)c1cccc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)c1Cl	ZINC000450865547	FG	On-Demand	Anodyne	BIRC2	42	36
COC(=O)c1cccc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)c1Cl	ZINC000450865549	FG	On-Demand	Anodyne	SLC6A1	64	33
COC(=O)c1cccc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)c1Cl	ZINC000450865549	FG	On-Demand	Anodyne	BIRC2	42	36
COC(=O)c1cccc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)c1Cl	ZINC000450865551	FG	On-Demand	Anodyne	SLC6A1	64	33
COC(=O)c1cccc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)c1Cl	ZINC000450865551	FG	On-Demand	Anodyne	BIRC2	42	36
CC[C@@H](C)N1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1	ZINC000450865578	EF	On-Demand	Bother	KCNJ1	18	42
CC[C@H](C)N1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1	ZINC000450865580	EF	On-Demand	Bother	KCNJ1	18	42
CC[C@@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865583	ED	On-Demand	Anodyne	ADRA1D	17	52
CC[C@@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865583	ED	On-Demand	Anodyne	ADRA1B	47	59
CC[C@@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865583	ED	On-Demand	Anodyne	HRH4	15	45
CC[C@@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865583	ED	On-Demand	Anodyne	CCR4	44	40
CC[C@@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865583	ED	On-Demand	Anodyne	PDE3B	52	34
CC[C@@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865583	ED	On-Demand	Anodyne	EHMT2	80	42
CC[C@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865585	ED	On-Demand	Anodyne	ADRA1D	17	52
CC[C@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865585	ED	On-Demand	Anodyne	ADRA1B	47	59
CC[C@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865585	ED	On-Demand	Anodyne	HRH4	15	45
CC[C@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865585	ED	On-Demand	Anodyne	CCR4	44	40
CC[C@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865585	ED	On-Demand	Anodyne	PDE3B	52	34
CC[C@H](C)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450865585	ED	On-Demand	Anodyne	EHMT2	80	42
CCS(=O)(=O)c1ccc(CSCC(=O)OC(C)C)cc1	ZINC000450865624	DF	On-Demand	Anodyne	LTA4H	34	42
CCS(=O)(=O)c1ccc(CSCC(=O)OC(C)C)cc1	ZINC000450865624	DF	On-Demand	Anodyne	RORC	43	36
Cc1ccc(C(=O)N2CCN(C)[C@H](c3nccn3C)C2)c(Cl)c1Cl	ZINC000450865655	FG	On-Demand	Anodyne	P2RX7	25	40
OC1CCN(CCNc2nccc(OCc3ccccc3)n2)CC1	ZINC000450865656	ED	On-Demand	Anodyne	GRIN2B	38	44
N#Cc1cccc(C#N)c1NCCN1CCC(O)CC1	ZINC000450865700	CD	On-Demand	Mild	DRD4	42	34
Cc1nnc2c3ccccc3c(N[C@@H]3C[C@H](OC(C)(C)C)[C@@H]3n3cccn3)nn12	ZINC000450865702	GF	On-Demand	Anodyne	CREBBP	40	31
Cc1nnc2c3ccccc3c(N[C@@H]3C[C@H](OC(C)(C)C)[C@@H]3n3cccn3)nn12	ZINC000450865702	GF	On-Demand	Anodyne	BRD9	50	32
Cc1nnc2c3ccccc3c(N[C@@H]3C[C@@H](OC(C)(C)C)[C@H]3n3cccn3)nn12	ZINC000450865705	GF	On-Demand	Anodyne	CREBBP	40	31
Cc1nnc2c3ccccc3c(N[C@@H]3C[C@@H](OC(C)(C)C)[C@H]3n3cccn3)nn12	ZINC000450865705	GF	On-Demand	Anodyne	BRD9	50	32
COC(=O)c1coc(CN2CCC(Oc3ncccc3C)CC2)n1	ZINC000450865707	EE	On-Demand	Anodyne	SCN5A	54	33
Cc1nnc2c3ccccc3c(N[C@@H]3C[C@@H](OC(C)(C)C)[C@@H]3n3cccn3)nn12	ZINC000450865708	GF	On-Demand	Anodyne	CREBBP	40	31
Cc1nnc2c3ccccc3c(N[C@@H]3C[C@@H](OC(C)(C)C)[C@@H]3n3cccn3)nn12	ZINC000450865708	GF	On-Demand	Anodyne	BRD9	50	32
CCN(C(=O)CNS(=O)(=O)NC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450865709	FC	On-Demand	Anodyne	DRD4	34	41
CCN(C(=O)CNS(=O)(=O)NC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450865709	FC	On-Demand	Anodyne	SIGMAR1	45	41
CCN(C(=O)CNS(=O)(=O)NC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450865709	FC	On-Demand	Anodyne	CCR5	50	50
Cc1nnc2c3ccccc3c(N[C@@H]3C[C@H](OC(C)(C)C)[C@H]3n3cccn3)nn12	ZINC000450865710	GF	On-Demand	Anodyne	CREBBP	40	31
Cc1nnc2c3ccccc3c(N[C@@H]3C[C@H](OC(C)(C)C)[C@H]3n3cccn3)nn12	ZINC000450865710	GF	On-Demand	Anodyne	BRD9	50	32
CCOC(=O)c1n[nH]c(C2CCN(CC/C=C\c3ccccc3)CC2)n1	ZINC000450865717	FG	On-Demand	Anodyne	CACNA1B	50	34
CCOC(=O)c1n[nH]c(C2CCN(CC/C=C/c3ccccc3)CC2)n1	ZINC000450865718	FG	On-Demand	Anodyne	CACNA1B	50	34
CCS(=O)(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450865719	FF	On-Demand	Anodyne	DRD2	0	42
CCS(=O)(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450865719	FF	On-Demand	Anodyne	DRD4	26	42
CCS(=O)(=O)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450865719	FF	On-Demand	Anodyne	SIGMAR1	46	37
CCN(C(=O)CNS(=O)(=O)NC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450865725	FC	On-Demand	Anodyne	DRD4	34	41
CCN(C(=O)CNS(=O)(=O)NC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450865725	FC	On-Demand	Anodyne	SIGMAR1	45	41
CCN(C(=O)CNS(=O)(=O)NC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450865725	FC	On-Demand	Anodyne	CCR5	50	50
CCCC[C@@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450865729	FI	On-Demand	Anodyne	CCKAR	0	40
CCCC[C@@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450865729	FI	On-Demand	Anodyne	CCKBR	28	40
CCCC[C@@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450865729	FI	On-Demand	Anodyne	NOD1	60	34
CCCC[C@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450865730	FI	On-Demand	Anodyne	CCKAR	0	40
CCCC[C@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450865730	FI	On-Demand	Anodyne	CCKBR	28	40
CCCC[C@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)OC	ZINC000450865730	FI	On-Demand	Anodyne	NOD1	60	34
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	KIT	18	45
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	F2R	0	47
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	ATF1	41	36
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	KDR	25	48
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	NR1H4	0	40
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	MTTP	63	39
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	TEK	31	43
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	BTK	23	45
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	TRPM4	0	41
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	KCNK3	95	55
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	KCNK9	87	55
C[C@@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865745	FI	On-Demand	Anodyne	PDS	41	40
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccccc1	ZINC000450865749	FH	On-Demand	Anodyne	DRD2	33	47
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccccc1	ZINC000450865749	FH	On-Demand	Anodyne	DRD4	22	47
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccccc1	ZINC000450865749	FH	On-Demand	Anodyne	SIGMAR1	45	44
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccccc1	ZINC000450865749	FH	On-Demand	Anodyne	SLC18A3	26	48
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccccc1	ZINC000450865749	FH	On-Demand	Anodyne	CYP2J2	63	44
O=C(CCCN1CCC(CO)(Cc2ccccc2)CC1)c1ccccc1	ZINC000450865749	FH	On-Demand	Anodyne	NPFFR1	38	43
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	KIT	18	45
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	F2R	0	47
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	ATF1	41	36
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	KDR	25	48
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	NR1H4	0	40
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	MTTP	63	39
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	TEK	31	43
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	BTK	23	45
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	TRPM4	0	41
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	KCNK3	95	55
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	KCNK9	87	55
C[C@H](O)CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450865750	FI	On-Demand	Anodyne	PDS	41	40
Cc1cccnc1OC1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450865779	DI	On-Demand	Anodyne	SCN5A	42	32
Cc1cccnc1OC1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450865782	DI	On-Demand	Anodyne	SCN5A	42	32
Brc1cncnc1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450865816	FH	On-Demand	Anodyne	PRCP	48	42
Brc1cncnc1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450865816	FH	On-Demand	Anodyne	KCNN3	33	48
Brc1cncnc1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450865817	FH	On-Demand	Anodyne	PRCP	48	42
Brc1cncnc1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450865817	FH	On-Demand	Anodyne	KCNN3	33	48
Cc1ccc2ncnc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)c2c1	ZINC000450865819	EG	On-Demand	Anodyne	PDE3A	45	36
Cc1ccc2ncnc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)c2c1	ZINC000450865819	EG	On-Demand	Anodyne	HTT	0	47
Cc1ccc2ncnc(N3CCN(CC(F)(F)F)C[C@H](C)C3)c2c1	ZINC000450865820	EG	On-Demand	Anodyne	PDE3A	45	36
Cc1ccc2ncnc(N3CCN(CC(F)(F)F)C[C@H](C)C3)c2c1	ZINC000450865820	EG	On-Demand	Anodyne	HTT	0	47
COC1(CO)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450865828	CD	On-Demand	Anodyne	SIGMAR1	29	45
COC1(CO)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450865828	CD	On-Demand	Anodyne	CCR8	44	46
COC1(CO)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450865828	CD	On-Demand	Anodyne	NPFFR1	48	38
Cc1cccc(C)c1[C@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450865837	FJ	On-Demand	Anodyne	TIMP3	54	33
Cc1cccc(C)c1[C@@H](C)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450865838	FJ	On-Demand	Anodyne	TIMP3	54	33
FC(F)Oc1cccc(CSCc2cc[nH]n2)c1	ZINC000450865855	CG	On-Demand	Anodyne	CACNA2D1	0	41
C[C@@H](O)CCn1nnnc1CCCc1ccccc1	ZINC000450865861	CD	On-Demand	Anodyne	DAGLA	29	42
C[C@H](O)CCn1nnnc1CCCc1ccccc1	ZINC000450865862	CD	On-Demand	Anodyne	DAGLA	29	42
C[C@H](Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865871	GE	On-Demand	Bother	DRD4	18	43
C[C@H](Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865871	GE	On-Demand	Bother	TPP2	55	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450865872	GE	On-Demand	Bother	DRD4	18	43
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1	ZINC000450865872	GE	On-Demand	Bother	TPP2	55	34
C[C@H](Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450865873	GE	On-Demand	Bother	DRD4	18	43
C[C@H](Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450865873	GE	On-Demand	Bother	TPP2	55	34
C[C@@H](Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865874	GE	On-Demand	Bother	DRD4	18	43
C[C@@H](Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865874	GE	On-Demand	Bother	TPP2	55	34
COc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450865875	DE	On-Demand	Anodyne	DRD4	20	41
COc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450865875	DE	On-Demand	Anodyne	TPP2	61	39
COc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450865876	DE	On-Demand	Anodyne	DRD4	20	41
COc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450865876	DE	On-Demand	Anodyne	TPP2	61	39
COc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450865877	DE	On-Demand	Anodyne	DRD4	20	41
COc1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450865877	DE	On-Demand	Anodyne	TPP2	61	39
COc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450865878	DE	On-Demand	Anodyne	DRD4	20	41
COc1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450865878	DE	On-Demand	Anodyne	TPP2	61	39
C[C@@H](Nc1ncc(Cl)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865885	DF	On-Demand	Anodyne	DRD4	26	44
C[C@@H](Nc1ncc(Cl)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865885	DF	On-Demand	Anodyne	TPP2	70	39
C[C@H](Nc1ncc(Cl)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865886	DF	On-Demand	Anodyne	DRD4	26	44
C[C@H](Nc1ncc(Cl)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865886	DF	On-Demand	Anodyne	TPP2	70	39
C[C@H](Nc1ncc(Cl)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450865887	DF	On-Demand	Anodyne	DRD4	26	44
C[C@H](Nc1ncc(Cl)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450865887	DF	On-Demand	Anodyne	TPP2	70	39
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(Cl)cn1	ZINC000450865888	DF	On-Demand	Anodyne	DRD4	26	44
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(Cl)cn1	ZINC000450865888	DF	On-Demand	Anodyne	TPP2	70	39
CSCc1ccccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450865899	FI	On-Demand	Anodyne	F10	27	41
CSCc1ccccc1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450865899	FI	On-Demand	Anodyne	GCK	23	42
CC[C@@H](O)CC(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450865904	CE	On-Demand	Anodyne	SLC1A1	49	41
CC[C@@H](O)CC(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450865904	CE	On-Demand	Anodyne	SLC1A3	50	38
CC[C@@H](O)CC(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450865904	CE	On-Demand	Anodyne	SLC1A2	62	42
CC[C@H](O)CC(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450865905	CE	On-Demand	Anodyne	SLC1A1	49	41
CC[C@H](O)CC(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450865905	CE	On-Demand	Anodyne	SLC1A3	50	38
CC[C@H](O)CC(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450865905	CE	On-Demand	Anodyne	SLC1A2	62	42
CC[C@H](O)CC(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450865906	CE	On-Demand	Anodyne	SLC1A1	49	41
CC[C@H](O)CC(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450865906	CE	On-Demand	Anodyne	SLC1A3	50	38
CC[C@H](O)CC(=O)Nc1ccc(C[C@@H](C)C(=O)OC)cc1	ZINC000450865906	CE	On-Demand	Anodyne	SLC1A2	62	42
CC[C@@H](O)CC(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450865907	CE	On-Demand	Anodyne	SLC1A1	49	41
CC[C@@H](O)CC(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450865907	CE	On-Demand	Anodyne	SLC1A3	50	38
CC[C@@H](O)CC(=O)Nc1ccc(C[C@H](C)C(=O)OC)cc1	ZINC000450865907	CE	On-Demand	Anodyne	SLC1A2	62	42
Cc1cccc(Cl)c1CN[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450865914	EF	On-Demand	Anodyne	EIF2AK1	40	34
Cc1cccc(Cl)c1CN[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450865915	EF	On-Demand	Anodyne	EIF2AK1	40	34
Cc1cccc(Cl)c1CN[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450865916	EF	On-Demand	Anodyne	EIF2AK1	40	34
Cc1cccc(Cl)c1CN[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450865917	EF	On-Demand	Anodyne	EIF2AK1	40	34
C[C@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865918	EF	On-Demand	Bother	DRD4	20	47
C[C@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865918	EF	On-Demand	Bother	TPP2	62	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])cn1	ZINC000450865919	EF	On-Demand	Bother	DRD4	20	47
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])cn1	ZINC000450865919	EF	On-Demand	Bother	TPP2	62	35
C[C@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450865920	EF	On-Demand	Bother	DRD4	20	47
C[C@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450865920	EF	On-Demand	Bother	TPP2	62	35
C[C@@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865921	EF	On-Demand	Bother	DRD4	20	47
C[C@@H](Nc1ccc([N+](=O)[O-])cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450865921	EF	On-Demand	Bother	TPP2	62	35
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)[C@H](O)CC	ZINC000450865933	EF	On-Demand	Anodyne	NPBWR1	41	41
CC[C@H](O)[C@@H](CC)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450865934	EF	On-Demand	Anodyne	NPBWR1	41	41
CC[C@@H](O)[C@@H](CC)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450865935	EF	On-Demand	Anodyne	NPBWR1	41	41
CC[C@H](O)[C@H](CC)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450865936	EF	On-Demand	Anodyne	NPBWR1	41	41
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865942	GG	On-Demand	Bother	COLA	62	33
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865942	GG	On-Demand	Bother	BCL2L1	110	38
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865942	GG	On-Demand	Bother	BCL2	95	38
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865942	GG	On-Demand	Bother	LIMK2	42	35
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450865943	GG	On-Demand	Bother	COLA	62	33
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450865943	GG	On-Demand	Bother	BCL2L1	110	38
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450865943	GG	On-Demand	Bother	BCL2	95	38
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450865943	GG	On-Demand	Bother	LIMK2	42	35
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865944	GG	On-Demand	Bother	COLA	62	33
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865944	GG	On-Demand	Bother	BCL2L1	110	38
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865944	GG	On-Demand	Bother	BCL2	95	38
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865944	GG	On-Demand	Bother	LIMK2	42	35
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865945	GG	On-Demand	Bother	COLA	62	33
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865945	GG	On-Demand	Bother	BCL2L1	110	38
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865945	GG	On-Demand	Bother	BCL2	95	38
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000450865945	GG	On-Demand	Bother	LIMK2	42	35
CCOC(=O)c1cc(N2CCN([C@H](C)CC)CC2)ccc1[N+](=O)[O-]	ZINC000450865972	EF	On-Demand	Bother	GYRB	0	42
CCOC(=O)c1cc(N2CCN([C@@H](C)CC)CC2)ccc1[N+](=O)[O-]	ZINC000450865973	EF	On-Demand	Bother	GYRB	0	42
Cc1nccc(N2CCN(C(=O)C3=C(c4ccccc4)CCC3)CC2)n1	ZINC000450865974	EG	On-Demand	Anodyne	SORD	66	37
Cc1nccc(N2CCN(C(=O)C3=C(c4ccccc4)CCC3)CC2)n1	ZINC000450865974	EG	On-Demand	Anodyne	SLC6A7	0	46
CO[C@H](C1CC1)[C@@H](C)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450865996	EG	On-Demand	Anodyne	NPBWR1	56	43
CO[C@H](C1CC1)[C@H](C)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450865997	EG	On-Demand	Anodyne	NPBWR1	56	43
CO[C@@H](C1CC1)[C@@H](C)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450865998	EG	On-Demand	Anodyne	NPBWR1	56	43
CO[C@@H](C1CC1)[C@H](C)Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450865999	EG	On-Demand	Anodyne	NPBWR1	56	43
COC(=O)c1ccc(CN2CCC(c3ncc(C)s3)CC2)cc1Cl	ZINC000450866051	FI	On-Demand	Anodyne	SIGMAR1	20	41
COC(=O)c1ccc(CN2CCC(c3ncc(C)s3)CC2)cc1Cl	ZINC000450866051	FI	On-Demand	Anodyne	SSTR5	64	41
COC(=O)c1ccc(CN2CCC(c3ncc(C)s3)CC2)cc1Cl	ZINC000450866051	FI	On-Demand	Anodyne	CCR3	23	41
COC(=O)c1ccc(CN2CCC(c3ncc(C)s3)CC2)cc1Cl	ZINC000450866051	FI	On-Demand	Anodyne	MCHR1	37	43
COC(=O)c1cc(C)nc(N[C@@H]2C[C@H]2c2cccc(OC)c2)c1[N+](=O)[O-]	ZINC000450866064	FG	On-Demand	Bother	CACNA1D	62	36
COC(=O)c1ccc(-c2nnn(CC3(OC)CCC3)n2)cc1	ZINC000450866066	DD	On-Demand	Anodyne	SCARB1	47	37
COC(=O)c1ccc(-c2nnn(CC3(C)CCC3)n2)cc1	ZINC000450866072	CE	On-Demand	Anodyne	SCARB1	48	37
COc1cccc([C@@H]2C[C@H]2Nc2ccc([N+](=O)[O-])cc2S(N)(=O)=O)c1	ZINC000450866102	FE	On-Demand	Bother	TBXA2R	15	42
COc1cccc([C@@H]2C[C@H]2Nc2ccc([N+](=O)[O-])cc2S(N)(=O)=O)c1	ZINC000450866102	FE	On-Demand	Bother	CACNA1D	59	34
OCC1(Cc2ccccc2)CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450866126	EI	On-Demand	Anodyne	SLC12A5	50	36
OCC1(Cc2ccccc2)CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450866132	EI	On-Demand	Anodyne	SLC12A5	50	36
CC(C)c1nc(NCCN2CCC(O)CC2)nc(N(C)C)n1	ZINC000450866165	DC	On-Demand	Anodyne	P2RX2	17	41
COc1cccc([C@@H]2C[C@H]2Nc2cc([N+](=O)[O-])ccc2S(N)(=O)=O)c1	ZINC000450866170	FE	On-Demand	Bother	CACNA1D	59	34
COc1ccc2nc(C(F)(F)F)nc(NCCN3CCC(O)CC3)c2c1	ZINC000450866195	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccc2nc(C(F)(F)F)nc(NCCN3CCC(O)CC3)c2c1	ZINC000450866195	FD	On-Demand	Anodyne	SLC2A1	15	41
COc1ccc2nc(C(F)(F)F)nc(NCCN3CCC(O)CC3)c2c1	ZINC000450866195	FD	On-Demand	Anodyne	CARM1	44	31
Cc1ccc(C(C)(C)NC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)cn1	ZINC000450866201	FJ	On-Demand	Anodyne	PRCP	50	39
Cc1ccc(C(C)(C)NC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)cn1	ZINC000450866206	FJ	On-Demand	Anodyne	PRCP	50	39
Cc1ccc(C(C)(C)NC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)cn1	ZINC000450866208	FJ	On-Demand	Anodyne	PRCP	50	39
Cc1ccc(C(C)(C)NC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)cn1	ZINC000450866210	FJ	On-Demand	Anodyne	PRCP	50	39
CC(C)N=c1[nH]c(=NCCO)[nH]c(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]1	ZINC000450866230	GC	On-Demand	Anodyne	ACE	20	41
CC(C)N=c1[nH]c(=NCCO)[nH]c(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]1	ZINC000450866230	GC	On-Demand	Anodyne	TPP2	61	38
CC(C)N=c1[nH]c(=NCCO)[nH]c(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]1	ZINC000450866231	GC	On-Demand	Anodyne	ACE	20	41
CC(C)N=c1[nH]c(=NCCO)[nH]c(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]1	ZINC000450866231	GC	On-Demand	Anodyne	TPP2	61	38
CC(C)N=c1[nH]c(=NCCO)[nH]c(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]1	ZINC000450866232	GC	On-Demand	Anodyne	ACE	20	41
CC(C)N=c1[nH]c(=NCCO)[nH]c(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)[nH]1	ZINC000450866232	GC	On-Demand	Anodyne	TPP2	61	38
CC(C)N=c1[nH]c(=NCCO)[nH]c(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]1	ZINC000450866234	GC	On-Demand	Anodyne	ACE	20	41
CC(C)N=c1[nH]c(=NCCO)[nH]c(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)[nH]1	ZINC000450866234	GC	On-Demand	Anodyne	TPP2	61	38
C[C@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866238	EF	On-Demand	Bother	DRD4	20	40
C[C@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866238	EF	On-Demand	Bother	TPP2	69	38
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])nc1	ZINC000450866239	EF	On-Demand	Bother	DRD4	20	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])nc1	ZINC000450866239	EF	On-Demand	Bother	TPP2	69	38
C[C@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450866240	EF	On-Demand	Bother	DRD4	20	40
C[C@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450866240	EF	On-Demand	Bother	TPP2	69	38
C[C@@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866241	EF	On-Demand	Bother	DRD4	20	40
C[C@@H](Nc1ccc([N+](=O)[O-])nc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866241	EF	On-Demand	Bother	TPP2	69	38
CC(C)c1cc(NCCN2CCC(O)CC2)nc(C(C)C)n1	ZINC000450866245	DE	On-Demand	Anodyne	P2RX2	17	42
CC(C)c1nnc(Cn2nnnc2CCCc2ccccc2)s1	ZINC000450866249	EF	On-Demand	Anodyne	DAGLA	27	41
C[C@@H](O)CCN1C[C@@H](c2ccccc2)c2ccccc21	ZINC000450866272	CG	On-Demand	Anodyne	SLC6A1	0	47
C[C@@H](O)CCN1C[C@@H](c2ccccc2)c2ccccc21	ZINC000450866272	CG	On-Demand	Anodyne	CHRM5	23	43
C[C@@H](O)CCN1C[C@H](c2ccccc2)c2ccccc21	ZINC000450866274	CG	On-Demand	Anodyne	SLC6A1	0	47
C[C@@H](O)CCN1C[C@H](c2ccccc2)c2ccccc21	ZINC000450866274	CG	On-Demand	Anodyne	CHRM5	23	43
C[C@H](O)CCN1C[C@H](c2ccccc2)c2ccccc21	ZINC000450866275	CG	On-Demand	Anodyne	SLC6A1	0	47
C[C@H](O)CCN1C[C@H](c2ccccc2)c2ccccc21	ZINC000450866275	CG	On-Demand	Anodyne	CHRM5	23	43
C[C@H](O)CCN1C[C@@H](c2ccccc2)c2ccccc21	ZINC000450866277	CG	On-Demand	Anodyne	SLC6A1	0	47
C[C@H](O)CCN1C[C@@H](c2ccccc2)c2ccccc21	ZINC000450866277	CG	On-Demand	Anodyne	CHRM5	23	43
CC[C@@H](C)CSCc1ccc(S(=O)(=O)CC)cc1	ZINC000450866308	CH	On-Demand	Anodyne	LTA4H	31	40
CC[C@H](C)CSCc1ccc(S(=O)(=O)CC)cc1	ZINC000450866311	CH	On-Demand	Anodyne	LTA4H	31	40
CCC(=O)CCCN1CCN(c2ccc(C#N)cc2Cl)CC1	ZINC000450866312	DG	On-Demand	Mild	HTR1A	45	43
CCC(=O)CCCN1CCN(c2ccc(C#N)cc2Cl)CC1	ZINC000450866312	DG	On-Demand	Mild	DRD2	43	43
CCC(=O)CCCN1CCN(c2ccc(C#N)cc2Cl)CC1	ZINC000450866312	DG	On-Demand	Mild	DRD3	59	39
CCC(=O)CCCN1CCN(c2ccc(C#N)cc2Cl)CC1	ZINC000450866312	DG	On-Demand	Mild	HTR7	55	36
CCCCNc1cc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc(N)n1	ZINC000450866316	FE	On-Demand	Anodyne	HRH4	38	44
CCCCNc1cc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc(N)n1	ZINC000450866320	FE	On-Demand	Anodyne	HRH4	38	44
CS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450866322	FH	On-Demand	Anodyne	CACNA1B	55	39
CS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450866322	FH	On-Demand	Anodyne	SLC6A9	0	44
CSCc1ccccc1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450866330	DI	On-Demand	Anodyne	HDAC1	41	38
C=CCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450866331	FE	On-Demand	Mild	HPGDS	37	49
C=CCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450866332	FE	On-Demand	Mild	HPGDS	37	49
CNS(=O)(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)c(F)c1	ZINC000450866336	GE	On-Demand	Anodyne	SLC6A9	17	40
COc1cc(CC(=O)NC(C)(C)c2ccc(C)nc2)ccc1O	ZINC000450866337	DF	On-Demand	Anodyne	TRPV1	27	58
COc1cc(CC(=O)NC(C)(C)c2ccc(C)nc2)ccc1O	ZINC000450866337	DF	On-Demand	Anodyne	NCE103	25	42
COc1cc(CC(=O)NC(C)(C)c2ccc(C)nc2)ccc1O	ZINC000450866337	DF	On-Demand	Anodyne	CAN2	0	42
C[C@@H](N=c1ncnc2[nH][nH]cc1-2)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866338	DD	On-Demand	Anodyne	TPP2	64	38
CNS(=O)(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)c(F)c1	ZINC000450866339	GE	On-Demand	Anodyne	SLC6A9	17	40
C[C@H](N=c1ncnc2[nH][nH]cc1-2)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866340	DD	On-Demand	Anodyne	TPP2	64	38
C[C@H](N=c1ncnc2[nH][nH]cc1-2)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450866342	DD	On-Demand	Anodyne	TPP2	64	38
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1ncnc2[nH][nH]cc1-2	ZINC000450866344	DD	On-Demand	Anodyne	TPP2	64	38
CC[C@H](O)[C@H](CC)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450866345	FF	On-Demand	Bother	COLA	48	33
CC[C@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450866346	FF	On-Demand	Bother	COLA	48	33
CC[C@@H](O)[C@@H](CC)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450866347	FF	On-Demand	Bother	COLA	48	33
CC[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450866348	FF	On-Demand	Bother	COLA	48	33
C[C@@H](N=c1nc(O)c2ccccc2[nH]1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866356	EF	On-Demand	Anodyne	TPP2	57	37
C[C@H](N=c1nc(O)c2ccccc2[nH]1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866357	EF	On-Demand	Anodyne	TPP2	57	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1nc(O)c2ccccc2[nH]1	ZINC000450866358	EF	On-Demand	Anodyne	TPP2	57	37
C[C@H](N=c1nc(O)c2ccccc2[nH]1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450866360	EF	On-Demand	Anodyne	TPP2	57	37
COCc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc(C(C)(C)C)n1	ZINC000450866407	GJ	On-Demand	Anodyne	PRCP	26	41
COCc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc(C(C)(C)C)n1	ZINC000450866407	GJ	On-Demand	Anodyne	KCNN3	34	45
COCc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc(C(C)(C)C)n1	ZINC000450866408	GJ	On-Demand	Anodyne	PRCP	26	41
COCc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc(C(C)(C)C)n1	ZINC000450866408	GJ	On-Demand	Anodyne	KCNN3	34	45
Cc1cccnc1OC1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450866411	DH	On-Demand	Anodyne	HRH1	15	40
Cc1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450866427	EH	On-Demand	Bother	PRCP	43	42
Cc1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450866427	EH	On-Demand	Bother	KCNN3	31	43
Cc1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450866428	EH	On-Demand	Bother	PRCP	43	42
Cc1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450866428	EH	On-Demand	Bother	KCNN3	31	43
CCCc1cc(N2CC(c3cccc(C(F)(F)F)c3)C2)n2ncnc2n1	ZINC000450866443	FH	On-Demand	Anodyne	DHOD	0	40
CC[C@H](C)N1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450866458	DD	On-Demand	Anodyne	SORD	51	41
CC[C@H](C)N1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450866458	DD	On-Demand	Anodyne	SMG1	41	33
CC[C@@H](C)N1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450866459	DD	On-Demand	Anodyne	SORD	51	41
CC[C@@H](C)N1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450866459	DD	On-Demand	Anodyne	SMG1	41	33
CC[C@H](C)N1CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450866472	CD	On-Demand	Anodyne	P2RY12	37	52
CC[C@H](C)N1CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450866472	CD	On-Demand	Anodyne	CXCR3	32	46
CC[C@@H](C)N1CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450866473	CD	On-Demand	Anodyne	P2RY12	37	52
CC[C@@H](C)N1CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450866473	CD	On-Demand	Anodyne	CXCR3	32	46
Cc1nccc(N2CCN(C(=O)[C@]3(C)CCC[C@H]3C)CC2)n1	ZINC000450866480	DE	On-Demand	Anodyne	SORD	42	32
Cc1nccc(N2CCN(C(=O)[C@@]3(C)CCC[C@H]3C)CC2)n1	ZINC000450866481	DE	On-Demand	Anodyne	SORD	42	32
Cc1nccc(N2CCN(C(=O)[C@@]3(C)CCC[C@@H]3C)CC2)n1	ZINC000450866482	DE	On-Demand	Anodyne	SORD	42	32
Cc1nccc(N2CCN(C(=O)[C@]3(C)CCC[C@@H]3C)CC2)n1	ZINC000450866483	DE	On-Demand	Anodyne	SORD	42	32
CC[C@@H](O)CC(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450866484	CE	On-Demand	Anodyne	SLC1A3	41	35
CC[C@H](O)CC(=O)Nc1ccc2c(c1)CCC(=O)N2CC	ZINC000450866485	CE	On-Demand	Anodyne	SLC1A3	41	35
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-]	ZINC000450866508	FF	On-Demand	Bother	TAAR1	15	41
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-]	ZINC000450866509	FF	On-Demand	Bother	TAAR1	15	41
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-]	ZINC000450866510	FF	On-Demand	Bother	TAAR1	15	41
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-]	ZINC000450866511	FF	On-Demand	Bother	TAAR1	15	41
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	HTR1A	22	58
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	DRD2	42	61
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	DRD1	27	52
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	DRD4	27	53
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	HTR2A	49	55
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	HTR2C	26	58
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	ADRA1A	18	40
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	HRH1	17	53
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	ADRA1B	19	45
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	DRD3	16	53
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	ERG2	21	45
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	HTR1F	24	40
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	HTR7	24	45
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	SIGMAR1	21	55
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	HTR3B	0	45
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	MCHR1	19	51
Cc1cnc(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)s1	ZINC000450866521	EI	On-Demand	Anodyne	CYP2J2	60	44
Cc1nn(C)cc1CC(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000450866525	EE	On-Demand	Anodyne	P2RX7	41	39
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450866528	GD	On-Demand	Bother	BCL2L1	61	34
CO[C@H](C1CC1)[C@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450866529	GD	On-Demand	Bother	BCL2L1	61	34
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450866530	GD	On-Demand	Bother	BCL2L1	61	34
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450866531	GD	On-Demand	Bother	BCL2L1	61	34
CCOC(=O)c1ccc(CSc2ncc(C(C)C)n2C)nc1	ZINC000450866539	DG	On-Demand	Anodyne	RXRA	40	33
CC[C@H](C)N1CCN(c2cc(C)nc(-c3ccncc3)n2)CC1	ZINC000450866545	DF	On-Demand	Anodyne	SORD	41	41
CC[C@@H](C)N1CCN(c2cc(C)nc(-c3ccncc3)n2)CC1	ZINC000450866546	DF	On-Demand	Anodyne	SORD	41	41
Cc1nccc(N2CCN(C(=O)C3(Cc4cccc(Cl)c4)CC3)CC2)n1	ZINC000450866547	FG	On-Demand	Anodyne	SORD	56	37
CC(F)(F)CCSCc1cccc(OC(F)F)c1	ZINC000450866567	CJ	On-Demand	Anodyne	CACNA2D1	24	49
COC(=O)c1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1[N+](=O)[O-]	ZINC000450866570	GF	On-Demand	Bother	TPP2	53	33
COC(=O)c1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1[N+](=O)[O-]	ZINC000450866571	GF	On-Demand	Bother	TPP2	53	33
COC(=O)c1cc(C)nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000450866572	GF	On-Demand	Bother	TPP2	53	33
COC(=O)c1cc(C)nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000450866573	GF	On-Demand	Bother	TPP2	53	33
C[C@H](Nc1ccc(Cl)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866576	DH	On-Demand	Anodyne	DRD4	27	45
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(Cl)cn1	ZINC000450866577	DH	On-Demand	Anodyne	DRD4	27	45
C[C@H](Nc1ccc(Cl)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450866578	DH	On-Demand	Anodyne	ACE	17	40
C[C@H](Nc1ccc(Cl)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450866578	DH	On-Demand	Anodyne	DRD4	27	45
C[C@H](Nc1ccc(Cl)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450866578	DH	On-Demand	Anodyne	TPP2	68	38
C[C@@H](Nc1ccc(Cl)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866579	DH	On-Demand	Anodyne	ACE	17	40
C[C@@H](Nc1ccc(Cl)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866579	DH	On-Demand	Anodyne	DRD4	27	45
C[C@@H](Nc1ccc(Cl)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866579	DH	On-Demand	Anodyne	TPP2	68	38
Cc1cccc(Cl)c1C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450866585	EF	On-Demand	Anodyne	REN	45	39
Cc1cccc(Cl)c1C(=O)N1CCN(c2ncc(F)cn2)CC1	ZINC000450866585	EF	On-Demand	Anodyne	SLC6A7	0	44
COc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncn1	ZINC000450866594	DE	On-Demand	Anodyne	TPP2	67	38
COc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncn1	ZINC000450866595	DE	On-Demand	Anodyne	TPP2	67	38
COc1cc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncn1	ZINC000450866596	DE	On-Demand	Anodyne	TPP2	67	38
COc1cc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncn1	ZINC000450866597	DE	On-Demand	Anodyne	TPP2	67	38
CCOc1cc(C(=O)N[C@H]2CCCO[C@@H]2c2cnn(CC)c2)on1	ZINC000450866621	ED	On-Demand	Anodyne	PANC	48	31
CCc1nnc2ccc(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)nn12	ZINC000450866630	FD	On-Demand	Anodyne	TPP2	60	37
CCc1nnc2ccc(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)nn12	ZINC000450866634	FD	On-Demand	Anodyne	TPP2	60	37
CCc1nnc2ccc(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nn12	ZINC000450866638	FD	On-Demand	Anodyne	TPP2	60	37
CCc1nnc2ccc(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nn12	ZINC000450866643	FD	On-Demand	Anodyne	TPP2	60	37
CC[C@H](O)[C@@H](CC)N=c1cc[nH]c(C(=O)NCc2ccccc2)c1	ZINC000450866646	EE	On-Demand	Anodyne	PDS	45	36
COCCOC[C@@H](O)CN1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000450866648	EF	On-Demand	Anodyne	HSP90AB1	31	41
CC[C@H](N=c1cc[nH]c(C(=O)NCc2ccccc2)c1)[C@H](O)CC	ZINC000450866649	EE	On-Demand	Anodyne	PDS	45	36
COCCOC[C@H](O)CN1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000450866651	EF	On-Demand	Anodyne	HSP90AB1	31	41
CC[C@@H](O)[C@@H](CC)N=c1cc[nH]c(C(=O)NCc2ccccc2)c1	ZINC000450866652	EE	On-Demand	Anodyne	PDS	45	36
COCCOC[C@@H](O)CN1CCCC[C@H]1c1cccc(Cl)c1	ZINC000450866653	EF	On-Demand	Anodyne	HSP90AB1	31	41
CC[C@H](O)[C@H](CC)N=c1cc[nH]c(C(=O)NCc2ccccc2)c1	ZINC000450866654	EE	On-Demand	Anodyne	PDS	45	36
COCCOC[C@H](O)CN1CCCC[C@H]1c1cccc(Cl)c1	ZINC000450866656	EF	On-Demand	Anodyne	HSP90AB1	31	41
CNS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c(F)c1	ZINC000450866657	GF	On-Demand	Anodyne	TPP2	61	35
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c(F)c1	ZINC000450866660	GF	On-Demand	Anodyne	TPP2	61	35
CNS(=O)(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c(F)c1	ZINC000450866663	GF	On-Demand	Anodyne	TPP2	61	35
CNS(=O)(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c(F)c1	ZINC000450866666	GF	On-Demand	Anodyne	TPP2	61	35
O=C(c1c(Cl)cc(Cl)cc1Cl)N1CCN(c2ncc(F)cn2)CC1	ZINC000450866674	GH	On-Demand	Anodyne	P2RX7	15	45
O=C(c1c(Cl)cc(Cl)cc1Cl)N1CCN(c2ncc(F)cn2)CC1	ZINC000450866674	GH	On-Demand	Anodyne	SLC6A7	0	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)cc1	ZINC000450866675	FE	On-Demand	Anodyne	ADRB2	32	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)cc1	ZINC000450866675	FE	On-Demand	Anodyne	ADRB1	53	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)cc1	ZINC000450866675	FE	On-Demand	Anodyne	ADRB3	31	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)cc1	ZINC000450866676	FE	On-Demand	Anodyne	ADRB2	32	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)cc1	ZINC000450866676	FE	On-Demand	Anodyne	ADRB1	53	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)cc1	ZINC000450866676	FE	On-Demand	Anodyne	ADRB3	31	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cc1	ZINC000450866677	FE	On-Demand	Anodyne	ADRB2	32	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cc1	ZINC000450866677	FE	On-Demand	Anodyne	ADRB1	53	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cc1	ZINC000450866677	FE	On-Demand	Anodyne	ADRB3	31	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1	ZINC000450866679	FE	On-Demand	Anodyne	ADRB2	32	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1	ZINC000450866679	FE	On-Demand	Anodyne	ADRB1	53	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1	ZINC000450866679	FE	On-Demand	Anodyne	ADRB3	31	43
O=C(N1CCN(c2ncc(F)cn2)CC1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450866693	FF	On-Demand	Anodyne	SLC6A7	0	41
CC(=O)c1ccc2cc(OCC[C@@H](C)O)ccc2c1	ZINC000450866731	CG	On-Demand	Anodyne	P2RY12	0	43
CC(=O)c1ccc2cc(OCC[C@H](C)O)ccc2c1	ZINC000450866733	CG	On-Demand	Anodyne	P2RY12	0	43
CC(=O)CCCCCOc1ccc([N+](=O)[O-])c2ccccc12	ZINC000450866734	DI	On-Demand	Bother	THRA	0	45
C[C@@H](O)CCCn1nnnc1CCCc1ccccc1	ZINC000450866736	CE	On-Demand	Anodyne	DAGLA	28	41
C[C@H](O)CCCn1nnnc1CCCc1ccccc1	ZINC000450866737	CE	On-Demand	Anodyne	DAGLA	28	41
C[C@H](N=c1[nH]ccc(C#N)c1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866740	EF	On-Demand	Mild	TPP2	59	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1[nH]ccc(C#N)c1Cl	ZINC000450866742	EF	On-Demand	Mild	TPP2	59	34
COC(=O)c1ccc(-c2nnn(CCN(C)Cc3ccccc3)n2)cc1	ZINC000450866743	FE	On-Demand	Anodyne	FAAH	23	41
COC(=O)c1ccc(-c2nnn(CCN(C)Cc3ccccc3)n2)cc1	ZINC000450866743	FE	On-Demand	Anodyne	SCARB1	51	40
C[C@H](N=c1[nH]ccc(C#N)c1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450866744	EF	On-Demand	Mild	TPP2	59	34
C[C@@H](N=c1[nH]ccc(C#N)c1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450866747	EF	On-Demand	Mild	TPP2	59	34
CC(C)c1nc(NCCN2CCC(O)CC2)cc(C(C)(C)C)n1	ZINC000450866753	DE	On-Demand	Anodyne	P2RX2	16	41
O=C(NCC[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450866784	FD	On-Demand	Anodyne	SOAT1	37	43
O=C(NCC[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450866784	FD	On-Demand	Anodyne	METAP2	0	50
O=C(NCC[C@H](NC(=O)[C@H](O)C1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450866785	FD	On-Demand	Anodyne	SOAT1	37	43
O=C(NCC[C@H](NC(=O)[C@H](O)C1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450866785	FD	On-Demand	Anodyne	METAP2	0	50
O=C(NCC[C@H](NC(=O)[C@H](O)C1CCC1)c1ccccc1)[C@H](O)C1CCC1	ZINC000450866786	FD	On-Demand	Anodyne	SOAT1	37	43
O=C(NCC[C@H](NC(=O)[C@H](O)C1CCC1)c1ccccc1)[C@H](O)C1CCC1	ZINC000450866786	FD	On-Demand	Anodyne	METAP2	0	50
O=C(N[C@@H](CCNC(=O)[C@H](O)C1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450866787	FD	On-Demand	Anodyne	SOAT1	37	43
O=C(N[C@@H](CCNC(=O)[C@H](O)C1CCC1)c1ccccc1)[C@@H](O)C1CCC1	ZINC000450866787	FD	On-Demand	Anodyne	METAP2	0	50
COc1cc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)ccc1Cl	ZINC000450866806	EG	On-Demand	Anodyne	OPRM1	0	48
COc1cc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)ccc1Cl	ZINC000450866806	EG	On-Demand	Anodyne	OPRK1	25	48
COc1cc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)ccc1Cl	ZINC000450866806	EG	On-Demand	Anodyne	COLA	69	37
COc1cc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)ccc1Cl	ZINC000450866806	EG	On-Demand	Anodyne	CPT1A	62	37
COc1cc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)ccc1Cl	ZINC000450866808	EG	On-Demand	Anodyne	OPRM1	0	48
COc1cc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)ccc1Cl	ZINC000450866808	EG	On-Demand	Anodyne	OPRK1	25	48
COc1cc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)ccc1Cl	ZINC000450866808	EG	On-Demand	Anodyne	COLA	69	37
COc1cc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)ccc1Cl	ZINC000450866808	EG	On-Demand	Anodyne	CPT1A	62	37
O=C(CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)N1CCC(OCc2ccccc2)CC1	ZINC000450866819	GG	On-Demand	Anodyne	TIMP3	51	33
O=C(CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)N1CCC(OCc2ccccc2)CC1	ZINC000450866821	GG	On-Demand	Anodyne	TIMP3	51	33
O=C(CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)N1CCC(OCc2ccccc2)CC1	ZINC000450866823	GG	On-Demand	Anodyne	TIMP3	51	33
O=C(CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)N1CCC(OCc2ccccc2)CC1	ZINC000450866829	GG	On-Demand	Anodyne	TIMP3	51	33
COC(=O)c1cn(C2CCN(C(=O)C3=C(c4ccccc4)CCCC3)CC2)nn1	ZINC000450866880	GG	On-Demand	Anodyne	CHRM5	32	40
COC(=O)c1cn(C2CCN(C(=O)C3=C(c4ccccc4)CCCC3)CC2)nn1	ZINC000450866880	GG	On-Demand	Anodyne	L3MBTL3	46	33
CCN1C(=O)CCc2cc(NC(=O)[C@]3(C)CCC[C@H]3C)ccc21	ZINC000450866907	DH	On-Demand	Anodyne	NAMPT	23	41
CCN1C(=O)CCc2cc(NC(=O)[C@@]3(C)CCC[C@@H]3C)ccc21	ZINC000450866908	DH	On-Demand	Anodyne	NAMPT	23	41
CCN1C(=O)CCc2cc(NC(=O)[C@]3(C)CCC[C@@H]3C)ccc21	ZINC000450866909	DH	On-Demand	Anodyne	NAMPT	23	41
CCN1C(=O)CCc2cc(NC(=O)[C@@]3(C)CCC[C@H]3C)ccc21	ZINC000450866910	DH	On-Demand	Anodyne	NAMPT	23	41
COc1ccc(CNC(=O)CCN[C@@H](CO)C(C)(C)C)c(OC)c1	ZINC000450866911	ED	On-Demand	Anodyne	MTNR1A	59	38
COc1ccc(CNC(=O)CCN[C@@H](CO)C(C)(C)C)c(OC)c1	ZINC000450866911	ED	On-Demand	Anodyne	MTNR1B	44	37
Cc1nnc2c3ccccc3c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)nn12	ZINC000450866967	GF	On-Demand	Anodyne	CREBBP	41	32
Cc1nnc2c3ccccc3c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)nn12	ZINC000450866967	GF	On-Demand	Anodyne	BRD9	51	32
Cc1nnc2c3ccccc3c(N3CCN(CC(F)(F)F)C[C@H](C)C3)nn12	ZINC000450866971	GF	On-Demand	Anodyne	CREBBP	41	32
Cc1nnc2c3ccccc3c(N3CCN(CC(F)(F)F)C[C@H](C)C3)nn12	ZINC000450866971	GF	On-Demand	Anodyne	BRD9	51	32
CC[C@H](C)N1CCN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450866981	GD	On-Demand	Bother	TAAR1	28	47
CC[C@@H](C)N1CCN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450866983	GD	On-Demand	Bother	TAAR1	28	47
CC[C@H](C)N1CCN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450866985	GD	On-Demand	Bother	TAAR1	28	47
CC[C@@H](C)N1CCN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450866986	GD	On-Demand	Bother	TAAR1	28	47
Cc1cccc(Cl)c1C(=O)NCCc1ccn(C)n1	ZINC000450867018	CE	On-Demand	Anodyne	DRD4	42	34
C[C@H]1CN(CC(F)(F)F)CCN(c2cncc(Br)c2)C1	ZINC000450867019	FG	On-Demand	Anodyne	CHRNA3	22	44
C[C@@H]1CN(CC(F)(F)F)CCN(c2cncc(Br)c2)C1	ZINC000450867020	FG	On-Demand	Anodyne	CHRNA3	22	44
N#Cc1ccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)cc1[N+](=O)[O-]	ZINC000450867021	EI	On-Demand	Mild	KCNN3	32	43
N#Cc1ccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)cc1[N+](=O)[O-]	ZINC000450867022	EI	On-Demand	Mild	KCNN3	32	43
CNC(=O)c1ccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450867047	GH	On-Demand	Bother	KCNN3	29	40
CNC(=O)c1ccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450867048	GH	On-Demand	Bother	KCNN3	29	40
CCc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n2ncnc2n1	ZINC000450867050	EG	On-Demand	Anodyne	PRCP	50	41
CCc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n2ncnc2n1	ZINC000450867050	EG	On-Demand	Anodyne	KCNN3	33	43
CCc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n2ncnc2n1	ZINC000450867051	EG	On-Demand	Anodyne	PRCP	50	41
CCc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n2ncnc2n1	ZINC000450867051	EG	On-Demand	Anodyne	KCNN3	33	43
COc1cc(-c2noc(CN3CCC(Oc4ncccc4C)CC3)n2)ncn1	ZINC000450867054	GE	On-Demand	Anodyne	SCN5A	60	37
CNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450867076	GF	On-Demand	Bother	TPP2	51	32
CNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450867076	GF	On-Demand	Bother	TAAR1	19	40
CNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450867077	GF	On-Demand	Bother	TPP2	51	32
CNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450867077	GF	On-Demand	Bother	TAAR1	19	40
CNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450867078	GF	On-Demand	Bother	TPP2	51	32
CNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450867078	GF	On-Demand	Bother	TAAR1	19	40
CNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450867079	GF	On-Demand	Bother	TPP2	51	32
CNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450867079	GF	On-Demand	Bother	TAAR1	19	40
CC(=O)c1ccc2cc(OCCC(C)(F)F)ccc2c1	ZINC000450867091	CI	On-Demand	Anodyne	PLA2G4B	45	33
CC[C@@H](O)[C@@H](CC)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450867125	CF	On-Demand	Bother	TAAR1	15	43
CC[C@H](O)[C@H](CC)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450867126	CF	On-Demand	Bother	TAAR1	15	43
CC[C@H](O)[C@@H](CC)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450867127	CF	On-Demand	Bother	TAAR1	15	43
CC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])[C@H](O)CC	ZINC000450867128	CF	On-Demand	Bother	TAAR1	15	43
CC(C)c1nnc2c(N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nccn12	ZINC000450867131	FE	On-Demand	Anodyne	TPP2	54	34
CC(C)c1nnc2c(N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)nccn12	ZINC000450867132	FE	On-Demand	Anodyne	TPP2	54	34
CC(C)c1nnc2c(N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)nccn12	ZINC000450867133	FE	On-Demand	Anodyne	TPP2	54	34
CC(C)c1nnc2c(N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)nccn12	ZINC000450867134	FE	On-Demand	Anodyne	TPP2	54	34
CC[C@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)[C@H](O)CC	ZINC000450867135	FE	On-Demand	Bother	TBXA2R	28	42
CC[C@H](O)[C@@H](CC)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450867136	FE	On-Demand	Bother	TBXA2R	28	42
CC[C@@H](O)[C@@H](CC)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450867137	FE	On-Demand	Bother	TBXA2R	28	42
CC[C@H](O)[C@H](CC)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450867138	FE	On-Demand	Bother	TBXA2R	28	42
C[C@@H](Nc1ncncc1Br)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867143	FG	On-Demand	Anodyne	TPP2	64	36
C[C@H](Nc1ncncc1Br)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867144	FG	On-Demand	Anodyne	TPP2	64	36
C[C@H](Nc1ncncc1Br)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867145	FG	On-Demand	Anodyne	TPP2	64	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncncc1Br	ZINC000450867146	FG	On-Demand	Anodyne	TPP2	64	36
CCOC(=O)c1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1[N+](=O)[O-]	ZINC000450867149	GF	On-Demand	Bother	TPP2	65	36
CCOC(=O)c1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1[N+](=O)[O-]	ZINC000450867150	GF	On-Demand	Bother	TPP2	65	36
CCOC(=O)c1ccnc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000450867151	GF	On-Demand	Bother	TPP2	65	36
CCOC(=O)c1ccnc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000450867152	GF	On-Demand	Bother	TPP2	65	36
C[C@@H](Nc1c([N+](=O)[O-])ncn1C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867153	EE	On-Demand	Bother	TPP2	57	36
C[C@H](Nc1c([N+](=O)[O-])ncn1C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867154	EE	On-Demand	Bother	TPP2	57	36
Clc1ccc2c(N[C@@H]3CCO[C@H](c4cccs4)C3)ncnc2c1	ZINC000450867229	EJ	On-Demand	Anodyne	CD38	52	40
Clc1ccc2c(N[C@H]3CCO[C@@H](c4cccs4)C3)ncnc2c1	ZINC000450867237	EJ	On-Demand	Anodyne	CD38	52	40
Clc1ccc2c(N[C@H]3CCO[C@H](c4cccs4)C3)ncnc2c1	ZINC000450867239	EJ	On-Demand	Anodyne	CD38	52	40
C[C@@H](Nc1ncc(C(F)F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867272	EG	On-Demand	Anodyne	ACE	15	40
C[C@@H](Nc1ncc(C(F)F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867272	EG	On-Demand	Anodyne	TPP2	66	38
C[C@H](Nc1ncc(C(F)F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867274	EG	On-Demand	Anodyne	ACE	15	40
C[C@H](Nc1ncc(C(F)F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867274	EG	On-Demand	Anodyne	TPP2	66	38
C[C@H](Nc1ncc(C(F)F)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867276	EG	On-Demand	Anodyne	ACE	15	40
C[C@H](Nc1ncc(C(F)F)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867276	EG	On-Demand	Anodyne	TPP2	66	38
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(C(F)F)cn1	ZINC000450867278	EG	On-Demand	Anodyne	ACE	15	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(C(F)F)cn1	ZINC000450867278	EG	On-Demand	Anodyne	TPP2	66	38
Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000450867287	GG	On-Demand	Anodyne	HRH3	0	42
Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000450867288	GG	On-Demand	Anodyne	HRH3	0	42
Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000450867289	GG	On-Demand	Anodyne	HRH3	0	42
Cc1cc(N2CCCC2)ccc1NC(=O)CN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000450867290	GG	On-Demand	Anodyne	HRH3	0	42
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)[C@H](Cc2ccccc2)OC)cn1	ZINC000450867305	FE	On-Demand	Anodyne	TIMP3	40	33
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)[C@@H](Cc2ccccc2)OC)cn1	ZINC000450867306	FE	On-Demand	Anodyne	TIMP3	40	33
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cn1	ZINC000450867307	GF	On-Demand	Anodyne	PANC	45	31
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450867338	GE	On-Demand	Anodyne	CA2	34	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450867338	GE	On-Demand	Anodyne	CA1	34	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450867338	GE	On-Demand	Anodyne	CA12	23	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450867338	GE	On-Demand	Anodyne	CA9	22	42
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)c2ccc(C(F)(F)F)cc2C)cn1	ZINC000450867351	GH	On-Demand	Anodyne	CCR2	92	45
COc1cc(CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1Cl	ZINC000450867370	EG	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)ccc1Cl	ZINC000450867371	EG	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1Cl	ZINC000450867372	EG	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1Cl	ZINC000450867373	EG	On-Demand	Anodyne	DRD3	0	42
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450867388	CG	On-Demand	Bother	TAAR1	18	51
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450867389	CG	On-Demand	Bother	TAAR1	18	51
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450867390	CG	On-Demand	Bother	TAAR1	18	51
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450867391	CG	On-Demand	Bother	TAAR1	18	51
Cc1nccc(N2CCN(C(=O)c3c(C)cccc3Cl)CC2)n1	ZINC000450867394	EF	On-Demand	Anodyne	REN	22	43
Cc1nccc(N2CCN(C(=O)c3c(C)cccc3Cl)CC2)n1	ZINC000450867394	EF	On-Demand	Anodyne	SORD	66	37
Cc1nccc(N2CCN(C(=O)c3c(C)cccc3Cl)CC2)n1	ZINC000450867394	EF	On-Demand	Anodyne	SLC6A7	0	40
Cc1nccc(N2CCN(C(=O)[C@@]3(C)CC=CCC3)CC2)n1	ZINC000450867411	DE	On-Demand	Anodyne	SORD	60	38
Cc1nccc(N2CCN(C(=O)[C@]3(C)CC=CCC3)CC2)n1	ZINC000450867412	DE	On-Demand	Anodyne	SORD	60	38
CCS(=O)(=O)c1ccc(CN2CC[C@H](CC(F)(F)F)C2)cc1	ZINC000450867413	EG	On-Demand	Anodyne	ACHE	15	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](CC(F)(F)F)C2)cc1	ZINC000450867414	EG	On-Demand	Anodyne	ACHE	15	40
O=C(CC[C@@H]1CCCCO1)CSc1nnc(CCc2ccccc2)o1	ZINC000450867428	FH	On-Demand	Anodyne	MGLL	0	44
O=C(CC[C@H]1CCCCO1)CSc1nnc(CCc2ccccc2)o1	ZINC000450867429	FH	On-Demand	Anodyne	MGLL	0	44
C[C@H](Nc1c([N+](=O)[O-])ncn1C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867455	EE	On-Demand	Bother	TPP2	57	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1c([N+](=O)[O-])ncn1C	ZINC000450867456	EE	On-Demand	Bother	TPP2	57	36
CC[C@@H](O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450867457	CE	On-Demand	Anodyne	KCNA3	39	41
CC[C@@H](O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450867457	CE	On-Demand	Anodyne	ACAT	0	55
CC[C@@H](O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450867457	CE	On-Demand	Anodyne	HCN1	41	35
CC[C@H](O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450867458	CE	On-Demand	Anodyne	KCNA3	39	41
CC[C@H](O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450867458	CE	On-Demand	Anodyne	ACAT	0	55
CC[C@H](O)CC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450867458	CE	On-Demand	Anodyne	HCN1	41	35
O=C(CNC(=O)Nc1cccc(Cl)c1)NCc1nc2ccccc2n1C1CC1	ZINC000450867467	GG	On-Demand	Anodyne	MCHR1	26	43
O=C(CNC(=O)Nc1cccc(Cl)c1)NCc1nc2ccccc2n1C1CC1	ZINC000450867467	GG	On-Demand	Anodyne	IMDH_CRYPV	25	43
COC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1OC	ZINC000450867473	FE	On-Demand	Anodyne	DRD4	20	41
COC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1OC	ZINC000450867473	FE	On-Demand	Anodyne	TPP2	64	38
COC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1OC	ZINC000450867474	FE	On-Demand	Anodyne	DRD4	20	41
COC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1OC	ZINC000450867474	FE	On-Demand	Anodyne	TPP2	64	38
COC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1OC	ZINC000450867475	FE	On-Demand	Anodyne	DRD4	20	41
COC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1OC	ZINC000450867475	FE	On-Demand	Anodyne	TPP2	64	38
COC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1OC	ZINC000450867476	FE	On-Demand	Anodyne	DRD4	20	41
COC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1OC	ZINC000450867476	FE	On-Demand	Anodyne	TPP2	64	38
C[C@H](Nc1ncnc2sccc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867489	EG	On-Demand	Anodyne	TPP2	65	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncnc2sccc12	ZINC000450867490	EG	On-Demand	Anodyne	TPP2	65	36
C[C@H](Nc1ncnc2sccc12)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867491	EG	On-Demand	Anodyne	TPP2	65	36
C[C@@H](Nc1ncnc2sccc12)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867492	EG	On-Demand	Anodyne	TPP2	65	36
Cc1cccc2c1O[C@@H](C(=O)N[C@@](C)(CO)C1CCCCC1)C2	ZINC000450867493	DF	On-Demand	Anodyne	AMY2	42	29
Cc1cccc2c1O[C@H](C(=O)N[C@@](C)(CO)C1CCCCC1)C2	ZINC000450867494	DF	On-Demand	Anodyne	AMY2	42	29
Cc1cccc2c1O[C@H](C(=O)N[C@](C)(CO)C1CCCCC1)C2	ZINC000450867495	DF	On-Demand	Anodyne	AMY2	42	29
Cc1cccc2c1O[C@@H](C(=O)N[C@](C)(CO)C1CCCCC1)C2	ZINC000450867496	DF	On-Demand	Anodyne	AMY2	42	29
Cc1cccc2ncnc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)c12	ZINC000450867498	EG	On-Demand	Anodyne	LIMK2	59	34
Cc1cccc2ncnc(N3CCN(CC(F)(F)F)C[C@H](C)C3)c12	ZINC000450867499	EG	On-Demand	Anodyne	LIMK2	59	34
CC1CCN(C(=O)c2ccc(N3CCN(CC(F)(F)F)C[C@H](C)C3)nc2)CC1	ZINC000450867535	GG	On-Demand	Anodyne	HPGDS	35	47
CC1CCN(C(=O)c2ccc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)nc2)CC1	ZINC000450867537	GG	On-Demand	Anodyne	HPGDS	35	47
CCc1ncnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c1F	ZINC000450867542	EH	On-Demand	Anodyne	PRCP	33	41
CCc1ncnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c1F	ZINC000450867542	EH	On-Demand	Anodyne	KCNN3	32	46
CCc1ncnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c1F	ZINC000450867546	EH	On-Demand	Anodyne	PRCP	33	41
CCc1ncnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c1F	ZINC000450867546	EH	On-Demand	Anodyne	KCNN3	32	46
CCCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450867548	FF	On-Demand	Anodyne	DRD4	40	30
CCCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450867548	FF	On-Demand	Anodyne	HPGDS	32	41
CCCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450867550	FF	On-Demand	Anodyne	DRD4	40	30
CCCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450867550	FF	On-Demand	Anodyne	HPGDS	32	41
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	HTR1A	16	54
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	DRD2	34	52
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	DRD1	17	48
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	DRD4	23	43
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	HTR2A	35	49
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	HTR2C	17	54
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	HRH1	20	49
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	DRD3	17	49
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	ERG2	20	42
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	SIGMAR1	17	51
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	CCR3	35	43
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	SLC18A3	0	45
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	HTR3B	0	43
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	CYP2J2	56	42
Cc1cnccc1OC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450867576	FI	On-Demand	Anodyne	AP2S1	0	42
CSc1cncc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450867585	EF	On-Demand	Anodyne	TPP2	58	38
CSc1cncc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450867586	EF	On-Demand	Anodyne	TPP2	58	38
CCOc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450867587	DG	On-Demand	Anodyne	PRCP	45	47
CCOc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450867587	DG	On-Demand	Anodyne	KCNN3	39	47
CSc1cncc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n1	ZINC000450867588	EF	On-Demand	Anodyne	TPP2	58	38
CCOc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450867589	DG	On-Demand	Anodyne	PRCP	45	47
CCOc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450867589	DG	On-Demand	Anodyne	KCNN3	39	47
CSc1cncc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n1	ZINC000450867590	EF	On-Demand	Anodyne	TPP2	58	38
COCc1nc(SCc2ccc(C(=O)OC)cc2Br)n[nH]1	ZINC000450867602	FF	On-Demand	Anodyne	METAP2	0	44
O=[N+]([O-])c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c(Cl)c1	ZINC000450867615	FI	On-Demand	Bother	PRCP	51	49
O=[N+]([O-])c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c(Cl)c1	ZINC000450867615	FI	On-Demand	Bother	KCNN3	30	43
O=[N+]([O-])c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c(Cl)c1	ZINC000450867616	FI	On-Demand	Bother	PRCP	51	49
O=[N+]([O-])c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c(Cl)c1	ZINC000450867616	FI	On-Demand	Bother	KCNN3	30	43
CCn1nccc1CN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450867641	FE	On-Demand	Anodyne	PDGFRB	38	43
CCn1nccc1CN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450867641	FE	On-Demand	Anodyne	MTNR1A	45	38
CCn1nccc1CN(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450867641	FE	On-Demand	Anodyne	CSF1R	15	43
COc1cc(CN2CCC[C@@H](c3ncc(C(F)(F)F)[nH]3)C2)ccc1Cl	ZINC000450867709	FI	On-Demand	Anodyne	DRD4	15	42
COc1cc(CN2CCC[C@@H](c3ncc(C(F)(F)F)[nH]3)C2)ccc1Cl	ZINC000450867709	FI	On-Demand	Anodyne	SSTR5	52	38
COc1cc(CN2CCC[C@H](c3ncc(C(F)(F)F)[nH]3)C2)ccc1Cl	ZINC000450867711	FI	On-Demand	Anodyne	DRD4	15	42
COc1cc(CN2CCC[C@H](c3ncc(C(F)(F)F)[nH]3)C2)ccc1Cl	ZINC000450867711	FI	On-Demand	Anodyne	SSTR5	52	38
CC[C@@H](C)N1CCN(c2nccc3ccc(F)cc23)CC1	ZINC000450867712	CG	On-Demand	Anodyne	SORD	35	43
CC[C@H](C)N1CCN(c2nccc3ccc(F)cc23)CC1	ZINC000450867717	CG	On-Demand	Anodyne	SORD	35	43
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867722	FE	On-Demand	Bother	BCL2L1	53	34
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867722	FE	On-Demand	Bother	TAAR1	19	42
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867722	FE	On-Demand	Bother	LRRK2	22	40
CO[C@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867722	FE	On-Demand	Bother	L3MBTL3	48	44
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867723	FE	On-Demand	Bother	BCL2L1	53	34
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867723	FE	On-Demand	Bother	TAAR1	19	42
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867723	FE	On-Demand	Bother	LRRK2	22	40
CO[C@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867723	FE	On-Demand	Bother	L3MBTL3	48	44
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867724	FE	On-Demand	Bother	BCL2L1	53	34
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867724	FE	On-Demand	Bother	TAAR1	19	42
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867724	FE	On-Demand	Bother	LRRK2	22	40
CO[C@@H](C1CC1)[C@@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867724	FE	On-Demand	Bother	L3MBTL3	48	44
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867725	FE	On-Demand	Bother	BCL2L1	53	34
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867725	FE	On-Demand	Bother	TAAR1	19	42
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867725	FE	On-Demand	Bother	LRRK2	22	40
CO[C@@H](C1CC1)[C@H](C)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450867725	FE	On-Demand	Bother	L3MBTL3	48	44
CC1(C)COC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450867730	DH	On-Demand	Bother	MAOB	26	52
CC1(C)COC[C@@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450867731	DH	On-Demand	Bother	MAOB	26	52
CCOC(=O)c1cc(N2CCN([C@H](C)CC)CC2)ncc1Cl	ZINC000450867739	EF	On-Demand	Anodyne	P2RY12	38	41
CCOC(=O)c1cc(N2CCN([C@H](C)CC)CC2)ncc1Cl	ZINC000450867739	EF	On-Demand	Anodyne	SMO	0	41
CCOC(=O)c1cc(N2CCN([C@@H](C)CC)CC2)ncc1Cl	ZINC000450867740	EF	On-Demand	Anodyne	P2RY12	38	41
CCOC(=O)c1cc(N2CCN([C@@H](C)CC)CC2)ncc1Cl	ZINC000450867740	EF	On-Demand	Anodyne	SMO	0	41
CC[C@H](C)N1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450867742	GD	On-Demand	Bother	SLC6A9	15	44
CC[C@@H](C)N1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450867743	GD	On-Demand	Bother	SLC6A9	15	44
C[C@]1(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)CC=CCC1	ZINC000450867759	GJ	On-Demand	Anodyne	PRSS2	43	30
C[C@@]1(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)CC=CCC1	ZINC000450867761	GJ	On-Demand	Anodyne	PRSS2	43	30
CCc1cc(CCCN2CCC(CO)(Cc3ccccc3)CC2)on1	ZINC000450867829	EG	On-Demand	Anodyne	SIGMAR1	24	41
c1ccc([C@H]2C[C@H](Nc3nccc(N[C@@H]4CCCOC4)n3)CCO2)nc1	ZINC000450867838	FE	On-Demand	Anodyne	MAPK1	47	35
c1ccc([C@H]2C[C@H](Nc3nccc(N[C@H]4CCCOC4)n3)CCO2)nc1	ZINC000450867839	FE	On-Demand	Anodyne	MAPK1	47	35
Cn1cc(-c2ccc(C(=O)N[C@](C)(CO)C3CCCCC3)o2)cn1	ZINC000450867947	EF	On-Demand	Anodyne	MMP13	0	46
Cn1cc(-c2ccc(C(=O)N[C@@](C)(CO)C3CCCCC3)o2)cn1	ZINC000450867948	EF	On-Demand	Anodyne	MMP13	0	46
C[C@@H](Nc1ncc(C(N)=O)cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867949	FF	On-Demand	Anodyne	DRD4	23	40
C[C@H](Nc1ncc(C(N)=O)cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867950	FF	On-Demand	Anodyne	DRD4	23	40
C[C@H](Nc1ncc(C(N)=O)cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867951	FF	On-Demand	Anodyne	DRD4	23	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ncc(C(N)=O)cc1Cl	ZINC000450867952	FF	On-Demand	Anodyne	DRD4	23	40
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867959	FF	On-Demand	Anodyne	ACE	16	40
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867959	FF	On-Demand	Anodyne	DRD4	20	40
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867959	FF	On-Demand	Anodyne	TPP2	56	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nnc(C(F)(F)F)s1	ZINC000450867960	FF	On-Demand	Anodyne	ACE	16	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nnc(C(F)(F)F)s1	ZINC000450867960	FF	On-Demand	Anodyne	DRD4	20	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nnc(C(F)(F)F)s1	ZINC000450867960	FF	On-Demand	Anodyne	TPP2	56	36
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867961	FF	On-Demand	Anodyne	ACE	16	40
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867961	FF	On-Demand	Anodyne	DRD4	20	40
C[C@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867961	FF	On-Demand	Anodyne	TPP2	56	36
C[C@@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867962	FF	On-Demand	Anodyne	ACE	16	40
C[C@@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867962	FF	On-Demand	Anodyne	DRD4	20	40
C[C@@H](Nc1nnc(C(F)(F)F)s1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867962	FF	On-Demand	Anodyne	TPP2	56	36
C[C@@H](Nc1cncc(OCCO)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867979	ED	On-Demand	Anodyne	TPP2	65	37
C[C@H](Nc1cncc(OCCO)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450867980	ED	On-Demand	Anodyne	TPP2	65	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1cncc(OCCO)n1	ZINC000450867981	ED	On-Demand	Anodyne	TPP2	65	37
C[C@H](Nc1cncc(OCCO)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450867982	ED	On-Demand	Anodyne	TPP2	65	37
CC(=O)CCCCCSc1nnc(-c2cc3ccccc3o2)o1	ZINC000450867993	EJ	On-Demand	Anodyne	ALOX15	58	34
CCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450867994	DE	On-Demand	Anodyne	DRD4	22	40
CCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)s[nH]1	ZINC000450867995	DE	On-Demand	Anodyne	DRD4	22	40
CCc1nc(=N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450867996	DE	On-Demand	Anodyne	DRD4	22	40
CCc1nc(=N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)s[nH]1	ZINC000450867997	DE	On-Demand	Anodyne	DRD4	22	40
O=C(CC[C@H]1CCCCO1)Cn1nnnc1CCCc1ccccc1	ZINC000450868003	EF	On-Demand	Anodyne	MGLL	0	42
O=C(CC[C@@H]1CCCCO1)Cn1nnnc1CCCc1ccccc1	ZINC000450868004	EF	On-Demand	Anodyne	MGLL	0	42
COC(=O)[C@H](C)Cc1ccc(NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450868023	EG	On-Demand	Anodyne	TIMP3	42	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450868024	EG	On-Demand	Anodyne	TIMP3	42	32
COc1cccc(OCCC(=O)NC(C)(C)CS(C)(=O)=O)c1	ZINC000450868026	ED	On-Demand	Anodyne	MTNR1A	39	41
COc1cccc(OCCC(=O)NC(C)(C)CS(C)(=O)=O)c1	ZINC000450868026	ED	On-Demand	Anodyne	MTNR1B	39	41
COCCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450868038	FD	On-Demand	Anodyne	DRD4	43	33
COCCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450868038	FD	On-Demand	Anodyne	HPGDS	37	51
COCCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450868039	FD	On-Demand	Anodyne	DRD4	43	33
COCCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450868039	FD	On-Demand	Anodyne	HPGDS	37	51
COC(=O)c1cccc(N2CC(=O)N(Cc3oc(C(C)C)nc3C)C2=O)c1	ZINC000450868045	FF	On-Demand	Anodyne	CTSG	17	42
Cc1nnc2ccc(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450868082	EG	On-Demand	Anodyne	LRRK2	23	42
CCc1nc(C)c(CN2C(=O)CN(c3cccc(C(=O)OC)c3)C2=O)o1	ZINC000450868105	FE	On-Demand	Anodyne	CTSG	17	43
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1	ZINC000450868106	FH	On-Demand	Anodyne	COLA	127	40
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1	ZINC000450868106	FH	On-Demand	Anodyne	CPT1A	110	40
C/C=C\COc1cccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1	ZINC000450868106	FH	On-Demand	Anodyne	CPT2	42	33
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450868107	DD	On-Demand	Anodyne	SLC27A1	40	32
C/C=C/COc1cccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1	ZINC000450868108	FH	On-Demand	Anodyne	COLA	127	40
C/C=C/COc1cccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1	ZINC000450868108	FH	On-Demand	Anodyne	CPT1A	110	40
C/C=C/COc1cccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1	ZINC000450868108	FH	On-Demand	Anodyne	CPT2	42	33
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450868109	DD	On-Demand	Anodyne	SLC27A1	40	32
C/C=C\COc1cccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c1	ZINC000450868110	FH	On-Demand	Anodyne	COLA	127	40
C/C=C\COc1cccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c1	ZINC000450868110	FH	On-Demand	Anodyne	CPT1A	110	40
C/C=C\COc1cccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c1	ZINC000450868110	FH	On-Demand	Anodyne	CPT2	42	33
Cc1cc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc(-c2cccnc2)n1	ZINC000450868112	FI	On-Demand	Anodyne	ROS1	36	43
C/C=C/COc1cccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c1	ZINC000450868113	FH	On-Demand	Anodyne	COLA	127	40
C/C=C/COc1cccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c1	ZINC000450868113	FH	On-Demand	Anodyne	CPT1A	110	40
C/C=C/COc1cccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c1	ZINC000450868113	FH	On-Demand	Anodyne	CPT2	42	33
CCc1nc(C)c(COc2cc(Br)ccc2C(C)=O)o1	ZINC000450868129	EI	On-Demand	Anodyne	SLC22A12	48	34
CCC[C@@]1(C(=O)OCC)CCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450868135	FG	On-Demand	Anodyne	SLC12A5	63	40
CCC[C@]1(C(=O)OCC)CCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450868137	FG	On-Demand	Anodyne	SLC12A5	63	40
Nc1ncccc1CN1CCC(CO)(Cc2ccccc2)CC1	ZINC000450868171	DE	On-Demand	Anodyne	NPFFR1	37	42
CCN(C(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868174	DE	On-Demand	Anodyne	DRD4	35	42
CCN(C(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868174	DE	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868174	DE	On-Demand	Anodyne	SIGMAR1	46	43
CCN(C(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868174	DE	On-Demand	Anodyne	CCR5	69	47
CCN(C(=O)[C@@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868174	DE	On-Demand	Anodyne	BIRC2	31	43
CCN(C(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868176	DE	On-Demand	Anodyne	DRD4	35	42
CCN(C(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868176	DE	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868176	DE	On-Demand	Anodyne	SIGMAR1	46	43
CCN(C(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868176	DE	On-Demand	Anodyne	CCR5	69	47
CCN(C(=O)[C@H](O)C1CCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450868176	DE	On-Demand	Anodyne	BIRC2	31	43
COc1cc(CN2CCCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450868177	EF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450868177	EF	On-Demand	Anodyne	AVPR1B	42	35
COc1cc(CN2CCCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450868177	EF	On-Demand	Anodyne	SSTR5	49	37
COc1cc(CN2CCCC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450868177	EF	On-Demand	Anodyne	UTS2R	28	41
CCN(C(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868178	DE	On-Demand	Anodyne	DRD4	35	42
CCN(C(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868178	DE	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868178	DE	On-Demand	Anodyne	SIGMAR1	46	43
CCN(C(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868178	DE	On-Demand	Anodyne	CCR5	69	47
CCN(C(=O)[C@@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868178	DE	On-Demand	Anodyne	BIRC2	31	43
COc1cc(CN2CCCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450868179	EF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450868179	EF	On-Demand	Anodyne	AVPR1B	42	35
COc1cc(CN2CCCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450868179	EF	On-Demand	Anodyne	SSTR5	49	37
COc1cc(CN2CCCC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450868179	EF	On-Demand	Anodyne	UTS2R	28	41
CCN(C(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868180	DE	On-Demand	Anodyne	DRD4	35	42
CCN(C(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868180	DE	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868180	DE	On-Demand	Anodyne	SIGMAR1	46	43
CCN(C(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868180	DE	On-Demand	Anodyne	CCR5	69	47
CCN(C(=O)[C@H](O)C1CCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450868180	DE	On-Demand	Anodyne	BIRC2	31	43
COc1ccc(-c2noc(CSCc3cc(C)ccc3OC)n2)nn1	ZINC000450868182	FG	On-Demand	Anodyne	WNT3A	18	40
COc1ccc(-c2noc(CSCc3cc(C)ccc3OC)n2)nn1	ZINC000450868182	FG	On-Demand	Anodyne	AXIN2	0	40
Cc1ccc(F)c(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c1	ZINC000450868195	DG	On-Demand	Anodyne	CPT1A	47	36
Cc1ccc(F)c(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1	ZINC000450868198	DG	On-Demand	Anodyne	CPT1A	47	36
CC(=O)[C@@](C)(O)CN1CCC(Oc2ccncc2C)CC1	ZINC000450868208	CD	On-Demand	Anodyne	HRH1	15	40
CC(=O)[C@](C)(O)CN1CCC(Oc2ccncc2C)CC1	ZINC000450868209	CD	On-Demand	Anodyne	HRH1	15	40
O=c1ccncn1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450868359	CH	On-Demand	Anodyne	DNAE	53	35
C[C@@H](Nc1ccc(C#N)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450868372	FG	On-Demand	Mild	TPP2	51	32
C[C@H](Nc1ccc(C#N)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450868373	FG	On-Demand	Mild	TPP2	51	32
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000450868374	FG	On-Demand	Mild	TPP2	51	32
C[C@H](Nc1ccc(C#N)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450868375	FG	On-Demand	Mild	TPP2	51	32
C=CCNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450868380	FF	On-Demand	Mild	TPP2	62	35
C=CCNC(=O)c1ccc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450868381	FF	On-Demand	Mild	TPP2	62	35
C=CCNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc1	ZINC000450868382	FF	On-Demand	Mild	TPP2	62	35
C=CCNC(=O)c1ccc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc1	ZINC000450868383	FF	On-Demand	Mild	TPP2	62	35
COc1cc2c(N3CC4(CCC4)[C@@H]3c3ccco3)ncnc2cc1F	ZINC000450868385	EI	On-Demand	Anodyne	PDE3A	45	34
COc1cc2c(N3CC4(CCC4)[C@@H]3c3ccco3)ncnc2cc1F	ZINC000450868385	EI	On-Demand	Anodyne	PDE3B	44	35
COc1cc2c(N3CC4(CCC4)[C@H]3c3ccco3)ncnc2cc1F	ZINC000450868387	EI	On-Demand	Anodyne	PDE3A	45	34
COc1cc2c(N3CC4(CCC4)[C@H]3c3ccco3)ncnc2cc1F	ZINC000450868387	EI	On-Demand	Anodyne	PDE3B	44	35
COc1ccccc1C1(CNC(=O)Cc2scnc2-c2ccccc2)CCC1	ZINC000450868391	GJ	On-Demand	Anodyne	KCNA3	48	41
COc1ccccc1C1(CNC(=O)Cc2scnc2-c2ccccc2)CCC1	ZINC000450868391	GJ	On-Demand	Anodyne	ACAT	0	46
CNS(=O)(=O)NCC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000450868408	EC	On-Demand	Anodyne	ACAT	0	51
CC[C@@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868410	CE	On-Demand	Anodyne	ADORA1	48	47
CC[C@@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868410	CE	On-Demand	Anodyne	ADORA2A	26	46
CC[C@@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868410	CE	On-Demand	Anodyne	ADORA2B	0	40
CC[C@@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868410	CE	On-Demand	Anodyne	P2RY1	41	40
CC[C@@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868410	CE	On-Demand	Anodyne	ADCY5	26	40
CC[C@@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868410	CE	On-Demand	Anodyne	ADORA3	43	32
CC[C@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868411	CE	On-Demand	Anodyne	ADORA1	48	47
CC[C@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868411	CE	On-Demand	Anodyne	ADORA2A	26	46
CC[C@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868411	CE	On-Demand	Anodyne	ADORA2B	0	40
CC[C@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868411	CE	On-Demand	Anodyne	P2RY1	41	40
CC[C@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868411	CE	On-Demand	Anodyne	ADCY5	26	40
CC[C@H](O)[C@@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868411	CE	On-Demand	Anodyne	ADORA3	43	32
CC[C@H](O)[C@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868412	CE	On-Demand	Anodyne	ADORA1	48	47
CC[C@H](O)[C@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868412	CE	On-Demand	Anodyne	ADORA2A	26	46
CC[C@H](O)[C@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868412	CE	On-Demand	Anodyne	ADORA2B	0	40
CC[C@H](O)[C@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868412	CE	On-Demand	Anodyne	P2RY1	41	40
CC[C@H](O)[C@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868412	CE	On-Demand	Anodyne	ADCY5	26	40
CC[C@H](O)[C@H](CC)Nc1ncnc2c1ncn2C1CC1	ZINC000450868412	CE	On-Demand	Anodyne	ADORA3	43	32
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](O)CC	ZINC000450868413	CE	On-Demand	Anodyne	ADORA1	48	47
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](O)CC	ZINC000450868413	CE	On-Demand	Anodyne	ADORA2A	26	46
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](O)CC	ZINC000450868413	CE	On-Demand	Anodyne	ADORA2B	0	40
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](O)CC	ZINC000450868413	CE	On-Demand	Anodyne	P2RY1	41	40
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](O)CC	ZINC000450868413	CE	On-Demand	Anodyne	ADCY5	26	40
CC[C@H](Nc1ncnc2c1ncn2C1CC1)[C@H](O)CC	ZINC000450868413	CE	On-Demand	Anodyne	ADORA3	43	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@]2(C)CC=CCC2)cc1	ZINC000450868421	DH	On-Demand	Anodyne	TIMP3	41	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@]2(C)CC=CCC2)cc1	ZINC000450868422	DH	On-Demand	Anodyne	TIMP3	41	32
COC(=O)[C@H](C)Cc1ccc(NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000450868423	DH	On-Demand	Anodyne	TIMP3	41	32
COC(=O)[C@@H](C)Cc1ccc(NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000450868424	DH	On-Demand	Anodyne	TIMP3	41	32
CC(C)(CS(C)(=O)=O)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450868427	FD	On-Demand	Anodyne	CCKBR	17	42
C=CCOc1ccc(CC(=O)NC(C)(C)c2ccc(C)nc2)cc1	ZINC000450868428	DH	On-Demand	Mild	CACNA1I	16	41
CS(=O)(=O)c1cccc(CN[C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1	ZINC000450868446	GI	On-Demand	Anodyne	PTGS2	20	44
CS(=O)(=O)c1cccc(CN[C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1	ZINC000450868446	GI	On-Demand	Anodyne	CTSF	52	34
CS(=O)(=O)c1cccc(CN[C@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1	ZINC000450868447	GI	On-Demand	Anodyne	PTGS2	20	44
CS(=O)(=O)c1cccc(CN[C@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1	ZINC000450868447	GI	On-Demand	Anodyne	CTSF	52	34
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	DRD2	17	42
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	DRD4	40	40
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	ACHE	24	40
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	DRD3	25	40
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	CHRM3	17	41
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	SIGMAR1	68	44
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	NPFFR2	37	45
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	ADAM17	20	42
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	MCHR1	22	40
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	MCHR2	74	38
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	CCR8	32	40
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	NPFFR1	63	49
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	SLC12A5	46	35
COC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1Cl	ZINC000450868460	GH	On-Demand	Anodyne	PA	27	44
CC(C)Cn1cc(C(=O)N2CCc3c2cccc3C(F)(F)F)c(C(F)F)n1	ZINC000450868519	GJ	On-Demand	Anodyne	SLC16A1	42	33
CCC[C@@]1(CO)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450868537	FE	On-Demand	Anodyne	MTNR1A	48	43
CCC[C@@]1(CO)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450868537	FE	On-Demand	Anodyne	MTNR1B	40	43
CCC[C@]1(CO)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450868538	FE	On-Demand	Anodyne	MTNR1A	48	43
CCC[C@]1(CO)CCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450868538	FE	On-Demand	Anodyne	MTNR1B	40	43
C[C@@H](N=c1[nH]c2ccccc2o1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450868559	DG	On-Demand	Anodyne	TPP2	54	35
C[C@H](N=c1[nH]c2ccccc2o1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450868561	DG	On-Demand	Anodyne	TPP2	54	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N=c1[nH]c2ccccc2o1	ZINC000450868563	DG	On-Demand	Anodyne	TPP2	54	35
C[C@H](N=c1[nH]c2ccccc2o1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450868565	DG	On-Demand	Anodyne	TPP2	54	35
CC(=O)CCCCCn1nnc(Cc2ccc(Cl)c(Cl)c2)n1	ZINC000450868588	EH	On-Demand	Anodyne	DNAE	60	32
O=C(c1c(Cl)cc(F)cc1Br)N1CCn2c(O)nnc2C1	ZINC000450868589	GE	On-Demand	Anodyne	P2RX7	44	48
CCOC(=O)c1ccnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c1[N+](=O)[O-]	ZINC000450868591	GH	On-Demand	Bother	TPP2	25	41
CCOC(=O)c1ccnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c1[N+](=O)[O-]	ZINC000450868592	GH	On-Demand	Bother	TPP2	25	41
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450868634	GG	On-Demand	Anodyne	SCD1	47	53
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450868634	GG	On-Demand	Anodyne	SCD	39	41
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450868635	GG	On-Demand	Anodyne	SCD1	60	53
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450868635	GG	On-Demand	Anodyne	SCD	48	53
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450868660	DC	On-Demand	Anodyne	SCD1	31	43
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450868661	DC	On-Demand	Anodyne	SCD1	31	43
Cc1cccnc1OC1CCN(Cc2cn(C)nc2C)CC1	ZINC000450868667	DE	On-Demand	Anodyne	SCN5A	39	43
CN1CCC2(CCN(Cc3ccn(CCc4ccccc4)n3)CC2)C1=O	ZINC000450868668	FF	On-Demand	Anodyne	SIGMAR1	24	41
CN1CCC2(CCN(Cc3ccn(CCc4ccccc4)n3)CC2)C1=O	ZINC000450868668	FF	On-Demand	Anodyne	EGLN1	0	40
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3ccsc23)C1	ZINC000450868676	EG	On-Demand	Anodyne	SIRT2	43	30
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3ccsc23)C1	ZINC000450868677	EG	On-Demand	Anodyne	SIRT2	43	30
N#Cc1ccnc(N2CC(c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450868680	DH	On-Demand	Mild	MAP3K12	64	36
C[C@H]1CN(CC(F)(F)F)CCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450868687	FG	On-Demand	Anodyne	SORD	43	35
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450868688	FG	On-Demand	Anodyne	SORD	43	35
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cn1	ZINC000450868790	DG	On-Demand	Anodyne	COLA	46	33
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cn1	ZINC000450868790	DG	On-Demand	Anodyne	CPT1A	47	33
Cn1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cn1	ZINC000450868791	DG	On-Demand	Anodyne	COLA	46	33
Cn1cc([C@H]2CCCCN2C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cn1	ZINC000450868791	DG	On-Demand	Anodyne	CPT1A	47	33
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000450868802	EE	On-Demand	Bother	TPP2	65	37
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000450868803	EE	On-Demand	Bother	TPP2	65	37
Cc1nc(N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncc1[N+](=O)[O-]	ZINC000450868804	EE	On-Demand	Bother	TPP2	65	37
Cc1nc(N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)ncc1[N+](=O)[O-]	ZINC000450868805	EE	On-Demand	Bother	TPP2	65	37
Cc1cc(OCc2ccccc2)nc(NCCN2CCC(O)CC2)n1	ZINC000450868818	ED	On-Demand	Anodyne	P2RX2	17	41
Cc1cc(OCc2ccccc2)nc(NCCN2CCC(O)CC2)n1	ZINC000450868818	ED	On-Demand	Anodyne	SIGMAR1	19	43
Cc1cc(OCc2ccccc2)nc(NCCN2CCC(O)CC2)n1	ZINC000450868818	ED	On-Demand	Anodyne	CARM1	45	33
C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)C(=O)C1CCOCC1	ZINC000450868820	GH	On-Demand	Mild	VCP	51	37
C=CCn1c(COc2ccccc2)nnc1S[C@H](C)C(=O)C1CCOCC1	ZINC000450868821	GH	On-Demand	Mild	VCP	51	37
COc1ccc(-n2c(SCCCCCC(C)=O)nnc2-c2ccccn2)cc1	ZINC000450868873	GJ	On-Demand	Anodyne	FAAH	17	40
CCn1cc([C@@H](C)Nc2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])cn1	ZINC000450868891	GE	On-Demand	Bother	TAAR1	18	42
CCn1cc([C@H](C)Nc2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])cn1	ZINC000450868892	GE	On-Demand	Bother	TAAR1	18	42
CCn1cc([C@H](C)Nc2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])cn1	ZINC000450868894	GE	On-Demand	Bother	TAAR1	18	42
COc1ccc(-c2csc3ncnc(NCCN4CCC(O)CC4)c23)cc1	ZINC000450868895	GG	On-Demand	Anodyne	ADRB3	27	48
COc1ccc(-c2csc3ncnc(NCCN4CCC(O)CC4)c23)cc1	ZINC000450868895	GG	On-Demand	Anodyne	GRM1	15	41
CCn1cc([C@@H](C)Nc2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])cn1	ZINC000450868896	GE	On-Demand	Bother	TAAR1	18	42
CCn1c(COc2ccc(Cl)cc2)nnc1SCC1(OC)CCC1	ZINC000450868934	FI	On-Demand	Anodyne	VCP	49	40
CC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450868955	DF	On-Demand	Anodyne	HPGDS	34	48
CC(C)N(C[C@H](O)COc1ccccc1)CC1(C#N)CCC1	ZINC000450868957	DF	On-Demand	Mild	ADRB2	15	43
CC(C)N(C[C@H](O)COc1ccccc1)CC1(C#N)CCC1	ZINC000450868957	DF	On-Demand	Mild	ABCB1	0	42
CC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450868958	DF	On-Demand	Anodyne	HPGDS	34	48
CC(C)N(C[C@@H](O)COc1ccccc1)CC1(C#N)CCC1	ZINC000450868959	DF	On-Demand	Mild	ADRB2	15	43
CC(C)N(C[C@@H](O)COc1ccccc1)CC1(C#N)CCC1	ZINC000450868959	DF	On-Demand	Mild	ABCB1	0	42
CSc1ccc2ncnc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)c2c1	ZINC000450868986	FH	On-Demand	Anodyne	PDE3A	44	35
CSc1ccc2ncnc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)c2c1	ZINC000450868986	FH	On-Demand	Anodyne	HTT	0	48
CSc1ccc2ncnc(N3CCN(CC(F)(F)F)C[C@H](C)C3)c2c1	ZINC000450868987	FH	On-Demand	Anodyne	PDE3A	44	35
CSc1ccc2ncnc(N3CCN(CC(F)(F)F)C[C@H](C)C3)c2c1	ZINC000450868987	FH	On-Demand	Anodyne	HTT	0	48
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ccncc3C)CC2)cc1	ZINC000450869039	FG	On-Demand	Anodyne	SSTR5	50	39
CCCC[C@@H](NC(=O)C(C)(C)C1CCC1)C(=O)OC	ZINC000450869051	CF	On-Demand	Anodyne	NOD1	74	34
CCCC[C@H](NC(=O)C(C)(C)C1CCC1)C(=O)OC	ZINC000450869052	CF	On-Demand	Anodyne	NOD1	74	34
CCCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869061	EF	On-Demand	Anodyne	GHRHR	59	35
CCCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869061	EF	On-Demand	Anodyne	P2RY12	50	35
CCCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869061	EF	On-Demand	Anodyne	KLK3	43	33
CCCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869061	EF	On-Demand	Anodyne	CTSK	64	47
CCCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869061	EF	On-Demand	Anodyne	TIMP3	70	37
CCCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869061	EF	On-Demand	Anodyne	CAPN1	45	40
CCCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869061	EF	On-Demand	Anodyne	CAPN2	63	37
CCCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869061	EF	On-Demand	Anodyne	NPPA	47	34
CCCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869062	EF	On-Demand	Anodyne	GHRHR	59	35
CCCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869062	EF	On-Demand	Anodyne	P2RY12	50	35
CCCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869062	EF	On-Demand	Anodyne	KLK3	43	33
CCCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869062	EF	On-Demand	Anodyne	CTSK	64	47
CCCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869062	EF	On-Demand	Anodyne	TIMP3	70	37
CCCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869062	EF	On-Demand	Anodyne	CAPN1	45	40
CCCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869062	EF	On-Demand	Anodyne	CAPN2	63	37
CCCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC	ZINC000450869062	EF	On-Demand	Anodyne	NPPA	47	34
CCOC(=O)c1ccc(CN2CCC(Oc3ccncc3C)CC2)nc1	ZINC000450869065	FG	On-Demand	Anodyne	SSTR5	46	37
COC(=O)c1cn([C@@H]2CCN(C(=O)c3c(C)cccc3Cl)C2)nn1	ZINC000450869072	EE	On-Demand	Anodyne	CCR5	34	41
COC(=O)c1cn([C@H]2CCN(C(=O)c3c(C)cccc3Cl)C2)nn1	ZINC000450869073	EE	On-Demand	Anodyne	CCR5	34	41
Clc1cncnc1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450869088	DH	On-Demand	Anodyne	PRCP	42	42
Clc1cncnc1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450869088	DH	On-Demand	Anodyne	KCNN3	36	48
Clc1cncnc1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450869089	DH	On-Demand	Anodyne	PRCP	42	42
CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450869109	GG	On-Demand	Anodyne	SSTR5	47	37
COc1cccc([C@@H]2C[C@H]2Nc2ccccn2)c1	ZINC000450869133	BG	On-Demand	Anodyne	EBP	17	44
COc1cccc([C@@H]2C[C@H]2Nc2ccccn2)c1	ZINC000450869133	BG	On-Demand	Anodyne	KDM1A	18	43
COc1cccc([C@@H]2C[C@H]2Nc2cc(C(C)=O)ccc2S(C)(=O)=O)c1	ZINC000450869150	FG	On-Demand	Anodyne	TAAR1	22	40
Cc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c(C)c1	ZINC000450869155	EF	On-Demand	Anodyne	ADRB2	0	49
Cc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c(C)c1	ZINC000450869156	EF	On-Demand	Anodyne	ADRB2	0	49
Cc1ccc(OC[C@H](O)CN[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c(C)c1	ZINC000450869157	EF	On-Demand	Anodyne	ADRB2	0	49
Cc1ccc(OC[C@H](O)CN[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c(C)c1	ZINC000450869158	EF	On-Demand	Anodyne	ADRB2	0	49
COc1cccc([C@@H]2C[C@H]2Nc2ncnc3c2cnn3C)c1	ZINC000450869183	CE	On-Demand	Anodyne	ABL1	0	41
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccc3F)n2Cc2ccco2)C1	ZINC000450869192	GJ	On-Demand	Anodyne	HCRTR2	20	42
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccc3F)n2Cc2ccco2)C1	ZINC000450869193	GJ	On-Demand	Anodyne	HCRTR2	20	42
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccc3F)n2Cc2ccco2)C1	ZINC000450869194	GJ	On-Demand	Anodyne	HCRTR2	20	42
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccc3F)n2Cc2ccco2)C1	ZINC000450869195	GJ	On-Demand	Anodyne	HCRTR2	20	42
CC(C)NC(=O)c1ccc(NC[C@@H](c2ccccc2)c2nc[nH]n2)c([N+](=O)[O-])c1	ZINC000450869229	GG	On-Demand	Bother	TAAR1	20	45
CC(C)NC(=O)c1ccc(NC[C@H](c2ccccc2)c2nc[nH]n2)c([N+](=O)[O-])c1	ZINC000450869230	GG	On-Demand	Bother	TAAR1	20	45
CCc1nc(C)c(CSc2nnc(-c3ccc(C)cc3)n2Cc2ccco2)o1	ZINC000450869238	GK	On-Demand	Anodyne	HCRTR2	20	40
c1nc(NC2CCN(C3CCC3)CC2)c2c3c(sc2n1)CCC3	ZINC000450869277	EH	On-Demand	Anodyne	IRAK4	19	64
CC(F)(F)CCn1nnc2c(cnn2-c2ccccc2)c1=O	ZINC000450869315	DE	On-Demand	Anodyne	Q9M629_MAIZE	48	31
CCOC(=O)c1n[nH]c(C2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450869331	FG	On-Demand	Anodyne	DRD4	18	48
CCS(=O)(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1	ZINC000450869386	GG	On-Demand	Anodyne	SIGMAR1	67	42
CCS(=O)(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1	ZINC000450869386	GG	On-Demand	Anodyne	MMP13	18	47
CCS(=O)(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1	ZINC000450869386	GG	On-Demand	Anodyne	NPFFR2	30	48
CCS(=O)(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1	ZINC000450869386	GG	On-Demand	Anodyne	ADAM17	24	47
CCS(=O)(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1	ZINC000450869386	GG	On-Demand	Anodyne	MCHR2	62	34
CCS(=O)(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1	ZINC000450869386	GG	On-Demand	Anodyne	NPFFR1	58	49
CCS(=O)(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)cc1	ZINC000450869386	GG	On-Demand	Anodyne	PA	23	42
COC(=O)c1ccc(CN2CCC3(CC2)CCN(C)C3=O)cc1Cl	ZINC000450869448	FF	On-Demand	Anodyne	MCHR2	40	36
CCCC[C@H](NC(=O)c1ccccc1-n1ccc(C)n1)C(=O)OC	ZINC000450869451	EF	On-Demand	Anodyne	P2RY12	41	31
CCCC[C@@H](NC(=O)c1ccccc1-n1ccc(C)n1)C(=O)OC	ZINC000450869452	EF	On-Demand	Anodyne	P2RY12	41	31
O=c1c2ccccc2sn1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450869453	CF	On-Demand	Anodyne	CASP7	41	33
O=c1c2ccccc2sn1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450869453	CF	On-Demand	Anodyne	SRTA	0	45
O=c1c2ccccc2sn1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450869462	CF	On-Demand	Anodyne	CASP7	41	33
O=c1c2ccccc2sn1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450869462	CF	On-Demand	Anodyne	SRTA	0	45
CCCC[C@@H](NC(=O)C1(C)CCC(=O)CC1)C(=O)OC	ZINC000450869468	CD	On-Demand	Anodyne	NOD1	48	31
CCCC[C@H](NC(=O)C1(C)CCC(=O)CC1)C(=O)OC	ZINC000450869469	CD	On-Demand	Anodyne	NOD1	48	31
CC(=O)CCCCCOc1cccc(C(F)(F)F)n1	ZINC000450869483	CH	On-Demand	Anodyne	LTB4R	22	41
COc1cccc([C@@H]2C[C@H]2Nc2ncc([N+](=O)[O-])cn2)c1	ZINC000450869486	CE	On-Demand	Bother	PRKCQ	0	42
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)c2cnn3ccc(C)cc23)cn1	ZINC000450869509	FF	On-Demand	Anodyne	EPHB3	33	46
CC(=O)CCCCCOc1ccc(Br)cc1[N+](=O)[O-]	ZINC000450869546	EH	On-Demand	Bother	THRA	23	50
CC(=O)CCCCCOc1ccc(Br)cc1[N+](=O)[O-]	ZINC000450869546	EH	On-Demand	Bother	S1PR4	0	41
O[C@@]1(C2CC2)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450869562	CF	On-Demand	Anodyne	CCR1	44	35
O[C@]1(C2CC2)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450869564	CF	On-Demand	Anodyne	CCR1	44	35
CCn1c(S[C@H]2C=CCCCCC2)nnc1-c1cccnc1	ZINC000450869596	DI	On-Demand	Anodyne	VCP	57	34
CCn1c(S[C@@H]2C=CCCCCC2)nnc1-c1cccnc1	ZINC000450869597	DI	On-Demand	Anodyne	VCP	57	34
COc1ccc(CNC(=O)CCN2CC[C@@](O)(C3CC3)C2)c(OC)c1	ZINC000450869616	ED	On-Demand	Anodyne	MTNR1A	43	33
COc1ccc(CNC(=O)CCN2CC[C@@](O)(C3CC3)C2)c(OC)c1	ZINC000450869616	ED	On-Demand	Anodyne	MTNR1B	31	41
COc1ccc(CNC(=O)CCN2CC[C@](O)(C3CC3)C2)c(OC)c1	ZINC000450869618	ED	On-Demand	Anodyne	MTNR1A	43	33
COc1ccc(CNC(=O)CCN2CC[C@](O)(C3CC3)C2)c(OC)c1	ZINC000450869618	ED	On-Demand	Anodyne	MTNR1B	31	41
CCn1cc([C@H](C)Nc2ncnc3c(C)csc23)cn1	ZINC000450869620	CG	On-Demand	Anodyne	LPAR2	22	45
CCn1cc([C@@H](C)Nc2ncnc3c(C)csc23)cn1	ZINC000450869622	CG	On-Demand	Anodyne	LPAR2	22	45
CC(=O)CCCCCSc1nnc(-c2cnccn2)n1Cc1ccco1	ZINC000450869665	FH	On-Demand	Anodyne	HCRTR2	0	48
CS(=O)(=O)[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869693	DF	On-Demand	Anodyne	SLC6A1	24	42
CS(=O)(=O)[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869693	DF	On-Demand	Anodyne	HRH3	24	44
CS(=O)(=O)[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869693	DF	On-Demand	Anodyne	SIGMAR1	22	46
CS(=O)(=O)[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869693	DF	On-Demand	Anodyne	CACNA1D	36	40
CS(=O)(=O)[C@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869693	DF	On-Demand	Anodyne	BIRC2	52	45
CS(=O)(=O)[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869694	DF	On-Demand	Anodyne	SLC6A1	24	42
CS(=O)(=O)[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869694	DF	On-Demand	Anodyne	HRH3	24	44
CS(=O)(=O)[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869694	DF	On-Demand	Anodyne	SIGMAR1	22	46
CS(=O)(=O)[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869694	DF	On-Demand	Anodyne	CACNA1D	36	40
CS(=O)(=O)[C@@H]1CCCCN(CCc2ccc(Cl)cc2)C1	ZINC000450869694	DF	On-Demand	Anodyne	BIRC2	52	45
COC(=O)c1csc(CN2CCCC[C@H]2c2cccc(Cl)c2)n1	ZINC000450869695	FI	On-Demand	Anodyne	COLA	34	41
COC(=O)c1csc(CN2CCCC[C@H]2c2cccc(Cl)c2)n1	ZINC000450869695	FI	On-Demand	Anodyne	CPT1A	33	41
COC(=O)c1csc(CN2CCCC[C@@H]2c2cccc(Cl)c2)n1	ZINC000450869696	FI	On-Demand	Anodyne	COLA	34	41
COC(=O)c1csc(CN2CCCC[C@@H]2c2cccc(Cl)c2)n1	ZINC000450869696	FI	On-Demand	Anodyne	CPT1A	33	41
C=CCn1c(COc2ccccc2)nnc1S[C@H]1C[C@H](C)CCC1=O	ZINC000450869790	FH	On-Demand	Mild	VCP	57	40
C=CCn1c(COc2ccccc2)nnc1S[C@@H]1C[C@H](C)CCC1=O	ZINC000450869791	FH	On-Demand	Mild	VCP	57	40
C=CCn1c(COc2ccccc2)nnc1S[C@@H]1C[C@@H](C)CCC1=O	ZINC000450869792	FH	On-Demand	Mild	VCP	57	40
C=CCn1c(COc2ccccc2)nnc1S[C@H]1C[C@@H](C)CCC1=O	ZINC000450869793	FH	On-Demand	Mild	VCP	57	40
COC[C@@H](c1ccc(Cl)cc1)N(C)Cc1cccc(C(C)=O)c1	ZINC000450869799	EI	On-Demand	Anodyne	UTS2	41	31
COC[C@H](c1ccc(Cl)cc1)N(C)Cc1cccc(C(C)=O)c1	ZINC000450869800	EI	On-Demand	Anodyne	UTS2	41	31
CCc1cc(CCCN2CCc3cccc(OC)c3CC2)on1	ZINC000450869811	DG	On-Demand	Anodyne	HTR1A	23	40
CCc1cc(CCCN2CCc3cccc(OC)c3CC2)on1	ZINC000450869811	DG	On-Demand	Anodyne	DRD2	28	43
CCc1cc(CCCN2CCc3cccc(OC)c3CC2)on1	ZINC000450869811	DG	On-Demand	Anodyne	DRD3	29	43
C[C@@H](O)CCSc1nnc(-c2ccccc2F)n1Cc1ccco1	ZINC000450869814	EH	On-Demand	Anodyne	HCRTR2	23	48
C[C@H](O)CCSc1nnc(-c2ccccc2F)n1Cc1ccco1	ZINC000450869815	EH	On-Demand	Anodyne	HCRTR2	23	48
Cc1ccc(-c2nnc(SCCC(C)(F)F)n2Cc2ccco2)cc1	ZINC000450869845	FK	On-Demand	Anodyne	HCRTR2	22	43
COc1cccc2c1CCN(Cc1cnn[nH]1)CC2	ZINC000450869880	CD	On-Demand	Anodyne	DRD2	15	40
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1	ZINC000450869932	FJ	On-Demand	Anodyne	SLC6A1	100	38
CCC(=O)CCCN1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1	ZINC000450869932	FJ	On-Demand	Anodyne	IARS	0	40
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1	ZINC000450869934	FJ	On-Demand	Anodyne	SLC6A1	100	38
CCC(=O)CCCN1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1	ZINC000450869934	FJ	On-Demand	Anodyne	IARS	0	40
COC(=O)c1cc(C)nc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c1[N+](=O)[O-]	ZINC000450869942	GH	On-Demand	Bother	KCNN3	30	42
COC(=O)c1cc(C)nc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c1[N+](=O)[O-]	ZINC000450869947	GH	On-Demand	Bother	KCNN3	30	42
CCCC[C@@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC	ZINC000450869952	CD	On-Demand	Anodyne	P2RY12	90	34
CCCC[C@@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC	ZINC000450869952	CD	On-Demand	Anodyne	ERAP2	40	38
CCCC[C@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC	ZINC000450869954	CD	On-Demand	Anodyne	P2RY12	90	34
CCCC[C@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC	ZINC000450869954	CD	On-Demand	Anodyne	ERAP2	40	38
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450869956	DE	On-Demand	Anodyne	AKT2	48	44
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450869956	DE	On-Demand	Anodyne	AKT1	22	40
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450869956	DE	On-Demand	Anodyne	LIMK2	35	43
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450869957	DE	On-Demand	Anodyne	AKT2	48	44
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450869957	DE	On-Demand	Anodyne	AKT1	22	40
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450869957	DE	On-Demand	Anodyne	LIMK2	35	43
Cc1cc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc(C)n1	ZINC000450869974	DE	On-Demand	Anodyne	SORD	16	43
Cc1cc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc(C)n1	ZINC000450869976	DE	On-Demand	Anodyne	SORD	16	43
Cn1ncc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c(Cl)c1=O	ZINC000450869978	EG	On-Demand	Anodyne	PRCP	44	36
Cn1ncc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c(Cl)c1=O	ZINC000450869978	EG	On-Demand	Anodyne	KCNN3	40	45
Cn1ncc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c(Cl)c1=O	ZINC000450869981	EG	On-Demand	Anodyne	PRCP	44	36
Cn1ncc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c(Cl)c1=O	ZINC000450869981	EG	On-Demand	Anodyne	KCNN3	40	45
CCCC[C@@H](NC(=O)[C@@]1(COC)CCOC1)C(=O)OC	ZINC000450869983	CC	On-Demand	Anodyne	NOD1	44	30
CCCC[C@H](NC(=O)[C@]1(COC)CCOC1)C(=O)OC	ZINC000450869984	CC	On-Demand	Anodyne	NOD1	44	30
CCCC[C@@H](NC(=O)[C@]1(COC)CCOC1)C(=O)OC	ZINC000450869986	CC	On-Demand	Anodyne	NOD1	44	30
CCCC[C@H](NC(=O)[C@@]1(COC)CCOC1)C(=O)OC	ZINC000450869988	CC	On-Demand	Anodyne	NOD1	44	30
Cc1cnccc1OC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450870016	EH	On-Demand	Anodyne	SCN5A	53	33
Cc1cnccc1OC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450870016	EH	On-Demand	Anodyne	SCD1	23	42
FC(F)(F)c1cccc(C2CN(c3ccc4nnc(C(F)(F)F)n4n3)C2)c1	ZINC000450870060	GH	On-Demand	Anodyne	LRRK2	22	43
COc1ccc2c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)ncnc2c1F	ZINC000450870061	FG	On-Demand	Anodyne	PDE3A	45	36
COc1ccc2c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)ncnc2c1F	ZINC000450870061	FG	On-Demand	Anodyne	PDE3B	66	35
COc1ccc2c(N3CCN(CC(F)(F)F)C[C@H](C)C3)ncnc2c1F	ZINC000450870062	FG	On-Demand	Anodyne	PDE3A	45	36
COc1ccc2c(N3CCN(CC(F)(F)F)C[C@H](C)C3)ncnc2c1F	ZINC000450870062	FG	On-Demand	Anodyne	PDE3B	66	35
CCc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc(C)n1	ZINC000450870072	DH	On-Demand	Anodyne	PRCP	24	41
CCc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc(C)n1	ZINC000450870073	DH	On-Demand	Anodyne	PRCP	24	41
CCCC[C@@H](NC(=O)C(C)(C)C(C)(F)F)C(=O)OC	ZINC000450870078	CF	On-Demand	Anodyne	CTSK	23	44
CCCC[C@@H](NC(=O)C(C)(C)C(C)(F)F)C(=O)OC	ZINC000450870078	CF	On-Demand	Anodyne	NOD1	59	32
CCCC[C@H](NC(=O)C(C)(C)C(C)(F)F)C(=O)OC	ZINC000450870079	CF	On-Demand	Anodyne	CTSK	23	44
CCCC[C@H](NC(=O)C(C)(C)C(C)(F)F)C(=O)OC	ZINC000450870079	CF	On-Demand	Anodyne	NOD1	59	32
CCCC[C@@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450870080	FE	On-Demand	Bother	P2RY12	125	33
CCCC[C@@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450870080	FE	On-Demand	Bother	CCR3	23	40
CCCC[C@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450870081	FE	On-Demand	Bother	P2RY12	125	33
CCCC[C@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OC	ZINC000450870081	FE	On-Demand	Bother	CCR3	23	40
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450870088	FG	On-Demand	Bother	SLC6A4	15	52
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450870089	FG	On-Demand	Bother	SLC6A4	15	52
C=CCn1c(COc2ccccc2)nnc1SC1CC(OC(C)(C)C)C1	ZINC000450870097	FI	On-Demand	Mild	VCP	71	44
COC(=O)c1coc(CN2CCC(CO)(Cc3ccccc3)CC2)n1	ZINC000450870106	EE	On-Demand	Anodyne	NPFFR1	47	41
COC(=O)c1coc(CN2CCC(CO)(Cc3ccccc3)CC2)n1	ZINC000450870106	EE	On-Demand	Anodyne	SLC12A5	43	36
Cn1cc([C@@H]2CCCCN2C(=O)C[C@@H]2CSc3ccccc3O2)cn1	ZINC000450870107	FG	On-Demand	Anodyne	COLA	96	39
Cn1cc([C@@H]2CCCCN2C(=O)C[C@@H]2CSc3ccccc3O2)cn1	ZINC000450870107	FG	On-Demand	Anodyne	CPT1A	84	39
Cn1cc([C@@H]2CCCCN2C(=O)C[C@H]2CSc3ccccc3O2)cn1	ZINC000450870108	FG	On-Demand	Anodyne	COLA	96	39
Cn1cc([C@@H]2CCCCN2C(=O)C[C@H]2CSc3ccccc3O2)cn1	ZINC000450870108	FG	On-Demand	Anodyne	CPT1A	84	39
Cn1cc([C@H]2CCCCN2C(=O)C[C@@H]2CSc3ccccc3O2)cn1	ZINC000450870110	FG	On-Demand	Anodyne	COLA	96	39
Cn1cc([C@H]2CCCCN2C(=O)C[C@@H]2CSc3ccccc3O2)cn1	ZINC000450870110	FG	On-Demand	Anodyne	CPT1A	84	39
Cn1cc([C@H]2CCCCN2C(=O)C[C@H]2CSc3ccccc3O2)cn1	ZINC000450870112	FG	On-Demand	Anodyne	COLA	96	39
Cn1cc([C@H]2CCCCN2C(=O)C[C@H]2CSc3ccccc3O2)cn1	ZINC000450870112	FG	On-Demand	Anodyne	CPT1A	84	39
C=CCn1c(COc2ccccc2)nnc1S[C@@H]1C[C@H]2CCCC[C@@H]2NC1=O	ZINC000450870115	GH	On-Demand	Mild	VCP	70	43
C=CCn1c(COc2ccccc2)nnc1S[C@@H]1C[C@@H]2CCCC[C@H]2NC1=O	ZINC000450870118	GH	On-Demand	Mild	VCP	70	43
C=CCn1c(COc2ccccc2)nnc1S[C@@H]1C[C@H]2CCCC[C@H]2NC1=O	ZINC000450870120	GH	On-Demand	Mild	VCP	70	43
C=CCn1c(COc2ccccc2)nnc1S[C@@H]1C[C@@H]2CCCC[C@@H]2NC1=O	ZINC000450870122	GH	On-Demand	Mild	VCP	70	43
CC(C)(C)O[C@@H]1C[C@@H](Nc2cc(C(F)(F)F)nc3ncnn23)[C@@H]1n1cccn1	ZINC000450870133	GF	On-Demand	Anodyne	DHOD	0	42
CC(C)(C)O[C@@H]1C[C@@H](Nc2cc(C(F)(F)F)nc3ncnn23)[C@H]1n1cccn1	ZINC000450870141	GF	On-Demand	Anodyne	DHOD	0	42
CC(C)(C)O[C@@H]1C[C@H](Nc2cc(C(F)(F)F)nc3ncnn23)[C@H]1n1cccn1	ZINC000450870143	GF	On-Demand	Anodyne	DHOD	0	42
CC(C)(C)O[C@@H]1C[C@H](Nc2cc(C(F)(F)F)nc3ncnn23)[C@@H]1n1cccn1	ZINC000450870146	GF	On-Demand	Anodyne	DHOD	0	42
C[C@@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450870211	GG	On-Demand	Anodyne	TPP2	62	36
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450870213	GG	On-Demand	Anodyne	TPP2	62	36
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1ccc(S(C)(=O)=O)cc1F	ZINC000450870215	GG	On-Demand	Anodyne	TPP2	62	36
C[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450870216	GG	On-Demand	Anodyne	TPP2	62	36
CCn1c(COc2ccc(Cl)cc2)nnc1SCn1cccn1	ZINC000450870271	EG	On-Demand	Anodyne	VCP	44	40
COC(=O)Cc1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)c([N+](=O)[O-])c1	ZINC000450870299	FG	On-Demand	Bother	TAAR1	18	41
COCc1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450870304	EH	On-Demand	Bother	CACNA1C	52	38
COCc1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450870304	EH	On-Demand	Bother	CACNA1D	83	38
COc1cccc([C@@H]2C[C@H]2Nc2ncc([N+](=O)[O-])c(C)n2)c1	ZINC000450870312	DF	On-Demand	Bother	PRKCQ	46	47
Cc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450870335	EH	On-Demand	Bother	PRCP	22	40
Cc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450870335	EH	On-Demand	Bother	KCNN3	31	43
Cc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450870336	EH	On-Demand	Bother	PRCP	22	40
Cc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450870336	EH	On-Demand	Bother	KCNN3	31	43
FC(F)(F)C1CCC(Sc2ncnc3[nH]ccc23)CC1	ZINC000450870339	DI	On-Demand	Anodyne	AKT2	17	44
FC(F)(F)C1CCC(Sc2ncnc3[nH]ccc23)CC1	ZINC000450870339	DI	On-Demand	Anodyne	JAK3	19	42
FC(F)(F)C1CCC(Sc2ncnc3[nH]ccc23)CC1	ZINC000450870339	DI	On-Demand	Anodyne	JAK1	19	42
CC(C)(CO)[C@@H](NC[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450870343	DI	On-Demand	Anodyne	AMY2	44	30
CC(C)(CO)[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450870344	DI	On-Demand	Anodyne	AMY2	44	30
CC(C)(CO)[C@H](NC[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450870345	DI	On-Demand	Anodyne	AMY2	44	30
CC(C)(CO)[C@H](NC[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450870346	DI	On-Demand	Anodyne	AMY2	44	30
Cc1cccnc1OC1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450870353	EG	On-Demand	Anodyne	SCN5A	0	40
Cc1cccnc1OC1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450870354	EG	On-Demand	Anodyne	SCN5A	0	40
Cc1cccnc1OC1CCN(CC[C@H]2CCOC2)CC1	ZINC000450870356	CF	On-Demand	Anodyne	HTR4	40	36
Cc1cccnc1OC1CCN(CC[C@H]2CCOC2)CC1	ZINC000450870356	CF	On-Demand	Anodyne	SCN5A	43	32
Cc1cccnc1OC1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450870357	CF	On-Demand	Anodyne	HTR4	40	36
Cc1cccnc1OC1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450870357	CF	On-Demand	Anodyne	SCN5A	43	32
CCCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450870364	DD	On-Demand	Anodyne	CTSK	0	43
CCCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450870364	DD	On-Demand	Anodyne	MMP3	22	40
CCCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450870364	DD	On-Demand	Anodyne	PROTEASE	0	40
CCCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450870364	DD	On-Demand	Anodyne	NOD1	53	31
CCCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450870365	DD	On-Demand	Anodyne	CTSK	0	43
CCCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450870365	DD	On-Demand	Anodyne	MMP3	22	40
CCCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450870365	DD	On-Demand	Anodyne	PROTEASE	0	40
CCCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC	ZINC000450870365	DD	On-Demand	Anodyne	NOD1	53	31
CCOC(=O)c1cccnc1N1CCN(CC(F)(F)F)C[C@@H](C)C1	ZINC000450870367	EF	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)c1cccnc1N1CCN(CC(F)(F)F)C[C@H](C)C1	ZINC000450870368	EF	On-Demand	Anodyne	P2RY12	46	36
O=c1c2ccccc2sn1C[C@@H]1CCCCC1(F)F	ZINC000450870369	CH	On-Demand	Anodyne	CASP7	45	36
O=c1c2ccccc2sn1C[C@@H]1CCCCC1(F)F	ZINC000450870369	CH	On-Demand	Anodyne	SRTA	0	45
O=c1c2ccccc2sn1C[C@H]1CCCCC1(F)F	ZINC000450870370	CH	On-Demand	Anodyne	CASP7	45	36
O=c1c2ccccc2sn1C[C@H]1CCCCC1(F)F	ZINC000450870370	CH	On-Demand	Anodyne	SRTA	0	45
CCCOc1cccc(CN(C)Cc2ccnn2CC)c1	ZINC000450870379	CG	On-Demand	Anodyne	ACHE	0	41
CCCOc1cccc(CN(C)Cc2ccnn2CC)c1	ZINC000450870379	CG	On-Demand	Anodyne	SQLE	45	31
C[C@H]1CN(CC(F)(F)F)CCN(c2nccc(CO)n2)C1	ZINC000450870383	DD	On-Demand	Anodyne	SORD	40	38
Fc1cc2ncnc(N[C@@H]3CCO[C@H](c4cccs4)C3)c2cc1F	ZINC000450870396	EI	On-Demand	Anodyne	CD38	58	42
Fc1cc2ncnc(N[C@H]3CCO[C@H](c4cccs4)C3)c2cc1F	ZINC000450870397	EI	On-Demand	Anodyne	CD38	58	42
Fc1cc2ncnc(N[C@H]3CCO[C@@H](c4cccs4)C3)c2cc1F	ZINC000450870398	EI	On-Demand	Anodyne	CD38	58	42
C[C@@H]1CN(CC(F)(F)F)CCN(c2nccc(CO)n2)C1	ZINC000450870418	DD	On-Demand	Anodyne	SORD	40	38
COc1ccc(CNC(=O)CCN2CCC(C)(C)S(=O)(=O)CC2)c(OC)c1	ZINC000450870441	GD	On-Demand	Anodyne	HTR7	25	41
COc1ccc(CNC(=O)CCN2CCC(C)(C)S(=O)(=O)CC2)c(OC)c1	ZINC000450870441	GD	On-Demand	Anodyne	MTNR1A	34	42
COc1ccc(CNC(=O)CCN2CCC(C)(C)S(=O)(=O)CC2)c(OC)c1	ZINC000450870441	GD	On-Demand	Anodyne	MTNR1B	25	42
Cc1nc(C)c(F)c(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450870443	EH	On-Demand	Anodyne	PRCP	44	40
Cc1nc(C)c(F)c(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450870443	EH	On-Demand	Anodyne	KCNN3	38	48
Cc1nc(C)c(F)c(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450870450	EH	On-Demand	Anodyne	PRCP	44	40
Cc1nc(C)c(F)c(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450870450	EH	On-Demand	Anodyne	KCNN3	38	48
COc1ccc(-c2noc(CN3CCC(Oc4ncccc4C)CC3)n2)nn1	ZINC000450870457	GE	On-Demand	Anodyne	SCN5A	43	32
O[C@@H](CNC1(c2cccc(C(F)(F)F)c2)CCOCC1)Cc1ccccc1	ZINC000450870487	GH	On-Demand	Anodyne	CTSD	27	50
O[C@@H](CNC1(c2cccc(C(F)(F)F)c2)CCOCC1)Cc1ccccc1	ZINC000450870487	GH	On-Demand	Anodyne	BACE1	23	41
O[C@@H](CNC1(c2cccc(C(F)(F)F)c2)CCOCC1)Cc1ccccc1	ZINC000450870487	GH	On-Demand	Anodyne	PHES	0	41
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ncccc3C)CC2)cc1	ZINC000450870488	FG	On-Demand	Anodyne	SSTR5	51	40
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ncccc3C)CC2)cc1	ZINC000450870488	FG	On-Demand	Anodyne	SCN9A	0	46
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ncccc3C)CC2)cc1	ZINC000450870488	FG	On-Demand	Anodyne	SCN5A	71	38
Cc1ccc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450870535	FI	On-Demand	Anodyne	HCRTR2	0	44
Cc1ccc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450870536	FI	On-Demand	Anodyne	HCRTR2	0	44
Cc1ccc(-c2nnc(SCC3CC(F)(F)C3)n2Cc2ccco2)cc1	ZINC000450870543	GK	On-Demand	Anodyne	HCRTR2	22	42
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	HTR1A	63	67
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	DRD2	56	49
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	DRD1	34	41
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	DRD4	41	31
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	HTR2A	36	42
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	DRD3	50	42
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	DRD5	25	49
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	HTR7	61	45
CCC(=O)CCCN1CCc2cccc(OC)c2CC1	ZINC000450870558	CF	On-Demand	Anodyne	SIGMAR1	22	42
COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870566	GG	On-Demand	Anodyne	DRD4	26	41
COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870566	GG	On-Demand	Anodyne	ACHE	31	47
COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870566	GG	On-Demand	Anodyne	DRD3	0	45
COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870566	GG	On-Demand	Anodyne	HTR4	22	47
COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870566	GG	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870566	GG	On-Demand	Anodyne	NPY2R	44	33
COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870566	GG	On-Demand	Anodyne	CCR3	56	38
COC(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870566	GG	On-Demand	Anodyne	MCHR1	30	42
COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870567	GG	On-Demand	Anodyne	DRD4	26	41
COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870567	GG	On-Demand	Anodyne	ACHE	31	47
COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870567	GG	On-Demand	Anodyne	DRD3	0	45
COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870567	GG	On-Demand	Anodyne	HTR4	22	47
COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870567	GG	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870567	GG	On-Demand	Anodyne	NPY2R	44	33
COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870567	GG	On-Demand	Anodyne	CCR3	56	38
COC(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1Cl	ZINC000450870567	GG	On-Demand	Anodyne	MCHR1	30	42
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C1CCCC1	ZINC000450870570	EG	On-Demand	Bother	TBXA2R	28	44
CC[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C1CCCC1	ZINC000450870571	EG	On-Demand	Bother	TBXA2R	28	44
COc1cccc2c1CCN(C[C@@H]1CCC(F)(F)C1)CC2	ZINC000450870572	CH	On-Demand	Anodyne	HTR1A	15	72
COc1cccc2c1CCN(C[C@H]1CCC(F)(F)C1)CC2	ZINC000450870573	CH	On-Demand	Anodyne	HTR1A	15	72
CCn1nnc(C)c1CSc1nnc(-c2ccc(C)cc2)n1Cc1ccco1	ZINC000450870588	GI	On-Demand	Anodyne	HCRTR2	21	43
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	DRD2	33	54
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	DRD1	22	46
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	DRD4	23	44
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	HTR2A	38	49
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	HTR2C	23	52
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	ADRA1B	19	41
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	ERG2	19	41
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	HTR1F	25	40
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	HTR7	18	41
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	CCR3	22	42
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	SLC18A3	0	41
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	HTR3B	0	43
CCOC(=O)c1n[nH]c(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450870614	GF	On-Demand	Anodyne	CYP2J2	56	41
CC(=O)CCCCCSc1ccncc1	ZINC000450870651	BG	On-Demand	Anodyne	THRB	0	40
CCOC(=O)c1ccc(N[C@@H]2C[C@H]2c2cccc(OC)c2)nc1	ZINC000450870705	DG	On-Demand	Anodyne	P2RY12	24	45
C=CCn1c(COc2ccccc2)nnc1SC[C@@H]1CCNC(=O)CC1	ZINC000450870706	FG	On-Demand	Mild	VCP	57	38
C=CCn1c(COc2ccccc2)nnc1SC[C@H]1CCNC(=O)CC1	ZINC000450870708	FG	On-Demand	Mild	VCP	57	38
CC[C@H](N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)C(=O)Nc1ccc(OC)cc1	ZINC000450870754	FG	On-Demand	Anodyne	TIMP3	69	43
CC[C@H](N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)C(=O)Nc1ccc(OC)cc1	ZINC000450870756	FG	On-Demand	Anodyne	TIMP3	69	43
CC[C@H](N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)C(=O)Nc1ccc(OC)cc1	ZINC000450870759	FG	On-Demand	Anodyne	TIMP3	69	43
CC[C@H](N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)C(=O)Nc1ccc(OC)cc1	ZINC000450870761	FG	On-Demand	Anodyne	TIMP3	69	43
COc1ccc(CNC(=O)CCN(C)[C@H]2CC2(C)C)c(OC)c1	ZINC000450870763	DE	On-Demand	Anodyne	MTNR1A	54	36
COc1ccc(CNC(=O)CCN(C)[C@@H]2CC2(C)C)c(OC)c1	ZINC000450870765	DE	On-Demand	Anodyne	MTNR1A	54	36
CCOC(=O)c1cc(C(=O)N[C@H]2CCCO[C@@H]2c2cnn(CC)c2)on1	ZINC000450870766	FD	On-Demand	Anodyne	PANC	40	31
CC(=O)CCCCCSc1nnc(-c2ccccc2F)n1Cc1ccco1	ZINC000450870772	GJ	On-Demand	Anodyne	HCRTR2	24	49
CCCc1cc(NC[C@@H](c2ccccc2)c2nc[nH]n2)n2ncnc2n1	ZINC000450870817	EE	On-Demand	Anodyne	DHOD	0	45
CCCc1cc(NC[C@H](c2ccccc2)c2nc[nH]n2)n2ncnc2n1	ZINC000450870818	EE	On-Demand	Anodyne	DHOD	0	45
CCn1c(COc2ccc(Cl)cc2)nnc1SCC1(C#N)CCC1	ZINC000450870845	FI	On-Demand	Mild	VCP	42	39
CCOc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2cnccn2)cc1	ZINC000450870857	GH	On-Demand	Anodyne	CACNA2D1	51	37
CCOc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2cnccn2)cc1	ZINC000450870858	GH	On-Demand	Anodyne	CACNA2D1	51	37
C=CCn1c(O)nnc1S[C@H](C)C(=O)Nc1nccs1	ZINC000450870884	DD	On-Demand	Mild	MAP	0	41
C=CCn1c(O)nnc1S[C@H](C)C(=O)Nc1nccs1	ZINC000450870884	DD	On-Demand	Mild	MAP1	93	41
C=CCn1c(O)nnc1S[C@@H](C)C(=O)Nc1nccs1	ZINC000450870885	DD	On-Demand	Mild	MAP	0	41
C=CCn1c(O)nnc1S[C@@H](C)C(=O)Nc1nccs1	ZINC000450870885	DD	On-Demand	Mild	MAP1	93	41
COc1ccc(C)cc1CS[C@@H]1C[C@H]2CCCC[C@H]2NC1=O	ZINC000450870893	DH	On-Demand	Anodyne	QRFPR	46	39
COc1ccc(C)cc1CS[C@@H]1C[C@@H]2CCCC[C@@H]2NC1=O	ZINC000450870894	DH	On-Demand	Anodyne	QRFPR	46	39
COc1ccc(C)cc1CS[C@@H]1C[C@H]2CCCC[C@@H]2NC1=O	ZINC000450870895	DH	On-Demand	Anodyne	QRFPR	46	39
COc1ccc(C)cc1CS[C@@H]1C[C@@H]2CCCC[C@H]2NC1=O	ZINC000450870896	DH	On-Demand	Anodyne	QRFPR	46	39
CCN(CCC1CC1)C(=O)c1ccc(C)c(C(=O)N(CC)CCC2CC2)c1	ZINC000450870897	FJ	On-Demand	Anodyne	OPRD1	30	42
CCN(CCC1CC1)C(=O)c1ccc(C)c(C(=O)N(CC)CCC2CC2)c1	ZINC000450870897	FJ	On-Demand	Anodyne	ACKR3	42	33
CC(C)c1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450870916	DI	On-Demand	Anodyne	PRCP	26	50
CC(C)c1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450870916	DI	On-Demand	Anodyne	KCNN3	32	47
CC(C)c1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450870917	DI	On-Demand	Anodyne	PRCP	26	50
CC(C)c1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450870917	DI	On-Demand	Anodyne	KCNN3	32	47
CC(=O)c1ccc(SC2CCC(C(F)(F)F)CC2)c([N+](=O)[O-])c1	ZINC000450870921	EK	On-Demand	Bother	GSTM2	44	32
CN1CCC2(CCN(CCc3ccc(Cl)cc3)CC2)C1=O	ZINC000450870924	DF	On-Demand	Anodyne	SIGMAR1	34	43
CCCC[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)OC	ZINC000450870944	CC	On-Demand	Anodyne	NOD1	77	36
CCCC[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)OC	ZINC000450870945	CC	On-Demand	Anodyne	NOD1	77	36
CCOC(=O)c1cc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)ncc1Cl	ZINC000450870964	GG	On-Demand	Anodyne	P2RY12	41	35
CCOC(=O)c1cc(N2CCN(CC(F)(F)F)C[C@H](C)C2)ncc1Cl	ZINC000450870965	GG	On-Demand	Anodyne	P2RY12	41	35
Cc1nc(N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)ncc1[N+](=O)[O-]	ZINC000450870971	EE	On-Demand	Bother	PRKCQ	43	35
Cc1nc(N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)ncc1[N+](=O)[O-]	ZINC000450870972	EE	On-Demand	Bother	PRKCQ	43	35
Cc1nc(N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)ncc1[N+](=O)[O-]	ZINC000450870973	EE	On-Demand	Bother	PRKCQ	43	35
Cc1nc(N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)ncc1[N+](=O)[O-]	ZINC000450870974	EE	On-Demand	Bother	PRKCQ	43	35
COc1cc(CN2CCN(C3CCOCC3)C[C@@H]2C)ccc1Cl	ZINC000450870984	EG	On-Demand	Anodyne	SSTR5	41	35
COc1cc(CN2CCN(C3CCOCC3)C[C@H]2C)ccc1Cl	ZINC000450870985	EG	On-Demand	Anodyne	SSTR5	41	35
C[C@H]1[C@H](CO)CCN1C[C@H](O)Cc1ccccc1	ZINC000450870986	BD	On-Demand	Anodyne	SLC18A2	43	37
C[C@H]1[C@H](CO)CCN1C[C@H](O)Cc1ccccc1	ZINC000450870986	BD	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@@H]1[C@@H](CO)CCN1C[C@H](O)Cc1ccccc1	ZINC000450870987	BD	On-Demand	Anodyne	SLC18A2	43	37
C[C@@H]1[C@@H](CO)CCN1C[C@H](O)Cc1ccccc1	ZINC000450870987	BD	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H]1[C@@H](CO)CCN1C[C@H](O)Cc1ccccc1	ZINC000450870988	BD	On-Demand	Anodyne	SLC18A2	43	37
C[C@H]1[C@@H](CO)CCN1C[C@H](O)Cc1ccccc1	ZINC000450870988	BD	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@@H]1[C@H](CO)CCN1C[C@H](O)Cc1ccccc1	ZINC000450870989	BD	On-Demand	Anodyne	SLC18A2	43	37
C[C@@H]1[C@H](CO)CCN1C[C@H](O)Cc1ccccc1	ZINC000450870989	BD	On-Demand	Anodyne	VACHT_TETCF	0	42
O[C@H]([C@H]1CCN(c2ncc(C(F)(F)F)s2)C1)C(F)(F)F	ZINC000450870991	DF	On-Demand	Anodyne	MLYCD	66	42
O[C@@H]([C@H]1CCN(c2ncc(C(F)(F)F)s2)C1)C(F)(F)F	ZINC000450870992	DF	On-Demand	Anodyne	MLYCD	66	42
O[C@H]([C@@H]1CCN(c2ncc(C(F)(F)F)s2)C1)C(F)(F)F	ZINC000450870993	DF	On-Demand	Anodyne	MLYCD	66	42
O[C@@H]([C@@H]1CCN(c2ncc(C(F)(F)F)s2)C1)C(F)(F)F	ZINC000450870994	DF	On-Demand	Anodyne	MLYCD	66	42
CCS(=O)(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1	ZINC000450871003	FE	On-Demand	Anodyne	SSTR5	64	42
Fc1ccc([C@H](NCc2cn(CC3CC3)nn2)C(F)(F)F)cc1Cl	ZINC000450871009	FH	On-Demand	Anodyne	MAP3K8	42	31
O[C@@H]([C@@H]1CCN(c2ncccc2C(F)(F)F)C1)C(F)(F)F	ZINC000450871013	DF	On-Demand	Anodyne	TRPV1	34	44
Fc1ccc([C@@H](NCc2cn(CC3CC3)nn2)C(F)(F)F)cc1Cl	ZINC000450871014	FH	On-Demand	Anodyne	MAP3K8	42	31
O[C@@H]([C@H]1CCN(c2ncccc2C(F)(F)F)C1)C(F)(F)F	ZINC000450871015	DF	On-Demand	Anodyne	TRPV1	34	44
O[C@H]([C@H]1CCN(c2ncccc2C(F)(F)F)C1)C(F)(F)F	ZINC000450871017	DF	On-Demand	Anodyne	TRPV1	34	44
O[C@H]([C@@H]1CCN(c2ncccc2C(F)(F)F)C1)C(F)(F)F	ZINC000450871018	DF	On-Demand	Anodyne	TRPV1	34	44
CN(C)c1nccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450871022	CD	On-Demand	Anodyne	SORD	66	38
CN(C)c1nccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450871026	CD	On-Demand	Anodyne	SORD	66	38
CN(C)c1nccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450871027	CD	On-Demand	Anodyne	SORD	66	38
CN(C)c1nccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450871028	CD	On-Demand	Anodyne	SORD	66	38
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	DRD2	33	46
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	DRD1	27	48
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	DRD4	24	48
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	HTR2A	42	52
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	HTR2C	27	56
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	ADRA1A	22	41
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	HRH1	22	59
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	DRD3	0	46
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	HTR4	25	41
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	HTR7	24	46
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	SCN5A	42	37
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCCN1CCC(Oc2ncccc2F)CC1)c1ccc(F)cc1	ZINC000450871043	FH	On-Demand	Anodyne	AP2S1	0	46
Cn1cc([C@@H]2CCCCN2C(=O)CCCC(=O)C2CC2)cn1	ZINC000450871061	DF	On-Demand	Anodyne	COLA	70	35
Cn1cc([C@@H]2CCCCN2C(=O)CCCC(=O)C2CC2)cn1	ZINC000450871061	DF	On-Demand	Anodyne	CPT1A	69	34
Cn1cc([C@H]2CCCCN2C(=O)CCCC(=O)C2CC2)cn1	ZINC000450871064	DF	On-Demand	Anodyne	COLA	70	35
Cn1cc([C@H]2CCCCN2C(=O)CCCC(=O)C2CC2)cn1	ZINC000450871064	DF	On-Demand	Anodyne	CPT1A	69	34
Cc1nnc2c3ccccc3c(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450871094	GI	On-Demand	Anodyne	CREBBP	41	33
Cc1nnc2c3ccccc3c(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450871094	GI	On-Demand	Anodyne	BRD9	53	34
O[C@H]([C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1)C(F)(F)F	ZINC000450871127	FI	On-Demand	Anodyne	LIPG	56	36
O[C@@H]([C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1)C(F)(F)F	ZINC000450871128	FI	On-Demand	Anodyne	LIPG	56	36
O[C@@H]([C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1)C(F)(F)F	ZINC000450871129	FI	On-Demand	Anodyne	LIPG	56	36
O[C@H]([C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1)C(F)(F)F	ZINC000450871130	FI	On-Demand	Anodyne	LIPG	56	36
CCO[C@@H]1C[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)[C@@H]1OC	ZINC000450871145	EE	On-Demand	Anodyne	TIMP3	65	36
CCO[C@@H]1C[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)[C@@H]1OC	ZINC000450871146	EE	On-Demand	Anodyne	TIMP3	65	36
CCO[C@@H]1C[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)[C@H]1OC	ZINC000450871147	EE	On-Demand	Anodyne	TIMP3	65	36
CCO[C@@H]1C[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)[C@H]1OC	ZINC000450871148	EE	On-Demand	Anodyne	TIMP3	65	36
CCOC(=O)c1ccc(CN2CCC(c3nc(C(=O)OCC)n[nH]3)CC2)nc1	ZINC000450871153	GD	On-Demand	Anodyne	SSTR5	42	35
Cc1nc2[nH]ccc2c(=NCCN2CCC(O)CC2)[nH]1	ZINC000450871166	CC	On-Demand	Anodyne	JAK1	42	35
COc1cccc2c1CCN(C[C@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450871208	EG	On-Demand	Anodyne	HTR1A	15	57
COc1cccc2c1CCN(C[C@@H](O)[C@@H](C)c1ccccc1)CC2	ZINC000450871209	EG	On-Demand	Anodyne	HTR1A	15	57
COc1cccc2c1CCN(C[C@@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450871210	EG	On-Demand	Anodyne	HTR1A	15	57
COc1cccc2c1CCN(C[C@H](O)[C@H](C)c1ccccc1)CC2	ZINC000450871211	EG	On-Demand	Anodyne	HTR1A	15	57
CC[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)C1CCCC1	ZINC000450871245	CG	On-Demand	Bother	PRKCQ	44	38
CC[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)C1CCCC1	ZINC000450871246	CG	On-Demand	Bother	PRKCQ	44	38
COc1cccc(OCCC(=O)N2CCN(c3cccc(C#N)n3)CC2)c1	ZINC000450871286	FE	On-Demand	Mild	DRD4	43	32
C[C@@H]1CN(CC(F)(F)F)CCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450871310	FH	On-Demand	Anodyne	FAAH	0	43
C[C@H]1CN(CC(F)(F)F)CCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450871312	FH	On-Demand	Anodyne	FAAH	0	43
O[C@H]([C@@H]1CCN(c2cnc3ccccc3n2)C1)C(F)(F)F	ZINC000450871315	CE	On-Demand	Anodyne	SORD	18	46
O[C@@H]([C@@H]1CCN(c2cnc3ccccc3n2)C1)C(F)(F)F	ZINC000450871318	CE	On-Demand	Anodyne	SORD	18	46
O[C@H]([C@H]1CCN(c2cnc3ccccc3n2)C1)C(F)(F)F	ZINC000450871319	CE	On-Demand	Anodyne	SORD	18	46
O[C@@H]([C@H]1CCN(c2cnc3ccccc3n2)C1)C(F)(F)F	ZINC000450871322	CE	On-Demand	Anodyne	SORD	18	46
O[C@@H]([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)C(F)(F)F	ZINC000450871332	GG	On-Demand	Anodyne	PDE3A	48	39
O[C@@H]([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)C(F)(F)F	ZINC000450871332	GG	On-Demand	Anodyne	PDE3B	70	36
O[C@H]([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)C(F)(F)F	ZINC000450871334	GG	On-Demand	Anodyne	PDE3A	48	39
O[C@H]([C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1)C(F)(F)F	ZINC000450871334	GG	On-Demand	Anodyne	PDE3B	70	36
O[C@H]([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)C(F)(F)F	ZINC000450871336	GG	On-Demand	Anodyne	PDE3A	48	39
O[C@H]([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)C(F)(F)F	ZINC000450871336	GG	On-Demand	Anodyne	PDE3B	70	36
O[C@@H]([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)C(F)(F)F	ZINC000450871338	GG	On-Demand	Anodyne	PDE3A	48	39
O[C@@H]([C@H]1CCN(c2ncnc3cc(Br)ccc23)C1)C(F)(F)F	ZINC000450871338	GG	On-Demand	Anodyne	PDE3B	70	36
CCOC(=O)c1csc(N2CC(c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450871340	FH	On-Demand	Anodyne	LIPG	42	33
COC(=O)c1ccc(CN2CCC[C@@H](c3ccnc(N)n3)C2)cc1Cl	ZINC000450871347	FF	On-Demand	Anodyne	CCR3	43	39
COC(=O)c1ccc(CN2CCC[C@@H](c3ccnc(N)n3)C2)cc1Cl	ZINC000450871347	FF	On-Demand	Anodyne	MCHR1	16	41
COC(=O)c1ccc(CN2CCC[C@H](c3ccnc(N)n3)C2)cc1Cl	ZINC000450871349	FF	On-Demand	Anodyne	CCR3	43	39
COC(=O)c1ccc(CN2CCC[C@H](c3ccnc(N)n3)C2)cc1Cl	ZINC000450871349	FF	On-Demand	Anodyne	MCHR1	16	41
COc1ccc(C)cc1CSCc1nc(-c2cc(C)ccn2)no1	ZINC000450871350	EI	On-Demand	Anodyne	AXIN2	0	40
Cc1ccc(F)c(CC(=O)N2CC[C@H](Oc3cccnc3N(C)C)C2)c1	ZINC000450871356	FF	On-Demand	Anodyne	HCRTR1	0	40
Cc1ccc(F)c(CC(=O)N2CC[C@H](Oc3cccnc3N(C)C)C2)c1	ZINC000450871356	FF	On-Demand	Anodyne	HCRTR2	0	40
Cc1ccc(F)c(CC(=O)N2CC[C@@H](Oc3cccnc3N(C)C)C2)c1	ZINC000450871358	FF	On-Demand	Anodyne	HCRTR1	0	40
Cc1ccc(F)c(CC(=O)N2CC[C@@H](Oc3cccnc3N(C)C)C2)c1	ZINC000450871358	FF	On-Demand	Anodyne	HCRTR2	0	40
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)Cc2ccccc2C)cc1	ZINC000450871365	EH	On-Demand	Anodyne	RORC	27	40
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)Cc2ccccc2C)cc1	ZINC000450871367	EH	On-Demand	Anodyne	RORC	27	40
O=[N+]([O-])c1c(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc2sccn12	ZINC000450871368	FH	On-Demand	Bother	KCNN3	24	42
O=[N+]([O-])c1c(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc2sccn12	ZINC000450871374	FH	On-Demand	Bother	KCNN3	24	42
CNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)c([N+](=O)[O-])c1	ZINC000450871383	GH	On-Demand	Bother	SERPINE1	24	42
CNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)c([N+](=O)[O-])c1	ZINC000450871383	GH	On-Demand	Bother	CCR2	41	37
CNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)c([N+](=O)[O-])c1	ZINC000450871383	GH	On-Demand	Bother	TAAR1	39	42
COc1ccc([N+](=O)[O-])c(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c1	ZINC000450871388	DE	On-Demand	Bother	TAAR1	18	42
COc1ccc([N+](=O)[O-])c(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c1	ZINC000450871389	DE	On-Demand	Bother	TAAR1	18	42
COc1ccc([N+](=O)[O-])c(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c1	ZINC000450871391	DE	On-Demand	Bother	TAAR1	18	42
COCc1nn(CCCCc2ccc(Cl)c(Cl)c2)c(=O)o1	ZINC000450871392	EG	On-Demand	Anodyne	DNAE	58	34
COc1ccc([N+](=O)[O-])c(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c1	ZINC000450871393	DE	On-Demand	Bother	TAAR1	18	42
O=[N+]([O-])c1cnccc1N1CC(c2cccc(C(F)(F)F)c2)C1	ZINC000450871411	DH	On-Demand	Bother	SERPINE1	15	40
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C#N)cn2)C1	ZINC000450871413	CE	On-Demand	Mild	SGPL1	0	41
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C#N)cn2)C1	ZINC000450871413	CE	On-Demand	Mild	SMO	0	45
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C#N)cn2)C1	ZINC000450871415	CE	On-Demand	Mild	SGPL1	0	41
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C#N)cn2)C1	ZINC000450871415	CE	On-Demand	Mild	SMO	0	45
CC(=O)N[C@H](C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1)C(C)(C)C	ZINC000450871416	GE	On-Demand	Anodyne	SCD	30	41
CC(=O)N[C@H](C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1)C(C)(C)C	ZINC000450871418	GE	On-Demand	Anodyne	SCD	30	41
Cc1nccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450871425	CG	On-Demand	Anodyne	PRCP	53	42
Cc1nccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450871426	CG	On-Demand	Anodyne	PRCP	53	42
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3c(F)cccc23)C1	ZINC000450871433	EG	On-Demand	Anodyne	ABCC1	66	38
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3c(F)cccc23)C1	ZINC000450871433	EG	On-Demand	Anodyne	ABCB1A	40	31
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3c(F)cccc23)C1	ZINC000450871435	EG	On-Demand	Anodyne	ABCC1	66	38
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3c(F)cccc23)C1	ZINC000450871435	EG	On-Demand	Anodyne	ABCB1A	40	31
CCCC[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450871440	EG	On-Demand	Anodyne	P2RY12	166	37
CCCC[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450871440	EG	On-Demand	Anodyne	POLG_WNV	48	32
CCCC[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450871440	EG	On-Demand	Anodyne	NOD1	50	31
CCCC[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450871442	EG	On-Demand	Anodyne	P2RY12	166	37
CCCC[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450871442	EG	On-Demand	Anodyne	POLG_WNV	48	32
CCCC[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC	ZINC000450871442	EG	On-Demand	Anodyne	NOD1	50	31
CCN(CCC1CC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450871457	EG	On-Demand	Bother	SLC27A4	51	37
C[C@H]1CN(CC(F)(F)F)CCN(c2cnc(-c3ccccc3)cn2)C1	ZINC000450871459	FG	On-Demand	Anodyne	HPGDS	22	42
C[C@@H]1CN(CC(F)(F)F)CCN(c2cnc(-c3ccccc3)cn2)C1	ZINC000450871461	FG	On-Demand	Anodyne	HPGDS	22	42
COC(=O)c1cn([C@@H]2CCN(C(=O)Cc3cc4ccccc4s3)C2)nn1	ZINC000450871473	FE	On-Demand	Anodyne	PREP	17	41
COC(=O)c1cn([C@H]2CCN(C(=O)Cc3cc4ccccc4s3)C2)nn1	ZINC000450871474	FE	On-Demand	Anodyne	PREP	17	41
CCCC[C@@H](NC(=O)[C@]1(OC(C)C)CCOC1)C(=O)OC	ZINC000450871475	DD	On-Demand	Anodyne	NOD1	40	30
CCCC[C@@H](NC(=O)[C@@]1(OC(C)C)CCOC1)C(=O)OC	ZINC000450871476	DD	On-Demand	Anodyne	NOD1	40	30
CCCC[C@H](NC(=O)[C@@]1(OC(C)C)CCOC1)C(=O)OC	ZINC000450871477	DD	On-Demand	Anodyne	NOD1	40	30
CCCC[C@H](NC(=O)[C@]1(OC(C)C)CCOC1)C(=O)OC	ZINC000450871478	DD	On-Demand	Anodyne	NOD1	40	30
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cn1	ZINC000450871479	EG	On-Demand	Anodyne	COLA	67	35
Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cn1	ZINC000450871479	EG	On-Demand	Anodyne	CPT1A	64	33
Cn1cc([C@@H]2CCCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cn1	ZINC000450871480	EG	On-Demand	Anodyne	COLA	67	35
Cn1cc([C@@H]2CCCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cn1	ZINC000450871480	EG	On-Demand	Anodyne	CPT1A	64	33
Cn1cc([C@H]2CCCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cn1	ZINC000450871481	EG	On-Demand	Anodyne	COLA	67	35
Cn1cc([C@H]2CCCCN2C(=O)[C@H]2CCN(c3ccccc3)C2)cn1	ZINC000450871481	EG	On-Demand	Anodyne	CPT1A	64	33
Cn1cc([C@H]2CCCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cn1	ZINC000450871482	EG	On-Demand	Anodyne	COLA	67	35
Cn1cc([C@H]2CCCCN2C(=O)[C@@H]2CCN(c3ccccc3)C2)cn1	ZINC000450871482	EG	On-Demand	Anodyne	CPT1A	64	33
Cn1cc([C@@H]2CCCCN2C(=O)Cc2ccc(O)c(F)c2)cn1	ZINC000450871489	DF	On-Demand	Anodyne	OPRK1	29	42
Cn1cc([C@@H]2CCCCN2C(=O)Cc2ccc(O)c(F)c2)cn1	ZINC000450871489	DF	On-Demand	Anodyne	COLA	43	35
Cn1cc([C@H]2CCCCN2C(=O)Cc2ccc(O)c(F)c2)cn1	ZINC000450871490	DF	On-Demand	Anodyne	OPRK1	29	42
Cn1cc([C@H]2CCCCN2C(=O)Cc2ccc(O)c(F)c2)cn1	ZINC000450871490	DF	On-Demand	Anodyne	COLA	43	35
CS(=O)(=O)[C@@H]1CCCCN(CC/C=C\c2ccccc2)C1	ZINC000450871495	DF	On-Demand	Anodyne	SLC6A1	96	40
CS(=O)(=O)[C@H]1CCCCN(CC/C=C\c2ccccc2)C1	ZINC000450871496	DF	On-Demand	Anodyne	SLC6A1	96	40
CS(=O)(=O)[C@@H]1CCCCN(CC/C=C/c2ccccc2)C1	ZINC000450871497	DF	On-Demand	Anodyne	SLC6A1	96	40
CS(=O)(=O)[C@H]1CCCCN(CC/C=C/c2ccccc2)C1	ZINC000450871498	DF	On-Demand	Anodyne	SLC6A1	96	40
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccccc1	ZINC000450871499	FI	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccccc1	ZINC000450871499	FI	On-Demand	Anodyne	HTR2A	18	44
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccccc1	ZINC000450871499	FI	On-Demand	Anodyne	SLC6A1	142	40
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccccc1	ZINC000450871499	FI	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccccc1	ZINC000450871500	FI	On-Demand	Anodyne	DRD4	0	43
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccccc1	ZINC000450871500	FI	On-Demand	Anodyne	HTR2A	18	44
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccccc1	ZINC000450871500	FI	On-Demand	Anodyne	SLC6A1	142	40
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccccc1	ZINC000450871500	FI	On-Demand	Anodyne	CYP2J2	56	40
CC(C)(C)O[C@@H]1C[C@H](Nc2cc(NCC3CC3)ncn2)[C@@H]1n1cccn1	ZINC000450871501	FG	On-Demand	Anodyne	GPR39	0	41
CC(C)(C)O[C@@H]1C[C@H](Nc2cc(NCC3CC3)ncn2)[C@H]1n1cccn1	ZINC000450871502	FG	On-Demand	Anodyne	GPR39	0	41
CC(C)(C)O[C@@H]1C[C@@H](Nc2cc(NCC3CC3)ncn2)[C@H]1n1cccn1	ZINC000450871503	FG	On-Demand	Anodyne	GPR39	0	41
CC(C)(C)O[C@@H]1C[C@@H](Nc2cc(NCC3CC3)ncn2)[C@@H]1n1cccn1	ZINC000450871504	FG	On-Demand	Anodyne	GPR39	0	41
Cc1nc(C(C)C)oc1CSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450871506	GJ	On-Demand	Anodyne	HCRTR2	19	40
COCCNC(=O)c1ccc(N2CCN(C(C)(C)CC(C)(C)C)CC2)nc1	ZINC000450871535	GF	On-Demand	Anodyne	DRD4	40	30
COCCNC(=O)c1ccc(N2CCN(C(C)(C)CC(C)(C)C)CC2)nc1	ZINC000450871535	GF	On-Demand	Anodyne	HPGDS	21	40
CCn1c(COc2ccc(C)cc2)nnc1SCn1cccn1	ZINC000450871543	EG	On-Demand	Anodyne	VCP	49	35
C[C@H](CN1CCC(C(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450871559	EE	On-Demand	Anodyne	HTR2A	23	56
C[C@H](CN1CCC(C(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450871559	EE	On-Demand	Anodyne	PLD1	44	37
C[C@H](CN1CCC(C(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450871559	EE	On-Demand	Anodyne	SLC18A3	36	48
C[C@H](CN1CCC(C(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450871559	EE	On-Demand	Anodyne	WNT3A	63	42
C[C@@H](CN1CCC(C(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450871560	EE	On-Demand	Anodyne	HTR2A	23	56
C[C@@H](CN1CCC(C(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450871560	EE	On-Demand	Anodyne	PLD1	44	37
C[C@@H](CN1CCC(C(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450871560	EE	On-Demand	Anodyne	SLC18A3	36	48
C[C@@H](CN1CCC(C(=O)c2ccc(F)cc2)CC1)S(C)(=O)=O	ZINC000450871560	EE	On-Demand	Anodyne	WNT3A	63	42
CCS(=O)(=O)c1ccc(CN(C[C@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871574	GG	On-Demand	Anodyne	ADRB2	33	52
CCS(=O)(=O)c1ccc(CN(C[C@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871574	GG	On-Demand	Anodyne	ADRB1	38	42
CCS(=O)(=O)c1ccc(CN(C[C@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871574	GG	On-Demand	Anodyne	GRIN1	35	42
CCS(=O)(=O)c1ccc(CN(C[C@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871574	GG	On-Demand	Anodyne	ADRB3	35	42
CCS(=O)(=O)c1ccc(CN(C[C@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871574	GG	On-Demand	Anodyne	ABCB1	22	45
CCS(=O)(=O)c1ccc(CN(C[C@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871574	GG	On-Demand	Anodyne	RORC	33	41
CCS(=O)(=O)c1ccc(CN(C[C@@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871577	GG	On-Demand	Anodyne	ADRB2	33	52
CCS(=O)(=O)c1ccc(CN(C[C@@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871577	GG	On-Demand	Anodyne	ADRB1	38	42
CCS(=O)(=O)c1ccc(CN(C[C@@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871577	GG	On-Demand	Anodyne	GRIN1	35	42
CCS(=O)(=O)c1ccc(CN(C[C@@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871577	GG	On-Demand	Anodyne	ADRB3	35	42
CCS(=O)(=O)c1ccc(CN(C[C@@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871577	GG	On-Demand	Anodyne	ABCB1	22	45
CCS(=O)(=O)c1ccc(CN(C[C@@H](O)COc2ccccc2)C(C)C)cc1	ZINC000450871577	GG	On-Demand	Anodyne	RORC	33	41
C=CCn1c(SC[C@H]2CCN(S(C)(=O)=O)C2)nnc1-c1ccccc1C	ZINC000450871616	GF	On-Demand	Mild	Q8MHZ5_SHEEP	40	31
C=CCn1c(SC[C@@H]2CCN(S(C)(=O)=O)C2)nnc1-c1ccccc1C	ZINC000450871620	GF	On-Demand	Mild	Q8MHZ5_SHEEP	40	31
C=CCn1c(COc2ccccc2)nnc1SC[C@H]1CCC(F)(F)C1	ZINC000450871625	FJ	On-Demand	Mild	VCP	51	39
FC1(F)CC(CSc2nnc(-c3ccccn3)n2Cc2ccco2)C1	ZINC000450871629	FI	On-Demand	Anodyne	HCRTR2	0	41
CNC(=O)c1ccc(N2CCN(C(C)(C)CC(C)(C)C)CC2)nn1	ZINC000450871630	EE	On-Demand	Anodyne	SCD1	47	39
CNC(=O)c1ccc(N2CCN(C(C)(C)CC(C)(C)C)CC2)nn1	ZINC000450871630	EE	On-Demand	Anodyne	SCD	24	44
C=CCn1c(COc2ccccc2)nnc1SC[C@@H]1CCC(F)(F)C1	ZINC000450871631	FJ	On-Demand	Mild	VCP	51	39
CCn1c(COc2ccc(C)cc2)nnc1SCC1(C#N)CCC1	ZINC000450871641	EH	On-Demand	Mild	VCP	55	39
CCc1c(C(=O)N2CCc3c(ncn(C)c3=O)C2)oc2ccccc12	ZINC000450871675	EE	On-Demand	Anodyne	FABI	52	32
C=CCn1c(COc2ccccc2)nnc1SCC1(C(=O)OC)CCCC1	ZINC000450871708	GH	On-Demand	Mild	VCP	56	37
CCn1c(COc2ccc(C)cc2)nnc1SC[C@H]1CCC(F)(F)C1	ZINC000450871719	FJ	On-Demand	Anodyne	VCP	52	38
CCn1c(COc2ccc(C)cc2)nnc1SC[C@@H]1CCC(F)(F)C1	ZINC000450871723	FJ	On-Demand	Anodyne	VCP	52	38
COC(=O)C1(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450871758	GF	On-Demand	Anodyne	CACNA1H	29	42
COC(=O)C1(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450871758	GF	On-Demand	Anodyne	FAAH	15	56
COC(=O)C1(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450871758	GF	On-Demand	Anodyne	CCR2	50	52
COC(=O)C1(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450871758	GF	On-Demand	Anodyne	EPHX2	48	52
COC(=O)C1(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450871758	GF	On-Demand	Anodyne	TRPM8	37	43
CNC(=O)c1ccc(NC2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1	ZINC000450871763	EE	On-Demand	Bother	L3MBTL1	0	44
CNC(=O)c1ccc(NC2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1	ZINC000450871763	EE	On-Demand	Bother	L3MBTL3	44	33
O[C@@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871790	GE	On-Demand	Anodyne	PIK3CA	43	42
O[C@@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871790	GE	On-Demand	Anodyne	PIK3CD	38	40
O[C@@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871790	GE	On-Demand	Anodyne	MTOR	39	41
O[C@@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871790	GE	On-Demand	Anodyne	PIK3CG	24	40
O[C@@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871790	GE	On-Demand	Anodyne	PIK3CB	20	42
O[C@@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871790	GE	On-Demand	Anodyne	PIK3C2B	21	40
O[C@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871791	GE	On-Demand	Anodyne	PIK3CA	43	42
O[C@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871791	GE	On-Demand	Anodyne	PIK3CD	38	40
O[C@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871791	GE	On-Demand	Anodyne	MTOR	39	41
O[C@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871791	GE	On-Demand	Anodyne	PIK3CG	24	40
O[C@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871791	GE	On-Demand	Anodyne	PIK3CB	20	42
O[C@H]([C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871791	GE	On-Demand	Anodyne	PIK3C2B	21	40
O[C@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871792	GE	On-Demand	Anodyne	PIK3CA	43	42
O[C@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871792	GE	On-Demand	Anodyne	PIK3CD	38	40
O[C@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871792	GE	On-Demand	Anodyne	MTOR	39	41
O[C@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871792	GE	On-Demand	Anodyne	PIK3CG	24	40
O[C@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871792	GE	On-Demand	Anodyne	PIK3CB	20	42
O[C@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871792	GE	On-Demand	Anodyne	PIK3C2B	21	40
O[C@@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871793	GE	On-Demand	Anodyne	PIK3CA	43	42
O[C@@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871793	GE	On-Demand	Anodyne	PIK3CD	38	40
O[C@@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871793	GE	On-Demand	Anodyne	MTOR	39	41
O[C@@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871793	GE	On-Demand	Anodyne	PIK3CG	24	40
O[C@@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871793	GE	On-Demand	Anodyne	PIK3CB	20	42
O[C@@H]([C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1)C(F)(F)F	ZINC000450871793	GE	On-Demand	Anodyne	PIK3C2B	21	40
COC(=O)c1nc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)sc1C	ZINC000450871816	DD	On-Demand	Anodyne	GYRB	44	40
COC(=O)c1nc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)sc1C	ZINC000450871816	DD	On-Demand	Anodyne	PARE	42	33
COC(=O)c1nc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)sc1C	ZINC000450871817	DD	On-Demand	Anodyne	GYRB	44	40
COC(=O)c1nc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)sc1C	ZINC000450871817	DD	On-Demand	Anodyne	PARE	42	33
COC(=O)c1nc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)sc1C	ZINC000450871818	DD	On-Demand	Anodyne	GYRB	44	40
COC(=O)c1nc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)sc1C	ZINC000450871818	DD	On-Demand	Anodyne	PARE	42	33
COC(=O)c1nc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)sc1C	ZINC000450871819	DD	On-Demand	Anodyne	GYRB	44	40
COC(=O)c1nc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)sc1C	ZINC000450871819	DD	On-Demand	Anodyne	PARE	42	33
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450871824	DE	On-Demand	Anodyne	CCR5	22	41
Cc1cccc(Cl)c1C(=O)N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000450871824	DE	On-Demand	Anodyne	EPHX2	41	42
Cc1cccc(Cl)c1C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450871825	DE	On-Demand	Anodyne	CCR5	22	41
Cc1cccc(Cl)c1C(=O)N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000450871825	DE	On-Demand	Anodyne	EPHX2	41	42
Cc1ccc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450871855	DF	On-Demand	Anodyne	PDE3A	51	41
Cc1ccc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450871855	DF	On-Demand	Anodyne	PDE3B	74	38
Cc1ccc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450871855	DF	On-Demand	Anodyne	HTT	0	41
Cc1ccc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450871856	DF	On-Demand	Anodyne	PDE3A	51	41
Cc1ccc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450871856	DF	On-Demand	Anodyne	PDE3B	74	38
Cc1ccc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450871856	DF	On-Demand	Anodyne	HTT	0	41
Cc1ccc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450871857	DF	On-Demand	Anodyne	PDE3A	51	41
Cc1ccc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450871857	DF	On-Demand	Anodyne	PDE3B	74	38
Cc1ccc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450871857	DF	On-Demand	Anodyne	HTT	0	41
Cc1ccc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450871858	DF	On-Demand	Anodyne	PDE3A	51	41
Cc1ccc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450871858	DF	On-Demand	Anodyne	PDE3B	74	38
Cc1ccc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450871858	DF	On-Demand	Anodyne	HTT	0	41
COc1ccc(CNC(=O)CCN2CCCC3(CCC3)C2)c(OC)c1	ZINC000450871910	EF	On-Demand	Anodyne	HTR7	24	40
COc1ccc(CNC(=O)CCN2CCCC3(CCC3)C2)c(OC)c1	ZINC000450871910	EF	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2CCCC3(CCC3)C2)c(OC)c1	ZINC000450871910	EF	On-Demand	Anodyne	EBP	26	42
Cn1c(SCCCCc2ccc(Cl)c(Cl)c2)nnc1-c1cnccn1	ZINC000450871915	GJ	On-Demand	Anodyne	DRD3	22	41
Cn1c(SCCCCc2ccc(Cl)c(Cl)c2)nnc1-c1cnccn1	ZINC000450871915	GJ	On-Demand	Anodyne	KCNH2	18	41
COCCOC[C@@H](O)CN1CCOc2ccc(F)cc2C1	ZINC000450871956	CD	On-Demand	Anodyne	CCR1	28	41
COCCOC[C@H](O)CN1CCOc2ccc(F)cc2C1	ZINC000450871957	CD	On-Demand	Anodyne	CCR1	28	41
COC(=O)C1(CN2CCc3cccc(OC)c3CC2)CC1	ZINC000450871962	CE	On-Demand	Anodyne	DRD2	20	41
O=C(Nc1ccc(Cl)cc1OC(F)F)c1ccc(N2CCC2)nc1	ZINC000450871971	FH	On-Demand	Anodyne	F10	29	42
C[C@@H](O)CCN1CCC[C@H](OCc2ccccc2F)C1	ZINC000450872003	CF	On-Demand	Anodyne	SLC6A1	85	37
C[C@@H](O)CCN1CCC[C@H](OCc2ccccc2F)C1	ZINC000450872003	CF	On-Demand	Anodyne	BIRC2	39	42
C[C@H](O)CCN1CCC[C@H](OCc2ccccc2F)C1	ZINC000450872004	CF	On-Demand	Anodyne	SLC6A1	85	37
C[C@H](O)CCN1CCC[C@H](OCc2ccccc2F)C1	ZINC000450872004	CF	On-Demand	Anodyne	BIRC2	39	42
C[C@H]1CN(CC(F)(F)F)CCN(c2ccnc(N3CCCCC3)n2)C1	ZINC000450872025	FF	On-Demand	Anodyne	SORD	44	38
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccnc(N3CCCCC3)n2)C1	ZINC000450872026	FF	On-Demand	Anodyne	SORD	44	38
CCCC[C@@H](NC(=O)c1ccc(Br)cc1C#N)C(=O)OC	ZINC000450872033	FF	On-Demand	Mild	CTRB_BOVIN	59	36
CCCC[C@H](NC(=O)c1ccc(Br)cc1C#N)C(=O)OC	ZINC000450872035	FF	On-Demand	Mild	CTRB_BOVIN	59	36
CCOC(=O)c1ccc(CN(C)[C@@H](C)Cc2ccccc2C)nc1	ZINC000450872036	EH	On-Demand	Anodyne	P2RY12	16	41
CCOC(=O)c1ccc(CN(C)[C@H](C)Cc2ccccc2C)nc1	ZINC000450872045	EH	On-Demand	Anodyne	P2RY12	16	41
CCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450872052	EE	On-Demand	Anodyne	HPGDS	36	52
CCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450872054	EE	On-Demand	Anodyne	HPGDS	36	52
COC(=O)c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450872057	EF	On-Demand	Anodyne	COLA	49	37
COC(=O)c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450872057	EF	On-Demand	Anodyne	CPT1A	49	37
COC(=O)c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450872057	EF	On-Demand	Anodyne	KCNN3	33	45
COC(=O)c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450872060	EF	On-Demand	Anodyne	COLA	49	37
COC(=O)c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450872060	EF	On-Demand	Anodyne	CPT1A	49	37
COC(=O)c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450872060	EF	On-Demand	Anodyne	KCNN3	33	45
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cnccn2)cc1	ZINC000450872064	GH	On-Demand	Anodyne	CACNA2D1	79	39
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cnccn2)cc1	ZINC000450872064	GH	On-Demand	Anodyne	CACNA2D2	54	32
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cnccn2)cc1	ZINC000450872064	GH	On-Demand	Anodyne	WNT3A	20	45
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cnccn2)cc1	ZINC000450872064	GH	On-Demand	Anodyne	VCP	60	37
CCn1nccc1C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450872065	DH	On-Demand	Anodyne	DRD4	18	47
CCn1nccc1C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450872065	DH	On-Demand	Anodyne	SIGMAR1	26	45
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450872078	GG	On-Demand	Anodyne	LRRK2	0	40
Cn1c(SCC2(C#N)CCC2)nnc1-c1cccc(Cl)c1	ZINC000450872080	DH	On-Demand	Mild	HSD11B1	23	50
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450872081	GG	On-Demand	Anodyne	LRRK2	0	40
Cc1ccc(-c2nnc(S[C@@H]3CC[C@@H](C#N)C3)n2Cc2ccco2)cc1	ZINC000450872139	FJ	On-Demand	Mild	HCRTR2	0	42
Cc1ccc(-c2nnc(S[C@@H]3CC[C@H](C#N)C3)n2Cc2ccco2)cc1	ZINC000450872141	FJ	On-Demand	Mild	HCRTR2	0	42
Cc1ccc(-c2nnc(S[C@H]3CC[C@@H](C#N)C3)n2Cc2ccco2)cc1	ZINC000450872143	FJ	On-Demand	Mild	HCRTR2	0	42
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450872144	FF	On-Demand	Anodyne	SLC6A9	31	44
Cc1ccc(-c2nnc(S[C@H]3CC[C@H](C#N)C3)n2Cc2ccco2)cc1	ZINC000450872145	FJ	On-Demand	Mild	HCRTR2	0	42
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450872146	FF	On-Demand	Anodyne	SLC6A9	31	44
COc1cc2nc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450872164	GE	On-Demand	Anodyne	ADRA1D	16	46
COc1cc2nc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450872164	GE	On-Demand	Anodyne	ADRA1B	41	52
COc1cc2nc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450872164	GE	On-Demand	Anodyne	PDE3B	51	32
COc1cc2nc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)nc(N)c2cc1OC	ZINC000450872164	GE	On-Demand	Anodyne	EHMT2	74	41
Cc1ccc2ncnc(N[C@@H]3C[C@H](OC(C)(C)C)[C@@H]3n3cccn3)c2c1	ZINC000450872168	FH	On-Demand	Anodyne	CD38	41	31
Cc1ccc2ncnc(N[C@@H]3C[C@@H](OC(C)(C)C)[C@H]3n3cccn3)c2c1	ZINC000450872169	FH	On-Demand	Anodyne	CD38	41	31
Cc1ccc2ncnc(N[C@@H]3C[C@@H](OC(C)(C)C)[C@@H]3n3cccn3)c2c1	ZINC000450872170	FH	On-Demand	Anodyne	CD38	41	31
Cc1ccc2ncnc(N[C@@H]3C[C@H](OC(C)(C)C)[C@H]3n3cccn3)c2c1	ZINC000450872171	FH	On-Demand	Anodyne	CD38	41	31
COc1cc2nc(N3CCN(CC(F)(F)F)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450872175	GE	On-Demand	Anodyne	ADRA1D	16	46
COc1cc2nc(N3CCN(CC(F)(F)F)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450872175	GE	On-Demand	Anodyne	ADRA1B	41	52
COc1cc2nc(N3CCN(CC(F)(F)F)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450872175	GE	On-Demand	Anodyne	PDE3B	51	32
COc1cc2nc(N3CCN(CC(F)(F)F)C[C@H](C)C3)nc(N)c2cc1OC	ZINC000450872175	GE	On-Demand	Anodyne	EHMT2	74	41
Cc1cc(C)cc(CS[C@H](C)C(=O)Nc2nccs2)c1	ZINC000450872184	DI	On-Demand	Anodyne	MAP	0	42
Cc1cc(C)cc(CS[C@H](C)C(=O)Nc2nccs2)c1	ZINC000450872184	DI	On-Demand	Anodyne	MAP1	123	42
Cc1cc(C)cc(CS[C@@H](C)C(=O)Nc2nccs2)c1	ZINC000450872185	DI	On-Demand	Anodyne	MAP	0	42
Cc1cc(C)cc(CS[C@@H](C)C(=O)Nc2nccs2)c1	ZINC000450872185	DI	On-Demand	Anodyne	MAP1	123	42
CCN(CCC1CC1)C(=O)CCOc1cccc(OC)c1	ZINC000450872196	CG	On-Demand	Anodyne	MTNR1A	28	43
CCN(CCC1CC1)C(=O)CCOc1cccc(OC)c1	ZINC000450872196	CG	On-Demand	Anodyne	CHRNA10	24	42
CCN(CCC1CC1)C(=O)CCOc1cccc(OC)c1	ZINC000450872196	CG	On-Demand	Anodyne	ACKR3	51	32
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450872206	EE	On-Demand	Anodyne	HPGDS	32	46
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C(=O)N(C)C)cn2)C1	ZINC000450872207	EE	On-Demand	Anodyne	HPGDS	32	46
C[C@@H](CN1CCN(c2cccc3cnccc23)C[C@H]1C)S(C)(=O)=O	ZINC000450872208	EE	On-Demand	Anodyne	Q95J97_RABIT	0	40
C[C@H]1CN(c2cccc3cnccc23)CCN1C[C@H](C)S(C)(=O)=O	ZINC000450872209	EE	On-Demand	Anodyne	Q95J97_RABIT	0	40
C[C@@H]1CN(c2cccc3cnccc23)CCN1C[C@@H](C)S(C)(=O)=O	ZINC000450872210	EE	On-Demand	Anodyne	Q95J97_RABIT	0	40
C[C@H]1CN(c2cccc3cnccc23)CCN1C[C@@H](C)S(C)(=O)=O	ZINC000450872213	EE	On-Demand	Anodyne	Q95J97_RABIT	0	40
CN(CCN1CCOC(C)(C)C1)Cc1ccn(CCc2ccccc2)n1	ZINC000450872216	FF	On-Demand	Anodyne	SIGMAR1	16	40
COc1cc(CN2CCC[C@H](N3CCCS3(=O)=O)C2)ccc1Cl	ZINC000450872218	FE	On-Demand	Anodyne	DRD4	17	40
COc1cc(CN2CCC[C@H](N3CCCS3(=O)=O)C2)ccc1Cl	ZINC000450872218	FE	On-Demand	Anodyne	SSTR5	43	37
COc1cc(CN2CCC[C@H](N3CCCS3(=O)=O)C2)ccc1Cl	ZINC000450872218	FE	On-Demand	Anodyne	UTS2R	24	40
COc1cc(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)ccc1Cl	ZINC000450872220	FE	On-Demand	Anodyne	DRD4	17	40
COc1cc(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)ccc1Cl	ZINC000450872220	FE	On-Demand	Anodyne	SSTR5	43	37
COc1cc(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)ccc1Cl	ZINC000450872220	FE	On-Demand	Anodyne	UTS2R	24	40
CNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nn1	ZINC000450872227	ED	On-Demand	Anodyne	SCD1	45	40
CNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nn1	ZINC000450872227	ED	On-Demand	Anodyne	SCD	37	40
CNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nn1	ZINC000450872232	ED	On-Demand	Anodyne	SCD1	45	40
CNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nn1	ZINC000450872232	ED	On-Demand	Anodyne	SCD	37	40
O=c1c2ccccc2sn1Cc1nnc(C2CC2)s1	ZINC000450872238	CF	On-Demand	Anodyne	CASP7	44	37
O=c1c2ccccc2sn1Cc1nnc(C2CC2)s1	ZINC000450872238	CF	On-Demand	Anodyne	SRTA	0	40
CC1CN(c2ncnc3[nH]ccc23)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450872243	EE	On-Demand	Anodyne	AKT2	55	51
CC1CN(c2ncnc3[nH]ccc23)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450872243	EE	On-Demand	Anodyne	AKT3	39	43
CC1CN(c2ncnc3[nH]ccc23)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450872243	EE	On-Demand	Anodyne	JAK3	26	66
CC1CN(c2ncnc3[nH]ccc23)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450872243	EE	On-Demand	Anodyne	JAK1	50	35
CC1CN(c2ncnc3[nH]ccc23)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450872243	EE	On-Demand	Anodyne	AKT1	26	46
CC1CN(c2ncnc3[nH]ccc23)CCN(c2ncnc3[nH]ccc23)C1	ZINC000450872243	EE	On-Demand	Anodyne	LIMK2	65	48
Cc1cc(N2CCN(c3cc(C)nc(C4CC4)n3)CC(C)C2)nc(C2CC2)n1	ZINC000450872245	GH	On-Demand	Anodyne	CHRM3	16	64
Cc1ccn2ncc(C(=O)N(C)C[C@@H]3CCN(C)[C@H]3c3cccnc3)c2c1	ZINC000450872253	FF	On-Demand	Anodyne	EPHB3	24	40
COc1ccc(CNC(=O)CCN(C)[C@@H](C)CN2CCOCC2)c(OC)c1	ZINC000450872261	GD	On-Demand	Anodyne	MTNR1A	45	37
COc1ccc(CNC(=O)CCN(C)[C@@H](C)CN2CCOCC2)c(OC)c1	ZINC000450872261	GD	On-Demand	Anodyne	PTGDS	19	40
COc1ccc(CNC(=O)CCN(C)[C@H](C)CN2CCOCC2)c(OC)c1	ZINC000450872263	GD	On-Demand	Anodyne	MTNR1A	45	37
COc1ccc(CNC(=O)CCN(C)[C@H](C)CN2CCOCC2)c(OC)c1	ZINC000450872263	GD	On-Demand	Anodyne	PTGDS	19	40
C[C@H]1CN(CCN(C)CCN(C)Cc2ccccc2)C[C@@H](C)O1	ZINC000450872292	DE	On-Demand	Anodyne	SIGMAR1	23	47
CCn1c(COc2ccc(C)cc2)nnc1SCC1CC(F)(F)C1	ZINC000450872341	FI	On-Demand	Anodyne	VCP	46	39
CCS(=O)(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1	ZINC000450872358	EF	On-Demand	Anodyne	DRD4	19	45
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1	ZINC000450872361	FI	On-Demand	Anodyne	HTR1A	15	45
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1	ZINC000450872361	FI	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1	ZINC000450872361	FI	On-Demand	Anodyne	HTR2A	21	45
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1	ZINC000450872361	FI	On-Demand	Anodyne	SLC6A1	57	36
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1	ZINC000450872361	FI	On-Demand	Anodyne	HTR7	19	42
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1	ZINC000450872361	FI	On-Demand	Anodyne	SIGMAR1	20	49
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1	ZINC000450872361	FI	On-Demand	Anodyne	HTR3B	0	40
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccccc1	ZINC000450872361	FI	On-Demand	Anodyne	CYP2J2	63	44
COc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2cnccn2)cc1	ZINC000450872367	GG	On-Demand	Anodyne	WNT3A	19	40
COc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2cnccn2)cc1	ZINC000450872368	GG	On-Demand	Anodyne	WNT3A	19	40
COC(=O)c1ccc(N2CCN(C(C)(C)CC(C)(C)C)CC2)nn1	ZINC000450872369	EF	On-Demand	Anodyne	SCD1	30	42
FC1(F)CC(CSc2nnc(-c3cccs3)n2Cc2ccco2)C1	ZINC000450872372	FJ	On-Demand	Anodyne	HCRTR2	20	43
CC(=O)CCCCCSc1nnc(-c2ccc(F)cc2)n1Cc1ccco1	ZINC000450872374	GJ	On-Demand	Anodyne	HCRTR2	23	52
O=C(c1ccc(F)cc1)C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450872375	EH	On-Demand	Anodyne	HTR2A	16	52
O=C(c1ccc(F)cc1)C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450872375	EH	On-Demand	Anodyne	SLC18A3	37	50
O=C(c1ccc(F)cc1)C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450872375	EH	On-Demand	Anodyne	WNT3A	58	38
CCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nn1	ZINC000450872380	FF	On-Demand	Anodyne	SCD1	55	44
CCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nn1	ZINC000450872380	FF	On-Demand	Anodyne	SCD	40	44
O[C@H]([C@H]1CCN(c2ccnc(-c3ccccc3)n2)C1)C(F)(F)F	ZINC000450872398	DF	On-Demand	Anodyne	SORD	82	39
O[C@@H]([C@H]1CCN(c2ccnc(-c3ccccc3)n2)C1)C(F)(F)F	ZINC000450872399	DF	On-Demand	Anodyne	SORD	82	39
O[C@@H]([C@@H]1CCN(c2ccnc(-c3ccccc3)n2)C1)C(F)(F)F	ZINC000450872400	DF	On-Demand	Anodyne	SORD	82	39
O[C@H]([C@@H]1CCN(c2ccnc(-c3ccccc3)n2)C1)C(F)(F)F	ZINC000450872401	DF	On-Demand	Anodyne	SORD	82	39
CN(C)c1ncccc1O[C@H]1CCN(C(=O)CCCC(=O)C(C)(C)C)C1	ZINC000450872412	FF	On-Demand	Anodyne	SCD	26	41
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)CCCC(=O)C(C)(C)C)C1	ZINC000450872413	FF	On-Demand	Anodyne	SCD	26	41
CCOC(=O)c1ccnc(N2CC(c3cccc(C(F)(F)F)c3)C2)c1[N+](=O)[O-]	ZINC000450872414	GH	On-Demand	Bother	CACNA1C	42	36
CCOC(=O)c1ccnc(N2CC(c3cccc(C(F)(F)F)c3)C2)c1[N+](=O)[O-]	ZINC000450872414	GH	On-Demand	Bother	P2RY12	36	41
CCOC(=O)c1ccnc(N2CC(c3cccc(C(F)(F)F)c3)C2)c1[N+](=O)[O-]	ZINC000450872414	GH	On-Demand	Bother	CACNA1D	64	35
CCC(=O)c1ccc(OC[C@H]2COCCO2)c(F)c1	ZINC000450872417	CE	On-Demand	Anodyne	PDEC	0	43
CCC(=O)c1ccc(OC[C@@H]2COCCO2)c(F)c1	ZINC000450872418	CE	On-Demand	Anodyne	PDEC	0	43
COc1cc(OC)c2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450872429	FE	On-Demand	Anodyne	PDE3A	55	43
COc1cc(OC)c2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450872429	FE	On-Demand	Anodyne	PDE3B	52	42
COc1cc(OC)c2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450872430	FE	On-Demand	Anodyne	PDE3A	55	43
COc1cc(OC)c2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450872430	FE	On-Demand	Anodyne	PDE3B	52	42
COc1cc(OC)c2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450872431	FE	On-Demand	Anodyne	PDE3A	55	43
COc1cc(OC)c2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450872431	FE	On-Demand	Anodyne	PDE3B	52	42
COc1cc(OC)c2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450872432	FE	On-Demand	Anodyne	PDE3A	55	43
COc1cc(OC)c2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450872432	FE	On-Demand	Anodyne	PDE3B	52	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450872437	GC	On-Demand	Anodyne	CA7	22	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450872437	GC	On-Demand	Anodyne	LIPG	49	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450872438	GC	On-Demand	Anodyne	CA7	22	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450872438	GC	On-Demand	Anodyne	LIPG	49	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450872439	GC	On-Demand	Anodyne	CA7	22	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450872439	GC	On-Demand	Anodyne	LIPG	49	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450872440	GC	On-Demand	Anodyne	CA7	22	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450872440	GC	On-Demand	Anodyne	LIPG	49	36
O=C(NCc1ccccc1)c1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)ccn1	ZINC000450872469	GF	On-Demand	Anodyne	MMP13	25	43
O=C(NCc1ccccc1)c1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)ccn1	ZINC000450872469	GF	On-Demand	Anodyne	SCD	41	36
O=C(NCc1ccccc1)c1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccn1	ZINC000450872470	GF	On-Demand	Anodyne	MMP13	25	43
O=C(NCc1ccccc1)c1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccn1	ZINC000450872470	GF	On-Demand	Anodyne	SCD	41	36
O=C(NCc1ccccc1)c1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)ccn1	ZINC000450872471	GF	On-Demand	Anodyne	MMP13	25	43
O=C(NCc1ccccc1)c1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)ccn1	ZINC000450872471	GF	On-Demand	Anodyne	SCD	41	36
O=C(NCc1ccccc1)c1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)ccn1	ZINC000450872472	GF	On-Demand	Anodyne	MMP13	25	43
O=C(NCc1ccccc1)c1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)ccn1	ZINC000450872472	GF	On-Demand	Anodyne	SCD	41	36
COc1cc(CN2CC[C@@](O)(C3CC3)C2)ccc1Cl	ZINC000450872486	CF	On-Demand	Anodyne	SIGMAR1	27	41
COc1cc(CN2CC[C@@](O)(C3CC3)C2)ccc1Cl	ZINC000450872486	CF	On-Demand	Anodyne	SSTR5	41	36
COc1cc(CN2CC[C@](O)(C3CC3)C2)ccc1Cl	ZINC000450872487	CF	On-Demand	Anodyne	SIGMAR1	27	41
COc1cc(CN2CC[C@](O)(C3CC3)C2)ccc1Cl	ZINC000450872487	CF	On-Demand	Anodyne	SSTR5	41	36
C[C@@H](O)CCN1CCC(C)(c2ccc(Cl)cc2)CC1	ZINC000450872597	CG	On-Demand	Anodyne	DRD4	0	40
C[C@@H](O)CCN1CCC(C)(c2ccc(Cl)cc2)CC1	ZINC000450872597	CG	On-Demand	Anodyne	US28	0	47
C[C@H](O)CCN1CCC(C)(c2ccc(Cl)cc2)CC1	ZINC000450872598	CG	On-Demand	Anodyne	DRD4	0	40
C[C@H](O)CCN1CCC(C)(c2ccc(Cl)cc2)CC1	ZINC000450872598	CG	On-Demand	Anodyne	US28	0	47
CC1=CCN(CCNC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450872652	FE	On-Demand	Anodyne	DRD4	41	32
CC1=CCN(CCNC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450872652	FE	On-Demand	Anodyne	EPHX2	17	43
CC1=CCN(CCNC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450872652	FE	On-Demand	Anodyne	MCHR1	22	41
O=C(c1ccc(N2CCC[C@@]3(CCOC3)C2)nc1)N1CCc2ccccc21	ZINC000450872653	FG	On-Demand	Anodyne	AVPR2	38	42
O=C(c1ccc(N2CCC[C@]3(CCOC3)C2)nc1)N1CCc2ccccc21	ZINC000450872656	FG	On-Demand	Anodyne	AVPR2	38	42
C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450872722	FD	On-Demand	Bother	TPP2	58	35
C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000450872727	FD	On-Demand	Bother	TPP2	58	35
C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450872729	FD	On-Demand	Bother	TPP2	58	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000450872732	FD	On-Demand	Bother	TPP2	58	35
Cc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc(C)n1	ZINC000450872744	DH	On-Demand	Anodyne	PRCP	0	42
CC(F)(F)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450872749	GH	On-Demand	Anodyne	Q9M629_MAIZE	59	35
Cc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc(C)n1	ZINC000450872752	DH	On-Demand	Anodyne	PRCP	0	42
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	PPIA	15	44
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	KIT	18	48
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	LCK	30	40
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	F2R	0	48
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	ATF1	40	34
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	KDR	25	48
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	NR1H4	0	41
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	MTTP	64	39
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	TEK	30	43
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	BTK	24	46
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	HCN1	42	31
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	TRPM4	0	42
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	KCNK3	103	56
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	KCNK9	88	56
C[C@@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872758	FI	On-Demand	Anodyne	PDS	41	41
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	PPIA	15	44
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	KIT	18	48
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	LCK	30	40
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	F2R	0	48
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	ATF1	40	34
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	KDR	25	48
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	NR1H4	0	41
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	MTTP	64	39
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	TEK	30	43
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	BTK	24	46
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	HCN1	42	31
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	TRPM4	0	42
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	KCNK3	103	56
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	KCNK9	88	56
C[C@H](O)CCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000450872760	FI	On-Demand	Anodyne	PDS	41	41
COc1ccc(C(=O)N[C@]2(CO)C[C@H](C)CC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450872787	GE	On-Demand	Anodyne	COLA	49	34
COc1ccc(C(=O)N[C@]2(CO)C[C@H](C)CC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450872787	GE	On-Demand	Anodyne	CPT1A	48	34
COc1ccc(C(=O)N[C@@]2(CO)C[C@@H](C)CC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450872789	GE	On-Demand	Anodyne	COLA	49	34
COc1ccc(C(=O)N[C@@]2(CO)C[C@@H](C)CC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450872789	GE	On-Demand	Anodyne	CPT1A	48	34
COc1ccc(C(=O)N[C@]2(CO)C[C@@H](C)CC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450872791	GE	On-Demand	Anodyne	COLA	49	34
COc1ccc(C(=O)N[C@]2(CO)C[C@@H](C)CC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450872791	GE	On-Demand	Anodyne	CPT1A	48	34
COc1ccc(C(=O)N[C@@]2(CO)C[C@H](C)CC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450872792	GE	On-Demand	Anodyne	COLA	49	34
COc1ccc(C(=O)N[C@@]2(CO)C[C@H](C)CC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450872792	GE	On-Demand	Anodyne	CPT1A	48	34
COCc1nc(C)cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450872843	EH	On-Demand	Anodyne	PRCP	27	40
COCc1nc(C)cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450872843	EH	On-Demand	Anodyne	KCNN3	34	45
COCc1nc(C)cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450872845	EH	On-Demand	Anodyne	PRCP	27	40
COCc1nc(C)cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450872845	EH	On-Demand	Anodyne	KCNN3	34	45
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(c2cnccn2)CC1	ZINC000450872847	EF	On-Demand	Anodyne	SORD	45	37
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1CCN(c2cnccn2)CC1	ZINC000450872848	EF	On-Demand	Anodyne	SORD	45	37
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1CCN(c2cnccn2)CC1	ZINC000450872850	EF	On-Demand	Anodyne	SORD	45	37
C[C@H](c1ccccc1)[C@H](O)CN(C)C1CCN(c2cnccn2)CC1	ZINC000450872852	EF	On-Demand	Anodyne	SORD	45	37
N#Cc1ccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450872857	EI	On-Demand	Mild	KCNN3	31	42
N#Cc1ccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450872857	EI	On-Demand	Mild	SMO	30	44
N#Cc1ccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450872858	EI	On-Demand	Mild	KCNN3	31	42
N#Cc1ccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000450872858	EI	On-Demand	Mild	SMO	30	44
CC(=O)CCCCCSc1nnc(-c2ccco2)n1Cc1ccco1	ZINC000450872863	FI	On-Demand	Anodyne	HCRTR2	23	46
CCn1nnc(C)c1CSc1nnc(-c2cccs2)n1Cc1ccco1	ZINC000450872868	GH	On-Demand	Anodyne	HCRTR2	20	42
CNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450872884	FE	On-Demand	Bother	TAAR1	24	43
CNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000450872885	FE	On-Demand	Bother	TAAR1	24	43
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450872896	FH	On-Demand	Anodyne	SLC18A3	27	49
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450872896	FH	On-Demand	Anodyne	CACNA1G	34	41
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450872896	FH	On-Demand	Anodyne	WNT3A	52	38
COc1cc(CN(C)CCCCCO)ccc1Cl	ZINC000450872901	CF	On-Demand	Anodyne	ACHE	0	43
C[C@@H](O)CCSc1nnc(-c2ccc(F)cc2)n1Cc1ccco1	ZINC000450872905	EH	On-Demand	Anodyne	HCRTR2	22	51
C[C@H](O)CCSc1nnc(-c2ccc(F)cc2)n1Cc1ccco1	ZINC000450872906	EH	On-Demand	Anodyne	HCRTR2	22	51
CCOC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)nc1	ZINC000450872907	EF	On-Demand	Anodyne	SSTR5	37	40
C[C@@H](CN1CCOCC1)N(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450872920	GG	On-Demand	Anodyne	THRA	33	47
C[C@@H](CN1CCOCC1)N(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450872920	GG	On-Demand	Anodyne	THRB	30	47
C[C@H](CN1CCOCC1)N(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450872921	GG	On-Demand	Anodyne	THRA	33	47
C[C@H](CN1CCOCC1)N(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450872921	GG	On-Demand	Anodyne	THRB	30	47
O=C(c1ccc(NC2CCN(C3CCC3)CC2)nc1)N1CCc2ccccc21	ZINC000450872929	GH	On-Demand	Anodyne	AVPR2	104	44
O=C(c1ccc(NC2CCN(C3CCC3)CC2)nc1)N1CCc2ccccc21	ZINC000450872929	GH	On-Demand	Anodyne	AVPR1A	61	41
O=C(c1ccc(NC2CCN(C3CCC3)CC2)nc1)N1CCc2ccccc21	ZINC000450872929	GH	On-Demand	Anodyne	HRH3	23	45
O=C(c1ccc(NC2CCN(C3CCC3)CC2)nc1)N1CCc2ccccc21	ZINC000450872929	GH	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccc(NC2CCN(C3CCC3)CC2)nc1)N1CCc2ccccc21	ZINC000450872929	GH	On-Demand	Anodyne	L3MBTL3	63	41
Cc1ccn(C2CCN(CCN(C)Cc3ccccc3)CC2)n1	ZINC000450872930	DF	On-Demand	Anodyne	DRD4	23	44
Cc1ccn(C2CCN(CCN(C)Cc3ccccc3)CC2)n1	ZINC000450872930	DF	On-Demand	Anodyne	SIGMAR1	34	43
CN(CCN1CCC(c2ncc3n2CCCC3)CC1)Cc1ccccc1	ZINC000450872932	FH	On-Demand	Anodyne	SIGMAR1	25	45
CCOC(=O)c1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)nc1	ZINC000450872948	FG	On-Demand	Anodyne	SSTR5	24	41
CCOc1ccc(-n2c(SC[C@@H]3COCCO3)nnc2-c2ccccn2)cc1	ZINC000450872962	GG	On-Demand	Anodyne	CACNA2D1	60	35
CCOc1ccc(-n2c(SC[C@@H]3COCCO3)nnc2-c2ccccn2)cc1	ZINC000450872962	GG	On-Demand	Anodyne	WNT3A	18	40
CCOc1ccc(-n2c(SC[C@H]3COCCO3)nnc2-c2ccccn2)cc1	ZINC000450872963	GG	On-Demand	Anodyne	CACNA2D1	60	35
CCOc1ccc(-n2c(SC[C@H]3COCCO3)nnc2-c2ccccn2)cc1	ZINC000450872963	GG	On-Demand	Anodyne	WNT3A	18	40
COc1cc(CN2CCC(c3ncc4n3CCCC4)CC2)ccc1Cl	ZINC000450872964	FI	On-Demand	Anodyne	DRD4	23	43
COc1cc(CN2CCC(c3ncc4n3CCCC4)CC2)ccc1Cl	ZINC000450872964	FI	On-Demand	Anodyne	SSTR5	67	40
C[C@H](O)CCSc1nnc(COc2ccccc2)n1-c1ccccc1	ZINC000450872974	FH	On-Demand	Anodyne	VCP	61	38
C[C@@H](O)CCSc1nnc(COc2ccccc2)n1-c1ccccc1	ZINC000450872975	FH	On-Demand	Anodyne	VCP	61	38
N#CC1(CSc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)CCC1	ZINC000450872996	GK	On-Demand	Mild	HCRTR2	17	44
CCn1cc([C@H](C)Nc2ncnc3cc(F)c(OC)cc23)cn1	ZINC000450872999	DG	On-Demand	Anodyne	EGFR	40	44
CCn1cc([C@H](C)Nc2ncnc3cc(F)c(OC)cc23)cn1	ZINC000450872999	DG	On-Demand	Anodyne	EPHA2	47	36
CCn1cc([C@@H](C)Nc2ncnc3cc(F)c(OC)cc23)cn1	ZINC000450873000	DG	On-Demand	Anodyne	EGFR	40	44
CCn1cc([C@@H](C)Nc2ncnc3cc(F)c(OC)cc23)cn1	ZINC000450873000	DG	On-Demand	Anodyne	EPHA2	47	36
COc1cccc2c1CCN(C[C@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000450873001	CF	On-Demand	Anodyne	HTR1A	15	63
COc1cccc2c1CCN(C[C@@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000450873002	CF	On-Demand	Anodyne	HTR1A	15	63
CCn1cc([C@@H](C)Nc2nc(-c3ccc(F)cc3)cs2)cn1	ZINC000450873019	DH	On-Demand	Anodyne	MAOB	17	41
CCn1cc([C@H](C)Nc2nc(-c3ccc(F)cc3)cs2)cn1	ZINC000450873020	DH	On-Demand	Anodyne	MAOB	17	41
c1ccc(CCn2ccc(CN3CCC(Oc4cnccn4)CC3)n2)cc1	ZINC000450873034	FF	On-Demand	Anodyne	SCN9A	0	50
c1ccc(CCn2ccc(CN3CCC(Oc4cnccn4)CC3)n2)cc1	ZINC000450873034	FF	On-Demand	Anodyne	SCN5A	44	40
O[C@H]([C@@H]1CCN(c2nc(-c3ccccc3)ns2)C1)C(F)(F)F	ZINC000450873102	EF	On-Demand	Anodyne	FAAH	0	45
O[C@@H]([C@@H]1CCN(c2nc(-c3ccccc3)ns2)C1)C(F)(F)F	ZINC000450873104	EF	On-Demand	Anodyne	FAAH	0	45
O[C@@H]([C@H]1CCN(c2nc(-c3ccccc3)ns2)C1)C(F)(F)F	ZINC000450873105	EF	On-Demand	Anodyne	FAAH	0	45
O[C@H]([C@H]1CCN(c2nc(-c3ccccc3)ns2)C1)C(F)(F)F	ZINC000450873106	EF	On-Demand	Anodyne	FAAH	0	45
COc1cccc2c1CCN(C[C@H]1CCCCN1C(C)C)CC2	ZINC000450873126	DG	On-Demand	Anodyne	HTR1A	15	63
COc1cccc2c1CCN(C[C@@H]1CCCCN1C(C)C)CC2	ZINC000450873130	DG	On-Demand	Anodyne	HTR1A	15	63
COCCN(CCCC(=O)c1ccccc1)[C@H]1CCOC1	ZINC000450873133	CE	On-Demand	Anodyne	CYP2J2	46	33
COCCN(CCCC(=O)c1ccccc1)[C@@H]1CCOC1	ZINC000450873134	CE	On-Demand	Anodyne	CYP2J2	46	33
c1coc(Cn2c(SCC34CCC(CC3)C4)nnc2-c2cnccn2)c1	ZINC000450873135	FI	On-Demand	Anodyne	HCRTR2	0	40
C=CCn1c(COc2ccccc2)nnc1SCC1(OC)CCC1	ZINC000450873142	EH	On-Demand	Mild	VCP	62	38
C=CCn1c(COc2ccccc2)nnc1S[C@@H]1CC[C@@H](C#N)C1	ZINC000450873144	EH	On-Demand	Mild	VCP	72	46
C=CCn1c(COc2ccccc2)nnc1S[C@@H]1CC[C@H](C#N)C1	ZINC000450873148	EH	On-Demand	Mild	VCP	72	46
C=CCn1c(COc2ccccc2)nnc1S[C@H]1CC[C@H](C#N)C1	ZINC000450873149	EH	On-Demand	Mild	VCP	72	46
C=CCn1c(COc2ccccc2)nnc1S[C@H]1CC[C@@H](C#N)C1	ZINC000450873150	EH	On-Demand	Mild	VCP	72	46
COC(=O)CNC(=O)c1ccc(N2CCC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450873183	GD	On-Demand	Bother	TAAR1	22	44
COC(=O)CNC(=O)c1ccc(N2CCC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450873184	GD	On-Demand	Bother	TAAR1	22	44
C[C@@H](O)CCSc1ncnc2c1cnn2Cc1ccccc1	ZINC000450873206	DF	On-Demand	Anodyne	ABL1	28	42
C[C@@H](O)CCSc1ncnc2c1cnn2Cc1ccccc1	ZINC000450873206	DF	On-Demand	Anodyne	SRC	42	44
C[C@H](O)CCSc1ncnc2c1cnn2Cc1ccccc1	ZINC000450873207	DF	On-Demand	Anodyne	ABL1	28	42
C[C@H](O)CCSc1ncnc2c1cnn2Cc1ccccc1	ZINC000450873207	DF	On-Demand	Anodyne	SRC	42	44
O=C(c1c[nH]c2nccc-2c1)N1CCCC[C@H]1c1ccccc1	ZINC000450873222	DH	On-Demand	Anodyne	COLA	115	42
O=C(c1c[nH]c2nccc-2c1)N1CCCC[C@H]1c1ccccc1	ZINC000450873222	DH	On-Demand	Anodyne	CPT1A	99	42
O=C(c1c[nH]c2nccc-2c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450873223	DH	On-Demand	Anodyne	COLA	115	42
O=C(c1c[nH]c2nccc-2c1)N1CCCC[C@@H]1c1ccccc1	ZINC000450873223	DH	On-Demand	Anodyne	CPT1A	99	42
Cn1c(COc2ccccc2)nnc1SC[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000450873250	GD	On-Demand	Anodyne	VCP	59	42
Cn1c(COc2ccccc2)nnc1SC[C@H]1CCN(S(C)(=O)=O)C1	ZINC000450873251	GD	On-Demand	Anodyne	VCP	59	42
COc1ccc(CNC(=O)CCN[C@H](CO)[C@@H]2CCCO2)c(OC)c1	ZINC000450873254	FC	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN[C@@H](CO)[C@@H]2CCCO2)c(OC)c1	ZINC000450873255	FC	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN[C@H](CO)[C@H]2CCCO2)c(OC)c1	ZINC000450873256	FC	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN[C@@H](CO)[C@H]2CCCO2)c(OC)c1	ZINC000450873257	FC	On-Demand	Anodyne	MTNR1A	43	36
CC[C@@H](O)CC(=O)NC1Cc2ccccc2C1	ZINC000450873258	BD	On-Demand	Anodyne	MTNR1A	0	45
CC[C@H](O)CC(=O)NC1Cc2ccccc2C1	ZINC000450873259	BD	On-Demand	Anodyne	MTNR1A	0	45
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450873274	DF	On-Demand	Anodyne	SLC6A3	16	42
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450873276	DF	On-Demand	Anodyne	SLC6A3	16	42
O=C(c1ccc(N2CCC2)nc1)N1CCCC[C@@H]1c1ccccc1	ZINC000450873285	DH	On-Demand	Anodyne	COLA	107	39
O=C(c1ccc(N2CCC2)nc1)N1CCCC[C@@H]1c1ccccc1	ZINC000450873285	DH	On-Demand	Anodyne	CPT1A	65	34
O=C(c1ccc(N2CCC2)nc1)N1CCCC[C@@H]1c1ccccc1	ZINC000450873285	DH	On-Demand	Anodyne	HDAC1	0	40
O=C(c1ccc(N2CCC2)nc1)N1CCCC[C@H]1c1ccccc1	ZINC000450873286	DH	On-Demand	Anodyne	COLA	107	39
O=C(c1ccc(N2CCC2)nc1)N1CCCC[C@H]1c1ccccc1	ZINC000450873286	DH	On-Demand	Anodyne	CPT1A	65	34
O=C(c1ccc(N2CCC2)nc1)N1CCCC[C@H]1c1ccccc1	ZINC000450873286	DH	On-Demand	Anodyne	HDAC1	0	40
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450873304	EG	On-Demand	Anodyne	ADAM17	41	41
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450873304	EG	On-Demand	Anodyne	COLA	73	36
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450873304	EG	On-Demand	Anodyne	CPT1A	71	36
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450873304	EG	On-Demand	Anodyne	PREP	71	37
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450873305	EG	On-Demand	Anodyne	ADAM17	41	41
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450873305	EG	On-Demand	Anodyne	COLA	73	36
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450873305	EG	On-Demand	Anodyne	CPT1A	71	36
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450873305	EG	On-Demand	Anodyne	PREP	71	37
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450873306	EG	On-Demand	Anodyne	ADAM17	41	41
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450873306	EG	On-Demand	Anodyne	COLA	73	36
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450873306	EG	On-Demand	Anodyne	CPT1A	71	36
C[C@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450873306	EG	On-Demand	Anodyne	PREP	71	37
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450873307	EG	On-Demand	Anodyne	ADAM17	41	41
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450873307	EG	On-Demand	Anodyne	COLA	73	36
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450873307	EG	On-Demand	Anodyne	CPT1A	71	36
C[C@@H](OCCc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450873307	EG	On-Demand	Anodyne	PREP	71	37
COc1ccc(OC(F)(F)F)c(C(=O)Nc2cncnc2N(C)C)c1	ZINC000450873320	FF	On-Demand	Anodyne	KCNK9	20	40
COc1cccc2c1CCN(CC1CC(F)(F)C1)CC2	ZINC000450873333	CG	On-Demand	Anodyne	HTR1A	17	41
COCCNC(=O)c1ccc(NC[C@@H](c2ccccc2)c2nc[nH]n2)nc1	ZINC000450873339	FD	On-Demand	Anodyne	EPHX2	0	45
COCCNC(=O)c1ccc(NC[C@H](c2ccccc2)c2nc[nH]n2)nc1	ZINC000450873341	FD	On-Demand	Anodyne	EPHX2	0	45
C=CCn1c(COc2ccccc2)nnc1SCC1(C#N)CCC1	ZINC000450873343	EH	On-Demand	Mild	VCP	55	38
COc1cccc2c1CCN(CC[C@@H](C)O)CC2	ZINC000450873376	BD	On-Demand	Anodyne	HTR1A	36	41
COc1cccc2c1CCN(CC[C@@H](C)O)CC2	ZINC000450873376	BD	On-Demand	Anodyne	DRD2	27	51
COc1cccc2c1CCN(CC[C@@H](C)O)CC2	ZINC000450873376	BD	On-Demand	Anodyne	ADRA1D	40	32
COc1cccc2c1CCN(CC[C@@H](C)O)CC2	ZINC000450873376	BD	On-Demand	Anodyne	ADRA1B	44	35
COc1cccc2c1CCN(CC[C@@H](C)O)CC2	ZINC000450873376	BD	On-Demand	Anodyne	DRD3	21	43
COc1cccc2c1CCN(CC[C@H](C)O)CC2	ZINC000450873377	BD	On-Demand	Anodyne	HTR1A	36	41
COc1cccc2c1CCN(CC[C@H](C)O)CC2	ZINC000450873377	BD	On-Demand	Anodyne	DRD2	27	51
COc1cccc2c1CCN(CC[C@H](C)O)CC2	ZINC000450873377	BD	On-Demand	Anodyne	ADRA1D	40	32
COc1cccc2c1CCN(CC[C@H](C)O)CC2	ZINC000450873377	BD	On-Demand	Anodyne	ADRA1B	44	35
COc1cccc2c1CCN(CC[C@H](C)O)CC2	ZINC000450873377	BD	On-Demand	Anodyne	DRD3	21	43
CCOc1ccc(-n2c(SC[C@@H]3COCCO3)nnc2-c2cnccn2)cc1	ZINC000450873396	GF	On-Demand	Anodyne	CACNA2D1	51	34
CCOc1ccc(-n2c(SC[C@@H]3COCCO3)nnc2-c2cnccn2)cc1	ZINC000450873396	GF	On-Demand	Anodyne	WNT3A	19	43
CCOc1ccc(-n2c(SC[C@H]3COCCO3)nnc2-c2cnccn2)cc1	ZINC000450873398	GF	On-Demand	Anodyne	CACNA2D1	51	34
CCOc1ccc(-n2c(SC[C@H]3COCCO3)nnc2-c2cnccn2)cc1	ZINC000450873398	GF	On-Demand	Anodyne	WNT3A	19	43
CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@H]1c1ncc[nH]1	ZINC000450873401	FG	On-Demand	Anodyne	LIPG	42	31
CCN1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C[C@@H]1c1ncc[nH]1	ZINC000450873402	FG	On-Demand	Anodyne	LIPG	42	31
COc1cc(CN2CCC3(CC2)CCN(C)C3=O)ccc1Cl	ZINC000450873426	DF	On-Demand	Anodyne	AVPR1B	40	33
Brc1ccc2c(NC3CCN(C4CCC4)CC3)ncnc2c1	ZINC000450873452	FH	On-Demand	Anodyne	CCR4	0	41
Brc1ccc2c(NC3CCN(C4CCC4)CC3)ncnc2c1	ZINC000450873452	FH	On-Demand	Anodyne	CD38	43	44
Cc1cccnc1OC1CCN(CCC[C@H](C)O)CC1	ZINC000450873455	CE	On-Demand	Anodyne	SCN5A	43	32
Cc1cccnc1OC1CCN(CCC[C@@H](C)O)CC1	ZINC000450873457	CE	On-Demand	Anodyne	SCN5A	43	32
CC(C)(C)CC(C)(C)N1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450873488	FF	On-Demand	Anodyne	SORD	60	38
CC(C)(C)CC(C)(C)N1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450873488	FF	On-Demand	Anodyne	SMG1	40	33
CCn1c(SC2CC(OC(C)(C)C)C2)nnc1-c1cccnc1	ZINC000450873495	EH	On-Demand	Anodyne	VCP	58	34
CNC(=O)[C@@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450873508	CD	On-Demand	Anodyne	MME	26	45
CNC(=O)[C@@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450873508	CD	On-Demand	Anodyne	PAPA1_CARPA	24	40
CNC(=O)[C@@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450873508	CD	On-Demand	Anodyne	PGA	26	40
CNC(=O)[C@@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450873508	CD	On-Demand	Anodyne	POL	0	48
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	DRD2	32	56
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	DRD4	19	43
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	HTR2A	45	56
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	HTR2C	17	59
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	HRH1	16	43
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	DRD3	15	42
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	HTR7	27	51
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	SIGMAR1	15	43
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	SLC18A3	28	42
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	CYP2J2	47	34
CCc1cc(CCCN2CCC(C(=O)c3ccc(F)cc3)CC2)on1	ZINC000450873509	EH	On-Demand	Anodyne	WNT3A	59	39
CNC(=O)[C@@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450873511	CD	On-Demand	Anodyne	MME	26	45
CNC(=O)[C@@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450873511	CD	On-Demand	Anodyne	PAPA1_CARPA	24	40
CNC(=O)[C@@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450873511	CD	On-Demand	Anodyne	PGA	26	40
CNC(=O)[C@@H](NC[C@H](O)[C@@H](C)c1ccccc1)C(C)C	ZINC000450873511	CD	On-Demand	Anodyne	POL	0	48
CNC(=O)[C@@H](NC[C@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450873512	CD	On-Demand	Anodyne	MME	26	45
CNC(=O)[C@@H](NC[C@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450873512	CD	On-Demand	Anodyne	PAPA1_CARPA	24	40
CNC(=O)[C@@H](NC[C@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450873512	CD	On-Demand	Anodyne	PGA	26	40
CNC(=O)[C@@H](NC[C@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450873512	CD	On-Demand	Anodyne	POL	0	48
CNC(=O)[C@@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450873514	CD	On-Demand	Anodyne	MME	26	45
CNC(=O)[C@@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450873514	CD	On-Demand	Anodyne	PAPA1_CARPA	24	40
CNC(=O)[C@@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450873514	CD	On-Demand	Anodyne	PGA	26	40
CNC(=O)[C@@H](NC[C@@H](O)[C@H](C)c1ccccc1)C(C)C	ZINC000450873514	CD	On-Demand	Anodyne	POL	0	48
COC(=O)c1ccc(CC(=O)N(C)C[C@@H]2CCCN(C)[C@H]2c2cnn(C)c2)cc1	ZINC000450873523	GE	On-Demand	Anodyne	PANC	47	39
COc1cc(CN2C[C@@H](O)Cc3ccccc32)ccc1Cl	ZINC000450873530	DG	On-Demand	Anodyne	DRD4	36	41
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450873534	GH	On-Demand	Anodyne	HCRTR2	41	35
COc1cc(CN2C[C@H](O)Cc3ccccc32)ccc1Cl	ZINC000450873536	DG	On-Demand	Anodyne	DRD4	36	41
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450873539	GH	On-Demand	Anodyne	HCRTR2	41	35
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450873554	FD	On-Demand	Anodyne	SORD	43	37
C[C@H]1CN(CC(F)(F)F)CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450873557	FD	On-Demand	Anodyne	SORD	43	37
COc1cc(Cn2nnnc2C)ccc1Cl	ZINC000450873568	BD	On-Demand	Anodyne	CCR1	0	41
COc1cc2c(NC3CCN(C4CCC4)CC3)ccnc2cc1F	ZINC000450873570	EH	On-Demand	Anodyne	PDE3A	46	36
COc1cc2c(NC3CCN(C4CCC4)CC3)ccnc2cc1F	ZINC000450873570	EH	On-Demand	Anodyne	CCR4	37	44
COc1cc2c(NC3CCN(C4CCC4)CC3)ccnc2cc1F	ZINC000450873570	EH	On-Demand	Anodyne	PDE3B	68	36
COc1cc2c(NC3CCN(C4CCC4)CC3)ccnc2cc1F	ZINC000450873570	EH	On-Demand	Anodyne	MET	45	39
COc1cc2c(NC3CCN(C4CCC4)CC3)ccnc2cc1F	ZINC000450873570	EH	On-Demand	Anodyne	EHMT2	72	38
COC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1Cl	ZINC000450873586	FF	On-Demand	Anodyne	HRH1	30	41
COC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1Cl	ZINC000450873586	FF	On-Demand	Anodyne	SSTR5	63	41
COC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1Cl	ZINC000450873586	FF	On-Demand	Anodyne	CCR3	49	37
COC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1Cl	ZINC000450873586	FF	On-Demand	Anodyne	MCHR1	28	43
CC1CN(c2ccnc(C(C)C)n2)CCN(c2ccnc(C(C)C)n2)C1	ZINC000450873596	FG	On-Demand	Anodyne	SORD	134	52
CCc1nc(C)c(CSc2nnc(-c3ccccn3)n2Cc2ccco2)o1	ZINC000450873603	GI	On-Demand	Anodyne	HCRTR2	19	40
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450873604	FD	On-Demand	Anodyne	GPR119	22	44
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450873604	FD	On-Demand	Anodyne	GCKR	64	34
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450873606	FD	On-Demand	Anodyne	GPR119	22	44
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450873606	FD	On-Demand	Anodyne	GCKR	64	34
CCOC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)nc1	ZINC000450873610	EE	On-Demand	Anodyne	SSTR5	46	36
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc3ccccc3n2)C1	ZINC000450873611	DH	On-Demand	Anodyne	HTR3A	36	48
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc3ccccc3n2)C1	ZINC000450873611	DH	On-Demand	Anodyne	SORD	24	45
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc3ccccc3n2)C1	ZINC000450873613	DH	On-Demand	Anodyne	HTR3A	36	48
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc3ccccc3n2)C1	ZINC000450873613	DH	On-Demand	Anodyne	SORD	24	45
C[C@@H](c1ccccc1)[C@H](O)CN1CCC2(CC1)CCN(C)C2=O	ZINC000450873626	DE	On-Demand	Anodyne	SLC18A3	44	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC2(CC1)CCN(C)C2=O	ZINC000450873628	DE	On-Demand	Anodyne	SLC18A3	44	41
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450873631	GG	On-Demand	Anodyne	ATP4A	18	47
FC1(F)CCC[C@@H]1CSc1nnc(-c2cccs2)n1Cc1ccco1	ZINC000450873632	GK	On-Demand	Anodyne	HCRTR2	20	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC2(CC1)CCN(C)C2=O	ZINC000450873633	DE	On-Demand	Anodyne	SLC18A3	44	41
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450873634	GG	On-Demand	Anodyne	ATP4A	18	47
C[C@H](c1ccccc1)[C@@H](O)CN1CCC2(CC1)CCN(C)C2=O	ZINC000450873635	DE	On-Demand	Anodyne	SLC18A3	44	41
COC(=O)c1cccc(CN2CCC(Oc3ccncc3C)CC2)c1Cl	ZINC000450873636	FH	On-Demand	Anodyne	HRH1	24	42
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450873637	GG	On-Demand	Anodyne	ATP4A	18	47
FC1(F)CCC[C@H]1CSc1nnc(-c2cccs2)n1Cc1ccco1	ZINC000450873638	GK	On-Demand	Anodyne	HCRTR2	20	42
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450873639	GG	On-Demand	Anodyne	ATP4A	18	47
CCOC(=O)c1ccc(CSc2nnc(-c3ccccn3)n2CC)nc1	ZINC000450873658	FG	On-Demand	Anodyne	SLC27A1	36	42
C[C@@H]1C[C@@H]1c1nnc2ccc(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450873662	FH	On-Demand	Anodyne	LRRK2	22	46
COC(=O)c1cnc(NC2CCN(C3CCC3)CC2)nc1	ZINC000450873663	CD	On-Demand	Anodyne	HRH3	26	42
COC(=O)c1cnc(NC2CCN(C3CCC3)CC2)nc1	ZINC000450873663	CD	On-Demand	Anodyne	L3MBTL3	42	33
C[C@@H]1C[C@H]1c1nnc2ccc(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450873665	FH	On-Demand	Anodyne	LRRK2	22	46
C[C@H]1C[C@@H]1c1nnc2ccc(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450873667	FH	On-Demand	Anodyne	LRRK2	22	46
C[C@@H](O)CCSc1nnc(-c2ccco2)n1Cc1ccco1	ZINC000450873669	DG	On-Demand	Anodyne	HCRTR2	22	45
C[C@H](O)CCSc1nnc(-c2ccco2)n1Cc1ccco1	ZINC000450873671	DG	On-Demand	Anodyne	HCRTR2	22	45
C[C@H]1C[C@H]1c1nnc2ccc(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450873672	FH	On-Demand	Anodyne	LRRK2	22	46
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	HTR2A	17	44
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	PTGER3	25	40
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	COLA	45	36
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	CPT1A	47	33
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	KDR	15	42
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	F7	31	43
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	PDGFRA	15	42
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	ENPP1	82	42
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	PSBA	0	42
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	KCNK3	52	38
COc1ccc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)cc1OC(C)C	ZINC000450873675	GH	On-Demand	Anodyne	KCNK9	48	38
COc1ccc(-c2noc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)n2)nn1	ZINC000450873681	GF	On-Demand	Anodyne	SLC18A3	34	46
COc1ccc(-c2noc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)n2)nn1	ZINC000450873681	GF	On-Demand	Anodyne	WNT3A	59	37
CC1(C2(Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[N+](=O)[O-])CC2)CC1	ZINC000450873684	GE	On-Demand	Bother	DDIT3	0	42
CC(=O)c1cccc(CN2CCC(Oc3cnccn3)CC2)c1	ZINC000450873705	DF	On-Demand	Anodyne	HRH1	0	49
CC(=O)c1cccc(CN2CCC(Oc3cnccn3)CC2)c1	ZINC000450873705	DF	On-Demand	Anodyne	PRSS2	45	32
CC(=O)c1cccc(CN2CCC(Oc3cnccn3)CC2)c1	ZINC000450873705	DF	On-Demand	Anodyne	SSTR5	51	38
CC(=O)c1cccc(CN2CCC(Oc3cnccn3)CC2)c1	ZINC000450873705	DF	On-Demand	Anodyne	FAAH	24	41
CCc1cnc(SCCCCCC(C)=O)[nH]1	ZINC000450873706	BG	On-Demand	Anodyne	HDA106	0	43
C[C@H](c1csnn1)N1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450873761	GG	On-Demand	Anodyne	EPHX2	18	43
C[C@@H](c1csnn1)N1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450873762	GG	On-Demand	Anodyne	EPHX2	18	43
CCc1cc(NC2CCN(C3CCC3)CC2)n2ncnc2n1	ZINC000450873777	DE	On-Demand	Anodyne	DHOD	0	47
CCOC(=O)c1ccc(CN2CCc3cccc(OC)c3CC2)nc1	ZINC000450873792	EF	On-Demand	Anodyne	NOD2	41	42
CC(=O)c1cccc(CN2CCOc3ccc(F)cc3C2)c1	ZINC000450873793	CG	On-Demand	Anodyne	CCR3	35	42
CC(=O)CCCCCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450873827	EI	On-Demand	Anodyne	DRD2	19	49
CC(=O)CCCCCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450873827	EI	On-Demand	Anodyne	DRD3	46	39
CC(=O)CCCCCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450873827	EI	On-Demand	Anodyne	KCNH2	32	49
C=CCn1c(COc2ccc(C)cc2)nnc1S[C@@H]1C[C@H](C)CCC1=O	ZINC000450873845	FI	On-Demand	Mild	VCP	53	38
C=CCn1c(COc2ccc(C)cc2)nnc1S[C@@H]1C[C@@H](C)CCC1=O	ZINC000450873850	FI	On-Demand	Mild	VCP	53	38
C=CCn1c(COc2ccc(C)cc2)nnc1S[C@H]1C[C@H](C)CCC1=O	ZINC000450873852	FI	On-Demand	Mild	VCP	53	38
C=CCn1c(COc2ccc(C)cc2)nnc1S[C@H]1C[C@@H](C)CCC1=O	ZINC000450873855	FI	On-Demand	Mild	VCP	53	38
CCS(=O)(=O)c1ccc(CN2[C@H](C(=O)OC)CC[C@H]2c2ccccc2)cc1	ZINC000450873861	GG	On-Demand	Anodyne	MMP13	19	40
CCS(=O)(=O)c1ccc(CN2[C@H](C(=O)OC)CC[C@H]2c2ccccc2)cc1	ZINC000450873861	GG	On-Demand	Anodyne	APP	23	40
CCS(=O)(=O)c1ccc(CN2[C@H](C(=O)OC)CC[C@H]2c2ccccc2)cc1	ZINC000450873861	GG	On-Demand	Anodyne	TIMP3	61	33
CCS(=O)(=O)c1ccc(CN2[C@H](C(=O)OC)CC[C@H]2c2ccccc2)cc1	ZINC000450873861	GG	On-Demand	Anodyne	MMP3	18	40
CCS(=O)(=O)c1ccc(CN2[C@H](C(=O)OC)CC[C@H]2c2ccccc2)cc1	ZINC000450873861	GG	On-Demand	Anodyne	MMP9	20	40
CCS(=O)(=O)c1ccc(CN2[C@H](C(=O)OC)CC[C@H]2c2ccccc2)cc1	ZINC000450873861	GG	On-Demand	Anodyne	MMP1	20	40
C[C@@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2)c1=O	ZINC000450873899	EE	On-Demand	Anodyne	PKM	18	41
C[C@@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2)c1=O	ZINC000450873899	EE	On-Demand	Anodyne	NPBWR1	18	41
C[C@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2)c1=O	ZINC000450873902	EE	On-Demand	Anodyne	PKM	18	41
C[C@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2)c1=O	ZINC000450873902	EE	On-Demand	Anodyne	NPBWR1	18	41
CCn1cc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cn1	ZINC000450873955	EI	On-Demand	Bother	AADAC	0	49
CCn1cc([C@H](C)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cn1	ZINC000450873957	EI	On-Demand	Bother	AADAC	0	49
Cn1c(SCCC(C)(F)F)nnc1-c1cccc(Cl)c1	ZINC000450873958	DI	On-Demand	Anodyne	DRD2	23	47
Cn1c(SCCC(C)(F)F)nnc1-c1cccc(Cl)c1	ZINC000450873958	DI	On-Demand	Anodyne	DRD3	27	47
Cn1c(SCCC(C)(F)F)nnc1-c1cccc(Cl)c1	ZINC000450873958	DI	On-Demand	Anodyne	KCNH2	27	41
Cn1c(SCCC(C)(F)F)nnc1-c1cccc(Cl)c1	ZINC000450873958	DI	On-Demand	Anodyne	HSD11B1	19	44
C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)C(=O)C1CCCCC1	ZINC000450873963	GJ	On-Demand	Mild	CPT1A	62	34
C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)C(=O)C1CCCCC1	ZINC000450873963	GJ	On-Demand	Mild	VCP	75	45
C=CCn1c(COc2ccccc2)nnc1S[C@H](C)C(=O)C1CCCCC1	ZINC000450873964	GJ	On-Demand	Mild	CPT1A	62	34
C=CCn1c(COc2ccccc2)nnc1S[C@H](C)C(=O)C1CCCCC1	ZINC000450873964	GJ	On-Demand	Mild	VCP	75	45
COC[C@@H](c1ccc(Cl)cc1)N(C)Cc1ccc(C(C)=O)cc1	ZINC000450874022	EI	On-Demand	Anodyne	UTS2	44	35
NS(=O)(=O)c1cnc(N2CC(c3cccc(C(F)(F)F)c3)C2)s1	ZINC000450874027	FE	On-Demand	Anodyne	MLYCD	41	39
CCC(=O)c1ccc(OCC[C@@H](C)O)c(F)c1	ZINC000450874033	BF	On-Demand	Anodyne	THRA	22	50
CCC(=O)c1ccc(OCC[C@@H](C)O)c(F)c1	ZINC000450874033	BF	On-Demand	Anodyne	GRM2	15	46
CCC(=O)c1ccc(OCC[C@H](C)O)c(F)c1	ZINC000450874034	BF	On-Demand	Anodyne	THRA	22	50
CCC(=O)c1ccc(OCC[C@H](C)O)c(F)c1	ZINC000450874034	BF	On-Demand	Anodyne	GRM2	15	46
Cc1nnc2c3ccccc3c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nn12	ZINC000450874035	FE	On-Demand	Anodyne	CREBBP	43	35
Cc1nnc2c3ccccc3c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nn12	ZINC000450874035	FE	On-Demand	Anodyne	BRD9	55	35
Cc1nnc2c3ccccc3c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nn12	ZINC000450874037	FE	On-Demand	Anodyne	CREBBP	43	35
Cc1nnc2c3ccccc3c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nn12	ZINC000450874037	FE	On-Demand	Anodyne	BRD9	55	35
Cc1nnc2c3ccccc3c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nn12	ZINC000450874040	FE	On-Demand	Anodyne	CREBBP	43	35
Cc1nnc2c3ccccc3c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nn12	ZINC000450874040	FE	On-Demand	Anodyne	BRD9	55	35
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c(Br)c1	ZINC000450874041	GH	On-Demand	Anodyne	COLA	49	35
Cc1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)c(Br)c1	ZINC000450874041	GH	On-Demand	Anodyne	CPT1A	48	35
Cc1nnc2c3ccccc3c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nn12	ZINC000450874042	FE	On-Demand	Anodyne	CREBBP	43	35
Cc1nnc2c3ccccc3c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nn12	ZINC000450874042	FE	On-Demand	Anodyne	BRD9	55	35
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c(Br)c1	ZINC000450874043	GH	On-Demand	Anodyne	COLA	49	35
Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)c(Br)c1	ZINC000450874043	GH	On-Demand	Anodyne	CPT1A	48	35
COc1ccc(CNC(=O)CCN2CCCC23CCC3)c(OC)c1	ZINC000450874070	EF	On-Demand	Anodyne	MTNR1A	53	37
OCC1(Cc2ccccc2)CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450874085	EF	On-Demand	Anodyne	NPFFR1	36	41
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)C(C)(C)C(C)(F)F)C1	ZINC000450874091	EF	On-Demand	Anodyne	SCD1	40	37
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)C(C)(C)C(C)(F)F)C1	ZINC000450874091	EF	On-Demand	Anodyne	SCD	39	43
CN(C)c1ncccc1O[C@H]1CCN(C(=O)C(C)(C)C(C)(F)F)C1	ZINC000450874093	EF	On-Demand	Anodyne	SCD1	40	37
CN(C)c1ncccc1O[C@H]1CCN(C(=O)C(C)(C)C(C)(F)F)C1	ZINC000450874093	EF	On-Demand	Anodyne	SCD	39	43
Fc1cccnc1O[C@@H]1CCCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450874100	FG	On-Demand	Anodyne	SCN5A	40	35
Fc1cccnc1O[C@H]1CCCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450874110	FG	On-Demand	Anodyne	SCN5A	40	35
COc1cc(C(C)=O)c(OC)cc1OCc1oc(C(C)C)nc1C	ZINC000450874119	EH	On-Demand	Anodyne	P2RX2	52	38
Cc1cc(N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)n2ncnc2n1	ZINC000450874150	EE	On-Demand	Anodyne	DHOD	0	47
Cc1cc(N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)n2ncnc2n1	ZINC000450874157	EE	On-Demand	Anodyne	DHOD	0	47
Cc1cc(N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)n2ncnc2n1	ZINC000450874158	EE	On-Demand	Anodyne	DHOD	0	47
Cc1cc(N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)n2ncnc2n1	ZINC000450874159	EE	On-Demand	Anodyne	DHOD	0	47
CCC(=O)c1ccc(OCCC[C@H](C)O)c(F)c1	ZINC000450874170	CF	On-Demand	Anodyne	THRA	25	52
CCC(=O)c1ccc(OCCC[C@H](C)O)c(F)c1	ZINC000450874170	CF	On-Demand	Anodyne	GRM2	0	48
CCC(=O)c1ccc(OCCC[C@@H](C)O)c(F)c1	ZINC000450874171	CF	On-Demand	Anodyne	THRA	25	52
CCC(=O)c1ccc(OCCC[C@@H](C)O)c(F)c1	ZINC000450874171	CF	On-Demand	Anodyne	GRM2	0	48
C[C@H](CN1CCC(Oc2ncccc2F)CC1)S(C)(=O)=O	ZINC000450874177	DD	On-Demand	Anodyne	SCN9A	0	43
C[C@H](CN1CCC(Oc2ncccc2F)CC1)S(C)(=O)=O	ZINC000450874177	DD	On-Demand	Anodyne	GPR119	33	42
C[C@@H](CN1CCC(Oc2ncccc2F)CC1)S(C)(=O)=O	ZINC000450874178	DD	On-Demand	Anodyne	SCN9A	0	43
C[C@@H](CN1CCC(Oc2ncccc2F)CC1)S(C)(=O)=O	ZINC000450874178	DD	On-Demand	Anodyne	GPR119	33	42
CCn1c(COc2ccc(C)cc2)nnc1SCc1cn(CC2CC2)nn1	ZINC000450874197	GG	On-Demand	Anodyne	VCP	41	38
CCn1c(COc2ccc(C)cc2)nnc1SCc1cccc(C(C)=O)c1	ZINC000450874218	GJ	On-Demand	Anodyne	SLC27A1	43	36
O=C1CCC(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450874230	DG	On-Demand	Anodyne	HTR2A	29	66
O=C1CCC(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450874230	DG	On-Demand	Anodyne	SIGMAR1	23	57
O=C1CCC(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450874230	DG	On-Demand	Anodyne	SLC18A3	35	50
O=C1CCC(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450874230	DG	On-Demand	Anodyne	WNT3A	70	45
COC(=O)c1ccc(CN2CCC[C@H](N3CCCS3(=O)=O)C2)cc1Cl	ZINC000450874235	GE	On-Demand	Anodyne	OPRK1	15	40
COC(=O)c1ccc(CN2CCC[C@H](N3CCCS3(=O)=O)C2)cc1Cl	ZINC000450874235	GE	On-Demand	Anodyne	CCR3	21	41
COC(=O)c1ccc(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)cc1Cl	ZINC000450874236	GE	On-Demand	Anodyne	OPRK1	15	40
COC(=O)c1ccc(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)cc1Cl	ZINC000450874236	GE	On-Demand	Anodyne	CCR3	21	41
CC(C)(C)c1cc(CSc2nnc(-c3ccco3)n2Cc2ccco2)no1	ZINC000450874237	GJ	On-Demand	Anodyne	HCRTR2	21	41
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccc(F)cc3)n2Cc2ccco2)C1	ZINC000450874241	GJ	On-Demand	Anodyne	HCRTR2	19	42
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3ccc(F)cc3)n2Cc2ccco2)C1	ZINC000450874242	GJ	On-Demand	Anodyne	HCRTR2	19	42
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3ccc(F)cc3)n2Cc2ccco2)C1	ZINC000450874243	GJ	On-Demand	Anodyne	HCRTR2	19	42
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccc(F)cc3)n2Cc2ccco2)C1	ZINC000450874244	GJ	On-Demand	Anodyne	HCRTR2	19	42
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450874247	GH	On-Demand	Anodyne	CACNA1H	40	45
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450874247	GH	On-Demand	Anodyne	FAAH	15	58
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450874247	GH	On-Demand	Anodyne	CCR2	41	67
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450874247	GH	On-Demand	Anodyne	EPHX2	48	48
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450874247	GH	On-Demand	Anodyne	TRPM8	49	40
COC(=O)c1ccc(CN2C[C@@H](O)Cc3ccccc32)cc1Cl	ZINC000450874250	EG	On-Demand	Anodyne	DRD4	33	43
COC(=O)c1ccc(CN2C[C@H](O)Cc3ccccc32)cc1Cl	ZINC000450874251	EG	On-Demand	Anodyne	DRD4	33	43
CCn1c(COc2ccc(C)cc2)nnc1SCC(=O)CC(C)(C)C1CC1	ZINC000450874252	GJ	On-Demand	Anodyne	VCP	52	38
Cc1ccn(C2CCN(Cc3ccc([C@H](C)C(F)(F)F)cc3)CC2)n1	ZINC000450874273	FJ	On-Demand	Anodyne	DRD4	21	48
Cc1ccn(C2CCN(Cc3ccc([C@@H](C)C(F)(F)F)cc3)CC2)n1	ZINC000450874277	FJ	On-Demand	Anodyne	DRD4	21	48
O=[N+]([O-])c1ccc(SCc2cccnc2)c(S(=O)(=O)N2CCCC2)c1	ZINC000450874292	GG	On-Demand	Bother	C3AR1	32	41
O=[N+]([O-])c1ccc(SCc2cccnc2)c(S(=O)(=O)N2CCCC2)c1	ZINC000450874292	GG	On-Demand	Bother	NAMPT	28	42
O=C(CCCN1CCC[C@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874294	FE	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874294	FE	On-Demand	Anodyne	HTR2A	26	48
O=C(CCCN1CCC[C@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874294	FE	On-Demand	Anodyne	HTR2C	15	52
O=C(CCCN1CCC[C@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874294	FE	On-Demand	Anodyne	SLC6A1	89	38
O=C(CCCN1CCC[C@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874294	FE	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC[C@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874294	FE	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCC[C@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874294	FE	On-Demand	Anodyne	CYP2J2	53	37
O=C(CCCN1CCC[C@@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874296	FE	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874296	FE	On-Demand	Anodyne	HTR2A	26	48
O=C(CCCN1CCC[C@@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874296	FE	On-Demand	Anodyne	HTR2C	15	52
O=C(CCCN1CCC[C@@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874296	FE	On-Demand	Anodyne	SLC6A1	89	38
O=C(CCCN1CCC[C@@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874296	FE	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC[C@@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874296	FE	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCC[C@@H](N2CCCS2(=O)=O)C1)c1ccc(F)cc1	ZINC000450874296	FE	On-Demand	Anodyne	CYP2J2	53	37
CCCC[C@@H](NC(=O)C[C@H](O)CC)C(=O)OC	ZINC000450874311	BC	On-Demand	Anodyne	NOD1	92	38
CCCC[C@H](NC(=O)C[C@@H](O)CC)C(=O)OC	ZINC000450874312	BC	On-Demand	Anodyne	NOD1	92	38
CCCC[C@@H](NC(=O)C[C@@H](O)CC)C(=O)OC	ZINC000450874314	BC	On-Demand	Anodyne	NOD1	92	38
CCCC[C@H](NC(=O)C[C@H](O)CC)C(=O)OC	ZINC000450874315	BC	On-Demand	Anodyne	NOD1	92	38
CCC(=O)CCCN(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450874316	CD	On-Demand	Anodyne	ZM.86993	0	46
Cc1nccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)n1	ZINC000450874318	CE	On-Demand	Anodyne	SORD	41	32
Cc1nccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)n1	ZINC000450874319	CE	On-Demand	Anodyne	SORD	41	32
CCCOc1cccc(CN2C(=O)CN(c3cccc(C(=O)OC)c3)C2=O)c1	ZINC000450874320	GG	On-Demand	Anodyne	HRH2	28	40
CCC(=O)CCCN1CCN(c2cccc3cnccc23)C[C@@H]1C	ZINC000450874323	EH	On-Demand	Anodyne	P2RX7	0	41
CCC(=O)CCCN1CCN(c2cccc3cnccc23)C[C@H]1C	ZINC000450874324	EH	On-Demand	Anodyne	P2RX7	0	41
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3c2oc2ccccc23)C1	ZINC000450874329	FH	On-Demand	Anodyne	HRH4	21	57
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3c2oc2ccccc23)C1	ZINC000450874330	FH	On-Demand	Anodyne	HRH4	21	57
Cn1cnc([N+](=O)[O-])c1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450874334	EF	On-Demand	Bother	KCNN3	28	45
Cn1cnc([N+](=O)[O-])c1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450874335	EF	On-Demand	Bother	KCNN3	28	45
Nc1nc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450874347	EE	On-Demand	Bother	KCNN3	24	46
Nc1nc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncc1[N+](=O)[O-]	ZINC000450874348	EE	On-Demand	Bother	KCNN3	24	46
COC(=O)c1ccc(CN2CCC(Oc3ccncc3C)CC2)cc1Cl	ZINC000450874355	FH	On-Demand	Anodyne	HRH1	34	40
COC(=O)c1ccc(CN2CCC(Oc3ccncc3C)CC2)cc1Cl	ZINC000450874355	FH	On-Demand	Anodyne	HTR4	55	33
COC(=O)c1ccc(CN2CCC(Oc3ccncc3C)CC2)cc1Cl	ZINC000450874355	FH	On-Demand	Anodyne	SSTR5	62	40
COC(=O)c1ccc(CN2CCC(Oc3ccncc3C)CC2)cc1Cl	ZINC000450874355	FH	On-Demand	Anodyne	CCR3	46	39
COC(=O)c1ccc(CN2CCC(Oc3ccncc3C)CC2)cc1Cl	ZINC000450874355	FH	On-Demand	Anodyne	MCHR1	32	42
COC[C@H](c1ccc(Cl)cc1)N(C)Cc1ccc(C(C)=O)cc1	ZINC000450874379	EI	On-Demand	Anodyne	UTS2	44	35
COc1cccc2c1CCN(C[C@@H]1CCNC(=O)CC1)CC2	ZINC000450874421	DE	On-Demand	Anodyne	PTGIR	43	37
COc1cccc2c1CCN(C[C@H]1CCNC(=O)CC1)CC2	ZINC000450874422	DE	On-Demand	Anodyne	PTGIR	43	37
C1=C(CSc2nnc(-c3cnccn3)n2Cc2ccco2)CCCC1	ZINC000450874437	FH	On-Demand	Anodyne	HCRTR2	0	40
C=CCn1c(COc2ccccc2)nnc1SC[C@@H]1CCCC1(F)F	ZINC000450874465	FJ	On-Demand	Mild	VCP	65	41
C=CCn1c(COc2ccccc2)nnc1SC[C@H]1CCCC1(F)F	ZINC000450874466	FJ	On-Demand	Mild	VCP	65	41
CCOC(=O)c1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)ncc1Cl	ZINC000450874482	FF	On-Demand	Anodyne	IKBKB	44	33
CCOC(=O)c1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ncc1Cl	ZINC000450874483	FF	On-Demand	Anodyne	IKBKB	44	33
CCOC(=O)c1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)ncc1Cl	ZINC000450874484	FF	On-Demand	Anodyne	IKBKB	44	33
CCOC(=O)c1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)ncc1Cl	ZINC000450874485	FF	On-Demand	Anodyne	IKBKB	44	33
COc1cc(C(C)=O)c(OC)cc1OC[C@H](Cc1ccccc1)OC	ZINC000450874490	EH	On-Demand	Anodyne	PDS	49	34
COc1cc(C(C)=O)c(OC)cc1OC[C@@H](Cc1ccccc1)OC	ZINC000450874494	EH	On-Demand	Anodyne	PDS	60	35
COc1ccc(CNC(=O)CCN2CC[C@H](CO)[C@@H]2C)c(OC)c1	ZINC000450874495	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CNC(=O)CCN2CC[C@H](CO)[C@@H]2C)c(OC)c1	ZINC000450874495	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2CC[C@@H](CO)[C@H]2C)c(OC)c1	ZINC000450874496	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CNC(=O)CCN2CC[C@@H](CO)[C@H]2C)c(OC)c1	ZINC000450874496	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2CC[C@H](CO)[C@H]2C)c(OC)c1	ZINC000450874497	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CNC(=O)CCN2CC[C@H](CO)[C@H]2C)c(OC)c1	ZINC000450874497	ED	On-Demand	Anodyne	MTNR1A	43	35
COc1ccc(CNC(=O)CCN2CC[C@@H](CO)[C@@H]2C)c(OC)c1	ZINC000450874498	ED	On-Demand	Anodyne	HTR7	22	40
COc1ccc(CNC(=O)CCN2CC[C@@H](CO)[C@@H]2C)c(OC)c1	ZINC000450874498	ED	On-Demand	Anodyne	MTNR1A	43	35
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450874509	GH	On-Demand	Anodyne	SCD1	41	37
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450874509	GH	On-Demand	Anodyne	SCD	37	43
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450874510	GH	On-Demand	Anodyne	SCD1	41	37
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450874510	GH	On-Demand	Anodyne	SCD	37	43
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450874511	GH	On-Demand	Anodyne	SCD1	41	37
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450874511	GH	On-Demand	Anodyne	SCD	37	43
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450874513	GH	On-Demand	Anodyne	SCD1	41	37
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450874513	GH	On-Demand	Anodyne	SCD	37	43
CCOC(=O)c1ccc(CSc2nnc(COc3ccccc3)n2C)nc1	ZINC000450874525	GG	On-Demand	Anodyne	SLC27A1	31	40
CC(F)(F)CCSc1nnc(-c2cccc(Cl)c2)n1Cc1ccco1	ZINC000450874529	GK	On-Demand	Anodyne	HCRTR2	20	43
CS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450874530	FG	On-Demand	Anodyne	PTGS2	19	40
CS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450874530	FG	On-Demand	Anodyne	CACNA1B	51	38
Cn1c(COc2ccccc2)nnc1SC[C@@H]1CCC(F)(F)C1	ZINC000450874537	EH	On-Demand	Anodyne	VCP	65	42
COC(=O)c1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1Cl	ZINC000450874541	GG	On-Demand	Bother	CCR3	29	43
COC(=O)c1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1Cl	ZINC000450874541	GG	On-Demand	Bother	MCHR1	24	42
Cn1c(COc2ccccc2)nnc1SC[C@H]1CCC(F)(F)C1	ZINC000450874543	EH	On-Demand	Anodyne	VCP	65	42
CC1CCN(C(=O)c2ccc(N3CCC[C@]4(CCOC4)C3)nc2)CC1	ZINC000450874545	EF	On-Demand	Anodyne	FASN	28	40
CC1CCN(C(=O)c2ccc(N3CCC[C@@]4(CCOC4)C3)nc2)CC1	ZINC000450874548	EF	On-Demand	Anodyne	FASN	28	40
CC[C@H](CC(F)(F)F)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450874561	CE	On-Demand	Anodyne	PROTEASE	0	45
CC[C@@H](CC(F)(F)F)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450874562	CE	On-Demand	Anodyne	PROTEASE	0	45
CCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450874566	FF	On-Demand	Anodyne	SCD1	70	49
CCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450874566	FF	On-Demand	Anodyne	SCD	57	48
COc1cc(CC(=O)N2CC[C@H](Oc3cccnc3N(C)C)C2)ccc1Cl	ZINC000450874569	GG	On-Demand	Anodyne	OPRK1	40	43
COc1cc(CC(=O)N2CC[C@H](Oc3cccnc3N(C)C)C2)ccc1Cl	ZINC000450874569	GG	On-Demand	Anodyne	UTS2R	22	41
COc1cc(CC(=O)N2CC[C@H](Oc3cccnc3N(C)C)C2)ccc1Cl	ZINC000450874569	GG	On-Demand	Anodyne	SCD	21	40
COc1cc(CC(=O)N2CC[C@@H](Oc3cccnc3N(C)C)C2)ccc1Cl	ZINC000450874571	GG	On-Demand	Anodyne	OPRK1	40	43
COc1cc(CC(=O)N2CC[C@@H](Oc3cccnc3N(C)C)C2)ccc1Cl	ZINC000450874571	GG	On-Demand	Anodyne	UTS2R	22	41
COc1cc(CC(=O)N2CC[C@@H](Oc3cccnc3N(C)C)C2)ccc1Cl	ZINC000450874571	GG	On-Demand	Anodyne	SCD	21	40
COc1cc(CN2CCC[C@@H](c3cc[nH]c(=N)n3)C2)ccc1Cl	ZINC000450874572	EF	On-Demand	Anodyne	SSTR5	49	38
COc1cc(CN2CCC[C@H](c3cc[nH]c(=N)n3)C2)ccc1Cl	ZINC000450874578	EF	On-Demand	Anodyne	SSTR5	49	38
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874579	GG	On-Demand	Anodyne	TRPV1	21	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874579	GG	On-Demand	Anodyne	PRNP	67	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874579	GG	On-Demand	Anodyne	HDAC1	31	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874579	GG	On-Demand	Anodyne	MCHR1	29	52
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874579	GG	On-Demand	Anodyne	SHH	32	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874579	GG	On-Demand	Anodyne	DGAT1	59	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874579	GG	On-Demand	Anodyne	HPGDS	33	41
COC(=O)[C@H]1CNC(=O)CN1CCCC(=O)c1ccccc1	ZINC000450874587	DC	On-Demand	Anodyne	CYP2J2	49	35
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874588	GG	On-Demand	Anodyne	TRPV1	21	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874588	GG	On-Demand	Anodyne	PRNP	67	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874588	GG	On-Demand	Anodyne	HDAC1	31	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874588	GG	On-Demand	Anodyne	MCHR1	29	52
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874588	GG	On-Demand	Anodyne	SHH	32	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874588	GG	On-Demand	Anodyne	DGAT1	59	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874588	GG	On-Demand	Anodyne	HPGDS	33	41
COC(=O)[C@@H]1CNC(=O)CN1CCCC(=O)c1ccccc1	ZINC000450874589	DC	On-Demand	Anodyne	CYP2J2	49	35
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874590	GG	On-Demand	Anodyne	TRPV1	21	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874590	GG	On-Demand	Anodyne	PRNP	67	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874590	GG	On-Demand	Anodyne	HDAC1	31	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874590	GG	On-Demand	Anodyne	MCHR1	29	52
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874590	GG	On-Demand	Anodyne	SHH	32	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874590	GG	On-Demand	Anodyne	DGAT1	59	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874590	GG	On-Demand	Anodyne	HPGDS	33	41
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874592	GG	On-Demand	Anodyne	TRPV1	21	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874592	GG	On-Demand	Anodyne	PRNP	67	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874592	GG	On-Demand	Anodyne	HDAC1	31	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874592	GG	On-Demand	Anodyne	MCHR1	29	52
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874592	GG	On-Demand	Anodyne	SHH	32	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874592	GG	On-Demand	Anodyne	DGAT1	59	40
Cc1ccc(NC(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)cc1	ZINC000450874592	GG	On-Demand	Anodyne	HPGDS	33	41
CC[C@H](CC(F)(F)F)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450874593	EJ	On-Demand	Anodyne	TIMP3	45	32
CC[C@@H](CC(F)(F)F)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450874594	EJ	On-Demand	Anodyne	TIMP3	45	32
O[C@H]([C@@H]1CCN(c2cc(C(F)(F)F)ccn2)C1)C(F)(F)F	ZINC000450874613	DF	On-Demand	Anodyne	LIPG	46	33
O[C@H]([C@H]1CCN(c2cc(C(F)(F)F)ccn2)C1)C(F)(F)F	ZINC000450874615	DF	On-Demand	Anodyne	LIPG	46	33
O[C@@H]([C@@H]1CCN(c2cc(C(F)(F)F)ccn2)C1)C(F)(F)F	ZINC000450874616	DF	On-Demand	Anodyne	LIPG	46	33
O[C@@H]([C@H]1CCN(c2cc(C(F)(F)F)ccn2)C1)C(F)(F)F	ZINC000450874618	DF	On-Demand	Anodyne	LIPG	46	33
CCC[C@@]1(C(=O)OCC)CCCN1Cc1ccn(CC(F)(F)F)n1	ZINC000450874655	EG	On-Demand	Anodyne	SLC12A5	48	33
CCC[C@]1(C(=O)OCC)CCCN1Cc1ccn(CC(F)(F)F)n1	ZINC000450874656	EG	On-Demand	Anodyne	SLC12A5	48	33
NC(=O)c1cc(N2CCC(Cc3cc(F)cc(F)c3)CC2)ccn1	ZINC000450874664	EF	On-Demand	Anodyne	CCR3	40	35
NC(=O)c1cc(N2CCC(Cc3cc(F)cc(F)c3)CC2)ccn1	ZINC000450874664	EF	On-Demand	Anodyne	STAT6	46	38
COC(=O)c1cnc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450874665	EG	On-Demand	Anodyne	CCR3	42	40
O=C(Nc1ccc(Cl)cc1OC(F)F)c1cc2n(n1)CCCC2	ZINC000450874691	EH	On-Demand	Anodyne	CNR1	50	31
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	DRD4	30	46
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	ACHE	20	46
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	LTA4H	18	41
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	HRH3	18	41
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	SIGMAR1	32	50
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	MMP13	15	40
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	ADAM17	16	40
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	FAAH	17	52
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	MMP9	17	40
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	MMP1	16	40
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	MGLL	0	45
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	ABHD6	0	45
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccccc3)CC2)cc1	ZINC000450874747	GF	On-Demand	Anodyne	GPR183	0	40
NC(=O)c1cccc(NC2CCN(C3CCC3)CC2)c1[N+](=O)[O-]	ZINC000450874789	DE	On-Demand	Bother	PARP1	24	44
c1coc(Cn2c(SCc3cn(CC4CC4)nn3)nnc2-c2cccs2)c1	ZINC000450874800	GH	On-Demand	Anodyne	HCRTR2	19	41
C1=C(CSc2nnc(-c3ccccn3)n2Cc2ccco2)CCCC1	ZINC000450874825	FJ	On-Demand	Anodyne	HCRTR2	20	42
C[C@H]1CN(CCN(C)Cc2ccn(CCc3ccccc3)n2)C[C@@H](C)O1	ZINC000450874834	FF	On-Demand	Anodyne	SIGMAR1	22	41
COc1cccc2c1CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450874855	DG	On-Demand	Anodyne	DRD2	36	53
COc1cccc2c1CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450874855	DG	On-Demand	Anodyne	DRD4	50	40
COc1cccc2c1CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450874855	DG	On-Demand	Anodyne	ACHE	24	40
COc1cccc2c1CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450874855	DG	On-Demand	Anodyne	ABCB1	23	43
COc1cccc2c1CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450874855	DG	On-Demand	Anodyne	NOD1	34	47
COc1cccc2c1CCN(Cc1ccc(C(C)=O)cc1)CC2	ZINC000450874855	DG	On-Demand	Anodyne	NOD2	52	47
COc1ccc(-n2c(SCC[C@@H](C)O)nnc2-c2cnccn2)cc1	ZINC000450874875	FF	On-Demand	Anodyne	WNT3A	20	41
COc1ccc(-n2c(SCC[C@H](C)O)nnc2-c2cnccn2)cc1	ZINC000450874876	FF	On-Demand	Anodyne	WNT3A	20	41
N#CC1(CSc2nnc(-c3cccs3)n2Cc2ccco2)CCC1	ZINC000450874877	FI	On-Demand	Mild	HCRTR2	19	41
COc1cc(CC(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)ccc1Cl	ZINC000450874893	GG	On-Demand	Anodyne	OPRK1	23	40
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CCc2cscn2)CC1	ZINC000450874900	GH	On-Demand	Anodyne	CCR2	21	51
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CCc2cscn2)CC1	ZINC000450874900	GH	On-Demand	Anodyne	EPHX2	33	44
CC(=O)c1cccc(CN2CC[C@@](O)(C3CC3)C2)c1	ZINC000450874922	CE	On-Demand	Anodyne	MCHR2	42	32
CC(=O)c1cccc(CN2CC[C@](O)(C3CC3)C2)c1	ZINC000450874924	CE	On-Demand	Anodyne	MCHR2	42	32
CCCN(CCc1cscn1)[C@@H](C)C(=O)Nc1ccccc1C	ZINC000450874931	EH	On-Demand	Anodyne	BMP1	42	34
CCCN(CCc1cscn1)[C@H](C)C(=O)Nc1ccccc1C	ZINC000450874932	EH	On-Demand	Anodyne	BMP1	42	34
CCn1cc([C@H](C)Nc2ccc(S(=O)(=O)NC)cc2F)cn1	ZINC000450874971	EE	On-Demand	Anodyne	TRPV1	60	31
CCn1cc([C@@H](C)Nc2ccc(S(=O)(=O)NC)cc2F)cn1	ZINC000450874972	EE	On-Demand	Anodyne	TRPV1	60	31
Cc1cccnc1OC1CCN(C[C@H]2COCCO2)CC1	ZINC000450874982	CD	On-Demand	Anodyne	SCN5A	43	32
Cc1cccnc1OC1CCN(C[C@@H]2COCCO2)CC1	ZINC000450874983	CD	On-Demand	Anodyne	SCN5A	43	32
O=C1CN(CCc2ccc(Cl)cc2)CN1CC1CC1	ZINC000450875000	CE	On-Demand	Anodyne	CACNA1D	49	44
COc1cccc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nccc12	ZINC000450875002	EF	On-Demand	Anodyne	PDE3A	47	39
COc1cccc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nccc12	ZINC000450875003	EF	On-Demand	Anodyne	PDE3A	47	39
COc1cccc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nccc12	ZINC000450875004	EF	On-Demand	Anodyne	PDE3A	47	39
COc1cccc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nccc12	ZINC000450875005	EF	On-Demand	Anodyne	PDE3A	47	39
O[C@H]([C@H]1CCN(c2ccnc(C3CC3)n2)C1)C(F)(F)F	ZINC000450875010	CE	On-Demand	Anodyne	SORD	51	39
O[C@@H]([C@@H]1CCN(c2ccnc(C3CC3)n2)C1)C(F)(F)F	ZINC000450875011	CE	On-Demand	Anodyne	SORD	51	39
O[C@H]([C@@H]1CCN(c2ccnc(C3CC3)n2)C1)C(F)(F)F	ZINC000450875012	CE	On-Demand	Anodyne	SORD	51	39
O[C@@H]([C@H]1CCN(c2ccnc(C3CC3)n2)C1)C(F)(F)F	ZINC000450875013	CE	On-Demand	Anodyne	SORD	51	39
COC(=O)[C@H]1CS(=O)(=O)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450875021	GC	On-Demand	Anodyne	OPRK1	36	40
COC(=O)[C@@H]1CS(=O)(=O)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450875023	GC	On-Demand	Anodyne	OPRK1	36	40
CC(=O)c1ccc(Br)cc1OCCC[C@@H](C)O	ZINC000450875030	DG	On-Demand	Anodyne	FOLH1	21	42
CC(=O)c1ccc(Br)cc1OCCC[C@H](C)O	ZINC000450875032	DG	On-Demand	Anodyne	FOLH1	21	42
Cc1cnccc1OC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450875060	GH	On-Demand	Anodyne	SCN9A	0	43
Cc1cnccc1OC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450875060	GH	On-Demand	Anodyne	SCN5A	58	38
CCc1nc(C)c(COc2ccc(Br)cc2C#N)o1	ZINC000450875067	DH	On-Demand	Mild	XDH	47	35
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1CC[C@H](C)O	ZINC000450875096	CE	On-Demand	Anodyne	ACE	44	42
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1CC[C@H](C)O	ZINC000450875096	CE	On-Demand	Anodyne	SLC6A1	80	42
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1CC[C@H](C)O	ZINC000450875096	CE	On-Demand	Anodyne	SLC6A3	39	42
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1CC[C@@H](C)O	ZINC000450875098	CE	On-Demand	Anodyne	ACE	44	42
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1CC[C@@H](C)O	ZINC000450875098	CE	On-Demand	Anodyne	SLC6A1	80	42
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1CC[C@@H](C)O	ZINC000450875098	CE	On-Demand	Anodyne	SLC6A3	39	42
C[C@H]1CN(CC(F)(F)F)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450875124	EF	On-Demand	Mild	CXCR3	23	49
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450875126	EF	On-Demand	Mild	CXCR3	23	49
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450875134	FG	On-Demand	Anodyne	SCD	26	41
CCc1cc(CCCN2CCN(C(=O)c3cc4ccccc4s3)CC2)on1	ZINC000450875137	GH	On-Demand	Anodyne	DRD3	15	46
CC[C@H](CC(F)(F)F)C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450875138	FG	On-Demand	Anodyne	SCD	26	41
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450875142	FG	On-Demand	Anodyne	SCD	26	41
CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450875148	FG	On-Demand	Anodyne	SCD	26	41
O=C(COc1c(Cl)cc(Cl)cc1Cl)N1CCn2c(O)nnc2C1	ZINC000450875154	GE	On-Demand	Anodyne	P2RX7	28	44
CC(C)c1nccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)n1	ZINC000450875182	DF	On-Demand	Anodyne	SORD	110	45
CC(C)c1nccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)n1	ZINC000450875184	DF	On-Demand	Anodyne	SORD	110	45
CCO[C@@H]1C[C@H](NC(=O)C2(Cc3cccc(Cl)c3)CC2)[C@H]1OC	ZINC000450875198	EF	On-Demand	Anodyne	TIMP3	57	33
CCO[C@@H]1C[C@@H](NC(=O)C2(Cc3cccc(Cl)c3)CC2)[C@H]1OC	ZINC000450875199	EF	On-Demand	Anodyne	TIMP3	57	33
CCO[C@@H]1C[C@@H](NC(=O)C2(Cc3cccc(Cl)c3)CC2)[C@@H]1OC	ZINC000450875200	EF	On-Demand	Anodyne	TIMP3	57	33
CCO[C@@H]1C[C@H](NC(=O)C2(Cc3cccc(Cl)c3)CC2)[C@@H]1OC	ZINC000450875201	EF	On-Demand	Anodyne	TIMP3	57	33
CCCC[C@@H](NC(=O)c1c(C)cccc1Cl)C(=O)OC	ZINC000450875222	CG	On-Demand	Anodyne	ACAT	0	42
CCCC[C@H](NC(=O)c1c(C)cccc1Cl)C(=O)OC	ZINC000450875224	CG	On-Demand	Anodyne	ACAT	0	42
O=S(=O)(c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCCC1	ZINC000450875248	GD	On-Demand	Anodyne	GCK	60	34
O=S(=O)(c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCCC1	ZINC000450875248	GD	On-Demand	Anodyne	GCKR	54	35
O=S(=O)(c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCCC1	ZINC000450875250	GD	On-Demand	Anodyne	GCK	60	34
O=S(=O)(c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCCC1	ZINC000450875250	GD	On-Demand	Anodyne	GCKR	54	35
O=S(=O)(c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCCC1	ZINC000450875252	GD	On-Demand	Anodyne	GCK	60	34
O=S(=O)(c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCCC1	ZINC000450875252	GD	On-Demand	Anodyne	GCKR	54	35
O=S(=O)(c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCCC1	ZINC000450875255	GD	On-Demand	Anodyne	GCK	60	34
O=S(=O)(c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCCC1	ZINC000450875255	GD	On-Demand	Anodyne	GCKR	54	35
CCC(=O)c1ccc(OCCC(C)(F)F)c(F)c1	ZINC000450875259	CH	On-Demand	Anodyne	THRA	22	50
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875271	EF	On-Demand	Anodyne	ACE	39	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875271	EF	On-Demand	Anodyne	FKBP1A	44	36
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875271	EF	On-Demand	Anodyne	ADAM17	42	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875271	EF	On-Demand	Anodyne	COLA	95	37
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875271	EF	On-Demand	Anodyne	CPT1A	88	35
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875271	EF	On-Demand	Anodyne	PREP	69	36
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875281	EF	On-Demand	Anodyne	ACE	39	40
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875281	EF	On-Demand	Anodyne	FKBP1A	44	36
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875281	EF	On-Demand	Anodyne	ADAM17	42	40
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875281	EF	On-Demand	Anodyne	COLA	95	37
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875281	EF	On-Demand	Anodyne	CPT1A	88	35
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875281	EF	On-Demand	Anodyne	PREP	69	36
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875283	EF	On-Demand	Anodyne	ACE	39	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875283	EF	On-Demand	Anodyne	FKBP1A	44	36
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875283	EF	On-Demand	Anodyne	ADAM17	42	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875283	EF	On-Demand	Anodyne	COLA	95	37
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875283	EF	On-Demand	Anodyne	CPT1A	88	35
CO[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875283	EF	On-Demand	Anodyne	PREP	69	36
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875287	EF	On-Demand	Anodyne	ACE	39	40
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875287	EF	On-Demand	Anodyne	FKBP1A	44	36
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875287	EF	On-Demand	Anodyne	ADAM17	42	40
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875287	EF	On-Demand	Anodyne	COLA	95	37
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875287	EF	On-Demand	Anodyne	CPT1A	88	35
CO[C@H](Cc1ccccc1)C(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875287	EF	On-Demand	Anodyne	PREP	69	36
CCCc1nc(C)c(CSc2nnc(-c3cccc(Cl)c3)n2C)o1	ZINC000450875293	FJ	On-Demand	Anodyne	CACNA1G	33	41
Cc1nccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450875302	CD	On-Demand	Anodyne	SORD	65	40
Cc1nccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450875304	CD	On-Demand	Anodyne	SORD	65	40
Cc1nccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450875307	CD	On-Demand	Anodyne	SORD	65	40
Cc1nccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450875308	CD	On-Demand	Anodyne	SORD	65	40
CC[C@@H](CC#N)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450875309	CG	On-Demand	Mild	CTSL	15	41
CC[C@@H](CC#N)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450875309	CG	On-Demand	Mild	TIMP3	40	32
CC[C@@H](CC#N)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450875309	CG	On-Demand	Mild	CTSV	40	41
CC[C@H](CC#N)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450875325	CG	On-Demand	Mild	CTSL	15	41
CC[C@H](CC#N)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450875325	CG	On-Demand	Mild	TIMP3	40	32
CC[C@H](CC#N)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450875325	CG	On-Demand	Mild	CTSV	40	41
COC1(CO)CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450875350	CD	On-Demand	Anodyne	NPFFR1	48	41
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	FOLH1	31	44
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	CAPN1	26	43
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	CAPN2	57	35
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	ENPEP	55	31
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	MMP1	0	44
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	NPR	32	56
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	F2RL1	41	29
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	METAP2	0	41
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	NOD1	70	34
CCCC[C@@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875360	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	43
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	FOLH1	31	44
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	CAPN1	26	43
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	CAPN2	57	35
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	ENPEP	55	31
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	MMP1	0	44
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	NPR	32	56
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	F2RL1	41	29
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	METAP2	0	41
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	NOD1	70	34
CCCC[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OC	ZINC000450875362	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	43
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	FOLH1	31	44
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	CAPN1	26	43
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	CAPN2	57	35
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	ENPEP	55	31
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	MMP1	0	44
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	NPR	32	56
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	F2RL1	41	29
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	METAP2	0	41
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	NOD1	70	34
CCCC[C@@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875363	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	43
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	FOLH1	31	44
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	CAPN1	26	43
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	CAPN2	57	35
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	ENPEP	55	31
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	MMP1	0	44
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	NPR	32	56
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	F2RL1	41	29
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	METAP2	0	41
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	NOD1	70	34
CCCC[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OC	ZINC000450875365	CF	On-Demand	Anodyne	Q9JN24_ECOLX	0	43
CCc1cc(CCCSc2nnc(-c3cnccn3)n2Cc2ccco2)on1	ZINC000450875385	GH	On-Demand	Anodyne	HCRTR2	0	40
C=CCn1c(COc2ccccc2)nnc1SCC1CC(F)(F)C1	ZINC000450875410	FI	On-Demand	Mild	VCP	49	39
OC[C@H]1CCCN(c2cc(NC[C@H](c3ccccc3)c3nc[nH]n3)ncn2)C1	ZINC000450875411	GE	On-Demand	Anodyne	PRCP	0	41
OC[C@@H]1CCCN(c2cc(NC[C@H](c3ccccc3)c3nc[nH]n3)ncn2)C1	ZINC000450875412	GE	On-Demand	Anodyne	PRCP	0	41
OC[C@H]1CCCN(c2cc(NC[C@@H](c3ccccc3)c3nc[nH]n3)ncn2)C1	ZINC000450875414	GE	On-Demand	Anodyne	PRCP	0	41
OC[C@@H]1CCCN(c2cc(NC[C@@H](c3ccccc3)c3nc[nH]n3)ncn2)C1	ZINC000450875417	GE	On-Demand	Anodyne	PRCP	0	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1SCc1cccnc1	ZINC000450875418	GE	On-Demand	Bother	NAMPT	38	49
CCOc1cc(NC[C@H](c2ccccc2)c2nc[nH]n2)ncn1	ZINC000450875425	DE	On-Demand	Anodyne	FAAH	15	44
CCOc1cc(NC[C@@H](c2ccccc2)c2nc[nH]n2)ncn1	ZINC000450875426	DE	On-Demand	Anodyne	FAAH	15	44
CCC[C@H](O)CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450875436	FG	On-Demand	Anodyne	CCR2	41	55
CCC[C@H](O)CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450875436	FG	On-Demand	Anodyne	EPHX2	28	49
CCC[C@H](O)CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450875436	FG	On-Demand	Anodyne	RHOA	0	40
CCC[C@@H](O)CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450875437	FG	On-Demand	Anodyne	CCR2	41	55
CCC[C@@H](O)CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450875437	FG	On-Demand	Anodyne	EPHX2	28	49
CCC[C@@H](O)CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450875437	FG	On-Demand	Anodyne	RHOA	0	40
COc1ccc(-n2c(SCC[C@@H](C)O)nnc2-c2ccco2)cc1	ZINC000450875440	EG	On-Demand	Anodyne	AXIN2	0	40
COc1ccc(-n2c(SCC[C@H](C)O)nnc2-c2ccco2)cc1	ZINC000450875441	EG	On-Demand	Anodyne	AXIN2	0	40
c1nc(NC2CCN(C3CCC3)CC2)cc(N2CCCC2)n1	ZINC000450875442	DF	On-Demand	Anodyne	HRH4	16	40
CCOc1ccc(-n2c(SCC[C@H](C)O)nnc2-c2ccccn2)cc1	ZINC000450875449	FH	On-Demand	Anodyne	CACNA2D1	65	38
CCOc1ccc(-n2c(SCC[C@@H](C)O)nnc2-c2ccccn2)cc1	ZINC000450875451	FH	On-Demand	Anodyne	CACNA2D1	65	38
Cc1cncc(-c2nc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)no2)c1	ZINC000450875463	GH	On-Demand	Anodyne	HTR2A	17	48
Cc1cncc(-c2nc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)no2)c1	ZINC000450875463	GH	On-Demand	Anodyne	SSTR5	43	43
Cc1cncc(-c2nc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)no2)c1	ZINC000450875463	GH	On-Demand	Anodyne	SLC18A3	28	41
Cc1cncc(-c2nc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)no2)c1	ZINC000450875463	GH	On-Demand	Anodyne	WNT3A	57	37
C=CCn1c(COc2ccccc2)nnc1SCC[C@@H]1CCOC1	ZINC000450875478	EH	On-Demand	Mild	VCP	46	39
C=CCn1c(COc2ccccc2)nnc1SCC[C@H]1CCOC1	ZINC000450875480	EH	On-Demand	Mild	VCP	46	39
COC[C@H](c1ccc(Cl)cc1)N(C)CC[C@@H](C)O	ZINC000450875488	CF	On-Demand	Anodyne	UTS2	41	33
COC[C@@H](c1ccc(Cl)cc1)N(C)CC[C@H](C)O	ZINC000450875489	CF	On-Demand	Anodyne	UTS2	41	33
COC[C@@H](c1ccc(Cl)cc1)N(C)CC[C@@H](C)O	ZINC000450875490	CF	On-Demand	Anodyne	UTS2	41	33
COC[C@H](c1ccc(Cl)cc1)N(C)CC[C@H](C)O	ZINC000450875492	CF	On-Demand	Anodyne	UTS2	41	33
COC(=O)C1(CSc2nnc(-c3ccco3)n2Cc2ccco2)CCCC1	ZINC000450875501	GI	On-Demand	Anodyne	HCRTR2	23	48
CC(C)(C)CC(C)(C)N1CCN(c2ccc(C(=O)NCCO)nn2)CC1	ZINC000450875506	FD	On-Demand	Anodyne	SCD1	65	52
CC(C)(C)CC(C)(C)N1CCN(c2ccc(C(=O)NCCO)nn2)CC1	ZINC000450875506	FD	On-Demand	Anodyne	SCD	53	52
Fc1ccccc1-c1nnc(SCC2CC(F)(F)C2)n1Cc1ccco1	ZINC000450875521	GJ	On-Demand	Anodyne	HCRTR2	22	44
FC1(F)CCCC[C@H]1CSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450875534	GJ	On-Demand	Anodyne	HCRTR2	20	40
FC1(F)CCCC[C@@H]1CSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450875535	GJ	On-Demand	Anodyne	HCRTR2	20	40
COc1cccc2c(NC3CCN(C4CCC4)CC3)nccc12	ZINC000450875539	DH	On-Demand	Anodyne	HRH3	19	45
COc1cccc2c(NC3CCN(C4CCC4)CC3)nccc12	ZINC000450875539	DH	On-Demand	Anodyne	CCR4	25	42
COc1cccc2c(NC3CCN(C4CCC4)CC3)nccc12	ZINC000450875539	DH	On-Demand	Anodyne	EBP	25	44
COc1cccc2c(NC3CCN(C4CCC4)CC3)nccc12	ZINC000450875539	DH	On-Demand	Anodyne	EHMT2	80	38
C[C@H](c1ccccc1)[C@@H](O)CN1C[C@H](O)Cc2ccccc21	ZINC000450875550	CF	On-Demand	Anodyne	ACE	18	42
C[C@H](c1ccccc1)[C@H](O)CN1C[C@@H](O)Cc2ccccc21	ZINC000450875551	CF	On-Demand	Anodyne	ACE	18	42
C[C@H](c1ccccc1)[C@@H](O)CN1C[C@@H](O)Cc2ccccc21	ZINC000450875552	CF	On-Demand	Anodyne	ACE	18	42
C[C@H](c1ccccc1)[C@H](O)CN1C[C@H](O)Cc2ccccc21	ZINC000450875553	CF	On-Demand	Anodyne	ACE	18	42
CCOC(=O)c1cc(NC2CCN(C3CCC3)CC2)ncc1Cl	ZINC000450875561	EG	On-Demand	Anodyne	MAPK9	15	41
O=C(NC1CC1)c1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc12	ZINC000450875593	GF	On-Demand	Anodyne	ACACB	23	46
O=C(NC1CC1)c1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc2ccccc12	ZINC000450875594	GF	On-Demand	Anodyne	ACACB	23	46
O=C(NC1CC1)c1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc2ccccc12	ZINC000450875595	GF	On-Demand	Anodyne	ACACB	23	46
O=C(NC1CC1)c1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc12	ZINC000450875596	GF	On-Demand	Anodyne	ACACB	23	46
CCc1cc(CCCN2CCC(Oc3ncccc3F)CC2)on1	ZINC000450875601	EG	On-Demand	Anodyne	SCN5A	46	36
COc1ccc(NC(=O)Cc2sccc2Br)cc1OC(C)C	ZINC000450875620	GI	On-Demand	Anodyne	ENPP1	78	39
CNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450875631	ED	On-Demand	Bother	TAAR1	33	43
CNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450875632	ED	On-Demand	Bother	TAAR1	33	43
CNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450875633	ED	On-Demand	Bother	TAAR1	33	43
CNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450875634	ED	On-Demand	Bother	TAAR1	33	43
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450875638	GF	On-Demand	Anodyne	GRIN2B	15	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450875639	GF	On-Demand	Anodyne	GRIN2B	15	40
C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450875640	GF	On-Demand	Anodyne	GRIN2B	15	40
C[C@H](OCc1ccc(F)cc1)C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450875641	GF	On-Demand	Anodyne	GRIN2B	15	40
COc1cc(Cn2cnc3c(cnn3C(C)(C)C)c2=O)ccc1Cl	ZINC000450875642	EG	On-Demand	Anodyne	SCD1	0	42
COc1cc(Cn2cnc3c(cnn3C(C)(C)C)c2=O)ccc1Cl	ZINC000450875642	EG	On-Demand	Anodyne	NPBWR1	42	38
COc1cc(Cn2cnc3c(cnn3C(C)(C)C)c2=O)ccc1Cl	ZINC000450875642	EG	On-Demand	Anodyne	Q9M629_MAIZE	51	37
CC(C)(C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1)C1CCC1	ZINC000450875643	FG	On-Demand	Anodyne	SCD	36	41
CC(C)(C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1)C1CCC1	ZINC000450875644	FG	On-Demand	Anodyne	SCD	36	41
CN(CCN1CCC(Oc2cnccn2)CC1)Cc1ccccc1	ZINC000450875650	EE	On-Demand	Anodyne	SIGMAR1	28	40
CC[C@@H](CC(F)(F)F)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450875660	FG	On-Demand	Anodyne	F7	28	40
CC[C@@H](CC(F)(F)F)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450875660	FG	On-Demand	Anodyne	PSBA	0	44
CC[C@H](CC(F)(F)F)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450875661	FG	On-Demand	Anodyne	F7	28	40
CC[C@H](CC(F)(F)F)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450875661	FG	On-Demand	Anodyne	PSBA	0	44
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccc(F)cc1	ZINC000450875677	EG	On-Demand	Anodyne	DRD2	29	44
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccc(F)cc1	ZINC000450875677	EG	On-Demand	Anodyne	DRD1	24	46
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccc(F)cc1	ZINC000450875677	EG	On-Demand	Anodyne	DRD4	23	44
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccc(F)cc1	ZINC000450875677	EG	On-Demand	Anodyne	HTR2A	28	50
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccc(F)cc1	ZINC000450875677	EG	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccc(F)cc1	ZINC000450875677	EG	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccc(F)cc1	ZINC000450875677	EG	On-Demand	Anodyne	CYP2J2	55	39
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccc(F)cc1	ZINC000450875677	EG	On-Demand	Anodyne	AP2S1	0	44
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCCC1	ZINC000450875678	FG	On-Demand	Bother	BCL2L1	78	38
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCCC1	ZINC000450875678	FG	On-Demand	Bother	BCL2	49	33
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCCC1	ZINC000450875678	FG	On-Demand	Bother	L3MBTL1	0	42
COc1ccc(CNC(=O)CCN2C[C@H](O)C(C)(C)C2)c(OC)c1	ZINC000450875681	ED	On-Demand	Anodyne	MTNR1A	55	35
COc1ccc(CNC(=O)CCN2C[C@@H](O)C(C)(C)C2)c(OC)c1	ZINC000450875682	ED	On-Demand	Anodyne	MTNR1A	55	35
O[C@H](Cc1ccccc1)CN1CCOc2ccc(F)cc2C1	ZINC000450875694	DF	On-Demand	Anodyne	VACHT_TETCF	0	40
CN1C(=O)CC[C@@H]1C(=O)Nc1ccc(Cl)cc1OC(F)F	ZINC000450875707	DF	On-Demand	Anodyne	P2RX7	51	48
CN1C(=O)CC[C@H]1C(=O)Nc1ccc(Cl)cc1OC(F)F	ZINC000450875709	DF	On-Demand	Anodyne	P2RX7	51	48
Cc1ncsc1CN(C)C[C@@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450875724	FG	On-Demand	Anodyne	HTR1B	17	46
Cc1ncsc1CN(C)C[C@H]1CCN(CCN(C)Cc2ccccc2)C1	ZINC000450875727	FG	On-Demand	Anodyne	HTR1B	17	46
Cc1ccc(-c2nnc(SCC3(C#N)CCC3)n2Cc2ccco2)cc1	ZINC000450875732	FJ	On-Demand	Mild	HCRTR2	20	40
C=CCn1c(COc2ccccc2)nnc1SCc1cn(CC2CC2)nn1	ZINC000450875740	GG	On-Demand	Mild	VCP	43	38
CC1=CCN(CCNC(=O)c2c(Cl)cc(F)cc2Br)CC1	ZINC000450875792	GH	On-Demand	Anodyne	DRD4	42	33
CC1=CCN(CCNC(=O)c2c(Cl)cc(F)cc2Br)CC1	ZINC000450875792	GH	On-Demand	Anodyne	PLD2	52	34
COC1(CSc2nnc(-c3ccccc3F)n2Cc2ccco2)CCC1	ZINC000450875853	FI	On-Demand	Anodyne	HCRTR2	22	45
O=C(Cc1scnc1-c1ccccc1)N1CCCC[C@H]1c1ccccc1	ZINC000450875854	FK	On-Demand	Anodyne	CPT1A	137	50
O=C(Cc1scnc1-c1ccccc1)N1CCCC[C@H]1c1ccccc1	ZINC000450875854	FK	On-Demand	Anodyne	CPT2	45	38
O=C(Cc1scnc1-c1ccccc1)N1CCCC[C@H]1c1ccccc1	ZINC000450875854	FK	On-Demand	Anodyne	PREP	51	34
O=C(Cc1scnc1-c1ccccc1)N1CCCC[C@H]1c1ccccc1	ZINC000450875854	FK	On-Demand	Anodyne	ABHD6	0	41
O=C(Cc1scnc1-c1ccccc1)N1CCCC[C@@H]1c1ccccc1	ZINC000450875856	FK	On-Demand	Anodyne	CPT1A	137	50
O=C(Cc1scnc1-c1ccccc1)N1CCCC[C@@H]1c1ccccc1	ZINC000450875856	FK	On-Demand	Anodyne	CPT2	45	38
O=C(Cc1scnc1-c1ccccc1)N1CCCC[C@@H]1c1ccccc1	ZINC000450875856	FK	On-Demand	Anodyne	PREP	51	34
O=C(Cc1scnc1-c1ccccc1)N1CCCC[C@@H]1c1ccccc1	ZINC000450875856	FK	On-Demand	Anodyne	ABHD6	0	41
Fc1cc(F)cc(CC2CCN(c3ncnc4[nH]cnc34)CC2)c1	ZINC000450875860	EG	On-Demand	Anodyne	AKT2	20	47
Fc1cc(F)cc(CC2CCN(c3ncnc4[nH]cnc34)CC2)c1	ZINC000450875860	EG	On-Demand	Anodyne	SIRT3	45	34
COc1cc2nc(N3CCC[C@@]4(CCOC4)C3)nc(N)c2cc1OC	ZINC000450875916	EE	On-Demand	Anodyne	ADRA1B	38	52
COc1cc2nc(N3CCC[C@@]4(CCOC4)C3)nc(N)c2cc1OC	ZINC000450875916	EE	On-Demand	Anodyne	EHMT2	50	33
COc1cc2nc(N3CCC[C@]4(CCOC4)C3)nc(N)c2cc1OC	ZINC000450875918	EE	On-Demand	Anodyne	ADRA1B	38	52
COc1cc2nc(N3CCC[C@]4(CCOC4)C3)nc(N)c2cc1OC	ZINC000450875918	EE	On-Demand	Anodyne	EHMT2	50	33
CC(=O)c1cccc(CN2CCC(n3ccc(C)n3)CC2)c1	ZINC000450875952	CG	On-Demand	Anodyne	DRD3	0	46
C=CCOc1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)cc1	ZINC000450875964	EG	On-Demand	Mild	COLA	123	39
C=CCOc1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)cc1	ZINC000450875964	EG	On-Demand	Mild	CPT1A	107	39
C=CCOc1ccc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)cc1	ZINC000450875964	EG	On-Demand	Mild	CPT2	43	33
C=CCOc1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)cc1	ZINC000450875965	EG	On-Demand	Mild	COLA	123	39
C=CCOc1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)cc1	ZINC000450875965	EG	On-Demand	Mild	CPT1A	107	39
C=CCOc1ccc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)cc1	ZINC000450875965	EG	On-Demand	Mild	CPT2	43	33
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450875971	GF	On-Demand	Anodyne	CXCR3	37	48
C[C@H]1CN(CC(F)(F)F)CCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450875983	GF	On-Demand	Anodyne	CXCR3	37	48
CC(C)CCCC(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875984	CG	On-Demand	Anodyne	COLA	63	34
CC(C)CCCC(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450875984	CG	On-Demand	Anodyne	CPT1A	63	34
CC(=O)[C@](C)(O)CN(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450875985	CC	On-Demand	Anodyne	ERG2	17	40
CC(=O)[C@](C)(O)CN(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450875985	CC	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
CC(=O)[C@@](C)(O)CN(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450875986	CC	On-Demand	Anodyne	ERG2	17	40
CC(=O)[C@@](C)(O)CN(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450875986	CC	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
CC(C)CCCC(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875990	CG	On-Demand	Anodyne	COLA	63	34
CC(C)CCCC(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450875990	CG	On-Demand	Anodyne	CPT1A	63	34
Fc1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)cc1	ZINC000450875998	GI	On-Demand	Anodyne	HCRTR2	19	44
Fc1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)cc1	ZINC000450876000	GI	On-Demand	Anodyne	HCRTR2	19	44
CCC(=O)c1ccc(NC2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1	ZINC000450876003	EH	On-Demand	Bother	L3MBTL1	0	44
CCC(=O)c1ccc(NC2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1	ZINC000450876003	EH	On-Demand	Bother	L3MBTL3	58	44
Cn1ccc(CCNC(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450876009	ED	On-Demand	Anodyne	CCKBR	25	41
C[C@H](Sc1nnc(-c2ccco2)n1Cc1ccco1)C(=O)C1CCCCC1	ZINC000450876021	GJ	On-Demand	Anodyne	HCRTR2	21	41
C[C@@H](Sc1nnc(-c2ccco2)n1Cc1ccco1)C(=O)C1CCCCC1	ZINC000450876022	GJ	On-Demand	Anodyne	HCRTR2	21	41
C[C@H]1CCCN(c2cc(NC3CCN(C4CCC4)CC3)ncn2)C1	ZINC000450876023	EG	On-Demand	Anodyne	PRCP	0	42
C[C@H]1CCCN(c2cc(NC3CCN(C4CCC4)CC3)ncn2)C1	ZINC000450876023	EG	On-Demand	Anodyne	HRH4	30	41
C[C@@H]1CCCN(c2cc(NC3CCN(C4CCC4)CC3)ncn2)C1	ZINC000450876024	EG	On-Demand	Anodyne	PRCP	0	42
C[C@@H]1CCCN(c2cc(NC3CCN(C4CCC4)CC3)ncn2)C1	ZINC000450876024	EG	On-Demand	Anodyne	HRH4	30	41
CC(C)C[C@H](C)N1C[C@H](O)Cc2ccccc21	ZINC000450876043	BF	On-Demand	Anodyne	ACE	18	43
CC(C)C[C@H](C)N1C[C@H](O)Cc2ccccc21	ZINC000450876043	BF	On-Demand	Anodyne	TPP2	45	34
CC(C)C[C@H](C)N1C[C@@H](O)Cc2ccccc21	ZINC000450876045	BF	On-Demand	Anodyne	ACE	18	43
CC(C)C[C@H](C)N1C[C@@H](O)Cc2ccccc21	ZINC000450876045	BF	On-Demand	Anodyne	TPP2	45	34
CC(C)C[C@@H](C)N1C[C@@H](O)Cc2ccccc21	ZINC000450876047	BF	On-Demand	Anodyne	ACE	18	43
CC(C)C[C@@H](C)N1C[C@@H](O)Cc2ccccc21	ZINC000450876047	BF	On-Demand	Anodyne	TPP2	45	34
CC(C)C[C@@H](C)N1C[C@H](O)Cc2ccccc21	ZINC000450876049	BF	On-Demand	Anodyne	ACE	18	43
CC(C)C[C@@H](C)N1C[C@H](O)Cc2ccccc21	ZINC000450876049	BF	On-Demand	Anodyne	TPP2	45	34
CCCc1nc(C)c(CN2C(=O)CN(c3cccc(C(=O)OC)c3)C2=O)o1	ZINC000450876058	FF	On-Demand	Anodyne	CTSG	17	41
CCOc1ccc(-n2c(SC[C@H](O)CC#N)nnc2-c2ccco2)cc1	ZINC000450876066	FG	On-Demand	Mild	CACNA2D1	58	36
CCOc1ccc(-n2c(SC[C@H](O)CC#N)nnc2-c2ccco2)cc1	ZINC000450876066	FG	On-Demand	Mild	WNT3A	18	40
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	F2	86	42
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	PLG	44	41
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	PRSS1	32	42
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	ACE	47	39
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	FKBP1A	58	49
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	SSTR2	42	38
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	OPRM1	24	45
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	OPRD1	16	43
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	P2RY12	113	33
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	ELANE	46	38
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	TRHR	49	36
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CMA1	39	41
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CTRA_BOVIN	61	35
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	PRSS3	0	48
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	MMP13	69	45
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	TRY1_BOVIN	111	42
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	NTSR1	100	34
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	NTSR2	60	33
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CTSG	41	35
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CTSK	53	43
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CCR4	0	41
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	ADAM17	48	41
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	ITGA4	76	49
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CAPNS1	25	51
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	MMP2	32	42
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	MMP3	79	45
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	MMP8	34	42
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CELA2A	50	35
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	LGMN	51	35
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CAPN1	39	55
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	MMP9	37	46
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	MMP12	17	40
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	CASP7	41	35
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	TPSAB1	18	48
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	MMP7	83	45
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	MMP1	72	48
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	XIAP	56	40
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	SFRP1	49	33
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	WNT3	49	33
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	BRCA1	51	31
CCCC[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876070	GD	On-Demand	Anodyne	TMPRSS11D	50	34
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	F2	86	42
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	PLG	44	41
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	PRSS1	32	42
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	ACE	47	39
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	FKBP1A	58	49
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	SSTR2	42	38
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	OPRM1	24	45
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	OPRD1	16	43
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	P2RY12	113	33
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	ELANE	46	38
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	TRHR	49	36
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CMA1	39	41
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CTRA_BOVIN	61	35
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	PRSS3	0	48
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	MMP13	69	45
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	TRY1_BOVIN	111	42
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	NTSR1	100	34
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	NTSR2	60	33
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CTSG	41	35
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CTSK	53	43
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CCR4	0	41
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	ADAM17	48	41
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	ITGA4	76	49
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CAPNS1	25	51
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	MMP2	32	42
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	MMP3	79	45
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	MMP8	34	42
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CELA2A	50	35
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	LGMN	51	35
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CAPN1	39	55
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	MMP9	37	46
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	MMP12	17	40
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	CASP7	41	35
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	TPSAB1	18	48
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	MMP7	83	45
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	MMP1	72	48
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	XIAP	56	40
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	SFRP1	49	33
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	WNT3	49	33
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	BRCA1	51	31
CCCC[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OC	ZINC000450876072	GD	On-Demand	Anodyne	TMPRSS11D	50	34
CC(=O)[C@@](C)(O)CN1CCC(Oc2ncccc2C)CC1	ZINC000450876093	CD	On-Demand	Anodyne	SCN5A	44	35
CC(=O)[C@](C)(O)CN1CCC(Oc2ncccc2C)CC1	ZINC000450876095	CD	On-Demand	Anodyne	SCN5A	44	35
CCC(=O)CCCN1C[C@@H](CO)C[C@@H](OCCOC)C1	ZINC000450876108	CD	On-Demand	Anodyne	GBA2	43	30
CCC(=O)CCCN1C[C@@H](OCCOC)C[C@@H](CO)C1	ZINC000450876109	CD	On-Demand	Anodyne	GBA2	43	30
CCC(=O)CCCN1C[C@H](CO)C[C@@H](OCCOC)C1	ZINC000450876110	CD	On-Demand	Anodyne	GBA2	43	30
CCC(=O)CCCN1C[C@@H](CO)C[C@H](OCCOC)C1	ZINC000450876111	CD	On-Demand	Anodyne	GBA2	43	30
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450876114	FH	On-Demand	Anodyne	RBP4	22	55
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450876115	FH	On-Demand	Anodyne	RBP4	22	55
Cn1c(NC2CCN(C3CCC3)CC2)nc2c(F)cccc21	ZINC000450876121	DF	On-Demand	Anodyne	HRH3	16	50
COC(=O)c1csc(CN2C[C@H](O)Cc3ccccc32)n1	ZINC000450876127	DD	On-Demand	Anodyne	TPP2	40	34
COC(=O)c1csc(CN2C[C@@H](O)Cc3ccccc32)n1	ZINC000450876128	DD	On-Demand	Anodyne	TPP2	40	34
O=[N+]([O-])c1ccc2nc(N3CCCC[C@H]3c3nc4ccccc4[nH]3)[nH]c2c1	ZINC000450876132	FI	On-Demand	Bother	PRCP	43	38
O=[N+]([O-])c1ccc2nc(N3CCCC[C@H]3c3nc4ccccc4[nH]3)[nH]c2c1	ZINC000450876132	FI	On-Demand	Bother	KCNN3	37	56
O=[N+]([O-])c1ccc2nc(N3CCCC[C@H]3c3nc4ccccc4[nH]3)[nH]c2c1	ZINC000450876132	FI	On-Demand	Bother	TXN	18	46
O=[N+]([O-])c1ccc2nc(N3CCCC[C@@H]3c3nc4ccccc4[nH]3)[nH]c2c1	ZINC000450876135	FI	On-Demand	Bother	PRCP	43	38
O=[N+]([O-])c1ccc2nc(N3CCCC[C@@H]3c3nc4ccccc4[nH]3)[nH]c2c1	ZINC000450876135	FI	On-Demand	Bother	KCNN3	37	56
O=[N+]([O-])c1ccc2nc(N3CCCC[C@@H]3c3nc4ccccc4[nH]3)[nH]c2c1	ZINC000450876135	FI	On-Demand	Bother	TXN	18	46
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	DRD2	30	42
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	ADRA1D	45	40
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	ADRA1A	43	40
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	ADRA1B	41	40
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	SIGMAR1	30	40
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	CCR1	57	38
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	KCNA3	0	45
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	CYP2J2	50	35
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	NET	0	40
CCC(=O)CCCN1CCC(F)(c2ccccc2)CC1	ZINC000450876140	CH	On-Demand	Anodyne	AP2S1	0	40
O=[N+]([O-])c1ccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450876159	DH	On-Demand	Bother	PRCP	46	39
O=[N+]([O-])c1ccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450876159	DH	On-Demand	Bother	KCNN3	33	46
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450876160	DH	On-Demand	Bother	PRCP	46	39
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450876160	DH	On-Demand	Bother	KCNN3	33	46
O=[N+]([O-])c1cc(Cl)cnc1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450876162	FI	On-Demand	Bother	PRCP	50	47
O=[N+]([O-])c1cc(Cl)cnc1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450876162	FI	On-Demand	Bother	KCNN3	34	44
CCOc1ccc(-n2c(SCC[C@@H]3CCOC3)nnc2-c2ccccn2)cc1	ZINC000450876166	GI	On-Demand	Anodyne	CACNA2D1	58	37
CCOc1ccc(-n2c(SCC[C@H]3CCOC3)nnc2-c2ccccn2)cc1	ZINC000450876167	GI	On-Demand	Anodyne	CACNA2D1	58	37
CCOC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450876178	FG	On-Demand	Anodyne	HTR2A	16	48
CCOC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450876178	FG	On-Demand	Anodyne	SSTR5	49	45
CCOC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450876178	FG	On-Demand	Anodyne	CCR3	15	42
CCOC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450876178	FG	On-Demand	Anodyne	SLC18A3	35	44
CCOC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450876178	FG	On-Demand	Anodyne	WNT3A	63	41
CCOC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)nc1	ZINC000450876178	FG	On-Demand	Anodyne	TNKS2	19	41
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCCC1	ZINC000450876179	FG	On-Demand	Bother	BCL2L1	78	38
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCCC1	ZINC000450876179	FG	On-Demand	Bother	BCL2	49	33
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCCC1	ZINC000450876179	FG	On-Demand	Bother	L3MBTL1	0	42
O=C(c1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450876218	GF	On-Demand	Bother	L3MBTL1	0	42
O=C(c1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450876218	GF	On-Demand	Bother	L3MBTL3	28	42
O=C(c1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450876219	GF	On-Demand	Bother	L3MBTL1	0	42
O=C(c1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450876219	GF	On-Demand	Bother	L3MBTL3	28	42
O=C(c1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450876220	GF	On-Demand	Bother	L3MBTL1	0	42
O=C(c1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450876220	GF	On-Demand	Bother	L3MBTL3	28	42
O=C(c1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450876221	GF	On-Demand	Bother	L3MBTL1	0	42
O=C(c1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450876221	GF	On-Demand	Bother	L3MBTL3	28	42
CN(CCN1CCC(Oc2ncccc2F)CC1)Cc1ccccc1	ZINC000450876222	EG	On-Demand	Anodyne	HTR4	24	41
CN(CCN1CCC(Oc2ncccc2F)CC1)Cc1ccccc1	ZINC000450876222	EG	On-Demand	Anodyne	SCN9A	0	45
CN(CCN1CCC(Oc2ncccc2F)CC1)Cc1ccccc1	ZINC000450876222	EG	On-Demand	Anodyne	SCN5A	84	45
CNC(=O)c1cccnc1N1CC(c2cccc(C(F)(F)F)c2)C1	ZINC000450876225	EG	On-Demand	Anodyne	TRPV1	25	41
CC(=O)CCCCCSc1nnc(-c2ccc(C)cc2)n1Cc1ccco1	ZINC000450876272	GK	On-Demand	Anodyne	HCRTR2	24	47
COC(=O)c1cc(C)nc(N2CC(c3cccc(C(F)(F)F)c3)C2)c1[N+](=O)[O-]	ZINC000450876284	GH	On-Demand	Bother	CACNA1C	40	38
COC(=O)c1cc(C)nc(N2CC(c3cccc(C(F)(F)F)c3)C2)c1[N+](=O)[O-]	ZINC000450876284	GH	On-Demand	Bother	CACNA1D	65	38
COC1(CSc2nnc(-c3ccc(C)cc3)n2Cc2ccco2)CCC1	ZINC000450876291	FJ	On-Demand	Anodyne	HCRTR2	21	43
COc1cc(CN2C(=O)C(=O)N(CCCN3CCOCC3)C2=O)ccc1Cl	ZINC000450876301	GD	On-Demand	Anodyne	HTR4	25	42
COc1cc(CN2C(=O)C(=O)N(CCCN3CCOCC3)C2=O)ccc1Cl	ZINC000450876301	GD	On-Demand	Anodyne	SIGMAR1	22	43
COc1cc(CN2C(=O)C(=O)N(CCCN3CCOCC3)C2=O)ccc1Cl	ZINC000450876301	GD	On-Demand	Anodyne	SRC	42	39
Cc1nc(NC2(Cc3cccc(Cl)c3)CC2)ncc1[N+](=O)[O-]	ZINC000450876324	DH	On-Demand	Bother	PRKCQ	44	46
Cc1ccc(-c2nnc(S[C@H]3C[C@H](C)CCC3=O)n2Cc2ccco2)cc1	ZINC000450876327	GJ	On-Demand	Anodyne	HCRTR2	17	41
Cc1ccc(-c2nnc(S[C@@H]3C[C@H](C)CCC3=O)n2Cc2ccco2)cc1	ZINC000450876328	GJ	On-Demand	Anodyne	HCRTR2	17	41
Cc1ccc(-c2nnc(S[C@@H]3C[C@@H](C)CCC3=O)n2Cc2ccco2)cc1	ZINC000450876329	GJ	On-Demand	Anodyne	HCRTR2	17	41
Cc1ccc(-c2nnc(S[C@H]3C[C@@H](C)CCC3=O)n2Cc2ccco2)cc1	ZINC000450876330	GJ	On-Demand	Anodyne	HCRTR2	17	41
COC1(CSc2nnc(-c3cnccn3)n2Cc2ccco2)CCC1	ZINC000450876331	FG	On-Demand	Anodyne	HCRTR2	19	40
N#CC1(CSc2nnc(-c3ccccc3F)n2Cc2ccco2)CCC1	ZINC000450876346	FJ	On-Demand	Mild	HCRTR2	20	42
CCS(=O)(=O)c1ccc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1	ZINC000450876351	GF	On-Demand	Anodyne	ACHE	15	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cc1	ZINC000450876352	GF	On-Demand	Anodyne	ACHE	15	40
N#Cc1ccc(NC2CCN(C3CCC3)CC2)cc1C(F)(F)F	ZINC000450876370	DI	On-Demand	Mild	AR	56	48
Cn1c(COc2ccccc2)nnc1SC[C@H]1CCCC1(F)F	ZINC000450876406	EH	On-Demand	Anodyne	VCP	73	44
Cn1c(COc2ccccc2)nnc1SC[C@@H]1CCCC1(F)F	ZINC000450876407	EH	On-Demand	Anodyne	VCP	73	44
Cn1ccc([C@@H](NC(=O)CCCC(=O)C2CC2)c2ccc(Cl)cc2)n1	ZINC000450876426	FG	On-Demand	Anodyne	PRCP	20	43
Cn1ccc([C@H](NC(=O)CCCC(=O)C2CC2)c2ccc(Cl)cc2)n1	ZINC000450876427	FG	On-Demand	Anodyne	PRCP	20	43
Fc1cc(F)cc(CC2CCN(c3ncccn3)CC2)c1	ZINC000450876433	CG	On-Demand	Anodyne	DRD4	16	47
CCS(=O)(=O)c1ccc(CN(CCC(F)(F)F)CC(F)(F)F)cc1	ZINC000450876446	GH	On-Demand	Anodyne	RORC	20	43
c1nc(N2CCC[C@]3(CCOC3)C2)c2c3c(sc2n1)CCC3	ZINC000450876448	DG	On-Demand	Anodyne	RBP4	18	45
c1nc(N2CCC[C@@]3(CCOC3)C2)c2c3c(sc2n1)CCC3	ZINC000450876449	DG	On-Demand	Anodyne	RBP4	18	45
C=CCOc1ccc(-c2nnc(SCc3oc(C(C)C)nc3C)o2)cc1	ZINC000450876458	FK	On-Demand	Mild	GSK3B	15	47
C=CCOc1ccc(-c2nnc(SCc3oc(C(C)C)nc3C)o2)cc1	ZINC000450876458	FK	On-Demand	Mild	GSK3A	36	41
COc1cc(CC(=O)N2CCO[C@H](c3ccnc(N(C)C)n3)C2)ccc1Cl	ZINC000450876478	GE	On-Demand	Anodyne	OPRK1	40	42
COc1cc(CC(=O)N2CCO[C@@H](c3ccnc(N(C)C)n3)C2)ccc1Cl	ZINC000450876481	GE	On-Demand	Anodyne	OPRK1	40	42
COc1cc(CN2CCC[C@@]3(C2)NC(=O)NC3=O)ccc1Cl	ZINC000450876495	DD	On-Demand	Anodyne	PDE7A	27	44
COc1cc(CN2CCC[C@]3(C2)NC(=O)NC3=O)ccc1Cl	ZINC000450876497	DD	On-Demand	Anodyne	PDE7A	27	44
CCCOc1cccc(CSCCN(C)C)c1	ZINC000450876518	CG	On-Demand	Anodyne	THRA	0	42
CCS(=O)(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450876527	EF	On-Demand	Anodyne	DRD4	45	40
CCS(=O)(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450876527	EF	On-Demand	Anodyne	HRH1	0	45
CCS(=O)(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450876527	EF	On-Demand	Anodyne	AVPR1B	41	34
CCS(=O)(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450876527	EF	On-Demand	Anodyne	SSTR5	42	34
CCS(=O)(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450876527	EF	On-Demand	Anodyne	CCR3	24	44
CCS(=O)(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450876527	EF	On-Demand	Anodyne	UTS2R	27	42
CCS(=O)(=O)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450876527	EF	On-Demand	Anodyne	MCHR1	24	44
CCn1c(COc2ccc(C)cc2)nnc1SC1CC(OC(C)(C)C)C1	ZINC000450876581	GJ	On-Demand	Anodyne	VCP	72	44
COc1ccc2nc(C)nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450876665	EF	On-Demand	Anodyne	PDE3A	45	39
COc1ccc2nc(C)nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450876665	EF	On-Demand	Anodyne	PDE3B	65	39
COc1ccc2nc(C)nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450876666	EF	On-Demand	Anodyne	PDE3A	45	39
COc1ccc2nc(C)nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450876666	EF	On-Demand	Anodyne	PDE3B	65	39
COc1ccc2nc(C)nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450876668	EF	On-Demand	Anodyne	PDE3A	45	39
COc1ccc2nc(C)nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450876668	EF	On-Demand	Anodyne	PDE3B	65	39
O=[N+]([O-])c1cc(Cl)cnc1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450876669	FI	On-Demand	Bother	PRCP	50	47
O=[N+]([O-])c1cc(Cl)cnc1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450876669	FI	On-Demand	Bother	KCNN3	34	44
COc1ccc2nc(C)nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450876671	EF	On-Demand	Anodyne	PDE3A	45	39
COc1ccc2nc(C)nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450876671	EF	On-Demand	Anodyne	PDE3B	65	39
COCCOC[C@H](O)CN1CC[C@](C)(c2ccc(C)cc2)C1	ZINC000450876673	DD	On-Demand	Anodyne	HSP90AB1	36	42
COc1cccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450876677	EF	On-Demand	Bother	ADRA1D	41	40
COc1cccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450876677	EF	On-Demand	Bother	ADRA1A	33	40
COc1cccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450876677	EF	On-Demand	Bother	ADRA1B	28	40
COc1cccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000450876679	EF	On-Demand	Bother	ADRA1D	41	40
COc1cccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000450876679	EF	On-Demand	Bother	ADRA1A	33	40
COc1cccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000450876679	EF	On-Demand	Bother	ADRA1B	28	40
COCCOC[C@H](O)CN1CC[C@@](C)(c2ccc(C)cc2)C1	ZINC000450876684	DD	On-Demand	Anodyne	HSP90AB1	36	42
O[C@@H]([C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876686	GI	On-Demand	Anodyne	ADRB2	21	53
O[C@@H]([C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876686	GI	On-Demand	Anodyne	ADRB1	15	55
O[C@@H]([C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876686	GI	On-Demand	Anodyne	ADRB3	21	57
COCCOC[C@@H](O)CN1CC[C@](C)(c2ccc(C)cc2)C1	ZINC000450876687	DD	On-Demand	Anodyne	HSP90AB1	36	42
COCCOC[C@@H](O)CN1CC[C@@](C)(c2ccc(C)cc2)C1	ZINC000450876689	DD	On-Demand	Anodyne	HSP90AB1	36	42
O[C@H]([C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876690	GI	On-Demand	Anodyne	ADRB2	21	53
O[C@H]([C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876690	GI	On-Demand	Anodyne	ADRB1	15	55
O[C@H]([C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876690	GI	On-Demand	Anodyne	ADRB3	21	57
CCC[C@H](O)CN1CCC(F)(c2ccccc2)CC1	ZINC000450876692	CG	On-Demand	Anodyne	ABCB1	30	44
CCC[C@@H](O)CN1CCC(F)(c2ccccc2)CC1	ZINC000450876693	CG	On-Demand	Anodyne	ABCB1	30	44
O[C@H]([C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876694	GI	On-Demand	Anodyne	ADRB2	21	53
O[C@H]([C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876694	GI	On-Demand	Anodyne	ADRB1	15	55
O[C@H]([C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876694	GI	On-Demand	Anodyne	ADRB3	21	57
COCc1nc(OC)cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450876695	FG	On-Demand	Anodyne	PRCP	27	40
COCc1nc(OC)cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450876695	FG	On-Demand	Anodyne	KCNN3	35	45
O[C@@H]([C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876697	GI	On-Demand	Anodyne	ADRB2	21	53
O[C@@H]([C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876697	GI	On-Demand	Anodyne	ADRB1	15	55
O[C@@H]([C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1)C(F)(F)F	ZINC000450876697	GI	On-Demand	Anodyne	ADRB3	21	57
COCc1nc(OC)cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450876698	FG	On-Demand	Anodyne	PRCP	27	40
COCc1nc(OC)cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450876698	FG	On-Demand	Anodyne	KCNN3	35	45
N#C[C@@H]1CC[C@H](Sc2nnc(COc3ccccc3)n2-c2ccccc2)C1	ZINC000450876699	GJ	On-Demand	Mild	VCP	104	69
N#C[C@H]1CC[C@H](Sc2nnc(COc3ccccc3)n2-c2ccccc2)C1	ZINC000450876702	GJ	On-Demand	Mild	VCP	104	69
N#C[C@H]1CC[C@@H](Sc2nnc(COc3ccccc3)n2-c2ccccc2)C1	ZINC000450876704	GJ	On-Demand	Mild	VCP	104	69
N#C[C@@H]1CC[C@@H](Sc2nnc(COc3ccccc3)n2-c2ccccc2)C1	ZINC000450876705	GJ	On-Demand	Mild	VCP	104	69
c1ccc(-c2nnc(SC[C@@H]3COCCO3)n2Cc2ccco2)nc1	ZINC000450876713	FE	On-Demand	Anodyne	HCRTR2	20	40
c1ccc(-c2nnc(SC[C@H]3COCCO3)n2Cc2ccco2)nc1	ZINC000450876714	FE	On-Demand	Anodyne	HCRTR2	20	40
CCn1c(SC[C@H]2CCCC2(F)F)nnc1-c1ccc([N+](=O)[O-])cc1	ZINC000450876720	FI	On-Demand	Bother	SLC27A4	49	32
CCn1c(SC[C@@H]2CCCC2(F)F)nnc1-c1ccc([N+](=O)[O-])cc1	ZINC000450876722	FI	On-Demand	Bother	SLC27A4	49	32
C[C@@H](O)CCN1CCC(F)(c2ccccc2)CC1	ZINC000450876724	CF	On-Demand	Anodyne	OPRL1	26	51
C[C@H](O)CCN1CCC(F)(c2ccccc2)CC1	ZINC000450876729	CF	On-Demand	Anodyne	OPRL1	26	51
CCn1c(COc2ccc(C)cc2)nnc1SCc1ccc(C(C)=O)cc1	ZINC000450876740	GJ	On-Demand	Anodyne	VCP	26	41
CCn1c(COc2ccc(C)cc2)nnc1SCc1ccc(C(C)=O)cc1	ZINC000450876740	GJ	On-Demand	Anodyne	SLC27A1	40	36
COc1cc(CN2CCN3C(=O)N(CC(C)C)C[C@@H]3C2)ccc1Cl	ZINC000450876741	FF	On-Demand	Anodyne	CCR1	24	41
COc1cc(CN2CCN3C(=O)N(CC(C)C)C[C@H]3C2)ccc1Cl	ZINC000450876742	FF	On-Demand	Anodyne	CCR1	24	41
CCn1nnc(C)c1CSc1nnc(-c2ccc(F)cc2)n1Cc1ccco1	ZINC000450876755	GH	On-Demand	Anodyne	HCRTR2	20	46
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	DRD2	43	62
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	DRD1	27	57
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	DRD4	30	60
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	HTR2A	27	69
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	ADRA1A	26	44
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	ADRA1B	22	55
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	DRD3	0	60
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	ERG2	28	60
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	HTR7	23	60
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	SLC18A3	28	67
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	HTR3B	0	46
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	PLD2	56	36
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	CYP2J2	56	40
CN1CCC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000450876769	EF	On-Demand	Anodyne	AP2S1	0	60
O=C(c1ccc(NC2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450876787	GE	On-Demand	Bother	HRH3	27	47
O=C(c1ccc(NC2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450876787	GE	On-Demand	Bother	L3MBTL1	0	53
O=C(c1ccc(NC2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450876787	GE	On-Demand	Bother	L3MBTL3	88	53
CCCC[C@@H](NC(=O)CNS(=O)(=O)NC)C(=O)OC	ZINC000450876794	CA	On-Demand	Anodyne	NOD1	91	38
CCCC[C@H](NC(=O)CNS(=O)(=O)NC)C(=O)OC	ZINC000450876798	CA	On-Demand	Anodyne	NOD1	91	38
CC(=O)c1cccc(CN2CCC3(CC2)CCN(C)C3=O)c1	ZINC000450876800	DE	On-Demand	Anodyne	MCHR2	41	35
CC(=O)c1cccc(CN2CCC3(CC2)CCN(C)C3=O)c1	ZINC000450876800	DE	On-Demand	Anodyne	NPFFR1	42	34
FC(F)(F)c1cccc(C2CN(c3cc(C(F)(F)F)nc4ncnn34)C2)c1	ZINC000450876802	GH	On-Demand	Anodyne	DHOD	0	46
COc1cc(CN2CCC(C)(C)S(=O)(=O)CC2)ccc1Cl	ZINC000450876805	EF	On-Demand	Anodyne	MCHR2	40	30
CCS(=O)(=O)c1ccc(CN[C@@H](c2ccccc2)C(C)(C)CO)cc1	ZINC000450876810	FG	On-Demand	Anodyne	RORC	44	39
CCS(=O)(=O)c1ccc(CN[C@H](c2ccccc2)C(C)(C)CO)cc1	ZINC000450876811	FG	On-Demand	Anodyne	RORC	44	39
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000450876812	EH	On-Demand	Mild	AR	23	51
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000450876813	EH	On-Demand	Mild	AR	23	51
CCn1nnc(C)c1CSc1nnc(-c2ccccc2F)n1Cc1ccco1	ZINC000450876818	GH	On-Demand	Anodyne	HCRTR2	21	43
C[C@H]1CN(CC(F)(F)F)CCN(c2ncccc2C(F)(F)F)C1	ZINC000450876821	EG	On-Demand	Anodyne	TRPV1	33	48
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncccc2C(F)(F)F)C1	ZINC000450876823	EG	On-Demand	Anodyne	TRPV1	33	48
COc1nc(C)cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450876845	DG	On-Demand	Anodyne	PRCP	50	41
COc1nc(C)cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450876845	DG	On-Demand	Anodyne	KCNN3	35	47
COc1nc(C)cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450876848	DG	On-Demand	Anodyne	PRCP	50	41
COc1nc(C)cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450876848	DG	On-Demand	Anodyne	KCNN3	35	47
CCOc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2cnccn2)cc1	ZINC000450876849	GI	On-Demand	Anodyne	CACNA2D1	62	38
CCOc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2cnccn2)cc1	ZINC000450876849	GI	On-Demand	Anodyne	WNT3A	19	43
COCCO[C@@H]1C[C@@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876850	FE	On-Demand	Anodyne	DRD2	28	40
COCCO[C@@H]1C[C@@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876850	FE	On-Demand	Anodyne	HTR2A	17	44
COCCO[C@@H]1C[C@@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876850	FE	On-Demand	Anodyne	ERG2	18	40
COCCO[C@@H]1C[C@@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876850	FE	On-Demand	Anodyne	CYP2J2	47	33
COCCO[C@@H]1C[C@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876852	FE	On-Demand	Anodyne	DRD2	28	40
COCCO[C@@H]1C[C@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876852	FE	On-Demand	Anodyne	HTR2A	17	44
COCCO[C@@H]1C[C@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876852	FE	On-Demand	Anodyne	ERG2	18	40
COCCO[C@@H]1C[C@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876852	FE	On-Demand	Anodyne	CYP2J2	47	33
COCCO[C@H]1C[C@@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876853	FE	On-Demand	Anodyne	DRD2	28	40
COCCO[C@H]1C[C@@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876853	FE	On-Demand	Anodyne	HTR2A	17	44
COCCO[C@H]1C[C@@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876853	FE	On-Demand	Anodyne	ERG2	18	40
COCCO[C@H]1C[C@@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876853	FE	On-Demand	Anodyne	CYP2J2	47	33
COCCO[C@H]1C[C@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876854	FE	On-Demand	Anodyne	DRD2	28	40
COCCO[C@H]1C[C@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876854	FE	On-Demand	Anodyne	HTR2A	17	44
COCCO[C@H]1C[C@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876854	FE	On-Demand	Anodyne	ERG2	18	40
COCCO[C@H]1C[C@H](CO)CN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450876854	FE	On-Demand	Anodyne	CYP2J2	47	33
CC(F)(F)CCn1cnc2c(cnn2C(C)(C)C)c1=O	ZINC000450876866	CE	On-Demand	Anodyne	Q9M629_MAIZE	54	32
CCCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450876874	ED	On-Demand	Anodyne	MCHR1	0	42
CCCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450876874	ED	On-Demand	Anodyne	SCD1	29	47
CCCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450876874	ED	On-Demand	Anodyne	HPGDS	33	45
CCCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450876876	ED	On-Demand	Anodyne	MCHR1	0	42
CCCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450876876	ED	On-Demand	Anodyne	SCD1	29	47
CCCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450876876	ED	On-Demand	Anodyne	HPGDS	33	45
CCCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450876878	ED	On-Demand	Anodyne	MCHR1	0	42
CCCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450876878	ED	On-Demand	Anodyne	SCD1	29	47
CCCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450876878	ED	On-Demand	Anodyne	HPGDS	33	45
CCCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450876880	ED	On-Demand	Anodyne	MCHR1	0	42
CCCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450876880	ED	On-Demand	Anodyne	SCD1	29	47
CCCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450876880	ED	On-Demand	Anodyne	HPGDS	33	45
CCc1cc(N2CC(c3cccc(C(F)(F)F)c3)C2)n2ncnc2n1	ZINC000450876900	EG	On-Demand	Anodyne	DHOD	0	48
CCCNC(=O)c1ccc(NC[C@@H](c2ccccc2)c2nc[nH]n2)nc1	ZINC000450876910	FF	On-Demand	Anodyne	EPHX2	0	45
C[C@H]1CN(CC(F)(F)F)CCN(c2ncccc2Cl)C1	ZINC000450876912	DG	On-Demand	Anodyne	TRPV1	19	43
CCCNC(=O)c1ccc(NC[C@H](c2ccccc2)c2nc[nH]n2)nc1	ZINC000450876913	FF	On-Demand	Anodyne	EPHX2	0	45
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncccc2Cl)C1	ZINC000450876914	DG	On-Demand	Anodyne	TRPV1	19	43
CC(=O)c1cccc(CN2CCN(c3cccc4cnccc34)C[C@@H]2C)c1	ZINC000450876925	FI	On-Demand	Anodyne	HTR1A	15	42
CC(=O)c1cccc(CN2CCN(c3cccc4cnccc34)C[C@@H]2C)c1	ZINC000450876925	FI	On-Demand	Anodyne	P2RX7	28	41
CCC[C@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000450876926	CE	On-Demand	Anodyne	ADRB2	0	40
CC(=O)c1cccc(CN2CCN(c3cccc4cnccc34)C[C@H]2C)c1	ZINC000450876927	FI	On-Demand	Anodyne	HTR1A	15	42
CC(=O)c1cccc(CN2CCN(c3cccc4cnccc34)C[C@H]2C)c1	ZINC000450876927	FI	On-Demand	Anodyne	P2RX7	28	41
CCC[C@@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000450876928	CE	On-Demand	Anodyne	ADRB2	0	40
Cc1sc2ncnc(NC3CCN(C4CCC4)CC3)c2c1C	ZINC000450876963	DH	On-Demand	Anodyne	IRAK4	18	48
C=CCOc1ccc(-c2nnc(SCc3cc(C(C)(C)C)on3)o2)cc1	ZINC000450876997	FJ	On-Demand	Mild	GSK3B	17	43
C=CCOc1ccc(-c2nnc(SCc3cc(C(C)(C)C)on3)o2)cc1	ZINC000450876997	FJ	On-Demand	Mild	GSK3A	49	42
c1ccc(-c2nsc(N3CCC[C@]4(CCOC4)C3)n2)cc1	ZINC000450877000	DG	On-Demand	Anodyne	FAAH	15	42
c1ccc(-c2nsc(N3CCC[C@@]4(CCOC4)C3)n2)cc1	ZINC000450877001	DG	On-Demand	Anodyne	FAAH	15	42
CS(=O)(=O)c1ccc(N2CCC[C@]3(CCOC3)C2)c(C(F)(F)F)c1	ZINC000450877004	FG	On-Demand	Anodyne	SLC6A9	21	40
CS(=O)(=O)c1ccc(N2CCC[C@@]3(CCOC3)C2)c(C(F)(F)F)c1	ZINC000450877005	FG	On-Demand	Anodyne	SLC6A9	21	40
COc1cc2c(N3CCC[C@]4(CCOC4)C3)ncnc2cc1F	ZINC000450877009	DF	On-Demand	Anodyne	PDE3A	49	38
COc1cc2c(N3CCC[C@]4(CCOC4)C3)ncnc2cc1F	ZINC000450877009	DF	On-Demand	Anodyne	PDGFRB	58	39
COc1cc2c(N3CCC[C@]4(CCOC4)C3)ncnc2cc1F	ZINC000450877009	DF	On-Demand	Anodyne	PDE3B	72	38
COc1cc2c(N3CCC[C@@]4(CCOC4)C3)ncnc2cc1F	ZINC000450877010	DF	On-Demand	Anodyne	PDE3A	49	38
COc1cc2c(N3CCC[C@@]4(CCOC4)C3)ncnc2cc1F	ZINC000450877010	DF	On-Demand	Anodyne	PDGFRB	58	39
COc1cc2c(N3CCC[C@@]4(CCOC4)C3)ncnc2cc1F	ZINC000450877010	DF	On-Demand	Anodyne	PDE3B	72	38
Cc1ccc(C(=O)NC[C@@]2(O)CCN(C)C2)c(C(C)C)n1	ZINC000450877011	CD	On-Demand	Anodyne	HCN1	56	34
Cc1ccc(C(=O)NC[C@]2(O)CCN(C)C2)c(C(C)C)n1	ZINC000450877012	CD	On-Demand	Anodyne	HCN1	56	34
CN1CCN(c2nc3ccccc3nc2N2CCC[C@]3(CCOC3)C2)CC1	ZINC000450877045	FE	On-Demand	Anodyne	HTR3A	25	47
CN1CCN(c2nc3ccccc3nc2N2CCC[C@]3(CCOC3)C2)CC1	ZINC000450877045	FE	On-Demand	Anodyne	HRH4	25	47
CN1CCN(c2nc3ccccc3nc2N2CCC[C@@]3(CCOC3)C2)CC1	ZINC000450877046	FE	On-Demand	Anodyne	HTR3A	25	47
CN1CCN(c2nc3ccccc3nc2N2CCC[C@@]3(CCOC3)C2)CC1	ZINC000450877046	FE	On-Demand	Anodyne	HRH4	25	47
CC(F)(F)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2)c1=O	ZINC000450877058	FG	On-Demand	Anodyne	PKM	24	43
CC(F)(F)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2)c1=O	ZINC000450877058	FG	On-Demand	Anodyne	Q9M629_MAIZE	56	33
O=C(CCCN1CCOc2c(F)cccc2C1)c1ccccc1	ZINC000450877067	DH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCOc2c(F)cccc2C1)c1ccccc1	ZINC000450877067	DH	On-Demand	Anodyne	DRD4	15	47
O=C(CCCN1CCOc2c(F)cccc2C1)c1ccccc1	ZINC000450877067	DH	On-Demand	Anodyne	HTR2A	22	47
O=C(CCCN1CCOc2c(F)cccc2C1)c1ccccc1	ZINC000450877067	DH	On-Demand	Anodyne	HTR2C	22	47
O=C(CCCN1CCOc2c(F)cccc2C1)c1ccccc1	ZINC000450877067	DH	On-Demand	Anodyne	HTR7	15	42
O=C(CCCN1CCOc2c(F)cccc2C1)c1ccccc1	ZINC000450877067	DH	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCOc2c(F)cccc2C1)c1ccccc1	ZINC000450877067	DH	On-Demand	Anodyne	CYP2J2	56	40
Cn1cc([C@H]2CCCCN2C(=O)c2cc(Cl)c3ccccc3n2)cn1	ZINC000450877094	FH	On-Demand	Anodyne	COLA	73	33
Cn1cc([C@H]2CCCCN2C(=O)c2cc(Cl)c3ccccc3n2)cn1	ZINC000450877094	FH	On-Demand	Anodyne	CPT1A	48	33
Cn1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)c3ccccc3n2)cn1	ZINC000450877095	FH	On-Demand	Anodyne	COLA	73	33
Cn1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)c3ccccc3n2)cn1	ZINC000450877095	FH	On-Demand	Anodyne	CPT1A	48	33
Cc1ccc(Br)cc1CC(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450877106	GH	On-Demand	Anodyne	COLA	56	35
Cc1ccc(Br)cc1CC(=O)N1CCCC[C@H]1c1cnn(C)c1	ZINC000450877106	GH	On-Demand	Anodyne	CPT1A	54	35
Cc1ccc(Br)cc1CC(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450877107	GH	On-Demand	Anodyne	COLA	56	35
Cc1ccc(Br)cc1CC(=O)N1CCCC[C@@H]1c1cnn(C)c1	ZINC000450877107	GH	On-Demand	Anodyne	CPT1A	54	35
COc1ccc(C(=O)N2CCCC[C@H]2c2cnn(C)c2)cc1S(C)(=O)=O	ZINC000450877108	GE	On-Demand	Anodyne	L3MBTL3	49	33
COc1ccc(C(=O)N2CCCC[C@@H]2c2cnn(C)c2)cc1S(C)(=O)=O	ZINC000450877109	GE	On-Demand	Anodyne	L3MBTL3	49	33
Cn1ncc2c(=O)n(CCCCc3ccc(Cl)c(Cl)c3)nnc21	ZINC000450877114	FF	On-Demand	Anodyne	Q9M629_MAIZE	72	43
CC(C)(C)O[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@@H]1n1cccn1	ZINC000450877128	ED	On-Demand	Bother	PRKCQ	45	36
CC(C)(C)O[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@H]1n1cccn1	ZINC000450877129	ED	On-Demand	Bother	PRKCQ	45	36
CC(C)(C)O[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@@H]1n1cccn1	ZINC000450877130	ED	On-Demand	Bother	PRKCQ	45	36
CC(C)(C)O[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@H]1n1cccn1	ZINC000450877131	ED	On-Demand	Bother	PRKCQ	45	36
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c1	ZINC000450877204	EE	On-Demand	Bother	TAAR1	22	41
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c1	ZINC000450877205	EE	On-Demand	Bother	TAAR1	22	41
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c1	ZINC000450877206	EE	On-Demand	Bother	TAAR1	22	41
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c1	ZINC000450877207	EE	On-Demand	Bother	TAAR1	22	41
CO[C@H](Cc1ccccc1)CN1CCC(Oc2ncccc2F)CC1	ZINC000450877221	EG	On-Demand	Anodyne	SCN9A	0	47
CO[C@H](Cc1ccccc1)CN1CCC(Oc2ncccc2F)CC1	ZINC000450877221	EG	On-Demand	Anodyne	SCN5A	77	47
Cc1ccc(NC(=O)c2ccc(NCCN3CCC(O)CC3)c([N+](=O)[O-])c2)cc1	ZINC000450877222	GG	On-Demand	Bother	TAAR1	23	47
CO[C@@H](Cc1ccccc1)CN1CCC(Oc2ncccc2F)CC1	ZINC000450877223	EG	On-Demand	Anodyne	SCN9A	0	47
CO[C@@H](Cc1ccccc1)CN1CCC(Oc2ncccc2F)CC1	ZINC000450877223	EG	On-Demand	Anodyne	SCN5A	77	47
COC(=O)c1cccc(CN2CCC(CO)(Cc3ccccc3)CC2)c1Cl	ZINC000450877232	GH	On-Demand	Anodyne	SIGMAR1	47	41
COC(=O)c1cccc(CN2CCC(CO)(Cc3ccccc3)CC2)c1Cl	ZINC000450877232	GH	On-Demand	Anodyne	NPFFR2	38	43
COC(=O)c1cccc(CN2CCC(CO)(Cc3ccccc3)CC2)c1Cl	ZINC000450877232	GH	On-Demand	Anodyne	CCR8	45	36
COC(=O)c1cccc(CN2CCC(CO)(Cc3ccccc3)CC2)c1Cl	ZINC000450877232	GH	On-Demand	Anodyne	NPFFR1	62	46
COC(=O)c1cccc(CN2CCC(CO)(Cc3ccccc3)CC2)c1Cl	ZINC000450877232	GH	On-Demand	Anodyne	PA	25	40
CC(C)(CC(=O)CSc1nnc(-c2ccccn2)n1Cc1ccco1)C1CC1	ZINC000450877246	GI	On-Demand	Anodyne	HCRTR2	23	48
C[C@@H](CN1CCOCC1)N(C)CCN(C)Cc1ccccc1	ZINC000450877256	DD	On-Demand	Anodyne	CASR	44	34
C[C@H](CN1CCOCC1)N(C)CCN(C)Cc1ccccc1	ZINC000450877258	DD	On-Demand	Anodyne	CASR	44	34
C[C@H]1[C@@H](CO)CCN1Cc1ccccc1OC1CC1	ZINC000450877270	CE	On-Demand	Anodyne	SLC5A4	41	40
C[C@H]1[C@H](CO)CCN1Cc1ccccc1OC1CC1	ZINC000450877271	CE	On-Demand	Anodyne	SLC5A4	41	40
C[C@@H]1[C@H](CO)CCN1Cc1ccccc1OC1CC1	ZINC000450877272	CE	On-Demand	Anodyne	SLC5A4	41	40
C[C@@H]1[C@@H](CO)CCN1Cc1ccccc1OC1CC1	ZINC000450877273	CE	On-Demand	Anodyne	SLC5A4	41	40
O[C@@H]([C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1)C(F)(F)F	ZINC000450877278	FI	On-Demand	Anodyne	LIPG	46	32
O[C@H]([C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1)C(F)(F)F	ZINC000450877280	FI	On-Demand	Anodyne	LIPG	46	32
O[C@@H]([C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1)C(F)(F)F	ZINC000450877281	FI	On-Demand	Anodyne	LIPG	46	32
O[C@H]([C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1)C(F)(F)F	ZINC000450877282	FI	On-Demand	Anodyne	LIPG	46	32
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	DRD2	25	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	HTR2A	23	62
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	SLC6A1	0	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	SLC6A3	28	55
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	ADRB3	0	49
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	VACHT_TETCF	0	43
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	SIGMAR1	36	53
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	CCR3	32	41
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	PLD1	43	36
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	SLC18A3	57	53
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	CACNA1G	39	42
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	WNT3A	61	42
CO[C@@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877283	FH	On-Demand	Anodyne	NET	0	47
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	DRD2	25	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	HTR2A	23	62
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	SLC6A1	0	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	SLC6A3	28	55
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	ADRB3	0	49
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	VACHT_TETCF	0	43
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	SIGMAR1	36	53
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	CCR3	32	41
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	PLD1	43	36
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	SLC18A3	57	53
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	CACNA1G	39	42
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	WNT3A	61	42
CO[C@H](Cc1ccccc1)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450877285	FH	On-Demand	Anodyne	NET	0	47
COc1ccc(NC(=O)C2(Cc3ccccc3)CCOCC2)cc1OC(C)C	ZINC000450877299	GI	On-Demand	Anodyne	ENPP1	71	33
CCOc1cc2nccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877303	GH	On-Demand	Anodyne	PDE3A	45	38
CCOc1cc2nccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877303	GH	On-Demand	Anodyne	SSTR5	40	35
CCOc1cc2nccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877303	GH	On-Demand	Anodyne	PDE3B	65	38
CCOc1cc2nccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877304	GH	On-Demand	Anodyne	PDE3A	45	38
CCOc1cc2nccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877304	GH	On-Demand	Anodyne	SSTR5	40	35
CCOc1cc2nccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877304	GH	On-Demand	Anodyne	PDE3B	65	38
CCOc1cc2nccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877305	GH	On-Demand	Anodyne	PDE3A	45	38
CCOc1cc2nccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877305	GH	On-Demand	Anodyne	SSTR5	40	35
CCOc1cc2nccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877305	GH	On-Demand	Anodyne	PDE3B	65	38
CCOc1cc2nccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877307	GH	On-Demand	Anodyne	PDE3A	45	38
CCOc1cc2nccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877307	GH	On-Demand	Anodyne	SSTR5	40	35
CCOc1cc2nccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2cc1OCC	ZINC000450877307	GH	On-Demand	Anodyne	PDE3B	65	38
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450877317	DE	On-Demand	Anodyne	SLC18A3	22	43
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2COCCO2)CC1	ZINC000450877317	DE	On-Demand	Anodyne	WNT3A	66	46
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450877318	DE	On-Demand	Anodyne	SLC18A3	22	43
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450877318	DE	On-Demand	Anodyne	WNT3A	66	46
CCc1nc(C)c(CSc2nnc(-c3ccccc3F)n2Cc2ccco2)o1	ZINC000450877333	GJ	On-Demand	Anodyne	HCRTR2	21	43
CCC[C@H]1CCC[C@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450877335	EH	On-Demand	Anodyne	CHRNA2	40	41
CCC[C@H]1CCC[C@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450877335	EH	On-Demand	Anodyne	CRTY	0	41
CCC[C@@H]1CCC[C@@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450877336	EH	On-Demand	Anodyne	CHRNA2	40	41
CCC[C@@H]1CCC[C@@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450877336	EH	On-Demand	Anodyne	CRTY	0	41
CCC[C@H]1CCC[C@@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450877337	EH	On-Demand	Anodyne	CHRNA2	40	41
CCC[C@H]1CCC[C@@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450877337	EH	On-Demand	Anodyne	CRTY	0	41
CCC[C@@H]1CCC[C@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450877338	EH	On-Demand	Anodyne	CHRNA2	40	41
CCC[C@@H]1CCC[C@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450877338	EH	On-Demand	Anodyne	CRTY	0	41
CCCOc1ccc(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c(OC)c1	ZINC000450877345	GH	On-Demand	Anodyne	PTAFR	19	41
CCOc1ccc(-n2c(SC[C@H](O)CC#N)nnc2-c2ccccn2)cc1	ZINC000450877375	GG	On-Demand	Mild	CACNA2D1	63	37
Fc1ccccc1-c1nnc(SC[C@H]2C[C@H]3CC[C@H]2O3)n1Cc1ccco1	ZINC000450877392	GI	On-Demand	Anodyne	HCRTR2	20	42
Fc1ccccc1-c1nnc(SC[C@@H]2C[C@H]3CC[C@H]2O3)n1Cc1ccco1	ZINC000450877393	GI	On-Demand	Anodyne	HCRTR2	20	42
COc1cccc2c1CCN(C[C@H]1COCCO1)CC2	ZINC000450877396	CD	On-Demand	Anodyne	HTR1A	15	63
COc1cccc2c1CCN(C[C@@H]1COCCO1)CC2	ZINC000450877397	CD	On-Demand	Anodyne	HTR1A	15	63
N#Cc1cc(NC2CCN(C3CCC3)CC2)ccc1C(F)(F)F	ZINC000450877407	DI	On-Demand	Mild	AR	25	41
CC1CN(c2ncc(C#N)cc2Cl)CCN(c2ncc(C#N)cc2Cl)C1	ZINC000450877408	GG	On-Demand	Mild	CXCR3	24	48
N#CC1(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CCC1	ZINC000450877415	DG	On-Demand	Mild	HTR2A	19	55
N#CC1(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CCC1	ZINC000450877415	DG	On-Demand	Mild	SLC18A3	28	47
N#CC1(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CCC1	ZINC000450877415	DG	On-Demand	Mild	WNT3A	53	38
Cc1ccc(-c2nnc(SCC[C@H](C)O)n2Cc2ccco2)cc1	ZINC000450877417	EH	On-Demand	Anodyne	HCRTR2	23	45
Cc1ccc(-c2nnc(SCC[C@@H](C)O)n2Cc2ccco2)cc1	ZINC000450877418	EH	On-Demand	Anodyne	HCRTR2	23	45
CCc1cc(N[C@@H](C)c2cnn(CC)c2)n2ncnc2n1	ZINC000450877432	CE	On-Demand	Anodyne	DHOD	0	47
CCc1cc(N[C@H](C)c2cnn(CC)c2)n2ncnc2n1	ZINC000450877433	CE	On-Demand	Anodyne	DHOD	0	47
C=CCn1c(COc2ccc(C)cc2)nnc1SCC1(OC)CCC1	ZINC000450877434	FI	On-Demand	Mild	VCP	52	38
COc1cc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)ccc1Cl	ZINC000450877449	FH	On-Demand	Anodyne	DRD3	0	48
COc1cc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)ccc1Cl	ZINC000450877449	FH	On-Demand	Anodyne	SSTR5	45	38
COc1cc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)ccc1Cl	ZINC000450877450	FH	On-Demand	Anodyne	DRD3	0	48
COc1cc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)ccc1Cl	ZINC000450877450	FH	On-Demand	Anodyne	SSTR5	45	38
COc1cccc2c1CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450877451	DG	On-Demand	Anodyne	HTR1A	31	47
COc1cccc2c1CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450877451	DG	On-Demand	Anodyne	DRD2	35	42
COc1cccc2c1CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450877451	DG	On-Demand	Anodyne	SIGMAR1	25	40
COc1cccc2c1CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450877451	DG	On-Demand	Anodyne	CCR8	37	42
COc1cccc2c1CCN(Cc1cccc(C(C)=O)c1)CC2	ZINC000450877451	DG	On-Demand	Anodyne	NOD2	42	39
CCn1cc([C@H](C)Nc2ccc(C(=O)Nc3ccc(C)cc3)cn2)cn1	ZINC000450877453	EI	On-Demand	Anodyne	PRNP	54	35
CCn1cc([C@H](C)Nc2ccc(C(=O)Nc3ccc(C)cc3)cn2)cn1	ZINC000450877453	EI	On-Demand	Anodyne	P4HTM	0	46
CCn1cc([C@@H](C)Nc2ccc(C(=O)Nc3ccc(C)cc3)cn2)cn1	ZINC000450877454	EI	On-Demand	Anodyne	PRNP	54	35
CCn1cc([C@@H](C)Nc2ccc(C(=O)Nc3ccc(C)cc3)cn2)cn1	ZINC000450877454	EI	On-Demand	Anodyne	P4HTM	0	46
CCOc1ccc(-n2c(SC[C@H](O)CC#N)nnc2-c2cccs2)cc1	ZINC000450877455	GH	On-Demand	Mild	CACNA2D1	57	37
CCn1cc([C@H](C)Nc2ncnc3ccc(I)cc23)cn1	ZINC000450877475	GH	On-Demand	Anodyne	CD38	33	40
CCn1cc([C@@H](C)Nc2ncnc3ccc(I)cc23)cn1	ZINC000450877476	GH	On-Demand	Anodyne	CD38	33	40
CCCC[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)OC	ZINC000450877488	DG	On-Demand	Anodyne	P2RY12	48	31
CCCC[C@H](NC(=O)Cc1cc2ccccc2s1)C(=O)OC	ZINC000450877488	DG	On-Demand	Anodyne	NOD1	49	31
CCCC[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)OC	ZINC000450877489	DG	On-Demand	Anodyne	P2RY12	48	31
CCCC[C@@H](NC(=O)Cc1cc2ccccc2s1)C(=O)OC	ZINC000450877489	DG	On-Demand	Anodyne	NOD1	49	31
Cc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450877501	CG	On-Demand	Anodyne	PRCP	62	52
Cc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000450877502	CG	On-Demand	Anodyne	PRCP	62	52
COc1cc(CN2CCC(Oc3ccncc3C)CC2)ccc1Cl	ZINC000450877504	EI	On-Demand	Anodyne	DRD4	21	40
COc1cc(CN2CCC(Oc3ccncc3C)CC2)ccc1Cl	ZINC000450877504	EI	On-Demand	Anodyne	HRH1	29	41
COc1cc(CN2CCC(Oc3ccncc3C)CC2)ccc1Cl	ZINC000450877504	EI	On-Demand	Anodyne	HTR4	19	42
COc1cc(CN2CCC(Oc3ccncc3C)CC2)ccc1Cl	ZINC000450877504	EI	On-Demand	Anodyne	SSTR5	79	46
COc1cc(CN2CCC(Oc3ccncc3C)CC2)ccc1Cl	ZINC000450877504	EI	On-Demand	Anodyne	CCR3	29	40
COc1cc(CN2CCC(Oc3ccncc3C)CC2)ccc1Cl	ZINC000450877504	EI	On-Demand	Anodyne	UTS2R	25	43
COc1cc(CN2CCC(Oc3ccncc3C)CC2)ccc1Cl	ZINC000450877504	EI	On-Demand	Anodyne	MCHR1	15	40
C[C@@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877529	GI	On-Demand	Anodyne	TACR1	25	40
C[C@@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877529	GI	On-Demand	Anodyne	CTSD	21	51
C[C@@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877529	GI	On-Demand	Anodyne	BACE1	21	42
C[C@@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877529	GI	On-Demand	Anodyne	PHES	0	40
C[C@@H](c1ccccc1)[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877530	GI	On-Demand	Anodyne	TACR1	25	40
C[C@@H](c1ccccc1)[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877530	GI	On-Demand	Anodyne	CTSD	21	51
C[C@@H](c1ccccc1)[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877530	GI	On-Demand	Anodyne	BACE1	21	42
C[C@@H](c1ccccc1)[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877530	GI	On-Demand	Anodyne	PHES	0	40
C[C@H](c1ccccc1)[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877531	GI	On-Demand	Anodyne	TACR1	25	40
C[C@H](c1ccccc1)[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877531	GI	On-Demand	Anodyne	CTSD	21	51
C[C@H](c1ccccc1)[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877531	GI	On-Demand	Anodyne	BACE1	21	42
C[C@H](c1ccccc1)[C@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877531	GI	On-Demand	Anodyne	PHES	0	40
C[C@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877532	GI	On-Demand	Anodyne	TACR1	25	40
C[C@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877532	GI	On-Demand	Anodyne	CTSD	21	51
C[C@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877532	GI	On-Demand	Anodyne	BACE1	21	42
C[C@H](c1ccccc1)[C@@H](O)CNC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000450877532	GI	On-Demand	Anodyne	PHES	0	40
NC(=O)c1cnc(N2CC(c3cccc(C(F)(F)F)c3)C2)c(Cl)c1	ZINC000450877534	FG	On-Demand	Anodyne	P2RY12	27	40
NC(=O)c1cnc(N2CC(c3cccc(C(F)(F)F)c3)C2)c(Cl)c1	ZINC000450877534	FG	On-Demand	Anodyne	CXCR3	27	41
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877538	FH	On-Demand	Anodyne	PDE3A	44	36
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877538	FH	On-Demand	Anodyne	HRP1_PLAFA	81	37
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877538	FH	On-Demand	Anodyne	HNMT	49	34
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877538	FH	On-Demand	Anodyne	PDE3B	64	36
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877538	FH	On-Demand	Anodyne	HTT	0	49
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877539	FH	On-Demand	Anodyne	PDE3A	44	36
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877539	FH	On-Demand	Anodyne	HRP1_PLAFA	81	37
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877539	FH	On-Demand	Anodyne	HNMT	49	34
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877539	FH	On-Demand	Anodyne	PDE3B	64	36
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450877539	FH	On-Demand	Anodyne	HTT	0	49
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	HTR1A	25	51
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	DRD2	38	55
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	DRD4	0	51
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	ADRA1D	33	43
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	ADRA1A	31	51
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	ADRA1B	28	43
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	ADRA2B	0	45
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	HTR7	41	49
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	SIGMAR1	31	45
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	SLC18A3	36	57
CN1CCC2(CCN(CCCC(=O)c3ccccc3)CC2)C1=O	ZINC000450877547	DF	On-Demand	Anodyne	CYP2J2	65	46
COC1(CO)CCN([C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000450877563	EI	On-Demand	Anodyne	OPRK1	15	50
COC1(CO)CCN([C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000450877563	EI	On-Demand	Anodyne	OPRL1	19	50
COC1(CO)CCN([C@H](C)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000450877564	EI	On-Demand	Anodyne	OPRK1	15	50
COC1(CO)CCN([C@H](C)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000450877564	EI	On-Demand	Anodyne	OPRL1	19	50
CCOC(=O)[C@@]1(C(C)C)CCN(Cc2ccc(S(=O)(=O)CC)cc2)C1	ZINC000450877565	FF	On-Demand	Anodyne	ADAM17	23	40
CCOC(=O)[C@]1(C(C)C)CCN(Cc2ccc(S(=O)(=O)CC)cc2)C1	ZINC000450877566	FF	On-Demand	Anodyne	ADAM17	23	40
O=C(NC1Cc2ccccc2C1)C1(Cc2ccccc2)CCOCC1	ZINC000450877584	EG	On-Demand	Anodyne	MME	16	40
COC(=O)c1cn([C@H]2CCCN(C(=O)Cc3cc4ccccc4s3)C2)nn1	ZINC000450877585	GF	On-Demand	Anodyne	PREP	25	44
COC(=O)c1cn([C@@H]2CCCN(C(=O)Cc3cc4ccccc4s3)C2)nn1	ZINC000450877586	GF	On-Demand	Anodyne	PREP	25	44
Cn1c(COc2ccccc2)nnc1SCCC(C)(F)F	ZINC000450877603	DH	On-Demand	Anodyne	VCP	39	40
CCS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450877611	FI	On-Demand	Anodyne	CACNA1B	47	34
CCS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)cc1	ZINC000450877611	FI	On-Demand	Anodyne	PDS	15	40
O[C@@H]([C@H]1CCN(c2ccnc(N3CCCCC3)n2)C1)C(F)(F)F	ZINC000450877616	EE	On-Demand	Anodyne	SORD	43	39
O[C@H]([C@@H]1CCN(c2ccnc(N3CCCCC3)n2)C1)C(F)(F)F	ZINC000450877617	EE	On-Demand	Anodyne	SORD	43	39
O[C@H]([C@H]1CCN(c2ccnc(N3CCCCC3)n2)C1)C(F)(F)F	ZINC000450877618	EE	On-Demand	Anodyne	SORD	43	39
O[C@@H]([C@@H]1CCN(c2ccnc(N3CCCCC3)n2)C1)C(F)(F)F	ZINC000450877619	EE	On-Demand	Anodyne	SORD	43	39
C[C@H](O)C[C@@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450877629	CF	On-Demand	Anodyne	SLC18A2	58	41
C[C@H](O)C[C@@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450877630	CF	On-Demand	Anodyne	SLC18A2	58	41
C[C@H](O)C[C@@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450877631	CF	On-Demand	Anodyne	SLC18A2	58	41
C[C@H](O)C[C@@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450877632	CF	On-Demand	Anodyne	SLC18A2	58	41
CCSc1cccnc1C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450877689	FF	On-Demand	Anodyne	SCD	21	40
CCSc1cccnc1C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450877691	FF	On-Demand	Anodyne	SCD	21	40
FC(F)(F)c1cccc(C2CN(c3cc(N4CCOCC4)ncn3)C2)c1	ZINC000450877700	FF	On-Demand	Anodyne	SMG1	25	45
Cn1c(COc2ccccc2)nnc1SCc1cn(CC2CC2)nn1	ZINC000450877726	FF	On-Demand	Anodyne	VCP	57	41
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1cccc(C(C)=O)c1	ZINC000450877746	EH	On-Demand	Anodyne	SLC6A3	17	40
CCc1nnc([C@@H]2CN(Cc3ccc(Cl)c(OC)c3)CCO2)o1	ZINC000450877750	EF	On-Demand	Anodyne	SSTR5	50	38
CCc1nnc([C@H]2CN(Cc3ccc(Cl)c(OC)c3)CCO2)o1	ZINC000450877754	EF	On-Demand	Anodyne	SSTR5	50	38
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1	ZINC000450877773	EG	On-Demand	Bother	ADRA2A	0	42
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1	ZINC000450877773	EG	On-Demand	Bother	DRD4	0	42
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1	ZINC000450877773	EG	On-Demand	Bother	ADRA2B	26	42
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1	ZINC000450877773	EG	On-Demand	Bother	CYP2J2	63	47
CC(C)(C)n1ncc2c(=O)n(CCc3ccc(Cl)cc3)cnc21	ZINC000450877792	EG	On-Demand	Anodyne	Q9M629_MAIZE	53	32
Cc1cc(C(F)(F)F)nc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450877804	EF	On-Demand	Anodyne	SORD	17	41
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	HTR1A	46	52
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	DRD2	42	47
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	DRD1	20	41
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	DRD4	49	38
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	HTR2A	18	41
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	DRD3	53	43
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	DRD5	25	41
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	HTR7	45	47
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	SIGMAR1	19	40
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	MTNR1A	74	39
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	MTNR1B	68	39
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	EBP	44	35
COc1ccc(CNC(=O)CCN2CCc3cccc(OC)c3CC2)c(OC)c1	ZINC000450877805	GF	On-Demand	Anodyne	SSTR1	47	35
Cn1nc(C(=O)Nc2ccc(Cl)cc2OC(F)F)c2c1CCCC2	ZINC000450877816	FH	On-Demand	Anodyne	CNR1	55	33
Cc1cc(C(F)(F)F)nc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450877826	EF	On-Demand	Anodyne	SORD	17	41
Cc1cc(C(F)(F)F)nc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450877829	EF	On-Demand	Anodyne	SORD	17	41
CC(=O)c1cccc(CN2CCN(C(=O)c3cc4ccccc4s3)CC2)c1	ZINC000450877839	GI	On-Demand	Anodyne	TRY2_BOVIN	64	34
CC(=O)c1cccc(CN2CCN(C(=O)c3cc4ccccc4s3)CC2)c1	ZINC000450877839	GI	On-Demand	Anodyne	FAAH	22	42
CC(=O)c1cccc(CN2CCN(C(=O)c3cc4ccccc4s3)CC2)c1	ZINC000450877839	GI	On-Demand	Anodyne	MGLL	0	43
C[C@@H](O)CCSc1nnc(COc2ccccc2)n1C	ZINC000450877852	CE	On-Demand	Anodyne	VCP	36	40
COc1cc(CC(=O)N2CCN(C)[C@H](c3nccn3C)C2)ccc1Cl	ZINC000450877886	FE	On-Demand	Anodyne	OPRK1	32	40
COc1cc(CC(=O)N2CCN(C)[C@H](c3nccn3C)C2)ccc1Cl	ZINC000450877886	FE	On-Demand	Anodyne	CCR1	32	41
COc1cc(CC(=O)N2CCN(C)[C@@H](c3nccn3C)C2)ccc1Cl	ZINC000450877887	FE	On-Demand	Anodyne	OPRK1	32	40
COc1cc(CC(=O)N2CCN(C)[C@@H](c3nccn3C)C2)ccc1Cl	ZINC000450877887	FE	On-Demand	Anodyne	CCR1	32	41
C[C@H](Nc1nccc(C#N)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450877891	DE	On-Demand	Mild	TPP2	58	37
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nccc(C#N)n1	ZINC000450877893	DE	On-Demand	Mild	TPP2	58	37
C[C@H](Nc1nccc(C#N)n1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450877895	DE	On-Demand	Mild	TPP2	58	37
C[C@@H](Nc1nccc(C#N)n1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450877897	DE	On-Demand	Mild	TPP2	58	37
CCc1cc(CC)nc(NC[C@@H](c2ccccc2)c2nc[nH]n2)n1	ZINC000450877898	DE	On-Demand	Anodyne	ESR1	17	42
CCc1cc(CC)nc(NC[C@H](c2ccccc2)c2nc[nH]n2)n1	ZINC000450877900	DE	On-Demand	Anodyne	ESR1	17	42
Fc1ccccc1-c1nnc(SCC[C@@H]2CCOC2)n1Cc1ccco1	ZINC000450877917	FI	On-Demand	Anodyne	HCRTR2	0	48
Fc1ccccc1-c1nnc(SCC[C@H]2CCOC2)n1Cc1ccco1	ZINC000450877919	FI	On-Demand	Anodyne	HCRTR2	0	48
CC(C)(C)O[C@@H]1C[C@H](Nc2nc3ccccc3[nH]2)[C@H]1n1cccn1	ZINC000450877928	EG	On-Demand	Anodyne	KCNN3	41	40
CC(C)(C)O[C@@H]1C[C@@H](Nc2nc3ccccc3[nH]2)[C@H]1n1cccn1	ZINC000450877929	EG	On-Demand	Anodyne	KCNN3	41	40
CC(C)(C)O[C@@H]1C[C@@H](Nc2nc3ccccc3[nH]2)[C@@H]1n1cccn1	ZINC000450877930	EG	On-Demand	Anodyne	KCNN3	41	40
CC(C)(C)O[C@@H]1C[C@H](Nc2nc3ccccc3[nH]2)[C@@H]1n1cccn1	ZINC000450877931	EG	On-Demand	Anodyne	KCNN3	41	40
CCOc1ccc(-n2c(SCC[C@@H](C)O)nnc2-c2cnccn2)cc1	ZINC000450877936	FF	On-Demand	Anodyne	CACNA2D1	59	37
CCOc1ccc(-n2c(SCC[C@H](C)O)nnc2-c2cnccn2)cc1	ZINC000450877938	FF	On-Demand	Anodyne	CACNA2D1	59	37
CCn1cc([C@H](C)Nc2ccc(C(=O)N3CCc4ccccc43)cn2)cn1	ZINC000450877944	FH	On-Demand	Anodyne	AVPR2	62	39
CCn1cc([C@H](C)Nc2ccc(C(=O)N3CCc4ccccc43)cn2)cn1	ZINC000450877944	FH	On-Demand	Anodyne	AVPR1A	44	42
CCn1cc([C@@H](C)Nc2ccc(C(=O)N3CCc4ccccc43)cn2)cn1	ZINC000450877946	FH	On-Demand	Anodyne	AVPR2	62	39
CCn1cc([C@@H](C)Nc2ccc(C(=O)N3CCc4ccccc43)cn2)cn1	ZINC000450877946	FH	On-Demand	Anodyne	AVPR1A	44	42
CCc1cc2c(NC3CCN(C4CCC4)CC3)ncnc2s1	ZINC000450877977	DH	On-Demand	Anodyne	CD38	40	39
CCn1c(SCc2nc(C(=O)OC)cs2)nnc1-c1ccccn1	ZINC000450877980	FF	On-Demand	Anodyne	SLC27A1	43	38
O=C1C[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450877981	DE	On-Demand	Anodyne	DRD2	38	58
O=C1C[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450877981	DE	On-Demand	Anodyne	ERG2	24	52
O=C1C[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450877981	DE	On-Demand	Anodyne	PLD2	60	38
O=C1C[C@@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450877981	DE	On-Demand	Anodyne	CYP2J2	47	34
O=C1C[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450877982	DE	On-Demand	Anodyne	DRD2	38	58
O=C1C[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450877982	DE	On-Demand	Anodyne	ERG2	24	52
O=C1C[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450877982	DE	On-Demand	Anodyne	PLD2	60	38
O=C1C[C@]2(CCN(CCCC(=O)c3ccc(F)cc3)C2)CN1	ZINC000450877982	DE	On-Demand	Anodyne	CYP2J2	47	34
CCc1cc(CCCN2CCC(F)(c3ccccc3)CC2)on1	ZINC000450877988	DI	On-Demand	Anodyne	SIGMAR1	23	41
CCCc1nc(C)c(CSc2nnc(-c3ccco3)n2Cc2ccco2)o1	ZINC000450877994	GJ	On-Demand	Anodyne	HCRTR2	19	40
CCn1c(COc2ccc(C)cc2)nnc1SCC1(OC)CCC1	ZINC000450878000	EH	On-Demand	Anodyne	VCP	59	41
Cn1c(NC2CCN(C3CCC3)CC2)nc2cccc(F)c21	ZINC000450878020	DF	On-Demand	Anodyne	HRH3	15	44
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	DRD4	0	52
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	HTR2A	32	67
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	SLC6A3	26	43
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	SIGMAR1	0	54
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	CCR3	56	35
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	CCR5	39	46
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	PLD1	42	35
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	SLC18A3	49	54
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	CACNA1G	40	40
C[C@@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878025	CE	On-Demand	Anodyne	WNT3A	65	44
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	DRD4	0	52
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	HTR2A	32	67
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	SLC6A3	26	43
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	SIGMAR1	0	54
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	CCR3	56	35
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	CCR5	39	46
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	PLD1	42	35
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	SLC18A3	49	54
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	CACNA1G	40	40
C[C@H](O)CCN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450878026	CE	On-Demand	Anodyne	WNT3A	65	44
CCn1c(COc2ccc(C)cc2)nnc1SCc1nnc(C2CC2)s1	ZINC000450878040	GI	On-Demand	Anodyne	VCP	45	38
N#CC1(CSc2nnc(-c3ccc(F)cc3)n2Cc2ccco2)CCC1	ZINC000450878042	FJ	On-Demand	Mild	HCRTR2	19	44
Fc1cc2ncnc(NC3CCN(C4CCC4)CC3)c2cc1F	ZINC000450878052	DG	On-Demand	Anodyne	CCR4	22	41
Fc1cc2ncnc(NC3CCN(C4CCC4)CC3)c2cc1F	ZINC000450878052	DG	On-Demand	Anodyne	CD38	44	43
c1ccc2c(c1)sc1ncnc(NC3CCN(C4CCC4)CC3)c12	ZINC000450878053	EI	On-Demand	Anodyne	IRAK4	17	75
C=CCn1c(SCc2cn(CC3CC3)nn2)nnc1-c1ccccc1C	ZINC000450878055	FH	On-Demand	Mild	Q8MHZ5_SHEEP	40	30
COc1cccc2c(NC3CCN(C4CCC4)CC3)ccnc12	ZINC000450878068	DH	On-Demand	Anodyne	CCR4	0	42
CC(=O)CCCCCSc1nnc(-c2cccs2)n1Cc1ccco1	ZINC000450878071	GJ	On-Demand	Anodyne	HCRTR2	22	48
COc1cc(CN2CC[C@@H](CN(C)Cc3scnc3C)C2)ccc1Cl	ZINC000450878084	GI	On-Demand	Anodyne	DRD4	15	44
COc1cc(CN2CC[C@@H](CN(C)Cc3scnc3C)C2)ccc1Cl	ZINC000450878084	GI	On-Demand	Anodyne	SSTR5	48	37
COc1cc(CN2CC[C@H](CN(C)Cc3scnc3C)C2)ccc1Cl	ZINC000450878089	GI	On-Demand	Anodyne	DRD4	15	44
COc1cc(CN2CC[C@H](CN(C)Cc3scnc3C)C2)ccc1Cl	ZINC000450878089	GI	On-Demand	Anodyne	SSTR5	48	37
O=C(NCCC[C@@H]1CCCCO1)c1ccc(N2CCC2)nc1	ZINC000450878100	DE	On-Demand	Anodyne	HPGDS	30	48
O=C(NCCC[C@H]1CCCCO1)c1ccc(N2CCC2)nc1	ZINC000450878101	DE	On-Demand	Anodyne	HPGDS	30	48
O[C@H]([C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F	ZINC000450878103	EG	On-Demand	Anodyne	GRM5	27	48
O[C@@H]([C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F	ZINC000450878105	EG	On-Demand	Anodyne	GRM5	27	48
O[C@H]([C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F	ZINC000450878108	EG	On-Demand	Anodyne	GRM5	27	48
O[C@@H]([C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F	ZINC000450878110	EG	On-Demand	Anodyne	GRM5	27	48
COc1cc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878120	EF	On-Demand	Anodyne	PDE3A	65	51
COc1cc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878120	EF	On-Demand	Anodyne	PDGFRB	63	39
COc1cc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878120	EF	On-Demand	Anodyne	PDE3B	94	48
COc1cc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878123	EF	On-Demand	Anodyne	PDE3A	65	51
COc1cc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878123	EF	On-Demand	Anodyne	PDGFRB	63	39
COc1cc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878123	EF	On-Demand	Anodyne	PDE3B	94	48
COc1cc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878125	EF	On-Demand	Anodyne	PDE3A	65	51
COc1cc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878125	EF	On-Demand	Anodyne	PDGFRB	63	39
COc1cc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878125	EF	On-Demand	Anodyne	PDE3B	94	48
COc1cc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878129	EF	On-Demand	Anodyne	PDE3A	65	51
COc1cc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878129	EF	On-Demand	Anodyne	PDGFRB	63	39
COc1cc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ncnc2cc1F	ZINC000450878129	EF	On-Demand	Anodyne	PDE3B	94	48
O=[N+]([O-])c1cnc(NC2(Cc3cccc(Cl)c3)CC2)nc1	ZINC000450878153	DG	On-Demand	Bother	PRKCQ	15	41
CC(F)(F)CCSc1nnc(-c2ccccc2F)n1Cc1ccco1	ZINC000450878154	FJ	On-Demand	Anodyne	HCRTR2	23	46
Fc1cccnc1OC1CCN(CCc2cscn2)CC1	ZINC000450878188	DF	On-Demand	Anodyne	SCN9A	23	49
Fc1cccnc1OC1CCN(CCc2cscn2)CC1	ZINC000450878188	DF	On-Demand	Anodyne	SCN5A	88	49
CN(C)c1ncccc1O[C@H]1CCN(C(=O)c2cc(Cl)sc2Cl)C1	ZINC000450878234	GH	On-Demand	Anodyne	HCRTR1	43	39
CN(C)c1ncccc1O[C@H]1CCN(C(=O)c2cc(Cl)sc2Cl)C1	ZINC000450878234	GH	On-Demand	Anodyne	HCRTR2	44	39
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)c2cc(Cl)sc2Cl)C1	ZINC000450878236	GH	On-Demand	Anodyne	HCRTR1	43	39
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)c2cc(Cl)sc2Cl)C1	ZINC000450878236	GH	On-Demand	Anodyne	HCRTR2	44	39
CCn1cc([C@@H](C)Nc2ccnc3cc(Cl)ccc23)cn1	ZINC000450878237	DI	On-Demand	Anodyne	HRP1_PLAFA	126	51
CCn1cc([C@@H](C)Nc2ccnc3cc(Cl)ccc23)cn1	ZINC000450878237	DI	On-Demand	Anodyne	HNMT	57	40
CCn1cc([C@@H](C)Nc2ccnc3cc(Cl)ccc23)cn1	ZINC000450878237	DI	On-Demand	Anodyne	BOTA	19	44
CCn1cc([C@@H](C)Nc2ccnc3cc(Cl)ccc23)cn1	ZINC000450878237	DI	On-Demand	Anodyne	RBP_CHICK	0	51
CCn1cc([C@H](C)Nc2ccnc3cc(Cl)ccc23)cn1	ZINC000450878245	DI	On-Demand	Anodyne	HRP1_PLAFA	103	38
CCn1cc([C@H](C)Nc2ccnc3cc(Cl)ccc23)cn1	ZINC000450878245	DI	On-Demand	Anodyne	HNMT	57	40
CCn1cc([C@H](C)Nc2ccnc3cc(Cl)ccc23)cn1	ZINC000450878245	DI	On-Demand	Anodyne	BOTA	19	44
CCn1cc([C@H](C)Nc2ccnc3cc(Cl)ccc23)cn1	ZINC000450878245	DI	On-Demand	Anodyne	RBP_CHICK	0	51
C[C@@H]1CN(CC(F)(F)F)CCN(c2nc3ccccc3o2)C1	ZINC000450878250	DG	On-Demand	Anodyne	SORD	16	43
C[C@H]1CN(CC(F)(F)F)CCN(c2nc3ccccc3o2)C1	ZINC000450878252	DG	On-Demand	Anodyne	SORD	16	43
O=C(CCCN1CCC[C@H](Oc2ncccc2F)C1)c1ccccc1	ZINC000450878253	EH	On-Demand	Anodyne	DRD4	20	44
O=C(CCCN1CCC[C@H](Oc2ncccc2F)C1)c1ccccc1	ZINC000450878253	EH	On-Demand	Anodyne	HTR2A	20	44
O=C(CCCN1CCC[C@H](Oc2ncccc2F)C1)c1ccccc1	ZINC000450878253	EH	On-Demand	Anodyne	SLC6A1	163	44
O=C(CCCN1CCC[C@H](Oc2ncccc2F)C1)c1ccccc1	ZINC000450878253	EH	On-Demand	Anodyne	CYP2J2	55	39
O=C(CCCN1CCC[C@@H](Oc2ncccc2F)C1)c1ccccc1	ZINC000450878255	EH	On-Demand	Anodyne	DRD4	20	44
O=C(CCCN1CCC[C@@H](Oc2ncccc2F)C1)c1ccccc1	ZINC000450878255	EH	On-Demand	Anodyne	HTR2A	20	44
O=C(CCCN1CCC[C@@H](Oc2ncccc2F)C1)c1ccccc1	ZINC000450878255	EH	On-Demand	Anodyne	SLC6A1	163	44
O=C(CCCN1CCC[C@@H](Oc2ncccc2F)C1)c1ccccc1	ZINC000450878255	EH	On-Demand	Anodyne	CYP2J2	55	39
C=C[C@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450878261	EF	On-Demand	Mild	MTNR1A	45	35
C=C[C@@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450878263	EF	On-Demand	Mild	MTNR1A	45	35
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450878275	FG	On-Demand	Anodyne	ACHE	21	40
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450878275	FG	On-Demand	Anodyne	OPRM1	17	43
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450878275	FG	On-Demand	Anodyne	OPRD1	15	41
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450878275	FG	On-Demand	Anodyne	CCR5	40	42
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450878275	FG	On-Demand	Anodyne	MCHR1	21	40
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450878275	FG	On-Demand	Anodyne	HPGDS	15	40
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450878275	FG	On-Demand	Anodyne	MBTPS1	51	34
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450878279	FG	On-Demand	Anodyne	ACHE	21	40
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450878279	FG	On-Demand	Anodyne	OPRM1	17	43
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450878279	FG	On-Demand	Anodyne	OPRD1	15	41
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450878279	FG	On-Demand	Anodyne	CCR5	40	42
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450878279	FG	On-Demand	Anodyne	MCHR1	21	40
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450878279	FG	On-Demand	Anodyne	HPGDS	15	40
CCN(C(=O)c1ccc(N2CCC2)nc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450878279	FG	On-Demand	Anodyne	MBTPS1	51	34
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450878284	FG	On-Demand	Anodyne	SCD1	50	39
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450878284	FG	On-Demand	Anodyne	SCD	42	45
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450878287	FG	On-Demand	Anodyne	SCD1	50	39
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450878287	FG	On-Demand	Anodyne	SCD	42	45
CN1CCN(c2nc3ccccc3nc2N2CC[C@H]([C@H](O)C(F)(F)F)C2)CC1	ZINC000450878290	GE	On-Demand	Anodyne	HTR3A	28	50
CN1CCN(c2nc3ccccc3nc2N2CC[C@H]([C@H](O)C(F)(F)F)C2)CC1	ZINC000450878290	GE	On-Demand	Anodyne	HRH4	28	50
CCCC[C@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OC	ZINC000450878291	EF	On-Demand	Anodyne	P2RY12	70	34
CCCC[C@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OC	ZINC000450878291	EF	On-Demand	Anodyne	CTSK	45	35
CCCC[C@@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OC	ZINC000450878293	EF	On-Demand	Anodyne	P2RY12	70	34
CCCC[C@@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OC	ZINC000450878293	EF	On-Demand	Anodyne	CTSK	45	35
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]([C@H](O)C(F)(F)F)C2)CC1	ZINC000450878294	GE	On-Demand	Anodyne	HTR3A	28	50
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]([C@H](O)C(F)(F)F)C2)CC1	ZINC000450878294	GE	On-Demand	Anodyne	HRH4	28	50
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)CC1	ZINC000450878298	GE	On-Demand	Anodyne	HTR3A	28	50
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)CC1	ZINC000450878298	GE	On-Demand	Anodyne	HRH4	28	50
CN1CCN(c2nc3ccccc3nc2N2CC[C@H]([C@@H](O)C(F)(F)F)C2)CC1	ZINC000450878302	GE	On-Demand	Anodyne	HTR3A	28	50
CN1CCN(c2nc3ccccc3nc2N2CC[C@H]([C@@H](O)C(F)(F)F)C2)CC1	ZINC000450878302	GE	On-Demand	Anodyne	HRH4	28	50
FC(F)(F)c1csc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450878312	FJ	On-Demand	Anodyne	KCNN3	33	47
O=C(c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450878318	GG	On-Demand	Anodyne	AVPR2	65	39
O=C(c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450878318	GG	On-Demand	Anodyne	AVPR1A	40	37
O=C(c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450878319	GG	On-Demand	Anodyne	AVPR2	65	39
O=C(c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450878319	GG	On-Demand	Anodyne	AVPR1A	40	37
FC(F)(F)c1csc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450878320	FJ	On-Demand	Anodyne	KCNN3	33	47
O=C(c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450878321	GG	On-Demand	Anodyne	AVPR2	65	39
O=C(c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450878321	GG	On-Demand	Anodyne	AVPR1A	40	37
O=C(c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450878323	GG	On-Demand	Anodyne	AVPR2	65	39
O=C(c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCc2ccccc21	ZINC000450878323	GG	On-Demand	Anodyne	AVPR1A	40	37
Cc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1C	ZINC000450878324	DI	On-Demand	Anodyne	MAP	0	40
Cc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1C	ZINC000450878324	DI	On-Demand	Anodyne	MAP1	123	40
Cc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1C	ZINC000450878326	DI	On-Demand	Anodyne	MAP	0	40
Cc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1C	ZINC000450878326	DI	On-Demand	Anodyne	MAP1	123	40
C[C@H](O)CCSc1nnc(COc2ccccc2)n1C	ZINC000450878347	CE	On-Demand	Anodyne	VCP	36	40
CNC(=O)c1cccnc1N1CCC(Cc2cc(F)cc(F)c2)CC1	ZINC000450878377	EG	On-Demand	Anodyne	CCR3	54	41
CNC(=O)c1cccnc1N1CCC(Cc2cc(F)cc(F)c2)CC1	ZINC000450878377	EG	On-Demand	Anodyne	SIRT2	43	30
O=c1c2ccccc2sn1CC1=CCCCC1	ZINC000450878387	BH	On-Demand	Anodyne	CASP3	30	40
O=c1c2ccccc2sn1CC1=CCCCC1	ZINC000450878387	BH	On-Demand	Anodyne	CASP7	47	37
CC(=O)c1ccc(CN2CCN(C(=O)c3cc4ccccc4s3)CC2)cc1	ZINC000450878394	GI	On-Demand	Anodyne	SIGMAR1	26	40
CC(=O)c1ccc(CN2CCN(C(=O)c3cc4ccccc4s3)CC2)cc1	ZINC000450878394	GI	On-Demand	Anodyne	FAAH	17	42
CC(=O)CCCCCSc1nnc(-c2ccccn2)n1C	ZINC000450878396	DG	On-Demand	Anodyne	FAAH	29	44
CC(C)c1nccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450878409	DI	On-Demand	Anodyne	PRCP	28	41
CC(C)c1nccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450878409	DI	On-Demand	Anodyne	KCNN3	36	51
CC(C)c1nccc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450878409	DI	On-Demand	Anodyne	SORD	65	37
CC(C)c1nccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450878410	DI	On-Demand	Anodyne	PRCP	28	41
CC(C)c1nccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450878410	DI	On-Demand	Anodyne	KCNN3	36	51
CC(C)c1nccc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450878410	DI	On-Demand	Anodyne	SORD	65	37
CN(C)C(=O)c1cnc(N2CCC(Cc3cc(F)cc(F)c3)CC2)c(Cl)c1	ZINC000450878415	GI	On-Demand	Anodyne	CXCR3	34	42
CC(C)(CC(=O)CN(C#N)c1ccccc1)C1CC1	ZINC000450878439	CG	On-Demand	Anodyne	AMY2	43	30
Clc1ccc2nccc(N3CCC[C@]4(CCOC4)C3)c2c1	ZINC000450878441	DH	On-Demand	Anodyne	HNMT	45	32
Clc1ccc2nccc(N3CCC[C@@]4(CCOC4)C3)c2c1	ZINC000450878442	DH	On-Demand	Anodyne	HNMT	45	32
COc1cc(CN2CCCC[C@@H]2C[C@H](C)O)ccc1Cl	ZINC000450878462	CG	On-Demand	Anodyne	DRD2	40	40
COc1cc(CN2CCCC[C@H]2C[C@H](C)O)ccc1Cl	ZINC000450878464	CG	On-Demand	Anodyne	DRD2	40	40
COc1cc(CN2CCCC[C@H]2C[C@@H](C)O)ccc1Cl	ZINC000450878466	CG	On-Demand	Anodyne	DRD2	40	40
COc1cc(CN2CCCC[C@@H]2C[C@@H](C)O)ccc1Cl	ZINC000450878468	CG	On-Demand	Anodyne	DRD2	40	40
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	DRD2	24	62
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	DRD4	35	47
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	ACHE	30	46
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	HTR2A	32	71
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	HTR2C	19	71
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	HRH1	19	47
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	VACHT_TETCF	0	41
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	HRH3	15	47
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	SIGMAR1	56	56
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	CCR3	37	41
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	SLC18A3	49	56
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	MLNR	22	46
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	MCHR1	27	40
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	CACNA1G	47	46
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	WNT3A	52	41
O=C(c1ccc(F)cc1)C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450878523	GI	On-Demand	Anodyne	TNKS2	17	41
CC[C@H](CC#N)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450878536	CD	On-Demand	Mild	ENPP2	16	40
CC[C@H](CC#N)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450878536	CD	On-Demand	Mild	HPGDS	15	42
CC[C@@H](CC#N)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450878548	CD	On-Demand	Mild	ENPP2	16	40
CC[C@@H](CC#N)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450878548	CD	On-Demand	Mild	HPGDS	15	42
COC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450878550	EG	On-Demand	Anodyne	CCR3	51	31
COC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450878550	EG	On-Demand	Anodyne	SCD1	65	44
COC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450878550	EG	On-Demand	Anodyne	SCD	48	41
CC[C@@H](SCc1nc(C(=O)OC)cs1)c1ccccc1	ZINC000450878572	DI	On-Demand	Anodyne	FAS	45	38
CC[C@H](SCc1nc(C(=O)OC)cs1)c1ccccc1	ZINC000450878579	DI	On-Demand	Anodyne	FAS	45	38
C[C@@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450878581	ED	On-Demand	Anodyne	TPP2	71	41
C[C@@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450878581	ED	On-Demand	Anodyne	TRPC6	63	34
C[C@@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450878581	ED	On-Demand	Anodyne	TRPC3	50	35
C[C@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450878583	ED	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450878583	ED	On-Demand	Anodyne	TRPC6	63	34
C[C@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450878583	ED	On-Demand	Anodyne	TRPC3	50	35
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nc(C(N)=O)cs1	ZINC000450878585	ED	On-Demand	Anodyne	TPP2	71	41
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nc(C(N)=O)cs1	ZINC000450878585	ED	On-Demand	Anodyne	TRPC6	63	34
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Nc1nc(C(N)=O)cs1	ZINC000450878585	ED	On-Demand	Anodyne	TRPC3	50	35
C[C@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450878587	ED	On-Demand	Anodyne	TPP2	71	41
C[C@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450878587	ED	On-Demand	Anodyne	TRPC6	63	34
C[C@H](Nc1nc(C(N)=O)cs1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450878587	ED	On-Demand	Anodyne	TRPC3	50	35
CC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1	ZINC000450878598	CG	On-Demand	Anodyne	DRD4	29	40
CC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1	ZINC000450878598	CG	On-Demand	Anodyne	ACHE	18	45
CC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1	ZINC000450878598	CG	On-Demand	Anodyne	SIGMAR1	32	41
CC(F)(F)CCSc1nnc(-c2ccc(F)cc2)n1Cc1ccco1	ZINC000450878625	FJ	On-Demand	Anodyne	HCRTR2	21	49
CCn1nnc(C)c1CSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450878627	GG	On-Demand	Anodyne	HCRTR2	20	41
COc1ccc(-n2c(SC[C@@H]3COCCO3)nnc2-c2cnccn2)cc1	ZINC000450878632	GE	On-Demand	Anodyne	WNT3A	21	42
COc1ccc(-n2c(SC[C@H]3COCCO3)nnc2-c2cnccn2)cc1	ZINC000450878634	GE	On-Demand	Anodyne	WNT3A	21	42
c1coc(Cn2c(SC[C@H]3COCCO3)nnc2-c2ccco2)c1	ZINC000450878635	EF	On-Demand	Anodyne	HCRTR2	0	41
c1coc(Cn2c(SC[C@@H]3COCCO3)nnc2-c2ccco2)c1	ZINC000450878636	EF	On-Demand	Anodyne	HCRTR2	0	41
CC(C)(C)OC1CC(N2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)C1	ZINC000450878658	GI	On-Demand	Anodyne	CACNA1H	17	44
CC(C)(C)OC1CC(N2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)C1	ZINC000450878658	GI	On-Demand	Anodyne	APOB	0	41
CC(C)(C)OC1CC(N2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)C1	ZINC000450878658	GI	On-Demand	Anodyne	CCR2	46	52
CC(C)(C)OC1CC(N2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)C1	ZINC000450878658	GI	On-Demand	Anodyne	EPHX2	33	47
CC(C)(C)OC1CC(N2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)C1	ZINC000450878658	GI	On-Demand	Anodyne	TRPM8	46	37
FC1(F)CCC[C@@H]1CSc1nnc(-c2ccco2)n1Cc1ccco1	ZINC000450878661	FJ	On-Demand	Anodyne	HCRTR2	20	40
FC1(F)CCC[C@H]1CSc1nnc(-c2ccco2)n1Cc1ccco1	ZINC000450878662	FJ	On-Demand	Anodyne	HCRTR2	20	40
COC(=O)c1csc(CN2CCC(n3ccc(C)n3)CC2)n1	ZINC000450878667	DE	On-Demand	Anodyne	TRPC6	45	32
CCOc1ccc(-n2c(S[C@H](C)c3noc(C)n3)nnc2-c2ccco2)cc1	ZINC000450878673	GI	On-Demand	Anodyne	CACNA2D1	56	36
CCOc1ccc(-n2c(S[C@H](C)c3noc(C)n3)nnc2-c2ccco2)cc1	ZINC000450878673	GI	On-Demand	Anodyne	WNT3A	19	41
CCOc1ccc(-n2c(S[C@@H](C)c3noc(C)n3)nnc2-c2ccco2)cc1	ZINC000450878674	GI	On-Demand	Anodyne	CACNA2D1	56	36
CCOc1ccc(-n2c(S[C@@H](C)c3noc(C)n3)nnc2-c2ccco2)cc1	ZINC000450878674	GI	On-Demand	Anodyne	WNT3A	19	41
c1coc(Cn2c(SCC[C@H]3CCOC3)nnc2-c2cccs2)c1	ZINC000450878675	FI	On-Demand	Anodyne	HCRTR2	0	40
c1coc(Cn2c(SCC[C@@H]3CCOC3)nnc2-c2cccs2)c1	ZINC000450878676	FI	On-Demand	Anodyne	HCRTR2	0	40
Fc1ccccc1-c1nnc(SC[C@@H]2COCCO2)n1Cc1ccco1	ZINC000450878690	GG	On-Demand	Anodyne	HCRTR2	21	43
Fc1ccccc1-c1nnc(SC[C@H]2COCCO2)n1Cc1ccco1	ZINC000450878691	GG	On-Demand	Anodyne	HCRTR2	21	43
COC(=O)c1csc(CN2CCc3cccc(OC)c3CC2)n1	ZINC000450878698	EF	On-Demand	Anodyne	ABCB1B	41	33
COC(=O)c1csc(CN2CCc3cccc(OC)c3CC2)n1	ZINC000450878698	EF	On-Demand	Anodyne	NOD2	40	38
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H](c2ccccc2)c2nc[nH]n2)nc1	ZINC000450878702	GE	On-Demand	Anodyne	NPY2R	73	38
O=S(=O)(NCC1CC1)c1ccc(NC[C@H](c2ccccc2)c2nc[nH]n2)nc1	ZINC000450878703	GE	On-Demand	Anodyne	NPY2R	73	38
COc1cccc2c1CCN(CCc1cscn1)CC2	ZINC000450878734	CF	On-Demand	Anodyne	DRD2	15	40
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(COc3ccccc3)n2Cc2ccco2)C1	ZINC000450878735	GI	On-Demand	Anodyne	VCP	49	38
C[C@@H]1CCC(=O)[C@H](Sc2nnc(COc3ccccc3)n2Cc2ccco2)C1	ZINC000450878736	GI	On-Demand	Anodyne	VCP	49	38
C[C@H]1CCC(=O)[C@H](Sc2nnc(COc3ccccc3)n2Cc2ccco2)C1	ZINC000450878737	GI	On-Demand	Anodyne	VCP	49	38
C[C@H]1CCC(=O)[C@@H](Sc2nnc(COc3ccccc3)n2Cc2ccco2)C1	ZINC000450878738	GI	On-Demand	Anodyne	VCP	49	38
Cc1ccc(-c2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)cc1	ZINC000450878746	GJ	On-Demand	Anodyne	HCRTR2	20	40
Cc1ccc(-c2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)n2Cc2ccco2)cc1	ZINC000450878747	GJ	On-Demand	Anodyne	HCRTR2	20	40
Fc1cccnc1OC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450878848	EH	On-Demand	Anodyne	SCN9A	22	48
Fc1cccnc1OC1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450878848	EH	On-Demand	Anodyne	SCN5A	90	48
CCCc1nnc(SCCC(=O)NCc2ccc(OC)cc2OC)o1	ZINC000450878850	FF	On-Demand	Anodyne	MTNR1A	49	40
CC(F)(F)CCOc1ccccc1S(N)(=O)=O	ZINC000450878858	CD	On-Demand	Anodyne	CYNT	18	42
COc1ccc(NC(=O)C2(C)CCC(=O)CC2)cc1OC(C)C	ZINC000450878864	DH	On-Demand	Anodyne	ENPP1	52	32
COc1cc(C(C)=O)c(OC)cc1OCc1cccc(C(C)=O)c1	ZINC000450878877	EH	On-Demand	Anodyne	MAOB	19	44
COc1cc(C(C)=O)c(OC)cc1OCc1cccc(C(C)=O)c1	ZINC000450878877	EH	On-Demand	Anodyne	PTGER2	0	40
Cc1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450878878	FG	On-Demand	Bother	GYRB	0	50
C[C@@H](O)CCCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450878882	EE	On-Demand	Anodyne	Q9M629_MAIZE	42	30
C[C@H](O)CCCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450878883	EE	On-Demand	Anodyne	Q9M629_MAIZE	42	30
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@]4(CCOC4)C3)c([N+](=O)[O-])c2)cc1	ZINC000450878893	GI	On-Demand	Bother	TAAR1	41	49
Cc1ccc(NC(=O)c2ccc(N3CCC[C@]4(CCOC4)C3)c([N+](=O)[O-])c2)cc1	ZINC000450878894	GI	On-Demand	Bother	TAAR1	41	49
COc1cc(CN2CC(=O)N(CC3CC3)C2)ccc1Cl	ZINC000450878895	CE	On-Demand	Anodyne	SSTR5	41	35
CCC[C@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450878908	EF	On-Demand	Anodyne	ACOX1	52	35
CCC[C@@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450878909	EF	On-Demand	Anodyne	ACOX1	52	35
CCCCNc1cc(N2CCC[C@]3(CCOC3)C2)nc(N)n1	ZINC000450878911	DE	On-Demand	Anodyne	HRH4	16	41
CCCCNc1cc(N2CCC[C@@]3(CCOC3)C2)nc(N)n1	ZINC000450878912	DE	On-Demand	Anodyne	HRH4	16	41
CC[C@@H](CC#N)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450878948	DF	On-Demand	Mild	TIMP3	59	32
CC[C@@H](CC#N)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450878948	DF	On-Demand	Mild	CTSC	31	44
CC[C@H](CC#N)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450878949	DF	On-Demand	Mild	TIMP3	59	32
CC[C@H](CC#N)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450878949	DF	On-Demand	Mild	CTSC	31	44
CCc1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450878974	EF	On-Demand	Anodyne	DRD2	28	41
CCc1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450878974	EF	On-Demand	Anodyne	DRD4	0	43
CCc1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450878974	EF	On-Demand	Anodyne	SLC18A3	0	40
CCc1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450878974	EF	On-Demand	Anodyne	CYP2J2	51	38
CCc1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450878976	EF	On-Demand	Anodyne	DRD2	28	41
CCc1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450878976	EF	On-Demand	Anodyne	DRD4	0	43
CCc1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450878976	EF	On-Demand	Anodyne	SLC18A3	0	40
CCc1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450878976	EF	On-Demand	Anodyne	CYP2J2	51	38
CCOC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450878986	EF	On-Demand	Anodyne	HPGDS	32	45
CCOC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450878987	EF	On-Demand	Anodyne	HPGDS	32	45
COc1cc(OC)c2ncnc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)c2c1	ZINC000450878989	GF	On-Demand	Anodyne	PDE3A	48	39
COc1cc(OC)c2ncnc(N3CCN(CC(F)(F)F)C[C@@H](C)C3)c2c1	ZINC000450878989	GF	On-Demand	Anodyne	PDE3B	70	38
COc1cc(OC)c2ncnc(N3CCN(CC(F)(F)F)C[C@H](C)C3)c2c1	ZINC000450878990	GF	On-Demand	Anodyne	PDE3A	48	39
COc1cc(OC)c2ncnc(N3CCN(CC(F)(F)F)C[C@H](C)C3)c2c1	ZINC000450878990	GF	On-Demand	Anodyne	PDE3B	70	38
FC(F)(F)C1CCC(Sc2ccc3nnc(-c4ccsc4)n3n2)CC1	ZINC000450879009	GK	On-Demand	Anodyne	LRRK2	41	40
CCN(C(=O)c1ccc(C2CC2)nc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450879015	FI	On-Demand	Anodyne	DRD4	37	40
CCN(C(=O)c1ccc(C2CC2)nc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450879015	FI	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)c1ccc(C2CC2)nc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450879015	FI	On-Demand	Anodyne	SIGMAR1	28	40
CCN(C(=O)c1ccc(C2CC2)nc1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450879015	FI	On-Demand	Anodyne	CCR5	59	44
CCN(C(=O)c1ccc(C2CC2)nc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450879016	FI	On-Demand	Anodyne	DRD4	37	40
CCN(C(=O)c1ccc(C2CC2)nc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450879016	FI	On-Demand	Anodyne	ACHE	27	42
CCN(C(=O)c1ccc(C2CC2)nc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450879016	FI	On-Demand	Anodyne	SIGMAR1	28	40
CCN(C(=O)c1ccc(C2CC2)nc1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450879016	FI	On-Demand	Anodyne	CCR5	59	44
O=C(c1c(Cl)cc(Cl)cc1Cl)N1CCn2c(O)nnc2C1	ZINC000450879028	EF	On-Demand	Anodyne	P2RX7	38	46
O=[N+]([O-])c1cccnc1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450879029	DH	On-Demand	Bother	PRCP	46	39
O=[N+]([O-])c1cccnc1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450879029	DH	On-Demand	Bother	KCNN3	31	46
O=[N+]([O-])c1cccnc1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450879030	DH	On-Demand	Bother	PRCP	46	39
O=[N+]([O-])c1cccnc1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450879030	DH	On-Demand	Bother	KCNN3	31	46
CN1CCC2(CCN(CCCC(=O)c3ccc(Br)cc3)CC2)C1=O	ZINC000450879048	GG	On-Demand	Anodyne	DRD2	34	48
CN1CCC2(CCN(CCCC(=O)c3ccc(Br)cc3)CC2)C1=O	ZINC000450879048	GG	On-Demand	Anodyne	DRD1	15	44
CN1CCC2(CCN(CCCC(=O)c3ccc(Br)cc3)CC2)C1=O	ZINC000450879048	GG	On-Demand	Anodyne	DRD4	0	46
CN1CCC2(CCN(CCCC(=O)c3ccc(Br)cc3)CC2)C1=O	ZINC000450879048	GG	On-Demand	Anodyne	ERG2	21	46
CN1CCC2(CCN(CCCC(=O)c3ccc(Br)cc3)CC2)C1=O	ZINC000450879048	GG	On-Demand	Anodyne	SLC18A3	42	52
CN1CCC2(CCN(CCCC(=O)c3ccc(Br)cc3)CC2)C1=O	ZINC000450879048	GG	On-Demand	Anodyne	CYP2J2	56	40
Cc1ccc(CSCC[C@@H](C)O)cc1C	ZINC000450879057	BG	On-Demand	Anodyne	CACNA2D1	38	63
Cc1ccc(CSCC[C@H](C)O)cc1C	ZINC000450879062	BG	On-Demand	Anodyne	CACNA2D1	38	63
C[C@@H]1CN(CC(F)(F)F)CCN(c2cc(C#N)ccn2)C1	ZINC000450879070	CE	On-Demand	Mild	MAP3K12	44	32
C[C@H]1CN(CC(F)(F)F)CCN(c2cc(C#N)ccn2)C1	ZINC000450879071	CE	On-Demand	Mild	MAP3K12	44	32
C[C@@H](c1ccc(CN2CCC3(CC2)CCN(C)C3=O)cc1)C(F)(F)F	ZINC000450879100	FH	On-Demand	Anodyne	SIGMAR1	19	41
C[C@H](c1ccc(CN2CCC3(CC2)CCN(C)C3=O)cc1)C(F)(F)F	ZINC000450879101	FH	On-Demand	Anodyne	SIGMAR1	19	41
Fc1ccc2c(NC3CCN(C4CCC4)CC3)ccnc2c1	ZINC000450879114	CH	On-Demand	Anodyne	HNMT	54	34
C[C@H]1CN(CCN(C)CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450879118	EF	On-Demand	Anodyne	DRD4	0	47
C[C@H]1CN(CCN(C)CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450879118	EF	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1CN(CCN(C)CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450879118	EF	On-Demand	Anodyne	CYP2J2	47	34
CCCc1nc(C)c(CSc2nnc(-c3ccccn3)n2Cc2ccco2)o1	ZINC000450879120	GJ	On-Demand	Anodyne	HCRTR2	19	40
CO[C@@H](Cc1ccccc1)CN1CCC2(CC1)CCN(C)C2=O	ZINC000450879131	DE	On-Demand	Anodyne	SLC18A3	40	39
CO[C@H](Cc1ccccc1)CN1CCC2(CC1)CCN(C)C2=O	ZINC000450879132	DE	On-Demand	Anodyne	SLC18A3	40	39
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450879135	DF	On-Demand	Anodyne	SORD	46	34
C[C@H]1CN(CC(F)(F)F)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450879137	DF	On-Demand	Anodyne	SORD	46	34
Cn1cc([C@H]2CCCCN2C(=O)CSC2CC2)cn1	ZINC000450879138	CE	On-Demand	Anodyne	COLA	42	33
Cn1cc([C@@H]2CCCCN2C(=O)CSC2CC2)cn1	ZINC000450879142	CE	On-Demand	Anodyne	COLA	42	33
CCOC(=O)c1ccc(CSc2nnc(-c3ccc(C)cc3)n2CC)nc1	ZINC000450879143	GI	On-Demand	Anodyne	SLC27A1	31	40
CNS(=O)(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nc1	ZINC000450879149	FD	On-Demand	Anodyne	GCKR	45	42
CCOc1ccc(-n2c(SC[C@@H]3C[C@H]4CC[C@H]3O4)nnc2-c2ccco2)cc1	ZINC000450879151	GJ	On-Demand	Anodyne	CACNA2D1	56	36
CCOc1ccc(-n2c(SC[C@H]3C[C@H]4CC[C@H]3O4)nnc2-c2ccco2)cc1	ZINC000450879158	GJ	On-Demand	Anodyne	CACNA2D1	56	36
CCn1c(S[C@H](C)C(=O)C2CCCCC2)nnc1-c1ccc([N+](=O)[O-])cc1	ZINC000450879166	GJ	On-Demand	Bother	SLC27A4	43	33
CCn1c(S[C@@H](C)C(=O)C2CCCCC2)nnc1-c1ccc([N+](=O)[O-])cc1	ZINC000450879168	GJ	On-Demand	Bother	SLC27A4	43	33
c1cc(NC2CCN(C3CCC3)CC2)nc(N2CCCCC2)n1	ZINC000450879181	DE	On-Demand	Anodyne	CCR4	23	42
c1cc(NC2CCN(C3CCC3)CC2)nc(N2CCCCC2)n1	ZINC000450879181	DE	On-Demand	Anodyne	PRKD1	49	40
COc1cc(OC)c2ncnc(NCCN3CCC(O)CC3)c2c1	ZINC000450879191	EC	On-Demand	Anodyne	P2RX2	17	42
COc1cc(OC)c2ncnc(NCCN3CCC(O)CC3)c2c1	ZINC000450879191	EC	On-Demand	Anodyne	PDE6A	41	32
CCOC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)nc1	ZINC000450879198	FG	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)nc1	ZINC000450879198	FG	On-Demand	Anodyne	NPFFR1	41	42
CCOC(=O)c1ccc(CN2CCC(CO)(Cc3ccccc3)CC2)nc1	ZINC000450879198	FG	On-Demand	Anodyne	SLC12A5	62	34
CN(CCN(C)Cc1ccccc1)CCN1CCOC(C)(C)C1	ZINC000450879220	DE	On-Demand	Anodyne	SIGMAR1	22	46
CC[C@H](S[C@@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879228	DI	On-Demand	Anodyne	MAP	0	46
CC[C@H](S[C@@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879228	DI	On-Demand	Anodyne	MAP1	134	46
CC[C@H](S[C@@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879228	DI	On-Demand	Anodyne	FFAR2	24	47
CCS(=O)(=O)c1ccc(CN2CCC(F)(c3ccccc3)CC2)cc1	ZINC000450879240	FH	On-Demand	Anodyne	ADAM17	24	45
CCS(=O)(=O)c1ccc(CN2CCC(F)(c3ccccc3)CC2)cc1	ZINC000450879240	FH	On-Demand	Anodyne	NPFFR1	44	36
CCOC(=O)c1ccc(CN2C[C@@H](O)Cc3ccccc32)nc1	ZINC000450879243	DE	On-Demand	Anodyne	TPP2	41	34
CCOC(=O)c1ccc(CN2C[C@H](O)Cc3ccccc32)nc1	ZINC000450879244	DE	On-Demand	Anodyne	TPP2	41	34
O=S1(=O)CCCN1[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450879249	EE	On-Demand	Anodyne	BIRC2	44	41
O=S1(=O)CCCN1[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450879250	EE	On-Demand	Anodyne	BIRC2	44	41
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	DRD2	25	53
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	DRD4	38	40
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	ACHE	24	42
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	HTR2A	20	61
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	HRH1	26	40
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	DRD3	0	45
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	HTR4	34	42
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	CHRM3	23	40
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	HRH3	17	44
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	SIGMAR1	41	54
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	SSTR5	52	43
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	CCR3	88	47
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	SLC18A3	36	54
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	MLNR	70	46
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	CXCR3	28	42
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	MCHR1	55	48
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	CACNA1G	60	47
COC(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1Cl	ZINC000450879258	GI	On-Demand	Anodyne	WNT3A	59	38
CCS(=O)(=O)c1ccc(CN2CCSC(C)(C)CC2)cc1	ZINC000450879266	EG	On-Demand	Anodyne	ADAM17	19	40
CCn1cc([C@H](C)Nc2ncnc3cc(Br)ccc23)cn1	ZINC000450879290	EH	On-Demand	Anodyne	EGFR	50	39
CCn1cc([C@H](C)Nc2ncnc3cc(Br)ccc23)cn1	ZINC000450879290	EH	On-Demand	Anodyne	HTT	0	40
CCn1cc([C@@H](C)Nc2ncnc3cc(Br)ccc23)cn1	ZINC000450879292	EH	On-Demand	Anodyne	EGFR	50	39
CCn1cc([C@@H](C)Nc2ncnc3cc(Br)ccc23)cn1	ZINC000450879292	EH	On-Demand	Anodyne	HTT	0	40
COC(=O)c1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)cc1Cl	ZINC000450879293	GI	On-Demand	Anodyne	SSTR5	53	38
COC(=O)c1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)cc1Cl	ZINC000450879293	GI	On-Demand	Anodyne	CCR3	24	40
COC(=O)c1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)cc1Cl	ZINC000450879293	GI	On-Demand	Anodyne	MCHR1	29	44
O=C(NC1CC1)c1ccc(NC[C@@H](c2ccccc2)c2nc[nH]n2)c([N+](=O)[O-])c1	ZINC000450879341	GF	On-Demand	Bother	TAAR1	17	42
O=C(NC1CC1)c1ccc(NC[C@H](c2ccccc2)c2nc[nH]n2)c([N+](=O)[O-])c1	ZINC000450879342	GF	On-Demand	Bother	TAAR1	17	42
Cc1ccc(-c2nnc(SC[C@@H]3COCCO3)n2Cc2ccco2)cc1	ZINC000450879352	FG	On-Demand	Anodyne	HCRTR2	21	45
Cc1ccc(-c2nnc(SC[C@H]3COCCO3)n2Cc2ccco2)cc1	ZINC000450879353	FG	On-Demand	Anodyne	HCRTR2	21	45
CC[C@H](Nc1ccc(C(=O)NCCOC)cn1)C1CCCC1	ZINC000450879366	DF	On-Demand	Anodyne	GCK	22	41
CC[C@@H](Nc1ccc(C(=O)NCCOC)cn1)C1CCCC1	ZINC000450879367	DF	On-Demand	Anodyne	GCK	22	41
Cc1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450879379	FG	On-Demand	Bother	GYRB	0	50
Cc1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450879380	FG	On-Demand	Bother	GYRB	0	50
Cc1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450879381	FG	On-Demand	Bother	GYRB	0	50
CC(=O)c1ccc(NC2(C3(C)CC3)CC2)c([N+](=O)[O-])c1	ZINC000450879382	CH	On-Demand	Bother	TAAR1	17	42
CC(=O)c1ccc(NC2(C3(C)CC3)CC2)c([N+](=O)[O-])c1	ZINC000450879382	CH	On-Demand	Bother	AKR1C3	17	49
CC1(C2(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)N3CCCC3)CC2)CC1	ZINC000450879415	FG	On-Demand	Bother	TBXA2R	18	42
c1ccc(OC2CC2)c(CN2CCC(Oc3cnccn3)CC2)c1	ZINC000450879421	EG	On-Demand	Anodyne	SCN5A	61	35
O[C@@H]([C@H]1CCN(c2ccnc(Cc3ccccc3)n2)C1)C(F)(F)F	ZINC000450879428	EF	On-Demand	Anodyne	SORD	79	40
O[C@@H]([C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C1)C(F)(F)F	ZINC000450879429	EF	On-Demand	Anodyne	SORD	79	40
O[C@H]([C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C1)C(F)(F)F	ZINC000450879430	EF	On-Demand	Anodyne	SORD	79	40
O[C@H]([C@H]1CCN(c2ccnc(Cc3ccccc3)n2)C1)C(F)(F)F	ZINC000450879431	EF	On-Demand	Anodyne	SORD	79	40
COc1cccc(C2(NCc3c(C)cccc3Cl)CCOCC2)c1F	ZINC000450879459	FJ	On-Demand	Anodyne	EIF2AK1	44	39
CC[C@@H](S[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879479	DI	On-Demand	Anodyne	MAP	0	46
CC[C@@H](S[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879479	DI	On-Demand	Anodyne	MAP1	134	46
CC[C@@H](S[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879479	DI	On-Demand	Anodyne	FFAR2	24	47
CC[C@@H](S[C@@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879480	DI	On-Demand	Anodyne	MAP	0	46
CC[C@@H](S[C@@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879480	DI	On-Demand	Anodyne	MAP1	134	46
CC[C@@H](S[C@@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879480	DI	On-Demand	Anodyne	FFAR2	24	47
CC[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879481	DI	On-Demand	Anodyne	MAP	0	46
CC[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879481	DI	On-Demand	Anodyne	MAP1	134	46
CC[C@H](S[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450879481	DI	On-Demand	Anodyne	FFAR2	24	47
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	DRD2	28	40
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	DRD1	16	44
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	HTR2A	25	46
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	HTR2C	21	48
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	SLC6A1	97	36
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879513	GI	On-Demand	Anodyne	CYP2J2	53	37
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	DRD2	28	40
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	DRD1	16	44
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	HTR2A	25	46
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	HTR2C	21	48
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	SLC6A1	97	36
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1)c1ccc(F)cc1	ZINC000450879514	GI	On-Demand	Anodyne	CYP2J2	53	37
COc1cc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)ccc1O	ZINC000450879518	EE	On-Demand	Anodyne	OPRK1	34	40
COc1cc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)ccc1O	ZINC000450879518	EE	On-Demand	Anodyne	TRPV1	17	41
COc1cc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)ccc1O	ZINC000450879518	EE	On-Demand	Anodyne	COLA	63	35
COc1cc(CC(=O)N2CCCC[C@H]2c2cnn(C)c2)ccc1O	ZINC000450879518	EE	On-Demand	Anodyne	CPT1A	61	35
COc1cc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)ccc1O	ZINC000450879519	EE	On-Demand	Anodyne	OPRK1	34	40
COc1cc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)ccc1O	ZINC000450879519	EE	On-Demand	Anodyne	TRPV1	17	41
COc1cc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)ccc1O	ZINC000450879519	EE	On-Demand	Anodyne	COLA	63	35
COc1cc(CC(=O)N2CCCC[C@@H]2c2cnn(C)c2)ccc1O	ZINC000450879519	EE	On-Demand	Anodyne	CPT1A	61	35
CC(=O)c1ccc(Br)cc1OCC[C@@H](C)O	ZINC000450879528	CF	On-Demand	Anodyne	FOLH1	20	40
CC(=O)c1ccc(Br)cc1OCC[C@H](C)O	ZINC000450879529	CF	On-Demand	Anodyne	FOLH1	20	40
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1ccc(C(C)=O)cc1	ZINC000450879616	EH	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1ccc(C(C)=O)cc1	ZINC000450879616	EH	On-Demand	Anodyne	SLC6A3	20	41
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1ccc(C(C)=O)cc1	ZINC000450879616	EH	On-Demand	Anodyne	LTA4H	24	43
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1ccc(C(C)=O)cc1	ZINC000450879616	EH	On-Demand	Anodyne	SIGMAR1	22	40
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2OC(F)F)cn1	ZINC000450879620	GJ	On-Demand	Anodyne	KLKB1	32	43
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2OC(F)F)cn1	ZINC000450879620	GJ	On-Demand	Anodyne	F10	52	45
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2OC(F)F)cn1	ZINC000450879620	GJ	On-Demand	Anodyne	PYGL	17	41
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2OC(F)F)cn1	ZINC000450879620	GJ	On-Demand	Anodyne	GCK	25	41
CC1=CCN(CCNC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450879634	DD	On-Demand	Anodyne	DRD4	43	34
CC1=CCN(CCNC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450879634	DD	On-Demand	Anodyne	PLD2	53	34
Cn1c(COc2ccccc2)nnc1SCC1=CCCCC1	ZINC000450879643	DH	On-Demand	Anodyne	VCP	56	42
N#CC1(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCC1	ZINC000450879646	FH	On-Demand	Mild	EPHX2	24	42
CC(C)(CC(=O)CSc1nnc(-c2ccco2)n1Cc1ccco1)C1CC1	ZINC000450879666	GJ	On-Demand	Anodyne	HCRTR2	24	47
Cc1ccnc(N2CCN(C(C)(C)CC(C)(C)C)CC2)n1	ZINC000450879671	CG	On-Demand	Anodyne	SORD	29	40
Cc1ccnc(N2CCN(C(C)(C)CC(C)(C)C)CC2)n1	ZINC000450879671	CG	On-Demand	Anodyne	SLC6A7	0	47
CCc1cc(CCCSc2nnc(-c3cnccn3)n2C)on1	ZINC000450879678	EF	On-Demand	Anodyne	DRD3	48	38
CC(F)(F)CCSc1nnc(-c2ccco2)n1Cc1ccco1	ZINC000450879690	EI	On-Demand	Anodyne	HCRTR2	22	43
Cc1ccc(-n2c(S[C@@H]3CC[C@H](C#N)C3)nnc2-c2ccccn2)cc1	ZINC000450879704	FI	On-Demand	Mild	VCP	47	37
Cc1ccc(-n2c(S[C@@H]3CC[C@@H](C#N)C3)nnc2-c2ccccn2)cc1	ZINC000450879706	FI	On-Demand	Mild	VCP	47	37
CCNC(=O)c1ccc(N2CCN(C(C)(C)CC(C)(C)C)CC2)nn1	ZINC000450879707	EF	On-Demand	Anodyne	SCD1	36	48
Cc1ccc(-n2c(S[C@H]3CC[C@H](C#N)C3)nnc2-c2ccccn2)cc1	ZINC000450879708	FI	On-Demand	Mild	VCP	47	37
Cc1ccc(-n2c(S[C@H]3CC[C@@H](C#N)C3)nnc2-c2ccccn2)cc1	ZINC000450879711	FI	On-Demand	Mild	VCP	47	37
CC(=O)CCCCCSc1nnc(-c2ccccn2)n1-c1ccccc1	ZINC000450879720	FJ	On-Demand	Anodyne	FAAH	26	42
CCn1cc([C@@H](C)Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])cn1	ZINC000450879724	FE	On-Demand	Bother	BCL2L1	66	36
CCn1cc([C@@H](C)Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])cn1	ZINC000450879724	FE	On-Demand	Bother	BCL2	45	32
CCn1cc([C@H](C)Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])cn1	ZINC000450879726	FE	On-Demand	Bother	BCL2L1	66	36
CCn1cc([C@H](C)Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])cn1	ZINC000450879726	FE	On-Demand	Bother	BCL2	45	32
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H](C)CN1CCOCC1	ZINC000450879730	DD	On-Demand	Anodyne	CASR	48	37
C[C@@H](CN1CCOCC1)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450879731	DD	On-Demand	Anodyne	CASR	48	37
C[C@@H](CN1CCOCC1)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450879732	DD	On-Demand	Anodyne	CASR	48	37
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H](C)CN1CCOCC1	ZINC000450879733	DD	On-Demand	Anodyne	CASR	48	37
CCOc1ccc(-n2c(S[C@H]3CC[C@@H](C#N)C3)nnc2-c2ccco2)cc1	ZINC000450879742	GJ	On-Demand	Mild	CACNA2D1	53	35
CCOc1ccc(-n2c(S[C@H]3CC[C@@H](C#N)C3)nnc2-c2ccco2)cc1	ZINC000450879742	GJ	On-Demand	Mild	VCP	52	35
CCOc1ccc(-n2c(S[C@@H]3CC[C@@H](C#N)C3)nnc2-c2ccco2)cc1	ZINC000450879745	GJ	On-Demand	Mild	CACNA2D1	53	35
CCOc1ccc(-n2c(S[C@@H]3CC[C@@H](C#N)C3)nnc2-c2ccco2)cc1	ZINC000450879745	GJ	On-Demand	Mild	VCP	52	35
CCOc1ccc(-n2c(S[C@@H]3CC[C@H](C#N)C3)nnc2-c2ccco2)cc1	ZINC000450879747	GJ	On-Demand	Mild	CACNA2D1	53	35
CCOc1ccc(-n2c(S[C@@H]3CC[C@H](C#N)C3)nnc2-c2ccco2)cc1	ZINC000450879747	GJ	On-Demand	Mild	VCP	52	35
CCOc1ccc(-n2c(S[C@H]3CC[C@H](C#N)C3)nnc2-c2ccco2)cc1	ZINC000450879749	GJ	On-Demand	Mild	CACNA2D1	53	35
CCOc1ccc(-n2c(S[C@H]3CC[C@H](C#N)C3)nnc2-c2ccco2)cc1	ZINC000450879749	GJ	On-Demand	Mild	VCP	52	35
CN1CCN(c2nc3ccccc3nc2NC2CCN(C3CCC3)CC2)CC1	ZINC000450879755	GF	On-Demand	Anodyne	HTR3A	26	47
CN1CCN(c2nc3ccccc3nc2NC2CCN(C3CCC3)CC2)CC1	ZINC000450879755	GF	On-Demand	Anodyne	HRH4	24	47
CN1CCN(c2nc3ccccc3nc2NC2CCN(C3CCC3)CC2)CC1	ZINC000450879755	GF	On-Demand	Anodyne	EHMT2	42	40
c1nc(NC2CCN(C3CCC3)CC2)cc(N2CCCCC2)n1	ZINC000450879761	DF	On-Demand	Anodyne	PRKD1	41	37
COc1cc(OC)nc(NC[C@H](c2ccccc2)c2nc[nH]n2)n1	ZINC000450879764	ED	On-Demand	Anodyne	ALS	52	33
COc1cc(OC)nc(NC[C@@H](c2ccccc2)c2nc[nH]n2)n1	ZINC000450879765	ED	On-Demand	Anodyne	ALS	52	33
CCS(=O)(=O)c1ccc(CN2CCc3cccc(OC)c3CC2)cc1	ZINC000450879768	FG	On-Demand	Anodyne	HTR1A	15	61
CCS(=O)(=O)c1ccc(CN2CCc3cccc(OC)c3CC2)cc1	ZINC000450879768	FG	On-Demand	Anodyne	DRD2	17	46
CCS(=O)(=O)c1ccc(CN2CCc3cccc(OC)c3CC2)cc1	ZINC000450879768	FG	On-Demand	Anodyne	DRD4	21	41
CCS(=O)(=O)c1ccc(CN2CCc3cccc(OC)c3CC2)cc1	ZINC000450879768	FG	On-Demand	Anodyne	ABCB1	17	40
CCS(=O)(=O)c1ccc(CN2CCc3cccc(OC)c3CC2)cc1	ZINC000450879768	FG	On-Demand	Anodyne	NOD2	43	39
CCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450879774	FH	On-Demand	Anodyne	SIGMAR1	23	42
CCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450879774	FH	On-Demand	Anodyne	SSTR5	63	38
CCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450879774	FH	On-Demand	Anodyne	CCR3	28	40
CCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450879774	FH	On-Demand	Anodyne	CCR5	46	31
CCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450879774	FH	On-Demand	Anodyne	MCHR1	35	44
CCn1nccc1C1CCN(CC2CCC(=O)CC2)CC1	ZINC000450879787	CF	On-Demand	Anodyne	CCR5	44	30
CCn1c(COc2ccc(Cl)cc2)nnc1S[C@@H]1C[C@@H](C)CCC1=O	ZINC000450879797	GI	On-Demand	Anodyne	VCP	54	40
CCn1c(COc2ccc(Cl)cc2)nnc1S[C@H]1C[C@@H](C)CCC1=O	ZINC000450879803	GI	On-Demand	Anodyne	VCP	54	40
CCn1c(COc2ccc(Cl)cc2)nnc1S[C@@H]1C[C@H](C)CCC1=O	ZINC000450879804	GI	On-Demand	Anodyne	VCP	54	40
CCn1c(COc2ccc(Cl)cc2)nnc1S[C@H]1C[C@H](C)CCC1=O	ZINC000450879805	GI	On-Demand	Anodyne	VCP	54	40
COc1ccc(CNC(=O)CCN2CCOc3ccc(F)cc3C2)c(OC)c1	ZINC000450879806	GF	On-Demand	Anodyne	HTR7	28	41
COc1ccc(CNC(=O)CCN2CCOc3ccc(F)cc3C2)c(OC)c1	ZINC000450879806	GF	On-Demand	Anodyne	MTNR1A	29	40
CC1CN(c2ccnc(C3CC3)n2)CCN(c2ccnc(C3CC3)n2)C1	ZINC000450879818	FF	On-Demand	Anodyne	SORD	68	40
COC(=O)C1(CN2CCC(F)(c3ccccc3)CC2)CC1	ZINC000450879819	CF	On-Demand	Anodyne	ADRA1D	33	40
COC(=O)C1(CN2CCC(F)(c3ccccc3)CC2)CC1	ZINC000450879819	CF	On-Demand	Anodyne	ADRA1A	28	40
COC(=O)C1(CN2CCC(F)(c3ccccc3)CC2)CC1	ZINC000450879819	CF	On-Demand	Anodyne	ADRA1B	26	40
CCS(=O)(=O)c1ccccc1NC1CCN(C2CCC2)CC1	ZINC000450879840	DF	On-Demand	Anodyne	CCR8	49	33
CNS(=O)(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nc1	ZINC000450879842	FD	On-Demand	Anodyne	GCKR	45	42
CC(=O)CCCCCSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450879846	FI	On-Demand	Anodyne	HCRTR2	23	46
CSc1ccc2ncnc(NC3CCN(C4CCC4)CC3)c2c1	ZINC000450879847	EH	On-Demand	Anodyne	CCR4	22	41
CSc1ccc2ncnc(NC3CCN(C4CCC4)CC3)c2c1	ZINC000450879847	EH	On-Demand	Anodyne	CD38	62	47
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450879850	FG	On-Demand	Anodyne	LIMK2	51	34
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450879851	FG	On-Demand	Anodyne	LIMK2	51	34
Cc1ccc2c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)ccnc2n1	ZINC000450879858	EG	On-Demand	Anodyne	HTR1D	45	32
Cc1ccc2c(N3CCN(CC(F)(F)F)C[C@H](C)C3)ccnc2n1	ZINC000450879859	EG	On-Demand	Anodyne	HTR1D	45	32
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cccc(F)c23)C1	ZINC000450879877	EG	On-Demand	Anodyne	LIMK2	47	33
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cccc(F)c23)C1	ZINC000450879878	EG	On-Demand	Anodyne	LIMK2	47	33
CCc1cc(CCCN2CCC(Oc3ncccc3C)CC2)on1	ZINC000450879888	EG	On-Demand	Anodyne	SCN5A	42	32
CC(C)NS(=O)(=O)c1cccnc1N1CCN(CC(F)(F)F)C[C@@H](C)C1	ZINC000450879899	GE	On-Demand	Anodyne	PRKCQ	40	31
CC(C)NS(=O)(=O)c1cccnc1N1CCN(CC(F)(F)F)C[C@H](C)C1	ZINC000450879900	GE	On-Demand	Anodyne	PRKCQ	40	31
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450879911	FC	On-Demand	Anodyne	SCD1	50	46
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450879912	FC	On-Demand	Anodyne	SCD1	50	46
CS(=O)(=O)c1cccnc1N1CC(c2cccc(C(F)(F)F)c2)C1	ZINC000450879931	FG	On-Demand	Anodyne	CACNA1B	49	39
CNC(=O)c1ccc(SC2CCC(C(F)(F)F)CC2)c([N+](=O)[O-])c1	ZINC000450879948	FI	On-Demand	Bother	GSTM2	59	32
COc1cc(CN2CCC(Oc3cnccn3)CC2)ccc1Cl	ZINC000450879953	EG	On-Demand	Anodyne	HRH1	26	41
COc1cc(CN2CCC(Oc3cnccn3)CC2)ccc1Cl	ZINC000450879953	EG	On-Demand	Anodyne	SSTR5	74	46
COc1cc(CN2CCC(Oc3cnccn3)CC2)ccc1Cl	ZINC000450879953	EG	On-Demand	Anodyne	UTS2R	23	41
CCN(C(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450879969	FD	On-Demand	Anodyne	DRD4	39	42
CCN(C(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450879969	FD	On-Demand	Anodyne	ACHE	33	43
CCN(C(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450879969	FD	On-Demand	Anodyne	SIGMAR1	50	44
CCN(C(=O)CS(=O)(=O)C1CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450879969	FD	On-Demand	Anodyne	CCR5	66	49
CCN(C(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450879972	FD	On-Demand	Anodyne	DRD4	39	42
CCN(C(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450879972	FD	On-Demand	Anodyne	ACHE	33	43
CCN(C(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450879972	FD	On-Demand	Anodyne	SIGMAR1	50	44
CCN(C(=O)CS(=O)(=O)C1CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450879972	FD	On-Demand	Anodyne	CCR5	66	49
CCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nn1	ZINC000450879975	ED	On-Demand	Anodyne	SCD1	49	42
CCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)nn1	ZINC000450879975	ED	On-Demand	Anodyne	SCD	41	42
C=CCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450879982	ED	On-Demand	Mild	HPGDS	30	41
C=CCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450879983	ED	On-Demand	Mild	HPGDS	30	41
C=CCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450879984	ED	On-Demand	Mild	HPGDS	30	41
C=CCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450879985	ED	On-Demand	Mild	HPGDS	30	41
CCCOc1cccc(Cn2cc(Br)cc([N+](=O)[O-])c2=O)c1	ZINC000450879996	FG	On-Demand	Bother	UPP1	45	40
CCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450880013	EG	On-Demand	Anodyne	CCR2	71	39
CCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450880013	EG	On-Demand	Anodyne	PDS	45	33
O=C(CCCN1CC[C@@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880057	FG	On-Demand	Anodyne	DRD2	28	44
O=C(CCCN1CC[C@@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880057	FG	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CC[C@@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880057	FG	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CC[C@@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880057	FG	On-Demand	Anodyne	SLC18A3	25	45
O=C(CCCN1CC[C@@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880057	FG	On-Demand	Anodyne	CYP2J2	55	39
O=C(CCCN1CC[C@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880058	FG	On-Demand	Anodyne	DRD2	28	44
O=C(CCCN1CC[C@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880058	FG	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CC[C@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880058	FG	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CC[C@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880058	FG	On-Demand	Anodyne	SLC18A3	25	45
O=C(CCCN1CC[C@](O)(C2CC2)C1)c1ccc(Br)cc1	ZINC000450880058	FG	On-Demand	Anodyne	CYP2J2	55	39
CCOc1ccc(-n2c(SC[C@H](O)CC#N)nnc2-c2cnccn2)cc1	ZINC000450880063	GE	On-Demand	Mild	CACNA2D1	57	36
CO[C@@H](Cc1ccccc1)CN1CC[C@](O)(C2CC2)C1	ZINC000450880070	CE	On-Demand	Anodyne	OPRL1	23	41
CO[C@H](Cc1ccccc1)CN1CC[C@](O)(C2CC2)C1	ZINC000450880071	CE	On-Demand	Anodyne	OPRL1	23	41
CO[C@@H](Cc1ccccc1)CN1CC[C@@](O)(C2CC2)C1	ZINC000450880072	CE	On-Demand	Anodyne	OPRL1	23	41
CO[C@H](Cc1ccccc1)CN1CC[C@@](O)(C2CC2)C1	ZINC000450880073	CE	On-Demand	Anodyne	OPRL1	23	41
COCCN(CCCC(=O)c1ccc(F)cc1)[C@H]1CCOC1	ZINC000450880082	DF	On-Demand	Anodyne	PDEC	0	40
COCCN(CCCC(=O)c1ccc(F)cc1)[C@@H]1CCOC1	ZINC000450880083	DF	On-Demand	Anodyne	PDEC	0	40
C=CCn1c(COc2ccccc2)nnc1SCc1nnc(C2CC2)s1	ZINC000450880092	GI	On-Demand	Mild	VCP	47	39
CCOc1ccc(-n2c(SCC3(C#N)CCC3)nnc2-c2cnccn2)cc1	ZINC000450880130	GH	On-Demand	Mild	CACNA2D1	59	36
CCOc1ccc(-n2c(SCC3(C#N)CCC3)nnc2-c2cnccn2)cc1	ZINC000450880130	GH	On-Demand	Mild	VCP	52	36
CN(CCN1CC[C@@](O)(C2CC2)C1)Cc1ccccc1	ZINC000450880133	CD	On-Demand	Anodyne	OPRL1	20	43
CN(CCN1CC[C@@](O)(C2CC2)C1)Cc1ccccc1	ZINC000450880133	CD	On-Demand	Anodyne	SIGMAR1	75	43
CN(CCN1CC[C@](O)(C2CC2)C1)Cc1ccccc1	ZINC000450880134	CD	On-Demand	Anodyne	OPRL1	20	43
CN(CCN1CC[C@](O)(C2CC2)C1)Cc1ccccc1	ZINC000450880134	CD	On-Demand	Anodyne	SIGMAR1	75	43
CC(C)(C)CC(C)(C)N1CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)CC1	ZINC000450880169	GH	On-Demand	Bother	HRH4	15	42
CC(C)(C)CC(C)(C)N1CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)CC1	ZINC000450880169	GH	On-Demand	Bother	F2RL3	44	33
CCc1nc(C)cc(N2CCN(c3cc(C)nc(CC)n3)CC(C)C2)n1	ZINC000450880182	FF	On-Demand	Anodyne	SORD	20	41
COC(=O)c1coc(CN2CCC(F)(c3ccccc3)CC2)n1	ZINC000450880190	DF	On-Demand	Anodyne	MGEA5	24	50
C[C@@H](CN1CCOCC1)N(C)CCCC(=O)c1ccc(F)cc1	ZINC000450880202	DE	On-Demand	Anodyne	DRD2	29	41
C[C@H](CN1CCOCC1)N(C)CCCC(=O)c1ccc(F)cc1	ZINC000450880203	DE	On-Demand	Anodyne	DRD2	29	41
CC(=O)c1ccc(N2CCC[C@]3(CCOC3)C2)nc1	ZINC000450880213	CE	On-Demand	Anodyne	HDAC1	0	42
CC(=O)c1ccc(N2CCC[C@@]3(CCOC3)C2)nc1	ZINC000450880215	CE	On-Demand	Anodyne	HDAC1	0	42
CC1CN(c2ccc(C#N)cn2)CCN(c2ccc(C#N)cn2)C1	ZINC000450880227	DE	On-Demand	Mild	SGPL1	0	47
COc1nccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450880228	GF	On-Demand	Anodyne	P2RY12	23	43
COc1nccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450880228	GF	On-Demand	Anodyne	PDGFRB	39	41
COc1nccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450880228	GF	On-Demand	Anodyne	TRPV1	18	41
COc1nccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450880228	GF	On-Demand	Anodyne	KDR	25	43
COc1nccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450880228	GF	On-Demand	Anodyne	FAAH	24	56
COc1nccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450880228	GF	On-Demand	Anodyne	CCR2	24	48
COc1nccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450880228	GF	On-Demand	Anodyne	EPHX2	23	42
COc1nccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450880228	GF	On-Demand	Anodyne	BRAF	38	40
COC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1Cl	ZINC000450880229	EG	On-Demand	Anodyne	DRD4	30	41
COC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1Cl	ZINC000450880229	EG	On-Demand	Anodyne	DRD3	23	41
COC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1Cl	ZINC000450880229	EG	On-Demand	Anodyne	OPRK1	32	41
COC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1Cl	ZINC000450880229	EG	On-Demand	Anodyne	SIGMAR1	23	42
COC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1Cl	ZINC000450880229	EG	On-Demand	Anodyne	CCR3	42	42
COC(=O)c1ccc(CN2CCC(n3ccc(C)n3)CC2)cc1Cl	ZINC000450880229	EG	On-Demand	Anodyne	MCHR1	37	45
CC(C)OC(C)(C)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450880266	FF	On-Demand	Anodyne	SCD	29	40
CC(C)OC(C)(C)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450880267	FF	On-Demand	Anodyne	SCD	29	40
Cc1cccc(Cl)c1CN1CCC(Oc2cnccn2)CC1	ZINC000450880272	DG	On-Demand	Anodyne	SCN5A	53	34
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450880286	GD	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@H](C)NC(=O)c1ccc(N2CCC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450880287	GD	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@H](C)NC(=O)c1ccc(N2CCC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450880288	GD	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450880289	GD	On-Demand	Bother	TAAR1	20	44
Cn1c(COc2ccccc2)nnc1SCC[C@H]1CCOC1	ZINC000450880290	DF	On-Demand	Anodyne	VCP	57	42
Cn1c(COc2ccccc2)nnc1SCC[C@@H]1CCOC1	ZINC000450880291	DF	On-Demand	Anodyne	VCP	57	42
CS(=O)(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)cc1	ZINC000450880322	FH	On-Demand	Anodyne	PTGS2	37	40
CS(=O)(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)cc1	ZINC000450880322	FH	On-Demand	Anodyne	CCR3	27	48
CS(=O)(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)cc1	ZINC000450880322	FH	On-Demand	Anodyne	SLC6A9	30	42
CS(=O)(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)cc1	ZINC000450880322	FH	On-Demand	Anodyne	GPR119	25	51
COc1cc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)ccc1Cl	ZINC000450880325	FG	On-Demand	Bother	SSTR5	57	43
COc1cc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)ccc1Cl	ZINC000450880325	FG	On-Demand	Bother	CCR3	17	44
CCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nn1	ZINC000450880353	ED	On-Demand	Anodyne	SCD1	49	42
CCNC(=O)c1ccc(N2CCN(CC(F)(F)F)C[C@H](C)C2)nn1	ZINC000450880353	ED	On-Demand	Anodyne	SCD	41	42
CCOc1cc(NC2CCN(C3CCC3)CC2)ccc1[N+](=O)[O-]	ZINC000450880386	DG	On-Demand	Bother	SSTR5	48	38
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccn3)n2Cc2ccco2)C1	ZINC000450880388	FH	On-Demand	Anodyne	HCRTR2	0	40
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccn3)n2Cc2ccco2)C1	ZINC000450880391	FH	On-Demand	Anodyne	HCRTR2	0	40
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3ccccn3)n2Cc2ccco2)C1	ZINC000450880393	FH	On-Demand	Anodyne	HCRTR2	0	40
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3ccccn3)n2Cc2ccco2)C1	ZINC000450880395	FH	On-Demand	Anodyne	HCRTR2	0	40
CC(C)(C)CC(C)(C)N1CCN(c2ccc(C(N)=O)nn2)CC1	ZINC000450880400	DD	On-Demand	Anodyne	SCD1	38	42
Cc1csc2c(NC3CCN(C4CCC4)CC3)ncnc12	ZINC000450880401	DG	On-Demand	Anodyne	LPAR2	20	40
C[C@@H]1CN(CC(F)(F)F)CCN(c2cnc3ccccc3n2)C1	ZINC000450880403	DF	On-Demand	Anodyne	SORD	20	44
C[C@H]1CN(CC(F)(F)F)CCN(c2cnc3ccccc3n2)C1	ZINC000450880404	DF	On-Demand	Anodyne	SORD	20	44
O=C(NC1CCCC1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nn1	ZINC000450880451	FD	On-Demand	Anodyne	SCD1	65	43
O=C(NC1CCCC1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nn1	ZINC000450880451	FD	On-Demand	Anodyne	SCD	52	42
O=C(NC1CCCC1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nn1	ZINC000450880453	FD	On-Demand	Anodyne	SCD1	65	43
O=C(NC1CCCC1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nn1	ZINC000450880453	FD	On-Demand	Anodyne	SCD	52	42
O=C(NC1CCCC1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nn1	ZINC000450880455	FD	On-Demand	Anodyne	SCD1	65	43
O=C(NC1CCCC1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nn1	ZINC000450880455	FD	On-Demand	Anodyne	SCD	52	42
O=C(NC1CCCC1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nn1	ZINC000450880458	FD	On-Demand	Anodyne	SCD1	65	43
O=C(NC1CCCC1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nn1	ZINC000450880458	FD	On-Demand	Anodyne	SCD	52	42
COc1cc(-c2noc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)n2)ncn1	ZINC000450880474	GF	On-Demand	Anodyne	SLC18A3	33	44
COc1cc(-c2noc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)n2)ncn1	ZINC000450880474	GF	On-Demand	Anodyne	WNT3A	57	36
CC(C)N1CCCC[C@H]1CN1CCC(Oc2ncccc2F)CC1	ZINC000450880477	EG	On-Demand	Anodyne	SCN5A	64	39
CC(C)N1CCCC[C@@H]1CN1CCC(Oc2ncccc2F)CC1	ZINC000450880478	EG	On-Demand	Anodyne	SCN5A	64	39
O=[N+]([O-])c1cc2c(N3CCCC[C@H]3c3nc4ccccc4[nH]3)ncnc2s1	ZINC000450880506	GI	On-Demand	Bother	PRCP	46	39
O=[N+]([O-])c1cc2c(N3CCCC[C@H]3c3nc4ccccc4[nH]3)ncnc2s1	ZINC000450880506	GI	On-Demand	Bother	KCNN3	20	41
O=[N+]([O-])c1cc2c(N3CCCC[C@@H]3c3nc4ccccc4[nH]3)ncnc2s1	ZINC000450880507	GI	On-Demand	Bother	PRCP	46	39
O=[N+]([O-])c1cc2c(N3CCCC[C@@H]3c3nc4ccccc4[nH]3)ncnc2s1	ZINC000450880507	GI	On-Demand	Bother	KCNN3	20	41
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450880510	EG	On-Demand	Anodyne	MLYCD	60	37
C[C@H]1CN(CC(F)(F)F)CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450880511	EG	On-Demand	Anodyne	MLYCD	60	37
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncc(Cl)cc2Cl)C1	ZINC000450880512	EH	On-Demand	Anodyne	CXCR3	27	41
C[C@H]1CN(CC(F)(F)F)CCN(c2ncc(Cl)cc2Cl)C1	ZINC000450880513	EH	On-Demand	Anodyne	CXCR3	27	41
O=[N+]([O-])c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450880514	DF	On-Demand	Bother	KCNN3	32	47
O=[N+]([O-])c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)nc1	ZINC000450880515	DF	On-Demand	Bother	KCNN3	32	47
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450880525	FE	On-Demand	Anodyne	GPR119	18	40
C[C@H]1CN(CC(F)(F)F)CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450880526	FE	On-Demand	Anodyne	GPR119	18	40
CC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450880527	EF	On-Demand	Anodyne	DRD2	39	56
CC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450880527	EF	On-Demand	Anodyne	DRD1	23	52
CC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450880527	EF	On-Demand	Anodyne	DRD4	27	56
CC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450880527	EF	On-Demand	Anodyne	ERG2	26	56
CC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450880527	EF	On-Demand	Anodyne	SLC18A3	24	57
CC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450880527	EF	On-Demand	Anodyne	CYP2J2	53	38
CC1(C)CCN(CCCC(=O)c2ccc(F)cc2)CCS1(=O)=O	ZINC000450880527	EF	On-Demand	Anodyne	AP2S1	0	56
COC(=O)c1ccc(CN2CC[C@@](O)(C3CC3)C2)cc1Cl	ZINC000450880600	DE	On-Demand	Anodyne	MCHR2	49	34
COC(=O)c1ccc(CN2CC[C@](O)(C3CC3)C2)cc1Cl	ZINC000450880601	DE	On-Demand	Anodyne	MCHR2	49	34
CC(=O)c1ccc(CN2CCOc3ccc(F)cc3C2)cc1	ZINC000450880616	CG	On-Demand	Anodyne	NOD2	42	36
O=[N+]([O-])c1ccc(NC2CCN(C3CCC3)CC2)cc1C(F)(F)F	ZINC000450880621	EI	On-Demand	Bother	AADAC	0	45
C=CCn1c(COc2ccc(C)cc2)nnc1SCC1(C#N)CCC1	ZINC000450880629	FI	On-Demand	Mild	VCP	47	37
CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)c2cnn(CC)c2)c([N+](=O)[O-])c1	ZINC000450880636	GG	On-Demand	Bother	BDKRB1	24	46
CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)c2cnn(CC)c2)c([N+](=O)[O-])c1	ZINC000450880637	GG	On-Demand	Bother	BDKRB1	24	46
C=CCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450880652	FH	On-Demand	Mild	CCR2	52	38
C[C@@H](O)CCN1CCC(Oc2ncccc2F)CC1	ZINC000450880663	CD	On-Demand	Anodyne	SCN5A	71	41
C[C@H](O)CCN1CCC(Oc2ncccc2F)CC1	ZINC000450880664	CD	On-Demand	Anodyne	SCN5A	71	41
COc1ccc(NC(=O)[C@]2(C)CC=CCC2)cc1OC(C)C	ZINC000450880665	DI	On-Demand	Anodyne	ENPP1	67	32
COc1ccc(NC(=O)[C@@]2(C)CC=CCC2)cc1OC(C)C	ZINC000450880666	DI	On-Demand	Anodyne	ENPP1	55	32
N#Cc1ccnc(N2CCC[C@]3(CCOC3)C2)c1	ZINC000450880686	BD	On-Demand	Mild	MAP3K12	53	39
N#Cc1ccnc(N2CCC[C@@]3(CCOC3)C2)c1	ZINC000450880687	BD	On-Demand	Mild	MAP3K12	53	39
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450880689	FG	On-Demand	Anodyne	HCRTR2	40	35
CN(C)c1ncccc1O[C@H]1CCN(C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450880693	FG	On-Demand	Anodyne	HCRTR2	40	35
O=c1c(Cl)c(NC2CCN(C3CCC3)CC2)cnn1-c1ccc(Cl)cc1	ZINC000450880694	GH	On-Demand	Anodyne	HRH3	21	41
O=C1CC[C@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880709	GF	On-Demand	Anodyne	CACNA1H	25	43
O=C1CC[C@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880709	GF	On-Demand	Anodyne	CCR3	21	42
O=C1CC[C@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880709	GF	On-Demand	Anodyne	CCR2	29	62
O=C1CC[C@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880709	GF	On-Demand	Anodyne	EPHX2	23	43
O=C1CC[C@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880709	GF	On-Demand	Anodyne	TRPM8	43	36
O=C1CC[C@@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880710	GF	On-Demand	Anodyne	CACNA1H	25	43
O=C1CC[C@@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880710	GF	On-Demand	Anodyne	CCR3	21	42
O=C1CC[C@@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880710	GF	On-Demand	Anodyne	CCR2	29	62
O=C1CC[C@@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880710	GF	On-Demand	Anodyne	EPHX2	23	43
O=C1CC[C@@H](CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)CCN1	ZINC000450880710	GF	On-Demand	Anodyne	TRPM8	43	36
CCOc1ccc(-n2c(SCc3cn(C)nc3C)nnc2-c2ccco2)cc1	ZINC000450880711	GI	On-Demand	Anodyne	CACNA2D1	69	38
CCOc1ccc(-n2c(SCc3cn(C)nc3C)nnc2-c2ccco2)cc1	ZINC000450880711	GI	On-Demand	Anodyne	WNT3A	21	45
Cc1ccc(-n2ncc3c(=O)n(CCC(C)(F)F)cnc32)cc1	ZINC000450880740	DF	On-Demand	Anodyne	Q9M629_MAIZE	47	30
COC(=O)c1csc(CN2CCC(Oc3ncccc3F)CC2)n1	ZINC000450880751	FF	On-Demand	Anodyne	SCN9A	0	40
COC(=O)c1csc(CN2CCC(Oc3ncccc3F)CC2)n1	ZINC000450880751	FF	On-Demand	Anodyne	SCN5A	83	40
c1coc(Cn2c(SC[C@H]3COCCO3)nnc2-c2cccs2)c1	ZINC000450880755	FG	On-Demand	Anodyne	HCRTR2	19	42
c1coc(Cn2c(SC[C@@H]3COCCO3)nnc2-c2cccs2)c1	ZINC000450880757	FG	On-Demand	Anodyne	HCRTR2	19	42
COc1ccc(CNC(=O)CCN2CCC(n3ccc(C)n3)CC2)c(OC)c1	ZINC000450880759	GF	On-Demand	Anodyne	PDGFRB	29	40
Cc1nccc(N2CCN(C(C)(C)CC(C)(C)C)CC2)n1	ZINC000450880768	CG	On-Demand	Anodyne	SORD	67	44
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	DRD2	18	59
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	DRD4	25	42
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	ACHE	17	45
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	HRH2	17	45
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	HTR2A	25	69
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	HTR2C	15	59
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	HRH1	15	42
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	VACHT_TETCF	0	45
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	HRH3	19	46
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	SIGMAR1	40	54
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	CCR3	47	44
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	SLC18A3	41	59
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	MLNR	62	48
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	MCHR1	27	42
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	CACNA1G	51	52
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	WNT3A	61	40
CCS(=O)(=O)c1ccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1	ZINC000450880776	GH	On-Demand	Anodyne	TNKS2	18	40
N#CC[C@@H](O)CSc1ncnc2c1cnn2Cc1ccccc1	ZINC000450880777	EE	On-Demand	Mild	SRC	0	42
CCc1nc(C)c(CSc2nnc(-c3ccc(F)cc3)n2Cc2ccco2)o1	ZINC000450880783	GJ	On-Demand	Anodyne	HCRTR2	20	45
COC(=O)[C@H]1CNC(=O)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450880809	DC	On-Demand	Anodyne	DRD4	0	40
COC(=O)[C@@H]1CNC(=O)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450880811	DC	On-Demand	Anodyne	DRD4	0	40
Cc1ccnc(-c2noc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)n2)c1	ZINC000450880826	GH	On-Demand	Anodyne	HTR2A	22	45
Cc1ccnc(-c2noc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)n2)c1	ZINC000450880826	GH	On-Demand	Anodyne	SLC18A3	32	42
Cc1ccnc(-c2noc(CN3CCC(C(=O)c4ccc(F)cc4)CC3)n2)c1	ZINC000450880826	GH	On-Demand	Anodyne	WNT3A	60	38
CCS(=O)(=O)c1ccc(CN(C)CCCCCO)cc1	ZINC000450880835	CE	On-Demand	Anodyne	RORC	18	42
Cc1cccc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ncnc12	ZINC000450880841	DF	On-Demand	Anodyne	PDE3B	53	33
Cc1cccc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ncnc12	ZINC000450880842	DF	On-Demand	Anodyne	PDE3B	53	33
Cc1cccc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ncnc12	ZINC000450880844	DF	On-Demand	Anodyne	PDE3B	53	33
Cc1cccc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ncnc12	ZINC000450880846	DF	On-Demand	Anodyne	PDE3B	53	33
CC(=O)c1ccc(CN2CCOc3c(F)cccc3C2)cc1	ZINC000450880856	CG	On-Demand	Anodyne	NOD1	31	41
CC(=O)c1ccc(CN2CCOc3c(F)cccc3C2)cc1	ZINC000450880856	CG	On-Demand	Anodyne	NOD2	47	41
CC(=O)CCCCCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450880870	FG	On-Demand	Anodyne	HTR7	16	46
CC(=O)CCCCCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450880870	FG	On-Demand	Anodyne	Q9M629_MAIZE	43	31
CCn1c(COc2ccc(C)cc2)nnc1SCc1nc(C(=O)OC)co1	ZINC000450880877	GG	On-Demand	Anodyne	SLC27A1	45	39
Clc1cccc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)c1	ZINC000450880911	GJ	On-Demand	Anodyne	HCRTR2	17	44
Clc1cccc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)c1	ZINC000450880913	GJ	On-Demand	Anodyne	HCRTR2	17	44
O=C1CN(CCc2ccc(Cl)cc2)CN1C1CC1	ZINC000450880916	CE	On-Demand	Anodyne	CACNA1C	0	40
O=C1CN(CCc2ccc(Cl)cc2)CN1C1CC1	ZINC000450880916	CE	On-Demand	Anodyne	CACNA1D	65	44
N#CC1(CSc2nnc(COc3ccccc3)n2-c2ccccc2)CCC1	ZINC000450880934	GJ	On-Demand	Mild	VCP	88	55
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@H]2CCOC2)CC1	ZINC000450880944	FG	On-Demand	Anodyne	DRD3	17	47
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@H]2CCOC2)CC1	ZINC000450880944	FG	On-Demand	Anodyne	ITGAL	41	33
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@H]2CCOC2)CC1	ZINC000450880944	FG	On-Demand	Anodyne	CASR	24	46
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@H]2CCOC2)CC1	ZINC000450880944	FG	On-Demand	Anodyne	CCR3	25	46
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@H]2CCOC2)CC1	ZINC000450880944	FG	On-Demand	Anodyne	CCR2	41	58
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@H]2CCOC2)CC1	ZINC000450880944	FG	On-Demand	Anodyne	EPHX2	38	49
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450880945	FG	On-Demand	Anodyne	DRD3	17	47
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450880945	FG	On-Demand	Anodyne	ITGAL	41	33
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450880945	FG	On-Demand	Anodyne	CASR	24	46
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450880945	FG	On-Demand	Anodyne	CCR3	25	46
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450880945	FG	On-Demand	Anodyne	CCR2	41	58
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(CC[C@@H]2CCOC2)CC1	ZINC000450880945	FG	On-Demand	Anodyne	EPHX2	38	49
CC(F)(F)CCSc1nnc(-c2cnccn2)n1Cc1ccco1	ZINC000450880956	FH	On-Demand	Anodyne	HCRTR2	0	41
CC(=O)c1cccc(CN(C)C2(C)CCCC2)c1	ZINC000450880974	BH	On-Demand	Anodyne	HSD17B2	23	42
COCCOC[C@@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000450880987	DD	On-Demand	Anodyne	ADRB2	23	42
COCCOC[C@@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000450880987	DD	On-Demand	Anodyne	ABCB1	54	39
COCCOC[C@@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000450880987	DD	On-Demand	Anodyne	HSP90AB1	39	48
COCCOC[C@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000450880988	DD	On-Demand	Anodyne	ADRB2	23	42
COCCOC[C@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000450880988	DD	On-Demand	Anodyne	ABCB1	54	39
COCCOC[C@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000450880988	DD	On-Demand	Anodyne	HSP90AB1	39	48
N#C[C@@H]1CC[C@@H](Sc2nnc(COc3ccccc3)n2Cc2ccco2)C1	ZINC000450881005	GI	On-Demand	Mild	VCP	64	43
N#C[C@H]1CC[C@@H](Sc2nnc(COc3ccccc3)n2Cc2ccco2)C1	ZINC000450881006	GI	On-Demand	Mild	VCP	64	43
N#C[C@@H]1CC[C@H](Sc2nnc(COc3ccccc3)n2Cc2ccco2)C1	ZINC000450881007	GI	On-Demand	Mild	VCP	64	43
N#C[C@H]1CC[C@H](Sc2nnc(COc3ccccc3)n2Cc2ccco2)C1	ZINC000450881008	GI	On-Demand	Mild	VCP	64	43
O[C@@]1(C2CC2)CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450881047	DE	On-Demand	Anodyne	SIGMAR1	35	40
O[C@]1(C2CC2)CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450881048	DE	On-Demand	Anodyne	SIGMAR1	35	40
CC(=O)c1ccc(CN2CCN(c3cccc4cnccc34)C[C@@H]2C)cc1	ZINC000450881053	FI	On-Demand	Anodyne	TRPV1	23	40
CC(=O)c1ccc(CN2CCN(c3cccc4cnccc34)C[C@@H]2C)cc1	ZINC000450881053	FI	On-Demand	Anodyne	P2RX7	42	45
CC(=O)c1ccc(CN2CCN(c3cccc4cnccc34)C[C@H]2C)cc1	ZINC000450881056	FI	On-Demand	Anodyne	TRPV1	23	40
CC(=O)c1ccc(CN2CCN(c3cccc4cnccc34)C[C@H]2C)cc1	ZINC000450881056	FI	On-Demand	Anodyne	P2RX7	42	45
CC[C@H](O)CC(=O)NC(c1ccccc1C)c1ccccc1C	ZINC000450881069	DH	On-Demand	Anodyne	CTSA	60	35
CC[C@@H](O)CC(=O)NC(c1ccccc1C)c1ccccc1C	ZINC000450881070	DH	On-Demand	Anodyne	CTSA	60	35
FC(F)(F)c1cccc(C2CN(c3ccccn3)C2)c1	ZINC000450881094	CH	On-Demand	Anodyne	EBP	26	41
CCn1c(C)nc([N+](=O)[O-])c1N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000450881095	FH	On-Demand	Bother	KCNN3	27	43
CCn1c(C)nc([N+](=O)[O-])c1N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000450881096	FH	On-Demand	Bother	KCNN3	27	43
Cc1ccnc(N2CCN(CC(F)(F)F)C[C@H](C)C2)n1	ZINC000450881097	CE	On-Demand	Anodyne	SORD	28	40
Cc1ccnc(N2CCN(CC(F)(F)F)C[C@@H](C)C2)n1	ZINC000450881098	CE	On-Demand	Anodyne	SORD	28	40
CCS(=O)(=O)c1ccc(CN2CCn3c(cc4ccc(Cl)cc43)C2)cc1	ZINC000450881112	GI	On-Demand	Anodyne	RORC	40	37
CCc1nc(C)cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450881113	DH	On-Demand	Anodyne	PRCP	24	41
CCc1nc(C)cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450881113	DH	On-Demand	Anodyne	KCNN3	36	47
CCc1nc(C)cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450881114	DH	On-Demand	Anodyne	PRCP	24	41
CCc1nc(C)cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450881114	DH	On-Demand	Anodyne	KCNN3	36	47
CS(=O)(=O)c1ccccc1N1CC(c2cccc(C(F)(F)F)c2)C1	ZINC000450881142	FH	On-Demand	Anodyne	CACNA1B	49	39
COc1ccc(Nc2cc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ncn2)c(OC)c1	ZINC000450881166	GF	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(Nc2cc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ncn2)c(OC)c1	ZINC000450881166	GF	On-Demand	Anodyne	GALR2	40	32
COc1ccc(Nc2cc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ncn2)c(OC)c1	ZINC000450881167	GF	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(Nc2cc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ncn2)c(OC)c1	ZINC000450881167	GF	On-Demand	Anodyne	GALR2	40	32
COc1ccc(Nc2cc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ncn2)c(OC)c1	ZINC000450881168	GF	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(Nc2cc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ncn2)c(OC)c1	ZINC000450881168	GF	On-Demand	Anodyne	GALR2	40	32
COc1ccc(Nc2cc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ncn2)c(OC)c1	ZINC000450881169	GF	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(Nc2cc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ncn2)c(OC)c1	ZINC000450881169	GF	On-Demand	Anodyne	GALR2	40	32
CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(Br)cc1C#N	ZINC000450881170	EH	On-Demand	Mild	SDH1	0	40
CC[C@H](CC(F)(F)F)NC(=O)c1ccc(Br)cc1C#N	ZINC000450881171	EH	On-Demand	Mild	SDH1	0	40
CCOC(=O)c1c(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881176	GG	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)c1c(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881176	GG	On-Demand	Anodyne	TSPO	15	41
CCOC(=O)c1c(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881176	GG	On-Demand	Anodyne	PDE6D	52	33
CCOC(=O)c1c(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881176	GG	On-Demand	Anodyne	TACR3	45	32
CCOC(=O)c1c(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881177	GG	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)c1c(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881177	GG	On-Demand	Anodyne	TSPO	15	41
CCOC(=O)c1c(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881177	GG	On-Demand	Anodyne	PDE6D	52	33
CCOC(=O)c1c(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881177	GG	On-Demand	Anodyne	TACR3	45	32
CCOC(=O)c1c(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881178	GG	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)c1c(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881178	GG	On-Demand	Anodyne	TSPO	15	41
CCOC(=O)c1c(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881178	GG	On-Demand	Anodyne	PDE6D	52	33
CCOC(=O)c1c(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881178	GG	On-Demand	Anodyne	TACR3	45	32
CCOC(=O)c1c(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881179	GG	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)c1c(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881179	GG	On-Demand	Anodyne	TSPO	15	41
CCOC(=O)c1c(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881179	GG	On-Demand	Anodyne	PDE6D	52	33
CCOC(=O)c1c(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc2ccccc2c1C	ZINC000450881179	GG	On-Demand	Anodyne	TACR3	45	32
CC[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450881190	EG	On-Demand	Anodyne	RIR1_HHV11	50	38
CC[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450881190	EG	On-Demand	Anodyne	CAPN1	42	37
CC[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450881190	EG	On-Demand	Anodyne	CAPN2	56	35
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450881192	EG	On-Demand	Anodyne	RIR1_HHV11	50	38
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450881192	EG	On-Demand	Anodyne	CAPN1	42	37
CC[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450881192	EG	On-Demand	Anodyne	CAPN2	56	35
Cn1c(SCCC(C)(F)F)nnc1-c1ccccn1	ZINC000450881194	CG	On-Demand	Anodyne	DRD2	0	41
Cn1c(SCCC(C)(F)F)nnc1-c1ccccn1	ZINC000450881194	CG	On-Demand	Anodyne	DRD3	45	41
Cn1c(SCCC(C)(F)F)nnc1-c1ccccn1	ZINC000450881194	CG	On-Demand	Anodyne	KCNH2	26	45
CC(C)NS(=O)(=O)c1cccnc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450881206	FD	On-Demand	Anodyne	PRKCQ	41	31
CC(C)NS(=O)(=O)c1cccnc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450881207	FD	On-Demand	Anodyne	PRKCQ	41	31
CC(C)NS(=O)(=O)c1cccnc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450881208	FD	On-Demand	Anodyne	PRKCQ	41	31
CC(C)NS(=O)(=O)c1cccnc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450881209	FD	On-Demand	Anodyne	PRKCQ	41	31
O[C@@H]([C@@H]1CCN(c2ncnc3sc4c(c23)CCC4)C1)C(F)(F)F	ZINC000450881214	EF	On-Demand	Anodyne	RBP4	20	48
O[C@H]([C@@H]1CCN(c2ncnc3sc4c(c23)CCC4)C1)C(F)(F)F	ZINC000450881215	EF	On-Demand	Anodyne	RBP4	20	48
O[C@H]([C@H]1CCN(c2ncnc3sc4c(c23)CCC4)C1)C(F)(F)F	ZINC000450881217	EF	On-Demand	Anodyne	RBP4	20	48
O[C@@H]([C@H]1CCN(c2ncnc3sc4c(c23)CCC4)C1)C(F)(F)F	ZINC000450881220	EF	On-Demand	Anodyne	RBP4	20	48
COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1CC1(C(=O)OC)CC1	ZINC000450881248	DE	On-Demand	Anodyne	MME	16	40
Cc1cc(C(F)(F)F)ccc1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450881251	GI	On-Demand	Anodyne	LIPG	41	32
Cn1ccc([C@H](NC(=O)CC[C@@H]2CCC(=O)N2)c2ccc(Cl)cc2)n1	ZINC000450881260	FE	On-Demand	Anodyne	PRCP	16	41
c1ccc(OCc2nnc(SC[C@H]3COCCO3)n2-c2ccccc2)cc1	ZINC000450881266	GG	On-Demand	Anodyne	VCP	83	54
c1ccc(OCc2nnc(SC[C@@H]3COCCO3)n2-c2ccccc2)cc1	ZINC000450881268	GG	On-Demand	Anodyne	VCP	83	54
Cn1ccc([C@@H](NC(=O)CC[C@H]2CCC(=O)N2)c2ccc(Cl)cc2)n1	ZINC000450881270	FE	On-Demand	Anodyne	PRCP	16	41
Cn1ccc([C@@H](NC(=O)CC[C@@H]2CCC(=O)N2)c2ccc(Cl)cc2)n1	ZINC000450881273	FE	On-Demand	Anodyne	PRCP	16	41
Cn1ccc([C@H](NC(=O)CC[C@H]2CCC(=O)N2)c2ccc(Cl)cc2)n1	ZINC000450881275	FE	On-Demand	Anodyne	PRCP	16	41
CCOCc1nc(C)c(C(=O)Nc2ccc(Cl)cc2OC(F)F)s1	ZINC000450881292	GI	On-Demand	Anodyne	F10	0	43
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	HTR1A	18	62
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	DRD2	43	61
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	DRD1	26	48
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	DRD4	24	53
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	HTR2A	52	53
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	HTR2C	27	62
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	HRH1	17	53
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	ADRA1B	19	45
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	DRD3	15	53
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	ERG2	21	45
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	HTR1F	34	42
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	SIGMAR1	19	57
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	PRCP	31	41
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	CCR3	27	41
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	CCR5	56	31
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	SLC18A3	0	46
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	HTR3B	0	48
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	MCHR1	15	51
CCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450881293	EH	On-Demand	Anodyne	CYP2J2	64	45
CCc1cc(CCCSc2nnc(-c3ccccn3)n2Cc2ccco2)on1	ZINC000450881304	GI	On-Demand	Anodyne	HCRTR2	19	41
CS(=O)(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881312	FG	On-Demand	Anodyne	GPR119	28	55
CCc1nc(C)c(CSc2nnc(-c3ccco3)n2Cc2ccco2)o1	ZINC000450881325	FI	On-Demand	Anodyne	HCRTR2	20	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	ADA	49	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	ADORA1	185	75
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	SLC29A1	138	56
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	P2RY12	54	43
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	ADORA2A	68	71
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	ADORA2B	31	60
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	GAPC	0	40
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	ADK	69	55
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	AK3	0	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	AHCY	55	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	CDA	42	32
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	P2RX4	35	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	P2RX1	46	39
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	P2RY1	39	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	P2RY11	0	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	AMD1	38	43
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	IARS	0	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	ITPR1	52	38
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	AK2	0	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	NS5B	0	45
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	ADORA3	146	71
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	OXGR1	128	45
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	MTAP	0	45
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	QARS	0	40
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	IMPDH2	51	35
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	AK	0	49
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	SETD7	0	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	PRMT1	0	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	RNASE1	44	35
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	MBTA	0	43
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	DNMT3B	78	41
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	Q4VQ11_PIG	97	71
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	GPR17	58	50
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	SAE1	0	42
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	DOT1L	91	47
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	METJ	0	40
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	NAE1	0	42
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	UBA6	0	42
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	UBA7	0	42
CC[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881340	GC	On-Demand	Anodyne	SETD2	0	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	ADA	49	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	ADORA1	185	75
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	SLC29A1	138	56
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	P2RY12	54	43
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	ADORA2A	68	71
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	ADORA2B	31	60
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	GAPC	0	40
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	ADK	69	55
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	AK3	0	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	AHCY	55	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	CDA	42	32
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	P2RX4	35	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	P2RX1	46	39
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	P2RY1	39	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	P2RY11	0	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	AMD1	38	43
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	IARS	0	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	ITPR1	52	38
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	AK2	0	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	NS5B	0	45
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	ADORA3	146	71
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	OXGR1	128	45
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	MTAP	0	45
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	QARS	0	40
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	IMPDH2	51	35
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	AK	0	49
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	SETD7	0	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	PRMT1	0	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	RNASE1	44	35
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	MBTA	0	43
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	DNMT3B	78	41
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	Q4VQ11_PIG	97	71
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	GPR17	58	50
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	SAE1	0	42
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	DOT1L	91	47
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	METJ	0	40
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	NAE1	0	42
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	UBA6	0	42
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	UBA7	0	42
CC[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCCC1	ZINC000450881341	GC	On-Demand	Anodyne	SETD2	0	41
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	DRD2	17	41
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	DRD4	42	32
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	DRD3	26	41
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	CETP	0	41
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	CCR3	49	45
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	PLD1	42	37
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	PLD2	52	37
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	CACNA1I	58	36
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	SCD1	27	43
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	SCD	19	42
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450881353	GG	On-Demand	Anodyne	HPGDS	37	43
CC(=O)c1ccc(CN(C)CCCCCO)cc1	ZINC000450881370	BE	On-Demand	Anodyne	LTA4H	23	43
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)C(C)(C)C1CCC1	ZINC000450881372	EG	On-Demand	Anodyne	CHRNA2	39	40
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)C(C)(C)C1CCC1	ZINC000450881372	EG	On-Demand	Anodyne	CRTY	0	40
COc1ccc(Nc2cc(NC3CCN(C4CCC4)CC3)ncn2)c(OC)c1	ZINC000450881375	GH	On-Demand	Anodyne	HRH3	28	42
COc1ccc(Nc2cc(NC3CCN(C4CCC4)CC3)ncn2)c(OC)c1	ZINC000450881375	GH	On-Demand	Anodyne	CCR4	23	41
COc1ccc(Nc2cc(NC3CCN(C4CCC4)CC3)ncn2)c(OC)c1	ZINC000450881375	GH	On-Demand	Anodyne	PDE3B	53	35
COc1ccc(Nc2cc(NC3CCN(C4CCC4)CC3)ncn2)c(OC)c1	ZINC000450881375	GH	On-Demand	Anodyne	GALR2	42	34
COc1ccc(Nc2cc(NC3CCN(C4CCC4)CC3)ncn2)c(OC)c1	ZINC000450881375	GH	On-Demand	Anodyne	TTK	34	43
FC1(F)CCC[C@@H]1CSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450881377	GJ	On-Demand	Anodyne	HCRTR2	20	40
FC1(F)CCC[C@H]1CSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450881380	GJ	On-Demand	Anodyne	HCRTR2	20	40
CCn1nnc(C)c1CSc1nnc(-c2ccco2)n1-c1ccc(OC)cc1	ZINC000450881431	GH	On-Demand	Anodyne	WNT3A	21	40
CCn1nnc(C)c1CSc1nnc(-c2ccco2)n1-c1ccc(OC)cc1	ZINC000450881431	GH	On-Demand	Anodyne	TNKS2	15	40
CCn1nnc(C)c1CSc1nnc(-c2ccco2)n1-c1ccc(OC)cc1	ZINC000450881431	GH	On-Demand	Anodyne	AXIN2	0	42
CN(C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450881433	GF	On-Demand	Anodyne	SLC6A1	52	32
CN(C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450881435	GF	On-Demand	Anodyne	SLC6A1	52	32
COC(=O)c1csc(CN2CCC(F)(c3ccccc3)CC2)n1	ZINC000450881452	EG	On-Demand	Anodyne	MGEA5	24	50
COC(=O)c1csc(CN2CCC(F)(c3ccccc3)CC2)n1	ZINC000450881452	EG	On-Demand	Anodyne	NPFFR1	45	36
Cc1ccn(C2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450881460	DH	On-Demand	Anodyne	DRD4	20	46
Cc1ccn(C2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450881460	DH	On-Demand	Anodyne	SIGMAR1	26	44
Cc1ccc(-c2nnc(SCc3cn(C)nc3C)n2Cc2ccco2)cc1	ZINC000450881474	GI	On-Demand	Anodyne	HCRTR2	21	41
Cc1cc(NC2CCN(C3CCC3)CC2)c2cccc(F)c2n1	ZINC000450881481	DI	On-Demand	Anodyne	HRH3	16	52
CCOc1ccc(-n2c(SCC3(C#N)CCC3)nnc2-c2ccccn2)cc1	ZINC000450881482	GJ	On-Demand	Mild	CACNA2D1	67	35
COc1ccc(-n2c(SC[C@@H]3COCCO3)nnc2-c2ccco2)cc1	ZINC000450881486	FG	On-Demand	Anodyne	AXIN2	0	40
COc1ccc(-n2c(SC[C@H]3COCCO3)nnc2-c2ccco2)cc1	ZINC000450881487	FG	On-Demand	Anodyne	AXIN2	0	40
COc1ccc(-n2c(SCCC(C)(F)F)nnc2-c2cnccn2)cc1	ZINC000450881490	GH	On-Demand	Anodyne	WNT3A	20	41
FC1(c2ccccc2)CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450881492	DH	On-Demand	Anodyne	MGEA5	23	45
C[C@H]1CN(CCN(C)C2CC(OC(C)(C)C)C2)C[C@@H](C)O1	ZINC000450881499	CE	On-Demand	Anodyne	ZM.86993	0	40
Clc1ccc(CCN2CCC[C@H]2c2cc[nH]n2)cc1	ZINC000450881517	CG	On-Demand	Anodyne	HRH3	45	44
Clc1ccc(CCN2CCC[C@@H]2c2cc[nH]n2)cc1	ZINC000450881519	CG	On-Demand	Anodyne	HRH3	45	44
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	DRD1	17	47
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	DRD4	25	45
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	HTR2A	36	49
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	HTR2C	18	57
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	ADRA1B	16	42
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	SIGMAR1	15	56
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	HTR3B	0	47
O=C(CCCN1CCC(c2ncc3n2CCCC3)CC1)c1ccc(F)cc1	ZINC000450881521	FI	On-Demand	Anodyne	CYP2J2	55	39
CC(C)(CC(=O)CSc1nnc(-c2cnccn2)n1Cc1ccco1)C1CC1	ZINC000450881524	GH	On-Demand	Anodyne	HCRTR2	22	44
CN(CCCC(=O)c1ccccc1)C1CCN(c2cnccn2)CC1	ZINC000450881532	EG	On-Demand	Anodyne	CYP2J2	48	34
COc1ccc(CNC(=O)CCN(C)C2(C)CCCC2)c(OC)c1	ZINC000450881533	EF	On-Demand	Anodyne	MTNR1A	51	36
CC1(C)CCN(CCc2ccc(Cl)cc2)CCS1(=O)=O	ZINC000450881547	DF	On-Demand	Anodyne	SIGMAR1	20	42
C[C@@H]1CN(CC(F)(F)F)CCN(c2nc3ccccc3n2C)C1	ZINC000450881566	EF	On-Demand	Anodyne	GRM2	25	50
C[C@H]1CN(CC(F)(F)F)CCN(c2nc3ccccc3n2C)C1	ZINC000450881567	EF	On-Demand	Anodyne	GRM2	25	50
COc1cc2c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)ncnc2cc1F	ZINC000450881572	FG	On-Demand	Anodyne	PDE3A	58	46
COc1cc2c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)ncnc2cc1F	ZINC000450881572	FG	On-Demand	Anodyne	PDGFRB	67	39
COc1cc2c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)ncnc2cc1F	ZINC000450881572	FG	On-Demand	Anodyne	PDE3B	84	43
COc1cc2c(N3CCN(CC(F)(F)F)C[C@@H](C)C3)ncnc2cc1F	ZINC000450881572	FG	On-Demand	Anodyne	HTT	0	40
COc1cc2c(N3CCN(CC(F)(F)F)C[C@H](C)C3)ncnc2cc1F	ZINC000450881573	FG	On-Demand	Anodyne	PDE3A	58	46
COc1cc2c(N3CCN(CC(F)(F)F)C[C@H](C)C3)ncnc2cc1F	ZINC000450881573	FG	On-Demand	Anodyne	PDGFRB	67	39
COc1cc2c(N3CCN(CC(F)(F)F)C[C@H](C)C3)ncnc2cc1F	ZINC000450881573	FG	On-Demand	Anodyne	PDE3B	84	43
COc1cc2c(N3CCN(CC(F)(F)F)C[C@H](C)C3)ncnc2cc1F	ZINC000450881573	FG	On-Demand	Anodyne	HTT	0	40
CCCC[C@@H](NC(=O)[C@@]1(C)CC=CCC1)C(=O)OC	ZINC000450881574	CF	On-Demand	Anodyne	NOD1	49	31
CCCC[C@@H](NC(=O)[C@]1(C)CC=CCC1)C(=O)OC	ZINC000450881575	CF	On-Demand	Anodyne	NOD1	49	31
CCCC[C@H](NC(=O)[C@]1(C)CC=CCC1)C(=O)OC	ZINC000450881576	CF	On-Demand	Anodyne	NOD1	49	31
CCCC[C@H](NC(=O)[C@@]1(C)CC=CCC1)C(=O)OC	ZINC000450881577	CF	On-Demand	Anodyne	NOD1	49	31
CC(=O)[C@](C)(O)CN1CCN(c2cccc3cnccc23)C[C@H]1C	ZINC000450881589	EE	On-Demand	Anodyne	P2RX7	27	44
CC(=O)[C@](C)(O)CN1CCN(c2cccc3cnccc23)C[C@@H]1C	ZINC000450881590	EE	On-Demand	Anodyne	P2RX7	27	44
CC(=O)[C@@](C)(O)CN1CCN(c2cccc3cnccc23)C[C@H]1C	ZINC000450881591	EE	On-Demand	Anodyne	P2RX7	27	44
CC(=O)[C@@](C)(O)CN1CCN(c2cccc3cnccc23)C[C@@H]1C	ZINC000450881592	EE	On-Demand	Anodyne	P2RX7	27	44
Cc1cccnc1OC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450881595	EG	On-Demand	Anodyne	SCN9A	0	44
Cc1cccnc1OC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450881595	EG	On-Demand	Anodyne	SCN5A	35	44
Cc1cccnc1OC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450881596	EG	On-Demand	Anodyne	SCN9A	0	44
Cc1cccnc1OC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450881596	EG	On-Demand	Anodyne	SCN5A	35	44
Cc1cccnc1OC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450881597	EG	On-Demand	Anodyne	SCN9A	0	44
Cc1cccnc1OC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450881597	EG	On-Demand	Anodyne	SCN5A	35	44
Cc1cccnc1OC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450881598	EG	On-Demand	Anodyne	SCN9A	0	44
Cc1cccnc1OC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450881598	EG	On-Demand	Anodyne	SCN5A	35	44
C[C@H]1CN(CC(F)(F)F)CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450881602	FG	On-Demand	Anodyne	SORD	49	38
C[C@@H]1CN(CC(F)(F)F)CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450881603	FG	On-Demand	Anodyne	SORD	49	38
CC[C@@H](O)CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450881641	DE	On-Demand	Anodyne	DRD4	35	40
CC[C@@H](O)CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450881641	DE	On-Demand	Anodyne	ACHE	28	41
CC[C@@H](O)CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450881641	DE	On-Demand	Anodyne	CCR5	60	48
CC[C@@H](O)CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450881641	DE	On-Demand	Anodyne	SLC18A3	22	41
CC[C@@H](O)CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450881642	DE	On-Demand	Anodyne	DRD4	35	40
CC[C@@H](O)CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450881642	DE	On-Demand	Anodyne	ACHE	28	41
CC[C@@H](O)CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450881642	DE	On-Demand	Anodyne	CCR5	60	48
CC[C@@H](O)CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450881642	DE	On-Demand	Anodyne	SLC18A3	22	41
CC[C@H](O)CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450881643	DE	On-Demand	Anodyne	DRD4	35	40
CC[C@H](O)CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450881643	DE	On-Demand	Anodyne	ACHE	28	41
CC[C@H](O)CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450881643	DE	On-Demand	Anodyne	CCR5	60	48
CC[C@H](O)CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000450881643	DE	On-Demand	Anodyne	SLC18A3	22	41
CC[C@H](O)CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450881644	DE	On-Demand	Anodyne	DRD4	35	40
CC[C@H](O)CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450881644	DE	On-Demand	Anodyne	ACHE	28	41
CC[C@H](O)CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450881644	DE	On-Demand	Anodyne	CCR5	60	48
CC[C@H](O)CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450881644	DE	On-Demand	Anodyne	SLC18A3	22	41
CCc1cc(NC2(C3(C)CC3)CC2)n2ncnc2n1	ZINC000450881668	CE	On-Demand	Anodyne	DHOD	0	53
CSc1cccc(C(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)c1	ZINC000450881673	GH	On-Demand	Anodyne	PDE3B	40	34
CSc1cccc(C(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)c1	ZINC000450881673	GH	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)c1	ZINC000450881674	GH	On-Demand	Anodyne	PDE3B	40	34
CSc1cccc(C(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)c1	ZINC000450881674	GH	On-Demand	Anodyne	RHOA	0	40
O[C@@H]([C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881681	EG	On-Demand	Anodyne	PDE3A	48	39
O[C@@H]([C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881681	EG	On-Demand	Anodyne	PDE3B	70	39
O[C@@H]([C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881681	EG	On-Demand	Anodyne	AKT1	0	40
O[C@@H]([C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881681	EG	On-Demand	Anodyne	HTT	0	41
O[C@H]([C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881682	EG	On-Demand	Anodyne	PDE3A	48	39
O[C@H]([C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881682	EG	On-Demand	Anodyne	PDE3B	70	39
O[C@H]([C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881682	EG	On-Demand	Anodyne	AKT1	0	40
O[C@H]([C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881682	EG	On-Demand	Anodyne	HTT	0	41
O[C@H]([C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881683	EG	On-Demand	Anodyne	PDE3A	48	39
O[C@H]([C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881683	EG	On-Demand	Anodyne	PDE3B	70	39
O[C@H]([C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881683	EG	On-Demand	Anodyne	AKT1	0	40
O[C@H]([C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881683	EG	On-Demand	Anodyne	HTT	0	41
O[C@@H]([C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881684	EG	On-Demand	Anodyne	PDE3A	48	39
O[C@@H]([C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881684	EG	On-Demand	Anodyne	PDE3B	70	39
O[C@@H]([C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881684	EG	On-Demand	Anodyne	AKT1	0	40
O[C@@H]([C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450881684	EG	On-Demand	Anodyne	HTT	0	41
CCCc1nnc(SCc2cc(C)ccc2F)o1	ZINC000450881685	CH	On-Demand	Anodyne	PTK2	18	41
Clc1cccc(-c2nnc(SC[C@@H]3COCCO3)n2Cc2ccco2)c1	ZINC000450881686	GH	On-Demand	Anodyne	HCRTR2	0	45
Clc1cccc(-c2nnc(SC[C@H]3COCCO3)n2Cc2ccco2)c1	ZINC000450881687	GH	On-Demand	Anodyne	HCRTR2	0	45
Cc1nn(C)cc1CC(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450881698	FD	On-Demand	Anodyne	FAAH	0	41
Cc1nn(C)cc1CC(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450881699	FD	On-Demand	Anodyne	FAAH	0	41
CN(C)c1ncccc1O[C@H]1CCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450881706	GF	On-Demand	Anodyne	SFRP1	34	42
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450881707	GF	On-Demand	Anodyne	SFRP1	34	42
CC(C)(C)C(=O)CCCC(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450881723	GG	On-Demand	Anodyne	SCD	32	42
CC(C)(C)C(=O)CCCC(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450881724	GG	On-Demand	Anodyne	SCD	32	42
COc1cccc2c1CCN(C[C@](C)(O)C(C)=O)CC2	ZINC000450881750	CD	On-Demand	Anodyne	DRD2	16	42
COc1cccc2c1CCN(C[C@@](C)(O)C(C)=O)CC2	ZINC000450881751	CD	On-Demand	Anodyne	DRD2	16	42
C[C@H](O)CCCN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450881761	CD	On-Demand	Anodyne	HTR1D	15	45
C[C@H](O)CCCN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450881761	CD	On-Demand	Anodyne	HTR1B	15	45
C[C@@H](O)CCCN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450881762	CD	On-Demand	Anodyne	HTR1D	15	45
C[C@@H](O)CCCN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450881762	CD	On-Demand	Anodyne	HTR1B	15	45
C[C@H](O)CCCN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450881763	CD	On-Demand	Anodyne	HTR1D	15	45
C[C@H](O)CCCN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450881763	CD	On-Demand	Anodyne	HTR1B	15	45
C[C@@H](O)CCCN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450881764	CD	On-Demand	Anodyne	HTR1D	15	45
C[C@@H](O)CCCN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450881764	CD	On-Demand	Anodyne	HTR1B	15	45
CCOC(=O)c1ccc(CN2CCOc3c(F)cccc3C2)nc1	ZINC000450881830	EF	On-Demand	Anodyne	NOD2	38	40
CNC(=O)c1ccc(N2CCC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450881834	DD	On-Demand	Bother	TAAR1	19	44
CNC(=O)c1ccc(N2CCC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450881837	DD	On-Demand	Bother	TAAR1	19	44
COCCOC[C@@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450881857	GD	On-Demand	Anodyne	ACOX1	70	37
COCCOC[C@@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450881857	GD	On-Demand	Anodyne	ABCB1	57	39
COCCOC[C@@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450881857	GD	On-Demand	Anodyne	HSP90AB1	40	43
COCCOC[C@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450881860	GD	On-Demand	Anodyne	ACOX1	70	37
COCCOC[C@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450881860	GD	On-Demand	Anodyne	ABCB1	57	39
COCCOC[C@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450881860	GD	On-Demand	Anodyne	HSP90AB1	40	43
COc1cc(CN2CCC[C@H]2c2cc[nH]n2)ccc1Cl	ZINC000450881875	CG	On-Demand	Anodyne	SSTR5	40	36
COc1cc(CN2CCC[C@@H]2c2cc[nH]n2)ccc1Cl	ZINC000450881877	CG	On-Demand	Anodyne	SSTR5	40	36
CC(=O)c1ccc(CN2CC[C@@](O)(C3CC3)C2)cc1	ZINC000450881903	CE	On-Demand	Anodyne	SIGMAR1	40	41
CC(=O)c1ccc(CN2CC[C@@](O)(C3CC3)C2)cc1	ZINC000450881903	CE	On-Demand	Anodyne	MCHR2	41	32
CC(=O)c1ccc(CN2CC[C@](O)(C3CC3)C2)cc1	ZINC000450881905	CE	On-Demand	Anodyne	SIGMAR1	40	41
CC(=O)c1ccc(CN2CC[C@](O)(C3CC3)C2)cc1	ZINC000450881905	CE	On-Demand	Anodyne	MCHR2	41	32
COC(=O)c1ccc(CN2CCO[C@H](C(C)(C)C)C2)cc1Cl	ZINC000450881921	EG	On-Demand	Anodyne	DRD4	22	45
COC(=O)c1ccc(CN2CCO[C@@H](C(C)(C)C)C2)cc1Cl	ZINC000450881922	EG	On-Demand	Anodyne	DRD4	22	45
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881925	CF	On-Demand	Anodyne	KCNQ2	48	34
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881925	CF	On-Demand	Anodyne	ADAM17	43	47
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881925	CF	On-Demand	Anodyne	COLA	128	41
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881925	CF	On-Demand	Anodyne	CPT1A	112	41
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881925	CF	On-Demand	Anodyne	PREP	47	36
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881925	CF	On-Demand	Anodyne	AMY2	44	31
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881925	CF	On-Demand	Anodyne	ABHD6	0	41
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881926	CF	On-Demand	Anodyne	KCNQ2	48	34
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881926	CF	On-Demand	Anodyne	ADAM17	43	47
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881926	CF	On-Demand	Anodyne	COLA	128	41
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881926	CF	On-Demand	Anodyne	CPT1A	112	41
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881926	CF	On-Demand	Anodyne	PREP	47	36
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881926	CF	On-Demand	Anodyne	AMY2	44	31
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1ccccc1	ZINC000450881926	CF	On-Demand	Anodyne	ABHD6	0	41
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881928	CF	On-Demand	Anodyne	KCNQ2	48	34
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881928	CF	On-Demand	Anodyne	ADAM17	43	47
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881928	CF	On-Demand	Anodyne	COLA	128	41
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881928	CF	On-Demand	Anodyne	CPT1A	112	41
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881928	CF	On-Demand	Anodyne	PREP	47	36
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881928	CF	On-Demand	Anodyne	AMY2	44	31
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881928	CF	On-Demand	Anodyne	ABHD6	0	41
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881929	CF	On-Demand	Anodyne	KCNQ2	48	34
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881929	CF	On-Demand	Anodyne	ADAM17	43	47
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881929	CF	On-Demand	Anodyne	COLA	128	41
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881929	CF	On-Demand	Anodyne	CPT1A	112	41
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881929	CF	On-Demand	Anodyne	PREP	47	36
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881929	CF	On-Demand	Anodyne	AMY2	44	31
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000450881929	CF	On-Demand	Anodyne	ABHD6	0	41
COC(=O)C1(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450881947	DF	On-Demand	Anodyne	HTR2A	22	54
COC(=O)C1(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450881947	DF	On-Demand	Anodyne	SIGMAR1	0	48
COC(=O)C1(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450881947	DF	On-Demand	Anodyne	SLC18A3	39	48
COC(=O)C1(CN2CCC(C(=O)c3ccc(F)cc3)CC2)CC1	ZINC000450881947	DF	On-Demand	Anodyne	WNT3A	62	39
CC(C)(C)CC(C)(C)N1CCN(c2ccc(C#N)cn2)CC1	ZINC000450881961	DG	On-Demand	Mild	SMO	24	46
CC1(CSc2nnc(-c3ccco3)n2Cc2ccco2)CCC1	ZINC000450881979	EI	On-Demand	Anodyne	HCRTR2	21	42
CC1CN(c2ncnc3n[nH]cc23)CCN(c2ncnc3n[nH]cc23)C1	ZINC000450881991	FC	On-Demand	Anodyne	PDE3B	51	31
COc1cccc2c1CCN(Cc1cn(CC3CC3)nn1)CC2	ZINC000450882011	DE	On-Demand	Anodyne	ADRB1	18	43
COC(=O)c1csc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)n1	ZINC000450882021	FG	On-Demand	Anodyne	SLC18A3	37	47
COC(=O)c1csc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)n1	ZINC000450882021	FG	On-Demand	Anodyne	CACNA1G	35	40
COC(=O)c1csc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)n1	ZINC000450882021	FG	On-Demand	Anodyne	WNT3A	62	39
COC(=O)c1csc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)n1	ZINC000450882021	FG	On-Demand	Anodyne	TNKS2	19	40
CCn1nnc(C)c1CSc1nnc(-c2ccco2)n1Cc1ccco1	ZINC000450882023	FG	On-Demand	Anodyne	HCRTR2	20	40
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	DRD2	20	49
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	DRD4	27	41
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	HTR2A	22	52
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	HTR2C	15	47
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	HRH1	15	41
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	SIGMAR1	31	49
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	CCR3	46	48
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	SLC18A3	41	47
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	MLNR	29	44
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	CACNA1G	45	46
COC(=O)c1cccc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)c1Cl	ZINC000450882030	GI	On-Demand	Anodyne	WNT3A	57	36
COc1ccc(CNC(=O)CCN2CCSC(C)(C)CC2)c(OC)c1	ZINC000450882035	FF	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCSC(C)(C)CC2)c(OC)c1	ZINC000450882035	FF	On-Demand	Anodyne	HTR7	25	41
CCCC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC	ZINC000450882074	DD	On-Demand	Anodyne	P2RY12	55	38
CCCC[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC	ZINC000450882075	DD	On-Demand	Anodyne	P2RY12	55	38
COc1cccc(OCCC(=O)NCCc2ccn(C)n2)c1	ZINC000450882077	DD	On-Demand	Anodyne	DRD4	45	34
COc1cccc(OCCC(=O)NCCc2ccn(C)n2)c1	ZINC000450882077	DD	On-Demand	Anodyne	MTNR1A	96	43
COc1cccc(OCCC(=O)NCCc2ccn(C)n2)c1	ZINC000450882077	DD	On-Demand	Anodyne	MTNR1B	80	41
CCCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882082	FE	On-Demand	Anodyne	CCKAR	18	42
CCCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882082	FE	On-Demand	Anodyne	CCKBR	19	42
CCCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882082	FE	On-Demand	Anodyne	F7	29	42
CCCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882082	FE	On-Demand	Anodyne	MCHR1	15	41
CCCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882082	FE	On-Demand	Anodyne	NOD1	52	32
CCCC[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882082	FE	On-Demand	Anodyne	PSBA	0	44
CCCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882083	FE	On-Demand	Anodyne	CCKAR	18	42
CCCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882083	FE	On-Demand	Anodyne	CCKBR	19	42
CCCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882083	FE	On-Demand	Anodyne	F7	29	42
CCCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882083	FE	On-Demand	Anodyne	MCHR1	15	41
CCCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882083	FE	On-Demand	Anodyne	NOD1	52	32
CCCC[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OC	ZINC000450882083	FE	On-Demand	Anodyne	PSBA	0	44
COc1ccccc1-c1csc([C@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)n1	ZINC000450882089	GG	On-Demand	Anodyne	ILES	24	43
COc1ccccc1-c1csc([C@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)n1	ZINC000450882090	GG	On-Demand	Anodyne	ILES	24	43
COc1ccccc1-c1csc([C@@H]2CCCN(C[C@@H](C)S(C)(=O)=O)C2)n1	ZINC000450882091	GG	On-Demand	Anodyne	ILES	24	43
COc1ccccc1-c1csc([C@@H]2CCCN(C[C@H](C)S(C)(=O)=O)C2)n1	ZINC000450882092	GG	On-Demand	Anodyne	ILES	24	43
COC1(CO)CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450882093	CD	On-Demand	Anodyne	SIGMAR1	41	40
Cc1cc(C)c([N+](=O)[O-])c(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450882094	FI	On-Demand	Bother	PRCP	41	38
Cc1cc(C)c([N+](=O)[O-])c(N2CCCC[C@H]2c2nc3ccccc3[nH]2)n1	ZINC000450882094	FI	On-Demand	Bother	KCNN3	31	44
Cc1cc(C)c([N+](=O)[O-])c(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450882095	FI	On-Demand	Bother	PRCP	41	38
Cc1cc(C)c([N+](=O)[O-])c(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)n1	ZINC000450882095	FI	On-Demand	Bother	KCNN3	31	44
CCc1cc(SC2CCC(C(F)(F)F)CC2)n2ncnc2n1	ZINC000450882133	EH	On-Demand	Anodyne	DHOD	0	44
CC(C)(C)OC(=O)c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)cn1	ZINC000450882144	GI	On-Demand	Anodyne	PRCP	44	37
CC(C)(C)OC(=O)c1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)cn1	ZINC000450882144	GI	On-Demand	Anodyne	KCNN3	21	44
CC(C)(C)OC(=O)c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)cn1	ZINC000450882146	GI	On-Demand	Anodyne	PRCP	44	37
CC(C)(C)OC(=O)c1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)cn1	ZINC000450882146	GI	On-Demand	Anodyne	KCNN3	21	44
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450882166	FG	On-Demand	Anodyne	PDE3A	46	37
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450882166	FG	On-Demand	Anodyne	PDE3B	66	34
C[C@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450882166	FG	On-Demand	Anodyne	HTT	0	44
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450882168	FG	On-Demand	Anodyne	PDE3A	46	37
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450882168	FG	On-Demand	Anodyne	PDE3B	66	34
C[C@@H]1CN(CC(F)(F)F)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450882168	FG	On-Demand	Anodyne	HTT	0	44
COC(=O)c1csc(CN2CCN(c3cccc4cnccc34)C[C@@H]2C)n1	ZINC000450882173	GG	On-Demand	Anodyne	P2RX7	0	40
COC(=O)c1csc(CN2CCN(c3cccc4cnccc34)C[C@H]2C)n1	ZINC000450882174	GG	On-Demand	Anodyne	P2RX7	0	40
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccccc1	ZINC000450882184	EF	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccccc1	ZINC000450882184	EF	On-Demand	Anodyne	FAAH	46	41
O=C(CCCN1CCC(Oc2cnccn2)CC1)c1ccccc1	ZINC000450882184	EF	On-Demand	Anodyne	CYP2J2	63	44
N#Cc1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1C(F)(F)F	ZINC000450882196	EG	On-Demand	Mild	AR	24	47
N#Cc1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1C(F)(F)F	ZINC000450882197	EG	On-Demand	Mild	AR	24	47
N#Cc1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1C(F)(F)F	ZINC000450882198	EG	On-Demand	Mild	AR	24	47
N#Cc1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1C(F)(F)F	ZINC000450882199	EG	On-Demand	Mild	AR	24	47
CCCc1nnc(SCc2ccc(Cl)c(OC)c2)o1	ZINC000450882200	CH	On-Demand	Anodyne	GSK3B	15	45
Cc1ccc(F)c(CC(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)c1	ZINC000450882232	GG	On-Demand	Anodyne	HCRTR1	22	42
Cc1ccc(F)c(CC(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)c1	ZINC000450882232	GG	On-Demand	Anodyne	HCRTR2	22	42
Cc1ccc(F)c(CC(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)c1	ZINC000450882233	GG	On-Demand	Anodyne	HCRTR1	22	42
Cc1ccc(F)c(CC(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)c1	ZINC000450882233	GG	On-Demand	Anodyne	HCRTR2	22	42
CSc1ccc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450882236	EG	On-Demand	Anodyne	PDE3A	50	39
CSc1ccc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450882236	EG	On-Demand	Anodyne	PDE3B	72	37
CSc1ccc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450882236	EG	On-Demand	Anodyne	SIRT3	50	32
CSc1ccc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450882236	EG	On-Demand	Anodyne	SIRT1	50	32
CSc1ccc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450882237	EG	On-Demand	Anodyne	PDE3A	50	39
CSc1ccc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450882237	EG	On-Demand	Anodyne	PDE3B	72	37
CSc1ccc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450882237	EG	On-Demand	Anodyne	SIRT3	50	32
CSc1ccc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450882237	EG	On-Demand	Anodyne	SIRT1	50	32
CSc1ccc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450882238	EG	On-Demand	Anodyne	PDE3A	50	39
CSc1ccc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450882238	EG	On-Demand	Anodyne	PDE3B	72	37
CSc1ccc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450882238	EG	On-Demand	Anodyne	SIRT3	50	32
CSc1ccc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450882238	EG	On-Demand	Anodyne	SIRT1	50	32
CSc1ccc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450882239	EG	On-Demand	Anodyne	PDE3A	50	39
CSc1ccc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450882239	EG	On-Demand	Anodyne	PDE3B	72	37
CSc1ccc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450882239	EG	On-Demand	Anodyne	SIRT3	50	32
CSc1ccc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450882239	EG	On-Demand	Anodyne	SIRT1	50	32
COc1ccc(CNC(=O)CCN(C)CCN2CCOC(C)(C)C2)c(OC)c1	ZINC000450882243	GD	On-Demand	Anodyne	MTNR1A	41	37
c1coc(Cn2c(SCc3nnc(C4CC4)s3)nnc2-c2ccco2)c1	ZINC000450882267	GI	On-Demand	Anodyne	HCRTR2	19	40
CC1(C(=O)N2CC=C(c3cccc(Br)c3)CC2)CCC(=O)CC1	ZINC000450882294	GI	On-Demand	Anodyne	ADAM10	34	40
CCC(=O)CCCN1CCCC2(CCC2)C1	ZINC000450882307	BG	On-Demand	Anodyne	EBP	18	49
CN1CC[C@@](O)(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450882310	EE	On-Demand	Anodyne	CACNA1H	24	50
CN1CC[C@@](O)(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450882310	EE	On-Demand	Anodyne	SLC6A9	46	35
CN1CC[C@@](O)(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450882310	EE	On-Demand	Anodyne	CACNA1I	48	32
CC(F)(F)CCSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450882311	FI	On-Demand	Anodyne	HCRTR2	0	43
CN1CC[C@](O)(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450882314	EE	On-Demand	Anodyne	CACNA1H	24	50
CNS(=O)(=O)NCC(=O)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450882315	GD	On-Demand	Anodyne	ADAM10	32	40
Cc1cnc(NC2CCN(C3CCC3)CC2)nc1-c1ccccc1F	ZINC000450882318	EI	On-Demand	Anodyne	MAPK9	31	44
Cc1cnc(NC2CCN(C3CCC3)CC2)nc1-c1ccccc1F	ZINC000450882318	EI	On-Demand	Anodyne	MAPK10	18	44
Cc1cnc(NC2CCN(C3CCC3)CC2)nc1-c1ccccc1F	ZINC000450882318	EI	On-Demand	Anodyne	MAPK8	24	46
CC(C)C[C@H](C)Sc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450882323	EJ	On-Demand	Anodyne	HCRTR2	19	41
CC(C)C[C@@H](C)Sc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450882325	EJ	On-Demand	Anodyne	HCRTR2	19	41
Cc1ccn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n1	ZINC000450882336	EG	On-Demand	Anodyne	DRD4	27	49
Cc1ccn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n1	ZINC000450882336	EG	On-Demand	Anodyne	DRD3	0	49
CCn1cnc2c(N3CCC(Cc4cc(F)cc(F)c4)CC3)ncnc21	ZINC000450882337	FH	On-Demand	Anodyne	ABCC1	40	33
Fc1ccccc1CO[C@H]1CCCN(CCc2cscn2)C1	ZINC000450882344	DH	On-Demand	Anodyne	SCN5A	53	43
C[C@H](N[C@H](CO)[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000450882361	EH	On-Demand	Anodyne	ACACA	41	40
C[C@H](N[C@H](CO)[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000450882364	EH	On-Demand	Anodyne	ACACA	41	40
C[C@H](N[C@@H](CO)[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000450882366	EH	On-Demand	Anodyne	ACACA	41	40
C[C@H](N[C@@H](CO)[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000450882368	EH	On-Demand	Anodyne	ACACA	41	40
CC1CN(c2cnc3ccccc3n2)CCN(c2cnc3ccccc3n2)C1	ZINC000450882374	FH	On-Demand	Anodyne	SORD	29	52
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450882380	FE	On-Demand	Anodyne	HTR7	28	40
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450882380	FE	On-Demand	Anodyne	MTNR1A	55	37
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450882380	FE	On-Demand	Anodyne	MTNR1B	50	36
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450882380	FE	On-Demand	Anodyne	ACKR3	69	34
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450882381	FE	On-Demand	Anodyne	HTR7	28	40
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450882381	FE	On-Demand	Anodyne	MTNR1A	55	37
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450882381	FE	On-Demand	Anodyne	MTNR1B	50	36
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450882381	FE	On-Demand	Anodyne	ACKR3	69	34
COc1ccc(CNC(=O)CCN2CCCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450882382	FE	On-Demand	Anodyne	HTR7	28	40
COc1ccc(CNC(=O)CCN2CCCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450882382	FE	On-Demand	Anodyne	MTNR1A	55	37
COc1ccc(CNC(=O)CCN2CCCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450882382	FE	On-Demand	Anodyne	MTNR1B	50	36
COc1ccc(CNC(=O)CCN2CCCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450882382	FE	On-Demand	Anodyne	ACKR3	69	34
COc1ccc(CNC(=O)CCN2CCCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450882383	FE	On-Demand	Anodyne	HTR7	28	40
COc1ccc(CNC(=O)CCN2CCCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450882383	FE	On-Demand	Anodyne	MTNR1A	55	37
COc1ccc(CNC(=O)CCN2CCCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450882383	FE	On-Demand	Anodyne	MTNR1B	50	36
COc1ccc(CNC(=O)CCN2CCCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450882383	FE	On-Demand	Anodyne	ACKR3	69	34
FC1(F)CC(CSc2nnc(-c3ccco3)n2Cc2ccco2)C1	ZINC000450882391	FI	On-Demand	Anodyne	HCRTR2	0	40
Cn1c(COc2ccccc2)nnc1SC[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450882398	EG	On-Demand	Anodyne	VCP	60	41
Cn1c(COc2ccccc2)nnc1SC[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450882399	EG	On-Demand	Anodyne	VCP	60	41
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	DRD2	29	43
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	DRD1	18	45
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	DRD4	0	46
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	HTR2A	25	54
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	HTR2C	19	55
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	ERG2	20	43
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	CCR3	17	41
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	SLC18A3	0	42
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	HTR3B	0	43
O=C(CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1	ZINC000450882473	FG	On-Demand	Bother	CYP2J2	55	40
C=C[C@H]1CCCCN1Cc1cccc(C(C)=O)c1	ZINC000450882479	BG	On-Demand	Mild	CCR3	17	40
C=C[C@@H]1CCCCN1Cc1cccc(C(C)=O)c1	ZINC000450882480	BG	On-Demand	Mild	CCR3	17	40
COc1cccc(OCCC(=O)Nc2ccc(OC)c(OC(C)C)c2)c1	ZINC000450882481	FH	On-Demand	Anodyne	MTNR1A	38	48
COc1cccc(OCCC(=O)Nc2ccc(OC)c(OC(C)C)c2)c1	ZINC000450882481	FH	On-Demand	Anodyne	MTNR1B	40	45
COc1cccc(OCCC(=O)Nc2ccc(OC)c(OC(C)C)c2)c1	ZINC000450882481	FH	On-Demand	Anodyne	ENPP1	68	41
COc1cc(CN2CCC(Oc3ncccc3F)CC2)ccc1Cl	ZINC000450882496	FH	On-Demand	Anodyne	HRH1	25	40
COc1cc(CN2CCC(Oc3ncccc3F)CC2)ccc1Cl	ZINC000450882496	FH	On-Demand	Anodyne	SSTR5	77	46
COc1cc(CN2CCC(Oc3ncccc3F)CC2)ccc1Cl	ZINC000450882496	FH	On-Demand	Anodyne	UTS2R	24	40
COc1cc(CN2CCC(Oc3ncccc3F)CC2)ccc1Cl	ZINC000450882496	FH	On-Demand	Anodyne	SCN9A	0	44
COc1cc(CN2CCC(Oc3ncccc3F)CC2)ccc1Cl	ZINC000450882496	FH	On-Demand	Anodyne	SCN5A	84	44
CC(C)CN1C[C@@H]2CN(CCN(C)Cc3ccccc3)CCN2C1=O	ZINC000450882517	EE	On-Demand	Anodyne	SIGMAR1	15	42
CC(C)CN1C[C@H]2CN(CCN(C)Cc3ccccc3)CCN2C1=O	ZINC000450882518	EE	On-Demand	Anodyne	SIGMAR1	15	42
C[C@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450882564	FF	On-Demand	Anodyne	P2RX7	26	41
C[C@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450882564	FF	On-Demand	Anodyne	NPBWR1	41	36
C[C@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450882564	FF	On-Demand	Anodyne	Q9M629_MAIZE	54	32
C[C@@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450882565	FF	On-Demand	Anodyne	P2RX7	26	41
C[C@@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450882565	FF	On-Demand	Anodyne	NPBWR1	41	36
C[C@@H](O)CCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450882565	FF	On-Demand	Anodyne	Q9M629_MAIZE	54	32
Nc1c(N2CCC(Cc3cc(F)cc(F)c3)CC2)ncnc1-n1cccn1	ZINC000450882569	FF	On-Demand	Anodyne	SIRT3	43	34
CN(C)C(=O)c1cnc(N2CCN(C(C)(C)CC(C)(C)C)CC2)c(Cl)c1	ZINC000450882570	GH	On-Demand	Anodyne	P2RY12	27	40
CN(C)C(=O)c1cnc(N2CCN(C(C)(C)CC(C)(C)C)CC2)c(Cl)c1	ZINC000450882570	GH	On-Demand	Anodyne	CXCR3	26	40
COc1cc(CC(=O)N(C)C[C@@H]2CCCN(C)[C@H]2c2cnn(C)c2)ccc1O	ZINC000450882579	GE	On-Demand	Anodyne	ACKR3	50	32
Cn1c(SCC[C@H]2CCOC2)nnc1-c1cccc(Cl)c1	ZINC000450882604	DH	On-Demand	Anodyne	DRD2	0	47
Cn1c(SCC[C@H]2CCOC2)nnc1-c1cccc(Cl)c1	ZINC000450882604	DH	On-Demand	Anodyne	DRD3	44	39
Cn1c(SCC[C@H]2CCOC2)nnc1-c1cccc(Cl)c1	ZINC000450882604	DH	On-Demand	Anodyne	KCNH2	28	47
Cc1ccc2c(NC3CCN(C4CCC4)CC3)ccnc2n1	ZINC000450882605	CG	On-Demand	Anodyne	HRH3	16	44
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1cccc(Cl)c1	ZINC000450882606	DH	On-Demand	Anodyne	DRD2	0	47
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1cccc(Cl)c1	ZINC000450882606	DH	On-Demand	Anodyne	DRD3	44	39
Cn1c(SCC[C@@H]2CCOC2)nnc1-c1cccc(Cl)c1	ZINC000450882606	DH	On-Demand	Anodyne	KCNH2	28	47
Cn1c(COc2ccccc2)nnc1SC[C@H]1CCCCC1(F)F	ZINC000450882620	FI	On-Demand	Anodyne	VCP	76	46
CCOc1ccc(-n2c(SCC[C@@H](C)O)nnc2-c2ccco2)cc1	ZINC000450882627	FH	On-Demand	Anodyne	CACNA2D1	60	37
CCOc1ccc(-n2c(SCC[C@@H](C)O)nnc2-c2ccco2)cc1	ZINC000450882627	FH	On-Demand	Anodyne	WNT3A	19	41
CCOc1ccc(-n2c(SCC[C@H](C)O)nnc2-c2ccco2)cc1	ZINC000450882629	FH	On-Demand	Anodyne	CACNA2D1	60	37
CCOc1ccc(-n2c(SCC[C@H](C)O)nnc2-c2ccco2)cc1	ZINC000450882629	FH	On-Demand	Anodyne	WNT3A	19	41
Nc1nccc([C@@H]2CCCN(CCc3ccc(Cl)cc3)C2)n1	ZINC000450882636	DF	On-Demand	Anodyne	BIRC2	39	44
Cn1c(COc2ccccc2)nnc1SC[C@@H]1CCCCC1(F)F	ZINC000450882646	FI	On-Demand	Anodyne	VCP	76	46
O=C([C@@H](O)C1CCC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450882650	CF	On-Demand	Anodyne	ADAM17	0	49
O=C([C@@H](O)C1CCC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450882650	CF	On-Demand	Anodyne	COLA	65	34
O=C([C@@H](O)C1CCC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450882650	CF	On-Demand	Anodyne	CPT1A	61	34
O=C([C@@H](O)C1CCC1)N1CCCC[C@H]1c1ccccc1	ZINC000450882653	CF	On-Demand	Anodyne	ADAM17	0	49
O=C([C@@H](O)C1CCC1)N1CCCC[C@H]1c1ccccc1	ZINC000450882653	CF	On-Demand	Anodyne	COLA	65	34
O=C([C@@H](O)C1CCC1)N1CCCC[C@H]1c1ccccc1	ZINC000450882653	CF	On-Demand	Anodyne	CPT1A	61	34
O=C([C@H](O)C1CCC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450882655	CF	On-Demand	Anodyne	ADAM17	0	49
O=C([C@H](O)C1CCC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450882655	CF	On-Demand	Anodyne	COLA	65	34
O=C([C@H](O)C1CCC1)N1CCCC[C@@H]1c1ccccc1	ZINC000450882655	CF	On-Demand	Anodyne	CPT1A	61	34
O=C([C@H](O)C1CCC1)N1CCCC[C@H]1c1ccccc1	ZINC000450882658	CF	On-Demand	Anodyne	ADAM17	0	49
O=C([C@H](O)C1CCC1)N1CCCC[C@H]1c1ccccc1	ZINC000450882658	CF	On-Demand	Anodyne	COLA	65	34
O=C([C@H](O)C1CCC1)N1CCCC[C@H]1c1ccccc1	ZINC000450882658	CF	On-Demand	Anodyne	CPT1A	61	34
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	PDGFRB	31	40
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	COLA	59	37
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	CPT1A	54	37
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	CPT2	46	34
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	PRNP	57	43
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	CPT1B	42	33
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	IMPDH2	0	42
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	ENPP1	62	36
COc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1OC(C)C	ZINC000450882673	EG	On-Demand	Anodyne	DGAT1	47	40
CCOC(=O)c1cnccc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450882691	DE	On-Demand	Anodyne	LIPG	48	36
CCOC(=O)c1cnccc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450882693	DE	On-Demand	Anodyne	LIPG	48	36
CCOC(=O)c1cnccc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450882694	DE	On-Demand	Anodyne	LIPG	48	36
CCOC(=O)c1cnccc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450882696	DE	On-Demand	Anodyne	LIPG	48	36
COc1cc(C(C)=O)c(OC)cc1OCc1ccc(C(C)=O)cc1	ZINC000450882722	EH	On-Demand	Anodyne	KCNA3	30	43
COc1cc(C(C)=O)c(OC)cc1OCc1ccc(C(C)=O)cc1	ZINC000450882722	EH	On-Demand	Anodyne	KLK_PIG	43	35
Cn1c(COc2ccccc2)nnc1SCC(=O)CC(C)(C)C1CC1	ZINC000450882725	FH	On-Demand	Anodyne	VCP	48	35
Fc1ccc(-c2nnc(SCC[C@@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450882743	FI	On-Demand	Anodyne	HCRTR2	0	40
Fc1ccc(-c2nnc(SCC[C@H]3CCOC3)n2Cc2ccco2)cc1	ZINC000450882744	FI	On-Demand	Anodyne	HCRTR2	0	40
CCn1c(COc2ccc(C)cc2)nnc1SC[C@@H]1CCCC1(F)F	ZINC000450882748	FJ	On-Demand	Anodyne	VCP	63	40
CCn1c(COc2ccc(C)cc2)nnc1SC[C@H]1CCCC1(F)F	ZINC000450882749	FJ	On-Demand	Anodyne	VCP	63	40
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450882763	GG	On-Demand	Anodyne	CCR2	31	58
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450882763	GG	On-Demand	Anodyne	EPHX2	34	44
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450882764	GG	On-Demand	Anodyne	CCR2	31	58
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450882764	GG	On-Demand	Anodyne	EPHX2	34	44
C[C@H](c1csnn1)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450882765	DG	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@H](c1csnn1)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450882765	DG	On-Demand	Anodyne	SLC18A3	25	41
C[C@H](c1csnn1)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450882765	DG	On-Demand	Anodyne	WNT3A	47	35
C[C@@H](c1csnn1)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450882766	DG	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@@H](c1csnn1)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450882766	DG	On-Demand	Anodyne	SLC18A3	25	41
C[C@@H](c1csnn1)N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450882766	DG	On-Demand	Anodyne	WNT3A	47	35
O=C(CCCN1C[C@@H](O)Cc2ccccc21)c1ccc(F)cc1	ZINC000450882773	DG	On-Demand	Anodyne	DRD2	32	40
O=C(CCCN1C[C@@H](O)Cc2ccccc21)c1ccc(F)cc1	ZINC000450882773	DG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1C[C@@H](O)Cc2ccccc21)c1ccc(F)cc1	ZINC000450882773	DG	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1C[C@H](O)Cc2ccccc21)c1ccc(F)cc1	ZINC000450882774	DG	On-Demand	Anodyne	DRD2	32	40
O=C(CCCN1C[C@H](O)Cc2ccccc21)c1ccc(F)cc1	ZINC000450882774	DG	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1C[C@H](O)Cc2ccccc21)c1ccc(F)cc1	ZINC000450882774	DG	On-Demand	Anodyne	CYP2J2	48	34
Cc1nc(C(C)C)oc1CSc1nnc(-c2ccco2)n1Cc1ccco1	ZINC000450882792	GJ	On-Demand	Anodyne	HCRTR2	20	40
CNS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450882795	FF	On-Demand	Anodyne	CACNA1B	44	31
Cc1ccn(C2CCN(CCCC(=O)c3ccc(Br)cc3)CC2)n1	ZINC000450882805	GI	On-Demand	Anodyne	DRD4	0	40
Cc1ccn(C2CCN(CCCC(=O)c3ccc(Br)cc3)CC2)n1	ZINC000450882805	GI	On-Demand	Anodyne	HTR2A	15	43
Cc1ccn(C2CCN(CCCC(=O)c3ccc(Br)cc3)CC2)n1	ZINC000450882805	GI	On-Demand	Anodyne	CYP2J2	64	48
CC(C)C[C@@H](C)N(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450882810	CE	On-Demand	Anodyne	ZM.86993	0	45
CC(C)C[C@H](C)N(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450882813	CE	On-Demand	Anodyne	ZM.86993	0	45
CC(=O)c1ccc(S(C)(=O)=O)c(N2CC(c3cccc(C(F)(F)F)c3)C2)c1	ZINC000450882819	GH	On-Demand	Anodyne	CACNA1B	45	40
Cc1cc(N2CCN(c3cc(C)nc4ncnn34)CC(C)C2)n2ncnc2n1	ZINC000450882830	GD	On-Demand	Anodyne	DHOD	0	45
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	P2RY12	25	41
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	TRPV1	17	43
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	FAAH	23	61
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	SORT1	18	41
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	CCR2	26	52
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	EPHX2	28	45
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	MCHR1	21	41
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	P2RY14	45	32
Cc1cccc(CN2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)n1	ZINC000450882831	GH	On-Demand	Anodyne	SCD1	17	41
COc1cc2[nH]c(=NC3CCN(C4CCC4)CC3)nc(N)c2cc1OC	ZINC000450882832	FD	On-Demand	Anodyne	CCR4	15	40
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2ccccn2)cc1	ZINC000450882835	GI	On-Demand	Anodyne	CACNA2D1	80	41
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2ccccn2)cc1	ZINC000450882835	GI	On-Demand	Anodyne	CACNA2D2	46	33
CCOc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2ccccn2)cc1	ZINC000450882835	GI	On-Demand	Anodyne	WNT3A	19	42
Cn1c(COc2ccccc2)nnc1SCc1nnc(C2CC2)s1	ZINC000450882899	FG	On-Demand	Anodyne	VCP	57	42
Clc1ccc2c(N3CCC[C@]4(CCOC4)C3)ncnc2c1	ZINC000450882938	DG	On-Demand	Anodyne	HNMT	45	32
Clc1ccc2c(N3CCC[C@@]4(CCOC4)C3)ncnc2c1	ZINC000450882939	DG	On-Demand	Anodyne	HNMT	45	32
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCO[C@@H]2C)O1	ZINC000450882940	EG	On-Demand	Anodyne	DRD2	30	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCO[C@@H]2C)O1	ZINC000450882940	EG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCO[C@@H]2C)O1	ZINC000450882940	EG	On-Demand	Anodyne	SLC18A3	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCO[C@@H]2C)O1	ZINC000450882940	EG	On-Demand	Anodyne	CYP2J2	48	34
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCO[C@@H]2C)O1	ZINC000450882941	EG	On-Demand	Anodyne	DRD2	30	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCO[C@@H]2C)O1	ZINC000450882941	EG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCO[C@@H]2C)O1	ZINC000450882941	EG	On-Demand	Anodyne	SLC18A3	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCO[C@@H]2C)O1	ZINC000450882941	EG	On-Demand	Anodyne	CYP2J2	48	34
COc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cnccn2)cc1	ZINC000450882953	GG	On-Demand	Anodyne	WNT3A	20	41
COc1ccc(-n2c(SCC3(OC)CCC3)nnc2-c2cnccn2)cc1	ZINC000450882953	GG	On-Demand	Anodyne	VCP	59	40
CN(Cc1ccccc1OC1CC1)C1CCN(c2cnccn2)CC1	ZINC000450882963	EG	On-Demand	Anodyne	SCD1	48	46
C[C@@H](O)CCSc1nnc(-c2cccs2)n1Cc1ccco1	ZINC000450882970	EH	On-Demand	Anodyne	HCRTR2	0	47
C[C@H](O)CCSc1nnc(-c2cccs2)n1Cc1ccco1	ZINC000450882972	EH	On-Demand	Anodyne	HCRTR2	0	47
COC1(CSc2nnc(-c3cccs3)n2Cc2ccco2)CCC1	ZINC000450882976	FI	On-Demand	Anodyne	HCRTR2	0	42
O[C@H]([C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882983	EH	On-Demand	Anodyne	HRP1_PLAFA	59	36
O[C@H]([C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882983	EH	On-Demand	Anodyne	NTSR2	22	40
O[C@H]([C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882983	EH	On-Demand	Anodyne	HNMT	47	33
CCOC(=O)c1ccc(CN2CCC(F)(c3ccccc3)CC2)nc1	ZINC000450882984	EH	On-Demand	Anodyne	OPRD1	17	42
CCOC(=O)c1ccc(CN2CCC(F)(c3ccccc3)CC2)nc1	ZINC000450882984	EH	On-Demand	Anodyne	P2RY12	31	41
CCOC(=O)c1ccc(CN2CCC(F)(c3ccccc3)CC2)nc1	ZINC000450882984	EH	On-Demand	Anodyne	MGEA5	17	49
O[C@@H]([C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882985	EH	On-Demand	Anodyne	HRP1_PLAFA	59	36
O[C@@H]([C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882985	EH	On-Demand	Anodyne	NTSR2	22	40
O[C@@H]([C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882985	EH	On-Demand	Anodyne	HNMT	47	33
O[C@@H]([C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882987	EH	On-Demand	Anodyne	HRP1_PLAFA	59	36
O[C@@H]([C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882987	EH	On-Demand	Anodyne	NTSR2	22	40
O[C@@H]([C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882987	EH	On-Demand	Anodyne	HNMT	47	33
O[C@H]([C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882988	EH	On-Demand	Anodyne	HRP1_PLAFA	59	36
O[C@H]([C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882988	EH	On-Demand	Anodyne	NTSR2	22	40
O[C@H]([C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1)C(F)(F)F	ZINC000450882988	EH	On-Demand	Anodyne	HNMT	47	33
CC(C)(C)OC1CC(Sc2nnc(-c3cccs3)n2Cc2ccco2)C1	ZINC000450883006	GK	On-Demand	Anodyne	HCRTR2	19	40
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450883013	GG	On-Demand	Anodyne	PDE3A	44	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450883013	GG	On-Demand	Anodyne	PDE3B	63	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450883016	GG	On-Demand	Anodyne	PDE3A	44	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450883016	GG	On-Demand	Anodyne	PDE3B	63	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450883018	GG	On-Demand	Anodyne	PDE3A	44	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1	ZINC000450883018	GG	On-Demand	Anodyne	PDE3B	63	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450883020	GG	On-Demand	Anodyne	PDE3A	44	38
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1	ZINC000450883020	GG	On-Demand	Anodyne	PDE3B	63	38
COc1cc2c(NC3(C4(C)CC4)CC3)ncnc2cc1F	ZINC000450883021	CH	On-Demand	Anodyne	EGFR	22	43
COc1cc2c(NC3(C4(C)CC4)CC3)ncnc2cc1F	ZINC000450883021	CH	On-Demand	Anodyne	FLT1	25	44
COc1cc2c(NC3(C4(C)CC4)CC3)ncnc2cc1F	ZINC000450883021	CH	On-Demand	Anodyne	EPHA2	45	37
O[C@H]([C@H]1CCN(c2ncncc2-c2ccccc2)C1)C(F)(F)F	ZINC000450883022	DF	On-Demand	Anodyne	SLC9A1	0	48
O[C@@H]([C@H]1CCN(c2ncncc2-c2ccccc2)C1)C(F)(F)F	ZINC000450883024	DF	On-Demand	Anodyne	SLC9A1	0	48
O[C@@H]([C@@H]1CCN(c2ncncc2-c2ccccc2)C1)C(F)(F)F	ZINC000450883026	DF	On-Demand	Anodyne	SLC9A1	0	48
O[C@H]([C@@H]1CCN(c2ncncc2-c2ccccc2)C1)C(F)(F)F	ZINC000450883028	DF	On-Demand	Anodyne	SLC9A1	0	48
COCCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450883050	ED	On-Demand	Anodyne	SCD1	26	45
COCCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450883050	ED	On-Demand	Anodyne	HPGDS	32	43
COCCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450883055	ED	On-Demand	Anodyne	SCD1	26	45
COCCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450883055	ED	On-Demand	Anodyne	HPGDS	32	43
COCCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450883057	ED	On-Demand	Anodyne	SCD1	26	45
COCCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450883057	ED	On-Demand	Anodyne	HPGDS	32	43
COCCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450883058	ED	On-Demand	Anodyne	SCD1	26	45
COCCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450883058	ED	On-Demand	Anodyne	HPGDS	32	43
CN(CCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)Cc1ccccc1	ZINC000450883059	EF	On-Demand	Bother	SIGMAR1	19	42
CC(C)NC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450883074	GE	On-Demand	Bother	TAAR1	41	47
CC(C)NC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450883076	GE	On-Demand	Bother	TAAR1	41	47
CC(C)NC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450883077	GE	On-Demand	Bother	TAAR1	41	47
CC(C)NC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450883078	GE	On-Demand	Bother	TAAR1	41	47
COC1(CSc2nnc(-c3ccc(F)cc3)n2Cc2ccco2)CCC1	ZINC000450883082	FI	On-Demand	Anodyne	HCRTR2	0	42
COc1ccc(CNC(=O)CCN(C)CCN2C[C@H](C)O[C@H](C)C2)c(OC)c1	ZINC000450883086	GD	On-Demand	Anodyne	MTNR1A	49	37
CCC(=O)CCCN1CCC(n2ccc(C)n2)CC1	ZINC000450883088	CF	On-Demand	Anodyne	CYP2J2	51	37
CCCOc1ccc(C(=O)N2CC[C@H](Oc3cccnc3N(C)C)C2)c(OC)c1	ZINC000450883091	GG	On-Demand	Anodyne	OXTR	33	41
CCCOc1ccc(C(=O)N2CC[C@@H](Oc3cccnc3N(C)C)C2)c(OC)c1	ZINC000450883092	GG	On-Demand	Anodyne	OXTR	33	41
Fc1ccc(-c2nnc(SCC3CC(F)(F)C3)n2Cc2ccco2)cc1	ZINC000450883104	GJ	On-Demand	Anodyne	HCRTR2	20	47
CCC[C@@H](O)CN(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450883117	CD	On-Demand	Anodyne	ZM.86993	0	45
CCC[C@H](O)CN(C)CCN1C[C@H](C)O[C@H](C)C1	ZINC000450883119	CD	On-Demand	Anodyne	ZM.86993	0	45
c1ccc(OCc2nnc(SCC[C@@H]3CCOC3)n2-c2ccccc2)cc1	ZINC000450883120	GI	On-Demand	Anodyne	VCP	85	56
c1ccc(OCc2nnc(SCC[C@H]3CCOC3)n2-c2ccccc2)cc1	ZINC000450883124	GI	On-Demand	Anodyne	VCP	85	56
Cc1nccc(N2CC(c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450883129	CG	On-Demand	Anodyne	SORD	47	33
COc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1OC(C)C	ZINC000450883130	CF	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1OC(C)C	ZINC000450883130	CF	On-Demand	Anodyne	ENPP1	57	33
COc1ccc(NC(=O)[C@H](O)C2CCC2)cc1OC(C)C	ZINC000450883131	CF	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(NC(=O)[C@H](O)C2CCC2)cc1OC(C)C	ZINC000450883131	CF	On-Demand	Anodyne	ENPP1	57	33
CC(=O)c1ccc(C#N)cc1N1CC(c2cccc(C(F)(F)F)c2)C1	ZINC000450883141	EI	On-Demand	Mild	CACNA1B	45	32
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450883142	EG	On-Demand	Anodyne	DRD2	30	45
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450883142	EG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450883142	EG	On-Demand	Anodyne	SLC18A3	0	46
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450883142	EG	On-Demand	Anodyne	CYP2J2	48	34
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450883143	EG	On-Demand	Anodyne	DRD2	30	45
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450883143	EG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450883143	EG	On-Demand	Anodyne	SLC18A3	0	46
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450883143	EG	On-Demand	Anodyne	CYP2J2	48	34
O=C1NC(=O)[C@@]2(CCCN(CCc3ccc(Cl)cc3)C2)N1	ZINC000450883170	DD	On-Demand	Anodyne	PDE7A	29	40
O=C1NC(=O)[C@]2(CCCN(CCc3ccc(Cl)cc3)C2)N1	ZINC000450883171	DD	On-Demand	Anodyne	PDE7A	29	40
CCn1nccc1C1CCN(CC[C@@H](C)O)CC1	ZINC000450883172	CD	On-Demand	Anodyne	CCR5	55	31
CCn1nccc1C1CCN(CC[C@H](C)O)CC1	ZINC000450883173	CD	On-Demand	Anodyne	CCR5	55	31
CC1=CCN(CCNC(=O)c2ccc(Br)cc2C#N)CC1	ZINC000450883182	EF	On-Demand	Mild	DRD4	43	34
C=CCOc1ccc(-c2nnc(SCC[C@@H](C)O)o2)cc1	ZINC000450883186	DG	On-Demand	Mild	TYMS	0	40
C=CCOc1ccc(-c2nnc(SCC[C@H](C)O)o2)cc1	ZINC000450883187	DG	On-Demand	Mild	TYMS	0	40
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883221	EH	On-Demand	Mild	DRD2	28	43
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883221	EH	On-Demand	Mild	DRD4	0	43
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883221	EH	On-Demand	Mild	ERG2	19	40
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883221	EH	On-Demand	Mild	SLC18A3	0	40
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883221	EH	On-Demand	Mild	CYP2J2	43	32
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883222	EH	On-Demand	Mild	DRD2	28	43
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883222	EH	On-Demand	Mild	DRD4	0	43
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883222	EH	On-Demand	Mild	ERG2	19	40
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883222	EH	On-Demand	Mild	SLC18A3	0	40
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@@]12CCCCO2	ZINC000450883222	EH	On-Demand	Mild	CYP2J2	43	32
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883223	EH	On-Demand	Mild	DRD2	28	43
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883223	EH	On-Demand	Mild	DRD4	0	43
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883223	EH	On-Demand	Mild	ERG2	19	40
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883223	EH	On-Demand	Mild	SLC18A3	0	40
N#C[C@@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883223	EH	On-Demand	Mild	CYP2J2	43	32
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883224	EH	On-Demand	Mild	DRD2	28	43
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883224	EH	On-Demand	Mild	DRD4	0	43
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883224	EH	On-Demand	Mild	ERG2	19	40
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883224	EH	On-Demand	Mild	SLC18A3	0	40
N#C[C@H]1N(CCCC(=O)c2ccc(F)cc2)CCC[C@]12CCCCO2	ZINC000450883224	EH	On-Demand	Mild	CYP2J2	43	32
COc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1OC(C)C	ZINC000450883242	ED	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(NC(=O)CS(=O)(=O)C2CC2)cc1OC(C)C	ZINC000450883242	ED	On-Demand	Anodyne	ENPP1	67	38
Cc1cnc(N2CC(c3cccc(C(F)(F)F)c3)C2)s1	ZINC000450883249	CI	On-Demand	Anodyne	MLYCD	44	38
O=C(c1cccnc1N1CC(c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000450883284	GI	On-Demand	Anodyne	CACNA1B	50	39
O=C(c1cccnc1N1CC(c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000450883284	GI	On-Demand	Anodyne	HPGD	31	45
O=C(c1cccnc1N1CC(c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000450883284	GI	On-Demand	Anodyne	SLC6A7	0	43
CC(=O)c1cc(N2CC(c3cccc(C(F)(F)F)c3)C2)ccc1[N+](=O)[O-]	ZINC000450883301	FI	On-Demand	Bother	SERPINE1	24	42
COC(=O)c1coc(CN2CCC(Oc3ncccc3F)CC2)n1	ZINC000450883317	EE	On-Demand	Anodyne	SCN5A	74	40
CC(=O)c1cccc(Cn2cnc3c(cnn3C(C)(C)C)c2=O)c1	ZINC000450883320	DF	On-Demand	Anodyne	SCD1	0	42
C[C@@H](O)CCSc1nnc(-c2cccc(Cl)c2)n1Cc1ccco1	ZINC000450883323	FI	On-Demand	Anodyne	HCRTR2	0	51
C[C@H](O)CCSc1nnc(-c2cccc(Cl)c2)n1Cc1ccco1	ZINC000450883324	FI	On-Demand	Anodyne	HCRTR2	0	51
NS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450883325	GE	On-Demand	Anodyne	HSD11B1	19	41
NS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450883325	GE	On-Demand	Anodyne	LIPG	40	32
NS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450883326	GE	On-Demand	Anodyne	HSD11B1	19	41
NS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450883326	GE	On-Demand	Anodyne	LIPG	40	32
NS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450883327	GE	On-Demand	Anodyne	HSD11B1	19	41
NS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450883327	GE	On-Demand	Anodyne	LIPG	40	32
NS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450883328	GE	On-Demand	Anodyne	HSD11B1	19	41
NS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450883328	GE	On-Demand	Anodyne	LIPG	40	32
FC(F)(F)c1cccc(C2CN(c3cc(N4CCCC4)ncn3)C2)c1	ZINC000450883337	EH	On-Demand	Anodyne	PRCP	23	52
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)CSC1CC1	ZINC000450883347	DE	On-Demand	Anodyne	CHRNA2	39	40
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)CSC1CC1	ZINC000450883347	DE	On-Demand	Anodyne	CRTY	0	40
COc1cc(CN2CCC(n3ccc(C)n3)CC2)ccc1Cl	ZINC000450883348	DH	On-Demand	Anodyne	DRD4	35	44
COc1cc(CN2CCC(n3ccc(C)n3)CC2)ccc1Cl	ZINC000450883348	DH	On-Demand	Anodyne	DRD3	25	44
COc1cc(CN2CCC(n3ccc(C)n3)CC2)ccc1Cl	ZINC000450883348	DH	On-Demand	Anodyne	SSTR5	70	43
COc1cc(CN2CCC(n3ccc(C)n3)CC2)ccc1Cl	ZINC000450883348	DH	On-Demand	Anodyne	CCR8	15	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	HTR2A	24	58
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	OPRK1	0	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	ADRB3	0	52
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	MC4R	41	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	CCR5	24	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	PLD1	59	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	SLC18A3	49	50
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	PLD2	39	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883349	FH	On-Demand	Anodyne	WNT3A	62	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	HTR2A	24	58
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	OPRK1	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	ADRB3	0	52
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	MC4R	41	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	CCR5	24	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	PLD1	59	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	SLC18A3	49	50
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	PLD2	39	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883350	FH	On-Demand	Anodyne	WNT3A	62	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	HTR2A	24	58
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	OPRK1	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	ADRB3	0	52
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	MC4R	41	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	CCR5	24	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	PLD1	59	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	SLC18A3	49	50
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	PLD2	39	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883351	FH	On-Demand	Anodyne	WNT3A	62	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	HTR2A	24	58
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	OPRK1	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	ADRB3	0	52
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	MC4R	41	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	CCR5	24	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	PLD1	59	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	SLC18A3	49	50
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	PLD2	39	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883352	FH	On-Demand	Anodyne	WNT3A	62	40
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	CACNA1H	30	44
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	ABL1	42	34
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	KIT	23	42
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	TRPV1	26	47
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	KDR	24	44
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	ABL2	43	33
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	FAAH	23	59
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	CCR2	26	51
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	EPHX2	25	43
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	BRAF	41	39
Nc1ncccc1CN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883355	GG	On-Demand	Anodyne	RIPK1	50	44
Fc1ccc(-c2nnc(SC[C@@H]3COCCO3)n2Cc2ccco2)cc1	ZINC000450883362	GG	On-Demand	Anodyne	HCRTR2	20	45
Fc1ccc(-c2nnc(SC[C@H]3COCCO3)n2Cc2ccco2)cc1	ZINC000450883363	GG	On-Demand	Anodyne	HCRTR2	20	45
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(Cc2cnn[nH]2)CC1	ZINC000450883370	FE	On-Demand	Anodyne	KIT	20	40
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(Cc2cnn[nH]2)CC1	ZINC000450883370	FE	On-Demand	Anodyne	KDR	18	42
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(Cc2cnn[nH]2)CC1	ZINC000450883370	FE	On-Demand	Anodyne	FAAH	21	61
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(Cc2cnn[nH]2)CC1	ZINC000450883370	FE	On-Demand	Anodyne	CCR2	23	52
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(Cc2cnn[nH]2)CC1	ZINC000450883370	FE	On-Demand	Anodyne	EPHX2	20	45
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(Cc2cnn[nH]2)CC1	ZINC000450883370	FE	On-Demand	Anodyne	BRAF	34	40
CC(F)(F)CCSc1nnc(-c2cccs2)n1Cc1ccco1	ZINC000450883382	FJ	On-Demand	Anodyne	HCRTR2	21	45
CC[C@@H]1CCC[C@@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450883389	EG	On-Demand	Anodyne	CHRNA2	41	42
CC[C@@H]1CCC[C@@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450883389	EG	On-Demand	Anodyne	CRTY	0	42
CC[C@H]1CCC[C@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450883390	EG	On-Demand	Anodyne	CHRNA2	41	42
CC[C@H]1CCC[C@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450883390	EG	On-Demand	Anodyne	CRTY	0	42
CC[C@@H]1CCC[C@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450883391	EG	On-Demand	Anodyne	CHRNA2	41	42
CC[C@@H]1CCC[C@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450883391	EG	On-Demand	Anodyne	CRTY	0	42
CC[C@H]1CCC[C@@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450883392	EG	On-Demand	Anodyne	CHRNA2	41	42
CC[C@H]1CCC[C@@H]1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000450883392	EG	On-Demand	Anodyne	CRTY	0	42
CCn1c(SCCCCCC(C)=O)nnc1-c1ccccn1	ZINC000450883398	DH	On-Demand	Anodyne	FAAH	35	43
c1coc(Cn2c(SC[C@@H]3C[C@H]4CC[C@H]3O4)nnc2-c2cccs2)c1	ZINC000450883404	FI	On-Demand	Anodyne	HCRTR2	0	41
c1coc(Cn2c(SC[C@H]3C[C@H]4CC[C@H]3O4)nnc2-c2cccs2)c1	ZINC000450883405	FI	On-Demand	Anodyne	HCRTR2	0	41
Cc1cccc2c(NC3CCN(C4CCC4)CC3)ncnc12	ZINC000450883411	CG	On-Demand	Anodyne	HRH3	15	46
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	HTR1A	15	63
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	DRD2	35	56
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	DRD1	24	50
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	DRD4	26	49
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	HTR2A	47	55
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	HTR2C	26	63
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	ADRA1B	17	46
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	DRD3	15	51
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	ERG2	21	46
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	SIGMAR1	18	55
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	CCR3	39	41
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	SLC18A3	0	47
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	HTR3B	0	46
Cc1ccn(C2CCN(CCCC(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883429	EH	On-Demand	Anodyne	CYP2J2	64	48
CCOc1ccc(-n2c(SC[C@@H]3COCCO3)nnc2-c2ccco2)cc1	ZINC000450883431	GG	On-Demand	Anodyne	CACNA2D1	57	35
CCOc1ccc(-n2c(SC[C@@H]3COCCO3)nnc2-c2ccco2)cc1	ZINC000450883431	GG	On-Demand	Anodyne	WNT3A	19	41
CCOc1ccc(-n2c(SC[C@H]3COCCO3)nnc2-c2ccco2)cc1	ZINC000450883432	GG	On-Demand	Anodyne	CACNA2D1	57	35
CCOc1ccc(-n2c(SC[C@H]3COCCO3)nnc2-c2ccco2)cc1	ZINC000450883432	GG	On-Demand	Anodyne	WNT3A	19	41
COC1(CSc2nnc(-c3ccco3)n2Cc2ccco2)CCC1	ZINC000450883438	EH	On-Demand	Anodyne	HCRTR2	0	40
COc1ccc(CNC(=O)CCN2CCOc3c(F)cccc3C2)c(OC)c1	ZINC000450883486	GF	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCOc3c(F)cccc3C2)c(OC)c1	ZINC000450883486	GF	On-Demand	Anodyne	HTR7	29	41
COc1ccc(CNC(=O)CCN2CCOc3c(F)cccc3C2)c(OC)c1	ZINC000450883486	GF	On-Demand	Anodyne	MTNR1A	40	38
O=C1NC(=O)[C@@]2(CCCN(CCc3c(Cl)cccc3Cl)C2)N1	ZINC000450883492	EE	On-Demand	Anodyne	PDE7A	42	44
O=C1NC(=O)[C@]2(CCCN(CCc3c(Cl)cccc3Cl)C2)N1	ZINC000450883493	EE	On-Demand	Anodyne	PDE7A	42	44
COC1(CSc2nnc(-c3cccc(Cl)c3)n2C)CCC1	ZINC000450883534	DH	On-Demand	Anodyne	KCNH2	0	43
COC1(CSc2nnc(-c3cccc(Cl)c3)n2C)CCC1	ZINC000450883534	DH	On-Demand	Anodyne	HSD11B1	25	51
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450883536	FG	On-Demand	Anodyne	PDE3B	40	35
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450883538	FG	On-Demand	Anodyne	PDE3B	40	35
CNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nn1	ZINC000450883571	EE	On-Demand	Anodyne	SCD1	48	39
CC[C@H](CC(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450883578	DF	On-Demand	Anodyne	HPGDS	33	52
CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450883579	DF	On-Demand	Anodyne	HPGDS	33	52
N#CC1(CN2CCC(Oc3ncccc3F)CC2)CCC1	ZINC000450883591	CF	On-Demand	Mild	SCN5A	48	38
O=C1C(=O)N(CCc2ccc(Cl)cc2)C(=O)N1CCCN1CCOCC1	ZINC000450883596	GD	On-Demand	Anodyne	SIGMAR1	21	48
O[C@@H]([C@@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883601	CD	On-Demand	Anodyne	AKT2	48	55
O[C@@H]([C@@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883601	CD	On-Demand	Anodyne	AKT3	22	41
O[C@@H]([C@@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883601	CD	On-Demand	Anodyne	AKT1	23	43
O[C@@H]([C@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883602	CD	On-Demand	Anodyne	AKT2	48	55
O[C@@H]([C@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883602	CD	On-Demand	Anodyne	AKT3	22	41
O[C@@H]([C@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883602	CD	On-Demand	Anodyne	AKT1	23	43
O[C@H]([C@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883603	CD	On-Demand	Anodyne	AKT2	48	55
O[C@H]([C@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883603	CD	On-Demand	Anodyne	AKT3	22	41
O[C@H]([C@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883603	CD	On-Demand	Anodyne	AKT1	23	43
O[C@H]([C@@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883604	CD	On-Demand	Anodyne	AKT2	48	55
O[C@H]([C@@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883604	CD	On-Demand	Anodyne	AKT3	22	41
O[C@H]([C@@H]1CCN(c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000450883604	CD	On-Demand	Anodyne	AKT1	23	43
O[C@H]([C@@H]1CCN(c2cncc(Br)c2)C1)C(F)(F)F	ZINC000450883613	EF	On-Demand	Anodyne	CHRNA3	31	51
O[C@H]([C@H]1CCN(c2cncc(Br)c2)C1)C(F)(F)F	ZINC000450883614	EF	On-Demand	Anodyne	CHRNA3	31	51
O[C@@H]([C@@H]1CCN(c2cncc(Br)c2)C1)C(F)(F)F	ZINC000450883615	EF	On-Demand	Anodyne	CHRNA3	31	51
O[C@@H]([C@H]1CCN(c2cncc(Br)c2)C1)C(F)(F)F	ZINC000450883616	EF	On-Demand	Anodyne	CHRNA3	31	51
Cc1sccc1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450883618	FG	On-Demand	Anodyne	HCRTR1	36	41
Cc1sccc1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450883618	FG	On-Demand	Anodyne	HCRTR2	36	41
Cc1sccc1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450883619	FG	On-Demand	Anodyne	HCRTR1	36	41
Cc1sccc1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450883619	FG	On-Demand	Anodyne	HCRTR2	36	41
O[C@H]([C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1)C(F)(F)F	ZINC000450883625	EF	On-Demand	Anodyne	PDE3A	50	40
O[C@H]([C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1)C(F)(F)F	ZINC000450883625	EF	On-Demand	Anodyne	PDE3B	73	37
O[C@H]([C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1)C(F)(F)F	ZINC000450883626	EF	On-Demand	Anodyne	PDE3A	50	40
O[C@H]([C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1)C(F)(F)F	ZINC000450883626	EF	On-Demand	Anodyne	PDE3B	73	37
O[C@@H]([C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1)C(F)(F)F	ZINC000450883627	EF	On-Demand	Anodyne	PDE3A	50	40
O[C@@H]([C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1)C(F)(F)F	ZINC000450883627	EF	On-Demand	Anodyne	PDE3B	73	37
O[C@@H]([C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1)C(F)(F)F	ZINC000450883628	EF	On-Demand	Anodyne	PDE3A	50	40
O[C@@H]([C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1)C(F)(F)F	ZINC000450883628	EF	On-Demand	Anodyne	PDE3B	73	37
Cc1cc(C)n(-c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nn2)n1	ZINC000450883636	EE	On-Demand	Anodyne	SCD1	32	48
Cc1cc(C)n(-c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nn2)n1	ZINC000450883637	EE	On-Demand	Anodyne	SCD1	32	48
Cc1cc(C)n(-c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nn2)n1	ZINC000450883638	EE	On-Demand	Anodyne	SCD1	32	48
Cc1cc(C)n(-c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nn2)n1	ZINC000450883639	EE	On-Demand	Anodyne	SCD1	32	48
C[C@@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883653	FG	On-Demand	Anodyne	CASR	26	46
C[C@@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883653	FG	On-Demand	Anodyne	CCR3	24	46
C[C@@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883653	FG	On-Demand	Anodyne	CCR2	45	39
C[C@@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883653	FG	On-Demand	Anodyne	EPHX2	36	48
C[C@@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883653	FG	On-Demand	Anodyne	MCHR1	19	42
C[C@@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883653	FG	On-Demand	Anodyne	CACNA1G	24	42
C[C@@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883653	FG	On-Demand	Anodyne	SCD1	0	41
C[C@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883654	FG	On-Demand	Anodyne	CASR	26	46
C[C@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883654	FG	On-Demand	Anodyne	CCR3	24	46
C[C@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883654	FG	On-Demand	Anodyne	CCR2	45	39
C[C@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883654	FG	On-Demand	Anodyne	EPHX2	36	48
C[C@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883654	FG	On-Demand	Anodyne	MCHR1	19	42
C[C@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883654	FG	On-Demand	Anodyne	CACNA1G	24	42
C[C@H](O)CCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000450883654	FG	On-Demand	Anodyne	SCD1	0	41
CCn1c(SCc2nc(-c3cc(C)ccn3)no2)nnc1-c1ccc(C)cc1	ZINC000450883660	GI	On-Demand	Anodyne	WNT3A	23	46
CCn1c(SCc2nc(-c3cc(C)ccn3)no2)nnc1-c1ccc(C)cc1	ZINC000450883660	GI	On-Demand	Anodyne	TNKS2	19	52
CCn1c(SCc2nc(-c3cc(C)ccn3)no2)nnc1-c1ccc(C)cc1	ZINC000450883660	GI	On-Demand	Anodyne	AXIN2	0	44
C[C@H](Sc1nnc(-c2ccccn2)n1Cc1ccco1)C(=O)C1CCCCC1	ZINC000450883662	GJ	On-Demand	Anodyne	HCRTR2	20	41
C[C@@H](Sc1nnc(-c2ccccn2)n1Cc1ccco1)C(=O)C1CCCCC1	ZINC000450883663	GJ	On-Demand	Anodyne	HCRTR2	20	41
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450883664	DG	On-Demand	Anodyne	HTR2A	16	53
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450883664	DG	On-Demand	Anodyne	SLC18A3	32	46
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450883664	DG	On-Demand	Anodyne	WNT3A	62	41
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450883664	DG	On-Demand	Anodyne	TNKS2	18	41
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450883665	DG	On-Demand	Anodyne	HTR2A	16	53
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450883665	DG	On-Demand	Anodyne	SLC18A3	32	46
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450883665	DG	On-Demand	Anodyne	WNT3A	62	41
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450883665	DG	On-Demand	Anodyne	TNKS2	18	41
COC1(CSc2nnc(-c3ccccn3)n2Cc2ccco2)CCC1	ZINC000450883685	FH	On-Demand	Anodyne	HCRTR2	0	41
COC(=O)c1coc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883693	EF	On-Demand	Anodyne	SLC18A3	36	47
COC(=O)c1coc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883693	EF	On-Demand	Anodyne	CACNA1G	36	56
COC(=O)c1coc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)n1	ZINC000450883693	EF	On-Demand	Anodyne	WNT3A	64	41
CCn1c(COc2ccc(C)cc2)nnc1SCC[C@@H]1CCOC1	ZINC000450883695	EH	On-Demand	Anodyne	VCP	45	38
CCn1c(COc2ccc(C)cc2)nnc1SCC[C@H]1CCOC1	ZINC000450883696	EH	On-Demand	Anodyne	VCP	45	38
C[C@H]1CN(CCN(C)CCCC(=O)c2ccccc2)C[C@@H](C)O1	ZINC000450883702	DF	On-Demand	Anodyne	CYP2J2	54	39
FC1(F)CC[C@@H](CSc2nnc(-c3cccs3)n2Cc2ccco2)C1	ZINC000450883705	GK	On-Demand	Anodyne	HCRTR2	19	40
FC1(F)CC[C@H](CSc2nnc(-c3cccs3)n2Cc2ccco2)C1	ZINC000450883706	GK	On-Demand	Anodyne	HCRTR2	19	40
CO[C@@H](Cc1ccccc1)CN1CCC(n2ccc(C)n2)CC1	ZINC000450883720	DG	On-Demand	Anodyne	DRD4	21	43
CO[C@H](Cc1ccccc1)CN1CCC(n2ccc(C)n2)CC1	ZINC000450883721	DG	On-Demand	Anodyne	DRD4	21	43
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883731	EH	On-Demand	Anodyne	HTR2A	20	53
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883731	EH	On-Demand	Anodyne	SLC18A3	33	46
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883731	EH	On-Demand	Anodyne	WNT3A	60	40
CC(C)N1CCCC[C@H]1CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883731	EH	On-Demand	Anodyne	TNKS2	18	40
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883732	EH	On-Demand	Anodyne	HTR2A	20	53
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883732	EH	On-Demand	Anodyne	SLC18A3	33	46
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883732	EH	On-Demand	Anodyne	WNT3A	60	40
CC(C)N1CCCC[C@@H]1CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450883732	EH	On-Demand	Anodyne	TNKS2	18	40
N#C[C@@H]1CC[C@@H](Sc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)C1	ZINC000450883750	GK	On-Demand	Mild	HCRTR2	16	42
N#C[C@@H]1CC[C@H](Sc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)C1	ZINC000450883751	GK	On-Demand	Mild	HCRTR2	16	42
N#C[C@H]1CC[C@H](Sc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)C1	ZINC000450883752	GK	On-Demand	Mild	HCRTR2	16	42
N#C[C@H]1CC[C@@H](Sc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)C1	ZINC000450883753	GK	On-Demand	Mild	HCRTR2	16	42
CCOC(=O)c1cnc2c(OC)cccc2c1N1CCC[C@]2(CCOC2)C1	ZINC000450883816	FG	On-Demand	Anodyne	ATP4A	19	49
CCOC(=O)c1cnc2c(OC)cccc2c1N1CCC[C@@]2(CCOC2)C1	ZINC000450883817	FG	On-Demand	Anodyne	ATP4A	19	49
CC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1	ZINC000450883830	DF	On-Demand	Anodyne	HRH1	22	40
CC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1	ZINC000450883830	DF	On-Demand	Anodyne	HRH3	23	43
CC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1	ZINC000450883830	DF	On-Demand	Anodyne	SIGMAR1	31	42
CC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1	ZINC000450883830	DF	On-Demand	Anodyne	SSTR5	49	39
CC(=O)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1	ZINC000450883830	DF	On-Demand	Anodyne	CXCR3	22	40
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccccc3)CCN2C1=O	ZINC000450883832	EF	On-Demand	Anodyne	DRD2	28	46
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccccc3)CCN2C1=O	ZINC000450883832	EF	On-Demand	Anodyne	DRD4	0	43
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccccc3)CCN2C1=O	ZINC000450883832	EF	On-Demand	Anodyne	CYP2J2	58	42
CC1(c2ccc(Cl)cc2)CCN(Cc2cnn[nH]2)CC1	ZINC000450883833	CG	On-Demand	Anodyne	DRD3	0	50
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccccc3)CCN2C1=O	ZINC000450883834	EF	On-Demand	Anodyne	DRD2	28	46
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccccc3)CCN2C1=O	ZINC000450883834	EF	On-Demand	Anodyne	DRD4	0	43
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccccc3)CCN2C1=O	ZINC000450883834	EF	On-Demand	Anodyne	CYP2J2	58	42
CS(=O)(=O)c1ccc(N2CCC[C@]3(CCOC3)C2)c(F)c1	ZINC000450883853	DE	On-Demand	Anodyne	SLC6A9	23	47
CS(=O)(=O)c1ccc(N2CCC[C@@]3(CCOC3)C2)c(F)c1	ZINC000450883856	DE	On-Demand	Anodyne	SLC6A9	23	47
COc1cccc(OCCC(=O)NC[C@@]2(O)CCN(C)C2)c1	ZINC000450883872	DC	On-Demand	Anodyne	DRD4	44	34
COc1cccc(OCCC(=O)NC[C@@]2(O)CCN(C)C2)c1	ZINC000450883872	DC	On-Demand	Anodyne	MTNR1A	42	39
COc1cccc(OCCC(=O)NC[C@@]2(O)CCN(C)C2)c1	ZINC000450883872	DC	On-Demand	Anodyne	MTNR1B	41	40
COc1cccc(OCCC(=O)NC[C@]2(O)CCN(C)C2)c1	ZINC000450883874	DC	On-Demand	Anodyne	DRD4	44	34
COc1cccc(OCCC(=O)NC[C@]2(O)CCN(C)C2)c1	ZINC000450883874	DC	On-Demand	Anodyne	MTNR1A	42	39
COc1cccc(OCCC(=O)NC[C@]2(O)CCN(C)C2)c1	ZINC000450883874	DC	On-Demand	Anodyne	MTNR1B	41	40
NC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nn1	ZINC000450883883	DE	On-Demand	Anodyne	SCD1	22	46
Clc1ccc(CCN2CCC(Oc3cnccn3)CC2)cc1	ZINC000450883887	DG	On-Demand	Anodyne	SIGMAR1	18	46
CNC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450883905	EF	On-Demand	Anodyne	SCD1	69	46
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883908	FF	On-Demand	Anodyne	DRD2	32	51
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883908	FF	On-Demand	Anodyne	DRD4	22	49
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883908	FF	On-Demand	Anodyne	HTR2A	22	50
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883908	FF	On-Demand	Anodyne	SLC18A3	0	42
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883908	FF	On-Demand	Anodyne	HTR3B	0	43
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883908	FF	On-Demand	Anodyne	CYP2J2	51	36
CC(C)CN1C[C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883908	FF	On-Demand	Anodyne	NET	0	45
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883910	FF	On-Demand	Anodyne	DRD2	32	51
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883910	FF	On-Demand	Anodyne	DRD4	22	49
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883910	FF	On-Demand	Anodyne	HTR2A	22	50
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883910	FF	On-Demand	Anodyne	SLC18A3	0	42
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883910	FF	On-Demand	Anodyne	HTR3B	0	43
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883910	FF	On-Demand	Anodyne	CYP2J2	51	36
CC(C)CN1C[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C1=O	ZINC000450883910	FF	On-Demand	Anodyne	NET	0	45
C=CCOc1ccc(-c2nnc(SCc3nnc(C(C)C)s3)o2)cc1	ZINC000450883939	FJ	On-Demand	Mild	GSK3B	0	44
CCc1nc(C)c(CSc2nnc(-c3ccco3)n2-c2ccc(OC)cc2)o1	ZINC000450883952	GJ	On-Demand	Anodyne	WNT3A	22	42
CCc1nc(C)c(CSc2nnc(-c3ccco3)n2-c2ccc(OC)cc2)o1	ZINC000450883952	GJ	On-Demand	Anodyne	TNKS2	15	42
CCc1nc(C)c(CSc2nnc(-c3ccco3)n2-c2ccc(OC)cc2)o1	ZINC000450883952	GJ	On-Demand	Anodyne	AXIN2	0	44
O=S1(=O)CCCN1[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450883956	EF	On-Demand	Anodyne	SLC6A1	66	39
O=S1(=O)CCCN1[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450883957	EF	On-Demand	Anodyne	SLC6A1	66	39
O=S1(=O)CCCN1[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450883958	EF	On-Demand	Anodyne	SLC6A1	66	39
O=S1(=O)CCCN1[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450883959	EF	On-Demand	Anodyne	SLC6A1	66	39
Cc1ccn(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450883976	DG	On-Demand	Anodyne	DRD4	23	46
Cc1ccn(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450883976	DG	On-Demand	Anodyne	HTR2A	23	46
Cc1ccn(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450883976	DG	On-Demand	Anodyne	HTR2C	22	55
Cc1ccn(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450883976	DG	On-Demand	Anodyne	HTR7	23	41
Cc1ccn(C2CCN(CCCC(=O)c3ccccc3)CC2)n1	ZINC000450883976	DG	On-Demand	Anodyne	CYP2J2	73	54
CCc1nc(C)c(CSc2nnc(-c3cccs3)n2Cc2ccco2)o1	ZINC000450883984	GJ	On-Demand	Anodyne	HCRTR2	19	42
COc1ccc(-n2c(COc3ccc(C)cc3)nnc2SCC[C@H](C)O)cc1	ZINC000450883989	GI	On-Demand	Anodyne	VCP	69	42
COc1ccc(-n2c(COc3ccc(C)cc3)nnc2SCC[C@H](C)O)cc1	ZINC000450883989	GI	On-Demand	Anodyne	AXIN2	0	40
COc1ccc(-n2c(COc3ccc(C)cc3)nnc2SCC[C@@H](C)O)cc1	ZINC000450883990	GI	On-Demand	Anodyne	VCP	69	42
COc1ccc(-n2c(COc3ccc(C)cc3)nnc2SCC[C@@H](C)O)cc1	ZINC000450883990	GI	On-Demand	Anodyne	AXIN2	0	40
O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NC1CCN(C2CCC2)CC1	ZINC000450883993	FF	On-Demand	Bother	SSTR5	45	36
CCn1c(COc2ccc(C)cc2)nnc1S[C@H]1C[C@H](C)CCC1=O	ZINC000450884013	FI	On-Demand	Anodyne	VCP	60	40
CCn1c(COc2ccc(C)cc2)nnc1S[C@@H]1C[C@H](C)CCC1=O	ZINC000450884014	FI	On-Demand	Anodyne	VCP	60	40
CCn1c(COc2ccc(C)cc2)nnc1S[C@@H]1C[C@@H](C)CCC1=O	ZINC000450884015	FI	On-Demand	Anodyne	VCP	60	40
CCn1c(COc2ccc(C)cc2)nnc1S[C@H]1C[C@@H](C)CCC1=O	ZINC000450884016	FI	On-Demand	Anodyne	VCP	60	40
C[C@@H](O)CCSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450884017	EF	On-Demand	Anodyne	HCRTR2	22	45
C[C@H](O)CCSc1nnc(-c2ccccn2)n1Cc1ccco1	ZINC000450884018	EF	On-Demand	Anodyne	HCRTR2	22	45
CCN(CC)S(=O)(=O)c1ccc(SCc2cccnc2)c([N+](=O)[O-])c1	ZINC000450884033	GG	On-Demand	Bother	COLA	44	32
c1ccc(OCc2nnc(SC[C@H]3C[C@H]4CC[C@H]3O4)n2-c2ccccc2)cc1	ZINC000450884038	GJ	On-Demand	Anodyne	VCP	83	55
c1ccc(OCc2nnc(SC[C@@H]3C[C@H]4CC[C@H]3O4)n2-c2ccccc2)cc1	ZINC000450884039	GJ	On-Demand	Anodyne	VCP	83	55
C[C@@H](c1ccccc1)[C@H](O)CN1CCC[C@H](O)C1	ZINC000450884040	BD	On-Demand	Anodyne	OPRK1	36	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](O)C1	ZINC000450884041	BD	On-Demand	Anodyne	OPRK1	36	46
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884053	FE	On-Demand	Mild	FASN	40	36
Cc1[nH]c(C#N)cc1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884054	FE	On-Demand	Mild	FASN	40	36
COc1ccc(CNC(=O)CCN2CC(=O)N(C3CC3)C2)c(OC)c1	ZINC000450884059	EC	On-Demand	Anodyne	MTNR1A	40	34
CS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)c(F)c1	ZINC000450884087	FH	On-Demand	Anodyne	PTGS2	32	41
CS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)c(F)c1	ZINC000450884087	FH	On-Demand	Anodyne	CACNA1B	53	39
CS(=O)(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)c(F)c1	ZINC000450884087	FH	On-Demand	Anodyne	SLC6A9	38	42
O[C@@H]([C@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884101	EH	On-Demand	Anodyne	LUCI_LUCLA	20	48
O[C@@H]([C@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884101	EH	On-Demand	Anodyne	MLYCD	66	42
O[C@@H]([C@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884101	EH	On-Demand	Anodyne	SCD1	19	43
O[C@H]([C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884106	EH	On-Demand	Anodyne	LUCI_LUCLA	20	48
O[C@H]([C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884106	EH	On-Demand	Anodyne	MLYCD	66	42
O[C@H]([C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884106	EH	On-Demand	Anodyne	SCD1	19	43
O[C@H]([C@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884107	EH	On-Demand	Anodyne	LUCI_LUCLA	20	48
O[C@H]([C@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884107	EH	On-Demand	Anodyne	MLYCD	66	42
O[C@H]([C@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884107	EH	On-Demand	Anodyne	SCD1	19	43
O[C@@H]([C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884108	EH	On-Demand	Anodyne	LUCI_LUCLA	20	48
O[C@@H]([C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884108	EH	On-Demand	Anodyne	MLYCD	66	42
O[C@@H]([C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1)C(F)(F)F	ZINC000450884108	EH	On-Demand	Anodyne	SCD1	19	43
C[C@@H](O)CCN1CCC[C@H](Oc2ncccc2F)C1	ZINC000450884140	CD	On-Demand	Anodyne	SLC6A1	63	36
C[C@H](O)CCN1CCC[C@@H](Oc2ncccc2F)C1	ZINC000450884141	CD	On-Demand	Anodyne	SLC6A1	63	36
C[C@H](O)CCN1CCC[C@H](Oc2ncccc2F)C1	ZINC000450884142	CD	On-Demand	Anodyne	SLC6A1	63	36
C[C@@H](O)CCN1CCC[C@@H](Oc2ncccc2F)C1	ZINC000450884143	CD	On-Demand	Anodyne	SLC6A1	63	36
Cc1ccc2oc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2c1	ZINC000450884150	DF	On-Demand	Anodyne	HCRTR1	17	41
Cc1ccc2oc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2c1	ZINC000450884152	DF	On-Demand	Anodyne	HCRTR1	17	41
Cc1ccc2oc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2c1	ZINC000450884154	DF	On-Demand	Anodyne	HCRTR1	17	41
Cc1ccc2oc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2c1	ZINC000450884156	DF	On-Demand	Anodyne	HCRTR1	17	41
CC(=O)c1cccc(CN2CCC(Oc3ncccc3F)CC2)c1	ZINC000450884168	EG	On-Demand	Anodyne	PRSS2	45	31
CC(=O)c1cccc(CN2CCC(Oc3ncccc3F)CC2)c1	ZINC000450884168	EG	On-Demand	Anodyne	SSTR5	49	38
CC(=O)c1cccc(CN2CCC(Oc3ncccc3F)CC2)c1	ZINC000450884168	EG	On-Demand	Anodyne	SCN9A	0	44
CC(=O)c1cccc(CN2CCC(Oc3ncccc3F)CC2)c1	ZINC000450884168	EG	On-Demand	Anodyne	SCN5A	84	44
CC[C@H](CC(F)(F)F)NC(=O)CCOc1cccc(OC)c1	ZINC000450884170	DG	On-Demand	Anodyne	MTNR1A	42	43
CC[C@H](CC(F)(F)F)NC(=O)CCOc1cccc(OC)c1	ZINC000450884170	DG	On-Demand	Anodyne	MTNR1B	41	43
CC[C@H](CC(F)(F)F)NC(=O)CCOc1cccc(OC)c1	ZINC000450884170	DG	On-Demand	Anodyne	PDS	80	37
CC[C@@H](CC(F)(F)F)NC(=O)CCOc1cccc(OC)c1	ZINC000450884172	DG	On-Demand	Anodyne	MTNR1A	42	43
CC[C@@H](CC(F)(F)F)NC(=O)CCOc1cccc(OC)c1	ZINC000450884172	DG	On-Demand	Anodyne	MTNR1B	41	43
CC[C@@H](CC(F)(F)F)NC(=O)CCOc1cccc(OC)c1	ZINC000450884172	DG	On-Demand	Anodyne	PDS	80	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Oc2ncccc2F)CC1	ZINC000450884180	EG	On-Demand	Anodyne	SCN9A	0	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Oc2ncccc2F)CC1	ZINC000450884180	EG	On-Demand	Anodyne	SCN5A	69	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Oc2ncccc2F)CC1	ZINC000450884181	EG	On-Demand	Anodyne	SCN9A	0	43
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Oc2ncccc2F)CC1	ZINC000450884181	EG	On-Demand	Anodyne	SCN5A	69	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Oc2ncccc2F)CC1	ZINC000450884183	EG	On-Demand	Anodyne	SCN9A	0	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Oc2ncccc2F)CC1	ZINC000450884183	EG	On-Demand	Anodyne	SCN5A	69	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Oc2ncccc2F)CC1	ZINC000450884185	EG	On-Demand	Anodyne	SCN9A	0	43
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Oc2ncccc2F)CC1	ZINC000450884185	EG	On-Demand	Anodyne	SCN5A	69	43
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1OC(C)C	ZINC000450884211	EJ	On-Demand	Anodyne	GRM4	18	40
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1OC(C)C	ZINC000450884211	EJ	On-Demand	Anodyne	ENPP1	77	37
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1OC(C)C	ZINC000450884211	EJ	On-Demand	Anodyne	DRTS_TRYCR	42	29
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1OC(C)C	ZINC000450884211	EJ	On-Demand	Anodyne	KCNK3	48	43
COc1ccc(NC(=O)c2ccc(C)nc2C(C)C)cc1OC(C)C	ZINC000450884211	EJ	On-Demand	Anodyne	KCNK9	41	43
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@]2(CCO[C@@H]2C)O1	ZINC000450884215	GH	On-Demand	Anodyne	CYP2J2	49	35
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@]2(CCO[C@@H]2C)O1	ZINC000450884216	GH	On-Demand	Anodyne	CYP2J2	49	35
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(Br)cc1)C[C@@H](C)O2	ZINC000450884217	GH	On-Demand	Anodyne	CYP2J2	49	35
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(Br)cc1)C[C@@H](C)O2	ZINC000450884218	GH	On-Demand	Anodyne	CYP2J2	49	35
NC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450884219	EE	On-Demand	Anodyne	SCD1	62	47
NC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450884219	EE	On-Demand	Anodyne	SCD	46	41
COc1ccnc(N2CCN(c3nccc(OC)n3)CC(C)C2)n1	ZINC000450884255	ED	On-Demand	Anodyne	SORD	42	37
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450884256	EJ	On-Demand	Anodyne	HTR2A	20	55
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450884256	EJ	On-Demand	Anodyne	SLC18A3	35	47
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450884256	EJ	On-Demand	Anodyne	CACNA1G	40	41
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450884256	EJ	On-Demand	Anodyne	WNT3A	60	38
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450884257	EJ	On-Demand	Anodyne	HTR2A	20	55
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450884257	EJ	On-Demand	Anodyne	SLC18A3	35	47
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450884257	EJ	On-Demand	Anodyne	CACNA1G	40	41
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450884257	EJ	On-Demand	Anodyne	WNT3A	60	38
COC(=O)c1ccc([N+](=O)[O-])c(NC2CCN(C3CCC3)CC2)c1	ZINC000450884258	EF	On-Demand	Bother	L3MBTL1	0	42
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(Cc2cc[nH]n2)CC1	ZINC000450884262	FF	On-Demand	Anodyne	FAAH	0	61
O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(Cc2cc[nH]n2)CC1	ZINC000450884262	FF	On-Demand	Anodyne	EPHX2	22	42
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1SCc1cccnc1	ZINC000450884270	GG	On-Demand	Bother	NAMPT	45	49
CCOc1ccc(-n2c(COc3ccccc3)nnc2SCC[C@H](C)O)cc1	ZINC000450884289	GI	On-Demand	Anodyne	CACNA2D1	60	38
CCOc1ccc(-n2c(COc3ccccc3)nnc2SCC[C@H](C)O)cc1	ZINC000450884289	GI	On-Demand	Anodyne	VCP	75	47
CCOc1ccc(-n2c(COc3ccccc3)nnc2SCC[C@@H](C)O)cc1	ZINC000450884290	GI	On-Demand	Anodyne	CACNA2D1	60	38
CCOc1ccc(-n2c(COc3ccccc3)nnc2SCC[C@@H](C)O)cc1	ZINC000450884290	GI	On-Demand	Anodyne	VCP	75	47
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450884298	EI	On-Demand	Anodyne	HTR2A	22	56
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450884298	EI	On-Demand	Anodyne	SIGMAR1	16	50
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450884298	EI	On-Demand	Anodyne	SLC18A3	34	47
O=C(c1ccc(F)cc1)C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450884298	EI	On-Demand	Anodyne	WNT3A	58	38
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450884299	EI	On-Demand	Anodyne	HTR2A	22	56
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450884299	EI	On-Demand	Anodyne	SIGMAR1	16	50
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450884299	EI	On-Demand	Anodyne	SLC18A3	34	47
O=C(c1ccc(F)cc1)C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450884299	EI	On-Demand	Anodyne	WNT3A	58	38
COCCOC[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884313	ED	On-Demand	Anodyne	ADRB2	28	56
COCCOC[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884313	ED	On-Demand	Anodyne	ADRB3	39	56
COCCOC[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884313	ED	On-Demand	Anodyne	SLC18A3	41	45
COCCOC[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884313	ED	On-Demand	Anodyne	CYP2D6	0	40
COCCOC[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884313	ED	On-Demand	Anodyne	ABCB1	45	42
COCCOC[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884313	ED	On-Demand	Anodyne	HSP90AB1	36	43
COCCOC[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884313	ED	On-Demand	Anodyne	WNT3A	56	36
COCCOC[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884314	ED	On-Demand	Anodyne	ADRB2	28	56
COCCOC[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884314	ED	On-Demand	Anodyne	ADRB3	39	56
COCCOC[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884314	ED	On-Demand	Anodyne	SLC18A3	41	45
COCCOC[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884314	ED	On-Demand	Anodyne	CYP2D6	0	40
COCCOC[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884314	ED	On-Demand	Anodyne	ABCB1	45	42
COCCOC[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884314	ED	On-Demand	Anodyne	HSP90AB1	36	43
COCCOC[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000450884314	ED	On-Demand	Anodyne	WNT3A	56	36
COCCOC[C@@H](O)CN1CCC(F)(c2ccccc2)CC1	ZINC000450884317	DD	On-Demand	Anodyne	ABCB1	48	41
COCCOC[C@@H](O)CN1CCC(F)(c2ccccc2)CC1	ZINC000450884317	DD	On-Demand	Anodyne	HSP90AB1	42	44
COCCOC[C@H](O)CN1CCC(F)(c2ccccc2)CC1	ZINC000450884318	DD	On-Demand	Anodyne	ABCB1	48	41
COCCOC[C@H](O)CN1CCC(F)(c2ccccc2)CC1	ZINC000450884318	DD	On-Demand	Anodyne	HSP90AB1	42	44
O=[N+]([O-])c1ccc(SCc2cccnc2)c(S(=O)(=O)N2CCOCC2)c1	ZINC000450884320	GE	On-Demand	Bother	NAMPT	23	44
COC(=O)c1coc(CN2C[C@H](O)Cc3ccccc32)n1	ZINC000450884327	CD	On-Demand	Anodyne	TPP2	53	32
COC(=O)c1coc(CN2C[C@@H](O)Cc3ccccc32)n1	ZINC000450884328	CD	On-Demand	Anodyne	TPP2	53	32
FC(F)c1ccnc(NC2CCN(C3CCC3)CC2)n1	ZINC000450884329	CF	On-Demand	Anodyne	MAPK1	50	34
CN1CC[C@](O)(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450884346	EC	On-Demand	Anodyne	NPFFR2	41	38
CN1CC[C@](O)(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450884346	EC	On-Demand	Anodyne	NPFFR1	54	38
CN1CC[C@@](O)(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450884347	EC	On-Demand	Anodyne	NPFFR2	41	38
CN1CC[C@@](O)(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450884347	EC	On-Demand	Anodyne	NPFFR1	54	38
c1ccc(-c2nnc(SCc3cn(CC4CC4)nn3)n2Cc2ccco2)nc1	ZINC000450884354	GG	On-Demand	Anodyne	HCRTR2	20	42
CCn1c(COc2ccc(C)cc2)nnc1SCC1(C(=O)OC)CCCC1	ZINC000450884355	GI	On-Demand	Anodyne	VCP	57	38
O=C(c1ccc(N2CCC2)nc1)N1CC=C(c2cccc(Br)c2)CC1	ZINC000450884365	GH	On-Demand	Anodyne	ADK	20	41
C=CCOc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450884399	EI	On-Demand	Mild	TYMS	0	40
C=CCOc1ccc(-c2nnc(SCCC(C)(F)F)o2)cc1	ZINC000450884399	EI	On-Demand	Mild	GSK3B	0	43
CCOC(=O)c1ccc(CN2CCCC[C@H]2C[C@H](C)O)nc1	ZINC000450884400	DE	On-Demand	Anodyne	SCARB1	41	32
CCOC(=O)c1ccc(CN2CCCC[C@H]2C[C@@H](C)O)nc1	ZINC000450884401	DE	On-Demand	Anodyne	SCARB1	41	32
CCOC(=O)c1ccc(CN2CCCC[C@@H]2C[C@@H](C)O)nc1	ZINC000450884402	DE	On-Demand	Anodyne	SCARB1	41	32
CCOC(=O)c1ccc(CN2CCCC[C@@H]2C[C@H](C)O)nc1	ZINC000450884403	DE	On-Demand	Anodyne	SCARB1	41	32
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1ccc(Cl)cc1OC(F)F	ZINC000450884428	GI	On-Demand	Anodyne	PDE4D	16	46
O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1ccc(Cl)cc1OC(F)F	ZINC000450884428	GI	On-Demand	Anodyne	PDEC	0	46
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1ccc(Cl)cc1OC(F)F	ZINC000450884430	GI	On-Demand	Anodyne	PDE4D	16	46
O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1ccc(Cl)cc1OC(F)F	ZINC000450884430	GI	On-Demand	Anodyne	PDEC	0	46
C=CCOc1ccc(-c2nnc(SCC3(OC)CCC3)o2)cc1	ZINC000450884456	EH	On-Demand	Mild	GSK3B	0	45
C=CCOc1ccc(-c2nnc(SCC3(OC)CCC3)o2)cc1	ZINC000450884456	EH	On-Demand	Mild	GSK3A	30	42
O=C(NC1CC1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450884485	FE	On-Demand	Bother	MAPK13	61	36
O=C(NC1CC1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450884485	FE	On-Demand	Bother	TAAR1	33	44
O=C(NC1CC1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450884486	FE	On-Demand	Bother	MAPK13	61	36
O=C(NC1CC1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450884486	FE	On-Demand	Bother	TAAR1	33	44
O=C(NC1CC1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450884487	FE	On-Demand	Bother	MAPK13	61	36
O=C(NC1CC1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450884487	FE	On-Demand	Bother	TAAR1	33	44
O=C(NC1CC1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450884488	FE	On-Demand	Bother	MAPK13	61	36
O=C(NC1CC1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450884488	FE	On-Demand	Bother	TAAR1	33	44
COc1cc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884489	EG	On-Demand	Anodyne	PDE3A	48	38
COc1cc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884489	EG	On-Demand	Anodyne	PDE3B	70	36
COc1cc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884489	EG	On-Demand	Anodyne	MET	45	33
COc1cc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884490	EG	On-Demand	Anodyne	PDE3A	48	38
COc1cc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884490	EG	On-Demand	Anodyne	PDE3B	70	36
COc1cc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884490	EG	On-Demand	Anodyne	MET	45	33
COc1cc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884491	EG	On-Demand	Anodyne	PDE3A	48	38
COc1cc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884491	EG	On-Demand	Anodyne	PDE3B	70	36
COc1cc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884491	EG	On-Demand	Anodyne	MET	45	33
COc1cc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884492	EG	On-Demand	Anodyne	PDE3A	48	38
COc1cc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884492	EG	On-Demand	Anodyne	PDE3B	70	36
COc1cc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ccnc2cc1F	ZINC000450884492	EG	On-Demand	Anodyne	MET	45	33
O[C@H]([C@@H]1CCN(c2nccc(C(F)(F)F)n2)C1)C(F)(F)F	ZINC000450884511	DE	On-Demand	Anodyne	RBP4	18	57
O[C@H]([C@H]1CCN(c2nccc(C(F)(F)F)n2)C1)C(F)(F)F	ZINC000450884512	DE	On-Demand	Anodyne	RBP4	18	57
O[C@@H]([C@@H]1CCN(c2nccc(C(F)(F)F)n2)C1)C(F)(F)F	ZINC000450884513	DE	On-Demand	Anodyne	RBP4	18	57
O[C@@H]([C@H]1CCN(c2nccc(C(F)(F)F)n2)C1)C(F)(F)F	ZINC000450884514	DE	On-Demand	Anodyne	RBP4	18	57
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884532	FG	On-Demand	Anodyne	FAAH	22	40
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884532	FG	On-Demand	Anodyne	SCD1	44	39
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884532	FG	On-Demand	Anodyne	SCD	38	41
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884533	FG	On-Demand	Anodyne	FAAH	22	40
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884533	FG	On-Demand	Anodyne	SCD1	44	39
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884533	FG	On-Demand	Anodyne	SCD	38	41
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884534	FG	On-Demand	Anodyne	FAAH	22	40
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884534	FG	On-Demand	Anodyne	SCD1	44	39
CC[C@@H]1CCC[C@H]1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884534	FG	On-Demand	Anodyne	SCD	38	41
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884535	FG	On-Demand	Anodyne	FAAH	22	40
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884535	FG	On-Demand	Anodyne	SCD1	44	39
CC[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884535	FG	On-Demand	Anodyne	SCD	38	41
CCOc1ccc(-n2c(SC[C@H](O)CC#N)nnc2-c2ccc(F)cc2)cc1	ZINC000450884559	GH	On-Demand	Mild	CACNA2D1	67	48
CCOc1ccc(-n2c(SC[C@H](O)CC#N)nnc2-c2ccc(F)cc2)cc1	ZINC000450884559	GH	On-Demand	Mild	WNT3A	20	45
COC1(CSc2nnc(COc3ccccc3)n2C)CCC1	ZINC000450884576	DG	On-Demand	Anodyne	VCP	54	32
c1nc(N2CCC[C@@]3(CCOC3)C2)c2c3c(sc2n1)CCCC3	ZINC000450884598	EH	On-Demand	Anodyne	RBP4	17	43
c1nc(N2CCC[C@]3(CCOC3)C2)c2c3c(sc2n1)CCCC3	ZINC000450884599	EH	On-Demand	Anodyne	RBP4	17	43
CCn1nccc1C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450884606	EH	On-Demand	Anodyne	DRD4	31	43
CCn1nccc1C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450884606	EH	On-Demand	Anodyne	SSTR5	83	44
NC(=O)c1cccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)c1[N+](=O)[O-]	ZINC000450884609	GG	On-Demand	Bother	CCR3	41	42
CCSc1cccnc1C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884641	GG	On-Demand	Anodyne	SCD	25	42
CCSc1cccnc1C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450884643	GG	On-Demand	Anodyne	SCD	25	42
CCOC(=O)c1cccnc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450884669	DE	On-Demand	Anodyne	P2RY12	48	37
CCOC(=O)c1cccnc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450884669	DE	On-Demand	Anodyne	PRKCQ	40	30
CCOC(=O)c1cccnc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450884670	DE	On-Demand	Anodyne	P2RY12	48	37
CCOC(=O)c1cccnc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450884670	DE	On-Demand	Anodyne	PRKCQ	40	30
CCOC(=O)c1cccnc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450884671	DE	On-Demand	Anodyne	P2RY12	48	37
CCOC(=O)c1cccnc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450884671	DE	On-Demand	Anodyne	PRKCQ	40	30
CCOC(=O)c1cccnc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450884672	DE	On-Demand	Anodyne	P2RY12	48	37
CCOC(=O)c1cccnc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450884672	DE	On-Demand	Anodyne	PRKCQ	40	30
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450884677	GE	On-Demand	Anodyne	HCRTR2	39	41
CN(C)c1ncccc1O[C@H]1CCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450884678	GE	On-Demand	Anodyne	HCRTR2	39	41
C=C[C@H]1CCCCN1CCCC(=O)c1ccccc1	ZINC000450884700	CH	On-Demand	Mild	SLC6A1	92	40
C=C[C@H]1CCCCN1CCCC(=O)c1ccccc1	ZINC000450884700	CH	On-Demand	Mild	PREP	34	41
C=C[C@H]1CCCCN1CCCC(=O)c1ccccc1	ZINC000450884700	CH	On-Demand	Mild	CYP2J2	60	47
C=C[C@@H]1CCCCN1CCCC(=O)c1ccccc1	ZINC000450884701	CH	On-Demand	Mild	SLC6A1	92	40
C=C[C@@H]1CCCCN1CCCC(=O)c1ccccc1	ZINC000450884701	CH	On-Demand	Mild	PREP	34	41
C=C[C@@H]1CCCCN1CCCC(=O)c1ccccc1	ZINC000450884701	CH	On-Demand	Mild	CYP2J2	60	47
CC(=O)c1cccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1	ZINC000450884702	EF	On-Demand	Bother	SIGMAR1	22	41
O=[N+]([O-])c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1C(F)(F)F	ZINC000450884716	FG	On-Demand	Bother	AADAC	0	41
O=[N+]([O-])c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1C(F)(F)F	ZINC000450884717	FG	On-Demand	Bother	AADAC	0	41
O=[N+]([O-])c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1C(F)(F)F	ZINC000450884718	FG	On-Demand	Bother	AADAC	0	41
O=[N+]([O-])c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1C(F)(F)F	ZINC000450884719	FG	On-Demand	Bother	AADAC	0	41
O=[N+]([O-])c1ccn(C2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450884736	EG	On-Demand	Bother	KCNJ1	29	41
COc1cc(C(C)=O)c(OC)cc1OC[C@H]1COCCO1	ZINC000450884738	CD	On-Demand	Anodyne	EPHA2	43	32
COc1cc(C(C)=O)c(OC)cc1OC[C@@H]1COCCO1	ZINC000450884739	CD	On-Demand	Anodyne	EPHA2	43	32
COc1ccc(Nc2cc(N3CCC[C@]4(CCOC4)C3)ncn2)c(OC)c1	ZINC000450884753	FG	On-Demand	Anodyne	GALR2	41	33
COc1ccc(Nc2cc(N3CCC[C@@]4(CCOC4)C3)ncn2)c(OC)c1	ZINC000450884754	FG	On-Demand	Anodyne	GALR2	41	33
Cc1ccnc(N2CCC(Cc3cc(F)cc(F)c3)CC2)n1	ZINC000450884769	DH	On-Demand	Anodyne	SORD	22	40
C[C@@H](O)CCCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450884845	GG	On-Demand	Anodyne	Q9M629_MAIZE	48	31
C[C@H](O)CCCn1cnc2c(cnn2Cc2ccc(Cl)cc2Cl)c1=O	ZINC000450884846	GG	On-Demand	Anodyne	Q9M629_MAIZE	48	31
CN1CC[C@](O)(CNC(=O)c2cccnc2-n2cc(Br)cn2)C1	ZINC000450884847	GC	On-Demand	Anodyne	HCN1	65	38
CN1CC[C@](O)(CNC(=O)c2cccnc2-n2cc(Br)cn2)C1	ZINC000450884847	GC	On-Demand	Anodyne	HCN4	51	33
CN1CC[C@@](O)(CNC(=O)c2cccnc2-n2cc(Br)cn2)C1	ZINC000450884848	GC	On-Demand	Anodyne	HCN1	65	38
CN1CC[C@@](O)(CNC(=O)c2cccnc2-n2cc(Br)cn2)C1	ZINC000450884848	GC	On-Demand	Anodyne	HCN4	51	33
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450884859	FE	On-Demand	Anodyne	SCD	24	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450884860	FE	On-Demand	Anodyne	SCD	24	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450884861	FE	On-Demand	Anodyne	SCD	24	40
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450884862	FE	On-Demand	Anodyne	SCD	24	40
NC(=O)c1cnc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450884871	DD	On-Demand	Anodyne	CXCR3	35	48
NC(=O)c1cnc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450884872	DD	On-Demand	Anodyne	CXCR3	35	48
NC(=O)c1cnc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450884873	DD	On-Demand	Anodyne	CXCR3	35	48
NC(=O)c1cnc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450884874	DD	On-Demand	Anodyne	CXCR3	35	48
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450884903	ED	On-Demand	Anodyne	SLC6A9	47	45
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450884903	ED	On-Demand	Anodyne	GPR119	39	49
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450884904	ED	On-Demand	Anodyne	SLC6A9	47	45
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450884904	ED	On-Demand	Anodyne	GPR119	39	49
CS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450884905	ED	On-Demand	Anodyne	SLC6A9	47	45
CS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450884905	ED	On-Demand	Anodyne	GPR119	39	49
CS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450884906	ED	On-Demand	Anodyne	SLC6A9	47	45
CS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450884906	ED	On-Demand	Anodyne	GPR119	39	49
CCC(=O)c1ccc(OCCCCCC(C)=O)c(F)c1	ZINC000450884907	CH	On-Demand	Anodyne	THRA	60	61
CCC(=O)c1ccc(OCCCCCC(C)=O)c(F)c1	ZINC000450884907	CH	On-Demand	Anodyne	THRB	39	61
CCC(=O)c1ccc(OCCCCCC(C)=O)c(F)c1	ZINC000450884907	CH	On-Demand	Anodyne	GRM2	20	46
CC(C)(C)n1ncc2c(=O)n(CCc3c(Cl)cccc3Cl)cnc21	ZINC000450884908	FH	On-Demand	Anodyne	Q9M629_MAIZE	53	33
Cc1nc(-c2ccccn2)nc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c1C	ZINC000450884928	FF	On-Demand	Anodyne	METAP1	26	42
Cc1nc(-c2ccccn2)nc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c1C	ZINC000450884929	FF	On-Demand	Anodyne	METAP1	26	42
Cc1nc(-c2ccccn2)nc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c1C	ZINC000450884930	FF	On-Demand	Anodyne	METAP1	26	42
Cc1nc(-c2ccccn2)nc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c1C	ZINC000450884931	FF	On-Demand	Anodyne	METAP1	26	42
O=S(=O)(c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCCCC1	ZINC000450884932	GE	On-Demand	Anodyne	GCK	59	34
O=S(=O)(c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCCCC1	ZINC000450884932	GE	On-Demand	Anodyne	GCKR	66	35
O=S(=O)(c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCCCC1	ZINC000450884933	GE	On-Demand	Anodyne	GCK	59	34
O=S(=O)(c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCCCC1	ZINC000450884933	GE	On-Demand	Anodyne	GCKR	66	35
O=S(=O)(c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCCCC1	ZINC000450884934	GE	On-Demand	Anodyne	GCK	59	34
O=S(=O)(c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1)N1CCCCC1	ZINC000450884934	GE	On-Demand	Anodyne	GCKR	66	35
O=S(=O)(c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCCCC1	ZINC000450884935	GE	On-Demand	Anodyne	GCK	59	34
O=S(=O)(c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1)N1CCCCC1	ZINC000450884935	GE	On-Demand	Anodyne	GCKR	66	35
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncc(C)cn1	ZINC000450884954	FF	On-Demand	Anodyne	P2RX2	42	42
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncc(C)cn1	ZINC000450884954	FF	On-Demand	Anodyne	P2RX3	40	42
COc1ccc(Br)cc1C[C@H](CO)CNc1ncc(C)cn1	ZINC000450884955	FF	On-Demand	Anodyne	P2RX2	42	42
COc1ccc(Br)cc1C[C@H](CO)CNc1ncc(C)cn1	ZINC000450884955	FF	On-Demand	Anodyne	P2RX3	40	42
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncccc1F	ZINC000450884981	FG	On-Demand	Anodyne	MC4R	0	43
COc1ccc(Br)cc1C[C@H](CO)CNc1ncccc1F	ZINC000450884982	FG	On-Demand	Anodyne	MC4R	0	43
COc1cc(CN2C[C@H](C3CC3)O[C@H](C)C2)ccc1Cl	ZINC000450884989	CG	On-Demand	Anodyne	SSTR5	40	36
COc1cc(CN2C[C@@H](C)O[C@H](C3CC3)C2)ccc1Cl	ZINC000450884990	CG	On-Demand	Anodyne	SSTR5	40	36
COc1cc(CN2C[C@H](C)O[C@@H](C3CC3)C2)ccc1Cl	ZINC000450884991	CG	On-Demand	Anodyne	SSTR5	40	36
COc1cc(CN2C[C@H](C)O[C@H](C3CC3)C2)ccc1Cl	ZINC000450884992	CG	On-Demand	Anodyne	SSTR5	40	36
Cc1nnc2c3ccccc3c(NCCC[C@@H]3CCOC3)nn12	ZINC000450884997	DE	On-Demand	Anodyne	BRD9	47	37
Cc1nnc2c3ccccc3c(NCCC[C@H]3CCOC3)nn12	ZINC000450884998	DE	On-Demand	Anodyne	BRD9	47	37
CCCc1nccn1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450885007	CF	On-Demand	Anodyne	CYP17A1	15	40
CCC(=O)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450885016	DG	On-Demand	Bother	TAAR1	15	43
CCC(=O)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450885017	DG	On-Demand	Bother	TAAR1	15	43
CC(=O)CCCCCOc1cc(F)ccc1Br	ZINC000450885043	DI	On-Demand	Anodyne	SCD	0	41
CC(=O)CCCCCOc1cc(F)ccc1Br	ZINC000450885043	DI	On-Demand	Anodyne	SCD5	0	41
Cn1c(COc2ccccc2)nnc1SC1CC(OC(C)(C)C)C1	ZINC000450885050	EH	On-Demand	Anodyne	VCP	79	49
CN(C)C(=O)c1cnc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450885064	FE	On-Demand	Anodyne	CXCR3	34	45
CN(C)C(=O)c1cnc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450885066	FE	On-Demand	Anodyne	CXCR3	34	45
CN(C)C(=O)c1cnc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450885067	FE	On-Demand	Anodyne	CXCR3	34	45
CN(C)C(=O)c1cnc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450885068	FE	On-Demand	Anodyne	CXCR3	34	45
CC[C@@H](O)CC(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450885073	CF	On-Demand	Anodyne	SLC1A2	49	34
CC[C@@H](O)CC(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450885073	CF	On-Demand	Anodyne	ENPP1	74	43
CC[C@@H](O)CC(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450885073	CF	On-Demand	Anodyne	KCNK3	43	36
CC[C@H](O)CC(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450885074	CF	On-Demand	Anodyne	SLC1A2	49	34
CC[C@H](O)CC(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450885074	CF	On-Demand	Anodyne	ENPP1	74	43
CC[C@H](O)CC(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000450885074	CF	On-Demand	Anodyne	KCNK3	43	36
CN(CCN1CCC[C@H](c2ccnc(N)n2)C1)Cc1ccccc1	ZINC000450885075	EE	On-Demand	Anodyne	SLC6A1	41	32
CN(CCN1CCC[C@H](c2ccnc(N)n2)C1)Cc1ccccc1	ZINC000450885075	EE	On-Demand	Anodyne	SIGMAR1	15	41
CN(CCN1CCC[C@@H](c2ccnc(N)n2)C1)Cc1ccccc1	ZINC000450885076	EE	On-Demand	Anodyne	SLC6A1	41	32
CN(CCN1CCC[C@@H](c2ccnc(N)n2)C1)Cc1ccccc1	ZINC000450885076	EE	On-Demand	Anodyne	SIGMAR1	15	41
CCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885084	DD	On-Demand	Anodyne	MCHR1	0	43
CCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885084	DD	On-Demand	Anodyne	SCD1	26	44
CCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885084	DD	On-Demand	Anodyne	SCD	23	44
CCNC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885084	DD	On-Demand	Anodyne	HPGDS	32	44
CCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885085	DD	On-Demand	Anodyne	MCHR1	0	43
CCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885085	DD	On-Demand	Anodyne	SCD1	26	44
CCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885085	DD	On-Demand	Anodyne	SCD	23	44
CCNC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885085	DD	On-Demand	Anodyne	HPGDS	32	44
CCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885086	DD	On-Demand	Anodyne	MCHR1	0	43
CCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885086	DD	On-Demand	Anodyne	SCD1	26	44
CCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885086	DD	On-Demand	Anodyne	SCD	23	44
CCNC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885086	DD	On-Demand	Anodyne	HPGDS	32	44
COCCOC[C@H](O)CN1CCOc2c(F)cccc2C1	ZINC000450885088	CD	On-Demand	Anodyne	ABCB1	47	35
CCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885089	DD	On-Demand	Anodyne	MCHR1	0	43
CCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885089	DD	On-Demand	Anodyne	SCD1	26	44
CCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885089	DD	On-Demand	Anodyne	SCD	23	44
CCNC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885089	DD	On-Demand	Anodyne	HPGDS	32	44
COCCOC[C@@H](O)CN1CCOc2c(F)cccc2C1	ZINC000450885090	CD	On-Demand	Anodyne	ABCB1	47	35
NC(=O)c1ccnc(N2CCC(Cc3cc(F)cc(F)c3)CC2)c1[N+](=O)[O-]	ZINC000450885092	GF	On-Demand	Bother	SIRT3	51	34
NC(=O)c1ccnc(N2CCC(Cc3cc(F)cc(F)c3)CC2)c1[N+](=O)[O-]	ZINC000450885092	GF	On-Demand	Bother	SIRT2	42	34
O[C@@H]([C@@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1)C(F)(F)F	ZINC000450885103	FF	On-Demand	Anodyne	LRRK2	22	44
O[C@H]([C@@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1)C(F)(F)F	ZINC000450885106	FF	On-Demand	Anodyne	LRRK2	22	44
O[C@H]([C@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1)C(F)(F)F	ZINC000450885108	FF	On-Demand	Anodyne	LRRK2	22	44
O[C@@H]([C@H]1CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1)C(F)(F)F	ZINC000450885110	FF	On-Demand	Anodyne	LRRK2	22	44
C[C@H](Sc1nnc(COc2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450885122	FI	On-Demand	Anodyne	NPY1R	40	34
C[C@H](Sc1nnc(COc2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450885122	FI	On-Demand	Anodyne	COLA	87	35
C[C@H](Sc1nnc(COc2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450885122	FI	On-Demand	Anodyne	CPT1A	81	35
C[C@H](Sc1nnc(COc2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450885122	FI	On-Demand	Anodyne	VCP	79	49
C[C@@H](Sc1nnc(COc2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450885128	FI	On-Demand	Anodyne	NPY1R	40	34
C[C@@H](Sc1nnc(COc2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450885128	FI	On-Demand	Anodyne	COLA	87	35
C[C@@H](Sc1nnc(COc2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450885128	FI	On-Demand	Anodyne	CPT1A	81	35
C[C@@H](Sc1nnc(COc2ccccc2)n1C)C(=O)C1CCCCC1	ZINC000450885128	FI	On-Demand	Anodyne	VCP	79	49
N#Cc1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450885154	DF	On-Demand	Mild	PGR	0	40
N#Cc1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450885154	DF	On-Demand	Mild	NR3C2	26	41
N#Cc1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450885156	DF	On-Demand	Mild	PGR	0	40
N#Cc1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450885156	DF	On-Demand	Mild	NR3C2	26	41
N#Cc1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450885158	DF	On-Demand	Mild	PGR	0	40
N#Cc1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450885158	DF	On-Demand	Mild	NR3C2	26	41
N#Cc1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450885160	DF	On-Demand	Mild	PGR	0	40
N#Cc1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1Cl	ZINC000450885160	DF	On-Demand	Mild	NR3C2	26	41
CCOC(=O)c1ccc(CN2CCC[C@H](OCc3ccccc3F)C2)nc1	ZINC000450885169	FH	On-Demand	Anodyne	SLC6A1	44	36
CCCCNc1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc(N)n1	ZINC000450885179	ED	On-Demand	Anodyne	HRH4	41	48
CCCCNc1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc(N)n1	ZINC000450885183	ED	On-Demand	Anodyne	HRH4	41	48
CCCCNc1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc(N)n1	ZINC000450885184	ED	On-Demand	Anodyne	HRH4	41	48
CCCCNc1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc(N)n1	ZINC000450885185	ED	On-Demand	Anodyne	HRH4	41	48
COC(=O)C1(CSc2nnc(-c3cccc(Cl)c3)n2C)CCCC1	ZINC000450885195	FH	On-Demand	Anodyne	HSD11B1	24	47
CCCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450885204	FH	On-Demand	Anodyne	CCR2	65	40
CCCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450885204	FH	On-Demand	Anodyne	PDS	41	32
C=CCOc1ccc(-c2nnc(SCc3c(C)nnn3CC)o2)cc1	ZINC000450885217	FH	On-Demand	Mild	TYMS	26	42
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)CC2(CCOCC2)O1	ZINC000450885231	GH	On-Demand	Anodyne	CYP2J2	50	35
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)CC2(CCOCC2)O1	ZINC000450885232	GH	On-Demand	Anodyne	CYP2J2	50	35
Cc1nn(CC2(C#N)CCC2)c2ccc([N+](=O)[O-])cc12	ZINC000450885248	CF	On-Demand	Mild	F2RL3	47	33
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450885262	DI	On-Demand	Anodyne	UTS2R	19	41
COc1cc(CN2CC[C@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450885263	DI	On-Demand	Anodyne	UTS2R	19	41
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@H]2C)ccc1Cl	ZINC000450885264	DI	On-Demand	Anodyne	UTS2R	19	41
COc1cc(CN2CC[C@H](C(F)(F)F)[C@@H]2C)ccc1Cl	ZINC000450885265	DI	On-Demand	Anodyne	UTS2R	19	41
Cc1cc(NC[C@H](CO)Cc2cccc(Br)c2C)n2ncnc2n1	ZINC000450885323	GF	On-Demand	Anodyne	DHOD	0	44
Cc1cc(NC[C@@H](CO)Cc2cccc(Br)c2C)n2ncnc2n1	ZINC000450885324	GF	On-Demand	Anodyne	DHOD	0	44
COc1cc(Cn2nnc3sc(C)c(C)c3c2=O)ccc1Cl	ZINC000450885325	EG	On-Demand	Anodyne	NPBWR1	27	41
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450885360	FG	On-Demand	Bother	SERPINE1	15	43
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450885360	FG	On-Demand	Bother	LIPG	61	41
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450885361	FG	On-Demand	Bother	SERPINE1	15	43
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450885361	FG	On-Demand	Bother	LIPG	61	41
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450885362	FG	On-Demand	Bother	SERPINE1	15	43
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450885362	FG	On-Demand	Bother	LIPG	61	41
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450885363	FG	On-Demand	Bother	SERPINE1	15	43
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450885363	FG	On-Demand	Bother	LIPG	61	41
FC(F)(F)c1cccc(C2CN(c3ccnc(N4CCOCC4)n3)C2)c1	ZINC000450885373	FF	On-Demand	Anodyne	SMG1	37	46
CCc1nc(C)c(Cn2nc(C)c3cc([N+](=O)[O-])ccc32)o1	ZINC000450885384	DG	On-Demand	Bother	F2RL3	49	34
Fc1cccnc1OC1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450885413	DF	On-Demand	Anodyne	SCN5A	42	38
COC(=O)CC1(NCc2ccc(Cl)c(OC)c2)CCCC1	ZINC000450885415	DG	On-Demand	Anodyne	PDE6A	41	31
Fc1cccnc1OC1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450885416	DF	On-Demand	Anodyne	SCN5A	42	38
COc1ccc(CNC(=O)CCN(C)Cc2ccnn2C)c(OC)c1	ZINC000450885417	ED	On-Demand	Anodyne	PDGFRB	33	43
CCc1cc(CCCN2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)on1	ZINC000450885432	EG	On-Demand	Anodyne	SIGMAR1	22	41
O=C(CC[C@@H]1CCCCO1)Cn1nnnc1/C=C\c1ccccc1	ZINC000450885437	EF	On-Demand	Anodyne	PDE8B	41	38
O=C(CC[C@H]1CCCCO1)Cn1nnnc1/C=C\c1ccccc1	ZINC000450885439	EF	On-Demand	Anodyne	PDE8B	41	38
CN(CCCC(=O)c1ccccc1)Cc1ccnn1C	ZINC000450885444	CF	On-Demand	Anodyne	CES1	43	34
CN(CCCC(=O)c1ccccc1)Cc1ccnn1C	ZINC000450885444	CF	On-Demand	Anodyne	CYP2J2	48	34
CCc1nnc2ccc(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450885464	EG	On-Demand	Anodyne	LRRK2	0	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	FKBP1A	34	48
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	ELANE	60	38
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	MMP13	45	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	ITGA4	51	52
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	CAPNS1	26	52
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	MMP3	50	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	MMP8	27	41
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	LGMN	45	34
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	CAPN1	22	57
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	MMP7	61	42
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	MMP1	49	45
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	XIAP	63	39
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	SFRP1	135	40
CC[C@@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885466	GF	On-Demand	Anodyne	WNT3	96	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	FKBP1A	34	48
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	ELANE	60	38
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	MMP13	45	42
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	ITGA4	51	52
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	CAPNS1	26	52
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	MMP3	50	42
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	MMP8	27	41
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	LGMN	45	34
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	CAPN1	22	57
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	MMP7	61	42
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	MMP1	49	45
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	XIAP	63	39
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	SFRP1	135	40
CC[C@H](CC(F)(F)F)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450885467	GF	On-Demand	Anodyne	WNT3	96	40
CC[C@H](CC(C)C)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885472	FH	On-Demand	Anodyne	FAAH	22	40
CC[C@H](CC(C)C)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885472	FH	On-Demand	Anodyne	SCD	27	40
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885473	FH	On-Demand	Anodyne	FAAH	22	40
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885473	FH	On-Demand	Anodyne	SCD	27	40
COCc1cc(NCCC[C@@H]2CCOC2)n2ncnc2n1	ZINC000450885475	CD	On-Demand	Anodyne	DHOD	0	41
CC[C@@H](CC(C)C)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885476	FH	On-Demand	Anodyne	FAAH	22	40
CC[C@@H](CC(C)C)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885476	FH	On-Demand	Anodyne	SCD	27	40
COCc1cc(NCCC[C@H]2CCOC2)n2ncnc2n1	ZINC000450885477	CD	On-Demand	Anodyne	DHOD	0	41
CC[C@@H](CC(C)C)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885478	FH	On-Demand	Anodyne	FAAH	22	40
CC[C@@H](CC(C)C)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885478	FH	On-Demand	Anodyne	SCD	27	40
CC1=CCN(CCNC(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450885492	EG	On-Demand	Anodyne	DRD4	41	32
COc1cc(-c2noc(CN3CCC(Oc4ncccc4F)CC3)n2)ncn1	ZINC000450885509	GE	On-Demand	Anodyne	DCK	40	33
COc1cc(-c2noc(CN3CCC(Oc4ncccc4F)CC3)n2)ncn1	ZINC000450885509	GE	On-Demand	Anodyne	SCN5A	76	39
CCC(=O)c1ccc(OC[C@H]2CCCC2(F)F)c(F)c1	ZINC000450885534	CI	On-Demand	Anodyne	THRA	0	42
CCC(=O)c1ccc(OC[C@@H]2CCCC2(F)F)c(F)c1	ZINC000450885540	CI	On-Demand	Anodyne	THRA	0	42
O[C@H]([C@@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885541	DE	On-Demand	Anodyne	SIRT3	54	35
O[C@H]([C@@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885541	DE	On-Demand	Anodyne	SIRT2	54	35
O[C@H]([C@@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885541	DE	On-Demand	Anodyne	SIRT1	54	35
O[C@H]([C@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885543	DE	On-Demand	Anodyne	SIRT3	54	35
O[C@H]([C@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885543	DE	On-Demand	Anodyne	SIRT2	54	35
O[C@H]([C@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885543	DE	On-Demand	Anodyne	SIRT1	54	35
O[C@@H]([C@@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885544	DE	On-Demand	Anodyne	SIRT3	54	35
O[C@@H]([C@@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885544	DE	On-Demand	Anodyne	SIRT2	54	35
O[C@@H]([C@@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885544	DE	On-Demand	Anodyne	SIRT1	54	35
O[C@@H]([C@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885547	DE	On-Demand	Anodyne	SIRT3	54	35
O[C@@H]([C@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885547	DE	On-Demand	Anodyne	SIRT2	54	35
O[C@@H]([C@H]1CCN(c2ncnc3ccsc23)C1)C(F)(F)F	ZINC000450885547	DE	On-Demand	Anodyne	SIRT1	54	35
CC(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885571	CE	On-Demand	Anodyne	MCHR1	0	42
CC(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885573	CE	On-Demand	Anodyne	MCHR1	0	42
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC2(CCOCC2)O1	ZINC000450885618	EG	On-Demand	Anodyne	DRD2	31	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC2(CCOCC2)O1	ZINC000450885618	EG	On-Demand	Anodyne	DRD4	0	48
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC2(CCOCC2)O1	ZINC000450885618	EG	On-Demand	Anodyne	SLC18A3	0	48
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC2(CCOCC2)O1	ZINC000450885618	EG	On-Demand	Anodyne	CYP2J2	50	35
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC2(CCOCC2)O1	ZINC000450885619	EG	On-Demand	Anodyne	DRD2	31	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC2(CCOCC2)O1	ZINC000450885619	EG	On-Demand	Anodyne	DRD4	0	48
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC2(CCOCC2)O1	ZINC000450885619	EG	On-Demand	Anodyne	SLC18A3	0	48
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC2(CCOCC2)O1	ZINC000450885619	EG	On-Demand	Anodyne	CYP2J2	50	35
Fc1cc(F)cc(CC2CCN(c3ccnc(N4CCOCC4)n3)CC2)c1	ZINC000450885635	FG	On-Demand	Anodyne	SMG1	43	34
O=C(NCCO)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450885643	GD	On-Demand	Anodyne	CCR3	46	42
O=C(NCCO)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450885643	GD	On-Demand	Anodyne	SCD1	78	54
O=C(NCCO)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nn1	ZINC000450885643	GD	On-Demand	Anodyne	SCD	64	52
c1nc(NCCC[C@@H]2CCOC2)c2ncn(C3CC3)c2n1	ZINC000450885685	CE	On-Demand	Anodyne	ADORA1	29	42
c1nc(NCCC[C@@H]2CCOC2)c2ncn(C3CC3)c2n1	ZINC000450885685	CE	On-Demand	Anodyne	ADORA2A	0	44
c1nc(NCCC[C@@H]2CCOC2)c2ncn(C3CC3)c2n1	ZINC000450885685	CE	On-Demand	Anodyne	Q4VQ11_PIG	44	44
c1nc(NCCC[C@H]2CCOC2)c2ncn(C3CC3)c2n1	ZINC000450885686	CE	On-Demand	Anodyne	ADORA1	29	42
c1nc(NCCC[C@H]2CCOC2)c2ncn(C3CC3)c2n1	ZINC000450885686	CE	On-Demand	Anodyne	ADORA2A	0	44
c1nc(NCCC[C@H]2CCOC2)c2ncn(C3CC3)c2n1	ZINC000450885686	CE	On-Demand	Anodyne	Q4VQ11_PIG	44	44
CCCc1nc(C)c(Cn2nc(C)c3cc([N+](=O)[O-])ccc32)o1	ZINC000450885721	DH	On-Demand	Bother	F2RL3	51	36
COC(=O)CNC(=O)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450885722	FD	On-Demand	Bother	TAAR1	17	42
COC(=O)CNC(=O)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450885723	FD	On-Demand	Bother	TAAR1	17	42
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450885746	GE	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450885747	GE	On-Demand	Bother	TAAR1	20	44
COC(=O)[C@H](C)NC(=O)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450885748	GE	On-Demand	Bother	TAAR1	20	44
CC(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450885749	CE	On-Demand	Anodyne	MCHR1	0	42
CC(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450885750	CE	On-Demand	Anodyne	MCHR1	0	42
O=C(NCCO)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nn1	ZINC000450885751	FD	On-Demand	Anodyne	SCD1	55	47
O=[N+]([O-])c1ccn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n1	ZINC000450885763	GG	On-Demand	Bother	DRD4	22	41
O=[N+]([O-])c1ccn(C2CCN(Cc3ccn(CCc4ccccc4)n3)CC2)n1	ZINC000450885763	GG	On-Demand	Bother	SIGMAR1	23	40
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	COLA	56	37
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	CPT1A	54	37
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	CPT2	45	37
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	GUAB	0	40
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	JAK1	0	42
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	GRM4	35	45
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	TYK2	50	37
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	ENPP1	70	35
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	KCNK3	73	44
COc1ccc(NC(=O)c2c(C)cccc2Cl)cc1OC(C)C	ZINC000450885795	EJ	On-Demand	Anodyne	KCNK9	68	41
Cc1nc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c2cc[nH]c2n1	ZINC000450885800	DE	On-Demand	Anodyne	JAK1	41	38
Cc1nc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c2cc[nH]c2n1	ZINC000450885801	DE	On-Demand	Anodyne	JAK1	41	38
Cc1nc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c2cc[nH]c2n1	ZINC000450885802	DE	On-Demand	Anodyne	JAK1	41	38
Cc1nc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c2cc[nH]c2n1	ZINC000450885803	DE	On-Demand	Anodyne	JAK1	41	38
CCC[C@H](O)CN1CCC(c2ccnn2CC)CC1	ZINC000450885817	CE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@@H](O)CN1CCC(c2ccnn2CC)CC1	ZINC000450885819	CE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
COc1ccc(-c2ccnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)n2)cc1	ZINC000450885822	FF	On-Demand	Anodyne	SORD	25	43
COc1ccc(-c2ccnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)n2)cc1	ZINC000450885822	FF	On-Demand	Anodyne	DKK1	0	43
COc1ccc(-c2ccnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)n2)cc1	ZINC000450885823	FF	On-Demand	Anodyne	SORD	25	43
COc1ccc(-c2ccnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)n2)cc1	ZINC000450885823	FF	On-Demand	Anodyne	DKK1	0	43
COc1ccc(-c2ccnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)n2)cc1	ZINC000450885824	FF	On-Demand	Anodyne	SORD	25	43
COc1ccc(-c2ccnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)n2)cc1	ZINC000450885824	FF	On-Demand	Anodyne	DKK1	0	43
COc1ccc(-c2ccnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)n2)cc1	ZINC000450885825	FF	On-Demand	Anodyne	SORD	25	43
COc1ccc(-c2ccnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)n2)cc1	ZINC000450885825	FF	On-Demand	Anodyne	DKK1	0	43
COc1cc(CN2CC[C@H](CO)[C@@H]2C)ccc1Cl	ZINC000450885836	CF	On-Demand	Anodyne	DRD2	15	42
COc1cc(CN2CC[C@@H](CO)[C@@H]2C)ccc1Cl	ZINC000450885837	CF	On-Demand	Anodyne	DRD2	15	42
COc1cc(CN2CC[C@@H](CO)[C@H]2C)ccc1Cl	ZINC000450885838	CF	On-Demand	Anodyne	DRD2	15	42
COc1cc(CN2CC[C@H](CO)[C@H]2C)ccc1Cl	ZINC000450885839	CF	On-Demand	Anodyne	DRD2	15	42
CCCc1nnc(SCc2cccc(S(C)(=O)=O)c2)o1	ZINC000450885862	DF	On-Demand	Anodyne	PTK2	22	40
CN(C)c1ncccc1O[C@H]1CCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450885873	GH	On-Demand	Anodyne	HCRTR2	40	39
CN(C)c1ncccc1O[C@H]1CCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450885873	GH	On-Demand	Anodyne	SCD	20	40
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450885874	GH	On-Demand	Anodyne	HCRTR2	40	39
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450885874	GH	On-Demand	Anodyne	SCD	20	40
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450885875	GF	On-Demand	Anodyne	SCD	30	44
CC(=O)[C@](C)(O)CN1CCC[C@H](OCc2ccccc2F)C1	ZINC000450885876	DE	On-Demand	Anodyne	SLC6A1	44	36
CC(=O)[C@@](C)(O)CN1CCC[C@H](OCc2ccccc2F)C1	ZINC000450885877	DE	On-Demand	Anodyne	SLC6A1	44	36
CCC(CC)(CCSc1nnc(-c2ccccn2)n1C)C(=O)OC	ZINC000450885879	EG	On-Demand	Anodyne	KCNH2	0	40
CC(C)c1nccc(N2CCC[C@]3(CCOC3)C2)n1	ZINC000450885881	CF	On-Demand	Anodyne	SORD	43	34
CC(C)c1nccc(N2CCC[C@@]3(CCOC3)C2)n1	ZINC000450885882	CF	On-Demand	Anodyne	SORD	43	34
CC1(CO)CCN(C(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450885924	EF	On-Demand	Anodyne	SLC12A5	43	34
COC(=O)[C@H](C)NC(=O)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450885949	GE	On-Demand	Bother	TAAR1	20	44
C[C@H]1[C@H](C(F)(F)F)CCN1C[C@H](O)Cc1ccccc1	ZINC000450885964	CF	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H]1[C@@H](C(F)(F)F)CCN1C[C@H](O)Cc1ccccc1	ZINC000450885965	CF	On-Demand	Anodyne	VACHT_TETCF	0	42
COc1ccc(CNC(=O)CCN2CCC[C@](C)(O)CC2)c(OC)c1	ZINC000450885979	FD	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC[C@](C)(O)CC2)c(OC)c1	ZINC000450885979	FD	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CCC[C@](C)(O)CC2)c(OC)c1	ZINC000450885979	FD	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc(CNC(=O)CCN2CCC[C@](C)(O)CC2)c(OC)c1	ZINC000450885979	FD	On-Demand	Anodyne	MTNR1B	27	40
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(O)CC2)c(OC)c1	ZINC000450885980	FD	On-Demand	Anodyne	DRD4	40	31
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(O)CC2)c(OC)c1	ZINC000450885980	FD	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(O)CC2)c(OC)c1	ZINC000450885980	FD	On-Demand	Anodyne	MTNR1A	42	36
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(O)CC2)c(OC)c1	ZINC000450885980	FD	On-Demand	Anodyne	MTNR1B	27	40
O=C1CC[C@H](CN2C[C@@H](O)C[C@@H]2c2ccccc2C(F)(F)F)CCN1	ZINC000450886038	FF	On-Demand	Anodyne	RBP4	47	34
O=C1CC[C@H](CN2C[C@H](O)C[C@@H]2c2ccccc2C(F)(F)F)CCN1	ZINC000450886039	FF	On-Demand	Anodyne	RBP4	47	34
O=C1CC[C@H](CN2C[C@@H](O)C[C@H]2c2ccccc2C(F)(F)F)CCN1	ZINC000450886040	FF	On-Demand	Anodyne	RBP4	47	34
O=C1CC[C@H](CN2C[C@H](O)C[C@H]2c2ccccc2C(F)(F)F)CCN1	ZINC000450886041	FF	On-Demand	Anodyne	RBP4	47	34
CO[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450886049	GF	On-Demand	Anodyne	SCD	30	44
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450886050	GF	On-Demand	Anodyne	SCD	30	44
CO[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450886051	GF	On-Demand	Anodyne	SCD	30	44
C[C@H]1CN(C2CCOCC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450886082	EF	On-Demand	Anodyne	DRD4	0	46
C[C@H]1CN(C2CCOCC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450886082	EF	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1CN(C2CCOCC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450886082	EF	On-Demand	Anodyne	CYP2J2	54	39
C[C@@H]1CN(C2CCOCC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450886083	EF	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1CN(C2CCOCC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450886083	EF	On-Demand	Anodyne	HTR3B	0	43
C[C@@H]1CN(C2CCOCC2)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450886083	EF	On-Demand	Anodyne	CYP2J2	54	39
CC(F)(F)CCSc1ncnc2c1cnn2Cc1ccccc1	ZINC000450886149	EI	On-Demand	Anodyne	ABL1	26	42
COc1cccc(OCCC(=O)NCCN2CC=C(C)CC2)c1	ZINC000450886150	DE	On-Demand	Anodyne	DRD4	55	43
COc1cccc(OCCC(=O)NCCN2CC=C(C)CC2)c1	ZINC000450886150	DE	On-Demand	Anodyne	HRH2	40	40
COc1cccc(OCCC(=O)NCCN2CC=C(C)CC2)c1	ZINC000450886150	DE	On-Demand	Anodyne	MTNR1A	56	39
COc1cccc(OCCC(=O)NCCN2CC=C(C)CC2)c1	ZINC000450886150	DE	On-Demand	Anodyne	MTNR1B	51	39
C=CCOc1ccc(-c2nnc(SCc3oc(CCC)nc3C)o2)cc1	ZINC000450886151	FJ	On-Demand	Mild	TYMS	0	41
C=CCOc1ccc(-c2nnc(SCc3oc(CCC)nc3C)o2)cc1	ZINC000450886151	FJ	On-Demand	Mild	GSK3B	0	46
C=CCOc1ccc(-c2nnc(SCc3oc(CCC)nc3C)o2)cc1	ZINC000450886151	FJ	On-Demand	Mild	GSK3A	39	40
Cc1nccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)n1	ZINC000450886166	DH	On-Demand	Anodyne	SORD	43	40
CC(C)(C)CC(C)(C)N1CCN(c2nccc(CO)n2)CC1	ZINC000450886179	DE	On-Demand	Anodyne	SORD	45	36
CCOC(=O)c1ccc(CN2CCC(c3ccnn3CC)CC2)nc1	ZINC000450886187	EF	On-Demand	Anodyne	SSTR5	45	36
COc1ccc(-c2csc3ncnc(N4CCC[C@]5(CCOC5)C4)c23)cc1	ZINC000450886200	GI	On-Demand	Anodyne	ADRB3	0	41
COc1ccc(-c2csc3ncnc(N4CCC[C@@]5(CCOC5)C4)c23)cc1	ZINC000450886201	GI	On-Demand	Anodyne	ADRB3	0	41
c1ccc(-c2csc3ncnc(N4CCC[C@]5(CCOC5)C4)c23)cc1	ZINC000450886212	FI	On-Demand	Anodyne	ADRB3	29	43
c1ccc(-c2csc3ncnc(N4CCC[C@@]5(CCOC5)C4)c23)cc1	ZINC000450886213	FI	On-Demand	Anodyne	ADRB3	29	43
CN(CCN1C[C@H](O)C(C)(C)C1)Cc1ccccc1	ZINC000450886218	CD	On-Demand	Anodyne	SIGMAR1	27	43
CN(CCN1C[C@@H](O)C(C)(C)C1)Cc1ccccc1	ZINC000450886219	CD	On-Demand	Anodyne	SIGMAR1	27	43
COc1cccc2c(N3CCC[C@]4(CCOC4)C3)cc(C)nc12	ZINC000450886235	DH	On-Demand	Anodyne	BDKRB2	53	31
COc1cccc2c(N3CCC[C@@]4(CCOC4)C3)cc(C)nc12	ZINC000450886236	DH	On-Demand	Anodyne	BDKRB2	53	31
C=C(C)CN(Cc1ccccc1)Cc1cn(CC2CC2)nn1	ZINC000450886328	CG	On-Demand	Mild	HSP90AB1	17	42
c1ccc2c(c1)[nH]c1ncnc(NCCC[C@@H]3CCOC3)c12	ZINC000450886329	CG	On-Demand	Anodyne	UTS2R	22	43
c1ccc2c(c1)[nH]c1ncnc(NCCC[C@H]3CCOC3)c12	ZINC000450886330	CG	On-Demand	Anodyne	UTS2R	22	43
CCOC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)nc1	ZINC000450886343	FF	On-Demand	Anodyne	CACNA1C	51	36
CCOC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)nc1	ZINC000450886343	FF	On-Demand	Anodyne	P2RY12	32	43
CCOC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)nc1	ZINC000450886343	FF	On-Demand	Anodyne	SSTR5	40	37
CCOC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)nc1	ZINC000450886343	FF	On-Demand	Anodyne	NOD2	40	43
O[C@@H]([C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1)C(F)(F)F	ZINC000450886356	FI	On-Demand	Anodyne	LIPG	48	32
O[C@@H]([C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1)C(F)(F)F	ZINC000450886357	FI	On-Demand	Anodyne	LIPG	48	32
O[C@H]([C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1)C(F)(F)F	ZINC000450886358	FI	On-Demand	Anodyne	LIPG	48	32
O[C@H]([C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1)C(F)(F)F	ZINC000450886359	FI	On-Demand	Anodyne	LIPG	48	32
C=C[C@@H]1CCCCN1C[C@H](O)Cc1ccccc1	ZINC000450886365	BF	On-Demand	Mild	VACHT_TETCF	0	42
C=C[C@H]1CCCCN1C[C@H](O)Cc1ccccc1	ZINC000450886366	BF	On-Demand	Mild	VACHT_TETCF	0	42
C[C@H]1CN(C2CCOCC2)CCN1CCc1ccc(Cl)cc1	ZINC000450886367	DG	On-Demand	Anodyne	HRH3	22	45
C[C@@H]1CN(C2CCOCC2)CCN1CCc1ccc(Cl)cc1	ZINC000450886368	DG	On-Demand	Anodyne	HRH3	22	45
FC(F)(F)c1cccc(C2CN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450886378	DH	On-Demand	Anodyne	AKT2	43	47
FC(F)(F)c1cccc(C2CN(c3ncnc4[nH]ccc34)C2)c1	ZINC000450886378	DH	On-Demand	Anodyne	AKT1	31	43
COC(=O)c1cccc(CN2CCC(Oc3ncccc3F)CC2)c1Cl	ZINC000450886379	GH	On-Demand	Anodyne	HRH1	17	41
COC(=O)c1cccc(CN2CCC(Oc3ncccc3F)CC2)c1Cl	ZINC000450886379	GH	On-Demand	Anodyne	CCR3	29	41
COC(=O)c1cccc(CN2CCC(Oc3ncccc3F)CC2)c1Cl	ZINC000450886379	GH	On-Demand	Anodyne	SCN9A	0	40
COC(=O)c1cccc(CN2CCC(Oc3ncccc3F)CC2)c1Cl	ZINC000450886379	GH	On-Demand	Anodyne	SCN5A	82	40
COc1ccc2c(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)ncnc2c1F	ZINC000450886381	EF	On-Demand	Anodyne	PDE3A	51	40
COc1ccc2c(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)ncnc2c1F	ZINC000450886382	EF	On-Demand	Anodyne	PDE3A	51	40
COc1ccc2c(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)ncnc2c1F	ZINC000450886383	EF	On-Demand	Anodyne	PDE3A	51	40
COc1ccc2c(N3CC[C@H]([C@H](O)C(F)(F)F)C3)ncnc2c1F	ZINC000450886384	EF	On-Demand	Anodyne	PDE3A	51	40
CCC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)c(F)c1	ZINC000450886385	DI	On-Demand	Anodyne	THRA	0	41
Cc1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c2cc(F)ccc2n1	ZINC000450886391	EG	On-Demand	Anodyne	DHODH	50	37
Cc1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c2cc(F)ccc2n1	ZINC000450886392	EG	On-Demand	Anodyne	DHODH	50	37
Cc1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c2cc(F)ccc2n1	ZINC000450886393	EG	On-Demand	Anodyne	DHODH	50	37
Cc1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c2cc(F)ccc2n1	ZINC000450886394	EG	On-Demand	Anodyne	DHODH	50	37
O=C(c1cccnc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1)N1CCCCC1	ZINC000450886401	FE	On-Demand	Anodyne	L3MBTL3	46	38
O=C(c1cccnc1N1CC[C@H]([C@H](O)C(F)(F)F)C1)N1CCCCC1	ZINC000450886402	FE	On-Demand	Anodyne	L3MBTL3	46	38
O=C(c1cccnc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1)N1CCCCC1	ZINC000450886403	FE	On-Demand	Anodyne	L3MBTL3	46	38
O=C(c1cccnc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1)N1CCCCC1	ZINC000450886404	FE	On-Demand	Anodyne	L3MBTL3	46	38
CNS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450886444	FD	On-Demand	Anodyne	SLC6A9	0	41
CNS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450886445	FD	On-Demand	Anodyne	SLC6A9	0	41
CNS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450886446	FD	On-Demand	Anodyne	SLC6A9	0	41
CNS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(F)c1	ZINC000450886447	FD	On-Demand	Anodyne	SLC6A9	0	41
CC(C)C[C@@H](C)Sc1nnc(COc2ccccc2)n1C	ZINC000450886450	DH	On-Demand	Anodyne	VCP	49	41
CC(C)C[C@H](C)Sc1nnc(COc2ccccc2)n1C	ZINC000450886451	DH	On-Demand	Anodyne	VCP	49	41
COc1cccc(OCCC(=O)N2CCC(C)(CO)CC2)c1	ZINC000450886452	DE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CCC(C)(CO)CC2)c1	ZINC000450886452	DE	On-Demand	Anodyne	MTNR1A	25	44
Cc1cccc(CN2CCO[C@@H](CN(C)CC(=O)OC(C)(C)C)C2)n1	ZINC000450886463	ED	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CN2CCO[C@H](CN(C)CC(=O)OC(C)(C)C)C2)n1	ZINC000450886464	ED	On-Demand	Anodyne	PDE8B	45	36
CC(=O)CCCCCSc1nnc(COc2ccccc2)n1C	ZINC000450886495	EH	On-Demand	Anodyne	VCP	47	37
c1ccc(-c2cncnc2N2CCC[C@@]3(CCOC3)C2)cc1	ZINC000450886510	CG	On-Demand	Anodyne	SLC9A1	0	43
c1ccc(-c2cncnc2N2CCC[C@]3(CCOC3)C2)cc1	ZINC000450886511	CG	On-Demand	Anodyne	SLC9A1	0	43
CCC(=O)CCCN1CCC[C@H](OCc2ccccc2F)C1	ZINC000450886512	DH	On-Demand	Anodyne	SLC6A1	156	43
CCC(=O)CCCN1CCC[C@H](OCc2ccccc2F)C1	ZINC000450886512	DH	On-Demand	Anodyne	BIRC2	25	41
N#Cc1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450886521	DH	On-Demand	Mild	SMO	0	47
COCCN(Cc1cncs1)C[C@H](Cc1ccccc1)OC	ZINC000450886538	DF	On-Demand	Anodyne	CYP3A4	40	41
COCCN(Cc1cncs1)C[C@@H](Cc1ccccc1)OC	ZINC000450886539	DF	On-Demand	Anodyne	CYP3A4	40	41
CN(CCCC(=O)c1ccc(Br)cc1)Cc1ccnn1C	ZINC000450886552	FG	On-Demand	Anodyne	HDAC8	17	40
CC(=O)c1cccc(Cn2cnc3c(cnn3C(C)C)c2=O)c1	ZINC000450886565	DE	On-Demand	Anodyne	SCD1	16	42
CCN(CC)S(=O)(=O)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450886573	GF	On-Demand	Bother	BDKRB1	23	44
CCN(CC)S(=O)(=O)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450886574	GF	On-Demand	Bother	BDKRB1	23	44
CCS(=O)(=O)c1ccc(CN2CCC[C@](C)(O)CC2)cc1	ZINC000450886577	DE	On-Demand	Anodyne	ADAM17	23	42
CCS(=O)(=O)c1ccc(CN2CCC[C@@](C)(O)CC2)cc1	ZINC000450886578	DE	On-Demand	Anodyne	ADAM17	23	42
CCS(=O)(=O)c1ccc(CN(C)Cc2ccccc2SC)cc1	ZINC000450886589	EH	On-Demand	Anodyne	RORC	32	40
COC(=O)c1nc([C@@H]2CCCN2Cc2nc(-c3cc(C)ccn3)no2)sc1C	ZINC000450886617	GG	On-Demand	Anodyne	COLA	29	41
COC(=O)c1nc([C@@H]2CCCN2Cc2nc(-c3cc(C)ccn3)no2)sc1C	ZINC000450886617	GG	On-Demand	Anodyne	CPT1A	29	41
COC(=O)c1nc([C@H]2CCCN2Cc2nc(-c3cc(C)ccn3)no2)sc1C	ZINC000450886618	GG	On-Demand	Anodyne	COLA	29	41
COC(=O)c1nc([C@H]2CCCN2Cc2nc(-c3cc(C)ccn3)no2)sc1C	ZINC000450886618	GG	On-Demand	Anodyne	CPT1A	29	41
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450886637	EI	On-Demand	Anodyne	RBP4	48	34
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450886638	EI	On-Demand	Anodyne	RBP4	48	34
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(C[C@H]2CCC(F)(F)C2)C1	ZINC000450886639	EI	On-Demand	Anodyne	RBP4	48	34
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(C[C@H]2CCC(F)(F)C2)C1	ZINC000450886640	EI	On-Demand	Anodyne	RBP4	48	34
COc1ccc(-c2noc(CN3CCC(Oc4ncccc4F)CC3)n2)nn1	ZINC000450886668	GE	On-Demand	Anodyne	SCN5A	50	37
Fc1cccnc1OC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450886673	FG	On-Demand	Anodyne	SCN9A	22	44
Fc1cccnc1OC1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450886673	FG	On-Demand	Anodyne	SCN5A	89	44
CC[C@H](CC(F)(F)F)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450886674	FI	On-Demand	Bother	PPXII	0	40
CC[C@@H](CC(F)(F)F)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450886675	FI	On-Demand	Bother	PPXII	0	40
Fc1cccnc1OC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450886693	GH	On-Demand	Anodyne	SCN9A	24	49
Fc1cccnc1OC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450886693	GH	On-Demand	Anodyne	SCN5A	96	49
COC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1Cl	ZINC000450886712	GH	On-Demand	Anodyne	HRH1	33	40
COC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1Cl	ZINC000450886712	GH	On-Demand	Anodyne	SIGMAR1	30	41
COC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1Cl	ZINC000450886712	GH	On-Demand	Anodyne	SSTR5	79	38
COC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1Cl	ZINC000450886712	GH	On-Demand	Anodyne	CCR3	72	40
COC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1Cl	ZINC000450886712	GH	On-Demand	Anodyne	SCN9A	0	41
COC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1Cl	ZINC000450886712	GH	On-Demand	Anodyne	MLNR	44	37
COC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1Cl	ZINC000450886712	GH	On-Demand	Anodyne	SCN5A	75	41
COC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1Cl	ZINC000450886712	GH	On-Demand	Anodyne	MCHR1	46	42
Fc1cccnc1OC1CCN(C[C@@H]2COCCO2)CC1	ZINC000450886731	CD	On-Demand	Anodyne	SCN5A	42	39
Fc1cccnc1OC1CCN(C[C@H]2COCCO2)CC1	ZINC000450886732	CD	On-Demand	Anodyne	SCN5A	42	39
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nn1	ZINC000450886737	FE	On-Demand	Anodyne	SCD1	81	54
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nn1	ZINC000450886737	FE	On-Demand	Anodyne	SCD	59	54
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nn1	ZINC000450886738	FE	On-Demand	Anodyne	SCD1	81	54
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nn1	ZINC000450886738	FE	On-Demand	Anodyne	SCD	59	54
O=C(Nc1ccccc1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nn1	ZINC000450886739	FE	On-Demand	Anodyne	SCD1	81	54
O=C(Nc1ccccc1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nn1	ZINC000450886739	FE	On-Demand	Anodyne	SCD	59	54
O=C(Nc1ccccc1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nn1	ZINC000450886740	FE	On-Demand	Anodyne	SCD1	81	54
O=C(Nc1ccccc1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nn1	ZINC000450886740	FE	On-Demand	Anodyne	SCD	59	54
N#Cc1cnc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450886747	DE	On-Demand	Mild	CXCR3	17	44
N#Cc1cnc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450886748	DE	On-Demand	Mild	CXCR3	17	44
COC(=O)[C@H]1CNC(=O)CN1CCc1ccc(Cl)cc1	ZINC000450886776	CC	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CNC(=O)CN1CCc1ccc(Cl)cc1	ZINC000450886776	CC	On-Demand	Anodyne	CMA1	41	38
COC(=O)[C@@H]1CNC(=O)CN1CCc1ccc(Cl)cc1	ZINC000450886777	CC	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@@H]1CNC(=O)CN1CCc1ccc(Cl)cc1	ZINC000450886777	CC	On-Demand	Anodyne	CMA1	41	38
C=CCOc1ccc(-c2nnc(SCc3oc(CC)nc3C)o2)cc1	ZINC000450886794	FI	On-Demand	Mild	GSK3B	15	47
C=CCOc1ccc(-c2nnc(SCc3oc(CC)nc3C)o2)cc1	ZINC000450886794	FI	On-Demand	Mild	GSK3A	37	42
COC(=O)[C@@H]1CNC(=O)CN1C[C@H](Cc1ccccc1)OC	ZINC000450886815	DC	On-Demand	Anodyne	MME	46	33
COC(=O)[C@@H]1CNC(=O)CN1C[C@@H](Cc1ccccc1)OC	ZINC000450886816	DC	On-Demand	Anodyne	MME	46	33
COC(=O)[C@H]1CNC(=O)CN1C[C@H](Cc1ccccc1)OC	ZINC000450886817	DC	On-Demand	Anodyne	MME	46	33
COC(=O)[C@H]1CNC(=O)CN1C[C@@H](Cc1ccccc1)OC	ZINC000450886818	DC	On-Demand	Anodyne	MME	46	33
CC1(c2ccc(Cl)cc2)CCN(Cc2cccnc2N)CC1	ZINC000450886820	DH	On-Demand	Anodyne	DRD4	19	41
CC1(c2ccc(Cl)cc2)CCN(Cc2cccnc2N)CC1	ZINC000450886820	DH	On-Demand	Anodyne	DRD3	0	54
CC(C)(C)CC(C)(C)N1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC1	ZINC000450886839	FG	On-Demand	Bother	MDAA	0	43
CC(C)n1ncc2c(=O)n(CCc3ccc(Cl)cc3)cnc21	ZINC000450886858	DG	On-Demand	Anodyne	Q9M629_MAIZE	55	33
COc1ccc(CNC(=O)CCn2cnc3c(cnn3C(C)C)c2=O)c(OC)c1	ZINC000450886877	GD	On-Demand	Anodyne	PDGFRB	40	43
COc1ccc(CNC(=O)CCn2cnc3c(cnn3C(C)C)c2=O)c(OC)c1	ZINC000450886877	GD	On-Demand	Anodyne	CSF1R	15	43
CCC(=O)CCCN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450886891	EG	On-Demand	Mild	HTR1A	15	43
CCC(=O)CCCN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450886891	EG	On-Demand	Mild	PTAFR	37	42
CCC(=O)CCCN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450886892	EG	On-Demand	Mild	HTR1A	15	43
CCC(=O)CCCN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450886892	EG	On-Demand	Mild	PTAFR	37	42
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886898	DF	On-Demand	Anodyne	DRD2	32	46
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886898	DF	On-Demand	Anodyne	DRD4	0	52
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886898	DF	On-Demand	Anodyne	SLC18A3	0	49
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886898	DF	On-Demand	Anodyne	CYP2J2	52	37
C[C@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886899	DF	On-Demand	Anodyne	DRD2	32	46
C[C@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886899	DF	On-Demand	Anodyne	DRD4	0	52
C[C@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886899	DF	On-Demand	Anodyne	SLC18A3	0	49
C[C@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886899	DF	On-Demand	Anodyne	CYP2J2	52	37
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886900	DF	On-Demand	Anodyne	DRD2	32	46
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886900	DF	On-Demand	Anodyne	DRD4	0	52
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886900	DF	On-Demand	Anodyne	SLC18A3	0	49
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886900	DF	On-Demand	Anodyne	CYP2J2	52	37
C[C@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886901	DF	On-Demand	Anodyne	DRD2	32	46
C[C@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886901	DF	On-Demand	Anodyne	DRD4	0	52
C[C@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886901	DF	On-Demand	Anodyne	SLC18A3	0	49
C[C@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(F)cc1)CCO2	ZINC000450886901	DF	On-Demand	Anodyne	CYP2J2	52	37
CO[C@H](COc1cc(F)ccc1C(C)=O)Cc1ccccc1	ZINC000450886935	DH	On-Demand	Anodyne	PDS	53	39
CO[C@@H](COc1cc(F)ccc1C(C)=O)Cc1ccccc1	ZINC000450886936	DH	On-Demand	Anodyne	PDS	53	39
C[C@H]1CC[C@@H](C(=O)N(CCNC(=O)[C@H]2CC[C@@H](C)O2)CCN2CCOCC2)O1	ZINC000450886946	GC	On-Demand	Anodyne	CASR	42	34
N#Cc1cnc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450886949	DE	On-Demand	Mild	CXCR3	17	44
N#Cc1cnc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1	ZINC000450886950	DE	On-Demand	Mild	CXCR3	17	44
CCCc1nnc(SCc2ccc(C)cc2Br)o1	ZINC000450886951	EI	On-Demand	Anodyne	PTK2	15	41
O=C(CC1CC(F)(F)C1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000450886958	FG	On-Demand	Anodyne	SCD	28	40
O=C(CC1CC(F)(F)C1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000450886959	FG	On-Demand	Anodyne	SCD	28	40
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1	ZINC000450886987	GG	On-Demand	Anodyne	SSTR5	58	42
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1	ZINC000450886987	GG	On-Demand	Anodyne	SCN9A	0	45
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1	ZINC000450886987	GG	On-Demand	Anodyne	SCN5A	84	45
CCS(=O)(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1	ZINC000450886987	GG	On-Demand	Anodyne	GPR119	41	37
Fc1cccnc1OC1CCN(CC2=CCCCC2)CC1	ZINC000450886993	CH	On-Demand	Anodyne	SCN5A	40	35
FC(F)c1nnc2ccc(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450886994	FH	On-Demand	Anodyne	LRRK2	0	41
CC[C@@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450886995	EH	On-Demand	Anodyne	TIMP3	72	34
CC[C@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450886996	EH	On-Demand	Anodyne	TIMP3	72	34
CC(C)c1noc(-c2ccnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2)n1	ZINC000450887000	FG	On-Demand	Anodyne	SORD	49	35
CC(C)c1noc(-c2ccnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2)n1	ZINC000450887001	FG	On-Demand	Anodyne	SORD	49	35
CC(C)c1noc(-c2ccnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2)n1	ZINC000450887002	FG	On-Demand	Anodyne	SORD	49	35
CC(C)c1noc(-c2ccnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2)n1	ZINC000450887003	FG	On-Demand	Anodyne	SORD	49	35
O[C@@H]([C@@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1)C(F)(F)F	ZINC000450887004	GI	On-Demand	Anodyne	ADRB2	18	55
O[C@@H]([C@@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1)C(F)(F)F	ZINC000450887004	GI	On-Demand	Anodyne	ADRB3	18	55
O[C@H]([C@@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1)C(F)(F)F	ZINC000450887005	GI	On-Demand	Anodyne	ADRB2	18	55
O[C@H]([C@@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1)C(F)(F)F	ZINC000450887005	GI	On-Demand	Anodyne	ADRB3	18	55
O[C@@H]([C@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1)C(F)(F)F	ZINC000450887006	GI	On-Demand	Anodyne	ADRB2	18	55
O[C@@H]([C@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1)C(F)(F)F	ZINC000450887006	GI	On-Demand	Anodyne	ADRB3	18	55
O[C@H]([C@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1)C(F)(F)F	ZINC000450887007	GI	On-Demand	Anodyne	ADRB2	18	55
O[C@H]([C@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1)C(F)(F)F	ZINC000450887007	GI	On-Demand	Anodyne	ADRB3	18	55
CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)CC)cc2)c(F)c1	ZINC000450887014	FH	On-Demand	Anodyne	THRA	0	41
CCS(=O)(=O)c1ccc(CN2CCN(C3CCOCC3)C[C@@H]2C)cc1	ZINC000450887035	FE	On-Demand	Anodyne	CHRM2	22	56
CCS(=O)(=O)c1ccc(CN2CCN(C3CCOCC3)C[C@H]2C)cc1	ZINC000450887036	FE	On-Demand	Anodyne	CHRM2	22	56
CC1=CCN(CCNC(=O)c2c(Cl)cc(Cl)cc2Cl)CC1	ZINC000450887060	EI	On-Demand	Anodyne	DRD4	47	36
CC1=CCN(CCNC(=O)c2c(Cl)cc(Cl)cc2Cl)CC1	ZINC000450887060	EI	On-Demand	Anodyne	CACNA1I	46	33
C[C@H](O)CCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450887069	DE	On-Demand	Anodyne	NPBWR1	30	41
C[C@H](O)CCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450887069	DE	On-Demand	Anodyne	Q9M629_MAIZE	52	31
C[C@@H](O)CCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450887070	DE	On-Demand	Anodyne	NPBWR1	30	41
C[C@@H](O)CCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450887070	DE	On-Demand	Anodyne	Q9M629_MAIZE	52	31
CC(=O)[C@](C)(O)CN1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1	ZINC000450887076	DD	On-Demand	Anodyne	ACHE	25	42
CC(=O)[C@@](C)(O)CN1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1	ZINC000450887078	DD	On-Demand	Anodyne	ACHE	25	42
CCc1cc(CCCSc2nnc(-c3cccc(Cl)c3)n2C)on1	ZINC000450887085	FI	On-Demand	Anodyne	DRD2	23	53
CCc1cc(CCCSc2nnc(-c3cccc(Cl)c3)n2C)on1	ZINC000450887085	FI	On-Demand	Anodyne	DRD3	57	40
CCc1cc(CCCSc2nnc(-c3cccc(Cl)c3)n2C)on1	ZINC000450887085	FI	On-Demand	Anodyne	KCNH2	27	42
CN(C)S(=O)(=O)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450887089	FE	On-Demand	Bother	BDKRB1	23	43
CN(C)S(=O)(=O)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450887090	FE	On-Demand	Bother	BDKRB1	23	43
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCCC[C@H]1CCOC1	ZINC000450887119	GD	On-Demand	Bother	DDIT3	0	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCCC[C@@H]1CCOC1	ZINC000450887121	GD	On-Demand	Bother	DDIT3	0	40
CCC(=O)CCCN1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000450887122	EG	On-Demand	Anodyne	DRD2	20	51
N#Cc1ccc(N2CCC[C@]3(CCOC3)C2)cc1C(F)(F)F	ZINC000450887134	DH	On-Demand	Mild	AR	52	43
N#Cc1ccc(N2CCC[C@@]3(CCOC3)C2)cc1C(F)(F)F	ZINC000450887136	DH	On-Demand	Mild	AR	52	43
CC(=O)c1cccc(CN2CCCC3(CCC3)C2)c1	ZINC000450887143	CH	On-Demand	Anodyne	SLC12A5	42	32
CC(=O)[C@](C)(O)CN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450887150	ED	On-Demand	Mild	PTAFR	43	39
CC(=O)[C@](C)(O)CN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450887151	ED	On-Demand	Mild	PTAFR	43	39
CC(=O)[C@@](C)(O)CN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450887152	ED	On-Demand	Mild	PTAFR	43	39
CC(=O)[C@@](C)(O)CN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450887153	ED	On-Demand	Mild	PTAFR	43	39
C[C@H](c1ccccc1)[C@H](O)CN1C[C@H](O)C[C@@H]1c1ccccc1C(F)(F)F	ZINC000450887164	GH	On-Demand	Anodyne	RBP4	65	39
C[C@H](c1ccccc1)[C@H](O)CN1C[C@H](O)C[C@H]1c1ccccc1C(F)(F)F	ZINC000450887166	GH	On-Demand	Anodyne	RBP4	65	39
C[C@H](c1ccccc1)[C@H](O)CN1C[C@@H](O)C[C@@H]1c1ccccc1C(F)(F)F	ZINC000450887168	GH	On-Demand	Anodyne	RBP4	65	39
C[C@H](c1ccccc1)[C@H](O)CN1C[C@@H](O)C[C@H]1c1ccccc1C(F)(F)F	ZINC000450887170	GH	On-Demand	Anodyne	RBP4	65	39
Cn1ccc([C@@H](NC(=O)CSC2CC2)c2ccc(Cl)cc2)n1	ZINC000450887213	EG	On-Demand	Anodyne	PRCP	21	41
Cn1ccc([C@H](NC(=O)CSC2CC2)c2ccc(Cl)cc2)n1	ZINC000450887215	EG	On-Demand	Anodyne	PRCP	21	41
COc1cccc2c(NCCC[C@@H]3CCOC3)ccnc12	ZINC000450887231	CG	On-Demand	Anodyne	KCNN3	17	41
COc1cccc2c(NCCC[C@H]3CCOC3)ccnc12	ZINC000450887232	CG	On-Demand	Anodyne	KCNN3	17	41
FC1(F)CC[C@@H](CN2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)C1	ZINC000450887245	DG	On-Demand	Anodyne	SIGMAR1	44	39
FC1(F)CC[C@H](CN2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)C1	ZINC000450887246	DG	On-Demand	Anodyne	SIGMAR1	44	39
Cc1cc(C(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)nn1C(C)C	ZINC000450887270	GG	On-Demand	Anodyne	SCD	23	40
Cc1cc(C(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)nn1C(C)C	ZINC000450887271	GG	On-Demand	Anodyne	SCD	23	40
O=C(c1cnc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1)N1CCCCC1	ZINC000450887278	GG	On-Demand	Anodyne	CXCR3	37	43
O=C(c1cnc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1)N1CCCCC1	ZINC000450887278	GG	On-Demand	Anodyne	HPGD	40	37
O=C(c1cnc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1)N1CCCCC1	ZINC000450887279	GG	On-Demand	Anodyne	CXCR3	37	43
O=C(c1cnc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1)N1CCCCC1	ZINC000450887279	GG	On-Demand	Anodyne	HPGD	40	37
O=C(c1cnc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1)N1CCCCC1	ZINC000450887280	GG	On-Demand	Anodyne	CXCR3	37	43
O=C(c1cnc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(Cl)c1)N1CCCCC1	ZINC000450887280	GG	On-Demand	Anodyne	HPGD	40	37
O=C(c1cnc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1)N1CCCCC1	ZINC000450887281	GG	On-Demand	Anodyne	CXCR3	37	43
O=C(c1cnc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(Cl)c1)N1CCCCC1	ZINC000450887281	GG	On-Demand	Anodyne	HPGD	40	37
O=C(c1cccnc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1)N1CCc2ccccc21	ZINC000450887284	GG	On-Demand	Anodyne	AVPR2	41	39
O=C(c1cccnc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1)N1CCc2ccccc21	ZINC000450887285	GG	On-Demand	Anodyne	AVPR2	41	39
O=C(c1cccnc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1)N1CCc2ccccc21	ZINC000450887286	GG	On-Demand	Anodyne	AVPR2	41	39
O=C(c1cccnc1N1CC[C@H]([C@H](O)C(F)(F)F)C1)N1CCc2ccccc21	ZINC000450887287	GG	On-Demand	Anodyne	AVPR2	41	39
C[C@@H]1[C@@H](CO)CCN1CCN(C)Cc1ccccc1	ZINC000450887325	CD	On-Demand	Anodyne	SIGMAR1	25	41
C[C@H]1[C@@H](CO)CCN1CCN(C)Cc1ccccc1	ZINC000450887326	CD	On-Demand	Anodyne	SIGMAR1	25	41
C[C@H]1[C@H](CO)CCN1CCN(C)Cc1ccccc1	ZINC000450887327	CD	On-Demand	Anodyne	SIGMAR1	25	41
C[C@@H]1[C@H](CO)CCN1CCN(C)Cc1ccccc1	ZINC000450887328	CD	On-Demand	Anodyne	SIGMAR1	25	41
CC(C)n1ncc2c(=O)n(CCc3c(Cl)cccc3Cl)cnc21	ZINC000450887351	FH	On-Demand	Anodyne	Q9M629_MAIZE	50	35
Cc1nn(Cc2ccn(CC(F)(F)F)n2)c2ccc([N+](=O)[O-])cc12	ZINC000450887366	EG	On-Demand	Bother	F2RL3	44	31
COC(=O)c1csc(CN2CC[C@@H](C(F)(F)F)[C@H]2C)n1	ZINC000450887373	DF	On-Demand	Anodyne	TRPC6	47	36
COC(=O)c1csc(CN2CC[C@@H](C(F)(F)F)[C@@H]2C)n1	ZINC000450887374	DF	On-Demand	Anodyne	TRPC6	47	36
COC(=O)c1csc(CN2CC[C@H](C(F)(F)F)[C@H]2C)n1	ZINC000450887375	DF	On-Demand	Anodyne	TRPC6	47	36
COC(=O)c1csc(CN2CC[C@H](C(F)(F)F)[C@@H]2C)n1	ZINC000450887376	DF	On-Demand	Anodyne	TRPC6	47	36
Cc1cc(NC[C@H](CO)Cc2ccc(F)c(Br)c2)n2ncnc2n1	ZINC000450887379	GF	On-Demand	Anodyne	DHOD	0	47
Cc1cc(NC[C@@H](CO)Cc2ccc(F)c(Br)c2)n2ncnc2n1	ZINC000450887380	GF	On-Demand	Anodyne	DHOD	0	47
C[C@H]1[C@H](C(F)(F)F)CCN1CCN(C)Cc1ccccc1	ZINC000450887401	DG	On-Demand	Anodyne	SIGMAR1	25	40
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCN(C)Cc1ccccc1	ZINC000450887402	DG	On-Demand	Anodyne	SIGMAR1	25	40
C[C@@H]1[C@H](C(F)(F)F)CCN1CCN(C)Cc1ccccc1	ZINC000450887403	DG	On-Demand	Anodyne	SIGMAR1	25	40
C[C@H]1[C@@H](C(F)(F)F)CCN1CCN(C)Cc1ccccc1	ZINC000450887404	DG	On-Demand	Anodyne	SIGMAR1	25	40
Cc1nn(CCC(C)(F)F)c2ccc([N+](=O)[O-])cc12	ZINC000450887407	CG	On-Demand	Bother	F2RL3	52	37
COc1cc2c(NCCC[C@@H]3CCOC3)ncnc2cc1F	ZINC000450887409	DE	On-Demand	Anodyne	EGFR	34	41
COc1cc2c(NCCC[C@@H]3CCOC3)ncnc2cc1F	ZINC000450887409	DE	On-Demand	Anodyne	FGFR1	21	41
COc1cc2c(NCCC[C@@H]3CCOC3)ncnc2cc1F	ZINC000450887409	DE	On-Demand	Anodyne	FLT1	31	41
COc1cc2c(NCCC[C@@H]3CCOC3)ncnc2cc1F	ZINC000450887409	DE	On-Demand	Anodyne	EPHA2	49	38
COc1cc2c(NCCC[C@H]3CCOC3)ncnc2cc1F	ZINC000450887410	DE	On-Demand	Anodyne	EGFR	34	41
COc1cc2c(NCCC[C@H]3CCOC3)ncnc2cc1F	ZINC000450887410	DE	On-Demand	Anodyne	FGFR1	21	41
COc1cc2c(NCCC[C@H]3CCOC3)ncnc2cc1F	ZINC000450887410	DE	On-Demand	Anodyne	FLT1	31	41
COc1cc2c(NCCC[C@H]3CCOC3)ncnc2cc1F	ZINC000450887410	DE	On-Demand	Anodyne	EPHA2	49	38
Cn1ncc2c(NC[C@H](CO)Cc3ccc(F)c(Br)c3)ncnc21	ZINC000450887444	GF	On-Demand	Anodyne	SRC	0	41
Cn1ncc2c(NC[C@@H](CO)Cc3ccc(F)c(Br)c3)ncnc21	ZINC000450887445	GF	On-Demand	Anodyne	SRC	0	41
COC(=O)C1(CN2CCC[C@H](OCc3ccccc3F)C2)CC1	ZINC000450887463	DF	On-Demand	Anodyne	SLC6A1	75	37
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC(Cc2cc(F)cc(F)c2)CC1	ZINC000450887468	GF	On-Demand	Bother	SIRT3	43	35
CC(C)(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450887491	CG	On-Demand	Anodyne	DRD4	0	46
CC(C)(C)[C@@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450887491	CG	On-Demand	Anodyne	SLC6A1	64	36
CC(C)(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450887492	CG	On-Demand	Anodyne	DRD4	0	46
CC(C)(C)[C@H]1CN(CCCC(=O)c2ccccc2)CCO1	ZINC000450887492	CG	On-Demand	Anodyne	SLC6A1	64	36
CCC1(c2ccc(Cl)cc2)CCN(C[C@@H](O)COCCOC)CC1	ZINC000450887502	FG	On-Demand	Anodyne	CCR1	46	37
CCC1(c2ccc(Cl)cc2)CCN(C[C@@H](O)COCCOC)CC1	ZINC000450887502	FG	On-Demand	Anodyne	HSP90AB1	38	46
CCC1(c2ccc(Cl)cc2)CCN(C[C@H](O)COCCOC)CC1	ZINC000450887503	FG	On-Demand	Anodyne	CCR1	46	37
CCC1(c2ccc(Cl)cc2)CCN(C[C@H](O)COCCOC)CC1	ZINC000450887503	FG	On-Demand	Anodyne	HSP90AB1	38	46
CN1CC[C@@](O)(CNC(=O)C2(c3ccccc3Br)CCCCC2)C1	ZINC000450887519	GF	On-Demand	Anodyne	HCN1	54	36
CN1CC[C@@](O)(CNC(=O)C2(c3ccccc3Br)CCCCC2)C1	ZINC000450887519	GF	On-Demand	Anodyne	HCN4	48	31
CN1CC[C@](O)(CNC(=O)C2(c3ccccc3Br)CCCCC2)C1	ZINC000450887520	GF	On-Demand	Anodyne	HCN1	54	36
CN1CC[C@](O)(CNC(=O)C2(c3ccccc3Br)CCCCC2)C1	ZINC000450887520	GF	On-Demand	Anodyne	HCN4	48	31
C[C@H](CN1CCC(C)(c2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450887539	EG	On-Demand	Anodyne	CCR1	48	37
C[C@@H](CN1CCC(C)(c2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450887540	EG	On-Demand	Anodyne	CCR1	48	37
CC[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)C1CCCC1	ZINC000450887558	FH	On-Demand	Anodyne	LRRK2	27	40
CC[C@@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)C1CCCC1	ZINC000450887559	FH	On-Demand	Anodyne	LRRK2	27	40
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887568	GF	On-Demand	Anodyne	HSD11B1	20	42
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887568	GF	On-Demand	Anodyne	SLC6A9	42	38
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887568	GF	On-Demand	Anodyne	LIPG	40	33
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887568	GF	On-Demand	Anodyne	GPR119	45	39
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887569	GF	On-Demand	Anodyne	HSD11B1	20	42
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887569	GF	On-Demand	Anodyne	SLC6A9	42	38
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887569	GF	On-Demand	Anodyne	LIPG	40	33
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887569	GF	On-Demand	Anodyne	GPR119	45	39
CS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887570	GF	On-Demand	Anodyne	HSD11B1	20	42
CS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887570	GF	On-Demand	Anodyne	SLC6A9	42	38
CS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887570	GF	On-Demand	Anodyne	LIPG	40	33
CS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887570	GF	On-Demand	Anodyne	GPR119	45	39
CS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887571	GF	On-Demand	Anodyne	HSD11B1	20	42
CS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887571	GF	On-Demand	Anodyne	SLC6A9	42	38
CS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887571	GF	On-Demand	Anodyne	LIPG	40	33
CS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c(C(F)(F)F)c1	ZINC000450887571	GF	On-Demand	Anodyne	GPR119	45	39
CC(C)c1nccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450887572	CE	On-Demand	Anodyne	SORD	75	49
CC(C)c1nccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450887573	CE	On-Demand	Anodyne	SORD	75	49
CC(C)c1nccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450887574	CE	On-Demand	Anodyne	SORD	75	49
CC(C)c1nccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450887575	CE	On-Demand	Anodyne	SORD	75	49
Cc1ccnc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450887582	CD	On-Demand	Anodyne	SORD	42	34
Cc1ccnc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450887583	CD	On-Demand	Anodyne	SORD	42	34
Cc1ccnc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000450887584	CD	On-Demand	Anodyne	SORD	42	34
Cc1ccnc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000450887585	CD	On-Demand	Anodyne	SORD	42	34
CCc1cccc(C(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)n1	ZINC000450887588	FF	On-Demand	Anodyne	HCRTR1	22	41
CCc1cccc(C(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)n1	ZINC000450887588	FF	On-Demand	Anodyne	HCRTR2	0	41
CCc1cccc(C(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)n1	ZINC000450887589	FF	On-Demand	Anodyne	HCRTR1	22	41
CCc1cccc(C(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)n1	ZINC000450887589	FF	On-Demand	Anodyne	HCRTR2	0	41
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450887590	GF	On-Demand	Anodyne	SCD	21	40
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450887591	GF	On-Demand	Anodyne	SCD	21	40
C[C@@H](OCCc1ccccc1)C(=O)N1CC[C@H](Oc2cccnc2N(C)C)C1	ZINC000450887592	GF	On-Demand	Anodyne	SCD	21	40
C[C@H](OCCc1ccccc1)C(=O)N1CC[C@@H](Oc2cccnc2N(C)C)C1	ZINC000450887593	GF	On-Demand	Anodyne	SCD	21	40
Cc1cc(C(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)c(C)n1C(C)C	ZINC000450887601	GH	On-Demand	Anodyne	HCRTR1	0	40
Cc1cc(C(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)c(C)n1C(C)C	ZINC000450887601	GH	On-Demand	Anodyne	HCRTR2	0	40
Cc1cc(C(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)c(C)n1C(C)C	ZINC000450887602	GH	On-Demand	Anodyne	HCRTR1	0	40
Cc1cc(C(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)c(C)n1C(C)C	ZINC000450887602	GH	On-Demand	Anodyne	HCRTR2	0	40
CCC(=O)c1ccc(OCC[C@H]2CCOC2)c(F)c1	ZINC000450887612	CG	On-Demand	Anodyne	THRA	0	43
CCC(=O)c1ccc(OCC[C@H]2CCOC2)c(F)c1	ZINC000450887612	CG	On-Demand	Anodyne	PDEC	0	44
CCC(=O)c1ccc(OCC[C@@H]2CCOC2)c(F)c1	ZINC000450887613	CG	On-Demand	Anodyne	THRA	0	43
CCC(=O)c1ccc(OCC[C@@H]2CCOC2)c(F)c1	ZINC000450887613	CG	On-Demand	Anodyne	PDEC	0	44
O=C(NC1CC1)N[C@H]1CCN(C(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450887631	GG	On-Demand	Anodyne	EPHX2	41	46
O=C(NC1CC1)N[C@@H]1CCN(C(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450887632	GG	On-Demand	Anodyne	EPHX2	41	46
O[C@H]([C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1)C(F)(F)F	ZINC000450887637	FG	On-Demand	Anodyne	RBP4	19	46
O[C@@H]([C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1)C(F)(F)F	ZINC000450887638	FG	On-Demand	Anodyne	RBP4	19	46
O[C@H]([C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1)C(F)(F)F	ZINC000450887639	FG	On-Demand	Anodyne	RBP4	19	46
O[C@@H]([C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1)C(F)(F)F	ZINC000450887640	FG	On-Demand	Anodyne	RBP4	19	46
CC1CCN(C(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)CC1	ZINC000450887641	FF	On-Demand	Anodyne	MCHR1	0	41
CC1CCN(C(=O)c2ccc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc2)CC1	ZINC000450887641	FF	On-Demand	Anodyne	L3MBTL3	48	34
CC1CCN(C(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)CC1	ZINC000450887642	FF	On-Demand	Anodyne	MCHR1	0	41
CC1CCN(C(=O)c2ccc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc2)CC1	ZINC000450887642	FF	On-Demand	Anodyne	L3MBTL3	48	34
CC1CCN(C(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)CC1	ZINC000450887643	FF	On-Demand	Anodyne	MCHR1	0	41
CC1CCN(C(=O)c2ccc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc2)CC1	ZINC000450887643	FF	On-Demand	Anodyne	L3MBTL3	48	34
CC1CCN(C(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)CC1	ZINC000450887644	FF	On-Demand	Anodyne	MCHR1	0	41
CC1CCN(C(=O)c2ccc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc2)CC1	ZINC000450887644	FF	On-Demand	Anodyne	L3MBTL3	48	34
CN(C)c1nc(NCCC[C@@H]2CCOC2)nc2ccccc12	ZINC000450887653	DE	On-Demand	Anodyne	ADRA2A	17	52
CN(C)c1nc(NCCC[C@H]2CCOC2)nc2ccccc12	ZINC000450887654	DE	On-Demand	Anodyne	ADRA2A	17	52
Cc1nn(C[C@H]2CCC(F)(F)C2)c2ccc([N+](=O)[O-])cc12	ZINC000450887673	CH	On-Demand	Bother	F2RL3	47	34
Cc1nn(C[C@@H]2CCC(F)(F)C2)c2ccc([N+](=O)[O-])cc12	ZINC000450887674	CH	On-Demand	Bother	F2RL3	47	34
COC(=O)CC1(NCc2ccccc2OC2CC2)CCCC1	ZINC000450887692	DG	On-Demand	Anodyne	HCN1	40	32
COC(=O)CC1(NCc2ccccc2OC2CC2)CCCC1	ZINC000450887692	DG	On-Demand	Anodyne	HCN4	40	32
COc1ccc(CNC(=O)CCN(C)Cc2ccccc2SC)c(OC)c1	ZINC000450887696	GH	On-Demand	Anodyne	MTNR1A	65	39
COc1ccc(CNC(=O)CCN(C)Cc2ccccc2SC)c(OC)c1	ZINC000450887696	GH	On-Demand	Anodyne	MTNR1B	58	39
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCC[C@@H]1CCOC1	ZINC000450887728	ED	On-Demand	Anodyne	CA2	34	47
COC(=O)c1cc(S(N)(=O)=O)ccc1NCCC[C@H]1CCOC1	ZINC000450887729	ED	On-Demand	Anodyne	CA2	34	47
C[C@@H](O)CCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450887758	CF	On-Demand	Anodyne	DRD2	0	47
C[C@@H](O)CCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450887758	CF	On-Demand	Anodyne	DRD3	38	41
C[C@@H](O)CCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450887758	CF	On-Demand	Anodyne	KCNH2	25	47
C[C@H](O)CCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450887759	CF	On-Demand	Anodyne	DRD2	0	47
C[C@H](O)CCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450887759	CF	On-Demand	Anodyne	DRD3	38	41
C[C@H](O)CCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000450887759	CF	On-Demand	Anodyne	KCNH2	25	47
COC1(CSc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)CCC1	ZINC000450887773	GJ	On-Demand	Anodyne	HCRTR2	20	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887778	GH	On-Demand	Anodyne	PRNP	36	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887778	GH	On-Demand	Anodyne	HDAC1	31	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887778	GH	On-Demand	Anodyne	MCHR1	19	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887778	GH	On-Demand	Anodyne	TAAR1	38	47
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887778	GH	On-Demand	Anodyne	DGAT1	40	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887778	GH	On-Demand	Anodyne	KCNK3	45	37
NC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450887784	EF	On-Demand	Anodyne	ENPP2	19	40
NC(=O)c1ccc(N2CCC(Cc3cc(F)cc(F)c3)CC2)nc1	ZINC000450887784	EF	On-Demand	Anodyne	HPGDS	21	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887785	GH	On-Demand	Anodyne	PRNP	36	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887785	GH	On-Demand	Anodyne	HDAC1	31	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887785	GH	On-Demand	Anodyne	MCHR1	19	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887785	GH	On-Demand	Anodyne	TAAR1	38	47
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887785	GH	On-Demand	Anodyne	DGAT1	40	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887785	GH	On-Demand	Anodyne	KCNK3	45	37
C[C@H](O)C[C@H]1CCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450887786	EG	On-Demand	Anodyne	SLC18A2	49	38
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887787	GH	On-Demand	Anodyne	PRNP	36	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887787	GH	On-Demand	Anodyne	HDAC1	31	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887787	GH	On-Demand	Anodyne	MCHR1	19	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887787	GH	On-Demand	Anodyne	TAAR1	38	47
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887787	GH	On-Demand	Anodyne	DGAT1	40	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc1	ZINC000450887787	GH	On-Demand	Anodyne	KCNK3	45	37
C[C@H](O)C[C@@H]1CCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450887788	EG	On-Demand	Anodyne	SLC18A2	49	38
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887789	GH	On-Demand	Anodyne	PRNP	36	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887789	GH	On-Demand	Anodyne	HDAC1	31	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887789	GH	On-Demand	Anodyne	MCHR1	19	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887789	GH	On-Demand	Anodyne	TAAR1	38	47
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887789	GH	On-Demand	Anodyne	DGAT1	40	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc1	ZINC000450887789	GH	On-Demand	Anodyne	KCNK3	45	37
C[C@@H](O)C[C@@H]1CCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450887790	EG	On-Demand	Anodyne	SLC18A2	49	38
CC(C)(C)c1nnc2ccc(N3CC(c4cccc(C(F)(F)F)c4)C3)nn12	ZINC000450887791	GI	On-Demand	Anodyne	LRRK2	22	41
C[C@@H](O)C[C@H]1CCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450887792	EG	On-Demand	Anodyne	SLC18A2	49	38
CC[C@@H](Nc1cc(COC)nc2ncnn12)C1CCCC1	ZINC000450887805	CF	On-Demand	Anodyne	DHOD	0	40
CC[C@H](Nc1cc(COC)nc2ncnn12)C1CCCC1	ZINC000450887807	CF	On-Demand	Anodyne	DHOD	0	40
CC1=CCN(CCNC(=O)c2c(C)cccc2Cl)CC1	ZINC000450887817	CG	On-Demand	Anodyne	DRD4	51	41
CC(C)NC(=O)c1ccc(N2CCC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450887818	EF	On-Demand	Bother	TAAR1	19	45
CC(C)NC(=O)c1ccc(N2CCC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000450887819	EF	On-Demand	Bother	TAAR1	19	45
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(COc3ccccc3)n2C)C1	ZINC000450887848	EG	On-Demand	Anodyne	VCP	52	35
C[C@@H]1CCC(=O)[C@H](Sc2nnc(COc3ccccc3)n2C)C1	ZINC000450887850	EG	On-Demand	Anodyne	VCP	52	35
C[C@H]1CCC(=O)[C@H](Sc2nnc(COc3ccccc3)n2C)C1	ZINC000450887852	EG	On-Demand	Anodyne	VCP	52	35
C[C@H]1CCC(=O)[C@@H](Sc2nnc(COc3ccccc3)n2C)C1	ZINC000450887854	EG	On-Demand	Anodyne	VCP	52	35
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(-c3cccnc3)n2-c2ccc(Cl)cc2)C1	ZINC000450887864	GJ	On-Demand	Anodyne	VCP	53	32
C[C@@H]1CCC(=O)[C@H](Sc2nnc(-c3cccnc3)n2-c2ccc(Cl)cc2)C1	ZINC000450887867	GJ	On-Demand	Anodyne	VCP	53	32
C[C@H]1CCC(=O)[C@H](Sc2nnc(-c3cccnc3)n2-c2ccc(Cl)cc2)C1	ZINC000450887869	GJ	On-Demand	Anodyne	VCP	53	32
C[C@H]1CCC(=O)[C@@H](Sc2nnc(-c3cccnc3)n2-c2ccc(Cl)cc2)C1	ZINC000450887871	GJ	On-Demand	Anodyne	VCP	53	32
CC(F)(F)CCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450887873	EG	On-Demand	Anodyne	NPBWR1	23	40
CC(F)(F)CCn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O	ZINC000450887873	EG	On-Demand	Anodyne	Q9M629_MAIZE	57	34
Clc1cccc(-c2noc(N3CCC[C@]4(CCOC4)C3)n2)c1	ZINC000450887881	DG	On-Demand	Anodyne	GRM5	21	43
Clc1cccc(-c2noc(N3CCC[C@@]4(CCOC4)C3)n2)c1	ZINC000450887883	DG	On-Demand	Anodyne	GRM5	21	43
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000450887887	EG	On-Demand	Mild	LIPG	60	40
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000450887889	EG	On-Demand	Mild	LIPG	60	40
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000450887890	EG	On-Demand	Mild	LIPG	60	40
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000450887892	EG	On-Demand	Mild	LIPG	60	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cc[nH]n2)c(OC)c1	ZINC000450887898	FE	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cc[nH]n2)c(OC)c1	ZINC000450887898	FE	On-Demand	Anodyne	MTNR1A	49	35
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cc[nH]n2)c(OC)c1	ZINC000450887898	FE	On-Demand	Anodyne	MTNR1B	44	37
COc1ccc(CNC(=O)CCN2CCC[C@H]2c2cc[nH]n2)c(OC)c1	ZINC000450887898	FE	On-Demand	Anodyne	ACKR3	50	32
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cc[nH]n2)c(OC)c1	ZINC000450887900	FE	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cc[nH]n2)c(OC)c1	ZINC000450887900	FE	On-Demand	Anodyne	MTNR1A	49	35
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cc[nH]n2)c(OC)c1	ZINC000450887900	FE	On-Demand	Anodyne	MTNR1B	44	37
COc1ccc(CNC(=O)CCN2CCC[C@@H]2c2cc[nH]n2)c(OC)c1	ZINC000450887900	FE	On-Demand	Anodyne	ACKR3	50	32
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1	ZINC000450887905	DD	On-Demand	Anodyne	SLC6A9	27	44
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1	ZINC000450887905	DD	On-Demand	Anodyne	GPR119	31	46
CS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1	ZINC000450887907	DD	On-Demand	Anodyne	SLC6A9	27	44
CS(=O)(=O)c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1	ZINC000450887907	DD	On-Demand	Anodyne	GPR119	31	46
CS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1	ZINC000450887908	DD	On-Demand	Anodyne	SLC6A9	27	44
CS(=O)(=O)c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc1	ZINC000450887908	DD	On-Demand	Anodyne	GPR119	31	46
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1	ZINC000450887909	DD	On-Demand	Anodyne	SLC6A9	27	44
CS(=O)(=O)c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc1	ZINC000450887909	DD	On-Demand	Anodyne	GPR119	31	46
CCOC(=O)c1sc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c2c1C	ZINC000450887927	GF	On-Demand	Anodyne	SIRT3	44	33
CCOC(=O)c1sc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c2c1C	ZINC000450887928	GF	On-Demand	Anodyne	SIRT3	44	33
CCOC(=O)c1sc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c2c1C	ZINC000450887929	GF	On-Demand	Anodyne	SIRT3	44	33
CCOC(=O)c1sc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c2c1C	ZINC000450887930	GF	On-Demand	Anodyne	SIRT3	44	33
Cc1cccc2ncnc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)c12	ZINC000450887934	DF	On-Demand	Anodyne	PDE3B	49	32
Cc1cccc2ncnc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)c12	ZINC000450887935	DF	On-Demand	Anodyne	PDE3B	49	32
Cc1cccc2ncnc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)c12	ZINC000450887936	DF	On-Demand	Anodyne	PDE3B	49	32
Cc1cccc2ncnc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)c12	ZINC000450887937	DF	On-Demand	Anodyne	PDE3B	49	32
COC(=O)c1ccc(Cn2cnc3c(cnn3C(C)C)c2=O)cc1Cl	ZINC000450887966	FF	On-Demand	Anodyne	DNAE	61	33
COC(=O)c1ccc(Cn2cnc3c(cnn3C(C)C)c2=O)cc1Cl	ZINC000450887966	FF	On-Demand	Anodyne	SCD1	0	45
COC(=O)c1ccc(Cn2cnc3c(cnn3C(C)C)c2=O)cc1Cl	ZINC000450887966	FF	On-Demand	Anodyne	Q9M629_MAIZE	55	35
CCS(=O)(=O)c1ccc(CNC2(CC(=O)OC)CCCC2)cc1	ZINC000450888013	EE	On-Demand	Anodyne	RORC	40	32
COC(=O)c1nc([C@H]2CCCN2CC/C=C\c2ccccc2)sc1C	ZINC000450888014	FI	On-Demand	Anodyne	CACNA1B	43	35
COC(=O)c1nc([C@H]2CCCN2CC/C=C\c2ccccc2)sc1C	ZINC000450888014	FI	On-Demand	Anodyne	COLA	0	41
COC(=O)c1nc([C@H]2CCCN2CC/C=C\c2ccccc2)sc1C	ZINC000450888014	FI	On-Demand	Anodyne	CPT1A	20	41
COC(=O)c1nc([C@@H]2CCCN2CC/C=C/c2ccccc2)sc1C	ZINC000450888015	FI	On-Demand	Anodyne	CACNA1B	43	35
COC(=O)c1nc([C@@H]2CCCN2CC/C=C/c2ccccc2)sc1C	ZINC000450888015	FI	On-Demand	Anodyne	COLA	0	41
COC(=O)c1nc([C@@H]2CCCN2CC/C=C/c2ccccc2)sc1C	ZINC000450888015	FI	On-Demand	Anodyne	CPT1A	20	41
COC(=O)c1nc([C@@H]2CCCN2CC/C=C\c2ccccc2)sc1C	ZINC000450888016	FI	On-Demand	Anodyne	CACNA1B	43	35
COC(=O)c1nc([C@@H]2CCCN2CC/C=C\c2ccccc2)sc1C	ZINC000450888016	FI	On-Demand	Anodyne	COLA	0	41
COC(=O)c1nc([C@@H]2CCCN2CC/C=C\c2ccccc2)sc1C	ZINC000450888016	FI	On-Demand	Anodyne	CPT1A	20	41
COC(=O)c1nc([C@H]2CCCN2CC/C=C/c2ccccc2)sc1C	ZINC000450888017	FI	On-Demand	Anodyne	CACNA1B	43	35
COC(=O)c1nc([C@H]2CCCN2CC/C=C/c2ccccc2)sc1C	ZINC000450888017	FI	On-Demand	Anodyne	COLA	0	41
COC(=O)c1nc([C@H]2CCCN2CC/C=C/c2ccccc2)sc1C	ZINC000450888017	FI	On-Demand	Anodyne	CPT1A	20	41
O=C(NCCN(CCN1CCOCC1)C(=O)[C@@H](O)C1CCC1)[C@H](O)C1CCC1	ZINC000450888021	GB	On-Demand	Anodyne	CASR	40	33
O=C(NCCN(CCN1CCOCC1)C(=O)[C@H](O)C1CCC1)[C@H](O)C1CCC1	ZINC000450888022	GB	On-Demand	Anodyne	CASR	40	33
O=C(NCCN(CCN1CCOCC1)C(=O)[C@@H](O)C1CCC1)[C@@H](O)C1CCC1	ZINC000450888023	GB	On-Demand	Anodyne	CASR	40	33
O=C(NCCN(CCN1CCOCC1)C(=O)[C@H](O)C1CCC1)[C@@H](O)C1CCC1	ZINC000450888024	GB	On-Demand	Anodyne	CASR	40	33
COCCOC[C@H](O)CN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888040	FD	On-Demand	Mild	CYP2D6	24	45
COCCOC[C@H](O)CN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888040	FD	On-Demand	Mild	HSP90AB1	37	46
COCCOC[C@H](O)CN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888041	FD	On-Demand	Mild	CYP2D6	24	45
COCCOC[C@H](O)CN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888041	FD	On-Demand	Mild	HSP90AB1	37	46
COCCOC[C@@H](O)CN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888042	FD	On-Demand	Mild	CYP2D6	24	45
COCCOC[C@@H](O)CN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888042	FD	On-Demand	Mild	HSP90AB1	37	46
COc1cc2nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888047	FD	On-Demand	Anodyne	ADRA1D	16	52
COc1cc2nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888047	FD	On-Demand	Anodyne	ADRA1B	44	52
COc1cc2nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888047	FD	On-Demand	Anodyne	PDE3A	46	36
COc1cc2nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888047	FD	On-Demand	Anodyne	CCR4	52	43
COc1cc2nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888047	FD	On-Demand	Anodyne	PDE3B	66	35
COc1cc2nc(N3CC[C@@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888047	FD	On-Demand	Anodyne	EHMT2	63	35
COc1cc2nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888048	FD	On-Demand	Anodyne	ADRA1D	16	52
COc1cc2nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888048	FD	On-Demand	Anodyne	ADRA1B	44	52
COc1cc2nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888048	FD	On-Demand	Anodyne	PDE3A	46	36
COc1cc2nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888048	FD	On-Demand	Anodyne	CCR4	52	43
COc1cc2nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888048	FD	On-Demand	Anodyne	PDE3B	66	35
COc1cc2nc(N3CC[C@H]([C@@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888048	FD	On-Demand	Anodyne	EHMT2	63	35
COc1cc2nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888049	FD	On-Demand	Anodyne	ADRA1D	16	52
COc1cc2nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888049	FD	On-Demand	Anodyne	ADRA1B	44	52
COc1cc2nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888049	FD	On-Demand	Anodyne	PDE3A	46	36
COc1cc2nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888049	FD	On-Demand	Anodyne	CCR4	52	43
COc1cc2nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888049	FD	On-Demand	Anodyne	PDE3B	66	35
COc1cc2nc(N3CC[C@@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888049	FD	On-Demand	Anodyne	EHMT2	63	35
COc1cc2nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888050	FD	On-Demand	Anodyne	ADRA1D	16	52
COc1cc2nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888050	FD	On-Demand	Anodyne	ADRA1B	44	52
COc1cc2nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888050	FD	On-Demand	Anodyne	PDE3A	46	36
COc1cc2nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888050	FD	On-Demand	Anodyne	CCR4	52	43
COc1cc2nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888050	FD	On-Demand	Anodyne	PDE3B	66	35
COc1cc2nc(N3CC[C@H]([C@H](O)C(F)(F)F)C3)nc(N)c2cc1OC	ZINC000450888050	FD	On-Demand	Anodyne	EHMT2	63	35
COC(=O)c1cccc(CN2CCC(Oc3cnccn3)CC2)c1Cl	ZINC000450888051	FF	On-Demand	Anodyne	HRH1	0	43
COC(=O)c1cccc(CN2CCC(Oc3cnccn3)CC2)c1Cl	ZINC000450888051	FF	On-Demand	Anodyne	CCR3	23	43
COC(=O)c1ccc(CN2CC[C@H](CO)[C@@H]2C)cc1Cl	ZINC000450888058	CE	On-Demand	Anodyne	DRD2	15	41
COC(=O)c1ccc(CN2CC[C@@H](CO)[C@@H]2C)cc1Cl	ZINC000450888059	CE	On-Demand	Anodyne	DRD2	15	41
COC(=O)c1ccc(CN2CC[C@@H](CO)[C@H]2C)cc1Cl	ZINC000450888060	CE	On-Demand	Anodyne	DRD2	15	41
COC(=O)c1ccc(CN2CC[C@H](CO)[C@H]2C)cc1Cl	ZINC000450888061	CE	On-Demand	Anodyne	DRD2	15	41
Cc1cc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)nc(-c2cccnc2)n1	ZINC000450888077	EF	On-Demand	Anodyne	ROS1	43	40
Cc1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)nc(-c2cccnc2)n1	ZINC000450888078	EF	On-Demand	Anodyne	ROS1	43	40
Cc1cc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)nc(-c2cccnc2)n1	ZINC000450888079	EF	On-Demand	Anodyne	ROS1	43	40
Cc1cc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)nc(-c2cccnc2)n1	ZINC000450888080	EF	On-Demand	Anodyne	ROS1	43	40
CCOC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)nc1	ZINC000450888103	FF	On-Demand	Anodyne	SSTR5	45	38
CCOC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)nc1	ZINC000450888103	FF	On-Demand	Anodyne	SCN9A	0	42
CCOC(=O)c1ccc(CN2CCC(Oc3ncccc3F)CC2)nc1	ZINC000450888103	FF	On-Demand	Anodyne	SCN5A	85	42
COCCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450888105	GG	On-Demand	Anodyne	CCR2	78	43
COCCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450888105	GG	On-Demand	Anodyne	SCD1	29	45
COCCNC(=O)c1ccc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450888105	GG	On-Demand	Anodyne	SCD	25	44
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450888106	GH	On-Demand	Anodyne	EPHX2	15	42
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450888107	GH	On-Demand	Anodyne	EPHX2	15	42
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450888108	GH	On-Demand	Anodyne	EPHX2	15	42
CN(C)c1ncccc1O[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450888109	GH	On-Demand	Anodyne	EPHX2	15	42
COC(=O)c1cnc(N2CC(c3cccc(C(F)(F)F)c3)C2)nc1	ZINC000450888110	EF	On-Demand	Anodyne	CCR2	52	42
COCCOC[C@@H](O)CN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888122	FD	On-Demand	Mild	CYP2D6	24	45
COCCOC[C@@H](O)CN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888122	FD	On-Demand	Mild	HSP90AB1	37	46
N#Cc1cccc(N2CCN(C(=O)CNC(=O)Nc3cccc(Cl)c3)CC2)n1	ZINC000450888132	GE	On-Demand	Mild	P2RY12	16	41
Cn1cc([C@@]2(C)NC(=O)N(CCCCc3ccc(Cl)c(Cl)c3)C2=O)cn1	ZINC000450888161	GH	On-Demand	Anodyne	SIGMAR1	15	40
Cn1cc([C@@]2(C)NC(=O)N(CCCCc3ccc(Cl)c(Cl)c3)C2=O)cn1	ZINC000450888161	GH	On-Demand	Anodyne	DNAE	69	32
Cn1cc([C@]2(C)NC(=O)N(CCCCc3ccc(Cl)c(Cl)c3)C2=O)cn1	ZINC000450888162	GH	On-Demand	Anodyne	SIGMAR1	15	40
Cn1cc([C@]2(C)NC(=O)N(CCCCc3ccc(Cl)c(Cl)c3)C2=O)cn1	ZINC000450888162	GH	On-Demand	Anodyne	DNAE	69	32
CCCc1cc(NCCC[C@@H]2CCOC2)n2ncnc2n1	ZINC000450888163	CE	On-Demand	Anodyne	DHOD	0	47
CCCc1cc(NCCC[C@H]2CCOC2)n2ncnc2n1	ZINC000450888164	CE	On-Demand	Anodyne	DHOD	0	47
C[C@H](O)CCN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888190	DE	On-Demand	Mild	PTAFR	29	42
C[C@@H](O)CCN1CCN([C@@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888191	DE	On-Demand	Mild	PTAFR	29	42
C[C@@H](O)CCN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888192	DE	On-Demand	Mild	PTAFR	29	42
C[C@H](O)CCN1CCN([C@H](C#N)c2cccc(Cl)c2)CC1	ZINC000450888193	DE	On-Demand	Mild	PTAFR	29	42
Cc1nn(C[C@@H]2COCCO2)c2ccc([N+](=O)[O-])cc12	ZINC000450888244	CD	On-Demand	Bother	F2RL3	45	32
Cc1nn(C[C@H]2COCCO2)c2ccc([N+](=O)[O-])cc12	ZINC000450888248	CD	On-Demand	Bother	F2RL3	45	32
CC(C)(CC(=O)COc1ccc(C#N)cc1F)C1CC1	ZINC000450888262	CG	On-Demand	Mild	AR	25	46
COC(=O)c1nc([C@@H]2CCCN2CCc2ccc(Cl)cc2)sc1C	ZINC000450888356	FI	On-Demand	Anodyne	HRH3	38	41
COC(=O)c1nc([C@H]2CCCN2CCc2ccc(Cl)cc2)sc1C	ZINC000450888357	FI	On-Demand	Anodyne	HRH3	38	41
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccccc1	ZINC000450888375	CH	On-Demand	Anodyne	CYP2J2	63	45
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccccc1	ZINC000450888376	CH	On-Demand	Anodyne	CYP2J2	63	45
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccccc1	ZINC000450888377	CH	On-Demand	Anodyne	CYP2J2	63	45
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccccc1	ZINC000450888378	CH	On-Demand	Anodyne	CYP2J2	63	45
CCCn1c(CO)nnc1SCc1ccc(Cl)c(OC)c1	ZINC000450888387	EG	On-Demand	Anodyne	AGTR1	16	42
CC(=O)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450888391	CG	On-Demand	Bother	TAAR1	16	41
CC(=O)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450888392	CG	On-Demand	Bother	TAAR1	16	41
COC(=O)c1csc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)n1	ZINC000450888402	FE	On-Demand	Anodyne	SIGMAR1	46	44
O=C(c1cnc(NCCC[C@@H]2CCOC2)c(Cl)c1)N1CCOCC1	ZINC000450888429	FE	On-Demand	Anodyne	LRRK2	28	41
O=C(c1cnc(NCCC[C@H]2CCOC2)c(Cl)c1)N1CCOCC1	ZINC000450888430	FE	On-Demand	Anodyne	LRRK2	28	41
Cc1nn(C[C@@H]2CCCC2(F)F)c2ccc([N+](=O)[O-])cc12	ZINC000450888471	CH	On-Demand	Bother	F2RL3	45	34
Cc1nn(C[C@H]2CCCC2(F)F)c2ccc([N+](=O)[O-])cc12	ZINC000450888472	CH	On-Demand	Bother	F2RL3	45	34
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(Cc2nnc(C3CC3)s2)C1	ZINC000450888485	FH	On-Demand	Anodyne	RBP4	44	32
O[C@H]1C[C@@H](c2ccccc2C(F)(F)F)N(Cc2nnc(C3CC3)s2)C1	ZINC000450888486	FH	On-Demand	Anodyne	RBP4	44	32
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(Cc2nnc(C3CC3)s2)C1	ZINC000450888487	FH	On-Demand	Anodyne	RBP4	44	32
O[C@H]1C[C@H](c2ccccc2C(F)(F)F)N(Cc2nnc(C3CC3)s2)C1	ZINC000450888488	FH	On-Demand	Anodyne	RBP4	44	32
Cc1nn(CCC[C@@H](C)O)c2ccc([N+](=O)[O-])cc12	ZINC000450888498	CE	On-Demand	Bother	F2RL3	51	38
Cc1nn(CCC[C@H](C)O)c2ccc([N+](=O)[O-])cc12	ZINC000450888499	CE	On-Demand	Bother	F2RL3	51	38
COc1cc(Cn2cnc3c(cnn3C(C)C)c2=O)ccc1Cl	ZINC000450888505	EF	On-Demand	Anodyne	NPBWR1	48	37
COc1cc(Cn2cnc3c(cnn3C(C)C)c2=O)ccc1Cl	ZINC000450888505	EF	On-Demand	Anodyne	Q9M629_MAIZE	52	38
CC(=O)CCCCCOc1ccc(C#N)cc1F	ZINC000450888529	BG	On-Demand	Mild	AR	16	42
CC(=O)CCCCCOc1ccc(C#N)cc1F	ZINC000450888529	BG	On-Demand	Mild	THRA	23	44
FC(F)(F)c1cc(NCCC[C@@H]2CCOC2)n2ncnc2n1	ZINC000450888545	DE	On-Demand	Anodyne	DHOD	0	48
FC(F)(F)c1cc(NCCC[C@H]2CCOC2)n2ncnc2n1	ZINC000450888546	DE	On-Demand	Anodyne	DHOD	0	48
CC(=O)c1cccc(CN2C[C@H](O)C[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000450888562	FI	On-Demand	Anodyne	RBP4	68	35
CC(=O)c1cccc(CN2C[C@@H](O)C[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000450888563	FI	On-Demand	Anodyne	RBP4	68	35
CC(=O)c1cccc(CN2C[C@@H](O)C[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000450888564	FI	On-Demand	Anodyne	RBP4	68	35
CC(=O)c1cccc(CN2C[C@H](O)C[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000450888565	FI	On-Demand	Anodyne	RBP4	68	35
CC(=O)c1cccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1	ZINC000450888605	EG	On-Demand	Anodyne	DRD2	0	41
CC(=O)c1cccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1	ZINC000450888605	EG	On-Demand	Anodyne	DRD4	43	44
CC(=O)c1cccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1	ZINC000450888605	EG	On-Demand	Anodyne	ACHE	29	45
CC(=O)c1cccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1	ZINC000450888605	EG	On-Demand	Anodyne	PROTEASE	0	50
CC(=O)c1cccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1	ZINC000450888605	EG	On-Demand	Anodyne	POL	0	56
CCCn1c(CO)nnc1SCc1ccn(CCc2ccccc2)n1	ZINC000450888606	FF	On-Demand	Anodyne	AGTR1	19	40
CCc1cc(NCCC[C@@H]2CCOC2)n2ncnc2n1	ZINC000450888626	CD	On-Demand	Anodyne	DHOD	0	48
CCc1cc(NCCC[C@H]2CCOC2)n2ncnc2n1	ZINC000450888627	CD	On-Demand	Anodyne	DHOD	0	48
Cc1nn(C[C@H]2C[C@H]3CC[C@H]2O3)c2ccc([N+](=O)[O-])cc12	ZINC000450888655	CF	On-Demand	Bother	F2RL3	46	34
Cc1nn(C[C@@H]2C[C@H]3CC[C@H]2O3)c2ccc([N+](=O)[O-])cc12	ZINC000450888656	CF	On-Demand	Bother	F2RL3	46	34
CCOc1cc(N2CCN(C[C@H](O)Cc3ccccc3)CC2)ccc1[N+](=O)[O-]	ZINC000450888688	GF	On-Demand	Bother	VACHT_TETCF	0	47
CCOc1cc(N2CCN(C[C@H](O)Cc3ccccc3)CC2)ccc1[N+](=O)[O-]	ZINC000450888688	GF	On-Demand	Bother	ABCB1	69	44
Cc1ccc(F)c(CC(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1	ZINC000450888689	EG	On-Demand	Anodyne	IMDH_CRYPV	16	41
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	DRD4	38	45
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	DRD3	24	45
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	HTR4	56	38
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	SIGMAR1	32	43
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	SSTR5	85	51
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	CCR3	31	41
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	UTS2R	29	41
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	MCHR1	35	48
CNS(=O)(=O)NC1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450888692	ED	On-Demand	Anodyne	CCR8	23	40
C[C@@](NC(=O)CSC1CC1)(c1ccccc1)C(F)(F)F	ZINC000450888742	DG	On-Demand	Anodyne	AMY2	42	29
C[C@](NC(=O)CSC1CC1)(c1ccccc1)C(F)(F)F	ZINC000450888743	DG	On-Demand	Anodyne	AMY2	42	29
CCC(=O)CCCN1CCC[C@](C)(OC)CC1	ZINC000450888755	BF	On-Demand	Anodyne	EBP	19	40
CCC(=O)CCCN1CCC[C@@](C)(OC)CC1	ZINC000450888756	BF	On-Demand	Anodyne	EBP	19	40
O=C(NCCN(CCN1CCOCC1)C(=O)c1ccsn1)c1ccsn1	ZINC000450888822	GC	On-Demand	Anodyne	CASR	57	41
CCC1(Cc2ccccc2)CCN(C[C@H](O)COCCOC)CC1	ZINC000450888846	EF	On-Demand	Anodyne	ABCB1	51	41
CCC1(Cc2ccccc2)CCN(C[C@H](O)COCCOC)CC1	ZINC000450888846	EF	On-Demand	Anodyne	HSP90AB1	40	41
CCC1(Cc2ccccc2)CCN(C[C@@H](O)COCCOC)CC1	ZINC000450888848	EF	On-Demand	Anodyne	ABCB1	51	41
CCC1(Cc2ccccc2)CCN(C[C@@H](O)COCCOC)CC1	ZINC000450888848	EF	On-Demand	Anodyne	HSP90AB1	40	41
CCn1ccnc(N2CCC(NC(=O)c3cccc(C(F)(F)F)n3)CC2)c1=O	ZINC000450888851	GE	On-Demand	Anodyne	CCR2	19	43
CCn1ccnc(N2CCC(NC(=O)c3cccc(C(F)(F)F)n3)CC2)c1=O	ZINC000450888851	GE	On-Demand	Anodyne	HPGDS	34	40
Cc1ccn2ncc(C(=O)Nc3c(C)c(C(F)(F)F)nn3C)c2c1	ZINC000450888875	EF	On-Demand	Anodyne	EPHB3	24	40
CCS(=O)(=O)c1ccc(CN2CCC[C@](C)(OC)CC2)cc1	ZINC000450888885	EF	On-Demand	Anodyne	ADAM17	23	43
CCS(=O)(=O)c1ccc(CN2CCC[C@](C)(OC)CC2)cc1	ZINC000450888885	EF	On-Demand	Anodyne	MCHR2	47	30
CCS(=O)(=O)c1ccc(CN2CCC[C@@](C)(OC)CC2)cc1	ZINC000450888886	EF	On-Demand	Anodyne	ADAM17	23	43
CCS(=O)(=O)c1ccc(CN2CCC[C@@](C)(OC)CC2)cc1	ZINC000450888886	EF	On-Demand	Anodyne	MCHR2	47	30
COc1ccc(CNC(=O)CCSCc2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000450888900	GH	On-Demand	Bother	U38	0	45
COc1ccc(CNC(=O)CCSCc2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000450888900	GH	On-Demand	Bother	ABHD6	0	44
CCC1(Cc2ccccc2)CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450888910	EH	On-Demand	Anodyne	SIGMAR1	32	41
CCC1(Cc2ccccc2)CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450888910	EH	On-Demand	Anodyne	NPFFR2	23	42
CCC1(Cc2ccccc2)CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450888910	EH	On-Demand	Anodyne	NPFFR1	44	42
CCC1(Cc2ccccc2)CCN(Cc2nc(C(=O)OC)co2)CC1	ZINC000450888910	EH	On-Demand	Anodyne	SLC12A5	42	36
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	HTR1A	17	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	THRA	0	41
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	DRD2	38	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	DRD1	27	53
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	DRD4	26	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	HTR2A	29	59
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	HTR2C	22	58
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	ADRA1A	18	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	ADRA1B	18	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	DRD3	22	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	ERG2	26	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	HTR7	17	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	SIGMAR1	22	56
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	SLC18A3	23	56
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	EBP	28	55
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888911	DH	On-Demand	Anodyne	CYP2J2	53	38
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	HTR1A	17	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	THRA	0	41
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	DRD2	38	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	DRD1	27	53
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	DRD4	26	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	HTR2A	29	59
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	HTR2C	22	58
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	ADRA1A	18	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	ADRA1B	18	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	DRD3	22	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	ERG2	26	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	HTR7	17	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	SIGMAR1	22	56
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	SLC18A3	23	56
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	EBP	28	55
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450888912	DH	On-Demand	Anodyne	CYP2J2	53	38
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1C	ZINC000450888914	CG	On-Demand	Bother	THRA	27	42
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1C	ZINC000450888914	CG	On-Demand	Bother	THRB	0	41
CC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1C	ZINC000450888914	CG	On-Demand	Bother	S1PR4	0	42
Cc1cc([N+](=O)[O-])ccc1OCCC(C)(F)F	ZINC000450888915	BG	On-Demand	Bother	S1PR4	0	46
N#Cc1ccc(N2CCN([C@@H]3CCNC(=O)CC3)CC2)cc1	ZINC000450888920	CD	In-Stock	Mild	ALK	17	42
N#Cc1ccc(N2CCN([C@H]3CCNC(=O)CC3)CC2)cc1	ZINC000450888921	CD	In-Stock	Mild	ALK	17	42
COc1cc(CN2CCC(c3nc(O)n[nH]3)CC2)ccc1Cl	ZINC000450888939	DF	On-Demand	Anodyne	DRD3	0	42
COc1cc(CN2CCC(c3nc(O)n[nH]3)CC2)ccc1Cl	ZINC000450888939	DF	On-Demand	Anodyne	SSTR5	68	41
C[S@@](=O)Cc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450888950	EG	On-Demand	Anodyne	KCNQ2	63	37
C[S@](=O)Cc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450888951	EG	On-Demand	Anodyne	KCNQ2	63	37
C[S@](=O)Cc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450888952	EG	On-Demand	Anodyne	KCNQ2	63	37
C[S@@](=O)Cc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450888953	EG	On-Demand	Anodyne	KCNQ2	63	37
CCCn1c(CO)nnc1SCc1cccc(C(=O)OC)c1Cl	ZINC000450888997	FF	On-Demand	Anodyne	AGTR1	26	49
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C2CC2)O1	ZINC000450889020	DG	On-Demand	Anodyne	DRD2	30	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C2CC2)O1	ZINC000450889020	DG	On-Demand	Anodyne	HTR2A	22	50
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C2CC2)O1	ZINC000450889020	DG	On-Demand	Anodyne	ERG2	30	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C2CC2)O1	ZINC000450889020	DG	On-Demand	Anodyne	CYP2J2	56	40
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C2CC2)O1	ZINC000450889021	DG	On-Demand	Anodyne	DRD2	30	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C2CC2)O1	ZINC000450889021	DG	On-Demand	Anodyne	HTR2A	22	50
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C2CC2)O1	ZINC000450889021	DG	On-Demand	Anodyne	ERG2	30	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C2CC2)O1	ZINC000450889021	DG	On-Demand	Anodyne	CYP2J2	56	40
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C2CC2)O1	ZINC000450889022	DG	On-Demand	Anodyne	DRD2	30	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C2CC2)O1	ZINC000450889022	DG	On-Demand	Anodyne	HTR2A	22	50
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C2CC2)O1	ZINC000450889022	DG	On-Demand	Anodyne	ERG2	30	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C2CC2)O1	ZINC000450889022	DG	On-Demand	Anodyne	CYP2J2	56	40
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C2CC2)O1	ZINC000450889023	DG	On-Demand	Anodyne	DRD2	30	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C2CC2)O1	ZINC000450889023	DG	On-Demand	Anodyne	HTR2A	22	50
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C2CC2)O1	ZINC000450889023	DG	On-Demand	Anodyne	ERG2	30	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C2CC2)O1	ZINC000450889023	DG	On-Demand	Anodyne	CYP2J2	56	40
Cc1cc(Br)c(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450889085	GI	On-Demand	Anodyne	HDAC1	35	42
CCS(=O)(=O)c1ccc(CSCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000450889099	FH	On-Demand	Bother	SLC29A1	49	40
Cc1cc(Br)c(NC(=O)CS(=O)(=O)C2CC2)cc1Cl	ZINC000450889112	FF	On-Demand	Anodyne	CA1	15	40
Cc1cc(Br)c(NC(=O)CS(=O)(=O)C2CC2)cc1Cl	ZINC000450889112	FF	On-Demand	Anodyne	CA4	21	40
Cc1cc(Br)c(NC(=O)[C@H]2CCC(=O)N2C)cc1Cl	ZINC000450889113	EF	On-Demand	Anodyne	P2RX7	30	53
Cc1cc(Br)c(NC(=O)[C@@H]2CCC(=O)N2C)cc1Cl	ZINC000450889114	EF	On-Demand	Anodyne	P2RX7	30	53
O=C1CC[C@@H](N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)CCN1	ZINC000450889126	GF	On-Demand	Anodyne	CXCR3	15	46
O=C1CC[C@H](N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)CCN1	ZINC000450889127	GF	On-Demand	Anodyne	CXCR3	15	46
CC(C)c1nnc(CN2CCC(c3cccc(Cl)c3)CC2)s1	ZINC000450889144	EJ	On-Demand	Anodyne	MCHR1	23	43
Cc1nn(Cc2nnc(C3CC3)s2)c2ccc([N+](=O)[O-])cc12	ZINC000450889189	DG	On-Demand	Bother	F2RL3	44	31
Cc1n[nH]cc1C(=O)NCCN(CCN1CCOCC1)C(=O)c1c[nH]nc1C	ZINC000450889207	GB	On-Demand	Anodyne	CASR	54	39
COc1ccc(CNC(=O)CCN2CC[C@H](C(F)(F)F)[C@H]2C)c(OC)c1	ZINC000450889214	FF	On-Demand	Anodyne	MTNR1A	41	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C(F)(F)F)[C@H]2C)c(OC)c1	ZINC000450889215	FF	On-Demand	Anodyne	MTNR1A	41	36
COc1ccc(CNC(=O)CCN2CC[C@@H](C(F)(F)F)[C@@H]2C)c(OC)c1	ZINC000450889216	FF	On-Demand	Anodyne	MTNR1A	41	36
COc1ccc(CNC(=O)CCN2CC[C@H](C(F)(F)F)[C@@H]2C)c(OC)c1	ZINC000450889217	FF	On-Demand	Anodyne	MTNR1A	41	36
COc1ccc(-c2ccnc(NCCC[C@H]3CCOC3)n2)cc1	ZINC000450889228	DF	On-Demand	Anodyne	CLK4	27	51
COc1ccc(-c2ccnc(NCCC[C@H]3CCOC3)n2)cc1	ZINC000450889228	DF	On-Demand	Anodyne	DYRK1B	16	51
COc1ccc(-c2ccnc(NCCC[C@@H]3CCOC3)n2)cc1	ZINC000450889229	DF	On-Demand	Anodyne	CLK4	27	51
COc1ccc(-c2ccnc(NCCC[C@@H]3CCOC3)n2)cc1	ZINC000450889229	DF	On-Demand	Anodyne	DYRK1B	16	51
Cc1nn(CC[C@@H](C)O)c2ccc([N+](=O)[O-])cc12	ZINC000450889248	BE	On-Demand	Bother	F2RL3	53	40
Cc1nn(CC[C@H](C)O)c2ccc([N+](=O)[O-])cc12	ZINC000450889249	BE	On-Demand	Bother	F2RL3	53	40
OC[C@@H](CNc1ncnc2[nH]ccc12)Cc1ccc(F)c(Br)c1	ZINC000450889250	GF	On-Demand	Anodyne	AKT1	43	35
OC[C@H](CNc1ncnc2[nH]ccc12)Cc1ccc(F)c(Br)c1	ZINC000450889251	GF	On-Demand	Anodyne	AKT1	43	35
OC[C@H](NCc1ccccc1OC1CC1)c1ccccc1OC(F)(F)F	ZINC000450889268	FH	On-Demand	Anodyne	SLC5A4	45	33
OC[C@@H](NCc1ccccc1OC1CC1)c1ccccc1OC(F)(F)F	ZINC000450889269	FH	On-Demand	Anodyne	SLC5A4	45	33
CC(=O)c1ccc(OCCC[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000450889316	CE	On-Demand	Bother	THRA	0	49
CC(=O)c1ccc(OCCC[C@H](C)O)c([N+](=O)[O-])c1	ZINC000450889317	CE	On-Demand	Bother	THRA	0	49
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(c2nccn(C)c2=O)C1	ZINC000450889325	GF	On-Demand	Anodyne	CCR2	46	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(c2nccn(C)c2=O)C1	ZINC000450889325	GF	On-Demand	Anodyne	LIPG	48	32
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(c2nccn(C)c2=O)C1	ZINC000450889326	GF	On-Demand	Anodyne	CCR2	46	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(c2nccn(C)c2=O)C1	ZINC000450889326	GF	On-Demand	Anodyne	LIPG	48	32
CO[C@@]1(C)CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450889379	CF	On-Demand	Anodyne	SLC12A5	45	32
CO[C@]1(C)CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450889380	CF	On-Demand	Anodyne	SLC12A5	45	32
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450889383	EG	On-Demand	Anodyne	RBP4	42	34
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450889384	EG	On-Demand	Anodyne	RBP4	42	34
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450889385	EG	On-Demand	Anodyne	RBP4	42	34
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450889386	EG	On-Demand	Anodyne	RBP4	42	34
N#C[C@@H](c1cccc(Cl)c1)N1CCN(Cc2cccnc2N)CC1	ZINC000450889416	EF	On-Demand	Mild	PTAFR	42	39
N#C[C@H](c1cccc(Cl)c1)N1CCN(Cc2cccnc2N)CC1	ZINC000450889417	EF	On-Demand	Mild	PTAFR	42	39
COc1ccc(CNC(=O)CCN2CCC[C@](C)(OC)C2)c(OC)c1	ZINC000450889434	FE	On-Demand	Anodyne	MTNR1A	46	42
COc1ccc(CNC(=O)CCN2CCC[C@](C)(OC)C2)c(OC)c1	ZINC000450889434	FE	On-Demand	Anodyne	MTNR1B	40	42
COc1ccc(CNC(=O)CCN2CCC[C@](C)(OC)C2)c(OC)c1	ZINC000450889434	FE	On-Demand	Anodyne	EBP	32	43
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(OC)C2)c(OC)c1	ZINC000450889435	FE	On-Demand	Anodyne	MTNR1A	46	42
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(OC)C2)c(OC)c1	ZINC000450889435	FE	On-Demand	Anodyne	MTNR1B	40	42
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(OC)C2)c(OC)c1	ZINC000450889435	FE	On-Demand	Anodyne	EBP	32	43
Cc1nn(C)cc1Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000450889436	CE	On-Demand	Bother	F2RL3	52	37
COC(=O)c1nc([C@@H]2CCCN2CCCC(=O)c2ccccc2)sc1C	ZINC000450889444	FI	On-Demand	Anodyne	SLC6A1	60	33
COC(=O)c1nc([C@@H]2CCCN2CCCC(=O)c2ccccc2)sc1C	ZINC000450889444	FI	On-Demand	Anodyne	CYP2J2	49	36
COC(=O)c1nc([C@H]2CCCN2CCCC(=O)c2ccccc2)sc1C	ZINC000450889445	FI	On-Demand	Anodyne	SLC6A1	60	33
COC(=O)c1nc([C@H]2CCCN2CCCC(=O)c2ccccc2)sc1C	ZINC000450889445	FI	On-Demand	Anodyne	CYP2J2	49	36
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1Cl	ZINC000450889468	GI	On-Demand	Anodyne	DRD4	27	43
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1Cl	ZINC000450889468	GI	On-Demand	Anodyne	CHRM3	15	45
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1Cl	ZINC000450889468	GI	On-Demand	Anodyne	UTS2R	22	41
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1Cl	ZINC000450889468	GI	On-Demand	Anodyne	MCHR2	46	34
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1Cl	ZINC000450889468	GI	On-Demand	Anodyne	CACNA1G	22	40
COC(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1Cl	ZINC000450889468	GI	On-Demand	Anodyne	NPFFR1	45	39
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCCN(c3ncc[nH]c3=O)C2)cn1	ZINC000450889470	FD	On-Demand	Anodyne	HPGDS	35	42
CC(F)(F)c1ccc(C(=O)N[C@H]2CCCN(c3ncc[nH]c3=O)C2)cn1	ZINC000450889472	FD	On-Demand	Anodyne	HPGDS	35	42
C[C@@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(Br)cc1)CCO2	ZINC000450889528	GG	On-Demand	Anodyne	CYP2J2	52	37
C[C@H]1OCC[C@]12CN(CCCC(=O)c1ccc(Br)cc1)CCO2	ZINC000450889529	GG	On-Demand	Anodyne	CYP2J2	52	37
C[C@@H]1OCC[C@]12CN(CCCC(=O)c1ccc(Br)cc1)CCO2	ZINC000450889530	GG	On-Demand	Anodyne	CYP2J2	52	37
C[C@H]1OCC[C@@]12CN(CCCC(=O)c1ccc(Br)cc1)CCO2	ZINC000450889531	GG	On-Demand	Anodyne	CYP2J2	52	37
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccccc3)CCO2)o1	ZINC000450889627	EG	On-Demand	Anodyne	CYP2J2	58	41
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccccc3)CCO2)o1	ZINC000450889628	EG	On-Demand	Anodyne	CYP2J2	58	41
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889645	FI	On-Demand	Anodyne	OPRM1	0	44
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889645	FI	On-Demand	Anodyne	OPRL1	44	43
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889645	FI	On-Demand	Anodyne	CCR5	26	55
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889645	FI	On-Demand	Anodyne	PLD1	55	38
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889645	FI	On-Demand	Anodyne	USP1	0	44
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889646	FI	On-Demand	Anodyne	OPRM1	0	44
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889646	FI	On-Demand	Anodyne	OPRL1	44	43
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889646	FI	On-Demand	Anodyne	CCR5	26	55
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889646	FI	On-Demand	Anodyne	PLD1	55	38
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889646	FI	On-Demand	Anodyne	USP1	0	44
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889647	FI	On-Demand	Anodyne	OPRM1	0	44
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889647	FI	On-Demand	Anodyne	OPRL1	44	43
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889647	FI	On-Demand	Anodyne	CCR5	26	55
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889647	FI	On-Demand	Anodyne	PLD1	55	38
Cc1nc2ccccc2n1C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450889647	FI	On-Demand	Anodyne	USP1	0	44
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889648	FI	On-Demand	Anodyne	OPRM1	0	44
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889648	FI	On-Demand	Anodyne	OPRL1	44	43
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889648	FI	On-Demand	Anodyne	CCR5	26	55
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889648	FI	On-Demand	Anodyne	PLD1	55	38
Cc1nc2ccccc2n1C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450889648	FI	On-Demand	Anodyne	USP1	0	44
C[C@H](CN1CCC(c2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450889651	DF	On-Demand	Anodyne	MDM2	81	35
C[C@@H](CN1CCC(c2cccc(Cl)c2)CC1)S(C)(=O)=O	ZINC000450889652	DF	On-Demand	Anodyne	MDM2	81	35
O=C(c1ccc(NCCC[C@H]2CCOC2)nc1)N1CCc2ccccc21	ZINC000450889660	FF	On-Demand	Anodyne	AVPR2	48	35
O=C(c1ccc(NCCC[C@@H]2CCOC2)nc1)N1CCc2ccccc21	ZINC000450889661	FF	On-Demand	Anodyne	AVPR2	48	35
Cc1ccc(F)c(Cn2cnc3c(cnn3C(C)C)c2=O)c1	ZINC000450889668	DF	On-Demand	Anodyne	Q9M629_MAIZE	52	31
COc1ccc(Br)cc1C[C@@H](CO)CNc1cnc(C#N)cn1	ZINC000450889674	GE	On-Demand	Mild	CHEK1	15	41
COc1ccc(Br)cc1C[C@H](CO)CNc1cnc(C#N)cn1	ZINC000450889675	GE	On-Demand	Mild	CHEK1	15	41
O[C@H]1C[C@@H](c2ccccc2C(F)(F)F)N(C[C@H](O)Cc2ccccc2)C1	ZINC000450889685	FG	On-Demand	Anodyne	RBP4	52	36
O[C@H](Cc1ccccc1)CN1C[C@H](O)C[C@@H]1c1ccccc1C(F)(F)F	ZINC000450889686	FG	On-Demand	Anodyne	RBP4	52	36
O[C@H]1C[C@H](c2ccccc2C(F)(F)F)N(C[C@H](O)Cc2ccccc2)C1	ZINC000450889687	FG	On-Demand	Anodyne	RBP4	52	36
O[C@H](Cc1ccccc1)CN1C[C@H](O)C[C@H]1c1ccccc1C(F)(F)F	ZINC000450889688	FG	On-Demand	Anodyne	RBP4	52	36
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(C[C@@H]2COCCO2)C1	ZINC000450889723	EE	On-Demand	Anodyne	RBP4	41	34
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(C[C@@H]2COCCO2)C1	ZINC000450889724	EE	On-Demand	Anodyne	RBP4	41	34
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(C[C@H]2COCCO2)C1	ZINC000450889725	EE	On-Demand	Anodyne	RBP4	41	34
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(C[C@H]2COCCO2)C1	ZINC000450889726	EE	On-Demand	Anodyne	RBP4	41	34
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncc(C)c(C)n1	ZINC000450889730	GG	On-Demand	Anodyne	P2RX2	42	41
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncc(C)c(C)n1	ZINC000450889730	GG	On-Demand	Anodyne	P2RX3	39	41
COc1ccc(Br)cc1C[C@H](CO)CNc1ncc(C)c(C)n1	ZINC000450889731	GG	On-Demand	Anodyne	P2RX2	42	41
COc1ccc(Br)cc1C[C@H](CO)CNc1ncc(C)c(C)n1	ZINC000450889731	GG	On-Demand	Anodyne	P2RX3	39	41
CCS(=O)(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450889743	GG	On-Demand	Anodyne	ACHE	15	42
CCS(=O)(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450889743	GG	On-Demand	Anodyne	SIGMAR1	53	48
CCS(=O)(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450889743	GG	On-Demand	Anodyne	RORC	44	41
O=C(CCCN1CCOCc2ccccc21)c1ccc(F)cc1	ZINC000450889744	DH	On-Demand	Anodyne	DRD2	34	44
O=C(CCCN1CCOCc2ccccc21)c1ccc(F)cc1	ZINC000450889744	DH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCOCc2ccccc21)c1ccc(F)cc1	ZINC000450889744	DH	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CCOCc2ccccc21)c1ccc(F)cc1	ZINC000450889744	DH	On-Demand	Anodyne	CYP2J2	50	35
C[C@H](O)CCN1C[C@@H](O)C[C@@H]1c1ccccc1C(F)(F)F	ZINC000450889750	DF	On-Demand	Anodyne	RBP4	57	39
C[C@H](O)CCN1C[C@H](O)C[C@@H]1c1ccccc1C(F)(F)F	ZINC000450889751	DF	On-Demand	Anodyne	RBP4	57	39
C[C@H](O)CCN1C[C@@H](O)C[C@H]1c1ccccc1C(F)(F)F	ZINC000450889752	DF	On-Demand	Anodyne	RBP4	57	39
C[C@H](O)CCN1C[C@H](O)C[C@H]1c1ccccc1C(F)(F)F	ZINC000450889753	DF	On-Demand	Anodyne	RBP4	57	39
CNS(=O)(=O)NCC(=O)Nc1cc(Cl)c(C)cc1Br	ZINC000450889782	FD	On-Demand	Anodyne	CA2	15	48
CNS(=O)(=O)NCC(=O)Nc1cc(Cl)c(C)cc1Br	ZINC000450889782	FD	On-Demand	Anodyne	CA1	22	48
CNS(=O)(=O)NCC(=O)Nc1cc(Cl)c(C)cc1Br	ZINC000450889782	FD	On-Demand	Anodyne	CA4	28	48
COc1cc(C(C)=O)ccc1S[C@H](C)C(=O)C1CCCCC1	ZINC000450889806	DJ	On-Demand	Anodyne	STK17B	40	34
COc1cc(C(C)=O)ccc1S[C@@H](C)C(=O)C1CCCCC1	ZINC000450889807	DJ	On-Demand	Anodyne	STK17B	40	34
CNS(=O)(=O)NC1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450889826	FE	On-Demand	Anodyne	SIGMAR1	16	42
Cc1cc(Br)c(NC(=O)c2cc3n(n2)CCCC3)cc1Cl	ZINC000450889852	FI	On-Demand	Anodyne	CNR1	52	32
COC(=O)c1coc(CN2C[C@@H](O)C[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450889875	FF	On-Demand	Anodyne	RBP4	54	35
COC(=O)c1coc(CN2C[C@@H](O)C[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450889876	FF	On-Demand	Anodyne	RBP4	54	35
COC(=O)c1coc(CN2C[C@H](O)C[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450889877	FF	On-Demand	Anodyne	RBP4	54	35
COC(=O)c1coc(CN2C[C@H](O)C[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450889878	FF	On-Demand	Anodyne	RBP4	54	35
CO[C@@]1(C)CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450889886	CF	On-Demand	Anodyne	SIGMAR1	30	42
CO[C@@]1(C)CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450889886	CF	On-Demand	Anodyne	SLC12A5	55	34
CO[C@]1(C)CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450889887	CF	On-Demand	Anodyne	SIGMAR1	30	42
CO[C@]1(C)CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450889887	CF	On-Demand	Anodyne	SLC12A5	55	34
Cc1nn(C[C@H]2CCCCC2(F)F)c2ccc([N+](=O)[O-])cc12	ZINC000450889893	DI	On-Demand	Bother	F2RL3	44	33
Cc1nn(C[C@@H]2CCCCC2(F)F)c2ccc([N+](=O)[O-])cc12	ZINC000450889894	DI	On-Demand	Bother	F2RL3	44	33
CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC1CCC1	ZINC000450889968	EF	On-Demand	Anodyne	MTR1B_CHICK	0	40
CCN(CCC(=O)NCc1ccc(OC)cc1OC)CC1CCC1	ZINC000450889968	EF	On-Demand	Anodyne	MTNR1A	51	36
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450890003	FE	On-Demand	Anodyne	ACACB	23	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1nc2ccccc2nc1C1CC1	ZINC000450890006	FE	On-Demand	Anodyne	ACACB	23	40
CCCn1c(CO)nnc1SCCc1ccc(Cl)cc1	ZINC000450890010	DG	On-Demand	Anodyne	AGTR1	20	44
Cc1ccc(Br)cc1CC(=O)Nc1c(C)c(C(F)(F)F)nn1C	ZINC000450890039	GH	On-Demand	Anodyne	IMDH_CRYPV	19	40
CC(=O)c1ccc(OCC[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000450890065	CD	On-Demand	Bother	S1PR4	15	41
CC(=O)c1ccc(OCC[C@H](C)O)c([N+](=O)[O-])c1	ZINC000450890066	CD	On-Demand	Bother	S1PR4	15	41
O=[N+]([O-])c1cc2ccccc2nc1NCCC[C@@H]1CCOC1	ZINC000450890072	DF	On-Demand	Bother	PRKCQ	43	36
O=[N+]([O-])c1cc2ccccc2nc1NCCC[C@H]1CCOC1	ZINC000450890074	DF	On-Demand	Bother	PRKCQ	43	36
N#Cc1cc(N2CCN([C@@H]3CCNC(=O)CC3)CC2)ccc1C(F)(F)F	ZINC000450890129	FE	On-Demand	Mild	AR	15	43
N#Cc1cc(N2CCN([C@H]3CCNC(=O)CC3)CC2)ccc1C(F)(F)F	ZINC000450890134	FE	On-Demand	Mild	AR	15	43
CC(=O)c1ccc(F)cc1OCCC[C@@H](C)O	ZINC000450890143	BF	On-Demand	Anodyne	FOLH1	16	41
CC(=O)c1ccc(F)cc1OCCC[C@@H](C)O	ZINC000450890143	BF	On-Demand	Anodyne	GRM2	19	41
CC(=O)c1ccc(F)cc1OCCC[C@H](C)O	ZINC000450890144	BF	On-Demand	Anodyne	FOLH1	16	41
CC(=O)c1ccc(F)cc1OCCC[C@H](C)O	ZINC000450890144	BF	On-Demand	Anodyne	GRM2	19	41
COC(=O)c1nc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)sc1C	ZINC000450890147	GI	On-Demand	Anodyne	HTR2A	15	40
COC(=O)c1nc([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)sc1C	ZINC000450890147	GI	On-Demand	Anodyne	HTR3B	0	40
COC(=O)c1nc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)sc1C	ZINC000450890157	GI	On-Demand	Anodyne	HTR2A	15	40
COC(=O)c1nc([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)sc1C	ZINC000450890157	GI	On-Demand	Anodyne	HTR3B	0	40
COC(=O)c1csc(CN2C[C@@H](O)C[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450890171	GG	On-Demand	Anodyne	RBP4	63	34
COC(=O)c1csc(CN2C[C@@H](O)C[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450890172	GG	On-Demand	Anodyne	RBP4	63	34
COC(=O)c1csc(CN2C[C@H](O)C[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000450890173	GG	On-Demand	Anodyne	RBP4	63	34
COC(=O)c1csc(CN2C[C@H](O)C[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000450890174	GG	On-Demand	Anodyne	RBP4	63	34
CCOC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2ccccc2C(F)(F)F)nc1	ZINC000450890187	GH	On-Demand	Anodyne	CACNA1C	15	41
CCOC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2ccccc2C(F)(F)F)nc1	ZINC000450890187	GH	On-Demand	Anodyne	RBP4	54	34
CCOC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2ccccc2C(F)(F)F)nc1	ZINC000450890188	GH	On-Demand	Anodyne	CACNA1C	15	41
CCOC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2ccccc2C(F)(F)F)nc1	ZINC000450890188	GH	On-Demand	Anodyne	RBP4	54	34
CCOC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2ccccc2C(F)(F)F)nc1	ZINC000450890189	GH	On-Demand	Anodyne	CACNA1C	15	41
CCOC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2ccccc2C(F)(F)F)nc1	ZINC000450890189	GH	On-Demand	Anodyne	RBP4	54	34
CCOC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2ccccc2C(F)(F)F)nc1	ZINC000450890190	GH	On-Demand	Anodyne	CACNA1C	15	41
CCOC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2ccccc2C(F)(F)F)nc1	ZINC000450890190	GH	On-Demand	Anodyne	RBP4	54	34
C[C@H](O)CCN1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1	ZINC000450890209	CD	On-Demand	Anodyne	SLC6A4	15	47
C[C@H](O)CCN1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1	ZINC000450890209	CD	On-Demand	Anodyne	SLC6A3	18	47
C[C@H](O)CCN1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1	ZINC000450890209	CD	On-Demand	Anodyne	SIGMAR1	58	44
C[C@@H](O)CCN1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1	ZINC000450890210	CD	On-Demand	Anodyne	SLC6A4	15	47
C[C@@H](O)CCN1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1	ZINC000450890210	CD	On-Demand	Anodyne	SLC6A3	18	47
C[C@@H](O)CCN1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1	ZINC000450890210	CD	On-Demand	Anodyne	SIGMAR1	58	44
COC(=O)C1(CN2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)CC1	ZINC000450890231	EE	On-Demand	Mild	PTAFR	40	40
COC(=O)C1(CN2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)CC1	ZINC000450890232	EE	On-Demand	Mild	PTAFR	40	40
COc1ccc(Br)cc1C[C@H](CO)CNc1ncc(F)cn1	ZINC000450890240	FE	On-Demand	Anodyne	P2RX2	42	41
COc1ccc(Br)cc1C[C@H](CO)CNc1ncc(F)cn1	ZINC000450890240	FE	On-Demand	Anodyne	P2RX3	39	41
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncc(F)cn1	ZINC000450890241	FE	On-Demand	Anodyne	P2RX2	42	41
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncc(F)cn1	ZINC000450890241	FE	On-Demand	Anodyne	P2RX3	39	41
N#C[C@H](c1cccc(Cl)c1)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450890244	FG	On-Demand	Mild	PTAFR	35	44
N#C[C@H](c1cccc(Cl)c1)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450890244	FG	On-Demand	Mild	VACHT_TETCF	0	45
N#C[C@@H](c1cccc(Cl)c1)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450890245	FG	On-Demand	Mild	PTAFR	35	44
N#C[C@@H](c1cccc(Cl)c1)N1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450890245	FG	On-Demand	Mild	VACHT_TETCF	0	45
O=[N+]([O-])c1ccc(CSCC[C@H]2CCOC2)cc1	ZINC000450890278	CG	On-Demand	Bother	KCNJ1	17	40
O=[N+]([O-])c1ccc(CSCC[C@@H]2CCOC2)cc1	ZINC000450890279	CG	On-Demand	Bother	KCNJ1	17	40
Cc1nc2ccccc2n1C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450890293	GJ	On-Demand	Anodyne	DRD4	28	42
Cc1nc2ccccc2n1C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450890293	GJ	On-Demand	Anodyne	CCR5	15	45
Cc1nc2ccccc2n1C1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450890293	GJ	On-Demand	Anodyne	AKT2	25	46
COC[C@@]1(CO)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450890319	FG	On-Demand	Anodyne	ADRB2	18	49
COC[C@@]1(CO)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450890319	FG	On-Demand	Anodyne	ADRB3	33	50
COC[C@]1(CO)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450890320	FG	On-Demand	Anodyne	ADRB2	18	49
COC[C@]1(CO)CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450890320	FG	On-Demand	Anodyne	ADRB3	33	50
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nccn1C	ZINC000450890341	EF	On-Demand	Anodyne	DRD2	29	42
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nccn1C	ZINC000450890341	EF	On-Demand	Anodyne	DRD1	0	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nccn1C	ZINC000450890341	EF	On-Demand	Anodyne	DRD4	0	44
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nccn1C	ZINC000450890341	EF	On-Demand	Anodyne	HTR2A	25	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nccn1C	ZINC000450890341	EF	On-Demand	Anodyne	SLC18A3	0	42
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nccn1C	ZINC000450890341	EF	On-Demand	Anodyne	HTR3B	0	44
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nccn1C	ZINC000450890341	EF	On-Demand	Anodyne	CYP2J2	49	35
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nccn1C	ZINC000450890341	EF	On-Demand	Anodyne	AP2S1	0	42
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nccn1C	ZINC000450890342	EF	On-Demand	Anodyne	DRD2	29	42
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nccn1C	ZINC000450890342	EF	On-Demand	Anodyne	DRD1	0	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nccn1C	ZINC000450890342	EF	On-Demand	Anodyne	DRD4	0	44
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nccn1C	ZINC000450890342	EF	On-Demand	Anodyne	HTR2A	25	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nccn1C	ZINC000450890342	EF	On-Demand	Anodyne	SLC18A3	0	42
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nccn1C	ZINC000450890342	EF	On-Demand	Anodyne	HTR3B	0	44
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nccn1C	ZINC000450890342	EF	On-Demand	Anodyne	CYP2J2	49	35
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nccn1C	ZINC000450890342	EF	On-Demand	Anodyne	AP2S1	0	42
CC(C)OC(=O)c1cccnc1N1CCN([C@@H]2CCNC(=O)CC2)CC1	ZINC000450890354	FD	On-Demand	Anodyne	ADRA1D	15	40
CC(C)OC(=O)c1cccnc1N1CCN([C@H]2CCNC(=O)CC2)CC1	ZINC000450890355	FD	On-Demand	Anodyne	ADRA1D	15	40
CCOC(=O)c1ccc(CN2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)nc1	ZINC000450890360	GG	On-Demand	Mild	P2RY12	35	42
CCOC(=O)c1ccc(CN2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)nc1	ZINC000450890360	GG	On-Demand	Mild	PTAFR	43	38
CCOC(=O)c1ccc(CN2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)nc1	ZINC000450890361	GG	On-Demand	Mild	P2RY12	35	42
CCOC(=O)c1ccc(CN2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)nc1	ZINC000450890361	GG	On-Demand	Mild	PTAFR	43	38
CC1CCN(C(=O)c2ccc(=NCCC[C@H]3CCOC3)[nH]c2)CC1	ZINC000450890375	EF	On-Demand	Anodyne	L3MBTL3	41	32
CC1CCN(C(=O)c2ccc(=NCCC[C@@H]3CCOC3)[nH]c2)CC1	ZINC000450890376	EF	On-Demand	Anodyne	L3MBTL3	41	32
c1ccc(CN2C[C@@H]3CN(CCc4cscn4)C[C@@H]3C2)cc1	ZINC000450890385	DF	On-Demand	Anodyne	SCN5A	38	40
CC(C)n1ncc2c(=O)n(CCC(C)(F)F)cnc21	ZINC000450890402	CE	On-Demand	Anodyne	Q9M629_MAIZE	54	32
CC(=O)CCCCCOc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450890476	CG	On-Demand	Bother	THRA	33	58
CC(=O)CCCCCOc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450890476	CG	On-Demand	Bother	THRB	0	58
CC(=O)CCCCCOc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450890476	CG	On-Demand	Bother	S1PR4	0	41
COc1cc(CN2CCN(C)[C@H](c3nccn3C)C2)ccc1Cl	ZINC000450890481	EF	On-Demand	Anodyne	SSTR5	40	35
COc1cc(CN2CCN(C)[C@@H](c3nccn3C)C2)ccc1Cl	ZINC000450890482	EF	On-Demand	Anodyne	SSTR5	40	35
COC(=O)c1coc(CN2CCC(n3c(C)nc4ccccc43)CC2)n1	ZINC000450890489	FF	On-Demand	Anodyne	CCR5	21	43
COC(=O)c1coc(CN2CCC(n3c(C)nc4ccccc43)CC2)n1	ZINC000450890489	FF	On-Demand	Anodyne	AKT2	15	40
COc1cc(CN2CCC[C@](C)(OC)CC2)ccc1Cl	ZINC000450890509	CH	On-Demand	Anodyne	SSTR5	42	38
COc1cc(CN2CCC[C@](C)(OC)CC2)ccc1Cl	ZINC000450890509	CH	On-Demand	Anodyne	MCHR2	42	32
COc1cc(CN2CCC[C@@](C)(OC)CC2)ccc1Cl	ZINC000450890510	CH	On-Demand	Anodyne	SSTR5	42	38
COc1cc(CN2CCC[C@@](C)(OC)CC2)ccc1Cl	ZINC000450890510	CH	On-Demand	Anodyne	MCHR2	42	32
COc1ccc(CN(CCc2ccccn2)CC[C@H](C)O)cc1	ZINC000450890547	DF	On-Demand	Anodyne	GRIN1	22	41
COc1ccc(CN(CCc2ccccn2)CC[C@@H](C)O)cc1	ZINC000450890548	DF	On-Demand	Anodyne	GRIN1	22	41
CCn1ccnc(N2CCC(NC(=O)c3cncc(Cl)c3)CC2)c1=O	ZINC000450890549	FD	On-Demand	Anodyne	SSTR5	48	49
O=C1CC[C@H](CN2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)CCN1	ZINC000450890615	ED	On-Demand	Anodyne	SIGMAR1	36	41
O=C1CC[C@@H](CN2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)CCN1	ZINC000450890616	ED	On-Demand	Anodyne	SIGMAR1	36	41
O=C(c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450890648	FE	On-Demand	Bother	L3MBTL1	0	42
O=C(c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450890649	FE	On-Demand	Bother	L3MBTL1	0	42
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	DRD2	0	44
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	DRD4	46	44
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	ACHE	30	53
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	DRD3	27	42
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	LTA4H	24	40
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	HRH3	0	41
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	POL	0	41
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	CYP2J2	44	32
CC(=O)c1ccc(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000450890650	EG	On-Demand	Anodyne	NOD2	43	37
COc1cc(OC)c2ncc(C#N)c(NCCC[C@@H]3CCOC3)c2c1	ZINC000450890659	EG	On-Demand	Mild	SRC	52	37
COc1cc(OC)c2ncc(C#N)c(NCCC[C@H]3CCOC3)c2c1	ZINC000450890660	EG	On-Demand	Mild	SRC	52	37
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450890661	GH	On-Demand	Anodyne	RBP4	40	34
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450890662	GH	On-Demand	Anodyne	RBP4	40	34
O[C@H]1C[C@H](c2ccccc2C(F)(F)F)N(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450890663	GH	On-Demand	Anodyne	RBP4	40	34
O[C@H]1C[C@@H](c2ccccc2C(F)(F)F)N(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450890664	GH	On-Demand	Anodyne	RBP4	40	34
Fc1ccc2c(NCCC[C@@H]3CCOC3)ccnc2c1	ZINC000450890685	CH	On-Demand	Anodyne	HRP1_PLAFA	101	37
Fc1ccc2c(NCCC[C@H]3CCOC3)ccnc2c1	ZINC000450890686	CH	On-Demand	Anodyne	HRP1_PLAFA	101	37
CCOC(=O)c1ccc(CN(C)Cc2ccccc2SC)nc1	ZINC000450890696	EH	On-Demand	Anodyne	CACNA1C	15	40
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	DRD2	31	43
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	DRD1	15	47
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	HTR2A	25	47
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	HTR2C	18	53
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	ERG2	21	43
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	HTR3B	0	43
C[C@@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890703	DI	On-Demand	Anodyne	CYP2J2	56	39
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	DRD2	31	43
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	DRD1	15	47
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	DRD4	0	46
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	HTR2A	25	47
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	HTR2C	18	53
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	ERG2	21	43
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890704	DI	On-Demand	Anodyne	CYP2J2	56	39
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	DRD2	31	43
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	DRD1	15	47
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	HTR2A	25	47
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	HTR2C	18	53
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	ERG2	21	43
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	SLC18A3	0	43
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	HTR3B	0	43
C[C@@H]1[C@@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890705	DI	On-Demand	Anodyne	CYP2J2	56	39
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	DRD2	31	43
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	DRD1	15	47
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	DRD4	0	46
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	HTR2A	25	47
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	HTR2C	18	53
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	ERG2	21	43
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	SLC18A3	0	43
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1[C@H](C(F)(F)F)CCN1CCCC(=O)c1ccc(F)cc1	ZINC000450890706	DI	On-Demand	Anodyne	CYP2J2	56	39
CC(F)(F)CCOc1ccc(C#N)cc1F	ZINC000450890707	BG	On-Demand	Mild	AR	16	42
Cn1ncc2c(NCCC[C@@H]3CCOC3)ccnc21	ZINC000450890708	CE	On-Demand	Anodyne	HNMT	41	31
Cn1ncc2c(NCCC[C@H]3CCOC3)ccnc21	ZINC000450890709	CE	On-Demand	Anodyne	HNMT	41	31
CCOC(=O)c1ccc(CN2CCC[C@](C)(O)CC2)nc1	ZINC000450890725	CD	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)c1ccc(CN2CCC[C@@](C)(O)CC2)nc1	ZINC000450890726	CD	On-Demand	Anodyne	SSTR5	43	36
O=C(CCCN1C[C@H](O)C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1	ZINC000450890738	GI	On-Demand	Anodyne	RBP4	75	39
O=C(CCCN1C[C@H](O)C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1	ZINC000450890738	GI	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1	ZINC000450890739	GI	On-Demand	Anodyne	RBP4	75	39
O=C(CCCN1C[C@@H](O)C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1	ZINC000450890739	GI	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1	ZINC000450890740	GI	On-Demand	Anodyne	RBP4	75	39
O=C(CCCN1C[C@@H](O)C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1	ZINC000450890740	GI	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1	ZINC000450890741	GI	On-Demand	Anodyne	RBP4	75	39
O=C(CCCN1C[C@H](O)C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1	ZINC000450890741	GI	On-Demand	Anodyne	CYP2J2	49	34
CC(=O)CCCCCn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000450890748	CG	On-Demand	Bother	F2RL3	51	38
COc1cc2c(NCCC[C@@H]3CCOC3)ccnc2cc1F	ZINC000450890751	DH	On-Demand	Anodyne	HRP1_PLAFA	105	39
COc1cc2c(NCCC[C@@H]3CCOC3)ccnc2cc1F	ZINC000450890751	DH	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(NCCC[C@@H]3CCOC3)ccnc2cc1F	ZINC000450890751	DH	On-Demand	Anodyne	FLT1	23	40
COc1cc2c(NCCC[C@@H]3CCOC3)ccnc2cc1F	ZINC000450890751	DH	On-Demand	Anodyne	HNMT	45	35
COc1cc2c(NCCC[C@H]3CCOC3)ccnc2cc1F	ZINC000450890752	DH	On-Demand	Anodyne	HRP1_PLAFA	89	34
COc1cc2c(NCCC[C@H]3CCOC3)ccnc2cc1F	ZINC000450890752	DH	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(NCCC[C@H]3CCOC3)ccnc2cc1F	ZINC000450890752	DH	On-Demand	Anodyne	FLT1	23	40
COc1cc2c(NCCC[C@H]3CCOC3)ccnc2cc1F	ZINC000450890752	DH	On-Demand	Anodyne	HNMT	45	35
COc1cccc(N2CCN([C@H]3CCNC(=O)CC3)CC2)c1[N+](=O)[O-]	ZINC000450890761	ED	On-Demand	Bother	HTR1A	31	47
COc1cccc(N2CCN([C@H]3CCNC(=O)CC3)CC2)c1[N+](=O)[O-]	ZINC000450890761	ED	On-Demand	Bother	DRD2	22	43
COc1cccc(N2CCN([C@H]3CCNC(=O)CC3)CC2)c1[N+](=O)[O-]	ZINC000450890761	ED	On-Demand	Bother	ADRA1D	43	43
COc1cccc(N2CCN([C@H]3CCNC(=O)CC3)CC2)c1[N+](=O)[O-]	ZINC000450890761	ED	On-Demand	Bother	ADRA1B	49	43
COc1cccc(N2CCN([C@@H]3CCNC(=O)CC3)CC2)c1[N+](=O)[O-]	ZINC000450890762	ED	On-Demand	Bother	HTR1A	31	47
COc1cccc(N2CCN([C@@H]3CCNC(=O)CC3)CC2)c1[N+](=O)[O-]	ZINC000450890762	ED	On-Demand	Bother	DRD2	22	43
COc1cccc(N2CCN([C@@H]3CCNC(=O)CC3)CC2)c1[N+](=O)[O-]	ZINC000450890762	ED	On-Demand	Bother	ADRA1D	43	43
COc1cccc(N2CCN([C@@H]3CCNC(=O)CC3)CC2)c1[N+](=O)[O-]	ZINC000450890762	ED	On-Demand	Bother	ADRA1B	49	43
CO[C@@]1(C)CCCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450890777	EH	On-Demand	Anodyne	SIGMAR1	41	37
CO[C@]1(C)CCCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450890778	EH	On-Demand	Anodyne	SIGMAR1	41	37
COc1ccc(CNC(=O)CCSc2ccc([N+](=O)[O-])cn2)c(OC)c1	ZINC000450890779	GF	On-Demand	Bother	MTNR1A	43	37
COc1ccc(CNC(=O)CCSc2ccc([N+](=O)[O-])cn2)c(OC)c1	ZINC000450890779	GF	On-Demand	Bother	ABHD6	0	41
COC(=O)c1csc(CN2CCC(O)(Cc3cccc(C)c3)CC2)n1	ZINC000450890789	FF	On-Demand	Anodyne	UTS2R	0	47
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890812	FI	On-Demand	Anodyne	THRA	0	41
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890812	FI	On-Demand	Anodyne	DRD2	30	43
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890812	FI	On-Demand	Anodyne	DRD4	0	43
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890812	FI	On-Demand	Anodyne	ERG2	20	43
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890812	FI	On-Demand	Anodyne	SLC18A3	24	44
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890812	FI	On-Demand	Anodyne	EBP	25	43
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890812	FI	On-Demand	Anodyne	CYP2J2	53	38
CO[C@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890812	FI	On-Demand	Anodyne	AP2S1	0	43
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890813	FI	On-Demand	Anodyne	THRA	0	41
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890813	FI	On-Demand	Anodyne	DRD2	30	43
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890813	FI	On-Demand	Anodyne	DRD4	0	43
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890813	FI	On-Demand	Anodyne	ERG2	20	43
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890813	FI	On-Demand	Anodyne	SLC18A3	24	44
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890813	FI	On-Demand	Anodyne	EBP	25	43
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890813	FI	On-Demand	Anodyne	CYP2J2	53	38
CO[C@@]1(C)CCCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450890813	FI	On-Demand	Anodyne	AP2S1	0	43
CN(Cc1cc(O)nc(N)n1)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450890832	FD	On-Demand	Anodyne	NOS3	17	44
CN(Cc1cc(O)nc(N)n1)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450890833	FD	On-Demand	Anodyne	NOS3	17	44
O=[N+]([O-])c1ccc(CSCc2ccn(CC(F)(F)F)n2)cc1	ZINC000450890834	EH	On-Demand	Bother	SLC29A1	41	38
COC[C@]1(CO)CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450890857	EE	On-Demand	Bother	LIPG	46	36
COC[C@@]1(CO)CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450890858	EE	On-Demand	Bother	LIPG	46	36
C[C@H](O)CCSc1ncnc2c1cnn2-c1ccc(Cl)cc1	ZINC000450890867	EG	On-Demand	Anodyne	GCK	26	40
C[C@@H](O)CCSc1ncnc2c1cnn2-c1ccc(Cl)cc1	ZINC000450890868	EG	On-Demand	Anodyne	GCK	26	40
Cc1nc(-c2ccccn2)nc(NCCC[C@H]2CCOC2)c1C	ZINC000450890887	DF	On-Demand	Anodyne	METAP1	39	44
Cc1nc(-c2ccccn2)nc(NCCC[C@@H]2CCOC2)c1C	ZINC000450890888	DF	On-Demand	Anodyne	METAP1	39	44
CO[C@@H](Cc1ccccc1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000450890893	EH	On-Demand	Bother	CTRB1	28	42
CO[C@@H](Cc1ccccc1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000450890893	EH	On-Demand	Bother	F2RL3	56	41
CO[C@H](Cc1ccccc1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000450890894	EH	On-Demand	Bother	CTRB1	28	42
CO[C@H](Cc1ccccc1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000450890894	EH	On-Demand	Bother	F2RL3	56	41
CC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2ccccc2C(F)(F)F)cc1	ZINC000450890925	FI	On-Demand	Anodyne	RBP4	70	37
CC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2ccccc2C(F)(F)F)cc1	ZINC000450890926	FI	On-Demand	Anodyne	RBP4	70	37
CC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2ccccc2C(F)(F)F)cc1	ZINC000450890927	FI	On-Demand	Anodyne	RBP4	70	37
CC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2ccccc2C(F)(F)F)cc1	ZINC000450890928	FI	On-Demand	Anodyne	RBP4	70	37
Cc1nc(C(C)C)oc1Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000450890936	DH	On-Demand	Bother	F2RL3	47	34
Cc1nn(CC(=O)CC(C)(C)C2CC2)c2ccc([N+](=O)[O-])cc12	ZINC000450890945	DH	On-Demand	Bother	F2RL3	44	33
CCC[C@H](OC)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450890984	DG	On-Demand	Anodyne	CTSK	25	42
CCC[C@H](OC)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450890985	DG	On-Demand	Anodyne	CTSK	25	42
CCC[C@@H](OC)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450890986	DG	On-Demand	Anodyne	CTSK	25	42
CCC[C@@H](OC)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450890987	DG	On-Demand	Anodyne	CTSK	25	42
CN1CCc2ncnc(Nc3cccc(CC#N)c3)c2C1	ZINC000450890994	CE	On-Demand	Mild	PAK1	45	41
CC(=O)[C@@](C)(O)CN1CCC(c2cccc(Cl)c2)CC1	ZINC000450891004	CF	On-Demand	Anodyne	CCR5	24	44
CC(=O)[C@@](C)(O)CN1CCC(c2cccc(Cl)c2)CC1	ZINC000450891004	CF	On-Demand	Anodyne	MCHR1	33	44
CC(=O)[C@@](C)(O)CN1CCC(c2cccc(Cl)c2)CC1	ZINC000450891004	CF	On-Demand	Anodyne	CACNA1I	44	40
CC(=O)[C@](C)(O)CN1CCC(c2cccc(Cl)c2)CC1	ZINC000450891005	CF	On-Demand	Anodyne	CCR5	24	44
CC(=O)[C@](C)(O)CN1CCC(c2cccc(Cl)c2)CC1	ZINC000450891005	CF	On-Demand	Anodyne	MCHR1	33	44
CC(=O)[C@](C)(O)CN1CCC(c2cccc(Cl)c2)CC1	ZINC000450891005	CF	On-Demand	Anodyne	CACNA1I	44	40
COC(=O)c1cccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)c1Cl	ZINC000450891007	GI	On-Demand	Anodyne	DRD4	15	41
COC(=O)c1cccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)c1Cl	ZINC000450891007	GI	On-Demand	Anodyne	UTS2R	15	43
COC(=O)c1cccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)c1Cl	ZINC000450891007	GI	On-Demand	Anodyne	NPFFR1	44	35
Ic1ccc2ncnc(NCCC[C@@H]3CCOC3)c2c1	ZINC000450891029	GF	On-Demand	Anodyne	DYRK1A	23	51
Ic1ccc2ncnc(NCCC[C@@H]3CCOC3)c2c1	ZINC000450891029	GF	On-Demand	Anodyne	CLK1	17	51
Ic1ccc2ncnc(NCCC[C@@H]3CCOC3)c2c1	ZINC000450891029	GF	On-Demand	Anodyne	CLK2	28	51
Ic1ccc2ncnc(NCCC[C@@H]3CCOC3)c2c1	ZINC000450891029	GF	On-Demand	Anodyne	CLK4	55	51
Ic1ccc2ncnc(NCCC[C@@H]3CCOC3)c2c1	ZINC000450891029	GF	On-Demand	Anodyne	CD38	50	36
Ic1ccc2ncnc(NCCC[C@@H]3CCOC3)c2c1	ZINC000450891029	GF	On-Demand	Anodyne	DYRK1B	29	51
Ic1ccc2ncnc(NCCC[C@H]3CCOC3)c2c1	ZINC000450891030	GF	On-Demand	Anodyne	DYRK1A	23	51
Ic1ccc2ncnc(NCCC[C@H]3CCOC3)c2c1	ZINC000450891030	GF	On-Demand	Anodyne	CLK1	17	51
Ic1ccc2ncnc(NCCC[C@H]3CCOC3)c2c1	ZINC000450891030	GF	On-Demand	Anodyne	CLK2	28	51
Ic1ccc2ncnc(NCCC[C@H]3CCOC3)c2c1	ZINC000450891030	GF	On-Demand	Anodyne	CLK4	55	51
Ic1ccc2ncnc(NCCC[C@H]3CCOC3)c2c1	ZINC000450891030	GF	On-Demand	Anodyne	CD38	50	36
Ic1ccc2ncnc(NCCC[C@H]3CCOC3)c2c1	ZINC000450891030	GF	On-Demand	Anodyne	DYRK1B	29	51
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891035	FG	On-Demand	Anodyne	DRD2	29	43
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891035	FG	On-Demand	Anodyne	DRD1	17	43
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891035	FG	On-Demand	Anodyne	DRD4	0	43
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891035	FG	On-Demand	Anodyne	HTR2A	20	45
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891035	FG	On-Demand	Anodyne	HTR2C	17	49
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891035	FG	On-Demand	Anodyne	ERG2	20	43
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891035	FG	On-Demand	Anodyne	SLC18A3	0	41
CC(C)c1nnc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891035	FG	On-Demand	Anodyne	CYP2J2	51	36
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891037	FG	On-Demand	Anodyne	DRD2	29	43
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891037	FG	On-Demand	Anodyne	DRD1	17	43
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891037	FG	On-Demand	Anodyne	DRD4	0	43
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891037	FG	On-Demand	Anodyne	HTR2A	20	45
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891037	FG	On-Demand	Anodyne	HTR2C	17	49
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891037	FG	On-Demand	Anodyne	ERG2	20	43
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891037	FG	On-Demand	Anodyne	SLC18A3	0	41
CC(C)c1nnc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCO2)o1	ZINC000450891037	FG	On-Demand	Anodyne	CYP2J2	51	36
CC(=O)CCCCCn1nnc(Cc2ccccc2C)n1	ZINC000450891051	CF	On-Demand	Anodyne	SOAT1	17	40
Clc1cccc(C2CCN(CCc3cscn3)CC2)c1	ZINC000450891063	DI	On-Demand	Anodyne	SCN5A	42	36
C[S@@](=O)Cc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450891065	GI	On-Demand	Anodyne	RBP4	89	39
CN1CCN(c2nc3ccccc3nc2NCCC[C@H]2CCOC2)CC1	ZINC000450891066	FF	On-Demand	Anodyne	TLR9	0	40
CN1CCN(c2nc3ccccc3nc2NCCC[C@@H]2CCOC2)CC1	ZINC000450891068	FF	On-Demand	Anodyne	TLR9	0	40
N#Cc1cnc2c(F)cc(F)cc2c1NCCC[C@@H]1CCOC1	ZINC000450891073	DH	On-Demand	Mild	MAP3K8	42	35
N#Cc1cnc2c(F)cc(F)cc2c1NCCC[C@H]1CCOC1	ZINC000450891074	DH	On-Demand	Mild	MAP3K8	42	35
CCCc1cc(Nc2cccc(CC#N)c2)n2ncnc2n1	ZINC000450891121	CF	On-Demand	Mild	DHOD	0	53
COc1ccc(Br)cc1C[C@H](CO)CNc1ncc(Cl)cn1	ZINC000450891135	GF	On-Demand	Anodyne	P2RX2	54	43
COc1ccc(Br)cc1C[C@H](CO)CNc1ncc(Cl)cn1	ZINC000450891135	GF	On-Demand	Anodyne	P2RX3	47	43
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncc(Cl)cn1	ZINC000450891136	GF	On-Demand	Anodyne	P2RX2	54	43
COc1ccc(Br)cc1C[C@@H](CO)CNc1ncc(Cl)cn1	ZINC000450891136	GF	On-Demand	Anodyne	P2RX3	47	43
c1ccc(CN2C[C@H]3CN(Cc4cn(CC5CC5)nn4)C[C@H]3C2)cc1	ZINC000450891226	EE	On-Demand	Anodyne	SIGMAR1	28	41
CC(C)N1CCCC[C@H]1CN1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1	ZINC000450891234	EG	On-Demand	Anodyne	BIRC2	28	40
CC(C)N1CCCC[C@@H]1CN1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1	ZINC000450891235	EG	On-Demand	Anodyne	BIRC2	28	40
O=C(NC1CC1)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450891256	EF	On-Demand	Bother	TAAR1	15	40
O=C(NC1CC1)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450891257	EF	On-Demand	Bother	TAAR1	15	40
COc1cc(CN2CC[C@H](N(C)Cc3cc(O)nc(N)n3)C2)ccc1Cl	ZINC000450891260	GD	On-Demand	Anodyne	DRD4	23	40
COc1cc(CN2CC[C@H](N(C)Cc3cc(O)nc(N)n3)C2)ccc1Cl	ZINC000450891260	GD	On-Demand	Anodyne	SSTR5	51	37
COc1cc(CN2CC[C@@H](N(C)Cc3cc(O)nc(N)n3)C2)ccc1Cl	ZINC000450891261	GD	On-Demand	Anodyne	DRD4	23	40
COc1cc(CN2CC[C@@H](N(C)Cc3cc(O)nc(N)n3)C2)ccc1Cl	ZINC000450891261	GD	On-Demand	Anodyne	SSTR5	51	37
COC[C@@]1(CO)CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450891276	EE	On-Demand	Anodyne	RBP4	17	41
COC[C@]1(CO)CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450891277	EE	On-Demand	Anodyne	RBP4	17	41
O=C1CC[C@@H](N2CCN(c3cncc(Br)c3)CC2)CCN1	ZINC000450891288	FD	On-Demand	Anodyne	CHRNA4	20	48
O=C1CC[C@H](N2CCN(c3cncc(Br)c3)CC2)CCN1	ZINC000450891289	FD	On-Demand	Anodyne	CHRNA4	20	48
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](N(C)Cc2cc(O)nc(N)n2)C1	ZINC000450891298	FD	On-Demand	Anodyne	OPRK1	15	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](N(C)Cc2cc(O)nc(N)n2)C1	ZINC000450891299	FD	On-Demand	Anodyne	OPRK1	15	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](N(C)Cc2cc(O)nc(N)n2)C1	ZINC000450891300	FD	On-Demand	Anodyne	OPRK1	15	40
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](N(C)Cc2cc(O)nc(N)n2)C1	ZINC000450891301	FD	On-Demand	Anodyne	OPRK1	15	40
COC(=O)c1csc(CN2CCC(n3c(C)nc4ccccc43)CC2)n1	ZINC000450891302	FG	On-Demand	Anodyne	AKT2	16	41
Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450891308	GJ	On-Demand	Anodyne	PRCP	42	36
Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450891309	GJ	On-Demand	Anodyne	PRCP	42	36
Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450891310	GJ	On-Demand	Anodyne	PRCP	42	36
Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450891311	GJ	On-Demand	Anodyne	PRCP	42	36
Cc1ccc2c(n1)c(=O)c(C#N)cn2CCCCc1ccc(Cl)c(Cl)c1	ZINC000450891313	GJ	On-Demand	Mild	DNAE	51	31
O=[N+]([O-])c1ccc(CSC[C@H]2COCCO2)cc1	ZINC000450891331	CE	On-Demand	Bother	KCNJ1	17	44
O=[N+]([O-])c1ccc(CSC[C@@H]2COCCO2)cc1	ZINC000450891332	CE	On-Demand	Bother	KCNJ1	17	44
COc1ccc(CN(CCc2ccccn2)C[C@H](O)Cc2ccccc2)cc1	ZINC000450891333	GH	On-Demand	Anodyne	GRIN1	23	45
COC(=O)c1cccc(CN2CCC(n3c(C)nc4ccccc43)CC2)c1Cl	ZINC000450891334	GJ	On-Demand	Anodyne	DRD4	20	41
COC(=O)c1cccc(CN2CCC(n3c(C)nc4ccccc43)CC2)c1Cl	ZINC000450891334	GJ	On-Demand	Anodyne	OPRL1	25	42
COC(=O)c1cccc(CN2CCC(n3c(C)nc4ccccc43)CC2)c1Cl	ZINC000450891334	GJ	On-Demand	Anodyne	PTAFR	23	43
COC(=O)c1cccc(CN2CCC(n3c(C)nc4ccccc43)CC2)c1Cl	ZINC000450891334	GJ	On-Demand	Anodyne	CCR5	21	47
COC(=O)c1cccc(CN2CCC(n3c(C)nc4ccccc43)CC2)c1Cl	ZINC000450891334	GJ	On-Demand	Anodyne	AKT2	17	41
COC(=O)c1cccc(CN2CCC(n3c(C)nc4ccccc43)CC2)c1Cl	ZINC000450891334	GJ	On-Demand	Anodyne	MCHR1	20	42
COC(=O)c1coc(CN2CCC(c3cccc(Cl)c3)CC2)n1	ZINC000450891341	EG	On-Demand	Anodyne	MCHR1	42	46
COC(=O)c1coc(CN2CCC(c3cccc(Cl)c3)CC2)n1	ZINC000450891341	EG	On-Demand	Anodyne	CARM1	44	31
COC(=O)c1coc(CN2CCC(c3cccc(Cl)c3)CC2)n1	ZINC000450891341	EG	On-Demand	Anodyne	MGEA5	27	41
CCOC(=O)C1(COC)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450891393	FG	On-Demand	Anodyne	SSTR5	45	39
CCOC(=O)C1(COC)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450891393	FG	On-Demand	Anodyne	NPFFR1	44	37
C=C(C)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450891459	EI	On-Demand	Mild	E1	0	42
C=C(C)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450891459	EI	On-Demand	Mild	LIMK2	41	38
C=C(C)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450891459	EI	On-Demand	Mild	RORC	41	56
COC(=O)c1ccc(CN(C)C2CCN(c3ccccc3)CC2)cc1Cl	ZINC000450891477	FI	On-Demand	Anodyne	HTR4	22	40
COC(=O)c1ccc(CN(C)C2CCN(c3ccccc3)CC2)cc1Cl	ZINC000450891477	FI	On-Demand	Anodyne	TACR3	47	34
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891479	EF	On-Demand	Anodyne	DRD2	32	44
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891479	EF	On-Demand	Anodyne	DRD4	0	45
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891479	EF	On-Demand	Anodyne	ADRA1D	34	40
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891479	EF	On-Demand	Anodyne	ADRA1B	26	40
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891479	EF	On-Demand	Anodyne	ADRA2B	0	40
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891479	EF	On-Demand	Anodyne	HTR7	24	47
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891479	EF	On-Demand	Anodyne	SLC18A3	0	44
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891479	EF	On-Demand	Anodyne	CYP2J2	59	43
C=CCC[C@@H](CO)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450891494	EG	On-Demand	Mild	P4HTM	0	47
C=CCC[C@H](CO)Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1	ZINC000450891500	EG	On-Demand	Mild	P4HTM	0	47
CCn1nnc(C)c1Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000450891503	DE	On-Demand	Bother	F2RL3	51	35
CC(C)NC(=O)c1ccc(NCCC[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450891518	EF	On-Demand	Bother	TAAR1	17	42
CC(C)NC(=O)c1ccc(NCCC[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000450891520	EF	On-Demand	Bother	TAAR1	17	42
CCS(=O)(=O)c1ccc(CN2CCC[C@H](C(C)(C)C)C2)cc1	ZINC000450891526	DH	On-Demand	Anodyne	HRH3	17	44
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](C(C)(C)C)C2)cc1	ZINC000450891528	DH	On-Demand	Anodyne	HRH3	17	44
COC(=O)C1(CN2Cc3ccc(C)cc3C2)CC1	ZINC000450891532	BE	On-Demand	Anodyne	DPP9	0	42
Cn1ccnc(N2CCC[C@@H](NC(=O)c3ccc(C(C)(F)F)nc3)C2)c1=O	ZINC000450891575	GD	On-Demand	Anodyne	HPGDS	35	42
Cn1ccnc(N2CCC[C@H](NC(=O)c3ccc(C(C)(F)F)nc3)C2)c1=O	ZINC000450891576	GD	On-Demand	Anodyne	HPGDS	35	42
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450891577	ED	On-Demand	Anodyne	HDAC1	25	42
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)c1ccc(N2CCC2)nc1	ZINC000450891578	ED	On-Demand	Anodyne	HDAC1	25	42
COc1ccc(OC)c(CN2C(=O)N[C@]3(CCc4cc(Cl)ccc43)C2=O)c1	ZINC000450891588	GG	On-Demand	Anodyne	AVPR1B	41	33
COc1ccc(OC)c(CN2C(=O)N[C@@]3(CCc4cc(Cl)ccc43)C2=O)c1	ZINC000450891589	GG	On-Demand	Anodyne	AVPR1B	41	33
Clc1ccc(CCN2CC[C@@H](OCc3ccncc3)C2)cc1	ZINC000450891590	DH	On-Demand	Anodyne	SIGMAR1	17	42
Clc1ccc(CCN2CC[C@H](OCc3ccncc3)C2)cc1	ZINC000450891591	DH	On-Demand	Anodyne	SIGMAR1	17	42
Cc1c(C(F)(F)F)nn(C)c1NC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450891615	GJ	On-Demand	Anodyne	KCNJ11	91	34
Cc1cccc(CN2CC[C@H](OCc3ccncc3)C2)n1	ZINC000450891621	CF	On-Demand	Anodyne	SCN5A	31	43
Cc1cccc(CN2CC[C@@H](OCc3ccncc3)C2)n1	ZINC000450891622	CF	On-Demand	Anodyne	SCN5A	31	43
COc1ccc(CNC(=O)CCSC2CCOCC2)c(OC)c1	ZINC000450891656	EF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc(CNC(=O)CCSC2CCOCC2)c(OC)c1	ZINC000450891656	EF	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(CNC(=O)CCSC2CCOCC2)c(OC)c1	ZINC000450891656	EF	On-Demand	Anodyne	MTNR1B	45	32
COC[C@@]1(CO)CCN(c2ccnc(C(C)C)n2)C1	ZINC000450891711	CD	On-Demand	Anodyne	SORD	71	40
COC[C@]1(CO)CCN(c2ccnc(C(C)C)n2)C1	ZINC000450891712	CD	On-Demand	Anodyne	SORD	71	40
COC[C@@]1(CO)CCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000450891728	CE	On-Demand	Mild	TRPV4	43	36
COC[C@]1(CO)CCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000450891729	CE	On-Demand	Mild	TRPV4	43	36
CCN1CCN(CCCC(=O)c2ccccc2)C[C@H]1c1ncc[nH]1	ZINC000450891755	EF	On-Demand	Anodyne	CYP2J2	56	40
CCN1CCN(CCCC(=O)c2ccccc2)C[C@@H]1c1ncc[nH]1	ZINC000450891756	EF	On-Demand	Anodyne	CYP2J2	56	40
CCC(=O)CCCN1CCC(O)(Cc2cccc(C)c2)CC1	ZINC000450891757	DG	On-Demand	Anodyne	UTS2R	19	47
O=C1CC[C@@H](N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)CCN1	ZINC000450891758	GE	On-Demand	Bother	SERPINE1	15	40
O=C1CC[C@H](N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)CCN1	ZINC000450891759	GE	On-Demand	Bother	SERPINE1	15	40
CSc1cccc(C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1	ZINC000450891817	EH	On-Demand	Anodyne	KCNK3	55	37
Cc1nc2ccccc2n1C1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450891834	EE	On-Demand	Anodyne	RPS6KB1	32	40
Cc1nc2ccccc2n1C1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450891835	EE	On-Demand	Anodyne	RPS6KB1	32	40
CCn1cnc2c(c1=O)CCN(Cc1ccc(Cl)c(OC)c1)C2	ZINC000450891870	EE	On-Demand	Anodyne	SSTR5	42	36
CO[C@@H](COCc1ncc[nH]1)Cc1ccccc1	ZINC000450891875	BE	On-Demand	Anodyne	TAAR1	16	48
CO[C@H](COCc1ncc[nH]1)Cc1ccccc1	ZINC000450891876	BE	On-Demand	Anodyne	TAAR1	16	48
C=CCC[C@H](CO)Nc1cc(CCC)nc2ncnn12	ZINC000450891895	CD	On-Demand	Mild	DHOD	0	40
C=CCC[C@@H](CO)Nc1cc(CCC)nc2ncnn12	ZINC000450891896	CD	On-Demand	Mild	DHOD	0	40
COC[C@]1(CO)CCN(c2nccc(-c3ccc(OC)cc3)n2)C1	ZINC000450891903	ED	On-Demand	Anodyne	SORD	15	40
COC[C@@]1(CO)CCN(c2nccc(-c3ccc(OC)cc3)n2)C1	ZINC000450891904	ED	On-Demand	Anodyne	SORD	15	40
CCS(=O)(=O)c1ccc(COc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000450891909	EG	On-Demand	Bother	MAOB	38	42
COC[C@]1(CO)CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C1	ZINC000450891936	GG	On-Demand	Anodyne	SMO	44	54
COC[C@@]1(CO)CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc23)C1	ZINC000450891937	GG	On-Demand	Anodyne	SMO	44	54
CO[C@@]1(C)CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450891951	CH	On-Demand	Anodyne	SIGMAR1	25	40
CO[C@]1(C)CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450891952	CH	On-Demand	Anodyne	SIGMAR1	25	40
CCc1cc(CCCN2CCC(n3c(C)nc4ccccc43)CC2)on1	ZINC000450891961	FI	On-Demand	Anodyne	CCR5	15	45
CCc1cc(CCCN2CCC(n3c(C)nc4ccccc43)CC2)on1	ZINC000450891961	FI	On-Demand	Anodyne	USP1	0	41
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	HTR1A	16	47
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	HTR2A	24	47
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	HTR2C	18	49
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	HRH1	29	45
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	DRD3	16	45
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	HTR7	29	45
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	TACR2	18	42
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	HRH3	16	43
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	SIGMAR1	18	45
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	CCR5	29	56
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	AKT2	18	41
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	PLD1	64	38
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	PLD2	58	38
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	MCHR1	24	48
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	CYP2J2	66	49
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	CDPK1	0	40
Cc1nc2ccccc2n1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450891982	FJ	On-Demand	Anodyne	USP1	0	48
CCN(CC)C(=O)CSCc1ccc(Cl)c(OC)c1	ZINC000450891992	DG	On-Demand	Anodyne	HCRTR2	16	42
N#CCc1cccc(Nc2ncnc3c2ncn3C2CC2)c1	ZINC000450892010	CF	On-Demand	Mild	ADORA1	47	42
N#CCc1cccc(Nc2ncnc3c2ncn3C2CC2)c1	ZINC000450892010	CF	On-Demand	Mild	CYSP_TRYCR	20	50
N#CCc1cccc(Nc2ncnc3c2ncn3C2CC2)c1	ZINC000450892010	CF	On-Demand	Mild	ADORA3	58	40
COC[C@]1(CO)CCN(c2ncccc2C(F)(F)F)C1	ZINC000450892048	CD	On-Demand	Anodyne	TRPV1	28	41
COC[C@@]1(CO)CCN(c2ncccc2C(F)(F)F)C1	ZINC000450892049	CD	On-Demand	Anodyne	TRPV1	28	41
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450892058	ED	On-Demand	Mild	TGM2	48	40
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450892058	ED	On-Demand	Mild	NAMPT	21	40
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450892059	ED	On-Demand	Mild	TGM2	48	40
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450892059	ED	On-Demand	Mild	NAMPT	21	40
CCC[C@H](O)CN1Cc2ccc(C)cc2C1	ZINC000450892062	BE	On-Demand	Anodyne	DPP9	0	43
CCC[C@@H](O)CN1Cc2ccc(C)cc2C1	ZINC000450892063	BE	On-Demand	Anodyne	DPP9	0	43
COc1cnccc1N1CCN(CC2(C#N)CCC2)CC1	ZINC000450892083	CD	On-Demand	Mild	HTR1A	33	41
COC(=O)c1csc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450892096	ED	On-Demand	Anodyne	HTR1A	51	41
COC(=O)c1csc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450892096	ED	On-Demand	Anodyne	DRD2	42	38
COC(=O)c1csc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450892096	ED	On-Demand	Anodyne	ADRA1D	42	39
COC(=O)c1csc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450892096	ED	On-Demand	Anodyne	HTR7	43	37
COC[C@]1(CO)CCN(c2nc(OC)cc(OC)n2)C1	ZINC000450892145	CC	On-Demand	Anodyne	ALS	41	35
COC[C@@]1(CO)CCN(c2nc(OC)cc(OC)n2)C1	ZINC000450892146	CC	On-Demand	Anodyne	ALS	41	35
COC[C@@]1(CO)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450892148	FG	On-Demand	Anodyne	ADRB2	15	49
COC[C@@]1(CO)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450892148	FG	On-Demand	Anodyne	ADRB3	31	52
COC[C@]1(CO)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450892149	FG	On-Demand	Anodyne	ADRB2	15	49
COC[C@]1(CO)CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450892149	FG	On-Demand	Anodyne	ADRB3	31	52
COc1ccc(CNC(=O)CCN2CC[C@H](OCc3ccncc3)C2)c(OC)c1	ZINC000450892167	GE	On-Demand	Anodyne	HTR7	19	41
COc1ccc(CNC(=O)CCN2CC[C@@H](OCc3ccncc3)C2)c(OC)c1	ZINC000450892168	GE	On-Demand	Anodyne	HTR7	19	41
COC(=O)c1coc(CN2CCC(O)(Cc3cccc(C)c3)CC2)n1	ZINC000450892173	EE	On-Demand	Anodyne	UTS2R	16	44
Cc1nc2ccccc2n1C1CCN(C[C@@H]2CCNC(=O)CC2)CC1	ZINC000450892180	EF	On-Demand	Anodyne	OPRL1	37	44
Cc1nc2ccccc2n1C1CCN(C[C@@H]2CCNC(=O)CC2)CC1	ZINC000450892180	EF	On-Demand	Anodyne	PLD1	45	33
Cc1nc2ccccc2n1C1CCN(C[C@H]2CCNC(=O)CC2)CC1	ZINC000450892181	EF	On-Demand	Anodyne	OPRL1	37	44
Cc1nc2ccccc2n1C1CCN(C[C@H]2CCNC(=O)CC2)CC1	ZINC000450892181	EF	On-Demand	Anodyne	PLD1	45	33
Cc1nc2ccccc2n1C1CCN([C@H](C)c2csnn2)CC1	ZINC000450892199	EH	On-Demand	Anodyne	CCR5	17	40
Cc1nc2ccccc2n1C1CCN([C@@H](C)c2csnn2)CC1	ZINC000450892200	EH	On-Demand	Anodyne	CCR5	17	40
CCOc1cc(N2CCN(Cc3cccc(C(C)=O)c3)CC2)ccc1[N+](=O)[O-]	ZINC000450892206	GH	On-Demand	Bother	HTR1A	16	50
CCOc1cc(N2CCN(Cc3cccc(C(C)=O)c3)CC2)ccc1[N+](=O)[O-]	ZINC000450892206	GH	On-Demand	Bother	SSTR5	41	36
CCOc1cc(N2CCN(Cc3cccc(C(C)=O)c3)CC2)ccc1[N+](=O)[O-]	ZINC000450892206	GH	On-Demand	Bother	ABCB1	0	40
CCS(=O)(=O)c1ccc(CN(C)[C@H](CC(N)=O)c2ccccc2)cc1	ZINC000450892207	FF	On-Demand	Anodyne	RORC	32	42
CCS(=O)(=O)c1ccc(CN(C)[C@@H](CC(N)=O)c2ccccc2)cc1	ZINC000450892208	FF	On-Demand	Anodyne	RORC	32	42
Oc1n[nH]c(C2CCN(CCc3ccc(Cl)cc3)CC2)n1	ZINC000450892215	DF	On-Demand	Anodyne	PRCP	26	42
CCn1ccnc(N2CCC(NC(=O)c3ccnc(OC(F)F)c3)CC2)c1=O	ZINC000450892233	GD	On-Demand	Anodyne	SSTR5	45	37
COC[C@]1(CO)CCN(c2ccc(C(F)(F)F)cn2)C1	ZINC000450892236	CD	On-Demand	Anodyne	ADAM33	0	41
COC[C@@]1(CO)CCN(c2ccc(C(F)(F)F)cn2)C1	ZINC000450892237	CD	On-Demand	Anodyne	ADAM33	0	41
Cc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450892243	CF	On-Demand	Anodyne	OPRM1	23	50
Cc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450892243	CF	On-Demand	Anodyne	OPRL1	25	40
Cc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450892243	CF	On-Demand	Anodyne	CCR5	28	62
Cc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450892243	CF	On-Demand	Anodyne	PLD1	59	35
Cc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450892243	CF	On-Demand	Anodyne	PLD2	48	35
Cc1nc2ccccc2n1C1CCN(CC[C@@H](C)O)CC1	ZINC000450892243	CF	On-Demand	Anodyne	USP1	0	50
Cc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450892244	CF	On-Demand	Anodyne	OPRM1	23	50
Cc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450892244	CF	On-Demand	Anodyne	OPRL1	25	40
Cc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450892244	CF	On-Demand	Anodyne	CCR5	28	62
Cc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450892244	CF	On-Demand	Anodyne	PLD1	59	35
Cc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450892244	CF	On-Demand	Anodyne	PLD2	48	35
Cc1nc2ccccc2n1C1CCN(CC[C@H](C)O)CC1	ZINC000450892244	CF	On-Demand	Anodyne	USP1	0	50
Cc1ccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c(C(C)C)n1	ZINC000450892252	GF	On-Demand	Anodyne	CDK1	20	40
Cc1ccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c(C(C)C)n1	ZINC000450892252	GF	On-Demand	Anodyne	CDK4	22	40
Cc1ccc(C(=O)NCc2ccc(N3CCCS3(=O)=O)cc2)c(C(C)C)n1	ZINC000450892252	GF	On-Demand	Anodyne	CALCA	0	42
COC[C@@]1(CO)CCN(c2ncnc3ccc(C)cc23)C1	ZINC000450892253	CD	On-Demand	Anodyne	PDGFRB	41	44
COC[C@@]1(CO)CCN(c2ncnc3ccc(C)cc23)C1	ZINC000450892253	CD	On-Demand	Anodyne	PDE3B	63	33
COC[C@@]1(CO)CCN(c2ncnc3ccc(C)cc23)C1	ZINC000450892253	CD	On-Demand	Anodyne	HTT	0	41
COC[C@]1(CO)CCN(c2ncnc3ccc(C)cc23)C1	ZINC000450892254	CD	On-Demand	Anodyne	PDGFRB	41	44
COC[C@]1(CO)CCN(c2ncnc3ccc(C)cc23)C1	ZINC000450892254	CD	On-Demand	Anodyne	PDE3B	63	33
COC[C@]1(CO)CCN(c2ncnc3ccc(C)cc23)C1	ZINC000450892254	CD	On-Demand	Anodyne	HTT	0	41
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@](CO)(COC)C1	ZINC000450892258	FE	On-Demand	Anodyne	ATP4A	19	48
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@](CO)(COC)C1	ZINC000450892259	FE	On-Demand	Anodyne	ATP4A	19	48
COc1cnccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450892284	CC	On-Demand	Anodyne	HTR1A	46	40
COc1cnccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450892284	CC	On-Demand	Anodyne	DRD2	36	41
COc1cnccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450892284	CC	On-Demand	Anodyne	DRD1	24	41
COc1cnccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450892284	CC	On-Demand	Anodyne	DRD4	27	44
COc1cnccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450892284	CC	On-Demand	Anodyne	DRD3	27	43
COc1cnccc1N1CCN(Cc2cnn[nH]2)CC1	ZINC000450892284	CC	On-Demand	Anodyne	HTR7	27	40
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	HTR1A	106	49
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	DRD2	90	46
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	DRD1	36	42
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	DRD4	52	35
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	ADRA1D	70	49
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	HTR1D	33	43
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	HTR1B	41	38
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	HTR2A	55	42
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	ADRA1A	55	43
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	ADRA1B	50	43
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	DRD3	72	44
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	HTR7	81	45
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	SIGMAR1	27	42
COc1cnccc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450892297	EE	On-Demand	Anodyne	AP2S1	0	40
COc1cnccc1N1CCN(Cc2cnns2)CC1	ZINC000450892330	CD	On-Demand	Anodyne	HTR1A	40	38
COc1cnccc1N1CCN(Cc2cnns2)CC1	ZINC000450892330	CD	On-Demand	Anodyne	DRD2	32	40
COc1cnccc1N1CCN(Cc2cnns2)CC1	ZINC000450892330	CD	On-Demand	Anodyne	DRD4	27	46
COc1cnccc1N1CCN(Cc2cnns2)CC1	ZINC000450892330	CD	On-Demand	Anodyne	ADRA1D	32	45
COc1cnccc1N1CCN(Cc2cnns2)CC1	ZINC000450892330	CD	On-Demand	Anodyne	ADRA1A	28	40
COc1cnccc1N1CCN(Cc2cnns2)CC1	ZINC000450892330	CD	On-Demand	Anodyne	ADRA1B	23	45
COc1cnccc1N1CCN(Cc2cnns2)CC1	ZINC000450892330	CD	On-Demand	Anodyne	DRD3	26	40
COC[C@@]1(CO)CCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450892344	CD	On-Demand	Anodyne	SORD	47	35
COC[C@]1(CO)CCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450892345	CD	On-Demand	Anodyne	SORD	47	35
C=CCC[C@H](CO)Nc1cc(CC)nc2ncnn12	ZINC000450892347	CD	On-Demand	Mild	DHOD	0	47
CNS(=O)(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450892396	EC	On-Demand	Anodyne	CCR5	37	41
CNS(=O)(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450892396	EC	On-Demand	Anodyne	CCR8	45	35
CNS(=O)(=O)NC1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450892396	EC	On-Demand	Anodyne	SFRP1	50	37
CNS(=O)(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450892397	EC	On-Demand	Anodyne	CCR5	37	41
CNS(=O)(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450892397	EC	On-Demand	Anodyne	CCR8	45	35
CNS(=O)(=O)NC1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450892397	EC	On-Demand	Anodyne	SFRP1	50	37
CNS(=O)(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450892398	EC	On-Demand	Anodyne	CCR5	37	41
CNS(=O)(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450892398	EC	On-Demand	Anodyne	CCR8	45	35
CNS(=O)(=O)NC1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450892398	EC	On-Demand	Anodyne	SFRP1	50	37
CNS(=O)(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450892399	EC	On-Demand	Anodyne	CCR5	37	41
CNS(=O)(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450892399	EC	On-Demand	Anodyne	CCR8	45	35
CNS(=O)(=O)NC1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450892399	EC	On-Demand	Anodyne	SFRP1	50	37
CCS(=O)(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1	ZINC000450892402	GH	On-Demand	Anodyne	DRD4	28	42
CCS(=O)(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1	ZINC000450892402	GH	On-Demand	Anodyne	DRD3	0	42
CCS(=O)(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1	ZINC000450892402	GH	On-Demand	Anodyne	SSTR5	43	40
CCS(=O)(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1	ZINC000450892402	GH	On-Demand	Anodyne	CCR5	20	45
CCS(=O)(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1	ZINC000450892402	GH	On-Demand	Anodyne	AKT2	29	51
CCS(=O)(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1	ZINC000450892402	GH	On-Demand	Anodyne	ALDH3A1	43	40
CCS(=O)(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1	ZINC000450892402	GH	On-Demand	Anodyne	MCHR1	15	45
CNS(=O)(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450892406	DD	On-Demand	Anodyne	SFRP1	75	40
CNS(=O)(=O)NC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450892406	DD	On-Demand	Anodyne	WNT3	41	36
CNS(=O)(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450892407	DD	On-Demand	Anodyne	SFRP1	75	40
CNS(=O)(=O)NC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450892407	DD	On-Demand	Anodyne	WNT3	41	36
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	DRD2	17	41
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	DRD4	45	41
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	ACHE	24	40
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	HRH1	40	37
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	DRD3	21	41
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	OPRL1	29	43
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	KCNH2	17	44
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	PTAFR	30	43
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	HRH3	15	41
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	SIGMAR1	28	43
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	SSTR5	74	39
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	CCR3	51	43
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	CCR5	26	46
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	PDE2A	31	40
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	PDE6D	41	37
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	AKT2	30	48
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	PLD1	43	35
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	TRPV4	29	40
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	CXCR3	34	41
COC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)cc1Cl	ZINC000450892421	GJ	On-Demand	Anodyne	MCHR1	45	46
COc1cc(CN2CCO[C@H](c3nnc(C(C)C)o3)C2)ccc1Cl	ZINC000450892424	FG	On-Demand	Anodyne	DRD4	17	52
COc1cc(CN2CCO[C@H](c3nnc(C(C)C)o3)C2)ccc1Cl	ZINC000450892424	FG	On-Demand	Anodyne	SSTR5	44	35
COc1cc(CN2CCO[C@@H](c3nnc(C(C)C)o3)C2)ccc1Cl	ZINC000450892425	FG	On-Demand	Anodyne	DRD4	17	52
COc1cc(CN2CCO[C@@H](c3nnc(C(C)C)o3)C2)ccc1Cl	ZINC000450892425	FG	On-Demand	Anodyne	SSTR5	44	35
CCOC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)nc1	ZINC000450892426	GH	On-Demand	Anodyne	PTAFR	19	43
CCOC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)nc1	ZINC000450892426	GH	On-Demand	Anodyne	SSTR5	47	41
CCOC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)nc1	ZINC000450892426	GH	On-Demand	Anodyne	CCR5	18	45
CCOC(=O)c1ccc(CN2CCC(n3c(C)nc4ccccc43)CC2)nc1	ZINC000450892426	GH	On-Demand	Anodyne	AKT2	24	43
COC[C@@]1(CO)CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450892441	GG	On-Demand	Anodyne	ADRB2	16	45
COC[C@@]1(CO)CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450892441	GG	On-Demand	Anodyne	ADRB3	29	44
COC[C@]1(CO)CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450892442	GG	On-Demand	Anodyne	ADRB2	16	45
COC[C@]1(CO)CCN(c2ncnc3scc(-c4ccc(OC)cc4)c23)C1	ZINC000450892442	GG	On-Demand	Anodyne	ADRB3	29	44
Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450892443	FI	On-Demand	Anodyne	SCN9A	0	40
Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450892444	FI	On-Demand	Anodyne	SCN9A	0	40
Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450892445	FI	On-Demand	Anodyne	SCN9A	0	40
Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450892446	FI	On-Demand	Anodyne	SCN9A	0	40
COc1cc(CN2CC[C@H](OCc3ccncc3)C2)ccc1Cl	ZINC000450892447	EH	On-Demand	Anodyne	DRD4	24	42
COc1cc(CN2CC[C@H](OCc3ccncc3)C2)ccc1Cl	ZINC000450892447	EH	On-Demand	Anodyne	HTR4	19	45
COc1cc(CN2CC[C@H](OCc3ccncc3)C2)ccc1Cl	ZINC000450892447	EH	On-Demand	Anodyne	SSTR5	58	40
COc1cc(CN2CC[C@H](OCc3ccncc3)C2)ccc1Cl	ZINC000450892447	EH	On-Demand	Anodyne	UTS2R	23	42
C=CCC[C@@H](CO)Nc1cc(CC)nc2ncnn12	ZINC000450892448	CD	On-Demand	Mild	DHOD	0	47
CC[C@H]1CN(CCCC(=O)c2ccccc2)C[C@]2(CCOC2)O1	ZINC000450892475	DF	On-Demand	Anodyne	CYP2J2	56	41
CC[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@]2(CCOC2)O1	ZINC000450892476	DF	On-Demand	Anodyne	CYP2J2	56	41
CC[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@]2(CCOC2)O1	ZINC000450892477	DF	On-Demand	Anodyne	CYP2J2	56	41
CC[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@]2(CCOC2)O1	ZINC000450892478	DF	On-Demand	Anodyne	CYP2J2	56	41
COc1cc(CN2CC[C@@H](OCc3ccncc3)C2)ccc1Cl	ZINC000450892510	EH	On-Demand	Anodyne	DRD4	24	42
COc1cc(CN2CC[C@@H](OCc3ccncc3)C2)ccc1Cl	ZINC000450892510	EH	On-Demand	Anodyne	HTR4	19	45
COc1cc(CN2CC[C@@H](OCc3ccncc3)C2)ccc1Cl	ZINC000450892510	EH	On-Demand	Anodyne	SSTR5	58	40
COc1cc(CN2CC[C@@H](OCc3ccncc3)C2)ccc1Cl	ZINC000450892510	EH	On-Demand	Anodyne	UTS2R	23	42
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@H](CC(N)=O)c1ccccc1	ZINC000450892528	EF	On-Demand	Anodyne	AOC3	21	40
C[C@H](c1ccccc1)[C@H](O)CN(C)[C@@H](CC(N)=O)c1ccccc1	ZINC000450892529	EF	On-Demand	Anodyne	AOC3	21	40
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@H](CC(N)=O)c1ccccc1	ZINC000450892530	EF	On-Demand	Anodyne	AOC3	21	40
C[C@H](c1ccccc1)[C@@H](O)CN(C)[C@@H](CC(N)=O)c1ccccc1	ZINC000450892531	EF	On-Demand	Anodyne	AOC3	21	40
O=C1CC[C@H](N2CCN(c3ccnc4cc(Cl)ccc34)CC2)CCN1	ZINC000450892533	FF	On-Demand	Anodyne	HRP1_PLAFA	95	36
O=C1CC[C@H](N2CCN(c3ccnc4cc(Cl)ccc34)CC2)CCN1	ZINC000450892533	FF	On-Demand	Anodyne	HNMT	47	33
O=C1CC[C@@H](N2CCN(c3ccnc4cc(Cl)ccc34)CC2)CCN1	ZINC000450892534	FF	On-Demand	Anodyne	HRP1_PLAFA	95	36
O=C1CC[C@@H](N2CCN(c3ccnc4cc(Cl)ccc34)CC2)CCN1	ZINC000450892534	FF	On-Demand	Anodyne	HNMT	47	33
CCn1ccnc(N2CCC(NC(=O)c3ccsc3C)CC2)c1=O	ZINC000450892549	EE	On-Demand	Anodyne	SIRT3	51	32
CCn1ccnc(N2CCC(NC(=O)c3ccsc3C)CC2)c1=O	ZINC000450892549	EE	On-Demand	Anodyne	SIRT2	57	32
CCn1ccnc(N2CCC(NC(=O)c3cc(C)cs3)CC2)c1=O	ZINC000450892562	EE	On-Demand	Anodyne	SIRT3	56	32
CCn1ccnc(N2CCC(NC(=O)c3cc(C)cs3)CC2)c1=O	ZINC000450892562	EE	On-Demand	Anodyne	SIRT2	67	34
CCn1ccnc(N2CCC(NC(=O)c3cc(C)cs3)CC2)c1=O	ZINC000450892562	EE	On-Demand	Anodyne	SIRT1	47	33
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	HTR1A	141	65
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	ADRA2A	22	45
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	DRD2	120	62
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	DRD1	61	48
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	DRD4	76	62
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	ADRA1D	85	51
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	HTR1B	41	42
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	HTR2A	86	48
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	HTR2C	50	48
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	SLC6A4	30	58
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	ADRA1A	66	51
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	ADRA1B	63	46
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	DRD3	99	49
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	ADRA2B	22	48
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	DRD5	23	48
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	TACR1	0	40
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	HTR7	123	73
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	SIGMAR1	32	48
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	HTR6	0	44
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	SLC18A3	24	42
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	ABCB1	40	41
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	CYP2J2	57	40
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	AP2S1	0	45
COc1cnccc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450892581	EF	On-Demand	Anodyne	ALPHA-1A	0	46
COC(=O)c1csc(CN2CCC(c3cccc(Cl)c3)CC2)n1	ZINC000450892590	FH	On-Demand	Anodyne	MCHR1	42	47
COC(=O)c1csc(CN2CCC(c3cccc(Cl)c3)CC2)n1	ZINC000450892590	FH	On-Demand	Anodyne	MGEA5	27	41
CCS(=O)(=O)c1ccc(CN2CCC(c3nc(O)n[nH]3)CC2)cc1	ZINC000450892607	FD	On-Demand	Anodyne	ADORA2B	41	35
O=C1CC[C@H](N2CCN(c3ncc(C(F)(F)F)s3)CC2)CCN1	ZINC000450892608	ED	On-Demand	Anodyne	MLYCD	63	39
O=C1CC[C@@H](N2CCN(c3ncc(C(F)(F)F)s3)CC2)CCN1	ZINC000450892609	ED	On-Demand	Anodyne	MLYCD	63	39
COC[C@@]1(CO)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450892623	DD	On-Demand	Anodyne	PDE3A	50	41
COC[C@@]1(CO)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450892623	DD	On-Demand	Anodyne	PDE3B	74	41
COC[C@]1(CO)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450892624	DD	On-Demand	Anodyne	PDE3A	50	41
COC[C@]1(CO)CCN(c2ncnc3cc(F)c(OC)cc23)C1	ZINC000450892624	DD	On-Demand	Anodyne	PDE3B	74	41
C[C@]1(C(N)=O)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450892630	CE	On-Demand	Anodyne	DRD4	15	42
C[C@]1(C(N)=O)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450892630	CE	On-Demand	Anodyne	SIGMAR1	17	40
C[C@@]1(C(N)=O)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450892631	CE	On-Demand	Anodyne	DRD4	15	42
C[C@@]1(C(N)=O)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450892631	CE	On-Demand	Anodyne	SIGMAR1	17	40
COc1ccc(CNC(=O)CCN2CCC[C@](C)(OC)CC2)c(OC)c1	ZINC000450892668	FF	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC[C@](C)(OC)CC2)c(OC)c1	ZINC000450892668	FF	On-Demand	Anodyne	HTR7	25	41
COc1ccc(CNC(=O)CCN2CCC[C@](C)(OC)CC2)c(OC)c1	ZINC000450892668	FF	On-Demand	Anodyne	MTNR1A	40	37
COc1ccc(CNC(=O)CCN2CCC[C@](C)(OC)CC2)c(OC)c1	ZINC000450892668	FF	On-Demand	Anodyne	MTNR1B	28	43
COc1ccc(CNC(=O)CCN2CCC[C@](C)(OC)CC2)c(OC)c1	ZINC000450892668	FF	On-Demand	Anodyne	EBP	25	40
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(OC)CC2)c(OC)c1	ZINC000450892669	FF	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(OC)CC2)c(OC)c1	ZINC000450892669	FF	On-Demand	Anodyne	HTR7	25	41
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(OC)CC2)c(OC)c1	ZINC000450892669	FF	On-Demand	Anodyne	MTNR1A	40	37
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(OC)CC2)c(OC)c1	ZINC000450892669	FF	On-Demand	Anodyne	MTNR1B	28	43
COc1ccc(CNC(=O)CCN2CCC[C@@](C)(OC)CC2)c(OC)c1	ZINC000450892669	FF	On-Demand	Anodyne	EBP	25	40
CCn1ccnc(N2CCC(NC(=O)c3cnn4ccc(C)cc34)CC2)c1=O	ZINC000450892670	GD	On-Demand	Anodyne	EPHB3	34	43
CCOC(=O)c1ccc(CSCc2ccc([N+](=O)[O-])cc2)nc1	ZINC000450892673	EH	On-Demand	Bother	CACNA1C	22	40
CCOC(=O)c1ccc(CSCc2ccc([N+](=O)[O-])cc2)nc1	ZINC000450892673	EH	On-Demand	Bother	GSTM2	23	46
CCOC(=O)c1ccc(CSCc2ccc([N+](=O)[O-])cc2)nc1	ZINC000450892673	EH	On-Demand	Bother	CCR3	0	40
CCOC(=O)c1ccc(CSCc2ccc([N+](=O)[O-])cc2)nc1	ZINC000450892673	EH	On-Demand	Bother	SLC27A4	44	32
O=C1CC[C@@H](N2CCN(c3ncccc3C(F)(F)F)CC2)CCN1	ZINC000450892674	ED	On-Demand	Anodyne	TRPV1	31	47
O=C1CC[C@H](N2CCN(c3ncccc3C(F)(F)F)CC2)CCN1	ZINC000450892675	ED	On-Demand	Anodyne	TRPV1	31	47
CCOc1cc(N2CCN(Cc3ccc(C(C)=O)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000450892688	GH	On-Demand	Bother	SSTR5	42	34
C=CCC[C@@H](CO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450892718	ED	On-Demand	Mild	BCL2L1	94	40
C=CCC[C@@H](CO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450892718	ED	On-Demand	Mild	BCL2	68	35
C=CCC[C@@H](CO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450892718	ED	On-Demand	Mild	BCL2L2	40	31
C=CCC[C@H](CO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450892720	ED	On-Demand	Mild	BCL2L1	94	40
C=CCC[C@H](CO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450892720	ED	On-Demand	Mild	BCL2	68	35
C=CCC[C@H](CO)Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450892720	ED	On-Demand	Mild	BCL2L2	40	31
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450892721	ED	On-Demand	Mild	TGM2	51	41
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450892721	ED	On-Demand	Mild	F13A1	45	40
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450892722	ED	On-Demand	Mild	TGM2	51	41
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450892722	ED	On-Demand	Mild	F13A1	45	40
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450892730	GG	On-Demand	Anodyne	ENPP2	20	41
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450892730	GG	On-Demand	Anodyne	HPGDS	23	40
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450892731	GG	On-Demand	Anodyne	ENPP2	20	41
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450892731	GG	On-Demand	Anodyne	HPGDS	23	40
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450892734	GG	On-Demand	Anodyne	ENPP2	20	41
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450892734	GG	On-Demand	Anodyne	HPGDS	23	40
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450892736	GG	On-Demand	Anodyne	ENPP2	20	41
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450892736	GG	On-Demand	Anodyne	HPGDS	23	40
COC[C@@]1(CO)CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450892744	ED	On-Demand	Bother	TAAR1	17	44
COC[C@]1(CO)CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450892747	ED	On-Demand	Bother	TAAR1	17	44
C=CCC[C@@H](CO)Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450892748	EE	On-Demand	Mild	TNKS	45	32
C=CCC[C@H](CO)Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450892749	EE	On-Demand	Mild	TNKS	45	32
CCS(=O)(=O)c1ccc(CSc2ccc(C(C)=O)cc2OC)cc1	ZINC000450892756	FH	On-Demand	Anodyne	RORC	46	33
COc1ccc(OC(F)(F)F)c(C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1	ZINC000450892764	GH	On-Demand	Anodyne	KCNK3	19	40
COc1ccc(OC(F)(F)F)c(C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1	ZINC000450892764	GH	On-Demand	Anodyne	KCNK9	25	40
COC[C@@]1(CO)CCN(c2c(C#N)cnc3ccc(Cl)cc23)C1	ZINC000450892786	EF	On-Demand	Mild	SRC	46	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	MME	66	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	ANPEP	59	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	PAPA1_CARPA	51	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	CYSP_TRYCR	64	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	CPA1	41	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	CAPNS1	48	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	CAPN2	45	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	FPR1	40	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892788	FH	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	MME	66	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	ANPEP	59	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	PAPA1_CARPA	51	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	CYSP_TRYCR	64	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	CPA1	41	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	CAPNS1	48	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	CAPN2	45	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	FPR1	40	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892789	FH	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	MME	66	36
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	ANPEP	59	34
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	PAPA1_CARPA	51	41
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	CYSP_TRYCR	64	38
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	CPA1	41	39
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	CAPNS1	48	34
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	CAPN2	45	35
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	FPR1	40	34
CO[C@H](Cc1ccccc1)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450892790	FH	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	MME	66	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	ANPEP	59	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	PAPA1_CARPA	51	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	CYSP_TRYCR	64	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	CPA1	41	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	CAPNS1	48	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	CAPN2	45	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	FPR1	40	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450892791	FH	On-Demand	Anodyne	POL	0	40
COC[C@]1(CO)CCN(c2c(C#N)cnc3ccc(Cl)cc23)C1	ZINC000450892793	EF	On-Demand	Mild	SRC	46	35
CC[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@]2(CCOC2)O1	ZINC000450892794	GH	On-Demand	Anodyne	CYP2J2	49	36
CC[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@]2(CCOC2)O1	ZINC000450892795	GH	On-Demand	Anodyne	CYP2J2	49	36
CC[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@]2(CCOC2)O1	ZINC000450892796	GH	On-Demand	Anodyne	CYP2J2	49	36
CC[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@]2(CCOC2)O1	ZINC000450892797	GH	On-Demand	Anodyne	CYP2J2	49	36
CCOC(=O)c1ccc(N2CC[C@](CO)(COC)C2)nc1	ZINC000450892800	CD	On-Demand	Anodyne	HDAC1	17	43
CCOC(=O)c1ccc(N2CC[C@@](CO)(COC)C2)nc1	ZINC000450892807	CD	On-Demand	Anodyne	HDAC1	17	43
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	HTR1A	65	42
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	DRD2	49	48
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	DRD1	27	43
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	DRD4	40	48
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	ADRA1D	43	40
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	ADRA1A	41	39
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	ADRA1B	32	40
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	DRD3	42	48
CCS(=O)(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1	ZINC000450892820	GE	On-Demand	Anodyne	HTR7	39	41
CCn1cnc2c(c1=O)CCN(CCCCc1ccc(Cl)c(Cl)c1)C2	ZINC000450892835	GH	On-Demand	Anodyne	SIGMAR1	21	46
CCn1cnc2c(c1=O)CCN(CCCCc1ccc(Cl)c(Cl)c1)C2	ZINC000450892835	GH	On-Demand	Anodyne	DNAE	76	36
Cc1cccc(Cl)c1C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450892837	GG	On-Demand	Anodyne	CDK1	21	42
Cc1cccc(Cl)c1C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000450892837	GG	On-Demand	Anodyne	CDK4	22	42
COC[C@@]1(CO)CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450892875	DE	On-Demand	Anodyne	RBP4	18	43
COC[C@]1(CO)CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450892876	DE	On-Demand	Anodyne	RBP4	18	43
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	HTR1A	20	46
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	DRD2	31	44
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	DRD4	24	42
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	HTR2A	28	50
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	ADRA1A	18	45
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	ADRA1B	16	42
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	DRD3	20	50
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	ERG2	21	44
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	HTR7	25	43
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	SIGMAR1	33	44
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	UTS2R	16	46
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	SLC18A3	24	44
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	FAAH	25	40
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccccc3)CC2)c1	ZINC000450892880	FI	On-Demand	Anodyne	CYP2J2	63	48
CCS(=O)(=O)c1ccc(CN2CCC(NS(=O)(=O)NC)CC2)cc1	ZINC000450892886	GC	On-Demand	Anodyne	SSTR5	64	45
CCn1nnc(C)c1CSCc1ccc([N+](=O)[O-])cc1	ZINC000450892916	CF	On-Demand	Bother	SLC29A1	43	38
Cc1nn(C)cc1CSCc1ccc([N+](=O)[O-])cc1	ZINC000450892918	CG	On-Demand	Bother	SLC29A1	54	41
COc1ccc(CNC(=O)CCN(C)[C@H]2CCC(C)(C)C2)c(OC)c1	ZINC000450892921	EG	On-Demand	Anodyne	MTNR1A	49	34
COc1ccc(CNC(=O)CCN(C)[C@@H]2CCC(C)(C)C2)c(OC)c1	ZINC000450892922	EG	On-Demand	Anodyne	MTNR1A	49	34
Cc1cccc(OCCCNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450892954	FD	On-Demand	Anodyne	HRH2	55	42
Cc1cccc(OCCCNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450892954	FD	On-Demand	Anodyne	AVPR1B	50	39
Cc1cccc(OCCCNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450892958	FD	On-Demand	Anodyne	HRH2	55	42
Cc1cccc(OCCCNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450892958	FD	On-Demand	Anodyne	AVPR1B	50	39
C[C@@H](NC(=O)C1(C)CCC(=O)CC1)c1ccc(Cl)c2ccccc12	ZINC000450892960	EJ	On-Demand	Anodyne	SDH1	0	50
C[C@H](NC(=O)C1(C)CCC(=O)CC1)c1ccc(Cl)c2ccccc12	ZINC000450892970	EJ	On-Demand	Anodyne	SDH1	0	50
CC(F)(F)C(C)(C)C(=O)N1CCc2c(F)cccc21	ZINC000450892988	CG	On-Demand	Anodyne	AR	26	41
CC1(C)CN(CCCC(=O)c2ccccc2)C[C@]2(CCCOC2)O1	ZINC000450893017	EG	On-Demand	Anodyne	SLC18A3	0	40
CC1(C)CN(CCCC(=O)c2ccccc2)C[C@]2(CCCOC2)O1	ZINC000450893017	EG	On-Demand	Anodyne	CYP2J2	54	38
CC1(C)CN(CCCC(=O)c2ccccc2)C[C@@]2(CCCOC2)O1	ZINC000450893018	EG	On-Demand	Anodyne	SLC18A3	0	40
CC1(C)CN(CCCC(=O)c2ccccc2)C[C@@]2(CCCOC2)O1	ZINC000450893018	EG	On-Demand	Anodyne	CYP2J2	54	38
O=[S@](CCN1CCC[C@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450893046	DD	On-Demand	Anodyne	SLC6A1	51	34
O=[S@@](CCN1CCC[C@@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450893047	DD	On-Demand	Anodyne	SLC6A1	51	34
O=[S@](CCN1CCC[C@@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450893048	DD	On-Demand	Anodyne	SLC6A1	51	34
O=[S@@](CCN1CCC[C@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450893049	DD	On-Demand	Anodyne	SLC6A1	51	34
Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450893055	GF	On-Demand	Anodyne	HRH3	0	42
CCOC(=O)C1(COC)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450893060	GF	On-Demand	Anodyne	ADAM17	16	40
CCOC(=O)C1(COC)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450893060	GF	On-Demand	Anodyne	MCHR2	46	34
CCOC(=O)C1(COC)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450893060	GF	On-Demand	Anodyne	NPFFR1	45	38
Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450893062	GF	On-Demand	Anodyne	HRH3	0	42
O=C(NC[C@@H]1C[C@H](F)CN1Cc1cccs1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450893080	GG	On-Demand	Anodyne	PDE8B	47	33
O=C(NC[C@@H]1C[C@H](F)CN1Cc1cccs1)[C@H]1CCN(c2ccccc2)C1	ZINC000450893081	GG	On-Demand	Anodyne	PDE8B	47	33
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3ccc4c(c3)OCO4)C2)o1	ZINC000450893086	FD	On-Demand	Anodyne	ACOX1	59	33
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3ccc4c(c3)OCO4)C2)o1	ZINC000450893086	FD	On-Demand	Anodyne	SSTR3	96	35
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3ccc4c(c3)OCO4)C2)o1	ZINC000450893103	FD	On-Demand	Anodyne	ACOX1	59	33
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3ccc4c(c3)OCO4)C2)o1	ZINC000450893103	FD	On-Demand	Anodyne	SSTR3	96	35
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3ccc4c(c3)OCO4)C2)o1	ZINC000450893105	FD	On-Demand	Anodyne	ACOX1	59	33
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3ccc4c(c3)OCO4)C2)o1	ZINC000450893105	FD	On-Demand	Anodyne	SSTR3	96	35
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3ccc4c(c3)OCO4)C2)o1	ZINC000450893107	FD	On-Demand	Anodyne	ACOX1	59	33
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3ccc4c(c3)OCO4)C2)o1	ZINC000450893107	FD	On-Demand	Anodyne	SSTR3	96	35
O=C(CCN1CCC[C@@H](c2nnc(O)o2)C1)Nc1cccnc1	ZINC000450893118	DD	On-Demand	Anodyne	CHRNA7	22	43
O=C(CCN1CCC[C@H](c2nnc(O)o2)C1)Nc1cccnc1	ZINC000450893119	DD	On-Demand	Anodyne	CHRNA7	22	43
C[C@H](O)CCn1cc(-c2cccc([N+](=O)[O-])c2)cn1	ZINC000450893127	CE	On-Demand	Bother	F2RL3	48	35
C[C@@H](O)CCn1cc(-c2cccc([N+](=O)[O-])c2)cn1	ZINC000450893128	CE	On-Demand	Bother	F2RL3	48	35
CC(C)(O)C(C)(C)CNc1ncnc2c1ncn2C1CC1	ZINC000450893132	CE	On-Demand	Anodyne	ADORA1	45	43
CC(C)(O)C(C)(C)CNc1ncnc2c1ncn2C1CC1	ZINC000450893132	CE	On-Demand	Anodyne	ADORA2A	27	48
CC(C)(O)C(C)(C)CNc1ncnc2c1ncn2C1CC1	ZINC000450893132	CE	On-Demand	Anodyne	ADORA3	75	40
CC(C)(O)C(C)(C)CNc1ncnc2c1ncn2C1CC1	ZINC000450893132	CE	On-Demand	Anodyne	OXGR1	52	31
CC(C)(O)C(C)(C)CNc1ncnc2c1ncn2C1CC1	ZINC000450893132	CE	On-Demand	Anodyne	Q4VQ11_PIG	51	40
Cc1ccc(-c2csc(NC(=O)CN3CCC[C@H](c4nnc(O)o4)C3)n2)cc1	ZINC000450893166	GG	On-Demand	Anodyne	HDAC9	15	45
Cc1ccc(-c2csc(NC(=O)CN3CCC[C@H](c4nnc(O)o4)C3)n2)cc1	ZINC000450893166	GG	On-Demand	Anodyne	TRPA1	20	41
Cc1ccc(-c2csc(NC(=O)CN3CCC[C@@H](c4nnc(O)o4)C3)n2)cc1	ZINC000450893168	GG	On-Demand	Anodyne	HDAC9	15	45
Cc1ccc(-c2csc(NC(=O)CN3CCC[C@@H](c4nnc(O)o4)C3)n2)cc1	ZINC000450893168	GG	On-Demand	Anodyne	TRPA1	20	41
CC(C)(O)C(C)(C)CNc1ncnc2sc3c(c12)CCC3	ZINC000450893171	DG	On-Demand	Anodyne	RBP4	16	41
Cc1nc(C(C)C)oc1CSCc1ccc([N+](=O)[O-])cc1	ZINC000450893177	DI	On-Demand	Bother	SLC29A1	42	35
Cc1nc2ccccc2n1C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450893182	FH	On-Demand	Anodyne	AKT2	15	43
C[C@@H](O)CCN1CC=C(c2cccc(Cl)c2)CC1	ZINC000450893200	CG	On-Demand	Anodyne	DRD2	0	46
C[C@H](O)CCN1CC=C(c2cccc(Cl)c2)CC1	ZINC000450893201	CG	On-Demand	Anodyne	DRD2	0	46
N#Cc1ccc(N2CCN([C@@H]3CCNC(=O)CC3)CC2)cc1C(F)(F)F	ZINC000450893220	FE	On-Demand	Mild	AR	56	53
N#Cc1ccc(N2CCN([C@H]3CCNC(=O)CC3)CC2)cc1C(F)(F)F	ZINC000450893221	FE	On-Demand	Mild	AR	56	53
CN1C(=O)CC[C@H]1C(=O)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450893239	FH	On-Demand	Anodyne	KCNQ2	25	41
CN1C(=O)CC[C@H]1C(=O)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450893239	FH	On-Demand	Anodyne	P2RX7	60	47
CN1C(=O)CC[C@@H]1C(=O)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450893240	FH	On-Demand	Anodyne	KCNQ2	25	41
CN1C(=O)CC[C@@H]1C(=O)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450893240	FH	On-Demand	Anodyne	P2RX7	60	47
CCO[C@@H]1COC[C@H]1Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450893241	EE	On-Demand	Bother	MAOB	17	47
Oc1nnc([C@@H]2CCCN(CCSc3ccnc4cc(Cl)ccc34)C2)o1	ZINC000450893248	GH	On-Demand	Anodyne	HRP1_PLAFA	84	38
Oc1nnc([C@@H]2CCCN(CCSc3ccnc4cc(Cl)ccc34)C2)o1	ZINC000450893248	GH	On-Demand	Anodyne	HNMT	54	38
Oc1nnc([C@H]2CCCN(CCSc3ccnc4cc(Cl)ccc34)C2)o1	ZINC000450893250	GH	On-Demand	Anodyne	HRP1_PLAFA	84	38
Oc1nnc([C@H]2CCCN(CCSc3ccnc4cc(Cl)ccc34)C2)o1	ZINC000450893250	GH	On-Demand	Anodyne	HNMT	54	38
COc1cc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cc(C)no2)ccc1O	ZINC000450893285	GD	On-Demand	Anodyne	TRPV1	0	44
CC(C)N1CCCC[C@@H]1CN(C)[C@@H](CC(N)=O)c1ccccc1	ZINC000450893295	DF	On-Demand	Anodyne	OPRK1	25	40
CC(C)N1CCCC[C@@H]1CN(C)[C@@H](CC(N)=O)c1ccccc1	ZINC000450893295	DF	On-Demand	Anodyne	AMY2	48	33
CC(C)N1CCCC[C@@H]1CN(C)[C@H](CC(N)=O)c1ccccc1	ZINC000450893296	DF	On-Demand	Anodyne	OPRK1	25	40
CC(C)N1CCCC[C@@H]1CN(C)[C@H](CC(N)=O)c1ccccc1	ZINC000450893296	DF	On-Demand	Anodyne	AMY2	48	33
CC(C)N1CCCC[C@H]1CN(C)[C@@H](CC(N)=O)c1ccccc1	ZINC000450893297	DF	On-Demand	Anodyne	OPRK1	25	40
CC(C)N1CCCC[C@H]1CN(C)[C@@H](CC(N)=O)c1ccccc1	ZINC000450893297	DF	On-Demand	Anodyne	AMY2	48	33
CC(C)N1CCCC[C@H]1CN(C)[C@H](CC(N)=O)c1ccccc1	ZINC000450893298	DF	On-Demand	Anodyne	OPRK1	25	40
CC(C)N1CCCC[C@H]1CN(C)[C@H](CC(N)=O)c1ccccc1	ZINC000450893298	DF	On-Demand	Anodyne	AMY2	48	33
CCN(c1ccccc1)S(=O)(=O)c1ccc(NCC(C)(C)C(C)(C)O)nc1	ZINC000450893330	GH	On-Demand	Anodyne	NR1I2	19	44
Cc1ccc(C(=O)N2CCN(c3ccccc3)C(=O)C2)c(C(C)C)n1	ZINC000450893334	EG	On-Demand	Anodyne	P2RX7	23	45
CCCOc1ccc(C(C)(C)NCC2(C(=O)OC)CC2)cc1	ZINC000450893351	DG	On-Demand	Anodyne	PLA2G4B	46	35
CCC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893377	CD	On-Demand	Anodyne	HTR1A	43	45
CCC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893377	CD	On-Demand	Anodyne	DRD2	33	43
CCC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893377	CD	On-Demand	Anodyne	DRD4	25	41
CCC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893377	CD	On-Demand	Anodyne	ADRA1D	39	46
CCC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893377	CD	On-Demand	Anodyne	ADRA1A	27	42
CCC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893377	CD	On-Demand	Anodyne	ADRA1B	23	46
CCC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893377	CD	On-Demand	Anodyne	ABCB1	44	38
CCC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893378	CD	On-Demand	Anodyne	HTR1A	43	45
CCC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893378	CD	On-Demand	Anodyne	DRD2	33	43
CCC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893378	CD	On-Demand	Anodyne	DRD4	25	41
CCC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893378	CD	On-Demand	Anodyne	ADRA1D	39	46
CCC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893378	CD	On-Demand	Anodyne	ADRA1A	27	42
CCC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893378	CD	On-Demand	Anodyne	ADRA1B	23	46
CCC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450893378	CD	On-Demand	Anodyne	ABCB1	44	38
O=c1c2c(ncn1CCc1ccc(Cl)cc1)CN(Cc1ccccc1)CC2	ZINC000450893452	GH	On-Demand	Anodyne	DRD2	17	41
O=c1c2c(ncn1CCc1ccc(Cl)cc1)CN(Cc1ccccc1)CC2	ZINC000450893452	GH	On-Demand	Anodyne	SIGMAR1	26	45
O=c1c2c(ncn1CCc1ccc(Cl)cc1)CN(Cc1ccccc1)CC2	ZINC000450893452	GH	On-Demand	Anodyne	NOD1	25	40
CC(C)(O)C(C)(C)CNc1ncc(C#N)cc1Cl	ZINC000450893458	CF	On-Demand	Mild	IRAK4	15	42
O=C(CC1CC(F)(F)C1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450893469	FK	On-Demand	Anodyne	KCNQ2	21	40
Cc1nc(-c2cccc(NC(=O)CN3CCC[C@H](c4nnc(O)o4)C3)c2)cs1	ZINC000450893474	GG	On-Demand	Anodyne	DRD4	0	42
Cc1nc(-c2cccc(NC(=O)CN3CCC[C@H](c4nnc(O)o4)C3)c2)cs1	ZINC000450893474	GG	On-Demand	Anodyne	ACOX1	42	38
Cc1nc(-c2cccc(NC(=O)CN3CCC[C@H](c4nnc(O)o4)C3)c2)cs1	ZINC000450893474	GG	On-Demand	Anodyne	CCKBR	15	49
Cc1nc(-c2cccc(NC(=O)CN3CCC[C@@H](c4nnc(O)o4)C3)c2)cs1	ZINC000450893476	GG	On-Demand	Anodyne	DRD4	0	42
Cc1nc(-c2cccc(NC(=O)CN3CCC[C@@H](c4nnc(O)o4)C3)c2)cs1	ZINC000450893476	GG	On-Demand	Anodyne	ACOX1	42	38
Cc1nc(-c2cccc(NC(=O)CN3CCC[C@@H](c4nnc(O)o4)C3)c2)cs1	ZINC000450893476	GG	On-Demand	Anodyne	CCKBR	15	49
Oc1nnc([C@H]2CCCN(CCCOc3ccc4ccccc4c3)C2)o1	ZINC000450893492	FH	On-Demand	Anodyne	KCNH2	0	41
Oc1nnc([C@H]2CCCN(CCCOc3ccc4ccccc4c3)C2)o1	ZINC000450893492	FH	On-Demand	Anodyne	SIGMAR1	26	44
Oc1nnc([C@H]2CCCN(CCCOc3ccc4ccccc4c3)C2)o1	ZINC000450893492	FH	On-Demand	Anodyne	CHRNA10	41	33
Oc1nnc([C@H]2CCCN(CCCOc3ccc4ccccc4c3)C2)o1	ZINC000450893492	FH	On-Demand	Anodyne	MEN1	48	33
Oc1nnc([C@@H]2CCCN(CCCOc3ccc4ccccc4c3)C2)o1	ZINC000450893493	FH	On-Demand	Anodyne	KCNH2	0	41
Oc1nnc([C@@H]2CCCN(CCCOc3ccc4ccccc4c3)C2)o1	ZINC000450893493	FH	On-Demand	Anodyne	SIGMAR1	26	44
Oc1nnc([C@@H]2CCCN(CCCOc3ccc4ccccc4c3)C2)o1	ZINC000450893493	FH	On-Demand	Anodyne	CHRNA10	41	33
Oc1nnc([C@@H]2CCCN(CCCOc3ccc4ccccc4c3)C2)o1	ZINC000450893493	FH	On-Demand	Anodyne	MEN1	48	33
COc1cc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)ccc1Cl	ZINC000450893494	GH	On-Demand	Anodyne	DRD4	28	43
COc1cc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)ccc1Cl	ZINC000450893494	GH	On-Demand	Anodyne	ACHE	15	43
COc1cc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)ccc1Cl	ZINC000450893494	GH	On-Demand	Anodyne	DRD3	0	43
COc1cc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)ccc1Cl	ZINC000450893494	GH	On-Demand	Anodyne	UTS2R	17	40
COc1cc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)ccc1Cl	ZINC000450893494	GH	On-Demand	Anodyne	ABCB1B	46	33
COc1cc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)ccc1Cl	ZINC000450893494	GH	On-Demand	Anodyne	NOX1	52	38
COc1cc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)ccc1Cl	ZINC000450893494	GH	On-Demand	Anodyne	NOX5	48	38
CC(C)(O)C(C)(C)CNc1cc(N2CCC[C@@H]2CO)ncn1	ZINC000450893505	DD	On-Demand	Anodyne	PRCP	0	42
CC(C)(O)C(C)(C)CNc1cc(N2CCC[C@H]2CO)ncn1	ZINC000450893507	DD	On-Demand	Anodyne	PRCP	0	42
COc1cc(OC)c2ncnc(N3CCN([C@@H]4CCNC(=O)CC4)CC3)c2c1	ZINC000450893525	GD	On-Demand	Anodyne	PDE3A	45	35
COc1cc(OC)c2ncnc(N3CCN([C@@H]4CCNC(=O)CC4)CC3)c2c1	ZINC000450893525	GD	On-Demand	Anodyne	PDE3B	67	35
COc1cc(OC)c2ncnc(N3CCN([C@H]4CCNC(=O)CC4)CC3)c2c1	ZINC000450893526	GD	On-Demand	Anodyne	PDE3A	45	35
COc1cc(OC)c2ncnc(N3CCN([C@H]4CCNC(=O)CC4)CC3)c2c1	ZINC000450893526	GD	On-Demand	Anodyne	PDE3B	67	35
COc1cc(CC(=O)N[C@@H]2CCCN(c3ncc[nH]c3=O)C2)ccc1Cl	ZINC000450893527	GD	On-Demand	Anodyne	HTR4	42	34
COc1cc(CC(=O)N[C@H]2CCCN(c3ncc[nH]c3=O)C2)ccc1Cl	ZINC000450893528	GD	On-Demand	Anodyne	HTR4	42	34
O=C1CC[C@H](N2CCN(c3ncc(-c4ccccc4)s3)CC2)CCN1	ZINC000450893544	FF	On-Demand	Anodyne	LUCI_LUCLA	17	40
O=C1CC[C@@H](N2CCN(c3ncc(-c4ccccc4)s3)CC2)CCN1	ZINC000450893545	FF	On-Demand	Anodyne	LUCI_LUCLA	17	40
CC(C)OC(=O)CCCNC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450893567	EH	On-Demand	Anodyne	PDS	50	36
COC(=O)c1ccc(CN2CCN(C)[C@H](c3nccn3C)C2)cc1Cl	ZINC000450893571	FE	On-Demand	Anodyne	MCHR1	17	40
COC(=O)c1ccc(CN2CCN(C)[C@@H](c3nccn3C)C2)cc1Cl	ZINC000450893574	FE	On-Demand	Anodyne	MCHR1	17	40
COc1ccc(CNC(=O)CCN2CCC(c3nc(O)n[nH]3)CC2)c(OC)c1	ZINC000450893582	GD	On-Demand	Anodyne	HTR7	33	41
COc1ccc(CNC(=O)CCN2CCC(c3nc(O)n[nH]3)CC2)c(OC)c1	ZINC000450893582	GD	On-Demand	Anodyne	CARM1	55	33
COc1ccc(CNC(=O)CCn2cnc3cc(F)c(C)cc3c2=O)c(OC)c1	ZINC000450893587	GF	On-Demand	Anodyne	PDGFRB	40	45
COc1ccc(CNC(=O)CCn2cnc3cc(F)c(C)cc3c2=O)c(OC)c1	ZINC000450893587	GF	On-Demand	Anodyne	P2RX7	43	39
COc1ccc(CNC(=O)CCn2cnc3cc(F)c(C)cc3c2=O)c(OC)c1	ZINC000450893587	GF	On-Demand	Anodyne	PDGFRA	26	44
COc1ccc(CNC(=O)CCn2cnc3cc(F)c(C)cc3c2=O)c(OC)c1	ZINC000450893587	GF	On-Demand	Anodyne	CSF1R	17	45
O=C(CCCC(=O)C1CC1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450893607	FK	On-Demand	Anodyne	KCNQ2	19	43
O=C(CCCC(=O)C1CC1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450893607	FK	On-Demand	Anodyne	HDAC1	28	40
O=C(CCCC(=O)C1CC1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450893607	FK	On-Demand	Anodyne	HDAC3	17	46
Cc1cc(Br)c(NC(=O)c2nn(C)c3c2CCCC3)cc1Cl	ZINC000450893611	GI	On-Demand	Anodyne	CNR1	52	32
CCOC(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)nc1	ZINC000450893614	FG	On-Demand	Anodyne	P2RY12	27	43
O=C1CC[C@@H](N2CCN(c3ncc(Br)cc3Cl)CC2)CCN1	ZINC000450893617	GE	On-Demand	Anodyne	CXCR3	15	42
O=C1CC[C@H](N2CCN(c3ncc(Br)cc3Cl)CC2)CCN1	ZINC000450893623	GE	On-Demand	Anodyne	CXCR3	15	42
CCO[C@@H]1COC[C@H]1Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450893625	DF	On-Demand	Mild	AR	49	41
CCOC(=O)c1ccc(Cn2ncc(C(=O)OCC)c2C#N)nc1	ZINC000450893642	ED	On-Demand	Mild	P2RY12	41	38
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	HTR1A	72	44
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	DRD2	71	44
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	DRD4	74	43
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	ADRA1D	46	41
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	ADRA1A	41	41
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	DRD3	78	44
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	HTR4	35	42
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	HTR7	44	44
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	SSTR5	47	38
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	CCR3	16	40
COC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)cc1Cl	ZINC000450893651	GF	On-Demand	Anodyne	MCHR1	16	40
COc1cc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cccs2)ccc1O	ZINC000450893675	GF	On-Demand	Anodyne	TRPV1	0	43
COC[C@]1(CO)CCN(c2cncc(Br)c2)C1	ZINC000450893730	DD	On-Demand	Anodyne	CHRNA4	15	43
COC[C@@]1(CO)CCN(c2cncc(Br)c2)C1	ZINC000450893731	DD	On-Demand	Anodyne	CHRNA4	15	43
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)CS(=O)(=O)C1CC1	ZINC000450893742	GD	On-Demand	Anodyne	MTR1B_CHICK	0	41
COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)CS(=O)(=O)C1CC1	ZINC000450893742	GD	On-Demand	Anodyne	HTR6	43	36
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)CS(=O)(=O)C1CC1	ZINC000450893743	GD	On-Demand	Anodyne	MTR1B_CHICK	0	41
COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)CS(=O)(=O)C1CC1	ZINC000450893743	GD	On-Demand	Anodyne	HTR6	43	36
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)CS(=O)(=O)C1CC1	ZINC000450893744	GD	On-Demand	Anodyne	MTR1B_CHICK	0	41
COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)CS(=O)(=O)C1CC1	ZINC000450893744	GD	On-Demand	Anodyne	HTR6	43	36
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)CS(=O)(=O)C1CC1	ZINC000450893745	GD	On-Demand	Anodyne	MTR1B_CHICK	0	41
COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)CS(=O)(=O)C1CC1	ZINC000450893745	GD	On-Demand	Anodyne	HTR6	43	36
COC(=O)c1ccc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cc(C)no2)cc1	ZINC000450893755	GE	On-Demand	Anodyne	ITGA4	40	33
COCc1cc([N+](=O)[O-])ccc1NCC(C)(C)C(C)(C)O	ZINC000450893762	CF	On-Demand	Bother	CACNA1D	48	32
COCc1cc([N+](=O)[O-])ccc1NCC(C)(C)C(C)(C)O	ZINC000450893762	CF	On-Demand	Bother	F2RL3	44	37
COc1ccc(CNC(=O)CCSCc2cccc(C(N)=O)n2)c(OC)c1	ZINC000450893781	GE	On-Demand	Anodyne	MTNR1A	56	39
COc1ccc(CNC(=O)CCSCc2cccc(C(N)=O)n2)c(OC)c1	ZINC000450893781	GE	On-Demand	Anodyne	MTNR1B	47	36
CCC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000450893812	DE	On-Demand	Anodyne	DRD4	26	49
CCC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000450893812	DE	On-Demand	Anodyne	NPFFR1	46	33
CCC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000450893813	DE	On-Demand	Anodyne	DRD4	26	49
CCC(=O)C1(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000450893813	DE	On-Demand	Anodyne	NPFFR1	46	33
CCC(=O)C1(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000450893814	DE	On-Demand	Anodyne	DRD4	26	49
CCC(=O)C1(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000450893814	DE	On-Demand	Anodyne	NPFFR1	46	33
CCC(=O)C1(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000450893815	DE	On-Demand	Anodyne	DRD4	26	49
CCC(=O)C1(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000450893815	DE	On-Demand	Anodyne	NPFFR1	46	33
C[C@@H](O)CCSCc1cccc(C(N)=O)n1	ZINC000450893817	BD	On-Demand	Anodyne	CACNA2D1	46	35
C[C@H](O)CCSCc1cccc(C(N)=O)n1	ZINC000450893818	BD	On-Demand	Anodyne	CACNA2D1	46	35
CCO[C@@H]1COC[C@H]1Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450893823	FG	On-Demand	Bother	GSTM2	43	31
COCCOCCOc1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450893832	GE	On-Demand	Anodyne	HRH3	27	49
COc1cc(CC(=O)N[C@H]2CCCN(c3nccn(C)c3=O)C2)ccc1Cl	ZINC000450893834	GD	On-Demand	Anodyne	HTR4	54	36
COCCOCCOc1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450893835	GE	On-Demand	Anodyne	HRH3	27	49
COc1cc(CC(=O)N[C@@H]2CCCN(c3nccn(C)c3=O)C2)ccc1Cl	ZINC000450893836	GD	On-Demand	Anodyne	HTR4	54	36
CCO[C@@H]1COC[C@H]1Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000450893844	GG	On-Demand	Bother	TAAR1	21	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893845	EE	On-Demand	Anodyne	DRD4	27	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893845	EE	On-Demand	Anodyne	SIGMAR1	38	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893845	EE	On-Demand	Anodyne	NPFFR1	42	31
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893847	EE	On-Demand	Anodyne	DRD4	27	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893847	EE	On-Demand	Anodyne	SIGMAR1	38	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893847	EE	On-Demand	Anodyne	NPFFR1	42	31
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893849	EE	On-Demand	Anodyne	DRD4	27	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893849	EE	On-Demand	Anodyne	SIGMAR1	38	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893849	EE	On-Demand	Anodyne	NPFFR1	42	31
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893851	EE	On-Demand	Anodyne	DRD4	27	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893851	EE	On-Demand	Anodyne	SIGMAR1	38	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450893851	EE	On-Demand	Anodyne	NPFFR1	42	31
N#Cc1cccc(CNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450893860	ED	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(CNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450893861	ED	On-Demand	Mild	CCR3	19	41
Cc1cccc(CC2(O)CCN(CC[C@H](C)O)CC2)c1	ZINC000450893896	CE	On-Demand	Anodyne	UTS2R	0	46
Cc1cccc(CC2(O)CCN(CC[C@@H](C)O)CC2)c1	ZINC000450893897	CE	On-Demand	Anodyne	UTS2R	0	46
C[C@](NC(=O)c1ccc(N2CCC2)nc1)(c1ccccc1)C(F)(F)F	ZINC000450893910	EG	On-Demand	Anodyne	DGAT1	36	41
C[C@](NC(=O)c1ccc(N2CCC2)nc1)(c1ccccc1)C(F)(F)F	ZINC000450893910	EG	On-Demand	Anodyne	HPGDS	30	47
C[C@@](NC(=O)c1ccc(N2CCC2)nc1)(c1ccccc1)C(F)(F)F	ZINC000450893911	EG	On-Demand	Anodyne	DGAT1	36	41
C[C@@](NC(=O)c1ccc(N2CCC2)nc1)(c1ccccc1)C(F)(F)F	ZINC000450893911	EG	On-Demand	Anodyne	HPGDS	30	47
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1ncc[nH]1	ZINC000450893921	EF	On-Demand	Anodyne	DRD2	29	40
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1ncc[nH]1	ZINC000450893921	EF	On-Demand	Anodyne	DRD4	0	45
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1ncc[nH]1	ZINC000450893921	EF	On-Demand	Anodyne	SLC18A3	0	41
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1ncc[nH]1	ZINC000450893921	EF	On-Demand	Anodyne	HTR3B	0	43
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1ncc[nH]1	ZINC000450893921	EF	On-Demand	Anodyne	CYP2J2	49	36
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1ncc[nH]1	ZINC000450893922	EF	On-Demand	Anodyne	DRD2	29	40
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1ncc[nH]1	ZINC000450893922	EF	On-Demand	Anodyne	DRD4	0	45
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1ncc[nH]1	ZINC000450893922	EF	On-Demand	Anodyne	SLC18A3	0	41
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1ncc[nH]1	ZINC000450893922	EF	On-Demand	Anodyne	HTR3B	0	43
CCN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1ncc[nH]1	ZINC000450893922	EF	On-Demand	Anodyne	CYP2J2	49	36
CCS(=O)(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1	ZINC000450893925	GG	On-Demand	Anodyne	ADAM17	22	40
CCS(=O)(=O)c1ccc(CN2CCC(O)(Cc3cccc(C)c3)CC2)cc1	ZINC000450893925	GG	On-Demand	Anodyne	MCHR2	49	32
COc1cc(CC(=O)Nc2c(C)c(C(F)(F)F)nn2C)ccc1Cl	ZINC000450893931	FH	On-Demand	Anodyne	CCR1	26	42
COc1cc(CC(=O)Nc2c(C)c(C(F)(F)F)nn2C)ccc1Cl	ZINC000450893931	FH	On-Demand	Anodyne	IMDH_CRYPV	25	46
C[C@@H](O)CCN1CCC(c2cccc(Cl)c2)CC1	ZINC000450893932	CG	On-Demand	Anodyne	DRD2	26	52
C[C@@H](O)CCN1CCC(c2cccc(Cl)c2)CC1	ZINC000450893932	CG	On-Demand	Anodyne	DRD4	0	40
C[C@@H](O)CCN1CCC(c2cccc(Cl)c2)CC1	ZINC000450893932	CG	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@H](O)CCN1CCC(c2cccc(Cl)c2)CC1	ZINC000450893933	CG	On-Demand	Anodyne	DRD2	26	52
C[C@H](O)CCN1CCC(c2cccc(Cl)c2)CC1	ZINC000450893933	CG	On-Demand	Anodyne	DRD4	0	40
C[C@H](O)CCN1CCC(c2cccc(Cl)c2)CC1	ZINC000450893933	CG	On-Demand	Anodyne	VACHT_TETCF	0	40
Cc1nc2ccccc2n1C1CCN(C[C@@H]2CCCCN2C(C)C)CC1	ZINC000450893934	FI	On-Demand	Anodyne	CCR5	20	42
Cc1nc2ccccc2n1C1CCN(C[C@H]2CCCCN2C(C)C)CC1	ZINC000450893935	FI	On-Demand	Anodyne	CCR5	20	42
COc1cc(CN(C)[C@@H](CC(N)=O)c2ccccc2)ccc1Cl	ZINC000450893942	EG	On-Demand	Anodyne	OPRK1	0	46
COc1cc(CN(C)[C@H](CC(N)=O)c2ccccc2)ccc1Cl	ZINC000450893943	EG	On-Demand	Anodyne	OPRK1	0	46
Cc1nc2ccccc2n1C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450893945	EJ	On-Demand	Anodyne	OPRL1	21	46
Cc1nc2ccccc2n1C1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450893945	EJ	On-Demand	Anodyne	CCR5	20	49
Cc1nc2ccccc2n1C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450893946	EJ	On-Demand	Anodyne	OPRL1	21	46
Cc1nc2ccccc2n1C1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450893946	EJ	On-Demand	Anodyne	CCR5	20	49
COC[C@@]1(CO)CCN(c2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000450893958	DE	On-Demand	Mild	AR	55	48
COC[C@]1(CO)CCN(c2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000450893959	DE	On-Demand	Mild	AR	55	48
CCC(=O)CCCN1Cc2ccc(C)cc2C1	ZINC000450893960	BG	On-Demand	Anodyne	DPP9	17	47
C[C@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)CC12CCCCC2	ZINC000450893980	EH	On-Demand	Anodyne	L3MBTL3	45	35
C[C@@H]1CCN(C(=O)c2ccc(N3CCC3)nc2)CC12CCCCC2	ZINC000450893983	EH	On-Demand	Anodyne	L3MBTL3	45	35
C[C@H]1OCC[C@H]1N(CCO)CCCC(=O)c1ccccc1	ZINC000450894008	CE	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1OCC[C@H]1N(CCO)CCCC(=O)c1ccccc1	ZINC000450894009	CE	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1OCC[C@@H]1N(CCO)CCCC(=O)c1ccccc1	ZINC000450894010	CE	On-Demand	Anodyne	CYP2J2	47	34
C[C@H]1OCC[C@@H]1N(CCO)CCCC(=O)c1ccccc1	ZINC000450894011	CE	On-Demand	Anodyne	CYP2J2	47	34
O=C(CSC1CC1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450894022	EJ	On-Demand	Anodyne	KCNQ2	23	44
COc1cnccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450894035	FE	On-Demand	Anodyne	DRD2	20	44
COc1cnccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450894035	FE	On-Demand	Anodyne	DRD4	27	41
COc1cnccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450894035	FE	On-Demand	Anodyne	DRD3	20	44
COc1cnccc1N1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450894035	FE	On-Demand	Anodyne	HTR7	16	41
O=C(NC[C@@H]1C[C@H](F)CN1Cc1cccs1)c1cncc(Cl)c1	ZINC000450894044	FG	On-Demand	Anodyne	CACNA1I	42	32
Cc1cccc(Cl)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894050	EH	On-Demand	Anodyne	DRD4	39	56
Cc1cccc(Cl)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894050	EH	On-Demand	Anodyne	DRD3	16	56
Cc1cccc(Cl)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894050	EH	On-Demand	Anodyne	SIGMAR1	28	43
Cc1cccc(Cl)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894053	EH	On-Demand	Anodyne	DRD4	39	56
Cc1cccc(Cl)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894053	EH	On-Demand	Anodyne	DRD3	16	56
Cc1cccc(Cl)c1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894053	EH	On-Demand	Anodyne	SIGMAR1	28	43
Cc1cccc(Cl)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894055	EH	On-Demand	Anodyne	DRD4	39	56
Cc1cccc(Cl)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894055	EH	On-Demand	Anodyne	DRD3	16	56
Cc1cccc(Cl)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894055	EH	On-Demand	Anodyne	SIGMAR1	28	43
Cc1cccc(Cl)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894057	EH	On-Demand	Anodyne	DRD4	39	56
Cc1cccc(Cl)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894057	EH	On-Demand	Anodyne	DRD3	16	56
Cc1cccc(Cl)c1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894057	EH	On-Demand	Anodyne	SIGMAR1	28	43
CN1CCN(c2nc3ccccc3nc2NCC(C)(C)C(C)(C)O)CC1	ZINC000450894059	FF	On-Demand	Anodyne	HTR3A	24	55
CC(=O)c1ccc(CN2Cc3ccc(C)cc3C2)cc1	ZINC000450894076	CH	On-Demand	Anodyne	DRD4	18	41
CC(=O)c1ccc(CN2Cc3ccc(C)cc3C2)cc1	ZINC000450894076	CH	On-Demand	Anodyne	DPP9	0	41
CC(=O)c1ccc(CN2Cc3ccc(C)cc3C2)cc1	ZINC000450894076	CH	On-Demand	Anodyne	NOD2	45	38
CC(=O)N[C@H](C(=O)Nc1ccccc1NCc1ccc(Cl)cc1)C(C)(C)C	ZINC000450894082	GI	On-Demand	Anodyne	MMP3	21	40
CC(=O)N[C@H](C(=O)Nc1ccccc1NCc1ccc(Cl)cc1)C(C)(C)C	ZINC000450894082	GI	On-Demand	Anodyne	AMP1_PLAFQ	23	42
CCO[C@@H]1COC[C@H]1Nc1ncnc2ccc(I)cc12	ZINC000450894110	GE	On-Demand	Anodyne	CD38	51	35
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450894111	CE	On-Demand	Mild	DRD4	25	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450894111	CE	On-Demand	Mild	DRD3	15	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450894112	CE	On-Demand	Mild	DRD4	25	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450894112	CE	On-Demand	Mild	DRD3	15	52
C[C@H]1C[C@@]1(C#N)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894113	CE	On-Demand	Mild	DRD4	25	52
C[C@H]1C[C@@]1(C#N)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894113	CE	On-Demand	Mild	DRD3	15	52
C[C@H]1C[C@]1(C#N)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894114	CE	On-Demand	Mild	DRD4	25	52
C[C@H]1C[C@]1(C#N)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894114	CE	On-Demand	Mild	DRD3	15	52
CCO[C@@H]1COC[C@H]1Nc1ccnc2cc(Cl)ccc12	ZINC000450894117	CG	On-Demand	Anodyne	HRP1_PLAFA	105	47
CCO[C@@H]1COC[C@H]1Nc1ccnc2cc(Cl)ccc12	ZINC000450894117	CG	On-Demand	Anodyne	HNMT	60	42
CCO[C@@H]1COC[C@H]1Nc1ccnc2cc(Cl)ccc12	ZINC000450894117	CG	On-Demand	Anodyne	RBP_CHICK	0	41
CCS(=O)(=O)c1ccc(COc2ccc([N+](=O)[O-])cc2C)cc1	ZINC000450894171	EG	On-Demand	Bother	CYP19A1	0	54
CC(C)CC(CC(C)C)C(=O)Nc1ccccc1C[S@@](C)=O	ZINC000450894184	DI	On-Demand	Anodyne	ANPEP	33	41
CC(C)CC(CC(C)C)C(=O)Nc1ccccc1C[S@@](C)=O	ZINC000450894184	DI	On-Demand	Anodyne	KCNQ2	43	34
CC(C)CC(CC(C)C)C(=O)Nc1ccccc1C[S@](C)=O	ZINC000450894185	DI	On-Demand	Anodyne	ANPEP	33	41
CC(C)CC(CC(C)C)C(=O)Nc1ccccc1C[S@](C)=O	ZINC000450894185	DI	On-Demand	Anodyne	KCNQ2	43	34
COc1ccc(CNC(=O)CCN(C)Cc2cnccc2C)c(OC)c1	ZINC000450894186	FF	On-Demand	Anodyne	PDGFRB	33	41
COc1ccc(CNC(=O)CCN(C)Cc2cnccc2C)c(OC)c1	ZINC000450894186	FF	On-Demand	Anodyne	MTNR1A	41	37
COc1cc(C(C)=O)ccc1SCC[C@H]1CCOC1	ZINC000450894201	CG	On-Demand	Anodyne	PDEC	0	44
COc1cc(C(C)=O)ccc1SCC[C@@H]1CCOC1	ZINC000450894202	CG	On-Demand	Anodyne	PDEC	0	44
CC(=O)CCCCCn1cnc2c(c1=O)CCN(Cc1ccccc1)C2	ZINC000450894274	FF	On-Demand	Anodyne	HTR7	16	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450894279	GH	On-Demand	Anodyne	DRD4	24	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450894279	GH	On-Demand	Anodyne	PA	25	41
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450894280	GH	On-Demand	Anodyne	DRD4	24	47
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450894280	GH	On-Demand	Anodyne	PA	25	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450894281	GH	On-Demand	Anodyne	DRD4	24	47
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450894281	GH	On-Demand	Anodyne	PA	25	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450894282	GH	On-Demand	Anodyne	DRD4	24	47
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450894282	GH	On-Demand	Anodyne	PA	25	41
Cc1cc(CN2C[C@@H](F)C[C@H]2CNC(=O)c2cncc(Cl)c2)on1	ZINC000450894293	FE	On-Demand	Anodyne	CACNA1I	55	33
CC[C@H](O)CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894294	CD	On-Demand	Anodyne	DRD4	24	51
CC[C@H](O)CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894294	CD	On-Demand	Anodyne	SIGMAR1	30	42
CC[C@H](O)CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894294	CD	On-Demand	Anodyne	NPFFR1	46	34
CC[C@H](O)CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894295	CD	On-Demand	Anodyne	DRD4	24	51
CC[C@H](O)CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894295	CD	On-Demand	Anodyne	SIGMAR1	30	42
CC[C@H](O)CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450894295	CD	On-Demand	Anodyne	NPFFR1	46	34
CC[C@H](O)CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894296	CD	On-Demand	Anodyne	DRD4	24	51
CC[C@H](O)CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894296	CD	On-Demand	Anodyne	SIGMAR1	30	42
CC[C@H](O)CC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894296	CD	On-Demand	Anodyne	NPFFR1	46	34
CC[C@H](O)CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894297	CD	On-Demand	Anodyne	DRD4	24	51
CC[C@H](O)CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894297	CD	On-Demand	Anodyne	SIGMAR1	30	42
CC[C@H](O)CC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450894297	CD	On-Demand	Anodyne	NPFFR1	46	34
CC(C)(O)C(C)(C)CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000450894311	ED	On-Demand	Bother	CA9	15	41
CCO[C@@H]1COC[C@H]1Nc1nc(N)c2cc(OC)c(OC)cc2n1	ZINC000450894312	ED	On-Demand	Anodyne	EHMT2	42	37
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000450894330	GD	On-Demand	Mild	BCL2L1	103	35
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000450894330	GD	On-Demand	Mild	BCL2	88	40
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000450894330	GD	On-Demand	Mild	BCL2L2	45	32
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000450894332	GD	On-Demand	Mild	BCL2L1	103	35
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000450894332	GD	On-Demand	Mild	BCL2	88	40
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000450894332	GD	On-Demand	Mild	BCL2L2	45	32
COC(=O)c1csc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)n1	ZINC000450894335	GE	On-Demand	Anodyne	NOD2	42	37
COc1cnccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450894346	DD	On-Demand	Anodyne	HTR1A	63	42
COc1cnccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450894346	DD	On-Demand	Anodyne	DRD2	43	38
COc1cnccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450894346	DD	On-Demand	Anodyne	DRD1	27	41
COc1cnccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450894346	DD	On-Demand	Anodyne	DRD4	27	41
COc1cnccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450894346	DD	On-Demand	Anodyne	HTR2A	32	50
COc1cnccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450894346	DD	On-Demand	Anodyne	ADRA1A	42	42
COc1cnccc1N1CCN(CC2CCC(=O)CC2)CC1	ZINC000450894346	DD	On-Demand	Anodyne	HTR7	38	40
Cc1cc(=NCC(C)(C)C(C)(C)O)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450894362	EF	On-Demand	Bother	GYRB	42	38
Cc1ccccc1C[C@@H](C)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450894366	FE	On-Demand	Anodyne	SLC6A1	44	33
COC[C@@]1(CO)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450894367	FE	On-Demand	Anodyne	AVPR2	56	39
Cc1ccccc1C[C@H](C)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450894368	FE	On-Demand	Anodyne	SLC6A1	44	33
Cc1ccccc1C[C@H](C)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450894369	FE	On-Demand	Anodyne	SLC6A1	44	33
Cc1ccccc1C[C@@H](C)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450894370	FE	On-Demand	Anodyne	SLC6A1	44	33
COC[C@]1(CO)CCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450894372	FE	On-Demand	Anodyne	AVPR2	56	39
C=CCC[C@H](CO)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450894378	DD	On-Demand	Mild	DHOD	0	48
C=CCC[C@@H](CO)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450894379	DD	On-Demand	Mild	DHOD	0	48
COC[C@@]1(CO)CCN(c2ncnc3cccc(C)c23)C1	ZINC000450894382	CD	On-Demand	Anodyne	AKT1	18	43
COC[C@]1(CO)CCN(c2ncnc3cccc(C)c23)C1	ZINC000450894383	CD	On-Demand	Anodyne	AKT1	18	43
COC[C@@]1(CO)CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450894389	DF	On-Demand	Anodyne	HNMT	42	30
COC[C@]1(CO)CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450894390	DF	On-Demand	Anodyne	HNMT	42	30
CCOC(=O)C1(COC)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450894423	EF	On-Demand	Anodyne	NPFFR1	43	36
COc1cccc(OCCC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)c1	ZINC000450894455	FD	On-Demand	Anodyne	MTNR1A	52	49
COc1cccc(OCCC(=O)NC[C@@](C)(O)C(=O)OC(C)(C)C)c1	ZINC000450894455	FD	On-Demand	Anodyne	MTNR1B	49	49
COc1cccc(OCCC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)c1	ZINC000450894456	FD	On-Demand	Anodyne	MTNR1A	52	49
COc1cccc(OCCC(=O)NC[C@](C)(O)C(=O)OC(C)(C)C)c1	ZINC000450894456	FD	On-Demand	Anodyne	MTNR1B	49	49
C[C@@H](O)CCSCc1ccc([N+](=O)[O-])cc1	ZINC000450894458	BF	On-Demand	Bother	CACNA2D1	0	46
C[C@@H](O)CCSCc1ccc([N+](=O)[O-])cc1	ZINC000450894458	BF	On-Demand	Bother	LTA4H	0	48
C[C@H](O)CCSCc1ccc([N+](=O)[O-])cc1	ZINC000450894459	BF	On-Demand	Bother	CACNA2D1	0	46
C[C@H](O)CCSCc1ccc([N+](=O)[O-])cc1	ZINC000450894459	BF	On-Demand	Bother	LTA4H	0	48
CCN(CC)C(=O)CSCCC(C)(F)F	ZINC000450894468	BF	On-Demand	Anodyne	EST1_PIG	44	38
CCS(=O)(=O)c1ccc(CN(CCO)CC(F)F)cc1	ZINC000450894479	DD	On-Demand	Anodyne	RORC	20	44
CCC[C@H](O)CN(CCc1ccccn1)Cc1ccc(OC)cc1	ZINC000450894480	EG	On-Demand	Anodyne	GRIN1	24	43
CCC[C@@H](O)CN(CCc1ccccn1)Cc1ccc(OC)cc1	ZINC000450894481	EG	On-Demand	Anodyne	GRIN1	24	43
CCC(CC)Oc1ccc(C(=O)Nc2ccccc2C[S@@](C)=O)cc1	ZINC000450894493	FI	On-Demand	Anodyne	HDAC1	0	42
CCC(CC)Oc1ccc(C(=O)Nc2ccccc2C[S@](C)=O)cc1	ZINC000450894494	FI	On-Demand	Anodyne	HDAC1	0	42
CO[C@H](COc1ccc(C(C)=O)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450894495	EG	On-Demand	Bother	PDS	45	34
CO[C@@H](COc1ccc(C(C)=O)cc1[N+](=O)[O-])Cc1ccccc1	ZINC000450894496	EG	On-Demand	Bother	PDS	45	34
Cc1cccc(CC2(O)CCN(C[C@H]3CCC(F)(F)C3)CC2)c1	ZINC000450894511	DH	On-Demand	Anodyne	TACR3	40	34
Cc1cccc(CC2(O)CCN(C[C@@H]3CCC(F)(F)C3)CC2)c1	ZINC000450894512	DH	On-Demand	Anodyne	TACR3	40	34
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1c(C)c(C(F)(F)F)nn1C	ZINC000450894513	FI	On-Demand	Anodyne	ATF1	54	36
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1c(C)c(C(F)(F)F)nn1C	ZINC000450894513	FI	On-Demand	Anodyne	SORT1	17	45
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1c(C)c(C(F)(F)F)nn1C	ZINC000450894513	FI	On-Demand	Anodyne	NFKB1	50	36
Cc1cc(N2CCN([C@@H]3CCNC(=O)CC3)CC2)c2ccccc2n1	ZINC000450894519	EE	On-Demand	Anodyne	HTR1D	43	38
Cc1cc(N2CCN([C@H]3CCNC(=O)CC3)CC2)c2ccccc2n1	ZINC000450894520	EE	On-Demand	Anodyne	HTR1D	43	38
CC[C@@H]1CC[C@H](C)N(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450894548	FE	On-Demand	Anodyne	GCKR	79	39
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450894550	FD	On-Demand	Anodyne	ESR1	71	43
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450894550	FD	On-Demand	Anodyne	ESR2	48	43
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450894550	FD	On-Demand	Anodyne	LTA4H	49	37
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450894550	FD	On-Demand	Anodyne	HRH3	41	41
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450894550	FD	On-Demand	Anodyne	PSMB2	48	37
CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450894550	FD	On-Demand	Anodyne	PSMB1	41	37
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450894551	FD	On-Demand	Anodyne	ESR1	71	43
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450894551	FD	On-Demand	Anodyne	ESR2	48	43
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450894551	FD	On-Demand	Anodyne	LTA4H	49	37
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450894551	FD	On-Demand	Anodyne	HRH3	41	41
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450894551	FD	On-Demand	Anodyne	PSMB2	48	37
CS(=O)(=O)c1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450894551	FD	On-Demand	Anodyne	PSMB1	41	37
CC(C)(O)C(C)(C)CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450894558	FG	On-Demand	Anodyne	AVPR2	83	43
CC(C)(O)C(C)(C)CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450894558	FG	On-Demand	Anodyne	AVPR1A	51	44
C[C@@H](c1ccsc1)N1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450894559	FF	On-Demand	Anodyne	NPBWR1	68	37
C[C@H](c1ccsc1)N1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450894560	FF	On-Demand	Anodyne	NPBWR1	68	37
CC(C)OCc1ccc(CNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450894568	GE	On-Demand	Anodyne	LGMN	47	33
CC(C)OCc1ccc(CNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450894569	GE	On-Demand	Anodyne	LGMN	47	33
COC[C@]1(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)CCOC1	ZINC000450894580	ED	On-Demand	Anodyne	DRD3	0	48
COC[C@]1(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CCOC1	ZINC000450894581	ED	On-Demand	Anodyne	DRD3	0	48
COC[C@]1(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CCOC1	ZINC000450894582	ED	On-Demand	Anodyne	DRD3	0	48
COC[C@]1(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CCOC1	ZINC000450894583	ED	On-Demand	Anodyne	DRD3	0	48
CCC(=O)c1ccc(NCC(C)(C)C(C)(C)O)c(S(N)(=O)=O)c1	ZINC000450894597	EE	On-Demand	Anodyne	CA13	43	37
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(C)(C)C(C)(F)F	ZINC000450894602	DG	On-Demand	Anodyne	DRD4	24	51
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(C)(C)C(C)(F)F	ZINC000450894602	DG	On-Demand	Anodyne	SIGMAR1	28	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(C)(C)C(C)(F)F	ZINC000450894603	DG	On-Demand	Anodyne	DRD4	24	51
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(C)(C)C(C)(F)F	ZINC000450894603	DG	On-Demand	Anodyne	SIGMAR1	28	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(C)(C)C(C)(F)F	ZINC000450894604	DG	On-Demand	Anodyne	DRD4	24	51
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(C)(C)C(C)(F)F	ZINC000450894604	DG	On-Demand	Anodyne	SIGMAR1	28	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(C)(C)C(C)(F)F	ZINC000450894605	DG	On-Demand	Anodyne	DRD4	24	51
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(C)(C)C(C)(F)F	ZINC000450894605	DG	On-Demand	Anodyne	SIGMAR1	28	41
CCO[C@@H]1COC[C@H]1Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450894616	FC	On-Demand	Anodyne	TGM2	22	40
C=CCC[C@@H](CO)Nc1cncc(SCc2ccccc2)n1	ZINC000450894669	DH	On-Demand	Mild	CX3CR1	40	36
C=CCC[C@H](CO)Nc1cncc(SCc2ccccc2)n1	ZINC000450894670	DH	On-Demand	Mild	CX3CR1	40	36
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450894671	FG	On-Demand	Anodyne	CCKAR	48	35
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450894671	FG	On-Demand	Anodyne	HDAC1	0	41
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450894672	FG	On-Demand	Anodyne	CCKAR	48	35
CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450894672	FG	On-Demand	Anodyne	HDAC1	0	41
COC[C@@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894677	DE	On-Demand	Anodyne	PDE3A	42	36
COC[C@@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894677	DE	On-Demand	Anodyne	PDGFRB	42	39
COC[C@@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894677	DE	On-Demand	Anodyne	HNMT	42	30
COC[C@@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894677	DE	On-Demand	Anodyne	PDE3B	62	36
COC[C@@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894677	DE	On-Demand	Anodyne	HTT	0	42
COC[C@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894678	DE	On-Demand	Anodyne	PDE3A	42	36
COC[C@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894678	DE	On-Demand	Anodyne	PDGFRB	42	39
COC[C@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894678	DE	On-Demand	Anodyne	HNMT	42	30
COC[C@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894678	DE	On-Demand	Anodyne	PDE3B	62	36
COC[C@]1(CO)CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450894678	DE	On-Demand	Anodyne	HTT	0	42
COCCOC[C@@H](O)CN1Cc2ccc(C)cc2C1	ZINC000450894682	CD	On-Demand	Anodyne	ABCB1	28	40
COCCOC[C@@H](O)CN1Cc2ccc(C)cc2C1	ZINC000450894682	CD	On-Demand	Anodyne	HSP90AB1	36	41
COCCOC[C@@H](O)CN1Cc2ccc(C)cc2C1	ZINC000450894682	CD	On-Demand	Anodyne	DPP9	15	41
COCCOC[C@H](O)CN1Cc2ccc(C)cc2C1	ZINC000450894683	CD	On-Demand	Anodyne	ABCB1	28	40
COCCOC[C@H](O)CN1Cc2ccc(C)cc2C1	ZINC000450894683	CD	On-Demand	Anodyne	HSP90AB1	36	41
COCCOC[C@H](O)CN1Cc2ccc(C)cc2C1	ZINC000450894683	CD	On-Demand	Anodyne	DPP9	15	41
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	HTR1A	76	53
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	DRD2	63	46
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	DRD4	41	32
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	ADRA1D	54	44
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	HTR2A	40	45
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	ADRA1A	41	39
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	ADRA1B	40	37
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	DRD3	51	41
COc1cnccc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450894686	CC	On-Demand	Anodyne	HTR7	57	40
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	HTR1A	76	53
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	DRD2	63	46
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	DRD4	41	32
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	ADRA1D	54	44
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	HTR2A	40	45
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	ADRA1A	41	39
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	ADRA1B	40	37
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	DRD3	51	41
COc1cnccc1N1CCN(CC[C@H](C)O)CC1	ZINC000450894687	CC	On-Demand	Anodyne	HTR7	57	40
C=CCC[C@H](CO)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450894693	ED	On-Demand	Mild	LRRK2	23	40
C=CCC[C@@H](CO)Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450894694	ED	On-Demand	Mild	LRRK2	23	40
CC(=O)c1cccc(CN2Cc3ccc(C)cc3C2)c1	ZINC000450894704	CH	On-Demand	Anodyne	AKR1C3	17	40
CCC(CC)(CNC(=O)c1ccc(N2CCC2)nc1)c1ccc(OC)c(OC)c1	ZINC000450894712	GH	On-Demand	Anodyne	MT-ND1	19	40
O=C1CC[C@@H](N2CCN(c3nc4ccccc4s3)CC2)CCN1	ZINC000450894749	EE	On-Demand	Anodyne	HRH3	18	47
O=C1CC[C@H](N2CCN(c3nc4ccccc4s3)CC2)CCN1	ZINC000450894750	EE	On-Demand	Anodyne	HRH3	18	47
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450894772	GD	On-Demand	Anodyne	CACNA1I	15	43
CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450894772	GD	On-Demand	Anodyne	IMDH_CRYPV	20	40
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450894773	GD	On-Demand	Anodyne	CACNA1I	15	43
CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450894773	GD	On-Demand	Anodyne	IMDH_CRYPV	20	40
CCn1ccnc(N2CCC(NC(=O)c3cccc(SC)c3)CC2)c1=O	ZINC000450894777	FE	On-Demand	Anodyne	SSTR5	43	37
CCn1ccnc(N2CCC(NC(=O)c3cccc(SC)c3)CC2)c1=O	ZINC000450894777	FE	On-Demand	Anodyne	SIRT3	64	41
CCn1ccnc(N2CCC(NC(=O)c3cccc(SC)c3)CC2)c1=O	ZINC000450894777	FE	On-Demand	Anodyne	SIRT2	69	41
CCn1ccnc(N2CCC(NC(=O)c3cccc(SC)c3)CC2)c1=O	ZINC000450894777	FE	On-Demand	Anodyne	SIRT1	62	41
Cc1cccc(CC2(O)CCN(C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450894783	EI	On-Demand	Anodyne	UTS2R	15	41
Cc1cccc(CC2(O)CCN(C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450894784	EI	On-Demand	Anodyne	UTS2R	15	41
COC(=O)c1ccc(CN(CCO)CC(F)F)cc1Cl	ZINC000450894790	DE	On-Demand	Anodyne	GRIN1	23	41
Cc1cc(Br)c(NC(=O)c2cc(C3CC3)[nH]n2)cc1Cl	ZINC000450894800	FI	On-Demand	Anodyne	CDK2	0	47
Cc1nc2ccccc2n1C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450894804	GH	On-Demand	Anodyne	AKT2	15	43
CO[C@@H](Cc1ccccc1)CN1CCC(n2c(C)nc3ccccc32)CC1	ZINC000450894809	FI	On-Demand	Anodyne	OPRM1	0	40
CO[C@@H](Cc1ccccc1)CN1CCC(n2c(C)nc3ccccc32)CC1	ZINC000450894809	FI	On-Demand	Anodyne	OPRL1	43	35
CO[C@@H](Cc1ccccc1)CN1CCC(n2c(C)nc3ccccc32)CC1	ZINC000450894809	FI	On-Demand	Anodyne	CCR5	18	47
CO[C@@H](Cc1ccccc1)CN1CCC(n2c(C)nc3ccccc32)CC1	ZINC000450894809	FI	On-Demand	Anodyne	AKT2	0	43
CO[C@H](Cc1ccccc1)CN1CCC(n2c(C)nc3ccccc32)CC1	ZINC000450894810	FI	On-Demand	Anodyne	OPRM1	0	40
CO[C@H](Cc1ccccc1)CN1CCC(n2c(C)nc3ccccc32)CC1	ZINC000450894810	FI	On-Demand	Anodyne	OPRL1	43	35
CO[C@H](Cc1ccccc1)CN1CCC(n2c(C)nc3ccccc32)CC1	ZINC000450894810	FI	On-Demand	Anodyne	CCR5	18	47
CO[C@H](Cc1ccccc1)CN1CCC(n2c(C)nc3ccccc32)CC1	ZINC000450894810	FI	On-Demand	Anodyne	AKT2	0	43
CCc1cccc(C(=O)Nc2ccccc2C[S@](C)=O)n1	ZINC000450894821	DF	On-Demand	Anodyne	PDE5A	25	42
CCc1cccc(C(=O)Nc2ccccc2C[S@@](C)=O)n1	ZINC000450894822	DF	On-Demand	Anodyne	PDE5A	25	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894827	FF	On-Demand	Anodyne	DRD4	25	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894827	FF	On-Demand	Anodyne	DRD3	0	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894827	FF	On-Demand	Anodyne	HDAC1	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894827	FF	On-Demand	Anodyne	SMO	0	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894827	FF	On-Demand	Anodyne	HPGDS	31	46
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894828	FF	On-Demand	Anodyne	DRD4	25	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894828	FF	On-Demand	Anodyne	DRD3	0	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894828	FF	On-Demand	Anodyne	HDAC1	22	43
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894828	FF	On-Demand	Anodyne	SMO	0	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894828	FF	On-Demand	Anodyne	HPGDS	31	46
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894829	FF	On-Demand	Anodyne	DRD4	25	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894829	FF	On-Demand	Anodyne	DRD3	0	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894829	FF	On-Demand	Anodyne	HDAC1	22	43
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894829	FF	On-Demand	Anodyne	SMO	0	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894829	FF	On-Demand	Anodyne	HPGDS	31	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894830	FF	On-Demand	Anodyne	DRD4	25	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894830	FF	On-Demand	Anodyne	DRD3	0	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894830	FF	On-Demand	Anodyne	HDAC1	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894830	FF	On-Demand	Anodyne	SMO	0	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450894830	FF	On-Demand	Anodyne	HPGDS	31	46
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	HTR1A	15	53
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	DRD2	37	53
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	DRD1	19	63
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	DRD4	25	53
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	HTR2A	36	54
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	HTR2C	18	51
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	ADRA1A	19	49
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	ADRA1B	18	53
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	DRD3	15	63
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	ERG2	26	56
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	HTR7	22	53
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	SIGMAR1	18	56
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	UTS2R	0	44
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	SLC18A3	22	54
Cc1cccc(CC2(O)CCN(CCCC(=O)c3ccc(F)cc3)CC2)c1	ZINC000450894838	FI	On-Demand	Anodyne	CYP2J2	57	43
CNS(=O)(=O)NCC(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450894878	EB	On-Demand	Anodyne	P2RX7	15	40
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cn1	ZINC000450894925	CC	On-Demand	Anodyne	CA2	61	40
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cn1	ZINC000450894925	CC	On-Demand	Anodyne	CA1	44	38
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cn1	ZINC000450894925	CC	On-Demand	Anodyne	CYNT	47	36
COc1cc(OC)c2ncc(C#N)c(NCC(C)(C)C(C)(C)O)c2c1	ZINC000450894927	EG	On-Demand	Mild	MAP2K1	0	40
CCc1cc(NCC(C)(C)C(C)(C)O)n2ncnc2n1	ZINC000450894932	CD	On-Demand	Anodyne	DHOD	0	57
CC(C)(O)C(C)(C)CNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450894940	EG	On-Demand	Anodyne	NPBWR1	49	44
CC1(C)CN(CCCC(=O)c2ccc(Br)cc2)C[C@]2(CCOC2)O1	ZINC000450894978	GH	On-Demand	Anodyne	CYP2J2	47	34
CC1(C)CN(CCCC(=O)c2ccc(Br)cc2)C[C@@]2(CCOC2)O1	ZINC000450894979	GH	On-Demand	Anodyne	CYP2J2	47	34
Cc1ccc2c(c1)CN(CCCC(=O)c1ccccc1)C2	ZINC000450895019	CH	On-Demand	Anodyne	HTR7	26	47
Cc1ccc2c(c1)CN(CCCC(=O)c1ccccc1)C2	ZINC000450895019	CH	On-Demand	Anodyne	CYP2J2	61	50
CCC(=O)CCCN1CCC[C@@H](C(C)(C)C)C1	ZINC000450895031	BH	On-Demand	Anodyne	CYP2J2	40	34
CCC(=O)CCCN1CCC[C@H](C(C)(C)C)C1	ZINC000450895032	BH	On-Demand	Anodyne	CYP2J2	40	34
CCOC(=O)C1(COC)CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450895043	EF	On-Demand	Anodyne	KCNA3	18	46
CCOC(=O)C1(COC)CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450895043	EF	On-Demand	Anodyne	TIMP3	45	32
CCOC(=O)C1(COC)CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450895044	EF	On-Demand	Anodyne	KCNA3	18	46
CCOC(=O)C1(COC)CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450895044	EF	On-Demand	Anodyne	TIMP3	45	32
CCS(=O)(=O)c1ccc(CN[C@@H](CO)c2c(Cl)cccc2Cl)cc1	ZINC000450895047	GH	On-Demand	Anodyne	RORC	47	39
O=C1CC[C@@H](N2CCN(c3ccc(C(F)(F)F)cn3)CC2)CCN1	ZINC000450895087	ED	On-Demand	Anodyne	CXCR3	15	44
O=C1CC[C@H](N2CCN(c3ccc(C(F)(F)F)cn3)CC2)CCN1	ZINC000450895088	ED	On-Demand	Anodyne	CXCR3	15	44
Cc1nc2ccccc2n1C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450895090	EI	On-Demand	Anodyne	OPRL1	22	40
Cc1nc2ccccc2n1C1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450895090	EI	On-Demand	Anodyne	CCR5	18	46
O=C(Nc1ccccc1NCc1ccc(Cl)cc1)C1(CF)CCOCC1	ZINC000450895093	GJ	On-Demand	Anodyne	MMP13	15	40
O=C(Nc1ccccc1NCc1ccc(Cl)cc1)C1(CF)CCOCC1	ZINC000450895093	GJ	On-Demand	Anodyne	MMP14	15	40
Cc1nc2ccccc2n1C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450895094	EI	On-Demand	Anodyne	OPRL1	22	40
Cc1nc2ccccc2n1C1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450895094	EI	On-Demand	Anodyne	CCR5	18	46
CCSc1cccnc1C(=O)NC1CCN(c2nccn(CC)c2=O)CC1	ZINC000450895106	GE	On-Demand	Anodyne	SIRT3	50	32
CCSc1cccnc1C(=O)NC1CCN(c2nccn(CC)c2=O)CC1	ZINC000450895106	GE	On-Demand	Anodyne	SIRT2	44	32
CCSc1cccnc1C(=O)NC1CCN(c2nccn(CC)c2=O)CC1	ZINC000450895106	GE	On-Demand	Anodyne	SIRT1	50	32
Cc1cc(Br)c(NC(=O)C2CCN(C(C)C)CC2)cc1Cl	ZINC000450895123	FI	On-Demand	Anodyne	EPHX2	32	40
COC(=O)c1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)c(Cl)c1	ZINC000450895125	GE	On-Demand	Anodyne	SLC6A1	48	34
COC(=O)c1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)c(Cl)c1	ZINC000450895126	GE	On-Demand	Anodyne	SLC6A1	48	34
Cc1nc2ccccc2n1C1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450895152	EH	On-Demand	Anodyne	CCR5	17	43
Cc1nc2ccccc2n1C1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450895162	EH	On-Demand	Anodyne	CCR5	17	43
COc1cc(C(C)=O)ccc1SC[C@H](Cc1ccccc1)OC	ZINC000450895179	EI	On-Demand	Anodyne	PDS	54	35
COc1cc(C(C)=O)ccc1SC[C@@H](Cc1ccccc1)OC	ZINC000450895181	EI	On-Demand	Anodyne	PDS	54	35
CC(=O)c1cccc(COc2nc(C)cc(C)c2[N+](=O)[O-])c1	ZINC000450895195	DG	On-Demand	Bother	ACR	23	41
CSc1ccc2ncnc(NCC(C)(C)C(C)(C)O)c2c1	ZINC000450895196	DF	On-Demand	Anodyne	DYRK1A	23	43
CSc1ccc2ncnc(NCC(C)(C)C(C)(C)O)c2c1	ZINC000450895196	DF	On-Demand	Anodyne	CLK2	25	43
CSc1ccc2ncnc(NCC(C)(C)C(C)(C)O)c2c1	ZINC000450895196	DF	On-Demand	Anodyne	CLK4	64	35
CSc1ccc2ncnc(NCC(C)(C)C(C)(C)O)c2c1	ZINC000450895196	DF	On-Demand	Anodyne	CD38	61	36
CSc1ccc2ncnc(NCC(C)(C)C(C)(C)O)c2c1	ZINC000450895196	DF	On-Demand	Anodyne	DYRK1B	27	42
C[C@H]1Cc2cccc(C(=O)Nc3ccccc3C[S@@](C)=O)c2O1	ZINC000450895211	EG	On-Demand	Anodyne	G2YM83_BOTF4	72	40
C[C@H]1Cc2cccc(C(=O)Nc3ccccc3C[S@](C)=O)c2O1	ZINC000450895212	EG	On-Demand	Anodyne	G2YM83_BOTF4	72	40
C[C@@H]1Cc2cccc(C(=O)Nc3ccccc3C[S@@](C)=O)c2O1	ZINC000450895213	EG	On-Demand	Anodyne	G2YM83_BOTF4	72	40
C[C@@H]1Cc2cccc(C(=O)Nc3ccccc3C[S@](C)=O)c2O1	ZINC000450895214	EG	On-Demand	Anodyne	G2YM83_BOTF4	72	40
Oc1nnc([C@H]2CCCN(CCCCCn3nnc(-c4ccccc4)n3)C2)o1	ZINC000450895244	GE	On-Demand	Anodyne	SLC6A1	48	36
Oc1nnc([C@@H]2CCCN(CCCCCn3nnc(-c4ccccc4)n3)C2)o1	ZINC000450895245	GE	On-Demand	Anodyne	SLC6A1	48	36
CCS(=O)(=O)c1ccc(CN[C@H](CO)c2c(Cl)cccc2Cl)cc1	ZINC000450895253	GH	On-Demand	Anodyne	RORC	47	39
COC[C@@]1(CO)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450895256	FE	On-Demand	Anodyne	PDE3B	52	32
COC[C@]1(CO)CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450895266	FE	On-Demand	Anodyne	PDE3B	52	32
COC[C@@]1(CO)CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450895295	CD	On-Demand	Anodyne	MLYCD	32	41
COC[C@]1(CO)CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450895296	CD	On-Demand	Anodyne	MLYCD	32	41
CCCOc1ccc(C(C)(C)NCc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450895308	GI	On-Demand	Anodyne	CA7	16	47
COC[C@@]1(CO)CCN(c2nc3ccccc3n2C)C1	ZINC000450895309	CD	On-Demand	Anodyne	HRH1	25	41
COC[C@]1(CO)CCN(c2nc3ccccc3n2C)C1	ZINC000450895311	CD	On-Demand	Anodyne	HRH1	25	41
CC[C@@H]1CC[C@H](C)N(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450895314	CF	On-Demand	Anodyne	P2RY12	25	41
CC[C@@H]1CC[C@H](C)N(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450895314	CF	On-Demand	Anodyne	CXCR3	34	47
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450895316	FE	On-Demand	Anodyne	PRNP	48	37
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450895316	FE	On-Demand	Anodyne	HDAC1	20	47
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450895316	FE	On-Demand	Anodyne	P4HTM	0	48
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450895316	FE	On-Demand	Anodyne	DGAT1	42	36
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450895317	FE	On-Demand	Anodyne	PRNP	48	37
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450895317	FE	On-Demand	Anodyne	HDAC1	20	47
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450895317	FE	On-Demand	Anodyne	P4HTM	0	48
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)C1	ZINC000450895317	FE	On-Demand	Anodyne	DGAT1	42	36
CN(C)S(=O)(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450895325	FE	On-Demand	Bother	COLA	65	33
CN(C)S(=O)(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450895325	FE	On-Demand	Bother	BCL2L1	57	36
CN(Cc1ccn(CCc2ccccc2)n1)C1CCN(c2ccccc2)CC1	ZINC000450895341	FI	On-Demand	Anodyne	SIGMAR1	16	40
O=C1CC[C@@H](N2CCN(c3ccccc3[N+](=O)[O-])CC2)CCN1	ZINC000450895390	DD	On-Demand	Bother	ADRA1B	16	42
O=C1CC[C@H](N2CCN(c3ccccc3[N+](=O)[O-])CC2)CCN1	ZINC000450895391	DD	On-Demand	Bother	ADRA1B	16	42
CCCOc1cccc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)c1	ZINC000450895392	GH	On-Demand	Anodyne	HRH2	41	40
COc1cnccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450895408	CC	On-Demand	Anodyne	HTR1A	36	45
COc1cnccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450895408	CC	On-Demand	Anodyne	ADRA1D	33	47
COc1cnccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450895408	CC	On-Demand	Anodyne	ADRA1A	27	47
COc1cnccc1N1CCN(C[C@@H]2COCCO2)CC1	ZINC000450895408	CC	On-Demand	Anodyne	ADRA1B	23	47
COc1cnccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450895413	CC	On-Demand	Anodyne	HTR1A	36	45
COc1cnccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450895413	CC	On-Demand	Anodyne	ADRA1D	33	47
COc1cnccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450895413	CC	On-Demand	Anodyne	ADRA1A	27	47
COc1cnccc1N1CCN(C[C@H]2COCCO2)CC1	ZINC000450895413	CC	On-Demand	Anodyne	ADRA1B	23	47
CCN(CC)S(=O)(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450895425	GF	On-Demand	Bother	COLA	54	32
CC[C@H](O)CC(=O)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450895457	EI	On-Demand	Anodyne	KCNQ2	34	40
CC[C@@H](O)CC(=O)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450895459	EI	On-Demand	Anodyne	KCNQ2	34	40
Cc1ccn2ncc(C(=O)NC[C@@H]3C[C@H](F)CN3Cc3cc(C)no3)c2c1	ZINC000450895462	FE	On-Demand	Anodyne	EPHB3	32	43
CC(C)(O)C(C)(C)CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450895489	GF	On-Demand	Bother	TBXA2R	28	42
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000450895509	GE	On-Demand	Anodyne	CCR2	46	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000450895509	GE	On-Demand	Anodyne	TEK	17	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000450895509	GE	On-Demand	Anodyne	LIPG	46	33
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000450895511	GE	On-Demand	Anodyne	CCR2	46	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000450895511	GE	On-Demand	Anodyne	TEK	17	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000450895511	GE	On-Demand	Anodyne	LIPG	46	33
CC(C)(O)C(C)(C)CNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450895521	GE	On-Demand	Anodyne	CA2	19	45
CC(C)(O)C(C)(C)CNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450895521	GE	On-Demand	Anodyne	CA4	20	45
Cc1nc2ccccc2n1C1CCN(CC2(C#N)CCC2)CC1	ZINC000450895532	DH	On-Demand	Mild	OPRL1	18	40
Cc1nc2ccccc2n1C1CCN(CC2(C#N)CCC2)CC1	ZINC000450895532	DH	On-Demand	Mild	CCR5	17	46
Cc1ccc(CC(=O)Nc2c(C)c(C(F)(F)F)nn2C)c(Br)c1	ZINC000450895545	GH	On-Demand	Anodyne	IMDH_CRYPV	18	40
N#Cc1cccc(NC(=O)CCN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450895573	ED	On-Demand	Mild	CCR3	21	46
N#Cc1cccc(NC(=O)CCN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450895574	ED	On-Demand	Mild	CCR3	21	46
CC(=O)c1ccc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)cc1	ZINC000450895575	FG	On-Demand	Anodyne	ACHE	18	41
CC(=O)c1ccc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)cc1	ZINC000450895575	FG	On-Demand	Anodyne	FABI	52	32
CC(=O)c1ccc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)cc1	ZINC000450895575	FG	On-Demand	Anodyne	BRS3	26	41
CC(=O)c1ccc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)cc1	ZINC000450895575	FG	On-Demand	Anodyne	HDAC6	17	43
CC(=O)c1ccc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)cc1	ZINC000450895575	FG	On-Demand	Anodyne	NOD2	45	38
O=C(CCN1CCC[C@H](c2nnc(O)o2)C1)NCC(=O)c1ccccc1	ZINC000450895577	FD	On-Demand	Anodyne	SLC6A1	91	36
O=C(CCN1CCC[C@@H](c2nnc(O)o2)C1)NCC(=O)c1ccccc1	ZINC000450895578	FD	On-Demand	Anodyne	SLC6A1	91	36
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCCCC1CCCCC1	ZINC000450895580	FE	On-Demand	Anodyne	BMP1	67	37
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCCCC1CCCCC1	ZINC000450895581	FE	On-Demand	Anodyne	BMP1	67	37
CC(C)(O)C(C)(C)CNc1nc2ccccc2nc1N1CCOCC1	ZINC000450895589	EF	On-Demand	Anodyne	PIK3CA	26	43
CCO[C@@H]1COC[C@H]1Nc1ccnc2cc(Br)ccc12	ZINC000450895630	EG	On-Demand	Anodyne	HRP1_PLAFA	49	35
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(CF)CCOCC1	ZINC000450895634	EE	On-Demand	Anodyne	DRD4	18	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(CF)CCOCC1	ZINC000450895635	EE	On-Demand	Anodyne	DRD4	18	46
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(CF)CCOCC1	ZINC000450895636	EE	On-Demand	Anodyne	DRD4	18	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(CF)CCOCC1	ZINC000450895637	EE	On-Demand	Anodyne	DRD4	18	46
CC(C)c1ccc(CC2CCN(C(=O)C3(C)CCC(=O)CC3)CC2)cc1	ZINC000450895646	FJ	On-Demand	Anodyne	GRIN2B	42	39
CC(=O)c1ccc(OCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450895671	CG	On-Demand	Bother	THRA	0	47
CC(=O)c1ccc(OCCC(C)(F)F)c([N+](=O)[O-])c1	ZINC000450895671	CG	On-Demand	Bother	S1PR4	0	41
Cc1ccc(OCc2nnc(C3CC3)s2)cc1[N+](=O)[O-]	ZINC000450895687	CG	On-Demand	Bother	MAOA	32	41
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450895697	GF	On-Demand	Mild	BCL2L1	103	35
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450895697	GF	On-Demand	Mild	BCL2	87	38
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450895697	GF	On-Demand	Mild	BCL2L2	44	31
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450895698	GF	On-Demand	Mild	BCL2L1	103	35
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450895698	GF	On-Demand	Mild	BCL2	87	38
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000450895698	GF	On-Demand	Mild	BCL2L2	44	31
O=C1CC[C@@H](N2CCN(c3ncc(Cl)cc3Cl)CC2)CCN1	ZINC000450895722	EE	On-Demand	Anodyne	CXCR3	28	41
O=C1CC[C@H](N2CCN(c3ncc(Cl)cc3Cl)CC2)CCN1	ZINC000450895731	EE	On-Demand	Anodyne	CXCR3	28	41
COc1cnccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450895755	CD	On-Demand	Anodyne	DRD2	45	46
COc1cnccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450895755	CD	On-Demand	Anodyne	ADRA1D	39	41
COc1cnccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450895755	CD	On-Demand	Anodyne	HTR2A	22	46
COc1cnccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450895755	CD	On-Demand	Anodyne	DRD3	37	53
COc1cnccc1N1CCN(Cc2cccnc2N)CC1	ZINC000450895755	CD	On-Demand	Anodyne	HTR7	39	48
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@]2(CCOC2)O1	ZINC000450895768	GG	On-Demand	Anodyne	CYP2J2	49	37
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@]2(CCOC2)O1	ZINC000450895769	GG	On-Demand	Anodyne	CYP2J2	49	37
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@]2(CCOC2)O1	ZINC000450895770	GG	On-Demand	Anodyne	CYP2J2	49	37
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@]2(CCOC2)O1	ZINC000450895772	GG	On-Demand	Anodyne	CYP2J2	49	37
CCOC(=O)C1(COC)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450895773	GF	On-Demand	Anodyne	SIGMAR1	24	40
CCOC(=O)C1(COC)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450895773	GF	On-Demand	Anodyne	NPFFR1	45	37
CCc1cc(CCCN2CCN(c3ccncc3OC)CC2)on1	ZINC000450895782	EE	On-Demand	Anodyne	DRD2	49	48
CCc1cc(CCCN2CCN(c3ccncc3OC)CC2)on1	ZINC000450895782	EE	On-Demand	Anodyne	ADRA1A	32	40
CCc1cc(CCCN2CCN(c3ccncc3OC)CC2)on1	ZINC000450895782	EE	On-Demand	Anodyne	DRD3	49	51
CCc1cc(CCCN2CCN(c3ccncc3OC)CC2)on1	ZINC000450895782	EE	On-Demand	Anodyne	HTR7	48	40
O=C1CC[C@@H](N2CCN(c3ccc(Cl)cn3)CC2)CCN1	ZINC000450895797	DD	On-Demand	Anodyne	EBP	23	40
O=C1CC[C@@H](N2CCN(c3ccc(Cl)cn3)CC2)CCN1	ZINC000450895797	DD	On-Demand	Anodyne	NPBWR1	43	32
O=C1CC[C@H](N2CCN(c3ccc(Cl)cn3)CC2)CCN1	ZINC000450895799	DD	On-Demand	Anodyne	EBP	23	40
O=C1CC[C@H](N2CCN(c3ccc(Cl)cn3)CC2)CCN1	ZINC000450895799	DD	On-Demand	Anodyne	NPBWR1	43	32
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@]1(C)CC=CCC1	ZINC000450895863	DG	On-Demand	Anodyne	DRD4	19	47
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@]1(C)CC=CCC1	ZINC000450895864	DG	On-Demand	Anodyne	DRD4	19	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@]1(C)CC=CCC1	ZINC000450895865	DG	On-Demand	Anodyne	DRD4	19	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@]1(C)CC=CCC1	ZINC000450895866	DG	On-Demand	Anodyne	DRD4	19	47
COC(=O)c1ccc(CS[C@@H]2CCCOC2)c(Br)c1	ZINC000450895867	EH	On-Demand	Anodyne	QRFPR	42	35
COC(=O)c1ccc(CS[C@H]2CCCOC2)c(Br)c1	ZINC000450895868	EH	On-Demand	Anodyne	QRFPR	42	35
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450895870	GH	On-Demand	Anodyne	PRNP	50	34
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450895870	GH	On-Demand	Anodyne	POL	0	44
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450895870	GH	On-Demand	Anodyne	KCNK3	76	39
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450895871	GH	On-Demand	Anodyne	PRNP	50	34
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450895871	GH	On-Demand	Anodyne	POL	0	44
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450895871	GH	On-Demand	Anodyne	KCNK3	76	39
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450895872	GH	On-Demand	Anodyne	PRNP	50	34
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450895872	GH	On-Demand	Anodyne	POL	0	44
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450895872	GH	On-Demand	Anodyne	KCNK3	76	39
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450895873	GH	On-Demand	Anodyne	PRNP	50	34
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450895873	GH	On-Demand	Anodyne	POL	0	44
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450895873	GH	On-Demand	Anodyne	KCNK3	76	39
Oc1nnc([C@@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895877	FG	On-Demand	Anodyne	ESR1	60	34
Oc1nnc([C@@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895877	FG	On-Demand	Anodyne	ESR2	40	34
Oc1nnc([C@@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895877	FG	On-Demand	Anodyne	LTA4H	44	43
Oc1nnc([C@@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895877	FG	On-Demand	Anodyne	HRH3	26	40
Oc1nnc([C@@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895877	FG	On-Demand	Anodyne	PSMB2	48	36
Oc1nnc([C@@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895877	FG	On-Demand	Anodyne	PSMB5	16	40
Oc1nnc([C@@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895877	FG	On-Demand	Anodyne	PSMB1	42	40
Oc1nnc([C@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895878	FG	On-Demand	Anodyne	ESR1	60	34
Oc1nnc([C@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895878	FG	On-Demand	Anodyne	ESR2	40	34
Oc1nnc([C@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895878	FG	On-Demand	Anodyne	LTA4H	44	43
Oc1nnc([C@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895878	FG	On-Demand	Anodyne	HRH3	26	40
Oc1nnc([C@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895878	FG	On-Demand	Anodyne	PSMB2	48	36
Oc1nnc([C@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895878	FG	On-Demand	Anodyne	PSMB5	16	40
Oc1nnc([C@H]2CCCN(CCOc3ccc(C(F)(F)F)cc3)C2)o1	ZINC000450895878	FG	On-Demand	Anodyne	PSMB1	42	40
NC(=O)c1ccnc(NC2(Cc3ccccc3)CCOCC2)c1[N+](=O)[O-]	ZINC000450895886	FE	On-Demand	Bother	STAT6	46	35
COc1ccccc1NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450895900	ED	On-Demand	Anodyne	DRD4	18	43
COc1ccccc1NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450895901	ED	On-Demand	Anodyne	DRD4	18	43
CC(=O)c1cccc(Cn2cnc3c(c2=O)CCN(Cc2ccccc2)C3)c1	ZINC000450895907	FG	On-Demand	Anodyne	SCD1	0	41
Oc1nnc([C@@H]2CCCN(CCCc3ccccc3Cl)C2)o1	ZINC000450895917	DG	On-Demand	Anodyne	SLC6A1	42	37
Oc1nnc([C@H]2CCCN(CCCc3ccccc3Cl)C2)o1	ZINC000450895918	DG	On-Demand	Anodyne	SLC6A1	42	37
CC(C)OC(=O)CCCNC(=O)[C@@]1(C)CCC[C@H]1C	ZINC000450895920	CF	On-Demand	Anodyne	EPHX2	0	44
CC(C)OC(=O)CCCNC(=O)[C@]1(C)CCC[C@H]1C	ZINC000450895921	CF	On-Demand	Anodyne	EPHX2	0	44
CC(C)OC(=O)CCCNC(=O)[C@]1(C)CCC[C@@H]1C	ZINC000450895922	CF	On-Demand	Anodyne	EPHX2	0	44
CC(C)OC(=O)CCCNC(=O)[C@@]1(C)CCC[C@@H]1C	ZINC000450895923	CF	On-Demand	Anodyne	EPHX2	0	44
Cc1cc(NCC(C)(C)C(C)(C)O)nc(-c2cccnc2)n1	ZINC000450895932	DE	On-Demand	Anodyne	ROS1	56	39
CC(C)OC(C)(C)C(=O)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450895937	FK	On-Demand	Anodyne	PTGES2	43	32
CC(C)OC(C)(C)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450895944	DF	On-Demand	Anodyne	DRD3	0	51
CC(C)OC(C)(C)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450895945	DF	On-Demand	Anodyne	DRD3	0	51
CC(C)OC(C)(C)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450895946	DF	On-Demand	Anodyne	DRD3	0	51
CC(C)OC(C)(C)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450895947	DF	On-Demand	Anodyne	DRD3	0	51
O=C1CC[C@H](N2CCN(c3ccc4ccccc4n3)CC2)CCN1	ZINC000450895971	DE	On-Demand	Anodyne	HTR3A	35	44
O=C1CC[C@@H](N2CCN(c3ccc4ccccc4n3)CC2)CCN1	ZINC000450895972	DE	On-Demand	Anodyne	HTR3A	35	44
O=C1CC[C@@H](N2CCN(c3ncccc3Cl)CC2)CCN1	ZINC000450895997	DD	On-Demand	Anodyne	EBP	23	44
O=C1CC[C@H](N2CCN(c3ncccc3Cl)CC2)CCN1	ZINC000450895998	DD	On-Demand	Anodyne	EBP	23	44
CCCOc1cccc(CN(C)[C@@H](CC(N)=O)c2ccccc2)c1	ZINC000450895999	EH	On-Demand	Anodyne	ALOX5	18	40
CCCOc1cccc(CN(C)[C@@H](CC(N)=O)c2ccccc2)c1	ZINC000450895999	EH	On-Demand	Anodyne	ACHE	15	43
CCCOc1cccc(CN(C)[C@@H](CC(N)=O)c2ccccc2)c1	ZINC000450895999	EH	On-Demand	Anodyne	NR1H3	16	47
CCCOc1cccc(CN(C)[C@@H](CC(N)=O)c2ccccc2)c1	ZINC000450895999	EH	On-Demand	Anodyne	TSPAN17	0	40
CCCOc1cccc(CN(C)[C@@H](CC(N)=O)c2ccccc2)c1	ZINC000450895999	EH	On-Demand	Anodyne	PTGES	25	40
CCCOc1cccc(CN(C)[C@@H](CC(N)=O)c2ccccc2)c1	ZINC000450895999	EH	On-Demand	Anodyne	PDS	62	36
CCCOc1cccc(CN(C)[C@H](CC(N)=O)c2ccccc2)c1	ZINC000450896000	EH	On-Demand	Anodyne	ALOX5	18	40
CCCOc1cccc(CN(C)[C@H](CC(N)=O)c2ccccc2)c1	ZINC000450896000	EH	On-Demand	Anodyne	ACHE	15	43
CCCOc1cccc(CN(C)[C@H](CC(N)=O)c2ccccc2)c1	ZINC000450896000	EH	On-Demand	Anodyne	NR1H3	16	47
CCCOc1cccc(CN(C)[C@H](CC(N)=O)c2ccccc2)c1	ZINC000450896000	EH	On-Demand	Anodyne	TSPAN17	0	40
CCCOc1cccc(CN(C)[C@H](CC(N)=O)c2ccccc2)c1	ZINC000450896000	EH	On-Demand	Anodyne	PTGES	25	40
CCCOc1cccc(CN(C)[C@H](CC(N)=O)c2ccccc2)c1	ZINC000450896000	EH	On-Demand	Anodyne	PDS	62	36
Cc1cccc(CC2(O)CCN(Cc3ccn(CCc4ccccc4)n3)CC2)c1	ZINC000450896029	GI	On-Demand	Anodyne	UTS2R	15	40
CCc1cccc(C(=O)NC[C@@H]2C[C@H](F)CN2Cc2cccs2)n1	ZINC000450896032	EG	On-Demand	Anodyne	PDE8B	40	31
COc1cnccc1N1CCN(CC2=CCCCC2)CC1	ZINC000450896035	CF	On-Demand	Anodyne	HTR1A	45	39
COc1cnccc1N1CCN(CC2=CCCCC2)CC1	ZINC000450896035	CF	On-Demand	Anodyne	DRD4	27	42
COc1cnccc1N1CCN(CC2=CCCCC2)CC1	ZINC000450896035	CF	On-Demand	Anodyne	ADRA1D	34	41
COc1cnccc1N1CCN(CC2=CCCCC2)CC1	ZINC000450896035	CF	On-Demand	Anodyne	ADRA1A	27	41
COc1cnccc1N1CCN(CC2=CCCCC2)CC1	ZINC000450896035	CF	On-Demand	Anodyne	DRD3	25	40
COc1cnccc1N1CCN(CC2=CCCCC2)CC1	ZINC000450896035	CF	On-Demand	Anodyne	HTR7	25	41
CC[C@@H]1C[C@H]1C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000450896037	CH	On-Demand	Anodyne	AMY2	53	31
CC[C@@H]1C[C@H]1C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000450896038	CH	On-Demand	Anodyne	AMY2	53	31
CC(=O)c1ccc(CN2CCC(C)=C(C)C2)cc1	ZINC000450896088	BG	On-Demand	Anodyne	FABI	46	34
CC(=O)c1ccc(CN2CCC(C)=C(C)C2)cc1	ZINC000450896088	BG	On-Demand	Anodyne	NOD1	32	42
CC(=O)c1ccc(CN2CCC(C)=C(C)C2)cc1	ZINC000450896088	BG	On-Demand	Anodyne	NOD2	49	42
CCOC(=O)c1ccc(Cn2ccnc2)nc1	ZINC000450896105	BD	On-Demand	Anodyne	CYP19A1	30	43
CCOC(=O)c1ccc(Cn2ccnc2)nc1	ZINC000450896105	BD	On-Demand	Anodyne	CYP11B1	57	43
CCOC(=O)c1ccc(Cn2ccnc2)nc1	ZINC000450896105	BD	On-Demand	Anodyne	CYP11B2	60	42
CCOC(=O)c1ccc(Cn2ccnc2)nc1	ZINC000450896105	BD	On-Demand	Anodyne	CYP17A1	0	40
COc1ccc2c(NCC(C)(C)C(C)(C)O)ncnc2c1F	ZINC000450896154	DE	On-Demand	Anodyne	PDE6A	43	34
CC(C)(O)C(C)(C)CNc1ccnc2cc(F)ccc12	ZINC000450896181	CH	On-Demand	Anodyne	HRP1_PLAFA	105	35
CC(C)(O)C(C)(C)CNc1ccnc2cc(F)ccc12	ZINC000450896181	CH	On-Demand	Anodyne	HNMT	55	36
CCc1cccc(C(=O)NC[C@@H]2C[C@H](F)CN2Cc2cc(C)no2)n1	ZINC000450896193	EE	On-Demand	Anodyne	PDE8B	44	33
CC(C)(C)N(Cc1cccc(F)c1)C(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450896195	GF	On-Demand	Anodyne	CCR5	46	33
CC(C)(C)N(Cc1cccc(F)c1)C(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450896196	GF	On-Demand	Anodyne	CCR5	46	33
COc1cc(CS[C@@H]2CCCOC2)ccc1Cl	ZINC000450896206	CH	On-Demand	Anodyne	QRFPR	41	36
COc1cc(CS[C@H]2CCCOC2)ccc1Cl	ZINC000450896207	CH	On-Demand	Anodyne	QRFPR	41	36
COC(=O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450896210	GF	On-Demand	Anodyne	RBP4	41	33
COC(=O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450896211	GF	On-Demand	Anodyne	RBP4	41	33
COC(=O)[C@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450896212	GF	On-Demand	Anodyne	RBP4	41	33
COC(=O)[C@@H](c1ccccc1C(F)(F)F)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450896213	GF	On-Demand	Anodyne	RBP4	41	33
CC(C)(O)C(C)(C)CNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450896214	FG	On-Demand	Anodyne	AVPR2	45	39
CC(C)(O)C(C)(C)CNc1ncnc2[nH]c3ccccc3c12	ZINC000450896237	CG	On-Demand	Anodyne	UTS2R	31	45
CC[C@@H]1CC[C@H](C)N(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450896243	GF	On-Demand	Bother	TAAR1	19	40
CC[C@@H]1CC[C@H](C)N(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000450896245	GF	On-Demand	Bother	TAAR1	19	40
CCN1CCN(Cc2ccc(Cl)c(OC)c2)C[C@H]1c1ncc[nH]1	ZINC000450896271	EF	On-Demand	Anodyne	SSTR5	42	36
CCN1CCN(Cc2ccc(Cl)c(OC)c2)C[C@@H]1c1ncc[nH]1	ZINC000450896272	EF	On-Demand	Anodyne	SSTR5	42	36
COc1cccc2c(N3CCN([C@@H]4CCNC(=O)CC4)CC3)cc(C)nc12	ZINC000450896282	FE	On-Demand	Anodyne	HTR1A	20	47
COc1cccc2c(N3CCN([C@@H]4CCNC(=O)CC4)CC3)cc(C)nc12	ZINC000450896282	FE	On-Demand	Anodyne	ADRA1D	30	40
COc1cccc2c(N3CCN([C@@H]4CCNC(=O)CC4)CC3)cc(C)nc12	ZINC000450896282	FE	On-Demand	Anodyne	ADRA1A	25	40
COc1cccc2c(N3CCN([C@@H]4CCNC(=O)CC4)CC3)cc(C)nc12	ZINC000450896282	FE	On-Demand	Anodyne	ADRA1B	25	40
COc1cccc2c(N3CCN([C@H]4CCNC(=O)CC4)CC3)cc(C)nc12	ZINC000450896283	FE	On-Demand	Anodyne	HTR1A	20	47
COc1cccc2c(N3CCN([C@H]4CCNC(=O)CC4)CC3)cc(C)nc12	ZINC000450896283	FE	On-Demand	Anodyne	ADRA1D	30	40
COc1cccc2c(N3CCN([C@H]4CCNC(=O)CC4)CC3)cc(C)nc12	ZINC000450896283	FE	On-Demand	Anodyne	ADRA1A	25	40
COc1cccc2c(N3CCN([C@H]4CCNC(=O)CC4)CC3)cc(C)nc12	ZINC000450896283	FE	On-Demand	Anodyne	ADRA1B	25	40
COC[C@@]1(CO)CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450896288	DF	On-Demand	Anodyne	HRP1_PLAFA	81	36
COC[C@@]1(CO)CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450896288	DF	On-Demand	Anodyne	HNMT	51	35
COC[C@]1(CO)CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450896289	DF	On-Demand	Anodyne	HRP1_PLAFA	81	36
COC[C@]1(CO)CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450896289	DF	On-Demand	Anodyne	HNMT	51	35
CCc1cccc(C(=O)NC[C@@H]2C[C@H](F)CN2Cc2noc(C)n2)n1	ZINC000450896319	ED	On-Demand	Anodyne	PDE8B	43	31
CN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)c1nncs1	ZINC000450896331	EG	On-Demand	Anodyne	PRCP	45	35
CN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1nncs1	ZINC000450896332	EG	On-Demand	Anodyne	PRCP	45	35
CN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1nncs1	ZINC000450896333	EG	On-Demand	Anodyne	PRCP	45	35
CN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)c1nncs1	ZINC000450896334	EG	On-Demand	Anodyne	PRCP	45	35
C[C@@H]1CCCN(c2cc(NCC(C)(C)C(C)(C)O)ncn2)C1	ZINC000450896338	DF	On-Demand	Anodyne	PRCP	0	49
C[C@H]1CCCN(c2cc(NCC(C)(C)C(C)(C)O)ncn2)C1	ZINC000450896339	DF	On-Demand	Anodyne	PRCP	17	49
COC(=O)C1(CN2CCN(c3ccncc3OC)CC2)CC1	ZINC000450896350	DD	On-Demand	Anodyne	HTR1A	64	45
COC(=O)C1(CN2CCN(c3ccncc3OC)CC2)CC1	ZINC000450896350	DD	On-Demand	Anodyne	DRD2	48	41
COC(=O)C1(CN2CCN(c3ccncc3OC)CC2)CC1	ZINC000450896350	DD	On-Demand	Anodyne	ADRA1A	41	38
COC(=O)C1(CN2CCN(c3ccncc3OC)CC2)CC1	ZINC000450896350	DD	On-Demand	Anodyne	DRD3	48	38
COC(=O)C1(CN2CCN(c3ccncc3OC)CC2)CC1	ZINC000450896350	DD	On-Demand	Anodyne	HTR7	49	37
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896368	GE	On-Demand	Anodyne	ACOX1	49	36
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896368	GE	On-Demand	Anodyne	ABCB1	25	40
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896368	GE	On-Demand	Anodyne	CHRNA10	26	46
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896369	GE	On-Demand	Anodyne	ACOX1	49	36
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896369	GE	On-Demand	Anodyne	ABCB1	25	40
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896369	GE	On-Demand	Anodyne	CHRNA10	26	46
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896371	GE	On-Demand	Anodyne	ACOX1	49	36
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896371	GE	On-Demand	Anodyne	ABCB1	25	40
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896371	GE	On-Demand	Anodyne	CHRNA10	26	46
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896374	GE	On-Demand	Anodyne	ACOX1	49	36
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896374	GE	On-Demand	Anodyne	ABCB1	25	40
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896374	GE	On-Demand	Anodyne	CHRNA10	26	46
COc1cnccc1N1CCN(Cc2nc(-c3cc(C)ccn3)no2)CC1	ZINC000450896387	FE	On-Demand	Anodyne	DRD2	27	41
CCOC(=O)C1(COC)CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450896389	GE	On-Demand	Anodyne	MMP13	24	44
CCOC(=O)C1(COC)CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450896389	GE	On-Demand	Anodyne	ADAM17	29	44
CCOC(=O)C1(COC)CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450896389	GE	On-Demand	Anodyne	MMP14	15	41
CCOC(=O)C1(COC)CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450896389	GE	On-Demand	Anodyne	MMP9	18	44
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450896396	GF	On-Demand	Mild	BCL2L1	103	35
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450896396	GF	On-Demand	Mild	BCL2	87	38
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450896396	GF	On-Demand	Mild	BCL2L2	44	31
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450896397	GF	On-Demand	Mild	BCL2L1	103	35
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450896397	GF	On-Demand	Mild	BCL2	87	38
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450896397	GF	On-Demand	Mild	BCL2L2	44	31
O=C1NCCN(C[C@H](O)Cc2ccccc2)[C@H]1c1ccc(Br)cc1	ZINC000450896424	GF	On-Demand	Anodyne	VACHT_TETCF	0	48
O=C1NCCN(C[C@H](O)Cc2ccccc2)[C@@H]1c1ccc(Br)cc1	ZINC000450896425	GF	On-Demand	Anodyne	VACHT_TETCF	0	48
COc1ccc(CNC(=O)CCN2CCC(C)=C(C)C2)c(OC)c1	ZINC000450896431	EF	On-Demand	Anodyne	DRD4	46	36
COc1ccc(CNC(=O)CCN2CCC(C)=C(C)C2)c(OC)c1	ZINC000450896431	EF	On-Demand	Anodyne	HTR7	31	42
COc1ccc(CNC(=O)CCN2CCC(C)=C(C)C2)c(OC)c1	ZINC000450896431	EF	On-Demand	Anodyne	MTNR1A	65	43
COc1ccc(CNC(=O)CCN2CCC(C)=C(C)C2)c(OC)c1	ZINC000450896431	EF	On-Demand	Anodyne	MTNR1B	56	42
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	HTR1A	56	39
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	DRD2	58	42
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	DRD1	26	43
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	DRD4	31	44
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	ADRA1D	55	40
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	HTR2A	32	41
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	ADRA1A	45	40
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	ADRA1B	40	40
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	DRD3	45	40
COc1cnccc1N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450896453	EE	On-Demand	Anodyne	HTR7	34	40
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	HTR1A	56	39
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	DRD2	58	42
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	DRD1	26	43
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	DRD4	31	44
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	ADRA1D	55	40
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	HTR2A	32	41
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	ADRA1A	45	40
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	ADRA1B	40	40
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	DRD3	45	40
COc1cnccc1N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450896455	EE	On-Demand	Anodyne	HTR7	34	40
CN(C)c1nc(NCC(C)(C)C(C)(C)O)nc2ccccc12	ZINC000450896483	DE	On-Demand	Anodyne	ADRA2A	17	50
Cc1nc(-c2cccnc2)nc(NCC(C)(C)C(C)(C)O)c1C	ZINC000450896490	DF	On-Demand	Anodyne	ROS1	44	32
CC(=O)N[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)C(C)(C)C	ZINC000450896496	EE	On-Demand	Anodyne	GAG-PRO	69	37
CC(=O)N[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)C(C)(C)C	ZINC000450896496	EE	On-Demand	Anodyne	Q82323_9DELA	67	32
CC(=O)N[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)C(C)(C)C	ZINC000450896497	EE	On-Demand	Anodyne	GAG-PRO	69	37
CC(=O)N[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)C(C)(C)C	ZINC000450896497	EE	On-Demand	Anodyne	Q82323_9DELA	67	32
CC(=O)N[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)C(C)(C)C	ZINC000450896498	EE	On-Demand	Anodyne	GAG-PRO	69	37
CC(=O)N[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)C(C)(C)C	ZINC000450896498	EE	On-Demand	Anodyne	Q82323_9DELA	67	32
CC(=O)N[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)C(C)(C)C	ZINC000450896499	EE	On-Demand	Anodyne	GAG-PRO	69	37
CC(=O)N[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)C(C)(C)C	ZINC000450896499	EE	On-Demand	Anodyne	Q82323_9DELA	67	32
CCO[C@@H]1COC[C@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450896513	CC	On-Demand	Bother	PRKCQ	40	35
CN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)c1nncs1	ZINC000450896525	FE	On-Demand	Mild	NR3C2	17	41
CN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)c1nncs1	ZINC000450896526	FE	On-Demand	Mild	NR3C2	17	41
COc1cc2c(NCC(C)(C)C(C)(C)O)ccnc2cc1F	ZINC000450896547	DH	On-Demand	Anodyne	HRP1_PLAFA	46	31
COc1cc2c(NCC(C)(C)C(C)(C)O)ccnc2cc1F	ZINC000450896547	DH	On-Demand	Anodyne	FGFR2	59	44
COc1cc2c(NCC(C)(C)C(C)(C)O)ccnc2cc1F	ZINC000450896547	DH	On-Demand	Anodyne	FGFR1	0	44
COc1cc2c(NCC(C)(C)C(C)(C)O)ccnc2cc1F	ZINC000450896547	DH	On-Demand	Anodyne	KDR	46	42
COc1cc2c(NCC(C)(C)C(C)(C)O)ccnc2cc1F	ZINC000450896547	DH	On-Demand	Anodyne	HNMT	40	31
COc1cc2c(NCC(C)(C)C(C)(C)O)ccnc2cc1F	ZINC000450896547	DH	On-Demand	Anodyne	MET	66	36
COc1cc2c(NCC(C)(C)C(C)(C)O)ccnc2cc1F	ZINC000450896547	DH	On-Demand	Anodyne	PDGFRA	51	38
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCCOc1cccc(F)c1	ZINC000450896569	FD	On-Demand	Anodyne	CHRNA10	40	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCCOc1cccc(F)c1	ZINC000450896570	FD	On-Demand	Anodyne	CHRNA10	40	40
CCOC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)nc1	ZINC000450896599	FD	On-Demand	Anodyne	HTR1A	60	41
CCOC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)nc1	ZINC000450896599	FD	On-Demand	Anodyne	DRD2	46	44
CCOC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)nc1	ZINC000450896599	FD	On-Demand	Anodyne	DRD4	32	44
CCOC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)nc1	ZINC000450896599	FD	On-Demand	Anodyne	DRD3	51	44
CCOC(=O)c1ccc(CN2CCN(c3ccncc3OC)CC2)nc1	ZINC000450896599	FD	On-Demand	Anodyne	P2RY12	23	40
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	DRD2	64	50
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	DRD1	29	50
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	DRD4	40	43
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	ADRA1D	28	40
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	HTR2A	33	50
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	ADRA1A	47	40
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	ADRA1B	40	42
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	DRD3	47	41
COc1cnccc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450896604	EF	On-Demand	Anodyne	HTR7	52	52
COc1cnccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450896609	EE	On-Demand	Anodyne	DRD2	29	40
COc1cnccc1N1CCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450896609	EE	On-Demand	Anodyne	DRD4	26	41
COc1cnccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896666	EF	On-Demand	Anodyne	HTR1A	70	46
COc1cnccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896666	EF	On-Demand	Anodyne	DRD2	69	47
COc1cnccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896666	EF	On-Demand	Anodyne	DRD1	26	43
COc1cnccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896666	EF	On-Demand	Anodyne	DRD4	51	33
COc1cnccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896666	EF	On-Demand	Anodyne	ADRA1D	54	43
COc1cnccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896666	EF	On-Demand	Anodyne	ADRA1B	32	43
COc1cnccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896666	EF	On-Demand	Anodyne	DRD3	52	39
COc1cnccc1N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896666	EF	On-Demand	Anodyne	HTR7	49	40
COC[C@]1(CO)CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C1	ZINC000450896673	FD	On-Demand	Anodyne	NPBWR1	48	41
COC[C@@]1(CO)CCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C1	ZINC000450896674	FD	On-Demand	Anodyne	NPBWR1	48	41
COc1cc(CN2CCN(c3ccncc3OC)CC2)ccc1Cl	ZINC000450896684	EG	On-Demand	Anodyne	HTR1A	50	43
COc1cc(CN2CCN(c3ccncc3OC)CC2)ccc1Cl	ZINC000450896684	EG	On-Demand	Anodyne	DRD2	52	47
COc1cc(CN2CCN(c3ccncc3OC)CC2)ccc1Cl	ZINC000450896684	EG	On-Demand	Anodyne	DRD1	22	43
COc1cc(CN2CCN(c3ccncc3OC)CC2)ccc1Cl	ZINC000450896684	EG	On-Demand	Anodyne	DRD3	43	47
COc1cc(CN2CCN(c3ccncc3OC)CC2)ccc1Cl	ZINC000450896684	EG	On-Demand	Anodyne	SSTR5	42	41
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	DRD2	31	44
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	HTR2A	23	61
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	HTR2C	24	61
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	SLC6A1	57	38
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	DRD3	22	43
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	CHRM5	27	42
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	HTR7	29	48
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	HTR5A	41	61
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	CHRNA6	0	43
CC1=C(C)CN(CCCC(=O)c2ccccc2)CC1	ZINC000450896689	CH	On-Demand	Anodyne	CYP2J2	64	48
CC(C)(O)C(C)(C)CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450896694	DE	On-Demand	Anodyne	DHOD	0	58
CC(C)Cn1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(C(F)F)n1	ZINC000450896705	GH	On-Demand	Anodyne	DRD4	19	54
CC(C)Cn1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(C(F)F)n1	ZINC000450896705	GH	On-Demand	Anodyne	DRD3	0	54
CC(C)Cn1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C(F)F)n1	ZINC000450896706	GH	On-Demand	Anodyne	DRD4	19	54
CC(C)Cn1cc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C(F)F)n1	ZINC000450896706	GH	On-Demand	Anodyne	DRD3	0	54
CC(C)Cn1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(C(F)F)n1	ZINC000450896707	GH	On-Demand	Anodyne	DRD4	19	54
CC(C)Cn1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(C(F)F)n1	ZINC000450896707	GH	On-Demand	Anodyne	DRD3	0	54
CC(C)Cn1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C(F)F)n1	ZINC000450896708	GH	On-Demand	Anodyne	DRD4	19	54
CC(C)Cn1cc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C(F)F)n1	ZINC000450896708	GH	On-Demand	Anodyne	DRD3	0	54
Oc1nnc([C@@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896731	FF	On-Demand	Anodyne	ESR1	57	34
Oc1nnc([C@@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896731	FF	On-Demand	Anodyne	LTA4H	43	38
Oc1nnc([C@@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896731	FF	On-Demand	Anodyne	HRH3	25	40
Oc1nnc([C@@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896731	FF	On-Demand	Anodyne	PSMB2	48	36
Oc1nnc([C@@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896731	FF	On-Demand	Anodyne	PSMB1	42	36
Oc1nnc([C@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896732	FF	On-Demand	Anodyne	ESR1	57	34
Oc1nnc([C@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896732	FF	On-Demand	Anodyne	LTA4H	43	38
Oc1nnc([C@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896732	FF	On-Demand	Anodyne	HRH3	25	40
Oc1nnc([C@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896732	FF	On-Demand	Anodyne	PSMB2	48	36
Oc1nnc([C@H]2CCCN(CCOc3ccc(OC(F)(F)F)cc3)C2)o1	ZINC000450896732	FF	On-Demand	Anodyne	PSMB1	42	36
O=C(CC[C@@H]1CCC(=O)N1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450896739	FH	On-Demand	Anodyne	KCNQ2	18	40
O=C(CC[C@H]1CCC(=O)N1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450896740	FH	On-Demand	Anodyne	KCNQ2	18	40
N#Cc1ccc(NC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450896746	ED	On-Demand	Mild	CETP	35	40
N#Cc1ccc(NC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450896747	ED	On-Demand	Mild	CETP	35	40
CCSc1cccnc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450896754	FG	On-Demand	Anodyne	DRD4	16	49
CCSc1cccnc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450896755	FG	On-Demand	Anodyne	DRD4	16	49
CCSc1cccnc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450896756	FG	On-Demand	Anodyne	DRD4	16	49
CCSc1cccnc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450896757	FG	On-Demand	Anodyne	DRD4	16	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C)CCC(=O)CC1	ZINC000450896764	EF	On-Demand	Anodyne	DRD4	24	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C)CCC(=O)CC1	ZINC000450896765	EF	On-Demand	Anodyne	DRD4	24	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C)CCC(=O)CC1	ZINC000450896766	EF	On-Demand	Anodyne	DRD4	24	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C)CCC(=O)CC1	ZINC000450896767	EF	On-Demand	Anodyne	DRD4	24	48
CNS(=O)(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450896790	ED	On-Demand	Bother	BDKRB1	22	41
COc1cccc(OCCC(=O)N2CCc3c(F)cccc32)c1	ZINC000450896823	DG	On-Demand	Anodyne	DRD4	50	39
COc1ccc(CNC(=O)CCN(CC2CC2)C2CCC2)c(OC)c1	ZINC000450896836	EF	On-Demand	Anodyne	MTNR1A	50	36
CC(=O)CCCCCSc1n[nH]c(-c2ccc3c(c2)OCCO3)n1	ZINC000450896850	EG	On-Demand	Anodyne	HSP82	0	40
COC[C@@]1(CO)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450896871	DE	On-Demand	Anodyne	PDE3B	45	32
COC[C@]1(CO)CCN(c2ncnc3ccc(SC)cc23)C1	ZINC000450896872	DE	On-Demand	Anodyne	PDE3B	45	32
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1scnc1-c1ccccc1	ZINC000450896876	GH	On-Demand	Anodyne	DRD4	19	44
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1scnc1-c1ccccc1	ZINC000450896876	GH	On-Demand	Anodyne	SIGMAR1	20	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1scnc1-c1ccccc1	ZINC000450896877	GH	On-Demand	Anodyne	DRD4	19	44
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1scnc1-c1ccccc1	ZINC000450896877	GH	On-Demand	Anodyne	SIGMAR1	20	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1scnc1-c1ccccc1	ZINC000450896878	GH	On-Demand	Anodyne	DRD4	19	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1scnc1-c1ccccc1	ZINC000450896878	GH	On-Demand	Anodyne	SIGMAR1	20	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1scnc1-c1ccccc1	ZINC000450896879	GH	On-Demand	Anodyne	DRD4	19	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1scnc1-c1ccccc1	ZINC000450896879	GH	On-Demand	Anodyne	SIGMAR1	20	40
CC(C)OC(=O)CCCNC(=O)[C@H](O)C1CCC1	ZINC000450896899	CC	On-Demand	Anodyne	EPHX2	22	47
CC(C)OC(=O)CCCNC(=O)[C@@H](O)C1CCC1	ZINC000450896900	CC	On-Demand	Anodyne	EPHX2	22	47
CC(C)NC(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450896907	EF	On-Demand	Bother	TAAR1	18	45
CCO[C@@H]1COC[C@H]1Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450896911	DF	On-Demand	Anodyne	MAOB	28	43
CCOC(=O)C1(COC)CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450896917	EF	On-Demand	Anodyne	NPFFR1	45	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896953	DD	On-Demand	Anodyne	ACE	45	36
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896953	DD	On-Demand	Anodyne	DRD4	25	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896953	DD	On-Demand	Anodyne	DRD3	0	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896953	DD	On-Demand	Anodyne	SIGMAR1	36	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896953	DD	On-Demand	Anodyne	BIRC2	49	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896954	DD	On-Demand	Anodyne	ACE	45	36
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896954	DD	On-Demand	Anodyne	DRD4	25	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896954	DD	On-Demand	Anodyne	DRD3	0	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896954	DD	On-Demand	Anodyne	SIGMAR1	36	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896954	DD	On-Demand	Anodyne	BIRC2	49	47
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896955	DD	On-Demand	Anodyne	ACE	45	36
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896955	DD	On-Demand	Anodyne	DRD4	25	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896955	DD	On-Demand	Anodyne	DRD3	0	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896955	DD	On-Demand	Anodyne	SIGMAR1	36	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450896955	DD	On-Demand	Anodyne	BIRC2	49	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896956	DD	On-Demand	Anodyne	ACE	45	36
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896956	DD	On-Demand	Anodyne	DRD4	25	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896956	DD	On-Demand	Anodyne	DRD3	0	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896956	DD	On-Demand	Anodyne	SIGMAR1	36	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450896956	DD	On-Demand	Anodyne	BIRC2	49	47
Oc1nnc([C@@H]2CCCN(CCCOc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896957	FG	On-Demand	Anodyne	HRH3	44	39
Oc1nnc([C@@H]2CCCN(CCCOc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896957	FG	On-Demand	Anodyne	CHRNA10	42	35
Oc1nnc([C@@H]2CCCN(CCCOc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896957	FG	On-Demand	Anodyne	GALR3	25	40
Oc1nnc([C@@H]2CCCN(CCCOc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896957	FG	On-Demand	Anodyne	MEN1	49	35
Oc1nnc([C@H]2CCCN(CCCOc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896958	FG	On-Demand	Anodyne	HRH3	44	39
Oc1nnc([C@H]2CCCN(CCCOc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896958	FG	On-Demand	Anodyne	CHRNA10	42	35
Oc1nnc([C@H]2CCCN(CCCOc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896958	FG	On-Demand	Anodyne	GALR3	25	40
Oc1nnc([C@H]2CCCN(CCCOc3cccc(C(F)(F)F)c3)C2)o1	ZINC000450896958	FG	On-Demand	Anodyne	MEN1	49	35
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C(C)(C)O	ZINC000450896999	ED	On-Demand	Anodyne	CA2	75	55
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C(C)(C)O	ZINC000450896999	ED	On-Demand	Anodyne	CA1	61	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C(C)(C)O	ZINC000450896999	ED	On-Demand	Anodyne	CA7	50	38
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C(C)(C)O	ZINC000450896999	ED	On-Demand	Anodyne	CA5B	52	38
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C(C)(C)O	ZINC000450896999	ED	On-Demand	Anodyne	CA4	61	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C(C)(C)O	ZINC000450896999	ED	On-Demand	Anodyne	CA5A	55	38
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C(C)(C)O	ZINC000450896999	ED	On-Demand	Anodyne	CA9	36	41
CC(C)(O)C(C)(C)CNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450897017	EG	On-Demand	Anodyne	DHOD	0	41
CC(F)(F)CCn1cc(-c2cccc([N+](=O)[O-])c2)cn1	ZINC000450897019	CH	On-Demand	Bother	F2RL3	45	32
CC(=O)CCCCCn1c(=O)sc2ccccc2c1=O	ZINC000450897022	CF	On-Demand	Anodyne	CASP3	29	42
CC(=O)CCCCCn1c(=O)sc2ccccc2c1=O	ZINC000450897022	CF	On-Demand	Anodyne	CASP7	46	40
Cc1nc(-c2ccccn2)nc(NCC(C)(C)C(C)(C)O)c1C	ZINC000450897040	DF	On-Demand	Anodyne	METAP1	59	47
O=c1sc2ccccc2c(=O)n1C[C@H]1CCCC1(F)F	ZINC000450897047	CF	On-Demand	Anodyne	ACACB	48	33
O=c1sc2ccccc2c(=O)n1C[C@@H]1CCCC1(F)F	ZINC000450897048	CF	On-Demand	Anodyne	ACACB	48	33
COc1cc(CN2CCC[C@@H](c3nnc(O)o3)C2)ccc1[N+](=O)[O-]	ZINC000450897054	EE	On-Demand	Bother	SSTR5	53	44
COc1cc(CN2CCC[C@H](c3nnc(O)o3)C2)ccc1[N+](=O)[O-]	ZINC000450897055	EE	On-Demand	Bother	SSTR5	53	44
COc1cccc(OCCC(=O)N(C)c2nncs2)c1	ZINC000450897066	CD	On-Demand	Anodyne	MTNR1A	22	44
CCS(=O)(=O)c1ccc(CN(CC2CC2)C2CCC2)cc1	ZINC000450897134	DG	On-Demand	Anodyne	RORC	16	40
COc1cnccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897143	DD	On-Demand	Anodyne	HTR1A	33	40
COc1cnccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897143	DD	On-Demand	Anodyne	DRD2	20	44
COc1cnccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897143	DD	On-Demand	Anodyne	ADRA1D	26	40
COc1cnccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897143	DD	On-Demand	Anodyne	ADRA1A	23	40
COc1cnccc1N1CCN(C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897143	DD	On-Demand	Anodyne	ADRA1B	22	40
COc1cnccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897144	DD	On-Demand	Anodyne	HTR1A	33	40
COc1cnccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897144	DD	On-Demand	Anodyne	DRD2	20	44
COc1cnccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897144	DD	On-Demand	Anodyne	ADRA1D	26	40
COc1cnccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897144	DD	On-Demand	Anodyne	ADRA1A	23	40
COc1cnccc1N1CCN(C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450897144	DD	On-Demand	Anodyne	ADRA1B	22	40
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450897145	ED	On-Demand	Mild	BCL2L1	107	36
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450897145	ED	On-Demand	Mild	BCL2	72	34
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450897145	ED	On-Demand	Mild	BCL2L2	40	31
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450897146	ED	On-Demand	Mild	BCL2L1	107	36
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450897146	ED	On-Demand	Mild	BCL2	72	34
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450897146	ED	On-Demand	Mild	BCL2L2	40	31
CCOC(=O)C1(COC)CCN(Cc2cccc(C(=O)OC)c2Cl)CC1	ZINC000450897147	GF	On-Demand	Anodyne	NPFFR1	44	36
C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450897198	GF	On-Demand	Anodyne	ADAM17	30	40
C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450897199	GF	On-Demand	Anodyne	ADAM17	30	40
C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450897200	GF	On-Demand	Anodyne	ADAM17	30	40
C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450897201	GF	On-Demand	Anodyne	ADAM17	30	40
COc1ccc(-c2noc(NCC(C)(C)C(C)(C)O)n2)cc1	ZINC000450897231	DE	On-Demand	Anodyne	LUCI_PHOPE	21	41
O=C(CC1(O)CCC1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450897252	EI	On-Demand	Anodyne	KCNQ2	23	44
COC(=O)c1coc(CN2CCC(F)(c3cccc(Cl)c3)CC2)n1	ZINC000450897298	FH	On-Demand	Anodyne	TACR3	46	35
Oc1nnc([C@@H]2CCCN(CCOc3ccccc3C(F)(F)F)C2)o1	ZINC000450897303	FG	On-Demand	Anodyne	SLC6A1	45	37
Oc1nnc([C@H]2CCCN(CCOc3ccccc3C(F)(F)F)C2)o1	ZINC000450897305	FG	On-Demand	Anodyne	SLC6A1	45	37
COCc1cc(NCC(C)(C)C(C)(C)O)n2ncnc2n1	ZINC000450897307	CD	On-Demand	Anodyne	DHOD	0	43
CCCNC(=O)c1ccc(N2CCC[C@]3(CCSC3)C2)nc1	ZINC000450897315	DF	On-Demand	Anodyne	HDAC1	0	43
CCCNC(=O)c1ccc(N2CCC[C@@]3(CCSC3)C2)nc1	ZINC000450897317	DF	On-Demand	Anodyne	HDAC1	0	43
Cc1nc(-c2ccccn2)nc(N2CCC[C@]3(CCSC3)C2)c1C	ZINC000450897326	EH	On-Demand	Anodyne	METAP1	15	42
Cc1nc(-c2ccccn2)nc(N2CCC[C@@]3(CCSC3)C2)c1C	ZINC000450897328	EH	On-Demand	Anodyne	METAP1	15	42
Cn1[nH]c([C@@H]2CCCN2CC(=O)N(Cc2ccccc2)CC(F)(F)F)nc1=N	ZINC000450897330	GD	On-Demand	Anodyne	PLA2G7	41	33
Cn1[nH]c([C@H]2CCCN2CC(=O)N(Cc2ccccc2)CC(F)(F)F)nc1=N	ZINC000450897331	GD	On-Demand	Anodyne	PLA2G7	41	33
COC(=O)[C@@H]1CN(C[C@](C)(O)C(C)=O)C[C@H]1c1ccccc1	ZINC000450897332	DD	On-Demand	Anodyne	SLC6A1	84	50
COC(=O)[C@@H]1CN(C[C@@](C)(O)C(C)=O)C[C@H]1c1ccccc1	ZINC000450897333	DD	On-Demand	Anodyne	SLC6A1	84	50
CC[C@H]1CN(CCc2ccc(Cl)cc2)CCCO1	ZINC000450897342	CG	On-Demand	Anodyne	DRD4	21	52
CC[C@H]1CN(CCc2ccc(Cl)cc2)CCCO1	ZINC000450897342	CG	On-Demand	Anodyne	SIGMAR1	26	44
CC[C@@H]1CN(CCc2ccc(Cl)cc2)CCCO1	ZINC000450897343	CG	On-Demand	Anodyne	DRD4	21	52
CC[C@@H]1CN(CCc2ccc(Cl)cc2)CCCO1	ZINC000450897343	CG	On-Demand	Anodyne	SIGMAR1	26	44
COCCOCCOc1ccc(Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450897346	GE	On-Demand	Anodyne	PLA2G2A	33	41
COCCOCCOc1ccc(Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450897346	GE	On-Demand	Anodyne	PROKR1	63	31
COc1ccc2ncc(=O)n(CCC(F)(F)F)c2c1	ZINC000450897347	CE	On-Demand	Anodyne	GSG2	40	37
COC(=O)[C@@H](C)NC(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450897348	GE	On-Demand	Bother	TAAR1	21	45
COC(=O)[C@H](C)NC(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450897349	GE	On-Demand	Bother	TAAR1	21	45
COc1cc(OC)c2ncnc(NCC(C)(C)C(C)(C)O)c2c1	ZINC000450897352	DE	On-Demand	Anodyne	PDE6A	44	35
CCO[C@@H]1COC[C@H]1Nc1ccnc2cc(F)ccc12	ZINC000450897357	CF	On-Demand	Anodyne	HRP1_PLAFA	41	35
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450897358	GH	On-Demand	Anodyne	C3AR1	42	36
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450897359	GH	On-Demand	Anodyne	C3AR1	42	36
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450897360	GH	On-Demand	Anodyne	C3AR1	42	36
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450897361	GH	On-Demand	Anodyne	C3AR1	42	36
COc1cc(CC(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)ccc1O	ZINC000450897365	FE	On-Demand	Anodyne	NPY2R	43	32
COc1cc(CC(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)ccc1O	ZINC000450897366	FE	On-Demand	Anodyne	NPY2R	43	32
COC[C@@]1(CO)CCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450897391	CD	On-Demand	Anodyne	GPR39	0	41
COC[C@]1(CO)CCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450897395	CD	On-Demand	Anodyne	GPR39	0	41
C=CCC[C@H](CO)Nc1ncnc2ccc(I)cc12	ZINC000450897402	FF	On-Demand	Mild	HTT	0	41
C=CCC[C@@H](CO)Nc1ncnc2ccc(I)cc12	ZINC000450897403	FF	On-Demand	Mild	HTT	0	41
CC(=O)[C@@](C)(O)CN(C)CCCOCc1ccccc1	ZINC000450897409	CD	On-Demand	Anodyne	AMY2	57	36
COC(=O)c1csc(CN2Cc3ccc(C)cc3C2)n1	ZINC000450897413	CF	On-Demand	Anodyne	DPP9	15	40
CC(=O)[C@](C)(O)CN(C)CCCOCc1ccccc1	ZINC000450897415	CD	On-Demand	Anodyne	AMY2	57	36
COC[C@@]1(CO)CCN(c2ccc3ccccc3n2)C1	ZINC000450897460	CE	On-Demand	Anodyne	HTR3A	24	45
COC[C@@]1(CO)CCN(c2ccc3ccccc3n2)C1	ZINC000450897460	CE	On-Demand	Anodyne	SORD	30	48
COC[C@]1(CO)CCN(c2ccc3ccccc3n2)C1	ZINC000450897461	CE	On-Demand	Anodyne	HTR3A	24	45
COC[C@]1(CO)CCN(c2ccc3ccccc3n2)C1	ZINC000450897461	CE	On-Demand	Anodyne	SORD	30	48
COC[C@@]1(CO)CCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450897467	DE	On-Demand	Anodyne	FAAH	16	45
COC[C@]1(CO)CCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450897468	DE	On-Demand	Anodyne	FAAH	16	45
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCCN1CCCC1	ZINC000450897516	CF	On-Demand	Anodyne	NET	0	40
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCCN1CCCC1	ZINC000450897517	CF	On-Demand	Anodyne	NET	0	40
C[C@H](c1ccccc1)[C@H](O)CN(C)CCCN1CCCC1	ZINC000450897518	CF	On-Demand	Anodyne	NET	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCCN1CCCC1	ZINC000450897519	CF	On-Demand	Anodyne	NET	0	40
COc1ccc(OCc2cn(C)nc2C)c(Br)c1	ZINC000450897524	DG	On-Demand	Anodyne	GSG2	47	36
CC(C)OCCOC1CCN(c2ncncc2-c2ccccc2)CC1	ZINC000450897565	EH	On-Demand	Anodyne	SLC9A1	0	51
CC(=O)CCCCCn1ccc(C)c(C#N)c1=O	ZINC000450897593	BE	On-Demand	Mild	GRM2	19	41
C[C@@H]1CCCN(c2cc(NCc3nc(-c4ccccn4)n[nH]3)ncn2)C1	ZINC000450897621	FF	On-Demand	Anodyne	GPR39	0	41
C[C@H]1CCCN(c2cc(NCc3nc(-c4ccccn4)n[nH]3)ncn2)C1	ZINC000450897622	FF	On-Demand	Anodyne	GPR39	0	41
CC(C)CCNS(=O)(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450897623	EG	On-Demand	Anodyne	MMP13	15	41
CC(=O)c1ccc(CN2CCC[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]32)cc1	ZINC000450897632	GG	On-Demand	Anodyne	ACHE	16	42
CC(=O)c1ccc(CN2CCC[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]32)cc1	ZINC000450897632	GG	On-Demand	Anodyne	SIGMAR1	28	41
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450897633	ED	On-Demand	Anodyne	ACE	47	39
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450897633	ED	On-Demand	Anodyne	XIAP	24	40
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450897633	ED	On-Demand	Anodyne	BIRC2	40	36
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450897634	ED	On-Demand	Anodyne	ACE	47	39
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450897634	ED	On-Demand	Anodyne	XIAP	24	40
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450897634	ED	On-Demand	Anodyne	BIRC2	40	36
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450897635	ED	On-Demand	Anodyne	ACE	47	39
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450897635	ED	On-Demand	Anodyne	XIAP	24	40
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450897635	ED	On-Demand	Anodyne	BIRC2	40	36
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450897636	ED	On-Demand	Anodyne	ACE	47	39
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450897636	ED	On-Demand	Anodyne	XIAP	24	40
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450897636	ED	On-Demand	Anodyne	BIRC2	40	36
CC1CCN(C(=O)c2ccc(NCC(C)(C)C(C)(C)O)nc2)CC1	ZINC000450897653	EG	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(NCC(C)(C)C(C)(C)O)nc2)CC1	ZINC000450897653	EG	On-Demand	Anodyne	L3MBTL3	58	34
CCc1nc(C)c(COc2ccc(S(=O)(=O)NCCC(C)C)cc2)o1	ZINC000450897654	FG	On-Demand	Anodyne	ADAMTS4	46	38
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450897661	ED	On-Demand	Bother	CA2	52	45
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450897661	ED	On-Demand	Bother	CA1	48	37
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450897661	ED	On-Demand	Bother	CA4	45	39
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450897661	ED	On-Demand	Bother	CA5A	40	34
COc1ccc(CNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1OC	ZINC000450897662	GD	On-Demand	Anodyne	HCRTR1	18	43
COc1ccc(CNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1OC	ZINC000450897662	GD	On-Demand	Anodyne	SSTR5	45	37
COc1ccc(CNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1OC	ZINC000450897662	GD	On-Demand	Anodyne	HCRTR2	16	40
COc1ccc(CNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1OC	ZINC000450897664	GD	On-Demand	Anodyne	HCRTR1	18	43
COc1ccc(CNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1OC	ZINC000450897664	GD	On-Demand	Anodyne	SSTR5	45	37
COc1ccc(CNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1OC	ZINC000450897664	GD	On-Demand	Anodyne	HCRTR2	16	40
COc1cc(C)c(Br)cc1NC(=O)CS(=O)(=O)C1CC1	ZINC000450897702	FE	On-Demand	Anodyne	GLMU	0	41
CCc1nc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)[nH]c(=N)n1	ZINC000450897713	EH	On-Demand	Anodyne	NS5B	0	42
CCc1nc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)[nH]c(=N)n1	ZINC000450897713	EH	On-Demand	Anodyne	CYP2C19	15	40
CCc1nc(SCc2ccc([C@H](C)C(F)(F)F)cc2)[nH]c(=N)n1	ZINC000450897714	EH	On-Demand	Anodyne	NS5B	0	42
CCc1nc(SCc2ccc([C@H](C)C(F)(F)F)cc2)[nH]c(=N)n1	ZINC000450897714	EH	On-Demand	Anodyne	CYP2C19	15	40
Cc1ccc(F)c(CC(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c1	ZINC000450897716	ED	On-Demand	Anodyne	SSTR3	23	41
Cc1ccc(F)c(CC(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)c1	ZINC000450897718	ED	On-Demand	Anodyne	SSTR3	23	41
Cc1ccc(F)c(CC(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c1	ZINC000450897719	ED	On-Demand	Anodyne	SSTR3	23	41
Cc1ccc(F)c(CC(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)c1	ZINC000450897720	ED	On-Demand	Anodyne	SSTR3	23	41
O=c1sc2ccccc2c(=O)n1C[C@@H]1CCCCC1(F)F	ZINC000450897729	DG	On-Demand	Anodyne	ACACB	46	32
O=c1sc2ccccc2c(=O)n1C[C@H]1CCCCC1(F)F	ZINC000450897730	DG	On-Demand	Anodyne	ACACB	46	32
CN1CCN(S(=O)(=O)c2ccc(NCC(C)(C)C(C)(C)O)nc2)CC1	ZINC000450897764	FD	On-Demand	Anodyne	TGM2	32	45
CN1CCN(S(=O)(=O)c2ccc(NCC(C)(C)C(C)(C)O)nc2)CC1	ZINC000450897764	FD	On-Demand	Anodyne	GCK	60	34
CN1CCN(S(=O)(=O)c2ccc(NCC(C)(C)C(C)(C)O)nc2)CC1	ZINC000450897764	FD	On-Demand	Anodyne	GCKR	75	34
CN1CCN(S(=O)(=O)c2ccc(NCC(C)(C)C(C)(C)O)nc2)CC1	ZINC000450897764	FD	On-Demand	Anodyne	NAMPT	20	40
CCO[C@@H]1COC[C@H]1Nc1ccnc2cc(F)c(Cl)cc12	ZINC000450897774	DG	On-Demand	Anodyne	HRP1_PLAFA	45	35
CC[C@@H]1CC[C@H](C)N(c2cc(C)nc3ncnn23)C1	ZINC000450897781	CE	On-Demand	Anodyne	DHOD	0	46
C=CCNC(=O)c1ccc(NCC(C)(C)C(C)(C)O)nc1	ZINC000450897790	CE	On-Demand	Mild	HCAR3	16	57
Cc1nnc2c3ccccc3c(NCC(C)(C)C(C)(C)O)nn12	ZINC000450897792	DE	On-Demand	Anodyne	CREBBP	44	35
Cc1nnc2c3ccccc3c(NCC(C)(C)C(C)(C)O)nn12	ZINC000450897792	DE	On-Demand	Anodyne	BRD9	57	39
CNS(=O)(=O)c1ccc(NCC(C)(C)C(C)(C)O)c(F)c1	ZINC000450897793	DD	On-Demand	Anodyne	CA1	16	40
CNS(=O)(=O)c1ccc(NCC(C)(C)C(C)(C)O)c(F)c1	ZINC000450897793	DD	On-Demand	Anodyne	CA4	15	40
c1nc(N2CCC[C@]3(CCSC3)C2)c2c3c(sc2n1)CCC3	ZINC000450897807	EH	On-Demand	Anodyne	RBP4	18	45
c1nc(N2CCC[C@@]3(CCSC3)C2)c2c3c(sc2n1)CCC3	ZINC000450897808	EH	On-Demand	Anodyne	RBP4	18	45
COC(=O)[C@@H]1CN(C[C@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC000450897813	EH	On-Demand	Anodyne	SLC6A1	81	48
COC(=O)[C@@H]1CN(C[C@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC000450897813	EH	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@@H]1CN(C[C@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC000450897813	EH	On-Demand	Anodyne	SLC6A3	41	49
COC(=O)[C@@H]1CN(C[C@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC000450897813	EH	On-Demand	Anodyne	CCR5	38	40
COC(=O)[C@@H]1CN(C[C@@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC000450897814	EH	On-Demand	Anodyne	SLC6A1	81	48
COC(=O)[C@@H]1CN(C[C@@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC000450897814	EH	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@@H]1CN(C[C@@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC000450897814	EH	On-Demand	Anodyne	SLC6A3	41	49
COC(=O)[C@@H]1CN(C[C@@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC000450897814	EH	On-Demand	Anodyne	CCR5	38	40
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	HTR1A	78	49
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	DRD2	53	49
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	DRD1	0	40
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	DRD4	50	39
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	ADRA1D	46	42
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	HTR1B	31	44
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	HTR2A	32	45
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	HTR2C	15	45
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	ADRA1A	45	42
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	DRD3	72	41
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	PDGFRB	45	40
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	HTR7	69	50
COc1ccc(CNC(=O)CCN2CCN(c3cnccc3C)CC2)c(OC)c1	ZINC000450897829	GE	On-Demand	Anodyne	CSF1R	18	40
COC(=O)[C@@H]1CN(Cc2nc(-c3ccc(OC)nn3)no2)C[C@H]1c1ccccc1	ZINC000450897844	GD	On-Demand	Anodyne	SLC6A1	28	41
COC(=O)[C@@H]1CN(Cc2nc(-c3ccc(OC)nn3)no2)C[C@H]1c1ccccc1	ZINC000450897844	GD	On-Demand	Anodyne	SLC6A3	16	40
COc1ccc2ncc(=O)n(Cc3cccc(C(=O)OC(C)(C)C)c3)c2c1	ZINC000450897845	FG	On-Demand	Anodyne	PLA2G2A	42	38
N#Cc1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450897847	DH	On-Demand	Mild	SMO	0	47
COCCOc1ccc(S[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450897849	EG	On-Demand	Anodyne	MAP	0	48
COCCOc1ccc(S[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450897849	EG	On-Demand	Anodyne	MAP1	135	45
COCCOc1ccc(S[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450897849	EG	On-Demand	Anodyne	GCK	29	44
COCCOc1ccc(S[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450897850	EG	On-Demand	Anodyne	MAP	0	48
COCCOc1ccc(S[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450897850	EG	On-Demand	Anodyne	MAP1	135	45
COCCOc1ccc(S[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450897850	EG	On-Demand	Anodyne	GCK	29	44
Brc1cccc(C2CCN(CCc3cscn3)CC2)c1	ZINC000450897854	FI	On-Demand	Anodyne	VACHT_TETCF	0	40
Brc1cccc(C2CCN(CCc3cscn3)CC2)c1	ZINC000450897854	FI	On-Demand	Anodyne	SCN5A	42	36
COC[C@]1(CO)CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450897882	ED	On-Demand	Anodyne	LRRK2	0	40
COC[C@@]1(CO)CCN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450897884	ED	On-Demand	Anodyne	LRRK2	0	40
CC(C)OCCOC1CCN(c2ccc3ccccc3n2)CC1	ZINC000450897980	DH	On-Demand	Anodyne	HTR3A	27	43
CC(C)OCCOC1CCN(c2ccc3ccccc3n2)CC1	ZINC000450897980	DH	On-Demand	Anodyne	SORD	24	45
C[C@@H](O)CCN1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000450898008	CG	On-Demand	Anodyne	OPRK1	17	43
C[C@@H](O)CCN1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000450898008	CG	On-Demand	Anodyne	OPRL1	17	42
C[C@@H](O)CCN1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000450898008	CG	On-Demand	Anodyne	CCR1	35	41
C[C@H](O)CCN1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000450898009	CG	On-Demand	Anodyne	OPRK1	17	43
C[C@H](O)CCN1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000450898009	CG	On-Demand	Anodyne	OPRL1	17	42
C[C@H](O)CCN1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000450898009	CG	On-Demand	Anodyne	CCR1	35	41
CC(=O)CCCCCOc1ccc(C)c([N+](=O)[O-])c1	ZINC000450898017	CG	On-Demand	Bother	P2RY12	22	41
CC(=O)CCCCCOc1ccc(C)c([N+](=O)[O-])c1	ZINC000450898017	CG	On-Demand	Bother	PLA2G4B	62	33
CNS(=O)(=O)c1ccc(N2CCC(OCCOC(C)C)CC2)c(F)c1	ZINC000450898033	FE	On-Demand	Anodyne	SLC6A9	20	40
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	ACE	40	46
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	OPRD1	0	41
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	GHRHR	55	32
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	P2RY12	131	41
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	MME	77	44
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CTSD	41	41
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	PGC	41	34
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	TACR2	34	40
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CTSB	34	44
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	TRY2_BOVIN	85	42
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	PAPA1_CARPA	42	37
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CYSP_TRYCR	45	37
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CCKAR	40	38
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CTSL	26	42
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	TIMP3	40	34
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	MC3R	45	34
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	MC5R	60	35
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	REN	45	41
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	PAM	0	41
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CCKBR	25	40
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CTSS	29	45
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CAPN1	50	38
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	CTSE	34	40
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	ACE2	96	40
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	PGA5	50	40
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	ST14	49	33
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	POL	0	47
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	SLC15A2	0	40
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	BLA1_STEMA	46	35
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	PSMB8	43	37
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	BRCA1	43	30
CC[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898041	EC	On-Demand	Anodyne	DERP1	0	44
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	ACE	40	46
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	OPRD1	0	41
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	GHRHR	55	32
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	P2RY12	131	41
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	MME	77	44
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CTSD	41	41
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	PGC	41	34
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	TACR2	34	40
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CTSB	34	44
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	TRY2_BOVIN	85	42
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	PAPA1_CARPA	42	37
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CYSP_TRYCR	45	37
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CCKAR	40	38
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CTSL	26	42
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	TIMP3	40	34
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	MC3R	45	34
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	MC5R	60	35
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	REN	45	41
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	PAM	0	41
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CCKBR	25	40
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CTSS	29	45
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CAPN1	50	38
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	CTSE	34	40
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	ACE2	96	40
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	PGA5	50	40
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	ST14	49	33
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	POL	0	47
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	SLC15A2	0	40
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	BLA1_STEMA	46	35
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	PSMB8	43	37
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	BRCA1	43	30
CC[C@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898042	EC	On-Demand	Anodyne	DERP1	0	44
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	ACE	40	46
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	OPRD1	0	41
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	GHRHR	55	32
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	P2RY12	131	41
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	MME	77	44
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CTSD	41	41
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	PGC	41	34
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	TACR2	34	40
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CTSB	34	44
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	TRY2_BOVIN	85	42
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	PAPA1_CARPA	42	37
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CYSP_TRYCR	45	37
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CCKAR	40	38
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CTSL	26	42
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	TIMP3	40	34
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	MC3R	45	34
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	MC5R	60	35
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	REN	45	41
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	PAM	0	41
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CCKBR	25	40
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CTSS	29	45
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CAPN1	50	38
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	CTSE	34	40
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	ACE2	96	40
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	PGA5	50	40
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	ST14	49	33
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	POL	0	47
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	SLC15A2	0	40
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	BLA1_STEMA	46	35
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	PSMB8	43	37
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	BRCA1	43	30
CC[C@@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898043	EC	On-Demand	Anodyne	DERP1	0	44
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	ACE	40	46
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	OPRD1	0	41
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	GHRHR	55	32
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	P2RY12	131	41
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	MME	77	44
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CTSD	41	41
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	PGC	41	34
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	TACR2	34	40
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CTSB	34	44
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	TRY2_BOVIN	85	42
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	PAPA1_CARPA	42	37
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CYSP_TRYCR	45	37
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CCKAR	40	38
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CTSL	26	42
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	TIMP3	40	34
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	MC3R	45	34
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	MC5R	60	35
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	REN	45	41
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	PAM	0	41
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CCKBR	25	40
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CTSS	29	45
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CAPN1	50	38
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	CTSE	34	40
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	ACE2	96	40
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	PGA5	50	40
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	ST14	49	33
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	POL	0	47
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	SLC15A2	0	40
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	BLA1_STEMA	46	35
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	PSMB8	43	37
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	BRCA1	43	30
CC[C@H](O)CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450898044	EC	On-Demand	Anodyne	DERP1	0	44
Cc1nc(NCC(C)(C)C(C)(C)O)ncc1[N+](=O)[O-]	ZINC000450898054	CD	On-Demand	Bother	PRKCQ	42	35
CC(C)OCCOC1CCN(c2ncnc3sccc23)CC1	ZINC000450898057	DG	On-Demand	Anodyne	PDE3A	43	33
COc1cc(CC(=O)N(C)c2nncs2)ccc1Cl	ZINC000450898062	CE	On-Demand	Anodyne	OPRK1	0	43
CC(C)OCCOC1CCN(c2ncnc3sc(-c4ccccc4)cc23)CC1	ZINC000450898068	GJ	On-Demand	Anodyne	PDE3A	42	38
CC(C)OCCOC1CCN(c2ncnc3sc(-c4ccccc4)cc23)CC1	ZINC000450898068	GJ	On-Demand	Anodyne	PDE3B	63	38
CC(C)OCCOC1CCN(c2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000450898077	FH	On-Demand	Mild	LIPG	64	45
CC(C)OCCOC1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1	ZINC000450898079	GF	On-Demand	Bother	TAAR1	23	48
CC[C@@H]1CC[C@H](C)N(c2ccnc(N3CCOCC3)n2)C1	ZINC000450898084	CE	On-Demand	Anodyne	SORD	42	37
CC(C)OCCOC1CCN(c2cnc3ccccc3n2)CC1	ZINC000450898112	DG	On-Demand	Anodyne	SORD	20	46
CCOC(=O)c1ccc(CN(C)CCCN2CCCC2)nc1	ZINC000450898124	DE	On-Demand	Anodyne	HNMT	49	33
COC(=O)[C@@H]1CN(C[C@H]2CCC(F)(F)C2)C[C@H]1c1ccccc1	ZINC000450898130	DG	On-Demand	Anodyne	SLC6A1	84	48
COC(=O)[C@@H]1CN(C[C@@H]2CCC(F)(F)C2)C[C@H]1c1ccccc1	ZINC000450898131	DG	On-Demand	Anodyne	SLC6A1	84	48
CC(C)OC(=O)CCCNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450898160	FI	On-Demand	Anodyne	ALPL	41	35
C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450898177	EE	On-Demand	Anodyne	CCR5	32	40
C[C@H](c1ccccc1)N(C)C(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450898178	EE	On-Demand	Anodyne	CCR5	32	40
C[C@H](c1ccccc1)N(C)C(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450898181	EE	On-Demand	Anodyne	CCR5	32	40
C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450898183	EE	On-Demand	Anodyne	CCR5	32	40
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1nc(-c2ccccc2)cs1	ZINC000450898198	GF	On-Demand	Anodyne	COLA	34	41
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1nc(-c2ccccc2)cs1	ZINC000450898198	GF	On-Demand	Anodyne	CPT1A	32	41
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1nc(-c2ccccc2)cs1	ZINC000450898198	GF	On-Demand	Anodyne	HDAC9	15	43
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1nc(-c2ccccc2)cs1	ZINC000450898198	GF	On-Demand	Anodyne	TRPA1	20	45
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1nc(-c2ccccc2)cs1	ZINC000450898201	GF	On-Demand	Anodyne	COLA	34	41
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1nc(-c2ccccc2)cs1	ZINC000450898201	GF	On-Demand	Anodyne	CPT1A	32	41
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1nc(-c2ccccc2)cs1	ZINC000450898201	GF	On-Demand	Anodyne	HDAC9	15	43
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1nc(-c2ccccc2)cs1	ZINC000450898201	GF	On-Demand	Anodyne	TRPA1	20	45
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3cccc(Br)c3)C2)o1	ZINC000450898207	GE	On-Demand	Anodyne	ACOX1	72	33
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3cccc(Br)c3)C2)o1	ZINC000450898208	GE	On-Demand	Anodyne	ACOX1	72	33
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3cccc(Br)c3)C2)o1	ZINC000450898210	GE	On-Demand	Anodyne	ACOX1	72	33
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3cccc(Br)c3)C2)o1	ZINC000450898213	GE	On-Demand	Anodyne	ACOX1	72	33
COc1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1Br	ZINC000450898246	FF	On-Demand	Anodyne	SSTR5	57	38
COc1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1Br	ZINC000450898247	FF	On-Demand	Anodyne	SSTR5	57	38
CC1(O)CC(C(=O)N2CCNC(=O)[C@H]2c2c(F)cccc2Cl)C1	ZINC000450898255	ED	On-Demand	Anodyne	NMBR	29	40
CC1(O)CC(C(=O)N2CCNC(=O)[C@@H]2c2c(F)cccc2Cl)C1	ZINC000450898256	ED	On-Demand	Anodyne	NMBR	29	40
CCC(CC)Oc1ccc(C(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1	ZINC000450898257	GF	On-Demand	Anodyne	SSTR3	29	47
CCC(CC)Oc1ccc(C(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)cc1	ZINC000450898258	GF	On-Demand	Anodyne	SSTR3	29	47
CCC(CC)Oc1ccc(C(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1	ZINC000450898259	GF	On-Demand	Anodyne	SSTR3	29	47
CCC(CC)Oc1ccc(C(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)cc1	ZINC000450898260	GF	On-Demand	Anodyne	SSTR3	29	47
CC(=O)c1ccc(NC2(Cc3ccccc3)CCOCC2)c([N+](=O)[O-])c1	ZINC000450898278	FI	On-Demand	Bother	TAAR1	19	43
CC(=O)c1ccc(NC2(Cc3ccccc3)CCOCC2)c([N+](=O)[O-])c1	ZINC000450898278	FI	On-Demand	Bother	AKR1C3	16	42
CNS(=O)(=O)c1ccc(N[C@H](C)C2CCCC2)c(F)c1	ZINC000450898292	DF	On-Demand	Anodyne	LEF	25	41
COC(=O)[C@@H]1CN(C[C@H](O)[C@@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450898302	FG	On-Demand	Anodyne	SLC6A1	88	51
COC(=O)[C@@H]1CN(C[C@H](O)[C@@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450898302	FG	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450898303	FG	On-Demand	Anodyne	SLC6A1	88	51
COC(=O)[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450898303	FG	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@@H]1CN(C[C@@H](O)[C@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450898304	FG	On-Demand	Anodyne	SLC6A1	88	51
COC(=O)[C@@H]1CN(C[C@@H](O)[C@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450898304	FG	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@@H]1CN(C[C@@H](O)[C@@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450898305	FG	On-Demand	Anodyne	SLC6A1	88	51
COC(=O)[C@@H]1CN(C[C@@H](O)[C@@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450898305	FG	On-Demand	Anodyne	SLC6A3	40	41
Cn1[nH]c([C@H]2CCCN2CCOc2ccc(Br)cc2)nc1=N	ZINC000450898346	FE	On-Demand	Anodyne	LTA4H	28	40
Cn1[nH]c([C@@H]2CCCN2CCOc2ccc(Br)cc2)nc1=N	ZINC000450898347	FE	On-Demand	Anodyne	LTA4H	28	40
COC(=O)[C@@H]1CN(CC[C@H](C)O)C[C@H]1c1ccccc1	ZINC000450898350	CD	On-Demand	Anodyne	SLC6A3	57	48
COC(=O)[C@@H]1CN(CC[C@@H](C)O)C[C@H]1c1ccccc1	ZINC000450898351	CD	On-Demand	Anodyne	SLC6A3	57	48
COC(=O)c1cc2ccc(OCc3cn(C)nc3C)cc2o1	ZINC000450898353	DF	On-Demand	Anodyne	MAOB	36	43
COC(=O)c1cnc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450898356	EG	On-Demand	Anodyne	ACKR3	40	33
C=CCNC(=O)c1ccc(N2CCC[C@]3(CCSC3)C2)nc1	ZINC000450898360	DF	On-Demand	Mild	HDAC1	0	41
C=CCNC(=O)c1ccc(N2CCC[C@@]3(CCSC3)C2)nc1	ZINC000450898361	DF	On-Demand	Mild	HDAC1	0	41
COC[C@@]1(CO)CCN(c2nc3ccccc3o2)C1	ZINC000450898390	CD	On-Demand	Anodyne	SORD	17	47
Brc1cccc(C2CCN(C[C@H]3COCCO3)CC2)c1	ZINC000450898393	EG	On-Demand	Anodyne	VACHT_TETCF	0	42
Brc1cccc(C2CCN(C[C@@H]3COCCO3)CC2)c1	ZINC000450898394	EG	On-Demand	Anodyne	VACHT_TETCF	0	42
COC[C@]1(CO)CCN(c2nc3ccccc3o2)C1	ZINC000450898399	CD	On-Demand	Anodyne	SORD	17	47
COC[C@@]1(CO)CCN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450898404	GH	On-Demand	Anodyne	SIRT3	57	31
COC[C@@]1(CO)CCN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450898404	GH	On-Demand	Anodyne	SIRT2	45	30
COC[C@]1(CO)CCN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450898406	GH	On-Demand	Anodyne	SIRT3	57	31
COC[C@]1(CO)CCN(c2ncnc3cc(-c4ccc(Cl)cc4)sc23)C1	ZINC000450898406	GH	On-Demand	Anodyne	SIRT2	45	30
COc1cnccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450898408	CE	On-Demand	Anodyne	HTR1A	48	39
COc1cnccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450898408	CE	On-Demand	Anodyne	ADRA1D	39	40
COc1cnccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450898408	CE	On-Demand	Anodyne	ADRA1A	31	40
COc1cnccc1N1CCN(CC2CC(F)(F)C2)CC1	ZINC000450898408	CE	On-Demand	Anodyne	ADRA1B	27	40
CC(C)(O)C(C)(C)CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450898417	FE	On-Demand	Anodyne	TGM2	29	44
CC(C)(O)C(C)(C)CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450898417	FE	On-Demand	Anodyne	GCK	57	32
CC(C)(O)C(C)(C)CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450898417	FE	On-Demand	Anodyne	GCKR	70	32
CC(C)(O)C(C)(C)CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450898417	FE	On-Demand	Anodyne	NAMPT	30	41
C[C@H]1CCN(C(=O)c2c[nH]c3nccc-3c2)CC12CCCCC2	ZINC000450898420	DH	On-Demand	Anodyne	L3MBTL3	44	33
C[C@@H]1CCN(C(=O)c2c[nH]c3nccc-3c2)CC12CCCCC2	ZINC000450898432	DH	On-Demand	Anodyne	L3MBTL3	44	33
O=C(CCCN1CCC[C@@H]1[C@H]1COCC[C@@H]1O)c1ccc(Br)cc1	ZINC000450898451	GG	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1CCC[C@@H]1[C@@H]1COCC[C@@H]1O)c1ccc(Br)cc1	ZINC000450898452	GG	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1CCC[C@@H]1[C@@H]1COCC[C@H]1O)c1ccc(Br)cc1	ZINC000450898453	GG	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1CCC[C@@H]1[C@H]1COCC[C@H]1O)c1ccc(Br)cc1	ZINC000450898454	GG	On-Demand	Anodyne	CYP2J2	48	34
COCCNC(=O)c1ccc(N2CCC(OCCOC(C)C)CC2)nc1	ZINC000450898456	FD	On-Demand	Anodyne	SCD1	23	44
C=CCC[C@@H](CO)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450898477	EG	On-Demand	Mild	AVPR2	54	37
CC[C@@H]1CC[C@H](C)N(c2ncc(C#N)cc2Cl)C1	ZINC000450898478	CH	On-Demand	Mild	CXCR3	18	41
C=CCC[C@H](CO)Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450898479	EG	On-Demand	Mild	AVPR2	54	37
COC[C@@]1(CO)CCN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450898488	ED	On-Demand	Anodyne	PDE3B	46	32
COC[C@]1(CO)CCN(c2ncnc3c(OC)cc(OC)cc23)C1	ZINC000450898489	ED	On-Demand	Anodyne	PDE3B	46	32
CCS(=O)(=O)c1ccc(CN(C)CCCN2CCCC2)cc1	ZINC000450898513	DE	On-Demand	Anodyne	HRH3	30	41
CCS(=O)(=O)c1ccc(CN(C)CCCN2CCCC2)cc1	ZINC000450898513	DE	On-Demand	Anodyne	SIGMAR1	26	55
COc1cnccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450898520	DC	On-Demand	Anodyne	HTR1A	53	40
COc1cnccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450898520	DC	On-Demand	Anodyne	DRD2	42	39
COc1cnccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450898520	DC	On-Demand	Anodyne	ADRA1D	52	40
COc1cnccc1N1CCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450898520	DC	On-Demand	Anodyne	ADRA1A	37	40
COc1cnccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450898523	DC	On-Demand	Anodyne	HTR1A	53	40
COc1cnccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450898523	DC	On-Demand	Anodyne	DRD2	42	39
COc1cnccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450898523	DC	On-Demand	Anodyne	ADRA1D	52	40
COc1cnccc1N1CCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450898523	DC	On-Demand	Anodyne	ADRA1A	37	40
CC(C)OCCOC1CCN(c2ncc(C(F)(F)F)s2)CC1	ZINC000450898525	EH	On-Demand	Anodyne	MLYCD	59	38
CC(C)OC(=O)CCCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450898529	DD	On-Demand	Anodyne	HPGDS	20	43
COc1ccc(-c2ccnc(NCC(C)(C)C(C)(C)O)n2)cc1	ZINC000450898537	DG	On-Demand	Anodyne	CLK4	26	57
COc1cc2c(NCC(C)(C)C(C)(C)O)ncnc2cc1F	ZINC000450898548	DE	On-Demand	Anodyne	EGFR	43	51
COc1cc2c(NCC(C)(C)C(C)(C)O)ncnc2cc1F	ZINC000450898548	DE	On-Demand	Anodyne	ERBB2	18	44
COc1cc2c(NCC(C)(C)C(C)(C)O)ncnc2cc1F	ZINC000450898548	DE	On-Demand	Anodyne	FGFR1	22	46
COc1cc2c(NCC(C)(C)C(C)(C)O)ncnc2cc1F	ZINC000450898548	DE	On-Demand	Anodyne	FLT1	33	46
COc1cc2c(NCC(C)(C)C(C)(C)O)ncnc2cc1F	ZINC000450898548	DE	On-Demand	Anodyne	FBP1	16	44
COc1cc2c(NCC(C)(C)C(C)(C)O)ncnc2cc1F	ZINC000450898548	DE	On-Demand	Anodyne	TEK	15	44
COc1cc2c(NCC(C)(C)C(C)(C)O)ncnc2cc1F	ZINC000450898548	DE	On-Demand	Anodyne	EPHA2	45	36
COc1cc2c(NCC(C)(C)C(C)(C)O)ncnc2cc1F	ZINC000450898548	DE	On-Demand	Anodyne	MKNK1	22	42
CCn1nnc(C)c1CSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C	ZINC000450898549	FE	On-Demand	Bother	F2RL3	44	31
O=C(NCc1ccc(C(F)F)cc1)C1(Cc2ccccc2)CCOCC1	ZINC000450898570	FI	On-Demand	Anodyne	NR3C2	23	43
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCCC1	ZINC000450898573	GF	On-Demand	Anodyne	SMO	15	44
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCCC1	ZINC000450898573	GF	On-Demand	Anodyne	ACAT	0	43
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCCC1	ZINC000450898573	GF	On-Demand	Anodyne	NPFFR1	36	41
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCCC1	ZINC000450898576	GF	On-Demand	Anodyne	SMO	15	44
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCCC1	ZINC000450898576	GF	On-Demand	Anodyne	ACAT	0	43
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCCC1	ZINC000450898576	GF	On-Demand	Anodyne	NPFFR1	36	41
CCCOc1cccc(CN2C(=O)N[C@](CC)(C3CC3)C2=O)c1	ZINC000450898591	DG	On-Demand	Anodyne	HRH2	22	41
CCCOc1cccc(CN2C(=O)N[C@@](CC)(C3CC3)C2=O)c1	ZINC000450898593	DG	On-Demand	Anodyne	HRH2	22	41
Cc1nc2ccccc2n1CCCCCN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450898604	FG	On-Demand	Anodyne	HRH1	18	40
Cc1nc2ccccc2n1CCCCCN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450898609	FG	On-Demand	Anodyne	HRH1	18	40
COC[C@@]1(CO)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450898618	FD	On-Demand	Anodyne	HTR3A	36	49
COC[C@@]1(CO)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450898618	FD	On-Demand	Anodyne	HRH4	33	49
CN(CCCN1CCCC1)CC1=CCCCC1	ZINC000450898623	BF	On-Demand	Anodyne	SIGMAR1	15	48
CCS(=O)(=O)c1ccc(CN2CCC(F)(c3cccc(OC)c3)CC2)cc1	ZINC000450898635	GH	On-Demand	Anodyne	SIGMAR1	30	45
CCS(=O)(=O)c1ccc(CN2CCC(F)(c3cccc(OC)c3)CC2)cc1	ZINC000450898635	GH	On-Demand	Anodyne	MMP13	21	49
CCS(=O)(=O)c1ccc(CN2CCC(F)(c3cccc(OC)c3)CC2)cc1	ZINC000450898635	GH	On-Demand	Anodyne	ADAM17	28	49
CCS(=O)(=O)c1ccc(CN2CCC(F)(c3cccc(OC)c3)CC2)cc1	ZINC000450898635	GH	On-Demand	Anodyne	MMP9	18	49
COC[C@]1(CO)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450898637	FD	On-Demand	Anodyne	HTR3A	36	49
COC[C@]1(CO)CCN(c2nc3ccccc3nc2N2CCN(C)CC2)C1	ZINC000450898637	FD	On-Demand	Anodyne	HRH4	33	49
Cc1nc(C2CC2)ccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450898650	EH	On-Demand	Anodyne	DRD4	31	54
Cc1nc(C2CC2)ccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450898650	EH	On-Demand	Anodyne	DRD3	0	54
Cc1nc(C2CC2)ccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450898651	EH	On-Demand	Anodyne	DRD4	31	54
Cc1nc(C2CC2)ccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450898651	EH	On-Demand	Anodyne	DRD3	0	54
Cc1nc(C2CC2)ccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450898653	EH	On-Demand	Anodyne	DRD4	31	54
Cc1nc(C2CC2)ccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450898653	EH	On-Demand	Anodyne	DRD3	0	54
Cc1nc(C2CC2)ccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450898655	EH	On-Demand	Anodyne	DRD4	31	54
Cc1nc(C2CC2)ccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450898655	EH	On-Demand	Anodyne	DRD3	0	54
CC(F)(F)CCSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450898703	CJ	On-Demand	Mild	AR	53	74
COc1cc(Cn2c(C)nn(C(C)(C)C)c2=O)ccc1Cl	ZINC000450898704	DF	On-Demand	Anodyne	PROKR1	62	38
CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450898743	FD	On-Demand	Anodyne	EPHX2	28	44
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450898744	FD	On-Demand	Anodyne	EPHX2	28	44
CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450898745	FD	On-Demand	Anodyne	EPHX2	28	44
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450898746	FD	On-Demand	Anodyne	EPHX2	28	44
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898777	FD	On-Demand	Anodyne	ACE	46	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898777	FD	On-Demand	Anodyne	MME	74	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898777	FD	On-Demand	Anodyne	TIMP3	42	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898777	FD	On-Demand	Anodyne	CAPNS1	48	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898777	FD	On-Demand	Anodyne	CAPN1	54	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898777	FD	On-Demand	Anodyne	CAPN2	58	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898777	FD	On-Demand	Anodyne	POL	0	49
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898778	FD	On-Demand	Anodyne	ACE	46	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898778	FD	On-Demand	Anodyne	MME	74	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898778	FD	On-Demand	Anodyne	TIMP3	42	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898778	FD	On-Demand	Anodyne	CAPNS1	48	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898778	FD	On-Demand	Anodyne	CAPN1	54	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898778	FD	On-Demand	Anodyne	CAPN2	58	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450898778	FD	On-Demand	Anodyne	POL	0	49
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898779	FD	On-Demand	Anodyne	ACE	46	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898779	FD	On-Demand	Anodyne	MME	74	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898779	FD	On-Demand	Anodyne	TIMP3	42	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898779	FD	On-Demand	Anodyne	CAPNS1	48	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898779	FD	On-Demand	Anodyne	CAPN1	54	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898779	FD	On-Demand	Anodyne	CAPN2	58	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898779	FD	On-Demand	Anodyne	POL	0	49
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898780	FD	On-Demand	Anodyne	ACE	46	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898780	FD	On-Demand	Anodyne	MME	74	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898780	FD	On-Demand	Anodyne	TIMP3	42	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898780	FD	On-Demand	Anodyne	CAPNS1	48	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898780	FD	On-Demand	Anodyne	CAPN1	54	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898780	FD	On-Demand	Anodyne	CAPN2	58	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450898780	FD	On-Demand	Anodyne	POL	0	49
N#Cc1ccc(SCC(=O)CC[C@@H]2CCCCO2)cc1C(F)(F)F	ZINC000450898788	FJ	On-Demand	Mild	AR	50	53
N#Cc1ccc(SCC(=O)CC[C@H]2CCCCO2)cc1C(F)(F)F	ZINC000450898789	FJ	On-Demand	Mild	AR	50	53
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450898792	FD	On-Demand	Anodyne	TRPV1	76	36
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450898792	FD	On-Demand	Anodyne	CCR2	22	40
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450898792	FD	On-Demand	Anodyne	SFRP1	46	32
CS(=O)(=O)N[C@H]1CCCC[C@@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450898793	FD	On-Demand	Anodyne	TRPV1	76	36
CS(=O)(=O)N[C@H]1CCCC[C@@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450898793	FD	On-Demand	Anodyne	CCR2	22	40
CS(=O)(=O)N[C@H]1CCCC[C@@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450898793	FD	On-Demand	Anodyne	SFRP1	46	32
CC(C)OC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450898809	EF	On-Demand	Anodyne	C3AR1	43	36
CC(C)OC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450898810	EF	On-Demand	Anodyne	C3AR1	43	36
CC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)c(Cl)c1	ZINC000450898832	DI	On-Demand	Anodyne	RAF1	15	40
CC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)c(Cl)c1	ZINC000450898832	DI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Cn1c(N2CCC[C@]3(CCSC3)C2)nc2ccccc21	ZINC000450898842	CG	On-Demand	Anodyne	HRH1	0	50
Cn1c(N2CCC[C@@]3(CCSC3)C2)nc2ccccc21	ZINC000450898845	CG	On-Demand	Anodyne	HRH1	0	50
c1ccc(-c2cncnc2N2CCC[C@@]3(CCSC3)C2)cc1	ZINC000450898874	DH	On-Demand	Anodyne	SLC9A1	0	43
c1ccc(-c2cncnc2N2CCC[C@]3(CCSC3)C2)cc1	ZINC000450898877	DH	On-Demand	Anodyne	SLC9A1	0	43
CCS(=O)(=O)c1ccc(CN2CCN(c3cnccc3C)CC2)cc1	ZINC000450898879	FF	On-Demand	Anodyne	DRD4	17	43
COc1ccc2ncc(=O)n(CCCCCC(C)=O)c2c1	ZINC000450898885	CF	On-Demand	Anodyne	P2RY12	32	41
COc1ccc2ncc(=O)n(CCCCCC(C)=O)c2c1	ZINC000450898885	CF	On-Demand	Anodyne	GSG2	43	39
N#Cc1cnc(N2CCC(Cc3cccc(F)c3F)CC2)c([N+](=O)[O-])c1	ZINC000450898902	FH	On-Demand	Mild	PRKCQ	0	41
COC(=O)[C@@H]1CN(CC2CCC(=O)CC2)C[C@H]1c1ccccc1	ZINC000450898905	DF	On-Demand	Anodyne	SLC6A1	103	51
COC(=O)[C@@H]1CN(CC2CCC(=O)CC2)C[C@H]1c1ccccc1	ZINC000450898905	DF	On-Demand	Anodyne	SLC6A3	43	43
COc1cc(OC)c2ncnc(N3CCC[C@@]4(CCSC4)C3)c2c1	ZINC000450898906	EG	On-Demand	Anodyne	PDE3B	42	32
COc1cc(OC)c2ncnc(N3CCC[C@]4(CCSC4)C3)c2c1	ZINC000450898907	EG	On-Demand	Anodyne	PDE3B	42	32
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1nc(=N)n(C)[nH]1	ZINC000450898927	FD	On-Demand	Mild	ADRB2	33	50
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1nc(=N)n(C)[nH]1	ZINC000450898927	FD	On-Demand	Mild	ADRB3	40	50
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1nc(=N)n(C)[nH]1	ZINC000450898930	FD	On-Demand	Mild	ADRB2	33	50
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1nc(=N)n(C)[nH]1	ZINC000450898930	FD	On-Demand	Mild	ADRB3	40	50
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1nc(=N)n(C)[nH]1	ZINC000450898932	FD	On-Demand	Mild	ADRB2	33	50
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1nc(=N)n(C)[nH]1	ZINC000450898932	FD	On-Demand	Mild	ADRB3	40	50
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1nc(=N)n(C)[nH]1	ZINC000450898934	FD	On-Demand	Mild	ADRB2	33	50
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1nc(=N)n(C)[nH]1	ZINC000450898934	FD	On-Demand	Mild	ADRB3	40	50
COc1ccc(-c2noc(=O)n2CCCCCC(C)=O)cc1Br	ZINC000450898936	GG	On-Demand	Anodyne	GRM7	16	40
COc1cc(OC)c(NC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1Cl	ZINC000450898951	GE	On-Demand	Anodyne	HTR4	40	41
COc1cc(OC)c(NC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1Cl	ZINC000450898952	GE	On-Demand	Anodyne	HTR4	40	41
CCOC(=O)c1ccc(CN2CCC(F)(c3cccc(OC)c3)CC2)nc1	ZINC000450898990	FH	On-Demand	Anodyne	P2RY12	23	45
CC(C)(O)C(C)(C)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450898995	EF	On-Demand	Bother	MAPK14	46	39
CC(C)(O)C(C)(C)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450898995	EF	On-Demand	Bother	MAPK13	53	36
CCS(=O)(=O)c1ccc(CN(CCCO)Cc2ccccn2)cc1	ZINC000450899001	EE	On-Demand	Anodyne	RORC	15	46
COC[C@@]1(CO)CCN(c2nc3ccccc3[nH]2)C1	ZINC000450899015	CD	On-Demand	Anodyne	NPY5R	19	46
COC[C@]1(CO)CCN(c2nc3ccccc3[nH]2)C1	ZINC000450899019	CD	On-Demand	Anodyne	NPY5R	19	46
Nc1ncccc1CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450899021	DH	On-Demand	Anodyne	DRD4	17	54
Nc1ncccc1CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450899021	DH	On-Demand	Anodyne	DRD3	0	54
CC(C)NC(=O)c1ccc(N2CCC(OCCOC(C)C)CC2)c([N+](=O)[O-])c1	ZINC000450899035	GG	On-Demand	Bother	TAAR1	33	49
CC[C@@H](O)CC(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450899038	CD	On-Demand	Anodyne	P2RX7	16	42
CC[C@@H](O)CC(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450899038	CD	On-Demand	Anodyne	DPP4	15	41
CCc1cc(CCCN2CCC(F)(c3cccc(OC)c3)CC2)on1	ZINC000450899039	EI	On-Demand	Anodyne	SIGMAR1	18	41
CCc1cc(CCCN2CCC(F)(c3cccc(OC)c3)CC2)on1	ZINC000450899039	EI	On-Demand	Anodyne	EBP	38	41
CC[C@H](O)CC(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450899041	CD	On-Demand	Anodyne	P2RX7	16	42
CC[C@H](O)CC(=O)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000450899041	CD	On-Demand	Anodyne	DPP4	15	41
CC(C)OCCOC1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450899045	GI	On-Demand	Bother	SERPINE1	19	40
CC(C)OCCOC1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450899045	GI	On-Demand	Bother	LIPG	64	46
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(Br)cc1	ZINC000450899071	GI	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(Br)cc1	ZINC000450899086	GI	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(Br)cc1	ZINC000450899087	GI	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(Br)cc1	ZINC000450899088	GI	On-Demand	Anodyne	CYP2J2	49	34
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450899111	ED	On-Demand	Anodyne	SCD1	41	46
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450899111	ED	On-Demand	Anodyne	SCD	34	40
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450899112	ED	On-Demand	Anodyne	SCD1	41	46
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450899112	ED	On-Demand	Anodyne	SCD	34	40
CC(C)OCCOC1CCN(c2ccc(C#N)c([N+](=O)[O-])c2)CC1	ZINC000450899133	EF	On-Demand	Mild	SERPINE1	27	41
C=CCC[C@H](CO)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450899143	DE	On-Demand	Mild	TAAR1	15	45
C=CCC[C@@H](CO)Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450899145	DE	On-Demand	Mild	TAAR1	15	45
CC(C)OCCOC1CCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450899156	EI	On-Demand	Anodyne	LUCI_LUCLA	20	50
CC(C)OCCOC1CCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450899156	EI	On-Demand	Anodyne	SCD1	19	43
COC(=O)c1ccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1Cl	ZINC000450899158	FH	On-Demand	Anodyne	OPRK1	23	40
COC(=O)c1ccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1Cl	ZINC000450899159	FH	On-Demand	Anodyne	OPRK1	23	40
COC(=O)c1ccc(CN2CCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1Cl	ZINC000450899160	FH	On-Demand	Anodyne	OPRK1	23	40
COC(=O)c1ccc(CN2CCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1Cl	ZINC000450899161	FH	On-Demand	Anodyne	OPRK1	23	40
CCn1cnc2c(N3CCC(Cc4cccc(F)c4F)CC3)ncnc21	ZINC000450899162	FH	On-Demand	Anodyne	SCN5A	42	39
CC[C@H](CC(C)C)C(=O)N[C@H](CC(F)(F)F)C(=O)OC	ZINC000450899163	CF	On-Demand	Anodyne	NPR	30	51
CC[C@@H](CC(C)C)C(=O)N[C@@H](CC(F)(F)F)C(=O)OC	ZINC000450899164	CF	On-Demand	Anodyne	NPR	30	51
CC[C@@H](CC(C)C)C(=O)N[C@H](CC(F)(F)F)C(=O)OC	ZINC000450899165	CF	On-Demand	Anodyne	NPR	30	51
CC[C@H](CC(C)C)C(=O)N[C@@H](CC(F)(F)F)C(=O)OC	ZINC000450899166	CF	On-Demand	Anodyne	NPR	30	51
CCS(=O)(=O)c1ccc(COc2ccc(OC)cc2Br)cc1	ZINC000450899167	GH	On-Demand	Anodyne	CA7	19	46
CCS(=O)(=O)c1ccc(COc2ccc(OC)cc2Br)cc1	ZINC000450899167	GH	On-Demand	Anodyne	ACR	15	42
CCS(=O)(=O)c1ccc(COc2ccc(OC)cc2Br)cc1	ZINC000450899167	GH	On-Demand	Anodyne	KLK_PIG	24	43
C[C@H](CN1CCC(F)(c2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450899169	EG	On-Demand	Anodyne	CCR1	43	36
C[C@@H](CN1CCC(F)(c2ccc(Cl)cc2)CC1)S(C)(=O)=O	ZINC000450899175	EG	On-Demand	Anodyne	CCR1	43	36
COc1ccc2c(c1)c(=O)ncn2CC[C@@H](C)O	ZINC000450899192	BD	On-Demand	Anodyne	MTNR1A	26	40
COc1ccc2c(c1)c(=O)ncn2CC[C@H](C)O	ZINC000450899193	BD	On-Demand	Anodyne	MTNR1A	26	40
CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450899194	FD	On-Demand	Anodyne	TRPV1	76	36
CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450899194	FD	On-Demand	Anodyne	CCR2	22	40
CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450899194	FD	On-Demand	Anodyne	SFRP1	46	32
CS(=O)(=O)N[C@H]1CCCC[C@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450899195	FD	On-Demand	Anodyne	TRPV1	76	36
CS(=O)(=O)N[C@H]1CCCC[C@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450899195	FD	On-Demand	Anodyne	CCR2	22	40
CS(=O)(=O)N[C@H]1CCCC[C@H]1NC(=O)c1cccc(C(F)(F)F)n1	ZINC000450899195	FD	On-Demand	Anodyne	SFRP1	46	32
C[C@@H](O)CCN1CCC[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]21	ZINC000450899200	DD	On-Demand	Anodyne	SLC6A1	52	33
C[C@H](O)CCN1CCC[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]21	ZINC000450899201	DD	On-Demand	Anodyne	SLC6A1	52	33
C[C@H](NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1)c1ccc(F)cc1	ZINC000450899220	ED	On-Demand	Anodyne	CCR3	66	35
C[C@@H](NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1)c1ccc(F)cc1	ZINC000450899221	ED	On-Demand	Anodyne	CCR3	66	35
C[C@H](NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1)c1ccc(F)cc1	ZINC000450899222	ED	On-Demand	Anodyne	CCR3	66	35
C[C@@H](NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1)c1ccc(F)cc1	ZINC000450899223	ED	On-Demand	Anodyne	CCR3	66	35
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@@H](O)C1CCC1	ZINC000450899224	ED	On-Demand	Anodyne	CDK4	23	43
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)[C@H](O)C1CCC1	ZINC000450899225	ED	On-Demand	Anodyne	CDK4	23	43
O=S(=O)(c1ccc(NCc2nc(-c3ccccn3)n[nH]2)nc1)N1CCCCC1	ZINC000450899236	GE	On-Demand	Anodyne	NAMPT	32	40
c1ccc(-c2n[nH]c(CNc3ccnc(N4CCCCC4)n3)n2)nc1	ZINC000450899240	ED	On-Demand	Anodyne	METAP1	18	41
CCCOc1cccc(Cn2cnn(C(C)(C)C)c2=O)c1	ZINC000450899245	CF	On-Demand	Anodyne	UPP1	45	39
Oc1nnc([C@@H]2CCCN(Cc3nc(-c4cccc(Cl)c4)no3)C2)o1	ZINC000450899246	FF	On-Demand	Anodyne	GRM5	30	53
Oc1nnc([C@H]2CCCN(Cc3nc(-c4cccc(Cl)c4)no3)C2)o1	ZINC000450899247	FF	On-Demand	Anodyne	GRM5	30	53
C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1csnn1	ZINC000450899258	DI	On-Demand	Mild	AR	32	61
C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1csnn1	ZINC000450899262	DI	On-Demand	Mild	AR	32	61
CN(CCCO)c1cccc2cccnc12	ZINC000450899264	BE	On-Demand	Anodyne	CCR1	0	40
CN(CCCO)c1cccc2cccnc12	ZINC000450899264	BE	On-Demand	Anodyne	METAP2	0	43
CC(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450899272	CG	On-Demand	Bother	TAAR1	17	44
CC(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450899272	CG	On-Demand	Bother	AKR1C3	16	45
CCOC(=O)c1cnn(Cc2c(C)cccc2Cl)c1C#N	ZINC000450899312	DF	On-Demand	Mild	NPBWR1	30	42
CC(C)(O)C(C)(C)CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450899314	FE	On-Demand	Anodyne	LRRK2	35	43
CCO[C@@H]1COC[C@H]1Nc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000450899353	GG	On-Demand	Anodyne	NPBWR1	43	38
CCOCc1nc(C)c(C(=O)Nc2c(C)cc(Cl)c3ccccc23)s1	ZINC000450899361	FK	On-Demand	Anodyne	LCK	21	43
CC(C)(O)C(C)(C)CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450899364	FE	On-Demand	Bother	BCL2	24	40
C[C@@H](Sc1nnc(C2CCC2)n1C)C(=O)Nc1nccs1	ZINC000450899367	DF	On-Demand	Anodyne	MAP1	75	38
C[C@H](Sc1nnc(C2CCC2)n1C)C(=O)Nc1nccs1	ZINC000450899368	DF	On-Demand	Anodyne	MAP1	75	38
CCCc1cc(NCC(C)(C)C(C)(C)O)n2ncnc2n1	ZINC000450899380	CE	On-Demand	Anodyne	DHOD	0	46
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cc(C)no1	ZINC000450899383	GE	On-Demand	Anodyne	ITGA4	48	34
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cc(C)no1	ZINC000450899384	GE	On-Demand	Anodyne	ITGA4	48	34
CCC[C@H](O)CN1C[C@@H](C(=O)OC)[C@H](c2ccccc2)C1	ZINC000450899396	CE	On-Demand	Anodyne	SLC6A1	108	50
CCC[C@H](O)CN1C[C@@H](C(=O)OC)[C@H](c2ccccc2)C1	ZINC000450899396	CE	On-Demand	Anodyne	HSD17B2	44	36
Fc1cccc(F)c1CC1CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450899402	EG	On-Demand	Anodyne	AKT2	24	52
Fc1cccc(F)c1CC1CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450899402	EG	On-Demand	Anodyne	SIRT3	50	32
Fc1cccc(F)c1CC1CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450899402	EG	On-Demand	Anodyne	SIRT2	45	32
Fc1cccc(F)c1CC1CCN(c2ncnc3[nH]cnc23)CC1	ZINC000450899402	EG	On-Demand	Anodyne	SIRT1	50	32
C=CCOCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450899405	CD	On-Demand	Mild	GSG2	40	35
CC[C@H]1CN(Cc2ccc(F)c(CN3CCCO[C@H](CC)C3)c2)CCCO1	ZINC000450899418	GH	On-Demand	Anodyne	DRD4	16	53
CC[C@@H]1CN(Cc2ccc(F)c(CN3CCCO[C@H](CC)C3)c2)CCCO1	ZINC000450899419	GH	On-Demand	Anodyne	DRD4	16	53
CC[C@H]1CN(Cc2cc(CN3CCCO[C@H](CC)C3)ccc2F)CCCO1	ZINC000450899420	GH	On-Demand	Anodyne	DRD4	16	53
CC[C@H]1CN(Cc2ccc(F)c(CN3CCCO[C@@H](CC)C3)c2)CCCO1	ZINC000450899421	GH	On-Demand	Anodyne	DRD4	16	53
CS(=O)(=O)N1CC[C@H](CSCCCCc2ccccc2)C1	ZINC000450899428	EG	On-Demand	Anodyne	SIGMAR1	17	41
CS(=O)(=O)N1CC[C@@H](CSCCCCc2ccccc2)C1	ZINC000450899429	EG	On-Demand	Anodyne	SIGMAR1	17	41
CNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nn1	ZINC000450899433	EF	On-Demand	Anodyne	SCD1	57	50
Fc1ccc(F)c(CC2CCN(c3ncccn3)CC2)c1	ZINC000450899438	CG	On-Demand	Anodyne	DRD4	21	46
Fc1ccc(F)c(CC2CCN(c3ncccn3)CC2)c1	ZINC000450899438	CG	On-Demand	Anodyne	DPP4	15	65
COC(=O)[C@@H](NC(=O)C1=C(c2ccccc2)CCC1)[C@@H](C)O	ZINC000450899447	DD	On-Demand	Anodyne	CHRM5	37	40
COC(=O)[C@H](NC(=O)C1=C(c2ccccc2)CCC1)[C@@H](C)O	ZINC000450899448	DD	On-Demand	Anodyne	CHRM5	37	40
COC(=O)[C@@H](NC(=O)C1=C(c2ccccc2)CCC1)[C@H](C)O	ZINC000450899449	DD	On-Demand	Anodyne	CHRM5	37	40
COC(=O)[C@H](NC(=O)C1=C(c2ccccc2)CCC1)[C@H](C)O	ZINC000450899450	DD	On-Demand	Anodyne	CHRM5	37	40
COC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nn1	ZINC000450899453	EG	On-Demand	Anodyne	SCD1	56	48
COC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nn1	ZINC000450899453	EG	On-Demand	Anodyne	SCD	37	44
CN1CCc2ncnc(N3CCC(Cc4cc(F)ccc4F)CC3)c2C1	ZINC000450899468	FG	On-Demand	Anodyne	DPP4	22	40
Fc1ccc(F)c(CC2CCN(c3nccnc3C(F)F)CC2)c1	ZINC000450899480	EI	On-Demand	Anodyne	DPP4	15	47
c1ccc(CCCCSCn2cccn2)cc1	ZINC000450899486	BH	On-Demand	Anodyne	FAAH	28	42
c1ccc(CCCCSCn2cccn2)cc1	ZINC000450899486	BH	On-Demand	Anodyne	CES1	41	34
CC(C)NC(=O)c1ccc(N2CCC[C@@]3(CCSC3)C2)c([N+](=O)[O-])c1	ZINC000450899491	FG	On-Demand	Bother	TAAR1	19	46
CC(C)NC(=O)c1ccc(N2CCC[C@]3(CCSC3)C2)c([N+](=O)[O-])c1	ZINC000450899492	FG	On-Demand	Bother	TAAR1	19	46
CCOC(=O)C1(COC)CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450899504	EE	On-Demand	Anodyne	SLC12A5	55	36
COC(=O)c1ccc(CN2CC[C@](C)(C(N)=O)C2)cc1Cl	ZINC000450899517	DD	On-Demand	Anodyne	NPFFR1	47	38
COC(=O)c1ccc(CN2CC[C@@](C)(C(N)=O)C2)cc1Cl	ZINC000450899518	DD	On-Demand	Anodyne	NPFFR1	47	38
CCOC(=O)c1ccc(CN2Cc3ccc(C)cc3C2)nc1	ZINC000450899529	CG	On-Demand	Anodyne	P2RY12	27	40
CCOC(=O)c1ccc(CN2Cc3ccc(C)cc3C2)nc1	ZINC000450899529	CG	On-Demand	Anodyne	DPP9	15	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H]2C(=O)NC[C@H]21	ZINC000450899543	CD	On-Demand	Anodyne	GALR1	42	37
C[C@@H](c1ccccc1)[C@H](O)CN1CCC[C@H]2C(=O)NC[C@H]21	ZINC000450899545	CD	On-Demand	Anodyne	GALR1	42	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]2C(=O)NC[C@H]21	ZINC000450899547	CD	On-Demand	Anodyne	GALR1	42	37
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC[C@H]2C(=O)NC[C@H]21	ZINC000450899549	CD	On-Demand	Anodyne	GALR1	42	37
COC(=O)[C@@H]1CN(C[C@H]2CCCCN2C(C)C)C[C@H]1c1ccccc1	ZINC000450899554	EG	On-Demand	Anodyne	SLC6A1	97	50
COC(=O)[C@@H]1CN(C[C@H]2CCCCN2C(C)C)C[C@H]1c1ccccc1	ZINC000450899554	EG	On-Demand	Anodyne	SLC6A3	42	42
COC(=O)[C@@H]1CN(C[C@H]2CCCCN2C(C)C)C[C@H]1c1ccccc1	ZINC000450899554	EG	On-Demand	Anodyne	CCR5	48	38
COC(=O)[C@@H]1CN(C[C@@H]2CCCCN2C(C)C)C[C@H]1c1ccccc1	ZINC000450899555	EG	On-Demand	Anodyne	SLC6A1	97	50
COC(=O)[C@@H]1CN(C[C@@H]2CCCCN2C(C)C)C[C@H]1c1ccccc1	ZINC000450899555	EG	On-Demand	Anodyne	SLC6A3	42	42
COC(=O)[C@@H]1CN(C[C@@H]2CCCCN2C(C)C)C[C@H]1c1ccccc1	ZINC000450899555	EG	On-Demand	Anodyne	CCR5	48	38
CC[C@@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899559	CF	On-Demand	Anodyne	MME	45	35
CC[C@@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899559	CF	On-Demand	Anodyne	CTSB	22	42
CC[C@@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899559	CF	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899559	CF	On-Demand	Anodyne	CAPNS1	44	31
CC[C@@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899559	CF	On-Demand	Anodyne	ACE2	53	39
CC[C@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899561	CF	On-Demand	Anodyne	MME	45	35
CC[C@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899561	CF	On-Demand	Anodyne	CTSB	22	42
CC[C@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899561	CF	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899561	CF	On-Demand	Anodyne	CAPNS1	44	31
CC[C@H](C)N(CC(=O)OC)C[C@@H](Cc1ccccc1)OC	ZINC000450899561	CF	On-Demand	Anodyne	ACE2	53	39
CC[C@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899562	CF	On-Demand	Anodyne	MME	45	35
CC[C@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899562	CF	On-Demand	Anodyne	CTSB	22	42
CC[C@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899562	CF	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899562	CF	On-Demand	Anodyne	CAPNS1	44	31
CC[C@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899562	CF	On-Demand	Anodyne	ACE2	53	39
CC[C@@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899563	CF	On-Demand	Anodyne	MME	45	35
CC[C@@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899563	CF	On-Demand	Anodyne	CTSB	22	42
CC[C@@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899563	CF	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899563	CF	On-Demand	Anodyne	CAPNS1	44	31
CC[C@@H](C)N(CC(=O)OC)C[C@H](Cc1ccccc1)OC	ZINC000450899563	CF	On-Demand	Anodyne	ACE2	53	39
CC(C)OCCOC1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1	ZINC000450899573	GG	On-Demand	Anodyne	SCD1	35	40
CC(C)OCCOC1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1	ZINC000450899573	GG	On-Demand	Anodyne	SCD	37	40
CC(C)OCCOC1CCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1	ZINC000450899573	GG	On-Demand	Anodyne	PDS	47	34
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	DRD2	15	40
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	DRD4	45	34
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	HRH2	27	41
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	OPRD1	16	41
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	OPRK1	16	43
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	CHRM3	19	45
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	SIGMAR1	38	48
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	FAAH	18	40
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	MCHR1	21	47
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	MCHR2	44	32
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	CACNA1G	23	41
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	CCR8	40	43
COc1cccc(C2(F)CCN(Cc3cccc(C(C)=O)c3)CC2)c1	ZINC000450899575	EI	On-Demand	Anodyne	NPFFR1	24	42
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCN(C)Cc2ccccc2)C1	ZINC000450899576	EG	On-Demand	Anodyne	SIGMAR1	19	40
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCN(C)Cc2ccccc2)C1	ZINC000450899577	EG	On-Demand	Anodyne	SIGMAR1	19	40
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCN(C)Cc2ccccc2)C1	ZINC000450899578	EG	On-Demand	Anodyne	SIGMAR1	19	40
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCN(C)Cc2ccccc2)C1	ZINC000450899579	EG	On-Demand	Anodyne	SIGMAR1	19	40
COC(=O)[C@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450899593	FF	On-Demand	Anodyne	TIMP3	67	36
COC(=O)[C@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450899593	FF	On-Demand	Anodyne	SLC12A5	46	34
COC(=O)[C@@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450899596	FF	On-Demand	Anodyne	TIMP3	67	36
COC(=O)[C@@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450899596	FF	On-Demand	Anodyne	SLC12A5	46	34
COC[C@@]1(C(=O)NC[C@@H]2C[C@H](F)CN2c2ccnc(N(C)C)n2)CCOC1	ZINC000450899629	GC	On-Demand	Anodyne	NOS2	48	33
COC[C@]1(C(=O)NC[C@@H]2C[C@H](F)CN2c2ccnc(N(C)C)n2)CCOC1	ZINC000450899632	GC	On-Demand	Anodyne	NOS2	48	33
O=C(NCc1ccc(C(F)F)cc1)c1ccc(N2CCC2)nc1	ZINC000450899652	DG	On-Demand	Anodyne	HPGDS	23	44
O=C(NCc1ccc(C(F)F)cc1)c1ccc(N2CCC2)nc1	ZINC000450899652	DG	On-Demand	Anodyne	NAMPT	28	46
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450899656	ED	On-Demand	Anodyne	PROTEASE	24	46
COC(=O)C1(CN(C)C2CCN(c3ccccc3)CC2)CC1	ZINC000450899657	DF	On-Demand	Anodyne	SLC12A5	42	33
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450899661	ED	On-Demand	Anodyne	PROTEASE	24	46
COc1cccc(C2(F)CCN(C[C@](C)(O)C(C)=O)CC2)c1	ZINC000450899670	DE	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C2(F)CCN(C[C@@](C)(O)C(C)=O)CC2)c1	ZINC000450899671	DE	On-Demand	Anodyne	DRD4	41	31
COC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nn1	ZINC000450899678	EG	On-Demand	Anodyne	SCD1	53	51
COC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nn1	ZINC000450899678	EG	On-Demand	Anodyne	SCD	35	42
CO[C@@H]1COCC[C@@H]1CC(=O)NC[C@@H]1C[C@H](F)CN1c1ccnc(N(C)C)n1	ZINC000450899693	GD	On-Demand	Anodyne	NOS2	41	33
CC(C)(O)C(C)(C)CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450899698	EE	On-Demand	Anodyne	TGM2	29	44
CC(C)(O)C(C)(C)CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450899698	EE	On-Demand	Anodyne	GCK	58	32
C=CCOc1ccc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cc(C)no2)cc1	ZINC000450899756	GF	On-Demand	Mild	ITGA4	48	33
Oc1nnc([C@@H]2CCCN(Cc3ccc(I)cc3)C2)o1	ZINC000450899761	GF	On-Demand	Anodyne	VACHT_TETCF	0	41
Oc1nnc([C@H]2CCCN(Cc3ccc(I)cc3)C2)o1	ZINC000450899762	GF	On-Demand	Anodyne	VACHT_TETCF	0	41
CC(C)(O)C(C)(C)CNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000450899772	DH	On-Demand	Mild	MAP3K8	111	38
CCOC(=O)c1cnn(Cc2ccc(Cl)c(OC)c2)c1C#N	ZINC000450899783	DF	On-Demand	Mild	PDE5A	25	48
CCOC(=O)c1cnn(Cc2ccc(Cl)c(OC)c2)c1C#N	ZINC000450899783	DF	On-Demand	Mild	NPBWR1	43	41
COc1ccccc1CCNC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450899795	FD	On-Demand	Anodyne	MBTPS1	60	40
COc1ccccc1CCNC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450899796	FD	On-Demand	Anodyne	MBTPS1	60	40
O=C1c2ccccc2C(=O)N1CCN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450899798	ED	On-Demand	Anodyne	SLC6A1	56	33
O=C1c2ccccc2C(=O)N1CCN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450899799	ED	On-Demand	Anodyne	SLC6A1	56	33
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3ccc(Br)cc3)C2)o1	ZINC000450899822	GE	On-Demand	Anodyne	HSP90AB1	22	40
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3ccc(Br)cc3)C2)o1	ZINC000450899823	GE	On-Demand	Anodyne	HSP90AB1	22	40
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3ccc(Br)cc3)C2)o1	ZINC000450899824	GE	On-Demand	Anodyne	HSP90AB1	22	40
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3ccc(Br)cc3)C2)o1	ZINC000450899825	GE	On-Demand	Anodyne	HSP90AB1	22	40
CCSc1cccnc1C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450899838	FG	On-Demand	Anodyne	C3AR1	43	35
CCSc1cccnc1C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450899840	FG	On-Demand	Anodyne	C3AR1	43	35
C[C@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450899846	GG	On-Demand	Anodyne	CCR2	41	39
C[C@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450899848	GG	On-Demand	Anodyne	CCR2	41	39
C[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450899849	GG	On-Demand	Anodyne	CCR2	41	39
C[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450899850	GG	On-Demand	Anodyne	CCR2	41	39
Fc1ccc(F)c(CC2CCN(c3cc(N4CCOCC4)ncn3)CC2)c1	ZINC000450899853	FG	On-Demand	Anodyne	STAT6	18	40
NC(=O)c1csc(N2CCC(Cc3cc(F)ccc3F)CC2)n1	ZINC000450899858	EF	On-Demand	Anodyne	DPP4	23	40
CC(=O)CCCCCSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450899871	DJ	On-Demand	Mild	AR	62	67
CCCc1nc(C)c(CSc2ccc(C#N)c(C(F)(F)F)c2)o1	ZINC000450899893	EK	On-Demand	Mild	AR	32	56
NC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nn1	ZINC000450899911	EE	On-Demand	Anodyne	SCD1	51	48
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450899922	FD	On-Demand	Anodyne	AMY2	43	29
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450899922	FD	On-Demand	Anodyne	MMP2	18	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450899924	FD	On-Demand	Anodyne	AMY2	43	29
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450899924	FD	On-Demand	Anodyne	MMP2	18	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450899926	FD	On-Demand	Anodyne	AMY2	43	29
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450899926	FD	On-Demand	Anodyne	MMP2	18	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450899927	FD	On-Demand	Anodyne	AMY2	43	29
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450899927	FD	On-Demand	Anodyne	MMP2	18	40
COC(=O)[C@@H]1CN(C[C@H]2COCCO2)C[C@H]1c1ccccc1	ZINC000450899935	DD	On-Demand	Anodyne	SLC6A1	60	46
COC(=O)[C@@H]1CN(C[C@@H]2COCCO2)C[C@H]1c1ccccc1	ZINC000450899937	DD	On-Demand	Anodyne	SLC6A1	60	46
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450899946	FD	On-Demand	Anodyne	SSTR3	21	41
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450899948	FD	On-Demand	Anodyne	SSTR3	21	41
COC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450899949	EG	On-Demand	Anodyne	SCD1	67	50
COC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450899949	EG	On-Demand	Anodyne	SCD	50	39
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450899950	FD	On-Demand	Anodyne	SSTR3	21	41
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450899952	FD	On-Demand	Anodyne	SSTR3	21	41
Cc1ccn2ncc(C(=O)NC[C@@H]3C[C@H](F)CN3Cc3noc(C)n3)c2c1	ZINC000450899975	FD	On-Demand	Anodyne	EPHB3	27	40
CO[C@H]1COCC[C@@H]1CC(=O)NC[C@@H]1C[C@H](F)CN1c1ccnc(N(C)C)n1	ZINC000450899994	GD	On-Demand	Anodyne	NOS2	41	33
CO[C@H]1COCC[C@H]1CC(=O)NC[C@@H]1C[C@H](F)CN1c1ccnc(N(C)C)n1	ZINC000450899995	GD	On-Demand	Anodyne	NOS2	41	33
CO[C@@H]1COCC[C@H]1CC(=O)NC[C@@H]1C[C@H](F)CN1c1ccnc(N(C)C)n1	ZINC000450899996	GD	On-Demand	Anodyne	NOS2	41	33
CC(C)OCCOC1CCN(c2ccc(C#N)cn2)CC1	ZINC000450900016	CE	On-Demand	Mild	SMO	0	42
Cc1nccc(N2CCC(OCCOC(C)C)CC2)n1	ZINC000450900022	CE	On-Demand	Anodyne	SORD	78	39
COC[C@@]1(CO)CCN(c2ccnc(N3CCCCC3)n2)C1	ZINC000450900033	DD	On-Demand	Anodyne	SORD	51	40
COC[C@]1(CO)CCN(c2ccnc(N3CCCCC3)n2)C1	ZINC000450900034	DD	On-Demand	Anodyne	SORD	51	40
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450900038	FC	On-Demand	Mild	TGM2	53	43
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450900038	FC	On-Demand	Mild	F13A1	47	33
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450900038	FC	On-Demand	Mild	GCKR	50	31
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450900039	FC	On-Demand	Mild	TGM2	53	43
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450900039	FC	On-Demand	Mild	F13A1	47	33
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450900039	FC	On-Demand	Mild	GCKR	50	31
COc1cnccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450900068	EG	On-Demand	Anodyne	HTR1A	41	41
COc1cnccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450900068	EG	On-Demand	Anodyne	ADRA1D	38	41
COc1cnccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450900068	EG	On-Demand	Anodyne	ADRA1A	30	42
COc1cnccc1N1CCN(C[C@@H]2CCCCC2(F)F)CC1	ZINC000450900068	EG	On-Demand	Anodyne	ADRA1B	24	42
COc1cnccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450900069	EG	On-Demand	Anodyne	HTR1A	41	41
COc1cnccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450900069	EG	On-Demand	Anodyne	ADRA1D	38	41
COc1cnccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450900069	EG	On-Demand	Anodyne	ADRA1A	30	42
COc1cnccc1N1CCN(C[C@H]2CCCCC2(F)F)CC1	ZINC000450900069	EG	On-Demand	Anodyne	ADRA1B	24	42
COC[C@]1(CO)CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450900070	DD	On-Demand	Anodyne	SORD	59	42
COC[C@@]1(CO)CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450900071	DD	On-Demand	Anodyne	SORD	59	42
CN(CCSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C)Cc1ccccc1	ZINC000450900115	GG	On-Demand	Bother	F2RL3	48	35
CN(CCSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C)Cc1ccccc1	ZINC000450900115	GG	On-Demand	Bother	IDO1	40	42
CCc1cc(CCCN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)on1	ZINC000450900135	EG	On-Demand	Anodyne	SLC6A1	43	49
CCc1cc(CCCN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)on1	ZINC000450900135	EG	On-Demand	Anodyne	INHA	45	33
COc1cnccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450900141	DF	On-Demand	Anodyne	ADRA1D	33	41
COc1cnccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450900141	DF	On-Demand	Anodyne	ADRA1A	27	41
COc1cnccc1N1CCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450900141	DF	On-Demand	Anodyne	ADRA1B	26	41
COc1cnccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450900142	DF	On-Demand	Anodyne	ADRA1D	33	41
COc1cnccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450900142	DF	On-Demand	Anodyne	ADRA1A	27	41
COc1cnccc1N1CCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450900142	DF	On-Demand	Anodyne	ADRA1B	26	41
O=C(CS(=O)(=O)C1CC1)Nc1ccccc1NCc1ccc(Cl)cc1	ZINC000450900144	GG	On-Demand	Anodyne	KCNQ2	18	41
CC(C)OCCOC1CCN(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450900153	EF	On-Demand	Anodyne	SLC6A9	24	44
CC(C)OCCOC1CCN(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450900153	EF	On-Demand	Anodyne	GPR119	27	43
COC[C@@]1(CO)CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450900159	FF	On-Demand	Bother	TAAR1	16	42
COC[C@]1(CO)CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450900161	FF	On-Demand	Bother	TAAR1	16	42
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450900174	EG	On-Demand	Anodyne	DRD2	31	44
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450900174	EG	On-Demand	Anodyne	DRD4	0	45
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450900174	EG	On-Demand	Anodyne	SLC18A3	0	48
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450900174	EG	On-Demand	Anodyne	CYP2J2	47	33
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450900177	EG	On-Demand	Anodyne	DRD2	31	44
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450900177	EG	On-Demand	Anodyne	DRD4	0	45
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450900177	EG	On-Demand	Anodyne	SLC18A3	0	48
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450900177	EG	On-Demand	Anodyne	CYP2J2	47	33
CCc1cc2c(N3CCC(OCCOC(C)C)CC3)ncnc2s1	ZINC000450900183	EH	On-Demand	Anodyne	PDE3B	56	32
CN(CCN1CCC[C@H](c2nnc(O)o2)C1)Cc1ccc(F)cc1	ZINC000450900208	EE	On-Demand	Anodyne	CCR3	42	35
CN(CCN1CCC[C@@H](c2nnc(O)o2)C1)Cc1ccc(F)cc1	ZINC000450900209	EE	On-Demand	Anodyne	CCR3	42	35
O=C1N[C@]2(CCOC2)C(=O)N1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450900213	FG	On-Demand	Anodyne	DNAE	41	33
O=C1N[C@@]2(CCOC2)C(=O)N1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450900214	FG	On-Demand	Anodyne	DNAE	41	33
CC(C)OCCOC1CCN(c2ccc(S(C)(=O)=O)cc2F)CC1	ZINC000450900230	FF	On-Demand	Anodyne	SLC6A9	40	48
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450900231	GD	On-Demand	Bother	KCNMA1	20	43
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450900232	GD	On-Demand	Bother	KCNMA1	20	43
Cc1ccc(F)c(COc2nc(C)cc(C)c2[N+](=O)[O-])c1	ZINC000450900236	CH	On-Demand	Bother	MGMT	16	41
CC(C)(O)C(C)(C)CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F	ZINC000450900243	FG	On-Demand	Anodyne	SFRP1	63	34
CSc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450900245	FH	On-Demand	Anodyne	PDE3A	51	39
CSc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450900245	FH	On-Demand	Anodyne	PDE3B	76	39
CSc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450900245	FH	On-Demand	Anodyne	SIRT3	42	32
CSc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450900245	FH	On-Demand	Anodyne	SIRT1	40	31
CSc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450900245	FH	On-Demand	Anodyne	HTT	0	41
COC(=O)CNC(=O)c1ccc(NCC(C)(C)C(C)(C)O)c([N+](=O)[O-])c1	ZINC000450900252	FD	On-Demand	Bother	TAAR1	21	47
COC(=O)c1cccc(COc2nc(C)cc(C)c2[N+](=O)[O-])c1Cl	ZINC000450900255	FH	On-Demand	Bother	CACNA1D	50	32
CC(C)(O)C(C)(C)CNc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450900268	EE	On-Demand	Anodyne	PIM1	15	60
CC(C)(O)C(C)(C)CNc1ccc2nnc(-c3ccccc3)n2n1	ZINC000450900268	EE	On-Demand	Anodyne	LRRK2	32	44
CC(=O)CCCCCn1cc(-c2cccc([N+](=O)[O-])c2)cn1	ZINC000450900274	DH	On-Demand	Bother	F2RL3	44	33
CCCCOc1cccc(CNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450900277	GE	On-Demand	Anodyne	HRH2	52	45
CCCCOc1cccc(CNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450900277	GE	On-Demand	Anodyne	AVPR1B	49	37
CCCCOc1cccc(CNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450900278	GE	On-Demand	Anodyne	HRH2	52	45
CCCCOc1cccc(CNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450900278	GE	On-Demand	Anodyne	AVPR1B	49	37
Fc1cccc(CC2CCN(c3ccnc(N4CCOCC4)n3)CC2)c1F	ZINC000450900294	FG	On-Demand	Anodyne	PIK3CA	17	42
Fc1cccc(CC2CCN(c3ccnc(N4CCOCC4)n3)CC2)c1F	ZINC000450900294	FG	On-Demand	Anodyne	SMG1	43	34
c1ccc2[nH]c(N3CCC[C@]4(CCSC4)C3)nc2c1	ZINC000450900320	CG	On-Demand	Anodyne	NPY5R	0	43
c1ccc2[nH]c(N3CCC[C@@]4(CCSC4)C3)nc2c1	ZINC000450900321	CG	On-Demand	Anodyne	NPY5R	0	43
Cc1ccncc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450900340	FG	On-Demand	Anodyne	DRD4	28	41
C[C@@H](O)CCn1nnc(-c2ccc(Cl)cc2Cl)n1	ZINC000450900341	CE	On-Demand	Anodyne	CNR1	22	42
C[C@H](O)CCn1nnc(-c2ccc(Cl)cc2Cl)n1	ZINC000450900342	CE	On-Demand	Anodyne	CNR1	22	42
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC(Cc2c(F)cccc2F)CC1	ZINC000450900345	GF	On-Demand	Bother	SIRT3	52	33
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC(Cc2c(F)cccc2F)CC1	ZINC000450900345	GF	On-Demand	Bother	SIRT2	44	32
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC(Cc2c(F)cccc2F)CC1	ZINC000450900345	GF	On-Demand	Bother	SIRT1	50	32
CCCc1nc(C)c(COc2ccc3cc(C(=O)OC)oc3c2)o1	ZINC000450900372	EI	On-Demand	Anodyne	MAOA	45	33
CCCc1nc(C)c(COc2ccc3cc(C(=O)OC)oc3c2)o1	ZINC000450900372	EI	On-Demand	Anodyne	MAOB	36	45
COc1ccc2ncc(=O)n(Cc3c(C)noc3C)c2c1	ZINC000450900377	CE	On-Demand	Anodyne	BRD4	18	44
COC(=O)c1csc(COc2ccc(S(=O)(=O)NCCC(C)C)cc2)n1	ZINC000450900398	GF	On-Demand	Anodyne	ADAMTS4	53	37
CN(CCNS(C)(=O)=O)c1cccc2cccnc12	ZINC000450900413	CD	On-Demand	Anodyne	C0L093_TOBAC	41	32
CN(CCNS(=O)(=O)c1cnn(C)c1)c1cccc2cccnc12	ZINC000450900426	ED	On-Demand	Anodyne	C0L093_TOBAC	42	33
COC(=O)C1(Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CCCC1	ZINC000450900427	EG	On-Demand	Bother	CACNA1D	78	34
COc1cc(C)c(Br)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450900437	GH	On-Demand	Anodyne	HDAC1	24	41
COc1cc(C)c(Br)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450900437	GH	On-Demand	Anodyne	FASN	25	49
COc1cc(C)c(Br)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450900437	GH	On-Demand	Anodyne	HPGDS	16	42
C[C@H](NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1)c1ccc(Cl)c(Cl)c1	ZINC000450900453	GG	On-Demand	Anodyne	TACR2	40	34
C[C@H](NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1)c1ccc(Cl)c(Cl)c1	ZINC000450900454	GG	On-Demand	Anodyne	TACR2	40	34
C[C@@H](NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1)c1ccc(Cl)c(Cl)c1	ZINC000450900455	GG	On-Demand	Anodyne	TACR2	40	34
C[C@@H](NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1)c1ccc(Cl)c(Cl)c1	ZINC000450900456	GG	On-Demand	Anodyne	TACR2	40	34
COC1(CSc2ccc(C#N)c(C(F)(F)F)c2)CCC1	ZINC000450900467	DI	On-Demand	Mild	AR	54	59
COc1cc(C)c(Br)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450900475	GH	On-Demand	Anodyne	PPARA	15	41
COc1cc(C)c(Br)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450900475	GH	On-Demand	Anodyne	MME	58	38
COc1cc(C)c(Br)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450900475	GH	On-Demand	Anodyne	ANPEP	51	34
COc1cc(C)c(Br)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450900475	GH	On-Demand	Anodyne	AMP1_PLAFQ	44	34
COc1cc(C)c(Br)cc1NC(=O)[C@H](Cc1ccccc1)OC	ZINC000450900475	GH	On-Demand	Anodyne	GLMU	0	40
COc1cc(C)c(Br)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450900476	GH	On-Demand	Anodyne	PPARA	15	41
COc1cc(C)c(Br)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450900476	GH	On-Demand	Anodyne	MME	58	38
COc1cc(C)c(Br)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450900476	GH	On-Demand	Anodyne	ANPEP	51	34
COc1cc(C)c(Br)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450900476	GH	On-Demand	Anodyne	AMP1_PLAFQ	44	34
COc1cc(C)c(Br)cc1NC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450900476	GH	On-Demand	Anodyne	GLMU	0	40
CCc1cc(NC2(Cc3ccccc3)CCOCC2)n2ncnc2n1	ZINC000450900490	EF	On-Demand	Anodyne	DHOD	0	49
COC[C@@]1(CO)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450900532	FD	On-Demand	Anodyne	PIK3CA	15	45
COC[C@]1(CO)CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450900533	FD	On-Demand	Anodyne	PIK3CA	15	45
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450900539	FF	On-Demand	Anodyne	CA2	67	42
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450900539	FF	On-Demand	Anodyne	CA1	56	40
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450900539	FF	On-Demand	Anodyne	CA7	45	36
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450900539	FF	On-Demand	Anodyne	CA4	53	40
CC(C)(O)C(C)(C)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450900539	FF	On-Demand	Anodyne	SFRP1	51	34
COC[C@@]1(CO)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450900542	DD	On-Demand	Anodyne	PDE3A	42	35
COC[C@@]1(CO)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450900542	DD	On-Demand	Anodyne	PDGFRB	40	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450900544	FG	On-Demand	Anodyne	DRD4	27	45
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450900544	FG	On-Demand	Anodyne	DRD3	0	45
COC[C@]1(CO)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450900545	DD	On-Demand	Anodyne	PDE3A	42	35
COC[C@]1(CO)CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450900545	DD	On-Demand	Anodyne	PDGFRB	40	41
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450900546	DF	On-Demand	Anodyne	DRD2	31	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450900546	DF	On-Demand	Anodyne	DRD4	0	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450900546	DF	On-Demand	Anodyne	SLC18A3	0	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450900546	DF	On-Demand	Anodyne	CYP2J2	49	37
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450900547	FG	On-Demand	Anodyne	DRD4	27	45
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450900547	FG	On-Demand	Anodyne	DRD3	0	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450900548	DF	On-Demand	Anodyne	DRD2	31	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450900548	DF	On-Demand	Anodyne	DRD4	0	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450900548	DF	On-Demand	Anodyne	SLC18A3	0	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450900548	DF	On-Demand	Anodyne	CYP2J2	49	37
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450900549	FG	On-Demand	Anodyne	DRD4	27	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450900549	FG	On-Demand	Anodyne	DRD3	0	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450900550	DF	On-Demand	Anodyne	DRD2	31	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450900550	DF	On-Demand	Anodyne	DRD4	0	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450900550	DF	On-Demand	Anodyne	SLC18A3	0	47
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450900550	DF	On-Demand	Anodyne	CYP2J2	49	37
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450900551	FG	On-Demand	Anodyne	DRD4	27	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450900551	FG	On-Demand	Anodyne	DRD3	0	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450900552	DF	On-Demand	Anodyne	DRD2	31	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450900552	DF	On-Demand	Anodyne	DRD4	0	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450900552	DF	On-Demand	Anodyne	SLC18A3	0	47
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450900552	DF	On-Demand	Anodyne	CYP2J2	49	37
Cc1cccc(Cl)c1Cn1cnc2c(c1=O)CCN(Cc1ccccc1)C2	ZINC000450900569	GH	On-Demand	Anodyne	NOX1	41	35
COc1cc(CSC2CCOCC2)ccc1Cl	ZINC000450900582	CH	On-Demand	Anodyne	QRFPR	41	36
COC[C@@]1(CO)CCN(c2ccnc3ccccc23)C1	ZINC000450900584	CE	On-Demand	Anodyne	HNMT	43	31
COC[C@]1(CO)CCN(c2ccnc3ccccc23)C1	ZINC000450900586	CE	On-Demand	Anodyne	HNMT	43	31
COc1cccc(OCCC(=O)N[C@@H](CCO)C2CCOCC2)c1	ZINC000450900600	ED	On-Demand	Anodyne	MTNR1A	26	41
CC(C)(O)C(C)(C)CNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450900601	DD	On-Demand	Anodyne	PRCP	0	48
CC(C)(O)C(C)(C)CNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450900602	DD	On-Demand	Anodyne	PRCP	0	48
COc1cccc(OCCC(=O)N[C@H](CCO)C2CCOCC2)c1	ZINC000450900604	ED	On-Demand	Anodyne	MTNR1A	26	41
CC(C)c1ncsc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450900613	EH	On-Demand	Anodyne	DRD4	22	52
CC(C)c1ncsc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450900613	EH	On-Demand	Anodyne	DRD3	0	52
CC(C)c1ncsc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450900615	EH	On-Demand	Anodyne	DRD4	22	52
CC(C)c1ncsc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450900615	EH	On-Demand	Anodyne	DRD3	0	52
CC(C)c1ncsc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450900617	EH	On-Demand	Anodyne	DRD4	22	52
CC(C)c1ncsc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000450900617	EH	On-Demand	Anodyne	DRD3	0	52
CC(C)c1ncsc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450900619	EH	On-Demand	Anodyne	DRD4	22	52
CC(C)c1ncsc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000450900619	EH	On-Demand	Anodyne	DRD3	0	52
CCOC(=O)C1(COC)CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450900627	GI	On-Demand	Anodyne	NPFFR1	41	34
CCOC(=O)C1(COC)CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450900632	GI	On-Demand	Anodyne	NPFFR1	41	34
CCS(=O)(=O)c1ccc(CN(CC2CCC2)CC2CC2)cc1	ZINC000450900646	DG	On-Demand	Anodyne	RORC	15	46
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	HTR1A	88	46
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	DRD2	77	43
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	DRD1	30	41
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	DRD4	69	43
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	ADRA1D	57	43
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	HTR2A	36	41
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	ADRA1A	53	43
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	ADRA1B	40	37
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	DRD3	90	43
COC(=O)c1cccc(CN2CCN(c3ccncc3OC)CC2)c1Cl	ZINC000450900658	GF	On-Demand	Anodyne	HTR7	56	46
CCOC(=O)c1ccc(CN2CCC(C)=C(C)C2)nc1	ZINC000450900660	CF	On-Demand	Anodyne	NOD2	33	43
COC[C@@]1(CO)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450900665	FD	On-Demand	Anodyne	DRD3	15	40
COC[C@@]1(CO)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450900665	FD	On-Demand	Anodyne	ACACA	0	42
COC[C@@]1(CO)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450900665	FD	On-Demand	Anodyne	ACACB	24	46
COC[C@@]1(CO)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450900665	FD	On-Demand	Anodyne	TNKS	56	33
COC[C@]1(CO)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450900666	FD	On-Demand	Anodyne	DRD3	15	40
COC[C@]1(CO)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450900666	FD	On-Demand	Anodyne	ACACA	0	42
COC[C@]1(CO)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450900666	FD	On-Demand	Anodyne	ACACB	24	46
COC[C@]1(CO)CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450900666	FD	On-Demand	Anodyne	TNKS	56	33
CCCCNc1cc(N2CC[C@](CO)(COC)C2)nc(N)n1	ZINC000450900668	DC	On-Demand	Anodyne	HRH4	19	44
CCCCNc1cc(N2CC[C@@](CO)(COC)C2)nc(N)n1	ZINC000450900669	DC	On-Demand	Anodyne	HRH4	19	44
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1c(F)cccc1F	ZINC000450900687	ED	On-Demand	Anodyne	DRD4	0	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1c(F)cccc1F	ZINC000450900688	ED	On-Demand	Anodyne	DRD4	0	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900691	GG	On-Demand	Anodyne	DRD4	0	43
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900691	GG	On-Demand	Anodyne	LTA4H	30	43
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900691	GG	On-Demand	Anodyne	ACOX1	31	43
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900691	GG	On-Demand	Anodyne	COLA	85	39
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900691	GG	On-Demand	Anodyne	CPT1A	80	39
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900691	GG	On-Demand	Anodyne	MCHR1	21	41
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900691	GG	On-Demand	Anodyne	F13A1	15	41
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900692	GG	On-Demand	Anodyne	DRD4	0	43
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900692	GG	On-Demand	Anodyne	LTA4H	30	43
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900692	GG	On-Demand	Anodyne	ACOX1	31	43
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900692	GG	On-Demand	Anodyne	COLA	85	39
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900692	GG	On-Demand	Anodyne	CPT1A	80	39
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900692	GG	On-Demand	Anodyne	MCHR1	21	41
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)Nc1cccc(Oc2ccccc2)c1	ZINC000450900692	GG	On-Demand	Anodyne	F13A1	15	41
CC(C)(O)C(C)(C)CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450900693	ED	On-Demand	Anodyne	NPY2R	64	38
CC(C)OCCOC1CCN(c2ccc3nnc(-c4ccccc4F)n3n2)CC1	ZINC000450900696	GG	On-Demand	Anodyne	SCD1	29	41
CC(C)OCCOC1CCN(c2ncnc3c(F)cccc23)CC1	ZINC000450900697	EG	On-Demand	Anodyne	PDE3A	41	35
CC(C)OCCOC1CCN(c2ncnc3c(F)cccc23)CC1	ZINC000450900697	EG	On-Demand	Anodyne	PDE3B	60	35
CC(C)OCCOC1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450900700	EH	On-Demand	Anodyne	PDE3A	52	42
CC(C)OCCOC1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450900700	EH	On-Demand	Anodyne	AKT2	28	42
CC(C)OCCOC1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450900700	EH	On-Demand	Anodyne	PDE3B	77	42
CC(C)OCCOC1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450900700	EH	On-Demand	Anodyne	AKT1	22	41
CC(C)OCCOC1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450900700	EH	On-Demand	Anodyne	HTT	0	44
CC[C@@H]1CC[C@H](C)N(c2nn3c(C)nnc3c3ccccc23)C1	ZINC000450900711	DH	On-Demand	Anodyne	BRD9	42	36
COc1ccc(CNC(=O)CCSc2cccc(O)c2)c(OC)c1	ZINC000450900716	EG	On-Demand	Anodyne	MTNR1A	61	42
COc1ccc(CNC(=O)CCSc2cccc(O)c2)c(OC)c1	ZINC000450900716	EG	On-Demand	Anodyne	MTNR1B	50	38
CCO[C@@H]1COC[C@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450900730	DF	On-Demand	Bother	AADAC	0	45
CC(C)OCCOC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000450900736	EH	On-Demand	Anodyne	LIPG	51	39
CC(C)OCCOC1CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450900737	EE	On-Demand	Anodyne	P2RY12	30	43
CC(C)OCCOC1CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450900737	EE	On-Demand	Anodyne	CXCR3	31	44
CC(C)OCCOC1CCN(c2cc(Cl)ccc2C#N)CC1	ZINC000450900738	DH	On-Demand	Mild	NOS2	20	42
CC(C)OCCOC1CCN(c2cc(Cl)ccc2C#N)CC1	ZINC000450900738	DH	On-Demand	Mild	NOS3	17	42
Cc1cncc(-c2nc(CN(C)CCCN3CCCC3)no2)c1	ZINC000450900740	DE	On-Demand	Anodyne	F2R	24	40
CC[C@@H]1CC[C@H](C)N(c2ncnc3[nH]ccc23)C1	ZINC000450900745	BF	On-Demand	Anodyne	AKT2	42	45
CC[C@@H]1CC[C@H](C)N(c2ncnc3[nH]ccc23)C1	ZINC000450900745	BF	On-Demand	Anodyne	JAK3	25	62
CC[C@@H]1CC[C@H](C)N(c2ncnc3[nH]ccc23)C1	ZINC000450900745	BF	On-Demand	Anodyne	JAK1	89	36
CC[C@@H]1CC[C@H](C)N(c2ncnc3[nH]ccc23)C1	ZINC000450900745	BF	On-Demand	Anodyne	AKT1	33	44
Nc1ncccc1CN1CCC(F)(c2ccccc2C(F)(F)F)CC1	ZINC000450900793	FI	On-Demand	Anodyne	EGLN1	0	43
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450900794	GI	On-Demand	Anodyne	LIPG	42	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450900797	GI	On-Demand	Anodyne	LIPG	42	35
NC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450900798	EF	On-Demand	Anodyne	DPP4	26	44
CCNC(=O)c1ccc(N2CCC(OCCOC(C)C)CC2)nn1	ZINC000450900821	ED	On-Demand	Anodyne	SCD1	67	48
CCNC(=O)c1ccc(N2CCC(OCCOC(C)C)CC2)nn1	ZINC000450900821	ED	On-Demand	Anodyne	SCD	43	41
Cc1nnc2c3ccccc3c(N3CCC[C@@]4(CCSC4)C3)nn12	ZINC000450900830	EG	On-Demand	Anodyne	CREBBP	44	35
Cc1nnc2c3ccccc3c(N3CCC[C@@]4(CCSC4)C3)nn12	ZINC000450900830	EG	On-Demand	Anodyne	BRD9	56	35
Cc1nnc2c3ccccc3c(N3CCC[C@]4(CCSC4)C3)nn12	ZINC000450900831	EG	On-Demand	Anodyne	CREBBP	44	35
Cc1nnc2c3ccccc3c(N3CCC[C@]4(CCSC4)C3)nn12	ZINC000450900831	EG	On-Demand	Anodyne	BRD9	56	35
COC(=O)CNC(=O)c1ccc(N2CCC[C@@]3(CCSC3)C2)c([N+](=O)[O-])c1	ZINC000450900832	GE	On-Demand	Bother	TAAR1	22	45
COC(=O)CNC(=O)c1ccc(N2CCC[C@]3(CCSC3)C2)c([N+](=O)[O-])c1	ZINC000450900833	GE	On-Demand	Bother	TAAR1	22	45
Nc1c(N2CCC(Cc3cc(F)ccc3F)CC2)ncnc1-n1cccn1	ZINC000450900836	FF	On-Demand	Anodyne	DPP4	16	47
Fc1ccc(F)c(CC2CCN(c3ncnc4[nH]cnc34)CC2)c1	ZINC000450900845	EG	On-Demand	Anodyne	AKT2	38	52
Fc1ccc(F)c(CC2CCN(c3ncnc4[nH]cnc34)CC2)c1	ZINC000450900845	EG	On-Demand	Anodyne	SIRT3	42	31
CCC(=O)CCCN1CCCc2c([nH]c3c(F)cccc23)C1	ZINC000450900849	DH	On-Demand	Anodyne	FABP4	42	35
CCC(=O)CCCN1CCCc2c([nH]c3c(F)cccc23)C1	ZINC000450900849	DH	On-Demand	Anodyne	HTR5A	29	45
COc1ccc2ncc(=O)n(Cc3ccc([C@@H](C)C(F)(F)F)cc3)c2c1	ZINC000450900854	FI	On-Demand	Anodyne	CASR	17	40
COc1ccc2ncc(=O)n(Cc3ccc([C@@H](C)C(F)(F)F)cc3)c2c1	ZINC000450900854	FI	On-Demand	Anodyne	ALOX5AP	45	32
COc1ccc2ncc(=O)n(Cc3ccc([C@H](C)C(F)(F)F)cc3)c2c1	ZINC000450900855	FI	On-Demand	Anodyne	CASR	17	40
COc1ccc2ncc(=O)n(Cc3ccc([C@H](C)C(F)(F)F)cc3)c2c1	ZINC000450900855	FI	On-Demand	Anodyne	ALOX5AP	45	32
CS(=O)(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450900863	FG	On-Demand	Anodyne	DPP4	15	44
CS(=O)(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450900863	FG	On-Demand	Anodyne	GPR119	26	54
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(Cc3cccc(F)c3F)CC2)n1	ZINC000450900864	GH	On-Demand	Bother	PRKCQ	0	40
COc1ccc2ncc(=O)n(Cc3ccc(S(=O)(=O)C(C)C)cc3)c2c1	ZINC000450900865	FF	On-Demand	Anodyne	PROKR1	43	30
COC(=O)[C@@H]1CN(Cc2noc(-c3cncc(C)c3)n2)C[C@H]1c1ccccc1	ZINC000450900869	GF	On-Demand	Anodyne	SLC6A1	0	42
CSCCCN(C)Cc1ccc(C(C)=O)cc1	ZINC000450900874	CG	On-Demand	Anodyne	LTA4H	18	40
CCC[C@H](O)CN1CCN(c2cnccc2C)CC1	ZINC000450900909	CD	On-Demand	Anodyne	ABCB1	25	42
CCC[C@@H](O)CN1CCN(c2cnccc2C)CC1	ZINC000450900910	CD	On-Demand	Anodyne	ABCB1	25	42
CCS(=O)(=O)c1ccc(COc2cc(C(=O)OC)cc(F)c2C)cc1	ZINC000450900937	FG	On-Demand	Anodyne	RORC	58	35
COc1nccc(COc2ccc(S(=O)(=O)NCCC(C)C)cc2)n1	ZINC000450900944	FE	On-Demand	Anodyne	ADAMTS4	41	35
C[C@@]1(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)CC=CCC1	ZINC000450900955	EE	On-Demand	Anodyne	STAT6	49	33
C[C@]1(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)CC=CCC1	ZINC000450900956	EE	On-Demand	Anodyne	STAT6	49	33
CCCCOc1ccc(-c2nnc(CN3CCC[C@H](c4nnc(O)o4)C3)o2)cc1	ZINC000450900965	GG	On-Demand	Anodyne	HRH3	34	41
CCCCOc1ccc(-c2nnc(CN3CCC[C@@H](c4nnc(O)o4)C3)o2)cc1	ZINC000450900966	GG	On-Demand	Anodyne	HRH3	34	41
COc1cccc(COC[C@@H](O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450900982	FD	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cccc(COC[C@@H](O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450900983	FD	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cccc(COC[C@H](O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450900984	FD	On-Demand	Anodyne	VACHT_TETCF	0	44
COc1cccc(COC[C@H](O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450900985	FD	On-Demand	Anodyne	VACHT_TETCF	0	44
CC(=O)CCCCCOc1ccc(F)c(Br)c1	ZINC000450901017	DI	On-Demand	Anodyne	ALDH2	46	34
CC(=O)CCCCCOc1ccc(F)c(Br)c1	ZINC000450901017	DI	On-Demand	Anodyne	THRA	36	46
CC(=O)CCCCCOc1ccc(F)c(Br)c1	ZINC000450901017	DI	On-Demand	Anodyne	P2RY12	31	43
CC(=O)CCCCCOc1ccc(F)c(Br)c1	ZINC000450901017	DI	On-Demand	Anodyne	THRB	0	46
CC(=O)CCCCCOc1ccc(F)c(Br)c1	ZINC000450901017	DI	On-Demand	Anodyne	SHC	29	42
CC(=O)CCCCCOc1ccc(F)c(Br)c1	ZINC000450901017	DI	On-Demand	Anodyne	PLA2G4B	87	36
COCCOC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901024	EC	On-Demand	Anodyne	HTR1A	36	42
COCCOC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901024	EC	On-Demand	Anodyne	ADRA1D	39	48
COCCOC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901024	EC	On-Demand	Anodyne	ADRA1B	23	48
COCCOC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901024	EC	On-Demand	Anodyne	DRD3	40	42
COCCOC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901024	EC	On-Demand	Anodyne	ABCB1	50	39
COCCOC[C@@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901024	EC	On-Demand	Anodyne	HSP90AB1	46	56
COCCOC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901028	EC	On-Demand	Anodyne	HTR1A	36	42
COCCOC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901028	EC	On-Demand	Anodyne	ADRA1D	39	48
COCCOC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901028	EC	On-Demand	Anodyne	ADRA1B	23	48
COCCOC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901028	EC	On-Demand	Anodyne	DRD3	40	42
COCCOC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901028	EC	On-Demand	Anodyne	ABCB1	50	39
COCCOC[C@H](O)CN1CCN(c2ccncc2OC)CC1	ZINC000450901028	EC	On-Demand	Anodyne	HSP90AB1	46	56
COC[C@]1(CO)CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C1	ZINC000450901034	FE	On-Demand	Anodyne	CXCR3	21	45
COC[C@@]1(CO)CCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)C1	ZINC000450901035	FE	On-Demand	Anodyne	CXCR3	21	45
COC(=O)c1coc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450901039	ED	On-Demand	Anodyne	HTR1A	55	42
COC(=O)c1coc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450901039	ED	On-Demand	Anodyne	DRD2	45	39
COC(=O)c1coc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450901039	ED	On-Demand	Anodyne	ADRA1D	45	39
COC(=O)c1coc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450901039	ED	On-Demand	Anodyne	DRD3	43	39
COC(=O)c1coc(CN2CCN(c3ccncc3OC)CC2)n1	ZINC000450901039	ED	On-Demand	Anodyne	HTR7	42	37
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	HTR1A	88	45
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	DRD2	70	49
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	DRD1	25	45
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	DRD4	51	49
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	ADRA1D	52	43
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	HTR2A	31	42
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	ADRA1A	49	40
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	ADRA1B	40	43
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	DRD3	66	49
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	HTR7	46	44
COc1cnccc1N1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450901040	GF	On-Demand	Anodyne	SIGMAR1	22	45
COc1cc(CN2CC[C@](C)(C(N)=O)C2)ccc1Cl	ZINC000450901049	CE	On-Demand	Anodyne	TACR1	0	40
COc1cc(CN2CC[C@](C)(C(N)=O)C2)ccc1Cl	ZINC000450901049	CE	On-Demand	Anodyne	TACR2	24	40
COc1cc(CN2CC[C@](C)(C(N)=O)C2)ccc1Cl	ZINC000450901049	CE	On-Demand	Anodyne	NPFFR1	43	35
COc1cc(CN2CC[C@@](C)(C(N)=O)C2)ccc1Cl	ZINC000450901050	CE	On-Demand	Anodyne	TACR1	0	40
COc1cc(CN2CC[C@@](C)(C(N)=O)C2)ccc1Cl	ZINC000450901050	CE	On-Demand	Anodyne	TACR2	24	40
COc1cc(CN2CC[C@@](C)(C(N)=O)C2)ccc1Cl	ZINC000450901050	CE	On-Demand	Anodyne	NPFFR1	43	35
COc1ccc(CNC(=O)CCN2Cc3ccc(C)cc3C2)c(OC)c1	ZINC000450901057	FG	On-Demand	Anodyne	HTR7	34	43
COc1ccc(CNC(=O)CCN2Cc3ccc(C)cc3C2)c(OC)c1	ZINC000450901057	FG	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN2Cc3ccc(C)cc3C2)c(OC)c1	ZINC000450901057	FG	On-Demand	Anodyne	MTNR1B	41	39
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	HTR1A	86	51
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	DRD2	84	50
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	DRD1	30	44
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	DRD4	64	52
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	HRH2	25	42
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	ADRA1D	62	42
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	HTR2A	45	42
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	ADRA1A	50	41
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	ADRA1B	48	38
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	DRD3	67	49
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	HTR7	57	45
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	CCR8	39	40
COc1cnccc1N1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450901071	EF	On-Demand	Anodyne	ALPHA-1A	0	40
COc1cnccc1N1CCN(CCc2cscn2)CC1	ZINC000450901072	DD	On-Demand	Anodyne	DRD2	44	42
COc1cnccc1N1CCN(CCc2cscn2)CC1	ZINC000450901072	DD	On-Demand	Anodyne	DRD4	27	41
COc1cnccc1N1CCN(CCc2cscn2)CC1	ZINC000450901072	DD	On-Demand	Anodyne	DRD3	39	42
COc1cnccc1N1CCN(CCc2cscn2)CC1	ZINC000450901072	DD	On-Demand	Anodyne	HTR7	38	43
CN(Cc1cccc(S(C)(=O)=O)c1)C1CCN(c2ccccc2)CC1	ZINC000450901111	FG	On-Demand	Anodyne	HTR7	21	40
CN(Cc1cccc(S(C)(=O)=O)c1)C1CCN(c2ccccc2)CC1	ZINC000450901111	FG	On-Demand	Anodyne	HTR6	16	43
CN(Cc1cccc(S(C)(=O)=O)c1)C1CCN(c2ccccc2)CC1	ZINC000450901111	FG	On-Demand	Anodyne	RORC	21	43
CNC(=O)c1ccc(N2CCC(OCCOC(C)C)CC2)c([N+](=O)[O-])c1	ZINC000450901115	FE	On-Demand	Bother	TAAR1	25	49
CC(C)c1nccc(N2CCC[C@]3(CCSC3)C2)n1	ZINC000450901127	CG	On-Demand	Anodyne	SORD	43	34
CC(C)c1nccc(N2CCC[C@@]3(CCSC3)C2)n1	ZINC000450901128	CG	On-Demand	Anodyne	SORD	43	34
CCS(=O)(=O)CCCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450901135	EE	On-Demand	Anodyne	GSG2	44	39
CC(C)OCCOC1CCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450901144	EI	On-Demand	Anodyne	HRP1_PLAFA	90	37
CC(C)OCCOC1CCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450901144	EI	On-Demand	Anodyne	HNMT	52	35
C=CCN1CC[C@H](N(C)CCCC(=O)c2ccccc2)C1=O	ZINC000450901145	DE	On-Demand	Mild	CYP2J2	50	38
C=CCN1CC[C@@H](N(C)CCCC(=O)c2ccccc2)C1=O	ZINC000450901146	DE	On-Demand	Mild	CYP2J2	50	38
COc1cc(OC)nc(N2CCC(OCCOC(C)C)CC2)n1	ZINC000450901148	ED	On-Demand	Anodyne	EHMT2	59	34
CCS(=O)(=O)c1ccc(CN[C@@H](CO)c2cccc(Cl)c2F)cc1	ZINC000450901175	FG	On-Demand	Anodyne	RORC	40	34
CCS(=O)(=O)c1ccc(CN[C@H](CO)c2cccc(Cl)c2F)cc1	ZINC000450901176	FG	On-Demand	Anodyne	RORC	40	34
CC(C)OCCOC1CCN(c2nc3ccccc3n2C)CC1	ZINC000450901179	DF	On-Demand	Anodyne	HRH1	33	43
CC(C)OCCOC1CCN(c2nc3ccccc3n2C)CC1	ZINC000450901179	DF	On-Demand	Anodyne	PDE6D	61	38
CN(C)c1nccc(N2C[C@@H](F)C[C@H]2CNC(=O)Cc2ccc(O)c(F)c2)n1	ZINC000450901180	GD	On-Demand	Anodyne	NOS2	70	33
CC(C)OCCOC1CCN(c2cc(-n3cccn3)nc(N)n2)CC1	ZINC000450901201	ED	On-Demand	Anodyne	HRH4	40	38
COC(=O)[C@H](CC(F)(F)F)NC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450901208	FH	On-Demand	Anodyne	KCNJ11	49	35
COC(=O)[C@@H](CC(F)(F)F)NC(=O)C(C)(C)c1cccc2ccccc12	ZINC000450901209	FH	On-Demand	Anodyne	KCNJ11	49	35
COc1ccc(CNC(=O)CCn2cnc(=O)c3cc(OC)ccc32)c(OC)c1	ZINC000450901213	GE	On-Demand	Anodyne	PDGFRB	39	42
COc1ccc(CNC(=O)CCn2cnc(=O)c3cc(OC)ccc32)c(OC)c1	ZINC000450901213	GE	On-Demand	Anodyne	NQO2	21	41
COc1ccc(CNC(=O)CCn2cnc(=O)c3cc(OC)ccc32)c(OC)c1	ZINC000450901213	GE	On-Demand	Anodyne	MTNR1A	63	41
COc1ccc(CNC(=O)CCn2cnc(=O)c3cc(OC)ccc32)c(OC)c1	ZINC000450901213	GE	On-Demand	Anodyne	MTNR1B	46	41
COc1ccc(CNC(=O)CCn2cnc(=O)c3cc(OC)ccc32)c(OC)c1	ZINC000450901213	GE	On-Demand	Anodyne	CSF1R	15	42
CC(C)OCCOC1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450901214	GG	On-Demand	Anodyne	SCD1	95	57
CC(C)OCCOC1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450901214	GG	On-Demand	Anodyne	SCD	58	47
Cn1nccc1[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450901222	EH	On-Demand	Anodyne	DRD4	0	43
Cn1nccc1[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450901222	EH	On-Demand	Anodyne	HTR2A	23	47
Cn1nccc1[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450901222	EH	On-Demand	Anodyne	HTR3B	0	45
Cn1nccc1[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450901222	EH	On-Demand	Anodyne	CYP2J2	50	35
Cn1nccc1[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450901223	EH	On-Demand	Anodyne	DRD4	0	43
Cn1nccc1[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450901223	EH	On-Demand	Anodyne	HTR2A	23	47
Cn1nccc1[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450901223	EH	On-Demand	Anodyne	HTR3B	0	45
Cn1nccc1[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450901223	EH	On-Demand	Anodyne	CYP2J2	50	35
CC(=O)CCCCCSc1nc(O)c(C)c(-c2ccccc2)n1	ZINC000450901224	EI	On-Demand	Anodyne	TNKS	52	34
Oc1nnc([C@H]2CCCN(CCOc3c(Cl)cccc3Cl)C2)o1	ZINC000450901231	FG	On-Demand	Anodyne	SLC6A1	59	37
Oc1nnc([C@@H]2CCCN(CCOc3c(Cl)cccc3Cl)C2)o1	ZINC000450901233	FG	On-Demand	Anodyne	SLC6A1	59	37
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	HTR1A	103	51
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	DRD2	80	50
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	DRD1	40	42
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	DRD4	42	33
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	ADRA1D	68	49
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	HTR2C	24	41
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	ADRA1A	50	45
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	ADRA1B	43	41
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	DRD3	73	46
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	HTR7	90	49
CCC(=O)CCCN1CCN(c2ccncc2OC)CC1	ZINC000450901244	CD	On-Demand	Anodyne	AP2S1	0	40
COC[C@@]1(CO)CCN(c2cc(Cl)ccc2C#N)C1	ZINC000450901251	CE	On-Demand	Mild	TRPV4	44	35
COC[C@]1(CO)CCN(c2cc(Cl)ccc2C#N)C1	ZINC000450901252	CE	On-Demand	Mild	TRPV4	44	35
COC[C@@]1(CO)CCN(c2cnc3ccccc3n2)C1	ZINC000450901273	CD	On-Demand	Anodyne	SORD	24	40
COC[C@]1(CO)CCN(c2cnc3ccccc3n2)C1	ZINC000450901274	CD	On-Demand	Anodyne	SORD	24	40
Cn1cccc1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450901296	GG	On-Demand	Anodyne	PRCP	17	41
CC[C@H](O)CC(=O)N[C@H]1c2ccccc2CCC[C@H]1C	ZINC000450901313	CF	On-Demand	Anodyne	POL	0	42
CC[C@H](O)CC(=O)N[C@@H]1c2ccccc2CCC[C@H]1C	ZINC000450901315	CF	On-Demand	Anodyne	POL	0	42
CC[C@H](O)CC(=O)N[C@@H]1c2ccccc2CCC[C@@H]1C	ZINC000450901317	CF	On-Demand	Anodyne	POL	0	42
CN(C)C(=O)c1cnc(N2CCC(Cc3c(F)cccc3F)CC2)c(Cl)c1	ZINC000450901318	GI	On-Demand	Anodyne	CXCR3	34	41
CC[C@H](O)CC(=O)N[C@H]1c2ccccc2CCC[C@@H]1C	ZINC000450901320	CF	On-Demand	Anodyne	POL	0	42
CC[C@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901343	CE	On-Demand	Anodyne	ACHE	0	42
CC[C@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901343	CE	On-Demand	Anodyne	CTSB	49	38
CC[C@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901343	CE	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901343	CE	On-Demand	Anodyne	CAPN2	49	33
CC[C@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901343	CE	On-Demand	Anodyne	PTGES	0	41
CC[C@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901343	CE	On-Demand	Anodyne	PDS	41	35
CC[C@@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901346	CE	On-Demand	Anodyne	ACHE	0	42
CC[C@@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901346	CE	On-Demand	Anodyne	CTSB	49	38
CC[C@@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901346	CE	On-Demand	Anodyne	PAPA1_CARPA	41	32
CC[C@@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901346	CE	On-Demand	Anodyne	CAPN2	49	33
CC[C@@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901346	CE	On-Demand	Anodyne	PTGES	0	41
CC[C@@H](C)N(CCN(C)Cc1ccccc1)CC(=O)OC	ZINC000450901346	CE	On-Demand	Anodyne	PDS	41	35
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450901358	FE	On-Demand	Mild	BCL2L1	88	34
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450901358	FE	On-Demand	Mild	BCL2	72	33
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450901358	FE	On-Demand	Mild	BCL2L2	44	31
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450901361	FE	On-Demand	Mild	BCL2L1	88	34
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450901361	FE	On-Demand	Mild	BCL2	72	33
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000450901361	FE	On-Demand	Mild	BCL2L2	44	31
CCOC(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)nc1	ZINC000450901396	FF	On-Demand	Anodyne	SLC6A1	31	44
CCCN(Cc1ccc(C)cc1)C(=O)CN1CCC[C@H]1c1nc(=N)n(C)[nH]1	ZINC000450901397	FE	On-Demand	Anodyne	PLA2G7	48	34
CCCN(Cc1ccc(C)cc1)C(=O)CN1CCC[C@@H]1c1nc(=N)n(C)[nH]1	ZINC000450901398	FE	On-Demand	Anodyne	PLA2G7	48	34
OC[C@@H]1CCCN(c2cc(NCc3nc(-c4ccccn4)n[nH]3)ncn2)C1	ZINC000450901427	FD	On-Demand	Anodyne	GPR39	0	41
OC[C@H]1CCCN(c2cc(NCc3nc(-c4ccccn4)n[nH]3)ncn2)C1	ZINC000450901428	FD	On-Demand	Anodyne	GPR39	0	41
COC[C@@]1(CO)CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450901457	DE	On-Demand	Anodyne	GRM5	21	42
O=C(c1cccnc1N1CCC[C@@]2(CCSC2)C1)N1CCc2ccccc21	ZINC000450901458	GI	On-Demand	Anodyne	AVPR2	43	41
O=C(c1cccnc1N1CCC[C@@]2(CCSC2)C1)N1CCc2ccccc21	ZINC000450901458	GI	On-Demand	Anodyne	GPBAR1	16	43
COC[C@]1(CO)CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450901460	DE	On-Demand	Anodyne	GRM5	21	42
O=C(c1cccnc1N1CCC[C@]2(CCSC2)C1)N1CCc2ccccc21	ZINC000450901462	GI	On-Demand	Anodyne	AVPR2	43	41
O=C(c1cccnc1N1CCC[C@]2(CCSC2)C1)N1CCc2ccccc21	ZINC000450901462	GI	On-Demand	Anodyne	GPBAR1	16	43
CCOC(=O)C1(COC)CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450901465	EE	On-Demand	Anodyne	KCNA3	17	46
CCOC(=O)C1(COC)CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450901467	EE	On-Demand	Anodyne	KCNA3	17	46
CCOC(=O)C1(COC)CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450901468	EE	On-Demand	Anodyne	KCNA3	17	46
CCOC(=O)C1(COC)CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450901469	EE	On-Demand	Anodyne	KCNA3	17	46
COC(=O)c1coc(CN2CC[C@@H](c3ccccc3)C[C@@H]2C)n1	ZINC000450901477	DG	On-Demand	Anodyne	MGEA5	24	41
COC(=O)c1coc(CN2CC[C@H](c3ccccc3)C[C@H]2C)n1	ZINC000450901479	DG	On-Demand	Anodyne	MGEA5	24	41
COC(=O)c1coc(CN2CC[C@@H](c3ccccc3)C[C@H]2C)n1	ZINC000450901480	DG	On-Demand	Anodyne	MGEA5	24	41
COC(=O)c1coc(CN2CC[C@H](c3ccccc3)C[C@@H]2C)n1	ZINC000450901482	DG	On-Demand	Anodyne	MGEA5	24	41
Cc1cccc(Cl)c1Cn1cnn(C(C)(C)C)c1=O	ZINC000450901505	CF	On-Demand	Anodyne	NPBWR1	15	41
CS(=O)(=O)c1cccnc1N1CCC(Cc2cc(F)ccc2F)CC1	ZINC000450901531	FG	On-Demand	Anodyne	DPP4	15	44
COCCNC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nc1	ZINC000450901532	GG	On-Demand	Anodyne	DRD4	42	32
COCCNC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nc1	ZINC000450901532	GG	On-Demand	Anodyne	DRD3	23	41
COCCNC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nc1	ZINC000450901532	GG	On-Demand	Anodyne	SCD1	22	41
COCCNC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nc1	ZINC000450901532	GG	On-Demand	Anodyne	DGAT1	26	40
COCCNC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nc1	ZINC000450901532	GG	On-Demand	Anodyne	HPGDS	39	40
COCCOc1ccc(SCc2nc(-c3ccc(OC)nn3)no2)cc1	ZINC000450901533	FF	On-Demand	Anodyne	AXIN2	0	41
Cc1cccc2ncnc(N3CCC[C@]4(CCSC4)C3)c12	ZINC000450901537	CH	On-Demand	Anodyne	AKT1	15	40
Cc1cccc2ncnc(N3CCC[C@@]4(CCSC4)C3)c12	ZINC000450901538	CH	On-Demand	Anodyne	AKT1	15	40
C[C@@H](O)CCSCCCCc1ccccc1	ZINC000450901540	BH	On-Demand	Anodyne	SIGMAR1	18	40
C[C@H](O)CCSCCCCc1ccccc1	ZINC000450901541	BH	On-Demand	Anodyne	SIGMAR1	18	40
CCNC(=O)c1ccc(N2CCC[C@]3(CCSC3)C2)nc1	ZINC000450901546	DF	On-Demand	Anodyne	HDAC1	22	44
CCNC(=O)c1ccc(N2CCC[C@@]3(CCSC3)C2)nc1	ZINC000450901547	DF	On-Demand	Anodyne	HDAC1	22	44
COC(=O)[C@@H]1CN([C@@H](C)c2csnn2)C[C@H]1c1ccccc1	ZINC000450901548	DE	On-Demand	Anodyne	SLC6A3	22	40
COC(=O)[C@@H]1CN([C@H](C)c2csnn2)C[C@H]1c1ccccc1	ZINC000450901549	DE	On-Demand	Anodyne	SLC6A3	22	40
Cc1nc(N2CCC(Cc3c(F)cccc3F)CC2)ncc1[N+](=O)[O-]	ZINC000450901552	EG	On-Demand	Bother	PRKCQ	26	41
CCn1cnc2c(N3CCC(Cc4cc(F)ccc4F)CC3)ncnc21	ZINC000450901560	FH	On-Demand	Anodyne	ABCC1	50	33
CCn1cnc2c(N3CCC(Cc4cc(F)ccc4F)CC3)ncnc21	ZINC000450901560	FH	On-Demand	Anodyne	HTT	0	43
NC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nn1	ZINC000450901561	EE	On-Demand	Anodyne	SCD1	54	49
N=c1[nH]c(N2CCC(Cc3c(F)cccc3F)CC2)ncc1[N+](=O)[O-]	ZINC000450901562	EF	On-Demand	Bother	PRKCQ	28	43
CNC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nn1	ZINC000450901573	EF	On-Demand	Anodyne	SCD1	55	53
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450901576	EG	On-Demand	Anodyne	C3AR1	41	34
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450901577	EG	On-Demand	Anodyne	C3AR1	41	34
CCOC(=O)c1cccnc1N1CCC[C@]2(CCSC2)C1	ZINC000450901578	DF	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)c1cccnc1N1CCC[C@@]2(CCSC2)C1	ZINC000450901579	DF	On-Demand	Anodyne	P2RY12	40	35
COC[C@@]1(CO)CCN(c2cc(C)nc3ccccc23)C1	ZINC000450901584	CE	On-Demand	Anodyne	ADAM17	42	38
COC[C@]1(CO)CCN(c2cc(C)nc3ccccc23)C1	ZINC000450901586	CE	On-Demand	Anodyne	ADAM17	42	38
CC(C)(C(=O)N1CCc2c(F)cccc21)C1CCC1	ZINC000450901612	CH	On-Demand	Anodyne	AR	25	41
C=CCC[C@H](CO)Nc1ncnc2ccc(C)cc12	ZINC000450901630	CF	On-Demand	Mild	HTT	0	41
C=CCC[C@@H](CO)Nc1ncnc2ccc(C)cc12	ZINC000450901631	CF	On-Demand	Mild	HTT	0	41
COc1cnccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450901634	CC	On-Demand	Anodyne	HTR1A	60	44
COc1cnccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450901634	CC	On-Demand	Anodyne	DRD2	45	42
COc1cnccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450901634	CC	On-Demand	Anodyne	ADRA1D	51	43
COc1cnccc1N1CCN(C[C@](C)(O)C(C)=O)CC1	ZINC000450901634	CC	On-Demand	Anodyne	DRD3	43	39
COc1cnccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450901635	CC	On-Demand	Anodyne	HTR1A	60	44
COc1cnccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450901635	CC	On-Demand	Anodyne	DRD2	45	42
COc1cnccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450901635	CC	On-Demand	Anodyne	ADRA1D	51	43
COc1cnccc1N1CCN(C[C@@](C)(O)C(C)=O)CC1	ZINC000450901635	CC	On-Demand	Anodyne	DRD3	43	39
CCOC(=O)C1(COC)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450901675	EG	On-Demand	Anodyne	KCNA3	0	46
CCOC(=O)C1(COC)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450901675	EG	On-Demand	Anodyne	PA	26	40
COC(=O)[C@@H]1CN(Cc2cccc(C(C)=O)c2)C[C@H]1c1ccccc1	ZINC000450901684	EG	On-Demand	Anodyne	SLC6A1	75	54
COC(=O)[C@@H]1CN(Cc2cccc(C(C)=O)c2)C[C@H]1c1ccccc1	ZINC000450901684	EG	On-Demand	Anodyne	SLC6A3	33	42
COC(=O)C1(CN2CCCc3c([nH]c4c(F)cccc34)C2)CC1	ZINC000450901686	DG	On-Demand	Anodyne	FABP4	46	36
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901721	EH	On-Demand	Anodyne	SLC6A1	60	37
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901721	EH	On-Demand	Anodyne	HRH3	23	41
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901721	EH	On-Demand	Anodyne	PREP	26	43
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901721	EH	On-Demand	Anodyne	CYP2J2	58	40
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901722	EH	On-Demand	Anodyne	SLC6A1	60	37
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901722	EH	On-Demand	Anodyne	HRH3	23	41
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901722	EH	On-Demand	Anodyne	PREP	26	43
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901722	EH	On-Demand	Anodyne	CYP2J2	58	40
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901723	EH	On-Demand	Anodyne	SLC6A1	60	37
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901723	EH	On-Demand	Anodyne	HRH3	23	41
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901723	EH	On-Demand	Anodyne	PREP	26	43
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901723	EH	On-Demand	Anodyne	CYP2J2	58	40
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901724	EH	On-Demand	Anodyne	SLC6A1	60	37
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901724	EH	On-Demand	Anodyne	HRH3	23	41
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901724	EH	On-Demand	Anodyne	PREP	26	43
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccccc2)C1	ZINC000450901724	EH	On-Demand	Anodyne	CYP2J2	58	40
Oc1nnc([C@@H]2CCCN(CCCc3nc(-c4cccs4)no3)C2)o1	ZINC000450901756	FF	On-Demand	Anodyne	ETHR	38	43
Oc1nnc([C@H]2CCCN(CCCc3nc(-c4cccs4)no3)C2)o1	ZINC000450901757	FF	On-Demand	Anodyne	ETHR	38	43
c1ccc(-c2n[nH]c(CNc3ncnc4c3ncn4C3CC3)n2)nc1	ZINC000450901758	ED	On-Demand	Anodyne	ADORA3	45	41
Oc1nnc([C@@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901764	FF	On-Demand	Anodyne	ESR1	70	35
Oc1nnc([C@@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901764	FF	On-Demand	Anodyne	LTA4H	47	39
Oc1nnc([C@@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901764	FF	On-Demand	Anodyne	HRH3	30	42
Oc1nnc([C@@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901764	FF	On-Demand	Anodyne	PSMB2	50	40
Oc1nnc([C@@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901764	FF	On-Demand	Anodyne	PSMB1	44	40
Oc1nnc([C@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901765	FF	On-Demand	Anodyne	ESR1	70	35
Oc1nnc([C@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901765	FF	On-Demand	Anodyne	LTA4H	47	39
Oc1nnc([C@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901765	FF	On-Demand	Anodyne	HRH3	30	42
Oc1nnc([C@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901765	FF	On-Demand	Anodyne	PSMB2	50	40
Oc1nnc([C@H]2CCCN(CCOc3ccc(Br)cc3)C2)o1	ZINC000450901765	FF	On-Demand	Anodyne	PSMB1	44	40
Cc1cccc(OC[C@@H](O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450901767	ED	On-Demand	Anodyne	ACOX1	86	36
Cc1cccc(OC[C@@H](O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450901767	ED	On-Demand	Anodyne	CHRNA10	41	33
Cc1cccc(OC[C@@H](O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450901768	ED	On-Demand	Anodyne	ACOX1	86	36
Cc1cccc(OC[C@@H](O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450901768	ED	On-Demand	Anodyne	CHRNA10	41	33
Cc1cccc(OC[C@H](O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450901769	ED	On-Demand	Anodyne	ACOX1	86	36
Cc1cccc(OC[C@H](O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450901769	ED	On-Demand	Anodyne	CHRNA10	41	33
Cc1cccc(OC[C@H](O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450901770	ED	On-Demand	Anodyne	ACOX1	86	36
Cc1cccc(OC[C@H](O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450901770	ED	On-Demand	Anodyne	CHRNA10	41	33
COCCOC[C@@H](O)CN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450901788	ED	On-Demand	Anodyne	DRD4	40	30
COCCOC[C@@H](O)CN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450901788	ED	On-Demand	Anodyne	ABCB1	41	39
COCCOC[C@@H](O)CN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450901788	ED	On-Demand	Anodyne	HSP90AB1	40	49
COCCOC[C@H](O)CN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450901789	ED	On-Demand	Anodyne	DRD4	40	30
COCCOC[C@H](O)CN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450901789	ED	On-Demand	Anodyne	ABCB1	41	39
COCCOC[C@H](O)CN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450901789	ED	On-Demand	Anodyne	HSP90AB1	40	49
CC(C)OCCOC1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1	ZINC000450901790	GH	On-Demand	Anodyne	P2RY12	49	39
CC(C)OCCOC1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1	ZINC000450901790	GH	On-Demand	Anodyne	ACACA	0	48
CC(C)OCCOC1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1	ZINC000450901790	GH	On-Demand	Anodyne	ACACB	25	48
CC(C)OCCOC1CCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)CC1	ZINC000450901790	GH	On-Demand	Anodyne	TNKS	56	31
Cc1nc2ccccn2c(=O)c1CCN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450901798	FD	On-Demand	Anodyne	ADRA2A	33	51
Cc1nc2ccccn2c(=O)c1CCN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450901798	FD	On-Demand	Anodyne	ADRA2B	42	51
Cc1nc2ccccn2c(=O)c1CCN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450901798	FD	On-Demand	Anodyne	ADRA2C	22	51
Cc1nc2ccccn2c(=O)c1CCN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450901801	FD	On-Demand	Anodyne	ADRA2A	33	51
Cc1nc2ccccn2c(=O)c1CCN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450901801	FD	On-Demand	Anodyne	ADRA2B	42	51
Cc1nc2ccccn2c(=O)c1CCN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450901801	FD	On-Demand	Anodyne	ADRA2C	22	51
COc1nc(N2CCCCCC2)nc(N2CCC(OCCOC(C)C)CC2)n1	ZINC000450901804	GF	On-Demand	Anodyne	EHMT2	59	35
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450901815	GF	On-Demand	Anodyne	OPRK1	49	44
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450901815	GF	On-Demand	Anodyne	SIGMAR1	15	43
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450901817	GF	On-Demand	Anodyne	OPRK1	49	44
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450901817	GF	On-Demand	Anodyne	SIGMAR1	15	43
N#Cc1ccc(SCc2nnc(C3CC3)s2)cc1C(F)(F)F	ZINC000450901860	EJ	On-Demand	Mild	AR	47	58
CCCOc1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450901861	EF	On-Demand	Anodyne	ESR1	79	38
CCCOc1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450901861	EF	On-Demand	Anodyne	ESR2	25	40
CCCOc1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450901861	EF	On-Demand	Anodyne	LTA4H	49	39
CCCOc1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450901861	EF	On-Demand	Anodyne	HRH3	50	45
CCCOc1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450901861	EF	On-Demand	Anodyne	PSMB2	53	40
CCCOc1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450901861	EF	On-Demand	Anodyne	PSMB1	46	40
CCCOc1ccc(OCCN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450901861	EF	On-Demand	Anodyne	NORA	0	41
CCCOc1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450901862	EF	On-Demand	Anodyne	ESR1	79	38
CCCOc1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450901862	EF	On-Demand	Anodyne	ESR2	25	40
CCCOc1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450901862	EF	On-Demand	Anodyne	LTA4H	49	39
CCCOc1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450901862	EF	On-Demand	Anodyne	HRH3	50	45
CCCOc1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450901862	EF	On-Demand	Anodyne	PSMB2	53	40
CCCOc1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450901862	EF	On-Demand	Anodyne	PSMB1	46	40
CCCOc1ccc(OCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450901862	EF	On-Demand	Anodyne	NORA	0	41
Cn1c(N2CCC(Cc3cccc(F)c3F)CC2)c(C#N)c(=O)n(C)c1=O	ZINC000450901874	FD	On-Demand	Mild	GRM2	15	42
COc1cc(OC)c2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450901883	GG	On-Demand	Anodyne	PDE3A	54	42
COc1cc(OC)c2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450901883	GG	On-Demand	Anodyne	PDE3B	79	42
COc1ccc2c(=O)n(Cc3cn(C)nc3C)cnc2c1	ZINC000450901896	CD	On-Demand	Anodyne	PDGFRB	15	48
COC(=O)[C@@H]1CN(CC2(C(=O)OC)CC2)C[C@H]1c1ccccc1	ZINC000450901912	DD	On-Demand	Anodyne	SLC6A1	93	49
COc1ccc2ncc(=O)n(CC(=O)c3c(C)noc3C)c2c1	ZINC000450901918	DD	On-Demand	Anodyne	BRD4	17	40
Brc1cncc(N2CCC[C@@]3(CCSC3)C2)c1	ZINC000450901927	DH	On-Demand	Anodyne	CHRNA4	24	52
Brc1cncc(N2CCC[C@]3(CCSC3)C2)c1	ZINC000450901928	DH	On-Demand	Anodyne	CHRNA4	24	52
CS(=O)(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)cc1	ZINC000450901929	FH	On-Demand	Anodyne	GPR119	29	45
CC1CCN(C(=O)c2ccc(N3CCC[C@]4(CCSC4)C3)nc2)CC1	ZINC000450901949	FH	On-Demand	Anodyne	FASN	29	40
CC1CCN(C(=O)c2ccc(N3CCC[C@@]4(CCSC4)C3)nc2)CC1	ZINC000450901950	FH	On-Demand	Anodyne	FASN	29	40
COC(=O)c1cc2ccc(OCCC(C)(F)F)cc2o1	ZINC000450901951	CH	On-Demand	Anodyne	SLC16A3	0	41
COC(=O)c1coc(CN2CCC(c3cccc(Br)c3)CC2)n1	ZINC000450901961	GH	On-Demand	Anodyne	MCHR1	32	41
COC(=O)c1coc(CN2CCC(c3cccc(Br)c3)CC2)n1	ZINC000450901961	GH	On-Demand	Anodyne	MGEA5	27	41
Fc1cccc(F)c1CC1CCN(c2cc(N3CCOCC3)ncn2)CC1	ZINC000450901964	FG	On-Demand	Anodyne	SMG1	41	33
N#Cc1cccn(CCCCc2ccc(Cl)c(Cl)c2)c1=O	ZINC000450901967	DI	On-Demand	Mild	DNAE	71	34
COC[C@@]1(CO)CCN(c2cc(C)nc3ccc(F)cc23)C1	ZINC000450901984	DF	On-Demand	Anodyne	DHODH	41	35
COC[C@]1(CO)CCN(c2cc(C)nc3ccc(F)cc23)C1	ZINC000450901985	DF	On-Demand	Anodyne	DHODH	41	35
CSCCCN(C)CCN(C)Cc1ccccc1	ZINC000450902001	CF	On-Demand	Anodyne	ACHE	0	48
COC(=O)[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450902002	FH	On-Demand	Anodyne	DRD4	0	44
COC(=O)[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@H]1c1ccccc1	ZINC000450902002	FH	On-Demand	Anodyne	CYP2J2	56	40
COC[C@@]1(CO)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450902014	EC	On-Demand	Anodyne	ADRA1D	15	46
COC[C@@]1(CO)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450902014	EC	On-Demand	Anodyne	ADRA1B	43	51
COC[C@@]1(CO)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450902014	EC	On-Demand	Anodyne	EHMT2	58	35
COC[C@]1(CO)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450902021	EC	On-Demand	Anodyne	ADRA1D	15	46
COC[C@]1(CO)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450902021	EC	On-Demand	Anodyne	ADRA1B	43	51
COC[C@]1(CO)CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1	ZINC000450902021	EC	On-Demand	Anodyne	EHMT2	58	35
CC[C@H]1CN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CCCO1	ZINC000450902037	DI	On-Demand	Anodyne	DRD4	15	48
CC[C@H]1CN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CCCO1	ZINC000450902039	DI	On-Demand	Anodyne	DRD4	15	48
CC[C@@H]1CN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CCCO1	ZINC000450902041	DI	On-Demand	Anodyne	DRD4	15	48
CC[C@@H]1CN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CCCO1	ZINC000450902043	DI	On-Demand	Anodyne	DRD4	15	48
COCCOc1ccc(SCc2cccc(C(C)=O)c2)cc1	ZINC000450902050	DI	On-Demand	Anodyne	PLA2G4B	51	38
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	DRD2	36	52
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	DRD1	24	55
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	DRD4	23	57
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	HTR2A	19	56
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	HTR2C	16	54
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	ADRA1B	15	48
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	DRD5	15	41
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	ERG2	24	52
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	SLC18A3	22	52
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	CYP2J2	51	37
CCOC(=O)C1(COC)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450902079	FG	On-Demand	Anodyne	AP2S1	0	52
COC[C@@]1(CO)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450902098	GE	On-Demand	Anodyne	PDE3B	58	32
COC[C@]1(CO)CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450902099	GE	On-Demand	Anodyne	PDE3B	58	32
CCOC(=O)C1(COC)CCN(CC/C=C\c2ccccc2)CC1	ZINC000450902104	EG	On-Demand	Anodyne	KCNA3	0	44
CCOC(=O)C1(COC)CCN(CC/C=C/c2ccccc2)CC1	ZINC000450902105	EG	On-Demand	Anodyne	KCNA3	0	44
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902106	EG	On-Demand	Anodyne	DRD2	30	45
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902106	EG	On-Demand	Anodyne	DRD4	0	45
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902106	EG	On-Demand	Anodyne	SLC18A3	0	45
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902106	EG	On-Demand	Anodyne	CYP2J2	49	36
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902107	EG	On-Demand	Anodyne	DRD2	30	45
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902107	EG	On-Demand	Anodyne	DRD4	0	45
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902107	EG	On-Demand	Anodyne	SLC18A3	0	45
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902107	EG	On-Demand	Anodyne	CYP2J2	49	36
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902108	EG	On-Demand	Anodyne	DRD2	30	45
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902108	EG	On-Demand	Anodyne	DRD4	0	45
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902108	EG	On-Demand	Anodyne	SLC18A3	0	45
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902108	EG	On-Demand	Anodyne	CYP2J2	49	36
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902109	EG	On-Demand	Anodyne	DRD2	30	45
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902109	EG	On-Demand	Anodyne	DRD4	0	45
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902109	EG	On-Demand	Anodyne	SLC18A3	0	45
CC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902109	EG	On-Demand	Anodyne	CYP2J2	49	36
C[C@@]1(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CC=CCC1	ZINC000450902118	EF	On-Demand	Anodyne	CDK4	22	40
C[C@]1(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CC=CCC1	ZINC000450902119	EF	On-Demand	Anodyne	CDK4	22	40
N#Cc1ncn(CCCCc2ccc(Cl)c(Cl)c2)c1C#N	ZINC000450902123	DH	On-Demand	Mild	DNAE	82	36
COc1ccc(CCNC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1OC	ZINC000450902191	GD	On-Demand	Anodyne	SSTR5	52	38
COc1ccc(CCNC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1OC	ZINC000450902193	GD	On-Demand	Anodyne	SSTR5	52	38
c1ccc(-c2n[nH]c(CN=c3cc(NCC4CC4)nc[nH]3)n2)nc1	ZINC000450902205	DD	On-Demand	Anodyne	GPR39	0	47
CCCNC(=O)c1ccc(N2CCC(OCCOC(C)C)CC2)nc1	ZINC000450902215	EF	On-Demand	Anodyne	SCD1	21	44
COc1cccc2c(N3CCC(OCCOC(C)C)CC3)nccc12	ZINC000450902223	EH	On-Demand	Anodyne	PDE3A	44	42
COc1cccc2c(N3CCC(OCCOC(C)C)CC3)nccc12	ZINC000450902223	EH	On-Demand	Anodyne	PDE3B	73	41
CC(C)OCCOC1CCN(c2ccc(Cl)cc2C#N)CC1	ZINC000450902224	DH	On-Demand	Mild	NOS2	18	40
CC(C)OCCOC1CCN(c2ccc(Cl)cc2C#N)CC1	ZINC000450902224	DH	On-Demand	Mild	NOS3	15	40
CCCCCSCCC(=O)NC(=O)NCCC(F)(F)F	ZINC000450902246	DG	On-Demand	Anodyne	CES2	29	40
CCCCCSCCC(=O)NC(=O)NCCC(F)(F)F	ZINC000450902246	DG	On-Demand	Anodyne	CES1	33	40
CCCCCSCCC(=O)NC(=O)NCCC(F)(F)F	ZINC000450902246	DG	On-Demand	Anodyne	EST1_PIG	56	40
CCCCCSCCC(=O)NC(=O)NCCC(F)(F)F	ZINC000450902246	DG	On-Demand	Anodyne	CES2C	30	40
CCCCCSCCC(=O)NC(=O)NCCC(F)(F)F	ZINC000450902246	DG	On-Demand	Anodyne	JHE	0	40
CCCCCSCCC(=O)NC(=O)NCCC(F)(F)F	ZINC000450902246	DG	On-Demand	Anodyne	Q9GPG0_MANSE	0	40
CCCCCSCCC(=O)NC(=O)NCCC(F)(F)F	ZINC000450902246	DG	On-Demand	Anodyne	EST5_RAT	0	40
c1ccc(-c2n[nH]c(CNc3nc4ccccc4nc3N3CCOCC3)n2)nc1	ZINC000450902248	GE	On-Demand	Anodyne	METAP1	44	52
CN(CCCN1CCCC1)Cc1ccn(CCc2ccccc2)n1	ZINC000450902250	EG	On-Demand	Anodyne	HRH3	24	42
CN(CCCN1CCCC1)Cc1ccn(CCc2ccccc2)n1	ZINC000450902250	EG	On-Demand	Anodyne	SIGMAR1	53	51
CN(CCCN1CCCC1)Cc1ccn(CCc2ccccc2)n1	ZINC000450902250	EG	On-Demand	Anodyne	F2R	22	41
CN(CCCN1CCCC1)Cc1ccn(CCc2ccccc2)n1	ZINC000450902250	EG	On-Demand	Anodyne	HNMT	55	40
CCOc1ccc(NC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1OCC	ZINC000450902294	GE	On-Demand	Anodyne	DRD4	0	41
CCOc1ccc(NC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1OCC	ZINC000450902294	GE	On-Demand	Anodyne	SSTR5	62	41
CCOc1ccc(NC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1OCC	ZINC000450902294	GE	On-Demand	Anodyne	ENPP1	62	33
CCOc1ccc(NC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1OCC	ZINC000450902295	GE	On-Demand	Anodyne	DRD4	0	41
CCOc1ccc(NC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1OCC	ZINC000450902295	GE	On-Demand	Anodyne	SSTR5	62	41
CCOc1ccc(NC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1OCC	ZINC000450902295	GE	On-Demand	Anodyne	ENPP1	62	33
CC(=O)CCCCCn1cnn(C(C)(C)C)c1=O	ZINC000450902306	CD	On-Demand	Anodyne	PAOX	40	35
CC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2cccc(F)c2)cc1	ZINC000450902318	DG	On-Demand	Anodyne	CCR5	40	30
CC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2cccc(F)c2)cc1	ZINC000450902319	DG	On-Demand	Anodyne	CCR5	40	30
CC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2cccc(F)c2)cc1	ZINC000450902320	DG	On-Demand	Anodyne	CCR5	40	30
CC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2cccc(F)c2)cc1	ZINC000450902321	DG	On-Demand	Anodyne	CCR5	40	30
COc1ccc(CNC(=O)CCN(C)CCCO)c(OC)c1	ZINC000450902324	DD	On-Demand	Anodyne	MTNR1A	60	40
COc1ccc(CNC(=O)CCN(C)CCCO)c(OC)c1	ZINC000450902324	DD	On-Demand	Anodyne	MTNR1B	45	38
CN1CCN(c2nc3ccccc3nc2NCc2ccc(C#N)c(F)c2)CC1	ZINC000450902343	GG	On-Demand	Mild	HTR3A	27	43
CN1CCN(c2nc3ccccc3nc2NCc2ccc(C#N)c(F)c2)CC1	ZINC000450902343	GG	On-Demand	Mild	HRH4	42	48
Cc1nc(SCC[C@H](C)O)[nH]c1-c1ccccc1	ZINC000450902356	CG	On-Demand	Anodyne	SOAT1	60	52
Cc1nc(SCC[C@@H](C)O)[nH]c1-c1ccccc1	ZINC000450902357	CG	On-Demand	Anodyne	SOAT1	60	52
O[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(Cc2ccccc2OC2CC2)[C@H]31	ZINC000450902376	CE	On-Demand	Anodyne	SLC5A4	53	33
Cc1ccncc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450902377	DG	On-Demand	Anodyne	HTR1A	28	42
Cc1ccncc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450902377	DG	On-Demand	Anodyne	DRD2	23	40
Cc1ccncc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450902377	DG	On-Demand	Anodyne	DRD4	33	46
Cc1ccncc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450902377	DG	On-Demand	Anodyne	DRD3	22	42
O[C@@H]1[C@H]2C[C@@H]3CN(Cc4ccccc4OC4CC4)[C@H]1[C@H]3C2	ZINC000450902378	CE	On-Demand	Anodyne	SLC5A4	53	33
O[C@@H]1[C@H]2C[C@@H]3CN(Cc4ccccc4OC4CC4)[C@@H]1[C@H]3C2	ZINC000450902379	CE	On-Demand	Anodyne	SLC5A4	53	33
O[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(Cc1ccccc1OC1CC1)C[C@@H]3C2	ZINC000450902380	CE	On-Demand	Anodyne	SLC5A4	53	33
COC(=O)c1ccc(CSc2nnc(C(F)(F)F)s2)cc1Cl	ZINC000450902381	FI	On-Demand	Anodyne	PTPRG	0	41
N#Cc1ccc(CNc2cc(N3CCC[C@H]3CO)ncn2)cc1F	ZINC000450902383	EE	On-Demand	Mild	PRCP	15	41
N#Cc1ccc(CNc2cc(N3CCC[C@@H]3CO)ncn2)cc1F	ZINC000450902384	EE	On-Demand	Mild	PRCP	15	41
Cc1ccn2ncc(C(=O)NC[C@@H]3C[C@H](F)CN3Cc3cccs3)c2c1	ZINC000450902390	FG	On-Demand	Anodyne	EPHB3	31	43
CN(CCOc1ccccc1C(C)(C)C)Cc1cccnc1N	ZINC000450902426	DG	On-Demand	Anodyne	P2RY1	22	41
Cc1nc(SCc2nnc(C(C)C)s2)[nH]c1-c1ccccc1	ZINC000450902433	EJ	On-Demand	Anodyne	SOAT1	34	43
COC(=O)CCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450902435	CD	On-Demand	Anodyne	P2RY12	22	47
COC(=O)CCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450902435	CD	On-Demand	Anodyne	KAT2B	0	41
COC(=O)CCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450902435	CD	On-Demand	Anodyne	GSG2	44	39
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450902444	GF	On-Demand	Bother	CPT1A	42	34
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450902444	GF	On-Demand	Bother	TAAR1	35	51
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450902445	GF	On-Demand	Bother	CPT1A	42	34
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000450902445	GF	On-Demand	Bother	TAAR1	35	51
CC(=O)c1ccc(OCCC(C)(F)F)c(Cl)c1	ZINC000450902457	CH	On-Demand	Anodyne	PPARA	26	42
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	HTR1A	106	51
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	DRD2	89	54
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	DRD1	46	54
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	DRD4	43	35
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	ADRA1D	49	41
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	HTR2A	74	54
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	HTR2C	57	44
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	SLC6A4	28	45
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	ADRA1A	42	43
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	DRD3	77	54
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	HTR7	109	57
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	ABCB1	34	41
Cc1ccncc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450902466	DG	On-Demand	Anodyne	CYP2J2	60	44
COC(=O)c1cc2ccc(OCc3oc(C(C)C)nc3C)cc2o1	ZINC000450902470	EI	On-Demand	Anodyne	MAOB	39	43
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)cc1	ZINC000450902490	GI	On-Demand	Anodyne	SLC18A3	19	41
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)cc1	ZINC000450902492	GI	On-Demand	Anodyne	SLC18A3	19	41
Cc1nn(C)cc1COc1cc(Br)ccc1Cl	ZINC000450902526	DH	On-Demand	Anodyne	PTGER1	15	41
COC[C@@]1(CO)CCN(c2ncccc2C(=O)N2CCc3ccccc32)C1	ZINC000450902542	FE	On-Demand	Anodyne	AVPR2	43	35
COC[C@@]1(CO)CCN(c2ncccc2C(=O)N2CCc3ccccc32)C1	ZINC000450902542	FE	On-Demand	Anodyne	GPBAR1	30	43
COC[C@]1(CO)CCN(c2ncccc2C(=O)N2CCc3ccccc32)C1	ZINC000450902544	FE	On-Demand	Anodyne	AVPR2	43	35
COC[C@]1(CO)CCN(c2ncccc2C(=O)N2CCc3ccccc32)C1	ZINC000450902544	FE	On-Demand	Anodyne	GPBAR1	30	43
Brc1cccc(C2CCN(Cc3nnc(C4CC4)s3)CC2)c1	ZINC000450902557	GJ	On-Demand	Anodyne	VACHT_TETCF	0	43
COC(=O)c1coc(CSCCCCc2ccccc2)n1	ZINC000450902568	DH	On-Demand	Anodyne	FAAH	47	59
CC(=O)CCCCCN1C(=O)N[C@]2(CCN(Cc3ccccc3)C2)C1=O	ZINC000450902580	FE	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)CCCCCN1C(=O)N[C@]2(CCN(Cc3ccccc3)C2)C1=O	ZINC000450902580	FE	On-Demand	Anodyne	NPFFR1	43	33
CC(=O)CCCCCN1C(=O)N[C@@]2(CCN(Cc3ccccc3)C2)C1=O	ZINC000450902581	FE	On-Demand	Anodyne	SIGMAR1	42	40
CC(=O)CCCCCN1C(=O)N[C@@]2(CCN(Cc3ccccc3)C2)C1=O	ZINC000450902581	FE	On-Demand	Anodyne	NPFFR1	43	33
NC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450902584	EE	On-Demand	Anodyne	DPP4	27	42
NC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450902584	EE	On-Demand	Anodyne	SCD1	63	48
NC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450902584	EE	On-Demand	Anodyne	SCD	50	38
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902592	EG	On-Demand	Anodyne	DRD2	31	45
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902592	EG	On-Demand	Anodyne	DRD4	0	46
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902592	EG	On-Demand	Anodyne	SLC18A3	0	48
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCOC2)O1	ZINC000450902592	EG	On-Demand	Anodyne	CYP2J2	47	34
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902594	EG	On-Demand	Anodyne	DRD2	31	45
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902594	EG	On-Demand	Anodyne	DRD4	0	46
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902594	EG	On-Demand	Anodyne	SLC18A3	0	48
CC1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCOC2)O1	ZINC000450902594	EG	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H](O)CCN1CCN(Cc2cc(Br)ccc2F)CC1	ZINC000450902599	EE	On-Demand	Anodyne	CCR5	15	41
C[C@H](O)CCN1CCN(Cc2cc(Br)ccc2F)CC1	ZINC000450902601	EE	On-Demand	Anodyne	CCR5	15	41
COC(=O)c1cc2ccc(OCCC[C@H](C)O)cc2o1	ZINC000450902603	CF	On-Demand	Anodyne	CA7	0	43
COC(=O)c1cc2ccc(OCCC[C@H](C)O)cc2o1	ZINC000450902603	CF	On-Demand	Anodyne	HST2	0	40
COC(=O)c1cc2ccc(OCCC[C@H](C)O)cc2o1	ZINC000450902603	CF	On-Demand	Anodyne	SLC16A3	0	41
COC(=O)c1cc2ccc(OCCC[C@@H](C)O)cc2o1	ZINC000450902609	CF	On-Demand	Anodyne	CA7	0	43
COC(=O)c1cc2ccc(OCCC[C@@H](C)O)cc2o1	ZINC000450902609	CF	On-Demand	Anodyne	HST2	0	40
COC(=O)c1cc2ccc(OCCC[C@@H](C)O)cc2o1	ZINC000450902609	CF	On-Demand	Anodyne	SLC16A3	0	41
Cc1cc(C#N)nc(N2CCC(Cc3c(F)cccc3F)CC2)n1	ZINC000450902612	EG	On-Demand	Mild	GPR119	0	40
O=C(CCCN1CCC[C@@H]1[C@H]1COCC[C@@H]1O)c1ccc(F)cc1	ZINC000450902627	EF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCC[C@@H]1[C@H]1COCC[C@@H]1O)c1ccc(F)cc1	ZINC000450902627	EF	On-Demand	Anodyne	CYP2J2	48	34
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CC1	ZINC000450902628	FD	On-Demand	Anodyne	KCNA3	40	34
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CC1	ZINC000450902628	FD	On-Demand	Anodyne	NPFFR1	43	43
O=C(CCCN1CCC[C@@H]1[C@@H]1COCC[C@@H]1O)c1ccc(F)cc1	ZINC000450902629	EF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCC[C@@H]1[C@@H]1COCC[C@@H]1O)c1ccc(F)cc1	ZINC000450902629	EF	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1CCC[C@@H]1[C@@H]1COCC[C@H]1O)c1ccc(F)cc1	ZINC000450902630	EF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCC[C@@H]1[C@@H]1COCC[C@H]1O)c1ccc(F)cc1	ZINC000450902630	EF	On-Demand	Anodyne	CYP2J2	48	34
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CC1	ZINC000450902631	FD	On-Demand	Anodyne	KCNA3	40	34
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CC1	ZINC000450902631	FD	On-Demand	Anodyne	NPFFR1	43	43
O=C(CCCN1CCC[C@@H]1[C@H]1COCC[C@H]1O)c1ccc(F)cc1	ZINC000450902632	EF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCC[C@@H]1[C@H]1COCC[C@H]1O)c1ccc(F)cc1	ZINC000450902632	EF	On-Demand	Anodyne	CYP2J2	48	34
Cc1nn(C)cc1COc1ccc(S(=O)(=O)NCCC(C)C)cc1	ZINC000450902636	FF	On-Demand	Anodyne	ADAMTS4	40	36
CC[C@]1(C2CC2)NC(=O)N(CC(=O)N2CCCC[C@@H]2C(N)=O)C1=O	ZINC000450902642	EB	On-Demand	Anodyne	TRHR	56	35
CC[C@@]1(C2CC2)NC(=O)N(CC(=O)N2CCCC[C@@H]2C(N)=O)C1=O	ZINC000450902643	EB	On-Demand	Anodyne	TRHR	56	35
CC[C@]1(C2CC2)NC(=O)N(CC(=O)N2CCCC[C@H]2C(N)=O)C1=O	ZINC000450902645	EB	On-Demand	Anodyne	TRHR	56	35
CC[C@@]1(C2CC2)NC(=O)N(CC(=O)N2CCCC[C@H]2C(N)=O)C1=O	ZINC000450902646	EB	On-Demand	Anodyne	TRHR	56	35
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450902682	CF	On-Demand	Anodyne	SOAT1	0	49
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450902682	CF	On-Demand	Anodyne	POL	0	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450902682	CF	On-Demand	Anodyne	BIRC2	40	36
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450902683	CF	On-Demand	Anodyne	SOAT1	0	49
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450902683	CF	On-Demand	Anodyne	POL	0	40
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450902683	CF	On-Demand	Anodyne	BIRC2	40	36
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450902684	CF	On-Demand	Anodyne	SOAT1	0	49
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450902684	CF	On-Demand	Anodyne	POL	0	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](O)C1CCC1	ZINC000450902684	CF	On-Demand	Anodyne	BIRC2	40	36
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450902686	CF	On-Demand	Anodyne	SOAT1	0	49
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450902686	CF	On-Demand	Anodyne	POL	0	40
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](O)C1CCC1	ZINC000450902686	CF	On-Demand	Anodyne	BIRC2	40	36
COc1cc2c(N3CCC(OCCOC(C)C)CC3)ccnc2cc1F	ZINC000450902689	FH	On-Demand	Anodyne	PDE3A	49	38
COc1cc2c(N3CCC(OCCOC(C)C)CC3)ccnc2cc1F	ZINC000450902689	FH	On-Demand	Anodyne	PDE3B	73	38
Oc1nnc([C@@H]2CCCN(CCc3ccc(Cl)cc3)C2)o1	ZINC000450902695	DF	On-Demand	Anodyne	BIRC2	37	41
Oc1nnc([C@H]2CCCN(CCc3ccc(Cl)cc3)C2)o1	ZINC000450902696	DF	On-Demand	Anodyne	BIRC2	37	41
O=C1NCCCc2cc(OCC3=CCCCC3)ccc21	ZINC000450902706	CG	On-Demand	Anodyne	MAOB	16	46
CN(CC(=O)NCC1(c2ccccc2)CCOCC1)c1cccc2cccnc12	ZINC000450902716	GH	On-Demand	Anodyne	ACAT	0	45
CC(C)OCCOC1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450902726	FD	On-Demand	Anodyne	SORD	57	38
COC(=O)[C@@H]1CN(Cc2cnn[nH]2)C[C@H]1c1ccccc1	ZINC000450902754	CD	On-Demand	Anodyne	SLC6A1	73	48
CC(=O)CCCCCOc1ccc2c(c1)CCCNC2=O	ZINC000450902767	CF	On-Demand	Anodyne	THRA	33	40
CC(=O)CCCCCOc1ccc2c(c1)CCCNC2=O	ZINC000450902767	CF	On-Demand	Anodyne	P2RY12	46	44
CC(=O)CCCCCOc1ccc2c(c1)CCCNC2=O	ZINC000450902767	CF	On-Demand	Anodyne	THRB	0	40
CC(=O)CCCCCOc1ccc2c(c1)CCCNC2=O	ZINC000450902767	CF	On-Demand	Anodyne	PLA2G4B	50	33
Cc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450902804	EG	On-Demand	Anodyne	PDE3A	53	40
Cc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450902804	EG	On-Demand	Anodyne	PDGFRB	38	41
Cc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450902804	EG	On-Demand	Anodyne	PDE3B	78	40
Cc1ccc2ncnc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450902804	EG	On-Demand	Anodyne	HTT	0	40
COC(=O)c1csc(COc2ccc3c(c2)CCC3=O)n1	ZINC000450902831	DF	On-Demand	Anodyne	PPARD	23	40
CCCN(CCc1cccs1)C(=O)Cc1scnc1-c1ccccc1	ZINC000450902842	FJ	On-Demand	Anodyne	TSPO	51	46
Cc1cc(C)c(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])cn1	ZINC000450902857	EG	On-Demand	Bother	TAAR1	15	41
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450902873	FE	On-Demand	Anodyne	OXTR	25	44
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450902873	FE	On-Demand	Anodyne	AVPR1A	15	44
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450902874	FE	On-Demand	Anodyne	OXTR	25	44
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450902874	FE	On-Demand	Anodyne	AVPR1A	15	44
COc1cccc(OCCC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450902883	FG	On-Demand	Anodyne	HRH2	20	41
COc1cccc(OCCC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450902883	FG	On-Demand	Anodyne	CHRNA10	18	42
COc1cccc(OCCC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450902883	FG	On-Demand	Anodyne	RHODESAIN	0	41
COc1cccc(OCCC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450902884	FG	On-Demand	Anodyne	HRH2	20	41
COc1cccc(OCCC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450902884	FG	On-Demand	Anodyne	CHRNA10	18	42
COc1cccc(OCCC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000450902884	FG	On-Demand	Anodyne	RHODESAIN	0	41
COc1ccc(CNC(=O)CCN[C@@]2(CO)CCCc3ccccc32)c(OC)c1	ZINC000450902904	GF	On-Demand	Anodyne	MTNR1A	55	37
COc1ccc(CNC(=O)CCN[C@@]2(CO)CCCc3ccccc32)c(OC)c1	ZINC000450902904	GF	On-Demand	Anodyne	MTNR1B	48	37
COc1ccc(CNC(=O)CCN[C@]2(CO)CCCc3ccccc32)c(OC)c1	ZINC000450902905	GF	On-Demand	Anodyne	MTNR1A	55	37
COc1ccc(CNC(=O)CCN[C@]2(CO)CCCc3ccccc32)c(OC)c1	ZINC000450902905	GF	On-Demand	Anodyne	MTNR1B	48	37
CCc1cc(O)nc(SCC(=O)c2ccc(C(=O)OC)o2)n1	ZINC000450902908	DE	On-Demand	Anodyne	CA7	18	44
CCc1cc(O)nc(SCC(=O)c2ccc(C(=O)OC)o2)n1	ZINC000450902908	DE	On-Demand	Anodyne	CA13	27	44
C[C@@H](SCc1ccccc1C1CC1)C(=O)Nc1nccs1	ZINC000450902909	DI	On-Demand	Anodyne	MAP	0	42
C[C@@H](SCc1ccccc1C1CC1)C(=O)Nc1nccs1	ZINC000450902909	DI	On-Demand	Anodyne	MAP1	126	42
C[C@@H](SCc1ccccc1C1CC1)C(=O)Nc1nccs1	ZINC000450902909	DI	On-Demand	Anodyne	GCK	20	41
C[C@H](SCc1ccccc1C1CC1)C(=O)Nc1nccs1	ZINC000450902910	DI	On-Demand	Anodyne	MAP	0	42
C[C@H](SCc1ccccc1C1CC1)C(=O)Nc1nccs1	ZINC000450902910	DI	On-Demand	Anodyne	MAP1	126	42
C[C@H](SCc1ccccc1C1CC1)C(=O)Nc1nccs1	ZINC000450902910	DI	On-Demand	Anodyne	GCK	20	41
COC(=O)c1csc(CSCCCCc2ccccc2)n1	ZINC000450902942	DI	On-Demand	Anodyne	FAAH	35	46
COC(=O)c1csc(CSCCCCc2ccccc2)n1	ZINC000450902942	DI	On-Demand	Anodyne	CES1	48	41
COc1ccc2ncc(=O)n(CCCS(=O)(=O)c3cccc(C)c3)c2c1	ZINC000450902953	FF	On-Demand	Anodyne	GSG2	43	36
CN(C)C(=O)c1cnc(N2CCC(Cc3cc(F)ccc3F)CC2)c(Cl)c1	ZINC000450902954	GI	On-Demand	Anodyne	MPL	25	42
CN(C)C(=O)c1cnc(N2CCC(Cc3cc(F)ccc3F)CC2)c(Cl)c1	ZINC000450902954	GI	On-Demand	Anodyne	CXCR3	35	42
CN(C)C(=O)c1cncc(N2CCC(Cc3cc(F)ccc3F)CC2)n1	ZINC000450902969	FF	On-Demand	Anodyne	DPP4	17	40
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	HTR1A	66	49
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	DRD2	58	41
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	DRD4	28	40
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	ADRA1D	60	43
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	HTR2A	30	42
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	ADRA1A	41	36
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	ADRA1B	36	43
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	DRD3	46	38
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	HTR7	50	38
COc1cnccc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902992	EE	On-Demand	Anodyne	ABCB1	41	36
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	HTR1A	66	49
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	DRD2	58	41
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	DRD4	28	40
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	ADRA1D	60	43
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	HTR2A	30	42
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	ADRA1A	41	36
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	ADRA1B	36	43
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	DRD3	46	38
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	HTR7	50	38
COc1cnccc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902993	EE	On-Demand	Anodyne	ABCB1	41	36
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	HTR1A	66	49
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	DRD2	58	41
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	DRD4	28	40
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	ADRA1D	60	43
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	HTR2A	30	42
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	ADRA1A	41	36
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	ADRA1B	36	43
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	DRD3	46	38
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	HTR7	50	38
COc1cnccc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450902994	EE	On-Demand	Anodyne	ABCB1	41	36
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	HTR1A	66	49
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	DRD2	58	41
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	DRD4	28	40
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	ADRA1D	60	43
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	HTR2A	30	42
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	ADRA1A	41	36
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	ADRA1B	36	43
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	DRD3	46	38
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	HTR7	50	38
COc1cnccc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450902995	EE	On-Demand	Anodyne	ABCB1	41	36
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	HTR1A	58	62
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	DRD2	63	70
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	DRD1	40	70
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	DRD4	52	56
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	ADRA1D	38	48
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	HTR2A	56	62
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	HTR2C	46	51
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	ADRA1A	28	41
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	DRD3	48	45
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	ERG2	22	48
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	HTR7	69	48
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	SLC18A3	0	52
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	HTR3B	0	46
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	CYP2J2	52	38
Cc1ccncc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903008	EG	On-Demand	Anodyne	AP2S1	0	48
CCC[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450903028	FH	On-Demand	Anodyne	P2RY12	53	34
CCC[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450903028	FH	On-Demand	Anodyne	PSENEN	0	41
CCC[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450903038	FH	On-Demand	Anodyne	P2RY12	53	34
CCC[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OC(C)(C)C	ZINC000450903038	FH	On-Demand	Anodyne	PSENEN	0	41
CCc1cc(CCCN2CCC=C(C)C2)on1	ZINC000450903049	BF	On-Demand	Anodyne	CHRNA6	0	54
COC[C@@]1(CO)CCN(c2cc(-c3nc(C(C)C)no3)ccn2)C1	ZINC000450903095	EE	On-Demand	Anodyne	SORD	45	33
COC[C@]1(CO)CCN(c2cc(-c3nc(C(C)C)no3)ccn2)C1	ZINC000450903097	EE	On-Demand	Anodyne	SORD	45	33
CCn1c(SC[C@H]2CCC(F)(F)C2)nc2ccc(F)cc2c1=O	ZINC000450903102	EI	On-Demand	Anodyne	Q8MHZ5_SHEEP	55	39
CCn1c(SC[C@@H]2CCC(F)(F)C2)nc2ccc(F)cc2c1=O	ZINC000450903107	EI	On-Demand	Anodyne	Q8MHZ5_SHEEP	55	39
CN(C(=O)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1)c1ccccc1	ZINC000450903156	GH	On-Demand	Anodyne	SLC6A1	48	32
CN(C(=O)[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1)c1ccccc1	ZINC000450903156	GH	On-Demand	Anodyne	MLNR	29	43
CN(C(=O)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1)c1ccccc1	ZINC000450903158	GH	On-Demand	Anodyne	SLC6A1	48	32
CN(C(=O)[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1)c1ccccc1	ZINC000450903158	GH	On-Demand	Anodyne	MLNR	29	43
COC[C@@]1(CO)CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1	ZINC000450903193	FD	On-Demand	Bother	CCKBR	45	33
COC[C@@]1(CO)CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1	ZINC000450903193	FD	On-Demand	Bother	TAAR1	22	47
COC[C@]1(CO)CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1	ZINC000450903194	FD	On-Demand	Bother	CCKBR	45	33
COC[C@]1(CO)CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1	ZINC000450903194	FD	On-Demand	Bother	TAAR1	22	47
COC(=O)[C@@H](C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450903212	ED	On-Demand	Anodyne	MTNR1A	61	44
COC(=O)[C@@H](C)N(C)CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450903212	ED	On-Demand	Anodyne	MTNR1B	49	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	ACE	49	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	OPRM1	64	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	OPRD1	47	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	MME	45	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	CMA1	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	CTRA_BOVIN	58	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	FCER2	43	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	TRY1_BOVIN	51	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	NPFFR2	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	TIMP3	40	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	ACE2	62	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	MARS	49	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	QRFPR	47	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	PSMB8	47	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	BRCA1	59	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903218	FD	On-Demand	Anodyne	NPFFR1	57	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	ACE	49	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	OPRM1	64	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	OPRD1	47	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	MME	45	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	CMA1	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	CTRA_BOVIN	58	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	FCER2	43	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	TRY1_BOVIN	51	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	NPFFR2	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	TIMP3	40	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	ACE2	62	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	MARS	49	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	QRFPR	47	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	PSMB8	47	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	BRCA1	59	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903219	FD	On-Demand	Anodyne	NPFFR1	57	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	ACE	49	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	OPRM1	64	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	OPRD1	47	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	MME	45	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	CMA1	62	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	CTRA_BOVIN	58	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	FCER2	43	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	TRY1_BOVIN	51	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	NPFFR2	62	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	TIMP3	40	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	ACE2	62	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	MARS	49	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	QRFPR	47	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	PSMB8	47	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	BRCA1	59	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450903220	FD	On-Demand	Anodyne	NPFFR1	57	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	ACE	49	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	OPRM1	64	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	OPRD1	47	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	MME	45	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	CMA1	62	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	CTRA_BOVIN	58	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	FCER2	43	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	TRY1_BOVIN	51	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	NPFFR2	62	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	TIMP3	40	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	ACE2	62	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	MARS	49	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	QRFPR	47	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	PSMB8	47	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	BRCA1	59	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450903221	FD	On-Demand	Anodyne	NPFFR1	57	32
O=C(NCc1cnc(N2CCOCC2)c(F)c1)[C@@H](O)C1CCC1	ZINC000450903230	DC	On-Demand	Anodyne	STAT6	45	33
O=C(NCc1cnc(N2CCOCC2)c(F)c1)[C@H](O)C1CCC1	ZINC000450903231	DC	On-Demand	Anodyne	STAT6	45	33
c1ccc(-c2n[nH]c(CNc3nc4ccccc4nc3N3CCCCC3)n2)nc1	ZINC000450903278	GG	On-Demand	Anodyne	METAP1	48	50
COc1cc(COc2ccc3c(c2)CCCNC3=O)ccc1Cl	ZINC000450903279	EH	On-Demand	Anodyne	MAOB	39	49
COc1cc(COc2ccc3c(c2)CCCNC3=O)ccc1Cl	ZINC000450903279	EH	On-Demand	Anodyne	CSNK1G2	65	38
Cn1cccc1[C@@H]1COCCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450903286	GE	On-Demand	Anodyne	EPHX2	31	42
Cn1cccc1[C@H]1COCCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450903287	GE	On-Demand	Anodyne	EPHX2	31	42
COc1ccc(CN(C)C(=O)CN2CCC[C@H](c3nnc(O)o3)C2)cc1OC	ZINC000450903288	GD	On-Demand	Anodyne	SSTR5	46	38
COc1ccc(CN(C)C(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)cc1OC	ZINC000450903289	GD	On-Demand	Anodyne	SSTR5	46	38
CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN(C)c1cccc2cccnc12	ZINC000450903298	GH	On-Demand	Anodyne	HCRTR2	23	41
CC(C)CCNS(=O)(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450903299	GF	On-Demand	Anodyne	MMP13	26	40
CC(C)CCNS(=O)(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450903299	GF	On-Demand	Anodyne	MMP8	22	40
C[C@@H]1CCC[C@]1(C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450903304	EE	On-Demand	Anodyne	STAT6	48	33
CC(C)OCCOC1CCN(c2ccc(C(=O)NC3CCCC3)nn2)CC1	ZINC000450903305	GF	On-Demand	Anodyne	SCD1	77	52
CC(C)OCCOC1CCN(c2ccc(C(=O)NC3CCCC3)nn2)CC1	ZINC000450903305	GF	On-Demand	Anodyne	SCD	47	38
C[C@@H]1CCC[C@@]1(C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450903306	EE	On-Demand	Anodyne	STAT6	48	33
C[C@H]1CCC[C@@]1(C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450903308	EE	On-Demand	Anodyne	STAT6	48	33
C[C@H]1CCC[C@]1(C)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450903310	EE	On-Demand	Anodyne	STAT6	48	33
N#Cc1ccc(SCC[C@@H]2CCOC2)cc1C(F)(F)F	ZINC000450903326	DI	On-Demand	Mild	AR	43	63
CC(C)OCCOC1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000450903336	FE	On-Demand	Bother	TAAR1	18	46
CC(C)OCCOC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450903337	GH	On-Demand	Anodyne	PDE3A	52	39
CC(C)OCCOC1CCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450903337	GH	On-Demand	Anodyne	PDE3B	77	39
Cc1cc(N2CCC(OCCOC(C)C)CC2)c2ccccc2n1	ZINC000450903339	EH	On-Demand	Anodyne	HTR1D	56	37
Cc1cc(N2CCC(OCCOC(C)C)CC2)c2ccccc2n1	ZINC000450903339	EH	On-Demand	Anodyne	HTR1B	50	37
COc1ccc2c(c1)c(=O)ncn2C[C@@H]1CCCC1(F)F	ZINC000450903345	CF	On-Demand	Anodyne	MTNR1A	26	40
COc1ccc2c(c1)c(=O)ncn2C[C@H]1CCCC1(F)F	ZINC000450903346	CF	On-Demand	Anodyne	MTNR1A	26	40
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	ADORA1	145	57
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	SLC29A1	130	62
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	ADORA2A	54	55
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	ADORA2B	48	54
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	ADK	62	57
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	AHCY	50	39
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	CDA	44	35
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	P2RX1	43	37
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	P2RY1	28	40
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	P2RY11	0	40
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	AMD1	25	40
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	ITPR1	51	38
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	NS5B	0	45
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	ADORA3	101	54
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	OXGR1	121	41
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	MTAP	0	45
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	IMPDH2	43	32
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	AK	0	48
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	SETD7	0	42
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	PRMT1	0	42
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	DNMT3B	64	39
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	Q4VQ11_PIG	77	54
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	GPR17	42	38
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	DOT1L	87	39
CC[C@@H]1CC[C@H](C)N(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450903349	GC	On-Demand	Anodyne	SETD2	0	42
COc1ccc(CNC(=O)CCN2CCC[C@@H]2[C@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450903354	GF	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCN2CCC[C@@H]2[C@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450903355	GF	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCN2CCC[C@@H]2[C@@H]2CCCC[C@H]2O)c(OC)c1	ZINC000450903356	GF	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCN2CCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c(OC)c1	ZINC000450903357	GF	On-Demand	Anodyne	MTNR1A	49	36
COc1cccc(C2(F)CCN(CC3CCC(=O)CC3)CC2)c1	ZINC000450903363	DH	On-Demand	Anodyne	OPRK1	15	40
COc1cccc(C2(F)CCN(CC3CCC(=O)CC3)CC2)c1	ZINC000450903363	DH	On-Demand	Anodyne	SIGMAR1	26	44
COc1ccc2c(c1)c(=O)ncn2C[C@H]1CCCCC1(F)F	ZINC000450903364	DG	On-Demand	Anodyne	MTNR1A	25	41
COc1ccc2c(c1)c(=O)ncn2C[C@@H]1CCCCC1(F)F	ZINC000450903365	DG	On-Demand	Anodyne	MTNR1A	25	41
Cc1nnc2c3ccccc3c(N3CCC(OCCOC(C)C)CC3)nn12	ZINC000450903368	FF	On-Demand	Anodyne	CREBBP	41	32
Cc1nnc2c3ccccc3c(N3CCC(OCCOC(C)C)CC3)nn12	ZINC000450903368	FF	On-Demand	Anodyne	BRD9	51	32
CCOC(=O)c1cccnc1N1CCC(OCCOC(C)C)CC1	ZINC000450903371	EF	On-Demand	Anodyne	P2RY12	43	38
Cc1nn(C)cc1CC(=O)NC[C@@H]1C[C@H](F)CN1c1ccnc(N(C)C)n1	ZINC000450903372	GC	On-Demand	Anodyne	NOS2	54	33
COC(=O)[C@H](CC(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450903377	ED	On-Demand	Anodyne	HPGDS	33	50
COC(=O)[C@@H](CC(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450903378	ED	On-Demand	Anodyne	HPGDS	33	50
CC(C)OCCOC1CCN(c2nc(-c3cccc(Cl)c3)no2)CC1	ZINC000450903384	FH	On-Demand	Anodyne	GRM5	24	45
CC(=O)[C@@](C)(O)CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450903385	DF	On-Demand	Anodyne	CCR1	47	35
CC(=O)[C@](C)(O)CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450903386	DF	On-Demand	Anodyne	CCR1	47	35
CC(C)OCCOC1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1	ZINC000450903406	GJ	On-Demand	Anodyne	ADRB2	22	54
CC(C)OCCOC1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1	ZINC000450903406	GJ	On-Demand	Anodyne	ADRB1	15	57
CC(C)OCCOC1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1	ZINC000450903406	GJ	On-Demand	Anodyne	ADRB3	22	59
C[C@@H](O)CCCN1CCOC[C@H]1c1nc(-c2cccs2)no1	ZINC000450903415	DE	On-Demand	Anodyne	ETHR	44	49
C[C@H](O)CCCN1CCOC[C@@H]1c1nc(-c2cccs2)no1	ZINC000450903416	DE	On-Demand	Anodyne	ETHR	44	49
C[C@H](O)CCCN1CCOC[C@H]1c1nc(-c2cccs2)no1	ZINC000450903417	DE	On-Demand	Anodyne	ETHR	44	49
C[C@@H](O)CCCN1CCOC[C@@H]1c1nc(-c2cccs2)no1	ZINC000450903418	DE	On-Demand	Anodyne	ETHR	44	49
CCCOc1cccc(COc2cnc(C#N)nc2)c1	ZINC000450903420	CF	On-Demand	Mild	MAOB	24	40
CCCOc1cccc(COc2cnc(C#N)nc2)c1	ZINC000450903420	CF	On-Demand	Mild	DRTS_LEIMA	46	40
CCCOc1cccc(COc2cnc(C#N)nc2)c1	ZINC000450903420	CF	On-Demand	Mild	DYR_PNECA	0	40
COC(=O)c1csc(CN2CCOC[C@@H]2c2nc(-c3cccs3)no2)n1	ZINC000450903429	GF	On-Demand	Anodyne	ETHR	44	45
COC(=O)c1csc(CN2CCOC[C@H]2c2nc(-c3cccs3)no2)n1	ZINC000450903430	GF	On-Demand	Anodyne	ETHR	44	45
Cc1nc(SC[C@H]2C[C@H]3CC[C@H]2O3)[nH]c1-c1ccccc1	ZINC000450903454	DI	On-Demand	Anodyne	SOAT1	29	44
Cc1nc(SC[C@@H]2C[C@H]3CC[C@H]2O3)[nH]c1-c1ccccc1	ZINC000450903455	DI	On-Demand	Anodyne	SOAT1	29	44
Cc1nc(SCCC(C)(F)F)[nH]c1-c1ccccc1	ZINC000450903457	CJ	On-Demand	Anodyne	SOAT1	54	48
CCOC(=O)c1nc(=NCc2ccc(C#N)c(F)c2)cc(C(C)(C)C)[nH]1	ZINC000450903460	FF	On-Demand	Mild	P2RY12	27	40
CCC(CC)(CCSc1nc2cncnc2[nH]1)C(=O)OC	ZINC000450903471	DF	On-Demand	Anodyne	ENPP1	41	32
COc1cc(OC)c2ncc(C#N)c(NCc3cnc(C)cc3C)c2c1	ZINC000450903487	EH	On-Demand	Mild	SRC	64	41
CN(CC(N)=O)C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000450903495	GD	On-Demand	Anodyne	RBP4	73	36
CCCC[C@@H](NC(=O)c1c(C2CC2)noc1C)C(=O)OC(C)(C)C	ZINC000450903516	EG	On-Demand	Anodyne	CTSK	0	40
CCCC[C@H](NC(=O)c1c(C2CC2)noc1C)C(=O)OC(C)(C)C	ZINC000450903517	EG	On-Demand	Anodyne	CTSK	0	40
C/C=C/C[C@H](NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1)C(=O)OCC	ZINC000450903548	FD	On-Demand	Anodyne	CPT1A	45	31
C/C=C\C[C@@H](NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1)C(=O)OCC	ZINC000450903549	FD	On-Demand	Anodyne	CPT1A	45	31
C/C=C\C[C@H](NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1)C(=O)OCC	ZINC000450903550	FD	On-Demand	Anodyne	CPT1A	45	31
C/C=C/C[C@@H](NC(=O)c1ccc(OC)c(S(C)(=O)=O)c1)C(=O)OCC	ZINC000450903551	FD	On-Demand	Anodyne	CPT1A	45	31
CCS(=O)(=O)c1ccc(CN2CCC=C(C)C2)cc1	ZINC000450903560	CF	On-Demand	Anodyne	CHRNA6	0	44
COC(=O)[C@@H](C)N(C)CCCC(=O)c1ccc(Br)cc1	ZINC000450903569	EF	On-Demand	Anodyne	HDAC8	18	44
Cc1ccc([N+](=O)[O-])c(NCc2cnc(C3CC3)o2)c1	ZINC000450903592	CG	On-Demand	Bother	PRKCQ	43	41
CN(C)C(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450903594	FH	On-Demand	Anodyne	ACKR3	45	32
CCC(=O)CCCN1CCN(c2cnccc2C)CC1	ZINC000450903596	CE	On-Demand	Anodyne	HTR1A	60	40
CCC(=O)CCCN1CCN(c2cnccc2C)CC1	ZINC000450903596	CE	On-Demand	Anodyne	DRD2	42	44
CCC(=O)CCCN1CCN(c2cnccc2C)CC1	ZINC000450903596	CE	On-Demand	Anodyne	DRD1	24	44
CCC(=O)CCCN1CCN(c2cnccc2C)CC1	ZINC000450903596	CE	On-Demand	Anodyne	DRD3	42	44
CCC(=O)CCCN1CCN(c2cnccc2C)CC1	ZINC000450903596	CE	On-Demand	Anodyne	HTR7	74	39
CCOC(=O)[C@]1(COC)CCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450903619	GF	On-Demand	Anodyne	SLC12A5	58	36
CCOC(=O)[C@@]1(COC)CCCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450903620	GF	On-Demand	Anodyne	SLC12A5	58	36
CCCC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450903621	CD	On-Demand	Anodyne	MTNR1A	38	40
CCCC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450903621	CD	On-Demand	Anodyne	MTNR1B	26	40
COC(=O)[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1c1ccccc1	ZINC000450903622	ED	On-Demand	Anodyne	SLC6A1	70	46
COC(=O)[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1c1ccccc1	ZINC000450903622	ED	On-Demand	Anodyne	SLC6A3	29	41
COC(=O)[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1c1ccccc1	ZINC000450903624	ED	On-Demand	Anodyne	SLC6A1	70	46
COC(=O)[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1c1ccccc1	ZINC000450903624	ED	On-Demand	Anodyne	SLC6A3	29	41
COCCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450903626	CD	On-Demand	Anodyne	GSG2	46	41
COC(=O)c1ccc(CN2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1Cl	ZINC000450903628	FI	On-Demand	Anodyne	OPRK1	31	42
COC(=O)c1ccc(CN2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1Cl	ZINC000450903629	FI	On-Demand	Anodyne	OPRK1	31	42
COC(=O)c1ccc(CN2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1Cl	ZINC000450903630	FI	On-Demand	Anodyne	OPRK1	31	42
COC(=O)c1ccc(CN2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1Cl	ZINC000450903631	FI	On-Demand	Anodyne	OPRK1	31	42
CCCC[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903636	CE	On-Demand	Anodyne	SSTR2	55	34
CCCC[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903636	CE	On-Demand	Anodyne	CTSK	25	48
CCCC[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903636	CE	On-Demand	Anodyne	PGA5	44	40
CCCC[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903638	CE	On-Demand	Anodyne	SSTR2	55	34
CCCC[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903638	CE	On-Demand	Anodyne	CTSK	25	48
CCCC[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903638	CE	On-Demand	Anodyne	PGA5	44	40
CCCC[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903639	CE	On-Demand	Anodyne	SSTR2	55	34
CCCC[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903639	CE	On-Demand	Anodyne	CTSK	25	48
CCCC[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903639	CE	On-Demand	Anodyne	PGA5	44	40
CCCC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903641	CE	On-Demand	Anodyne	SSTR2	55	34
CCCC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903641	CE	On-Demand	Anodyne	CTSK	25	48
CCCC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450903641	CE	On-Demand	Anodyne	PGA5	44	40
CC[C@H](O)CC(=O)NCC(CC)(CC)c1ccc(OC)c(OC)c1	ZINC000450903642	EG	On-Demand	Anodyne	ENPP1	48	29
CC[C@@H](O)CC(=O)NCC(CC)(CC)c1ccc(OC)c(OC)c1	ZINC000450903644	EG	On-Demand	Anodyne	ENPP1	48	29
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450903650	GD	On-Demand	Mild	BCL2L1	109	38
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450903650	GD	On-Demand	Mild	BCL2	93	40
C=CCC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450903650	GD	On-Demand	Mild	BCL2L2	46	33
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450903653	GD	On-Demand	Mild	BCL2L1	109	38
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450903653	GD	On-Demand	Mild	BCL2	93	40
C=CCC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450903653	GD	On-Demand	Mild	BCL2L2	46	33
CC(C)c1ccc(C[C@@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)cc1	ZINC000450903657	FI	On-Demand	Anodyne	ENPP2	19	42
CC(C)c1ccc(C[C@H]2CCN(C(=O)c3ccc(N4CCC4)nc3)C2)cc1	ZINC000450903659	FI	On-Demand	Anodyne	ENPP2	19	42
COC(=O)[C@@H]1CN(CC2CC(F)(F)C2)C[C@H]1c1ccccc1	ZINC000450903697	DF	On-Demand	Anodyne	SLC6A1	75	48
COC(=O)[C@@H]1CN(CC2CC(F)(F)C2)C[C@H]1c1ccccc1	ZINC000450903697	DF	On-Demand	Anodyne	SLC6A3	31	40
O=C(NCCO)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nn1	ZINC000450903713	GD	On-Demand	Anodyne	SCD1	77	56
O=C(NCCO)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nn1	ZINC000450903713	GD	On-Demand	Anodyne	SCD	63	54
Cc1nccc(N2CCC(Cc3c(F)cccc3F)CC2)n1	ZINC000450903715	DH	On-Demand	Anodyne	SORD	56	38
Brc1cccc(C2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450903718	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903722	GF	On-Demand	Anodyne	COLA	62	37
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903722	GF	On-Demand	Anodyne	CPT1A	67	35
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903722	GF	On-Demand	Anodyne	CPT2	43	33
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903722	GF	On-Demand	Anodyne	PRNP	35	42
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903722	GF	On-Demand	Anodyne	HDAC1	33	47
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903722	GF	On-Demand	Anodyne	TAAR1	46	42
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903722	GF	On-Demand	Anodyne	DGAT1	26	42
COC[C@@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903722	GF	On-Demand	Anodyne	KCNK3	48	38
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903724	GF	On-Demand	Anodyne	COLA	62	37
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903724	GF	On-Demand	Anodyne	CPT1A	67	35
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903724	GF	On-Demand	Anodyne	CPT2	43	33
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903724	GF	On-Demand	Anodyne	PRNP	35	42
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903724	GF	On-Demand	Anodyne	HDAC1	33	47
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903724	GF	On-Demand	Anodyne	TAAR1	46	42
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903724	GF	On-Demand	Anodyne	DGAT1	26	42
COC[C@]1(CO)CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450903724	GF	On-Demand	Anodyne	KCNK3	48	38
COC(=O)[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H](C)O	ZINC000450903725	ED	On-Demand	Anodyne	TIMP3	61	36
COC(=O)[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H](C)O	ZINC000450903725	ED	On-Demand	Anodyne	CAPN2	41	32
COC(=O)[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H](C)O	ZINC000450903725	ED	On-Demand	Anodyne	SLC12A5	51	37
COC(=O)[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H](C)O	ZINC000450903727	ED	On-Demand	Anodyne	TIMP3	61	36
COC(=O)[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H](C)O	ZINC000450903727	ED	On-Demand	Anodyne	CAPN2	41	32
COC(=O)[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H](C)O	ZINC000450903727	ED	On-Demand	Anodyne	SLC12A5	51	37
COC(=O)[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H](C)O	ZINC000450903729	ED	On-Demand	Anodyne	TIMP3	61	36
COC(=O)[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H](C)O	ZINC000450903729	ED	On-Demand	Anodyne	CAPN2	41	32
COC(=O)[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H](C)O	ZINC000450903729	ED	On-Demand	Anodyne	SLC12A5	51	37
COC(=O)[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H](C)O	ZINC000450903731	ED	On-Demand	Anodyne	TIMP3	61	36
COC(=O)[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H](C)O	ZINC000450903731	ED	On-Demand	Anodyne	CAPN2	41	32
COC(=O)[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H](C)O	ZINC000450903731	ED	On-Demand	Anodyne	SLC12A5	51	37
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	HTR1A	105	60
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	ADRA2A	20	44
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	DRD2	97	59
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	DRD1	60	58
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	DRD4	64	55
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	ADRA1D	73	48
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	HTR2A	61	58
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	HTR2C	37	48
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	SLC6A4	21	53
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	ADRA1A	56	44
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	HRH1	20	59
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	ADRA1B	48	46
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	DRD3	77	57
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	ADRA2B	0	46
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	DRD5	18	44
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	ERG2	21	46
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	HTR7	91	61
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	SIGMAR1	26	56
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	SLC18A3	26	49
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	TACR3	19	42
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	EBP	18	46
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	HTR3B	0	44
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	ABCB1	23	46
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	CYP2J2	49	35
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	AP2S1	0	46
COc1cnccc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450903734	FG	On-Demand	Anodyne	ALPHA-1A	0	42
CC[C@H](O)CC(=O)N[C@H](C[C@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903741	EE	On-Demand	Anodyne	MTR1B_CHICK	0	43
CC[C@H](O)CC(=O)N[C@@H](C[C@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903743	EE	On-Demand	Anodyne	MTR1B_CHICK	0	43
CC[C@H](O)CC(=O)N[C@H](C[C@@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903744	EE	On-Demand	Anodyne	MTR1B_CHICK	0	43
CC[C@H](O)CC(=O)N[C@@H](C[C@@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903745	EE	On-Demand	Anodyne	MTR1B_CHICK	0	43
CCC(=O)CCCN1C[C@@H](C(=O)OC)[C@H](c2ccccc2)C1	ZINC000450903752	DF	On-Demand	Anodyne	SLC6A1	97	52
CCC(=O)CCCN1C[C@@H](C(=O)OC)[C@H](c2ccccc2)C1	ZINC000450903752	DF	On-Demand	Anodyne	SLC6A3	41	42
CNS(=O)(=O)NCC(=O)N[C@H](C[C@@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903772	GC	On-Demand	Anodyne	MTR1B_CHICK	0	42
CNS(=O)(=O)NCC(=O)N[C@H](C[C@@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903772	GC	On-Demand	Anodyne	HTR6	42	35
CNS(=O)(=O)NCC(=O)N[C@@H](C[C@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903774	GC	On-Demand	Anodyne	MTR1B_CHICK	0	42
CNS(=O)(=O)NCC(=O)N[C@@H](C[C@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903774	GC	On-Demand	Anodyne	HTR6	42	35
CNS(=O)(=O)NCC(=O)N[C@H](C[C@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903776	GC	On-Demand	Anodyne	MTR1B_CHICK	0	42
CNS(=O)(=O)NCC(=O)N[C@H](C[C@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903776	GC	On-Demand	Anodyne	HTR6	42	35
CNS(=O)(=O)NCC(=O)N[C@@H](C[C@@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903778	GC	On-Demand	Anodyne	MTR1B_CHICK	0	42
CNS(=O)(=O)NCC(=O)N[C@@H](C[C@@H]1CCCc2ccccc21)C(=O)OC	ZINC000450903778	GC	On-Demand	Anodyne	HTR6	42	35
COC(=O)[C@@H]1CN(Cc2cccnc2N)C[C@H]1c1ccccc1	ZINC000450903786	DE	On-Demand	Anodyne	MTAP	0	42
COC(=O)[C@@H]1CN(Cc2nc(-c3cc(C)ccn3)no2)C[C@H]1c1ccccc1	ZINC000450903789	GF	On-Demand	Anodyne	SLC6A1	26	41
CSc1ccc2ncnc(N3CCC[C@]4(CCSC4)C3)c2c1	ZINC000450903794	EI	On-Demand	Anodyne	HTT	0	40
CSc1ccc2ncnc(N3CCC[C@@]4(CCSC4)C3)c2c1	ZINC000450903796	EI	On-Demand	Anodyne	HTT	0	40
CC(C)c1ccccc1NC(=O)CN1CCC[C@H]1c1nc(=N)n(C)[nH]1	ZINC000450903799	EE	On-Demand	Anodyne	KCNQ2	67	34
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H]1c1nc(=N)n(C)[nH]1	ZINC000450903805	EE	On-Demand	Anodyne	KCNQ2	67	34
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450903806	GI	On-Demand	Anodyne	GRIN2B	19	41
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450903806	GI	On-Demand	Anodyne	CCR5	40	40
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450903806	GI	On-Demand	Anodyne	C3AR1	43	38
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450903807	GI	On-Demand	Anodyne	GRIN2B	19	41
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450903807	GI	On-Demand	Anodyne	CCR5	40	40
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450903807	GI	On-Demand	Anodyne	C3AR1	43	38
CO[C@H](Cc1ccccc1)CN1CC[C@@](C)(C(N)=O)C1	ZINC000450903814	CD	On-Demand	Anodyne	NPFFR1	43	34
CO[C@H](Cc1ccccc1)CN1CC[C@@](C)(C(N)=O)C1	ZINC000450903814	CD	On-Demand	Anodyne	SLC12A5	45	33
CO[C@@H](Cc1ccccc1)CN1CC[C@@](C)(C(N)=O)C1	ZINC000450903815	CD	On-Demand	Anodyne	NPFFR1	43	34
CO[C@@H](Cc1ccccc1)CN1CC[C@@](C)(C(N)=O)C1	ZINC000450903815	CD	On-Demand	Anodyne	SLC12A5	45	33
CO[C@@H](Cc1ccccc1)CN1CC[C@](C)(C(N)=O)C1	ZINC000450903816	CD	On-Demand	Anodyne	NPFFR1	43	34
CO[C@@H](Cc1ccccc1)CN1CC[C@](C)(C(N)=O)C1	ZINC000450903816	CD	On-Demand	Anodyne	SLC12A5	45	33
CO[C@H](Cc1ccccc1)CN1CC[C@](C)(C(N)=O)C1	ZINC000450903817	CD	On-Demand	Anodyne	NPFFR1	43	34
CO[C@H](Cc1ccccc1)CN1CC[C@](C)(C(N)=O)C1	ZINC000450903817	CD	On-Demand	Anodyne	SLC12A5	45	33
COc1ccc(CNC(=O)CCN2CC[C@@](C)(C(N)=O)C2)c(OC)c1	ZINC000450903818	EC	On-Demand	Anodyne	MTNR1A	43	34
COc1ccc(CNC(=O)CCN2CC[C@](C)(C(N)=O)C2)c(OC)c1	ZINC000450903819	EC	On-Demand	Anodyne	MTNR1A	43	34
N#Cc1ccc(SCC[C@H]2CCOC2)cc1C(F)(F)F	ZINC000450903824	DI	On-Demand	Mild	AR	38	63
Oc1nnc([C@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903830	EE	On-Demand	Anodyne	SLC6A1	50	41
Oc1nnc([C@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903830	EE	On-Demand	Anodyne	LTA4H	47	40
Oc1nnc([C@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903830	EE	On-Demand	Anodyne	HRH3	38	41
Oc1nnc([C@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903830	EE	On-Demand	Anodyne	CHRNA10	42	40
Oc1nnc([C@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903830	EE	On-Demand	Anodyne	PSMB2	47	36
Oc1nnc([C@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903830	EE	On-Demand	Anodyne	PSMB1	40	37
Oc1nnc([C@@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903831	EE	On-Demand	Anodyne	SLC6A1	50	41
Oc1nnc([C@@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903831	EE	On-Demand	Anodyne	LTA4H	47	40
Oc1nnc([C@@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903831	EE	On-Demand	Anodyne	HRH3	38	41
Oc1nnc([C@@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903831	EE	On-Demand	Anodyne	CHRNA10	42	40
Oc1nnc([C@@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903831	EE	On-Demand	Anodyne	PSMB2	47	36
Oc1nnc([C@@H]2CCCN(CCOCCOc3ccccc3)C2)o1	ZINC000450903831	EE	On-Demand	Anodyne	PSMB1	40	37
CCOC(=O)[C@@H]1CCCCN1C(=O)CN(C)c1cccc2cccnc12	ZINC000450903909	FF	On-Demand	Anodyne	COLA	51	37
CCOC(=O)[C@@H]1CCCCN1C(=O)CN(C)c1cccc2cccnc12	ZINC000450903909	FF	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCCN1C(=O)CN(C)c1cccc2cccnc12	ZINC000450903910	FF	On-Demand	Anodyne	COLA	51	37
CCOC(=O)[C@H]1CCCCN1C(=O)CN(C)c1cccc2cccnc12	ZINC000450903910	FF	On-Demand	Anodyne	FKBP12.6	0	41
c1ccc(-c2n[nH]c(CNc3nc4ccccc4nc3N3CCCC3)n2)nc1	ZINC000450903941	FG	On-Demand	Anodyne	METAP1	45	48
Cc1cc(C)n(CCN(C)c2cccc3cccnc23)n1	ZINC000450903943	CG	On-Demand	Anodyne	C0L093_TOBAC	50	36
N#Cc1ccc(CNc2ncccc2S(=O)(=O)N2CCCCC2)cc1F	ZINC000450903963	FF	On-Demand	Mild	TRPV4	45	37
CCCCN(C)C(=O)CSCCN(C)Cc1ccccc1	ZINC000450903966	DG	On-Demand	Anodyne	ACHE	19	48
O[C@@H]1CCOC[C@@H]1[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450904002	DF	On-Demand	Anodyne	HRH3	38	40
O[C@@H]1CCOC[C@H]1[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450904003	DF	On-Demand	Anodyne	HRH3	38	40
O[C@@H]1CCOC[C@@H]1[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450904004	DF	On-Demand	Anodyne	HRH3	38	40
O[C@@H]1CCOC[C@H]1[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450904005	DF	On-Demand	Anodyne	HRH3	38	40
C[C@@H](O)CN(CC1CCC(=O)CC1)[C@H](C)Cc1ccc(Cl)cc1	ZINC000450904009	EH	On-Demand	Anodyne	AVPR1A	18	42
C[C@@H](Cc1ccc(Cl)cc1)N(CC1CCC(=O)CC1)C[C@@H](C)O	ZINC000450904018	EH	On-Demand	Anodyne	AVPR1A	18	42
COC(=O)c1ccc(CN(C)CCCN2CCCC2)cc1Cl	ZINC000450904021	DG	On-Demand	Anodyne	HTR4	49	41
COC(=O)c1ccc(CN(C)CCCN2CCCC2)cc1Cl	ZINC000450904021	DG	On-Demand	Anodyne	SIGMAR1	34	60
CO[C@H](CSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C)Cc1ccccc1	ZINC000450904038	GG	On-Demand	Bother	F2RL3	49	36
CO[C@@H](CSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C)Cc1ccccc1	ZINC000450904040	GG	On-Demand	Bother	F2RL3	49	36
CO[C@@H]1CCN(CCC2=CCCCC2)[C@@H](C)C1	ZINC000450904063	BG	On-Demand	Anodyne	HRH3	0	41
CO[C@H]1CCN(CCC2=CCCCC2)[C@H](C)C1	ZINC000450904064	BG	On-Demand	Anodyne	HRH3	0	41
CO[C@@H]1CCN(CCC2=CCCCC2)[C@H](C)C1	ZINC000450904066	BG	On-Demand	Anodyne	HRH3	0	41
CO[C@H]1CCN(CCC2=CCCCC2)[C@@H](C)C1	ZINC000450904067	BG	On-Demand	Anodyne	HRH3	0	41
COc1cc2c(N3CCC(OCCOC(C)C)CC3)ncnc2cc1F	ZINC000450904068	FG	On-Demand	Anodyne	PDE3A	64	48
COc1cc2c(N3CCC(OCCOC(C)C)CC3)ncnc2cc1F	ZINC000450904068	FG	On-Demand	Anodyne	PDGFRB	68	41
COc1cc2c(N3CCC(OCCOC(C)C)CC3)ncnc2cc1F	ZINC000450904068	FG	On-Demand	Anodyne	PDE3B	94	48
Oc1nnc([C@@H]2CCCN(CC/C=C/c3ccccc3)C2)o1	ZINC000450904070	CG	On-Demand	Anodyne	SLC6A1	72	39
Oc1nnc([C@@H]2CCCN(CC/C=C\c3ccccc3)C2)o1	ZINC000450904071	CG	On-Demand	Anodyne	SLC6A1	72	39
Oc1nnc([C@H]2CCCN(CC/C=C\c3ccccc3)C2)o1	ZINC000450904072	CG	On-Demand	Anodyne	SLC6A1	72	39
Oc1nnc([C@H]2CCCN(CC/C=C/c3ccccc3)C2)o1	ZINC000450904073	CG	On-Demand	Anodyne	SLC6A1	72	39
CC(C)OCCOC1CCN(c2ccnc3ccc(OC(C)C)cc23)CC1	ZINC000450904076	FI	On-Demand	Anodyne	PDE3B	41	31
CC(=O)CCCCCn1nnc(COc2ccccc2)n1	ZINC000450904089	CE	On-Demand	Anodyne	SOAT1	23	40
Cc1cc(C)c(CNc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])cn1	ZINC000450904107	FF	On-Demand	Bother	LRRK2	21	43
N#Cc1ccc(CNc2ccc(S(=O)(=O)N3CCCCC3)cn2)cc1F	ZINC000450904112	FE	On-Demand	Mild	TRPV4	47	39
N#Cc1ccc(CNc2ccc(S(=O)(=O)N3CCCCC3)cn2)cc1F	ZINC000450904112	FE	On-Demand	Mild	NAMPT	35	41
CCN(CC)S(=O)(=O)c1ccc(NC[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450904113	FE	On-Demand	Bother	BDKRB1	24	45
CC1CCN(C(=O)c2ccc(=NCc3ccc(C#N)c(F)c3)[nH]c2)CC1	ZINC000450904114	FF	On-Demand	Mild	L3MBTL3	48	32
c1ccc(CCN(CCc2cscn2)Cc2cccnc2)nc1	ZINC000450904144	DG	On-Demand	Anodyne	NR1D1	43	35
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	DRD2	15	43
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	DRD4	53	45
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	SLC6A1	55	34
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	DRD3	23	49
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	SIGMAR1	38	42
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	CCR3	39	40
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	CCR5	29	42
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	MLNR	60	48
COC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904145	GH	On-Demand	Anodyne	MCHR1	29	45
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	DRD2	15	43
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	DRD4	53	45
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	SLC6A1	55	34
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	DRD3	23	49
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	SIGMAR1	38	42
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	CCR3	39	40
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	CCR5	29	42
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	MLNR	60	48
COC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1Cl	ZINC000450904146	GH	On-Demand	Anodyne	MCHR1	29	45
CCOC(=O)c1ccc(CN(Cc2ccc(Cl)cc2)Cc2cnn(C)c2)nc1	ZINC000450904157	GH	On-Demand	Anodyne	P2RY12	23	41
CCOC(=O)c1ccc(CN(Cc2ccc(Cl)cc2)Cc2cnn(C)c2)nc1	ZINC000450904157	GH	On-Demand	Anodyne	PLA2G7	42	36
C/C=C/C[C@@H](NC(=O)c1cc(C2CC2)[nH]n1)C(=O)OCC	ZINC000450904169	CD	On-Demand	Anodyne	P2RY12	61	38
C/C=C\C[C@H](NC(=O)c1cc(C2CC2)[nH]n1)C(=O)OCC	ZINC000450904170	CD	On-Demand	Anodyne	P2RY12	61	38
C/C=C/C[C@H](NC(=O)c1cc(C2CC2)[nH]n1)C(=O)OCC	ZINC000450904171	CD	On-Demand	Anodyne	P2RY12	61	38
C/C=C\C[C@@H](NC(=O)c1cc(C2CC2)[nH]n1)C(=O)OCC	ZINC000450904172	CD	On-Demand	Anodyne	P2RY12	61	38
Cc1cccc([N+](=O)[O-])c1NCc1cnc(C2CC2)o1	ZINC000450904188	CG	On-Demand	Bother	PRKCQ	40	39
COC(=O)c1cn(CC/C=C\c2ccccc2)c(C)n1	ZINC000450904189	CG	On-Demand	Anodyne	CACNA1B	45	37
COC(=O)c1cn(CC/C=C/c2ccccc2)c(C)n1	ZINC000450904190	CG	On-Demand	Anodyne	CACNA1B	45	37
O=c1cc(C2CCC2)ncn1CCc1ccc(Cl)cc1	ZINC000450904195	CG	On-Demand	Anodyne	CACNA1D	36	40
O=c1cc(C2CCC2)ncn1CCc1ccc(Cl)cc1	ZINC000450904195	CG	On-Demand	Anodyne	DNAE	46	30
COc1cc(N2CCN(C(=O)c3c(C)cccc3Cl)CC2)ncn1	ZINC000450904196	EE	On-Demand	Anodyne	DRD4	42	33
COc1cc(N2CCN(C(=O)c3c(C)cccc3Cl)CC2)ncn1	ZINC000450904196	EE	On-Demand	Anodyne	ALS	71	41
CC1=CCCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450904204	BF	On-Demand	Anodyne	CHRNA6	0	43
CC1=CCCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450904205	BF	On-Demand	Anodyne	CHRNA6	0	43
CC1=CCCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450904206	BF	On-Demand	Anodyne	CHRNA6	0	43
CC1=CCCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450904207	BF	On-Demand	Anodyne	CHRNA6	0	43
C/C=C/C[C@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OCC	ZINC000450904209	DE	On-Demand	Anodyne	P2RY12	41	33
C/C=C\C[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OCC	ZINC000450904210	DE	On-Demand	Anodyne	P2RY12	41	33
C/C=C/C[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OCC	ZINC000450904211	DE	On-Demand	Anodyne	P2RY12	41	33
C/C=C\C[C@H](NC(=O)c1cc(C)n(C(C)C)n1)C(=O)OCC	ZINC000450904212	DE	On-Demand	Anodyne	P2RY12	41	33
Cc1ccn2ncc(C(=O)NC[C@@H]3C[C@H](F)CN3Cc3c(C)noc3C)c2c1	ZINC000450904220	GF	On-Demand	Anodyne	EPHB3	27	41
N=c1[nH]c(N2CCC(Cc3cc(F)ccc3F)CC2)ncc1[N+](=O)[O-]	ZINC000450904237	EF	On-Demand	Bother	PRKCQ	27	46
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	SLC6A1	60	56
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	SLC6A4	17	44
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	SLC6A3	35	47
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	MC4R	16	41
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	SIGMAR1	30	40
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	MMP13	43	44
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	CCR5	27	43
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	ADAM17	32	43
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	MMP3	34	44
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	MMP9	39	44
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	MMP1	36	44
CCS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)cc1	ZINC000450904238	GF	On-Demand	Anodyne	RORC	42	35
COCCOCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450904251	CD	On-Demand	Anodyne	PDE5A	43	34
COCCOCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450904251	CD	On-Demand	Anodyne	GSG2	40	36
COc1ccc2ncc(=O)n(CCCCOC(C)(C)C)c2c1	ZINC000450904264	DG	On-Demand	Anodyne	GSG2	43	38
CS(=O)(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nc1	ZINC000450904267	FG	On-Demand	Anodyne	GPR119	24	50
CO[C@@H](Cc1ccccc1)CN1CCN(c2cnccc2C)CC1	ZINC000450904283	EF	On-Demand	Anodyne	ABCB1	42	41
CO[C@H](Cc1ccccc1)CN1CCN(c2cnccc2C)CC1	ZINC000450904284	EF	On-Demand	Anodyne	ABCB1	42	41
CC(=O)CCCCCOc1ccc(C(C)=O)cc1Cl	ZINC000450904302	CI	On-Demand	Anodyne	THRA	42	41
CC(=O)CCCCCOc1ccc(C(C)=O)cc1Cl	ZINC000450904302	CI	On-Demand	Anodyne	THRB	37	41
CC(=O)CCCCCOc1ccc(C(C)=O)cc1Cl	ZINC000450904302	CI	On-Demand	Anodyne	GRM2	15	42
CC(=O)CCCCCOc1ccc(C(C)=O)cc1Cl	ZINC000450904302	CI	On-Demand	Anodyne	PLA2G4B	40	33
CC/C=C\CCn1c(=O)cnc2ccc(OC)cc21	ZINC000450904322	CF	On-Demand	Anodyne	GSG2	40	35
CC/C=C/CCn1c(=O)cnc2ccc(OC)cc21	ZINC000450904323	CF	On-Demand	Anodyne	GSG2	40	35
Cc1ccc(C(=O)N2CCC[C@H](N(C)Cc3ccccn3)CC2)c2c1CCC2	ZINC000450904330	GI	On-Demand	Anodyne	L3MBTL3	43	36
Cc1ccc(C(=O)N2CCC[C@@H](N(C)Cc3ccccn3)CC2)c2c1CCC2	ZINC000450904331	GI	On-Demand	Anodyne	L3MBTL3	43	36
COc1ccc2ncc(=O)n(CC(=O)N[C@H]3CCCc4ccccc43)c2c1	ZINC000450904382	FF	On-Demand	Anodyne	MTR1B_CHICK	0	41
COc1ccc2ncc(=O)n(CC(=O)N[C@@H]3CCCc4ccccc43)c2c1	ZINC000450904383	FF	On-Demand	Anodyne	MTR1B_CHICK	0	41
Cn1[nH]c([C@@H]2CCCN2CCOc2ccc(Oc3ccccc3)cc2)nc1=N	ZINC000450904384	GG	On-Demand	Anodyne	LTA4H	74	44
Cn1[nH]c([C@@H]2CCCN2CCOc2ccc(Oc3ccccc3)cc2)nc1=N	ZINC000450904384	GG	On-Demand	Anodyne	COLA	59	35
Cn1[nH]c([C@@H]2CCCN2CCOc2ccc(Oc3ccccc3)cc2)nc1=N	ZINC000450904384	GG	On-Demand	Anodyne	CPT1A	57	35
Cn1[nH]c([C@H]2CCCN2CCOc2ccc(Oc3ccccc3)cc2)nc1=N	ZINC000450904386	GG	On-Demand	Anodyne	LTA4H	74	44
Cn1[nH]c([C@H]2CCCN2CCOc2ccc(Oc3ccccc3)cc2)nc1=N	ZINC000450904386	GG	On-Demand	Anodyne	COLA	59	35
Cn1[nH]c([C@H]2CCCN2CCOc2ccc(Oc3ccccc3)cc2)nc1=N	ZINC000450904386	GG	On-Demand	Anodyne	CPT1A	57	35
CCCCN(CC)C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450904387	DE	On-Demand	Anodyne	TSPO	21	40
N#Cc1ccc(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)cc1F	ZINC000450904399	GD	On-Demand	Mild	TRPV4	46	38
N#Cc1ccc(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)cc1F	ZINC000450904399	GD	On-Demand	Mild	MAP3K8	55	37
N#Cc1ccc(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)cc1F	ZINC000450904399	GD	On-Demand	Mild	MERTK	26	40
N#Cc1ccc(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)cc1F	ZINC000450904399	GD	On-Demand	Mild	NAMPT	35	42
CCCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nc1	ZINC000450904423	EH	On-Demand	Anodyne	SSTR5	40	39
CCCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nc1	ZINC000450904425	EH	On-Demand	Anodyne	SSTR5	40	39
COc1ccc2ncc(=O)n(CC(=O)N[C@H]3CCOc4ccccc43)c2c1	ZINC000450904448	FE	On-Demand	Anodyne	LUXR	54	36
COc1ccc2ncc(=O)n(CC(=O)N[C@H]3CCOc4ccccc43)c2c1	ZINC000450904448	FE	On-Demand	Anodyne	TRAR	65	37
COc1ccc2ncc(=O)n(CC(=O)N[C@@H]3CCOc4ccccc43)c2c1	ZINC000450904449	FE	On-Demand	Anodyne	LUXR	54	36
COc1ccc2ncc(=O)n(CC(=O)N[C@@H]3CCOc4ccccc43)c2c1	ZINC000450904449	FE	On-Demand	Anodyne	TRAR	65	37
COc1ccc(=O)n(CCCCc2ccc(Cl)c(Cl)c2)n1	ZINC000450904461	EH	On-Demand	Anodyne	DNAE	65	34
Cc1cc(C)c(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)cn1	ZINC000450904469	EH	On-Demand	Anodyne	BDKRB1	24	44
Cc1cc(C)c(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)cn1	ZINC000450904469	EH	On-Demand	Anodyne	L3MBTL3	55	37
Cc1cc(C)c(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)cn1	ZINC000450904469	EH	On-Demand	Anodyne	TRPC6	41	35
CN(CC(=O)N1CCC(OCc2ccccc2)CC1)c1cccc2cccnc12	ZINC000450904475	GH	On-Demand	Anodyne	GRIN2B	33	41
Cc1cc(F)ccc1[C@@H]1CCCN1c1cc(N2CCSCC2)ncn1	ZINC000450904482	FH	On-Demand	Anodyne	PRCP	46	40
Cc1cc(F)ccc1[C@H]1CCCN1c1cc(N2CCSCC2)ncn1	ZINC000450904485	FH	On-Demand	Anodyne	PRCP	46	40
COC(=O)CCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450904486	DC	On-Demand	Anodyne	P2RY12	0	40
COC(=O)CCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450904486	DC	On-Demand	Anodyne	MTNR1A	52	42
COC(=O)CCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450904486	DC	On-Demand	Anodyne	MTNR1B	32	42
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)N[C@@H]2C)c(OC)c1	ZINC000450904512	EC	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)N[C@@H]2C)c(OC)c1	ZINC000450904512	EC	On-Demand	Anodyne	MTNR1A	43	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)N[C@@H]2C)c(OC)c1	ZINC000450904515	EC	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)N[C@@H]2C)c(OC)c1	ZINC000450904515	EC	On-Demand	Anodyne	MTNR1A	43	37
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)N[C@H]2C)c(OC)c1	ZINC000450904517	EC	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)N[C@H]2C)c(OC)c1	ZINC000450904517	EC	On-Demand	Anodyne	MTNR1A	43	37
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)N[C@H]2C)c(OC)c1	ZINC000450904519	EC	On-Demand	Anodyne	NQO2	32	40
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)N[C@H]2C)c(OC)c1	ZINC000450904519	EC	On-Demand	Anodyne	MTNR1A	43	37
C=C(CC)CNc1ncnc2c1ncn2C1CC1	ZINC000450904525	BF	On-Demand	Mild	ADORA1	44	43
C=C(CC)CNc1ncnc2c1ncn2C1CC1	ZINC000450904525	BF	On-Demand	Mild	ADORA2A	29	47
C=C(CC)CNc1ncnc2c1ncn2C1CC1	ZINC000450904525	BF	On-Demand	Mild	P2RY1	36	40
C=C(CC)CNc1ncnc2c1ncn2C1CC1	ZINC000450904525	BF	On-Demand	Mild	ADCY5	27	41
C=C(CC)CNc1ncnc2c1ncn2C1CC1	ZINC000450904525	BF	On-Demand	Mild	ADORA3	77	39
Cc1cc(C)c(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cn1	ZINC000450904529	EG	On-Demand	Bother	MAPK11	33	42
Cc1cc(C)c(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cn1	ZINC000450904529	EG	On-Demand	Bother	MAPK14	46	42
Cc1cc(C)c(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cn1	ZINC000450904529	EG	On-Demand	Bother	MAPK13	40	35
CNS(=O)(=O)c1ccc(NCc2cnc(C3CC3)o2)c([N+](=O)[O-])c1	ZINC000450904555	FD	On-Demand	Bother	PRKCQ	42	33
CN(CCN1C[C@@H](O)C[C@H]1c1cccc(F)c1)Cc1ccccc1	ZINC000450904562	EG	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1C[C@@H](O)C[C@H]1c1cccc(F)c1)Cc1ccccc1	ZINC000450904562	EG	On-Demand	Anodyne	CCR5	48	34
COc1cccc(OCCC(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c1	ZINC000450904563	FD	On-Demand	Anodyne	MTNR1A	41	44
COc1cccc(OCCC(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c1	ZINC000450904563	FD	On-Demand	Anodyne	MTNR1B	40	44
CN(CCN1C[C@H](O)C[C@H]1c1cccc(F)c1)Cc1ccccc1	ZINC000450904564	EG	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1C[C@H](O)C[C@H]1c1cccc(F)c1)Cc1ccccc1	ZINC000450904564	EG	On-Demand	Anodyne	CCR5	48	34
CN(CCN1C[C@@H](O)C[C@@H]1c1cccc(F)c1)Cc1ccccc1	ZINC000450904566	EG	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1C[C@@H](O)C[C@@H]1c1cccc(F)c1)Cc1ccccc1	ZINC000450904566	EG	On-Demand	Anodyne	CCR5	48	34
CN(CCN1C[C@H](O)C[C@@H]1c1cccc(F)c1)Cc1ccccc1	ZINC000450904568	EG	On-Demand	Anodyne	SIGMAR1	15	40
CN(CCN1C[C@H](O)C[C@@H]1c1cccc(F)c1)Cc1ccccc1	ZINC000450904568	EG	On-Demand	Anodyne	CCR5	48	34
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450904571	FD	On-Demand	Anodyne	OXTR	25	42
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450904571	FD	On-Demand	Anodyne	AVPR1A	0	42
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450904572	FD	On-Demand	Anodyne	OXTR	25	42
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450904572	FD	On-Demand	Anodyne	AVPR1A	0	42
CSc1cccc(C(=O)Nc2cccc(S(=O)(=O)NCCN(C)C)c2)c1	ZINC000450904579	GF	On-Demand	Anodyne	KCNK3	97	39
CSc1cccc(C(=O)Nc2cccc(S(=O)(=O)NCCN(C)C)c2)c1	ZINC000450904579	GF	On-Demand	Anodyne	KCNK9	49	39
COc1cccc(OCCC(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)c1	ZINC000450904582	FD	On-Demand	Anodyne	MTNR1A	41	44
COc1cccc(OCCC(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)c1	ZINC000450904582	FD	On-Demand	Anodyne	MTNR1B	40	44
COc1cccc(OCCC(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c1	ZINC000450904584	FD	On-Demand	Anodyne	MTNR1A	41	44
COc1cccc(OCCC(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c1	ZINC000450904584	FD	On-Demand	Anodyne	MTNR1B	40	44
COc1cccc(OCCC(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)c1	ZINC000450904586	FD	On-Demand	Anodyne	MTNR1A	41	44
COc1cccc(OCCC(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)c1	ZINC000450904586	FD	On-Demand	Anodyne	MTNR1B	40	44
CC(C)[C@@H](NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450904597	FE	On-Demand	Anodyne	PRCP	18	42
CC(C)[C@@H](NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450904597	FE	On-Demand	Anodyne	BIRC2	45	37
CC(C)[C@@H](NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450904599	FE	On-Demand	Anodyne	PRCP	18	42
CC(C)[C@@H](NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450904599	FE	On-Demand	Anodyne	BIRC2	45	37
CC(C)[C@H](NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450904602	FE	On-Demand	Anodyne	PRCP	18	42
CC(C)[C@H](NC(=O)CN1CCC[C@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450904602	FE	On-Demand	Anodyne	BIRC2	45	37
CC(C)[C@H](NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450904604	FE	On-Demand	Anodyne	PRCP	18	42
CC(C)[C@H](NC(=O)CN1CCC[C@@H](c2nnc(O)o2)C1)c1ccccc1	ZINC000450904604	FE	On-Demand	Anodyne	BIRC2	45	37
CS(=O)(=O)c1ccc(NC2(Cc3ccccc3)CCOCC2)c([N+](=O)[O-])c1	ZINC000450904620	GG	On-Demand	Bother	BCL2L1	46	37
C=CCC[C@@H](CO)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450904621	CF	On-Demand	Mild	FGFR1	0	41
C=CCC[C@H](CO)Nc1ncnc2cc(F)c(OC)cc12	ZINC000450904623	CF	On-Demand	Mild	FGFR1	0	41
C/C=C\C[C@H](NC(=O)c1ccn(CCc2ccccc2)n1)C(=O)OCC	ZINC000450904638	FF	On-Demand	Anodyne	P2RY12	72	36
C/C=C\C[C@@H](NC(=O)c1ccn(CCc2ccccc2)n1)C(=O)OCC	ZINC000450904640	FF	On-Demand	Anodyne	P2RY12	72	36
C/C=C/C[C@@H](NC(=O)c1ccn(CCc2ccccc2)n1)C(=O)OCC	ZINC000450904642	FF	On-Demand	Anodyne	P2RY12	72	36
C/C=C/C[C@H](NC(=O)c1ccn(CCc2ccccc2)n1)C(=O)OCC	ZINC000450904643	FF	On-Demand	Anodyne	P2RY12	72	36
Fc1cccc(CC2CCN(c3ncnc4[nH]cnc34)CC2)c1F	ZINC000450904653	EG	On-Demand	Anodyne	AKT2	28	50
Fc1cccc(CC2CCN(c3ncnc4[nH]cnc34)CC2)c1F	ZINC000450904653	EG	On-Demand	Anodyne	AKT1	0	40
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450904660	GG	On-Demand	Anodyne	TMPRSS11D	45	33
COC(=O)[C@@H]1CN(CCc2cscn2)C[C@H]1c1ccccc1	ZINC000450904661	DF	On-Demand	Anodyne	SLC6A1	59	49
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450904663	GG	On-Demand	Anodyne	TMPRSS11D	45	33
O=C(NCc1ccccc1)[C@@H](c1ccccc1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450904666	GG	On-Demand	Anodyne	TMPRSS11D	45	33
O=C(NCc1ccccc1)[C@@H](c1ccccc1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450904671	GG	On-Demand	Anodyne	TMPRSS11D	45	33
CC(C)CCNS(=O)(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450904676	DE	On-Demand	Anodyne	MMP13	22	46
CC(C)CCNS(=O)(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450904676	DE	On-Demand	Anodyne	ADAMTS4	41	34
CC(C)CCNS(=O)(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450904676	DE	On-Demand	Anodyne	O69638_MYCTO	0	43
CC(C)CCNS(=O)(=O)c1ccc(OCC[C@H](C)O)cc1	ZINC000450904679	DE	On-Demand	Anodyne	MMP13	22	46
CC(C)CCNS(=O)(=O)c1ccc(OCC[C@H](C)O)cc1	ZINC000450904679	DE	On-Demand	Anodyne	ADAMTS4	41	34
CC(C)CCNS(=O)(=O)c1ccc(OCC[C@H](C)O)cc1	ZINC000450904679	DE	On-Demand	Anodyne	O69638_MYCTO	0	43
C[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C1CCCC1	ZINC000450904690	EH	On-Demand	Bother	L3MBTL1	0	43
C[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C1CCCC1	ZINC000450904690	EH	On-Demand	Bother	L3MBTL3	34	43
CN(CC(=O)OC(C)(C)C)[C@H]1CN(C[C@H](O)Cc2ccccc2)C[C@H]1O	ZINC000450904712	FC	On-Demand	Anodyne	POL	0	42
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cnn(C)c1	ZINC000450904715	FD	On-Demand	Anodyne	ITGA4	43	33
CCc1c(C(=O)NC[C@@H]2C[C@H](F)CN2Cc2nccn2C)oc2ccccc12	ZINC000450904718	GG	On-Demand	Anodyne	INHA	48	31
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cnn(C)c1	ZINC000450904719	FD	On-Demand	Anodyne	ITGA4	43	33
CN(CC(=O)OC(C)(C)C)[C@@H]1CN(C[C@H](O)Cc2ccccc2)C[C@H]1O	ZINC000450904724	FC	On-Demand	Anodyne	POL	0	42
CC(C)OCCOC1CCN(c2ncnc3sc4c(c23)CCCC4)CC1	ZINC000450904746	GH	On-Demand	Anodyne	RBP4	17	42
CCCC[C@H](NC(=O)C[C@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904759	CE	On-Demand	Anodyne	CTSK	33	51
CCCC[C@H](NC(=O)C[C@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904759	CE	On-Demand	Anodyne	PGA5	41	38
CCCC[C@H](NC(=O)C[C@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904759	CE	On-Demand	Anodyne	NOD1	85	36
CCCC[C@@H](NC(=O)C[C@@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904761	CE	On-Demand	Anodyne	CTSK	33	51
CCCC[C@@H](NC(=O)C[C@@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904761	CE	On-Demand	Anodyne	PGA5	41	38
CCCC[C@@H](NC(=O)C[C@@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904761	CE	On-Demand	Anodyne	NOD1	85	36
CCCC[C@H](NC(=O)C[C@@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904762	CE	On-Demand	Anodyne	CTSK	33	51
CCCC[C@H](NC(=O)C[C@@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904762	CE	On-Demand	Anodyne	PGA5	41	38
CCCC[C@H](NC(=O)C[C@@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904762	CE	On-Demand	Anodyne	NOD1	85	36
CCCC[C@@H](NC(=O)C[C@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904764	CE	On-Demand	Anodyne	CTSK	33	51
CCCC[C@@H](NC(=O)C[C@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904764	CE	On-Demand	Anodyne	PGA5	41	38
CCCC[C@@H](NC(=O)C[C@H](O)CC)C(=O)OC(C)(C)C	ZINC000450904764	CE	On-Demand	Anodyne	NOD1	85	36
COc1ccc2c(N3CCC(OCCOC(C)C)CC3)c([N+](=O)[O-])cnc2c1	ZINC000450904813	GH	On-Demand	Bother	PDE3B	49	33
Cc1ccnc(N2CCC(Cc3c(F)cccc3F)CC2)n1	ZINC000450904826	DH	On-Demand	Anodyne	SORD	19	40
C[C@H](CN1CCC(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450904833	FG	On-Demand	Anodyne	VACHT_TETCF	0	50
C[C@H](CN1CCC(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450904833	FG	On-Demand	Anodyne	SLC18A3	19	42
C[C@@H](CN1CCC(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450904834	FG	On-Demand	Anodyne	VACHT_TETCF	0	50
C[C@@H](CN1CCC(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450904834	FG	On-Demand	Anodyne	SLC18A3	19	42
CNC(=O)c1cccnc1N1CCC(Cc2c(F)cccc2F)CC1	ZINC000450904839	EG	On-Demand	Anodyne	SIRT3	41	33
CNC(=O)c1cccnc1N1CCC(Cc2c(F)cccc2F)CC1	ZINC000450904839	EG	On-Demand	Anodyne	SIRT1	41	33
Cc1cc(N2CCC(Cc3cc(F)ccc3F)CC2)ncn1	ZINC000450904846	DH	On-Demand	Anodyne	PDE3B	48	32
Cn1ncc2c(N3CCC(Cc4cc(F)ccc4F)CC3)ncnc21	ZINC000450904861	EG	On-Demand	Anodyne	ABCC1	42	33
Cn1ncc2c(N3CCC(Cc4cc(F)ccc4F)CC3)ncnc21	ZINC000450904861	EG	On-Demand	Anodyne	HTT	0	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(SC)cc2)c(OC)c1	ZINC000450904863	GH	On-Demand	Anodyne	MTNR1A	53	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc(SC)cc2)c(OC)c1	ZINC000450904863	GH	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc2ncc(=O)n(C[C@H]3CCc4ccccc4C3)c2c1	ZINC000450904867	DG	On-Demand	Anodyne	PTGIR	37	42
COc1ccc2ncc(=O)n(C[C@@H]3CCc4ccccc4C3)c2c1	ZINC000450904868	DG	On-Demand	Anodyne	PTGIR	37	42
Cc1ccc(C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)c2c1CCC2	ZINC000450904871	FG	On-Demand	Anodyne	NPY2R	46	35
Cc1ccc(C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)c2c1CCC2	ZINC000450904871	FG	On-Demand	Anodyne	C3AR1	40	37
Cc1ccc(C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)c2c1CCC2	ZINC000450904872	FG	On-Demand	Anodyne	NPY2R	46	35
Cc1ccc(C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)c2c1CCC2	ZINC000450904872	FG	On-Demand	Anodyne	C3AR1	40	37
COCCOC[C@@H](O)CN1CCN(c2cnccc2C)CC1	ZINC000450904878	DC	On-Demand	Anodyne	ABCB1	51	40
COCCOC[C@@H](O)CN1CCN(c2cnccc2C)CC1	ZINC000450904878	DC	On-Demand	Anodyne	HSP90AB1	46	53
COCCOC[C@H](O)CN1CCN(c2cnccc2C)CC1	ZINC000450904879	DC	On-Demand	Anodyne	ABCB1	51	40
COCCOC[C@H](O)CN1CCN(c2cnccc2C)CC1	ZINC000450904879	DC	On-Demand	Anodyne	HSP90AB1	46	53
NC(=O)c1cc(N2CCC(Cc3cccc(F)c3F)CC2)ccn1	ZINC000450904886	EF	On-Demand	Anodyne	STAT6	37	41
Brc1cccc(C2CCN(C[C@@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450904897	FI	On-Demand	Anodyne	VACHT_TETCF	0	41
Brc1cccc(C2CCN(C[C@H]3C[C@H]4CC[C@H]3O4)CC2)c1	ZINC000450904898	FI	On-Demand	Anodyne	VACHT_TETCF	0	41
CN1CCN(S(=O)(=O)c2ccc(NCc3ccc(C#N)c(F)c3)nc2)CC1	ZINC000450904968	GD	On-Demand	Mild	TRPV4	46	38
CN1CCN(S(=O)(=O)c2ccc(NCc3ccc(C#N)c(F)c3)nc2)CC1	ZINC000450904968	GD	On-Demand	Mild	GCK	51	32
CN1CCN(S(=O)(=O)c2ccc(NCc3ccc(C#N)c(F)c3)nc2)CC1	ZINC000450904968	GD	On-Demand	Mild	GCKR	74	31
CN1CCN(S(=O)(=O)c2ccc(NCc3ccc(C#N)c(F)c3)nc2)CC1	ZINC000450904968	GD	On-Demand	Mild	NAMPT	29	40
COc1cc(N2CCN(C(=O)c3nc4ccccc4nc3C3CC3)CC2)ncn1	ZINC000450904981	GE	On-Demand	Anodyne	CCKAR	37	41
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCCO	ZINC000450905040	BD	On-Demand	Anodyne	AOC3	21	40
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCCO	ZINC000450905042	BD	On-Demand	Anodyne	AOC3	21	40
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCCO	ZINC000450905043	BD	On-Demand	Anodyne	AOC3	21	40
C[C@H](c1ccccc1)[C@H](O)CN(C)CCCO	ZINC000450905046	BD	On-Demand	Anodyne	AOC3	21	40
CCCOc1cccc(Cn2[nH]c(SC)nc2=O)c1	ZINC000450905060	CE	On-Demand	Anodyne	UPP1	45	39
CCc1cc(O)nc(SCc2ccc(S(=O)(=O)CC)cc2)n1	ZINC000450905077	EF	On-Demand	Anodyne	CA13	17	45
O=[N+]([O-])c1ccccc1NCc1cnc(C2CC2)o1	ZINC000450905098	CG	On-Demand	Bother	PRKCQ	0	40
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccc(C(C)C)cc3)c2c1	ZINC000450905138	GF	On-Demand	Anodyne	MTNR1A	55	42
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccc(C(C)C)cc3)c2c1	ZINC000450905138	GF	On-Demand	Anodyne	MTNR1B	46	42
COC(=O)c1ccc(CN2CCN(c3nccnc3C)CC2)cc1Cl	ZINC000450905143	FF	On-Demand	Anodyne	P2RY12	31	40
Cc1nnc2c3ccccc3c(N3CCC[C@@H]3c3ccc(F)cc3F)nn12	ZINC000450905151	FI	On-Demand	Anodyne	CREBBP	46	36
Cc1nnc2c3ccccc3c(N3CCC[C@@H]3c3ccc(F)cc3F)nn12	ZINC000450905151	FI	On-Demand	Anodyne	BRD9	57	36
Cc1nnc2c3ccccc3c(N3CCC[C@H]3c3ccc(F)cc3F)nn12	ZINC000450905152	FI	On-Demand	Anodyne	CREBBP	46	36
Cc1nnc2c3ccccc3c(N3CCC[C@H]3c3ccc(F)cc3F)nn12	ZINC000450905152	FI	On-Demand	Anodyne	BRD9	57	36
COc1ccc2ncc(=O)n(CC(=O)NCCCC3CCCCC3)c2c1	ZINC000450905163	FF	On-Demand	Anodyne	AVPR1B	47	38
COc1ccc2ncc(=O)n(CC(=O)NCCCC3CCCCC3)c2c1	ZINC000450905163	FF	On-Demand	Anodyne	NQO2	40	39
Cc1cc(F)ccc1[C@@H]1CCCN1c1cc(N2CCOCC2)ncn1	ZINC000450905183	EG	On-Demand	Anodyne	PRCP	47	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCCCc1ccccc1	ZINC000450905184	ED	On-Demand	Anodyne	PREP	50	34
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCCCc1ccccc1	ZINC000450905185	ED	On-Demand	Anodyne	PREP	50	34
Cc1cc(F)ccc1[C@H]1CCCN1c1cc(N2CCOCC2)ncn1	ZINC000450905188	EG	On-Demand	Anodyne	PRCP	47	40
CN(CCCF)c1cccc2cccnc12	ZINC000450905191	BG	On-Demand	Anodyne	CCR1	15	40
CN(C[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc2cccnc12	ZINC000450905213	EH	On-Demand	Anodyne	SMO	17	43
COCCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nc1	ZINC000450905214	FG	On-Demand	Anodyne	ACKR3	47	34
COCCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nc1	ZINC000450905215	FG	On-Demand	Anodyne	ACKR3	47	34
CN(C[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc2cccnc12	ZINC000450905219	EH	On-Demand	Anodyne	SMO	17	43
COc1ccc2nc(C)nc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450905236	FG	On-Demand	Anodyne	PDE3A	44	38
COc1ccc2nc(C)nc(N3CCC(OCCOC(C)C)CC3)c2c1	ZINC000450905236	FG	On-Demand	Anodyne	PDE3B	65	38
CC(C)OCCOC1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000450905243	FI	On-Demand	Anodyne	LIPG	42	35
CC[C@@]1(C2CC2)NC(=O)N(CC(=O)Nc2ccsc2C(=O)OC)C1=O	ZINC000450905253	FD	On-Demand	Anodyne	FAS	37	44
CC[C@]1(C2CC2)NC(=O)N(CC(=O)Nc2ccsc2C(=O)OC)C1=O	ZINC000450905254	FD	On-Demand	Anodyne	FAS	37	44
O=C1CCC(CN2CCC(F)(c3ccccc3OC(F)(F)F)CC2)CC1	ZINC000450905257	FJ	On-Demand	Anodyne	SIGMAR1	15	43
COc1ccc2ncc(=O)n(CC(=O)N[C@H](C)Cc3c(F)cccc3F)c2c1	ZINC000450905259	GE	On-Demand	Anodyne	AVPR1B	47	38
COc1ccc2ncc(=O)n(CC(=O)N[C@H](C)Cc3c(F)cccc3F)c2c1	ZINC000450905259	GE	On-Demand	Anodyne	CTRA_BOVIN	42	39
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](C)Cc3c(F)cccc3F)c2c1	ZINC000450905260	GE	On-Demand	Anodyne	AVPR1B	47	38
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](C)Cc3c(F)cccc3F)c2c1	ZINC000450905260	GE	On-Demand	Anodyne	CTRA_BOVIN	42	39
COC(=O)c1cccc(CN(C)CCCN2CCCC2)c1Cl	ZINC000450905261	DG	On-Demand	Anodyne	SIGMAR1	19	43
Cn1[nH]c([C@H]2CCCN2CCOc2cccc(F)c2)nc1=N	ZINC000450905279	DD	On-Demand	Anodyne	CHRNA10	59	46
CCC[C@H](CC(C)C)C(=O)N[C@H](CC(F)(F)F)C(=O)OC	ZINC000450905284	DG	On-Demand	Anodyne	NPR	26	52
Cn1[nH]c([C@@H]2CCCN2CCOc2cccc(F)c2)nc1=N	ZINC000450905286	DD	On-Demand	Anodyne	CHRNA10	59	46
CCC[C@H](CC(C)C)C(=O)N[C@@H](CC(F)(F)F)C(=O)OC	ZINC000450905287	DG	On-Demand	Anodyne	NPR	26	52
CCC[C@@H](CC(C)C)C(=O)N[C@@H](CC(F)(F)F)C(=O)OC	ZINC000450905289	DG	On-Demand	Anodyne	NPR	26	52
CCC[C@@H](CC(C)C)C(=O)N[C@H](CC(F)(F)F)C(=O)OC	ZINC000450905292	DG	On-Demand	Anodyne	NPR	26	52
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	DRD2	17	43
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	DRD4	45	34
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	ACHE	18	42
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	OPRD1	23	42
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	OPRK1	15	46
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	SIGMAR1	50	46
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	MMP13	15	45
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	NPFFR2	19	43
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	ADAM17	24	45
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	TACR3	27	43
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	MCHR1	31	41
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	MCHR2	50	32
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	CCR8	37	42
COc1cccc(C2(F)CCN(Cc3ccc(C(C)=O)cc3)CC2)c1	ZINC000450905294	EI	On-Demand	Anodyne	NPFFR1	33	43
Cc1cccc(OCCCNC(=O)CN2CCC[C@H]2c2nc(=N)n(C)[nH]2)c1	ZINC000450905297	FD	On-Demand	Anodyne	HRH2	48	37
Cc1cccc(OCCCNC(=O)CN2CCC[C@@H]2c2nc(=N)n(C)[nH]2)c1	ZINC000450905298	FD	On-Demand	Anodyne	HRH2	48	37
CC(C)OCCOC1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1	ZINC000450905314	GG	On-Demand	Anodyne	PDE3B	50	34
CC(C)OCCOC1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1	ZINC000450905314	GG	On-Demand	Anodyne	GPR119	18	41
CN(CCN1CCC[C@H]2C(=O)NC[C@H]21)Cc1ccccc1	ZINC000450905318	CD	On-Demand	Anodyne	GHRL	59	32
Oc1nnc([C@@H]2CCCN(CCOc3cccc(F)c3)C2)o1	ZINC000450905348	DE	On-Demand	Anodyne	ESR1	45	37
Oc1nnc([C@@H]2CCCN(CCOc3cccc(F)c3)C2)o1	ZINC000450905348	DE	On-Demand	Anodyne	CHRNA10	63	49
Oc1nnc([C@@H]2CCCN(CCOc3cccc(F)c3)C2)o1	ZINC000450905348	DE	On-Demand	Anodyne	PSMB2	42	31
Oc1nnc([C@H]2CCCN(CCOc3cccc(F)c3)C2)o1	ZINC000450905350	DE	On-Demand	Anodyne	ESR1	45	37
Oc1nnc([C@H]2CCCN(CCOc3cccc(F)c3)C2)o1	ZINC000450905350	DE	On-Demand	Anodyne	CHRNA10	63	49
Oc1nnc([C@H]2CCCN(CCOc3cccc(F)c3)C2)o1	ZINC000450905350	DE	On-Demand	Anodyne	PSMB2	42	31
CCn1cc(C(=O)N2CCOC[C@H]2c2cccn2C)c2ccccc21	ZINC000450905352	EG	On-Demand	Anodyne	CNR1	29	47
CCn1cc(C(=O)N2CCOC[C@H]2c2cccn2C)c2ccccc21	ZINC000450905352	EG	On-Demand	Anodyne	CNR2	32	42
CCn1cc(C(=O)N2CCOC[C@H]2c2cccn2C)c2ccccc21	ZINC000450905352	EG	On-Demand	Anodyne	PTGDS	35	41
CCn1cc(C(=O)N2CCOC[C@H]2c2cccn2C)c2ccccc21	ZINC000450905352	EG	On-Demand	Anodyne	TPSAB1	22	42
CCn1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)c2ccccc21	ZINC000450905355	EG	On-Demand	Anodyne	CNR1	29	47
CCn1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)c2ccccc21	ZINC000450905355	EG	On-Demand	Anodyne	CNR2	32	42
CCn1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)c2ccccc21	ZINC000450905355	EG	On-Demand	Anodyne	PTGDS	35	41
CCn1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)c2ccccc21	ZINC000450905355	EG	On-Demand	Anodyne	TPSAB1	22	42
Cc1ccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c(C(C)C)n1	ZINC000450905359	GF	On-Demand	Anodyne	CDK1	20	42
Cc1ccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c(C(C)C)n1	ZINC000450905359	GF	On-Demand	Anodyne	CDK4	22	42
Cc1ccc(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)c(C(C)C)n1	ZINC000450905359	GF	On-Demand	Anodyne	CALCA	0	44
CCCOc1cccc(Cn2cnc(=O)c3cc(OC)ccc32)c1	ZINC000450905376	DG	On-Demand	Anodyne	PLA2G2A	49	40
CCCOc1cccc(Cn2cnc(=O)c3cc(OC)ccc32)c1	ZINC000450905376	DG	On-Demand	Anodyne	UPP1	44	40
CCCOc1cccc(Cn2cnc(=O)c3cc(OC)ccc32)c1	ZINC000450905376	DG	On-Demand	Anodyne	NR1I2	40	34
CC[C@H](C)N(CC(=O)OC)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450905397	CE	On-Demand	Anodyne	KCNA5	23	40
CC[C@H](C)N(CC(=O)OC)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450905398	CE	On-Demand	Anodyne	KCNA5	23	40
CC[C@H](C)N(CC(=O)OC)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450905399	CE	On-Demand	Anodyne	KCNA5	23	40
CC[C@H](C)N(CC(=O)OC)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450905400	CE	On-Demand	Anodyne	KCNA5	23	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(SC)cc2)c(OC)c1	ZINC000450905419	GH	On-Demand	Anodyne	MTNR1A	53	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc(SC)cc2)c(OC)c1	ZINC000450905419	GH	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc2ncc(=O)n(CCCC(C)(C)C)c2c1	ZINC000450905432	CG	On-Demand	Anodyne	GSG2	44	39
CS(=O)(=O)c1ccc(N2CCC[C@]3(CCSC3)C2)c(F)c1	ZINC000450905442	EF	On-Demand	Anodyne	SLC6A9	0	47
CS(=O)(=O)c1ccc(N2CCC[C@@]3(CCSC3)C2)c(F)c1	ZINC000450905443	EF	On-Demand	Anodyne	SLC6A9	0	47
COC(=O)c1coc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)n1	ZINC000450905445	ED	On-Demand	Anodyne	SLC6A1	34	47
COc1ccc2ncc(=O)n(C[C@@H]3CCCC(F)(F)C3)c2c1	ZINC000450905451	DG	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	34
COc1ccc2ncc(=O)n(C[C@H]3CCCC(F)(F)C3)c2c1	ZINC000450905452	DG	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	34
COC(=O)c1cc2ccc(OC[C@H]3CCNC(=O)CC3)cc2o1	ZINC000450905454	DF	On-Demand	Anodyne	MAOB	17	42
COC(=O)c1cc2ccc(OC[C@@H]3CCNC(=O)CC3)cc2o1	ZINC000450905455	DF	On-Demand	Anodyne	MAOB	17	42
COC(=O)[C@@H]1CN(C[C@H](C)S(C)(=O)=O)C[C@H]1c1ccccc1	ZINC000450905460	ED	On-Demand	Anodyne	SLC6A1	91	48
COC(=O)[C@@H]1CN(C[C@H](C)S(C)(=O)=O)C[C@H]1c1ccccc1	ZINC000450905460	ED	On-Demand	Anodyne	SLC6A3	36	42
COC(=O)[C@@H]1CN(C[C@@H](C)S(C)(=O)=O)C[C@H]1c1ccccc1	ZINC000450905461	ED	On-Demand	Anodyne	SLC6A1	91	48
COC(=O)[C@@H]1CN(C[C@@H](C)S(C)(=O)=O)C[C@H]1c1ccccc1	ZINC000450905461	ED	On-Demand	Anodyne	SLC6A3	36	42
CC(C)CC(CC(C)C)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450905463	FI	On-Demand	Anodyne	CHRNA7	41	35
CC(C)CC(CC(C)C)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000450905463	FI	On-Demand	Anodyne	C3AR1	40	36
CC(C)CC(CC(C)C)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450905464	FI	On-Demand	Anodyne	CHRNA7	41	35
CC(C)CC(CC(C)C)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000450905464	FI	On-Demand	Anodyne	C3AR1	40	36
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	DRD2	20	42
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	DRD3	25	42
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	CETP	0	41
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	PLD1	42	37
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	PLD2	43	39
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	CACNA1I	52	33
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	SCD1	28	42
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	DGAT1	26	40
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	HPGDS	27	40
COCCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nc1	ZINC000450905476	GG	On-Demand	Anodyne	ACKR3	47	33
COCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450905513	BD	On-Demand	Anodyne	GSG2	44	39
C[C@H](CN1CCCc2c([nH]c3c(F)cccc23)C1)S(C)(=O)=O	ZINC000450905516	DE	On-Demand	Anodyne	FABP4	41	36
C[C@@H](CN1CCCc2c([nH]c3c(F)cccc23)C1)S(C)(=O)=O	ZINC000450905517	DE	On-Demand	Anodyne	FABP4	41	36
CCCN(CCc1cccs1)C(=O)c1ccc(N2CCC2)nc1	ZINC000450905526	EG	On-Demand	Anodyne	ADAM17	0	42
COCCOC[C@H](O)CN1CCC=C(C)C1	ZINC000450905533	BC	On-Demand	Anodyne	CHRNA6	0	45
COCCOC[C@@H](O)CN1CCC=C(C)C1	ZINC000450905534	BC	On-Demand	Anodyne	CHRNA6	0	45
NC(=O)c1ccc(NCc2cnc(C3CC3)o2)c([N+](=O)[O-])c1	ZINC000450905535	DE	On-Demand	Bother	PRKCQ	43	33
CCCN(CCN(CC)CC)C(=O)Cc1scnc1-c1ccccc1	ZINC000450905548	FH	On-Demand	Anodyne	TSPO	38	43
COc1cc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cnn(C)c2)ccc1O	ZINC000450905564	GD	On-Demand	Anodyne	TRPV1	0	43
CC(=O)c1ccc(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000450905566	FF	On-Demand	Anodyne	DRD4	32	42
CC(=O)c1ccc(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000450905566	FF	On-Demand	Anodyne	DRD3	0	40
CC(=O)c1ccc(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000450905566	FF	On-Demand	Anodyne	SIGMAR1	43	40
Cc1ccc(NC(=O)c2ccc(N3CCC(OCCOC(C)C)CC3)nc2)cc1	ZINC000450905592	GI	On-Demand	Anodyne	PRNP	59	43
Cc1ccc(NC(=O)c2ccc(N3CCC(OCCOC(C)C)CC3)nc2)cc1	ZINC000450905592	GI	On-Demand	Anodyne	P4HTM	0	46
Cc1ccc(NC(=O)c2ccc(N3CCC(OCCOC(C)C)CC3)nc2)cc1	ZINC000450905592	GI	On-Demand	Anodyne	ENPP2	19	40
Cc1ccc(NC(=O)c2ccc(N3CCC(OCCOC(C)C)CC3)nc2)cc1	ZINC000450905592	GI	On-Demand	Anodyne	DGAT1	47	42
CC[C@@H]1CC[C@H](C)N(c2ccc(S(=O)(=O)NC)cn2)C1	ZINC000450905595	CE	On-Demand	Anodyne	GCKR	17	43
CCNC(=O)c1ccc(N2C[C@@H](CC)CC[C@H]2C)nn1	ZINC000450905597	CE	On-Demand	Anodyne	SCD1	25	43
CC(C)OCCOC1CCN(c2ncccc2C(F)(F)F)CC1	ZINC000450905602	EH	On-Demand	Anodyne	TRPV1	31	44
CC1=CCCN(C[C@@H]2CCCCN2C(C)C)C1	ZINC000450905643	BF	On-Demand	Anodyne	CHRNA6	0	43
CC1=CCCN(C[C@H]2CCCCN2C(C)C)C1	ZINC000450905646	BF	On-Demand	Anodyne	CHRNA6	0	43
Cn1[nH]c([C@H]2CCCN2CC(=O)NC[C@@H]2COc3ccccc3O2)nc1=N	ZINC000450905685	FC	On-Demand	Anodyne	ADRA2B	20	40
Cn1[nH]c([C@@H]2CCCN2CC(=O)NC[C@@H]2COc3ccccc3O2)nc1=N	ZINC000450905688	FC	On-Demand	Anodyne	ADRA2B	20	40
Cn1[nH]c([C@H]2CCCN2CC(=O)NC[C@H]2COc3ccccc3O2)nc1=N	ZINC000450905691	FC	On-Demand	Anodyne	ADRA2B	20	40
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450905692	FE	On-Demand	Anodyne	OXTR	28	46
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450905692	FE	On-Demand	Anodyne	AVPR1A	18	46
Cn1[nH]c([C@@H]2CCCN2CC(=O)NC[C@H]2COc3ccccc3O2)nc1=N	ZINC000450905695	FC	On-Demand	Anodyne	ADRA2B	20	40
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450905697	FE	On-Demand	Anodyne	OXTR	28	46
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc3c(c2)OC(F)(F)O3)C1	ZINC000450905697	FE	On-Demand	Anodyne	AVPR1A	18	46
COCCOc1ccc(SCC(=O)c2ccc(C(=O)OC)o2)cc1	ZINC000450905701	FG	On-Demand	Anodyne	FAS	49	38
Cc1nc(-c2ccccn2)nc(N2CCC(OCCOC(C)C)CC2)c1C	ZINC000450905726	FH	On-Demand	Anodyne	METAP1	24	40
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc(S(C)(=O)=O)cc1F	ZINC000450905749	FI	On-Demand	Anodyne	PTGS2	30	41
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc(S(C)(=O)=O)cc1F	ZINC000450905749	FI	On-Demand	Anodyne	SLC6A9	19	42
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc(S(C)(=O)=O)cc1F	ZINC000450905751	FI	On-Demand	Anodyne	PTGS2	30	41
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc(S(C)(=O)=O)cc1F	ZINC000450905751	FI	On-Demand	Anodyne	SLC6A9	19	42
CC[C@@H]1CC[C@H](C)N(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450905766	FG	On-Demand	Anodyne	CXCR3	43	39
CO[C@H](Cc1ccccc1)CN(C)CCCN1CCCC1	ZINC000450905792	CF	On-Demand	Anodyne	HRH3	30	40
CO[C@H](Cc1ccccc1)CN(C)CCCN1CCCC1	ZINC000450905792	CF	On-Demand	Anodyne	SIGMAR1	33	43
CO[C@H](Cc1ccccc1)CN(C)CCCN1CCCC1	ZINC000450905792	CF	On-Demand	Anodyne	NET	0	42
CO[C@@H](Cc1ccccc1)CN(C)CCCN1CCCC1	ZINC000450905794	CF	On-Demand	Anodyne	HRH3	30	40
CO[C@@H](Cc1ccccc1)CN(C)CCCN1CCCC1	ZINC000450905794	CF	On-Demand	Anodyne	SIGMAR1	33	43
CO[C@@H](Cc1ccccc1)CN(C)CCCN1CCCC1	ZINC000450905794	CF	On-Demand	Anodyne	NET	0	42
CC1=CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450905797	CG	On-Demand	Anodyne	DRD2	35	50
CC1=CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450905797	CG	On-Demand	Anodyne	DRD1	0	54
CC1=CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450905797	CG	On-Demand	Anodyne	DRD4	22	50
CC1=CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450905797	CG	On-Demand	Anodyne	ERG2	23	49
CC1=CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450905797	CG	On-Demand	Anodyne	CHRNA6	0	57
CC1=CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450905797	CG	On-Demand	Anodyne	SLC18A3	0	50
CC1=CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450905797	CG	On-Demand	Anodyne	CYP2J2	54	41
CC1=CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450905797	CG	On-Demand	Anodyne	NET	0	49
COc1cccc(C2(F)CCN(C[C@@H]3CCCCN3C(C)C)CC2)c1	ZINC000450905805	EI	On-Demand	Anodyne	EBP	40	37
COc1ccc2ncc(=O)n(CCCCC3CCOCC3)c2c1	ZINC000450905816	DG	On-Demand	Anodyne	GSG2	40	35
Cc1ccc(F)c(CC(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)c1	ZINC000450905819	EE	On-Demand	Anodyne	OXTR	19	43
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccccc3OC)c2c1	ZINC000450905824	FD	On-Demand	Anodyne	F2	17	40
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccccc3OC)c2c1	ZINC000450905824	FD	On-Demand	Anodyne	NQO2	37	43
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccccc3OC)c2c1	ZINC000450905824	FD	On-Demand	Anodyne	MTNR1A	105	47
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccccc3OC)c2c1	ZINC000450905824	FD	On-Demand	Anodyne	MTNR1B	87	47
CC(=O)c1cccc(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000450905825	FF	On-Demand	Anodyne	DRD4	23	40
CC(=O)c1cccc(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000450905825	FF	On-Demand	Anodyne	SIGMAR1	32	41
COc1cccc(C2(F)CCN(C[C@H]3CCCCN3C(C)C)CC2)c1	ZINC000450905830	EI	On-Demand	Anodyne	EBP	40	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cnoc1C	ZINC000450905837	GE	On-Demand	Anodyne	ITGA4	48	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cnoc1C	ZINC000450905842	GE	On-Demand	Anodyne	ITGA4	48	34
COc1ccc(CNC(=O)CCn2cnc(C3CCC3)cc2=O)c(OC)c1	ZINC000450905846	FE	On-Demand	Anodyne	PDGFRB	39	40
COc1ccc(CNC(=O)CCn2cnc(C3CCC3)cc2=O)c(OC)c1	ZINC000450905846	FE	On-Demand	Anodyne	CSF1R	15	40
COc1ccc2ncc(=O)n(CC(=O)NC3CCN(C(C)C)CC3)c2c1	ZINC000450905847	FD	On-Demand	Anodyne	AVPR1B	51	42
COc1ccc2ncc(=O)n(CC(=O)NC3CCN(C(C)C)CC3)c2c1	ZINC000450905847	FD	On-Demand	Anodyne	EHMT2	40	30
Cc1ccc(F)c(CC(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)c1	ZINC000450905848	EE	On-Demand	Anodyne	OXTR	19	43
COc1cc(CN2CCN(c3cnccc3C)CC2)ccc1Cl	ZINC000450905849	EG	On-Demand	Anodyne	DRD2	30	41
COc1cc(CN2CCN(c3cnccc3C)CC2)ccc1Cl	ZINC000450905849	EG	On-Demand	Anodyne	DRD1	25	44
COc1cc(CN2CCN(c3cnccc3C)CC2)ccc1Cl	ZINC000450905849	EG	On-Demand	Anodyne	DRD4	43	45
COc1cc(CN2CCN(c3cnccc3C)CC2)ccc1Cl	ZINC000450905849	EG	On-Demand	Anodyne	DRD3	29	41
Cn1cccc1[C@@H]1COCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450905874	FG	On-Demand	Anodyne	COLA	40	37
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450905877	GG	On-Demand	Anodyne	TACR1	31	42
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450905877	GG	On-Demand	Anodyne	CCR5	33	41
Cn1cccc1[C@H]1COCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450905879	FG	On-Demand	Anodyne	COLA	40	37
CN(Cc1ncccn1)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450905884	GG	On-Demand	Anodyne	TACR1	31	42
CN(Cc1ncccn1)[C@H]1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450905884	GG	On-Demand	Anodyne	CCR5	33	41
COC(=O)[C@@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)C(C)C	ZINC000450905887	EC	On-Demand	Anodyne	ELANE	61	45
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	DRD4	25	42
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	ACHE	19	42
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	LTA4H	20	41
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	PRNP	48	37
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	HDAC1	25	41
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	FLT3	17	43
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	MCHR1	26	40
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	NPFFR1	42	33
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	NOD1	32	42
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1	ZINC000450905895	GG	On-Demand	Anodyne	NOD2	49	41
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	DRD4	25	42
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	ACHE	19	42
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	LTA4H	20	41
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	PRNP	48	37
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	HDAC1	25	41
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	FLT3	17	43
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	MCHR1	26	40
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	NPFFR1	42	33
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	NOD1	32	42
O=C(Nc1ccccc1)c1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1	ZINC000450905897	GG	On-Demand	Anodyne	NOD2	49	41
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCCc1ccc(F)cc1	ZINC000450905898	ED	On-Demand	Anodyne	CCR3	62	38
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCCc1ccc(F)cc1	ZINC000450905898	ED	On-Demand	Anodyne	GPBAR1	31	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCCc1ccc(F)cc1	ZINC000450905899	ED	On-Demand	Anodyne	CCR3	62	38
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCCc1ccc(F)cc1	ZINC000450905899	ED	On-Demand	Anodyne	GPBAR1	31	40
CS(=O)(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450905904	FG	On-Demand	Anodyne	GPR119	23	52
Cn1cccc1[C@@H]1COCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450905906	FE	On-Demand	Anodyne	THYX_PBCV1	0	40
Cn1cccc1[C@H]1COCCN1C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450905911	FE	On-Demand	Anodyne	THYX_PBCV1	0	40
C[C@H]1CCC(=O)[C@H](Sc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000450905927	DI	On-Demand	Mild	AR	58	56
COC(=O)c1cc2ccc(OCc3nnc(C(C)C)s3)cc2o1	ZINC000450905933	EH	On-Demand	Anodyne	MAOA	50	41
COC(=O)c1cc2ccc(OCc3nnc(C(C)C)s3)cc2o1	ZINC000450905933	EH	On-Demand	Anodyne	MAOB	37	56
C[C@@H]1CCC(=O)[C@@H](Sc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000450905936	DI	On-Demand	Mild	AR	58	56
C[C@H]1CCC(=O)[C@@H](Sc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000450905940	DI	On-Demand	Mild	AR	50	50
C[C@@H]1CCC(=O)[C@H](Sc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000450905942	DI	On-Demand	Mild	AR	50	50
CCC[C@@H](NC(=O)CN1CCC[C@H]1c1nc(=N)n(C)[nH]1)c1ccccc1	ZINC000450905947	FE	On-Demand	Anodyne	TPP2	40	32
O=C(Nc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905955	GH	On-Demand	Anodyne	PRNP	17	43
O=C(Nc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905955	GH	On-Demand	Anodyne	GRM4	25	41
O=C(Nc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905955	GH	On-Demand	Anodyne	GRM5	16	50
O=C(Nc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905955	GH	On-Demand	Anodyne	CCKBR	0	40
O=C(Nc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905955	GH	On-Demand	Anodyne	ENV	40	32
O=C(Nc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905955	GH	On-Demand	Anodyne	TAAR1	33	40
O=C(Nc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905955	GH	On-Demand	Anodyne	KCNK3	77	46
O=C(Nc1ccc(NC(=O)[C@@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905955	GH	On-Demand	Anodyne	KCNK9	33	44
CCC[C@H](NC(=O)CN1CCC[C@H]1c1nc(=N)n(C)[nH]1)c1ccccc1	ZINC000450905959	FE	On-Demand	Anodyne	TPP2	40	32
O=C(Nc1ccc(NC(=O)[C@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905960	GH	On-Demand	Anodyne	PRNP	17	43
O=C(Nc1ccc(NC(=O)[C@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905960	GH	On-Demand	Anodyne	GRM4	25	41
O=C(Nc1ccc(NC(=O)[C@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905960	GH	On-Demand	Anodyne	GRM5	16	50
O=C(Nc1ccc(NC(=O)[C@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905960	GH	On-Demand	Anodyne	CCKBR	0	40
O=C(Nc1ccc(NC(=O)[C@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905960	GH	On-Demand	Anodyne	ENV	40	32
O=C(Nc1ccc(NC(=O)[C@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905960	GH	On-Demand	Anodyne	TAAR1	33	40
O=C(Nc1ccc(NC(=O)[C@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905960	GH	On-Demand	Anodyne	KCNK3	77	46
O=C(Nc1ccc(NC(=O)[C@H](O)C2CCC2)cc1F)c1cccc(Cl)c1	ZINC000450905960	GH	On-Demand	Anodyne	KCNK9	33	44
CCC[C@@H](NC(=O)CN1CCC[C@@H]1c1nc(=N)n(C)[nH]1)c1ccccc1	ZINC000450905963	FE	On-Demand	Anodyne	TPP2	40	32
CCC[C@H](NC(=O)CN1CCC[C@@H]1c1nc(=N)n(C)[nH]1)c1ccccc1	ZINC000450905966	FE	On-Demand	Anodyne	TPP2	40	32
COC(=O)c1ccc(Cn2cnn(C(C)(C)C)c2=O)cc1Cl	ZINC000450905999	DE	On-Demand	Anodyne	DNAE	48	32
Oc1nnc([C@@H]2CCCN(Cc3csc(Nc4ccccc4)n3)C2)o1	ZINC000450906002	FF	On-Demand	Anodyne	SPHK2	49	34
Oc1nnc([C@H]2CCCN(Cc3csc(Nc4ccccc4)n3)C2)o1	ZINC000450906004	FF	On-Demand	Anodyne	SPHK2	49	34
Cc1nccnc1N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450906011	EE	On-Demand	Anodyne	SORD	47	40
Cc1nccnc1N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450906015	EE	On-Demand	Anodyne	SORD	47	40
Cc1nccnc1N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450906019	EE	On-Demand	Anodyne	SORD	47	40
COc1ccc2ncc(=O)n(CCC(C)(C)C)c2c1	ZINC000450906022	CF	On-Demand	Anodyne	GSG2	40	35
Cc1nccnc1N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450906023	EE	On-Demand	Anodyne	SORD	47	40
COc1ccc2ncc(=O)n(CCCCCF)c2c1	ZINC000450906026	CF	On-Demand	Anodyne	GSG2	61	45
O=S(=O)(NCC1CC1)c1ccc(NCc2nc(-c3ccccn3)n[nH]2)nc1	ZINC000450906043	GD	On-Demand	Anodyne	NPY2R	64	38
O=S(=O)(NCC1CC1)c1ccc(NCc2nc(-c3ccccn3)n[nH]2)nc1	ZINC000450906043	GD	On-Demand	Anodyne	GPR39	0	46
COC(=O)c1cc2ccc(OCc3nnc(C4CC4)s3)cc2o1	ZINC000450906055	EH	On-Demand	Anodyne	MAOA	40	40
COC(=O)c1cc2ccc(OCc3nnc(C4CC4)s3)cc2o1	ZINC000450906055	EH	On-Demand	Anodyne	MAOB	29	42
COC(=O)c1cc2ccc(OCc3cn(CC4CC4)nn3)cc2o1	ZINC000450906087	EF	On-Demand	Anodyne	MAOB	15	41
Clc1ccc2c(N3CCC[C@]4(CCSC4)C3)ncnc2c1	ZINC000450906088	DI	On-Demand	Anodyne	HTT	0	40
Clc1ccc2c(N3CCC[C@@]4(CCSC4)C3)ncnc2c1	ZINC000450906093	DI	On-Demand	Anodyne	HTT	0	40
COc1ccc2ncc(=O)n(CCC[C@H](C)O)c2c1	ZINC000450906099	CD	On-Demand	Anodyne	GSG2	42	38
Cc1cn2nc(N3CCC[C@@H]3c3ccc(F)cc3F)sc2n1	ZINC000450906100	DH	On-Demand	Anodyne	PRCP	41	33
COc1ccc2ncc(=O)n(CCC[C@@H](C)O)c2c1	ZINC000450906101	CD	On-Demand	Anodyne	GSG2	42	38
Cc1cn2nc(N3CCC[C@H]3c3ccc(F)cc3F)sc2n1	ZINC000450906103	DH	On-Demand	Anodyne	PRCP	41	33
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc(C#N)cn1	ZINC000450906105	CH	On-Demand	Mild	CYP11B1	16	41
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc(C#N)cn1	ZINC000450906105	CH	On-Demand	Mild	CYP11B2	18	44
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc(C#N)cn1	ZINC000450906107	CH	On-Demand	Mild	CYP11B1	16	41
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc(C#N)cn1	ZINC000450906107	CH	On-Demand	Mild	CYP11B2	18	44
CNS(=O)(=O)NCC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450906109	GD	On-Demand	Anodyne	MME	59	40
CNS(=O)(=O)NCC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450906109	GD	On-Demand	Anodyne	CPA1	29	40
CNS(=O)(=O)NCC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450906109	GD	On-Demand	Anodyne	MMP8	15	43
CNS(=O)(=O)NCC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450906109	GD	On-Demand	Anodyne	CAPN2	44	30
CC(=O)c1cccc(CN2CCN(c3nccnc3C)CC2)c1	ZINC000450906120	DE	On-Demand	Anodyne	HTR1A	31	45
CC(=O)c1cccc(CN2CCN(c3nccnc3C)CC2)c1	ZINC000450906120	DE	On-Demand	Anodyne	DRD2	23	45
CC(=O)c1cccc(CN2CCN(c3nccnc3C)CC2)c1	ZINC000450906120	DE	On-Demand	Anodyne	DRD4	41	42
COC(=O)c1cn(Cc2ccn(CCc3ccccc3)n2)c(C)n1	ZINC000450906127	DE	On-Demand	Anodyne	FAS	28	45
CC1=CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450906132	BF	On-Demand	Anodyne	SLC6A1	15	40
CC1=CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450906132	BF	On-Demand	Anodyne	SIGMAR1	29	49
CC1=CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450906132	BF	On-Demand	Anodyne	CHRNA6	0	51
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450906139	GD	On-Demand	Anodyne	HDAC10	20	41
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450906139	GD	On-Demand	Anodyne	RCE1	0	40
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450906139	GD	On-Demand	Anodyne	ST14	45	38
C/C=C/C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C(=O)OCC	ZINC000450906144	EF	On-Demand	Anodyne	CTSV	48	35
C/C=C/C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C(=O)OCC	ZINC000450906145	EF	On-Demand	Anodyne	CTSV	48	35
C/C=C\C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C(=O)OCC	ZINC000450906146	EF	On-Demand	Anodyne	CTSV	48	35
C/C=C\C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C(=O)OCC	ZINC000450906147	EF	On-Demand	Anodyne	CTSV	48	35
CCC(=O)CCCN(Cc1ccc(Cl)cc1)Cc1cnn(C)c1	ZINC000450906158	EH	On-Demand	Anodyne	PLA2G7	59	42
COC(=O)c1ccc(CN2CCC=C(C)C2)cc1Cl	ZINC000450906187	CG	On-Demand	Anodyne	OPRK1	0	44
CCCC[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)OC(C)(C)C	ZINC000450906196	ED	On-Demand	Anodyne	CTSK	28	46
CCCC[C@@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)OC(C)(C)C	ZINC000450906196	ED	On-Demand	Anodyne	NOD1	64	33
CCCC[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)OC(C)(C)C	ZINC000450906197	ED	On-Demand	Anodyne	CTSK	28	46
CCCC[C@H](NC(=O)CS(=O)(=O)C1CC1)C(=O)OC(C)(C)C	ZINC000450906197	ED	On-Demand	Anodyne	NOD1	64	33
CCCC[C@@H](NC(=O)C1(C(=O)C2CC2)CC1)C(=O)OC(C)(C)C	ZINC000450906217	DF	On-Demand	Anodyne	CTSK	0	45
CCCC[C@H](NC(=O)C1(C(=O)C2CC2)CC1)C(=O)OC(C)(C)C	ZINC000450906218	DF	On-Demand	Anodyne	CTSK	0	45
CNC(=O)C[C@H](NCCN(C)Cc1ccccc1)c1ccccc1	ZINC000450906223	EF	On-Demand	Anodyne	LTA4H	18	40
CCCOc1ccc(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)c(OC)c1	ZINC000450906224	GF	On-Demand	Anodyne	OXTR	22	43
CCCOc1ccc(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)c(OC)c1	ZINC000450906225	GF	On-Demand	Anodyne	OXTR	22	43
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450906231	GG	On-Demand	Anodyne	OXTR	30	52
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450906231	GG	On-Demand	Anodyne	AVPR1A	0	52
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450906233	GG	On-Demand	Anodyne	OXTR	30	52
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450906233	GG	On-Demand	Anodyne	AVPR1A	0	52
N#Cc1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906257	DH	On-Demand	Mild	SMO	0	45
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450906262	GH	On-Demand	Anodyne	NAMPT	19	41
COC(=O)[C@H](NC(=O)C1=C(c2ccccc2)CCCC1)[C@H](C)O	ZINC000450906264	DE	On-Demand	Anodyne	CHRM5	37	40
COC(=O)[C@@H](NC(=O)C1=C(c2ccccc2)CCCC1)[C@H](C)O	ZINC000450906266	DE	On-Demand	Anodyne	CHRM5	37	40
COC(=O)[C@H](NC(=O)C1=C(c2ccccc2)CCCC1)[C@@H](C)O	ZINC000450906267	DE	On-Demand	Anodyne	CHRM5	37	40
COC(=O)[C@@H](NC(=O)C1=C(c2ccccc2)CCCC1)[C@@H](C)O	ZINC000450906268	DE	On-Demand	Anodyne	CHRM5	37	40
C[C@@H](O)CCN1CCC(c2cccc(Br)c2)CC1	ZINC000450906289	DG	On-Demand	Anodyne	VACHT_TETCF	0	53
C[C@@H](O)CCN1CCC(c2cccc(Br)c2)CC1	ZINC000450906289	DG	On-Demand	Anodyne	CCR5	42	38
C[C@@H](O)CCN1CCC(c2cccc(Br)c2)CC1	ZINC000450906289	DG	On-Demand	Anodyne	SLC18A3	27	44
C[C@@H](O)CCN1CCC(c2cccc(Br)c2)CC1	ZINC000450906289	DG	On-Demand	Anodyne	MCHR1	23	41
C[C@H](O)CCN1CCC(c2cccc(Br)c2)CC1	ZINC000450906291	DG	On-Demand	Anodyne	VACHT_TETCF	0	53
C[C@H](O)CCN1CCC(c2cccc(Br)c2)CC1	ZINC000450906291	DG	On-Demand	Anodyne	CCR5	42	38
C[C@H](O)CCN1CCC(c2cccc(Br)c2)CC1	ZINC000450906291	DG	On-Demand	Anodyne	SLC18A3	27	44
C[C@H](O)CCN1CCC(c2cccc(Br)c2)CC1	ZINC000450906291	DG	On-Demand	Anodyne	MCHR1	23	41
O=C(CCCN1C[C@H](O)C[C@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906343	EH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1C[C@H](O)C[C@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906343	EH	On-Demand	Anodyne	HTR2A	18	41
O=C(CCCN1C[C@H](O)C[C@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906343	EH	On-Demand	Anodyne	ERG2	18	40
O=C(CCCN1C[C@H](O)C[C@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906343	EH	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@@H](O)C[C@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906346	EH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1C[C@@H](O)C[C@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906346	EH	On-Demand	Anodyne	HTR2A	18	41
O=C(CCCN1C[C@@H](O)C[C@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906346	EH	On-Demand	Anodyne	ERG2	18	40
O=C(CCCN1C[C@@H](O)C[C@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906346	EH	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906349	EH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906349	EH	On-Demand	Anodyne	HTR2A	18	41
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906349	EH	On-Demand	Anodyne	ERG2	18	40
O=C(CCCN1C[C@@H](O)C[C@@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906349	EH	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCCN1C[C@H](O)C[C@@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906351	EH	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1C[C@H](O)C[C@@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906351	EH	On-Demand	Anodyne	HTR2A	18	41
O=C(CCCN1C[C@H](O)C[C@@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906351	EH	On-Demand	Anodyne	ERG2	18	40
O=C(CCCN1C[C@H](O)C[C@@H]1c1cccc(F)c1)c1ccc(F)cc1	ZINC000450906351	EH	On-Demand	Anodyne	CYP2J2	44	31
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906364	GH	On-Demand	Anodyne	COLA	68	36
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906364	GH	On-Demand	Anodyne	CPT1A	63	36
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906364	GH	On-Demand	Anodyne	RHODESAIN	0	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906364	GH	On-Demand	Anodyne	SFRP1	44	33
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906364	GH	On-Demand	Anodyne	WNT3	49	32
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906365	GH	On-Demand	Anodyne	COLA	68	36
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906365	GH	On-Demand	Anodyne	CPT1A	63	36
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906365	GH	On-Demand	Anodyne	RHODESAIN	0	43
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906365	GH	On-Demand	Anodyne	SFRP1	44	33
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450906365	GH	On-Demand	Anodyne	WNT3	49	32
c1ccc(OCc2nnn(Cc3cn(CC4CC4)nn3)n2)cc1	ZINC000450906367	DD	On-Demand	Anodyne	GRM5	0	40
c1ccc(OCc2nnn(Cc3cn(CC4CC4)nn3)n2)cc1	ZINC000450906367	DD	On-Demand	Anodyne	MAL12	0	40
Cc1cc(C)c(CNc2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)cn1	ZINC000450906377	FF	On-Demand	Anodyne	PTK2	53	33
COc1ccc(CNC(=O)CCN2CCOC[C@@]23CCOC3)c(OC)c1	ZINC000450906382	FD	On-Demand	Anodyne	MTNR1A	45	36
COc1ccc(CNC(=O)CCN2CCOC[C@]23CCOC3)c(OC)c1	ZINC000450906383	FD	On-Demand	Anodyne	MTNR1A	45	36
COC(=O)[C@@H]1CN(Cc2cnns2)C[C@H]1c1ccccc1	ZINC000450906393	DD	On-Demand	Anodyne	SLC6A1	60	51
COC(=O)[C@@H]1CN(Cc2cnns2)C[C@H]1c1ccccc1	ZINC000450906393	DD	On-Demand	Anodyne	MGEA5	32	41
COc1cc(CC(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)ccc1Cl	ZINC000450906401	GG	On-Demand	Anodyne	OPRK1	41	42
COc1cc(CC(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)ccc1Cl	ZINC000450906404	GG	On-Demand	Anodyne	OPRK1	41	42
NC(=O)c1cncc(N2CCC(Cc3cc(F)ccc3F)CC2)n1	ZINC000450906406	EE	On-Demand	Anodyne	DPP4	24	42
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450906407	FE	On-Demand	Anodyne	OXTR	28	51
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450906407	FE	On-Demand	Anodyne	AVPR1A	19	51
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450906409	FE	On-Demand	Anodyne	OXTR	28	51
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450906409	FE	On-Demand	Anodyne	AVPR1A	19	51
C=CCCCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450906447	CG	On-Demand	Mild	GSG2	45	39
CCCOc1ccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450906526	GF	On-Demand	Anodyne	AVPR1B	42	40
CCCOc1ccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450906526	GF	On-Demand	Anodyne	MTNR1A	43	42
CCCOc1ccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450906526	GF	On-Demand	Anodyne	PROKR1	53	35
c1ccc(-c2n[nH]c(CNc3cc(N4CCCC4)ncn3)n2)nc1	ZINC000450906536	DD	On-Demand	Anodyne	GPR39	0	41
COCCOc1cccc(CNC(=O)CN(C)c2cccc3cccnc23)c1	ZINC000450906537	GG	On-Demand	Anodyne	ROCK2	39	40
COc1ccc(CN2CCC[C@@H](c3nnc(O)o3)C2)cc1[N+](=O)[O-]	ZINC000450906543	EE	On-Demand	Bother	SSTR5	48	44
COc1ccc(CN2CCC[C@H](c3nnc(O)o3)C2)cc1[N+](=O)[O-]	ZINC000450906544	EE	On-Demand	Bother	SSTR5	48	44
COc1ccc2ncc(=O)n(CC(=O)NCC3CC3)c2c1	ZINC000450906552	CC	On-Demand	Anodyne	AVPR1B	50	44
COc1ccc2ncc(=O)n(CC(=O)NCC3CC3)c2c1	ZINC000450906552	CC	On-Demand	Anodyne	MTNR1A	42	38
COc1ccc2ncc(=O)n(CC(=O)NCC3CC3)c2c1	ZINC000450906552	CC	On-Demand	Anodyne	MTNR1B	42	36
O=C(c1cc2n(n1)CCCC2)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450906569	GG	On-Demand	Anodyne	COLA	86	34
O=C(c1cc2n(n1)CCCC2)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450906569	GG	On-Demand	Anodyne	CPT1A	80	34
O=C(c1cc2n(n1)CCCC2)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450906569	GG	On-Demand	Anodyne	GRM5	0	42
Cc1cccc(Cl)c1CN1CCN(c2nccnc2C)CC1	ZINC000450906570	DG	On-Demand	Anodyne	DRD4	25	40
COc1cc(CN2CCN(c3nccnc3C)CC2)ccc1Cl	ZINC000450906574	EF	On-Demand	Anodyne	DRD1	0	47
COc1cc(CN2CCN(c3nccnc3C)CC2)ccc1Cl	ZINC000450906574	EF	On-Demand	Anodyne	DRD4	33	41
COc1cc(CN2CCN(c3nccnc3C)CC2)ccc1Cl	ZINC000450906574	EF	On-Demand	Anodyne	DRD3	23	45
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NC[C@@H]1COc2ccccc2O1	ZINC000450906593	FC	On-Demand	Anodyne	ADRA2B	19	40
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450906594	GI	On-Demand	Anodyne	CCR5	15	40
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NC[C@H]1COc2ccccc2O1	ZINC000450906595	FC	On-Demand	Anodyne	ADRA2B	19	40
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450906596	GI	On-Demand	Anodyne	CCR5	15	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NC[C@@H]1COc2ccccc2O1	ZINC000450906597	FC	On-Demand	Anodyne	ADRA2B	19	40
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450906598	GI	On-Demand	Anodyne	CCR5	15	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NC[C@H]1COc2ccccc2O1	ZINC000450906599	FC	On-Demand	Anodyne	ADRA2B	19	40
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450906600	GI	On-Demand	Anodyne	CCR5	15	40
CCc1nc(C)c(COc2ccc(OC)cc2Br)o1	ZINC000450906603	EH	On-Demand	Anodyne	SLC22A12	48	39
CNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nn1	ZINC000450906633	DE	On-Demand	Anodyne	SCD1	25	43
CNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nn1	ZINC000450906636	DE	On-Demand	Anodyne	SCD1	25	43
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCC1	ZINC000450906649	GF	On-Demand	Anodyne	KCNA3	40	36
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCC1	ZINC000450906649	GF	On-Demand	Anodyne	SMO	16	44
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCC1	ZINC000450906649	GF	On-Demand	Anodyne	ACAT	0	41
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCC1	ZINC000450906649	GF	On-Demand	Anodyne	NPFFR1	39	42
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCC1	ZINC000450906650	GF	On-Demand	Anodyne	KCNA3	40	36
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCC1	ZINC000450906650	GF	On-Demand	Anodyne	SMO	16	44
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCC1	ZINC000450906650	GF	On-Demand	Anodyne	ACAT	0	41
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCC1(c2ccccc2)CCCC1	ZINC000450906650	GF	On-Demand	Anodyne	NPFFR1	39	42
O=C([C@@H]1CCCCC1(F)F)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450906654	GI	On-Demand	Anodyne	AMY2	44	31
O=C([C@H]1CCCCC1(F)F)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450906655	GI	On-Demand	Anodyne	AMY2	44	31
CS(=O)(=O)N[C@H]1CCCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450906666	GD	On-Demand	Bother	CACNA1D	48	33
CS(=O)(=O)N[C@H]1CCCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450906666	GD	On-Demand	Bother	LUXR	16	40
CS(=O)(=O)N[C@H]1CCCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450906667	GD	On-Demand	Bother	CACNA1D	48	33
CS(=O)(=O)N[C@H]1CCCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450906667	GD	On-Demand	Bother	LUXR	16	40
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450906669	GD	On-Demand	Bother	CACNA1D	48	33
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450906669	GD	On-Demand	Bother	LUXR	16	40
CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450906671	GD	On-Demand	Bother	CACNA1D	48	33
CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450906671	GD	On-Demand	Bother	LUXR	16	40
C[C@@H](O)CCN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450906754	CG	On-Demand	Anodyne	DRD4	0	43
C[C@@H](O)CCN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450906754	CG	On-Demand	Anodyne	DRD3	0	48
C[C@@H](O)CCN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450906754	CG	On-Demand	Anodyne	CCR1	49	37
C[C@@H](O)CCN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450906754	CG	On-Demand	Anodyne	US28	0	46
C[C@H](O)CCN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450906755	CG	On-Demand	Anodyne	DRD4	0	43
C[C@H](O)CCN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450906755	CG	On-Demand	Anodyne	DRD3	0	48
C[C@H](O)CCN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450906755	CG	On-Demand	Anodyne	CCR1	49	37
C[C@H](O)CCN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450906755	CG	On-Demand	Anodyne	US28	0	46
CC(C)OCCOC1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000450906769	DE	On-Demand	Anodyne	PDE3A	42	33
CC(C)OCCOC1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000450906769	DE	On-Demand	Anodyne	AKT2	50	53
CC(C)OCCOC1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000450906769	DE	On-Demand	Anodyne	AKT3	38	42
CC(C)OCCOC1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000450906769	DE	On-Demand	Anodyne	JAK1	44	34
CC(C)OCCOC1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000450906769	DE	On-Demand	Anodyne	AKT1	24	42
COC(=O)c1cccc(CN2CCN(c3cnccc3C)CC2)c1Cl	ZINC000450906813	FG	On-Demand	Anodyne	HTR1A	20	42
COC(=O)c1cccc(CN2CCN(c3cnccc3C)CC2)c1Cl	ZINC000450906813	FG	On-Demand	Anodyne	DRD4	53	35
COC(=O)c1cccc(CN2CCN(c3cnccc3C)CC2)c1Cl	ZINC000450906813	FG	On-Demand	Anodyne	HTR7	23	42
Cc1nccnc1N1CCC(Cc2cc(F)ccc2F)CC1	ZINC000450906822	DH	On-Demand	Anodyne	DPP4	17	46
CCn1nnc(C)c1COc1ccc2cc(C(=O)OC)oc2c1	ZINC000450906831	DF	On-Demand	Anodyne	MAOB	30	46
COC(=O)[C@@H]1CN(Cc2nnc(C3CC3)s2)C[C@H]1c1ccccc1	ZINC000450906832	EF	On-Demand	Anodyne	SLC6A1	70	48
COC(=O)[C@@H]1CN(Cc2nnc(C3CC3)s2)C[C@H]1c1ccccc1	ZINC000450906832	EF	On-Demand	Anodyne	SLC6A3	26	41
COCCOC[C@H](O)CN1CC[C@H](c2ccccc2)C[C@H]1C	ZINC000450906838	DE	On-Demand	Anodyne	SLC6A4	15	45
COCCOC[C@H](O)CN1CC[C@H](c2ccccc2)C[C@H]1C	ZINC000450906838	DE	On-Demand	Anodyne	SLC18A3	32	45
COCCOC[C@H](O)CN1CC[C@@H](c2ccccc2)C[C@@H]1C	ZINC000450906839	DE	On-Demand	Anodyne	SLC6A4	15	45
COCCOC[C@H](O)CN1CC[C@@H](c2ccccc2)C[C@@H]1C	ZINC000450906839	DE	On-Demand	Anodyne	SLC18A3	32	45
COCCOC[C@H](O)CN1CC[C@@H](c2ccccc2)C[C@H]1C	ZINC000450906840	DE	On-Demand	Anodyne	SLC6A4	15	45
COCCOC[C@H](O)CN1CC[C@@H](c2ccccc2)C[C@H]1C	ZINC000450906840	DE	On-Demand	Anodyne	SLC18A3	32	45
COCCOC[C@H](O)CN1CC[C@H](c2ccccc2)C[C@@H]1C	ZINC000450906841	DE	On-Demand	Anodyne	SLC6A4	15	45
COCCOC[C@H](O)CN1CC[C@H](c2ccccc2)C[C@@H]1C	ZINC000450906841	DE	On-Demand	Anodyne	SLC18A3	32	45
CC[C@@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCCO1	ZINC000450906860	DG	On-Demand	Anodyne	DRD4	34	46
CC[C@@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCCO1	ZINC000450906860	DG	On-Demand	Anodyne	FABP4	46	37
CC[C@@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCCO1	ZINC000450906860	DG	On-Demand	Anodyne	CCR3	30	40
CC[C@@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCCO1	ZINC000450906860	DG	On-Demand	Anodyne	MCHR1	24	40
CC[C@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCCO1	ZINC000450906861	DG	On-Demand	Anodyne	DRD4	34	46
CC[C@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCCO1	ZINC000450906861	DG	On-Demand	Anodyne	FABP4	46	37
CC[C@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCCO1	ZINC000450906861	DG	On-Demand	Anodyne	CCR3	30	40
CC[C@H]1CN(Cc2ccc(C(=O)OC)c(Cl)c2)CCCO1	ZINC000450906861	DG	On-Demand	Anodyne	MCHR1	24	40
CNc1nc(N2CCC[C@]3(CCSC3)C2)nc2ccccc12	ZINC000450906873	DF	On-Demand	Anodyne	HRH4	15	42
CNc1nc(N2CCC[C@@]3(CCSC3)C2)nc2ccccc12	ZINC000450906874	DF	On-Demand	Anodyne	HRH4	15	42
CNC(=O)C[C@@H](NCCN(C)Cc1ccccc1)c1ccccc1	ZINC000450906885	EF	On-Demand	Anodyne	LTA4H	18	40
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	DRD2	15	42
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	DRD4	43	33
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	DRD3	25	42
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	PLD1	40	33
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	PLD2	41	33
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	SCD1	26	42
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	SCD	15	42
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	DGAT1	28	41
COCCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nc1	ZINC000450906902	GG	On-Demand	Anodyne	HPGDS	36	42
O=C1CCC(CN2CCC(c3cccc(Br)c3)CC2)CC1	ZINC000450906912	FI	On-Demand	Anodyne	VACHT_TETCF	0	44
O=C1CCC(CN2CCC(c3cccc(Br)c3)CC2)CC1	ZINC000450906912	FI	On-Demand	Anodyne	SIGMAR1	16	49
Cc1nc(CN2C[C@@H](F)C[C@H]2CNC(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cs1	ZINC000450906913	GG	On-Demand	Anodyne	PDE8B	50	30
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)[C@@H](O)C2CCC2)c1	ZINC000450906952	FC	On-Demand	Anodyne	ST14	42	35
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)[C@H](O)C2CCC2)c1	ZINC000450906953	FC	On-Demand	Anodyne	ST14	42	35
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	F2	87	41
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	PLG	43	40
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	PRSS1	29	40
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	ACE	56	46
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	FKBP1A	40	39
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	OPRM1	33	50
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	OPRD1	22	50
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	P2RY12	43	38
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	CELA1	58	37
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	ELANE	72	41
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	TACR1	17	46
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	TRHR	61	37
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	HLA-DRB3	53	36
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	CMA1	41	40
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	CTRA_BOVIN	65	35
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	TRY1_BOVIN	106	40
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	NTSR1	102	36
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	NTSR2	63	32
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	CTSG	45	34
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	HLA-A	43	37
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	PREP	73	41
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	CELA2A	53	35
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	LGMN	106	40
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	CTRC	18	40
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	NS3	0	42
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	MARS	46	40
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	XIAP	65	42
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	BRCA1	67	36
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906963	FE	On-Demand	Anodyne	TMPRSS11D	67	36
Cc1cc(C)c(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)cn1	ZINC000450906964	ED	On-Demand	Anodyne	NPY1R	40	34
Cc1cc(C)c(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)cn1	ZINC000450906964	ED	On-Demand	Anodyne	NPY2R	58	38
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	F2	87	41
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	PLG	43	40
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	PRSS1	29	40
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	ACE	56	46
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	FKBP1A	40	39
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	OPRM1	33	50
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	OPRD1	22	50
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	P2RY12	43	38
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	CELA1	58	37
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	ELANE	72	41
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	TACR1	17	46
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	TRHR	61	37
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	HLA-DRB3	53	36
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	CMA1	41	40
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	CTRA_BOVIN	65	35
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	TRY1_BOVIN	106	40
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	NTSR1	102	36
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	NTSR2	63	32
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	CTSG	45	34
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	HLA-A	43	37
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	PREP	73	41
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	CELA2A	53	35
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	LGMN	106	40
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	CTRC	18	40
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	NS3	0	42
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	MARS	46	40
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	XIAP	65	42
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	BRCA1	67	36
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906965	FE	On-Demand	Anodyne	TMPRSS11D	67	36
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	F2	87	41
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	PLG	43	40
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	PRSS1	29	40
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	ACE	56	46
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	FKBP1A	40	39
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	OPRM1	33	50
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	OPRD1	22	50
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	P2RY12	43	38
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	CELA1	58	37
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	ELANE	72	41
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	TACR1	17	46
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	TRHR	61	37
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	HLA-DRB3	53	36
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	CMA1	41	40
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	CTRA_BOVIN	65	35
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	TRY1_BOVIN	106	40
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	NTSR1	102	36
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	NTSR2	63	32
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	CTSG	45	34
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	HLA-A	43	37
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	PREP	73	41
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	CELA2A	53	35
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	LGMN	106	40
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	CTRC	18	40
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	NS3	0	42
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	MARS	46	40
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	XIAP	65	42
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	BRCA1	67	36
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906966	FE	On-Demand	Anodyne	TMPRSS11D	67	36
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	F2	87	41
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	PLG	43	40
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	PRSS1	29	40
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	ACE	56	46
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	FKBP1A	40	39
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	OPRM1	33	50
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	OPRD1	22	50
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	P2RY12	43	38
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	CELA1	58	37
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	ELANE	72	41
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	TACR1	17	46
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	TRHR	61	37
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	HLA-DRB3	53	36
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	CMA1	41	40
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	CTRA_BOVIN	65	35
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	TRY1_BOVIN	106	40
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	NTSR1	102	36
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	NTSR2	63	32
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	CTSG	45	34
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	HLA-A	43	37
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	PREP	73	41
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	CELA2A	53	35
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	LGMN	106	40
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	CTRC	18	40
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	NS3	0	42
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	MARS	46	40
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	XIAP	65	42
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	BRCA1	67	36
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccccc1)C(=O)OCC	ZINC000450906967	FE	On-Demand	Anodyne	TMPRSS11D	67	36
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2cnc(C)cc2C)c([N+](=O)[O-])c1	ZINC000450906989	GF	On-Demand	Bother	TAAR1	16	42
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2cnc(C)cc2C)c([N+](=O)[O-])c1	ZINC000450906991	GF	On-Demand	Bother	TAAR1	16	42
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cccc3c2CCCC3)C1	ZINC000450906992	EF	On-Demand	Anodyne	OXTR	28	46
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cccc3c2CCCC3)C1	ZINC000450906992	EF	On-Demand	Anodyne	AVPR1A	0	46
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cccc3c2CCCC3)C1	ZINC000450906992	EF	On-Demand	Anodyne	FABP4	44	40
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cccc3c2CCCC3)C1	ZINC000450906994	EF	On-Demand	Anodyne	OXTR	28	46
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cccc3c2CCCC3)C1	ZINC000450906994	EF	On-Demand	Anodyne	AVPR1A	0	46
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cccc3c2CCCC3)C1	ZINC000450906994	EF	On-Demand	Anodyne	FABP4	44	40
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450907022	GH	On-Demand	Anodyne	FKBP1A	52	36
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450907022	GH	On-Demand	Anodyne	RHODESAIN	0	45
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450907023	GH	On-Demand	Anodyne	FKBP1A	52	36
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450907023	GH	On-Demand	Anodyne	RHODESAIN	0	45
CCCN(CCc1cccs1)C(=O)[C@@H](O)C1CCC1	ZINC000450907044	CF	On-Demand	Anodyne	ADAM17	0	46
CCCN(CCc1cccs1)C(=O)[C@H](O)C1CCC1	ZINC000450907045	CF	On-Demand	Anodyne	ADAM17	0	46
CCCOc1cccc(CSc2nc3cncnc3[nH]2)c1	ZINC000450907081	DG	On-Demand	Anodyne	CYP2C8	26	40
CCCOc1cccc(CSc2nc3cncnc3[nH]2)c1	ZINC000450907081	DG	On-Demand	Anodyne	CYP2C19	30	44
CCCOc1cccc(CSc2nc3cncnc3[nH]2)c1	ZINC000450907081	DG	On-Demand	Anodyne	ENPP1	23	43
N#Cc1ccc(CNc2nc3ccccc3nc2N2CCOCC2)cc1F	ZINC000450907082	FG	On-Demand	Mild	STAT6	50	35
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(C#N)n2C)C1	ZINC000450907086	DD	On-Demand	Mild	OXTR	0	43
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(C#N)n2C)C1	ZINC000450907087	DD	On-Demand	Mild	OXTR	0	43
CN1CCO[C@@H](CN(CC2CC2)C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450907088	GG	On-Demand	Anodyne	SLC6A1	22	43
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450907089	GG	On-Demand	Anodyne	SLC6A1	22	43
COc1ccc(CNC(=O)CCSc2nc3cncnc3[nH]2)c(OC)c1	ZINC000450907101	FE	On-Demand	Anodyne	PDGFRB	39	40
COc1ccc(CNC(=O)CCSc2nc3cncnc3[nH]2)c(OC)c1	ZINC000450907101	FE	On-Demand	Anodyne	CSF1R	16	40
COc1ccc(CNC(=O)CCSc2nc3cncnc3[nH]2)c(OC)c1	ZINC000450907101	FE	On-Demand	Anodyne	ENPP1	80	54
CCCCCSCC[C@H]1CCOC1	ZINC000450907127	BG	On-Demand	Anodyne	GBA3	0	41
CCCCCSCC[C@@H]1CCOC1	ZINC000450907128	BG	On-Demand	Anodyne	GBA3	0	41
CCS(=O)(=O)c1ccc(Cn2ccc(C(=O)OC(C)C)cc2=O)cc1	ZINC000450907133	FE	On-Demand	Anodyne	RORC	47	39
Cc1nc(S[C@H](C)C(=O)Nc2nccs2)nc(O)c1C	ZINC000450907165	DE	On-Demand	Anodyne	MAP	0	42
Cc1nc(S[C@H](C)C(=O)Nc2nccs2)nc(O)c1C	ZINC000450907165	DE	On-Demand	Anodyne	MAP1	95	38
Cc1nc(S[C@@H](C)C(=O)Nc2nccs2)nc(O)c1C	ZINC000450907166	DE	On-Demand	Anodyne	MAP	0	42
Cc1nc(S[C@@H](C)C(=O)Nc2nccs2)nc(O)c1C	ZINC000450907166	DE	On-Demand	Anodyne	MAP1	95	38
Cn1cccc1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450907175	GH	On-Demand	Anodyne	RBP4	68	37
Cn1cccc1[C@@H]1COCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450907180	GH	On-Demand	Anodyne	PRCP	44	34
Cn1cccc1[C@@H]1COCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450907181	GH	On-Demand	Anodyne	PRCP	44	34
Cn1cccc1[C@@H]1COCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450907182	GH	On-Demand	Anodyne	PRCP	44	34
Cn1cccc1[C@@H]1COCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450907183	GH	On-Demand	Anodyne	PRCP	44	34
COc1cc(CC(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)ccc1Cl	ZINC000450907189	FD	On-Demand	Anodyne	SSTR3	22	44
COc1cc(CC(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)ccc1Cl	ZINC000450907190	FD	On-Demand	Anodyne	SSTR3	22	44
COc1cc(CC(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)ccc1Cl	ZINC000450907191	FD	On-Demand	Anodyne	SSTR3	22	44
COc1cc(CC(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)ccc1Cl	ZINC000450907192	FD	On-Demand	Anodyne	SSTR3	22	44
Cc1nn(C)cc1COc1cc(Br)ccc1F	ZINC000450907193	CG	On-Demand	Anodyne	PTGER1	16	41
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CCCC3)c2c1	ZINC000450907222	GG	On-Demand	Anodyne	AVPR1B	48	38
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CCCC3)c2c1	ZINC000450907222	GG	On-Demand	Anodyne	KCNA3	46	39
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CCCC3)c2c1	ZINC000450907222	GG	On-Demand	Anodyne	MTNR1A	28	47
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CCCC3)c2c1	ZINC000450907222	GG	On-Demand	Anodyne	MTNR1B	28	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](N(C)Cc2ncccn2)C1	ZINC000450907225	GG	On-Demand	Anodyne	TRPV1	18	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](N(C)Cc2ncccn2)C1	ZINC000450907225	GG	On-Demand	Anodyne	CACNA1B	52	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](N(C)Cc2ncccn2)C1	ZINC000450907225	GG	On-Demand	Anodyne	MCHR1	31	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@H](N(C)Cc2ncccn2)C1	ZINC000450907225	GG	On-Demand	Anodyne	LIPG	52	38
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](N(C)Cc2ncccn2)C1	ZINC000450907226	GG	On-Demand	Anodyne	TRPV1	18	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](N(C)Cc2ncccn2)C1	ZINC000450907226	GG	On-Demand	Anodyne	CACNA1B	52	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](N(C)Cc2ncccn2)C1	ZINC000450907226	GG	On-Demand	Anodyne	MCHR1	31	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](N(C)Cc2ncccn2)C1	ZINC000450907226	GG	On-Demand	Anodyne	LIPG	52	38
Cc1cc(F)ccc1[C@@H]1CCCN1c1nn2c(C)nnc2c2ccccc12	ZINC000450907235	FI	On-Demand	Anodyne	CREBBP	43	34
Cc1cc(F)ccc1[C@@H]1CCCN1c1nn2c(C)nnc2c2ccccc12	ZINC000450907235	FI	On-Demand	Anodyne	BRD9	55	35
Cc1cc(F)ccc1[C@H]1CCCN1c1nn2c(C)nnc2c2ccccc12	ZINC000450907236	FI	On-Demand	Anodyne	CREBBP	43	34
Cc1cc(F)ccc1[C@H]1CCCN1c1nn2c(C)nnc2c2ccccc12	ZINC000450907236	FI	On-Demand	Anodyne	BRD9	55	35
C=C(CC)CN=c1ccc(C(=O)N2CCC(C)CC2)c[nH]1	ZINC000450907237	CF	On-Demand	Mild	L3MBTL3	61	36
Cn1[nH]c([C@H]2CCCN2CC(=O)Nc2ccc3c(c2)OCO3)nc1=N	ZINC000450907238	EC	On-Demand	Anodyne	LDLR	0	40
Cn1[nH]c([C@H]2CCCN2CC(=O)Nc2ccc3c(c2)OCO3)nc1=N	ZINC000450907238	EC	On-Demand	Anodyne	NOS2	80	37
Cn1[nH]c([C@@H]2CCCN2CC(=O)Nc2ccc3c(c2)OCO3)nc1=N	ZINC000450907239	EC	On-Demand	Anodyne	LDLR	0	40
Cn1[nH]c([C@@H]2CCCN2CC(=O)Nc2ccc3c(c2)OCO3)nc1=N	ZINC000450907239	EC	On-Demand	Anodyne	NOS2	80	37
COc1ccc2ncc(=O)n(CC(=O)NC(=O)NCC(C)C)c2c1	ZINC000450907257	EC	On-Demand	Anodyne	MTNR1A	38	40
COc1ccc2ncc(=O)n(CC(=O)NC(=O)NCC(C)C)c2c1	ZINC000450907257	EC	On-Demand	Anodyne	MTNR1B	30	40
C=C(CC)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450907278	DC	On-Demand	Mild	TGM2	42	45
C=C(CC)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450907278	DC	On-Demand	Mild	GCKR	45	31
Cc1cc(N2CCC[C@H]2c2ccc(F)cc2F)ncn1	ZINC000450907280	CG	On-Demand	Anodyne	PRCP	43	36
Cc1cc(N2CCC[C@@H]2c2ccc(F)cc2F)ncn1	ZINC000450907281	CG	On-Demand	Anodyne	PRCP	43	36
Cc1cc(F)ccc1[C@@H]1CCCN1c1cc(N2CCCC2)ncn1	ZINC000450907284	EH	On-Demand	Anodyne	PRCP	50	48
Cc1cc(F)ccc1[C@H]1CCCN1c1cc(N2CCCC2)ncn1	ZINC000450907285	EH	On-Demand	Anodyne	PRCP	50	48
COc1ccc2ncc(=O)n(CC(=O)N(C)CCCOc3ccccc3)c2c1	ZINC000450907286	GE	On-Demand	Anodyne	TSPO	32	40
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](C)Cc3ccccc3C)c2c1	ZINC000450907287	FE	On-Demand	Anodyne	AVPR1B	43	39
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](C)Cc3ccccc3C)c2c1	ZINC000450907287	FE	On-Demand	Anodyne	CMA1	46	40
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](C)Cc3ccccc3C)c2c1	ZINC000450907287	FE	On-Demand	Anodyne	CTRA_BOVIN	48	40
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](C)Cc3ccccc3C)c2c1	ZINC000450907287	FE	On-Demand	Anodyne	CTRC	43	38
COc1ccc2ncc(=O)n(CC(=O)N[C@H](C)Cc3ccccc3C)c2c1	ZINC000450907288	FE	On-Demand	Anodyne	AVPR1B	43	39
COc1ccc2ncc(=O)n(CC(=O)N[C@H](C)Cc3ccccc3C)c2c1	ZINC000450907288	FE	On-Demand	Anodyne	CMA1	46	40
COc1ccc2ncc(=O)n(CC(=O)N[C@H](C)Cc3ccccc3C)c2c1	ZINC000450907288	FE	On-Demand	Anodyne	CTRA_BOVIN	48	40
COc1ccc2ncc(=O)n(CC(=O)N[C@H](C)Cc3ccccc3C)c2c1	ZINC000450907288	FE	On-Demand	Anodyne	CTRC	43	38
COc1ccc2ncc(=O)n(CC(=O)N(C)Cc3ccc(OC)c(OC)c3)c2c1	ZINC000450907294	GE	On-Demand	Anodyne	MT-ND1	25	45
Cn1[nH]c([C@@H]2CCCN2CCCOc2ccc(C(C)(C)C)cc2)nc1=N	ZINC000450907312	FG	On-Demand	Anodyne	HTR3A	21	41
Cn1[nH]c([C@@H]2CCCN2CCCOc2ccc(C(C)(C)C)cc2)nc1=N	ZINC000450907312	FG	On-Demand	Anodyne	HRH3	45	45
COc1cccc2c(N3CCC(OCCOC(C)C)CC3)c(C)cnc12	ZINC000450907318	FH	On-Demand	Anodyne	PDE3B	56	34
CC(C)OCCOC1CCN(c2ccccn2)CC1	ZINC000450907354	CE	On-Demand	Anodyne	AVPR1A	0	43
CC(C)OCCOC1CCN(c2ccccn2)CC1	ZINC000450907354	CE	On-Demand	Anodyne	EBP	29	40
CS(=O)(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)cc1	ZINC000450907355	FH	On-Demand	Anodyne	GPR119	25	43
COc1ccc2c(c1)c(=O)ncn2CCCCCC(C)=O	ZINC000450907374	CF	On-Demand	Anodyne	MTNR1A	45	39
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	F2	36	45
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	SERPINC1	0	44
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	OPRM1	30	44
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	OPRD1	24	44
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	GHRHR	43	33
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	P2RY12	126	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	MME	74	39
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	MC4R	97	42
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	TACR2	34	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	CTSB	33	45
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	TRY2_BOVIN	109	45
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	TRY1_BOVIN	29	45
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	CYSP_TRYCR	40	46
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	CTSL	25	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	CYP51A1	21	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	MC3R	42	35
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	MC5R	51	37
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	CAPNS1	55	31
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	MMP3	21	52
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	CCKBR	52	39
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	CTSS	30	45
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	CAPN1	80	42
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	ACE2	67	34
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	TGM2	22	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	PGA5	49	36
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	ST14	99	39
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	FPR1	42	33
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	Q9NBA7_PLAFA	0	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	SLC15A2	0	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	BLA1_STEMA	40	34
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	PSMB8	47	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	Q9N6S8_PLAFA	16	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	TMPRSS6	44	30
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907376	GA	On-Demand	Anodyne	DERP1	0	45
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	F2	36	45
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	SERPINC1	0	44
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	OPRM1	30	44
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	OPRD1	24	44
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	GHRHR	43	33
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	P2RY12	126	40
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	MME	74	39
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	MC4R	97	42
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	TACR2	34	41
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	CTSB	33	45
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	TRY2_BOVIN	109	45
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	TRY1_BOVIN	29	45
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	CYSP_TRYCR	40	46
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	CTSL	25	41
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	CYP51A1	21	41
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	MC3R	42	35
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	MC5R	51	37
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	CAPNS1	55	31
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	MMP3	21	52
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	CCKBR	52	39
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	CTSS	30	45
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	CAPN1	80	42
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	ACE2	67	34
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	TGM2	22	40
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	PGA5	49	36
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	ST14	99	39
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	FPR1	42	33
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	Q9NBA7_PLAFA	0	41
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	SLC15A2	0	41
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	BLA1_STEMA	40	34
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	PSMB8	47	41
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	Q9N6S8_PLAFA	16	40
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	TMPRSS6	44	30
CNS(=O)(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000450907377	GA	On-Demand	Anodyne	DERP1	0	45
Cc1cc(C)n(-c2ccc(N3CCC(OCCOC(C)C)CC3)nn2)n1	ZINC000450907378	FF	On-Demand	Anodyne	SCD1	41	35
CC(C)OCCOC1CCN(c2ccnc3ccccc23)CC1	ZINC000450907385	DH	On-Demand	Anodyne	HNMT	44	31
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)C(C)(C)C2CCC2)C1	ZINC000450907401	EG	On-Demand	Anodyne	C3AR1	40	36
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)C(C)(C)C2CCC2)C1	ZINC000450907402	EG	On-Demand	Anodyne	C3AR1	40	36
O=C(NCCO)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450907412	GD	On-Demand	Anodyne	SCD1	84	57
O=C(NCCO)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450907412	GD	On-Demand	Anodyne	SCD	73	52
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907422	FG	On-Demand	Anodyne	DRD2	31	44
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907422	FG	On-Demand	Anodyne	DRD1	16	46
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907422	FG	On-Demand	Anodyne	DRD4	0	47
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907422	FG	On-Demand	Anodyne	ERG2	20	44
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907422	FG	On-Demand	Anodyne	SLC18A3	0	49
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907422	FG	On-Demand	Anodyne	EBP	21	44
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907423	FG	On-Demand	Anodyne	DRD2	31	44
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907423	FG	On-Demand	Anodyne	DRD1	16	46
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907423	FG	On-Demand	Anodyne	DRD4	0	47
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907423	FG	On-Demand	Anodyne	ERG2	20	44
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907423	FG	On-Demand	Anodyne	SLC18A3	0	49
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450907423	FG	On-Demand	Anodyne	EBP	21	44
O=C(NCCO)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nn1	ZINC000450907428	GD	On-Demand	Anodyne	SCD1	73	57
O=C(NCCO)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nn1	ZINC000450907428	GD	On-Demand	Anodyne	SCD	58	52
NC(=O)c1cc(N2CCC(Cc3cc(F)ccc3F)CC2)ccn1	ZINC000450907430	EF	On-Demand	Anodyne	DPP4	27	47
NC(=O)c1cc(N2CCC(Cc3cc(F)ccc3F)CC2)ccn1	ZINC000450907430	EF	On-Demand	Anodyne	STAT6	45	42
CC(=O)[C@@](C)(O)CN1CCCc2c([nH]c3c(F)cccc23)C1	ZINC000450907439	DE	On-Demand	Anodyne	FABP4	42	36
CC(=O)[C@](C)(O)CN1CCCc2c([nH]c3c(F)cccc23)C1	ZINC000450907440	DE	On-Demand	Anodyne	FABP4	42	36
Fc1cccc(F)c1CC1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450907441	FG	On-Demand	Anodyne	PIK3CA	17	44
Fc1cccc(F)c1CC1CCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450907441	FG	On-Demand	Anodyne	SMG1	44	35
C=CCC1(C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)CCCCC1	ZINC000450907451	FH	On-Demand	Mild	C3AR1	41	34
C=CCC1(C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)CCCCC1	ZINC000450907452	FH	On-Demand	Mild	C3AR1	41	34
COc1ccc2ncc(=O)n(C[C@H]3CCN(C(=O)c4ccccc4)C3)c2c1	ZINC000450907456	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	54	33
COc1ccc2ncc(=O)n(C[C@H]3CCN(C(=O)c4ccccc4)C3)c2c1	ZINC000450907456	FF	On-Demand	Anodyne	MAP3K12	31	41
COc1ccc2ncc(=O)n(C[C@@H]3CCN(C(=O)c4ccccc4)C3)c2c1	ZINC000450907457	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	54	33
COc1ccc2ncc(=O)n(C[C@@H]3CCN(C(=O)c4ccccc4)C3)c2c1	ZINC000450907457	FF	On-Demand	Anodyne	MAP3K12	31	41
Fc1ccc(F)c(CC2CCN(c3ccnc(N4CCOCC4)n3)CC2)c1	ZINC000450907458	FG	On-Demand	Anodyne	SMG1	42	37
COC(=O)[C@@H]1CN(Cc2cn(CC3CC3)nn2)C[C@H]1c1ccccc1	ZINC000450907459	EE	On-Demand	Anodyne	SLC6A3	23	40
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450907464	GF	On-Demand	Anodyne	GRIN2B	17	40
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450907464	GF	On-Demand	Anodyne	C3AR1	41	35
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450907465	GF	On-Demand	Anodyne	GRIN2B	17	40
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450907465	GF	On-Demand	Anodyne	C3AR1	41	35
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450907466	GF	On-Demand	Anodyne	GRIN2B	17	40
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450907466	GF	On-Demand	Anodyne	C3AR1	41	35
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450907467	GF	On-Demand	Anodyne	GRIN2B	17	40
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450907467	GF	On-Demand	Anodyne	C3AR1	41	35
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(C[C@H]2CCC(F)(F)C2)C1=O	ZINC000450907468	FH	On-Demand	Anodyne	TACR3	47	38
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(C[C@@H]2CCC(F)(F)C2)C1=O	ZINC000450907469	FH	On-Demand	Anodyne	TACR3	47	38
C[C@]1(c2ccc(F)c(Cl)c2)NC(=O)N(C[C@@H]2CCC(F)(F)C2)C1=O	ZINC000450907470	FH	On-Demand	Anodyne	TACR3	47	38
C[C@@]1(c2ccc(F)c(Cl)c2)NC(=O)N(C[C@H]2CCC(F)(F)C2)C1=O	ZINC000450907471	FH	On-Demand	Anodyne	TACR3	47	38
Cc1nc(N2CCC(Cc3cc(F)ccc3F)CC2)ncc1[N+](=O)[O-]	ZINC000450907487	EG	On-Demand	Bother	PRKCQ	24	44
Cc1cc(C)c(CNc2nc(N(C)C)c3ccccc3n2)cn1	ZINC000450907525	DF	On-Demand	Anodyne	ADRA2A	16	46
COC(=O)c1cnc(SCCCCCC(C)=O)[nH]1	ZINC000450907528	CE	On-Demand	Anodyne	HDA106	0	43
Cc1cc(C(F)(F)F)ccc1C(=O)N(CC1CC1)C[C@@H]1CN(C)CCO1	ZINC000450907586	FG	On-Demand	Anodyne	OXTR	25	51
Cc1cc(C(F)(F)F)ccc1C(=O)N(CC1CC1)C[C@@H]1CN(C)CCO1	ZINC000450907586	FG	On-Demand	Anodyne	AVPR1A	0	51
Cc1cc(C(F)(F)F)ccc1C(=O)N(CC1CC1)C[C@@H]1CN(C)CCO1	ZINC000450907586	FG	On-Demand	Anodyne	MCHR1	28	43
Cc1cc(C(F)(F)F)ccc1C(=O)N(CC1CC1)C[C@@H]1CN(C)CCO1	ZINC000450907586	FG	On-Demand	Anodyne	LIPG	53	39
Cc1cc(C(F)(F)F)ccc1C(=O)N(CC1CC1)C[C@H]1CN(C)CCO1	ZINC000450907587	FG	On-Demand	Anodyne	OXTR	25	51
Cc1cc(C(F)(F)F)ccc1C(=O)N(CC1CC1)C[C@H]1CN(C)CCO1	ZINC000450907587	FG	On-Demand	Anodyne	AVPR1A	0	51
Cc1cc(C(F)(F)F)ccc1C(=O)N(CC1CC1)C[C@H]1CN(C)CCO1	ZINC000450907587	FG	On-Demand	Anodyne	MCHR1	28	43
Cc1cc(C(F)(F)F)ccc1C(=O)N(CC1CC1)C[C@H]1CN(C)CCO1	ZINC000450907587	FG	On-Demand	Anodyne	LIPG	53	39
CNC(=O)c1cccnc1NCc1cnc(C)cc1C	ZINC000450907610	CE	On-Demand	Anodyne	BDKRB1	0	42
O=C(CCN1CCC[C@H](c2nnc(O)o2)C1)N1CCN(c2ncccn2)CC1	ZINC000450907613	GC	On-Demand	Anodyne	SLC6A7	0	41
O=C(CCN1CCC[C@@H](c2nnc(O)o2)C1)N1CCN(c2ncccn2)CC1	ZINC000450907614	GC	On-Demand	Anodyne	SLC6A7	0	41
Cn1ncn(CCCCc2ccc(Cl)c(Cl)c2)c1=O	ZINC000450907615	DF	On-Demand	Anodyne	DNAE	75	36
Cc1nn(C)c(C)c1NC(=O)CN(C)c1cccc2cccnc12	ZINC000450907626	DF	On-Demand	Anodyne	C0L093_TOBAC	56	32
Cc1ccc(OCCCN2CCC[C@H](c3nnc(O)o3)C2)cc1C	ZINC000450907649	EG	On-Demand	Anodyne	KCNH2	0	41
Cc1ccc(OCCCN2CCC[C@H](c3nnc(O)o3)C2)cc1C	ZINC000450907649	EG	On-Demand	Anodyne	HRH4	31	42
Cc1ccc(OCCCN2CCC[C@H](c3nnc(O)o3)C2)cc1C	ZINC000450907649	EG	On-Demand	Anodyne	MEN1	40	31
Cc1ccc(OCCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1C	ZINC000450907650	EG	On-Demand	Anodyne	KCNH2	0	41
Cc1ccc(OCCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1C	ZINC000450907650	EG	On-Demand	Anodyne	HRH4	31	42
Cc1ccc(OCCCN2CCC[C@@H](c3nnc(O)o3)C2)cc1C	ZINC000450907650	EG	On-Demand	Anodyne	MEN1	40	31
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450907677	FF	On-Demand	Bother	EEF1A1	0	49
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450907677	FF	On-Demand	Bother	EEF1A2	0	49
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450907678	FF	On-Demand	Bother	EEF1A1	0	49
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450907678	FF	On-Demand	Bother	EEF1A2	0	49
Cn1[nH]c([C@H]2CCCN2CCCOc2ccc(C(C)(C)C)cc2)nc1=N	ZINC000450907695	FG	On-Demand	Anodyne	HTR3A	21	41
Cn1[nH]c([C@H]2CCCN2CCCOc2ccc(C(C)(C)C)cc2)nc1=N	ZINC000450907695	FG	On-Demand	Anodyne	HRH3	45	45
C=C(CC)CNc1cc(COC)nc2ncnn12	ZINC000450907705	BD	On-Demand	Mild	DHOD	0	44
COc1cc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2nccn2C)ccc1Cl	ZINC000450907713	GE	On-Demand	Anodyne	ITGA4	30	40
COC(=O)c1ccc(COc2ccc3c(c2)CCCNC3=O)cc1Cl	ZINC000450907716	FG	On-Demand	Anodyne	MAOB	30	46
COC(=O)c1ccc(COc2ccc3c(c2)CCCNC3=O)cc1Cl	ZINC000450907716	FG	On-Demand	Anodyne	CSNK1G2	44	31
C=CCC[C@@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000450907731	CD	On-Demand	Mild	ADORA1	35	44
COc1ccc2ncc(=O)n(CC(=O)N[C@H](C)C(C)C)c2c1	ZINC000450907732	DD	On-Demand	Anodyne	AVPR1B	58	42
COc1ccc2ncc(=O)n(CC(=O)N[C@H](C)C(C)C)c2c1	ZINC000450907732	DD	On-Demand	Anodyne	MTNR1A	42	39
C=CCC[C@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000450907733	CD	On-Demand	Mild	ADORA1	35	44
CCOC(=O)c1ccc(CSc2nc3ccc(F)cc3c(=O)n2CC)nc1	ZINC000450907736	GG	On-Demand	Anodyne	PTGDR2	15	42
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](C)C(C)C)c2c1	ZINC000450907740	DD	On-Demand	Anodyne	AVPR1B	58	42
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](C)C(C)C)c2c1	ZINC000450907740	DD	On-Demand	Anodyne	MTNR1A	42	39
CN(C(=O)[C@H]1CCN(CC2=CCCCC2)C1)c1ccccc1	ZINC000450907751	CG	On-Demand	Anodyne	SLC6A1	71	37
CN(C(=O)[C@H]1CCN(CC2=CCCCC2)C1)c1ccccc1	ZINC000450907751	CG	On-Demand	Anodyne	MLNR	19	45
CN(C(=O)[C@@H]1CCN(CC2=CCCCC2)C1)c1ccccc1	ZINC000450907752	CG	On-Demand	Anodyne	SLC6A1	71	37
CN(C(=O)[C@@H]1CCN(CC2=CCCCC2)C1)c1ccccc1	ZINC000450907752	CG	On-Demand	Anodyne	MLNR	19	45
CCN(CC)S(=O)(=O)c1ccc(NCc2cnc(C3CC3)o2)c([N+](=O)[O-])c1	ZINC000450907756	GG	On-Demand	Bother	BDKRB1	21	40
O=[N+]([O-])c1cc(Cl)ccc1NCc1cnc(C2CC2)o1	ZINC000450907765	CH	On-Demand	Bother	PRKCQ	23	41
CCOC(=O)CCCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450907786	DF	On-Demand	Anodyne	GSG2	48	40
O=C([C@@H](O)C1CCC1)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450907788	EF	On-Demand	Anodyne	AMY2	45	32
O=C([C@H](O)C1CCC1)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450907791	EF	On-Demand	Anodyne	AMY2	45	32
CC1=CCCN(Cc2ccccc2OC2CC2)C1	ZINC000450907795	BG	On-Demand	Anodyne	CHRNA6	0	44
CCCC[C@H](NC(=O)[C@@]1(OC(C)C)CCOC1)C(=O)OC(C)(C)C	ZINC000450907796	EF	On-Demand	Anodyne	CTSK	23	42
CCCC[C@@H](NC(=O)[C@]1(OC(C)C)CCOC1)C(=O)OC(C)(C)C	ZINC000450907797	EF	On-Demand	Anodyne	CTSK	23	42
CCCC[C@H](NC(=O)[C@]1(OC(C)C)CCOC1)C(=O)OC(C)(C)C	ZINC000450907799	EF	On-Demand	Anodyne	CTSK	23	42
CCCC[C@@H](NC(=O)[C@@]1(OC(C)C)CCOC1)C(=O)OC(C)(C)C	ZINC000450907801	EF	On-Demand	Anodyne	CTSK	23	42
COCc1cc(N2CCC[C@H]2c2ccc(F)cc2C)n2ncnc2n1	ZINC000450907812	EG	On-Demand	Anodyne	DHOD	0	40
COCc1cc(N2CCC[C@@H]2c2ccc(F)cc2C)n2ncnc2n1	ZINC000450907816	EG	On-Demand	Anodyne	DHOD	0	40
c1ccc(CCN(Cc2cccnc2)Cc2cnns2)nc1	ZINC000450907848	DF	On-Demand	Anodyne	NR1D1	46	38
COC(=O)[C@H](C)N(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450907862	CD	On-Demand	Anodyne	AOC3	35	40
COC(=O)[C@H](C)N(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450907863	CD	On-Demand	Anodyne	AOC3	35	40
COC(=O)[C@H](C)N(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450907864	CD	On-Demand	Anodyne	AOC3	35	40
COC(=O)[C@H](C)N(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450907866	CD	On-Demand	Anodyne	AOC3	35	40
C=C(CC)CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450907887	DE	On-Demand	Mild	BDKRB1	0	47
C=C(CC)CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450907887	DE	On-Demand	Mild	COLA	46	31
COc1ccc2ncc(=O)n(CC(=O)N[C@H](c3ccccc3)C3CCCC3)c2c1	ZINC000450907890	GG	On-Demand	Anodyne	AVPR1B	71	40
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](c3ccccc3)C3CCCC3)c2c1	ZINC000450907891	GG	On-Demand	Anodyne	AVPR1B	71	40
Cn1[nH]c([C@@H]2CCCN2C[C@H](O)COc2ccc3c(c2)OCO3)nc1=N	ZINC000450907900	FC	On-Demand	Anodyne	SSTR3	55	31
Cn1[nH]c([C@H]2CCCN2C[C@@H](O)COc2ccc3c(c2)OCO3)nc1=N	ZINC000450907901	FC	On-Demand	Anodyne	SSTR3	55	31
Cn1[nH]c([C@H]2CCCN2C[C@H](O)COc2ccc3c(c2)OCO3)nc1=N	ZINC000450907902	FC	On-Demand	Anodyne	SSTR3	55	31
Cn1[nH]c([C@@H]2CCCN2C[C@@H](O)COc2ccc3c(c2)OCO3)nc1=N	ZINC000450907903	FC	On-Demand	Anodyne	SSTR3	55	31
CC(C)OCCOC1CCN(c2nc3ccccc3[nH]2)CC1	ZINC000450907925	DF	On-Demand	Anodyne	KCNN3	24	41
CC(C)OCCOC1CCN(c2ccc(C(F)(F)F)nn2)CC1	ZINC000450907931	EF	On-Demand	Anodyne	SCD1	33	41
CC[C@@]1(C2CC2)NC(=O)N(CCc2ccc(Cl)cc2)C1=O	ZINC000450907935	DF	On-Demand	Anodyne	CACNA1C	25	42
CC[C@@]1(C2CC2)NC(=O)N(CCc2ccc(Cl)cc2)C1=O	ZINC000450907935	DF	On-Demand	Anodyne	CACNA1D	75	42
CC[C@]1(C2CC2)NC(=O)N(CCc2ccc(Cl)cc2)C1=O	ZINC000450907936	DF	On-Demand	Anodyne	CACNA1C	25	42
CC[C@]1(C2CC2)NC(=O)N(CCc2ccc(Cl)cc2)C1=O	ZINC000450907936	DF	On-Demand	Anodyne	CACNA1D	75	42
CC(C)C[C@H](C)Sc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C	ZINC000450907950	DG	On-Demand	Bother	F2RL3	43	31
CC(C)C[C@@H](C)Sc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C	ZINC000450907951	DG	On-Demand	Bother	F2RL3	43	31
CC(C)OCCOC1CCN(c2ccnc(N(C)C)n2)CC1	ZINC000450907952	DD	On-Demand	Anodyne	SORD	71	34
O=C(CCCN1CCC[C@@H]1[C@H]1COCC[C@@H]1O)c1ccccc1	ZINC000450907956	DF	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCC[C@@H]1[C@@H]1COCC[C@@H]1O)c1ccccc1	ZINC000450907957	DF	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCC[C@@H]1[C@@H]1COCC[C@H]1O)c1ccccc1	ZINC000450907958	DF	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCC[C@@H]1[C@H]1COCC[C@H]1O)c1ccccc1	ZINC000450907959	DF	On-Demand	Anodyne	CYP2J2	56	39
COc1cccc(OCCC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450907968	FG	On-Demand	Anodyne	COLA	68	47
COc1cccc(OCCC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450907968	FG	On-Demand	Anodyne	CPT1A	53	47
COc1cccc(OCCC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450907968	FG	On-Demand	Anodyne	SMO	50	45
COc1cccc(OCCC(=O)N2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000450907968	FG	On-Demand	Anodyne	ETHR	90	50
CC(C)OCCOC1CCN(c2cncc(Br)c2)CC1	ZINC000450907979	EG	On-Demand	Anodyne	CHRNA3	15	43
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907992	EH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907992	EH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907992	EH	On-Demand	Anodyne	HTR2A	22	47
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907992	EH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907992	EH	On-Demand	Anodyne	SLC18A3	23	45
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907992	EH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907992	EH	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907993	EH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907993	EH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907993	EH	On-Demand	Anodyne	HTR2A	22	47
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907993	EH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907993	EH	On-Demand	Anodyne	SLC18A3	23	45
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907993	EH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907993	EH	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907994	EH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907994	EH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907994	EH	On-Demand	Anodyne	HTR2A	22	47
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907994	EH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907994	EH	On-Demand	Anodyne	SLC18A3	23	45
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907994	EH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450907994	EH	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907995	EH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907995	EH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907995	EH	On-Demand	Anodyne	HTR2A	22	47
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907995	EH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907995	EH	On-Demand	Anodyne	SLC18A3	23	45
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907995	EH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450907995	EH	On-Demand	Anodyne	CYP2J2	49	34
CC(C)OCCOC1CCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000450907999	FH	On-Demand	Mild	AR	54	44
CN(CC(=O)OC(C)(C)C)[C@H]1CN(Cc2cccc(S(C)(=O)=O)c2)C[C@H]1O	ZINC000450908000	GC	On-Demand	Anodyne	CACNA1B	46	33
CN(CC(=O)OC(C)(C)C)[C@@H]1CN(Cc2cccc(S(C)(=O)=O)c2)C[C@H]1O	ZINC000450908001	GC	On-Demand	Anodyne	CACNA1B	46	33
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450908006	EG	On-Demand	Anodyne	SCN9A	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450908007	EG	On-Demand	Anodyne	SCN9A	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450908008	EG	On-Demand	Anodyne	SCN9A	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450908009	EG	On-Demand	Anodyne	SCN9A	0	41
CC(C)(C)S(=O)(=O)c1ccc(NCc2ccc(C#N)c(F)c2)cn1	ZINC000450908024	EG	On-Demand	Mild	MAP3K8	58	39
CNC(=O)c1ccc(N2CCC[C@]3(CCSC3)C2)c([N+](=O)[O-])c1	ZINC000450908026	EF	On-Demand	Bother	TAAR1	15	45
CNC(=O)c1ccc(N2CCC[C@@]3(CCSC3)C2)c([N+](=O)[O-])c1	ZINC000450908027	EF	On-Demand	Bother	TAAR1	15	45
Cc1ccc(F)c(CN2C(=O)N[C@]3(CCN(Cc4ccccc4)C3)C2=O)c1	ZINC000450908028	FF	On-Demand	Anodyne	SIGMAR1	29	40
Cc1ccc(F)c(CN2C(=O)N[C@@]3(CCN(Cc4ccccc4)C3)C2=O)c1	ZINC000450908029	FF	On-Demand	Anodyne	SIGMAR1	29	40
COc1ccc2ncc(=O)n(CCCc3ccc(C)cc3)c2c1	ZINC000450908030	DG	On-Demand	Anodyne	GSG2	42	38
COc1cc2c(N3CCC[C@]4(CCSC4)C3)ncnc2cc1F	ZINC000450908041	EH	On-Demand	Anodyne	PDE3A	50	39
COc1cc2c(N3CCC[C@]4(CCSC4)C3)ncnc2cc1F	ZINC000450908041	EH	On-Demand	Anodyne	PDGFRB	55	39
COc1cc2c(N3CCC[C@]4(CCSC4)C3)ncnc2cc1F	ZINC000450908041	EH	On-Demand	Anodyne	PDE3B	48	39
COc1ccc(CNC(=O)CCN[C@@H]2C(=O)NCC[C@H]2C)c(OC)c1	ZINC000450908042	EC	On-Demand	Anodyne	MTNR1A	48	36
COc1cc2c(N3CCC[C@@]4(CCSC4)C3)ncnc2cc1F	ZINC000450908043	EH	On-Demand	Anodyne	PDE3A	50	39
COc1cc2c(N3CCC[C@@]4(CCSC4)C3)ncnc2cc1F	ZINC000450908043	EH	On-Demand	Anodyne	PDGFRB	55	39
COc1cc2c(N3CCC[C@@]4(CCSC4)C3)ncnc2cc1F	ZINC000450908043	EH	On-Demand	Anodyne	PDE3B	48	39
COc1ccc(CNC(=O)CCN[C@@H]2C(=O)NCC[C@@H]2C)c(OC)c1	ZINC000450908044	EC	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@H]2C(=O)NCC[C@H]2C)c(OC)c1	ZINC000450908045	EC	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN[C@H]2C(=O)NCC[C@@H]2C)c(OC)c1	ZINC000450908047	EC	On-Demand	Anodyne	MTNR1A	48	36
CN1CCN(c2nc3ccccc3nc2N2CCC[C@]3(CCSC3)C2)CC1	ZINC000450908055	GG	On-Demand	Anodyne	HTR3A	29	47
CN1CCN(c2nc3ccccc3nc2N2CCC[C@]3(CCSC3)C2)CC1	ZINC000450908055	GG	On-Demand	Anodyne	HRH4	41	47
CN1CCN(c2nc3ccccc3nc2N2CCC[C@@]3(CCSC3)C2)CC1	ZINC000450908058	GG	On-Demand	Anodyne	HTR3A	29	47
CN1CCN(c2nc3ccccc3nc2N2CCC[C@@]3(CCSC3)C2)CC1	ZINC000450908058	GG	On-Demand	Anodyne	HRH4	41	47
O[C@H]1C[C@@H](c2cccc(F)c2)N(Cc2ccccc2OC2CC2)C1	ZINC000450908059	EH	On-Demand	Anodyne	SLC5A4	45	35
O[C@@H]1C[C@H](c2cccc(F)c2)N(Cc2ccccc2OC2CC2)C1	ZINC000450908061	EH	On-Demand	Anodyne	SLC5A4	45	35
O[C@@H]1C[C@@H](c2cccc(F)c2)N(Cc2ccccc2OC2CC2)C1	ZINC000450908063	EH	On-Demand	Anodyne	SLC5A4	45	35
O[C@H]1C[C@H](c2cccc(F)c2)N(Cc2ccccc2OC2CC2)C1	ZINC000450908066	EH	On-Demand	Anodyne	SLC5A4	45	35
C[C@H](O)CCN1CC[C@H](c2ccccc2)C[C@@H]1C	ZINC000450908098	BG	On-Demand	Anodyne	SLC18A3	47	35
N#Cc1ccc(CNc2ncc(C(=O)N3CCCCC3)cc2Cl)cc1F	ZINC000450908099	FH	On-Demand	Mild	MAP3K8	44	35
C[C@H](O)CCN1CC[C@@H](c2ccccc2)C[C@H]1C	ZINC000450908100	BG	On-Demand	Anodyne	SLC18A3	47	35
C[C@H](O)CCN1CC[C@@H](c2ccccc2)C[C@@H]1C	ZINC000450908101	BG	On-Demand	Anodyne	SLC18A3	47	35
C[C@H](O)CCN1CC[C@H](c2ccccc2)C[C@H]1C	ZINC000450908102	BG	On-Demand	Anodyne	SLC18A3	47	35
CNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450908104	EF	On-Demand	Anodyne	SCD1	73	52
CC(=O)c1cccc(CN2CCN(c3cnccc3C)CC2)c1	ZINC000450908108	DF	On-Demand	Anodyne	HTR1A	32	47
CC(=O)c1cccc(CN2CCN(c3cnccc3C)CC2)c1	ZINC000450908108	DF	On-Demand	Anodyne	DRD2	31	47
CC(=O)c1cccc(CN2CCN(c3cnccc3C)CC2)c1	ZINC000450908108	DF	On-Demand	Anodyne	DRD4	50	44
CC(=O)c1cccc(CN2CCN(c3cnccc3C)CC2)c1	ZINC000450908108	DF	On-Demand	Anodyne	FAAH	23	40
CCS(=O)(=O)c1ccc(COc2ccc3c(c2)CCC3=O)cc1	ZINC000450908123	EG	On-Demand	Anodyne	MAOB	47	58
CCS(=O)(=O)c1ccc(COc2ccc3c(c2)CCC3=O)cc1	ZINC000450908123	EG	On-Demand	Anodyne	ADAMTS4	24	52
COc1ccc2ncc(=O)n(CCCCF)c2c1	ZINC000450908131	CE	On-Demand	Anodyne	GSG2	62	46
CCCOc1cccc(CN2C(=O)N[C@@]3(CCN(Cc4ccccc4)C3)C2=O)c1	ZINC000450908148	GG	On-Demand	Anodyne	HRH2	41	46
CCCOc1cccc(CN2C(=O)N[C@@]3(CCN(Cc4ccccc4)C3)C2=O)c1	ZINC000450908148	GG	On-Demand	Anodyne	CHRM3	18	42
CCCOc1cccc(CN2C(=O)N[C@@]3(CCN(Cc4ccccc4)C3)C2=O)c1	ZINC000450908148	GG	On-Demand	Anodyne	SIGMAR1	25	42
CCCOc1cccc(CN2C(=O)N[C@]3(CCN(Cc4ccccc4)C3)C2=O)c1	ZINC000450908151	GG	On-Demand	Anodyne	HRH2	41	46
CCCOc1cccc(CN2C(=O)N[C@]3(CCN(Cc4ccccc4)C3)C2=O)c1	ZINC000450908151	GG	On-Demand	Anodyne	CHRM3	18	42
CCCOc1cccc(CN2C(=O)N[C@]3(CCN(Cc4ccccc4)C3)C2=O)c1	ZINC000450908151	GG	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cnc(C)cc1C	ZINC000450908161	ED	On-Demand	Anodyne	CA2	44	48
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cnc(C)cc1C	ZINC000450908161	ED	On-Demand	Anodyne	CA4	41	38
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cnc(C)cc1C	ZINC000450908161	ED	On-Demand	Anodyne	CA5A	45	35
O=C(c1ccc(N2CCC[C@@]3(CCSC3)C2)nc1)N1CCc2ccccc21	ZINC000450908168	GI	On-Demand	Anodyne	AVPR2	52	42
O=C(c1ccc(N2CCC[C@]3(CCSC3)C2)nc1)N1CCc2ccccc21	ZINC000450908169	GI	On-Demand	Anodyne	AVPR2	52	42
CSc1cccc(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)c1	ZINC000450908184	EF	On-Demand	Anodyne	OXTR	27	47
CSc1cccc(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)c1	ZINC000450908184	EF	On-Demand	Anodyne	AVPR1A	0	47
CSc1cccc(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)c1	ZINC000450908186	EF	On-Demand	Anodyne	OXTR	27	47
CSc1cccc(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)c1	ZINC000450908186	EF	On-Demand	Anodyne	AVPR1A	0	47
CCCOc1cccc(Cn2ncsc2=O)c1	ZINC000450908188	CE	On-Demand	Anodyne	UPP1	44	39
COc1ccc2ncc(=O)n(CCCC(=O)OC(C)(C)C)c2c1	ZINC000450908193	DF	On-Demand	Anodyne	GSG2	41	37
Cc1ccncc1N1CCN(CC[C@@H](C)O)CC1	ZINC000450908194	BD	On-Demand	Anodyne	HTR1A	17	41
Cc1ccncc1N1CCN(CC[C@H](C)O)CC1	ZINC000450908195	BD	On-Demand	Anodyne	HTR1A	17	41
CO[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@H](C)C1	ZINC000450908208	CE	On-Demand	Anodyne	VACHT_TETCF	0	42
CO[C@H]1CCN(C[C@H](O)Cc2ccccc2)[C@@H](C)C1	ZINC000450908209	CE	On-Demand	Anodyne	VACHT_TETCF	0	42
O=S(=O)(NCC1CC1)c1ccc(NCc2cnc(C3CC3)o2)nc1	ZINC000450908228	ED	On-Demand	Anodyne	NPY1R	40	32
Cc1ccn2ncc(C(=O)NC[C@@H]3C[C@H](F)CN3Cc3csc(C)n3)c2c1	ZINC000450908237	GF	On-Demand	Anodyne	EPHB3	27	40
CCn1c(SC[C@@H]2CCCC2(F)F)nc2ccc(F)cc2c1=O	ZINC000450908307	EI	On-Demand	Anodyne	Q8MHZ5_SHEEP	61	38
CCn1c(SC[C@H]2CCCC2(F)F)nc2ccc(F)cc2c1=O	ZINC000450908308	EI	On-Demand	Anodyne	Q8MHZ5_SHEEP	61	38
N#Cc1ccc(SC[C@H]2C[C@H]3CC[C@H]2O3)cc1C(F)(F)F	ZINC000450908315	DI	On-Demand	Mild	AR	42	63
N#Cc1ccc(SC[C@@H]2C[C@H]3CC[C@H]2O3)cc1C(F)(F)F	ZINC000450908316	DI	On-Demand	Mild	AR	42	63
N#CC1(COc2ccc(Cl)c(F)c2)CCC1	ZINC000450908333	BH	On-Demand	Mild	TRPV4	33	40
COC(=O)c1cc(F)c(C)c(OCc2cn(CC3CC3)nn2)c1	ZINC000450908336	DF	On-Demand	Anodyne	MAPK13	48	31
CCN(CC)C(=O)c1ccc(NC(=O)CN(C)c2cccc3cccnc23)cc1	ZINC000450908346	GH	On-Demand	Anodyne	OPRD1	21	45
CCCCCSCc1ccn(CC(F)(F)F)n1	ZINC000450908384	CH	On-Demand	Anodyne	EST1_PIG	42	35
CCc1cccc(NC(=O)CN2CCC[C@@H](c3nnc(O)o3)C2)c1	ZINC000450908389	EE	On-Demand	Anodyne	RHOA	0	41
CCc1cccc(NC(=O)CN2CCC[C@H](c3nnc(O)o3)C2)c1	ZINC000450908390	EE	On-Demand	Anodyne	RHOA	0	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450908417	FH	On-Demand	Anodyne	CHRM5	36	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450908418	FH	On-Demand	Anodyne	CHRM5	36	40
CC(C)OCCOC1CCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000450908419	FG	On-Demand	Anodyne	SORD	71	39
CC(C)OCCOC1CCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000450908419	FG	On-Demand	Anodyne	SCD1	19	41
CN(CCSc1cccc(O)c1)Cc1ccccc1	ZINC000450908440	CH	On-Demand	Anodyne	FDPS	15	45
CN(CCSc1cccc(O)c1)Cc1ccccc1	ZINC000450908440	CH	On-Demand	Anodyne	HSD17B2	25	40
Cc1cc(C#N)nc(N2CCC(OCCOC(C)C)CC2)n1	ZINC000450908455	DE	On-Demand	Mild	GPR119	18	42
COCCOC[C@@H](O)CN1CCC(F)(c2ccccc2OC(F)(F)F)CC1	ZINC000450908472	GF	On-Demand	Anodyne	ABCB1	49	41
COCCOC[C@@H](O)CN1CCC(F)(c2ccccc2OC(F)(F)F)CC1	ZINC000450908472	GF	On-Demand	Anodyne	HSP90AB1	39	45
COCCOC[C@H](O)CN1CCC(F)(c2ccccc2OC(F)(F)F)CC1	ZINC000450908473	GF	On-Demand	Anodyne	ABCB1	49	41
COCCOC[C@H](O)CN1CCC(F)(c2ccccc2OC(F)(F)F)CC1	ZINC000450908473	GF	On-Demand	Anodyne	HSP90AB1	39	45
CN(CCCN1CCCC1)Cc1ccn(CC(F)(F)F)n1	ZINC000450908478	DE	On-Demand	Anodyne	HNMT	31	40
COC(=O)c1ccc(CN2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)cc1Cl	ZINC000450908490	FH	On-Demand	Anodyne	DRD2	41	35
Cc1nccnc1N1CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450908491	DF	On-Demand	Anodyne	DRD4	28	41
COC(=O)c1ccc(CN2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cc1Cl	ZINC000450908492	FH	On-Demand	Anodyne	DRD2	41	35
COC(=O)c1ccc(CN2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cc1Cl	ZINC000450908495	FH	On-Demand	Anodyne	DRD2	41	35
COC(=O)c1ccc(CN2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cc1Cl	ZINC000450908498	FH	On-Demand	Anodyne	DRD2	41	35
Cc1cc(C)c(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)cn1	ZINC000450908511	FF	On-Demand	Anodyne	LRRK2	28	44
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc3cnccc3c2)C1	ZINC000450908528	EE	On-Demand	Anodyne	OXTR	28	46
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc3cnccc3c2)C1	ZINC000450908528	EE	On-Demand	Anodyne	AVPR1A	18	46
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc3cnccc3c2)C1	ZINC000450908533	EE	On-Demand	Anodyne	OXTR	28	46
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc3cnccc3c2)C1	ZINC000450908533	EE	On-Demand	Anodyne	AVPR1A	18	46
Oc1nnc([C@@H]2CCCN(CCn3ccc4cc(Cl)ccc43)C2)o1	ZINC000450908550	EG	On-Demand	Anodyne	HTR7	0	46
Oc1nnc([C@H]2CCCN(CCn3ccc4cc(Cl)ccc43)C2)o1	ZINC000450908552	EG	On-Demand	Anodyne	HTR7	0	46
CO[C@H](COc1ccc2c(c1)CCC2=O)Cc1ccccc1	ZINC000450908562	CG	On-Demand	Anodyne	MAOB	27	46
CO[C@H](COc1ccc2c(c1)CCC2=O)Cc1ccccc1	ZINC000450908562	CG	On-Demand	Anodyne	PDS	42	35
CO[C@@H](COc1ccc2c(c1)CCC2=O)Cc1ccccc1	ZINC000450908563	CG	On-Demand	Anodyne	MAOB	27	46
CO[C@@H](COc1ccc2c(c1)CCC2=O)Cc1ccccc1	ZINC000450908563	CG	On-Demand	Anodyne	PDS	42	35
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450908569	EE	On-Demand	Anodyne	OXTR	24	41
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450908569	EE	On-Demand	Anodyne	AVPR1A	15	41
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450908571	EE	On-Demand	Anodyne	OXTR	24	41
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450908571	EE	On-Demand	Anodyne	AVPR1A	15	41
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)CC1	ZINC000450908599	FG	On-Demand	Anodyne	SFRP1	48	34
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)CC1	ZINC000450908599	FG	On-Demand	Anodyne	WNT3	43	34
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)CC1	ZINC000450908602	FG	On-Demand	Anodyne	SFRP1	48	34
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2C(F)(F)F)CC1	ZINC000450908602	FG	On-Demand	Anodyne	WNT3	43	34
CCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nn1	ZINC000450908611	EF	On-Demand	Anodyne	SCD1	28	41
CCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nn1	ZINC000450908611	EF	On-Demand	Anodyne	SCD	28	40
CCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nn1	ZINC000450908613	EF	On-Demand	Anodyne	SCD1	28	41
CCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nn1	ZINC000450908613	EF	On-Demand	Anodyne	SCD	28	40
CC[C@H](O)CC(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450908614	EF	On-Demand	Anodyne	AMY2	48	34
CC[C@@H](O)CC(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450908615	EF	On-Demand	Anodyne	AMY2	48	34
C=CCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450908627	BE	On-Demand	Mild	GSG2	42	37
CCCN(CCc1cccs1)C(=O)C[C@H](O)CC	ZINC000450908642	CF	On-Demand	Anodyne	ADAM17	0	41
CCCN(CCc1cccs1)C(=O)C[C@@H](O)CC	ZINC000450908644	CF	On-Demand	Anodyne	ADAM17	0	41
FC(F)(F)c1cccnc1N1CCC[C@@]2(CCSC2)C1	ZINC000450908650	DH	On-Demand	Anodyne	TRPV1	28	43
FC(F)(F)c1cccnc1N1CCC[C@]2(CCSC2)C1	ZINC000450908652	DH	On-Demand	Anodyne	TRPV1	25	43
COC(=O)c1cc2ccc(OCC[C@@H](C)O)cc2o1	ZINC000450908659	CE	On-Demand	Anodyne	MAOB	23	48
COC(=O)c1cc2ccc(OCC[C@@H](C)O)cc2o1	ZINC000450908659	CE	On-Demand	Anodyne	CA7	22	43
COC(=O)c1cc2ccc(OCC[C@@H](C)O)cc2o1	ZINC000450908659	CE	On-Demand	Anodyne	SLC16A3	0	41
COC(=O)c1cc2ccc(OCC[C@H](C)O)cc2o1	ZINC000450908665	CE	On-Demand	Anodyne	MAOB	23	48
COC(=O)c1cc2ccc(OCC[C@H](C)O)cc2o1	ZINC000450908665	CE	On-Demand	Anodyne	CA7	22	43
COC(=O)c1cc2ccc(OCC[C@H](C)O)cc2o1	ZINC000450908665	CE	On-Demand	Anodyne	SLC16A3	0	41
CC(=O)N[C@H](C(=O)N1CC[C@@H](CN(C)Cc2scnc2C)C1)C(C)(C)C	ZINC000450908679	GE	On-Demand	Anodyne	VHL	65	43
CC(=O)N[C@H](C(=O)N1CC[C@H](CN(C)Cc2scnc2C)C1)C(C)(C)C	ZINC000450908682	GE	On-Demand	Anodyne	VHL	65	43
Nc1ncccc1CN1CCC(c2cccc(Br)c2)CC1	ZINC000450908686	EH	On-Demand	Anodyne	VACHT_TETCF	0	41
CN1CCC[C@H](C(=O)N(CCCOc2ccccc2)C2CCOCC2)C1=O	ZINC000450908695	FE	On-Demand	Anodyne	HRH3	35	44
CN1CCC[C@@H](C(=O)N(CCCOc2ccccc2)C2CCOCC2)C1=O	ZINC000450908697	FE	On-Demand	Anodyne	HRH3	35	44
CC[C@@H]1CN(CC/C=C\c2ccccc2)CCCO1	ZINC000450908706	CH	On-Demand	Anodyne	SLC6A1	40	36
CC[C@H]1CN(CC/C=C/c2ccccc2)CCCO1	ZINC000450908709	CH	On-Demand	Anodyne	SLC6A1	40	36
CC[C@H]1CN(CC/C=C\c2ccccc2)CCCO1	ZINC000450908712	CH	On-Demand	Anodyne	SLC6A1	40	36
CC[C@@H]1CN(CC/C=C/c2ccccc2)CCCO1	ZINC000450908713	CH	On-Demand	Anodyne	SLC6A1	40	36
COc1ccc2ncc(=O)n(CCCCOc3c(OC)cccc3OC)c2c1	ZINC000450908719	GG	On-Demand	Anodyne	GSG2	54	39
COC(=O)[C@H](NC(=O)c1c(C)cccc1Cl)[C@H](C)O	ZINC000450908721	CD	On-Demand	Anodyne	H9CNL0_SPOEX	0	40
COC(=O)[C@@H](NC(=O)c1c(C)cccc1Cl)[C@@H](C)O	ZINC000450908729	CD	On-Demand	Anodyne	H9CNL0_SPOEX	0	40
COC(=O)[C@@H](NC(=O)c1c(C)cccc1Cl)[C@H](C)O	ZINC000450908730	CD	On-Demand	Anodyne	H9CNL0_SPOEX	0	40
COC(=O)[C@H](NC(=O)c1c(C)cccc1Cl)[C@@H](C)O	ZINC000450908736	CD	On-Demand	Anodyne	H9CNL0_SPOEX	0	40
CCc1cc(O)nc(SCc2ccc(C(=O)OC)c(Cl)c2)n1	ZINC000450908770	EG	On-Demand	Anodyne	PTPRG	0	40
COC(=O)CNC(=O)c1ccc(NCc2cnc(C)cc2C)c([N+](=O)[O-])c1	ZINC000450908777	FE	On-Demand	Bother	TAAR1	17	42
CCOC(=O)c1ccc(CSc2nc(O)cc(CC)n2)nc1	ZINC000450908779	DF	On-Demand	Anodyne	CA7	19	41
CCOC(=O)c1ccc(CSc2nc(O)cc(CC)n2)nc1	ZINC000450908779	DF	On-Demand	Anodyne	CA13	20	41
COc1ccc2ncc(=O)n(CCCc3cccc(C)c3)c2c1	ZINC000450908791	DG	On-Demand	Anodyne	GSG2	44	36
CCCN(CCN(CC)CC)C(=O)c1c[nH]c2nccc-2c1	ZINC000450908825	DF	On-Demand	Anodyne	PLM2_PLAFA	48	37
O=C1CCC2(CC1)NC(=O)N(CCCCc1ccc(Cl)c(Cl)c1)C2=O	ZINC000450908852	GH	On-Demand	Anodyne	SIGMAR1	15	40
O=C1CCC2(CC1)NC(=O)N(CCCCc1ccc(Cl)c(Cl)c1)C2=O	ZINC000450908852	GH	On-Demand	Anodyne	DNAE	66	32
CNC(=O)[C@@]1(C)CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450908858	CE	On-Demand	Anodyne	ADAM17	16	45
CNC(=O)[C@@]1(C)CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450908858	CE	On-Demand	Anodyne	MCHR1	15	42
CNC(=O)[C@]1(C)CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450908859	CE	On-Demand	Anodyne	ADAM17	16	45
CNC(=O)[C@]1(C)CCN(Cc2ccc(Cl)c(OC)c2)C1	ZINC000450908859	CE	On-Demand	Anodyne	MCHR1	15	42
O=[N+]([O-])c1cc(F)ccc1NCc1cnc(C2CC2)o1	ZINC000450908865	CG	On-Demand	Bother	PRKCQ	28	41
COc1ccc(CNC(=O)CCN2CC(C)=C[C@H](C)C2)c(OC)c1	ZINC000450908886	EF	On-Demand	Anodyne	MTNR1A	41	34
COc1ccc(CNC(=O)CCN2CC(C)=C[C@@H](C)C2)c(OC)c1	ZINC000450908887	EF	On-Demand	Anodyne	MTNR1A	41	34
Cc1ccn2ncc(C(=O)NC[C@@H]3C[C@H](F)CN3Cc3cnn(C)c3)c2c1	ZINC000450908898	FD	On-Demand	Anodyne	EPHB3	28	42
COc1cc(CN2CCC=C(C)C2)ccc1Cl	ZINC000450908902	CH	On-Demand	Anodyne	CHRNA6	0	41
CCC[C@@H](NC(=O)C[C@H](O)CC)C(=O)OC(C)(C)C	ZINC000450908903	CD	On-Demand	Anodyne	CTSK	0	40
CCC[C@H](NC(=O)C[C@H](O)CC)C(=O)OC(C)(C)C	ZINC000450908904	CD	On-Demand	Anodyne	CTSK	0	40
CCC[C@H](NC(=O)C[C@@H](O)CC)C(=O)OC(C)(C)C	ZINC000450908905	CD	On-Demand	Anodyne	CTSK	0	40
CCC[C@@H](NC(=O)C[C@@H](O)CC)C(=O)OC(C)(C)C	ZINC000450908906	CD	On-Demand	Anodyne	CTSK	0	40
CCc1nc(C)c(CSc2ccc(C#N)c(C(F)(F)F)c2)o1	ZINC000450908914	EJ	On-Demand	Mild	AR	37	55
COCCc1ccc(OC[C@@H](O)CN(C)c2cccc3cccnc23)cc1	ZINC000450908921	FG	On-Demand	Anodyne	ADRB1	16	47
COCCc1ccc(OC[C@H](O)CN(C)c2cccc3cccnc23)cc1	ZINC000450908922	FG	On-Demand	Anodyne	ADRB1	16	47
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCCc1ccc(Cl)cc1	ZINC000450908937	FD	On-Demand	Anodyne	MMP2	46	33
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)NCCc1ccc(Cl)cc1	ZINC000450908937	FD	On-Demand	Anodyne	GPBAR1	25	43
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCCc1ccc(Cl)cc1	ZINC000450908938	FD	On-Demand	Anodyne	MMP2	46	33
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)NCCc1ccc(Cl)cc1	ZINC000450908938	FD	On-Demand	Anodyne	GPBAR1	25	43
Cc1ccc(Nc2nc(CN3CCC[C@@H](c4nnc(O)o4)C3)cs2)cc1	ZINC000450908946	FH	On-Demand	Anodyne	SPHK2	43	31
Cc1ccc(Nc2nc(CN3CCC[C@@H](c4nnc(O)o4)C3)cs2)cc1	ZINC000450908946	FH	On-Demand	Anodyne	SPHK1	43	38
Cc1ccc(Nc2nc(CN3CCC[C@@H](c4nnc(O)o4)C3)cs2)cc1	ZINC000450908946	FH	On-Demand	Anodyne	TRPC6	43	41
Cc1ccc(Nc2nc(CN3CCC[C@@H](c4nnc(O)o4)C3)cs2)cc1	ZINC000450908946	FH	On-Demand	Anodyne	TRPC3	42	42
Cc1ccc(Nc2nc(CN3CCC[C@H](c4nnc(O)o4)C3)cs2)cc1	ZINC000450908947	FH	On-Demand	Anodyne	SPHK2	43	31
Cc1ccc(Nc2nc(CN3CCC[C@H](c4nnc(O)o4)C3)cs2)cc1	ZINC000450908947	FH	On-Demand	Anodyne	SPHK1	43	38
Cc1ccc(Nc2nc(CN3CCC[C@H](c4nnc(O)o4)C3)cs2)cc1	ZINC000450908947	FH	On-Demand	Anodyne	TRPC6	43	41
Cc1ccc(Nc2nc(CN3CCC[C@H](c4nnc(O)o4)C3)cs2)cc1	ZINC000450908947	FH	On-Demand	Anodyne	TRPC3	42	42
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908962	GG	On-Demand	Anodyne	ADRB3	36	40
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908962	GG	On-Demand	Anodyne	ACOX1	72	38
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908962	GG	On-Demand	Anodyne	COLA	43	35
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908962	GG	On-Demand	Anodyne	CPT1A	40	35
Oc1nnc([C@@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908962	GG	On-Demand	Anodyne	ABCB1	38	41
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908963	GG	On-Demand	Anodyne	ADRB3	36	40
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908963	GG	On-Demand	Anodyne	ACOX1	72	38
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908963	GG	On-Demand	Anodyne	COLA	43	35
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908963	GG	On-Demand	Anodyne	CPT1A	40	35
Oc1nnc([C@H]2CCCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908963	GG	On-Demand	Anodyne	ABCB1	38	41
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908964	GG	On-Demand	Anodyne	ADRB3	36	40
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908964	GG	On-Demand	Anodyne	ACOX1	72	38
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908964	GG	On-Demand	Anodyne	COLA	43	35
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908964	GG	On-Demand	Anodyne	CPT1A	40	35
Oc1nnc([C@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908964	GG	On-Demand	Anodyne	ABCB1	38	41
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908965	GG	On-Demand	Anodyne	ADRB3	36	40
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908965	GG	On-Demand	Anodyne	ACOX1	72	38
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908965	GG	On-Demand	Anodyne	COLA	43	35
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908965	GG	On-Demand	Anodyne	CPT1A	40	35
Oc1nnc([C@@H]2CCCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)C2)o1	ZINC000450908965	GG	On-Demand	Anodyne	ABCB1	38	41
N#Cc1ccc(SCc2ccn(CC(F)(F)F)n2)cc1C(F)(F)F	ZINC000450908982	FJ	On-Demand	Mild	AR	36	52
O=[N+]([O-])c1ccc(NC2(Cc3ccccc3)CCOCC2)c(F)c1	ZINC000450908987	EH	On-Demand	Bother	F2RL3	45	32
c1ccc(-c2n[nH]c(CNc3cc(N4CCCCC4)ncn3)n2)nc1	ZINC000450908992	EE	On-Demand	Anodyne	GPR39	0	41
Fc1ccc(F)c(CC2CCN(c3ncnc4n[nH]cc34)CC2)c1	ZINC000450909021	EG	On-Demand	Anodyne	PDE3B	49	32
COc1ccc(CNC(=O)CCN2CC(C)(C)O[C@@H]3CCC[C@H]32)c(OC)c1	ZINC000450909034	GF	On-Demand	Anodyne	MTNR1A	41	37
CN(CCN1CCOC[C@H]1c1nc(-c2cccs2)no1)Cc1ccccc1	ZINC000450909036	GG	On-Demand	Anodyne	ETHR	32	42
CN(CCN1CCOC[C@@H]1c1nc(-c2cccs2)no1)Cc1ccccc1	ZINC000450909038	GG	On-Demand	Anodyne	ETHR	32	42
COC(=O)[C@@H]1CN(Cc2ccn(CC(F)(F)F)n2)C[C@H]1c1ccccc1	ZINC000450909044	FF	On-Demand	Anodyne	SLC6A1	22	47
COc1ccc2ncc(=O)n(CCCCC(C)(C)C#N)c2c1	ZINC000450909051	CG	On-Demand	Mild	GSG2	42	37
CC(C)OCCOC1CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC1	ZINC000450909057	GJ	On-Demand	Anodyne	TACR3	41	34
CC(=O)c1cccc(CN(C)CCCOCc2ccccc2)c1	ZINC000450909068	DH	On-Demand	Anodyne	ACHE	28	50
CC(=O)c1cccc(CN(C)CCCOCc2ccccc2)c1	ZINC000450909068	DH	On-Demand	Anodyne	LTA4H	28	41
COc1ccc2ncc(=O)n(C[C@@H]3C[C@H]3c3ccccc3)c2c1	ZINC000450909079	DG	On-Demand	Anodyne	UTS2R	0	40
O=C(CCSc1nc2cncnc2[nH]1)NC(=O)NCCC(F)(F)F	ZINC000450909097	FD	On-Demand	Anodyne	ENPP1	15	41
CCc1cc(O)nc(SCc2cccc(S(C)(=O)=O)c2)n1	ZINC000450909108	DE	On-Demand	Anodyne	CXCR2	24	41
CCc1cc(O)nc(SCc2cccc(S(C)(=O)=O)c2)n1	ZINC000450909108	DE	On-Demand	Anodyne	CA13	16	45
CCOC(=O)[C@@]1(COC)CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450909136	EE	On-Demand	Anodyne	SLC12A5	73	40
CCOC(=O)[C@]1(COC)CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450909138	EE	On-Demand	Anodyne	SLC12A5	73	40
COc1cccc(C2(F)CCN(CC[C@@H](C)O)CC2)c1	ZINC000450909151	CF	On-Demand	Anodyne	DRD4	44	33
COc1cccc(C2(F)CCN(CC[C@@H](C)O)CC2)c1	ZINC000450909151	CF	On-Demand	Anodyne	OPRK1	0	47
COc1cccc(C2(F)CCN(CC[C@@H](C)O)CC2)c1	ZINC000450909151	CF	On-Demand	Anodyne	EBP	37	40
COc1cccc(C2(F)CCN(CC[C@H](C)O)CC2)c1	ZINC000450909153	CF	On-Demand	Anodyne	DRD4	44	33
COc1cccc(C2(F)CCN(CC[C@H](C)O)CC2)c1	ZINC000450909153	CF	On-Demand	Anodyne	OPRK1	0	47
COc1cccc(C2(F)CCN(CC[C@H](C)O)CC2)c1	ZINC000450909153	CF	On-Demand	Anodyne	EBP	37	40
CCOC(=O)[C@]1(COC)CCCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450909160	EF	On-Demand	Anodyne	SLC12A5	65	37
CCOC(=O)[C@@]1(COC)CCCN(C[C@H](Cc2ccccc2)OC)C1	ZINC000450909161	EF	On-Demand	Anodyne	SLC12A5	65	37
CCOC(=O)[C@@]1(COC)CCCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450909162	EF	On-Demand	Anodyne	SLC12A5	65	37
CCOC(=O)[C@]1(COC)CCCN(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450909163	EF	On-Demand	Anodyne	SLC12A5	65	37
Cc1cccc2ncnc(N3CCC(OCCOC(C)C)CC3)c12	ZINC000450909186	EG	On-Demand	Anodyne	PDE3B	65	36
N#Cc1ccc(CNc2cc(N3CCOCC3)ncn2)cc1F	ZINC000450909199	DD	On-Demand	Mild	MAP3K8	25	41
N#Cc1ccc(CNc2cc(N3CCOCC3)ncn2)cc1F	ZINC000450909199	DD	On-Demand	Mild	SMG1	41	36
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450909201	GD	On-Demand	Bother	OXTR	22	40
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450909203	GD	On-Demand	Bother	OXTR	22	40
CC(C)OCCOC1CCN(c2ccc3ccc(Cl)cc3n2)CC1	ZINC000450909224	EI	On-Demand	Anodyne	SCD1	16	40
CCc1cccc(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)n1	ZINC000450909250	DD	On-Demand	Anodyne	OXTR	26	44
CCc1cccc(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)n1	ZINC000450909250	DD	On-Demand	Anodyne	AVPR1A	0	42
CC(C)OCCOC1CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450909251	EH	On-Demand	Anodyne	SORD	73	37
CCc1cccc(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)n1	ZINC000450909252	DD	On-Demand	Anodyne	OXTR	26	44
CCc1cccc(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)n1	ZINC000450909252	DD	On-Demand	Anodyne	AVPR1A	0	42
CN1CCO[C@@H](CN(CC2CC2)C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450909258	EF	On-Demand	Anodyne	OXTR	23	41
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)C1	ZINC000450909261	EF	On-Demand	Anodyne	OXTR	23	41
CC(C)OCCOC1CCN(c2ccnc3cc(C(F)(F)F)ccc23)CC1	ZINC000450909277	GJ	On-Demand	Anodyne	LIPG	57	41
N=c1[nH]c(N2CCC(Cc3cccc(F)c3F)CC2)ncc1[N+](=O)[O-]	ZINC000450909290	EF	On-Demand	Bother	PRKCQ	29	46
CC(=O)CCCCCOc1cnc(C#N)nc1	ZINC000450909291	BD	On-Demand	Mild	PLA2G4B	40	30
Oc1nnc([C@H]2CCCN(CCOc3ccc(Cl)c(F)c3)C2)o1	ZINC000450909292	EF	On-Demand	Anodyne	ESR1	47	34
Oc1nnc([C@H]2CCCN(CCOc3ccc(Cl)c(F)c3)C2)o1	ZINC000450909292	EF	On-Demand	Anodyne	CHRNA10	32	40
Oc1nnc([C@H]2CCCN(CCOc3ccc(Cl)c(F)c3)C2)o1	ZINC000450909292	EF	On-Demand	Anodyne	PSMB2	43	32
Oc1nnc([C@@H]2CCCN(CCOc3ccc(Cl)c(F)c3)C2)o1	ZINC000450909293	EF	On-Demand	Anodyne	ESR1	47	34
Oc1nnc([C@@H]2CCCN(CCOc3ccc(Cl)c(F)c3)C2)o1	ZINC000450909293	EF	On-Demand	Anodyne	CHRNA10	32	40
Oc1nnc([C@@H]2CCCN(CCOc3ccc(Cl)c(F)c3)C2)o1	ZINC000450909293	EF	On-Demand	Anodyne	PSMB2	43	32
COc1ccc2ncc(=O)n(CC3CCCCC3)c2c1	ZINC000450909307	CF	On-Demand	Anodyne	Q8MHZ5_SHEEP	46	34
COc1ccc2ncc(=O)n(CC(=O)N3CCN(c4ccccc4F)CC3)c2c1	ZINC000450909329	GD	On-Demand	Anodyne	HTR1A	36	40
COc1ccc2ncc(=O)n(CC(=O)N3CCN(c4ccccc4F)CC3)c2c1	ZINC000450909329	GD	On-Demand	Anodyne	DRD4	43	36
COc1ccc2ncc(=O)n(CC(=O)N3CCN(c4ccccc4F)CC3)c2c1	ZINC000450909329	GD	On-Demand	Anodyne	CCKAR	22	41
CO[C@H](Cc1ccccc1)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450909338	GH	On-Demand	Anodyne	PPARG	31	50
CO[C@H](Cc1ccccc1)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450909338	GH	On-Demand	Anodyne	PPARA	38	47
CO[C@@H](Cc1ccccc1)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450909339	GH	On-Demand	Anodyne	PPARG	31	50
CO[C@@H](Cc1ccccc1)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450909339	GH	On-Demand	Anodyne	PPARA	38	47
C=C(CC)CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450909351	DG	On-Demand	Mild	ROS1	49	37
CCOCc1ccccc1CNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450909361	GE	On-Demand	Anodyne	MTNR1A	52	39
CCC[C@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)c1ccccc1	ZINC000450909364	FG	On-Demand	Anodyne	EDNRB	21	45
CCC[C@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)c1ccccc1	ZINC000450909364	FG	On-Demand	Anodyne	SOAT1	0	41
CCC[C@@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)c1ccccc1	ZINC000450909365	FG	On-Demand	Anodyne	EDNRB	21	45
CCC[C@@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)c1ccccc1	ZINC000450909365	FG	On-Demand	Anodyne	SOAT1	0	41
CSc1cccc(C(=O)N(CCCOc2ccccc2)C2CCOCC2)c1	ZINC000450909366	GI	On-Demand	Anodyne	ACE	20	42
COc1ccc([C@H](NC(=O)Cn2c(=O)cnc3ccc(OC)cc32)C2CC2)cc1	ZINC000450909371	GF	On-Demand	Anodyne	AVPR1B	54	38
COc1ccc([C@@H](NC(=O)Cn2c(=O)cnc3ccc(OC)cc32)C2CC2)cc1	ZINC000450909372	GF	On-Demand	Anodyne	AVPR1B	54	38
Cc1cc(F)ccc1[C@H]1CCCN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450909378	FH	On-Demand	Anodyne	DHOD	0	41
Cc1cc(F)ccc1[C@@H]1CCCN1c1cc(C(F)(F)F)nc2ncnn12	ZINC000450909379	FH	On-Demand	Anodyne	DHOD	0	41
COc1cc(N2CCC[C@H]2c2ccc(F)cc2C)ncn1	ZINC000450909405	CG	On-Demand	Anodyne	PRCP	41	35
COc1cc(N2CCC[C@@H]2c2ccc(F)cc2C)ncn1	ZINC000450909406	CG	On-Demand	Anodyne	PRCP	41	35
C=C(CC)CNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000450909410	EF	On-Demand	Mild	CA2	15	44
CC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nc1	ZINC000450909411	DH	On-Demand	Anodyne	PRCP	42	30
CC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nc1	ZINC000450909412	DH	On-Demand	Anodyne	PRCP	42	30
CC(=O)c1ccc(CN(C)CCCOCc2ccccc2)cc1	ZINC000450909413	DH	On-Demand	Anodyne	ACHE	26	51
CC(=O)c1ccc(CN(C)CCCOCc2ccccc2)cc1	ZINC000450909413	DH	On-Demand	Anodyne	LTA4H	38	45
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2cc3ccncc3s2)C1	ZINC000450909422	FG	On-Demand	Anodyne	NAMPT	17	46
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2cc3ccncc3s2)C1	ZINC000450909423	FG	On-Demand	Anodyne	NAMPT	17	46
COc1ccc2ncc(=O)n(CCCS(=O)(=O)c3ccccc3OC)c2c1	ZINC000450909447	GE	On-Demand	Anodyne	GSG2	44	37
COC(=O)[C@@H]1CN(Cc2nnc(C(C)C)s2)C[C@H]1c1ccccc1	ZINC000450909448	EG	On-Demand	Anodyne	SLC6A1	55	47
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC(Cc2cc(F)ccc2F)CC1	ZINC000450909477	GF	On-Demand	Bother	STAT6	27	40
Cc1ccn2ncc(C(=O)N3CCOC[C@H]3c3cccn3C)c2c1	ZINC000450909483	DE	On-Demand	Anodyne	EPHB3	19	40
COCCSCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450909485	DE	On-Demand	Anodyne	GSG2	40	35
COc1ccc(CNC(=O)CCN2CC[C@H](OC)C[C@H]2C)c(OC)c1	ZINC000450909496	FE	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCN2CC[C@@H](OC)C[C@H]2C)c(OC)c1	ZINC000450909501	FE	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCN2CC[C@@H](OC)C[C@@H]2C)c(OC)c1	ZINC000450909503	FE	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCN2CC[C@H](OC)C[C@@H]2C)c(OC)c1	ZINC000450909505	FE	On-Demand	Anodyne	MTNR1A	49	36
Cc1ccn2ncc(C(=O)N3CCOC[C@@H]3c3cccn3C)c2c1	ZINC000450909507	DE	On-Demand	Anodyne	EPHB3	19	40
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450909532	FE	On-Demand	Anodyne	CHRNA7	22	41
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450909534	FE	On-Demand	Anodyne	CHRNA7	22	41
CCn1c(SCC(=O)CC(C)(C)C2CC2)nc2ccc(F)cc2c1=O	ZINC000450909538	FI	On-Demand	Anodyne	Q8MHZ5_SHEEP	53	37
Oc1nnc([C@@H]2CCCN(CCOc3ccccc3Cl)C2)o1	ZINC000450909556	DF	On-Demand	Anodyne	SLC6A1	69	39
Oc1nnc([C@H]2CCCN(CCOc3ccccc3Cl)C2)o1	ZINC000450909558	DF	On-Demand	Anodyne	SLC6A1	69	39
Cc1nccc(N2CCC(Cc3cccc(F)c3F)CC2)n1	ZINC000450909560	DH	On-Demand	Anodyne	SORD	49	36
COC(=O)[C@@H]1CN(CC2(C#N)CCC2)C[C@H]1c1ccccc1	ZINC000450909570	CF	On-Demand	Mild	SLC6A1	68	46
CC(C)N1CCCC[C@@H]1CN1C[C@@H](O)C[C@@H]1c1cccc(F)c1	ZINC000450909579	DG	On-Demand	Anodyne	CCR5	69	33
CC(C)N1CCCC[C@@H]1CN1C[C@H](O)C[C@@H]1c1cccc(F)c1	ZINC000450909581	DG	On-Demand	Anodyne	CCR5	69	33
CC(C)N1CCCC[C@@H]1CN1C[C@H](O)C[C@H]1c1cccc(F)c1	ZINC000450909583	DG	On-Demand	Anodyne	CCR5	69	33
CC(C)N1CCCC[C@@H]1CN1C[C@@H](O)C[C@H]1c1cccc(F)c1	ZINC000450909584	DG	On-Demand	Anodyne	CCR5	69	33
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)c2ccsc2Br)C1	ZINC000450909600	GG	On-Demand	Anodyne	CHRNA7	42	37
C[C@@H]1CCCN(c2cc(NCc3ccc(C#N)c(F)c3)ncn2)C1	ZINC000450909612	EG	On-Demand	Mild	PRCP	0	41
C[C@H]1CCCN(c2cc(NCc3ccc(C#N)c(F)c3)ncn2)C1	ZINC000450909615	EG	On-Demand	Mild	PRCP	0	41
CCOc1ccccc1CN1CCN(CCc2cscn2)[C@@H](C)C1	ZINC000450909616	EG	On-Demand	Anodyne	SCN5A	40	33
CCOc1ccccc1CN1CCN(CCc2cscn2)[C@H](C)C1	ZINC000450909618	EG	On-Demand	Anodyne	SCN5A	40	33
CCS(=O)(=O)c1ccc(CN2CC[C@](C)(c3ccc(F)cc3)C2)cc1	ZINC000450909622	FH	On-Demand	Anodyne	ADAM17	15	43
CCS(=O)(=O)c1ccc(CN2CC[C@@](C)(c3ccc(F)cc3)C2)cc1	ZINC000450909625	FH	On-Demand	Anodyne	ADAM17	15	43
CO[C@@H](Cc1ccccc1)CN1CCOC[C@@H]1c1nc(-c2cccs2)no1	ZINC000450909651	GG	On-Demand	Anodyne	ETHR	26	41
CCS(=O)(=O)c1ccc(COc2ccc3c(c2)CCCNC3=O)cc1	ZINC000450909652	FF	On-Demand	Anodyne	MAOB	36	52
CO[C@H](Cc1ccccc1)CN1CCOC[C@@H]1c1nc(-c2cccs2)no1	ZINC000450909653	GG	On-Demand	Anodyne	ETHR	26	41
CO[C@@H](Cc1ccccc1)CN1CCOC[C@H]1c1nc(-c2cccs2)no1	ZINC000450909655	GG	On-Demand	Anodyne	ETHR	26	41
CO[C@H](Cc1ccccc1)CN1CCOC[C@H]1c1nc(-c2cccs2)no1	ZINC000450909656	GG	On-Demand	Anodyne	ETHR	26	41
COc1cc(CN2CCC[C@@H](c3nnc(O)o3)C2)ccc1Cl	ZINC000450909680	DF	On-Demand	Anodyne	SSTR5	65	41
COc1cc(CN2CCC[C@H](c3nnc(O)o3)C2)ccc1Cl	ZINC000450909683	DF	On-Demand	Anodyne	SSTR5	65	41
CC(C)OCCOC1CCN(c2nc(-c3ccccc3)ns2)CC1	ZINC000450909685	EH	On-Demand	Anodyne	FAAH	0	43
CCOC(=O)c1ccc(CSc2nccn2Cc2ccc(OC)cc2)nc1	ZINC000450909688	GH	On-Demand	Anodyne	ALOX5AP	48	33
CCCC[C@H](NC(=O)C1(C)CCC(=O)CC1)C(=O)OC(C)(C)C	ZINC000450909696	EG	On-Demand	Anodyne	CTSK	26	45
CCOC(=O)C1CCN(C(=O)CN(C)c2cccc3cccnc23)CC1	ZINC000450909700	FE	On-Demand	Anodyne	PTR1	48	37
CCCC[C@@H](NC(=O)C1(C)CCC(=O)CC1)C(=O)OC(C)(C)C	ZINC000450909710	EG	On-Demand	Anodyne	CTSK	26	45
COC(=O)C1(CN2CCC(F)(c3cccc(OC)c3)CC2)CC1	ZINC000450909712	DF	On-Demand	Anodyne	DRD4	45	34
COC(=O)C1(CN2CCC(F)(c3cccc(OC)c3)CC2)CC1	ZINC000450909712	DF	On-Demand	Anodyne	TACR3	24	41
CCOc1nc2ccc(C(=O)N(CC3CC3)C[C@@H]3CN(C)CCO3)cc2[nH]1	ZINC000450909716	FE	On-Demand	Anodyne	OXTR	27	44
CCOc1nc2ccc(C(=O)N(CC3CC3)C[C@@H]3CN(C)CCO3)cc2[nH]1	ZINC000450909716	FE	On-Demand	Anodyne	AVPR1A	17	44
CCOc1nc2ccc(C(=O)N(CC3CC3)C[C@H]3CN(C)CCO3)cc2[nH]1	ZINC000450909718	FE	On-Demand	Anodyne	OXTR	27	44
CCOc1nc2ccc(C(=O)N(CC3CC3)C[C@H]3CN(C)CCO3)cc2[nH]1	ZINC000450909718	FE	On-Demand	Anodyne	AVPR1A	17	44
C[C@H]1CCC(=O)[C@H](Oc2ccc(C#N)c(Cl)c2)C1	ZINC000450909723	CG	On-Demand	Mild	TRPV4	47	40
C[C@@H]1CCC(=O)[C@@H](Oc2ccc(C#N)c(Cl)c2)C1	ZINC000450909726	CG	On-Demand	Mild	TRPV4	47	40
C[C@H]1CCC(=O)[C@@H](Oc2ccc(C#N)c(Cl)c2)C1	ZINC000450909727	CG	On-Demand	Mild	TRPV4	47	40
C[C@@H]1CCC(=O)[C@H](Oc2ccc(C#N)c(Cl)c2)C1	ZINC000450909729	CG	On-Demand	Mild	TRPV4	47	40
C[C@@H]1Cc2cccc(C(=O)N(CC3CC3)C[C@@H]3CN(C)CCO3)c2O1	ZINC000450909732	EE	On-Demand	Anodyne	OXTR	21	42
COCc1nn(C)cc1C(=O)NC[C@@H]1C[C@H](F)CN1c1ccnc(N(C)C)n1	ZINC000450909733	GC	On-Demand	Anodyne	NOS2	47	31
CCCCN(C)C(=O)CSCC[C@H](C)O	ZINC000450909743	BD	On-Demand	Anodyne	CQSS	40	33
CCCCN(C)C(=O)CSCC[C@@H](C)O	ZINC000450909744	BD	On-Demand	Anodyne	CQSS	40	33
C[C@@H]1Cc2cccc(C(=O)N(CC3CC3)C[C@H]3CN(C)CCO3)c2O1	ZINC000450909758	EE	On-Demand	Anodyne	OXTR	21	42
C[C@H]1Cc2cccc(C(=O)N(CC3CC3)C[C@H]3CN(C)CCO3)c2O1	ZINC000450909762	EE	On-Demand	Anodyne	OXTR	21	42
C[C@H]1Cc2cccc(C(=O)N(CC3CC3)C[C@@H]3CN(C)CCO3)c2O1	ZINC000450909765	EE	On-Demand	Anodyne	OXTR	21	42
CC(C)OCCOC1CCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450909789	GE	On-Demand	Anodyne	GPR119	18	43
CC(=O)CCCCCOc1ccc(C#N)c(Cl)c1	ZINC000450909800	CH	On-Demand	Mild	PLA2G4B	74	38
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@H](O)C2CCC2)C1	ZINC000450909802	CD	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)[C@@H](O)C2CCC2)C1	ZINC000450909804	CD	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@H](O)C2CCC2)C1	ZINC000450909805	CD	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)[C@@H](O)C2CCC2)C1	ZINC000450909808	CD	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)CCCC(=O)Nc1cccc(S(=O)(=O)NCCN(C)C)c1	ZINC000450909827	FE	On-Demand	Anodyne	HDAC10	18	40
CC(C)CCCC(=O)Nc1cccc(S(=O)(=O)NCCN(C)C)c1	ZINC000450909827	FE	On-Demand	Anodyne	RCE1	0	40
Cc1[nH]c(C#N)cc1C(=O)N(CC1CC1)C[C@@H]1CN(C)CCO1	ZINC000450909833	DD	On-Demand	Mild	OXTR	0	42
Cc1[nH]c(C#N)cc1C(=O)N(CC1CC1)C[C@H]1CN(C)CCO1	ZINC000450909839	DD	On-Demand	Mild	OXTR	0	42
CN(C)c1nccc(N2C[C@@H](F)C[C@H]2CNC(=O)c2cncc(Cl)c2)n1	ZINC000450909860	GD	On-Demand	Anodyne	CACNA1I	55	32
O=[N+]([O-])c1cc(I)ccc1NCc1cnc(C2CC2)o1	ZINC000450909862	GH	On-Demand	Bother	PRKCQ	41	32
O=C1CCC(CN2CCC(F)(c3ccc(Cl)cc3)CC2)CC1	ZINC000450909865	DI	On-Demand	Anodyne	OPRL1	15	53
O=C1CCC(CN2CCC(F)(c3ccc(Cl)cc3)CC2)CC1	ZINC000450909865	DI	On-Demand	Anodyne	SIGMAR1	15	43
O=C1CCC(CN2CCC(F)(c3ccc(Cl)cc3)CC2)CC1	ZINC000450909865	DI	On-Demand	Anodyne	PA	15	42
CCCCN(C)C(=O)CSCc1nc(-c2ccc(OC)nn2)no1	ZINC000450909866	FE	On-Demand	Anodyne	TSPO	15	41
CCNC(=O)c1ccc(N2CCC(OCCOC(C)C)CC2)nc1	ZINC000450909867	EE	On-Demand	Anodyne	SCD1	21	41
CS(=O)(=O)c1cccc(Cn2cnc(C3CCC3)cc2=O)c1	ZINC000450909869	DD	On-Demand	Anodyne	NR1I2	41	36
COc1cccc(OCCC(=O)N2CC(Oc3ccc(C#N)cc3)C2)c1	ZINC000450909873	FF	On-Demand	Mild	MTNR1A	16	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909875	GF	On-Demand	Anodyne	DRD4	38	47
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909875	GF	On-Demand	Anodyne	ACHE	16	45
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909875	GF	On-Demand	Anodyne	SIGMAR1	35	42
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909875	GF	On-Demand	Anodyne	CCR5	65	40
CCS(=O)(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909875	GF	On-Demand	Anodyne	MLNR	59	51
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909876	GF	On-Demand	Anodyne	DRD4	38	47
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909876	GF	On-Demand	Anodyne	ACHE	16	45
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909876	GF	On-Demand	Anodyne	SIGMAR1	35	42
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909876	GF	On-Demand	Anodyne	CCR5	65	40
CCS(=O)(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1	ZINC000450909876	GF	On-Demand	Anodyne	MLNR	59	51
C/C=C/C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)C(=O)OCC	ZINC000450909878	EF	On-Demand	Anodyne	GPR88	0	44
CN(CCCN1CCCC1)CCN(C)Cc1ccccc1	ZINC000450909896	CF	On-Demand	Anodyne	ACHE	29	54
CN(CCCN1CCCC1)CCN(C)Cc1ccccc1	ZINC000450909896	CF	On-Demand	Anodyne	LTA4H	36	49
CN(CCCN1CCCC1)CCN(C)Cc1ccccc1	ZINC000450909896	CF	On-Demand	Anodyne	HTR7	23	40
CN(CCCN1CCCC1)CCN(C)Cc1ccccc1	ZINC000450909896	CF	On-Demand	Anodyne	HRH3	45	45
CN(CCCN1CCCC1)CCN(C)Cc1ccccc1	ZINC000450909896	CF	On-Demand	Anodyne	SIGMAR1	73	62
CN(CCCN1CCCC1)CCN(C)Cc1ccccc1	ZINC000450909896	CF	On-Demand	Anodyne	F2R	23	47
CN(CCCN1CCCC1)CCN(C)Cc1ccccc1	ZINC000450909896	CF	On-Demand	Anodyne	HNMT	48	43
CC(C)OCCOC1CCN(c2cc(C(F)(F)F)ccn2)CC1	ZINC000450909904	EH	On-Demand	Anodyne	LIPG	58	40
CC(C)(COCc1ccccc1)NC[C@H](O)Cc1ccccc1	ZINC000450909910	DG	On-Demand	Anodyne	CASR	37	53
CC(C)(COCc1ccccc1)NC[C@H](O)Cc1ccccc1	ZINC000450909910	DG	On-Demand	Anodyne	CAPN2	46	33
CC(C)OCCOC1CCN(c2ccnc(C3CC3)n2)CC1	ZINC000450909911	DF	On-Demand	Anodyne	SORD	73	35
COC(=O)C1(NC(=O)Cn2c(=O)cnc3ccc(OC)cc32)CCCCC1	ZINC000450909929	FD	On-Demand	Anodyne	AVPR1B	40	37
COc1ccc2ncc(=O)n(CC(=O)Nc3ccccc3C(C)(C)C)c2c1	ZINC000450909934	FG	On-Demand	Anodyne	F2	20	40
CC1(C(=O)NCC(Cc2ccccc2)Cc2ccccc2)CCC(=O)CC1	ZINC000450909940	FI	On-Demand	Anodyne	MME	73	37
CC1(C(=O)NCC(Cc2ccccc2)Cc2ccccc2)CCC(=O)CC1	ZINC000450909940	FI	On-Demand	Anodyne	TIMP3	44	33
Cc1cc(N2CCC[C@H]2c2ccc(F)cc2F)n2ncnc2n1	ZINC000450909947	DG	On-Demand	Anodyne	DHOD	0	49
Cc1cc(N2CCC[C@@H]2c2ccc(F)cc2F)n2ncnc2n1	ZINC000450909948	DG	On-Demand	Anodyne	DHOD	0	49
CCc1cc(N2CCC[C@H]2c2ccc(F)cc2C)n2ncnc2n1	ZINC000450909953	EG	On-Demand	Anodyne	DHOD	0	41
CCc1cc(N2CCC[C@@H]2c2ccc(F)cc2C)n2ncnc2n1	ZINC000450909954	EG	On-Demand	Anodyne	DHOD	0	41
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CC3)c2c1	ZINC000450909971	FE	On-Demand	Anodyne	AVPR1B	46	37
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CC3)c2c1	ZINC000450909971	FE	On-Demand	Anodyne	KCNA3	47	40
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CC3)c2c1	ZINC000450909971	FE	On-Demand	Anodyne	MTNR1A	33	46
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CC3)c2c1	ZINC000450909971	FE	On-Demand	Anodyne	MTNR1B	31	46
COc1ccc2ncc(=O)n(CC(=O)NCC3(c4ccccc4)CC3)c2c1	ZINC000450909971	FE	On-Demand	Anodyne	ACAT	0	45
CCCCN(CCCC)C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450909978	EF	On-Demand	Anodyne	TSPO	19	41
CCN(CC(=O)NC(C)C)C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450909994	FC	On-Demand	Anodyne	AVPR1B	42	38
COc1ccc2ncc(=O)n(CC(=O)Nc3ccc4c(c3)OCCCO4)c2c1	ZINC000450910006	GE	On-Demand	Anodyne	CALCRL	33	40
COc1ccc2ncc(=O)n(CC(=O)Nc3ccc4c(c3)OCCCO4)c2c1	ZINC000450910006	GE	On-Demand	Anodyne	IMDH_CRYPV	34	40
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)c2ccsc2Br)C1	ZINC000450910013	GG	On-Demand	Anodyne	CHRNA7	42	37
COCCOC[C@@H](O)CN1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000450910025	EF	On-Demand	Anodyne	HSP90AB1	38	46
COCCOC[C@H](O)CN1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000450910026	EF	On-Demand	Anodyne	HSP90AB1	38	46
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)CCCC(=O)C(C)(C)C)C1	ZINC000450910048	FG	On-Demand	Anodyne	C3AR1	45	40
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)CCCC(=O)C(C)(C)C)C1	ZINC000450910049	FG	On-Demand	Anodyne	C3AR1	45	40
c1ccc(-c2nsc(N3CCC[C@]4(CCSC4)C3)n2)cc1	ZINC000450910061	DH	On-Demand	Anodyne	FAAH	0	42
c1ccc(-c2nsc(N3CCC[C@@]4(CCSC4)C3)n2)cc1	ZINC000450910062	DH	On-Demand	Anodyne	FAAH	0	42
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450910069	EF	On-Demand	Anodyne	SLC18A3	0	42
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450910069	EF	On-Demand	Anodyne	CYP2J2	53	38
CCOC(=O)[C@@]1(COC)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450910069	EF	On-Demand	Anodyne	SLC12A5	48	36
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450910070	EF	On-Demand	Anodyne	SLC18A3	0	42
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450910070	EF	On-Demand	Anodyne	CYP2J2	53	38
CCOC(=O)[C@]1(COC)CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450910070	EF	On-Demand	Anodyne	SLC12A5	48	36
COc1ccc(-c2noc(=O)n2CCC(C)(F)F)cc1Br	ZINC000450910072	FG	On-Demand	Anodyne	GRM7	18	42
COC(=O)[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@H](C)O	ZINC000450910103	ED	On-Demand	Anodyne	TIMP3	42	33
COC(=O)[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@H](C)O	ZINC000450910104	ED	On-Demand	Anodyne	TIMP3	42	33
COC(=O)[C@@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@@H](C)O	ZINC000450910105	ED	On-Demand	Anodyne	TIMP3	42	33
COC(=O)[C@H](NC(=O)C1(Cc2cccc(Cl)c2)CC1)[C@@H](C)O	ZINC000450910106	ED	On-Demand	Anodyne	TIMP3	42	33
COc1ccc(-c2noc(=O)n2CC[C@@H](C)O)cc1Br	ZINC000450910107	EE	On-Demand	Anodyne	GRM7	17	41
COc1ccc(-c2noc(=O)n2CC[C@H](C)O)cc1Br	ZINC000450910108	EE	On-Demand	Anodyne	GRM7	17	41
CCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450910109	FF	On-Demand	Anodyne	SCD1	73	55
CCNC(=O)c1ccc(N2CCC(Cc3cc(F)ccc3F)CC2)nn1	ZINC000450910109	FF	On-Demand	Anodyne	SCD	29	49
CN1CCO[C@@H](CN(CC2CC2)C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450910130	GG	On-Demand	Anodyne	OXTR	0	44
CN1CCO[C@@H](CN(CC2CC2)C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450910130	GG	On-Demand	Anodyne	RBP4	85	39
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450910131	GG	On-Demand	Anodyne	OXTR	0	44
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450910131	GG	On-Demand	Anodyne	RBP4	85	39
Cc1nn(C)cc1CSc1nc(C)c(-c2ccccc2)[nH]1	ZINC000450910138	CH	On-Demand	Anodyne	SOAT1	26	45
COc1cc(CN[C@@H]2CCC(=O)N[C@@H]2C)ccc1Cl	ZINC000450910148	CE	On-Demand	Anodyne	SSTR3	0	42
COc1cc(CN[C@H]2CCC(=O)N[C@H]2C)ccc1Cl	ZINC000450910149	CE	On-Demand	Anodyne	SSTR3	0	42
COc1cc(CN[C@@H]2CCC(=O)N[C@H]2C)ccc1Cl	ZINC000450910150	CE	On-Demand	Anodyne	SSTR3	0	42
COc1cc(CN[C@H]2CCC(=O)N[C@@H]2C)ccc1Cl	ZINC000450910151	CE	On-Demand	Anodyne	SSTR3	0	42
CCc1c(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)oc2ccccc12	ZINC000450910152	FG	On-Demand	Anodyne	OXTR	0	41
CCc1c(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)oc2ccccc12	ZINC000450910153	FG	On-Demand	Anodyne	OXTR	0	41
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cc3cccnc3s2)C1	ZINC000450910154	EE	On-Demand	Anodyne	OXTR	23	42
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cc3cccnc3s2)C1	ZINC000450910154	EE	On-Demand	Anodyne	AVPR1A	15	42
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cc3cccnc3s2)C1	ZINC000450910155	EE	On-Demand	Anodyne	OXTR	23	42
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cc3cccnc3s2)C1	ZINC000450910155	EE	On-Demand	Anodyne	AVPR1A	15	42
COc1cc(OC)c2ncnc(NCc3cnc(C)cc3C)c2c1	ZINC000450910158	DF	On-Demand	Anodyne	PDE6A	44	34
CC(F)(F)CCOc1ccc2c(c1)CCC2=O	ZINC000450910165	BG	On-Demand	Anodyne	MAOB	16	52
Cc1nc(SC[C@H]2COCCO2)[nH]c1-c1ccccc1	ZINC000450910185	CF	On-Demand	Anodyne	SOAT1	31	46
Cc1nc(SC[C@@H]2COCCO2)[nH]c1-c1ccccc1	ZINC000450910186	CF	On-Demand	Anodyne	SOAT1	31	46
C=C(CC)CNc1ccc(S(N)(=O)=O)cn1	ZINC000450910201	BC	On-Demand	Mild	CA2	53	37
C=C(CC)CNc1ccc(S(N)(=O)=O)cn1	ZINC000450910201	BC	On-Demand	Mild	CA7	40	36
Cc1cccc(Cl)c1C(=O)Nc1cccc(S(=O)(=O)NCCN(C)C)c1	ZINC000450910225	GF	On-Demand	Anodyne	KCNK3	41	36
C/C=C\C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)C(=O)OCC	ZINC000450910240	EF	On-Demand	Anodyne	GPR88	0	44
C/C=C/C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)C(=O)OCC	ZINC000450910242	EF	On-Demand	Anodyne	GPR88	0	44
C/C=C\C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)C(=O)OCC	ZINC000450910244	EF	On-Demand	Anodyne	GPR88	0	44
O=[N+]([O-])c1cccc2ncnc(NCc3cnc(C4CC4)o3)c12	ZINC000450910271	DE	On-Demand	Bother	PRKCQ	41	34
COc1cc(-c2noc(CN3CC[C@H](C(=O)N(C)c4ccccc4)C3)n2)ncn1	ZINC000450910282	GE	On-Demand	Anodyne	COLA	61	36
COc1cc(-c2noc(CN3CC[C@H](C(=O)N(C)c4ccccc4)C3)n2)ncn1	ZINC000450910282	GE	On-Demand	Anodyne	CPT1A	56	36
COc1cc(-c2noc(CN3CC[C@@H](C(=O)N(C)c4ccccc4)C3)n2)ncn1	ZINC000450910283	GE	On-Demand	Anodyne	COLA	61	36
COc1cc(-c2noc(CN3CC[C@@H](C(=O)N(C)c4ccccc4)C3)n2)ncn1	ZINC000450910283	GE	On-Demand	Anodyne	CPT1A	56	36
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450910286	GD	On-Demand	Anodyne	ABCB1	40	37
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450910286	GD	On-Demand	Anodyne	ACKR3	41	35
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450910287	GD	On-Demand	Anodyne	ABCB1	40	37
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450910287	GD	On-Demand	Anodyne	ACKR3	41	35
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450910288	GD	On-Demand	Anodyne	ABCB1	40	37
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450910288	GD	On-Demand	Anodyne	ACKR3	41	35
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450910290	GD	On-Demand	Anodyne	ABCB1	40	37
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450910290	GD	On-Demand	Anodyne	ACKR3	41	35
c1ccc(-c2n[nH]c(CNc3cc(N4CCOCC4)ncn3)n2)nc1	ZINC000450910307	ED	On-Demand	Anodyne	SMG1	41	32
Cc1cccc(Cl)c1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450910311	FF	On-Demand	Anodyne	LCK	24	41
Cc1cccc(Cl)c1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450910311	FF	On-Demand	Anodyne	SCN10A	29	44
Cc1cccc(Cl)c1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450910311	FF	On-Demand	Anodyne	CXCR3	22	41
Cc1cccc(Cl)c1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000450910311	FF	On-Demand	Anodyne	STAT6	58	36
Oc1nnc([C@@H]2CCCN(CCOc3cccc(Br)c3)C2)o1	ZINC000450910341	FF	On-Demand	Anodyne	ESR1	40	33
Oc1nnc([C@@H]2CCCN(CCOc3cccc(Br)c3)C2)o1	ZINC000450910341	FF	On-Demand	Anodyne	CHRNA10	43	35
Oc1nnc([C@@H]2CCCN(CCOc3cccc(Br)c3)C2)o1	ZINC000450910341	FF	On-Demand	Anodyne	PSMB2	42	31
Oc1nnc([C@H]2CCCN(CCOc3cccc(Br)c3)C2)o1	ZINC000450910343	FF	On-Demand	Anodyne	ESR1	40	33
Oc1nnc([C@H]2CCCN(CCOc3cccc(Br)c3)C2)o1	ZINC000450910343	FF	On-Demand	Anodyne	CHRNA10	43	35
Oc1nnc([C@H]2CCCN(CCOc3cccc(Br)c3)C2)o1	ZINC000450910343	FF	On-Demand	Anodyne	PSMB2	42	31
OC[C@H]1CCCN1c1cc(NCc2nc(-c3ccccn3)n[nH]2)ncn1	ZINC000450910371	FD	On-Demand	Anodyne	PRCP	0	43
OC[C@@H]1CCCN1c1cc(NCc2nc(-c3ccccn3)n[nH]2)ncn1	ZINC000450910372	FD	On-Demand	Anodyne	PRCP	0	43
C[C@H](c1nc(-c2cccs2)no1)N1CCC(c2nnc(O)o2)CC1	ZINC000450910385	EF	On-Demand	Anodyne	SMO	46	33
C[C@H](c1nc(-c2cccs2)no1)N1CCC(c2nnc(O)o2)CC1	ZINC000450910385	EF	On-Demand	Anodyne	ETHR	58	51
CCC[C@H](NC(=O)C(C)(C)C(C)(F)F)C(=O)OC(C)(C)C	ZINC000450910387	DG	On-Demand	Anodyne	PAPA1_CARPA	15	42
CCC[C@H](NC(=O)C(C)(C)C(C)(F)F)C(=O)OC(C)(C)C	ZINC000450910387	DG	On-Demand	Anodyne	CTSK	22	41
CCC[C@@H](NC(=O)C(C)(C)C(C)(F)F)C(=O)OC(C)(C)C	ZINC000450910390	DG	On-Demand	Anodyne	PAPA1_CARPA	15	42
CCC[C@@H](NC(=O)C(C)(C)C(C)(F)F)C(=O)OC(C)(C)C	ZINC000450910390	DG	On-Demand	Anodyne	CTSK	22	41
C[C@@H](c1nc(-c2cccs2)no1)N1CCC(c2nnc(O)o2)CC1	ZINC000450910391	EF	On-Demand	Anodyne	SMO	46	33
C[C@@H](c1nc(-c2cccs2)no1)N1CCC(c2nnc(O)o2)CC1	ZINC000450910391	EF	On-Demand	Anodyne	ETHR	58	51
COC(=O)Cc1ccc(NCc2cnc(C3CC3)o2)c([N+](=O)[O-])c1	ZINC000450910392	EF	On-Demand	Bother	PRKCQ	43	34
COC(=O)CNC(=O)c1ccc(N[C@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450910419	EE	On-Demand	Bother	EEF1A1	0	43
COC(=O)CNC(=O)c1ccc(N[C@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450910419	EE	On-Demand	Bother	EEF1A2	0	43
CC(=O)CCCCCS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450910421	DH	On-Demand	Anodyne	CACNA1B	50	35
CCOC(=O)c1c(CN2CCC(c3nnc(O)o3)CC2)nc2ccccc2c1C	ZINC000450910472	GG	On-Demand	Anodyne	SSTR5	34	43
CC(=O)CCCCCn1nc(C)sc1=O	ZINC000450910478	BD	On-Demand	Anodyne	PAOX	41	39
COC(=O)c1csc(COc2ccc(C(=O)OC)c(OC)c2)n1	ZINC000450910479	EE	On-Demand	Anodyne	PPARD	25	40
Cc1ccc(F)c(CC(=O)NC[C@@H]2C[C@H](F)CN2c2ccnc(N(C)C)n2)c1	ZINC000450910481	GE	On-Demand	Anodyne	NOS2	50	32
COC(=O)c1ccc(C(F)(F)F)nc1S[C@H](C)C(=O)Nc1nccs1	ZINC000450910492	GG	On-Demand	Anodyne	MAP1	79	37
COC(=O)c1ccc(C(F)(F)F)nc1S[C@@H](C)C(=O)Nc1nccs1	ZINC000450910494	GG	On-Demand	Anodyne	MAP1	79	37
CN(C)CCNS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450910510	GD	On-Demand	Bother	BDKRB1	0	53
CN(C)CCNS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450910510	GD	On-Demand	Bother	BCL2L1	90	34
CN(C)CCNS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450910510	GD	On-Demand	Bother	BCL2	82	33
CN(C)CCNS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450910510	GD	On-Demand	Bother	BCL2L2	43	34
C[C@@H](O)CCN1CCC(F)(c2ccccc2OC(F)(F)F)CC1	ZINC000450910517	EH	On-Demand	Anodyne	SIGMAR1	15	40
C[C@H](O)CCN1CCC(F)(c2ccccc2OC(F)(F)F)CC1	ZINC000450910519	EH	On-Demand	Anodyne	SIGMAR1	15	40
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910521	EI	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910521	EI	On-Demand	Anodyne	HTR2A	19	44
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910521	EI	On-Demand	Anodyne	ERG2	18	40
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910521	EI	On-Demand	Anodyne	SLC18A3	16	45
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910521	EI	On-Demand	Anodyne	HTR3B	0	42
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910521	EI	On-Demand	Anodyne	CYP2J2	50	35
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910523	EI	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910523	EI	On-Demand	Anodyne	HTR2A	19	44
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910523	EI	On-Demand	Anodyne	ERG2	18	40
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910523	EI	On-Demand	Anodyne	SLC18A3	16	45
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910523	EI	On-Demand	Anodyne	HTR3B	0	42
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910523	EI	On-Demand	Anodyne	CYP2J2	50	35
CN(C)CCNS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450910524	GD	On-Demand	Bother	BDKRB1	0	53
CN(C)CCNS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450910524	GD	On-Demand	Bother	BCL2L1	90	34
CN(C)CCNS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450910524	GD	On-Demand	Bother	BCL2	82	33
CN(C)CCNS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450910524	GD	On-Demand	Bother	BCL2L2	43	34
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910525	EI	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910525	EI	On-Demand	Anodyne	HTR2A	19	44
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910525	EI	On-Demand	Anodyne	ERG2	18	40
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910525	EI	On-Demand	Anodyne	SLC18A3	16	45
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910525	EI	On-Demand	Anodyne	HTR3B	0	42
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910525	EI	On-Demand	Anodyne	CYP2J2	50	35
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910527	EI	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910527	EI	On-Demand	Anodyne	HTR2A	19	44
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910527	EI	On-Demand	Anodyne	ERG2	18	40
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910527	EI	On-Demand	Anodyne	SLC18A3	16	45
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910527	EI	On-Demand	Anodyne	HTR3B	0	42
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2CCCC(=O)c2ccc(F)cc2)C1	ZINC000450910527	EI	On-Demand	Anodyne	CYP2J2	50	35
Cc1cc(NCC(C)(C)C2(O)CCCC2)n2ncnc2n1	ZINC000450910535	CE	On-Demand	Anodyne	DHOD	0	52
COc1cc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cnoc2C)ccc1Cl	ZINC000450910544	GF	On-Demand	Anodyne	ITGA4	41	35
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1[N+](=O)[O-]	ZINC000450910555	EE	On-Demand	Bother	SSTR5	65	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	ACE	71	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	MME	98	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	ANPEP	45	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CTSD	42	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	PGC	65	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	MC4R	78	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	FCER2	67	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CTSB	36	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	TRY2_BOVIN	66	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CYSP_TRYCR	53	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CTSL	28	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CACNA1B	39	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	NPFFR2	59	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CYP51A1	23	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	TIMP3	56	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	MC3R	40	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	MC5R	62	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CAPNS1	57	31
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	MMP3	26	56
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	REN	88	54
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CTSS	35	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CAPN1	59	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CAPN2	35	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	CTSE	53	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	ACE2	90	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	PGA5	61	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	ST14	55	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	FPR1	47	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	POL	0	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	AMP1_PLAFQ	37	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	XIAP	41	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	BLA1_STEMA	55	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	PSMB8	49	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	BRCA1	64	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	NPFFR1	62	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910557	EC	On-Demand	Anodyne	DERP1	0	44
Oc1nnc(C2CCN(C[C@@H](O)COc3c(Cl)cccc3Cl)CC2)o1	ZINC000450910558	GF	On-Demand	Anodyne	ADRB3	43	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	ACE	71	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	MME	98	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	ANPEP	45	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CTSD	42	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	PGC	65	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	MC4R	78	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	FCER2	67	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CTSB	36	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	TRY2_BOVIN	66	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CYSP_TRYCR	53	50
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CTSL	28	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CACNA1B	39	47
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	NPFFR2	59	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CYP51A1	23	45
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	TIMP3	56	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	MC3R	40	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	MC5R	62	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CAPNS1	57	31
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	MMP3	26	56
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	REN	88	54
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CTSS	35	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CAPN1	59	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CAPN2	35	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	CTSE	53	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	ACE2	90	49
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	PGA5	61	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	ST14	55	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	FPR1	47	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	POL	0	47
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	AMP1_PLAFQ	37	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	XIAP	41	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	BLA1_STEMA	55	37
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	PSMB8	49	38
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	BRCA1	64	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	NPFFR1	62	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@H](O)C1CCC1	ZINC000450910559	EC	On-Demand	Anodyne	DERP1	0	44
Oc1nnc(C2CCN(C[C@H](O)COc3c(Cl)cccc3Cl)CC2)o1	ZINC000450910560	GF	On-Demand	Anodyne	ADRB3	43	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	ACE	71	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	MME	98	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	ANPEP	45	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CTSD	42	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	PGC	65	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	MC4R	78	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	FCER2	67	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CTSB	36	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	TRY2_BOVIN	66	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CYSP_TRYCR	53	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CTSL	28	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CACNA1B	39	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	NPFFR2	59	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CYP51A1	23	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	TIMP3	56	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	MC3R	40	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	MC5R	62	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CAPNS1	57	31
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	MMP3	26	56
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	REN	88	54
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CTSS	35	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CAPN1	59	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CAPN2	35	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	CTSE	53	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	ACE2	90	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	PGA5	61	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	ST14	55	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	FPR1	47	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	POL	0	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	AMP1_PLAFQ	37	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	XIAP	41	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	BLA1_STEMA	55	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	PSMB8	49	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	BRCA1	64	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	NPFFR1	62	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910561	EC	On-Demand	Anodyne	DERP1	0	44
CCC[C@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccccc1	ZINC000450910562	FF	On-Demand	Anodyne	CCR5	36	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	ACE	71	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	MME	98	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	ANPEP	45	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CTSD	42	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	PGC	65	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	MC4R	78	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	FCER2	67	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CTSB	36	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	TRY2_BOVIN	66	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CYSP_TRYCR	53	50
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CTSL	28	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CACNA1B	39	47
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	NPFFR2	59	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CYP51A1	23	45
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	TIMP3	56	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	MC3R	40	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	MC5R	62	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CAPNS1	57	31
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	MMP3	26	56
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	REN	88	54
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CTSS	35	48
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CAPN1	59	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CAPN2	35	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	CTSE	53	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	ACE2	90	49
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	PGA5	61	44
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	ST14	55	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	FPR1	47	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	POL	0	47
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	AMP1_PLAFQ	37	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	XIAP	41	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	BLA1_STEMA	55	37
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	PSMB8	49	38
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	BRCA1	64	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	NPFFR1	62	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)[C@@H](O)C1CCC1	ZINC000450910563	EC	On-Demand	Anodyne	DERP1	0	44
CCC[C@@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccccc1	ZINC000450910564	FF	On-Demand	Anodyne	CCR5	36	41
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cc(F)ccc1F	ZINC000450910579	ED	On-Demand	Anodyne	DRD4	0	48
COc1ccc(CN(C)C(=O)CN2CCC(c3nnc(O)o3)CC2)cc1OC	ZINC000450910584	GD	On-Demand	Anodyne	SSTR5	45	37
COCc1cc([N+](=O)[O-])ccc1NCC(C)(C)C1(O)CCCC1	ZINC000450910586	DG	On-Demand	Bother	CACNA1D	43	32
COCc1cc([N+](=O)[O-])ccc1NCC(C)(C)C1(O)CCCC1	ZINC000450910586	DG	On-Demand	Bother	NMBR	40	30
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cc(F)cc(F)c1	ZINC000450910592	ED	On-Demand	Anodyne	DRD4	0	46
CC[C@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccc(Cl)cc1	ZINC000450910600	GF	On-Demand	Anodyne	PRCP	25	40
CC[C@@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccc(Cl)cc1	ZINC000450910601	GF	On-Demand	Anodyne	PRCP	25	40
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccccc2C(F)(F)F)cc1	ZINC000450910603	GG	On-Demand	Anodyne	SFRP1	42	32
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccccc2C(F)(F)F)cc1	ZINC000450910603	GG	On-Demand	Anodyne	RORC	62	42
Oc1nnc(C2CCN(CCCOc3cccc4ccccc34)CC2)o1	ZINC000450910604	FH	On-Demand	Anodyne	HRH3	22	43
Oc1nnc(C2CCN(CCCOc3cccc4ccccc34)CC2)o1	ZINC000450910604	FH	On-Demand	Anodyne	NPY1R	45	37
Oc1nnc(C2CCN(CCCOc3cccc4ccccc34)CC2)o1	ZINC000450910604	FH	On-Demand	Anodyne	MCL1	35	43
CC(C)(CNc1ncc(C#N)cc1Cl)C1(O)CCCC1	ZINC000450910606	CG	On-Demand	Mild	IRAK4	16	42
O=S(=O)(C[C@@H]1CCCC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000450910612	EH	On-Demand	Anodyne	CACNA1B	57	37
O=S(=O)(C[C@@H]1CCCC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000450910612	EH	On-Demand	Anodyne	CCR2	34	43
O=C(c1cc2n(n1)CCC2)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450910615	FF	On-Demand	Anodyne	COLA	51	33
COCCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2C)nc1	ZINC000450910626	FG	On-Demand	Anodyne	ACKR3	52	33
COCCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2C)nc1	ZINC000450910627	FG	On-Demand	Anodyne	ACKR3	52	33
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3Cc4ccccc4O3)c2c1	ZINC000450910628	FD	On-Demand	Anodyne	PTGER2	17	41
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3Cc4ccccc4O3)c2c1	ZINC000450910628	FD	On-Demand	Anodyne	AVPR1B	46	37
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3Cc4ccccc4O3)c2c1	ZINC000450910629	FD	On-Demand	Anodyne	PTGER2	17	41
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3Cc4ccccc4O3)c2c1	ZINC000450910629	FD	On-Demand	Anodyne	AVPR1B	46	37
COCCn1c(NC(=O)C2(Cc3ccccc3)CCOCC2)nc2ccccc21	ZINC000450910634	GH	On-Demand	Anodyne	HRH1	19	40
COCCn1c(NC(=O)C2(Cc3ccccc3)CCOCC2)nc2ccccc21	ZINC000450910634	GH	On-Demand	Anodyne	BDKRB1	0	43
COCCn1c(NC(=O)C2(Cc3ccccc3)CCOCC2)nc2ccccc21	ZINC000450910634	GH	On-Demand	Anodyne	ITK	24	41
C=C(CC)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450910637	CF	On-Demand	Mild	TAAR1	16	44
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450910645	DD	On-Demand	Mild	CA2	56	41
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450910645	DD	On-Demand	Mild	CA1	50	41
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450910645	DD	On-Demand	Mild	CA7	46	40
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450910645	DD	On-Demand	Mild	CA4	55	41
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000450910645	DD	On-Demand	Mild	CAH_METTE	45	33
C[C@H](O)CCCOc1ccc2c(c1)CCC2=O	ZINC000450910694	BE	On-Demand	Anodyne	THRA	0	42
C[C@@H](O)CCCOc1ccc2c(c1)CCC2=O	ZINC000450910695	BE	On-Demand	Anodyne	THRA	0	42
COCCn1c(NC(=O)[C@@]2(C)CCC[C@H]2C)nc2ccccc21	ZINC000450910697	DG	On-Demand	Anodyne	HRH1	19	41
COCCn1c(NC(=O)[C@@]2(C)CCC[C@H]2C)nc2ccccc21	ZINC000450910697	DG	On-Demand	Anodyne	ITK	34	40
COCCn1c(NC(=O)[C@]2(C)CCC[C@H]2C)nc2ccccc21	ZINC000450910698	DG	On-Demand	Anodyne	HRH1	19	41
COCCn1c(NC(=O)[C@]2(C)CCC[C@H]2C)nc2ccccc21	ZINC000450910698	DG	On-Demand	Anodyne	ITK	34	40
COCCn1c(NC(=O)[C@]2(C)CCC[C@@H]2C)nc2ccccc21	ZINC000450910699	DG	On-Demand	Anodyne	HRH1	19	41
COCCn1c(NC(=O)[C@]2(C)CCC[C@@H]2C)nc2ccccc21	ZINC000450910699	DG	On-Demand	Anodyne	ITK	34	40
COCCn1c(NC(=O)[C@@]2(C)CCC[C@@H]2C)nc2ccccc21	ZINC000450910700	DG	On-Demand	Anodyne	HRH1	19	41
COCCn1c(NC(=O)[C@@]2(C)CCC[C@@H]2C)nc2ccccc21	ZINC000450910700	DG	On-Demand	Anodyne	ITK	34	40
COCc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450910707	FD	On-Demand	Anodyne	F2	17	42
COCc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450910707	FD	On-Demand	Anodyne	AVPR1B	47	38
COCc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450910707	FD	On-Demand	Anodyne	CMA1	32	40
COCc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450910707	FD	On-Demand	Anodyne	MTNR1A	51	38
COCc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450910707	FD	On-Demand	Anodyne	MTNR1B	50	38
COCc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450910707	FD	On-Demand	Anodyne	CTRC	33	40
CCCCOCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450910709	CE	On-Demand	Anodyne	PDE5A	48	34
CCCCOCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450910709	CE	On-Demand	Anodyne	GSG2	40	35
C[C@@H](O)CCCOc1ccc(I)cc1[N+](=O)[O-]	ZINC000450910738	FF	On-Demand	Bother	S1PR4	0	42
Cc1nc(SCc2ccn(CC(F)(F)F)n2)[nH]c1-c1ccccc1	ZINC000450910739	FI	On-Demand	Anodyne	SOAT1	15	40
C[C@H](O)CCCOc1ccc(I)cc1[N+](=O)[O-]	ZINC000450910740	FF	On-Demand	Bother	S1PR4	0	42
CCCc1cc(NCc2cnc(C)cc2C)n2ncnc2n1	ZINC000450910758	CF	On-Demand	Anodyne	DHOD	0	47
Cc1ccc(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)c2c1CCC2	ZINC000450910776	EF	On-Demand	Anodyne	OXTR	26	50
Cc1ccc(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)c2c1CCC2	ZINC000450910776	EF	On-Demand	Anodyne	AVPR1A	0	50
Cc1ccc(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)c2c1CCC2	ZINC000450910781	EF	On-Demand	Anodyne	OXTR	26	50
Cc1ccc(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)c2c1CCC2	ZINC000450910781	EF	On-Demand	Anodyne	AVPR1A	0	50
COC(=O)C1(CN2CCOC[C@@H]2c2nc(-c3cccs3)no2)CC1	ZINC000450910795	EE	On-Demand	Anodyne	SMO	40	38
COC(=O)C1(CN2CCOC[C@@H]2c2nc(-c3cccs3)no2)CC1	ZINC000450910795	EE	On-Demand	Anodyne	ETHR	61	47
COC(=O)C1(CN2CCOC[C@H]2c2nc(-c3cccs3)no2)CC1	ZINC000450910796	EE	On-Demand	Anodyne	SMO	40	38
COC(=O)C1(CN2CCOC[C@H]2c2nc(-c3cccs3)no2)CC1	ZINC000450910796	EE	On-Demand	Anodyne	ETHR	61	47
CC(C)c1ncc(CN(C)CCCC(=O)c2ccccc2)cn1	ZINC000450910804	DH	On-Demand	Anodyne	FAAH	58	40
CC(C)c1ncc(CN(C)CCCC(=O)c2ccccc2)cn1	ZINC000450910804	DH	On-Demand	Anodyne	CES1D	47	33
COC(=O)[C@@H]1CN(C[C@@H]2C[C@H]3CC[C@H]2O3)C[C@H]1c1ccccc1	ZINC000450910807	DE	On-Demand	Anodyne	SLC6A4	31	48
COC(=O)[C@@H]1CN(C[C@@H]2C[C@H]3CC[C@H]2O3)C[C@H]1c1ccccc1	ZINC000450910807	DE	On-Demand	Anodyne	SLC6A3	52	51
COC(=O)[C@@H]1CN(C[C@@H]2C[C@H]3CC[C@H]2O3)C[C@H]1c1ccccc1	ZINC000450910807	DE	On-Demand	Anodyne	CCR5	34	42
COC(=O)[C@@H]1CN(C[C@H]2C[C@H]3CC[C@H]2O3)C[C@H]1c1ccccc1	ZINC000450910809	DE	On-Demand	Anodyne	SLC6A4	31	48
COC(=O)[C@@H]1CN(C[C@H]2C[C@H]3CC[C@H]2O3)C[C@H]1c1ccccc1	ZINC000450910809	DE	On-Demand	Anodyne	SLC6A3	52	51
COC(=O)[C@@H]1CN(C[C@H]2C[C@H]3CC[C@H]2O3)C[C@H]1c1ccccc1	ZINC000450910809	DE	On-Demand	Anodyne	CCR5	34	42
N#Cc1ccnc(N2CCC(Cc3c(F)cccc3F)CC2)c1	ZINC000450910811	DH	On-Demand	Mild	MAP3K12	41	33
COc1cc(CN2C(=O)N[C@]3(CCN(Cc4ccccc4)C3)C2=O)ccc1Cl	ZINC000450910824	GG	On-Demand	Anodyne	ACHE	15	40
COc1cc(CN2C(=O)N[C@]3(CCN(Cc4ccccc4)C3)C2=O)ccc1Cl	ZINC000450910824	GG	On-Demand	Anodyne	SIGMAR1	37	40
COc1cc(CN2C(=O)N[C@]3(CCN(Cc4ccccc4)C3)C2=O)ccc1Cl	ZINC000450910824	GG	On-Demand	Anodyne	UTS2R	16	43
COc1cc(CN2C(=O)N[C@@]3(CCN(Cc4ccccc4)C3)C2=O)ccc1Cl	ZINC000450910825	GG	On-Demand	Anodyne	ACHE	15	40
COc1cc(CN2C(=O)N[C@@]3(CCN(Cc4ccccc4)C3)C2=O)ccc1Cl	ZINC000450910825	GG	On-Demand	Anodyne	SIGMAR1	37	40
COc1cc(CN2C(=O)N[C@@]3(CCN(Cc4ccccc4)C3)C2=O)ccc1Cl	ZINC000450910825	GG	On-Demand	Anodyne	UTS2R	16	43
CCc1nc(C)c(COc2ccc3cc(C(=O)OC)oc3c2)o1	ZINC000450910826	DH	On-Demand	Anodyne	MAOA	47	34
CCc1nc(C)c(COc2ccc3cc(C(=O)OC)oc3c2)o1	ZINC000450910826	DH	On-Demand	Anodyne	MAOB	42	46
CC[C@@H]1CN(Cc2ccc(Cl)c(OC)c2)CCCO1	ZINC000450910834	CG	On-Demand	Anodyne	DRD3	0	46
CC[C@H]1CN(Cc2ccc(Cl)c(OC)c2)CCCO1	ZINC000450910836	CG	On-Demand	Anodyne	DRD3	0	46
COCCOc1ccc(SCc2ccc(C(C)=O)cc2)cc1	ZINC000450910845	DI	On-Demand	Anodyne	PLA2G4B	42	37
COCCOc1ccc(SCc2nc(C(=O)OC)cs2)cc1	ZINC000450910850	EG	On-Demand	Anodyne	FAS	34	41
CC(=O)[C@@](C)(O)CN1CCC(c2cccc(Br)c2)CC1	ZINC000450910853	EF	On-Demand	Anodyne	DRD4	0	41
CC(=O)[C@@](C)(O)CN1CCC(c2cccc(Br)c2)CC1	ZINC000450910853	EF	On-Demand	Anodyne	VACHT_TETCF	0	44
CC(=O)[C@](C)(O)CN1CCC(c2cccc(Br)c2)CC1	ZINC000450910854	EF	On-Demand	Anodyne	DRD4	0	41
CC(=O)[C@](C)(O)CN1CCC(c2cccc(Br)c2)CC1	ZINC000450910854	EF	On-Demand	Anodyne	VACHT_TETCF	0	44
O=C(NC1CC1)c1cc(N2CCC[C@]3(CCSC3)C2)nc2ccccc12	ZINC000450910860	FH	On-Demand	Anodyne	ACACB	19	41
O=C(NC1CC1)c1cc(N2CCC[C@@]3(CCSC3)C2)nc2ccccc12	ZINC000450910861	FH	On-Demand	Anodyne	ACACB	19	41
Cn1[nH]c([C@@H]2CCCN2CC(=O)NCCCc2ccccc2)nc1=N	ZINC000450910865	ED	On-Demand	Anodyne	PREP	51	40
Cn1[nH]c([C@H]2CCCN2CC(=O)NCCCc2ccccc2)nc1=N	ZINC000450910866	ED	On-Demand	Anodyne	PREP	51	40
CCOC(=O)[C@@]1(COC)CCCN(Cc2ccc(S(=O)(=O)CC)cc2)C1	ZINC000450910870	GE	On-Demand	Anodyne	ADAM17	19	41
CCOC(=O)[C@]1(COC)CCCN(Cc2ccc(S(=O)(=O)CC)cc2)C1	ZINC000450910871	GE	On-Demand	Anodyne	ADAM17	19	41
O=S(=O)(C[C@H]1CCCC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000450910874	EH	On-Demand	Anodyne	CACNA1B	57	37
O=S(=O)(C[C@H]1CCCC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000450910874	EH	On-Demand	Anodyne	CCR2	34	43
Cc1ccncc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450910875	DF	On-Demand	Anodyne	HTR1A	57	39
Cc1ccncc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450910875	DF	On-Demand	Anodyne	HTR1D	44	38
Cc1ccncc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450910875	DF	On-Demand	Anodyne	HTR1B	40	38
Cc1ccncc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450910875	DF	On-Demand	Anodyne	HTR7	44	37
Cc1ccncc1N1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450910875	DF	On-Demand	Anodyne	SIGMAR1	24	43
N#Cc1cc2c(nc1N1CCC(Cc3cc(F)ccc3F)CC1)CCOC2	ZINC000450910897	FH	On-Demand	Mild	WNT3A	45	33
CCc1cccc(C(=O)NC[C@@H]2C[C@H](F)CN2Cc2c(C)noc2C)n1	ZINC000450910922	FF	On-Demand	Anodyne	PDE8B	43	32
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	DRD2	15	47
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	DRD4	45	47
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	ACHE	38	47
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	DRD3	0	47
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	LTA4H	25	42
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	SIGMAR1	37	44
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	HDAC8	15	40
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	PRNP	53	36
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	HDAC1	22	49
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	HDAC2	17	40
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	FLT3	18	47
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	MCHR1	54	43
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	AURKA	15	43
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	NPFFR1	46	35
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	NOD1	34	44
O=C(Nc1ccccc1)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450910929	GG	On-Demand	Anodyne	NOD2	51	43
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CCCO1	ZINC000450910950	FE	On-Demand	Anodyne	HTR7	27	40
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CCCO1	ZINC000450910950	FE	On-Demand	Anodyne	MTNR1A	50	38
CC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CCCO1	ZINC000450910950	FE	On-Demand	Anodyne	MTNR1B	44	37
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CCCO1	ZINC000450910953	FE	On-Demand	Anodyne	HTR7	27	40
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CCCO1	ZINC000450910953	FE	On-Demand	Anodyne	MTNR1A	50	38
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CCCO1	ZINC000450910953	FE	On-Demand	Anodyne	MTNR1B	44	37
CCNC(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)nn1	ZINC000450910989	FF	On-Demand	Anodyne	SCD1	60	53
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450910996	FH	On-Demand	Anodyne	AMY2	44	30
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450910996	FH	On-Demand	Anodyne	Q9NBD4_PLAFA	0	40
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450910996	FH	On-Demand	Anodyne	Q9NAW4_PLAFA	23	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450910998	FH	On-Demand	Anodyne	AMY2	44	30
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450910998	FH	On-Demand	Anodyne	Q9NBD4_PLAFA	0	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450910998	FH	On-Demand	Anodyne	Q9NAW4_PLAFA	23	40
O=[N+]([O-])c1cccc(F)c1NCc1cnc(C2CC2)o1	ZINC000450911001	CG	On-Demand	Bother	PRKCQ	27	41
CC(C)OCCOC1CCN(c2ncnc3nc(N)ccc23)CC1	ZINC000450911033	ED	On-Demand	Anodyne	PDE3A	42	32
CC(C)OCCOC1CCN(c2ncnc3nc(N)ccc23)CC1	ZINC000450911033	ED	On-Demand	Anodyne	PDE3B	63	32
CC(C)(CNc1ncccc1C(=O)N1CCCCC1)C1(O)CCCC1	ZINC000450911039	EG	On-Demand	Anodyne	HCN4	48	32
C[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1CCC(c2nnc(O)o2)CC1	ZINC000450911040	GG	On-Demand	Anodyne	CCR2	42	37
C[C@H](C(=O)Nc1cccc(C(F)(F)F)c1)N1CCC(c2nnc(O)o2)CC1	ZINC000450911044	GG	On-Demand	Anodyne	CCR2	42	37
CC(=O)CCCCCOc1ccc(Cl)c(F)c1	ZINC000450911060	CI	On-Demand	Anodyne	P2RY12	31	43
CC(=O)CCCCCOc1ccc(Cl)c(F)c1	ZINC000450911060	CI	On-Demand	Anodyne	SHC	22	40
CC(=O)CCCCCOc1ccc(Cl)c(F)c1	ZINC000450911060	CI	On-Demand	Anodyne	PLA2G4B	73	36
CC(=O)CCCCCOc1ccc(Cl)c(F)c1	ZINC000450911060	CI	On-Demand	Anodyne	LSS	22	42
O=c1cc(N2CCC(Cc3cccc(F)c3F)CC2)nc2ccccn12	ZINC000450911084	FG	On-Demand	Anodyne	PIK3CB	15	42
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911086	FE	On-Demand	Anodyne	CTSK	32	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911086	FE	On-Demand	Anodyne	CAPNS1	55	38
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911086	FE	On-Demand	Anodyne	CAPN1	62	41
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911086	FE	On-Demand	Anodyne	CAPN2	72	35
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911086	FE	On-Demand	Anodyne	FPR1	43	35
COC(=O)[C@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911086	FE	On-Demand	Anodyne	NPR	41	43
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911088	FE	On-Demand	Anodyne	CTSK	32	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911088	FE	On-Demand	Anodyne	CAPNS1	55	38
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911088	FE	On-Demand	Anodyne	CAPN1	62	41
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911088	FE	On-Demand	Anodyne	CAPN2	72	35
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911088	FE	On-Demand	Anodyne	FPR1	43	35
COC(=O)[C@@H](CC(F)(F)F)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450911088	FE	On-Demand	Anodyne	NPR	41	43
CCS(=O)(=O)c1ccc(Cn2cnc3cc(C)c(C)cc32)cc1	ZINC000450911104	EG	On-Demand	Anodyne	NR1I2	61	47
c1ccc(-c2n[nH]c(CNc3ccnc(N4CCOCC4)n3)n2)nc1	ZINC000450911115	EC	On-Demand	Anodyne	PIK3CA	16	45
CN(Cc1ccccc1)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450911128	ED	On-Demand	Anodyne	HCRTR1	15	41
Cc1cccc(CN2CCC[C@@H](c3nnc(O)o3)C2)n1	ZINC000450911144	CD	On-Demand	Anodyne	PDE8A	0	42
Cc1cccc(CN2CCC[C@H](c3nnc(O)o3)C2)n1	ZINC000450911155	CD	On-Demand	Anodyne	PDE8A	0	42
Oc1nnc(C2CCN(Cc3nc(-c4cccc(Cl)c4)no3)CC2)o1	ZINC000450911204	FF	On-Demand	Anodyne	GRM5	27	45
CNC(=O)c1ccc(NC2(Cc3ccccc3)CCOCC2)c([N+](=O)[O-])c1	ZINC000450911218	FG	On-Demand	Bother	TAAR1	17	41
COC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1OC	ZINC000450911238	DE	On-Demand	Anodyne	ALOX5AP	27	41
O[C@@H]1CCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450911240	FE	On-Demand	Anodyne	DYRK1A	23	43
O[C@@H]1CCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450911240	FE	On-Demand	Anodyne	CLK1	18	43
O[C@@H]1CCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450911240	FE	On-Demand	Anodyne	CLK2	27	43
O[C@@H]1CCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450911240	FE	On-Demand	Anodyne	CLK4	62	43
O[C@@H]1CCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450911240	FE	On-Demand	Anodyne	CD38	58	40
O[C@@H]1CCC[C@H]1CNc1ncnc2ccc(I)cc12	ZINC000450911240	FE	On-Demand	Anodyne	DYRK1B	29	43
COc1ccc(CCNC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1OC	ZINC000450911241	GD	On-Demand	Anodyne	DRD4	15	40
COc1ccc(CCNC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1OC	ZINC000450911241	GD	On-Demand	Anodyne	SSTR5	58	42
CCn1c(SCC2CC(F)(F)C2)nc2ccc(F)cc2c1=O	ZINC000450911251	EH	On-Demand	Anodyne	Q8MHZ5_SHEEP	75	39
COC(=O)c1ccc(Cn2cnc(C(C)C)cc2=O)cc1Cl	ZINC000450911276	DF	On-Demand	Anodyne	DNAE	63	35
CCCn1c(C)nnc1SCc1nc(-c2cc(OC)ncn2)no1	ZINC000450911280	EE	On-Demand	Anodyne	WNT3A	22	43
CCCn1c(C)nnc1SCc1nc(-c2cc(OC)ncn2)no1	ZINC000450911280	EE	On-Demand	Anodyne	AXIN2	0	45
CC(=O)c1cc(N[C@H](C)C2CCCC2)ccc1[N+](=O)[O-]	ZINC000450911285	CH	On-Demand	Bother	AADAC	0	40
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450911304	FE	On-Demand	Mild	ADRB2	32	57
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450911304	FE	On-Demand	Mild	ADRB3	42	57
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450911304	FE	On-Demand	Mild	ABCB1	52	39
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450911305	FE	On-Demand	Mild	ADRB2	32	57
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450911305	FE	On-Demand	Mild	ADRB3	42	57
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450911305	FE	On-Demand	Mild	ABCB1	52	39
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450911306	FE	On-Demand	Mild	ADRB2	32	57
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450911306	FE	On-Demand	Mild	ADRB3	42	57
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450911306	FE	On-Demand	Mild	ABCB1	52	39
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450911307	FE	On-Demand	Mild	ADRB2	32	57
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450911307	FE	On-Demand	Mild	ADRB3	42	57
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450911307	FE	On-Demand	Mild	ABCB1	52	39
C=C(CC)CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450911313	CG	On-Demand	Mild	TAAR1	18	47
COc1ccc2ncc(=O)n(Cc3ccc(C(=O)OC(C)C)cc3)c2c1	ZINC000450911329	FG	On-Demand	Anodyne	PTGS2	26	41
COc1ccc2ncc(=O)n(Cc3ccc(C(=O)OC(C)C)cc3)c2c1	ZINC000450911329	FG	On-Demand	Anodyne	PROKR1	52	31
COc1ccc2ncc(=O)n(CCc3c(C)noc3C)c2c1	ZINC000450911372	CE	On-Demand	Anodyne	BRD4	15	41
CC[C@H](C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450911373	CD	On-Demand	Anodyne	AVPR1B	57	41
CC[C@H](C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450911373	CD	On-Demand	Anodyne	MTNR1A	43	40
CC[C@H](C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450911373	CD	On-Demand	Anodyne	MTNR1B	44	40
CC[C@@H](C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450911374	CD	On-Demand	Anodyne	AVPR1B	57	41
CC[C@@H](C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450911374	CD	On-Demand	Anodyne	MTNR1A	43	40
CC[C@@H](C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450911374	CD	On-Demand	Anodyne	MTNR1B	44	40
Cc1nc(N2CCC(Cc3cccc(F)c3F)CC2)ncc1[N+](=O)[O-]	ZINC000450911378	EG	On-Demand	Bother	PRKCQ	25	44
CN1CCO[C@@H](CN(CC2CC2)C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450911403	FG	On-Demand	Anodyne	OXTR	0	43
CCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450911408	GF	On-Demand	Anodyne	AVPR1B	58	45
CCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450911408	GF	On-Demand	Anodyne	CMA1	26	40
CCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450911408	GF	On-Demand	Anodyne	PLA2G2A	40	37
CCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450911408	GF	On-Demand	Anodyne	MTNR1A	62	40
CCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450911408	GF	On-Demand	Anodyne	MTNR1B	55	40
CCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450911408	GF	On-Demand	Anodyne	ROCK2	43	37
CCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450911408	GF	On-Demand	Anodyne	CTRC	30	40
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)C1	ZINC000450911411	FG	On-Demand	Anodyne	OXTR	0	43
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@H]2C[C@@H]2c2ccccc2Cl)C1	ZINC000450911413	FG	On-Demand	Anodyne	OXTR	0	43
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450911416	FG	On-Demand	Anodyne	OXTR	0	43
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000450911418	FG	On-Demand	Anodyne	OXTR	0	43
O=C(CCCN1CCO[C@@]2(C[C@H]3CC[C@H]2C3)C1)c1ccccc1	ZINC000450911420	DH	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCCN1CCO[C@]2(C[C@H]3CC[C@H]2C3)C1)c1ccccc1	ZINC000450911423	DH	On-Demand	Anodyne	CYP2J2	58	41
COC(=O)c1csc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)n1	ZINC000450911442	FE	On-Demand	Anodyne	SLC6A1	26	46
COC(=O)c1csc(CN2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)n1	ZINC000450911442	FE	On-Demand	Anodyne	SLC6A3	15	45
Cn1[nH]c([C@@H]2CCCN2CC(=O)N2CCN(c3ccc(F)cc3)CC2)nc1=N	ZINC000450911451	GC	On-Demand	Anodyne	CCR1	25	41
Cn1[nH]c([C@@H]2CCCN2CC(=O)N2CCN(c3ccc(F)cc3)CC2)nc1=N	ZINC000450911451	GC	On-Demand	Anodyne	SLC27A1	53	40
Cn1[nH]c([C@H]2CCCN2CC(=O)N2CCN(c3ccc(F)cc3)CC2)nc1=N	ZINC000450911462	GC	On-Demand	Anodyne	CCR1	25	41
Cn1[nH]c([C@H]2CCCN2CC(=O)N2CCN(c3ccc(F)cc3)CC2)nc1=N	ZINC000450911462	GC	On-Demand	Anodyne	SLC27A1	53	40
CCNC(=O)c1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nn1	ZINC000450911466	FF	On-Demand	Anodyne	SCD1	59	56
COc1ccc2ncc(=O)n(CC(=O)NC(C3CC3)C3CC3)c2c1	ZINC000450911469	ED	On-Demand	Anodyne	AVPR1B	51	38
Cc1cc(F)ccc1[C@@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450911471	CH	On-Demand	Anodyne	AKT2	36	43
CCS(=O)(=O)c1ccc(CN(C)CCCOCc2ccccc2)cc1	ZINC000450911472	FH	On-Demand	Anodyne	ACHE	0	43
CCS(=O)(=O)c1ccc(CN(C)CCCOCc2ccccc2)cc1	ZINC000450911472	FH	On-Demand	Anodyne	LTA4H	25	43
CCc1cc(O)nc(SCc2ccc([C@H](C)C(F)(F)F)cc2)n1	ZINC000450911474	EJ	On-Demand	Anodyne	CXCR2	0	43
CCc1cc(O)nc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)n1	ZINC000450911475	EJ	On-Demand	Anodyne	CXCR2	0	43
Cc1cc(F)ccc1[C@H]1CCCN1c1ncnc2[nH]ccc12	ZINC000450911482	CH	On-Demand	Anodyne	AKT2	36	43
CS(=O)(=O)c1ccc(N2CCC(Cc3c(F)cccc3F)CC2)cc1	ZINC000450911490	FH	On-Demand	Anodyne	GPR119	22	50
COC(=O)c1csc(CN2CC[C@@H](c3ccccc3)C[C@@H]2C)n1	ZINC000450911502	EH	On-Demand	Anodyne	MGEA5	24	41
COC(=O)c1csc(CN2CC[C@@H](c3ccccc3)C[C@@H]2C)n1	ZINC000450911502	EH	On-Demand	Anodyne	TRPC6	52	34
COC(=O)c1csc(CN2CC[C@H](c3ccccc3)C[C@H]2C)n1	ZINC000450911504	EH	On-Demand	Anodyne	MGEA5	24	41
COC(=O)c1csc(CN2CC[C@H](c3ccccc3)C[C@H]2C)n1	ZINC000450911504	EH	On-Demand	Anodyne	TRPC6	52	34
COC(=O)c1csc(CN2CC[C@@H](c3ccccc3)C[C@H]2C)n1	ZINC000450911505	EH	On-Demand	Anodyne	MGEA5	24	41
COC(=O)c1csc(CN2CC[C@@H](c3ccccc3)C[C@H]2C)n1	ZINC000450911505	EH	On-Demand	Anodyne	TRPC6	52	34
COC(=O)c1csc(CN2CC[C@H](c3ccccc3)C[C@@H]2C)n1	ZINC000450911506	EH	On-Demand	Anodyne	MGEA5	24	41
COC(=O)c1csc(CN2CC[C@H](c3ccccc3)C[C@@H]2C)n1	ZINC000450911506	EH	On-Demand	Anodyne	TRPC6	52	34
COCCOc1ccc(SCc2nc(-c3cc(C)ccn3)no2)cc1	ZINC000450911531	FH	On-Demand	Anodyne	AXIN2	0	40
Cn1ncc(N2CCC(Cc3cc(F)ccc3F)CC2)c(Cl)c1=O	ZINC000450911534	FG	On-Demand	Anodyne	Q9M629_MAIZE	42	31
COC(=O)c1csc(CN2CCC(c3cccc(Br)c3)CC2)n1	ZINC000450911536	GI	On-Demand	Anodyne	MCHR1	32	43
COC(=O)c1csc(CN2CCC(c3cccc(Br)c3)CC2)n1	ZINC000450911536	GI	On-Demand	Anodyne	MGEA5	27	41
NC(=O)c1cc(N2CCC(Cc3c(F)cccc3F)CC2)ccn1	ZINC000450911552	EF	On-Demand	Anodyne	SIRT1	50	32
NC(=O)c1cc(N2CCC(Cc3c(F)cccc3F)CC2)ccn1	ZINC000450911552	EF	On-Demand	Anodyne	STAT6	41	38
COC(=O)[C@@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@H]1c1ccccc1	ZINC000450911554	EG	On-Demand	Anodyne	DRD4	27	40
COC(=O)[C@@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@H]1c1ccccc1	ZINC000450911554	EG	On-Demand	Anodyne	SLC6A1	80	59
COC(=O)[C@@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@H]1c1ccccc1	ZINC000450911554	EG	On-Demand	Anodyne	SLC6A3	37	41
COC(=O)[C@@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@H]1c1ccccc1	ZINC000450911554	EG	On-Demand	Anodyne	LTA4H	27	41
COC(=O)[C@@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@H]1c1ccccc1	ZINC000450911554	EG	On-Demand	Anodyne	SIGMAR1	37	42
COC(=O)[C@@H]1CN(Cc2ccc(C(C)=O)cc2)C[C@H]1c1ccccc1	ZINC000450911554	EG	On-Demand	Anodyne	NOD2	43	39
Oc1nc(N2CCC(Cc3cccc(F)c3F)CC2)nc2ccccc12	ZINC000450911557	FI	On-Demand	Anodyne	HTR4	25	42
O=[N+]([O-])c1ccc(NC[C@@H]2CCC[C@H]2O)nc1NC[C@@H]1CCC[C@H]1O	ZINC000450911567	FD	On-Demand	Bother	PRKCQ	47	38
CC(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450911568	CE	On-Demand	Bother	TAAR1	17	42
CC(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450911569	CE	On-Demand	Bother	TAAR1	17	42
COc1cccc2c(NC[C@@H]3CCC[C@H]3O)c(C)cnc12	ZINC000450911571	CG	On-Demand	Anodyne	ATP4A	17	42
C/C=C\C[C@H](NC(=O)CCc1ccc2c(c1)OCCO2)C(=O)OCC	ZINC000450911589	EE	On-Demand	Anodyne	LUXR	18	41
C/C=C/C[C@@H](NC(=O)CCc1ccc2c(c1)OCCO2)C(=O)OCC	ZINC000450911590	EE	On-Demand	Anodyne	LUXR	18	41
C/C=C/C[C@H](NC(=O)CCc1ccc2c(c1)OCCO2)C(=O)OCC	ZINC000450911591	EE	On-Demand	Anodyne	LUXR	18	41
C/C=C\C[C@@H](NC(=O)CCc1ccc2c(c1)OCCO2)C(=O)OCC	ZINC000450911592	EE	On-Demand	Anodyne	LUXR	18	41
C/C=C\C[C@H](NC(=O)c1cc2n(n1)CCC2)C(=O)OCC	ZINC000450911612	CD	On-Demand	Anodyne	P2RY12	56	37
C/C=C\C[C@@H](NC(=O)c1cc2n(n1)CCC2)C(=O)OCC	ZINC000450911613	CD	On-Demand	Anodyne	P2RY12	56	37
C/C=C/C[C@@H](NC(=O)c1cc2n(n1)CCC2)C(=O)OCC	ZINC000450911614	CD	On-Demand	Anodyne	P2RY12	56	37
C/C=C/C[C@H](NC(=O)c1cc2n(n1)CCC2)C(=O)OCC	ZINC000450911615	CD	On-Demand	Anodyne	P2RY12	56	37
COc1cc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2c(C)noc2C)ccc1O	ZINC000450911619	GE	On-Demand	Anodyne	TRPV1	0	44
COc1ccccc1NC(=O)[C@@H](C)N1CCC(c2nnc(O)o2)CC1	ZINC000450911625	ED	On-Demand	Anodyne	SMO	28	46
COc1ccccc1NC(=O)[C@H](C)N1CCC(c2nnc(O)o2)CC1	ZINC000450911627	ED	On-Demand	Anodyne	SMO	28	46
CC(C)(CNc1ccc(S(N)(=O)=O)cn1)C1(O)CCCC1	ZINC000450911648	DD	On-Demand	Anodyne	CYNT	43	33
O=C(CCCN1CCOC[C@@]12CCOC2)c1ccc(F)cc1	ZINC000450911658	DE	On-Demand	Anodyne	DRD2	32	48
O=C(CCCN1CCOC[C@@]12CCOC2)c1ccc(F)cc1	ZINC000450911658	DE	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CCOC[C@@]12CCOC2)c1ccc(F)cc1	ZINC000450911658	DE	On-Demand	Anodyne	CYP2J2	46	32
O=C(CCCN1CCOC[C@]12CCOC2)c1ccc(F)cc1	ZINC000450911660	DE	On-Demand	Anodyne	DRD2	32	48
O=C(CCCN1CCOC[C@]12CCOC2)c1ccc(F)cc1	ZINC000450911660	DE	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CCOC[C@]12CCOC2)c1ccc(F)cc1	ZINC000450911660	DE	On-Demand	Anodyne	CYP2J2	46	32
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccsc2Br)C1	ZINC000450911661	FF	On-Demand	Anodyne	OXTR	0	42
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccsc2Br)C1	ZINC000450911662	FF	On-Demand	Anodyne	OXTR	0	42
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450911668	GF	On-Demand	Anodyne	OPRK1	41	41
CCc1nc(C(C)(C)NCCC(=O)NCc2ccc(OC)cc2OC)no1	ZINC000450911679	GE	On-Demand	Anodyne	PDGFRB	24	41
CCc1nc(C(C)(C)NCCC(=O)NCc2ccc(OC)cc2OC)no1	ZINC000450911679	GE	On-Demand	Anodyne	MTNR1A	55	38
CCc1nc(C(C)(C)NCCC(=O)NCc2ccc(OC)cc2OC)no1	ZINC000450911679	GE	On-Demand	Anodyne	MTNR1B	46	38
CC(C)(CNc1ccc2nnc(-c3ccccc3)n2n1)C1(O)CCCC1	ZINC000450911685	FF	On-Demand	Anodyne	PIM1	15	54
CC(C)(CNc1ccc2nnc(-c3ccccc3)n2n1)C1(O)CCCC1	ZINC000450911685	FF	On-Demand	Anodyne	LRRK2	25	42
COc1cccc(C2(F)CCN(C[C@H](O)Cc3ccccc3)CC2)c1	ZINC000450911688	EH	On-Demand	Anodyne	OPRM1	15	52
COc1cccc(C2(F)CCN(C[C@H](O)Cc3ccccc3)CC2)c1	ZINC000450911688	EH	On-Demand	Anodyne	OPRK1	18	52
COc1cccc(C2(F)CCN(C[C@H](O)Cc3ccccc3)CC2)c1	ZINC000450911688	EH	On-Demand	Anodyne	VACHT_TETCF	0	58
COc1cccc(C2(F)CCN(C[C@H](O)Cc3ccccc3)CC2)c1	ZINC000450911688	EH	On-Demand	Anodyne	SIGMAR1	25	43
COc1cccc(C2(F)CCN(C[C@H](O)Cc3ccccc3)CC2)c1	ZINC000450911688	EH	On-Demand	Anodyne	SLC18A3	37	42
COc1cccc(C2(F)CCN(C[C@H](O)Cc3ccccc3)CC2)c1	ZINC000450911688	EH	On-Demand	Anodyne	ABCB1	61	42
COC(=O)c1csc(CSCc2ccc(OC)c(Cl)c2)n1	ZINC000450911705	EI	On-Demand	Anodyne	PDE6A	44	34
COC(=O)c1csc(CSCc2ccc(OC)c(Cl)c2)n1	ZINC000450911705	EI	On-Demand	Anodyne	PTPRG	0	41
COc1cccc2c(N3CCC(OCCOC(C)C)CC3)ccnc12	ZINC000450911722	EH	On-Demand	Anodyne	PDE3B	54	35
C1=C(CN2CCOC[C@H]2c2nc(-c3cccs3)no2)CCCC1	ZINC000450911755	EH	On-Demand	Anodyne	ETHR	27	41
C1=C(CN2CCOC[C@@H]2c2nc(-c3cccs3)no2)CCCC1	ZINC000450911757	EH	On-Demand	Anodyne	ETHR	27	41
COc1cc(CC(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)ccc1O	ZINC000450911762	FC	On-Demand	Anodyne	TRPV1	27	46
COc1ccc(CNC(=O)CCn2cnc3c(C)csc3c2=O)c(OC)c1	ZINC000450911764	GE	On-Demand	Anodyne	PDGFRB	28	41
C[C@@H]1CCC[C@@]1(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911766	DI	On-Demand	Anodyne	NAMPT	41	37
C/C=C\C[C@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OCC	ZINC000450911768	FG	On-Demand	Anodyne	P2RY12	78	38
C[C@H]1CCC[C@@]1(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911769	DI	On-Demand	Anodyne	NAMPT	41	37
C[C@@H]1CCC[C@]1(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911770	DI	On-Demand	Anodyne	NAMPT	41	37
C/C=C/C[C@@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OCC	ZINC000450911771	FG	On-Demand	Anodyne	P2RY12	78	38
C[C@H]1CCC[C@]1(C)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911772	DI	On-Demand	Anodyne	NAMPT	49	37
C/C=C\C[C@@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OCC	ZINC000450911773	FG	On-Demand	Anodyne	P2RY12	78	38
C/C=C/C[C@H](NC(=O)c1nc2ccccc2nc1C1CC1)C(=O)OCC	ZINC000450911775	FG	On-Demand	Anodyne	P2RY12	78	38
COc1cc(CC(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)ccc1O	ZINC000450911776	FC	On-Demand	Anodyne	TRPV1	27	46
COc1cc(CC(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)ccc1O	ZINC000450911780	FC	On-Demand	Anodyne	TRPV1	27	46
COc1ccc(OCCCCCC(C)=O)c(Br)c1	ZINC000450911782	DH	On-Demand	Anodyne	THRA	47	46
COc1ccc(OCCCCCC(C)=O)c(Br)c1	ZINC000450911782	DH	On-Demand	Anodyne	THRB	30	46
COc1ccc(OCCCCCC(C)=O)c(Br)c1	ZINC000450911782	DH	On-Demand	Anodyne	MTNR1A	51	43
COc1ccc(OCCCCCC(C)=O)c(Br)c1	ZINC000450911782	DH	On-Demand	Anodyne	MTNR1B	51	43
COc1ccc(OCCCCCC(C)=O)c(Br)c1	ZINC000450911782	DH	On-Demand	Anodyne	PLA2G4B	66	38
COc1ccc(OCCCCCC(C)=O)c(Br)c1	ZINC000450911782	DH	On-Demand	Anodyne	ACR	31	45
COc1cc(CC(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)ccc1O	ZINC000450911786	FC	On-Demand	Anodyne	TRPV1	27	46
COC(=O)c1coc(COc2ccc(S(=O)(=O)NCCC(C)C)cc2)n1	ZINC000450911793	GE	On-Demand	Anodyne	MMP2	17	40
COC(=O)c1coc(COc2ccc(S(=O)(=O)NCCC(C)C)cc2)n1	ZINC000450911793	GE	On-Demand	Anodyne	ADAMTS4	58	38
Cc1cnc(NCc2cnc(C3CC3)o2)c([N+](=O)[O-])c1	ZINC000450911794	CF	On-Demand	Bother	PRKCQ	44	38
CC(C)(CC(=O)CS(=O)(=O)c1ccccc1)C1CC1	ZINC000450911796	CF	On-Demand	Anodyne	E1	0	44
Oc1nnc(C2CCN(Cc3c(-c4ccccc4)nc4ccccn34)CC2)o1	ZINC000450911798	GG	On-Demand	Anodyne	AKT2	49	35
CNC(=O)C[C@@H](NCc1ccccc1OC1CC1)c1ccccc1	ZINC000450911805	DG	On-Demand	Anodyne	SLC5A4	52	33
CNC(=O)C[C@H](NCc1ccccc1OC1CC1)c1ccccc1	ZINC000450911807	DG	On-Demand	Anodyne	SLC5A4	52	33
COc1ccc(-c2cnc(CN3CCC(c4nnc(O)o4)CC3)o2)cc1	ZINC000450911813	FF	On-Demand	Anodyne	PDK1	40	35
FC1(c2ccc(Cl)cc2)CCN(Cc2cnn[nH]2)CC1	ZINC000450911822	CF	On-Demand	Anodyne	DRD3	0	50
Oc1nnc(C2CCN(CCOc3cccc(F)c3)CC2)o1	ZINC000450911843	DE	On-Demand	Anodyne	ESR1	50	35
Oc1nnc(C2CCN(CCOc3cccc(F)c3)CC2)o1	ZINC000450911843	DE	On-Demand	Anodyne	HTR2A	22	42
Oc1nnc(C2CCN(CCOc3cccc(F)c3)CC2)o1	ZINC000450911843	DE	On-Demand	Anodyne	CHRNA10	65	47
CC[C@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911844	CF	On-Demand	Anodyne	GYRB	0	40
CC[C@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911844	CF	On-Demand	Anodyne	CYP11B2	42	39
CC[C@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911844	CF	On-Demand	Anodyne	NAMPT	40	34
CC[C@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911844	CF	On-Demand	Anodyne	HAO2	26	43
CC[C@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911844	CF	On-Demand	Anodyne	SUCNR1	42	39
CC[C@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911844	CF	On-Demand	Anodyne	PDS	53	35
CC[C@@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911846	CF	On-Demand	Anodyne	GYRB	0	40
CC[C@@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911846	CF	On-Demand	Anodyne	CYP11B2	42	39
CC[C@@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911846	CF	On-Demand	Anodyne	NAMPT	40	34
CC[C@@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911846	CF	On-Demand	Anodyne	HAO2	26	43
CC[C@@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911846	CF	On-Demand	Anodyne	SUCNR1	42	39
CC[C@@H](O)CC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000450911846	CF	On-Demand	Anodyne	PDS	53	35
CC(C)OCCOC1CCN(c2nccc3cc(C(F)(F)F)ccc23)CC1	ZINC000450911848	GJ	On-Demand	Anodyne	LIPG	57	39
CCN(CCN(C)Cc1ccccc1)[C@H]1CCNC1=O	ZINC000450911874	CD	On-Demand	Anodyne	GHRL	51	32
CCN(CCN(C)Cc1ccccc1)[C@@H]1CCNC1=O	ZINC000450911875	CD	On-Demand	Anodyne	GHRL	51	32
CCC(=O)CCCN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450911881	DH	On-Demand	Anodyne	DRD4	46	35
CCC(=O)CCCN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450911881	DH	On-Demand	Anodyne	HTR7	30	42
CCC(=O)CCCN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450911881	DH	On-Demand	Anodyne	SIGMAR1	23	42
CCC(=O)CCCN1CCC(F)(c2cccc(OC)c2)CC1	ZINC000450911881	DH	On-Demand	Anodyne	EBP	40	41
COC(=O)c1ccc(CC(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1	ZINC000450911882	FC	On-Demand	Anodyne	LEPB	0	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1	ZINC000450911882	FC	On-Demand	Anodyne	SSTR3	24	40
COC(=O)c1ccc(CC(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1	ZINC000450911884	FC	On-Demand	Anodyne	LEPB	0	40
COC(=O)c1ccc(CC(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)cc1	ZINC000450911884	FC	On-Demand	Anodyne	SSTR3	24	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)cc1	ZINC000450911886	FC	On-Demand	Anodyne	LEPB	0	40
COC(=O)c1ccc(CC(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)cc1	ZINC000450911886	FC	On-Demand	Anodyne	SSTR3	24	40
CC(C)OCCOC1CCN(c2ncnc3ccsc23)CC1	ZINC000450911887	DG	On-Demand	Anodyne	PDE3A	45	35
CC(C)OCCOC1CCN(c2ncnc3ccsc23)CC1	ZINC000450911887	DG	On-Demand	Anodyne	PDE3B	67	36
CC(C)OCCOC1CCN(c2ncnc3ccsc23)CC1	ZINC000450911887	DG	On-Demand	Anodyne	SIRT3	54	34
CC(C)OCCOC1CCN(c2ncnc3ccsc23)CC1	ZINC000450911887	DG	On-Demand	Anodyne	SIRT2	55	34
COC(=O)c1ccc(CC(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)cc1	ZINC000450911888	FC	On-Demand	Anodyne	LEPB	0	40
COC(=O)c1ccc(CC(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)cc1	ZINC000450911888	FC	On-Demand	Anodyne	SSTR3	24	40
C=CCN1CC[C@H](N(C)CCCC(=O)c2ccc(Br)cc2)C1=O	ZINC000450911897	GG	On-Demand	Mild	SHC	44	36
C=CCN1CC[C@H](N(C)CCCC(=O)c2ccc(Br)cc2)C1=O	ZINC000450911897	GG	On-Demand	Mild	HDAC8	18	41
COC(=O)c1coc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)n1	ZINC000450911898	ED	On-Demand	Anodyne	FASN	40	34
C=CCN1CC[C@@H](N(C)CCCC(=O)c2ccc(Br)cc2)C1=O	ZINC000450911899	GG	On-Demand	Mild	SHC	44	36
C=CCN1CC[C@@H](N(C)CCCC(=O)c2ccc(Br)cc2)C1=O	ZINC000450911899	GG	On-Demand	Mild	HDAC8	18	41
COC(=O)c1coc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)n1	ZINC000450911900	ED	On-Demand	Anodyne	FASN	40	34
CC[C@@H]1CC[C@H](C)N(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450911916	CD	On-Demand	Anodyne	SCD1	25	46
CC[C@@H]1CC[C@H](C)N(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450911916	CD	On-Demand	Anodyne	SCD	29	40
CN(C)C(=O)c1cnc(N2CCC(Cc3cccc(F)c3F)CC2)c(Cl)c1	ZINC000450911918	GI	On-Demand	Anodyne	P2RY12	27	40
CN(C)C(=O)c1cnc(N2CCC(Cc3cccc(F)c3F)CC2)c(Cl)c1	ZINC000450911918	GI	On-Demand	Anodyne	CXCR3	34	40
c1ccc(-c2n[nH]c(CNc3nccc(N[C@@H]4CCCOC4)n3)n2)nc1	ZINC000450911955	FD	On-Demand	Anodyne	PKNB	22	40
c1ccc(-c2n[nH]c(CNc3nccc(N[C@H]4CCCOC4)n3)n2)nc1	ZINC000450911961	FD	On-Demand	Anodyne	PKNB	22	40
CCCOc1cccc(Cn2cnc3cc(OC)ccc3c2=O)c1	ZINC000450911968	DG	On-Demand	Anodyne	MAOB	16	42
CC(C)N1CCC(C(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)CC1	ZINC000450911973	ED	On-Demand	Anodyne	EPHX2	24	45
CC(C)N1CCC(C(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)CC1	ZINC000450911974	ED	On-Demand	Anodyne	EPHX2	24	45
CC(C)N1CCC(C(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)CC1	ZINC000450911975	ED	On-Demand	Anodyne	EPHX2	24	45
CC(C)N1CCC(C(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)CC1	ZINC000450911976	ED	On-Demand	Anodyne	EPHX2	24	45
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)N[C@H](c1ccccc1)c1cccs1	ZINC000450911979	GF	On-Demand	Anodyne	PRCP	17	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)N[C@H](c1ccccc1)c1cccs1	ZINC000450911980	GF	On-Demand	Anodyne	PRCP	17	40
O=C(CN1CCC[C@@H](c2nnc(O)o2)C1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450911981	GF	On-Demand	Anodyne	PRCP	17	40
O=C(CN1CCC[C@H](c2nnc(O)o2)C1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450911982	GF	On-Demand	Anodyne	PRCP	17	40
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450911996	GD	On-Demand	Anodyne	FAAH	15	43
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450911997	GD	On-Demand	Anodyne	FAAH	15	43
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450911998	GD	On-Demand	Anodyne	FAAH	15	43
Cn1nc(-c2ccccc2)cc1C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450911999	GD	On-Demand	Anodyne	FAAH	15	43
CC[C@@H](O)CC(=O)Nc1cccc(S(=O)(=O)NCCN(C)C)c1	ZINC000450912000	EC	On-Demand	Anodyne	CA4	15	42
CC[C@H](O)CC(=O)Nc1cccc(S(=O)(=O)NCCN(C)C)c1	ZINC000450912001	EC	On-Demand	Anodyne	CA4	15	42
C[C@@H](O)CCCn1nnc(-c2ccc(Cl)cc2Cl)n1	ZINC000450912033	DF	On-Demand	Anodyne	CNR1	17	43
C[C@H](O)CCCn1nnc(-c2ccc(Cl)cc2Cl)n1	ZINC000450912034	DF	On-Demand	Anodyne	CNR1	17	43
Cc1cc(N2CCC(Cc3cc(F)ccc3F)CC2)n2ncnc2n1	ZINC000450912035	EG	On-Demand	Anodyne	DHOD	0	43
COc1ccc2ncc(=O)n(CCCCc3ccccc3)c2c1	ZINC000450912039	DG	On-Demand	Anodyne	PLA2G2A	43	36
COc1ccc2ncc(=O)n(CCCCc3ccccc3)c2c1	ZINC000450912039	DG	On-Demand	Anodyne	GSG2	43	38
COc1ccc2ncc(=O)n(CCCCc3ccccc3)c2c1	ZINC000450912039	DG	On-Demand	Anodyne	CES1D	52	32
CCS(=O)(=O)c1ccc(COc2ccsc2C(C)=O)cc1	ZINC000450912044	DG	On-Demand	Anodyne	INPPL1	0	43
COCCOC[C@H](O)CN1C[C@@H](C(=O)OC)[C@H](c2ccccc2)C1	ZINC000450912059	EC	On-Demand	Anodyne	SLC6A1	74	46
COCCOC[C@H](O)CN1C[C@@H](C(=O)OC)[C@H](c2ccccc2)C1	ZINC000450912059	EC	On-Demand	Anodyne	HSP90AB1	36	40
COC(=O)c1ccc(CN2CCN(c3cnccc3C)CC2)cc1Cl	ZINC000450912062	FG	On-Demand	Anodyne	DRD4	37	40
COC(=O)c1ccc(CN2CCN(c3cnccc3C)CC2)cc1Cl	ZINC000450912062	FG	On-Demand	Anodyne	DRD3	0	40
CCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912081	CC	On-Demand	Anodyne	AVPR1B	30	45
CCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912081	CC	On-Demand	Anodyne	MTNR1A	64	46
FC(F)(F)c1cnc(N2CCC[C@@]3(CCSC3)C2)s1	ZINC000450912084	DH	On-Demand	Anodyne	MLYCD	61	37
FC(F)(F)c1cnc(N2CCC[C@]3(CCSC3)C2)s1	ZINC000450912085	DH	On-Demand	Anodyne	MLYCD	61	37
CC(=O)c1ccc(CN2CCN(c3cnccc3C)CC2)cc1	ZINC000450912088	DF	On-Demand	Anodyne	DRD4	37	41
CC(=O)c1ccc(CN2CCN(c3cnccc3C)CC2)cc1	ZINC000450912088	DF	On-Demand	Anodyne	ABCB1	0	43
C[C@@H](O)CCN1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000450912093	CG	On-Demand	Anodyne	US28	0	40
C[C@H](O)CCN1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000450912094	CG	On-Demand	Anodyne	US28	0	40
C=C(CC)CNc1ccc([N+](=O)[O-])cc1COC	ZINC000450912100	CG	On-Demand	Mild	CACNA1D	50	34
C=C(CC)CNc1ccc([N+](=O)[O-])cc1COC	ZINC000450912100	CG	On-Demand	Mild	F2RL3	44	36
CNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)c([N+](=O)[O-])c1	ZINC000450912113	FH	On-Demand	Bother	TAAR1	22	44
CNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)c([N+](=O)[O-])c1	ZINC000450912114	FH	On-Demand	Bother	TAAR1	22	44
Cn1ncc(N2CCC[C@@H]2c2ccc(F)cc2F)c(Cl)c1=O	ZINC000450912121	EG	On-Demand	Anodyne	PRCP	43	31
Cn1ncc(N2CCC[C@H]2c2ccc(F)cc2F)c(Cl)c1=O	ZINC000450912122	EG	On-Demand	Anodyne	PRCP	43	31
C=C(CC)CNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-]	ZINC000450912129	CD	On-Demand	Mild	BDKRB1	22	41
C=CCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2C)nc1	ZINC000450912166	EH	On-Demand	Mild	ACKR3	40	32
C=CCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2C)nc1	ZINC000450912167	EH	On-Demand	Mild	ACKR3	40	32
COc1ccc2ncc(=O)n(CC(=O)NC3CCCCCC3)c2c1	ZINC000450912181	EE	On-Demand	Anodyne	AVPR1B	48	47
COc1ccc2ncc(=O)n(CC(=O)NC3CCCCCC3)c2c1	ZINC000450912181	EE	On-Demand	Anodyne	FAAH	24	41
CCOC(=O)c1ccc(CN2CCN(c3nccnc3C)CC2)nc1	ZINC000450912182	ED	On-Demand	Anodyne	P2RY12	54	43
Fc1ccc([C@@H]2CCCN2c2cc(N3CCCC3)ncn2)c(F)c1	ZINC000450912183	EH	On-Demand	Anodyne	PRCP	50	49
Fc1ccc([C@@H]2CCCN2c2cc(N3CCCC3)ncn2)c(F)c1	ZINC000450912183	EH	On-Demand	Anodyne	DPP4	0	43
Fc1ccc([C@H]2CCCN2c2cc(N3CCCC3)ncn2)c(F)c1	ZINC000450912184	EH	On-Demand	Anodyne	PRCP	50	49
Fc1ccc([C@H]2CCCN2c2cc(N3CCCC3)ncn2)c(F)c1	ZINC000450912184	EH	On-Demand	Anodyne	DPP4	0	43
CCOC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nc1	ZINC000450912192	EH	On-Demand	Anodyne	SSTR5	42	37
CCOC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nc1	ZINC000450912193	EH	On-Demand	Anodyne	SSTR5	42	37
Cc1ccc(F)c(Cn2nc(C)sc2=O)c1	ZINC000450912199	BE	On-Demand	Anodyne	PKM	22	41
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc(Br)cc3)CC2)o1	ZINC000450912201	GE	On-Demand	Anodyne	VACHT_TETCF	0	42
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc(Br)cc3)CC2)o1	ZINC000450912201	GE	On-Demand	Anodyne	ACOX1	73	33
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc(Br)cc3)CC2)o1	ZINC000450912201	GE	On-Demand	Anodyne	HSP90AB1	30	42
Oc1nnc(C2CCN(C[C@H](O)COc3ccc(Br)cc3)CC2)o1	ZINC000450912202	GE	On-Demand	Anodyne	VACHT_TETCF	0	42
Oc1nnc(C2CCN(C[C@H](O)COc3ccc(Br)cc3)CC2)o1	ZINC000450912202	GE	On-Demand	Anodyne	ACOX1	73	33
Oc1nnc(C2CCN(C[C@H](O)COc3ccc(Br)cc3)CC2)o1	ZINC000450912202	GE	On-Demand	Anodyne	HSP90AB1	30	42
CC(=O)CCCCCn1nnc(Cc2ccc(C)cc2)n1	ZINC000450912203	CF	On-Demand	Anodyne	MGLL	0	52
CO[C@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C)C1	ZINC000450912220	CG	On-Demand	Anodyne	HRH3	33	47
CO[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@H](C)C1	ZINC000450912223	CG	On-Demand	Anodyne	HRH3	33	47
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450912225	GG	On-Demand	Anodyne	VDR	45	37
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450912225	GG	On-Demand	Anodyne	ACOX1	48	36
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450912225	GG	On-Demand	Anodyne	ABCB1	48	37
CO[C@@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C)C1	ZINC000450912226	CG	On-Demand	Anodyne	HRH3	33	47
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450912227	GG	On-Demand	Anodyne	VDR	45	37
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450912227	GG	On-Demand	Anodyne	ACOX1	48	36
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450912227	GG	On-Demand	Anodyne	ABCB1	48	37
CC(C)C[C@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccccc1	ZINC000450912228	FF	On-Demand	Anodyne	CCR5	18	43
CO[C@H]1CCN(CCc2ccc(Cl)cc2)[C@@H](C)C1	ZINC000450912229	CG	On-Demand	Anodyne	HRH3	33	47
CC(C)C[C@@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccccc1	ZINC000450912230	FF	On-Demand	Anodyne	CCR5	18	43
CC(C)(CNc1cc(C(F)(F)F)nc2ncnn12)C1(O)CCCC1	ZINC000450912235	EF	On-Demand	Anodyne	DHOD	0	52
Oc1nnc(C2CCN(Cc3csc(Nc4ccccc4)n3)CC2)o1	ZINC000450912249	FF	On-Demand	Anodyne	SPHK2	55	34
Oc1nnc(C2CCN(Cc3csc(Nc4ccccc4)n3)CC2)o1	ZINC000450912249	FF	On-Demand	Anodyne	SPHK1	50	33
Oc1nnc(C2CCN(Cc3csc(Nc4ccccc4)n3)CC2)o1	ZINC000450912249	FF	On-Demand	Anodyne	TRPC6	44	31
CC(C)c1nnc(CS(=O)(=O)c2cccc(C(F)(F)F)c2)s1	ZINC000450912254	FH	On-Demand	Anodyne	CACNA1B	48	36
Cc1cccc(-c2noc(CN3CCC(c4nnc(O)o4)CC3)n2)c1	ZINC000450912257	EF	On-Demand	Anodyne	GRM5	26	46
Cc1cc(C)c(CNc2cc(N3CCC[C@@H](C)C3)ncn2)cn1	ZINC000450912264	DG	On-Demand	Anodyne	PRCP	15	42
O=S(=O)(CC1CC(F)(F)C1)c1cccc(C(F)(F)F)c1	ZINC000450912266	DH	On-Demand	Anodyne	CACNA1B	34	45
Cc1cc(C)c(CNc2cc(N3CCC[C@H](C)C3)ncn2)cn1	ZINC000450912269	DG	On-Demand	Anodyne	PRCP	15	42
C/C=C/C[C@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OCC	ZINC000450912277	FF	On-Demand	Bother	CCR3	22	44
C/C=C/C[C@@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OCC	ZINC000450912279	FF	On-Demand	Bother	CCR3	22	44
C/C=C\C[C@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OCC	ZINC000450912280	FF	On-Demand	Bother	CCR3	22	44
C/C=C\C[C@@H](NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(=O)OCC	ZINC000450912283	FF	On-Demand	Bother	CCR3	22	44
CCc1ccccc1NC(=O)[C@@H](C)N1CCC(c2nnc(O)o2)CC1	ZINC000450912328	EF	On-Demand	Anodyne	KCNQ2	42	33
CCc1ccccc1NC(=O)[C@H](C)N1CCC(c2nnc(O)o2)CC1	ZINC000450912329	EF	On-Demand	Anodyne	KCNQ2	42	33
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2nc3ccccc3nc2C2CC2)C1	ZINC000450912337	GH	On-Demand	Anodyne	RHODESAIN	0	40
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2nc3ccccc3nc2C2CC2)C1	ZINC000450912338	GH	On-Demand	Anodyne	RHODESAIN	0	40
CCCOc1cccc(CS(=O)(=O)c2ccccc2OC)c1	ZINC000450912354	DG	On-Demand	Anodyne	SQLE	49	34
Cc1cc(C)c(CNc2ccc(S(C)(=O)=O)cc2C(F)(F)F)cn1	ZINC000450912382	FH	On-Demand	Anodyne	PTK2	53	39
Cc1cc(C)c(CNc2ccc(S(C)(=O)=O)cc2C(F)(F)F)cn1	ZINC000450912382	FH	On-Demand	Anodyne	NR1H3	51	39
Cc1cc(C)c(CNc2ccc(S(C)(=O)=O)cc2C(F)(F)F)cn1	ZINC000450912382	FH	On-Demand	Anodyne	NR1H2	42	39
C[C@@H](CN1CC[C@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912383	DD	On-Demand	Anodyne	SLC6A1	50	34
C[C@@H](CN1CC[C@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912383	DD	On-Demand	Anodyne	OPRK1	23	41
C[C@@H](CN1CC[C@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912383	DD	On-Demand	Anodyne	FASN	41	42
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)OC)c(OC)c2)cc1	ZINC000450912388	FF	On-Demand	Anodyne	ADAMTS4	43	37
C[C@H](CN1CC[C@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912393	DD	On-Demand	Anodyne	SLC6A1	50	34
C[C@H](CN1CC[C@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912393	DD	On-Demand	Anodyne	OPRK1	23	41
C[C@H](CN1CC[C@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912393	DD	On-Demand	Anodyne	FASN	41	42
C[C@@H](CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912395	DD	On-Demand	Anodyne	SLC6A1	50	34
C[C@@H](CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912395	DD	On-Demand	Anodyne	OPRK1	23	41
C[C@@H](CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912395	DD	On-Demand	Anodyne	FASN	41	42
C[C@H](CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912397	DD	On-Demand	Anodyne	SLC6A1	50	34
C[C@H](CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912397	DD	On-Demand	Anodyne	OPRK1	23	41
C[C@H](CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)S(C)(=O)=O	ZINC000450912397	DD	On-Demand	Anodyne	FASN	41	42
C/C=C/C[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OCC	ZINC000450912406	GF	On-Demand	Anodyne	P2RY12	125	35
C/C=C\C[C@H](NC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OCC	ZINC000450912410	GF	On-Demand	Anodyne	P2RY12	125	35
C/C=C/C[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OCC	ZINC000450912413	GF	On-Demand	Anodyne	P2RY12	125	35
C/C=C\C[C@H](NC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C(=O)OCC	ZINC000450912415	GF	On-Demand	Anodyne	P2RY12	125	35
O=C(CC[C@@H]1CCCCO1)CS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450912417	FG	On-Demand	Anodyne	CACNA1B	54	34
CCc1cc(O)nc(SCc2ccc(C(=O)OC)cc2Br)n1	ZINC000450912433	GH	On-Demand	Anodyne	CA7	15	40
CCc1cc(O)nc(SCc2ccc(C(=O)OC)cc2Br)n1	ZINC000450912433	GH	On-Demand	Anodyne	CA13	20	41
C/C=C/C[C@H](NC(=O)C[C@@H](O)C(C)C)C(=O)OCC	ZINC000450912435	CD	On-Demand	Anodyne	NOD1	57	38
C/C=C\C[C@H](NC(=O)C[C@H](O)C(C)C)C(=O)OCC	ZINC000450912436	CD	On-Demand	Anodyne	NOD1	57	38
C/C=C/C[C@H](NC(=O)C[C@H](O)C(C)C)C(=O)OCC	ZINC000450912437	CD	On-Demand	Anodyne	NOD1	57	38
O=C(CC[C@H]1CCCCO1)CS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450912438	FG	On-Demand	Anodyne	CACNA1B	54	34
CC(C)(CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F)C1(O)CCCC1	ZINC000450912439	GG	On-Demand	Anodyne	CA2	29	40
C/C=C\C[C@H](NC(=O)C[C@@H](O)C(C)C)C(=O)OCC	ZINC000450912440	CD	On-Demand	Anodyne	NOD1	57	38
Cc1cc(C)c(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)cn1	ZINC000450912446	GG	On-Demand	Bother	PIK3CA	0	41
C/C=C\C[C@@H](NC(=O)CCCn1nc(C)nc1C)C(=O)OCC	ZINC000450912450	DD	On-Demand	Anodyne	NOD1	52	37
C/C=C/C[C@H](NC(=O)CCCn1nc(C)nc1C)C(=O)OCC	ZINC000450912451	DD	On-Demand	Anodyne	NOD1	52	37
C/C=C/C[C@@H](NC(=O)CCCn1nc(C)nc1C)C(=O)OCC	ZINC000450912452	DD	On-Demand	Anodyne	NOD1	52	37
C/C=C\C[C@H](NC(=O)CCCn1nc(C)nc1C)C(=O)OCC	ZINC000450912453	DD	On-Demand	Anodyne	NOD1	52	37
C=CCOc1ccc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cnoc2C)cc1	ZINC000450912465	GF	On-Demand	Mild	ITGA4	43	33
CC[C@@H]1CC[C@H](C)N(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450912473	CG	On-Demand	Anodyne	SLC6A9	17	43
C/C=C/C[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912491	EF	On-Demand	Anodyne	KLK3	40	30
C/C=C/C[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912491	EF	On-Demand	Anodyne	CAPN2	70	33
C/C=C/C[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912491	EF	On-Demand	Anodyne	ACE2	32	40
C/C=C/C[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912492	EF	On-Demand	Anodyne	KLK3	40	30
C/C=C/C[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912492	EF	On-Demand	Anodyne	CAPN2	70	33
C/C=C/C[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912492	EF	On-Demand	Anodyne	ACE2	32	40
C/C=C\C[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912493	EF	On-Demand	Anodyne	KLK3	40	30
C/C=C\C[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912493	EF	On-Demand	Anodyne	CAPN2	70	33
C/C=C\C[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912493	EF	On-Demand	Anodyne	ACE2	32	40
COc1ccc2c(c1)c(=O)ncn2Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000450912502	FI	On-Demand	Anodyne	CASR	22	42
COc1ccc2c(c1)c(=O)ncn2Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000450912503	FI	On-Demand	Anodyne	CASR	22	42
CC(C)OCCOC1CCN(c2nc3cc(C(F)(F)F)ccc3s2)CC1	ZINC000450912528	GJ	On-Demand	Anodyne	LIPG	53	39
COc1cccc(C2(F)CCN(CC3CC(F)(F)C3)CC2)c1	ZINC000450912531	DI	On-Demand	Anodyne	SIGMAR1	0	42
COc1cccc(C2(F)CCN(CC3CC(F)(F)C3)CC2)c1	ZINC000450912531	DI	On-Demand	Anodyne	TACR3	0	41
COc1ccc(OCc2oc(C(C)C)nc2C)c(Br)c1	ZINC000450912535	EI	On-Demand	Anodyne	P2RX2	53	41
CCCCN(C)C(=O)CSCCC(C)(F)F	ZINC000450912542	CG	On-Demand	Anodyne	CES2	23	40
CCCCN(C)C(=O)CSCCC(C)(F)F	ZINC000450912542	CG	On-Demand	Anodyne	CES1	33	44
CCCCN(C)C(=O)CSCCC(C)(F)F	ZINC000450912542	CG	On-Demand	Anodyne	JHE	0	40
CCCCN(C)C(=O)CSCCC(C)(F)F	ZINC000450912542	CG	On-Demand	Anodyne	Q9GPG0_MANSE	0	40
CCCCN(C)C(=O)CSCCC(C)(F)F	ZINC000450912542	CG	On-Demand	Anodyne	EST5_RAT	0	40
COc1ccc2nc(N3CCC(OCCOC(C)C)CC3)c(C)nc2c1	ZINC000450912562	FG	On-Demand	Anodyne	PDE3B	41	35
Cc1cccc2c(N3CCC(OCCOC(C)C)CC3)ncnc12	ZINC000450912577	EG	On-Demand	Anodyne	PDE3B	65	36
COc1cc(N2CCC(OCCOC(C)C)CC2)ncn1	ZINC000450912581	CD	On-Demand	Anodyne	PDE3B	46	32
CC(C)OCCOC1CCN(c2cc(C#N)ccn2)CC1	ZINC000450912588	CE	On-Demand	Mild	MAP3K12	44	31
Cc1ccn2ncc(C(=O)N[C@H]3CCCC[C@@H]3NS(C)(=O)=O)c2c1	ZINC000450912605	FD	On-Demand	Anodyne	EPHB3	37	50
Cc1ccn2ncc(C(=O)N[C@@H]3CCCC[C@@H]3NS(C)(=O)=O)c2c1	ZINC000450912606	FD	On-Demand	Anodyne	EPHB3	37	50
Cc1ccn2ncc(C(=O)N[C@H]3CCCC[C@H]3NS(C)(=O)=O)c2c1	ZINC000450912607	FD	On-Demand	Anodyne	EPHB3	37	50
Cc1ccn2ncc(C(=O)N[C@@H]3CCCC[C@H]3NS(C)(=O)=O)c2c1	ZINC000450912608	FD	On-Demand	Anodyne	EPHB3	37	50
CCS(=O)(=O)NCCCN(C)c1cccc2cccnc12	ZINC000450912631	DE	On-Demand	Anodyne	C0L093_TOBAC	53	32
Cc1nn(C)cc1CSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450912639	DH	On-Demand	Mild	AR	43	54
CCC(=O)CCCN1CCC[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]21	ZINC000450912640	EE	On-Demand	Anodyne	SLC6A1	48	32
CCC(=O)CCCN1CCC[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]21	ZINC000450912640	EE	On-Demand	Anodyne	BLA	41	33
Oc1nnc([C@H]2CCCN(CCCOc3cccc4ccccc34)C2)o1	ZINC000450912641	FH	On-Demand	Anodyne	NPY1R	41	34
Oc1nnc([C@@H]2CCCN(CCCOc3cccc4ccccc34)C2)o1	ZINC000450912642	FH	On-Demand	Anodyne	NPY1R	41	34
CC(C)CCNS(=O)(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450912657	EF	On-Demand	Anodyne	MMP13	23	48
CC(C)CCNS(=O)(=O)c1ccc(OCCC[C@H](C)O)cc1	ZINC000450912657	EF	On-Demand	Anodyne	ADAMTS4	41	34
CC(C)CCNS(=O)(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450912658	EF	On-Demand	Anodyne	MMP13	23	48
CC(C)CCNS(=O)(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450912658	EF	On-Demand	Anodyne	ADAMTS4	41	34
Cc1cccc(Cl)c1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450912673	GG	On-Demand	Anodyne	CDK1	21	43
Cc1cccc(Cl)c1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000450912673	GG	On-Demand	Anodyne	CDK4	22	43
CCOC(=O)[C@@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912696	FD	On-Demand	Anodyne	FKBP1A	76	44
CCOC(=O)[C@@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912696	FD	On-Demand	Anodyne	COLA	64	38
CCOC(=O)[C@@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912696	FD	On-Demand	Anodyne	CPT1A	60	38
CCOC(=O)[C@@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912696	FD	On-Demand	Anodyne	CPT2	45	38
CCOC(=O)[C@@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912696	FD	On-Demand	Anodyne	UTS2R	20	46
CCOC(=O)[C@@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912696	FD	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912697	FD	On-Demand	Anodyne	FKBP1A	76	44
CCOC(=O)[C@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912697	FD	On-Demand	Anodyne	COLA	64	38
CCOC(=O)[C@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912697	FD	On-Demand	Anodyne	CPT1A	60	38
CCOC(=O)[C@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912697	FD	On-Demand	Anodyne	CPT2	45	38
CCOC(=O)[C@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912697	FD	On-Demand	Anodyne	UTS2R	20	46
CCOC(=O)[C@H]1CCCCN1C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450912697	FD	On-Demand	Anodyne	FKBP12.6	0	40
COc1ccc2ncc(=O)n(CC(=O)NCCCN3CCCCCC3=O)c2c1	ZINC000450912703	GD	On-Demand	Anodyne	DRD4	40	31
COc1ccc2ncc(=O)n(CC(=O)NCCCN3CCCCCC3=O)c2c1	ZINC000450912703	GD	On-Demand	Anodyne	AVPR1B	56	43
COc1ccc2ncc(=O)n(CC(=O)NCCCN3CCCCCC3=O)c2c1	ZINC000450912703	GD	On-Demand	Anodyne	NQO2	16	47
COc1ccc2ncc(=O)n(CC(=O)NCCCN3CCCCCC3=O)c2c1	ZINC000450912703	GD	On-Demand	Anodyne	TYRO3	24	45
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3CCCO3)c2c1	ZINC000450912705	DC	On-Demand	Anodyne	AVPR1B	43	38
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3CCCO3)c2c1	ZINC000450912706	DC	On-Demand	Anodyne	AVPR1B	43	38
COc1nccc(CSc2n[nH]c(O)n2)n1	ZINC000450912710	BC	On-Demand	Anodyne	METAP2	0	42
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3CCN(c4ccccc4)C3)c2c1	ZINC000450912735	GE	On-Demand	Anodyne	AVPR1B	58	44
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3CCN(c4ccccc4)C3)c2c1	ZINC000450912736	GE	On-Demand	Anodyne	AVPR1B	58	44
CC(=O)c1ccc(CN2CCN(c3nccnc3C)CC2)cc1	ZINC000450912738	DE	On-Demand	Anodyne	ABCB1	15	40
COc1ccc2ncc(=O)n(Cc3ccccc3OC(C)C)c2c1	ZINC000450912745	DG	On-Demand	Anodyne	NPBWR1	43	40
CS(=O)(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)cc1	ZINC000450912760	EH	On-Demand	Anodyne	PTGS2	50	41
CS(=O)(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)cc1	ZINC000450912760	EH	On-Demand	Anodyne	GPR119	18	41
CS(=O)(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)cc1	ZINC000450912761	EH	On-Demand	Anodyne	PTGS2	50	41
CS(=O)(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)cc1	ZINC000450912761	EH	On-Demand	Anodyne	GPR119	18	41
CC[C@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912762	CE	On-Demand	Anodyne	NQO2	44	48
CC[C@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912762	CE	On-Demand	Anodyne	MTR1B_CHICK	0	64
CC[C@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912762	CE	On-Demand	Anodyne	HTR6	41	47
CC[C@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912762	CE	On-Demand	Anodyne	PPARD	44	41
CC[C@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912762	CE	On-Demand	Anodyne	MTNR1B	44	38
CC[C@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912763	CE	On-Demand	Anodyne	NQO2	44	48
CC[C@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912763	CE	On-Demand	Anodyne	MTR1B_CHICK	0	64
CC[C@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912763	CE	On-Demand	Anodyne	HTR6	41	47
CC[C@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912763	CE	On-Demand	Anodyne	PPARD	44	41
CC[C@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912763	CE	On-Demand	Anodyne	MTNR1B	44	38
CC[C@@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912764	CE	On-Demand	Anodyne	NQO2	44	48
CC[C@@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912764	CE	On-Demand	Anodyne	MTR1B_CHICK	0	64
CC[C@@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912764	CE	On-Demand	Anodyne	HTR6	41	47
CC[C@@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912764	CE	On-Demand	Anodyne	PPARD	44	41
CC[C@@H](O)CC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000450912764	CE	On-Demand	Anodyne	MTNR1B	44	38
CC[C@@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912765	CE	On-Demand	Anodyne	NQO2	44	48
CC[C@@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912765	CE	On-Demand	Anodyne	MTR1B_CHICK	0	64
CC[C@@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912765	CE	On-Demand	Anodyne	HTR6	41	47
CC[C@@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912765	CE	On-Demand	Anodyne	PPARD	44	41
CC[C@@H](O)CC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000450912765	CE	On-Demand	Anodyne	MTNR1B	44	38
Fc1ccc([C@@H]2CCCN2c2cc(N3CCSCC3)ncn2)c(F)c1	ZINC000450912769	FH	On-Demand	Anodyne	PRCP	42	42
Fc1ccc([C@H]2CCCN2c2cc(N3CCSCC3)ncn2)c(F)c1	ZINC000450912770	FH	On-Demand	Anodyne	PRCP	42	42
CCOC(=O)c1ccnc(N2CCC[C@H]2c2ccc(F)cc2F)c1[N+](=O)[O-]	ZINC000450912771	GH	On-Demand	Bother	CACNA1C	23	42
CCOC(=O)c1ccnc(N2CCC[C@H]2c2ccc(F)cc2F)c1[N+](=O)[O-]	ZINC000450912771	GH	On-Demand	Bother	CACNA1D	34	42
CCOC(=O)c1ccnc(N2CCC[C@@H]2c2ccc(F)cc2F)c1[N+](=O)[O-]	ZINC000450912772	GH	On-Demand	Bother	CACNA1C	23	42
CCOC(=O)c1ccnc(N2CCC[C@@H]2c2ccc(F)cc2F)c1[N+](=O)[O-]	ZINC000450912772	GH	On-Demand	Bother	CACNA1D	34	42
COc1ccc2ncc(=O)n(Cc3noc(C4CCCCC4)n3)c2c1	ZINC000450912777	EF	On-Demand	Anodyne	ETHR	16	40
COc1ccc2ncc(=O)n(CC(=O)NCCO[C@@H]3CCCC[C@@H]3C)c2c1	ZINC000450912780	FE	On-Demand	Anodyne	AVPR1B	40	37
COc1ccc2ncc(=O)n(CC(=O)NCCO[C@H]3CCCC[C@H]3C)c2c1	ZINC000450912781	FE	On-Demand	Anodyne	AVPR1B	40	37
COc1ccc2ncc(=O)n(CC(=O)NCCO[C@H]3CCCC[C@@H]3C)c2c1	ZINC000450912782	FE	On-Demand	Anodyne	AVPR1B	40	37
COc1ccc2ncc(=O)n(CC(=O)NCCO[C@@H]3CCCC[C@H]3C)c2c1	ZINC000450912783	FE	On-Demand	Anodyne	AVPR1B	40	37
CCOC(=O)[C@@H]1CCCN(C(=O)Cn2c(=O)cnc3ccc(OC)cc32)C1	ZINC000450912786	FD	On-Demand	Anodyne	FDFT1	32	41
CCOC(=O)[C@@H]1CCCN(C(=O)Cn2c(=O)cnc3ccc(OC)cc32)C1	ZINC000450912786	FD	On-Demand	Anodyne	UTS2R	18	41
CCOC(=O)[C@H]1CCCN(C(=O)Cn2c(=O)cnc3ccc(OC)cc32)C1	ZINC000450912787	FD	On-Demand	Anodyne	FDFT1	32	41
CCOC(=O)[C@H]1CCCN(C(=O)Cn2c(=O)cnc3ccc(OC)cc32)C1	ZINC000450912787	FD	On-Demand	Anodyne	UTS2R	18	41
C=C(CC)CNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450912792	CF	On-Demand	Mild	DHOD	0	56
CC(C)(CNc1ccc([N+](=O)[O-])cc1)C1(O)CCCC1	ZINC000450912796	CG	On-Demand	Bother	NMBR	57	35
COC(=O)c1coc(CSCc2ccc(OC)c(Cl)c2)n1	ZINC000450912797	EH	On-Demand	Anodyne	PDE6A	42	32
CC(=O)c1ccc(NCC(C)(C)C2(O)CCCC2)c([N+](=O)[O-])c1	ZINC000450912800	DH	On-Demand	Bother	TAAR1	16	40
CCOC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2cccc(F)c2)nc1	ZINC000450912803	EF	On-Demand	Anodyne	CCR5	48	32
CCOC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2cccc(F)c2)nc1	ZINC000450912805	EF	On-Demand	Anodyne	CCR5	48	32
CCOC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2cccc(F)c2)nc1	ZINC000450912806	EF	On-Demand	Anodyne	CCR5	48	32
CCOC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2cccc(F)c2)nc1	ZINC000450912807	EF	On-Demand	Anodyne	CCR5	48	32
COc1cc(-c2noc(CSCc3ccc(OC)c(Cl)c3)n2)ncn1	ZINC000450912809	GH	On-Demand	Anodyne	PDE6A	41	31
COCc1cc(NCc2cnc(C)cc2C)n2ncnc2n1	ZINC000450912810	CD	On-Demand	Anodyne	DHOD	0	41
COc1cc(-c2noc(CSc3c(OC)cccc3OC)n2)ncn1	ZINC000450912813	FF	On-Demand	Anodyne	TNKS2	15	40
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc4c(c3)OCO4)CC2)o1	ZINC000450912814	FD	On-Demand	Anodyne	ACOX1	76	34
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc4c(c3)OCO4)CC2)o1	ZINC000450912814	FD	On-Demand	Anodyne	SSTR3	87	32
Oc1nnc(C2CCN(C[C@H](O)COc3ccc4c(c3)OCO4)CC2)o1	ZINC000450912816	FD	On-Demand	Anodyne	ACOX1	76	34
Oc1nnc(C2CCN(C[C@H](O)COc3ccc4c(c3)OCO4)CC2)o1	ZINC000450912816	FD	On-Demand	Anodyne	SSTR3	87	32
N#Cc1ccc(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)cc1F	ZINC000450912823	FD	On-Demand	Mild	NPY2R	44	42
CC(C)(CNc1ccc(S(=O)(=O)NCC2CC2)cn1)C1(O)CCCC1	ZINC000450912828	FF	On-Demand	Anodyne	NPY2R	47	36
C/C=C\C[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912840	EF	On-Demand	Anodyne	KLK3	40	30
C/C=C\C[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912840	EF	On-Demand	Anodyne	CAPN2	70	33
C/C=C\C[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)C(=O)OCC	ZINC000450912840	EF	On-Demand	Anodyne	ACE2	32	40
O=c1c2c(ncn1CCc1ccc(Cl)cc1)CCCC2	ZINC000450912866	CG	On-Demand	Anodyne	GABRA1	15	40
O=c1c2c(ncn1CCc1ccc(Cl)cc1)CCCC2	ZINC000450912866	CG	On-Demand	Anodyne	GABRA2	18	44
N#Cc1ccc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)cc1F	ZINC000450912869	FF	On-Demand	Mild	MAP3K8	53	38
N#Cc1ccc(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)cc1F	ZINC000450912869	FF	On-Demand	Mild	STAT6	49	34
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450912890	GG	On-Demand	Anodyne	HRH2	15	43
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450912890	GG	On-Demand	Anodyne	EPHX2	27	51
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450912890	GG	On-Demand	Anodyne	CACNA1I	32	41
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450912890	GG	On-Demand	Anodyne	PRMT3	33	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450912895	GG	On-Demand	Anodyne	HRH2	15	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450912895	GG	On-Demand	Anodyne	EPHX2	27	51
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450912895	GG	On-Demand	Anodyne	CACNA1I	32	41
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450912895	GG	On-Demand	Anodyne	PRMT3	33	43
Cc1ccc(OCCCN2CCC(c3nnc(O)o3)CC2)cc1C	ZINC000450912900	EG	On-Demand	Anodyne	KCNH2	0	40
Cc1ccc(OCCCN2CCC(c3nnc(O)o3)CC2)cc1C	ZINC000450912900	EG	On-Demand	Anodyne	CARM1	44	31
Cc1ccc(OCCCN2CCC(c3nnc(O)o3)CC2)cc1C	ZINC000450912900	EG	On-Demand	Anodyne	MEN1	49	34
C[C@@H](C(=O)C1CCOCC1)S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450912912	FF	On-Demand	Anodyne	CACNA1B	47	43
C[C@H](C(=O)C1CCOCC1)S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450912919	FF	On-Demand	Anodyne	CACNA1B	47	43
CC(C)(CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)C1(O)CCCC1	ZINC000450912923	GF	On-Demand	Anodyne	TGM2	22	42
CC(C)(CNc1ccc(S(=O)(=O)N2CCCCC2)cn1)C1(O)CCCC1	ZINC000450912923	GF	On-Demand	Anodyne	GCK	47	32
CC(C)NC(=O)CCN1CCC(c2nnc(O)o2)CC1	ZINC000450912928	CC	On-Demand	Anodyne	PRCP	24	46
C[C@@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccc(F)cc1	ZINC000450912931	ED	On-Demand	Anodyne	PRCP	26	41
C[C@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccc(F)cc1	ZINC000450912935	ED	On-Demand	Anodyne	PRCP	26	41
Oc1nnc(C2CCN(CCOc3cccc(Br)c3)CC2)o1	ZINC000450912943	FF	On-Demand	Anodyne	ESR1	41	35
COc1ccc(CNC(=O)CCN2CCC=C(C)C2)c(OC)c1	ZINC000450912947	DE	On-Demand	Anodyne	DRD4	40	32
COc1ccc(CNC(=O)CCN2CCC=C(C)C2)c(OC)c1	ZINC000450912947	DE	On-Demand	Anodyne	HTR7	28	41
COc1ccc(CNC(=O)CCN2CCC=C(C)C2)c(OC)c1	ZINC000450912947	DE	On-Demand	Anodyne	CHRNA6	0	40
COC(=O)[C@H](C)N(C)CC/C=C/c1ccccc1	ZINC000450912999	BF	On-Demand	Anodyne	CACNA1B	51	38
COC(=O)[C@@H](C)N(C)CC/C=C\c1ccccc1	ZINC000450913001	BF	On-Demand	Anodyne	CACNA1B	51	38
COC(=O)[C@@H](C)N(C)CC/C=C/c1ccccc1	ZINC000450913003	BF	On-Demand	Anodyne	CACNA1B	51	38
COC(=O)[C@H](C)N(C)CC/C=C\c1ccccc1	ZINC000450913005	BF	On-Demand	Anodyne	CACNA1B	51	38
COC(=O)c1csc(CSc2c(OC)cccc2OC)n1	ZINC000450913026	EG	On-Demand	Anodyne	ALS	63	37
CC(=O)CCCCCn1cnc2cc(C)c(C)cc21	ZINC000450913047	CH	On-Demand	Anodyne	NR1I2	15	40
CSc1nc(=O)n(CCCCc2ccc(Cl)c(Cl)c2)[nH]1	ZINC000450913056	EH	On-Demand	Anodyne	DNAE	76	36
Oc1nnc(C2CCN(CCSc3ccc(F)cc3)CC2)o1	ZINC000450913061	DF	On-Demand	Anodyne	CCR3	17	43
CN(CCN(CCc1ccccn1)Cc1cccnc1)Cc1ccccc1	ZINC000450913077	FH	On-Demand	Anodyne	NR1D1	45	36
Oc1nnc(C2CCN(CCOc3ccc4ccccc4c3)CC2)o1	ZINC000450913081	EG	On-Demand	Anodyne	ESR1	68	35
Oc1nnc(C2CCN(CCOc3ccc4ccccc4c3)CC2)o1	ZINC000450913081	EG	On-Demand	Anodyne	LTA4H	56	42
Oc1nnc(C2CCN(CCOc3ccc4ccccc4c3)CC2)o1	ZINC000450913081	EG	On-Demand	Anodyne	PSMB2	46	33
Oc1nnc(C2CCN(CCOc3ccc4ccccc4c3)CC2)o1	ZINC000450913081	EG	On-Demand	Anodyne	PSMB1	40	36
Oc1nnc(C2CCN(CCOc3ccc4ccccc4c3)CC2)o1	ZINC000450913081	EG	On-Demand	Anodyne	MEN1	42	31
CC(C)(CNc1ccc(S(=O)(=O)N2CCCC2)cn1)C1(O)CCCC1	ZINC000450913082	FF	On-Demand	Anodyne	TGM2	26	42
CC(C)(CNc1ccc(S(=O)(=O)N2CCCC2)cn1)C1(O)CCCC1	ZINC000450913082	FF	On-Demand	Anodyne	GCK	47	32
Oc1nnc(C2CCN(CCOc3ccccc3C(F)(F)F)CC2)o1	ZINC000450913089	FG	On-Demand	Anodyne	RBP4	42	36
COc1cc(CN(C)CCCN2CCCC2)ccc1Cl	ZINC000450913101	CG	On-Demand	Anodyne	OPRK1	26	45
COc1cc(CN(C)CCCN2CCCC2)ccc1Cl	ZINC000450913101	CG	On-Demand	Anodyne	CACNA1C	23	43
COc1cc(CN(C)CCCN2CCCC2)ccc1Cl	ZINC000450913101	CG	On-Demand	Anodyne	SIGMAR1	0	42
COc1cc(CN(C)CCCN2CCCC2)ccc1Cl	ZINC000450913101	CG	On-Demand	Anodyne	F2R	0	40
COc1cc(CN(C)CCCN2CCCC2)ccc1Cl	ZINC000450913101	CG	On-Demand	Anodyne	HCN2	0	41
CC(C)OCCOC1CCN(c2ccnc(C(C)C)n2)CC1	ZINC000450913102	DG	On-Demand	Anodyne	SORD	67	38
CC(C)OCCOC1CCN(c2ncnc3sc4c(c23)CCC4)CC1	ZINC000450913103	FH	On-Demand	Anodyne	RBP4	18	44
CC(C)(COCc1ccccc1)NCc1cn(CC2CC2)nn1	ZINC000450913111	DF	On-Demand	Anodyne	GBA	15	40
O=C(NCc1ccc(C(F)F)cc1)[C@H](O)C1CCC1	ZINC000450913129	CE	On-Demand	Anodyne	PROC	48	35
O=C(NCc1ccc(C(F)F)cc1)[C@@H](O)C1CCC1	ZINC000450913130	CE	On-Demand	Anodyne	PROC	48	35
COc1ccc2c(N3CCC(OCCOC(C)C)CC3)ncnc2c1F	ZINC000450913135	FG	On-Demand	Anodyne	PDE3A	51	39
COc1ccc2c(N3CCC(OCCOC(C)C)CC3)ncnc2c1F	ZINC000450913135	FG	On-Demand	Anodyne	PDE3B	75	39
CC(C)OCCOC1CCN(c2ncnc3cccc(F)c23)CC1	ZINC000450913168	EG	On-Demand	Anodyne	PDE3B	61	35
CC(C)OCCOC1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450913177	FG	On-Demand	Anodyne	PDE3A	53	41
CC(C)OCCOC1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450913177	FG	On-Demand	Anodyne	PDGFRB	40	39
CC(C)OCCOC1CCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450913177	FG	On-Demand	Anodyne	PDE3B	79	41
Nc1nc(NC2(Cc3ccccc3)CCOCC2)ncc1[N+](=O)[O-]	ZINC000450913198	EE	On-Demand	Bother	PRKCQ	40	39
CC(=O)c1cccc(CN2CCC[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]32)c1	ZINC000450913208	GG	On-Demand	Anodyne	SIGMAR1	23	41
Oc1nnc([C@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913212	EG	On-Demand	Anodyne	ESR1	68	37
Oc1nnc([C@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913212	EG	On-Demand	Anodyne	ESR2	47	36
Oc1nnc([C@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913212	EG	On-Demand	Anodyne	LTA4H	50	38
Oc1nnc([C@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913212	EG	On-Demand	Anodyne	PSMB2	47	35
Oc1nnc([C@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913212	EG	On-Demand	Anodyne	PSMB1	41	37
Oc1nnc([C@@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913213	EG	On-Demand	Anodyne	ESR1	68	37
Oc1nnc([C@@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913213	EG	On-Demand	Anodyne	ESR2	47	36
Oc1nnc([C@@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913213	EG	On-Demand	Anodyne	LTA4H	50	38
Oc1nnc([C@@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913213	EG	On-Demand	Anodyne	PSMB2	47	35
Oc1nnc([C@@H]2CCCN(CCOc3ccc4ccccc4c3)C2)o1	ZINC000450913213	EG	On-Demand	Anodyne	PSMB1	41	37
CC(=O)CCCCCn1c(C)nn(C(C)(C)C)c1=O	ZINC000450913223	CE	On-Demand	Anodyne	PAOX	42	38
Cc1ccc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c(C(C)C)n1	ZINC000450913239	FF	On-Demand	Anodyne	STAT6	57	35
COc1cc(Cn2cnn(C(C)(C)C)c2=O)ccc1Cl	ZINC000450913243	CF	On-Demand	Anodyne	NPBWR1	63	40
COc1cc(CNC(=O)CN(C)c2cccc3cccnc23)cc(OC)c1OC	ZINC000450913259	GG	On-Demand	Anodyne	PTK2	44	36
COc1ccc(CNC(=O)CCn2cnc3cc(OC)ccc3c2=O)c(OC)c1	ZINC000450913292	GE	On-Demand	Anodyne	PDGFRB	56	51
COc1ccc(CNC(=O)CCn2cnc3cc(OC)ccc3c2=O)c(OC)c1	ZINC000450913292	GE	On-Demand	Anodyne	KDR	17	45
COc1ccc(CNC(=O)CCn2cnc3cc(OC)ccc3c2=O)c(OC)c1	ZINC000450913292	GE	On-Demand	Anodyne	PDGFRA	31	50
COc1ccc(CNC(=O)CCn2cnc3cc(OC)ccc3c2=O)c(OC)c1	ZINC000450913292	GE	On-Demand	Anodyne	CSF1R	24	51
CN(CC(=O)NCCCN1CCCC1=O)c1cccc2cccnc12	ZINC000450913294	ED	On-Demand	Anodyne	TYRO3	25	40
CS(=O)(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nc1	ZINC000450913297	EG	On-Demand	Anodyne	GPR119	15	45
CS(=O)(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nc1	ZINC000450913298	EG	On-Demand	Anodyne	GPR119	15	45
CCN(Cc1ccccc1)C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450913302	FE	On-Demand	Anodyne	TSPO	50	51
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450913318	GD	On-Demand	Anodyne	OXTR	29	48
CN1CCO[C@H](CN(CC2CC2)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450913318	GD	On-Demand	Anodyne	AVPR1A	0	45
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450913320	GD	On-Demand	Anodyne	OXTR	29	48
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)C1	ZINC000450913320	GD	On-Demand	Anodyne	AVPR1A	0	45
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)Cc2sccc2Br)C1	ZINC000450913351	GH	On-Demand	Anodyne	RHODESAIN	0	43
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)Cc2sccc2Br)C1	ZINC000450913352	GH	On-Demand	Anodyne	RHODESAIN	0	43
COC(=O)[C@H](CC(C)C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450913357	FD	On-Demand	Anodyne	AVPR1B	55	41
COC(=O)[C@H](CC(C)C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450913357	FD	On-Demand	Anodyne	FOLH1	50	39
COC(=O)[C@@H](CC(C)C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450913358	FD	On-Demand	Anodyne	AVPR1B	55	41
COC(=O)[C@@H](CC(C)C)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450913358	FD	On-Demand	Anodyne	FOLH1	50	39
CC(C)(CC(=O)Cn1nnc(COc2ccccc2)n1)C1CC1	ZINC000450913368	DF	On-Demand	Anodyne	COLA	70	36
CC(C)(CC(=O)Cn1nnc(COc2ccccc2)n1)C1CC1	ZINC000450913368	DF	On-Demand	Anodyne	CPT1A	64	35
Cc1nc(SC[C@H](O)CC#N)[nH]c1-c1ccccc1	ZINC000450913379	CF	On-Demand	Mild	SOAT1	27	45
CCN(CC)S(=O)(=O)c1ccc(NCc2cnc(C)cc2C)c([N+](=O)[O-])c1	ZINC000450913381	GG	On-Demand	Bother	BDKRB1	22	43
COCCOC[C@@H](O)CN1CCC(C)(c2ccc(Br)cc2)CC1	ZINC000450913387	GF	On-Demand	Anodyne	SLC18A3	30	40
COCCOC[C@@H](O)CN1CCC(C)(c2ccc(Br)cc2)CC1	ZINC000450913387	GF	On-Demand	Anodyne	ABCB1	26	40
COCCOC[C@@H](O)CN1CCC(C)(c2ccc(Br)cc2)CC1	ZINC000450913387	GF	On-Demand	Anodyne	HSP90AB1	42	49
COCCOC[C@H](O)CN1CCC(C)(c2ccc(Br)cc2)CC1	ZINC000450913389	GF	On-Demand	Anodyne	SLC18A3	30	40
COCCOC[C@H](O)CN1CCC(C)(c2ccc(Br)cc2)CC1	ZINC000450913389	GF	On-Demand	Anodyne	ABCB1	26	40
COCCOC[C@H](O)CN1CCC(C)(c2ccc(Br)cc2)CC1	ZINC000450913389	GF	On-Demand	Anodyne	HSP90AB1	42	49
COc1ccc2ncc(=O)n(CCCOC(C)C)c2c1	ZINC000450913391	CE	On-Demand	Anodyne	GSG2	42	38
C[C@H](O)CCSc1nc2cncnc2[nH]1	ZINC000450913398	BD	On-Demand	Anodyne	ENPP1	23	45
C[C@@H](O)CCSc1nc2cncnc2[nH]1	ZINC000450913399	BD	On-Demand	Anodyne	ENPP1	23	45
COc1ccc2ncc(=O)n(CC(=O)NCCCOc3ccccc3F)c2c1	ZINC000450913402	GE	On-Demand	Anodyne	AVPR1B	43	38
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450913413	FG	On-Demand	Anodyne	OXTR	27	44
CN1CCO[C@H](CN(CC2CC2)C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450913413	FG	On-Demand	Anodyne	AVPR1A	0	44
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450913416	FG	On-Demand	Anodyne	OXTR	27	44
CN1CCO[C@@H](CN(CC2CC2)C(=O)c2cc(Cl)c3ccccc3n2)C1	ZINC000450913416	FG	On-Demand	Anodyne	AVPR1A	0	44
CCC(=O)c1ccc(NCc2cnc(C)cc2C)c(S(N)(=O)=O)c1	ZINC000450913422	EF	On-Demand	Anodyne	CA7	22	40
CCC(=O)c1ccc(NCc2cnc(C)cc2C)c(S(N)(=O)=O)c1	ZINC000450913422	EF	On-Demand	Anodyne	CA13	37	40
CCc1ccc([C@H](C)NC(=O)Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450913425	FF	On-Demand	Anodyne	ACACA	55	39
CCc1ccc([C@@H](C)NC(=O)Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450913427	FF	On-Demand	Anodyne	ACACA	55	39
O=C(CCCN(CCc1ccccn1)Cc1cccnc1)c1ccc(F)cc1	ZINC000450913429	GI	On-Demand	Anodyne	PTAFR	15	40
O=C(CCCN(CCc1ccccn1)Cc1cccnc1)c1ccc(F)cc1	ZINC000450913429	GI	On-Demand	Anodyne	FAAH	39	40
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3CN(CC(C)C)CCO3)c2c1	ZINC000450913430	GC	On-Demand	Anodyne	AVPR1B	55	41
CCCc1cc(NCC(C)(C)C2(O)CCCC2)n2ncnc2n1	ZINC000450913432	DF	On-Demand	Anodyne	DHOD	0	42
COC(=O)c1ccc(OC[C@H](Cc2ccccc2)OC)cc1OC	ZINC000450913434	EG	On-Demand	Anodyne	PDS	85	40
COC(=O)c1ccc(OC[C@H](Cc2ccccc2)OC)cc1OC	ZINC000450913434	EG	On-Demand	Anodyne	GPR88	0	41
COC(=O)c1ccc(OC[C@@H](Cc2ccccc2)OC)cc1OC	ZINC000450913439	EG	On-Demand	Anodyne	PDS	85	40
COC(=O)c1ccc(OC[C@@H](Cc2ccccc2)OC)cc1OC	ZINC000450913439	EG	On-Demand	Anodyne	GPR88	0	41
CN1CCO[C@@H](CN(CC2CC2)C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450913440	FE	On-Demand	Anodyne	OXTR	22	41
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3CN(CC(C)C)CCO3)c2c1	ZINC000450913442	GC	On-Demand	Anodyne	AVPR1B	55	41
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450913443	FE	On-Demand	Anodyne	OXTR	22	41
CN1CCO[C@H](CN(CC2CC2)C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450913447	FE	On-Demand	Anodyne	OXTR	22	41
CN1CCO[C@@H](CN(CC2CC2)C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450913449	FE	On-Demand	Anodyne	OXTR	22	41
Cn1[nH]c([C@@H]2CCCN2CC(=O)NCCOc2ccc(F)cc2)nc1=N	ZINC000450913461	FC	On-Demand	Anodyne	HRH3	23	41
COC(=O)c1ccc(C(F)(F)F)nc1SCn1cccn1	ZINC000450913469	DF	On-Demand	Anodyne	SHH	23	42
Cn1[nH]c([C@H]2CCCN2CC(=O)NCCOc2ccc(F)cc2)nc1=N	ZINC000450913493	FC	On-Demand	Anodyne	HRH3	23	41
Cc1cc(N2CCC[C@H]2c2ccc(F)cc2C)n2ncnc2n1	ZINC000450913494	DG	On-Demand	Anodyne	DHOD	0	51
Cc1cc(N2CCC[C@@H]2c2ccc(F)cc2C)n2ncnc2n1	ZINC000450913495	DG	On-Demand	Anodyne	DHOD	0	51
CCC(=O)CCCN1CCN(c2nccnc2C)CC1	ZINC000450913498	CD	On-Demand	Anodyne	DRD2	23	40
CCC(=O)CCCN1CCN(c2nccnc2C)CC1	ZINC000450913498	CD	On-Demand	Anodyne	HTR2A	24	42
Cc1cc(C)c(CNc2cc(N3CCCC3)ncn2)cn1	ZINC000450913501	CF	On-Demand	Anodyne	HRH4	15	49
O=C(NC1CC1)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)c([N+](=O)[O-])c1	ZINC000450913526	GI	On-Demand	Bother	TAAR1	18	41
CCc1ccc([C@@H](C)NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450913534	FE	On-Demand	Anodyne	PRCP	21	41
CCc1ccc([C@H](C)NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450913537	FE	On-Demand	Anodyne	PRCP	21	41
O=C(NC1CC1)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)c([N+](=O)[O-])c1	ZINC000450913542	GI	On-Demand	Bother	TAAR1	18	41
C=CCNC(=O)c1ccc(NCC(C)(C)C2(O)CCCC2)nc1	ZINC000450913557	DF	On-Demand	Mild	HCAR3	15	51
COC(=O)c1csc(Cn2cnc3cc(C)c(C)cc32)n1	ZINC000450913570	DF	On-Demand	Anodyne	NR1I2	42	34
CN1C(=O)CC[C@@H]1C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450913579	FE	On-Demand	Anodyne	LTA4H	31	42
CCn1c(S[C@H]2C[C@H](C)CCC2=O)nc2ccc(F)cc2c1=O	ZINC000450913581	EG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	41
CN1C(=O)CC[C@H]1C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450913582	FE	On-Demand	Anodyne	LTA4H	31	42
COCCn1c(NC(=O)[C@@H](O)C2CCC2)nc2ccccc21	ZINC000450913584	DD	On-Demand	Anodyne	ITK	38	42
CCn1c(S[C@H]2C[C@@H](C)CCC2=O)nc2ccc(F)cc2c1=O	ZINC000450913586	EG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	41
COCCn1c(NC(=O)[C@H](O)C2CCC2)nc2ccccc21	ZINC000450913588	DD	On-Demand	Anodyne	ITK	38	42
CCn1c(S[C@@H]2C[C@H](C)CCC2=O)nc2ccc(F)cc2c1=O	ZINC000450913589	EG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	41
CCn1c(S[C@@H]2C[C@@H](C)CCC2=O)nc2ccc(F)cc2c1=O	ZINC000450913592	EG	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	41
CC(C)(CNc1cc(C#N)ccn1)C1(O)CCCC1	ZINC000450913593	CF	On-Demand	Mild	MAP3K12	44	32
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccccc1F	ZINC000450913619	DD	On-Demand	Anodyne	DRD4	22	58
NC(=O)c1ncc(Br)cc1NC[C@@H]1CCC[C@H]1O	ZINC000450913623	DD	On-Demand	Anodyne	SYK	25	40
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913627	GH	On-Demand	Anodyne	SSTR2	45	32
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913627	GH	On-Demand	Anodyne	GHRHR	59	34
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913627	GH	On-Demand	Anodyne	TIMP3	84	38
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913627	GH	On-Demand	Anodyne	CAPN1	20	40
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913627	GH	On-Demand	Anodyne	CAPN2	42	36
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913627	GH	On-Demand	Anodyne	NPPA	49	35
CCC[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913627	GH	On-Demand	Anodyne	CTRB_BOVIN	46	39
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913628	GH	On-Demand	Anodyne	SSTR2	45	32
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913628	GH	On-Demand	Anodyne	GHRHR	59	34
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913628	GH	On-Demand	Anodyne	TIMP3	84	38
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913628	GH	On-Demand	Anodyne	CAPN1	20	40
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913628	GH	On-Demand	Anodyne	CAPN2	42	36
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913628	GH	On-Demand	Anodyne	NPPA	49	35
CCC[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OC(C)(C)C	ZINC000450913628	GH	On-Demand	Anodyne	CTRB_BOVIN	46	39
CCCn1c(C)nnc1SCc1nc(-c2cc(C)ccn2)no1	ZINC000450913631	EG	On-Demand	Anodyne	AXIN2	0	43
CC(C)C[C@H](C)S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450913660	CH	On-Demand	Anodyne	CACNA1B	49	38
CC(C)C[C@@H](C)S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450913662	CH	On-Demand	Anodyne	CACNA1B	49	38
Oc1nnc(C2CCN(CCOc3ccc(Br)cc3)CC2)o1	ZINC000450913683	FF	On-Demand	Anodyne	ESR1	60	35
Oc1nnc(C2CCN(CCOc3ccc(Br)cc3)CC2)o1	ZINC000450913683	FF	On-Demand	Anodyne	ESR2	46	38
Oc1nnc(C2CCN(CCOc3ccc(Br)cc3)CC2)o1	ZINC000450913683	FF	On-Demand	Anodyne	LTA4H	50	40
Oc1nnc(C2CCN(CCOc3ccc(Br)cc3)CC2)o1	ZINC000450913683	FF	On-Demand	Anodyne	HRH3	24	48
Oc1nnc(C2CCN(CCOc3ccc(Br)cc3)CC2)o1	ZINC000450913683	FF	On-Demand	Anodyne	PSMB2	49	37
Oc1nnc(C2CCN(CCOc3ccc(Br)cc3)CC2)o1	ZINC000450913683	FF	On-Demand	Anodyne	PSMB1	43	37
C/C=C\C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OCC	ZINC000450913689	FG	On-Demand	Anodyne	TIMP3	69	36
C/C=C\C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OCC	ZINC000450913689	FG	On-Demand	Anodyne	CAPN2	51	34
COC(=O)c1csc(CN2CCCC[C@@H]2c2ccnn2C)n1	ZINC000450913696	DE	On-Demand	Anodyne	COLA	19	41
COC(=O)c1csc(CN2CCCC[C@H]2c2ccnn2C)n1	ZINC000450913697	DE	On-Demand	Anodyne	COLA	19	41
CC(C)OCCOC1CCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450913699	FF	On-Demand	Bother	PDE3B	42	33
COC(=O)[C@@H](CC(F)(F)F)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450913729	FG	On-Demand	Anodyne	TIMP3	64	36
COC(=O)[C@H](CC(F)(F)F)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450913730	FG	On-Demand	Anodyne	TIMP3	64	36
CC(C)OCCOC1CCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450913731	EF	On-Demand	Anodyne	SORD	50	39
CC(C)OCCOC1CCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450913731	EF	On-Demand	Anodyne	EHMT2	43	33
COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450913736	GG	On-Demand	Anodyne	SLC6A3	15	47
COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](c2nnc(O)o2)C1	ZINC000450913737	GG	On-Demand	Anodyne	SLC6A3	15	47
COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450913738	GG	On-Demand	Anodyne	SLC6A3	15	47
COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450913739	GG	On-Demand	Anodyne	SLC6A3	15	47
COc1ccc(-c2ccnc(N3CCC(OCCOC(C)C)CC3)n2)cc1	ZINC000450913740	FH	On-Demand	Anodyne	DKK1	0	44
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450913764	GG	On-Demand	Anodyne	VDR	51	38
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450913766	GG	On-Demand	Anodyne	VDR	51	38
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC[C@H](c2nnc(O)o2)C1	ZINC000450913768	GG	On-Demand	Anodyne	VDR	51	38
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC[C@@H](c2nnc(O)o2)C1	ZINC000450913771	GG	On-Demand	Anodyne	VDR	51	38
N#Cc1ccc(SCC2(C#N)CCC2)cc1C(F)(F)F	ZINC000450913783	CI	On-Demand	Mild	AR	42	54
CCCCCSCC1CC(F)(F)C1	ZINC000450913787	BH	On-Demand	Anodyne	EST1_PIG	40	33
CC(=O)CCCCCn1cnc(-c2ccccn2)n1	ZINC000450913790	CE	On-Demand	Anodyne	TBXAS1	19	41
CC(=O)CCCCCn1cnc(-c2ccccn2)n1	ZINC000450913790	CE	On-Demand	Anodyne	FAAH	44	43
CCn1nnc(C)c1CSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000450913798	EH	On-Demand	Mild	AR	48	58
CC(C)CCCS[C@@H](C)C(=O)Nc1nccs1	ZINC000450913808	CH	On-Demand	Anodyne	MAP	0	49
CC(C)CCCS[C@@H](C)C(=O)Nc1nccs1	ZINC000450913808	CH	On-Demand	Anodyne	MAP1	135	49
CC(C)CCCS[C@H](C)C(=O)Nc1nccs1	ZINC000450913809	CH	On-Demand	Anodyne	MAP	0	49
CC(C)CCCS[C@H](C)C(=O)Nc1nccs1	ZINC000450913809	CH	On-Demand	Anodyne	MAP1	135	49
CN(CCN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)Cc1ccccc1	ZINC000450913812	DG	On-Demand	Anodyne	SIGMAR1	25	41
CN(CCN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)Cc1ccccc1	ZINC000450913814	DG	On-Demand	Anodyne	SIGMAR1	25	41
CN(CCN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)Cc1ccccc1	ZINC000450913815	DG	On-Demand	Anodyne	SIGMAR1	25	41
CN(CCN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)Cc1ccccc1	ZINC000450913816	DG	On-Demand	Anodyne	SIGMAR1	25	41
CC(=O)c1cc(N2CCC(OCCOC(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000450913817	FG	On-Demand	Bother	SERPINE1	27	41
CC(C)OCCOC1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1	ZINC000450913827	GI	On-Demand	Bother	AADAC	0	41
COCCOC[C@@H](O)CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450913828	EF	On-Demand	Anodyne	CCR1	48	35
COCCOC[C@@H](O)CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450913828	EF	On-Demand	Anodyne	CYP2D6	0	40
COCCOC[C@@H](O)CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450913828	EF	On-Demand	Anodyne	HSP90AB1	40	48
COCCOC[C@H](O)CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450913829	EF	On-Demand	Anodyne	CCR1	48	35
COCCOC[C@H](O)CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450913829	EF	On-Demand	Anodyne	CYP2D6	0	40
COCCOC[C@H](O)CN1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000450913829	EF	On-Demand	Anodyne	HSP90AB1	40	48
N#Cc1ccc(N2CCC(Cc3cccc(F)c3F)CC2)nc1	ZINC000450913832	DH	On-Demand	Mild	SMO	0	48
COc1ccc2c(=O)n(Cc3ccc([C@@H](C)C(F)(F)F)cc3)cnc2c1	ZINC000450913840	FI	On-Demand	Anodyne	SCD1	0	41
COc1ccc2c(=O)n(Cc3ccc([C@H](C)C(F)(F)F)cc3)cnc2c1	ZINC000450913842	FI	On-Demand	Anodyne	SCD1	0	41
CC(C)CCNS(=O)(=O)c1ccc(OCC2(C#N)CCC2)cc1	ZINC000450913845	EG	On-Demand	Mild	MMP13	17	41
CC(C)CCNS(=O)(=O)c1ccc(OCC2(C#N)CCC2)cc1	ZINC000450913845	EG	On-Demand	Mild	ADAM17	18	41
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)cn1	ZINC000450913848	FD	On-Demand	Anodyne	SSTR3	24	42
CC(F)(F)c1ccc(C(=O)N[C@H]2CCCC[C@H]2NS(C)(=O)=O)cn1	ZINC000450913849	FD	On-Demand	Anodyne	SSTR3	24	42
CC(F)(F)c1ccc(C(=O)N[C@H]2CCCC[C@@H]2NS(C)(=O)=O)cn1	ZINC000450913850	FD	On-Demand	Anodyne	SSTR3	24	42
CC(F)(F)c1ccc(C(=O)N[C@@H]2CCCC[C@H]2NS(C)(=O)=O)cn1	ZINC000450913851	FD	On-Demand	Anodyne	SSTR3	24	42
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450913855	GF	On-Demand	Anodyne	APOB	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450913855	GF	On-Demand	Anodyne	CACNA1B	48	34
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450913855	GF	On-Demand	Anodyne	MTTP	24	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450913855	GF	On-Demand	Anodyne	CCR2	36	44
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450913856	GF	On-Demand	Anodyne	APOB	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450913856	GF	On-Demand	Anodyne	CACNA1B	48	34
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450913856	GF	On-Demand	Anodyne	MTTP	24	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCC[C@@H]1NS(C)(=O)=O	ZINC000450913856	GF	On-Demand	Anodyne	CCR2	36	44
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450913857	GF	On-Demand	Anodyne	APOB	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450913857	GF	On-Demand	Anodyne	CACNA1B	48	34
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450913857	GF	On-Demand	Anodyne	MTTP	24	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450913857	GF	On-Demand	Anodyne	CCR2	36	44
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450913858	GF	On-Demand	Anodyne	APOB	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450913858	GF	On-Demand	Anodyne	CACNA1B	48	34
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450913858	GF	On-Demand	Anodyne	MTTP	24	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCC[C@H]1NS(C)(=O)=O	ZINC000450913858	GF	On-Demand	Anodyne	CCR2	36	44
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@@H]2C[C@H](F)CN2Cc2nccn2C)c1	ZINC000450913864	GE	On-Demand	Anodyne	DRD4	40	30
COC(=O)[C@H](CC(F)(F)F)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450913879	EG	On-Demand	Anodyne	CHRM5	35	40
COC(=O)[C@@H](CC(F)(F)F)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450913880	EG	On-Demand	Anodyne	CHRM5	35	40
CC(C)OCCOC1CCN(c2ncnc3n[nH]cc23)CC1	ZINC000450913884	DD	On-Demand	Anodyne	PDE3B	42	32
CCCCNc1cc(N2CCC(OCCOC(C)C)CC2)nc(N)n1	ZINC000450913886	FF	On-Demand	Anodyne	HRH4	43	48
CC1(C)CN(CCCC(=O)c2ccccc2)[C@@H]2CCC[C@H]2O1	ZINC000450913912	DH	On-Demand	Anodyne	CYP2J2	56	40
COC[C@H](CSc1nc2cncnc2[nH]1)c1ccc(Br)cc1	ZINC000450913916	GH	On-Demand	Anodyne	ENPP1	33	44
COC[C@@H](CSc1nc2cncnc2[nH]1)c1ccc(Br)cc1	ZINC000450913917	GH	On-Demand	Anodyne	ENPP1	33	44
N#Cc1ccc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)cc1F	ZINC000450913935	FD	On-Demand	Mild	TRPV4	45	38
N#Cc1ccc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)cc1F	ZINC000450913935	FD	On-Demand	Mild	MAP3K8	41	30
COc1cc(-c2noc(CSc3nnc(C)n3C(C)C)n2)ncn1	ZINC000450913961	EE	On-Demand	Anodyne	WNT3A	22	44
COc1cc(-c2noc(CSc3nnc(C)n3C(C)C)n2)ncn1	ZINC000450913961	EE	On-Demand	Anodyne	AXIN2	0	46
COCc1cc([N+](=O)[O-])ccc1NCc1cnc(C)cc1C	ZINC000450913980	DG	On-Demand	Bother	CACNA1D	45	32
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2SC)c(OC)c1	ZINC000450913989	GH	On-Demand	Anodyne	MTNR1A	63	40
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccccc2SC)c(OC)c1	ZINC000450913989	GH	On-Demand	Anodyne	MTNR1B	56	40
CCc1cc(O)nc(SCc2ccc(C(C)=O)cc2)n1	ZINC000450913995	CG	On-Demand	Anodyne	CA13	16	43
Cc1nc(SCC[C@H]2CCOC2)[nH]c1-c1ccccc1	ZINC000450913996	CH	On-Demand	Anodyne	SOAT1	45	45
Cc1nc(SCC[C@@H]2CCOC2)[nH]c1-c1ccccc1	ZINC000450913997	CH	On-Demand	Anodyne	SOAT1	45	45
C/C=C\C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OCC	ZINC000450914005	FG	On-Demand	Anodyne	TIMP3	69	36
C/C=C\C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OCC	ZINC000450914005	FG	On-Demand	Anodyne	CAPN2	51	34
C/C=C/C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OCC	ZINC000450914006	FG	On-Demand	Anodyne	TIMP3	69	36
C/C=C/C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OCC	ZINC000450914006	FG	On-Demand	Anodyne	CAPN2	51	34
C/C=C/C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OCC	ZINC000450914007	FG	On-Demand	Anodyne	TIMP3	69	36
C/C=C/C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)C(=O)OCC	ZINC000450914007	FG	On-Demand	Anodyne	CAPN2	51	34
C/C=C/C[C@H](NC(=O)[C@@H]1CCCN1C)C(=O)OCC	ZINC000450914008	CD	On-Demand	Anodyne	LGMN	44	34
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1C)C(=O)OCC	ZINC000450914009	CD	On-Demand	Anodyne	LGMN	44	34
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1C)C(=O)OCC	ZINC000450914010	CD	On-Demand	Anodyne	LGMN	44	34
C/C=C\C[C@H](NC(=O)[C@@H]1CCCN1C)C(=O)OCC	ZINC000450914011	CD	On-Demand	Anodyne	LGMN	44	34
CCn1ncc2c(=O)n(Cc3cccc(C(=O)OC)c3Cl)cnc21	ZINC000450914033	EE	On-Demand	Anodyne	NPBWR1	43	36
C/C=C/C[C@H](NC(=O)[C@H](O)[C@@H](C)CC)C(=O)OCC	ZINC000450914035	CD	On-Demand	Anodyne	METAP2	26	43
C/C=C\C[C@H](NC(=O)[C@H](O)[C@H](C)CC)C(=O)OCC	ZINC000450914037	CD	On-Demand	Anodyne	METAP2	26	43
C/C=C\C[C@H](NC(=O)[C@H](O)[C@@H](C)CC)C(=O)OCC	ZINC000450914039	CD	On-Demand	Anodyne	METAP2	26	43
C/C=C/C[C@H](NC(=O)[C@H](O)[C@H](C)CC)C(=O)OCC	ZINC000450914040	CD	On-Demand	Anodyne	METAP2	26	43
COc1ccc([C@H](NC(=O)CN2CCC(c3nnc(O)o3)CC2)C2CC2)cc1	ZINC000450914074	GE	On-Demand	Anodyne	PDK1	40	34
COc1ccc([C@@H](NC(=O)CN2CCC(c3nnc(O)o3)CC2)C2CC2)cc1	ZINC000450914076	GE	On-Demand	Anodyne	PDK1	40	34
CCOC(=O)[C@H]1CCCCN1C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450914082	FC	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450914084	FC	On-Demand	Anodyne	FKBP12.6	0	43
N#Cc1cnc2c(Br)cccc2c1NC[C@@H]1CCC[C@H]1O	ZINC000450914088	EG	On-Demand	Mild	MAP3K8	46	33
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450914099	CD	On-Demand	Mild	CA2	72	56
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450914099	CD	On-Demand	Mild	CA1	60	43
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450914099	CD	On-Demand	Mild	CA7	57	40
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450914099	CD	On-Demand	Mild	CA5B	44	38
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450914099	CD	On-Demand	Mild	CA4	63	43
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450914099	CD	On-Demand	Mild	CA5A	50	38
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450914099	CD	On-Demand	Mild	CA12	31	41
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(=O)OC	ZINC000450914099	CD	On-Demand	Mild	CA9	36	41
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	ZINC000450914107	GG	On-Demand	Anodyne	CACNA1B	49	35
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	ZINC000450914107	GG	On-Demand	Anodyne	COLA	15	42
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	ZINC000450914107	GG	On-Demand	Anodyne	RORC	44	43
Fc1ccc([C@@H]2CCCN2c2cc(N3CCOCC3)ncn2)c(F)c1	ZINC000450914118	EF	On-Demand	Anodyne	PRCP	43	42
Fc1ccc([C@H]2CCCN2c2cc(N3CCOCC3)ncn2)c(F)c1	ZINC000450914121	EF	On-Demand	Anodyne	PRCP	43	42
C[C@H](C(=O)C1CCCCC1)S(=O)(=O)c1ccccc1	ZINC000450914125	CF	On-Demand	Anodyne	AMY2	44	30
C[C@@H](C(=O)C1CCCCC1)S(=O)(=O)c1ccccc1	ZINC000450914126	CF	On-Demand	Anodyne	AMY2	44	30
COc1cc(CN2CCO[C@H](CN(C)CC(N)=O)C2)ccc1Cl	ZINC000450914127	EC	On-Demand	Anodyne	DRD4	21	55
COc1cc(CN2CCO[C@@H](CN(C)CC(N)=O)C2)ccc1Cl	ZINC000450914134	EC	On-Demand	Anodyne	DRD4	21	55
COc1ccc2ncc(=O)n(CC(=O)NCCOc3c(C)cccc3C)c2c1	ZINC000450914162	GE	On-Demand	Anodyne	AVPR1B	57	43
COc1ccc2ncc(=O)n(CC(=O)NCCOc3c(C)cccc3C)c2c1	ZINC000450914162	GE	On-Demand	Anodyne	MTNR1A	65	40
COc1ccc2ncc(=O)n(CC(=O)NCCOc3c(C)cccc3C)c2c1	ZINC000450914162	GE	On-Demand	Anodyne	MTNR1B	56	40
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc(C(=O)NCCO)nn1	ZINC000450914164	ED	On-Demand	Anodyne	SCD1	46	45
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc(C(=O)NCCO)nn1	ZINC000450914164	ED	On-Demand	Anodyne	SCD	35	43
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc(C(=O)NCCO)nn1	ZINC000450914166	ED	On-Demand	Anodyne	SCD1	46	45
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc(C(=O)NCCO)nn1	ZINC000450914166	ED	On-Demand	Anodyne	SCD	35	43
CC(F)(F)CCOc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450914170	CI	On-Demand	Bother	S1PR4	0	43
CC(F)(F)CCOc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450914170	CI	On-Demand	Bother	PPXII	0	40
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	HTR1A	96	58
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	THRA	0	44
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	DRD2	83	58
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	DRD1	37	46
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	DRD4	66	47
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	ADRA1D	38	42
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	HTR2A	76	58
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	HTR2C	52	46
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	SLC6A4	25	47
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	ADRA1A	33	40
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	DRD3	67	57
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	HTR7	111	54
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	SIGMAR1	23	47
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	HTR6	0	43
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	SLC18A3	0	40
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	FAAH	40	35
Cc1nccnc1N1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450914181	DF	On-Demand	Anodyne	CYP2J2	62	46
COc1cc(Cn2cnc(C3CCC3)cc2=O)ccc1Cl	ZINC000450914186	DG	On-Demand	Anodyne	PDE4A	32	40
COc1cc(Cn2cnc(C3CCC3)cc2=O)ccc1Cl	ZINC000450914186	DG	On-Demand	Anodyne	PDE4D	38	40
CCCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914196	GF	On-Demand	Anodyne	AVPR1B	62	46
CCCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914196	GF	On-Demand	Anodyne	CMA1	26	40
CCCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914196	GF	On-Demand	Anodyne	PLA2G2A	46	37
CCCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914196	GF	On-Demand	Anodyne	MTNR1A	68	42
CCCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914196	GF	On-Demand	Anodyne	MTNR1B	62	42
CCCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914196	GF	On-Demand	Anodyne	ROCK2	42	37
CCCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914196	GF	On-Demand	Anodyne	DUSP3	0	41
CCCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914196	GF	On-Demand	Anodyne	CTRC	30	40
COc1ccc2ncc(=O)n(CCCOc3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000450914202	GE	On-Demand	Anodyne	GSG2	40	37
COC(=O)c1cccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)c1Cl	ZINC000450914204	GH	On-Demand	Anodyne	SLC6A1	73	35
COC(=O)c1cccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)c1Cl	ZINC000450914204	GH	On-Demand	Anodyne	MLNR	15	41
COC(=O)c1cccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c1Cl	ZINC000450914207	GH	On-Demand	Anodyne	SLC6A1	73	35
COC(=O)c1cccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c1Cl	ZINC000450914207	GH	On-Demand	Anodyne	MLNR	15	41
C/C=C/c1ccc(OC[C@@H](O)CN2CCC(c3nnc(O)o3)CC2)c(OC)c1	ZINC000450914211	GE	On-Demand	Anodyne	ADRB2	28	48
C/C=C\c1ccc(OC[C@H](O)CN2CCC(c3nnc(O)o3)CC2)c(OC)c1	ZINC000450914214	GE	On-Demand	Anodyne	ADRB2	28	48
C/C=C/c1ccc(OC[C@H](O)CN2CCC(c3nnc(O)o3)CC2)c(OC)c1	ZINC000450914216	GE	On-Demand	Anodyne	ADRB2	28	48
C/C=C\c1ccc(OC[C@@H](O)CN2CCC(c3nnc(O)o3)CC2)c(OC)c1	ZINC000450914219	GE	On-Demand	Anodyne	ADRB2	28	48
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000450914234	GH	On-Demand	Anodyne	PREP	60	38
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000450914234	GH	On-Demand	Anodyne	WNT3	46	33
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000450914246	GH	On-Demand	Anodyne	PREP	60	38
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000450914246	GH	On-Demand	Anodyne	WNT3	46	33
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000450914249	GH	On-Demand	Anodyne	PREP	60	38
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000450914249	GH	On-Demand	Anodyne	WNT3	46	33
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000450914251	GH	On-Demand	Anodyne	PREP	60	38
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000450914251	GH	On-Demand	Anodyne	WNT3	46	33
COCCOCCOc1ccc(CN2CCC[C@H]2c2nc(=N)n(C)[nH]2)cc1	ZINC000450914259	GD	On-Demand	Anodyne	CHEK2	27	41
COCCOCCOc1ccc(CN2CCC[C@@H]2c2nc(=N)n(C)[nH]2)cc1	ZINC000450914266	GD	On-Demand	Anodyne	CHEK2	27	41
COc1ccc2ncc(=O)n(CCCS(=O)(=O)c3ccc(C)cc3)c2c1	ZINC000450914278	FF	On-Demand	Anodyne	GSG2	41	38
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450914283	FF	On-Demand	Anodyne	ECE2	0	40
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450914284	FF	On-Demand	Anodyne	ECE2	0	40
Cc1cc(C(=O)N(CCCOc2ccccc2)C2CCOCC2)nn1C(C)C	ZINC000450914298	GH	On-Demand	Anodyne	COLA	52	33
Cc1cc(C(=O)N(CCCOc2ccccc2)C2CCOCC2)nn1C(C)C	ZINC000450914298	GH	On-Demand	Anodyne	CPT1A	48	33
c1csc(-c2noc([C@H]3COCCN3C[C@H]3C[C@H]4CC[C@H]3O4)n2)c1	ZINC000450914319	EF	On-Demand	Anodyne	ETHR	27	44
c1csc(-c2noc([C@H]3COCCN3C[C@@H]3C[C@H]4CC[C@H]3O4)n2)c1	ZINC000450914320	EF	On-Demand	Anodyne	ETHR	27	44
c1csc(-c2noc([C@@H]3COCCN3C[C@@H]3C[C@H]4CC[C@H]3O4)n2)c1	ZINC000450914321	EF	On-Demand	Anodyne	ETHR	27	44
c1csc(-c2noc([C@@H]3COCCN3C[C@H]3C[C@H]4CC[C@H]3O4)n2)c1	ZINC000450914322	EF	On-Demand	Anodyne	ETHR	27	44
COC1(CSc2nc(C)c(-c3ccccc3)[nH]2)CCC1	ZINC000450914363	CI	On-Demand	Anodyne	SOAT1	37	43
CC(F)(F)CCOc1ccc(C#N)c(Cl)c1	ZINC000450914378	BH	On-Demand	Mild	AR	23	45
CC(F)(F)CCOc1ccc(C#N)c(Cl)c1	ZINC000450914378	BH	On-Demand	Mild	TRPV4	48	39
Cc1cc(C)c(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])cn1	ZINC000450914379	FE	On-Demand	Bother	BDKRB1	22	41
Cc1cc(C)c(CNc2cc(C(F)(F)F)nc3ncnn23)cn1	ZINC000450914399	DF	On-Demand	Anodyne	DHOD	0	52
CCN(CC1CCC(=O)CC1)[C@@H](C)Cc1ccccc1C(F)(F)F	ZINC000450914405	EJ	On-Demand	Anodyne	SLC16A1	48	32
CCN(CC1CCC(=O)CC1)[C@H](C)Cc1ccccc1C(F)(F)F	ZINC000450914406	EJ	On-Demand	Anodyne	SLC16A1	48	32
CNC(=O)C[C@H](NC[C@H]1CCCCN1C(C)C)c1ccccc1	ZINC000450914409	DF	On-Demand	Anodyne	BIRC2	42	33
CNC(=O)C[C@@H](NC[C@H]1CCCCN1C(C)C)c1ccccc1	ZINC000450914410	DF	On-Demand	Anodyne	BIRC2	42	33
CNC(=O)C[C@H](NC[C@@H]1CCCCN1C(C)C)c1ccccc1	ZINC000450914411	DF	On-Demand	Anodyne	BIRC2	42	33
CNC(=O)C[C@@H](NC[C@@H]1CCCCN1C(C)C)c1ccccc1	ZINC000450914412	DF	On-Demand	Anodyne	BIRC2	42	33
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)C(=O)OC)cc1	ZINC000450914421	CD	On-Demand	Anodyne	CA2	41	40
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)C(=O)OC)cc1	ZINC000450914421	CD	On-Demand	Anodyne	BMP1	31	40
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)C(=O)OC)cc1	ZINC000450914421	CD	On-Demand	Anodyne	CA1	34	40
CCS(=O)(=O)c1ccc(CN(C)[C@H](C)C(=O)OC)cc1	ZINC000450914421	CD	On-Demand	Anodyne	RORC	40	38
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)C(=O)OC)cc1	ZINC000450914422	CD	On-Demand	Anodyne	CA2	41	40
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)C(=O)OC)cc1	ZINC000450914422	CD	On-Demand	Anodyne	BMP1	31	40
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)C(=O)OC)cc1	ZINC000450914422	CD	On-Demand	Anodyne	CA1	34	40
CCS(=O)(=O)c1ccc(CN(C)[C@@H](C)C(=O)OC)cc1	ZINC000450914422	CD	On-Demand	Anodyne	RORC	40	38
CC(C)c1nnc(CN(CCc2ccccn2)Cc2cccnc2)s1	ZINC000450914427	FH	On-Demand	Anodyne	NR1D1	43	34
Oc1nnc(C2CCN(Cc3ccccc3Oc3cccnc3)CC2)o1	ZINC000450914443	FG	On-Demand	Anodyne	CCR8	20	41
C[C@]1(C(=O)NCc2cccc(-c3cccnc3)c2)CC=CCC1	ZINC000450914470	DI	On-Demand	Anodyne	NAMPT	45	37
CC(C)(CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)C1(O)CCCC1	ZINC000450914473	FD	On-Demand	Bother	TBXA2R	28	40
COC(=O)c1ccc(Cn2cnc(C)c(C)c2=O)cc1Cl	ZINC000450914474	DE	On-Demand	Anodyne	DNAE	70	34
COc1ccc(-c2noc(CSc3c(OC)cccc3OC)n2)nn1	ZINC000450914476	FF	On-Demand	Anodyne	AXIN2	0	40
Oc1nnc(C2CCN(Cc3ccc(I)cc3)CC2)o1	ZINC000450914477	GF	On-Demand	Anodyne	VACHT_TETCF	0	43
Oc1nnc(C2CCN(Cc3ccc(I)cc3)CC2)o1	ZINC000450914477	GF	On-Demand	Anodyne	SIGMAR1	25	43
CNC(=O)C[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450914498	DG	On-Demand	Anodyne	METAP1	46	42
CNC(=O)C[C@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450914498	DG	On-Demand	Anodyne	CAN2	0	40
CNC(=O)C[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450914499	DG	On-Demand	Anodyne	METAP1	46	42
CNC(=O)C[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1	ZINC000450914499	DG	On-Demand	Anodyne	CAN2	0	40
CN(CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914505	FG	On-Demand	Anodyne	ACHE	18	40
CN(CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914505	FG	On-Demand	Anodyne	SLC6A1	108	41
CN(CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914505	FG	On-Demand	Anodyne	LTA4H	15	41
CN(CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914505	FG	On-Demand	Anodyne	SIGMAR1	49	43
CN(CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914505	FG	On-Demand	Anodyne	CCR5	41	44
CN(CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914505	FG	On-Demand	Anodyne	FASN	40	38
CN(CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914505	FG	On-Demand	Anodyne	CYP2J2	46	33
CN(CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914507	FG	On-Demand	Anodyne	ACHE	18	40
CN(CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914507	FG	On-Demand	Anodyne	SLC6A1	108	41
CN(CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914507	FG	On-Demand	Anodyne	LTA4H	15	41
CN(CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914507	FG	On-Demand	Anodyne	SIGMAR1	49	43
CN(CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914507	FG	On-Demand	Anodyne	CCR5	41	44
CN(CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914507	FG	On-Demand	Anodyne	FASN	40	38
CN(CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1)Cc1ccccc1	ZINC000450914507	FG	On-Demand	Anodyne	CYP2J2	46	33
Cc1ccc(C)c(OC[C@@H](O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450914508	EE	On-Demand	Anodyne	ACOX1	58	31
Cc1ccc(C)c(OC[C@@H](O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450914508	EE	On-Demand	Anodyne	ABCB1	42	38
Cc1ccc(C)c(OC[C@H](O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450914510	EE	On-Demand	Anodyne	ACOX1	58	31
Cc1ccc(C)c(OC[C@H](O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450914510	EE	On-Demand	Anodyne	ABCB1	42	38
CCC[C@H](NC(=O)[C@@]1(C#N)C[C@H]1C)C(=O)OC(C)(C)C	ZINC000450914513	CE	On-Demand	Mild	PAPA1_CARPA	31	43
CC(C)(C)c1ccccc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450914514	FF	On-Demand	Anodyne	DRD4	26	43
CCC[C@H](NC(=O)[C@]1(C#N)C[C@@H]1C)C(=O)OC(C)(C)C	ZINC000450914515	CE	On-Demand	Mild	PAPA1_CARPA	31	43
CCC[C@H](NC(=O)[C@]1(C#N)C[C@H]1C)C(=O)OC(C)(C)C	ZINC000450914517	CE	On-Demand	Mild	PAPA1_CARPA	31	43
CCC[C@H](NC(=O)[C@@]1(C#N)C[C@@H]1C)C(=O)OC(C)(C)C	ZINC000450914519	CE	On-Demand	Mild	PAPA1_CARPA	31	43
CC(C)(CNc1ccc(S(C)(=O)=O)cc1C(F)(F)F)C1(O)CCCC1	ZINC000450914528	GH	On-Demand	Anodyne	PTGS2	16	42
Cc1cccc(OCCCNC(=O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450914530	FD	On-Demand	Anodyne	DRD4	0	45
Cc1cccc(OCCCNC(=O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450914530	FD	On-Demand	Anodyne	HRH2	52	40
Cc1cccc(OCCCNC(=O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450914530	FD	On-Demand	Anodyne	ACOX1	40	32
CNC(=O)c1cccnc1NCC(C)(C)C1(O)CCCC1	ZINC000450914534	CE	On-Demand	Anodyne	G2YM83_BOTF4	51	32
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	ACE	47	40
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	MME	81	40
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	ANPEP	75	36
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	FCER2	56	34
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	PFDN6	0	41
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	KLK3	62	34
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	CTSB	58	40
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	PAPA1_CARPA	62	41
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	CYSP_TRYCR	49	40
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	CPA1	29	40
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	TIMP3	64	33
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	CAPNS1	61	39
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	HLA-DRB1	61	39
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	PAM	0	40
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	CAPN1	95	41
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	CAPN2	101	39
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	ACE2	73	40
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	FPR1	50	37
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	CTRB_BOVIN	50	39
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	NPR	37	42
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	AMP1_PLAFQ	23	41
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	HDA106	0	41
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	RHODESAIN	0	44
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	SLC15A2	0	40
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	BLA1_STEMA	42	33
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	PSMB8	41	35
C/C=C\C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914546	DE	On-Demand	Anodyne	NPFFR1	41	32
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	ACE	47	40
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	MME	81	40
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	ANPEP	75	36
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	FCER2	56	34
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	PFDN6	0	41
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	KLK3	62	34
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	CTSB	58	40
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	PAPA1_CARPA	62	41
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	CYSP_TRYCR	49	40
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	CPA1	29	40
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	TIMP3	64	33
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	CAPNS1	61	39
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	HLA-DRB1	61	39
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	PAM	0	40
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	CAPN1	95	41
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	CAPN2	101	39
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	ACE2	73	40
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	FPR1	50	37
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	CTRB_BOVIN	50	39
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	NPR	37	42
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	AMP1_PLAFQ	23	41
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	HDA106	0	41
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	RHODESAIN	0	44
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	SLC15A2	0	40
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	BLA1_STEMA	42	33
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	PSMB8	41	35
C/C=C\C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914547	DE	On-Demand	Anodyne	NPFFR1	41	32
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	ACE	47	40
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	MME	81	40
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	ANPEP	75	36
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	FCER2	56	34
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	PFDN6	0	41
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	KLK3	62	34
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	CTSB	58	40
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	PAPA1_CARPA	62	41
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	CYSP_TRYCR	49	40
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	CPA1	29	40
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	TIMP3	64	33
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	CAPNS1	61	39
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	HLA-DRB1	61	39
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	PAM	0	40
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	CAPN1	95	41
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	CAPN2	101	39
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	ACE2	73	40
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	FPR1	50	37
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	CTRB_BOVIN	50	39
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	NPR	37	42
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	AMP1_PLAFQ	23	41
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	HDA106	0	41
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	RHODESAIN	0	44
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	SLC15A2	0	40
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	BLA1_STEMA	42	33
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	PSMB8	41	35
C/C=C/C[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914549	DE	On-Demand	Anodyne	NPFFR1	41	32
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	ACE	47	40
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	MME	81	40
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	ANPEP	75	36
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	FCER2	56	34
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	PFDN6	0	41
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	KLK3	62	34
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	CTSB	58	40
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	PAPA1_CARPA	62	41
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	CYSP_TRYCR	49	40
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	CPA1	29	40
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	TIMP3	64	33
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	CAPNS1	61	39
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	HLA-DRB1	61	39
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	PAM	0	40
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	CAPN1	95	41
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	CAPN2	101	39
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	ACE2	73	40
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	FPR1	50	37
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	CTRB_BOVIN	50	39
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	NPR	37	42
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	AMP1_PLAFQ	23	41
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	HDA106	0	41
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	RHODESAIN	0	44
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	SLC15A2	0	40
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	BLA1_STEMA	42	33
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	PSMB8	41	35
C/C=C/C[C@H](NC(=O)[C@H](Cc1ccccc1)OC)C(=O)OCC	ZINC000450914551	DE	On-Demand	Anodyne	NPFFR1	41	32
NC(=O)CCN(C(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccc(F)cc1	ZINC000450914553	GD	On-Demand	Anodyne	WNT3A	46	35
COc1ccccc1S(=O)(=O)[C@H](C)C(=O)C1CCCCC1	ZINC000450914573	DG	On-Demand	Anodyne	AMY2	45	31
COc1ccccc1S(=O)(=O)[C@@H](C)C(=O)C1CCCCC1	ZINC000450914574	DG	On-Demand	Anodyne	AMY2	45	31
CO[C@@H](Cc1ccccc1)CS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450914594	FH	On-Demand	Anodyne	CACNA1B	41	36
CO[C@@H](Cc1ccccc1)CS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450914594	FH	On-Demand	Anodyne	PDS	41	38
CO[C@H](Cc1ccccc1)CS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450914595	FH	On-Demand	Anodyne	CACNA1B	41	36
CO[C@H](Cc1ccccc1)CS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450914595	FH	On-Demand	Anodyne	PDS	41	38
C=C(CC)CNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000450914607	DH	On-Demand	Mild	AVPR2	42	37
O=S(=O)(c1ccc(NC[C@H](O)C2CCC2)nc1)N1CCCCC1	ZINC000450914616	ED	On-Demand	Anodyne	EPHX2	17	40
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	F2	21	40
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	AVPR1B	51	40
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	PTAFR	18	42
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	CMA1	45	39
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	CTRA_BOVIN	42	38
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	MTNR1A	84	50
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	MTNR1B	79	50
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	FAAH	32	41
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	CES1	22	41
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	CTRC	43	39
COc1ccc2ncc(=O)n(CC(=O)NCCCc3ccccc3)c2c1	ZINC000450914617	FE	On-Demand	Anodyne	CRTM	44	39
O=S(=O)(c1ccc(NC[C@@H](O)C2CCC2)nc1)N1CCCCC1	ZINC000450914618	ED	On-Demand	Anodyne	EPHX2	17	40
COc1ccc2ncc(=O)n(CC(=O)Nc3ccccc3C(C)C)c2c1	ZINC000450914622	FG	On-Demand	Anodyne	AVPR1B	37	40
C[C@H](Sc1n[nH]c(O)n1)C(=O)Nc1nccs1	ZINC000450914626	CD	On-Demand	Anodyne	MAP	0	43
C[C@H](Sc1n[nH]c(O)n1)C(=O)Nc1nccs1	ZINC000450914626	CD	On-Demand	Anodyne	MAP1	105	39
C[C@@H](Sc1n[nH]c(O)n1)C(=O)Nc1nccs1	ZINC000450914627	CD	On-Demand	Anodyne	MAP	0	43
C[C@@H](Sc1n[nH]c(O)n1)C(=O)Nc1nccs1	ZINC000450914627	CD	On-Demand	Anodyne	MAP1	105	39
COc1ccc2ncc(=O)n(CC(=O)N[C@H](c3ccccc3)C(C)C)c2c1	ZINC000450914629	FF	On-Demand	Anodyne	AVPR1B	41	40
COc1ccc2ncc(=O)n(CC(=O)N[C@H](c3ccccc3)C(C)C)c2c1	ZINC000450914629	FF	On-Demand	Anodyne	ELANE	44	38
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](c3ccccc3)C(C)C)c2c1	ZINC000450914630	FF	On-Demand	Anodyne	AVPR1B	41	40
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](c3ccccc3)C(C)C)c2c1	ZINC000450914630	FF	On-Demand	Anodyne	ELANE	44	38
COC(=O)c1cnc(N2CCC[C@H]2c2ccc(F)cc2C)nc1	ZINC000450914631	DG	On-Demand	Anodyne	GRM5	15	41
COC(=O)c1cnc(N2CCC[C@@H]2c2ccc(F)cc2C)nc1	ZINC000450914632	DG	On-Demand	Anodyne	GRM5	15	41
COc1ccc2ncc(=O)n(CC(=O)NCCC3CCCCC3)c2c1	ZINC000450914641	EE	On-Demand	Anodyne	AVPR1B	43	40
COc1ccc2ncc(=O)n(CC(=O)NCCC3CCCCC3)c2c1	ZINC000450914641	EE	On-Demand	Anodyne	NQO2	41	40
COc1ccc2ncc(=O)n(CCCF)c2c1	ZINC000450914649	BD	On-Demand	Anodyne	GSG2	47	44
C=C(CC)CNc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450914650	EE	On-Demand	Mild	TAAR1	17	46
C=C(CC)CNc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450914651	EE	On-Demand	Mild	TAAR1	17	46
CC[C@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914668	EG	On-Demand	Anodyne	MME	61	41
CC[C@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914668	EG	On-Demand	Anodyne	ANPEP	32	41
CC[C@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914668	EG	On-Demand	Anodyne	CPA1	48	38
CC[C@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914668	EG	On-Demand	Anodyne	ACE2	55	37
CC[C@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914668	EG	On-Demand	Anodyne	AMP1_PLAFQ	44	38
CC[C@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914668	EG	On-Demand	Anodyne	PDS	41	35
CC[C@@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914669	EG	On-Demand	Anodyne	MME	61	41
CC[C@@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914669	EG	On-Demand	Anodyne	ANPEP	32	41
CC[C@@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914669	EG	On-Demand	Anodyne	CPA1	48	38
CC[C@@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914669	EG	On-Demand	Anodyne	ACE2	55	37
CC[C@@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914669	EG	On-Demand	Anodyne	AMP1_PLAFQ	44	38
CC[C@@H](O)CC(=O)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450914669	EG	On-Demand	Anodyne	PDS	41	35
CCCOc1cccc(CN(CCNS(C)(=O)=O)C2CC2)c1	ZINC000450914676	ED	On-Demand	Anodyne	SQLE	52	38
COc1ccc2ncc(=O)n(CC(=O)NCCCSc3ccccc3)c2c1	ZINC000450914678	GF	On-Demand	Anodyne	AVPR1B	44	40
COc1ccc2ncc(=O)n(CC(=O)NCCCSc3ccccc3)c2c1	ZINC000450914678	GF	On-Demand	Anodyne	MTNR1A	46	38
COc1cc(CC(=O)N2CC[C@H](N(C)Cc3ncccn3)C2)ccc1Cl	ZINC000450914687	FE	On-Demand	Anodyne	OPRK1	26	44
COc1cc(CC(=O)N2CC[C@H](N(C)Cc3ncccn3)C2)ccc1Cl	ZINC000450914687	FE	On-Demand	Anodyne	CCR1	24	43
COc1cc(CC(=O)N2CC[C@H](N(C)Cc3ncccn3)C2)ccc1Cl	ZINC000450914687	FE	On-Demand	Anodyne	MBTPS1	44	32
COc1cc(CC(=O)N2CC[C@@H](N(C)Cc3ncccn3)C2)ccc1Cl	ZINC000450914688	FE	On-Demand	Anodyne	OPRK1	26	44
COc1cc(CC(=O)N2CC[C@@H](N(C)Cc3ncccn3)C2)ccc1Cl	ZINC000450914688	FE	On-Demand	Anodyne	CCR1	24	43
COc1cc(CC(=O)N2CC[C@@H](N(C)Cc3ncccn3)C2)ccc1Cl	ZINC000450914688	FE	On-Demand	Anodyne	MBTPS1	44	32
COc1cc(CC(=O)N2CCO[C@H](CN(C)CC(N)=O)C2)ccc1Cl	ZINC000450914690	FC	On-Demand	Anodyne	OPRK1	36	42
COc1cc(CC(=O)N2CCO[C@@H](CN(C)CC(N)=O)C2)ccc1Cl	ZINC000450914691	FC	On-Demand	Anodyne	OPRK1	36	42
CCc1cc(NCc2cnc(C)cc2C)n2ncnc2n1	ZINC000450914707	CE	On-Demand	Anodyne	DHOD	0	50
Cc1ccnc(-c2noc(CSc3nnc(C)n3C(C)C)n2)c1	ZINC000450914708	EG	On-Demand	Anodyne	AXIN2	0	44
Cc1ccc(CC(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)c(Br)c1	ZINC000450914710	GF	On-Demand	Anodyne	OXTR	0	43
Cc1ccc(CC(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)c(Br)c1	ZINC000450914711	GF	On-Demand	Anodyne	OXTR	0	43
CCN(Cc1ccn(CCc2ccccc2)n1)[C@H]1CCNC1=O	ZINC000450914725	DD	On-Demand	Anodyne	GHRL	42	29
CCN(Cc1ccn(CCc2ccccc2)n1)[C@@H]1CCNC1=O	ZINC000450914726	DD	On-Demand	Anodyne	GHRL	42	29
CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450914737	EE	On-Demand	Anodyne	HPGD	40	38
CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450914738	EE	On-Demand	Anodyne	HPGD	40	38
COc1ccc2nc(NCc3cnc(C)cc3C)c(C)nc2c1	ZINC000450914769	DH	On-Demand	Anodyne	DHFR	16	41
COc1ccc2nc(NCc3cnc(C)cc3C)c(C)nc2c1	ZINC000450914769	DH	On-Demand	Anodyne	DRTS_TOXGO	27	41
COc1ccc2nc(NCc3cnc(C)cc3C)c(C)nc2c1	ZINC000450914769	DH	On-Demand	Anodyne	DYR_PNECA	26	41
FC1(F)CC[C@@H](CN2CCOC[C@H]2c2nc(-c3cccs3)no2)C1	ZINC000450914770	FH	On-Demand	Anodyne	ETHR	48	42
FC1(F)CC[C@H](CN2CCOC[C@@H]2c2nc(-c3cccs3)no2)C1	ZINC000450914771	FH	On-Demand	Anodyne	ETHR	48	42
FC1(F)CC[C@H](CN2CCOC[C@H]2c2nc(-c3cccs3)no2)C1	ZINC000450914772	FH	On-Demand	Anodyne	ETHR	48	42
FC1(F)CC[C@@H](CN2CCOC[C@@H]2c2nc(-c3cccs3)no2)C1	ZINC000450914773	FH	On-Demand	Anodyne	ETHR	48	42
CCCC[C@H](NC(=O)[C@@]1(C#N)C[C@H]1C)C(=O)OC(C)(C)C	ZINC000450914794	CF	On-Demand	Mild	CTSK	0	44
CCCC[C@H](NC(=O)[C@]1(C#N)C[C@@H]1C)C(=O)OC(C)(C)C	ZINC000450914797	CF	On-Demand	Mild	CTSK	0	44
CCCC[C@H](NC(=O)[C@@]1(C#N)C[C@@H]1C)C(=O)OC(C)(C)C	ZINC000450914798	CF	On-Demand	Mild	CTSK	0	44
CCCC[C@H](NC(=O)[C@]1(C#N)C[C@H]1C)C(=O)OC(C)(C)C	ZINC000450914799	CF	On-Demand	Mild	CTSK	0	44
O=[N+]([O-])c1ccc(NCc2cnc(C3CC3)o2)cc1C(F)(F)F	ZINC000450914809	EI	On-Demand	Bother	AADAC	0	42
COCCOC[C@@H](O)CN1CC[C@@](C)(c2ccc(F)cc2)C1	ZINC000450914828	DD	On-Demand	Anodyne	HSP90AB1	36	43
COCCOC[C@H](O)CN1CC[C@@](C)(c2ccc(F)cc2)C1	ZINC000450914829	DD	On-Demand	Anodyne	HSP90AB1	36	43
COCCOC[C@@H](O)CN1CC[C@](C)(c2ccc(F)cc2)C1	ZINC000450914830	DD	On-Demand	Anodyne	HSP90AB1	36	43
COCCOC[C@H](O)CN1CC[C@](C)(c2ccc(F)cc2)C1	ZINC000450914831	DD	On-Demand	Anodyne	HSP90AB1	36	43
COC(=O)[C@H](C)N(C)Cc1ccn(CCc2ccccc2)n1	ZINC000450914872	DE	On-Demand	Anodyne	FAS	16	40
COC(=O)[C@@H](C)N(C)Cc1ccn(CCc2ccccc2)n1	ZINC000450914873	DE	On-Demand	Anodyne	FAS	16	40
COC(=O)c1csc(CN2CCC=C(C)C2)n1	ZINC000450914904	CE	On-Demand	Anodyne	CHRNA6	0	43
CC(C)(CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C1(O)CCCC1	ZINC000450914923	FD	On-Demand	Bother	CA2	28	40
Oc1nnc(C2CCN(C[C@H]3CCCCO3)CC2)o1	ZINC000450914925	CD	On-Demand	Anodyne	PDE8B	49	36
Oc1nnc(C2CCN(C[C@@H]3CCCCO3)CC2)o1	ZINC000450914927	CD	On-Demand	Anodyne	PDE8B	49	36
CC(C)(CNc1ncc(C(=O)N2CCOCC2)cc1Cl)C1(O)CCCC1	ZINC000450914935	GF	On-Demand	Anodyne	LRRK2	33	40
COc1ccc(CNC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1OC	ZINC000450914941	GD	On-Demand	Anodyne	DRD4	18	41
COc1ccc(CNC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1OC	ZINC000450914941	GD	On-Demand	Anodyne	HCRTR1	21	44
COc1ccc(CNC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1OC	ZINC000450914941	GD	On-Demand	Anodyne	SSTR5	52	39
COc1ccc(CNC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1OC	ZINC000450914941	GD	On-Demand	Anodyne	HCRTR2	19	41
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450914953	GF	On-Demand	Anodyne	CCR5	31	40
C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450914954	GF	On-Demand	Anodyne	CCR5	31	40
O=S(=O)(CC1=CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000450914961	DH	On-Demand	Anodyne	CACNA1B	46	34
CC(C)NC(=O)c1ccc(NCC(C)(C)C2(O)CCCC2)c([N+](=O)[O-])c1	ZINC000450914964	FG	On-Demand	Bother	TAAR1	17	42
COc1ccc2ncc(=O)n(CC(=O)NCCC(C)(C)C)c2c1	ZINC000450914977	DD	On-Demand	Anodyne	MTNR1A	48	42
COc1ccc2ncc(=O)n(CC(=O)NCCC(C)(C)C)c2c1	ZINC000450914977	DD	On-Demand	Anodyne	PROKR1	44	32
COCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914989	GD	On-Demand	Anodyne	F2	15	45
COCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914989	GD	On-Demand	Anodyne	AVPR1B	59	43
COCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914989	GD	On-Demand	Anodyne	CMA1	29	41
COCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914989	GD	On-Demand	Anodyne	MTNR1A	56	39
COCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914989	GD	On-Demand	Anodyne	MTNR1B	52	39
COCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914989	GD	On-Demand	Anodyne	ROCK2	44	39
COCCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450914989	GD	On-Demand	Anodyne	CTRC	30	41
C=CCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nc1	ZINC000450914998	EH	On-Demand	Mild	ACKR3	40	33
C=CCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nc1	ZINC000450915000	EH	On-Demand	Mild	ACKR3	40	33
CCn1ncc2c(=O)n(CCC(=O)NCc3ccc(OC)cc3OC)cnc21	ZINC000450915008	GD	On-Demand	Anodyne	PDGFRB	42	44
CCn1ncc2c(=O)n(CCC(=O)NCc3ccc(OC)cc3OC)cnc21	ZINC000450915008	GD	On-Demand	Anodyne	CSF1R	17	44
COc1ccc2ncc(=O)n(CC(=O)Nc3ccc4c(c3)CCC4)c2c1	ZINC000450915012	EF	On-Demand	Anodyne	ACOX1	23	44
COc1ccc2ncc(=O)n(CC(=O)Nc3ccc4c(c3)CCC4)c2c1	ZINC000450915012	EF	On-Demand	Anodyne	CALCRL	40	45
COc1ccc2ncc(=O)n(CC(=O)Nc3ccc4c(c3)CCC4)c2c1	ZINC000450915012	EF	On-Demand	Anodyne	NOD1	24	46
CC(C)(CNc1ccc(C(=O)N2CCc3ccccc32)cn1)C1(O)CCCC1	ZINC000450915013	GI	On-Demand	Anodyne	AVPR2	102	43
CC(C)(CNc1ccc(C(=O)N2CCc3ccccc32)cn1)C1(O)CCCC1	ZINC000450915013	GI	On-Demand	Anodyne	AVPR1A	55	41
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(COC(C)C)c3)c2c1	ZINC000450915018	GF	On-Demand	Anodyne	AVPR1B	49	40
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(COC(C)C)c3)c2c1	ZINC000450915018	GF	On-Demand	Anodyne	CMA1	32	40
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(COC(C)C)c3)c2c1	ZINC000450915018	GF	On-Demand	Anodyne	MTNR1A	40	36
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(COC(C)C)c3)c2c1	ZINC000450915018	GF	On-Demand	Anodyne	MTNR1B	40	36
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(COC(C)C)c3)c2c1	ZINC000450915018	GF	On-Demand	Anodyne	CTRC	34	40
C[C@@H]1CCC(=O)[C@H](S(=O)(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000450915019	DG	On-Demand	Anodyne	CACNA1B	51	37
C[C@@H]1CCC(=O)[C@@H](S(=O)(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000450915020	DG	On-Demand	Anodyne	CACNA1B	51	37
C[C@H]1CCC(=O)[C@H](S(=O)(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000450915022	DG	On-Demand	Anodyne	CACNA1B	51	37
C[C@H]1CCC(=O)[C@@H](S(=O)(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000450915024	DG	On-Demand	Anodyne	CACNA1B	51	37
CS(=O)(=O)N1CC[C@@H](CSCc2ccccc2Cl)C1	ZINC000450915025	DF	On-Demand	Anodyne	EPHX2	15	42
CS(=O)(=O)N1CC[C@H](CSCc2ccccc2Cl)C1	ZINC000450915026	DF	On-Demand	Anodyne	EPHX2	15	42
CCc1cc(NCC(C)(C)C2(O)CCCC2)n2ncnc2n1	ZINC000450915034	DE	On-Demand	Anodyne	DHOD	0	51
C[C@H]1CCCN(c2cc(NC[C@@H]3CCC[C@H]3O)ncn2)C1	ZINC000450915037	CE	On-Demand	Anodyne	PRCP	0	46
O=C(CN1CCC(c2nnc(O)o2)CC1)NCCCc1ccccc1	ZINC000450915039	ED	On-Demand	Anodyne	CRTM	40	40
COc1ccc2ncc(=O)n(CC(=O)NC3(c4ccccc4)CCC3)c2c1	ZINC000450915041	FF	On-Demand	Anodyne	AVPR1B	42	37
COc1ccc2ncc(=O)n(CC(=O)NC3(c4ccccc4)CCC3)c2c1	ZINC000450915041	FF	On-Demand	Anodyne	NPBWR1	53	31
C=C(CC)CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450915057	FD	On-Demand	Mild	BDKRB1	36	51
C=C(CC)CNc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-]	ZINC000450915057	FD	On-Demand	Mild	BCL2L1	50	31
O=C(CS(=O)(=O)C1CC1)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450915058	FF	On-Demand	Anodyne	MME	62	39
O=C(CS(=O)(=O)C1CC1)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450915058	FF	On-Demand	Anodyne	CPA1	44	43
O=C(CS(=O)(=O)C1CC1)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450915058	FF	On-Demand	Anodyne	CAPN1	52	39
O=C(CS(=O)(=O)C1CC1)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450915058	FF	On-Demand	Anodyne	CAPN2	49	34
O=C(CS(=O)(=O)C1CC1)NCC(Cc1ccccc1)Cc1ccccc1	ZINC000450915058	FF	On-Demand	Anodyne	AMP1_PLAFQ	41	34
C=C(CC)CNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450915060	FD	On-Demand	Mild	DDIT3	0	40
COc1ccc2ncc(=O)n(CC(=O)NC(=O)NC3CC3)c2c1	ZINC000450915066	DC	On-Demand	Anodyne	AVPR1B	33	41
COc1ccc2ncc(=O)n(CC(=O)NCCOc3ccc(C(C)C)cc3)c2c1	ZINC000450915071	GF	On-Demand	Anodyne	AVPR1B	48	38
Cc1csc(C(=O)N(CCCOc2ccccc2)C2CCOCC2)c1	ZINC000450915083	FI	On-Demand	Anodyne	AMY2	43	31
COc1ccc2ncc(=O)n(CC(=O)NCc3ccc(OC)c(OC)c3)c2c1	ZINC000450915086	GD	On-Demand	Anodyne	PDGFRB	49	38
COc1ccc2ncc(=O)n(CC(=O)NCc3ccc(OC)c(OC)c3)c2c1	ZINC000450915086	GD	On-Demand	Anodyne	HCRTR1	17	40
COc1ccc2ncc(=O)n(CC(=O)NCc3ccc(OC)c(OC)c3)c2c1	ZINC000450915086	GD	On-Demand	Anodyne	MT-ND1	25	42
COc1ccc2ncc(=O)n(CC(=O)NCc3ccc(OC)c(OC)c3)c2c1	ZINC000450915086	GD	On-Demand	Anodyne	PROKR1	50	30
COc1ccc2ncc(=O)n(CC(=O)NCc3ccc(OC)c(OC)c3)c2c1	ZINC000450915086	GD	On-Demand	Anodyne	ENPP1	51	32
COc1ccc2ncc(=O)n(CC(=O)NCc3ccc(OC)c(OC)c3)c2c1	ZINC000450915086	GD	On-Demand	Anodyne	DRTS_TRYCR	48	33
C=C(CC)CN=c1ccc(S(=O)(=O)NCC2CC2)c[nH]1	ZINC000450915101	CD	On-Demand	Mild	NPY1R	42	36
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915102	GI	On-Demand	Anodyne	NQO2	36	43
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915102	GI	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915102	GI	On-Demand	Anodyne	NPY2R	41	36
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915102	GI	On-Demand	Anodyne	HTR6	42	39
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915102	GI	On-Demand	Anodyne	MTNR1A	49	45
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915102	GI	On-Demand	Anodyne	MTNR1B	50	40
COc1ccc2c(c1)CCC[C@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915102	GI	On-Demand	Anodyne	EBP	20	44
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915103	GI	On-Demand	Anodyne	NQO2	36	43
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915103	GI	On-Demand	Anodyne	MTR1B_CHICK	0	53
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915103	GI	On-Demand	Anodyne	NPY2R	41	36
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915103	GI	On-Demand	Anodyne	HTR6	42	39
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915103	GI	On-Demand	Anodyne	MTNR1A	49	45
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915103	GI	On-Demand	Anodyne	MTNR1B	50	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450915103	GI	On-Demand	Anodyne	EBP	20	44
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450915104	CD	On-Demand	Mild	CA2	43	44
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450915104	CD	On-Demand	Mild	CA1	44	39
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000450915104	CD	On-Demand	Mild	CA4	41	39
Cc1csc(C(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)c1	ZINC000450915131	DE	On-Demand	Anodyne	OXTR	20	42
Cc1csc(C(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)c1	ZINC000450915132	DE	On-Demand	Anodyne	OXTR	20	42
CCN(Cc1cccc(S(C)(=O)=O)c1)c1ccccc1Cl	ZINC000450915135	DH	On-Demand	Anodyne	NR1H3	25	42
CCc1cc(O)nc(SCc2c(C)cccc2Cl)n1	ZINC000450915136	CH	On-Demand	Anodyne	CXCR2	15	44
CCc1cc(CCCN2CCOC[C@H]2c2nc(-c3cccs3)no2)on1	ZINC000450915137	FG	On-Demand	Anodyne	ETHR	31	41
CCc1cc(CCCN2CCOC[C@@H]2c2nc(-c3cccs3)no2)on1	ZINC000450915138	FG	On-Demand	Anodyne	ETHR	31	41
CCn1nnc(C)c1COc1ccc(C#N)c(Cl)c1	ZINC000450915145	CF	On-Demand	Mild	CYP2C19	27	41
Cc1nnc(S[C@H](C)C(=O)Nc2nccs2)n1C(C)C	ZINC000450915158	DF	On-Demand	Anodyne	MAP1	99	39
Cc1nnc(S[C@@H](C)C(=O)Nc2nccs2)n1C(C)C	ZINC000450915159	DF	On-Demand	Anodyne	MAP1	99	39
COc1ccc(CNC(=O)CCN(C)Cc2cnc(C(C)C)nc2)c(OC)c1	ZINC000450915186	GF	On-Demand	Anodyne	PDGFRB	39	40
COc1ccc(CNC(=O)CCN(C)Cc2cnc(C(C)C)nc2)c(OC)c1	ZINC000450915186	GF	On-Demand	Anodyne	MTNR1A	46	38
COc1ccc(CNC(=O)CCN(C)Cc2cnc(C(C)C)nc2)c(OC)c1	ZINC000450915186	GF	On-Demand	Anodyne	CSF1R	15	40
COc1cc(CN2CC[C@H](OC)C[C@@H]2C)ccc1Cl	ZINC000450915198	CG	On-Demand	Anodyne	UTS2R	16	41
COc1cc(CN2CC[C@@H](OC)C[C@H]2C)ccc1Cl	ZINC000450915199	CG	On-Demand	Anodyne	UTS2R	16	41
COc1cc(CN2CC[C@@H](OC)C[C@@H]2C)ccc1Cl	ZINC000450915200	CG	On-Demand	Anodyne	UTS2R	16	41
COc1cc(CN2CC[C@H](OC)C[C@H]2C)ccc1Cl	ZINC000450915201	CG	On-Demand	Anodyne	UTS2R	16	41
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	ZINC000450915209	GH	On-Demand	Bother	PPARD	15	43
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	ZINC000450915209	GH	On-Demand	Bother	PTGDR2	18	47
C/C=C/C[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OCC	ZINC000450915210	FE	On-Demand	Anodyne	PDEC	0	42
C/C=C\C[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)C(=O)OCC	ZINC000450915211	FE	On-Demand	Anodyne	PDEC	0	42
C/C=C/C[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OCC	ZINC000450915212	FE	On-Demand	Anodyne	PDE4D	15	42
C/C=C\C[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)C(=O)OCC	ZINC000450915213	FE	On-Demand	Anodyne	PDEC	0	42
C/C=C/C[C@H](NC(=O)CNS(=O)(=O)NC)C(=O)OCC	ZINC000450915228	DB	On-Demand	Anodyne	NOD1	43	36
C/C=C/C[C@@H](NC(=O)CNS(=O)(=O)NC)C(=O)OCC	ZINC000450915229	DB	On-Demand	Anodyne	NOD1	43	36
C/C=C\C[C@H](NC(=O)CNS(=O)(=O)NC)C(=O)OCC	ZINC000450915230	DB	On-Demand	Anodyne	NOD1	43	36
C/C=C\C[C@@H](NC(=O)CNS(=O)(=O)NC)C(=O)OCC	ZINC000450915231	DB	On-Demand	Anodyne	NOD1	43	36
CCn1c(S[C@H](C)C(=O)Nc2nccs2)nc2ccc(F)cc2c1=O	ZINC000450915253	GG	On-Demand	Anodyne	MAP1	79	39
CCn1c(S[C@@H](C)C(=O)Nc2nccs2)nc2ccc(F)cc2c1=O	ZINC000450915254	GG	On-Demand	Anodyne	MAP1	79	39
N#Cc1ccc(NCc2cnc(C3CC3)o2)cc1C(F)(F)F	ZINC000450915271	DI	On-Demand	Mild	AR	42	38
CC(=O)[C@@](C)(O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450915272	DD	On-Demand	Anodyne	CYP2J2	48	36
CC(=O)[C@](C)(O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450915273	DD	On-Demand	Anodyne	CYP2J2	48	36
CC(=O)[C@](C)(O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450915274	DD	On-Demand	Anodyne	CYP2J2	48	36
CC(=O)[C@@](C)(O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450915275	DD	On-Demand	Anodyne	CYP2J2	48	36
C/C=C\C[C@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OCC	ZINC000450915284	DD	On-Demand	Anodyne	P2RY12	52	39
C/C=C\C[C@@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OCC	ZINC000450915287	DD	On-Demand	Anodyne	P2RY12	52	39
C/C=C/C[C@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OCC	ZINC000450915289	DD	On-Demand	Anodyne	P2RY12	52	39
C/C=C/C[C@@H](NC(=O)c1cc2n(n1)CCCC2)C(=O)OCC	ZINC000450915290	DD	On-Demand	Anodyne	P2RY12	52	39
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450915291	FG	On-Demand	Anodyne	CCR5	31	40
CO[C@@H](Cc1ccccc1)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450915292	FG	On-Demand	Anodyne	CCR5	31	40
CO[C@H](Cc1ccccc1)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450915293	FG	On-Demand	Anodyne	CCR5	31	40
Oc1nnc(C2CCN([C@@H]3CCCC[C@H]3O)CC2)o1	ZINC000450915295	CD	On-Demand	Anodyne	VACHT_TETCF	0	49
Oc1nnc(C2CCN([C@@H]3CCCC[C@H]3O)CC2)o1	ZINC000450915295	CD	On-Demand	Anodyne	SLC18A3	28	49
CO[C@H](Cc1ccccc1)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450915296	FG	On-Demand	Anodyne	CCR5	31	40
COC(=O)c1ccc([N+](=O)[O-])c(NCc2cnc(C3CC3)o2)n1	ZINC000450915301	DE	On-Demand	Bother	PRKCQ	46	36
CCCOc1cccc(Cn2cc(C(=O)OC)nc2C)c1	ZINC000450915309	CF	On-Demand	Anodyne	UPP1	51	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NC[C@H](O)C1CCC1	ZINC000450915311	GD	On-Demand	Bother	DDIT3	0	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NC[C@@H](O)C1CCC1	ZINC000450915313	GD	On-Demand	Bother	DDIT3	0	41
Oc1nnc(C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)o1	ZINC000450915314	FG	On-Demand	Anodyne	ESR1	61	36
Oc1nnc(C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)o1	ZINC000450915314	FG	On-Demand	Anodyne	LTA4H	47	43
Oc1nnc(C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)o1	ZINC000450915314	FG	On-Demand	Anodyne	HRH3	21	46
Oc1nnc(C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)o1	ZINC000450915314	FG	On-Demand	Anodyne	SLC6A5	31	40
Oc1nnc(C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)o1	ZINC000450915314	FG	On-Demand	Anodyne	PSMB2	46	35
Oc1nnc(C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)o1	ZINC000450915314	FG	On-Demand	Anodyne	PSMB5	15	40
Oc1nnc(C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)o1	ZINC000450915314	FG	On-Demand	Anodyne	PSMB1	41	40
Oc1nnc(C2CCN(CCOc3ccc(C(F)(F)F)cc3)CC2)o1	ZINC000450915314	FG	On-Demand	Anodyne	MEN1	48	34
CN(C)S(=O)(=O)c1ccc(NCC(C)(C)C2(O)CCCC2)c([N+](=O)[O-])c1	ZINC000450915316	GF	On-Demand	Bother	BCL2L1	65	34
CN(C)S(=O)(=O)c1ccc(NCC(C)(C)C2(O)CCCC2)c([N+](=O)[O-])c1	ZINC000450915316	GF	On-Demand	Bother	BCL2	54	32
Cc1ccc(Nc2nc(CN3CCC(c4nnc(O)o4)CC3)cs2)cc1	ZINC000450915334	FH	On-Demand	Anodyne	SPHK2	44	32
Cc1ccc(Nc2nc(CN3CCC(c4nnc(O)o4)CC3)cs2)cc1	ZINC000450915334	FH	On-Demand	Anodyne	SPHK1	48	39
Cc1ccc(Nc2nc(CN3CCC(c4nnc(O)o4)CC3)cs2)cc1	ZINC000450915334	FH	On-Demand	Anodyne	TRPC6	51	42
Cc1ccc(Nc2nc(CN3CCC(c4nnc(O)o4)CC3)cs2)cc1	ZINC000450915334	FH	On-Demand	Anodyne	TRPC3	47	42
CC(F)(F)CCS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450915335	DH	On-Demand	Anodyne	CACNA1B	50	37
CC(C)(CC(=O)CS(=O)(=O)c1ccccc1C(F)(F)F)C1CC1	ZINC000450915345	EH	On-Demand	Anodyne	SFRP1	50	33
CC(C)(CNc1ncc([N+](=O)[O-])s1)C1(O)CCCC1	ZINC000450915346	CF	On-Demand	Bother	MAPK9	15	41
CC(C)(C)c1cc(CS(=O)(=O)c2cccc(C(F)(F)F)c2)no1	ZINC000450915364	EH	On-Demand	Anodyne	CACNA1B	47	34
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450915367	FD	On-Demand	Bother	TAAR1	17	42
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000450915368	FD	On-Demand	Bother	TAAR1	17	42
COC(=O)c1ccc(C(F)(F)F)nc1SC[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000450915387	GE	On-Demand	Anodyne	TRPV1	64	40
COC(=O)c1ccc(C(F)(F)F)nc1SC[C@H]1CCN(S(C)(=O)=O)C1	ZINC000450915388	GE	On-Demand	Anodyne	TRPV1	64	40
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@@H](O)C1CCC1	ZINC000450915403	GF	On-Demand	Bother	MTNN	50	35
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@@H](O)C1CCC1	ZINC000450915403	GF	On-Demand	Bother	BCL2L1	48	35
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@@H](O)C1CCC1	ZINC000450915403	GF	On-Demand	Bother	BCL2	41	37
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@@H](O)C1CCC1	ZINC000450915403	GF	On-Demand	Bother	SFRP1	41	31
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@@H](O)C1CCC1	ZINC000450915403	GF	On-Demand	Bother	WNT3	48	31
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@H](O)C1CCC1	ZINC000450915404	GF	On-Demand	Bother	MTNN	50	35
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@H](O)C1CCC1	ZINC000450915404	GF	On-Demand	Bother	BCL2L1	48	35
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@H](O)C1CCC1	ZINC000450915404	GF	On-Demand	Bother	BCL2	41	37
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@H](O)C1CCC1	ZINC000450915404	GF	On-Demand	Bother	SFRP1	41	31
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NC[C@H](O)C1CCC1	ZINC000450915404	GF	On-Demand	Bother	WNT3	48	31
COc1cc(CN(C)CCCO)ccc1Cl	ZINC000450915413	BE	On-Demand	Anodyne	CACNA1C	0	40
CC(=O)CCCCCOc1ccc2c(c1)CCC2=O	ZINC000450915414	CG	On-Demand	Anodyne	THRA	41	46
CC(=O)CCCCCOc1ccc2c(c1)CCC2=O	ZINC000450915414	CG	On-Demand	Anodyne	ACHE	0	43
CC(=O)CCCCCOc1ccc2c(c1)CCC2=O	ZINC000450915414	CG	On-Demand	Anodyne	P2RY12	41	44
CC(=O)CCCCCOc1ccc2c(c1)CCC2=O	ZINC000450915414	CG	On-Demand	Anodyne	THRB	27	46
CC(=O)CCCCCOc1ccc2c(c1)CCC2=O	ZINC000450915414	CG	On-Demand	Anodyne	PLA2G4B	61	34
CCCc1cc(NCc2ccc(C#N)c(F)c2)n2ncnc2n1	ZINC000450915417	DF	On-Demand	Mild	DHOD	0	46
COc1cc(CC(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)ccc1Cl	ZINC000450915460	FE	On-Demand	Anodyne	OXTR	16	42
COc1cc(CC(=O)N(CC2CC2)C[C@@H]2CN(C)CCO2)ccc1Cl	ZINC000450915460	FE	On-Demand	Anodyne	OPRK1	34	41
COc1cc(CC(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)ccc1Cl	ZINC000450915461	FE	On-Demand	Anodyne	OXTR	16	42
COc1cc(CC(=O)N(CC2CC2)C[C@H]2CN(C)CCO2)ccc1Cl	ZINC000450915461	FE	On-Demand	Anodyne	OPRK1	34	41
O=C(CC[C@@H]1CCCCO1)Cn1nnc(COc2ccccc2)n1	ZINC000450915465	EE	On-Demand	Anodyne	CPT1A	98	36
O=C(CC[C@@H]1CCCCO1)Cn1nnc(COc2ccccc2)n1	ZINC000450915465	EE	On-Demand	Anodyne	SCARB1	40	36
O=C(CC[C@H]1CCCCO1)Cn1nnc(COc2ccccc2)n1	ZINC000450915466	EE	On-Demand	Anodyne	CPT1A	98	36
O=C(CC[C@H]1CCCCO1)Cn1nnc(COc2ccccc2)n1	ZINC000450915466	EE	On-Demand	Anodyne	SCARB1	40	36
COCCOc1ccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450915476	GD	On-Demand	Anodyne	AVPR1B	43	38
COCCOc1ccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450915476	GD	On-Demand	Anodyne	PROKR1	62	30
COc1ccc2ncc(=O)n(CC(=O)NC3CCN(C4CC4)CC3)c2c1	ZINC000450915480	FD	On-Demand	Anodyne	AVPR1B	36	43
COc1ccc2ncc(=O)n(CC(=O)NCCc3c(C)cc(C)cc3C)c2c1	ZINC000450915481	GF	On-Demand	Anodyne	MTNR1A	75	43
COc1ccc2ncc(=O)n(CC(=O)NCCc3c(C)cc(C)cc3C)c2c1	ZINC000450915481	GF	On-Demand	Anodyne	MTNR1B	66	43
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc(S(C)(=O)=O)cc1	ZINC000450915483	EH	On-Demand	Anodyne	PTGS2	46	44
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc(S(C)(=O)=O)cc1	ZINC000450915484	EH	On-Demand	Anodyne	PTGS2	46	44
CC(C)OC(=O)C[C@@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450915489	EE	On-Demand	Anodyne	GPR119	15	44
CC(C)OC(=O)C[C@H]1CCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450915490	EE	On-Demand	Anodyne	GPR119	15	44
COc1ccc2ncc(=O)n(CC(=O)NCCOc3ccc4c(c3)OCO4)c2c1	ZINC000450915495	GD	On-Demand	Anodyne	AVPR1B	40	40
COc1ccc2ncc(=O)n(CC(=O)NCCOc3ccc4c(c3)OCO4)c2c1	ZINC000450915495	GD	On-Demand	Anodyne	EDNRB	72	41
COc1ccc2ncc(=O)n(CC(=O)NCCOc3ccc4c(c3)OCO4)c2c1	ZINC000450915495	GD	On-Demand	Anodyne	EDNRA	70	44
COc1ccc2ncc(=O)n(CC(=O)NCCOc3ccc4c(c3)OCO4)c2c1	ZINC000450915495	GD	On-Demand	Anodyne	BMP1	54	37
CCC[C@H](OC)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450915496	EG	On-Demand	Anodyne	AMY2	45	32
CCC[C@@H](OC)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450915497	EG	On-Demand	Anodyne	AMY2	45	32
C=C(CC)CNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450915498	EF	On-Demand	Mild	TBXA2R	28	41
COc1ccc2ncc(=O)n(CC(=O)NCCCOC3CCCCC3)c2c1	ZINC000450915502	FE	On-Demand	Anodyne	AVPR1B	60	41
COc1ccc2ncc(=O)n(CC(=O)NCCCOC3CCCCC3)c2c1	ZINC000450915502	FE	On-Demand	Anodyne	NQO2	34	40
C[C@@H](O)CCOc1ccc(I)cc1[N+](=O)[O-]	ZINC000450915506	EE	On-Demand	Bother	S1PR4	17	42
C[C@H](O)CCOc1ccc(I)cc1[N+](=O)[O-]	ZINC000450915507	EE	On-Demand	Bother	S1PR4	17	42
CCCOCc1ccccc1CNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450915526	GF	On-Demand	Anodyne	MTNR1A	53	38
O=C(NCCO)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nn1	ZINC000450915531	ED	On-Demand	Anodyne	SCD1	44	47
O=C(NCCO)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nn1	ZINC000450915531	ED	On-Demand	Anodyne	SCD	35	44
O=C(NCCO)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nn1	ZINC000450915532	ED	On-Demand	Anodyne	SCD1	44	47
O=C(NCCO)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nn1	ZINC000450915532	ED	On-Demand	Anodyne	SCD	35	44
COc1ccc2ncc(=O)n(CC(=O)N(C(C)C)C3CCCC3)c2c1	ZINC000450915533	EF	On-Demand	Anodyne	SCARB1	54	43
COc1cccc(NCc2cnc(C3CC3)o2)c1[N+](=O)[O-]	ZINC000450915562	CG	On-Demand	Bother	PRKCQ	24	40
C/C=C\C[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OCC	ZINC000450915564	DF	On-Demand	Anodyne	AKT1	0	42
C/C=C/C[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OCC	ZINC000450915565	DF	On-Demand	Anodyne	AKT1	0	42
C/C=C\C[C@@H](NC(=O)c1ccc2cnccc2c1)C(=O)OCC	ZINC000450915566	DF	On-Demand	Anodyne	AKT1	0	42
C/C=C/C[C@H](NC(=O)c1ccc2cnccc2c1)C(=O)OCC	ZINC000450915567	DF	On-Demand	Anodyne	AKT1	0	42
CC(=O)CCCCCOc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450915576	DI	On-Demand	Bother	THRA	0	47
CC(=O)CCCCCOc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450915576	DI	On-Demand	Bother	PPARD	23	42
CC(=O)CCCCCOc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000450915576	DI	On-Demand	Bother	PPXII	0	41
C/C=C\C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OCC	ZINC000450915577	CD	On-Demand	Anodyne	METAP2	22	44
C/C=C\C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OCC	ZINC000450915578	CD	On-Demand	Anodyne	METAP2	22	44
C/C=C/C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OCC	ZINC000450915579	CD	On-Demand	Anodyne	METAP2	22	44
C/C=C/C[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OCC	ZINC000450915580	CD	On-Demand	Anodyne	METAP2	22	44
CC1=CCCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450915591	BG	On-Demand	Anodyne	CHRNA6	0	46
CC1=CCCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450915592	BG	On-Demand	Anodyne	CHRNA6	0	46
CCS(=O)(=O)c1ccc(CN[C@H](CC(=O)NC)c2ccccc2)cc1	ZINC000450915593	FE	On-Demand	Anodyne	RORC	56	40
CCS(=O)(=O)c1ccc(CN[C@@H](CC(=O)NC)c2ccccc2)cc1	ZINC000450915594	FE	On-Demand	Anodyne	RORC	56	40
CCCn1c(C)nnc1SCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450915602	GF	On-Demand	Anodyne	MTNR1A	41	38
CCCC[C@@H](NC(=O)c1scnc1C(C)C)C(=O)OC(C)(C)C	ZINC000450915603	EH	On-Demand	Anodyne	CTSK	32	42
CCCC[C@H](NC(=O)c1scnc1C(C)C)C(=O)OC(C)(C)C	ZINC000450915604	EH	On-Demand	Anodyne	CTSK	32	42
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@]2(CCO[C@H](C)C2)O1	ZINC000450915619	EG	On-Demand	Anodyne	CYP2J2	55	39
C[C@@H]1C[C@@]2(CCO1)CN(CCCC(=O)c1ccccc1)C[C@@H](C)O2	ZINC000450915620	EG	On-Demand	Anodyne	CYP2J2	55	39
C[C@@H]1C[C@]2(CCO1)CN(CCCC(=O)c1ccccc1)C[C@@H](C)O2	ZINC000450915621	EG	On-Demand	Anodyne	CYP2J2	55	39
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@]2(CCO[C@H](C)C2)O1	ZINC000450915622	EG	On-Demand	Anodyne	CYP2J2	55	39
C/C=C\C[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OCC	ZINC000450915659	FF	On-Demand	Mild	CCR3	0	43
C/C=C\C[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OCC	ZINC000450915660	FF	On-Demand	Mild	CCR3	0	43
C/C=C/C[C@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OCC	ZINC000450915661	FF	On-Demand	Mild	CCR3	0	43
C/C=C/C[C@@H](NC(=O)c1cccc(C#N)c1Br)C(=O)OCC	ZINC000450915662	FF	On-Demand	Mild	CCR3	0	43
Cc1ccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1F	ZINC000450915675	EE	On-Demand	Anodyne	DRD4	23	49
O=[S@](CCN1CCC(c2nnc(O)o2)CC1)c1ccccc1	ZINC000450915680	DD	On-Demand	Anodyne	CYP2J2	43	30
O=[S@@](CCN1CCC(c2nnc(O)o2)CC1)c1ccccc1	ZINC000450915681	DD	On-Demand	Anodyne	CYP2J2	43	30
CCN(CC)S(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450915683	FE	On-Demand	Bother	BDKRB1	26	52
CCN(CC)S(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450915683	FE	On-Demand	Bother	COLA	40	33
CCN(CC)S(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450915684	FE	On-Demand	Bother	BDKRB1	26	52
CCN(CC)S(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450915684	FE	On-Demand	Bother	COLA	40	33
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H]1CCCc2ccccc21	ZINC000450915701	FE	On-Demand	Anodyne	BDKRB1	53	39
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H]1CCCc2ccccc21	ZINC000450915702	FE	On-Demand	Anodyne	BDKRB1	53	39
Cc1oc(-c2ccsc2)nc1CN1CCC(c2nnc(O)o2)CC1	ZINC000450915703	EG	On-Demand	Anodyne	PDE8B	59	35
Oc1nnc(C2CCN(CCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450915706	FG	On-Demand	Anodyne	HRH3	39	43
Oc1nnc(C2CCN(CCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450915706	FG	On-Demand	Anodyne	EPHX2	15	49
Oc1nnc(C2CCN(CCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450915706	FG	On-Demand	Anodyne	GALR3	24	40
Oc1nnc(C2CCN(CCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450915706	FG	On-Demand	Anodyne	MEN1	54	39
O=C(c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450915711	ED	On-Demand	Bother	L3MBTL3	27	43
O=C(c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450915712	ED	On-Demand	Bother	L3MBTL3	27	43
Cc1cccc(Cl)c1C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	ZINC000450915723	GJ	On-Demand	Anodyne	ITGA4	45	32
Cc1cccc(Cl)c1C(=O)Nc1ccc(Cc2nnc3n2CCCCC3)cc1	ZINC000450915723	GJ	On-Demand	Anodyne	TYK2	44	34
Cc1ccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)c(F)c1	ZINC000450915728	EE	On-Demand	Anodyne	DRD4	23	48
C[C@H](C(=O)NCCc1ccccc1)N1CCC(c2nnc(O)o2)CC1	ZINC000450915729	ED	On-Demand	Anodyne	AMP1_PLAFQ	34	41
C[C@@H](C(=O)NCCc1ccccc1)N1CCC(c2nnc(O)o2)CC1	ZINC000450915730	ED	On-Demand	Anodyne	AMP1_PLAFQ	34	41
CCn1c(SCC(=O)CC[C@@H]2CCCCO2)nc2ccc(F)cc2c1=O	ZINC000450915769	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	44	35
CCn1c(SCC(=O)CC[C@H]2CCCCO2)nc2ccc(F)cc2c1=O	ZINC000450915770	GH	On-Demand	Anodyne	Q8MHZ5_SHEEP	44	35
C/C=C\C[C@H](NC(=O)CO)C(=O)OCC	ZINC000450915775	BB	On-Demand	Anodyne	NOD1	66	38
C/C=C\C[C@@H](NC(=O)CO)C(=O)OCC	ZINC000450915780	BB	On-Demand	Anodyne	NOD1	66	38
C/C=C/C[C@@H](NC(=O)CO)C(=O)OCC	ZINC000450915782	BB	On-Demand	Anodyne	NOD1	66	38
C/C=C/C[C@H](NC(=O)CO)C(=O)OCC	ZINC000450915783	BB	On-Demand	Anodyne	NOD1	66	38
CC(C)c1nccc(N2CCC[C@H]2c2ccc(F)cc2F)n1	ZINC000450915803	DI	On-Demand	Anodyne	SORD	80	35
CC(C)c1nccc(N2CCC[C@@H]2c2ccc(F)cc2F)n1	ZINC000450915804	DI	On-Demand	Anodyne	SORD	80	35
CN(C(=O)[C@H]1CCN(Cc2ccn(CC(F)(F)F)n2)C1)c1ccccc1	ZINC000450915818	FF	On-Demand	Anodyne	MLNR	22	43
CN(C(=O)[C@@H]1CCN(Cc2ccn(CC(F)(F)F)n2)C1)c1ccccc1	ZINC000450915819	FF	On-Demand	Anodyne	MLNR	22	43
CC1=C[C@H](C)CN(CCCC(=O)c2ccccc2)C1	ZINC000450915823	CH	On-Demand	Anodyne	DRD2	28	40
CC1=C[C@H](C)CN(CCCC(=O)c2ccccc2)C1	ZINC000450915823	CH	On-Demand	Anodyne	SLC6A1	43	33
CC1=C[C@H](C)CN(CCCC(=O)c2ccccc2)C1	ZINC000450915823	CH	On-Demand	Anodyne	CYP2J2	61	46
CC1=C[C@@H](C)CN(CCCC(=O)c2ccccc2)C1	ZINC000450915824	CH	On-Demand	Anodyne	DRD2	28	40
CC1=C[C@@H](C)CN(CCCC(=O)c2ccccc2)C1	ZINC000450915824	CH	On-Demand	Anodyne	HTR2A	17	49
CC1=C[C@@H](C)CN(CCCC(=O)c2ccccc2)C1	ZINC000450915824	CH	On-Demand	Anodyne	SLC6A1	57	33
CC1=C[C@@H](C)CN(CCCC(=O)c2ccccc2)C1	ZINC000450915824	CH	On-Demand	Anodyne	CYP2J2	61	46
Fc1ccc([C@@H]2CCCN2c2ncnc3[nH]ccc23)c(F)c1	ZINC000450915828	DH	On-Demand	Anodyne	AKT2	29	40
Fc1ccc([C@@H]2CCCN2c2ncnc3[nH]ccc23)c(F)c1	ZINC000450915828	DH	On-Demand	Anodyne	AKT1	30	45
Fc1ccc([C@H]2CCCN2c2ncnc3[nH]ccc23)c(F)c1	ZINC000450915829	DH	On-Demand	Anodyne	AKT2	46	47
Fc1ccc([C@H]2CCCN2c2ncnc3[nH]ccc23)c(F)c1	ZINC000450915829	DH	On-Demand	Anodyne	AKT1	30	45
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H](c3ccccc3)C(C)C)c2c1	ZINC000450915830	GF	On-Demand	Anodyne	AVPR1B	43	38
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H](c3ccccc3)C(C)C)c2c1	ZINC000450915830	GF	On-Demand	Anodyne	MTNR1A	36	40
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H](c3ccccc3)C(C)C)c2c1	ZINC000450915830	GF	On-Demand	Anodyne	MTNR1B	34	40
COc1ccc2ncc(=O)n(CC(=O)NC[C@H](c3ccccc3)C(C)C)c2c1	ZINC000450915831	GF	On-Demand	Anodyne	AVPR1B	43	38
COc1ccc2ncc(=O)n(CC(=O)NC[C@H](c3ccccc3)C(C)C)c2c1	ZINC000450915831	GF	On-Demand	Anodyne	MTNR1A	36	40
COc1ccc2ncc(=O)n(CC(=O)NC[C@H](c3ccccc3)C(C)C)c2c1	ZINC000450915831	GF	On-Demand	Anodyne	MTNR1B	34	40
CN(C(=O)[C@H]1CCN(C[C@@H]2CCC(F)(F)C2)C1)c1ccccc1	ZINC000450915897	DG	On-Demand	Anodyne	CHRM3	17	41
CN(C(=O)[C@H]1CCN(C[C@@H]2CCC(F)(F)C2)C1)c1ccccc1	ZINC000450915897	DG	On-Demand	Anodyne	TACR3	58	31
CN(C(=O)[C@H]1CCN(C[C@H]2CCC(F)(F)C2)C1)c1ccccc1	ZINC000450915898	DG	On-Demand	Anodyne	CHRM3	17	41
CN(C(=O)[C@H]1CCN(C[C@H]2CCC(F)(F)C2)C1)c1ccccc1	ZINC000450915898	DG	On-Demand	Anodyne	TACR3	58	31
CN(C(=O)[C@@H]1CCN(C[C@@H]2CCC(F)(F)C2)C1)c1ccccc1	ZINC000450915899	DG	On-Demand	Anodyne	CHRM3	17	41
CN(C(=O)[C@@H]1CCN(C[C@@H]2CCC(F)(F)C2)C1)c1ccccc1	ZINC000450915899	DG	On-Demand	Anodyne	TACR3	58	31
CN(C(=O)[C@@H]1CCN(C[C@H]2CCC(F)(F)C2)C1)c1ccccc1	ZINC000450915900	DG	On-Demand	Anodyne	CHRM3	17	41
CN(C(=O)[C@@H]1CCN(C[C@H]2CCC(F)(F)C2)C1)c1ccccc1	ZINC000450915900	DG	On-Demand	Anodyne	TACR3	58	31
c1ccc(CCN(Cc2cccnc2)Cc2nnc(C3CC3)s2)nc1	ZINC000450915903	FG	On-Demand	Anodyne	NR1D1	41	33
CCCCNC(=O)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450915910	ED	On-Demand	Anodyne	MTNR1A	49	41
CCCCNC(=O)NC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450915910	ED	On-Demand	Anodyne	MTNR1B	36	41
COc1ccc2ncc(=O)n(Cc3cccc(C(=O)NCC(C)C)c3)c2c1	ZINC000450915914	FF	On-Demand	Anodyne	DRD4	44	33
COc1ccc2ncc(=O)n(CC(=O)NC34CC5CC(CC(C5)C3)C4)c2c1	ZINC000450915915	FE	On-Demand	Anodyne	CNR2	28	43
COc1ccc2ncc(=O)n(CC(=O)NC34CC5CC(CC(C5)C3)C4)c2c1	ZINC000450915915	FE	On-Demand	Anodyne	EPHX2	73	45
COc1ccc2ncc(=O)n(CC(=O)NC34CC5CC(CC(C5)C3)C4)c2c1	ZINC000450915915	FE	On-Demand	Anodyne	SRTA	0	41
CCCOc1cccc(CSc2n[nH]c(O)n2)c1	ZINC000450915924	CF	On-Demand	Anodyne	METAP2	0	43
C=C(CC)CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450915928	DG	On-Demand	Mild	AVPR2	79	41
C=C(CC)CNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450915928	DG	On-Demand	Mild	AVPR1A	51	43
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450915938	FG	On-Demand	Anodyne	TACR1	31	42
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450915938	FG	On-Demand	Anodyne	CCR5	24	41
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450915940	FG	On-Demand	Anodyne	TACR1	31	42
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450915940	FG	On-Demand	Anodyne	CCR5	24	41
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450915942	FG	On-Demand	Anodyne	TACR1	31	42
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450915942	FG	On-Demand	Anodyne	CCR5	24	41
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450915944	FG	On-Demand	Anodyne	TACR1	31	42
CN(Cc1ncccn1)[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450915944	FG	On-Demand	Anodyne	CCR5	24	41
N#CC1(CS(=O)(=O)c2cccc(C(F)(F)F)c2)CCC1	ZINC000450915965	DG	On-Demand	Mild	CACNA1B	46	35
COC(=O)c1ccc(OCCN2CCC(c3nnc(O)o3)CC2)c(Cl)c1	ZINC000450915966	GE	On-Demand	Anodyne	HTR4	52	38
COC(=O)c1ccc(OCCN2CCC(c3nnc(O)o3)CC2)c(Cl)c1	ZINC000450915966	GE	On-Demand	Anodyne	UTS2R	16	41
Oc1nnc(C2CCN(CCOCCOc3ccccc3)CC2)o1	ZINC000450915969	EE	On-Demand	Anodyne	LTA4H	48	41
Oc1nnc(C2CCN(CCOCCOc3ccccc3)CC2)o1	ZINC000450915969	EE	On-Demand	Anodyne	HRH3	32	47
Oc1nnc(C2CCN(CCOCCOc3ccccc3)CC2)o1	ZINC000450915969	EE	On-Demand	Anodyne	NPY1R	40	32
Oc1nnc(C2CCN(CCOCCOc3ccccc3)CC2)o1	ZINC000450915969	EE	On-Demand	Anodyne	GRIN3A	0	44
Oc1nnc(C2CCN(CCOCCOc3ccccc3)CC2)o1	ZINC000450915969	EE	On-Demand	Anodyne	PSMB2	45	34
Oc1nnc(C2CCN(CCOCCOc3ccccc3)CC2)o1	ZINC000450915969	EE	On-Demand	Anodyne	MEN1	48	35
COc1nccc(CSCc2ccc(OC)c(Cl)c2)n1	ZINC000450915970	DH	On-Demand	Anodyne	PDE5A	29	40
C[C@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccc(Cl)c(Cl)c1	ZINC000450915978	GG	On-Demand	Anodyne	PRCP	34	42
C[C@@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccc(Cl)c(Cl)c1	ZINC000450915979	GG	On-Demand	Anodyne	PRCP	34	42
CNC(=O)c1ccc(NCC(C)(C)C2(O)CCCC2)c([N+](=O)[O-])c1	ZINC000450915981	EF	On-Demand	Bother	TAAR1	16	41
CC(C)c1ccccc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450915982	EF	On-Demand	Anodyne	DRD4	25	44
CC(C)c1ccccc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450915982	EF	On-Demand	Anodyne	SMO	37	46
CC(C)c1cccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450915989	EF	On-Demand	Anodyne	DRD4	22	51
COc1cc(Cn2nc(C)sc2=O)ccc1Cl	ZINC000450915996	CE	On-Demand	Anodyne	NPBWR1	32	43
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CCCC1	ZINC000450916008	GF	On-Demand	Anodyne	KCNA3	41	35
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CCCC1	ZINC000450916008	GF	On-Demand	Anodyne	SMO	26	49
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CCCC1	ZINC000450916008	GF	On-Demand	Anodyne	ACAT	0	42
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CCCC1	ZINC000450916008	GF	On-Demand	Anodyne	NPFFR1	32	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NCC(C)(C)C1(O)CCCC1	ZINC000450916010	FD	On-Demand	Anodyne	CA2	39	49
Cc1nn(C)cc1CS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000450916011	DF	On-Demand	Anodyne	CACNA1B	46	36
CS(=O)(=O)c1ccc(OCCN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916030	FD	On-Demand	Anodyne	ESR1	56	41
CS(=O)(=O)c1ccc(OCCN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916030	FD	On-Demand	Anodyne	ESR2	37	42
CS(=O)(=O)c1ccc(OCCN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916030	FD	On-Demand	Anodyne	LTA4H	45	38
CS(=O)(=O)c1ccc(OCCN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916030	FD	On-Demand	Anodyne	PSMB2	46	34
CS(=O)(=O)c1ccc(OCCN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916030	FD	On-Demand	Anodyne	PSMB1	40	34
Oc1nnc(C2CCN(CCCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450916032	GH	On-Demand	Anodyne	DRD2	21	43
Oc1nnc(C2CCN(CCCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450916032	GH	On-Demand	Anodyne	HTR2A	18	43
Oc1nnc(C2CCN(CCCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450916032	GH	On-Demand	Anodyne	HRH3	30	51
Oc1nnc(C2CCN(CCCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450916032	GH	On-Demand	Anodyne	EPHX2	19	48
Oc1nnc(C2CCN(CCCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450916032	GH	On-Demand	Anodyne	CHRNA10	27	48
Oc1nnc(C2CCN(CCCCOc3cccc(C(F)(F)F)c3)CC2)o1	ZINC000450916032	GH	On-Demand	Anodyne	MEN1	51	39
C=C(CC)CNc1cc(CCC)nc2ncnn12	ZINC000450916060	BE	On-Demand	Mild	DHOD	0	46
C=C(CC)CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450916064	DE	On-Demand	Mild	TGM2	35	43
C=C(CC)CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450916064	DE	On-Demand	Mild	NAMPT	27	40
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](O)C1CCC1	ZINC000450916074	DE	On-Demand	Anodyne	NQO2	41	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](O)C1CCC1	ZINC000450916074	DE	On-Demand	Anodyne	MTR1B_CHICK	0	58
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](O)C1CCC1	ZINC000450916074	DE	On-Demand	Anodyne	HTR6	44	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](O)C1CCC1	ZINC000450916074	DE	On-Demand	Anodyne	PPARD	39	42
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](O)C1CCC1	ZINC000450916075	DE	On-Demand	Anodyne	NQO2	41	46
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](O)C1CCC1	ZINC000450916075	DE	On-Demand	Anodyne	MTR1B_CHICK	0	58
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](O)C1CCC1	ZINC000450916075	DE	On-Demand	Anodyne	HTR6	44	41
COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@H](O)C1CCC1	ZINC000450916075	DE	On-Demand	Anodyne	PPARD	39	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](O)C1CCC1	ZINC000450916076	DE	On-Demand	Anodyne	NQO2	41	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](O)C1CCC1	ZINC000450916076	DE	On-Demand	Anodyne	MTR1B_CHICK	0	58
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](O)C1CCC1	ZINC000450916076	DE	On-Demand	Anodyne	HTR6	44	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@H](O)C1CCC1	ZINC000450916076	DE	On-Demand	Anodyne	PPARD	39	42
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](O)C1CCC1	ZINC000450916077	DE	On-Demand	Anodyne	NQO2	41	46
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](O)C1CCC1	ZINC000450916077	DE	On-Demand	Anodyne	MTR1B_CHICK	0	58
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](O)C1CCC1	ZINC000450916077	DE	On-Demand	Anodyne	HTR6	44	41
COc1ccc2c(c1)CCC[C@H]2CNC(=O)[C@@H](O)C1CCC1	ZINC000450916077	DE	On-Demand	Anodyne	PPARD	39	42
O=C(c1cnn2c1CCC2)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450916092	FF	On-Demand	Anodyne	COLA	49	34
O=C(c1cnn2c1CCC2)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450916092	FF	On-Demand	Anodyne	CPT1A	42	33
CN(C)C(=O)c1cnc(N2CCC[C@H]2c2ccc(F)cc2F)c(Cl)c1	ZINC000450916095	FI	On-Demand	Anodyne	PRCP	46	35
CN(C)C(=O)c1cnc(N2CCC[C@@H]2c2ccc(F)cc2F)c(Cl)c1	ZINC000450916096	FI	On-Demand	Anodyne	PRCP	46	35
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450916098	DF	On-Demand	Mild	CA2	53	40
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450916098	DF	On-Demand	Mild	CA1	46	41
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450916098	DF	On-Demand	Mild	CA7	42	38
C=C(CC)CNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000450916098	DF	On-Demand	Mild	CA4	44	40
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)Cc2ccc(O)c(F)c2)c1	ZINC000450916113	GD	On-Demand	Anodyne	CA4	17	42
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)Cc2ccc(O)c(F)c2)c1	ZINC000450916113	GD	On-Demand	Anodyne	CA5A	40	34
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)Cc2ccc(O)c(F)c2)c1	ZINC000450916113	GD	On-Demand	Anodyne	PFK	0	40
C=C(CC)CNc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1[N+](=O)[O-]	ZINC000450916118	GD	On-Demand	Mild	BCL2L1	49	35
COc1ccc2ncc(=O)n(CC(=O)NCC(C)(C)N3CCOCC3)c2c1	ZINC000450916127	FC	On-Demand	Anodyne	AVPR1B	30	40
CC(C)(C)OC(=O)c1cnc(N2CCC[C@H]2c2ccc(F)cc2F)cn1	ZINC000450916133	FI	On-Demand	Anodyne	PRCP	43	31
CC(C)(C)OC(=O)c1cnc(N2CCC[C@@H]2c2ccc(F)cc2F)cn1	ZINC000450916135	FI	On-Demand	Anodyne	PRCP	43	31
c1ccc(COc2cccnc2NCc2cnc(C3CC3)o2)cc1	ZINC000450916141	DI	On-Demand	Anodyne	PPIA	42	38
CCCC[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC(C)(C)C	ZINC000450916146	EF	On-Demand	Anodyne	SSTR2	47	33
CCCC[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC(C)(C)C	ZINC000450916146	EF	On-Demand	Anodyne	P2RY12	47	36
CCCC[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC(C)(C)C	ZINC000450916146	EF	On-Demand	Anodyne	HDAC1	27	43
CCCC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC(C)(C)C	ZINC000450916147	EF	On-Demand	Anodyne	SSTR2	47	33
CCCC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC(C)(C)C	ZINC000450916147	EF	On-Demand	Anodyne	P2RY12	47	36
CCCC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC(C)(C)C	ZINC000450916147	EF	On-Demand	Anodyne	HDAC1	27	43
COC(=O)c1cn(Cc2ccc(C(=O)OC)c(Cl)c2)c(C)n1	ZINC000450916157	DE	On-Demand	Anodyne	DNAE	47	31
COc1ccc2ncc(=O)n(CC(=O)N(C)[C@@H](C)c3ccccc3OC)c2c1	ZINC000450916172	GF	On-Demand	Anodyne	PLK1	31	40
COc1ccc2ncc(=O)n(CC(=O)N(C)[C@@H](C)c3ccccc3OC)c2c1	ZINC000450916172	GF	On-Demand	Anodyne	PLK3	26	40
COc1ccc2ncc(=O)n(CC(=O)N(C)[C@H](C)c3ccccc3OC)c2c1	ZINC000450916173	GF	On-Demand	Anodyne	PLK1	31	40
COc1ccc2ncc(=O)n(CC(=O)N(C)[C@H](C)c3ccccc3OC)c2c1	ZINC000450916173	GF	On-Demand	Anodyne	PLK3	26	40
CNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2C)nn1	ZINC000450916201	DF	On-Demand	Anodyne	SCD1	30	42
CNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2C)nn1	ZINC000450916203	DF	On-Demand	Anodyne	SCD1	30	42
CC1CCN(C(=O)c2ccc(N3CCC[C@H]3c3ccc(F)cc3F)nc2)CC1	ZINC000450916207	GJ	On-Demand	Anodyne	PRCP	46	33
CC1CCN(C(=O)c2ccc(N3CCC[C@@H]3c3ccc(F)cc3F)nc2)CC1	ZINC000450916208	GJ	On-Demand	Anodyne	PRCP	46	33
Cn1cc(CN(Cc2ccc(Cl)cc2)CC2CCC(=O)CC2)cn1	ZINC000450916215	EH	On-Demand	Anodyne	NR1D1	40	37
CCCn1c(C)nnc1SCc1ccc(C(=O)OCC)cn1	ZINC000450916243	DF	On-Demand	Anodyne	SLC27A1	28	40
O=[N+]([O-])c1cccnc1NCc1cnc(C2CC2)o1	ZINC000450916247	CE	On-Demand	Bother	PRKCQ	45	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	DRD4	22	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	OPRM1	44	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	CMA1	48	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	CTRA_BOVIN	56	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	FCER2	66	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	TRY2_BOVIN	47	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	NPFFR2	40	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	F11	40	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	CTRC	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	ACE2	56	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	MARS	40	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	PSMB8	47	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916249	FD	On-Demand	Anodyne	BRCA1	49	29
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	DRD4	22	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	OPRM1	44	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	CMA1	48	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	CTRA_BOVIN	56	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	FCER2	66	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	TRY2_BOVIN	47	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	NPFFR2	40	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	F11	40	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	CTRC	42	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	ACE2	56	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	MARS	40	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	PSMB8	47	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916252	FD	On-Demand	Anodyne	BRCA1	49	29
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916278	GD	On-Demand	Anodyne	ADRB3	40	39
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916278	GD	On-Demand	Anodyne	ACOX1	43	31
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916278	GD	On-Demand	Anodyne	ABCB1	58	41
COc1ccc(-c2noc(CN3CC[C@H](C(=O)N(C)c4ccccc4)C3)n2)nn1	ZINC000450916279	GE	On-Demand	Anodyne	COLA	58	37
COc1ccc(-c2noc(CN3CC[C@H](C(=O)N(C)c4ccccc4)C3)n2)nn1	ZINC000450916279	GE	On-Demand	Anodyne	CPT1A	53	37
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916280	GD	On-Demand	Anodyne	ADRB3	40	39
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916280	GD	On-Demand	Anodyne	ACOX1	43	31
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916280	GD	On-Demand	Anodyne	ABCB1	58	41
COc1ccc(-c2noc(CN3CC[C@@H](C(=O)N(C)c4ccccc4)C3)n2)nn1	ZINC000450916281	GE	On-Demand	Anodyne	COLA	58	37
COc1ccc(-c2noc(CN3CC[C@@H](C(=O)N(C)c4ccccc4)C3)n2)nn1	ZINC000450916281	GE	On-Demand	Anodyne	CPT1A	53	37
CCCC[C@@H](NC(=O)C1(C(F)(F)F)CCC1)C(=O)OC(C)(C)C	ZINC000450916283	EH	On-Demand	Anodyne	CTSK	30	41
CCCC[C@H](NC(=O)C1(C(F)(F)F)CCC1)C(=O)OC(C)(C)C	ZINC000450916285	EH	On-Demand	Anodyne	CTSK	30	41
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H]1CCOc2ccccc21	ZINC000450916296	FD	On-Demand	Anodyne	LUXR	42	34
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H]1CCOc2ccccc21	ZINC000450916296	FD	On-Demand	Anodyne	TRAR	61	34
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450916297	FD	On-Demand	Anodyne	LUXR	42	34
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450916297	FD	On-Demand	Anodyne	TRAR	61	34
COC(=O)c1ccc(CN2CCO[C@H](CN(C)CC(N)=O)C2)cc1Cl	ZINC000450916303	FC	On-Demand	Anodyne	DRD4	18	46
COC(=O)c1ccc(CN2CCO[C@@H](CN(C)CC(N)=O)C2)cc1Cl	ZINC000450916304	FC	On-Demand	Anodyne	DRD4	18	46
CC(C)(CN=c1cc(C#N)c2cc([N+](=O)[O-])ccc2[nH]1)C1(O)CCCC1	ZINC000450916306	FG	On-Demand	Mild	NMBR	40	31
COc1ccccc1S(=O)(=O)CC(=O)CC[C@@H]1CCCCO1	ZINC000450916312	EE	On-Demand	Anodyne	OXTR	18	41
COc1ccccc1S(=O)(=O)CC(=O)CC[C@H]1CCCCO1	ZINC000450916313	EE	On-Demand	Anodyne	OXTR	18	41
Cc1ccc(NC(=O)c2ccc(NC[C@@H]3CCC[C@H]3O)c([N+](=O)[O-])c2)cc1	ZINC000450916319	FH	On-Demand	Bother	TAAR1	19	46
CC(C)(CC(=O)CS(=O)(=O)c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450916328	EH	On-Demand	Anodyne	CACNA1B	62	42
CC(C)(CC(=O)CS(=O)(=O)c1cccc(C(F)(F)F)c1)C1CC1	ZINC000450916328	EH	On-Demand	Anodyne	CCR2	48	38
CC(=O)CCCCCS(=O)(=O)c1ccccc1	ZINC000450916335	CF	On-Demand	Anodyne	THRB	27	43
CCc1nc(C(C)(C)NCc2c(C)cccc2Cl)no1	ZINC000450916351	CH	On-Demand	Anodyne	EIF2AK1	40	36
CCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450916361	EE	On-Demand	Anodyne	CTSK	15	40
CCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450916361	EE	On-Demand	Anodyne	PROTEASE	17	40
CS(=O)(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)c(F)c1	ZINC000450916370	FH	On-Demand	Anodyne	PTGS2	31	40
CS(=O)(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)c(F)c1	ZINC000450916370	FH	On-Demand	Anodyne	SLC6A9	22	43
CCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450916371	EE	On-Demand	Anodyne	CTSK	15	40
CCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450916371	EE	On-Demand	Anodyne	PROTEASE	17	40
CS(=O)(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)c(F)c1	ZINC000450916372	FH	On-Demand	Anodyne	PTGS2	31	40
CS(=O)(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)c(F)c1	ZINC000450916372	FH	On-Demand	Anodyne	SLC6A9	22	43
COc1cc(N2CCN(C(=O)c3ccc(C)nc3C(C)C)CC2)ncn1	ZINC000450916379	FE	On-Demand	Anodyne	CCKAR	32	40
CC(=O)CCCCCOc1ccc(I)cc1[N+](=O)[O-]	ZINC000450916405	GH	On-Demand	Bother	THRA	0	50
CC(=O)CCCCCOc1ccc(I)cc1[N+](=O)[O-]	ZINC000450916405	GH	On-Demand	Bother	S1PR4	0	41
CO[C@@H](Cc1ccccc1)CN(C)CC(=O)Nc1nnc(CC(C)C)s1	ZINC000450916415	GF	On-Demand	Anodyne	GLS	0	42
CO[C@H](Cc1ccccc1)CN(C)CC(=O)Nc1nnc(CC(C)C)s1	ZINC000450916416	GF	On-Demand	Anodyne	GLS	0	42
C/C=C\C[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OCC	ZINC000450916441	CG	On-Demand	Anodyne	CAPN2	50	33
C/C=C\C[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OCC	ZINC000450916441	CG	On-Demand	Anodyne	NPR	21	43
COc1ccc2ncc(=O)n(CC(=O)NCc3ccccc3COC(C)C)c2c1	ZINC000450916442	GF	On-Demand	Anodyne	MTNR1A	51	37
C/C=C\C[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OCC	ZINC000450916446	CG	On-Demand	Anodyne	CAPN2	50	33
C/C=C\C[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OCC	ZINC000450916446	CG	On-Demand	Anodyne	NPR	21	43
C/C=C/C[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OCC	ZINC000450916447	CG	On-Demand	Anodyne	CAPN2	50	33
C/C=C/C[C@H](NC(=O)[C@@H](CC)CC(C)C)C(=O)OCC	ZINC000450916447	CG	On-Demand	Anodyne	NPR	21	43
C/C=C/C[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OCC	ZINC000450916448	CG	On-Demand	Anodyne	CAPN2	50	33
C/C=C/C[C@H](NC(=O)[C@H](CC)CC(C)C)C(=O)OCC	ZINC000450916448	CG	On-Demand	Anodyne	NPR	21	43
COc1ccc2ncc(=O)n(CC(=O)Nc3cc(C(C)(C)C)nn3C)c2c1	ZINC000450916459	FE	On-Demand	Anodyne	MAPK14	15	47
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)nc1	ZINC000450916460	FF	On-Demand	Anodyne	SLC6A1	47	32
CCOC(=O)c1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)nc1	ZINC000450916460	FF	On-Demand	Anodyne	MLNR	42	34
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)nc1	ZINC000450916462	FF	On-Demand	Anodyne	SLC6A1	47	32
CCOC(=O)c1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)nc1	ZINC000450916462	FF	On-Demand	Anodyne	MLNR	42	34
C=C(CC)CNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450916463	DG	On-Demand	Mild	PKM	24	40
C=C(CC)CNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450916463	DG	On-Demand	Mild	NPBWR1	44	42
COc1ccc2ncc(=O)n(CCCO)c2c1	ZINC000450916476	BC	On-Demand	Anodyne	GSG2	44	39
CCc1cc(CCCN2CC[C@H](C(=O)N(C)c3ccccc3)C2)on1	ZINC000450916485	EG	On-Demand	Anodyne	CYP2J2	49	36
CCc1cc(CCCN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)on1	ZINC000450916486	EG	On-Demand	Anodyne	CYP2J2	49	36
CCC[C@@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC(C)(C)C	ZINC000450916489	DF	On-Demand	Anodyne	SSTR2	43	40
CCC[C@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC(C)(C)C	ZINC000450916490	DF	On-Demand	Anodyne	SSTR2	43	40
C[C@@H](Oc1ccccn1)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450916493	GG	On-Demand	Anodyne	PPARA	19	42
C[C@H](Oc1ccccn1)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450916494	GG	On-Demand	Anodyne	PPARA	19	42
O=[N+]([O-])c1cc(Cl)cnc1NCc1cnc(C2CC2)o1	ZINC000450916496	CG	On-Demand	Bother	PRKCQ	22	40
CNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2C)c([N+](=O)[O-])c1	ZINC000450916498	FH	On-Demand	Bother	TAAR1	22	43
CNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2C)c([N+](=O)[O-])c1	ZINC000450916499	FH	On-Demand	Bother	TAAR1	22	43
C=C(CC)CNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000450916500	BG	On-Demand	Mild	TAAR1	16	46
COC(=O)c1cccc(CN2CCN(c3nccnc3C)CC2)c1Cl	ZINC000450916511	FF	On-Demand	Anodyne	DRD4	40	31
CCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2C)nn1	ZINC000450916514	EG	On-Demand	Anodyne	SCD1	26	41
CCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(F)cc2C)nn1	ZINC000450916514	EG	On-Demand	Anodyne	SCD	37	40
CCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2C)nn1	ZINC000450916516	EG	On-Demand	Anodyne	SCD1	26	41
CCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)cc2C)nn1	ZINC000450916516	EG	On-Demand	Anodyne	SCD	37	40
C=C(CC)CNc1ccc(S(=O)(=O)NC)cc1F	ZINC000450916521	CE	On-Demand	Mild	CA4	15	42
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	DRD2	55	71
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	DRD1	37	60
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	DRD4	51	58
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	ADRA1D	34	53
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	HTR2A	53	71
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	HTR2C	34	53
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	ADRA1A	22	46
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	DRD3	37	71
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	ERG2	24	53
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	HTR7	54	44
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	SLC18A3	0	48
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	HTR3B	0	45
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	ABCB1	0	41
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	CYP2J2	54	40
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	NET	0	54
Cc1nccnc1N1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450916533	EF	On-Demand	Anodyne	AP2S1	0	53
C=C(CC)CNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000450916536	CD	On-Demand	Mild	CA9	15	40
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450916537	GH	On-Demand	Anodyne	SFRP1	81	48
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450916537	GH	On-Demand	Anodyne	WNT3	62	34
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450916537	GH	On-Demand	Anodyne	RHOA	0	40
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450916538	GH	On-Demand	Anodyne	SFRP1	81	48
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450916538	GH	On-Demand	Anodyne	WNT3	62	34
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)c2ccc(C(C)(F)F)nc2)CC1	ZINC000450916538	GH	On-Demand	Anodyne	RHOA	0	40
CC(F)(F)CCOc1ccc(I)cc1[N+](=O)[O-]	ZINC000450916542	FH	On-Demand	Bother	S1PR4	0	43
COc1ccc2ncc(=O)n(Cc3ccc(C(=O)OC(C)(C)C)cc3)c2c1	ZINC000450916544	FG	On-Demand	Anodyne	ALOX5AP	52	34
COc1ccc2ncc(=O)n(Cc3ccc(C(=O)OC(C)(C)C)cc3)c2c1	ZINC000450916544	FG	On-Demand	Anodyne	PROKR1	55	33
Cn1[nH]c([C@@H]2CCCN2CC(=O)Nc2ccc(N3CCCCC3)nc2)nc1=N	ZINC000450916548	GD	On-Demand	Anodyne	SLC27A1	54	39
Cn1[nH]c([C@H]2CCCN2CC(=O)Nc2ccc(N3CCCCC3)nc2)nc1=N	ZINC000450916549	GD	On-Demand	Anodyne	SLC27A1	54	39
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1Br	ZINC000450916564	FF	On-Demand	Anodyne	SSTR5	71	44
COc1ccc(-c2nc(CN3CCC(c4nnc(O)o4)CC3)no2)cc1	ZINC000450916567	FE	On-Demand	Anodyne	ACOX1	33	40
COc1ccc(-c2nc(CN3CCC(c4nnc(O)o4)CC3)no2)cc1	ZINC000450916567	FE	On-Demand	Anodyne	PDK1	42	37
C[C@H](c1ccccc1)N(C)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916572	EE	On-Demand	Anodyne	OPRK1	17	41
C[C@H](c1ccccc1)N(C)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916572	EE	On-Demand	Anodyne	CCR5	48	43
C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916573	EE	On-Demand	Anodyne	OPRK1	17	41
C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916573	EE	On-Demand	Anodyne	CCR5	48	43
Cc1cc(CN2CCC(c3nnc(O)o3)CC2)c2ccccc2n1	ZINC000450916574	DG	On-Demand	Anodyne	SSTR5	34	40
CCn1ncc2c(=O)n(Cc3ccc(Cl)c(OC)c3)cnc21	ZINC000450916575	DE	On-Demand	Anodyne	NPBWR1	66	42
CCn1ncc2c(=O)n(Cc3ccc(Cl)c(OC)c3)cnc21	ZINC000450916575	DE	On-Demand	Anodyne	Q9M629_MAIZE	51	37
Oc1nnc(C2CCN(Cc3csc(Cc4ccccc4)n3)CC2)o1	ZINC000450916576	FG	On-Demand	Anodyne	SCN5A	37	40
Oc1nnc(C2CCN(CCCc3nc(-c4cccs4)no3)CC2)o1	ZINC000450916580	FF	On-Demand	Anodyne	ETHR	62	50
Oc1nnc(C2CCN(CCCCOc3ccccc3C(F)(F)F)CC2)o1	ZINC000450916592	GH	On-Demand	Anodyne	HTR1A	15	40
Oc1nnc(C2CCN(CCCCOc3ccccc3C(F)(F)F)CC2)o1	ZINC000450916592	GH	On-Demand	Anodyne	DRD2	19	40
Oc1nnc(C2CCN(CCCCOc3ccccc3C(F)(F)F)CC2)o1	ZINC000450916592	GH	On-Demand	Anodyne	NPY1R	40	33
Oc1nnc(C2CCN(CCCCOc3ccccc3C(F)(F)F)CC2)o1	ZINC000450916592	GH	On-Demand	Anodyne	RBP4	42	36
Oc1nnc(C2CCN(CCCOc3ccc4ccccc4c3)CC2)o1	ZINC000450916595	FH	On-Demand	Anodyne	KCNH2	0	40
Oc1nnc(C2CCN(CCCOc3ccc4ccccc4c3)CC2)o1	ZINC000450916595	FH	On-Demand	Anodyne	HRH3	74	41
Oc1nnc(C2CCN(CCCOc3ccc4ccccc4c3)CC2)o1	ZINC000450916595	FH	On-Demand	Anodyne	SIGMAR1	29	41
Oc1nnc(C2CCN(CCCOc3ccc4ccccc4c3)CC2)o1	ZINC000450916595	FH	On-Demand	Anodyne	MEN1	53	36
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)C1CCC1	ZINC000450916601	DC	On-Demand	Bother	TBXA2R	21	40
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)C1CCC1	ZINC000450916602	DC	On-Demand	Bother	TBXA2R	21	40
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NC[C@@H](O)C1CCC1	ZINC000450916622	GF	On-Demand	Bother	EPHX2	15	45
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NC[C@H](O)C1CCC1	ZINC000450916623	GF	On-Demand	Bother	EPHX2	15	45
Oc1nnc(C2CCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)CC2)o1	ZINC000450916630	GG	On-Demand	Anodyne	ADRB3	66	42
Oc1nnc(C2CCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)CC2)o1	ZINC000450916630	GG	On-Demand	Anodyne	ACOX1	85	42
Oc1nnc(C2CCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)CC2)o1	ZINC000450916630	GG	On-Demand	Anodyne	CYP2D6	22	43
Oc1nnc(C2CCN(C[C@H](O)COc3ccc(-c4ccccc4)cc3)CC2)o1	ZINC000450916630	GG	On-Demand	Anodyne	ABCB1	60	40
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)CC2)o1	ZINC000450916631	GG	On-Demand	Anodyne	ADRB3	66	42
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)CC2)o1	ZINC000450916631	GG	On-Demand	Anodyne	ACOX1	85	42
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)CC2)o1	ZINC000450916631	GG	On-Demand	Anodyne	CYP2D6	22	43
Oc1nnc(C2CCN(C[C@@H](O)COc3ccc(-c4ccccc4)cc3)CC2)o1	ZINC000450916631	GG	On-Demand	Anodyne	ABCB1	60	40
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450916639	CD	On-Demand	Anodyne	LGMN	56	33
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(O)c(F)c1	ZINC000450916639	CD	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCN1C(=O)c1c[nH]c2nccc-2c1	ZINC000450916649	CD	On-Demand	Anodyne	PREP	41	36
COC(=O)c1ccc(C(F)(F)F)nc1SCc1nnc(C(C)C)s1	ZINC000450916650	GI	On-Demand	Anodyne	TRPV1	57	33
Oc1nnc(C2CCN(Cc3nc(-c4ccc(C(F)(F)F)cc4)no3)CC2)o1	ZINC000450916653	GG	On-Demand	Anodyne	ETHR	43	38
COC(=O)c1ccccc1C(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450916665	GG	On-Demand	Bother	TAAR1	19	40
COC(=O)c1ccccc1C(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450916666	GG	On-Demand	Bother	TAAR1	19	40
CC(C)[C@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccccc1	ZINC000450916667	FE	On-Demand	Anodyne	PRCP	25	48
CC(C)[C@@H](NC(=O)CN1CCC(c2nnc(O)o2)CC1)c1ccccc1	ZINC000450916669	FE	On-Demand	Anodyne	PRCP	25	48
COc1cc(C#N)cc(OCCCCCC(C)=O)c1	ZINC000450916673	CG	On-Demand	Mild	PLA2G4B	54	31
O=C(CCN1CCC(c2nnc(O)o2)CC1)N1CCCCC1	ZINC000450916677	DD	On-Demand	Anodyne	ETHR	48	36
O=S(=O)(C[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(C(F)(F)F)c1	ZINC000450916687	DG	On-Demand	Anodyne	CACNA1B	47	36
CCc1ccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916693	EE	On-Demand	Anodyne	DRD4	20	46
COCC1(CNc2cc(C)nc(-c3cccnc3)n2)CCCC1	ZINC000450916698	DF	On-Demand	Anodyne	ROS1	59	41
O=c1c(Cl)c(NC[C@H](O)C2CCC2)cnn1-c1ccc(F)cc1F	ZINC000450916699	FF	On-Demand	Anodyne	MAPK14	15	43
O=c1c(Cl)c(NC[C@@H](O)C2CCC2)cnn1-c1ccc(F)cc1F	ZINC000450916700	FF	On-Demand	Anodyne	MAPK14	15	43
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(OC)c(OC)cc1Br	ZINC000450916701	GF	On-Demand	Anodyne	FKBP1A	68	44
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(OC)c(OC)cc1Br	ZINC000450916701	GF	On-Demand	Anodyne	FKBP12.6	0	43
CC(C)(C)CCNC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450916704	DD	On-Demand	Anodyne	CACNA1I	45	35
COC(=O)C[C@@]1(NC(=O)c2ccc(N3CCC3)nc2)CCOC1	ZINC000450916717	DC	On-Demand	Anodyne	HDAC1	26	42
COC(=O)C[C@]1(NC(=O)c2ccc(N3CCC3)nc2)CCOC1	ZINC000450916718	DC	On-Demand	Anodyne	HDAC1	26	42
COCC(=O)Cn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450916729	FF	On-Demand	Anodyne	SCD	23	46
N#Cc1cc(Cl)ccc1CN1CCC(c2nnc(O)o2)CC1	ZINC000450916734	DF	On-Demand	Mild	NOS2	15	41
COCC1(CNc2cnc(C#N)cn2)CCCC1	ZINC000450916740	BD	On-Demand	Mild	CHEK1	15	43
Cc1ccc(NC(=O)c2ccc(NC[C@H](O)C3CCC3)c([N+](=O)[O-])c2)cc1	ZINC000450916758	FH	On-Demand	Bother	TAAR1	19	46
Cc1ccc([N+](=O)[O-])c(NCc2cnc(C3CC3)o2)n1	ZINC000450916775	CF	On-Demand	Bother	PRKCQ	48	38
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	DRD2	36	47
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	DRD4	28	55
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	HTR2A	36	56
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	HTR2C	30	65
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	SLC6A1	108	38
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	SIGMAR1	23	59
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	CCR5	30	41
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	SLC18A3	28	48
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	HTR3B	0	49
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	CYP2J2	68	48
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	WNT3A	47	35
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	NET	0	42
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916785	FH	On-Demand	Anodyne	AP2S1	0	42
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	DRD2	36	47
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	DRD4	28	55
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	HTR2A	36	56
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	HTR2C	30	65
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	SLC6A1	108	38
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	SIGMAR1	23	59
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	CCR5	30	41
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	SLC18A3	28	48
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	HTR3B	0	49
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	CYP2J2	68	48
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	WNT3A	47	35
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	NET	0	42
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1)c1ccccc1	ZINC000450916786	FH	On-Demand	Anodyne	AP2S1	0	42
Cc1ccc(NC(=O)c2ccc(NC[C@@H](O)C3CCC3)c([N+](=O)[O-])c2)cc1	ZINC000450916811	FH	On-Demand	Bother	TAAR1	19	46
CCCC[C@@H](NC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccnc1)C(=O)OC(C)(C)C	ZINC000450916826	GF	On-Demand	Anodyne	SSTR2	47	37
CCCC[C@H](NC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccnc1)C(=O)OC(C)(C)C	ZINC000450916827	GF	On-Demand	Anodyne	SSTR2	47	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450916831	DF	On-Demand	Anodyne	FKBP1A	69	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450916831	DF	On-Demand	Anodyne	PREP	87	42
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450916831	DF	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@H]1CCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450916832	GE	On-Demand	Mild	FKBP1A	41	35
CCOC(=O)[C@H]1CCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450916832	GE	On-Demand	Mild	COLA	78	39
CCOC(=O)[C@H]1CCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450916832	GE	On-Demand	Mild	CPT1A	73	39
CCOC(=O)[C@H]1CCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450916832	GE	On-Demand	Mild	CPT2	44	39
CCOC(=O)[C@H]1CCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450916832	GE	On-Demand	Mild	PREP	65	37
CCOC(=O)[C@H]1CCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450916832	GE	On-Demand	Mild	LGMN	52	36
CCOC(=O)[C@H]1CCCN1C(=O)COc1cccc(Br)c1C#N	ZINC000450916832	GE	On-Demand	Mild	FAP	0	40
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450916845	EG	On-Demand	Anodyne	CACNA1B	41	34
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450916845	EG	On-Demand	Anodyne	FKBP12.6	0	45
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450916845	EG	On-Demand	Anodyne	LIPG	53	39
Oc1nnc(C2CCN(Cc3nc(O)c4oc5ccccc5c4n3)CC2)o1	ZINC000450916859	FF	On-Demand	Anodyne	PIM1	23	52
Oc1nnc(C2CCN(Cc3nc(O)c4oc5ccccc5c4n3)CC2)o1	ZINC000450916859	FF	On-Demand	Anodyne	PIM2	24	52
Oc1nnc(C2CCN(Cc3nc(O)c4oc5ccccc5c4n3)CC2)o1	ZINC000450916859	FF	On-Demand	Anodyne	CDC7	24	52
Oc1nnc(C2CCN(Cc3nc(O)c4oc5ccccc5c4n3)CC2)o1	ZINC000450916859	FF	On-Demand	Anodyne	PIM3	24	51
CC(C)Cc1nnc(NC(=O)CN(C)C[C@H](O)Cc2ccccc2)s1	ZINC000450916863	FE	On-Demand	Anodyne	GLS	0	44
CC(C)Cc1nnc(NC(=O)CN(C)C[C@H](O)Cc2ccccc2)s1	ZINC000450916863	FE	On-Demand	Anodyne	GLS2	0	40
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cn(C)nc1C	ZINC000450916881	CC	On-Demand	Anodyne	FKBP1A	43	38
C/C=C\C[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OCC	ZINC000450916883	FE	On-Demand	Anodyne	CA2	15	42
C/C=C/C[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OCC	ZINC000450916884	FE	On-Demand	Anodyne	CA2	15	42
C/C=C\C[C@@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OCC	ZINC000450916885	FE	On-Demand	Anodyne	CA2	15	42
C/C=C/C[C@H](NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C(=O)OCC	ZINC000450916886	FE	On-Demand	Anodyne	CA2	15	42
CC1(C)Cc2cccc(CN3CCC(c4nnc(O)o4)CC3)c2O1	ZINC000450916909	EF	On-Demand	Anodyne	CCR8	17	44
C=C(CC)CNc1ccc([N+](=O)[O-])cc1C(=O)NC	ZINC000450916912	CE	On-Demand	Mild	KCNMA1	19	40
CCOC(=O)[C@H]1CCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450916913	EF	On-Demand	Anodyne	COLA	102	41
CCOC(=O)[C@H]1CCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450916913	EF	On-Demand	Anodyne	CPT1A	88	41
CCOC(=O)[C@H]1CCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450916913	EF	On-Demand	Anodyne	CPT2	45	37
CCOC(=O)[C@H]1CCCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450916913	EF	On-Demand	Anodyne	PREP	73	42
C=C(CC)CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450916914	DF	On-Demand	Mild	LRRK2	29	45
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2C(=O)OCC)on1	ZINC000450916915	DD	On-Demand	Anodyne	FKBP12.6	0	43
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916917	CE	On-Demand	Anodyne	DRD4	25	43
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916917	CE	On-Demand	Anodyne	DRD3	0	42
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916917	CE	On-Demand	Anodyne	SIGMAR1	33	45
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916917	CE	On-Demand	Anodyne	SSTR5	64	39
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916917	CE	On-Demand	Anodyne	PDK1	44	41
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916917	CE	On-Demand	Anodyne	MCHR1	23	40
COc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450916917	CE	On-Demand	Anodyne	PROKR1	40	30
COc1cc2c(NC[C@H](O)C3CCC3)ccnc2cc1F	ZINC000450916928	CF	On-Demand	Anodyne	HRP1_PLAFA	43	30
COc1cc2c(NC[C@H](O)C3CCC3)ccnc2cc1F	ZINC000450916928	CF	On-Demand	Anodyne	FGFR2	48	36
COc1cc2c(NC[C@H](O)C3CCC3)ccnc2cc1F	ZINC000450916928	CF	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(NC[C@H](O)C3CCC3)ccnc2cc1F	ZINC000450916928	CF	On-Demand	Anodyne	NTSR2	42	36
COc1cc2c(NC[C@H](O)C3CCC3)ccnc2cc1F	ZINC000450916928	CF	On-Demand	Anodyne	FLT1	22	40
COc1cc2c(NC[C@H](O)C3CCC3)ccnc2cc1F	ZINC000450916928	CF	On-Demand	Anodyne	HNMT	42	32
COc1cc2c(NC[C@@H](O)C3CCC3)ccnc2cc1F	ZINC000450916929	CF	On-Demand	Anodyne	HRP1_PLAFA	43	30
COc1cc2c(NC[C@@H](O)C3CCC3)ccnc2cc1F	ZINC000450916929	CF	On-Demand	Anodyne	FGFR2	48	36
COc1cc2c(NC[C@@H](O)C3CCC3)ccnc2cc1F	ZINC000450916929	CF	On-Demand	Anodyne	FGFR1	0	40
COc1cc2c(NC[C@@H](O)C3CCC3)ccnc2cc1F	ZINC000450916929	CF	On-Demand	Anodyne	NTSR2	42	36
COc1cc2c(NC[C@@H](O)C3CCC3)ccnc2cc1F	ZINC000450916929	CF	On-Demand	Anodyne	FLT1	22	40
COc1cc2c(NC[C@@H](O)C3CCC3)ccnc2cc1F	ZINC000450916929	CF	On-Demand	Anodyne	HNMT	42	32
CS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c(C(F)(F)F)c1	ZINC000450916932	EF	On-Demand	Anodyne	SFRP1	94	38
CS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c(C(F)(F)F)c1	ZINC000450916932	EF	On-Demand	Anodyne	WNT3	53	33
CS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c(C(F)(F)F)c1	ZINC000450916933	EF	On-Demand	Anodyne	SFRP1	94	38
CS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c(C(F)(F)F)c1	ZINC000450916933	EF	On-Demand	Anodyne	WNT3	53	33
COc1ccc2ncc(=O)n(CCCCC(F)(F)F)c2c1	ZINC000450916939	DG	On-Demand	Anodyne	GSG2	45	42
COCCOCCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450916947	GG	On-Demand	Anodyne	SCD	21	46
CCOCCCn1c(=O)cnc2ccc(OC)cc21	ZINC000450916964	CD	On-Demand	Anodyne	GSG2	42	37
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	HTR1A	56	47
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	DRD2	43	43
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	DRD4	46	36
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	ADRA1D	36	40
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	HTR2A	22	42
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	ADRA1A	32	40
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	DRD3	55	43
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	PDGFRB	77	42
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	HTR7	59	47
COc1ccc(CNC(=O)CCN2CCN(c3nccnc3C)CC2)c(OC)c1	ZINC000450916965	GD	On-Demand	Anodyne	CSF1R	16	42
CC(=O)N[C@H](C(=O)N1CCC[C@H](N(C)Cc2ccccn2)CC1)C(C)(C)C	ZINC000450916967	FE	On-Demand	Anodyne	CCR1	24	40
CC(=O)N[C@H](C(=O)N1CCC[C@H](N(C)Cc2ccccn2)CC1)C(C)(C)C	ZINC000450916967	FE	On-Demand	Anodyne	BIRC2	33	45
O=C(CCN1CCC(c2nnc(O)o2)CC1)Nc1cccnc1	ZINC000450916968	DD	On-Demand	Anodyne	NAMPT	18	40
CC(=O)N[C@H](C(=O)N1CCC[C@@H](N(C)Cc2ccccn2)CC1)C(C)(C)C	ZINC000450916969	FE	On-Demand	Anodyne	CCR1	24	40
CC(=O)N[C@H](C(=O)N1CCC[C@@H](N(C)Cc2ccccn2)CC1)C(C)(C)C	ZINC000450916969	FE	On-Demand	Anodyne	BIRC2	33	45
Cc1ccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1C	ZINC000450916971	EE	On-Demand	Anodyne	DRD4	26	49
Oc1nnc(C2CCN(CCOc3ccc(OC(F)(F)F)cc3)CC2)o1	ZINC000450916982	FF	On-Demand	Anodyne	ESR1	45	33
Oc1nnc(C2CCN(CCOc3ccc(OC(F)(F)F)cc3)CC2)o1	ZINC000450916982	FF	On-Demand	Anodyne	LTA4H	46	38
Oc1nnc(C2CCN(CCOc3ccc(OC(F)(F)F)cc3)CC2)o1	ZINC000450916982	FF	On-Demand	Anodyne	PSMB2	46	35
Oc1nnc(C2CCN(CCOc3ccc(OC(F)(F)F)cc3)CC2)o1	ZINC000450916982	FF	On-Demand	Anodyne	PSMB1	41	36
Oc1nnc(C2CCN(CCOc3ccc(OC(F)(F)F)cc3)CC2)o1	ZINC000450916982	FF	On-Demand	Anodyne	MEN1	47	32
Cc1sccc1C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450916983	FI	On-Demand	Anodyne	C5AR1	20	41
CCCCOCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450917003	ED	On-Demand	Anodyne	AVPR1B	35	42
CCCCOCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450917003	ED	On-Demand	Anodyne	MTNR1A	50	45
CCCCOCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450917003	ED	On-Demand	Anodyne	MTNR1B	34	45
COC(=O)c1cc(C)nc(N2CCC[C@H]2c2ccc(F)cc2F)c1[N+](=O)[O-]	ZINC000450917004	GH	On-Demand	Bother	CACNA1D	43	35
COC(=O)c1cc(C)nc(N2CCC[C@@H]2c2ccc(F)cc2F)c1[N+](=O)[O-]	ZINC000450917006	GH	On-Demand	Bother	CACNA1D	43	35
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3COc4ccccc4O3)c2c1	ZINC000450917009	GD	On-Demand	Anodyne	PTGER2	19	41
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3COc4ccccc4O3)c2c1	ZINC000450917009	GD	On-Demand	Anodyne	AVPR1B	42	37
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3COc4ccccc4O3)c2c1	ZINC000450917009	GD	On-Demand	Anodyne	MTNR1A	18	43
COc1ccc2ncc(=O)n(CC(=O)NC[C@H]3COc4ccccc4O3)c2c1	ZINC000450917009	GD	On-Demand	Anodyne	PTGDR	37	41
CC(C)(C)OC(=O)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450917011	FG	On-Demand	Anodyne	PANC	27	40
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3COc4ccccc4O3)c2c1	ZINC000450917012	GD	On-Demand	Anodyne	PTGER2	19	41
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3COc4ccccc4O3)c2c1	ZINC000450917012	GD	On-Demand	Anodyne	AVPR1B	42	37
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3COc4ccccc4O3)c2c1	ZINC000450917012	GD	On-Demand	Anodyne	MTNR1A	18	43
COc1ccc2ncc(=O)n(CC(=O)NC[C@@H]3COc4ccccc4O3)c2c1	ZINC000450917012	GD	On-Demand	Anodyne	PTGDR	37	41
Cn1[nH]c([C@@H]2CCCN2Cc2ccc(C(=O)OC(C)(C)C)cc2)nc1=N	ZINC000450917015	FF	On-Demand	Anodyne	PANC	31	40
Cn1[nH]c([C@H]2CCCN2Cc2ccc(C(=O)OC(C)(C)C)cc2)nc1=N	ZINC000450917016	FF	On-Demand	Anodyne	PANC	31	40
O=S(=O)(C[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(C(F)(F)F)c1	ZINC000450917018	DG	On-Demand	Anodyne	CACNA1B	47	36
Oc1nnc(C2CCN(CCCCCn3nnc(-c4ccccc4)n3)CC2)o1	ZINC000450917025	GE	On-Demand	Anodyne	CYP2J2	45	31
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC[C@H](O)C1CCC1	ZINC000450917026	GE	On-Demand	Bother	EPHX2	15	45
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC[C@@H](O)C1CCC1	ZINC000450917027	GE	On-Demand	Bother	EPHX2	15	45
N#Cc1cccc(CNC(=O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450917036	ED	On-Demand	Mild	DRD4	0	41
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccc(OC(C)C)cc3)c2c1	ZINC000450917043	GF	On-Demand	Anodyne	MTNR1A	55	42
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccc(OC(C)C)cc3)c2c1	ZINC000450917043	GF	On-Demand	Anodyne	MTNR1B	43	42
CCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450917048	FE	On-Demand	Anodyne	F2	15	45
CCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450917048	FE	On-Demand	Anodyne	AVPR1B	51	42
CCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450917048	FE	On-Demand	Anodyne	CMA1	35	41
CCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450917048	FE	On-Demand	Anodyne	MTNR1A	63	41
CCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450917048	FE	On-Demand	Anodyne	MTNR1B	57	41
CCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450917048	FE	On-Demand	Anodyne	ROCK2	43	38
CCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450917048	FE	On-Demand	Anodyne	CTRC	37	41
CCOc1cccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)c1	ZINC000450917048	FE	On-Demand	Anodyne	PDS	54	41
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(OC(C)C)c3)c2c1	ZINC000450917050	GF	On-Demand	Anodyne	F2	18	46
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(OC(C)C)c3)c2c1	ZINC000450917050	GF	On-Demand	Anodyne	AVPR1B	53	42
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(OC(C)C)c3)c2c1	ZINC000450917050	GF	On-Demand	Anodyne	CMA1	35	42
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(OC(C)C)c3)c2c1	ZINC000450917050	GF	On-Demand	Anodyne	MTNR1A	50	40
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(OC(C)C)c3)c2c1	ZINC000450917050	GF	On-Demand	Anodyne	MTNR1B	48	40
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(OC(C)C)c3)c2c1	ZINC000450917050	GF	On-Demand	Anodyne	ROCK2	41	38
COc1ccc2ncc(=O)n(CC(=O)NCc3cccc(OC(C)C)c3)c2c1	ZINC000450917050	GF	On-Demand	Anodyne	CTRC	35	42
Cc1ccc(C(=O)N2CC[C@@H](N(C)Cc3ncccn3)C2)c(Cl)c1Cl	ZINC000450917052	GG	On-Demand	Anodyne	P2RX7	43	41
Cc1ccc(C(=O)N2CC[C@H](N(C)Cc3ncccn3)C2)c(Cl)c1Cl	ZINC000450917053	GG	On-Demand	Anodyne	P2RX7	43	41
NS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450917059	DC	On-Demand	Bother	CA2	27	44
NS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450917059	DC	On-Demand	Bother	BDKRB1	0	41
NS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450917060	DC	On-Demand	Bother	CA2	27	44
NS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450917060	DC	On-Demand	Bother	BDKRB1	0	41
CCn1ncc2c(=O)n(CCCCc3ccc(Cl)c(Cl)c3)cnc21	ZINC000450917062	FH	On-Demand	Anodyne	DNAE	74	35
CCn1ncc2c(=O)n(CCCCc3ccc(Cl)c(Cl)c3)cnc21	ZINC000450917062	FH	On-Demand	Anodyne	Q9M629_MAIZE	54	33
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccc2c(c1)OCCCO2	ZINC000450917071	FD	On-Demand	Anodyne	DRD4	0	42
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H](c1ccccc1)c1cccs1	ZINC000450917086	GF	On-Demand	Anodyne	PRCP	25	44
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450917088	GF	On-Demand	Anodyne	PRCP	25	44
CC(C)(CNc1ccc(S(C)(=O)=O)cc1F)C1(O)CCCC1	ZINC000450917090	EF	On-Demand	Anodyne	SLC6A9	23	42
COC(=O)CNC(=O)c1ccc(NCC(C)(C)C2(O)CCCC2)c([N+](=O)[O-])c1	ZINC000450917091	GE	On-Demand	Bother	TAAR1	20	42
COc1ccc2ncc(=O)n(CC(=O)c3ccc(CCNC(C)=O)s3)c2c1	ZINC000450917097	GE	On-Demand	Anodyne	NQO2	36	42
COc1ccc2ncc(=O)n(CC(=O)c3ccc(CCNC(C)=O)s3)c2c1	ZINC000450917097	GE	On-Demand	Anodyne	MTNR1A	87	45
COc1ccc2ncc(=O)n(CC(=O)c3ccc(CCNC(C)=O)s3)c2c1	ZINC000450917097	GE	On-Demand	Anodyne	MTNR1B	72	45
CC[C@@H](CC(F)(F)F)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450917106	GI	On-Demand	Anodyne	AMY2	49	35
Cc1nc(NCC(C)(C)C2(O)CCCC2)ncc1[N+](=O)[O-]	ZINC000450917128	CE	On-Demand	Bother	PRKCQ	40	34
CC(C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])C1(O)CCCC1	ZINC000450917131	FG	On-Demand	Bother	MAPK13	42	34
Oc1nnc(C2CCN(C[C@@H](O)COCc3ccco3)CC2)o1	ZINC000450917134	DD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	53
Oc1nnc(C2CCN(C[C@H](O)COCc3ccco3)CC2)o1	ZINC000450917135	DD	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	53
CC(C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C1(O)CCCC1	ZINC000450917139	FF	On-Demand	Bother	TBXA2R	28	40
COC(=O)c1ccc(C(F)(F)F)nc1SCC[C@@H](C)O	ZINC000450917145	DF	On-Demand	Anodyne	TRPV1	58	41
COC(=O)c1ccc(C(F)(F)F)nc1SCC[C@H](C)O	ZINC000450917146	DF	On-Demand	Anodyne	TRPV1	58	41
Oc1nnc(C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)o1	ZINC000450917151	FH	On-Demand	Anodyne	DRD2	0	51
Oc1nnc(C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)o1	ZINC000450917151	FH	On-Demand	Anodyne	DRD4	28	41
Oc1nnc(C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)o1	ZINC000450917151	FH	On-Demand	Anodyne	DRD3	0	41
Oc1nnc(C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)o1	ZINC000450917151	FH	On-Demand	Anodyne	LTA4H	48	40
Oc1nnc(C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)o1	ZINC000450917151	FH	On-Demand	Anodyne	SSTR5	46	34
Oc1nnc(C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)o1	ZINC000450917151	FH	On-Demand	Anodyne	SLC6A5	29	47
Oc1nnc(C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)o1	ZINC000450917151	FH	On-Demand	Anodyne	ADIPOR1	0	42
Oc1nnc(C2CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)o1	ZINC000450917151	FH	On-Demand	Anodyne	ADIPOR2	0	42
CCc1cc(NC[C@@H]2C[C@H]2C2CC2)n2ncnc2n1	ZINC000450917172	CE	On-Demand	Anodyne	DHOD	0	49
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)c2cncc(Cl)c2)c1	ZINC000450917189	GD	On-Demand	Anodyne	PPIA	15	41
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)c2cncc(Cl)c2)c1	ZINC000450917189	GD	On-Demand	Anodyne	SCN10A	36	40
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)c2cncc(Cl)c2)c1	ZINC000450917189	GD	On-Demand	Anodyne	CSF1R	21	41
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)c2cncc(Cl)c2)c1	ZINC000450917189	GD	On-Demand	Anodyne	USP47	41	33
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)c2cncc(Cl)c2)c1	ZINC000450917189	GD	On-Demand	Anodyne	KCNK3	55	35
C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@]2(CCCOC2)O1	ZINC000450917190	DF	On-Demand	Anodyne	CYP2J2	56	42
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@]2(CCCOC2)O1	ZINC000450917191	DF	On-Demand	Anodyne	CYP2J2	56	42
C[C@H]1CN(CCCC(=O)c2ccccc2)C[C@@]2(CCCOC2)O1	ZINC000450917192	DF	On-Demand	Anodyne	CYP2J2	56	42
C[C@@H]1CN(CCCC(=O)c2ccccc2)C[C@@]2(CCCOC2)O1	ZINC000450917193	DF	On-Demand	Anodyne	CYP2J2	56	42
CCCC[C@@H](NC(=O)C1(CF)CCOCC1)C(=O)OC(C)(C)C	ZINC000450917239	EF	On-Demand	Anodyne	CTSK	28	43
CCCC[C@H](NC(=O)C1(CF)CCOCC1)C(=O)OC(C)(C)C	ZINC000450917240	EF	On-Demand	Anodyne	CTSK	28	43
C/C=C/C[C@H](NC(=O)CNC(=O)NC)C(=O)OCC	ZINC000450917259	CB	On-Demand	Anodyne	NOD1	46	34
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(Br)c(C)cc1C	ZINC000450917261	FG	On-Demand	Anodyne	FKBP12.6	0	44
C/C=C/C[C@@H](NC(=O)CNC(=O)NC)C(=O)OCC	ZINC000450917262	CB	On-Demand	Anodyne	NOD1	46	34
C/C=C\C[C@H](NC(=O)CNC(=O)NC)C(=O)OCC	ZINC000450917263	CB	On-Demand	Anodyne	NOD1	46	34
C/C=C\C[C@@H](NC(=O)CNC(=O)NC)C(=O)OCC	ZINC000450917264	CB	On-Demand	Anodyne	NOD1	46	34
C=CC(C)(C)C(=O)N[C@H](CCCC)C(=O)OC(C)(C)C	ZINC000450917266	CG	On-Demand	Mild	CTSK	22	42
C=CC(C)(C)C(=O)N[C@H](CCCC)C(=O)OC(C)(C)C	ZINC000450917266	CG	On-Demand	Mild	NOD1	59	33
C=CC(C)(C)C(=O)N[C@@H](CCCC)C(=O)OC(C)(C)C	ZINC000450917267	CG	On-Demand	Mild	CTSK	22	42
C=CC(C)(C)C(=O)N[C@@H](CCCC)C(=O)OC(C)(C)C	ZINC000450917267	CG	On-Demand	Mild	NOD1	59	33
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	DRD4	57	46
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	ACHE	25	42
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	OPRM1	28	42
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	DRD3	30	50
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	HTR4	43	39
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	SIGMAR1	40	42
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	SSTR5	55	37
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	CCR3	44	42
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	CCR5	32	42
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	TACR3	42	37
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	S1PR5	22	41
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917268	FH	On-Demand	Anodyne	MCHR1	32	45
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	DRD4	57	46
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	ACHE	25	42
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	OPRM1	28	42
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	DRD3	30	50
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	HTR4	43	39
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	SIGMAR1	40	42
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	SSTR5	55	37
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	CCR3	44	42
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	CCR5	32	42
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	TACR3	42	37
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	S1PR5	22	41
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1Cl	ZINC000450917269	FH	On-Demand	Anodyne	MCHR1	32	45
CCOC(=O)[C@H]1CCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450917296	GE	On-Demand	Mild	FKBP1A	56	37
CCOC(=O)[C@H]1CCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450917296	GE	On-Demand	Mild	COLA	99	46
CCOC(=O)[C@H]1CCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450917296	GE	On-Demand	Mild	CPT1A	91	46
CCOC(=O)[C@H]1CCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450917296	GE	On-Demand	Mild	CPT2	51	46
CCOC(=O)[C@H]1CCCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450917296	GE	On-Demand	Mild	PREP	46	35
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1nc2c(s1)CCCC2	ZINC000450917302	FD	On-Demand	Anodyne	SLC27A1	48	54
C/C=C/C[C@H](NC(=O)C[C@H](O)CC)C(=O)OCC	ZINC000450917309	CD	On-Demand	Anodyne	NOD1	43	36
C/C=C\C[C@H](NC(=O)C[C@@H](O)CC)C(=O)OCC	ZINC000450917310	CD	On-Demand	Anodyne	NOD1	43	36
C/C=C\C[C@H](NC(=O)C[C@H](O)CC)C(=O)OCC	ZINC000450917311	CD	On-Demand	Anodyne	NOD1	43	36
C/C=C/C[C@H](NC(=O)C[C@@H](O)CC)C(=O)OCC	ZINC000450917312	CD	On-Demand	Anodyne	NOD1	43	36
CCCc1cc(NCC2(COC)CCCC2)n2ncnc2n1	ZINC000450917315	DF	On-Demand	Anodyne	DHOD	0	43
C/C=C\C[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917316	DD	On-Demand	Anodyne	TRPV1	53	51
C/C=C\C[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917316	DD	On-Demand	Anodyne	NCE103	28	41
C/C=C\C[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917316	DD	On-Demand	Anodyne	CAN2	0	41
C/C=C/C[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917318	DD	On-Demand	Anodyne	TRPV1	53	51
C/C=C/C[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917318	DD	On-Demand	Anodyne	NCE103	28	41
C/C=C/C[C@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917318	DD	On-Demand	Anodyne	CAN2	0	41
C/C=C/C[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917319	DD	On-Demand	Anodyne	TRPV1	53	51
C/C=C/C[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917319	DD	On-Demand	Anodyne	NCE103	28	41
C/C=C/C[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917319	DD	On-Demand	Anodyne	CAN2	0	41
C/C=C\C[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917321	DD	On-Demand	Anodyne	TRPV1	53	51
C/C=C\C[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917321	DD	On-Demand	Anodyne	NCE103	28	41
C/C=C\C[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)C(=O)OCC	ZINC000450917321	DD	On-Demand	Anodyne	CAN2	0	41
COCC1(CNc2ccc(C(C)=O)cc2[N+](=O)[O-])CCCC1	ZINC000450917335	DG	On-Demand	Bother	TAAR1	18	45
Oc1nnc(C2CCN(Cc3ccc(OCc4ccc(F)cc4)cc3)CC2)o1	ZINC000450917337	GH	On-Demand	Anodyne	HRH3	15	55
Oc1nnc(C2CCN(Cc3ccc(OCc4ccc(F)cc4)cc3)CC2)o1	ZINC000450917337	GH	On-Demand	Anodyne	SIGMAR1	28	51
Oc1nnc(C2CCN(Cc3ccc(OCc4ccc(F)cc4)cc3)CC2)o1	ZINC000450917337	GH	On-Demand	Anodyne	SLC6A5	28	40
Oc1nnc(C2CCN(Cc3ccc(OCc4ccc(F)cc4)cc3)CC2)o1	ZINC000450917337	GH	On-Demand	Anodyne	MCHR1	15	42
Oc1nnc(C2CCN(Cc3ccc(OCc4ccc(F)cc4)cc3)CC2)o1	ZINC000450917337	GH	On-Demand	Anodyne	CACNA1G	22	40
COC(=O)C[C@@]1(NC(=O)CCOc2cccc(OC)c2)CCOC1	ZINC000450917343	ED	On-Demand	Anodyne	MTNR1A	23	43
COC(=O)C[C@]1(NC(=O)CCOc2cccc(OC)c2)CCOC1	ZINC000450917346	ED	On-Demand	Anodyne	MTNR1A	23	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450917353	DE	On-Demand	Anodyne	ACE	45	46
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450917353	DE	On-Demand	Anodyne	FKBP1A	88	45
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450917353	DE	On-Demand	Anodyne	SLC6A1	78	33
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450917353	DE	On-Demand	Anodyne	CPT2	41	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450917353	DE	On-Demand	Anodyne	PREP	101	48
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450917353	DE	On-Demand	Anodyne	ACE2	26	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450917353	DE	On-Demand	Anodyne	FKBP12.6	0	45
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450917353	DE	On-Demand	Anodyne	F1PEP1	0	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450917355	DE	On-Demand	Anodyne	ACE	45	46
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450917355	DE	On-Demand	Anodyne	FKBP1A	88	45
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450917355	DE	On-Demand	Anodyne	SLC6A1	78	33
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450917355	DE	On-Demand	Anodyne	CPT2	41	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450917355	DE	On-Demand	Anodyne	PREP	101	48
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450917355	DE	On-Demand	Anodyne	ACE2	26	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450917355	DE	On-Demand	Anodyne	FKBP12.6	0	45
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450917355	DE	On-Demand	Anodyne	F1PEP1	0	40
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc(C)ccc1F	ZINC000450917358	CE	On-Demand	Anodyne	DPP4	23	41
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc(C)ccc1F	ZINC000450917358	CE	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc(C)ccc1F	ZINC000450917358	CE	On-Demand	Anodyne	FAP	0	40
CCn1ncc2c(=O)n(CCc3ccc(Cl)cc3)cnc21	ZINC000450917362	DF	On-Demand	Anodyne	Q9M629_MAIZE	54	33
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(N2CCCC2=O)c1	ZINC000450917363	GD	On-Demand	Anodyne	DRD4	0	47
CNS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450917367	ED	On-Demand	Bother	BDKRB1	22	42
CNS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450917368	ED	On-Demand	Bother	BDKRB1	22	42
OC[C@H]1CCCN(c2cc(NC[C@@H]3CCC[C@H]3O)ncn2)C1	ZINC000450917374	DD	On-Demand	Anodyne	PRCP	0	43
COc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1Cl	ZINC000450917377	EI	On-Demand	Anodyne	MAP	0	45
COc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1Cl	ZINC000450917377	EI	On-Demand	Anodyne	MAP1	110	41
COc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1Cl	ZINC000450917377	EI	On-Demand	Anodyne	PDE6A	43	34
COc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1Cl	ZINC000450917377	EI	On-Demand	Anodyne	PTPRG	0	41
COc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1Cl	ZINC000450917378	EI	On-Demand	Anodyne	MAP	0	45
COc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1Cl	ZINC000450917378	EI	On-Demand	Anodyne	MAP1	110	41
COc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1Cl	ZINC000450917378	EI	On-Demand	Anodyne	PDE6A	43	34
COc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1Cl	ZINC000450917378	EI	On-Demand	Anodyne	PTPRG	0	41
CC1CCN(C(=O)c2ccc(NCC(C)(C)C3(O)CCCC3)nc2)CC1	ZINC000450917381	FH	On-Demand	Anodyne	L3MBTL1	0	40
CC1CCN(C(=O)c2ccc(NCC(C)(C)C3(O)CCCC3)nc2)CC1	ZINC000450917381	FH	On-Demand	Anodyne	L3MBTL3	59	34
CC1CCN(C(=O)c2ccc(NCC(C)(C)C3(O)CCCC3)nc2)CC1	ZINC000450917381	FH	On-Demand	Anodyne	TRPC6	40	34
CC(C)(CNc1ncccc1C(=O)N1CCc2ccccc21)C1(O)CCCC1	ZINC000450917382	GI	On-Demand	Anodyne	AVPR2	68	40
Cc1cc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)n(C(C)(C)C)n1	ZINC000450917385	FD	On-Demand	Anodyne	DRD4	0	40
Oc1nnc(C2CCN(Cc3noc(-c4ccccc4)n3)CC2)o1	ZINC000450917392	EE	On-Demand	Anodyne	TNKS	18	41
COC(=O)c1ccc(OCCCCCC(C)=O)cc1OC	ZINC000450917393	CG	On-Demand	Anodyne	THRA	28	41
COC(=O)c1ccc(OCCCCCC(C)=O)cc1OC	ZINC000450917393	CG	On-Demand	Anodyne	P2RY12	35	44
COC(=O)c1ccc(OCCCCCC(C)=O)cc1OC	ZINC000450917393	CG	On-Demand	Anodyne	THRB	0	41
COC(=O)c1ccc(OCCCCCC(C)=O)cc1OC	ZINC000450917393	CG	On-Demand	Anodyne	ACAT	0	40
CC[C@H](CC(F)(F)F)C(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450917408	GI	On-Demand	Anodyne	AMY2	49	35
C[C@@H](c1nccs1)N1CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450917413	FH	On-Demand	Anodyne	SLC6A7	0	42
CNS(=O)(=O)NCC(=O)N(CCCOc1ccccc1)C1CCOCC1	ZINC000450917414	GC	On-Demand	Anodyne	LTA4H	28	41
C[C@H](c1nccs1)N1CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450917415	FH	On-Demand	Anodyne	SLC6A7	0	42
C=C(CC)CNc1nc2ccccc2nc1N1CCOCC1	ZINC000450917416	CF	On-Demand	Mild	PIK3CA	20	43
CC[C@H](C)[C@@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)C(=O)OC	ZINC000450917428	FD	On-Demand	Anodyne	ELANE	39	42
CC[C@@H](C)[C@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)C(=O)OC	ZINC000450917429	FD	On-Demand	Anodyne	ELANE	39	42
CC[C@H](C)[C@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)C(=O)OC	ZINC000450917431	FD	On-Demand	Anodyne	ELANE	39	42
CC[C@@H](C)[C@@H](NC(=O)Cn1c(=O)cnc2ccc(OC)cc21)C(=O)OC	ZINC000450917432	FD	On-Demand	Anodyne	ELANE	39	42
CCCOc1cccc(Cn2cnc(C)c(C)c2=O)c1	ZINC000450917433	CF	On-Demand	Anodyne	UPP1	52	41
CCOCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450917436	DC	On-Demand	Anodyne	AVPR1B	29	40
CCOCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450917436	DC	On-Demand	Anodyne	MTNR1A	47	43
CCOCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450917436	DC	On-Demand	Anodyne	MTNR1B	31	41
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccc2c(c1)OCCO2	ZINC000450917443	FD	On-Demand	Anodyne	DRD4	0	43
O=S(=O)(Cc1ccn(CC(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000450917453	FG	On-Demand	Anodyne	CACNA1B	44	32
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450917468	FH	On-Demand	Anodyne	RHOA	0	40
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450917468	FH	On-Demand	Anodyne	L3MBTL3	42	36
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450917470	FH	On-Demand	Anodyne	RHOA	0	40
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)CC1	ZINC000450917470	FH	On-Demand	Anodyne	L3MBTL3	42	36
COc1cc(CC(=O)N(CCCOc2ccccc2)C2CCOCC2)ccc1O	ZINC000450917471	GG	On-Demand	Anodyne	MBTPS1	59	36
COCc1ccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)cc1	ZINC000450917472	FD	On-Demand	Anodyne	PROKR1	51	31
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CC1	ZINC000450917474	FD	On-Demand	Anodyne	SMO	24	45
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CC1	ZINC000450917474	FD	On-Demand	Anodyne	NPFFR1	32	42
CNC(=O)c1cccc(CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450917476	DD	On-Demand	Anodyne	DRD4	31	42
CNC(=O)c1cccc(CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450917476	DD	On-Demand	Anodyne	SIGMAR1	23	42
CNC(=O)c1cccc(CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450917476	DD	On-Demand	Anodyne	MCHR1	36	42
O=S(=O)(C[C@@H]1CCC(F)(F)C1)c1cccc(C(F)(F)F)c1	ZINC000450917478	EH	On-Demand	Anodyne	CACNA1B	50	37
O=S(=O)(C[C@H]1CCC(F)(F)C1)c1cccc(C(F)(F)F)c1	ZINC000450917480	EH	On-Demand	Anodyne	CACNA1B	50	37
COc1ccccc1CCNC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450917482	FD	On-Demand	Anodyne	DRD4	25	45
COc1ccccc1CCNC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450917482	FD	On-Demand	Anodyne	MBTPS1	42	35
CCOc1cc(OCCCCCC(C)=O)ccc1[N+](=O)[O-]	ZINC000450917492	CH	On-Demand	Bother	PLA2G4B	64	33
CCOc1cc(OCCCCCC(C)=O)ccc1[N+](=O)[O-]	ZINC000450917492	CH	On-Demand	Bother	ACR	26	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](N(C)Cc2ncccn2)C1	ZINC000450917498	GE	On-Demand	Anodyne	CACNA1B	32	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@H](N(C)Cc2ncccn2)C1	ZINC000450917498	GE	On-Demand	Anodyne	CCR1	33	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](N(C)Cc2ncccn2)C1	ZINC000450917500	GE	On-Demand	Anodyne	CACNA1B	32	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CC[C@@H](N(C)Cc2ncccn2)C1	ZINC000450917500	GE	On-Demand	Anodyne	CCR1	33	41
COc1ccc2ncc(=O)n(CC(=O)NCCCO[C@@H](C)c3ccccc3)c2c1	ZINC000450917501	GF	On-Demand	Anodyne	AVPR1B	49	39
O=S(=O)(C[C@H]1CCCCC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000450917503	EI	On-Demand	Anodyne	CACNA1B	57	36
O=S(=O)(C[C@H]1CCCCC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000450917503	EI	On-Demand	Anodyne	CCR2	33	43
COc1ccc2ncc(=O)n(CC(=O)NCCCO[C@H](C)c3ccccc3)c2c1	ZINC000450917504	GF	On-Demand	Anodyne	AVPR1B	49	39
O=S(=O)(C[C@@H]1CCCCC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000450917505	EI	On-Demand	Anodyne	CACNA1B	57	36
O=S(=O)(C[C@@H]1CCCCC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000450917505	EI	On-Demand	Anodyne	CCR2	33	43
COC(=O)c1cccc(-c2nc(CN3CCC[C@H]3c3nc(=N)n(C)[nH]3)cs2)c1	ZINC000450917519	GE	On-Demand	Anodyne	COLA	0	40
COC(=O)c1cccc(-c2nc(CN3CCC[C@H]3c3nc(=N)n(C)[nH]3)cs2)c1	ZINC000450917519	GE	On-Demand	Anodyne	CPT1A	17	40
COC(=O)c1cccc(-c2nc(CN3CCC[C@@H]3c3nc(=N)n(C)[nH]3)cs2)c1	ZINC000450917520	GE	On-Demand	Anodyne	COLA	0	40
COC(=O)c1cccc(-c2nc(CN3CCC[C@@H]3c3nc(=N)n(C)[nH]3)cs2)c1	ZINC000450917520	GE	On-Demand	Anodyne	CPT1A	17	40
C=C(CC)CNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450917533	CE	On-Demand	Mild	PRCP	15	42
C=C(CC)CNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450917535	CE	On-Demand	Mild	PRCP	15	42
COCCn1c(NC(=O)CCOc2cccc(OC)c2)nc2ccccc21	ZINC000450917561	FG	On-Demand	Anodyne	INSR	28	43
COCCn1c(NC(=O)CCOc2cccc(OC)c2)nc2ccccc21	ZINC000450917561	FG	On-Demand	Anodyne	MTNR1A	22	41
COCC1(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)CCCC1	ZINC000450917567	FE	On-Demand	Anodyne	TGM2	15	42
COC(=O)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1F	ZINC000450917574	EE	On-Demand	Anodyne	MCHR1	34	40
CC(=O)CCCCCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450917580	GJ	On-Demand	Anodyne	SCD	23	49
CC(=O)CCCCCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450917580	GJ	On-Demand	Anodyne	RORB	0	40
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(Br)c(F)cc1O	ZINC000450917581	FE	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCN1C(=O)CCc1nc2cnccc2[nH]1	ZINC000450917587	DD	On-Demand	Anodyne	FKBP1A	40	41
CCOC(=O)[C@H]1CCCN1C(=O)CCc1nc2cnccc2[nH]1	ZINC000450917587	DD	On-Demand	Anodyne	PREP	52	41
O=C(NC1CC1)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450917616	DE	On-Demand	Bother	TAAR1	16	41
O=C(NC1CC1)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450917617	DE	On-Demand	Bother	TAAR1	16	41
COCC1(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCC1	ZINC000450917637	DE	On-Demand	Bother	TAAR1	17	43
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(C)C	ZINC000450917643	CE	On-Demand	Anodyne	ACE	23	41
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(C)C	ZINC000450917643	CE	On-Demand	Anodyne	PREP	40	44
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(C)C	ZINC000450917643	CE	On-Demand	Anodyne	FKBP12.6	0	49
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(C)C	ZINC000450917643	CE	On-Demand	Anodyne	TPP2	43	39
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(C)C	ZINC000450917643	CE	On-Demand	Anodyne	RHODESAIN	0	41
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccccc1Cc1ccccc1	ZINC000450917657	GG	On-Demand	Anodyne	DRD4	15	43
Cc1cccc(C)c1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450917661	EE	On-Demand	Anodyne	DRD4	26	57
CCOC(=O)[C@H]1CCCN1C(=O)c1cn(-c2cccnc2)nn1	ZINC000450917664	DC	On-Demand	Anodyne	FKBP1A	44	45
CCOC(=O)[C@H]1CCCN1C(=O)c1cn(-c2cccnc2)nn1	ZINC000450917664	DC	On-Demand	Anodyne	MTOR	0	44
C/C=C\C[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OCC	ZINC000450917673	FG	On-Demand	Anodyne	P2RY12	55	35
C/C=C/C[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OCC	ZINC000450917674	FG	On-Demand	Anodyne	P2RY12	55	35
C/C=C/C[C@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OCC	ZINC000450917675	FG	On-Demand	Anodyne	P2RY12	55	35
C/C=C\C[C@@H](NC(=O)Cc1scnc1-c1ccccc1)C(=O)OCC	ZINC000450917676	FG	On-Demand	Anodyne	P2RY12	55	35
CN(C(=O)[C@H]1CCN(CC2(C#N)CCC2)C1)c1ccccc1	ZINC000450917701	CF	On-Demand	Mild	SLC6A1	70	36
CN(C(=O)[C@@H]1CCN(CC2(C#N)CCC2)C1)c1ccccc1	ZINC000450917702	CF	On-Demand	Mild	SLC6A1	70	36
C/C=C/C[C@H](NC(=O)[C@@H](O)CCSC)C(=O)OCC	ZINC000450917703	CD	On-Demand	Anodyne	METAP2	21	49
C/C=C\C[C@H](NC(=O)[C@H](O)CCSC)C(=O)OCC	ZINC000450917704	CD	On-Demand	Anodyne	METAP2	21	49
C/C=C\C[C@H](NC(=O)[C@@H](O)CCSC)C(=O)OCC	ZINC000450917705	CD	On-Demand	Anodyne	METAP2	21	49
C/C=C/C[C@H](NC(=O)[C@H](O)CCSC)C(=O)OCC	ZINC000450917706	CD	On-Demand	Anodyne	METAP2	21	49
COc1ccc(CNC(=O)CCn2cnc3c(c2=O)CCCC3)c(OC)c1	ZINC000450917737	FD	On-Demand	Anodyne	BCHE	42	35
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CCCCC1	ZINC000450917783	GF	On-Demand	Anodyne	KCNA3	40	35
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CCCCC1	ZINC000450917783	GF	On-Demand	Anodyne	SMO	27	49
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CCCCC1	ZINC000450917783	GF	On-Demand	Anodyne	ACAT	0	44
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC1(c2ccccc2)CCCCC1	ZINC000450917783	GF	On-Demand	Anodyne	NPFFR1	31	41
COC(=O)C[C@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917784	GF	On-Demand	Anodyne	AVPR1B	48	37
COC(=O)C[C@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917784	GF	On-Demand	Anodyne	PDE6D	75	36
COC(=O)C[C@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917784	GF	On-Demand	Anodyne	ADAM17	24	41
COC(=O)C[C@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917784	GF	On-Demand	Anodyne	ADAMTS1	0	41
COC(=O)C[C@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917784	GF	On-Demand	Anodyne	IMDH_CRYPV	38	49
COC(=O)C[C@@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917785	GF	On-Demand	Anodyne	AVPR1B	48	37
COC(=O)C[C@@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917785	GF	On-Demand	Anodyne	PDE6D	75	36
COC(=O)C[C@@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917785	GF	On-Demand	Anodyne	ADAM17	24	41
COC(=O)C[C@@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917785	GF	On-Demand	Anodyne	ADAMTS1	0	41
COC(=O)C[C@@]1(NC(=O)Cn2c(-c3ccccc3)nc3ccccc32)CCOC1	ZINC000450917785	GF	On-Demand	Anodyne	IMDH_CRYPV	38	49
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C#N)n1C	ZINC000450917788	CD	On-Demand	Mild	PREP	44	37
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C#N)n1C	ZINC000450917788	CD	On-Demand	Mild	LGMN	52	34
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C#N)n1C	ZINC000450917788	CD	On-Demand	Mild	FKBP12.6	0	43
N=c1[nH]c(NC[C@@H](O)C2CCC2)ncc1[N+](=O)[O-]	ZINC000450917793	CC	On-Demand	Bother	PRKCQ	43	34
N=c1[nH]c(NC[C@H](O)C2CCC2)ncc1[N+](=O)[O-]	ZINC000450917798	CC	On-Demand	Bother	PRKCQ	43	34
O=C(c1cc(NC[C@@H]2C[C@H]2C2CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450917800	EG	On-Demand	Bother	L3MBTL1	0	41
O=[N+]([O-])c1ccc(-c2csc(NC[C@H](O)C3CCC3)n2)cc1	ZINC000450917807	DF	On-Demand	Bother	MAOB	26	54
O=[N+]([O-])c1ccc(-c2csc(NC[C@@H](O)C3CCC3)n2)cc1	ZINC000450917808	DF	On-Demand	Bother	MAOB	26	54
Cc1ccc(-c2csc(NC(=O)CN3CCC(c4nnc(O)o4)CC3)n2)cc1	ZINC000450917809	GG	On-Demand	Anodyne	DRD4	0	40
Cc1ccc(-c2csc(NC(=O)CN3CCC(c4nnc(O)o4)CC3)n2)cc1	ZINC000450917809	GG	On-Demand	Anodyne	HDAC9	15	47
Cc1cccc(Cl)c1C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1	ZINC000450917815	EH	On-Demand	Anodyne	CCR5	28	44
Cc1cccc(Cl)c1C(=O)N1CCC[C@H](CC(=O)OC(C)C)C1	ZINC000450917816	EH	On-Demand	Anodyne	CCR5	28	44
Cc1ccc(NC(=O)CCN2CCC(c3nnc(O)o3)CC2)nc1	ZINC000450917822	ED	On-Demand	Anodyne	DRD4	0	40
C=C(CC)CNc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-]	ZINC000450917829	DD	On-Demand	Mild	TAAR1	18	48
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450917832	GE	On-Demand	Anodyne	FKBP1A	82	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450917832	GE	On-Demand	Anodyne	PREP	78	38
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450917832	GE	On-Demand	Anodyne	LGMN	54	39
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccc(OC)c(OC)c3)c2c1	ZINC000450917836	GD	On-Demand	Anodyne	MTNR1A	55	44
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccc(OC)c(OC)c3)c2c1	ZINC000450917836	GD	On-Demand	Anodyne	MTNR1B	47	44
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccc(OC)c(OC)c3)c2c1	ZINC000450917836	GD	On-Demand	Anodyne	ABCG2	25	40
COc1ccc2ncc(=O)n(CC(=O)NCCc3ccc(OC)c(OC)c3)c2c1	ZINC000450917836	GD	On-Demand	Anodyne	PROKR1	53	31
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450917838	GE	On-Demand	Anodyne	FKBP1A	82	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450917838	GE	On-Demand	Anodyne	PREP	78	38
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3cccc(C)c3)n2C1	ZINC000450917838	GE	On-Demand	Anodyne	LGMN	54	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](O)C1CCC1	ZINC000450917839	CC	On-Demand	Anodyne	TPP2	46	46
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](O)C1CCC1	ZINC000450917847	CC	On-Demand	Anodyne	TPP2	46	46
COc1ccc2ncc(=O)n(CC(=O)NCCCOc3cccc(C)c3)c2c1	ZINC000450917848	GE	On-Demand	Anodyne	DRD4	40	33
COc1ccc2ncc(=O)n(CC(=O)NCCCOc3cccc(C)c3)c2c1	ZINC000450917848	GE	On-Demand	Anodyne	AVPR1B	62	49
COc1ccc2ncc(=O)n(CC(=O)NCCCOc3cccc(C)c3)c2c1	ZINC000450917848	GE	On-Demand	Anodyne	MTNR1A	58	41
COc1ccc2ncc(=O)n(CC(=O)NCCCOc3cccc(C)c3)c2c1	ZINC000450917848	GE	On-Demand	Anodyne	MTNR1B	52	43
COCC1(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)CCCC1	ZINC000450917849	EH	On-Demand	Anodyne	PTR1	47	35
COCC1(CNc2ccc(C(=O)N3CCC(C)CC3)cn2)CCCC1	ZINC000450917849	EH	On-Demand	Anodyne	L3MBTL3	62	39
COC(C)(C)C(=O)Cn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450917866	GG	On-Demand	Anodyne	SCD	19	46
CCOC(=O)[C@H]1CCCN1C(=O)c1c2n(c(=O)n1C)CCCC2	ZINC000450917871	DC	On-Demand	Anodyne	FKBP12.6	0	46
C[C@@H]1CCCN1C(=O)CCN1CCC(c2nnc(O)o2)CC1	ZINC000450917881	DD	On-Demand	Anodyne	PRCP	40	36
C[C@H]1CCCN1C(=O)CCN1CCC(c2nnc(O)o2)CC1	ZINC000450917883	DD	On-Demand	Anodyne	PRCP	40	36
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc2c1CCCC2	ZINC000450917900	DF	On-Demand	Anodyne	FKBP1A	73	40
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc2c1CCCC2	ZINC000450917900	DF	On-Demand	Anodyne	AVPR2	27	43
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc2c1CCCC2	ZINC000450917900	DF	On-Demand	Anodyne	FABP4	43	35
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc2c1CCCC2	ZINC000450917900	DF	On-Demand	Anodyne	PREP	64	39
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc2c1CCCC2	ZINC000450917900	DF	On-Demand	Anodyne	FKBP12.6	0	42
COc1ccc2ncc(=O)n(CC(=O)N[C@H](c3ccc(C)cc3)C3CC3)c2c1	ZINC000450917908	GF	On-Demand	Anodyne	AVPR1B	56	37
COc1ccc2ncc(=O)n(CC(=O)N[C@@H](c3ccc(C)cc3)C3CC3)c2c1	ZINC000450917910	GF	On-Demand	Anodyne	AVPR1B	56	37
CNC(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450917921	CE	On-Demand	Bother	TAAR1	16	41
O=S(=O)(c1ccc(N2CCC[C@@H]2c2ccc(F)cc2F)nc1)N1CCCC1	ZINC000450917924	GG	On-Demand	Anodyne	GCKR	44	35
O=S(=O)(c1ccc(N2CCC[C@H]2c2ccc(F)cc2F)nc1)N1CCCC1	ZINC000450917926	GG	On-Demand	Anodyne	GCKR	44	35
COc1ccc2ncc(=O)n(CC(=O)NCCSc3ccc(C)cc3)c2c1	ZINC000450917928	GF	On-Demand	Anodyne	MTNR1A	25	40
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1nc2c(s1)CCC2	ZINC000450917935	ED	On-Demand	Anodyne	SLC27A1	54	50
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450917937	FG	On-Demand	Anodyne	FKBP1A	60	38
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450917937	FG	On-Demand	Anodyne	PREP	64	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450917937	FG	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450917937	FG	On-Demand	Anodyne	RBP4	73	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450917937	FG	On-Demand	Anodyne	SFRP1	56	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450917937	FG	On-Demand	Anodyne	WNT3	58	37
NC(=O)c1cnc(N2CCC[C@H]2c2ccc(F)cc2F)c(Cl)c1	ZINC000450917946	EG	On-Demand	Anodyne	CXCR3	28	40
NC(=O)c1cnc(N2CCC[C@@H]2c2ccc(F)cc2F)c(Cl)c1	ZINC000450917947	EG	On-Demand	Anodyne	CXCR3	28	40
CCCNC(=O)CN(C)C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450917958	EC	On-Demand	Anodyne	AVPR1B	26	40
CCCNC(=O)CN(C)C(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450917958	EC	On-Demand	Anodyne	MTNR1B	27	40
COc1ccc2ncc(=O)n(CCCC(C)(C)C#N)c2c1	ZINC000450917961	CF	On-Demand	Mild	GSG2	40	35
C/C=C\C[C@@H](NC(=O)c1cnn2ccc(C)cc12)C(=O)OCC	ZINC000450917966	DE	On-Demand	Anodyne	EPHB3	32	46
C/C=C\C[C@H](NC(=O)c1cnn2ccc(C)cc12)C(=O)OCC	ZINC000450917967	DE	On-Demand	Anodyne	EPHB3	32	46
C/C=C/C[C@@H](NC(=O)c1cnn2ccc(C)cc12)C(=O)OCC	ZINC000450917968	DE	On-Demand	Anodyne	EPHB3	32	46
C/C=C/C[C@H](NC(=O)c1cnn2ccc(C)cc12)C(=O)OCC	ZINC000450917969	DE	On-Demand	Anodyne	EPHB3	32	46
CNC(=O)[C@@]1(C)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450917974	CE	On-Demand	Anodyne	DRD4	16	43
CNC(=O)[C@@]1(C)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450917974	CE	On-Demand	Anodyne	SIGMAR1	17	40
CNC(=O)[C@@]1(C)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450917974	CE	On-Demand	Anodyne	CCR1	43	36
CNC(=O)[C@]1(C)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450917975	CE	On-Demand	Anodyne	DRD4	16	43
CNC(=O)[C@]1(C)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450917975	CE	On-Demand	Anodyne	SIGMAR1	17	40
CNC(=O)[C@]1(C)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450917975	CE	On-Demand	Anodyne	CCR1	43	36
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCO[C@H](C)C2)O1	ZINC000450917984	EG	On-Demand	Anodyne	DRD2	30	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCO[C@H](C)C2)O1	ZINC000450917984	EG	On-Demand	Anodyne	DRD4	0	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCO[C@H](C)C2)O1	ZINC000450917984	EG	On-Demand	Anodyne	SLC18A3	0	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCO[C@H](C)C2)O1	ZINC000450917984	EG	On-Demand	Anodyne	CYP2J2	47	34
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCO[C@H](C)C2)O1	ZINC000450917985	EG	On-Demand	Anodyne	DRD2	30	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCO[C@H](C)C2)O1	ZINC000450917985	EG	On-Demand	Anodyne	DRD4	0	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCO[C@H](C)C2)O1	ZINC000450917985	EG	On-Demand	Anodyne	SLC18A3	0	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCO[C@H](C)C2)O1	ZINC000450917985	EG	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1C[C@]2(CCO1)CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450917986	EG	On-Demand	Anodyne	DRD2	30	45
C[C@@H]1C[C@]2(CCO1)CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450917986	EG	On-Demand	Anodyne	DRD4	0	45
C[C@@H]1C[C@]2(CCO1)CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450917986	EG	On-Demand	Anodyne	SLC18A3	0	45
C[C@@H]1C[C@]2(CCO1)CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450917986	EG	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1C[C@@]2(CCO1)CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450917987	EG	On-Demand	Anodyne	DRD2	30	45
C[C@@H]1C[C@@]2(CCO1)CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450917987	EG	On-Demand	Anodyne	DRD4	0	45
C[C@@H]1C[C@@]2(CCO1)CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450917987	EG	On-Demand	Anodyne	SLC18A3	0	45
C[C@@H]1C[C@@]2(CCO1)CN(CCCC(=O)c1ccc(F)cc1)C[C@@H](C)O2	ZINC000450917987	EG	On-Demand	Anodyne	CYP2J2	47	34
CC(C)C[C@@H](C)N1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918001	CG	On-Demand	Anodyne	AGTR2	0	41
CC(C)C[C@@H](C)N1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918001	CG	On-Demand	Anodyne	CHRNA4	0	41
CC(C)C[C@@H](C)N1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918001	CG	On-Demand	Anodyne	FASN	41	43
CC(C)C[C@H](C)N1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918002	CG	On-Demand	Anodyne	AGTR2	0	41
CC(C)C[C@H](C)N1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918002	CG	On-Demand	Anodyne	CHRNA4	0	41
CC(C)C[C@H](C)N1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918002	CG	On-Demand	Anodyne	FASN	41	43
CC(C)C[C@@H](C)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918003	CG	On-Demand	Anodyne	AGTR2	0	41
CC(C)C[C@@H](C)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918003	CG	On-Demand	Anodyne	CHRNA4	0	41
CC(C)C[C@@H](C)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918003	CG	On-Demand	Anodyne	FASN	41	43
CC(C)C[C@H](C)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918004	CG	On-Demand	Anodyne	AGTR2	0	41
CC(C)C[C@H](C)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450918004	CG	On-Demand	Anodyne	CHRNA4	0	41
C/C=C\C[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OCC	ZINC000450918011	DF	On-Demand	Anodyne	SELE	48	35
C/C=C\C[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OCC	ZINC000450918011	DF	On-Demand	Anodyne	ICAM1	48	35
C/C=C\C[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OCC	ZINC000450918012	DF	On-Demand	Anodyne	SELE	48	35
C/C=C\C[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OCC	ZINC000450918012	DF	On-Demand	Anodyne	ICAM1	48	35
C/C=C/C[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OCC	ZINC000450918013	DF	On-Demand	Anodyne	SELE	48	35
C/C=C/C[C@@H](NC(=O)c1cc2ccncc2s1)C(=O)OCC	ZINC000450918013	DF	On-Demand	Anodyne	ICAM1	48	35
C/C=C/C[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OCC	ZINC000450918014	DF	On-Demand	Anodyne	SELE	48	35
C/C=C/C[C@H](NC(=O)c1cc2ccncc2s1)C(=O)OCC	ZINC000450918014	DF	On-Demand	Anodyne	ICAM1	48	35
CCn1c(SCC2(OC)CCC2)nc2ccc(F)cc2c1=O	ZINC000450918026	DG	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	35
O=C(CCCN(CCc1ccccn1)Cc1cccnc1)c1ccccc1	ZINC000450918034	FI	On-Demand	Anodyne	TBXAS1	42	40
O=C(CCCN(CCc1ccccn1)Cc1cccnc1)c1ccccc1	ZINC000450918034	FI	On-Demand	Anodyne	FAAH	68	40
O=C(CCCN(CCc1ccccn1)Cc1cccnc1)c1ccccc1	ZINC000450918034	FI	On-Demand	Anodyne	CES1	56	40
O=C(CCCN(CCc1ccccn1)Cc1cccnc1)c1ccccc1	ZINC000450918034	FI	On-Demand	Anodyne	FAAH2	0	40
O=C(CCCN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1)c1ccccc1	ZINC000450918054	FG	On-Demand	Anodyne	HTR2A	15	42
O=C(CCCN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1)c1ccccc1	ZINC000450918054	FG	On-Demand	Anodyne	HTR2C	15	42
O=C(CCCN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1)c1ccccc1	ZINC000450918054	FG	On-Demand	Anodyne	SIGMAR1	17	42
O=C(CCCN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1)c1ccccc1	ZINC000450918054	FG	On-Demand	Anodyne	CYP2J2	59	41
Cc1nccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450918066	DF	On-Demand	Anodyne	DRD2	27	51
Cc1nccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450918066	DF	On-Demand	Anodyne	DRD1	0	43
Cc1nccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450918066	DF	On-Demand	Anodyne	DRD4	45	42
Cc1nccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450918066	DF	On-Demand	Anodyne	ABCC1	111	47
Cc1nccnc1N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450918066	DF	On-Demand	Anodyne	ABCB1A	55	37
C=C(CC)CNc1cc(CC)nc2ncnn12	ZINC000450918076	BE	On-Demand	Mild	DHOD	0	56
COCC1(CNc2cc(C(F)(F)F)nc3ncnn23)CCCC1	ZINC000450918079	EF	On-Demand	Anodyne	DHOD	0	50
Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450918081	GE	On-Demand	Anodyne	DRD4	0	44
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	F2	42	35
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	ACE	41	42
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	FKBP1A	90	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	TRY1_BOVIN	51	34
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	CPT1A	47	34
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	PREP	115	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	LGMN	54	33
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918095	FE	On-Demand	Anodyne	TMPRSS11D	47	32
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	F2	42	35
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	ACE	41	42
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	FKBP1A	90	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	TRY1_BOVIN	51	34
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	CPT1A	47	34
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	PREP	115	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	LGMN	54	33
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450918096	FE	On-Demand	Anodyne	TMPRSS11D	47	32
COc1cc([N+](=O)[O-])ccc1CN1CCC(c2nnc(O)o2)CC1	ZINC000450918106	EE	On-Demand	Bother	SSTR5	33	46
COc1cc([N+](=O)[O-])ccc1CN1CCC(c2nnc(O)o2)CC1	ZINC000450918106	EE	On-Demand	Bother	ABHD6	0	42
CCOC(=O)[C@H]1CCCN1C(=O)CC1CC(F)(F)C1	ZINC000450918119	CD	On-Demand	Anodyne	FKBP1A	34	40
CCOC(=O)[C@H]1CCCN1C(=O)CC1CC(F)(F)C1	ZINC000450918119	CD	On-Demand	Anodyne	FKBP12.6	0	49
COc1ccc2ncc(=O)n(CCCSCC(C)C)c2c1	ZINC000450918120	DG	On-Demand	Anodyne	GSG2	40	36
COCCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450918122	DC	On-Demand	Anodyne	AVPR1B	35	40
COCCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450918122	DC	On-Demand	Anodyne	MTNR1A	48	41
COCCCNC(=O)Cn1c(=O)cnc2ccc(OC)cc21	ZINC000450918122	DC	On-Demand	Anodyne	MTNR1B	33	40
C=C(CC)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000450918136	FD	On-Demand	Mild	PDE5A	20	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450918146	FG	On-Demand	Anodyne	FKBP1A	45	36
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450918146	FG	On-Demand	Anodyne	SLC6A1	45	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450918146	FG	On-Demand	Anodyne	SLC6A3	21	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450918146	FG	On-Demand	Anodyne	PREP	46	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450918146	FG	On-Demand	Anodyne	FKBP12.6	0	45
CCc1ccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)s1	ZINC000450918165	FE	On-Demand	Anodyne	AVPR1B	42	39
CCc1ccc(CNC(=O)Cn2c(=O)cnc3ccc(OC)cc32)s1	ZINC000450918165	FE	On-Demand	Anodyne	MTNR1A	41	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450918175	FG	On-Demand	Anodyne	FKBP1A	42	36
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450918175	FG	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450918175	FG	On-Demand	Anodyne	WNT3	40	31
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450918178	FE	On-Demand	Anodyne	FKBP1A	73	43
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(OC)c(OC)c1Cl	ZINC000450918178	FE	On-Demand	Anodyne	FKBP12.6	0	40
C=C(CC)CNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	ZINC000450918183	FE	On-Demand	Mild	BCL2L1	49	38
COc1ccc2ncc(=O)n(CC(=O)NC3CCCCC3)c2c1	ZINC000450918185	DD	On-Demand	Anodyne	AVPR1B	48	47
COc1ccc2ncc(=O)n(CC(=O)NC3CCCCC3)c2c1	ZINC000450918185	DD	On-Demand	Anodyne	P2RY12	0	45
COc1ccc2ncc(=O)n(CC(=O)NC3CCCCC3)c2c1	ZINC000450918185	DD	On-Demand	Anodyne	FAAH	24	41
Cc1ccccc1C[C@H](C)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450918188	FE	On-Demand	Anodyne	DRD4	22	46
Cc1ccccc1C[C@@H](C)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450918190	FE	On-Demand	Anodyne	DRD4	22	46
Cc1cnc(N2CCC[C@H]2c2ccc(F)cc2F)nc1	ZINC000450918191	CG	On-Demand	Anodyne	PRCP	43	31
Cc1cnc(N2CCC[C@@H]2c2ccc(F)cc2F)nc1	ZINC000450918193	CG	On-Demand	Anodyne	PRCP	43	31
C[C@@H](C(=O)N[C@H](C)c1ccc2ccccc2c1)N1CCC(c2nnc(O)o2)CC1	ZINC000450918209	GG	On-Demand	Anodyne	SMO	47	35
C[C@H](NC(=O)[C@H](C)N1CCC(c2nnc(O)o2)CC1)c1ccc2ccccc2c1	ZINC000450918210	GG	On-Demand	Anodyne	SMO	47	35
C[C@@H](NC(=O)[C@@H](C)N1CCC(c2nnc(O)o2)CC1)c1ccc2ccccc2c1	ZINC000450918211	GG	On-Demand	Anodyne	SMO	47	35
C[C@H](NC(=O)[C@@H](C)N1CCC(c2nnc(O)o2)CC1)c1ccc2ccccc2c1	ZINC000450918212	GG	On-Demand	Anodyne	SMO	47	35
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000450918219	GG	On-Demand	Anodyne	DRD4	0	41
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000450918219	GG	On-Demand	Anodyne	PRCP	23	40
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000450918220	GG	On-Demand	Anodyne	DRD4	0	41
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000450918220	GG	On-Demand	Anodyne	PRCP	23	40
Oc1nnc(C2CCN(CCCc3ccncc3)CC2)o1	ZINC000450918222	CD	On-Demand	Anodyne	SIGMAR1	15	41
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450918226	FG	On-Demand	Anodyne	FKBP1A	63	42
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450918226	FG	On-Demand	Anodyne	PREP	40	35
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)[nH]1	ZINC000450918227	DE	On-Demand	Anodyne	FKBP12.6	0	45
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450918254	EE	On-Demand	Anodyne	FKBP1A	53	40
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc2ccccc2c(O)n1	ZINC000450918254	EE	On-Demand	Anodyne	PREP	62	41
Cc1cc(NCc2cnc(C3CC3)o2)c2cccc([N+](=O)[O-])c2n1	ZINC000450918255	DH	On-Demand	Bother	PRKCQ	44	37
CCOC(=O)c1ccc(CN[C@H](c2ccc(C)cc2)[C@@H](C)S(C)(=O)=O)nc1	ZINC000450918259	GF	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)c1ccc(CN[C@@H](c2ccc(C)cc2)[C@@H](C)S(C)(=O)=O)nc1	ZINC000450918261	GF	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)c1ccc(CN[C@@H](c2ccc(C)cc2)[C@H](C)S(C)(=O)=O)nc1	ZINC000450918262	GF	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)c1ccc(CN[C@H](c2ccc(C)cc2)[C@H](C)S(C)(=O)=O)nc1	ZINC000450918263	GF	On-Demand	Anodyne	P2RY12	21	41
COc1cccc(OCCC(=O)NC[C@@]2(OC)CCOC2)c1	ZINC000450918264	DD	On-Demand	Anodyne	MTNR1A	43	45
CCOC(=O)[C@H]1CCCN1C(=O)C[C@@H]1CSc2ccccc2O1	ZINC000450918265	EE	On-Demand	Anodyne	PREP	54	35
COc1cccc(OCCC(=O)NC[C@]2(OC)CCOC2)c1	ZINC000450918266	DD	On-Demand	Anodyne	MTNR1A	43	45
CCOC(=O)[C@H]1CCCN1C(=O)C[C@H]1CSc2ccccc2O1	ZINC000450918267	EE	On-Demand	Anodyne	PREP	54	35
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450918272	GF	On-Demand	Anodyne	CACNA1I	42	34
COCC1(CNc2ncccc2C(=O)N2CCc3ccccc32)CCCC1	ZINC000450918285	FH	On-Demand	Anodyne	AVPR2	44	36
C=C(C)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450918299	FI	On-Demand	Mild	SCD	19	48
COC(=O)c1ccccc1OCCN1CCC(c2nnc(O)o2)CC1	ZINC000450918306	ED	On-Demand	Anodyne	HRH1	30	44
COC(=O)c1ccccc1OCCN1CCC(c2nnc(O)o2)CC1	ZINC000450918306	ED	On-Demand	Anodyne	HCN1	44	33
CSc1ccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450918332	EE	On-Demand	Anodyne	DRD4	19	45
CN(C(=O)[C@@H]1CCN(Cc2ccccc2OC2CC2)C1)c1ccccc1	ZINC000450918339	FH	On-Demand	Anodyne	MLNR	26	46
CN(C(=O)[C@H]1CCN(Cc2ccccc2OC2CC2)C1)c1ccccc1	ZINC000450918341	FH	On-Demand	Anodyne	MLNR	26	46
CCOC(=O)[C@H]1CCCN1C(=O)CCCn1nc(C)nc1C	ZINC000450918342	DD	On-Demand	Anodyne	PREP	32	41
CCOC(=O)[C@H]1CCCN1C(=O)CCCn1nc(C)nc1C	ZINC000450918342	DD	On-Demand	Anodyne	FKBP12.6	0	42
COc1cc(CN2CCC(c3nnc(O)o3)CC2)ccn1	ZINC000450918357	CD	On-Demand	Anodyne	SSTR5	61	37
CC(F)(F)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450918364	FI	On-Demand	Mild	SCD	21	50
O=C(CN1CCC(c2nnc(O)o2)CC1)NCCc1cccc(Cl)c1Cl	ZINC000450918387	GF	On-Demand	Anodyne	DRD4	0	40
CCCC[C@@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC(C)(C)C	ZINC000450918396	DG	On-Demand	Anodyne	PGA5	41	38
CCCC[C@@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC(C)(C)C	ZINC000450918396	DG	On-Demand	Anodyne	NOD1	56	33
CCCC[C@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC(C)(C)C	ZINC000450918397	DG	On-Demand	Anodyne	PGA5	41	38
CCCC[C@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC(C)(C)C	ZINC000450918397	DG	On-Demand	Anodyne	NOD1	56	33
CNC(=O)[C@@]1(C)CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450918400	FD	On-Demand	Anodyne	MTNR1A	44	33
CNC(=O)[C@]1(C)CCN(CCC(=O)NCc2ccc(OC)cc2OC)C1	ZINC000450918401	FD	On-Demand	Anodyne	MTNR1A	44	33
CCCC[C@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC(C)(C)C	ZINC000450918402	EG	On-Demand	Anodyne	SSTR2	47	33
CCCC[C@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC(C)(C)C	ZINC000450918402	EG	On-Demand	Anodyne	P2RY12	63	34
CCCC[C@@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC(C)(C)C	ZINC000450918403	EG	On-Demand	Anodyne	SSTR2	47	33
CCCC[C@@H](NC(=O)c1c[nH]c2nccc-2c1)C(=O)OC(C)(C)C	ZINC000450918403	EG	On-Demand	Anodyne	P2RY12	63	34
CCOC(=O)[C@H]1CCCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450918442	CD	On-Demand	Anodyne	PREP	40	33
CCOC(=O)[C@H]1CCCN1C(=O)c1cc2n(n1)CCCC2	ZINC000450918442	CD	On-Demand	Anodyne	FKBP12.6	0	44
CN(C)S(=O)(=O)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450918444	FD	On-Demand	Anodyne	SSTR5	19	43
O=C(CN1CCC(c2nnc(O)o2)CC1)NC12CC3CC(CC(C3)C1)C2	ZINC000450918449	FE	On-Demand	Anodyne	EPHX2	44	50
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450918450	DD	On-Demand	Anodyne	FKBP1A	43	38
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450918450	DD	On-Demand	Anodyne	PREP	40	36
COC(=O)CNC(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450918465	ED	On-Demand	Bother	TAAR1	16	41
C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC(c2nnc(O)o2)CC1	ZINC000450918472	GF	On-Demand	Anodyne	ADAM17	34	41
C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC(c2nnc(O)o2)CC1	ZINC000450918473	GF	On-Demand	Anodyne	ADAM17	34	41
C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC(c2nnc(O)o2)CC1	ZINC000450918474	GF	On-Demand	Anodyne	ADAM17	34	41
C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC(c2nnc(O)o2)CC1	ZINC000450918475	GF	On-Demand	Anodyne	ADAM17	34	41
O=S(=O)(NCC1CC1)c1ccc(NC[C@H](O)C2CCC2)nc1	ZINC000450918476	ED	On-Demand	Anodyne	NPY2R	53	37
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H](O)C2CCC2)nc1	ZINC000450918477	ED	On-Demand	Anodyne	NPY2R	53	37
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450918478	CD	On-Demand	Anodyne	FKBP1A	50	40
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450918478	CD	On-Demand	Anodyne	PREP	31	40
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(=O)C1CC1	ZINC000450918478	CD	On-Demand	Anodyne	FKBP12.6	0	52
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1C[C@H]1C1CC1	ZINC000450918479	DD	On-Demand	Anodyne	CA2	37	49
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1C[C@H]1C1CC1	ZINC000450918479	DD	On-Demand	Anodyne	CA7	34	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1C[C@H]1C1CC1	ZINC000450918479	DD	On-Demand	Anodyne	CA4	40	37
COC(=O)C[C@@]1(NC(=O)Cc2cc3ccccc3s2)CCOC1	ZINC000450918480	EE	On-Demand	Anodyne	AROQ	28	42
COC(=O)C[C@]1(NC(=O)Cc2cc3ccccc3s2)CCOC1	ZINC000450918481	EE	On-Demand	Anodyne	AROQ	28	42
CCOC(=O)[C@H]1CCCN1C(=O)c1ccsc1Br	ZINC000450918504	EF	On-Demand	Anodyne	FKBP12.6	0	44
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450918505	FD	On-Demand	Bother	DRD4	0	62
Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450918522	GF	On-Demand	Anodyne	DRD4	0	44
COC(=O)C[C@@]1(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCOC1	ZINC000450918536	FF	On-Demand	Anodyne	RBP4	59	35
COC(=O)C[C@]1(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCOC1	ZINC000450918537	FF	On-Demand	Anodyne	RBP4	59	35
COc1cc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cnoc2C)ccc1O	ZINC000450918554	GD	On-Demand	Anodyne	TRPV1	26	46
CCCOc1cccc(Cn2ccnc2[C@H](C)OCC)c1	ZINC000450918560	CH	On-Demand	Anodyne	UPP1	32	42
CCCOc1cccc(Cn2ccnc2[C@@H](C)OCC)c1	ZINC000450918561	CH	On-Demand	Anodyne	UPP1	32	42
C/C=C/C[C@@H](NC(=O)c1cccc(CC)n1)C(=O)OCC	ZINC000450918564	CE	On-Demand	Anodyne	PDE5A	27	40
C/C=C/C[C@H](NC(=O)c1cccc(CC)n1)C(=O)OCC	ZINC000450918565	CE	On-Demand	Anodyne	PDE5A	27	40
C/C=C\C[C@@H](NC(=O)c1cccc(CC)n1)C(=O)OCC	ZINC000450918566	CE	On-Demand	Anodyne	PDE5A	27	40
C/C=C\C[C@H](NC(=O)c1cccc(CC)n1)C(=O)OCC	ZINC000450918567	CE	On-Demand	Anodyne	PDE5A	27	40
C/C=C/C[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OCC	ZINC000450918583	DD	On-Demand	Anodyne	PROTEASE	22	43
C/C=C\C[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OCC	ZINC000450918584	DD	On-Demand	Anodyne	PROTEASE	22	43
C/C=C/C[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OCC	ZINC000450918585	DD	On-Demand	Anodyne	PROTEASE	22	43
C/C=C\C[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OCC	ZINC000450918586	DD	On-Demand	Anodyne	PROTEASE	22	43
CO[C@@H](Cc1ccccc1)CN1CCC=C(C)C1	ZINC000450918603	BF	On-Demand	Anodyne	CHRNA6	0	42
CO[C@H](Cc1ccccc1)CN1CCC=C(C)C1	ZINC000450918604	BF	On-Demand	Anodyne	CHRNA6	0	42
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccc(F)cc1	ZINC000450918637	DD	On-Demand	Anodyne	DRD4	0	54
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450918639	GE	On-Demand	Mild	PGR	18	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450918645	GE	On-Demand	Mild	PGR	18	41
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc2c1O[C@H](C)C2	ZINC000450918658	DE	On-Demand	Anodyne	PREP	40	35
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc2c1O[C@@H](C)C2	ZINC000450918659	DE	On-Demand	Anodyne	PREP	40	35
COc1cc(CN2CCC(c3nnc(O)o3)CC2)ccc1[N+](=O)[O-]	ZINC000450918662	EE	On-Demand	Bother	SSTR5	69	48
COCC1(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CCCC1	ZINC000450918669	EG	On-Demand	Bother	TAAR1	19	48
N#Cc1ccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450918670	ED	On-Demand	Mild	DRD4	0	46
N#Cc1ccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450918670	ED	On-Demand	Mild	CETP	37	41
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)C1CCC1	ZINC000450918672	DD	On-Demand	Bother	TBXA2R	28	42
CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)C1CCC1	ZINC000450918673	DD	On-Demand	Bother	TBXA2R	28	42
CCCc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450918691	DG	On-Demand	Anodyne	SSTR5	44	33
CCOC(=O)[C@H]1CCCN1C(=O)c1nn(C)c2c1CCCC2	ZINC000450918694	DD	On-Demand	Anodyne	FKBP12.6	0	45
O=[N+]([O-])c1cccnc1NC[C@@H]1C[C@H]1C1CC1	ZINC000450918707	BE	On-Demand	Bother	PRKCQ	46	37
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918770	FH	On-Demand	Anodyne	DRD4	0	44
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918770	FH	On-Demand	Anodyne	HTR2A	22	50
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918770	FH	On-Demand	Anodyne	HTR2C	23	56
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918770	FH	On-Demand	Anodyne	SLC6A1	107	41
CN(C(=O)[C@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918770	FH	On-Demand	Anodyne	CYP2J2	70	50
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918771	FH	On-Demand	Anodyne	DRD4	0	44
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918771	FH	On-Demand	Anodyne	HTR2A	22	50
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918771	FH	On-Demand	Anodyne	HTR2C	23	56
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918771	FH	On-Demand	Anodyne	SLC6A1	107	41
CN(C(=O)[C@@H]1CCN(CCCC(=O)c2ccccc2)C1)c1ccccc1	ZINC000450918771	FH	On-Demand	Anodyne	CYP2J2	70	50
CCCC[C@H](NC(=O)CNS(=O)(=O)NC)C(=O)OC(C)(C)C	ZINC000450918772	EC	On-Demand	Anodyne	CTSK	25	47
CCCC[C@H](NC(=O)CNS(=O)(=O)NC)C(=O)OC(C)(C)C	ZINC000450918772	EC	On-Demand	Anodyne	NOD1	85	35
CCCC[C@@H](NC(=O)CNS(=O)(=O)NC)C(=O)OC(C)(C)C	ZINC000450918773	EC	On-Demand	Anodyne	CTSK	25	47
CCCC[C@@H](NC(=O)CNS(=O)(=O)NC)C(=O)OC(C)(C)C	ZINC000450918773	EC	On-Demand	Anodyne	NOD1	85	35
CCC[C@@H](O)CN(CCc1ccccn1)Cc1cccnc1	ZINC000450918776	CF	On-Demand	Anodyne	GRIN1	27	47
CCC[C@H](O)CN(CCc1ccccn1)Cc1cccnc1	ZINC000450918777	CF	On-Demand	Anodyne	GRIN1	27	47
C/C=C/C[C@H](NC(=O)CCCC(C)C)C(=O)OCC	ZINC000450918786	CF	On-Demand	Anodyne	NOD1	99	46
C/C=C\C[C@@H](NC(=O)CCCC(C)C)C(=O)OCC	ZINC000450918787	CF	On-Demand	Anodyne	NOD1	99	46
C/C=C\C[C@H](NC(=O)CCCC(C)C)C(=O)OCC	ZINC000450918788	CF	On-Demand	Anodyne	NOD1	99	46
C/C=C/C[C@@H](NC(=O)CCCC(C)C)C(=O)OCC	ZINC000450918789	CF	On-Demand	Anodyne	NOD1	99	46
CC(C)(C#N)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450918843	GI	On-Demand	Mild	SCD	17	46
CCOC(=O)Cn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450918847	FF	On-Demand	Anodyne	PIN4	0	42
Cc1cccc(NC(=O)NC(=O)CN2CCC(c3nnc(O)o3)CC2)c1C	ZINC000450918848	FD	On-Demand	Anodyne	DRD4	0	44
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450918852	ED	On-Demand	Anodyne	FKBP1A	56	37
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450918852	ED	On-Demand	Anodyne	CPT2	29	42
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450918852	ED	On-Demand	Anodyne	PREP	43	39
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450918853	ED	On-Demand	Anodyne	FKBP1A	56	37
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450918853	ED	On-Demand	Anodyne	CPT2	29	42
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450918853	ED	On-Demand	Anodyne	PREP	43	39
CCOC(=O)c1ccccc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450918858	FD	On-Demand	Anodyne	DRD4	0	42
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(CC)n1	ZINC000450918862	CD	On-Demand	Anodyne	PREP	76	38
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(CC)n1	ZINC000450918862	CD	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@H]1CCCN1C(=O)CCCc1ncc(C)o1	ZINC000450918864	CD	On-Demand	Anodyne	FKBP1A	55	41
CCOC(=O)[C@H]1CCCN1C(=O)CCCc1ncc(C)o1	ZINC000450918864	CD	On-Demand	Anodyne	PREP	64	49
CCOC(=O)[C@H]1CCCN1C(=O)CCCc1ncc(C)o1	ZINC000450918864	CD	On-Demand	Anodyne	FKBP12.6	0	44
CCOCc1nc(C)c(C(=O)N2CCC[C@@H]2C(=O)OCC)s1	ZINC000450918865	EE	On-Demand	Anodyne	FKBP12.6	0	42
COCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)CCCC1	ZINC000450918876	FD	On-Demand	Anodyne	CA2	50	49
COCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)CCCC1	ZINC000450918876	FD	On-Demand	Anodyne	CA1	45	41
COCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)CCCC1	ZINC000450918876	FD	On-Demand	Anodyne	CA5B	40	38
COCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)CCCC1	ZINC000450918876	FD	On-Demand	Anodyne	CA4	52	41
COCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)CCCC1	ZINC000450918876	FD	On-Demand	Anodyne	CA5A	46	38
COCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)CCCC1	ZINC000450918876	FD	On-Demand	Anodyne	CA12	23	42
COCC1(CNc2ccc(S(N)(=O)=O)cc2C(=O)OC)CCCC1	ZINC000450918876	FD	On-Demand	Anodyne	CA9	29	42
CNC(=O)c1cccnc1NC[C@@H](O)C1CCC1	ZINC000450918877	BD	On-Demand	Anodyne	G2YM83_BOTF4	57	32
CNC(=O)c1cccnc1NC[C@H](O)C1CCC1	ZINC000450918878	BD	On-Demand	Anodyne	G2YM83_BOTF4	57	32
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450918930	DD	On-Demand	Anodyne	PREP	61	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC000450918930	DD	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450918931	DD	On-Demand	Anodyne	PREP	61	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1Cc2cccc(C)c2O1	ZINC000450918931	DD	On-Demand	Anodyne	FKBP12.6	0	40
CC(C)N(C(=O)CN1CCC(c2nnc(O)o2)CC1)C1CCCC1	ZINC000450918933	EE	On-Demand	Anodyne	SCARB1	47	33
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	DRD4	23	51
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	LTA4H	32	45
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	NPY2R	0	43
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	ACOX1	36	46
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	COLA	71	37
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	CPT1A	68	37
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	FAAH	21	40
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	NPY5R	15	45
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	MCHR1	36	46
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1cccc(Oc2ccccc2)c1	ZINC000450918934	GG	On-Demand	Anodyne	F13A1	15	42
Oc1nnc(C2CCN(Cc3ccc(Br)c(Cl)c3)CC2)o1	ZINC000450918935	FH	On-Demand	Anodyne	DRD4	15	41
Oc1nnc(C2CCN(Cc3ccc(Br)c(Cl)c3)CC2)o1	ZINC000450918935	FH	On-Demand	Anodyne	SIGMAR1	18	40
CCCN(CCN(CC)CC)C(=O)c1ccc(N2CCC2)nc1	ZINC000450918950	DE	On-Demand	Anodyne	PLM2_PLAFA	58	41
C/C=C/C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OCC	ZINC000450918991	FE	On-Demand	Anodyne	F7	27	41
C/C=C/C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OCC	ZINC000450918991	FE	On-Demand	Anodyne	PSBA	0	40
C/C=C/C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OCC	ZINC000450918992	FE	On-Demand	Anodyne	F7	27	41
C/C=C/C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OCC	ZINC000450918992	FE	On-Demand	Anodyne	PSBA	0	40
C/C=C\C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OCC	ZINC000450918993	FE	On-Demand	Anodyne	F7	27	41
C/C=C\C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OCC	ZINC000450918993	FE	On-Demand	Anodyne	PSBA	0	40
C/C=C\C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OCC	ZINC000450918994	FE	On-Demand	Anodyne	F7	27	41
C/C=C\C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)C(=O)OCC	ZINC000450918994	FE	On-Demand	Anodyne	PSBA	0	40
C/C=C/C[C@@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)C(=O)OCC	ZINC000450919001	FD	On-Demand	Anodyne	P2RY12	45	37
C/C=C/C[C@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)C(=O)OCC	ZINC000450919002	FD	On-Demand	Anodyne	P2RY12	45	37
C/C=C\C[C@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)C(=O)OCC	ZINC000450919003	FD	On-Demand	Anodyne	P2RY12	45	37
C/C=C\C[C@@H](NC(=O)c1cn(-c2cccc(OC)c2)nn1)C(=O)OCC	ZINC000450919004	FD	On-Demand	Anodyne	P2RY12	45	37
COC(=O)c1cc(S(N)(=O)=O)ccc1NCc1cnc(C2CC2)o1	ZINC000450919005	FD	On-Demand	Anodyne	CA2	27	44
O=[N+]([O-])c1cccc2c(NCc3cnc(C4CC4)o3)ccnc12	ZINC000450919015	DH	On-Demand	Bother	PRKCQ	42	34
CNC(=O)c1cccnc1NCC1(COC)CCCC1	ZINC000450919016	CE	On-Demand	Anodyne	HCN1	40	31
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450919021	GG	On-Demand	Anodyne	F2	42	38
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450919021	GG	On-Demand	Anodyne	FKBP1A	70	41
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450919021	GG	On-Demand	Anodyne	MMP13	17	41
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450919021	GG	On-Demand	Anodyne	PREP	66	47
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450919021	GG	On-Demand	Anodyne	LGMN	40	46
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450919021	GG	On-Demand	Anodyne	TMPRSS11D	64	35
CCS(=O)(=O)c1ccc(CN2CC[C@](C)(C(=O)NC)C2)cc1	ZINC000450919039	DD	On-Demand	Anodyne	ADAM17	25	42
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C)c(Cl)c1Cl	ZINC000450919041	EG	On-Demand	Anodyne	FKBP12.6	0	44
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(C)cc1Br	ZINC000450919043	FF	On-Demand	Anodyne	FKBP12.6	0	43
CCS(=O)(=O)c1ccc(CN2CC[C@@](C)(C(=O)NC)C2)cc1	ZINC000450919046	DD	On-Demand	Anodyne	ADAM17	25	42
COc1cc(N2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)ncn1	ZINC000450919049	FD	On-Demand	Anodyne	CCKAR	23	42
COc1cc(N2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)ncn1	ZINC000450919049	FD	On-Demand	Anodyne	HPGD	42	38
COc1cc(N2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)ncn1	ZINC000450919049	FD	On-Demand	Anodyne	SLC6A7	0	44
CCc1cccc(C(=O)NC[C@@H]2C[C@H](F)CN2Cc2cnoc2C)n1	ZINC000450919054	EE	On-Demand	Anodyne	PDE8B	43	31
O=C(CN1CCC(c2nnc(O)o2)CC1)NCCCC1CCCCC1	ZINC000450919064	FE	On-Demand	Anodyne	BMP1	55	35
COCc1cc([N+](=O)[O-])ccc1NC[C@H](O)C1CCC1	ZINC000450919078	CE	On-Demand	Bother	CACNA1D	40	32
COCc1cc([N+](=O)[O-])ccc1NC[C@@H](O)C1CCC1	ZINC000450919079	CE	On-Demand	Bother	CACNA1D	40	32
CCOC(=O)[C@H]1CCCN1C(=O)C[C@@H]1CC[C@@H]2C[C@H]12	ZINC000450919080	CD	On-Demand	Anodyne	FKBP12.6	0	47
CCOC(=O)[C@H]1CCCN1C(=O)C[C@@H]1CC[C@H]2C[C@@H]12	ZINC000450919081	CD	On-Demand	Anodyne	FKBP12.6	0	47
CCOC(=O)[C@H]1CCCN1C(=O)C[C@@H]1CC[C@@H]2C[C@@H]12	ZINC000450919082	CD	On-Demand	Anodyne	FKBP12.6	0	47
CCOC(=O)[C@H]1CCCN1C(=O)C[C@@H]1CC[C@H]2C[C@H]12	ZINC000450919083	CD	On-Demand	Anodyne	FKBP12.6	0	47
CN(C)CCNS(=O)(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450919087	GD	On-Demand	Bother	BDKRB1	0	46
CCOC(=O)[C@H]1CCCN1C(=O)c1cc2c(Br)cccc2cn1	ZINC000450919090	GG	On-Demand	Anodyne	FKBP1A	56	37
CCOC(=O)[C@H]1CCCN1C(=O)c1cc2c(Br)cccc2cn1	ZINC000450919090	GG	On-Demand	Anodyne	PREP	62	36
COCC1(CNc2ncc([N+](=O)[O-])c(C)n2)CCCC1	ZINC000450919095	CE	On-Demand	Bother	PRKCQ	44	35
COC(=O)C[C@@]1(NC(=O)c2cnn3ccc(C)cc23)CCOC1	ZINC000450919100	DD	On-Demand	Anodyne	EPHB3	35	46
COC(=O)C[C@]1(NC(=O)c2cnn3ccc(C)cc23)CCOC1	ZINC000450919101	DD	On-Demand	Anodyne	EPHB3	35	46
C[C@H](O)CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919141	CD	On-Demand	Anodyne	SLC6A1	108	41
C[C@H](O)CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919141	CD	On-Demand	Anodyne	CCR5	42	37
C[C@H](O)CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919141	CD	On-Demand	Anodyne	FASN	39	42
C[C@H](O)CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919141	CD	On-Demand	Anodyne	CYP2J2	47	33
C[C@@H](O)CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919142	CD	On-Demand	Anodyne	SLC6A1	108	41
C[C@@H](O)CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919142	CD	On-Demand	Anodyne	CCR5	42	37
C[C@@H](O)CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919142	CD	On-Demand	Anodyne	FASN	39	42
C[C@@H](O)CCN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919142	CD	On-Demand	Anodyne	CYP2J2	47	33
C[C@H](O)CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919143	CD	On-Demand	Anodyne	SLC6A1	108	41
C[C@H](O)CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919143	CD	On-Demand	Anodyne	CCR5	42	37
C[C@H](O)CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919143	CD	On-Demand	Anodyne	FASN	39	42
C[C@H](O)CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919143	CD	On-Demand	Anodyne	CYP2J2	47	33
C[C@@H](O)CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919144	CD	On-Demand	Anodyne	SLC6A1	108	41
C[C@@H](O)CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919144	CD	On-Demand	Anodyne	CCR5	42	37
C[C@@H](O)CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919144	CD	On-Demand	Anodyne	FASN	39	42
C[C@@H](O)CCN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919144	CD	On-Demand	Anodyne	CYP2J2	47	33
CCC(=O)CCCN1CC[C@](C)(c2ccc(F)cc2)C1	ZINC000450919146	CH	On-Demand	Anodyne	DRD2	29	47
CCC(=O)CCCN1CC[C@](C)(c2ccc(F)cc2)C1	ZINC000450919146	CH	On-Demand	Anodyne	ERG2	21	47
CCC(=O)CCCN1CC[C@](C)(c2ccc(F)cc2)C1	ZINC000450919146	CH	On-Demand	Anodyne	HTR7	21	40
CCC(=O)CCCN1CC[C@](C)(c2ccc(F)cc2)C1	ZINC000450919146	CH	On-Demand	Anodyne	CCR1	20	40
CCC(=O)CCCN1CC[C@](C)(c2ccc(F)cc2)C1	ZINC000450919146	CH	On-Demand	Anodyne	EBP	26	47
CCC(=O)CCCN1CC[C@@](C)(c2ccc(F)cc2)C1	ZINC000450919147	CH	On-Demand	Anodyne	DRD2	29	47
CCC(=O)CCCN1CC[C@@](C)(c2ccc(F)cc2)C1	ZINC000450919147	CH	On-Demand	Anodyne	ERG2	21	47
CCC(=O)CCCN1CC[C@@](C)(c2ccc(F)cc2)C1	ZINC000450919147	CH	On-Demand	Anodyne	HTR7	21	40
CCC(=O)CCCN1CC[C@@](C)(c2ccc(F)cc2)C1	ZINC000450919147	CH	On-Demand	Anodyne	CCR1	20	40
CCC(=O)CCCN1CC[C@@](C)(c2ccc(F)cc2)C1	ZINC000450919147	CH	On-Demand	Anodyne	EBP	26	47
COc1ccc([N+](=O)[O-])c(NCc2cnc(C3CC3)o2)c1	ZINC000450919148	CG	On-Demand	Bother	PRKCQ	44	42
CCC[C@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC(C)(C)C	ZINC000450919149	EF	On-Demand	Anodyne	HDAC1	27	44
CCC[C@@H](NC(=O)c1ccc(N2CCC2)nc1)C(=O)OC(C)(C)C	ZINC000450919150	EF	On-Demand	Anodyne	HDAC1	27	44
CCn1c(SCC[C@H]2CCOC2)nc2ccc(F)cc2c1=O	ZINC000450919153	DG	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	37
CCn1c(SCC[C@@H]2CCOC2)nc2ccc(F)cc2c1=O	ZINC000450919154	DG	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	37
N#Cc1ccc(NCc2cnc(C3CC3)o2)cc1Cl	ZINC000450919155	CH	On-Demand	Mild	MAP3K8	53	39
Nc1c([N+](=O)[O-])ccc(NCc2cnc(C3CC3)o2)c1F	ZINC000450919166	CF	On-Demand	Bother	PRKCQ	44	38
CCCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450919167	EF	On-Demand	Anodyne	CTSK	28	50
CCCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450919167	EF	On-Demand	Anodyne	PGA5	43	39
CCCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450919167	EF	On-Demand	Anodyne	NOD1	40	30
CCCC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450919167	EF	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
CCCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450919168	EF	On-Demand	Anodyne	CTSK	28	50
CCCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450919168	EF	On-Demand	Anodyne	PGA5	43	39
CCCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450919168	EF	On-Demand	Anodyne	NOD1	40	30
CCCC[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)(C)C)C(=O)OC(C)(C)C	ZINC000450919168	EF	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
CCCC[C@@H](NC(=O)C1(C(=O)CC)CC1)C(=O)OC(C)(C)C	ZINC000450919174	DF	On-Demand	Anodyne	CTSK	27	48
CCCC[C@H](NC(=O)C1(C(=O)CC)CC1)C(=O)OC(C)(C)C	ZINC000450919175	DF	On-Demand	Anodyne	CTSK	27	48
CCCC[C@@H](NC(=O)[C@]1(C#N)CC12CCCC2)C(=O)OC(C)(C)C	ZINC000450919180	EG	On-Demand	Mild	CTSK	0	42
CCCC[C@H](NC(=O)[C@]1(C#N)CC12CCCC2)C(=O)OC(C)(C)C	ZINC000450919182	EG	On-Demand	Mild	CTSK	0	42
CCCC[C@@H](NC(=O)[C@@]1(C#N)CC12CCCC2)C(=O)OC(C)(C)C	ZINC000450919183	EG	On-Demand	Mild	CTSK	0	42
CCCC[C@H](NC(=O)[C@@]1(C#N)CC12CCCC2)C(=O)OC(C)(C)C	ZINC000450919184	EG	On-Demand	Mild	CTSK	0	42
O=[N+]([O-])c1cc2ccccc2nc1NCc1cnc(C2CC2)o1	ZINC000450919185	DG	On-Demand	Bother	PRKCQ	49	39
CCC[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450919189	CD	On-Demand	Anodyne	SSTR2	41	33
CCC[C@@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450919189	CD	On-Demand	Anodyne	PGA5	41	37
CCC[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450919191	CD	On-Demand	Anodyne	SSTR2	41	33
CCC[C@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450919191	CD	On-Demand	Anodyne	PGA5	41	37
CCC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450919193	CD	On-Demand	Anodyne	SSTR2	41	33
CCC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450919193	CD	On-Demand	Anodyne	PGA5	41	37
CCC[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450919194	CD	On-Demand	Anodyne	SSTR2	41	33
CCC[C@@H](NC(=O)[C@H](O)C1CCC1)C(=O)OC(C)(C)C	ZINC000450919194	CD	On-Demand	Anodyne	PGA5	41	37
O=C(CN1CCC(c2nnc(O)o2)CC1)NC1(c2ccccc2)CCC1	ZINC000450919211	FE	On-Demand	Anodyne	TACR3	58	32
CC(C)Cc1nnc(NC(=O)CN(C)Cc2cccc(S(C)(=O)=O)c2)s1	ZINC000450919218	GE	On-Demand	Anodyne	RORC	16	42
CC(C)Oc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1Cl	ZINC000450919222	FH	On-Demand	Anodyne	SSTR5	59	37
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(I)cc1F	ZINC000450919228	GF	On-Demand	Anodyne	FKBP1A	53	37
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(I)cc1F	ZINC000450919228	GF	On-Demand	Anodyne	MAP2K1	32	42
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(I)cc1F	ZINC000450919228	GF	On-Demand	Anodyne	FKBP12.6	0	42
CN(C)CCNS(=O)(=O)c1cccc(NC(=O)CC2(O)CCC2)c1	ZINC000450919237	FC	On-Demand	Anodyne	CA4	15	41
C=CCC[C@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450919243	DG	On-Demand	Mild	EGFR	57	40
C=CCC[C@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450919243	DG	On-Demand	Mild	HTT	0	47
C=CCC[C@@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450919244	DG	On-Demand	Mild	EGFR	57	40
C=CCC[C@@H](CO)Nc1ncnc2cc(Br)ccc12	ZINC000450919244	DG	On-Demand	Mild	HTT	0	47
COCC1(CNc2ncc(C(=O)N3CCOCC3)cc2Cl)CCCC1	ZINC000450919277	FF	On-Demand	Anodyne	LRRK2	28	41
COCC1(CNc2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CCCC1	ZINC000450919292	FE	On-Demand	Bother	BDKRB1	23	43
CC(C)(C)N(Cc1cccc(F)c1)C(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450919294	GF	On-Demand	Anodyne	CCR5	72	36
CCCC(=O)Cn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450919296	FH	On-Demand	Anodyne	SCD	16	45
C[C@@H](O)C[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450919309	FF	On-Demand	Anodyne	PRCP	17	41
C[C@@H](O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450919310	FF	On-Demand	Anodyne	PRCP	17	41
C[C@H](O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000450919311	FF	On-Demand	Anodyne	PRCP	17	41
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450919322	DE	On-Demand	Anodyne	PREP	47	36
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450919322	DE	On-Demand	Anodyne	FKBP12.6	0	47
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450919322	DE	On-Demand	Anodyne	WNT3	48	36
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(Oc2ccccc2OC)cn1	ZINC000450919325	FG	On-Demand	Anodyne	FKBP1A	77	42
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(Oc2ccccc2OC)cn1	ZINC000450919325	FG	On-Demand	Anodyne	PREP	59	38
Oc1nnc(C2CCN(Cc3ccc(-c4ccsc4)cc3)CC2)o1	ZINC000450919326	EH	On-Demand	Anodyne	AKT2	46	34
CCOc1cccc(CN2CCC(c3nnc(O)o3)CC2)n1	ZINC000450919327	DD	On-Demand	Anodyne	SSTR5	45	34
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450919337	EE	On-Demand	Anodyne	LGMN	40	38
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OC(F)(F)O2	ZINC000450919337	EE	On-Demand	Anodyne	FKBP12.6	0	40
CCc1cc(NC[C@@H](O)C2CCC2)n2ncnc2n1	ZINC000450919351	CD	On-Demand	Anodyne	DHOD	0	50
CCc1cc(NC[C@H](O)C2CCC2)n2ncnc2n1	ZINC000450919352	CD	On-Demand	Anodyne	DHOD	0	50
Oc1nnc(C2CCN(CCSc3ccnc4cc(Cl)ccc34)CC2)o1	ZINC000450919353	GH	On-Demand	Anodyne	HRP1_PLAFA	90	41
Oc1nnc(C2CCN(CCSc3ccnc4cc(Cl)ccc34)CC2)o1	ZINC000450919353	GH	On-Demand	Anodyne	HNMT	53	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450919361	DF	On-Demand	Anodyne	ACE	24	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450919361	DF	On-Demand	Anodyne	FKBP1A	70	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450919361	DF	On-Demand	Anodyne	PREP	92	45
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@@]1(C)c1ccccc1	ZINC000450919361	DF	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C(=O)c1cn2nccc2nc1C	ZINC000450919363	DD	On-Demand	Anodyne	FKBP1A	40	40
NS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c(C(F)(F)F)c1	ZINC000450919369	ED	On-Demand	Anodyne	SFRP1	93	35
NS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c(C(F)(F)F)c1	ZINC000450919369	ED	On-Demand	Anodyne	WNT3	73	36
NS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c(C(F)(F)F)c1	ZINC000450919370	ED	On-Demand	Anodyne	SFRP1	93	35
NS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c(C(F)(F)F)c1	ZINC000450919370	ED	On-Demand	Anodyne	WNT3	73	36
COC(=O)CNC(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450919372	FD	On-Demand	Bother	TAAR1	18	43
COC(=O)CNC(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450919373	FD	On-Demand	Bother	TAAR1	18	43
CCc1cc(NCC2(COC)CCCC2)n2ncnc2n1	ZINC000450919374	CE	On-Demand	Anodyne	DHOD	0	48
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(C#N)[nH]c1C	ZINC000450919382	CD	On-Demand	Mild	LGMN	47	33
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(C#N)[nH]c1C	ZINC000450919382	CD	On-Demand	Mild	FKBP12.6	0	41
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccc(N2CCCCC2)nc1	ZINC000450919385	GD	On-Demand	Anodyne	DRD4	0	42
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccc(N2CCCCC2)nc1	ZINC000450919385	GD	On-Demand	Anodyne	DGAT1	41	42
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccc(N2CCCCC2)nc1	ZINC000450919385	GD	On-Demand	Anodyne	SLC27A1	56	44
COCCOCCOc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450919386	GE	On-Demand	Anodyne	HRH3	21	56
COCCOCCOc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450919386	GE	On-Demand	Anodyne	SIGMAR1	19	40
CN1C(=O)c2ccc(NC(=O)CN3CCC(c4nnc(O)o4)CC3)cc2C1=O	ZINC000450919405	GC	On-Demand	Anodyne	DRD4	0	46
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450919409	FD	On-Demand	Bother	TAAR1	18	43
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450919410	FD	On-Demand	Bother	TAAR1	18	43
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450919411	FD	On-Demand	Bother	TAAR1	18	43
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450919412	FD	On-Demand	Bother	TAAR1	18	43
CN1CCN(C(=O)CCN2CCC(c3nnc(O)o3)CC2)CC1	ZINC000450919414	DC	On-Demand	Anodyne	ETHR	64	36
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(C#N)c1Br	ZINC000450919416	FE	On-Demand	Mild	FKBP1A	46	37
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(C#N)c1Br	ZINC000450919416	FE	On-Demand	Mild	PREP	61	39
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(C#N)c1Br	ZINC000450919416	FE	On-Demand	Mild	LGMN	63	35
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(C#N)c1Br	ZINC000450919416	FE	On-Demand	Mild	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCN1C(=O)c1cc2ccncc2s1	ZINC000450919424	DE	On-Demand	Anodyne	FKBP1A	40	41
CCCC[C@@H](NC(=O)[C@@]1(COC)CCOC1)C(=O)OC(C)(C)C	ZINC000450919460	EE	On-Demand	Anodyne	CTSK	24	41
CCCC[C@@H](NC(=O)[C@]1(COC)CCOC1)C(=O)OC(C)(C)C	ZINC000450919461	EE	On-Demand	Anodyne	CTSK	24	41
CCCC[C@H](NC(=O)[C@]1(COC)CCOC1)C(=O)OC(C)(C)C	ZINC000450919462	EE	On-Demand	Anodyne	CTSK	24	41
CCCC[C@H](NC(=O)[C@@]1(COC)CCOC1)C(=O)OC(C)(C)C	ZINC000450919463	EE	On-Demand	Anodyne	CTSK	24	41
C=CCOc1ccc(CC(=O)NC[C@@H]2C[C@H](F)CN2Cc2cnn(C)c2)cc1	ZINC000450919498	GE	On-Demand	Mild	ITGA4	40	33
Cc1ccn2ncc(C(=O)NC[C@@H]3C[C@H](F)CN3Cc3cnoc3C)c2c1	ZINC000450919499	FE	On-Demand	Anodyne	EPHB3	28	42
C/C=C\C[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919510	FE	On-Demand	Anodyne	P2RY12	69	35
C/C=C\C[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919510	FE	On-Demand	Anodyne	CAPN2	44	32
C/C=C\C[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919510	FE	On-Demand	Anodyne	THYX_PBCV1	0	41
C/C=C/C[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919511	FE	On-Demand	Anodyne	P2RY12	69	35
C/C=C/C[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919511	FE	On-Demand	Anodyne	CAPN2	44	32
C/C=C/C[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919511	FE	On-Demand	Anodyne	THYX_PBCV1	0	41
C/C=C\C[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919512	FE	On-Demand	Anodyne	P2RY12	69	35
C/C=C\C[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919512	FE	On-Demand	Anodyne	CAPN2	44	32
C/C=C\C[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919512	FE	On-Demand	Anodyne	THYX_PBCV1	0	41
C/C=C/C[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919513	FE	On-Demand	Anodyne	P2RY12	69	35
C/C=C/C[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919513	FE	On-Demand	Anodyne	CAPN2	44	32
C/C=C/C[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)C(=O)OCC	ZINC000450919513	FE	On-Demand	Anodyne	THYX_PBCV1	0	41
Cc1nc(CN2C[C@@H](F)C[C@H]2CNC(=O)c2cncc(Cl)c2)cs1	ZINC000450919520	FF	On-Demand	Anodyne	CACNA1I	42	32
CCS(=O)(=O)c1ccc(CN(CCc2ccccn2)Cc2cccnc2)cc1	ZINC000450919525	GH	On-Demand	Anodyne	NR1D1	46	38
O=[N+]([O-])c1cc(Br)cnc1NCc1cnc(C2CC2)o1	ZINC000450919536	EG	On-Demand	Bother	PRKCQ	43	35
COC(=O)C[C@@]1(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCOC1	ZINC000450919548	FD	On-Demand	Anodyne	PDEC	0	40
COC(=O)C[C@]1(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)CCOC1	ZINC000450919549	FD	On-Demand	Anodyne	PDEC	0	40
COC(=O)C[C@]1(NC(=O)Cc2ccccc2O[C@H]2CCOC2)CCOC1	ZINC000450919550	FD	On-Demand	Anodyne	PDEC	0	40
COC(=O)C[C@@]1(NC(=O)Cc2ccccc2O[C@H]2CCOC2)CCOC1	ZINC000450919551	FD	On-Demand	Anodyne	PDEC	0	40
Oc1nnc(C2CCN(CCc3ccc(F)c(F)c3)CC2)o1	ZINC000450919553	DE	On-Demand	Anodyne	ABCC1	108	38
Oc1nnc(C2CCN(CCc3ccc(F)c(F)c3)CC2)o1	ZINC000450919553	DE	On-Demand	Anodyne	ABCB1A	55	36
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CC1(F)F	ZINC000450919556	BD	On-Demand	Anodyne	FKBP12.6	0	50
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC1(F)F	ZINC000450919557	BD	On-Demand	Anodyne	FKBP12.6	0	50
CN(C)S(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450919562	ED	On-Demand	Bother	COLA	54	33
CN(C)S(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450919563	ED	On-Demand	Bother	COLA	54	33
CCOC(=O)[C@H]1CCCN1C(=O)CCc1ccc2ccccc2c1O	ZINC000450919576	EG	On-Demand	Anodyne	PREP	64	48
CCOC(=O)[C@H]1CCCN1C(=O)CCc1ccc2ccccc2c1O	ZINC000450919576	EG	On-Demand	Anodyne	FKBP12.6	0	40
COCC1(CNc2ncccc2C(=O)N2CCCCC2)CCCC1	ZINC000450919585	EG	On-Demand	Anodyne	HCN1	45	35
COCC1(CNc2ncccc2C(=O)N2CCCCC2)CCCC1	ZINC000450919585	EG	On-Demand	Anodyne	HCN4	53	35
N#Cc1cccc(S(=O)(=O)CCN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450919598	FD	On-Demand	Mild	MEN1	42	34
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450919600	CE	On-Demand	Anodyne	FKBP1A	30	44
CCOC(=O)[C@H]1CCCN1C(=O)CCCC(=O)C(C)(C)C	ZINC000450919600	CE	On-Demand	Anodyne	FKBP12.6	0	54
COCC1(CNc2ccc(S(=O)(=O)N3CCCCC3)cn2)CCCC1	ZINC000450919605	FF	On-Demand	Anodyne	TGM2	15	41
CC(C)NC(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450919606	DG	On-Demand	Bother	TAAR1	17	41
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H](O)C1CCC1	ZINC000450919621	EC	On-Demand	Anodyne	CA2	41	49
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H](O)C1CCC1	ZINC000450919621	EC	On-Demand	Anodyne	CA1	42	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H](O)C1CCC1	ZINC000450919621	EC	On-Demand	Anodyne	CA7	40	39
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H](O)C1CCC1	ZINC000450919621	EC	On-Demand	Anodyne	CA4	47	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H](O)C1CCC1	ZINC000450919622	EC	On-Demand	Anodyne	CA2	41	49
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H](O)C1CCC1	ZINC000450919622	EC	On-Demand	Anodyne	CA1	42	40
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H](O)C1CCC1	ZINC000450919622	EC	On-Demand	Anodyne	CA7	40	39
COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H](O)C1CCC1	ZINC000450919622	EC	On-Demand	Anodyne	CA4	47	40
O[C@@H](CNc1ncccc1OCc1ccccc1)C1CCC1	ZINC000450919624	CG	On-Demand	Anodyne	PPIA	39	48
O[C@H](CNc1ncccc1OCc1ccccc1)C1CCC1	ZINC000450919625	CG	On-Demand	Anodyne	PPIA	39	48
C/C=C/C[C@@H](NC(=O)c1cccc(C(F)(F)F)n1)C(=O)OCC	ZINC000450919645	EF	On-Demand	Anodyne	P2RY12	54	37
C/C=C\C[C@H](NC(=O)c1cccc(C(F)(F)F)n1)C(=O)OCC	ZINC000450919646	EF	On-Demand	Anodyne	P2RY12	54	37
C/C=C/C[C@H](NC(=O)c1cccc(C(F)(F)F)n1)C(=O)OCC	ZINC000450919647	EF	On-Demand	Anodyne	P2RY12	54	37
C/C=C\C[C@@H](NC(=O)c1cccc(C(F)(F)F)n1)C(=O)OCC	ZINC000450919648	EF	On-Demand	Anodyne	P2RY12	54	37
COc1cccc(OCCC(=O)N2CCN(c3cc(OC)ncn3)CC2)c1	ZINC000450919649	FD	On-Demand	Anodyne	DRD4	45	37
COc1cccc(OCCC(=O)N2CCN(c3cc(OC)ncn3)CC2)c1	ZINC000450919649	FD	On-Demand	Anodyne	CCKAR	28	42
COc1cccc(OCCC(=O)N2CCN(c3cc(OC)ncn3)CC2)c1	ZINC000450919649	FD	On-Demand	Anodyne	MTNR1A	17	42
COc1cccc(OCCC(=O)N2CCN(c3cc(OC)ncn3)CC2)c1	ZINC000450919649	FD	On-Demand	Anodyne	MTNR1B	23	42
C/C=C\C[C@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OCC	ZINC000450919654	FG	On-Demand	Anodyne	HDA106	0	40
C/C=C\C[C@@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OCC	ZINC000450919655	FG	On-Demand	Anodyne	HDA106	0	40
C/C=C/C[C@@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OCC	ZINC000450919656	FG	On-Demand	Anodyne	HDA106	0	40
C/C=C/C[C@H](NC(=O)CCc1ccc2ccccc2c1O)C(=O)OCC	ZINC000450919657	FG	On-Demand	Anodyne	HDA106	0	40
Cc1ccc(NCc2cnc(C3CC3)o2)c([N+](=O)[O-])c1	ZINC000450919666	CG	On-Demand	Bother	PRKCQ	43	41
CCC[C@@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC(C)(C)C	ZINC000450919669	DF	On-Demand	Anodyne	CTSK	0	41
CCC[C@H](NC(=O)C(C)(C)OC(C)C)C(=O)OC(C)(C)C	ZINC000450919670	DF	On-Demand	Anodyne	CTSK	0	41
CN(C(=O)[C@@H]1CCN(C[C@@H]2CCCCC2(F)F)C1)c1ccccc1	ZINC000450919692	EH	On-Demand	Anodyne	SLC6A1	55	37
CN(C(=O)[C@@H]1CCN(C[C@@H]2CCCCC2(F)F)C1)c1ccccc1	ZINC000450919692	EH	On-Demand	Anodyne	CACNA1G	25	41
CN(C(=O)[C@H]1CCN(C[C@@H]2CCCCC2(F)F)C1)c1ccccc1	ZINC000450919693	EH	On-Demand	Anodyne	SLC6A1	55	37
CN(C(=O)[C@H]1CCN(C[C@@H]2CCCCC2(F)F)C1)c1ccccc1	ZINC000450919693	EH	On-Demand	Anodyne	CACNA1G	25	41
CN(C(=O)[C@@H]1CCN(C[C@H]2CCCCC2(F)F)C1)c1ccccc1	ZINC000450919694	EH	On-Demand	Anodyne	SLC6A1	55	37
CN(C(=O)[C@@H]1CCN(C[C@H]2CCCCC2(F)F)C1)c1ccccc1	ZINC000450919694	EH	On-Demand	Anodyne	CACNA1G	25	41
CN(C(=O)[C@H]1CCN(C[C@H]2CCCCC2(F)F)C1)c1ccccc1	ZINC000450919695	EH	On-Demand	Anodyne	SLC6A1	55	37
CN(C(=O)[C@H]1CCN(C[C@H]2CCCCC2(F)F)C1)c1ccccc1	ZINC000450919695	EH	On-Demand	Anodyne	CACNA1G	25	41
O=[N+]([O-])c1cc(Br)ccc1NCc1cnc(C2CC2)o1	ZINC000450919697	EH	On-Demand	Bother	PRKCQ	41	34
O=[N+]([O-])c1cccc(Cl)c1NCc1cnc(C2CC2)o1	ZINC000450919718	CH	On-Demand	Bother	PRKCQ	42	39
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@]2(CCCOC2)O1	ZINC000450919721	GH	On-Demand	Anodyne	CYP2J2	49	36
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919722	GH	On-Demand	Anodyne	CYP2J2	49	36
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919723	GH	On-Demand	Anodyne	CYP2J2	49	36
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@]2(CCCOC2)O1	ZINC000450919724	GH	On-Demand	Anodyne	CYP2J2	49	36
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919735	FG	On-Demand	Anodyne	OPRM1	0	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919735	FG	On-Demand	Anodyne	OPRK1	27	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919735	FG	On-Demand	Anodyne	CCR5	47	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919735	FG	On-Demand	Anodyne	FASN	38	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919736	FG	On-Demand	Anodyne	OPRM1	0	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919736	FG	On-Demand	Anodyne	OPRK1	27	44
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919736	FG	On-Demand	Anodyne	CCR5	47	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919736	FG	On-Demand	Anodyne	FASN	38	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919737	FG	On-Demand	Anodyne	OPRM1	0	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919737	FG	On-Demand	Anodyne	OPRK1	27	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919737	FG	On-Demand	Anodyne	CCR5	47	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919737	FG	On-Demand	Anodyne	FASN	38	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919738	FG	On-Demand	Anodyne	OPRM1	0	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919738	FG	On-Demand	Anodyne	OPRK1	27	44
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919738	FG	On-Demand	Anodyne	CCR5	47	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000450919738	FG	On-Demand	Anodyne	FASN	38	41
O=C(c1cc(NC[C@H](O)C2CCC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450919740	EE	On-Demand	Bother	L3MBTL1	0	41
O=C(c1cc(NC[C@H](O)C2CCC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450919740	EE	On-Demand	Bother	L3MBTL3	23	41
O=C(c1cc(NC[C@@H](O)C2CCC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450919741	EE	On-Demand	Bother	L3MBTL1	0	41
O=C(c1cc(NC[C@@H](O)C2CCC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000450919741	EE	On-Demand	Bother	L3MBTL3	23	41
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450919753	CE	On-Demand	Anodyne	FKBP1A	41	42
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450919753	CE	On-Demand	Anodyne	PREP	65	41
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc2cnccc2c1	ZINC000450919753	CE	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450919766	GD	On-Demand	Anodyne	F2	18	41
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450919766	GD	On-Demand	Anodyne	FKBP1A	69	38
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450919766	GD	On-Demand	Anodyne	PREP	48	40
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450919766	GD	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450919771	DD	On-Demand	Anodyne	PREP	65	37
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450919771	DD	On-Demand	Anodyne	FKBP12.6	0	44
COC(=O)[C@H](C)NC(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450919772	FE	On-Demand	Bother	TAAR1	19	41
COC(=O)[C@@H](C)NC(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450919773	FE	On-Demand	Bother	TAAR1	19	41
N#Cc1cccc(NC(=O)CCN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450919774	ED	On-Demand	Mild	CCR3	25	46
N#Cc1cccc(NC(=O)CCN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450919774	ED	On-Demand	Mild	MCHR1	50	39
Cc1ccsc1-c1nnc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)o1	ZINC000450919781	GE	On-Demand	Anodyne	DRD4	0	40
CCOC(=O)[C@H]1CCCN1C(=O)CC1(O)CCC1	ZINC000450919782	CC	On-Demand	Anodyne	TPP2	40	39
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCC(c2nnc(O)o2)CC1	ZINC000450919786	GE	On-Demand	Mild	MAPK10	0	41
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCC(c2nnc(O)o2)CC1	ZINC000450919786	GE	On-Demand	Mild	MURF	0	40
C[C@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCC(c2nnc(O)o2)CC1	ZINC000450919787	GE	On-Demand	Mild	MAPK10	0	41
C[C@H](C(=O)Nc1sc2c(c1C#N)CCC2)N1CCC(c2nnc(O)o2)CC1	ZINC000450919787	GE	On-Demand	Mild	MURF	0	40
C[C@@H](O)C[C@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450919790	GF	On-Demand	Anodyne	PDE6D	96	39
C[C@@H](O)C[C@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450919790	GF	On-Demand	Anodyne	IMDH_CRYPV	25	42
C[C@H](O)C[C@@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450919791	GF	On-Demand	Anodyne	PDE6D	96	39
C[C@H](O)C[C@@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450919791	GF	On-Demand	Anodyne	IMDH_CRYPV	25	42
C[C@@H](O)C[C@@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450919792	GF	On-Demand	Anodyne	PDE6D	96	39
C[C@@H](O)C[C@@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450919792	GF	On-Demand	Anodyne	IMDH_CRYPV	25	42
C[C@H](O)C[C@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450919793	GF	On-Demand	Anodyne	PDE6D	96	39
C[C@H](O)C[C@H]1COCCN1C(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450919793	GF	On-Demand	Anodyne	IMDH_CRYPV	25	42
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450919798	DD	On-Demand	Anodyne	PREP	67	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450919798	DD	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450919799	DD	On-Demand	Anodyne	PREP	67	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450919799	DD	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	ACE	33	40
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	FKBP1A	72	41
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	P2RY12	71	37
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	TRHR	45	33
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	TRY1_BOVIN	66	34
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	CPT1A	60	38
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	PREP	82	39
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	CELA2A	48	32
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	LGMN	49	33
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)nn1C	ZINC000450919800	EE	On-Demand	Anodyne	BRCA1	58	31
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450919806	DE	On-Demand	Anodyne	PREP	63	38
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000450919806	DE	On-Demand	Anodyne	GPR88	0	41
CC(C)Oc1cccc(CNC(=O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450919813	FE	On-Demand	Anodyne	DRD4	16	45
COCC1(CNc2ccc([N+](=O)[O-])cc2)CCCC1	ZINC000450919820	CG	On-Demand	Bother	NMBR	56	33
CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2C(=O)OCC)[nH]c1C	ZINC000450919829	DD	On-Demand	Anodyne	FKBP12.6	0	43
C[C@H](c1ccc(CN(CCc2ccccn2)Cc2cccnc2)cc1)C(F)(F)F	ZINC000450919839	GK	On-Demand	Anodyne	NR1D1	40	34
C[C@@H](c1ccc(CN(CCc2ccccn2)Cc2cccnc2)cc1)C(F)(F)F	ZINC000450919840	GK	On-Demand	Anodyne	NR1D1	40	34
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450919844	EG	On-Demand	Anodyne	DRD2	30	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450919844	EG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450919844	EG	On-Demand	Anodyne	SLC18A3	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450919844	EG	On-Demand	Anodyne	CYP2J2	49	36
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919845	EG	On-Demand	Anodyne	DRD2	30	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919845	EG	On-Demand	Anodyne	DRD4	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919845	EG	On-Demand	Anodyne	SLC18A3	0	46
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919845	EG	On-Demand	Anodyne	CYP2J2	49	36
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919846	EG	On-Demand	Anodyne	DRD2	30	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919846	EG	On-Demand	Anodyne	DRD4	0	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919846	EG	On-Demand	Anodyne	SLC18A3	0	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@]2(CCCOC2)O1	ZINC000450919846	EG	On-Demand	Anodyne	CYP2J2	49	36
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450919847	EG	On-Demand	Anodyne	DRD2	30	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450919847	EG	On-Demand	Anodyne	DRD4	0	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450919847	EG	On-Demand	Anodyne	SLC18A3	0	46
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@]2(CCCOC2)O1	ZINC000450919847	EG	On-Demand	Anodyne	CYP2J2	49	36
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	F2	53	39
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	ACE	28	41
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	FKBP1A	38	47
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	OPRM1	18	44
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	CTRA_BOVIN	40	30
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	MMP13	49	41
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	TRY1_BOVIN	78	35
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	ITGA4	58	53
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	CAPNS1	28	55
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	MMP3	52	41
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	LGMN	41	34
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	CAPN1	34	57
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	MMP7	63	41
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	MMP1	51	44
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	XIAP	47	37
C/C=C\C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919861	GD	On-Demand	Anodyne	WNT3	40	31
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	F2	53	39
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	ACE	28	41
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	FKBP1A	38	47
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	OPRM1	18	44
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	CTRA_BOVIN	40	30
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	MMP13	49	41
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	TRY1_BOVIN	78	35
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	ITGA4	58	53
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	CAPNS1	28	55
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	MMP3	52	41
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	LGMN	41	34
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	CAPN1	34	57
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	MMP7	63	41
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	MMP1	51	44
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	XIAP	47	37
C/C=C/C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919862	GD	On-Demand	Anodyne	WNT3	40	31
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	F2	53	39
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	ACE	28	41
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	FKBP1A	38	47
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	OPRM1	18	44
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	CTRA_BOVIN	40	30
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	MMP13	49	41
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	TRY1_BOVIN	78	35
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	ITGA4	58	53
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	CAPNS1	28	55
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	MMP3	52	41
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	LGMN	41	34
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	CAPN1	34	57
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	MMP7	63	41
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	MMP1	51	44
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	XIAP	47	37
C/C=C\C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919863	GD	On-Demand	Anodyne	WNT3	40	31
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	F2	53	39
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	ACE	28	41
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	FKBP1A	38	47
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	OPRM1	18	44
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	CTRA_BOVIN	40	30
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	MMP13	49	41
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	TRY1_BOVIN	78	35
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	ITGA4	58	53
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	CAPNS1	28	55
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	MMP3	52	41
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	LGMN	41	34
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	CAPN1	34	57
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	MMP7	63	41
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	MMP1	51	44
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	XIAP	47	37
C/C=C/C[C@@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)C(=O)OCC	ZINC000450919864	GD	On-Demand	Anodyne	WNT3	40	31
C/C=C/C[C@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OCC	ZINC000450919869	EF	On-Demand	Anodyne	P2RY12	67	35
C/C=C/C[C@@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OCC	ZINC000450919870	EF	On-Demand	Anodyne	P2RY12	67	35
C/C=C\C[C@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OCC	ZINC000450919871	EF	On-Demand	Anodyne	P2RY12	67	35
C/C=C\C[C@@H](NC(=O)c1ocnc1-c1ccccc1)C(=O)OCC	ZINC000450919872	EF	On-Demand	Anodyne	P2RY12	67	35
CC(C)(C)c1ccc(CCNC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450919876	GF	On-Demand	Anodyne	CACNA1I	27	42
O=[N+]([O-])c1cccc2c(NCc3cnc(C4CC4)o3)nccc12	ZINC000450919883	DH	On-Demand	Bother	PRKCQ	41	34
CNC(=O)C[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919884	EF	On-Demand	Anodyne	MME	44	41
CNC(=O)C[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919884	EF	On-Demand	Anodyne	ANPEP	41	36
CNC(=O)C[C@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919884	EF	On-Demand	Anodyne	SOAT1	23	43
CNC(=O)C[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919885	EF	On-Demand	Anodyne	MME	44	41
CNC(=O)C[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919885	EF	On-Demand	Anodyne	ANPEP	41	36
CNC(=O)C[C@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919885	EF	On-Demand	Anodyne	SOAT1	23	43
CNC(=O)C[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919886	EF	On-Demand	Anodyne	MME	44	41
CNC(=O)C[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919886	EF	On-Demand	Anodyne	ANPEP	41	36
CNC(=O)C[C@@H](NC[C@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919886	EF	On-Demand	Anodyne	SOAT1	23	43
CNC(=O)C[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919887	EF	On-Demand	Anodyne	MME	44	41
CNC(=O)C[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919887	EF	On-Demand	Anodyne	ANPEP	41	36
CNC(=O)C[C@@H](NC[C@@H](Cc1ccccc1)OC)c1ccccc1	ZINC000450919887	EF	On-Demand	Anodyne	SOAT1	23	43
C/C=C/C[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OCC	ZINC000450919888	EF	On-Demand	Anodyne	P2RY12	71	36
C/C=C\C[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OCC	ZINC000450919889	EF	On-Demand	Anodyne	P2RY12	71	36
C/C=C/C[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)C(=O)OCC	ZINC000450919890	EF	On-Demand	Anodyne	P2RY12	71	36
C/C=C\C[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)C(=O)OCC	ZINC000450919891	EF	On-Demand	Anodyne	P2RY12	71	36
Cn1cc(CN2C[C@@H](F)C[C@H]2CNC(=O)c2cncc(Cl)c2)cn1	ZINC000450919892	FD	On-Demand	Anodyne	CACNA1I	59	35
CCCNC(=O)c1ccc(NCC2(COC)CCCC2)nc1	ZINC000450919899	DF	On-Demand	Anodyne	HCN1	49	31
CCCNC(=O)c1ccc(NCC2(COC)CCCC2)nc1	ZINC000450919899	DF	On-Demand	Anodyne	HCN4	47	31
Oc1nnc(C2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)o1	ZINC000450919904	GF	On-Demand	Anodyne	CDC7	22	40
CC1(C(=O)Cn2c(=O)c(C(F)(F)F)nc3ccc(C(F)(F)F)cc32)CC1	ZINC000450919905	GH	On-Demand	Anodyne	SCD	18	46
CCc1cccc(C(=O)Nc2cccc(S(=O)(=O)NCCN(C)C)c2)n1	ZINC000450919907	GD	On-Demand	Anodyne	PDE5A	23	40
CCc1cccc(C(=O)Nc2cccc(S(=O)(=O)NCCN(C)C)c2)n1	ZINC000450919907	GD	On-Demand	Anodyne	KCNK3	44	35
COC(=O)C[C@@]1(NC(=O)Cc2ccc(O)c(OC)c2)CCOC1	ZINC000450919911	DC	On-Demand	Anodyne	TRPV1	22	44
COC(=O)C[C@@]1(NC(=O)Cc2ccc(O)c(OC)c2)CCOC1	ZINC000450919911	DC	On-Demand	Anodyne	NCE103	31	40
COC(=O)C[C@@]1(NC(=O)Cc2ccc(O)c(OC)c2)CCOC1	ZINC000450919911	DC	On-Demand	Anodyne	CAN2	0	40
COC(=O)C[C@]1(NC(=O)Cc2ccc(O)c(OC)c2)CCOC1	ZINC000450919922	DC	On-Demand	Anodyne	TRPV1	22	44
COC(=O)C[C@]1(NC(=O)Cc2ccc(O)c(OC)c2)CCOC1	ZINC000450919922	DC	On-Demand	Anodyne	NCE103	31	40
COC(=O)C[C@]1(NC(=O)Cc2ccc(O)c(OC)c2)CCOC1	ZINC000450919922	DC	On-Demand	Anodyne	CAN2	0	40
CNC(=O)c1ccc(NCC2(COC)CCCC2)c([N+](=O)[O-])c1	ZINC000450919928	DF	On-Demand	Bother	TAAR1	19	46
Cc1nc(CN(C)[C@H]2CCCN(C(=O)CCCC(=O)C(C)(C)C)CC2)no1	ZINC000450919933	GF	On-Demand	Anodyne	ETHR	40	32
Cc1nc(CN(C)[C@@H]2CCCN(C(=O)CCCC(=O)C(C)(C)C)CC2)no1	ZINC000450919934	GF	On-Demand	Anodyne	ETHR	40	32
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450919945	EE	On-Demand	Anodyne	FKBP1A	81	46
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450919945	EE	On-Demand	Anodyne	OPRK1	24	46
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450919945	EE	On-Demand	Anodyne	HTR4	40	37
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450919945	EE	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450919974	DF	On-Demand	Anodyne	FKBP1A	55	41
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450919974	DF	On-Demand	Anodyne	COLA	41	35
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450919974	DF	On-Demand	Anodyne	CPT2	40	35
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450919974	DF	On-Demand	Anodyne	PREP	80	43
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc2ccccc2s1	ZINC000450919974	DF	On-Demand	Anodyne	FKBP12.6	0	40
O=C(CCN1CCC(c2nnc(O)o2)CC1)NCC(=O)c1ccccc1	ZINC000450919975	FD	On-Demand	Anodyne	PRCP	32	42
O=C(CCN1CCC(c2nnc(O)o2)CC1)NCC(=O)c1ccccc1	ZINC000450919975	FD	On-Demand	Anodyne	CYP2J2	49	35
C/C=C\COc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCC)c1	ZINC000450919980	EF	On-Demand	Anodyne	CPT2	41	38
C/C=C\COc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCC)c1	ZINC000450919980	EF	On-Demand	Anodyne	PREP	54	42
C/C=C/COc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCC)c1	ZINC000450919981	EF	On-Demand	Anodyne	CPT2	41	38
C/C=C/COc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCC)c1	ZINC000450919981	EF	On-Demand	Anodyne	PREP	54	42
COc1ccc(Cl)c(CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450919983	DF	On-Demand	Anodyne	PDK1	42	36
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450919987	GG	On-Demand	Anodyne	FKBP1A	58	39
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450919987	GG	On-Demand	Anodyne	PREP	40	40
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450919987	GG	On-Demand	Anodyne	HPGD	56	63
COCC1(CNc2ccc(S(=O)(=O)NCC3CC3)cn2)CCCC1	ZINC000450919995	FE	On-Demand	Anodyne	NPY2R	41	34
C[C@@H](F)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920002	FI	On-Demand	Mild	SCD	16	46
C[C@H](F)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920003	FI	On-Demand	Mild	SCD	16	46
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450920006	CF	On-Demand	Anodyne	LGMN	42	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450920006	CF	On-Demand	Anodyne	FKBP12.6	0	51
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000450920006	CF	On-Demand	Anodyne	RHODESAIN	0	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450920007	CF	On-Demand	Anodyne	LGMN	42	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450920007	CF	On-Demand	Anodyne	FKBP12.6	0	51
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000450920007	CF	On-Demand	Anodyne	RHODESAIN	0	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450920008	CF	On-Demand	Anodyne	LGMN	42	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450920008	CF	On-Demand	Anodyne	FKBP12.6	0	51
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000450920008	CF	On-Demand	Anodyne	RHODESAIN	0	41
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450920009	CF	On-Demand	Anodyne	LGMN	42	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450920009	CF	On-Demand	Anodyne	FKBP12.6	0	51
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000450920009	CF	On-Demand	Anodyne	RHODESAIN	0	41
CCOC(=O)[C@H]1CCCN1C(=O)CSC1CC1	ZINC000450920011	CD	On-Demand	Anodyne	FKBP12.6	0	51
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450920017	CD	On-Demand	Anodyne	FKBP12.6	0	53
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450920017	CD	On-Demand	Anodyne	WNT3	40	31
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccc2c(c1)OCO2	ZINC000450920018	ED	On-Demand	Anodyne	DRD4	0	43
COCC1(CNc2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])CCCC1	ZINC000450920025	GF	On-Demand	Bother	TAAR1	21	45
COCC1(CNc2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])CCCC1	ZINC000450920026	GF	On-Demand	Bother	TAAR1	21	45
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C)c2c1CCC2	ZINC000450920033	DF	On-Demand	Anodyne	FKBP1A	62	40
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C)c2c1CCC2	ZINC000450920033	DF	On-Demand	Anodyne	PREP	48	38
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(C)c2c1CCC2	ZINC000450920033	DF	On-Demand	Anodyne	FKBP12.6	0	44
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920042	CD	On-Demand	Mild	FKBP12.6	0	44
C[C@@H](C(=O)N[C@H](C)c1cccc2ccccc12)N1CCC(c2nnc(O)o2)CC1	ZINC000450920045	GG	On-Demand	Anodyne	SMO	40	35
C[C@H](NC(=O)[C@H](C)N1CCC(c2nnc(O)o2)CC1)c1cccc2ccccc12	ZINC000450920046	GG	On-Demand	Anodyne	SMO	40	35
C[C@@H](NC(=O)[C@@H](C)N1CCC(c2nnc(O)o2)CC1)c1cccc2ccccc12	ZINC000450920047	GG	On-Demand	Anodyne	SMO	40	35
C[C@H](NC(=O)[C@@H](C)N1CCC(c2nnc(O)o2)CC1)c1cccc2ccccc12	ZINC000450920048	GG	On-Demand	Anodyne	SMO	40	35
COc1cc(OC)c(NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1Cl	ZINC000450920049	GE	On-Demand	Anodyne	DRD4	22	43
COc1cc(OC)c(NC(=O)CN2CCC(c3nnc(O)o3)CC2)cc1Cl	ZINC000450920049	GE	On-Demand	Anodyne	HTR4	56	35
NS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)cc1C(F)(F)F	ZINC000450920067	ED	On-Demand	Anodyne	SFRP1	53	33
NS(=O)(=O)c1ccc(NC[C@@H](O)C2CCC2)cc1C(F)(F)F	ZINC000450920067	ED	On-Demand	Anodyne	WNT3	49	33
NS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)cc1C(F)(F)F	ZINC000450920068	ED	On-Demand	Anodyne	SFRP1	53	33
NS(=O)(=O)c1ccc(NC[C@H](O)C2CCC2)cc1C(F)(F)F	ZINC000450920068	ED	On-Demand	Anodyne	WNT3	49	33
COc1cc(C#N)cc(OC[C@@H](Cc2ccccc2)OC)c1	ZINC000450920078	CG	On-Demand	Mild	PDS	38	44
COc1cc(C#N)cc(OC[C@H](Cc2ccccc2)OC)c1	ZINC000450920079	CG	On-Demand	Mild	PDS	38	44
CCOC(=O)[C@H]1CCCN1C(=O)c1nn2c(c1C)OCCC2	ZINC000450920097	DD	On-Demand	Anodyne	FKBP12.6	0	43
O[C@@H](CNc1ccnc2c(Cl)cccc12)C1CCC1	ZINC000450920105	CG	On-Demand	Anodyne	HRP1_PLAFA	43	34
O[C@@H](CNc1ccnc2c(Cl)cccc12)C1CCC1	ZINC000450920105	CG	On-Demand	Anodyne	HNMT	52	34
O[C@H](CNc1ccnc2c(Cl)cccc12)C1CCC1	ZINC000450920106	CG	On-Demand	Anodyne	HRP1_PLAFA	43	34
O[C@H](CNc1ccnc2c(Cl)cccc12)C1CCC1	ZINC000450920106	CG	On-Demand	Anodyne	HNMT	52	34
COCC1(CNc2cc(N3CCCCC3)ncn2)CCCC1	ZINC000450920110	DG	On-Demand	Anodyne	GALR2	41	32
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450920112	FD	On-Demand	Bother	DRD4	22	49
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450920116	FH	On-Demand	Anodyne	PRCP	46	35
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450920117	FH	On-Demand	Anodyne	PRCP	46	35
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450920118	FH	On-Demand	Anodyne	PRCP	46	35
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450920119	FH	On-Demand	Anodyne	PRCP	46	35
CCOC(=O)[C@H]1CCCN1C(=O)C[C@H](O)CC	ZINC000450920121	BC	On-Demand	Anodyne	FKBP12.6	0	50
CCOC(=O)[C@H]1CCCN1C(=O)C[C@@H](O)CC	ZINC000450920122	BC	On-Demand	Anodyne	FKBP12.6	0	50
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCC[C@H]1CC	ZINC000450920128	CE	On-Demand	Anodyne	XPNPEP1	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCC[C@H]1CC	ZINC000450920128	CE	On-Demand	Anodyne	XPNPEP2	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCC[C@H]1CC	ZINC000450920128	CE	On-Demand	Anodyne	FKBP12.6	0	52
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCC[C@H]1CC	ZINC000450920129	CE	On-Demand	Anodyne	XPNPEP1	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCC[C@H]1CC	ZINC000450920129	CE	On-Demand	Anodyne	XPNPEP2	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCC[C@H]1CC	ZINC000450920129	CE	On-Demand	Anodyne	FKBP12.6	0	52
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCC[C@@H]1CC	ZINC000450920130	CE	On-Demand	Anodyne	XPNPEP1	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCC[C@@H]1CC	ZINC000450920130	CE	On-Demand	Anodyne	XPNPEP2	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCC[C@@H]1CC	ZINC000450920130	CE	On-Demand	Anodyne	FKBP12.6	0	52
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCC[C@@H]1CC	ZINC000450920131	CE	On-Demand	Anodyne	XPNPEP1	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCC[C@@H]1CC	ZINC000450920131	CE	On-Demand	Anodyne	XPNPEP2	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCC[C@@H]1CC	ZINC000450920131	CE	On-Demand	Anodyne	FKBP12.6	0	52
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H](c1ccccc1)C1CCCC1	ZINC000450920135	GG	On-Demand	Anodyne	DRD4	0	40
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H](c1ccccc1)C1CCCC1	ZINC000450920135	GG	On-Demand	Anodyne	PRCP	24	41
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@@H](c1ccccc1)C1CCCC1	ZINC000450920135	GG	On-Demand	Anodyne	SMO	40	35
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H](c1ccccc1)C1CCCC1	ZINC000450920136	GG	On-Demand	Anodyne	DRD4	0	40
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H](c1ccccc1)C1CCCC1	ZINC000450920136	GG	On-Demand	Anodyne	PRCP	24	41
O=C(CN1CCC(c2nnc(O)o2)CC1)N[C@H](c1ccccc1)C1CCCC1	ZINC000450920136	GG	On-Demand	Anodyne	SMO	40	35
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1ccccc1Cl	ZINC000450920153	EE	On-Demand	Anodyne	SMO	29	42
CCC[C@@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920174	CD	On-Demand	Anodyne	TRHR	45	32
CCC[C@@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920174	CD	On-Demand	Anodyne	LGMN	42	39
CCC[C@@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920174	CD	On-Demand	Anodyne	FKBP12.6	0	48
CCC[C@@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920174	CD	On-Demand	Anodyne	TPP2	46	44
CCC[C@@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920174	CD	On-Demand	Anodyne	RHODESAIN	0	41
CCC[C@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920175	CD	On-Demand	Anodyne	TRHR	45	32
CCC[C@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920175	CD	On-Demand	Anodyne	LGMN	42	39
CCC[C@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920175	CD	On-Demand	Anodyne	FKBP12.6	0	48
CCC[C@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920175	CD	On-Demand	Anodyne	TPP2	46	44
CCC[C@H](OC)C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920175	CD	On-Demand	Anodyne	RHODESAIN	0	41
CC(C)NC(=O)c1ccc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450920180	DE	On-Demand	Bother	TAAR1	18	45
CC(C)NC(=O)c1ccc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450920181	DE	On-Demand	Bother	TAAR1	18	45
CCOC(=O)[C@H]1CCCN1C(=O)c1cc2cccnc2s1	ZINC000450920191	DE	On-Demand	Anodyne	FKBP1A	40	41
CCOC(=O)[C@H]1CCCN1C(=O)c1cc2cccnc2s1	ZINC000450920191	DE	On-Demand	Anodyne	PREP	72	37
CCC[C@H]1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920201	CF	On-Demand	Anodyne	XPNPEP1	0	41
CCC[C@H]1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920201	CF	On-Demand	Anodyne	XPNPEP2	0	41
CCC[C@H]1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920201	CF	On-Demand	Anodyne	FKBP12.6	0	50
CCC[C@H]1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920201	CF	On-Demand	Anodyne	TPP2	40	40
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920202	CF	On-Demand	Anodyne	XPNPEP1	0	41
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920202	CF	On-Demand	Anodyne	XPNPEP2	0	41
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920202	CF	On-Demand	Anodyne	FKBP12.6	0	50
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920202	CF	On-Demand	Anodyne	TPP2	40	40
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920203	CF	On-Demand	Anodyne	XPNPEP1	0	41
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920203	CF	On-Demand	Anodyne	XPNPEP2	0	41
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920203	CF	On-Demand	Anodyne	FKBP12.6	0	50
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920203	CF	On-Demand	Anodyne	TPP2	40	40
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920204	CF	On-Demand	Anodyne	XPNPEP1	0	41
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920204	CF	On-Demand	Anodyne	XPNPEP2	0	41
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920204	CF	On-Demand	Anodyne	FKBP12.6	0	50
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCC	ZINC000450920204	CF	On-Demand	Anodyne	TPP2	40	40
C[C@@H](O)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920215	FG	On-Demand	Anodyne	SCD	19	49
C[C@H](O)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920216	FG	On-Demand	Anodyne	SCD	19	49
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(C)n(C(C)C)n1	ZINC000450920217	CD	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450920218	EF	On-Demand	Anodyne	LGMN	56	33
CCOC(=O)[C@H]1CCCN1C(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450920219	ED	On-Demand	Anodyne	LGMN	42	35
CCOC(=O)[C@H]1CCCN1C(=O)C[C@@H](CNC(C)=O)CC(C)C	ZINC000450920219	ED	On-Demand	Anodyne	TPP2	41	40
O=c1c(C(F)(F)F)nc2ccc(C(F)(F)F)cc2n1CCCCCF	ZINC000450920223	FJ	On-Demand	Mild	SCD	15	50
O=c1c(C(F)(F)F)nc2ccc(C(F)(F)F)cc2n1CCCCCF	ZINC000450920223	FJ	On-Demand	Mild	RORB	0	41
COCC1(CNc2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])CCCC1	ZINC000450920224	GE	On-Demand	Bother	TAAR1	21	44
O[C@H](CNc1ncnc2ccc(I)cc12)C1CCC1	ZINC000450920228	FE	On-Demand	Anodyne	CLK4	56	35
O[C@H](CNc1ncnc2ccc(I)cc12)C1CCC1	ZINC000450920228	FE	On-Demand	Anodyne	CD38	56	37
O[C@@H](CNc1ncnc2ccc(I)cc12)C1CCC1	ZINC000450920229	FE	On-Demand	Anodyne	CLK4	56	35
O[C@@H](CNc1ncnc2ccc(I)cc12)C1CCC1	ZINC000450920229	FE	On-Demand	Anodyne	CD38	56	37
COC(=O)[C@@H](c1ccccc1C(F)(F)F)N1CCC(c2nnc(O)o2)CC1	ZINC000450920238	GF	On-Demand	Anodyne	RBP4	56	37
COC(=O)[C@H](c1ccccc1C(F)(F)F)N1CCC(c2nnc(O)o2)CC1	ZINC000450920239	GF	On-Demand	Anodyne	RBP4	56	37
NC(=O)c1csc(NC[C@@H](O)C2CCC2)n1	ZINC000450920245	BC	On-Demand	Anodyne	TRPC6	48	34
NC(=O)c1csc(NC[C@H](O)C2CCC2)n1	ZINC000450920246	BC	On-Demand	Anodyne	TRPC6	48	34
COCC1(CNc2cc(C)nc3ncnn23)CCCC1	ZINC000450920251	CE	On-Demand	Anodyne	DHOD	0	51
Cc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1Br	ZINC000450920257	FG	On-Demand	Anodyne	SSTR5	47	33
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@H](O)C1CCC1	ZINC000450920263	DF	On-Demand	Mild	MAP3K8	64	34
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@@H](O)C1CCC1	ZINC000450920264	DF	On-Demand	Mild	MAP3K8	64	34
Cc1nc(NC[C@H](O)C2CCC2)ncc1[N+](=O)[O-]	ZINC000450920279	CD	On-Demand	Bother	PRKCQ	51	40
Cc1nc(NC[C@@H](O)C2CCC2)ncc1[N+](=O)[O-]	ZINC000450920280	CD	On-Demand	Bother	PRKCQ	51	40
COCCCCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920282	FH	On-Demand	Anodyne	SCD	21	47
COc1cc(CC(=O)N2CCOC[C@@H]2C[C@H](C)O)ccc1Cl	ZINC000450920286	ED	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCOC[C@@H]2C[C@H](C)O)ccc1Cl	ZINC000450920286	ED	On-Demand	Anodyne	OPRK1	23	43
COc1cc(CC(=O)N2CCOC[C@H]2C[C@@H](C)O)ccc1Cl	ZINC000450920287	ED	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCOC[C@H]2C[C@@H](C)O)ccc1Cl	ZINC000450920287	ED	On-Demand	Anodyne	OPRK1	23	43
COc1cc(CC(=O)N2CCOC[C@H]2C[C@H](C)O)ccc1Cl	ZINC000450920288	ED	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCOC[C@H]2C[C@H](C)O)ccc1Cl	ZINC000450920288	ED	On-Demand	Anodyne	OPRK1	23	43
COc1cc(CC(=O)N2CCOC[C@@H]2C[C@@H](C)O)ccc1Cl	ZINC000450920289	ED	On-Demand	Anodyne	OPRM1	0	43
COc1cc(CC(=O)N2CCOC[C@@H]2C[C@@H](C)O)ccc1Cl	ZINC000450920289	ED	On-Demand	Anodyne	OPRK1	23	43
COCC1(CNc2ccc(C(=O)N3CCc4ccccc43)cn2)CCCC1	ZINC000450920290	FH	On-Demand	Anodyne	AVPR1A	47	40
COC(=O)c1cnc(NC[C@@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450920298	CD	On-Demand	Bother	PRKCQ	43	35
COC(=O)c1cnc(NC[C@H](O)C2CCC2)c([N+](=O)[O-])c1	ZINC000450920299	CD	On-Demand	Bother	PRKCQ	43	35
CN1CCC[C@@H]1CCN1CCC(c2nnc(O)o2)CC1	ZINC000450920303	CD	On-Demand	Anodyne	CHRNA10	47	34
CN1CCC[C@H]1CCN1CCC(c2nnc(O)o2)CC1	ZINC000450920304	CD	On-Demand	Anodyne	CHRNA10	47	34
COCC1(CNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])CCCC1	ZINC000450920320	ED	On-Demand	Bother	CA2	23	40
CN(C)CCCNS(=O)(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450920348	GE	On-Demand	Bother	BDKRB1	0	49
CCOC(=O)[C@H]1CCCN1C(=O)Cc1cc(Br)ccc1C	ZINC000450920361	FF	On-Demand	Anodyne	FKBP12.6	0	45
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCC(=O)N1C	ZINC000450920382	CC	On-Demand	Anodyne	PREP	55	35
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCC(=O)N1C	ZINC000450920383	CC	On-Demand	Anodyne	PREP	55	35
Oc1nnc(C2CCN(C[C@H](O)Cc3ccccc3C(F)(F)F)CC2)o1	ZINC000450920398	FF	On-Demand	Anodyne	VACHT_TETCF	0	44
Oc1nnc(C2CCN(C[C@@H](O)Cc3ccccc3C(F)(F)F)CC2)o1	ZINC000450920399	FF	On-Demand	Anodyne	VACHT_TETCF	0	44
C[C@H](Cc1c(F)cccc1F)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450920404	GD	On-Demand	Anodyne	DRD4	0	40
C[C@@H](Cc1c(F)cccc1F)NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450920405	GD	On-Demand	Anodyne	DRD4	0	40
CCOC(=O)[C@H]1CCCN1C(=O)CCc1cccc(F)c1Br	ZINC000450920412	FG	On-Demand	Anodyne	FKBP1A	62	39
CCOC(=O)[C@H]1CCCN1C(=O)CCc1cccc(F)c1Br	ZINC000450920412	FG	On-Demand	Anodyne	PREP	49	43
CCOC(=O)[C@H]1CCCN1C(=O)CCc1cccc(F)c1Br	ZINC000450920412	FG	On-Demand	Anodyne	FKBP12.6	0	40
COCC1(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCCC1	ZINC000450920416	EG	On-Demand	Bother	TAAR1	18	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	F2	42	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	ACE	38	48
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	FKBP1A	58	46
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	ELANE	48	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	TRY1_BOVIN	41	34
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	PREP	61	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	TPP2	44	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	XIAP	50	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccn1	ZINC000450920422	CD	On-Demand	Anodyne	BRCA1	43	32
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	F2	42	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	ACE	38	48
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	FKBP1A	58	46
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	ELANE	48	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	TRY1_BOVIN	41	34
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	PREP	61	37
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	TPP2	44	39
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	XIAP	50	40
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccn1	ZINC000450920423	CD	On-Demand	Anodyne	BRCA1	43	32
O=C(CN1CCC(c2nnc(O)o2)CC1)Nc1c(F)cccc1F	ZINC000450920425	ED	On-Demand	Anodyne	DRD4	22	46
O=c1c(C(F)(F)F)nc2ccc(C(F)(F)F)cc2n1CCCCF	ZINC000450920439	FI	On-Demand	Mild	SCD	15	51
O=c1c(C(F)(F)F)nc2ccc(C(F)(F)F)cc2n1CCCCF	ZINC000450920439	FI	On-Demand	Mild	RORB	0	41
Cc1cc(Cl)ccc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450920440	FF	On-Demand	Anodyne	DRD4	27	51
COC(C)(C)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920441	GI	On-Demand	Anodyne	SCD	21	47
CCSCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920445	FI	On-Demand	Anodyne	SCD	16	45
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CC12CCSCC2	ZINC000450920464	CE	On-Demand	Anodyne	FKBP12.6	0	44
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CC12CCSCC2	ZINC000450920465	CE	On-Demand	Anodyne	FKBP12.6	0	44
CCOC(=O)[C@H]1CCCN1C(=O)c1oc2ccccc2c1CC	ZINC000450920467	DG	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(SC)c1	ZINC000450920480	CF	On-Demand	Anodyne	PREP	48	47
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(SC)c1	ZINC000450920480	CF	On-Demand	Anodyne	LGMN	41	32
CCOC(=O)[C@H]1CCCN1C(=O)c1cccc(SC)c1	ZINC000450920480	CF	On-Demand	Anodyne	FKBP12.6	0	42
O=C(CN1CCC(c2nnc(O)o2)CC1)NCCOc1ccc(F)cc1	ZINC000450920482	FD	On-Demand	Anodyne	AVPR1B	17	42
O=C(CN1CCC(c2nnc(O)o2)CC1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000450920484	GC	On-Demand	Anodyne	DRD4	0	44
C[C@@H](C(=O)N1CCN(c2ccccn2)CC1)N1CCC(c2nnc(O)o2)CC1	ZINC000450920487	GD	On-Demand	Anodyne	SLC6A7	0	40
C[C@H](C(=O)N1CCN(c2ccccn2)CC1)N1CCC(c2nnc(O)o2)CC1	ZINC000450920488	GD	On-Demand	Anodyne	SLC6A7	0	40
CCOC(=O)[C@H]1CCCN1C(=O)Cn1ccc(C)n1	ZINC000450920500	CC	On-Demand	Anodyne	PREP	44	34
COC(=O)C[C@@]1(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000450920504	FD	On-Demand	Bother	CACNA1C	41	34
COC(=O)C[C@@]1(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000450920504	FD	On-Demand	Bother	CACNA1D	68	34
COC(=O)C[C@]1(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000450920505	FD	On-Demand	Bother	CACNA1C	41	34
COC(=O)C[C@]1(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000450920505	FD	On-Demand	Bother	CACNA1D	68	34
CCOC(=O)[C@H]1CCCN1C(=O)C1CC(C)(O)C1	ZINC000450920506	CC	On-Demand	Anodyne	LGMN	40	36
Oc1nnc(C2CCN(CCOc3ccc(Cl)c(F)c3)CC2)o1	ZINC000450920511	EF	On-Demand	Anodyne	ESR1	52	34
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	ADORA1	175	68
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	SLC29A1	137	59
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RY12	51	44
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	ADORA2A	62	63
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	ADORA2B	28	56
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	GAPC	0	46
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	ADK	73	53
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RX5	0	40
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	AK3	0	42
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	AHCY	51	39
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RX4	43	42
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RX1	57	40
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RX6	0	40
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RY4	20	40
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RY1	43	42
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RY11	0	41
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	MAT2A	0	40
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	AMD1	38	42
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	GAPDH	37	41
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	ITPR1	53	39
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	P2RY2	22	42
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	AK2	0	42
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	NS5B	0	44
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	ADORA3	146	63
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	OXGR1	121	41
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	MTAP	0	42
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	QARS	0	41
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	IMPDH2	56	34
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	AK	0	49
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	RNASE1	45	36
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	MBTA	0	45
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	DNMT3B	72	45
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	NADK	0	40
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	PANC	37	40
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	Q4VQ11_PIG	88	63
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	GPR17	59	47
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	SAE1	0	41
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	HSPA5	53	38
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	DOT1L	88	43
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	METJ	0	42
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	NAE1	0	41
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	UBA6	0	41
COCC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1	ZINC000450920522	GC	On-Demand	Anodyne	UBA7	0	41
Oc1nnc(C2CCN(Cc3cc4ccccc4o3)CC2)o1	ZINC000450920526	CF	On-Demand	Anodyne	HTR2B	15	52
Oc1nnc(C2CCN(Cc3cc4ccccc4o3)CC2)o1	ZINC000450920526	CF	On-Demand	Anodyne	SIGMAR1	15	42
O=[N+]([O-])c1ccc(NC[C@@H](O)C2CCC2)nc1NC[C@H](O)C1CCC1	ZINC000450920531	FD	On-Demand	Bother	PRKCQ	43	33
O=[N+]([O-])c1ccc(NC[C@H](O)C2CCC2)nc1NC[C@H](O)C1CCC1	ZINC000450920532	FD	On-Demand	Bother	PRKCQ	43	33
O=[N+]([O-])c1ccc(NC[C@@H](O)C2CCC2)nc1NC[C@@H](O)C1CCC1	ZINC000450920533	FD	On-Demand	Bother	PRKCQ	43	33
O=[N+]([O-])c1ccc(NC[C@H](O)C2CCC2)nc1NC[C@@H](O)C1CCC1	ZINC000450920534	FD	On-Demand	Bother	PRKCQ	43	33
Oc1nnc(C2CCN(CCc3cccnc3)CC2)o1	ZINC000450920571	CD	On-Demand	Anodyne	ACHP_LYMST	23	42
C[C@@H](O)CCCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920579	FH	On-Demand	Anodyne	RORB	0	40
C[C@H](O)CCCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450920580	FH	On-Demand	Anodyne	RORB	0	40
COc1ccccc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450920586	ED	On-Demand	Anodyne	DRD4	0	45
COc1ccccc1NC(=O)CN1CCC(c2nnc(O)o2)CC1	ZINC000450920586	ED	On-Demand	Anodyne	SMO	24	45
O[C@@H](CNc1ccnc2cc(F)ccc12)C1CCC1	ZINC000450920588	CF	On-Demand	Anodyne	HRP1_PLAFA	87	33
O[C@@H](CNc1ccnc2cc(F)ccc12)C1CCC1	ZINC000450920588	CF	On-Demand	Anodyne	HNMT	58	38
O[C@H](CNc1ccnc2cc(F)ccc12)C1CCC1	ZINC000450920589	CF	On-Demand	Anodyne	HRP1_PLAFA	87	33
O[C@H](CNc1ccnc2cc(F)ccc12)C1CCC1	ZINC000450920589	CF	On-Demand	Anodyne	HNMT	58	38
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450920590	FD	On-Demand	Anodyne	PREP	37	41
CCOC(=O)[C@H]1CCCN1C(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450920590	FD	On-Demand	Anodyne	FKBP12.6	0	41
C[C@H](O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450920595	FF	On-Demand	Anodyne	RBP4	56	38
C[C@@H](O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450920596	FF	On-Demand	Anodyne	RBP4	56	38
C[C@@H](O)C[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450920597	FF	On-Demand	Anodyne	RBP4	56	38
CCOC(=O)[C@H]1CCCN1C(=O)CNS(=O)(=O)NC	ZINC000450920657	CA	On-Demand	Anodyne	FKBP12.6	0	46
CCOC(=O)[C@H]1CCCN1C(=O)CNS(=O)(=O)NC	ZINC000450920657	CA	On-Demand	Anodyne	FAP	0	43
CCOC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCCN(C)C1=O	ZINC000450920660	CC	On-Demand	Anodyne	PREP	49	31
CCOC(=O)[C@H]1CCCN1C(=O)[C@H]1CCCN(C)C1=O	ZINC000450920661	CC	On-Demand	Anodyne	PREP	49	31
COC(=O)c1cccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)n1	ZINC000450920662	FC	On-Demand	Anodyne	DRD4	0	41
COC(=O)c1cccc(NC(=O)CN2CCC(c3nnc(O)o3)CC2)n1	ZINC000450920662	FC	On-Demand	Anodyne	HTR1F	47	33
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450920667	FG	On-Demand	Anodyne	FKBP1A	49	42
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450920667	FG	On-Demand	Anodyne	PREP	41	35
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450920667	FG	On-Demand	Anodyne	FKBP12.6	0	42
CCOc1cccc(CNC(=O)CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450920676	FD	On-Demand	Anodyne	PDS	46	34
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NC[C@@H]1C[C@H]1C1CC1	ZINC000450920678	GE	On-Demand	Bother	DDIT3	0	40
Cc1cnc(Cn2c(=O)c(C(F)(F)F)nc3ccc(C(F)(F)F)cc32)nc1	ZINC000450920684	GH	On-Demand	Anodyne	SCD	15	42
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450920699	FD	On-Demand	Anodyne	FKBP1A	62	37
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450920699	FD	On-Demand	Anodyne	PREP	42	45
CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450920699	FD	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)CN(C(=O)c1cc2c(=O)n(C)c(=O)n(C)c2s1)C1CCC1	ZINC000450920709	GC	On-Demand	Anodyne	ACE	24	43
Cc1ccc(NC(=O)Cc2cc3ccccc3s2)cc1NC(=O)CCN(C)C	ZINC000450920718	GI	On-Demand	Anodyne	LDLR	0	40
CC(C)NS(=O)(=O)N1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000450920730	FC	On-Demand	Bother	COLA	62	33
CCOC(=O)CN(C(=O)c1cc2n(n1)CCCC2)C1CCC1	ZINC000450920732	DD	On-Demand	Anodyne	ACE	44	45
CCC[C@@H](O)CN(C)CC(=O)N(C)[C@H](C)c1ccccc1	ZINC000450920734	CE	On-Demand	Anodyne	AOC3	16	40
CCC[C@@H](O)CN(C)CC(=O)N(C)[C@@H](C)c1ccccc1	ZINC000450920735	CE	On-Demand	Anodyne	AOC3	16	40
CCC[C@H](O)CN(C)CC(=O)N(C)[C@@H](C)c1ccccc1	ZINC000450920736	CE	On-Demand	Anodyne	AOC3	16	40
CCC[C@H](O)CN(C)CC(=O)N(C)[C@H](C)c1ccccc1	ZINC000450920737	CE	On-Demand	Anodyne	AOC3	16	40
CC(=O)c1c(F)cccc1N1CCC[C@@H](NC(=O)N(C)C)C1	ZINC000450920747	DE	On-Demand	Anodyne	KCNQ2	46	33
CC(=O)c1c(F)cccc1N1CCC[C@H](NC(=O)N(C)C)C1	ZINC000450920748	DE	On-Demand	Anodyne	KCNQ2	46	33
CN(C)C(=O)N[C@H]1CCCN(c2ncccc2S(=O)(=O)N2CCCCC2)C1	ZINC000450920769	GD	On-Demand	Anodyne	EPHX2	21	43
CN(C)C(=O)N[C@@H]1CCCN(c2ncccc2S(=O)(=O)N2CCCCC2)C1	ZINC000450920770	GD	On-Demand	Anodyne	EPHX2	21	43
COCCN(Cc1ccc(F)c(Cl)c1)c1ncnc2c1cnn2C	ZINC000450920771	EF	On-Demand	Anodyne	Q9M629_MAIZE	50	35
COc1ccccc1[C@@H]1CN(CC[C@H]2CCOC2)CCN1CC[C@H]1CCOC1	ZINC000450920772	GG	On-Demand	Anodyne	HTR1A	18	42
COc1ccccc1[C@@H]1CN(CC[C@@H]2CCOC2)CCN1CC[C@@H]1CCOC1	ZINC000450920773	GG	On-Demand	Anodyne	HTR1A	18	42
COc1ccccc1[C@@H]1CN(CC[C@@H]2CCOC2)CCN1CC[C@H]1CCOC1	ZINC000450920774	GG	On-Demand	Anodyne	HTR1A	18	42
COc1ccccc1[C@@H]1CN(CC[C@H]2CCOC2)CCN1CC[C@@H]1CCOC1	ZINC000450920775	GG	On-Demand	Anodyne	HTR1A	18	42
CCCc1cc(C(=O)N(CC(=O)OCC)C2CCC2)no1	ZINC000450920778	CE	On-Demand	Anodyne	ACE	48	45
CCCc1cc(C(=O)N(CC(=O)OCC)C2CCC2)no1	ZINC000450920778	CE	On-Demand	Anodyne	S1PR3	0	65
Cc1nc(-c2ccccn2)nc(N2CCC[C@H](NC(=O)N(C)C)C2)c1C	ZINC000450920790	FE	On-Demand	Anodyne	METAP1	31	40
Cc1nc(-c2ccccn2)nc(N2CCC[C@H](NC(=O)N(C)C)C2)c1C	ZINC000450920790	FE	On-Demand	Anodyne	MAP3K12	28	41
Cc1nc(-c2ccccn2)nc(N2CCC[C@@H](NC(=O)N(C)C)C2)c1C	ZINC000450920791	FE	On-Demand	Anodyne	METAP1	31	40
Cc1nc(-c2ccccn2)nc(N2CCC[C@@H](NC(=O)N(C)C)C2)c1C	ZINC000450920791	FE	On-Demand	Anodyne	MAP3K12	28	41
COc1cccc(OCCC(=O)N[C@H]2COc3ccc(F)cc32)c1	ZINC000450920792	EF	On-Demand	Anodyne	MTNR1A	27	41
COc1cccc(OCCC(=O)N[C@@H]2COc3ccc(F)cc32)c1	ZINC000450920793	EF	On-Demand	Anodyne	MTNR1A	27	41
C=CCc1ccccc1OC[C@H](O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920798	GD	On-Demand	Mild	ADRB2	55	62
C=CCc1ccccc1OC[C@H](O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920798	GD	On-Demand	Mild	ADRB1	16	62
C=CCc1ccccc1OC[C@H](O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920798	GD	On-Demand	Mild	ADRB3	51	62
C=CCc1ccccc1OC[C@H](O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920798	GD	On-Demand	Mild	ABCB1	92	43
C=CCc1ccccc1OC[C@@H](O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920799	GD	On-Demand	Mild	ADRB2	55	62
C=CCc1ccccc1OC[C@@H](O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920799	GD	On-Demand	Mild	ADRB1	16	62
C=CCc1ccccc1OC[C@@H](O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920799	GD	On-Demand	Mild	ADRB3	51	62
C=CCc1ccccc1OC[C@@H](O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920799	GD	On-Demand	Mild	ABCB1	92	43
CCOC(=O)CN(C(=O)Cc1ccc(O)c(OC)c1)C1CCC1	ZINC000450920812	DD	On-Demand	Anodyne	TRPV1	24	44
Cc1cccc(C)c1NC(=O)CCCN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450920826	GD	On-Demand	Anodyne	ACAT	0	42
O[C@H]1C[C@@H](Nc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450920829	CF	On-Demand	Anodyne	HNMT	42	33
CCOC(=O)CN(C(=O)c1cn(CC2CC2)nn1)C1CCC1	ZINC000450920849	DD	On-Demand	Anodyne	ACE	47	44
CN(C)C(=O)N[C@H]1CCCN(c2nccc(OCc3ccccc3)n2)C1	ZINC000450920858	FE	On-Demand	Anodyne	PREP	42	34
CN(C)C(=O)N[C@@H]1CCCN(c2nccc(OCc3ccccc3)n2)C1	ZINC000450920859	FE	On-Demand	Anodyne	PREP	42	34
CN(C)C(=O)N[C@H]1CCCN(c2cncc(OCc3cccc(Cl)c3)n2)C1	ZINC000450920860	GF	On-Demand	Anodyne	GRM5	17	43
CN(C)C(=O)N[C@@H]1CCCN(c2cncc(OCc3cccc(Cl)c3)n2)C1	ZINC000450920861	GF	On-Demand	Anodyne	GRM5	17	43
C[C@H](O)CNC(=O)c1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450920863	FD	On-Demand	Anodyne	MAOB	28	41
C[C@H](O)CNC(=O)c1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450920863	FD	On-Demand	Anodyne	MMP13	16	44
C[C@H](O)CNC(=O)c1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450920863	FD	On-Demand	Anodyne	ADAMTS4	52	43
C[C@H](O)CNC(=O)c1ccc(OCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450920863	FD	On-Demand	Anodyne	FFAR1	44	40
CO[C@@H]1Cc2ccccc2N(Cc2cccc(C(C)=O)c2)C1	ZINC000450920885	CG	On-Demand	Anodyne	TPP2	52	34
CO[C@H]1Cc2ccccc2N(Cc2cccc(C(C)=O)c2)C1	ZINC000450920886	CG	On-Demand	Anodyne	TPP2	52	34
Cc1cc(C)n(-c2cncc(N3CCC[C@H](NC(=O)N(C)C)C3)n2)n1	ZINC000450920889	ED	On-Demand	Anodyne	ADORA2A	15	40
Cc1cc(C)n(-c2cncc(N3CCC[C@@H](NC(=O)N(C)C)C3)n2)n1	ZINC000450920890	ED	On-Demand	Anodyne	ADORA2A	15	40
C[C@@H](O)CCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450920904	DD	On-Demand	Anodyne	PTGDR2	25	42
C[C@H](O)CCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450920905	DD	On-Demand	Anodyne	PTGDR2	25	42
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2C#N)C1	ZINC000450920906	EF	On-Demand	Mild	LIPG	58	38
CN(C)C(=O)N[C@H]1CCCN(c2ccc(C(F)(F)F)cc2C#N)C1	ZINC000450920907	EF	On-Demand	Mild	LIPG	58	38
CN(C)C(=O)N[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450920908	FF	On-Demand	Bother	WNT3	40	31
CN(C)C(=O)N[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450920908	FF	On-Demand	Bother	AADAC	0	41
CN(C)C(=O)N[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450920909	FF	On-Demand	Bother	WNT3	40	31
CN(C)C(=O)N[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450920909	FF	On-Demand	Bother	AADAC	0	41
Cc1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)c(Br)c1	ZINC000450920910	GG	On-Demand	Anodyne	ADAM17	37	40
CCOC(=O)CN(C(=O)c1ccc(N2CCC2)nc1)C1CCC1	ZINC000450920912	DD	On-Demand	Anodyne	ACE	45	41
CCOC(=O)CN(C(=O)c1cn(-c2cccc(OC)c2)nn1)C1CCC1	ZINC000450920929	FD	On-Demand	Anodyne	DRD4	42	33
CCOC(=O)CN(C(=O)c1cn(-c2cccc(OC)c2)nn1)C1CCC1	ZINC000450920929	FD	On-Demand	Anodyne	ESRRA	22	47
CCOC(=O)CN(C(=O)c1cc2c(Br)c(F)ccc2[nH]1)C1CCC1	ZINC000450920933	GH	On-Demand	Anodyne	ACE	42	45
CCOC(=O)CN(C(=O)c1cc2c(Br)c(F)ccc2[nH]1)C1CCC1	ZINC000450920933	GH	On-Demand	Anodyne	PYGL	36	53
CCc1ccc(CN(C)C(=O)CN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450920942	GD	On-Demand	Anodyne	LIMK2	31	40
COC(=O)c1ccc(CN[C@@H]2CCCC[C@H]2OC(F)F)cc1Cl	ZINC000450920944	EH	On-Demand	Anodyne	SSTR3	28	47
CCOC(=O)c1ccc(CN(C)CC(=O)N(C)[C@@H](C)c2ccccc2)nc1	ZINC000450920947	FF	On-Demand	Anodyne	P2RY12	16	40
CCOC(=O)c1ccc(CN(C)CC(=O)N(C)[C@H](C)c2ccccc2)nc1	ZINC000450920948	FF	On-Demand	Anodyne	P2RY12	16	40
CCOC(=O)CN(C(=O)c1cn2nccc2nc1C)C1CCC1	ZINC000450920960	DD	On-Demand	Anodyne	ACE	55	45
COc1cc(CN2CC(=O)N(C)[C@@H](C)C2)ccc1Cl	ZINC000450920961	CE	On-Demand	Anodyne	CCR1	23	42
COc1cc(CN2CC(=O)N(C)[C@H](C)C2)ccc1Cl	ZINC000450920962	CE	On-Demand	Anodyne	CCR1	23	42
C[C@H](O)CNC(=O)c1ccc(OC[C@H]2CCCCC2(F)F)cc1	ZINC000450920966	EG	On-Demand	Anodyne	KCNQ1	0	48
C[C@H](O)CNC(=O)c1ccc(OC[C@@H]2CCCCC2(F)F)cc1	ZINC000450920967	EG	On-Demand	Anodyne	KCNQ1	0	48
COCCN(Cc1ccc(F)c(Cl)c1)c1ccccn1	ZINC000450920979	CH	On-Demand	Anodyne	SSTR2	17	40
CCOC(=O)CN(C(=O)c1cc(C)n(C(C)C)n1)C1CCC1	ZINC000450920980	DE	On-Demand	Anodyne	ACE	48	44
Cn1ncc(Br)c1C(=O)NC1(Cc2ccccc2)CCCCC1	ZINC000450920981	GH	On-Demand	Anodyne	SLC12A5	46	34
CCOC(=O)CN(C(=O)c1ocnc1-c1ccccc1)C1CCC1	ZINC000450920997	EF	On-Demand	Anodyne	ACE	59	45
C[C@H](O)CCCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450921001	DE	On-Demand	Anodyne	PTGDR2	25	42
C[C@@H](O)CCCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450921002	DE	On-Demand	Anodyne	PTGDR2	25	42
CCOC(=O)CN(C(=O)c1cc2n(n1)CCC2)C1CCC1	ZINC000450921020	CD	On-Demand	Anodyne	ACE	50	46
CCN1CCN(CC(C)(C)Nc2ccc(C(C)=O)cc2[N+](=O)[O-])CC1	ZINC000450921032	EF	On-Demand	Bother	AKR1C3	15	41
CCOC(=O)CN(C(=O)c1cnc(OC2CCOCC2)c(Cl)c1)C1CCC1	ZINC000450921037	GF	On-Demand	Anodyne	ACE	43	47
CCOC(=O)CN(C(=O)c1cnc(OC2CCOCC2)c(Cl)c1)C1CCC1	ZINC000450921037	GF	On-Demand	Anodyne	PYGL	21	44
COc1cc(OCCCCCC(C)=O)ccc1C#N	ZINC000450921049	CG	On-Demand	Mild	THRA	40	37
COc1cc(OCCCCCC(C)=O)ccc1C#N	ZINC000450921049	CG	On-Demand	Mild	P2RY12	24	40
COc1cc(OCCCCCC(C)=O)ccc1C#N	ZINC000450921049	CG	On-Demand	Mild	EDNRA	0	41
CN(C)C(=O)N[C@H]1CCCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450921058	GD	On-Demand	Anodyne	PIK3CA	51	42
CN(C)C(=O)N[C@H]1CCCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450921058	GD	On-Demand	Anodyne	MTOR	55	38
CN(C)C(=O)N[C@@H]1CCCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450921059	GD	On-Demand	Anodyne	PIK3CA	51	42
CN(C)C(=O)N[C@@H]1CCCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450921059	GD	On-Demand	Anodyne	MTOR	55	38
Cc1ccc(NC(=O)c2c[nH]c3nccc-3c2)cc1NC(=O)CCN(C)C	ZINC000450921065	FF	On-Demand	Anodyne	MAPK14	20	40
C[C@H](O)CNC(=O)c1ccc(OCCC(C)(F)F)cc1	ZINC000450921068	CE	On-Demand	Anodyne	KCNQ1	0	51
CN(C)C(=O)N[C@@H]1CCCN(c2cc(C(F)(F)F)nc(-c3ccncc3)n2)C1	ZINC000450921075	GF	On-Demand	Anodyne	PRKD1	55	39
CN(C)C(=O)N[C@H]1CCCN(c2cc(C(F)(F)F)nc(-c3ccncc3)n2)C1	ZINC000450921076	GF	On-Demand	Anodyne	PRKD1	55	39
COc1cccc(OCCC(=O)Nc2ccc(OC(C)C)c(OC)c2)c1	ZINC000450921082	FH	On-Demand	Anodyne	PDGFRB	25	42
COc1cccc(OCCC(=O)Nc2ccc(OC(C)C)c(OC)c2)c1	ZINC000450921082	FH	On-Demand	Anodyne	MTNR1A	38	48
COc1cccc(OCCC(=O)Nc2ccc(OC(C)C)c(OC)c2)c1	ZINC000450921082	FH	On-Demand	Anodyne	MTNR1B	40	45
COc1cccc(OCCC(=O)Nc2ccc(OC(C)C)c(OC)c2)c1	ZINC000450921082	FH	On-Demand	Anodyne	ENPP1	68	41
COc1cccc2c(N3CCC[C@H](NC(=O)N(C)C)C3)cc(C)nc12	ZINC000450921083	EF	On-Demand	Anodyne	BDKRB2	55	40
COc1cccc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)cc(C)nc12	ZINC000450921084	EF	On-Demand	Anodyne	BDKRB2	55	40
COc1cc(NC(=O)[C@@H](O)C2CCC2)ccc1OC(C)C	ZINC000450921093	CF	On-Demand	Anodyne	QRFPR	40	33
COc1cc(NC(=O)[C@@H](O)C2CCC2)ccc1OC(C)C	ZINC000450921093	CF	On-Demand	Anodyne	ENPP1	57	33
COc1cc(NC(=O)[C@H](O)C2CCC2)ccc1OC(C)C	ZINC000450921094	CF	On-Demand	Anodyne	QRFPR	40	33
COc1cc(NC(=O)[C@H](O)C2CCC2)ccc1OC(C)C	ZINC000450921094	CF	On-Demand	Anodyne	ENPP1	57	33
CCOC(=O)CN(C(=O)c1oc2ccccc2c1CC)C1CCC1	ZINC000450921095	EH	On-Demand	Anodyne	ACE	43	43
O=C(COc1ccccc1NC(=O)CSC1CC1)Nc1cccnc1	ZINC000450921107	FF	On-Demand	Anodyne	CHRNA7	31	41
CC[C@@H](O)CC(=O)NCCc1c(C)oc2ccccc12	ZINC000450921114	CF	On-Demand	Anodyne	MTNR1A	27	40
CC[C@H](O)CC(=O)NCCc1c(C)oc2ccccc12	ZINC000450921115	CF	On-Demand	Anodyne	MTNR1A	27	40
COC(=O)[C@]1(C)CN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450921116	DF	On-Demand	Anodyne	HTR4	51	35
COC(=O)[C@]1(C)CN(Cc2ccc(Cl)c(OC)c2)C[C@H]1C	ZINC000450921116	DF	On-Demand	Anodyne	SSTR5	46	36
CCOC(=O)CN(C(=O)c1cccc(CC)n1)C1CCC1	ZINC000450921130	CE	On-Demand	Anodyne	ACE	60	45
Cc1nnc2n1C[C@@H](C(=O)OC(C)(C)C)N(CCCC(=O)c1ccccc1)C2	ZINC000450921143	GF	On-Demand	Anodyne	CYP2J2	50	37
Cc1nnc2n1C[C@H](C(=O)OC(C)(C)C)N(CCCC(=O)c1ccccc1)C2	ZINC000450921144	GF	On-Demand	Anodyne	CYP2J2	50	37
COCCN(Cc1ccc(F)c(Cl)c1)c1nc(O)c2cnn(C)c2n1	ZINC000450921159	FF	On-Demand	Anodyne	Q9M629_MAIZE	53	33
CCOc1cc2nccc(N3CCC[C@H](NC(=O)N(C)C)C3)c2cc1OCC	ZINC000450921168	GG	On-Demand	Anodyne	SSTR5	57	39
CCOc1cc2nccc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2cc1OCC	ZINC000450921169	GG	On-Demand	Anodyne	SSTR5	57	39
CCOC(=O)CN(C(=O)c1ccn(CCc2ccccc2)n1)C1CCC1	ZINC000450921178	FF	On-Demand	Anodyne	ACE	44	39
COc1ccc(CNC(=O)CCN2CC(=O)N(C)[C@H](C)C2)c(OC)c1	ZINC000450921185	EC	On-Demand	Anodyne	MTNR1A	42	35
COc1ccc(CNC(=O)CCN2CC(=O)N(C)[C@@H](C)C2)c(OC)c1	ZINC000450921186	EC	On-Demand	Anodyne	MTNR1A	42	35
COCCN(Cc1ccc(F)c(Cl)c1)c1ccc(S(C)(=O)=O)cc1	ZINC000450921187	FH	On-Demand	Anodyne	PTGS2	27	43
CCCCCNC(=O)[C@H](C)N1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450921193	EC	On-Demand	Anodyne	ASAH1	45	32
CCCCCNC(=O)[C@@H](C)N1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450921194	EC	On-Demand	Anodyne	ASAH1	45	32
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450921207	FF	On-Demand	Bother	GYRB	0	54
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450921208	FF	On-Demand	Bother	GYRB	0	54
Cc1csc2c(N[C@@H]3C[C@H](O)C3)ncnc12	ZINC000450921219	BD	On-Demand	Anodyne	LPAR2	21	42
C[C@H](O)CNC(=O)c1ccc(OCC2CC(F)(F)C2)cc1	ZINC000450921222	CE	On-Demand	Anodyne	KCNQ1	0	42
COC(=O)COc1ccc([C@@H](C)NC(=O)c2c(C)cccc2Cl)cc1	ZINC000450921229	FH	On-Demand	Anodyne	ACACA	60	38
COC(=O)COc1ccc([C@H](C)NC(=O)c2c(C)cccc2Cl)cc1	ZINC000450921230	FH	On-Demand	Anodyne	ACACA	60	38
CCOC(=O)CN(C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1)C1CCC1	ZINC000450921231	GE	On-Demand	Anodyne	CCR5	24	40
CC(C)NS(=O)(=O)N1CCN(CC(=O)NCCc2ccc(F)cc2)CC1	ZINC000450921232	GC	On-Demand	Anodyne	SLC27A1	43	36
CCOC(=O)CN(C(=O)c1cnn(-c2ccncc2)c1)C1CCC1	ZINC000450921239	ED	On-Demand	Anodyne	ACE	37	40
C[C@H](O)CNC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)cc1	ZINC000450921247	EF	On-Demand	Anodyne	FLT3	41	37
C[C@H](O)CNC(=O)c1ccc(OCc2cc(C(C)(C)C)on2)cc1	ZINC000450921247	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc(C#N)c2)C1	ZINC000450921248	CD	On-Demand	Mild	HRH4	19	40
CN(C)C(=O)N[C@H]1CCCN(c2ccnc(C#N)c2)C1	ZINC000450921249	CD	On-Demand	Mild	HRH4	19	40
CCOC(=O)CN(C(=O)c1cncc(Cl)c1)C1CCC1	ZINC000450921250	CE	On-Demand	Anodyne	ACE	55	53
C[C@H](O)CNC(=O)c1ccc(OCCc2ccc(Cl)cc2)cc1	ZINC000450921256	EG	On-Demand	Anodyne	ADRB1	29	43
C[C@H](O)CNC(=O)c1ccc(OCCc2ccc(Cl)cc2)cc1	ZINC000450921256	EG	On-Demand	Anodyne	PTGS2	0	42
C[C@H](O)CNC(=O)c1ccc(OCCc2ccc(Cl)cc2)cc1	ZINC000450921256	EG	On-Demand	Anodyne	GRIN1	0	40
C[C@H](O)CNC(=O)c1ccc(OCCc2ccc(Cl)cc2)cc1	ZINC000450921256	EG	On-Demand	Anodyne	KCNQ1	0	41
C[C@H](O)CNC(=O)c1ccc(OCCc2ccc(Cl)cc2)cc1	ZINC000450921256	EG	On-Demand	Anodyne	PLA2G4A	74	36
C[C@H](O)CNC(=O)c1ccc(OCCc2ccc(Cl)cc2)cc1	ZINC000450921256	EG	On-Demand	Anodyne	UTS2	44	37
CCOC(=O)CN(C(=O)c1ccsc1C)C1CCC1	ZINC000450921257	CF	On-Demand	Anodyne	ACE	62	52
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450921261	FF	On-Demand	Bother	LIPG	56	35
CN(C)C(=O)N[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450921262	FF	On-Demand	Bother	LIPG	56	35
CCOC(=O)CN(C(=O)[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450921280	DE	On-Demand	Anodyne	ACE	42	38
CCOC(=O)CN(C(=O)[C@H](Cc1ccccc1)OC)C1CCC1	ZINC000450921280	DE	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)CN(C(=O)[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450921281	DE	On-Demand	Anodyne	ACE	42	38
CCOC(=O)CN(C(=O)[C@@H](Cc1ccccc1)OC)C1CCC1	ZINC000450921281	DE	On-Demand	Anodyne	AMY2	44	31
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(=O)(=O)NCC3CC3)cn2)C1	ZINC000450921282	GD	On-Demand	Anodyne	NPY2R	40	34
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(=O)(=O)NCC3CC3)cn2)C1	ZINC000450921283	GD	On-Demand	Anodyne	NPY2R	40	34
CCN1CCN(CC(C)(C)Nc2ccc(C(=O)NC)cc2[N+](=O)[O-])CC1	ZINC000450921286	FD	On-Demand	Bother	TAAR1	19	40
CCOC(=O)CN(C(=O)Cc1ccccc1O[C@H]1CCOC1)C1CCC1	ZINC000450921294	FE	On-Demand	Anodyne	PDEC	0	40
CCOC(=O)CN(C(=O)Cc1ccccc1O[C@@H]1CCOC1)C1CCC1	ZINC000450921295	FE	On-Demand	Anodyne	PDEC	0	40
CCNC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nn1	ZINC000450921306	DC	On-Demand	Anodyne	SCD1	44	41
CCNC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nn1	ZINC000450921307	DC	On-Demand	Anodyne	SCD1	44	41
CCOc1ccccc1OCCN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450921310	FD	On-Demand	Anodyne	HTR1A	20	47
CCOc1ccccc1OCCN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450921310	FD	On-Demand	Anodyne	HTR7	29	48
CCOc1ccccc1OCCN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450921310	FD	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1OCCN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450921310	FD	On-Demand	Anodyne	HCN4	41	34
C[C@H](O)CNC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450921319	CD	On-Demand	Anodyne	KCNQ1	0	49
C[C@H](O)CNC(=O)c1ccc(OCCC[C@@H](C)O)cc1	ZINC000450921319	CD	On-Demand	Anodyne	PLA2G4B	57	36
C[C@H](O)CCCOc1ccc(C(=O)NC[C@H](C)O)cc1	ZINC000450921320	CD	On-Demand	Anodyne	KCNQ1	0	49
C[C@H](O)CCCOc1ccc(C(=O)NC[C@H](C)O)cc1	ZINC000450921320	CD	On-Demand	Anodyne	PLA2G4B	57	36
CN(C)C(=O)N[C@@H]1CCCN(c2cc(-n3cccn3)nc(N)n2)C1	ZINC000450921326	EC	On-Demand	Anodyne	HRH4	44	44
CN(C)C(=O)N[C@H]1CCCN(c2cc(-n3cccn3)nc(N)n2)C1	ZINC000450921327	EC	On-Demand	Anodyne	HRH4	44	44
Cc1ccc(NC(=O)C2=C(c3ccccc3)CCC2)cc1NC(=O)CCN(C)C	ZINC000450921330	GI	On-Demand	Anodyne	DHODH	19	43
Cc1ccc(NC(=O)C2=C(c3ccccc3)CCC2)cc1NC(=O)CCN(C)C	ZINC000450921330	GI	On-Demand	Anodyne	LDLR	0	45
CCOC(=O)CN(C(=O)c1cn(C)nc1COC)C1CCC1	ZINC000450921331	DD	On-Demand	Anodyne	ACE	43	47
COCCNC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450921332	EC	On-Demand	Anodyne	HPGDS	31	45
COCCNC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450921333	EC	On-Demand	Anodyne	HPGDS	31	45
CCN1CCN(CC(C)(C)Nc2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450921336	GD	On-Demand	Anodyne	PRNP	45	44
CCN1CCN(CC(C)(C)Nc2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450921336	GD	On-Demand	Anodyne	NOD2	40	34
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	PDGFRB	39	42
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	COLA	59	37
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	CPT1A	53	36
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	CPT2	46	34
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	PRNP	57	43
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	CPT1B	44	35
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	IMPDH2	0	42
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	ENPP1	62	36
COc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1OC(C)C	ZINC000450921343	EG	On-Demand	Anodyne	DGAT1	44	38
CCOC(=O)CN(C(=O)c1ccc(-n2nnnc2C)cc1F)C1CCC1	ZINC000450921347	FD	On-Demand	Anodyne	ACE	30	43
CCOC(=O)CN(C(=O)c1cnc(C2CC2)nc1)C1CCC1	ZINC000450921353	DD	On-Demand	Anodyne	ACE	50	45
CCOC(=O)CN(C(=O)c1ccc(Oc2ccccc2OC)cn1)C1CCC1	ZINC000450921355	GG	On-Demand	Anodyne	ACE	41	38
CCOC(=O)CN(C(=O)c1ccc(Oc2ccccc2OC)cn1)C1CCC1	ZINC000450921355	GG	On-Demand	Anodyne	MBTPS1	50	35
CCOC(=O)CN(C(=O)c1ccc(Oc2ccccc2OC)cn1)C1CCC1	ZINC000450921355	GG	On-Demand	Anodyne	ACKR3	47	32
COc1cc(NC(=O)C2(Cc3ccccc3)CCOCC2)ccc1OC(C)C	ZINC000450921358	GI	On-Demand	Anodyne	ENPP1	71	33
C[C@H](O)CNC(=O)c1ccc(OC[C@@H]2CCC(F)(F)C2)cc1	ZINC000450921380	DF	On-Demand	Anodyne	KCNQ1	0	44
C[C@H](O)CNC(=O)c1ccc(OC[C@H]2CCC(F)(F)C2)cc1	ZINC000450921381	DF	On-Demand	Anodyne	KCNQ1	0	44
CCN1CCN(CC(C)(C)Nc2ncnc3cc(Cl)ccc23)CC1	ZINC000450921382	EG	On-Demand	Anodyne	HRP1_PLAFA	67	34
CCN1CCN(CC(C)(C)Nc2ncnc3cc(Cl)ccc23)CC1	ZINC000450921382	EG	On-Demand	Anodyne	HNMT	55	39
CCN1CCN(CC(C)(C)Nc2ncnc3cc(Cl)ccc23)CC1	ZINC000450921382	EG	On-Demand	Anodyne	HTT	0	50
CCOC(=O)CN(C(=O)c1cc(OCC)no1)C1CCC1	ZINC000450921385	CD	On-Demand	Anodyne	ACE	47	45
CCS(=O)(=O)c1ccc(CN2C[C@@H](C)[C@](C)(C(=O)OC)C2)cc1	ZINC000450921389	EE	On-Demand	Anodyne	RORC	40	32
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450921395	ED	On-Demand	Anodyne	NPY2R	0	43
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450921395	ED	On-Demand	Anodyne	AKR1C3	25	41
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450921396	ED	On-Demand	Anodyne	NPY2R	0	43
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450921396	ED	On-Demand	Anodyne	AKR1C3	25	41
CN(C)C(=O)N[C@@H]1CCCN(c2nc3cc(F)ccc3o2)C1	ZINC000450921423	DE	On-Demand	Anodyne	PTGES	38	45
CN(C)C(=O)N[C@@H]1CCCN(c2nc3cc(F)ccc3o2)C1	ZINC000450921423	DE	On-Demand	Anodyne	NPBWR1	39	40
CN(C)C(=O)N[C@H]1CCCN(c2nc3cc(F)ccc3o2)C1	ZINC000450921424	DE	On-Demand	Anodyne	PTGES	38	45
CN(C)C(=O)N[C@H]1CCCN(c2nc3cc(F)ccc3o2)C1	ZINC000450921424	DE	On-Demand	Anodyne	NPBWR1	39	40
CCOC(=O)CN(C(=O)c1ccc(Oc2ccc(OC)cc2)cn1)C1CCC1	ZINC000450921426	GG	On-Demand	Anodyne	ACE	36	40
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)nc(-c2ccncc2)n1	ZINC000450921444	EE	On-Demand	Anodyne	PKD2	0	41
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc(-c2ccncc2)n1	ZINC000450921445	EE	On-Demand	Anodyne	PKD2	0	41
CCOC(=O)c1ccc(CN2C[C@@H](OC)Cc3ccccc32)nc1	ZINC000450921456	EF	On-Demand	Anodyne	TPP2	42	35
CCOC(=O)c1ccc(CN2C[C@H](OC)Cc3ccccc32)nc1	ZINC000450921457	EF	On-Demand	Anodyne	TPP2	42	35
CCN1CCN(CC(C)(C)Nc2ncc([N+](=O)[O-])s2)CC1	ZINC000450921460	DD	On-Demand	Bother	MAPK9	15	40
CC(C)NS(=O)(=O)N1CCN(CC(=O)NCCCc2ccccc2)CC1	ZINC000450921463	GC	On-Demand	Anodyne	FKBP1A	27	43
CC(C)NS(=O)(=O)N1CCN(CC(=O)NCCCc2ccccc2)CC1	ZINC000450921463	GC	On-Demand	Anodyne	SCN2A	21	42
CC(C)NS(=O)(=O)N1CCN(CC(=O)NCCCc2ccccc2)CC1	ZINC000450921463	GC	On-Demand	Anodyne	AMP1_PLAFQ	24	41
CC(C)NS(=O)(=O)N1CCN(CC(=O)NCCCc2ccccc2)CC1	ZINC000450921463	GC	On-Demand	Anodyne	CRTM	35	40
COc1cc2c(N[C@@H]3C[C@H](O)C3)ncnc2cc1F	ZINC000450921464	CD	On-Demand	Anodyne	EGFR	22	41
COc1cc2c(N[C@@H]3C[C@H](O)C3)ncnc2cc1F	ZINC000450921464	CD	On-Demand	Anodyne	PIK3R1	0	40
COc1cc2c(N[C@@H]3C[C@H](O)C3)ncnc2cc1F	ZINC000450921464	CD	On-Demand	Anodyne	FLT1	25	46
COc1cc2c(N[C@@H]3C[C@H](O)C3)ncnc2cc1F	ZINC000450921464	CD	On-Demand	Anodyne	EPHA2	47	37
COc1cc2c(N[C@@H]3C[C@H](O)C3)ncnc2cc1F	ZINC000450921464	CD	On-Demand	Anodyne	MKNK1	22	44
CCOC(=O)CN(C(=O)[C@@H]1C[C@@]1(C)c1ccccc1)C1CCC1	ZINC000450921474	DF	On-Demand	Anodyne	ACE	48	41
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450921476	DF	On-Demand	Anodyne	ADAM17	65	37
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450921476	DF	On-Demand	Anodyne	FAP	0	42
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450921477	DF	On-Demand	Anodyne	ADAM17	65	37
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450921477	DF	On-Demand	Anodyne	FAP	0	42
CCOC(=O)CN(C(=O)c1cc(-c2ccccc2)nn1C)C1CCC1	ZINC000450921478	EF	On-Demand	Anodyne	ACE	56	42
C[C@@H]1CN(CCc2ccc(Cl)cc2)CC(=O)N1C	ZINC000450921493	CE	On-Demand	Anodyne	CACNA1C	0	43
C[C@@H]1CN(CCc2ccc(Cl)cc2)CC(=O)N1C	ZINC000450921493	CE	On-Demand	Anodyne	CACNA1D	54	43
C[C@H]1CN(CCc2ccc(Cl)cc2)CC(=O)N1C	ZINC000450921494	CE	On-Demand	Anodyne	CACNA1C	0	43
C[C@H]1CN(CCc2ccc(Cl)cc2)CC(=O)N1C	ZINC000450921494	CE	On-Demand	Anodyne	CACNA1D	54	43
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450921495	FE	On-Demand	Anodyne	HPGDS	23	41
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450921496	FE	On-Demand	Anodyne	HPGDS	23	41
C[C@H](O)CNC(=O)c1ccc(OC[C@@H]2CCCC2(F)F)cc1	ZINC000450921501	DF	On-Demand	Anodyne	KCNQ1	0	47
C[C@H](O)CNC(=O)c1ccc(OC[C@H]2CCCC2(F)F)cc1	ZINC000450921502	DF	On-Demand	Anodyne	KCNQ1	0	47
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc(C(C)C)n1	ZINC000450921510	DE	On-Demand	Anodyne	HRH4	15	47
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)nc(C(C)C)n1	ZINC000450921511	DE	On-Demand	Anodyne	HRH4	15	47
CCOC(=O)CN(C(=O)c1ccc(OC)c(S(C)(=O)=O)c1)C1CCC1	ZINC000450921541	FD	On-Demand	Anodyne	ACE	46	42
CCOC(=O)CN(C(=O)c1ccc(OC)c(S(C)(=O)=O)c1)C1CCC1	ZINC000450921541	FD	On-Demand	Anodyne	MBTPS1	49	32
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450921542	DD	On-Demand	Anodyne	ACACA	26	48
CC[C@H](O)CC(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450921542	DD	On-Demand	Anodyne	ACACB	34	50
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450921543	DD	On-Demand	Anodyne	ACACA	26	48
CC[C@@H](O)CC(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450921543	DD	On-Demand	Anodyne	ACACB	34	50
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450921544	DD	On-Demand	Anodyne	ACACA	26	48
CC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450921544	DD	On-Demand	Anodyne	ACACB	34	50
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450921545	DD	On-Demand	Anodyne	ACACA	26	48
CC[C@H](O)CC(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450921545	DD	On-Demand	Anodyne	ACACB	34	50
CN(C)C(=O)N[C@H]1CCCN(c2c(C#N)cnc3ccccc23)C1	ZINC000450921577	DE	On-Demand	Mild	FAP	0	41
CN(C)C(=O)N[C@@H]1CCCN(c2c(C#N)cnc3ccccc23)C1	ZINC000450921578	DE	On-Demand	Mild	FAP	0	41
CN(C)C(=O)N[C@@H]1CCCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450921612	FH	On-Demand	Anodyne	LIPG	44	32
CN(C)C(=O)N[C@H]1CCCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450921613	FH	On-Demand	Anodyne	LIPG	44	32
CN(C)C(=O)N[C@H]1CCCN(c2nccc3ccc(F)cc23)C1	ZINC000450921616	DF	On-Demand	Anodyne	CCR3	32	40
CN(C)C(=O)N[C@H]1CCCN(c2nccc3ccc(F)cc23)C1	ZINC000450921616	DF	On-Demand	Anodyne	FAP	0	40
CN(C)C(=O)N[C@@H]1CCCN(c2nccc3ccc(F)cc23)C1	ZINC000450921617	DF	On-Demand	Anodyne	CCR3	32	40
CN(C)C(=O)N[C@@H]1CCCN(c2nccc3ccc(F)cc23)C1	ZINC000450921617	DF	On-Demand	Anodyne	FAP	0	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450921638	ED	On-Demand	Anodyne	NPY2R	0	43
CN(C)C(=O)N[C@@H]1CCCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450921638	ED	On-Demand	Anodyne	MTNR1A	30	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450921638	ED	On-Demand	Anodyne	MTNR1B	0	40
CN(C)C(=O)N[C@H]1CCCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450921639	ED	On-Demand	Anodyne	NPY2R	0	43
CN(C)C(=O)N[C@H]1CCCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450921639	ED	On-Demand	Anodyne	MTNR1A	30	40
CN(C)C(=O)N[C@H]1CCCN(c2ccccc2S(C)(=O)=O)C1	ZINC000450921639	ED	On-Demand	Anodyne	MTNR1B	0	40
CCOC(=O)CN(C(=O)c1cc2cccnc2s1)C1CCC1	ZINC000450921643	DF	On-Demand	Anodyne	ACE	47	42
CN(C)C(=O)N[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450921653	FD	On-Demand	Anodyne	SCD1	52	45
CN(C)C(=O)N[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450921653	FD	On-Demand	Anodyne	SCD	41	45
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450921654	FD	On-Demand	Anodyne	SCD1	52	45
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450921654	FD	On-Demand	Anodyne	SCD	41	45
CN(C)C(=O)N[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000450921662	DE	On-Demand	Anodyne	TRPV1	39	48
CN(C)C(=O)N[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000450921662	DE	On-Demand	Anodyne	SFRP1	67	33
CN(C)C(=O)N[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000450921662	DE	On-Demand	Anodyne	WNT3	40	30
CN(C)C(=O)N[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000450921663	DE	On-Demand	Anodyne	TRPV1	39	48
CN(C)C(=O)N[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000450921663	DE	On-Demand	Anodyne	SFRP1	67	33
CN(C)C(=O)N[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000450921663	DE	On-Demand	Anodyne	WNT3	40	30
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)cc1	ZINC000450921671	GE	On-Demand	Anodyne	MMP13	36	45
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)cc1	ZINC000450921671	GE	On-Demand	Anodyne	MMP2	24	45
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)cc1	ZINC000450921671	GE	On-Demand	Anodyne	MMP14	16	45
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)cc1	ZINC000450921671	GE	On-Demand	Anodyne	MMP10	26	43
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)cc1	ZINC000450921671	GE	On-Demand	Anodyne	ADAMTS4	66	46
CCS(=O)(=O)c1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)cc1	ZINC000450921671	GE	On-Demand	Anodyne	RORC	45	38
CO[C@@H](COc1ccc(C(=O)NC[C@H](C)O)cc1)Cc1ccccc1	ZINC000450921672	EE	On-Demand	Anodyne	PPARA	22	40
CO[C@@H](COc1ccc(C(=O)NC[C@H](C)O)cc1)Cc1ccccc1	ZINC000450921672	EE	On-Demand	Anodyne	CTRB_BOVIN	44	30
CO[C@@H](COc1ccc(C(=O)NC[C@H](C)O)cc1)Cc1ccccc1	ZINC000450921672	EE	On-Demand	Anodyne	POL	0	43
CO[C@@H](COc1ccc(C(=O)NC[C@H](C)O)cc1)Cc1ccccc1	ZINC000450921672	EE	On-Demand	Anodyne	PDS	72	43
CO[C@H](COc1ccc(C(=O)NC[C@H](C)O)cc1)Cc1ccccc1	ZINC000450921673	EE	On-Demand	Anodyne	PPARA	22	40
CO[C@H](COc1ccc(C(=O)NC[C@H](C)O)cc1)Cc1ccccc1	ZINC000450921673	EE	On-Demand	Anodyne	CTRB_BOVIN	44	30
CO[C@H](COc1ccc(C(=O)NC[C@H](C)O)cc1)Cc1ccccc1	ZINC000450921673	EE	On-Demand	Anodyne	POL	0	43
CO[C@H](COc1ccc(C(=O)NC[C@H](C)O)cc1)Cc1ccccc1	ZINC000450921673	EE	On-Demand	Anodyne	PDS	72	43
CN(C)S(=O)(=O)c1cc(Cl)ccc1OCC1(C#N)CCC1	ZINC000450921675	EF	On-Demand	Mild	PTGDR2	19	41
CN(C)C(=O)N[C@@H]1CCCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450921684	DD	On-Demand	Anodyne	PRCP	0	45
CN(C)C(=O)N[C@@H]1CCCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450921684	DD	On-Demand	Anodyne	HRH4	32	46
CN(C)C(=O)N[C@@H]1CCCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450921684	DD	On-Demand	Anodyne	GPR39	0	41
CN(C)C(=O)N[C@H]1CCCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450921685	DD	On-Demand	Anodyne	PRCP	0	45
CN(C)C(=O)N[C@H]1CCCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450921685	DD	On-Demand	Anodyne	HRH4	32	46
CN(C)C(=O)N[C@H]1CCCN(c2cc(NCC3CC3)ncn2)C1	ZINC000450921685	DD	On-Demand	Anodyne	GPR39	0	41
CCOC(=O)CN(C(=O)Cc1cc2ccccc2c(O)n1)C1CCC1	ZINC000450921692	EE	On-Demand	Anodyne	ACE	18	40
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000450921701	FC	On-Demand	Bother	HRH3	27	45
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000450921701	FC	On-Demand	Bother	PSMB2	49	38
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000450921701	FC	On-Demand	Bother	PSMB1	44	46
COc1cc(NC(=O)[C@]2(C)CC=CCC2)ccc1OC(C)C	ZINC000450921708	DI	On-Demand	Anodyne	ENPP1	55	32
COc1cc(NC(=O)[C@@]2(C)CC=CCC2)ccc1OC(C)C	ZINC000450921709	DI	On-Demand	Anodyne	ENPP1	67	32
CC(C)c1nccc(N2CCC[C@@H](NC(=O)N(C)C)C2)n1	ZINC000450921715	CD	On-Demand	Anodyne	SORD	71	40
CC(C)c1nccc(N2CCC[C@H](NC(=O)N(C)C)C2)n1	ZINC000450921716	CD	On-Demand	Anodyne	SORD	71	40
CC(C)NS(=O)(=O)N1CCN(CCOCCOc2ccccc2)CC1	ZINC000450921733	FC	On-Demand	Anodyne	LTA4H	44	44
CC(C)NS(=O)(=O)N1CCN(CCOCCOc2ccccc2)CC1	ZINC000450921733	FC	On-Demand	Anodyne	HRH3	53	40
CC(C)NS(=O)(=O)N1CCN(CCOCCOc2ccccc2)CC1	ZINC000450921733	FC	On-Demand	Anodyne	PSMB2	49	37
CC(C)NS(=O)(=O)N1CCN(CCOCCOc2ccccc2)CC1	ZINC000450921733	FC	On-Demand	Anodyne	PSMB1	43	40
NS(=O)(=O)c1cc(F)c(N[C@@H]2C[C@H](O)C2)c(Br)c1	ZINC000450921736	ED	On-Demand	Anodyne	CA2	15	46
NS(=O)(=O)c1cc(F)c(N[C@@H]2C[C@H](O)C2)c(Br)c1	ZINC000450921736	ED	On-Demand	Anodyne	CA4	16	46
COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](NC(=O)N(C)C)C2)c1	ZINC000450921760	DD	On-Demand	Bother	TAAR1	18	41
COc1ccc([N+](=O)[O-])c(N2CCC[C@H](NC(=O)N(C)C)C2)c1	ZINC000450921761	DD	On-Demand	Bother	TAAR1	18	41
COCCN(Cc1ccc(F)c(Cl)c1)c1cc(C)nc2ncnn12	ZINC000450921765	EF	On-Demand	Anodyne	DHOD	0	42
CN(C)S(=O)(=O)c1cc(Cl)ccc1OC[C@H]1CCCCC1(F)F	ZINC000450921768	FH	On-Demand	Anodyne	PTGDR2	15	41
CN(C)S(=O)(=O)c1cc(Cl)ccc1OC[C@@H]1CCCCC1(F)F	ZINC000450921769	FH	On-Demand	Anodyne	PTGDR2	15	41
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3c(Br)cccc23)C1	ZINC000450921774	GG	On-Demand	Anodyne	PREP	15	42
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3c(Br)cccc23)C1	ZINC000450921775	GG	On-Demand	Anodyne	PREP	15	42
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2cc(F)ccc2n1	ZINC000450921777	EF	On-Demand	Anodyne	GYRB	0	58
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2cc(F)ccc2n1	ZINC000450921777	EF	On-Demand	Anodyne	DHODH	54	39
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2cc(F)ccc2n1	ZINC000450921778	EF	On-Demand	Anodyne	GYRB	0	58
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2cc(F)ccc2n1	ZINC000450921778	EF	On-Demand	Anodyne	DHODH	54	39
COCCN(Cc1ccc(F)c(Cl)c1)c1ccc(C(N)=O)cn1	ZINC000450921779	EF	On-Demand	Anodyne	CSF1R	15	43
COCCN(Cc1ccc(F)c(Cl)c1)c1ccc(C(N)=O)cn1	ZINC000450921779	EF	On-Demand	Anodyne	SCD1	16	40
CCOC(=O)CN(C(=O)Cc1cn(C)nc1C)C1CCC1	ZINC000450921785	CD	On-Demand	Anodyne	ACE	18	40
CCc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)nc(-c2ccccn2)n1	ZINC000450921786	FE	On-Demand	Anodyne	HRH4	17	41
CCc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc(-c2ccccn2)n1	ZINC000450921787	FE	On-Demand	Anodyne	HRH4	17	41
CN(C)C(=O)N[C@H]1CCCN(c2cncc(-c3ccccc3)n2)C1	ZINC000450921790	EE	On-Demand	Anodyne	PIM2	16	43
CN(C)C(=O)N[C@@H]1CCCN(c2cncc(-c3ccccc3)n2)C1	ZINC000450921791	EE	On-Demand	Anodyne	PIM2	16	43
COc1ccc2nc(C)nc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921796	EE	On-Demand	Anodyne	PDE3B	51	36
COc1ccc2nc(C)nc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921796	EE	On-Demand	Anodyne	MCHR1	25	42
COc1ccc2nc(C)nc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921797	EE	On-Demand	Anodyne	PDE3B	51	36
COc1ccc2nc(C)nc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921797	EE	On-Demand	Anodyne	MCHR1	25	42
O=C(CC[C@@H]1CCCCO1)CSc1nc(-c2ccccc2)co1	ZINC000450921810	EI	On-Demand	Anodyne	COLA	46	36
O=C(CC[C@@H]1CCCCO1)CSc1nc(-c2ccccc2)co1	ZINC000450921810	EI	On-Demand	Anodyne	CPT1A	45	36
O=C(CC[C@H]1CCCCO1)CSc1nc(-c2ccccc2)co1	ZINC000450921811	EI	On-Demand	Anodyne	COLA	46	36
O=C(CC[C@H]1CCCCO1)CSc1nc(-c2ccccc2)co1	ZINC000450921811	EI	On-Demand	Anodyne	CPT1A	45	36
COc1ccc(CNC(=O)CCN[C@@H]2CCCC[C@H]2OC(F)F)c(OC)c1	ZINC000450921812	GF	On-Demand	Anodyne	MTNR1A	52	36
C[C@H](C(=O)Nc1nc(-c2ccc(F)cc2)cs1)N1CCC(O)(C(N)=O)CC1	ZINC000450921817	GD	On-Demand	Anodyne	ROCK1	20	42
C[C@H](C(=O)Nc1nc(-c2ccc(F)cc2)cs1)N1CCC(O)(C(N)=O)CC1	ZINC000450921817	GD	On-Demand	Anodyne	CAPN1	0	40
C[C@@H](C(=O)Nc1nc(-c2ccc(F)cc2)cs1)N1CCC(O)(C(N)=O)CC1	ZINC000450921818	GD	On-Demand	Anodyne	ROCK1	20	42
C[C@@H](C(=O)Nc1nc(-c2ccc(F)cc2)cs1)N1CCC(O)(C(N)=O)CC1	ZINC000450921818	GD	On-Demand	Anodyne	CAPN1	0	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450921821	GE	On-Demand	Anodyne	HSD11B1	17	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450921821	GE	On-Demand	Anodyne	SFRP1	128	39
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450921821	GE	On-Demand	Anodyne	WNT3	88	39
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450921822	GE	On-Demand	Anodyne	HSD11B1	17	40
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450921822	GE	On-Demand	Anodyne	SFRP1	128	39
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450921822	GE	On-Demand	Anodyne	WNT3	88	39
COC(=O)c1nc(N2CCC[C@H](NC(=O)N(C)C)C2)sc1C	ZINC000450921825	ED	On-Demand	Anodyne	GYRB	44	39
COC(=O)c1nc(N2CCC[C@H](NC(=O)N(C)C)C2)sc1C	ZINC000450921825	ED	On-Demand	Anodyne	PARE	50	32
COC(=O)c1nc(N2CCC[C@@H](NC(=O)N(C)C)C2)sc1C	ZINC000450921826	ED	On-Demand	Anodyne	GYRB	44	39
COC(=O)c1nc(N2CCC[C@@H](NC(=O)N(C)C)C2)sc1C	ZINC000450921826	ED	On-Demand	Anodyne	PARE	50	32
COc1cc(CN2CCN(S(=O)(=O)NC(C)C)CC2)ccc1Cl	ZINC000450921828	FD	On-Demand	Anodyne	AVPR1B	40	33
COc1cc(CN2CCN(S(=O)(=O)NC(C)C)CC2)ccc1Cl	ZINC000450921828	FD	On-Demand	Anodyne	SSTR5	47	38
Cc1ccc(NC(=O)c2c(C)cccc2Cl)cc1NC(=O)CCN(C)C	ZINC000450921831	FI	On-Demand	Anodyne	F2R	0	51
Cc1ccc(NC(=O)c2c(C)cccc2Cl)cc1NC(=O)CCN(C)C	ZINC000450921831	FI	On-Demand	Anodyne	JAK1	0	42
Cc1ccc(NC(=O)c2c(C)cccc2Cl)cc1NC(=O)CCN(C)C	ZINC000450921831	FI	On-Demand	Anodyne	TYK2	46	42
Cc1ccc(NC(=O)c2c(C)cccc2Cl)cc1NC(=O)CCN(C)C	ZINC000450921831	FI	On-Demand	Anodyne	BTK	16	43
Cc1ccc(NC(=O)c2c(C)cccc2Cl)cc1NC(=O)CCN(C)C	ZINC000450921831	FI	On-Demand	Anodyne	KCNK3	42	37
CCOC(=O)c1c(N2CCC[C@H](NC(=O)N(C)C)C2)nc2ccccc2c1C	ZINC000450921832	GF	On-Demand	Anodyne	ADAM17	46	33
CCOC(=O)c1c(N2CCC[C@@H](NC(=O)N(C)C)C2)nc2ccccc2c1C	ZINC000450921833	GF	On-Demand	Anodyne	ADAM17	46	33
CNS(=O)(=O)NCC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450921852	EB	On-Demand	Bother	P2RX7	45	36
COC(=O)c1coc(COc2ccc(Cl)cc2S(=O)(=O)N(C)C)n1	ZINC000450921869	FD	On-Demand	Anodyne	PTGER1	26	44
COC(=O)c1coc(COc2ccc(Cl)cc2S(=O)(=O)N(C)C)n1	ZINC000450921869	FD	On-Demand	Anodyne	CPT1B	55	35
COc1cc(OC[C@H]2CCCC2(F)F)ccc1C#N	ZINC000450921871	CG	On-Demand	Mild	AR	15	43
COc1cc(OC[C@@H]2CCCC2(F)F)ccc1C#N	ZINC000450921872	CG	On-Demand	Mild	AR	15	43
COc1cc(O[C@H]2C[C@H](C)CCC2=O)ccc1C#N	ZINC000450921876	CF	On-Demand	Mild	AR	15	42
COc1cc(O[C@H]2C[C@@H](C)CCC2=O)ccc1C#N	ZINC000450921877	CF	On-Demand	Mild	AR	15	42
COc1cc(O[C@@H]2C[C@H](C)CCC2=O)ccc1C#N	ZINC000450921878	CF	On-Demand	Mild	AR	15	42
COc1cc(O[C@@H]2C[C@@H](C)CCC2=O)ccc1C#N	ZINC000450921879	CF	On-Demand	Mild	AR	15	42
N#Cc1cnc2c(F)cc(F)cc2c1N[C@H]1CC[C@@H](C(N)=O)C1	ZINC000450921889	DE	On-Demand	Mild	MAP3K8	50	31
CN(C)C(=O)N[C@@H]1CCCN(c2noc(-c3ccccc3)n2)C1	ZINC000450921890	DD	On-Demand	Anodyne	COLA	47	36
CN(C)C(=O)N[C@H]1CCCN(c2noc(-c3ccccc3)n2)C1	ZINC000450921891	DD	On-Demand	Anodyne	COLA	47	36
NC(=O)[C@@H]1CC[C@H](Nc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450921896	DD	On-Demand	Anodyne	DHOD	0	44
NC(=O)[C@@H]1CC[C@H](Nc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450921896	DD	On-Demand	Anodyne	VCP	59	39
CCS(=O)(=O)c1ccc(CN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450921899	GC	On-Demand	Anodyne	ADORA2B	45	36
Cc1nc(N[C@@H]2CC[C@H](C(N)=O)C2)ccc1C#N	ZINC000450921901	BC	On-Demand	Mild	CSNK2A1	58	35
Cc1nc(N[C@@H]2CC[C@H](C(N)=O)C2)ccc1C#N	ZINC000450921901	BC	On-Demand	Mild	HIPK2	41	35
CSc1ccc2ncnc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921921	EF	On-Demand	Anodyne	PDE3A	45	34
CSc1ccc2ncnc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921921	EF	On-Demand	Anodyne	PDGFRB	28	41
CSc1ccc2ncnc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921921	EF	On-Demand	Anodyne	PDE3B	66	34
CSc1ccc2ncnc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921921	EF	On-Demand	Anodyne	SIRT3	51	31
CSc1ccc2ncnc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921921	EF	On-Demand	Anodyne	SIRT1	51	31
CSc1ccc2ncnc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921922	EF	On-Demand	Anodyne	PDE3A	45	34
CSc1ccc2ncnc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921922	EF	On-Demand	Anodyne	PDGFRB	28	41
CSc1ccc2ncnc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921922	EF	On-Demand	Anodyne	PDE3B	66	34
CSc1ccc2ncnc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921922	EF	On-Demand	Anodyne	SIRT3	51	31
CSc1ccc2ncnc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450921922	EF	On-Demand	Anodyne	SIRT1	51	31
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(F)c(C)c1	ZINC000450921923	GG	On-Demand	Anodyne	LEF	54	37
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(F)c(C)c1	ZINC000450921924	GG	On-Demand	Anodyne	LEF	54	37
COc1ccc(-c2ccnc(N[C@@H]3C[C@H](O)C3)n2)cc1	ZINC000450921927	CE	On-Demand	Anodyne	IKBKB	0	47
COc1ccc(-c2ccnc(N[C@@H]3C[C@H](O)C3)n2)cc1	ZINC000450921927	CE	On-Demand	Anodyne	MAPK1	53	40
COc1ccc(-c2ccnc(N[C@@H]3C[C@H](O)C3)n2)cc1	ZINC000450921927	CE	On-Demand	Anodyne	MAPK8	0	42
C[C@@H](CCN1CCC(O)(C(N)=O)CC1)OCc1ccccc1	ZINC000450921931	DD	On-Demand	Anodyne	NPR	48	32
C[C@@H](CCN1CCC(O)(C(N)=O)CC1)OCc1ccccc1	ZINC000450921931	DD	On-Demand	Anodyne	NPFFR1	43	33
C[C@@H](CCN1CCC(O)(C(N)=O)CC1)OCc1ccccc1	ZINC000450921931	DD	On-Demand	Anodyne	SLC12A5	70	36
C[C@H](CCN1CCC(O)(C(N)=O)CC1)OCc1ccccc1	ZINC000450921932	DD	On-Demand	Anodyne	NPR	48	32
C[C@H](CCN1CCC(O)(C(N)=O)CC1)OCc1ccccc1	ZINC000450921932	DD	On-Demand	Anodyne	NPFFR1	43	33
C[C@H](CCN1CCC(O)(C(N)=O)CC1)OCc1ccccc1	ZINC000450921932	DD	On-Demand	Anodyne	SLC12A5	70	36
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(F)c(C)c1	ZINC000450921933	FG	On-Demand	Anodyne	LEF	71	38
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(F)c(C)c1	ZINC000450921934	FG	On-Demand	Anodyne	LEF	71	38
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(F)c(C)c1	ZINC000450921935	FG	On-Demand	Anodyne	LEF	71	38
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(F)c(C)c1	ZINC000450921936	FG	On-Demand	Anodyne	LEF	71	38
CCN1CCN(CC(C)(C)Nc2ncnc3c(C)csc23)CC1	ZINC000450921937	EF	On-Demand	Anodyne	LPAR2	23	46
CC(=O)c1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)cc1	ZINC000450921940	EF	On-Demand	Anodyne	SLC15A1	0	41
CC(=O)c1ccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)cc1	ZINC000450921940	EF	On-Demand	Anodyne	ADAMTS4	40	50
NC(=O)[C@@H]1CC[C@H](Nc2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450921943	ED	On-Demand	Anodyne	TNKS	56	32
CC(=O)c1cccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)c1	ZINC000450921944	EF	On-Demand	Anodyne	MAOB	33	41
CC(=O)c1cccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)c1	ZINC000450921944	EF	On-Demand	Anodyne	PTGER3	46	35
CC(=O)c1cccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)c1	ZINC000450921944	EF	On-Demand	Anodyne	ACR	29	40
CC(=O)c1cccc(COc2ccc(C(=O)NC[C@H](C)O)cc2)c1	ZINC000450921944	EF	On-Demand	Anodyne	ADAMTS4	36	42
NC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450921953	EF	On-Demand	Anodyne	OPRK1	31	41
NC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450921953	EF	On-Demand	Anodyne	TACR2	49	36
NC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450921953	EF	On-Demand	Anodyne	SIGMAR1	33	51
NC(=O)C1(O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000450921953	EF	On-Demand	Anodyne	TACR3	44	36
CCOC(=O)CN(C(=O)Cc1ccc(Cl)c(OC)c1)C1CCC1	ZINC000450921973	EF	On-Demand	Anodyne	OPRM1	0	42
CCOC(=O)CN(C(=O)Cc1ccc(Cl)c(OC)c1)C1CCC1	ZINC000450921973	EF	On-Demand	Anodyne	OPRK1	41	42
CCOC(=O)CN(C(=O)Cc1ccc(Cl)c(OC)c1)C1CCC1	ZINC000450921973	EF	On-Demand	Anodyne	PDE6A	41	33
CN1CCC[C@@H](C(=O)NC2(Cc3ccccc3)CCCCC2)C1=O	ZINC000450921974	EF	On-Demand	Anodyne	SLC12A5	53	35
CN(C)C(=O)N[C@@H]1CCCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450921982	ED	On-Demand	Anodyne	ADRA2A	0	42
CN(C)C(=O)N[C@@H]1CCCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450921982	ED	On-Demand	Anodyne	NPY2R	0	40
CN(C)C(=O)N[C@H]1CCCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450921983	ED	On-Demand	Anodyne	ADRA2A	0	42
CN(C)C(=O)N[C@H]1CCCN(c2nc(N(C)C)c3ccccc3n2)C1	ZINC000450921983	ED	On-Demand	Anodyne	NPY2R	0	40
CS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c(C(F)(F)F)c1	ZINC000450921984	FE	On-Demand	Anodyne	SFRP1	110	35
CS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c(C(F)(F)F)c1	ZINC000450921984	FE	On-Demand	Anodyne	WNT3	72	33
NC(=O)[C@@H]1CC[C@H](Nc2ccc3nnc(-c4ccccc4F)n3n2)C1	ZINC000450921987	ED	On-Demand	Anodyne	MAPK13	56	38
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](O)C1CCC1	ZINC000450922001	CF	On-Demand	Anodyne	OPRM1	24	42
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](O)C1CCC1	ZINC000450922001	CF	On-Demand	Anodyne	OPRD1	37	43
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](O)C1CCC1	ZINC000450922001	CF	On-Demand	Anodyne	AGTR2	66	42
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](O)C1CCC1	ZINC000450922002	CF	On-Demand	Anodyne	OPRM1	24	42
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](O)C1CCC1	ZINC000450922002	CF	On-Demand	Anodyne	OPRD1	37	43
CC[C@H]1Cc2ccccc2CN1C(=O)[C@@H](O)C1CCC1	ZINC000450922002	CF	On-Demand	Anodyne	AGTR2	66	42
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](O)C1CCC1	ZINC000450922003	CF	On-Demand	Anodyne	OPRM1	24	42
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](O)C1CCC1	ZINC000450922003	CF	On-Demand	Anodyne	OPRD1	37	43
CC[C@@H]1Cc2ccccc2CN1C(=O)[C@H](O)C1CCC1	ZINC000450922003	CF	On-Demand	Anodyne	AGTR2	66	42
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](O)C1CCC1	ZINC000450922004	CF	On-Demand	Anodyne	OPRM1	24	42
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](O)C1CCC1	ZINC000450922004	CF	On-Demand	Anodyne	OPRD1	37	43
CC[C@H]1Cc2ccccc2CN1C(=O)[C@H](O)C1CCC1	ZINC000450922004	CF	On-Demand	Anodyne	AGTR2	66	42
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	TSHR	41	32
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	LTA4H	44	59
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	TACR2	20	40
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	CA1	27	47
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	CTSK	23	42
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	SCN2A	15	44
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	SLC15A1	0	42
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	ADAM17	44	48
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	TIMP3	50	35
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	MMP2	16	48
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	MMP9	17	48
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	FFAR1	26	40
C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922009	GD	On-Demand	Anodyne	SLC12A5	55	35
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	TSHR	41	32
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	LTA4H	44	59
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	TACR2	20	40
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	CA1	27	47
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	CTSK	23	42
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	SCN2A	15	44
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	SLC15A1	0	42
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	ADAM17	44	48
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	TIMP3	50	35
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	MMP2	16	48
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	MMP9	17	48
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	FFAR1	26	40
C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922010	GD	On-Demand	Anodyne	SLC12A5	55	35
Cc1nccc(N[C@@H]2CC[C@H](C(N)=O)C2)n1	ZINC000450922013	BC	On-Demand	Anodyne	PRKD1	42	37
CN1CCC[C@H](C(=O)NC2(Cc3ccccc3)CCCCC2)C1=O	ZINC000450922017	EF	On-Demand	Anodyne	SLC12A5	53	35
Cc1cc(N[C@@H]2CC[C@H](C(N)=O)C2)c2cc(Cl)cc(C)c2n1	ZINC000450922018	DH	On-Demand	Anodyne	CD38	38	41
CN(C)C(=O)N[C@H]1CCCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450922023	EE	On-Demand	Anodyne	HRH4	15	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450922025	EE	On-Demand	Anodyne	HRH4	15	40
Cc1ccc(NC(=O)[C@]2(C)CCC[C@H]2C)cc1NC(=O)CCN(C)C	ZINC000450922031	EH	On-Demand	Anodyne	LDLR	0	42
Cc1ccc(NC(=O)[C@]2(C)CCC[C@@H]2C)cc1NC(=O)CCN(C)C	ZINC000450922037	EH	On-Demand	Anodyne	LDLR	0	42
Cc1ccc(NC(=O)[C@@]2(C)CCC[C@H]2C)cc1NC(=O)CCN(C)C	ZINC000450922040	EH	On-Demand	Anodyne	LDLR	0	42
Cc1ccc(NC(=O)[C@@]2(C)CCC[C@@H]2C)cc1NC(=O)CCN(C)C	ZINC000450922042	EH	On-Demand	Anodyne	LDLR	0	42
CO[C@H](CN[C@H](Cn1ccccc1=O)c1ccccc1)Cc1ccccc1	ZINC000450922054	FG	On-Demand	Anodyne	SOAT1	25	41
CO[C@@H](CN[C@H](Cn1ccccc1=O)c1ccccc1)Cc1ccccc1	ZINC000450922055	FG	On-Demand	Anodyne	SOAT1	25	41
CO[C@H](CN[C@@H](Cn1ccccc1=O)c1ccccc1)Cc1ccccc1	ZINC000450922056	FG	On-Demand	Anodyne	SOAT1	25	41
CO[C@@H](CN[C@@H](Cn1ccccc1=O)c1ccccc1)Cc1ccccc1	ZINC000450922057	FG	On-Demand	Anodyne	SOAT1	25	41
CC(C)NS(=O)(=O)N1CCN(CC(=O)Nc2ccc3c(c2)OCO3)CC1	ZINC000450922076	GC	On-Demand	Anodyne	SSTR3	46	30
CNS(=O)(=O)c1ccc(N[C@@H](C)C2CCCC2)c(F)c1	ZINC000450922078	DF	On-Demand	Anodyne	LEF	25	41
NC(=O)[C@@H]1CC[C@H](Nc2nccc(Oc3ccccc3)n2)C1	ZINC000450922093	CE	On-Demand	Anodyne	MAPK8	35	41
CCOC(=O)c1cc(C(=O)N[C@H](C(=O)OC)c2ccc(F)c(C)c2)on1	ZINC000450922120	FD	On-Demand	Anodyne	LEF	47	35
CN(C)C(=O)N[C@@H]1CCCN(c2cc(C#N)ccc2C(F)(F)F)C1	ZINC000450922121	EF	On-Demand	Mild	SFRP1	41	32
CN(C)C(=O)N[C@H]1CCCN(c2cc(C#N)ccc2C(F)(F)F)C1	ZINC000450922122	EF	On-Demand	Mild	SFRP1	41	32
COc1ccc(-c2nc(CN3CCN(S(=O)(=O)NC(C)C)CC3)no2)cc1	ZINC000450922123	GD	On-Demand	Anodyne	ACOX1	34	42
CCOC(=O)c1ccc(CN2CCC(S(=O)(=O)N3CCCC3)CC2)nc1	ZINC000450922124	GD	On-Demand	Anodyne	SSTR5	47	41
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450922128	EG	On-Demand	Anodyne	HRP1_PLAFA	90	34
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450922128	EG	On-Demand	Anodyne	HNMT	52	37
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450922128	EG	On-Demand	Anodyne	FAP	0	42
CCOC(=O)c1cc(C(=O)N[C@@H](C(=O)OC)c2ccc(F)c(C)c2)on1	ZINC000450922129	FD	On-Demand	Anodyne	LEF	47	35
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450922130	EG	On-Demand	Anodyne	HRP1_PLAFA	90	34
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450922130	EG	On-Demand	Anodyne	HNMT	52	37
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450922130	EG	On-Demand	Anodyne	FAP	0	42
CCOC(=O)CN(C(=O)c1cccc2c1CCCC2)C1CCC1	ZINC000450922138	DG	On-Demand	Anodyne	ACE	62	48
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3cccc(I)c23)C1	ZINC000450922143	GE	On-Demand	Anodyne	CD38	26	47
CCOC(=O)CN(C(=O)CCc1ccc(C(N)=O)cc1)C1CCC1	ZINC000450922145	ED	On-Demand	Anodyne	ACE	35	40
Cc1nc(N[C@@H]2CC[C@H](C(N)=O)C2)c2cc[nH]c2n1	ZINC000450922146	CD	On-Demand	Anodyne	JAK1	48	39
CCCNC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450922149	ED	On-Demand	Anodyne	MTNR1B	0	40
CCCNC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450922149	ED	On-Demand	Anodyne	HPGDS	31	46
CCN(CC)S(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450922150	GD	On-Demand	Bother	BDKRB1	0	41
CCCNC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450922151	ED	On-Demand	Anodyne	MTNR1B	0	40
CCCNC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450922151	ED	On-Demand	Anodyne	HPGDS	31	46
C[C@H](O)CNC(=O)c1ccc(OCC[C@@H](C)O)cc1	ZINC000450922152	CC	On-Demand	Anodyne	PLA2G4B	40	34
C[C@H](O)CCOc1ccc(C(=O)NC[C@H](C)O)cc1	ZINC000450922153	CC	On-Demand	Anodyne	PLA2G4B	40	34
O=S(=O)(C1CCN(CCc2ccc(Cl)cc2)CC1)N1CCCC1	ZINC000450922158	FF	On-Demand	Anodyne	HRH3	27	47
O=S(=O)(C1CCN(CCc2ccc(Cl)cc2)CC1)N1CCCC1	ZINC000450922158	FF	On-Demand	Anodyne	SIGMAR1	25	40
O=S(=O)(C1CCN(CCc2ccc(Cl)cc2)CC1)N1CCCC1	ZINC000450922158	FF	On-Demand	Anodyne	L3MBTL3	31	41
CCCCCc1nnc(NC(=O)CN2CCC(O)(C(N)=O)CC2)s1	ZINC000450922170	FC	On-Demand	Anodyne	GLS	0	44
CCNC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450922173	DD	On-Demand	Anodyne	HDAC1	23	41
CCNC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450922173	DD	On-Demand	Anodyne	HPGDS	30	45
CCNC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450922174	DD	On-Demand	Anodyne	HDAC1	23	41
CCNC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450922174	DD	On-Demand	Anodyne	HPGDS	30	45
O[C@H]1C[C@@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450922175	CE	On-Demand	Anodyne	EGFR	46	41
O[C@H]1C[C@@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450922175	CE	On-Demand	Anodyne	CD38	42	43
CCCCNc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc(N)n1	ZINC000450922180	ED	On-Demand	Anodyne	HRH4	46	47
CCCCNc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)nc(N)n1	ZINC000450922181	ED	On-Demand	Anodyne	HRH4	46	47
CC(C)CN(C(=O)Cn1c(=O)oc2cc(S(=O)(=O)CCO)ccc21)C(C)C	ZINC000450922186	GD	On-Demand	Anodyne	TSPO	18	44
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccccc3Cl)cs2)C1	ZINC000450922195	DF	On-Demand	Anodyne	MPL	18	40
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccccc3Cl)cs2)C1	ZINC000450922195	DF	On-Demand	Anodyne	SPHK2	61	36
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccccc3Cl)cs2)C1	ZINC000450922195	DF	On-Demand	Anodyne	SPHK1	49	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H]1CC[C@H](C(N)=O)C1	ZINC000450922197	EC	On-Demand	Anodyne	CA2	29	45
NC(=O)[C@@H]1CC[C@H](Nc2ccnc3c(Cl)cc(Br)cc23)C1	ZINC000450922198	FH	On-Demand	Anodyne	TYK2	46	33
Cc1ccc(Br)cc1COc1ccc(C(=O)NC[C@H](C)O)cc1	ZINC000450922227	GG	On-Demand	Anodyne	ADAM17	40	42
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)ccc1OC(C)C	ZINC000450922239	EJ	On-Demand	Anodyne	GRM4	18	40
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)ccc1OC(C)C	ZINC000450922239	EJ	On-Demand	Anodyne	ENPP1	77	37
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)ccc1OC(C)C	ZINC000450922239	EJ	On-Demand	Anodyne	KCNK3	48	43
COc1cc(NC(=O)c2ccc(C)nc2C(C)C)ccc1OC(C)C	ZINC000450922239	EJ	On-Demand	Anodyne	KCNK9	41	43
CCOC(=O)CN(C(=O)Cc1cc(C)ccc1F)C1CCC1	ZINC000450922249	DF	On-Demand	Anodyne	ACE	35	44
CC(C)NS(=O)(=O)N1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000450922254	DC	On-Demand	Anodyne	SLC18A3	45	50
COCCN(Cc1ccc(F)c(Cl)c1)c1nc(C)nc(N(C)C)n1	ZINC000450922258	FF	On-Demand	Anodyne	CRHR1	17	41
O=C(COc1ccccc1NC(=O)CCCC(=O)C1CC1)Nc1cccnc1	ZINC000450922261	GG	On-Demand	Anodyne	HDAC3	22	50
O=C(COc1ccccc1NC(=O)CCCC(=O)C1CC1)Nc1cccnc1	ZINC000450922261	GG	On-Demand	Anodyne	HDAC6	15	50
CC1(C)CNC(=O)CN1CCc1ccc(Cl)cc1	ZINC000450922264	CE	On-Demand	Anodyne	CACNA1D	33	40
CCOC(=O)CN(C(=O)c1cc2ccncc2s1)C1CCC1	ZINC000450922285	DF	On-Demand	Anodyne	ACE	40	42
CCOC(=O)CN(C(=O)c1ccc(C(C)(F)F)nc1)C1CCC1	ZINC000450922293	EF	On-Demand	Anodyne	ACE	44	41
C[C@H](CC(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450922296	CE	On-Demand	Anodyne	DGAT1	24	40
C[C@H](CC(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450922296	CE	On-Demand	Anodyne	HPGDS	34	53
C[C@@H](CC(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450922297	CE	On-Demand	Anodyne	DGAT1	24	40
C[C@@H](CC(F)(F)F)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450922297	CE	On-Demand	Anodyne	HPGDS	34	53
CC(=O)CCCCCOc1ccnc(C(F)(F)F)c1	ZINC000450922298	CH	On-Demand	Anodyne	PLA2G4B	53	32
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450922302	GC	On-Demand	Bother	BDKRB1	0	45
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450922302	GC	On-Demand	Bother	BCL2L1	54	33
CN(C)CCNS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450922302	GC	On-Demand	Bother	BCL2	42	33
COc1ccc2nc(C(F)(F)F)nc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450922304	GF	On-Demand	Anodyne	PDGFRB	15	40
COc1ccc2nc(C(F)(F)F)nc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450922304	GF	On-Demand	Anodyne	PDE3B	46	35
COc1ccc2nc(C(F)(F)F)nc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450922305	GF	On-Demand	Anodyne	PDGFRB	15	40
COc1ccc2nc(C(F)(F)F)nc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450922305	GF	On-Demand	Anodyne	PDE3B	46	35
C[C@@H](O)CCCn1cnc2c(Cl)cccc2c1=O	ZINC000450922307	CE	On-Demand	Anodyne	DNAE	42	33
C[C@H](O)CCCn1cnc2c(Cl)cccc2c1=O	ZINC000450922308	CE	On-Demand	Anodyne	DNAE	42	33
CCc1cccc(C(=O)N[C@H](C(=O)OC)c2ccc(F)c(C)c2)n1	ZINC000450922319	EF	On-Demand	Anodyne	PDE5A	27	42
CCc1cccc(C(=O)N[C@@H](C(=O)OC)c2ccc(F)c(C)c2)n1	ZINC000450922320	EF	On-Demand	Anodyne	PDE5A	27	42
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922322	FF	On-Demand	Anodyne	ANPEP	45	33
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922322	FF	On-Demand	Anodyne	CTSB	40	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922322	FF	On-Demand	Anodyne	CYSP_TRYCR	41	32
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922322	FF	On-Demand	Anodyne	CAPN2	54	32
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922322	FF	On-Demand	Anodyne	POL	0	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922322	FF	On-Demand	Anodyne	LEF	72	43
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922323	FF	On-Demand	Anodyne	ANPEP	45	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922323	FF	On-Demand	Anodyne	CTSB	40	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922323	FF	On-Demand	Anodyne	CYSP_TRYCR	41	32
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922323	FF	On-Demand	Anodyne	CAPN2	54	32
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922323	FF	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922323	FF	On-Demand	Anodyne	LEF	72	43
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922324	FF	On-Demand	Anodyne	ANPEP	45	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922324	FF	On-Demand	Anodyne	CTSB	40	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922324	FF	On-Demand	Anodyne	CYSP_TRYCR	41	32
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922324	FF	On-Demand	Anodyne	CAPN2	54	32
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922324	FF	On-Demand	Anodyne	POL	0	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922324	FF	On-Demand	Anodyne	LEF	72	43
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922325	FF	On-Demand	Anodyne	ANPEP	45	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922325	FF	On-Demand	Anodyne	CTSB	40	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922325	FF	On-Demand	Anodyne	CYSP_TRYCR	41	32
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922325	FF	On-Demand	Anodyne	CAPN2	54	32
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922325	FF	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(F)c(C)c1	ZINC000450922325	FF	On-Demand	Anodyne	LEF	72	43
NC(=O)C1(O)CCN(CCSc2ccnc3cc(Cl)ccc23)CC1	ZINC000450922326	FE	On-Demand	Anodyne	HRP1_PLAFA	109	40
NC(=O)C1(O)CCN(CCSc2ccnc3cc(Cl)ccc23)CC1	ZINC000450922326	FE	On-Demand	Anodyne	HNMT	58	41
Cc1cc(Cl)c2ncc(C#N)c(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1	ZINC000450922346	EG	On-Demand	Mild	MAP3K8	43	37
CN(C)C(=O)N[C@H]1CCCN(c2ccnc(C(F)(F)F)c2)C1	ZINC000450922352	DE	On-Demand	Anodyne	HRH4	19	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc(C(F)(F)F)c2)C1	ZINC000450922353	DE	On-Demand	Anodyne	HRH4	19	40
CC(C)c1nc(S[C@H](C)C(=O)Nc2nccs2)c2ccccc2n1	ZINC000450922357	FI	On-Demand	Anodyne	MAP1	94	37
CC(C)c1nc(S[C@@H](C)C(=O)Nc2nccs2)c2ccccc2n1	ZINC000450922358	FI	On-Demand	Anodyne	MAP1	94	37
COc1ccc(-c2ccnc(N3CCC[C@H](NC(=O)N(C)C)C3)n2)cc1	ZINC000450922359	FE	On-Demand	Anodyne	DKK1	0	42
COc1ccc(-c2ccnc(N3CCC[C@@H](NC(=O)N(C)C)C3)n2)cc1	ZINC000450922360	FE	On-Demand	Anodyne	DKK1	0	42
NC(=O)[C@@H]1CC[C@H](Nc2cnn(-c3ccc(F)cc3F)c(=O)c2Cl)C1	ZINC000450922373	FE	On-Demand	Anodyne	MAPK14	23	45
Cc1ccc(NC(=O)c2ccc(N[C@@H]3CC[C@H](C(N)=O)C3)nc2)cc1	ZINC000450922378	EF	On-Demand	Anodyne	PRNP	47	32
Cc1ccc(NC(=O)c2ccc(N[C@@H]3CC[C@H](C(N)=O)C3)nc2)cc1	ZINC000450922378	EF	On-Demand	Anodyne	P4HTM	0	50
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3sc4c(c23)CCC4)C1	ZINC000450922386	DE	On-Demand	Anodyne	CD38	22	45
NC(=O)[C@@H]1CC[C@H](Nc2nccc(OCc3ccccc3)n2)C1	ZINC000450922390	DE	On-Demand	Anodyne	MAPK9	42	36
NC(=O)[C@@H]1CC[C@H](Nc2nccc(OCc3ccccc3)n2)C1	ZINC000450922390	DE	On-Demand	Anodyne	VCP	44	38
COc1cc(OC)nc(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)n1	ZINC000450922391	GC	On-Demand	Anodyne	PTGS2	20	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1	ZINC000450922392	ED	On-Demand	Bother	L3MBTL3	23	43
COC(=O)[C@@H](NC(=O)c1cc(C)cs1)c1ccc(F)c(C)c1	ZINC000450922394	DG	On-Demand	Anodyne	LEF	64	36
COC(=O)[C@H](NC(=O)c1cc(C)cs1)c1ccc(F)c(C)c1	ZINC000450922395	DG	On-Demand	Anodyne	LEF	64	36
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450922413	GC	On-Demand	Bother	COLA	103	37
CN(C)C(=O)N[C@@H]1CCCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450922423	EE	On-Demand	Anodyne	FAAH	21	48
CN(C)C(=O)N[C@H]1CCCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450922424	EE	On-Demand	Anodyne	FAAH	21	48
COc1cc(CN2CCC(S(=O)(=O)N3CCCC3)CC2)ccc1Cl	ZINC000450922429	FF	On-Demand	Anodyne	OPRK1	25	46
COc1cc(CN2CCC(S(=O)(=O)N3CCCC3)CC2)ccc1Cl	ZINC000450922429	FF	On-Demand	Anodyne	AVPR1B	43	36
COc1cc(CN2CCC(S(=O)(=O)N3CCCC3)CC2)ccc1Cl	ZINC000450922429	FF	On-Demand	Anodyne	UTS2R	28	40
COC(=O)[C@]1(C)CN(C[C@@H](Cc2ccccc2)OC)C[C@H]1C	ZINC000450922435	DE	On-Demand	Anodyne	OPRM1	24	43
COC(=O)[C@]1(C)CN(C[C@@H](Cc2ccccc2)OC)C[C@H]1C	ZINC000450922435	DE	On-Demand	Anodyne	MME	40	34
COC(=O)[C@]1(C)CN(C[C@H](Cc2ccccc2)OC)C[C@H]1C	ZINC000450922436	DE	On-Demand	Anodyne	OPRM1	24	43
COC(=O)[C@]1(C)CN(C[C@H](Cc2ccccc2)OC)C[C@H]1C	ZINC000450922436	DE	On-Demand	Anodyne	MME	40	34
CCOC(=O)CN(C(=O)c1cccc(C#N)c1Br)C1CCC1	ZINC000450922437	FF	On-Demand	Mild	ACE	60	46
CCOC(=O)CN(C(=O)c1cccc(C#N)c1Br)C1CCC1	ZINC000450922437	FF	On-Demand	Mild	TRPM8	28	46
CNS(=O)(=O)NCC(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450922441	FB	On-Demand	Anodyne	ACACA	23	43
CNS(=O)(=O)NCC(=O)N[C@@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450922441	FB	On-Demand	Anodyne	ACACB	28	45
CNS(=O)(=O)NCC(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450922442	FB	On-Demand	Anodyne	ACACA	23	43
CNS(=O)(=O)NCC(=O)N[C@H](C)c1ccc(OCC(=O)OC)cc1	ZINC000450922442	FB	On-Demand	Anodyne	ACACB	28	45
CC(=O)CCCCCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450922456	EG	On-Demand	Anodyne	THRA	34	42
CC(=O)CCCCCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450922456	EG	On-Demand	Anodyne	THRB	27	42
CC(=O)CCCCCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450922456	EG	On-Demand	Anodyne	CPT1A	43	30
CC(=O)CCCCCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450922456	EG	On-Demand	Anodyne	CPT1B	41	33
CC(=O)CCCCCOc1ccc(Cl)cc1S(=O)(=O)N(C)C	ZINC000450922456	EG	On-Demand	Anodyne	PTGDR2	36	43
CN(C)S(=O)(=O)c1cc(Cl)ccc1OC[C@@H]1CCCC1(F)F	ZINC000450922460	FG	On-Demand	Anodyne	PTGDR2	18	41
CN(C)S(=O)(=O)c1cc(Cl)ccc1OC[C@H]1CCCC1(F)F	ZINC000450922461	FG	On-Demand	Anodyne	PTGDR2	18	41
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)C1	ZINC000450922466	GD	On-Demand	Anodyne	SFRP1	108	36
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)C1	ZINC000450922466	GD	On-Demand	Anodyne	WNT3	72	36
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)C1	ZINC000450922467	GD	On-Demand	Anodyne	SFRP1	108	36
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)C1	ZINC000450922467	GD	On-Demand	Anodyne	WNT3	72	36
COCCN(Cc1ccc(F)c(Cl)c1)c1ccc(C(=O)NCCO)nn1	ZINC000450922468	GD	On-Demand	Anodyne	ALPL	41	35
COc1cc(OC[C@H]2CCC(F)(F)C2)ccc1C#N	ZINC000450922482	CG	On-Demand	Mild	AR	15	46
COc1cc(OC[C@@H]2CCC(F)(F)C2)ccc1C#N	ZINC000450922483	CG	On-Demand	Mild	AR	15	46
CSc1ccc2ncnc(N[C@@H]3C[C@H](O)C3)c2c1	ZINC000450922492	CE	On-Demand	Anodyne	CD38	90	46
Cc1cc(OCCC(C)(F)F)ccc1C#N	ZINC000450922495	BG	On-Demand	Mild	AR	16	41
CCN1CCN(CC(C)(C)Nc2nc3ccccc3o2)CC1	ZINC000450922496	DF	On-Demand	Anodyne	SSTR5	42	41
Cc1cc(Cl)ccc1Oc1ccc(CN2CCC(O)(C(N)=O)CC2)cc1	ZINC000450922503	FG	On-Demand	Anodyne	AVPR1B	40	33
Cc1cc(Cl)ccc1Oc1ccc(CN2CCC(O)(C(N)=O)CC2)cc1	ZINC000450922503	FG	On-Demand	Anodyne	ADAM17	17	43
Cc1cc(Cl)ccc1Oc1ccc(CN2CCC(O)(C(N)=O)CC2)cc1	ZINC000450922503	FG	On-Demand	Anodyne	FAAH	20	42
Cc1cc(Cl)ccc1Oc1ccc(CN2CCC(O)(C(N)=O)CC2)cc1	ZINC000450922503	FG	On-Demand	Anodyne	CCR8	35	42
Cc1cc(Cl)ccc1Oc1ccc(CN2CCC(O)(C(N)=O)CC2)cc1	ZINC000450922503	FG	On-Demand	Anodyne	NPFFR1	40	33
Cc1cc(Cl)ccc1Oc1ccc(CN2CCC(O)(C(N)=O)CC2)cc1	ZINC000450922503	FG	On-Demand	Anodyne	ENR	0	40
Cc1ccc(C#N)c(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)n1	ZINC000450922504	FD	On-Demand	Mild	S1PR4	0	42
CN(C)C(=O)N[C@H]1CCCN(c2nc3c(F)cccc3o2)C1	ZINC000450922506	DE	On-Demand	Anodyne	HTR3A	29	42
CN(C)C(=O)N[C@@H]1CCCN(c2nc3c(F)cccc3o2)C1	ZINC000450922507	DE	On-Demand	Anodyne	HTR3A	29	42
CNS(=O)(=O)NCC(=O)N1CCC[C@H](Cc2csc3ccccc23)C1	ZINC000450922508	GD	On-Demand	Anodyne	FFAR2	50	37
CNS(=O)(=O)NCC(=O)N1CCC[C@@H](Cc2csc3ccccc23)C1	ZINC000450922509	GD	On-Demand	Anodyne	FFAR2	50	37
CC(C)(COCc1ccccc1)NC(=O)NCCN1CCC(O)(C(N)=O)CC1	ZINC000450922510	GC	On-Demand	Anodyne	CACNA1H	25	41
CC(C)(COCc1ccccc1)NC(=O)NCCN1CCC(O)(C(N)=O)CC1	ZINC000450922510	GC	On-Demand	Anodyne	UTS2R	17	41
CC(C)(COCc1ccccc1)NC(=O)NCCN1CCC(O)(C(N)=O)CC1	ZINC000450922510	GC	On-Demand	Anodyne	NPFFR1	53	36
CC(C)(COCc1ccccc1)NC(=O)NCCN1CCC(O)(C(N)=O)CC1	ZINC000450922510	GC	On-Demand	Anodyne	SLC12A5	58	35
NC(=O)C1(O)CCN(CCCCOc2ccccc2C(F)(F)F)CC1	ZINC000450922515	FE	On-Demand	Anodyne	HTR1A	33	40
NC(=O)C1(O)CCN(CCCCOc2ccccc2C(F)(F)F)CC1	ZINC000450922515	FE	On-Demand	Anodyne	DRD2	36	40
NC(=O)C1(O)CCN(CCCCOc2ccccc2C(F)(F)F)CC1	ZINC000450922515	FE	On-Demand	Anodyne	HTR2A	18	40
NC(=O)C1(O)CCN(CCCCOc2ccccc2C(F)(F)F)CC1	ZINC000450922515	FE	On-Demand	Anodyne	CCR1	21	43
NC(=O)C1(O)CCN(CCCCOc2ccccc2C(F)(F)F)CC1	ZINC000450922515	FE	On-Demand	Anodyne	SCD1	19	40
NC(=O)C1(O)CCN(CCCCOc2ccccc2C(F)(F)F)CC1	ZINC000450922515	FE	On-Demand	Anodyne	SCD	18	40
C/C=C\c1ccc(OC[C@H](O)CN2CCC(O)(C(N)=O)CC2)c(OC)c1	ZINC000450922521	FC	On-Demand	Anodyne	ADRB2	30	52
C/C=C\c1ccc(OC[C@H](O)CN2CCC(O)(C(N)=O)CC2)c(OC)c1	ZINC000450922521	FC	On-Demand	Anodyne	ABCB1	55	39
C/C=C/c1ccc(OC[C@@H](O)CN2CCC(O)(C(N)=O)CC2)c(OC)c1	ZINC000450922522	FC	On-Demand	Anodyne	ADRB2	30	52
C/C=C/c1ccc(OC[C@@H](O)CN2CCC(O)(C(N)=O)CC2)c(OC)c1	ZINC000450922522	FC	On-Demand	Anodyne	ABCB1	55	39
C/C=C\c1ccc(OC[C@@H](O)CN2CCC(O)(C(N)=O)CC2)c(OC)c1	ZINC000450922523	FC	On-Demand	Anodyne	ADRB2	30	52
C/C=C\c1ccc(OC[C@@H](O)CN2CCC(O)(C(N)=O)CC2)c(OC)c1	ZINC000450922523	FC	On-Demand	Anodyne	ABCB1	55	39
C/C=C/c1ccc(OC[C@H](O)CN2CCC(O)(C(N)=O)CC2)c(OC)c1	ZINC000450922524	FC	On-Demand	Anodyne	ADRB2	30	52
C/C=C/c1ccc(OC[C@H](O)CN2CCC(O)(C(N)=O)CC2)c(OC)c1	ZINC000450922524	FC	On-Demand	Anodyne	ABCB1	55	39
COCc1ccc(Cn2c(=O)oc3cc(S(=O)(=O)CCO)ccc32)cc1	ZINC000450922529	GD	On-Demand	Anodyne	MIF	17	44
CC(=O)CCCCCn1cnc2c(Cl)cccc2c1=O	ZINC000450922534	CG	On-Demand	Anodyne	DNAE	57	34
NC(=O)C1(O)CCN(Cc2ccc(Oc3ccccc3F)c(F)c2)CC1	ZINC000450922540	FF	On-Demand	Anodyne	MCHR2	56	34
NC(=O)C1(O)CCN(Cc2ccc(Oc3ccccc3F)c(F)c2)CC1	ZINC000450922540	FF	On-Demand	Anodyne	CCR8	44	39
NC(=O)C1(O)CCN(Cc2ccc(Oc3ccccc3F)c(F)c2)CC1	ZINC000450922540	FF	On-Demand	Anodyne	NPFFR1	51	35
NC(=O)[C@@H]1CC[C@H](Nc2ccnc(C(F)(F)F)c2)C1	ZINC000450922565	CE	On-Demand	Anodyne	TYK2	46	34
COC(=O)[C@H]1CN(c2cccc(F)c2C#N)C[C@@H]1c1ccccc1	ZINC000450922570	DG	On-Demand	Mild	SLC6A1	49	41
COC(=O)[C@H]1CN(c2cccc(F)c2C#N)C[C@H]1c1ccccc1	ZINC000450922571	DG	On-Demand	Mild	SLC6A1	49	41
COC(=O)[C@@H]1CN(c2cccc(F)c2C#N)C[C@H]1c1ccccc1	ZINC000450922572	DG	On-Demand	Mild	SLC6A1	49	41
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3c(F)cccc23)C1	ZINC000450922591	CD	On-Demand	Anodyne	CD38	21	45
COc1cccnc1CNc1ccnc(N2CCOCC2)n1	ZINC000450922601	DC	On-Demand	Anodyne	PIK3CA	19	41
COc1cccnc1CNc1ccnc(N2CCOCC2)n1	ZINC000450922601	DC	On-Demand	Anodyne	EPHB4	40	33
Cc1nc2ccccc2n1CCCCCN1CCC(c2nnc(O)o2)CC1	ZINC000450922611	FG	On-Demand	Anodyne	PDE6D	15	40
COc1cc(CN[C@@H]2CCCC[C@H]2OC(F)F)ccc1Cl	ZINC000450922618	DH	On-Demand	Anodyne	SSTR3	0	45
CCCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450922655	DH	On-Demand	Anodyne	SCD	15	49
O[C@H]1C[C@@H](Nc2cc(-c3ccccc3)nc3ncnn23)C1	ZINC000450922658	CD	On-Demand	Anodyne	DHOD	0	50
COCCNC(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)nc1	ZINC000450922671	CD	On-Demand	Anodyne	IKBKB	15	41
CCOC(=O)CN(C(=O)c1ccc2cnccc2c1)C1CCC1	ZINC000450922684	DF	On-Demand	Anodyne	ACE	53	44
Cc1ccccc1[C@@]1(F)CCN(CC2CCC(=O)CC2)C1	ZINC000450922689	CH	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	31
Cc1ccccc1[C@]1(F)CCN(CC2CCC(=O)CC2)C1	ZINC000450922690	CH	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	31
CCC(=O)CCCN1CC[C@@](F)(c2ccccc2C)C1	ZINC000450922691	CH	On-Demand	Anodyne	SLC18A3	29	42
CCC(=O)CCCN1CC[C@](F)(c2ccccc2C)C1	ZINC000450922692	CH	On-Demand	Anodyne	SLC18A3	29	42
COC(=O)c1csc(COc2ccc(Cl)cc2S(=O)(=O)N(C)C)n1	ZINC000450922700	GE	On-Demand	Anodyne	PTGER1	37	43
COC(=O)c1csc(COc2ccc(Cl)cc2S(=O)(=O)N(C)C)n1	ZINC000450922700	GE	On-Demand	Anodyne	COLA	42	40
COC(=O)c1csc(COc2ccc(Cl)cc2S(=O)(=O)N(C)C)n1	ZINC000450922700	GE	On-Demand	Anodyne	CPT1A	41	40
COC(=O)c1csc(COc2ccc(Cl)cc2S(=O)(=O)N(C)C)n1	ZINC000450922700	GE	On-Demand	Anodyne	CPT1B	58	35
O=C(c1ccc(N[C@@H]2C[C@H](O)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450922706	DD	On-Demand	Bother	AKR1C3	0	40
O=C(c1ccc(N[C@@H]2C[C@H](O)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000450922706	DD	On-Demand	Bother	L3MBTL1	0	43
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	DRD2	34	49
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	DRD1	24	52
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	DRD4	28	56
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	HTR2A	37	65
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	HTR2C	32	61
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	DRD3	0	49
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	ERG2	22	49
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	SLC18A3	0	47
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	HTR3B	0	47
CS(=O)(=O)[C@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922715	DD	On-Demand	Anodyne	CYP2J2	61	43
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	DRD2	34	49
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	DRD1	24	52
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	DRD4	28	56
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	HTR2A	37	65
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	HTR2C	32	61
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	DRD3	0	49
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	ERG2	22	49
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	SLC18A3	0	47
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	HTR3B	0	47
CS(=O)(=O)[C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450922717	DD	On-Demand	Anodyne	CYP2J2	61	43
CCOC(=O)CN(C(=O)CCOc1cccc(OC)c1)C1CCC1	ZINC000450922718	EE	On-Demand	Anodyne	ACE	30	42
CCOC(=O)CN(C(=O)CCOc1cccc(OC)c1)C1CCC1	ZINC000450922718	EE	On-Demand	Anodyne	MTNR1A	28	43
CCOC(=O)CN(C(=O)CCOc1cccc(OC)c1)C1CCC1	ZINC000450922718	EE	On-Demand	Anodyne	MTNR1B	31	42
CCOC(=O)CN(C(=O)CCOc1cccc(OC)c1)C1CCC1	ZINC000450922718	EE	On-Demand	Anodyne	CHRNA10	24	41
FC1(F)CCCC[C@@H]1CN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450922719	FH	On-Demand	Anodyne	COLA	44	40
FC1(F)CCCC[C@@H]1CN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450922719	FH	On-Demand	Anodyne	CPT1A	35	40
NC(=O)c1ccc(CCC(=O)NC2(Cc3ccccc3)CCCCC2)cc1	ZINC000450922720	FH	On-Demand	Anodyne	NPFFR1	43	37
NC(=O)c1ccc(CCC(=O)NC2(Cc3ccccc3)CCCCC2)cc1	ZINC000450922720	FH	On-Demand	Anodyne	SLC12A5	45	37
FC1(F)CCCC[C@H]1CN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450922726	FH	On-Demand	Anodyne	COLA	44	40
FC1(F)CCCC[C@H]1CN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450922726	FH	On-Demand	Anodyne	CPT1A	35	40
FC1(F)CCCC[C@@H]1CN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450922727	FH	On-Demand	Anodyne	COLA	44	40
FC1(F)CCCC[C@@H]1CN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450922727	FH	On-Demand	Anodyne	CPT1A	35	40
FC1(F)CCCC[C@H]1CN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450922728	FH	On-Demand	Anodyne	COLA	44	40
FC1(F)CCCC[C@H]1CN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450922728	FH	On-Demand	Anodyne	CPT1A	35	40
CC(C)NS(=O)(=O)N1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1	ZINC000450922764	GD	On-Demand	Bother	COLA	71	33
COc1ccccc1CCNC(=O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450922771	GC	On-Demand	Anodyne	DRD2	32	41
COc1ccccc1CCNC(=O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450922771	GC	On-Demand	Anodyne	ADRA1A	17	41
COc1ccccc1CCNC(=O)CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450922771	GC	On-Demand	Anodyne	MBTPS1	50	35
COc1cc(OC[C@H](Cc2ccccc2)OC)ccc1C#N	ZINC000450922776	CG	On-Demand	Mild	EDNRA	22	44
COc1cc(OC[C@H](Cc2ccccc2)OC)ccc1C#N	ZINC000450922776	CG	On-Demand	Mild	PDS	41	38
COc1cc(OC[C@@H](Cc2ccccc2)OC)ccc1C#N	ZINC000450922777	CG	On-Demand	Mild	EDNRA	22	44
COc1cc(OC[C@@H](Cc2ccccc2)OC)ccc1C#N	ZINC000450922777	CG	On-Demand	Mild	PDS	41	38
CC(C)NC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)c([N+](=O)[O-])c1	ZINC000450922784	GD	On-Demand	Bother	TAAR1	19	45
CC(C)NC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)c([N+](=O)[O-])c1	ZINC000450922785	GD	On-Demand	Bother	TAAR1	19	45
CCS(=O)(=O)c1ccc(CN(C)CC(=O)N(C)[C@@H](C)c2ccccc2)cc1	ZINC000450922790	GG	On-Demand	Anodyne	LIMK2	26	42
CCS(=O)(=O)c1ccc(CN(C)CC(=O)N(C)[C@@H](C)c2ccccc2)cc1	ZINC000450922790	GG	On-Demand	Anodyne	RORC	36	42
CCS(=O)(=O)c1ccc(CN(C)CC(=O)N(C)[C@H](C)c2ccccc2)cc1	ZINC000450922791	GG	On-Demand	Anodyne	LIMK2	26	42
CCS(=O)(=O)c1ccc(CN(C)CC(=O)N(C)[C@H](C)c2ccccc2)cc1	ZINC000450922791	GG	On-Demand	Anodyne	RORC	36	42
CC[C@H]1Cc2ccccc2CN1C(=O)c1c[nH]c2nccc-2c1	ZINC000450922795	DG	On-Demand	Anodyne	CFTR	55	39
CC[C@@H]1Cc2ccccc2CN1C(=O)c1c[nH]c2nccc-2c1	ZINC000450922796	DG	On-Demand	Anodyne	CFTR	55	39
CC[C@H](O)CC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450922797	CD	On-Demand	Anodyne	LUXR	65	35
CC[C@H](O)CC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450922797	CD	On-Demand	Anodyne	TRAR	81	38
CC[C@H](O)CC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450922797	CD	On-Demand	Anodyne	PHZR	0	41
CC[C@@H](O)CC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450922798	CD	On-Demand	Anodyne	LUXR	65	35
CC[C@@H](O)CC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450922798	CD	On-Demand	Anodyne	TRAR	81	38
CC[C@@H](O)CC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450922798	CD	On-Demand	Anodyne	PHZR	0	41
C[C@H](CCc1ccccc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922815	CD	On-Demand	Anodyne	ANPEP	41	36
C[C@H](CCc1ccccc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922815	CD	On-Demand	Anodyne	LAP3	45	36
C[C@@H](CCc1ccccc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922816	CD	On-Demand	Anodyne	ANPEP	41	36
C[C@@H](CCc1ccccc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922816	CD	On-Demand	Anodyne	LAP3	45	36
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922821	EF	On-Demand	Anodyne	OPRK1	0	49
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922821	EF	On-Demand	Anodyne	ACACA	0	40
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922822	EF	On-Demand	Anodyne	OPRK1	0	49
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC(O)(C(N)=O)CC1	ZINC000450922822	EF	On-Demand	Anodyne	ACACA	0	40
Cc1ccc(NC(=O)CCN2CCN(S(=O)(=O)NC(C)C)CC2)nc1	ZINC000450922824	FC	On-Demand	Anodyne	GCK	0	40
NC(=O)C1(O)CCN(Cc2ccc(Br)c(Cl)c2)CC1	ZINC000450922826	ED	On-Demand	Anodyne	MCHR2	47	31
NC(=O)C1(O)CCN(Cc2ccc(Br)c(Cl)c2)CC1	ZINC000450922826	ED	On-Demand	Anodyne	NPFFR1	53	40
NC(=O)C1(O)CCN(CC(=O)N(CCc2ccccc2)Cc2ccccc2)CC1	ZINC000450922831	GD	On-Demand	Anodyne	OPRM1	15	41
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450922836	FD	On-Demand	Anodyne	CA2	26	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450922836	FD	On-Demand	Anodyne	SFRP1	112	36
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450922836	FD	On-Demand	Anodyne	WNT3	71	34
COc1ccc(-c2ccnc(N[C@@H]3CC[C@H](C(N)=O)C3)n2)cc1	ZINC000450922837	DE	On-Demand	Anodyne	MAPK1	57	42
COc1ccc(-c2ccnc(N[C@@H]3CC[C@H](C(N)=O)C3)n2)cc1	ZINC000450922837	DE	On-Demand	Anodyne	VCP	52	43
COc1ccc(-c2ccnc(N[C@@H]3CC[C@H](C(N)=O)C3)n2)cc1	ZINC000450922837	DE	On-Demand	Anodyne	SMG1	40	30
Cc1cc(C)c([N+](=O)[O-])c(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)n1	ZINC000450922846	GD	On-Demand	Bother	S1PR4	0	41
CCOC(=O)c1ccc(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)nc1	ZINC000450922859	GD	On-Demand	Anodyne	CA2	20	41
CCOC(=O)c1ccc(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)nc1	ZINC000450922859	GD	On-Demand	Anodyne	CA1	17	41
CCOC(=O)c1ccc(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)nc1	ZINC000450922859	GD	On-Demand	Anodyne	CA7	19	41
CCOC(=O)c1ccc(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)nc1	ZINC000450922859	GD	On-Demand	Anodyne	CA13	22	41
COC(=O)[C@H]1CN(c2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1	ZINC000450922872	EF	On-Demand	Bother	SLC6A1	61	44
COC(=O)[C@H]1CN(c2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450922873	EF	On-Demand	Bother	SLC6A1	61	44
COC(=O)[C@@H]1CN(c2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450922874	EF	On-Demand	Bother	SLC6A1	61	44
NC(=O)[C@@H]1CC[C@H](Nc2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450922875	DF	On-Demand	Anodyne	CD38	15	41
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)C1	ZINC000450922880	FD	On-Demand	Anodyne	EPHX2	15	43
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)C1	ZINC000450922880	FD	On-Demand	Anodyne	TGM2	59	45
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)C1	ZINC000450922880	FD	On-Demand	Anodyne	GCK	46	30
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)C1	ZINC000450922880	FD	On-Demand	Anodyne	F13A1	54	42
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)C1	ZINC000450922880	FD	On-Demand	Anodyne	GCKR	62	36
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)C1	ZINC000450922880	FD	On-Demand	Anodyne	NAMPT	36	41
COc1cc(CN2CCC(O)(C(N)=O)CC2)ccc1OCc1cccc(C#N)c1	ZINC000450922892	GD	On-Demand	Mild	NPFFR1	40	36
COc1cc(CN2CCC(O)(C(N)=O)CC2)ccc1OCc1cccc(C#N)c1	ZINC000450922892	GD	On-Demand	Mild	PDEB1	0	40
Cc1cc(OCc2ccccc2)nc(N[C@@H]2CC[C@H](C(N)=O)C2)n1	ZINC000450922894	EE	On-Demand	Anodyne	VCP	53	39
COc1ccc(-c2noc(N3CCC[C@@H](NC(=O)N(C)C)C3)n2)cc1	ZINC000450922895	ED	On-Demand	Anodyne	COLA	45	45
COc1ccc(-c2noc(N3CCC[C@@H](NC(=O)N(C)C)C3)n2)cc1	ZINC000450922895	ED	On-Demand	Anodyne	CPT1A	34	43
COc1ccc(-c2noc(N3CCC[C@H](NC(=O)N(C)C)C3)n2)cc1	ZINC000450922896	ED	On-Demand	Anodyne	COLA	45	45
COc1ccc(-c2noc(N3CCC[C@H](NC(=O)N(C)C)C3)n2)cc1	ZINC000450922896	ED	On-Demand	Anodyne	CPT1A	34	43
O=C(c1ccc(NC[C@@H]2C[C@H]2C2CC2)nc1)N1CCc2ccccc21	ZINC000450922920	EH	On-Demand	Anodyne	AVPR2	84	40
O=C(c1ccc(NC[C@@H]2C[C@H]2C2CC2)nc1)N1CCc2ccccc21	ZINC000450922920	EH	On-Demand	Anodyne	AVPR1A	52	40
CCCOc1cccc(COc2ccc([N+](=O)[O-])c(CO)c2)c1	ZINC000450922931	DG	On-Demand	Bother	MAOB	41	38
CCCOc1cccc(COc2ccc([N+](=O)[O-])c(CO)c2)c1	ZINC000450922931	DG	On-Demand	Bother	UPP1	52	39
CCCOc1cccc(COc2ccc([N+](=O)[O-])c(CO)c2)c1	ZINC000450922931	DG	On-Demand	Bother	ACR	28	43
COC(=O)c1csc(CN2CCC(c3ccc(Br)cc3)CC2)n1	ZINC000450922936	GI	On-Demand	Anodyne	MGEA5	25	40
CCc1cc2c(NCc3ncccc3OC)ncnc2s1	ZINC000450922937	DG	On-Demand	Anodyne	EGFR	16	54
CCc1cc2c(NCc3ncccc3OC)ncnc2s1	ZINC000450922937	DG	On-Demand	Anodyne	CLK4	51	37
COc1cccnc1CNc1cc(N2CCCCC2)ncn1	ZINC000450922938	CE	On-Demand	Anodyne	GALR2	50	36
CCOC(=O)c1cccnc1NCc1ncccc1OC	ZINC000450922943	CE	On-Demand	Anodyne	PPIA	26	48
CCc1ccccc1NC(=O)[C@H](C)N1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450922954	GD	On-Demand	Anodyne	KCNQ2	66	37
CCc1ccccc1NC(=O)[C@@H](C)N1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450922955	GD	On-Demand	Anodyne	KCNQ2	66	37
C[C@H](O)C[C@@H]1COCCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450922956	FF	On-Demand	Anodyne	PRCP	44	34
C[C@H](O)C[C@@H]1COCCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450922958	FF	On-Demand	Anodyne	PRCP	44	34
C[C@H](O)C[C@@H]1COCCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450922959	FF	On-Demand	Anodyne	PRCP	44	34
C[C@H](O)C[C@@H]1COCCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450922960	FF	On-Demand	Anodyne	PRCP	44	34
CN(C)S(=O)(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450922964	EE	On-Demand	Bother	BDKRB1	22	42
O=c1c(C(F)(F)F)nc2ccc(C(F)(F)F)cc2n1CC1CCC1	ZINC000450922965	FI	On-Demand	Anodyne	Q8MHZ5_SHEEP	50	39
COC(=O)c1csc(CN2C[C@H](OC)Cc3ccccc32)n1	ZINC000450922970	DF	On-Demand	Anodyne	TPP2	55	36
COC(=O)c1csc(CN2C[C@@H](OC)Cc3ccccc32)n1	ZINC000450922971	DF	On-Demand	Anodyne	TPP2	55	36
CCOC(=O)CN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C1CCC1	ZINC000450922972	FE	On-Demand	Anodyne	ACE	38	46
CCOC(=O)CN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C1CCC1	ZINC000450922972	FE	On-Demand	Anodyne	PYGL	35	57
CCOC(=O)CN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C1CCC1	ZINC000450922972	FE	On-Demand	Anodyne	EPHX2	19	55
CCOC(=O)CN(C(=O)CNC(=O)Nc1cccc(Cl)c1)C1CCC1	ZINC000450922972	FE	On-Demand	Anodyne	PSBA	0	41
C[C@H](O)CCCN1CCN(CCC[C@H](C)O)[C@@H](c2cccc(F)c2)C1	ZINC000450922973	FF	On-Demand	Anodyne	CCR5	60	32
C[C@H](O)CCCN1CCN(CCC[C@@H](C)O)[C@H](c2cccc(F)c2)C1	ZINC000450922977	FF	On-Demand	Anodyne	CCR5	60	32
C[C@H](O)CCCN1CCN(CCC[C@@H](C)O)[C@@H](c2cccc(F)c2)C1	ZINC000450922979	FF	On-Demand	Anodyne	CCR5	60	32
C[C@H](O)CCCN1CCN(CCC[C@H](C)O)[C@H](c2cccc(F)c2)C1	ZINC000450922980	FF	On-Demand	Anodyne	CCR5	60	32
Cc1ccc2ncnc(N[C@@H]3C[C@H](O)C3)c2c1	ZINC000450922993	BD	On-Demand	Anodyne	CD38	98	48
COc1cc(CS(=O)(=O)c2ccc(C)c(C)c2)ccc1Cl	ZINC000450923010	DH	On-Demand	Anodyne	FFAR4	22	48
COc1cc(NC(=O)CS(=O)(=O)C2CC2)ccc1OC(C)C	ZINC000450923015	ED	On-Demand	Anodyne	QRFPR	40	33
COc1cc(NC(=O)CS(=O)(=O)C2CC2)ccc1OC(C)C	ZINC000450923015	ED	On-Demand	Anodyne	ENPP1	67	38
COCCN(Cc1ccc(F)c(Cl)c1)c1ccc([N+](=O)[O-])cn1	ZINC000450923017	EG	On-Demand	Bother	SSTR2	22	47
CCOC(=O)CN(C(=O)Cc1ccc(C(=O)OC)cc1)C1CCC1	ZINC000450923019	ED	On-Demand	Anodyne	ACE	35	40
C[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)CC(=O)N1C	ZINC000450923037	FF	On-Demand	Anodyne	CYP2J2	52	37
C[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)CC(=O)N1C	ZINC000450923038	FF	On-Demand	Anodyne	CYP2J2	52	37
CCOC(=O)CN(C(=O)c1ccc(C)c2c1CCC2)C1CCC1	ZINC000450923055	DG	On-Demand	Anodyne	ACE	63	50
COc1ccccc1[C@@H]1CN(C[C@H]2COCCO2)CCN1C[C@H]1COCCO1	ZINC000450923065	GD	On-Demand	Anodyne	HTR1A	18	43
COc1ccccc1[C@@H]1CN(C[C@H]2COCCO2)CCN1C[C@H]1COCCO1	ZINC000450923065	GD	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1[C@@H]1CN(C[C@H]2COCCO2)CCN1C[C@H]1COCCO1	ZINC000450923065	GD	On-Demand	Anodyne	ADRA1A	19	43
COc1ccccc1[C@@H]1CN(C[C@H]2COCCO2)CCN1C[C@H]1COCCO1	ZINC000450923065	GD	On-Demand	Anodyne	ADRA1B	19	43
COc1ccccc1[C@@H]1CN(C[C@@H]2COCCO2)CCN1C[C@@H]1COCCO1	ZINC000450923067	GD	On-Demand	Anodyne	HTR1A	18	43
COc1ccccc1[C@@H]1CN(C[C@@H]2COCCO2)CCN1C[C@@H]1COCCO1	ZINC000450923067	GD	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1[C@@H]1CN(C[C@@H]2COCCO2)CCN1C[C@@H]1COCCO1	ZINC000450923067	GD	On-Demand	Anodyne	ADRA1A	19	43
COc1ccccc1[C@@H]1CN(C[C@@H]2COCCO2)CCN1C[C@@H]1COCCO1	ZINC000450923067	GD	On-Demand	Anodyne	ADRA1B	19	43
COC(=O)[C@H]1CN(c2ccc(F)cc2[N+](=O)[O-])C[C@@H]1c1ccccc1	ZINC000450923068	EG	On-Demand	Bother	SLC6A1	37	40
COc1ccccc1[C@@H]1CN(C[C@@H]2COCCO2)CCN1C[C@H]1COCCO1	ZINC000450923069	GD	On-Demand	Anodyne	HTR1A	18	43
COc1ccccc1[C@@H]1CN(C[C@@H]2COCCO2)CCN1C[C@H]1COCCO1	ZINC000450923069	GD	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1[C@@H]1CN(C[C@@H]2COCCO2)CCN1C[C@H]1COCCO1	ZINC000450923069	GD	On-Demand	Anodyne	ADRA1A	19	43
COc1ccccc1[C@@H]1CN(C[C@@H]2COCCO2)CCN1C[C@H]1COCCO1	ZINC000450923069	GD	On-Demand	Anodyne	ADRA1B	19	43
COC(=O)[C@H]1CN(c2ccc(F)cc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450923070	EG	On-Demand	Bother	SLC6A1	37	40
COc1ccccc1[C@@H]1CN(C[C@H]2COCCO2)CCN1C[C@@H]1COCCO1	ZINC000450923071	GD	On-Demand	Anodyne	HTR1A	18	43
COc1ccccc1[C@@H]1CN(C[C@H]2COCCO2)CCN1C[C@@H]1COCCO1	ZINC000450923071	GD	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1[C@@H]1CN(C[C@H]2COCCO2)CCN1C[C@@H]1COCCO1	ZINC000450923071	GD	On-Demand	Anodyne	ADRA1A	19	43
COc1ccccc1[C@@H]1CN(C[C@H]2COCCO2)CCN1C[C@@H]1COCCO1	ZINC000450923071	GD	On-Demand	Anodyne	ADRA1B	19	43
COC(=O)[C@@H]1CN(c2ccc(F)cc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450923072	EG	On-Demand	Bother	SLC6A1	37	40
Cc1nc(N[C@@H]2CC[C@H](C(N)=O)C2)c(Cl)cc1C#N	ZINC000450923074	CD	On-Demand	Mild	CSNK2A1	61	36
Cc1nc(N[C@@H]2CC[C@H](C(N)=O)C2)c(Cl)cc1C#N	ZINC000450923074	CD	On-Demand	Mild	HIPK2	41	33
NC(=O)[C@@H]1CC[C@H](Nc2ncncc2Br)C1	ZINC000450923075	CD	On-Demand	Anodyne	CD38	23	47
CN(C)C(=O)N[C@H]1CCCN(c2cccc(C(F)(F)F)n2)C1	ZINC000450923086	DE	On-Demand	Anodyne	SFRP1	47	35
CN(C)C(=O)N[C@@H]1CCCN(c2cccc(C(F)(F)F)n2)C1	ZINC000450923087	DE	On-Demand	Anodyne	SFRP1	47	35
Cc1ccn(CC(=O)NC2(Cc3ccccc3)CCCCC2)n1	ZINC000450923088	DG	On-Demand	Anodyne	SLC12A5	47	37
Cc1ccnc(N[C@@H]2CC[C@H](C(N)=O)C2)n1	ZINC000450923093	BC	On-Demand	Anodyne	MAPK8	31	42
CCOC(=O)CN(C(=O)c1cccc2c1O[C@H](C)C2)C1CCC1	ZINC000450923099	DF	On-Demand	Anodyne	ACE	57	45
CCOC(=O)CN(C(=O)c1cccc2c1O[C@@H](C)C2)C1CCC1	ZINC000450923100	DF	On-Demand	Anodyne	ACE	57	45
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450923101	GF	On-Demand	Anodyne	AVPR2	72	42
NC(=O)C1(O)CCN(Cc2ccc(C3CCCCC3)cc2)CC1	ZINC000450923103	DF	On-Demand	Anodyne	SIGMAR1	38	40
NC(=O)C1(O)CCN(Cc2ccc(C3CCCCC3)cc2)CC1	ZINC000450923103	DF	On-Demand	Anodyne	NPFFR1	51	34
CN(C)C(=O)N[C@H]1CCCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450923104	GF	On-Demand	Anodyne	AVPR2	72	42
NC(=O)[C@@H]1CC[C@H](Nc2cc(N3CCCC3)ncn2)C1	ZINC000450923109	CD	On-Demand	Anodyne	HRH4	15	40
CN(C)C(=O)N[C@H]1CCCN(c2nc(-c3ccccc3)cs2)C1	ZINC000450923110	EG	On-Demand	Anodyne	COLA	48	41
CN(C)C(=O)N[C@H]1CCCN(c2nc(-c3ccccc3)cs2)C1	ZINC000450923110	EG	On-Demand	Anodyne	CPT1A	43	41
CN(C)C(=O)N[C@@H]1CCCN(c2nc(-c3ccccc3)cs2)C1	ZINC000450923112	EG	On-Demand	Anodyne	COLA	48	41
CN(C)C(=O)N[C@@H]1CCCN(c2nc(-c3ccccc3)cs2)C1	ZINC000450923112	EG	On-Demand	Anodyne	CPT1A	43	41
CN(C)C(=O)N[C@H]1CCCN(c2nnc(Cc3ccc(F)cc3)s2)C1	ZINC000450923119	FF	On-Demand	Anodyne	CCR3	73	33
CN(C)C(=O)N[C@@H]1CCCN(c2nnc(Cc3ccc(F)cc3)s2)C1	ZINC000450923120	FF	On-Demand	Anodyne	CCR3	73	33
NC(=O)C1(O)CCN(Cc2cccc(SCc3ccccc3)c2)CC1	ZINC000450923128	FF	On-Demand	Anodyne	NPFFR2	44	41
NC(=O)C1(O)CCN(Cc2cccc(SCc3ccccc3)c2)CC1	ZINC000450923128	FF	On-Demand	Anodyne	MCHR2	47	32
NC(=O)C1(O)CCN(Cc2cccc(SCc3ccccc3)c2)CC1	ZINC000450923128	FF	On-Demand	Anodyne	NPFFR1	66	41
CN(C)C(=O)N[C@@H]1CCCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450923130	DD	On-Demand	Mild	MTNR1A	31	40
CN(C)C(=O)N[C@@H]1CCCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450923130	DD	On-Demand	Mild	MTNR1B	0	40
CN(C)C(=O)N[C@H]1CCCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450923131	DD	On-Demand	Mild	MTNR1A	31	40
CN(C)C(=O)N[C@H]1CCCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000450923131	DD	On-Demand	Mild	MTNR1B	0	40
COC(=O)[C@@H](NC(=O)CC1CC(F)(F)C1)c1ccc(F)c(C)c1	ZINC000450923132	EF	On-Demand	Anodyne	LEF	55	34
COC(=O)[C@H](NC(=O)CC1CC(F)(F)C1)c1ccc(F)c(C)c1	ZINC000450923133	EF	On-Demand	Anodyne	LEF	55	34
COc1ccc2c(c1)[C@@H](NC(=O)Cc1sccc1Br)CCO2	ZINC000450923137	GH	On-Demand	Anodyne	LUXR	63	35
COc1ccc2c(c1)[C@@H](NC(=O)Cc1sccc1Br)CCO2	ZINC000450923137	GH	On-Demand	Anodyne	TRAR	68	38
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccccc3)cs2)CC1	ZINC000450923138	FD	On-Demand	Anodyne	COLA	0	40
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccccc3)cs2)CC1	ZINC000450923138	FD	On-Demand	Anodyne	CPT1A	16	40
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccccc3)cs2)CC1	ZINC000450923138	FD	On-Demand	Anodyne	ROCK1	22	44
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccccc3)cs2)CC1	ZINC000450923138	FD	On-Demand	Anodyne	ROCK2	15	44
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccccc3)cs2)CC1	ZINC000450923138	FD	On-Demand	Anodyne	HDAC9	16	49
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccccc3)cs2)CC1	ZINC000450923138	FD	On-Demand	Anodyne	TRPA1	15	48
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccccc3)cs2)CC1	ZINC000450923138	FD	On-Demand	Anodyne	SLC12A5	19	43
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccccc3)cs2)CC1	ZINC000450923138	FD	On-Demand	Anodyne	SLC27A1	35	40
CC(C)[C@H](NC(=O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450923163	EC	On-Demand	Anodyne	NPFFR1	46	33
CC(C)[C@@H](NC(=O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450923164	EC	On-Demand	Anodyne	NPFFR1	46	33
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450923174	EG	On-Demand	Anodyne	ADRB3	28	49
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450923174	EG	On-Demand	Anodyne	CD38	26	46
Cc1cccc(Cc2cnc(NC(=O)CN3CCC(O)(C(N)=O)CC3)s2)c1	ZINC000450923175	GD	On-Demand	Anodyne	SCD1	23	40
Cc1cccc(Cc2cnc(NC(=O)CN3CCC(O)(C(N)=O)CC3)s2)c1	ZINC000450923175	GD	On-Demand	Anodyne	SCD	31	40
Cc1cccc(Cc2cnc(NC(=O)CN3CCC(O)(C(N)=O)CC3)s2)c1	ZINC000450923175	GD	On-Demand	Anodyne	MGEA5	34	44
C[C@@H]1CCC[C@]1(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450923184	DH	On-Demand	Bother	P2RX7	35	46
C[C@H]1CCC[C@]1(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450923185	DH	On-Demand	Bother	P2RX7	27	45
C[C@@H]1CCC[C@@]1(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450923186	DH	On-Demand	Bother	P2RX7	35	46
C[C@H]1CCC[C@@]1(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450923187	DH	On-Demand	Bother	P2RX7	35	46
NC(=O)C1(O)CCN(CC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450923194	GD	On-Demand	Anodyne	NPFFR2	44	35
NC(=O)C1(O)CCN(CC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450923194	GD	On-Demand	Anodyne	SOAT1	27	46
NC(=O)C1(O)CCN(CC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450923194	GD	On-Demand	Anodyne	NPFFR1	58	38
NC(=O)C1(O)CCN(CC(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450923195	GD	On-Demand	Anodyne	NPFFR2	44	35
NC(=O)C1(O)CCN(CC(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450923195	GD	On-Demand	Anodyne	SOAT1	27	46
NC(=O)C1(O)CCN(CC(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450923195	GD	On-Demand	Anodyne	NPFFR1	58	38
CC[C@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923200	FI	On-Demand	Anodyne	SLC1A1	46	39
CC[C@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923200	FI	On-Demand	Anodyne	SLC1A3	43	39
CC[C@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923200	FI	On-Demand	Anodyne	SLC1A2	51	39
CC[C@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923200	FI	On-Demand	Anodyne	CSF1R	21	47
CC[C@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923200	FI	On-Demand	Anodyne	BTK	24	41
CC[C@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923200	FI	On-Demand	Anodyne	TAAR1	28	42
CC[C@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923200	FI	On-Demand	Anodyne	KCNK3	102	51
CC[C@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923200	FI	On-Demand	Anodyne	KCNK9	52	51
CC[C@@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923201	FI	On-Demand	Anodyne	SLC1A1	46	39
CC[C@@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923201	FI	On-Demand	Anodyne	SLC1A3	43	39
CC[C@@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923201	FI	On-Demand	Anodyne	SLC1A2	51	39
CC[C@@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923201	FI	On-Demand	Anodyne	CSF1R	21	47
CC[C@@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923201	FI	On-Demand	Anodyne	BTK	24	41
CC[C@@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923201	FI	On-Demand	Anodyne	TAAR1	28	42
CC[C@@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923201	FI	On-Demand	Anodyne	KCNK3	102	51
CC[C@@H](O)CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000450923201	FI	On-Demand	Anodyne	KCNK9	52	51
CN(C)C(=O)N[C@H]1CCCN(c2nc3ccccc3nc2N2CCCC2)C1	ZINC000450923206	FE	On-Demand	Anodyne	FASN	25	40
CN(C)C(=O)N[C@@H]1CCCN(c2nc3ccccc3nc2N2CCCC2)C1	ZINC000450923207	FE	On-Demand	Anodyne	FASN	25	40
COc1cc(NC(=O)C2(C)CCC(=O)CC2)ccc1OC(C)C	ZINC000450923223	DH	On-Demand	Anodyne	ENPP1	53	32
C=CCNC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450923233	ED	On-Demand	Mild	HPGDS	28	43
C=CCNC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450923234	ED	On-Demand	Mild	HPGDS	28	43
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(C(F)(F)F)c(C#N)c2)C1	ZINC000450923244	EF	On-Demand	Mild	SFRP1	53	33
CN(C)C(=O)N[C@H]1CCCN(c2ccc(C(F)(F)F)c(C#N)c2)C1	ZINC000450923245	EF	On-Demand	Mild	SFRP1	53	33
Cc1ccc(OCCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1C	ZINC000450923247	FD	On-Demand	Anodyne	DRD2	20	41
Cc1ccc(OCCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1C	ZINC000450923247	FD	On-Demand	Anodyne	DRD3	17	41
Cc1ccc(OCCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1C	ZINC000450923247	FD	On-Demand	Anodyne	HRH3	102	47
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C)CCC[C@H]2C)cc1	ZINC000450923251	EG	On-Demand	Anodyne	ACACA	54	39
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C)CCC[C@@H]2C)cc1	ZINC000450923253	EG	On-Demand	Anodyne	ACACA	54	39
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C)CCC[C@@H]2C)cc1	ZINC000450923254	EG	On-Demand	Anodyne	ACACA	54	39
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C)CCC[C@H]2C)cc1	ZINC000450923255	EG	On-Demand	Anodyne	ACACA	54	39
CN(C)S(=O)(=O)c1cc(Cl)ccc1OCC(=O)CC(C)(C)C1CC1	ZINC000450923256	FG	On-Demand	Anodyne	PTGDR2	33	43
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2cc(OC(F)F)ccc2n1	ZINC000450923257	GG	On-Demand	Anodyne	GYRB	0	48
Cc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2cc(OC(F)F)ccc2n1	ZINC000450923257	GG	On-Demand	Anodyne	ADAM17	51	37
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2cc(OC(F)F)ccc2n1	ZINC000450923259	GG	On-Demand	Anodyne	GYRB	0	48
Cc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2cc(OC(F)F)ccc2n1	ZINC000450923259	GG	On-Demand	Anodyne	ADAM17	51	37
CN(C)C(=O)N[C@H]1CCCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450923267	EG	On-Demand	Anodyne	LUCI_LUCLA	19	43
CN(C)C(=O)N[C@@H]1CCCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450923269	EG	On-Demand	Anodyne	LUCI_LUCLA	19	43
CCOC(=O)CN(C(=O)c1cccc(C(F)(F)F)n1)C1CCC1	ZINC000450923270	EF	On-Demand	Anodyne	ACE	52	43
CC(C)(C)OC1CC(Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450923280	EG	On-Demand	Anodyne	VCP	57	34
COCc1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450923288	DE	On-Demand	Anodyne	SSTR5	46	35
CCCc1cc(N[C@@H]2CC[C@H](C(N)=O)C2)n2ncnc2n1	ZINC000450923308	CD	On-Demand	Anodyne	DHOD	0	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000450923313	EF	On-Demand	Mild	AR	55	44
CN(C)C(=O)N[C@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000450923315	EF	On-Demand	Mild	AR	55	44
COC(=O)c1coc(CN2C[C@H](OC)Cc3ccccc32)n1	ZINC000450923322	DE	On-Demand	Anodyne	TPP2	53	34
COC(=O)c1coc(CN2C[C@@H](OC)Cc3ccccc32)n1	ZINC000450923324	DE	On-Demand	Anodyne	TPP2	53	34
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc3ccccc3s1)CCO2	ZINC000450923336	FI	On-Demand	Anodyne	EDNRB	45	38
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc3ccccc3s1)CCO2	ZINC000450923336	FI	On-Demand	Anodyne	LUXR	59	44
COc1ccc2c(c1)[C@@H](NC(=O)Cc1cc3ccccc3s1)CCO2	ZINC000450923336	FI	On-Demand	Anodyne	TRAR	71	37
CCc1cc(CC)nc(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)n1	ZINC000450923385	GD	On-Demand	Anodyne	CA1	17	40
COCCOC[C@@H](O)CN1CC[C@](F)(c2ccccc2C)C1	ZINC000450923387	DD	On-Demand	Anodyne	HSP90AB1	36	42
COCCOC[C@H](O)CN1CC[C@](F)(c2ccccc2C)C1	ZINC000450923391	DD	On-Demand	Anodyne	HSP90AB1	36	42
N#Cc1cc(N[C@H]2CC[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000450923392	CD	On-Demand	Mild	HIPK2	40	33
COCCOC[C@@H](O)CN1CC[C@@](F)(c2ccccc2C)C1	ZINC000450923394	DD	On-Demand	Anodyne	HSP90AB1	36	42
COCCOC[C@H](O)CN1CC[C@@](F)(c2ccccc2C)C1	ZINC000450923395	DD	On-Demand	Anodyne	HSP90AB1	36	42
COC(=O)c1csc(CN2CCC(N3CCc4ccccc43)CC2)n1	ZINC000450923403	FF	On-Demand	Anodyne	SCD1	0	50
COC(=O)c1csc(CN2CCC(N3CCc4ccccc43)CC2)n1	ZINC000450923403	FF	On-Demand	Anodyne	NAMPT	22	40
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450923413	GD	On-Demand	Anodyne	CA7	25	40
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450923413	GD	On-Demand	Anodyne	HSD11B1	17	42
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450923413	GD	On-Demand	Anodyne	SFRP1	126	38
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450923413	GD	On-Demand	Anodyne	WNT3	87	38
CC(=O)c1ccc(N[C@@H]2C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450923414	CD	On-Demand	Bother	AKR1C3	15	45
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450923415	GD	On-Demand	Anodyne	CA7	25	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450923415	GD	On-Demand	Anodyne	HSD11B1	17	42
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450923415	GD	On-Demand	Anodyne	SFRP1	126	38
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450923415	GD	On-Demand	Anodyne	WNT3	87	38
COc1cccnc1CNc1cc(N2CCCC2)ncn1	ZINC000450923416	CE	On-Demand	Anodyne	GALR2	48	35
COc1cccnc1CNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450923418	FE	On-Demand	Anodyne	NAMPT	34	43
CN(C)C(=O)c1ccc(=NC[C@@H]2CCCC(C)(C)C2)[nH]c1	ZINC000450923424	CF	On-Demand	Anodyne	KCNQ1	0	42
CN(C)C(=O)c1ccc(=NC[C@H]2CCCC(C)(C)C2)[nH]c1	ZINC000450923426	CF	On-Demand	Anodyne	KCNQ1	0	42
NC(=O)C1(O)CCN(CC(=O)Nc2ccccc2Cc2ccccc2)CC1	ZINC000450923432	FD	On-Demand	Anodyne	KCNQ2	23	40
NC(=O)C1(O)CCN(CC(=O)Nc2ccccc2Cc2ccccc2)CC1	ZINC000450923432	FD	On-Demand	Anodyne	NPFFR1	55	35
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450923434	GH	On-Demand	Anodyne	F7	31	42
CN(C)C(=O)N[C@@H]1CCCN(c2cccc(C(=O)OC(C)(C)C)n2)C1	ZINC000450923436	EE	On-Demand	Anodyne	PRKCQ	19	42
CN(C)C(=O)N[C@H]1CCCN(c2cccc(C(=O)OC(C)(C)C)n2)C1	ZINC000450923437	EE	On-Demand	Anodyne	PRKCQ	19	42
CCC[C@H](NC(=O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450923438	EC	On-Demand	Anodyne	OPRK1	0	40
CCC[C@H](NC(=O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450923438	EC	On-Demand	Anodyne	NPFFR1	45	33
CCC[C@@H](NC(=O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450923439	EC	On-Demand	Anodyne	OPRK1	0	40
CCC[C@@H](NC(=O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450923439	EC	On-Demand	Anodyne	NPFFR1	45	33
COC(=O)c1ccc(CC(=O)N[C@@H](C(=O)OC)c2ccc(F)c(C)c2)cc1	ZINC000450923441	FE	On-Demand	Anodyne	LEF	54	37
CCOC(=O)CN(C(=O)c1cc(F)c(N2CCOCC2)c(F)c1)C1CCC1	ZINC000450923442	GE	On-Demand	Anodyne	ACE	42	42
COCCN(Cc1ccc(F)c(Cl)c1)c1ccnc2c1cnn2C	ZINC000450923447	EG	On-Demand	Anodyne	Q9M629_MAIZE	50	35
COC(=O)c1ccc(CC(=O)N[C@H](C(=O)OC)c2ccc(F)c(C)c2)cc1	ZINC000450923448	FE	On-Demand	Anodyne	LEF	54	37
COC(=O)[C@@H](NC(=O)Cn1ccc(C)n1)c1ccc(F)c(C)c1	ZINC000450923463	DD	On-Demand	Anodyne	LEF	45	31
COC(=O)[C@H](NC(=O)Cn1ccc(C)n1)c1ccc(F)c(C)c1	ZINC000450923464	DD	On-Demand	Anodyne	LEF	45	31
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	OPRK1	0	46
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	OPRL1	19	46
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	CASR	18	43
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	KCNQ2	30	41
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	NPY2R	64	41
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	CCR3	17	40
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	NPFFR2	19	43
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	MTNR1B	24	42
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	PLAU	23	47
COc1cccc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923469	GD	On-Demand	Anodyne	NPFFR1	24	43
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	OPRK1	0	46
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	OPRL1	19	46
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	CASR	18	43
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	KCNQ2	30	41
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	NPY2R	64	41
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	CCR3	17	40
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	NPFFR2	19	43
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	MTNR1B	24	42
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	PLAU	23	47
COc1cccc(NC(=O)[C@H](c2ccccc2)N2CCC(O)(C(N)=O)CC2)c1	ZINC000450923470	GD	On-Demand	Anodyne	NPFFR1	24	43
Cc1cnc(N[C@@H]2CC[C@H](C(N)=O)C2)nc1-c1ccccc1F	ZINC000450923474	DF	On-Demand	Anodyne	MAPK10	0	45
Cc1cnc(N[C@@H]2CC[C@H](C(N)=O)C2)nc1-c1ccccc1F	ZINC000450923474	DF	On-Demand	Anodyne	CDK2	0	42
CCOC(=O)c1cnc2c(OC)cccc2c1N[C@@H]1CC[C@H](C(N)=O)C1	ZINC000450923475	FE	On-Demand	Anodyne	PDE4B	17	50
COC(=O)[C@@H](NC(=O)CCCC(=O)C1CC1)c1ccc(F)c(C)c1	ZINC000450923478	EF	On-Demand	Anodyne	LEF	62	36
COC(=O)[C@H](NC(=O)CCCC(=O)C1CC1)c1ccc(F)c(C)c1	ZINC000450923479	EF	On-Demand	Anodyne	LEF	62	36
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450923487	GC	On-Demand	Bother	TAAR1	19	41
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450923488	GC	On-Demand	Bother	TAAR1	19	41
COC(=O)[C@H](NC(=O)C1CC(C)(O)C1)c1ccc(F)c(C)c1	ZINC000450923494	DD	On-Demand	Anodyne	LEF	40	33
COC(=O)[C@@H](NC(=O)C1CC(C)(O)C1)c1ccc(F)c(C)c1	ZINC000450923495	DD	On-Demand	Anodyne	LEF	40	33
CCN1CCN(CC(C)(C)Nc2ncnc3ccc(C)cc23)CC1	ZINC000450923504	EF	On-Demand	Anodyne	HTT	0	43
CCOC(=O)CN(C(=O)c1ccnc(OC(F)F)c1)C1CCC1	ZINC000450923526	EE	On-Demand	Anodyne	ACE	50	44
Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450923529	GH	On-Demand	Anodyne	F7	31	42
CN1C(=O)CC[C@H]1C(=O)NC1(Cc2ccccc2)CCCCC1	ZINC000450923532	DF	On-Demand	Anodyne	P2RX7	22	43
CN1C(=O)CC[C@H]1C(=O)NC1(Cc2ccccc2)CCCCC1	ZINC000450923532	DF	On-Demand	Anodyne	SLC12A5	40	38
CN1C(=O)CC[C@@H]1C(=O)NC1(Cc2ccccc2)CCCCC1	ZINC000450923534	DF	On-Demand	Anodyne	P2RX7	22	43
CN1C(=O)CC[C@@H]1C(=O)NC1(Cc2ccccc2)CCCCC1	ZINC000450923534	DF	On-Demand	Anodyne	SLC12A5	40	38
N#C[C@H]1CC[C@H](Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450923535	DF	On-Demand	Mild	VCP	62	47
N#C[C@@H]1CC[C@@H](Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450923541	DF	On-Demand	Mild	VCP	62	47
N#C[C@H]1CC[C@@H](Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450923543	DF	On-Demand	Mild	VCP	62	47
N#C[C@@H]1CC[C@H](Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450923545	DF	On-Demand	Mild	VCP	62	47
COc1ccc2nc(C)nc(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1	ZINC000450923559	DE	On-Demand	Anodyne	CD38	22	40
CC(C)(O)Cn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450923562	FG	On-Demand	Anodyne	SCD	17	48
NC(=O)[C@@H]1CC[C@H](Nc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000450923571	FE	On-Demand	Anodyne	VCP	26	43
CCOC(=O)CN(C(=O)c1cn(CCc2ccccc2)nn1)C1CCC1	ZINC000450923579	FE	On-Demand	Anodyne	ACE	43	38
CCOC(=O)CN(C(=O)c1cn(CCc2ccccc2)nn1)C1CCC1	ZINC000450923579	FE	On-Demand	Anodyne	THYX_PBCV1	0	47
CCN1CCN(CC(C)(C)Nc2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450923581	FF	On-Demand	Anodyne	FGFR1	23	41
CCN1CCN(CC(C)(C)Nc2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450923581	FF	On-Demand	Anodyne	FLT1	26	42
CCN1CCN(CC(C)(C)Nc2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450923581	FF	On-Demand	Anodyne	PDE3B	51	33
CCN1CCN(CC(C)(C)Nc2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450923581	FF	On-Demand	Anodyne	EPHA2	46	35
Cc1cccc(Cl)c1COc1ccc(C(=O)NC[C@H](C)O)cc1	ZINC000450923602	EG	On-Demand	Anodyne	NR1H4	63	38
CCN1CCN(CC(C)(C)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1	ZINC000450923607	FG	On-Demand	Bother	AADAC	0	46
CN(C)S(=O)(=O)c1cc(Cl)ccc1OCCC(C)(F)F	ZINC000450923609	EG	On-Demand	Anodyne	PTGDR2	15	43
CO[C@H](COc1ccc([N+](=O)[O-])c(CO)c1)Cc1ccccc1	ZINC000450923614	DF	On-Demand	Bother	PDS	71	43
CO[C@H](COc1ccc([N+](=O)[O-])c(CO)c1)Cc1ccccc1	ZINC000450923614	DF	On-Demand	Bother	PQSD	0	42
CO[C@@H](COc1ccc([N+](=O)[O-])c(CO)c1)Cc1ccccc1	ZINC000450923615	DF	On-Demand	Bother	PDS	71	43
CO[C@@H](COc1ccc([N+](=O)[O-])c(CO)c1)Cc1ccccc1	ZINC000450923615	DF	On-Demand	Bother	PQSD	0	42
COc1cnc(N[C@@H]2CC[C@H](C(N)=O)C2)nc1N[C@@H]1CC[C@H](C(N)=O)C1	ZINC000450923628	FC	On-Demand	Anodyne	TYRO3	42	38
O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1C[C@H]1C1CC1	ZINC000450923631	CG	On-Demand	Bother	PRKCQ	23	42
Cc1ccc([N+](=O)[O-])c(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)n1	ZINC000450923635	GD	On-Demand	Bother	S1PR4	25	48
N#Cc1ccc(N[C@H]2CC[C@@H](C(N)=O)C2)cc1C(F)(F)F	ZINC000450923639	CF	On-Demand	Mild	AR	50	43
N#Cc1ccc(N[C@H]2CC[C@@H](C(N)=O)C2)cc1C(F)(F)F	ZINC000450923639	CF	On-Demand	Mild	DHODH	62	39
CCS(=O)(=O)c1ccccc1N1CCC[C@@H](NC(=O)N(C)C)C1	ZINC000450923666	ED	On-Demand	Anodyne	KCNQ2	69	34
CCS(=O)(=O)c1ccccc1N1CCC[C@@H](NC(=O)N(C)C)C1	ZINC000450923666	ED	On-Demand	Anodyne	MTNR1A	31	40
CCS(=O)(=O)c1ccccc1N1CCC[C@@H](NC(=O)N(C)C)C1	ZINC000450923666	ED	On-Demand	Anodyne	MTNR1B	0	40
CCS(=O)(=O)c1ccccc1N1CCC[C@H](NC(=O)N(C)C)C1	ZINC000450923667	ED	On-Demand	Anodyne	KCNQ2	69	34
CCS(=O)(=O)c1ccccc1N1CCC[C@H](NC(=O)N(C)C)C1	ZINC000450923667	ED	On-Demand	Anodyne	MTNR1A	31	40
CCS(=O)(=O)c1ccccc1N1CCC[C@H](NC(=O)N(C)C)C1	ZINC000450923667	ED	On-Demand	Anodyne	MTNR1B	0	40
CC[C@H](O)CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450923673	CE	On-Demand	Bother	P2RX7	58	38
CC[C@@H](O)CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450923675	CE	On-Demand	Bother	P2RX7	58	38
CCOC(=O)CN(C(=O)c1ccn(CCn2cccn2)n1)C1CCC1	ZINC000450923689	ED	On-Demand	Anodyne	ACE	42	40
Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1NC(=O)CCN(C)C	ZINC000450923691	GF	On-Demand	Anodyne	LCK	31	42
Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1NC(=O)CCN(C)C	ZINC000450923691	GF	On-Demand	Anodyne	MAPK14	41	44
Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1NC(=O)CCN(C)C	ZINC000450923691	GF	On-Demand	Anodyne	LDLR	0	43
Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1NC(=O)CCN(C)C	ZINC000450923691	GF	On-Demand	Anodyne	FASN	15	47
Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1NC(=O)CCN(C)C	ZINC000450923691	GF	On-Demand	Anodyne	BTK	24	42
Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1NC(=O)CCN(C)C	ZINC000450923691	GF	On-Demand	Anodyne	HSPB1	0	40
CC[C@@H]1C[C@H]1C(=O)N[C@@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450923699	CF	On-Demand	Anodyne	LEF	69	36
CC[C@@H]1C[C@H]1C(=O)N[C@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450923704	CF	On-Demand	Anodyne	LEF	69	36
CCOC(=O)CN(C(=O)c1ccc(C#N)n1C)C1CCC1	ZINC000450923708	CD	On-Demand	Mild	ACE	53	42
CC(=O)c1cccc(CN2CCCC[C@H]2C(F)F)c1	ZINC000450923725	CH	On-Demand	Anodyne	CCR3	19	42
CC(=O)c1cccc(CN2CCCC[C@@H]2C(F)F)c1	ZINC000450923727	CH	On-Demand	Anodyne	CCR3	19	42
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(C)(C)OC(C)C	ZINC000450923737	GK	On-Demand	Anodyne	CPT1A	61	36
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(C)(C)OC(C)C	ZINC000450923737	GK	On-Demand	Anodyne	CPT2	44	33
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(C)(C)OC(C)C	ZINC000450923737	GK	On-Demand	Anodyne	CSF1R	23	45
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(C)(C)OC(C)C	ZINC000450923737	GK	On-Demand	Anodyne	BTK	22	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(C)(C)OC(C)C	ZINC000450923737	GK	On-Demand	Anodyne	TAAR1	32	42
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(C)(C)OC(C)C	ZINC000450923737	GK	On-Demand	Anodyne	KCNK3	115	51
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(C)(C)OC(C)C	ZINC000450923737	GK	On-Demand	Anodyne	KCNK9	74	51
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C(C)(C)OC(C)C	ZINC000450923737	GK	On-Demand	Anodyne	H9CNL0_SPOEX	0	42
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450923739	FG	On-Demand	Anodyne	CCR2	53	36
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450923739	FG	On-Demand	Anodyne	TEK	18	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450923739	FG	On-Demand	Anodyne	LIPG	54	35
Cc1ccc2ncnc(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1	ZINC000450923740	CE	On-Demand	Anodyne	CD38	75	59
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450923741	FG	On-Demand	Anodyne	CCR2	53	36
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450923741	FG	On-Demand	Anodyne	TEK	18	40
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450923741	FG	On-Demand	Anodyne	LIPG	54	35
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450923743	GH	On-Demand	Anodyne	ADRB2	18	48
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450923743	GH	On-Demand	Anodyne	ADRB3	33	51
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450923744	GH	On-Demand	Anodyne	ADRB2	18	48
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450923744	GH	On-Demand	Anodyne	ADRB3	33	51
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	COLA	57	37
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	CPT1A	54	37
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	CPT2	45	37
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	GUAB	0	40
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	JAK1	0	42
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	GRM4	35	45
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	TYK2	50	37
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	ENPP1	70	35
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	KCNK3	73	44
COc1cc(NC(=O)c2c(C)cccc2Cl)ccc1OC(C)C	ZINC000450923746	EJ	On-Demand	Anodyne	KCNK9	68	41
CC[C@@H](O)CC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450923752	CF	On-Demand	Anodyne	SLC1A2	49	34
CC[C@@H](O)CC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450923752	CF	On-Demand	Anodyne	ENPP1	74	43
CC[C@@H](O)CC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450923752	CF	On-Demand	Anodyne	KCNK3	43	36
CC[C@H](O)CC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450923753	CF	On-Demand	Anodyne	SLC1A2	49	34
CC[C@H](O)CC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450923753	CF	On-Demand	Anodyne	ENPP1	74	43
CC[C@H](O)CC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450923753	CF	On-Demand	Anodyne	KCNK3	43	36
CS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c(F)c1	ZINC000450923770	DD	On-Demand	Anodyne	SLC6A9	0	40
CS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c(F)c1	ZINC000450923770	DD	On-Demand	Anodyne	GPR119	24	40
CC1CCN(C(=O)c2ccc(N[C@@H]3CC[C@H](C(N)=O)C3)nc2)CC1	ZINC000450923771	EE	On-Demand	Anodyne	PTR1	46	35
CC1CCN(C(=O)c2ccc(N[C@@H]3CC[C@H](C(N)=O)C3)nc2)CC1	ZINC000450923771	EE	On-Demand	Anodyne	L3MBTL1	0	42
CC1CCN(C(=O)c2ccc(N[C@@H]3CC[C@H](C(N)=O)C3)nc2)CC1	ZINC000450923771	EE	On-Demand	Anodyne	L3MBTL3	63	36
CC1CCN(C(=O)c2ccc(N[C@@H]3CC[C@H](C(N)=O)C3)nc2)CC1	ZINC000450923771	EE	On-Demand	Anodyne	TRPC6	41	35
NC(=O)[C@@H]1CC[C@H](Nc2ccnc3cc(F)c(Cl)cc23)C1	ZINC000450923783	DG	On-Demand	Anodyne	HRP1_PLAFA	41	31
COCc1cc([N+](=O)[O-])ccc1N[C@@H]1CC[C@H](C(N)=O)C1	ZINC000450923786	CD	On-Demand	Bother	CACNA1D	79	35
NC(=O)[C@H]1CC[C@@H](Nc2cc(N[C@H]3CC[C@@H](C(N)=O)C3)nc3cnccc23)C1	ZINC000450923795	GD	On-Demand	Anodyne	PRKD1	38	40
CN(C)C(=O)N[C@H]1CCCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450923800	GE	On-Demand	Anodyne	ACACA	0	43
CN(C)C(=O)N[C@H]1CCCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450923800	GE	On-Demand	Anodyne	ACACB	24	44
CN(C)C(=O)N[C@@H]1CCCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450923801	GE	On-Demand	Anodyne	ACACA	0	43
CN(C)C(=O)N[C@@H]1CCCN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450923801	GE	On-Demand	Anodyne	ACACB	24	44
C[C@@H](CC(F)(F)F)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450923802	DI	On-Demand	Anodyne	SDH1	0	40
C[C@@H](CC(F)(F)F)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450923802	DI	On-Demand	Anodyne	TIMP3	45	33
C[C@H](CC(F)(F)F)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450923803	DI	On-Demand	Anodyne	SDH1	0	40
C[C@H](CC(F)(F)F)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450923803	DI	On-Demand	Anodyne	TIMP3	45	33
CCN1CCN(CC(C)(C)Nc2ncnc3ccc(SC)cc23)CC1	ZINC000450923810	FG	On-Demand	Anodyne	HTT	0	44
C[C@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450923811	EG	On-Demand	Anodyne	SDH1	0	43
C[C@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450923811	EG	On-Demand	Anodyne	TIMP3	55	35
C[C@@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450923812	EG	On-Demand	Anodyne	SDH1	0	43
C[C@@H](CC(F)(F)F)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450923812	EG	On-Demand	Anodyne	TIMP3	55	35
CC(C)NS(=O)(=O)N1CCN(CCC(=O)Nc2cccnc2)CC1	ZINC000450923824	FC	On-Demand	Anodyne	NAMPT	40	36
CCOC(=O)CN(C(=O)c1cc(C)cs1)C1CCC1	ZINC000450923827	CF	On-Demand	Anodyne	ACE	56	51
CC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450923848	CD	On-Demand	Anodyne	MCHR1	16	45
CC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450923848	CD	On-Demand	Anodyne	HPGDS	17	42
CC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450923849	CD	On-Demand	Anodyne	MCHR1	16	45
CC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450923849	CD	On-Demand	Anodyne	HPGDS	17	42
CCOC(=O)CN(C(=O)[C@H](C)OCCc1ccccc1)C1CCC1	ZINC000450923852	EF	On-Demand	Anodyne	ACE	40	37
CCOC(=O)CN(C(=O)[C@H](C)OCCc1ccccc1)C1CCC1	ZINC000450923852	EF	On-Demand	Anodyne	AMY2	48	34
CCOC(=O)CN(C(=O)[C@@H](C)OCCc1ccccc1)C1CCC1	ZINC000450923853	EF	On-Demand	Anodyne	ACE	40	37
CCOC(=O)CN(C(=O)[C@@H](C)OCCc1ccccc1)C1CCC1	ZINC000450923853	EF	On-Demand	Anodyne	AMY2	48	34
CCOC(=O)CN(C(=O)c1ccc(C(F)(F)F)[nH]1)C1CCC1	ZINC000450923859	DF	On-Demand	Anodyne	ACE	48	44
CN(C)C(=O)N[C@@H]1CCCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450923867	EF	On-Demand	Anodyne	COLA	43	38
CN(C)C(=O)N[C@@H]1CCCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450923867	EF	On-Demand	Anodyne	GRM5	40	50
CN(C)C(=O)N[C@H]1CCCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450923868	EF	On-Demand	Anodyne	COLA	43	38
CN(C)C(=O)N[C@H]1CCCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450923868	EF	On-Demand	Anodyne	GRM5	40	50
CCN1CCN(CC(C)(C)Nc2ncnc3cc(Br)ccc23)CC1	ZINC000450923869	GG	On-Demand	Anodyne	EGFR	56	38
CCOC(=O)CN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C1CCC1	ZINC000450923873	FF	On-Demand	Bother	SLC27A4	54	36
CCOC(=O)c1c[nH]c2ccc(OC)cc2c1=N[C@@H]1CC[C@H](C(N)=O)C1	ZINC000450923874	FD	On-Demand	Anodyne	MTNR1A	18	41
NC(=O)C1(O)CCN(CC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)CC1	ZINC000450923884	GC	On-Demand	Anodyne	EPHX2	87	44
CNS(=O)(=O)NCC(=O)NCCc1c(C)oc2ccccc12	ZINC000450923908	EC	On-Demand	Anodyne	THRB	0	41
CNS(=O)(=O)NCC(=O)NCCc1c(C)oc2ccccc12	ZINC000450923908	EC	On-Demand	Anodyne	MTNR1A	23	41
CCN1CCN(CC(C)(C)Nc2ncc([N+](=O)[O-])c(N)n2)CC1	ZINC000450923925	DC	On-Demand	Bother	PRKCQ	41	37
NC(=O)[C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1	ZINC000450923926	GD	On-Demand	Bother	TBXA2R	19	43
NC(=O)[C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1	ZINC000450923926	GD	On-Demand	Bother	EPHX2	20	50
NC(=O)C1(O)CCN(Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1	ZINC000450923930	GF	On-Demand	Anodyne	DRD4	16	40
NC(=O)C1(O)CCN(Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1	ZINC000450923930	GF	On-Demand	Anodyne	AGTR1	20	41
NC(=O)C1(O)CCN(Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1	ZINC000450923930	GF	On-Demand	Anodyne	TBXA2R	23	48
NC(=O)C1(O)CCN(Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1	ZINC000450923930	GF	On-Demand	Anodyne	AGTR1B	19	41
NC(=O)C1(O)CCN(Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1	ZINC000450923930	GF	On-Demand	Anodyne	GRM2	0	49
NC(=O)C1(O)CCN(Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1	ZINC000450923930	GF	On-Demand	Anodyne	CCR2	0	40
NC(=O)C1(O)CCN(Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1	ZINC000450923930	GF	On-Demand	Anodyne	MCHR2	48	32
NC(=O)C1(O)CCN(Cc2nc3cc(Cl)ccc3n2Cc2ccccc2)CC1	ZINC000450923930	GF	On-Demand	Anodyne	NPFFR1	55	36
CC[C@@H](O)CC(=O)N[C@@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450923966	CD	On-Demand	Anodyne	LEF	64	38
CC[C@H](O)CC(=O)N[C@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450923967	CD	On-Demand	Anodyne	LEF	64	38
CC[C@@H](O)CC(=O)N[C@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450923968	CD	On-Demand	Anodyne	LEF	64	38
CC[C@H](O)CC(=O)N[C@@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450923969	CD	On-Demand	Anodyne	LEF	64	38
CN(C)C(=O)N[C@@H]1CCCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450923983	DE	On-Demand	Anodyne	MLYCD	63	39
CN(C)C(=O)N[C@H]1CCCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450923984	DE	On-Demand	Anodyne	MLYCD	63	39
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3ccc(I)cc23)C1	ZINC000450923986	GE	On-Demand	Anodyne	CD38	72	60
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450923988	GF	On-Demand	Anodyne	PDE3A	44	33
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450923988	GF	On-Demand	Anodyne	PDE3B	66	34
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450923988	GF	On-Demand	Anodyne	SIRT3	41	30
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450923989	GF	On-Demand	Anodyne	PDE3A	44	33
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450923989	GF	On-Demand	Anodyne	PDE3B	66	34
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450923989	GF	On-Demand	Anodyne	SIRT3	41	30
COc1cccnc1CNc1nc2ccccc2nc1N1CCOCC1	ZINC000450923997	FE	On-Demand	Anodyne	EPHB4	45	33
COc1cccnc1CNc1nc2ccccc2nc1N1CCOCC1	ZINC000450923997	FE	On-Demand	Anodyne	STAT6	38	41
COc1cc(CN2CCOC[C@H]2c2nc(-c3ccccc3)no2)ccc1Cl	ZINC000450924031	GH	On-Demand	Anodyne	COLA	35	41
COc1cc(CN2CCOC[C@H]2c2nc(-c3ccccc3)no2)ccc1Cl	ZINC000450924031	GH	On-Demand	Anodyne	CPT1A	31	41
COc1cc(CN2CCOC[C@H]2c2nc(-c3ccccc3)no2)ccc1Cl	ZINC000450924031	GH	On-Demand	Anodyne	GRM5	18	40
COc1cc(CN2CCOC[C@@H]2c2nc(-c3ccccc3)no2)ccc1Cl	ZINC000450924032	GH	On-Demand	Anodyne	COLA	35	41
COc1cc(CN2CCOC[C@@H]2c2nc(-c3ccccc3)no2)ccc1Cl	ZINC000450924032	GH	On-Demand	Anodyne	CPT1A	31	41
COc1cc(CN2CCOC[C@@H]2c2nc(-c3ccccc3)no2)ccc1Cl	ZINC000450924032	GH	On-Demand	Anodyne	GRM5	18	40
COc1cccnc1CNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450924044	ED	On-Demand	Anodyne	PDE3A	41	34
COc1cccnc1CNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450924044	ED	On-Demand	Anodyne	PRCP	0	41
COc1cccnc1CNc1cc(N2CCC[C@@H](CO)C2)ncn1	ZINC000450924044	ED	On-Demand	Anodyne	PDE3B	61	35
COc1cccnc1CNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450924045	ED	On-Demand	Anodyne	PDE3A	41	34
COc1cccnc1CNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450924045	ED	On-Demand	Anodyne	PRCP	0	41
COc1cccnc1CNc1cc(N2CCC[C@H](CO)C2)ncn1	ZINC000450924045	ED	On-Demand	Anodyne	PDE3B	61	35
COc1cccnc1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450924075	FE	On-Demand	Anodyne	HTR1A	30	41
COc1cccnc1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450924075	FE	On-Demand	Anodyne	DRD2	18	42
COc1cccnc1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450924075	FE	On-Demand	Anodyne	DRD3	18	42
COc1cccnc1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450924075	FE	On-Demand	Anodyne	HTR3A	27	45
COc1cccnc1CNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000450924075	FE	On-Demand	Anodyne	HRH4	36	46
Cc1cc(NC[C@@H]2C[C@H]2C2CC2)cc(C#N)n1	ZINC000450924079	BF	On-Demand	Mild	GPR119	0	44
COc1ccc(-c2noc(CN3CCC(N4CCc5ccccc54)CC3)n2)nn1	ZINC000450924086	GF	On-Demand	Anodyne	SCD1	18	41
COc1ccc(-c2noc(CN3CCC(N4CCc5ccccc54)CC3)n2)nn1	ZINC000450924086	GF	On-Demand	Anodyne	SCD	27	40
CCS(=O)(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450924097	GH	On-Demand	Anodyne	CHRM2	15	40
CCS(=O)(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450924097	GH	On-Demand	Anodyne	DRD2	16	41
CCS(=O)(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450924097	GH	On-Demand	Anodyne	DRD4	42	41
CCS(=O)(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450924097	GH	On-Demand	Anodyne	ACHE	18	40
CCS(=O)(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450924097	GH	On-Demand	Anodyne	SIGMAR1	42	43
CCS(=O)(=O)c1ccc(CN[C@]2(Cc3ccc(Cl)cc3)CCOC2)cc1	ZINC000450924105	GH	On-Demand	Anodyne	PSEN2	49	31
CCS(=O)(=O)c1ccc(CN[C@@]2(Cc3ccc(Cl)cc3)CCOC2)cc1	ZINC000450924106	GH	On-Demand	Anodyne	PSEN2	49	31
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	ESR1	48	37
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	DRD2	18	41
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	HTR2A	15	43
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	LTA4H	58	41
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	HTR7	30	43
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	HRH3	55	43
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	SIGMAR1	17	40
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	PSMB2	50	37
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	PSMB5	17	42
CC(C)NS(=O)(=O)N1CCN(CCOc2ccc3ccccc3c2)CC1	ZINC000450924112	GE	On-Demand	Anodyne	PSMB1	44	42
CCOC(=O)CN(C(=O)c1ccsn1)C1CCC1	ZINC000450924121	CD	On-Demand	Anodyne	ACE	57	45
CN(C)C(=O)N[C@@H]1CCCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450924133	FD	On-Demand	Anodyne	CXCR3	32	40
CN(C)C(=O)N[C@H]1CCCN(c2ncc(C(=O)N(C)C)cc2Cl)C1	ZINC000450924134	FD	On-Demand	Anodyne	CXCR3	32	40
CN(C)C(=O)N[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450924135	ED	On-Demand	Anodyne	P2RY12	26	40
CN(C)C(=O)N[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450924135	ED	On-Demand	Anodyne	CXCR3	32	46
CN(C)C(=O)N[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450924136	ED	On-Demand	Anodyne	P2RY12	26	40
CN(C)C(=O)N[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450924136	ED	On-Demand	Anodyne	CXCR3	32	46
O=c1oc2cc(S(=O)(=O)CCO)ccc2n1C[C@H]1CCc2ccccc2C1	ZINC000450924139	GE	On-Demand	Anodyne	NPY1R	40	39
O=c1oc2cc(S(=O)(=O)CCO)ccc2n1C[C@@H]1CCc2ccccc2C1	ZINC000450924140	GE	On-Demand	Anodyne	NPY1R	40	39
Cc1cc(C#N)cc(N[C@@H]2CC[C@H](C(N)=O)C2)n1	ZINC000450924142	BD	On-Demand	Mild	CSNK2A1	47	33
N#Cc1cc2c(nc1N[C@H]1CC[C@@H](C(N)=O)C1)CCCC2	ZINC000450924145	CD	On-Demand	Mild	CSNK2A1	49	34
COc1cc(OCC[C@@H](C)O)ccc1C#N	ZINC000450924159	BD	On-Demand	Mild	EDNRA	0	43
COc1cc(OCC[C@H](C)O)ccc1C#N	ZINC000450924160	BD	On-Demand	Mild	EDNRA	0	43
CNS(=O)(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)c(F)c1	ZINC000450924172	FC	On-Demand	Anodyne	SLC6A9	0	41
CNS(=O)(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)c(F)c1	ZINC000450924173	FC	On-Demand	Anodyne	SLC6A9	0	41
CCN1CCN(CC(C)(C)Nc2nc3cc(C)ccc3o2)CC1	ZINC000450924175	DF	On-Demand	Anodyne	SSTR5	41	33
O=C(N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)[C@@H](O)C1CCC1	ZINC000450924179	FE	On-Demand	Anodyne	RBP4	48	33
O=C(N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)[C@@H](O)C1CCC1	ZINC000450924181	FE	On-Demand	Anodyne	RBP4	48	33
O=C(N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)[C@H](O)C1CCC1	ZINC000450924183	FE	On-Demand	Anodyne	RBP4	48	33
O=C(N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)[C@H](O)C1CCC1	ZINC000450924185	FE	On-Demand	Anodyne	RBP4	48	33
CCOC(=O)CN(C(=O)c1cc(C(=O)OCC)c(C)[nH]1)C1CCC1	ZINC000450924190	EE	On-Demand	Anodyne	ACE	55	48
CCOC(=O)CN(C(=O)Cn1ccc(C)n1)C1CCC1	ZINC000450924197	CD	On-Demand	Anodyne	ACE	18	40
CCOC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)nc1	ZINC000450924203	DD	On-Demand	Anodyne	HPGDS	22	41
CCOC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)nc1	ZINC000450924204	DD	On-Demand	Anodyne	HPGDS	22	41
C[C@H](CC(F)(F)F)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450924205	EF	On-Demand	Anodyne	F7	30	42
C[C@H](CC(F)(F)F)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450924205	EF	On-Demand	Anodyne	PSBA	0	42
CCS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)cc1	ZINC000450924207	CD	On-Demand	Anodyne	RORC	40	33
C[C@@H](CC(F)(F)F)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450924208	EF	On-Demand	Anodyne	F7	30	42
C[C@@H](CC(F)(F)F)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450924208	EF	On-Demand	Anodyne	PSBA	0	42
COc1cc(CC(=O)NC2(Cc3ccccc3)CCCCC2)ccc1O	ZINC000450924211	FI	On-Demand	Anodyne	TRPV1	30	47
COc1cc(CC(=O)NC2(Cc3ccccc3)CCCCC2)ccc1O	ZINC000450924211	FI	On-Demand	Anodyne	BCHE	17	40
COc1cc(CC(=O)NC2(Cc3ccccc3)CCCCC2)ccc1O	ZINC000450924211	FI	On-Demand	Anodyne	SLC12A5	46	37
C[C@H](O)CNC(=O)c1ccc(OCC/C=C\c2ccccc2)cc1	ZINC000450924222	EG	On-Demand	Anodyne	CYP24A1	25	43
C[C@H](O)CNC(=O)c1ccc(OCC/C=C\c2ccccc2)cc1	ZINC000450924222	EG	On-Demand	Anodyne	CYP27B1	36	43
C[C@H](O)CNC(=O)c1ccc(OCC/C=C/c2ccccc2)cc1	ZINC000450924224	EG	On-Demand	Anodyne	CYP24A1	25	43
C[C@H](O)CNC(=O)c1ccc(OCC/C=C/c2ccccc2)cc1	ZINC000450924224	EG	On-Demand	Anodyne	CYP27B1	36	43
CC(C)NS(=O)(=O)N1CCN(Cc2ccc(C(=O)OC(C)(C)C)cc2)CC1	ZINC000450924226	GE	On-Demand	Anodyne	NOD2	40	35
NC(=O)C1(O)CCN([C@H](C(=O)Nc2ccccc2)c2ccccc2)CC1	ZINC000450924251	FD	On-Demand	Anodyne	OPRK1	0	52
NC(=O)C1(O)CCN([C@H](C(=O)Nc2ccccc2)c2ccccc2)CC1	ZINC000450924251	FD	On-Demand	Anodyne	NPFFR1	42	32
NC(=O)C1(O)CCN([C@@H](C(=O)Nc2ccccc2)c2ccccc2)CC1	ZINC000450924252	FD	On-Demand	Anodyne	OPRK1	0	52
NC(=O)C1(O)CCN([C@@H](C(=O)Nc2ccccc2)c2ccccc2)CC1	ZINC000450924252	FD	On-Demand	Anodyne	NPFFR1	42	32
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccc(F)cc3)cs2)CC1	ZINC000450924261	GD	On-Demand	Anodyne	ROCK1	20	47
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccc(F)cc3)cs2)CC1	ZINC000450924261	GD	On-Demand	Anodyne	HDAC9	17	52
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccc(F)cc3)cs2)CC1	ZINC000450924261	GD	On-Demand	Anodyne	TRPA1	20	40
NC(=O)C1(O)CCN(CC(=O)Nc2nc(-c3ccc(F)cc3)cs2)CC1	ZINC000450924261	GD	On-Demand	Anodyne	SLC27A1	46	45
CC[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450924262	DG	On-Demand	Anodyne	CFTR	54	35
CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450924263	DG	On-Demand	Anodyne	CFTR	54	35
Cc1ccc(C#N)c(N[C@@H]2CC[C@H](C(N)=O)C2)n1	ZINC000450924271	BD	On-Demand	Mild	CSNK2A1	49	33
Cc1ccc(C#N)c(N[C@@H]2CC[C@H](C(N)=O)C2)n1	ZINC000450924271	BD	On-Demand	Mild	HIPK2	40	33
CC(C)NS(=O)(=O)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450924273	ED	On-Demand	Anodyne	BIRC2	48	41
CCOC(=O)c1ccc2c(c1)nc(CN1CCC(O)(C(N)=O)CC1)n2CC	ZINC000450924275	FD	On-Demand	Anodyne	MCHR2	41	32
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450924285	GC	On-Demand	Bother	DDIT3	0	41
CCOC(=O)c1cc(C(=O)N[C@H](C(=O)OC)c2ccc(F)c(C)c2)[nH]c1C	ZINC000450924291	GF	On-Demand	Anodyne	LEF	48	34
CCOC(=O)c1cc(C(=O)N[C@@H](C(=O)OC)c2ccc(F)c(C)c2)[nH]c1C	ZINC000450924292	GF	On-Demand	Anodyne	LEF	48	34
NC(=O)C1(O)CCN(Cc2ccccc2Oc2cccnc2)CC1	ZINC000450924296	ED	On-Demand	Anodyne	CCR8	56	55
CC(C)NS(=O)(=O)N1CCN([C@@H](C)CCc2ccccc2)CC1	ZINC000450924314	ED	On-Demand	Anodyne	PGA5	44	32
CC(C)NS(=O)(=O)N1CCN([C@H](C)CCc2ccccc2)CC1	ZINC000450924315	ED	On-Demand	Anodyne	PGA5	44	32
CCOC(=O)c1cccnc1N1CCC[C@@H](NC(=O)N(C)C)C1	ZINC000450924326	DD	On-Demand	Anodyne	P2RY12	49	35
CCOC(=O)c1cccnc1N1CCC[C@H](NC(=O)N(C)C)C1	ZINC000450924327	DD	On-Demand	Anodyne	P2RY12	49	35
CCOC(=O)CN(C(=O)c1cc(C(=O)OCC)no1)C1CCC1	ZINC000450924332	DD	On-Demand	Anodyne	ACE	54	46
CCOC(=O)CN(C(=O)c1cc(C(=O)OCC)no1)C1CCC1	ZINC000450924332	DD	On-Demand	Anodyne	S1PR3	0	40
CN(C)C(=O)N[C@H]1CCCN(c2ccnc(C(N)=O)c2)C1	ZINC000450924340	CC	On-Demand	Anodyne	HRH4	34	42
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc(C(N)=O)c2)C1	ZINC000450924341	CC	On-Demand	Anodyne	HRH4	34	42
CO[C@H](COc1ccnc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450924345	DH	On-Demand	Anodyne	PDS	41	34
CO[C@@H](COc1ccnc(C(F)(F)F)c1)Cc1ccccc1	ZINC000450924346	DH	On-Demand	Anodyne	PDS	41	34
O=C(N[C@H]1CCCc2sccc21)c1ccc(N2CCC2)nc1	ZINC000450924347	DG	On-Demand	Anodyne	HPGDS	24	47
O=C(N[C@@H]1CCCc2sccc21)c1ccc(N2CCC2)nc1	ZINC000450924348	DG	On-Demand	Anodyne	HPGDS	24	47
Cc1cc(-c2cccc(F)c2)nnc1N1CCC[C@H](NC(=O)N(C)C)C1	ZINC000450924349	FF	On-Demand	Anodyne	GRM5	0	43
Cc1cc(-c2cccc(F)c2)nnc1N1CCC[C@@H](NC(=O)N(C)C)C1	ZINC000450924350	FF	On-Demand	Anodyne	GRM5	0	43
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450924364	EG	On-Demand	Anodyne	FAP	0	43
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450924366	EG	On-Demand	Anodyne	FAP	0	43
CN(C)C(=O)N[C@H]1CCCN(c2ncncc2-c2ccccc2)C1	ZINC000450924368	EE	On-Demand	Anodyne	SLC9A1	15	45
CN(C)C(=O)N[C@@H]1CCCN(c2ncncc2-c2ccccc2)C1	ZINC000450924370	EE	On-Demand	Anodyne	SLC9A1	15	45
CN(C)C(=O)N[C@H]1CCCN(c2nc(-c3ccccc3)c3ccccc3n2)C1	ZINC000450924375	GH	On-Demand	Anodyne	TACR2	23	40
CN(C)C(=O)N[C@H]1CCCN(c2nc(-c3ccccc3)c3ccccc3n2)C1	ZINC000450924375	GH	On-Demand	Anodyne	TACR3	61	35
CN(C)C(=O)N[C@@H]1CCCN(c2nc(-c3ccccc3)c3ccccc3n2)C1	ZINC000450924377	GH	On-Demand	Anodyne	TACR2	23	40
CN(C)C(=O)N[C@@H]1CCCN(c2nc(-c3ccccc3)c3ccccc3n2)C1	ZINC000450924377	GH	On-Demand	Anodyne	TACR3	61	35
Cc1nc2ccccc2n1CCCCCN1CCC(O)(C(N)=O)CC1	ZINC000450924387	ED	On-Demand	Anodyne	HRH1	34	41
CCOC(=O)CN(C(=O)c1cccc(SC)c1)C1CCC1	ZINC000450924397	DF	On-Demand	Anodyne	ACE	65	56
COc1cc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ncnc2cc1F	ZINC000450924401	EE	On-Demand	Anodyne	PDE3A	57	43
COc1cc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ncnc2cc1F	ZINC000450924401	EE	On-Demand	Anodyne	PDGFRB	74	42
COc1cc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ncnc2cc1F	ZINC000450924401	EE	On-Demand	Anodyne	PDE3B	85	44
COc1cc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ncnc2cc1F	ZINC000450924401	EE	On-Demand	Anodyne	PDGFRA	36	40
COc1cc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ncnc2cc1F	ZINC000450924405	EE	On-Demand	Anodyne	PDE3A	57	43
COc1cc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ncnc2cc1F	ZINC000450924405	EE	On-Demand	Anodyne	PDGFRB	74	42
COc1cc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ncnc2cc1F	ZINC000450924405	EE	On-Demand	Anodyne	PDE3B	85	44
COc1cc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ncnc2cc1F	ZINC000450924405	EE	On-Demand	Anodyne	PDGFRA	36	40
COC(=O)[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccc(F)c(C)c1	ZINC000450924420	GF	On-Demand	Anodyne	FOLH1	46	42
COC(=O)[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccc(F)c(C)c1	ZINC000450924420	GF	On-Demand	Anodyne	LEF	43	33
COC(=O)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccc(F)c(C)c1	ZINC000450924422	GF	On-Demand	Anodyne	FOLH1	46	42
COC(=O)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccc(F)c(C)c1	ZINC000450924422	GF	On-Demand	Anodyne	LEF	43	33
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3sc([N+](=O)[O-])cc23)C1	ZINC000450924424	DD	On-Demand	Bother	CD38	31	46
CC1(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCC(=O)CC1	ZINC000450924430	DG	On-Demand	Bother	P2RX7	28	45
CCOC(=O)CN(C(=O)c1cc(Br)c(F)cc1O)C1CCC1	ZINC000450924450	FF	On-Demand	Anodyne	ACE	56	49
NC(=O)C1(O)CCN(C[C@@H](O)COc2cc(F)cc(Br)c2)CC1	ZINC000450924458	GC	On-Demand	Anodyne	ACOX1	46	34
NC(=O)C1(O)CCN(C[C@@H](O)COc2cc(F)cc(Br)c2)CC1	ZINC000450924458	GC	On-Demand	Anodyne	ABCB1	38	41
NC(=O)C1(O)CCN(C[C@H](O)COc2cc(F)cc(Br)c2)CC1	ZINC000450924460	GC	On-Demand	Anodyne	ACOX1	46	34
NC(=O)C1(O)CCN(C[C@H](O)COc2cc(F)cc(Br)c2)CC1	ZINC000450924460	GC	On-Demand	Anodyne	ABCB1	38	41
COc1cc(OC)c2ncnc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450924491	FD	On-Demand	Anodyne	PDE3A	48	38
COc1cc(OC)c2ncnc(N3CCC[C@@H](NC(=O)N(C)C)C3)c2c1	ZINC000450924491	FD	On-Demand	Anodyne	PDE3B	46	38
COc1cc(OC)c2ncnc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450924493	FD	On-Demand	Anodyne	PDE3A	48	38
COc1cc(OC)c2ncnc(N3CCC[C@H](NC(=O)N(C)C)C3)c2c1	ZINC000450924493	FD	On-Demand	Anodyne	PDE3B	46	38
CCCN(CC[C@H](C)O)[C@H](C)CC(=O)Nc1ccccc1	ZINC000450924498	CF	On-Demand	Anodyne	LTA4H	21	40
CCCN(CC[C@H](C)O)[C@@H](C)CC(=O)Nc1ccccc1	ZINC000450924499	CF	On-Demand	Anodyne	LTA4H	21	40
CCCN(CC[C@@H](C)O)[C@H](C)CC(=O)Nc1ccccc1	ZINC000450924501	CF	On-Demand	Anodyne	LTA4H	21	40
CCCN(CC[C@@H](C)O)[C@@H](C)CC(=O)Nc1ccccc1	ZINC000450924503	CF	On-Demand	Anodyne	LTA4H	21	40
COc1cccnc1CNc1ncc(C(=O)N2CCCCC2)cc1Cl	ZINC000450924525	FG	On-Demand	Anodyne	HPGD	33	41
Cc1ccc(F)c(CS(=O)(=O)c2ccc(C)c(C)c2)c1	ZINC000450924526	CH	On-Demand	Anodyne	LEF	47	36
C[C@@H](O)CCOc1ccc([N+](=O)[O-])c(CO)c1	ZINC000450924542	BD	On-Demand	Bother	COLA	43	32
C[C@H](O)CCOc1ccc([N+](=O)[O-])c(CO)c1	ZINC000450924553	BD	On-Demand	Bother	COLA	43	32
COC(=O)c1cccc(CN2C[C@H](O)C[C@@H]2c2cccc(OC)c2)c1Cl	ZINC000450924554	GG	On-Demand	Anodyne	DRD4	40	32
COC(=O)c1cccc(CN2C[C@@H](O)C[C@@H]2c2cccc(OC)c2)c1Cl	ZINC000450924555	GG	On-Demand	Anodyne	DRD4	40	32
COC(=O)c1cccc(CN2C[C@H](O)C[C@H]2c2cccc(OC)c2)c1Cl	ZINC000450924556	GG	On-Demand	Anodyne	DRD4	40	32
COC(=O)c1cccc(CN2C[C@@H](O)C[C@H]2c2cccc(OC)c2)c1Cl	ZINC000450924557	GG	On-Demand	Anodyne	DRD4	40	32
NC(=O)C1(O)CCN(CCOc2cccc(F)c2)CC1	ZINC000450924565	CC	On-Demand	Anodyne	LTA4H	34	42
NC(=O)C1(O)CCN(CCOc2cccc(F)c2)CC1	ZINC000450924565	CC	On-Demand	Anodyne	CHRNA10	32	41
NC(=O)C1(O)CCN(CCOc2cccc(F)c2)CC1	ZINC000450924565	CC	On-Demand	Anodyne	PSMB2	45	35
C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C1CCCC1	ZINC000450924578	EH	On-Demand	Bother	L3MBTL1	0	43
C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C1CCCC1	ZINC000450924578	EH	On-Demand	Bother	L3MBTL3	34	43
CN(C)C(=O)N[C@@H]1CCCN(c2cc(Br)ccn2)C1	ZINC000450924584	EE	On-Demand	Anodyne	HRH4	19	42
CN(C)C(=O)N[C@H]1CCCN(c2cc(Br)ccn2)C1	ZINC000450924585	EE	On-Demand	Anodyne	HRH4	19	42
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](S(C)(=O)=O)C1	ZINC000450924587	CD	On-Demand	Anodyne	OPRK1	22	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](S(C)(=O)=O)C1	ZINC000450924588	CD	On-Demand	Anodyne	OPRK1	22	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](S(C)(=O)=O)C1	ZINC000450924589	CD	On-Demand	Anodyne	OPRK1	22	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](S(C)(=O)=O)C1	ZINC000450924591	CD	On-Demand	Anodyne	OPRK1	22	41
NC(=O)[C@@H]1CC[C@H](Nc2ncncc2-c2ccccc2)C1	ZINC000450924595	CE	On-Demand	Anodyne	CD38	21	45
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)C1	ZINC000450924596	FD	On-Demand	Anodyne	SFRP1	106	34
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)C1	ZINC000450924596	FD	On-Demand	Anodyne	WNT3	75	32
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1	ZINC000450924600	DE	On-Demand	Anodyne	ADAM33	0	40
CN(C)C(=O)N[C@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1	ZINC000450924601	DE	On-Demand	Anodyne	ADAM33	0	40
CCOC(=O)CN(C(=O)c1c(Br)cnn1C)C1CCC1	ZINC000450924610	ED	On-Demand	Anodyne	ACE	24	43
COc1cc(COc2ccc(C(=O)NC[C@H](C)O)cc2)ccc1Cl	ZINC000450924613	EG	On-Demand	Anodyne	GCGR	0	42
COc1cc(COc2ccc(C(=O)NC[C@H](C)O)cc2)ccc1Cl	ZINC000450924613	EG	On-Demand	Anodyne	TRPV1	34	40
COc1cc(COc2ccc(C(=O)NC[C@H](C)O)cc2)ccc1Cl	ZINC000450924613	EG	On-Demand	Anodyne	PTGER3	41	35
COc1cc(COc2ccc(C(=O)NC[C@H](C)O)cc2)ccc1Cl	ZINC000450924613	EG	On-Demand	Anodyne	MT-ND1	26	43
COc1cc(COc2ccc(C(=O)NC[C@H](C)O)cc2)ccc1Cl	ZINC000450924613	EG	On-Demand	Anodyne	ADCYAP1R1	64	38
COCCN(Cc1ccc(F)c(Cl)c1)c1nc(C)nc2c1cnn2C	ZINC000450924630	FG	On-Demand	Anodyne	CRHR1	21	45
COCCN(Cc1ccc(F)c(Cl)c1)c1nc(C)nc2c1cnn2C	ZINC000450924630	FG	On-Demand	Anodyne	Q9M629_MAIZE	48	35
CC(C)CCCC(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	ZINC000450924633	FH	On-Demand	Anodyne	LTA4H	0	41
COc1ccc(Nc2nc(N[C@@H]3C[C@H](O)C3)cc(N[C@@H]3C[C@H](O)C3)n2)cc1	ZINC000450924638	FD	On-Demand	Anodyne	GALR2	66	48
COC(=O)[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450924641	DF	On-Demand	Anodyne	DRD2	31	44
COC(=O)[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450924641	DF	On-Demand	Anodyne	DRD1	0	45
COC(=O)[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450924641	DF	On-Demand	Anodyne	DRD4	0	47
COC(=O)[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450924641	DF	On-Demand	Anodyne	SLC18A3	0	48
COC(=O)[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450924641	DF	On-Demand	Anodyne	CYP2J2	52	37
COC(=O)[C@]1(C)CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C	ZINC000450924641	DF	On-Demand	Anodyne	AP2S1	0	44
CCOC(=O)CN(C(=O)c1coc2c1C(=O)CCC2)C1CCC1	ZINC000450924647	DE	On-Demand	Anodyne	ACE	33	50
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450924653	DD	On-Demand	Anodyne	SDH1	0	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450924653	DD	On-Demand	Anodyne	ACACB	36	43
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450924654	DD	On-Demand	Anodyne	SDH1	0	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450924654	DD	On-Demand	Anodyne	ACACB	36	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450924655	DD	On-Demand	Anodyne	SDH1	0	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@H](O)C2CCC2)cc1	ZINC000450924655	DD	On-Demand	Anodyne	ACACB	36	43
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450924656	DD	On-Demand	Anodyne	SDH1	0	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@H](O)C2CCC2)cc1	ZINC000450924656	DD	On-Demand	Anodyne	ACACB	36	43
CCOC(=O)CN(C(=O)c1c[nH]c2nccc-2c1)C1CCC1	ZINC000450924657	DE	On-Demand	Anodyne	ACE	45	42
CC(=O)CCCCCSc1nc(-c2ccccc2)co1	ZINC000450924668	CJ	On-Demand	Anodyne	CES1	41	36
CC(=O)CCCCCSc1nc(-c2ccccc2)co1	ZINC000450924668	CJ	On-Demand	Anodyne	HDA106	0	42
CC(=O)CCCCCSc1nc(-c2ccccc2)co1	ZINC000450924668	CJ	On-Demand	Anodyne	HD1B	0	42
CCOC(=O)CN(C(=O)c1cc(C)c(C(N)=O)cn1)C1CCC1	ZINC000450924671	DD	On-Demand	Anodyne	ACE	56	47
CC1(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)CCC(=O)CC1	ZINC000450924680	EG	On-Demand	Anodyne	MDM2	41	32
CC1(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)CCC(=O)CC1	ZINC000450924681	EG	On-Demand	Anodyne	MDM2	41	32
CCN1CCN(CC(C)(C)Nc2ncnc3sc4c(c23)CCC4)CC1	ZINC000450924685	FG	On-Demand	Anodyne	RBP4	16	41
CCOC(=O)CN(C(=O)c1ccc(-c2ccncc2)c(F)c1)C1CCC1	ZINC000450924688	FG	On-Demand	Anodyne	ACE	51	43
CC(C)NS(=O)(=O)N1CCN(Cc2ccccc2Oc2cccnc2)CC1	ZINC000450924691	GE	On-Demand	Anodyne	CCR8	20	41
CCC(=O)CCCN(C)CC(=O)N(C)[C@@H](C)c1ccccc1	ZINC000450924693	DF	On-Demand	Anodyne	SLC6A9	0	42
CCC(=O)CCCN(C)CC(=O)N(C)[C@H](C)c1ccccc1	ZINC000450924695	DF	On-Demand	Anodyne	SLC6A9	0	42
NC(=O)c1ncc(Br)cc1N[C@@H]1C[C@H](O)C1	ZINC000450924697	CC	On-Demand	Anodyne	SYK	45	33
COc1ccc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ncnc2c1F	ZINC000450924701	EE	On-Demand	Anodyne	PDE3A	45	35
COc1ccc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ncnc2c1F	ZINC000450924701	EE	On-Demand	Anodyne	PDE3B	67	35
COc1ccc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ncnc2c1F	ZINC000450924703	EE	On-Demand	Anodyne	PDE3A	45	35
COc1ccc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ncnc2c1F	ZINC000450924703	EE	On-Demand	Anodyne	PDE3B	67	35
Cc1sc2ncnc(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1C	ZINC000450924717	CE	On-Demand	Anodyne	IRAK4	17	44
Cc1sc2ncnc(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1C	ZINC000450924717	CE	On-Demand	Anodyne	CD38	15	42
NC(=O)[C@@H]1CC[C@H](Nc2cc(C(F)(F)F)ccn2)C1	ZINC000450924718	CE	On-Demand	Anodyne	PRKD1	44	38
Cc1nc2ccccc2c(N2CCC[C@H](NC(=O)N(C)C)C2)c1C	ZINC000450924738	EG	On-Demand	Anodyne	FAP	0	40
Cc1nc2ccccc2c(N2CCC[C@@H](NC(=O)N(C)C)C2)c1C	ZINC000450924739	EG	On-Demand	Anodyne	FAP	0	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450924747	FD	On-Demand	Bother	L3MBTL1	0	44
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450924747	FD	On-Demand	Bother	L3MBTL3	36	44
COc1cc(Br)ccc1CCCN1CCC(O)(C(N)=O)CC1	ZINC000450924748	FD	On-Demand	Anodyne	HTR1A	20	40
COc1cc(Br)ccc1CCCN1CCC(O)(C(N)=O)CC1	ZINC000450924748	FD	On-Demand	Anodyne	DRD2	19	40
COc1cccc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)nccc12	ZINC000450924750	EE	On-Demand	Anodyne	PDE3B	54	34
COc1cccc2c(N3CCC[C@H](NC(=O)N(C)C)C3)nccc12	ZINC000450924751	EE	On-Demand	Anodyne	PDE3B	54	34
CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CCC(O)(C(N)=O)CC1	ZINC000450924777	ED	On-Demand	Anodyne	SLC12A5	41	32
CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CCC(O)(C(N)=O)CC1	ZINC000450924778	ED	On-Demand	Anodyne	SLC12A5	41	32
Cc1cccc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc12	ZINC000450924781	CE	On-Demand	Anodyne	CD38	21	45
CC(C)c1noc(-c2ccnc(N[C@@H]3CC[C@H](C(N)=O)C3)c2)n1	ZINC000450924785	DE	On-Demand	Anodyne	PRKD1	63	36
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])C1	ZINC000450924792	GD	On-Demand	Bother	EPHX2	16	45
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3cc(Cl)ccc23)C1	ZINC000450924793	CE	On-Demand	Anodyne	CD38	44	52
NC(=O)C1(O)CCN(Cc2csc(Cc3ccccc3)n2)CC1	ZINC000450924797	ED	On-Demand	Anodyne	NPFFR1	57	35
CN(CCN1CCC[C@H](S(C)(=O)=O)CC1)Cc1ccccc1	ZINC000450924812	DE	On-Demand	Anodyne	SIGMAR1	31	44
CN(CCN1CCC[C@@H](S(C)(=O)=O)CC1)Cc1ccccc1	ZINC000450924813	DE	On-Demand	Anodyne	SIGMAR1	31	44
CCOC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2cccc(OC)c2)nc1	ZINC000450924833	FF	On-Demand	Anodyne	P2RY12	19	42
CCOC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2cccc(OC)c2)nc1	ZINC000450924834	FF	On-Demand	Anodyne	P2RY12	19	42
CCOC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2cccc(OC)c2)nc1	ZINC000450924835	FF	On-Demand	Anodyne	P2RY12	19	42
CCOC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2cccc(OC)c2)nc1	ZINC000450924836	FF	On-Demand	Anodyne	P2RY12	19	42
CS(=O)(=O)[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450924841	CE	On-Demand	Anodyne	SLC6A1	46	34
CS(=O)(=O)[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450924842	CE	On-Demand	Anodyne	SLC6A1	46	34
CS(=O)(=O)[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450924843	CE	On-Demand	Anodyne	SLC6A1	46	34
CS(=O)(=O)[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450924844	CE	On-Demand	Anodyne	SLC6A1	46	34
O=C1CCC(CN2CCC(c3ccc(Br)cc3)CC2)CC1	ZINC000450924870	FI	On-Demand	Anodyne	VACHT_TETCF	0	41
CS(=O)(=O)[C@H]1CCCN(CC/C=C/c2ccccc2)CC1	ZINC000450924871	DF	On-Demand	Anodyne	SLC6A1	63	36
CS(=O)(=O)[C@@H]1CCCN(CC/C=C/c2ccccc2)CC1	ZINC000450924872	DF	On-Demand	Anodyne	SLC6A1	63	36
CS(=O)(=O)[C@@H]1CCCN(CC/C=C\c2ccccc2)CC1	ZINC000450924873	DF	On-Demand	Anodyne	SLC6A1	63	36
CS(=O)(=O)[C@H]1CCCN(CC/C=C\c2ccccc2)CC1	ZINC000450924874	DF	On-Demand	Anodyne	SLC6A1	63	36
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924898	FI	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924898	FI	On-Demand	Anodyne	HTR2A	26	48
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924898	FI	On-Demand	Anodyne	HTR2C	16	50
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924898	FI	On-Demand	Anodyne	SLC6A1	104	37
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924898	FI	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924898	FI	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924898	FI	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924899	FI	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924899	FI	On-Demand	Anodyne	HTR2A	26	48
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924899	FI	On-Demand	Anodyne	HTR2C	16	50
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924899	FI	On-Demand	Anodyne	SLC6A1	104	37
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924899	FI	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924899	FI	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccc(F)cc1	ZINC000450924899	FI	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)[C@]1(C)CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H]1C	ZINC000450924906	GD	On-Demand	Anodyne	MTNR1A	47	38
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@@H](NC(=O)N(C)C)C1	ZINC000450924912	GC	On-Demand	Anodyne	CA7	25	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CCC[C@H](NC(=O)N(C)C)C1	ZINC000450924913	GC	On-Demand	Anodyne	CA7	25	40
C[C@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)CC(=O)N1C	ZINC000450924920	CD	On-Demand	Anodyne	HSD17B2	58	37
C[C@H]1CN(C[C@@H](O)[C@H](C)c2ccccc2)CC(=O)N1C	ZINC000450924921	CD	On-Demand	Anodyne	HSD17B2	58	37
C[C@H](c1ccccc1)[C@@H](O)CN1CC(=O)N(C)[C@H](C)C1	ZINC000450924922	CD	On-Demand	Anodyne	HSD17B2	58	37
C[C@H](c1ccccc1)[C@H](O)CN1CC(=O)N(C)[C@H](C)C1	ZINC000450924923	CD	On-Demand	Anodyne	HSD17B2	58	37
CCCOc1ccc(C(=O)N(CC(=O)OCC)C2CCC2)c(OC)c1	ZINC000450924943	EG	On-Demand	Anodyne	ACE	55	47
CCOC(=O)CN(C(=O)c1ccc(NC(=O)C(C)(C)C)nc1)C1CCC1	ZINC000450924944	FF	On-Demand	Anodyne	ACE	44	41
O=C(COc1ccccc1NC(=O)CC1(O)CCC1)Nc1cccnc1	ZINC000450924945	FE	On-Demand	Anodyne	NAMPT	17	41
CCC[C@@H](NC(=O)CN1CCN(S(=O)(=O)NC(C)C)CC1)c1ccccc1	ZINC000450924947	GD	On-Demand	Anodyne	CCR5	40	39
CCC[C@H](NC(=O)CN1CCN(S(=O)(=O)NC(C)C)CC1)c1ccccc1	ZINC000450924948	GD	On-Demand	Anodyne	CCR5	40	39
CNC(=O)c1ccc(N2CCC[C@@H](NC(=O)N(C)C)C2)c([N+](=O)[O-])c1	ZINC000450924952	ED	On-Demand	Bother	TAAR1	15	44
CNC(=O)c1ccc(N2CCC[C@H](NC(=O)N(C)C)C2)c([N+](=O)[O-])c1	ZINC000450924953	ED	On-Demand	Bother	TAAR1	15	44
C[C@H](O)CNC(=O)c1ccc(OCc2ccn(CCc3ccccc3)n2)cc1	ZINC000450924957	GF	On-Demand	Anodyne	CYSLTR1	33	41
CCN1CCN(CC(C)(C)Nc2ncnc3cc(F)c(F)cc23)CC1	ZINC000450924958	EF	On-Demand	Anodyne	HTT	0	41
CC(C)NS(=O)(=O)N1CCN(Cc2nc(-c3cccc(Cl)c3)no2)CC1	ZINC000450924974	GD	On-Demand	Anodyne	GRM5	25	48
Cc1cc(C#N)cc(N2CCC[C@@H](NC(=O)N(C)C)C2)n1	ZINC000450924982	CD	On-Demand	Mild	ERG	0	40
Cc1cc(C#N)cc(N2CCC[C@H](NC(=O)N(C)C)C2)n1	ZINC000450924983	CD	On-Demand	Mild	ERG	0	40
CN(C)C(=O)N[C@H]1CCCN(c2ncccc2C(=O)N2CCc3ccccc32)C1	ZINC000450925002	GF	On-Demand	Anodyne	AVPR2	63	40
CN(C)C(=O)N[C@@H]1CCCN(c2ncccc2C(=O)N2CCc3ccccc32)C1	ZINC000450925004	GF	On-Demand	Anodyne	AVPR2	63	40
COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(C)nc2C(C)C)cc1	ZINC000450925006	FH	On-Demand	Anodyne	ACACA	52	38
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450925007	ED	On-Demand	Anodyne	SLC6A9	31	49
CN(C)C(=O)N[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450925007	ED	On-Demand	Anodyne	GPR119	32	41
COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(C)nc2C(C)C)cc1	ZINC000450925008	FH	On-Demand	Anodyne	ACACA	52	38
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450925009	ED	On-Demand	Anodyne	SLC6A9	31	49
CN(C)C(=O)N[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450925009	ED	On-Demand	Anodyne	GPR119	32	41
CC(C)NS(=O)(=O)N1CCN(Cc2cncn2Cc2ccccc2)CC1	ZINC000450925014	GD	On-Demand	Anodyne	CYP11B2	0	45
CCOC(=O)CN(C(=O)c1ccc(C(F)(F)F)cc1C)C1CCC1	ZINC000450925016	EH	On-Demand	Anodyne	ACE	61	51
CCOC(=O)CN(C(=O)c1ccc(C(F)(F)F)cc1C)C1CCC1	ZINC000450925016	EH	On-Demand	Anodyne	LIPG	52	38
COC(=O)[C@@H](NC(=O)c1cn(CC2CC2)nn1)c1ccc(F)c(C)c1	ZINC000450925043	ED	On-Demand	Anodyne	LEF	46	37
COC(=O)[C@H](NC(=O)c1cn(CC2CC2)nn1)c1ccc(F)c(C)c1	ZINC000450925044	ED	On-Demand	Anodyne	LEF	46	37
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)NCC3CC3)cn2)C1	ZINC000450925060	EC	On-Demand	Anodyne	NPY2R	65	38
NC(=O)C1(O)CCN(CC(=O)Nc2ncc(Cc3ccc(F)cc3)s2)CC1	ZINC000450925064	GD	On-Demand	Anodyne	MGEA5	31	40
NC(=O)C1(O)CCN(CC(=O)Nc2ncc(Cc3ccc(F)cc3)s2)CC1	ZINC000450925064	GD	On-Demand	Anodyne	SLC27A1	50	43
Cc1cc(N(C)CCOc2ccc(S(N)(=O)=O)cc2F)n2ncnc2n1	ZINC000450925078	GC	On-Demand	Anodyne	DHOD	0	41
COc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925085	GD	On-Demand	Anodyne	KCNQ1	0	46
COc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925085	GD	On-Demand	Anodyne	ACOX1	44	32
COc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925085	GD	On-Demand	Anodyne	ROCK1	21	43
COc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925085	GD	On-Demand	Anodyne	SPHK2	16	40
COc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925085	GD	On-Demand	Anodyne	ROCK2	15	43
COc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925085	GD	On-Demand	Anodyne	HDAC9	15	42
COc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925085	GD	On-Demand	Anodyne	SPHK1	20	40
COc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925085	GD	On-Demand	Anodyne	TRPA1	20	43
CCn1c2ccccc2c2cc(NC(=O)CN3CCC(O)(C(N)=O)CC3)ccc21	ZINC000450925091	GE	On-Demand	Anodyne	DRD4	0	40
CCn1c2ccccc2c2cc(NC(=O)CN3CCC(O)(C(N)=O)CC3)ccc21	ZINC000450925091	GE	On-Demand	Anodyne	NPY2R	29	60
CCn1c2ccccc2c2cc(NC(=O)CN3CCC(O)(C(N)=O)CC3)ccc21	ZINC000450925091	GE	On-Demand	Anodyne	ACOX1	22	49
CCn1c2ccccc2c2cc(NC(=O)CN3CCC(O)(C(N)=O)CC3)ccc21	ZINC000450925091	GE	On-Demand	Anodyne	NPY5R	26	60
CCn1c2ccccc2c2cc(NC(=O)CN3CCC(O)(C(N)=O)CC3)ccc21	ZINC000450925091	GE	On-Demand	Anodyne	MCHR2	61	42
CCn1c2ccccc2c2cc(NC(=O)CN3CCC(O)(C(N)=O)CC3)ccc21	ZINC000450925091	GE	On-Demand	Anodyne	IMDH_CRYPV	40	33
N#Cc1ccc(N[C@H]2CC[C@@H](C(N)=O)C2)nc1N[C@@H]1CC[C@H](C(N)=O)C1	ZINC000450925096	FC	On-Demand	Mild	CSNK2A1	41	32
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1ncccc1OC	ZINC000450925107	EF	On-Demand	Bother	CACNA1D	85	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@H]2CCC(=O)c3cccc1c32	ZINC000450925122	FJ	On-Demand	Anodyne	CACNA1B	44	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@H]2CCC(=O)c3cccc1c32	ZINC000450925122	FJ	On-Demand	Anodyne	LIPG	49	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H]2CCC(=O)c3cccc1c32	ZINC000450925123	FJ	On-Demand	Anodyne	CACNA1B	44	33
Cc1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H]2CCC(=O)c3cccc1c32	ZINC000450925123	FJ	On-Demand	Anodyne	LIPG	49	34
CCc1cc(N[C@@H]2C[C@H](O)C2)n2ncnc2n1	ZINC000450925130	BC	On-Demand	Anodyne	DHOD	0	50
COc1cccnc1CNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450925138	FD	On-Demand	Bother	BDKRB1	0	46
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	ADORA1	123	72
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	SLC29A1	110	56
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	ADORA2A	56	68
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	ADORA2B	24	61
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	GAPC	0	43
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	ADK	63	56
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	P2RX5	0	40
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	AK3	0	41
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	AHCY	49	39
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	P2RX4	35	41
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	P2RX1	46	40
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	P2RX6	0	40
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	P2RY1	32	41
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	P2RY11	0	41
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	AMD1	24	40
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	ITPR1	53	38
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	P2RY2	19	41
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	AK2	0	41
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	NS5B	0	46
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	ADORA3	114	67
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	OXGR1	114	43
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	MTAP	0	42
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	AK	0	48
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	RNASE1	44	35
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	MBTA	0	45
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	DNMT3B	74	44
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	NADK	0	40
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	Q4VQ11_PIG	91	67
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	GPR17	57	47
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	SAE1	0	44
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	DOT1L	80	43
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	NAE1	0	44
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	UBA6	0	44
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4C[C@H]4C4CC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000450925143	FB	On-Demand	Anodyne	UBA7	0	44
N#Cc1cnc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450925144	CE	On-Demand	Mild	PRKCQ	44	34
OCc1nnc(SC[C@H]2CCCC2(F)F)n1-c1ccccc1	ZINC000450925148	EG	On-Demand	Anodyne	VCP	32	40
OCc1nnc(SC[C@@H]2CCCC2(F)F)n1-c1ccccc1	ZINC000450925149	EG	On-Demand	Anodyne	VCP	32	40
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccccc1	ZINC000450925157	FI	On-Demand	Anodyne	HTR2A	16	40
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccccc1	ZINC000450925157	FI	On-Demand	Anodyne	HTR2C	16	44
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccccc1	ZINC000450925157	FI	On-Demand	Anodyne	SLC6A1	155	43
O=C(CCCN1CCC[C@H](c2ncc3n2CCCC3)C1)c1ccccc1	ZINC000450925157	FI	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccccc1	ZINC000450925158	FI	On-Demand	Anodyne	HTR2A	16	40
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccccc1	ZINC000450925158	FI	On-Demand	Anodyne	HTR2C	16	44
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccccc1	ZINC000450925158	FI	On-Demand	Anodyne	SLC6A1	155	43
O=C(CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1)c1ccccc1	ZINC000450925158	FI	On-Demand	Anodyne	CYP2J2	56	39
O[C@H]1C[C@@H](Nc2ncnc3cc(F)c(F)cc23)C1	ZINC000450925194	CD	On-Demand	Anodyne	CD38	48	42
COc1cc(OCC2(C#N)CCC2)ccc1C#N	ZINC000450925203	BF	On-Demand	Mild	TRPV4	41	31
C[C@H](O)CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450925212	GI	On-Demand	Anodyne	SLC6A5	38	43
C[C@H](O)CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450925212	GI	On-Demand	Anodyne	ADAMTS4	40	38
C[C@H](O)CNC(=O)c1ccc(OCc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450925212	GI	On-Demand	Anodyne	FFAR1	34	43
C[C@H](O)CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450925213	GI	On-Demand	Anodyne	SLC6A5	38	43
C[C@H](O)CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450925213	GI	On-Demand	Anodyne	ADAMTS4	40	38
C[C@H](O)CNC(=O)c1ccc(OCc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450925213	GI	On-Demand	Anodyne	FFAR1	34	43
COc1cccc(OCCC(=O)N[C@H]2CCCc3sccc32)c1	ZINC000450925216	EH	On-Demand	Anodyne	MTNR1A	29	41
COc1cccc(OCCC(=O)N[C@H]2CCCc3sccc32)c1	ZINC000450925216	EH	On-Demand	Anodyne	MTNR1B	32	41
COc1cccc(OCCC(=O)N[C@@H]2CCCc3sccc32)c1	ZINC000450925217	EH	On-Demand	Anodyne	MTNR1A	29	41
COc1cccc(OCCC(=O)N[C@@H]2CCCc3sccc32)c1	ZINC000450925217	EH	On-Demand	Anodyne	MTNR1B	32	41
CCOC(=O)CN(C(=O)c1ccnn1CC(F)(F)F)C1CCC1	ZINC000450925233	EE	On-Demand	Anodyne	ACE	35	42
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	ESR1	47	36
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	LTA4H	53	49
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	THRB	0	40
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	HRH3	51	42
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	MMP13	27	40
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	MMP3	15	40
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	PSMB2	55	42
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	PSMB5	19	48
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	PSMB1	48	48
CCCOc1ccc(OCCN2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000450925234	GD	On-Demand	Anodyne	NORA	0	40
CCOC(=O)CN(C(=O)c1nn(C)c2c1CCCC2)C1CCC1	ZINC000450925242	DD	On-Demand	Anodyne	ACE	18	40
COc1cc(OCCC[C@H](C)O)ccc1C#N	ZINC000450925243	BE	On-Demand	Mild	EDNRA	0	44
COc1cc(OCCC[C@@H](C)O)ccc1C#N	ZINC000450925244	BE	On-Demand	Mild	EDNRA	0	44
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450925245	FG	On-Demand	Anodyne	SLC6A7	0	41
O=C(c1ccc(N2CCC2)nc1)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450925246	FG	On-Demand	Anodyne	SLC6A7	0	41
CC[C@H](O)CC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450925251	CE	On-Demand	Anodyne	MDM2	54	34
CC[C@@H](O)CC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1	ZINC000450925252	CE	On-Demand	Anodyne	MDM2	54	34
CC[C@H](O)CC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450925253	CE	On-Demand	Anodyne	MDM2	54	34
CC[C@@H](O)CC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1	ZINC000450925254	CE	On-Demand	Anodyne	MDM2	54	34
CC(C)NS(=O)(=O)N1CCN([C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)CC1	ZINC000450925255	GD	On-Demand	Anodyne	ACE	15	40
CC(C)NS(=O)(=O)N1CCN([C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)CC1	ZINC000450925255	GD	On-Demand	Anodyne	TPP2	54	36
CC(C)NS(=O)(=O)N1CCN([C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)CC1	ZINC000450925256	GD	On-Demand	Anodyne	ACE	15	40
CC(C)NS(=O)(=O)N1CCN([C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)CC1	ZINC000450925256	GD	On-Demand	Anodyne	TPP2	54	36
CC(C)NS(=O)(=O)N1CCN([C@H](C)C(=O)N2c3ccccc3C[C@H]2C)CC1	ZINC000450925257	GD	On-Demand	Anodyne	ACE	15	40
CC(C)NS(=O)(=O)N1CCN([C@H](C)C(=O)N2c3ccccc3C[C@H]2C)CC1	ZINC000450925257	GD	On-Demand	Anodyne	TPP2	54	36
CC(C)NS(=O)(=O)N1CCN([C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)CC1	ZINC000450925258	GD	On-Demand	Anodyne	ACE	15	40
CC(C)NS(=O)(=O)N1CCN([C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)CC1	ZINC000450925258	GD	On-Demand	Anodyne	TPP2	54	36
CCOC(=O)CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000450925266	FF	On-Demand	Bother	CACNA1C	62	42
CCOC(=O)CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000450925266	FF	On-Demand	Bother	IRAK4	23	42
CCOC(=O)CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000450925266	FF	On-Demand	Bother	SLC27A4	48	31
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	HTR2A	17	44
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	PTGER3	25	40
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	COLA	45	34
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	KDR	18	44
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	F7	29	41
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	PDGFRA	25	44
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	ENPP1	82	42
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	PSBA	0	42
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	KCNK3	52	38
COc1cc(NC(=O)CNC(=O)Nc2cccc(Cl)c2)ccc1OC(C)C	ZINC000450925267	GH	On-Demand	Anodyne	KCNK9	48	38
CN(C)C(=O)N[C@@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1	ZINC000450925269	DE	On-Demand	Anodyne	CCR2	39	45
CN(C)C(=O)N[C@@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1	ZINC000450925269	DE	On-Demand	Anodyne	LIPG	45	33
CN(C)C(=O)N[C@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1	ZINC000450925270	DE	On-Demand	Anodyne	CCR2	39	45
CN(C)C(=O)N[C@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1	ZINC000450925270	DE	On-Demand	Anodyne	LIPG	45	33
COc1ccccc1[C@@H]1CN(CCC[C@H](C)O)CCN1CCC[C@H](C)O	ZINC000450925273	FF	On-Demand	Anodyne	DRD2	33	41
COc1ccccc1[C@@H]1CN(CCC[C@H](C)O)CCN1CCC[C@H](C)O	ZINC000450925273	FF	On-Demand	Anodyne	HTR2A	22	40
COc1ccccc1[C@@H]1CN(CCC[C@@H](C)O)CCN1CCC[C@@H](C)O	ZINC000450925274	FF	On-Demand	Anodyne	DRD2	33	41
COc1ccccc1[C@@H]1CN(CCC[C@@H](C)O)CCN1CCC[C@@H](C)O	ZINC000450925274	FF	On-Demand	Anodyne	HTR2A	22	40
COc1ccccc1[C@@H]1CN(CCC[C@@H](C)O)CCN1CCC[C@H](C)O	ZINC000450925275	FF	On-Demand	Anodyne	DRD2	33	41
COc1ccccc1[C@@H]1CN(CCC[C@@H](C)O)CCN1CCC[C@H](C)O	ZINC000450925275	FF	On-Demand	Anodyne	HTR2A	22	40
COc1ccccc1[C@@H]1CN(CCC[C@H](C)O)CCN1CCC[C@@H](C)O	ZINC000450925276	FF	On-Demand	Anodyne	DRD2	33	41
COc1ccccc1[C@@H]1CN(CCC[C@H](C)O)CCN1CCC[C@@H](C)O	ZINC000450925276	FF	On-Demand	Anodyne	HTR2A	22	40
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925285	GF	On-Demand	Anodyne	AVPR2	24	42
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925285	GF	On-Demand	Anodyne	PRNP	51	38
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925285	GF	On-Demand	Anodyne	HDAC1	30	43
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925285	GF	On-Demand	Anodyne	P4HTM	0	47
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925285	GF	On-Demand	Anodyne	MCHR1	17	52
Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925285	GF	On-Demand	Anodyne	HPGDS	24	42
CC(C)NS(=O)(=O)N1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)CC1	ZINC000450925286	GF	On-Demand	Anodyne	ADORA2B	43	36
CC(C)NS(=O)(=O)N1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CC1	ZINC000450925287	GF	On-Demand	Anodyne	ADORA2B	43	36
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925293	GF	On-Demand	Anodyne	AVPR2	24	42
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925293	GF	On-Demand	Anodyne	PRNP	51	38
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925293	GF	On-Demand	Anodyne	HDAC1	30	43
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925293	GF	On-Demand	Anodyne	P4HTM	0	47
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925293	GF	On-Demand	Anodyne	MCHR1	17	52
Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](NC(=O)N(C)C)C3)nc2)cc1	ZINC000450925293	GF	On-Demand	Anodyne	HPGDS	24	42
COc1cc(CN2CCN(S(=O)(=O)NC(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000450925294	FC	On-Demand	Bother	AVPR1B	40	33
CCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450925298	FI	On-Demand	Anodyne	PRNP	62	41
CCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450925298	FI	On-Demand	Anodyne	P4HTM	0	44
CCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450925298	FI	On-Demand	Anodyne	MCHR1	19	40
CCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450925298	FI	On-Demand	Anodyne	TAAR1	31	40
CCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450925298	FI	On-Demand	Anodyne	DGAT1	43	41
CCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450925298	FI	On-Demand	Anodyne	HPGDS	19	43
CCOc1c(Cl)cc(NC(=O)c2ccc(N3CCC3)nc2)cc1Cl	ZINC000450925298	FI	On-Demand	Anodyne	NOD2	41	40
COc1cccc(OCCC(=O)N[C@@H](C)CC(F)(F)F)c1	ZINC000450925301	DF	On-Demand	Anodyne	MTNR1A	40	44
COc1cccc(OCCC(=O)N[C@@H](C)CC(F)(F)F)c1	ZINC000450925301	DF	On-Demand	Anodyne	MTNR1B	40	44
COc1cccc(OCCC(=O)N[C@@H](C)CC(F)(F)F)c1	ZINC000450925301	DF	On-Demand	Anodyne	PDS	44	35
COc1cccc(OCCC(=O)N[C@H](C)CC(F)(F)F)c1	ZINC000450925303	DF	On-Demand	Anodyne	MTNR1A	40	44
COc1cccc(OCCC(=O)N[C@H](C)CC(F)(F)F)c1	ZINC000450925303	DF	On-Demand	Anodyne	MTNR1B	40	44
COc1cccc(OCCC(=O)N[C@H](C)CC(F)(F)F)c1	ZINC000450925303	DF	On-Demand	Anodyne	PDS	44	35
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3[nH]ccc23)C1	ZINC000450925312	BD	On-Demand	Anodyne	JAK2	41	48
COC(=O)[C@@H](c1ccccc1Cl)N1CCC(O)(C(N)=O)CC1	ZINC000450925315	EC	On-Demand	Anodyne	OPRM1	23	45
COC(=O)[C@@H](c1ccccc1Cl)N1CCC(O)(C(N)=O)CC1	ZINC000450925315	EC	On-Demand	Anodyne	OPRL1	45	45
COC(=O)[C@H](c1ccccc1Cl)N1CCC(O)(C(N)=O)CC1	ZINC000450925316	EC	On-Demand	Anodyne	OPRM1	23	45
COC(=O)[C@H](c1ccccc1Cl)N1CCC(O)(C(N)=O)CC1	ZINC000450925316	EC	On-Demand	Anodyne	OPRL1	45	45
CC[C@@H](O)CC(=O)NCc1cc2cc(Br)ccc2[nH]1	ZINC000450925326	EF	On-Demand	Anodyne	PYK	45	38
CC[C@H](O)CC(=O)NCc1cc2cc(Br)ccc2[nH]1	ZINC000450925327	EF	On-Demand	Anodyne	PYK	45	38
Cc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(C(C)C)n1	ZINC000450925330	EI	On-Demand	Bother	P2RX7	42	38
Cc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925333	FD	On-Demand	Anodyne	KCNQ1	0	40
Cc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925333	FD	On-Demand	Anodyne	ROCK1	20	40
Cc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925333	FD	On-Demand	Anodyne	TRPA1	0	42
Cc1ccc(-c2csc(NC(=O)CN3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925333	FD	On-Demand	Anodyne	SLC27A1	35	42
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3sccc23)C1	ZINC000450925348	CD	On-Demand	Anodyne	CD38	48	53
COC(=O)[C@H](NC(=O)Cc1cc(C)ccc1F)c1ccc(F)c(C)c1	ZINC000450925371	EG	On-Demand	Anodyne	LEF	59	38
COC(=O)[C@@H](NC(=O)Cc1cc(C)ccc1F)c1ccc(F)c(C)c1	ZINC000450925372	EG	On-Demand	Anodyne	LEF	59	38
NC(=O)C1(O)CCN(Cc2cc(Cl)ccc2OCC2CC2)CC1	ZINC000450925373	ED	On-Demand	Anodyne	PTGER1	31	45
COC(=O)[C@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(F)c(C)c1	ZINC000450925374	DD	On-Demand	Anodyne	P2RX7	22	42
COC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(F)c(C)c1	ZINC000450925375	DD	On-Demand	Anodyne	P2RX7	22	42
COC(=O)[C@@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc(F)c(C)c1	ZINC000450925376	DD	On-Demand	Anodyne	P2RX7	22	42
COC(=O)[C@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc(F)c(C)c1	ZINC000450925377	DD	On-Demand	Anodyne	P2RX7	22	42
NC(=O)[C@H]1CC[C@@H](Nc2nc(N[C@H]3CC[C@@H](C(N)=O)C3)ncc2Cl)C1	ZINC000450925378	FC	On-Demand	Anodyne	AURKB	15	47
NC(=O)[C@H]1CC[C@@H](Nc2nc(N[C@H]3CC[C@@H](C(N)=O)C3)ncc2Cl)C1	ZINC000450925378	FC	On-Demand	Anodyne	MAPK9	40	33
NC(=O)[C@H]1CC[C@@H](Nc2nc(N[C@H]3CC[C@@H](C(N)=O)C3)ncc2Cl)C1	ZINC000450925378	FC	On-Demand	Anodyne	MAPK10	42	33
NC(=O)[C@H]1CC[C@@H](Nc2nc(N[C@H]3CC[C@@H](C(N)=O)C3)ncc2Cl)C1	ZINC000450925378	FC	On-Demand	Anodyne	TYRO3	45	34
NC(=O)[C@H]1CC[C@@H](Nc2nc(N[C@H]3CC[C@@H](C(N)=O)C3)ncc2Cl)C1	ZINC000450925378	FC	On-Demand	Anodyne	MERTK	47	37
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450925379	FH	On-Demand	Anodyne	ADRB3	22	53
NC(=O)C1(O)CCN(Cc2ccccc2OCC(F)(F)F)CC1	ZINC000450925385	ED	On-Demand	Anodyne	CCR8	32	45
N#Cc1cc(C(F)(F)F)ccc1N[C@H]1CC[C@@H](C(N)=O)C1	ZINC000450925392	CF	On-Demand	Mild	DHODH	47	40
CC1(C(=O)N2CCC[C@@H](Cc3csc4ccccc34)C2)CCC(=O)CC1	ZINC000450925393	FJ	On-Demand	Anodyne	FFAR2	66	35
CC1(C(=O)N2CCC[C@H](Cc3csc4ccccc34)C2)CCC(=O)CC1	ZINC000450925394	FJ	On-Demand	Anodyne	FFAR2	66	35
Oc1nnc(C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)o1	ZINC000450925407	FE	On-Demand	Anodyne	HTR1A	66	50
Oc1nnc(C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)o1	ZINC000450925407	FE	On-Demand	Anodyne	DRD2	42	50
Oc1nnc(C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)o1	ZINC000450925407	FE	On-Demand	Anodyne	DRD4	40	44
Oc1nnc(C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)o1	ZINC000450925407	FE	On-Demand	Anodyne	HTR2A	46	50
Oc1nnc(C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)o1	ZINC000450925407	FE	On-Demand	Anodyne	DRD3	43	44
Oc1nnc(C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)o1	ZINC000450925407	FE	On-Demand	Anodyne	HTR7	79	45
Oc1nnc(C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)o1	ZINC000450925407	FE	On-Demand	Anodyne	SIGMAR1	22	46
Oc1nnc(C2CCN(CCCN3CCN(c4ccccc4)CC3)CC2)o1	ZINC000450925407	FE	On-Demand	Anodyne	CYP2J2	43	30
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@]2(C)CC=CCC2)cc1	ZINC000450925419	EG	On-Demand	Anodyne	SDH1	0	42
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@]2(C)CC=CCC2)cc1	ZINC000450925419	EG	On-Demand	Anodyne	ACACA	53	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@]2(C)CC=CCC2)cc1	ZINC000450925419	EG	On-Demand	Anodyne	ACACB	28	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C)CC=CCC2)cc1	ZINC000450925420	EG	On-Demand	Anodyne	SDH1	0	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C)CC=CCC2)cc1	ZINC000450925420	EG	On-Demand	Anodyne	ACACA	53	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@]2(C)CC=CCC2)cc1	ZINC000450925420	EG	On-Demand	Anodyne	ACACB	28	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000450925421	EG	On-Demand	Anodyne	SDH1	0	42
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000450925421	EG	On-Demand	Anodyne	ACACA	53	40
COC(=O)COc1ccc([C@@H](C)NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000450925421	EG	On-Demand	Anodyne	ACACB	28	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000450925423	EG	On-Demand	Anodyne	SDH1	0	42
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000450925423	EG	On-Demand	Anodyne	ACACA	53	40
COC(=O)COc1ccc([C@H](C)NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000450925423	EG	On-Demand	Anodyne	ACACB	28	40
COc1cc(NC(=O)Cc2sccc2Br)ccc1OC(C)C	ZINC000450925424	GI	On-Demand	Anodyne	ENPP1	78	39
CN(C)C(=O)N[C@H]1CCCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450925425	EE	On-Demand	Anodyne	SORD	44	37
CN(C)C(=O)N[C@H]1CCCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450925425	EE	On-Demand	Anodyne	BIRC2	52	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450925426	EE	On-Demand	Anodyne	SORD	44	37
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450925426	EE	On-Demand	Anodyne	BIRC2	52	40
CN(C)C(=O)N[C@@H]1CCCN(c2cncc(Br)c2)C1	ZINC000450925438	EE	On-Demand	Anodyne	CHRNA3	25	44
CN(C)C(=O)N[C@H]1CCCN(c2cncc(Br)c2)C1	ZINC000450925440	EE	On-Demand	Anodyne	CHRNA3	25	44
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	HTR1A	23	68
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	DRD2	39	66
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	DRD1	26	55
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	DRD4	31	53
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	ADRA1D	16	41
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	HTR2A	51	69
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	HTR2C	30	68
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	ADRA1A	15	41
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	HRH1	17	55
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	ADRA1B	18	47
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	DRD3	20	55
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	DRD5	17	48
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	ERG2	23	52
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	HTR7	33	52
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	SIGMAR1	26	66
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	CCR3	31	41
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	SLC18A3	17	47
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	EBP	15	52
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	HTR3B	0	52
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	CYP2J2	65	46
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	NET	0	54
O=C(CCCN1CCC(S(=O)(=O)N2CCCC2)CC1)c1ccc(F)cc1	ZINC000450925441	GF	On-Demand	Anodyne	AP2S1	0	52
CCOC(=O)CN(C(=O)[C@H]1CCN(c2ccccc2)C1)C1CCC1	ZINC000450925447	EE	On-Demand	Anodyne	ACE	41	37
CCOC(=O)CN(C(=O)[C@H]1CCN(c2ccccc2)C1)C1CCC1	ZINC000450925447	EE	On-Demand	Anodyne	SLC6A1	53	32
CCOC(=O)CN(C(=O)[C@@H]1CCN(c2ccccc2)C1)C1CCC1	ZINC000450925448	EE	On-Demand	Anodyne	ACE	41	37
CCOC(=O)CN(C(=O)[C@@H]1CCN(c2ccccc2)C1)C1CCC1	ZINC000450925448	EE	On-Demand	Anodyne	SLC6A1	53	32
CN(CCN1CCOC[C@H]1c1nc(-c2ccccc2)no1)Cc1ccccc1	ZINC000450925453	GG	On-Demand	Anodyne	COLA	36	40
CN(CCN1CCOC[C@H]1c1nc(-c2ccccc2)no1)Cc1ccccc1	ZINC000450925453	GG	On-Demand	Anodyne	CPT1A	33	40
CN(CCN1CCOC[C@@H]1c1nc(-c2ccccc2)no1)Cc1ccccc1	ZINC000450925456	GG	On-Demand	Anodyne	COLA	36	40
CN(CCN1CCOC[C@@H]1c1nc(-c2ccccc2)no1)Cc1ccccc1	ZINC000450925456	GG	On-Demand	Anodyne	CPT1A	33	40
CNS(=O)(=O)NCC(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000450925457	EC	On-Demand	Anodyne	ENPP1	64	40
O=C(NC1(Cc2ccccc2)CCCCC1)[C@@H]1CC1(F)F	ZINC000450925470	CH	On-Demand	Anodyne	SLC12A5	50	37
O=C(NC1(Cc2ccccc2)CCCCC1)[C@H]1CC1(F)F	ZINC000450925471	CH	On-Demand	Anodyne	SLC12A5	50	37
COCCN(Cc1ccc(F)c(Cl)c1)c1ccc(S(C)(=O)=O)cc1F	ZINC000450925478	GH	On-Demand	Anodyne	PTGS2	18	43
CN(C)C(=O)N[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])C1	ZINC000450925483	CD	On-Demand	Bother	MTNR1A	30	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])C1	ZINC000450925483	CD	On-Demand	Bother	MTNR1B	19	40
CN(C)C(=O)N[C@H]1CCCN(c2ccccc2[N+](=O)[O-])C1	ZINC000450925484	CD	On-Demand	Bother	MTNR1A	30	40
CN(C)C(=O)N[C@H]1CCCN(c2ccccc2[N+](=O)[O-])C1	ZINC000450925484	CD	On-Demand	Bother	MTNR1B	19	40
CCOC(=O)CN(C(=O)c1cc2c(Br)cccc2cn1)C1CCC1	ZINC000450925485	GH	On-Demand	Anodyne	ACE	38	43
COc1cc2nc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925486	FD	On-Demand	Anodyne	ADRA1D	22	53
COc1cc2nc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925486	FD	On-Demand	Anodyne	ADRA1A	17	54
COc1cc2nc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925486	FD	On-Demand	Anodyne	ADRA1B	51	53
COc1cc2nc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925486	FD	On-Demand	Anodyne	PDE3A	44	33
COc1cc2nc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925486	FD	On-Demand	Anodyne	CCR4	53	48
COc1cc2nc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925486	FD	On-Demand	Anodyne	PDE3B	66	33
COc1cc2nc(N3CCC[C@@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925486	FD	On-Demand	Anodyne	EHMT2	97	47
COc1cc2nc(N3CCC[C@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925492	FD	On-Demand	Anodyne	ADRA1D	22	53
COc1cc2nc(N3CCC[C@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925492	FD	On-Demand	Anodyne	ADRA1A	17	54
COc1cc2nc(N3CCC[C@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925492	FD	On-Demand	Anodyne	ADRA1B	51	53
COc1cc2nc(N3CCC[C@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925492	FD	On-Demand	Anodyne	PDE3A	44	33
COc1cc2nc(N3CCC[C@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925492	FD	On-Demand	Anodyne	CCR4	53	48
COc1cc2nc(N3CCC[C@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925492	FD	On-Demand	Anodyne	PDE3B	66	33
COc1cc2nc(N3CCC[C@H](NC(=O)N(C)C)C3)nc(N)c2cc1OC	ZINC000450925492	FD	On-Demand	Anodyne	EHMT2	97	47
CCN1CCN(CC(C)(C)Nc2nc3cc(F)ccc3o2)CC1	ZINC000450925494	DF	On-Demand	Anodyne	SSTR5	45	34
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450925496	EE	On-Demand	Anodyne	PDE3A	46	34
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450925496	EE	On-Demand	Anodyne	PDGFRB	35	43
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450925496	EE	On-Demand	Anodyne	PDE3B	68	35
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450925497	EE	On-Demand	Anodyne	PDE3A	46	34
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450925497	EE	On-Demand	Anodyne	PDGFRB	35	43
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450925497	EE	On-Demand	Anodyne	PDE3B	68	35
CCOC(=O)CN(C(=O)c1ccc(C2CC2)nc1C)C1CCC1	ZINC000450925507	DF	On-Demand	Anodyne	ACE	57	48
c1ccc(-c2noc([C@H]3COCCN3C[C@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450925513	EF	On-Demand	Anodyne	COLA	39	40
c1ccc(-c2noc([C@H]3COCCN3C[C@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450925513	EF	On-Demand	Anodyne	CPT1A	34	40
c1ccc(-c2noc([C@@H]3COCCN3C[C@@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450925514	EF	On-Demand	Anodyne	COLA	39	40
c1ccc(-c2noc([C@@H]3COCCN3C[C@@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450925514	EF	On-Demand	Anodyne	CPT1A	34	40
c1ccc(-c2noc([C@@H]3COCCN3C[C@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450925515	EF	On-Demand	Anodyne	COLA	39	40
c1ccc(-c2noc([C@@H]3COCCN3C[C@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450925515	EF	On-Demand	Anodyne	CPT1A	34	40
c1ccc(-c2noc([C@H]3COCCN3C[C@@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450925516	EF	On-Demand	Anodyne	COLA	39	40
c1ccc(-c2noc([C@H]3COCCN3C[C@@H]3C[C@H]4CC[C@H]3O4)n2)cc1	ZINC000450925516	EF	On-Demand	Anodyne	CPT1A	34	40
C[C@H](O)CNC(=O)c1ccc(OCc2cn(CC3CC3)nn2)cc1	ZINC000450925524	ED	On-Demand	Anodyne	CA14	17	40
CCCn1nccc1C1CCN(CCCC(=O)CC)CC1	ZINC000450925536	CG	On-Demand	Anodyne	CYP2J2	50	36
COc1cc(OCCC(C)(F)F)ccc1C#N	ZINC000450925542	BF	On-Demand	Mild	AR	21	47
CCOC(=O)CN(C(=O)Cc1ccc(OC)c(OC)c1Cl)C1CCC1	ZINC000450925547	FF	On-Demand	Anodyne	ACE	19	44
CCC(=O)CCCN1CCC[C@H](c2ncc3n2CCCC3)C1	ZINC000450925563	DG	On-Demand	Anodyne	SLC6A1	49	32
CCC(=O)CCCN1CCC[C@@H](c2ncc3n2CCCC3)C1	ZINC000450925565	DG	On-Demand	Anodyne	SLC6A1	49	32
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450925567	FF	On-Demand	Bother	EEF1A1	0	49
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450925567	FF	On-Demand	Bother	EEF1A2	0	49
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450925569	FF	On-Demand	Bother	EEF1A1	0	49
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450925569	FF	On-Demand	Bother	EEF1A2	0	49
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	ADORA1	171	78
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	SLC29A1	135	58
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	P2RY12	49	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	ADORA2A	59	64
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	ADORA2B	25	57
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	GAPC	0	42
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	ADK	61	52
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	AK3	0	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	AHCY	44	37
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	CDA	40	31
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	P2RX4	43	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	P2RX1	56	39
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	P2RY1	36	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	P2RY11	0	40
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	AMD1	36	42
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	ITPR1	52	38
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	P2RY2	21	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	AK2	0	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	NS5B	0	43
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	ADORA3	137	64
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	OXGR1	120	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	MTAP	0	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	IMPDH2	51	33
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	AK	0	46
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	RNASE1	46	36
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	MBTA	0	42
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	DNMT3B	70	41
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	Q4VQ11_PIG	104	64
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	GPR17	58	47
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	SAE1	0	40
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	DOT1L	89	42
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	NAE1	0	40
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	UBA6	0	40
CC1(C)CCC[C@@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925570	GD	On-Demand	Anodyne	UBA7	0	40
CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CC[C@H](C(N)=O)C1	ZINC000450925571	ED	On-Demand	Bother	SLC27A4	42	30
COc1ccc(-c2csc3ncnc(N[C@@H]4CC[C@H](C(N)=O)C4)c23)cc1	ZINC000450925573	FG	On-Demand	Anodyne	ADRB3	24	46
COc1ccc(-c2csc3ncnc(N[C@@H]4CC[C@H](C(N)=O)C4)c23)cc1	ZINC000450925573	FG	On-Demand	Anodyne	CD38	31	44
COc1ccc(-c2csc3ncnc(N[C@@H]4CC[C@H](C(N)=O)C4)c23)cc1	ZINC000450925573	FG	On-Demand	Anodyne	NPBWR1	62	30
COc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ccnc2cc1F	ZINC000450925579	DE	On-Demand	Anodyne	KDR	55	38
COc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ccnc2cc1F	ZINC000450925579	DE	On-Demand	Anodyne	PDGFRA	56	37
COc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ccnc2cc1F	ZINC000450925579	DE	On-Demand	Anodyne	CSF1R	45	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450925584	ED	On-Demand	Bother	MAPK13	46	34
CCCCN(CC)C(=O)Cn1c(=O)oc2cc(S(=O)(=O)CCO)ccc21	ZINC000450925585	GD	On-Demand	Anodyne	TSPO	19	44
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	ADORA1	171	78
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	SLC29A1	135	58
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	P2RY12	49	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	ADORA2A	59	64
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	ADORA2B	25	57
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	GAPC	0	42
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	ADK	61	52
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	AK3	0	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	AHCY	44	37
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	CDA	40	31
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	P2RX4	43	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	P2RX1	56	39
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	P2RY1	36	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	P2RY11	0	40
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	AMD1	36	42
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	ITPR1	52	38
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	P2RY2	21	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	AK2	0	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	NS5B	0	43
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	ADORA3	137	64
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	OXGR1	120	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	MTAP	0	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	IMPDH2	51	33
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	AK	0	46
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	RNASE1	46	36
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	MBTA	0	42
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	DNMT3B	70	41
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	Q4VQ11_PIG	104	64
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	GPR17	58	47
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	SAE1	0	40
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	DOT1L	89	42
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	NAE1	0	40
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	UBA6	0	40
CC1(C)CCC[C@H](CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450925592	GD	On-Demand	Anodyne	UBA7	0	40
COc1cc(OC)c2ncnc(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1	ZINC000450925603	DD	On-Demand	Anodyne	PDE6A	40	34
COc1cc(OC)c2ncnc(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1	ZINC000450925603	DD	On-Demand	Anodyne	CD38	23	42
CCc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450925609	EG	On-Demand	Anodyne	KCNQ2	43	33
CCc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450925609	EG	On-Demand	Anodyne	TACR3	44	35
CCc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450925609	EG	On-Demand	Anodyne	MTNR1A	30	41
CCc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450925609	EG	On-Demand	Anodyne	MTNR1B	0	41
CCc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450925610	EG	On-Demand	Anodyne	KCNQ2	43	33
CCc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450925610	EG	On-Demand	Anodyne	TACR3	44	35
CCc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450925610	EG	On-Demand	Anodyne	MTNR1A	30	41
CCc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2ccccc2n1	ZINC000450925610	EG	On-Demand	Anodyne	MTNR1B	0	41
CC(=O)CCCCCOc1ccc(C#N)c(C)c1	ZINC000450925611	BG	On-Demand	Mild	THRA	34	43
CC(=O)CCCCCOc1ccc(C#N)c(C)c1	ZINC000450925611	BG	On-Demand	Mild	P2RY12	29	42
CC(=O)CCCCCOc1ccc(C#N)c(C)c1	ZINC000450925611	BG	On-Demand	Mild	THRB	0	43
CC(=O)CCCCCOc1ccc(C#N)c(C)c1	ZINC000450925611	BG	On-Demand	Mild	PLA2G4B	75	39
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450925616	EE	On-Demand	Anodyne	EGFR	43	39
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3cc(Br)ccc23)C1	ZINC000450925616	EE	On-Demand	Anodyne	CD38	37	44
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925619	FD	On-Demand	Anodyne	ADRB2	39	40
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925619	FD	On-Demand	Anodyne	VDR	59	43
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925619	FD	On-Demand	Anodyne	ACOX1	52	34
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925619	FD	On-Demand	Anodyne	CCR1	48	39
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925619	FD	On-Demand	Anodyne	ABCB1	72	45
COc1cc(CN2CCC[C@@H](S(C)(=O)=O)CC2)ccc1Cl	ZINC000450925620	EF	On-Demand	Anodyne	AVPR1B	45	37
COc1cc(CN2CCC[C@@H](S(C)(=O)=O)CC2)ccc1Cl	ZINC000450925620	EF	On-Demand	Anodyne	CCR3	25	44
COc1cc(CN2CCC[C@@H](S(C)(=O)=O)CC2)ccc1Cl	ZINC000450925620	EF	On-Demand	Anodyne	UTS2R	26	40
COc1cc(CN2CCC[C@@H](S(C)(=O)=O)CC2)ccc1Cl	ZINC000450925620	EF	On-Demand	Anodyne	MCHR1	23	42
COc1cc(CN2CCC[C@H](S(C)(=O)=O)CC2)ccc1Cl	ZINC000450925621	EF	On-Demand	Anodyne	AVPR1B	45	37
COc1cc(CN2CCC[C@H](S(C)(=O)=O)CC2)ccc1Cl	ZINC000450925621	EF	On-Demand	Anodyne	CCR3	25	44
COc1cc(CN2CCC[C@H](S(C)(=O)=O)CC2)ccc1Cl	ZINC000450925621	EF	On-Demand	Anodyne	UTS2R	26	40
COc1cc(CN2CCC[C@H](S(C)(=O)=O)CC2)ccc1Cl	ZINC000450925621	EF	On-Demand	Anodyne	MCHR1	23	42
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925625	FD	On-Demand	Anodyne	ADRB2	39	40
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925625	FD	On-Demand	Anodyne	VDR	59	43
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925625	FD	On-Demand	Anodyne	ACOX1	52	34
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925625	FD	On-Demand	Anodyne	CCR1	48	39
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCC(O)(C(N)=O)CC1	ZINC000450925625	FD	On-Demand	Anodyne	ABCB1	72	45
COC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1ccc(F)c(C)c1	ZINC000450925634	EF	On-Demand	Anodyne	LEF	54	33
CCS(=O)(=O)c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1	ZINC000450925637	FD	On-Demand	Anodyne	SSTR5	44	42
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1C(F)(F)F)c1ccc(F)c(C)c1	ZINC000450925638	EF	On-Demand	Anodyne	LEF	54	33
CSc1ccc2ncnc(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1	ZINC000450925641	DE	On-Demand	Anodyne	CD38	52	48
C[C@@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)N1CCC(O)(C(N)=O)CC1	ZINC000450925642	GC	On-Demand	Anodyne	EPHX2	72	43
C[C@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)N1CCC(O)(C(N)=O)CC1	ZINC000450925643	GC	On-Demand	Anodyne	EPHX2	72	43
COCc1cc(N2CCC[C@H](NC(=O)N(C)C)C2)c2cc(F)ccc2n1	ZINC000450925647	FF	On-Demand	Anodyne	DHODH	42	36
COCc1cc(N2CCC[C@@H](NC(=O)N(C)C)C2)c2cc(F)ccc2n1	ZINC000450925648	FF	On-Demand	Anodyne	DHODH	42	36
CC(C)[C@H](CNC(=O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450925655	EC	On-Demand	Anodyne	NPFFR1	52	35
CC(C)[C@@H](CNC(=O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450925656	EC	On-Demand	Anodyne	NPFFR1	52	35
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450925664	EG	On-Demand	Anodyne	LEF	69	38
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450925665	EG	On-Demand	Anodyne	LEF	69	38
CC[C@H](CC(F)(F)F)C(=O)N[C@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450925666	EG	On-Demand	Anodyne	LEF	69	38
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450925667	EG	On-Demand	Anodyne	LEF	69	38
CCCOc1ccc(Br)cc1CN1CCC(O)(C(N)=O)CC1	ZINC000450925668	FE	On-Demand	Anodyne	CCR5	17	49
CC(C)NS(=O)(=O)N1CCN(CCn2ccc3cc(Cl)ccc32)CC1	ZINC000450925669	GE	On-Demand	Anodyne	HTR7	0	51
CN(CCOc1ccc(S(N)(=O)=O)cc1F)c1nc(C(F)(F)F)cs1	ZINC000450925670	GE	On-Demand	Anodyne	PTGS2	24	41
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3c2cnn3-c2ccccc2)C1	ZINC000450925672	DD	On-Demand	Anodyne	CD38	16	43
Cc1ccc(-c2csc(NC(=O)[C@@H](C)N3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925676	GD	On-Demand	Anodyne	KCNQ1	0	41
Cc1ccc(-c2csc(NC(=O)[C@H](C)N3CCC(O)(C(N)=O)CC3)n2)cc1	ZINC000450925677	GD	On-Demand	Anodyne	KCNQ1	0	41
NC(=O)[C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1	ZINC000450925681	DF	On-Demand	Bother	AADAC	0	51
NC(=O)[C@@H]1CC[C@H](Nc2cc(C(F)(F)F)nc3ncnn23)C1	ZINC000450925685	DD	On-Demand	Anodyne	DHOD	0	47
NC(=O)C1(O)CCN(Cc2ccc(C3CCC3)cc2)CC1	ZINC000450925687	CD	On-Demand	Anodyne	NPFFR1	51	34
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc(F)c(C)c1	ZINC000450925688	FG	On-Demand	Anodyne	GPR88	0	40
NC(=O)C1(O)CCN(CCOc2ccc(Cl)c(F)c2)CC1	ZINC000450925694	DD	On-Demand	Anodyne	PSMB2	45	36
COc1cc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ccnc2cc1F	ZINC000450925697	EF	On-Demand	Anodyne	PDE3A	42	32
COc1cc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ccnc2cc1F	ZINC000450925697	EF	On-Demand	Anodyne	KDR	46	36
COc1cc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ccnc2cc1F	ZINC000450925697	EF	On-Demand	Anodyne	MET	48	36
COc1cc2c(N3CCC[C@@H](NC(=O)N(C)C)C3)ccnc2cc1F	ZINC000450925697	EF	On-Demand	Anodyne	PDGFRA	49	36
COc1cc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ccnc2cc1F	ZINC000450925698	EF	On-Demand	Anodyne	PDE3A	42	32
COc1cc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ccnc2cc1F	ZINC000450925698	EF	On-Demand	Anodyne	KDR	46	36
COc1cc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ccnc2cc1F	ZINC000450925698	EF	On-Demand	Anodyne	MET	48	36
COc1cc2c(N3CCC[C@H](NC(=O)N(C)C)C3)ccnc2cc1F	ZINC000450925698	EF	On-Demand	Anodyne	PDGFRA	49	36
COc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc2cc1F	ZINC000450925699	DD	On-Demand	Anodyne	ERBB2	22	41
COc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc2cc1F	ZINC000450925699	DD	On-Demand	Anodyne	FGFR1	0	41
COc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc2cc1F	ZINC000450925699	DD	On-Demand	Anodyne	FLT1	23	41
COc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc2cc1F	ZINC000450925699	DD	On-Demand	Anodyne	EPHA2	43	33
COc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc2cc1F	ZINC000450925699	DD	On-Demand	Anodyne	CD38	39	48
CCOC(=O)CN(C(=O)c1ccsc1Br)C1CCC1	ZINC000450925709	EG	On-Demand	Anodyne	ACE	61	50
CCOC(=O)CN(C(=O)c1ccc(S(=O)(=O)C2CC2)cc1)C1CCC1	ZINC000450925710	FE	On-Demand	Anodyne	ACE	55	44
C[C@H](c1ccccc1)N(C)C(=O)CN(C)CCCC(=O)c1ccccc1	ZINC000450925716	FH	On-Demand	Anodyne	SLC6A9	0	42
C[C@@H](c1ccccc1)N(C)C(=O)CN(C)CCCC(=O)c1ccccc1	ZINC000450925717	FH	On-Demand	Anodyne	SLC6A9	0	42
CCOC(=O)CN(C(=O)c1cnn2c1CCC2)C1CCC1	ZINC000450925741	CD	On-Demand	Anodyne	ACE	43	46
CN(C)C(=O)N[C@@H]1CCCN(c2nc3ccccc3s2)C1	ZINC000450925758	DF	On-Demand	Anodyne	TRY1_BOVIN	43	37
CN(C)C(=O)N[C@H]1CCCN(c2nc3ccccc3s2)C1	ZINC000450925759	DF	On-Demand	Anodyne	TRY1_BOVIN	43	37
COC(=O)COc1ccc([C@@H](C)NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450925762	EF	On-Demand	Anodyne	SDH1	0	42
COC(=O)COc1ccc([C@@H](C)NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450925762	EF	On-Demand	Anodyne	ACACA	56	41
COC(=O)COc1ccc([C@@H](C)NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450925762	EF	On-Demand	Anodyne	ACACB	29	41
COC(=O)COc1ccc([C@H](C)NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450925763	EF	On-Demand	Anodyne	SDH1	0	42
COC(=O)COc1ccc([C@H](C)NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450925763	EF	On-Demand	Anodyne	ACACA	56	41
COC(=O)COc1ccc([C@H](C)NC(=O)C2(C)CCC(=O)CC2)cc1	ZINC000450925763	EF	On-Demand	Anodyne	ACACB	29	41
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450925764	GH	On-Demand	Anodyne	ADRB2	16	49
CN(C)C(=O)N[C@H]1CCCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450925764	GH	On-Demand	Anodyne	ADRB3	30	49
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450925765	GH	On-Demand	Anodyne	ADRB2	16	49
CN(C)C(=O)N[C@@H]1CCCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450925765	GH	On-Demand	Anodyne	ADRB3	30	49
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(=O)N1C	ZINC000450925771	CD	On-Demand	Anodyne	DRD2	32	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(=O)N1C	ZINC000450925771	CD	On-Demand	Anodyne	HTR2A	22	48
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(=O)N1C	ZINC000450925771	CD	On-Demand	Anodyne	CYP2J2	52	37
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(=O)N1C	ZINC000450925772	CD	On-Demand	Anodyne	DRD2	32	45
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(=O)N1C	ZINC000450925772	CD	On-Demand	Anodyne	HTR2A	22	48
C[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(=O)N1C	ZINC000450925772	CD	On-Demand	Anodyne	CYP2J2	52	37
CCOC(=O)CN(C(=O)c1cc2c([nH]1)CCCC2)C1CCC1	ZINC000450925773	DE	On-Demand	Anodyne	ACE	55	45
C[C@@H](c1ccccc1)N(C)C(=O)CN(C)C[C@H]1CCCCC1(F)F	ZINC000450925778	EH	On-Demand	Anodyne	AMY2	43	29
C[C@H](c1ccccc1)N(C)C(=O)CN(C)C[C@H]1CCCCC1(F)F	ZINC000450925779	EH	On-Demand	Anodyne	AMY2	43	29
C[C@@H](c1ccccc1)N(C)C(=O)CN(C)C[C@@H]1CCCCC1(F)F	ZINC000450925780	EH	On-Demand	Anodyne	AMY2	43	29
C[C@H](c1ccccc1)N(C)C(=O)CN(C)C[C@@H]1CCCCC1(F)F	ZINC000450925781	EH	On-Demand	Anodyne	AMY2	43	29
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CN2CCOCC2)C1	ZINC000450925784	EE	On-Demand	Anodyne	CASR	44	34
C[C@@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CN2CCOCC2)C1	ZINC000450925785	EE	On-Demand	Anodyne	CASR	44	34
CO[C@H]1Cc2ccccc2N(CC[C@H](C)O)C1	ZINC000450925786	BD	On-Demand	Anodyne	TPP2	51	32
CO[C@@H]1Cc2ccccc2N(CC[C@@H](C)O)C1	ZINC000450925787	BD	On-Demand	Anodyne	TPP2	51	32
CO[C@@H]1Cc2ccccc2N(CC[C@H](C)O)C1	ZINC000450925788	BD	On-Demand	Anodyne	TPP2	51	32
CO[C@H]1Cc2ccccc2N(CC[C@@H](C)O)C1	ZINC000450925789	BD	On-Demand	Anodyne	TPP2	51	32
CN(C)C(=O)N[C@H]1CCCN(c2ccc3ccc(F)cc3n2)C1	ZINC000450925799	DF	On-Demand	Anodyne	CCR3	25	41
CN(C)C(=O)N[C@@H]1CCCN(c2ccc3ccc(F)cc3n2)C1	ZINC000450925800	DF	On-Demand	Anodyne	CCR3	25	41
COC(=O)[C@@H](NC(=O)CC1(O)CCC1)c1ccc(F)c(C)c1	ZINC000450925801	DD	On-Demand	Anodyne	LEF	57	32
COC(=O)[C@H](NC(=O)CC1(O)CCC1)c1ccc(F)c(C)c1	ZINC000450925802	DD	On-Demand	Anodyne	LEF	57	32
CN(C(=O)CN1CCC(O)(C(N)=O)CC1)[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000450925810	GD	On-Demand	Anodyne	OPRK1	29	48
CN(C(=O)CN1CCC(O)(C(N)=O)CC1)[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000450925810	GD	On-Demand	Anodyne	CCR5	21	41
CN(C(=O)CN1CCC(O)(C(N)=O)CC1)[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000450925811	GD	On-Demand	Anodyne	OPRK1	29	48
CN(C(=O)CN1CCC(O)(C(N)=O)CC1)[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000450925811	GD	On-Demand	Anodyne	CCR5	21	41
Cc1cccc(OCCCNC(=O)CN2CCC(O)(C(N)=O)CC2)c1	ZINC000450925815	EC	On-Demand	Anodyne	HRH2	50	44
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450925818	FE	On-Demand	Anodyne	AVPR2	96	45
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450925818	FE	On-Demand	Anodyne	AVPR1A	60	45
C[C@]1(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC=CCC1	ZINC000450925826	DH	On-Demand	Bother	P2RX7	24	44
CC(C)=CCS[C@H](C)C(=O)Nc1nccs1	ZINC000450925836	CG	On-Demand	Anodyne	MAP	0	47
CC(C)=CCS[C@@H](C)C(=O)Nc1nccs1	ZINC000450925837	CG	On-Demand	Anodyne	MAP	0	47
CC(C)NS(=O)(=O)N1CCN(CCc2ccc3c(c2)OCCO3)CC1	ZINC000450925839	FC	On-Demand	Anodyne	PKM	31	41
CN(C)C(=O)N[C@H]1CCCN(c2ccnc(C(=O)NCc3ccccc3)c2)C1	ZINC000450925840	GE	On-Demand	Anodyne	ALK	18	40
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc(C(=O)NCc3ccccc3)c2)C1	ZINC000450925843	GE	On-Demand	Anodyne	ALK	18	40
NC(=O)C1(O)CCN(CC(=O)NCc2ccccc2COc2ccccc2)CC1	ZINC000450925846	GD	On-Demand	Anodyne	ADAM17	42	37
NC(=O)C1(O)CCN(CC(=O)NCc2ccccc2COc2ccccc2)CC1	ZINC000450925846	GD	On-Demand	Anodyne	NPFFR1	52	35
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccccc3F)cs2)C1	ZINC000450925850	DE	On-Demand	Anodyne	VCP	20	50
CC(C)(C)C1CCC(Cn2c(=O)oc3cc(S(=O)(=O)CCO)ccc32)CC1	ZINC000450925851	GG	On-Demand	Anodyne	CNR2	22	55
COC(=O)[C@@H](NC(=O)c1ccc(C(C)(F)F)nc1)c1ccc(F)c(C)c1	ZINC000450925857	FG	On-Demand	Anodyne	LEF	55	35
CCOC(=O)CN(C(=O)c1cc(C#N)[nH]c1C)C1CCC1	ZINC000450925859	CD	On-Demand	Mild	ACE	55	49
COC(=O)[C@H](NC(=O)c1ccc(C(C)(F)F)nc1)c1ccc(F)c(C)c1	ZINC000450925860	FG	On-Demand	Anodyne	LEF	55	35
CC(C)(C)C(=O)CCCC(=O)Nc1ccccc1OCC(=O)Nc1cccnc1	ZINC000450925861	GH	On-Demand	Anodyne	HDAC3	16	49
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3ccsc23)C1	ZINC000450925865	CD	On-Demand	Anodyne	CD38	34	41
COCCN(Cc1ccc(F)c(Cl)c1)c1ccnc(N2CCOCC2)n1	ZINC000450925869	GF	On-Demand	Anodyne	EPHB4	70	36
COC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(F)c(C)c1	ZINC000450925874	GF	On-Demand	Anodyne	MTNR1A	30	45
COC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(F)c(C)c1	ZINC000450925874	GF	On-Demand	Anodyne	MTNR1B	33	45
COC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(F)c(C)c1	ZINC000450925875	GF	On-Demand	Anodyne	MTNR1A	30	45
COC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(F)c(C)c1	ZINC000450925875	GF	On-Demand	Anodyne	MTNR1B	33	45
NC(=O)C1(O)CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000450925876	FD	On-Demand	Anodyne	ADRB1	0	42
NC(=O)C1(O)CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000450925876	FD	On-Demand	Anodyne	CCR1	44	42
NC(=O)C1(O)CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000450925876	FD	On-Demand	Anodyne	ABCB1	71	44
NC(=O)C1(O)CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000450925877	FD	On-Demand	Anodyne	ADRB1	0	42
NC(=O)C1(O)CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000450925877	FD	On-Demand	Anodyne	CCR1	44	42
NC(=O)C1(O)CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000450925877	FD	On-Demand	Anodyne	ABCB1	71	44
CNS(=O)(=O)NCC(=O)N[C@@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450925887	EB	On-Demand	Anodyne	LEF	64	37
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@H](S(C)(=O)=O)C1	ZINC000450925889	EH	On-Demand	Anodyne	CHRM2	19	40
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@@H](S(C)(=O)=O)C1	ZINC000450925890	EH	On-Demand	Anodyne	CHRM2	19	40
CNS(=O)(=O)NCC(=O)N[C@H](C(=O)OC)c1ccc(F)c(C)c1	ZINC000450925891	EB	On-Demand	Anodyne	LEF	64	37
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@@H](S(C)(=O)=O)C1	ZINC000450925892	EH	On-Demand	Anodyne	CHRM2	19	40
CCOC(=O)CN(C(=O)c1cnn2ccc(C)cc12)C1CCC1	ZINC000450925893	DE	On-Demand	Anodyne	ACE	54	46
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@H](S(C)(=O)=O)C1	ZINC000450925894	EH	On-Demand	Anodyne	CHRM2	19	40
COc1ccc(Br)c(OCCCCCC(C)=O)c1	ZINC000450925896	DH	On-Demand	Anodyne	THRA	43	40
COc1ccc(Br)c(OCCCCCC(C)=O)c1	ZINC000450925896	DH	On-Demand	Anodyne	THRB	0	40
COc1ccc(Br)c(OCCCCCC(C)=O)c1	ZINC000450925896	DH	On-Demand	Anodyne	MTNR1A	46	40
COc1ccc(Br)c(OCCCCCC(C)=O)c1	ZINC000450925896	DH	On-Demand	Anodyne	MTNR1B	44	40
COc1ccc(Br)c(OCCCCCC(C)=O)c1	ZINC000450925896	DH	On-Demand	Anodyne	PLA2G4B	64	35
COC(=O)[C@@H](NC(=O)CCCC(=O)C(C)(C)C)c1ccc(F)c(C)c1	ZINC000450925909	FG	On-Demand	Anodyne	LEF	55	33
COC(=O)[C@H](NC(=O)CCCC(=O)C(C)(C)C)c1ccc(F)c(C)c1	ZINC000450925910	FG	On-Demand	Anodyne	LEF	55	33
CN(CCN1CCC[C@H](c2nc(N(C)C)no2)C1)Cc1ccccc1	ZINC000450925913	EE	On-Demand	Anodyne	SLC6A1	52	32
CN(CCN1CCC[C@@H](c2nc(N(C)C)no2)C1)Cc1ccccc1	ZINC000450925914	EE	On-Demand	Anodyne	SLC6A1	52	32
COc1ccc([N+](=O)[O-])c(N[C@@H]2CC[C@H](C(N)=O)C2)c1	ZINC000450925916	CD	On-Demand	Bother	AKR1C2	39	40
CCCCCOc1ccc(Br)cc1CN1CCC(O)(C(N)=O)CC1	ZINC000450925918	GF	On-Demand	Anodyne	CCR5	15	48
c1ccc2c(c1)CCN2C1CCN(C[C@H]2COCCO2)CC1	ZINC000450925921	DD	On-Demand	Anodyne	NAMPT	0	41
c1ccc2c(c1)CCN2C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450925923	DD	On-Demand	Anodyne	NAMPT	0	41
CN(C)C(=O)N[C@@H]1CCCN(c2ccnc3c(Cl)cccc23)C1	ZINC000450925924	EG	On-Demand	Anodyne	FAP	0	42
CN(C)C(=O)N[C@H]1CCCN(c2ccnc3c(Cl)cccc23)C1	ZINC000450925926	EG	On-Demand	Anodyne	FAP	0	42
O=C(CCCN1CCCC[C@H]1C(F)F)c1ccc(F)cc1	ZINC000450925971	CH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCCC[C@H]1C(F)F)c1ccc(F)cc1	ZINC000450925971	CH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCCC[C@H]1C(F)F)c1ccc(F)cc1	ZINC000450925971	CH	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450925972	CH	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450925972	CH	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CCCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450925972	CH	On-Demand	Anodyne	CYP2J2	49	35
CCS(=O)(=O)c1ccc(CN2CC[C@@](F)(c3ccccc3C)C2)cc1	ZINC000450925973	FH	On-Demand	Anodyne	MCHR2	47	31
CCS(=O)(=O)c1ccc(CN2CC[C@](F)(c3ccccc3C)C2)cc1	ZINC000450925974	FH	On-Demand	Anodyne	MCHR2	47	31
CO[C@@H](Cc1ccccc1)CN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450925986	GG	On-Demand	Anodyne	COLA	35	40
CO[C@@H](Cc1ccccc1)CN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450925986	GG	On-Demand	Anodyne	CPT1A	31	40
CO[C@H](Cc1ccccc1)CN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450925987	GG	On-Demand	Anodyne	COLA	35	40
CO[C@H](Cc1ccccc1)CN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450925987	GG	On-Demand	Anodyne	CPT1A	31	40
CO[C@@H](Cc1ccccc1)CN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450925988	GG	On-Demand	Anodyne	COLA	35	40
CO[C@@H](Cc1ccccc1)CN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450925988	GG	On-Demand	Anodyne	CPT1A	31	40
CO[C@H](Cc1ccccc1)CN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450925989	GG	On-Demand	Anodyne	COLA	35	40
CO[C@H](Cc1ccccc1)CN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450925989	GG	On-Demand	Anodyne	CPT1A	31	40
COc1cc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)ccc1Cl	ZINC000450925992	FI	On-Demand	Anodyne	DRD4	16	43
COc1cc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)ccc1Cl	ZINC000450925992	FI	On-Demand	Anodyne	SSTR5	43	39
COc1cc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)ccc1Cl	ZINC000450925993	FI	On-Demand	Anodyne	DRD4	16	43
COc1cc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)ccc1Cl	ZINC000450925993	FI	On-Demand	Anodyne	SSTR5	43	39
CCOC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)nc1	ZINC000450925997	FG	On-Demand	Anodyne	AVPR1A	24	42
CCOC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)nc1	ZINC000450925997	FG	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)nc1	ZINC000450925997	FG	On-Demand	Anodyne	SCD1	0	43
CCOC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)nc1	ZINC000450925997	FG	On-Demand	Anodyne	NOD2	25	41
CC(C)NS(=O)(=O)N1CCN(C[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000450926012	GD	On-Demand	Anodyne	VACHT_TETCF	0	54
CC(C)NS(=O)(=O)N1CCN(C[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000450926012	GD	On-Demand	Anodyne	TRY2_BOVIN	74	37
CC(C)NS(=O)(=O)N1CCN(C[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000450926012	GD	On-Demand	Anodyne	ECE1	18	42
CC(C)NS(=O)(=O)N1CCN(C[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000450926013	GD	On-Demand	Anodyne	VACHT_TETCF	0	54
CC(C)NS(=O)(=O)N1CCN(C[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000450926013	GD	On-Demand	Anodyne	TRY2_BOVIN	74	37
CC(C)NS(=O)(=O)N1CCN(C[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000450926013	GD	On-Demand	Anodyne	ECE1	18	42
COc1ccc2nc(C(F)(F)F)nc(N[C@@H]3CC[C@H](C(N)=O)C3)c2c1	ZINC000450926014	FE	On-Demand	Anodyne	CD38	21	40
CC[C@H](O)CC(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450926031	CF	On-Demand	Anodyne	ADAM9	43	32
CC[C@H](O)CC(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000450926032	CF	On-Demand	Anodyne	ADAM9	43	32
CC[C@@H](O)CC(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000450926033	CF	On-Demand	Anodyne	ADAM9	43	32
CC[C@H]1Cc2ccccc2CN1C(=O)C[C@H](O)CC	ZINC000450926034	CF	On-Demand	Anodyne	ADAM9	43	32
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccc(F)cc3)cs2)C1	ZINC000450926039	DE	On-Demand	Anodyne	MAOB	31	45
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccc(F)cc3)cs2)C1	ZINC000450926039	DE	On-Demand	Anodyne	ROCK1	16	42
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccc(F)cc3)cs2)C1	ZINC000450926039	DE	On-Demand	Anodyne	SPHK2	49	34
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3cccc(F)c23)C1	ZINC000450926041	CD	On-Demand	Anodyne	CD38	21	45
COC(=O)[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)c1ccc(F)c(C)c1	ZINC000450926045	EF	On-Demand	Anodyne	CTSA	40	35
COC(=O)[C@H](NC(=O)c1cc(C)n(C(C)C)n1)c1ccc(F)c(C)c1	ZINC000450926046	EF	On-Demand	Anodyne	CTSA	40	35
NC(=O)C1(O)CCN(Cc2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1	ZINC000450926071	GH	On-Demand	Anodyne	ADAM17	17	40
NC(=O)C1(O)CCN(Cc2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1	ZINC000450926071	GH	On-Demand	Anodyne	CCR8	45	42
NC(=O)C1(O)CCN(Cc2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1	ZINC000450926071	GH	On-Demand	Anodyne	NPFFR1	51	36
Cc1ccc(NC(=O)c2ccc(N[C@@H]3CC[C@H](C(N)=O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450926076	GG	On-Demand	Bother	TAAR1	21	41
NC(=O)C1(O)CCN(CCS(=O)(=O)c2cc(Cl)ccc2Cl)CC1	ZINC000450926077	GD	On-Demand	Anodyne	CCR1	28	48
NC(=O)[C@@H]1CC[C@H](Nc2ncccc2C(=O)N2CCc3ccccc32)C1	ZINC000450926078	FE	On-Demand	Anodyne	AVPR2	51	39
Cc1cc(=N[C@@H]2CC[C@H](C(N)=O)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450926083	ED	On-Demand	Bother	SLC27A4	42	31
COC(=O)[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(F)c(C)c1	ZINC000450926091	DD	On-Demand	Anodyne	LEF	72	44
COC(=O)[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(F)c(C)c1	ZINC000450926092	DD	On-Demand	Anodyne	LEF	72	44
COC(=O)[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc(F)c(C)c1	ZINC000450926093	DD	On-Demand	Anodyne	LEF	72	44
COC(=O)[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(F)c(C)c1	ZINC000450926094	DD	On-Demand	Anodyne	LEF	72	44
NC(=O)C1(O)CCN(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000450926097	GD	On-Demand	Anodyne	ENV	40	31
NC(=O)C1(O)CCN(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000450926097	GD	On-Demand	Anodyne	MCHR1	18	42
NC(=O)C1(O)CCN(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000450926097	GD	On-Demand	Anodyne	Q8MMZ8_EIMTE	40	41
NC(=O)C1(O)CCN(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000450926097	GD	On-Demand	Anodyne	IMDH_CRYPV	25	43
O=C(CS(=O)(=O)C1CC1)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000450926105	ED	On-Demand	Bother	P2RX7	44	37
COC(=O)CNC(=O)c1ccc(N[C@@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450926107	EE	On-Demand	Bother	EEF1A1	0	43
COC(=O)CNC(=O)c1ccc(N[C@@H](C)C2CCCC2)c([N+](=O)[O-])c1	ZINC000450926107	EE	On-Demand	Bother	EEF1A2	0	43
N#Cc1ccc(N[C@H]2CC[C@@H](C(N)=O)C2)cn1	ZINC000450926108	BD	On-Demand	Mild	DHODH	43	42
CS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450926133	CE	On-Demand	Anodyne	DRD4	22	40
CS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450926133	CE	On-Demand	Anodyne	SLC6A1	27	46
CS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450926133	CE	On-Demand	Anodyne	SIGMAR1	25	44
CS(=O)(=O)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450926133	CE	On-Demand	Anodyne	BIRC2	47	43
CS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450926134	CE	On-Demand	Anodyne	DRD4	22	40
CS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450926134	CE	On-Demand	Anodyne	SLC6A1	27	46
CS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450926134	CE	On-Demand	Anodyne	SIGMAR1	25	44
CS(=O)(=O)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450926134	CE	On-Demand	Anodyne	BIRC2	47	43
CCN(CCOCCO)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450926136	DD	On-Demand	Anodyne	RORC	17	44
CC(C)(C)OC(=O)c1cccc(CN2CCC(c3nnc(O)o3)CC2)c1	ZINC000450926166	FG	On-Demand	Anodyne	SSTR5	43	32
CCOC(=O)c1c[nH]c2ccc(OC)cc2c1=N[C@@H]1C[C@H](O)C1	ZINC000450926174	DD	On-Demand	Anodyne	MAPKAPK2	0	40
COC(=O)c1ccc(CN2CCC[C@@H](S(C)(=O)=O)CC2)cc1Cl	ZINC000450926190	FF	On-Demand	Anodyne	AVPR1B	40	33
COC(=O)c1ccc(CN2CCC[C@@H](S(C)(=O)=O)CC2)cc1Cl	ZINC000450926190	FF	On-Demand	Anodyne	SIGMAR1	29	41
COC(=O)c1ccc(CN2CCC[C@@H](S(C)(=O)=O)CC2)cc1Cl	ZINC000450926190	FF	On-Demand	Anodyne	CCR3	42	43
COC(=O)c1ccc(CN2CCC[C@@H](S(C)(=O)=O)CC2)cc1Cl	ZINC000450926190	FF	On-Demand	Anodyne	MCHR1	39	44
COC(=O)c1ccc(CN2CCC[C@H](S(C)(=O)=O)CC2)cc1Cl	ZINC000450926191	FF	On-Demand	Anodyne	AVPR1B	40	33
COC(=O)c1ccc(CN2CCC[C@H](S(C)(=O)=O)CC2)cc1Cl	ZINC000450926191	FF	On-Demand	Anodyne	SIGMAR1	29	41
COC(=O)c1ccc(CN2CCC[C@H](S(C)(=O)=O)CC2)cc1Cl	ZINC000450926191	FF	On-Demand	Anodyne	CCR3	42	43
COC(=O)c1ccc(CN2CCC[C@H](S(C)(=O)=O)CC2)cc1Cl	ZINC000450926191	FF	On-Demand	Anodyne	MCHR1	39	44
CCc1nc(C)c(COc2cc(OC)ccc2Br)o1	ZINC000450926206	EH	On-Demand	Anodyne	SLC22A12	47	38
N#Cc1cc(N[C@H]2CC[C@@H](C(N)=O)C2)ccc1C(F)(F)F	ZINC000450926220	CF	On-Demand	Mild	DHODH	54	41
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1	ZINC000450926221	EE	On-Demand	Bother	MAOB	21	50
NC(=O)[C@@H]1CC[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1	ZINC000450926221	EE	On-Demand	Bother	VCP	20	41
CC(C)NC(=O)c1ccc(N[C@@H]2CC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000450926222	ED	On-Demand	Bother	TAAR1	17	42
COc1cc(OC)nc(N[C@@H]2CC[C@H](C(N)=O)C2)n1	ZINC000450926224	CB	On-Demand	Anodyne	ALS	67	33
Cc1csc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc12	ZINC000450926230	CE	On-Demand	Anodyne	CD38	18	42
CC(=O)c1cc(N[C@@H](C)C2CCCC2)ccc1[N+](=O)[O-]	ZINC000450926245	CH	On-Demand	Bother	AADAC	0	40
COC(=O)[C@H](NC(=O)CC[C@@H]1CCC(=O)N1)c1ccc(F)c(C)c1	ZINC000450926257	ED	On-Demand	Anodyne	LEF	46	32
COC(=O)[C@@H](NC(=O)CC[C@@H]1CCC(=O)N1)c1ccc(F)c(C)c1	ZINC000450926258	ED	On-Demand	Anodyne	LEF	46	32
COC(=O)[C@H](NC(=O)CC[C@H]1CCC(=O)N1)c1ccc(F)c(C)c1	ZINC000450926259	ED	On-Demand	Anodyne	LEF	46	32
COC(=O)[C@@H](NC(=O)CC[C@H]1CCC(=O)N1)c1ccc(F)c(C)c1	ZINC000450926260	ED	On-Demand	Anodyne	LEF	46	32
COC(=O)[C@@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)c1ccc(F)c(C)c1	ZINC000450926270	GG	On-Demand	Anodyne	LEF	49	35
COC(=O)[C@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)c1ccc(F)c(C)c1	ZINC000450926271	GG	On-Demand	Anodyne	LEF	49	35
CCCc1ccc(Cn2c(=O)oc3cc(S(=O)(=O)CCO)ccc32)cc1	ZINC000450926277	GE	On-Demand	Anodyne	MIF	17	42
COC(=O)[C@H]1CN(c2ncccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450926284	EE	On-Demand	Bother	SLC6A1	25	40
COC(=O)[C@H]1CN(c2ncccc2[N+](=O)[O-])C[C@@H]1c1ccccc1	ZINC000450926285	EE	On-Demand	Bother	SLC6A1	25	40
COC(=O)[C@H](NC(=O)[C@H](C)Oc1ccccn1)c1ccc(F)c(C)c1	ZINC000450926286	EE	On-Demand	Anodyne	LEF	47	37
COC(=O)[C@@H](NC(=O)[C@H](C)Oc1ccccn1)c1ccc(F)c(C)c1	ZINC000450926287	EE	On-Demand	Anodyne	LEF	47	37
COC(=O)[C@H](NC(=O)[C@@H](C)Oc1ccccn1)c1ccc(F)c(C)c1	ZINC000450926288	EE	On-Demand	Anodyne	LEF	47	37
COC(=O)[C@@H](NC(=O)[C@@H](C)Oc1ccccn1)c1ccc(F)c(C)c1	ZINC000450926289	EE	On-Demand	Anodyne	LEF	47	37
Cc1cccc(N2CCC[C@@H](NC(=O)N(C)C)C2)c1[N+](=O)[O-]	ZINC000450926299	DE	On-Demand	Bother	MTNR1A	31	41
Cc1cccc(N2CCC[C@@H](NC(=O)N(C)C)C2)c1[N+](=O)[O-]	ZINC000450926299	DE	On-Demand	Bother	MTNR1B	20	41
Cc1cccc(N2CCC[C@H](NC(=O)N(C)C)C2)c1[N+](=O)[O-]	ZINC000450926300	DE	On-Demand	Bother	MTNR1A	31	41
Cc1cccc(N2CCC[C@H](NC(=O)N(C)C)C2)c1[N+](=O)[O-]	ZINC000450926300	DE	On-Demand	Bother	MTNR1B	20	41
COc1cc(CC(=O)N2CC[C@H](N(C)Cc3nccc(N)n3)C2)ccc1Cl	ZINC000450926303	GD	On-Demand	Anodyne	OPRK1	35	40
COc1cc(CC(=O)N2CC[C@@H](N(C)Cc3nccc(N)n3)C2)ccc1Cl	ZINC000450926304	GD	On-Demand	Anodyne	OPRK1	35	40
CCOC(=O)c1c(NC(=O)CN2CCC(O)(C(N)=O)CC2)sc2c1CCC2	ZINC000450926309	GC	On-Demand	Anodyne	NS5B	0	49
CCOC(=O)c1c(NC(=O)CN2CCC(O)(C(N)=O)CC2)sc2c1CCC2	ZINC000450926309	GC	On-Demand	Anodyne	FLT3	0	47
COc1ccc(CNC(=O)CCN2CC[C@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450926314	FC	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CC[C@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450926314	FC	On-Demand	Anodyne	HTR7	32	41
COc1ccc(CNC(=O)CCN2CC[C@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450926314	FC	On-Demand	Anodyne	MTNR1A	41	37
COc1ccc(CNC(=O)CCN2CC[C@@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450926315	FC	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CC[C@@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450926315	FC	On-Demand	Anodyne	HTR7	32	41
COc1ccc(CNC(=O)CCN2CC[C@@H](S(C)(=O)=O)C2)c(OC)c1	ZINC000450926315	FC	On-Demand	Anodyne	MTNR1A	41	37
CCCN(CC1(C(=O)OC)CC1)[C@@H](C)CC(=O)Nc1ccccc1	ZINC000450926335	EG	On-Demand	Anodyne	TIMP3	48	32
CCCN(CC1(C(=O)OC)CC1)[C@H](C)CC(=O)Nc1ccccc1	ZINC000450926336	EG	On-Demand	Anodyne	TIMP3	48	32
Cc1cc(CN2CCC(c3nnc(O)o3)CC2)ccc1Br	ZINC000450926367	FG	On-Demand	Anodyne	SSTR5	48	34
COc1cccnc1CNc1cc(N2CCC[C@@H](C)C2)ncn1	ZINC000450926372	DF	On-Demand	Anodyne	PRCP	22	41
COc1cccnc1CNc1cc(N2CCC[C@@H](C)C2)ncn1	ZINC000450926372	DF	On-Demand	Anodyne	PDE3B	58	35
COc1cccnc1CNc1cc(N2CCC[C@H](C)C2)ncn1	ZINC000450926373	DF	On-Demand	Anodyne	PRCP	22	41
COc1cccnc1CNc1cc(N2CCC[C@H](C)C2)ncn1	ZINC000450926373	DF	On-Demand	Anodyne	PDE3B	58	35
CCCOc1ccc(C(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)c(OC)c1	ZINC000450926374	FI	On-Demand	Anodyne	OXTR	26	42
CCCOc1ccc(C(=O)N2C[C@H]3CCC(=O)c4cccc2c43)c(OC)c1	ZINC000450926375	FI	On-Demand	Anodyne	OXTR	26	42
CCN(CC)S(=O)(=O)c1ccc(NCc2ncccc2OC)c([N+](=O)[O-])c1	ZINC000450926392	GF	On-Demand	Bother	BDKRB1	24	47
CC(C)NS(=O)(=O)N1CCN(Cc2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450926418	GC	On-Demand	Anodyne	ADORA2B	41	35
CC(C)Sc1ccc(CN2CCC(O)(C(N)=O)CC2)cc1	ZINC000450926419	DD	On-Demand	Anodyne	NPFFR1	51	34
CO[C@H](CN1CCC(O)(C(N)=O)CC1)c1ccc(Cl)cc1	ZINC000450926421	DD	On-Demand	Anodyne	CCR1	41	38
CO[C@@H](CN1CCC(O)(C(N)=O)CC1)c1ccc(Cl)cc1	ZINC000450926422	DD	On-Demand	Anodyne	CCR1	41	38
CC(C)NS(=O)(=O)N1CCN(Cc2cccc(C(=O)OC(C)(C)C)c2)CC1	ZINC000450926423	GE	On-Demand	Anodyne	HRH2	26	40
CC(C)NS(=O)(=O)N1CCN(Cc2cccc(C(=O)OC(C)(C)C)c2)CC1	ZINC000450926423	GE	On-Demand	Anodyne	TRY2_BOVIN	87	37
COc1ccc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc2c1F	ZINC000450926426	DD	On-Demand	Anodyne	CD38	23	45
NC(=O)[C@@H]1CC[C@H](Nc2ncccc2S(=O)(=O)N2CCCCC2)C1	ZINC000450926427	FD	On-Demand	Anodyne	EPHX2	21	44
COC(=O)[C@@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)c1ccc(F)c(C)c1	ZINC000450926428	GG	On-Demand	Anodyne	LEF	101	42
COC(=O)[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)c1ccc(F)c(C)c1	ZINC000450926429	GG	On-Demand	Anodyne	LEF	101	42
COC(=O)[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)c1ccc(F)c(C)c1	ZINC000450926430	GG	On-Demand	Anodyne	LEF	101	42
COC(=O)[C@@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)c1ccc(F)c(C)c1	ZINC000450926431	GG	On-Demand	Anodyne	LEF	101	42
CCn1cnc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc21	ZINC000450926436	CC	On-Demand	Anodyne	ADORA1	46	45
CCn1cnc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc21	ZINC000450926436	CC	On-Demand	Anodyne	ADORA2A	22	43
CCn1cnc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc21	ZINC000450926436	CC	On-Demand	Anodyne	Q4VQ11_PIG	42	39
CNS(=O)(=O)NCC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450926437	EB	On-Demand	Anodyne	LUXR	61	34
CNS(=O)(=O)NCC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450926437	EB	On-Demand	Anodyne	TRAR	76	35
CNS(=O)(=O)NCC(=O)N[C@H]1CCOc2ccc(OC)cc21	ZINC000450926437	EB	On-Demand	Anodyne	LASR	45	32
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3sc4c(c23)CCCC4)C1	ZINC000450926448	DF	On-Demand	Anodyne	CD38	22	45
NC(=O)C1(O)CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450926452	DC	On-Demand	Anodyne	MCHR2	42	34
NC(=O)C1(O)CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450926452	DC	On-Demand	Anodyne	NPFFR1	42	33
NC(=O)C1(O)CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450926452	DC	On-Demand	Anodyne	CISD1	0	40
CC[C@@H](O)CC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450926470	FE	On-Demand	Anodyne	P2RX7	22	41
CC[C@H](O)CC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450926471	FE	On-Demand	Anodyne	P2RX7	22	41
CC[C@@H](O)CC(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450926472	FE	On-Demand	Anodyne	P2RX7	22	41
CC[C@H](O)CC(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000450926473	FE	On-Demand	Anodyne	P2RX7	22	41
CC(=O)c1ccc(C#N)c(N[C@@H]2CC[C@H](C(N)=O)C2)c1	ZINC000450926479	CD	On-Demand	Mild	CSNK2A1	53	34
CC(=O)c1ccc(C#N)c(N[C@@H]2CC[C@H](C(N)=O)C2)c1	ZINC000450926479	CD	On-Demand	Mild	HIPK2	41	34
Cc1ccccc1[C@@H](OC[C@H](O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450926482	GD	On-Demand	Anodyne	ABCB1	66	41
Cc1ccccc1[C@@H](OC[C@@H](O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450926483	GD	On-Demand	Anodyne	ABCB1	66	41
Cc1ccccc1[C@H](OC[C@@H](O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450926484	GD	On-Demand	Anodyne	ABCB1	66	41
Cc1ccccc1[C@H](OC[C@H](O)CN1CCC(O)(C(N)=O)CC1)c1ccccc1	ZINC000450926485	GD	On-Demand	Anodyne	ABCB1	66	41
CCc1cc2c(N[C@@H]3CC[C@H](C(N)=O)C3)ncnc2s1	ZINC000450926486	CE	On-Demand	Anodyne	CD38	33	40
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3ccccc23)C1	ZINC000450926487	CD	On-Demand	Anodyne	CD38	47	55
NC(=O)C1(O)CCN(CC(=O)NCCC(c2ccccc2)c2ccccc2)CC1	ZINC000450926490	GD	On-Demand	Anodyne	OPRL1	21	45
NC(=O)C1(O)CCN(CC(=O)NCCC(c2ccccc2)c2ccccc2)CC1	ZINC000450926490	GD	On-Demand	Anodyne	KCNA3	0	42
NC(=O)C1(O)CCN(CC(=O)NCCC(c2ccccc2)c2ccccc2)CC1	ZINC000450926490	GD	On-Demand	Anodyne	TPSAB1	15	43
NC(=O)C1(O)CCN(CC(=O)NCCC(c2ccccc2)c2ccccc2)CC1	ZINC000450926490	GD	On-Demand	Anodyne	US28	0	40
NC(=O)C1(O)CCN(CC(=O)NCCC(c2ccccc2)c2ccccc2)CC1	ZINC000450926490	GD	On-Demand	Anodyne	NPFFR1	57	35
N#Cc1ncccc1N[C@H]1CC[C@@H](C(N)=O)C1	ZINC000450926495	BD	On-Demand	Mild	DHODH	41	35
COC(=O)C1(CSc2nnc(CO)n2-c2ccccc2)CCCC1	ZINC000450926513	EF	On-Demand	Anodyne	VCP	44	39
COc1cccnc1CNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450926530	EF	On-Demand	Anodyne	BDKRB1	23	41
COc1cccc2c(N[C@@H]3CC[C@H](C(N)=O)C3)c(C)cnc12	ZINC000450926531	CF	On-Demand	Anodyne	ATP4A	18	45
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	DRD4	30	44
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	ACHE	22	48
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	LTA4H	17	44
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	SIGMAR1	55	42
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	NPFFR2	50	46
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	PRNP	54	43
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	HDAC1	30	46
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	HDAC2	22	43
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	PLAU	18	45
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	TGFBR1	0	41
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	MCHR1	24	43
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	MCHR2	45	37
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	NPFFR1	73	47
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	NOD1	38	50
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	NOD2	57	48
NC(=O)C1(O)CCN(Cc2ccc(C(=O)Nc3ccccc3)cc2)CC1	ZINC000450926537	FD	On-Demand	Anodyne	KCNK3	54	37
CCOC(=O)c1c(CN2CCC(O)(C(N)=O)CC2)nc2ccccc2c1C	ZINC000450926540	FD	On-Demand	Anodyne	TSPO	15	41
CCC[C@H](O)CN1CCC(c2ccnn2CCC)CC1	ZINC000450926542	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
CCC[C@@H](O)CN1CCC(c2ccnn2CCC)CC1	ZINC000450926543	CF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	45
COc1cccc([C@H]2C[C@H](O)CN2Cc2ccc(C(C)=O)cc2)c1	ZINC000450926544	EG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2C[C@H](O)CN2Cc2ccc(C(C)=O)cc2)c1	ZINC000450926545	EG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H]2C[C@@H](O)CN2Cc2ccc(C(C)=O)cc2)c1	ZINC000450926546	EG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H]2C[C@@H](O)CN2Cc2ccc(C(C)=O)cc2)c1	ZINC000450926547	EG	On-Demand	Anodyne	DRD4	41	32
CCOC(=O)c1nnc(S[C@@H](C)C(=O)Nc2nccs2)s1	ZINC000450926563	EE	On-Demand	Anodyne	MAP	0	41
CCOC(=O)c1nnc(S[C@@H](C)C(=O)Nc2nccs2)s1	ZINC000450926563	EE	On-Demand	Anodyne	MAP1	106	41
CCOC(=O)c1nnc(S[C@H](C)C(=O)Nc2nccs2)s1	ZINC000450926566	EE	On-Demand	Anodyne	MAP	0	41
CCOC(=O)c1nnc(S[C@H](C)C(=O)Nc2nccs2)s1	ZINC000450926566	EE	On-Demand	Anodyne	MAP1	106	41
Cc1c(C#N)c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc2ccccc12	ZINC000450926571	FE	On-Demand	Mild	SMO	42	51
COc1cccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ccnc12	ZINC000450926603	FE	On-Demand	Anodyne	SLC6A7	0	41
CCCn1nccc1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450926626	EH	On-Demand	Anodyne	DRD2	19	41
CCCn1nccc1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450926626	EH	On-Demand	Anodyne	ACHE	22	41
CCCn1nccc1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450926626	EH	On-Demand	Anodyne	SSTR5	47	34
CCCn1nccc1C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450926626	EH	On-Demand	Anodyne	CCR5	46	32
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	HTR1A	41	48
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	DRD2	33	52
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	DRD4	0	48
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	HTR2A	31	48
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	HTR2C	30	54
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	SLC6A1	110	40
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	DRD3	29	48
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	HTR7	52	48
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	SIGMAR1	31	54
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	SLC18A3	0	40
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	HTR3B	0	42
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926630	DF	On-Demand	Anodyne	CYP2J2	71	51
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	HTR1A	41	48
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	DRD2	33	52
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	DRD4	0	48
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	HTR2A	31	48
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	HTR2C	30	54
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	SLC6A1	110	40
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	DRD3	29	48
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	HTR7	52	48
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	SIGMAR1	31	54
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	SLC18A3	0	40
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	HTR3B	0	42
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccccc2)CC1	ZINC000450926632	DF	On-Demand	Anodyne	CYP2J2	71	51
CN(C)C(=O)CSc1nc(C2CC2)nc2sc3c(c12)CCCC3	ZINC000450926635	EH	On-Demand	Anodyne	CEL	18	40
Oc1nnc(C2CCN(C[C@@H]3C[C@H]3c3ccccc3)CC2)o1	ZINC000450926643	CF	On-Demand	Anodyne	CCR5	54	38
COc1cc(CN2CCC(O)(C(N)=O)CC2)ccc1Cl	ZINC000450926645	CD	On-Demand	Anodyne	HTR4	46	34
COc1cc(CN2CCC(O)(C(N)=O)CC2)ccc1Cl	ZINC000450926645	CD	On-Demand	Anodyne	TACR2	24	41
COc1cc(CN2CCC(O)(C(N)=O)CC2)ccc1Cl	ZINC000450926645	CD	On-Demand	Anodyne	MCHR2	56	36
COc1cc(CN2CCC(O)(C(N)=O)CC2)ccc1Cl	ZINC000450926645	CD	On-Demand	Anodyne	CCR8	44	43
COc1cc(CN2CCC(O)(C(N)=O)CC2)ccc1Cl	ZINC000450926645	CD	On-Demand	Anodyne	NPFFR1	52	38
N#Cc1cc2c(nc1N[C@H]1CC[C@@H](C(N)=O)C1)CCC2	ZINC000450926646	CD	On-Demand	Mild	CSNK2A1	47	34
CCS(=O)(=O)c1ccc(CN2CCc3ccc(Br)cc3C2)cc1	ZINC000450926652	GH	On-Demand	Anodyne	NOD2	44	37
COC(=O)[C@@H](NC(=O)CS(=O)(=O)C1CC1)c1ccc(F)c(C)c1	ZINC000450926654	ED	On-Demand	Anodyne	LEF	73	38
COC(=O)[C@H](NC(=O)CS(=O)(=O)C1CC1)c1ccc(F)c(C)c1	ZINC000450926669	ED	On-Demand	Anodyne	LEF	73	38
NC(=O)[C@@H]1CC[C@H](Nc2ncnc3cc(F)c(F)cc23)C1	ZINC000450926672	CD	On-Demand	Anodyne	CD38	36	44
COc1cc(OC)c2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450926676	GD	On-Demand	Anodyne	PDE3A	45	35
COc1cc(OC)c2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450926676	GD	On-Demand	Anodyne	PDE3B	66	35
COc1cc(OC)c2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450926676	GD	On-Demand	Anodyne	LIMK2	37	40
COc1cccnc1CNc1nc(-c2ccccn2)nc2c1CCC2	ZINC000450926695	EE	On-Demand	Anodyne	METAP2	15	40
O=C(CCCN1CCCC[C@H]1C(F)F)c1ccccc1	ZINC000450926711	CH	On-Demand	Anodyne	SLC6A1	101	45
O=C(CCCN1CCCC[C@H]1C(F)F)c1ccccc1	ZINC000450926711	CH	On-Demand	Anodyne	PREP	35	43
O=C(CCCN1CCCC[C@H]1C(F)F)c1ccccc1	ZINC000450926711	CH	On-Demand	Anodyne	CYP2J2	56	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000450926712	DF	On-Demand	Bother	AKR1C4	0	49
O=C(CCCN1CCCC[C@@H]1C(F)F)c1ccccc1	ZINC000450926713	CH	On-Demand	Anodyne	SLC6A1	101	45
O=C(CCCN1CCCC[C@@H]1C(F)F)c1ccccc1	ZINC000450926713	CH	On-Demand	Anodyne	PREP	35	43
O=C(CCCN1CCCC[C@@H]1C(F)F)c1ccccc1	ZINC000450926713	CH	On-Demand	Anodyne	CYP2J2	56	40
O[C@H](Cc1ccccc1)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450926718	EG	On-Demand	Anodyne	VACHT_TETCF	0	51
O[C@H](Cc1ccccc1)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450926718	EG	On-Demand	Anodyne	SLC18A3	23	44
O[C@H](Cc1ccccc1)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450926718	EG	On-Demand	Anodyne	NAMPT	0	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450926719	EC	On-Demand	Anodyne	TGM2	66	45
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450926719	EC	On-Demand	Anodyne	GCK	51	31
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450926719	EC	On-Demand	Anodyne	F13A1	62	42
NC(=O)[C@@H]1CC[C@H](Nc2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450926719	EC	On-Demand	Anodyne	NAMPT	34	41
CN(C)C(=O)N[C@@H]1CCCN(c2ccc3c(Cl)cccc3n2)C1	ZINC000450926720	EG	On-Demand	Anodyne	GPBAR1	0	40
CCOC(=O)c1ccc(CN2CCc3cc(F)cc(C)c3C2)nc1	ZINC000450926730	EG	On-Demand	Anodyne	NOD2	41	42
CN(C)C(=O)N[C@H]1CCCN(c2ccc3c(Cl)cccc3n2)C1	ZINC000450926731	EG	On-Demand	Anodyne	GPBAR1	0	40
COc1cccc(OCCC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450926739	FG	On-Demand	Anodyne	MTNR1A	52	42
COc1cccc(OCCC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450926739	FG	On-Demand	Anodyne	MTNR1B	43	39
COc1cccc(OCCC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450926739	FG	On-Demand	Anodyne	LUXR	69	40
COc1cccc(OCCC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450926739	FG	On-Demand	Anodyne	TRAR	81	38
COc1cccc(OCCC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450926739	FG	On-Demand	Anodyne	LASR	50	36
COc1cccc(OCCC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450926739	FG	On-Demand	Anodyne	PHZR	0	40
COc1cccc(OCCC(=O)N[C@H]2CCOc3ccc(OC)cc32)c1	ZINC000450926739	FG	On-Demand	Anodyne	CVIR	0	44
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	ADORA1	135	57
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	SLC29A1	141	71
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	ADORA2A	49	53
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	ADORA2B	46	51
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	ADK	55	53
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	AHCY	47	42
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	P2RX1	42	36
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	AMD1	38	42
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	ITPR1	51	35
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	NS5B	0	44
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	ADORA3	110	53
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	OXGR1	114	39
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	MTAP	0	42
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	AK	0	56
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	RNASE1	43	34
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	MBTA	0	43
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	DNMT3B	71	36
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	Q4VQ11_PIG	60	48
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	DOT1L	92	38
Cc1ccc(CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C	ZINC000450926740	GC	On-Demand	Anodyne	METJ	0	41
CCOc1cccc(CN(CCO)c2ccc3nnc(C(F)(F)F)n3n2)c1	ZINC000450926742	GF	On-Demand	Anodyne	CETP	0	40
COC(=O)c1ccc(CN2CCC[C@@H](c3nc(N(C)C)no3)C2)cc1Cl	ZINC000450926755	GF	On-Demand	Anodyne	MCHR1	19	40
COC(=O)c1csc(CN2CCc3c(cccc3S(=O)(=O)N(C)C)C2)n1	ZINC000450926756	GD	On-Demand	Anodyne	NOD2	40	36
COC(=O)c1ccc(CN2CCC[C@H](c3nc(N(C)C)no3)C2)cc1Cl	ZINC000450926757	GF	On-Demand	Anodyne	MCHR1	19	40
Cc1cc(N[C@@H]2CC[C@H](C(N)=O)C2)n2c(nc3ccccc32)c1C#N	ZINC000450926758	EF	On-Demand	Mild	CSNK2A1	60	36
Cc1cc(N[C@@H]2CC[C@H](C(N)=O)C2)n2c(nc3ccccc32)c1C#N	ZINC000450926758	EF	On-Demand	Mild	HIPK2	44	36
C[C@H]1CN(c2nc3cc(Cl)ccn3c2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450926765	GD	On-Demand	Mild	SLC6A7	0	40
CN(C)C(=O)CSc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450926767	GC	On-Demand	Bother	MGLL	0	42
CN(C)C(=O)CSc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450926767	GC	On-Demand	Bother	BCL2L1	48	32
CN(C)C(=O)CSc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450926767	GC	On-Demand	Bother	DDIT3	0	41
COC(=O)[C@H]1CN(c2ncnc3sccc23)C[C@@H]1c1ccccc1	ZINC000450926772	EG	On-Demand	Anodyne	SLC6A1	23	44
COC(=O)[C@H]1CN(c2ncnc3sccc23)C[C@H]1c1ccccc1	ZINC000450926775	EG	On-Demand	Anodyne	SLC6A1	23	44
COC(=O)[C@@H]1CN(c2ncnc3sccc23)C[C@H]1c1ccccc1	ZINC000450926776	EG	On-Demand	Anodyne	SLC6A1	23	44
NC(=O)[C@@H]1CC[C@H](Nc2ncc(-c3ccccc3)s2)C1	ZINC000450926784	CF	On-Demand	Anodyne	LUCI_LUCLA	22	41
C[C@H]1CN(c2ccc(S(C)(=O)=O)cc2F)CCN1C(=O)c1cnn(C)c1	ZINC000450926786	GD	On-Demand	Anodyne	SLC6A9	38	46
CN(CCN1CC[C@@H]2OCCN(C)[C@@H]2C1)Cc1ccccc1	ZINC000450926787	DD	On-Demand	Anodyne	SIGMAR1	38	44
CN(CCN1CC[C@@H]2OCCN(C)[C@@H]2C1)Cc1ccccc1	ZINC000450926787	DD	On-Demand	Anodyne	CYP2J2	42	29
NC(=O)[C@@H]1CC[C@H](Nc2ccc3nnc(-c4cc(Cl)cc(Cl)c4)n3n2)C1	ZINC000450926789	GF	On-Demand	Anodyne	MAPK13	50	35
COc1cc([N+](=O)[O-])ccc1CN1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000450926807	FC	On-Demand	Bother	ABHD6	0	44
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	BACE2	28	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	JAK1	0	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	GRM5	19	43
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	TYK2	66	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	CSF1R	19	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	BTK	22	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	LUCI_LUCLA	23	40
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	TAAR1	18	48
NC(=O)[C@@H]1CC[C@H](Nc2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450926812	FG	On-Demand	Anodyne	KCNK3	67	38
NC(=O)C1(O)CCN(Cc2nc(-c3ccccc3)cs2)CC1	ZINC000450926815	DD	On-Demand	Anodyne	NPFFR1	54	35
CN(CCN1CCC(O)(C(N)=O)CC1)Cc1ccc(F)cc1	ZINC000450926818	DC	On-Demand	Anodyne	SIGMAR1	22	50
CN(CCN1CC[C@H]2OCCN(C)[C@@H]2C1)Cc1ccccc1	ZINC000450926834	DD	On-Demand	Anodyne	SIGMAR1	38	44
CN(CCN1CC[C@H]2OCCN(C)[C@@H]2C1)Cc1ccccc1	ZINC000450926834	DD	On-Demand	Anodyne	CYP2J2	42	29
CN(CCN1CC[C@@H]2OCCN(C)[C@H]2C1)Cc1ccccc1	ZINC000450926835	DD	On-Demand	Anodyne	SIGMAR1	38	44
CN(CCN1CC[C@@H]2OCCN(C)[C@H]2C1)Cc1ccccc1	ZINC000450926835	DD	On-Demand	Anodyne	CYP2J2	42	29
CN(CCN1CC[C@H]2OCCN(C)[C@H]2C1)Cc1ccccc1	ZINC000450926836	DD	On-Demand	Anodyne	SIGMAR1	38	44
CN(CCN1CC[C@H]2OCCN(C)[C@H]2C1)Cc1ccccc1	ZINC000450926836	DD	On-Demand	Anodyne	CYP2J2	42	29
Cc1ccnc2[nH]c(SCC(=O)NCCN3CCc4ccccc43)nc12	ZINC000450926841	FF	On-Demand	Anodyne	ENPP1	38	47
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)[C@H]1Cc2ccccc21	ZINC000450926846	EI	On-Demand	Anodyne	RBP4	63	33
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)[C@@H]1Cc2ccccc21	ZINC000450926850	EI	On-Demand	Anodyne	RBP4	63	33
CCOC(=O)[C@@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450926857	EH	On-Demand	Anodyne	OPRK1	0	40
CCOC(=O)[C@@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450926857	EH	On-Demand	Anodyne	OPRL1	20	47
CCOC(=O)[C@@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450926857	EH	On-Demand	Anodyne	NPY2R	45	37
CCOC(=O)[C@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450926859	EH	On-Demand	Anodyne	OPRK1	0	40
CCOC(=O)[C@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450926859	EH	On-Demand	Anodyne	OPRL1	20	47
CCOC(=O)[C@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450926859	EH	On-Demand	Anodyne	NPY2R	45	37
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450926863	DG	On-Demand	Anodyne	DRD2	35	52
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450926863	DG	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450926863	DG	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450926866	DG	On-Demand	Anodyne	DRD2	35	52
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450926866	DG	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450926866	DG	On-Demand	Anodyne	CYP2J2	49	35
CC(C)N1CCC(C(=O)N[C@H]2CCCN(C(C)C)C2)CC1	ZINC000450926868	CE	On-Demand	Anodyne	EPHX2	26	49
CC(C)N1CCC(C(=O)N[C@@H]2CCCN(C(C)C)C2)CC1	ZINC000450926870	CE	On-Demand	Anodyne	EPHX2	26	49
COc1ccc(Cl)c(CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450926872	EI	On-Demand	Anodyne	SIGMAR1	20	43
COc1ccc2c(SCC(=O)N(C)C)ncnc2c1F	ZINC000450926876	CD	On-Demand	Anodyne	PDE6A	41	32
COc1cc(C)nc(SCC(=O)N(C)C)n1	ZINC000450926882	BC	On-Demand	Anodyne	ALS	50	37
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1ccc(F)cc1	ZINC000450926893	EG	On-Demand	Anodyne	DRD4	0	48
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1ccc(F)cc1	ZINC000450926893	EG	On-Demand	Anodyne	IMDH_CRYPV	28	41
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1ccc(F)cc1	ZINC000450926893	EG	On-Demand	Anodyne	SLC27A1	43	40
COC(=O)c1ccc(CN2CCCC[C@@H]2C(F)F)cc1Cl	ZINC000450926912	DH	On-Demand	Anodyne	OPRK1	34	44
CO[C@@H](Cc1ccccc1)CN1CCC(CC(F)(F)F)CC1	ZINC000450926916	DH	On-Demand	Anodyne	SLC6A3	19	45
CO[C@H](Cc1ccccc1)CN1CCC(CC(F)(F)F)CC1	ZINC000450926917	DH	On-Demand	Anodyne	SLC6A3	19	45
COC(=O)c1ccc(CN2CCCC[C@H]2C(F)F)cc1Cl	ZINC000450926919	DH	On-Demand	Anodyne	OPRK1	34	44
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[C@H]2C2CC2)n1	ZINC000450926929	BF	On-Demand	Bother	PRKCQ	47	37
CC(=O)c1ccc(C#N)c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1	ZINC000450926938	FD	On-Demand	Mild	SLC6A7	0	41
COc1ccc(CNC(=O)CCN2C[C@H]3CC[C@H]2c2ccccc23)c(OC)c1	ZINC000450926947	GH	On-Demand	Anodyne	MTNR1A	63	37
COc1ccc(CNC(=O)CCN2C[C@H]3CC[C@H]2c2ccccc23)c(OC)c1	ZINC000450926947	GH	On-Demand	Anodyne	MTNR1B	56	37
CCCn1nccc1C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450926948	EH	On-Demand	Anodyne	DRD2	15	43
CCCn1nccc1C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450926948	EH	On-Demand	Anodyne	SIGMAR1	27	41
CCCn1nccc1C1CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450926948	EH	On-Demand	Anodyne	CCR5	64	38
COC(=O)[C@@H](Sc1nc2c(C)ccnc2[nH]1)c1cc(OC)cc(OC)c1	ZINC000450926963	FG	On-Demand	Anodyne	ENPP1	45	49
COC(=O)[C@H](Sc1nc2c(C)ccnc2[nH]1)c1cc(OC)cc(OC)c1	ZINC000450926966	FG	On-Demand	Anodyne	ENPP1	45	49
CCCOc1ccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)cc1	ZINC000450926967	FG	On-Demand	Anodyne	ENPP1	63	52
C[C@H]1CN(c2ccnc3c([N+](=O)[O-])cccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450926968	GE	On-Demand	Bother	SLC6A7	0	40
COCc1cccc(CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450926990	CH	On-Demand	Anodyne	CYP2C19	22	40
C[C@H]1CN(c2nccc(C(C)(C)C)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450926991	ED	On-Demand	Anodyne	HCRTR1	45	37
Cc1ccnc2[nH]c(SCCCc3ccncc3)nc12	ZINC000450926992	CG	On-Demand	Anodyne	PLA2G7	29	42
COC(=O)c1cccc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)c1Cl	ZINC000450926996	GI	On-Demand	Anodyne	SLC6A1	51	34
COC(=O)c1cccc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)c1Cl	ZINC000450926997	GI	On-Demand	Anodyne	SLC6A1	51	34
COc1cccnc1CNc1ccc(C(=O)NC2CCCC2)nn1	ZINC000450927004	ED	On-Demand	Anodyne	CNR2	19	41
COc1cccnc1CNc1ccc(C(=O)NC2CCCC2)nn1	ZINC000450927004	ED	On-Demand	Anodyne	TYRO3	18	41
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	DRD2	19	42
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	DRD4	36	42
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	ACHE	44	50
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	DRD3	0	41
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	CHRM3	25	44
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	SIGMAR1	50	46
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	CCR3	60	46
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	MCHR1	43	39
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	CACNA1G	29	42
CC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1	ZINC000450927032	CI	On-Demand	Anodyne	CACNA1I	43	47
CC(C)N1CCC[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450927033	EG	On-Demand	Anodyne	MAPK11	22	40
CC(C)N1CCC[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450927033	EG	On-Demand	Anodyne	MAPK14	42	40
CC(C)N1CCC[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450927033	EG	On-Demand	Anodyne	MAPK13	76	39
CC(C)N1CCC[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450927034	EG	On-Demand	Anodyne	MAPK11	22	40
CC(C)N1CCC[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450927034	EG	On-Demand	Anodyne	MAPK14	42	40
CC(C)N1CCC[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450927034	EG	On-Demand	Anodyne	MAPK13	76	39
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1ccccc1Cl	ZINC000450927036	EH	On-Demand	Anodyne	EPHB3	55	35
CCCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450927038	GI	On-Demand	Anodyne	HTR4	40	36
CCCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450927038	GI	On-Demand	Anodyne	SIGMAR1	19	40
CCCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450927038	GI	On-Demand	Anodyne	SSTR5	73	38
CCCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450927038	GI	On-Demand	Anodyne	CCR3	27	40
CCCn1nccc1C1CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450927038	GI	On-Demand	Anodyne	MCHR1	37	43
O=C(CS(=O)(=O)C1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450927039	GF	On-Demand	Anodyne	ADAM17	67	46
O=C(CS(=O)(=O)C1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450927039	GF	On-Demand	Anodyne	CDC25B	23	43
O=C(CS(=O)(=O)C1CC1)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450927039	GF	On-Demand	Anodyne	GYS1	56	33
CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450927043	GF	On-Demand	Bother	COLA	49	34
Cc1c(Cl)cccc1N1CCCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450927057	FI	On-Demand	Anodyne	DRD2	20	41
Cc1c(Cl)cccc1N1CCCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450927057	FI	On-Demand	Anodyne	DRD4	16	40
Cc1c(Cl)cccc1N1CCCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450927057	FI	On-Demand	Anodyne	HTR2A	19	41
Cc1c(Cl)cccc1N1CCCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450927057	FI	On-Demand	Anodyne	HTR2C	20	41
Cc1c(Cl)cccc1N1CCCN(Cc2nnc(C(C)C)s2)CC1	ZINC000450927057	FI	On-Demand	Anodyne	DRD3	17	40
Cc1ccc([C@@H](NC(=O)CN2CCC(F)(c3ccccn3)CC2)C2CC2)cc1	ZINC000450927069	GH	On-Demand	Anodyne	DRD4	0	42
Cc1ccc([C@H](NC(=O)CN2CCC(F)(c3ccccn3)CC2)C2CC2)cc1	ZINC000450927070	GH	On-Demand	Anodyne	DRD4	0	42
CCOCCCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450927086	FH	On-Demand	Anodyne	RORB	0	40
CC(=O)[C@](C)(O)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450927089	DD	On-Demand	Anodyne	SCD1	0	44
CC(=O)[C@@](C)(O)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450927091	DD	On-Demand	Anodyne	SCD1	0	44
CN(CCN1CCCC[C@H]1c1cnn(C)c1)Cc1ccccc1	ZINC000450927098	DG	On-Demand	Anodyne	SIGMAR1	15	43
CN(CCN1CCCC[C@@H]1c1cnn(C)c1)Cc1ccccc1	ZINC000450927103	DG	On-Demand	Anodyne	SIGMAR1	15	43
CCC(CC)Oc1ccc(C(=O)N[C@H](C(=O)OC)c2ccc(O)cc2)cc1	ZINC000450927112	FH	On-Demand	Anodyne	UTS2	42	37
CCC(CC)Oc1ccc(C(=O)N[C@@H](C(=O)OC)c2ccc(O)cc2)cc1	ZINC000450927113	FH	On-Demand	Anodyne	UTS2	42	37
COc1ccc(N2CCN(c3ncnc4c3ncn4C3CC3)CC2)nc1	ZINC000450927120	FD	On-Demand	Anodyne	EBP	23	40
C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC(F)(c2ccccn2)CC1	ZINC000450927126	GI	On-Demand	Anodyne	ADAM17	39	47
C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N1CCC(F)(c2ccccn2)CC1	ZINC000450927127	GI	On-Demand	Anodyne	ADAM17	39	47
C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC(F)(c2ccccn2)CC1	ZINC000450927128	GI	On-Demand	Anodyne	ADAM17	39	47
C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N1CCC(F)(c2ccccn2)CC1	ZINC000450927129	GI	On-Demand	Anodyne	ADAM17	39	47
Cc1cc(C)n(-c2ccc(CN3CCC(F)(c4ccccn4)CC3)cc2)n1	ZINC000450927130	FI	On-Demand	Anodyne	MCHR2	55	33
CC(C)N1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450927152	FH	On-Demand	Anodyne	RBP4	60	38
CC(C)N1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450927153	FH	On-Demand	Anodyne	RBP4	60	38
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(Br)cc1	ZINC000450927154	GI	On-Demand	Anodyne	THRA	0	43
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(Br)cc1	ZINC000450927154	GI	On-Demand	Anodyne	DRD2	30	46
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(Br)cc1	ZINC000450927154	GI	On-Demand	Anodyne	DRD1	15	43
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(Br)cc1	ZINC000450927154	GI	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(Br)cc1	ZINC000450927154	GI	On-Demand	Anodyne	ERG2	22	46
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(Br)cc1	ZINC000450927154	GI	On-Demand	Anodyne	SLC18A3	25	45
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(Br)cc1	ZINC000450927154	GI	On-Demand	Anodyne	CYP2J2	60	42
Cc1cccc(CN(C)c2ccc(S(=O)(=O)NCC3CC3)cn2)n1	ZINC000450927168	EE	On-Demand	Anodyne	NPY1R	44	35
Cc1cccc(CN(C)c2ccc(S(=O)(=O)NCC3CC3)cn2)n1	ZINC000450927168	EE	On-Demand	Anodyne	NPY2R	64	38
CC[C@H](C)[C@H](O)C(=O)N[C@H]1CCCN(C(C)C)C1	ZINC000450927173	CD	On-Demand	Anodyne	BIRC2	40	34
CC[C@H](C)[C@@H](O)C(=O)N[C@H]1CCCN(C(C)C)C1	ZINC000450927174	CD	On-Demand	Anodyne	BIRC2	40	34
CC[C@H](C)[C@H](O)C(=O)N[C@@H]1CCCN(C(C)C)C1	ZINC000450927175	CD	On-Demand	Anodyne	BIRC2	40	34
CC[C@H](C)[C@@H](O)C(=O)N[C@@H]1CCCN(C(C)C)C1	ZINC000450927176	CD	On-Demand	Anodyne	BIRC2	40	34
C[C@@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927177	DE	On-Demand	Anodyne	HTR1A	49	48
C[C@@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927177	DE	On-Demand	Anodyne	DRD2	22	46
C[C@@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927177	DE	On-Demand	Anodyne	HTR2A	32	50
C[C@@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927177	DE	On-Demand	Anodyne	DRD3	24	41
C[C@@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927177	DE	On-Demand	Anodyne	HTR7	44	49
C[C@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927178	DE	On-Demand	Anodyne	HTR1A	49	48
C[C@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927178	DE	On-Demand	Anodyne	DRD2	22	46
C[C@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927178	DE	On-Demand	Anodyne	HTR2A	32	50
C[C@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927178	DE	On-Demand	Anodyne	DRD3	24	41
C[C@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927178	DE	On-Demand	Anodyne	HTR7	44	49
CCOc1ccc(NC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)cc1	ZINC000450927189	GI	On-Demand	Anodyne	ADORA2B	40	36
CCOc1ccc(NC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)cc1	ZINC000450927189	GI	On-Demand	Anodyne	KCNK3	32	47
CCOc1ccc(NC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)cc1	ZINC000450927189	GI	On-Demand	Anodyne	KCNK9	28	47
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1cc(C(C)(C)C)nn1C	ZINC000450927190	GH	On-Demand	Anodyne	TNF	45	33
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1cc(C(C)(C)C)nn1C	ZINC000450927190	GH	On-Demand	Anodyne	CTSV	44	31
COC(=O)c1coc(CN2CCc3ccc(Br)cc3C2)n1	ZINC000450927194	FF	On-Demand	Anodyne	ABCB1	0	44
COc1cccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450927195	FD	On-Demand	Bother	TACR3	18	48
COc1cccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450927195	FD	On-Demand	Bother	SSTR1	57	39
COc1ccc(-n2c(C)nnc2SCc2cn(C)nc2C)cc1	ZINC000450927220	EF	On-Demand	Anodyne	WNT3A	26	53
COc1ccc(-n2c(C)nnc2SCc2cn(C)nc2C)cc1	ZINC000450927220	EF	On-Demand	Anodyne	AXIN2	0	59
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H]2CCCN(C(C)C)C2)c1	ZINC000450927226	FG	On-Demand	Anodyne	DRD3	0	40
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H]2CCCN(C(C)C)C2)c1	ZINC000450927227	FG	On-Demand	Anodyne	DRD3	0	40
C[C@H]1CN(c2ccnc3cc(F)c(Cl)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450927228	GG	On-Demand	Anodyne	HCRTR1	46	34
C[C@H]1CN(c2ccnc3cc(F)c(Cl)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450927228	GG	On-Demand	Anodyne	HCRTR2	33	40
COc1cc(CN2CCC3(CCOCC3)CC2)ccc1Cl	ZINC000450927245	DH	On-Demand	Anodyne	SIGMAR1	37	43
COc1cc(CN2CCC3(CCOCC3)CC2)ccc1Cl	ZINC000450927245	DH	On-Demand	Anodyne	SSTR5	47	37
COc1cc(CN2CCC3(CCOCC3)CC2)ccc1Cl	ZINC000450927245	DH	On-Demand	Anodyne	CCR8	41	42
COC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ccsc1	ZINC000450927246	EF	On-Demand	Anodyne	MTNR1A	30	44
COC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)c1ccsc1	ZINC000450927248	EF	On-Demand	Anodyne	MTNR1A	30	44
COc1cc(COc2c(C(C)=O)cccc2C(F)(F)F)ccn1	ZINC000450927265	EH	On-Demand	Anodyne	KCNA3	24	41
COc1cc(COc2c(C(C)=O)cccc2C(F)(F)F)ccn1	ZINC000450927265	EH	On-Demand	Anodyne	NR1H2	56	36
C[C@H]1CN(c2nc3cccc(F)c3s2)CCN1C(=O)c1cnn(C)c1	ZINC000450927270	FF	On-Demand	Anodyne	SLC6A7	0	42
COC(=O)c1coc(CSc2nnc(C)n2-c2ccc(OC)cc2)n1	ZINC000450927290	FF	On-Demand	Anodyne	WNT3A	25	52
COC(=O)c1coc(CSc2nnc(C)n2-c2ccc(OC)cc2)n1	ZINC000450927290	FF	On-Demand	Anodyne	AXIN2	0	57
CC(=O)CCCCCS(=O)(=O)c1ccc(C)c(C)c1	ZINC000450927291	CG	On-Demand	Anodyne	THRB	28	44
COc1cc(CN2CC[C@@H]3OCCN(C)[C@@H]3C2)ccc1Cl	ZINC000450927297	DE	On-Demand	Anodyne	DRD4	28	44
COc1cc(CN2CC[C@@H]3OCCN(C)[C@@H]3C2)ccc1Cl	ZINC000450927297	DE	On-Demand	Anodyne	SSTR5	56	39
COc1cc(CN2CC[C@@H]3OCCN(C)[C@H]3C2)ccc1Cl	ZINC000450927298	DE	On-Demand	Anodyne	DRD4	28	44
COc1cc(CN2CC[C@@H]3OCCN(C)[C@H]3C2)ccc1Cl	ZINC000450927298	DE	On-Demand	Anodyne	SSTR5	56	39
COc1cc(CN2CC[C@H]3OCCN(C)[C@@H]3C2)ccc1Cl	ZINC000450927299	DE	On-Demand	Anodyne	DRD4	28	44
COc1cc(CN2CC[C@H]3OCCN(C)[C@@H]3C2)ccc1Cl	ZINC000450927299	DE	On-Demand	Anodyne	SSTR5	56	39
COc1cc(CN2CC[C@H]3OCCN(C)[C@H]3C2)ccc1Cl	ZINC000450927300	DE	On-Demand	Anodyne	DRD4	28	44
COc1cc(CN2CC[C@H]3OCCN(C)[C@H]3C2)ccc1Cl	ZINC000450927300	DE	On-Demand	Anodyne	SSTR5	56	39
Cc1ccnc2[nH]c(SCC(=O)Nc3ccccc3SC[C@H](C)C#N)nc12	ZINC000450927312	GI	On-Demand	Mild	ENPP1	75	51
Cc1ccnc2[nH]c(SCC(=O)Nc3ccccc3SC[C@@H](C)C#N)nc12	ZINC000450927316	GI	On-Demand	Mild	ENPP1	75	51
O=C(COc1ccc(C(F)(F)F)cc1F)CC1CC1	ZINC000450927340	CH	On-Demand	Anodyne	LIPC	0	45
O=C(COc1ccc(C(F)(F)F)cc1F)CC1CC1	ZINC000450927340	CH	On-Demand	Anodyne	PTGDR2	29	41
O=C(COc1ccc(C(F)(F)F)cc1F)CC1CC1	ZINC000450927340	CH	On-Demand	Anodyne	LIPG	54	45
Cc1ccnc2[nH]c(SCC(=O)NCC#N)nc12	ZINC000450927350	CC	On-Demand	Mild	ENPP1	63	41
CS(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450927355	DF	On-Demand	Anodyne	HRH3	28	45
CS(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450927355	DF	On-Demand	Anodyne	SIGMAR1	32	46
CS(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450927355	DF	On-Demand	Anodyne	BIRC2	33	42
CS(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450927356	DF	On-Demand	Anodyne	HRH3	28	45
CS(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450927356	DF	On-Demand	Anodyne	SIGMAR1	32	46
CS(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450927356	DF	On-Demand	Anodyne	BIRC2	33	42
COc1ccc(-n2c(C)nnc2SCC[C@H]2CCOC2)cc1	ZINC000450927398	DG	On-Demand	Anodyne	WNT3A	22	45
COc1ccc(-n2c(C)nnc2SCC[C@H]2CCOC2)cc1	ZINC000450927398	DG	On-Demand	Anodyne	AXIN2	0	50
COc1ccc(-n2c(C)nnc2SCC[C@@H]2CCOC2)cc1	ZINC000450927399	DG	On-Demand	Anodyne	WNT3A	22	45
COc1ccc(-n2c(C)nnc2SCC[C@@H]2CCOC2)cc1	ZINC000450927399	DG	On-Demand	Anodyne	AXIN2	0	50
CCC(=O)CCCN1CCC(F)(c2cccnc2)CC1	ZINC000450927401	CG	On-Demand	Anodyne	CCR1	15	44
C[C@H]1CN(c2nccc(C#N)c2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450927412	ED	On-Demand	Mild	SMO	0	44
COc1cccnc1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000450927420	EF	On-Demand	Bother	TAAR1	18	46
O=c1c(C(F)(F)F)nc2ccc(C(F)(F)F)cc2n1CCF	ZINC000450927423	EG	On-Demand	Mild	RORB	0	40
C[C@H](O)CCCN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450927424	DE	On-Demand	Anodyne	CPT1A	30	40
C[C@@H](O)CCCN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450927425	DE	On-Demand	Anodyne	CPT1A	30	40
C[C@@H](O)CCCN1CCOC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000450927426	DE	On-Demand	Anodyne	CPT1A	30	40
C[C@H](O)CCCN1CCOC[C@H]1c1nc(-c2ccccc2)no1	ZINC000450927427	DE	On-Demand	Anodyne	CPT1A	30	40
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	THRA	0	43
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	DRD2	39	60
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	DRD1	25	57
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	DRD4	28	60
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	HTR2A	24	63
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	DRD3	0	60
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	ERG2	28	60
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	SLC18A3	24	58
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	PLD2	49	34
O=C(CCCN1CCC2(CCOCC2)CC1)c1ccc(F)cc1	ZINC000450927435	DH	On-Demand	Anodyne	CYP2J2	60	42
FC1(c2ccccn2)CCN(Cc2cccc(Br)c2)CC1	ZINC000450927438	EI	On-Demand	Anodyne	SIGMAR1	40	40
COc1ccc(N2CCN(c3nc(C(N)=O)cs3)CC2)nc1	ZINC000450927441	DC	On-Demand	Anodyne	NPBWR1	49	38
COC(=O)[C@@H](NC(=O)CN1CCC(F)(c2ccccn2)CC1)C(C)C	ZINC000450927444	FD	On-Demand	Anodyne	ELANE	60	38
Cc1cc(Cl)ccc1NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450927445	FH	On-Demand	Anodyne	DRD4	0	51
CN(CCN1CCC(F)(c2ccccn2)CC1)Cc1ccccc1	ZINC000450927448	EG	On-Demand	Anodyne	SIGMAR1	33	44
CCOC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)nc1	ZINC000450927449	EG	On-Demand	Anodyne	SSTR5	46	39
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC1CCN(C2CC2)CC1	ZINC000450927463	GG	On-Demand	Anodyne	SIGMAR1	16	42
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC1CCN(C2CC2)CC1	ZINC000450927463	GG	On-Demand	Anodyne	CCR2	54	44
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC1CCN(C2CC2)CC1	ZINC000450927463	GG	On-Demand	Anodyne	SLC6A5	32	40
Cc1cccc(CN(C)c2cc(NCC3CC3)ncn2)n1	ZINC000450927478	CF	On-Demand	Anodyne	GPR39	0	43
COC(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)c(F)c1	ZINC000450927487	EG	On-Demand	Anodyne	BDKRB1	39	40
CCOc1cccc(CNC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c1	ZINC000450927488	GI	On-Demand	Anodyne	ROCK2	20	41
CCOc1cccc(CNC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c1	ZINC000450927488	GI	On-Demand	Anodyne	NR1H3	42	37
CCOc1cccc(CNC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c1	ZINC000450927488	GI	On-Demand	Anodyne	NR1H2	55	36
CCOc1cccc(CNC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c1	ZINC000450927488	GI	On-Demand	Anodyne	KCNK3	19	42
CCOc1cccc(CNC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c1	ZINC000450927488	GI	On-Demand	Anodyne	PDS	82	41
COc1cc([N+](=O)[O-])ccc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450927490	EG	On-Demand	Bother	ABHD6	0	46
CCOC(=O)c1ccc(CN2CCC=C(c3ccccc3)C2)nc1	ZINC000450927509	DH	On-Demand	Anodyne	P2RY12	40	39
CCOC(=O)c1ccc(CN2CCC=C(c3ccccc3)C2)nc1	ZINC000450927509	DH	On-Demand	Anodyne	NOD2	25	41
CC(C)N1CCC[C@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC000450927530	DG	On-Demand	Anodyne	BIRC2	42	36
CC(C)N1CCC[C@@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC000450927531	DG	On-Demand	Anodyne	BIRC2	42	36
Cc1oc(-c2ccsc2)nc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450927532	FJ	On-Demand	Anodyne	PDE8B	60	35
Cc1ccc(CN(C)c2cc(N3CCOCC3)ncn2)cc1C	ZINC000450927536	DF	On-Demand	Anodyne	ADK	29	40
Cc1ccc(CN(C)c2cc(N3CCOCC3)ncn2)cc1C	ZINC000450927536	DF	On-Demand	Anodyne	EPHB4	61	39
COC(=O)Cc1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450927542	DD	On-Demand	Bother	GSTM2	46	34
COC(=O)Cc1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450927542	DD	On-Demand	Bother	GSTP1	56	38
COc1ccc(CNC(=O)CCN2CCOCC23CC3)c(OC)c1	ZINC000450927553	ED	On-Demand	Anodyne	MTNR1A	49	37
COc1ccc(CNC(=O)CCN2CCOCC23CC3)c(OC)c1	ZINC000450927553	ED	On-Demand	Anodyne	MTNR1B	34	40
CCc1ccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)s1	ZINC000450927560	EG	On-Demand	Anodyne	ENPP1	55	38
COc1ccc(-n2c(C)nnc2SCCCCCC(C)=O)cc1	ZINC000450927565	EH	On-Demand	Anodyne	WNT3A	22	45
COc1ccc(-n2c(C)nnc2SCCCCCC(C)=O)cc1	ZINC000450927565	EH	On-Demand	Anodyne	AXIN2	0	50
CN(C)C(=O)CSc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450927569	DF	On-Demand	Bother	GSTM2	46	36
CN(C)C(=O)CSc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000450927569	DF	On-Demand	Bother	AADAC	0	45
Cc1nccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1Cl	ZINC000450927579	EE	On-Demand	Anodyne	SLC6A7	0	48
C[C@H]1CN(c2ccc3c(Cl)cccc3n2)CCN1C(=O)c1cnn(C)c1	ZINC000450927582	FF	On-Demand	Anodyne	SMO	0	44
C[C@H]1CN(c2ccc3c(Cl)cccc3n2)CCN1C(=O)c1cnn(C)c1	ZINC000450927582	FF	On-Demand	Anodyne	SLC6A7	0	44
Cc1ccnc2[nH]c(SCCCCn3ccnc3C)nc12	ZINC000450927593	DG	On-Demand	Anodyne	ENPP1	25	50
N#CC1(COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450927605	CH	On-Demand	Mild	PTGDR2	20	43
CC(=O)CCCCCOc1ccc([N+](=O)[O-])c(CO)c1	ZINC000450927619	CF	On-Demand	Bother	P2RY12	22	40
CC(=O)CCCCCOc1ccc([N+](=O)[O-])c(CO)c1	ZINC000450927619	CF	On-Demand	Bother	PLA2G4B	59	31
CN(C)S(=O)(=O)c1cccc2c1CCN(CCc1ccc(Cl)cc1)C2	ZINC000450927626	GG	On-Demand	Anodyne	DRD4	15	41
CN(C)S(=O)(=O)c1cccc2c1CCN(CCc1ccc(Cl)cc1)C2	ZINC000450927626	GG	On-Demand	Anodyne	SIGMAR1	17	43
Cc1ccc(CN(C)c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1C	ZINC000450927635	GE	On-Demand	Anodyne	NAMPT	18	40
CCC[C@@H](O)CN(CCC)[C@@H](C)CC(=O)Nc1ccccc1	ZINC000450927655	DG	On-Demand	Anodyne	LTA4H	20	41
CCC[C@@H](O)CN(CCC)[C@H](C)CC(=O)Nc1ccccc1	ZINC000450927656	DG	On-Demand	Anodyne	LTA4H	20	41
CCC[C@H](O)CN(CCC)[C@@H](C)CC(=O)Nc1ccccc1	ZINC000450927657	DG	On-Demand	Anodyne	LTA4H	20	41
CCC[C@H](O)CN(CCC)[C@H](C)CC(=O)Nc1ccccc1	ZINC000450927658	DG	On-Demand	Anodyne	LTA4H	20	41
CCCC[C@H](SCc1cccc(S(C)(=O)=O)c1)C(=O)OC	ZINC000450927673	EG	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
CCCC[C@@H](SCc1cccc(S(C)(=O)=O)c1)C(=O)OC	ZINC000450927674	EG	On-Demand	Anodyne	Q9JN24_ECOLX	0	40
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	CHRM2	19	41
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	DRD2	28	46
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	DRD4	65	47
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	ACHE	36	49
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	DRD3	0	41
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	AVPR1A	26	44
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	CHRM3	18	41
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	HRH3	17	44
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	SIGMAR1	58	48
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	CXCR3	34	43
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	CYP2J2	44	31
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	SCD1	15	44
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	NOD1	31	40
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	NOD2	48	41
CC(=O)c1ccc(CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000450927681	EH	On-Demand	Anodyne	NAMPT	0	42
Cc1cccc(CN2CCOC[C@H]2c2nc(-c3ccccc3)no2)n1	ZINC000450927682	EG	On-Demand	Anodyne	COLA	36	40
Cc1cccc(CN2CCOC[C@@H]2c2nc(-c3ccccc3)no2)n1	ZINC000450927684	EG	On-Demand	Anodyne	COLA	36	40
Nc1ncccc1CN1CCC(c2ccc(Br)cc2)CC1	ZINC000450927701	EH	On-Demand	Anodyne	VACHT_TETCF	0	40
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	HTR1A	17	56
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	DRD2	40	59
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	DRD1	18	46
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	DRD4	27	44
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	HTR2A	45	52
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	HTR2C	20	56
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	HRH1	15	51
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	ADRA1B	17	44
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	DRD3	16	51
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	ERG2	20	44
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	HTR1F	39	46
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	SIGMAR1	16	53
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	CCR3	25	40
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	SLC18A3	0	45
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	HTR3B	0	46
CCCn1nccc1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450927712	FI	On-Demand	Anodyne	CYP2J2	63	45
N#CCc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450927737	DH	On-Demand	Mild	SIGMAR1	29	40
CCC(=O)CCCN1CCC(CC(F)(F)F)CC1	ZINC000450927745	CG	On-Demand	Anodyne	CYP2J2	40	33
CC(=O)NCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450927746	CD	On-Demand	Anodyne	HTR1A	38	42
CC(=O)NCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450927746	CD	On-Demand	Anodyne	ADRA1D	71	39
CC(=O)NCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450927746	CD	On-Demand	Anodyne	HTR2A	42	44
CC(=O)NCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450927746	CD	On-Demand	Anodyne	ADRA1A	68	40
CC(=O)NCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450927746	CD	On-Demand	Anodyne	ADRA1B	62	44
CC(=O)NCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450927746	CD	On-Demand	Anodyne	DRD3	57	38
CC(=O)NCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450927746	CD	On-Demand	Anodyne	CCR1	28	43
COC(=O)C1(CN2CCN(c3cccc(Br)c3)CC2)CC1	ZINC000450927747	FF	On-Demand	Anodyne	HTR1A	22	43
COC(=O)C1(CN2CCN(c3cccc(Br)c3)CC2)CC1	ZINC000450927747	FF	On-Demand	Anodyne	DRD4	44	35
FC1(c2ccccn2)CCN(Cc2cc3ccccc3o2)CC1	ZINC000450927759	DI	On-Demand	Anodyne	HTR2B	16	53
FC1(c2ccccn2)CCN(Cc2cc3ccccc3o2)CC1	ZINC000450927759	DI	On-Demand	Anodyne	SIGMAR1	21	48
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)CC(C)(C)C	ZINC000450927765	DI	On-Demand	Anodyne	NR1H2	48	33
COC(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Cl	ZINC000450927792	FH	On-Demand	Anodyne	MCHR2	57	37
COC(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Cl	ZINC000450927792	FH	On-Demand	Anodyne	NPFFR1	42	37
Cc1cc(Cl)ccc1NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450927806	GI	On-Demand	Anodyne	PANK3	0	42
Cc1cc(Cl)ccc1NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450927807	GI	On-Demand	Anodyne	PANK3	0	42
O=C(CN1CCC(F)(c2ccccn2)CC1)NC1(c2ccccc2)CCC1	ZINC000450927819	FH	On-Demand	Anodyne	TACR3	63	33
C[C@H]1CN(c2ncnc3cc(F)c(F)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450927822	FD	On-Demand	Anodyne	PDE3A	42	32
C[C@H]1CN(c2ncnc3cc(F)c(F)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450927822	FD	On-Demand	Anodyne	PDGFRB	23	41
C[C@H]1CN(c2ncnc3cc(F)c(F)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450927822	FD	On-Demand	Anodyne	PDE3B	62	32
C[C@H]1CN(c2ncnc3cc(F)c(F)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450927822	FD	On-Demand	Anodyne	LIMK2	63	39
C[C@H]1CN(c2ncnc3cc(F)c(F)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450927822	FD	On-Demand	Anodyne	SLC6A7	0	42
O=S(=O)(CCCN1CCC(F)(c2ccccn2)CC1)c1ccc(F)cc1	ZINC000450927824	GG	On-Demand	Anodyne	DRD4	15	42
O=S(=O)(CCCN1CCC(F)(c2ccccn2)CC1)c1ccc(F)cc1	ZINC000450927824	GG	On-Demand	Anodyne	HTR2A	18	42
O=S(=O)(CCCN1CCC(F)(c2ccccn2)CC1)c1ccc(F)cc1	ZINC000450927824	GG	On-Demand	Anodyne	HTR7	18	42
CCOc1ccc(CN(C)C(=O)CSc2nc3c(C)ccnc3[nH]2)cc1	ZINC000450927836	FG	On-Demand	Anodyne	ENPP1	41	33
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450927837	CF	On-Demand	Anodyne	SLC6A1	45	38
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450927837	CF	On-Demand	Anodyne	SLC18A3	38	51
CC(=O)c1cccc(C(F)(F)F)c1OCC1CCN(C(=O)C(C)(C)C)CC1	ZINC000450927840	GJ	On-Demand	Anodyne	SLC9A1	28	42
CC(=O)c1cccc(C(F)(F)F)c1OCC1CCN(C(=O)C(C)(C)C)CC1	ZINC000450927840	GJ	On-Demand	Anodyne	RBP4	47	38
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450927841	CF	On-Demand	Anodyne	SLC6A1	45	38
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450927841	CF	On-Demand	Anodyne	SLC18A3	38	51
CN(c1nc(-c2ccccc2)ns1)C1CCN(CC(F)(F)F)CC1	ZINC000450927882	FH	On-Demand	Anodyne	HPGDS	23	43
CCS(=O)(=O)c1ccc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)cc1	ZINC000450927887	FI	On-Demand	Anodyne	SLC18A3	29	45
COc1ccc([C@H](NC(=O)CSc2nc3c(C)ccnc3[nH]2)C2CC2)cc1	ZINC000450927892	GH	On-Demand	Anodyne	ENPP1	82	56
COc1ccc([C@H](NC(=O)CSc2nc3c(C)ccnc3[nH]2)C2CC2)cc1	ZINC000450927892	GH	On-Demand	Anodyne	FOLK	0	40
COc1ccc([C@@H](NC(=O)CSc2nc3c(C)ccnc3[nH]2)C2CC2)cc1	ZINC000450927893	GH	On-Demand	Anodyne	ENPP1	82	56
COc1ccc([C@@H](NC(=O)CSc2nc3c(C)ccnc3[nH]2)C2CC2)cc1	ZINC000450927893	GH	On-Demand	Anodyne	FOLK	0	40
CCN(CC(=O)NC(C)C)C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450927920	ED	On-Demand	Anodyne	ENPP1	41	33
O=C(CCCN1CCOC[C@H]1c1ncnn1-c1ccccc1)c1ccc(F)cc1	ZINC000450927934	GG	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1CCOC[C@H]1c1ncnn1-c1ccccc1)c1ccc(F)cc1	ZINC000450927934	GG	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCOC[C@H]1c1ncnn1-c1ccccc1)c1ccc(F)cc1	ZINC000450927934	GG	On-Demand	Anodyne	CYP2J2	47	33
O=C(CCCN1CCOC[C@@H]1c1ncnn1-c1ccccc1)c1ccc(F)cc1	ZINC000450927935	GG	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1CCOC[C@@H]1c1ncnn1-c1ccccc1)c1ccc(F)cc1	ZINC000450927935	GG	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCOC[C@@H]1c1ncnn1-c1ccccc1)c1ccc(F)cc1	ZINC000450927935	GG	On-Demand	Anodyne	CYP2J2	47	33
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927945	DE	On-Demand	Anodyne	DRD2	33	44
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927945	DE	On-Demand	Anodyne	HTR2A	32	54
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927945	DE	On-Demand	Anodyne	HTR2C	28	57
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927945	DE	On-Demand	Anodyne	SLC18A3	23	44
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927945	DE	On-Demand	Anodyne	HTR3B	0	46
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927945	DE	On-Demand	Anodyne	CYP2J2	64	45
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927946	DE	On-Demand	Anodyne	DRD2	33	44
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927946	DE	On-Demand	Anodyne	HTR2A	32	54
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927946	DE	On-Demand	Anodyne	HTR2C	28	57
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927946	DE	On-Demand	Anodyne	SLC18A3	23	44
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927946	DE	On-Demand	Anodyne	HTR3B	0	46
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927946	DE	On-Demand	Anodyne	CYP2J2	64	45
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927947	DE	On-Demand	Anodyne	DRD2	33	44
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927947	DE	On-Demand	Anodyne	HTR2A	32	54
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927947	DE	On-Demand	Anodyne	HTR2C	28	57
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927947	DE	On-Demand	Anodyne	SLC18A3	23	44
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927947	DE	On-Demand	Anodyne	HTR3B	0	46
CN1CCO[C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@H]21	ZINC000450927947	DE	On-Demand	Anodyne	CYP2J2	64	45
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927948	DE	On-Demand	Anodyne	DRD2	33	44
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927948	DE	On-Demand	Anodyne	HTR2A	32	54
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927948	DE	On-Demand	Anodyne	HTR2C	28	57
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927948	DE	On-Demand	Anodyne	SLC18A3	23	44
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927948	DE	On-Demand	Anodyne	HTR3B	0	46
CN1CCO[C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C[C@@H]21	ZINC000450927948	DE	On-Demand	Anodyne	CYP2J2	64	45
C[C@H]1CN(c2c(C#N)cccc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450927949	ED	On-Demand	Mild	LIMK2	41	30
C[C@H]1CN(c2ccncc2Br)CCN1C(=O)c1cnn(C)c1	ZINC000450927950	FD	On-Demand	Anodyne	SMO	0	45
C[C@H]1CN(c2ccncc2Br)CCN1C(=O)c1cnn(C)c1	ZINC000450927950	FD	On-Demand	Anodyne	SLC6A7	0	44
CCC[C@H](O)CN1CCc2ccc(S(C)(=O)=O)cc2CC1	ZINC000450927954	DD	On-Demand	Anodyne	PNMT	15	42
CCC[C@@H](O)CN1CCc2ccc(S(C)(=O)=O)cc2CC1	ZINC000450927955	DD	On-Demand	Anodyne	PNMT	15	42
COc1ccc(-n2c(C)nnc2SCCN(C)Cc2ccccc2)cc1	ZINC000450927957	FH	On-Demand	Anodyne	AXIN2	0	48
COCCOC[C@@H](O)CN1CCc2ccc(Br)cc2C1	ZINC000450927980	ED	On-Demand	Anodyne	HSP90AB1	39	45
COCCOC[C@H](O)CN1CCc2ccc(Br)cc2C1	ZINC000450927981	ED	On-Demand	Anodyne	HSP90AB1	39	45
CCS(=O)(=O)c1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1	ZINC000450928015	GJ	On-Demand	Anodyne	CACNA1B	46	34
CCS(=O)(=O)c1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1	ZINC000450928015	GJ	On-Demand	Anodyne	PHES	0	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450928030	FI	On-Demand	Anodyne	LDLR	0	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450928030	FI	On-Demand	Anodyne	CCKBR	0	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450928030	FI	On-Demand	Anodyne	CSF1R	19	44
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450928030	FI	On-Demand	Anodyne	BTK	20	43
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450928030	FI	On-Demand	Anodyne	TAAR1	22	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450928030	FI	On-Demand	Anodyne	KCNK3	98	53
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@H](O)C1CCC1	ZINC000450928030	FI	On-Demand	Anodyne	KCNK9	53	53
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450928031	FI	On-Demand	Anodyne	LDLR	0	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450928031	FI	On-Demand	Anodyne	CCKBR	0	40
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450928031	FI	On-Demand	Anodyne	CSF1R	19	44
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450928031	FI	On-Demand	Anodyne	BTK	20	43
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450928031	FI	On-Demand	Anodyne	TAAR1	22	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450928031	FI	On-Demand	Anodyne	KCNK3	98	53
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@H](O)C1CCC1	ZINC000450928031	FI	On-Demand	Anodyne	KCNK9	53	53
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@H]3C[C@H](C)O)ccc21	ZINC000450928033	GF	On-Demand	Anodyne	PLK1	60	34
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@H]3C[C@H](C)O)ccc21	ZINC000450928033	GF	On-Demand	Anodyne	HPGD	55	62
Cc1cnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)s1	ZINC000450928034	DD	On-Demand	Anodyne	SLC6A7	0	43
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@H]3C[C@@H](C)O)ccc21	ZINC000450928035	GF	On-Demand	Anodyne	PLK1	60	34
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@H]3C[C@@H](C)O)ccc21	ZINC000450928035	GF	On-Demand	Anodyne	HPGD	55	62
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@@H]3C[C@H](C)O)ccc21	ZINC000450928036	GF	On-Demand	Anodyne	PLK1	60	34
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@@H]3C[C@H](C)O)ccc21	ZINC000450928036	GF	On-Demand	Anodyne	HPGD	55	62
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@@H]3C[C@@H](C)O)ccc21	ZINC000450928037	GF	On-Demand	Anodyne	PLK1	60	34
COc1ccccc1-n1cnc2cc(C(=O)N3CCOC[C@@H]3C[C@@H](C)O)ccc21	ZINC000450928037	GF	On-Demand	Anodyne	HPGD	55	62
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	HTR1A	21	47
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	DRD2	29	53
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	DRD4	24	44
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	HTR2A	26	47
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	HTR2C	23	49
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	SLC6A1	40	32
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	HRH1	28	46
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	DRD3	16	44
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	HTR7	25	44
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	SIGMAR1	23	51
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	MCHR1	18	52
CCCn1nccc1C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450928044	EI	On-Demand	Anodyne	CYP2J2	72	51
CCS(=O)(=O)c1ccc(CN2CC[C@@](F)(c3ccccc3F)C2)cc1	ZINC000450928079	FH	On-Demand	Anodyne	MCHR2	47	31
CCS(=O)(=O)c1ccc(CN2CC[C@](F)(c3ccccc3F)C2)cc1	ZINC000450928080	FH	On-Demand	Anodyne	MCHR2	47	31
FC1(c2ccccn2)CCN(CCOC2CCCCCC2)CC1	ZINC000450928086	DI	On-Demand	Anodyne	SIGMAR1	19	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450928091	FI	On-Demand	Mild	CSF1R	20	44
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450928091	FI	On-Demand	Mild	BTK	19	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450928091	FI	On-Demand	Mild	KCNK3	103	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450928091	FI	On-Demand	Mild	KCNK9	55	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450928093	FI	On-Demand	Mild	CSF1R	20	44
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450928093	FI	On-Demand	Mild	BTK	19	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450928093	FI	On-Demand	Mild	KCNK3	103	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450928093	FI	On-Demand	Mild	KCNK9	55	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450928095	FI	On-Demand	Mild	CSF1R	20	44
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450928095	FI	On-Demand	Mild	BTK	19	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450928095	FI	On-Demand	Mild	KCNK3	103	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450928095	FI	On-Demand	Mild	KCNK9	55	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450928097	FI	On-Demand	Mild	CSF1R	20	44
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450928097	FI	On-Demand	Mild	BTK	19	41
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450928097	FI	On-Demand	Mild	KCNK3	103	47
Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450928097	FI	On-Demand	Mild	KCNK9	55	47
Cc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1Br	ZINC000450928099	GE	On-Demand	Anodyne	LIMK2	65	35
Cc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1Br	ZINC000450928099	GE	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)c1sccc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450928116	EG	On-Demand	Anodyne	MGEA5	22	40
COC(=O)c1sccc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450928116	EG	On-Demand	Anodyne	FAS	46	38
COc1cccnc1CNc1ncccc1C(=O)N1CCCCC1	ZINC000450928122	EF	On-Demand	Anodyne	HCN1	52	36
COc1cccnc1CNc1ncccc1C(=O)N1CCCCC1	ZINC000450928122	EF	On-Demand	Anodyne	HCN4	50	36
CCc1nc(C)cc(N2CCN(c3ccc(OC)cn3)CC2)n1	ZINC000450928134	DE	On-Demand	Anodyne	SORD	27	44
COC(=O)c1ccc(CN2CCC[C@H](c3ncc4n3CCCC4)C2)cc1Cl	ZINC000450928139	GI	On-Demand	Anodyne	DRD4	16	40
COC(=O)c1ccc(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1Cl	ZINC000450928145	GI	On-Demand	Anodyne	DRD4	16	40
CC(C)N1CCC[C@H](NC(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450928166	DH	On-Demand	Anodyne	SLC6A1	0	42
CC(C)N1CCC[C@H](NC(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450928166	DH	On-Demand	Anodyne	EPHX2	21	40
CC(C)N1CCC[C@H](NC(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450928166	DH	On-Demand	Anodyne	BIRC2	49	38
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450928167	DH	On-Demand	Anodyne	SLC6A1	0	42
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450928167	DH	On-Demand	Anodyne	EPHX2	21	40
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450928167	DH	On-Demand	Anodyne	BIRC2	49	38
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450928168	DH	On-Demand	Anodyne	SLC6A1	0	42
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450928168	DH	On-Demand	Anodyne	EPHX2	21	40
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450928168	DH	On-Demand	Anodyne	BIRC2	49	38
CC(C)N1CCC[C@H](NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450928169	DH	On-Demand	Anodyne	SLC6A1	0	42
CC(C)N1CCC[C@H](NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450928169	DH	On-Demand	Anodyne	EPHX2	21	40
CC(C)N1CCC[C@H](NC(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450928169	DH	On-Demand	Anodyne	BIRC2	49	38
COc1ccc(-c2noc(N3CCN(c4ccc(OC)cn4)CC3)n2)cc1	ZINC000450928170	FE	On-Demand	Anodyne	LUCI_PHOPE	15	40
CC(=O)c1cccc(C(F)(F)F)c1OC[C@H](O)COC(C)C	ZINC000450928178	DG	On-Demand	Anodyne	ABCB1	24	41
CC(=O)c1cccc(C(F)(F)F)c1OC[C@@H](O)COC(C)C	ZINC000450928179	DG	On-Demand	Anodyne	ABCB1	24	41
CS(=O)(=O)c1ccc(OCCN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450928184	GF	On-Demand	Anodyne	ESR1	22	40
CS(=O)(=O)c1ccc(OCCN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450928184	GF	On-Demand	Anodyne	ESR2	15	40
CS(=O)(=O)c1ccc(OCCN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450928184	GF	On-Demand	Anodyne	LTA4H	59	45
CS(=O)(=O)c1ccc(OCCN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450928184	GF	On-Demand	Anodyne	MMP13	18	45
CS(=O)(=O)c1ccc(OCCN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450928184	GF	On-Demand	Anodyne	ADAM17	18	45
CS(=O)(=O)c1ccc(OCCN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450928184	GF	On-Demand	Anodyne	MMP9	15	45
CS(=O)(=O)c1ccc(OCCN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450928184	GF	On-Demand	Anodyne	PSMB2	49	37
CS(=O)(=O)c1ccc(OCCN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450928184	GF	On-Demand	Anodyne	PSMB1	42	36
FC1(c2ccccn2)CCN(C[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000450928206	DI	On-Demand	Anodyne	CCR5	20	41
COC(=O)c1cc2cc(CN3CCC(F)(c4ccccn4)CC3)ccc2o1	ZINC000450928213	FI	On-Demand	Anodyne	SSTR5	58	38
COC(=O)c1cc2cc(CN3CCC(F)(c4ccccn4)CC3)ccc2o1	ZINC000450928213	FI	On-Demand	Anodyne	MCHR1	24	41
COC(=O)c1cc2cc(CN3CCC(F)(c4ccccn4)CC3)ccc2o1	ZINC000450928213	FI	On-Demand	Anodyne	MCHR2	65	36
CC(C)N1CCC[C@H](NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450928214	FE	On-Demand	Anodyne	MAPK13	58	33
CC(C)N1CCC[C@@H](NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450928215	FE	On-Demand	Anodyne	MAPK13	58	33
O=S(=O)(C[C@H]1CCC(F)(F)C1)c1ccc2c(c1)OCCO2	ZINC000450928236	DF	On-Demand	Anodyne	PKM	32	42
O=S(=O)(C[C@@H]1CCC(F)(F)C1)c1ccc2c(c1)OCCO2	ZINC000450928239	DF	On-Demand	Anodyne	PKM	32	42
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1nc(-c2ccco2)cs1	ZINC000450928244	GH	On-Demand	Anodyne	SLC27A1	39	40
CN(c1ccc(C(=O)Nc2ccccc2)nn1)C1CCN(CC(F)(F)F)CC1	ZINC000450928251	GG	On-Demand	Anodyne	SCD1	43	43
CN(c1ccc(C(=O)Nc2ccccc2)nn1)C1CCN(CC(F)(F)F)CC1	ZINC000450928251	GG	On-Demand	Anodyne	SCD	36	43
CN(c1ccc(C(=O)Nc2ccccc2)nn1)C1CCN(CC(F)(F)F)CC1	ZINC000450928251	GG	On-Demand	Anodyne	HPGDS	36	43
COC[C@H]1CCCCN1c1ccnc(C)n1	ZINC000450928252	BD	On-Demand	Anodyne	NOS2	18	40
COC[C@@H]1CCCCN1c1ccnc(C)n1	ZINC000450928263	BD	On-Demand	Anodyne	NOS2	18	40
COC(=O)c1cc(CN2CCC(F)(c3ccccn3)CC2)cc(C(=O)OC)c1	ZINC000450928267	GG	On-Demand	Anodyne	SSTR5	41	34
COC(=O)c1cc(CN2CCC(F)(c3ccccn3)CC2)cc(C(=O)OC)c1	ZINC000450928267	GG	On-Demand	Anodyne	ADAM17	15	40
COC(=O)c1cc(CN2CCC(F)(c3ccccn3)CC2)cc(C(=O)OC)c1	ZINC000450928267	GG	On-Demand	Anodyne	FAAH	16	40
COC(=O)c1cc(CN2CCC(F)(c3ccccn3)CC2)cc(C(=O)OC)c1	ZINC000450928267	GG	On-Demand	Anodyne	MCHR2	61	36
COC(=O)c1cc(CN2CCC(F)(c3ccccn3)CC2)cc(C(=O)OC)c1	ZINC000450928267	GG	On-Demand	Anodyne	CCR8	40	37
COC(=O)c1cc(CN2CCC(F)(c3ccccn3)CC2)cc(C(=O)OC)c1	ZINC000450928267	GG	On-Demand	Anodyne	MGEA5	15	40
COC(=O)c1cc(CN2CCC(F)(c3ccccn3)CC2)cc(C(=O)OC)c1	ZINC000450928267	GG	On-Demand	Anodyne	NPFFR1	52	41
Fc1cc(Cl)ccc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450928269	DI	On-Demand	Anodyne	CXCR3	0	44
CCNC(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1	ZINC000450928277	FC	On-Demand	Anodyne	HDAC1	0	47
CCNC(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1	ZINC000450928277	FC	On-Demand	Anodyne	SLC6A7	0	42
Cc1cccc(CN(C)c2cc(C(=O)NC3CC3)c3ccccc3n2)n1	ZINC000450928284	EG	On-Demand	Anodyne	TNKS	45	31
CCc1cccc(C(=O)N[C@H]2CCCN(C(C)C)C2)n1	ZINC000450928285	CE	On-Demand	Anodyne	PDE5A	24	40
CCc1cccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)n1	ZINC000450928286	CE	On-Demand	Anodyne	PDE5A	24	40
Cc1cccc(CN(C)c2cc(N(C)Cc3cccc(C)n3)n3ncnc3n2)n1	ZINC000450928287	GF	On-Demand	Anodyne	DHOD	0	42
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NCCCN1CCCC1=O	ZINC000450928293	GE	On-Demand	Anodyne	P2RX7	45	37
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NCCCN1CCCC1=O	ZINC000450928293	GE	On-Demand	Anodyne	TYRO3	25	41
COc1ccc(N2CCN(c3nc(N(C)C)c4ccccc4n3)CC2)nc1	ZINC000450928294	FE	On-Demand	Anodyne	SORD	57	36
COc1cccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)cc(C)nc12	ZINC000450928302	GF	On-Demand	Anodyne	SSTR2	0	41
COC(=O)c1oc([C@H](C)Sc2nc3c(C)ccnc3[nH]2)cc1C	ZINC000450928329	EH	On-Demand	Anodyne	ENPP1	22	44
COC(=O)c1oc([C@@H](C)Sc2nc3c(C)ccnc3[nH]2)cc1C	ZINC000450928338	EH	On-Demand	Anodyne	ENPP1	22	44
COC(=O)c1csc(CN[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450928354	FF	On-Demand	Anodyne	ADRA1D	43	37
COC(=O)c1csc(CN[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450928356	FF	On-Demand	Anodyne	ADRA1D	43	37
COC(=O)c1csc(CN[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450928358	FF	On-Demand	Anodyne	ADRA1D	43	37
COC(=O)c1csc(CN[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450928359	FF	On-Demand	Anodyne	ADRA1D	43	37
COC(=O)[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)O1	ZINC000450928360	GF	On-Demand	Anodyne	HDAC8	18	40
COC(=O)[C@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)O1	ZINC000450928360	GF	On-Demand	Anodyne	CYP2J2	51	36
O=S(=O)(NCC1CC1)c1ccc(=NC[C@@H]2C[C@H]2C2CC2)[nH]c1	ZINC000450928364	DD	On-Demand	Anodyne	NPY1R	40	34
COC[C@H]1CCCCN1c1ncnc2c(OC)cc(OC)cc12	ZINC000450928372	DF	On-Demand	Anodyne	PDE3B	57	34
COC[C@@H]1CCCCN1c1ncnc2c(OC)cc(OC)cc12	ZINC000450928374	DF	On-Demand	Anodyne	PDE3B	57	34
N#Cc1cnc2c(F)cc(F)cc2c1N[C@@H]1C[C@H](O)C1	ZINC000450928382	CE	On-Demand	Mild	MAP3K8	53	31
COC[C@H]1CCCCN(C(=O)C2=C(c3ccccc3)CCC2)C1	ZINC000450928383	DH	On-Demand	Anodyne	CHRM5	35	47
COC[C@@H]1CCCCN(C(=O)C2=C(c3ccccc3)CCC2)C1	ZINC000450928386	DH	On-Demand	Anodyne	CHRM5	35	47
COc1cc(CN2CCC(c3nnc(O)o3)CC2)ccc1Cl	ZINC000450928398	DF	On-Demand	Anodyne	SSTR5	76	44
CCc1cc(CCCN2CCOC[C@@H]2c2nc(-c3ccccc3)no2)on1	ZINC000450928401	FG	On-Demand	Anodyne	COLA	31	41
CCc1cc(CCCN2CCOC[C@H]2c2nc(-c3ccccc3)no2)on1	ZINC000450928403	FG	On-Demand	Anodyne	COLA	31	41
CCS(=O)(=O)c1ccc(COc2c(C(C)=O)cccc2C(F)(F)F)cc1	ZINC000450928408	GI	On-Demand	Anodyne	RORC	51	39
Cc1cc(SCC(=O)N(C)C)nc(-c2cccnc2)n1	ZINC000450928410	CE	On-Demand	Anodyne	GYRB	0	40
Cc1cc(SCC(=O)N(C)C)nc(-c2cccnc2)n1	ZINC000450928410	CE	On-Demand	Anodyne	ROS1	47	33
COc1cccc(CN(C)C(=O)CSc2nc3c(C)ccnc3[nH]2)c1OC	ZINC000450928414	GG	On-Demand	Anodyne	ENPP1	79	54
C[C@H](CN1CCC(c2ccc(Br)cc2)CC1)S(C)(=O)=O	ZINC000450928418	FG	On-Demand	Anodyne	VACHT_TETCF	0	48
C[C@H](CN1CCC(c2ccc(Br)cc2)CC1)S(C)(=O)=O	ZINC000450928418	FG	On-Demand	Anodyne	GRIA4	19	40
C[C@H]1CN(c2cccc(C(F)(F)F)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450928423	FE	On-Demand	Anodyne	SLC6A7	0	41
C[C@@H](CN1CCC(c2ccc(Br)cc2)CC1)S(C)(=O)=O	ZINC000450928426	FG	On-Demand	Anodyne	VACHT_TETCF	0	48
C[C@@H](CN1CCC(c2ccc(Br)cc2)CC1)S(C)(=O)=O	ZINC000450928426	FG	On-Demand	Anodyne	GRIA4	19	40
Brc1ccc(C2CCN(CCc3cscn3)CC2)cc1	ZINC000450928432	FI	On-Demand	Anodyne	SCN5A	41	34
O=C(CCN1CCC(F)(c2ccccn2)CC1)NC1CCCC1	ZINC000450928436	DF	On-Demand	Anodyne	EPHX2	29	42
CCc1ncnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1F	ZINC000450928437	ED	On-Demand	Anodyne	LIMK2	56	36
CN(CCN1CCC(c2nnc(O)o2)CC1)Cc1ccccc1	ZINC000450928441	DE	On-Demand	Anodyne	SIGMAR1	38	42
CC[C@H](Sc1nc2c(C)ccnc2[nH]1)C(=O)Nc1ccc(OC)cc1	ZINC000450928452	FH	On-Demand	Anodyne	ENPP1	61	52
Cc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1C	ZINC000450928461	EH	On-Demand	Anodyne	DRD4	0	49
Cc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1C	ZINC000450928461	EH	On-Demand	Anodyne	GRM4	41	39
CC[C@@H](Sc1nc2c(C)ccnc2[nH]1)C(=O)Nc1ccc(OC)cc1	ZINC000450928467	FH	On-Demand	Anodyne	ENPP1	61	52
C[C@H]1CN(c2cccc(Cl)c2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450928470	EE	On-Demand	Mild	SLC6A7	0	44
CCCn1nccc1C1CCN(Cc2ccc(C(=O)OCC)cn2)CC1	ZINC000450928472	FG	On-Demand	Anodyne	SSTR5	43	35
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NCC#N	ZINC000450928478	DD	On-Demand	Mild	CTSS	18	42
Cc1ccnc2[nH]c(SCc3ccc4c(c3)OCCO4)nc12	ZINC000450928479	DG	On-Demand	Anodyne	TERT	15	40
C[C@H]1CN(c2ccc(F)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450928482	DD	On-Demand	Anodyne	SLC6A7	0	44
C[C@H]1CN(c2ncnc3cccc([N+](=O)[O-])c23)CCN1C(=O)c1cnn(C)c1	ZINC000450928484	GD	On-Demand	Bother	LIMK2	72	39
COc1ccc(CNC(=O)CCN2CCc3cc(F)cc(C)c3C2)c(OC)c1	ZINC000450928492	GG	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN2CCc3cc(F)cc(C)c3C2)c(OC)c1	ZINC000450928492	GG	On-Demand	Anodyne	ABCB1B	53	35
COc1ccc(CNC(=O)CCN2CCc3cc(F)cc(C)c3C2)c(OC)c1	ZINC000450928492	GG	On-Demand	Anodyne	ABCB1	25	40
c1ccc([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2cn(CC3CC3)nn2)cc1	ZINC000450928499	DH	On-Demand	Anodyne	SLC18A3	24	43
CN(C)C(=O)CSc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450928510	ED	On-Demand	Bother	GSTM2	40	33
CN(C)C(=O)CSc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000450928510	ED	On-Demand	Bother	COLA	70	34
COC(=O)c1coc(CN2CCC(c3ccc(Br)cc3)CC2)n1	ZINC000450928514	GH	On-Demand	Anodyne	MGEA5	25	40
O=C(NCCC1=CCCCCC1)c1ccc(N2CCC2)nc1	ZINC000450928516	CG	On-Demand	Anodyne	HPGDS	20	44
CCOC(=O)c1csc(COc2ccc(C(F)(F)F)cc2F)n1	ZINC000450928524	EI	On-Demand	Anodyne	PPARD	50	36
COc1ccc(-n2c(C)nnc2S[C@H](C)c2csnn2)cc1	ZINC000450928544	EG	On-Demand	Anodyne	AXIN2	0	43
COCC1(C#N)CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450928545	CF	On-Demand	Mild	SIGMAR1	24	40
COCC1(C#N)CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450928545	CF	On-Demand	Mild	NPFFR1	47	44
COc1ccc(-n2c(C)nnc2S[C@@H](C)c2csnn2)cc1	ZINC000450928546	EG	On-Demand	Anodyne	AXIN2	0	43
Cc1cccc(CN(C)c2cc(N3CCOCC3)ncn2)n1	ZINC000450928547	CD	On-Demand	Anodyne	EPHB4	49	35
Cc1ccnc2[nH]c(SCC(=O)NCCCN3CCCCCC3=O)nc12	ZINC000450928565	GE	On-Demand	Anodyne	ENPP1	71	49
CCOCC(=O)Cn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450928577	GG	On-Demand	Anodyne	SCD	16	45
O=C(c1ccc(N[C@@H]2C[C@H](O)C2)nc1)N1CCc2ccccc21	ZINC000450928603	DE	On-Demand	Anodyne	AVPR2	29	41
O=C(c1ccc(N[C@@H]2C[C@H](O)C2)nc1)N1CCc2ccccc21	ZINC000450928603	DE	On-Demand	Anodyne	AVPR1A	39	43
COc1ccc(CNC(=O)CCN[C@H]2CCCC23CCOCC3)c(OC)c1	ZINC000450928614	GF	On-Demand	Anodyne	MTNR1A	53	36
COc1ccc(CNC(=O)CCN[C@@H]2CCCC23CCOCC3)c(OC)c1	ZINC000450928617	GF	On-Demand	Anodyne	MTNR1A	53	36
CCCOc1cccc(Cn2cccc(Br)c2=O)c1	ZINC000450928621	DG	On-Demand	Anodyne	UPP1	63	44
CCN(CCOCCO)Cc1ccccc1OC1CC1	ZINC000450928629	CE	On-Demand	Anodyne	SLC5A4	59	35
COc1cccnc1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450928633	FE	On-Demand	Anodyne	PDE5A	35	43
COc1cccnc1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450928633	FE	On-Demand	Anodyne	PDE6A	48	31
COc1cccnc1CNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450928633	FE	On-Demand	Anodyne	LRRK2	38	48
C[C@@H](O)CCCN1CCC(F)(c2ccccn2)CC1	ZINC000450928637	CF	On-Demand	Anodyne	CCR1	19	45
C[C@H](O)CCCN1CCC(F)(c2ccccn2)CC1	ZINC000450928638	CF	On-Demand	Anodyne	CCR1	19	45
COC(=O)c1csc(CN2CCN(c3cccc(Br)c3)CC2)n1	ZINC000450928648	GG	On-Demand	Anodyne	DRD3	21	41
FC1(c2ccccn2)CCN(CCCc2ccncc2)CC1	ZINC000450928652	CG	On-Demand	Anodyne	SIGMAR1	27	45
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCCC[C@@H]1C(N)=O	ZINC000450928654	FE	On-Demand	Anodyne	FKBP1A	47	37
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCCC[C@@H]1C(N)=O	ZINC000450928654	FE	On-Demand	Anodyne	CPT1A	99	39
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCCC[C@@H]1C(N)=O	ZINC000450928654	FE	On-Demand	Anodyne	CPT2	48	38
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCCC[C@@H]1C(N)=O	ZINC000450928654	FE	On-Demand	Anodyne	WNT3	40	31
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCCC[C@H]1C(N)=O	ZINC000450928655	FE	On-Demand	Anodyne	FKBP1A	47	37
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCCC[C@H]1C(N)=O	ZINC000450928655	FE	On-Demand	Anodyne	CPT1A	99	39
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCCC[C@H]1C(N)=O	ZINC000450928655	FE	On-Demand	Anodyne	CPT2	48	38
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCCC[C@H]1C(N)=O	ZINC000450928655	FE	On-Demand	Anodyne	WNT3	40	31
COC(=O)[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccc(O)cc1	ZINC000450928663	FD	On-Demand	Anodyne	FOLH1	47	39
COC(=O)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccc(O)cc1	ZINC000450928664	FD	On-Demand	Anodyne	FOLH1	47	39
O=C(CCN1CCC(F)(c2ccccn2)CC1)Nc1cccc(Cl)c1	ZINC000450928669	FI	On-Demand	Anodyne	DRD4	20	44
O=C(CCN1CCC(F)(c2ccccn2)CC1)Nc1cccc(Cl)c1	ZINC000450928669	FI	On-Demand	Anodyne	GRM4	49	50
O=C(CCN1CCC(F)(c2ccccn2)CC1)Nc1cccc(Cl)c1	ZINC000450928669	FI	On-Demand	Anodyne	CACNA1I	15	46
CC[C@H](NC(=O)CCOc1cccc(OC)c1)c1ncc[nH]1	ZINC000450928674	DE	On-Demand	Anodyne	MTNR1A	33	40
CC[C@H](NC(=O)CCOc1cccc(OC)c1)c1ncc[nH]1	ZINC000450928674	DE	On-Demand	Anodyne	MTNR1B	31	40
CC[C@H](NC(=O)CCOc1cccc(OC)c1)c1ncc[nH]1	ZINC000450928674	DE	On-Demand	Anodyne	PDS	35	41
CC[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ncc[nH]1	ZINC000450928675	DE	On-Demand	Anodyne	MTNR1A	33	40
CC[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ncc[nH]1	ZINC000450928675	DE	On-Demand	Anodyne	MTNR1B	31	40
CC[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ncc[nH]1	ZINC000450928675	DE	On-Demand	Anodyne	PDS	35	41
O[C@H](Cc1ccccc1)CN1CCC(CC(F)(F)F)CC1	ZINC000450928692	DG	On-Demand	Anodyne	VACHT_TETCF	0	54
O[C@H](Cc1ccccc1)CN1CCC(CC(F)(F)F)CC1	ZINC000450928692	DG	On-Demand	Anodyne	SIGMAR1	34	44
COCCCCCOc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450928698	DI	On-Demand	Anodyne	KCNK3	30	41
COCCCCCOc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450928698	DI	On-Demand	Anodyne	KCNK9	27	41
O=c1cc(CN2CCC(F)(c3ccccn3)CC2)nc2ccccn12	ZINC000450928702	EF	On-Demand	Anodyne	PKM	15	48
Cc1cccc(OCCCNC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450928706	GG	On-Demand	Anodyne	DRD4	18	41
Cc1cccc(OCCCNC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450928706	GG	On-Demand	Anodyne	HRH2	48	41
Cc1cccc(OCCCNC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450928706	GG	On-Demand	Anodyne	ACOX1	44	32
O=C(CN1CCC(F)(c2ccccn2)CC1)NCC1(c2ccccc2)CC1	ZINC000450928717	FG	On-Demand	Anodyne	NPFFR1	49	45
COc1ccc(CNC(=O)CCN2CCC3(CCOCC3)CC2)c(OC)c1	ZINC000450928718	GF	On-Demand	Anodyne	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCC3(CCOCC3)CC2)c(OC)c1	ZINC000450928718	GF	On-Demand	Anodyne	HTR7	27	42
COc1ccc(CNC(=O)CCN2CCC3(CCOCC3)CC2)c(OC)c1	ZINC000450928718	GF	On-Demand	Anodyne	MTNR1A	52	40
COc1ccc(CNC(=O)CCN2CCC3(CCOCC3)CC2)c(OC)c1	ZINC000450928718	GF	On-Demand	Anodyne	MTNR1B	42	40
CC(=O)c1cccc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)c1	ZINC000450928724	FF	On-Demand	Anodyne	TRY2_BOVIN	70	34
CC(=O)c1cccc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)c1	ZINC000450928724	FF	On-Demand	Anodyne	AKR1C3	57	37
CC(C)N1CCC[C@@H](NC(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450928728	EF	On-Demand	Anodyne	BIRC2	40	35
CC(C)N1CCC[C@H](NC(=O)Cc2ccc(OC(F)F)c(F)c2)C1	ZINC000450928729	EF	On-Demand	Anodyne	BIRC2	40	35
Cc1ccnc2[nH]c(SCC(=O)NC(=O)N3CCC[C@@H]3C(N)=O)nc12	ZINC000450928732	FC	On-Demand	Anodyne	TRHR	55	32
Cc1ccnc2[nH]c(SCC(=O)NC(=O)N3CCC[C@@H]3C(N)=O)nc12	ZINC000450928732	FC	On-Demand	Anodyne	ENPP1	63	50
Cc1ccnc2[nH]c(SCC(=O)NC(=O)N3CCC[C@H]3C(N)=O)nc12	ZINC000450928735	FC	On-Demand	Anodyne	TRHR	55	32
Cc1ccnc2[nH]c(SCC(=O)NC(=O)N3CCC[C@H]3C(N)=O)nc12	ZINC000450928735	FC	On-Demand	Anodyne	ENPP1	63	50
COC(=O)[C@@H](Sc1nc2c(C)ccnc2[nH]1)C1CC1	ZINC000450928736	CE	On-Demand	Anodyne	ENPP1	24	47
COC(=O)[C@H](Sc1nc2c(C)ccnc2[nH]1)C1CC1	ZINC000450928737	CE	On-Demand	Anodyne	ENPP1	24	47
Cc1ccnc2[nH]c(SCCCC(=O)OC(C)(C)C)nc12	ZINC000450928763	DG	On-Demand	Anodyne	ENPP1	43	34
Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450928765	EH	On-Demand	Anodyne	SLC6A3	16	60
Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450928765	EH	On-Demand	Anodyne	KCNH2	35	40
Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450928765	EH	On-Demand	Anodyne	CYP2J2	56	40
Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450928765	EH	On-Demand	Anodyne	ACHP_LYMST	20	42
Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccccc1	ZINC000450928765	EH	On-Demand	Anodyne	Q8WSF8_APLCA	34	42
CCN(CC)CCCSc1nc2c(C)ccnc2[nH]1	ZINC000450928767	CG	On-Demand	Anodyne	ENPP1	16	44
CCC[C@H](Sc1nc2c(C)ccnc2[nH]1)C(=O)OCC	ZINC000450928768	CG	On-Demand	Anodyne	ENPP1	25	48
CCC[C@@H](Sc1nc2c(C)ccnc2[nH]1)C(=O)OCC	ZINC000450928769	CG	On-Demand	Anodyne	ENPP1	25	48
CCCC[C@H](Sc1nc2c(C)ccnc2[nH]1)C(=O)OC	ZINC000450928775	CG	On-Demand	Anodyne	ENPP1	31	48
CCCC[C@@H](Sc1nc2c(C)ccnc2[nH]1)C(=O)OC	ZINC000450928776	CG	On-Demand	Anodyne	ENPP1	31	48
C[C@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCN1C(=O)c1cnn(C)c1	ZINC000450928777	GF	On-Demand	Bother	SLC6A7	0	41
CSc1ccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450928779	GE	On-Demand	Anodyne	PDE3B	54	31
CSc1ccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450928779	GE	On-Demand	Anodyne	SIRT3	43	30
CSc1ccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450928779	GE	On-Demand	Anodyne	LIMK2	64	38
Cc1ccnc2[nH]c(SCC(=O)N(CC(C)C)CC(F)(F)F)nc12	ZINC000450928797	FG	On-Demand	Anodyne	ENPP1	24	47
CN(C)S(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450928800	GF	On-Demand	Anodyne	HTR2A	17	50
CN(C)S(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450928800	GF	On-Demand	Anodyne	HTR2C	16	50
CN(C)S(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450928800	GF	On-Demand	Anodyne	HTR7	33	44
CN(C)S(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450928800	GF	On-Demand	Anodyne	HTR5A	24	50
CN(C)S(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450928800	GF	On-Demand	Anodyne	SLC18A3	0	40
CN(C)S(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccccc1)C2	ZINC000450928800	GF	On-Demand	Anodyne	CYP2J2	54	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H](O)C1	ZINC000450928811	CC	On-Demand	Bother	KCNMA1	19	40
C[C@@H]1CCC(=O)[C@H](Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450928818	DF	On-Demand	Anodyne	VCP	53	41
C[C@H]1CCC(=O)[C@@H](Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450928819	DF	On-Demand	Anodyne	VCP	53	41
C[C@@H]1CCC(=O)[C@@H](Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450928820	DF	On-Demand	Anodyne	VCP	53	41
C[C@H]1CCC(=O)[C@H](Sc2nnc(CO)n2-c2ccccc2)C1	ZINC000450928821	DF	On-Demand	Anodyne	VCP	53	41
C[C@H](O)CCN1CCC(N2CCc3ccccc32)CC1	ZINC000450928829	CE	On-Demand	Anodyne	OPRM1	0	41
C[C@H](O)CCN1CCC(N2CCc3ccccc32)CC1	ZINC000450928829	CE	On-Demand	Anodyne	OPRL1	26	41
C[C@H](O)CCN1CCC(N2CCc3ccccc32)CC1	ZINC000450928829	CE	On-Demand	Anodyne	NAMPT	0	44
C[C@@H](O)CCN1CCC(N2CCc3ccccc32)CC1	ZINC000450928830	CE	On-Demand	Anodyne	OPRM1	0	41
C[C@@H](O)CCN1CCC(N2CCc3ccccc32)CC1	ZINC000450928830	CE	On-Demand	Anodyne	OPRL1	26	41
C[C@@H](O)CCN1CCC(N2CCc3ccccc32)CC1	ZINC000450928830	CE	On-Demand	Anodyne	NAMPT	0	44
CCO[C@@H]1CCCC[C@H]1Nc1ncnc2cc(F)c(F)cc12	ZINC000450928855	DH	On-Demand	Anodyne	EGFR	15	41
CCO[C@@H]1CCCC[C@H]1N=c1ccc(C(=O)Nc2ccccc2)n[nH]1	ZINC000450928869	EF	On-Demand	Anodyne	TIMP3	48	32
CN(C)C(=O)CSc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000450928877	CD	On-Demand	Mild	GSTM2	43	30
COc1ccc(CN(C)C(=O)CSc2nc3c(C)ccnc3[nH]2)cc1OC	ZINC000450928879	GG	On-Demand	Anodyne	ENPP1	97	65
COC(=O)c1cnc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450928894	CE	On-Demand	Bother	PRKCQ	45	35
Cc1c(Cl)cccc1N1CCCN(Cc2cccnc2N)CC1	ZINC000450928921	EG	On-Demand	Anodyne	DRD4	22	42
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	HTR1A	18	60
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	DRD2	32	60
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	DRD1	25	60
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	DRD4	25	60
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	HTR2A	38	60
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	DRD3	17	60
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	HTR7	20	47
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	SIGMAR1	19	57
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	HTR3B	0	52
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	NET	0	60
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1	ZINC000450928923	FE	On-Demand	Anodyne	AP2S1	0	47
COc1ccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)cc1OC	ZINC000450928942	FF	On-Demand	Anodyne	ENPP1	91	73
COc1ccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)cc1OC	ZINC000450928942	FF	On-Demand	Anodyne	DRTS_TRYCR	45	31
Cc1ccnc2[nH]c(SCC(=O)N(C)[C@H](C)CC(C)C)nc12	ZINC000450928951	DG	On-Demand	Anodyne	ENPP1	53	35
Cc1ccnc2[nH]c(SCC(=O)N(C)[C@@H](C)CC(C)C)nc12	ZINC000450928953	DG	On-Demand	Anodyne	ENPP1	53	35
CCOC(=O)[C@H]1CCCCN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450928956	FE	On-Demand	Anodyne	FKBP1A	71	39
CCOC(=O)[C@H]1CCCCN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450928956	FE	On-Demand	Anodyne	CPT1A	55	36
CCOC(=O)[C@H]1CCCCN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450928956	FE	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@H]1CCCCN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450928956	FE	On-Demand	Anodyne	ENPP1	45	46
CCOC(=O)[C@@H]1CCCCN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450928959	FE	On-Demand	Anodyne	FKBP1A	71	39
CCOC(=O)[C@@H]1CCCCN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450928959	FE	On-Demand	Anodyne	CPT1A	55	36
CCOC(=O)[C@@H]1CCCCN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450928959	FE	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@@H]1CCCCN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450928959	FE	On-Demand	Anodyne	ENPP1	45	46
Cc1ccnc2[nH]c(SCCN3CCCCC3)nc12	ZINC000450928971	CF	On-Demand	Anodyne	HNMT	58	33
COc1cccnc1CNc1ncc(C(=O)N(C)C)cc1Cl	ZINC000450928991	DE	On-Demand	Anodyne	PDE6A	41	32
CCc1cc(NCc2ncccc2OC)n2ncnc2n1	ZINC000450929008	CD	On-Demand	Anodyne	DHOD	0	52
CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nc3c(C)ccnc3[nH]2)c1C	ZINC000450929024	FG	On-Demand	Anodyne	ENPP1	60	49
COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)Sc2nc3c(C)ccnc3[nH]2)c1	ZINC000450929027	GG	On-Demand	Anodyne	ENPP1	22	44
COC(=O)c1ccc(C)c(NC(=O)[C@H](C)Sc2nc3c(C)ccnc3[nH]2)c1	ZINC000450929028	GG	On-Demand	Anodyne	ENPP1	22	44
CCOc1ccc(N(CCC#N)C(=O)CSc2nc3c(C)ccnc3[nH]2)cc1	ZINC000450929033	GH	On-Demand	Mild	ENPP1	28	45
CC(C)S(=O)(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450929035	GH	On-Demand	Anodyne	ADAM17	22	44
Cc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1C#N	ZINC000450929039	DH	On-Demand	Mild	MCHR2	47	30
COCC1(C#N)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450929049	EF	On-Demand	Mild	ADAM17	0	41
COCC1(C#N)CCN(Cc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000450929049	EF	On-Demand	Mild	NPFFR1	47	43
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCC(c2ccccc2)=N1	ZINC000450929065	GH	On-Demand	Anodyne	NR1H2	44	33
Cc1cccc(CN(C)c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])n1	ZINC000450929066	EF	On-Demand	Bother	MAPK14	40	38
Cc1cccc(CN(C)c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])n1	ZINC000450929066	EF	On-Demand	Bother	MAPK13	49	36
COc1ccccc1OCc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)o1	ZINC000450929067	FG	On-Demand	Anodyne	DRD3	23	43
COc1ccccc1OCc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)o1	ZINC000450929067	FG	On-Demand	Anodyne	BIRC2	42	41
COc1ccccc1OCc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)o1	ZINC000450929067	FG	On-Demand	Anodyne	ACKR3	45	32
COc1ccccc1OCc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)o1	ZINC000450929068	FG	On-Demand	Anodyne	DRD3	23	43
COc1ccccc1OCc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)o1	ZINC000450929068	FG	On-Demand	Anodyne	BIRC2	42	41
COc1ccccc1OCc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)o1	ZINC000450929068	FG	On-Demand	Anodyne	ACKR3	45	32
C=CCN1CC[C@@H](Oc2c(C(C)=O)cccc2C(F)(F)F)C1=O	ZINC000450929076	EG	On-Demand	Mild	P2RX7	18	40
C=CCN1CC[C@H](Oc2c(C(C)=O)cccc2C(F)(F)F)C1=O	ZINC000450929077	EG	On-Demand	Mild	P2RX7	18	40
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)C1CC1	ZINC000450929078	CG	On-Demand	Anodyne	RBP4	40	33
COc1ccc(N2CCN(c3ncnc4c(F)c(OC)ccc34)CC2)nc1	ZINC000450929079	FF	On-Demand	Anodyne	PDE3A	45	38
COc1ccc(N2CCN(c3ncnc4c(F)c(OC)ccc34)CC2)nc1	ZINC000450929079	FF	On-Demand	Anodyne	PDGFRB	50	35
COc1ccc(N2CCN(c3ncnc4c(F)c(OC)ccc34)CC2)nc1	ZINC000450929079	FF	On-Demand	Anodyne	PDE3B	67	38
FC(F)(F)CC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450929080	FI	On-Demand	Anodyne	DRD2	0	42
FC(F)(F)CC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450929080	FI	On-Demand	Anodyne	ACHE	42	42
FC(F)(F)CC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450929080	FI	On-Demand	Anodyne	SLC6A3	15	40
FC(F)(F)CC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450929080	FI	On-Demand	Anodyne	SIGMAR1	51	42
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929088	EF	On-Demand	Anodyne	POL	0	42
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929089	EF	On-Demand	Anodyne	CAPN1	42	34
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929089	EF	On-Demand	Anodyne	CAPN2	68	33
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929089	EF	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929090	EF	On-Demand	Anodyne	CAPN1	42	34
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929090	EF	On-Demand	Anodyne	CAPN2	68	33
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929090	EF	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929091	EF	On-Demand	Anodyne	CAPN1	42	34
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929091	EF	On-Demand	Anodyne	CAPN2	68	33
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccsc1	ZINC000450929091	EF	On-Demand	Anodyne	POL	0	42
CCS(=O)(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450929107	EH	On-Demand	Anodyne	ACHE	36	46
CCS(=O)(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450929107	EH	On-Demand	Anodyne	SIGMAR1	34	40
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC(=O)NC1CC1	ZINC000450929109	EE	On-Demand	Anodyne	EPHX2	40	42
CCN(C)C(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450929110	DF	On-Demand	Anodyne	KCNK3	18	41
COc1ncccc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450929127	DF	On-Demand	Anodyne	CCR8	24	42
Cc1cc(C)c(NC(=O)CCCN2CCC(F)(c3ccccn3)CC2)c(C)c1	ZINC000450929130	GJ	On-Demand	Anodyne	ADRA1A	18	42
Cc1cc(C)c(NC(=O)CCCN2CCC(F)(c3ccccn3)CC2)c(C)c1	ZINC000450929130	GJ	On-Demand	Anodyne	CHRNA7	17	43
COc1ccc(N2CCN(c3nccc(C(F)F)n3)CC2)nc1	ZINC000450929133	DE	On-Demand	Anodyne	SORD	41	36
Cc1csc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc12	ZINC000450929139	FE	On-Demand	Anodyne	LIMK2	65	36
C[C@@H](O)CCCOc1ccc(C(F)(F)F)cc1F	ZINC000450929140	CG	On-Demand	Anodyne	PPARD	22	42
C[C@H](O)CCCOc1ccc(C(F)(F)F)cc1F	ZINC000450929141	CG	On-Demand	Anodyne	PPARD	22	42
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	HTR1A	36	49
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	DRD2	32	49
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	DRD4	20	46
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	HTR2A	32	56
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	HTR2C	23	51
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	SLC6A1	89	39
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	DRD3	24	46
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	HTR7	55	46
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	SIGMAR1	31	51
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCCN(S(=O)(=O)C2CC2)CC1)c1ccccc1	ZINC000450929152	FE	On-Demand	Anodyne	CYP2J2	68	48
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	DRD2	38	56
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	DRD1	24	54
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	DRD4	24	56
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	HTR2A	29	57
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	DRD3	17	56
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	ERG2	27	56
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	SIGMAR1	17	57
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccc(F)cc1	ZINC000450929157	EI	On-Demand	Anodyne	AP2S1	0	56
OC[C@@]1(F)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450929167	CE	On-Demand	Anodyne	SIGMAR1	23	43
OC[C@]1(F)CCN(CCc2ccc(Cl)cc2)C1	ZINC000450929168	CE	On-Demand	Anodyne	SIGMAR1	23	43
COC(=O)c1ccc(CN2CCCC[C@H]2c2cnn(C)c2)cc1Cl	ZINC000450929169	EH	On-Demand	Anodyne	OPRK1	28	40
COC(=O)c1ccc(CN2CCCC[C@@H]2c2cnn(C)c2)cc1Cl	ZINC000450929170	EH	On-Demand	Anodyne	OPRK1	28	40
CCC(=O)CCCN1CC[C@@](F)(c2ccccc2F)C1	ZINC000450929174	CG	On-Demand	Anodyne	SLC18A3	30	44
CCC(=O)CCCN1CC[C@](F)(c2ccccc2F)C1	ZINC000450929175	CG	On-Demand	Anodyne	SLC18A3	30	44
CCOC(=O)c1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)ncc1Cl	ZINC000450929176	GD	On-Demand	Anodyne	SMO	25	40
CCOC(=O)c1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)ncc1Cl	ZINC000450929176	GD	On-Demand	Anodyne	SLC6A7	0	40
Cc1ccnc2[nH]c(SCC(=O)NCc3ccc(CN4CCCC4)cc3)nc12	ZINC000450929179	GG	On-Demand	Anodyne	ENPP1	72	50
CC(=O)CCCCCOc1ccc(C(F)(F)F)cc1F	ZINC000450929181	CI	On-Demand	Anodyne	THRA	26	44
CC(=O)CCCCCOc1ccc(C(F)(F)F)cc1F	ZINC000450929181	CI	On-Demand	Anodyne	PPARA	17	42
CC(=O)CCCCCOc1ccc(C(F)(F)F)cc1F	ZINC000450929181	CI	On-Demand	Anodyne	THRB	0	44
CC(=O)CCCCCOc1ccc(C(F)(F)F)cc1F	ZINC000450929181	CI	On-Demand	Anodyne	PPARD	39	43
COc1ccc(-n2c(C)nnc2S[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450929188	FI	On-Demand	Anodyne	AXIN2	0	41
COc1ccc(-n2c(C)nnc2S[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450929189	FI	On-Demand	Anodyne	AXIN2	0	41
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	DRD2	34	48
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	DRD4	20	48
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	HTR2A	17	48
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	ADRA1A	21	48
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	ADRA1B	17	48
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	TBXAS1	34	42
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	ERG2	22	45
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	SIGMAR1	18	45
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	CCR1	17	46
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CCC(F)(c2cccnc2)CC1)c1ccccc1	ZINC000450929201	EI	On-Demand	Anodyne	AP2S1	0	45
Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccc(F)cc1	ZINC000450929204	FH	On-Demand	Anodyne	DRD4	0	67
Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2CCCC(=O)c1ccc(F)cc1	ZINC000450929204	FH	On-Demand	Anodyne	CYP2J2	49	35
COc1ccc(-c2ccnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)n2)cc1	ZINC000450929214	GE	On-Demand	Anodyne	SLC6A7	0	49
C[C@H](c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1)C(F)(F)F	ZINC000450929218	FH	On-Demand	Anodyne	SIGMAR1	17	40
C[C@@H](c1ccc(CN2CCC(c3nnc(O)o3)CC2)cc1)C(F)(F)F	ZINC000450929219	FH	On-Demand	Anodyne	SIGMAR1	17	40
CCc1cc(CCCSc2nnc(C)n2-c2ccc(OC)cc2)on1	ZINC000450929223	FH	On-Demand	Anodyne	WNT3A	25	51
CCc1cc(CCCSc2nnc(C)n2-c2ccc(OC)cc2)on1	ZINC000450929223	FH	On-Demand	Anodyne	AXIN2	0	53
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2ncccc2OC)c([N+](=O)[O-])c1	ZINC000450929229	GD	On-Demand	Bother	TAAR1	21	47
COC(=O)[C@H](C)NC(=O)c1ccc(NCc2ncccc2OC)c([N+](=O)[O-])c1	ZINC000450929230	GD	On-Demand	Bother	TAAR1	21	47
CCn1cnc2c(NCc3ncccc3OC)ncnc21	ZINC000450929248	CD	On-Demand	Anodyne	ADORA3	37	41
CCOC(=O)c1cnc2c(OC)cccc2c1N[C@@H]1C[C@H](O)C1	ZINC000450929284	DE	On-Demand	Anodyne	PDE4B	15	49
COc1cccc([C@H]2C[C@H](O)CN2CCCC(=O)c2ccc(F)cc2)c1	ZINC000450929293	FH	On-Demand	Anodyne	DRD4	15	45
COc1cccc([C@@H]2C[C@H](O)CN2CCCC(=O)c2ccc(F)cc2)c1	ZINC000450929294	FH	On-Demand	Anodyne	DRD4	15	45
COc1cccc([C@@H]2C[C@@H](O)CN2CCCC(=O)c2ccc(F)cc2)c1	ZINC000450929295	FH	On-Demand	Anodyne	DRD4	15	45
COc1cccc([C@H]2C[C@@H](O)CN2CCCC(=O)c2ccc(F)cc2)c1	ZINC000450929296	FH	On-Demand	Anodyne	DRD4	15	45
CC(C)(O)CCn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450929302	FH	On-Demand	Anodyne	SCD	19	51
C[C@@H](Sc1nnc(CO)n1-c1ccccc1)C(=O)C1CCCCC1	ZINC000450929309	EG	On-Demand	Anodyne	VCP	56	35
C[C@H](Sc1nnc(CO)n1-c1ccccc1)C(=O)C1CCCCC1	ZINC000450929310	EG	On-Demand	Anodyne	VCP	56	35
CCOc1cc(N2CCCC[C@@H]2COC)ccc1[N+](=O)[O-]	ZINC000450929319	CF	On-Demand	Bother	CASP7	45	35
CCOc1cc(N2CCCC[C@H]2COC)ccc1[N+](=O)[O-]	ZINC000450929320	CF	On-Demand	Bother	CASP7	45	35
Cc1ccc(NC(=O)c2ccc(N[C@@H]3C[C@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450929328	EG	On-Demand	Bother	TAAR1	22	44
CCO[C@@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450929330	EF	On-Demand	Bother	TBXA2R	25	44
COc1cccc([C@@H]2[C@@H](NC[C@H](O)Cc3ccccc3)CCN2C2CC2)c1	ZINC000450929332	FG	On-Demand	Anodyne	SLC18A2	36	42
COc1cccc([C@@H]2[C@@H](NC[C@H](O)Cc3ccccc3)CCN2C2CC2)c1	ZINC000450929332	FG	On-Demand	Anodyne	VACHT_TETCF	0	51
COc1cccc([C@H]2[C@H](NC[C@H](O)Cc3ccccc3)CCN2C2CC2)c1	ZINC000450929333	FG	On-Demand	Anodyne	SLC18A2	36	42
COc1cccc([C@H]2[C@H](NC[C@H](O)Cc3ccccc3)CCN2C2CC2)c1	ZINC000450929333	FG	On-Demand	Anodyne	VACHT_TETCF	0	51
COc1cccc([C@H]2[C@@H](NC[C@H](O)Cc3ccccc3)CCN2C2CC2)c1	ZINC000450929334	FG	On-Demand	Anodyne	SLC18A2	36	42
COc1cccc([C@H]2[C@@H](NC[C@H](O)Cc3ccccc3)CCN2C2CC2)c1	ZINC000450929334	FG	On-Demand	Anodyne	VACHT_TETCF	0	51
COc1cccc([C@@H]2[C@H](NC[C@H](O)Cc3ccccc3)CCN2C2CC2)c1	ZINC000450929335	FG	On-Demand	Anodyne	SLC18A2	36	42
COc1cccc([C@@H]2[C@H](NC[C@H](O)Cc3ccccc3)CCN2C2CC2)c1	ZINC000450929335	FG	On-Demand	Anodyne	VACHT_TETCF	0	51
C[C@H]1CN(c2ccc(C(F)(F)F)cc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450929341	GF	On-Demand	Mild	LIPG	49	36
C[C@H]1CN(c2ccc(C(F)(F)F)cc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450929341	GF	On-Demand	Mild	SMO	16	52
C[C@H]1CN(c2ccc(C(F)(F)F)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450929349	FE	On-Demand	Anodyne	SMO	16	49
C[C@H]1CN(c2ccc(C(F)(F)F)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450929349	FE	On-Demand	Anodyne	ADAM33	0	43
C[C@H]1CN(c2ccc(C(F)(F)F)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450929349	FE	On-Demand	Anodyne	SLC6A7	0	42
COCC[C@@H]1CCCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450929368	DF	On-Demand	Anodyne	HPGDS	15	42
COCC[C@H]1CCCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450929369	DF	On-Demand	Anodyne	HPGDS	15	42
CCCn1c(N)c(C(=O)CSc2nc3c(C)ccnc3[nH]2)c(O)nc1=O	ZINC000450929385	FD	On-Demand	Anodyne	ENPP1	39	44
COC[C@H]1CCCCN1c1ncc(C)cc1[N+](=O)[O-]	ZINC000450929400	CE	On-Demand	Bother	CASP3	41	35
COC[C@H]1CCCCN1c1ncc(C)cc1[N+](=O)[O-]	ZINC000450929400	CE	On-Demand	Bother	CASP7	52	34
COC[C@@H]1CCCCN1c1ncc(C)cc1[N+](=O)[O-]	ZINC000450929401	CE	On-Demand	Bother	CASP3	41	35
COC[C@@H]1CCCCN1c1ncc(C)cc1[N+](=O)[O-]	ZINC000450929401	CE	On-Demand	Bother	CASP7	52	34
COC(=O)C1(NC(=O)CSc2nc3c(C)ccnc3[nH]2)CCCCC1	ZINC000450929405	FE	On-Demand	Anodyne	ENPP1	84	58
Cc1ccnc2[nH]c(SCC(=O)NCCCSc3ccccc3)nc12	ZINC000450929406	FH	On-Demand	Anodyne	ENPP1	62	52
COc1ccc([N+](=O)[O-])c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1	ZINC000450929411	FD	On-Demand	Bother	TAAR1	20	40
CCS(=O)(=O)c1ccc(CN2CCOc3cc(OC)ccc3C2)cc1	ZINC000450929413	FF	On-Demand	Anodyne	BMP1	41	36
COc1ccc(NC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c(OC)c1	ZINC000450929438	GH	On-Demand	Anodyne	MTNR1B	40	39
COc1ccc(NC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c(OC)c1	ZINC000450929438	GH	On-Demand	Anodyne	MAPK10	16	40
COc1ccc(NC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c(OC)c1	ZINC000450929438	GH	On-Demand	Anodyne	RBP4	23	40
COc1ccc(NC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c(OC)c1	ZINC000450929438	GH	On-Demand	Anodyne	KCNK3	48	39
CC(=O)c1cccc(C(F)(F)F)c1OCc1cnc(C)cn1	ZINC000450929439	DH	On-Demand	Anodyne	P2RX7	54	34
COc1cc(-c2noc(CS(=O)(=O)c3ccc4c(c3)OCCO4)n2)ncn1	ZINC000450929485	GD	On-Demand	Anodyne	PKM	23	40
CCn1c(CN2CCC(F)(c3ccccn3)CC2)nc2cc(F)ccc21	ZINC000450929492	FI	On-Demand	Anodyne	GRM2	0	45
Cc1cccc(CN(C)c2ccc(S(C)(=O)=O)cc2C(F)(F)F)n1	ZINC000450929506	FG	On-Demand	Anodyne	PTGS2	29	41
Cc1cccc(CN(C)c2ccc(S(C)(=O)=O)cc2C(F)(F)F)n1	ZINC000450929506	FG	On-Demand	Anodyne	PTK2	41	38
Cc1cccc(CN(C)c2ccc(S(C)(=O)=O)cc2C(F)(F)F)n1	ZINC000450929506	FG	On-Demand	Anodyne	NR1H3	65	42
Cc1cccc(CN(C)c2ccc(S(C)(=O)=O)cc2C(F)(F)F)n1	ZINC000450929506	FG	On-Demand	Anodyne	NR1H2	41	39
FC(F)(F)c1cccnc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450929524	EH	On-Demand	Anodyne	EGLN1	0	54
CC(C)N1CCC[C@@H](NC(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC000450929526	DF	On-Demand	Anodyne	BIRC2	41	33
CC(C)N1CCC[C@H](NC(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC000450929527	DF	On-Demand	Anodyne	BIRC2	41	33
CC(C)N1CCC[C@@H](NC(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC000450929528	DF	On-Demand	Anodyne	BIRC2	41	33
CC(C)N1CCC[C@H](NC(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC000450929529	DF	On-Demand	Anodyne	BIRC2	41	33
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCN(C(C)=O)CC1	ZINC000450929530	FD	On-Demand	Anodyne	P2RX7	54	38
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCN(C(C)=O)CC1	ZINC000450929530	FD	On-Demand	Anodyne	RBP4	49	33
COc1ccc(-n2c(C)nnc2SC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000450929538	GD	On-Demand	Anodyne	WNT3A	20	42
COc1ccc(-n2c(C)nnc2SC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000450929538	GD	On-Demand	Anodyne	TNKS2	15	43
COc1ccc(-n2c(C)nnc2SC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000450929538	GD	On-Demand	Anodyne	AXIN2	0	46
COc1ccc(-n2c(C)nnc2SC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000450929539	GD	On-Demand	Anodyne	WNT3A	20	42
COc1ccc(-n2c(C)nnc2SC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000450929539	GD	On-Demand	Anodyne	TNKS2	15	43
COc1ccc(-n2c(C)nnc2SC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000450929539	GD	On-Demand	Anodyne	AXIN2	0	46
CC(=O)NCCN(Cc1cn(CC2CC2)nn1)Cc1ccc(Cl)cc1Cl	ZINC000450929550	GG	On-Demand	Anodyne	P2RX7	24	40
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2CC(c2ccnn2C)C3)c1	ZINC000450929570	DH	On-Demand	Anodyne	KCNH2	41	45
CC(=O)c1cccc(CN2[C@H]3CC[C@H]2CC(c2ccnn2C)C3)c1	ZINC000450929570	DH	On-Demand	Anodyne	CCR3	23	40
COc1ccccc1S(=O)(=O)CCCSc1nc2c(C)ccnc2[nH]1	ZINC000450929581	GG	On-Demand	Anodyne	ENPP1	60	49
Cc1ccnc2[nH]c(SCc3ccc(S(=O)(=O)C(C)C)cc3)nc12	ZINC000450929583	FH	On-Demand	Anodyne	FOLK	0	40
CNC(=O)c1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450929601	CD	On-Demand	Bother	GSTM2	58	38
Brc1cccc(N2CCN(CCc3cscn3)CC2)c1	ZINC000450929603	FG	On-Demand	Anodyne	HTR1A	25	42
Brc1cccc(N2CCN(CCc3cscn3)CC2)c1	ZINC000450929603	FG	On-Demand	Anodyne	HTR2A	18	42
Brc1cccc(N2CCN(CCc3cscn3)CC2)c1	ZINC000450929603	FG	On-Demand	Anodyne	HTR7	20	41
COc1cc(CC(=O)N[C@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929604	DF	On-Demand	Anodyne	DRD2	40	36
COc1cc(CC(=O)N[C@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929604	DF	On-Demand	Anodyne	OPRM1	0	45
COc1cc(CC(=O)N[C@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929604	DF	On-Demand	Anodyne	DRD3	0	44
COc1cc(CC(=O)N[C@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929604	DF	On-Demand	Anodyne	OPRK1	40	45
COc1cc(CC(=O)N[C@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929604	DF	On-Demand	Anodyne	HTR4	62	39
COc1cc(CC(=O)N[C@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929604	DF	On-Demand	Anodyne	BIRC2	45	38
COc1cc(CC(=O)N[C@@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929605	DF	On-Demand	Anodyne	DRD2	40	36
COc1cc(CC(=O)N[C@@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929605	DF	On-Demand	Anodyne	OPRM1	0	45
COc1cc(CC(=O)N[C@@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929605	DF	On-Demand	Anodyne	DRD3	0	44
COc1cc(CC(=O)N[C@@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929605	DF	On-Demand	Anodyne	OPRK1	40	45
COc1cc(CC(=O)N[C@@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929605	DF	On-Demand	Anodyne	HTR4	62	39
COc1cc(CC(=O)N[C@@H]2CCCN(C(C)C)C2)ccc1Cl	ZINC000450929605	DF	On-Demand	Anodyne	BIRC2	45	38
CCC[C@H](O)CN1CCN(c2cccc(Br)c2)CC1	ZINC000450929609	EF	On-Demand	Anodyne	IGF1R	0	51
CCC[C@H](O)CN1CCN(c2cccc(Br)c2)CC1	ZINC000450929609	EF	On-Demand	Anodyne	VACHT_TETCF	0	60
CCC[C@@H](O)CN1CCN(c2cccc(Br)c2)CC1	ZINC000450929610	EF	On-Demand	Anodyne	IGF1R	0	51
CCC[C@@H](O)CN1CCN(c2cccc(Br)c2)CC1	ZINC000450929610	EF	On-Demand	Anodyne	VACHT_TETCF	0	60
COc1ccc(N2CCN(c3nc(C)cc(C#N)n3)CC2)nc1	ZINC000450929611	DD	On-Demand	Mild	GPR119	19	41
Cc1ccc(Br)cc1CC(=O)N[C@H]1CCCN(C(C)C)C1	ZINC000450929618	FG	On-Demand	Anodyne	BIRC2	43	38
Cc1ccc(Br)cc1CC(=O)N[C@@H]1CCCN(C(C)C)C1	ZINC000450929620	FG	On-Demand	Anodyne	BIRC2	43	38
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccccc1	ZINC000450929621	CG	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccccc1	ZINC000450929621	CG	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccccc1	ZINC000450929621	CG	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccccc1	ZINC000450929622	CG	On-Demand	Anodyne	DRD2	30	42
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccccc1	ZINC000450929622	CG	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccccc1	ZINC000450929622	CG	On-Demand	Anodyne	SLC18A3	0	44
Cc1cnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1-c1ccccc1F	ZINC000450929644	GF	On-Demand	Anodyne	HCRTR1	42	37
Cc1cnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1-c1ccccc1F	ZINC000450929644	GF	On-Demand	Anodyne	SMO	16	41
Cc1cnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1-c1ccccc1F	ZINC000450929644	GF	On-Demand	Anodyne	SLC6A7	0	45
CN(C)C(=O)CSc1c(F)cccc1[N+](=O)[O-]	ZINC000450929650	CD	On-Demand	Bother	COLA	57	33
Cc1cccc(CN(C)c2nc3ccccc3nc2N2CCN(C)CC2)n1	ZINC000450929656	FF	On-Demand	Anodyne	HTR3A	21	47
Cc1cccc(CN(C)c2nc3ccccc3nc2N2CCN(C)CC2)n1	ZINC000450929656	FF	On-Demand	Anodyne	HRH4	15	47
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	ACE	38	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	OPRM1	56	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	OPRD1	43	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	MME	97	41
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	ANPEP	74	39
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	BMP1	42	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	CTSB	50	44
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	PAPA1_CARPA	54	41
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	CYSP_TRYCR	61	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	PGA	22	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	TIMP3	41	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	TACR3	24	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	CAPNS1	51	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	GRIA1	41	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	SOAT1	28	48
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	YARS	65	52
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	CAPN1	78	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	CAPN2	90	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	ACE2	68	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929664	ED	On-Demand	Anodyne	NPR	56	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	ACE	38	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	OPRM1	56	38
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	OPRD1	43	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	MME	97	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	ANPEP	74	39
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	BMP1	42	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	CTSB	50	44
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	PAPA1_CARPA	54	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	CYSP_TRYCR	61	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	PGA	22	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	TIMP3	41	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	TACR3	24	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	CAPNS1	51	38
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	GRIA1	41	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	SOAT1	28	48
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	YARS	65	52
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	CAPN1	78	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	CAPN2	90	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	ACE2	68	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929666	ED	On-Demand	Anodyne	NPR	56	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	ACE	38	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	OPRM1	56	38
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	OPRD1	43	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	MME	97	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	ANPEP	74	39
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	BMP1	42	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	CTSB	50	44
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	PAPA1_CARPA	54	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	CYSP_TRYCR	61	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	PGA	22	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	TIMP3	41	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	TACR3	24	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	CAPNS1	51	38
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	GRIA1	41	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	SOAT1	28	48
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	YARS	65	52
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	CAPN1	78	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	CAPN2	90	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	ACE2	68	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929668	ED	On-Demand	Anodyne	NPR	56	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	ACE	38	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	OPRM1	56	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	OPRD1	43	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	MME	97	41
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	ANPEP	74	39
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	BMP1	42	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	CTSB	50	44
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	PAPA1_CARPA	54	41
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	CYSP_TRYCR	61	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	PGA	22	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	TIMP3	41	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	TACR3	24	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	CAPNS1	51	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	GRIA1	41	33
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	SOAT1	28	48
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	YARS	65	52
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	CAPN1	78	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	CAPN2	90	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	ACE2	68	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(O)cc1	ZINC000450929670	ED	On-Demand	Anodyne	NPR	56	34
Brc1ccc(C2CCN(C[C@H]3COCCO3)CC2)cc1	ZINC000450929678	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
Brc1ccc(C2CCN(C[C@@H]3COCCO3)CC2)cc1	ZINC000450929679	EG	On-Demand	Anodyne	VACHT_TETCF	0	40
COCCOC[C@@H](O)CN1CCC[C@@H]1c1ccc(Br)cn1	ZINC000450929680	FE	On-Demand	Anodyne	HSP90AB1	35	40
COCCOC[C@H](O)CN1CCC[C@H]1c1ccc(Br)cn1	ZINC000450929682	FE	On-Demand	Anodyne	HSP90AB1	35	40
COCCOC[C@H](O)CN1CCC[C@@H]1c1ccc(Br)cn1	ZINC000450929685	FE	On-Demand	Anodyne	HSP90AB1	35	40
COCCOC[C@@H](O)CN1CCC[C@H]1c1ccc(Br)cn1	ZINC000450929687	FE	On-Demand	Anodyne	HSP90AB1	35	40
FC1(c2ccccn2)CCN(Cc2ccc(OCc3cccnc3)cc2)CC1	ZINC000450929688	GJ	On-Demand	Anodyne	LTA4H	16	42
FC1(c2ccccn2)CCN(Cc2ccc(OCc3cccnc3)cc2)CC1	ZINC000450929688	GJ	On-Demand	Anodyne	SIGMAR1	38	44
FC1(c2ccccn2)CCN(Cc2ccc(OCc3cccnc3)cc2)CC1	ZINC000450929688	GJ	On-Demand	Anodyne	PRCP	19	41
FC1(c2ccccn2)CCN(Cc2ccc(OCc3cccnc3)cc2)CC1	ZINC000450929688	GJ	On-Demand	Anodyne	FAAH	15	42
CC1CCN(CCN2CCC(F)(c3ccccn3)CC2)CC1	ZINC000450929701	DG	On-Demand	Anodyne	SIGMAR1	24	42
CC(C)N1CCCC[C@H]1CN1CCc2ccc(S(C)(=O)=O)cc2CC1	ZINC000450929704	FF	On-Demand	Anodyne	MLNR	0	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1cccc(C)n1	ZINC000450929707	ED	On-Demand	Anodyne	CA2	38	46
CC(C)N1CCCC[C@@H]1CN1CCc2ccc(S(C)(=O)=O)cc2CC1	ZINC000450929708	FF	On-Demand	Anodyne	MLNR	0	40
CCOCCCSc1nc2c(C)ccnc2[nH]1	ZINC000450929714	CF	On-Demand	Anodyne	ENPP1	23	46
COc1cc(CN2CCC(F)(c3ccccn3)CC2)ccn1	ZINC000450929732	DF	On-Demand	Anodyne	MCHR2	51	33
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC[C@@H](S(C)(=O)=O)CC1	ZINC000450929734	FI	On-Demand	Anodyne	CHRM2	15	44
COC(=O)[C@H](c1ccccc1C(F)(F)F)N1CCC(F)(c2ccccn2)CC1	ZINC000450929735	GI	On-Demand	Anodyne	PLK1	45	35
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC[C@@H](S(C)(=O)=O)CC1	ZINC000450929736	FI	On-Demand	Anodyne	CHRM2	15	44
COC(=O)[C@@H](c1ccccc1C(F)(F)F)N1CCC(F)(c2ccccn2)CC1	ZINC000450929738	GI	On-Demand	Anodyne	PLK1	45	35
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC[C@H](S(C)(=O)=O)CC1	ZINC000450929739	FI	On-Demand	Anodyne	CHRM2	15	44
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC[C@H](S(C)(=O)=O)CC1	ZINC000450929743	FI	On-Demand	Anodyne	CHRM2	15	44
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC[C@H]1CCCO1	ZINC000450929754	EF	On-Demand	Anodyne	OXTR	23	42
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC[C@H]1CCCO1	ZINC000450929754	EF	On-Demand	Anodyne	AVPR1A	0	42
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC[C@@H]1CCCO1	ZINC000450929755	EF	On-Demand	Anodyne	OXTR	23	42
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC[C@@H]1CCCO1	ZINC000450929755	EF	On-Demand	Anodyne	AVPR1A	0	42
Cc1ccnc2[nH]c(SCC(=O)NCc3ccccc3COC(C)C)nc12	ZINC000450929762	GH	On-Demand	Anodyne	ENPP1	74	51
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	HTR1A	24	62
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	DRD2	35	50
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	DRD1	28	54
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	DRD4	29	51
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	HTR2A	41	66
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	HTR2C	30	62
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	SLC6A1	49	35
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	DRD3	0	50
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	ERG2	23	50
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	SLC18A3	0	48
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	HTR3B	0	50
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	CYP2J2	62	44
CS(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929785	EF	On-Demand	Anodyne	AP2S1	0	50
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	HTR1A	24	62
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	DRD2	35	50
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	DRD1	28	54
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	DRD4	29	51
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	HTR2A	41	66
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	HTR2C	30	62
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	SLC6A1	49	35
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	DRD3	0	50
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	ERG2	23	50
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	SLC18A3	0	48
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	HTR3B	0	50
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	CYP2J2	62	44
CS(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450929786	EF	On-Demand	Anodyne	AP2S1	0	50
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450929787	DC	On-Demand	Bother	BDKRB1	0	42
COC(=O)c1ccc(CN2C[C@H](O)C[C@H]2c2cccc(OC)c2)cc1Cl	ZINC000450929791	GG	On-Demand	Anodyne	DRD4	40	31
COC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2c2cccc(OC)c2)cc1Cl	ZINC000450929793	GG	On-Demand	Anodyne	DRD4	40	31
COC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2c2cccc(OC)c2)cc1Cl	ZINC000450929795	GG	On-Demand	Anodyne	DRD4	40	31
FC1(c2ccccn2)CCN(CCOCCOc2ccccc2)CC1	ZINC000450929811	EG	On-Demand	Anodyne	LTA4H	44	43
FC1(c2ccccn2)CCN(CCOCCOc2ccccc2)CC1	ZINC000450929811	EG	On-Demand	Anodyne	PSMB2	47	38
FC1(c2ccccn2)CCN(CCOCCOc2ccccc2)CC1	ZINC000450929811	EG	On-Demand	Anodyne	PSMB1	40	37
CN(C)C(=O)CSc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000450929821	CD	On-Demand	Mild	GSTM2	49	33
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1[N+](=O)[O-]	ZINC000450929837	EG	On-Demand	Bother	SSTR5	42	38
CCCCNc1cc(N(C)Cc2cccc(C)n2)nc(N)n1	ZINC000450929842	DE	On-Demand	Anodyne	HRH4	26	41
CC(C)N(C(=O)CN1CCC(F)(c2ccccn2)CC1)C1CCCC1	ZINC000450929849	EH	On-Demand	Anodyne	SCARB1	53	41
O=c1cc(CN2CCC(F)(c3ccccn3)CC2)occ1O	ZINC000450929858	DE	On-Demand	Anodyne	DAO	31	41
COC(=O)[C@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)O1	ZINC000450929865	CE	On-Demand	Anodyne	SLC6A1	34	49
CN(CCN1CC[C@]2(CCCOC2)C1)Cc1ccccc1	ZINC000450929876	CF	On-Demand	Anodyne	SIGMAR1	22	42
CN(CCN1CC[C@@]2(CCCOC2)C1)Cc1ccccc1	ZINC000450929877	CF	On-Demand	Anodyne	SIGMAR1	22	42
COC(=O)c1ccc(C(=O)CS(=O)(=O)c2ccc3c(c2)OCCO3)o1	ZINC000450929880	FD	On-Demand	Anodyne	BMP1	49	36
COC(=O)c1ccc(C(=O)CS(=O)(=O)c2ccc3c(c2)OCCO3)o1	ZINC000450929880	FD	On-Demand	Anodyne	PKM	33	40
CCc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2ccccc2n1	ZINC000450929898	FF	On-Demand	Anodyne	CCKAR	55	33
CCc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2ccccc2n1	ZINC000450929898	FF	On-Demand	Anodyne	SMO	38	46
C[C@H]1CN(c2ccc(F)cc2[N+](=O)[O-])CCN1C(=O)c1cnn(C)c1	ZINC000450929906	ED	On-Demand	Bother	HCRTR1	47	31
Cn1cc(-c2ccc(=O)n(CCCCc3ccc(Cl)c(Cl)c3)n2)cn1	ZINC000450929907	GH	On-Demand	Anodyne	DNAE	63	31
COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(N3CCC3)nc2)o1	ZINC000450929915	EG	On-Demand	Anodyne	COLA	45	34
COCc1ccc([C@H]2CCCN2C(=O)c2ccc(N3CCC3)nc2)o1	ZINC000450929916	EG	On-Demand	Anodyne	COLA	45	34
C[C@H]1CN(c2c(C#N)cnc3ccccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450929928	FE	On-Demand	Mild	SMO	30	44
C[C@H]1CN(c2c(C#N)cnc3ccccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450929928	FE	On-Demand	Mild	SLC6A7	0	41
Fc1ccc(CCN2CCC(F)(c3ccccn3)CC2)cc1F	ZINC000450929936	DH	On-Demand	Anodyne	PRCP	0	46
Fc1ccc(CCN2CCC(F)(c3ccccn3)CC2)cc1F	ZINC000450929936	DH	On-Demand	Anodyne	ABCC1	50	41
Fc1ccc(CCN2CCC(F)(c3ccccn3)CC2)cc1F	ZINC000450929936	DH	On-Demand	Anodyne	ABCB1A	61	41
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1nc(-c2ccccc2)cs1	ZINC000450929937	GI	On-Demand	Anodyne	ROCK1	22	44
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1nc(-c2ccccc2)cs1	ZINC000450929937	GI	On-Demand	Anodyne	ROCK2	15	44
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1nc(-c2ccccc2)cs1	ZINC000450929937	GI	On-Demand	Anodyne	NPY5R	22	45
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1nc(-c2ccccc2)cs1	ZINC000450929937	GI	On-Demand	Anodyne	HDAC9	18	46
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1nc(-c2ccccc2)cs1	ZINC000450929937	GI	On-Demand	Anodyne	TRPA1	21	47
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1nc(-c2ccccc2)cs1	ZINC000450929937	GI	On-Demand	Anodyne	SLC27A1	39	40
FC1(c2ccccn2)CCN(Cc2cn(-c3ccccc3)nn2)CC1	ZINC000450929938	EG	On-Demand	Anodyne	EGLN1	0	43
COc1ccc(N2CCN(c3nc(C)c(C#N)cc3Cl)CC2)nc1	ZINC000450929944	EF	On-Demand	Mild	SRC	42	35
COc1ccc(-c2ccnc(N3CCN(c4ccc(OC)cn4)CC3)n2)cc1	ZINC000450929949	GF	On-Demand	Anodyne	SORD	58	49
COc1ccc(-c2ccnc(N3CCN(c4ccc(OC)cn4)CC3)n2)cc1	ZINC000450929949	GF	On-Demand	Anodyne	ZAP70	25	45
COc1ccc(-c2ccnc(N3CCN(c4ccc(OC)cn4)CC3)n2)cc1	ZINC000450929949	GF	On-Demand	Anodyne	DKK1	0	42
COc1ccc(-c2ccnc(N3CCN(c4ccc(OC)cn4)CC3)n2)cc1	ZINC000450929949	GF	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)[C@@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)c1ccc(O)cc1	ZINC000450929959	FE	On-Demand	Anodyne	MME	15	43
COC(=O)[C@@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)c1ccc(O)cc1	ZINC000450929960	FE	On-Demand	Anodyne	MME	15	43
COC(=O)[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)c1ccc(O)cc1	ZINC000450929961	FE	On-Demand	Anodyne	MME	15	43
COC(=O)[C@H](NC(=O)[C@H](C)OCc1ccc(F)cc1)c1ccc(O)cc1	ZINC000450929962	FE	On-Demand	Anodyne	MME	15	43
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	HTR1A	84	53
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	DRD2	49	44
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	HTR2A	62	52
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	HTR2C	40	52
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	ADRA1A	22	40
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	DRD3	50	40
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	DRD5	23	40
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	HTR7	95	50
CCC(=O)CCCN1CCN(c2cccc(Br)c2)CC1	ZINC000450929975	EG	On-Demand	Anodyne	CACNA1G	0	47
COc1ccc(N2CCN(c3nccc4cc([N+](=O)[O-])ccc34)CC2)nc1	ZINC000450929982	FF	On-Demand	Bother	KAT2B	0	40
COC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(O)cc1	ZINC000450929983	ED	On-Demand	Anodyne	HPGDS	15	40
COC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(O)cc1	ZINC000450929984	ED	On-Demand	Anodyne	HPGDS	15	40
COc1ccc(N2CCN(c3cccc(C#N)c3[N+](=O)[O-])CC2)nc1	ZINC000450929996	EE	On-Demand	Mild	DRD4	41	34
N#Cc1cccc(NC(=O)CCN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450929997	FG	On-Demand	Mild	CACNA1H	15	42
N#Cc1cccc(NC(=O)CCN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450929997	FG	On-Demand	Mild	CCR3	17	43
N#Cc1cccc(NC(=O)CCN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450929997	FG	On-Demand	Mild	MCHR1	35	40
COc1ccc(N2CCN(c3cccc(C(N)=O)c3[N+](=O)[O-])CC2)nc1	ZINC000450930002	FD	On-Demand	Bother	HTR1A	20	40
COCc1cccc(CNC(=O)COc2c(C(C)=O)cccc2C(F)(F)F)c1	ZINC000450930009	GH	On-Demand	Anodyne	NR1H2	41	37
CCOC(=O)c1c(CSc2nc3c(C)ccnc3[nH]2)noc1C	ZINC000450930038	EG	On-Demand	Anodyne	ENPP1	24	45
Cc1c(Cl)cccc1N1CCCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450930048	EF	On-Demand	Anodyne	HTR2A	33	45
Cc1c(Cl)cccc1N1CCCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450930048	EF	On-Demand	Anodyne	HTR2C	31	43
Cc1c(Cl)cccc1N1CCCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450930048	EF	On-Demand	Anodyne	DRD3	31	40
Cc1c(Cl)cccc1N1CCCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450930048	EF	On-Demand	Anodyne	NOX1	52	31
Cc1c(Cl)cccc1N1CCCN(C[C@@H](C)S(C)(=O)=O)CC1	ZINC000450930048	EF	On-Demand	Anodyne	NOX5	49	31
Cc1c(Cl)cccc1N1CCCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450930049	EF	On-Demand	Anodyne	HTR2A	33	45
Cc1c(Cl)cccc1N1CCCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450930049	EF	On-Demand	Anodyne	HTR2C	31	43
Cc1c(Cl)cccc1N1CCCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450930049	EF	On-Demand	Anodyne	DRD3	31	40
Cc1c(Cl)cccc1N1CCCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450930049	EF	On-Demand	Anodyne	NOX1	52	31
Cc1c(Cl)cccc1N1CCCN(C[C@H](C)S(C)(=O)=O)CC1	ZINC000450930049	EF	On-Demand	Anodyne	NOX5	49	31
CCCc1nc(C)c(CSc2nnc(C)n2-c2ccc(OC)cc2)o1	ZINC000450930064	FI	On-Demand	Anodyne	AXIN2	0	56
CN(C)C(=O)CSc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450930065	EF	On-Demand	Anodyne	ROS1	40	30
COc1ccc(-n2c(C)nnc2SC[C@H](Cc2ccccc2)OC)cc1	ZINC000450930074	FH	On-Demand	Anodyne	WNT3A	22	45
COc1ccc(-n2c(C)nnc2SC[C@H](Cc2ccccc2)OC)cc1	ZINC000450930074	FH	On-Demand	Anodyne	AXIN2	0	49
COc1ccc(-n2c(C)nnc2SC[C@@H](Cc2ccccc2)OC)cc1	ZINC000450930075	FH	On-Demand	Anodyne	WNT3A	22	45
COc1ccc(-n2c(C)nnc2SC[C@@H](Cc2ccccc2)OC)cc1	ZINC000450930075	FH	On-Demand	Anodyne	AXIN2	0	49
Cc1c(Cl)cccc1N1CCCN(CCc2cscn2)CC1	ZINC000450930077	EH	On-Demand	Anodyne	DRD2	29	43
Cc1c(Cl)cccc1N1CCCN(CCc2cscn2)CC1	ZINC000450930077	EH	On-Demand	Anodyne	HTR1D	42	33
Cc1c(Cl)cccc1N1CCCN(CCc2cscn2)CC1	ZINC000450930077	EH	On-Demand	Anodyne	HTR2A	34	42
Cc1c(Cl)cccc1N1CCCN(CCc2cscn2)CC1	ZINC000450930077	EH	On-Demand	Anodyne	HTR2C	26	42
Cc1c(Cl)cccc1N1CCCN(CCc2cscn2)CC1	ZINC000450930077	EH	On-Demand	Anodyne	SLC6A4	20	42
Cc1c(Cl)cccc1N1CCCN(CCc2cscn2)CC1	ZINC000450930077	EH	On-Demand	Anodyne	DRD3	38	42
C[C@H]1CN(c2cc(Br)ccn2)CCN1C(=O)c1cnn(C)c1	ZINC000450930096	FD	On-Demand	Anodyne	SLC6A7	0	45
C[C@@H](O)CCN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930097	CE	On-Demand	Anodyne	HTR1A	25	48
C[C@H](O)CCN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930098	CE	On-Demand	Anodyne	HTR1A	25	48
CCC[C@H](O)CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930099	CF	On-Demand	Anodyne	ABCB1	0	40
CCC[C@@H](O)CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930100	CF	On-Demand	Anodyne	ABCB1	0	40
Nc1ncccc1CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930102	DF	On-Demand	Anodyne	DRD1	0	44
Nc1ncccc1CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930102	DF	On-Demand	Anodyne	DRD4	34	45
CCCCNc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc(N)n1	ZINC000450930105	FD	On-Demand	Anodyne	HRH4	23	44
Cc1ccnc2[nH]c(SCC(=O)N3CCN(Cc4ccco4)CC3)nc12	ZINC000450930106	FE	On-Demand	Anodyne	ENPP1	22	44
COC(=O)CNC(=O)c1ccc(N2C[C@H]3[C@@H]4CC[C@@H](C4)[C@@]3(C)C2)c([N+](=O)[O-])c1	ZINC000450930120	GE	On-Demand	Bother	TAAR1	15	40
COC(=O)CNC(=O)c1ccc(N2C[C@@H]3[C@@H]4CC[C@@H](C4)[C@@]3(C)C2)c([N+](=O)[O-])c1	ZINC000450930121	GE	On-Demand	Bother	TAAR1	15	40
CC(=O)c1c(F)cccc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450930130	EE	On-Demand	Anodyne	SLC6A7	0	43
COC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2c2cccc(OC)c2)cc1Cl	ZINC000450930134	GG	On-Demand	Anodyne	DRD4	40	31
CCC(=O)C1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CC1	ZINC000450930135	GJ	On-Demand	Anodyne	CSF1R	15	43
CCC(=O)C1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CC1	ZINC000450930135	GJ	On-Demand	Anodyne	BTK	18	40
CCC(=O)C1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CC1	ZINC000450930135	GJ	On-Demand	Anodyne	TAAR1	21	40
CCC(=O)C1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CC1	ZINC000450930135	GJ	On-Demand	Anodyne	KCNK3	93	49
CCC(=O)C1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CC1	ZINC000450930135	GJ	On-Demand	Anodyne	KCNK9	50	49
Cc1ccc2oc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)nc2c1	ZINC000450930142	EE	On-Demand	Anodyne	HCRTR1	48	50
Cc1ccc2oc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)nc2c1	ZINC000450930142	EE	On-Demand	Anodyne	HCRTR2	33	50
Cc1ccc(Br)cc1CS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450930144	GH	On-Demand	Anodyne	PKM	36	43
Cc1ccnc2[nH]c(SCC(=O)N[C@@H](C)C(C)C)nc12	ZINC000450930146	CF	On-Demand	Anodyne	ENPP1	60	39
Cc1ccnc2[nH]c(SCC(=O)N[C@H](C)C(C)C)nc12	ZINC000450930148	CF	On-Demand	Anodyne	ENPP1	60	39
O=c1c(Cl)c(N[C@@H]2C[C@H](O)C2)cnn1-c1ccc(Cl)cc1Cl	ZINC000450930153	FG	On-Demand	Anodyne	CNR1	50	31
Cc1ccccc1CNC(=O)[C@@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450930158	EG	On-Demand	Anodyne	AMP1_PLAFQ	18	41
Cc1ccccc1CNC(=O)[C@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450930159	EG	On-Demand	Anodyne	AMP1_PLAFQ	18	41
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N[C@@H]1C[C@H](O)C1	ZINC000450930163	FE	On-Demand	Bother	DDIT3	0	40
O[C@H](Cc1ccccc1)CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930169	EG	On-Demand	Anodyne	VACHT_TETCF	0	55
O[C@H](Cc1ccccc1)CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930169	EG	On-Demand	Anodyne	ABCB1	46	43
CC(=O)NCCN(Cc1cnn[nH]1)Cc1ccc(Cl)cc1Cl	ZINC000450930195	EE	On-Demand	Anodyne	ALPL	41	34
C[C@H](c1ccc(CS(=O)(=O)c2ccc3c(c2)OCCO3)cc1)C(F)(F)F	ZINC000450930205	GI	On-Demand	Anodyne	PKM	36	40
C[C@@H](c1ccc(CS(=O)(=O)c2ccc3c(c2)OCCO3)cc1)C(F)(F)F	ZINC000450930207	GI	On-Demand	Anodyne	PKM	36	40
Cc1ccnc2[nH]c(SCC(=O)N(CC(C)C)[C@@H]3CCS(=O)(=O)C3)nc12	ZINC000450930208	GE	On-Demand	Anodyne	ENPP1	22	42
COc1ccc(CNC(=O)CCSC[C@@H]2CCCO2)c(OC)c1	ZINC000450930209	EF	On-Demand	Anodyne	MTNR1A	41	36
COC(=O)c1ccc(C)c(NC(=O)c2ccc(N3CCC3)nc2)c1O	ZINC000450930210	EE	On-Demand	Anodyne	HPGDS	15	40
Cc1ccnc2[nH]c(SCC(=O)N(CC(C)C)[C@H]3CCS(=O)(=O)C3)nc12	ZINC000450930211	GE	On-Demand	Anodyne	ENPP1	22	42
COc1ccc(CNC(=O)CCSC[C@H]2CCCO2)c(OC)c1	ZINC000450930212	EF	On-Demand	Anodyne	MTNR1A	41	36
CCO[C@@H]1CCCC[C@H]1Nc1cc(CC)nc2ncnn12	ZINC000450930228	CE	On-Demand	Anodyne	DHOD	0	46
CC(C)N1CCC[C@H](NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450930257	EF	On-Demand	Anodyne	SSTR5	26	41
CC(C)N1CCC[C@@H](NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450930259	EF	On-Demand	Anodyne	SSTR5	26	41
CCCc1cc(NCc2ncccc2OC)n2ncnc2n1	ZINC000450930264	CE	On-Demand	Anodyne	DHOD	0	43
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC1CCCCC1	ZINC000450930268	EH	On-Demand	Anodyne	EPHX2	19	47
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NC1CCCCC1	ZINC000450930268	EH	On-Demand	Anodyne	LUXN	0	46
Cc1ccnc2[nH]c(SCC(=O)NC[C@@H](c3ccccc3)N(C)C)nc12	ZINC000450930275	FF	On-Demand	Anodyne	ENPP1	54	35
Cc1ccnc2[nH]c(SCC(=O)NC[C@H](c3ccccc3)N(C)C)nc12	ZINC000450930281	FF	On-Demand	Anodyne	ENPP1	54	35
COC1(CSc2nnc(CO)n2-c2ccccc2)CCC1	ZINC000450930294	DE	On-Demand	Anodyne	VCP	44	38
FC(F)(F)Cn1ccc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)n1	ZINC000450930295	EI	On-Demand	Anodyne	SLC18A3	20	42
COc1cccnc1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450930296	EF	On-Demand	Bother	TAAR1	19	48
CC1CCN(C(=O)c2ccc(NC[C@@H]3C[C@H]3C3CC3)nc2)CC1	ZINC000450930297	DG	On-Demand	Anodyne	L3MBTL3	57	32
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2SC)c(OC)c1	ZINC000450930303	GH	On-Demand	Anodyne	MTNR1A	63	40
COc1ccc(CNC(=O)CCN[C@H](C)c2ccccc2SC)c(OC)c1	ZINC000450930303	GH	On-Demand	Anodyne	MTNR1B	56	40
CCS(=O)(=O)c1ccc(CN2CCc3cc(F)cc(C)c3C2)cc1	ZINC000450930312	EG	On-Demand	Anodyne	NOD2	41	36
CN(c1ccnc(-c2ccccc2)n1)C1CCN(CC(F)(F)F)CC1	ZINC000450930318	FH	On-Demand	Anodyne	HPGDS	24	45
COc1ccccc1NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450930328	EF	On-Demand	Anodyne	DRD4	15	51
COc1cccnc1CNc1cc(N2CCC[C@@H]2CO)ncn1	ZINC000450930332	DD	On-Demand	Anodyne	ACKR3	49	30
COc1cccnc1CNc1cc(N2CCC[C@H]2CO)ncn1	ZINC000450930334	DD	On-Demand	Anodyne	ACKR3	49	30
O=S(=O)(CCc1ccc(Cl)cc1)c1ccc2c(c1)OCCO2	ZINC000450930336	EG	On-Demand	Anodyne	PKM	27	40
COc1ccc(CN(C)C(=O)[C@@H](C)Sc2nc3c(C)ccnc3[nH]2)cc1F	ZINC000450930341	GH	On-Demand	Anodyne	ENPP1	65	48
COc1ccc(CN(C)C(=O)[C@H](C)Sc2nc3c(C)ccnc3[nH]2)cc1F	ZINC000450930348	GH	On-Demand	Anodyne	ENPP1	65	48
CCO[C@@H]1CCCC[C@H]1Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450930358	EF	On-Demand	Anodyne	DHOD	0	47
O=C(c1cnc(N[C@@H]2C[C@H](O)C2)c(Cl)c1)N1CCOCC1	ZINC000450930362	DD	On-Demand	Anodyne	AKR1C3	26	42
O=C(c1cnc(N[C@@H]2C[C@H](O)C2)c(Cl)c1)N1CCOCC1	ZINC000450930362	DD	On-Demand	Anodyne	LRRK2	28	44
CCSc1cccnc1C(=O)N[C@@H]1CCCN(C(C)C)C1	ZINC000450930370	DF	On-Demand	Anodyne	BIRC2	40	36
Cc1cccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc12	ZINC000450930371	FE	On-Demand	Anodyne	LIMK2	77	41
Cc1cccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc12	ZINC000450930371	FE	On-Demand	Anodyne	SMO	16	48
Cc1cccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc12	ZINC000450930371	FE	On-Demand	Anodyne	SLC6A7	0	42
CCSc1cccnc1C(=O)N[C@H]1CCCN(C(C)C)C1	ZINC000450930372	DF	On-Demand	Anodyne	BIRC2	40	36
COC[C@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930375	DF	On-Demand	Anodyne	DRD4	41	32
COC[C@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930375	DF	On-Demand	Anodyne	COLA	94	37
COC[C@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930375	DF	On-Demand	Anodyne	CPT1A	85	37
COC[C@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930375	DF	On-Demand	Anodyne	CPT2	45	37
COC[C@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930375	DF	On-Demand	Anodyne	CHRNA10	34	45
COC[C@@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930377	DF	On-Demand	Anodyne	DRD4	41	32
COC[C@@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930377	DF	On-Demand	Anodyne	COLA	94	37
COC[C@@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930377	DF	On-Demand	Anodyne	CPT1A	85	37
COC[C@@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930377	DF	On-Demand	Anodyne	CPT2	45	37
COC[C@@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450930377	DF	On-Demand	Anodyne	CHRNA10	34	45
COc1cc(OC)nc(N(C)Cc2cccc(C)n2)n1	ZINC000450930401	CD	On-Demand	Anodyne	ALS	41	33
CC(C)N1CCC[C@@H](NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)C1	ZINC000450930408	GE	On-Demand	Anodyne	BIRC2	40	34
CC(C)N1CCC[C@H](NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)C1	ZINC000450930409	GE	On-Demand	Anodyne	BIRC2	40	34
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1ccccc1C(C)C	ZINC000450930410	GK	On-Demand	Anodyne	KCNK3	37	41
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1ccccc1C(C)C	ZINC000450930410	GK	On-Demand	Anodyne	KCNK9	39	41
CCOC(=O)c1nc(N2CCN(c3ccc(OC)cn3)CC2)cc(C(C)(C)C)n1	ZINC000450930427	GF	On-Demand	Anodyne	CCKAR	15	42
CC(=O)c1cccc(CN2CC[C@@](F)(CO)C2)c1	ZINC000450930445	CD	On-Demand	Anodyne	MCHR2	48	32
CC(=O)c1cccc(CN2CC[C@@](F)(CO)C2)c1	ZINC000450930445	CD	On-Demand	Anodyne	NPFFR1	42	32
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccc(O)cc1	ZINC000450930446	GH	On-Demand	Anodyne	RBP4	80	42
CC(=O)c1cccc(CN2CC[C@](F)(CO)C2)c1	ZINC000450930448	CD	On-Demand	Anodyne	MCHR2	48	32
CC(=O)c1cccc(CN2CC[C@](F)(CO)C2)c1	ZINC000450930448	CD	On-Demand	Anodyne	NPFFR1	42	32
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccccc1	ZINC000450930457	CE	On-Demand	Anodyne	DRD2	34	48
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccccc1	ZINC000450930457	CE	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccccc1	ZINC000450930457	CE	On-Demand	Anodyne	SLC6A1	23	41
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccccc1	ZINC000450930457	CE	On-Demand	Anodyne	SLC18A3	0	52
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccccc1	ZINC000450930457	CE	On-Demand	Anodyne	EBP	25	45
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccccc1	ZINC000450930457	CE	On-Demand	Anodyne	CYP2J2	58	41
O=C(CCCN1CC[C@](F)(CO)C1)c1ccccc1	ZINC000450930458	CE	On-Demand	Anodyne	DRD2	34	48
O=C(CCCN1CC[C@](F)(CO)C1)c1ccccc1	ZINC000450930458	CE	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CC[C@](F)(CO)C1)c1ccccc1	ZINC000450930458	CE	On-Demand	Anodyne	SLC6A1	23	41
O=C(CCCN1CC[C@](F)(CO)C1)c1ccccc1	ZINC000450930458	CE	On-Demand	Anodyne	SLC18A3	0	52
O=C(CCCN1CC[C@](F)(CO)C1)c1ccccc1	ZINC000450930458	CE	On-Demand	Anodyne	EBP	25	45
O=C(CCCN1CC[C@](F)(CO)C1)c1ccccc1	ZINC000450930458	CE	On-Demand	Anodyne	CYP2J2	58	41
COCCOC[C@@H](O)CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930460	ED	On-Demand	Anodyne	ABCB1	40	38
COCCOC[C@@H](O)CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930460	ED	On-Demand	Anodyne	HSP90AB1	41	44
COCCOC[C@H](O)CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930465	ED	On-Demand	Anodyne	ABCB1	40	38
COCCOC[C@H](O)CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450930465	ED	On-Demand	Anodyne	HSP90AB1	41	44
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CC(F)(F)F)CC1	ZINC000450930474	DH	On-Demand	Anodyne	SLC6A3	23	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CC(F)(F)F)CC1	ZINC000450930476	DH	On-Demand	Anodyne	SLC6A3	18	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CC(F)(F)F)CC1	ZINC000450930479	DH	On-Demand	Anodyne	SLC6A3	18	42
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CC(F)(F)F)CC1	ZINC000450930481	DH	On-Demand	Anodyne	SLC6A3	23	42
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	ADORA1	171	72
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	SLC29A1	131	53
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	P2RY12	51	43
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	ADORA2A	59	67
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	ADORA2B	25	59
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	GAPC	0	40
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	ADK	70	52
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	AK3	0	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	AHCY	48	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	P2RX4	35	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	P2RX1	46	39
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	P2RY1	40	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	P2RY11	0	40
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	AMD1	37	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	ITPR1	52	38
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	AK2	0	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	NS5B	0	43
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	ADORA3	128	64
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	OXGR1	121	43
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	QARS	0	40
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	IMPDH2	52	35
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	AK	0	46
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	RNASE1	46	36
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	MBTA	0	43
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	DNMT3B	70	40
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	Q4VQ11_PIG	90	64
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	GPR17	58	47
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	SAE1	0	42
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	DOT1L	87	44
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	NAE1	0	42
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	UBA6	0	42
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@@H]1CCC[C@@H](C)C1	ZINC000450930488	GD	On-Demand	Anodyne	UBA7	0	42
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	ADORA1	171	72
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	SLC29A1	131	53
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	P2RY12	51	43
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	ADORA2A	59	67
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	ADORA2B	25	59
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	GAPC	0	40
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	ADK	70	52
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	AK3	0	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	AHCY	48	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	P2RX4	35	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	P2RX1	46	39
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	P2RY1	40	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	P2RY11	0	40
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	AMD1	37	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	ITPR1	52	38
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	AK2	0	41
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	NS5B	0	43
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	ADORA3	128	64
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	OXGR1	121	43
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	QARS	0	40
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	IMPDH2	52	35
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	AK	0	46
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	RNASE1	46	36
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	MBTA	0	43
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	DNMT3B	70	40
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	Q4VQ11_PIG	90	64
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	GPR17	58	47
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	SAE1	0	42
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	DOT1L	87	44
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	NAE1	0	42
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	UBA6	0	42
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)[C@H]1CCC[C@@H](C)C1	ZINC000450930490	GD	On-Demand	Anodyne	UBA7	0	42
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	ADORA1	171	72
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	SLC29A1	131	53
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	P2RY12	51	43
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	ADORA2A	59	67
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	ADORA2B	25	59
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	GAPC	0	40
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	ADK	70	52
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	AK3	0	41
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	AHCY	48	41
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	P2RX4	35	41
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	P2RX1	46	39
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	P2RY1	40	41
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	P2RY11	0	40
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	AMD1	37	41
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	ITPR1	52	38
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	AK2	0	41
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	NS5B	0	43
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	ADORA3	128	64
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	OXGR1	121	43
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	QARS	0	40
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	IMPDH2	52	35
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	AK	0	46
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	RNASE1	46	36
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	MBTA	0	43
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	DNMT3B	70	40
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	Q4VQ11_PIG	90	64
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	GPR17	58	47
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	SAE1	0	42
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	DOT1L	87	44
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	NAE1	0	42
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	UBA6	0	42
C[C@H]1CCC[C@@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930491	GD	On-Demand	Anodyne	UBA7	0	42
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	ADORA1	171	72
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	SLC29A1	131	53
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	P2RY12	51	43
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	ADORA2A	59	67
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	ADORA2B	25	59
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	GAPC	0	40
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	ADK	70	52
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	AK3	0	41
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	AHCY	48	41
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	P2RX4	35	41
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	P2RX1	46	39
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	P2RY1	40	41
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	P2RY11	0	40
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	AMD1	37	41
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	ITPR1	52	38
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	AK2	0	41
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	NS5B	0	43
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	ADORA3	128	64
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	OXGR1	121	43
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	QARS	0	40
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	IMPDH2	52	35
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	AK	0	46
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	RNASE1	46	36
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	MBTA	0	43
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	DNMT3B	70	40
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	Q4VQ11_PIG	90	64
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	GPR17	58	47
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	SAE1	0	42
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	DOT1L	87	44
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	NAE1	0	42
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	UBA6	0	42
C[C@H]1CCC[C@H]([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450930492	GD	On-Demand	Anodyne	UBA7	0	42
Cc1ccc([N+](=O)[O-])c(SCC(=O)N(C)C)n1	ZINC000450930498	CD	On-Demand	Bother	GSTP1	41	36
COCc1ccc(CSc2nc3c(C)ccnc3[nH]2)cc1	ZINC000450930510	CH	On-Demand	Anodyne	CYP2C8	21	42
CCOc1cccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450930512	FG	On-Demand	Anodyne	ENPP1	67	55
CCOc1cccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450930512	FG	On-Demand	Anodyne	PDS	70	38
C[C@H]1CN(c2nc3cccc(F)c3n2C)CCN1C(=O)c1cnn(C)c1	ZINC000450930524	FD	On-Demand	Anodyne	SLC6A7	0	42
COC(=O)[C@H](c1ccccc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450930526	FH	On-Demand	Anodyne	OPRM1	19	47
COC(=O)[C@H](c1ccccc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450930526	FH	On-Demand	Anodyne	OPRL1	40	47
COC(=O)[C@@H](c1ccccc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450930527	FH	On-Demand	Anodyne	OPRM1	19	47
COC(=O)[C@@H](c1ccccc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450930527	FH	On-Demand	Anodyne	OPRL1	40	47
O=C(c1ccccc1)N1CC[C@@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930530	FI	On-Demand	Anodyne	CCR2	39	43
O=C(c1ccccc1)N1CC[C@@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930530	FI	On-Demand	Anodyne	RBP4	35	42
O=C(c1ccccc1)N1CC[C@@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930530	FI	On-Demand	Anodyne	PTGDR2	20	40
O=C(c1ccccc1)N1CC[C@@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930530	FI	On-Demand	Anodyne	LIPG	56	40
O=C(c1ccccc1)N1CC[C@@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930530	FI	On-Demand	Anodyne	SMO	36	44
O=C(c1ccccc1)N1CC[C@@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930530	FI	On-Demand	Anodyne	MAP3K12	28	41
O=C(c1ccccc1)N1CC[C@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930531	FI	On-Demand	Anodyne	CCR2	39	43
O=C(c1ccccc1)N1CC[C@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930531	FI	On-Demand	Anodyne	RBP4	35	42
O=C(c1ccccc1)N1CC[C@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930531	FI	On-Demand	Anodyne	PTGDR2	20	40
O=C(c1ccccc1)N1CC[C@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930531	FI	On-Demand	Anodyne	LIPG	56	40
O=C(c1ccccc1)N1CC[C@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930531	FI	On-Demand	Anodyne	SMO	36	44
O=C(c1ccccc1)N1CC[C@H](COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450930531	FI	On-Demand	Anodyne	MAP3K12	28	41
CCS(=O)(=O)c1ccc(CN2CCCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000450930534	GD	On-Demand	Anodyne	HRH3	20	42
CCCC[C@H](SCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450930537	EG	On-Demand	Anodyne	Q9JN24_ECOLX	0	41
CCCC[C@@H](SCc1ccc(S(=O)(=O)CC)cc1)C(=O)OC	ZINC000450930538	EG	On-Demand	Anodyne	Q9JN24_ECOLX	0	41
CC(=O)c1cccc(C(F)(F)F)c1OC[C@@H]1CCCO1	ZINC000450930540	CG	On-Demand	Anodyne	OXTR	24	43
CC(=O)c1cccc(C(F)(F)F)c1OC[C@@H]1CCCO1	ZINC000450930540	CG	On-Demand	Anodyne	AVPR1A	0	43
CC(=O)c1cccc(C(F)(F)F)c1OC[C@H]1CCCO1	ZINC000450930542	CG	On-Demand	Anodyne	OXTR	24	43
CC(=O)c1cccc(C(F)(F)F)c1OC[C@H]1CCCO1	ZINC000450930542	CG	On-Demand	Anodyne	AVPR1A	0	43
CC(C)OC(=O)c1cccnc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450930551	FD	On-Demand	Anodyne	SLC6A7	0	44
O=C(CN1CCC(F)(c2ccccn2)CC1)NCc1cc(F)cc(F)c1	ZINC000450930562	FF	On-Demand	Anodyne	CALCA	0	40
O=C(CN1CCC(F)(c2ccccn2)CC1)NCc1cc(F)cc(F)c1	ZINC000450930562	FF	On-Demand	Anodyne	EGLN1	0	41
C=CCCC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450930568	CH	On-Demand	Mild	PPARD	41	38
C=CCCC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450930568	CH	On-Demand	Mild	PTGDR2	30	43
Cn1ncnc1[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450930581	ED	On-Demand	Anodyne	CYP2J2	45	32
Cn1ncnc1[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450930583	ED	On-Demand	Anodyne	CYP2J2	45	32
O=C(CN1CCC(F)(c2ccccn2)CC1)NC1CCN(C2CC2)CC1	ZINC000450930584	FE	On-Demand	Anodyne	CCR2	15	45
CC(=O)[C@@](C)(O)CN1CCc2ccc(Br)cc2C1	ZINC000450930621	DE	On-Demand	Anodyne	HSD17B3	47	39
CC(=O)[C@](C)(O)CN1CCc2ccc(Br)cc2C1	ZINC000450930623	DE	On-Demand	Anodyne	HSD17B3	47	39
CC[C@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930629	EG	On-Demand	Anodyne	CDC25B	27	45
CC[C@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930629	EG	On-Demand	Anodyne	GYS1	60	39
CC[C@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930629	EG	On-Demand	Anodyne	ACE2	40	41
CC[C@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930629	EG	On-Demand	Anodyne	FFAR4	43	37
CC[C@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930629	EG	On-Demand	Anodyne	PDS	61	40
CC[C@@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930631	EG	On-Demand	Anodyne	CDC25B	27	45
CC[C@@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930631	EG	On-Demand	Anodyne	GYS1	60	39
CC[C@@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930631	EG	On-Demand	Anodyne	ACE2	40	41
CC[C@@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930631	EG	On-Demand	Anodyne	FFAR4	43	37
CC[C@@H](O)CC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000450930631	EG	On-Demand	Anodyne	PDS	61	40
COc1ccc(CNC(=O)CCN2CCCC[C@H]2c2cnn(C)c2)c(OC)c1	ZINC000450930639	GF	On-Demand	Anodyne	PDGFRB	43	45
COc1ccc(CNC(=O)CCN2CCCC[C@H]2c2cnn(C)c2)c(OC)c1	ZINC000450930639	GF	On-Demand	Anodyne	CSF1R	17	45
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2c2cnn(C)c2)c(OC)c1	ZINC000450930641	GF	On-Demand	Anodyne	PDGFRB	43	45
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2c2cnn(C)c2)c(OC)c1	ZINC000450930641	GF	On-Demand	Anodyne	CSF1R	17	45
CC(=O)[C@@](C)(O)CN1CCC(c2ccc(Br)cc2)CC1	ZINC000450930644	EF	On-Demand	Anodyne	VACHT_TETCF	0	42
CC(=O)[C@](C)(O)CN1CCC(c2ccc(Br)cc2)CC1	ZINC000450930645	EF	On-Demand	Anodyne	VACHT_TETCF	0	42
N#CCNC(=O)Cn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21	ZINC000450930656	GE	On-Demand	Mild	SCD	19	49
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(c1ccnn1C)C2	ZINC000450930658	EG	On-Demand	Anodyne	SLC6A3	15	50
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(c1ccnn1C)C2	ZINC000450930658	EG	On-Demand	Anodyne	SLC18A3	19	50
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(c1ccnn1C)C2	ZINC000450930659	EG	On-Demand	Anodyne	SLC6A3	15	50
C[C@@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(c1ccnn1C)C2	ZINC000450930659	EG	On-Demand	Anodyne	SLC18A3	19	50
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(c1ccnn1C)C2	ZINC000450930660	EG	On-Demand	Anodyne	SLC6A3	15	50
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1CC(c1ccnn1C)C2	ZINC000450930660	EG	On-Demand	Anodyne	SLC18A3	19	50
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(c1ccnn1C)C2	ZINC000450930663	EG	On-Demand	Anodyne	SLC6A3	15	50
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1CC(c1ccnn1C)C2	ZINC000450930663	EG	On-Demand	Anodyne	SLC18A3	19	50
CN(C)C(=O)CSc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1	ZINC000450930665	EF	On-Demand	Bother	GSTM2	48	40
CN(C)C(=O)CSc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1	ZINC000450930665	EF	On-Demand	Bother	GSTP1	43	40
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H]2C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450930672	EC	On-Demand	Bother	TAAR1	17	42
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H]2C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450930673	EC	On-Demand	Bother	TAAR1	17	42
COc1cccnc1CNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450930676	ED	On-Demand	Anodyne	NAMPT	29	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](S(C)(=O)=O)CC1	ZINC000450930691	EE	On-Demand	Anodyne	OPRK1	27	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](S(C)(=O)=O)CC1	ZINC000450930692	EE	On-Demand	Anodyne	OPRK1	27	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](S(C)(=O)=O)CC1	ZINC000450930693	EE	On-Demand	Anodyne	OPRK1	27	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](S(C)(=O)=O)CC1	ZINC000450930694	EE	On-Demand	Anodyne	OPRK1	27	40
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	CHRM2	18	42
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	HTR1A	16	49
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	DRD2	32	44
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	DRD4	64	44
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	ACHE	37	44
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	DRD3	15	41
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	CHRM3	29	42
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	SIGMAR1	48	46
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	CCR3	36	40
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	CXCR3	24	41
CC(=O)c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000450930695	EH	On-Demand	Anodyne	SCD1	18	52
COC(=O)c1csc(CN2CCOC[C@H]2c2nc(-c3ccccc3)no2)n1	ZINC000450930699	GF	On-Demand	Anodyne	COLA	48	42
COC(=O)c1csc(CN2CCOC[C@H]2c2nc(-c3ccccc3)no2)n1	ZINC000450930699	GF	On-Demand	Anodyne	CPT1A	43	42
COC(=O)c1csc(CN2CCOC[C@@H]2c2nc(-c3ccccc3)no2)n1	ZINC000450930700	GF	On-Demand	Anodyne	COLA	48	42
COC(=O)c1csc(CN2CCOC[C@@H]2c2nc(-c3ccccc3)no2)n1	ZINC000450930700	GF	On-Demand	Anodyne	CPT1A	43	42
Oc1nnc(C2CCN(CCc3ccc(Cl)cc3)CC2)o1	ZINC000450930719	DF	On-Demand	Anodyne	DRD4	15	44
Oc1nnc(C2CCN(CCc3ccc(Cl)cc3)CC2)o1	ZINC000450930719	DF	On-Demand	Anodyne	SIGMAR1	20	44
COc1cccnc1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450930731	FE	On-Demand	Bother	BCL2L1	26	42
COc1cccnc1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450930731	FE	On-Demand	Bother	BCL2	17	42
COc1cccnc1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450930731	FE	On-Demand	Bother	TAAR1	20	42
COc1cccnc1CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450930731	FE	On-Demand	Bother	LRRK2	37	46
COc1cccnc1CNc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450930733	ED	On-Demand	Anodyne	NPY2R	69	38
COCCOC[C@@H](O)CN1CCOc2cc(OC)ccc2C1	ZINC000450930735	DC	On-Demand	Anodyne	HSP90AB1	38	42
COCCOC[C@H](O)CN1CCOc2cc(OC)ccc2C1	ZINC000450930736	DC	On-Demand	Anodyne	HSP90AB1	38	42
c1ccc([C@@H]2C[C@@H]3CC[C@H](C2)N3C[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450930746	CH	On-Demand	Anodyne	SLC18A3	26	47
c1ccc([C@@H]2C[C@@H]3CC[C@H](C2)N3C[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450930747	CH	On-Demand	Anodyne	SLC18A3	26	47
CC(=O)[C@H](NC(=O)CSc1nc2c(C)ccnc2[nH]1)C(C)C	ZINC000450930748	DE	On-Demand	Anodyne	ENPP1	60	39
CC(=O)[C@@H](NC(=O)CSc1nc2c(C)ccnc2[nH]1)C(C)C	ZINC000450930749	DE	On-Demand	Anodyne	ENPP1	60	39
CCC(=O)CCCN1C[C@@H](C)O[C@@H](C(=O)OC)C1	ZINC000450930762	CD	On-Demand	Anodyne	ZM.86993	0	44
COc1nc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)ncc1Br	ZINC000450930779	GD	On-Demand	Anodyne	SLC6A7	0	43
COc1cc(CSc2nc3c(C)ccnc3[nH]2)c([N+](=O)[O-])cc1OC(F)F	ZINC000450930781	GI	On-Demand	Bother	ENPP1	65	48
COCc1ccc([C@@H]2CCCN2C(=O)Cc2cc3ccccc3s2)o1	ZINC000450930782	FJ	On-Demand	Anodyne	CPT1A	106	38
COCc1ccc([C@H]2CCCN2C(=O)Cc2cc3ccccc3s2)o1	ZINC000450930783	FJ	On-Demand	Anodyne	CPT1A	106	38
C[C@H]1CN(c2ncccc2F)CCN1C(=O)c1cnn(C)c1	ZINC000450930784	DD	On-Demand	Anodyne	HCRTR1	40	35
C[C@H]1CN(c2ncccc2F)CCN1C(=O)c1cnn(C)c1	ZINC000450930784	DD	On-Demand	Anodyne	GRM1	0	59
C[C@H]1CN(c2ncccc2F)CCN1C(=O)c1cnn(C)c1	ZINC000450930784	DD	On-Demand	Anodyne	LIMK2	47	35
C[C@H]1CN(c2ncccc2F)CCN1C(=O)c1cnn(C)c1	ZINC000450930784	DD	On-Demand	Anodyne	SMO	32	47
C[C@H]1CN(c2ncccc2F)CCN1C(=O)c1cnn(C)c1	ZINC000450930784	DD	On-Demand	Anodyne	SLC6A7	0	52
CN(c1ncccn1)C1CCN(CC(F)(F)F)CC1	ZINC000450930794	CD	On-Demand	Anodyne	HPGDS	22	41
Cc1cc(-c2cccc(F)c2)nnc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450930795	GF	On-Demand	Anodyne	LIMK2	61	37
Cc1cc(-c2cccc(F)c2)nnc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450930795	GF	On-Demand	Anodyne	SMO	19	49
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450930798	EH	On-Demand	Anodyne	BDKRB1	17	40
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450930798	EH	On-Demand	Anodyne	L3MBTL3	72	39
C[C@H]1CN(c2ccnc3cc(F)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450930799	FE	On-Demand	Anodyne	HCRTR1	53	34
C[C@H]1CN(c2ccnc3cc(F)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450930799	FE	On-Demand	Anodyne	HCRTR2	36	41
C[C@H]1CN(c2ccnc3cc(F)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450930799	FE	On-Demand	Anodyne	SLC6A7	0	43
COC(=O)c1csc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)n1	ZINC000450930822	EH	On-Demand	Anodyne	SLC6A3	22	44
COC(=O)c1csc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)n1	ZINC000450930822	EH	On-Demand	Anodyne	SLC18A3	20	44
CCOc1cc(NC2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)ncn1	ZINC000450930824	GE	On-Demand	Anodyne	SSTR5	46	35
CCOc1cc(NC2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)ncn1	ZINC000450930824	GE	On-Demand	Anodyne	FASN	29	40
CCOc1cc(NC2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)ncn1	ZINC000450930824	GE	On-Demand	Anodyne	HPGDS	23	42
CCOc1cc(NC2CCN(C(=O)c3ccc(N4CCC4)nc3)CC2)ncn1	ZINC000450930824	GE	On-Demand	Anodyne	L3MBTL3	43	33
COCCOC[C@@H](O)CN1CCN(c2ccc(F)c(OC)c2)CC1	ZINC000450930827	EC	On-Demand	Anodyne	ABCB1	41	45
COCCOC[C@@H](O)CN1CCN(c2ccc(F)c(OC)c2)CC1	ZINC000450930827	EC	On-Demand	Anodyne	HSP90AB1	42	48
COCCOC[C@H](O)CN1CCN(c2ccc(F)c(OC)c2)CC1	ZINC000450930828	EC	On-Demand	Anodyne	ABCB1	41	45
COCCOC[C@H](O)CN1CCN(c2ccc(F)c(OC)c2)CC1	ZINC000450930828	EC	On-Demand	Anodyne	HSP90AB1	42	48
CC(C)Oc1ccccc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450930836	EI	On-Demand	Anodyne	CCR8	21	42
COC(=O)c1cccc(OCCN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450930845	FG	On-Demand	Anodyne	DRD4	46	36
COC(=O)c1cccc(OCCN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450930845	FG	On-Demand	Anodyne	PSMB2	40	35
COC(=O)c1cccc(OCCN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450930845	FG	On-Demand	Anodyne	ALPHA-1A	0	41
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCC[C@@H](C(N)=O)C1	ZINC000450930850	FE	On-Demand	Anodyne	RBP4	59	34
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCC[C@H](C(N)=O)C1	ZINC000450930851	FE	On-Demand	Anodyne	RBP4	59	34
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	ZINC000450930859	GE	On-Demand	Anodyne	PKM	40	48
COC(=O)c1coc(CN2CCN(c3cccc(Br)c3)CC2)n1	ZINC000450930872	GF	On-Demand	Anodyne	HTR1A	30	41
COC(=O)c1coc(CN2CCN(c3cccc(Br)c3)CC2)n1	ZINC000450930872	GF	On-Demand	Anodyne	DRD2	16	43
COC(=O)c1coc(CN2CCN(c3cccc(Br)c3)CC2)n1	ZINC000450930872	GF	On-Demand	Anodyne	DRD4	26	43
COC(=O)c1coc(CN2CCN(c3cccc(Br)c3)CC2)n1	ZINC000450930872	GF	On-Demand	Anodyne	HTR2A	23	40
COC(=O)c1coc(CN2CCN(c3cccc(Br)c3)CC2)n1	ZINC000450930872	GF	On-Demand	Anodyne	DRD3	28	43
COC(=O)c1coc(CN2CCN(c3cccc(Br)c3)CC2)n1	ZINC000450930872	GF	On-Demand	Anodyne	HTR7	17	40
COC(=O)[C@H](NC(=O)CSC1CC1)c1ccc(O)cc1	ZINC000450930877	CD	On-Demand	Anodyne	YARS	50	37
COC(=O)[C@@H](NC(=O)CSC1CC1)c1ccc(O)cc1	ZINC000450930878	CD	On-Demand	Anodyne	YARS	50	37
COc1ccc(N2CCN(c3nccc(-c4cnccn4)n3)CC2)nc1	ZINC000450930880	ED	On-Demand	Anodyne	SORD	49	38
CC(=O)[C@@](C)(O)CN1CCN(c2cccc(Br)c2)CC1	ZINC000450930881	ED	On-Demand	Anodyne	HTR1A	27	41
CC(=O)[C@](C)(O)CN1CCN(c2cccc(Br)c2)CC1	ZINC000450930882	ED	On-Demand	Anodyne	HTR1A	27	41
COC(=O)[C@H](NC(=O)C[C@H]1COc2ccccc2O1)c1ccc(O)cc1	ZINC000450930894	FD	On-Demand	Anodyne	ADRA2B	18	41
COC(=O)[C@@H](NC(=O)C[C@@H]1COc2ccccc2O1)c1ccc(O)cc1	ZINC000450930895	FD	On-Demand	Anodyne	ADRA2B	18	41
COC(=O)[C@@H](NC(=O)C[C@H]1COc2ccccc2O1)c1ccc(O)cc1	ZINC000450930896	FD	On-Demand	Anodyne	ADRA2B	18	41
COC(=O)[C@H](NC(=O)C[C@@H]1COc2ccccc2O1)c1ccc(O)cc1	ZINC000450930897	FD	On-Demand	Anodyne	ADRA2B	18	41
C[C@H](CN1CCN(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450930898	FE	On-Demand	Anodyne	HTR1A	22	43
C[C@H](CN1CCN(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450930898	FE	On-Demand	Anodyne	IGF1R	15	47
C[C@H](CN1CCN(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450930898	FE	On-Demand	Anodyne	HTR7	21	41
C[C@@H](CN1CCN(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450930899	FE	On-Demand	Anodyne	HTR1A	22	43
C[C@@H](CN1CCN(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450930899	FE	On-Demand	Anodyne	IGF1R	15	47
C[C@@H](CN1CCN(c2cccc(Br)c2)CC1)S(C)(=O)=O	ZINC000450930899	FE	On-Demand	Anodyne	HTR7	21	41
COc1ccc(N2CCN(c3cc(C#N)cc(C)n3)CC2)nc1	ZINC000450930905	DD	On-Demand	Mild	GPR119	18	40
COc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)cc1S(C)(=O)=O	ZINC000450930911	FD	On-Demand	Anodyne	DRD2	16	52
COc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)cc1S(C)(=O)=O	ZINC000450930911	FD	On-Demand	Anodyne	COLA	50	37
COc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)cc1S(C)(=O)=O	ZINC000450930911	FD	On-Demand	Anodyne	CPT1A	48	37
COc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)cc1S(C)(=O)=O	ZINC000450930912	FD	On-Demand	Anodyne	DRD2	16	52
COc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)cc1S(C)(=O)=O	ZINC000450930912	FD	On-Demand	Anodyne	COLA	50	37
COc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)cc1S(C)(=O)=O	ZINC000450930912	FD	On-Demand	Anodyne	CPT1A	48	37
COCC1(C#N)CCN(CCN(C)Cc2ccccc2)CC1	ZINC000450930919	DE	On-Demand	Mild	SIGMAR1	36	43
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCC[C@@H](C(F)(F)F)C1	ZINC000450930929	GI	On-Demand	Anodyne	RBP4	44	33
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000450930930	GI	On-Demand	Anodyne	RBP4	44	33
COc1ccc(N2CCN(c3nc(C(C)=O)c(C)s3)CC2)nc1	ZINC000450930931	EE	On-Demand	Anodyne	NPBWR1	42	38
COc1cccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)nccc12	ZINC000450930935	FE	On-Demand	Anodyne	SMO	33	46
COc1cccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)nccc12	ZINC000450930935	FE	On-Demand	Anodyne	SLC6A7	0	43
C[C@@H](O)CCSCc1ccc(C(F)(F)F)cc1	ZINC000450930941	CH	On-Demand	Anodyne	CACNA2D1	33	48
C[C@H](O)CCSCc1ccc(C(F)(F)F)cc1	ZINC000450930942	CH	On-Demand	Anodyne	CACNA2D1	33	48
Cc1c(Cl)cccc1N1CCCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450930945	FI	On-Demand	Anodyne	NOX1	41	29
Cc1c(Cl)cccc1N1CCCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450930945	FI	On-Demand	Anodyne	NOX5	42	29
COC(=O)c1cccc(CN2CCC(F)(c3cccnc3)CC2)c1Cl	ZINC000450930975	FH	On-Demand	Anodyne	CCR8	40	36
O=C(CCCN1CCOCC12CC2)c1ccc(Br)cc1	ZINC000450930989	EG	On-Demand	Anodyne	CYP2J2	46	33
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	DRD2	33	46
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	DRD1	20	54
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	DRD4	18	48
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	HTR2A	35	53
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	HTR2C	25	51
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	DRD3	15	54
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	ERG2	22	46
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	HTR7	25	46
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	SLC18A3	0	53
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccc(F)cc1)CC2	ZINC000450930991	GG	On-Demand	Anodyne	CYP2J2	51	36
Cc1ccc(CN(C)c2ccnc(N3CCOCC3)n2)cc1C	ZINC000450930999	DF	On-Demand	Anodyne	EPHB4	89	43
CC(=O)c1cccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)c1	ZINC000450931001	EH	On-Demand	Anodyne	HTR1A	33	55
CC(=O)c1cccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)c1	ZINC000450931001	EH	On-Demand	Anodyne	DRD2	23	53
CC(=O)c1cccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)c1	ZINC000450931001	EH	On-Demand	Anodyne	DRD1	0	42
CC(=O)c1cccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)c1	ZINC000450931001	EH	On-Demand	Anodyne	DRD4	48	41
CC(=O)c1cccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)c1	ZINC000450931001	EH	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)c1cccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)c1	ZINC000450931001	EH	On-Demand	Anodyne	CCR3	19	40
COc1ccc(-n2c(C)nnc2SC2CC(OC(C)(C)C)C2)cc1	ZINC000450931023	EI	On-Demand	Anodyne	AXIN2	0	43
CCS(=O)(=O)c1ccccc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450931030	GD	On-Demand	Anodyne	SLC6A7	0	41
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H](O)C1CCC1	ZINC000450931044	EG	On-Demand	Anodyne	PTPN2	0	40
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H](O)C1CCC1	ZINC000450931044	EG	On-Demand	Anodyne	ADAM17	25	43
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H](O)C1CCC1	ZINC000450931044	EG	On-Demand	Anodyne	CDC25B	25	42
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@@H](O)C1CCC1	ZINC000450931044	EG	On-Demand	Anodyne	GYS1	47	34
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@H](O)C1CCC1	ZINC000450931045	EG	On-Demand	Anodyne	PTPN2	0	40
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@H](O)C1CCC1	ZINC000450931045	EG	On-Demand	Anodyne	ADAM17	25	43
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@H](O)C1CCC1	ZINC000450931045	EG	On-Demand	Anodyne	CDC25B	25	42
O=C(NCc1ccc(OCc2ccccc2F)cc1)[C@H](O)C1CCC1	ZINC000450931045	EG	On-Demand	Anodyne	GYS1	47	34
COc1cc(CN2CC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931069	DD	On-Demand	Anodyne	DRD4	35	43
COc1cc(CN2CC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931069	DD	On-Demand	Anodyne	DRD3	23	43
COc1cc(CN2CC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931069	DD	On-Demand	Anodyne	HTR4	51	36
COc1cc(CN2CC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931069	DD	On-Demand	Anodyne	SSTR5	58	41
COc1cc(CN2CC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931069	DD	On-Demand	Anodyne	CCR1	27	41
COc1cc(CN2CC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931069	DD	On-Demand	Anodyne	CCR3	29	41
COc1cc(CN2CC[C@@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931069	DD	On-Demand	Anodyne	UTS2R	32	43
COc1cc(CN2CC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931070	DD	On-Demand	Anodyne	DRD4	35	43
COc1cc(CN2CC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931070	DD	On-Demand	Anodyne	DRD3	23	43
COc1cc(CN2CC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931070	DD	On-Demand	Anodyne	HTR4	51	36
COc1cc(CN2CC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931070	DD	On-Demand	Anodyne	SSTR5	58	41
COc1cc(CN2CC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931070	DD	On-Demand	Anodyne	CCR1	27	41
COc1cc(CN2CC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931070	DD	On-Demand	Anodyne	CCR3	29	41
COc1cc(CN2CC[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000450931070	DD	On-Demand	Anodyne	UTS2R	32	43
C(=C/c1ccccc1)\CCN1CCC[C@@H](c2ncc3n2CCCC3)C1	ZINC000450931073	EJ	On-Demand	Anodyne	SLC6A1	75	37
C(=C/c1ccccc1)\CCN1CCC[C@H](c2ncc3n2CCCC3)C1	ZINC000450931074	EJ	On-Demand	Anodyne	SLC6A1	75	37
C(=C\c1ccccc1)\CCN1CCC[C@@H](c2ncc3n2CCCC3)C1	ZINC000450931075	EJ	On-Demand	Anodyne	SLC6A1	75	37
C(=C\c1ccccc1)\CCN1CCC[C@H](c2ncc3n2CCCC3)C1	ZINC000450931076	EJ	On-Demand	Anodyne	SLC6A1	75	37
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2C[C@H]2C2CC2)n1	ZINC000450931077	CE	On-Demand	Bother	PRKCQ	45	36
CN(CCN1CCC[C@H](c2ncc3n2CCCC3)C1)Cc1ccccc1	ZINC000450931092	FH	On-Demand	Anodyne	SLC6A1	50	34
CN(CCN1CCC[C@@H](c2ncc3n2CCCC3)C1)Cc1ccccc1	ZINC000450931093	FH	On-Demand	Anodyne	SLC6A1	50	34
CCC(=O)c1ccc(NCc2ncccc2OC)c([N+](=O)[O-])c1	ZINC000450931099	DG	On-Demand	Bother	TAAR1	18	47
Cc1cnc(NC[C@@H]2C[C@H]2C2CC2)c([N+](=O)[O-])c1	ZINC000450931105	BF	On-Demand	Bother	PRKCQ	47	39
COC(=O)[C@@H](NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F)C(C)C	ZINC000450931128	GF	On-Demand	Anodyne	ELANE	50	35
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@H](C)c1ccc(F)cc1	ZINC000450931130	GI	On-Demand	Anodyne	ACACA	45	35
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@@H](C)c1ccc(F)cc1	ZINC000450931134	GI	On-Demand	Anodyne	ACACA	45	35
CC(C)N1CCC[C@H](NC(=O)c2ccc(-c3cnn(C)c3)o2)C1	ZINC000450931139	DE	On-Demand	Anodyne	MMP13	15	44
CC(C)N1CCC[C@@H](NC(=O)c2ccc(-c3cnn(C)c3)o2)C1	ZINC000450931141	DE	On-Demand	Anodyne	MMP13	15	44
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CCCN(C(C)C)C2)c1	ZINC000450931143	DF	On-Demand	Anodyne	SLC6A1	0	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CCCN(C(C)C)C2)c1	ZINC000450931143	DF	On-Demand	Anodyne	GPR88	0	41
CC(=O)NCCN(Cc1ccc(Cl)cc1Cl)CC1CCC(=O)CC1	ZINC000450931144	FH	On-Demand	Anodyne	P2RX7	34	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CCCN(C(C)C)C2)c1	ZINC000450931146	DF	On-Demand	Anodyne	SLC6A1	0	41
COc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CCCN(C(C)C)C2)c1	ZINC000450931146	DF	On-Demand	Anodyne	GPR88	0	41
FC1(c2ccccn2)CCN(CCCO[C@H]2CCCCO2)CC1	ZINC000450931149	DG	On-Demand	Anodyne	MEN1	45	37
COCCOC[C@H](O)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450931150	ED	On-Demand	Anodyne	ABCB1	41	37
COCCOC[C@H](O)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450931150	ED	On-Demand	Anodyne	CTSS	0	43
COCCOC[C@H](O)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450931150	ED	On-Demand	Anodyne	HSP90AB1	42	44
FC1(c2ccccn2)CCN(CCCO[C@@H]2CCCCO2)CC1	ZINC000450931151	DG	On-Demand	Anodyne	MEN1	45	37
COC[C@H]1CCCCN1c1ccc([N+](=O)[O-])c(C)c1	ZINC000450931163	CF	On-Demand	Bother	CASP3	41	37
COC[C@H]1CCCCN1c1ccc([N+](=O)[O-])c(C)c1	ZINC000450931163	CF	On-Demand	Bother	CASP7	47	37
COC[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c(C)c1	ZINC000450931164	CF	On-Demand	Bother	CASP3	41	37
COC[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c(C)c1	ZINC000450931164	CF	On-Demand	Bother	CASP7	47	37
COC(=O)C1(CN2CCC[C@@](CO)(c3ccccc3)C2)CC1	ZINC000450931166	DD	On-Demand	Anodyne	SLC12A5	57	36
COC(=O)C1(CN2CCC[C@](CO)(c3ccccc3)C2)CC1	ZINC000450931167	DD	On-Demand	Anodyne	SLC12A5	57	36
O=C1CCC(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)CC1	ZINC000450931174	DE	On-Demand	Anodyne	CHRM4	15	43
O=C1CCC(CN2CCC[C@H](CNC(=O)c3ccco3)C2)CC1	ZINC000450931175	DE	On-Demand	Anodyne	CHRM4	15	43
COCc1cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)nc(C(C)(C)C)n1	ZINC000450931194	GG	On-Demand	Anodyne	SLC6A1	23	42
COCC1(C#N)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450931195	GD	On-Demand	Mild	DRD4	42	32
COCC1(C#N)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450931195	GD	On-Demand	Mild	HTR7	25	41
COCC1(C#N)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450931195	GD	On-Demand	Mild	MTNR1A	32	41
COCC1(C#N)CCN(CCC(=O)NCc2ccc(OC)cc2OC)CC1	ZINC000450931195	GD	On-Demand	Mild	MTNR1B	26	41
COCc1cc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)nc(C(C)(C)C)n1	ZINC000450931196	GG	On-Demand	Anodyne	SLC6A1	23	42
COCc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)nc(C(C)(C)C)n1	ZINC000450931197	GG	On-Demand	Anodyne	SLC6A1	23	42
COC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1Cl	ZINC000450931205	EI	On-Demand	Anodyne	ACHE	32	41
COC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1Cl	ZINC000450931205	EI	On-Demand	Anodyne	SIGMAR1	28	42
COC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1Cl	ZINC000450931205	EI	On-Demand	Anodyne	CCR3	34	46
COC(=O)c1cccc(CN2CCC(CC(F)(F)F)CC2)c1Cl	ZINC000450931205	EI	On-Demand	Anodyne	CACNA1I	55	39
FC1(c2ccccn2)CCN(CCc2ccc3c(c2)OCCO3)CC1	ZINC000450931209	EG	On-Demand	Anodyne	PRCP	0	41
CCN(Cc1ccccc1)C(=O)[C@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450931232	FH	On-Demand	Anodyne	HRAS	48	33
COCC1(C#N)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450931233	CG	On-Demand	Mild	SIGMAR1	21	44
CCN(Cc1ccccc1)C(=O)[C@@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450931235	FH	On-Demand	Anodyne	HRAS	48	33
COCC[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450931241	FI	On-Demand	Anodyne	COLA	101	38
COCC[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450931241	FI	On-Demand	Anodyne	CPT1A	95	38
COCC[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450931241	FI	On-Demand	Anodyne	CPT2	41	35
COCC[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450931243	FI	On-Demand	Anodyne	COLA	101	38
COCC[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450931243	FI	On-Demand	Anodyne	CPT1A	95	38
COCC[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450931243	FI	On-Demand	Anodyne	CPT2	41	35
Cc1ccc(F)c(CS(=O)(=O)c2ccc3c(c2)OCCO3)c1	ZINC000450931273	DF	On-Demand	Anodyne	PKM	36	43
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2C)C[C@@H]1c1ccccc1	ZINC000450931302	EF	On-Demand	Bother	CACNA1D	66	36
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2C)C[C@H]1c1ccccc1	ZINC000450931307	EF	On-Demand	Bother	CACNA1D	66	36
FC(F)(F)COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cn1	ZINC000450931318	FH	On-Demand	Anodyne	PRCP	0	41
CCS(=O)(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931319	FG	On-Demand	Anodyne	ADAM17	21	43
CCS(=O)(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931319	FG	On-Demand	Anodyne	MCHR2	48	33
Nc1ncccc1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450931321	DD	On-Demand	Anodyne	CCR3	17	40
Nc1ncccc1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450931322	DD	On-Demand	Anodyne	CCR3	17	40
Cc1ccc2nc(CN3CCC(F)(c4ccccn4)CC3)cc(=O)n2c1	ZINC000450931338	FF	On-Demand	Anodyne	PKM	16	52
C[C@H](C(=O)Nc1ccc(F)cc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450931339	GI	On-Demand	Anodyne	GRM4	24	44
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)NCCO)nn1	ZINC000450931343	CB	On-Demand	Anodyne	SCD1	22	40
CCO[C@@H]1CCCC[C@H]1Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450931356	FG	On-Demand	Anodyne	EPHX2	16	40
CCO[C@@H]1CCCC[C@H]1Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450931356	FG	On-Demand	Anodyne	TGM2	35	40
C[C@@H](C(=O)Nc1ccc(F)cc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450931361	GI	On-Demand	Anodyne	GRM4	24	44
C[C@H]1CN(c2cncc(Br)c2)CCN1C(=O)c1cnn(C)c1	ZINC000450931364	FD	On-Demand	Anodyne	SLC6A7	0	41
CCO[C@@H]1CCC[C@H]1Nc1ncnc2cc(Cl)ccc12	ZINC000450931382	CH	On-Demand	Anodyne	HNMT	43	30
Cc1ccnc2[nH]c(SCC(=O)NCCCO[C@@H](C)c3ccccc3)nc12	ZINC000450931400	GH	On-Demand	Anodyne	ENPP1	72	50
Cc1cc(CN2CCC(F)(c3ccccn3)CC2)c2ccccc2n1	ZINC000450931402	EI	On-Demand	Anodyne	ADAM17	73	41
Cc1ccnc2[nH]c(SCC(=O)NCCCO[C@H](C)c3ccccc3)nc12	ZINC000450931403	GH	On-Demand	Anodyne	ENPP1	72	50
O=C(c1ccc(N2CCC2)nc1)N1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450931410	GH	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc(N2CCC2)nc1)N1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450931410	GH	On-Demand	Anodyne	L3MBTL3	45	40
O=C(c1ccc(N2CCC2)nc1)N1CCN(c2c(Cl)cccc2Cl)CC1	ZINC000450931410	GH	On-Demand	Anodyne	SLC6A7	0	46
COc1ccc(N2CCN(c3nccc(Oc4ccccc4)n3)CC2)nc1	ZINC000450931414	FF	On-Demand	Anodyne	SLC6A7	0	40
COc1cc(OC)c2ncnc(N(C)C3CCN(CC(F)(F)F)CC3)c2c1	ZINC000450931417	GG	On-Demand	Anodyne	PDE3A	40	34
COc1cc(OC)c2ncnc(N(C)C3CCN(CC(F)(F)F)CC3)c2c1	ZINC000450931417	GG	On-Demand	Anodyne	PDE3B	55	33
COc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)ncn1	ZINC000450931422	DC	On-Demand	Anodyne	SLC6A7	0	41
CCOC(=O)c1ccc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)nc1	ZINC000450931435	GE	On-Demand	Anodyne	P2RY12	26	41
CCOC(=O)c1ccc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)nc1	ZINC000450931435	GE	On-Demand	Anodyne	MLNR	22	41
Cc1ccnc2[nH]c(SCC(=O)NCc3ccc(COC(C)C)cc3)nc12	ZINC000450931450	GH	On-Demand	Anodyne	ENPP1	76	53
C[C@H]1CN(c2ncnc3c(F)cccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450931451	FD	On-Demand	Anodyne	LIMK2	74	38
C[C@H]1CN(c2ncnc3c(F)cccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450931451	FD	On-Demand	Anodyne	SMO	31	45
C[C@H]1CN(c2ncnc3c(F)cccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450931451	FD	On-Demand	Anodyne	SLC6A7	0	43
CCCOc1cccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450931456	FG	On-Demand	Anodyne	ENPP1	65	53
CCCOc1cccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450931456	FG	On-Demand	Anodyne	PDS	42	33
CN(C)C(=O)CSc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1	ZINC000450931457	GC	On-Demand	Bother	MGLL	0	44
COC(=O)c1csc(CN2CCc3ccc(Br)cc3C2)n1	ZINC000450931458	FG	On-Demand	Anodyne	ABCB1	0	45
COC(=O)c1csc(CN2CCc3ccc(Br)cc3C2)n1	ZINC000450931458	FG	On-Demand	Anodyne	NOD2	41	38
COc1ccc(-n2c(C)nnc2SCc2ccn(CC(F)(F)F)n2)cc1	ZINC000450931459	GH	On-Demand	Anodyne	WNT3A	24	48
COc1ccc(-n2c(C)nnc2SCc2ccn(CC(F)(F)F)n2)cc1	ZINC000450931459	GH	On-Demand	Anodyne	TNKS2	18	51
COc1ccc(-n2c(C)nnc2SCc2ccn(CC(F)(F)F)n2)cc1	ZINC000450931459	GH	On-Demand	Anodyne	AXIN2	0	53
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@@](F)(CO)C1	ZINC000450931463	DH	On-Demand	Anodyne	OPRL1	17	43
C[C@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@](F)(CO)C1	ZINC000450931464	DH	On-Demand	Anodyne	OPRL1	17	43
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@](F)(CO)C1	ZINC000450931465	DH	On-Demand	Anodyne	OPRL1	17	43
C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CC[C@@](F)(CO)C1	ZINC000450931466	DH	On-Demand	Anodyne	OPRL1	17	43
CC(C)(C)C(=O)N1CCC(COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450931467	FJ	On-Demand	Anodyne	CACNA1B	41	33
CC(C)(C)C(=O)N1CCC(COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450931467	FJ	On-Demand	Anodyne	LIPC	0	40
CC(C)(C)C(=O)N1CCC(COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450931467	FJ	On-Demand	Anodyne	SLC6A9	16	47
CC(C)(C)C(=O)N1CCC(COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450931467	FJ	On-Demand	Anodyne	LIPG	55	41
Cc1c(Cl)cccc1N1CCCN(CC[C@@H](C)O)CC1	ZINC000450931468	CF	On-Demand	Anodyne	HTR1A	43	43
Cc1c(Cl)cccc1N1CCCN(CC[C@@H](C)O)CC1	ZINC000450931468	CF	On-Demand	Anodyne	DRD2	48	48
Cc1c(Cl)cccc1N1CCCN(CC[C@@H](C)O)CC1	ZINC000450931468	CF	On-Demand	Anodyne	HTR2A	46	47
Cc1c(Cl)cccc1N1CCCN(CC[C@@H](C)O)CC1	ZINC000450931468	CF	On-Demand	Anodyne	HTR2C	39	43
Cc1c(Cl)cccc1N1CCCN(CC[C@@H](C)O)CC1	ZINC000450931468	CF	On-Demand	Anodyne	SLC6A4	26	45
Cc1c(Cl)cccc1N1CCCN(CC[C@@H](C)O)CC1	ZINC000450931468	CF	On-Demand	Anodyne	ADRA1B	22	43
Cc1c(Cl)cccc1N1CCCN(CC[C@H](C)O)CC1	ZINC000450931469	CF	On-Demand	Anodyne	HTR1A	43	43
Cc1c(Cl)cccc1N1CCCN(CC[C@H](C)O)CC1	ZINC000450931469	CF	On-Demand	Anodyne	DRD2	48	48
Cc1c(Cl)cccc1N1CCCN(CC[C@H](C)O)CC1	ZINC000450931469	CF	On-Demand	Anodyne	HTR2A	46	47
Cc1c(Cl)cccc1N1CCCN(CC[C@H](C)O)CC1	ZINC000450931469	CF	On-Demand	Anodyne	HTR2C	39	43
Cc1c(Cl)cccc1N1CCCN(CC[C@H](C)O)CC1	ZINC000450931469	CF	On-Demand	Anodyne	SLC6A4	26	45
Cc1c(Cl)cccc1N1CCCN(CC[C@H](C)O)CC1	ZINC000450931469	CF	On-Demand	Anodyne	ADRA1B	22	43
Cc1cc(SCC(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000450931471	CE	On-Demand	Bother	GSTM2	56	39
C[C@@H](c1ccccc1)[C@@H](O)CN(C)[C@@H](C)CO	ZINC000450931472	BD	On-Demand	Anodyne	AOC3	24	42
C[C@@H](c1ccccc1)[C@H](O)CN(C)[C@@H](C)CO	ZINC000450931473	BD	On-Demand	Anodyne	AOC3	24	42
CCC(=O)c1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450931477	CE	On-Demand	Bother	GSTM2	56	38
CCc1c(C)nc2ccccc2c1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450931497	GG	On-Demand	Anodyne	CCKAR	52	32
CCc1c(C)nc2ccccc2c1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450931497	GG	On-Demand	Anodyne	SMO	21	45
CCN(CC)S(=O)(=O)c1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450931503	GD	On-Demand	Bother	BDKRB1	0	43
CCN(CC)S(=O)(=O)c1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450931503	GD	On-Demand	Bother	COLA	55	33
CCc1cc(CCCN2CCc3ccc(Br)cc3C2)on1	ZINC000450931507	EH	On-Demand	Anodyne	CHRNA6	0	40
CN(CCN1CCOCC12CC2)Cc1ccccc1	ZINC000450931512	CD	On-Demand	Anodyne	SIGMAR1	20	41
CN(CCN1CCCN(S(=O)(=O)C2CC2)CC1)Cc1ccccc1	ZINC000450931513	FD	On-Demand	Anodyne	SIGMAR1	48	52
CC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450931520	EH	On-Demand	Anodyne	HTR1A	21	47
CC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450931520	EH	On-Demand	Anodyne	DRD2	19	47
CC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450931520	EH	On-Demand	Anodyne	DRD1	0	47
CC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450931520	EH	On-Demand	Anodyne	DRD4	55	47
CC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450931520	EH	On-Demand	Anodyne	DRD3	15	47
CC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450931520	EH	On-Demand	Anodyne	SIGMAR1	17	42
CC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450931520	EH	On-Demand	Anodyne	ABCC1	45	33
CC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450931520	EH	On-Demand	Anodyne	LSS	15	40
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1c(F)cccc1F	ZINC000450931535	EG	On-Demand	Anodyne	DRD4	0	44
CCOCC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450931540	DF	On-Demand	Anodyne	PLA2G4B	42	32
COC(=O)c1ccc(C)c(NC(=O)C[C@@H]2COc3ccccc3O2)c1O	ZINC000450931545	FF	On-Demand	Anodyne	ADRA2B	17	40
COC(=O)c1ccc(C)c(NC(=O)C[C@H]2COc3ccccc3O2)c1O	ZINC000450931546	FF	On-Demand	Anodyne	ADRA2B	17	40
COc1ccc(N2CCN(c3ncnc4ccc(SC)cc34)CC2)nc1	ZINC000450931547	FG	On-Demand	Anodyne	PDE3A	50	40
COc1ccc(N2CCN(c3ncnc4ccc(SC)cc34)CC2)nc1	ZINC000450931547	FG	On-Demand	Anodyne	PDGFRB	74	46
COc1ccc(N2CCN(c3ncnc4ccc(SC)cc34)CC2)nc1	ZINC000450931547	FG	On-Demand	Anodyne	PDE3B	74	40
COc1ccc(N2CCN(c3ncnc4ccc(SC)cc34)CC2)nc1	ZINC000450931547	FG	On-Demand	Anodyne	HTT	0	46
Brc1cccc(N2CCN(Cc3cn(CC4CC4)nn3)CC2)c1	ZINC000450931548	GF	On-Demand	Anodyne	DRD4	21	48
COCC1(C#N)CCN(Cc2cccc(C(=O)OC)c2Cl)CC1	ZINC000450931549	EF	On-Demand	Mild	NPFFR1	48	41
CC(C)N1CCC[C@@H](NC(=O)c2c(Cl)c3ccccc3n2C)C1	ZINC000450931553	EG	On-Demand	Anodyne	HTR3B	0	40
CC(C)N1CCC[C@H](NC(=O)c2c(Cl)c3ccccc3n2C)C1	ZINC000450931554	EG	On-Demand	Anodyne	HTR3B	0	40
C[C@H]1CCCN1C(=O)CCN1CCC(F)(c2ccccn2)CC1	ZINC000450931555	DF	On-Demand	Anodyne	PRCP	42	36
C[C@H]1CCCN1C(=O)CCN1CCC(F)(c2ccccn2)CC1	ZINC000450931555	DF	On-Demand	Anodyne	PREP	42	37
C[C@@H]1CCCN1C(=O)CCN1CCC(F)(c2ccccn2)CC1	ZINC000450931556	DF	On-Demand	Anodyne	PRCP	42	36
C[C@@H]1CCCN1C(=O)CCN1CCC(F)(c2ccccn2)CC1	ZINC000450931556	DF	On-Demand	Anodyne	PREP	42	37
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCN(C(C)C)C1	ZINC000450931558	EF	On-Demand	Anodyne	BIRC2	42	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCN(C(C)C)C1	ZINC000450931559	EF	On-Demand	Anodyne	BIRC2	42	36
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	DRD2	15	45
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	DRD4	39	41
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	ACHE	49	43
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	HRH1	20	41
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	KCNH2	15	44
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	HTR4	69	43
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	SIGMAR1	41	47
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	SSTR5	58	37
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	CCR3	61	42
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	CCR2	18	42
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	MCHR1	48	45
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	CACNA1G	42	38
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	CACNA1I	75	44
COC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1Cl	ZINC000450931563	EI	On-Demand	Anodyne	ARG2	15	41
COCCOCCOc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931569	GH	On-Demand	Anodyne	HRH3	17	44
COCCOCCOc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931569	GH	On-Demand	Anodyne	SIGMAR1	36	44
COCCOCCOc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931569	GH	On-Demand	Anodyne	PRCP	0	41
COCCOCCOc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931569	GH	On-Demand	Anodyne	ADAM17	19	41
COCCOCCOc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931569	GH	On-Demand	Anodyne	SLC18A3	0	44
FC(F)(F)COc1ccccc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450931574	FI	On-Demand	Anodyne	CCR8	19	42
CCCCCc1nnc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)s1	ZINC000450931575	GH	On-Demand	Anodyne	GLS	0	43
CC(C)OC(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931577	FI	On-Demand	Anodyne	ADAM17	15	40
CC(C)OC(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931577	FI	On-Demand	Anodyne	MCHR2	40	33
CC(C)OC(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450931577	FI	On-Demand	Anodyne	NOD2	41	35
CC(C)N1CCC[C@H](NC(=O)CCc2ccc(C(N)=O)cc2)C1	ZINC000450931582	DD	On-Demand	Anodyne	BIRC2	46	38
CC(C)N1CCC[C@@H](NC(=O)CCc2ccc(C(N)=O)cc2)C1	ZINC000450931583	DD	On-Demand	Anodyne	BIRC2	46	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	MME	62	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	ANPEP	60	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	FCER2	45	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	CYSP_TRYCR	43	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	CAPNS1	49	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	CAPN1	53	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	CAPN2	60	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	ACE2	44	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931584	EE	On-Demand	Anodyne	POL	0	42
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	MME	62	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	ANPEP	60	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	FCER2	45	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	CYSP_TRYCR	43	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	CAPNS1	49	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	CAPN1	53	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	CAPN2	60	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	ACE2	44	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931585	EE	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	MME	62	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	ANPEP	60	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	FCER2	45	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	CYSP_TRYCR	43	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	CAPNS1	49	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	CAPN1	53	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	CAPN2	60	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	ACE2	44	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931586	EE	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	MME	62	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	ANPEP	60	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	FCER2	45	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	CYSP_TRYCR	43	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	CAPNS1	49	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	CAPN1	53	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	CAPN2	60	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	ACE2	44	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccsc1	ZINC000450931587	EE	On-Demand	Anodyne	POL	0	42
CCCOc1cccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450931588	GG	On-Demand	Anodyne	HRH2	30	41
CCCOc1cccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450931588	GG	On-Demand	Anodyne	PDS	54	34
FC1(c2ccccn2)CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450931597	EI	On-Demand	Anodyne	CCR8	18	40
COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)OCc2ccc(F)cc2)c1O	ZINC000450931604	FG	On-Demand	Anodyne	LEF	40	32
COC(=O)c1ccc(C)c(NC(=O)[C@H](C)OCc2ccc(F)cc2)c1O	ZINC000450931605	FG	On-Demand	Anodyne	LEF	40	32
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1ccc(O)cc1	ZINC000450931606	GE	On-Demand	Anodyne	PDE4D	15	41
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1ccc(O)cc1	ZINC000450931606	GE	On-Demand	Anodyne	PDEC	0	40
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1ccc(O)cc1	ZINC000450931607	GE	On-Demand	Anodyne	PDE4D	15	41
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1ccc(O)cc1	ZINC000450931607	GE	On-Demand	Anodyne	PDEC	0	40
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1ccc(O)cc1	ZINC000450931608	GE	On-Demand	Anodyne	PDE4D	15	41
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1ccc(O)cc1	ZINC000450931608	GE	On-Demand	Anodyne	PDEC	0	40
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1ccc(O)cc1	ZINC000450931609	GE	On-Demand	Anodyne	PDE4D	15	41
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1ccc(O)cc1	ZINC000450931609	GE	On-Demand	Anodyne	PDEC	0	40
CCOc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1[N+](=O)[O-]	ZINC000450931610	FH	On-Demand	Bother	SSTR5	62	39
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000450931612	GH	On-Demand	Anodyne	TRPV1	17	44
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000450931612	GH	On-Demand	Anodyne	IMDH_CRYPV	17	41
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000450931612	GH	On-Demand	Anodyne	KCNK3	30	41
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000450931612	GH	On-Demand	Anodyne	KCNK9	31	41
COCC1(C#N)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450931615	GH	On-Demand	Mild	DRD2	29	42
COCC1(C#N)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450931615	GH	On-Demand	Mild	DRD1	15	41
COCC1(C#N)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450931615	GH	On-Demand	Mild	DRD4	0	42
COCC1(C#N)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450931615	GH	On-Demand	Mild	ERG2	19	42
COCC1(C#N)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450931615	GH	On-Demand	Mild	SLC18A3	24	43
COCC1(C#N)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450931615	GH	On-Demand	Mild	CYP2J2	52	37
COCC1(C#N)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450931615	GH	On-Demand	Mild	AP2S1	0	42
COCC[C@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450931619	EI	On-Demand	Anodyne	OPRL1	15	46
COCC[C@@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450931620	EI	On-Demand	Anodyne	OPRL1	15	46
CC[C@H](NC(=O)c1ccc(C)c(C(=O)N[C@H](CC)c2ncc[nH]2)c1)c1ncc[nH]1	ZINC000450931629	GG	On-Demand	Anodyne	UTS2	54	33
CC[C@@H](NC(=O)c1ccc(C)c(C(=O)N[C@H](CC)c2ncc[nH]2)c1)c1ncc[nH]1	ZINC000450931630	GG	On-Demand	Anodyne	UTS2	54	33
CC[C@H](NC(=O)c1ccc(C)c(C(=O)N[C@@H](CC)c2ncc[nH]2)c1)c1ncc[nH]1	ZINC000450931631	GG	On-Demand	Anodyne	UTS2	54	33
CC[C@H](NC(=O)c1cc(C(=O)N[C@H](CC)c2ncc[nH]2)ccc1C)c1ncc[nH]1	ZINC000450931632	GG	On-Demand	Anodyne	UTS2	54	33
CCO[C@@H]1CCC[C@H]1Nc1ncnc2[nH]cnc12	ZINC000450931637	BD	On-Demand	Anodyne	AHK3	0	40
COC(=O)[C@H]1CN(c2nc(C)ccc2C#N)C[C@H]1c1ccccc1	ZINC000450931640	DF	On-Demand	Mild	SLC6A1	62	40
COC(=O)[C@H]1CN(c2nc(C)ccc2C#N)C[C@@H]1c1ccccc1	ZINC000450931641	DF	On-Demand	Mild	SLC6A1	62	40
COC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931642	GG	On-Demand	Anodyne	DRD2	24	45
COC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931642	GG	On-Demand	Anodyne	DRD4	18	45
COC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931642	GG	On-Demand	Anodyne	DRD3	23	45
COC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931642	GG	On-Demand	Anodyne	HTR4	45	40
COC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931642	GG	On-Demand	Anodyne	CCR3	27	42
COC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931642	GG	On-Demand	Anodyne	CACNA1I	50	35
COC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931643	GG	On-Demand	Anodyne	DRD2	24	45
COC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931643	GG	On-Demand	Anodyne	DRD4	18	45
COC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931643	GG	On-Demand	Anodyne	DRD3	23	45
COC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931643	GG	On-Demand	Anodyne	HTR4	45	40
COC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931643	GG	On-Demand	Anodyne	CCR3	27	42
COC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1Cl	ZINC000450931643	GG	On-Demand	Anodyne	CACNA1I	50	35
CCC(=O)CCCN(C)CCc1cccc([N+](=O)[O-])c1	ZINC000450931644	CF	On-Demand	Bother	CACNA1C	50	38
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450931648	EG	On-Demand	Anodyne	DRD4	24	44
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450931648	EG	On-Demand	Anodyne	DRD3	0	44
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450931648	EG	On-Demand	Anodyne	CCR3	47	42
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450931648	EG	On-Demand	Anodyne	CACNA1I	58	37
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450931649	EG	On-Demand	Anodyne	DRD4	24	44
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450931649	EG	On-Demand	Anodyne	DRD3	0	44
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450931649	EG	On-Demand	Anodyne	CCR3	47	42
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450931649	EG	On-Demand	Anodyne	CACNA1I	58	37
COC(=O)[C@H]1CN(c2ncnc3c2cnn3C)C[C@@H]1c1ccccc1	ZINC000450931688	ED	On-Demand	Anodyne	SLC6A1	41	44
COC(=O)[C@H]1CN(c2ncnc3c2cnn3C)C[C@H]1c1ccccc1	ZINC000450931689	ED	On-Demand	Anodyne	SLC6A1	41	44
COC(=O)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccccc1	ZINC000450931690	FE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccccc1	ZINC000450931690	FE	On-Demand	Anodyne	P2RY12	30	46
COC(=O)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccccc1	ZINC000450931690	FE	On-Demand	Anodyne	CXCR3	30	43
COC(=O)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1c1ccccc1	ZINC000450931691	FE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1c1ccccc1	ZINC000450931691	FE	On-Demand	Anodyne	P2RY12	30	46
COC(=O)[C@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1c1ccccc1	ZINC000450931691	FE	On-Demand	Anodyne	CXCR3	30	43
COC(=O)[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccccc1	ZINC000450931692	FE	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccccc1	ZINC000450931692	FE	On-Demand	Anodyne	P2RY12	30	46
COC(=O)[C@@H]1CN(c2ncc(C(N)=O)cc2Cl)C[C@H]1c1ccccc1	ZINC000450931692	FE	On-Demand	Anodyne	CXCR3	30	43
COC(=O)[C@H]1CN(c2nnc(-c3ccccn3)s2)C[C@@H]1c1ccccc1	ZINC000450931693	FF	On-Demand	Anodyne	SLC6A1	0	40
COC(=O)[C@H]1CN(c2nnc(-c3ccccn3)s2)C[C@H]1c1ccccc1	ZINC000450931694	FF	On-Demand	Anodyne	SLC6A1	0	40
CCO[C@@H]1CCC[C@H]1Nc1nc2ccccc2[nH]1	ZINC000450931717	BF	On-Demand	Anodyne	KCNN3	50	47
CCOC(=O)[C@H](Sc1nc2c(C)ccnc2[nH]1)C(C)C	ZINC000450931738	CF	On-Demand	Anodyne	ENPP1	23	45
CCOC(=O)[C@@H](Sc1nc2c(C)ccnc2[nH]1)C(C)C	ZINC000450931739	CF	On-Demand	Anodyne	ENPP1	23	45
Cc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2cc(F)ccc2n1	ZINC000450931741	FF	On-Demand	Anodyne	HCRTR1	53	33
Cc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2cc(F)ccc2n1	ZINC000450931741	FF	On-Demand	Anodyne	HCRTR2	33	41
COC[C@H]1CCCCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1	ZINC000450931753	DG	On-Demand	Bother	CASP7	42	34
COC[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1	ZINC000450931754	DG	On-Demand	Bother	CASP7	42	34
Cc1ccc(CN(C)c2cnn(C)c(=O)c2Cl)cc1C	ZINC000450931765	CF	On-Demand	Anodyne	NPBWR1	15	41
COC(=O)C1(CSc2nnc(C)n2-c2ccc(OC)cc2)CCCC1	ZINC000450931773	FG	On-Demand	Anodyne	WNT3A	22	44
COC(=O)C1(CSc2nnc(C)n2-c2ccc(OC)cc2)CCCC1	ZINC000450931773	FG	On-Demand	Anodyne	TNKS2	16	45
COC(=O)C1(CSc2nnc(C)n2-c2ccc(OC)cc2)CCCC1	ZINC000450931773	FG	On-Demand	Anodyne	AXIN2	0	48
C[C@H]1CN(c2ccc3ccc(Cl)cc3n2)CCN1C(=O)c1cnn(C)c1	ZINC000450931775	FF	On-Demand	Anodyne	SLC6A7	0	48
COc1ccccc1NC(=O)[C@@H](Sc1nc2c(C)ccnc2[nH]1)C(C)C	ZINC000450931784	FI	On-Demand	Anodyne	ENPP1	44	48
CCOc1cccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450931788	FE	On-Demand	Bother	CCKAR	51	32
C[C@H]1CN(c2nc3ccc(F)cc3n2C)CCN1C(=O)c1cnn(C)c1	ZINC000450931789	FD	On-Demand	Anodyne	HCRTR2	26	41
COc1ccccc1NC(=O)[C@H](Sc1nc2c(C)ccnc2[nH]1)C(C)C	ZINC000450931792	FI	On-Demand	Anodyne	ENPP1	44	48
CCOC(=O)c1ccc(CN2CC[C@@H]3OCCN(C)[C@@H]3C2)nc1	ZINC000450931794	DD	On-Demand	Anodyne	SSTR5	41	34
CCOC(=O)c1ccc(CN2CC[C@@H]3OCCN(C)[C@H]3C2)nc1	ZINC000450931798	DD	On-Demand	Anodyne	SSTR5	41	34
CCOC(=O)c1ccc(CN2CC[C@H]3OCCN(C)[C@@H]3C2)nc1	ZINC000450931800	DD	On-Demand	Anodyne	SSTR5	41	34
CCOC(=O)c1ccc(CN2CC[C@H]3OCCN(C)[C@H]3C2)nc1	ZINC000450931802	DD	On-Demand	Anodyne	SSTR5	41	34
CCOC(=O)c1cccc(SCCc2cscn2)c1	ZINC000450931806	CH	On-Demand	Anodyne	BMP1	45	34
CCC[C@H](O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450931814	CH	On-Demand	Anodyne	SLC18A3	43	66
CCC[C@@H](O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450931815	CH	On-Demand	Anodyne	SLC18A3	43	66
C[C@@H](O)CCOc1ccc(C(F)(F)F)cc1F	ZINC000450931825	CF	On-Demand	Anodyne	PPARD	22	40
C[C@H](O)CCOc1ccc(C(F)(F)F)cc1F	ZINC000450931829	CF	On-Demand	Anodyne	PPARD	22	40
O=C(CCCN1CCOCC12CC2)c1ccccc1	ZINC000450931838	CF	On-Demand	Anodyne	DRD2	28	43
O=C(CCCN1CCOCC12CC2)c1ccccc1	ZINC000450931838	CF	On-Demand	Anodyne	CYP2J2	54	38
COc1ccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc2c1F	ZINC000450931839	GD	On-Demand	Anodyne	PDE3B	52	34
COc1ccc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc2c1F	ZINC000450931839	GD	On-Demand	Anodyne	LIMK2	50	38
CS(=O)(=O)c1ccc2c(c1)CCN(CC1=CCCCC1)CC2	ZINC000450931849	DF	On-Demand	Anodyne	MLNR	0	40
CN(CCN1CC[C@@](F)(CO)C1)Cc1ccccc1	ZINC000450931860	CD	On-Demand	Anodyne	SIGMAR1	38	44
CN(CCN1CC[C@](F)(CO)C1)Cc1ccccc1	ZINC000450931863	CD	On-Demand	Anodyne	SIGMAR1	38	44
Cc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)ccn1	ZINC000450931867	CD	On-Demand	Anodyne	SLC6A7	0	46
CN(CCN1CCC(F)(c2cccnc2)CC1)Cc1ccccc1	ZINC000450931870	EG	On-Demand	Anodyne	SIGMAR1	28	42
CN(CCN1CCC(F)(c2cccnc2)CC1)Cc1ccccc1	ZINC000450931870	EG	On-Demand	Anodyne	TACR3	54	35
COC(=O)c1csc(CN2CCN(c3ccc(F)c(OC)c3)CC2)n1	ZINC000450931879	FE	On-Demand	Anodyne	DRD2	16	40
COC(=O)c1csc(CN2CCN(c3ccc(F)c(OC)c3)CC2)n1	ZINC000450931879	FE	On-Demand	Anodyne	DRD1	20	40
COC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450931881	FF	On-Demand	Anodyne	CCR3	46	42
COC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450931881	FF	On-Demand	Anodyne	EPHX2	24	59
COC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450931881	FF	On-Demand	Anodyne	MCHR1	25	43
COC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450931881	FF	On-Demand	Anodyne	PRMT3	34	43
COC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450931883	FF	On-Demand	Anodyne	CCR3	46	42
COC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450931883	FF	On-Demand	Anodyne	EPHX2	24	59
COC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450931883	FF	On-Demand	Anodyne	MCHR1	25	43
COC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450931883	FF	On-Demand	Anodyne	PRMT3	34	43
CCc1cc(=N)[nH]c(SCCCCCC(C)=O)n1	ZINC000450931885	CF	On-Demand	Anodyne	HDA106	0	47
CCc1cc(=N)[nH]c(SCCCCCC(C)=O)n1	ZINC000450931885	CF	On-Demand	Anodyne	HD1B	0	41
CN(c1ccc2nnc(-c3ccccc3)n2n1)C1CCN(CC(F)(F)F)CC1	ZINC000450931908	GG	On-Demand	Anodyne	LRRK2	27	45
COc1cc(CN(CCNC(C)=O)C2CCSCC2)ccc1Cl	ZINC000450931911	FG	On-Demand	Anodyne	MTNR1A	18	40
COc1cc(CN(CCNC(C)=O)C2CCSCC2)ccc1Cl	ZINC000450931911	FG	On-Demand	Anodyne	MTNR1B	18	40
Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2CCc1ccc(Cl)cc1	ZINC000450931924	EI	On-Demand	Anodyne	CACNA1D	34	40
COCCOC[C@@H](O)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450931934	ED	On-Demand	Anodyne	ABCB1	41	37
COCCOC[C@@H](O)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450931934	ED	On-Demand	Anodyne	CTSS	0	43
COCCOC[C@@H](O)CN1CCC(N2CCc3ccccc32)CC1	ZINC000450931934	ED	On-Demand	Anodyne	HSP90AB1	42	44
CCCn1nccc1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450931944	EH	On-Demand	Anodyne	ACHE	15	42
CCCn1nccc1C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450931944	EH	On-Demand	Anodyne	SSTR5	43	36
Brc1ccc(C2CCN(Cc3nnc(C4CC4)s3)CC2)cc1	ZINC000450931946	GJ	On-Demand	Anodyne	VACHT_TETCF	0	40
C[C@@H](O)CCN1CCC(c2ccc(Br)cc2)CC1	ZINC000450931947	DG	On-Demand	Anodyne	VACHT_TETCF	0	51
C[C@@H](O)CCN1CCC(c2ccc(Br)cc2)CC1	ZINC000450931947	DG	On-Demand	Anodyne	CCR5	36	44
C[C@@H](O)CCN1CCC(c2ccc(Br)cc2)CC1	ZINC000450931947	DG	On-Demand	Anodyne	SLC18A3	29	51
C[C@H](O)CCN1CCC(c2ccc(Br)cc2)CC1	ZINC000450931948	DG	On-Demand	Anodyne	VACHT_TETCF	0	51
C[C@H](O)CCN1CCC(c2ccc(Br)cc2)CC1	ZINC000450931948	DG	On-Demand	Anodyne	CCR5	36	44
C[C@H](O)CCN1CCC(c2ccc(Br)cc2)CC1	ZINC000450931948	DG	On-Demand	Anodyne	SLC18A3	29	51
COC(=O)c1coc(CN2CCC(N3CCc4ccccc43)CC2)n1	ZINC000450931954	EE	On-Demand	Anodyne	SCD1	16	43
CCCN(Cc1cnns1)[C@H](C)CC(=O)Nc1ccccc1	ZINC000450931955	DG	On-Demand	Anodyne	AHK3	0	42
CCCN(Cc1cnns1)[C@@H](C)CC(=O)Nc1ccccc1	ZINC000450931956	DG	On-Demand	Anodyne	AHK3	0	42
CCC(=O)CCCN1CCc2cc(F)cc(C)c2C1	ZINC000450931958	CG	On-Demand	Anodyne	HTR5A	18	40
O=[N+]([O-])c1ccc2nc(NC[C@@H]3C[C@H]3C3CC3)nc(O)c2c1	ZINC000450931959	DE	On-Demand	Bother	VCP	28	43
COc1ccc(Br)c(OCc2oc(C(C)C)nc2C)c1	ZINC000450931961	EI	On-Demand	Anodyne	P2RX2	36	40
OCc1nnc(SC[C@H]2CCCCC2(F)F)n1-c1ccccc1	ZINC000450931983	EH	On-Demand	Anodyne	VCP	54	42
OCc1nnc(SC[C@@H]2CCCCC2(F)F)n1-c1ccccc1	ZINC000450931985	EH	On-Demand	Anodyne	VCP	54	42
COc1ccc(N2CCN(c3cnc(C(=O)OC(C)(C)C)cn3)CC2)nc1	ZINC000450931990	FE	On-Demand	Anodyne	GPR119	19	48
COc1cccnc1CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450931998	GD	On-Demand	Anodyne	GCK	47	32
COCCCCOc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450932011	CH	On-Demand	Anodyne	KCNK3	30	42
COCCCCOc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450932011	CH	On-Demand	Anodyne	KCNK9	27	42
Brc1cccc(N2CCN(Cc3cnns3)CC2)c1	ZINC000450932013	EF	On-Demand	Anodyne	DRD1	0	42
COC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(O)cc1	ZINC000450932025	FE	On-Demand	Anodyne	MTNR1A	45	47
COC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(O)cc1	ZINC000450932025	FE	On-Demand	Anodyne	MTNR1B	44	47
COC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(O)cc1	ZINC000450932027	FE	On-Demand	Anodyne	MTNR1A	45	47
COC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ccc(O)cc1	ZINC000450932027	FE	On-Demand	Anodyne	MTNR1B	44	47
CC1(C)CCC[C@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450932028	DF	On-Demand	Bother	PRKCQ	40	33
CC1(C)CCC[C@@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450932030	DF	On-Demand	Bother	PRKCQ	40	33
CCCNC(=O)c1ccc(NC[C@@H]2C[C@H]2C2CC2)nc1	ZINC000450932043	CF	On-Demand	Anodyne	IKBKB	0	40
Cn1c(CN2CCC(F)(c3ccccn3)CC2)nnc1-c1ccccc1	ZINC000450932067	FG	On-Demand	Anodyne	EGLN1	0	40
CCOC(=O)CC(C)(C)CCN1CCC(F)(c2ccccn2)CC1	ZINC000450932069	EH	On-Demand	Anodyne	KCNA3	0	41
O=C1[C@@H](N2CCC(F)(c3ccccn3)CC2)CCN1c1ccc(Cl)cc1	ZINC000450932080	FH	On-Demand	Anodyne	CACNA1H	43	33
O=C1[C@H](N2CCC(F)(c3ccccn3)CC2)CCN1c1ccc(Cl)cc1	ZINC000450932081	FH	On-Demand	Anodyne	CACNA1H	43	33
Cc1ccc(F)c(CC(=O)N[C@H]2CCCN(C(C)C)C2)c1	ZINC000450932083	CF	On-Demand	Anodyne	BIRC2	44	39
Cc1ccc(F)c(CC(=O)N[C@@H]2CCCN(C(C)C)C2)c1	ZINC000450932088	CF	On-Demand	Anodyne	BIRC2	44	39
CCCCOc1cccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450932095	GH	On-Demand	Anodyne	HRH2	39	42
CCCCOc1cccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450932095	GH	On-Demand	Anodyne	PDS	51	34
CCc1c(C(=O)N[C@H]2CCCN(C(C)C)C2)oc2ccccc12	ZINC000450932096	DH	On-Demand	Anodyne	INHA	45	34
CCc1c(C(=O)N[C@H]2CCCN(C(C)C)C2)oc2ccccc12	ZINC000450932096	DH	On-Demand	Anodyne	HTR4	46	37
CCc1c(C(=O)N[C@@H]2CCCN(C(C)C)C2)oc2ccccc12	ZINC000450932097	DH	On-Demand	Anodyne	INHA	45	34
CCc1c(C(=O)N[C@@H]2CCCN(C(C)C)C2)oc2ccccc12	ZINC000450932097	DH	On-Demand	Anodyne	HTR4	46	37
N#Cc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450932100	EF	On-Demand	Mild	CETP	0	41
N#Cc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450932100	EF	On-Demand	Mild	IMDH_CRYPV	27	41
N#Cc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450932100	EF	On-Demand	Mild	HIVRT	0	41
CC(C)N1CCC[C@@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450932101	DF	On-Demand	Anodyne	HRH3	28	41
CC(C)N1CCC[C@@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450932101	DF	On-Demand	Anodyne	EPHX2	30	44
CC(C)N1CCC[C@@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450932102	DF	On-Demand	Anodyne	HRH3	28	41
CC(C)N1CCC[C@@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450932102	DF	On-Demand	Anodyne	EPHX2	30	44
CC(C)N1CCC[C@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450932103	DF	On-Demand	Anodyne	HRH3	28	41
CC(C)N1CCC[C@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450932103	DF	On-Demand	Anodyne	EPHX2	30	44
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450932104	DF	On-Demand	Anodyne	HRH3	28	41
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450932104	DF	On-Demand	Anodyne	EPHX2	30	44
CS(=O)(=O)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450932105	EF	In-Stock	Anodyne	ADAM17	20	43
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccc(Br)cc1	ZINC000450932110	FH	On-Demand	Anodyne	DRD2	27	40
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccc(Br)cc1	ZINC000450932110	FH	On-Demand	Anodyne	SLC18A3	23	41
O=C(CCCN1CC[C@]2(CCCOC2)C1)c1ccc(Br)cc1	ZINC000450932110	FH	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccc(Br)cc1	ZINC000450932111	FH	On-Demand	Anodyne	DRD2	27	40
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccc(Br)cc1	ZINC000450932111	FH	On-Demand	Anodyne	SLC18A3	23	41
O=C(CCCN1CC[C@@]2(CCCOC2)C1)c1ccc(Br)cc1	ZINC000450932111	FH	On-Demand	Anodyne	CYP2J2	49	35
COc1ccc(N2CCN(c3cc([N+](=O)[O-])ccc3C(C)=O)CC2)nc1	ZINC000450932115	FF	On-Demand	Bother	SLC6A9	0	47
COCC1(C#N)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450932121	CF	On-Demand	Mild	CHRM3	16	41
COCC1(C#N)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450932121	CF	On-Demand	Mild	CCR8	39	41
COCC1(C#N)CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450932121	CF	On-Demand	Mild	NPFFR1	50	39
CCOC(=O)c1csc(N2CCN(c3ccc(OC)cn3)CC2)n1	ZINC000450932129	EE	On-Demand	Anodyne	NPBWR1	43	38
COc1ccc(Cl)cc1NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450932132	GI	On-Demand	Anodyne	RBP4	28	46
COc1ccc(Cl)cc1NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450932133	GI	On-Demand	Anodyne	RBP4	28	46
CCCOc1cccc(CN2[C@H](C)CC[C@@H]3O[C@@H](C(=O)OC)C[C@H]32)c1	ZINC000450932166	EG	On-Demand	Anodyne	HRH2	22	41
CCCOc1cccc(CN2[C@H]3C[C@@H](C(=O)OC)O[C@H]3CC[C@H]2C)c1	ZINC000450932167	EG	On-Demand	Anodyne	HRH2	22	41
CCCOc1cccc(CN2[C@H]3C[C@H](C(=O)OC)O[C@H]3CC[C@H]2C)c1	ZINC000450932168	EG	On-Demand	Anodyne	HRH2	22	41
CCCOc1cccc(CN2[C@H](C)CC[C@@H]3O[C@H](C(=O)OC)C[C@H]32)c1	ZINC000450932169	EG	On-Demand	Anodyne	HRH2	22	41
CCc1nnc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)nc1CC	ZINC000450932170	EE	On-Demand	Anodyne	SLC6A1	60	42
CCc1nnc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)nc1CC	ZINC000450932171	EE	On-Demand	Anodyne	SLC6A1	60	42
CCc1cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)n2ncnc2n1	ZINC000450932174	FE	On-Demand	Anodyne	SLC6A3	16	41
CCc1cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)n2ncnc2n1	ZINC000450932174	FE	On-Demand	Anodyne	DHOD	0	40
COC(=O)[C@H]1CN(c2ccc(S(C)(=O)=O)cn2)C[C@@H]1c1ccccc1	ZINC000450932192	FD	On-Demand	Anodyne	SLC6A1	47	42
COC(=O)[C@H]1CN(c2ccc(S(C)(=O)=O)cn2)C[C@@H]1c1ccccc1	ZINC000450932192	FD	On-Demand	Anodyne	SLC6A3	21	47
COC(=O)[C@H]1CN(c2ccc(S(C)(=O)=O)cn2)C[C@H]1c1ccccc1	ZINC000450932194	FD	On-Demand	Anodyne	SLC6A1	47	42
COC(=O)[C@H]1CN(c2ccc(S(C)(=O)=O)cn2)C[C@H]1c1ccccc1	ZINC000450932194	FD	On-Demand	Anodyne	SLC6A3	21	47
COC(=O)[C@@H]1CN(c2ccc(S(C)(=O)=O)cn2)C[C@H]1c1ccccc1	ZINC000450932197	FD	On-Demand	Anodyne	SLC6A1	47	42
COC(=O)[C@@H]1CN(c2ccc(S(C)(=O)=O)cn2)C[C@H]1c1ccccc1	ZINC000450932197	FD	On-Demand	Anodyne	SLC6A3	21	47
Cc1cccc2nc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)sc12	ZINC000450932220	FF	On-Demand	Anodyne	SLC6A7	0	40
CNC(=O)c1ccc(N(C)[C@@H]2C[C@@H](c3cccc(OC)c3)C2)c([N+](=O)[O-])c1	ZINC000450932225	FG	On-Demand	Bother	TAAR1	28	45
COC[C@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450932230	CG	On-Demand	Anodyne	HNMT	49	34
COC[C@@H]1CCCCN1c1ncnc2cc(Cl)ccc12	ZINC000450932232	CG	On-Demand	Anodyne	HNMT	49	34
COC(=O)[C@@H](NC(=O)CSc1nc2c(C)ccnc2[nH]1)C(C)C	ZINC000450932245	ED	On-Demand	Anodyne	ENPP1	74	61
CCO[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1	ZINC000450932246	CF	On-Demand	Bother	SLC27A4	49	32
CC(=O)[C@@](C)(O)CN(C)CCc1cccc([N+](=O)[O-])c1	ZINC000450932250	CD	On-Demand	Bother	CACNA1C	40	34
CC(=O)[C@](C)(O)CN(C)CCc1cccc([N+](=O)[O-])c1	ZINC000450932251	CD	On-Demand	Bother	CACNA1C	40	34
CC(=O)[C@](C)(O)CN(C)CCc1cccc([N+](=O)[O-])c1	ZINC000450932251	CD	On-Demand	Bother	CACNA1D	75	35
CC(=O)c1ccc(CN2CCC(F)(c3cccnc3)CC2)cc1	ZINC000450932255	DH	On-Demand	Anodyne	CXCR3	17	42
CC(=O)c1ccc(CN2CCC(F)(c3cccnc3)CC2)cc1	ZINC000450932255	DH	On-Demand	Anodyne	MCHR2	40	32
COc1ccc(-n2c(C)nnc2S[C@@H]2C[C@H](C)CCC2=O)cc1	ZINC000450932262	EG	On-Demand	Anodyne	AXIN2	0	41
COc1ccc(-n2c(C)nnc2S[C@H]2C[C@H](C)CCC2=O)cc1	ZINC000450932263	EG	On-Demand	Anodyne	AXIN2	0	41
COc1ccc(-n2c(C)nnc2S[C@@H]2C[C@@H](C)CCC2=O)cc1	ZINC000450932264	EG	On-Demand	Anodyne	AXIN2	0	41
COc1ccc(-n2c(C)nnc2S[C@H]2C[C@@H](C)CCC2=O)cc1	ZINC000450932266	EG	On-Demand	Anodyne	AXIN2	0	41
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450932269	FE	On-Demand	Bother	L3MBTL1	0	41
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450932269	FE	On-Demand	Bother	L3MBTL3	18	41
COC(=O)c1csc(CN[C@H]2CCN(Cc3ccccc3)CC2(C)C)n1	ZINC000450932270	FG	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1csc(CN[C@H]2CCN(Cc3ccccc3)CC2(C)C)n1	ZINC000450932270	FG	On-Demand	Anodyne	SIGMAR1	44	39
COC(=O)c1csc(CN[C@@H]2CCN(Cc3ccccc3)CC2(C)C)n1	ZINC000450932271	FG	On-Demand	Anodyne	DRD3	0	41
COC(=O)c1csc(CN[C@@H]2CCN(Cc3ccccc3)CC2(C)C)n1	ZINC000450932271	FG	On-Demand	Anodyne	SIGMAR1	44	39
CCO[C@@H]1CCC[C@H]1Nc1cc(C)nc2ncnn12	ZINC000450932272	CD	On-Demand	Anodyne	DHOD	0	51
COC(=O)c1csc(CSC(C)(C)c2ccccc2)n1	ZINC000450932273	DI	On-Demand	Anodyne	FAS	44	37
CC(=O)NCCN(CCc1ccc(Cl)cc1)C1CCSCC1	ZINC000450932275	EG	On-Demand	Anodyne	C5AR1	27	40
CCc1cc(N)nc(SCCC(=O)NCc2ccc(OC)cc2OC)n1	ZINC000450932283	GE	On-Demand	Anodyne	MTNR1A	48	37
COC(=O)c1ccc(C(=O)Cn2nnc(C3CC3)n2)o1	ZINC000450932294	CC	On-Demand	Anodyne	SCARB1	43	35
COC(=O)c1ccc(CN2CCC(F)(c3cccnc3)CC2)cc1Cl	ZINC000450932299	FH	On-Demand	Anodyne	TACR3	55	34
COC(=O)c1ccc(CN2CCC(F)(c3cccnc3)CC2)cc1Cl	ZINC000450932299	FH	On-Demand	Anodyne	FAAH	18	41
CN(CCN1C[C@H]2COC[C@@H](C1)O2)Cc1ccccc1	ZINC000450932316	CD	On-Demand	Anodyne	SIGMAR1	22	43
Cc1cccc(Cl)c1CN1CCc2ccc(S(C)(=O)=O)cc2CC1	ZINC000450932325	FH	On-Demand	Anodyne	MLNR	0	45
Cc1ccnc2[nH]c(SCC(=O)N[C@H](C)C(=O)N(C)C)nc12	ZINC000450932328	DC	On-Demand	Anodyne	ENPP1	64	54
Cc1ccnc2[nH]c(SCC(=O)N[C@@H](C)C(=O)N(C)C)nc12	ZINC000450932329	DC	On-Demand	Anodyne	ENPP1	64	54
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(c2ccnn2C)C3)cc1Cl	ZINC000450932330	FH	On-Demand	Anodyne	ARG1	31	41
COC(=O)c1ccc(CN2[C@H]3CC[C@H]2CC(c2ccnn2C)C3)cc1Cl	ZINC000450932330	FH	On-Demand	Anodyne	ARG2	31	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA2	77	48
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA1	70	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA7	46	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA5B	55	35
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA4	67	39
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA5A	57	34
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA14	33	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA12	46	39
COC(=O)c1cc(S(N)(=O)=O)ccc1N(C)Cc1ccc(C)c(C)c1	ZINC000450932348	FE	On-Demand	Anodyne	CA9	50	41
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	HTR1A	73	47
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	DRD2	63	47
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	ADRA1D	35	47
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	ADRA1A	40	47
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	ADRA1B	27	47
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	DRD3	59	38
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	HTR7	43	39
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	SIGMAR1	32	41
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	EBP	37	40
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	HNMT	40	33
COc1cccc(OC)c1OCCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932353	GI	On-Demand	Anodyne	ABCB1	15	41
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)NCc1ccc(C)cc1	ZINC000450932360	FH	On-Demand	Anodyne	NR1H2	40	38
COC(=O)c1cccc(CN2CCC(F)(c3ccccn3)CC2)c1Cl	ZINC000450932373	FH	On-Demand	Anodyne	CCR8	33	40
FC1(c2ccccn2)CCN(Cc2ccccc2Oc2cccnc2)CC1	ZINC000450932376	FJ	On-Demand	Anodyne	CCR8	28	48
CCC(=O)CCCN1CCC=C(c2ccccc2)C1	ZINC000450932383	CH	On-Demand	Anodyne	CHRNA6	0	40
COC[C@H]1CCCCN1c1ncnc2ccc(SC)cc12	ZINC000450932393	DG	On-Demand	Anodyne	PDE3A	42	32
COC[C@H]1CCCCN1c1ncnc2ccc(SC)cc12	ZINC000450932393	DG	On-Demand	Anodyne	PDE3B	63	32
COC[C@@H]1CCCCN1c1ncnc2ccc(SC)cc12	ZINC000450932395	DG	On-Demand	Anodyne	PDE3A	42	32
COC[C@@H]1CCCCN1c1ncnc2ccc(SC)cc12	ZINC000450932395	DG	On-Demand	Anodyne	PDE3B	63	32
COc1ccc(C)cc1NC(=O)[C@@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450932410	FH	On-Demand	Anodyne	ENPP1	56	38
COc1ccc(C)cc1NC(=O)[C@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450932413	FH	On-Demand	Anodyne	ENPP1	56	38
CC(F)(F)CCS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450932418	CE	On-Demand	Anodyne	PKM	29	44
Cc1ccnc2[nH]c(SCC(=O)NC[C@@H]3COc4ccccc4O3)nc12	ZINC000450932421	FE	On-Demand	Anodyne	ENPP1	59	48
Cc1ccnc2[nH]c(SCC(=O)NC[C@H]3COc4ccccc4O3)nc12	ZINC000450932422	FE	On-Demand	Anodyne	ENPP1	59	48
COC(=O)c1cncc(N2CCN(c3ccc(OC)cn3)CC2)n1	ZINC000450932449	EC	On-Demand	Anodyne	NPBWR1	42	37
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1c(C)cccc1C	ZINC000450932450	FJ	On-Demand	Anodyne	KCNK3	28	40
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1c(C)cccc1C	ZINC000450932450	FJ	On-Demand	Anodyne	KCNK9	26	40
C[C@H]1CN(c2cc(C(F)(F)F)ccn2)CCN1C(=O)c1cnn(C)c1	ZINC000450932452	FE	On-Demand	Anodyne	SLC6A7	0	43
Cc1nc(N(C)C)nc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450932455	EC	On-Demand	Anodyne	SLC6A7	0	42
CC(C)(C)OC(=O)c1cnc(N(CCN2CCOCC2)Cc2ccco2)cn1	ZINC000450932458	GE	On-Demand	Anodyne	CASR	45	41
CCc1cc(CC)nc(N2CCN(c3ccc(OC)cn3)CC2)n1	ZINC000450932466	EE	On-Demand	Anodyne	ACACB	17	43
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450932468	GH	On-Demand	Anodyne	BDKRB1	24	44
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450932468	GH	On-Demand	Anodyne	RBP4	63	32
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450932468	GH	On-Demand	Anodyne	LUXR	60	38
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@H]1CCOc2ccccc21	ZINC000450932468	GH	On-Demand	Anodyne	TRAR	75	43
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450932470	GH	On-Demand	Anodyne	BDKRB1	24	44
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450932470	GH	On-Demand	Anodyne	RBP4	63	32
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450932470	GH	On-Demand	Anodyne	LUXR	60	38
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N[C@@H]1CCOc2ccccc21	ZINC000450932470	GH	On-Demand	Anodyne	TRAR	75	43
COc1ccc(N2CCN(c3nc4ccccc4c(C)c3C#N)CC2)nc1	ZINC000450932473	FG	On-Demand	Mild	SMO	26	43
CC(=O)N[C@H](C(=O)N[C@H]1CCCN(C(C)C)C1)C(C)(C)C	ZINC000450932475	CD	On-Demand	Anodyne	BIRC2	27	44
CC(=O)N[C@H](C(=O)N[C@@H]1CCCN(C(C)C)C1)C(C)(C)C	ZINC000450932477	CD	On-Demand	Anodyne	BIRC2	27	44
CC(=O)c1cccc(C(F)(F)F)c1OC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000450932484	GI	On-Demand	Anodyne	SLC9A1	42	41
CC(=O)c1cccc(C(F)(F)F)c1OC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000450932484	GI	On-Demand	Anodyne	RBP4	79	38
CC(=O)c1cccc(C(F)(F)F)c1OC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000450932484	GI	On-Demand	Anodyne	SFRP1	54	36
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450932485	FE	On-Demand	Anodyne	PDE3B	52	35
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450932485	FE	On-Demand	Anodyne	LIMK2	65	40
C[C@H]1CN(c2ncnc3cc(Cl)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450932485	FE	On-Demand	Anodyne	SLC6A7	0	49
CC(=O)c1cccc(C(F)(F)F)c1OC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000450932487	GI	On-Demand	Anodyne	SLC9A1	42	41
CC(=O)c1cccc(C(F)(F)F)c1OC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000450932487	GI	On-Demand	Anodyne	RBP4	79	38
CC(=O)c1cccc(C(F)(F)F)c1OC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000450932487	GI	On-Demand	Anodyne	SFRP1	54	36
CCOc1ccccc1NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450932491	GI	On-Demand	Anodyne	RBP4	28	42
CCOc1ccccc1NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450932491	GI	On-Demand	Anodyne	KCNK3	48	53
CCOc1ccccc1NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450932491	GI	On-Demand	Anodyne	KCNK9	46	53
COc1ccc(N2CCN(c3ccc(C(=O)NC(C)C)cc3[N+](=O)[O-])CC2)nc1	ZINC000450932493	GE	On-Demand	Bother	DRD4	42	33
COc1ccc(N2CCN(c3ccc(C(=O)NC(C)C)cc3[N+](=O)[O-])CC2)nc1	ZINC000450932493	GE	On-Demand	Bother	TAAR1	40	55
C[C@H]1CN(c2ncc(C(N)=O)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450932501	FC	On-Demand	Anodyne	CXCR3	33	51
C[C@H]1CN(c2ncc(C(N)=O)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450932501	FC	On-Demand	Anodyne	SLC6A7	0	43
C[C@H]1CN(c2c(C#N)cnc3ccc(Cl)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450932503	GF	On-Demand	Mild	SLC6A7	0	44
CC(=O)c1cccc(C(F)(F)F)c1OCc1ncc(C)cn1	ZINC000450932508	DH	On-Demand	Anodyne	NR1H2	54	34
COc1ccc(N2CCN(c3cc(-n4cccn4)nc(N)n3)CC2)nc1	ZINC000450932511	FC	On-Demand	Anodyne	HRH4	31	47
COc1ccc(N2CCN(c3cc(-n4cccn4)nc(N)n3)CC2)nc1	ZINC000450932511	FC	On-Demand	Anodyne	GALR2	40	30
CCO[C@@H]1CCCC[C@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450932512	CE	On-Demand	Bother	PRKCQ	47	37
COc1cc(CN2CCCCC[C@H]2CCO)ccc1Cl	ZINC000450932513	CG	On-Demand	Anodyne	DRD2	45	38
COc1cc(CN2CCCCC[C@@H]2CCO)ccc1Cl	ZINC000450932514	CG	On-Demand	Anodyne	DRD2	45	38
CC(C)N1CCC(NC(=O)COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450932520	FG	On-Demand	Anodyne	CCR2	75	38
CC(C)N1CCC(NC(=O)COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450932520	FG	On-Demand	Anodyne	EPHX2	21	41
CC(C)N1CCC(NC(=O)COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450932520	FG	On-Demand	Anodyne	MCHR1	24	47
CC(C)N1CCC(NC(=O)COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450932520	FG	On-Demand	Anodyne	LIPG	49	35
CC(C)N1CCC(NC(=O)COc2ccc(C(F)(F)F)cc2F)CC1	ZINC000450932520	FG	On-Demand	Anodyne	LUXN	0	40
CC(C)Oc1cccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450932528	GG	On-Demand	Anodyne	PDS	47	33
Cc1ccc([C@@H](C)NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1C	ZINC000450932530	FH	On-Demand	Anodyne	ACOX1	30	41
CCOC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450932536	CD	On-Demand	Anodyne	ENPP1	60	41
Cc1ccc([C@H](C)NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1C	ZINC000450932538	FH	On-Demand	Anodyne	ACOX1	30	41
COc1ccc(N2CCN(c3cccc(OC)c3[N+](=O)[O-])CC2)nc1	ZINC000450932539	EE	On-Demand	Bother	HTR1A	58	41
COc1ccc(N2CCN(c3cccc(OC)c3[N+](=O)[O-])CC2)nc1	ZINC000450932539	EE	On-Demand	Bother	DRD2	47	39
COc1ccc(N2CCN(c3cccc(OC)c3[N+](=O)[O-])CC2)nc1	ZINC000450932539	EE	On-Demand	Bother	DRD3	43	39
COc1ccc(N2CCN(c3cccc(OC)c3[N+](=O)[O-])CC2)nc1	ZINC000450932539	EE	On-Demand	Bother	HTR7	43	40
CC(=O)Nc1cccc(NC(=O)[C@@H](Sc2nc3c(C)ccnc3[nH]2)C(C)C)c1	ZINC000450932540	GH	On-Demand	Anodyne	ENPP1	27	45
COc1ccc(N2CCN(c3nc(OC)cc(OC)n3)CC2)nc1	ZINC000450932541	ED	On-Demand	Anodyne	GALR2	40	36
CC(=O)Nc1cccc(NC(=O)[C@H](Sc2nc3c(C)ccnc3[nH]2)C(C)C)c1	ZINC000450932542	GH	On-Demand	Anodyne	ENPP1	27	45
Oc1nc(N(CCN2CCOCC2)Cc2ccco2)nc2ccccc12	ZINC000450932550	FE	On-Demand	Anodyne	CASR	41	37
O=S(=O)(C[C@@H]1CCCC1(F)F)c1ccc2c(c1)OCCO2	ZINC000450932551	DF	On-Demand	Anodyne	PKM	33	43
O=S(=O)(C[C@H]1CCCC1(F)F)c1ccc2c(c1)OCCO2	ZINC000450932553	DF	On-Demand	Anodyne	PKM	33	43
C[C@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C(=O)c1cnn(C)c1	ZINC000450932555	GF	On-Demand	Bother	LIPG	47	35
CCOc1cccc(CN(CCO)c2nc(C(C)(C)C)ns2)c1	ZINC000450932560	EG	On-Demand	Anodyne	SQLE	40	30
COC(=O)c1ccc([N+](=O)[O-])c(N2CCN(c3ccc(OC)cn3)CC2)c1	ZINC000450932563	FE	On-Demand	Bother	TAAR1	24	44
COc1ccc(N2CCN(c3ccc(C(N)=O)nn3)CC2)nc1	ZINC000450932570	DC	On-Demand	Anodyne	SCD1	42	42
CN(c1ncc(C(N)=O)cc1Cl)C1CCN(CC(F)(F)F)CC1	ZINC000450932576	FE	On-Demand	Anodyne	HPGDS	37	41
C[C@H]1CN(c2nc3ccccc3cc2CO)CCN1C(=O)c1cnn(C)c1	ZINC000450932578	FD	On-Demand	Anodyne	SMO	19	44
COc1ccc(N2CCN(c3ncnc4sc5c(c34)CCC5)CC2)nc1	ZINC000450932581	FF	On-Demand	Anodyne	RBP4	21	52
CCc1cc(O)nc(-c2ccc(N3CCN(c4ccc(OC)cn4)CC3)nc2)n1	ZINC000450932583	GF	On-Demand	Anodyne	CCKAR	0	41
NC(=O)c1cc(N(CCN2CCOCC2)Cc2ccco2)ccn1	ZINC000450932585	ED	On-Demand	Anodyne	CASR	47	38
c1coc(CN(CCN2CCOCC2)c2nc3ccccc3s2)c1	ZINC000450932589	EG	On-Demand	Anodyne	CASR	31	44
COc1ccc(CNC(=O)CCN2CCC[C@@H]2[C@@H]2CCCO2)c(OC)c1	ZINC000450932594	FE	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN2CCC[C@@H]2[C@@H]2CCCO2)c(OC)c1	ZINC000450932594	FE	On-Demand	Anodyne	ACKR3	51	31
Cc1ccnc2[nH]c(SCC(=O)NCCc3ccc(OC(C)C)cc3)nc12	ZINC000450932595	GH	On-Demand	Anodyne	ENPP1	74	51
COc1ccc(CNC(=O)CCN2CCC[C@@H]2[C@H]2CCCO2)c(OC)c1	ZINC000450932596	FE	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN2CCC[C@@H]2[C@H]2CCCO2)c(OC)c1	ZINC000450932596	FE	On-Demand	Anodyne	ACKR3	51	31
COc1ccc(CNC(=O)CCN2CCC[C@H]2[C@@H]2CCCO2)c(OC)c1	ZINC000450932597	FE	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN2CCC[C@H]2[C@@H]2CCCO2)c(OC)c1	ZINC000450932597	FE	On-Demand	Anodyne	ACKR3	51	31
COc1ccc(CNC(=O)CCN2CCC[C@H]2[C@H]2CCCO2)c(OC)c1	ZINC000450932598	FE	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc(CNC(=O)CCN2CCC[C@H]2[C@H]2CCCO2)c(OC)c1	ZINC000450932598	FE	On-Demand	Anodyne	ACKR3	51	31
CCOc1cccc(CN(CCO)c2ccnc(C(C)C)n2)c1	ZINC000450932601	DF	On-Demand	Anodyne	CETP	0	41
Cc1ccnc2[nH]c(SCC(=O)NCCCc3ccccc3)nc12	ZINC000450932609	EG	On-Demand	Anodyne	CRTM	40	36
Cc1ccnc2[nH]c(SCC(=O)NCCCc3ccccc3)nc12	ZINC000450932609	EG	On-Demand	Anodyne	ENPP1	63	53
C[C@H](O)CCN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450932610	CG	On-Demand	Anodyne	SLC6A1	49	40
C[C@@H](O)CCN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450932611	CG	On-Demand	Anodyne	SLC6A1	49	40
COc1ccc(N2CCN(c3cc(C#N)c4ccccc4n3)CC2)nc1	ZINC000450932623	EF	On-Demand	Mild	SMO	25	41
CC[C@H]1CCCCN1C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932629	EG	On-Demand	Anodyne	COLA	95	39
CC[C@H]1CCCCN1C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932629	EG	On-Demand	Anodyne	CPT1A	59	39
CC[C@H]1CCCCN1C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932629	EG	On-Demand	Anodyne	ABHD11	0	40
CC[C@@H]1CCCCN1C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932630	EG	On-Demand	Anodyne	COLA	95	39
CC[C@@H]1CCCCN1C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932630	EG	On-Demand	Anodyne	CPT1A	59	39
CC[C@@H]1CCCCN1C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932630	EG	On-Demand	Anodyne	ABHD11	0	40
COc1ccc(N2CCN(c3nc(N)c4cnn(C)c4n3)CC2)nc1	ZINC000450932631	EC	On-Demand	Anodyne	HRH4	23	40
CCOC(=O)c1ccc(CSCc2ccc3c(c2)OCO3)nc1	ZINC000450932648	EG	On-Demand	Anodyne	PLM2_PLAFA	0	41
O[C@H](COCc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932652	GH	On-Demand	Anodyne	ABCB1	40	38
COc1ccc(N2CCN(c3nccc4c(OC)cccc34)CC2)nc1	ZINC000450932654	FF	On-Demand	Anodyne	PDE3A	42	34
COc1ccc(N2CCN(c3nccc4c(OC)cccc34)CC2)nc1	ZINC000450932654	FF	On-Demand	Anodyne	PDE3B	62	34
CC(C)N1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450932655	FH	On-Demand	Anodyne	BIRC2	36	41
CC(C)N1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450932656	FH	On-Demand	Anodyne	BIRC2	36	41
CN(CCN1CCC(F)(c2ccccn2)CC1)Cc1ccc(F)cc1	ZINC000450932666	EH	On-Demand	Anodyne	DRD4	15	41
CN(CCN1CCC(F)(c2ccccn2)CC1)Cc1ccc(F)cc1	ZINC000450932666	EH	On-Demand	Anodyne	HTR2A	15	41
CN(CCN1CCC(F)(c2ccccn2)CC1)Cc1ccc(F)cc1	ZINC000450932666	EH	On-Demand	Anodyne	SIGMAR1	26	46
COc1ccc2nc(N(C)Cc3cccc(C)n3)c(C)nc2c1	ZINC000450932667	DG	On-Demand	Anodyne	DFR1	16	40
COc1ccc2nc(N(C)Cc3cccc(C)n3)c(C)nc2c1	ZINC000450932667	DG	On-Demand	Anodyne	DYR_PNECA	15	43
C[C@H]1CN(c2ccnc(C(F)(F)F)c2)CCN1C(=O)c1cnn(C)c1	ZINC000450932676	FE	On-Demand	Anodyne	SLC6A7	0	43
C[C@H](O)CCCS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450932678	CD	On-Demand	Anodyne	PKM	33	44
CCOc1cc(SCC(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000450932680	CE	On-Demand	Bother	GSTM2	47	36
C[C@@H](O)CCCS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450932682	CD	On-Demand	Anodyne	PKM	33	44
COc1ccc(N2CCN(c3nn4c(C)nnc4c4ccccc34)CC2)nc1	ZINC000450932690	GE	On-Demand	Anodyne	CREBBP	46	42
COc1ccc(N2CCN(c3nn4c(C)nnc4c4ccccc34)CC2)nc1	ZINC000450932690	GE	On-Demand	Anodyne	SMO	23	40
COc1ccc(N2CCN(c3nn4c(C)nnc4c4ccccc34)CC2)nc1	ZINC000450932690	GE	On-Demand	Anodyne	CECR2	0	42
COc1ccc(N2CCN(c3nn4c(C)nnc4c4ccccc34)CC2)nc1	ZINC000450932690	GE	On-Demand	Anodyne	BRD9	57	42
COCC1(C#N)CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450932710	DG	On-Demand	Mild	SRC	42	39
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	DRD2	39	54
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	DRD1	27	52
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	DRD4	25	54
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	HRH2	0	54
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	HTR2A	24	58
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	HTR2C	19	55
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	HRH1	17	54
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	DRD3	16	51
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	DRD5	20	41
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	ERG2	25	54
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	HTR7	15	41
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	SLC18A3	23	55
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	CYP2J2	52	37
COCC1(C#N)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450932716	DG	On-Demand	Mild	AP2S1	0	54
CN1CCC[C@H]1CCN1CCC(F)(c2ccccn2)CC1	ZINC000450932718	CF	On-Demand	Anodyne	CHRNA10	55	42
CN1CCC[C@H]1CCN1CCC(F)(c2ccccn2)CC1	ZINC000450932718	CF	On-Demand	Anodyne	ACKR3	61	31
COCc1nc(SCC(=O)N(C)C)c2c(-c3ccccc3)csc2n1	ZINC000450932723	FH	On-Demand	Anodyne	TGM2	16	40
CN1CCC[C@@H]1CCN1CCC(F)(c2ccccn2)CC1	ZINC000450932726	CF	On-Demand	Anodyne	CHRNA10	55	42
CN1CCC[C@@H]1CCN1CCC(F)(c2ccccn2)CC1	ZINC000450932726	CF	On-Demand	Anodyne	ACKR3	61	31
c1ccc(CCn2ccc(CN3CCC4(CCOCC4)CC3)n2)cc1	ZINC000450932734	EH	On-Demand	Anodyne	SIGMAR1	47	40
COC[C@@H]1CCCCN1c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450932748	GD	On-Demand	Bother	CASP3	86	43
COC[C@@H]1CCCCN1c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450932748	GD	On-Demand	Bother	CASP7	89	43
CN(C)C(=O)CSc1ccc(F)cc1[N+](=O)[O-]	ZINC000450932751	CD	On-Demand	Bother	GSTM2	60	34
CN(C)C(=O)CSc1ccc(F)cc1[N+](=O)[O-]	ZINC000450932751	CD	On-Demand	Bother	GSTP1	44	36
COC[C@H]1CCCCN1c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450932752	GD	On-Demand	Bother	CASP3	86	43
COC[C@H]1CCCCN1c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450932752	GD	On-Demand	Bother	CASP7	89	43
CCCOCc1ccccc1CNC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450932753	GH	On-Demand	Anodyne	ENPP1	73	50
COC(=O)[C@H]1CN(c2cc(C(F)(F)F)nc3ncnn23)C[C@@H]1c1ccccc1	ZINC000450932764	GF	On-Demand	Anodyne	DHOD	0	40
COC(=O)[C@H]1CN(c2cc(C(F)(F)F)nc3ncnn23)C[C@H]1c1ccccc1	ZINC000450932767	GF	On-Demand	Anodyne	DHOD	0	40
CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCCC1(F)F	ZINC000450932770	DH	On-Demand	Bother	CACNA1C	52	38
CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCCC1(F)F	ZINC000450932770	DH	On-Demand	Bother	CACNA1D	85	37
CN(CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCCCC1(F)F	ZINC000450932773	DH	On-Demand	Bother	CACNA1C	52	38
CN(CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCCCC1(F)F	ZINC000450932773	DH	On-Demand	Bother	CACNA1D	85	37
COc1ccc(N2CCN(c3ncc(C#N)cc3[N+](=O)[O-])CC2)nc1	ZINC000450932776	ED	On-Demand	Mild	SMO	0	41
C[C@H]1CN(c2cccc(Br)c2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450932780	GE	On-Demand	Mild	SLC6A7	0	40
CC(C)(O)COc1ccc(C(F)(F)F)cc1F	ZINC000450932787	CF	On-Demand	Anodyne	PTGDR2	29	40
C[C@H](C(=O)Nc1ccc(F)cc1F)N1CCC(F)(c2ccccn2)CC1	ZINC000450932795	FH	On-Demand	Anodyne	PRNP	27	42
C[C@@H](C(=O)Nc1ccc(F)cc1F)N1CCC(F)(c2ccccn2)CC1	ZINC000450932798	FH	On-Demand	Anodyne	PRNP	27	42
CC(C)(C)OC(=O)CCCN1CCC(F)(c2ccccn2)CC1	ZINC000450932802	DG	On-Demand	Anodyne	CYP2J2	44	32
COc1cc(CS(=O)(=O)c2ccc3c(c2)OCCO3)ccc1Cl	ZINC000450932814	FG	On-Demand	Anodyne	PKM	33	46
COC(=O)[C@H]1CN(c2nc(C)cc(C#N)n2)C[C@@H]1c1ccccc1	ZINC000450932817	DE	On-Demand	Mild	SLC6A1	24	40
COc1cc(CN2CCC(F)(c3cccnc3)CC2)ccc1Cl	ZINC000450932818	EI	On-Demand	Anodyne	TACR2	25	41
COc1cc(CN2CCC(F)(c3cccnc3)CC2)ccc1Cl	ZINC000450932818	EI	On-Demand	Anodyne	SIGMAR1	21	41
COc1cc(CN2CCC(F)(c3cccnc3)CC2)ccc1Cl	ZINC000450932818	EI	On-Demand	Anodyne	SSTR5	44	37
COC(=O)[C@H]1CN(c2nc(C)cc(C#N)n2)C[C@H]1c1ccccc1	ZINC000450932819	DE	On-Demand	Mild	SLC6A1	24	40
COC(=O)[C@H]1CN(c2nc(C)nc3c2cnn3C)C[C@@H]1c1ccccc1	ZINC000450932841	FE	On-Demand	Anodyne	SLC6A1	35	41
COC(=O)[C@H]1CN(c2nc(C)nc3c2cnn3C)C[C@@H]1c1ccccc1	ZINC000450932841	FE	On-Demand	Anodyne	SLC6A3	20	46
COC(=O)[C@H]1CN(c2nc(C)nc3c2cnn3C)C[C@H]1c1ccccc1	ZINC000450932845	FE	On-Demand	Anodyne	SLC6A1	35	41
COC(=O)[C@H]1CN(c2nc(C)nc3c2cnn3C)C[C@H]1c1ccccc1	ZINC000450932845	FE	On-Demand	Anodyne	SLC6A3	20	46
COC(=O)[C@@H]1CN(c2nc(C)nc3c2cnn3C)C[C@H]1c1ccccc1	ZINC000450932846	FE	On-Demand	Anodyne	SLC6A1	35	41
COC(=O)[C@@H]1CN(c2nc(C)nc3c2cnn3C)C[C@H]1c1ccccc1	ZINC000450932846	FE	On-Demand	Anodyne	SLC6A3	20	46
COC[C@@H]1CCCCN1c1ccnc(-c2ccccc2)n1	ZINC000450932848	CG	On-Demand	Anodyne	COLA	57	36
COC[C@@H]1CCCCN1c1ccnc(-c2ccccc2)n1	ZINC000450932848	CG	On-Demand	Anodyne	CPT1A	40	36
COC[C@H]1CCCCN1c1ccnc(-c2ccccc2)n1	ZINC000450932850	CG	On-Demand	Anodyne	COLA	57	36
COC[C@H]1CCCCN1c1ccnc(-c2ccccc2)n1	ZINC000450932850	CG	On-Demand	Anodyne	CPT1A	40	36
CC(C)N1CCCC[C@H]1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450932864	EF	On-Demand	Anodyne	BIRC2	40	34
Cc1cccc(CN(C)c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])n1	ZINC000450932865	EG	On-Demand	Bother	COLA	67	33
CC(C)N1CCCC[C@@H]1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450932866	EF	On-Demand	Anodyne	BIRC2	40	34
CC(C)N1CCCC[C@H]1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450932868	EF	On-Demand	Anodyne	BIRC2	40	34
CC(C)N1CCCC[C@@H]1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450932870	EF	On-Demand	Anodyne	BIRC2	40	34
O=C(NC[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1)c1ccco1	ZINC000450932888	GG	On-Demand	Anodyne	HTR4	35	41
O=C(NC[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1)c1ccco1	ZINC000450932888	GG	On-Demand	Anodyne	CCR3	23	43
O=C(NC[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1)c1ccco1	ZINC000450932891	GG	On-Demand	Anodyne	HTR4	35	41
O=C(NC[C@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1)c1ccco1	ZINC000450932891	GG	On-Demand	Anodyne	CCR3	23	43
CCO[C@@H]1CCC[C@H]1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC000450932892	CE	On-Demand	Bother	PRKCQ	47	37
COC(=O)[C@H]1CN(c2ncnc3ccc(SC)cc23)C[C@@H]1c1ccccc1	ZINC000450932898	GH	On-Demand	Anodyne	SLC6A1	0	42
COC(=O)[C@H]1CN(c2ncnc3ccc(SC)cc23)C[C@@H]1c1ccccc1	ZINC000450932898	GH	On-Demand	Anodyne	PDE3A	43	33
COC(=O)[C@H]1CN(c2ncnc3ccc(SC)cc23)C[C@@H]1c1ccccc1	ZINC000450932898	GH	On-Demand	Anodyne	PDGFRB	38	42
COC(=O)[C@H]1CN(c2ncnc3ccc(SC)cc23)C[C@@H]1c1ccccc1	ZINC000450932898	GH	On-Demand	Anodyne	PDE3B	64	33
CCS(=O)(=O)c1ccc(CN2CCC3(CCOCC3)CC2)cc1	ZINC000450932899	EF	On-Demand	Anodyne	MMP13	18	40
CCS(=O)(=O)c1ccc(CN2CCC3(CCOCC3)CC2)cc1	ZINC000450932899	EF	On-Demand	Anodyne	ADAM17	21	40
COC(=O)[C@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1c1ccccc1	ZINC000450932901	GH	On-Demand	Anodyne	SLC6A1	0	42
COC(=O)[C@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1c1ccccc1	ZINC000450932901	GH	On-Demand	Anodyne	PDE3A	43	33
COC(=O)[C@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1c1ccccc1	ZINC000450932901	GH	On-Demand	Anodyne	PDGFRB	38	42
COC(=O)[C@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1c1ccccc1	ZINC000450932901	GH	On-Demand	Anodyne	PDE3B	64	33
COC(=O)[C@@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1c1ccccc1	ZINC000450932902	GH	On-Demand	Anodyne	SLC6A1	0	42
COC(=O)[C@@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1c1ccccc1	ZINC000450932902	GH	On-Demand	Anodyne	PDE3A	43	33
COC(=O)[C@@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1c1ccccc1	ZINC000450932902	GH	On-Demand	Anodyne	PDGFRB	38	42
COC(=O)[C@@H]1CN(c2ncnc3ccc(SC)cc23)C[C@H]1c1ccccc1	ZINC000450932902	GH	On-Demand	Anodyne	PDE3B	64	33
CCOC(=O)c1ccnc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1[N+](=O)[O-]	ZINC000450932905	GF	On-Demand	Bother	CACNA1C	50	36
CCOC(=O)c1ccnc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1[N+](=O)[O-]	ZINC000450932905	GF	On-Demand	Bother	CACNA1D	74	34
CCOC(=O)c1ccnc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450932907	GF	On-Demand	Bother	CACNA1C	50	36
CCOC(=O)c1ccnc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450932907	GF	On-Demand	Bother	CACNA1D	74	34
CC(=O)[C@@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932913	DF	On-Demand	Anodyne	DRD2	31	43
CC(=O)[C@@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932913	DF	On-Demand	Anodyne	HTR2A	40	42
CC(=O)[C@@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932913	DF	On-Demand	Anodyne	HTR2C	38	41
CC(=O)[C@@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932913	DF	On-Demand	Anodyne	DRD3	46	39
CC(=O)[C@@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932913	DF	On-Demand	Anodyne	KCNQ2	48	36
CC(=O)[C@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932914	DF	On-Demand	Anodyne	DRD2	31	43
CC(=O)[C@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932914	DF	On-Demand	Anodyne	HTR2A	40	42
CC(=O)[C@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932914	DF	On-Demand	Anodyne	HTR2C	38	41
CC(=O)[C@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932914	DF	On-Demand	Anodyne	DRD3	46	39
CC(=O)[C@](C)(O)CN1CCCN(c2cccc(Cl)c2C)CC1	ZINC000450932914	DF	On-Demand	Anodyne	KCNQ2	48	36
COC(=O)c1cn(CCSc2nc3c(C)ccnc3[nH]2)nn1	ZINC000450932923	DD	On-Demand	Anodyne	ENPP1	53	35
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1	ZINC000450932927	ED	On-Demand	Bother	SLC6A1	51	42
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1	ZINC000450932927	ED	On-Demand	Bother	CACNA1D	41	34
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@@H]1c1ccccc1	ZINC000450932928	ED	On-Demand	Bother	SLC6A1	51	42
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@@H]1c1ccccc1	ZINC000450932928	ED	On-Demand	Bother	CACNA1D	41	34
O=C(NCC(F)(F)CO)c1ccc(N2CCC2)nc1	ZINC000450932932	CC	On-Demand	Anodyne	HPGDS	33	54
CCc1nsc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)n1	ZINC000450932934	DE	On-Demand	Anodyne	SLC6A1	61	42
CCc1nsc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)n1	ZINC000450932935	DE	On-Demand	Anodyne	SLC6A1	61	42
COC(=O)[C@H]1CN(c2nc(-c3cccnc3)nc(C)c2C)C[C@H]1c1ccccc1	ZINC000450932952	GH	On-Demand	Anodyne	SLC6A1	0	42
O[C@@H](COCc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932953	GH	On-Demand	Anodyne	ABCB1	40	38
CC(C)N(C)C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450932954	CG	On-Demand	Anodyne	PTGDR2	0	44
O=C(COc1ccc(C(F)(F)F)cc1F)NCCCN1CCCCCC1=O	ZINC000450932958	GG	On-Demand	Anodyne	TYRO3	24	40
COc1ccc(CN(C)C(=O)CN2CCC(F)(c3ccccn3)CC2)cc1F	ZINC000450932963	GG	On-Demand	Anodyne	TACR3	40	36
COc1ccc(N2CCN(c3ccc(C(=O)N(C)C)cn3)CC2)nc1	ZINC000450932964	ED	On-Demand	Anodyne	DRD4	40	31
COc1ccc(N2CCN(c3ccc(C(=O)N(C)C)cn3)CC2)nc1	ZINC000450932964	ED	On-Demand	Anodyne	HDAC1	0	44
COc1ccc(N2CCN(c3cc(C(F)(F)F)ccn3)CC2)nc1	ZINC000450932965	EF	On-Demand	Anodyne	SMO	0	40
CCOc1cccc(CN(CCO)c2nc(C(F)(F)F)ccc2C#N)c1	ZINC000450932967	FG	On-Demand	Mild	CETP	0	41
CCOc1cccc(CN(CCO)c2nc(C(F)(F)F)ccc2C#N)c1	ZINC000450932967	FG	On-Demand	Mild	SQLE	45	34
CCc1ccc(S(C)(=O)=O)cc1C(=O)N[C@H](C(=O)OC)c1ccc(O)cc1	ZINC000450932968	GE	On-Demand	Anodyne	PTGER3	43	31
CCc1ccc(S(C)(=O)=O)cc1C(=O)N[C@@H](C(=O)OC)c1ccc(O)cc1	ZINC000450932969	GE	On-Demand	Anodyne	PTGER3	43	31
N#CCNC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450932970	CD	On-Demand	Mild	PPARA	22	42
N#CCNC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450932970	CD	On-Demand	Mild	PTGDR2	34	47
O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932978	GI	On-Demand	Anodyne	F8	0	40
O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932978	GI	On-Demand	Anodyne	CCR1	49	43
O[C@H](COc1cc(Cl)ccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932978	GI	On-Demand	Anodyne	ABCB1	61	43
O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932985	GI	On-Demand	Anodyne	F8	0	40
O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932985	GI	On-Demand	Anodyne	CCR1	49	43
O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450932985	GI	On-Demand	Anodyne	ABCB1	61	43
c1ccc(-c2cnc(N(CCN3CCOCC3)Cc3ccco3)cn2)cc1	ZINC000450932988	FG	On-Demand	Anodyne	CASR	43	38
CCO[C@@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1	ZINC000450932994	CG	On-Demand	Bother	SLC27A4	45	32
COC[C@@H]1CCCCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450932995	CF	On-Demand	Bother	CASP3	41	34
COC[C@@H]1CCCCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450932995	CF	On-Demand	Bother	CASP7	50	34
COC[C@H]1CCCCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450932996	CF	On-Demand	Bother	CASP3	41	34
COC[C@H]1CCCCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450932996	CF	On-Demand	Bother	CASP7	50	34
CCOc1cccc(CN(CCO)c2ncc(F)cn2)c1	ZINC000450933005	CE	On-Demand	Anodyne	CETP	0	44
COc1ccc(N2CCN(c3cc(C#N)ccc3C(C)=O)CC2)nc1	ZINC000450933012	EE	On-Demand	Mild	SMO	16	41
COC(=O)c1ccc(CN[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1Cl	ZINC000450933013	FH	On-Demand	Anodyne	SSTR3	23	45
COC(=O)c1ccc(CN[C@H]2CCN(C)[C@H]2c2ccccc2)cc1Cl	ZINC000450933014	FH	On-Demand	Anodyne	SSTR3	23	45
COC(=O)c1ccc(CN[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1Cl	ZINC000450933015	FH	On-Demand	Anodyne	SSTR3	23	45
COC(=O)c1ccc(CN[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1Cl	ZINC000450933016	FH	On-Demand	Anodyne	SSTR3	23	45
C[C@H]1CN(c2ncnc3sccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450933020	ED	On-Demand	Anodyne	LIMK2	55	36
Cc1cnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1C	ZINC000450933040	DD	On-Demand	Anodyne	SLC6A7	0	46
Cc1ccc2ncnc(N(CCN3CCOCC3)Cc3ccco3)c2c1	ZINC000450933044	FF	On-Demand	Anodyne	CLK4	22	44
CCO[C@@H]1CCCC[C@H]1Nc1ncnc2c1ncn2CC	ZINC000450933091	CF	In-Stock	Anodyne	ADORA1	22	45
COc1ccc(N2CCN(c3nc(C)nc4c3CCCC4)CC2)nc1	ZINC000450933102	EE	On-Demand	Anodyne	TUBB3	21	44
CCOC(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1	ZINC000450933111	FD	On-Demand	Anodyne	SMO	0	40
CCOC(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1	ZINC000450933111	FD	On-Demand	Anodyne	SLC6A7	0	42
O=C(CCCN1CCCCC[C@H]1CCO)c1ccccc1	ZINC000450933119	CG	On-Demand	Anodyne	SLC6A1	80	43
O=C(CCCN1CCCCC[C@H]1CCO)c1ccccc1	ZINC000450933119	CG	On-Demand	Anodyne	SLC18A2	37	40
O=C(CCCN1CCCCC[C@H]1CCO)c1ccccc1	ZINC000450933119	CG	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCCCC[C@@H]1CCO)c1ccccc1	ZINC000450933121	CG	On-Demand	Anodyne	SLC6A1	80	43
O=C(CCCN1CCCCC[C@@H]1CCO)c1ccccc1	ZINC000450933121	CG	On-Demand	Anodyne	SLC18A2	37	40
O=C(CCCN1CCCCC[C@@H]1CCO)c1ccccc1	ZINC000450933121	CG	On-Demand	Anodyne	CYP2J2	56	39
COc1ccc(CCNC(=O)CSc2nc3c(C)ccnc3[nH]2)cc1OC	ZINC000450933125	GF	On-Demand	Anodyne	ENPP1	106	70
Cc1ccnc2[nH]c(SCC(=O)NCCc3ccc(OC(F)F)cc3)nc12	ZINC000450933126	GG	On-Demand	Anodyne	ENPP1	72	50
CCNC(=O)C[C@@H]1CCCCN1Cc1cccc(C(C)=O)c1	ZINC000450933130	DF	On-Demand	Anodyne	CCR3	19	43
CCNC(=O)C[C@H]1CCCCN1Cc1cccc(C(C)=O)c1	ZINC000450933131	DF	On-Demand	Anodyne	CCR3	19	43
O=C(NCCO)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nn1	ZINC000450933137	GC	On-Demand	Anodyne	CASR	43	35
CC(=O)c1nc(N(CCN2CCOCC2)Cc2ccco2)sc1C	ZINC000450933147	EF	On-Demand	Anodyne	CASR	47	37
Cc1ccc(CNC(=O)[C@H](C)N2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933150	FG	On-Demand	Anodyne	SLC6A11	0	41
Cc1ccc(CNC(=O)[C@H](C)N2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933150	FG	On-Demand	Anodyne	SLC6A12	0	41
Cc1ccc(CNC(=O)[C@@H](C)N2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933151	FG	On-Demand	Anodyne	SLC6A11	0	41
Cc1ccc(CNC(=O)[C@@H](C)N2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933151	FG	On-Demand	Anodyne	SLC6A12	0	41
Cn1c(CN2CCC(F)(c3ccccn3)CC2)nc2ccccc2c1=O	ZINC000450933154	FF	On-Demand	Anodyne	GRM2	23	41
Cn1c(CN2CCC(F)(c3ccccn3)CC2)nc2ccccc2c1=O	ZINC000450933154	FF	On-Demand	Anodyne	HIF1A	23	44
O=C1CCC(CN2CCN(c3cccc(Br)c3)CC2)CC1	ZINC000450933155	FG	On-Demand	Anodyne	HTR1A	29	49
CC(C)(C)c1cc(CS(=O)(=O)c2ccc3c(c2)OCCO3)no1	ZINC000450933157	EF	On-Demand	Anodyne	PKM	30	42
CC(C)N1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450933159	FH	On-Demand	Anodyne	SLC6A1	23	42
CC(C)N1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450933160	FH	On-Demand	Anodyne	SLC6A1	23	42
COc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1[N+](=O)[O-]	ZINC000450933180	EG	On-Demand	Bother	SSTR5	48	38
O[C@H](COc1ccc2c(c1)OCO2)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933185	FF	On-Demand	Anodyne	ACOX1	76	34
O[C@H](COc1ccc2c(c1)OCO2)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933185	FF	On-Demand	Anodyne	ABCB1	40	37
O[C@@H](COc1ccc2c(c1)OCO2)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933186	FF	On-Demand	Anodyne	ACOX1	76	34
O[C@@H](COc1ccc2c(c1)OCO2)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933186	FF	On-Demand	Anodyne	ABCB1	40	37
CCOc1ccccc1[C@H](CC)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933191	GI	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1[C@H](CC)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933191	GI	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1[C@@H](CC)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933192	GI	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1[C@@H](CC)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933192	GI	On-Demand	Anodyne	HCN4	41	33
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	DRD2	17	53
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	DRD4	31	42
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	ACHE	39	57
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	LTA4H	17	40
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	SIGMAR1	48	53
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	CCR3	33	43
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	SLC6A5	28	40
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	MCHR1	42	39
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	CACNA1G	26	41
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	CACNA1I	60	40
CC(=O)c1ccc(CN2CCC(CC(F)(F)F)CC2)cc1	ZINC000450933198	CI	On-Demand	Anodyne	CYP2J2	44	32
COCCOCCOc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450933204	DF	On-Demand	Anodyne	KCNK3	30	41
COCCOCCOc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450933204	DF	On-Demand	Anodyne	KCNK9	27	41
CCOC(=O)c1ccc(CN2CCC(C#N)(COC)CC2)nc1	ZINC000450933229	DE	On-Demand	Mild	P2RY12	38	40
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1nc(C)cs1	ZINC000450933230	FH	On-Demand	Anodyne	MPL	43	40
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)Nc1nc(C)cs1	ZINC000450933230	FH	On-Demand	Anodyne	GCK	0	45
COC(=O)[C@@H](NC(=O)CCCC(=O)C1CC1)c1ccc(O)cc1	ZINC000450933231	DD	On-Demand	Anodyne	HDA106	0	43
COC(=O)[C@H](NC(=O)CCCC(=O)C1CC1)c1ccc(O)cc1	ZINC000450933232	DD	On-Demand	Anodyne	HDA106	0	43
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933238	GH	On-Demand	Anodyne	ACOX1	75	36
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933238	GH	On-Demand	Anodyne	CYP2D6	0	51
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933238	GH	On-Demand	Anodyne	ABCB1	52	41
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933238	GH	On-Demand	Anodyne	PDS	42	37
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933239	GH	On-Demand	Anodyne	ACOX1	75	36
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933239	GH	On-Demand	Anodyne	CYP2D6	0	51
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933239	GH	On-Demand	Anodyne	ABCB1	52	41
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933239	GH	On-Demand	Anodyne	PDS	42	37
COc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1Cl	ZINC000450933240	EI	On-Demand	Anodyne	DRD2	15	41
COc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1Cl	ZINC000450933240	EI	On-Demand	Anodyne	DRD4	32	43
COc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1Cl	ZINC000450933240	EI	On-Demand	Anodyne	DRD3	15	41
COc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1Cl	ZINC000450933240	EI	On-Demand	Anodyne	SIGMAR1	41	43
COc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1Cl	ZINC000450933240	EI	On-Demand	Anodyne	SSTR5	58	40
COc1cc(CN2CCC(F)(c3ccccn3)CC2)ccc1Cl	ZINC000450933240	EI	On-Demand	Anodyne	MCHR2	67	32
COc1ccc(N2CCN(c3ncnc4sc([N+](=O)[O-])cc34)CC2)nc1	ZINC000450933244	FE	On-Demand	Bother	PDGFRB	45	39
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)CC[C@@H]1CCCCO1	ZINC000450933248	FI	On-Demand	Anodyne	OXTR	0	40
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)CC[C@H]1CCCCO1	ZINC000450933249	FI	On-Demand	Anodyne	OXTR	0	40
C[C@@H](O)CCN1CC[C@](F)(c2ccccc2F)C1	ZINC000450933256	CE	On-Demand	Anodyne	SLC18A3	40	34
C[C@H](O)CCN1CC[C@@](F)(c2ccccc2F)C1	ZINC000450933257	CE	On-Demand	Anodyne	SLC18A3	40	34
C[C@@H](O)CCN1CC[C@@](F)(c2ccccc2F)C1	ZINC000450933258	CE	On-Demand	Anodyne	SLC18A3	40	34
C[C@H](O)CCN1CC[C@](F)(c2ccccc2F)C1	ZINC000450933259	CE	On-Demand	Anodyne	SLC18A3	40	34
COc1cc(OCCCCCC(C)=O)ccc1[N+](=O)[O-]	ZINC000450933262	CG	On-Demand	Bother	P2RY12	0	40
COc1cc(OCCCCCC(C)=O)ccc1[N+](=O)[O-]	ZINC000450933262	CG	On-Demand	Bother	PLA2G4B	53	31
O=C(CCCN1CCOCC12CC2)c1ccc(F)cc1	ZINC000450933270	CF	On-Demand	Anodyne	DRD2	33	48
O=C(CCCN1CCOCC12CC2)c1ccc(F)cc1	ZINC000450933270	CF	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CCOCC12CC2)c1ccc(F)cc1	ZINC000450933270	CF	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CCOCC12CC2)c1ccc(F)cc1	ZINC000450933270	CF	On-Demand	Anodyne	SLC18A3	0	47
O=C(CCCN1CCOCC12CC2)c1ccc(F)cc1	ZINC000450933270	CF	On-Demand	Anodyne	CYP2J2	46	33
CCOC(=O)c1ccc(CSc2nc3c(C)ccnc3[nH]2)nc1	ZINC000450933275	EG	On-Demand	Anodyne	ENPP1	31	46
COc1ccc(CNC(=O)CCN2CC[C@@](F)(CO)C2)c(OC)c1	ZINC000450933285	ED	On-Demand	Anodyne	HTR7	25	41
COc1ccc(CNC(=O)CCN2CC[C@@](F)(CO)C2)c(OC)c1	ZINC000450933285	ED	On-Demand	Anodyne	MTNR1A	53	36
COc1ccc(CNC(=O)CCN2CC[C@](F)(CO)C2)c(OC)c1	ZINC000450933286	ED	On-Demand	Anodyne	HTR7	25	41
COc1ccc(CNC(=O)CCN2CC[C@](F)(CO)C2)c(OC)c1	ZINC000450933286	ED	On-Demand	Anodyne	MTNR1A	53	36
COc1ccc(OCCSc2nc3c(C)ccnc3[nH]2)c([N+](=O)[O-])c1	ZINC000450933288	FG	On-Demand	Bother	ENPP1	57	49
COc1ccc(-n2c(C)nnc2SCC[C@H](C)O)cc1	ZINC000450933290	CE	On-Demand	Anodyne	WNT3A	23	48
COc1ccc(-n2c(C)nnc2SCC[C@H](C)O)cc1	ZINC000450933290	CE	On-Demand	Anodyne	AXIN2	0	54
COc1ccc(-n2c(C)nnc2SCC[C@@H](C)O)cc1	ZINC000450933291	CE	On-Demand	Anodyne	WNT3A	23	48
COc1ccc(-n2c(C)nnc2SCC[C@@H](C)O)cc1	ZINC000450933291	CE	On-Demand	Anodyne	AXIN2	0	54
Cc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1Cl	ZINC000450933292	EE	On-Demand	Anodyne	LIMK2	40	36
Cc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1Cl	ZINC000450933292	EE	On-Demand	Anodyne	SLC6A7	0	49
CCOc1cccc(CN(CCO)c2ccccc2[N+](=O)[O-])c1	ZINC000450933295	DF	On-Demand	Bother	CETP	0	41
C[C@H]1CN(c2nccc3c([N+](=O)[O-])cccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450933297	GE	On-Demand	Bother	SMO	15	44
C[C@H]1CN(c2nccc3c([N+](=O)[O-])cccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450933297	GE	On-Demand	Bother	SLC6A7	0	41
Cn1ncnc1[C@@H]1COCCN1CCCC(=O)c1ccccc1	ZINC000450933307	DD	On-Demand	Anodyne	CYP2J2	52	37
Cn1ncnc1[C@H]1COCCN1CCCC(=O)c1ccccc1	ZINC000450933308	DD	On-Demand	Anodyne	CYP2J2	52	37
CCS(=O)(=O)c1ccc(COc2ccc(C(F)(F)F)cc2F)cc1	ZINC000450933309	FI	On-Demand	Anodyne	PTGDR2	29	47
C[C@H](SC[C@@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933317	DI	On-Demand	Anodyne	MAP	0	45
C[C@H](SC[C@@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933317	DI	On-Demand	Anodyne	MAP1	133	45
C[C@H](SC[C@@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933317	DI	On-Demand	Anodyne	FFAR2	24	48
C[C@@H](SC[C@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933318	DI	On-Demand	Anodyne	MAP	0	45
C[C@@H](SC[C@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933318	DI	On-Demand	Anodyne	MAP1	133	45
C[C@@H](SC[C@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933318	DI	On-Demand	Anodyne	FFAR2	24	48
C[C@H](SC[C@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933319	DI	On-Demand	Anodyne	MAP	0	45
C[C@H](SC[C@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933319	DI	On-Demand	Anodyne	MAP1	133	45
C[C@H](SC[C@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933319	DI	On-Demand	Anodyne	GCK	23	40
C[C@H](SC[C@H](C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450933319	DI	On-Demand	Anodyne	FFAR2	24	48
C[C@H](CS[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450933320	DI	On-Demand	Anodyne	MAP	0	45
C[C@H](CS[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450933320	DI	On-Demand	Anodyne	MAP1	133	45
C[C@H](CS[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450933320	DI	On-Demand	Anodyne	GCK	23	40
C[C@H](CS[C@H](C)C(=O)Nc1nccs1)c1ccccc1	ZINC000450933320	DI	On-Demand	Anodyne	FFAR2	24	48
FC1(c2cccnc2)CCN(Cc2ccccc2OC2CC2)CC1	ZINC000450933322	EI	On-Demand	Anodyne	CCR8	20	41
COC(=O)[C@H]1CN(c2nc(-c3cccnc3)nc(C)c2C)C[C@@H]1c1ccccc1	ZINC000450933378	GH	On-Demand	Anodyne	SLC6A1	0	42
C[C@H]1C[C@@H](O)CN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C1	ZINC000450933379	EE	On-Demand	Anodyne	NPBWR1	31	40
COC(=O)[C@@H]1CN(c2nc(-c3cccnc3)nc(C)c2C)C[C@H]1c1ccccc1	ZINC000450933380	GH	On-Demand	Anodyne	SLC6A1	0	42
C[C@H]1C[C@H](O)CN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C1	ZINC000450933381	EE	On-Demand	Anodyne	NPBWR1	31	40
C[C@@H]1C[C@@H](O)CN(c2cnn(Cc3ccccc3)c(=O)c2Cl)C1	ZINC000450933383	EE	On-Demand	Anodyne	NPBWR1	31	40
COC[C@H]1CCCCN1c1ccccc1[N+](=O)[O-]	ZINC000450933384	CF	On-Demand	Bother	CASP3	43	37
COC[C@H]1CCCCN1c1ccccc1[N+](=O)[O-]	ZINC000450933384	CF	On-Demand	Bother	CASP7	52	37
COC[C@@H]1CCCCN1c1ccccc1[N+](=O)[O-]	ZINC000450933386	CF	On-Demand	Bother	CASP3	43	37
COC[C@@H]1CCCCN1c1ccccc1[N+](=O)[O-]	ZINC000450933386	CF	On-Demand	Bother	CASP7	52	37
CCS(=O)(=O)c1ccc(CN(CCNC(C)=O)Cc2ccc(C)s2)cc1	ZINC000450933389	GF	On-Demand	Anodyne	RORC	24	47
COC(=O)c1coc(CN2CCC(N3CCc4cc(F)ccc43)CC2)n1	ZINC000450933390	FF	On-Demand	Anodyne	SCD1	28	43
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1	ZINC000450933417	GF	On-Demand	Bother	CACNA1D	43	34
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](C(=O)OC)[C@H](c3ccccc3)C2)c1	ZINC000450933420	GF	On-Demand	Bother	CACNA1D	43	34
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)c1	ZINC000450933422	GF	On-Demand	Bother	CACNA1D	43	34
COC(=O)[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ccc(C)c(C)c1	ZINC000450933453	FF	On-Demand	Anodyne	MMP13	0	41
COC(=O)[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ccc(C)c(C)c1	ZINC000450933454	FF	On-Demand	Anodyne	MMP13	0	41
COc1cc(CN(CCNC(C)=O)Cc2ccsc2)ccc1Cl	ZINC000450933475	FH	On-Demand	Anodyne	MTNR1A	20	41
CC[C@H](Nc1ccc([N+](=O)[O-])cc1)C(=O)NC	ZINC000450933483	BD	On-Demand	Bother	PGR	22	43
CC[C@H](Nc1ccc([N+](=O)[O-])cc1)C(=O)NC	ZINC000450933483	BD	On-Demand	Bother	AR	0	43
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)C(=O)NC	ZINC000450933484	BD	On-Demand	Bother	PGR	22	43
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)C(=O)NC	ZINC000450933484	BD	On-Demand	Bother	AR	0	43
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)F)n3n2)C[C@@H]1c1ccccc1	ZINC000450933501	FE	On-Demand	Anodyne	SLC6A1	93	43
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)F)n3n2)C[C@@H]1c1ccccc1	ZINC000450933501	FE	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)F)n3n2)C[C@@H]1c1ccccc1	ZINC000450933501	FE	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)F)n3n2)C[C@H]1c1ccccc1	ZINC000450933503	FE	On-Demand	Anodyne	SLC6A1	93	43
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)F)n3n2)C[C@H]1c1ccccc1	ZINC000450933503	FE	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)F)n3n2)C[C@H]1c1ccccc1	ZINC000450933503	FE	On-Demand	Anodyne	SLC6A3	48	43
CN(CCCC(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1	ZINC000450933514	EH	On-Demand	Bother	THRA	0	49
CN(CCCC(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1	ZINC000450933514	EH	On-Demand	Bother	CACNA1C	52	40
CN(CCCC(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1	ZINC000450933514	EH	On-Demand	Bother	CACNA1D	80	40
CN(CCCC(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1	ZINC000450933514	EH	On-Demand	Bother	FAAH	30	47
CN(CCCC(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1	ZINC000450933514	EH	On-Demand	Bother	CES1	34	42
COC(=O)c1coc(CN(C)CCc2cccc([N+](=O)[O-])c2)n1	ZINC000450933527	DE	On-Demand	Bother	CACNA1D	43	36
COc1cccc([C@@H]2C[C@@H](N(C)c3cnc(C(=O)OC(C)(C)C)cn3)C2)c1	ZINC000450933549	FH	On-Demand	Anodyne	GPBAR1	43	35
COCCOC[C@@H](O)CN1CCC(F)(c2cc(OC)cc(OC)c2)CC1	ZINC000450933550	FD	On-Demand	Anodyne	HSP90AB1	38	43
COCCOC[C@H](O)CN1CCC(F)(c2cc(OC)cc(OC)c2)CC1	ZINC000450933553	FD	On-Demand	Anodyne	HSP90AB1	38	43
COc1cccc(OCCC(=O)N2CC[C@H](C)c3cccc(O)c32)c1	ZINC000450933556	EH	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc(OCCC(=O)N2CC[C@H](C)c3cccc(O)c32)c1	ZINC000450933556	EH	On-Demand	Anodyne	MTNR1B	25	40
COc1ccc(N2CCN(c3cc(C)nc(C4CC4)n3)CC2)nc1	ZINC000450933557	EE	On-Demand	Anodyne	EBP	28	43
COc1cccc(OCCC(=O)N2CC[C@@H](C)c3cccc(O)c32)c1	ZINC000450933559	EH	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc(OCCC(=O)N2CC[C@@H](C)c3cccc(O)c32)c1	ZINC000450933559	EH	On-Demand	Anodyne	MTNR1B	25	40
CCO[C@@H]1CCCC[C@H]1Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450933565	FF	On-Demand	Anodyne	NPY2R	40	34
COC[C@H]1CCCCN1c1nc2cc(C)ccc2o1	ZINC000450933574	CG	On-Demand	Anodyne	HTR3A	0	56
COC[C@@H]1CCCCN1c1nc2cc(C)ccc2o1	ZINC000450933575	CG	On-Demand	Anodyne	HTR3A	0	56
CCO[C@@H]1CCCC[C@H]1Nc1ncnc2[nH]ccc12	ZINC000450933582	CF	On-Demand	Anodyne	JAK1	26	45
CCO[C@@H]1CCCC[C@H]1Nc1ncnc2[nH]ccc12	ZINC000450933582	CF	On-Demand	Anodyne	JAK2	30	45
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)NC2(C)C)c(OC)c1	ZINC000450933594	FD	On-Demand	Anodyne	MTNR1A	69	36
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)NC2(C)C)c(OC)c1	ZINC000450933594	FD	On-Demand	Anodyne	MTNR1B	57	36
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)NC2(C)C)c(OC)c1	ZINC000450933595	FD	On-Demand	Anodyne	MTNR1A	69	36
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)NC2(C)C)c(OC)c1	ZINC000450933595	FD	On-Demand	Anodyne	MTNR1B	57	36
COc1ccc(N2CCN(c3nc4ccccc4nc3N3CCCC3)CC2)nc1	ZINC000450933601	GF	On-Demand	Anodyne	HTR3A	20	43
COc1ccc(N2CCN(c3nc4ccccc4nc3N3CCCC3)CC2)nc1	ZINC000450933601	GF	On-Demand	Anodyne	EBP	31	43
COc1ccc(N2CCN(c3nc4ccccc4nc3N3CCCC3)CC2)nc1	ZINC000450933601	GF	On-Demand	Anodyne	GALR2	44	35
O=C(CN1CCC(F)(c2ccccn2)CC1)N1CCN(Cc2ccccc2)CC1	ZINC000450933606	GF	On-Demand	Anodyne	CHRM2	18	43
O=C(CN1CCC(F)(c2ccccn2)CC1)N1CCN(Cc2ccccc2)CC1	ZINC000450933606	GF	On-Demand	Anodyne	DRD2	15	43
O=C(CN1CCC(F)(c2ccccn2)CC1)N1CCN(Cc2ccccc2)CC1	ZINC000450933606	GF	On-Demand	Anodyne	DRD4	37	43
O=C(CN1CCC(F)(c2ccccn2)CC1)N1CCN(Cc2ccccc2)CC1	ZINC000450933606	GF	On-Demand	Anodyne	SIGMAR1	60	40
O=C(CN1CCC(F)(c2ccccn2)CC1)N1CCN(Cc2ccccc2)CC1	ZINC000450933606	GF	On-Demand	Anodyne	FAAH	27	42
O=C(CN1CCC(F)(c2ccccn2)CC1)N1CCN(Cc2ccccc2)CC1	ZINC000450933606	GF	On-Demand	Anodyne	MGLL	0	42
O=C(CN1CCC(F)(c2ccccn2)CC1)N1CCN(Cc2ccccc2)CC1	ZINC000450933606	GF	On-Demand	Anodyne	NPFFR1	48	35
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	HTR1A	19	63
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	DRD2	30	43
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	DRD1	15	50
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	DRD4	25	50
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	ACHE	24	44
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	HTR2A	27	57
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	HTR2C	27	60
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	SLC6A1	62	35
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	HRH1	20	50
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	DRD3	19	50
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	HTR4	48	33
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	GRIN2B	38	43
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	HTR7	29	42
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	SIGMAR1	36	53
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	CCR3	28	47
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccccc1	ZINC000450933610	DI	On-Demand	Anodyne	CYP2J2	76	54
C[C@H](CO)N(C)Cc1cc(CN(C)[C@H](C)CO)cc(C(F)(F)F)c1	ZINC000450933614	EE	On-Demand	Anodyne	TACR1	16	43
CCCNC(=O)CN(C)C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450933615	FE	On-Demand	Anodyne	PPARD	41	39
COc1ccc(COC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933622	FF	On-Demand	Anodyne	ABCB1	47	38
COc1ccc(COC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933622	FF	On-Demand	Anodyne	HSP90AB1	36	42
COc1ccc(COC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933623	FF	On-Demand	Anodyne	ABCB1	47	38
COc1ccc(COC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933623	FF	On-Demand	Anodyne	HSP90AB1	36	42
COc1ccc(N2CCN(c3cc(N4CCC[C@H](CO)C4)ncn3)CC2)nc1	ZINC000450933631	GD	On-Demand	Anodyne	PDE3B	47	34
COC[C@@H]1CCCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450933633	EF	On-Demand	Anodyne	SCD1	36	42
COc1ccc(N2CCN(c3cc(N4CCC[C@@H](CO)C4)ncn3)CC2)nc1	ZINC000450933634	GD	On-Demand	Anodyne	PDE3B	47	34
COC[C@H]1CCCCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450933635	EF	On-Demand	Anodyne	SCD1	36	42
CCOc1cccc(CN(CCO)c2nc(C(F)F)nc3ccccc23)c1	ZINC000450933642	FH	On-Demand	Anodyne	CETP	0	43
CC(=O)c1cccc(C(F)(F)F)c1OCC(=O)N(C)Cc1ccccc1	ZINC000450933647	FH	On-Demand	Anodyne	NR1H2	42	32
COc1ccc(N2CCN(c3ccnc(N4CCCCC4)n3)CC2)nc1	ZINC000450933656	FE	On-Demand	Anodyne	SORD	100	41
COc1ccc(N2CCN(c3ccnc(N4CCCCC4)n3)CC2)nc1	ZINC000450933656	FE	On-Demand	Anodyne	GALR2	49	36
Cc1nccc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450933663	DD	On-Demand	Anodyne	EPHB4	47	33
CCOc1cccc(CN(CCO)c2nc3cc(F)ccc3o2)c1	ZINC000450933698	EG	On-Demand	Anodyne	PPARA	24	62
CCCCCC(=O)Nc1ccc(C(=O)Cn2cnc3snc(C)c3c2=O)cc1	ZINC000450933708	GH	On-Demand	Anodyne	ENPP2	27	40
CC(=O)c1cccc(C(F)(F)F)c1OCc1cnc(C)nc1	ZINC000450933718	DH	On-Demand	Anodyne	NR1H3	24	40
CC(=O)c1cccc(C(F)(F)F)c1OCc1cnc(C)nc1	ZINC000450933718	DH	On-Demand	Anodyne	NR1H2	58	36
CCCNC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450933727	CE	On-Demand	Anodyne	SLC6A9	21	40
CCCNC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450933728	CE	On-Demand	Anodyne	SLC6A9	21	40
CCOc1cccc(CN(CCO)c2cc(C(C)C)ncn2)c1	ZINC000450933730	DF	On-Demand	Anodyne	CETP	0	41
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450933741	EG	On-Demand	Bother	TAAR1	16	41
CCOC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450933750	CF	On-Demand	Anodyne	KCNK3	19	43
COc1cc(OC)c2ncnc(N3C[C@H](C)C[C@@H](O)C3)c2c1	ZINC000450933751	DD	On-Demand	Anodyne	PDE3A	46	37
COc1cc(OC)c2ncnc(N3C[C@@H](O)C[C@@H](C)C3)c2c1	ZINC000450933752	DD	On-Demand	Anodyne	PDE3A	46	37
COc1cc(OC)c2ncnc(N3C[C@@H](C)C[C@H](O)C3)c2c1	ZINC000450933753	DD	On-Demand	Anodyne	PDE3A	46	37
CC[C@@H](Nc1ncnc2c1cnn2-c1ccccc1)C(=O)NC	ZINC000450933754	DD	On-Demand	Anodyne	PDE9A	0	41
CC[C@H](Nc1ncnc2c1cnn2-c1ccccc1)C(=O)NC	ZINC000450933755	DD	On-Demand	Anodyne	PDE9A	0	41
FC1(c2ccccn2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450933762	DI	On-Demand	Anodyne	DRD2	18	46
FC1(c2ccccn2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450933762	DI	On-Demand	Anodyne	DRD4	27	41
FC1(c2ccccn2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450933762	DI	On-Demand	Anodyne	SIGMAR1	42	46
FC1(c2ccccn2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450933762	DI	On-Demand	Anodyne	PRCP	19	48
FC1(c2ccccn2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450933762	DI	On-Demand	Anodyne	ABCC1	62	34
COc1ccc(N2CCN(c3c(C#N)cnc4ccc(C)cc34)CC2)nc1	ZINC000450933771	FG	On-Demand	Mild	SRC	60	34
COCc1ccc([C@@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)o1	ZINC000450933774	GI	On-Demand	Anodyne	COLA	142	46
COCc1ccc([C@@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)o1	ZINC000450933774	GI	On-Demand	Anodyne	CPT1A	132	46
COCc1ccc([C@@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)o1	ZINC000450933774	GI	On-Demand	Anodyne	CPT2	43	36
COCc1ccc([C@@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)o1	ZINC000450933774	GI	On-Demand	Anodyne	PREP	48	34
Cc1cccc(C)c1NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933776	EH	On-Demand	Anodyne	DRD4	0	55
COCc1ccc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)o1	ZINC000450933778	GI	On-Demand	Anodyne	COLA	142	46
COCc1ccc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)o1	ZINC000450933778	GI	On-Demand	Anodyne	CPT1A	132	46
COCc1ccc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)o1	ZINC000450933778	GI	On-Demand	Anodyne	CPT2	43	36
COCc1ccc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)o1	ZINC000450933778	GI	On-Demand	Anodyne	PREP	48	34
CC[C@@H](Nc1ccc(C(=O)NC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450933796	CC	On-Demand	Bother	TAAR1	18	47
CC[C@H](Nc1ccc(C(=O)NC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450933798	CC	On-Demand	Bother	TAAR1	18	47
CCc1cc(N(C)C2CCN(CC(F)(F)F)CC2)n2ncnc2n1	ZINC000450933812	EE	On-Demand	Anodyne	DHOD	0	44
COC(=O)c1ccc(C)c(NC(=O)[C@H](Cc2ccccc2)OC)c1O	ZINC000450933834	EF	On-Demand	Anodyne	MME	41	35
COCC[C@@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450933841	EG	On-Demand	Anodyne	DRD4	43	33
COCC[C@@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450933841	EG	On-Demand	Anodyne	COLA	77	36
COCC[C@@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450933841	EG	On-Demand	Anodyne	CPT1A	70	36
CCOC(=O)CCCNC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933842	FD	On-Demand	Anodyne	ADRA1A	15	41
COC(=O)c1ccc(C)c(NC(=O)[C@@H](Cc2ccccc2)OC)c1O	ZINC000450933843	EF	On-Demand	Anodyne	MME	41	35
CCOc1ccc([C@H](COC)NCc2ccccc2OC2CC2)cc1	ZINC000450933852	EI	On-Demand	Anodyne	SLC5A4	28	42
COc1ccc(N2CCN(c3nc(OC)nc(N4CCCCCC4)n3)CC2)nc1	ZINC000450933863	GD	On-Demand	Anodyne	GALR2	46	39
CCOc1ccc([C@@H](COC)NCc2ccccc2OC2CC2)cc1	ZINC000450933868	EI	On-Demand	Anodyne	SLC5A4	28	42
CC[C@@H](Nc1ncnc2ccc(SC)cc12)C(=O)NC	ZINC000450933870	CE	On-Demand	Anodyne	EGFR	44	33
CC[C@H](Nc1ncnc2ccc(SC)cc12)C(=O)NC	ZINC000450933872	CE	On-Demand	Anodyne	EGFR	44	33
O=C1[C@H](N2CCC(F)(c3ccccn3)CC2)CCCN1c1cccc(F)c1	ZINC000450933874	FH	On-Demand	Anodyne	OPRL1	15	40
O=C1[C@@H](N2CCC(F)(c3ccccn3)CC2)CCCN1c1cccc(F)c1	ZINC000450933877	FH	On-Demand	Anodyne	OPRL1	15	40
Cc1ccc(CS(=O)(=O)c2ccc3c(c2)OCCO3)c(Br)c1	ZINC000450933882	GH	On-Demand	Anodyne	PKM	36	43
CCc1csc(N2CCN(c3ccc(OC)cn3)CC2)n1	ZINC000450933901	DE	On-Demand	Anodyne	NPBWR1	42	36
CCN(Cc1ccccc1)C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450933911	FG	On-Demand	Anodyne	TSPO	17	40
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933920	DH	On-Demand	Anodyne	DRD4	28	44
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933920	DH	On-Demand	Anodyne	DRD3	0	44
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933920	DH	On-Demand	Anodyne	HRH3	15	47
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933920	DH	On-Demand	Anodyne	SIGMAR1	62	56
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933920	DH	On-Demand	Anodyne	PRCP	0	45
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933920	DH	On-Demand	Anodyne	SLC18A3	22	42
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450933920	DH	On-Demand	Anodyne	MCHR1	17	40
CCCOc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450933923	BH	On-Demand	Anodyne	KCNK3	19	43
CCCOc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450933923	BH	On-Demand	Anodyne	KCNK9	18	43
CNc1nc(N2CCN(c3ccc(OC)cn3)CC2)nc2ccccc12	ZINC000450933924	FD	On-Demand	Anodyne	HTR3A	23	61
CNc1nc(N2CCN(c3ccc(OC)cn3)CC2)nc2ccccc12	ZINC000450933924	FD	On-Demand	Anodyne	HRH4	24	45
CNc1nc(N2CCN(c3ccc(OC)cn3)CC2)nc2ccccc12	ZINC000450933924	FD	On-Demand	Anodyne	CCR4	33	40
C[C@@H](O)CCS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450933925	CD	On-Demand	Anodyne	PKM	27	41
CC[C@@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(=O)NC	ZINC000450933928	DF	On-Demand	Bother	AADAC	0	61
CC[C@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(=O)NC	ZINC000450933929	DF	On-Demand	Bother	AADAC	0	61
C[C@H](O)CCS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450933930	CD	On-Demand	Anodyne	PKM	27	41
COc1ccc(N2CCN(c3cccc(C(=O)OC(C)(C)C)n3)CC2)nc1	ZINC000450933936	FF	On-Demand	Anodyne	GPR119	18	45
Fc1ccccc1CCN1CCC(F)(c2ccccn2)CC1	ZINC000450933941	DH	On-Demand	Anodyne	HTR2A	16	44
CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)CC1CCC(=O)CC1	ZINC000450933947	FJ	On-Demand	Anodyne	TACR1	39	42
CN(C)C(=O)CSc1ncnc2cc(Br)ccc12	ZINC000450933966	EF	On-Demand	Anodyne	EGFR	46	37
CCOc1cccc(CN(CCO)c2cccc(F)c2C#N)c1	ZINC000450933970	DG	On-Demand	Mild	CETP	0	40
Cc1ccc(CN(C)c2ccc3ncc([N+](=O)[O-])n3n2)cc1C	ZINC000450933976	DF	On-Demand	Bother	PK7	0	42
Cc1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450933979	CE	On-Demand	Bother	GSTM2	46	36
Cc1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450933979	CE	On-Demand	Bother	GSTP1	50	36
CCCC[C@H](SCc1cc[nH]n1)C(=O)OC	ZINC000450933981	BE	On-Demand	Anodyne	CTSK	0	40
CCCC[C@@H](SCc1cc[nH]n1)C(=O)OC	ZINC000450933982	BE	On-Demand	Anodyne	CTSK	0	40
Cc1c(Cl)cccc1N1CCCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450933984	FG	On-Demand	Anodyne	ADRB1	17	41
C[C@H]1CN(c2ccnc3c(Cl)cccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450934036	FF	On-Demand	Anodyne	HCRTR2	29	41
C[C@H]1CN(c2ccnc3c(Cl)cccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450934036	FF	On-Demand	Anodyne	SLC6A7	0	47
COc1cc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc2cc1F	ZINC000450934049	GD	On-Demand	Anodyne	PDE3A	53	41
COc1cc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc2cc1F	ZINC000450934049	GD	On-Demand	Anodyne	PDGFRB	83	40
COc1cc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc2cc1F	ZINC000450934049	GD	On-Demand	Anodyne	PDE3B	78	41
COc1cc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc2cc1F	ZINC000450934049	GD	On-Demand	Anodyne	LIMK2	51	39
Cc1cnc2c(C)cccc2c1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450934050	FF	On-Demand	Anodyne	SLC6A7	0	42
O=C1CCC(CN2CCC[C@](CO)(c3ccccc3)C2)CC1	ZINC000450934055	DF	On-Demand	Anodyne	OPRL1	15	41
O=C1CCC(CN2CCC[C@@](CO)(c3ccccc3)C2)CC1	ZINC000450934056	DF	On-Demand	Anodyne	OPRL1	15	41
CNC(=O)N[C@@H]1CCN(C(=O)Cc2sccc2Br)C1	ZINC000450934071	ED	On-Demand	Anodyne	EPHX2	22	40
CNC(=O)N[C@H]1CCN(C(=O)Cc2sccc2Br)C1	ZINC000450934072	ED	On-Demand	Anodyne	EPHX2	22	40
N#CC1(CN2CC[C@@](F)(c3cccc(Cl)c3)C2)CCC1	ZINC000450934101	CH	On-Demand	Mild	CCR1	15	40
N#CC1(CN2CC[C@](F)(c3cccc(Cl)c3)C2)CCC1	ZINC000450934102	CH	On-Demand	Mild	CCR1	15	40
CCCN(CCCC(=O)c1ccccc1)[C@H]1CC(=O)N(C)C1=O	ZINC000450934103	DE	On-Demand	Anodyne	CYP2J2	49	35
CCCN(CCCC(=O)c1ccccc1)[C@@H]1CC(=O)N(C)C1=O	ZINC000450934104	DE	On-Demand	Anodyne	CYP2J2	49	35
CCc1ncnc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1F	ZINC000450934114	EF	On-Demand	Anodyne	SLC6A1	40	42
CCc1ncnc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)c1F	ZINC000450934115	EF	On-Demand	Anodyne	SLC6A1	40	42
CCNC(=O)c1ccc(N[C@@H]2CN(CC(F)(F)F)C[C@H]2c2ccccc2)nc1	ZINC000450934120	GG	On-Demand	Anodyne	HPGDS	37	43
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000450934125	EG	On-Demand	Bother	TAAR1	16	41
CCO[C@@H]1CCC[C@H]1N=c1ccc(C(=O)Nc2ccccc2)n[nH]1	ZINC000450934131	EF	On-Demand	Anodyne	TIMP3	48	32
COc1cc(CN2CCC[C@@H](c3nc(N(C)C)no3)C2)ccc1Cl	ZINC000450934137	FG	On-Demand	Anodyne	SSTR5	56	39
COc1cc(CN2CCC[C@H](c3nc(N(C)C)no3)C2)ccc1Cl	ZINC000450934138	FG	On-Demand	Anodyne	SSTR5	56	39
COC[C@@H]1CCCCN1c1ncccn1	ZINC000450934142	BD	On-Demand	Anodyne	CHRNA10	42	36
COC[C@H]1CCCCN1c1ncccn1	ZINC000450934143	BD	On-Demand	Anodyne	CHRNA10	42	36
COC[C@H]1CCCCN1c1ccc(F)cc1[N+](=O)[O-]	ZINC000450934144	CF	On-Demand	Bother	CASP3	44	37
COC[C@@H]1CCCCN1c1ccc(F)cc1[N+](=O)[O-]	ZINC000450934145	CF	On-Demand	Bother	CASP3	44	37
CSc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934160	FH	On-Demand	Anodyne	DRD4	0	42
CSc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934160	FH	On-Demand	Anodyne	CALCRL	43	35
FC1(c2ccccn2)CCN(CCOCC2CC2)CC1	ZINC000450934161	CF	On-Demand	Anodyne	HTR4	46	34
CCc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934162	EH	On-Demand	Anodyne	DRD4	0	43
CCc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934162	EH	On-Demand	Anodyne	PRNP	40	38
CCc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934162	EH	On-Demand	Anodyne	CALCRL	44	34
CCS(=O)(=O)c1ccc(CN2CCC=C(c3ccccc3)C2)cc1	ZINC000450934187	EH	On-Demand	Anodyne	SIGMAR1	15	41
CCn1cc(C(=O)N[C@H]2CCCN(C(C)C)C2)c2ccccc21	ZINC000450934191	DG	On-Demand	Anodyne	CNR1	34	46
CCn1cc(C(=O)N[C@H]2CCCN(C(C)C)C2)c2ccccc21	ZINC000450934191	DG	On-Demand	Anodyne	CNR2	42	47
CCn1cc(C(=O)N[C@@H]2CCCN(C(C)C)C2)c2ccccc21	ZINC000450934192	DG	On-Demand	Anodyne	CNR1	34	46
CCn1cc(C(=O)N[C@@H]2CCCN(C(C)C)C2)c2ccccc21	ZINC000450934192	DG	On-Demand	Anodyne	CNR2	42	47
CC[C@@H](Nc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1)C(=O)NC	ZINC000450934212	DD	On-Demand	Mild	F2RL3	45	32
CC[C@H](Nc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1)C(=O)NC	ZINC000450934213	DD	On-Demand	Mild	F2RL3	45	32
COC(=O)[C@@H](C)NC(=O)c1ccc(N(C)Cc2cccc(C)n2)c([N+](=O)[O-])c1	ZINC000450934216	GE	On-Demand	Bother	COLA	44	30
COC(=O)[C@H](C)NC(=O)c1ccc(N(C)Cc2cccc(C)n2)c([N+](=O)[O-])c1	ZINC000450934222	GE	On-Demand	Bother	COLA	44	30
COc1ccc(OCCN2CCC(F)(c3ccccn3)CC2)c([N+](=O)[O-])c1	ZINC000450934224	GG	On-Demand	Bother	LTA4H	15	42
Fc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Cl	ZINC000450934233	DI	On-Demand	Anodyne	DRD2	0	44
Fc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Cl	ZINC000450934233	DI	On-Demand	Anodyne	DRD4	33	44
Fc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Cl	ZINC000450934233	DI	On-Demand	Anodyne	DRD3	0	44
Fc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Cl	ZINC000450934233	DI	On-Demand	Anodyne	SIGMAR1	46	47
Fc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Cl	ZINC000450934233	DI	On-Demand	Anodyne	CXCR3	15	40
Fc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Cl	ZINC000450934233	DI	On-Demand	Anodyne	MCHR2	52	33
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000450934234	GH	On-Demand	Anodyne	CACNA1H	20	43
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000450934234	GH	On-Demand	Anodyne	DRD4	0	52
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000450934234	GH	On-Demand	Anodyne	KIT	15	40
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000450934234	GH	On-Demand	Anodyne	KDR	18	41
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000450934234	GH	On-Demand	Anodyne	CCR2	42	43
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000450934234	GH	On-Demand	Anodyne	EPHX2	16	41
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000450934234	GH	On-Demand	Anodyne	SLC11A2	26	46
COC(=O)[C@@H](NC(=O)CCOc1cccc(OC)c1)c1ccc2c(c1)CCO2	ZINC000450934336	GE	On-Demand	Anodyne	MTNR1A	31	42
COC(=O)[C@H](NC(=O)CCOc1cccc(OC)c1)c1ccc2c(c1)CCO2	ZINC000450934337	GE	On-Demand	Anodyne	MTNR1A	31	42
COC(=O)c1ccc(CN2CCCCC[C@H]2CCO)cc1Cl	ZINC000450934356	EG	On-Demand	Anodyne	DRD2	46	38
COC(=O)c1ccc(CN2CCCCC[C@H]2CCO)cc1Cl	ZINC000450934356	EG	On-Demand	Anodyne	OPRK1	32	44
COC(=O)c1ccc(CN2CCCCC[C@@H]2CCO)cc1Cl	ZINC000450934357	EG	On-Demand	Anodyne	DRD2	46	38
COC(=O)c1ccc(CN2CCCCC[C@@H]2CCO)cc1Cl	ZINC000450934357	EG	On-Demand	Anodyne	OPRK1	32	44
CCOc1cccc(CN(CCO)c2nccc(C(F)(F)F)n2)c1	ZINC000450934358	EF	On-Demand	Anodyne	CETP	0	45
CCOC(=O)c1cnccc1N1CCN(c2ccc(OC)cn2)CC1	ZINC000450934359	ED	On-Demand	Anodyne	P2RY12	27	41
CSc1ccc(CSCC[C@H](C)O)cc1	ZINC000450934360	BG	On-Demand	Anodyne	CACNA2D1	0	40
CSc1ccc(CSCC[C@H](C)O)cc1	ZINC000450934360	BG	On-Demand	Anodyne	LTA4H	27	44
CSc1ccc(CSCC[C@@H](C)O)cc1	ZINC000450934361	BG	On-Demand	Anodyne	CACNA2D1	0	40
CSc1ccc(CSCC[C@@H](C)O)cc1	ZINC000450934361	BG	On-Demand	Anodyne	LTA4H	27	44
CCOC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nc1	ZINC000450934365	FE	On-Demand	Anodyne	CASR	35	42
CCOc1ccc(C(C)=O)cc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450934370	FI	On-Demand	Anodyne	SSTR5	48	36
CCOc1ccc(C(C)=O)cc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450934370	FI	On-Demand	Anodyne	CCR8	34	42
FC1(c2ccccn2)CCN(Cc2ccc(Cl)s2)CC1	ZINC000450934374	DI	On-Demand	Anodyne	MGEA5	15	41
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	MME	67	40
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	ANPEP	79	35
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	FCER2	49	34
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	PAPA1_CARPA	49	41
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	CPA1	47	36
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	CAPNS1	48	36
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	CAPN1	49	38
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	CAPN2	44	37
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	ACE2	45	36
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	LAP3	42	39
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	POL	0	48
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	NPR	32	40
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934378	EF	On-Demand	Anodyne	BLAIMP-1	0	44
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	MME	67	40
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	ANPEP	79	35
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	FCER2	49	34
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	PAPA1_CARPA	49	41
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	CPA1	47	36
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	CAPNS1	48	36
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	CAPN1	49	38
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	CAPN2	44	37
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	ACE2	45	36
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	LAP3	42	39
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	POL	0	48
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	NPR	32	40
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934379	EF	On-Demand	Anodyne	BLAIMP-1	0	44
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	MME	67	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	ANPEP	79	35
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	FCER2	49	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	PAPA1_CARPA	49	41
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	CPA1	47	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	CAPNS1	48	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	CAPN1	49	38
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	CAPN2	44	37
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	ACE2	45	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	LAP3	42	39
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	POL	0	48
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	NPR	32	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934380	EF	On-Demand	Anodyne	BLAIMP-1	0	44
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	MME	67	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	ANPEP	79	35
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	FCER2	49	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	PAPA1_CARPA	49	41
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	CPA1	47	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	CAPNS1	48	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	CAPN1	49	38
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	CAPN2	44	37
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	ACE2	45	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	LAP3	42	39
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	POL	0	48
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	NPR	32	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000450934381	EF	On-Demand	Anodyne	BLAIMP-1	0	44
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	OPRM1	0	42
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	MME	60	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	ANPEP	77	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	PAPA1_CARPA	62	41
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	CAPNS1	47	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	MMP14	46	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	HLA-DRB1	44	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	FURIN	40	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	DNPEP	0	42
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	CAPN1	49	37
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	CAPN2	56	33
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	LAP3	38	42
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	POL	0	43
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	NPFFR1	49	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@@H](C)O	ZINC000450934383	CE	On-Demand	Anodyne	BLAIMP-1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	OPRM1	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	MME	60	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	ANPEP	77	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	PAPA1_CARPA	62	41
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	CAPNS1	47	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	MMP14	46	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	HLA-DRB1	44	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	FURIN	40	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	DNPEP	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	CAPN1	49	37
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	CAPN2	56	33
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	LAP3	38	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	POL	0	43
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	NPFFR1	49	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@@H](C)O	ZINC000450934384	CE	On-Demand	Anodyne	BLAIMP-1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	OPRM1	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	MME	60	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	ANPEP	77	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	PAPA1_CARPA	62	41
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	CAPNS1	47	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	MMP14	46	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	HLA-DRB1	44	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	FURIN	40	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	DNPEP	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	CAPN1	49	37
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	CAPN2	56	33
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	LAP3	38	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	POL	0	43
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	NPFFR1	49	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCC[C@H](C)O	ZINC000450934385	CE	On-Demand	Anodyne	BLAIMP-1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	OPRM1	0	42
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	MME	60	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	ANPEP	77	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	PAPA1_CARPA	62	41
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	CAPNS1	47	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	MMP14	46	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	HLA-DRB1	44	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	FURIN	40	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	DNPEP	0	42
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	CAPN1	49	37
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	CAPN2	56	33
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	LAP3	38	42
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	POL	0	43
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	NPFFR1	49	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCC[C@H](C)O	ZINC000450934386	CE	On-Demand	Anodyne	BLAIMP-1	0	40
COc1ccc(N2CCN(c3cc(C)ncn3)CC2)nc1	ZINC000450934390	CD	On-Demand	Anodyne	ADK	19	40
COCC[C@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450934394	EG	On-Demand	Anodyne	DRD4	43	33
COCC[C@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450934394	EG	On-Demand	Anodyne	COLA	77	36
COCC[C@H]1CCCCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450934394	EG	On-Demand	Anodyne	CPT1A	70	36
C=CCNC(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1	ZINC000450934401	FD	On-Demand	Mild	SLC6A7	0	42
COc1ccc(CNC(=O)CCN2CCC(C)=C(c3ccco3)C2)c(OC)c1	ZINC000450934405	GG	On-Demand	Anodyne	DRD4	40	32
COc1ccc(CNC(=O)CCN2CCC(C)=C(c3ccco3)C2)c(OC)c1	ZINC000450934405	GG	On-Demand	Anodyne	HTR7	25	40
COc1ccc(CNC(=O)CCN2CCC(C)=C(c3ccco3)C2)c(OC)c1	ZINC000450934405	GG	On-Demand	Anodyne	MTNR1A	40	37
C[C@H]1CN(c2ncc(C#N)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450934408	ED	On-Demand	Mild	LIMK2	62	34
C[C@H]1CN(c2ncc(C#N)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450934408	ED	On-Demand	Mild	SMO	0	43
CCO[C@@H]1CCCC[C@H]1Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450934431	FF	On-Demand	Anodyne	LRRK2	27	40
C[C@H]1CN(c2ccc(Cl)cc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450934432	EE	On-Demand	Mild	SLC6A7	0	48
COc1ccc(N2CCN(c3ccc(C#N)cc3Br)CC2)nc1	ZINC000450934443	FG	On-Demand	Mild	SMO	0	42
COc1ccc(N2CCN(c3ccc4nnc(-c5ccsc5)n4n3)CC2)nc1	ZINC000450934446	GF	On-Demand	Anodyne	LRRK2	26	40
COc1ccc(N2CCN(c3ccc4nnc(-c5ccsc5)n4n3)CC2)nc1	ZINC000450934446	GF	On-Demand	Anodyne	NPBWR1	71	40
COc1ccc(CNC(=O)CCSCCC(F)(F)F)c(OC)c1	ZINC000450934447	FG	On-Demand	Anodyne	MTNR1A	55	37
C=CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450934448	FD	On-Demand	Mild	DRD4	44	34
C=CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450934448	FD	On-Demand	Mild	DRD3	29	41
C=CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450934448	FD	On-Demand	Mild	HDAC1	26	46
CC(=O)c1cccc(CN2CCC(F)(c3cccnc3)CC2)c1	ZINC000450934457	DH	On-Demand	Anodyne	OPRK1	15	41
CC(=O)c1cccc(CN2CCC(F)(c3cccnc3)CC2)c1	ZINC000450934457	DH	On-Demand	Anodyne	CHRM3	18	42
CC(=O)c1cccc(CN2CCC(F)(c3cccnc3)CC2)c1	ZINC000450934457	DH	On-Demand	Anodyne	FAAH	23	41
CC(=O)c1cccc(CN2CCC(F)(c3cccnc3)CC2)c1	ZINC000450934457	DH	On-Demand	Anodyne	MCHR2	49	32
CC(=O)c1cccc(CN2CCC(F)(c3cccnc3)CC2)c1	ZINC000450934457	DH	On-Demand	Anodyne	CCR8	41	45
COC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nn1	ZINC000450934475	ED	On-Demand	Anodyne	CASR	49	38
CNS(=O)(=O)c1cccc2c1CCN(CCc1ccc(Cl)cc1)C2	ZINC000450934483	FF	On-Demand	Anodyne	DHCR7	0	44
CNS(=O)(=O)c1cccc2c1CCN(CCc1ccc(Cl)cc1)C2	ZINC000450934483	FF	On-Demand	Anodyne	NOD1	26	40
CCOc1cccc(CN(CCO)c2cc(C(F)(F)F)nc3ncnn23)c1	ZINC000450934489	GF	On-Demand	Anodyne	CETP	0	40
C[C@H]1CN(c2cccnc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450934491	DD	On-Demand	Mild	SLC6A7	0	47
O=C(CC[C@H]1CCCCO1)COc1ccc(C(F)(F)F)cc1F	ZINC000450934493	EI	On-Demand	Anodyne	PPARD	45	40
O=C(CC[C@@H]1CCCCO1)COc1ccc(C(F)(F)F)cc1F	ZINC000450934501	EI	On-Demand	Anodyne	PPARD	45	40
CCOc1cccc(CN(CCO)c2nc3ccccc3o2)c1	ZINC000450934509	DG	On-Demand	Anodyne	PPARA	23	57
COc1ccc(N2CCN(c3nn4cc(C)nc4s3)CC2)nc1	ZINC000450934510	ED	On-Demand	Anodyne	NPBWR1	41	37
O=C1CC[C@H](NCCc2ccc(Cl)cc2)C2(CCC2)N1	ZINC000450934518	CF	On-Demand	Anodyne	CACNA1D	36	41
CCc1nnc(N2CCN(c3ccc(OC)cn3)CC2)c(C#N)c1CC	ZINC000450934520	FE	On-Demand	Mild	SMO	24	42
O=C1CC[C@@H](NCCc2ccc(Cl)cc2)C2(CCC2)N1	ZINC000450934522	CF	On-Demand	Anodyne	CACNA1D	36	41
CN(CCN1CCc2ccc(S(C)(=O)=O)cc2CC1)Cc1ccccc1	ZINC000450934541	FF	On-Demand	Anodyne	SIGMAR1	27	46
CCCC[C@@H](SCCC(C)(F)F)C(=O)OC	ZINC000450934552	CG	On-Demand	Anodyne	EST1_PIG	46	33
CCCC[C@H](SCCC(C)(F)F)C(=O)OC	ZINC000450934554	CG	On-Demand	Anodyne	EST1_PIG	46	33
COc1cc(N2CCN(Cc3cccnc3N)CC2)ccc1F	ZINC000450934557	DE	On-Demand	Anodyne	DRD3	29	42
COC(=O)c1coc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450934565	FG	On-Demand	Anodyne	DRD2	46	39
COC(=O)c1coc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450934565	FG	On-Demand	Anodyne	HTR2A	43	44
COC(=O)c1coc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450934565	FG	On-Demand	Anodyne	HTR2C	40	43
COC(=O)c1coc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450934565	FG	On-Demand	Anodyne	SLC6A4	21	44
COC(=O)c1coc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450934565	FG	On-Demand	Anodyne	DRD3	56	37
COc1cc(OC[C@H](Cc2ccccc2)OC)ccc1[N+](=O)[O-]	ZINC000450934579	DG	On-Demand	Bother	PDS	42	37
COc1cc(OC[C@@H](Cc2ccccc2)OC)ccc1[N+](=O)[O-]	ZINC000450934580	DG	On-Demand	Bother	PDS	42	37
CCOC(=O)c1cccc(S[C@@H](C)C(=O)Nc2nccs2)c1	ZINC000450934581	EG	On-Demand	Anodyne	MAP	0	42
CCOC(=O)c1cccc(S[C@@H](C)C(=O)Nc2nccs2)c1	ZINC000450934581	EG	On-Demand	Anodyne	MAP1	109	42
CCOC(=O)c1cccc(S[C@H](C)C(=O)Nc2nccs2)c1	ZINC000450934594	EG	On-Demand	Anodyne	MAP	0	42
CCOC(=O)c1cccc(S[C@H](C)C(=O)Nc2nccs2)c1	ZINC000450934594	EG	On-Demand	Anodyne	MAP1	109	42
C[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450934599	FD	On-Demand	Bother	SLC6A7	0	41
Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCCC(=O)c1ccc(F)cc1	ZINC000450934604	FH	On-Demand	Anodyne	DRD4	0	48
Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCCC(=O)c1ccc(F)cc1	ZINC000450934604	FH	On-Demand	Anodyne	CYP2J2	45	32
CN(C)C(=O)CSc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-]	ZINC000450934606	ED	On-Demand	Bother	GSTM2	53	36
CO[C@@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934609	DH	On-Demand	Anodyne	PAPA1_CARPA	45	41
CO[C@@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934609	DH	On-Demand	Anodyne	CYSP_TRYCR	44	36
CO[C@@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934609	DH	On-Demand	Anodyne	CTSL	17	41
CO[C@@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934609	DH	On-Demand	Anodyne	REN	26	41
CO[C@@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934609	DH	On-Demand	Anodyne	FPR1	50	38
CO[C@@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934609	DH	On-Demand	Anodyne	CTRB_BOVIN	39	40
CO[C@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934611	DH	On-Demand	Anodyne	PAPA1_CARPA	45	41
CO[C@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934611	DH	On-Demand	Anodyne	CYSP_TRYCR	44	36
CO[C@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934611	DH	On-Demand	Anodyne	CTSL	17	41
CO[C@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934611	DH	On-Demand	Anodyne	REN	26	41
CO[C@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934611	DH	On-Demand	Anodyne	FPR1	50	38
CO[C@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934611	DH	On-Demand	Anodyne	CTRB_BOVIN	39	40
CO[C@@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934614	DH	On-Demand	Anodyne	PAPA1_CARPA	45	41
CO[C@@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934614	DH	On-Demand	Anodyne	CYSP_TRYCR	44	36
CO[C@@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934614	DH	On-Demand	Anodyne	CTSL	17	41
CO[C@@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934614	DH	On-Demand	Anodyne	REN	26	41
CO[C@@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934614	DH	On-Demand	Anodyne	FPR1	50	38
CO[C@@H](CS[C@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934614	DH	On-Demand	Anodyne	CTRB_BOVIN	39	40
CO[C@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934616	DH	On-Demand	Anodyne	PAPA1_CARPA	45	41
CO[C@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934616	DH	On-Demand	Anodyne	CYSP_TRYCR	44	36
CO[C@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934616	DH	On-Demand	Anodyne	REN	26	41
CO[C@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934616	DH	On-Demand	Anodyne	FPR1	41	38
CO[C@H](CS[C@@H](C)C(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450934616	DH	On-Demand	Anodyne	CTRB_BOVIN	39	40
CCOC(=O)c1ccc(CSc2nnc(C)n2-c2ccc(OC)cc2)nc1	ZINC000450934625	GG	On-Demand	Anodyne	WNT3A	25	47
CCOC(=O)c1ccc(CSc2nnc(C)n2-c2ccc(OC)cc2)nc1	ZINC000450934625	GG	On-Demand	Anodyne	TNKS2	18	48
CCC(=O)CCCN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450934643	DG	On-Demand	Anodyne	HTR1A	55	48
CCC(=O)CCCN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450934643	DG	On-Demand	Anodyne	DRD2	30	48
CCC(=O)CCCN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450934643	DG	On-Demand	Anodyne	DRD4	24	48
CCC(=O)CCCN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450934643	DG	On-Demand	Anodyne	HTR2A	41	55
CCC(=O)CCCN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450934643	DG	On-Demand	Anodyne	DRD3	30	55
CCC(=O)CCCN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000450934643	DG	On-Demand	Anodyne	HTR7	77	44
COC(=O)[C@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934653	GF	On-Demand	Anodyne	FOLH1	47	37
COC(=O)[C@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934653	GF	On-Demand	Anodyne	ANPEP	23	42
COC(=O)[C@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934653	GF	On-Demand	Anodyne	CASP3	22	40
COC(=O)[C@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934653	GF	On-Demand	Anodyne	CTSS	18	41
COC(=O)[C@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934653	GF	On-Demand	Anodyne	CASP1	17	40
COC(=O)[C@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934653	GF	On-Demand	Anodyne	CAPN2	27	40
COC(=O)[C@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934653	GF	On-Demand	Anodyne	CASP6	22	40
COC(=O)[C@@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934656	GF	On-Demand	Anodyne	FOLH1	47	37
COC(=O)[C@@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934656	GF	On-Demand	Anodyne	ANPEP	23	42
COC(=O)[C@@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934656	GF	On-Demand	Anodyne	CASP3	22	40
COC(=O)[C@@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934656	GF	On-Demand	Anodyne	CTSS	18	41
COC(=O)[C@@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934656	GF	On-Demand	Anodyne	CASP1	17	40
COC(=O)[C@@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934656	GF	On-Demand	Anodyne	CAPN2	27	40
COC(=O)[C@@H](CC(C)C)NC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450934656	GF	On-Demand	Anodyne	CASP6	22	40
Cc1cc(Br)cnc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450934662	GE	On-Demand	Anodyne	LIMK2	51	38
Cc1cc(Br)cnc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450934662	GE	On-Demand	Anodyne	SLC6A7	0	40
COc1cc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)ccc1Cl	ZINC000450934669	GG	On-Demand	Anodyne	AVPR1B	40	34
COc1cc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)ccc1Cl	ZINC000450934669	GG	On-Demand	Anodyne	SSTR5	43	36
COc1cc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)ccc1Cl	ZINC000450934669	GG	On-Demand	Anodyne	MLNR	23	42
COc1cc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)ccc1Cl	ZINC000450934669	GG	On-Demand	Anodyne	ABCB1	15	43
Cc1nc2c(Cl)cccc2c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1C	ZINC000450934671	GH	On-Demand	Anodyne	SMO	0	42
Cc1nc2c(Cl)cccc2c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1C	ZINC000450934671	GH	On-Demand	Anodyne	SLC6A7	0	43
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	HTR1A	84	59
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	DRD2	58	59
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	DRD1	17	42
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	DRD4	65	50
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	ADRA1D	18	42
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	HTR2A	53	59
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	ADRA1A	23	40
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	DRD3	45	50
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	DRD5	23	40
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	HTR7	81	45
FC1(c2ccccn2)CCN(CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000450934674	GH	On-Demand	Anodyne	SIGMAR1	30	49
Cc1cccc(CN(C)c2ncc(C(=O)N3CCOCC3)cc2Cl)n1	ZINC000450934694	FF	On-Demand	Anodyne	LRRK2	19	41
COC(=O)[C@@H](NC(=O)c1ccc(C2CC2)nc1C)c1ccc(O)cc1	ZINC000450934696	EF	On-Demand	Anodyne	TACR3	15	52
COC(=O)[C@H](NC(=O)c1ccc(C2CC2)nc1C)c1ccc(O)cc1	ZINC000450934698	EF	On-Demand	Anodyne	TACR3	15	52
COC(=O)[C@@H](NC(=O)c1cn2nccc2nc1C)c1cc(C)cc(C)c1	ZINC000450934699	FE	On-Demand	Anodyne	DDR1	40	39
CC(=O)CCCCCS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450934702	DE	On-Demand	Anodyne	THRB	26	40
CC(=O)CCCCCS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450934702	DE	On-Demand	Anodyne	PKM	32	43
COc1ccc(N2CCN(c3ccnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450934704	FG	On-Demand	Anodyne	PDE3A	42	35
COc1ccc(N2CCN(c3ccnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450934704	FG	On-Demand	Anodyne	FGFR2	43	36
COc1ccc(N2CCN(c3ccnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450934704	FG	On-Demand	Anodyne	KDR	53	36
COc1ccc(N2CCN(c3ccnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450934704	FG	On-Demand	Anodyne	PDE3B	62	35
COC(=O)[C@H](NC(=O)c1cn2nccc2nc1C)c1cc(C)cc(C)c1	ZINC000450934705	FE	On-Demand	Anodyne	DDR1	40	39
COC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1cc(C)cc(C)c1	ZINC000450934712	GG	On-Demand	Bother	CACNA1C	60	37
COC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1cc(C)cc(C)c1	ZINC000450934712	GG	On-Demand	Bother	CACNA1D	90	37
COC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1cc(C)cc(C)c1	ZINC000450934715	GG	On-Demand	Bother	CACNA1C	60	37
COC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1cc(C)cc(C)c1	ZINC000450934715	GG	On-Demand	Bother	CACNA1D	90	37
Cc1cccc(CN(C)c2ccnc(N3CCOCC3)n2)n1	ZINC000450934723	CD	On-Demand	Anodyne	EPHB4	75	38
CNC(=O)c1cccc(CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450934733	EF	On-Demand	Anodyne	MCHR2	40	35
CNC(=O)c1cccc(CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450934733	EF	On-Demand	Anodyne	NPFFR1	40	34
C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450934751	GJ	On-Demand	Anodyne	SLC6A9	33	43
C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450934751	GJ	On-Demand	Anodyne	PANK3	0	46
COc1ccc(-n2c(C)nnc2SCc2cc(C(C)(C)C)on2)cc1	ZINC000450934759	FI	On-Demand	Anodyne	AXIN2	0	61
C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450934760	GJ	On-Demand	Anodyne	SLC6A9	33	43
C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)N1CCC(F)(c2ccccn2)CC1	ZINC000450934760	GJ	On-Demand	Anodyne	PANK3	0	46
Cc1ccc(Br)cc1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450934770	GH	On-Demand	Anodyne	DRD4	15	49
Cc1ccc(Br)cc1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450934770	GH	On-Demand	Anodyne	DRD3	0	49
Cc1ccc(Br)cc1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450934770	GH	On-Demand	Anodyne	CCR3	30	41
Cc1ccc(Br)cc1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450934773	GH	On-Demand	Anodyne	DRD4	15	49
Cc1ccc(Br)cc1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450934773	GH	On-Demand	Anodyne	DRD3	0	49
Cc1ccc(Br)cc1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450934773	GH	On-Demand	Anodyne	CCR3	30	41
CCc1cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)nc(C)n1	ZINC000450934778	EF	On-Demand	Anodyne	SLC6A1	66	44
CCc1cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)nc(C)n1	ZINC000450934778	EF	On-Demand	Anodyne	SLC6A3	22	48
COc1cc2nc(N(C)Cc3cccc(C)n3)nc(N)c2cc1OC	ZINC000450934780	EE	On-Demand	Anodyne	DHFR	22	40
COc1cc2nc(N(C)Cc3cccc(C)n3)nc(N)c2cc1OC	ZINC000450934780	EE	On-Demand	Anodyne	ADRA1D	19	51
COc1cc2nc(N(C)Cc3cccc(C)n3)nc(N)c2cc1OC	ZINC000450934780	EE	On-Demand	Anodyne	ADRA1B	45	51
COc1cc2nc(N(C)Cc3cccc(C)n3)nc(N)c2cc1OC	ZINC000450934780	EE	On-Demand	Anodyne	DRTS_TOXGO	28	40
COc1cc2nc(N(C)Cc3cccc(C)n3)nc(N)c2cc1OC	ZINC000450934780	EE	On-Demand	Anodyne	DYR_PNECA	32	40
COc1cc2nc(N(C)Cc3cccc(C)n3)nc(N)c2cc1OC	ZINC000450934780	EE	On-Demand	Anodyne	PDPK1	51	37
CC[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)C(=O)NC	ZINC000450934782	DE	On-Demand	Bother	COLA	73	31
CC[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)C(=O)NC	ZINC000450934784	DE	On-Demand	Bother	COLA	73	31
CCCCNc1cc(N2CCN(c3ccc(OC)cn3)CC2)nc(N)n1	ZINC000450934789	FD	On-Demand	Anodyne	HRH4	39	58
CCCCNc1cc(N2CCN(c3ccc(OC)cn3)CC2)nc(N)n1	ZINC000450934789	FD	On-Demand	Anodyne	GALR2	42	34
CC[C@@H](Nc1cnc2ccccc2n1)C(=O)NC	ZINC000450934790	BD	On-Demand	Anodyne	CCR1	24	46
CC[C@@H](Nc1cnc2ccccc2n1)C(=O)NC	ZINC000450934790	BD	On-Demand	Anodyne	RHOA	0	42
CC[C@H](Nc1cnc2ccccc2n1)C(=O)NC	ZINC000450934791	BD	On-Demand	Anodyne	CCR1	24	46
CC[C@H](Nc1cnc2ccccc2n1)C(=O)NC	ZINC000450934791	BD	On-Demand	Anodyne	RHOA	0	42
O[C@@H](Cc1ccc2ccccc2c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450934808	FI	On-Demand	Anodyne	VACHT_TETCF	0	54
O[C@@H](Cc1ccc2ccccc2c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450934808	FI	On-Demand	Anodyne	SLC18A3	23	42
COCCOC[C@H](O)CN1CC[C@@](F)(c2cccc(Cl)c2)C1	ZINC000450934809	EE	On-Demand	Anodyne	HSP90AB1	34	42
COCCOC[C@@H](O)CN1CC[C@@](F)(c2cccc(Cl)c2)C1	ZINC000450934811	EE	On-Demand	Anodyne	HSP90AB1	34	42
COCCOC[C@H](O)CN1CC[C@](F)(c2cccc(Cl)c2)C1	ZINC000450934813	EE	On-Demand	Anodyne	HSP90AB1	34	42
COCCOC[C@@H](O)CN1CC[C@](F)(c2cccc(Cl)c2)C1	ZINC000450934815	EE	On-Demand	Anodyne	HSP90AB1	34	42
CCO[C@@H]1CCC[C@H]1Nc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450934821	FF	On-Demand	Anodyne	LRRK2	27	40
O[C@H](Cc1ccc2ccccc2c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450934829	FI	On-Demand	Anodyne	VACHT_TETCF	0	54
O[C@H](Cc1ccc2ccccc2c1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450934829	FI	On-Demand	Anodyne	SLC18A3	23	42
COC(=O)[C@@H]1CN(c2nc(C)cc(OC)n2)C[C@H]1c1ccccc1	ZINC000450934844	EE	On-Demand	Anodyne	ALS	42	30
CCOc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934860	FG	On-Demand	Anodyne	DRD4	0	44
CCOc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934860	FG	On-Demand	Anodyne	LTA4H	24	40
CCOc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934860	FG	On-Demand	Anodyne	PRNP	52	39
CCOc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934860	FG	On-Demand	Anodyne	NOD2	31	41
CSc1ccc2ncnc(N3C[C@H](C)C[C@@H](O)C3)c2c1	ZINC000450934875	CF	On-Demand	Anodyne	PDE3A	42	32
CSc1ccc2ncnc(N3C[C@@H](O)C[C@@H](C)C3)c2c1	ZINC000450934876	CF	On-Demand	Anodyne	PDE3A	42	32
CSc1ccc2ncnc(N3C[C@@H](C)C[C@H](O)C3)c2c1	ZINC000450934877	CF	On-Demand	Anodyne	PDE3A	42	32
CNC(=O)N[C@@H]1CCN(C(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450934900	FF	On-Demand	Anodyne	EPHX2	27	44
CNC(=O)N[C@H]1CCN(C(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450934903	FF	On-Demand	Anodyne	EPHX2	27	44
C[C@H]1C[C@H](O)CN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450934910	CD	On-Demand	Anodyne	AADAT	15	40
C[C@@H]1C[C@@H](O)CN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450934911	CD	On-Demand	Anodyne	AADAT	15	40
C[C@H]1C[C@@H](O)CN(c2cnn(Cc3ccccc3)c(=O)c2)C1	ZINC000450934913	CD	On-Demand	Anodyne	AADAT	15	40
COC(=O)[C@H]1CN(c2nc(C)nc3c2CCCC3)C[C@@H]1c1ccccc1	ZINC000450934926	FG	On-Demand	Anodyne	SLC6A1	26	40
COC(=O)[C@H]1CN(c2nc(C)nc3c2CCCC3)C[C@H]1c1ccccc1	ZINC000450934927	FG	On-Demand	Anodyne	SLC6A1	26	40
COC(=O)[C@@H]1CN(c2nc(C)nc3c2CCCC3)C[C@H]1c1ccccc1	ZINC000450934928	FG	On-Demand	Anodyne	SLC6A1	26	40
COc1ccc(CNC(=O)CCN2CCOc3cccc(F)c3C2)c(OC)c1	ZINC000450934940	GF	On-Demand	Anodyne	DRD4	43	34
COc1ccc(CNC(=O)CCN2CCOc3cccc(F)c3C2)c(OC)c1	ZINC000450934940	GF	On-Demand	Anodyne	HTR7	23	40
COCc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934975	DH	On-Demand	Anodyne	SIGMAR1	49	42
COCc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450934975	DH	On-Demand	Anodyne	PRCP	0	41
CC(C)N1CCC[C@@H](NC(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450934976	CE	On-Demand	Anodyne	BIRC2	42	38
CC(C)N1CCC[C@H](NC(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450934977	CE	On-Demand	Anodyne	BIRC2	42	38
C/C=C\COc1cccc(CC(=O)N[C@@H]2CCCN(C(C)C)C2)c1	ZINC000450934985	EG	On-Demand	Anodyne	BIRC2	39	40
C/C=C/COc1cccc(CC(=O)N[C@@H]2CCCN(C(C)C)C2)c1	ZINC000450934986	EG	On-Demand	Anodyne	BIRC2	39	40
C/C=C/COc1cccc(CC(=O)N[C@H]2CCCN(C(C)C)C2)c1	ZINC000450934987	EG	On-Demand	Anodyne	BIRC2	39	40
C/C=C\COc1cccc(CC(=O)N[C@H]2CCCN(C(C)C)C2)c1	ZINC000450934988	EG	On-Demand	Anodyne	BIRC2	39	40
COc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3F)CC2)nc1	ZINC000450934994	FD	On-Demand	Anodyne	PTGS2	32	41
COc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3F)CC2)nc1	ZINC000450934994	FD	On-Demand	Anodyne	SLC6A9	34	48
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	DRD2	35	51
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	DRD1	25	54
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	HTR2A	36	58
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	HTR2C	27	67
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	ERG2	25	51
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	SIGMAR1	23	54
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	CCR3	44	43
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	HTR3B	0	51
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	CYP2J2	67	47
O=C(CCCN1CCC(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000450934996	EI	On-Demand	Anodyne	AP2S1	0	51
C[C@H]1C[C@@H](O)CN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000450935066	EF	On-Demand	Anodyne	ROS1	37	47
C[C@H]1C[C@H](O)CN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000450935068	EF	On-Demand	Anodyne	ROS1	37	47
C[C@@H]1C[C@@H](O)CN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000450935070	EF	On-Demand	Anodyne	ROS1	37	47
COC(=O)c1ccccc1OCCN1CCC(F)(c2ccccn2)CC1	ZINC000450935074	FG	On-Demand	Anodyne	DRD2	17	40
COC(=O)c1ccccc1OCCN1CCC(F)(c2ccccn2)CC1	ZINC000450935074	FG	On-Demand	Anodyne	HRH1	17	40
COC(=O)c1ccccc1OCCN1CCC(F)(c2ccccn2)CC1	ZINC000450935074	FG	On-Demand	Anodyne	HTR7	22	41
COC(=O)c1ccccc1OCCN1CCC(F)(c2ccccn2)CC1	ZINC000450935074	FG	On-Demand	Anodyne	ABCB1	0	41
COC(=O)c1ccccc1OCCN1CCC(F)(c2ccccn2)CC1	ZINC000450935074	FG	On-Demand	Anodyne	HCN1	56	34
COC(=O)c1ccccc1OCCN1CCC(F)(c2ccccn2)CC1	ZINC000450935074	FG	On-Demand	Anodyne	HCN4	49	33
CCNC(=O)C[C@@H]1CCCCN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450935081	FG	On-Demand	Anodyne	DRD2	46	39
CCNC(=O)C[C@@H]1CCCCN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450935081	FG	On-Demand	Anodyne	OPRK1	28	43
CCNC(=O)C[C@H]1CCCCN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450935083	FG	On-Demand	Anodyne	DRD2	46	39
CCNC(=O)C[C@H]1CCCCN1Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450935083	FG	On-Demand	Anodyne	OPRK1	28	43
COC(=O)[C@@H](NC(=O)CCCC(C)C)c1ccc(O)cc1	ZINC000450935084	CF	On-Demand	Anodyne	FOLH1	46	34
COC(=O)[C@@H](NC(=O)CCCC(C)C)c1ccc(O)cc1	ZINC000450935084	CF	On-Demand	Anodyne	HDA106	0	43
COC(=O)[C@H](NC(=O)CCCC(C)C)c1ccc(O)cc1	ZINC000450935085	CF	On-Demand	Anodyne	FOLH1	46	34
COC(=O)[C@H](NC(=O)CCCC(C)C)c1ccc(O)cc1	ZINC000450935085	CF	On-Demand	Anodyne	HDA106	0	43
Cc1ccc(NC(=O)[C@H](C)N2CCC(F)(c3ccccn3)CC2)c(F)c1	ZINC000450935086	FH	On-Demand	Anodyne	PRNP	21	41
Cc1ccc(NC(=O)[C@@H](C)N2CCC(F)(c3ccccn3)CC2)c(F)c1	ZINC000450935088	FH	On-Demand	Anodyne	PRNP	21	41
O[C@H](COc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935102	FG	On-Demand	Anodyne	ACOX1	73	34
O[C@H](COc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935102	FG	On-Demand	Anodyne	CYP2D6	22	44
O[C@H](COc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935102	FG	On-Demand	Anodyne	ABCB1	55	41
O[C@H](COc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935102	FG	On-Demand	Anodyne	HSP90AB1	33	43
O[C@@H](COc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935105	FG	On-Demand	Anodyne	ACOX1	73	34
O[C@@H](COc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935105	FG	On-Demand	Anodyne	CYP2D6	22	44
O[C@@H](COc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935105	FG	On-Demand	Anodyne	ABCB1	55	41
O[C@@H](COc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935105	FG	On-Demand	Anodyne	HSP90AB1	33	43
N#Cc1cc(N(CCN2CCOCC2)Cc2ccco2)nc2ccccc12	ZINC000450935110	FG	On-Demand	Mild	MAP2K1	26	41
CC[C@H](Nc1ncnc2ccc(I)cc12)C(=O)NC	ZINC000450935123	FE	On-Demand	Anodyne	EGFR	45	42
CC[C@H](Nc1ncnc2ccc(I)cc12)C(=O)NC	ZINC000450935123	FE	On-Demand	Anodyne	CD38	53	37
CC[C@@H](Nc1ncnc2ccc(I)cc12)C(=O)NC	ZINC000450935125	FE	On-Demand	Anodyne	EGFR	45	42
CC[C@@H](Nc1ncnc2ccc(I)cc12)C(=O)NC	ZINC000450935125	FE	On-Demand	Anodyne	CD38	53	37
CCOC(=O)CCCCCSc1nc2c(C)ccnc2[nH]1	ZINC000450935143	DG	On-Demand	Anodyne	HDA106	0	43
CCOC(=O)CCCCCSc1nc2c(C)ccnc2[nH]1	ZINC000450935143	DG	On-Demand	Anodyne	ENPP1	42	34
CCOc1cccc(CN(CCO)c2nc(C)cc(C(F)(F)F)n2)c1	ZINC000450935149	FG	On-Demand	Anodyne	CETP	0	43
COc1ccc(N2CCN(c3cc(C)nc(-c4cccnc4)n3)CC2)nc1	ZINC000450935172	FF	On-Demand	Anodyne	CYP11B1	26	42
COc1ccc(N2CCN(c3cc(C)nc(-c4cccnc4)n3)CC2)nc1	ZINC000450935172	FF	On-Demand	Anodyne	CYP11B2	41	43
COc1ccc(N2CCN(c3cc(C)nc(-c4cccnc4)n3)CC2)nc1	ZINC000450935172	FF	On-Demand	Anodyne	GALR2	41	33
COc1ccc(N2CCN(c3cc(C)nc(-c4cccnc4)n3)CC2)nc1	ZINC000450935172	FF	On-Demand	Anodyne	ROS1	51	47
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450935183	GG	On-Demand	Anodyne	DRD1	0	40
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)cc1	ZINC000450935183	GG	On-Demand	Anodyne	DRD4	32	40
Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450935186	GJ	On-Demand	Anodyne	ACAT	0	44
CC[C@@H](Nc1nc2cc(C(F)(F)F)ccc2s1)C(=O)NC	ZINC000450935192	DF	On-Demand	Anodyne	CSNK1D	41	45
Cc1cccc(C(C)C)c1NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450935193	GJ	On-Demand	Anodyne	ACAT	0	44
CC[C@H](Nc1nc2cc(C(F)(F)F)ccc2s1)C(=O)NC	ZINC000450935194	DF	On-Demand	Anodyne	CSNK1D	41	45
FC(F)Oc1ccccc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450935196	EI	On-Demand	Anodyne	CCR8	18	41
CS(=O)(=O)c1ccc2c(c1)CCN(CCc1ccc(Cl)cc1)CC2	ZINC000450935199	FG	On-Demand	Anodyne	SIGMAR1	19	41
CS(=O)(=O)c1ccc2c(c1)CCN(CCc1ccc(Cl)cc1)CC2	ZINC000450935199	FG	On-Demand	Anodyne	PNMT	15	42
CS(=O)(=O)c1ccc2c(c1)CCN(CCc1ccc(Cl)cc1)CC2	ZINC000450935199	FG	On-Demand	Anodyne	MLNR	25	44
CS(=O)(=O)c1ccc2c(c1)CCN(CCc1ccc(Cl)cc1)CC2	ZINC000450935199	FG	On-Demand	Anodyne	DHCR7	0	48
CS(=O)(=O)c1ccc2c(c1)CCN(CCc1ccc(Cl)cc1)CC2	ZINC000450935199	FG	On-Demand	Anodyne	KCNJ1	47	37
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(=O)NC	ZINC000450935201	ED	On-Demand	Anodyne	TGM2	50	41
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(=O)NC	ZINC000450935201	ED	On-Demand	Anodyne	F13A1	43	38
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(=O)NC	ZINC000450935201	ED	On-Demand	Anodyne	NAMPT	31	43
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(=O)NC	ZINC000450935203	ED	On-Demand	Anodyne	TGM2	50	41
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(=O)NC	ZINC000450935203	ED	On-Demand	Anodyne	F13A1	43	38
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cn1)C(=O)NC	ZINC000450935203	ED	On-Demand	Anodyne	NAMPT	31	43
CCOC(=O)c1c(Cn2cnc3snc(C)c3c2=O)nc2ccccc2c1C	ZINC000450935239	GG	On-Demand	Anodyne	TSPO	15	41
COC(=O)c1csc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)n1	ZINC000450935244	FE	On-Demand	Anodyne	ANPEP	43	32
COC(=O)c1csc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)n1	ZINC000450935246	FE	On-Demand	Anodyne	ANPEP	43	32
COC(=O)c1csc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)n1	ZINC000450935247	FE	On-Demand	Anodyne	ANPEP	43	32
COC(=O)c1csc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)n1	ZINC000450935248	FE	On-Demand	Anodyne	ANPEP	43	32
COC(=O)c1ccc(CN2CCC[C@@H]2[C@@H]2CCCO2)cc1Cl	ZINC000450935250	DG	On-Demand	Anodyne	OPRK1	20	40
COC(=O)c1ccc(CN2CCC[C@H]2[C@@H]2CCCO2)cc1Cl	ZINC000450935251	DG	On-Demand	Anodyne	OPRK1	20	40
COC(=O)c1ccc(CN2CCC[C@@H]2[C@H]2CCCO2)cc1Cl	ZINC000450935252	DG	On-Demand	Anodyne	OPRK1	20	40
COC(=O)c1ccc(CN2CCC[C@H]2[C@H]2CCCO2)cc1Cl	ZINC000450935253	DG	On-Demand	Anodyne	OPRK1	20	40
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450935256	FH	On-Demand	Anodyne	TPP2	52	34
C[C@H](C(=O)N1c2ccccc2C[C@H]1C)N1CCC(F)(c2ccccn2)CC1	ZINC000450935259	FH	On-Demand	Anodyne	TPP2	52	34
C[C@@H](C(=O)N1c2ccccc2C[C@@H]1C)N1CCC(F)(c2ccccn2)CC1	ZINC000450935263	FH	On-Demand	Anodyne	TPP2	52	34
C[C@@H](C(=O)N1c2ccccc2C[C@H]1C)N1CCC(F)(c2ccccn2)CC1	ZINC000450935265	FH	On-Demand	Anodyne	TPP2	52	34
COC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nn1	ZINC000450935267	EC	On-Demand	Anodyne	SCD1	43	39
COC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nn1	ZINC000450935267	EC	On-Demand	Anodyne	NPBWR1	46	37
C[C@@H](SCc1ccc(C(F)(F)F)cc1)C(=O)Nc1nccs1	ZINC000450935268	EI	On-Demand	Anodyne	MAP1	119	39
C[C@@H](SCc1ccc(C(F)(F)F)cc1)C(=O)Nc1nccs1	ZINC000450935268	EI	On-Demand	Anodyne	GCK	20	45
COc1cc(CC(=O)N2CCN(c3cncc4ncnn34)CC2)ccc1Cl	ZINC000450935269	GD	On-Demand	Anodyne	CCR1	24	44
C[C@H](SCc1ccc(C(F)(F)F)cc1)C(=O)Nc1nccs1	ZINC000450935274	EI	On-Demand	Anodyne	MAP1	119	39
C[C@H](SCc1ccc(C(F)(F)F)cc1)C(=O)Nc1nccs1	ZINC000450935274	EI	On-Demand	Anodyne	GCK	20	45
O=C(COc1ccc(C(F)(F)F)cc1F)C1CCC(F)(F)CC1	ZINC000450935275	EJ	On-Demand	Anodyne	PPARD	40	36
O=C(COc1ccc(C(F)(F)F)cc1F)C1CCC(F)(F)CC1	ZINC000450935275	EJ	On-Demand	Anodyne	LIPG	43	35
O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935295	GI	On-Demand	Anodyne	F8	0	48
O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935295	GI	On-Demand	Anodyne	CCR1	49	43
O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935295	GI	On-Demand	Anodyne	ABCB1	62	43
O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935297	GI	On-Demand	Anodyne	F8	0	48
O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935297	GI	On-Demand	Anodyne	CCR1	49	43
O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935297	GI	On-Demand	Anodyne	ABCB1	62	43
COC(=O)c1cnc(N(C)C2CCN(CC(F)(F)F)CC2)nc1	ZINC000450935302	ED	On-Demand	Anodyne	HPGDS	39	46
C[C@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CCN1C(=O)c1cnn(C)c1	ZINC000450935305	FE	On-Demand	Bother	SLC6A7	0	43
Cc1ccnc2[nH]c(SCC(=O)N(C)CCOc3ccccc3F)nc12	ZINC000450935352	FG	On-Demand	Anodyne	ENPP1	51	33
Cc1ccc2nccc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450935360	EF	On-Demand	Anodyne	HCRTR1	68	39
Cc1ccc2nccc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450935360	EF	On-Demand	Anodyne	HCRTR2	43	39
Cc1ccc2nccc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450935360	EF	On-Demand	Anodyne	SLC6A7	0	41
COc1cc(OC)c2ncc(C#N)c(SCC(=O)N(C)C)c2c1	ZINC000450935361	EE	On-Demand	Mild	HSP90AB1	52	42
CS(=O)(=O)c1cccc(CSCc2ccc(C(F)(F)F)cc2)c1	ZINC000450935362	FJ	On-Demand	Anodyne	PTGS2	17	41
CS(=O)(=O)c1cccc(CSCc2ccc(C(F)(F)F)cc2)c1	ZINC000450935362	FJ	On-Demand	Anodyne	CACNA1B	47	33
CS(=O)(=O)c1cccc(CSCc2ccc(C(F)(F)F)cc2)c1	ZINC000450935362	FJ	On-Demand	Anodyne	NR1H3	41	36
C[C@H]1CN(c2cccc(C#N)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450935364	DD	On-Demand	Mild	SLC6A7	0	41
COC[C@H]1CCCCN1c1nc2cc(F)ccc2o1	ZINC000450935371	CF	On-Demand	Anodyne	HTR3A	0	56
COC[C@@H]1CCCCN1c1nc2cc(F)ccc2o1	ZINC000450935373	CF	On-Demand	Anodyne	HTR3A	0	56
O=S(=O)(C1CC1)N1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC000450935377	EE	On-Demand	Anodyne	L3MBTL3	32	44
CCOC(=O)c1ccc(CN2CCN(c3ccc(F)c(OC)c3)CC2)nc1	ZINC000450935380	FF	On-Demand	Anodyne	DRD1	0	40
CCOC(=O)c1ccc(CN2CCN(c3ccc(F)c(OC)c3)CC2)nc1	ZINC000450935380	FF	On-Demand	Anodyne	P2RY12	31	41
C[C@H]1CN(c2ncccc2Br)CCN1C(=O)c1cnn(C)c1	ZINC000450935383	FD	On-Demand	Anodyne	LIMK2	42	35
C[C@H]1CN(c2ncccc2Br)CCN1C(=O)c1cnn(C)c1	ZINC000450935383	FD	On-Demand	Anodyne	SMO	0	48
C[C@H]1CN(c2ncccc2Br)CCN1C(=O)c1cnn(C)c1	ZINC000450935383	FD	On-Demand	Anodyne	SLC6A7	0	50
COc1ccc(-n2c(C)nnc2SCC(=O)CC(C)(C)C2CC2)cc1	ZINC000450935384	FI	On-Demand	Anodyne	WNT3A	22	45
COc1ccc(-n2c(C)nnc2SCC(=O)CC(C)(C)C2CC2)cc1	ZINC000450935384	FI	On-Demand	Anodyne	AXIN2	0	49
Cc1ccc(CN(C)c2ncc(C(=O)N3CCOCC3)cc2Cl)cc1C	ZINC000450935393	FG	On-Demand	Anodyne	LRRK2	23	41
Cc1ccnc2[nH]c(SCC(=O)NCCOc3ccc4c(c3)OCO4)nc12	ZINC000450935403	GE	On-Demand	Anodyne	NOS2	66	31
Cc1ccnc2[nH]c(SCC(=O)NCCOc3ccc4c(c3)OCO4)nc12	ZINC000450935403	GE	On-Demand	Anodyne	ENPP1	73	50
CC(C)C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450935406	CG	On-Demand	Anodyne	PTGDR2	22	46
Cc1ccc(CN(C)c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1C	ZINC000450935420	EE	On-Demand	Bother	CA2	27	41
CC(C)c1nccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450935429	ED	On-Demand	Anodyne	SORD	105	45
COc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450935431	DC	On-Demand	Anodyne	HCRTR1	41	36
COc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450935431	DC	On-Demand	Anodyne	SORD	47	35
COc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450935431	DC	On-Demand	Anodyne	SLC6A7	0	50
CN(c1ncnc2[nH]ccc12)C1CCN(CC(F)(F)F)CC1	ZINC000450935440	DE	On-Demand	Anodyne	JAK3	33	66
CN(c1ncnc2[nH]ccc12)C1CCN(CC(F)(F)F)CC1	ZINC000450935440	DE	On-Demand	Anodyne	JAK1	30	46
COc1ccc(CNC(=O)CCN[C@H](C)c2ccncc2F)c(OC)c1	ZINC000450935445	FF	On-Demand	Anodyne	MTNR1A	45	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccncc2F)c(OC)c1	ZINC000450935446	FF	On-Demand	Anodyne	MTNR1A	45	38
CCO[C@@H]1CCC[C@H]1Nc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450935466	EG	On-Demand	Anodyne	TNKS	62	35
CCO[C@@H]1CCC[C@H]1Nc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450935482	FF	On-Demand	Anodyne	TGM2	30	40
COC(=O)[C@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)C[C@@H]1c1ccccc1	ZINC000450935494	EF	On-Demand	Bother	SLC6A1	35	41
COC(=O)[C@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)C[C@H]1c1ccccc1	ZINC000450935495	EF	On-Demand	Bother	SLC6A1	35	41
COC(=O)[C@H]1CN(c2nc(C(C)C)nc(N(C)C)n2)C[C@@H]1c1ccccc1	ZINC000450935496	FE	On-Demand	Anodyne	SLC6A1	31	40
COC(=O)[C@H]1CN(c2nc(C(C)C)nc(N(C)C)n2)C[C@@H]1c1ccccc1	ZINC000450935496	FE	On-Demand	Anodyne	SLC6A3	20	45
COC(=O)[C@H]1CN(c2nc(C(C)C)nc(N(C)C)n2)C[C@H]1c1ccccc1	ZINC000450935497	FE	On-Demand	Anodyne	SLC6A1	31	40
COC(=O)[C@H]1CN(c2nc(C(C)C)nc(N(C)C)n2)C[C@H]1c1ccccc1	ZINC000450935497	FE	On-Demand	Anodyne	SLC6A3	20	45
COC(=O)[C@@H]1CN(c2nc(C(C)C)nc(N(C)C)n2)C[C@H]1c1ccccc1	ZINC000450935498	FE	On-Demand	Anodyne	SLC6A1	31	40
COC(=O)[C@@H]1CN(c2nc(C(C)C)nc(N(C)C)n2)C[C@H]1c1ccccc1	ZINC000450935498	FE	On-Demand	Anodyne	SLC6A3	20	45
CCc1cc(CCCN2CCC(N3CCc4cc(F)ccc43)CC2)on1	ZINC000450935499	FH	On-Demand	Anodyne	SCD	29	42
Fc1ccc2c(c1)CCN2C1CCN(C[C@H]2COCCO2)CC1	ZINC000450935518	DE	On-Demand	Anodyne	SCD	28	40
Fc1ccc2c(c1)CCN2C1CCN(C[C@@H]2COCCO2)CC1	ZINC000450935519	DE	On-Demand	Anodyne	SCD	28	40
COC(=O)[C@H]1CN(c2nnc(C)c(C)c2C#N)C[C@H]1c1ccccc1	ZINC000450935520	EE	On-Demand	Mild	SLC6A1	48	40
COC(=O)[C@H]1CN(c2nnc(C)c(C)c2C#N)C[C@@H]1c1ccccc1	ZINC000450935521	EE	On-Demand	Mild	SLC6A1	48	40
O=C(NC[C@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccco1	ZINC000450935522	DF	On-Demand	Anodyne	CCR3	41	34
O=C(NC[C@@H]1CCCN(CC2CC(F)(F)C2)C1)c1ccco1	ZINC000450935523	DF	On-Demand	Anodyne	CCR3	41	34
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2CC/C=C\c2ccccc2)O1	ZINC000450935524	EG	On-Demand	Anodyne	SLC6A1	33	42
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2CC/C=C/c2ccccc2)O1	ZINC000450935525	EG	On-Demand	Anodyne	SLC6A1	33	42
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2CC/C=C\c2ccccc2)O1	ZINC000450935526	EG	On-Demand	Anodyne	SLC6A1	33	42
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2CC/C=C/c2ccccc2)O1	ZINC000450935527	EG	On-Demand	Anodyne	SLC6A1	33	42
O=C(CCCN1C[C@H]2COC[C@@H](C1)O2)c1ccccc1	ZINC000450935539	CD	On-Demand	Anodyne	CYP2J2	63	45
O=C(CN1CCC(F)(c2ccccn2)CC1)NC12CC3CC(CC(C3)C1)C2	ZINC000450935557	FG	On-Demand	Anodyne	EPHX2	59	44
O=C(CN1CCC(F)(c2ccccn2)CC1)NC12CC3CC(CC(C3)C1)C2	ZINC000450935557	FG	On-Demand	Anodyne	SRTA	0	45
COC(=O)c1ccoc1COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450935560	EH	On-Demand	Anodyne	KCNA3	48	38
COc1ccccc1CCNC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450935563	GH	On-Demand	Anodyne	MTNR1A	60	38
COc1ccccc1CCNC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450935563	GH	On-Demand	Anodyne	MTNR1B	46	38
COc1ccccc1CCNC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450935563	GH	On-Demand	Anodyne	KCNK3	50	40
COc1ccccc1CCNC(=O)COc1c(C(C)=O)cccc1C(F)(F)F	ZINC000450935563	GH	On-Demand	Anodyne	KCNK9	37	40
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	HTR1A	17	46
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	THRA	0	41
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	DRD2	34	48
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	DRD1	21	46
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	DRD4	20	46
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	ADRA1D	30	46
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	ADRA1A	32	46
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	ADRA1B	31	46
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	DRD3	22	46
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	ADRA2B	15	46
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	ADRA2C	16	43
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	ERG2	20	43
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	HTR7	28	49
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	SIGMAR1	22	43
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	KCNA3	0	41
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	SLC18A3	26	48
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	CYP2J2	62	44
COCC1(C#N)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450935568	DF	On-Demand	Mild	AP2S1	0	43
COC(=O)c1ccc(C)c(NC(=O)CSC2CC2)c1O	ZINC000450935571	CE	On-Demand	Anodyne	FAS	44	36
COCC1(C#N)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450935572	EF	On-Demand	Mild	SIGMAR1	29	42
CC(=O)c1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450935580	FG	On-Demand	Anodyne	PRNP	67	40
O[C@@H](Cc1ccc(C(F)(F)F)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935584	GH	On-Demand	Anodyne	SLC18A3	0	44
O[C@H](Cc1ccc(C(F)(F)F)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935585	GH	On-Demand	Anodyne	SLC18A3	0	44
CCCOc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)c(OC)c1	ZINC000450935587	EG	On-Demand	Anodyne	DRD2	41	36
CCCOc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)c(OC)c1	ZINC000450935587	EG	On-Demand	Anodyne	DRD3	24	44
CCCOc1ccc(C(=O)N[C@H]2CCCN(C(C)C)C2)c(OC)c1	ZINC000450935587	EG	On-Demand	Anodyne	HTR4	48	41
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)c(OC)c1	ZINC000450935588	EG	On-Demand	Anodyne	DRD2	41	36
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)c(OC)c1	ZINC000450935588	EG	On-Demand	Anodyne	DRD3	24	44
CCCOc1ccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)c(OC)c1	ZINC000450935588	EG	On-Demand	Anodyne	HTR4	48	41
COC(=O)c1cnc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450935589	EC	On-Demand	Anodyne	DRD4	40	30
COC(=O)c1cnc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450935589	EC	On-Demand	Anodyne	NPBWR1	46	36
COC(=O)c1cnc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450935589	EC	On-Demand	Anodyne	SLC6A7	0	44
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cc(F)cc(F)c1	ZINC000450935590	EG	On-Demand	Anodyne	CACNA1H	31	41
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cc(F)cc(F)c1	ZINC000450935590	EG	On-Demand	Anodyne	DRD4	0	45
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1cc(F)cc(F)c1	ZINC000450935590	EG	On-Demand	Anodyne	CALCRL	40	37
Clc1ccc(CCN2CCC3(CCOCC3)CC2)cc1	ZINC000450935600	CH	On-Demand	Anodyne	SIGMAR1	26	43
COC(=O)c1ccc(C)c(NC(=O)CCOc2cccc(OC)c2)c1O	ZINC000450935622	FF	On-Demand	Anodyne	MTNR1A	36	47
Cc1cc(N2CCCC2)ccc1NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935636	GH	On-Demand	Anodyne	SLC27A1	41	38
CC(C)N1CCC[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450935638	EG	On-Demand	Anodyne	NR3C2	0	45
CC(C)N1CCC[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450935638	EG	On-Demand	Anodyne	BIRC2	47	38
CC(C)N1CCC[C@H](NC(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450935638	EG	On-Demand	Anodyne	SLC12A5	45	32
CC(C)N1CCC[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450935641	EG	On-Demand	Anodyne	NR3C2	0	45
CC(C)N1CCC[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450935641	EG	On-Demand	Anodyne	BIRC2	47	38
CC(C)N1CCC[C@@H](NC(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450935641	EG	On-Demand	Anodyne	SLC12A5	45	32
C[C@@H](O)CCN1CCC=C(c2ccccc2)C1	ZINC000450935652	BF	On-Demand	Anodyne	SLC6A1	15	40
C[C@H](O)CCN1CCC=C(c2ccccc2)C1	ZINC000450935653	BF	On-Demand	Anodyne	SLC6A1	15	40
CC[C@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NC	ZINC000450935672	CD	On-Demand	Anodyne	LEF	52	43
CC[C@@H](Nc1ccc(S(C)(=O)=O)cc1F)C(=O)NC	ZINC000450935673	CD	On-Demand	Anodyne	LEF	52	43
O=S(=O)(Cc1ccn(CC(F)(F)F)n1)c1ccc2c(c1)OCCO2	ZINC000450935682	FE	On-Demand	Anodyne	PKM	37	41
CNS(=O)(=O)NCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450935689	GD	On-Demand	Anodyne	CACNA1B	52	33
CNS(=O)(=O)NCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450935689	GD	On-Demand	Anodyne	COLA	52	41
CNS(=O)(=O)NCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450935689	GD	On-Demand	Anodyne	CPT1A	51	41
CNS(=O)(=O)NCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450935689	GD	On-Demand	Anodyne	CCR2	54	39
CNS(=O)(=O)NCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450935690	GD	On-Demand	Anodyne	CACNA1B	52	33
CNS(=O)(=O)NCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450935690	GD	On-Demand	Anodyne	COLA	52	41
CNS(=O)(=O)NCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450935690	GD	On-Demand	Anodyne	CPT1A	51	41
CNS(=O)(=O)NCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450935690	GD	On-Demand	Anodyne	CCR2	54	39
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450935735	GD	On-Demand	Bother	BCL2L1	83	35
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450935735	GD	On-Demand	Bother	BCL2	73	35
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450935735	GD	On-Demand	Bother	BCL2L2	43	30
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450935735	GD	On-Demand	Bother	DDIT3	0	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450935736	GD	On-Demand	Bother	BCL2L1	83	35
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450935736	GD	On-Demand	Bother	BCL2	73	35
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450935736	GD	On-Demand	Bother	BCL2L2	43	30
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450935736	GD	On-Demand	Bother	DDIT3	0	40
Cc1cccc(C)c1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935759	FG	On-Demand	Anodyne	ACOX1	70	35
Cc1cccc(C)c1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935759	FG	On-Demand	Anodyne	CYP2D6	0	44
Cc1cccc(C)c1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935759	FG	On-Demand	Anodyne	ABCB1	60	42
Cc1cccc(C)c1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935760	FG	On-Demand	Anodyne	ACOX1	70	35
Cc1cccc(C)c1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935760	FG	On-Demand	Anodyne	CYP2D6	0	44
Cc1cccc(C)c1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450935760	FG	On-Demand	Anodyne	ABCB1	60	42
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC1CC(F)(F)C1	ZINC000450935761	DG	On-Demand	Anodyne	ANPEP	43	32
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC1CC(F)(F)C1	ZINC000450935761	DG	On-Demand	Anodyne	CAPNS1	45	33
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC1CC(F)(F)C1	ZINC000450935762	DG	On-Demand	Anodyne	ANPEP	43	32
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC1CC(F)(F)C1	ZINC000450935762	DG	On-Demand	Anodyne	CAPNS1	45	33
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC1CC(F)(F)C1	ZINC000450935763	DG	On-Demand	Anodyne	ANPEP	43	32
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC1CC(F)(F)C1	ZINC000450935763	DG	On-Demand	Anodyne	CAPNS1	45	33
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC1CC(F)(F)C1	ZINC000450935764	DG	On-Demand	Anodyne	ANPEP	43	32
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC1CC(F)(F)C1	ZINC000450935764	DG	On-Demand	Anodyne	CAPNS1	45	33
CCNC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nn1	ZINC000450935778	FD	On-Demand	Anodyne	CASR	52	35
COC(=O)c1ccc(CN[C@@H]2CCC(=O)N[C@@H]2C2CC2)cc1Cl	ZINC000450935779	EE	On-Demand	Anodyne	SSTR3	18	41
COC(=O)c1ccc(CN[C@@H]2CCC(=O)N[C@@H]2C2CC2)cc1Cl	ZINC000450935779	EE	On-Demand	Anodyne	DNAE	46	31
COC(=O)c1ccc(CN[C@H]2CCC(=O)N[C@@H]2C2CC2)cc1Cl	ZINC000450935780	EE	On-Demand	Anodyne	SSTR3	18	41
COC(=O)c1ccc(CN[C@H]2CCC(=O)N[C@@H]2C2CC2)cc1Cl	ZINC000450935780	EE	On-Demand	Anodyne	DNAE	46	31
COC(=O)c1ccc(CN[C@H]2CCC(=O)N[C@H]2C2CC2)cc1Cl	ZINC000450935781	EE	On-Demand	Anodyne	SSTR3	18	41
COC(=O)c1ccc(CN[C@H]2CCC(=O)N[C@H]2C2CC2)cc1Cl	ZINC000450935781	EE	On-Demand	Anodyne	DNAE	46	31
COC(=O)c1ccc(CN[C@@H]2CCC(=O)N[C@H]2C2CC2)cc1Cl	ZINC000450935782	EE	On-Demand	Anodyne	SSTR3	18	41
COC(=O)c1ccc(CN[C@@H]2CCC(=O)N[C@H]2C2CC2)cc1Cl	ZINC000450935782	EE	On-Demand	Anodyne	DNAE	46	31
CCOC(=O)c1cnn(C)c1NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450935795	GF	On-Demand	Anodyne	PPARD	46	35
O=C(Nc1ccccc1)[C@@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450935800	GJ	On-Demand	Anodyne	NPY2R	42	36
O=C(Nc1ccccc1)[C@H](c1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450935801	GJ	On-Demand	Anodyne	NPY2R	42	36
COCc1nnc(N2CCN(c3ccc(OC)cn3)CC2)s1	ZINC000450935823	DD	On-Demand	Anodyne	NPBWR1	40	35
COC(=O)[C@@H](CC(C)C)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450935828	FF	On-Demand	Anodyne	FOLH1	50	43
COC(=O)[C@H](CC(C)C)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450935829	FF	On-Demand	Anodyne	FOLH1	50	43
COC(=O)c1csc(CSc2nnc(C)n2-c2ccc(OC)cc2)n1	ZINC000450935837	GG	On-Demand	Anodyne	WNT3A	23	46
COC(=O)c1csc(CSc2nnc(C)n2-c2ccc(OC)cc2)n1	ZINC000450935837	GG	On-Demand	Anodyne	TNKS2	17	47
Cc1oc(-c2cccs2)nc1CN1CCC(F)(c2ccccn2)CC1	ZINC000450935839	FJ	On-Demand	Anodyne	PDE8B	51	33
c1coc(CN(CCN2CCOCC2)c2ccnc(N3CCOCC3)n2)c1	ZINC000450935841	FD	On-Demand	Anodyne	EPHB4	46	33
COc1ccc(N2CCN(c3ccnc4ccccc34)CC2)nc1	ZINC000450935844	DF	On-Demand	Anodyne	METAP1	40	33
COc1ccc(N2CCN(c3ccnc4ccccc34)CC2)nc1	ZINC000450935844	DF	On-Demand	Anodyne	HNMT	47	35
COc1ccc(N2CCN(c3ccnc4ccccc34)CC2)nc1	ZINC000450935844	DF	On-Demand	Anodyne	BMP4	47	39
COC(=O)[C@H](NC(=O)[C@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935845	CC	On-Demand	Anodyne	PLG	0	41
COC(=O)[C@H](NC(=O)[C@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935845	CC	On-Demand	Anodyne	ELANE	50	42
COC(=O)[C@H](NC(=O)[C@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935845	CC	On-Demand	Anodyne	LGMN	66	38
COC(=O)[C@H](NC(=O)[C@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935845	CC	On-Demand	Anodyne	XIAP	42	38
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935846	CC	On-Demand	Anodyne	PLG	0	41
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935846	CC	On-Demand	Anodyne	ELANE	50	42
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935846	CC	On-Demand	Anodyne	LGMN	66	38
COC(=O)[C@@H](NC(=O)[C@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935846	CC	On-Demand	Anodyne	XIAP	42	38
COC(=O)[C@H](NC(=O)[C@@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935847	CC	On-Demand	Anodyne	PLG	0	41
COC(=O)[C@H](NC(=O)[C@@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935847	CC	On-Demand	Anodyne	ELANE	50	42
COC(=O)[C@H](NC(=O)[C@@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935847	CC	On-Demand	Anodyne	LGMN	66	38
COC(=O)[C@H](NC(=O)[C@@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935847	CC	On-Demand	Anodyne	XIAP	42	38
COC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935848	CC	On-Demand	Anodyne	PLG	0	41
COC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935848	CC	On-Demand	Anodyne	ELANE	50	42
COC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935848	CC	On-Demand	Anodyne	LGMN	66	38
COC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C)c1ccc(O)cc1	ZINC000450935848	CC	On-Demand	Anodyne	XIAP	42	38
COc1ccc(N2CCN(c3ncccc3I)CC2)nc1	ZINC000450935852	GE	On-Demand	Anodyne	EBP	21	41
Cc1ccccc1C[C@H](C)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450935856	FG	On-Demand	Anodyne	ENPP1	61	52
Cc1ccccc1C[C@@H](C)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450935857	FG	On-Demand	Anodyne	ENPP1	61	52
COc1cc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ccnc2cc1F	ZINC000450935862	GE	On-Demand	Anodyne	SLC6A7	0	42
CN(C)C(=O)CSc1ccc([N+](=O)[O-])c(OC(F)F)c1	ZINC000450935863	DE	On-Demand	Bother	GSTP1	41	37
FC1(c2cccnc2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450935870	DI	On-Demand	Anodyne	DRD4	15	42
FC1(c2cccnc2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450935870	DI	On-Demand	Anodyne	SIGMAR1	22	41
FC1(c2cccnc2)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450935870	DI	On-Demand	Anodyne	CCR1	29	42
Cc1nc(SCC(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000450935872	CD	On-Demand	Bother	GSTP1	44	36
CC(=O)c1ccc(CN2CCCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000450935880	ED	On-Demand	Anodyne	ACHE	15	43
CC(=O)c1ccc(CN2CCCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000450935880	ED	On-Demand	Anodyne	HRH3	17	43
Cc1cccc(Cl)c1CS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000450935887	EG	On-Demand	Anodyne	PKM	27	43
CC(C)N1CCC[C@@H](NC(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450935889	EG	On-Demand	Anodyne	BIRC2	41	35
CC(C)N1CCC[C@H](NC(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450935890	EG	On-Demand	Anodyne	BIRC2	41	35
Cc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1F	ZINC000450935893	EG	On-Demand	Anodyne	DRD4	0	48
CC(C)N1CCC[C@H](NC(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450935894	DD	On-Demand	Anodyne	PRNP	31	42
CC(C)N1CCC[C@H](NC(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450935894	DD	On-Demand	Anodyne	HDAC1	29	42
CC(C)N1CCC[C@@H](NC(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450935895	DD	On-Demand	Anodyne	PRNP	31	42
CC(C)N1CCC[C@@H](NC(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450935895	DD	On-Demand	Anodyne	HDAC1	29	42
CC(C)N1CCC[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450935928	DF	On-Demand	Anodyne	BIRC2	40	36
CC(C)N1CCC[C@@H](NC(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450935928	DF	On-Demand	Anodyne	HPGDS	35	42
CC(C)N1CCC[C@H](NC(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450935930	DF	On-Demand	Anodyne	BIRC2	40	36
CC(C)N1CCC[C@H](NC(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450935930	DF	On-Demand	Anodyne	HPGDS	35	42
Cc1ccnc2[nH]c(SCC(=O)NCc3cccc(OC(C)C)c3)nc12	ZINC000450935934	FG	On-Demand	Anodyne	ENPP1	67	55
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935936	CE	On-Demand	Anodyne	DRD2	39	57
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935936	CE	On-Demand	Anodyne	DRD1	0	57
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935936	CE	On-Demand	Anodyne	DRD4	26	60
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935936	CE	On-Demand	Anodyne	ERG2	26	57
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935936	CE	On-Demand	Anodyne	SLC18A3	24	58
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935936	CE	On-Demand	Anodyne	CYP2J2	53	38
COc1ccc(CNC(=O)CCN2CCC(CC(F)(F)F)CC2)c(OC)c1	ZINC000450935938	GG	On-Demand	Anodyne	DRD2	15	40
COc1ccc(CNC(=O)CCN2CCC(CC(F)(F)F)CC2)c(OC)c1	ZINC000450935938	GG	On-Demand	Anodyne	DRD4	40	30
COc1ccc(CNC(=O)CCN2CCC(CC(F)(F)F)CC2)c(OC)c1	ZINC000450935938	GG	On-Demand	Anodyne	HTR4	47	39
COc1ccc(CNC(=O)CCN2CCC(CC(F)(F)F)CC2)c(OC)c1	ZINC000450935938	GG	On-Demand	Anodyne	HTR7	31	41
COc1ccc(CNC(=O)CCN2CCC(CC(F)(F)F)CC2)c(OC)c1	ZINC000450935938	GG	On-Demand	Anodyne	MTNR1A	49	36
COc1ccc(CNC(=O)CCN2CCC(CC(F)(F)F)CC2)c(OC)c1	ZINC000450935938	GG	On-Demand	Anodyne	CACNA1I	55	37
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935948	CE	On-Demand	Anodyne	DRD2	39	57
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935948	CE	On-Demand	Anodyne	DRD1	0	57
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935948	CE	On-Demand	Anodyne	DRD4	26	60
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935948	CE	On-Demand	Anodyne	ERG2	26	57
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935948	CE	On-Demand	Anodyne	SLC18A3	24	58
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(F)cc1	ZINC000450935948	CE	On-Demand	Anodyne	CYP2J2	53	38
CCCC[C@@H](S[C@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935957	DF	On-Demand	Anodyne	MAP	0	51
CCCC[C@@H](S[C@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935957	DF	On-Demand	Anodyne	ADAM17	0	41
CCCC[C@@H](S[C@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935957	DF	On-Demand	Anodyne	MAP1	134	51
CCCC[C@H](S[C@@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935958	DF	On-Demand	Anodyne	MAP	0	51
CCCC[C@H](S[C@@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935958	DF	On-Demand	Anodyne	ADAM17	0	41
CCCC[C@H](S[C@@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935958	DF	On-Demand	Anodyne	MAP1	134	51
CCCC[C@@H](S[C@@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935959	DF	On-Demand	Anodyne	MAP	0	51
CCCC[C@@H](S[C@@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935959	DF	On-Demand	Anodyne	ADAM17	0	41
CCCC[C@@H](S[C@@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935959	DF	On-Demand	Anodyne	MAP1	134	51
CCCC[C@H](S[C@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935960	DF	On-Demand	Anodyne	MAP	0	51
CCCC[C@H](S[C@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935960	DF	On-Demand	Anodyne	ADAM17	0	41
CCCC[C@H](S[C@H](C)C(=O)Nc1nccs1)C(=O)OC	ZINC000450935960	DF	On-Demand	Anodyne	MAP1	134	51
COC(=O)C(C)(C)C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450935961	DF	On-Demand	Anodyne	PPARD	50	38
COC(=O)C(C)(C)C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450935961	DF	On-Demand	Anodyne	PTGDR2	30	41
COc1ccc(-n2c(C)nnc2SCC2(OC)CCC2)cc1	ZINC000450935970	DG	On-Demand	Anodyne	WNT3A	23	48
COc1ccc(-n2c(C)nnc2SCC2(OC)CCC2)cc1	ZINC000450935970	DG	On-Demand	Anodyne	AXIN2	0	53
Cc1ccc([N+](=O)[O-])c(SCC(=O)N(C)C)c1	ZINC000450935973	CE	On-Demand	Bother	GSTM2	46	36
Cc1ccc([N+](=O)[O-])c(SCC(=O)N(C)C)c1	ZINC000450935973	CE	On-Demand	Bother	GSTP1	50	36
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	MME	48	39
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	CTSB	43	37
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	PAPA1_CARPA	47	39
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	PGA	18	40
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	CAPNS1	57	34
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	YARS	32	44
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	CAPN1	72	39
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	CAPN2	103	39
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	POL	0	44
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	NPR	77	37
COC(=O)[C@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935987	FE	On-Demand	Anodyne	AKR1B10	35	43
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	MME	48	39
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	CTSB	43	37
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	PAPA1_CARPA	47	39
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	PGA	18	40
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	CAPNS1	57	34
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	YARS	32	44
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	CAPN1	72	39
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	CAPN2	103	39
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	POL	0	44
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	NPR	77	37
COC(=O)[C@@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935988	FE	On-Demand	Anodyne	AKR1B10	35	43
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	MME	48	39
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	CTSB	43	37
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	PAPA1_CARPA	47	39
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	PGA	18	40
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	CAPNS1	57	34
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	YARS	32	44
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	CAPN1	72	39
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	CAPN2	103	39
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	POL	0	44
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	NPR	77	37
COC(=O)[C@@H](NC(=O)[C@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935989	FE	On-Demand	Anodyne	AKR1B10	35	43
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	MME	48	39
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	CTSB	43	37
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	PAPA1_CARPA	47	39
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	PGA	18	40
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	CAPNS1	57	34
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	YARS	32	44
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	CAPN1	72	39
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	CAPN2	103	39
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	POL	0	44
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	NPR	77	37
COC(=O)[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(O)cc1	ZINC000450935990	FE	On-Demand	Anodyne	AKR1B10	35	43
COC(=O)c1ccc(CN2CCCN(S(=O)(=O)C3CC3)CC2)cc1Cl	ZINC000450935997	GE	On-Demand	Anodyne	MCHR1	24	43
CCC(=O)CCCN1CCc2ccc(Br)cc2C1	ZINC000450936001	DH	On-Demand	Anodyne	ABCB1	0	40
CCc1cc(=N)[nH]c(SCC(=O)c2ccc(C(=O)OC)o2)n1	ZINC000450936003	DD	On-Demand	Anodyne	ENPP1	50	32
COC[C@H]1CCCCN1c1ncnc2cc(Br)ccc12	ZINC000450936017	EG	On-Demand	Anodyne	PDE3A	43	32
COC[C@@H]1CCCCN1c1ncnc2cc(Br)ccc12	ZINC000450936019	EG	On-Demand	Anodyne	PDE3A	43	32
Cc1cc(C)nc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450936027	DD	On-Demand	Anodyne	HCRTR1	40	35
Cc1cc(C)nc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450936027	DD	On-Demand	Anodyne	SLC6A7	0	46
C[C@@]1(Cc2ccccc2)CCCN1C(=O)[C@H](O)C1CCC1	ZINC000450936029	CF	On-Demand	Anodyne	SLC12A5	84	42
C[C@]1(Cc2ccccc2)CCCN1C(=O)[C@@H](O)C1CCC1	ZINC000450936030	CF	On-Demand	Anodyne	SLC12A5	84	42
C[C@]1(Cc2ccccc2)CCCN1C(=O)[C@H](O)C1CCC1	ZINC000450936031	CF	On-Demand	Anodyne	SLC12A5	84	42
C[C@@]1(Cc2ccccc2)CCCN1C(=O)[C@@H](O)C1CCC1	ZINC000450936032	CF	On-Demand	Anodyne	SLC12A5	84	42
COCc1ccc([C@@H]2CCCN2C(=O)c2c[nH]c3nccc-3c2)o1	ZINC000450936039	EG	On-Demand	Anodyne	COLA	79	36
COCc1ccc([C@@H]2CCCN2C(=O)c2c[nH]c3nccc-3c2)o1	ZINC000450936039	EG	On-Demand	Anodyne	CPT1A	56	36
COCc1ccc([C@H]2CCCN2C(=O)c2c[nH]c3nccc-3c2)o1	ZINC000450936040	EG	On-Demand	Anodyne	COLA	79	36
COCc1ccc([C@H]2CCCN2C(=O)c2c[nH]c3nccc-3c2)o1	ZINC000450936040	EG	On-Demand	Anodyne	CPT1A	56	36
COc1cccc(OCCC(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)c1	ZINC000450936041	EF	On-Demand	Anodyne	MTNR1A	29	42
COc1cccc(OCCC(=O)NC[C@]2(C)CCO[C@H]2C2CC2)c1	ZINC000450936042	EF	On-Demand	Anodyne	MTNR1A	29	42
COc1cccc(OCCC(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)c1	ZINC000450936043	EF	On-Demand	Anodyne	MTNR1A	29	42
COc1cccc(OCCC(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)c1	ZINC000450936044	EF	On-Demand	Anodyne	MTNR1A	29	42
C[C@H]1CN(c2nccc(C(F)(F)F)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450936045	FD	On-Demand	Anodyne	HCRTR1	42	36
C[C@H]1CN(c2nccc(C(F)(F)F)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450936045	FD	On-Demand	Anodyne	SLC6A7	0	50
C[C@H]1CN(c2ccnc(N(C)C)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450936048	EC	On-Demand	Anodyne	SLC6A7	0	44
C[C@H]1CN(c2ccc([N+](=O)[O-])c3cccnc23)CCN1C(=O)c1cnn(C)c1	ZINC000450936070	GE	On-Demand	Bother	SLC6A7	0	42
C[C@H]1CN(c2ccc(C#N)cc2Br)CCN1C(=O)c1cnn(C)c1	ZINC000450936075	GE	On-Demand	Mild	SMO	0	41
Cc1ccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450936087	FE	On-Demand	Anodyne	PDE3A	40	32
Cc1ccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450936087	FE	On-Demand	Anodyne	PDGFRB	20	44
Cc1ccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450936087	FE	On-Demand	Anodyne	HCRTR1	52	38
Cc1ccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450936087	FE	On-Demand	Anodyne	PDE3B	59	32
Cc1ccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1	ZINC000450936087	FE	On-Demand	Anodyne	LIMK2	71	38
CN(c1nccc(Oc2ccccc2)n1)C1CCN(CC(F)(F)F)CC1	ZINC000450936094	FH	On-Demand	Anodyne	HPGDS	32	48
COc1cc(N2CCN(Cc3cn(CC4CC4)nn3)CC2)ccc1F	ZINC000450936106	EE	On-Demand	Anodyne	ADRB1	20	46
COc1cc(N2CCN(Cc3cn(CC4CC4)nn3)CC2)ccc1F	ZINC000450936106	EE	On-Demand	Anodyne	DRD1	22	41
COc1cc(N2CCN(Cc3cn(CC4CC4)nn3)CC2)ccc1F	ZINC000450936106	EE	On-Demand	Anodyne	DRD3	18	46
COC[C@H]1CCCCN1c1cc(C)c([N+](=O)[O-])cc1F	ZINC000450936107	CG	On-Demand	Bother	CASP3	42	34
COC[C@@H]1CCCCN1c1cc(C)c([N+](=O)[O-])cc1F	ZINC000450936108	CG	On-Demand	Bother	CASP3	42	34
COC[C@@H]1CCCCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450936109	GI	On-Demand	Anodyne	COLA	26	42
COC[C@@H]1CCCCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450936109	GI	On-Demand	Anodyne	CPT1A	29	42
COC[C@@H]1CCCCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450936109	GI	On-Demand	Anodyne	CPT2	25	42
COC[C@H]1CCCCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450936110	GI	On-Demand	Anodyne	COLA	26	42
COC[C@H]1CCCCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450936110	GI	On-Demand	Anodyne	CPT1A	29	42
COC[C@H]1CCCCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450936110	GI	On-Demand	Anodyne	CPT2	25	42
CCOc1cc(NC2CCN(C(=O)c3c(C)cccc3Cl)CC2)ncn1	ZINC000450936112	FH	On-Demand	Anodyne	CCR5	30	40
CCO[C@@H]1CCC[C@H]1Nc1ncnc2[nH]ccc12	ZINC000450936125	BE	On-Demand	Anodyne	JAK3	16	43
CCO[C@@H]1CCC[C@H]1Nc1ncnc2[nH]ccc12	ZINC000450936125	BE	On-Demand	Anodyne	JAK1	52	43
CCO[C@@H]1CCC[C@H]1Nc1ncnc2[nH]ccc12	ZINC000450936125	BE	On-Demand	Anodyne	JAK2	29	46
CC[C@@H](Nc1ncc(C)s1)C(=O)NC	ZINC000450936134	BD	On-Demand	Anodyne	FDPS	16	50
CC[C@H](Nc1ncc(C)s1)C(=O)NC	ZINC000450936135	BD	On-Demand	Anodyne	FDPS	16	50
CCO[C@@H]1CCC[C@H]1Nc1nc(O)c2ccccc2n1	ZINC000450936153	CF	On-Demand	Anodyne	TNKS	60	35
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1	ZINC000450936155	EG	On-Demand	Anodyne	DRD3	0	43
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1	ZINC000450936155	EG	On-Demand	Anodyne	CCR3	47	43
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)c1	ZINC000450936155	EG	On-Demand	Anodyne	CACNA1I	52	40
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1	ZINC000450936157	EG	On-Demand	Anodyne	DRD3	0	43
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1	ZINC000450936157	EG	On-Demand	Anodyne	CCR3	47	43
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)c1	ZINC000450936157	EG	On-Demand	Anodyne	CACNA1I	52	40
CCCNC(=O)c1ccc(N[C@@H]2CCC[C@H]2OCC)nc1	ZINC000450936159	CF	On-Demand	Anodyne	SSTR5	15	40
COC(=O)[C@H]1CN(c2nc3c(F)cccc3o2)C[C@H]1c1ccccc1	ZINC000450936172	EG	On-Demand	Anodyne	SLC6A1	36	41
CC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936173	CE	On-Demand	Bother	COLA	42	36
COC(=O)[C@H]1CN(c2nc3c(F)cccc3o2)C[C@@H]1c1ccccc1	ZINC000450936174	EG	On-Demand	Anodyne	SLC6A1	36	41
CC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936175	CE	On-Demand	Bother	COLA	42	36
COC(=O)[C@@H]1CN(c2nc3c(F)cccc3o2)C[C@H]1c1ccccc1	ZINC000450936177	EG	On-Demand	Anodyne	SLC6A1	36	41
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@H](C)C[C@@H](O)C1	ZINC000450936195	EF	On-Demand	Anodyne	ATP4A	19	50
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@@H](O)C[C@@H](C)C1	ZINC000450936197	EF	On-Demand	Anodyne	ATP4A	19	50
CCOC(=O)c1cnc2c(OC)cccc2c1N1C[C@@H](C)C[C@H](O)C1	ZINC000450936199	EF	On-Demand	Anodyne	ATP4A	19	50
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C[C@@H]1c1ccccc1	ZINC000450936216	FD	On-Demand	Bother	CACNA1D	48	35
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936217	FG	On-Demand	Bother	TAAR1	21	48
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936218	FG	On-Demand	Bother	TAAR1	21	48
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C[C@H]1c1ccccc1	ZINC000450936219	FD	On-Demand	Bother	CACNA1D	48	35
COC[C@H]1CCCCN1c1ncnc2cccc(F)c12	ZINC000450936224	CF	On-Demand	Anodyne	CHRNA10	48	37
COC[C@@H]1CCCCN1c1ncnc2cccc(F)c12	ZINC000450936225	CF	On-Demand	Anodyne	CHRNA10	48	37
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@@H](C)C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450936240	FD	On-Demand	Bother	TAAR1	18	46
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@@H](O)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450936242	FD	On-Demand	Bother	TAAR1	18	46
COC(=O)[C@H](C)NC(=O)c1ccc(N2C[C@H](C)C[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000450936244	FD	On-Demand	Bother	TAAR1	18	46
CCCc1nsc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)n1	ZINC000450936258	EF	On-Demand	Anodyne	SLC6A1	32	40
CCCc1nsc(N2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)n1	ZINC000450936259	EF	On-Demand	Anodyne	SLC6A1	32	40
CCCc1nsc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)n1	ZINC000450936261	EF	On-Demand	Anodyne	SLC6A1	32	40
C[C@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936285	EG	On-Demand	Anodyne	PRNP	40	44
C[C@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936285	EG	On-Demand	Anodyne	HDAC1	30	45
C[C@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936285	EG	On-Demand	Anodyne	TAAR1	36	46
C[C@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936285	EG	On-Demand	Anodyne	KCNK3	54	40
C[C@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936285	EG	On-Demand	Anodyne	KCNK9	23	40
C[C@H]1C[C@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936286	EG	On-Demand	Anodyne	PRNP	40	44
C[C@H]1C[C@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936286	EG	On-Demand	Anodyne	HDAC1	30	45
C[C@H]1C[C@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936286	EG	On-Demand	Anodyne	TAAR1	36	46
C[C@H]1C[C@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936286	EG	On-Demand	Anodyne	KCNK3	54	40
C[C@H]1C[C@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936286	EG	On-Demand	Anodyne	KCNK9	23	40
C[C@@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936287	EG	On-Demand	Anodyne	PRNP	40	44
C[C@@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936287	EG	On-Demand	Anodyne	HDAC1	30	45
C[C@@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936287	EG	On-Demand	Anodyne	TAAR1	36	46
C[C@@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936287	EG	On-Demand	Anodyne	KCNK3	54	40
C[C@@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1	ZINC000450936287	EG	On-Demand	Anodyne	KCNK9	23	40
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936291	GC	On-Demand	Bother	BCL2L1	109	37
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936291	GC	On-Demand	Bother	BCL2	88	37
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936291	GC	On-Demand	Bother	BCL2L2	45	32
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936291	GC	On-Demand	Bother	DDIT3	0	43
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936292	GC	On-Demand	Bother	BCL2L1	109	37
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936292	GC	On-Demand	Bother	BCL2	88	37
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936292	GC	On-Demand	Bother	BCL2L2	45	32
CC[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936292	GC	On-Demand	Bother	DDIT3	0	43
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(=O)NC	ZINC000450936293	EC	On-Demand	Anodyne	TGM2	57	42
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(=O)NC	ZINC000450936293	EC	On-Demand	Anodyne	F13A1	53	39
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(=O)NC	ZINC000450936293	EC	On-Demand	Anodyne	NAMPT	31	42
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(=O)NC	ZINC000450936294	EC	On-Demand	Anodyne	TGM2	57	42
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(=O)NC	ZINC000450936294	EC	On-Demand	Anodyne	F13A1	53	39
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCC2)cn1)C(=O)NC	ZINC000450936294	EC	On-Demand	Anodyne	NAMPT	31	42
CC[C@H](Nc1ccc(S(=O)(=O)NC)cc1F)C(=O)NC	ZINC000450936298	DC	On-Demand	Anodyne	LEF	62	47
CC[C@@H](Nc1ccc(S(=O)(=O)NC)cc1F)C(=O)NC	ZINC000450936299	DC	On-Demand	Anodyne	LEF	62	47
Cc1cnn(Cc2ccccc2F)c1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450936313	FH	On-Demand	Anodyne	CTSA	40	35
CC[C@H](Nc1cc(N2CCCC2)ncn1)C(=O)NC	ZINC000450936314	CD	On-Demand	Anodyne	KCNQ2	41	33
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(Br)cc1	ZINC000450936315	EF	On-Demand	Anodyne	DRD2	31	45
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(Br)cc1	ZINC000450936315	EF	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(Br)cc1	ZINC000450936315	EF	On-Demand	Anodyne	SLC18A3	26	47
O=C(CCCN1CC[C@@](F)(CO)C1)c1ccc(Br)cc1	ZINC000450936315	EF	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(Br)cc1	ZINC000450936316	EF	On-Demand	Anodyne	DRD2	31	45
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(Br)cc1	ZINC000450936316	EF	On-Demand	Anodyne	DRD4	0	48
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(Br)cc1	ZINC000450936316	EF	On-Demand	Anodyne	SLC18A3	26	47
O=C(CCCN1CC[C@](F)(CO)C1)c1ccc(Br)cc1	ZINC000450936316	EF	On-Demand	Anodyne	CYP2J2	52	37
Cc1ccnc2[nH]c(SCC(=O)NCC(=O)NC(C)(C)C)nc12	ZINC000450936323	ED	On-Demand	Anodyne	ENPP1	64	55
C[C@H]1CN(c2ncnc(N)c2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450936331	EC	On-Demand	Anodyne	LIMK2	64	37
C[C@H]1CN(c2ncnc(N)c2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450936331	EC	On-Demand	Anodyne	SLC6A7	0	44
COc1ccc(N2CCN(c3cc(N4CCC[C@H](C)C4)ncn3)CC2)nc1	ZINC000450936349	FE	On-Demand	Anodyne	DCK	31	40
COc1ccc(N2CCN(c3cc(N4CCC[C@H](C)C4)ncn3)CC2)nc1	ZINC000450936349	FE	On-Demand	Anodyne	PDE3B	43	34
COc1ccc(N2CCN(c3cc(N4CCC[C@@H](C)C4)ncn3)CC2)nc1	ZINC000450936350	FE	On-Demand	Anodyne	DCK	31	40
COc1ccc(N2CCN(c3cc(N4CCC[C@@H](C)C4)ncn3)CC2)nc1	ZINC000450936350	FE	On-Demand	Anodyne	PDE3B	43	34
COc1ccc(N2CCN(c3ncccc3S(=O)(=O)NC(C)C)CC2)nc1	ZINC000450936366	GD	On-Demand	Anodyne	ZAP70	19	40
CS(=O)(=O)c1ccc2c(c1)CCN(CC/C=C\c1ccccc1)CC2	ZINC000450936370	FH	On-Demand	Anodyne	SLC6A5	26	45
CS(=O)(=O)c1ccc2c(c1)CCN(CC/C=C/c1ccccc1)CC2	ZINC000450936371	FH	On-Demand	Anodyne	SLC6A5	26	45
CCNC(=O)C[C@@H]1CCCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450936378	FE	On-Demand	Anodyne	RORC	46	32
CCNC(=O)C[C@H]1CCCCN1Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450936380	FE	On-Demand	Anodyne	RORC	46	32
COc1ccc(N2CCN(c3c(C#N)nnc4ccccc34)CC2)nc1	ZINC000450936396	EE	On-Demand	Mild	SMO	25	40
CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450936410	ED	On-Demand	Anodyne	DRD4	47	36
CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450936410	ED	On-Demand	Anodyne	DRD3	22	41
CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450936410	ED	On-Demand	Anodyne	HDAC1	0	49
CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450936410	ED	On-Demand	Anodyne	NPBWR1	40	36
Cc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1C#N	ZINC000450936415	DD	On-Demand	Mild	LIMK2	62	33
Cc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1C#N	ZINC000450936415	DD	On-Demand	Mild	SLC6A7	0	42
CC(=O)c1ccc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)cc1	ZINC000450936421	FF	On-Demand	Anodyne	MLNR	22	41
CC(=O)c1ccc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)cc1	ZINC000450936421	FF	On-Demand	Anodyne	NOD2	45	38
CCS(=O)(=O)c1ccc(CS[C@@H](Cc2ccc(C)cc2)C(=O)OC)cc1	ZINC000450936428	GH	On-Demand	Anodyne	RORC	22	40
COc1ccc(N2CCN(c3nc(O)c4ccccc4n3)CC2)nc1	ZINC000450936430	EE	On-Demand	Anodyne	SORD	54	37
CCS(=O)(=O)c1ccc(CS[C@H](Cc2ccc(C)cc2)C(=O)OC)cc1	ZINC000450936439	GH	On-Demand	Anodyne	RORC	22	40
COC(=O)[C@H](CC(C)C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450936441	CF	On-Demand	Anodyne	ENPP1	24	47
O[C@@H](CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)Cc1ccccc1	ZINC000450936442	GI	On-Demand	Anodyne	PHES	0	47
COC(=O)[C@@H](CC(C)C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450936443	CF	On-Demand	Anodyne	ENPP1	24	47
Cc1ccnc2[nH]c(SCCCCC(N)=O)nc12	ZINC000450936446	CE	On-Demand	Anodyne	HDA106	0	44
Cc1ccnc2[nH]c(SCCCCC(N)=O)nc12	ZINC000450936446	CE	On-Demand	Anodyne	ENPP1	60	53
O[C@@H](CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)Cc1ccccc1	ZINC000450936449	GI	On-Demand	Anodyne	PHES	0	47
COc1ccc(N2CCN(c3ccnc(-c4ccccc4)n3)CC2)nc1	ZINC000450936451	EF	On-Demand	Anodyne	DRD4	28	42
COc1ccc(N2CCN(c3cc(N4CCCCC4)ncn3)CC2)nc1	ZINC000450936455	FE	On-Demand	Anodyne	GALR2	48	38
C[C@H]1CN(c2nc3c(F)cccc3o2)CCN1C(=O)c1cnn(C)c1	ZINC000450936458	EE	On-Demand	Anodyne	SLC6A7	0	43
Cc1nc2ccccc2c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1C	ZINC000450936460	FF	On-Demand	Anodyne	SMO	37	48
Cc1nc2ccccc2c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1C	ZINC000450936460	FF	On-Demand	Anodyne	SLC6A7	0	40
c1ccc(-c2nc(N(CCN3CCOCC3)Cc3ccco3)no2)cc1	ZINC000450936462	FF	On-Demand	Anodyne	CASR	49	38
Cc1c(Cl)cnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1C#N	ZINC000450936463	FD	On-Demand	Mild	SLC6A7	0	41
COc1cc(CN2CCc3c(cccc3S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450936470	GG	On-Demand	Anodyne	DRD4	29	41
COc1cc(CN2CCc3c(cccc3S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450936470	GG	On-Demand	Anodyne	ABCB1	17	41
COc1cc(CN2CCc3c(cccc3S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450936470	GG	On-Demand	Anodyne	NOD2	41	38
CC[C@@H](Nc1cc(N2CCCC2)ncn1)C(=O)NC	ZINC000450936481	CD	On-Demand	Anodyne	KCNQ2	41	33
COc1ccc(N2CCN(c3ncnc(N)c3Cl)CC2)nc1	ZINC000450936488	DD	On-Demand	Anodyne	ADK	39	43
CCCOc1cccc(CN(C#N)c2ccc(OC)cc2)c1	ZINC000450936489	CH	On-Demand	Anodyne	SQLE	51	34
C[C@H]1C[C@@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936500	CE	On-Demand	Anodyne	PDE3A	42	35
C[C@H]1C[C@@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936500	CE	On-Demand	Anodyne	PDE3B	63	35
C[C@H]1C[C@@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936500	CE	On-Demand	Anodyne	HTT	0	42
C[C@@H]1C[C@@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936502	CE	On-Demand	Anodyne	PDE3A	42	35
C[C@@H]1C[C@@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936502	CE	On-Demand	Anodyne	PDE3B	63	35
C[C@@H]1C[C@@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936502	CE	On-Demand	Anodyne	HTT	0	42
COc1ccc(N2CCN(c3c(C#N)cccc3C#N)CC2)nc1	ZINC000450936503	DE	On-Demand	Mild	SMO	29	40
C[C@H]1C[C@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936504	CE	On-Demand	Anodyne	PDE3A	42	35
C[C@H]1C[C@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936504	CE	On-Demand	Anodyne	PDE3B	63	35
C[C@H]1C[C@H](O)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450936504	CE	On-Demand	Anodyne	HTT	0	42
O=C(CN1CCC(F)(c2ccccn2)CC1)NCCc1ccc(Cl)cc1	ZINC000450936506	GG	On-Demand	Anodyne	MRGPRX1	41	38
CC[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)C(=O)NC	ZINC000450936519	CF	On-Demand	Mild	AR	23	44
CC[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)C(=O)NC	ZINC000450936520	CF	On-Demand	Mild	AR	23	44
CC[C@@H](Nc1ccnc2cc(Cl)ccc12)C(=O)NC	ZINC000450936521	CF	On-Demand	Anodyne	RBP_CHICK	0	51
CC[C@H](Nc1ccnc2cc(Cl)ccc12)C(=O)NC	ZINC000450936524	CF	On-Demand	Anodyne	HRP1_PLAFA	110	41
CC[C@H](Nc1ccnc2cc(Cl)ccc12)C(=O)NC	ZINC000450936524	CF	On-Demand	Anodyne	HNMT	59	42
CC[C@H](Nc1ccnc2cc(Cl)ccc12)C(=O)NC	ZINC000450936524	CF	On-Demand	Anodyne	BOTA	38	46
CC[C@H](Nc1ccnc2cc(Cl)ccc12)C(=O)NC	ZINC000450936524	CF	On-Demand	Anodyne	RBP_CHICK	0	51
COc1ccc(N2CCN(c3ncccc3C(=O)N3CCCCC3)CC2)nc1	ZINC000450936531	GE	On-Demand	Anodyne	CCKAR	0	41
COc1ccc(N2CCN(c3ncccc3C(=O)N3CCCCC3)CC2)nc1	ZINC000450936531	GE	On-Demand	Anodyne	SCD1	19	46
COc1ccc(N2CCN(c3ncccc3C(=O)N3CCCCC3)CC2)nc1	ZINC000450936531	GE	On-Demand	Anodyne	SCD	17	40
COc1ccc(N2CCN(c3ncccc3C(=O)N3CCCCC3)CC2)nc1	ZINC000450936531	GE	On-Demand	Anodyne	SLC6A7	0	45
CC[C@H]1c2ccsc2CCN1C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450936535	GH	On-Demand	Anodyne	TRPM8	16	42
CC[C@@H]1c2ccsc2CCN1C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450936537	GH	On-Demand	Anodyne	TRPM8	16	42
COc1ccc(N2CCN(c3nnc(-c4ccccn4)s3)CC2)nc1	ZINC000450936539	FE	On-Demand	Anodyne	EBP	21	41
CSc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450936541	DI	On-Demand	Anodyne	MAP	0	40
CSc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450936541	DI	On-Demand	Anodyne	MAP1	125	40
CSc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450936541	DI	On-Demand	Anodyne	GCK	18	41
CSc1ccc(CS[C@@H](C)C(=O)Nc2nccs2)cc1	ZINC000450936541	DI	On-Demand	Anodyne	FFAR2	19	45
CSc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450936545	DI	On-Demand	Anodyne	MAP	0	40
CSc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450936545	DI	On-Demand	Anodyne	MAP1	125	40
CSc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450936545	DI	On-Demand	Anodyne	GCK	21	41
CSc1ccc(CS[C@H](C)C(=O)Nc2nccs2)cc1	ZINC000450936545	DI	On-Demand	Anodyne	FFAR2	19	45
CCOc1cccc(CN(CCO)c2ccc(C(F)(F)F)c(C#N)n2)c1	ZINC000450936546	FG	On-Demand	Mild	CETP	0	41
CCOc1cccc(CN(CCO)c2ncc([N+](=O)[O-])s2)c1	ZINC000450936547	DE	On-Demand	Bother	NR1D1	22	41
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450936548	DG	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450936548	DG	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450936548	DG	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCC[C@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450936549	DG	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450936549	DG	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450936549	DG	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCC[C@@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450936551	DG	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450936551	DG	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450936551	DG	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCC[C@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450936553	DG	On-Demand	Anodyne	DRD2	28	42
O=C(CCCN1CCC[C@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450936553	DG	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CCC[C@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450936553	DG	On-Demand	Anodyne	CYP2J2	52	37
COc1ccc(N2CCN(c3cc(C(C)=O)ccc3C#N)CC2)nc1	ZINC000450936558	EE	On-Demand	Mild	DRD4	41	33
CC(=O)[C@](C)(O)CN1CCN(C)[C@@H](Cc2ccccc2)C1	ZINC000450936565	CD	On-Demand	Anodyne	CYP2J2	46	33
CC(=O)[C@](C)(O)CN1CCN(C)[C@H](Cc2ccccc2)C1	ZINC000450936566	CD	On-Demand	Anodyne	CYP2J2	46	33
CC(=O)[C@@](C)(O)CN1CCN(C)[C@@H](Cc2ccccc2)C1	ZINC000450936567	CD	On-Demand	Anodyne	CYP2J2	46	33
CC(=O)[C@@](C)(O)CN1CCN(C)[C@H](Cc2ccccc2)C1	ZINC000450936568	CD	On-Demand	Anodyne	CYP2J2	46	33
C[C@H]1C[C@@H](O)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450936578	DF	On-Demand	Anodyne	PDE3A	42	32
C[C@H]1C[C@@H](O)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450936578	DF	On-Demand	Anodyne	PDE3B	62	32
C[C@@H]1C[C@@H](O)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450936579	DF	On-Demand	Anodyne	PDE3A	42	32
C[C@@H]1C[C@@H](O)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450936579	DF	On-Demand	Anodyne	PDE3B	62	32
C[C@H]1C[C@H](O)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450936580	DF	On-Demand	Anodyne	PDE3A	42	32
C[C@H]1C[C@H](O)CN(c2ncnc3cc(Br)ccc23)C1	ZINC000450936580	DF	On-Demand	Anodyne	PDE3B	62	32
C[C@H]1C[C@@H](O)CN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450936603	DD	On-Demand	Anodyne	LRRK2	0	42
C[C@H]1C[C@H](O)CN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450936604	DD	On-Demand	Anodyne	LRRK2	0	42
C[C@@H]1C[C@@H](O)CN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450936605	DD	On-Demand	Anodyne	LRRK2	0	42
C[C@H](CN(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000450936609	GH	On-Demand	Anodyne	TACR1	22	45
C[C@@H](CN(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000450936610	GH	On-Demand	Anodyne	TACR1	22	45
Cc1cc(C)c(C#N)c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450936626	ED	On-Demand	Mild	LIMK2	55	31
C[C@H]1CN(c2ccc(C#N)cc2C(F)(F)F)CCN1C(=O)c1cnn(C)c1	ZINC000450936629	GF	On-Demand	Mild	HSD11B1	16	49
CCS(=O)(=O)c1ccc(CSCCN(C)Cc2ccccc2)cc1	ZINC000450936631	FH	On-Demand	Anodyne	RORC	23	45
CCO[C@@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000450936647	CF	On-Demand	Bother	SLC27A4	44	32
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1c[nH]c2nccc-2c1	ZINC000450936659	DH	On-Demand	Anodyne	SLC12A5	69	37
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1c[nH]c2nccc-2c1	ZINC000450936660	DH	On-Demand	Anodyne	SLC12A5	69	37
CCO[C@@H]1CCCC[C@H]1Nc1nc(O)c2ccccc2n1	ZINC000450936667	CG	On-Demand	Anodyne	TNKS	57	33
CCCNC(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1	ZINC000450936669	FD	On-Demand	Anodyne	DRD4	40	32
COC[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450936673	EH	On-Demand	Anodyne	COLA	115	40
COC[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450936673	EH	On-Demand	Anodyne	CPT1A	106	40
COC[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450936673	EH	On-Demand	Anodyne	CPT2	45	36
COC[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450936674	EH	On-Demand	Anodyne	COLA	115	40
COC[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450936674	EH	On-Demand	Anodyne	CPT1A	106	40
COC[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450936674	EH	On-Demand	Anodyne	CPT2	45	36
COC(=O)[C@H]1CN(c2ccc(C#N)cn2)C[C@@H]1c1ccccc1	ZINC000450936696	DE	On-Demand	Mild	SLC6A1	41	41
COC(=O)[C@H]1CN(c2ccc(C#N)cn2)C[C@@H]1c1ccccc1	ZINC000450936696	DE	On-Demand	Mild	SMO	21	42
COC(=O)[C@H]1CN(c2ccc(C#N)cn2)C[C@H]1c1ccccc1	ZINC000450936698	DE	On-Demand	Mild	SLC6A1	41	41
COC(=O)[C@H]1CN(c2ccc(C#N)cn2)C[C@H]1c1ccccc1	ZINC000450936698	DE	On-Demand	Mild	SMO	21	42
Cc1ccnc2[nH]c(SCC(=O)N(C)Cc3ccc(Cl)s3)nc12	ZINC000450936700	FH	On-Demand	Anodyne	ENPP1	31	46
CCO[C@@H]1CCC[C@H]1Nc1ccnc2cc(F)ccc12	ZINC000450936701	CH	On-Demand	Anodyne	HNMT	43	30
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	HTR1A	21	51
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	DRD2	32	43
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	DRD1	20	45
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	DRD4	27	45
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	HTR2A	27	60
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	HTR2C	22	45
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	DRD3	27	45
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	DRD5	21	45
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	ERG2	19	40
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	HTR7	22	44
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	SIGMAR1	20	48
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	HTR5A	19	46
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	SLC18A3	0	48
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	CYP2J2	51	36
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450936707	EH	On-Demand	Anodyne	AP2S1	0	40
Cc1ccnc2[nH]c(SCC(=O)Nc3ccccc3C(C)C)nc12	ZINC000450936715	EI	On-Demand	Anodyne	ENPP1	82	57
COC(=O)c1coc(CN[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450936724	FE	On-Demand	Anodyne	ADRA1D	44	37
COC(=O)c1coc(CN[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450936724	FE	On-Demand	Anodyne	ADRA1A	45	37
COC(=O)c1coc(CN[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450936725	FE	On-Demand	Anodyne	ADRA1D	44	37
COC(=O)c1coc(CN[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)n1	ZINC000450936725	FE	On-Demand	Anodyne	ADRA1A	45	37
COC(=O)c1coc(CN[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450936726	FE	On-Demand	Anodyne	ADRA1D	44	37
COC(=O)c1coc(CN[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450936726	FE	On-Demand	Anodyne	ADRA1A	45	37
COC(=O)c1coc(CN[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450936727	FE	On-Demand	Anodyne	ADRA1D	44	37
COC(=O)c1coc(CN[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000450936727	FE	On-Demand	Anodyne	ADRA1A	45	37
CCO[C@@H]1CCCC[C@H]1Nc1nc2ccccc2[nH]1	ZINC000450936729	CG	On-Demand	Anodyne	KCNN3	42	48
CCC(=O)CCCN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450936740	DG	On-Demand	Anodyne	HTR2A	26	41
COC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936745	GG	On-Demand	Anodyne	DRD4	33	51
COC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936745	GG	On-Demand	Anodyne	DRD3	28	51
COC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936745	GG	On-Demand	Anodyne	HTR4	51	44
COC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936745	GG	On-Demand	Anodyne	SIGMAR1	16	41
COC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936745	GG	On-Demand	Anodyne	CCR3	41	51
COC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936745	GG	On-Demand	Anodyne	MCHR1	24	43
COC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936745	GG	On-Demand	Anodyne	CACNA1I	71	41
COC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936746	GG	On-Demand	Anodyne	DRD4	33	51
COC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936746	GG	On-Demand	Anodyne	DRD3	28	51
COC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936746	GG	On-Demand	Anodyne	HTR4	51	44
COC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936746	GG	On-Demand	Anodyne	SIGMAR1	16	41
COC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936746	GG	On-Demand	Anodyne	CCR3	41	51
COC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936746	GG	On-Demand	Anodyne	MCHR1	24	43
COC(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1Cl	ZINC000450936746	GG	On-Demand	Anodyne	CACNA1I	71	41
CNS(=O)(=O)NCC(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450936759	GB	On-Demand	Anodyne	MMP13	40	41
CNS(=O)(=O)NCC(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450936759	GB	On-Demand	Anodyne	MMP2	19	40
CNS(=O)(=O)NCC(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450936759	GB	On-Demand	Anodyne	MMP3	40	40
CNS(=O)(=O)NCC(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450936759	GB	On-Demand	Anodyne	MMP8	29	40
CNS(=O)(=O)NCC(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450936759	GB	On-Demand	Anodyne	MMP9	36	40
CNS(=O)(=O)NCC(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450936759	GB	On-Demand	Anodyne	MMP7	41	36
CNS(=O)(=O)NCC(=O)N1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000450936759	GB	On-Demand	Anodyne	MMP1	42	40
COC[C@@H]1CCCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450936764	GF	On-Demand	Bother	CASP3	94	46
COC[C@@H]1CCCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450936764	GF	On-Demand	Bother	CASP1	0	42
COC[C@@H]1CCCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450936764	GF	On-Demand	Bother	CASP7	106	44
COC[C@H]1CCCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450936765	GF	On-Demand	Bother	CASP3	94	46
COC[C@H]1CCCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450936765	GF	On-Demand	Bother	CASP1	0	42
COC[C@H]1CCCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000450936765	GF	On-Demand	Bother	CASP7	106	44
CCC(=O)CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450936766	DE	On-Demand	Anodyne	SLC6A1	45	36
CCC(=O)CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450936766	DE	On-Demand	Anodyne	HTR4	46	38
CCC(=O)CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450936766	DE	On-Demand	Anodyne	CYP2J2	43	31
CCC(=O)CCCN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450936767	DE	On-Demand	Anodyne	SLC6A1	45	36
CCC(=O)CCCN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450936767	DE	On-Demand	Anodyne	HTR4	46	38
CCC(=O)CCCN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450936767	DE	On-Demand	Anodyne	CYP2J2	43	31
COC(=O)[C@H]1CN(c2cnc3ccccc3n2)C[C@@H]1c1ccccc1	ZINC000450936784	EG	On-Demand	Anodyne	SLC6A1	61	46
COC(=O)[C@H]1CN(c2cnc3ccccc3n2)C[C@@H]1c1ccccc1	ZINC000450936784	EG	On-Demand	Anodyne	SLC6A3	23	42
COC(=O)[C@H]1CN(c2cnc3ccccc3n2)C[C@H]1c1ccccc1	ZINC000450936785	EG	On-Demand	Anodyne	SLC6A1	61	46
COC(=O)[C@H]1CN(c2cnc3ccccc3n2)C[C@H]1c1ccccc1	ZINC000450936785	EG	On-Demand	Anodyne	SLC6A3	23	42
O=C(CCCN1C[C@H]2COC[C@@H](C1)O2)c1ccc(F)cc1	ZINC000450936799	CD	On-Demand	Anodyne	DRD2	31	46
O=C(CCCN1C[C@H]2COC[C@@H](C1)O2)c1ccc(F)cc1	ZINC000450936799	CD	On-Demand	Anodyne	HTR2A	22	51
O=C(CCCN1C[C@H]2COC[C@@H](C1)O2)c1ccc(F)cc1	ZINC000450936799	CD	On-Demand	Anodyne	CYP2J2	54	38
CCOC(=O)C1CCC(N(CC)CC[C@H](C)O)CC1	ZINC000450936801	CE	On-Demand	Anodyne	CHRNA4	0	45
CCOC(=O)C1CCC(N(CC)CC[C@@H](C)O)CC1	ZINC000450936802	CE	On-Demand	Anodyne	CHRNA4	0	45
COC(=O)[C@H]1CN(c2snc(C)c2C#N)C[C@@H]1c1ccccc1	ZINC000450936803	EF	On-Demand	Mild	SLC6A1	23	40
COC(=O)[C@H]1CN(c2snc(C)c2C#N)C[C@H]1c1ccccc1	ZINC000450936804	EF	On-Demand	Mild	SLC6A1	23	40
CC(C)c1nnc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)s1	ZINC000450936805	EF	On-Demand	Anodyne	HTR4	38	40
CC(C)c1nnc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)s1	ZINC000450936806	EF	On-Demand	Anodyne	HTR4	38	40
COCc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2cc(F)ccc2n1	ZINC000450936830	GF	On-Demand	Anodyne	DHODH	44	35
COc1ccc(-n2c(C)nnc2SCC2(C#N)CCC2)cc1	ZINC000450936831	DG	On-Demand	Mild	WNT3A	21	45
COc1ccc(-n2c(C)nnc2SCC2(C#N)CCC2)cc1	ZINC000450936831	DG	On-Demand	Mild	TNKS2	17	45
COc1ccc(-n2c(C)nnc2SCC2(C#N)CCC2)cc1	ZINC000450936831	DG	On-Demand	Mild	AXIN2	0	49
O[C@H](Cc1ccccc1)CN1CCC[C@H]1c1ccc(Br)cn1	ZINC000450936834	FH	On-Demand	Anodyne	VACHT_TETCF	0	46
O[C@H](Cc1ccccc1)CN1CCC[C@@H]1c1ccc(Br)cn1	ZINC000450936835	FH	On-Demand	Anodyne	VACHT_TETCF	0	46
CCOC(=O)c1ccc(CN2CCCN(c3ccc(F)c(F)c3)CC2)nc1	ZINC000450936838	GG	On-Demand	Anodyne	P2RY12	30	41
O=C(CCCN1CCOC[C@H]1c1ncnn1-c1ccccc1)c1ccccc1	ZINC000450936841	GG	On-Demand	Anodyne	CYP2J2	48	34
O=C(CCCN1CCOC[C@@H]1c1ncnn1-c1ccccc1)c1ccccc1	ZINC000450936842	GG	On-Demand	Anodyne	CYP2J2	48	34
CNS(=O)(=O)c1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450936844	EC	On-Demand	Bother	BDKRB1	0	40
CNS(=O)(=O)c1ccc(SCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000450936844	EC	On-Demand	Bother	COLA	66	33
CN(CCN1CCc2c(cccc2S(=O)(=O)N(C)C)C1)Cc1ccccc1	ZINC000450936849	GE	On-Demand	Anodyne	SIGMAR1	19	48
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	HTR1A	16	42
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	DRD2	29	41
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	DRD1	21	41
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	HTR2A	19	49
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	HTR2C	22	45
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	DRD5	40	34
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	HTR7	33	44
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	SLC18A3	0	44
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	AKR1C3	57	37
CS(=O)(=O)c1ccc2c(c1)CCN(CCCC(=O)c1ccccc1)CC2	ZINC000450936859	FG	On-Demand	Anodyne	CYP2J2	59	42
COc1ccc(-n2c(C)nnc2SCCC(C)(F)F)cc1	ZINC000450936898	DH	On-Demand	Anodyne	WNT3A	23	48
CC(=O)c1cccc(CN2CCCN(S(=O)(=O)C3CC3)CC2)c1	ZINC000450936914	ED	On-Demand	Anodyne	SIGMAR1	28	40
Cc1cccc(N(CCC#N)C(=O)CSc2nc3c(C)ccnc3[nH]2)c1C	ZINC000450936915	GH	On-Demand	Mild	ENPP1	22	43
CC[C@H](Nc1ccc(C(=O)c2ccccc2C(=O)OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936981	GF	On-Demand	Bother	TAAR1	19	43
CC[C@@H](Nc1ccc(C(=O)c2ccccc2C(=O)OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450936982	GF	On-Demand	Bother	TAAR1	19	43
CCNC(=O)C[C@@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450937003	DG	On-Demand	Anodyne	HRH3	26	41
CCNC(=O)C[C@@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450937003	DG	On-Demand	Anodyne	SPHK2	42	48
CCNC(=O)C[C@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450937005	DG	On-Demand	Anodyne	HRH3	26	41
CCNC(=O)C[C@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450937005	DG	On-Demand	Anodyne	SPHK2	42	48
CC[C@@H](Nc1ncc([N+](=O)[O-])s1)C(=O)NC	ZINC000450937006	BC	On-Demand	Bother	MAPK9	0	45
COc1ccc(N2CCN(c3cc(C)nc(OC)n3)CC2)nc1	ZINC000450937007	DD	On-Demand	Anodyne	SORD	23	40
COc1ccc(N2CCN(c3cc(C)nc(OC)n3)CC2)nc1	ZINC000450937007	DD	On-Demand	Anodyne	GALR2	41	33
CC[C@H](Nc1ncc([N+](=O)[O-])s1)C(=O)NC	ZINC000450937008	BC	On-Demand	Bother	MAPK9	0	45
COc1ccc(N2CCN(c3ncnc4cccc(C)c34)CC2)nc1	ZINC000450937020	EF	On-Demand	Anodyne	PDE3B	57	33
CCOc1cccc(CN(CCO)c2ccc(C(F)(F)F)cn2)c1	ZINC000450937024	EG	On-Demand	Anodyne	CETP	0	45
CCOc1cccc(CN(CCO)c2ccc(C(F)(F)F)cn2)c1	ZINC000450937024	EG	On-Demand	Anodyne	PDS	50	34
CNS(=O)(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)c(F)c1	ZINC000450937034	GD	On-Demand	Anodyne	SLC6A9	22	43
CNS(=O)(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)c(F)c1	ZINC000450937034	GD	On-Demand	Anodyne	GPR119	24	44
COc1ccc(N2CCN(c3nc(-c4ccccn4)nc4c3CCC4)CC2)nc1	ZINC000450937039	GF	On-Demand	Anodyne	DRD4	22	40
COc1ccc(N2CCN(c3nc(-c4ccccn4)nc4c3CCC4)CC2)nc1	ZINC000450937039	GF	On-Demand	Anodyne	EBP	19	41
CCOc1cccc(CN(CCO)c2nc(C(F)(F)F)ns2)c1	ZINC000450937047	EF	On-Demand	Anodyne	CETP	0	43
COc1ccc(N2CCN(c3nc(C)cc(C(F)(F)F)n3)CC2)nc1	ZINC000450937048	FF	On-Demand	Anodyne	SORD	29	45
COc1ccc(N2CCN(c3nc(C)cc(C(F)(F)F)n3)CC2)nc1	ZINC000450937048	FF	On-Demand	Anodyne	GALR2	40	35
CCOc1cccc(CN(CCO)c2ncc(Br)cn2)c1	ZINC000450937057	FF	On-Demand	Anodyne	CETP	0	41
O[C@@H](COCc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450937085	GH	On-Demand	Anodyne	ABCB1	41	36
O[C@H](COCc1ccc(Cl)cc1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450937086	GH	On-Demand	Anodyne	ABCB1	41	36
COc1ccc(N2CCN(c3cc(NCC4CC4)ncn3)CC2)nc1	ZINC000450937087	EE	On-Demand	Anodyne	PDE3B	43	33
COc1ccc(N2CCN(c3cc(NCC4CC4)ncn3)CC2)nc1	ZINC000450937087	EE	On-Demand	Anodyne	GALR2	42	33
COc1ccc(N2CCN(c3cc(NCC4CC4)ncn3)CC2)nc1	ZINC000450937087	EE	On-Demand	Anodyne	GPR39	0	45
C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N1CCC(F)(c2ccccn2)CC1	ZINC000450937094	GG	On-Demand	Anodyne	PRNP	44	39
C[C@H](C(=O)N1CCN(c2ccccc2)CC1)N1CCC(F)(c2ccccn2)CC1	ZINC000450937095	GG	On-Demand	Anodyne	PRNP	44	39
COc1ccc(N2CCN(c3cc(C)nc4ccccc34)CC2)nc1	ZINC000450937098	EG	On-Demand	Anodyne	HTR1A	43	36
COc1ccc(N2CCN(c3cc(C)nc4ccccc34)CC2)nc1	ZINC000450937098	EG	On-Demand	Anodyne	HTR1D	42	33
COc1ccc(N2CCN(c3cc(C)nc4ccccc34)CC2)nc1	ZINC000450937098	EG	On-Demand	Anodyne	HTR1B	54	41
COc1ccc(N2CCN(c3cc(C)nc4ccccc34)CC2)nc1	ZINC000450937098	EG	On-Demand	Anodyne	METAP1	45	40
COc1ccc(N2CCN(c3cc(C)nc4ccccc34)CC2)nc1	ZINC000450937098	EG	On-Demand	Anodyne	CCKAR	0	42
COc1ccc(N2CCN(c3cc(C)nc4ccccc34)CC2)nc1	ZINC000450937098	EG	On-Demand	Anodyne	ADAM17	61	36
COc1ccc(N2CCN(c3cc(C)nc4ccccc34)CC2)nc1	ZINC000450937098	EG	On-Demand	Anodyne	SORD	41	39
COc1ccc(N2CCN(c3cc(C)nc4ccccc34)CC2)nc1	ZINC000450937098	EG	On-Demand	Anodyne	ATP4A	23	40
CCNC(=O)C[C@@H]1CCCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450937109	GH	On-Demand	Anodyne	CYP2J2	49	36
CCNC(=O)C[C@H]1CCCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450937110	GH	On-Demand	Anodyne	CYP2J2	49	36
c1coc(CN(CCN2CCOCC2)c2nc3ccccc3[nH]2)c1	ZINC000450937111	EE	On-Demand	Anodyne	CASR	26	41
COC[C@@H]1CCCCN1c1ccnc(Cc2ccccc2)n1	ZINC000450937126	CG	On-Demand	Anodyne	NOS2	16	40
COC[C@H]1CCCCN1c1ccnc(Cc2ccccc2)n1	ZINC000450937127	CG	On-Demand	Anodyne	NOS2	16	40
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)c(OC)c3)CC2)cc1	ZINC000450937128	GF	On-Demand	Anodyne	HTR1A	18	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)c(OC)c3)CC2)cc1	ZINC000450937128	GF	On-Demand	Anodyne	DRD2	20	46
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)c(OC)c3)CC2)cc1	ZINC000450937128	GF	On-Demand	Anodyne	DRD1	25	50
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)c(OC)c3)CC2)cc1	ZINC000450937128	GF	On-Demand	Anodyne	DRD4	43	39
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)c(OC)c3)CC2)cc1	ZINC000450937128	GF	On-Demand	Anodyne	DRD3	17	41
CCS(=O)(=O)c1ccc(CN2CCN(c3ccc(F)c(OC)c3)CC2)cc1	ZINC000450937128	GF	On-Demand	Anodyne	AVPR1B	40	34
COC[C@@H]1CCCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1	ZINC000450937165	FF	On-Demand	Bother	SLC27A4	43	33
COC[C@H]1CCCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1	ZINC000450937166	FF	On-Demand	Bother	SLC27A4	43	33
COC(=O)[C@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccccc1	ZINC000450937169	FG	On-Demand	Anodyne	SLC6A1	48	45
COC(=O)[C@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccccc1	ZINC000450937169	FG	On-Demand	Anodyne	SLC6A3	18	40
COC(=O)[C@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccccc1	ZINC000450937169	FG	On-Demand	Anodyne	SORD	40	35
COC(=O)[C@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1c1ccccc1	ZINC000450937170	FG	On-Demand	Anodyne	SLC6A1	48	45
COC(=O)[C@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1c1ccccc1	ZINC000450937170	FG	On-Demand	Anodyne	SLC6A3	18	40
COC(=O)[C@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1c1ccccc1	ZINC000450937170	FG	On-Demand	Anodyne	SORD	40	35
COC(=O)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccccc1	ZINC000450937171	FG	On-Demand	Anodyne	SLC6A1	48	45
COC(=O)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccccc1	ZINC000450937171	FG	On-Demand	Anodyne	SLC6A3	18	40
COC(=O)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)C[C@H]1c1ccccc1	ZINC000450937171	FG	On-Demand	Anodyne	SORD	40	35
C[C@H]1CN(c2ncc(C(F)(F)F)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450937178	GF	On-Demand	Anodyne	CXCR3	29	43
C[C@H]1CN(c2ncc(C(F)(F)F)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450937178	GF	On-Demand	Anodyne	SLC6A7	0	42
Cc1ccnc2[nH]c(SCC(=O)N(CC(C)C)C(C)C)nc12	ZINC000450937192	DG	On-Demand	Anodyne	ENPP1	32	50
COCC[C@@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450937205	FH	On-Demand	Anodyne	FKBP1A	46	36
COCC[C@@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450937205	FH	On-Demand	Anodyne	SLC12A5	65	39
COCC[C@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450937206	FH	On-Demand	Anodyne	FKBP1A	46	36
COCC[C@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450937206	FH	On-Demand	Anodyne	SLC12A5	65	39
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NCc1cn(CC2CC2)nn1	ZINC000450937209	FG	On-Demand	Anodyne	GBA	17	41
CC1(C)CN(Cc2ccccc2)CC[C@H]1NCc1cn(CC2CC2)nn1	ZINC000450937210	FG	On-Demand	Anodyne	GBA	17	41
CCOC(=O)c1ccc(CN2CCc3cc(F)ccc32)nc1	ZINC000450937213	DF	On-Demand	Anodyne	SRD5A1	24	43
CCOC(=O)c1ccc(CN2CCc3cc(F)ccc32)nc1	ZINC000450937213	DF	On-Demand	Anodyne	SRD5A2	29	43
CCOC(=O)c1ccc(CN2CCc3cc(F)ccc32)nc1	ZINC000450937213	DF	On-Demand	Anodyne	GABRA4	23	40
CCOC(=O)c1ccc(CN2CCc3cc(F)ccc32)nc1	ZINC000450937213	DF	On-Demand	Anodyne	GABRA5	34	40
CCOC(=O)c1ccc(CN2CCC(N3CCc4cc(F)ccc43)CC2)nc1	ZINC000450937216	GG	On-Demand	Anodyne	SSTR5	45	40
CCOC(=O)c1ccc(CN2CCC(N3CCc4cc(F)ccc43)CC2)nc1	ZINC000450937216	GG	On-Demand	Anodyne	SCD1	30	43
CCOC(=O)c1ccc(CN2CCC(N3CCc4cc(F)ccc43)CC2)nc1	ZINC000450937216	GG	On-Demand	Anodyne	SCD	24	41
CCCCN(CC)C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450937217	DG	On-Demand	Anodyne	ENPP1	32	49
COC(=O)[C@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@@H]1c1ccccc1	ZINC000450937218	FG	On-Demand	Anodyne	SLC6A1	43	41
COC(=O)[C@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@@H]1c1ccccc1	ZINC000450937218	FG	On-Demand	Anodyne	ADAM33	0	42
COC(=O)[C@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@H]1c1ccccc1	ZINC000450937221	FG	On-Demand	Anodyne	SLC6A1	43	41
COC(=O)[C@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@H]1c1ccccc1	ZINC000450937221	FG	On-Demand	Anodyne	ADAM33	0	42
COC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@H]1c1ccccc1	ZINC000450937223	FG	On-Demand	Anodyne	SLC6A1	43	41
COC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@H]1c1ccccc1	ZINC000450937223	FG	On-Demand	Anodyne	ADAM33	0	42
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])s2)C[C@@H]1c1ccccc1	ZINC000450937225	EE	On-Demand	Bother	SLC6A1	23	40
CCOC(=O)C1CCN(C(=O)CSc2nc3c(C)ccnc3[nH]2)CC1	ZINC000450937226	FE	On-Demand	Anodyne	ENPP1	46	48
CCOC(=O)C1CCN(C(=O)CSc2nc3c(C)ccnc3[nH]2)CC1	ZINC000450937226	FE	On-Demand	Anodyne	PTR1	50	37
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])s2)C[C@H]1c1ccccc1	ZINC000450937227	EE	On-Demand	Bother	SLC6A1	23	40
C[C@H]1CN(c2ccc3ccc(F)cc3n2)CCN1C(=O)c1cnn(C)c1	ZINC000450937236	FE	On-Demand	Anodyne	HCRTR1	46	36
CCO[C@@H]1CCC[C@H]1Nc1ncnc2ccc(SC)cc12	ZINC000450937237	DH	On-Demand	Anodyne	CD38	50	42
Cc1ccnc2[nH]c(SCC(=O)N(CC(F)(F)F)C(C)C)nc12	ZINC000450937238	EG	On-Demand	Anodyne	ENPP1	25	48
Cc1ccc(C#N)c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450937260	DD	On-Demand	Mild	LIMK2	42	31
COCCOc1ccc(CNC(=O)CSc2nc3c(C)ccnc3[nH]2)cc1	ZINC000450937263	GF	On-Demand	Anodyne	ENPP1	79	55
COC[C@H]1CCCCN1c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000450937280	CE	On-Demand	Mild	CASP3	46	37
COC[C@H]1CCCCN1c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000450937280	CE	On-Demand	Mild	CASP7	55	37
COC[C@@H]1CCCCN1c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000450937281	CE	On-Demand	Mild	CASP3	46	37
COC[C@@H]1CCCCN1c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000450937281	CE	On-Demand	Mild	CASP7	55	37
CCc1nc(C)cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)n1	ZINC000450937286	EF	On-Demand	Anodyne	SLC6A1	48	40
CCc1nc(C)cc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)n1	ZINC000450937287	EF	On-Demand	Anodyne	SLC6A1	48	40
CC(=O)c1ccc(CN2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1	ZINC000450937292	EI	On-Demand	Anodyne	SIGMAR1	21	41
CC(=O)c1ccc(CN2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1	ZINC000450937293	EI	On-Demand	Anodyne	SIGMAR1	21	41
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937296	FG	On-Demand	Anodyne	HTR2A	16	41
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937296	FG	On-Demand	Anodyne	HTR2C	17	41
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937296	FG	On-Demand	Anodyne	SLC6A1	109	39
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937296	FG	On-Demand	Anodyne	SIGMAR1	15	50
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937296	FG	On-Demand	Anodyne	CYP2J2	58	40
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937297	FG	On-Demand	Anodyne	HTR2A	16	41
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937297	FG	On-Demand	Anodyne	HTR2C	17	41
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937297	FG	On-Demand	Anodyne	SLC6A1	109	39
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937297	FG	On-Demand	Anodyne	SIGMAR1	15	50
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccccc1	ZINC000450937297	FG	On-Demand	Anodyne	CYP2J2	58	40
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450937311	FF	On-Demand	Anodyne	DRD3	0	42
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450937312	FF	On-Demand	Anodyne	DRD3	0	42
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450937313	FF	On-Demand	Anodyne	DRD3	0	42
CO[C@H](Cc1ccccc1)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450937314	FF	On-Demand	Anodyne	DRD3	0	42
COC(=O)[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1cc(C)cc(C)c1	ZINC000450937318	FG	On-Demand	Anodyne	EPHX2	21	40
COC(=O)[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1cc(C)cc(C)c1	ZINC000450937319	FG	On-Demand	Anodyne	EPHX2	21	40
COC(=O)[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1cc(C)cc(C)c1	ZINC000450937320	FG	On-Demand	Anodyne	EPHX2	21	40
COC(=O)[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1cc(C)cc(C)c1	ZINC000450937321	FG	On-Demand	Anodyne	EPHX2	21	40
CC[C@@H](Nc1ncccc1[N+](=O)[O-])C(=O)NC	ZINC000450937322	BC	On-Demand	Bother	COLA	48	36
CC[C@H](Nc1ncccc1[N+](=O)[O-])C(=O)NC	ZINC000450937323	BC	On-Demand	Bother	COLA	48	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	MME	66	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	ANPEP	65	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	CTSB	41	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	PAPA1_CARPA	47	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	TIMP3	40	32
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	CAPNS1	46	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	HLA-DRB1	49	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	SOAT1	0	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	CAPN1	48	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	CAPN2	57	33
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	ACE2	47	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	POL	0	42
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937353	FF	On-Demand	Anodyne	PENP_PENJA	0	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	MME	66	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	ANPEP	65	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	CTSB	41	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	PAPA1_CARPA	47	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	TIMP3	40	32
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	CAPNS1	46	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	HLA-DRB1	49	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	SOAT1	0	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	CAPN1	48	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	CAPN2	57	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	ACE2	47	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	POL	0	42
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937354	FF	On-Demand	Anodyne	PENP_PENJA	0	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	MME	66	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	ANPEP	65	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	CTSB	41	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	PAPA1_CARPA	47	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	TIMP3	40	32
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	CAPNS1	46	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	HLA-DRB1	49	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	SOAT1	0	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	CAPN1	48	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	CAPN2	57	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	ACE2	47	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937355	FF	On-Demand	Anodyne	PENP_PENJA	0	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	MME	66	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	ANPEP	65	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	CTSB	41	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	PAPA1_CARPA	47	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	SLC15A1	0	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	TIMP3	40	32
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	CAPNS1	46	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	HLA-DRB1	49	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	SOAT1	0	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	CAPN1	48	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	CAPN2	57	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	ACE2	47	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(C)c(C)c1	ZINC000450937356	FF	On-Demand	Anodyne	PENP_PENJA	0	40
CC[C@@H](Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1)C(=O)NC	ZINC000450937357	DC	On-Demand	Bother	F2RL3	45	34
CC[C@H](Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1)C(=O)NC	ZINC000450937358	DC	On-Demand	Bother	F2RL3	45	34
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	HTR1A	29	67
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	DRD2	38	51
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	DRD1	30	51
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	DRD4	30	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	HRH2	0	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	HTR2A	39	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	HTR2C	36	58
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	SLC6A1	67	36
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	SLC6A4	23	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	HRH1	25	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	DRD3	31	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	DRD5	25	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	ERG2	22	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	HTR7	40	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	SIGMAR1	36	50
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	SLC18A3	28	52
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	HTR3B	0	51
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	ABCB1	0	42
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	CYP2J2	65	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	NET	0	50
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1Cc1ccccc1	ZINC000450937378	FH	On-Demand	Anodyne	AP2S1	0	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	HTR1A	29	67
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	DRD2	38	51
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	DRD1	30	51
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	DRD4	30	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	HRH2	0	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	HTR2A	39	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	HTR2C	36	58
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	SLC6A1	67	36
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	SLC6A4	23	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	HRH1	25	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	DRD3	31	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	DRD5	25	54
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	ERG2	22	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	HTR7	40	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	SIGMAR1	36	50
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	SLC18A3	28	52
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	HTR3B	0	51
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	ABCB1	0	42
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	CYP2J2	65	46
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	NET	0	50
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1Cc1ccccc1	ZINC000450937379	FH	On-Demand	Anodyne	AP2S1	0	46
C[C@@H]1C[C@@H](O)CN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450937388	EE	On-Demand	Anodyne	HSD11B1	20	42
C[C@H]1C[C@H](O)CN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450937389	EE	On-Demand	Anodyne	HSD11B1	20	42
C[C@H]1C[C@@H](O)CN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)C1	ZINC000450937390	EE	On-Demand	Anodyne	HSD11B1	20	42
CCc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)ccn1	ZINC000450937402	DD	On-Demand	Anodyne	SLC6A7	0	44
CCc1cc(N(C)Cc2ccc(C)c(C)c2)n2ncnc2n1	ZINC000450937421	CF	On-Demand	Anodyne	DHOD	0	40
Cc1cc(N(C)Cc2ccc(C)c(C)c2)n2ncnc2n1	ZINC000450937423	CF	On-Demand	Anodyne	DHOD	0	49
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	MME	72	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	ANPEP	71	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	PTGER3	43	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	CTSB	52	41
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	PAPA1_CARPA	48	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	TIMP3	41	33
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	CAPNS1	63	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	SOAT1	22	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	CAPN1	66	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	CAPN2	65	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	ACE2	58	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	POL	0	46
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	NPR	22	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	HDA106	0	41
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937431	FF	On-Demand	Anodyne	PENP_PENJA	0	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	MME	72	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	ANPEP	71	38
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	PTGER3	43	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	CTSB	52	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	PAPA1_CARPA	48	38
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	TIMP3	41	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	CAPNS1	63	38
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	SOAT1	22	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	CAPN1	66	38
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	CAPN2	65	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	ACE2	58	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	POL	0	46
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	NPR	22	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	HDA106	0	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937433	FF	On-Demand	Anodyne	PENP_PENJA	0	41
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	MME	72	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	ANPEP	71	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	PTGER3	43	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	CTSB	52	41
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	PAPA1_CARPA	48	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	TIMP3	41	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	CAPNS1	63	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	SOAT1	22	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	CAPN1	66	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	CAPN2	65	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	ACE2	58	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	POL	0	46
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	NPR	22	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	HDA106	0	41
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937435	FF	On-Demand	Anodyne	PENP_PENJA	0	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	MME	72	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	ANPEP	71	38
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	PTGER3	43	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	CTSB	52	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	PAPA1_CARPA	48	38
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	TIMP3	41	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	CAPNS1	63	38
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	SOAT1	22	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	CAPN1	66	38
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	CAPN2	65	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	ACE2	58	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	POL	0	46
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	NPR	22	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	HDA106	0	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1cc(C)cc(C)c1	ZINC000450937437	FF	On-Demand	Anodyne	PENP_PENJA	0	41
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	HTR1A	43	39
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	DRD2	48	40
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	DRD4	33	41
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	ADRA1D	17	40
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	HTR2A	41	43
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	HTR2C	38	42
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	SLC6A4	21	43
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	ADRA1A	16	40
COC(=O)c1csc(CN2CCCN(c3cccc(Cl)c3C)CC2)n1	ZINC000450937447	GH	On-Demand	Anodyne	DRD3	64	37
C[C@]12CN(c3ncc(C(=O)N4CCOCC4)cc3Cl)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000450937455	GG	On-Demand	Anodyne	CXCR3	26	40
C[C@]12CN(c3ncc(C(=O)N4CCOCC4)cc3Cl)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000450937456	GG	On-Demand	Anodyne	CXCR3	26	40
COc1cc(CN2CCCN(S(=O)(=O)C3CC3)CC2)ccc1Cl	ZINC000450937460	FE	On-Demand	Anodyne	ACHE	17	45
COc1cc(CN2CCCN(S(=O)(=O)C3CC3)CC2)ccc1Cl	ZINC000450937460	FE	On-Demand	Anodyne	AVPR1B	43	35
COc1cc(CN2CCCN(S(=O)(=O)C3CC3)CC2)ccc1Cl	ZINC000450937460	FE	On-Demand	Anodyne	SSTR5	51	39
Cc1ccc(CN(C)c2cc(C(F)(F)F)nc3ncnn23)cc1C	ZINC000450937471	EG	On-Demand	Anodyne	DHOD	0	41
COc1ccc(-n2c(C)nnc2SC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450937477	EG	On-Demand	Anodyne	WNT3A	22	45
COc1ccc(-n2c(C)nnc2SC[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450937477	EG	On-Demand	Anodyne	AXIN2	0	49
COc1ccc(-n2c(C)nnc2SC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450937478	EG	On-Demand	Anodyne	WNT3A	22	45
COc1ccc(-n2c(C)nnc2SC[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450937478	EG	On-Demand	Anodyne	AXIN2	0	49
CCS(=O)(=O)c1ccc(CN(CCOCCO)C(C)C)cc1	ZINC000450937479	ED	On-Demand	Anodyne	RORC	15	40
COc1ccc(-n2c(C)nnc2SCC2CC(F)(F)C2)cc1	ZINC000450937507	EH	On-Demand	Anodyne	WNT3A	22	47
COc1ccc(-n2c(C)nnc2SCC2CC(F)(F)C2)cc1	ZINC000450937507	EH	On-Demand	Anodyne	AXIN2	0	52
FC1(c2ccccn2)CCN(CCOc2ccccc2Cl)CC1	ZINC000450937519	EI	On-Demand	Anodyne	LTA4H	31	41
CC[C@H](C)[C@H](O)C(=O)N[C@@H](C(=O)OC)c1ccc(O)cc1	ZINC000450937527	CD	On-Demand	Anodyne	ACE2	35	40
CC[C@H](C)[C@H](O)C(=O)N[C@@H](C(=O)OC)c1ccc(O)cc1	ZINC000450937527	CD	On-Demand	Anodyne	SLC15A2	0	42
CC[C@H](C)[C@@H](O)C(=O)N[C@H](C(=O)OC)c1ccc(O)cc1	ZINC000450937528	CD	On-Demand	Anodyne	ACE2	35	40
CC[C@H](C)[C@@H](O)C(=O)N[C@H](C(=O)OC)c1ccc(O)cc1	ZINC000450937528	CD	On-Demand	Anodyne	SLC15A2	0	42
CC[C@H](C)[C@H](O)C(=O)N[C@H](C(=O)OC)c1ccc(O)cc1	ZINC000450937529	CD	On-Demand	Anodyne	ACE2	35	40
CC[C@H](C)[C@H](O)C(=O)N[C@H](C(=O)OC)c1ccc(O)cc1	ZINC000450937529	CD	On-Demand	Anodyne	SLC15A2	0	42
CC[C@H](C)[C@@H](O)C(=O)N[C@@H](C(=O)OC)c1ccc(O)cc1	ZINC000450937530	CD	On-Demand	Anodyne	ACE2	35	40
CC[C@H](C)[C@@H](O)C(=O)N[C@@H](C(=O)OC)c1ccc(O)cc1	ZINC000450937530	CD	On-Demand	Anodyne	SLC15A2	0	42
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	MME	60	39
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	ANPEP	41	31
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	MMP13	22	41
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	PAPA1_CARPA	44	39
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	CPA1	42	36
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	CAPNS1	60	32
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	MMP9	22	41
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	CAPN2	46	33
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	ADAMTS4	42	37
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	MMP1	19	41
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937539	GF	On-Demand	Anodyne	RORC	40	41
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	MME	60	39
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	ANPEP	41	31
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	MMP13	22	41
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	PAPA1_CARPA	44	39
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	CPA1	42	36
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	CAPNS1	60	32
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	MMP9	22	41
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	CAPN2	46	33
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	ADAMTS4	42	37
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	MMP1	19	41
CCS(=O)(=O)c1ccc(CN[C@@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937540	GF	On-Demand	Anodyne	RORC	40	41
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	MME	60	39
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	ANPEP	41	31
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	MMP13	22	41
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	PAPA1_CARPA	44	39
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	CPA1	42	36
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	CAPNS1	60	32
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	MMP9	22	41
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	CAPN2	46	33
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	ADAMTS4	42	37
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	MMP1	19	41
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937541	GF	On-Demand	Anodyne	RORC	40	41
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	MME	60	39
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	ANPEP	41	31
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	MMP13	22	41
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	PAPA1_CARPA	44	39
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	CPA1	42	36
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	CAPNS1	60	32
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	MMP9	22	41
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	CAPN2	46	33
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	ADAMTS4	42	37
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	MMP1	19	41
CCS(=O)(=O)c1ccc(CN[C@H](C)[C@H](Cc2ccccc2)C(=O)OC)cc1	ZINC000450937542	GF	On-Demand	Anodyne	RORC	40	41
COc1ccc(N2CCN(c3nccc(OCc4ccccc4)n3)CC2)nc1	ZINC000450937543	GF	On-Demand	Anodyne	DRD4	15	45
COc1ccc(N2CCN(c3nccc(OCc4ccccc4)n3)CC2)nc1	ZINC000450937543	GF	On-Demand	Anodyne	SORD	45	37
COc1ccc(N2CCN(c3nccc(OCc4ccccc4)n3)CC2)nc1	ZINC000450937543	GF	On-Demand	Anodyne	SLC6A7	0	43
O=C(CN1CCC(F)(c2ccccn2)CC1)NC1CCCCC1	ZINC000450937545	DF	On-Demand	Anodyne	EPHX2	32	40
COc1ccc(N2CCN(c3ccc(C(F)(F)F)cc3C#N)CC2)nc1	ZINC000450937548	FG	On-Demand	Mild	LIPG	42	35
COc1ccc(N2CCN(c3ccc(C(F)(F)F)cc3C#N)CC2)nc1	ZINC000450937548	FG	On-Demand	Mild	SGPL1	0	40
COc1ccc(N2CCN(c3ccc(C(F)(F)F)cc3C#N)CC2)nc1	ZINC000450937548	FG	On-Demand	Mild	SMO	27	45
COc1ccc(N2CCN(c3cc(Cl)ccc3C#N)CC2)nc1	ZINC000450937554	EF	On-Demand	Mild	PAK1	42	37
COc1ccc(N2CCN(c3cccc(Cl)c3C#N)CC2)nc1	ZINC000450937558	EF	On-Demand	Mild	PAK1	56	36
O=C(CCCN1CCC[C@@H]1[C@@H]1CCCO1)c1ccc(Br)cc1	ZINC000450937559	FI	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCC[C@H]1[C@H]1CCCO1)c1ccc(Br)cc1	ZINC000450937560	FI	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCC[C@@H]1[C@H]1CCCO1)c1ccc(Br)cc1	ZINC000450937561	FI	On-Demand	Anodyne	CYP2J2	52	37
O=C(CCCN1CCC[C@H]1[C@@H]1CCCO1)c1ccc(Br)cc1	ZINC000450937562	FI	On-Demand	Anodyne	CYP2J2	52	37
COc1ccc(N2CCN(c3cccc(C(F)(F)F)n3)CC2)nc1	ZINC000450937572	EF	On-Demand	Anodyne	DRD4	15	40
COc1ccc(N2CCN(c3cccc(C(F)(F)F)n3)CC2)nc1	ZINC000450937572	EF	On-Demand	Anodyne	EBP	16	40
C[C@H](C(=O)Nc1cc(Cl)ccc1F)N1CCC(F)(c2ccccn2)CC1	ZINC000450937575	GI	On-Demand	Anodyne	CACNA1H	44	35
C[C@H](C(=O)Nc1cc(Cl)ccc1F)N1CCC(F)(c2ccccn2)CC1	ZINC000450937575	GI	On-Demand	Anodyne	SLC6A9	25	41
C[C@H](C(=O)Nc1cc(Cl)ccc1F)N1CCC(F)(c2ccccn2)CC1	ZINC000450937575	GI	On-Demand	Anodyne	PANK3	0	46
C[C@@H](C(=O)Nc1cc(Cl)ccc1F)N1CCC(F)(c2ccccn2)CC1	ZINC000450937576	GI	On-Demand	Anodyne	CACNA1H	44	35
C[C@@H](C(=O)Nc1cc(Cl)ccc1F)N1CCC(F)(c2ccccn2)CC1	ZINC000450937576	GI	On-Demand	Anodyne	SLC6A9	25	41
C[C@@H](C(=O)Nc1cc(Cl)ccc1F)N1CCC(F)(c2ccccn2)CC1	ZINC000450937576	GI	On-Demand	Anodyne	PANK3	0	46
CC(=O)NCCc1ccc(C(=O)COc2ccc(C(F)(F)F)cc2F)cc1	ZINC000450937585	GH	On-Demand	Anodyne	PPARA	21	40
CC(=O)NCCc1ccc(C(=O)COc2ccc(C(F)(F)F)cc2F)cc1	ZINC000450937585	GH	On-Demand	Anodyne	RAF1	20	40
CC(=O)NCCc1ccc(C(=O)COc2ccc(C(F)(F)F)cc2F)cc1	ZINC000450937585	GH	On-Demand	Anodyne	PPARD	62	38
COc1ccc(N2CCN(c3cccc(F)c3C(C)=O)CC2)nc1	ZINC000450937586	EF	On-Demand	Anodyne	DRD4	46	37
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2CCO)c(OC)c1	ZINC000450937587	FE	On-Demand	Anodyne	MTNR1A	44	36
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2CCO)c(OC)c1	ZINC000450937587	FE	On-Demand	Anodyne	ACKR3	66	34
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2CCO)c(OC)c1	ZINC000450937588	FE	On-Demand	Anodyne	MTNR1A	44	36
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2CCO)c(OC)c1	ZINC000450937588	FE	On-Demand	Anodyne	ACKR3	66	34
COC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nc1OC	ZINC000450937595	GD	On-Demand	Anodyne	CASR	41	36
COc1ccc(N2CCN(c3cc(C)nc4ccc([N+](=O)[O-])cc34)CC2)nc1	ZINC000450937596	GG	On-Demand	Bother	GYRB	0	54
COc1nc(C)cc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450937612	ED	On-Demand	Anodyne	CASR	25	42
CC(C)CNC(=O)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450937613	EF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CC[C@@H](Nc1nccc(Oc2ccccc2)n1)C(=O)NC	ZINC000450937619	CE	On-Demand	Anodyne	ACE2	41	38
CC[C@H](Nc1nccc(Oc2ccccc2)n1)C(=O)NC	ZINC000450937620	CE	On-Demand	Anodyne	ACE2	41	38
C[C@@H]1C[C@H](O)CN(c2cc(N3C[C@@H](O)C[C@@H](C)C3)nc(-c3ccccc3)n2)C1	ZINC000450937621	GF	On-Demand	Anodyne	P2RY12	40	31
C[C@H]1C[C@H](O)CN(c2cc(N3C[C@@H](O)C[C@@H](C)C3)nc(-c3ccccc3)n2)C1	ZINC000450937622	GF	On-Demand	Anodyne	P2RY12	40	31
C[C@@H]1C[C@H](O)CN(c2cc(N3C[C@H](C)C[C@@H](O)C3)nc(-c3ccccc3)n2)C1	ZINC000450937623	GF	On-Demand	Anodyne	P2RY12	40	31
COC[C@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1S(C)(=O)=O	ZINC000450937626	FD	On-Demand	Anodyne	CASP3	59	42
COC[C@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1S(C)(=O)=O	ZINC000450937626	FD	On-Demand	Anodyne	CASP7	50	41
COC[C@@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1S(C)(=O)=O	ZINC000450937627	FD	On-Demand	Anodyne	CASP3	59	42
COC[C@@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1S(C)(=O)=O	ZINC000450937627	FD	On-Demand	Anodyne	CASP7	50	41
COC(=O)[C@@H]1CN(c2ccc(C#N)c(C)n2)C[C@H]1c1ccccc1	ZINC000450937631	DF	On-Demand	Mild	SLC6A1	31	40
COC(=O)[C@H]1CN(c2ccc(C#N)c(C)n2)C[C@H]1c1ccccc1	ZINC000450937632	DF	On-Demand	Mild	SLC6A1	31	40
CC[C@@H](Nc1ncnc2c(OC)cc(OC)cc12)C(=O)NC	ZINC000450937633	DD	On-Demand	Anodyne	PDE6A	42	32
COC(=O)[C@H]1CN(c2ccc(C#N)c(C)n2)C[C@@H]1c1ccccc1	ZINC000450937634	DF	On-Demand	Mild	SLC6A1	31	40
CC[C@H](Nc1ncnc2c(OC)cc(OC)cc12)C(=O)NC	ZINC000450937635	DD	On-Demand	Anodyne	PDE6A	42	32
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccsc1	ZINC000450937657	GH	On-Demand	Anodyne	NPBWR1	48	32
COC(=O)[C@H]1CN(c2ncncc2Br)C[C@@H]1c1ccccc1	ZINC000450937661	FF	On-Demand	Anodyne	SLC6A1	57	42
COC(=O)[C@H]1CN(c2ncncc2Br)C[C@H]1c1ccccc1	ZINC000450937664	FF	On-Demand	Anodyne	SLC6A1	57	42
Cc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1	ZINC000450937669	CD	On-Demand	Anodyne	HCRTR1	49	37
Cc1ccnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c1	ZINC000450937669	CD	On-Demand	Anodyne	SLC6A7	0	46
CCC1(CC)CN(C(=O)C2=C(c3ccccc3)CCC2)CC[S@@]1=O	ZINC000450937675	EH	On-Demand	Anodyne	CHRM5	34	40
CCC1(CC)CN(C(=O)C2=C(c3ccccc3)CCC2)CC[S@]1=O	ZINC000450937679	EH	On-Demand	Anodyne	CHRM5	34	40
C[C@H]1CN(c2ncc(Cl)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450937690	DD	On-Demand	Anodyne	SLC6A7	0	59
COC[C@@H]1CCCCN(C(=O)c2c(C)cccc2Cl)C1	ZINC000450937737	CH	On-Demand	Anodyne	CCR5	22	46
COC[C@H]1CCCCN(C(=O)c2c(C)cccc2Cl)C1	ZINC000450937740	CH	On-Demand	Anodyne	CCR5	22	46
COC(=O)[C@H]1CN(c2nc(C(F)(F)F)ns2)C[C@@H]1c1ccccc1	ZINC000450937745	FF	On-Demand	Anodyne	SLC6A1	34	40
COC(=O)[C@H]1CN(c2nc(C(F)(F)F)ns2)C[C@H]1c1ccccc1	ZINC000450937749	FF	On-Demand	Anodyne	SLC6A1	34	40
COC(=O)[C@H]1CN(c2ncnc3c(F)c(OC)ccc23)C[C@@H]1c1ccccc1	ZINC000450937762	GG	On-Demand	Anodyne	PDE3A	27	41
COC(=O)[C@H]1CN(c2ncnc3c(F)c(OC)ccc23)C[C@H]1c1ccccc1	ZINC000450937763	GG	On-Demand	Anodyne	PDE3A	27	41
COC(=O)[C@@H]1CN(c2ncnc3c(F)c(OC)ccc23)C[C@H]1c1ccccc1	ZINC000450937764	GG	On-Demand	Anodyne	PDE3A	27	41
O=C(NCC(F)(F)CO)c1noc(-c2ccccc2)n1	ZINC000450937771	CD	On-Demand	Anodyne	KCNQ1	0	45
COC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H](C)O1	ZINC000450937780	DE	On-Demand	Anodyne	DRD4	23	41
COC(=O)[C@H]1CN(Cc2ccc(Cl)c(OC)c2)C[C@@H](C)O1	ZINC000450937780	DE	On-Demand	Anodyne	HTR4	46	37
COC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(C)c(C)c1	ZINC000450937788	FF	On-Demand	Anodyne	ENPP2	15	40
COC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(C)c(C)c1	ZINC000450937788	FF	On-Demand	Anodyne	HPGDS	15	40
C[C@H]1CN(c2ccc(Cl)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450937798	DD	On-Demand	Anodyne	SMO	0	47
C[C@H]1CN(c2ccc(Cl)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450937798	DD	On-Demand	Anodyne	NPBWR1	46	35
C[C@H]1CN(c2ccc(Cl)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450937798	DD	On-Demand	Anodyne	SLC6A7	0	54
COC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(C)c(C)c1	ZINC000450937805	FF	On-Demand	Anodyne	ENPP2	15	40
COC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(C)c(C)c1	ZINC000450937805	FF	On-Demand	Anodyne	HPGDS	15	40
COC(=O)[C@H](NC(=O)CCCC(=O)C1CC1)c1ccc(C)c(C)c1	ZINC000450937814	EF	On-Demand	Anodyne	HDA106	0	41
COC(=O)[C@H]1CN(c2cnc3cc(F)c(F)cc3n2)C[C@H]1c1ccccc1	ZINC000450937816	FG	On-Demand	Anodyne	SLC6A1	46	42
COC(=O)[C@H]1CN(c2cnc3cc(F)c(F)cc3n2)C[C@H]1c1ccccc1	ZINC000450937816	FG	On-Demand	Anodyne	SLC6A3	17	41
COC(=O)[C@@H](NC(=O)CCCC(=O)C1CC1)c1ccc(C)c(C)c1	ZINC000450937821	EF	On-Demand	Anodyne	HDA106	0	41
COC(=O)c1cc(S(N)(=O)=O)ccc1N1C[C@H](C)C[C@@H](O)C1	ZINC000450937823	EC	On-Demand	Anodyne	CA2	20	45
COC(=O)c1coc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)n1	ZINC000450937824	EG	On-Demand	Anodyne	SLC6A3	18	44
COC(=O)c1coc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)n1	ZINC000450937824	EG	On-Demand	Anodyne	SLC18A3	20	44
COC(=O)c1cc(S(N)(=O)=O)ccc1N1C[C@@H](C)C[C@H](O)C1	ZINC000450937825	EC	On-Demand	Anodyne	CA2	20	45
COC(=O)c1cc(S(N)(=O)=O)ccc1N1C[C@@H](O)C[C@@H](C)C1	ZINC000450937827	EC	On-Demand	Anodyne	CA2	20	45
COC(=O)[C@H]1CN(c2cnc3cc(F)c(F)cc3n2)C[C@@H]1c1ccccc1	ZINC000450937830	FG	On-Demand	Anodyne	SLC6A1	46	42
COC(=O)[C@H]1CN(c2cnc3cc(F)c(F)cc3n2)C[C@@H]1c1ccccc1	ZINC000450937830	FG	On-Demand	Anodyne	SLC6A3	17	41
COC(=O)[C@@H]1CN(c2cnc3cc(F)c(F)cc3n2)C[C@H]1c1ccccc1	ZINC000450937833	FG	On-Demand	Anodyne	SLC6A1	46	42
COC(=O)[C@@H]1CN(c2cnc3cc(F)c(F)cc3n2)C[C@H]1c1ccccc1	ZINC000450937833	FG	On-Demand	Anodyne	SLC6A3	17	41
COC(=O)[C@H]1CN(c2ccc(C(F)(F)F)nn2)C[C@@H]1c1ccccc1	ZINC000450937852	FF	On-Demand	Anodyne	SLC6A1	44	42
COC(=O)[C@@H]1CN(c2ccc(C(F)(F)F)nn2)C[C@H]1c1ccccc1	ZINC000450937854	FF	On-Demand	Anodyne	SLC6A1	44	42
COC(=O)[C@H]1CN(c2ccc(C(F)(F)F)nn2)C[C@H]1c1ccccc1	ZINC000450937857	FF	On-Demand	Anodyne	SLC6A1	44	42
CC[C@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937870	GD	On-Demand	Anodyne	ADORA1	19	57
CC[C@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937870	GD	On-Demand	Anodyne	P2RY12	26	40
CC[C@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937870	GD	On-Demand	Anodyne	TPH1	41	34
CC[C@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937870	GD	On-Demand	Anodyne	ACE2	49	34
CC[C@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937870	GD	On-Demand	Anodyne	ADORA3	25	57
CC[C@H](Nc1cc(N[C@@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937873	GD	On-Demand	Anodyne	ADORA1	19	57
CC[C@H](Nc1cc(N[C@@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937873	GD	On-Demand	Anodyne	P2RY12	26	40
CC[C@H](Nc1cc(N[C@@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937873	GD	On-Demand	Anodyne	TPH1	41	34
CC[C@H](Nc1cc(N[C@@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937873	GD	On-Demand	Anodyne	ACE2	49	34
CC[C@H](Nc1cc(N[C@@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937873	GD	On-Demand	Anodyne	ADORA3	25	57
CC[C@@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937875	GD	On-Demand	Anodyne	ADORA1	19	57
CC[C@@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937875	GD	On-Demand	Anodyne	P2RY12	26	40
CC[C@@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937875	GD	On-Demand	Anodyne	TPH1	41	34
CC[C@@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937875	GD	On-Demand	Anodyne	ACE2	49	34
CC[C@@H](Nc1cc(N[C@H](CC)C(=O)NC)nc(-c2ccccc2)n1)C(=O)NC	ZINC000450937875	GD	On-Demand	Anodyne	ADORA3	25	57
Cc1ccnc2[nH]c(SCC(=O)NCCCN(C)C)nc12	ZINC000450937920	DD	On-Demand	Anodyne	ENPP1	60	39
Cc1ccnc2[nH]c(SCCCn3cnc4c(N)ncnc43)nc12	ZINC000450937930	EE	On-Demand	Anodyne	ENPP1	25	41
CN(C)C(=O)CSc1nc(C2CC2)nc2scc(-c3ccccc3)c12	ZINC000450937939	FI	On-Demand	Anodyne	TGM2	15	40
Cc1ccnc2[nH]c(SCC(=O)NCc3cccc(COC(C)C)c3)nc12	ZINC000450937959	GH	On-Demand	Anodyne	ENPP1	77	53
COc1ccnc(SCC(=O)N(C)C)n1	ZINC000450937965	BC	On-Demand	Anodyne	ENPP1	48	33
C[C@H]1CN(c2ncc(Cl)cc2Br)CCN1C(=O)c1cnn(C)c1	ZINC000450937994	GF	On-Demand	Anodyne	SLC6A7	0	46
Cc1c(Cl)cccc1N1CCCN(CC2CCC(=O)CC2)CC1	ZINC000450937995	EH	On-Demand	Anodyne	HTR1A	34	44
Cc1c(Cl)cccc1N1CCCN(CC2CCC(=O)CC2)CC1	ZINC000450937995	EH	On-Demand	Anodyne	DRD2	34	46
Cc1c(Cl)cccc1N1CCCN(CC2CCC(=O)CC2)CC1	ZINC000450937995	EH	On-Demand	Anodyne	ADRA1D	20	40
Cc1c(Cl)cccc1N1CCCN(CC2CCC(=O)CC2)CC1	ZINC000450937995	EH	On-Demand	Anodyne	HTR2A	28	42
Cc1c(Cl)cccc1N1CCCN(CC2CCC(=O)CC2)CC1	ZINC000450937995	EH	On-Demand	Anodyne	HTR2C	22	41
Cc1c(Cl)cccc1N1CCCN(CC2CCC(=O)CC2)CC1	ZINC000450937995	EH	On-Demand	Anodyne	ADRA1B	16	40
Cc1c(Cl)cccc1N1CCCN(CC2CCC(=O)CC2)CC1	ZINC000450937995	EH	On-Demand	Anodyne	NOX1	51	32
Cc1c(Cl)cccc1N1CCCN(CC2CCC(=O)CC2)CC1	ZINC000450937995	EH	On-Demand	Anodyne	NOX5	48	32
CCc1cc(CCCN2CCCN(c3ccc(F)c(F)c3)CC2)on1	ZINC000450938003	EH	On-Demand	Anodyne	HTR1A	15	44
CCc1cc(CCCN2CCCN(c3ccc(F)c(F)c3)CC2)on1	ZINC000450938003	EH	On-Demand	Anodyne	DRD4	18	47
C[C@H]1CN(c2ncc(Br)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450938008	GF	On-Demand	Anodyne	SLC6A7	0	44
COc1ccc(-c2csc3ncnc(N4CCOC[C@H]4CC(N)=O)c23)cc1	ZINC000450938017	GE	On-Demand	Anodyne	ADRB2	15	41
COc1ccc(-c2csc3ncnc(N4CCOC[C@H]4CC(N)=O)c23)cc1	ZINC000450938017	GE	On-Demand	Anodyne	ADRB3	15	48
COc1ccc(-c2csc3ncnc(N4CCOC[C@@H]4CC(N)=O)c23)cc1	ZINC000450938018	GE	On-Demand	Anodyne	ADRB2	15	41
COc1ccc(-c2csc3ncnc(N4CCOC[C@@H]4CC(N)=O)c23)cc1	ZINC000450938018	GE	On-Demand	Anodyne	ADRB3	15	48
COC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nn1	ZINC000450938048	CF	On-Demand	Anodyne	SCD1	45	41
COC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nn1	ZINC000450938049	CF	On-Demand	Anodyne	SCD1	45	41
CCc1cc2c(Nc3ccc(CS(=O)(=O)CC)cc3)ncnc2s1	ZINC000450938052	FH	On-Demand	Anodyne	EGFR	34	43
CCc1cc2c(Nc3ccc(CS(=O)(=O)CC)cc3)ncnc2s1	ZINC000450938052	FH	On-Demand	Anodyne	HDAC3	19	40
CCc1cc2c(Nc3ccc(CS(=O)(=O)CC)cc3)ncnc2s1	ZINC000450938052	FH	On-Demand	Anodyne	HDAC6	15	41
CC(C)(C)C[C@H]1CCN(c2ccccn2)C1	ZINC000450938055	BG	On-Demand	Anodyne	DRD4	27	40
CC(C)(C)C[C@H]1CCN(c2ccccn2)C1	ZINC000450938055	BG	On-Demand	Anodyne	AVPR1A	0	44
CC(C)(C)C[C@H]1CCN(c2ccccn2)C1	ZINC000450938055	BG	On-Demand	Anodyne	EBP	28	41
CC(C)(C)C[C@@H]1CCN(c2ccccn2)C1	ZINC000450938056	BG	On-Demand	Anodyne	DRD4	27	40
CC(C)(C)C[C@@H]1CCN(c2ccccn2)C1	ZINC000450938056	BG	On-Demand	Anodyne	AVPR1A	0	44
CC(C)(C)C[C@@H]1CCN(c2ccccn2)C1	ZINC000450938056	BG	On-Demand	Anodyne	EBP	28	41
COC[C@H]1CCCN(c2c(F)cc(S(N)(=O)=O)cc2Br)CC1	ZINC000450938057	GE	On-Demand	Anodyne	CASP3	22	41
COC[C@H]1CCCN(c2c(F)cc(S(N)(=O)=O)cc2Br)CC1	ZINC000450938057	GE	On-Demand	Anodyne	CASP7	34	42
COC[C@@H]1CCCN(c2c(F)cc(S(N)(=O)=O)cc2Br)CC1	ZINC000450938058	GE	On-Demand	Anodyne	CASP3	22	41
COC[C@@H]1CCCN(c2c(F)cc(S(N)(=O)=O)cc2Br)CC1	ZINC000450938058	GE	On-Demand	Anodyne	CASP7	34	42
Cc1cccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c1	ZINC000450938060	EG	On-Demand	Bother	TBXA2R	28	41
Cc1cccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c1	ZINC000450938061	EG	On-Demand	Bother	TBXA2R	28	41
COC[C@H]1CCCN(c2ncccc2C(=O)N2CCc3ccccc32)CC1	ZINC000450938062	FH	On-Demand	Anodyne	AVPR2	41	39
COC[C@@H]1CCCN(c2ncccc2C(=O)N2CCc3ccccc32)CC1	ZINC000450938063	FH	On-Demand	Anodyne	AVPR2	41	39
COC[C@H]1CCCN(c2nc3ccccc3cc2CO)CC1	ZINC000450938064	DF	On-Demand	Anodyne	PDE1B	0	40
COC[C@@H]1CCCN(c2nc3ccccc3cc2CO)CC1	ZINC000450938065	DF	On-Demand	Anodyne	PDE1B	0	40
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c(C)csc23)cc1	ZINC000450938066	EH	On-Demand	Anodyne	LPAR2	22	43
COC[C@@H]1CCCN(c2cc(Cl)ccc2C#N)CC1	ZINC000450938073	CG	On-Demand	Mild	NOS3	0	42
COC[C@H]1CCCN(c2cc(Cl)ccc2C#N)CC1	ZINC000450938074	CG	On-Demand	Mild	NOS3	0	42
COC[C@@H]1CCCN(c2ncnc3c2oc2ccccc23)CC1	ZINC000450938075	DH	On-Demand	Anodyne	HRH4	21	62
COC[C@@H]1CCCN(c2ncnc3c2oc2ccccc23)CC1	ZINC000450938075	DH	On-Demand	Anodyne	PDE3B	42	33
COC[C@H]1CCCN(c2ncnc3c2oc2ccccc23)CC1	ZINC000450938076	DH	On-Demand	Anodyne	HRH4	25	62
COC[C@H]1CCCN(c2ncnc3c2oc2ccccc23)CC1	ZINC000450938076	DH	On-Demand	Anodyne	PDE3B	42	33
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)C1CCC1	ZINC000450938096	DE	On-Demand	Anodyne	REN	57	36
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)C1CCC1	ZINC000450938096	DE	On-Demand	Anodyne	CTSE	44	33
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)C1CCC1	ZINC000450938096	DE	On-Demand	Anodyne	POL	0	42
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)C1CCC1	ZINC000450938097	DE	On-Demand	Anodyne	REN	57	36
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)C1CCC1	ZINC000450938097	DE	On-Demand	Anodyne	CTSE	44	33
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)C1CCC1	ZINC000450938097	DE	On-Demand	Anodyne	POL	0	42
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)C1CCC1	ZINC000450938098	DE	On-Demand	Anodyne	REN	57	36
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)C1CCC1	ZINC000450938098	DE	On-Demand	Anodyne	CTSE	44	33
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)C1CCC1	ZINC000450938098	DE	On-Demand	Anodyne	POL	0	42
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)C1CCC1	ZINC000450938099	DE	On-Demand	Anodyne	REN	57	36
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)C1CCC1	ZINC000450938099	DE	On-Demand	Anodyne	CTSE	44	33
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)C1CCC1	ZINC000450938099	DE	On-Demand	Anodyne	POL	0	42
COC[C@@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)CC1	ZINC000450938116	EH	On-Demand	Anodyne	RBP4	19	46
COC[C@H]1CCCN(c2ncnc3sc4c(c23)CCCC4)CC1	ZINC000450938119	EH	On-Demand	Anodyne	RBP4	19	46
COc1ccc(N2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])CC2)nc1	ZINC000450938126	GE	On-Demand	Bother	DRD4	43	34
COc1ccc(N2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])CC2)nc1	ZINC000450938126	GE	On-Demand	Bother	SSTR5	40	35
COc1ccc(N2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])CC2)nc1	ZINC000450938126	GE	On-Demand	Bother	TAAR1	30	54
COc1ccc(N2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])CC2)nc1	ZINC000450938126	GE	On-Demand	Bother	HPGDS	33	42
COc1ccc(N2CCN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])CC2)nc1	ZINC000450938126	GE	On-Demand	Bother	NPBWR1	65	38
C[C@H](c1ccc(CS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1)C(F)(F)F	ZINC000450938134	FI	On-Demand	Bother	COLA	27	40
C[C@@H](c1ccc(CS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1)C(F)(F)F	ZINC000450938135	FI	On-Demand	Bother	COLA	27	40
CCOc1cccc(CN(CCO)c2nccc(C)n2)c1	ZINC000450938137	CE	On-Demand	Anodyne	CETP	0	41
CS(=O)(=O)c1cccc(CSCc2ccc3c(c2)OCO3)c1	ZINC000450938142	EG	On-Demand	Anodyne	BMP1	42	40
CCOC(=O)CSc1cncc(N2CCN(c3ccc(OC)cn3)CC2)n1	ZINC000450938145	GD	On-Demand	Anodyne	NPBWR1	41	38
O[C@H](CN1CCOCC1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938146	DD	On-Demand	Anodyne	ABCB1	0	42
O[C@@H](CN1CCOCC1)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938147	DD	On-Demand	Anodyne	ABCB1	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450938151	FG	On-Demand	Anodyne	MME	53	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450938151	FG	On-Demand	Anodyne	ANPEP	60	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450938151	FG	On-Demand	Anodyne	FCER2	42	32
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450938151	FG	On-Demand	Anodyne	CAPNS1	45	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450938151	FG	On-Demand	Anodyne	CAPN2	40	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450938151	FG	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000450938151	FG	On-Demand	Anodyne	BLAIMP-1	0	49
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450938153	FG	On-Demand	Anodyne	MME	53	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450938153	FG	On-Demand	Anodyne	ANPEP	60	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450938153	FG	On-Demand	Anodyne	FCER2	42	32
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450938153	FG	On-Demand	Anodyne	CAPNS1	45	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450938153	FG	On-Demand	Anodyne	CAPN2	40	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450938153	FG	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000450938153	FG	On-Demand	Anodyne	BLAIMP-1	0	49
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000450938155	FG	On-Demand	Anodyne	MME	53	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000450938155	FG	On-Demand	Anodyne	ANPEP	60	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000450938155	FG	On-Demand	Anodyne	FCER2	42	32
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000450938155	FG	On-Demand	Anodyne	CAPNS1	45	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000450938155	FG	On-Demand	Anodyne	CAPN2	40	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000450938155	FG	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000450938155	FG	On-Demand	Anodyne	BLAIMP-1	0	49
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450938157	FG	On-Demand	Anodyne	MME	53	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450938157	FG	On-Demand	Anodyne	ANPEP	60	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450938157	FG	On-Demand	Anodyne	FCER2	42	32
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450938157	FG	On-Demand	Anodyne	CAPNS1	45	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450938157	FG	On-Demand	Anodyne	CAPN2	40	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450938157	FG	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450938157	FG	On-Demand	Anodyne	BLAIMP-1	0	49
COC(=O)c1ccc(CSCCC(F)(F)F)cc1Cl	ZINC000450938159	DI	On-Demand	Anodyne	CACNA2D1	0	40
NC(=O)[C@H]1CCCCN1C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450938173	EE	On-Demand	Anodyne	CPT1A	83	42
NC(=O)[C@H]1CCCCN1C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450938173	EE	On-Demand	Anodyne	CPT2	50	42
NC(=O)[C@H]1CCCCN1C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450938173	EE	On-Demand	Anodyne	LIPG	51	34
NC(=O)[C@@H]1CCCCN1C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450938174	EE	On-Demand	Anodyne	CPT1A	83	42
NC(=O)[C@@H]1CCCCN1C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450938174	EE	On-Demand	Anodyne	CPT2	50	42
NC(=O)[C@@H]1CCCCN1C(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450938174	EE	On-Demand	Anodyne	LIPG	51	34
COc1ccccc1CCNC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938194	FF	On-Demand	Anodyne	DRD4	17	44
COc1ccccc1CCNC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938194	FF	On-Demand	Anodyne	CCR8	20	41
CCOc1cccc(CN(CCO)c2nc3c(F)cccc3o2)c1	ZINC000450938199	EG	On-Demand	Anodyne	PPARA	26	49
CCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450938203	FD	On-Demand	Anodyne	DRD2	22	41
CCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450938203	FD	On-Demand	Anodyne	DRD1	0	44
CCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450938203	FD	On-Demand	Anodyne	DRD4	51	39
CCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450938203	FD	On-Demand	Anodyne	HDAC1	30	47
CNC(=O)c1cccnc1N1CCN(c2ccc(OC)cn2)CC1	ZINC000450938214	ED	On-Demand	Anodyne	SMO	25	40
CCN(Cc1cccc(F)c1)C(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938218	FH	On-Demand	Anodyne	CCR5	43	33
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc(O)cc1	ZINC000450938226	FF	On-Demand	Anodyne	GPR88	0	44
COC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc(O)cc1	ZINC000450938227	FF	On-Demand	Anodyne	GPR88	0	44
OCC[C@@H]1CCCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450938234	EG	On-Demand	Anodyne	SLC18A2	34	40
OCC[C@H]1CCCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450938235	EG	On-Demand	Anodyne	SLC18A2	34	40
COc1ccc(N2CCN(c3ncc(C#N)cc3Cl)CC2)nc1	ZINC000450938236	EE	On-Demand	Mild	CXCR3	23	40
COc1ccc(N2CCN(c3ncc(C#N)cc3Cl)CC2)nc1	ZINC000450938236	EE	On-Demand	Mild	SGPL1	0	40
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938252	GC	On-Demand	Bother	BDKRB1	0	49
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938252	GC	On-Demand	Bother	COLA	65	31
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938252	GC	On-Demand	Bother	BCL2L1	112	36
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938252	GC	On-Demand	Bother	BCL2	100	36
CC[C@@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938252	GC	On-Demand	Bother	BCL2L2	48	34
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938254	GC	On-Demand	Bother	BDKRB1	0	49
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938254	GC	On-Demand	Bother	COLA	65	31
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938254	GC	On-Demand	Bother	BCL2L1	112	36
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938254	GC	On-Demand	Bother	BCL2	100	36
CC[C@H](Nc1ccc(S(=O)(=O)NCCN(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938254	GC	On-Demand	Bother	BCL2L2	48	34
C[C@@H]1C[C@@H](O)CN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450938255	DF	On-Demand	Anodyne	RBP4	17	41
C[C@H]1C[C@H](O)CN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450938256	DF	On-Demand	Anodyne	RBP4	17	41
C[C@H]1C[C@@H](O)CN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450938257	DF	On-Demand	Anodyne	RBP4	17	41
CCc1cccc(C(=O)N[C@H](C(=O)OC)c2ccc3c(c2)CCO3)n1	ZINC000450938260	EE	On-Demand	Anodyne	PDE5A	27	40
CCc1cccc(C(=O)N[C@@H](C(=O)OC)c2ccc3c(c2)CCO3)n1	ZINC000450938261	EE	On-Demand	Anodyne	PDE5A	27	40
C[C@H]1C[C@@H](O)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450938276	EE	On-Demand	Anodyne	ACACB	22	43
C[C@H]1C[C@H](O)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450938277	EE	On-Demand	Anodyne	ACACB	22	43
C[C@@H]1C[C@@H](O)CN(c2cc(C(=O)NC3CC3)c3ccccc3n2)C1	ZINC000450938278	EE	On-Demand	Anodyne	ACACB	22	43
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	DRD2	37	53
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	DRD1	22	52
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	DRD4	28	57
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	HTR2A	22	57
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	ERG2	25	53
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	SLC18A3	22	54
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	NET	0	53
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938318	FH	On-Demand	Anodyne	AP2S1	0	53
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	DRD2	37	53
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	DRD1	22	52
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	DRD4	28	57
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	HTR2A	22	57
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	ERG2	25	53
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	SLC18A3	22	54
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	HTR3B	0	48
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	NET	0	53
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccc(F)cc1	ZINC000450938319	FH	On-Demand	Anodyne	AP2S1	0	53
COC(=O)[C@H]1CN(c2ncccn2)C[C@H]1c1ccccc1	ZINC000450938321	CD	On-Demand	Anodyne	SLC6A1	98	48
COC(=O)[C@H]1CN(c2ncccn2)C[C@@H]1c1ccccc1	ZINC000450938322	CD	On-Demand	Anodyne	SLC6A1	98	48
COC(=O)[C@H]1CN(c2nc(C)ccc2[N+](=O)[O-])C[C@@H]1c1ccccc1	ZINC000450938332	EF	On-Demand	Bother	SLC6A1	50	40
COC(=O)[C@H]1CN(c2nc(C)ccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450938333	EF	On-Demand	Bother	SLC6A1	50	40
C[C@H]1CN(c2ncccc2C(F)(F)F)CCN1C(=O)c1cnn(C)c1	ZINC000450938369	FE	On-Demand	Anodyne	TRPV1	37	59
C[C@H]1CN(c2ncccc2C(F)(F)F)CCN1C(=O)c1cnn(C)c1	ZINC000450938369	FE	On-Demand	Anodyne	HSD11B1	15	52
C[C@H]1CN(c2ncccc2C(F)(F)F)CCN1C(=O)c1cnn(C)c1	ZINC000450938369	FE	On-Demand	Anodyne	RBP4	24	52
C[C@H]1CN(c2ncccc2C(F)(F)F)CCN1C(=O)c1cnn(C)c1	ZINC000450938369	FE	On-Demand	Anodyne	SLC6A7	0	47
COC(=O)[C@H]1CN(c2nc3cc(C)ccc3o2)C[C@@H]1c1ccccc1	ZINC000450938385	EH	On-Demand	Anodyne	SLC6A1	32	42
COC(=O)[C@H]1CN(c2nc3cc(C)ccc3o2)C[C@@H]1c1ccccc1	ZINC000450938385	EH	On-Demand	Anodyne	SLC6A3	17	47
COC(=O)[C@H]1CN(c2nc3cc(C)ccc3o2)C[C@@H]1c1ccccc1	ZINC000450938385	EH	On-Demand	Anodyne	PTGES	17	44
COC(=O)[C@H]1CN(c2nc3cc(C)ccc3o2)C[C@@H]1c1ccccc1	ZINC000450938385	EH	On-Demand	Anodyne	NPBWR1	40	40
COC(=O)[C@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccccc1	ZINC000450938386	EH	On-Demand	Anodyne	SLC6A1	32	42
COC(=O)[C@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccccc1	ZINC000450938386	EH	On-Demand	Anodyne	SLC6A3	17	47
COC(=O)[C@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccccc1	ZINC000450938386	EH	On-Demand	Anodyne	PTGES	17	44
COC(=O)[C@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccccc1	ZINC000450938386	EH	On-Demand	Anodyne	NPBWR1	40	40
COC(=O)[C@@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccccc1	ZINC000450938387	EH	On-Demand	Anodyne	SLC6A1	32	42
COC(=O)[C@@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccccc1	ZINC000450938387	EH	On-Demand	Anodyne	SLC6A3	17	47
COC(=O)[C@@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccccc1	ZINC000450938387	EH	On-Demand	Anodyne	PTGES	17	44
COC(=O)[C@@H]1CN(c2nc3cc(C)ccc3o2)C[C@H]1c1ccccc1	ZINC000450938387	EH	On-Demand	Anodyne	NPBWR1	40	40
COc1ncc(Cl)c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450938389	FD	On-Demand	Anodyne	SMO	0	41
COc1ncc(Cl)c(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450938389	FD	On-Demand	Anodyne	SLC6A7	0	42
Fc1ccc2c(c1)CCN2C1CCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450938412	GH	On-Demand	Anodyne	SCD	30	40
CCN(CC)S(=O)(=O)c1ccc(N2CCCC[C@H]2COC)c([N+](=O)[O-])c1	ZINC000450938429	GF	On-Demand	Bother	CASP3	61	41
CCN(CC)S(=O)(=O)c1ccc(N2CCCC[C@H]2COC)c([N+](=O)[O-])c1	ZINC000450938429	GF	On-Demand	Bother	CASP7	69	42
CCN(CC)S(=O)(=O)c1ccc(N2CCCC[C@@H]2COC)c([N+](=O)[O-])c1	ZINC000450938431	GF	On-Demand	Bother	CASP3	61	41
CCN(CC)S(=O)(=O)c1ccc(N2CCCC[C@@H]2COC)c([N+](=O)[O-])c1	ZINC000450938431	GF	On-Demand	Bother	CASP7	69	42
C[C@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CCN1C(=O)c1cnn(C)c1	ZINC000450938432	FE	On-Demand	Bother	SLC6A7	0	45
O=C(NC[C@@H]1CCCN(CCC2=CCCCC2)C1)c1ccco1	ZINC000450938433	DH	On-Demand	Anodyne	BIRC2	42	33
O=C(NC[C@H]1CCCN(CCC2=CCCCC2)C1)c1ccco1	ZINC000450938435	DH	On-Demand	Anodyne	BIRC2	42	33
COc1ccc(-n2c(C)nnc2SCc2cn(CC3CC3)nn2)cc1	ZINC000450938458	FF	On-Demand	Anodyne	WNT3A	24	48
COc1ccc(-n2c(C)nnc2SCc2cn(CC3CC3)nn2)cc1	ZINC000450938458	FF	On-Demand	Anodyne	AXIN2	0	53
COc1ccc(-n2c(C)nnc2SC[C@@H]2CCC(F)(F)C2)cc1	ZINC000450938459	EI	On-Demand	Anodyne	AXIN2	0	48
COc1ccc(-n2c(C)nnc2SC[C@H]2CCC(F)(F)C2)cc1	ZINC000450938462	EI	On-Demand	Anodyne	AXIN2	0	48
C[C@H]1CN(c2ccc(F)cc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450938472	ED	On-Demand	Mild	HCRTR1	49	33
COC[C@H]1CCCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450938480	DE	On-Demand	Anodyne	FASN	25	41
COC[C@H]1CCCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450938480	DE	On-Demand	Anodyne	L3MBTL3	40	35
COC[C@@H]1CCCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450938482	DE	On-Demand	Anodyne	FASN	25	41
COC[C@@H]1CCCCN(C(=O)c2ccc(N3CCC3)nc2)C1	ZINC000450938482	DE	On-Demand	Anodyne	L3MBTL3	40	35
COC[C@H]1CCCCN1c1ccc(S(C)(=O)=O)cn1	ZINC000450938496	CD	On-Demand	Anodyne	CASP3	43	42
COC[C@@H]1CCCCN1c1ccc(S(C)(=O)=O)cn1	ZINC000450938497	CD	On-Demand	Anodyne	CASP3	43	42
CCS(=O)(=O)c1ccc(CN2C[C@@H](C)O[C@@H](C(=O)OC)C2)cc1	ZINC000450938500	ED	On-Demand	Anodyne	RORC	52	32
CC(=O)c1ccc(CN2C[C@H]3CC[C@H]2c2ccccc23)cc1	ZINC000450938503	CI	On-Demand	Anodyne	MBTPS1	44	34
C[C@H]1CN(c2ncc(Br)cc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450938510	GD	On-Demand	Mild	LIMK2	53	33
COC[C@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450938514	EG	On-Demand	Anodyne	FKBP1A	44	42
COC[C@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450938514	EG	On-Demand	Anodyne	SLC12A5	68	38
COC[C@@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450938515	EG	On-Demand	Anodyne	FKBP1A	44	42
COC[C@@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450938515	EG	On-Demand	Anodyne	SLC12A5	68	38
Cc1ccnc2[nH]c(SCC(=O)N(C)[C@H](C)c3ccccc3)nc12	ZINC000450938526	EH	On-Demand	Anodyne	ENPP1	67	51
Cc1ccnc2[nH]c(SCC(=O)N(C)[C@@H](C)c3ccccc3)nc12	ZINC000450938527	EH	On-Demand	Anodyne	ENPP1	67	51
COC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450938535	DE	On-Demand	Anodyne	DRD2	29	41
COC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450938535	DE	On-Demand	Anodyne	ERG2	28	41
COC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)O1	ZINC000450938535	DE	On-Demand	Anodyne	CYP2J2	51	36
C[C@]12CN(c3ncnc4[nH]ccc34)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000450938555	CF	On-Demand	Anodyne	AKT2	44	44
C[C@]12CN(c3ncnc4[nH]ccc34)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000450938555	CF	On-Demand	Anodyne	ROCK2	40	39
C[C@]12CN(c3ncnc4[nH]ccc34)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000450938555	CF	On-Demand	Anodyne	AKT1	0	41
C[C@]12CN(c3ncnc4[nH]ccc34)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000450938556	CF	On-Demand	Anodyne	AKT2	44	44
C[C@]12CN(c3ncnc4[nH]ccc34)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000450938556	CF	On-Demand	Anodyne	ROCK2	40	39
C[C@]12CN(c3ncnc4[nH]ccc34)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000450938556	CF	On-Demand	Anodyne	AKT1	0	41
Fc1ccc(N2CCCN(CCc3cscn3)CC2)cc1F	ZINC000450938559	DG	On-Demand	Anodyne	ABCC1	101	38
Fc1ccc(N2CCCN(CCc3cscn3)CC2)cc1F	ZINC000450938559	DG	On-Demand	Anodyne	ABCB1A	48	36
CCCC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450938568	CH	On-Demand	Anodyne	PPARA	24	45
CCCC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450938568	CH	On-Demand	Anodyne	PTGDR2	38	45
CC[C@@H](F)CSc1nc2c(C)ccnc2[nH]1	ZINC000450938579	BG	On-Demand	Anodyne	ENPP1	23	47
CC[C@H](F)CSc1nc2c(C)ccnc2[nH]1	ZINC000450938580	BG	On-Demand	Anodyne	ENPP1	23	47
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938585	FD	On-Demand	Bother	BCL2L1	87	37
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938585	FD	On-Demand	Bother	BCL2	50	34
CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938585	FD	On-Demand	Bother	BCL2L2	40	31
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938587	FD	On-Demand	Bother	BCL2L1	87	37
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938587	FD	On-Demand	Bother	BCL2	50	34
CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450938587	FD	On-Demand	Bother	BCL2L2	40	31
CC[C@@H](Nc1cccc(C)n1)C(=O)NC	ZINC000450938615	BD	On-Demand	Anodyne	GRM5	17	44
CC[C@H](Nc1cccc(C)n1)C(=O)NC	ZINC000450938616	BD	On-Demand	Anodyne	GRM5	17	44
COc1ccc(-n2c(C)nnc2SC[C@H]2CCCC2(F)F)cc1	ZINC000450938621	EI	On-Demand	Anodyne	AXIN2	0	48
COc1ccc(-n2c(C)nnc2SC[C@@H]2CCCC2(F)F)cc1	ZINC000450938623	EI	On-Demand	Anodyne	AXIN2	0	48
C[C@H]1CN(c2nc3c(F)cccc3n2C)CCN1C(=O)c1cnn(C)c1	ZINC000450938625	FD	On-Demand	Anodyne	SLC6A7	0	43
C[C@H]1CN(c2ncc(C(F)(F)F)s2)CCN1C(=O)c1cnn(C)c1	ZINC000450938631	FE	On-Demand	Anodyne	MLYCD	62	38
Cc1cnccc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450938633	CD	On-Demand	Anodyne	SLC6A7	0	44
CN(C)Cc1nc(SCC(=O)N(C)C)c2c(-c3ccccc3)csc2n1	ZINC000450938650	GH	On-Demand	Anodyne	TGM2	16	41
Cc1nc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2c(C)csc2n1	ZINC000450938654	FE	On-Demand	Anodyne	HCRTR1	27	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	OPRM1	28	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	OPRD1	20	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	CMA1	51	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	CTRA_BOVIN	55	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	TIMP3	48	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	CTRC	45	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	ACE2	62	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	PSMB8	56	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938660	GF	On-Demand	Anodyne	GPR142	49	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	OPRM1	28	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	OPRD1	20	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	CMA1	51	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	CTRA_BOVIN	55	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	TIMP3	48	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	CTRC	45	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	ACE2	62	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	PSMB8	56	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938661	GF	On-Demand	Anodyne	GPR142	49	39
CCOc1cccc(CN(CCO)c2ccnc(C)n2)c1	ZINC000450938662	CE	On-Demand	Anodyne	CETP	0	40
COc1ccc(N2CCN(c3cnc4cc(F)c(F)cc4n3)CC2)nc1	ZINC000450938674	FF	On-Demand	Anodyne	SORD	16	42
CCc1cc(N2CCN(c3ccc(OC)cn3)CC2)nc(-c2ccccn2)n1	ZINC000450938691	GF	On-Demand	Anodyne	DRD4	28	40
CCc1cc(N2CCN(c3ccc(OC)cn3)CC2)nc(-c2ccccn2)n1	ZINC000450938691	GF	On-Demand	Anodyne	EBP	21	42
CC[C@H](Nc1ncnc2cc(Cl)ccc12)C(=O)NC	ZINC000450938695	CE	On-Demand	Anodyne	EGFR	42	40
CC[C@@H](Nc1ncnc2cc(Cl)ccc12)C(=O)NC	ZINC000450938696	CE	On-Demand	Anodyne	EGFR	42	40
CCCc1cc(Nc2ccc(CS(=O)(=O)CC)cc2)n2ncnc2n1	ZINC000450938710	FF	On-Demand	Anodyne	DHOD	0	62
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000450938714	ED	On-Demand	Bother	CASP3	59	40
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000450938714	ED	On-Demand	Bother	CASP7	65	39
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000450938716	ED	On-Demand	Bother	CASP3	59	40
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000450938716	ED	On-Demand	Bother	CASP7	65	39
COC[C@@H]1CCCN(c2nnc(-c3ccccc3Cl)s2)CC1	ZINC000450938718	EI	On-Demand	Anodyne	HRH3	15	61
COC[C@H]1CCCN(c2nnc(-c3ccccc3Cl)s2)CC1	ZINC000450938719	EI	On-Demand	Anodyne	HRH3	15	61
Cc1ccc(OC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)c(C)c1	ZINC000450938722	FG	On-Demand	Anodyne	ADRB2	33	45
Cc1ccc(OC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)c(C)c1	ZINC000450938722	FG	On-Demand	Anodyne	ACOX1	43	31
Cc1ccc(OC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)c(C)c1	ZINC000450938722	FG	On-Demand	Anodyne	ABCB1	60	43
Cc1ccc(OC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)c(C)c1	ZINC000450938724	FG	On-Demand	Anodyne	ADRB2	33	45
Cc1ccc(OC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)c(C)c1	ZINC000450938724	FG	On-Demand	Anodyne	ACOX1	43	31
Cc1ccc(OC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)c(C)c1	ZINC000450938724	FG	On-Demand	Anodyne	ABCB1	60	43
C[C@H](NC(=O)CN1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450938725	GH	On-Demand	Anodyne	PRCP	38	45
C[C@H](NC(=O)CN1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450938725	GH	On-Demand	Anodyne	CCR1	41	38
C[C@H](NC(=O)CN1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450938725	GH	On-Demand	Anodyne	SLC6A9	17	40
C[C@@H](NC(=O)CN1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450938731	GH	On-Demand	Anodyne	PRCP	38	45
C[C@@H](NC(=O)CN1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450938731	GH	On-Demand	Anodyne	CCR1	41	38
C[C@@H](NC(=O)CN1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450938731	GH	On-Demand	Anodyne	SLC6A9	17	40
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938740	EH	On-Demand	Anodyne	TACR1	25	45
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938740	EH	On-Demand	Anodyne	CACNA1B	51	33
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938740	EH	On-Demand	Anodyne	COLA	80	43
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938740	EH	On-Demand	Anodyne	CPT1A	77	43
CC[C@@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938740	EH	On-Demand	Anodyne	CCR2	50	37
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938743	EH	On-Demand	Anodyne	TACR1	25	45
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938743	EH	On-Demand	Anodyne	CACNA1B	51	33
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938743	EH	On-Demand	Anodyne	COLA	80	43
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938743	EH	On-Demand	Anodyne	CPT1A	77	43
CC[C@H](O)CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450938743	EH	On-Demand	Anodyne	CCR2	50	37
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938746	EH	On-Demand	Anodyne	TACR1	25	45
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938746	EH	On-Demand	Anodyne	CACNA1B	51	33
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938746	EH	On-Demand	Anodyne	COLA	80	43
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938746	EH	On-Demand	Anodyne	CPT1A	77	43
CC[C@@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938746	EH	On-Demand	Anodyne	CCR2	50	37
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938748	EH	On-Demand	Anodyne	TACR1	25	45
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938748	EH	On-Demand	Anodyne	CACNA1B	51	33
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938748	EH	On-Demand	Anodyne	COLA	80	43
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938748	EH	On-Demand	Anodyne	CPT1A	77	43
CC[C@H](O)CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450938748	EH	On-Demand	Anodyne	CCR2	50	37
CCC1(CC)CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC[S@]1=O	ZINC000450938797	GF	On-Demand	Anodyne	EPHX2	19	48
CCC1(CC)CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC[S@]1=O	ZINC000450938797	GF	On-Demand	Anodyne	CACNA1I	15	45
CCC1(CC)CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC[S@@]1=O	ZINC000450938799	GF	On-Demand	Anodyne	EPHX2	19	48
CCC1(CC)CN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC[S@@]1=O	ZINC000450938799	GF	On-Demand	Anodyne	CACNA1I	15	45
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccc(F)cc3)CC2)cc1	ZINC000450938808	GF	On-Demand	Anodyne	SIGMAR1	17	42
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccc(F)cc3)CC2)cc1	ZINC000450938808	GF	On-Demand	Anodyne	CCR3	18	41
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccc(F)cc3)CC2)cc1	ZINC000450938808	GF	On-Demand	Anodyne	MLNR	56	37
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccc(F)cc3)CC2)cc1	ZINC000450938808	GF	On-Demand	Anodyne	CACNA1G	29	46
COc1ccc(CN2CCCN(C(=O)CN(C#N)c3ccc(F)cc3)CC2)cc1	ZINC000450938808	GF	On-Demand	Anodyne	ABHD6	0	43
COc1ccc(N2CCN(c3nc(C(F)(F)F)cs3)CC2)nc1	ZINC000450938818	EF	On-Demand	Anodyne	NPBWR1	40	35
CNc1nc(N2CCC[C@@H](COC)CC2)nc2ccccc12	ZINC000450938819	DE	On-Demand	Anodyne	HRH4	21	45
CNc1nc(N2CCC[C@@H](COC)CC2)nc2ccccc12	ZINC000450938819	DE	On-Demand	Anodyne	CCR4	41	44
CNc1nc(N2CCC[C@@H](COC)CC2)nc2ccccc12	ZINC000450938819	DE	On-Demand	Anodyne	EHMT2	55	36
CNc1nc(N2CCC[C@H](COC)CC2)nc2ccccc12	ZINC000450938821	DE	On-Demand	Anodyne	HRH4	21	45
CNc1nc(N2CCC[C@H](COC)CC2)nc2ccccc12	ZINC000450938821	DE	On-Demand	Anodyne	CCR4	41	44
CNc1nc(N2CCC[C@H](COC)CC2)nc2ccccc12	ZINC000450938821	DE	On-Demand	Anodyne	EHMT2	55	36
COC[C@@H]1CCCN(c2ccc(C(C)=O)cn2)CC1	ZINC000450938823	CF	On-Demand	Anodyne	HPGDS	15	41
COC[C@H]1CCCN(c2ccc(C(C)=O)cn2)CC1	ZINC000450938825	CF	On-Demand	Anodyne	HPGDS	15	41
COC(=O)CNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC000450938842	GF	On-Demand	Bother	CACNA1I	59	38
COC(=O)CNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC000450938842	GF	On-Demand	Bother	TAAR1	20	47
COC(=O)CNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC000450938844	GF	On-Demand	Bother	CACNA1I	59	38
COC(=O)CNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC000450938844	GF	On-Demand	Bother	TAAR1	20	47
Cc1ccc(C(=O)CCN2CCC[C@H](c3nc(C(F)(F)F)cn3C)C2)cc1	ZINC000450938856	GI	On-Demand	Anodyne	SLC6A1	44	32
Cc1ccc(C(=O)CCN2CCC[C@@H](c3nc(C(F)(F)F)cn3C)C2)cc1	ZINC000450938860	GI	On-Demand	Anodyne	SLC6A1	44	32
COc1ccc(N2CCN(c3ccnc(C(C)C)n3)CC2)nc1	ZINC000450938871	DE	On-Demand	Anodyne	SORD	78	43
COC[C@H]1CCCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000450938875	DG	On-Demand	Anodyne	SORD	56	43
COC[C@@H]1CCCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000450938876	DG	On-Demand	Anodyne	SORD	56	43
COC[C@@H]1CCCN(c2ncccc2C#N)CC1	ZINC000450938880	BE	On-Demand	Mild	DPP4	18	41
Cc1cc(C(F)(F)F)nc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450938881	FD	On-Demand	Anodyne	SLC6A7	0	41
COC[C@H]1CCCN(c2ncccc2C#N)CC1	ZINC000450938882	BE	On-Demand	Mild	DPP4	18	41
CCOc1cccc(CN(CCO)c2ccc(C(F)(F)F)nn2)c1	ZINC000450938889	EF	On-Demand	Anodyne	CETP	0	45
CCOc1cccc(CN(CCO)c2ccc(C(F)(F)F)nn2)c1	ZINC000450938889	EF	On-Demand	Anodyne	SQLE	40	30
O=C(COc1ccc(C(F)(F)F)cc1F)NCCCN1CCCC1=O	ZINC000450938902	FE	On-Demand	Anodyne	TYRO3	25	41
COC(=O)[C@@H](NC(=O)CCc1ccc2c(c1)OCCO2)c1ccc(O)cc1	ZINC000450938906	FE	On-Demand	Anodyne	LUXR	22	41
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450938908	FE	On-Demand	Anodyne	DRD2	32	45
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450938908	FE	On-Demand	Anodyne	DRD1	15	47
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450938908	FE	On-Demand	Anodyne	DRD4	17	47
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450938908	FE	On-Demand	Anodyne	HTR2A	32	52
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450938908	FE	On-Demand	Anodyne	HTR2C	16	58
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450938908	FE	On-Demand	Anodyne	ERG2	21	45
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450938908	FE	On-Demand	Anodyne	HTR3B	0	45
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450938908	FE	On-Demand	Anodyne	CYP2J2	60	42
CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450938909	GF	On-Demand	Bother	CASP3	55	39
CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450938909	GF	On-Demand	Bother	CASP7	62	39
COC(=O)[C@H](NC(=O)CCc1ccc2c(c1)OCCO2)c1ccc(O)cc1	ZINC000450938910	FE	On-Demand	Anodyne	LUXR	22	41
CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450938911	GF	On-Demand	Bother	CASP3	55	39
CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450938911	GF	On-Demand	Bother	CASP7	62	39
Cc1noc(C(C)(C)NCCc2ccc(Cl)cc2)n1	ZINC000450938916	CG	On-Demand	Anodyne	PETD	0	40
O[C@H](COc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938924	FG	On-Demand	Anodyne	ADRB2	35	42
O[C@H](COc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938924	FG	On-Demand	Anodyne	ADRB3	45	42
O[C@H](COc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938924	FG	On-Demand	Anodyne	CCR1	39	40
O[C@H](COc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450938924	FG	On-Demand	Anodyne	ABCB1	57	46
C[C@@H](O)CCN(C)CCc1cccc([N+](=O)[O-])c1	ZINC000450938940	CD	On-Demand	Bother	CACNA1D	65	35
C[C@H](O)CCN(C)CCc1cccc([N+](=O)[O-])c1	ZINC000450938941	CD	On-Demand	Bother	CACNA1D	65	35
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cn2)C[C@@H]1c1ccccc1	ZINC000450938942	EE	On-Demand	Bother	SLC6A1	31	40
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1	ZINC000450938943	EE	On-Demand	Bother	SLC6A1	31	40
COC(=O)[C@H]1CN(c2nc(C(F)(F)F)ccc2C#N)C[C@@H]1c1ccccc1	ZINC000450938948	GG	On-Demand	Mild	P2RY12	31	42
COC(=O)[C@H]1CN(c2nc(C(F)(F)F)ccc2C#N)C[C@H]1c1ccccc1	ZINC000450938949	GG	On-Demand	Mild	P2RY12	31	42
COC(=O)[C@@H]1CN(c2nc(C(F)(F)F)ccc2C#N)C[C@H]1c1ccccc1	ZINC000450938950	GG	On-Demand	Mild	P2RY12	31	42
COC(=O)[C@H]1CN(c2ncnc3ccsc23)C[C@H]1c1ccccc1	ZINC000450938951	EG	On-Demand	Anodyne	SLC6A1	26	44
COC(=O)[C@H]1CN(c2ncnc3ccsc23)C[C@H]1c1ccccc1	ZINC000450938951	EG	On-Demand	Anodyne	SIRT3	50	33
COC(=O)[C@H]1CN(c2ncnc3ccsc23)C[C@H]1c1ccccc1	ZINC000450938951	EG	On-Demand	Anodyne	SIRT2	51	33
COC(=O)[C@H]1CN(c2ncnc3ccsc23)C[C@H]1c1ccccc1	ZINC000450938951	EG	On-Demand	Anodyne	SIRT1	50	33
COC(=O)[C@H]1CN(c2ncnc3ccsc23)C[C@@H]1c1ccccc1	ZINC000450938952	EG	On-Demand	Anodyne	SLC6A1	26	44
COC(=O)[C@H]1CN(c2ncnc3ccsc23)C[C@@H]1c1ccccc1	ZINC000450938952	EG	On-Demand	Anodyne	SIRT3	50	33
COC(=O)[C@H]1CN(c2ncnc3ccsc23)C[C@@H]1c1ccccc1	ZINC000450938952	EG	On-Demand	Anodyne	SIRT2	51	33
COC(=O)[C@H]1CN(c2ncnc3ccsc23)C[C@@H]1c1ccccc1	ZINC000450938952	EG	On-Demand	Anodyne	SIRT1	50	33
COC(=O)[C@H]1CN(c2ccc(Cl)c(C#N)n2)C[C@H]1c1ccccc1	ZINC000450938963	EF	On-Demand	Mild	SLC6A1	30	42
COC(=O)[C@H]1CN(c2ccc(Cl)c(C#N)n2)C[C@@H]1c1ccccc1	ZINC000450938964	EF	On-Demand	Mild	SLC6A1	30	42
COC(=O)[C@H]1CN(c2c([N+](=O)[O-])c(C)nn2C)C[C@H]1c1ccccc1	ZINC000450938965	EE	On-Demand	Bother	SLC6A1	39	42
COC(=O)[C@H]1CN(c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1c1ccccc1	ZINC000450938966	EE	On-Demand	Bother	SLC6A1	39	42
COC(=O)[C@H]1CN(c2ccnc(C(C)C)n2)C[C@@H]1c1ccccc1	ZINC000450938969	EF	On-Demand	Anodyne	SLC6A1	65	42
COC(=O)[C@H]1CN(c2ccnc(C(C)C)n2)C[C@@H]1c1ccccc1	ZINC000450938969	EF	On-Demand	Anodyne	SORD	58	38
COC(=O)[C@H]1CN(c2ccnc(C(C)C)n2)C[C@H]1c1ccccc1	ZINC000450938970	EF	On-Demand	Anodyne	SLC6A1	65	42
COC(=O)[C@H]1CN(c2ccnc(C(C)C)n2)C[C@H]1c1ccccc1	ZINC000450938970	EF	On-Demand	Anodyne	SORD	58	38
O=C(NC[C@@H]1CCCN(Cc2ccccc2OC2CC2)C1)c1ccco1	ZINC000450938974	FG	On-Demand	Anodyne	DRD3	0	42
O=C(NC[C@H]1CCCN(Cc2ccccc2OC2CC2)C1)c1ccco1	ZINC000450938975	FG	On-Demand	Anodyne	DRD3	0	42
C[C@@H](SC(C)(C)c1ccccc1)C(=O)C1CCOCC1	ZINC000450938976	CI	On-Demand	Anodyne	AMY2	43	30
C[C@H](SC(C)(C)c1ccccc1)C(=O)C1CCOCC1	ZINC000450938977	CI	On-Demand	Anodyne	AMY2	43	30
CCS(=O)(=O)c1ccc(CN(C)CCc2cccc([N+](=O)[O-])c2)cc1	ZINC000450938993	FG	On-Demand	Bother	MMP1	23	42
CCO[C@@H]1CCC[C@H]1Nc1cc(-c2ccccc2)nc2ncnn12	ZINC000450938998	DG	On-Demand	Anodyne	DHOD	0	41
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	DRD2	29	42
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	DRD4	15	46
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	HTR2A	16	46
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	SLC6A1	45	41
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	HTR7	20	44
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	SIGMAR1	24	42
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939011	EH	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	DRD2	29	42
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	DRD4	15	46
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	HTR2A	16	46
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	SLC6A1	45	41
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	ERG2	20	42
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	HTR7	20	44
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	SIGMAR1	24	42
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1CCC[C@](CO)(c2ccccc2)C1)c1ccccc1	ZINC000450939012	EH	On-Demand	Anodyne	CYP2J2	56	39
COC(=O)[C@H]1CN(c2nc(C)nc(C)c2C)C[C@H]1c1ccccc1	ZINC000450939013	EF	On-Demand	Anodyne	SLC6A1	72	44
COC(=O)[C@H]1CN(c2nc(C)nc(C)c2C)C[C@@H]1c1ccccc1	ZINC000450939014	EF	On-Demand	Anodyne	SLC6A1	72	44
CC(C)c1nccc(N2C[C@H](C)C[C@@H](O)C2)n1	ZINC000450939059	BD	On-Demand	Anodyne	SORD	74	41
CC(C)c1nccc(N2C[C@@H](O)C[C@@H](C)C2)n1	ZINC000450939060	BD	On-Demand	Anodyne	SORD	74	41
CC(C)c1nccc(N2C[C@@H](C)C[C@H](O)C2)n1	ZINC000450939061	BD	On-Demand	Anodyne	SORD	74	41
CN(CCN1CCN(C)[C@H](Cc2ccccc2)C1)Cc1ccccc1	ZINC000450939075	EF	On-Demand	Anodyne	SIGMAR1	38	41
CN(CCN1CCN(C)[C@@H](Cc2ccccc2)C1)Cc1ccccc1	ZINC000450939076	EF	On-Demand	Anodyne	SIGMAR1	38	41
CC[C@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)C(=O)NC	ZINC000450939087	DD	On-Demand	Anodyne	PTR1	44	33
CC[C@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)C(=O)NC	ZINC000450939087	DD	On-Demand	Anodyne	L3MBTL3	49	32
CC[C@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)C(=O)NC	ZINC000450939087	DD	On-Demand	Anodyne	TRPC6	40	35
CC[C@@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)C(=O)NC	ZINC000450939088	DD	On-Demand	Anodyne	PTR1	44	33
CC[C@@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)C(=O)NC	ZINC000450939088	DD	On-Demand	Anodyne	L3MBTL3	49	32
CC[C@@H](Nc1ccc(C(=O)N2CCC(C)CC2)cn1)C(=O)NC	ZINC000450939088	DD	On-Demand	Anodyne	TRPC6	40	35
Cc1nsc2ncn(CCCCOc3cccc(C(F)(F)F)c3)c(=O)c12	ZINC000450939125	GI	On-Demand	Anodyne	GALR3	72	39
Cc1nsc2ncn(CCCCOc3cccc(C(F)(F)F)c3)c(=O)c12	ZINC000450939125	GI	On-Demand	Anodyne	PDS	42	36
CCO[C@@H]1CCCC[C@H]1Nc1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450939135	DG	On-Demand	Bother	TXN	18	48
CN(c1ncnc2cc(Cl)ccc12)C1CCN(CC(F)(F)F)CC1	ZINC000450939149	FH	On-Demand	Anodyne	HRP1_PLAFA	54	34
CN(c1ncnc2cc(Cl)ccc12)C1CCN(CC(F)(F)F)CC1	ZINC000450939149	FH	On-Demand	Anodyne	HNMT	47	33
COc1ccccc1CCNC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939151	FF	On-Demand	Anodyne	ENPP1	76	62
COc1cccc([C@H]2[C@H](NCc3cccnc3N)CCN2C2CC2)c1	ZINC000450939152	EF	On-Demand	Anodyne	EBP	29	41
COc1cccc([C@H]2[C@@H](NCc3cccnc3N)CCN2C2CC2)c1	ZINC000450939153	EF	On-Demand	Anodyne	EBP	29	41
COc1cccc([C@@H]2[C@@H](NCc3cccnc3N)CCN2C2CC2)c1	ZINC000450939154	EF	On-Demand	Anodyne	EBP	29	41
COc1cccc([C@@H]2[C@H](NCc3cccnc3N)CCN2C2CC2)c1	ZINC000450939155	EF	On-Demand	Anodyne	EBP	29	41
Cc1ccnc2[nH]c(SCC(=O)N[C@H]3CCCc4ccccc43)nc12	ZINC000450939160	FH	On-Demand	Anodyne	ENPP1	52	48
Cc1ccnc2[nH]c(SCC(=O)N[C@@H]3CCCc4ccccc43)nc12	ZINC000450939161	FH	On-Demand	Anodyne	ENPP1	52	48
C[C@H]1CN(c2nc3cc(F)ccc3o2)CCN1C(=O)c1cnn(C)c1	ZINC000450939168	EE	On-Demand	Anodyne	HCRTR1	51	45
C[C@H]1CN(c2nc3cc(F)ccc3o2)CCN1C(=O)c1cnn(C)c1	ZINC000450939168	EE	On-Demand	Anodyne	HCRTR2	33	45
COc1ccc(OC)c(CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450939186	DH	On-Demand	Anodyne	CYP2C19	32	40
COc1ccc(OC)c(CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450939186	DH	On-Demand	Anodyne	ENPP1	60	38
COc1ccc(OC)c(CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450939186	DH	On-Demand	Anodyne	METAP2	0	43
COC[C@H]1CCCCN1c1ncnc2c(F)cccc12	ZINC000450939194	CF	On-Demand	Anodyne	CHRNA10	41	37
COC[C@@H]1CCCCN1c1ncnc2c(F)cccc12	ZINC000450939195	CF	On-Demand	Anodyne	CHRNA10	41	37
C[C@H]1CN(c2nccc3ccc(F)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450939201	FE	On-Demand	Anodyne	HCRTR1	53	34
C[C@H]1CN(c2nccc3ccc(F)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450939201	FE	On-Demand	Anodyne	SLC6A7	0	41
C[C@H]1CN(c2cc(C#N)c3ccccc3n2)CCN1C(=O)c1cnn(C)c1	ZINC000450939213	FE	On-Demand	Mild	SMO	38	46
CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nc3c(C)ccnc3[nH]2)c1C	ZINC000450939224	FG	On-Demand	Anodyne	ENPP1	60	49
O[C@@H](COc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450939225	FG	On-Demand	Anodyne	ADRB2	35	42
O[C@@H](COc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450939225	FG	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](COc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450939225	FG	On-Demand	Anodyne	CCR1	39	40
O[C@@H](COc1ccccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450939225	FG	On-Demand	Anodyne	ABCB1	57	46
O=C(CCCN1CCC[C@](O)(Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450939228	ED	On-Demand	Anodyne	DRD2	31	46
O=C(CCCN1CCC[C@](O)(Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450939228	ED	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@](O)(Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450939228	ED	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCC[C@](O)(Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450939228	ED	On-Demand	Anodyne	CYP2J2	45	32
O=C(CCCN1CCC[C@@](O)(Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450939229	ED	On-Demand	Anodyne	DRD2	31	46
O=C(CCCN1CCC[C@@](O)(Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450939229	ED	On-Demand	Anodyne	DRD4	0	49
O=C(CCCN1CCC[C@@](O)(Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450939229	ED	On-Demand	Anodyne	SLC18A3	0	45
O=C(CCCN1CCC[C@@](O)(Cn2ccnn2)C1)c1ccc(F)cc1	ZINC000450939229	ED	On-Demand	Anodyne	CYP2J2	45	32
CCOc1cccc(CN(CCO)c2ncnc3c(F)cccc23)c1	ZINC000450939231	EG	On-Demand	Anodyne	CETP	0	40
O=C1N[C@@H]2CCCC[C@@H]2C[C@@H]1SCc1ccc2c(c1)OCO2	ZINC000450939234	DG	On-Demand	Anodyne	SSTR3	94	33
O=C1N[C@@H]2CCCC[C@H]2C[C@H]1SCc1ccc2c(c1)OCO2	ZINC000450939235	DG	On-Demand	Anodyne	SSTR3	94	33
O=C1N[C@@H]2CCCC[C@@H]2C[C@H]1SCc1ccc2c(c1)OCO2	ZINC000450939236	DG	On-Demand	Anodyne	SSTR3	94	33
O=C1N[C@@H]2CCCC[C@H]2C[C@@H]1SCc1ccc2c(c1)OCO2	ZINC000450939237	DG	On-Demand	Anodyne	SSTR3	94	33
CC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nc1	ZINC000450939238	EE	On-Demand	Anodyne	CASR	45	38
Cn1ncc2c(N)nc(N(CCN3CCOCC3)Cc3ccco3)nc21	ZINC000450939246	FC	On-Demand	Anodyne	ADORA2A	25	44
CCOc1ccc(OC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939247	FG	On-Demand	Anodyne	ADRB3	45	39
CCOc1ccc(OC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939247	FG	On-Demand	Anodyne	ACOX1	76	34
CCOc1ccc(OC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939247	FG	On-Demand	Anodyne	CYP2D6	25	41
CCOc1ccc(OC[C@@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939247	FG	On-Demand	Anodyne	ABCB1	58	44
CCOc1ccc(OC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939248	FG	On-Demand	Anodyne	ADRB3	45	39
CCOc1ccc(OC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939248	FG	On-Demand	Anodyne	ACOX1	76	34
CCOc1ccc(OC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939248	FG	On-Demand	Anodyne	CYP2D6	25	41
CCOc1ccc(OC[C@H](O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939248	FG	On-Demand	Anodyne	ABCB1	58	44
CCOc1cccc(CN(CCO)c2cc(C)nc(CC)n2)c1	ZINC000450939252	DF	On-Demand	Anodyne	SQLE	44	31
CC(F)(F)CCSCC(=O)Nc1ccc(F)cc1	ZINC000450939256	CH	On-Demand	Anodyne	ENPP1	49	30
Cc1noc([C@@H]2CN(Cc3ccc(-c4cccs4)cc3)CCN2C)n1	ZINC000450939257	FH	On-Demand	Anodyne	NK-3	0	40
Cc1noc([C@H]2CN(Cc3ccc(-c4cccs4)cc3)CCN2C)n1	ZINC000450939260	FH	On-Demand	Anodyne	NK-3	0	40
CNc1nc(N(CCN2CCOCC2)Cc2ccco2)nc2ccccc12	ZINC000450939263	FE	On-Demand	Anodyne	CASR	42	36
COc1ccc(N2CCN(c3c(C#N)cnc4ccc(Cl)cc34)CC2)nc1	ZINC000450939265	GG	On-Demand	Mild	SRC	75	39
COC[C@H]1CCCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)CC1	ZINC000450939273	FG	On-Demand	Anodyne	PDE3B	58	36
COC[C@H]1CCCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)CC1	ZINC000450939273	FG	On-Demand	Anodyne	GALR2	45	36
COC[C@@H]1CCCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)CC1	ZINC000450939274	FG	On-Demand	Anodyne	PDE3B	58	36
COC[C@@H]1CCCN(c2cc(Nc3ccc(OC)cc3OC)ncn2)CC1	ZINC000450939274	FG	On-Demand	Anodyne	GALR2	45	36
COC[C@@H]1CCCN(c2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000450939285	DF	On-Demand	Bother	TAAR1	21	42
COC[C@H]1CCCN(c2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000450939287	DF	On-Demand	Bother	TAAR1	21	42
C[C@@H](O)CCSCC(=O)Nc1ccc(F)cc1	ZINC000450939289	CE	On-Demand	Anodyne	ENPP1	50	30
C[C@H](O)CCSCC(=O)Nc1ccc(F)cc1	ZINC000450939290	CE	On-Demand	Anodyne	ENPP1	50	30
CCS(=O)(=O)Cc1ccc(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1	ZINC000450939320	GG	On-Demand	Bother	PKM	45	41
COC[C@@H]1CCCN(c2ncc(C#N)cc2Cl)CC1	ZINC000450939321	CF	On-Demand	Mild	CXCR3	16	42
COC[C@H]1CCCN(c2ncc(C#N)cc2Cl)CC1	ZINC000450939322	CF	On-Demand	Mild	CXCR3	16	42
COC[C@@H]1CCCN(c2ccc(C(=O)OC)nn2)CC1	ZINC000450939323	CD	On-Demand	Anodyne	SCD1	33	43
COC[C@H]1CCCN(c2ccc(C(=O)OC)nn2)CC1	ZINC000450939324	CD	On-Demand	Anodyne	SCD1	33	43
COC[C@@H]1CCCN(c2ncc(C(F)(F)F)s2)CC1	ZINC000450939325	CG	On-Demand	Anodyne	MLYCD	63	39
COC[C@H]1CCCN(c2ncc(C(F)(F)F)s2)CC1	ZINC000450939326	CG	On-Demand	Anodyne	MLYCD	63	39
O=C(COc1ccc(C(F)(F)F)cc1F)NC[C@@H]1CCCO1	ZINC000450939331	DF	On-Demand	Anodyne	PPARD	37	42
O=C(COc1ccc(C(F)(F)F)cc1F)NC[C@H]1CCCO1	ZINC000450939335	DF	On-Demand	Anodyne	PPARD	37	42
CN(C)C(=O)c1cncc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450939336	FD	On-Demand	Anodyne	CASR	50	35
COc1ccc(N2CCN(c3nccc(C)n3)CC2)nc1	ZINC000450939339	CD	On-Demand	Anodyne	SORD	52	43
CCOc1cccc(CN(CCO)c2ncccn2)c1	ZINC000450939350	CD	On-Demand	Anodyne	CETP	0	45
CCOc1cccc(CN(CCO)c2ncccn2)c1	ZINC000450939350	CD	On-Demand	Anodyne	SQLE	45	30
CCOc1cccc(CN(CCO)c2ccc([N+](=O)[O-])nc2)c1	ZINC000450939362	DE	On-Demand	Bother	CETP	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H]1CCC(F)(F)C1	ZINC000450939364	EG	On-Demand	Anodyne	TIMP3	53	31
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@H]1CCC(F)(F)C1	ZINC000450939364	EG	On-Demand	Anodyne	F11	43	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@@H]1CCC(F)(F)C1	ZINC000450939365	EG	On-Demand	Anodyne	TIMP3	53	31
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@@H]1CCC(F)(F)C1	ZINC000450939365	EG	On-Demand	Anodyne	F11	43	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H]1CCC(F)(F)C1	ZINC000450939367	EG	On-Demand	Anodyne	TIMP3	53	31
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@H]1CCC(F)(F)C1	ZINC000450939367	EG	On-Demand	Anodyne	F11	43	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H]1CCC(F)(F)C1	ZINC000450939369	EG	On-Demand	Anodyne	TIMP3	53	31
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@H]1CCC(F)(F)C1	ZINC000450939369	EG	On-Demand	Anodyne	F11	43	34
CCOc1cccc(CN(CCO)c2nc(C(F)(F)F)cs2)c1	ZINC000450939371	EH	On-Demand	Anodyne	CETP	0	43
CCOc1cccc(CN(CCO)c2nc(C(F)(F)F)cs2)c1	ZINC000450939371	EH	On-Demand	Anodyne	SQLE	67	33
CCOc1cccc(CN(CCO)c2nc(C(F)(F)F)cs2)c1	ZINC000450939371	EH	On-Demand	Anodyne	PDS	48	33
CNS(=O)(=O)c1ccc(N[C@H](C)c2cccc(C)c2)c([N+](=O)[O-])c1	ZINC000450939377	EF	On-Demand	Bother	BDKRB1	23	42
COc1ccc(N2CCN(c3ncnc4[nH]ccc34)CC2)nc1	ZINC000450939381	DD	On-Demand	Anodyne	PDGFRB	46	36
COc1ccc(N2CCN(c3ncnc4[nH]ccc34)CC2)nc1	ZINC000450939381	DD	On-Demand	Anodyne	AKT2	53	56
COc1ccc(N2CCN(c3ncnc4[nH]ccc34)CC2)nc1	ZINC000450939381	DD	On-Demand	Anodyne	AKT3	38	42
COc1ccc(N2CCN(c3ncnc4[nH]ccc34)CC2)nc1	ZINC000450939381	DD	On-Demand	Anodyne	ROCK2	45	43
COc1ccc(N2CCN(c3ncnc4[nH]ccc34)CC2)nc1	ZINC000450939381	DD	On-Demand	Anodyne	PDE3B	46	33
COc1ccc(N2CCN(c3ncnc4[nH]ccc34)CC2)nc1	ZINC000450939381	DD	On-Demand	Anodyne	AKT1	25	44
CCc1cc2nncn2c(SCc2nc(-c3cc(OC)ncn3)no2)n1	ZINC000450939384	FD	On-Demand	Anodyne	TNKS2	15	40
CNS(=O)(=O)c1ccc(N[C@@H](C)c2cccc(C)c2)c([N+](=O)[O-])c1	ZINC000450939386	EF	On-Demand	Bother	BDKRB1	23	42
O[C@H](COc1c(Cl)cccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450939390	GI	On-Demand	Anodyne	ABCB1	60	46
O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC(F)(c2ccccn2)CC1	ZINC000450939392	GI	On-Demand	Anodyne	ABCB1	60	46
COc1ccc(N2CCN(c3cc(C(C)=O)ccc3S(C)(=O)=O)CC2)nc1	ZINC000450939394	GE	On-Demand	Anodyne	GPR119	19	47
NC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nn1	ZINC000450939395	EC	On-Demand	Anodyne	CASR	52	36
Cc1cccc([C@@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)c1	ZINC000450939402	CH	On-Demand	Bother	PLK1	30	43
Cc1cccc([C@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)c1	ZINC000450939404	CH	On-Demand	Bother	PLK1	30	43
C[C@H](CCC1CC1)NC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450939408	DJ	On-Demand	Anodyne	CACNA1I	48	40
CC(=O)[C@@](C)(O)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450939411	DD	On-Demand	Anodyne	CACNA1I	48	34
CC(=O)[C@@](C)(O)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450939412	DD	On-Demand	Anodyne	CACNA1I	48	34
CC(=O)[C@](C)(O)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450939413	DD	On-Demand	Anodyne	CACNA1I	48	34
C[C@@H](CCC1CC1)NC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000450939414	DJ	On-Demand	Anodyne	CACNA1I	59	40
CC(=O)[C@](C)(O)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450939415	DD	On-Demand	Anodyne	CACNA1I	48	34
CNC(=O)N[C@H]1CCN(C(=O)C2=C(c3ccccc3)CCC2)C1	ZINC000450939423	DE	On-Demand	Anodyne	MTNR1A	21	41
CNC(=O)N[C@@H]1CCN(C(=O)C2=C(c3ccccc3)CCC2)C1	ZINC000450939425	DE	On-Demand	Anodyne	MTNR1A	21	41
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450939427	GG	On-Demand	Anodyne	EGFR	34	44
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450939427	GG	On-Demand	Anodyne	SLC6A1	25	41
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450939427	GG	On-Demand	Anodyne	PDE3A	54	41
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450939427	GG	On-Demand	Anodyne	PDGFRB	92	46
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450939427	GG	On-Demand	Anodyne	PDE3B	80	42
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450939427	GG	On-Demand	Anodyne	MET	28	40
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939430	GG	On-Demand	Anodyne	EGFR	34	44
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939430	GG	On-Demand	Anodyne	SLC6A1	25	41
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939430	GG	On-Demand	Anodyne	PDE3A	54	41
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939430	GG	On-Demand	Anodyne	PDGFRB	92	46
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939430	GG	On-Demand	Anodyne	PDE3B	80	42
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939430	GG	On-Demand	Anodyne	MET	28	40
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939431	GG	On-Demand	Anodyne	EGFR	34	44
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939431	GG	On-Demand	Anodyne	SLC6A1	25	41
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939431	GG	On-Demand	Anodyne	PDE3A	54	41
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939431	GG	On-Demand	Anodyne	PDGFRB	92	46
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939431	GG	On-Demand	Anodyne	PDE3B	80	42
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(OC)cc23)C[C@H]1c1ccccc1	ZINC000450939431	GG	On-Demand	Anodyne	MET	28	40
Fc1ccc2c(c1)CCN2C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450939436	FF	On-Demand	Anodyne	SCD1	29	42
Fc1ccc2c(c1)CCN2C1CCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450939436	FF	On-Demand	Anodyne	SCD	24	42
COC(=O)[C@H]1CN(c2c(C#N)cccc2C#N)C[C@@H]1c1ccccc1	ZINC000450939453	EF	On-Demand	Mild	SLC6A1	96	45
COC(=O)[C@H]1CN(c2c(C#N)cccc2C#N)C[C@H]1c1ccccc1	ZINC000450939454	EF	On-Demand	Mild	SLC6A1	96	45
COC(=O)[C@H]1CN(c2nc3cc(F)ccc3o2)C[C@@H]1c1ccccc1	ZINC000450939465	EG	On-Demand	Anodyne	SLC6A1	33	41
COC(=O)[C@H]1CN(c2nc3cc(F)ccc3o2)C[C@@H]1c1ccccc1	ZINC000450939465	EG	On-Demand	Anodyne	CTRA_BOVIN	42	33
COC(=O)[C@H]1CN(c2nc3cc(F)ccc3o2)C[C@@H]1c1ccccc1	ZINC000450939465	EG	On-Demand	Anodyne	NPBWR1	42	41
COC(=O)[C@H]1CN(c2nc3cc(F)ccc3o2)C[C@H]1c1ccccc1	ZINC000450939466	EG	On-Demand	Anodyne	SLC6A1	33	41
COC(=O)[C@H]1CN(c2nc3cc(F)ccc3o2)C[C@H]1c1ccccc1	ZINC000450939466	EG	On-Demand	Anodyne	CTRA_BOVIN	42	33
COC(=O)[C@H]1CN(c2nc3cc(F)ccc3o2)C[C@H]1c1ccccc1	ZINC000450939466	EG	On-Demand	Anodyne	NPBWR1	42	41
COC(=O)[C@@H]1CN(c2nc3cc(F)ccc3o2)C[C@H]1c1ccccc1	ZINC000450939467	EG	On-Demand	Anodyne	SLC6A1	33	41
COC(=O)[C@@H]1CN(c2nc3cc(F)ccc3o2)C[C@H]1c1ccccc1	ZINC000450939467	EG	On-Demand	Anodyne	CTRA_BOVIN	42	33
COC(=O)[C@@H]1CN(c2nc3cc(F)ccc3o2)C[C@H]1c1ccccc1	ZINC000450939467	EG	On-Demand	Anodyne	NPBWR1	42	41
O=C(NC[C@@H]1CCCN(CC/C=C\c2ccccc2)C1)c1ccco1	ZINC000450939468	EH	On-Demand	Anodyne	SLC6A1	108	38
O=C(NC[C@@H]1CCCN(CC/C=C/c2ccccc2)C1)c1ccco1	ZINC000450939469	EH	On-Demand	Anodyne	SLC6A1	108	38
O=C(NC[C@H]1CCCN(CC/C=C\c2ccccc2)C1)c1ccco1	ZINC000450939470	EH	On-Demand	Anodyne	SLC6A1	108	38
O=C(NC[C@H]1CCCN(CC/C=C/c2ccccc2)C1)c1ccco1	ZINC000450939471	EH	On-Demand	Anodyne	SLC6A1	108	38
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccccc1	ZINC000450939477	FH	On-Demand	Anodyne	SLC6A1	62	47
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccccc1	ZINC000450939477	FH	On-Demand	Anodyne	PDE3A	43	34
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccccc1	ZINC000450939477	FH	On-Demand	Anodyne	PDGFRB	39	41
COC(=O)[C@@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccccc1	ZINC000450939477	FH	On-Demand	Anodyne	PDE3B	65	34
COC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccccc1	ZINC000450939478	FH	On-Demand	Anodyne	SLC6A1	62	47
COC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccccc1	ZINC000450939478	FH	On-Demand	Anodyne	PDE3A	43	34
COC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccccc1	ZINC000450939478	FH	On-Demand	Anodyne	PDGFRB	39	41
COC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@H]1c1ccccc1	ZINC000450939478	FH	On-Demand	Anodyne	PDE3B	65	34
COC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@@H]1c1ccccc1	ZINC000450939479	FH	On-Demand	Anodyne	SLC6A1	62	47
COC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@@H]1c1ccccc1	ZINC000450939479	FH	On-Demand	Anodyne	PDE3A	43	34
COC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@@H]1c1ccccc1	ZINC000450939479	FH	On-Demand	Anodyne	PDGFRB	39	41
COC(=O)[C@H]1CN(c2ncnc3cc(Cl)ccc23)C[C@@H]1c1ccccc1	ZINC000450939479	FH	On-Demand	Anodyne	PDE3B	65	34
COC(=O)[C@H]1CN(c2nccc(C#N)c2Cl)C[C@@H]1c1ccccc1	ZINC000450939480	EF	On-Demand	Mild	SLC6A1	28	43
COC(=O)[C@H]1CN(c2nccc(C#N)c2Cl)C[C@H]1c1ccccc1	ZINC000450939481	EF	On-Demand	Mild	SLC6A1	28	43
COC(=O)[C@@H]1CN(c2nccc(C#N)c2Cl)C[C@H]1c1ccccc1	ZINC000450939482	EF	On-Demand	Mild	SLC6A1	28	43
CCO[C@@H]1CCC[C@H]1Nc1cc(NCC2CC2)ncn1	ZINC000450939488	CF	On-Demand	Anodyne	GPR39	0	42
COC(=O)[C@H]1CN(c2ncc(Cl)cn2)C[C@H]1c1ccccc1	ZINC000450939489	DF	On-Demand	Anodyne	SLC6A1	101	49
COC(=O)[C@H]1CN(c2ncc(Cl)cn2)C[C@H]1c1ccccc1	ZINC000450939489	DF	On-Demand	Anodyne	SLC6A3	38	46
COC(=O)[C@H]1CN(c2ncc(Cl)cn2)C[C@@H]1c1ccccc1	ZINC000450939490	DF	On-Demand	Anodyne	SLC6A1	101	49
COC(=O)[C@H]1CN(c2ncc(Cl)cn2)C[C@@H]1c1ccccc1	ZINC000450939490	DF	On-Demand	Anodyne	SLC6A3	38	46
COC(=O)[C@@H]1CN(c2ncc(Cl)cn2)C[C@H]1c1ccccc1	ZINC000450939491	DF	On-Demand	Anodyne	SLC6A1	101	49
COC(=O)[C@@H]1CN(c2ncc(Cl)cn2)C[C@H]1c1ccccc1	ZINC000450939491	DF	On-Demand	Anodyne	SLC6A3	38	46
COC(=O)[C@H]1CN(c2cnn(C)c(=O)c2Cl)C[C@@H]1c1ccccc1	ZINC000450939510	ED	On-Demand	Anodyne	SLC6A1	80	43
COC(=O)[C@H]1CN(c2cnn(C)c(=O)c2Cl)C[C@H]1c1ccccc1	ZINC000450939512	ED	On-Demand	Anodyne	SLC6A1	80	43
CNC(=O)N[C@@H]1CCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450939522	DC	On-Demand	Anodyne	MTNR1A	29	42
CNC(=O)N[C@@H]1CCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450939522	DC	On-Demand	Anodyne	MTNR1B	35	48
CNC(=O)N[C@@H]1CCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450939522	DC	On-Demand	Anodyne	EPHX2	37	43
CNC(=O)N[C@H]1CCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450939523	DC	On-Demand	Anodyne	MTNR1A	29	42
CNC(=O)N[C@H]1CCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450939523	DC	On-Demand	Anodyne	MTNR1B	35	48
CNC(=O)N[C@H]1CCN(C(=O)CCOc2cccc(OC)c2)C1	ZINC000450939523	DC	On-Demand	Anodyne	EPHX2	37	43
COC(=O)[C@@H](NC(=O)c1ccc(C2CC2)nc1C)c1cc(C)cc(C)c1	ZINC000450939527	FH	On-Demand	Anodyne	TACR3	15	49
COC(=O)[C@H](NC(=O)c1ccc(C2CC2)nc1C)c1cc(C)cc(C)c1	ZINC000450939528	FH	On-Demand	Anodyne	TACR3	15	49
COCc1nc(OC)cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)n1	ZINC000450939533	FE	On-Demand	Anodyne	SLC6A1	35	40
COCc1nc(OC)cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)n1	ZINC000450939533	FE	On-Demand	Anodyne	SLC6A3	17	45
COC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CC(C)(C)O1	ZINC000450939542	GD	On-Demand	Anodyne	MTNR1A	46	36
COC[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)CC(C)(C)O1	ZINC000450939544	GD	On-Demand	Anodyne	MTNR1A	46	36
C[C@H]1C[C@@H](O)CN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450939574	CE	On-Demand	Anodyne	SORD	48	40
C[C@@H]1C[C@@H](O)CN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450939575	CE	On-Demand	Anodyne	SORD	48	40
C[C@H]1C[C@H](O)CN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450939576	CE	On-Demand	Anodyne	SORD	48	40
CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C[C@H]1CCNC(=O)CC1	ZINC000450939582	GI	On-Demand	Anodyne	TACR1	31	40
CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C[C@@H]1CCNC(=O)CC1	ZINC000450939583	GI	On-Demand	Anodyne	TACR1	31	40
CC[C@@H](Nc1ccc(S(=O)(=O)NCC2CC2)cn1)C(=O)NC	ZINC000450939596	EC	On-Demand	Anodyne	NPY2R	52	38
CC[C@H](Nc1ccc(S(=O)(=O)NCC2CC2)cn1)C(=O)NC	ZINC000450939597	EC	On-Demand	Anodyne	NPY2R	52	38
CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2)cn1)C(=O)NC	ZINC000450939606	GE	On-Demand	Anodyne	LEF	48	40
CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2)cn1)C(=O)NC	ZINC000450939607	GE	On-Demand	Anodyne	LEF	48	40
COC(=O)[C@@H](NC(=O)c1cn(CCc2ccccc2)nn1)c1cc(C)cc(C)c1	ZINC000450939616	GF	On-Demand	Anodyne	PTGER3	50	37
COC(=O)[C@H](NC(=O)c1cn(CCc2ccccc2)nn1)c1cc(C)cc(C)c1	ZINC000450939617	GF	On-Demand	Anodyne	PTGER3	50	37
Cc1ccnc2[nH]c(SCC(=O)NC(=O)NCC(C)C)nc12	ZINC000450939679	DD	On-Demand	Anodyne	ENPP1	57	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939681	FF	On-Demand	Anodyne	CMA1	41	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939681	FF	On-Demand	Anodyne	CTRA_BOVIN	46	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939681	FF	On-Demand	Anodyne	FCER2	64	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939681	FF	On-Demand	Anodyne	CYSP_TRYCR	41	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939681	FF	On-Demand	Anodyne	CTRC	43	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939681	FF	On-Demand	Anodyne	ENPP1	64	54
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939682	FF	On-Demand	Anodyne	CMA1	41	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939682	FF	On-Demand	Anodyne	CTRA_BOVIN	46	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939682	FF	On-Demand	Anodyne	FCER2	64	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939682	FF	On-Demand	Anodyne	CYSP_TRYCR	41	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939682	FF	On-Demand	Anodyne	CTRC	43	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450939682	FF	On-Demand	Anodyne	ENPP1	64	54
CC[C@H](O)CC(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450939688	CF	On-Demand	Anodyne	SLC12A5	82	43
CC[C@@H](O)CC(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000450939689	CF	On-Demand	Anodyne	SLC12A5	82	43
CC[C@H](O)CC(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450939690	CF	On-Demand	Anodyne	SLC12A5	82	43
CC[C@@H](O)CC(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000450939691	CF	On-Demand	Anodyne	SLC12A5	82	43
COc1cc(OC)nc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450939695	EC	On-Demand	Anodyne	SLC6A7	0	44
CCC(=O)CCCN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450939702	CI	On-Demand	Anodyne	SLC6A1	47	37
CCC(=O)CCCN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450939702	CI	On-Demand	Anodyne	SLC6A3	28	52
CCC(=O)CCCN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450939702	CI	On-Demand	Anodyne	SLC18A3	40	63
CCC(=O)CCCN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450939702	CI	On-Demand	Anodyne	ACHP_LYMST	17	41
CCC(=O)CCCN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450939702	CI	On-Demand	Anodyne	Q8WSF8_APLCA	32	41
COCC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939708	FG	On-Demand	Anodyne	HRH2	18	43
COCC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939708	FG	On-Demand	Anodyne	CCR3	39	40
COCC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939708	FG	On-Demand	Anodyne	EPHX2	19	45
COCC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939708	FG	On-Demand	Anodyne	CACNA1I	45	38
COCC[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939708	FG	On-Demand	Anodyne	PRMT3	33	41
COCC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939709	FG	On-Demand	Anodyne	HRH2	18	43
COCC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939709	FG	On-Demand	Anodyne	CCR3	39	40
COCC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939709	FG	On-Demand	Anodyne	EPHX2	19	45
COCC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939709	FG	On-Demand	Anodyne	CACNA1I	45	38
COCC[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450939709	FG	On-Demand	Anodyne	PRMT3	33	41
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450939712	GF	On-Demand	Bother	L3MBTL1	0	41
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000450939712	GF	On-Demand	Bother	L3MBTL3	15	41
COC(=O)[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ccc2c(c1)CCO2	ZINC000450939727	GE	On-Demand	Anodyne	MMP13	0	40
COC(=O)[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ccc2c(c1)CCO2	ZINC000450939729	GE	On-Demand	Anodyne	MMP13	0	40
COc1ccc(N2CCN(c3ncnc4[nH]cnc34)CC2)nc1	ZINC000450939730	DD	On-Demand	Anodyne	AHK3	0	42
CC[C@@H](Nc1nc2ccccc2n1C)C(=O)NC	ZINC000450939736	BC	On-Demand	Anodyne	HDAC8	15	40
CC[C@H](Nc1nc2ccccc2n1C)C(=O)NC	ZINC000450939738	BC	On-Demand	Anodyne	HDAC8	15	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	ACE	26	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	PPARG	20	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	PPARA	27	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	MME	65	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	ANPEP	41	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	CMA1	44	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	FCER2	42	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	PAPA1_CARPA	52	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	PPARD	79	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	HLA-DRB1	46	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	PAM	0	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	MTTP	49	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	CAPN1	45	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	CTRC	47	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	CAPN2	44	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	ACE2	58	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	FPR1	40	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	CTRB_BOVIN	44	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	BLA1_STEMA	34	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939739	GH	On-Demand	Anodyne	PDS	44	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	ACE	26	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	PPARG	20	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	PPARA	27	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	MME	65	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	ANPEP	41	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	CMA1	44	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	FCER2	42	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	PAPA1_CARPA	52	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	PPARD	79	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	HLA-DRB1	46	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	PAM	0	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	MTTP	49	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	CAPN1	45	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	CTRC	47	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	CAPN2	44	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	ACE2	58	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	FPR1	40	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	CTRB_BOVIN	44	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	BLA1_STEMA	34	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450939741	GH	On-Demand	Anodyne	PDS	44	37
COc1ccc(N2CCN(c3ccccc3S(C)(=O)=O)CC2)nc1	ZINC000450939755	ED	On-Demand	Anodyne	GPR119	17	47
CC[C@@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450939759	DD	On-Demand	Bother	TAAR1	18	51
CC[C@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])C(=O)NC	ZINC000450939760	DD	On-Demand	Bother	TAAR1	18	51
CN(CCN1CCCCC[C@@H]1CCO)Cc1ccccc1	ZINC000450939764	CF	On-Demand	Anodyne	SLC18A2	68	47
CN(CCN1CCCCC[C@@H]1CCO)Cc1ccccc1	ZINC000450939764	CF	On-Demand	Anodyne	SIGMAR1	26	43
CN(CCN1CCCCC[C@H]1CCO)Cc1ccccc1	ZINC000450939766	CF	On-Demand	Anodyne	SLC18A2	68	47
CN(CCN1CCCCC[C@H]1CCO)Cc1ccccc1	ZINC000450939766	CF	On-Demand	Anodyne	SIGMAR1	26	43
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939775	FF	On-Demand	Anodyne	FOLH1	49	47
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939775	FF	On-Demand	Anodyne	TRPV1	22	57
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939775	FF	On-Demand	Anodyne	NCE103	37	43
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939775	FF	On-Demand	Anodyne	P96878_MYCTU	22	42
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939775	FF	On-Demand	Anodyne	N1L	0	40
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939775	FF	On-Demand	Anodyne	CAN2	0	43
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939776	FF	On-Demand	Anodyne	FOLH1	49	47
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939776	FF	On-Demand	Anodyne	TRPV1	22	57
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939776	FF	On-Demand	Anodyne	NCE103	37	43
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939776	FF	On-Demand	Anodyne	P96878_MYCTU	22	42
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939776	FF	On-Demand	Anodyne	N1L	0	40
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(C)c(C)c1	ZINC000450939776	FF	On-Demand	Anodyne	CAN2	0	43
COc1ccc(N2CCN(c3nccc(N[C@H]4CCCOC4)n3)CC2)nc1	ZINC000450939791	FD	On-Demand	Anodyne	NPBWR1	40	36
COc1ccc(N2CCN(c3nccc(N[C@@H]4CCCOC4)n3)CC2)nc1	ZINC000450939792	FD	On-Demand	Anodyne	NPBWR1	40	36
COC(=O)c1coc(CN(C)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1	ZINC000450939804	GI	On-Demand	Anodyne	TACR1	31	40
CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450939805	GG	On-Demand	Anodyne	FDFT1	26	41
CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450939805	GG	On-Demand	Anodyne	LIPG	51	38
CCOC(=O)[C@H]1CCCN(C(=O)COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450939811	GG	On-Demand	Anodyne	FDFT1	26	41
CCOC(=O)[C@H]1CCCN(C(=O)COc2ccc(C(F)(F)F)cc2F)C1	ZINC000450939811	GG	On-Demand	Anodyne	LIPG	51	38
CCc1ccc([C@H](C)NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939812	FH	On-Demand	Anodyne	ACACA	42	33
CCc1ccc([C@@H](C)NC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450939817	FH	On-Demand	Anodyne	ACACA	42	33
COc1ccc(CNC(=O)CCSCc2ccc3c(c2)OCO3)c(OC)c1	ZINC000450939821	GG	On-Demand	Anodyne	PDE5A	0	43
COc1ccc(CNC(=O)CCSCc2ccc3c(c2)OCO3)c(OC)c1	ZINC000450939821	GG	On-Demand	Anodyne	EDNRB	95	42
COc1ccc(CNC(=O)CCSCc2ccc3c(c2)OCO3)c(OC)c1	ZINC000450939821	GG	On-Demand	Anodyne	EDNRA	91	42
COc1ccc(CNC(=O)CCSCc2ccc3c(c2)OCO3)c(OC)c1	ZINC000450939821	GG	On-Demand	Anodyne	BMP1	73	44
COc1ccc(CNC(=O)CCSCc2ccc3c(c2)OCO3)c(OC)c1	ZINC000450939821	GG	On-Demand	Anodyne	NOS2	74	35
COc1ccc(CNC(=O)CCSCc2ccc3c(c2)OCO3)c(OC)c1	ZINC000450939821	GG	On-Demand	Anodyne	MTNR1A	47	42
COc1ccc(N2CCN(c3ccnc(N4CCOCC4)n3)CC2)nc1	ZINC000450939823	FD	On-Demand	Anodyne	ADK	33	44
COc1ccc(N2CCN(c3ccnc(N4CCOCC4)n3)CC2)nc1	ZINC000450939823	FD	On-Demand	Anodyne	SORD	79	38
COc1ccc(N2CCN(c3ccnc(N4CCOCC4)n3)CC2)nc1	ZINC000450939823	FD	On-Demand	Anodyne	SMG1	40	33
OCC[C@@H]1CCCCCN1Cc1ccccc1OC1CC1	ZINC000450939872	CG	On-Demand	Anodyne	SLC18A2	25	40
OCC[C@H]1CCCCCN1Cc1ccccc1OC1CC1	ZINC000450939875	CG	On-Demand	Anodyne	SLC18A2	25	40
COC(=O)c1cc(C)nc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1[N+](=O)[O-]	ZINC000450939899	GE	On-Demand	Bother	CACNA1C	44	37
COC(=O)c1cc(C)nc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1[N+](=O)[O-]	ZINC000450939899	GE	On-Demand	Bother	CACNA1D	68	37
COC(=O)c1cc(C)nc(N2C[C@H](C(=O)OC)[C@H](c3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450939906	GE	On-Demand	Bother	CACNA1C	44	37
COC(=O)c1cc(C)nc(N2C[C@H](C(=O)OC)[C@H](c3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450939906	GE	On-Demand	Bother	CACNA1D	68	37
COc1cccc([C@@H]2C[C@@H](N(C)c3ccnc(C4CC4)n3)C2)c1	ZINC000450939908	DH	On-Demand	Anodyne	EBP	15	41
CCNC(=O)C[C@@H]1CCCCN1CC/C=C\c1ccccc1	ZINC000450939911	DG	On-Demand	Anodyne	ACKR3	40	38
CCNC(=O)C[C@H]1CCCCN1CC/C=C/c1ccccc1	ZINC000450939912	DG	On-Demand	Anodyne	ACKR3	40	38
CCNC(=O)C[C@H]1CCCCN1CC/C=C\c1ccccc1	ZINC000450939915	DG	On-Demand	Anodyne	ACKR3	40	38
COC1(CSCC(=O)Nc2ccc(F)cc2)CCC1	ZINC000450939916	CG	On-Demand	Anodyne	ENPP1	52	31
CCC[C@H](O)CN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450939918	DF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
CCNC(=O)C[C@@H]1CCCCN1CC/C=C/c1ccccc1	ZINC000450939919	DG	On-Demand	Anodyne	ACKR3	40	38
C[C@@H](c1ccccc1)[C@@H](O)CN(C)[C@H](C)CO	ZINC000450939922	BD	On-Demand	Anodyne	AOC3	24	42
CCC[C@@H](O)CN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450939923	DF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	44
C[C@@H](c1ccccc1)[C@H](O)CN(C)[C@H](C)CO	ZINC000450939925	BD	On-Demand	Anodyne	AOC3	24	42
CC(C)(C)C[C@H]1CCN(c2cc(N3CCC[C@H](CO)C3)ncn2)C1	ZINC000450939946	EF	On-Demand	Anodyne	PRCP	28	40
CC(C)(C)C[C@@H]1CCN(c2cc(N3CCC[C@H](CO)C3)ncn2)C1	ZINC000450939949	EF	On-Demand	Anodyne	PRCP	28	40
CC(C)(C)C[C@H]1CCN(c2cc(N3CCC[C@@H](CO)C3)ncn2)C1	ZINC000450939953	EF	On-Demand	Anodyne	PRCP	28	40
COc1ccc(N2CCN(c3ncnc4ccc(C)cc34)CC2)nc1	ZINC000450939957	EF	On-Demand	Anodyne	PDE3A	52	41
COc1ccc(N2CCN(c3ncnc4ccc(C)cc34)CC2)nc1	ZINC000450939957	EF	On-Demand	Anodyne	PDE3B	76	41
COc1ccc(N2CCN(c3ncnc4ccc(C)cc34)CC2)nc1	ZINC000450939957	EF	On-Demand	Anodyne	HTT	0	45
CC(C)(C)C[C@@H]1CCN(c2cc(N3CCC[C@@H](CO)C3)ncn2)C1	ZINC000450939959	EF	On-Demand	Anodyne	PRCP	28	40
COc1ccc(N2CCN(c3cc(C)nc(-c4ccccn4)n3)CC2)nc1	ZINC000450939961	FF	On-Demand	Anodyne	DRD4	31	40
COc1ccc(N2CCN(c3cc(C)nc(-c4ccccn4)n3)CC2)nc1	ZINC000450939961	FF	On-Demand	Anodyne	EBP	24	43
COc1ccc(N2CCN(c3cc(C)nc(-c4ccccn4)n3)CC2)nc1	ZINC000450939961	FF	On-Demand	Anodyne	TGFB1	0	42
COc1cc(CN2CCC[C@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939978	EH	On-Demand	Anodyne	DRD4	26	40
COc1cc(CN2CCC[C@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939978	EH	On-Demand	Anodyne	TACR1	28	40
COc1cc(CN2CCC[C@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939978	EH	On-Demand	Anodyne	TACR2	41	40
COc1cc(CN2CCC[C@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939978	EH	On-Demand	Anodyne	SIGMAR1	27	40
COc1cc(CN2CCC[C@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939978	EH	On-Demand	Anodyne	TACR3	48	38
CC[C@@H](Nc1nc(-c2ccccc2Cl)cs1)C(=O)NC	ZINC000450939979	DF	On-Demand	Anodyne	ROCK1	15	40
COc1cc(CN2CCC[C@@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939981	EH	On-Demand	Anodyne	DRD4	26	40
COc1cc(CN2CCC[C@@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939981	EH	On-Demand	Anodyne	TACR1	28	40
COc1cc(CN2CCC[C@@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939981	EH	On-Demand	Anodyne	TACR2	41	40
COc1cc(CN2CCC[C@@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939981	EH	On-Demand	Anodyne	SIGMAR1	27	40
COc1cc(CN2CCC[C@@](CO)(c3ccccc3)C2)ccc1Cl	ZINC000450939981	EH	On-Demand	Anodyne	TACR3	48	38
CC[C@H](Nc1nc(-c2ccccc2Cl)cs1)C(=O)NC	ZINC000450939982	DF	On-Demand	Anodyne	ROCK1	15	40
Cc1cc(C)n(-c2cncc(N(CCN3CCOCC3)Cc3ccco3)n2)n1	ZINC000450939998	GE	On-Demand	Anodyne	ADORA2A	16	40
CCS(=O)(=O)Cc1ccc(Nc2ncc([N+](=O)[O-])s2)cc1	ZINC000450940010	EF	On-Demand	Bother	MAPK9	15	42
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450940011	CE	On-Demand	Anodyne	SLC6A9	0	45
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450940011	CE	On-Demand	Anodyne	AKR1C3	0	44
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450940011	CE	On-Demand	Anodyne	GPR119	26	48
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450940012	CE	On-Demand	Anodyne	SLC6A9	0	45
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450940012	CE	On-Demand	Anodyne	AKR1C3	0	44
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000450940012	CE	On-Demand	Anodyne	GPR119	26	48
Cc1cccc([C@@H](C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1	ZINC000450940016	EH	On-Demand	Bother	PKM	40	42
Cc1cccc([C@@H](C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1	ZINC000450940016	EH	On-Demand	Bother	KIF11	0	42
Cc1cccc([C@H](C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1	ZINC000450940018	EH	On-Demand	Bother	PKM	40	42
Cc1cccc([C@H](C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1	ZINC000450940018	EH	On-Demand	Bother	KIF11	0	42
CNC(=O)c1cccnc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450940026	CF	On-Demand	Anodyne	SIRT3	52	32
CNC(=O)c1cccnc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450940026	CF	On-Demand	Anodyne	SIRT2	53	32
CNC(=O)c1cccnc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450940026	CF	On-Demand	Anodyne	SIRT1	52	32
CNC(=O)c1cccnc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450940028	CF	On-Demand	Anodyne	SIRT3	52	32
CNC(=O)c1cccnc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450940028	CF	On-Demand	Anodyne	SIRT2	53	32
CNC(=O)c1cccnc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450940028	CF	On-Demand	Anodyne	SIRT1	52	32
COC[C@H]1CCCN(c2ncc(OC)c(N3CCC[C@@H](COC)CC3)n2)CC1	ZINC000450940038	GF	On-Demand	Anodyne	CCR4	32	41
COC[C@H]1CCCN(c2ncc(OC)c(N3CCC[C@@H](COC)CC3)n2)CC1	ZINC000450940038	GF	On-Demand	Anodyne	PDE3B	57	32
COC[C@H]1CCCN(c2ncc(OC)c(N3CCC[C@@H](COC)CC3)n2)CC1	ZINC000450940038	GF	On-Demand	Anodyne	EHMT2	65	34
COC[C@@H]1CCCN(c2ncc(OC)c(N3CCC[C@@H](COC)CC3)n2)CC1	ZINC000450940039	GF	On-Demand	Anodyne	CCR4	32	41
COC[C@@H]1CCCN(c2ncc(OC)c(N3CCC[C@@H](COC)CC3)n2)CC1	ZINC000450940039	GF	On-Demand	Anodyne	PDE3B	57	32
COC[C@@H]1CCCN(c2ncc(OC)c(N3CCC[C@@H](COC)CC3)n2)CC1	ZINC000450940039	GF	On-Demand	Anodyne	EHMT2	65	34
COC[C@H]1CCCN(c2ncc(OC)c(N3CCC[C@H](COC)CC3)n2)CC1	ZINC000450940040	GF	On-Demand	Anodyne	CCR4	32	41
COC[C@H]1CCCN(c2ncc(OC)c(N3CCC[C@H](COC)CC3)n2)CC1	ZINC000450940040	GF	On-Demand	Anodyne	PDE3B	57	32
COC[C@H]1CCCN(c2ncc(OC)c(N3CCC[C@H](COC)CC3)n2)CC1	ZINC000450940040	GF	On-Demand	Anodyne	EHMT2	65	34
COC[C@H]1CCCN(c2nc(N3CCC[C@@H](COC)CC3)ncc2OC)CC1	ZINC000450940041	GF	On-Demand	Anodyne	CCR4	32	41
COC[C@H]1CCCN(c2nc(N3CCC[C@@H](COC)CC3)ncc2OC)CC1	ZINC000450940041	GF	On-Demand	Anodyne	PDE3B	57	32
COC[C@H]1CCCN(c2nc(N3CCC[C@@H](COC)CC3)ncc2OC)CC1	ZINC000450940041	GF	On-Demand	Anodyne	EHMT2	65	34
COC[C@H]1CCCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)CC1	ZINC000450940047	FH	On-Demand	Anodyne	P2RY12	31	42
COC[C@@H]1CCCN(c2ncc(C(=O)N3CCCCC3)cc2Cl)CC1	ZINC000450940049	FH	On-Demand	Anodyne	P2RY12	31	42
CC(=O)c1cccc(CN2CCC[C@](CO)(c3ccccc3)C2)c1	ZINC000450940067	DG	On-Demand	Anodyne	NPFFR1	41	39
CC(=O)c1cccc(CN2CCC[C@](CO)(c3ccccc3)C2)c1	ZINC000450940067	DG	On-Demand	Anodyne	SLC12A5	59	34
CC(=O)c1cccc(CN2CCC[C@@](CO)(c3ccccc3)C2)c1	ZINC000450940069	DG	On-Demand	Anodyne	NPFFR1	41	39
CC(=O)c1cccc(CN2CCC[C@@](CO)(c3ccccc3)C2)c1	ZINC000450940069	DG	On-Demand	Anodyne	SLC12A5	59	34
CC1(C(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)CCC(=O)CC1	ZINC000450940078	EI	On-Demand	Anodyne	SRD5A2	20	43
COC[C@H]1CCCN(c2nc3ccccc3nc2N2CCCC2)CC1	ZINC000450940089	EG	On-Demand	Anodyne	HTR4	40	37
COC[C@@H]1CCCN(c2nc3ccccc3nc2N2CCCC2)CC1	ZINC000450940091	EG	On-Demand	Anodyne	HTR4	40	37
CN(CCN1CCC[C@@H](CNC(=O)c2ccco2)C1)Cc1ccccc1	ZINC000450940098	FF	On-Demand	Anodyne	SLC6A1	85	36
CN(CCN1CCC[C@H](CNC(=O)c2ccco2)C1)Cc1ccccc1	ZINC000450940099	FF	On-Demand	Anodyne	SLC6A1	85	36
COC[C@H]1CCCN(c2ccnc3ccccc23)CC1	ZINC000450940109	CG	On-Demand	Anodyne	HTR4	35	41
COC[C@@H]1CCCN(c2ccnc3ccccc23)CC1	ZINC000450940110	CG	On-Demand	Anodyne	HTR4	35	41
COC[C@@H]1CCCN(c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000450940117	CG	On-Demand	Bother	CASP7	42	34
COC[C@H]1CCCN(c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000450940118	CG	On-Demand	Bother	CASP7	42	34
CC[C@@H](Nc1ncc(C(F)(F)F)cc1Cl)C(=O)NC	ZINC000450940127	CF	On-Demand	Anodyne	ATF1	51	32
CC[C@@H](Nc1ncc(C(F)(F)F)cc1Cl)C(=O)NC	ZINC000450940127	CF	On-Demand	Anodyne	NFKB1	47	32
CC[C@H](Nc1ncc(C(F)(F)F)cc1Cl)C(=O)NC	ZINC000450940128	CF	On-Demand	Anodyne	ATF1	51	32
CC[C@H](Nc1ncc(C(F)(F)F)cc1Cl)C(=O)NC	ZINC000450940128	CF	On-Demand	Anodyne	NFKB1	47	32
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1cc(C)cc(C)c1	ZINC000450940143	GG	On-Demand	Anodyne	PDE4D	15	43
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1cc(C)cc(C)c1	ZINC000450940143	GG	On-Demand	Anodyne	PDEC	0	41
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1cc(C)cc(C)c1	ZINC000450940144	GG	On-Demand	Anodyne	PDE4D	15	43
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1cc(C)cc(C)c1	ZINC000450940144	GG	On-Demand	Anodyne	PDEC	0	41
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1cc(C)cc(C)c1	ZINC000450940145	GG	On-Demand	Anodyne	PDE4D	15	43
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1cc(C)cc(C)c1	ZINC000450940145	GG	On-Demand	Anodyne	PDEC	0	41
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1cc(C)cc(C)c1	ZINC000450940146	GG	On-Demand	Anodyne	PDE4D	15	43
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1cc(C)cc(C)c1	ZINC000450940146	GG	On-Demand	Anodyne	PDEC	0	41
CCc1cccc(C(=O)N[C@@H](C(=O)OC)c2ccsc2)n1	ZINC000450940170	DE	On-Demand	Anodyne	PDE5A	31	44
CCc1cccc(C(=O)N[C@H](C(=O)OC)c2ccsc2)n1	ZINC000450940171	DE	On-Demand	Anodyne	PDE5A	31	44
CC[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)C(=O)NC	ZINC000450940175	ED	On-Demand	Anodyne	CAPN2	45	36
CC[C@@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)C(=O)NC	ZINC000450940175	ED	On-Demand	Anodyne	NPBWR1	48	40
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)C(=O)NC	ZINC000450940176	ED	On-Demand	Anodyne	CAPN2	45	36
CC[C@H](Nc1cnn(Cc2ccccc2)c(=O)c1Cl)C(=O)NC	ZINC000450940176	ED	On-Demand	Anodyne	NPBWR1	48	40
COc1ccc(-c2noc(N3C[C@@H](C)C[C@H](O)C3)n2)cc1	ZINC000450940195	CD	On-Demand	Anodyne	S1PR1	15	40
COc1ccc(-c2noc(N3C[C@@H](O)C[C@@H](C)C3)n2)cc1	ZINC000450940196	CD	On-Demand	Anodyne	S1PR1	15	40
COc1ccc(-c2noc(N3C[C@H](C)C[C@@H](O)C3)n2)cc1	ZINC000450940197	CD	On-Demand	Anodyne	S1PR1	15	40
CN(CCN1CCC2(CC1)C[C@@H]2N(C)Cc1nccs1)Cc1ccccc1	ZINC000450940207	GH	On-Demand	Anodyne	SIGMAR1	21	42
CN(CCN1CCC2(CC1)C[C@H]2N(C)Cc1nccs1)Cc1ccccc1	ZINC000450940216	GH	On-Demand	Anodyne	SIGMAR1	21	42
CCS(=O)(=O)c1ccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1	ZINC000450940231	FF	On-Demand	Anodyne	SIGMAR1	44	42
CCS(=O)(=O)c1ccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1	ZINC000450940232	FF	On-Demand	Anodyne	SIGMAR1	44	42
Cc1ccnc2[nH]c(SCC(=O)N[C@H](C)Cc3c(F)cccc3F)nc12	ZINC000450940238	GG	On-Demand	Anodyne	ENPP1	71	50
Cc1ccnc2[nH]c(SCC(=O)N[C@@H](C)Cc3c(F)cccc3F)nc12	ZINC000450940239	GG	On-Demand	Anodyne	ENPP1	71	50
Cc1cccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c12	ZINC000450940247	FE	On-Demand	Anodyne	LIMK1	34	40
Cc1cccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c12	ZINC000450940247	FE	On-Demand	Anodyne	LIMK2	86	45
Cc1cccc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c12	ZINC000450940247	FE	On-Demand	Anodyne	SLC6A7	0	41
CN(c1cnc2ccccc2n1)C1CCN(CC(F)(F)F)CC1	ZINC000450940261	DG	On-Demand	Anodyne	HPGDS	22	40
C[C@H]1CN(c2ncnc3cccc(F)c23)CCN1C(=O)c1cnn(C)c1	ZINC000450940264	FD	On-Demand	Anodyne	LIMK1	33	40
C[C@H]1CN(c2ncnc3cccc(F)c23)CCN1C(=O)c1cnn(C)c1	ZINC000450940264	FD	On-Demand	Anodyne	LIMK2	80	43
C[C@H]1CN(c2ncnc3cccc(F)c23)CCN1C(=O)c1cnn(C)c1	ZINC000450940264	FD	On-Demand	Anodyne	SLC6A7	0	43
Cc1ccnc2[nH]c(SCC(=O)N3CCCC[C@H]3C(N)=O)nc12	ZINC000450940275	ED	On-Demand	Anodyne	TRHR	55	32
Cc1ccnc2[nH]c(SCC(=O)N3CCCC[C@H]3C(N)=O)nc12	ZINC000450940275	ED	On-Demand	Anodyne	COLA	42	35
Cc1ccnc2[nH]c(SCC(=O)N3CCCC[C@H]3C(N)=O)nc12	ZINC000450940275	ED	On-Demand	Anodyne	CPT1A	45	35
Cc1ccnc2[nH]c(SCC(=O)N3CCCC[C@H]3C(N)=O)nc12	ZINC000450940275	ED	On-Demand	Anodyne	ENPP1	46	48
Cc1ccnc2[nH]c(SCC(=O)N3CCCC[C@@H]3C(N)=O)nc12	ZINC000450940276	ED	On-Demand	Anodyne	TRHR	55	32
Cc1ccnc2[nH]c(SCC(=O)N3CCCC[C@@H]3C(N)=O)nc12	ZINC000450940276	ED	On-Demand	Anodyne	COLA	42	35
Cc1ccnc2[nH]c(SCC(=O)N3CCCC[C@@H]3C(N)=O)nc12	ZINC000450940276	ED	On-Demand	Anodyne	CPT1A	45	35
Cc1ccnc2[nH]c(SCC(=O)N3CCCC[C@@H]3C(N)=O)nc12	ZINC000450940276	ED	On-Demand	Anodyne	ENPP1	46	48
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450940281	FI	On-Demand	Anodyne	AVPR2	98	42
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450940281	FI	On-Demand	Anodyne	AVPR1A	57	40
COC[C@H]1CCCCN(C(=O)Cc2cc3ccccc3s2)C1	ZINC000450940297	DH	On-Demand	Anodyne	COLA	56	34
COC[C@H]1CCCCN(C(=O)Cc2cc3ccccc3s2)C1	ZINC000450940297	DH	On-Demand	Anodyne	CPT1A	58	34
COC[C@@H]1CCCCN(C(=O)Cc2cc3ccccc3s2)C1	ZINC000450940299	DH	On-Demand	Anodyne	COLA	56	34
COC[C@@H]1CCCCN(C(=O)Cc2cc3ccccc3s2)C1	ZINC000450940299	DH	On-Demand	Anodyne	CPT1A	58	34
CCC(=O)CCCN1CCOc2cc(OC)ccc2C1	ZINC000450940300	CF	On-Demand	Anodyne	KCNQ1	0	41
CCOc1cccc(CN(CCO)c2nc(-c3cccnc3)nc3c2CCC3)c1	ZINC000450940303	GG	On-Demand	Anodyne	P2RY14	25	43
COc1ccc(N2CCN(c3ccnc(C(N)=O)c3)CC2)nc1	ZINC000450940304	DC	On-Demand	Anodyne	NPBWR1	46	37
c1ccc(Oc2ccnc(N(CCN3CCOCC3)Cc3ccco3)n2)cc1	ZINC000450940305	GG	On-Demand	Anodyne	CASR	40	36
CCNC(=O)C[C@@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450940318	GE	On-Demand	Anodyne	MTNR1A	54	39
CCNC(=O)C[C@@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450940318	GE	On-Demand	Anodyne	MTNR1B	48	39
CCNC(=O)C[C@@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450940318	GE	On-Demand	Anodyne	ACKR3	51	32
CCNC(=O)C[C@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450940320	GE	On-Demand	Anodyne	MTNR1A	54	39
CCNC(=O)C[C@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450940320	GE	On-Demand	Anodyne	MTNR1B	48	39
CCNC(=O)C[C@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450940320	GE	On-Demand	Anodyne	ACKR3	51	32
Cc1ccnc2[nH]c(SCC(=O)N(C)CC(F)(F)F)nc12	ZINC000450940329	DE	On-Demand	Anodyne	ENPP1	32	50
C[C@H]1CN(c2ncc(Cl)cc2F)CCN1C(=O)c1cnn(C)c1	ZINC000450940330	ED	On-Demand	Anodyne	SMO	0	48
Cc1ccnc2[nH]c(SCC(=O)N(Cc3ccccc3)CC(F)(F)F)nc12	ZINC000450940346	GH	On-Demand	Anodyne	ENPP1	33	46
CC(=O)c1cccc(CN2CCCCC[C@H]2CCO)c1	ZINC000450940354	CG	On-Demand	Anodyne	CCR3	18	43
CC(=O)c1cccc(CN2CCCCC[C@@H]2CCO)c1	ZINC000450940356	CG	On-Demand	Anodyne	CCR3	18	43
COc1ccc2c(c1)OCCN(Cc1ccc(C(C)=O)cc1)C2	ZINC000450940357	DG	On-Demand	Anodyne	NOD1	29	46
COc1ccc2c(c1)OCCN(Cc1ccc(C(C)=O)cc1)C2	ZINC000450940357	DG	On-Demand	Anodyne	NOD2	46	46
Cc1ccnc2[nH]c(SCC(=O)NCCCOC3CCCCC3)nc12	ZINC000450940359	FG	On-Demand	Anodyne	ENPP1	61	50
CCc1cc(CC)nc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450940373	EF	On-Demand	Anodyne	CASR	43	34
COc1ccc(N2CCN(c3cnn(C)c(=O)c3Cl)CC2)nc1	ZINC000450940374	ED	On-Demand	Anodyne	NPBWR1	85	34
COc1ccc(N2CCN(c3ccc(OC(F)F)cn3)CC2)nc1	ZINC000450940377	EE	On-Demand	Anodyne	GALR2	29	40
C[C@H](c1ccccc1)[C@H](O)CN1CCCCC[C@H]1CCO	ZINC000450940378	CF	On-Demand	Anodyne	SLC18A2	93	43
C[C@H](c1ccccc1)[C@H](O)CN1CCCCC[C@@H]1CCO	ZINC000450940379	CF	On-Demand	Anodyne	SLC18A2	93	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCCCC[C@H]1CCO	ZINC000450940380	CF	On-Demand	Anodyne	SLC18A2	93	43
C[C@H](c1ccccc1)[C@@H](O)CN1CCCCC[C@@H]1CCO	ZINC000450940381	CF	On-Demand	Anodyne	SLC18A2	93	43
CN(CCCNC(=O)CN1CCC(F)(c2ccccn2)CC1)c1ccccc1	ZINC000450940382	GF	On-Demand	Anodyne	ADRA1A	16	40
Clc1ccc2c(N(CCN3CCOCC3)Cc3ccco3)ncnc2c1	ZINC000450940383	FG	On-Demand	Anodyne	HRP1_PLAFA	67	35
Clc1ccc2c(N(CCN3CCOCC3)Cc3ccco3)ncnc2c1	ZINC000450940383	FG	On-Demand	Anodyne	HNMT	48	34
COc1ccc(N2CCN(c3ccc(C#N)cc3C(F)(F)F)CC2)nc1	ZINC000450940398	FG	On-Demand	Mild	AR	16	41
COc1ccc(N2CCN(c3ccc(C#N)cc3C(F)(F)F)CC2)nc1	ZINC000450940398	FG	On-Demand	Mild	SMO	0	41
COCCNC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nc1	ZINC000450940401	GD	On-Demand	Anodyne	DRD4	41	32
COCCNC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nc1	ZINC000450940401	GD	On-Demand	Anodyne	HPGDS	25	41
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1cnns1	ZINC000450940403	DE	On-Demand	Anodyne	GPR142	48	34
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1cnns1	ZINC000450940404	DE	On-Demand	Anodyne	GPR142	48	34
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1cnns1	ZINC000450940405	DE	On-Demand	Anodyne	GPR142	48	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1cnns1	ZINC000450940406	DE	On-Demand	Anodyne	GPR142	48	34
CNS(=O)(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450940409	FC	On-Demand	Anodyne	HTR7	15	41
CNS(=O)(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450940409	FC	On-Demand	Anodyne	GPR119	15	46
COC(=O)[C@H]1CN(c2ncc(Cl)c(C)c2C#N)C[C@@H]1c1ccccc1	ZINC000450940429	FG	On-Demand	Mild	SLC6A1	28	40
COC(=O)[C@H]1CN(c2ncc(Cl)c(C)c2C#N)C[C@H]1c1ccccc1	ZINC000450940430	FG	On-Demand	Mild	SLC6A1	28	40
COC(=O)[C@@H]1CN(c2ncc(Cl)c(C)c2C#N)C[C@H]1c1ccccc1	ZINC000450940431	FG	On-Demand	Mild	SLC6A1	28	40
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450940440	FH	On-Demand	Anodyne	AVPR2	82	39
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450940440	FH	On-Demand	Anodyne	AVPR1A	47	39
COC(=O)[C@H]1CN(c2cc(C(C)C)ncn2)C[C@@H]1c1ccccc1	ZINC000450940472	EF	On-Demand	Anodyne	SLC6A1	70	43
COC(=O)[C@H]1CN(c2cc(C(C)C)ncn2)C[C@@H]1c1ccccc1	ZINC000450940472	EF	On-Demand	Anodyne	SLC6A3	27	40
COC(=O)[C@H]1CN(c2cc(C(C)C)ncn2)C[C@H]1c1ccccc1	ZINC000450940473	EF	On-Demand	Anodyne	SLC6A1	70	43
COC(=O)[C@H]1CN(c2cc(C(C)C)ncn2)C[C@H]1c1ccccc1	ZINC000450940473	EF	On-Demand	Anodyne	SLC6A3	27	40
COC(=O)[C@@H]1CN(c2cc(C(C)C)ncn2)C[C@H]1c1ccccc1	ZINC000450940474	EF	On-Demand	Anodyne	SLC6A1	70	43
COC(=O)[C@@H]1CN(c2cc(C(C)C)ncn2)C[C@H]1c1ccccc1	ZINC000450940474	EF	On-Demand	Anodyne	SLC6A3	27	40
CN(C)c1noc([C@@H]2CCCN(CC/C=C\c3ccccc3)C2)n1	ZINC000450940481	EG	On-Demand	Anodyne	SLC6A1	47	35
CN(C)c1noc([C@H]2CCCN(CC/C=C/c3ccccc3)C2)n1	ZINC000450940482	EG	On-Demand	Anodyne	SLC6A1	47	35
CN(C)c1noc([C@H]2CCCN(CC/C=C\c3ccccc3)C2)n1	ZINC000450940483	EG	On-Demand	Anodyne	SLC6A1	47	35
CN(C)c1noc([C@@H]2CCCN(CC/C=C/c3ccccc3)C2)n1	ZINC000450940484	EG	On-Demand	Anodyne	SLC6A1	47	35
COC(=O)[C@H]1CN(c2c(F)cccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450940485	EG	On-Demand	Bother	SLC6A1	38	40
COC(=O)[C@H]1CN(c2c(F)cccc2[N+](=O)[O-])C[C@@H]1c1ccccc1	ZINC000450940486	EG	On-Demand	Bother	SLC6A1	38	40
COC(=O)[C@@H]1CN(c2c(F)cccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450940487	EG	On-Demand	Bother	SLC6A1	38	40
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940491	EH	On-Demand	Anodyne	DRD2	17	44
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940491	EH	On-Demand	Anodyne	DRD4	20	43
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940491	EH	On-Demand	Anodyne	SLC6A1	42	36
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940491	EH	On-Demand	Anodyne	DRD3	18	44
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940491	EH	On-Demand	Anodyne	CCR3	25	45
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940491	EH	On-Demand	Anodyne	CACNA1I	49	37
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940492	EH	On-Demand	Anodyne	DRD2	17	44
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940492	EH	On-Demand	Anodyne	DRD4	20	43
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940492	EH	On-Demand	Anodyne	SLC6A1	42	36
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940492	EH	On-Demand	Anodyne	DRD3	18	44
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940492	EH	On-Demand	Anodyne	CCR3	25	45
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940492	EH	On-Demand	Anodyne	CACNA1I	49	37
COC(=O)[C@H]1CN(c2nccnc2C#N)C[C@H]1c1ccccc1	ZINC000450940504	DD	On-Demand	Mild	SLC6A1	45	42
COC(=O)[C@H]1CN(c2nccnc2C#N)C[C@@H]1c1ccccc1	ZINC000450940505	DD	On-Demand	Mild	SLC6A1	45	42
COC(=O)[C@H]1CN(c2ncnc3c2ncn3C2CC2)C[C@@H]1c1ccccc1	ZINC000450940511	FF	On-Demand	Anodyne	SLC6A1	87	42
COC(=O)[C@H]1CN(c2ncnc3c2ncn3C2CC2)C[C@@H]1c1ccccc1	ZINC000450940511	FF	On-Demand	Anodyne	OXGR1	43	34
COC(=O)[C@H]1CN(c2ncnc3c2ncn3C2CC2)C[C@H]1c1ccccc1	ZINC000450940512	FF	On-Demand	Anodyne	SLC6A1	87	42
COC(=O)[C@H]1CN(c2ncnc3c2ncn3C2CC2)C[C@H]1c1ccccc1	ZINC000450940512	FF	On-Demand	Anodyne	OXGR1	43	34
COC(=O)[C@H]1CN(c2nccc(OC)n2)C[C@H]1c1ccccc1	ZINC000450940514	DD	On-Demand	Anodyne	SLC6A1	46	42
COC(=O)[C@H]1CN(c2nccc(OC)n2)C[C@@H]1c1ccccc1	ZINC000450940515	DD	On-Demand	Anodyne	SLC6A1	46	42
COC[C@@H]1CCCCN1c1cc(-c2ccccc2)nc2ncnn12	ZINC000450940524	DF	On-Demand	Anodyne	COLA	50	34
COC[C@@H]1CCCCN1c1cc(-c2ccccc2)nc2ncnn12	ZINC000450940524	DF	On-Demand	Anodyne	CPT1A	44	34
CSc1cncc(N[C@H](C)c2cccc(C)c2)n1	ZINC000450940537	CH	On-Demand	Anodyne	PLK1	19	40
CSc1cncc(N[C@@H](C)c2cccc(C)c2)n1	ZINC000450940538	CH	On-Demand	Anodyne	PLK1	19	40
COC[C@@H]1CCCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450940551	DI	On-Demand	Anodyne	HRH4	21	41
COC[C@@H]1CCCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450940551	DI	On-Demand	Anodyne	CCR4	16	40
COC[C@@H]1CCCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450940551	DI	On-Demand	Anodyne	HNMT	45	31
COC[C@H]1CCCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450940552	DI	On-Demand	Anodyne	HRH4	21	41
COC[C@H]1CCCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450940552	DI	On-Demand	Anodyne	CCR4	16	40
COC[C@H]1CCCN(c2ccnc3ccc(Cl)cc23)CC1	ZINC000450940552	DI	On-Demand	Anodyne	HNMT	45	31
CNS(=O)(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450940565	DE	On-Demand	Anodyne	GCKR	35	46
CNS(=O)(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450940566	DE	On-Demand	Anodyne	GCKR	35	46
Cn1ncc2c(N3CC[C@H](CC(C)(C)C)C3)ncnc21	ZINC000450940567	CF	On-Demand	Anodyne	PDE3B	52	32
Cn1ncc2c(N3CC[C@@H](CC(C)(C)C)C3)ncnc21	ZINC000450940568	CF	On-Demand	Anodyne	PDE3B	52	32
Cc1c(C(=O)N(Cc2ccccc2)[C@@H](C)C(C)(C)C)nn2c1OCCC2	ZINC000450940585	FI	On-Demand	Anodyne	HTR4	44	34
Cc1c(C(=O)N(Cc2ccccc2)[C@H](C)C(C)(C)C)nn2c1OCCC2	ZINC000450940586	FI	On-Demand	Anodyne	HTR4	44	34
CCS(=O)(=O)Cc1ccc(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1	ZINC000450940601	GI	On-Demand	Bother	AADAC	0	50
COC[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450940617	CE	On-Demand	Anodyne	P2RY12	34	46
COC[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450940617	CE	On-Demand	Anodyne	CXCR3	33	47
COC[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450940617	CE	On-Demand	Anodyne	SIRT2	52	33
COC[C@H]1CCCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450940617	CE	On-Demand	Anodyne	SIRT1	50	32
COC[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450940618	CE	On-Demand	Anodyne	P2RY12	34	46
COC[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450940618	CE	On-Demand	Anodyne	CXCR3	33	47
COC[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450940618	CE	On-Demand	Anodyne	SIRT2	52	33
COC[C@@H]1CCCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000450940618	CE	On-Demand	Anodyne	SIRT1	50	32
COc1cc2c(N3C[C@H](C)C[C@@H](O)C3)ncnc2cc1F	ZINC000450940627	CD	On-Demand	Anodyne	PDE3A	56	42
COc1cc2c(N3C[C@H](C)C[C@@H](O)C3)ncnc2cc1F	ZINC000450940627	CD	On-Demand	Anodyne	PDGFRB	61	40
COc1cc2c(N3C[C@H](C)C[C@@H](O)C3)ncnc2cc1F	ZINC000450940627	CD	On-Demand	Anodyne	PDE3B	82	42
COc1cc2c(N3C[C@@H](C)C[C@H](O)C3)ncnc2cc1F	ZINC000450940628	CD	On-Demand	Anodyne	PDE3A	56	42
COc1cc2c(N3C[C@@H](C)C[C@H](O)C3)ncnc2cc1F	ZINC000450940628	CD	On-Demand	Anodyne	PDGFRB	61	40
COc1cc2c(N3C[C@@H](C)C[C@H](O)C3)ncnc2cc1F	ZINC000450940628	CD	On-Demand	Anodyne	PDE3B	82	42
COc1cc2c(N3C[C@@H](O)C[C@@H](C)C3)ncnc2cc1F	ZINC000450940629	CD	On-Demand	Anodyne	PDE3A	56	42
COc1cc2c(N3C[C@@H](O)C[C@@H](C)C3)ncnc2cc1F	ZINC000450940629	CD	On-Demand	Anodyne	PDGFRB	61	40
COc1cc2c(N3C[C@@H](O)C[C@@H](C)C3)ncnc2cc1F	ZINC000450940629	CD	On-Demand	Anodyne	PDE3B	82	42
CC[C@@H](Nc1ncnc2ccc(C)cc12)C(=O)NC	ZINC000450940643	CD	On-Demand	Anodyne	EGFR	44	40
CC[C@H](Nc1ncnc2ccc(C)cc12)C(=O)NC	ZINC000450940644	CD	On-Demand	Anodyne	EGFR	44	40
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccsc1	ZINC000450940672	GH	On-Demand	Anodyne	RBP4	70	39
CC[C@H](Nc1ccc([N+](=O)[O-])c(C)c1)C(=O)NC	ZINC000450940697	CD	On-Demand	Bother	COLA	43	34
CC[C@@H](Nc1ccc([N+](=O)[O-])c(C)c1)C(=O)NC	ZINC000450940698	CD	On-Demand	Bother	COLA	43	34
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])C1	ZINC000450940701	GE	On-Demand	Bother	NOD2	19	43
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])C1	ZINC000450940702	GE	On-Demand	Bother	NOD2	19	43
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])C1	ZINC000450940703	GE	On-Demand	Bother	NOD2	19	43
O=C(CN1CCC(F)(c2ccccn2)CC1)N[C@H]1CCCc2ccccc21	ZINC000450940728	FH	On-Demand	Anodyne	BDKRB1	49	35
O=C(CN1CCC(F)(c2ccccn2)CC1)N[C@@H]1CCCc2ccccc21	ZINC000450940729	FH	On-Demand	Anodyne	BDKRB1	49	35
Cc1nc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc(C)c1CC(C)C	ZINC000450940735	FE	On-Demand	Anodyne	SLC6A7	0	41
CN(c1ncnc2sc3c(c12)CCC3)C1CCN(CC(F)(F)F)CC1	ZINC000450940739	FH	On-Demand	Anodyne	RBP4	17	44
CCS(=O)(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)cc1	ZINC000450940742	FE	On-Demand	Anodyne	GPR119	16	46
NC(=O)c1csc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450940780	ED	On-Demand	Anodyne	CASR	41	37
COc1ccc(N2CCN(c3cnc4ccccc4n3)CC2)nc1	ZINC000450940782	DE	On-Demand	Anodyne	SORD	28	42
Cc1ccc2c(C)cc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)nc2c1	ZINC000450940793	FF	On-Demand	Anodyne	HCRTR1	46	38
CCC[C@H](O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000450940803	EH	On-Demand	Anodyne	PHES	0	43
CCC[C@@H](O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000450940804	EH	On-Demand	Anodyne	PHES	0	43
CCC[C@H](O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000450940805	EH	On-Demand	Anodyne	PHES	0	43
CCC[C@@H](O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000450940806	EH	On-Demand	Anodyne	PHES	0	43
CCOc1cccc(CN(CCO)c2ncc(C(=O)OC)cn2)c1	ZINC000450940818	ED	On-Demand	Anodyne	PDS	41	34
COc1ccc(N2CCN(c3ccnc4cc(F)ccc34)CC2)nc1	ZINC000450940820	EG	On-Demand	Anodyne	DRD4	15	42
COC(=O)[C@@H](NC(=O)c1cc(C2CC2)[nH]n1)c1ccc(O)cc1	ZINC000450940822	DD	On-Demand	Anodyne	CDK2	22	45
COC(=O)[C@@H](NC(=O)c1cc(C2CC2)[nH]n1)c1ccc(O)cc1	ZINC000450940822	DD	On-Demand	Anodyne	PKNB	50	33
COC(=O)[C@H](NC(=O)c1cc(C2CC2)[nH]n1)c1ccc(O)cc1	ZINC000450940824	DD	On-Demand	Anodyne	CDK2	22	45
COC(=O)[C@H](NC(=O)c1cc(C2CC2)[nH]n1)c1ccc(O)cc1	ZINC000450940824	DD	On-Demand	Anodyne	PKNB	50	33
C[C@H]1CN(c2nc3ccccc3o2)CCN1C(=O)c1cnn(C)c1	ZINC000450940838	ED	On-Demand	Anodyne	HCRTR1	33	40
CC(=O)CCCCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000450940848	CF	On-Demand	Bother	THRB	0	42
COC(=O)C1(CN[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)CC1	ZINC000450940851	DE	On-Demand	Anodyne	ADRA1D	56	38
COC(=O)C1(CN[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)CC1	ZINC000450940851	DE	On-Demand	Anodyne	ADRA1A	47	37
COC(=O)C1(CN[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)CC1	ZINC000450940852	DE	On-Demand	Anodyne	ADRA1D	56	38
COC(=O)C1(CN[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)CC1	ZINC000450940852	DE	On-Demand	Anodyne	ADRA1A	47	37
COC(=O)C1(CN[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)CC1	ZINC000450940853	DE	On-Demand	Anodyne	ADRA1D	56	38
COC(=O)C1(CN[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)CC1	ZINC000450940853	DE	On-Demand	Anodyne	ADRA1A	47	37
COC(=O)C1(CN[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)CC1	ZINC000450940859	DE	On-Demand	Anodyne	ADRA1D	56	38
COC(=O)C1(CN[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)CC1	ZINC000450940859	DE	On-Demand	Anodyne	ADRA1A	47	37
COc1ccc(CN(C)C(=O)CSc2nc3c(C)ccnc3[nH]2)cc1F	ZINC000450940860	FG	On-Demand	Anodyne	ENPP1	72	57
COc1ccc(N2CCN(c3ccc4ccc(F)cc4n3)CC2)nc1	ZINC000450940861	EG	On-Demand	Anodyne	HTR3A	15	40
COc1ccc(N2CCN(c3ncc(C(=O)N(C)C)cc3Cl)CC2)nc1	ZINC000450940862	GE	On-Demand	Anodyne	DRD4	43	34
COc1ccc(N2CCN(c3ncc(C(=O)N(C)C)cc3Cl)CC2)nc1	ZINC000450940862	GE	On-Demand	Anodyne	P2RY12	33	46
COc1ccc(N2CCN(c3ncc(C(=O)N(C)C)cc3Cl)CC2)nc1	ZINC000450940862	GE	On-Demand	Anodyne	CXCR3	27	45
Cc1ccc2nc(CN3CCC(F)(c4ccccn4)CC3)cn2c1	ZINC000450940863	DG	On-Demand	Anodyne	DRD4	18	41
CCS(=O)(=O)c1ccc(CSCc2ccc3c(c2)OCO3)cc1	ZINC000450940868	FH	On-Demand	Anodyne	BMP1	46	47
COc1ccc(N2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)nc1	ZINC000450940869	GD	On-Demand	Anodyne	AR	0	56
COc1cc(CN2CCC3(CC2)C[C@H]3N(C)Cc2nccs2)ccc1Cl	ZINC000450940873	GI	On-Demand	Anodyne	SSTR5	41	36
COc1cc(CN2CCC3(CC2)C[C@@H]3N(C)Cc2nccs2)ccc1Cl	ZINC000450940874	GI	On-Demand	Anodyne	SSTR5	41	36
Cc1ccnc2[nH]c(SCC(=O)N(C)[C@H](C)c3ccc(F)c(F)c3)nc12	ZINC000450940877	GH	On-Demand	Anodyne	ENPP1	66	49
Cc1ccnc2[nH]c(SCC(=O)N(C)[C@@H](C)c3ccc(F)c(F)c3)nc12	ZINC000450940878	GH	On-Demand	Anodyne	ENPP1	66	49
C[C@H]1CN(c2c(Cl)cccc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450940879	EE	On-Demand	Mild	SLC6A7	0	45
COc1ccc(N2CCN(c3ccc(C(F)(F)F)c(C#N)c3)CC2)nc1	ZINC000450940891	FG	On-Demand	Mild	AR	35	45
COc1ccc(N2CCN(c3ncc(Cl)cc3Br)CC2)nc1	ZINC000450940893	GG	On-Demand	Anodyne	DRD4	16	43
CC(C)(CC(=O)CS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000450940896	EF	On-Demand	Bother	SLC27A4	49	32
COc1cc(N2CCN(Cc3ccn(CC(F)(F)F)n3)CC2)ccc1F	ZINC000450940905	FF	On-Demand	Anodyne	DRD1	22	42
COC[C@H]1CCCCN1c1cc(-c2ccccc2)nc2ncnn12	ZINC000450940906	DF	On-Demand	Anodyne	COLA	50	34
COC[C@H]1CCCCN1c1cc(-c2ccccc2)nc2ncnn12	ZINC000450940906	DF	On-Demand	Anodyne	CPT1A	44	34
C[C@@H](O)CCN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940917	CD	On-Demand	Anodyne	CACNA1I	57	35
C[C@@H](O)CCN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940917	CD	On-Demand	Anodyne	BIRC2	50	38
C[C@@H](O)CCN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940919	CD	On-Demand	Anodyne	CACNA1I	57	35
C[C@@H](O)CCN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940919	CD	On-Demand	Anodyne	BIRC2	50	38
C[C@H]1CN(c2ccnc(-c3ccccc3)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450940920	FE	On-Demand	Anodyne	SORD	60	40
C[C@H]1CN(c2ccnc(-c3ccccc3)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450940920	FE	On-Demand	Anodyne	SMO	27	47
C[C@H]1CN(c2ccnc(-c3ccccc3)n2)CCN1C(=O)c1cnn(C)c1	ZINC000450940920	FE	On-Demand	Anodyne	SLC6A7	0	48
C[C@H](O)CCN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940921	CD	On-Demand	Anodyne	CACNA1I	57	35
C[C@H](O)CCN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450940921	CD	On-Demand	Anodyne	BIRC2	50	38
C[C@H](O)CCN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940922	CD	On-Demand	Anodyne	CACNA1I	57	35
C[C@H](O)CCN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450940922	CD	On-Demand	Anodyne	BIRC2	50	38
CCO[C@@H]1CCC[C@H]1Nc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450940924	EG	On-Demand	Anodyne	NPBWR1	33	40
C[C@@H](C(=O)NCCc1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450940926	FG	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@H](C(=O)NCCc1ccccc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450940928	FG	On-Demand	Anodyne	AMP1_PLAFQ	26	40
COc1ccc(N2CCN(c3noc(C(C)(C)C)n3)CC2)nc1	ZINC000450940931	DE	On-Demand	Anodyne	ACACB	16	41
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)(F)F)n3n2)C[C@@H]1c1ccccc1	ZINC000450940960	GF	On-Demand	Anodyne	SLC6A1	40	42
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)(F)F)n3n2)C[C@@H]1c1ccccc1	ZINC000450940960	GF	On-Demand	Anodyne	SLC6A3	19	45
COC(=O)[C@@H]1CN(c2ccc3nnc(C(F)(F)F)n3n2)C[C@H]1c1ccccc1	ZINC000450940961	GF	On-Demand	Anodyne	SLC6A1	40	42
COC(=O)[C@@H]1CN(c2ccc3nnc(C(F)(F)F)n3n2)C[C@H]1c1ccccc1	ZINC000450940961	GF	On-Demand	Anodyne	SLC6A3	19	45
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)(F)F)n3n2)C[C@H]1c1ccccc1	ZINC000450940962	GF	On-Demand	Anodyne	SLC6A1	40	42
COC(=O)[C@H]1CN(c2ccc3nnc(C(F)(F)F)n3n2)C[C@H]1c1ccccc1	ZINC000450940962	GF	On-Demand	Anodyne	SLC6A3	19	45
CCO[C@@H]1CCC[C@H]1Nc1ncnc2cc(F)c(OC)cc12	ZINC000450940969	DG	On-Demand	Anodyne	EGFR	31	45
CCO[C@@H]1CCC[C@H]1Nc1ncnc2cc(F)c(OC)cc12	ZINC000450940969	DG	On-Demand	Anodyne	FLT1	24	41
CCO[C@@H]1CCC[C@H]1Nc1ncnc2cc(F)c(OC)cc12	ZINC000450940969	DG	On-Demand	Anodyne	EPHA2	45	35
COC(=O)c1cc(C)nc(N(C)[C@@H]2C[C@@H](c3cccc(OC)c3)C2)c1[N+](=O)[O-]	ZINC000450940970	GG	On-Demand	Bother	CACNA1D	49	35
C[C@H](c1csnn1)N1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450940974	EG	On-Demand	Anodyne	SCD1	30	41
C[C@H](c1csnn1)N1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450940974	EG	On-Demand	Anodyne	SCD	25	42
C[C@@H](c1csnn1)N1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450940975	EG	On-Demand	Anodyne	SCD1	30	41
C[C@@H](c1csnn1)N1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450940975	EG	On-Demand	Anodyne	SCD	25	42
CC(C)(SCc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450940980	DI	On-Demand	Anodyne	KIF11	0	51
COC(=O)[C@H]1CN(c2nccn(C)c2=O)C[C@H]1c1ccccc1	ZINC000450940995	DD	On-Demand	Anodyne	SLC6A1	79	44
COC(=O)[C@H]1CN(c2nccn(C)c2=O)C[C@@H]1c1ccccc1	ZINC000450940996	DD	On-Demand	Anodyne	SLC6A1	79	44
CN(C)c1noc([C@H]2CCCN(CCc3ccc(Cl)cc3)C2)n1	ZINC000450941002	EG	On-Demand	Anodyne	SIGMAR1	15	43
CN(C)c1noc([C@@H]2CCCN(CCc3ccc(Cl)cc3)C2)n1	ZINC000450941003	EG	On-Demand	Anodyne	SIGMAR1	15	43
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450941005	GF	On-Demand	Anodyne	DRD4	18	42
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450941005	GF	On-Demand	Anodyne	HTR4	40	39
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450941005	GF	On-Demand	Anodyne	CCR3	31	41
CCS(=O)(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450941006	GF	On-Demand	Anodyne	DRD4	18	42
CCS(=O)(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450941006	GF	On-Demand	Anodyne	HTR4	40	39
CCS(=O)(=O)c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1	ZINC000450941006	GF	On-Demand	Anodyne	CCR3	31	41
COC(=O)[C@H]1CN(c2nccc(C(F)(F)F)n2)C[C@@H]1c1ccccc1	ZINC000450941013	FF	On-Demand	Anodyne	SLC6A1	51	43
COC(=O)[C@H]1CN(c2nccc(C(F)(F)F)n2)C[C@H]1c1ccccc1	ZINC000450941014	FF	On-Demand	Anodyne	SLC6A1	51	43
CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC(F)(F)C1	ZINC000450941016	CH	On-Demand	Bother	CACNA1D	41	33
CN(CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCC(F)(F)C1	ZINC000450941017	CH	On-Demand	Bother	CACNA1D	41	33
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450941025	FC	On-Demand	Anodyne	GCK	57	33
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450941025	FC	On-Demand	Anodyne	GCKR	68	37
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450941026	FC	On-Demand	Anodyne	GCK	57	33
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450941026	FC	On-Demand	Anodyne	GCKR	68	37
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450941027	FC	On-Demand	Anodyne	GCK	57	33
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1	ZINC000450941027	FC	On-Demand	Anodyne	GCKR	68	37
O=C([C@@H](O)C1CCC1)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450941042	EH	On-Demand	Anodyne	CACNA1B	46	35
O=C([C@@H](O)C1CCC1)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450941042	EH	On-Demand	Anodyne	ADAM17	42	38
O=C([C@@H](O)C1CCC1)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450941043	EH	On-Demand	Anodyne	CACNA1B	46	35
O=C([C@@H](O)C1CCC1)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450941043	EH	On-Demand	Anodyne	ADAM17	42	38
O=C([C@H](O)C1CCC1)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450941044	EH	On-Demand	Anodyne	CACNA1B	46	35
O=C([C@H](O)C1CCC1)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450941044	EH	On-Demand	Anodyne	ADAM17	42	38
O=C([C@H](O)C1CCC1)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450941045	EH	On-Demand	Anodyne	CACNA1B	46	35
O=C([C@H](O)C1CCC1)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450941045	EH	On-Demand	Anodyne	ADAM17	42	38
C[C@H]1C[C@@H](O)CN(c2ncnc3ccc(I)cc23)C1	ZINC000450941068	FE	On-Demand	Anodyne	PDE3A	42	32
C[C@H]1C[C@@H](O)CN(c2ncnc3ccc(I)cc23)C1	ZINC000450941068	FE	On-Demand	Anodyne	PDE3B	41	32
C[C@@H]1C[C@@H](O)CN(c2ncnc3ccc(I)cc23)C1	ZINC000450941069	FE	On-Demand	Anodyne	PDE3A	42	32
C[C@@H]1C[C@@H](O)CN(c2ncnc3ccc(I)cc23)C1	ZINC000450941069	FE	On-Demand	Anodyne	PDE3B	41	32
C[C@H]1C[C@H](O)CN(c2ncnc3ccc(I)cc23)C1	ZINC000450941070	FE	On-Demand	Anodyne	PDE3A	42	32
C[C@H]1C[C@H](O)CN(c2ncnc3ccc(I)cc23)C1	ZINC000450941070	FE	On-Demand	Anodyne	PDE3B	41	32
CC[C@@H](Nc1cncc(-n2nc(C)cc2C)n1)C(=O)NC	ZINC000450941102	CD	On-Demand	Anodyne	ADORA2A	26	41
CC[C@H](Nc1cncc(-n2nc(C)cc2C)n1)C(=O)NC	ZINC000450941103	CD	On-Demand	Anodyne	ADORA2A	26	41
COc1ccc(CCNC(=O)Cn2cnc3snc(C)c3c2=O)cc1OC	ZINC000450941108	GD	On-Demand	Anodyne	ENPP1	49	30
COC(=O)[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1cc(C)cc(C)c1	ZINC000450941121	FF	On-Demand	Anodyne	MMP13	0	42
COC(=O)[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1cc(C)cc(C)c1	ZINC000450941122	FF	On-Demand	Anodyne	MMP13	0	42
Cc1cccc([C@H](C)Nc2cc(N3CCCC[C@@H]3CO)ncn2)c1	ZINC000450941132	EG	On-Demand	Anodyne	PRCP	0	48
Cc1cccc([C@@H](C)Nc2cc(N3CCCC[C@@H]3CO)ncn2)c1	ZINC000450941133	EG	On-Demand	Anodyne	PRCP	0	48
Cc1cccc([C@H](C)Nc2cc(N3CCCC[C@H]3CO)ncn2)c1	ZINC000450941134	EG	On-Demand	Anodyne	PRCP	0	48
Cc1cccc([C@@H](C)Nc2cc(N3CCCC[C@H]3CO)ncn2)c1	ZINC000450941135	EG	On-Demand	Anodyne	PRCP	0	48
CNC(=O)CSCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450941146	ED	On-Demand	Anodyne	MTNR1A	64	38
CNC(=O)CSCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450941146	ED	On-Demand	Anodyne	MTNR1B	47	38
CC(C)(C)C[C@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450941148	CF	On-Demand	Anodyne	GPR119	33	51
CC(C)(C)C[C@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450941148	CF	On-Demand	Anodyne	GCKR	40	38
CC(C)(C)C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450941149	CF	On-Demand	Anodyne	GPR119	33	51
CC(C)(C)C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cn2)C1	ZINC000450941149	CF	On-Demand	Anodyne	GCKR	40	38
COC[C@@H]1CCCN(c2nc(-c3ccc(OC)cc3)no2)CC1	ZINC000450941152	DF	On-Demand	Anodyne	COLA	0	43
COC[C@H]1CCCN(c2nc(-c3ccc(OC)cc3)no2)CC1	ZINC000450941153	DF	On-Demand	Anodyne	COLA	0	43
CCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nn1	ZINC000450941159	CE	On-Demand	Anodyne	SIRT2	46	36
CCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nn1	ZINC000450941159	CE	On-Demand	Anodyne	SCD1	53	46
CCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nn1	ZINC000450941160	CE	On-Demand	Anodyne	SIRT2	46	36
CCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nn1	ZINC000450941160	CE	On-Demand	Anodyne	SCD1	53	46
COC[C@H]1CCCN(c2nc(C)nc3ccc(OC)cc23)CC1	ZINC000450941166	DG	On-Demand	Anodyne	PDE3A	41	38
COC[C@H]1CCCN(c2nc(C)nc3ccc(OC)cc23)CC1	ZINC000450941166	DG	On-Demand	Anodyne	PDE3B	60	38
COC[C@@H]1CCCN(c2nc(C)nc3ccc(OC)cc23)CC1	ZINC000450941167	DG	On-Demand	Anodyne	PDE3A	41	38
COC[C@@H]1CCCN(c2nc(C)nc3ccc(OC)cc23)CC1	ZINC000450941167	DG	On-Demand	Anodyne	PDE3B	60	38
CCS(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)cc1	ZINC000450941168	DF	On-Demand	Anodyne	CASP7	47	38
CCS(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)cc1	ZINC000450941169	DF	On-Demand	Anodyne	CASP7	47	38
CCOC(=O)c1ccnc(N2CCC[C@@H](COC)CC2)c1[N+](=O)[O-]	ZINC000450941185	EE	On-Demand	Bother	P2RY12	40	34
CCOC(=O)c1ccnc(N2CCC[C@H](COC)CC2)c1[N+](=O)[O-]	ZINC000450941186	EE	On-Demand	Bother	P2RY12	40	34
COc1ccnc(N[C@H](C)c2cccc(C)c2)n1	ZINC000450941191	BF	On-Demand	Anodyne	HTR7	18	40
COc1ccnc(N[C@@H](C)c2cccc(C)c2)n1	ZINC000450941192	BF	On-Demand	Anodyne	HTR7	18	40
CO[C@H](CSCCC(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450941203	DH	On-Demand	Anodyne	PAPA1_CARPA	46	43
CO[C@H](CSCCC(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450941203	DH	On-Demand	Anodyne	CYSP_TRYCR	42	38
CO[C@H](CSCCC(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450941203	DH	On-Demand	Anodyne	FPR1	45	40
CO[C@@H](CSCCC(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450941204	DH	On-Demand	Anodyne	PAPA1_CARPA	46	43
CO[C@@H](CSCCC(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450941204	DH	On-Demand	Anodyne	CYSP_TRYCR	42	38
CO[C@@H](CSCCC(=O)OC(C)(C)C)Cc1ccccc1	ZINC000450941204	DH	On-Demand	Anodyne	FPR1	45	40
COC[C@@H]1CCCN(c2ccc(C#N)c(Cl)c2)CC1	ZINC000450941211	CG	On-Demand	Mild	PGR	22	43
COC[C@H]1CCCN(c2ccc(C#N)c(Cl)c2)CC1	ZINC000450941212	CG	On-Demand	Mild	PGR	22	43
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	DRD4	21	41
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	ACHE	18	43
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	TRPV1	19	41
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	SIGMAR1	47	39
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	NPFFR2	40	38
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	PRNP	74	42
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	GRM4	44	39
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	HDAC1	25	41
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	FAAH	15	45
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	MCHR1	26	43
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	MCHR2	41	32
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	MGEA5	15	41
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	NPFFR1	61	39
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	NOD1	35	46
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	NOD2	53	44
O=C(Nc1ccccc1)c1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1	ZINC000450941231	GJ	On-Demand	Anodyne	KCNK3	47	36
CCCNC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nc1	ZINC000450941235	FE	On-Demand	Anodyne	HPGDS	32	41
COC(=O)[C@H]1CN(c2nc(C)ns2)C[C@@H]1c1ccccc1	ZINC000450941245	DE	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)[C@H]1CN(c2nc(C)ns2)C[C@H]1c1ccccc1	ZINC000450941246	DE	On-Demand	Anodyne	SLC6A3	23	40
CNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nn1	ZINC000450941247	EC	On-Demand	Anodyne	SCD1	49	42
CCOc1cc(N2CCN(c3ccc(OC)cn3)CC2)ncn1	ZINC000450941250	DD	On-Demand	Anodyne	DCK	25	41
O=C(CCCN1C[C@H]2COC[C@@H](C1)O2)c1ccc(Br)cc1	ZINC000450941263	FF	On-Demand	Anodyne	CYP2J2	54	38
Fc1ccc2c(c1)CCN2C1CCN(CC2CC(F)(F)C2)CC1	ZINC000450941267	DH	On-Demand	Anodyne	SCD	30	45
COc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cn3)CC2)nc1	ZINC000450941268	ED	On-Demand	Anodyne	GPR119	22	47
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450941270	GE	On-Demand	Bother	TAAR1	18	40
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450941273	GE	On-Demand	Bother	TAAR1	18	40
CN(C)c1nccc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450941288	ED	On-Demand	Anodyne	EPHB4	43	34
CCO[C@@H]1CCC[C@H]1Nc1nn2c(C)nnc2c2ccccc12	ZINC000450941289	DE	On-Demand	Anodyne	CREBBP	42	32
CCO[C@@H]1CCC[C@H]1Nc1nn2c(C)nnc2c2ccccc12	ZINC000450941289	DE	On-Demand	Anodyne	BRD9	53	35
Cc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2cc(Cl)cc(C)c2n1	ZINC000450941325	GH	On-Demand	Anodyne	SMO	0	41
CNS(=O)(=O)c1cccc2c1CCN(CCN(C)Cc1ccccc1)C2	ZINC000450941331	FE	On-Demand	Anodyne	SIGMAR1	17	48
C[C@H]1CN(c2cc(Cl)ccc2C#N)CCN1C(=O)c1cnn(C)c1	ZINC000450941332	EE	On-Demand	Mild	SLC6A7	0	48
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])c(C)n2)C[C@@H]1c1ccccc1	ZINC000450941336	EF	On-Demand	Bother	SLC6A1	26	40
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])c(C)n2)C[C@H]1c1ccccc1	ZINC000450941339	EF	On-Demand	Bother	SLC6A1	26	40
CCc1nnc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c(C#N)c1CC	ZINC000450941353	FD	On-Demand	Mild	SMO	0	42
CNS(=O)(=O)c1cccc2c1CCN(Cc1ccc(Cl)c(OC)c1)C2	ZINC000450941360	GF	On-Demand	Anodyne	DRD4	26	46
CNS(=O)(=O)c1cccc2c1CCN(Cc1ccc(Cl)c(OC)c1)C2	ZINC000450941360	GF	On-Demand	Anodyne	DRD3	0	45
CNS(=O)(=O)c1cccc2c1CCN(Cc1ccc(Cl)c(OC)c1)C2	ZINC000450941360	GF	On-Demand	Anodyne	SSTR5	45	37
CNS(=O)(=O)c1cccc2c1CCN(Cc1ccc(Cl)c(OC)c1)C2	ZINC000450941360	GF	On-Demand	Anodyne	ABCB1	20	41
CNS(=O)(=O)c1cccc2c1CCN(Cc1ccc(Cl)c(OC)c1)C2	ZINC000450941360	GF	On-Demand	Anodyne	NOD1	29	41
CNS(=O)(=O)c1cccc2c1CCN(Cc1ccc(Cl)c(OC)c1)C2	ZINC000450941360	GF	On-Demand	Anodyne	NOD2	44	41
N#CC1(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)CCC1	ZINC000450941365	CI	On-Demand	Mild	SLC18A3	27	47
CCOC(=O)c1cccnc1N1CCN(c2ccc(OC)cn2)CC1	ZINC000450941396	ED	On-Demand	Anodyne	P2RY12	49	42
COC(=O)c1cncc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450941398	ED	On-Demand	Anodyne	CASR	48	37
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Br	ZINC000450941402	GI	On-Demand	Anodyne	DRD4	16	41
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Br	ZINC000450941402	GI	On-Demand	Anodyne	DRD3	15	41
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Br	ZINC000450941402	GI	On-Demand	Anodyne	SSTR5	49	37
COc1ccc(CN2CCC(F)(c3ccccn3)CC2)cc1Br	ZINC000450941402	GI	On-Demand	Anodyne	MCHR2	52	32
COc1ccc(N2CCN(c3nc4ccccc4[nH]3)CC2)nc1	ZINC000450941404	DE	On-Demand	Anodyne	NPBWR1	34	45
COc1ccc(N2CCN(c3nc4ccccc4[nH]3)CC2)nc1	ZINC000450941404	DE	On-Demand	Anodyne	ALKBH3	39	46
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)c1csnn1	ZINC000450941408	DF	On-Demand	Anodyne	MME	54	38
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)c1csnn1	ZINC000450941408	DF	On-Demand	Anodyne	ANPEP	64	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)c1csnn1	ZINC000450941408	DF	On-Demand	Anodyne	CPA1	44	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@@H](C)c1csnn1	ZINC000450941408	DF	On-Demand	Anodyne	ACE2	47	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)c1csnn1	ZINC000450941410	DF	On-Demand	Anodyne	MME	54	38
COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)c1csnn1	ZINC000450941410	DF	On-Demand	Anodyne	ANPEP	64	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)c1csnn1	ZINC000450941410	DF	On-Demand	Anodyne	CPA1	44	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@H](C)c1csnn1	ZINC000450941410	DF	On-Demand	Anodyne	ACE2	47	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)c1csnn1	ZINC000450941411	DF	On-Demand	Anodyne	MME	54	38
COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)c1csnn1	ZINC000450941411	DF	On-Demand	Anodyne	ANPEP	64	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)c1csnn1	ZINC000450941411	DF	On-Demand	Anodyne	CPA1	44	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)N[C@@H](C)c1csnn1	ZINC000450941411	DF	On-Demand	Anodyne	ACE2	47	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)c1csnn1	ZINC000450941413	DF	On-Demand	Anodyne	MME	54	38
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)c1csnn1	ZINC000450941413	DF	On-Demand	Anodyne	ANPEP	64	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)c1csnn1	ZINC000450941413	DF	On-Demand	Anodyne	CPA1	44	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)N[C@H](C)c1csnn1	ZINC000450941413	DF	On-Demand	Anodyne	ACE2	47	36
COc1ccc(N2CCN(c3ncnc4n[nH]cc34)CC2)nc1	ZINC000450941418	DD	On-Demand	Anodyne	PDGFRB	35	48
COc1ccc(N2CCN(c3ncnc4n[nH]cc34)CC2)nc1	ZINC000450941418	DD	On-Demand	Anodyne	PDE3B	46	33
COC[C@H]1CCCCN1c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000450941421	CG	On-Demand	Bother	CASP3	55	38
COC[C@@H]1CCCCN1c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000450941426	CG	On-Demand	Bother	CASP3	55	38
COC(=O)[C@@]12CCCC[C@@H]1CN(C[C@H](O)Cc1ccccc1)C2	ZINC000450941429	DE	On-Demand	Anodyne	TIMP3	41	33
COc1ccc(CN2CCCN(C(=O)c3ccc(C)nc3C(C)C)CC2=O)cc1	ZINC000450941446	GG	On-Demand	Anodyne	DPP7	15	42
COc1ccc(CN2CCCN(C(=O)c3ccc(C)nc3C(C)C)CC2=O)cc1	ZINC000450941446	GG	On-Demand	Anodyne	PROKR1	57	31
COC[C@@H]1CCCCN(C(=O)c2ccc(Br)cc2C#N)C1	ZINC000450941450	FG	On-Demand	Mild	NR3C2	50	34
COC[C@H]1CCCCN(C(=O)c2ccc(Br)cc2C#N)C1	ZINC000450941451	FG	On-Demand	Mild	NR3C2	50	34
CN(CCN1CCC[C@@](CO)(c2ccccc2)C1)Cc1ccccc1	ZINC000450941458	EG	On-Demand	Anodyne	SIGMAR1	28	47
CN(CCN1CCC[C@@](CO)(c2ccccc2)C1)Cc1ccccc1	ZINC000450941458	EG	On-Demand	Anodyne	SLC12A5	54	33
CN(CCN1CCC[C@](CO)(c2ccccc2)C1)Cc1ccccc1	ZINC000450941460	EG	On-Demand	Anodyne	SIGMAR1	28	47
CN(CCN1CCC[C@](CO)(c2ccccc2)C1)Cc1ccccc1	ZINC000450941460	EG	On-Demand	Anodyne	SLC12A5	54	33
CNC(=O)N[C@@H]1CCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450941474	GF	On-Demand	Anodyne	EPHX2	32	47
C[C@H]1C[C@@H](O)CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450941478	CE	On-Demand	Anodyne	PDE3A	44	33
C[C@H]1C[C@H](O)CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450941480	CE	On-Demand	Anodyne	PDE3A	44	33
C[C@@H]1C[C@@H](O)CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450941481	CE	On-Demand	Anodyne	PDE3A	44	33
CNC(=O)N[C@H]1CCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000450941482	GF	On-Demand	Anodyne	EPHX2	32	47
CC(C)NC(=O)c1ccc(N2C[C@@H](C)C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450941483	DD	On-Demand	Bother	TAAR1	22	46
CC(C)NC(=O)c1ccc(N2C[C@H](C)C[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000450941486	DD	On-Demand	Bother	TAAR1	22	46
CC(C)NC(=O)c1ccc(N2C[C@@H](O)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450941488	DD	On-Demand	Bother	TAAR1	22	46
CC1(C)CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450941492	FG	On-Demand	Anodyne	SIGMAR1	49	44
CC1(C)CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450941492	FG	On-Demand	Anodyne	LOC100281352	0	45
CC1(C)CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)Cc1ccccc1	ZINC000450941492	FG	On-Demand	Anodyne	ZM.86993	0	45
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450941493	FG	On-Demand	Anodyne	SIGMAR1	49	44
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450941493	FG	On-Demand	Anodyne	LOC100281352	0	45
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)Cc1ccccc1	ZINC000450941493	FG	On-Demand	Anodyne	ZM.86993	0	45
CCO[C@@H]1CCC[C@H]1Nc1ccc(S(=O)(=O)NCC2CC2)cn1	ZINC000450941511	EE	On-Demand	Anodyne	NPY2R	40	34
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1Cc1cccc(C(C)=O)c1	ZINC000450941512	EE	On-Demand	Anodyne	KCNH2	33	42
COC(=O)[C@@H]1CN(c2ncnc3cccc(C)c23)C[C@H]1c1ccccc1	ZINC000450941514	EG	On-Demand	Anodyne	SLC6A1	25	42
COC(=O)[C@H]1CN(c2ncnc3cccc(C)c23)C[C@H]1c1ccccc1	ZINC000450941515	EG	On-Demand	Anodyne	SLC6A1	25	42
CC(C)c1nnc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)s1	ZINC000450941517	EJ	On-Demand	Anodyne	SLC18A3	25	47
COC(=O)[C@H]1CN(c2ncnc3cccc(C)c23)C[C@@H]1c1ccccc1	ZINC000450941518	EG	On-Demand	Anodyne	SLC6A1	25	42
C[C@@H](O)CCN1CC[C@](F)(c2cccc(Cl)c2)C1	ZINC000450941523	CF	On-Demand	Anodyne	OPRK1	16	42
C[C@H](O)CCN1CC[C@@](F)(c2cccc(Cl)c2)C1	ZINC000450941525	CF	On-Demand	Anodyne	OPRK1	16	42
C[C@@H](O)CCN1CC[C@@](F)(c2cccc(Cl)c2)C1	ZINC000450941528	CF	On-Demand	Anodyne	OPRK1	16	42
C[C@@H]1C[C@@H](O)CN(c2ncccc2OCc2ccccc2)C1	ZINC000450941533	CF	On-Demand	Anodyne	PPIA	45	36
C[C@H]1C[C@@H](O)CN(c2ncccc2OCc2ccccc2)C1	ZINC000450941534	CF	On-Demand	Anodyne	PPIA	45	36
C[C@H]1C[C@H](O)CN(c2ncccc2OCc2ccccc2)C1	ZINC000450941536	CF	On-Demand	Anodyne	PPIA	45	36
COc1ccccc1[C@@H](C)N(C)C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450941551	FH	On-Demand	Anodyne	ENPP1	69	56
COc1ccccc1[C@H](C)N(C)C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450941552	FH	On-Demand	Anodyne	ENPP1	69	56
COc1ccc(-c2csc3ncnc(N4C[C@@H](C)C[C@H](O)C4)c23)cc1	ZINC000450941559	FH	On-Demand	Anodyne	ADRB3	0	42
COc1ccc(-c2csc3ncnc(N4C[C@@H](O)C[C@@H](C)C4)c23)cc1	ZINC000450941562	FH	On-Demand	Anodyne	ADRB3	0	42
COC[C@@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450941563	CG	On-Demand	Anodyne	COLA	83	37
COC[C@@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450941563	CG	On-Demand	Anodyne	CPT1A	49	34
COc1ccc(-c2csc3ncnc(N4C[C@H](C)C[C@@H](O)C4)c23)cc1	ZINC000450941564	FH	On-Demand	Anodyne	ADRB3	0	42
COC[C@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450941565	CG	On-Demand	Anodyne	COLA	83	37
COC[C@H]1CCCCN1c1nccc(Oc2ccccc2)n1	ZINC000450941565	CG	On-Demand	Anodyne	CPT1A	49	34
CCC(C)(C)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450941571	CF	On-Demand	Anodyne	ENPP1	59	38
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])C1	ZINC000450941592	GC	On-Demand	Bother	NOD2	19	43
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])C1	ZINC000450941593	GC	On-Demand	Bother	NOD2	19	43
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])C1	ZINC000450941594	GC	On-Demand	Bother	NOD2	19	43
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NC	ZINC000450941602	CD	On-Demand	Anodyne	ADORA1	46	44
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NC	ZINC000450941602	CD	On-Demand	Anodyne	ADCY5	28	41
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NC	ZINC000450941602	CD	On-Demand	Anodyne	ADORA3	53	35
CC[C@@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NC	ZINC000450941602	CD	On-Demand	Anodyne	OXGR1	85	35
CC[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NC	ZINC000450941603	CD	On-Demand	Anodyne	ADORA1	46	44
CC[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NC	ZINC000450941603	CD	On-Demand	Anodyne	ADCY5	28	41
CC[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NC	ZINC000450941603	CD	On-Demand	Anodyne	ADORA3	53	35
CC[C@H](Nc1ncnc2c1ncn2C1CC1)C(=O)NC	ZINC000450941603	CD	On-Demand	Anodyne	OXGR1	85	35
CCCCOc1ccc(C(=O)Cn2cnc3snc(C)c3c2=O)cc1	ZINC000450941610	FG	On-Demand	Anodyne	PLA2G4B	56	35
CCNC(=O)c1ccc(N2C[C@@H](C)C[C@H](O)C2)nc1	ZINC000450941622	CD	On-Demand	Anodyne	HDAC1	18	44
CCNC(=O)c1ccc(N2C[C@@H](O)C[C@@H](C)C2)nc1	ZINC000450941623	CD	On-Demand	Anodyne	HDAC1	18	44
CCNC(=O)c1ccc(N2C[C@H](C)C[C@@H](O)C2)nc1	ZINC000450941624	CD	On-Demand	Anodyne	HDAC1	18	44
CN(C)c1nccc(N2CC[C@H](CC(C)(C)C)C2)n1	ZINC000450941640	CF	On-Demand	Anodyne	HRH4	0	43
CN(C)c1nccc(N2CC[C@@H](CC(C)(C)C)C2)n1	ZINC000450941642	CF	On-Demand	Anodyne	HRH4	0	43
CCS(=O)(=O)Cc1ccc(Nc2nccc(C(F)(F)F)n2)cc1	ZINC000450941659	EG	On-Demand	Anodyne	IKBKB	25	41
CCS(=O)(=O)Cc1ccc(Nc2nccc(C(F)(F)F)n2)cc1	ZINC000450941659	EG	On-Demand	Anodyne	SYK	0	40
CCS(=O)(=O)Cc1ccc(Nc2nccc(C(F)(F)F)n2)cc1	ZINC000450941659	EG	On-Demand	Anodyne	CDK2	46	38
CCS(=O)(=O)Cc1ccc(Nc2nccc(C(F)(F)F)n2)cc1	ZINC000450941659	EG	On-Demand	Anodyne	DKK1	0	41
COC(=O)[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1cc(C)cc(C)c1	ZINC000450941672	GF	On-Demand	Anodyne	FOLH1	42	35
COC(=O)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1cc(C)cc(C)c1	ZINC000450941673	GF	On-Demand	Anodyne	FOLH1	42	35
CCCc1cc(N[C@H](C)c2cccc(C)c2)n2ncnc2n1	ZINC000450941679	CH	On-Demand	Anodyne	DHOD	0	44
CCCc1cc(N[C@@H](C)c2cccc(C)c2)n2ncnc2n1	ZINC000450941680	CH	On-Demand	Anodyne	DHOD	0	44
COC[C@H]1CCCN(c2c(C#N)cnc3ccccc23)CC1	ZINC000450941702	CG	On-Demand	Mild	DPP4	22	40
COC[C@@H]1CCCN(c2c(C#N)cnc3ccccc23)CC1	ZINC000450941708	CG	On-Demand	Mild	DPP4	22	40
Cc1cccc([C@H](C)Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])c1	ZINC000450941721	FH	On-Demand	Bother	BCL2L1	81	38
Cc1cccc([C@H](C)Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])c1	ZINC000450941721	FH	On-Demand	Bother	BCL2	44	33
Cc1cccc([C@@H](C)Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])c1	ZINC000450941722	FH	On-Demand	Bother	BCL2L1	81	38
Cc1cccc([C@@H](C)Nc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])c1	ZINC000450941722	FH	On-Demand	Bother	BCL2	44	33
CC(C)(C)C[C@H]1CCN(c2ncnc(-n3cccn3)c2N)C1	ZINC000450941724	DF	On-Demand	Anodyne	SIRT3	49	32
CC(C)(C)C[C@H]1CCN(c2ncnc(-n3cccn3)c2N)C1	ZINC000450941724	DF	On-Demand	Anodyne	SIRT2	51	32
CC(C)(C)C[C@H]1CCN(c2ncnc(-n3cccn3)c2N)C1	ZINC000450941724	DF	On-Demand	Anodyne	SIRT1	49	32
CC(C)(C)C[C@@H]1CCN(c2ncnc(-n3cccn3)c2N)C1	ZINC000450941727	DF	On-Demand	Anodyne	SIRT3	49	32
CC(C)(C)C[C@@H]1CCN(c2ncnc(-n3cccn3)c2N)C1	ZINC000450941727	DF	On-Demand	Anodyne	SIRT2	51	32
CC(C)(C)C[C@@H]1CCN(c2ncnc(-n3cccn3)c2N)C1	ZINC000450941727	DF	On-Demand	Anodyne	SIRT1	49	32
CC[C@H](Nc1ncnc2cc(Br)ccc12)C(=O)NC	ZINC000450941751	DE	On-Demand	Anodyne	EGFR	57	42
CC[C@H](Nc1ncnc2cc(Br)ccc12)C(=O)NC	ZINC000450941751	DE	On-Demand	Anodyne	ERBB4	32	41
CC[C@H](Nc1ncnc2cc(Br)ccc12)C(=O)NC	ZINC000450941751	DE	On-Demand	Anodyne	HTT	0	42
CC[C@@H](Nc1ncnc2cc(Br)ccc12)C(=O)NC	ZINC000450941753	DE	On-Demand	Anodyne	EGFR	57	42
CC[C@@H](Nc1ncnc2cc(Br)ccc12)C(=O)NC	ZINC000450941753	DE	On-Demand	Anodyne	ERBB4	32	41
CC[C@@H](Nc1ncnc2cc(Br)ccc12)C(=O)NC	ZINC000450941753	DE	On-Demand	Anodyne	HTT	0	42
C[C@@H](O)CCN1CCN(C)[C@H](Cc2ccccc2)C1	ZINC000450941783	CD	On-Demand	Anodyne	CCR5	30	41
C[C@H](O)CCN1CCN(C)[C@H](Cc2ccccc2)C1	ZINC000450941785	CD	On-Demand	Anodyne	CCR5	30	41
C[C@H](O)CCN1CCN(C)[C@@H](Cc2ccccc2)C1	ZINC000450941787	CD	On-Demand	Anodyne	CCR5	30	41
C[C@@H](O)CCN1CCN(C)[C@@H](Cc2ccccc2)C1	ZINC000450941789	CD	On-Demand	Anodyne	CCR5	30	41
COc1ccc(N2CCN(c3nc4ccccc4cc3CO)CC2)nc1	ZINC000450941799	FE	On-Demand	Anodyne	HTR3A	18	40
COc1ccc(N2CCN(c3nc4ccccc4cc3CO)CC2)nc1	ZINC000450941799	FE	On-Demand	Anodyne	SORD	38	43
COc1ccc(N2CCN(c3nc4ccccc4cc3CO)CC2)nc1	ZINC000450941799	FE	On-Demand	Anodyne	SMO	18	40
COc1ccc(N2CCN(c3nc(C(F)(F)F)ccc3C#N)CC2)nc1	ZINC000450941804	FF	On-Demand	Mild	P2RY12	24	42
Fc1cccc(OCCN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450941809	DH	On-Demand	Anodyne	CHRNA10	32	40
COC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1OC	ZINC000450941814	FD	On-Demand	Anodyne	NPBWR1	42	37
CCNC(=O)C[C@@H]1CCCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450941824	DG	On-Demand	Anodyne	DRD2	54	43
CCNC(=O)C[C@H]1CCCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450941827	DG	On-Demand	Anodyne	DRD2	54	43
CC(=O)c1cccc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)c1	ZINC000450941838	ED	On-Demand	Anodyne	ACHE	21	41
CC(=O)c1cccc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)c1	ZINC000450941838	ED	On-Demand	Anodyne	CHRM3	19	40
CC(=O)c1cccc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)c1	ZINC000450941838	ED	On-Demand	Anodyne	CCR3	21	42
COCc1nsc(N2CCN(c3ccc(OC)cn3)CC2)n1	ZINC000450941839	DD	On-Demand	Anodyne	NPBWR1	41	35
COc1ccc(N2CCN(c3noc(-c4ccccc4)n3)CC2)nc1	ZINC000450941841	EE	On-Demand	Anodyne	LUCI_PHOPE	29	40
COCCOC[C@H](O)CN[C@@H]1CCCCC[C@H]1c1ccc(Cl)cc1	ZINC000450941850	FG	On-Demand	Anodyne	SLC6A1	42	35
COCCOC[C@H](O)CN[C@@H]1CCCCC[C@@H]1c1ccc(Cl)cc1	ZINC000450941853	FG	On-Demand	Anodyne	SLC6A1	42	35
COCCOC[C@H](O)CN[C@H]1CCCCC[C@@H]1c1ccc(Cl)cc1	ZINC000450941854	FG	On-Demand	Anodyne	SLC6A1	42	35
COCCOC[C@H](O)CN[C@H]1CCCCC[C@H]1c1ccc(Cl)cc1	ZINC000450941856	FG	On-Demand	Anodyne	SLC6A1	42	35
CCCc1cc(NCc2nc3cccc(Br)c3[nH]2)n2ncnc2n1	ZINC000450941862	GG	On-Demand	Anodyne	DHOD	0	40
CCCCNC(=O)NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450941876	EF	On-Demand	Anodyne	PPARD	44	43
CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nn1	ZINC000450941878	EC	On-Demand	Anodyne	DRD4	40	30
CCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nn1	ZINC000450941878	EC	On-Demand	Anodyne	SCD1	50	45
CCOC(=O)c1cc(N2CCN(c3ccc(OC)cn3)CC2)ncc1Cl	ZINC000450941886	GF	On-Demand	Anodyne	DRD4	40	31
CCOC(=O)c1cc(N2CCN(c3ccc(OC)cn3)CC2)ncc1Cl	ZINC000450941886	GF	On-Demand	Anodyne	HTR4	27	41
CCOC(=O)c1cc(N2CCN(c3ccc(OC)cn3)CC2)ncc1Cl	ZINC000450941886	GF	On-Demand	Anodyne	P2RY12	48	44
CCOC(=O)c1cc(N2CCN(c3ccc(OC)cn3)CC2)ncc1Cl	ZINC000450941886	GF	On-Demand	Anodyne	IKBKB	44	42
CCOC(=O)c1cc(N2CCN(c3ccc(OC)cn3)CC2)ncc1Cl	ZINC000450941886	GF	On-Demand	Anodyne	SMO	17	41
CCOC(=O)c1cc(N2CCN(c3ccc(OC)cn3)CC2)ncc1Cl	ZINC000450941886	GF	On-Demand	Anodyne	NPBWR1	41	35
COc1ccc(N2CCN(c3ccc(C(=O)NC4CCCC4)nn3)CC2)nc1	ZINC000450941891	GD	On-Demand	Anodyne	SCD1	64	51
COc1ccc(N2CCN(c3ccc(C(=O)NC4CCCC4)nn3)CC2)nc1	ZINC000450941891	GD	On-Demand	Anodyne	SCD	50	43
COc1ccc(N2CCN(c3ccc(C(=O)NC4CCCC4)nn3)CC2)nc1	ZINC000450941891	GD	On-Demand	Anodyne	HPGDS	25	43
COc1ccc(N2CCN(c3ccc(C(=O)NC4CCCC4)nn3)CC2)nc1	ZINC000450941891	GD	On-Demand	Anodyne	NPBWR1	74	40
CCOc1cccc(CN(CCO)c2nnc(C)c(C)n2)c1	ZINC000450941911	DD	On-Demand	Anodyne	CETP	0	40
O=C(COc1ccc(C(F)(F)F)cc1F)NC(=O)NCC(F)(F)F	ZINC000450941912	FF	On-Demand	Mild	PPARD	40	38
COc1ccc(N2CCN(c3nc(-c4cccnc4)nc(C)c3C)CC2)nc1	ZINC000450941914	GF	On-Demand	Anodyne	ROS1	43	41
C[C@H](O)CCN1CC[C@](F)(c2cccc(Cl)c2)C1	ZINC000450941917	CF	On-Demand	Anodyne	OPRK1	16	42
O[C@H](Cc1ccccc1)CN1CC[C@H](C(F)(F)F)C2(CCC2)C1	ZINC000450941918	EH	On-Demand	Anodyne	VACHT_TETCF	0	45
O[C@H](Cc1ccccc1)CN1CC[C@@H](C(F)(F)F)C2(CCC2)C1	ZINC000450941919	EH	On-Demand	Anodyne	VACHT_TETCF	0	45
CCOC(=O)c1ccc(CN(C)CCc2cccc([N+](=O)[O-])c2)nc1	ZINC000450941922	EF	On-Demand	Bother	CACNA1D	91	43
COc1ccc(N2CCN(c3ncnc4cc(F)c(F)cc34)CC2)nc1	ZINC000450941927	FF	On-Demand	Anodyne	PDE3A	54	44
COc1ccc(N2CCN(c3ncnc4cc(F)c(F)cc34)CC2)nc1	ZINC000450941927	FF	On-Demand	Anodyne	PDGFRB	80	49
COc1ccc(N2CCN(c3ncnc4cc(F)c(F)cc34)CC2)nc1	ZINC000450941927	FF	On-Demand	Anodyne	PDE3B	80	44
COc1ccc(N2CCN(c3ncnc4cc(F)c(F)cc34)CC2)nc1	ZINC000450941927	FF	On-Demand	Anodyne	HTT	0	45
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@H](O)Cc1ccccc1	ZINC000450941938	ED	On-Demand	Anodyne	SLC6A1	0	40
CCO[C@@H]1CCCC[C@H]1Nc1cc(C)nc2ncnn12	ZINC000450941942	CE	On-Demand	Anodyne	DHOD	0	51
COC(=O)[C@H]1CN(c2nc(CC(C)C)ns2)C[C@@H]1c1ccccc1	ZINC000450941943	EG	On-Demand	Anodyne	SLC6A1	42	39
COC(=O)[C@H]1CN(c2nc(CC(C)C)ns2)C[C@H]1c1ccccc1	ZINC000450941944	EG	On-Demand	Anodyne	SLC6A1	42	39
COC(=O)[C@@H]1CN(c2nc(CC(C)C)ns2)C[C@H]1c1ccccc1	ZINC000450941945	EG	On-Demand	Anodyne	SLC6A1	42	39
CCOc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-]	ZINC000450941959	FG	On-Demand	Bother	SLC6A1	46	39
CCOc1cc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-]	ZINC000450941960	FG	On-Demand	Bother	SLC6A1	46	39
CCOc1cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)ccc1[N+](=O)[O-]	ZINC000450941961	FG	On-Demand	Bother	SLC6A1	46	39
COC(=O)[C@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450941962	FG	On-Demand	Bother	SLC6A1	32	42
COC(=O)[C@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1c1ccccc1	ZINC000450941963	FG	On-Demand	Bother	SLC6A1	32	42
COC(=O)[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450941964	FG	On-Demand	Bother	SLC6A1	32	42
CCO[C@@H]1CCC[C@H]1Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450941981	EE	On-Demand	Anodyne	TGM2	32	41
COc1cc(N2CCN(CC[C@@H](C)O)CC2)ccc1F	ZINC000450941982	CD	On-Demand	Anodyne	HTR1A	46	44
COc1cc(N2CCN(CC[C@@H](C)O)CC2)ccc1F	ZINC000450941982	CD	On-Demand	Anodyne	DRD2	33	42
COc1cc(N2CCN(CC[C@@H](C)O)CC2)ccc1F	ZINC000450941982	CD	On-Demand	Anodyne	HTR2A	26	41
COc1cc(N2CCN(CC[C@@H](C)O)CC2)ccc1F	ZINC000450941982	CD	On-Demand	Anodyne	HTR7	35	43
COc1cc(N2CCN(CC[C@H](C)O)CC2)ccc1F	ZINC000450941984	CD	On-Demand	Anodyne	HTR1A	46	44
COc1cc(N2CCN(CC[C@H](C)O)CC2)ccc1F	ZINC000450941984	CD	On-Demand	Anodyne	DRD2	33	42
COc1cc(N2CCN(CC[C@H](C)O)CC2)ccc1F	ZINC000450941984	CD	On-Demand	Anodyne	HTR2A	26	41
COc1cc(N2CCN(CC[C@H](C)O)CC2)ccc1F	ZINC000450941984	CD	On-Demand	Anodyne	HTR7	35	43
CCCc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2ccccc2n1	ZINC000450941988	GG	On-Demand	Anodyne	SMO	33	44
CC(=O)c1ccc(CN2CCOc3cccc(F)c3C2)cc1	ZINC000450942019	CG	On-Demand	Anodyne	NOD2	40	35
COC[C@H]1CCCCN1c1ccc([N+](=O)[O-])c(N)c1F	ZINC000450942022	CE	For-Sale	Bother	CASP7	47	37
COC[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c(N)c1F	ZINC000450942024	CE	For-Sale	Bother	CASP7	47	37
Cc1cc(C(=O)CSc2nc3c(C)ccnc3[nH]2)c(C)[nH]1	ZINC000450942029	DG	On-Demand	Anodyne	ENPP1	56	36
O=C(NC[C@H]1CCCN(CCc2cscn2)C1)c1ccco1	ZINC000450942038	DE	On-Demand	Anodyne	CCR3	34	40
O=C(NC[C@@H]1CCCN(CCc2cscn2)C1)c1ccco1	ZINC000450942040	DE	On-Demand	Anodyne	CCR3	34	40
COC[C@H]1CCCCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450942058	EH	On-Demand	Anodyne	FKBP1A	37	40
COC[C@@H]1CCCCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450942059	EH	On-Demand	Anodyne	FKBP1A	37	40
Cc1ccnc2[nH]c(SCC(=O)NCCCN3CCCC3=O)nc12	ZINC000450942082	ED	On-Demand	Anodyne	TYRO3	25	40
Cc1ccnc2[nH]c(SCC(=O)NCCCN3CCCC3=O)nc12	ZINC000450942082	ED	On-Demand	Anodyne	ENPP1	61	50
CN(c1ncnc2sc3ccccc3c12)C1CCN(CC(F)(F)F)CC1	ZINC000450942109	GI	On-Demand	Anodyne	NPY1R	24	40
CNS(=O)(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c(F)c1	ZINC000450942114	GC	On-Demand	Anodyne	SLC6A9	22	44
C[C@H]1CN(c2nc(C(F)F)nc3ccccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450942122	GF	On-Demand	Anodyne	SMO	39	49
Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](O)C3)nc2)cc1	ZINC000450942126	EF	On-Demand	Anodyne	PRNP	55	39
Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](O)C3)nc2)cc1	ZINC000450942126	EF	On-Demand	Anodyne	HDAC1	28	47
Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](O)C3)nc2)cc1	ZINC000450942126	EF	On-Demand	Anodyne	P4HTM	0	49
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](O)C3)nc2)cc1	ZINC000450942127	EF	On-Demand	Anodyne	PRNP	55	39
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](O)C3)nc2)cc1	ZINC000450942127	EF	On-Demand	Anodyne	HDAC1	28	47
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](O)C3)nc2)cc1	ZINC000450942127	EF	On-Demand	Anodyne	P4HTM	0	49
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](O)C3)nc2)cc1	ZINC000450942128	EF	On-Demand	Anodyne	PRNP	55	39
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](O)C3)nc2)cc1	ZINC000450942128	EF	On-Demand	Anodyne	HDAC1	28	47
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](O)C3)nc2)cc1	ZINC000450942128	EF	On-Demand	Anodyne	P4HTM	0	49
C[C@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450942139	DD	On-Demand	Anodyne	SCD1	31	41
C[C@H]1C[C@H](O)CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450942140	DD	On-Demand	Anodyne	SCD1	31	41
C[C@@H]1C[C@@H](O)CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450942141	DD	On-Demand	Anodyne	SCD1	31	41
CC[C@@H](Nc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1)C(=O)NC	ZINC000450942156	ED	On-Demand	Anodyne	CA2	17	43
CC[C@@H](Nc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1)C(=O)NC	ZINC000450942156	ED	On-Demand	Anodyne	CA7	16	43
CC[C@H](Nc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1)C(=O)NC	ZINC000450942157	ED	On-Demand	Anodyne	CA2	17	43
CC[C@H](Nc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1)C(=O)NC	ZINC000450942157	ED	On-Demand	Anodyne	CA7	16	43
COC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1cc(C)cc(C)c1	ZINC000450942181	FF	On-Demand	Anodyne	ENPP2	16	48
COC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1cc(C)cc(C)c1	ZINC000450942182	FF	On-Demand	Anodyne	ENPP2	16	48
CC[C@H](Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl)C(=O)NC	ZINC000450942198	GG	On-Demand	Anodyne	CNR1	47	41
CC[C@@H](Nc1cnn(-c2ccc(Cl)cc2Cl)c(=O)c1Cl)C(=O)NC	ZINC000450942199	GG	On-Demand	Anodyne	CNR1	47	41
CC[C@@H](Nc1ccc(C#N)cc1)C(=O)NC	ZINC000450942221	BD	On-Demand	Mild	CTRB_BOVIN	47	34
CC[C@H](Nc1ccc(C#N)cc1)C(=O)NC	ZINC000450942222	BD	On-Demand	Mild	CTRB_BOVIN	47	34
CCS(=O)(=O)Cc1ccc(Nc2nc(-c3ccccn3)nc3c2CCC3)cc1	ZINC000450942230	GH	On-Demand	Anodyne	PDE4B	25	51
Cc1cccc([C@@H](C)Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1	ZINC000450942237	EG	On-Demand	Bother	BDKRB1	0	43
Cc1cccc([C@H](C)Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1	ZINC000450942238	EG	On-Demand	Bother	BDKRB1	0	43
Cc1nc(C)n(CCCC(=O)N(Cc2ccccc2)[C@@H](C)C(C)(C)C)n1	ZINC000450942249	FI	On-Demand	Anodyne	HLA-DRB1	44	33
Cc1nc(C)n(CCCC(=O)N(Cc2ccccc2)[C@H](C)C(C)(C)C)n1	ZINC000450942250	FI	On-Demand	Anodyne	HLA-DRB1	44	33
COC[C@@H]1CCCN(c2nc(-c3cccc(Cl)c3)no2)CC1	ZINC000450942252	DH	On-Demand	Anodyne	GRM5	28	45
COC[C@H]1CCCN(c2nc(-c3cccc(Cl)c3)no2)CC1	ZINC000450942253	DH	On-Demand	Anodyne	GRM5	28	45
COC[C@@H]1CCCN(c2ccnc(C(N)=O)c2)CC1	ZINC000450942256	CD	On-Demand	Anodyne	SIRT2	50	31
COC[C@@H]1CCCN(c2ccnc(C(N)=O)c2)CC1	ZINC000450942256	CD	On-Demand	Anodyne	SIRT1	49	30
COC[C@H]1CCCN(c2ccnc(C(N)=O)c2)CC1	ZINC000450942257	CD	On-Demand	Anodyne	SIRT2	50	31
COC[C@H]1CCCN(c2ccnc(C(N)=O)c2)CC1	ZINC000450942257	CD	On-Demand	Anodyne	SIRT1	49	30
CC(C)(C)C[C@H]1CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450942258	CE	On-Demand	Anodyne	HRH4	0	42
CC(C)(C)C[C@H]1CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450942258	CE	On-Demand	Anodyne	SIRT3	55	35
CC(C)(C)C[C@H]1CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450942258	CE	On-Demand	Anodyne	SIRT2	56	36
CC(C)(C)C[C@H]1CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450942258	CE	On-Demand	Anodyne	SIRT1	55	35
CC(C)(C)C[C@@H]1CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450942259	CE	On-Demand	Anodyne	HRH4	0	42
CC(C)(C)C[C@@H]1CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450942259	CE	On-Demand	Anodyne	SIRT3	55	35
CC(C)(C)C[C@@H]1CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450942259	CE	On-Demand	Anodyne	SIRT2	56	36
CC(C)(C)C[C@@H]1CCN(c2ccnc(C(N)=O)c2)C1	ZINC000450942259	CE	On-Demand	Anodyne	SIRT1	55	35
COC(=O)c1nc(N2CCN(c3ccc(OC)cn3)CC2)sc1C	ZINC000450942266	ED	On-Demand	Anodyne	NPBWR1	48	39
COc1ccc(N2CCN(c3ncnc4cc(Cl)ccc34)CC2)nc1	ZINC000450942277	FG	On-Demand	Anodyne	PDE3A	51	41
COc1ccc(N2CCN(c3ncnc4cc(Cl)ccc34)CC2)nc1	ZINC000450942277	FG	On-Demand	Anodyne	PDGFRB	74	45
COc1ccc(N2CCN(c3ncnc4cc(Cl)ccc34)CC2)nc1	ZINC000450942277	FG	On-Demand	Anodyne	HRH4	18	40
COc1ccc(N2CCN(c3ncnc4cc(Cl)ccc34)CC2)nc1	ZINC000450942277	FG	On-Demand	Anodyne	HNMT	45	33
COc1ccc(N2CCN(c3ncnc4cc(Cl)ccc34)CC2)nc1	ZINC000450942277	FG	On-Demand	Anodyne	PDE3B	75	41
COc1ccc(N2CCN(c3ncnc4cc(Cl)ccc34)CC2)nc1	ZINC000450942277	FG	On-Demand	Anodyne	AKT1	26	43
COc1ccc(N2CCN(c3ncnc4cc(Cl)ccc34)CC2)nc1	ZINC000450942277	FG	On-Demand	Anodyne	HTT	0	50
COC[C@H]1CCCN(c2ncncc2-c2ccccc2)CC1	ZINC000450942281	CG	On-Demand	Anodyne	SLC9A1	22	54
COC[C@@H]1CCCN(c2ncncc2-c2ccccc2)CC1	ZINC000450942284	CG	On-Demand	Anodyne	SLC9A1	22	54
COC[C@H]1CCCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)CC1	ZINC000450942293	EG	On-Demand	Anodyne	FASN	25	41
COC[C@H]1CCCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)CC1	ZINC000450942293	EG	On-Demand	Anodyne	L3MBTL3	45	34
COC[C@@H]1CCCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)CC1	ZINC000450942294	EG	On-Demand	Anodyne	FASN	25	41
COC[C@@H]1CCCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)CC1	ZINC000450942294	EG	On-Demand	Anodyne	L3MBTL3	45	34
COc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3)CC2)nc1	ZINC000450942296	ED	On-Demand	Anodyne	PTGS1	23	46
COc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3)CC2)nc1	ZINC000450942296	ED	On-Demand	Anodyne	PTGS2	34	46
COc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3)CC2)nc1	ZINC000450942296	ED	On-Demand	Anodyne	SLC6A9	0	42
COc1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3)CC2)nc1	ZINC000450942296	ED	On-Demand	Anodyne	GPR119	28	59
CNS(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)c(F)c1	ZINC000450942306	ED	On-Demand	Anodyne	CASP3	52	37
CNS(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)c(F)c1	ZINC000450942306	ED	On-Demand	Anodyne	SLC6A9	22	50
CNS(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)c(F)c1	ZINC000450942306	ED	On-Demand	Anodyne	CASP7	67	38
CNS(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)c(F)c1	ZINC000450942308	ED	On-Demand	Anodyne	CASP3	52	37
CNS(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)c(F)c1	ZINC000450942308	ED	On-Demand	Anodyne	SLC6A9	22	50
CNS(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)c(F)c1	ZINC000450942308	ED	On-Demand	Anodyne	CASP7	67	38
COCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450942319	FD	On-Demand	Anodyne	DRD2	22	41
COCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450942319	FD	On-Demand	Anodyne	DRD1	0	44
COCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450942319	FD	On-Demand	Anodyne	DRD4	51	39
COCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450942319	FD	On-Demand	Anodyne	HDAC1	30	47
COCCNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)nc1	ZINC000450942319	FD	On-Demand	Anodyne	AP2S1	0	41
CNC(=O)N[C@H]1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450942363	EE	On-Demand	Anodyne	EPHX2	27	46
CCOc1cccc(CN(CCO)c2nc(C(C)C)nc(N(C)C)n2)c1	ZINC000450942373	FE	On-Demand	Anodyne	CETP	0	40
CNC(=O)N[C@@H]1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000450942381	EE	On-Demand	Anodyne	EPHX2	27	46
COC(=O)c1cc(N2CCN(c3ccc(OC)cn3)CC2)cc(C)c1[N+](=O)[O-]	ZINC000450942385	GE	On-Demand	Bother	CCKAR	0	41
CCC[C@H](O)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450942386	CD	On-Demand	Anodyne	HTR4	55	39
CCC[C@H](O)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450942386	CD	On-Demand	Anodyne	CACNA1I	43	36
CCC[C@H](O)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450942387	CD	On-Demand	Anodyne	HTR4	55	39
CCC[C@H](O)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450942387	CD	On-Demand	Anodyne	CACNA1I	43	36
CCC[C@@H](O)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450942389	CD	On-Demand	Anodyne	HTR4	55	39
CCC[C@@H](O)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450942389	CD	On-Demand	Anodyne	CACNA1I	43	36
O=C(NC1CCCC1)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nn1	ZINC000450942390	GE	On-Demand	Anodyne	CASR	43	36
CCC[C@@H](O)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450942391	CD	On-Demand	Anodyne	HTR4	55	39
CCC[C@@H](O)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450942391	CD	On-Demand	Anodyne	CACNA1I	43	36
COc1ccc(N2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)nc1	ZINC000450942397	FD	On-Demand	Bother	TAAR1	25	50
COc1ccc(N2CCN(c3nc4ccccc4nc3C)CC2)nc1	ZINC000450942398	EF	On-Demand	Anodyne	EBP	24	45
CCc1cc(N[C@H](C)c2cccc(C)c2)n2ncnc2n1	ZINC000450942409	CG	On-Demand	Anodyne	DHOD	0	52
CCc1cc(N[C@@H](C)c2cccc(C)c2)n2ncnc2n1	ZINC000450942411	CG	On-Demand	Anodyne	DHOD	0	52
COC(=O)[C@H]1CN(c2nc(C)c(C#N)cc2Cl)C[C@@H]1c1ccccc1	ZINC000450942412	FG	On-Demand	Mild	SLC6A1	25	40
COC[C@@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000450942413	CF	On-Demand	Bother	CASP3	49	39
COC[C@@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000450942413	CF	On-Demand	Bother	CASP7	62	39
COC(=O)[C@H]1CN(c2nc(C)c(C#N)cc2Cl)C[C@H]1c1ccccc1	ZINC000450942414	FG	On-Demand	Mild	SLC6A1	25	40
COC(=O)[C@@H]1CN(c2nc(C)c(C#N)cc2Cl)C[C@H]1c1ccccc1	ZINC000450942415	FG	On-Demand	Mild	SLC6A1	25	40
COC[C@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450942422	EE	On-Demand	Bother	CASP3	25	42
COC[C@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450942422	EE	On-Demand	Bother	CASP7	52	41
COC[C@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000450942423	CF	On-Demand	Bother	CASP3	49	39
COC[C@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000450942423	CF	On-Demand	Bother	CASP7	62	39
COC[C@@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450942425	EE	On-Demand	Bother	CASP3	25	42
COC[C@@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450942425	EE	On-Demand	Bother	CASP7	52	41
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H](CC(C)(C)C)C3)nc2)CC1	ZINC000450942426	GE	On-Demand	Anodyne	GCK	60	34
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H](CC(C)(C)C)C3)nc2)CC1	ZINC000450942426	GE	On-Demand	Anodyne	GCKR	84	39
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@H](CC(C)(C)C)C3)nc2)CC1	ZINC000450942429	GE	On-Demand	Anodyne	GCK	60	34
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@H](CC(C)(C)C)C3)nc2)CC1	ZINC000450942429	GE	On-Demand	Anodyne	GCKR	84	39
COC(=O)c1csc(CN2CCC(N3CCc4cc(F)ccc43)CC2)n1	ZINC000450942440	GG	On-Demand	Anodyne	SCD1	29	45
CCO[C@@H]1CCC[C@H]1Nc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000450942443	EG	On-Demand	Anodyne	L3MBTL3	61	34
COc1ccc(N2CCN(c3cc(N4CCCC4)ncn3)CC2)nc1	ZINC000450942455	ED	On-Demand	Anodyne	GALR2	46	36
COC(=O)[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc(O)cc1	ZINC000450942456	CC	On-Demand	Anodyne	YARS	40	30
COC(=O)[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(O)cc1	ZINC000450942457	CC	On-Demand	Anodyne	YARS	40	30
COC[C@H]1CCCCN1c1cnn(C)c(=O)c1Cl	ZINC000450942469	CD	On-Demand	Anodyne	CASP3	42	36
COC[C@H]1CCCCN1c1cnn(C)c(=O)c1Cl	ZINC000450942469	CD	On-Demand	Anodyne	CASP7	54	36
COC[C@@H]1CCCCN1c1cnn(C)c(=O)c1Cl	ZINC000450942470	CD	On-Demand	Anodyne	CASP3	42	36
COC[C@@H]1CCCCN1c1cnn(C)c(=O)c1Cl	ZINC000450942470	CD	On-Demand	Anodyne	CASP7	54	36
CCc1cc(N[C@@H]2CN(CC(F)(F)F)C[C@H]2c2ccccc2)n2ncnc2n1	ZINC000450942471	GG	On-Demand	Anodyne	DHOD	0	47
C[C@@H](c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942481	GJ	On-Demand	Anodyne	DRD4	19	41
C[C@@H](c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942481	GJ	On-Demand	Anodyne	HTR4	46	40
C[C@@H](c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942481	GJ	On-Demand	Anodyne	CCR3	42	40
C[C@@H](c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942481	GJ	On-Demand	Anodyne	CACNA1I	61	38
C[C@H](c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942482	GJ	On-Demand	Anodyne	DRD4	19	41
C[C@H](c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942482	GJ	On-Demand	Anodyne	HTR4	46	40
C[C@H](c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942482	GJ	On-Demand	Anodyne	CCR3	42	40
C[C@H](c1ccc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942482	GJ	On-Demand	Anodyne	CACNA1I	61	38
C[C@@H](c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942483	GJ	On-Demand	Anodyne	DRD4	19	41
C[C@@H](c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942483	GJ	On-Demand	Anodyne	HTR4	46	40
C[C@@H](c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942483	GJ	On-Demand	Anodyne	CCR3	42	40
C[C@@H](c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942483	GJ	On-Demand	Anodyne	CACNA1I	61	38
C[C@H](c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942485	GJ	On-Demand	Anodyne	DRD4	19	41
C[C@H](c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942485	GJ	On-Demand	Anodyne	HTR4	46	40
C[C@H](c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942485	GJ	On-Demand	Anodyne	CCR3	42	40
C[C@H](c1ccc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)cc1)C(F)(F)F	ZINC000450942485	GJ	On-Demand	Anodyne	CACNA1I	61	38
CC(=O)c1ccc(N[C@@H]2CN(CC(F)(F)F)C[C@H]2c2ccccc2)nc1	ZINC000450942486	FH	On-Demand	Anodyne	HPGDS	23	41
CCn1ccnc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1=O	ZINC000450942505	ED	On-Demand	Anodyne	SLC6A1	65	41
C[C@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])CCN1C(=O)c1cnn(C)c1	ZINC000450942508	FD	On-Demand	Bother	SLC6A7	0	43
CCn1ccnc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)c1=O	ZINC000450942513	ED	On-Demand	Anodyne	SLC6A1	65	41
COc1ccc(CNC(=O)CCN2C[C@H]3COC[C@@H](C2)O3)c(OC)c1	ZINC000450942517	FC	On-Demand	Anodyne	HTR7	23	40
COc1ccc(CNC(=O)CCN2C[C@H]3COC[C@@H](C2)O3)c(OC)c1	ZINC000450942517	FC	On-Demand	Anodyne	MTNR1A	54	36
COc1ccc(CNC(=O)CCN2C[C@H]3COC[C@@H](C2)O3)c(OC)c1	ZINC000450942517	FC	On-Demand	Anodyne	MTNR1B	41	38
CNS(=O)(=O)c1ccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)nc1	ZINC000450942522	GC	On-Demand	Anodyne	SLC6A7	0	40
C[C@@H](SC(C)(C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450942527	DI	On-Demand	Anodyne	MAP	0	45
C[C@@H](SC(C)(C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450942527	DI	On-Demand	Anodyne	MAP1	132	43
C[C@@H](SC(C)(C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450942527	DI	On-Demand	Anodyne	FFAR2	22	46
C[C@H](SC(C)(C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450942528	DI	On-Demand	Anodyne	MAP	0	45
C[C@H](SC(C)(C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450942528	DI	On-Demand	Anodyne	MAP1	132	43
C[C@H](SC(C)(C)c1ccccc1)C(=O)Nc1nccs1	ZINC000450942528	DI	On-Demand	Anodyne	FFAR2	22	46
Cc1ccnc2[nH]c(SCC(=O)NCCCOc3ccccc3F)nc12	ZINC000450942539	FG	On-Demand	Anodyne	ENPP1	64	53
CCOC(=O)c1ccnc(N(C)[C@@H]2C[C@@H](c3cccc(OC)c3)C2)c1[N+](=O)[O-]	ZINC000450942546	GH	On-Demand	Bother	CACNA1C	37	41
CCOC(=O)c1ccnc(N(C)[C@@H]2C[C@@H](c3cccc(OC)c3)C2)c1[N+](=O)[O-]	ZINC000450942546	GH	On-Demand	Bother	CACNA1D	59	35
COCc1nc(C)cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)n1	ZINC000450942562	EE	On-Demand	Anodyne	SLC6A1	38	40
COCc1nc(C)cc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)n1	ZINC000450942571	EE	On-Demand	Anodyne	SLC6A1	38	40
COCc1ccc([C@H]2CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)o1	ZINC000450942576	GH	On-Demand	Bother	COLA	48	40
COCc1ccc([C@H]2CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)o1	ZINC000450942576	GH	On-Demand	Bother	CPT1A	46	40
COCc1ccc([C@@H]2CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)o1	ZINC000450942577	GH	On-Demand	Bother	COLA	48	40
COCc1ccc([C@@H]2CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)o1	ZINC000450942577	GH	On-Demand	Bother	CPT1A	46	40
CC(=O)c1ccc(CN2CCC(C)=C(c3ccco3)C2)cc1	ZINC000450942580	CI	On-Demand	Anodyne	NOD2	44	38
CC[C@@H](Nc1nc(OC)cc(OC)n1)C(=O)NC	ZINC000450942631	CB	On-Demand	Anodyne	ALS	80	34
CC[C@H](Nc1nc(OC)cc(OC)n1)C(=O)NC	ZINC000450942632	CB	On-Demand	Anodyne	ALS	80	34
CC[C@@H](N=c1[nH]c(C(F)F)nc2ccccc12)C(=O)NC	ZINC000450942635	CD	On-Demand	Anodyne	TACR3	37	40
CC[C@H](N=c1[nH]c(C(F)F)nc2ccccc12)C(=O)NC	ZINC000450942636	CD	On-Demand	Anodyne	TACR3	37	40
COc1cc2c(N3C[C@H](C)C[C@@H](O)C3)ccnc2cc1F	ZINC000450942667	CF	On-Demand	Anodyne	PDE3A	43	33
COc1cc2c(N3C[C@@H](O)C[C@@H](C)C3)ccnc2cc1F	ZINC000450942668	CF	On-Demand	Anodyne	PDE3A	43	33
COc1cc2c(N3C[C@@H](C)C[C@H](O)C3)ccnc2cc1F	ZINC000450942669	CF	On-Demand	Anodyne	PDE3A	43	33
COC(=O)[C@@H](NC(=O)c1cn2nccc2nc1C)c1ccc(C)c(C)c1	ZINC000450942674	FE	On-Demand	Anodyne	DDR1	49	41
COC(=O)[C@H](NC(=O)c1cn2nccc2nc1C)c1ccc(C)c(C)c1	ZINC000450942675	FE	On-Demand	Anodyne	DDR1	49	41
OCC1(CN(Cc2ccccc2)Cc2cn(CC3CC3)nn2)CC1	ZINC000450942676	EE	On-Demand	Anodyne	HSP90AB1	17	41
CC[C@H](N=c1nc(-c2ccccc2)[nH]s1)C(=O)NC	ZINC000450942689	CD	On-Demand	Anodyne	TACR3	58	39
CC[C@@H](N=c1nc(-c2ccccc2)[nH]s1)C(=O)NC	ZINC000450942690	CD	On-Demand	Anodyne	TACR3	58	39
CC[C@@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)C(=O)NC	ZINC000450942699	ED	On-Demand	Anodyne	LRRK2	29	45
CC[C@H](Nc1ncc(C(=O)N2CCOCC2)cc1Cl)C(=O)NC	ZINC000450942700	ED	On-Demand	Anodyne	LRRK2	29	45
COC(=O)CNC(=O)c1ccc(N2C[C@@H](C)C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450942703	FC	On-Demand	Bother	TAAR1	22	46
COC(=O)CNC(=O)c1ccc(N2C[C@@H](O)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450942704	FC	On-Demand	Bother	TAAR1	22	46
COC(=O)CNC(=O)c1ccc(N2C[C@H](C)C[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000450942705	FC	On-Demand	Bother	TAAR1	22	46
COC(=O)[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc(O)cc1	ZINC000450942725	CC	On-Demand	Anodyne	YARS	40	30
COC(=O)[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc(O)cc1	ZINC000450942726	CC	On-Demand	Anodyne	YARS	40	30
COc1ccc(N2CCN(c3cncc(-n4nc(C)cc4C)n3)CC2)nc1	ZINC000450942732	FE	On-Demand	Anodyne	ADORA2A	28	40
COc1ccc(N2CCN(c3ccnc(C4CC4)n3)CC2)nc1	ZINC000450942735	DE	On-Demand	Anodyne	EBP	30	47
COc1ccc(N2CCN(c3ccnc(C4CC4)n3)CC2)nc1	ZINC000450942735	DE	On-Demand	Anodyne	SORD	49	35
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)C(=O)NC	ZINC000450942741	FD	On-Demand	Bother	TBXA2R	28	43
CC[C@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1)C(=O)NC	ZINC000450942743	FD	On-Demand	Bother	TBXA2R	28	43
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1nnc(C(C)C)s1	ZINC000450942746	EG	On-Demand	Anodyne	FCER2	42	32
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1nnc(C(C)C)s1	ZINC000450942749	EG	On-Demand	Anodyne	FCER2	42	32
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1nnc(C(C)C)s1	ZINC000450942751	EG	On-Demand	Anodyne	FCER2	42	32
CC[C@@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C(=O)NC	ZINC000450942752	ED	On-Demand	Bother	CAPN1	43	39
CC[C@@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C(=O)NC	ZINC000450942752	ED	On-Demand	Bother	CAPN2	83	39
CC[C@@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C(=O)NC	ZINC000450942752	ED	On-Demand	Bother	NPR	48	37
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1nnc(C(C)C)s1	ZINC000450942753	EG	On-Demand	Anodyne	FCER2	42	32
CC[C@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C(=O)NC	ZINC000450942754	ED	On-Demand	Bother	CAPN1	43	39
CC[C@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C(=O)NC	ZINC000450942754	ED	On-Demand	Bother	CAPN2	83	39
CC[C@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C(=O)NC	ZINC000450942754	ED	On-Demand	Bother	NPR	48	37
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942760	DD	On-Demand	Anodyne	MME	45	39
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942760	DD	On-Demand	Anodyne	ANPEP	51	33
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942760	DD	On-Demand	Anodyne	PAPA1_CARPA	49	41
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942760	DD	On-Demand	Anodyne	CAPNS1	46	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942760	DD	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942760	DD	On-Demand	Anodyne	BLAIMP-1	0	43
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942762	DD	On-Demand	Anodyne	MME	45	39
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942762	DD	On-Demand	Anodyne	ANPEP	51	33
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942762	DD	On-Demand	Anodyne	PAPA1_CARPA	49	41
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942762	DD	On-Demand	Anodyne	CAPNS1	46	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942762	DD	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942762	DD	On-Demand	Anodyne	BLAIMP-1	0	43
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942763	DD	On-Demand	Anodyne	MME	45	39
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942763	DD	On-Demand	Anodyne	ANPEP	51	33
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942763	DD	On-Demand	Anodyne	PAPA1_CARPA	49	41
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942763	DD	On-Demand	Anodyne	CAPNS1	46	34
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942763	DD	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC[C@](C)(O)C(C)=O	ZINC000450942763	DD	On-Demand	Anodyne	BLAIMP-1	0	43
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942765	DD	On-Demand	Anodyne	MME	45	39
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942765	DD	On-Demand	Anodyne	ANPEP	51	33
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942765	DD	On-Demand	Anodyne	PAPA1_CARPA	49	41
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942765	DD	On-Demand	Anodyne	CAPNS1	46	34
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942765	DD	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC[C@@](C)(O)C(C)=O	ZINC000450942765	DD	On-Demand	Anodyne	BLAIMP-1	0	43
Cc1nnc2c3ccccc3c(N(CCN3CCOCC3)Cc3ccco3)nn12	ZINC000450942774	GF	On-Demand	Anodyne	BRD9	45	37
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	DRD2	31	43
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	DRD1	16	48
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	DRD4	18	48
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	HTR2A	28	54
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	HTR2C	26	47
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	DRD3	15	48
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	ERG2	20	41
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	HTR7	31	46
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	HTR5A	27	54
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	SLC18A3	0	52
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	HTR3B	0	48
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	CYP2J2	51	38
CNS(=O)(=O)c1cccc2c1CCN(CCCC(=O)c1ccc(F)cc1)C2	ZINC000450942781	GF	On-Demand	Anodyne	AP2S1	0	41
COc1cc(OC)nc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450942793	ED	On-Demand	Anodyne	CASR	25	41
COC(=O)[C@@H](NC(=O)C[C@H]1COc2ccccc2O1)c1cc(C)cc(C)c1	ZINC000450942798	FF	On-Demand	Anodyne	ADRA2B	16	40
COC(=O)[C@H](NC(=O)C[C@H]1COc2ccccc2O1)c1cc(C)cc(C)c1	ZINC000450942805	FF	On-Demand	Anodyne	ADRA2B	16	40
COc1ccc(N2CCN(c3ncnc4cccc(F)c34)CC2)nc1	ZINC000450942806	EE	On-Demand	Anodyne	PDE3B	50	32
COC(=O)[C@H](NC(=O)C[C@@H]1COc2ccccc2O1)c1cc(C)cc(C)c1	ZINC000450942807	FF	On-Demand	Anodyne	ADRA2B	16	40
COC(=O)[C@@H](NC(=O)C[C@@H]1COc2ccccc2O1)c1cc(C)cc(C)c1	ZINC000450942810	FF	On-Demand	Anodyne	ADRA2B	16	40
COC(=O)[C@H](NC(=O)CCCC(=O)C1CC1)c1cc(C)cc(C)c1	ZINC000450942829	EF	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@@H](NC(=O)CCCC(=O)C1CC1)c1cc(C)cc(C)c1	ZINC000450942830	EF	On-Demand	Anodyne	HDA106	0	40
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450942834	DF	On-Demand	Anodyne	DRD2	30	44
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450942834	DF	On-Demand	Anodyne	DRD4	0	45
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450942834	DF	On-Demand	Anodyne	SLC18A3	0	45
COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450942834	DF	On-Demand	Anodyne	CYP2J2	50	35
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450942835	DF	On-Demand	Anodyne	DRD2	30	44
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450942835	DF	On-Demand	Anodyne	DRD4	0	45
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450942835	DF	On-Demand	Anodyne	SLC18A3	0	45
COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450942835	DF	On-Demand	Anodyne	CYP2J2	50	35
COc1ccc(N2CCN(c3ncc(Cl)cc3F)CC2)nc1	ZINC000450942859	DF	On-Demand	Anodyne	DRD4	27	40
COc1ccc(N2CCN(c3ncc(Cl)cc3F)CC2)nc1	ZINC000450942859	DF	On-Demand	Anodyne	NPBWR1	46	38
CNC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nn1	ZINC000450942862	EC	On-Demand	Anodyne	CASR	54	36
CCOc1cccc(CN(CCO)c2ncnc(CC)c2F)c1	ZINC000450942870	DF	On-Demand	Anodyne	CETP	0	41
CC[C@@H](N=c1cc(C)[nH]c(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)NC	ZINC000450942885	ED	On-Demand	Bother	GYRB	44	39
CCc1ccccc1NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450942886	FH	On-Demand	Anodyne	KCNQ2	45	32
CC[C@H](N=c1cc(C)[nH]c(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)NC	ZINC000450942887	ED	On-Demand	Bother	GYRB	44	39
CCc1ccccc1NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450942888	FH	On-Demand	Anodyne	KCNQ2	45	32
CCOc1cccc(CN(CCO)c2cc(C)nc(C(C)C)n2)c1	ZINC000450942890	EG	On-Demand	Anodyne	CETP	0	40
COc1ccc(N2CCN(c3nc(C4CC4)ns3)CC2)nc1	ZINC000450942901	DE	On-Demand	Anodyne	EBP	25	42
COc1ccc(N2CCN(c3nc(C4CC4)ns3)CC2)nc1	ZINC000450942901	DE	On-Demand	Anodyne	NPBWR1	40	35
COc1ccc(N2CCN(c3ncnc4nc(N)ccc34)CC2)nc1	ZINC000450942913	ED	On-Demand	Anodyne	PDE3B	40	33
C[C@@H]1C[C@@H](O)CN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450942918	EH	On-Demand	Anodyne	ADRB3	29	48
C[C@H]1C[C@H](O)CN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450942919	EH	On-Demand	Anodyne	ADRB3	29	48
C[C@H]1C[C@@H](O)CN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450942920	EH	On-Demand	Anodyne	ADRB3	29	48
CCO[C@@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450942933	GG	On-Demand	Bother	TBXA2R	24	42
COC[C@H]1CCCCN1c1ncnc2ccc(I)cc12	ZINC000450942934	GG	On-Demand	Anodyne	PDE3A	43	32
COC[C@H]1CCCCN1c1ncnc2ccc(I)cc12	ZINC000450942934	GG	On-Demand	Anodyne	PDE3B	63	33
COC[C@@H]1CCCCN1c1ncnc2ccc(I)cc12	ZINC000450942937	GG	On-Demand	Anodyne	PDE3A	43	32
COC[C@@H]1CCCCN1c1ncnc2ccc(I)cc12	ZINC000450942937	GG	On-Demand	Anodyne	PDE3B	63	33
COC[C@@H]1CCCN(c2cc([N+](=O)[O-])ccc2S(N)(=O)=O)CC1	ZINC000450942955	ED	On-Demand	Bother	CASP7	42	34
COC[C@H]1CCCN(c2cc([N+](=O)[O-])ccc2S(N)(=O)=O)CC1	ZINC000450942956	ED	On-Demand	Bother	CASP7	42	34
Cc1ccnc2[nH]c(SCC(=O)N[C@@H]3CCOc4ccccc43)nc12	ZINC000450942962	FF	On-Demand	Anodyne	ENPP1	42	33
Cc1ccnc2[nH]c(SCC(=O)N[C@H]3CCOc4ccccc43)nc12	ZINC000450942965	FF	On-Demand	Anodyne	ENPP1	42	33
CN(C)C(=O)c1cnc(N2CC[C@H](CC(C)(C)C)C2)c(Cl)c1	ZINC000450942969	DH	On-Demand	Anodyne	CXCR3	35	41
CN(C)C(=O)c1cnc(N2CC[C@H](CC(C)(C)C)C2)c(Cl)c1	ZINC000450942969	DH	On-Demand	Anodyne	CACNA1I	51	38
CN(C)C(=O)c1cnc(N2CC[C@@H](CC(C)(C)C)C2)c(Cl)c1	ZINC000450942970	DH	On-Demand	Anodyne	CXCR3	35	41
CN(C)C(=O)c1cnc(N2CC[C@@H](CC(C)(C)C)C2)c(Cl)c1	ZINC000450942970	DH	On-Demand	Anodyne	CACNA1I	51	38
COc1cc(CC(=O)N2CC[C@@H](C)c3cccc(O)c32)ccc1Cl	ZINC000450942991	EI	On-Demand	Anodyne	OPRK1	37	42
COc1cc(CC(=O)N2CC[C@H](C)c3cccc(O)c32)ccc1Cl	ZINC000450942992	EI	On-Demand	Anodyne	OPRK1	37	42
COc1cccc(NC(=O)CN(C)C(=O)CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450942997	GE	On-Demand	Anodyne	ENPP1	93	61
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1c1ccccc1	ZINC000450943020	FG	On-Demand	Anodyne	SLC6A1	34	44
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1c1ccccc1	ZINC000450943020	FG	On-Demand	Anodyne	PDE3A	46	36
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1c1ccccc1	ZINC000450943020	FG	On-Demand	Anodyne	PDGFRB	56	49
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@@H]1c1ccccc1	ZINC000450943020	FG	On-Demand	Anodyne	PDE3B	69	36
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450943023	FG	On-Demand	Anodyne	SLC6A1	34	44
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450943023	FG	On-Demand	Anodyne	PDE3A	46	36
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450943023	FG	On-Demand	Anodyne	PDGFRB	56	49
COC(=O)[C@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450943023	FG	On-Demand	Anodyne	PDE3B	69	36
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450943024	FG	On-Demand	Anodyne	SLC6A1	34	44
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450943024	FG	On-Demand	Anodyne	PDE3A	46	36
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450943024	FG	On-Demand	Anodyne	PDGFRB	56	49
COC(=O)[C@@H]1CN(c2ncnc3cc(F)c(F)cc23)C[C@H]1c1ccccc1	ZINC000450943024	FG	On-Demand	Anodyne	PDE3B	69	36
CC(=O)c1ccc(CN2CCC[C@](CO)(c3ccccc3)C2)cc1	ZINC000450943035	DG	On-Demand	Anodyne	FABP4	45	37
CC(=O)c1ccc(CN2CCC[C@](CO)(c3ccccc3)C2)cc1	ZINC000450943035	DG	On-Demand	Anodyne	NPFFR1	48	41
CC(=O)c1ccc(CN2CCC[C@](CO)(c3ccccc3)C2)cc1	ZINC000450943035	DG	On-Demand	Anodyne	SLC12A5	58	33
CC(=O)c1ccc(CN2CCC[C@@](CO)(c3ccccc3)C2)cc1	ZINC000450943037	DG	On-Demand	Anodyne	FABP4	45	37
CC(=O)c1ccc(CN2CCC[C@@](CO)(c3ccccc3)C2)cc1	ZINC000450943037	DG	On-Demand	Anodyne	NPFFR1	48	41
CC(=O)c1ccc(CN2CCC[C@@](CO)(c3ccccc3)C2)cc1	ZINC000450943037	DG	On-Demand	Anodyne	SLC12A5	58	33
COc1cc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943050	FH	On-Demand	Anodyne	DRD2	47	41
COc1cc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943050	FH	On-Demand	Anodyne	DRD3	22	42
COc1cc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943050	FH	On-Demand	Anodyne	HTR4	47	43
COc1cc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943050	FH	On-Demand	Anodyne	CCR3	42	55
COc1cc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943050	FH	On-Demand	Anodyne	MCHR1	29	49
COc1cc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943050	FH	On-Demand	Anodyne	CACNA1I	47	41
COc1cc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943053	FH	On-Demand	Anodyne	DRD2	47	41
COc1cc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943053	FH	On-Demand	Anodyne	DRD3	22	42
COc1cc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943053	FH	On-Demand	Anodyne	HTR4	47	43
COc1cc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943053	FH	On-Demand	Anodyne	CCR3	42	55
COc1cc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943053	FH	On-Demand	Anodyne	MCHR1	29	49
COc1cc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)ccc1Cl	ZINC000450943053	FH	On-Demand	Anodyne	CACNA1I	47	41
Nc1nc(N[C@@H]2CN(CC(F)(F)F)C[C@H]2c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450943055	GE	On-Demand	Bother	PRKCQ	47	38
CCO[C@@H]1CCCC[C@H]1Nc1ncnc2[nH]cnc12	ZINC000450943079	CE	On-Demand	Anodyne	AHK3	0	40
Cc1noc([C@@H]2CN(CCCOc3ccc(C(C)(C)C)cc3)CCN2C)n1	ZINC000450943092	FG	On-Demand	Anodyne	HRH3	57	47
Cc1noc([C@H]2CN(CCCOc3ccc(C(C)(C)C)cc3)CCN2C)n1	ZINC000450943094	FG	On-Demand	Anodyne	HRH3	57	47
COC(=O)[C@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)O1	ZINC000450943095	GC	On-Demand	Anodyne	MTNR1A	44	38
COc1cc2c(N(C)C3CCN(CC(F)(F)F)CC3)ncnc2cc1F	ZINC000450943101	FG	On-Demand	Anodyne	PDE3A	47	37
COc1cc2c(N(C)C3CCN(CC(F)(F)F)CC3)ncnc2cc1F	ZINC000450943101	FG	On-Demand	Anodyne	PDE3B	68	36
COC[C@@H]1CCCN(c2ncnc3sc4c(c23)CCC4)CC1	ZINC000450943117	DG	On-Demand	Anodyne	RBP4	20	49
COC[C@H]1CCCN(c2ncnc3sc4c(c23)CCC4)CC1	ZINC000450943118	DG	On-Demand	Anodyne	RBP4	20	49
CCO[C@@H]1CCC[C@H]1Nc1cc(CC)nc2ncnn12	ZINC000450943132	CE	On-Demand	Anodyne	DHOD	0	46
Cc1cccc([C@H](C)Nc2cc(N3CCCC3)ncn2)c1	ZINC000450943137	CH	On-Demand	Anodyne	PLK1	29	40
CCc1cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)nc(-c2ccncc2)n1	ZINC000450943138	GG	On-Demand	Anodyne	SLC6A3	17	41
CCc1cc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)nc(-c2ccncc2)n1	ZINC000450943138	GG	On-Demand	Anodyne	P2RY12	47	34
Cc1cccc([C@@H](C)Nc2cc(N3CCCC3)ncn2)c1	ZINC000450943140	CH	On-Demand	Anodyne	PLK1	29	40
CCc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)nc(-c2ccncc2)n1	ZINC000450943142	GG	On-Demand	Anodyne	SLC6A3	17	41
CCc1cc(N2C[C@@H](C(=O)OC)[C@H](c3ccccc3)C2)nc(-c2ccncc2)n1	ZINC000450943142	GG	On-Demand	Anodyne	P2RY12	47	34
CCc1cc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)nc(-c2ccncc2)n1	ZINC000450943145	GG	On-Demand	Anodyne	SLC6A3	17	41
CCc1cc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)nc(-c2ccncc2)n1	ZINC000450943145	GG	On-Demand	Anodyne	P2RY12	47	34
C[C@H](CCC1CC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450943146	DG	On-Demand	Anodyne	F7	30	41
C[C@@H](CCC1CC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450943147	DG	On-Demand	Anodyne	F7	30	41
COC(=O)[C@@H]1CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccccc1	ZINC000450943148	FH	On-Demand	Anodyne	SLC6A1	57	47
COC(=O)[C@@H]1CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccccc1	ZINC000450943148	FH	On-Demand	Anodyne	FAAH	0	48
COC(=O)[C@H]1CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccccc1	ZINC000450943150	FH	On-Demand	Anodyne	SLC6A1	57	47
COC(=O)[C@H]1CN(c2nc(-c3ccccc3)ns2)C[C@H]1c1ccccc1	ZINC000450943150	FH	On-Demand	Anodyne	FAAH	0	48
COC(=O)[C@H]1CN(c2nc(-c3ccccc3)ns2)C[C@@H]1c1ccccc1	ZINC000450943152	FH	On-Demand	Anodyne	SLC6A1	57	47
COC(=O)[C@H]1CN(c2nc(-c3ccccc3)ns2)C[C@@H]1c1ccccc1	ZINC000450943152	FH	On-Demand	Anodyne	FAAH	0	48
COC(=O)[C@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@@H]1c1ccccc1	ZINC000450943156	GH	On-Demand	Anodyne	SLC6A1	53	42
COC(=O)[C@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@@H]1c1ccccc1	ZINC000450943156	GH	On-Demand	Anodyne	SLC6A3	28	47
COC(=O)[C@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@H]1c1ccccc1	ZINC000450943158	GH	On-Demand	Anodyne	SLC6A1	53	42
COC(=O)[C@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@H]1c1ccccc1	ZINC000450943158	GH	On-Demand	Anodyne	SLC6A3	28	47
COC(=O)[C@@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@H]1c1ccccc1	ZINC000450943161	GH	On-Demand	Anodyne	SLC6A1	53	42
COC(=O)[C@@H]1CN(c2nc(C(F)F)nc3ccccc23)C[C@H]1c1ccccc1	ZINC000450943161	GH	On-Demand	Anodyne	SLC6A3	28	47
COC[C@H]1CCCCN1c1nc(C)cc(C)n1	ZINC000450943162	BE	On-Demand	Anodyne	CHRNA10	41	33
COC[C@@H]1CCCCN1c1nc(C)cc(C)n1	ZINC000450943163	BE	On-Demand	Anodyne	CHRNA10	41	33
CC(C)(C)C[C@@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450943169	EH	On-Demand	Anodyne	SIRT3	40	31
CC(C)(C)C[C@H]1CCN(c2ncccc2C(=O)N2CCCCC2)C1	ZINC000450943170	EH	On-Demand	Anodyne	SIRT3	40	31
COC(=O)[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)C[C@@H]1c1ccccc1	ZINC000450943173	FF	On-Demand	Bother	CACNA1C	44	37
COC(=O)[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)C[C@@H]1c1ccccc1	ZINC000450943173	FF	On-Demand	Bother	CACNA1D	71	37
COC(=O)[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)C[C@H]1c1ccccc1	ZINC000450943174	FF	On-Demand	Bother	CACNA1C	44	37
COC(=O)[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)C[C@H]1c1ccccc1	ZINC000450943174	FF	On-Demand	Bother	CACNA1D	71	37
COC(=O)[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)C[C@H]1c1ccccc1	ZINC000450943175	FF	On-Demand	Bother	CACNA1C	44	37
COC(=O)[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)C[C@H]1c1ccccc1	ZINC000450943175	FF	On-Demand	Bother	CACNA1D	71	37
COC(=O)[C@H]1CN(c2ncnc3ccc(C)cc23)C[C@@H]1c1ccccc1	ZINC000450943196	EG	On-Demand	Anodyne	SLC6A1	51	44
COC(=O)[C@H]1CN(c2ncnc3ccc(C)cc23)C[C@@H]1c1ccccc1	ZINC000450943196	EG	On-Demand	Anodyne	PDE3A	44	34
COC(=O)[C@H]1CN(c2ncnc3ccc(C)cc23)C[C@@H]1c1ccccc1	ZINC000450943196	EG	On-Demand	Anodyne	PDGFRB	41	50
COC(=O)[C@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccccc1	ZINC000450943198	EG	On-Demand	Anodyne	SLC6A1	51	44
COC(=O)[C@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccccc1	ZINC000450943198	EG	On-Demand	Anodyne	PDE3A	44	34
COC(=O)[C@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccccc1	ZINC000450943198	EG	On-Demand	Anodyne	PDGFRB	41	50
COC(=O)[C@@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccccc1	ZINC000450943199	EG	On-Demand	Anodyne	SLC6A1	51	44
COC(=O)[C@@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccccc1	ZINC000450943199	EG	On-Demand	Anodyne	PDE3A	44	34
COC(=O)[C@@H]1CN(c2ncnc3ccc(C)cc23)C[C@H]1c1ccccc1	ZINC000450943199	EG	On-Demand	Anodyne	PDGFRB	41	50
CCO[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000450943206	CE	On-Demand	Bother	SLC27A4	49	32
CCO[C@@H]1CCC[C@H]1Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450943217	DF	On-Demand	Anodyne	DHOD	0	47
Cc1ccc2ncnc(N3C[C@@H](C)C[C@@H](O)C3)c2c1	ZINC000450943233	CE	On-Demand	Anodyne	PDE3B	63	33
Cc1ccc2ncnc(N3C[C@@H](C)C[C@H](O)C3)c2c1	ZINC000450943234	CE	On-Demand	Anodyne	PDE3B	63	33
Cc1ccc2ncnc(N3C[C@H](C)C[C@@H](O)C3)c2c1	ZINC000450943235	CE	On-Demand	Anodyne	PDE3B	63	33
C[C@H]1C[C@H](O)CN(c2ncc(-c3ccccc3)s2)C1	ZINC000450943258	CG	On-Demand	Anodyne	LUCI_LUCLA	17	40
C[C@@H]1C[C@@H](O)CN(c2ncc(-c3ccccc3)s2)C1	ZINC000450943259	CG	On-Demand	Anodyne	LUCI_LUCLA	17	40
C[C@H]1C[C@@H](O)CN(c2ncc(-c3ccccc3)s2)C1	ZINC000450943260	CG	On-Demand	Anodyne	LUCI_LUCLA	17	40
CC[C@@H](Nc1ncnc2c1ncn2CC)C(=O)NC	ZINC000450943278	CC	On-Demand	Anodyne	P2RY1	0	42
CC[C@H](Nc1ncnc2c1ncn2CC)C(=O)NC	ZINC000450943279	CC	On-Demand	Anodyne	P2RY1	0	42
CC[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450943286	DC	On-Demand	Bother	BDKRB1	0	41
CC[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450943286	DC	On-Demand	Bother	COLA	70	34
CC[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450943287	DC	On-Demand	Bother	BDKRB1	0	41
CC[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450943287	DC	On-Demand	Bother	COLA	70	34
C[C@H]1C[C@@H](O)CN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450943301	ED	On-Demand	Anodyne	HSD11B1	0	42
C[C@H]1C[C@H](O)CN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450943302	ED	On-Demand	Anodyne	HSD11B1	0	42
C[C@@H]1C[C@@H](O)CN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)C1	ZINC000450943303	ED	On-Demand	Anodyne	HSD11B1	0	42
Cc1nn(C)c(C)c1NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450943347	EG	On-Demand	Anodyne	PPARD	43	36
CCNC(=O)C[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450943359	EG	On-Demand	Anodyne	DRD2	49	38
CCNC(=O)C[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450943359	EG	On-Demand	Anodyne	DRD4	0	44
CCNC(=O)C[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450943359	EG	On-Demand	Anodyne	HTR3B	0	41
CCNC(=O)C[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450943359	EG	On-Demand	Anodyne	CYP2J2	49	36
CCNC(=O)C[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450943360	EG	On-Demand	Anodyne	DRD2	49	38
CCNC(=O)C[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450943360	EG	On-Demand	Anodyne	DRD4	0	44
CCNC(=O)C[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450943360	EG	On-Demand	Anodyne	HTR3B	0	41
CCNC(=O)C[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450943360	EG	On-Demand	Anodyne	CYP2J2	49	36
COc1cc(N2CCN(C[C@H]3COCCO3)CC2)ccc1F	ZINC000450943364	DD	On-Demand	Anodyne	DRD4	15	40
COc1cc(N2CCN(C[C@@H]3COCCO3)CC2)ccc1F	ZINC000450943366	DD	On-Demand	Anodyne	DRD4	15	40
COc1cccc([C@@H]2[C@H](NC[C@@](C)(O)C(C)=O)CCN2C2CC2)c1	ZINC000450943369	ED	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H]2[C@@H](NC[C@@](C)(O)C(C)=O)CCN2C2CC2)c1	ZINC000450943371	ED	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H]2[C@@H](NC[C@](C)(O)C(C)=O)CCN2C2CC2)c1	ZINC000450943373	ED	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H]2[C@H](NC[C@](C)(O)C(C)=O)CCN2C2CC2)c1	ZINC000450943375	ED	On-Demand	Anodyne	DRD4	40	30
Cc1sc2ncnc(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c2c1C	ZINC000450943392	FE	On-Demand	Anodyne	LIMK2	74	39
CCO[C@@H]1CCCC[C@H]1Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450943400	GD	On-Demand	Anodyne	PDE5A	23	40
CCO[C@@H]1CCCC[C@H]1Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450943400	GD	On-Demand	Anodyne	TGM2	39	41
COC[C@H]1CCCCN1c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450943408	EE	On-Demand	Bother	CASP3	41	37
COC[C@H]1CCCCN1c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450943408	EE	On-Demand	Bother	CASP7	55	37
COC[C@@H]1CCCCN1c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450943409	EE	On-Demand	Bother	CASP3	41	37
COC[C@@H]1CCCCN1c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000450943409	EE	On-Demand	Bother	CASP7	55	37
Fc1ccc2c(c1)CCN2C1CCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450943418	FH	On-Demand	Anodyne	SCD	24	40
C[C@@H](O)CCSCc1ccc2c(c1)OCO2	ZINC000450943420	BE	On-Demand	Anodyne	BMP1	26	40
C[C@@H](O)CCSCc1ccc2c(c1)OCO2	ZINC000450943420	BE	On-Demand	Anodyne	SSTR3	97	33
C[C@H](O)CCSCc1ccc2c(c1)OCO2	ZINC000450943424	BE	On-Demand	Anodyne	BMP1	26	40
C[C@H](O)CCSCc1ccc2c(c1)OCO2	ZINC000450943424	BE	On-Demand	Anodyne	SSTR3	97	33
COC(=O)C1(CN2CCC[C@H](CNC(=O)c3ccco3)C2)CC1	ZINC000450943427	DD	On-Demand	Anodyne	DRD3	0	41
COC(=O)C1(CN2CCC[C@H](CNC(=O)c3ccco3)C2)CC1	ZINC000450943427	DD	On-Demand	Anodyne	CACNA1I	40	31
COC(=O)C1(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)CC1	ZINC000450943429	DD	On-Demand	Anodyne	DRD3	0	41
COC(=O)C1(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)CC1	ZINC000450943429	DD	On-Demand	Anodyne	CACNA1I	40	31
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	HTR1A	25	48
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	DRD2	26	50
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	DRD1	17	50
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	DRD4	43	33
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	ACHE	15	40
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	HTR2A	18	49
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	DRD3	27	42
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	DRD5	24	50
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	KCNQ1	0	40
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	HTR7	29	48
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	SIGMAR1	29	40
COc1ccc2c(c1)OCCN(CCCC(=O)c1ccccc1)C2	ZINC000450943437	EH	On-Demand	Anodyne	CYP2J2	56	39
COC(=O)[C@H]1CN(c2nc(C(C)(C)C)ns2)C[C@H]1c1ccccc1	ZINC000450943439	EG	On-Demand	Anodyne	SLC6A1	40	41
Cc1cccc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)n1	ZINC000450943441	CD	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)[C@H]1CN(c2nc(C(C)(C)C)ns2)C[C@@H]1c1ccccc1	ZINC000450943442	EG	On-Demand	Anodyne	SLC6A1	40	41
COC(=O)[C@@H]1CN(c2nc(C(C)(C)C)ns2)C[C@H]1c1ccccc1	ZINC000450943444	EG	On-Demand	Anodyne	SLC6A1	40	41
COC[C@@H]1CCCCN1c1ncnc2cc(F)c(F)cc12	ZINC000450943445	CF	On-Demand	Anodyne	PDE3A	44	33
COC[C@H]1CCCCN1c1ncnc2cc(F)c(F)cc12	ZINC000450943447	CF	On-Demand	Anodyne	PDE3A	44	33
N#C[C@@H](CCc1ccccc1)C(=O)NCC(F)(F)CO	ZINC000450943454	CD	On-Demand	Mild	SDH1	0	44
N#C[C@@H](CCc1ccccc1)C(=O)NCC(F)(F)CO	ZINC000450943454	CD	On-Demand	Mild	CTSC	23	41
COCCOC[C@H](O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450943458	DE	On-Demand	Anodyne	SLC18A3	34	57
COCCOC[C@H](O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450943458	DE	On-Demand	Anodyne	Q8WSF8_APLCA	22	40
N#C[C@H](CCc1ccccc1)C(=O)NCC(F)(F)CO	ZINC000450943459	CD	On-Demand	Mild	SDH1	0	44
N#C[C@H](CCc1ccccc1)C(=O)NCC(F)(F)CO	ZINC000450943459	CD	On-Demand	Mild	CTSC	23	41
COCCOC[C@@H](O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450943461	DE	On-Demand	Anodyne	SLC18A3	34	57
COCCOC[C@@H](O)CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2	ZINC000450943461	DE	On-Demand	Anodyne	Q8WSF8_APLCA	22	40
C[C@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)CCN1C(=O)c1cnn(C)c1	ZINC000450943466	GF	On-Demand	Mild	AR	20	43
COC[C@@H]1CCCCN1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450943476	DF	On-Demand	Anodyne	LRRK2	0	42
COC[C@H]1CCCCN1c1ccc2nnc(-c3ccccc3)n2n1	ZINC000450943478	DF	On-Demand	Anodyne	LRRK2	0	42
CCc1cc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)ncnc2s1	ZINC000450943510	FE	On-Demand	Anodyne	LIMK2	61	35
C[C@@H](CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2)S(C)(=O)=O	ZINC000450943513	DF	On-Demand	Anodyne	SLC18A3	36	60
C[C@H](CN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2)S(C)(=O)=O	ZINC000450943515	DF	On-Demand	Anodyne	SLC18A3	36	60
CN(c1cc(-c2ccccc2)nc2ncnn12)C1CCN(CC(F)(F)F)CC1	ZINC000450943548	GG	On-Demand	Anodyne	HPGDS	33	42
COc1ccc(N2CCN(c3nnc(C4CC4)s3)CC2)nc1	ZINC000450943555	DE	On-Demand	Anodyne	EBP	23	41
COc1ccc(N2CCN(c3ncc(C(F)(F)F)s3)CC2)nc1	ZINC000450943558	EF	On-Demand	Anodyne	MLYCD	67	43
CCc1cc(CCCN2CCN(c3ccc(F)c(OC)c3)CC2)on1	ZINC000450943567	EG	On-Demand	Anodyne	DRD2	30	49
CCc1cc(CCCN2CCN(c3ccc(F)c(OC)c3)CC2)on1	ZINC000450943567	EG	On-Demand	Anodyne	DRD4	26	49
CCc1cc(CCCN2CCN(c3ccc(F)c(OC)c3)CC2)on1	ZINC000450943567	EG	On-Demand	Anodyne	DRD3	31	49
Cc1cccc(OCCCNC(=O)CSc2nc3c(C)ccnc3[nH]2)c1	ZINC000450943570	FG	On-Demand	Anodyne	ENPP1	65	54
COC(=O)c1cccc(CN2CCC[C@](CO)(c3ccccc3)C2)c1Cl	ZINC000450943580	FH	On-Demand	Anodyne	ACAT	0	40
COC(=O)c1cccc(CN2CCC[C@@](CO)(c3ccccc3)C2)c1Cl	ZINC000450943581	FH	On-Demand	Anodyne	ACAT	0	40
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1CC1CCC(=O)CC1	ZINC000450943592	ED	On-Demand	Anodyne	Q8AWE3_CHICK	17	40
COC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450943596	DE	On-Demand	Anodyne	AKT2	45	45
COC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450943596	DE	On-Demand	Anodyne	AKT3	36	43
COC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)C[C@@H]1c1ccccc1	ZINC000450943596	DE	On-Demand	Anodyne	AKT1	26	40
COC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450943597	DE	On-Demand	Anodyne	AKT2	45	45
COC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450943597	DE	On-Demand	Anodyne	AKT3	36	43
COC(=O)[C@H]1CN(c2ncnc3[nH]ccc23)C[C@H]1c1ccccc1	ZINC000450943597	DE	On-Demand	Anodyne	AKT1	26	40
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943617	EG	On-Demand	Anodyne	SLC6A1	80	41
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943617	EG	On-Demand	Anodyne	SLC6A3	32	41
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943617	EG	On-Demand	Anodyne	CACNA1D	40	39
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943618	EG	On-Demand	Anodyne	SLC6A1	80	41
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943618	EG	On-Demand	Anodyne	SLC6A3	32	41
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943618	EG	On-Demand	Anodyne	CACNA1D	40	39
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943619	EG	On-Demand	Anodyne	SLC6A1	80	41
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943619	EG	On-Demand	Anodyne	SLC6A3	32	41
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943619	EG	On-Demand	Anodyne	CACNA1D	40	39
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943620	EG	On-Demand	Anodyne	SLC6A1	80	41
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943620	EG	On-Demand	Anodyne	SLC6A3	32	41
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2CCc2ccc(Cl)cc2)O1	ZINC000450943620	EG	On-Demand	Anodyne	CACNA1D	40	39
COC[C@@H]1CCCN(c2ccnc(C(C)C)n2)CC1	ZINC000450943637	CF	On-Demand	Anodyne	SORD	68	38
COC[C@H]1CCCN(c2ccnc(C(C)C)n2)CC1	ZINC000450943638	CF	On-Demand	Anodyne	SORD	68	38
NC(=O)[C@H]1CCO[C@@H]1C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450943642	EE	On-Demand	Anodyne	SIGMAR1	18	46
CCS(=O)(=O)Cc1ccc(Nc2nc(C(F)(F)F)cs2)cc1	ZINC000450943651	FH	On-Demand	Anodyne	SPHK2	46	34
CCS(=O)(=O)Cc1ccc(Nc2nc(C(F)(F)F)cs2)cc1	ZINC000450943651	FH	On-Demand	Anodyne	SPHK1	46	33
COC[C@@H]1CCCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1	ZINC000450943656	FG	On-Demand	Anodyne	MMP13	18	41
COC[C@@H]1CCCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1	ZINC000450943656	FG	On-Demand	Anodyne	ALK	18	44
COC[C@H]1CCCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1	ZINC000450943657	FG	On-Demand	Anodyne	MMP13	18	41
COC[C@H]1CCCN(c2ccnc(C(=O)NCc3ccccc3)c2)CC1	ZINC000450943657	FG	On-Demand	Anodyne	ALK	18	44
COC[C@@H]1CCCN(c2ccc3ccc(Cl)cc3n2)CC1	ZINC000450943658	DI	On-Demand	Anodyne	HRH4	15	47
COC[C@@H]1CCCN(c2ccc3ccc(Cl)cc3n2)CC1	ZINC000450943658	DI	On-Demand	Anodyne	CCR4	22	42
COC[C@H]1CCCN(c2ccc3ccc(Cl)cc3n2)CC1	ZINC000450943659	DI	On-Demand	Anodyne	HRH4	15	47
COC[C@H]1CCCN(c2ccc3ccc(Cl)cc3n2)CC1	ZINC000450943659	DI	On-Demand	Anodyne	CCR4	22	42
Cc1nnc2c3ccccc3c(N3CC[C@@H](CC(C)(C)C)C3)nn12	ZINC000450943669	DH	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3CC[C@@H](CC(C)(C)C)C3)nn12	ZINC000450943669	DH	On-Demand	Anodyne	BRD9	55	34
Cc1nnc2c3ccccc3c(N3CC[C@H](CC(C)(C)C)C3)nn12	ZINC000450943670	DH	On-Demand	Anodyne	CREBBP	43	34
Cc1nnc2c3ccccc3c(N3CC[C@H](CC(C)(C)C)C3)nn12	ZINC000450943670	DH	On-Demand	Anodyne	BRD9	55	34
CNS(=O)(=O)c1ccc(N[C@H](C)c2cccc(C)c2)nc1	ZINC000450943681	DE	On-Demand	Anodyne	PLK1	27	41
CNS(=O)(=O)c1ccc(N[C@@H](C)c2cccc(C)c2)nc1	ZINC000450943682	DE	On-Demand	Anodyne	PLK1	27	41
O=C([C@@H](O)C1CCC1)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450943691	DG	On-Demand	Anodyne	SRD5A2	0	48
O=C([C@H](O)C1CCC1)N1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000450943692	DG	On-Demand	Anodyne	SRD5A2	0	48
NC(=O)C[C@@H]1COCCN1c1ncnc2cc(-c3ccc(Cl)cc3)sc12	ZINC000450943693	GG	On-Demand	Anodyne	MCHR1	31	41
NC(=O)C[C@@H]1COCCN1c1ncnc2cc(-c3ccc(Cl)cc3)sc12	ZINC000450943693	GG	On-Demand	Anodyne	SIRT3	83	38
NC(=O)C[C@@H]1COCCN1c1ncnc2cc(-c3ccc(Cl)cc3)sc12	ZINC000450943693	GG	On-Demand	Anodyne	SIRT2	71	37
NC(=O)C[C@@H]1COCCN1c1ncnc2cc(-c3ccc(Cl)cc3)sc12	ZINC000450943693	GG	On-Demand	Anodyne	SIRT1	63	37
NC(=O)C[C@H]1COCCN1c1ncnc2cc(-c3ccc(Cl)cc3)sc12	ZINC000450943694	GG	On-Demand	Anodyne	MCHR1	31	41
NC(=O)C[C@H]1COCCN1c1ncnc2cc(-c3ccc(Cl)cc3)sc12	ZINC000450943694	GG	On-Demand	Anodyne	SIRT3	83	38
NC(=O)C[C@H]1COCCN1c1ncnc2cc(-c3ccc(Cl)cc3)sc12	ZINC000450943694	GG	On-Demand	Anodyne	SIRT2	71	37
NC(=O)C[C@H]1COCCN1c1ncnc2cc(-c3ccc(Cl)cc3)sc12	ZINC000450943694	GG	On-Demand	Anodyne	SIRT1	63	37
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1	ZINC000450943704	FE	On-Demand	Bother	CASP3	62	40
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1	ZINC000450943704	FE	On-Demand	Bother	CASP7	69	40
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1	ZINC000450943705	FE	On-Demand	Bother	CASP3	62	40
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N(C)C)cc2[N+](=O)[O-])CC1	ZINC000450943705	FE	On-Demand	Bother	CASP7	69	40
Cc1cccc([C@H](C)Nc2cncc(-n3nc(C)cc3C)n2)c1	ZINC000450943713	DH	On-Demand	Anodyne	PLK1	0	43
Cc1cccc([C@@H](C)Nc2cncc(-n3nc(C)cc3C)n2)c1	ZINC000450943714	DH	On-Demand	Anodyne	PLK1	0	43
CC[C@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)C(=O)NC	ZINC000450943726	EE	On-Demand	Anodyne	AVPR2	50	43
CC[C@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)C(=O)NC	ZINC000450943726	EE	On-Demand	Anodyne	AVPR1A	41	43
CC[C@@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)C(=O)NC	ZINC000450943727	EE	On-Demand	Anodyne	AVPR2	50	43
CC[C@@H](Nc1ccc(C(=O)N2CCc3ccccc32)cn1)C(=O)NC	ZINC000450943727	EE	On-Demand	Anodyne	AVPR1A	41	43
C[C@H]1C[C@@H](O)CN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450943739	CE	On-Demand	Anodyne	SORD	66	42
C[C@H]1C[C@H](O)CN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450943740	CE	On-Demand	Anodyne	SORD	66	42
C[C@@H]1C[C@@H](O)CN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450943741	CE	On-Demand	Anodyne	SORD	66	42
C[C@H]1C[C@@H](O)CN(c2cc(NCC3CC3)ncn2)C1	ZINC000450943758	CD	On-Demand	Anodyne	GPR39	0	40
C[C@H]1C[C@H](O)CN(c2cc(NCC3CC3)ncn2)C1	ZINC000450943759	CD	On-Demand	Anodyne	GPR39	0	40
C[C@@H]1C[C@@H](O)CN(c2cc(NCC3CC3)ncn2)C1	ZINC000450943760	CD	On-Demand	Anodyne	GPR39	0	40
C[C@H]1C[C@H](O)CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450943777	DD	On-Demand	Bother	TAAR1	16	41
C[C@H]1C[C@@H](O)CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450943778	DD	On-Demand	Bother	TAAR1	16	41
C[C@@H]1C[C@@H](O)CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1	ZINC000450943779	DD	On-Demand	Bother	TAAR1	16	41
CC[C@@H](Nc1ncc(-c2ccccc2)s1)C(=O)NC	ZINC000450943786	CF	On-Demand	Anodyne	FABK	0	45
CC[C@H](Nc1ncc(-c2ccccc2)s1)C(=O)NC	ZINC000450943787	CF	On-Demand	Anodyne	FABK	0	45
Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450943817	FG	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450943817	FG	On-Demand	Bother	TAAR1	37	51
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450943818	FG	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450943818	FG	On-Demand	Bother	TAAR1	37	51
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450943819	FG	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](O)C3)c([N+](=O)[O-])c2)cc1	ZINC000450943819	FG	On-Demand	Bother	TAAR1	37	51
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1ccc(C)c(C)c1	ZINC000450943822	GG	On-Demand	Anodyne	PDE4D	16	44
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1ccc(C)c(C)c1	ZINC000450943822	GG	On-Demand	Anodyne	PDEC	0	44
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1ccc(C)c(C)c1	ZINC000450943823	GG	On-Demand	Anodyne	PDE4D	16	44
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@@H]1CCOC1)c1ccc(C)c(C)c1	ZINC000450943823	GG	On-Demand	Anodyne	PDEC	0	44
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1ccc(C)c(C)c1	ZINC000450943824	GG	On-Demand	Anodyne	PDE4D	16	44
COC(=O)[C@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1ccc(C)c(C)c1	ZINC000450943824	GG	On-Demand	Anodyne	PDEC	0	44
CN(c1nc2ccccc2o1)C1CCN(CC(F)(F)F)CC1	ZINC000450943828	DG	On-Demand	Anodyne	SSTR5	28	41
COc1ccc(N2CCN(c3nc(C(F)F)nc4ccccc34)CC2)nc1	ZINC000450943833	FG	On-Demand	Anodyne	SORD	40	39
COc1ccc(N2CCN(c3nc(C(F)F)nc4ccccc34)CC2)nc1	ZINC000450943833	FG	On-Demand	Anodyne	SMO	24	40
CO[C@@H](Cc1ccccc1)CN1CCCCC[C@@H]1CCO	ZINC000450943839	CF	On-Demand	Anodyne	SLC18A2	92	43
CO[C@H](Cc1ccccc1)CN1CCCCC[C@@H]1CCO	ZINC000450943841	CF	On-Demand	Anodyne	SLC18A2	92	43
CO[C@@H](Cc1ccccc1)CN1CCCCC[C@H]1CCO	ZINC000450943843	CF	On-Demand	Anodyne	SLC18A2	92	43
CO[C@H](Cc1ccccc1)CN1CCCCC[C@H]1CCO	ZINC000450943845	CF	On-Demand	Anodyne	SLC18A2	92	43
O=C(CN1CCC(F)(c2ccccn2)CC1)NCCCN1CCCC1=O	ZINC000450943846	FD	On-Demand	Anodyne	TYRO3	26	43
O=C(CCCN(Cc1ccc(-n2cncn2)cc1)C1CC1)c1ccccc1	ZINC000450943848	FH	On-Demand	Anodyne	CYP2J2	44	32
COc1ccc(N2CCN(c3ncnc4c(C)cccc34)CC2)nc1	ZINC000450943854	EF	On-Demand	Anodyne	PDE3B	57	33
COc1ccc(N2CCN(c3cc(OC)ccc3[N+](=O)[O-])CC2)nc1	ZINC000450943856	EE	On-Demand	Bother	TAAR1	18	40
COc1ccc(N2CCN(c3ccc(Cl)cc3C#N)CC2)nc1	ZINC000450943869	EF	On-Demand	Mild	PAK1	47	36
COc1ccc(N2CCN(c3ccc(Cl)cc3C#N)CC2)nc1	ZINC000450943869	EF	On-Demand	Mild	SMO	0	40
COc1ccccc1COC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450943870	FF	On-Demand	Anodyne	ADRB2	26	40
COc1ccccc1COC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450943870	FF	On-Demand	Anodyne	HSP90AB1	34	41
COc1ccccc1COC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450943872	FF	On-Demand	Anodyne	ADRB2	26	40
COc1ccccc1COC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450943872	FF	On-Demand	Anodyne	HSP90AB1	34	41
Cc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)ncc1Br	ZINC000450943873	GE	On-Demand	Anodyne	SLC6A7	0	43
CCOc1cccc(CN(CCO)c2cnc3cc(F)c(F)cc3n2)c1	ZINC000450943882	FG	On-Demand	Anodyne	CETP	0	42
c1ccc([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2nnc(C3CC3)s2)cc1	ZINC000450943909	EI	On-Demand	Anodyne	SLC18A3	26	47
C[C@H]1CN(c2ccnc3ccc(Cl)cc23)CCN1C(=O)c1cnn(C)c1	ZINC000450943911	FF	On-Demand	Anodyne	SLC6A7	0	49
C[C@H]1CN(c2ccnc(C#N)c2)CCN1C(=O)c1cnn(C)c1	ZINC000450943915	DD	On-Demand	Mild	SLC6A7	0	43
COc1ccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1OC	ZINC000450943919	GF	On-Demand	Anodyne	DRD4	19	41
COc1ccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1OC	ZINC000450943919	GF	On-Demand	Anodyne	HCRTR1	28	52
COc1ccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1OC	ZINC000450943919	GF	On-Demand	Anodyne	HCRTR2	29	48
COc1ccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1OC	ZINC000450943919	GF	On-Demand	Anodyne	MCHR2	42	36
COc1ccc(CNC(=O)CN2CCC(F)(c3ccccn3)CC2)cc1OC	ZINC000450943919	GF	On-Demand	Anodyne	DRTS_TRYCR	44	30
N#Cc1ccc(N(CCN2CCOCC2)Cc2ccco2)cc1Cl	ZINC000450943920	EG	On-Demand	Mild	PGR	31	44
N#Cc1ccc(N(CCN2CCOCC2)Cc2ccco2)cc1Cl	ZINC000450943920	EG	On-Demand	Mild	CYP2C19	27	40
COC1(c2nc(-c3ccccn3)no2)CCN([C@@H](C)CC(C)C)CC1	ZINC000450943921	EH	On-Demand	Anodyne	LUCI_PHOPE	23	42
COC1(c2nc(-c3ccccn3)no2)CCN([C@H](C)CC(C)C)CC1	ZINC000450943922	EH	On-Demand	Anodyne	LUCI_PHOPE	23	42
C[C@H]1CN(c2ncc(Cl)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450943927	FE	On-Demand	Anodyne	CXCR3	29	41
C[C@H]1CN(c2ncc(Cl)cc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450943927	FE	On-Demand	Anodyne	SLC6A7	0	48
COc1cc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943938	FG	On-Demand	Anodyne	HTR1A	23	41
COc1cc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943938	FG	On-Demand	Anodyne	DRD2	18	42
COc1cc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943938	FG	On-Demand	Anodyne	DRD1	0	41
COc1cc(N2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943938	FG	On-Demand	Anodyne	SLC6A4	15	41
COc1cc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943939	FG	On-Demand	Anodyne	HTR1A	23	41
COc1cc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943939	FG	On-Demand	Anodyne	DRD2	18	42
COc1cc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943939	FG	On-Demand	Anodyne	DRD1	0	41
COc1cc(N2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943939	FG	On-Demand	Anodyne	SLC6A4	15	41
COc1cc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943940	FG	On-Demand	Anodyne	HTR1A	23	41
COc1cc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943940	FG	On-Demand	Anodyne	DRD2	18	42
COc1cc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943940	FG	On-Demand	Anodyne	DRD1	0	41
COc1cc(N2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943940	FG	On-Demand	Anodyne	SLC6A4	15	41
COc1cc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943941	FG	On-Demand	Anodyne	HTR1A	23	41
COc1cc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943941	FG	On-Demand	Anodyne	DRD2	18	42
COc1cc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943941	FG	On-Demand	Anodyne	DRD1	0	41
COc1cc(N2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)ccc1F	ZINC000450943941	FG	On-Demand	Anodyne	SLC6A4	15	41
Cc1ccnc2[nH]c(S[C@H](C)C(=O)NCCc3ccccc3)nc12	ZINC000450943951	EG	On-Demand	Anodyne	AMP1_PLAFQ	26	40
Cc1ccnc2[nH]c(S[C@@H](C)C(=O)NCCc3ccccc3)nc12	ZINC000450943952	EG	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450943953	GF	On-Demand	Bother	TAAR1	18	40
CCO[C@@H]1CCCC[C@H]1Nc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-]	ZINC000450943954	GF	On-Demand	Bother	TAAR1	18	40
CCO[C@@H]1CCCC[C@H]1Nc1cc(-c2ccccc2)nc2ncnn12	ZINC000450943955	EH	On-Demand	Anodyne	DHOD	0	41
CCO[C@@H]1CCCC[C@H]1Nc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450943960	FF	On-Demand	Anodyne	TGM2	35	41
CCc1cc2nncn2c(SCc2nc(-c3ccc(OC)nn3)no2)n1	ZINC000450943961	FD	On-Demand	Anodyne	AXIN2	0	41
Clc1ccc(CCN2CCC[C@@H]2[C@@H]2CCCO2)cc1	ZINC000450943982	CH	On-Demand	Anodyne	HRH3	26	46
Clc1ccc(CCN2CCC[C@H]2[C@@H]2CCCO2)cc1	ZINC000450943984	CH	On-Demand	Anodyne	HRH3	26	46
Clc1ccc(CCN2CCC[C@@H]2[C@H]2CCCO2)cc1	ZINC000450943986	CH	On-Demand	Anodyne	HRH3	26	46
Clc1ccc(CCN2CCC[C@H]2[C@H]2CCCO2)cc1	ZINC000450943988	CH	On-Demand	Anodyne	HRH3	26	46
Cc1cc(F)cc2c(N3CCN(C(=O)c4cnn(C)c4)[C@@H](C)C3)c(C#N)cnc12	ZINC000450944000	GF	On-Demand	Mild	LIMK2	42	31
COc1ccc(N2CCN(c3ccc(C(=O)Nc4nncs4)cn3)CC2)nc1	ZINC000450944005	GD	On-Demand	Anodyne	HDAC1	32	46
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450944014	EH	On-Demand	Anodyne	HDAC1	24	42
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450944014	EH	On-Demand	Anodyne	SMO	0	42
C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450944014	EH	On-Demand	Anodyne	SLC12A5	75	41
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450944021	EH	On-Demand	Anodyne	HDAC1	24	42
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450944021	EH	On-Demand	Anodyne	SMO	0	42
C[C@]1(Cc2ccccc2)CCCN1C(=O)c1ccc(N2CCC2)nc1	ZINC000450944021	EH	On-Demand	Anodyne	SLC12A5	75	41
COC(=O)C1(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)CC1	ZINC000450944027	CG	On-Demand	Anodyne	SLC6A1	56	39
CC1(C)CN(Cc2ccccc2)CC[C@H]1NCC1(C#N)CCC1	ZINC000450944036	DH	On-Demand	Mild	ACHE	17	40
CC1(C)CN(Cc2ccccc2)CC[C@H]1NCC1(C#N)CCC1	ZINC000450944036	DH	On-Demand	Mild	SIGMAR1	47	41
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NCC1(C#N)CCC1	ZINC000450944037	DH	On-Demand	Mild	ACHE	17	40
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NCC1(C#N)CCC1	ZINC000450944037	DH	On-Demand	Mild	SIGMAR1	47	41
COc1ccc(N2CCN(c3ncccc3C(F)(F)F)CC2)nc1	ZINC000450944039	EF	On-Demand	Anodyne	TRPV1	34	52
CCOC(=O)c1cc(C(=O)N2CC[C@@H](Nc3ccc4nccn4n3)C2)on1	ZINC000450944046	FC	On-Demand	Anodyne	SSTR5	42	34
COc1ccc(N2CCN(c3ccc4cc([N+](=O)[O-])ccc4n3)CC2)nc1	ZINC000450944047	FF	On-Demand	Bother	SLC6A4	15	50
CCOC(=O)c1cc(C(=O)N2CC[C@H](Nc3ccc4nccn4n3)C2)on1	ZINC000450944048	FC	On-Demand	Anodyne	SSTR5	42	34
COc1ccc(N2CCN(c3ncnc4c3oc3ccccc34)CC2)nc1	ZINC000450944052	FG	On-Demand	Anodyne	HRH4	18	65
CCO[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450944056	EE	On-Demand	Bother	TBXA2R	25	42
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944061	FH	On-Demand	Anodyne	DRD2	30	40
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944061	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944061	FH	On-Demand	Anodyne	SLC6A1	68	34
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944061	FH	On-Demand	Anodyne	CCR3	74	38
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944061	FH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944061	FH	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944061	FH	On-Demand	Anodyne	CYP2J2	53	37
O=C(CCCN1CCC[C@@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944061	FH	On-Demand	Anodyne	AP2S1	0	40
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944062	FH	On-Demand	Anodyne	DRD2	30	40
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944062	FH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944062	FH	On-Demand	Anodyne	SLC6A1	68	34
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944062	FH	On-Demand	Anodyne	CCR3	74	38
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944062	FH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944062	FH	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944062	FH	On-Demand	Anodyne	CYP2J2	53	37
O=C(CCCN1CCC[C@H](CNC(=O)c2ccco2)C1)c1ccc(F)cc1	ZINC000450944062	FH	On-Demand	Anodyne	AP2S1	0	40
O=C(COc1ccc(C(F)(F)F)cc1F)NC(=O)NC1CC1	ZINC000450944063	DE	On-Demand	Anodyne	EPHX2	48	39
O=C(COc1ccc(C(F)(F)F)cc1F)NC(=O)NC1CC1	ZINC000450944063	DE	On-Demand	Anodyne	LUXN	0	41
CNC(=O)N[C@@H]1CCN(C(=O)Cc2cc3ccccc3s2)C1	ZINC000450944085	DD	On-Demand	Anodyne	EPHX2	24	42
CNC(=O)N[C@@H]1CCN(C(=O)Cc2cc3ccccc3s2)C1	ZINC000450944085	DD	On-Demand	Anodyne	BIRC2	25	41
CNC(=O)N[C@H]1CCN(C(=O)Cc2cc3ccccc3s2)C1	ZINC000450944086	DD	On-Demand	Anodyne	EPHX2	24	42
CNC(=O)N[C@H]1CCN(C(=O)Cc2cc3ccccc3s2)C1	ZINC000450944086	DD	On-Demand	Anodyne	BIRC2	25	41
CC(=O)[C@](C)(O)CN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450944090	DD	On-Demand	Anodyne	SCD	30	42
CC(=O)[C@@](C)(O)CN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450944092	DD	On-Demand	Anodyne	SCD	30	42
COC[C@H]1CCCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450944094	DG	On-Demand	Anodyne	RBP4	17	41
COC[C@@H]1CCCCN1c1ncnc2sc3c(c12)CCC3	ZINC000450944096	DG	On-Demand	Anodyne	RBP4	17	41
COc1cccc(CN(C)C[C@](C)(O)C(C)=O)c1OCc1ccccc1F	ZINC000450944098	GG	On-Demand	Anodyne	TSPO	40	33
COc1cccc(CN(C)C[C@@](C)(O)C(C)=O)c1OCc1ccccc1F	ZINC000450944099	GG	On-Demand	Anodyne	TSPO	40	33
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1ccc(C)c(C)c1	ZINC000450944105	GG	On-Demand	Anodyne	PDE4D	16	44
COC(=O)[C@@H](NC(=O)Cc1ccccc1O[C@H]1CCOC1)c1ccc(C)c(C)c1	ZINC000450944105	GG	On-Demand	Anodyne	PDEC	0	44
CC(C)c1noc(-c2ccnc(N3C[C@@H](C)C[C@H](O)C3)c2)n1	ZINC000450944108	DE	On-Demand	Anodyne	SORD	48	34
CC(C)c1noc(-c2ccnc(N3C[C@H](C)C[C@@H](O)C3)c2)n1	ZINC000450944109	DE	On-Demand	Anodyne	SORD	48	34
CC(C)c1noc(-c2ccnc(N3C[C@@H](O)C[C@@H](C)C3)c2)n1	ZINC000450944110	DE	On-Demand	Anodyne	SORD	48	34
CCS(=O)(=O)c1ccc(CN(Cc2ccccc2)CC2(CO)CC2)cc1	ZINC000450944160	FG	On-Demand	Anodyne	RORC	32	50
C[C@H]1C[C@H](O)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450944173	CD	On-Demand	Anodyne	P2RY12	26	40
C[C@H]1C[C@H](O)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450944173	CD	On-Demand	Anodyne	CXCR3	32	49
C[C@H]1C[C@@H](O)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450944174	CD	On-Demand	Anodyne	P2RY12	26	40
C[C@H]1C[C@@H](O)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450944174	CD	On-Demand	Anodyne	CXCR3	32	49
C[C@@H]1C[C@@H](O)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450944175	CD	On-Demand	Anodyne	P2RY12	26	40
C[C@@H]1C[C@@H](O)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450944175	CD	On-Demand	Anodyne	CXCR3	32	49
CCOC(=O)c1cc(N2CCC[C@@H](COC)CC2)ncc1Cl	ZINC000450944176	EG	On-Demand	Anodyne	HTR4	42	36
CCOC(=O)c1cc(N2CCC[C@H](COC)CC2)ncc1Cl	ZINC000450944177	EG	On-Demand	Anodyne	HTR4	42	36
CCCNC(=O)c1ccc(N[C@@H](C)c2cccc(C)c2)nc1	ZINC000450944178	CH	On-Demand	Anodyne	PLK1	27	40
CCCNC(=O)c1ccc(N[C@H](C)c2cccc(C)c2)nc1	ZINC000450944180	CH	On-Demand	Anodyne	PLK1	27	40
COCCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450944191	DF	On-Demand	Anodyne	DRD4	40	30
COCCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450944191	DF	On-Demand	Anodyne	HDAC1	22	41
COCCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450944191	DF	On-Demand	Anodyne	CACNA1I	50	39
COCCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450944191	DF	On-Demand	Anodyne	SIRT3	52	33
COCCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450944191	DF	On-Demand	Anodyne	SIRT2	52	33
COCCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450944191	DF	On-Demand	Anodyne	SIRT1	52	33
COCCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450944191	DF	On-Demand	Anodyne	HPGDS	30	42
COCCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450944194	DF	On-Demand	Anodyne	DRD4	40	30
COCCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450944194	DF	On-Demand	Anodyne	HDAC1	22	41
COCCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450944194	DF	On-Demand	Anodyne	CACNA1I	50	39
COCCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450944194	DF	On-Demand	Anodyne	SIRT3	52	33
COCCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450944194	DF	On-Demand	Anodyne	SIRT2	52	33
COCCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450944194	DF	On-Demand	Anodyne	SIRT1	52	33
COCCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450944194	DF	On-Demand	Anodyne	HPGDS	30	42
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944222	CD	On-Demand	Anodyne	EGFR	35	40
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944222	CD	On-Demand	Anodyne	ERBB2	26	43
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944222	CD	On-Demand	Anodyne	FLT1	24	41
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944222	CD	On-Demand	Anodyne	EPHA2	40	34
CC[C@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944222	CD	On-Demand	Anodyne	MKNK1	22	41
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944223	CD	On-Demand	Anodyne	EGFR	35	40
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944223	CD	On-Demand	Anodyne	ERBB2	26	43
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944223	CD	On-Demand	Anodyne	FLT1	24	41
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944223	CD	On-Demand	Anodyne	EPHA2	40	34
CC[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450944223	CD	On-Demand	Anodyne	MKNK1	22	41
C[C@H]1C[C@@H](O)CN(c2ncncc2-c2ccccc2)C1	ZINC000450944227	CE	On-Demand	Anodyne	SLC9A1	0	47
C[C@H]1C[C@H](O)CN(c2ncncc2-c2ccccc2)C1	ZINC000450944228	CE	On-Demand	Anodyne	SLC9A1	0	47
C[C@@H]1C[C@@H](O)CN(c2ncncc2-c2ccccc2)C1	ZINC000450944229	CE	On-Demand	Anodyne	SLC9A1	0	47
C[C@@H]1C[C@@H](O)CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450944230	EE	On-Demand	Anodyne	AVPR2	44	43
C[C@H]1C[C@@H](O)CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450944232	EE	On-Demand	Anodyne	AVPR2	44	43
C[C@H]1C[C@H](O)CN(c2ccc(C(=O)N3CCc4ccccc43)cn2)C1	ZINC000450944233	EE	On-Demand	Anodyne	AVPR2	44	43
COC[C@@H]1CCCN(c2ncc(C(=O)N(C)C)cc2Cl)CC1	ZINC000450944242	EF	On-Demand	Anodyne	P2RY12	28	40
COC[C@H]1CCCN(c2ncc(C(=O)N(C)C)cc2Cl)CC1	ZINC000450944243	EF	On-Demand	Anodyne	P2RY12	28	40
COC[C@H]1CCCN(c2cc(N3CCC[C@@H](COC)CC3)ncn2)CC1	ZINC000450944283	FF	On-Demand	Anodyne	PDE3B	52	32
COC[C@@H]1CCCN(c2cc(N3CCC[C@@H](COC)CC3)ncn2)CC1	ZINC000450944284	FF	On-Demand	Anodyne	PDE3B	52	32
COC[C@H]1CCCN(c2cc(N3CCC[C@H](COC)CC3)ncn2)CC1	ZINC000450944285	FF	On-Demand	Anodyne	PDE3B	52	32
COC(=O)c1cnc(N[C@H](C)c2cccc(C)c2)nc1	ZINC000450944287	CF	On-Demand	Anodyne	PLK1	0	40
COC(=O)c1cnc(N[C@@H](C)c2cccc(C)c2)nc1	ZINC000450944288	CF	On-Demand	Anodyne	PLK1	0	40
COC[C@@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944295	DG	On-Demand	Anodyne	PDE3A	61	45
COC[C@@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944295	DG	On-Demand	Anodyne	PDGFRB	78	43
COC[C@@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944295	DG	On-Demand	Anodyne	FLT1	22	46
COC[C@@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944295	DG	On-Demand	Anodyne	PDE3B	90	46
COC[C@@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944295	DG	On-Demand	Anodyne	HTT	0	40
COC[C@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944296	DG	On-Demand	Anodyne	PDE3A	61	45
COC[C@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944296	DG	On-Demand	Anodyne	PDGFRB	78	43
COC[C@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944296	DG	On-Demand	Anodyne	FLT1	22	46
COC[C@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944296	DG	On-Demand	Anodyne	PDE3B	90	46
COC[C@H]1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1	ZINC000450944296	DG	On-Demand	Anodyne	HTT	0	40
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450944306	DD	On-Demand	Anodyne	SIRT2	53	32
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450944306	DD	On-Demand	Anodyne	SIRT1	52	32
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450944306	DD	On-Demand	Anodyne	SCD1	56	53
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450944307	DD	On-Demand	Anodyne	SIRT2	53	32
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450944307	DD	On-Demand	Anodyne	SIRT1	52	32
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000450944307	DD	On-Demand	Anodyne	SCD1	56	53
CC(C)(C)C[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450944311	DG	On-Demand	Anodyne	SLC6A9	34	50
CC(C)(C)C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C1	ZINC000450944312	DG	On-Demand	Anodyne	SLC6A9	34	50
CN(C)C(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450944315	CG	On-Demand	Anodyne	MCHR1	0	42
CN(C)C(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450944316	CG	On-Demand	Anodyne	MCHR1	0	42
CC[C@@H](Nc1ccccc1[N+](=O)[O-])C(=O)NC	ZINC000450944330	BD	On-Demand	Bother	COLA	90	37
CC[C@@H](Nc1ccccc1[N+](=O)[O-])C(=O)NC	ZINC000450944330	BD	On-Demand	Bother	PQSD	0	40
CC[C@H](Nc1ccccc1[N+](=O)[O-])C(=O)NC	ZINC000450944331	BD	On-Demand	Bother	COLA	90	37
CC[C@H](Nc1ccccc1[N+](=O)[O-])C(=O)NC	ZINC000450944331	BD	On-Demand	Bother	PQSD	0	40
C[C@@H]1C[C@@H](O)CN(c2nc(-c3ccccc3F)cs2)C1	ZINC000450944354	CG	On-Demand	Anodyne	GABRA3	47	32
C[C@H]1C[C@H](O)CN(c2nc(-c3ccccc3F)cs2)C1	ZINC000450944355	CG	On-Demand	Anodyne	GABRA3	47	32
C[C@H]1C[C@@H](O)CN(c2nc(-c3ccccc3F)cs2)C1	ZINC000450944356	CG	On-Demand	Anodyne	GABRA3	47	32
CC[C@H](N=c1cc[nH]c(C(=O)NCc2ccccc2)c1)C(=O)NC	ZINC000450944357	ED	On-Demand	Anodyne	PDS	44	35
CC[C@@H](N=c1cc[nH]c(C(=O)NCc2ccccc2)c1)C(=O)NC	ZINC000450944358	ED	On-Demand	Anodyne	PDS	44	35
CC[C@@H](Nc1ccc(S(=O)(=O)CC)cc1)C(=O)NC	ZINC000450944361	CD	On-Demand	Anodyne	RORC	25	42
CC[C@H](Nc1ccc(S(=O)(=O)CC)cc1)C(=O)NC	ZINC000450944362	CD	On-Demand	Anodyne	RORC	25	42
CCCCNC(=O)NC(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944366	DD	On-Demand	Anodyne	ENPP1	56	36
COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450944372	FH	On-Demand	Anodyne	ENPP1	24	46
COc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450944373	FH	On-Demand	Anodyne	ENPP1	24	46
COc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450944374	FH	On-Demand	Anodyne	ENPP1	24	46
COc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1nc2c(C)ccnc2[nH]1	ZINC000450944375	FH	On-Demand	Anodyne	ENPP1	24	46
CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1cccnc1N	ZINC000450944380	FI	On-Demand	Anodyne	TACR1	29	57
Cc1ccnc2[nH]c(SCC(=O)NCCO[C@@H]3CCCC[C@@H]3C)nc12	ZINC000450944381	FG	On-Demand	Anodyne	ENPP1	60	49
Cc1ccnc2[nH]c(SCC(=O)NCCO[C@H]3CCCC[C@@H]3C)nc12	ZINC000450944382	FG	On-Demand	Anodyne	ENPP1	60	49
Cc1ccnc2[nH]c(SCC(=O)NCCO[C@H]3CCCC[C@H]3C)nc12	ZINC000450944383	FG	On-Demand	Anodyne	ENPP1	60	49
Cc1ccnc2[nH]c(SCC(=O)NCCO[C@@H]3CCCC[C@H]3C)nc12	ZINC000450944384	FG	On-Demand	Anodyne	ENPP1	60	49
c1ccc(-c2cncc(N(CCN3CCOCC3)Cc3ccco3)n2)cc1	ZINC000450944389	FG	On-Demand	Anodyne	CASR	40	38
C[C@H]1C[C@@H](O)CN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450944404	EH	On-Demand	Anodyne	ADRB3	17	49
C[C@H]1C[C@H](O)CN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450944407	EH	On-Demand	Anodyne	ADRB3	17	49
C[C@@H]1C[C@@H](O)CN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450944409	EH	On-Demand	Anodyne	ADRB3	17	49
COc1ccc(N(C#N)CC(=O)NCCCN2CCCCCC2=O)cc1	ZINC000450944410	FD	On-Demand	Anodyne	TYRO3	23	44
COC[C@H]1CCCCN1c1cc(C)ccc1[N+](=O)[O-]	ZINC000450944421	CF	On-Demand	Bother	CASP3	44	39
COC[C@H]1CCCCN1c1cc(C)ccc1[N+](=O)[O-]	ZINC000450944421	CF	On-Demand	Bother	CASP7	54	39
COC[C@@H]1CCCCN1c1cc(C)ccc1[N+](=O)[O-]	ZINC000450944422	CF	On-Demand	Bother	CASP3	44	39
COC[C@@H]1CCCCN1c1cc(C)ccc1[N+](=O)[O-]	ZINC000450944422	CF	On-Demand	Bother	CASP7	54	39
CCN(Cc1ccccc1)C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944423	EG	On-Demand	Anodyne	ENPP1	32	48
CC[C@@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944435	EC	On-Demand	Bother	BDKRB1	0	40
CC[C@@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944435	EC	On-Demand	Bother	COLA	72	32
CC[C@@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944435	EC	On-Demand	Bother	BCL2L1	62	33
CC[C@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944436	EC	On-Demand	Bother	BDKRB1	0	40
CC[C@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944436	EC	On-Demand	Bother	COLA	72	32
CC[C@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944436	EC	On-Demand	Bother	BCL2L1	62	33
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)C(=O)NC	ZINC000450944438	EF	On-Demand	Anodyne	PRNP	61	36
CC[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)C(=O)NC	ZINC000450944438	EF	On-Demand	Anodyne	P4HTM	0	52
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)C(=O)NC	ZINC000450944440	EF	On-Demand	Anodyne	PRNP	61	36
CC[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cn1)C(=O)NC	ZINC000450944440	EF	On-Demand	Anodyne	P4HTM	0	52
NC(=O)c1cncc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450944449	EC	On-Demand	Anodyne	CASR	49	35
C[C@H]1CN(c2ccccn2)CCN1C(=O)c1cnn(C)c1	ZINC000450944460	CD	On-Demand	Anodyne	DRD4	27	43
C[C@H]1CN(c2ccccn2)CCN1C(=O)c1cnn(C)c1	ZINC000450944460	CD	On-Demand	Anodyne	HCRTR1	45	36
C[C@H]1CN(c2ccccn2)CCN1C(=O)c1cnn(C)c1	ZINC000450944460	CD	On-Demand	Anodyne	HCRTR2	47	39
C[C@H]1CN(c2ccccn2)CCN1C(=O)c1cnn(C)c1	ZINC000450944460	CD	On-Demand	Anodyne	SLC6A7	0	52
C[C@H]1CN(c2ccc3ccccc3n2)CCN1C(=O)c1cnn(C)c1	ZINC000450944465	EE	On-Demand	Anodyne	HTR3A	34	44
C[C@H]1CN(c2ccc3ccccc3n2)CCN1C(=O)c1cnn(C)c1	ZINC000450944465	EE	On-Demand	Anodyne	PDE1B	0	41
C[C@H]1CN(c2ccc3ccccc3n2)CCN1C(=O)c1cnn(C)c1	ZINC000450944465	EE	On-Demand	Anodyne	SLC6A7	0	43
C[C@H]1CN(c2ncc(Br)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450944466	FD	On-Demand	Anodyne	SLC6A7	0	51
CC[C@@H](Nc1ccc(Br)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944468	DE	On-Demand	Bother	COLA	67	34
CC[C@H](Nc1ccc(Br)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944469	DE	On-Demand	Bother	COLA	67	34
c1coc(CN(CCN2CCOCC2)c2ccnc3ccccc23)c1	ZINC000450944483	EG	On-Demand	Anodyne	HNMT	54	49
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944485	DF	On-Demand	Anodyne	BMP1	74	43
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944485	DF	On-Demand	Anodyne	CAPNS1	52	33
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944485	DF	On-Demand	Anodyne	CAPN2	46	32
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944485	DF	On-Demand	Anodyne	POL	0	45
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944485	DF	On-Demand	Anodyne	GPR142	47	43
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944486	DF	On-Demand	Anodyne	BMP1	74	43
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944486	DF	On-Demand	Anodyne	CAPNS1	52	33
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944486	DF	On-Demand	Anodyne	CAPN2	46	32
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944486	DF	On-Demand	Anodyne	POL	0	45
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944486	DF	On-Demand	Anodyne	GPR142	47	43
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944487	DF	On-Demand	Anodyne	BMP1	74	43
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944487	DF	On-Demand	Anodyne	CAPNS1	52	33
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944487	DF	On-Demand	Anodyne	CAPN2	46	32
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944487	DF	On-Demand	Anodyne	POL	0	45
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCCc1cscn1	ZINC000450944487	DF	On-Demand	Anodyne	GPR142	47	43
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944489	DF	On-Demand	Anodyne	BMP1	74	43
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944489	DF	On-Demand	Anodyne	CAPNS1	52	33
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944489	DF	On-Demand	Anodyne	CAPN2	46	32
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944489	DF	On-Demand	Anodyne	POL	0	45
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCCc1cscn1	ZINC000450944489	DF	On-Demand	Anodyne	GPR142	47	43
c1ccc(-c2nnc(N(CCN3CCOCC3)Cc3ccco3)s2)cc1	ZINC000450944500	FG	On-Demand	Anodyne	CASR	27	46
COc1ccc(N2CCN(c3ccc(F)cc3C#N)CC2)nc1	ZINC000450944504	DE	On-Demand	Mild	DRD4	16	43
COc1ccc(N2CCN(c3ccc(F)cc3C#N)CC2)nc1	ZINC000450944504	DE	On-Demand	Mild	SMO	17	40
C[C@H]1CN(c2ccnc3ccccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450944510	EE	On-Demand	Anodyne	HCRTR2	35	40
C[C@H]1CN(c2ccnc3ccccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450944510	EE	On-Demand	Anodyne	BMP4	44	30
C[C@H]1CN(c2ccnc3ccccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450944510	EE	On-Demand	Anodyne	SMO	25	47
C[C@H]1CN(c2ccnc3ccccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450944510	EE	On-Demand	Anodyne	SLC6A7	0	45
C[C@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])CCN1C(=O)c1cnn(C)c1	ZINC000450944514	GE	On-Demand	Bother	SLC6A7	0	42
CCCNC(=O)c1ccc(N[C@@H]2CCCC[C@H]2OCC)nc1	ZINC000450944517	DF	On-Demand	Anodyne	SSTR5	15	40
CC[C@@H](Nc1cc(C)ccc1[N+](=O)[O-])C(=O)NC	ZINC000450944525	CD	On-Demand	Bother	COLA	40	33
CCOC(=O)c1csc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450944530	FE	On-Demand	Anodyne	CASR	52	41
COc1ccc(CNC(=O)CCN[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450944538	GF	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450944538	GF	On-Demand	Anodyne	HTR7	26	40
COc1ccc(CNC(=O)CCN[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450944538	GF	On-Demand	Anodyne	MTNR1A	72	36
COc1ccc(CNC(=O)CCN[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450944538	GF	On-Demand	Anodyne	MTNR1B	64	36
COc1ccc(CNC(=O)CCN[C@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450944540	GF	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN[C@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450944540	GF	On-Demand	Anodyne	HTR7	26	40
COc1ccc(CNC(=O)CCN[C@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450944540	GF	On-Demand	Anodyne	MTNR1A	72	36
COc1ccc(CNC(=O)CCN[C@H]2CCN(C)[C@@H]2c2ccccc2)c(OC)c1	ZINC000450944540	GF	On-Demand	Anodyne	MTNR1B	64	36
COc1ccc(CNC(=O)CCN[C@@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450944545	GF	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN[C@@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450944545	GF	On-Demand	Anodyne	HTR7	26	40
COc1ccc(CNC(=O)CCN[C@@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450944545	GF	On-Demand	Anodyne	MTNR1A	72	36
COc1ccc(CNC(=O)CCN[C@@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450944545	GF	On-Demand	Anodyne	MTNR1B	64	36
COc1ccc(CNC(=O)CCN[C@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450944547	GF	On-Demand	Anodyne	DRD4	41	32
COc1ccc(CNC(=O)CCN[C@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450944547	GF	On-Demand	Anodyne	HTR7	26	40
COc1ccc(CNC(=O)CCN[C@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450944547	GF	On-Demand	Anodyne	MTNR1A	72	36
COc1ccc(CNC(=O)CCN[C@H]2CCN(C)[C@H]2c2ccccc2)c(OC)c1	ZINC000450944547	GF	On-Demand	Anodyne	MTNR1B	64	36
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450944557	ED	On-Demand	Anodyne	Q8AWE3_CHICK	25	42
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450944560	ED	On-Demand	Anodyne	Q8AWE3_CHICK	25	42
CCn1cnc2c(N3C[C@H](c4ccccc4)[C@@H](C(=O)OC)C3)ncnc21	ZINC000450944563	FE	On-Demand	Anodyne	SLC6A1	45	40
CCn1cnc2c(N3C[C@H](c4ccccc4)[C@@H](C(=O)OC)C3)ncnc21	ZINC000450944563	FE	On-Demand	Anodyne	SLC6A3	19	44
COC[C@@H]1CCCCN1c1nc(C)cc(C(F)(F)F)n1	ZINC000450944573	CF	On-Demand	Anodyne	CASP3	51	39
COC[C@@H]1CCCCN1c1nc(C)cc(C(F)(F)F)n1	ZINC000450944573	CF	On-Demand	Anodyne	CASP7	64	39
COC(=O)c1cnc(N(CCN2CCOCC2)Cc2ccco2)nc1	ZINC000450944574	ED	On-Demand	Anodyne	CASR	46	39
COC[C@H]1CCCCN1c1nc(C)cc(C(F)(F)F)n1	ZINC000450944575	CF	On-Demand	Anodyne	CASP3	51	39
COC[C@H]1CCCCN1c1nc(C)cc(C(F)(F)F)n1	ZINC000450944575	CF	On-Demand	Anodyne	CASP7	64	39
CCn1cnc2c(N3C[C@@H](C(=O)OC)[C@@H](c4ccccc4)C3)ncnc21	ZINC000450944576	FE	On-Demand	Anodyne	SLC6A1	45	40
CCn1cnc2c(N3C[C@@H](C(=O)OC)[C@@H](c4ccccc4)C3)ncnc21	ZINC000450944576	FE	On-Demand	Anodyne	SLC6A3	19	44
C[C@H]1CN(c2ccnc3cc(Cl)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450944591	FF	On-Demand	Anodyne	HRP1_PLAFA	65	34
C[C@H]1CN(c2ccnc3cc(Cl)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450944591	FF	On-Demand	Anodyne	HNMT	43	33
C[C@H]1CN(c2ccnc3cc(Cl)ccc23)CCN1C(=O)c1cnn(C)c1	ZINC000450944591	FF	On-Demand	Anodyne	SLC6A7	0	52
CCNC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nc1	ZINC000450944603	FD	On-Demand	Anodyne	CASR	42	34
COc1ccc(N2CCN(c3cc(N4CCSCC4)ncn3)CC2)nc1	ZINC000450944605	FD	On-Demand	Anodyne	ADK	21	40
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944612	GE	On-Demand	Anodyne	OPRM1	26	46
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944612	GE	On-Demand	Anodyne	OPRD1	67	34
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944612	GE	On-Demand	Anodyne	AGTR2	81	43
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944612	GE	On-Demand	Anodyne	CFTR	50	34
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944612	GE	On-Demand	Anodyne	ADAM9	54	32
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944612	GE	On-Demand	Anodyne	ENPP1	65	48
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944615	GE	On-Demand	Anodyne	OPRM1	26	46
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944615	GE	On-Demand	Anodyne	OPRD1	67	34
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944615	GE	On-Demand	Anodyne	AGTR2	81	43
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944615	GE	On-Demand	Anodyne	CFTR	50	34
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944615	GE	On-Demand	Anodyne	ADAM9	54	32
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSc1nc2c(C)ccnc2[nH]1	ZINC000450944615	GE	On-Demand	Anodyne	ENPP1	65	48
COc1ccc(N2CCN(c3nc(C)nc4[nH]ccc34)CC2)nc1	ZINC000450944630	DD	On-Demand	Anodyne	AKT2	22	40
COc1cc2c(N(CCN3CCOCC3)Cc3ccco3)ncnc2cc1F	ZINC000450944632	GF	On-Demand	Anodyne	EGFR	31	47
COc1cc2c(N(CCN3CCOCC3)Cc3ccco3)ncnc2cc1F	ZINC000450944632	GF	On-Demand	Anodyne	FGFR1	0	46
COc1cc2c(N(CCN3CCOCC3)Cc3ccco3)ncnc2cc1F	ZINC000450944632	GF	On-Demand	Anodyne	SRC	33	44
COc1cc2c(N(CCN3CCOCC3)Cc3ccco3)ncnc2cc1F	ZINC000450944632	GF	On-Demand	Anodyne	FLT1	22	45
COc1cc2c(N(CCN3CCOCC3)Cc3ccco3)ncnc2cc1F	ZINC000450944632	GF	On-Demand	Anodyne	MAP2K1	0	42
COc1cc2c(N(CCN3CCOCC3)Cc3ccco3)ncnc2cc1F	ZINC000450944632	GF	On-Demand	Anodyne	AURKA	32	40
C[C@@H](O)CCN1CCC[C@@](CO)(c2ccccc2)C1	ZINC000450944651	CD	On-Demand	Anodyne	OPRL1	17	42
C[C@H](O)CCN1CCC[C@@](CO)(c2ccccc2)C1	ZINC000450944652	CD	On-Demand	Anodyne	OPRL1	17	42
C[C@H](O)CCN1CCC[C@](CO)(c2ccccc2)C1	ZINC000450944653	CD	On-Demand	Anodyne	OPRL1	17	42
C[C@@H](O)CCN1CCC[C@](CO)(c2ccccc2)C1	ZINC000450944654	CD	On-Demand	Anodyne	OPRL1	17	42
CC[C@H](C)[C@@H](NC(=O)COc1ccc(C(F)(F)F)cc1F)C(=O)OC	ZINC000450944656	FF	On-Demand	Anodyne	PPARD	46	40
CC[C@@H](C)[C@H](NC(=O)COc1ccc(C(F)(F)F)cc1F)C(=O)OC	ZINC000450944658	FF	On-Demand	Anodyne	PPARD	46	40
CC[C@H](C)[C@H](NC(=O)COc1ccc(C(F)(F)F)cc1F)C(=O)OC	ZINC000450944660	FF	On-Demand	Anodyne	PPARD	46	40
CCc1nn(C)c(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1[N+](=O)[O-]	ZINC000450944661	FE	On-Demand	Bother	SLC6A1	34	40
CCc1nn(C)c(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c1[N+](=O)[O-]	ZINC000450944661	FE	On-Demand	Bother	SLC6A3	19	45
CC[C@@H](C)[C@@H](NC(=O)COc1ccc(C(F)(F)F)cc1F)C(=O)OC	ZINC000450944662	FF	On-Demand	Anodyne	PPARD	46	40
O=C1c2ccccc2C(=O)N1CCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450944663	GG	On-Demand	Anodyne	CHRM2	0	47
O=C1c2ccccc2C(=O)N1CCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450944663	GG	On-Demand	Anodyne	HTR1A	32	60
O=C1c2ccccc2C(=O)N1CCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450944663	GG	On-Demand	Anodyne	DRD2	27	49
O=C1c2ccccc2C(=O)N1CCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450944663	GG	On-Demand	Anodyne	HTR2A	15	43
O=C1c2ccccc2C(=O)N1CCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450944663	GG	On-Demand	Anodyne	DRD3	15	45
O=C1c2ccccc2C(=O)N1CCCCN1CCC(F)(c2ccccn2)CC1	ZINC000450944663	GG	On-Demand	Anodyne	HTR7	19	45
CCc1nn(C)c(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450944664	FE	On-Demand	Bother	SLC6A1	34	40
CCc1nn(C)c(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)c1[N+](=O)[O-]	ZINC000450944664	FE	On-Demand	Bother	SLC6A3	19	45
COC(=O)[C@H]1CN(c2nc(C(F)(F)F)cs2)C[C@@H]1c1ccccc1	ZINC000450944665	FH	On-Demand	Anodyne	SLC6A1	29	43
COC(=O)[C@@H]1CN(c2nc(C(F)(F)F)cs2)C[C@H]1c1ccccc1	ZINC000450944667	FH	On-Demand	Anodyne	SLC6A1	29	43
COC(=O)[C@H]1CN(c2nc(C(F)(F)F)cs2)C[C@H]1c1ccccc1	ZINC000450944669	FH	On-Demand	Anodyne	SLC6A1	29	43
COC(=O)[C@H]1CN(c2nccc(C)n2)C[C@@H]1c1ccccc1	ZINC000450944688	CE	On-Demand	Anodyne	SLC6A1	53	43
COC(=O)[C@H]1CN(c2nccc(C)n2)C[C@@H]1c1ccccc1	ZINC000450944688	CE	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)[C@H]1CN(c2nccc(C)n2)C[C@H]1c1ccccc1	ZINC000450944689	CE	On-Demand	Anodyne	SLC6A1	53	43
COC(=O)[C@H]1CN(c2nccc(C)n2)C[C@H]1c1ccccc1	ZINC000450944689	CE	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)[C@H]1CN(c2nc3ccccc3o2)C[C@@H]1c1ccccc1	ZINC000450944692	DG	On-Demand	Anodyne	SLC6A1	50	45
COC(=O)[C@H]1CN(c2nc3ccccc3o2)C[C@H]1c1ccccc1	ZINC000450944693	DG	On-Demand	Anodyne	SLC6A1	50	45
COC(=O)c1csc(CN(C)CCc2cccc([N+](=O)[O-])c2)n1	ZINC000450944695	EF	On-Demand	Bother	CACNA1D	85	38
CCOc1cccc(CN(CCO)c2cc(C)nc(C)n2)c1	ZINC000450944698	DE	On-Demand	Anodyne	CETP	0	40
COC(=O)[C@H]1CN(c2nccc(C)c2C#N)C[C@H]1c1ccccc1	ZINC000450944703	DF	On-Demand	Mild	SLC6A1	35	40
COC(=O)[C@H]1CN(c2nccc(C)c2C#N)C[C@@H]1c1ccccc1	ZINC000450944704	DF	On-Demand	Mild	SLC6A1	35	40
COC(=O)[C@H]1CN(c2cncc(C(=O)N(C)C)n2)C[C@@H]1c1ccccc1	ZINC000450944722	FD	On-Demand	Anodyne	SLC6A1	24	40
COC(=O)[C@H]1CN(c2cncc(C(=O)N(C)C)n2)C[C@H]1c1ccccc1	ZINC000450944723	FD	On-Demand	Anodyne	SLC6A1	24	40
COC(=O)[C@@H]1CN(c2cncc(C(=O)N(C)C)n2)C[C@H]1c1ccccc1	ZINC000450944724	FD	On-Demand	Anodyne	SLC6A1	24	40
COC[C@@H]1CCCN(c2ncnc3sccc23)CC1	ZINC000450944730	CF	On-Demand	Anodyne	PDE3A	40	32
COC[C@@H]1CCCN(c2ncnc3sccc23)CC1	ZINC000450944730	CF	On-Demand	Anodyne	PDE3B	60	32
COC[C@H]1CCCN(c2ncnc3sccc23)CC1	ZINC000450944731	CF	On-Demand	Anodyne	PDE3A	40	32
COC[C@H]1CCCN(c2ncnc3sccc23)CC1	ZINC000450944731	CF	On-Demand	Anodyne	PDE3B	60	32
COC[C@@H]1CCCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000450944741	CG	On-Demand	Anodyne	CXCR3	15	47
COC[C@H]1CCCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000450944742	CG	On-Demand	Anodyne	CXCR3	15	47
Cc1cccc([C@H](C)Nc2ccc(-c3nc(C)c(C)c(O)n3)cn2)c1	ZINC000450944748	EI	On-Demand	Anodyne	PLK1	28	44
Cc1cccc([C@@H](C)Nc2ccc(-c3nc(C)c(C)c(O)n3)cn2)c1	ZINC000450944749	EI	On-Demand	Anodyne	PLK1	28	44
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C(=O)NC	ZINC000450944761	DC	On-Demand	Bother	TBXA2R	30	40
CC[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C(=O)NC	ZINC000450944762	DC	On-Demand	Bother	TBXA2R	30	40
Cc1ccnc(N2CC[C@H](CC(C)(C)C)C2)n1	ZINC000450944768	BG	On-Demand	Anodyne	SORD	24	40
Cc1ccnc(N2CC[C@@H](CC(C)(C)C)C2)n1	ZINC000450944769	BG	On-Demand	Anodyne	SORD	24	40
CCc1cc(O)nc(-c2ccc(N[C@@H](C)c3cccc(C)c3)nc2)n1	ZINC000450944774	EI	On-Demand	Anodyne	PLK1	26	43
CCc1cc(O)nc(-c2ccc(N[C@H](C)c3cccc(C)c3)nc2)n1	ZINC000450944775	EI	On-Demand	Anodyne	PLK1	26	43
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944780	FG	On-Demand	Anodyne	CASP3	55	40
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944780	FG	On-Demand	Anodyne	HSD11B1	22	43
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944780	FG	On-Demand	Anodyne	SLC6A9	39	48
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944780	FG	On-Demand	Anodyne	CASP7	65	40
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944780	FG	On-Demand	Anodyne	SFRP1	44	33
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944781	FG	On-Demand	Anodyne	CASP3	55	40
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944781	FG	On-Demand	Anodyne	HSD11B1	22	43
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944781	FG	On-Demand	Anodyne	SLC6A9	39	48
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944781	FG	On-Demand	Anodyne	CASP7	65	40
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450944781	FG	On-Demand	Anodyne	SFRP1	44	33
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	AKT2	56	51
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	AKT3	40	42
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	JAK3	25	40
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	JAK2	23	43
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	ROCK2	47	43
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	AKT1	27	46
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	SIRT3	49	30
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	SIRT2	50	31
COC[C@@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944804	CE	On-Demand	Anodyne	SIRT1	49	30
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	AKT2	56	51
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	AKT3	40	42
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	JAK3	25	40
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	JAK2	23	43
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	ROCK2	47	43
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	AKT1	27	46
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	SIRT3	49	30
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	SIRT2	50	31
COC[C@H]1CCCN(c2ncnc3[nH]ccc23)CC1	ZINC000450944805	CE	On-Demand	Anodyne	SIRT1	49	30
CC[C@H](Nc1cc(C)ccc1[N+](=O)[O-])C(=O)NC	ZINC000450944825	CD	On-Demand	Bother	COLA	40	33
CC[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944858	CC	On-Demand	Bother	TAAR1	17	44
CC[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944859	CC	On-Demand	Bother	TAAR1	17	44
CCc1cc(CCCN2CCN(C)[C@@H](Cc3ccccc3)C2)on1	ZINC000450944860	EG	On-Demand	Anodyne	SIGMAR1	24	41
CCc1cc(CCCN2CCN(C)[C@H](Cc3ccccc3)C2)on1	ZINC000450944861	EG	On-Demand	Anodyne	SIGMAR1	24	41
CCOc1ccc([C@H](COC)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450944873	EH	On-Demand	Anodyne	GPR88	0	41
CCOc1ccc([C@H](COC)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450944874	EH	On-Demand	Anodyne	GPR88	0	41
CCOc1ccc([C@H](COC)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000450944875	EH	On-Demand	Anodyne	GPR88	0	41
CCOc1ccc([C@H](COC)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000450944876	EH	On-Demand	Anodyne	GPR88	0	41
COC(=O)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccsc1	ZINC000450944883	FE	On-Demand	Anodyne	FOLH1	40	33
COC(=O)[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccsc1	ZINC000450944884	FE	On-Demand	Anodyne	FOLH1	40	33
CCCc1cc(N[C@@H](CC)C(=O)NC)n2ncnc2n1	ZINC000450944887	CD	On-Demand	Anodyne	DHOD	0	47
CCCc1cc(N[C@H](CC)C(=O)NC)n2ncnc2n1	ZINC000450944888	CD	On-Demand	Anodyne	DHOD	0	47
COC(=O)[C@H](NC(=O)c1cnn2ccc(C)cc12)c1cc(C)cc(C)c1	ZINC000450944889	FF	On-Demand	Anodyne	EPHB3	36	50
COC(=O)[C@@H](NC(=O)c1cnn2ccc(C)cc12)c1cc(C)cc(C)c1	ZINC000450944890	FF	On-Demand	Anodyne	EPHB3	36	50
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944903	GE	On-Demand	Bother	BCL2L1	83	35
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944903	GE	On-Demand	Bother	BCL2	73	35
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944903	GE	On-Demand	Bother	BCL2L2	43	30
CC[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944903	GE	On-Demand	Bother	DDIT3	0	40
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944904	GE	On-Demand	Bother	BCL2L1	83	35
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944904	GE	On-Demand	Bother	BCL2	73	35
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944904	GE	On-Demand	Bother	BCL2L2	43	30
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450944904	GE	On-Demand	Bother	DDIT3	0	40
C[C@H]1CN(c2nnnn2-c2ccccc2)CCN1C(=O)c1cnn(C)c1	ZINC000450944932	FC	On-Demand	Anodyne	SMO	23	45
C[C@H]1CN(c2nnnn2-c2ccccc2)CCN1C(=O)c1cnn(C)c1	ZINC000450944932	FC	On-Demand	Anodyne	SLC6A7	0	41
Cc1ccc(CN(C(=O)CSc2nc3c(C)ccnc3[nH]2)C2CC2)o1	ZINC000450944938	FG	On-Demand	Anodyne	ENPP1	23	44
COCCN1CN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450944939	FC	On-Demand	Anodyne	DRD4	40	30
COCCN1CN(CCC(=O)NCc2ccc(OC)cc2OC)CC1=O	ZINC000450944939	FC	On-Demand	Anodyne	MTNR1A	40	35
C[C@H]1CN(c2ncncc2Br)CCN1C(=O)c1cnn(C)c1	ZINC000450944940	FD	On-Demand	Anodyne	LIMK2	42	36
Cc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2ccccc2n1	ZINC000450944941	EF	On-Demand	Anodyne	HCRTR1	42	38
Cc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2ccccc2n1	ZINC000450944941	EF	On-Demand	Anodyne	SMO	41	50
Cc1cc(N2CCN(C(=O)c3cnn(C)c3)[C@@H](C)C2)c2ccccc2n1	ZINC000450944941	EF	On-Demand	Anodyne	SLC6A7	0	40
c1ccc(-c2nsc(N(CCN3CCOCC3)Cc3ccco3)n2)cc1	ZINC000450944948	FG	On-Demand	Anodyne	CASR	34	46
C[C@H]1CN(c2ccc(Br)cn2)CCN1C(=O)c1cnn(C)c1	ZINC000450944951	FD	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)c1coc(CN[C@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1	ZINC000450944952	FI	On-Demand	Anodyne	SLC6A1	43	37
CCOC(=O)c1cccnc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450944953	FD	On-Demand	Anodyne	P2RY12	45	35
CCOC(=O)c1cccnc1N1CCN(C(=O)c2cnn(C)c2)[C@@H](C)C1	ZINC000450944953	FD	On-Demand	Anodyne	SLC6A7	0	44
COC(=O)c1coc(CN[C@H]2CCCCC[C@H]2c2ccc(Cl)cc2)n1	ZINC000450944954	FI	On-Demand	Anodyne	SLC6A1	43	37
C[C@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)CCN1C(=O)c1cnn(C)c1	ZINC000450944955	GF	On-Demand	Mild	AR	61	49
COC(=O)c1coc(CN[C@@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1	ZINC000450944956	FI	On-Demand	Anodyne	SLC6A1	43	37
COC(=O)c1coc(CN[C@@H]2CCCCC[C@H]2c2ccc(Cl)cc2)n1	ZINC000450944958	FI	On-Demand	Anodyne	SLC6A1	43	37
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	AVPR1A	19	40
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	GRM3	15	41
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	HRH3	22	47
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	SLC18A3	19	40
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	GPR119	15	44
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	L3MBTL1	0	42
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	L3MBTL3	60	42
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	NPBWR1	59	38
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	TRPC6	42	45
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	TRPC3	23	45
COc1ccc(N2CCN(c3ccc(C(=O)N4CCC(C)CC4)cn3)CC2)nc1	ZINC000450944962	GF	On-Demand	Anodyne	SLC6A7	0	47
C=CCc1ccccc1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450944964	FH	On-Demand	Mild	ADRB2	37	64
C=CCc1ccccc1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450944964	FH	On-Demand	Mild	ADRB3	49	64
C=CCc1ccccc1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450944964	FH	On-Demand	Mild	ABCB1	59	43
C=CCc1ccccc1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450944965	FH	On-Demand	Mild	ADRB2	37	64
C=CCc1ccccc1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450944965	FH	On-Demand	Mild	ADRB3	49	64
C=CCc1ccccc1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450944965	FH	On-Demand	Mild	ABCB1	59	43
C[C@H]1CN(c2nc3ccccc3n2C)CCN1C(=O)c1cnn(C)c1	ZINC000450944971	ED	On-Demand	Anodyne	SMO	18	42
COC[C@@H]1CCCCN(C(=O)c2c[nH]c3nccc-3c2)C1	ZINC000450944973	CE	On-Demand	Anodyne	L3MBTL3	46	33
COC[C@H]1CCCCN(C(=O)c2c[nH]c3nccc-3c2)C1	ZINC000450944975	CE	On-Demand	Anodyne	L3MBTL3	46	33
COC[C@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945020	DF	On-Demand	Anodyne	PDE3A	52	39
COC[C@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945020	DF	On-Demand	Anodyne	PDGFRB	56	35
COC[C@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945020	DF	On-Demand	Anodyne	FGFR1	0	40
COC[C@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945020	DF	On-Demand	Anodyne	FLT1	23	40
COC[C@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945020	DF	On-Demand	Anodyne	PDE3B	77	40
COC[C@@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945021	DF	On-Demand	Anodyne	PDE3A	52	39
COC[C@@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945021	DF	On-Demand	Anodyne	PDGFRB	56	35
COC[C@@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945021	DF	On-Demand	Anodyne	FGFR1	0	40
COC[C@@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945021	DF	On-Demand	Anodyne	FLT1	23	40
COC[C@@H]1CCCCN1c1ncnc2cc(F)c(OC)cc12	ZINC000450945021	DF	On-Demand	Anodyne	PDE3B	77	40
CN(c1ncc(C(F)(F)F)cc1Cl)C1CCN(CC(F)(F)F)CC1	ZINC000450945023	GI	On-Demand	Anodyne	TRPM8	42	37
Cc1ccnc2[nH]c(SCC(=O)N(C)CCCOc3ccccc3)nc12	ZINC000450945028	FG	On-Demand	Anodyne	ENPP1	41	33
CC[C@@H](O)CC(=O)NCc1c(C)oc2ccccc12	ZINC000450945030	CF	On-Demand	Anodyne	THRB	22	40
CC[C@H](O)CC(=O)NCc1c(C)oc2ccccc12	ZINC000450945032	CF	On-Demand	Anodyne	THRB	22	40
COc1ccc2c(c1)OCCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450945050	DG	On-Demand	Anodyne	DRD4	42	33
COc1ccc2c(c1)OCCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450945050	DG	On-Demand	Anodyne	NOD1	25	40
COc1ccc2c(c1)OCCN(Cc1cccc(C(C)=O)c1)C2	ZINC000450945050	DG	On-Demand	Anodyne	NOD2	39	40
COc1cccc(CNC(=O)[C@@H](C)Sc2nc3c(C)ccnc3[nH]2)c1	ZINC000450945054	FG	On-Demand	Anodyne	ROCK1	41	44
COc1cccc(CNC(=O)[C@@H](C)Sc2nc3c(C)ccnc3[nH]2)c1	ZINC000450945054	FG	On-Demand	Anodyne	ROCK2	49	42
COc1cccc(CNC(=O)[C@H](C)Sc2nc3c(C)ccnc3[nH]2)c1	ZINC000450945055	FG	On-Demand	Anodyne	ROCK1	41	44
COc1cccc(CNC(=O)[C@H](C)Sc2nc3c(C)ccnc3[nH]2)c1	ZINC000450945055	FG	On-Demand	Anodyne	ROCK2	49	42
CC(C)c1nnc(N(CCN2CCOCC2)Cc2ccco2)o1	ZINC000450945059	DE	On-Demand	Anodyne	CASR	41	34
CNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)c([N+](=O)[O-])c1	ZINC000450945061	FD	On-Demand	Bother	DRD4	43	34
CNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)c([N+](=O)[O-])c1	ZINC000450945061	FD	On-Demand	Bother	TAAR1	35	54
CNC(=O)c1ccc(N2CCN(c3ccc(OC)cn3)CC2)c([N+](=O)[O-])c1	ZINC000450945061	FD	On-Demand	Bother	WDR5	31	41
COc1ccc(N2CCN(c3cc(-c4nc(C(C)C)no4)ccn3)CC2)nc1	ZINC000450945062	GF	On-Demand	Anodyne	SORD	54	34
CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450945099	GJ	On-Demand	Anodyne	KCNQ2	42	36
CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450945100	GJ	On-Demand	Anodyne	KCNQ2	42	36
CC[C@H](C)c1ccccc1NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450945101	GJ	On-Demand	Anodyne	KCNQ2	42	36
CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1	ZINC000450945102	GJ	On-Demand	Anodyne	KCNQ2	42	36
O[C@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945103	GH	On-Demand	Anodyne	ADRB2	48	54
O[C@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945103	GH	On-Demand	Anodyne	ADRB1	15	46
O[C@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945103	GH	On-Demand	Anodyne	HTR1A	17	52
O[C@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945103	GH	On-Demand	Anodyne	ADRB3	53	41
O[C@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945103	GH	On-Demand	Anodyne	CYP2D26	0	42
O[C@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945103	GH	On-Demand	Anodyne	CYP2D6	22	42
O[C@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945103	GH	On-Demand	Anodyne	ABCB1	74	54
O[C@@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945104	GH	On-Demand	Anodyne	ADRB2	48	54
O[C@@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945104	GH	On-Demand	Anodyne	ADRB1	15	46
O[C@@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945104	GH	On-Demand	Anodyne	HTR1A	17	52
O[C@@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945104	GH	On-Demand	Anodyne	ADRB3	53	41
O[C@@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945104	GH	On-Demand	Anodyne	CYP2D26	0	42
O[C@@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945104	GH	On-Demand	Anodyne	CYP2D6	22	42
O[C@@H](COc1cccc2ccccc12)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945104	GH	On-Demand	Anodyne	ABCB1	74	54
COc1cc(CN2CCC[C@@H]2[C@@H]2CCCO2)ccc1Cl	ZINC000450945109	CG	On-Demand	Anodyne	OPRK1	0	40
COc1cc(CN2CCC[C@H]2[C@@H]2CCCO2)ccc1Cl	ZINC000450945110	CG	On-Demand	Anodyne	OPRK1	0	40
COc1cc(CN2CCC[C@@H]2[C@H]2CCCO2)ccc1Cl	ZINC000450945111	CG	On-Demand	Anodyne	OPRK1	0	40
COc1cc(CN2CCC[C@H]2[C@H]2CCCO2)ccc1Cl	ZINC000450945112	CG	On-Demand	Anodyne	OPRK1	0	40
CC(C)c1ccccc1NC(=O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450945113	FI	On-Demand	Anodyne	DRD4	0	40
COc1ccc(N2CCN(c3ccc(C#N)c(Cl)c3)CC2)nc1	ZINC000450945123	EF	On-Demand	Mild	DRD4	41	34
COC[C@H]1CCCCN1c1ccc(C(F)(F)F)cn1	ZINC000450945159	CG	On-Demand	Anodyne	CXCR3	23	40
COC[C@@H]1CCCCN1c1ccc(C(F)(F)F)cn1	ZINC000450945160	CG	On-Demand	Anodyne	CXCR3	23	40
COC(=O)[C@H]1CN(c2cc(C)nc(-c3cccnc3)n2)C[C@@H]1c1ccccc1	ZINC000450945165	FG	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CN(c2cc(C)nc(-c3cccnc3)n2)C[C@@H]1c1ccccc1	ZINC000450945165	FG	On-Demand	Anodyne	ROS1	42	41
COC(=O)[C@H]1CN(c2cc(C)nc(-c3cccnc3)n2)C[C@H]1c1ccccc1	ZINC000450945166	FG	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@H]1CN(c2cc(C)nc(-c3cccnc3)n2)C[C@H]1c1ccccc1	ZINC000450945166	FG	On-Demand	Anodyne	ROS1	42	41
COC(=O)[C@@H]1CN(c2cc(C)nc(-c3cccnc3)n2)C[C@H]1c1ccccc1	ZINC000450945167	FG	On-Demand	Anodyne	SLC6A1	0	41
COC(=O)[C@@H]1CN(c2cc(C)nc(-c3cccnc3)n2)C[C@H]1c1ccccc1	ZINC000450945167	FG	On-Demand	Anodyne	ROS1	42	41
COC(=O)c1cnc(N(C)[C@@H]2C[C@@H](c3cccc(OC)c3)C2)nc1	ZINC000450945174	EF	On-Demand	Anodyne	GPBAR1	45	36
COC[C@H]1CCCCN1c1ncnc2ccc(C)cc12	ZINC000450945185	CF	On-Demand	Anodyne	PDE3B	65	33
COC[C@@H]1CCCCN1c1ncnc2ccc(C)cc12	ZINC000450945186	CF	On-Demand	Anodyne	PDE3B	65	33
COC(=O)[C@H]1CN(c2cccc(C#N)n2)C[C@@H]1c1ccccc1	ZINC000450945199	DE	On-Demand	Mild	SLC6A1	55	42
COC(=O)[C@H]1CN(c2cccc(C#N)n2)C[C@H]1c1ccccc1	ZINC000450945200	DE	On-Demand	Mild	SLC6A1	55	42
COC(=O)[C@H]1CN(c2ncnc3c2CN(C)CC3)C[C@@H]1c1ccccc1	ZINC000450945216	FD	On-Demand	Anodyne	SLC6A1	36	45
COC(=O)[C@H]1CN(c2ncnc3c2CN(C)CC3)C[C@@H]1c1ccccc1	ZINC000450945216	FD	On-Demand	Anodyne	SLC6A3	21	51
COC(=O)[C@H]1CN(c2ncnc3c2CN(C)CC3)C[C@H]1c1ccccc1	ZINC000450945217	FD	On-Demand	Anodyne	SLC6A1	36	45
COC(=O)[C@H]1CN(c2ncnc3c2CN(C)CC3)C[C@H]1c1ccccc1	ZINC000450945217	FD	On-Demand	Anodyne	SLC6A3	21	51
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2CCCC(=O)c2ccc(F)cc2)O1	ZINC000450945218	FF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2CCCC(=O)c2ccc(F)cc2)O1	ZINC000450945219	FF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2CCCC(=O)c2ccc(F)cc2)O1	ZINC000450945220	FF	On-Demand	Anodyne	DRD4	0	45
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2CCCC(=O)c2ccc(F)cc2)O1	ZINC000450945221	FF	On-Demand	Anodyne	DRD4	0	45
CC[C@H](Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945234	FC	On-Demand	Bother	TAAR1	18	48
CC[C@@H](Nc1ccc(C(=O)NCC(=O)OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945235	FC	On-Demand	Bother	TAAR1	18	48
CC[C@@H](Nc1ncnc2c(C)csc12)C(=O)NC	ZINC000450945238	CD	On-Demand	Anodyne	LPAR2	22	43
CC[C@H](Nc1ncnc2c(C)csc12)C(=O)NC	ZINC000450945239	CD	On-Demand	Anodyne	LPAR2	22	43
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945252	FB	On-Demand	Anodyne	TGM2	58	43
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945252	FB	On-Demand	Anodyne	GCK	41	30
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945252	FB	On-Demand	Anodyne	F13A1	59	36
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945252	FB	On-Demand	Anodyne	GCKR	53	32
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945252	FB	On-Demand	Anodyne	NAMPT	25	40
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945253	FB	On-Demand	Anodyne	TGM2	58	43
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945253	FB	On-Demand	Anodyne	GCK	41	30
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945253	FB	On-Demand	Anodyne	F13A1	59	36
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945253	FB	On-Demand	Anodyne	GCKR	53	32
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)NC	ZINC000450945253	FB	On-Demand	Anodyne	NAMPT	25	40
CC[C@@H](Nc1cc(C(F)(F)F)ccn1)C(=O)NC	ZINC000450945254	CE	On-Demand	Anodyne	PDS	42	39
CC[C@H](Nc1cc(C(F)(F)F)ccn1)C(=O)NC	ZINC000450945255	CE	On-Demand	Anodyne	PDS	42	39
CC[C@@H](Nc1ncc(C#N)cc1Cl)C(=O)NC	ZINC000450945279	CD	On-Demand	Mild	IRAK4	15	41
CC[C@H](Nc1ncc(C#N)cc1Cl)C(=O)NC	ZINC000450945280	CD	On-Demand	Mild	IRAK4	15	41
COC(=O)[C@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccc(C)c(C)c1	ZINC000450945288	GF	On-Demand	Anodyne	FOLH1	48	39
COC(=O)[C@@H](NC(=O)C[C@@H](CNC(C)=O)CC(C)C)c1ccc(C)c(C)c1	ZINC000450945289	GF	On-Demand	Anodyne	FOLH1	48	39
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945293	GC	On-Demand	Bother	BCL2L1	77	36
CC[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945293	GC	On-Demand	Bother	BCL2	62	36
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945294	GC	On-Demand	Bother	BCL2L1	77	36
CC[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945294	GC	On-Demand	Bother	BCL2	62	36
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc(C)c(C)c1	ZINC000450945314	FG	On-Demand	Anodyne	GPR88	0	42
CC[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)C(=O)NC	ZINC000450945331	DE	On-Demand	Bother	MAOB	18	48
CC[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)C(=O)NC	ZINC000450945332	DE	On-Demand	Bother	MAOB	18	48
COC[C@@H]1CCCN(c2ccnc(C)n2)CC1	ZINC000450945334	BE	On-Demand	Anodyne	SORD	62	38
COC[C@H]1CCCN(c2ccnc(C)n2)CC1	ZINC000450945335	BE	On-Demand	Anodyne	SORD	62	38
COC[C@@H]1CCCN(c2ncnc(-n3cccn3)c2N)CC1	ZINC000450945347	DD	On-Demand	Anodyne	SIRT3	42	31
COC[C@H]1CCCN(c2ncnc(-n3cccn3)c2N)CC1	ZINC000450945348	DD	On-Demand	Anodyne	SIRT3	42	31
Cc1cccc([C@H](C)Nc2ccc3nnc(C(F)F)n3n2)c1	ZINC000450945349	DF	On-Demand	Anodyne	PLK1	17	41
Cc1cccc([C@@H](C)Nc2ccc3nnc(C(F)F)n3n2)c1	ZINC000450945350	DF	On-Demand	Anodyne	PLK1	17	41
COC[C@H]1CCCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450945369	DF	On-Demand	Anodyne	SORD	66	38
COC[C@@H]1CCCN(c2ccnc(N3CCCCC3)n2)CC1	ZINC000450945370	DF	On-Demand	Anodyne	SORD	66	38
COc1cccc(OCCC(=O)N[C@H](C)CCC2CC2)c1	ZINC000450945375	CG	On-Demand	Anodyne	MTNR1A	43	42
COc1cccc(OCCC(=O)N[C@H](C)CCC2CC2)c1	ZINC000450945375	CG	On-Demand	Anodyne	MTNR1B	39	44
COc1cccc(OCCC(=O)N[C@@H](C)CCC2CC2)c1	ZINC000450945376	CG	On-Demand	Anodyne	MTNR1A	43	42
COc1cccc(OCCC(=O)N[C@@H](C)CCC2CC2)c1	ZINC000450945376	CG	On-Demand	Anodyne	MTNR1B	39	44
CCc1cc(Nc2ccc(CS(=O)(=O)CC)cc2)n2ncnc2n1	ZINC000450945388	EE	On-Demand	Anodyne	DHOD	0	65
COC[C@@H]1CCCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1	ZINC000450945399	EF	On-Demand	Bother	TAAR1	28	49
COC[C@H]1CCCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1	ZINC000450945400	EF	On-Demand	Bother	TAAR1	28	49
COC[C@@H]1CCCN(c2nc3cc(C)ccc3o2)CC1	ZINC000450945401	CG	On-Demand	Anodyne	PTGES	36	41
COC[C@H]1CCCN(c2nc3cc(C)ccc3o2)CC1	ZINC000450945402	CG	On-Demand	Anodyne	PTGES	36	41
C[C@H]1CN(c2ccc(C#N)c(Cl)c2)CCN1C(=O)c1cnn(C)c1	ZINC000450945425	EE	On-Demand	Mild	SLC6A7	0	43
C[C@H]1CN(c2ncnc3ccsc23)CCN1C(=O)c1cnn(C)c1	ZINC000450945432	ED	On-Demand	Anodyne	SIRT3	65	32
C[C@H]1CN(c2ncnc3ccsc23)CCN1C(=O)c1cnn(C)c1	ZINC000450945432	ED	On-Demand	Anodyne	SIRT2	64	31
C[C@H]1CN(c2ncnc3ccsc23)CCN1C(=O)c1cnn(C)c1	ZINC000450945432	ED	On-Demand	Anodyne	SIRT1	50	31
C[C@H]1CN(c2ncnc3ccsc23)CCN1C(=O)c1cnn(C)c1	ZINC000450945432	ED	On-Demand	Anodyne	LIMK2	63	35
c1ccc([C@@H]2C[C@@H]3CC[C@H](C2)N3C[C@H]2COCCO2)cc1	ZINC000450945458	CF	On-Demand	Anodyne	SLC18A3	29	47
c1ccc([C@@H]2C[C@@H]3CC[C@H](C2)N3C[C@@H]2COCCO2)cc1	ZINC000450945459	CF	On-Demand	Anodyne	SLC18A3	29	47
C[C@H]1CN(c2ncccc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450945462	DD	On-Demand	Anodyne	SMO	0	48
C[C@H]1CN(c2ncccc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450945462	DD	On-Demand	Anodyne	SLC6A7	0	55
C[C@H]1CN(c2ccncc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450945475	DD	On-Demand	Anodyne	SMO	0	43
C[C@H]1CN(c2ccncc2Cl)CCN1C(=O)c1cnn(C)c1	ZINC000450945475	DD	On-Demand	Anodyne	SLC6A7	0	49
COC[C@H]1CCCCN1c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000450945476	DE	On-Demand	Bother	CACNA1D	41	34
COC[C@@H]1CCCCN1c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000450945477	DE	On-Demand	Bother	CACNA1D	41	34
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)NC23CCC3)c(OC)c1	ZINC000450945478	GD	On-Demand	Anodyne	MTNR1A	43	39
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)NC23CCC3)c(OC)c1	ZINC000450945479	GD	On-Demand	Anodyne	MTNR1A	43	39
COc1ccc(N2CCN(c3ncccc3-c3nc(C)no3)CC2)nc1	ZINC000450945501	FE	On-Demand	Anodyne	ELANE	17	43
CCc1cc2c(N3CCN(c4ccc(OC)cn4)CC3)ncnc2s1	ZINC000450945504	FF	On-Demand	Anodyne	PDE3B	48	34
C[C@@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450945519	GI	On-Demand	Anodyne	PRCP	31	40
C[C@@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450945519	GI	On-Demand	Anodyne	AKT3	24	40
C[C@@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450945519	GI	On-Demand	Anodyne	SLC6A9	16	40
C[C@@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450945519	GI	On-Demand	Anodyne	ROCK2	26	40
C[C@@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)N1CCC(F)(c2ccccn2)CC1	ZINC000450945519	GI	On-Demand	Anodyne	AKT1	0	40
C[C@H](NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945520	GI	On-Demand	Anodyne	PRCP	31	40
C[C@H](NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945520	GI	On-Demand	Anodyne	AKT3	24	40
C[C@H](NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945520	GI	On-Demand	Anodyne	SLC6A9	16	40
C[C@H](NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945520	GI	On-Demand	Anodyne	ROCK2	26	40
C[C@H](NC(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945520	GI	On-Demand	Anodyne	AKT1	0	40
C[C@@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945521	GI	On-Demand	Anodyne	PRCP	31	40
C[C@@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945521	GI	On-Demand	Anodyne	AKT3	24	40
C[C@@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945521	GI	On-Demand	Anodyne	SLC6A9	16	40
C[C@@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945521	GI	On-Demand	Anodyne	ROCK2	26	40
C[C@@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945521	GI	On-Demand	Anodyne	AKT1	0	40
C[C@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945522	GI	On-Demand	Anodyne	PRCP	31	40
C[C@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945522	GI	On-Demand	Anodyne	AKT3	24	40
C[C@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945522	GI	On-Demand	Anodyne	SLC6A9	16	40
C[C@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945522	GI	On-Demand	Anodyne	ROCK2	26	40
C[C@H](NC(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)c1ccc(Cl)cc1	ZINC000450945522	GI	On-Demand	Anodyne	AKT1	0	40
COc1ccc(N2CCN(c3ncccc3C(=O)OC(C)C)CC2)nc1	ZINC000450945523	FE	On-Demand	Anodyne	NPBWR1	40	37
COC(=O)c1nc(N(CCN2CCOCC2)Cc2ccco2)sc1C	ZINC000450945535	FE	On-Demand	Anodyne	CASR	57	38
CCS(=O)(=O)c1ccccc1N1CCN(c2ccc(OC)cn2)CC1	ZINC000450945537	FE	On-Demand	Anodyne	DRD2	22	42
COc1ccc(N2CCN(c3ccc(S(N)(=O)=O)cn3)CC2)nc1	ZINC000450945542	EC	On-Demand	Anodyne	CA2	28	43
COc1ccc(N2CCN(c3ccc(S(N)(=O)=O)cn3)CC2)nc1	ZINC000450945542	EC	On-Demand	Anodyne	CA1	22	43
N#Cc1cc(Br)cnc1N(CCN1CCOCC1)Cc1ccco1	ZINC000450945555	GF	On-Demand	Mild	MAP2K1	22	40
COc1ccc(N2CCN(c3nc(-c4cccc(Cl)c4)no3)CC2)nc1	ZINC000450945564	FG	On-Demand	Anodyne	GRM5	23	44
COc1ccc(N2CCN(c3ccc(C(C)=O)cn3)CC2)nc1	ZINC000450945571	DE	On-Demand	Anodyne	DRD4	40	30
COc1ccc(N2CCN(c3ccc(C(C)=O)cn3)CC2)nc1	ZINC000450945571	DE	On-Demand	Anodyne	SLC6A7	0	42
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	ADRA1D	20	52
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	ADRA1A	17	59
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	ADRA1B	50	59
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	PDE3A	48	39
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	HRH4	21	43
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	CCR4	47	40
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	PDPK1	55	39
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	PDE3B	71	39
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	PDE10A	15	43
COc1ccc(N2CCN(c3nc(N)c4cc(OC)c(OC)cc4n3)CC2)nc1	ZINC000450945586	GD	On-Demand	Anodyne	EHMT2	78	44
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945621	GF	On-Demand	Bother	GHSR	0	41
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945621	GF	On-Demand	Bother	BCL2L1	53	33
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945621	GF	On-Demand	Bother	BCL2	42	32
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945622	GF	On-Demand	Bother	GHSR	0	41
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945622	GF	On-Demand	Bother	BCL2L1	53	33
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945622	GF	On-Demand	Bother	BCL2	42	32
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945623	GF	On-Demand	Bother	GHSR	0	41
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945623	GF	On-Demand	Bother	BCL2L1	53	33
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1	ZINC000450945623	GF	On-Demand	Bother	BCL2	42	32
CC(=O)c1cccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)c1	ZINC000450945630	DG	On-Demand	Anodyne	DRD2	23	45
CC(=O)c1cccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)c1	ZINC000450945630	DG	On-Demand	Anodyne	SIGMAR1	44	39
CC(=O)c1cccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)c1	ZINC000450945630	DG	On-Demand	Anodyne	CCR3	40	43
CC(=O)c1cccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)c1	ZINC000450945630	DG	On-Demand	Anodyne	PROTEASE	0	46
CC(=O)c1cccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)c1	ZINC000450945630	DG	On-Demand	Anodyne	POL	0	51
CC(=O)c1cccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)c1	ZINC000450945631	DG	On-Demand	Anodyne	DRD2	23	45
CC(=O)c1cccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)c1	ZINC000450945631	DG	On-Demand	Anodyne	SIGMAR1	44	39
CC(=O)c1cccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)c1	ZINC000450945631	DG	On-Demand	Anodyne	CCR3	40	43
CC(=O)c1cccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)c1	ZINC000450945631	DG	On-Demand	Anodyne	PROTEASE	0	46
CC(=O)c1cccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)c1	ZINC000450945631	DG	On-Demand	Anodyne	POL	0	51
C[C@H]1C[C@@H](O)CN(c2ccnc(C3CC3)n2)C1	ZINC000450945632	BD	On-Demand	Anodyne	SORD	66	35
C[C@@H]1C[C@@H](O)CN(c2ccnc(C3CC3)n2)C1	ZINC000450945633	BD	On-Demand	Anodyne	SORD	66	35
C[C@H]1C[C@H](O)CN(c2ccnc(C3CC3)n2)C1	ZINC000450945634	BD	On-Demand	Anodyne	SORD	66	35
C[C@@H]1C[C@@H](O)CN(c2ncccc2C(=O)Nc2ccc(Br)cc2)C1	ZINC000450945642	GG	On-Demand	Anodyne	TRPV1	18	44
C[C@H]1C[C@@H](O)CN(c2ncccc2C(=O)Nc2ccc(Br)cc2)C1	ZINC000450945643	GG	On-Demand	Anodyne	TRPV1	18	44
C[C@H]1C[C@H](O)CN(c2ncccc2C(=O)Nc2ccc(Br)cc2)C1	ZINC000450945644	GG	On-Demand	Anodyne	TRPV1	18	44
COC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccsc1	ZINC000450945659	ED	On-Demand	Anodyne	HDAC1	25	41
COC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccsc1	ZINC000450945659	ED	On-Demand	Anodyne	NPBWR1	66	36
COC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccsc1	ZINC000450945660	ED	On-Demand	Anodyne	HDAC1	25	41
COC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccsc1	ZINC000450945660	ED	On-Demand	Anodyne	NPBWR1	66	36
CC[C@@H](N=c1ccc2ccc(Cl)cc2[nH]1)C(=O)NC	ZINC000450945663	CE	On-Demand	Anodyne	PYGL	51	40
CC[C@H](N=c1ccc2ccc(Cl)cc2[nH]1)C(=O)NC	ZINC000450945664	CE	On-Demand	Anodyne	PYGL	51	40
CN(C)C(=O)COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945665	GE	On-Demand	Anodyne	DRD2	27	40
CN(C)C(=O)COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945665	GE	On-Demand	Anodyne	DRD4	0	41
CN(C)C(=O)COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945665	GE	On-Demand	Anodyne	ERG2	18	40
CN(C)C(=O)COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945665	GE	On-Demand	Anodyne	SLC18A3	0	41
CN(C)C(=O)COC[C@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945665	GE	On-Demand	Anodyne	CYP2J2	45	32
CN(C)C(=O)COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945666	GE	On-Demand	Anodyne	DRD2	27	40
CN(C)C(=O)COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945666	GE	On-Demand	Anodyne	DRD4	0	41
CN(C)C(=O)COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945666	GE	On-Demand	Anodyne	ERG2	18	40
CN(C)C(=O)COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945666	GE	On-Demand	Anodyne	SLC18A3	0	41
CN(C)C(=O)COC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)CC(C)(C)O1	ZINC000450945666	GE	On-Demand	Anodyne	CYP2J2	45	32
COC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(C)c(C)c1	ZINC000450945667	GG	On-Demand	Bother	CACNA1C	54	36
COC(=O)[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(C)c(C)c1	ZINC000450945667	GG	On-Demand	Bother	CACNA1D	87	36
COC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(C)c(C)c1	ZINC000450945668	GG	On-Demand	Bother	CACNA1C	54	36
COC(=O)[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(C)c(C)c1	ZINC000450945668	GG	On-Demand	Bother	CACNA1D	87	36
CNC(=O)N[C@@H]1CCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450945703	ED	On-Demand	Anodyne	BIRC2	26	41
CNC(=O)N[C@H]1CCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450945704	ED	On-Demand	Anodyne	BIRC2	26	41
C[C@H](CN1CCC(N2CCc3cc(F)ccc32)CC1)S(C)(=O)=O	ZINC000450945750	EE	On-Demand	Anodyne	SCD	32	45
C[C@@H](CN1CCC(N2CCc3cc(F)ccc32)CC1)S(C)(=O)=O	ZINC000450945751	EE	On-Demand	Anodyne	SCD	32	45
O=C(NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945755	EH	On-Demand	Anodyne	HTR4	43	40
O=C(NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945755	EH	On-Demand	Anodyne	HRH3	15	42
O=C(NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945755	EH	On-Demand	Anodyne	SIGMAR1	15	45
O=C(NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945755	EH	On-Demand	Anodyne	CCR3	36	48
O=C(NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945755	EH	On-Demand	Anodyne	CACNA1I	67	37
O=C(NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945755	EH	On-Demand	Anodyne	BIRC2	61	44
O=C(NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945756	EH	On-Demand	Anodyne	HTR4	43	40
O=C(NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945756	EH	On-Demand	Anodyne	HRH3	15	42
O=C(NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945756	EH	On-Demand	Anodyne	SIGMAR1	15	45
O=C(NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945756	EH	On-Demand	Anodyne	CCR3	36	48
O=C(NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945756	EH	On-Demand	Anodyne	CACNA1I	67	37
O=C(NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)c1ccco1	ZINC000450945756	EH	On-Demand	Anodyne	BIRC2	61	44
CCS(=O)(=O)Cc1ccc(Nc2ncc(C(F)(F)F)cc2Cl)cc1	ZINC000450945792	GI	On-Demand	Anodyne	TRPM8	43	38
CCS(=O)(=O)Cc1ccc(Nc2nc3cc(C)cc(C)c3o2)cc1	ZINC000450945802	EI	On-Demand	Anodyne	RPS6KA2	45	34
COC[C@H]1CCCN(c2ncc(Cl)cn2)CC1	ZINC000450945815	CE	On-Demand	Anodyne	GPR119	21	41
COC[C@@H]1CCCN(c2ncc(Cl)cn2)CC1	ZINC000450945816	CE	On-Demand	Anodyne	GPR119	21	41
CNS(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450945829	DD	On-Demand	Anodyne	CASP3	40	35
CNS(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450945829	DD	On-Demand	Anodyne	CASP7	43	35
CNS(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450945830	DD	On-Demand	Anodyne	CASP3	40	35
CNS(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450945830	DD	On-Demand	Anodyne	CASP7	43	35
COC[C@@H]1CCCN(c2ncnc3c(F)cccc23)CC1	ZINC000450945845	CG	On-Demand	Anodyne	HTR4	30	42
COC[C@H]1CCCN(c2ncnc3c(F)cccc23)CC1	ZINC000450945846	CG	On-Demand	Anodyne	HTR4	30	42
CC(C)(C)C[C@@H]1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450945850	DE	On-Demand	Bother	SIRT2	50	32
CC(C)(C)C[C@@H]1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450945850	DE	On-Demand	Bother	SIRT1	49	32
CC(C)(C)C[C@H]1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450945851	DE	On-Demand	Bother	SIRT2	50	32
CC(C)(C)C[C@H]1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450945851	DE	On-Demand	Bother	SIRT1	49	32
Cc1cccc([C@H](C)Nc2ncc(C(=O)N3CCOCC3)cc2Cl)c1	ZINC000450945852	FH	On-Demand	Anodyne	LRRK2	21	42
Cc1cccc([C@@H](C)Nc2ncc(C(=O)N3CCOCC3)cc2Cl)c1	ZINC000450945853	FH	On-Demand	Anodyne	LRRK2	21	42
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450945863	FF	On-Demand	Anodyne	CASP3	55	38
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450945863	FF	On-Demand	Anodyne	HSD11B1	0	43
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450945863	FF	On-Demand	Anodyne	CASP7	49	36
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450945864	FF	On-Demand	Anodyne	CASP3	55	38
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450945864	FF	On-Demand	Anodyne	HSD11B1	0	43
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(F)(F)F)CC1	ZINC000450945864	FF	On-Demand	Anodyne	CASP7	49	36
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450945867	FE	On-Demand	Anodyne	CA2	24	47
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450945867	FE	On-Demand	Anodyne	CA7	35	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450945867	FE	On-Demand	Anodyne	CASP7	49	35
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450945867	FE	On-Demand	Anodyne	CA12	17	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450945867	FE	On-Demand	Anodyne	CA9	17	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](CC(C)(C)C)C1	ZINC000450945867	FE	On-Demand	Anodyne	LIPG	51	39
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450945868	FE	On-Demand	Anodyne	CA2	24	47
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450945868	FE	On-Demand	Anodyne	CA7	35	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450945868	FE	On-Demand	Anodyne	CASP7	49	35
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450945868	FE	On-Demand	Anodyne	CA12	17	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450945868	FE	On-Demand	Anodyne	CA9	17	42
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](CC(C)(C)C)C1	ZINC000450945868	FE	On-Demand	Anodyne	LIPG	51	39
CCS(=O)(=O)Cc1ccc(Nc2nnc(C)c(C)c2C#N)cc1	ZINC000450945881	EF	On-Demand	Mild	RPS27	40	33
C[C@@H]1C[C@@H](O)CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450945900	CE	On-Demand	Anodyne	RBP4	18	43
C[C@H]1C[C@H](O)CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450945901	CE	On-Demand	Anodyne	RBP4	18	43
C[C@H]1C[C@@H](O)CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450945902	CE	On-Demand	Anodyne	RBP4	18	43
CC[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945915	CD	On-Demand	Bother	COLA	31	40
CC[C@H](Nc1ccc(F)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945916	CD	On-Demand	Bother	COLA	31	40
CC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945918	CD	On-Demand	Bother	TAAR1	17	44
CC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945918	CD	On-Demand	Bother	AKR1C3	16	42
CC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945920	CD	On-Demand	Bother	TAAR1	17	44
CC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C(=O)NC	ZINC000450945920	CD	On-Demand	Bother	AKR1C3	16	42
CC[C@@H](Nc1cc(=O)n2ccccc2n1)C(=O)NC	ZINC000450945927	CC	On-Demand	Anodyne	POLR1A	40	33
CC[C@H](Nc1cc(=O)n2ccccc2n1)C(=O)NC	ZINC000450945928	CC	On-Demand	Anodyne	POLR1A	40	33
CC[C@@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)C(=O)NC	ZINC000450945934	GG	On-Demand	Anodyne	NPBWR1	41	35
CC[C@H](Nc1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1Cl)C(=O)NC	ZINC000450945935	GG	On-Demand	Anodyne	NPBWR1	41	35
COc1ccc(N2CCN(c3cccc(S(C)(=O)=O)c3[N+](=O)[O-])CC2)nc1	ZINC000450945959	GD	On-Demand	Bother	GPR119	15	43
COc1ccc(N2CCN(c3cc(C(F)(F)F)nc4ncnn34)CC2)nc1	ZINC000450945972	GD	On-Demand	Anodyne	DHOD	0	40
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc2c(c1)CCO2	ZINC000450945992	FE	On-Demand	Anodyne	FOLH1	38	43
CCOc1cccc(CN(CCO)c2nc(C)nc(C)c2F)c1	ZINC000450945993	DF	On-Demand	Anodyne	CETP	0	42
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc2c(c1)CCO2	ZINC000450945994	FE	On-Demand	Anodyne	FOLH1	38	43
CC[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946027	DF	On-Demand	Bother	AKR1C4	0	51
CC[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946027	DF	On-Demand	Bother	AADAC	0	41
CC[C@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946029	DF	On-Demand	Bother	AKR1C4	0	51
CC[C@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946029	DF	On-Demand	Bother	AADAC	0	41
COc1ccc(N2CCN(c3cc(C#N)ccc3C(F)(F)F)CC2)nc1	ZINC000450946030	FG	On-Demand	Mild	SMO	0	42
COc1ccc(N2CCN(c3ccc(-n4nc(C)cc4C)nn3)CC2)nc1	ZINC000450946044	FE	On-Demand	Anodyne	ADORA2A	25	40
CCOc1cccc(CN(CCO)c2cc(C)ncn2)c1	ZINC000450946045	CE	On-Demand	Anodyne	CETP	0	41
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC1(C(=O)OC)CC1	ZINC000450946048	DD	On-Demand	Anodyne	MME	46	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC1(C(=O)OC)CC1	ZINC000450946048	DD	On-Demand	Anodyne	ANPEP	44	32
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC1(C(=O)OC)CC1	ZINC000450946048	DD	On-Demand	Anodyne	TIMP3	56	35
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC1(C(=O)OC)CC1	ZINC000450946048	DD	On-Demand	Anodyne	CAPNS1	52	35
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC1(C(=O)OC)CC1	ZINC000450946049	DD	On-Demand	Anodyne	MME	46	36
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC1(C(=O)OC)CC1	ZINC000450946049	DD	On-Demand	Anodyne	ANPEP	44	32
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC1(C(=O)OC)CC1	ZINC000450946049	DD	On-Demand	Anodyne	TIMP3	56	35
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC1(C(=O)OC)CC1	ZINC000450946049	DD	On-Demand	Anodyne	CAPNS1	52	35
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC1(C(=O)OC)CC1	ZINC000450946050	DD	On-Demand	Anodyne	MME	46	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC1(C(=O)OC)CC1	ZINC000450946050	DD	On-Demand	Anodyne	ANPEP	44	32
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC1(C(=O)OC)CC1	ZINC000450946050	DD	On-Demand	Anodyne	TIMP3	56	35
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC1(C(=O)OC)CC1	ZINC000450946050	DD	On-Demand	Anodyne	CAPNS1	52	35
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC1(C(=O)OC)CC1	ZINC000450946051	DD	On-Demand	Anodyne	MME	46	36
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC1(C(=O)OC)CC1	ZINC000450946051	DD	On-Demand	Anodyne	ANPEP	44	32
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC1(C(=O)OC)CC1	ZINC000450946051	DD	On-Demand	Anodyne	TIMP3	56	35
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC1(C(=O)OC)CC1	ZINC000450946051	DD	On-Demand	Anodyne	CAPNS1	52	35
c1cnn(CSCc2ccc3c(c2)OCO3)c1	ZINC000450946059	BF	On-Demand	Anodyne	SCN9A	0	40
c1cnn(CSCc2ccc3c(c2)OCO3)c1	ZINC000450946059	BF	On-Demand	Anodyne	NOS2	64	31
COc1ccc(N2CCN(c3nc4cc(F)ccc4o3)CC2)nc1	ZINC000450946061	EF	On-Demand	Anodyne	GALR2	41	36
COc1ccc(N2CCN(c3nc4cc(F)ccc4o3)CC2)nc1	ZINC000450946061	EF	On-Demand	Anodyne	NPBWR1	55	46
CC(C)c1cccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946067	FI	On-Demand	Anodyne	DRD4	0	49
CC(C)c1cccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946067	FI	On-Demand	Anodyne	ACOX1	42	36
Cc1cccc(Cl)c1CN[C@@H]1CCC(=O)N[C@@H]1C1CC1	ZINC000450946072	CF	On-Demand	Anodyne	EIF2AK1	40	34
Cc1cccc(Cl)c1CN[C@H]1CCC(=O)N[C@@H]1C1CC1	ZINC000450946073	CF	On-Demand	Anodyne	EIF2AK1	40	34
Cc1cccc(Cl)c1CN[C@H]1CCC(=O)N[C@H]1C1CC1	ZINC000450946074	CF	On-Demand	Anodyne	EIF2AK1	40	34
Cc1cccc(Cl)c1CN[C@@H]1CCC(=O)N[C@H]1C1CC1	ZINC000450946075	CF	On-Demand	Anodyne	EIF2AK1	40	34
CCOC(=O)c1cc(N2CCN(c3ccc(OC)cn3)CC2)ccc1[N+](=O)[O-]	ZINC000450946079	GF	On-Demand	Bother	GYRB	0	40
COc1ccc(N2CCN(c3ncc(C(N)=O)cc3Cl)CC2)nc1	ZINC000450946083	ED	On-Demand	Anodyne	P2RY12	40	55
COc1ccc(N2CCN(c3ncc(C(N)=O)cc3Cl)CC2)nc1	ZINC000450946083	ED	On-Demand	Anodyne	CXCR3	34	51
COc1ccc(N2CCN(c3ncc(C(N)=O)cc3Cl)CC2)nc1	ZINC000450946083	ED	On-Demand	Anodyne	SMO	24	44
COc1ccc(N2CCN(c3ncc(C(N)=O)cc3Cl)CC2)nc1	ZINC000450946083	ED	On-Demand	Anodyne	NPBWR1	41	37
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)N[C@H]2C2CC2)c(OC)c1	ZINC000450946086	GD	On-Demand	Anodyne	MTNR1A	54	36
COc1ccc(CNC(=O)CCN[C@H]2CCC(=O)N[C@@H]2C2CC2)c(OC)c1	ZINC000450946087	GD	On-Demand	Anodyne	MTNR1A	54	36
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)N[C@@H]2C2CC2)c(OC)c1	ZINC000450946088	GD	On-Demand	Anodyne	MTNR1A	54	36
COc1ccc(CNC(=O)CCN[C@@H]2CCC(=O)N[C@H]2C2CC2)c(OC)c1	ZINC000450946089	GD	On-Demand	Anodyne	MTNR1A	54	36
COC(=O)c1ccc(CN2CCC[C@](CO)(c3ccccc3)C2)cc1Cl	ZINC000450946097	FH	On-Demand	Anodyne	NPFFR1	43	38
COC(=O)c1ccc(CN2CCC[C@@](CO)(c3ccccc3)C2)cc1Cl	ZINC000450946098	FH	On-Demand	Anodyne	NPFFR1	43	38
COC(=O)C1(CN2CCC(N3CCc4cc(F)ccc43)CC2)CC1	ZINC000450946106	EF	On-Demand	Anodyne	SCD1	29	40
COC(=O)[C@H]1CN(c2nc(O)c3cnn(C)c3n2)C[C@H]1c1ccccc1	ZINC000450946117	FD	On-Demand	Anodyne	SLC6A1	31	43
COC(=O)[C@H]1CN(c2nc(O)c3cnn(C)c3n2)C[C@H]1c1ccccc1	ZINC000450946117	FD	On-Demand	Anodyne	SLC6A3	18	48
COC(=O)[C@H]1CN(c2nc(O)c3cnn(C)c3n2)C[C@@H]1c1ccccc1	ZINC000450946118	FD	On-Demand	Anodyne	SLC6A1	31	43
COC(=O)[C@H]1CN(c2nc(O)c3cnn(C)c3n2)C[C@@H]1c1ccccc1	ZINC000450946118	FD	On-Demand	Anodyne	SLC6A3	18	48
COC(=O)[C@@H]1CN(c2nc(O)c3cnn(C)c3n2)C[C@H]1c1ccccc1	ZINC000450946119	FD	On-Demand	Anodyne	SLC6A1	31	43
COC(=O)[C@@H]1CN(c2nc(O)c3cnn(C)c3n2)C[C@H]1c1ccccc1	ZINC000450946119	FD	On-Demand	Anodyne	SLC6A3	18	48
CC(C)c1nnc(CN2CCC(N3CCc4cc(F)ccc43)CC2)s1	ZINC000450946131	FH	On-Demand	Anodyne	SCD1	31	41
CC(C)c1nnc(CN2CCC(N3CCc4cc(F)ccc43)CC2)s1	ZINC000450946131	FH	On-Demand	Anodyne	SCD	26	43
COc1cccc([C@@H]2C[C@@H](N(C)c3ncccn3)C2)c1	ZINC000450946134	CF	On-Demand	Anodyne	EBP	18	47
C[C@@H](O)CCN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450946136	CE	On-Demand	Anodyne	SCD1	31	41
C[C@@H](O)CCN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450946136	CE	On-Demand	Anodyne	SCD	26	40
C[C@@H](O)CCN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450946136	CE	On-Demand	Anodyne	NAMPT	0	43
C[C@H](O)CCN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450946137	CE	On-Demand	Anodyne	SCD1	31	41
C[C@H](O)CCN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450946137	CE	On-Demand	Anodyne	SCD	26	40
C[C@H](O)CCN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000450946137	CE	On-Demand	Anodyne	NAMPT	0	43
COC(=O)[C@H]1CN(c2c(C#N)c(=O)n(C)c(=O)n2C)C[C@@H]1c1ccccc1	ZINC000450946141	FC	On-Demand	Mild	SLC6A1	60	42
COC(=O)[C@H]1CN(c2c(C#N)c(=O)n(C)c(=O)n2C)C[C@@H]1c1ccccc1	ZINC000450946141	FC	On-Demand	Mild	SLC6A3	23	40
COC(=O)[C@H]1CN(c2c(C#N)c(=O)n(C)c(=O)n2C)C[C@H]1c1ccccc1	ZINC000450946142	FC	On-Demand	Mild	SLC6A1	60	42
COC(=O)[C@H]1CN(c2c(C#N)c(=O)n(C)c(=O)n2C)C[C@H]1c1ccccc1	ZINC000450946142	FC	On-Demand	Mild	SLC6A3	23	40
CCc1cc(CCCN2CCC[C@@H](CNC(=O)c3ccco3)C2)on1	ZINC000450946143	EF	On-Demand	Anodyne	CCR3	27	41
CCc1cc(CCCN2CCC[C@H](CNC(=O)c3ccco3)C2)on1	ZINC000450946144	EF	On-Demand	Anodyne	CCR3	27	41
Cc1ccnc(-c2noc(CN3CCC[C@@H](CNC(=O)c4ccco4)C3)n2)c1	ZINC000450946153	GF	On-Demand	Anodyne	HRH3	19	40
Cc1ccnc(-c2noc(CN3CCC[C@@H](CNC(=O)c4ccco4)C3)n2)c1	ZINC000450946153	GF	On-Demand	Anodyne	CCR3	22	41
Cc1ccnc(-c2noc(CN3CCC[C@H](CNC(=O)c4ccco4)C3)n2)c1	ZINC000450946154	GF	On-Demand	Anodyne	HRH3	19	40
Cc1ccnc(-c2noc(CN3CCC[C@H](CNC(=O)c4ccco4)C3)n2)c1	ZINC000450946154	GF	On-Demand	Anodyne	CCR3	22	41
CCS(=O)(=O)c1ccc(CN(CCNC(C)=O)Cc2ccsc2)cc1	ZINC000450946159	GF	On-Demand	Anodyne	RORC	32	47
CNC(=O)N[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450946164	FC	On-Demand	Anodyne	CCKAR	24	40
CNC(=O)N[C@@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450946164	FC	On-Demand	Anodyne	EPHX2	45	63
CNC(=O)N[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450946165	FC	On-Demand	Anodyne	CCKAR	24	40
CNC(=O)N[C@H]1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450946165	FC	On-Demand	Anodyne	EPHX2	45	63
COC(=O)[C@H]1CN(c2ncnc3cccc(F)c23)C[C@@H]1c1ccccc1	ZINC000450946168	FG	On-Demand	Anodyne	SLC6A1	31	41
COC(=O)[C@H]1CN(c2ncnc3cccc(F)c23)C[C@H]1c1ccccc1	ZINC000450946169	FG	On-Demand	Anodyne	SLC6A1	31	41
COC(=O)[C@@H]1CN(c2ncnc3cccc(F)c23)C[C@H]1c1ccccc1	ZINC000450946170	FG	On-Demand	Anodyne	SLC6A1	31	41
COCCOC[C@H](O)CN1CCC[C@](CO)(c2ccccc2)C1	ZINC000450946175	DD	On-Demand	Anodyne	ABCB1	40	35
COCCOC[C@H](O)CN1CCC[C@](CO)(c2ccccc2)C1	ZINC000450946175	DD	On-Demand	Anodyne	HSP90AB1	39	41
COCCOC[C@H](O)CN1CCC[C@@](CO)(c2ccccc2)C1	ZINC000450946176	DD	On-Demand	Anodyne	ABCB1	40	35
COCCOC[C@H](O)CN1CCC[C@@](CO)(c2ccccc2)C1	ZINC000450946176	DD	On-Demand	Anodyne	HSP90AB1	39	41
COCCOC[C@@H](O)CN1CCC[C@](CO)(c2ccccc2)C1	ZINC000450946177	DD	On-Demand	Anodyne	ABCB1	40	35
COCCOC[C@@H](O)CN1CCC[C@](CO)(c2ccccc2)C1	ZINC000450946177	DD	On-Demand	Anodyne	HSP90AB1	39	41
COCCOC[C@@H](O)CN1CCC[C@@](CO)(c2ccccc2)C1	ZINC000450946178	DD	On-Demand	Anodyne	ABCB1	40	35
COCCOC[C@@H](O)CN1CCC[C@@](CO)(c2ccccc2)C1	ZINC000450946178	DD	On-Demand	Anodyne	HSP90AB1	39	41
COC(=O)[C@H]1CN(c2nccn(C(F)F)c2=O)C[C@@H]1c1ccccc1	ZINC000450946179	EE	On-Demand	Anodyne	SLC6A3	26	42
COC(=O)[C@H]1CN(c2nccn(C(F)F)c2=O)C[C@H]1c1ccccc1	ZINC000450946180	EE	On-Demand	Anodyne	SLC6A3	26	42
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1cc(C)cc(C)c1	ZINC000450946191	FG	On-Demand	Anodyne	GPR88	0	41
CCCOc1ccc(C(=O)Nc2c(C)cnn2Cc2ccccc2F)c(OC)c1	ZINC000450946204	GI	On-Demand	Anodyne	LUCI_LUCLA	15	41
CCCOc1ccc(C(=O)Nc2c(C)cnn2Cc2ccccc2F)c(OC)c1	ZINC000450946204	GI	On-Demand	Anodyne	KCNK3	45	34
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(F)c1)c1cc(C)cc(C)c1	ZINC000450946205	EF	On-Demand	Anodyne	FOLH1	37	43
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(F)c1)c1cc(C)cc(C)c1	ZINC000450946206	EF	On-Demand	Anodyne	FOLH1	37	43
CC[C@@H](Nc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946210	FC	On-Demand	Bother	TAAR1	18	48
CC[C@H](Nc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946211	FC	On-Demand	Bother	TAAR1	18	48
CC[C@@H](Nc1ccc(C(=O)N[C@H](C)C(=O)OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946212	FC	On-Demand	Bother	TAAR1	18	48
CC[C@H](Nc1ccc(C(=O)N[C@@H](C)C(=O)OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946213	FC	On-Demand	Bother	TAAR1	18	48
CC[C@H](Nc1ccc(F)cc1C#N)C(=O)NC	ZINC000450946216	BD	On-Demand	Mild	SDH1	0	41
CC[C@@H](Nc1ccc(F)cc1C#N)C(=O)NC	ZINC000450946217	BD	On-Demand	Mild	SDH1	0	41
C[C@@H]1C[C@@H](O)CN(c2nccc(Oc3ccccc3)n2)C1	ZINC000450946219	CE	On-Demand	Anodyne	SORD	43	35
C[C@H]1C[C@@H](O)CN(c2nccc(Oc3ccccc3)n2)C1	ZINC000450946220	CE	On-Demand	Anodyne	SORD	43	35
C[C@H]1C[C@H](O)CN(c2nccc(Oc3ccccc3)n2)C1	ZINC000450946221	CE	On-Demand	Anodyne	SORD	43	35
COC(=O)[C@H](NC(=O)c1cnn2ccc(C)cc12)c1ccc(C)c(C)c1	ZINC000450946222	FF	On-Demand	Anodyne	EPHB3	34	48
COC(=O)[C@@H](NC(=O)c1cnn2ccc(C)cc12)c1ccc(C)c(C)c1	ZINC000450946223	FF	On-Demand	Anodyne	EPHB3	34	48
CC[C@@H](Nc1ccc(Cl)cn1)C(=O)NC	ZINC000450946232	BD	On-Demand	Anodyne	F10	0	40
CC[C@H](Nc1ccc(Cl)cn1)C(=O)NC	ZINC000450946233	BD	On-Demand	Anodyne	F10	0	40
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(C)c(C)c1	ZINC000450946262	EF	On-Demand	Anodyne	FOLH1	46	46
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(C)c(C)c1	ZINC000450946262	EF	On-Demand	Anodyne	TRPV1	28	43
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(C)c(C)c1	ZINC000450946263	EF	On-Demand	Anodyne	FOLH1	46	46
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(C)c(C)c1	ZINC000450946263	EF	On-Demand	Anodyne	TRPV1	28	43
CC[C@H](Nc1cc(NCC2CC2)ncn1)C(=O)NC	ZINC000450946269	CD	On-Demand	Anodyne	GPR39	0	42
CC[C@@H](Nc1cc(NCC2CC2)ncn1)C(=O)NC	ZINC000450946270	CD	On-Demand	Anodyne	GPR39	0	42
COC(=O)c1ccccc1C(=O)c1ccc(N2C[C@@H](O)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000450946281	GF	On-Demand	Bother	TAAR1	19	43
COC(=O)c1ccccc1C(=O)c1ccc(N2C[C@H](C)C[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000450946282	GF	On-Demand	Bother	TAAR1	19	43
COC(=O)c1ccccc1C(=O)c1ccc(N2C[C@@H](C)C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000450946283	GF	On-Demand	Bother	TAAR1	19	43
CC(C)(C)OC1CC(SCC(=O)Nc2ccc(F)cc2)C1	ZINC000450946292	DH	On-Demand	Anodyne	FUCA1	22	40
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000450946293	EE	On-Demand	Bother	CASP3	24	40
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000450946293	EE	On-Demand	Bother	CASP7	50	38
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000450946294	EE	On-Demand	Bother	CASP3	24	40
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000450946294	EE	On-Demand	Bother	CASP7	50	38
CCS(=O)(=O)Cc1ccc(Nc2cc(C(F)(F)F)nc3ncnn23)cc1	ZINC000450946298	GF	On-Demand	Anodyne	DHOD	0	66
Cc1cccc([C@@H](C)Nc2cc(N3CCC[C@H](CO)C3)ncn2)c1	ZINC000450946299	EG	On-Demand	Anodyne	PRCP	0	60
Cc1cccc([C@H](C)Nc2cc(N3CCC[C@H](CO)C3)ncn2)c1	ZINC000450946300	EG	On-Demand	Anodyne	PRCP	0	60
Cc1cccc([C@@H](C)Nc2cc(N3CCC[C@@H](CO)C3)ncn2)c1	ZINC000450946301	EG	On-Demand	Anodyne	PRCP	0	60
Cc1cccc([C@H](C)Nc2cc(N3CCC[C@@H](CO)C3)ncn2)c1	ZINC000450946302	EG	On-Demand	Anodyne	PRCP	0	60
CCCCNc1cc(N2CCC[C@@H](COC)CC2)nc(N)n1	ZINC000450946309	DE	On-Demand	Anodyne	HRH4	45	48
CCCCNc1cc(N2CCC[C@H](COC)CC2)nc(N)n1	ZINC000450946317	DE	On-Demand	Anodyne	HRH4	45	48
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1ccc2c(c1)CCC2	ZINC000450946321	FG	On-Demand	Anodyne	ACOX1	35	44
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1ccc2c(c1)CCC2	ZINC000450946321	FG	On-Demand	Anodyne	CALCRL	41	38
O=C(CN1CCC(F)(c2ccccn2)CC1)Nc1ccc2c(c1)CCC2	ZINC000450946321	FG	On-Demand	Anodyne	NOD1	17	40
CNS(=O)(=O)c1cccc2c1CCN(Cc1nc(C(=O)OC)cs1)C2	ZINC000450946326	GD	On-Demand	Anodyne	NOD2	41	37
Cc1ccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)c(F)c1	ZINC000450946327	EG	On-Demand	Anodyne	DRD4	0	45
COc1ccc(N2CCN(c3ncnc4c(OC)cc(OC)cc34)CC2)nc1	ZINC000450946331	GE	On-Demand	Anodyne	PDE3A	50	40
COc1ccc(N2CCN(c3ncnc4c(OC)cc(OC)cc34)CC2)nc1	ZINC000450946331	GE	On-Demand	Anodyne	PDGFRB	74	39
COc1ccc(N2CCN(c3ncnc4c(OC)cc(OC)cc34)CC2)nc1	ZINC000450946331	GE	On-Demand	Anodyne	PDE3B	74	40
COc1ccc(N2CCN(c3ncnc4c(OC)cc(OC)cc34)CC2)nc1	ZINC000450946331	GE	On-Demand	Anodyne	PDE10A	15	40
CC(C)(C)C[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1	ZINC000450946337	FF	On-Demand	Anodyne	SLC6A9	32	40
CC(C)(C)C[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1	ZINC000450946337	FF	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1	ZINC000450946338	FF	On-Demand	Anodyne	SLC6A9	32	40
CC(C)(C)C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1	ZINC000450946338	FF	On-Demand	Anodyne	GPR119	37	42
COC[C@@H]1CCCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450946339	CD	On-Demand	Anodyne	DGAT1	18	41
COC[C@@H]1CCCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450946339	CD	On-Demand	Anodyne	HPGDS	19	41
COC[C@H]1CCCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450946341	CD	On-Demand	Anodyne	DGAT1	18	41
COC[C@H]1CCCN(c2ccc(C(N)=O)cn2)CC1	ZINC000450946341	CD	On-Demand	Anodyne	HPGDS	19	41
COc1ccc(N2CCN(c3ncnc4c(F)cccc34)CC2)nc1	ZINC000450946354	EE	On-Demand	Anodyne	ABCC1	65	38
COc1ccc(N2CCN(c3ncnc4c(F)cccc34)CC2)nc1	ZINC000450946354	EE	On-Demand	Anodyne	PDE3B	46	32
COc1ccc(N2CCN(c3ncc(Cl)cn3)CC2)nc1	ZINC000450946356	DD	On-Demand	Anodyne	NPBWR1	46	38
CCS(=O)(=O)Cc1ccc(Nc2nc(C)nc3c2CCCC3)cc1	ZINC000450946364	EG	On-Demand	Anodyne	PDE4B	19	46
COc1ccc(N2CCN(c3ncccc3S(C)(=O)=O)CC2)nc1	ZINC000450946366	ED	On-Demand	Anodyne	EBP	21	41
COC[C@@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946371	GG	On-Demand	Anodyne	PDE3A	44	32
COC[C@@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946371	GG	On-Demand	Anodyne	PDE3B	65	34
COC[C@@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946371	GG	On-Demand	Anodyne	SIRT3	51	31
COC[C@@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946371	GG	On-Demand	Anodyne	SIRT2	44	31
COC[C@@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946371	GG	On-Demand	Anodyne	SIRT1	49	31
COC[C@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946374	GG	On-Demand	Anodyne	PDE3A	44	32
COC[C@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946374	GG	On-Demand	Anodyne	PDE3B	65	34
COC[C@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946374	GG	On-Demand	Anodyne	SIRT3	51	31
COC[C@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946374	GG	On-Demand	Anodyne	SIRT2	44	31
COC[C@H]1CCCN(c2ncnc3cccc(I)c23)CC1	ZINC000450946374	GG	On-Demand	Anodyne	SIRT1	49	31
COc1ccc(N2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450946376	FF	On-Demand	Anodyne	PDE3A	61	48
COc1ccc(N2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450946376	FF	On-Demand	Anodyne	PDGFRB	91	46
COc1ccc(N2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450946376	FF	On-Demand	Anodyne	PDE3B	89	48
COc1ccc(N2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450946376	FF	On-Demand	Anodyne	PDGFRA	31	40
COc1ccc(N2CCN(c3ncnc4cc(F)c(OC)cc34)CC2)nc1	ZINC000450946376	FF	On-Demand	Anodyne	HTT	0	43
CCOc1cccc(CN(CCO)c2cnc3ccccc3n2)c1	ZINC000450946378	DG	On-Demand	Anodyne	CETP	0	44
CC(C)(C)C[C@H]1CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450946387	CE	On-Demand	Anodyne	HDAC1	0	40
CC(C)(C)C[C@H]1CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450946387	CE	On-Demand	Anodyne	SIRT2	53	34
CC(C)(C)C[C@H]1CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450946387	CE	On-Demand	Anodyne	SIRT1	52	33
CC(C)(C)C[C@@H]1CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450946388	CE	On-Demand	Anodyne	HDAC1	0	40
CC(C)(C)C[C@@H]1CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450946388	CE	On-Demand	Anodyne	SIRT2	53	34
CC(C)(C)C[C@@H]1CCN(c2ccc(C(N)=O)cn2)C1	ZINC000450946388	CE	On-Demand	Anodyne	SIRT1	52	33
COC[C@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946394	CG	On-Demand	Anodyne	PDE3A	44	33
COC[C@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946394	CG	On-Demand	Anodyne	PDE3B	66	35
COC[C@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946394	CG	On-Demand	Anodyne	SIRT3	50	33
COC[C@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946394	CG	On-Demand	Anodyne	SIRT2	50	33
COC[C@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946394	CG	On-Demand	Anodyne	SIRT1	50	33
COC[C@@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946396	CG	On-Demand	Anodyne	PDE3A	44	33
COC[C@@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946396	CG	On-Demand	Anodyne	PDE3B	66	35
COC[C@@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946396	CG	On-Demand	Anodyne	SIRT3	50	33
COC[C@@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946396	CG	On-Demand	Anodyne	SIRT2	50	33
COC[C@@H]1CCCN(c2ncnc3cccc(C)c23)CC1	ZINC000450946396	CG	On-Demand	Anodyne	SIRT1	50	33
NC(=O)c1cnc(N(CCN2CCOCC2)Cc2ccco2)c(Cl)c1	ZINC000450946397	FD	On-Demand	Anodyne	CASR	45	35
Cc1cccc([C@@H](C)Nc2cc(C)nc3ncnn23)c1	ZINC000450946404	CF	On-Demand	Anodyne	DHOD	0	55
Cc1cccc([C@H](C)Nc2cc(C)nc3ncnn23)c1	ZINC000450946405	CF	On-Demand	Anodyne	DHOD	0	55
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cn2)CC1	ZINC000450946411	CD	On-Demand	Anodyne	GPR119	28	51
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cn2)CC1	ZINC000450946412	CD	On-Demand	Anodyne	GPR119	28	51
O=C(COc1ccc(C(F)(F)F)cc1F)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000450946416	FG	On-Demand	Anodyne	LIPG	51	34
O=C(COc1ccc(C(F)(F)F)cc1F)N1CCO[C@H]2CCCC[C@H]21	ZINC000450946417	FG	On-Demand	Anodyne	LIPG	51	34
O=C(COc1ccc(C(F)(F)F)cc1F)N1CCO[C@@H]2CCCC[C@H]21	ZINC000450946418	FG	On-Demand	Anodyne	LIPG	51	34
O=C(COc1ccc(C(F)(F)F)cc1F)N1CCO[C@H]2CCCC[C@@H]21	ZINC000450946420	FG	On-Demand	Anodyne	LIPG	51	34
COC1(CSCc2ccc3c(c2)OCO3)CCC1	ZINC000450946427	CG	On-Demand	Anodyne	BMP1	17	40
CC(C)c1ccccc1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450946445	FH	On-Demand	Anodyne	ADRB2	48	61
CC(C)c1ccccc1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450946445	FH	On-Demand	Anodyne	ADRB1	0	49
CC(C)c1ccccc1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450946445	FH	On-Demand	Anodyne	ADRB3	55	61
CC(C)c1ccccc1OC[C@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450946445	FH	On-Demand	Anodyne	ABCB1	57	44
CC(C)c1ccccc1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450946447	FH	On-Demand	Anodyne	ADRB2	48	61
CC(C)c1ccccc1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450946447	FH	On-Demand	Anodyne	ADRB1	0	49
CC(C)c1ccccc1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450946447	FH	On-Demand	Anodyne	ADRB3	55	61
CC(C)c1ccccc1OC[C@@H](O)CN1CCC(F)(c2ccccn2)CC1	ZINC000450946447	FH	On-Demand	Anodyne	ABCB1	57	44
CCN(C(=O)CN1CCC(F)(c2ccccn2)CC1)C1CCCCC1	ZINC000450946448	EH	On-Demand	Anodyne	CCR5	44	37
CCN(C(=O)CN1CCC(F)(c2ccccn2)CC1)C1CCCCC1	ZINC000450946448	EH	On-Demand	Anodyne	SCARB1	41	37
CNC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)c([N+](=O)[O-])c1	ZINC000450946449	GD	On-Demand	Bother	CASR	40	37
COc1ccc(N2CCN(c3nccn4c(C5CC5)nnc34)CC2)nc1	ZINC000450946463	FD	On-Demand	Anodyne	EBP	27	44
COc1ccc(N2CCN(c3nc(C)cnc3C)CC2)nc1	ZINC000450946474	CD	On-Demand	Anodyne	EBP	17	42
Cn1nc(C(C)(C)C)cc1NC(=O)COc1ccc(C(F)(F)F)cc1F	ZINC000450946478	FH	On-Demand	Anodyne	TNF	46	34
CCOC(=O)c1ccc(CN2CCc3c(cccc3S(=O)(=O)NC)C2)nc1	ZINC000450946484	GD	On-Demand	Anodyne	P2RY12	29	44
CCOC(=O)c1ccc(CN2CCc3c(cccc3S(=O)(=O)NC)C2)nc1	ZINC000450946484	GD	On-Demand	Anodyne	NOD1	28	45
CCOC(=O)c1ccc(CN2CCc3c(cccc3S(=O)(=O)NC)C2)nc1	ZINC000450946484	GD	On-Demand	Anodyne	NOD2	44	45
CN(c1nc(C(F)F)nc2ccccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450946519	GI	On-Demand	Anodyne	HTR4	22	40
O=C(c1c(Cl)cc(Cl)cc1Cl)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450946521	GJ	On-Demand	Anodyne	AVPR1A	15	53
O=C(c1c(Cl)cc(Cl)cc1Cl)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450946522	GJ	On-Demand	Anodyne	AVPR1A	15	53
CC1(C)CN(Cc2cn(CC3CC3)nn2)C[C@@H](COc2ccccc2)O1	ZINC000450946555	FF	On-Demand	Anodyne	MAL12	0	43
CC1(C)CN(Cc2cn(CC3CC3)nn2)C[C@H](COc2ccccc2)O1	ZINC000450946556	FF	On-Demand	Anodyne	MAL12	0	43
CC[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)NC	ZINC000450946558	DD	On-Demand	Anodyne	DHOD	0	53
CC[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)C(=O)NC	ZINC000450946560	DD	On-Demand	Anodyne	DHOD	0	53
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccsc1	ZINC000450946564	EE	On-Demand	Anodyne	NCE103	25	41
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccsc1	ZINC000450946564	EE	On-Demand	Anodyne	CAN2	0	41
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccsc1	ZINC000450946565	EE	On-Demand	Anodyne	NCE103	25	41
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccsc1	ZINC000450946565	EE	On-Demand	Anodyne	CAN2	0	41
COc1cc(F)cc(C[C@@H](C)Nc2ccc(C(=O)N(C)C)cn2)c1	ZINC000450946585	EF	On-Demand	Anodyne	GCK	26	46
COC(=O)[C@@H](NC(=O)C[C@H]1COc2ccccc2O1)c1ccc(C)c(C)c1	ZINC000450946587	FF	On-Demand	Anodyne	ADRA1B	15	44
COC(=O)[C@@H](NC(=O)C[C@H]1COc2ccccc2O1)c1ccc(C)c(C)c1	ZINC000450946587	FF	On-Demand	Anodyne	ADRA2B	17	44
COc1cc(F)cc(C[C@H](C)Nc2ccc(C(=O)N(C)C)cn2)c1	ZINC000450946588	EF	On-Demand	Anodyne	GCK	26	46
COC(=O)[C@H](NC(=O)C[C@H]1COc2ccccc2O1)c1ccc(C)c(C)c1	ZINC000450946589	FF	On-Demand	Anodyne	ADRA1B	15	44
COC(=O)[C@H](NC(=O)C[C@H]1COc2ccccc2O1)c1ccc(C)c(C)c1	ZINC000450946589	FF	On-Demand	Anodyne	ADRA2B	17	44
COC(=O)[C@H](NC(=O)C[C@@H]1COc2ccccc2O1)c1ccc(C)c(C)c1	ZINC000450946591	FF	On-Demand	Anodyne	ADRA1B	15	44
COC(=O)[C@H](NC(=O)C[C@@H]1COc2ccccc2O1)c1ccc(C)c(C)c1	ZINC000450946591	FF	On-Demand	Anodyne	ADRA2B	17	44
COC(=O)[C@@H](NC(=O)C[C@@H]1COc2ccccc2O1)c1ccc(C)c(C)c1	ZINC000450946593	FF	On-Demand	Anodyne	ADRA1B	15	44
COC(=O)[C@@H](NC(=O)C[C@@H]1COc2ccccc2O1)c1ccc(C)c(C)c1	ZINC000450946593	FF	On-Demand	Anodyne	ADRA2B	17	44
CCC1(CC)CN(C(=O)CCOc2cccc(OC)c2)CC[S@@]1=O	ZINC000450946603	FF	On-Demand	Anodyne	MTNR1A	28	41
C[C@H](O)CCSCC(=O)Nc1ccccc1	ZINC000450946604	BE	On-Demand	Anodyne	LTA4H	31	41
C[C@H](O)CCSCC(=O)Nc1ccccc1	ZINC000450946604	BE	On-Demand	Anodyne	HDAC3	21	40
C[C@H](O)CCSCC(=O)Nc1ccccc1	ZINC000450946604	BE	On-Demand	Anodyne	HDAC11	22	40
CCC1(CC)CN(C(=O)CCOc2cccc(OC)c2)CC[S@]1=O	ZINC000450946605	FF	On-Demand	Anodyne	MTNR1A	28	41
C[C@@H](O)CCSCC(=O)Nc1ccccc1	ZINC000450946606	BE	On-Demand	Anodyne	LTA4H	31	41
C[C@@H](O)CCSCC(=O)Nc1ccccc1	ZINC000450946606	BE	On-Demand	Anodyne	HDAC3	21	40
C[C@@H](O)CCSCC(=O)Nc1ccccc1	ZINC000450946606	BE	On-Demand	Anodyne	HDAC11	22	40
Cn1ccnc1[C@@H]1C[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450946629	GF	On-Demand	Bother	MAPK13	55	36
CC[C@@H](Nc1cc(-c2ccccc2)nc2ncnn12)C(=O)NC	ZINC000450946631	DD	On-Demand	Anodyne	DHOD	0	43
Cn1ccnc1[C@H]1C[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450946632	GF	On-Demand	Bother	MAPK13	55	36
CC[C@H](Nc1cc(-c2ccccc2)nc2ncnn12)C(=O)NC	ZINC000450946633	DD	On-Demand	Anodyne	DHOD	0	43
Cn1ccnc1[C@H]1C[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450946634	GF	On-Demand	Bother	MAPK13	55	36
COC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1C)c1ccsc1	ZINC000450946635	FH	On-Demand	Anodyne	MTTP	54	34
Cn1ccnc1[C@@H]1C[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCO1	ZINC000450946636	GF	On-Demand	Bother	MAPK13	55	36
COC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1C)c1ccsc1	ZINC000450946637	FH	On-Demand	Anodyne	MTTP	54	34
CC[C@H](O)CC(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450946657	DF	On-Demand	Anodyne	CCR3	35	40
CC[C@@H](O)CC(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450946658	DF	On-Demand	Anodyne	CCR3	35	40
CCOC(=O)c1ccc(N[C@H]2CCO[C@H](c3nccn3C)C2)nc1	ZINC000450946660	EE	On-Demand	Anodyne	SSTR5	40	36
CCOC(=O)c1ccc(N[C@@H]2CCO[C@H](c3nccn3C)C2)nc1	ZINC000450946661	EE	On-Demand	Anodyne	SSTR5	40	36
CCOC(=O)c1ccc(N[C@H]2CCO[C@@H](c3nccn3C)C2)nc1	ZINC000450946662	EE	On-Demand	Anodyne	SSTR5	40	36
CCOC(=O)c1ccc(N[C@@H]2CCO[C@@H](c3nccn3C)C2)nc1	ZINC000450946664	EE	On-Demand	Anodyne	SSTR5	40	36
Cc1nsc2ncn(CCCOc3cccc(C(F)(F)F)c3)c(=O)c12	ZINC000450946675	FH	On-Demand	Anodyne	GALR3	72	38
Cc1nsc2ncn(CCCOc3cccc(C(F)(F)F)c3)c(=O)c12	ZINC000450946675	FH	On-Demand	Anodyne	PDS	41	35
COc1cc(CC(=O)N2CC[C@H](Nc3ccc4nccn4n3)C2)ccc1O	ZINC000450946694	FD	On-Demand	Anodyne	SSTR5	46	34
COc1cc(CC(=O)N2CC[C@@H](Nc3ccc4nccn4n3)C2)ccc1O	ZINC000450946695	FD	On-Demand	Anodyne	SSTR5	46	34
COC(=O)[C@H]1CN(c2ncnc3c(C)cccc23)C[C@@H]1c1ccccc1	ZINC000450946696	EG	On-Demand	Anodyne	SLC6A1	31	43
COC(=O)[C@H]1CN(c2ncnc3c(C)cccc23)C[C@H]1c1ccccc1	ZINC000450946697	EG	On-Demand	Anodyne	SLC6A1	31	43
COC(=O)[C@@H]1CN(c2ncnc3c(C)cccc23)C[C@H]1c1ccccc1	ZINC000450946698	EG	On-Demand	Anodyne	SLC6A1	31	43
COC(=O)[C@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450946704	GG	On-Demand	Anodyne	SLC6A1	22	40
COC(=O)[C@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450946704	GG	On-Demand	Anodyne	PDE3A	45	35
COC(=O)[C@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450946704	GG	On-Demand	Anodyne	PDGFRB	40	39
COC(=O)[C@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@@H]1c1ccccc1	ZINC000450946704	GG	On-Demand	Anodyne	PDE3B	67	35
COC(=O)[C@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1c1ccccc1	ZINC000450946705	GG	On-Demand	Anodyne	SLC6A1	22	40
COC(=O)[C@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1c1ccccc1	ZINC000450946705	GG	On-Demand	Anodyne	PDE3A	45	35
COC(=O)[C@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1c1ccccc1	ZINC000450946705	GG	On-Demand	Anodyne	PDGFRB	40	39
COC(=O)[C@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1c1ccccc1	ZINC000450946705	GG	On-Demand	Anodyne	PDE3B	67	35
COC(=O)[C@@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1c1ccccc1	ZINC000450946706	GG	On-Demand	Anodyne	SLC6A1	22	40
COC(=O)[C@@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1c1ccccc1	ZINC000450946706	GG	On-Demand	Anodyne	PDE3A	45	35
COC(=O)[C@@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1c1ccccc1	ZINC000450946706	GG	On-Demand	Anodyne	PDGFRB	40	39
COC(=O)[C@@H]1CN(c2ncnc3c(OC)cc(OC)cc23)C[C@H]1c1ccccc1	ZINC000450946706	GG	On-Demand	Anodyne	PDE3B	67	35
CS(=O)(=O)N1CC[C@@H](Cn2c(-c3ccc(F)c(Cl)c3)noc2=O)C1	ZINC000450946722	GD	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	34
COc1ccc(N2CCN(c3nnc(-c4ccccc4)s3)CC2)nc1	ZINC000450946730	FF	On-Demand	Anodyne	SMO	34	40
COc1ccc(N2CCN(c3ncccc3Br)CC2)nc1	ZINC000450946733	EF	On-Demand	Anodyne	EBP	21	41
COc1ccc(N2CCN(c3nc(-c4ccccn4)nc(C)c3C)CC2)nc1	ZINC000450946738	GF	On-Demand	Anodyne	DRD4	25	40
COc1ccc(N2CCN(c3nc(-c4ccccn4)nc(C)c3C)CC2)nc1	ZINC000450946738	GF	On-Demand	Anodyne	METAP1	43	40
COc1ccc(N2CCN(c3nc(-c4ccccn4)nc(C)c3C)CC2)nc1	ZINC000450946738	GF	On-Demand	Anodyne	EBP	23	43
COc1ccc(N2CCN(c3nc(-c4ccccn4)nc(C)c3C)CC2)nc1	ZINC000450946738	GF	On-Demand	Anodyne	TGFB1	0	41
CC(C)(C)OC(=O)c1cccc(N(CCN2CCOCC2)Cc2ccco2)n1	ZINC000450946746	GF	On-Demand	Anodyne	CASR	45	41
COc1ccc(N2CCN(c3nc4ccccc4n3C)CC2)nc1	ZINC000450946749	DE	On-Demand	Anodyne	HRH1	32	50
COc1ccc(N2CCN(c3nc4ccccc4n3C)CC2)nc1	ZINC000450946749	DE	On-Demand	Anodyne	EBP	23	41
CCN(C(=O)[C@H](C)N1CCC(F)(c2ccccn2)CC1)C1CCCCC1	ZINC000450946751	FH	On-Demand	Anodyne	SCARB1	40	35
CCN(C(=O)[C@@H](C)N1CCC(F)(c2ccccn2)CC1)C1CCCCC1	ZINC000450946752	FH	On-Demand	Anodyne	SCARB1	40	35
COc1ccc(-c2noc(CSCc3ccc4c(c3)OCO4)n2)nn1	ZINC000450946756	FF	On-Demand	Anodyne	GSK3A	24	42
Cc1cccc(NC(=O)[C@H](C)N2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946757	EH	On-Demand	Anodyne	SLC11A2	16	40
Cc1cccc(NC(=O)[C@H](C)N2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946757	EH	On-Demand	Anodyne	KCNK3	55	34
Cc1cccc(NC(=O)[C@H](C)N2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946757	EH	On-Demand	Anodyne	KCNK9	40	34
Cc1cccc(NC(=O)[C@@H](C)N2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946758	EH	On-Demand	Anodyne	SLC11A2	16	40
Cc1cccc(NC(=O)[C@@H](C)N2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946758	EH	On-Demand	Anodyne	KCNK3	55	34
Cc1cccc(NC(=O)[C@@H](C)N2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946758	EH	On-Demand	Anodyne	KCNK9	40	34
COC(=O)[C@@H](NC(=O)c1cnn(C(C)(C)C)c1)c1ccc(O)cc1	ZINC000450946760	ED	On-Demand	Anodyne	AMP1_PLAFQ	41	34
COC(=O)[C@H](NC(=O)c1cnn(C(C)(C)C)c1)c1ccc(O)cc1	ZINC000450946761	ED	On-Demand	Anodyne	AMP1_PLAFQ	41	34
CS(=O)(=O)N1CC[C@H](Cn2c(-c3ccc(F)c(Cl)c3)noc2=O)C1	ZINC000450946762	GD	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	34
COC(=O)c1csc(CSCc2ccc3c(c2)OCO3)n1	ZINC000450946763	DG	On-Demand	Anodyne	EDNRA	27	41
COC(=O)c1csc(CSCc2ccc3c(c2)OCO3)n1	ZINC000450946763	DG	On-Demand	Anodyne	BMP1	50	43
COC(=O)c1csc(CSCc2ccc3c(c2)OCO3)n1	ZINC000450946763	DG	On-Demand	Anodyne	DYRK2	51	32
CNC(=O)c1ccc(N2CCCC[C@@H]2COC)c([N+](=O)[O-])c1	ZINC000450946770	DD	On-Demand	Bother	CASP3	40	36
CNC(=O)c1ccc(N2CCCC[C@@H]2COC)c([N+](=O)[O-])c1	ZINC000450946770	DD	On-Demand	Bother	CASP7	50	36
CNC(=O)c1ccc(N2CCCC[C@@H]2COC)c([N+](=O)[O-])c1	ZINC000450946770	DD	On-Demand	Bother	TAAR1	18	43
CNC(=O)c1ccc(N2CCCC[C@H]2COC)c([N+](=O)[O-])c1	ZINC000450946771	DD	On-Demand	Bother	CASP3	40	36
CNC(=O)c1ccc(N2CCCC[C@H]2COC)c([N+](=O)[O-])c1	ZINC000450946771	DD	On-Demand	Bother	CASP7	50	36
CNC(=O)c1ccc(N2CCCC[C@H]2COC)c([N+](=O)[O-])c1	ZINC000450946771	DD	On-Demand	Bother	TAAR1	18	43
COc1ccc(N2CCN(c3ccc(C#N)cc3)CC2)nc1	ZINC000450946795	CE	On-Demand	Mild	SMO	0	44
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450946796	FE	On-Demand	Anodyne	SLC6A3	21	43
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450946796	FE	On-Demand	Anodyne	AMY2	54	33
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450946797	FE	On-Demand	Anodyne	SLC6A3	21	43
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450946797	FE	On-Demand	Anodyne	AMY2	54	33
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450946798	FE	On-Demand	Anodyne	SLC6A3	21	43
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450946798	FE	On-Demand	Anodyne	AMY2	54	33
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450946799	FE	On-Demand	Anodyne	SLC6A3	21	43
CCOC(=O)[C@H]1CC[C@H](C(=O)OCC)N1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450946799	FE	On-Demand	Anodyne	AMY2	54	33
COC(=O)[C@@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450946814	FF	On-Demand	Bother	SLC6A1	30	40
COC(=O)[C@@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000450946814	FF	On-Demand	Bother	AKR1C2	25	41
COC(=O)[C@@H]1CN(c2cc(C)nc(C(C)C)n2)C[C@H]1c1ccccc1	ZINC000450946815	EG	On-Demand	Anodyne	SLC6A1	52	41
COC(=O)[C@@H]1CN(c2cc(C)nc(C(C)C)n2)C[C@H]1c1ccccc1	ZINC000450946815	EG	On-Demand	Anodyne	SLC6A3	22	41
COC(=O)[C@H]1CN(c2cc(C)nc(C(C)C)n2)C[C@H]1c1ccccc1	ZINC000450946816	EG	On-Demand	Anodyne	SLC6A1	52	41
COC(=O)[C@H]1CN(c2cc(C)nc(C(C)C)n2)C[C@H]1c1ccccc1	ZINC000450946816	EG	On-Demand	Anodyne	SLC6A3	22	41
COC(=O)[C@H]1CN(c2cc(C)nc(C(C)C)n2)C[C@@H]1c1ccccc1	ZINC000450946817	EG	On-Demand	Anodyne	SLC6A1	52	41
COC(=O)[C@H]1CN(c2cc(C)nc(C(C)C)n2)C[C@@H]1c1ccccc1	ZINC000450946817	EG	On-Demand	Anodyne	SLC6A3	22	41
CCOc1cccc(CN(CCO)c2ncc(Cl)cn2)c1	ZINC000450946819	DF	On-Demand	Anodyne	CETP	0	41
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1c1ccccc1	ZINC000450946826	FG	On-Demand	Bother	SLC6A1	29	40
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1c1ccccc1	ZINC000450946826	FG	On-Demand	Bother	CACNA1D	40	34
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@@H]1c1ccccc1	ZINC000450946827	FG	On-Demand	Bother	SLC6A1	29	40
COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@@H]1c1ccccc1	ZINC000450946827	FG	On-Demand	Bother	CACNA1D	40	34
COC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1c1ccccc1	ZINC000450946828	FG	On-Demand	Bother	SLC6A1	29	40
COC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1c1ccccc1	ZINC000450946828	FG	On-Demand	Bother	CACNA1D	40	34
COC(=O)c1coc(CSCc2ccc3c(c2)OCO3)n1	ZINC000450946829	DF	On-Demand	Anodyne	BMP1	46	41
COC(=O)c1coc(CSCc2ccc3c(c2)OCO3)n1	ZINC000450946829	DF	On-Demand	Anodyne	NOS2	41	31
COc1ccc(N2CCN(c3ccnc4c(OC)cccc34)CC2)nc1	ZINC000450946833	FF	On-Demand	Anodyne	HTR1A	44	39
COc1ccc(N2CCN(c3ccnc4c(OC)cccc34)CC2)nc1	ZINC000450946833	FF	On-Demand	Anodyne	ADRA1D	21	41
COc1ccc(N2CCN(c3ccnc4c(OC)cccc34)CC2)nc1	ZINC000450946833	FF	On-Demand	Anodyne	ADRA1A	21	43
COc1ccc(N2CCN(c3ccnc4c(OC)cccc34)CC2)nc1	ZINC000450946833	FF	On-Demand	Anodyne	ADRA1B	16	41
COc1ccc(N2CCN(c3ccnc4c(OC)cccc34)CC2)nc1	ZINC000450946833	FF	On-Demand	Anodyne	DRD3	29	42
COC(=O)[C@H]1CN(c2ncc(Br)cn2)C[C@H]1c1ccccc1	ZINC000450946839	FF	On-Demand	Anodyne	SLC6A1	80	45
COC(=O)[C@H]1CN(c2ncc(Br)cn2)C[C@@H]1c1ccccc1	ZINC000450946840	FF	On-Demand	Anodyne	SLC6A1	80	45
NC(=O)c1ccc(N(CCN2CCOCC2)Cc2ccco2)nc1	ZINC000450946843	ED	On-Demand	Anodyne	CASR	42	35
COc1ccc(N2CCN(c3ccc(C#N)c(C(F)(F)F)c3)CC2)nc1	ZINC000450946845	FG	On-Demand	Mild	AR	58	50
CSc1cccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946854	FH	On-Demand	Anodyne	DRD4	0	51
CSc1cccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946854	FH	On-Demand	Anodyne	CALCRL	48	36
CSc1cccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946854	FH	On-Demand	Anodyne	PANK1	0	40
CSc1cccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946854	FH	On-Demand	Anodyne	PANK2	0	40
CSc1cccc(NC(=O)CN2CCC(F)(c3ccccn3)CC2)c1	ZINC000450946854	FH	On-Demand	Anodyne	PANK3	0	40
COc1ccc(N2CCN(c3cc(=O)n4ccccc4n3)CC2)nc1	ZINC000450946859	ED	On-Demand	Anodyne	SLC27A1	19	45
COC[C@@H]1CCCN(c2ccnc(N(C)C)n2)CC1	ZINC000450946864	CD	On-Demand	Anodyne	SORD	55	35
COC[C@H]1CCCN(c2ccnc(N(C)C)n2)CC1	ZINC000450946865	CD	On-Demand	Anodyne	SORD	55	35
COC[C@H]1CCCN(c2nccc3c(OC)cccc23)CC1	ZINC000450946867	DG	On-Demand	Anodyne	PDE3A	46	36
COC[C@H]1CCCN(c2nccc3c(OC)cccc23)CC1	ZINC000450946867	DG	On-Demand	Anodyne	PDE3B	69	37
COC[C@@H]1CCCN(c2nccc3c(OC)cccc23)CC1	ZINC000450946868	DG	On-Demand	Anodyne	PDE3A	46	36
COC[C@@H]1CCCN(c2nccc3c(OC)cccc23)CC1	ZINC000450946868	DG	On-Demand	Anodyne	PDE3B	69	37
COC[C@H]1CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450946877	GE	On-Demand	Bother	SLC6A9	19	41
COC[C@H]1CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450946877	GE	On-Demand	Bother	L3MBTL1	0	41
COC[C@H]1CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450946877	GE	On-Demand	Bother	L3MBTL3	17	41
COC[C@@H]1CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450946878	GE	On-Demand	Bother	SLC6A9	19	41
COC[C@@H]1CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450946878	GE	On-Demand	Bother	L3MBTL1	0	41
COC[C@@H]1CCCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000450946878	GE	On-Demand	Bother	L3MBTL3	17	41
COC[C@@H]1CCCN(c2ccc(C#N)cn2)CC1	ZINC000450946890	BE	On-Demand	Mild	SMO	0	46
COC[C@H]1CCCN(c2ccc(C#N)cn2)CC1	ZINC000450946891	BE	On-Demand	Mild	SMO	0	46
CCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nn1	ZINC000450946895	CD	On-Demand	Anodyne	SCD1	52	46
CCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nn1	ZINC000450946895	CD	On-Demand	Anodyne	SCD	25	47
CCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nn1	ZINC000450946896	CD	On-Demand	Anodyne	SCD1	52	46
CCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nn1	ZINC000450946896	CD	On-Demand	Anodyne	SCD	25	47
CCS(=O)(=O)Cc1ccc(Nc2cc(COC)nc3ncnn23)cc1	ZINC000450946906	FD	On-Demand	Anodyne	DHOD	0	54
COC[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450946907	DI	On-Demand	Anodyne	HRP1_PLAFA	105	40
COC[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450946907	DI	On-Demand	Anodyne	CCR4	16	40
COC[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450946907	DI	On-Demand	Anodyne	HNMT	54	38
COC[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450946908	DI	On-Demand	Anodyne	HRP1_PLAFA	85	37
COC[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450946908	DI	On-Demand	Anodyne	CCR4	16	40
COC[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000450946908	DI	On-Demand	Anodyne	HNMT	54	38
CCS(=O)(=O)Cc1ccc(Nc2nccc(C)n2)cc1	ZINC000450946910	CE	On-Demand	Anodyne	CCNT1	0	40
CCS(=O)(=O)Cc1ccc(Nc2nccc(C)n2)cc1	ZINC000450946910	CE	On-Demand	Anodyne	CCNB1	0	40
CCS(=O)(=O)Cc1ccc(Nc2nccc(C)n2)cc1	ZINC000450946910	CE	On-Demand	Anodyne	IKBKB	24	41
CCS(=O)(=O)Cc1ccc(Nc2nccc(C)n2)cc1	ZINC000450946910	CE	On-Demand	Anodyne	CCNE1	0	40
CCS(=O)(=O)Cc1ccc(Nc2nccc(C)n2)cc1	ZINC000450946910	CE	On-Demand	Anodyne	CDK1	0	40
CCS(=O)(=O)Cc1ccc(Nc2nccc(C)n2)cc1	ZINC000450946910	CE	On-Demand	Anodyne	CCND3	0	40
CCS(=O)(=O)Cc1ccc(Nc2nccc(C)n2)cc1	ZINC000450946910	CE	On-Demand	Anodyne	CDK4	50	40
CCS(=O)(=O)Cc1ccc(Nc2nccc(C)n2)cc1	ZINC000450946910	CE	On-Demand	Anodyne	DKK1	0	44
CCS(=O)(=O)Cc1ccc(Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	ZINC000450946911	GI	On-Demand	Bother	AKR1C4	0	53
COC[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946936	DG	On-Demand	Anodyne	PDE3A	53	39
COC[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946936	DG	On-Demand	Anodyne	PDGFRB	70	42
COC[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946936	DG	On-Demand	Anodyne	PDE3B	78	40
COC[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946936	DG	On-Demand	Anodyne	SIRT3	51	35
COC[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946936	DG	On-Demand	Anodyne	SIRT2	51	33
COC[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946936	DG	On-Demand	Anodyne	SIRT1	50	32
COC[C@@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946936	DG	On-Demand	Anodyne	HTT	0	43
COC[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946937	DG	On-Demand	Anodyne	PDE3A	53	39
COC[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946937	DG	On-Demand	Anodyne	PDGFRB	70	42
COC[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946937	DG	On-Demand	Anodyne	PDE3B	78	40
COC[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946937	DG	On-Demand	Anodyne	SIRT3	51	35
COC[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946937	DG	On-Demand	Anodyne	SIRT2	51	33
COC[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946937	DG	On-Demand	Anodyne	SIRT1	50	32
COC[C@H]1CCCN(c2ncnc3cc(F)c(F)cc23)CC1	ZINC000450946937	DG	On-Demand	Anodyne	HTT	0	43
COC[C@H]1CCCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000450946954	CG	On-Demand	Mild	HTR4	32	40
COC[C@H]1CCCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000450946954	CG	On-Demand	Mild	DPP4	22	40
COC[C@@H]1CCCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000450946955	CG	On-Demand	Mild	HTR4	32	40
COC[C@@H]1CCCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000450946955	CG	On-Demand	Mild	DPP4	22	40
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C1	ZINC000450946973	GC	On-Demand	Bother	BCL2L1	85	32
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C1	ZINC000450946973	GC	On-Demand	Bother	BCL2	77	32
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C1	ZINC000450946974	GC	On-Demand	Bother	BCL2L1	85	32
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C1	ZINC000450946974	GC	On-Demand	Bother	BCL2	77	32
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C1	ZINC000450946975	GC	On-Demand	Bother	BCL2L1	85	32
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)NCCN(C)C)cc2[N+](=O)[O-])C1	ZINC000450946975	GC	On-Demand	Bother	BCL2	77	32
CC[C@@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946984	DD	On-Demand	Bother	TAAR1	16	42
CC[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])C(=O)NC	ZINC000450946985	DD	On-Demand	Bother	TAAR1	16	42
COC(=O)[C@@H](NC(=O)CCc1nc2cnccc2[nH]1)c1ccc(C)c(C)c1	ZINC000450947000	FF	On-Demand	Anodyne	ENPP1	42	33
COC(=O)[C@H](NC(=O)CCc1nc2cnccc2[nH]1)c1ccc(C)c(C)c1	ZINC000450947001	FF	On-Demand	Anodyne	ENPP1	42	33
CC(=O)c1ccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1	ZINC000450947016	DG	On-Demand	Anodyne	DRD2	26	45
CC(=O)c1ccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1	ZINC000450947016	DG	On-Demand	Anodyne	DRD4	48	45
CC(=O)c1ccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1	ZINC000450947016	DG	On-Demand	Anodyne	ACHE	26	50
CC(=O)c1ccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1	ZINC000450947016	DG	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1	ZINC000450947016	DG	On-Demand	Anodyne	NOD2	40	34
CC(=O)c1ccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1	ZINC000450947017	DG	On-Demand	Anodyne	DRD2	26	45
CC(=O)c1ccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1	ZINC000450947017	DG	On-Demand	Anodyne	DRD4	48	45
CC(=O)c1ccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1	ZINC000450947017	DG	On-Demand	Anodyne	ACHE	26	50
CC(=O)c1ccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1	ZINC000450947017	DG	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1	ZINC000450947017	DG	On-Demand	Anodyne	NOD2	40	34
CCc1cc(=N[C@@H](CC)C(=O)NC)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450947049	ED	On-Demand	Bother	GYRB	43	39
CCc1cc(=N[C@H](CC)C(=O)NC)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000450947051	ED	On-Demand	Bother	GYRB	43	39
CO[C@@H](Cc1ccccc1)Cn1cnc2ccc(S(C)(=O)=O)cc2c1=O	ZINC000450947095	FE	On-Demand	Anodyne	NR1I2	42	35
CO[C@H](Cc1ccccc1)Cn1cnc2ccc(S(C)(=O)=O)cc2c1=O	ZINC000450947096	FE	On-Demand	Anodyne	NR1I2	42	35
COc1cc(CC(=O)NC(C)(C)c2nc3ccccc3n2C)ccc1Cl	ZINC000450947097	FH	On-Demand	Anodyne	IMDH_CRYPV	38	41
COC[C@@H]1C[C@H](OC)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450947102	DF	On-Demand	Anodyne	DRD4	0	43
COC[C@@H]1C[C@@H](OC)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450947103	DF	On-Demand	Anodyne	DRD4	0	43
C[C@@H](c1ccccc1)N1CCN(C(=O)Cn2cc(C#N)cn2)CC1	ZINC000450947125	DD	On-Demand	Mild	PTAFR	24	42
C[C@H](c1ccccc1)N1CCN(C(=O)Cn2cc(C#N)cn2)CC1	ZINC000450947126	DD	On-Demand	Mild	PTAFR	24	42
Cc1ccccc1CN1CCC(NC(=O)Cn2cc(C#N)cn2)CC1	ZINC000450947135	ED	On-Demand	Mild	SIGMAR1	23	49
Cc1ccccc1CN1CCC(NC(=O)Cn2cc(C#N)cn2)CC1	ZINC000450947135	ED	On-Demand	Mild	CCR3	25	40
Cc1ccccc1CN1CCC(NC(=O)Cn2cc(C#N)cn2)CC1	ZINC000450947135	ED	On-Demand	Mild	MCHR1	27	43
COC(=O)c1ccc(CN2CCC[C@H]2Cn2ccnn2)cc1Cl	ZINC000450947144	EE	On-Demand	Anodyne	OPRK1	29	43
COc1cc(CN2CCN(C)[C@H](c3nc(C4CC4)no3)C2)ccc1Cl	ZINC000450947145	FG	On-Demand	Anodyne	DRD4	16	43
COc1cc(CN2CCN(C)[C@H](c3nc(C4CC4)no3)C2)ccc1Cl	ZINC000450947145	FG	On-Demand	Anodyne	SSTR5	48	36
COc1cc(CN2CCN(C)[C@@H](c3nc(C4CC4)no3)C2)ccc1Cl	ZINC000450947146	FG	On-Demand	Anodyne	DRD4	16	43
COc1cc(CN2CCN(C)[C@@H](c3nc(C4CC4)no3)C2)ccc1Cl	ZINC000450947146	FG	On-Demand	Anodyne	SSTR5	48	36
COc1cc(CN2C[C@@H](OC)C[C@H]2C(=O)N2CCCC2)ccc1Cl	ZINC000450947152	FF	On-Demand	Anodyne	OPRK1	28	40
COC(=O)[C@H]1CN(c2cnc(C#N)cn2)C[C@@H]1c1ccccc1	ZINC000450947168	DD	On-Demand	Mild	SLC6A1	72	41
COC(=O)[C@H]1CN(c2cnc(C#N)cn2)C[C@H]1c1ccccc1	ZINC000450947169	DD	On-Demand	Mild	SLC6A1	72	41
COC(=O)[C@H]1CN(c2nc(-c3ccncc3)nc(C)c2C)C[C@H]1c1ccccc1	ZINC000450947179	GH	On-Demand	Anodyne	SLC6A1	30	42
COC(=O)[C@H]1CN(c2nc(-c3ccncc3)nc(C)c2C)C[C@H]1c1ccccc1	ZINC000450947179	GH	On-Demand	Anodyne	SLC6A3	15	45
COC(=O)[C@H]1CN(c2nc(-c3ccncc3)nc(C)c2C)C[C@@H]1c1ccccc1	ZINC000450947180	GH	On-Demand	Anodyne	SLC6A1	30	42
COC(=O)[C@H]1CN(c2nc(-c3ccncc3)nc(C)c2C)C[C@@H]1c1ccccc1	ZINC000450947180	GH	On-Demand	Anodyne	SLC6A3	15	45
COC(=O)[C@@H]1CN(c2nc(-c3ccncc3)nc(C)c2C)C[C@H]1c1ccccc1	ZINC000450947181	GH	On-Demand	Anodyne	SLC6A1	30	42
COC(=O)[C@@H]1CN(c2nc(-c3ccncc3)nc(C)c2C)C[C@H]1c1ccccc1	ZINC000450947181	GH	On-Demand	Anodyne	SLC6A3	15	45
COc1ccc(CN2CCCN(C(=O)c3c(C)cccc3Cl)CC2=O)cc1	ZINC000450947189	GH	On-Demand	Anodyne	P2RX7	18	41
O=C(NCC(F)(F)CO)c1cc(C(F)(F)F)n[nH]1	ZINC000450947195	CC	On-Demand	Anodyne	ALPL	53	39
COC[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450947210	BD	On-Demand	Anodyne	AKT1	32	40
COC[C@@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450947210	BD	On-Demand	Anodyne	TYK2	0	40
COC[C@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450947211	BD	On-Demand	Anodyne	AKT1	32	40
COC[C@H]1CCCCN1c1ncnc2[nH]ccc12	ZINC000450947211	BD	On-Demand	Anodyne	TYK2	0	40
COC(=O)[C@H]1CN(c2cc(C)nc(-c3ccncc3)n2)C[C@@H]1c1ccccc1	ZINC000450947229	FG	On-Demand	Anodyne	SLC6A1	31	41
COC(=O)[C@H]1CN(c2cc(C)nc(-c3ccncc3)n2)C[C@H]1c1ccccc1	ZINC000450947231	FG	On-Demand	Anodyne	SLC6A1	31	41
COC(=O)[C@@H]1CN(c2cc(C)nc(-c3ccncc3)n2)C[C@H]1c1ccccc1	ZINC000450947233	FG	On-Demand	Anodyne	SLC6A1	31	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450947242	FF	On-Demand	Anodyne	HTR4	44	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450947244	FF	On-Demand	Anodyne	HTR4	44	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000450947246	FF	On-Demand	Anodyne	HTR4	44	41
C[C@H]1C[C@H](O)CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450947247	ED	On-Demand	Anodyne	LRRK2	21	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000450947248	FF	On-Demand	Anodyne	HTR4	44	41
C[C@@H]1C[C@@H](O)CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450947251	ED	On-Demand	Anodyne	LRRK2	21	40
C[C@H]1C[C@@H](O)CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450947254	ED	On-Demand	Anodyne	LRRK2	21	40
COC(=O)[C@H]1CN(c2nc(C)cc(C(F)(F)F)n2)C[C@H]1c1ccccc1	ZINC000450947263	FG	On-Demand	Anodyne	SLC6A1	52	42
COC(=O)[C@H]1CN(c2nc(C)cc(C(F)(F)F)n2)C[C@H]1c1ccccc1	ZINC000450947263	FG	On-Demand	Anodyne	SLC6A3	21	41
COC(=O)[C@H]1CN(c2nc(C)cc(C(F)(F)F)n2)C[C@@H]1c1ccccc1	ZINC000450947273	FG	On-Demand	Anodyne	SLC6A1	52	42
COC(=O)[C@H]1CN(c2nc(C)cc(C(F)(F)F)n2)C[C@@H]1c1ccccc1	ZINC000450947273	FG	On-Demand	Anodyne	SLC6A3	21	41
COC(=O)[C@@H]1CN(c2nc(C)cc(C(F)(F)F)n2)C[C@H]1c1ccccc1	ZINC000450947274	FG	On-Demand	Anodyne	SLC6A1	52	42
COC(=O)[C@@H]1CN(c2nc(C)cc(C(F)(F)F)n2)C[C@H]1c1ccccc1	ZINC000450947274	FG	On-Demand	Anodyne	SLC6A3	21	41
N#CC1(CN2CCC(N3CCc4cc(F)ccc43)CC2)CCC1	ZINC000450947290	DG	On-Demand	Mild	SCD	28	41
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450947306	GC	On-Demand	Bother	NOD2	19	42
C[C@@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450947306	GC	On-Demand	Bother	PMM2	0	41
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450947313	GC	On-Demand	Bother	NOD2	19	42
C[C@H]1C[C@@H](O)CN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450947313	GC	On-Demand	Bother	PMM2	0	41
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450947315	GC	On-Demand	Bother	NOD2	19	42
C[C@H]1C[C@H](O)CN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000450947315	GC	On-Demand	Bother	PMM2	0	41
COC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc2c(c1)CCO2	ZINC000450947340	GF	On-Demand	Anodyne	GPR88	0	40
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc2c(c1)CCO2	ZINC000450947341	GF	On-Demand	Anodyne	GPR88	0	40
Cc1cccc([C@H](C)Nc2ncc([N+](=O)[O-])c(C)n2)c1	ZINC000450947357	CG	On-Demand	Bother	PRKCQ	0	46
Cc1cccc([C@@H](C)Nc2ncc([N+](=O)[O-])c(C)n2)c1	ZINC000450947359	CG	On-Demand	Bother	PRKCQ	0	46
NC(=O)C[C@@H]1COCCN1c1nccc(Oc2ccccc2)n1	ZINC000450947366	DD	On-Demand	Anodyne	COLA	41	35
NC(=O)C[C@H]1COCCN1c1nccc(Oc2ccccc2)n1	ZINC000450947367	DD	On-Demand	Anodyne	COLA	41	35
COc1cccc(OCCC(=O)NC(C)(C)c2nc3ccccc3n2C)c1	ZINC000450947368	FG	On-Demand	Anodyne	MTNR1A	20	41
C[C@H](CCC1CC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450947382	CF	On-Demand	Anodyne	HDAC1	29	41
C[C@H](CCC1CC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450947382	CF	On-Demand	Anodyne	ENPP2	22	48
C[C@H](CCC1CC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450947382	CF	On-Demand	Anodyne	HPGDS	31	49
C[C@@H](CCC1CC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450947384	CF	On-Demand	Anodyne	HDAC1	29	41
C[C@@H](CCC1CC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450947384	CF	On-Demand	Anodyne	ENPP2	22	48
C[C@@H](CCC1CC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450947384	CF	On-Demand	Anodyne	HPGDS	31	49
Cc1cc(C(=O)N(Cc2ccccc2)[C@@H](C)C(C)(C)C)ncc1C(N)=O	ZINC000450947386	FH	On-Demand	Anodyne	STAT6	63	35
Cc1cc(C(=O)N(Cc2ccccc2)[C@H](C)C(C)(C)C)ncc1C(N)=O	ZINC000450947388	FH	On-Demand	Anodyne	STAT6	63	35
CCS(=O)(=O)c1ccccc1N1CCC[C@H](COC)CC1	ZINC000450947389	DF	On-Demand	Anodyne	CASP7	44	35
CCS(=O)(=O)c1ccccc1N1CCC[C@@H](COC)CC1	ZINC000450947390	DF	On-Demand	Anodyne	CASP7	44	35
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450947392	FF	On-Demand	Anodyne	DRD4	0	41
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450947392	FF	On-Demand	Anodyne	SLC18A3	0	40
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450947392	FF	On-Demand	Anodyne	PREP	55	36
COC[C@@H]1CCCN(c2cccc(F)c2C(C)=O)CC1	ZINC000450947410	CG	On-Demand	Anodyne	KCNQ2	50	34
COC[C@H]1CCCN(c2cccc(F)c2C(C)=O)CC1	ZINC000450947411	CG	On-Demand	Anodyne	KCNQ2	50	34
CC[C@H](O)CC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450947412	DE	On-Demand	Anodyne	PGA	55	38
CC[C@H](O)CC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450947412	DE	On-Demand	Anodyne	POL	0	40
CC[C@@H](O)CC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450947413	DE	On-Demand	Anodyne	PGA	55	38
CC[C@@H](O)CC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450947413	DE	On-Demand	Anodyne	POL	0	40
CC[C@H](O)CC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450947414	DE	On-Demand	Anodyne	PGA	55	38
CC[C@H](O)CC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450947414	DE	On-Demand	Anodyne	POL	0	40
CC[C@@H](O)CC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450947415	DE	On-Demand	Anodyne	PGA	55	38
CC[C@@H](O)CC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450947415	DE	On-Demand	Anodyne	POL	0	40
CC(C)(C)c1cc(CSCC(=O)Nc2ccccc2)no1	ZINC000450947420	DH	On-Demand	Anodyne	KIT	15	43
CC(C)(C)c1cc(CSCC(=O)Nc2ccccc2)no1	ZINC000450947420	DH	On-Demand	Anodyne	FLT3	51	50
CC(C)(C)c1cc(CSCC(=O)Nc2ccccc2)no1	ZINC000450947420	DH	On-Demand	Anodyne	CSF1R	17	43
CC(C)(C)c1cc(CSCC(=O)Nc2ccccc2)no1	ZINC000450947420	DH	On-Demand	Anodyne	Q8MMZ8_EIMTE	24	46
N#Cc1cnn(CC(=O)N2CCN(Cc3cccc4ccccc34)CC2)c1	ZINC000450947434	FE	On-Demand	Mild	MGLL	0	48
CN(c1ncnc2c(F)cccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450947460	FH	On-Demand	Anodyne	HTR4	0	51
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947463	EG	On-Demand	Anodyne	MPL	23	41
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947463	EG	On-Demand	Anodyne	HDAC1	29	41
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947463	EG	On-Demand	Anodyne	SIRT3	49	30
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947463	EG	On-Demand	Anodyne	SIRT2	43	30
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947463	EG	On-Demand	Anodyne	SIRT1	49	30
CC(C)(C)C[C@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947463	EG	On-Demand	Anodyne	HPGDS	28	40
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947465	EG	On-Demand	Anodyne	MPL	23	41
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947465	EG	On-Demand	Anodyne	HDAC1	29	41
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947465	EG	On-Demand	Anodyne	SIRT3	49	30
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947465	EG	On-Demand	Anodyne	SIRT2	43	30
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947465	EG	On-Demand	Anodyne	SIRT1	49	30
CC(C)(C)C[C@@H]1CCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000450947465	EG	On-Demand	Anodyne	HPGDS	28	40
COC[C@@H]1CCCN(c2c(C#N)cnc3ccc(Cl)cc23)CC1	ZINC000450947472	EI	On-Demand	Mild	SRC	44	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nc(C2CC2)no1	ZINC000450947476	FG	On-Demand	Anodyne	DRD2	29	41
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nc(C2CC2)no1	ZINC000450947476	FG	On-Demand	Anodyne	DRD1	15	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nc(C2CC2)no1	ZINC000450947476	FG	On-Demand	Anodyne	DRD4	0	43
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nc(C2CC2)no1	ZINC000450947476	FG	On-Demand	Anodyne	HTR2A	23	47
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nc(C2CC2)no1	ZINC000450947476	FG	On-Demand	Anodyne	HTR2C	19	47
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nc(C2CC2)no1	ZINC000450947476	FG	On-Demand	Anodyne	ERG2	18	41
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nc(C2CC2)no1	ZINC000450947476	FG	On-Demand	Anodyne	HTR3B	0	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1c1nc(C2CC2)no1	ZINC000450947476	FG	On-Demand	Anodyne	CYP2J2	51	36
COC[C@H]1CCCN(c2c(C#N)cnc3ccc(Cl)cc23)CC1	ZINC000450947477	EI	On-Demand	Mild	SRC	44	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450947478	FG	On-Demand	Anodyne	DRD2	29	41
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450947478	FG	On-Demand	Anodyne	DRD1	15	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450947478	FG	On-Demand	Anodyne	DRD4	0	43
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450947478	FG	On-Demand	Anodyne	HTR2A	23	47
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450947478	FG	On-Demand	Anodyne	HTR2C	19	47
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450947478	FG	On-Demand	Anodyne	ERG2	18	41
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450947478	FG	On-Demand	Anodyne	HTR3B	0	45
CN1CCN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450947478	FG	On-Demand	Anodyne	CYP2J2	51	36
CN(c1ncc(C(N)=O)cc1Cl)C1CCN(CCC(F)(F)F)CC1	ZINC000450947494	FF	On-Demand	Anodyne	CACNA1I	43	38
CN(C)[C@H](CNC(=O)[C@@H](O)C1CCC1)c1cccc(C(F)(F)F)c1	ZINC000450947520	EF	On-Demand	Anodyne	PHES	0	41
CN(C)[C@@H](CNC(=O)[C@@H](O)C1CCC1)c1cccc(C(F)(F)F)c1	ZINC000450947521	EF	On-Demand	Anodyne	PHES	0	41
CN(C)[C@H](CNC(=O)[C@H](O)C1CCC1)c1cccc(C(F)(F)F)c1	ZINC000450947523	EF	On-Demand	Anodyne	PHES	0	41
CN(C)[C@@H](CNC(=O)[C@H](O)C1CCC1)c1cccc(C(F)(F)F)c1	ZINC000450947525	EF	On-Demand	Anodyne	PHES	0	41
COc1ccc(CN(C(=O)Cn2cc(C#N)cn2)[C@@H](C)Cc2cccs2)cc1	ZINC000450947530	GG	On-Demand	Mild	BMP1	30	40
CC(C)(C)C[C@H]1CCN(c2nc(C(N)=O)cs2)C1	ZINC000450947532	CF	On-Demand	Anodyne	SIRT3	50	33
CC(C)(C)C[C@H]1CCN(c2nc(C(N)=O)cs2)C1	ZINC000450947532	CF	On-Demand	Anodyne	SIRT1	50	33
CC(C)(C)C[C@@H]1CCN(c2nc(C(N)=O)cs2)C1	ZINC000450947533	CF	On-Demand	Anodyne	SIRT3	50	33
CC(C)(C)C[C@@H]1CCN(c2nc(C(N)=O)cs2)C1	ZINC000450947533	CF	On-Demand	Anodyne	SIRT1	50	33
COc1ccc(CN(C(=O)Cn2cc(C#N)cn2)[C@H](C)Cc2cccs2)cc1	ZINC000450947534	GG	On-Demand	Mild	BMP1	30	40
COC(=O)c1cnc(N(C)C2CCN(CCC(F)(F)F)CC2)nc1	ZINC000450947547	EE	On-Demand	Anodyne	CACNA1I	54	39
COC[C@@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947552	GG	On-Demand	Anodyne	PDE3A	51	38
COC[C@@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947552	GG	On-Demand	Anodyne	PDGFRB	68	42
COC[C@@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947552	GG	On-Demand	Anodyne	PDE3B	76	39
COC[C@@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947552	GG	On-Demand	Anodyne	SIRT3	58	34
COC[C@@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947552	GG	On-Demand	Anodyne	SIRT2	52	32
COC[C@@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947552	GG	On-Demand	Anodyne	SIRT1	52	31
COC[C@@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947552	GG	On-Demand	Anodyne	HTT	0	44
COC[C@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947554	GG	On-Demand	Anodyne	PDE3A	51	38
COC[C@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947554	GG	On-Demand	Anodyne	PDGFRB	68	42
COC[C@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947554	GG	On-Demand	Anodyne	PDE3B	76	39
COC[C@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947554	GG	On-Demand	Anodyne	SIRT3	58	34
COC[C@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947554	GG	On-Demand	Anodyne	SIRT2	52	32
COC[C@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947554	GG	On-Demand	Anodyne	SIRT1	52	31
COC[C@H]1CCCN(c2ncnc3ccc(I)cc23)CC1	ZINC000450947554	GG	On-Demand	Anodyne	HTT	0	44
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947568	CE	On-Demand	Anodyne	FGFR2	45	37
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947568	CE	On-Demand	Anodyne	KDR	71	43
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947568	CE	On-Demand	Anodyne	MET	56	37
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947568	CE	On-Demand	Anodyne	PDGFRA	58	43
CC[C@@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947568	CE	On-Demand	Anodyne	CSF1R	46	35
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947569	CE	On-Demand	Anodyne	FGFR2	45	37
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947569	CE	On-Demand	Anodyne	KDR	71	43
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947569	CE	On-Demand	Anodyne	MET	56	37
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947569	CE	On-Demand	Anodyne	PDGFRA	58	43
CC[C@H](Nc1ccnc2cc(F)c(OC)cc12)C(=O)NC	ZINC000450947569	CE	On-Demand	Anodyne	CSF1R	46	35
COc1ccc(-c2nnc(N3C[C@H](C)C[C@@H](O)C3)c3ccccc23)cc1	ZINC000450947573	EH	On-Demand	Anodyne	SMO	49	53
COc1ccc(-c2nnc(N3C[C@@H](C)C[C@H](O)C3)c3ccccc23)cc1	ZINC000450947574	EH	On-Demand	Anodyne	SMO	49	53
COc1ccc(-c2nnc(N3C[C@@H](O)C[C@@H](C)C3)c3ccccc23)cc1	ZINC000450947575	EH	On-Demand	Anodyne	SMO	49	53
C[C@H]1C[C@@H](O)CN(c2nc(-c3ccccc3)ns2)C1	ZINC000450947584	CE	On-Demand	Anodyne	FAAH	0	45
C[C@H]1C[C@H](O)CN(c2nc(-c3ccccc3)ns2)C1	ZINC000450947585	CE	On-Demand	Anodyne	FAAH	0	45
C[C@@H]1C[C@@H](O)CN(c2nc(-c3ccccc3)ns2)C1	ZINC000450947586	CE	On-Demand	Anodyne	FAAH	0	45
CC[C@@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450947637	FD	On-Demand	Bother	BDKRB1	0	50
CC[C@@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450947637	FD	On-Demand	Bother	COLA	100	36
CC[C@@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450947637	FD	On-Demand	Bother	BCL2L1	40	31
CC[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450947638	FD	On-Demand	Bother	BDKRB1	0	50
CC[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450947638	FD	On-Demand	Bother	COLA	100	36
CC[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])C(=O)NC	ZINC000450947638	FD	On-Demand	Bother	BCL2L1	40	31
CC[C@@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)C(=O)NC	ZINC000450947648	GF	On-Demand	Anodyne	NPY5R	16	41
CC[C@@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)C(=O)NC	ZINC000450947648	GF	On-Demand	Anodyne	PDS	39	68
CC[C@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)C(=O)NC	ZINC000450947649	GF	On-Demand	Anodyne	NPY5R	16	41
CC[C@H](Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Cl)C(=O)NC	ZINC000450947649	GF	On-Demand	Anodyne	PDS	39	68
CC[C@@H](Nc1cncc(SCc2ccccc2)n1)C(=O)NC	ZINC000450947652	DF	On-Demand	Anodyne	CX3CR1	40	36
CC[C@H](Nc1cncc(SCc2ccccc2)n1)C(=O)NC	ZINC000450947653	DF	On-Demand	Anodyne	CX3CR1	40	36
C[C@@H]1C[C@@H](O)CN(c2nccc(C(F)F)n2)C1	ZINC000450947657	BD	On-Demand	Anodyne	SORD	51	34
C[C@H]1C[C@@H](O)CN(c2nccc(C(F)F)n2)C1	ZINC000450947658	BD	On-Demand	Anodyne	SORD	51	34
C[C@H]1C[C@H](O)CN(c2nccc(C(F)F)n2)C1	ZINC000450947659	BD	On-Demand	Anodyne	SORD	51	34
COC(=O)[C@H]1CN(c2ncc(C#N)cc2Cl)C[C@@H]1c1ccccc1	ZINC000450947665	EF	On-Demand	Mild	SLC6A1	39	42
COC(=O)[C@H]1CN(c2ncc(C#N)cc2Cl)C[C@H]1c1ccccc1	ZINC000450947666	EF	On-Demand	Mild	SLC6A1	39	42
COC(=O)[C@H]1CN(c2ncnc3c(F)cccc23)C[C@@H]1c1ccccc1	ZINC000450947668	FG	On-Demand	Anodyne	SLC6A1	31	41
COC(=O)[C@H]1CN(c2ncnc3c(F)cccc23)C[C@H]1c1ccccc1	ZINC000450947669	FG	On-Demand	Anodyne	SLC6A1	31	41
COC(=O)[C@@H]1CN(c2ncnc3c(F)cccc23)C[C@H]1c1ccccc1	ZINC000450947670	FG	On-Demand	Anodyne	SLC6A1	31	41
Cc1nc(N[C@@H]2CN(CC(F)(F)F)C[C@H]2c2ccccc2)ncc1[N+](=O)[O-]	ZINC000450947674	GG	On-Demand	Bother	PRKCQ	45	38
C[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450947695	FG	On-Demand	Anodyne	CCL5	0	42
C[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450947696	FG	On-Demand	Anodyne	CCL5	0	42
C[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450947697	FG	On-Demand	Anodyne	CCL5	0	42
C[C@H](NC[C@H](O)[C@H](C)c1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450947698	FG	On-Demand	Anodyne	CCL5	0	42
CCO[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450947699	GF	On-Demand	Bother	TBXA2R	24	40
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1c1ccccc1	ZINC000450947700	GH	On-Demand	Bother	SLC6A1	51	39
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1c1ccccc1	ZINC000450947701	GH	On-Demand	Bother	SLC6A1	51	39
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1c1ccccc1	ZINC000450947702	GH	On-Demand	Bother	SLC6A1	51	39
CCOC(=O)C1CCC(N(CC)C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450947703	DF	On-Demand	Anodyne	PPM1B	0	40
CCOC(=O)C1CCC(N(CC)C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450947703	DF	On-Demand	Anodyne	PPP1CC	0	40
CCOC(=O)C1CCC(N(CC)C[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450947703	DF	On-Demand	Anodyne	Q8AWE3_CHICK	24	40
CCOC(=O)C1CCC(N(CC)C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450947704	DF	On-Demand	Anodyne	PPM1B	0	40
CCOC(=O)C1CCC(N(CC)C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450947704	DF	On-Demand	Anodyne	PPP1CC	0	40
CCOC(=O)C1CCC(N(CC)C[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000450947704	DF	On-Demand	Anodyne	Q8AWE3_CHICK	24	40
COc1cccc([C@@H]2C[C@@H](N(C)c3ccc(C(F)(F)F)nn3)C2)c1	ZINC000450947713	EH	On-Demand	Anodyne	GPBAR1	0	41
COC[C@H]1CCCCN1c1ccnc(C(C)C)n1	ZINC000450947718	BF	On-Demand	Anodyne	SORD	87	37
COC[C@@H]1CCCCN1c1ccnc(C(C)C)n1	ZINC000450947719	BF	On-Demand	Anodyne	SORD	87	37
COC[C@@H]1CCCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450947736	CD	On-Demand	Anodyne	P2RY12	28	43
COC[C@@H]1CCCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450947736	CD	On-Demand	Anodyne	CXCR3	29	42
COC[C@H]1CCCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450947737	CD	On-Demand	Anodyne	P2RY12	28	43
COC[C@H]1CCCCN1c1ncc(C(N)=O)cc1Cl	ZINC000450947737	CD	On-Demand	Anodyne	CXCR3	29	42
CCS(=O)(=O)c1ccc(CSCC(=O)Nc2nc(C)cs2)cc1	ZINC000450947776	FG	On-Demand	Anodyne	RORC	64	36
COC(=O)c1ccc(CSCC(=O)Nc2nc(C)cs2)cc1Cl	ZINC000450947783	FH	On-Demand	Anodyne	GCK	0	40
COc1ccc(CNC(=O)CCSCC(=O)Nc2ccccc2)c(OC)c1	ZINC000450947790	GG	On-Demand	Anodyne	TSHR	68	33
COc1ccc(CNC(=O)CCSCC(=O)Nc2ccccc2)c(OC)c1	ZINC000450947790	GG	On-Demand	Anodyne	PDGFRB	50	41
COc1ccc(CNC(=O)CCSCC(=O)Nc2ccccc2)c(OC)c1	ZINC000450947790	GG	On-Demand	Anodyne	CPT1A	46	32
COc1ccc(CNC(=O)CCSCC(=O)Nc2ccccc2)c(OC)c1	ZINC000450947790	GG	On-Demand	Anodyne	MTNR1A	84	42
COc1ccc(CNC(=O)CCSCC(=O)Nc2ccccc2)c(OC)c1	ZINC000450947790	GG	On-Demand	Anodyne	MTNR1B	79	42
COc1ccc(CNC(=O)CCSCC(=O)Nc2ccccc2)c(OC)c1	ZINC000450947790	GG	On-Demand	Anodyne	CSF1R	18	41
COc1ccc(CNC(=O)CCSCC(=O)Nc2ccccc2)c(OC)c1	ZINC000450947790	GG	On-Demand	Anodyne	ENPP1	69	34
CO[C@@H]1C[C@@H](c2nncn2C)N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450947791	EE	On-Demand	Anodyne	DRD4	15	40
CC(C)(CN1CCCC1)Nc1nc(C(F)F)nc2ccccc12	ZINC000450947798	DH	On-Demand	Anodyne	HNMT	80	38
CCOC(=O)c1ccc(CSCC(=O)Nc2nc(C)cs2)nc1	ZINC000450947803	FF	On-Demand	Anodyne	GCK	0	40
CCO[C@@H]1CCC[C@H]1Nc1ncnc2ccc(C)cc12	ZINC000450947864	CG	On-Demand	Anodyne	CD38	56	43
C[C@@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CN2CCOCC2)C1	ZINC000450947867	EE	On-Demand	Anodyne	CASR	44	34
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CN2CCOCC2)C1	ZINC000450947868	EE	On-Demand	Anodyne	CASR	44	34
CNC(=O)c1ccc(N2C[C@H](c3ccccc3)[C@@H](C(=O)OC)C2)c([N+](=O)[O-])c1	ZINC000450947870	GE	On-Demand	Bother	TAAR1	21	44
CNC(=O)c1ccc(N2C[C@@H](C(=O)OC)[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000450947871	GE	On-Demand	Bother	TAAR1	21	44
COc1cc(CN2C[C@H]3COC[C@@H](C2)O3)ccc1Cl	ZINC000450947882	CD	On-Demand	Anodyne	DRD4	17	46
COC(=O)c1ccc(C(=O)CSC(C)(C)c2ccccc2)o1	ZINC000450947889	DH	On-Demand	Anodyne	KIF11	27	40
COC(=O)[C@H]1CN(c2cc(C)nc(C3CC3)n2)C[C@H]1c1ccccc1	ZINC000450947890	EG	On-Demand	Anodyne	SLC6A1	71	43
COC(=O)[C@H]1CN(c2cc(C)nc(C3CC3)n2)C[C@@H]1c1ccccc1	ZINC000450947892	EG	On-Demand	Anodyne	SLC6A1	71	43
CCCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450947898	DE	On-Demand	Anodyne	SCD1	22	41
CCCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450947898	DE	On-Demand	Anodyne	HPGDS	23	45
CCCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450947899	DE	On-Demand	Anodyne	SCD1	22	41
CCCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450947899	DE	On-Demand	Anodyne	HPGDS	23	45
CC(C)(C)C[C@@H]1CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450947911	CD	On-Demand	Anodyne	SIRT3	43	32
CC(C)(C)C[C@@H]1CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450947911	CD	On-Demand	Anodyne	SIRT2	45	32
CC(C)(C)C[C@@H]1CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450947911	CD	On-Demand	Anodyne	SIRT1	40	32
CC(C)(C)C[C@@H]1CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450947911	CD	On-Demand	Anodyne	SCD1	40	47
CC(C)(C)C[C@H]1CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450947912	CD	On-Demand	Anodyne	SIRT3	43	32
CC(C)(C)C[C@H]1CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450947912	CD	On-Demand	Anodyne	SIRT2	45	32
CC(C)(C)C[C@H]1CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450947912	CD	On-Demand	Anodyne	SIRT1	40	32
CC(C)(C)C[C@H]1CCN(c2ccc(C(N)=O)nn2)C1	ZINC000450947912	CD	On-Demand	Anodyne	SCD1	40	47
COC[C@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc23)CC1	ZINC000450947924	DF	On-Demand	Bother	SIRT3	45	33
COC[C@@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc23)CC1	ZINC000450947925	DF	On-Demand	Bother	SIRT3	45	33
COC[C@H]1CCCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CC1	ZINC000450947926	FH	On-Demand	Anodyne	AVPR2	51	38
COC[C@@H]1CCCN(c2ccc(C(=O)N3CCc4ccccc43)cn2)CC1	ZINC000450947927	FH	On-Demand	Anodyne	AVPR2	51	38
COC[C@@H]1CCCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000450947931	DI	On-Demand	Anodyne	CXCR3	16	46
CC(C)(C)C[C@H]1CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450947977	EH	On-Demand	Bother	F2RL3	44	33
CC(C)(C)C[C@@H]1CCN(c2nc(O)c3cc([N+](=O)[O-])ccc3n2)C1	ZINC000450947978	EH	On-Demand	Bother	F2RL3	44	33
Cc1cnn(Cc2ccccc2F)c1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450947979	ED	On-Demand	Anodyne	P2RX7	34	45
Cc1cnn(Cc2ccccc2F)c1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450947981	ED	On-Demand	Anodyne	P2RX7	34	45
CCOC(=O)c1cccnc1N1CCC[C@@H](COC)CC1	ZINC000450948002	CF	On-Demand	Anodyne	P2RY12	48	37
CCOC(=O)c1cccnc1N1CCC[C@H](COC)CC1	ZINC000450948003	CF	On-Demand	Anodyne	P2RY12	48	37
Cc1ccc(-c2cnc(NC(=O)[C@@H](O)C3CCC3)s2)c(C)c1	ZINC000450948004	DH	On-Demand	Anodyne	CDK5	42	36
Cc1ccc(-c2cnc(NC(=O)[C@H](O)C3CCC3)s2)c(C)c1	ZINC000450948005	DH	On-Demand	Anodyne	CDK5	42	36
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	ADORA1	168	77
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	SLC29A1	144	63
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	P2RY12	53	44
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	ADORA2A	63	69
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	ADORA2B	31	54
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	GAPC	0	44
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	ADK	72	52
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	AHCY	41	38
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	P2RX1	44	37
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	GAPDH	38	43
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	ITPR1	50	35
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	NS5B	0	43
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	ADORA3	146	65
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	OXGR1	115	39
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	IMPDH2	55	36
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	AK	0	63
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	RNASE1	41	32
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	MBTA	0	44
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	DNMT3B	78	43
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	Q4VQ11_PIG	78	56
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	GPR17	55	40
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	SAE1	0	40
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	DOT1L	98	44
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	METJ	0	44
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	NAE1	0	40
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	UBA6	0	40
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	UBA7	0	40
Cc1cccc([C@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948010	GC	On-Demand	Anodyne	DNPH1	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2snc(C)c2c1=O	ZINC000450948013	FD	On-Demand	Anodyne	CMA1	52	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2snc(C)c2c1=O	ZINC000450948013	FD	On-Demand	Anodyne	CTRA_BOVIN	52	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2snc(C)c2c1=O	ZINC000450948013	FD	On-Demand	Anodyne	CTRC	51	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2snc(C)c2c1=O	ZINC000450948014	FD	On-Demand	Anodyne	CMA1	52	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2snc(C)c2c1=O	ZINC000450948014	FD	On-Demand	Anodyne	CTRA_BOVIN	52	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2snc(C)c2c1=O	ZINC000450948014	FD	On-Demand	Anodyne	CTRC	51	41
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	ADORA1	168	77
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	SLC29A1	144	63
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	P2RY12	53	44
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	ADORA2A	63	69
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	ADORA2B	31	54
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	GAPC	0	44
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	ADK	72	52
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	AHCY	41	38
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	P2RX1	44	37
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	GAPDH	38	43
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	ITPR1	50	35
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	NS5B	0	43
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	ADORA3	146	65
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	OXGR1	115	39
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	IMPDH2	55	36
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	AK	0	63
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	RNASE1	41	32
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	MBTA	0	44
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	DNMT3B	78	43
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	Q4VQ11_PIG	78	56
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	GPR17	55	40
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	SAE1	0	40
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	DOT1L	98	44
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	METJ	0	44
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	NAE1	0	40
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	UBA6	0	40
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	UBA7	0	40
Cc1cccc([C@@H](C)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1	ZINC000450948015	GC	On-Demand	Anodyne	DNPH1	0	42
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2F)CC1	ZINC000450948036	DE	On-Demand	Anodyne	SLC6A9	38	60
COC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2F)CC1	ZINC000450948036	DE	On-Demand	Anodyne	CASP7	79	39
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2F)CC1	ZINC000450948037	DE	On-Demand	Anodyne	SLC6A9	38	60
COC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2F)CC1	ZINC000450948037	DE	On-Demand	Anodyne	CASP7	79	39
CC[C@@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948045	DD	On-Demand	Anodyne	BMP1	41	35
CC[C@@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948045	DD	On-Demand	Anodyne	CAPN1	44	39
CC[C@@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948045	DD	On-Demand	Anodyne	CAPN2	85	39
CC[C@@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948045	DD	On-Demand	Anodyne	ACE2	48	40
CC[C@@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948045	DD	On-Demand	Anodyne	NPR	42	32
CC[C@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948046	DD	On-Demand	Anodyne	BMP1	41	35
CC[C@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948046	DD	On-Demand	Anodyne	CAPN1	44	39
CC[C@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948046	DD	On-Demand	Anodyne	CAPN2	85	39
CC[C@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948046	DD	On-Demand	Anodyne	ACE2	48	40
CC[C@H](Nc1nccc(OCc2ccccc2)n1)C(=O)NC	ZINC000450948046	DD	On-Demand	Anodyne	NPR	42	32
CC[C@@H](Nc1nc(C)nc2scc(C)c12)C(=O)NC	ZINC000450948060	CE	On-Demand	Anodyne	UL26	62	32
CC[C@@H](Nc1nc(C)nc2scc(C)c12)C(=O)NC	ZINC000450948060	CE	On-Demand	Anodyne	SCAF_EBVB9	56	30
CC[C@H](Nc1nc(C)nc2scc(C)c12)C(=O)NC	ZINC000450948061	CE	On-Demand	Anodyne	UL26	62	32
CC[C@H](Nc1nc(C)nc2scc(C)c12)C(=O)NC	ZINC000450948061	CE	On-Demand	Anodyne	SCAF_EBVB9	56	30
CC[C@H](Nc1nnc(-c2ccc(OC)cc2)c2ccccc12)C(=O)NC	ZINC000450948080	FF	On-Demand	Anodyne	MMP1	18	40
CC[C@@H](Nc1nnc(-c2ccc(OC)cc2)c2ccccc12)C(=O)NC	ZINC000450948081	FF	On-Demand	Anodyne	MMP1	18	40
COC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1C)c1ccc2c(c1)CCO2	ZINC000450948088	GH	On-Demand	Anodyne	MTTP	51	36
COC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1C)c1ccc2c(c1)CCO2	ZINC000450948089	GH	On-Demand	Anodyne	MTTP	51	36
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948090	ED	On-Demand	Anodyne	CNR2	15	42
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948090	ED	On-Demand	Anodyne	TACR2	24	42
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948090	ED	On-Demand	Anodyne	ACACB	24	41
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948090	ED	On-Demand	Anodyne	TACR3	63	39
CC[C@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948090	ED	On-Demand	Anodyne	TNKS	61	34
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948091	ED	On-Demand	Anodyne	CNR2	15	42
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948091	ED	On-Demand	Anodyne	TACR2	24	42
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948091	ED	On-Demand	Anodyne	ACACB	24	41
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948091	ED	On-Demand	Anodyne	TACR3	63	39
CC[C@@H](Nc1cc(C(=O)NC2CC2)c2ccccc2n1)C(=O)NC	ZINC000450948091	ED	On-Demand	Anodyne	TNKS	61	34
CC[C@H](N=c1[nH]c2ccccc2cc1[N+](=O)[O-])C(=O)NC	ZINC000450948099	CD	On-Demand	Bother	BMP1	17	42
CC[C@H](N=c1[nH]c2ccccc2cc1[N+](=O)[O-])C(=O)NC	ZINC000450948099	CD	On-Demand	Bother	COLA	69	31
CC[C@@H](N=c1[nH]c2ccccc2cc1[N+](=O)[O-])C(=O)NC	ZINC000450948100	CD	On-Demand	Bother	BMP1	17	42
CC[C@@H](N=c1[nH]c2ccccc2cc1[N+](=O)[O-])C(=O)NC	ZINC000450948100	CD	On-Demand	Bother	COLA	69	31
Cc1csc(NC(=O)CSCC/C=C\c2ccccc2)n1	ZINC000450948120	DI	On-Demand	Anodyne	GCK	20	41
Cc1csc(NC(=O)CSCC/C=C/c2ccccc2)n1	ZINC000450948121	DI	On-Demand	Anodyne	GCK	20	41
COc1cc(CN2CCN(C)[C@H](c3nc(C)no3)C2)ccc1Cl	ZINC000450948132	EF	On-Demand	Anodyne	SSTR5	44	37
COc1cc(CN2CCN(C)[C@@H](c3nc(C)no3)C2)ccc1Cl	ZINC000450948133	EF	On-Demand	Anodyne	SSTR5	44	37
CN(c1ncnc2[nH]ccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450948153	EF	On-Demand	Anodyne	JAK3	31	63
CN(c1ncnc2[nH]ccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450948153	EF	On-Demand	Anodyne	JAK1	54	39
CN(c1ncnc2[nH]ccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450948153	EF	On-Demand	Anodyne	JAK2	0	53
CN(c1ncnc2[nH]ccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450948153	EF	On-Demand	Anodyne	ROCK2	0	44
CN(c1ncnc2[nH]ccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450948153	EF	On-Demand	Anodyne	TYK2	0	52
COCc1cc(NCCN2CCCC2(C)C)n2ncnc2n1	ZINC000450948161	DD	On-Demand	Anodyne	DHOD	0	41
COc1cc(F)cc(C[C@@H](C)Nc2ncnc3[nH]cnc23)c1	ZINC000450948172	DF	On-Demand	Anodyne	AHK3	0	46
COc1cc(F)cc(C[C@H](C)Nc2ncnc3[nH]cnc23)c1	ZINC000450948173	DF	On-Demand	Anodyne	AHK3	0	46
CNC(=O)c1ccc(N[C@H](C)Cc2cc(F)cc(OC)c2)c([N+](=O)[O-])c1	ZINC000450948185	FG	On-Demand	Bother	TAAR1	20	49
CNC(=O)c1ccc(N[C@@H](C)Cc2cc(F)cc(OC)c2)c([N+](=O)[O-])c1	ZINC000450948186	FG	On-Demand	Bother	TAAR1	20	49
CSc1ccc2ncnc(N3CCOC[C@@H]3CC(N)=O)c2c1	ZINC000450948195	DD	On-Demand	Anodyne	SIRT3	65	33
CSc1ccc2ncnc(N3CCOC[C@@H]3CC(N)=O)c2c1	ZINC000450948195	DD	On-Demand	Anodyne	SIRT2	63	31
CSc1ccc2ncnc(N3CCOC[C@@H]3CC(N)=O)c2c1	ZINC000450948195	DD	On-Demand	Anodyne	SIRT1	46	33
CSc1ccc2ncnc(N3CCOC[C@H]3CC(N)=O)c2c1	ZINC000450948196	DD	On-Demand	Anodyne	SIRT3	65	33
CSc1ccc2ncnc(N3CCOC[C@H]3CC(N)=O)c2c1	ZINC000450948196	DD	On-Demand	Anodyne	SIRT2	63	31
CSc1ccc2ncnc(N3CCOC[C@H]3CC(N)=O)c2c1	ZINC000450948196	DD	On-Demand	Anodyne	SIRT1	46	33
CCc1cc(NCCN2CCCC2(C)C)n2ncnc2n1	ZINC000450948210	CD	On-Demand	Anodyne	DHOD	0	47
Cc1cccc([C@@H](C)Nc2ncnc3c2cnn3C)c1	ZINC000450948219	CF	On-Demand	Anodyne	SRC	0	47
Cc1cccc([C@H](C)Nc2ncnc3c2cnn3C)c1	ZINC000450948220	CF	On-Demand	Anodyne	SRC	0	47
COC[C@@H]1CCCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000450948229	CE	On-Demand	Bother	CHRNA3	15	52
COC[C@H]1CCCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000450948230	CE	On-Demand	Bother	CHRNA3	15	52
COC[C@@H]1CCCN(c2cc(C(F)(F)F)ccn2)CC1	ZINC000450948235	CG	On-Demand	Anodyne	LIPG	40	35
COC[C@H]1CCCN(c2cc(C(F)(F)F)ccn2)CC1	ZINC000450948236	CG	On-Demand	Anodyne	LIPG	40	35
CCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450948237	CE	On-Demand	Anodyne	CETP	0	42
CCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450948237	CE	On-Demand	Anodyne	DGAT1	22	42
CCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450948238	CE	On-Demand	Anodyne	CETP	0	42
CCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450948238	CE	On-Demand	Anodyne	DGAT1	22	42
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450948248	FE	On-Demand	Anodyne	CASP3	43	38
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450948248	FE	On-Demand	Anodyne	CASP7	49	38
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450948248	FE	On-Demand	Anodyne	GCK	23	42
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450948248	FE	On-Demand	Anodyne	GPR119	15	48
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450948249	FE	On-Demand	Anodyne	CASP3	43	38
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450948249	FE	On-Demand	Anodyne	CASP7	49	38
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450948249	FE	On-Demand	Anodyne	GCK	23	42
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)CC1	ZINC000450948249	FE	On-Demand	Anodyne	GPR119	15	48
CC(C)(C)C[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450948256	CG	On-Demand	Anodyne	JAK1	63	36
CC(C)(C)C[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450948256	CG	On-Demand	Anodyne	ROCK2	46	40
CC(C)(C)C[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450948256	CG	On-Demand	Anodyne	AKT1	41	50
CC(C)(C)C[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450948256	CG	On-Demand	Anodyne	SIRT1	52	33
CC(C)(C)C[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450948257	CG	On-Demand	Anodyne	JAK1	63	36
CC(C)(C)C[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450948257	CG	On-Demand	Anodyne	ROCK2	46	40
CC(C)(C)C[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450948257	CG	On-Demand	Anodyne	AKT1	41	50
CC(C)(C)C[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450948257	CG	On-Demand	Anodyne	SIRT1	52	33
CC(C)(C)C[C@H]1CCN(c2cnc(C(=O)OC(C)(C)C)cn2)C1	ZINC000450948295	DH	On-Demand	Anodyne	GPR119	16	41
CC(C)(C)C[C@@H]1CCN(c2cnc(C(=O)OC(C)(C)C)cn2)C1	ZINC000450948296	DH	On-Demand	Anodyne	GPR119	16	41
Cc1cnc(N[C@H](C)c2cccc(C)c2)nc1	ZINC000450948297	BG	On-Demand	Anodyne	PLK1	22	44
Cc1cnc(N[C@@H](C)c2cccc(C)c2)nc1	ZINC000450948298	BG	On-Demand	Anodyne	PLK1	22	44
COC[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000450948301	CF	On-Demand	Bother	HTR1A	15	43
COC[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000450948301	CF	On-Demand	Bother	ADRA1D	16	43
COC[C@H]1CCCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000450948302	CF	On-Demand	Bother	HTR1A	15	43
COC[C@H]1CCCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000450948302	CF	On-Demand	Bother	ADRA1D	16	43
Cc1cccc([C@@H](C)Nc2nccc(N[C@@H]3CCCOC3)n2)c1	ZINC000450948312	DF	On-Demand	Anodyne	PAK3	15	40
Cc1cccc([C@@H](C)Nc2nccc(N[C@@H]3CCCOC3)n2)c1	ZINC000450948312	DF	On-Demand	Anodyne	PAK1	24	40
Cc1cccc([C@@H](C)Nc2nccc(N[C@@H]3CCCOC3)n2)c1	ZINC000450948312	DF	On-Demand	Anodyne	PAK2	16	40
Cc1cccc([C@H](C)Nc2nccc(N[C@@H]3CCCOC3)n2)c1	ZINC000450948313	DF	On-Demand	Anodyne	PAK3	15	40
Cc1cccc([C@H](C)Nc2nccc(N[C@@H]3CCCOC3)n2)c1	ZINC000450948313	DF	On-Demand	Anodyne	PAK1	24	40
Cc1cccc([C@H](C)Nc2nccc(N[C@@H]3CCCOC3)n2)c1	ZINC000450948313	DF	On-Demand	Anodyne	PAK2	16	40
COC(=O)c1cccc(CSCC(=O)Nc2nc(C)cs2)c1Cl	ZINC000450948347	FH	On-Demand	Anodyne	GCK	0	42
COC(=O)c1cccc(CSCC(=O)Nc2nc(C)cs2)c1Cl	ZINC000450948347	FH	On-Demand	Anodyne	FAS	45	36
COc1cc2c(NC(C)(C)CN3CCCC3)ncnc2cc1F	ZINC000450948360	DG	On-Demand	Anodyne	EGFR	41	48
COc1cc2c(NC(C)(C)CN3CCCC3)ncnc2cc1F	ZINC000450948360	DG	On-Demand	Anodyne	PDE3A	43	34
COc1cc2c(NC(C)(C)CN3CCCC3)ncnc2cc1F	ZINC000450948360	DG	On-Demand	Anodyne	ERBB2	23	40
COc1cc2c(NC(C)(C)CN3CCCC3)ncnc2cc1F	ZINC000450948360	DG	On-Demand	Anodyne	FLT1	27	49
COc1cc2c(NC(C)(C)CN3CCCC3)ncnc2cc1F	ZINC000450948360	DG	On-Demand	Anodyne	PDE3B	62	32
COc1cc2c(NC(C)(C)CN3CCCC3)ncnc2cc1F	ZINC000450948360	DG	On-Demand	Anodyne	ERBB4	33	40
COc1cc2c(NC(C)(C)CN3CCCC3)ncnc2cc1F	ZINC000450948360	DG	On-Demand	Anodyne	EPHA2	47	36
COc1cc2c(NC(C)(C)CN3CCCC3)ncnc2cc1F	ZINC000450948360	DG	On-Demand	Anodyne	EHMT2	42	31
COc1cc2c(N(C)C3CCN(CCC(F)(F)F)CC3)ncnc2cc1F	ZINC000450948366	GH	On-Demand	Anodyne	EGFR	22	41
COc1cc2c(N(C)C3CCN(CCC(F)(F)F)CC3)ncnc2cc1F	ZINC000450948366	GH	On-Demand	Anodyne	PDE3A	43	34
COc1cc2c(N(C)C3CCN(CCC(F)(F)F)CC3)ncnc2cc1F	ZINC000450948366	GH	On-Demand	Anodyne	PDE3B	63	34
N#Cc1cnn(CC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1	ZINC000450948389	GF	On-Demand	Mild	PTAFR	48	44
N#Cc1cnn(CC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1	ZINC000450948389	GF	On-Demand	Mild	NMUR2	0	41
N#Cc1cnn(CC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1	ZINC000450948389	GF	On-Demand	Mild	NMUR1	0	41
NC(=O)C[C@@H]1COCCN1c1ccnc(-c2ccccc2)n1	ZINC000450948408	CD	On-Demand	Anodyne	MTOR	44	35
NC(=O)C[C@H]1COCCN1c1ccnc(-c2ccccc2)n1	ZINC000450948409	CD	On-Demand	Anodyne	MTOR	44	35
CC(C)(CN1CCCC1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000450948413	EE	On-Demand	Bother	TBXA2R	23	41
Cc1cccc([C@H](C)Nc2nccc(N[C@H]3CCCOC3)n2)c1	ZINC000450948414	DF	On-Demand	Anodyne	PAK3	15	40
Cc1cccc([C@H](C)Nc2nccc(N[C@H]3CCCOC3)n2)c1	ZINC000450948414	DF	On-Demand	Anodyne	PAK1	24	40
Cc1cccc([C@H](C)Nc2nccc(N[C@H]3CCCOC3)n2)c1	ZINC000450948414	DF	On-Demand	Anodyne	PAK2	16	40
Cc1cccc([C@@H](C)Nc2nccc(N[C@H]3CCCOC3)n2)c1	ZINC000450948415	DF	On-Demand	Anodyne	PAK3	15	40
Cc1cccc([C@@H](C)Nc2nccc(N[C@H]3CCCOC3)n2)c1	ZINC000450948415	DF	On-Demand	Anodyne	PAK1	24	40
Cc1cccc([C@@H](C)Nc2nccc(N[C@H]3CCCOC3)n2)c1	ZINC000450948415	DF	On-Demand	Anodyne	PAK2	16	40
COC[C@@H]1CCCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450948421	EF	On-Demand	Anodyne	PDE3A	51	40
COC[C@@H]1CCCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450948421	EF	On-Demand	Anodyne	PDGFRB	51	33
COC[C@@H]1CCCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450948421	EF	On-Demand	Anodyne	PDE3B	75	40
COC[C@H]1CCCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450948422	EF	On-Demand	Anodyne	PDE3A	51	40
COC[C@H]1CCCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450948422	EF	On-Demand	Anodyne	PDGFRB	51	33
COC[C@H]1CCCN(c2ncnc3c(OC)cc(OC)cc23)CC1	ZINC000450948422	EF	On-Demand	Anodyne	PDE3B	75	40
COC[C@@H]1CCCN(c2nccn3c(C)nnc23)CC1	ZINC000450948423	CD	On-Demand	Anodyne	PDE10A	25	40
COC[C@H]1CCCN(c2nccn3c(C)nnc23)CC1	ZINC000450948424	CD	On-Demand	Anodyne	PDE10A	25	40
COC[C@@H]1CCCN(c2cnc(C(=O)OC(C)(C)C)cn2)CC1	ZINC000450948432	DF	On-Demand	Anodyne	GPR119	19	40
COC[C@H]1CCCN(c2cnc(C(=O)OC(C)(C)C)cn2)CC1	ZINC000450948433	DF	On-Demand	Anodyne	GPR119	19	40
CCS(=O)(=O)Cc1ccc(Nc2ncc(C(=O)OC)cn2)cc1	ZINC000450948436	ED	On-Demand	Anodyne	PTPRB	48	41
CNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nn1	ZINC000450948440	CD	On-Demand	Anodyne	SCD1	50	43
CNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nn1	ZINC000450948440	CD	On-Demand	Anodyne	SCD	39	40
CNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nn1	ZINC000450948441	CD	On-Demand	Anodyne	SCD1	50	43
CNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nn1	ZINC000450948441	CD	On-Demand	Anodyne	SCD	39	40
Cc1cccc([C@@H](C)Nc2ncc(C)s2)c1	ZINC000450948442	BH	On-Demand	Anodyne	PLK1	23	41
COC[C@H]1CCCN(c2nc(OC)nc(N3CCCCCC3)n2)CC1	ZINC000450948443	EF	On-Demand	Anodyne	CCR4	23	40
COC[C@@H]1CCCN(c2nc(OC)nc(N3CCCCCC3)n2)CC1	ZINC000450948444	EF	On-Demand	Anodyne	CCR4	23	40
COC[C@H]1CCCN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450948452	GE	On-Demand	Bother	TAAR1	28	48
COC[C@H]1CCCN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450948453	GE	On-Demand	Bother	TAAR1	28	48
COC[C@@H]1CCCN(c2ccc(C(=O)N[C@@H](C)C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450948454	GE	On-Demand	Bother	TAAR1	28	48
COC[C@@H]1CCCN(c2ccc(C(=O)N[C@H](C)C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450948455	GE	On-Demand	Bother	TAAR1	28	48
C[C@H](N(Cc1ccccc1)C(=O)c1ccc(C#N)n1C)C(C)(C)C	ZINC000450948463	DH	On-Demand	Mild	PAPA1_CARPA	41	32
C[C@@H](N(Cc1ccccc1)C(=O)c1ccc(C#N)n1C)C(C)(C)C	ZINC000450948464	DH	On-Demand	Mild	PAPA1_CARPA	41	32
CC(=O)c1ccc(CSCCC(=O)OC(C)(C)C)cc1	ZINC000450948471	CH	On-Demand	Anodyne	CACNA2D1	19	41
Cc1noc([C@@H]2CN(CCCOc3cccc(C(C)(C)C)c3)CCN2C)n1	ZINC000450948487	FG	On-Demand	Anodyne	HRH3	43	36
Cc1noc([C@H]2CN(CCCOc3cccc(C(C)(C)C)c3)CCN2C)n1	ZINC000450948488	FG	On-Demand	Anodyne	HRH3	43	36
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450948493	FF	On-Demand	Anodyne	CASP3	42	37
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450948493	FF	On-Demand	Anodyne	CASP7	47	37
COC[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450948493	FF	On-Demand	Anodyne	GCK	21	41
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450948494	FF	On-Demand	Anodyne	CASP3	42	37
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450948494	FF	On-Demand	Anodyne	CASP7	47	37
COC[C@@H]1CCCN(c2ccc(S(=O)(=O)N3CCCCC3)cn2)CC1	ZINC000450948494	FF	On-Demand	Anodyne	GCK	21	41
COC[C@H]1CCCN(c2nc(-c3ccccc3)cs2)CC1	ZINC000450948495	DI	On-Demand	Anodyne	COLA	26	40
COC[C@H]1CCCN(c2nc(-c3ccccc3)cs2)CC1	ZINC000450948495	DI	On-Demand	Anodyne	CPT1A	21	40
COC[C@@H]1CCCN(c2nc(-c3ccccc3)cs2)CC1	ZINC000450948496	DI	On-Demand	Anodyne	COLA	26	40
COC[C@@H]1CCCN(c2nc(-c3ccccc3)cs2)CC1	ZINC000450948496	DI	On-Demand	Anodyne	CPT1A	25	40
CCC(=O)c1ccc(Nc2ccc(CS(=O)(=O)CC)cc2)c([N+](=O)[O-])c1	ZINC000450948499	GH	On-Demand	Bother	COLA	51	34
CNC(=O)CSCc1cccc2c1OC(C)(C)C2	ZINC000450948500	CE	On-Demand	Anodyne	G2YM83_BOTF4	21	41
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@@H](C)c2cccc(C)c2)c([N+](=O)[O-])c1	ZINC000450948501	GG	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@H](C)NC(=O)c1ccc(N[C@H](C)c2cccc(C)c2)c([N+](=O)[O-])c1	ZINC000450948502	GG	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H](C)c2cccc(C)c2)c([N+](=O)[O-])c1	ZINC000450948503	GG	On-Demand	Bother	TAAR1	21	49
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@H](C)c2cccc(C)c2)c([N+](=O)[O-])c1	ZINC000450948504	GG	On-Demand	Bother	TAAR1	21	49
Cc1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c(C(C)C)n1	ZINC000450948516	EH	On-Demand	Anodyne	AVPR1A	0	48
Cc1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)c(C(C)C)n1	ZINC000450948517	EH	On-Demand	Anodyne	AVPR1A	0	48
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@@H]3CC(N)=O)c([N+](=O)[O-])c2)cc1	ZINC000450948539	GE	On-Demand	Bother	MTOR	43	35
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@@H]3CC(N)=O)c([N+](=O)[O-])c2)cc1	ZINC000450948539	GE	On-Demand	Bother	TAAR1	23	47
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@H]3CC(N)=O)c([N+](=O)[O-])c2)cc1	ZINC000450948540	GE	On-Demand	Bother	MTOR	43	35
Cc1ccc(NC(=O)c2ccc(N3CCOC[C@H]3CC(N)=O)c([N+](=O)[O-])c2)cc1	ZINC000450948540	GE	On-Demand	Bother	TAAR1	23	47
COc1cc(F)cc(C[C@H](C)Nc2ncccc2C(=O)N2CCCCC2)c1	ZINC000450948573	FH	On-Demand	Anodyne	CCR3	16	46
COc1cc(F)cc(C[C@@H](C)Nc2ncccc2C(=O)N2CCCCC2)c1	ZINC000450948574	FH	On-Demand	Anodyne	CCR3	16	46
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450948579	ED	On-Demand	Anodyne	PREP	78	38
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450948580	ED	On-Demand	Anodyne	PREP	78	38
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450948581	ED	On-Demand	Anodyne	PREP	78	38
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450948582	ED	On-Demand	Anodyne	PREP	78	38
CC(C)(CN1CCCC1)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000450948598	GF	On-Demand	Bother	TBXA2R	20	40
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450948635	FD	On-Demand	Mild	TGM2	69	41
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450948635	FD	On-Demand	Mild	F13A1	91	46
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450948635	FD	On-Demand	Mild	RAC1	0	42
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450948635	FD	On-Demand	Mild	NAMPT	66	48
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1	ZINC000450948635	FD	On-Demand	Mild	DDIT3	0	42
CC(C)(C)C[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450948648	CG	On-Demand	Anodyne	AKR1C3	29	41
CC(C)(C)C[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450948648	CG	On-Demand	Anodyne	GPR119	34	48
CC(C)(C)C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450948649	CG	On-Demand	Anodyne	AKR1C3	29	41
CC(C)(C)C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C1	ZINC000450948649	CG	On-Demand	Anodyne	GPR119	34	48
CCS(=O)(=O)Cc1ccc(Nc2nccc(OC)n2)cc1	ZINC000450948661	DE	On-Demand	Anodyne	CDK2	45	39
NC(=O)C[C@@H]1COCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450948689	FE	On-Demand	Anodyne	ADRB2	17	44
NC(=O)C[C@@H]1COCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450948689	FE	On-Demand	Anodyne	ADRB3	32	49
NC(=O)C[C@H]1COCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450948691	FE	On-Demand	Anodyne	ADRB2	17	44
NC(=O)C[C@H]1COCCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450948691	FE	On-Demand	Anodyne	ADRB3	32	49
CNS(=O)(=O)NCC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450948700	GC	On-Demand	Anodyne	CCR2	40	36
CNS(=O)(=O)NCC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450948701	GC	On-Demand	Anodyne	CCR2	40	36
CO[C@H](CSCC(=O)Nc1ccc(F)cc1)Cc1ccccc1	ZINC000450948702	EH	On-Demand	Anodyne	FCER2	44	34
CO[C@H](CSCC(=O)Nc1ccc(F)cc1)Cc1ccccc1	ZINC000450948702	EH	On-Demand	Anodyne	CYSP_TRYCR	43	34
CO[C@H](CSCC(=O)Nc1ccc(F)cc1)Cc1ccccc1	ZINC000450948702	EH	On-Demand	Anodyne	NPY5R	21	43
CO[C@H](CSCC(=O)Nc1ccc(F)cc1)Cc1ccccc1	ZINC000450948702	EH	On-Demand	Anodyne	ENPP1	50	33
CO[C@@H](CSCC(=O)Nc1ccc(F)cc1)Cc1ccccc1	ZINC000450948703	EH	On-Demand	Anodyne	FCER2	44	34
CO[C@@H](CSCC(=O)Nc1ccc(F)cc1)Cc1ccccc1	ZINC000450948703	EH	On-Demand	Anodyne	CYSP_TRYCR	43	34
CO[C@@H](CSCC(=O)Nc1ccc(F)cc1)Cc1ccccc1	ZINC000450948703	EH	On-Demand	Anodyne	NPY5R	21	43
CO[C@@H](CSCC(=O)Nc1ccc(F)cc1)Cc1ccccc1	ZINC000450948703	EH	On-Demand	Anodyne	ENPP1	50	33
COC[C@H]1CCCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450948709	DD	On-Demand	Anodyne	SORD	42	37
COC[C@@H]1CCCN(c2ccnc(N3CCOCC3)n2)CC1	ZINC000450948710	DD	On-Demand	Anodyne	SORD	42	37
COc1ccc(CN2CCCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450948723	FD	On-Demand	Mild	FAAH	15	53
COc1ccc(CN2CCCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450948723	FD	On-Demand	Mild	MGLL	0	46
COc1ccc(CN2CCCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450948723	FD	On-Demand	Mild	ABHD6	0	46
CC(C)(C)C[C@@H]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000450948725	DE	On-Demand	Bother	SIRT3	51	34
CC(C)(C)C[C@@H]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000450948725	DE	On-Demand	Bother	SIRT1	51	34
CC(C)(C)C[C@H]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000450948726	DE	On-Demand	Bother	SIRT3	51	34
CC(C)(C)C[C@H]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000450948726	DE	On-Demand	Bother	SIRT1	51	34
COC[C@H]1CCCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CC1	ZINC000450948728	FG	On-Demand	Anodyne	CASP3	21	40
COC[C@H]1CCCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CC1	ZINC000450948728	FG	On-Demand	Anodyne	NPBWR1	48	42
COC[C@@H]1CCCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CC1	ZINC000450948730	FG	On-Demand	Anodyne	CASP3	21	40
COC[C@@H]1CCCN(c2cnn(Cc3ccccc3)c(=O)c2Cl)CC1	ZINC000450948730	FG	On-Demand	Anodyne	NPBWR1	48	42
COC[C@@H]1CCCN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC1	ZINC000450948749	EE	On-Demand	Bother	CASP7	45	35
COC[C@H]1CCCN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC1	ZINC000450948751	EE	On-Demand	Bother	CASP7	45	35
O=C(N1CC[C@@]2(C1)OCc1ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450948760	GH	On-Demand	Anodyne	SIGMAR1	22	48
O=C(N1CC[C@]2(C1)OCc1ccccc12)C1(Cc2ccccc2)CCOCC1	ZINC000450948762	GH	On-Demand	Anodyne	SIGMAR1	22	48
COC[C@H]1CCCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450948792	FE	On-Demand	Anodyne	P2RY12	29	40
COC[C@H]1CCCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450948792	FE	On-Demand	Anodyne	CXCR3	30	43
COC[C@H]1CCCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450948792	FE	On-Demand	Anodyne	LRRK2	30	41
COC[C@@H]1CCCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450948793	FE	On-Demand	Anodyne	P2RY12	29	40
COC[C@@H]1CCCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450948793	FE	On-Demand	Anodyne	CXCR3	30	43
COC[C@@H]1CCCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1	ZINC000450948793	FE	On-Demand	Anodyne	LRRK2	30	41
COC[C@@H]1CCCN(c2nc(O)c3ccccc3n2)CC1	ZINC000450948833	CF	On-Demand	Anodyne	HTR4	38	40
COC[C@@H]1CCCN(c2nc(O)c3ccccc3n2)CC1	ZINC000450948833	CF	On-Demand	Anodyne	CCR4	30	40
COC[C@H]1CCCN(c2nc(O)c3ccccc3n2)CC1	ZINC000450948834	CF	On-Demand	Anodyne	HTR4	38	40
COC[C@H]1CCCN(c2nc(O)c3ccccc3n2)CC1	ZINC000450948834	CF	On-Demand	Anodyne	CCR4	30	40
COc1cccc(OCCC(=O)NCc2nc3cc(C)ccc3n2C)c1	ZINC000450948835	FF	On-Demand	Anodyne	MTNR1A	49	41
COc1cccc(OCCC(=O)NCc2nc3cc(C)ccc3n2C)c1	ZINC000450948835	FF	On-Demand	Anodyne	MTNR1B	40	41
COC[C@H]1CCCN(c2nc(OC)nc(N3CCC[C@@H](COC)CC3)n2)CC1	ZINC000450948843	GE	On-Demand	Anodyne	CCR4	19	41
COC[C@@H]1CCCN(c2nc(OC)nc(N3CCC[C@@H](COC)CC3)n2)CC1	ZINC000450948845	GE	On-Demand	Anodyne	CCR4	19	41
COC[C@H]1CCCN(c2nc(OC)nc(N3CCC[C@H](COC)CC3)n2)CC1	ZINC000450948847	GE	On-Demand	Anodyne	CCR4	19	41
CN(c1ncnc2sc3c(c12)CCC3)C1CCN(CCC(F)(F)F)CC1	ZINC000450948848	GI	On-Demand	Anodyne	RBP4	17	42
CNC(=O)c1ccc(N(C)C2CCN(CCC(F)(F)F)CC2)c([N+](=O)[O-])c1	ZINC000450948855	GF	On-Demand	Bother	CACNA1I	49	39
COc1cc(CSCC(=O)Nc2nc(C)cs2)ccc1Cl	ZINC000450948864	EH	On-Demand	Anodyne	GCK	17	42
COc1cc(CSCC(=O)Nc2nc(C)cs2)ccc1Cl	ZINC000450948864	EH	On-Demand	Anodyne	ENPP1	55	32
COC[C@@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948873	DH	On-Demand	Anodyne	PDE3A	48	37
COC[C@@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948873	DH	On-Demand	Anodyne	FGFR1	0	40
COC[C@@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948873	DH	On-Demand	Anodyne	CCR4	31	40
COC[C@@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948873	DH	On-Demand	Anodyne	FLT1	0	40
COC[C@@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948873	DH	On-Demand	Anodyne	PDE3B	71	37
COC[C@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948874	DH	On-Demand	Anodyne	PDE3A	48	37
COC[C@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948874	DH	On-Demand	Anodyne	FGFR1	0	40
COC[C@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948874	DH	On-Demand	Anodyne	CCR4	31	40
COC[C@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948874	DH	On-Demand	Anodyne	FLT1	0	40
COC[C@H]1CCCN(c2ccnc3cc(F)c(OC)cc23)CC1	ZINC000450948874	DH	On-Demand	Anodyne	PDE3B	71	37
CCc1cc2c(N3CCC[C@@H](COC)CC3)ncnc2s1	ZINC000450948877	DH	On-Demand	Anodyne	SIRT3	50	33
CCc1cc2c(N3CCC[C@@H](COC)CC3)ncnc2s1	ZINC000450948877	DH	On-Demand	Anodyne	SIRT2	40	32
CCc1cc2c(N3CCC[C@@H](COC)CC3)ncnc2s1	ZINC000450948877	DH	On-Demand	Anodyne	SIRT1	40	31
Cc1cccc2c(NC(C)(C)CN3CCCC3)ncnc12	ZINC000450948878	CG	On-Demand	Anodyne	HNMT	50	34
CCc1cc2c(N3CCC[C@H](COC)CC3)ncnc2s1	ZINC000450948879	DH	On-Demand	Anodyne	SIRT3	50	33
CCc1cc2c(N3CCC[C@H](COC)CC3)ncnc2s1	ZINC000450948879	DH	On-Demand	Anodyne	SIRT2	40	32
CCc1cc2c(N3CCC[C@H](COC)CC3)ncnc2s1	ZINC000450948879	DH	On-Demand	Anodyne	SIRT1	40	31
CNS(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450948897	FD	On-Demand	Bother	CASP3	54	39
CNS(=O)(=O)c1ccc(N2CCC[C@@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450948897	FD	On-Demand	Bother	CASP7	65	39
CNS(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450948898	FD	On-Demand	Bother	CASP3	54	39
CNS(=O)(=O)c1ccc(N2CCC[C@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450948898	FD	On-Demand	Bother	CASP7	65	39
CCNC(=O)c1ccc(N[C@H](C)c2cccc(C)c2)nc1	ZINC000450948899	CG	On-Demand	Anodyne	PLK1	27	41
CCNC(=O)c1ccc(N[C@@H](C)c2cccc(C)c2)nc1	ZINC000450948901	CG	On-Demand	Anodyne	PLK1	27	41
COC[C@@H]1CCCN(c2ccc(C#N)cc2[N+](=O)[O-])CC1	ZINC000450948925	CF	On-Demand	Mild	CASP7	47	35
COC[C@H]1CCCN(c2ccc(C#N)cc2[N+](=O)[O-])CC1	ZINC000450948926	CF	On-Demand	Mild	CASP7	47	35
COC[C@@H]1CCCN(c2ncnc3[nH]c(=N)ccc23)CC1	ZINC000450948951	CD	On-Demand	Anodyne	SIRT3	51	32
COC[C@@H]1CCCN(c2ncnc3[nH]c(=N)ccc23)CC1	ZINC000450948951	CD	On-Demand	Anodyne	SIRT2	52	33
COC[C@@H]1CCCN(c2ncnc3[nH]c(=N)ccc23)CC1	ZINC000450948951	CD	On-Demand	Anodyne	SIRT1	51	32
COC[C@H]1CCCN(c2ncnc3[nH]c(=N)ccc23)CC1	ZINC000450948953	CD	On-Demand	Anodyne	SIRT3	51	32
COC[C@H]1CCCN(c2ncnc3[nH]c(=N)ccc23)CC1	ZINC000450948953	CD	On-Demand	Anodyne	SIRT2	52	33
COC[C@H]1CCCN(c2ncnc3[nH]c(=N)ccc23)CC1	ZINC000450948953	CD	On-Demand	Anodyne	SIRT1	51	32
COC[C@@H]1CCCN(c2ccnc(C3CC3)n2)CC1	ZINC000450948966	CF	On-Demand	Anodyne	SORD	68	35
COC[C@H]1CCCN(c2ccnc(C3CC3)n2)CC1	ZINC000450948967	CF	On-Demand	Anodyne	SORD	68	35
COc1cc(N[C@H](C)c2cccc(C)c2)ncn1	ZINC000450948968	BF	On-Demand	Anodyne	PLK1	28	42
COc1cc(N[C@@H](C)c2cccc(C)c2)ncn1	ZINC000450948970	BF	On-Demand	Anodyne	PLK1	28	42
Cc1cc(NC(C)(C)CN2CCCC2)nc(-c2cccnc2)n1	ZINC000450948986	DG	On-Demand	Anodyne	ROS1	51	35
CCC[C@H](NC(=O)Cn1cc(C#N)cn1)c1ccccc1	ZINC000450948992	CE	On-Demand	Mild	CTRB_BOVIN	43	30
CCC[C@H](NC(=O)Cn1cc(C#N)cn1)c1ccccc1	ZINC000450948992	CE	On-Demand	Mild	USP5	0	45
CCC[C@H](NC(=O)Cn1cc(C#N)cn1)c1ccccc1	ZINC000450948992	CE	On-Demand	Mild	USP9X	0	45
CCC[C@@H](NC(=O)Cn1cc(C#N)cn1)c1ccccc1	ZINC000450948993	CE	On-Demand	Mild	CTRB_BOVIN	43	30
CCC[C@@H](NC(=O)Cn1cc(C#N)cn1)c1ccccc1	ZINC000450948993	CE	On-Demand	Mild	USP5	0	45
CCC[C@@H](NC(=O)Cn1cc(C#N)cn1)c1ccccc1	ZINC000450948993	CE	On-Demand	Mild	USP9X	0	45
COC(=O)C1(CSc2cccc([N+](=O)[O-])c2)CCCC1	ZINC000450948999	CG	On-Demand	Bother	CACNA1D	60	37
CCS(=O)(=O)c1ccc(Cn2ccc(C(F)(F)F)cc2=O)cc1	ZINC000450949013	EF	On-Demand	Anodyne	RORC	44	44
CC(C)c1nccc(N2CC(C)(C)[C@@H]3COC[C@@H]32)n1	ZINC000450949014	CE	On-Demand	Anodyne	SORD	50	33
COC[C@@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949034	DH	On-Demand	Anodyne	PDE3A	51	42
COC[C@@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949034	DH	On-Demand	Anodyne	PDGFRB	66	42
COC[C@@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949034	DH	On-Demand	Anodyne	AKT2	30	40
COC[C@@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949034	DH	On-Demand	Anodyne	FLT1	0	44
COC[C@@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949034	DH	On-Demand	Anodyne	HNMT	46	32
COC[C@@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949034	DH	On-Demand	Anodyne	PDE3B	76	42
COC[C@@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949034	DH	On-Demand	Anodyne	SIRT3	51	31
COC[C@@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949034	DH	On-Demand	Anodyne	SIRT2	52	32
COC[C@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949036	DH	On-Demand	Anodyne	PDE3A	51	42
COC[C@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949036	DH	On-Demand	Anodyne	PDGFRB	66	42
COC[C@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949036	DH	On-Demand	Anodyne	AKT2	30	40
COC[C@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949036	DH	On-Demand	Anodyne	FLT1	0	44
COC[C@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949036	DH	On-Demand	Anodyne	HNMT	46	32
COC[C@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949036	DH	On-Demand	Anodyne	PDE3B	76	42
COC[C@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949036	DH	On-Demand	Anodyne	SIRT3	51	31
COC[C@H]1CCCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000450949036	DH	On-Demand	Anodyne	SIRT2	52	32
CN(c1ncccn1)C1CCN(CCC(F)(F)F)CC1	ZINC000450949046	CE	On-Demand	Anodyne	HTR4	0	44
COC[C@@H]1CCCN(c2ncccc2-c2nc(C)no2)CC1	ZINC000450949055	DF	On-Demand	Anodyne	ELANE	0	40
COC[C@H]1CCCN(c2ncccc2-c2nc(C)no2)CC1	ZINC000450949056	DF	On-Demand	Anodyne	ELANE	0	40
COC[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450949058	DF	On-Demand	Bother	PDE3B	52	32
COC[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450949058	DF	On-Demand	Bother	SIRT3	48	31
COC[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450949058	DF	On-Demand	Bother	SIRT2	43	31
COC[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450949058	DF	On-Demand	Bother	SIRT1	48	31
COC[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450949060	DF	On-Demand	Bother	PDE3B	52	32
COC[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450949060	DF	On-Demand	Bother	SIRT3	48	31
COC[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450949060	DF	On-Demand	Bother	SIRT2	43	31
COC[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000450949060	DF	On-Demand	Bother	SIRT1	48	31
CC(C)(C)C[C@H]1CCN(c2cc(-n3cccn3)nc(N)n2)C1	ZINC000450949070	DE	On-Demand	Anodyne	HRH4	51	40
CC(C)(C)C[C@@H]1CCN(c2cc(-n3cccn3)nc(N)n2)C1	ZINC000450949077	DE	On-Demand	Anodyne	HRH4	51	40
CCNC(=O)c1ccc(N[C@H](C)Cc2cc(F)cc(OC)c2)nc1	ZINC000450949078	EG	On-Demand	Anodyne	GCK	26	47
CCNC(=O)c1ccc(N[C@@H](C)Cc2cc(F)cc(OC)c2)nc1	ZINC000450949079	EG	On-Demand	Anodyne	GCK	26	47
COC[C@@H]1CCCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])CC1	ZINC000450949096	EE	On-Demand	Bother	CACNA1D	48	38
COC[C@H]1CCCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])CC1	ZINC000450949098	EE	On-Demand	Bother	CACNA1D	48	38
COC[C@H]1CCCN(c2cnn(Cc3ccccc3)c(=O)c2)CC1	ZINC000450949103	EF	On-Demand	Anodyne	CASP3	27	41
COC[C@@H]1CCCN(c2cnn(Cc3ccccc3)c(=O)c2)CC1	ZINC000450949105	EF	On-Demand	Anodyne	CASP3	27	41
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450949109	EF	On-Demand	Anodyne	SCD1	58	50
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450949109	EF	On-Demand	Anodyne	SCD	30	44
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450949109	EF	On-Demand	Anodyne	DGAT1	38	44
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450949110	EF	On-Demand	Anodyne	SCD1	58	50
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450949110	EF	On-Demand	Anodyne	SCD	30	44
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000450949110	EF	On-Demand	Anodyne	DGAT1	38	44
Cc1cc(N(C)C2CCN(CCC(F)(F)F)CC2)n2ncnc2n1	ZINC000450949130	EE	On-Demand	Anodyne	DHOD	0	43
COC[C@@H]1CCCN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450949132	GD	On-Demand	Bother	CACNA1I	41	33
COC[C@@H]1CCCN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450949132	GD	On-Demand	Bother	TAAR1	39	49
COC[C@H]1CCCN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450949134	GD	On-Demand	Bother	CACNA1I	41	33
COC[C@H]1CCCN(c2ccc(C(=O)NCC(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000450949134	GD	On-Demand	Bother	TAAR1	39	49
NC(=O)C[C@@H]1COCCN1c1cc(C(F)(F)F)nc(-c2ccncc2)n1	ZINC000450949145	FD	On-Demand	Anodyne	PIK3CA	18	40
NC(=O)C[C@@H]1COCCN1c1cc(C(F)(F)F)nc(-c2ccncc2)n1	ZINC000450949145	FD	On-Demand	Anodyne	MTOR	56	40
NC(=O)C[C@H]1COCCN1c1cc(C(F)(F)F)nc(-c2ccncc2)n1	ZINC000450949147	FD	On-Demand	Anodyne	PIK3CA	18	40
NC(=O)C[C@H]1COCCN1c1cc(C(F)(F)F)nc(-c2ccncc2)n1	ZINC000450949147	FD	On-Demand	Anodyne	MTOR	56	40
COC(=O)c1ccc(CN2CCC[C@H]2Cn2cc(C3CC3)nn2)cc1Cl	ZINC000450949151	FG	On-Demand	Anodyne	OPRK1	27	42
COc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)ccc1Cl	ZINC000450949154	FE	On-Demand	Anodyne	DRD4	33	42
COc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)ccc1Cl	ZINC000450949154	FE	On-Demand	Anodyne	ACHE	20	41
COc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)ccc1Cl	ZINC000450949154	FE	On-Demand	Anodyne	HTR4	59	40
COc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)ccc1Cl	ZINC000450949154	FE	On-Demand	Anodyne	SIGMAR1	20	46
COc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)ccc1Cl	ZINC000450949154	FE	On-Demand	Anodyne	SSTR5	65	40
COc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)ccc1Cl	ZINC000450949154	FE	On-Demand	Anodyne	CCR3	25	40
COc1cc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)ccc1Cl	ZINC000450949154	FE	On-Demand	Anodyne	MCHR1	27	44
COC[C@@H]1CCCN(c2cnc3ccccc3n2)CC1	ZINC000450949156	CF	On-Demand	Anodyne	HTR4	52	38
COC[C@H]1CCCN(c2cnc3ccccc3n2)CC1	ZINC000450949157	CF	On-Demand	Anodyne	HTR4	52	38
CNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450949158	DE	On-Demand	Bother	TAAR1	32	51
CNC(=O)c1ccc(N2CCC[C@H](COC)CC2)c([N+](=O)[O-])c1	ZINC000450949160	DE	On-Demand	Bother	TAAR1	32	51
COC[C@H]1CCCN(c2cc(C(C)=O)ccc2S(C)(=O)=O)CC1	ZINC000450949162	EF	On-Demand	Anodyne	CASP7	40	35
COC[C@@H]1CCCN(c2cc(C(C)=O)ccc2S(C)(=O)=O)CC1	ZINC000450949163	EF	On-Demand	Anodyne	CASP7	40	35
CC[C@@H](Nc1nccc(-c2ccc(OC)cc2)n1)C(=O)NC	ZINC000450949169	DE	On-Demand	Anodyne	SMG1	64	35
CC[C@H](Nc1nccc(-c2ccc(OC)cc2)n1)C(=O)NC	ZINC000450949171	DE	On-Demand	Anodyne	SMG1	64	35
Cc1cccc([C@@H](C)Nc2ncc(C)c(C)n2)c1	ZINC000450949173	BH	On-Demand	Anodyne	PLK1	24	40
CC1(CC(F)(F)F)CN(c2ccc(C(=O)Nc3ccccc3)nn2)C1	ZINC000450949174	FH	On-Demand	Anodyne	SCD1	36	40
Cc1cccc([C@H](C)Nc2ncc(C)c(C)n2)c1	ZINC000450949183	BH	On-Demand	Anodyne	PLK1	24	40
Cc1nccc(N2CC[C@H](CC(C)(C)C)C2)n1	ZINC000450949184	BG	On-Demand	Anodyne	HRH4	0	44
Cc1nccc(N2CC[C@H](CC(C)(C)C)C2)n1	ZINC000450949184	BG	On-Demand	Anodyne	SORD	49	35
Cc1nccc(N2CC[C@@H](CC(C)(C)C)C2)n1	ZINC000450949185	BG	On-Demand	Anodyne	HRH4	0	44
Cc1nccc(N2CC[C@@H](CC(C)(C)C)C2)n1	ZINC000450949185	BG	On-Demand	Anodyne	SORD	49	35
COC[C@@H]1CCCN(c2nc(C)cc(C)n2)CC1	ZINC000450949186	BE	On-Demand	Anodyne	CCR4	23	40
COC[C@H]1CCCN(c2nc(C)cc(C)n2)CC1	ZINC000450949187	BE	On-Demand	Anodyne	CCR4	23	40
NC(=O)C[C@@H]1COCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450949191	FF	On-Demand	Anodyne	ADRB3	29	47
NC(=O)C[C@H]1COCCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450949193	FF	On-Demand	Anodyne	ADRB3	29	47
Cc1c(C(=O)NC2(C#N)CCC(C(C)(C)C)CC2)nn2c1OCCC2	ZINC000450949196	EG	On-Demand	Mild	TSPO	0	41
COC[C@@H]1CCCN(c2nccc(C)n2)CC1	ZINC000450949197	BE	On-Demand	Anodyne	SORD	23	43
COC[C@H]1CCCN(c2nccc(C)n2)CC1	ZINC000450949198	BE	On-Demand	Anodyne	SORD	23	43
Cc1cc(N2CCN(CCO)C[C@@H]2C)nc(-c2cccnc2)n1	ZINC000450949243	DD	On-Demand	Anodyne	ROS1	53	39
Cc1cc(N2CCN(CCO)C[C@H]2C)nc(-c2cccnc2)n1	ZINC000450949244	DD	On-Demand	Anodyne	ROS1	53	39
Cc1cc(N2CCN(CCO)C[C@@H]2C)nc(-c2ccccn2)n1	ZINC000450949264	DD	On-Demand	Anodyne	METAP1	28	40
Cc1cc(N2CCN(CCO)C[C@H]2C)nc(-c2ccccn2)n1	ZINC000450949265	DD	On-Demand	Anodyne	METAP1	28	40
C[C@@H]1CN(CCO)CCN1c1ncnc2c1oc1ccccc12	ZINC000450949303	DD	On-Demand	Anodyne	HRH4	19	54
C[C@H]1CN(CCO)CCN1c1ncnc2c1oc1ccccc12	ZINC000450949304	DD	On-Demand	Anodyne	HRH4	19	54
OCCC[C@@H]1CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450949311	DF	On-Demand	Anodyne	RBP4	18	44
OCCC[C@H]1CCN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450949312	DF	On-Demand	Anodyne	RBP4	18	44
COC1(CSc2cccc([N+](=O)[O-])c2)CCC1	ZINC000450949316	CG	On-Demand	Bother	CACNA1D	45	33
CC1(C)CCCN1CCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000450949348	EG	On-Demand	Anodyne	DHOD	0	40
Cn1c(C(C)(C)NC(=O)[C@@H](O)C2CCC2)nc2ccccc21	ZINC000450949362	DE	On-Demand	Anodyne	NR1H4	23	40
Cn1c(C(C)(C)NC(=O)[C@H](O)C2CCC2)nc2ccccc21	ZINC000450949363	DE	On-Demand	Anodyne	NR1H4	23	40
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1	ZINC000450949365	GH	On-Demand	Anodyne	PREP	46	37
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1	ZINC000450949366	GH	On-Demand	Anodyne	PREP	46	37
CC1(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)CCC(=O)CC1	ZINC000450949368	EH	On-Demand	Anodyne	CCR3	25	41
COCCNC(=O)c1ccc(N[C@H](C)Cc2cc(F)cc(OC)c2)nc1	ZINC000450949383	FF	On-Demand	Anodyne	GCK	27	48
COCCNC(=O)c1ccc(N[C@@H](C)Cc2cc(F)cc(OC)c2)nc1	ZINC000450949384	FF	On-Demand	Anodyne	GCK	27	48
Cc1nc(N(C)C2CCN(CCC(F)(F)F)CC2)c(Cl)cc1C#N	ZINC000450949390	FH	On-Demand	Mild	PGR	24	49
Cc1cc(NCCN2CCCC2(C)C)nc(-c2cccnc2)n1	ZINC000450949391	DF	On-Demand	Anodyne	ROS1	61	39
COc1cc(F)cc(C[C@H](C)Nc2cc(C)nc3ncnn23)c1	ZINC000450949404	DF	On-Demand	Anodyne	DHOD	0	43
COc1cc(F)cc(C[C@@H](C)Nc2cc(C)nc3ncnn23)c1	ZINC000450949405	DF	On-Demand	Anodyne	DHOD	0	43
COC[C@H]1CCCN(c2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)CC1	ZINC000450949428	GI	On-Demand	Anodyne	NPBWR1	44	38
COC[C@@H]1CCCN(c2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)CC1	ZINC000450949429	GI	On-Demand	Anodyne	NPBWR1	44	38
Cc1cccc([C@H](C)Nc2nccc(C(F)F)n2)c1	ZINC000450949430	CH	On-Demand	Anodyne	HTR7	18	40
Cc1cccc([C@@H](C)Nc2nccc(C(F)F)n2)c1	ZINC000450949431	CH	On-Demand	Anodyne	HTR7	18	40
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	ADORA1	140	60
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	SLC29A1	133	60
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	ADORA2A	51	56
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	ADORA2B	47	55
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	ADK	52	55
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	AHCY	53	39
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	CDA	55	33
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	P2RX1	43	37
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	AMD1	19	40
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	ITPR1	52	38
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	NS5B	0	45
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	ADORA3	98	55
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	OXGR1	118	40
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	MTAP	0	43
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	AK	0	49
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	DNMT3B	66	39
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	Q4VQ11_PIG	78	55
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	DOT1L	88	39
CC(C)(C)C[C@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949433	GC	On-Demand	Anodyne	METJ	0	40
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	ADORA1	140	60
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	SLC29A1	133	60
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	ADORA2A	51	56
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	ADORA2B	47	55
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	ADK	52	55
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	AHCY	53	39
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	CDA	55	33
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	P2RX1	43	37
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	AMD1	19	40
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	ITPR1	52	38
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	NS5B	0	45
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	ADORA3	98	55
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	OXGR1	118	40
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	MTAP	0	43
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	AK	0	49
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	DNMT3B	66	39
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	Q4VQ11_PIG	78	55
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	DOT1L	88	39
CC(C)(C)C[C@@H]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1	ZINC000450949434	GC	On-Demand	Anodyne	METJ	0	40
CCNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nc1	ZINC000450949437	CG	On-Demand	Anodyne	HDAC1	27	42
CCNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nc1	ZINC000450949438	CG	On-Demand	Anodyne	HDAC1	27	42
CCS(=O)(=O)Cc1ccc(Nc2nc(-c3cccnc3)nc(C)c2C)cc1	ZINC000450949439	GH	On-Demand	Anodyne	PDE4B	32	49
CCS(=O)(=O)Cc1ccc(Nc2nc(-c3cccnc3)nc(C)c2C)cc1	ZINC000450949439	GH	On-Demand	Anodyne	PDE4D	25	49
COC[C@H]1CCCN(c2cc(C)nc3c(F)cccc23)CC1	ZINC000450949447	DH	On-Demand	Anodyne	HTR4	24	42
COC[C@@H]1CCCN(c2cc(C)nc3c(F)cccc23)CC1	ZINC000450949448	DH	On-Demand	Anodyne	HTR4	24	42
COC[C@H]1CCCN(c2cccc(C(=O)OC(C)(C)C)n2)CC1	ZINC000450949454	DG	On-Demand	Anodyne	PRKCQ	19	42
COC[C@@H]1CCCN(c2cccc(C(=O)OC(C)(C)C)n2)CC1	ZINC000450949455	DG	On-Demand	Anodyne	PRKCQ	19	42
Cc1cccc([C@@H](C)Nc2nccc(C)n2)c1	ZINC000450949458	BG	On-Demand	Anodyne	HTR7	19	41
Cc1cccc([C@H](C)Nc2nccc(C)n2)c1	ZINC000450949459	BG	On-Demand	Anodyne	HTR7	19	41
Cc1cccc([C@@H](C)Nc2cc(C)ncn2)c1	ZINC000450949460	BG	On-Demand	Anodyne	PLK1	28	44
Cc1cccc([C@H](C)Nc2cc(C)ncn2)c1	ZINC000450949461	BG	On-Demand	Anodyne	PLK1	28	44
CCS(=O)(=O)Cc1ccc(Nc2cc(C)nc3ncnn23)cc1	ZINC000450949476	EE	On-Demand	Anodyne	DHOD	0	76
COC[C@@H]1CCCN(c2ncnc3cccc(F)c23)CC1	ZINC000450949477	CG	On-Demand	Anodyne	HTR4	26	40
COC[C@H]1CCCN(c2ncnc3cccc(F)c23)CC1	ZINC000450949478	CG	On-Demand	Anodyne	HTR4	26	40
COC[C@H]1CCCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1	ZINC000450949487	FF	On-Demand	Anodyne	HRH1	0	43
COC[C@H]1CCCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1	ZINC000450949487	FF	On-Demand	Anodyne	HTR3A	23	50
COC[C@H]1CCCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1	ZINC000450949487	FF	On-Demand	Anodyne	HTR4	28	42
COC[C@H]1CCCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1	ZINC000450949487	FF	On-Demand	Anodyne	HRH4	32	50
COC[C@@H]1CCCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1	ZINC000450949488	FF	On-Demand	Anodyne	HRH1	0	43
COC[C@@H]1CCCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1	ZINC000450949488	FF	On-Demand	Anodyne	HTR3A	23	50
COC[C@@H]1CCCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1	ZINC000450949488	FF	On-Demand	Anodyne	HTR4	28	42
COC[C@@H]1CCCN(c2nc3ccccc3nc2N2CCN(C)CC2)CC1	ZINC000450949488	FF	On-Demand	Anodyne	HRH4	32	50
COC[C@@H]1CCCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1	ZINC000450949496	DG	On-Demand	Bother	CACNA1D	50	39
COC[C@H]1CCCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1	ZINC000450949497	DG	On-Demand	Bother	CACNA1D	50	39
Cc1cccc([C@@H](C)Nc2ccc(C(=O)N(C)C)cn2)c1	ZINC000450949500	CG	On-Demand	Anodyne	PLK1	31	43
Cc1cccc([C@H](C)Nc2ccc(C(=O)N(C)C)cn2)c1	ZINC000450949501	CG	On-Demand	Anodyne	PLK1	31	43
CNC(=O)CSCCc1ccc(Cl)cc1	ZINC000450949504	BE	On-Demand	Anodyne	SLC6A1	0	46
COC(=O)CNC(=O)c1ccc(N2CCN(CCO)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450949521	GC	On-Demand	Bother	DRD4	40	31
COC(=O)CNC(=O)c1ccc(N2CCN(CCO)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450949521	GC	On-Demand	Bother	TAAR1	19	40
COC(=O)CNC(=O)c1ccc(N2CCN(CCO)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450949522	GC	On-Demand	Bother	DRD4	40	31
COC(=O)CNC(=O)c1ccc(N2CCN(CCO)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450949522	GC	On-Demand	Bother	TAAR1	19	40
OCCC[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450949529	CF	On-Demand	Anodyne	PDE3A	50	38
OCCC[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450949529	CF	On-Demand	Anodyne	PDE3B	73	38
OCCC[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450949529	CF	On-Demand	Anodyne	SIRT3	50	32
OCCC[C@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450949529	CF	On-Demand	Anodyne	SIRT2	52	33
OCCC[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450949530	CF	On-Demand	Anodyne	PDE3A	50	38
OCCC[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450949530	CF	On-Demand	Anodyne	PDE3B	73	38
OCCC[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450949530	CF	On-Demand	Anodyne	SIRT3	50	32
OCCC[C@@H]1CCN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450949530	CF	On-Demand	Anodyne	SIRT2	52	33
C[C@@H]1CN(CCO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450949539	DD	On-Demand	Anodyne	HRP1_PLAFA	81	36
C[C@@H]1CN(CCO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450949539	DD	On-Demand	Anodyne	HNMT	48	34
C[C@@H]1CN(CCO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450949539	DD	On-Demand	Anodyne	HTT	0	44
C[C@H]1CN(CCO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450949540	DD	On-Demand	Anodyne	HRP1_PLAFA	81	36
C[C@H]1CN(CCO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450949540	DD	On-Demand	Anodyne	HNMT	48	34
C[C@H]1CN(CCO)CCN1c1ncnc2cc(Cl)ccc12	ZINC000450949540	DD	On-Demand	Anodyne	HTT	0	44
C[C@@H]1CN(CCO)CCN1c1ncc(Cl)cc1Cl	ZINC000450949552	CD	On-Demand	Anodyne	CXCR3	26	40
C[C@H]1CN(CCO)CCN1c1ncc(Cl)cc1Cl	ZINC000450949553	CD	On-Demand	Anodyne	CXCR3	26	40
C[C@H]1CN(CCO)CCN1c1nc2cc(F)ccc2o1	ZINC000450949562	CD	On-Demand	Anodyne	HTR3A	15	55
C[C@@H]1CN(CCO)CCN1c1nc2cc(F)ccc2o1	ZINC000450949563	CD	On-Demand	Anodyne	HTR3A	15	55
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@@H]3C)nc2)cc1	ZINC000450949574	FE	On-Demand	Anodyne	ABL1	44	39
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@@H]3C)nc2)cc1	ZINC000450949574	FE	On-Demand	Anodyne	PRNP	53	36
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@@H]3C)nc2)cc1	ZINC000450949574	FE	On-Demand	Anodyne	HDAC1	17	42
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@@H]3C)nc2)cc1	ZINC000450949574	FE	On-Demand	Anodyne	P4HTM	0	47
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@@H]3C)nc2)cc1	ZINC000450949574	FE	On-Demand	Anodyne	MCHR1	16	40
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@@H]3C)nc2)cc1	ZINC000450949574	FE	On-Demand	Anodyne	NOD2	40	34
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@H]3C)nc2)cc1	ZINC000450949575	FE	On-Demand	Anodyne	ABL1	44	39
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@H]3C)nc2)cc1	ZINC000450949575	FE	On-Demand	Anodyne	PRNP	53	36
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@H]3C)nc2)cc1	ZINC000450949575	FE	On-Demand	Anodyne	HDAC1	17	42
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@H]3C)nc2)cc1	ZINC000450949575	FE	On-Demand	Anodyne	P4HTM	0	47
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@H]3C)nc2)cc1	ZINC000450949575	FE	On-Demand	Anodyne	MCHR1	16	40
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@H]3C)nc2)cc1	ZINC000450949575	FE	On-Demand	Anodyne	NOD2	40	34
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@@H](CCCO)C1	ZINC000450949576	EC	On-Demand	Anodyne	CA2	25	52
COC(=O)c1cc(S(N)(=O)=O)ccc1N1CC[C@H](CCCO)C1	ZINC000450949577	EC	On-Demand	Anodyne	CA2	25	52
CC1(CC(F)(F)F)CN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450949595	DI	On-Demand	Anodyne	HTT	0	44
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)cc1OC	ZINC000450949605	GE	On-Demand	Anodyne	TRPV1	38	41
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)cc1OC	ZINC000450949606	GE	On-Demand	Anodyne	TRPV1	38	41
CC(C)(CN1CCCC1)Nc1cc(C(F)(F)F)nc2ncnn12	ZINC000450949646	EE	On-Demand	Anodyne	DHOD	0	51
CCCCCC(=O)Nc1ccc(C(=O)Cn2cc(C#N)cn2)cc1	ZINC000450949679	DG	On-Demand	Mild	ENPP2	22	41
CCN(CCO)CCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450949724	CC	On-Demand	Anodyne	HPGDS	20	44
CCn1cnc2c(Nc3ccc(CS(=O)(=O)CC)cc3)ncnc21	ZINC000450949731	EF	On-Demand	Anodyne	CDK1	24	45
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)CC1	ZINC000450949733	EE	On-Demand	Anodyne	DGAT1	24	42
COC[C@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)CC1	ZINC000450949734	EE	On-Demand	Anodyne	DGAT1	24	42
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	DRD1	15	43
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	DRD4	0	47
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	HTR2A	24	48
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	HTR2C	19	48
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	SLC6A1	66	35
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	ERG2	20	42
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	CCR3	55	35
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	SLC18A3	0	40
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949763	GI	On-Demand	Anodyne	CYP2J2	53	38
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	DRD1	15	43
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	DRD4	0	47
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	HTR2A	24	48
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	HTR2C	19	48
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	SLC6A1	66	35
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	ERG2	20	42
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	CCR3	55	35
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	SLC18A3	0	40
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450949764	GI	On-Demand	Anodyne	CYP2J2	53	38
CC1(CSCC(=O)Nc2ccc(F)cc2)CCC1	ZINC000450949786	CH	On-Demand	Anodyne	FUCA1	22	40
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949787	GI	On-Demand	Anodyne	HTR2A	18	44
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949787	GI	On-Demand	Anodyne	HTR2C	16	43
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949787	GI	On-Demand	Anodyne	SLC6A1	144	40
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949787	GI	On-Demand	Anodyne	DRD3	15	41
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949787	GI	On-Demand	Anodyne	CYP2J2	60	43
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949788	GI	On-Demand	Anodyne	HTR2A	18	44
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949788	GI	On-Demand	Anodyne	HTR2C	16	43
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949788	GI	On-Demand	Anodyne	SLC6A1	144	40
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949788	GI	On-Demand	Anodyne	DRD3	15	41
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450949788	GI	On-Demand	Anodyne	CYP2J2	60	43
NC(=O)C[C@H]1COCCN1c1nc(-c2ccccc2)c2ccccc2n1	ZINC000450949815	EE	On-Demand	Anodyne	TACR3	42	37
NC(=O)C[C@@H]1COCCN1c1nc(-c2ccccc2)c2ccccc2n1	ZINC000450949816	EE	On-Demand	Anodyne	TACR3	42	37
C[C@@H]1CN(CCO)CCN1c1ccnc(N(C)C)n1	ZINC000450949826	CC	On-Demand	Anodyne	SORD	41	38
C[C@H]1CN(CCO)CCN1c1ccnc(N(C)C)n1	ZINC000450949850	CC	On-Demand	Anodyne	SORD	41	38
O=C(CCCN1CCC[C@H]1Cn1ccnn1)c1ccc(Br)cc1	ZINC000450949874	GG	On-Demand	Anodyne	CYP2J2	44	31
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949906	FE	On-Demand	Anodyne	ABL1	45	37
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949906	FE	On-Demand	Anodyne	CPT1A	52	31
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949906	FE	On-Demand	Anodyne	PRNP	35	40
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949906	FE	On-Demand	Anodyne	HDAC1	17	41
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949906	FE	On-Demand	Anodyne	CXCR3	24	41
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949906	FE	On-Demand	Anodyne	TAAR1	34	43
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949906	FE	On-Demand	Anodyne	DDR1	43	38
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949908	FE	On-Demand	Anodyne	ABL1	45	37
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949908	FE	On-Demand	Anodyne	CPT1A	52	31
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949908	FE	On-Demand	Anodyne	PRNP	35	40
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949908	FE	On-Demand	Anodyne	HDAC1	17	41
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949908	FE	On-Demand	Anodyne	CXCR3	24	41
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949908	FE	On-Demand	Anodyne	TAAR1	34	43
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000450949908	FE	On-Demand	Anodyne	DDR1	43	38
COc1ccc(-c2nnc(N3CCN(CCO)C[C@@H]3C)c3ccccc23)cc1	ZINC000450949924	GF	On-Demand	Anodyne	SMO	58	52
COc1ccc(-c2nnc(N3CCN(CCO)C[C@H]3C)c3ccccc23)cc1	ZINC000450949926	GF	On-Demand	Anodyne	SMO	58	52
CN1C[C@@H]2[C@@H](CCCN2Cc2ccn(CCc3ccccc3)n2)C1=O	ZINC000450949942	EE	On-Demand	Anodyne	HRH3	19	40
Cc1cc(N2CC(C)(CC(F)(F)F)C2)n2ncnc2n1	ZINC000450949955	CE	On-Demand	Anodyne	DHOD	0	43
O=C(N1CC[C@@H](c2c(F)cccc2F)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450949963	GI	On-Demand	Anodyne	SLC12A5	46	34
O=C(N1CC[C@H](c2c(F)cccc2F)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450949965	GI	On-Demand	Anodyne	SLC12A5	46	34
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@H](CCCO)C1	ZINC000450949973	FG	On-Demand	Anodyne	ATP4A	18	47
CCOC(=O)c1cnc2c(OC)cccc2c1N1CC[C@@H](CCCO)C1	ZINC000450949974	FG	On-Demand	Anodyne	ATP4A	18	47
N=c1ccc2c(N3CC[C@H](CCCO)C3)ncnc2[nH]1	ZINC000450949978	CD	On-Demand	Anodyne	SIRT2	53	35
N=c1ccc2c(N3CC[C@H](CCCO)C3)ncnc2[nH]1	ZINC000450949978	CD	On-Demand	Anodyne	SIRT1	52	32
N=c1ccc2c(N3CC[C@@H](CCCO)C3)ncnc2[nH]1	ZINC000450949980	CD	On-Demand	Anodyne	SIRT2	53	35
N=c1ccc2c(N3CC[C@@H](CCCO)C3)ncnc2[nH]1	ZINC000450949980	CD	On-Demand	Anodyne	SIRT1	52	32
C[C@@H]1CN(CCO)CCN1c1ccc(C(F)(F)F)c(C#N)c1	ZINC000450949994	DE	On-Demand	Mild	AR	29	42
C[C@H]1CN(CCO)CCN1c1ccc(C(F)(F)F)c(C#N)c1	ZINC000450949995	DE	On-Demand	Mild	AR	29	42
COc1cc(OC)c2ncnc(N(C)[C@@H]3CCN(C(C)C)C3)c2c1	ZINC000450950009	EF	On-Demand	Anodyne	PDE3B	60	33
COc1cc(OC)c2ncnc(N(C)[C@H]3CCN(C(C)C)C3)c2c1	ZINC000450950010	EF	On-Demand	Anodyne	PDE3B	60	33
COc1cc(CN2CCC[C@@H](c3nc(C(F)(F)F)cn3C)C2)ccc1Cl	ZINC000450950020	GI	On-Demand	Anodyne	SSTR5	48	35
COc1cc(CN2CCC[C@H](c3nc(C(F)(F)F)cn3C)C2)ccc1Cl	ZINC000450950021	GI	On-Demand	Anodyne	SSTR5	48	35
COC[C@@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950024	EE	On-Demand	Anodyne	ADRA1D	18	56
COC[C@@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950024	EE	On-Demand	Anodyne	ADRA1B	46	56
COC[C@@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950024	EE	On-Demand	Anodyne	PDE3A	47	36
COC[C@@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950024	EE	On-Demand	Anodyne	CCR4	56	53
COC[C@@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950024	EE	On-Demand	Anodyne	PDE3B	69	36
COC[C@@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950024	EE	On-Demand	Anodyne	EHMT2	89	44
COC[C@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950025	EE	On-Demand	Anodyne	ADRA1D	18	56
COC[C@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950025	EE	On-Demand	Anodyne	ADRA1B	46	56
COC[C@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950025	EE	On-Demand	Anodyne	PDE3A	47	36
COC[C@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950025	EE	On-Demand	Anodyne	CCR4	56	53
COC[C@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950025	EE	On-Demand	Anodyne	PDE3B	69	36
COC[C@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)CC1	ZINC000450950025	EE	On-Demand	Anodyne	EHMT2	89	44
COC[C@@H]1CCCN(c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000450950028	CF	On-Demand	Bother	CASP7	43	37
COC[C@@H]1CCCN(c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000450950028	CF	On-Demand	Bother	TAAR1	17	42
COC[C@H]1CCCN(c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000450950029	CF	On-Demand	Bother	CASP7	43	37
COC[C@H]1CCCN(c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000450950029	CF	On-Demand	Bother	TAAR1	17	42
CCS(=O)(=O)Cc1ccc(Nc2nc(C)nc3ccc(OC)cc23)cc1	ZINC000450950039	FH	On-Demand	Anodyne	GLMU	0	45
COC[C@@H]1CCCN(c2ccccc2S(C)(=O)=O)CC1	ZINC000450950055	CE	On-Demand	Anodyne	CASP7	41	37
COC[C@H]1CCCN(c2ccccc2S(C)(=O)=O)CC1	ZINC000450950056	CE	On-Demand	Anodyne	CASP7	41	37
CN(C)[C@@H](CNC(=O)c1ccc(N2CCC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000450950057	GG	On-Demand	Anodyne	CCR2	66	37
CN(C)[C@@H](CNC(=O)c1ccc(N2CCC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000450950057	GG	On-Demand	Anodyne	SCD1	33	45
CN(C)[C@@H](CNC(=O)c1ccc(N2CCC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000450950057	GG	On-Demand	Anodyne	HPGDS	31	42
CN(C)[C@H](CNC(=O)c1ccc(N2CCC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000450950058	GG	On-Demand	Anodyne	CCR2	66	37
CN(C)[C@H](CNC(=O)c1ccc(N2CCC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000450950058	GG	On-Demand	Anodyne	SCD1	33	45
CN(C)[C@H](CNC(=O)c1ccc(N2CCC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000450950058	GG	On-Demand	Anodyne	HPGDS	31	42
C=CCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450950063	DE	On-Demand	Mild	CETP	0	41
C=CCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450950063	DE	On-Demand	Mild	DGAT1	17	40
C=CCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450950063	DE	On-Demand	Mild	HPGDS	15	42
C=CCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450950064	DE	On-Demand	Mild	CETP	0	41
C=CCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450950064	DE	On-Demand	Mild	DGAT1	17	40
C=CCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450950064	DE	On-Demand	Mild	HPGDS	15	42
CCS(=O)(=O)Cc1ccc(Nc2ccc(CC(=O)OC)cc2[N+](=O)[O-])cc1	ZINC000450950079	GF	On-Demand	Bother	COLA	43	34
COC[C@@H]1CCCN(c2nnc(-c3ccccc3)s2)CC1	ZINC000450950080	DG	On-Demand	Anodyne	HRH3	18	57
COC[C@H]1CCCN(c2nnc(-c3ccccc3)s2)CC1	ZINC000450950081	DG	On-Demand	Anodyne	HRH3	18	57
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H](c1ccccc1)N(C)C	ZINC000450950115	EF	On-Demand	Anodyne	HDAC1	27	44
C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H](c1ccccc1)N(C)C	ZINC000450950116	EF	On-Demand	Anodyne	HDAC1	27	44
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@H](c1ccccc1)N(C)C	ZINC000450950117	EF	On-Demand	Anodyne	HDAC1	27	44
C[C@H](NC(=O)c1ccc(N2CCC2)nc1)[C@@H](c1ccccc1)N(C)C	ZINC000450950118	EF	On-Demand	Anodyne	HDAC1	27	44
NC(=O)C[C@@H]1COCCN1c1nc(-c2ccccc2)ns1	ZINC000450950131	DD	On-Demand	Anodyne	FAAH	0	42
NC(=O)C[C@H]1COCCN1c1nc(-c2ccccc2)ns1	ZINC000450950132	DD	On-Demand	Anodyne	FAAH	0	42
Cc1cccc2ncnc(NC(C)(C)CN3CCCC3)c12	ZINC000450950141	CG	On-Demand	Anodyne	HNMT	44	34
Clc1ccc(CCN2CCC[C@H]2Cn2cc(C3CC3)nn2)cc1	ZINC000450950166	EH	On-Demand	Anodyne	HRH1	34	41
Clc1ccc(CCN2CCC[C@H]2Cn2cc(C3CC3)nn2)cc1	ZINC000450950166	EH	On-Demand	Anodyne	ADRA1B	0	41
Clc1ccc(CCN2CCC[C@H]2Cn2cc(C3CC3)nn2)cc1	ZINC000450950166	EH	On-Demand	Anodyne	SPHK2	40	43
Clc1ccc(CCN2CCC[C@H]2Cn2cc(C3CC3)nn2)cc1	ZINC000450950166	EH	On-Demand	Anodyne	SPHK1	37	43
C[C@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)[C@H](c1ccccc1)N(C)C	ZINC000450950171	GK	On-Demand	Anodyne	UTS2	42	34
C[C@@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)[C@@H](c1ccccc1)N(C)C	ZINC000450950172	GK	On-Demand	Anodyne	UTS2	42	34
C[C@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)[C@@H](c1ccccc1)N(C)C	ZINC000450950173	GK	On-Demand	Anodyne	UTS2	42	34
C[C@@H](NC(=O)c1c(Cl)cc(Cl)cc1Cl)[C@H](c1ccccc1)N(C)C	ZINC000450950174	GK	On-Demand	Anodyne	UTS2	42	34
CN(c1ncccc1C#N)C1CCN(CCC(F)(F)F)CC1	ZINC000450950175	DF	On-Demand	Mild	MEN1	40	35
Cn1ccnc1C(=O)c1ccc(NC(C)(C)CN2CCCC2)c([N+](=O)[O-])c1	ZINC000450950182	FF	On-Demand	Bother	HNMT	40	31
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000450950187	GD	On-Demand	Mild	TGM2	69	41
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000450950187	GD	On-Demand	Mild	F13A1	91	46
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000450950187	GD	On-Demand	Mild	RAC1	0	42
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000450950187	GD	On-Demand	Mild	NAMPT	66	48
N#Cc1cnn(CC(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000450950187	GD	On-Demand	Mild	DDIT3	0	42
CN(c1nccc(Oc2ccccc2)n1)C1CCN(CCC(F)(F)F)CC1	ZINC000450950194	GI	On-Demand	Anodyne	HTR4	0	41
CCc1cc(N(C)C2CCN(CCC(F)(F)F)CC2)n2ncnc2n1	ZINC000450950196	FF	On-Demand	Anodyne	DHOD	0	43
C[C@@H](CCC1CC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450950211	DH	On-Demand	Anodyne	TIMP3	65	37
C[C@H](CCC1CC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450950212	DH	On-Demand	Anodyne	TIMP3	81	37
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C)Cc1cc(F)cc(OC)c1	ZINC000450950213	GE	On-Demand	Anodyne	CA2	39	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C)Cc1cc(F)cc(OC)c1	ZINC000450950213	GE	On-Demand	Anodyne	CA1	37	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C)Cc1cc(F)cc(OC)c1	ZINC000450950213	GE	On-Demand	Anodyne	CA12	22	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@H](C)Cc1cc(F)cc(OC)c1	ZINC000450950213	GE	On-Demand	Anodyne	CA9	29	44
Cn1c(N2CC[C@@H](CCCO)C2)nc2ccccc21	ZINC000450950267	CE	On-Demand	Anodyne	HRH1	31	43
Cn1c(N2CC[C@H](CCCO)C2)nc2ccccc21	ZINC000450950268	CE	On-Demand	Anodyne	HRH1	31	43
C[C@@H]1CN(CCO)CCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450950296	FG	On-Demand	Anodyne	ADRB3	28	49
C[C@H]1CN(CCO)CCN1c1ncnc2scc(-c3ccc(F)cc3)c12	ZINC000450950297	FG	On-Demand	Anodyne	ADRB3	28	49
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	PTGS2	0	40
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	PPARA	21	42
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	MME	62	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	CTSB	32	41
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	CAPNS1	51	33
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	SOAT1	0	44
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	CAPN1	66	45
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	CAPN2	58	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	ACE2	47	34
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	PLM2_PLAFA	15	42
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	PSMB8	58	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950302	GE	On-Demand	Anodyne	PQSD	0	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	PTGS2	0	40
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	PPARA	21	42
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	MME	62	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	CTSB	32	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	CAPNS1	51	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	SOAT1	0	44
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	CAPN1	66	45
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	CAPN2	58	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	ACE2	47	34
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	POL	0	41
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	PLM2_PLAFA	15	42
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	PSMB8	58	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950303	GE	On-Demand	Anodyne	PQSD	0	41
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	PTGS2	0	40
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	PPARA	21	42
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	MME	62	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	CTSB	32	41
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	CAPNS1	51	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	SOAT1	0	44
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	CAPN1	66	45
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	CAPN2	58	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	ACE2	47	34
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	POL	0	41
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	PLM2_PLAFA	15	42
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	PSMB8	58	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950304	GE	On-Demand	Anodyne	PQSD	0	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	PTGS2	0	40
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	PPARA	21	42
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	MME	62	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	CTSB	32	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	CAPNS1	51	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	HLA-DRB1	45	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	SOAT1	0	44
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	CAPN1	66	45
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	CAPN2	58	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	ACE2	47	34
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	POL	0	41
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	PLM2_PLAFA	15	42
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	PSMB8	58	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)cc1OC	ZINC000450950305	GE	On-Demand	Anodyne	PQSD	0	41
COC[C@@H]1CCCN(c2nc(OC)cc(OC)n2)CC1	ZINC000450950320	CD	On-Demand	Anodyne	CCR4	33	42
COC[C@@H]1CCCN(c2nc(OC)cc(OC)n2)CC1	ZINC000450950320	CD	On-Demand	Anodyne	EHMT2	57	32
COC[C@H]1CCCN(c2nc(OC)cc(OC)n2)CC1	ZINC000450950321	CD	On-Demand	Anodyne	CCR4	33	42
COC[C@H]1CCCN(c2nc(OC)cc(OC)n2)CC1	ZINC000450950321	CD	On-Demand	Anodyne	EHMT2	57	32
CC(C)(C)C[C@H]1CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450950324	CG	On-Demand	Bother	CHRNA3	20	60
CC(C)(C)C[C@H]1CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450950324	CG	On-Demand	Bother	CHRNA4	17	60
CC(C)(C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450950325	CG	On-Demand	Bother	CHRNA3	20	60
CC(C)(C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])nc2)C1	ZINC000450950325	CG	On-Demand	Bother	CHRNA4	17	60
COC[C@H]1CCCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)CC1	ZINC000450950329	EH	On-Demand	Bother	GYRB	0	51
COC[C@H]1CCCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)CC1	ZINC000450950329	EH	On-Demand	Bother	Q8MHZ5_SHEEP	40	31
COC[C@@H]1CCCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)CC1	ZINC000450950330	EH	On-Demand	Bother	GYRB	0	51
COC[C@@H]1CCCN(c2cc(C)nc3ccc([N+](=O)[O-])cc23)CC1	ZINC000450950330	EH	On-Demand	Bother	Q8MHZ5_SHEEP	40	31
Cc1cccc([C@@H](C)Nc2ccnc3c2cnn3C)c1	ZINC000450950339	CG	On-Demand	Anodyne	PLK1	0	40
Cc1cccc([C@H](C)Nc2ccnc3c2cnn3C)c1	ZINC000450950340	CG	On-Demand	Anodyne	PLK1	0	40
Cc1cccc([C@@H](C)Nc2ccc(S(C)(=O)=O)cn2)c1	ZINC000450950367	CF	On-Demand	Anodyne	PLK1	0	47
Cc1cccc([C@H](C)Nc2ccc(S(C)(=O)=O)cn2)c1	ZINC000450950368	CF	On-Demand	Anodyne	PLK1	0	47
COC[C@H]1CCCN(c2nc(-c3ccccn3)nc(C)c2C)CC1	ZINC000450950370	EG	On-Demand	Anodyne	METAP1	32	43
COC[C@@H]1CCCN(c2nc(-c3ccccn3)nc(C)c2C)CC1	ZINC000450950371	EG	On-Demand	Anodyne	METAP1	32	43
CC(C)(C)C[C@H]1CCN(c2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)C1	ZINC000450950377	FH	On-Demand	Anodyne	HSD11B1	0	42
CC(C)(C)C[C@@H]1CCN(c2ccc(S(N)(=O)=O)c(C(F)(F)F)c2)C1	ZINC000450950378	FH	On-Demand	Anodyne	HSD11B1	0	42
COC[C@@H]1CCCN(c2ccc(-c3ccc(Br)s3)nn2)CC1	ZINC000450950381	GI	On-Demand	Anodyne	SCD1	30	40
COC[C@@H]1CCCN(c2ccc(-c3ccc(Br)s3)nn2)CC1	ZINC000450950381	GI	On-Demand	Anodyne	SCD	0	40
COC[C@H]1CCCN(c2ccc(-c3ccc(Br)s3)nn2)CC1	ZINC000450950382	GI	On-Demand	Anodyne	SCD1	30	40
COC[C@H]1CCCN(c2ccc(-c3ccc(Br)s3)nn2)CC1	ZINC000450950382	GI	On-Demand	Anodyne	SCD	0	40
CC(C)(C)C[C@@H]1CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450950389	DF	On-Demand	Anodyne	SORD	42	35
CC(C)(C)C[C@H]1CCN(c2ccnc(N3CCOCC3)n2)C1	ZINC000450950390	DF	On-Demand	Anodyne	SORD	42	35
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c(OC)cc(OC)cc23)cc1	ZINC000450950396	GG	On-Demand	Anodyne	EGFR	52	48
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c(OC)cc(OC)cc23)cc1	ZINC000450950396	GG	On-Demand	Anodyne	ERBB2	30	44
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c(OC)cc(OC)cc23)cc1	ZINC000450950396	GG	On-Demand	Anodyne	PDE6A	44	33
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c(OC)cc(OC)cc23)cc1	ZINC000450950396	GG	On-Demand	Anodyne	FLT4	23	45
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c(OC)cc(OC)cc23)cc1	ZINC000450950396	GG	On-Demand	Anodyne	CD38	15	42
COC[C@@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950399	DH	On-Demand	Anodyne	PDE3A	50	38
COC[C@@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950399	DH	On-Demand	Anodyne	PDGFRB	64	43
COC[C@@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950399	DH	On-Demand	Anodyne	PDE3B	75	38
COC[C@@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950399	DH	On-Demand	Anodyne	SIRT3	65	35
COC[C@@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950399	DH	On-Demand	Anodyne	SIRT2	55	35
COC[C@@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950399	DH	On-Demand	Anodyne	SIRT1	54	33
COC[C@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950400	DH	On-Demand	Anodyne	PDE3A	50	38
COC[C@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950400	DH	On-Demand	Anodyne	PDGFRB	62	43
COC[C@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950400	DH	On-Demand	Anodyne	PDE3B	75	38
COC[C@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950400	DH	On-Demand	Anodyne	SIRT3	54	33
COC[C@H]1CCCN(c2ncnc3ccc(SC)cc23)CC1	ZINC000450950400	DH	On-Demand	Anodyne	SIRT1	54	33
CC[C@H](Nc1ncnc2[nH]c3ccccc3c12)C(=O)NC	ZINC000450950401	CE	On-Demand	Anodyne	UTS2R	26	41
CC[C@@H](Nc1ncnc2[nH]c3ccccc3c12)C(=O)NC	ZINC000450950402	CE	On-Demand	Anodyne	UTS2R	26	41
CCS(=O)(=O)Cc1ccc(Nc2ncnc3sc(C)c(C)c23)cc1	ZINC000450950403	FH	On-Demand	Anodyne	MKNK2	17	42
CC(C)(C)C[C@@H]1CCN(c2ncc(F)cn2)C1	ZINC000450950407	BF	On-Demand	Anodyne	ADAMTS4	51	29
CC(C)(C)C[C@H]1CCN(c2ncc(F)cn2)C1	ZINC000450950408	BF	On-Demand	Anodyne	ADAMTS4	51	29
CN(C)[C@@H](CNC(=O)CS(=O)(=O)C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450950410	GE	On-Demand	Anodyne	CACNA1B	46	32
CN(C)[C@@H](CNC(=O)CS(=O)(=O)C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450950410	GE	On-Demand	Anodyne	CCR2	67	42
CN(C)[C@@H](CNC(=O)CS(=O)(=O)C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450950410	GE	On-Demand	Anodyne	PHES	0	40
CN(C)[C@H](CNC(=O)CS(=O)(=O)C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450950411	GE	On-Demand	Anodyne	CACNA1B	46	32
CN(C)[C@H](CNC(=O)CS(=O)(=O)C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450950411	GE	On-Demand	Anodyne	CCR2	67	42
CN(C)[C@H](CNC(=O)CS(=O)(=O)C1CC1)c1cccc(C(F)(F)F)c1	ZINC000450950411	GE	On-Demand	Anodyne	PHES	0	40
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C)Cc1cc(F)cc(OC)c1	ZINC000450950414	GE	On-Demand	Anodyne	CA2	39	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C)Cc1cc(F)cc(OC)c1	ZINC000450950414	GE	On-Demand	Anodyne	CA1	37	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C)Cc1cc(F)cc(OC)c1	ZINC000450950414	GE	On-Demand	Anodyne	CA12	22	46
COC(=O)c1cc(S(N)(=O)=O)ccc1N[C@@H](C)Cc1cc(F)cc(OC)c1	ZINC000450950414	GE	On-Demand	Anodyne	CA9	29	44
CN(c1ncnc2sc3ccccc3c12)C1CCN(CCC(F)(F)F)CC1	ZINC000450950416	GJ	On-Demand	Anodyne	NPY1R	25	41
CCS(=O)(=O)c1ccc(CN2C[C@@H](OC)C[C@H]2C(=O)N2CCCC2)cc1	ZINC000450950427	GD	On-Demand	Anodyne	PREP	43	35
CCCOc1cccc(Cn2ccc(C(F)(F)F)cc2=O)c1	ZINC000450950457	DH	On-Demand	Anodyne	GALR3	69	38
CCCOc1cccc(Cn2ccc(C(F)(F)F)cc2=O)c1	ZINC000450950457	DH	On-Demand	Anodyne	PDS	45	39
Cc1cc(N(C)[C@@H]2CCN(C(C)C)C2)n2ncnc2n1	ZINC000450950497	CD	On-Demand	Anodyne	DHOD	0	46
Cc1cc(N(C)[C@H]2CCN(C(C)C)C2)n2ncnc2n1	ZINC000450950498	CD	On-Demand	Anodyne	DHOD	0	46
Cc1cc(N2CCOC[C@@H]2CC(N)=O)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450950508	FD	On-Demand	Bother	MTOR	51	36
Cc1cc(N2CCOC[C@H]2CC(N)=O)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450950509	FD	On-Demand	Bother	MTOR	51	36
Cc1nc(N(C)[C@@H]2CCN(C(C)C)C2)c(Cl)cc1C#N	ZINC000450950514	CF	On-Demand	Mild	PGR	0	50
Cc1nc(N(C)[C@H]2CCN(C(C)C)C2)c(Cl)cc1C#N	ZINC000450950515	CF	On-Demand	Mild	PGR	0	50
NC(=O)c1cnc(N2CC[C@@H](CCCO)C2)c(Cl)c1	ZINC000450950516	CD	On-Demand	Anodyne	CXCR3	33	49
NC(=O)c1cnc(N2CC[C@@H](CCCO)C2)c(Cl)c1	ZINC000450950516	CD	On-Demand	Anodyne	SIRT3	45	34
NC(=O)c1cnc(N2CC[C@@H](CCCO)C2)c(Cl)c1	ZINC000450950516	CD	On-Demand	Anodyne	SIRT2	44	32
NC(=O)c1cnc(N2CC[C@@H](CCCO)C2)c(Cl)c1	ZINC000450950516	CD	On-Demand	Anodyne	SIRT1	40	31
NC(=O)c1cnc(N2CC[C@H](CCCO)C2)c(Cl)c1	ZINC000450950517	CD	On-Demand	Anodyne	CXCR3	33	49
NC(=O)c1cnc(N2CC[C@H](CCCO)C2)c(Cl)c1	ZINC000450950517	CD	On-Demand	Anodyne	SIRT3	45	34
NC(=O)c1cnc(N2CC[C@H](CCCO)C2)c(Cl)c1	ZINC000450950517	CD	On-Demand	Anodyne	SIRT2	44	32
NC(=O)c1cnc(N2CC[C@H](CCCO)C2)c(Cl)c1	ZINC000450950517	CD	On-Demand	Anodyne	SIRT1	40	31
CC[C@@H](O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950532	FG	On-Demand	Anodyne	TACR3	42	37
CC[C@@H](O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950532	FG	On-Demand	Anodyne	ACE2	43	36
CC[C@@H](O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950532	FG	On-Demand	Anodyne	UTS2	65	38
CC[C@H](O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950533	FG	On-Demand	Anodyne	TACR3	42	37
CC[C@H](O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950533	FG	On-Demand	Anodyne	ACE2	43	36
CC[C@H](O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950533	FG	On-Demand	Anodyne	UTS2	65	38
CC[C@H](O)CC(=O)N[C@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950534	FG	On-Demand	Anodyne	TACR3	42	37
CC[C@H](O)CC(=O)N[C@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950534	FG	On-Demand	Anodyne	ACE2	43	36
CC[C@H](O)CC(=O)N[C@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950534	FG	On-Demand	Anodyne	UTS2	65	38
CC[C@@H](O)CC(=O)N[C@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950535	FG	On-Demand	Anodyne	TACR3	42	37
CC[C@@H](O)CC(=O)N[C@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950535	FG	On-Demand	Anodyne	ACE2	43	36
CC[C@@H](O)CC(=O)N[C@H](CC(=O)OC)c1ccc(-c2ccccc2)cc1	ZINC000450950535	FG	On-Demand	Anodyne	UTS2	65	38
Cc1nc(N(C)[C@@H]2CCN(C(C)C)C2)c2cc[nH]c2n1	ZINC000450950554	CE	On-Demand	Anodyne	JAK3	19	45
Cc1nc(N(C)[C@H]2CCN(C(C)C)C2)c2cc[nH]c2n1	ZINC000450950555	CE	On-Demand	Anodyne	JAK3	19	45
Cc1sc2ncnc(N3CC[C@@H](CCCO)C3)c2c1C	ZINC000450950556	CF	On-Demand	Anodyne	SIRT3	44	34
Cc1sc2ncnc(N3CC[C@H](CCCO)C3)c2c1C	ZINC000450950557	CF	On-Demand	Anodyne	SIRT3	44	34
CCOC(=O)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450950571	CD	On-Demand	Anodyne	ENPP2	19	40
CCOC(=O)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450950572	CD	On-Demand	Anodyne	ENPP2	19	40
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@H](CCCO)C3)nc2)CC1	ZINC000450950587	FC	On-Demand	Anodyne	GCK	31	42
CN1CCN(S(=O)(=O)c2ccc(N3CC[C@@H](CCCO)C3)nc2)CC1	ZINC000450950588	FC	On-Demand	Anodyne	GCK	31	42
CC1(CC(F)(F)F)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450950596	DF	On-Demand	Anodyne	P2RY12	26	40
CC1(CC(F)(F)F)CN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450950596	DF	On-Demand	Anodyne	CXCR3	24	41
Cc1ccc2ncnc(N3CCN(CCO)C[C@H]3C)c2c1	ZINC000450950597	CD	On-Demand	Anodyne	HTT	0	41
Cc1ccc2ncnc(N3CCN(CCO)C[C@@H]3C)c2c1	ZINC000450950598	CD	On-Demand	Anodyne	HTT	0	41
C[C@H]1CN(CCO)CCN1c1ncnc2cc(F)c(F)cc12	ZINC000450950601	DD	On-Demand	Anodyne	HTT	0	40
C[C@@H]1CN(CCO)CCN1c1ncnc2cc(F)c(F)cc12	ZINC000450950602	DD	On-Demand	Anodyne	HTT	0	40
OCCC[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950609	CF	On-Demand	Anodyne	PDE3A	49	40
OCCC[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950609	CF	On-Demand	Anodyne	HRP1_PLAFA	44	31
OCCC[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950609	CF	On-Demand	Anodyne	HNMT	49	34
OCCC[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950609	CF	On-Demand	Anodyne	PDE3B	72	40
OCCC[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950609	CF	On-Demand	Anodyne	SIRT3	51	32
OCCC[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950609	CF	On-Demand	Anodyne	SIRT2	52	32
OCCC[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950609	CF	On-Demand	Anodyne	HTT	0	42
OCCC[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950610	CF	On-Demand	Anodyne	PDE3A	49	40
OCCC[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950610	CF	On-Demand	Anodyne	HRP1_PLAFA	44	31
OCCC[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950610	CF	On-Demand	Anodyne	HNMT	49	34
OCCC[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950610	CF	On-Demand	Anodyne	PDE3B	72	40
OCCC[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950610	CF	On-Demand	Anodyne	SIRT3	51	32
OCCC[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950610	CF	On-Demand	Anodyne	SIRT2	52	32
OCCC[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000450950610	CF	On-Demand	Anodyne	HTT	0	42
COC[C@@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950623	CF	On-Demand	Anodyne	PDE3A	46	35
COC[C@@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950623	CF	On-Demand	Anodyne	PDE3B	69	37
COC[C@@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950623	CF	On-Demand	Anodyne	SIRT3	69	38
COC[C@@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950623	CF	On-Demand	Anodyne	SIRT2	68	38
COC[C@@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950623	CF	On-Demand	Anodyne	SIRT1	61	38
COC[C@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950624	CF	On-Demand	Anodyne	PDE3A	46	35
COC[C@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950624	CF	On-Demand	Anodyne	PDE3B	69	37
COC[C@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950624	CF	On-Demand	Anodyne	SIRT3	69	38
COC[C@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950624	CF	On-Demand	Anodyne	SIRT2	68	38
COC[C@H]1CCCN(c2ncnc3ccsc23)CC1	ZINC000450950624	CF	On-Demand	Anodyne	SIRT1	61	38
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950625	FD	On-Demand	Anodyne	CA2	16	44
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950625	FD	On-Demand	Anodyne	CASP3	76	42
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950625	FD	On-Demand	Anodyne	CA7	33	43
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950625	FD	On-Demand	Anodyne	CA5B	16	43
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950625	FD	On-Demand	Anodyne	SLC6A9	22	44
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950625	FD	On-Demand	Anodyne	CASP7	84	42
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950626	FD	On-Demand	Anodyne	CA2	16	44
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950626	FD	On-Demand	Anodyne	CASP3	76	42
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950626	FD	On-Demand	Anodyne	CA7	33	43
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950626	FD	On-Demand	Anodyne	CA5B	16	43
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950626	FD	On-Demand	Anodyne	SLC6A9	22	44
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cc2C(=O)OC)CC1	ZINC000450950626	FD	On-Demand	Anodyne	CASP7	84	42
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450950649	FG	On-Demand	Anodyne	HDAC1	23	41
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450950649	FG	On-Demand	Anodyne	ENPP2	15	40
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450950649	FG	On-Demand	Anodyne	RORC	16	42
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450950651	FG	On-Demand	Anodyne	HDAC1	23	41
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450950651	FG	On-Demand	Anodyne	ENPP2	15	40
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450950651	FG	On-Demand	Anodyne	RORC	16	42
COC[C@H]1CCCN(c2cc(C)nc3ccccc23)CC1	ZINC000450950659	CH	On-Demand	Anodyne	HTR1D	67	41
COC[C@H]1CCCN(c2cc(C)nc3ccccc23)CC1	ZINC000450950659	CH	On-Demand	Anodyne	HTR1B	62	41
COC[C@@H]1CCCN(c2cc(C)nc3ccccc23)CC1	ZINC000450950660	CH	On-Demand	Anodyne	HTR1D	67	41
COC[C@@H]1CCCN(c2cc(C)nc3ccccc23)CC1	ZINC000450950660	CH	On-Demand	Anodyne	HTR1B	62	41
CC(C)(C)C[C@H]1CCN(c2cc(N3CCC[C@H]3CO)ncn2)C1	ZINC000450950661	DF	On-Demand	Anodyne	PRCP	39	41
CC(C)(C)C[C@@H]1CCN(c2cc(N3CCC[C@H]3CO)ncn2)C1	ZINC000450950662	DF	On-Demand	Anodyne	PRCP	39	41
CC(C)(C)C[C@H]1CCN(c2cc(N3CCC[C@@H]3CO)ncn2)C1	ZINC000450950663	DF	On-Demand	Anodyne	PRCP	39	41
CC(C)(C)C[C@@H]1CCN(c2cc(N3CCC[C@@H]3CO)ncn2)C1	ZINC000450950664	DF	On-Demand	Anodyne	PRCP	39	41
COC[C@@H]1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000450950665	CH	On-Demand	Bother	CASP3	43	36
COC[C@@H]1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000450950665	CH	On-Demand	Bother	CASP7	54	36
COC[C@H]1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000450950666	CH	On-Demand	Bother	CASP3	43	36
COC[C@H]1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000450950666	CH	On-Demand	Bother	CASP7	54	36
COC[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450950686	EH	On-Demand	Bother	CASP3	27	41
COC[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450950686	EH	On-Demand	Bother	SERPINE1	24	43
COC[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450950686	EH	On-Demand	Bother	CASP7	39	41
COC[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450950686	EH	On-Demand	Bother	LIPG	56	41
COC[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450950687	EH	On-Demand	Bother	CASP3	27	41
COC[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450950687	EH	On-Demand	Bother	SERPINE1	24	43
COC[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450950687	EH	On-Demand	Bother	CASP7	39	41
COC[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000450950687	EH	On-Demand	Bother	LIPG	56	41
COC[C@@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000450950732	DH	On-Demand	Mild	AR	58	47
COC[C@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000450950733	DH	On-Demand	Mild	AR	70	47
Cc1noc([C@@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950736	GH	On-Demand	Anodyne	LTA4H	73	48
Cc1noc([C@@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950736	GH	On-Demand	Anodyne	COLA	55	39
Cc1noc([C@@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950736	GH	On-Demand	Anodyne	CPT1A	50	39
Cc1noc([C@@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950736	GH	On-Demand	Anodyne	PSMB2	46	34
Cc1noc([C@@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950736	GH	On-Demand	Anodyne	PSMB1	40	35
Cc1noc([C@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950737	GH	On-Demand	Anodyne	LTA4H	73	48
Cc1noc([C@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950737	GH	On-Demand	Anodyne	COLA	55	39
Cc1noc([C@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950737	GH	On-Demand	Anodyne	CPT1A	50	39
Cc1noc([C@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950737	GH	On-Demand	Anodyne	PSMB2	46	34
Cc1noc([C@H]2CN(CCOc3ccc(Oc4ccccc4)cc3)CCN2C)n1	ZINC000450950737	GH	On-Demand	Anodyne	PSMB1	40	35
COC[C@@H]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000450950738	DD	On-Demand	Bother	TAAR1	22	48
COC[C@H]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000450950740	DD	On-Demand	Bother	TAAR1	22	48
N#Cc1cnn(CC(=O)NCC2(c3ccccc3)CC2)c1	ZINC000450950744	CD	On-Demand	Mild	ACAT	0	42
N#Cc1cnn(CC(=O)NCC2(c3ccccc3)CC2)c1	ZINC000450950744	CD	On-Demand	Mild	NPFFR1	40	45
N#Cc1cnn(CC(=O)NCC2(c3ccccc3)CCCC2)c1	ZINC000450950748	DE	On-Demand	Mild	ACAT	0	48
N#Cc1cnn(CC(=O)NCC2(c3ccccc3)CCCC2)c1	ZINC000450950748	DE	On-Demand	Mild	NPFFR1	36	44
CC(C)(CN1CCCC1)Nc1ncnc2[nH]ccc12	ZINC000450950770	CE	On-Demand	Anodyne	JAK2	22	41
CC(C)(CN1CCCC1)Nc1ncnc2[nH]ccc12	ZINC000450950770	CE	On-Demand	Anodyne	HNMT	54	33
CO[C@H]1C[C@@H](C(N)=O)N(CC/C=C\c2ccccc2)C1	ZINC000450950771	CD	On-Demand	Anodyne	CACNA1B	41	32
CO[C@H]1C[C@@H](C(N)=O)N(CC/C=C/c2ccccc2)C1	ZINC000450950772	CD	On-Demand	Anodyne	CACNA1B	41	32
COc1cccc(OCCC(=O)N2CC[C@H](c3c(F)cccc3F)C2)c1	ZINC000450950790	FH	On-Demand	Anodyne	DRD4	40	32
COc1cccc(OCCC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c1	ZINC000450950791	FH	On-Demand	Anodyne	DRD4	40	32
CCCC(=O)Nc1ccc(C(=O)Cn2cc(C#N)cn2)cc1	ZINC000450950795	CE	On-Demand	Mild	PFKFB3	46	37
CC(C)(C)OC1CC(Sc2cccc([N+](=O)[O-])c2)C1	ZINC000450950797	CI	On-Demand	Bother	CACNA1C	42	33
CC(C)(C)OC1CC(Sc2cccc([N+](=O)[O-])c2)C1	ZINC000450950797	CI	On-Demand	Bother	CACNA1D	62	33
OCCC[C@H]1CCN(c2ncnc3ccsc23)C1	ZINC000450950822	CE	On-Demand	Anodyne	PDE3A	44	33
OCCC[C@H]1CCN(c2ncnc3ccsc23)C1	ZINC000450950822	CE	On-Demand	Anodyne	SIRT3	62	41
OCCC[C@H]1CCN(c2ncnc3ccsc23)C1	ZINC000450950822	CE	On-Demand	Anodyne	SIRT2	63	41
OCCC[C@H]1CCN(c2ncnc3ccsc23)C1	ZINC000450950822	CE	On-Demand	Anodyne	SIRT1	62	41
OCCC[C@@H]1CCN(c2ncnc3ccsc23)C1	ZINC000450950823	CE	On-Demand	Anodyne	PDE3A	44	33
OCCC[C@@H]1CCN(c2ncnc3ccsc23)C1	ZINC000450950823	CE	On-Demand	Anodyne	SIRT3	62	41
OCCC[C@@H]1CCN(c2ncnc3ccsc23)C1	ZINC000450950823	CE	On-Demand	Anodyne	SIRT2	63	41
OCCC[C@@H]1CCN(c2ncnc3ccsc23)C1	ZINC000450950823	CE	On-Demand	Anodyne	SIRT1	62	41
CNS(=O)(=O)c1ccc(N2CCN(CCO)C[C@H]2C)nc1	ZINC000450950828	DB	On-Demand	Anodyne	GCKR	23	46
CNS(=O)(=O)c1ccc(N2CCN(CCO)C[C@@H]2C)nc1	ZINC000450950829	DB	On-Demand	Anodyne	GCKR	23	46
CC(C)c1nccc(N2CC[C@@H](CCCO)C2)n1	ZINC000450950833	BE	On-Demand	Anodyne	SORD	119	47
CC(C)c1nccc(N2CC[C@H](CCCO)C2)n1	ZINC000450950834	BE	On-Demand	Anodyne	SORD	119	47
C[C@@H]1CN(CCO)CCN1c1ccc(C#N)cn1	ZINC000450950845	BC	On-Demand	Mild	SGPL1	0	51
C[C@@H]1CN(CCO)CCN1c1ccc(C#N)cn1	ZINC000450950845	BC	On-Demand	Mild	SMO	0	51
C[C@H]1CN(CCO)CCN1c1ccc(C#N)cn1	ZINC000450950846	BC	On-Demand	Mild	SGPL1	0	51
C[C@H]1CN(CCO)CCN1c1ccc(C#N)cn1	ZINC000450950846	BC	On-Demand	Mild	SMO	0	51
Cc1cc(Br)c(F)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450950870	FH	On-Demand	Anodyne	HDAC1	25	41
N#Cc1cnc(N2CC[C@H](CCCO)C2)c(Cl)c1	ZINC000450950871	CE	On-Demand	Mild	CXCR3	19	40
N#Cc1cnc(N2CC[C@@H](CCCO)C2)c(Cl)c1	ZINC000450950872	CE	On-Demand	Mild	CXCR3	19	40
CCc1cc(CC)nc(N2CCN(CCO)C[C@H]2C)n1	ZINC000450950880	CD	On-Demand	Anodyne	SORD	18	40
CCc1cc(CC)nc(N2CCN(CCO)C[C@@H]2C)n1	ZINC000450950888	CD	On-Demand	Anodyne	SORD	18	40
COC[C@@H]1CCCN(c2cc(C#N)cc(C)n2)CC1	ZINC000450950903	CF	On-Demand	Mild	GPBAR1	0	42
COC[C@@H]1CCCN(c2cc(C#N)cc(C)n2)CC1	ZINC000450950903	CF	On-Demand	Mild	ERG	0	42
COC[C@H]1CCCN(c2cc(C#N)cc(C)n2)CC1	ZINC000450950906	CF	On-Demand	Mild	GPBAR1	0	42
COC[C@H]1CCCN(c2cc(C#N)cc(C)n2)CC1	ZINC000450950906	CF	On-Demand	Mild	ERG	0	42
CN1C[C@@H]2[C@@H](CCCN2CCc2ccc(Cl)cc2)C1=O	ZINC000450950935	CE	On-Demand	Anodyne	SLC6A1	48	37
CN1C[C@@H]2[C@@H](CCCN2CCc2ccc(Cl)cc2)C1=O	ZINC000450950935	CE	On-Demand	Anodyne	HRH3	27	49
CN1C[C@@H]2[C@@H](CCCN2CCc2ccc(Cl)cc2)C1=O	ZINC000450950935	CE	On-Demand	Anodyne	CACNA1D	45	44
COc1cc(CC(=O)NC(C)(C)c2nc3ccccc3n2C)ccc1O	ZINC000450950943	FF	On-Demand	Anodyne	TRPV1	29	47
COC[C@H]1CCCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450950954	CG	On-Demand	Anodyne	SORD	57	36
COC[C@@H]1CCCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000450950955	CG	On-Demand	Anodyne	SORD	57	36
CC(C)(CN1CCCC1)Nc1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450950966	EE	On-Demand	Anodyne	PRNP	40	34
CC(C)(CN1CCCC1)Nc1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450950966	EE	On-Demand	Anodyne	SCD1	17	42
CC(C)(CN1CCCC1)Nc1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450950966	EE	On-Demand	Anodyne	NOD2	41	34
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	MMP13	43	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	MMP2	22	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	MMP3	42	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	MMP8	29	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	MMP9	33	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	TGM2	50	36
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	MMP7	41	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	MMP1	40	40
COc1ccc(S(=O)(=O)N2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450951002	GC	On-Demand	Mild	F13A1	51	37
COC[C@@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])CC1	ZINC000450951006	EH	On-Demand	Bother	CASP3	42	36
COC[C@@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])CC1	ZINC000450951006	EH	On-Demand	Bother	CASP7	53	36
COC[C@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])CC1	ZINC000450951007	EH	On-Demand	Bother	CASP3	42	36
COC[C@H]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])CC1	ZINC000450951007	EH	On-Demand	Bother	CASP7	53	36
NC(=O)C[C@@H]1COCCN1c1nc(-c2ccncc2)nc2c1CCC2	ZINC000450951008	ED	On-Demand	Anodyne	MTOR	58	44
COC[C@@H]1CCCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)CC1	ZINC000450951009	FH	On-Demand	Anodyne	PDE3B	51	36
NC(=O)C[C@H]1COCCN1c1nc(-c2ccncc2)nc2c1CCC2	ZINC000450951010	ED	On-Demand	Anodyne	MTOR	58	44
COC[C@H]1CCCN(c2nc(C(F)(F)F)nc3ccc(OC)cc23)CC1	ZINC000450951011	FH	On-Demand	Anodyne	PDE3B	51	36
COC[C@H]1CCCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450951042	DI	On-Demand	Anodyne	LUCI_LUCLA	19	46
COC[C@H]1CCCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450951042	DI	On-Demand	Anodyne	MLYCD	40	32
COC[C@@H]1CCCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450951044	DI	On-Demand	Anodyne	LUCI_LUCLA	19	46
COC[C@@H]1CCCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000450951044	DI	On-Demand	Anodyne	MLYCD	40	32
COC[C@@H]1CCCN(c2nc(-c3ccccc3)ns2)CC1	ZINC000450951049	DG	On-Demand	Anodyne	FAAH	18	48
COC[C@H]1CCCN(c2nc(-c3ccccc3)ns2)CC1	ZINC000450951050	DG	On-Demand	Anodyne	FAAH	18	48
CC(C)(C)C[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000450951053	DF	On-Demand	Bother	MDAA	0	40
CC(C)(C)C[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000450951055	DF	On-Demand	Bother	MDAA	0	40
COC[C@@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951070	CF	On-Demand	Bother	DRD2	38	41
COC[C@@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951070	CF	On-Demand	Bother	ADRA1D	49	43
COC[C@@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951070	CF	On-Demand	Bother	HTR2A	24	41
COC[C@@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951070	CF	On-Demand	Bother	ADRA1A	40	43
COC[C@@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951070	CF	On-Demand	Bother	ADRA1B	40	43
COC[C@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951071	CF	On-Demand	Bother	DRD2	38	41
COC[C@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951071	CF	On-Demand	Bother	ADRA1D	49	43
COC[C@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951071	CF	On-Demand	Bother	HTR2A	24	41
COC[C@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951071	CF	On-Demand	Bother	ADRA1A	40	43
COC[C@H]1CCCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000450951071	CF	On-Demand	Bother	ADRA1B	40	43
CN(CCN(C)C(=O)CNC(=O)Nc1cccc(Cl)c1)CC(F)F	ZINC000450951075	FE	On-Demand	Anodyne	PSBA	0	44
COC[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1	ZINC000450951080	EH	On-Demand	Bother	SERPINE1	22	41
COC[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1	ZINC000450951081	EH	On-Demand	Bother	SERPINE1	22	41
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	F10	21	41
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	COLA	55	36
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	CPT1A	57	34
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	CPT2	46	34
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	PRNP	45	40
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	GRM5	22	40
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	MCHR1	26	40
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	TAAR1	46	44
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	DGAT2	0	41
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	DGAT1	45	51
COC[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951088	FI	On-Demand	Anodyne	KCNK3	42	36
O=C(C1=C(c2ccccc2)CCC1)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450951091	EI	On-Demand	Anodyne	AVPR1A	17	46
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	F10	21	41
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	COLA	55	36
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	CPT1A	57	34
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	CPT2	46	34
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	PRNP	45	40
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	GRM5	22	40
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	MCHR1	26	40
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	TAAR1	46	44
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	DGAT2	0	41
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	DGAT1	45	51
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)CC1	ZINC000450951092	FI	On-Demand	Anodyne	KCNK3	42	36
O=C(C1=C(c2ccccc2)CCC1)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450951094	EI	On-Demand	Anodyne	AVPR1A	17	46
CN(c1cccc(C#N)n1)C1CCN(CCC(F)(F)F)CC1	ZINC000450951106	DF	On-Demand	Mild	HTR4	0	44
CO[C@@H](Cc1ccccc1)CN1C[C@@H](OC)C[C@H]1C(=O)N1CCCC1	ZINC000450951107	ED	On-Demand	Anodyne	PREP	87	41
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C[C@@H](Cc2ccccc2)OC)C1	ZINC000450951108	ED	On-Demand	Anodyne	PREP	87	41
CC(C)(CN1CCCC1)Nc1ncnc2cc(F)c(F)cc12	ZINC000450951152	DG	On-Demand	Anodyne	HNMT	51	32
OCCC[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450951156	CG	On-Demand	Anodyne	HRP1_PLAFA	89	42
OCCC[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450951156	CG	On-Demand	Anodyne	HNMT	54	38
OCCC[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450951157	CG	On-Demand	Anodyne	HRP1_PLAFA	89	42
OCCC[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000450951157	CG	On-Demand	Anodyne	HNMT	54	38
CCc1cc(NC(C)(C)CN2CCCC2)n2ncnc2n1	ZINC000450951164	CD	On-Demand	Anodyne	DHOD	0	50
Cc1nc(-c2cccnc2)nc(N2CC[C@H](CCCO)C2)c1C	ZINC000450951169	DF	On-Demand	Anodyne	ROS1	45	36
Cc1nc(-c2cccnc2)nc(N2CC[C@@H](CCCO)C2)c1C	ZINC000450951174	DF	On-Demand	Anodyne	ROS1	45	36
CCNC(=O)c1ccc(N2CCN(CCO)C[C@H]2C)nc1	ZINC000450951195	CC	On-Demand	Anodyne	HDAC1	0	41
CCNC(=O)c1ccc(N2CCN(CCO)C[C@@H]2C)nc1	ZINC000450951196	CC	On-Demand	Anodyne	HDAC1	0	41
CCc1ccc(CN(C)C(=O)Cn2cc(C#N)cn2)cc1	ZINC000450951232	CD	On-Demand	Mild	PLA2G7	30	44
CC1(C(=O)NCC2(Cc3ccccc3)CCCCC2)CCC(=O)CC1	ZINC000450951238	EI	On-Demand	Anodyne	NPFFR2	15	40
CC1(C(=O)NCC2(Cc3ccccc3)CCCCC2)CCC(=O)CC1	ZINC000450951238	EI	On-Demand	Anodyne	NPFFR1	20	40
C[C@@H]1CN(CCO)CCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000450951241	ED	On-Demand	Bother	KCNJ1	21	46
C[C@H]1CN(CCO)CCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000450951242	ED	On-Demand	Bother	KCNJ1	21	46
Cn1ccnc1[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1	ZINC000450951254	FH	On-Demand	Bother	AADAC	0	40
Cn1ccnc1[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1	ZINC000450951257	FH	On-Demand	Bother	AADAC	0	40
Cn1ccnc1[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1	ZINC000450951261	FH	On-Demand	Bother	AADAC	0	40
Cn1ccnc1[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1	ZINC000450951264	FH	On-Demand	Bother	AADAC	0	40
Cc1cccc2c(N(C)C3CCN(CCC(F)(F)F)CC3)ncnc12	ZINC000450951280	FH	On-Demand	Anodyne	HTR4	0	42
Cc1cc(N2CC[C@H](CCCO)C2)nc(-c2cccnc2)n1	ZINC000450951281	CE	On-Demand	Anodyne	ROS1	50	41
Cc1cc(N2CC[C@@H](CCCO)C2)nc(-c2cccnc2)n1	ZINC000450951284	CE	On-Demand	Anodyne	ROS1	50	41
C[C@H]1CN(CCO)CCN1c1nc(-c2ccccc2)c2ccccc2n1	ZINC000450951286	EF	On-Demand	Anodyne	SMO	35	40
C[C@@H]1CN(CCO)CCN1c1nc(-c2ccccc2)c2ccccc2n1	ZINC000450951290	EF	On-Demand	Anodyne	SMO	35	40
COC[C@H]1CCCN(c2ccc3nnc(-c4ccccc4)n3n2)CC1	ZINC000450951300	EG	On-Demand	Anodyne	LRRK2	0	42
COC[C@@H]1CCCN(c2ccc3nnc(-c4ccccc4)n3n2)CC1	ZINC000450951302	EG	On-Demand	Anodyne	LRRK2	0	42
CNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC000450951324	DG	On-Demand	Bother	TAAR1	17	43
CNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC000450951325	DG	On-Demand	Bother	TAAR1	17	43
CC(=O)CCCCCOc1ccc(C#N)cc1I	ZINC000450951339	FH	On-Demand	Mild	ACR	28	43
CC(=O)c1ccc(N[C@H](C)c2cccc(C)c2)nc1	ZINC000450951343	CH	On-Demand	Anodyne	PLK1	32	45
CC(=O)c1ccc(N[C@@H](C)c2cccc(C)c2)nc1	ZINC000450951344	CH	On-Demand	Anodyne	PLK1	32	45
CNC(=O)c1ccc(N2CC[C@H](CC(C)(C)C)C2)nn1	ZINC000450951345	CE	On-Demand	Anodyne	SCD1	51	43
CNC(=O)c1ccc(N2CC[C@@H](CC(C)(C)C)C2)nn1	ZINC000450951346	CE	On-Demand	Anodyne	SCD1	51	43
COC[C@@H]1CCCN(c2ncnc3c(C)csc23)CC1	ZINC000450951348	CG	On-Demand	Anodyne	SIRT3	49	31
COC[C@@H]1CCCN(c2ncnc3c(C)csc23)CC1	ZINC000450951348	CG	On-Demand	Anodyne	SIRT2	50	32
COC[C@@H]1CCCN(c2ncnc3c(C)csc23)CC1	ZINC000450951348	CG	On-Demand	Anodyne	SIRT1	49	31
COC[C@H]1CCCN(c2ncnc3c(C)csc23)CC1	ZINC000450951349	CG	On-Demand	Anodyne	SIRT3	49	31
COC[C@H]1CCCN(c2ncnc3c(C)csc23)CC1	ZINC000450951349	CG	On-Demand	Anodyne	SIRT2	50	32
COC[C@H]1CCCN(c2ncnc3c(C)csc23)CC1	ZINC000450951349	CG	On-Demand	Anodyne	SIRT1	49	31
Cc1cccc([C@H](C)Nc2ncc(C(F)F)cn2)c1	ZINC000450951366	CH	On-Demand	Anodyne	PLK1	26	41
Cc1cccc([C@@H](C)Nc2ncc(C(F)F)cn2)c1	ZINC000450951368	CH	On-Demand	Anodyne	PLK1	26	41
OCCC[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450951372	EH	On-Demand	Anodyne	ADRB2	16	54
OCCC[C@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450951372	EH	On-Demand	Anodyne	ADRB3	20	54
OCCC[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450951373	EH	On-Demand	Anodyne	ADRB2	16	54
OCCC[C@@H]1CCN(c2ncnc3scc(-c4ccccc4)c23)C1	ZINC000450951373	EH	On-Demand	Anodyne	ADRB3	20	54
CCOC(=O)c1cc(N2CCC[C@@H](COC)CC2)ccc1[N+](=O)[O-]	ZINC000450951376	EG	On-Demand	Bother	GYRB	0	40
CCOC(=O)c1cc(N2CCC[C@H](COC)CC2)ccc1[N+](=O)[O-]	ZINC000450951377	EG	On-Demand	Bother	GYRB	0	40
COC[C@@H]1CCCN(c2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000450951378	DH	On-Demand	Mild	AR	29	40
COC[C@H]1CCCN(c2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000450951379	DH	On-Demand	Mild	AR	29	40
Cc1cccc([C@@H](C)Nc2cc(N3CCC[C@@H]3CO)ncn2)c1	ZINC000450951380	DF	On-Demand	Anodyne	PRCP	0	51
Cc1cccc([C@H](C)Nc2cc(N3CCC[C@@H]3CO)ncn2)c1	ZINC000450951381	DF	On-Demand	Anodyne	PRCP	0	51
Cc1cccc([C@H](C)Nc2cc(N3CCC[C@H]3CO)ncn2)c1	ZINC000450951382	DF	On-Demand	Anodyne	PRCP	0	51
Cc1cccc([C@@H](C)Nc2cc(N3CCC[C@H]3CO)ncn2)c1	ZINC000450951383	DF	On-Demand	Anodyne	PRCP	0	51
COc1cc(CC(=O)NC2(C#N)CCC(C(C)(C)C)CC2)ccc1O	ZINC000450951387	EH	On-Demand	Mild	TRPV1	39	51
CN(C)[C@@H](CNC(=O)c1c[nH]c2nccc-2c1)c1cccc(C(F)(F)F)c1	ZINC000450951394	GH	On-Demand	Anodyne	CCR2	59	38
CN(C)[C@H](CNC(=O)c1c[nH]c2nccc-2c1)c1cccc(C(F)(F)F)c1	ZINC000450951395	GH	On-Demand	Anodyne	CCR2	59	38
Cc1cccc([C@@H](C)Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1	ZINC000450951408	EH	On-Demand	Bother	TAAR1	19	45
Cc1cccc([C@H](C)Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1	ZINC000450951409	EH	On-Demand	Bother	TAAR1	19	45
CC(=O)c1ccc(NC(C)(C)CN2CCCC2)c([N+](=O)[O-])c1	ZINC000450951416	DG	On-Demand	Bother	AKR1C3	16	43
CN(c1ncc([N+](=O)[O-])cn1)C1CCN(CCC(F)(F)F)CC1	ZINC000450951418	EE	On-Demand	Bother	CCR5	19	41
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(CC/C=C\c2ccccc2)C1	ZINC000450951419	EF	On-Demand	Anodyne	PREP	90	39
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(CC/C=C/c2ccccc2)C1	ZINC000450951420	EF	On-Demand	Anodyne	PREP	90	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	MME	52	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CMA1	46	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CTRA_BOVIN	60	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	FCER2	65	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CTSB	45	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	PAPA1_CARPA	59	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CYSP_TRYCR	58	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CTSL	40	48
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	ITGA4	55	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CTSS	31	48
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CTRC	49	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	ACE2	48	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CTSV	48	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	CTRB_BOVIN	52	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	SLC15A2	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	BLA1_STEMA	42	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	QRFPR	55	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951438	CD	On-Demand	Mild	NPFFR1	47	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	MME	52	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CMA1	46	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CTRA_BOVIN	60	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	FCER2	65	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CTSB	45	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	PAPA1_CARPA	59	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CYSP_TRYCR	58	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CTSL	40	48
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	ITGA4	55	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CTSS	31	48
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CTRC	49	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	ACE2	48	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CTSV	48	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	CTRB_BOVIN	52	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	SLC15A2	0	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	BLA1_STEMA	42	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	QRFPR	55	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc(C#N)cn1	ZINC000450951439	CD	On-Demand	Mild	NPFFR1	47	32
CC(C)(CN1CCCC1)Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450951444	FH	On-Demand	Anodyne	ROS1	49	34
CCNC(=O)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450951464	CD	On-Demand	Anodyne	HDAC1	18	40
CCNC(=O)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450951464	CD	On-Demand	Anodyne	ENPP2	20	42
CCNC(=O)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450951466	CD	On-Demand	Anodyne	HDAC1	18	40
CCNC(=O)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450951466	CD	On-Demand	Anodyne	ENPP2	20	42
CN1CCN(CCCOc2ccc3ccccc3c2)C[C@H]1c1nc(C2CC2)no1	ZINC000450951475	GH	On-Demand	Anodyne	HRH3	68	42
CN1CCN(CCCOc2ccc3ccccc3c2)C[C@@H]1c1nc(C2CC2)no1	ZINC000450951477	GH	On-Demand	Anodyne	HRH3	68	42
COc1cc(F)cc(C[C@@H](C)Nc2ccnc(N3CCOCC3)n2)c1	ZINC000450951491	ED	On-Demand	Anodyne	EPHB4	49	37
COc1cc(F)cc(C[C@H](C)Nc2ccnc(N3CCOCC3)n2)c1	ZINC000450951492	ED	On-Demand	Anodyne	EPHB4	49	37
COc1cc(F)cc(C[C@@H](C)Nc2cc(C(F)(F)F)nc3ncnn23)c1	ZINC000450951515	FG	On-Demand	Anodyne	DHOD	0	44
COc1cc(F)cc(C[C@H](C)Nc2cc(C(F)(F)F)nc3ncnn23)c1	ZINC000450951516	FG	On-Demand	Anodyne	DHOD	0	44
Cc1cc(Br)c(F)cc1NC(=O)[C@H]1CCC(=O)N1C	ZINC000450951533	EE	On-Demand	Anodyne	P2RX7	22	46
Cc1cc(Br)c(F)cc1NC(=O)[C@@H]1CCC(=O)N1C	ZINC000450951543	EE	On-Demand	Anodyne	P2RX7	22	46
CC1(CC(F)(F)F)CN(c2ccc3nnc(-c4ccccc4)n3n2)C1	ZINC000450951546	EH	On-Demand	Anodyne	LRRK2	23	43
O=C(NCC1(CCOCc2ccccc2)CC1)[C@@H](O)C1CCC1	ZINC000450951561	DF	On-Demand	Anodyne	TIMP3	41	33
O=C(NCC1(CCOCc2ccccc2)CC1)[C@H](O)C1CCC1	ZINC000450951562	DF	On-Demand	Anodyne	TIMP3	41	33
Nc1c(N2CC[C@@H](CCCO)C2)ncnc1-n1cccn1	ZINC000450951566	CC	On-Demand	Anodyne	SIRT3	43	32
Nc1c(N2CC[C@H](CCCO)C2)ncnc1-n1cccn1	ZINC000450951567	CC	On-Demand	Anodyne	SIRT3	43	32
OCCC[C@@H]1CCN(c2ccccn2)C1	ZINC000450951571	BD	On-Demand	Anodyne	AVPR1A	0	40
OCCC[C@H]1CCN(c2ccccn2)C1	ZINC000450951572	BD	On-Demand	Anodyne	AVPR1A	0	40
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450951573	GF	On-Demand	Bother	TAAR1	32	43
Cc1ccc(NC(=O)c2ccc(N3CCN(CCO)C[C@H]3C)c([N+](=O)[O-])c2)cc1	ZINC000450951574	GF	On-Demand	Bother	TAAR1	32	43
COCCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450951586	DD	On-Demand	Anodyne	CETP	0	41
COCCNC(=O)c1ccc(N2CCC[C@H](COC)CC2)nc1	ZINC000450951586	DD	On-Demand	Anodyne	HPGDS	29	45
COCCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450951588	DD	On-Demand	Anodyne	CETP	0	41
COCCNC(=O)c1ccc(N2CCC[C@@H](COC)CC2)nc1	ZINC000450951588	DD	On-Demand	Anodyne	HPGDS	29	45
COC(=O)[C@H](NC(=O)CCCn1nc(C)nc1C)c1ccc(OC)cc1OC	ZINC000450951597	GD	On-Demand	Anodyne	HDA106	0	40
COC(=O)[C@@H](NC(=O)CCCn1nc(C)nc1C)c1ccc(OC)cc1OC	ZINC000450951602	GD	On-Demand	Anodyne	HDA106	0	40
CNC(=O)CSCCCCc1ccc(Cl)c(Cl)c1	ZINC000450951605	DH	On-Demand	Anodyne	OPRK1	0	41
Cc1cccc([C@H](C)Nc2cc(N3CCOCC3)ncn2)c1	ZINC000450951611	CF	On-Demand	Anodyne	PLK1	28	41
Cc1cccc([C@H](C)Nc2cc(N3CCOCC3)ncn2)c1	ZINC000450951611	CF	On-Demand	Anodyne	PIK3CB	23	43
Cc1cccc([C@H](C)Nc2cc(N3CCOCC3)ncn2)c1	ZINC000450951611	CF	On-Demand	Anodyne	SMG1	36	42
Cc1cccc([C@@H](C)Nc2cc(N3CCOCC3)ncn2)c1	ZINC000450951613	CF	On-Demand	Anodyne	PLK1	28	41
Cc1cccc([C@@H](C)Nc2cc(N3CCOCC3)ncn2)c1	ZINC000450951613	CF	On-Demand	Anodyne	PIK3CB	23	43
Cc1cccc([C@@H](C)Nc2cc(N3CCOCC3)ncn2)c1	ZINC000450951613	CF	On-Demand	Anodyne	SMG1	36	42
OCCC[C@@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450951620	FI	On-Demand	Anodyne	ADRB3	33	53
OCCC[C@H]1CCN(c2ncnc3scc(-c4ccc(F)cc4)c23)C1	ZINC000450951621	FI	On-Demand	Anodyne	ADRB3	33	53
CNC(=O)c1ccc(N2CC(C)(CC(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000450951629	EF	On-Demand	Bother	TAAR1	23	41
C[C@@H]1CN(CCO)CCN1c1ccccn1	ZINC000450951632	BC	On-Demand	Anodyne	DRD4	36	40
COC[C@H]1CCCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450951635	CG	On-Demand	Anodyne	HTT	0	45
COC[C@@H]1CCCN(c2ncnc3ccc(C)cc23)CC1	ZINC000450951636	CG	On-Demand	Anodyne	HTT	0	45
COC[C@H]1CCCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1	ZINC000450951645	EF	On-Demand	Bother	TAAR1	30	51
COC[C@@H]1CCCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1	ZINC000450951646	EF	On-Demand	Bother	TAAR1	30	51
CCS(=O)(=O)Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1	ZINC000450951647	GF	On-Demand	Bother	TBXA2R	29	47
COC[C@@H]1CCCN(c2ncccc2I)CC1	ZINC000450951650	EF	On-Demand	Anodyne	HTR4	0	40
COC[C@H]1CCCN(c2ncccc2I)CC1	ZINC000450951651	EF	On-Demand	Anodyne	HTR4	0	40
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450951654	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450951655	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
COC(=O)CNC(=O)c1ccc(N[C@H](C)c2cccc(C)c2)c([N+](=O)[O-])c1	ZINC000450951661	FF	On-Demand	Bother	TAAR1	18	50
COC(=O)CNC(=O)c1ccc(N[C@@H](C)c2cccc(C)c2)c([N+](=O)[O-])c1	ZINC000450951662	FF	On-Demand	Bother	TAAR1	18	50
CC[C@H](Nc1ccnc2c([N+](=O)[O-])cccc12)C(=O)NC	ZINC000450951679	CE	On-Demand	Bother	COLA	49	31
CC[C@@H](Nc1ccnc2c([N+](=O)[O-])cccc12)C(=O)NC	ZINC000450951680	CE	On-Demand	Bother	COLA	49	31
COc1cccc([C@@H]2C[C@H]2C(=O)N(C)C[C@@H]2C[C@H](F)CN2Cc2ncccn2)c1	ZINC000450951699	GF	On-Demand	Anodyne	GPR88	0	40
CC(C)(C)C[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450951704	FG	On-Demand	Anodyne	CXCR3	35	40
CC(C)(C)C[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000450951705	FG	On-Demand	Anodyne	CXCR3	35	40
COC[C@H]1CCCN(c2nccc(-c3ccc(OC)cc3)n2)CC1	ZINC000450951706	EG	On-Demand	Anodyne	DKK1	0	50
COC[C@@H]1CCCN(c2nccc(-c3ccc(OC)cc3)n2)CC1	ZINC000450951707	EG	On-Demand	Anodyne	DKK1	0	50
CC(C)(C)C[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450951708	FG	On-Demand	Anodyne	GCK	58	33
CC(C)(C)C[C@@H]1CCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450951708	FG	On-Demand	Anodyne	GCKR	70	38
CC(C)(C)C[C@H]1CCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450951709	FG	On-Demand	Anodyne	GCK	58	33
CC(C)(C)C[C@H]1CCN(c2ccc(S(=O)(=O)N3CCCC3)cn2)C1	ZINC000450951709	FG	On-Demand	Anodyne	GCKR	70	38
N#Cc1cnn(CC(=O)N2CCC(OCc3ccccc3)CC2)c1	ZINC000450951744	DD	On-Demand	Mild	GRIN2B	22	44
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(CCc2c(Cl)cccc2Cl)C1	ZINC000450951748	FG	On-Demand	Anodyne	PREP	82	39
CCOC(=O)[C@@H](C)N(C)c1ccc([N+](=O)[O-])c(N)c1F	ZINC000450951765	CD	On-Demand	Bother	COLA	49	31
CCOC(=O)[C@H](C)N(C)c1ccc([N+](=O)[O-])c(N)c1F	ZINC000450951766	CD	On-Demand	Bother	COLA	49	31
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450951773	EG	On-Demand	Anodyne	FASN	31	45
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450951773	EG	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@H](c2c(F)cccc2F)C1	ZINC000450951773	EG	On-Demand	Anodyne	L3MBTL3	46	36
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450951774	EG	On-Demand	Anodyne	FASN	31	45
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450951774	EG	On-Demand	Anodyne	L3MBTL1	0	40
O=C(c1ccc(N2CCC2)nc1)N1CC[C@@H](c2c(F)cccc2F)C1	ZINC000450951774	EG	On-Demand	Anodyne	L3MBTL3	46	36
C[C@H]1CN(CCO)CCN1c1ccccn1	ZINC000450951814	BC	On-Demand	Anodyne	DRD4	36	40
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H](CCCO)C1	ZINC000450951817	CG	On-Demand	Mild	LIPG	62	44
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@H](CCCO)C1	ZINC000450951818	CG	On-Demand	Mild	LIPG	62	44
C[C@H]1CN(CCO)CCN1c1ccnc(N2CCCCC2)n1	ZINC000450951825	DC	On-Demand	Anodyne	SORD	60	43
C[C@@H]1CN(CCO)CCN1c1ccnc(N2CCCCC2)n1	ZINC000450951826	DC	On-Demand	Anodyne	SORD	60	43
COC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951845	FH	On-Demand	Anodyne	PDE3A	51	38
COC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951845	FH	On-Demand	Anodyne	PDGFRB	66	42
COC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951845	FH	On-Demand	Anodyne	PDE3B	75	39
COC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951845	FH	On-Demand	Anodyne	SIRT3	51	31
COC[C@@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951845	FH	On-Demand	Anodyne	SIRT2	52	32
COC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951846	FH	On-Demand	Anodyne	PDE3A	51	38
COC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951846	FH	On-Demand	Anodyne	PDGFRB	66	42
COC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951846	FH	On-Demand	Anodyne	PDE3B	75	39
COC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951846	FH	On-Demand	Anodyne	SIRT3	51	31
COC[C@H]1CCCN(c2ncnc3cc(Br)ccc23)CC1	ZINC000450951846	FH	On-Demand	Anodyne	SIRT2	52	32
C[C@@H]1CN(CCO)CCN1c1ccnc(N2CCOCC2)n1	ZINC000450951851	DB	On-Demand	Anodyne	SORD	51	40
C[C@H]1CN(CCO)CCN1c1ccnc(N2CCOCC2)n1	ZINC000450951853	DB	On-Demand	Anodyne	SORD	51	40
CC[C@H](O)CC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450951856	EF	On-Demand	Anodyne	PHES	0	42
CC[C@H](O)CC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450951856	EF	On-Demand	Anodyne	PDS	42	37
CC[C@@H](O)CC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450951858	EF	On-Demand	Anodyne	PHES	0	42
CC[C@@H](O)CC(=O)NC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450951858	EF	On-Demand	Anodyne	PDS	42	37
CC[C@H](O)CC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450951860	EF	On-Demand	Anodyne	PHES	0	42
CC[C@H](O)CC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450951860	EF	On-Demand	Anodyne	PDS	42	37
CC[C@@H](O)CC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450951862	EF	On-Demand	Anodyne	PHES	0	42
CC[C@@H](O)CC(=O)NC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000450951862	EF	On-Demand	Anodyne	PDS	42	37
C[C@H]1CN(CCO)CCN1c1ncnc2[nH]ccc12	ZINC000450951865	CC	On-Demand	Anodyne	AKT2	46	41
C[C@H]1CN(CCO)CCN1c1ncnc2[nH]ccc12	ZINC000450951865	CC	On-Demand	Anodyne	AKT3	37	41
C[C@H]1CN(CCO)CCN1c1ncnc2[nH]ccc12	ZINC000450951865	CC	On-Demand	Anodyne	ROCK2	42	41
C[C@H]1CN(CCO)CCN1c1ncnc2[nH]ccc12	ZINC000450951865	CC	On-Demand	Anodyne	AKT1	23	41
C[C@@H]1CN(CCO)CCN1c1ncnc2[nH]ccc12	ZINC000450951867	CC	On-Demand	Anodyne	AKT2	46	41
C[C@@H]1CN(CCO)CCN1c1ncnc2[nH]ccc12	ZINC000450951867	CC	On-Demand	Anodyne	AKT3	37	41
C[C@@H]1CN(CCO)CCN1c1ncnc2[nH]ccc12	ZINC000450951867	CC	On-Demand	Anodyne	ROCK2	42	41
C[C@@H]1CN(CCO)CCN1c1ncnc2[nH]ccc12	ZINC000450951867	CC	On-Demand	Anodyne	AKT1	23	41
C[C@@H](O)CCSCCC(=O)OC(C)(C)C	ZINC000450951868	BE	On-Demand	Anodyne	BHMT	52	33
C[C@H](O)CCSCCC(=O)OC(C)(C)C	ZINC000450951870	BE	On-Demand	Anodyne	BHMT	52	33
CNC(=O)CSCc1ccn(CCc2ccccc2)n1	ZINC000450951871	CE	On-Demand	Anodyne	FAS	20	40
Cc1cnc(CCCC(=O)N(Cc2ccccc2)[C@@H](C)C(C)(C)C)o1	ZINC000450951882	EJ	On-Demand	Anodyne	CES1D	44	30
Cc1cnc(CCCC(=O)N(Cc2ccccc2)[C@H](C)C(C)(C)C)o1	ZINC000450951886	EJ	On-Demand	Anodyne	CES1D	44	30
CC(C)(C)C[C@H]1CCN(c2ccc(S(N)(=O)=O)cn2)C1	ZINC000450951888	CD	On-Demand	Anodyne	GCKR	65	37
CC(C)(C)C[C@@H]1CCN(c2ccc(S(N)(=O)=O)cn2)C1	ZINC000450951889	CD	On-Demand	Anodyne	GCKR	65	37
COC[C@H]1CCCN(c2ncnc3c(C)cccc23)CC1	ZINC000450951896	CG	On-Demand	Anodyne	HTR4	34	42
COC[C@@H]1CCCN(c2ncnc3c(C)cccc23)CC1	ZINC000450951898	CG	On-Demand	Anodyne	HTR4	34	42
COC[C@H]1CCCN(c2ccnc3c(OC)cccc23)CC1	ZINC000450951900	DG	On-Demand	Anodyne	HTR1A	40	36
COC[C@H]1CCCN(c2ccnc3c(OC)cccc23)CC1	ZINC000450951900	DG	On-Demand	Anodyne	ADRA1A	24	40
COC[C@H]1CCCN(c2ccnc3c(OC)cccc23)CC1	ZINC000450951900	DG	On-Demand	Anodyne	PDE3B	53	32
COC[C@@H]1CCCN(c2ccnc3c(OC)cccc23)CC1	ZINC000450951902	DG	On-Demand	Anodyne	HTR1A	40	36
COC[C@@H]1CCCN(c2ccnc3c(OC)cccc23)CC1	ZINC000450951902	DG	On-Demand	Anodyne	ADRA1A	24	40
COC[C@@H]1CCCN(c2ccnc3c(OC)cccc23)CC1	ZINC000450951902	DG	On-Demand	Anodyne	PDE3B	53	32
C[C@@H]1CN(CCO)CCN1c1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450951909	FC	On-Demand	Anodyne	CXCR3	32	44
C[C@H]1CN(CCO)CCN1c1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000450951911	FC	On-Demand	Anodyne	CXCR3	32	44
C[C@@H]1CN(CCO)CCN1c1nc(-c2ccccc2)cs1	ZINC000450951921	DE	On-Demand	Anodyne	EGFR	15	40
C[C@H]1CN(CCO)CCN1c1nc(-c2ccccc2)cs1	ZINC000450951923	DE	On-Demand	Anodyne	EGFR	15	40
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c2cnn3C)cc1	ZINC000450951931	EE	On-Demand	Anodyne	ABL1	23	40
COC[C@H]1CCCN(c2ccc3ccccc3n2)CC1	ZINC000450951932	CG	On-Demand	Anodyne	PDE1B	0	48
COC[C@@H]1CCCN(c2ccc3ccccc3n2)CC1	ZINC000450951933	CG	On-Demand	Anodyne	PDE1B	0	48
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cn2)CC1	ZINC000450951945	CC	On-Demand	Anodyne	CASP3	51	36
COC[C@@H]1CCCN(c2ccc(S(N)(=O)=O)cn2)CC1	ZINC000450951945	CC	On-Demand	Anodyne	CASP7	54	36
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cn2)CC1	ZINC000450951947	CC	On-Demand	Anodyne	CASP3	51	36
COC[C@H]1CCCN(c2ccc(S(N)(=O)=O)cn2)CC1	ZINC000450951947	CC	On-Demand	Anodyne	CASP7	54	36
COC[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000450951961	DH	On-Demand	Mild	LIPG	56	41
COC[C@H]1CCCN(c2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000450951963	DH	On-Demand	Mild	LIPG	56	41
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951965	FH	On-Demand	Anodyne	CETP	0	40
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951965	FH	On-Demand	Anodyne	PRNP	60	42
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951965	FH	On-Demand	Anodyne	P4HTM	0	47
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951965	FH	On-Demand	Anodyne	DGAT2	0	43
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951965	FH	On-Demand	Anodyne	DGAT1	56	50
COC[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951965	FH	On-Demand	Anodyne	HSPB1	0	43
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951973	FH	On-Demand	Anodyne	CETP	0	40
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951973	FH	On-Demand	Anodyne	PRNP	60	42
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951973	FH	On-Demand	Anodyne	P4HTM	0	47
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951973	FH	On-Demand	Anodyne	DGAT2	0	43
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951973	FH	On-Demand	Anodyne	DGAT1	56	50
COC[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C)cc3)cn2)CC1	ZINC000450951973	FH	On-Demand	Anodyne	HSPB1	0	43
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c2ncn3C2CC2)cc1	ZINC000450951974	FF	On-Demand	Anodyne	ADORA1	44	41
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c2ncn3C2CC2)cc1	ZINC000450951974	FF	On-Demand	Anodyne	ADORA2A	0	45
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c2ncn3C2CC2)cc1	ZINC000450951974	FF	On-Demand	Anodyne	ADORA2B	0	40
CCS(=O)(=O)Cc1ccc(Nc2ncnc3c2ncn3C2CC2)cc1	ZINC000450951974	FF	On-Demand	Anodyne	ADORA3	71	36
CC(C)(C)C[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450951976	CG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)C[C@H]1CCN(c2ncc(C(N)=O)cc2Cl)C1	ZINC000450951977	CG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)C[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450951978	CF	On-Demand	Anodyne	PDE3B	52	33
CC(C)(C)C[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450951978	CF	On-Demand	Anodyne	SIRT3	54	34
CC(C)(C)C[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450951978	CF	On-Demand	Anodyne	SIRT2	55	34
CC(C)(C)C[C@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450951978	CF	On-Demand	Anodyne	SIRT1	54	34
CC(C)(C)C[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450951979	CF	On-Demand	Anodyne	PDE3B	52	33
CC(C)(C)C[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450951979	CF	On-Demand	Anodyne	SIRT3	54	34
CC(C)(C)C[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450951979	CF	On-Demand	Anodyne	SIRT2	55	34
CC(C)(C)C[C@@H]1CCN(c2ncnc3[nH]c(=N)ccc23)C1	ZINC000450951979	CF	On-Demand	Anodyne	SIRT1	54	34
COc1ccc(CN(C)C(=O)Cn2cc(C#N)cn2)cc1OC	ZINC000450952032	DD	On-Demand	Mild	MT-ND1	25	44
CN(c1ncnc2cc(Cl)ccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450952058	FI	On-Demand	Anodyne	HRP1_PLAFA	67	35
CN(c1ncnc2cc(Cl)ccc12)C1CCN(CCC(F)(F)F)CC1	ZINC000450952058	FI	On-Demand	Anodyne	HNMT	49	34
CCOC(=O)c1sc2ncnc(N3CCC[C@@H](COC)CC3)c2c1C	ZINC000450952117	FG	On-Demand	Anodyne	SIRT3	57	37
CCOC(=O)c1sc2ncnc(N3CCC[C@@H](COC)CC3)c2c1C	ZINC000450952117	FG	On-Demand	Anodyne	SIRT2	53	33
CCOC(=O)c1sc2ncnc(N3CCC[C@@H](COC)CC3)c2c1C	ZINC000450952117	FG	On-Demand	Anodyne	SIRT1	52	33
CCOC(=O)c1sc2ncnc(N3CCC[C@H](COC)CC3)c2c1C	ZINC000450952118	FG	On-Demand	Anodyne	SIRT3	57	37
CCOC(=O)c1sc2ncnc(N3CCC[C@H](COC)CC3)c2c1C	ZINC000450952118	FG	On-Demand	Anodyne	SIRT2	53	33
CCOC(=O)c1sc2ncnc(N3CCC[C@H](COC)CC3)c2c1C	ZINC000450952118	FG	On-Demand	Anodyne	SIRT1	52	33
COC[C@@H]1CCCN(c2ncccc2C(F)(F)F)CC1	ZINC000450952119	CG	On-Demand	Anodyne	TRPV1	31	43
COC[C@@H]1CCCN(c2ncccc2C(F)(F)F)CC1	ZINC000450952119	CG	On-Demand	Anodyne	RBP4	16	43
COC[C@H]1CCCN(c2ncccc2C(F)(F)F)CC1	ZINC000450952120	CG	On-Demand	Anodyne	TRPV1	31	43
COC[C@H]1CCCN(c2ncccc2C(F)(F)F)CC1	ZINC000450952120	CG	On-Demand	Anodyne	RBP4	16	43
CC[C@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(=O)NC	ZINC000450952135	DE	On-Demand	Anodyne	CAPN1	41	38
CC[C@@H](Nc1nc(C)cc(OCc2ccccc2)n1)C(=O)NC	ZINC000450952136	DE	On-Demand	Anodyne	CAPN1	41	38
COC[C@H]1CCCN(c2cc(C)nc3ccc(F)cc23)CC1	ZINC000450952139	DH	On-Demand	Anodyne	GYRB	0	52
COC[C@@H]1CCCN(c2cc(C)nc3ccc(F)cc23)CC1	ZINC000450952140	DH	On-Demand	Anodyne	GYRB	0	52
COC[C@@H]1CCCN(c2cc(C)nc3ccc(F)cc23)CC1	ZINC000450952140	DH	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	37
CN(CCN1CCC[C@H](c2nc(C(F)(F)F)cn2C)C1)Cc1ccccc1	ZINC000450952158	GH	On-Demand	Anodyne	SIGMAR1	22	42
CN(CCN1CCC[C@@H](c2nc(C(F)(F)F)cn2C)C1)Cc1ccccc1	ZINC000450952159	GH	On-Demand	Anodyne	SIGMAR1	22	42
COC[C@@H]1CCCN(c2ncnc3c(F)c(OC)ccc23)CC1	ZINC000450952165	DG	On-Demand	Anodyne	PDE3A	47	37
COC[C@@H]1CCCN(c2ncnc3c(F)c(OC)ccc23)CC1	ZINC000450952165	DG	On-Demand	Anodyne	PDE3B	70	37
COC[C@H]1CCCN(c2ncnc3c(F)c(OC)ccc23)CC1	ZINC000450952166	DG	On-Demand	Anodyne	PDE3A	47	37
COC[C@H]1CCCN(c2ncnc3c(F)c(OC)ccc23)CC1	ZINC000450952166	DG	On-Demand	Anodyne	PDE3B	70	37
COCc1nc(N2CCC[C@H](COC)CC2)c2c(-c3ccccc3)csc2n1	ZINC000450952169	GJ	On-Demand	Anodyne	ADRB3	0	42
COCc1nc(N2CCC[C@@H](COC)CC2)c2c(-c3ccccc3)csc2n1	ZINC000450952170	GJ	On-Demand	Anodyne	ADRB3	0	42
OCCC[C@@H]1CCN(c2ccc3ccccc3n2)C1	ZINC000450952203	CF	On-Demand	Anodyne	HTR3A	30	45
OCCC[C@@H]1CCN(c2ccc3ccccc3n2)C1	ZINC000450952203	CF	On-Demand	Anodyne	PDE1B	0	55
OCCC[C@H]1CCN(c2ccc3ccccc3n2)C1	ZINC000450952204	CF	On-Demand	Anodyne	HTR3A	30	45
OCCC[C@H]1CCN(c2ccc3ccccc3n2)C1	ZINC000450952204	CF	On-Demand	Anodyne	PDE1B	0	55
CN1C[C@@H]2[C@@H](CCCN2CCCC(=O)c2ccc(Br)cc2)C1=O	ZINC000450952226	GF	On-Demand	Anodyne	CYP2J2	49	37
O=S(=O)(NCC1CC1)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450952254	ED	On-Demand	Anodyne	NPY1R	41	33
O=S(=O)(NCC1CC1)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450952255	ED	On-Demand	Anodyne	NPY1R	41	33
OCCC[C@H]1CCN(c2ccc(C(F)(F)F)cn2)C1	ZINC000450952271	CF	On-Demand	Anodyne	LIPG	47	38
OCCC[C@@H]1CCN(c2ccc(C(F)(F)F)cn2)C1	ZINC000450952272	CF	On-Demand	Anodyne	LIPG	47	38
OCCC[C@@H]1CCN(c2nc3ccccc3cc2CO)C1	ZINC000450952273	CE	On-Demand	Anodyne	PDE1B	0	42
OCCC[C@H]1CCN(c2nc3ccccc3cc2CO)C1	ZINC000450952274	CE	On-Demand	Anodyne	PDE1B	0	42
C[C@@H](c1ccc(Cn2ccc(C(F)(F)F)cc2=O)cc1)C(F)(F)F	ZINC000450952316	EJ	On-Demand	Anodyne	PTGDR	0	43
C[C@H](c1ccc(Cn2ccc(C(F)(F)F)cc2=O)cc1)C(F)(F)F	ZINC000450952317	EJ	On-Demand	Anodyne	PTGDR	0	43
COC[C@@H]1C[C@@H](OC)CN1CCCC(=O)c1ccccc1	ZINC000450952338	CE	On-Demand	Anodyne	CYP2J2	52	39
COc1cc(F)cc(C[C@H](C)Nc2nccn3c(C)nnc23)c1	ZINC000450952356	DE	On-Demand	Anodyne	ZAP70	42	42
COc1cc(F)cc(C[C@@H](C)Nc2nccn3c(C)nnc23)c1	ZINC000450952357	DE	On-Demand	Anodyne	ZAP70	42	42
COc1cccc(OCCC(=O)N(C)CCN(C)CC(F)F)c1	ZINC000450952369	EE	On-Demand	Anodyne	MTNR1A	23	44
COc1cccc(OCCC(=O)N(C)CCN(C)CC(F)F)c1	ZINC000450952369	EE	On-Demand	Anodyne	MTNR1B	29	40
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(Cc2cc(Br)ccc2C)C1	ZINC000450952371	GF	On-Demand	Anodyne	PREP	46	33
C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000450952372	GG	On-Demand	Anodyne	CCKBR	15	40
C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000450952372	GG	On-Demand	Anodyne	F7	31	42
C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000450952372	GG	On-Demand	Anodyne	PSBA	0	44
C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000450952373	GG	On-Demand	Anodyne	CCKBR	15	40
C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000450952373	GG	On-Demand	Anodyne	F7	31	42
C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000450952373	GG	On-Demand	Anodyne	PSBA	0	44
C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000450952374	GG	On-Demand	Anodyne	CCKBR	15	40
C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000450952374	GG	On-Demand	Anodyne	F7	31	42
C[C@@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000450952374	GG	On-Demand	Anodyne	PSBA	0	44
C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000450952375	GG	On-Demand	Anodyne	CCKBR	15	40
C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000450952375	GG	On-Demand	Anodyne	F7	31	42
C[C@H](NC(=O)CNC(=O)Nc1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000450952375	GG	On-Demand	Anodyne	PSBA	0	44
CN(c1nc2ccccc2s1)C1CCN(CCC(F)(F)F)CC1	ZINC000450952405	EI	On-Demand	Anodyne	LTA4H	29	41
CO[C@H]1C[C@@H](C(N)=O)N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450952407	DD	On-Demand	Anodyne	DRD4	0	45
CC(C)C[C@@H](C)SCC(=O)Nc1ccccc1	ZINC000450952422	CH	On-Demand	Anodyne	MMP3	35	40
CC(C)C[C@@H](C)SCC(=O)Nc1ccccc1	ZINC000450952422	CH	On-Demand	Anodyne	PSMB5	22	41
CC(C)C[C@@H](C)SCC(=O)Nc1ccccc1	ZINC000450952422	CH	On-Demand	Anodyne	PFHDAC1	0	40
CC(C)C[C@@H](C)SCC(=O)Nc1ccccc1	ZINC000450952422	CH	On-Demand	Anodyne	P95276_MYCTO	0	40
CC(C)C[C@H](C)SCC(=O)Nc1ccccc1	ZINC000450952423	CH	On-Demand	Anodyne	MMP3	35	40
CC(C)C[C@H](C)SCC(=O)Nc1ccccc1	ZINC000450952423	CH	On-Demand	Anodyne	PSMB5	22	41
CC(C)C[C@H](C)SCC(=O)Nc1ccccc1	ZINC000450952423	CH	On-Demand	Anodyne	PFHDAC1	0	40
CC(C)C[C@H](C)SCC(=O)Nc1ccccc1	ZINC000450952423	CH	On-Demand	Anodyne	P95276_MYCTO	0	40
Cc1ccc(F)c(CSCC(=O)Nc2nc(C)cs2)c1	ZINC000450952424	DH	On-Demand	Anodyne	GCK	19	42
COc1cc(F)cc(C[C@H](C)Nc2ccc(C(N)=O)cn2)c1	ZINC000450952425	DE	On-Demand	Anodyne	GCK	24	45
COc1cc(F)cc(C[C@@H](C)Nc2ccc(C(N)=O)cn2)c1	ZINC000450952426	DE	On-Demand	Anodyne	GCK	24	45
CC(C)c1ccc(CN2CCN(C(=O)Cn3cc(C#N)cn3)CC2)cc1	ZINC000450952427	FE	On-Demand	Mild	MLNR	28	40
CCCc1cc(NCCN2CCCC2(C)C)n2ncnc2n1	ZINC000450952429	DE	On-Demand	Anodyne	DHOD	0	47
COc1ccc(CNC(=O)CCN2C[C@H](OC)C[C@H]2CO)c(OC)c1	ZINC000450952448	FC	On-Demand	Anodyne	MTNR1A	44	33
CCc1cc(N2CCOC[C@@H]2CC(N)=O)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450952455	FD	On-Demand	Bother	MTOR	47	39
CCc1cc(N2CCOC[C@H]2CC(N)=O)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450952456	FD	On-Demand	Bother	MTOR	47	39
O=C(NCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952457	GH	On-Demand	Anodyne	CCKAR	15	44
O=C(NCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952457	GH	On-Demand	Anodyne	CCR1	33	41
O=C(NCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952457	GH	On-Demand	Anodyne	CCR3	48	41
O=C(NCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952457	GH	On-Demand	Anodyne	CCKBR	19	44
O=C(NCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952457	GH	On-Demand	Anodyne	CCR2	16	41
O=C(NCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952457	GH	On-Demand	Anodyne	EPHX2	43	50
O=C(NCC(=O)N1CC[C@@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952457	GH	On-Demand	Anodyne	MCHR1	42	42
O=C(NCC(=O)N1CC[C@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952460	GH	On-Demand	Anodyne	CCKAR	15	44
O=C(NCC(=O)N1CC[C@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952460	GH	On-Demand	Anodyne	CCR1	33	41
O=C(NCC(=O)N1CC[C@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952460	GH	On-Demand	Anodyne	CCR3	48	41
O=C(NCC(=O)N1CC[C@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952460	GH	On-Demand	Anodyne	CCKBR	19	44
O=C(NCC(=O)N1CC[C@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952460	GH	On-Demand	Anodyne	CCR2	16	41
O=C(NCC(=O)N1CC[C@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952460	GH	On-Demand	Anodyne	EPHX2	43	50
O=C(NCC(=O)N1CC[C@H](c2c(F)cccc2F)C1)Nc1cccc(Cl)c1	ZINC000450952460	GH	On-Demand	Anodyne	MCHR1	42	42
CCc1cccc(C(=O)N[C@H](C(=O)OC)c2ccc(OC)cc2OC)n1	ZINC000450952468	FE	On-Demand	Anodyne	PDE5A	29	42
CCc1cccc(C(=O)N[C@@H](C(=O)OC)c2ccc(OC)cc2OC)n1	ZINC000450952469	FE	On-Demand	Anodyne	PDE5A	29	42
Cc1cc(N2CCN(CCO)C[C@H]2C)c2cc(F)ccc2n1	ZINC000450952475	DE	On-Demand	Anodyne	HTR1D	19	40
Cc1cc(N2CCN(CCO)C[C@H]2C)c2cc(F)ccc2n1	ZINC000450952475	DE	On-Demand	Anodyne	HTR1B	17	40
Cc1cc(N2CCN(CCO)C[C@@H]2C)c2cc(F)ccc2n1	ZINC000450952477	DE	On-Demand	Anodyne	HTR1D	19	40
Cc1cc(N2CCN(CCO)C[C@@H]2C)c2cc(F)ccc2n1	ZINC000450952477	DE	On-Demand	Anodyne	HTR1B	17	40
Cc1cccc(Cl)c1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450952478	EH	On-Demand	Anodyne	AVPR1A	0	46
Cc1cccc(Cl)c1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450952480	EH	On-Demand	Anodyne	AVPR1A	0	46
Cc1cc(NCCN2CCCC2(C)C)n2ncnc2n1	ZINC000450952485	CD	On-Demand	Anodyne	DHOD	0	57
OCCC[C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450952487	DF	On-Demand	Anodyne	GRM5	26	46
OCCC[C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000450952488	DF	On-Demand	Anodyne	GRM5	26	46
CCc1cc(N2CCOC[C@@H]2CC(N)=O)nc(-c2ccncc2)n1	ZINC000450952503	ED	On-Demand	Anodyne	MTOR	61	40
CCc1cc(N2CCOC[C@H]2CC(N)=O)nc(-c2ccncc2)n1	ZINC000450952505	ED	On-Demand	Anodyne	MTOR	61	40
C[C@@H]1CN(CCO)CCN1c1ccnc2ccccc12	ZINC000450952542	CD	On-Demand	Anodyne	HNMT	49	37
C[C@H]1CN(CCO)CCN1c1ccnc2ccccc12	ZINC000450952543	CD	On-Demand	Anodyne	HNMT	49	37
C[C@@H]1CN(CCO)CCN1c1ccnc2cc(F)c(Cl)cc12	ZINC000450952563	DF	On-Demand	Anodyne	HRP1_PLAFA	48	33
C[C@H]1CN(CCO)CCN1c1ccnc2cc(F)c(Cl)cc12	ZINC000450952564	DF	On-Demand	Anodyne	HRP1_PLAFA	48	33
CN(c1ccc(C#N)cn1)C1CCN(CCC(F)(F)F)CC1	ZINC000450952612	DF	On-Demand	Mild	MEN1	42	36
C[C@H](CCC1CC1)NC(=O)c1c(Cl)cc(F)cc1Br	ZINC000450952613	EJ	On-Demand	Anodyne	CACNA1I	41	33
C[C@@H](CCC1CC1)NC(=O)c1c(Cl)cc(F)cc1Br	ZINC000450952614	EJ	On-Demand	Anodyne	CACNA1I	41	33
CCCc1cc(NC(C)(C)CN2CCCC2)n2ncnc2n1	ZINC000450952657	DE	On-Demand	Anodyne	DHOD	0	41
CCS(=O)(=O)c1ccc(CN2CCC[C@H]2Cn2ccnn2)cc1	ZINC000450952666	ED	On-Demand	Anodyne	CASP3	44	33
CNS(=O)(=O)c1ccc(NCCN2CCCC2(C)C)c([N+](=O)[O-])c1	ZINC000450952681	FD	On-Demand	Bother	BCL2L1	24	41
CNS(=O)(=O)c1ccc(NCCN2CCCC2(C)C)c([N+](=O)[O-])c1	ZINC000450952681	FD	On-Demand	Bother	BCL2	19	41
O=C(NCC1(CCOCc2ccccc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450952698	FG	On-Demand	Anodyne	HDAC1	28	46
O=C(NCC1(CCOCc2ccccc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450952698	FG	On-Demand	Anodyne	HCN1	51	32
O=C(NCC1(CCOCc2ccccc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450952698	FG	On-Demand	Anodyne	HCN4	48	32
OCCC[C@@H]1CCN(c2ncnc3cccc(F)c23)C1	ZINC000450952708	CE	On-Demand	Anodyne	PDE3B	49	31
OCCC[C@@H]1CCN(c2ncnc3cccc(F)c23)C1	ZINC000450952708	CE	On-Demand	Anodyne	SIRT3	52	33
OCCC[C@@H]1CCN(c2ncnc3cccc(F)c23)C1	ZINC000450952708	CE	On-Demand	Anodyne	SIRT2	52	33
OCCC[C@H]1CCN(c2ncnc3cccc(F)c23)C1	ZINC000450952709	CE	On-Demand	Anodyne	PDE3B	49	31
OCCC[C@H]1CCN(c2ncnc3cccc(F)c23)C1	ZINC000450952709	CE	On-Demand	Anodyne	SIRT3	52	33
OCCC[C@H]1CCN(c2ncnc3cccc(F)c23)C1	ZINC000450952709	CE	On-Demand	Anodyne	SIRT2	52	33
Cc1nc2ccccc2nc1N1CC[C@@H](CCCO)C1	ZINC000450952711	CF	On-Demand	Anodyne	PDE1B	0	42
Cc1nc2ccccc2nc1N1CC[C@H](CCCO)C1	ZINC000450952712	CF	On-Demand	Anodyne	PDE1B	0	42
COCc1nc(N2CC[C@H](CCCO)C2)c2c(-c3ccccc3)csc2n1	ZINC000450952723	GI	On-Demand	Anodyne	ADRB3	26	40
COCc1nc(N2CC[C@@H](CCCO)C2)c2c(-c3ccccc3)csc2n1	ZINC000450952724	GI	On-Demand	Anodyne	ADRB3	26	40
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450952729	FD	On-Demand	Anodyne	DRD4	17	46
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450952729	FD	On-Demand	Anodyne	AVPR2	46	38
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450952730	FD	On-Demand	Anodyne	DRD4	17	46
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000450952730	FD	On-Demand	Anodyne	AVPR2	46	38
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](CCCO)C3)c([N+](=O)[O-])c2)cc1	ZINC000450952737	GH	On-Demand	Bother	TAAR1	32	49
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](CCCO)C3)c([N+](=O)[O-])c2)cc1	ZINC000450952738	GH	On-Demand	Bother	TAAR1	32	49
COc1cc(OC)c2ncnc(N3CCN(CCO)C[C@H]3C)c2c1	ZINC000450952741	ED	On-Demand	Anodyne	PDE3B	45	32
COc1cc(OC)c2ncnc(N3CCN(CCO)C[C@@H]3C)c2c1	ZINC000450952742	ED	On-Demand	Anodyne	PDE3B	45	32
OCCC[C@@H]1CCN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000450952752	FG	On-Demand	Anodyne	ROS1	40	37
OCCC[C@H]1CCN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000450952753	FG	On-Demand	Anodyne	ROS1	40	37
CSc1ccc2ncnc(N3CCN(CCO)C[C@H]3C)c2c1	ZINC000450952756	DD	On-Demand	Anodyne	HTT	0	42
CSc1ccc2ncnc(N3CCN(CCO)C[C@@H]3C)c2c1	ZINC000450952757	DD	On-Demand	Anodyne	HTT	0	42
COc1ccccc1[C@H](CNC(=O)c1ccc(C)nc1C(C)C)OC(C)C	ZINC000450952761	FI	On-Demand	Anodyne	KCNK3	36	40
COc1ccccc1[C@H](CNC(=O)c1ccc(C)nc1C(C)C)OC(C)C	ZINC000450952761	FI	On-Demand	Anodyne	KCNK9	28	40
COc1ccccc1[C@@H](CNC(=O)c1ccc(C)nc1C(C)C)OC(C)C	ZINC000450952762	FI	On-Demand	Anodyne	KCNK3	36	40
COc1ccccc1[C@@H](CNC(=O)c1ccc(C)nc1C(C)C)OC(C)C	ZINC000450952762	FI	On-Demand	Anodyne	KCNK9	28	40
OCCC[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952763	GF	On-Demand	Anodyne	PDE3A	48	37
OCCC[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952763	GF	On-Demand	Anodyne	PDE3B	72	37
OCCC[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952763	GF	On-Demand	Anodyne	SIRT3	59	35
OCCC[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952763	GF	On-Demand	Anodyne	SIRT2	53	33
OCCC[C@@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952763	GF	On-Demand	Anodyne	SIRT1	52	33
OCCC[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952764	GF	On-Demand	Anodyne	PDE3A	48	37
OCCC[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952764	GF	On-Demand	Anodyne	PDE3B	72	37
OCCC[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952764	GF	On-Demand	Anodyne	SIRT3	59	35
OCCC[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952764	GF	On-Demand	Anodyne	SIRT2	53	33
OCCC[C@H]1CCN(c2ncnc3ccc(I)cc23)C1	ZINC000450952764	GF	On-Demand	Anodyne	SIRT1	52	33
C[C@@H]1CN(CCO)CCN1c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000450952765	DD	On-Demand	Bother	SLC6A4	15	55
C[C@@H]1CN(CCO)CCN1c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000450952765	DD	On-Demand	Bother	KCNJ1	15	46
C[C@H]1CN(CCO)CCN1c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000450952766	DD	On-Demand	Bother	SLC6A4	15	55
C[C@H]1CN(CCO)CCN1c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000450952766	DD	On-Demand	Bother	KCNJ1	15	46
CC1(C)CCCN1CCNc1cc(C(F)(F)F)nc2ncnn12	ZINC000450952803	EE	On-Demand	Anodyne	DHOD	0	49
O=C1N[C@@H]2CCCC[C@H]2C[C@@H]1Sc1cccc([N+](=O)[O-])c1	ZINC000450952807	DG	On-Demand	Bother	CACNA1D	52	33
O=C1N[C@@H]2CCCC[C@@H]2C[C@@H]1Sc1cccc([N+](=O)[O-])c1	ZINC000450952808	DG	On-Demand	Bother	CACNA1D	52	33
O=C1N[C@@H]2CCCC[C@@H]2C[C@H]1Sc1cccc([N+](=O)[O-])c1	ZINC000450952809	DG	On-Demand	Bother	CACNA1D	52	33
O=C1N[C@@H]2CCCC[C@H]2C[C@H]1Sc1cccc([N+](=O)[O-])c1	ZINC000450952810	DG	On-Demand	Bother	CACNA1D	52	33
COc1cccc(OCCC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450952827	FG	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450952827	FG	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450952827	FG	On-Demand	Anodyne	CYP26A1	46	33
COc1cccc(OCCC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450952828	FG	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450952828	FG	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc(OCCC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450952828	FG	On-Demand	Anodyne	CYP26A1	46	33
COc1cccc(OCCC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450952829	FG	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450952829	FG	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc(OCCC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000450952829	FG	On-Demand	Anodyne	CYP26A1	46	33
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450952830	FG	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450952830	FG	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc(OCCC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000450952830	FG	On-Demand	Anodyne	CYP26A1	46	33
COc1cccc(NC(=O)CN(C)C(=O)Cn2cc(C#N)cn2)c1	ZINC000450952843	EC	On-Demand	Mild	PDGFRB	27	49
COc1cccc(NC(=O)CN(C)C(=O)Cn2cc(C#N)cn2)c1	ZINC000450952843	EC	On-Demand	Mild	MTNR1A	22	40
COc1cccc(NC(=O)CN(C)C(=O)Cn2cc(C#N)cn2)c1	ZINC000450952843	EC	On-Demand	Mild	MTNR1B	31	40
COc1cccc(NC(=O)CN(C)C(=O)Cn2cc(C#N)cn2)c1	ZINC000450952843	EC	On-Demand	Mild	FLT4	24	46
COc1cc(F)cc(C[C@@H](C)Nc2cc(N3CCC[C@H](CO)C3)ncn2)c1	ZINC000450952847	FF	On-Demand	Anodyne	PRCP	0	45
COc1cc(F)cc(C[C@H](C)Nc2cc(N3CCC[C@H](CO)C3)ncn2)c1	ZINC000450952848	FF	On-Demand	Anodyne	PRCP	0	45
COc1cc(F)cc(C[C@@H](C)Nc2cc(N3CCC[C@@H](CO)C3)ncn2)c1	ZINC000450952849	FF	On-Demand	Anodyne	PRCP	0	45
COc1cc(F)cc(C[C@H](C)Nc2cc(N3CCC[C@@H](CO)C3)ncn2)c1	ZINC000450952850	FF	On-Demand	Anodyne	PRCP	0	45
COc1ccc(CNC(=O)CCN2CCC[C@H]2Cn2ccnn2)c(OC)c1	ZINC000450952851	FD	On-Demand	Anodyne	ACKR3	51	32
CO[C@@H]1C[C@@H](c2nncn2C)N(CCCC(=O)c2ccccc2)C1	ZINC000450952876	EE	On-Demand	Anodyne	CYP2J2	49	36
Cc1ccc(OCCCN2CCN(C)[C@H](c3nc(C4CC4)no3)C2)cc1C	ZINC000450952878	FG	On-Demand	Anodyne	HRH3	55	42
Cc1ccc(OCCCN2CCN(C)[C@@H](c3nc(C4CC4)no3)C2)cc1C	ZINC000450952879	FG	On-Demand	Anodyne	HRH3	55	42
CC(F)(F)CCSCC(=O)Nc1ccccc1	ZINC000450952880	CG	On-Demand	Anodyne	CES1	18	41
OCCC[C@@H]1CCN(c2ccc3ccc(F)cc3n2)C1	ZINC000450952895	CF	On-Demand	Anodyne	PDE1B	0	41
OCCC[C@H]1CCN(c2ccc3ccc(F)cc3n2)C1	ZINC000450952896	CF	On-Demand	Anodyne	PDE1B	0	41
NC(=O)c1cc(N2CC[C@H](CCCO)C2)ccn1	ZINC000450952897	BC	On-Demand	Anodyne	SIRT3	50	31
NC(=O)c1cc(N2CC[C@H](CCCO)C2)ccn1	ZINC000450952897	BC	On-Demand	Anodyne	SIRT2	51	32
NC(=O)c1cc(N2CC[C@H](CCCO)C2)ccn1	ZINC000450952897	BC	On-Demand	Anodyne	SIRT1	50	31
NC(=O)c1cc(N2CC[C@@H](CCCO)C2)ccn1	ZINC000450952898	BC	On-Demand	Anodyne	SIRT3	50	31
NC(=O)c1cc(N2CC[C@@H](CCCO)C2)ccn1	ZINC000450952898	BC	On-Demand	Anodyne	SIRT2	51	32
NC(=O)c1cc(N2CC[C@@H](CCCO)C2)ccn1	ZINC000450952898	BC	On-Demand	Anodyne	SIRT1	50	31
C[C@H]1CN(CCO)CCN1c1ccc([N+](=O)[O-])c(OCc2ccccc2)n1	ZINC000450952915	FE	On-Demand	Bother	SGPL1	0	40
C[C@@H]1CN(CCO)CCN1c1ccc([N+](=O)[O-])c(OCc2ccccc2)n1	ZINC000450952916	FE	On-Demand	Bother	SGPL1	0	40
CCCOc1cccc(CN2C(=O)N[C@@](C)(C3(C)CC3)C2=O)c1	ZINC000450952937	DG	On-Demand	Anodyne	UPP1	45	39
CCCOc1cccc(CN2C(=O)N[C@](C)(C3(C)CC3)C2=O)c1	ZINC000450952938	DG	On-Demand	Anodyne	UPP1	45	39
OCCC[C@@H]1CCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450952944	CF	On-Demand	Anodyne	FAAH	0	45
OCCC[C@H]1CCN(c2nc(-c3ccccc3)ns2)C1	ZINC000450952945	CF	On-Demand	Anodyne	FAAH	0	45
Cc1cc(N2CCN(CCO)C[C@H]2C)nc(C(C)C)n1	ZINC000450952956	CD	On-Demand	Anodyne	SORD	33	41
Cc1cc(N2CCN(CCO)C[C@@H]2C)nc(C(C)C)n1	ZINC000450952957	CD	On-Demand	Anodyne	SORD	33	41
CNS(=O)(=O)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450952963	CC	On-Demand	Anodyne	GCKR	21	41
CNS(=O)(=O)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450952964	CC	On-Demand	Anodyne	GCKR	21	41
OCCC[C@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000450952982	EH	On-Demand	Anodyne	SIRT3	52	33
OCCC[C@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000450952982	EH	On-Demand	Anodyne	SIRT2	45	32
OCCC[C@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000450952982	EH	On-Demand	Anodyne	SIRT1	40	32
OCCC[C@@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000450952983	EH	On-Demand	Anodyne	SIRT3	52	33
OCCC[C@@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000450952983	EH	On-Demand	Anodyne	SIRT2	45	32
OCCC[C@@H]1CCN(c2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000450952983	EH	On-Demand	Anodyne	SIRT1	40	32
C[C@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450952984	ED	On-Demand	Anodyne	SCD1	37	42
C[C@@H]1CN(CCO)CCN1c1ccc(C(=O)Nc2ccccc2)nn1	ZINC000450952985	ED	On-Demand	Anodyne	SCD1	37	42
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(CCc2ccc(Cl)cc2)C1	ZINC000450953003	EF	On-Demand	Anodyne	SLC6A1	24	41
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(CCc2ccc(Cl)cc2)C1	ZINC000450953003	EF	On-Demand	Anodyne	PREP	72	38
COc1ccc(-c2nnc(N3CCOC[C@@H]3CC(N)=O)c3ccccc23)cc1	ZINC000450953008	GE	On-Demand	Anodyne	SMO	50	51
COc1ccc(-c2nnc(N3CCOC[C@H]3CC(N)=O)c3ccccc23)cc1	ZINC000450953009	GE	On-Demand	Anodyne	SMO	50	51
CCc1cc(N[C@H](C)Cc2cc(F)cc(OC)c2)n2ncnc2n1	ZINC000450953010	EF	On-Demand	Anodyne	DHOD	0	44
CCc1cc(N[C@@H](C)Cc2cc(F)cc(OC)c2)n2ncnc2n1	ZINC000450953011	EF	On-Demand	Anodyne	DHOD	0	44
COc1cc2c(N3CC(C)(C)[C@@H]4COC[C@@H]43)ncnc2cc1F	ZINC000450953035	DF	On-Demand	Anodyne	PDE3A	45	34
COc1cc2c(N3CC(C)(C)[C@@H]4COC[C@@H]43)ncnc2cc1F	ZINC000450953035	DF	On-Demand	Anodyne	PDE3B	66	34
CCc1cc(N2CC[C@H](CCCO)C2)nc(-c2ccncc2)n1	ZINC000450953098	DF	On-Demand	Anodyne	P2RY12	41	31
CCc1cc(N2CC[C@@H](CCCO)C2)nc(-c2ccncc2)n1	ZINC000450953099	DF	On-Demand	Anodyne	P2RY12	41	31
C[C@@H]1CN(CCO)CCN1c1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450953100	FE	On-Demand	Anodyne	ROS1	48	36
C[C@H]1CN(CCO)CCN1c1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000450953102	FE	On-Demand	Anodyne	ROS1	48	36
CC1CCN(C(=O)c2ccc(N3CCN(CCO)C[C@@H]3C)nc2)CC1	ZINC000450953103	ED	On-Demand	Anodyne	L3MBTL3	42	33
CC1CCN(C(=O)c2ccc(N3CCN(CCO)C[C@H]3C)nc2)CC1	ZINC000450953105	ED	On-Demand	Anodyne	L3MBTL3	42	33
CNC(=O)c1cccnc1N1CC[C@@H](CCCO)C1	ZINC000450953107	CD	On-Demand	Anodyne	SIRT2	50	31
CNC(=O)c1cccnc1N1CC[C@H](CCCO)C1	ZINC000450953109	CD	On-Demand	Anodyne	SIRT2	50	31
Cc1cc(Br)c(F)cc1NC(=O)c1cc2n(n1)CCCC2	ZINC000450953111	FH	On-Demand	Anodyne	CNR1	49	30
C[C@]1(c2cnccn2)NC(=O)N(CCCCc2ccc(Cl)c(Cl)c2)C1=O	ZINC000450953125	GH	On-Demand	Anodyne	DNAE	64	30
C[C@@]1(c2cnccn2)NC(=O)N(CCCCc2ccc(Cl)c(Cl)c2)C1=O	ZINC000450953126	GH	On-Demand	Anodyne	DNAE	64	30
O=[N+]([O-])c1cccc(SCC2CC(F)(F)C2)c1	ZINC000450953133	CH	On-Demand	Bother	CACNA1C	45	35
O=[N+]([O-])c1cccc(SCC2CC(F)(F)C2)c1	ZINC000450953133	CH	On-Demand	Bother	CACNA1D	75	35
CN(c1cnc2ccccc2n1)C1CCN(CCC(F)(F)F)CC1	ZINC000450953136	EG	On-Demand	Anodyne	HTR4	26	42
CCO[C@H]1C[C@@H](NC(=O)C2(Cc3cccc(Cl)c3)CC2)C12CCOCC2	ZINC000450953167	GH	On-Demand	Anodyne	TIMP3	65	35
CCO[C@@H]1C[C@@H](NC(=O)C2(Cc3cccc(Cl)c3)CC2)C12CCOCC2	ZINC000450953168	GH	On-Demand	Anodyne	TIMP3	65	35
CCO[C@H]1C[C@H](NC(=O)C2(Cc3cccc(Cl)c3)CC2)C12CCOCC2	ZINC000450953169	GH	On-Demand	Anodyne	TIMP3	65	35
CCO[C@@H]1C[C@H](NC(=O)C2(Cc3cccc(Cl)c3)CC2)C12CCOCC2	ZINC000450953170	GH	On-Demand	Anodyne	TIMP3	65	35
C[C@H]1CN(CCO)CCN1c1ccc([N+](=O)[O-])cn1	ZINC000450953178	CC	On-Demand	Bother	KCNJ1	21	46
C[C@@H]1CN(CCO)CCN1c1ccc([N+](=O)[O-])cn1	ZINC000450953179	CC	On-Demand	Bother	KCNJ1	21	46
O=C(c1c[nH]c2nccc-2c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450953197	FH	On-Demand	Anodyne	CCR3	32	42
O=C(c1c[nH]c2nccc-2c1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450953197	FH	On-Demand	Anodyne	PARP1	41	36
CN(c1ncc(C(F)(F)F)cc1Cl)C1CCN(CCC(F)(F)F)CC1	ZINC000450953209	GJ	On-Demand	Anodyne	TRPM8	41	36
O=C(c1ccc(N2CCC2)nc1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450953219	FH	On-Demand	Anodyne	CCR3	27	44
O=C(c1ccc(N2CCC2)nc1)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000450953219	FH	On-Demand	Anodyne	L3MBTL3	48	36
Cn1c(C(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)nc2ccccc21	ZINC000450953225	GG	On-Demand	Anodyne	CACNA1I	15	44
Cn1c(C(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)nc2ccccc21	ZINC000450953225	GG	On-Demand	Anodyne	IMDH_CRYPV	54	44
N#Cc1cc(Br)ccc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450953226	GH	On-Demand	Mild	AVPR1A	22	48
N#Cc1cc(Br)ccc1C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450953227	GH	On-Demand	Mild	AVPR1A	22	48
C[C@@H]1CN(CCO)CCN1c1ncnc2c(F)cccc12	ZINC000450953235	CD	On-Demand	Anodyne	ABCC1	61	35
C[C@H]1CN(CCO)CCN1c1ncnc2c(F)cccc12	ZINC000450953236	CD	On-Demand	Anodyne	ABCC1	61	35
C[C@@H]1CN(CCO)CCN1c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl	ZINC000450953237	GD	On-Demand	Bother	KCNJ1	22	41
C[C@H]1CN(CCO)CCN1c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl	ZINC000450953238	GD	On-Demand	Bother	KCNJ1	22	41
C[C@@H]1CN(CCO)CCN1c1ccnc(C2CC2)n1	ZINC000450953239	CC	On-Demand	Anodyne	SORD	42	34
C[C@H]1CN(CCO)CCN1c1ccnc(C2CC2)n1	ZINC000450953240	CC	On-Demand	Anodyne	SORD	42	34
CC(C)NC(=O)c1ccc(N2CCN(CCO)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000450953266	FD	On-Demand	Bother	TAAR1	20	40
CC(C)NC(=O)c1ccc(N2CCN(CCO)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000450953267	FD	On-Demand	Bother	TAAR1	20	40
COc1cc(CN2CCO[C@H]3CCN(C)C[C@H]32)ccc1Cl	ZINC000450953270	DE	On-Demand	Anodyne	UTS2R	20	47
COc1cc(CN2CCO[C@H]3CCN(C)C[C@@H]32)ccc1Cl	ZINC000450953271	DE	On-Demand	Anodyne	UTS2R	20	47
COc1cc(CN2CCO[C@@H]3CCN(C)C[C@H]32)ccc1Cl	ZINC000450953272	DE	On-Demand	Anodyne	UTS2R	20	47
COc1cc(CN2CCO[C@@H]3CCN(C)C[C@@H]32)ccc1Cl	ZINC000450953273	DE	On-Demand	Anodyne	UTS2R	20	47
COc1ccc(-c2csc3ncnc(N4CC[C@H](CCCO)C4)c23)cc1	ZINC000450953276	FH	On-Demand	Anodyne	PDE3A	43	36
COc1ccc(-c2csc3ncnc(N4CC[C@H](CCCO)C4)c23)cc1	ZINC000450953276	FH	On-Demand	Anodyne	ADRB3	0	47
COc1ccc(-c2csc3ncnc(N4CC[C@H](CCCO)C4)c23)cc1	ZINC000450953276	FH	On-Demand	Anodyne	PDE3B	66	36
COc1ccc(-c2csc3ncnc(N4CC[C@@H](CCCO)C4)c23)cc1	ZINC000450953277	FH	On-Demand	Anodyne	PDE3A	43	36
COc1ccc(-c2csc3ncnc(N4CC[C@@H](CCCO)C4)c23)cc1	ZINC000450953277	FH	On-Demand	Anodyne	ADRB3	0	47
COc1ccc(-c2csc3ncnc(N4CC[C@@H](CCCO)C4)c23)cc1	ZINC000450953277	FH	On-Demand	Anodyne	PDE3B	66	36
OCCC[C@@H]1CCN(c2cnc3ccccc3n2)C1	ZINC000450953291	CE	On-Demand	Anodyne	PDE1B	0	42
OCCC[C@@H]1CCN(c2cnc3ccccc3n2)C1	ZINC000450953291	CE	On-Demand	Anodyne	SORD	23	42
OCCC[C@H]1CCN(c2cnc3ccccc3n2)C1	ZINC000450953292	CE	On-Demand	Anodyne	PDE1B	0	42
OCCC[C@H]1CCN(c2cnc3ccccc3n2)C1	ZINC000450953292	CE	On-Demand	Anodyne	SORD	23	42
COC[C@@H]1C[C@@H](OC)CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450953308	FD	On-Demand	Anodyne	MTNR1A	45	36
COC[C@@H]1C[C@H](OC)CN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450953309	FD	On-Demand	Anodyne	MTNR1A	45	36
CN(c1ccc(C#N)c([N+](=O)[O-])c1)C1CCN(CCC(F)(F)F)CC1	ZINC000450953310	FG	On-Demand	Mild	PGR	20	46
COc1cc(F)cc(C[C@@H](C)Nc2ccc(C(C)=O)cn2)c1	ZINC000450953348	DG	On-Demand	Anodyne	GCK	25	46
COc1cc(F)cc(C[C@H](C)Nc2ccc(C(C)=O)cn2)c1	ZINC000450953349	DG	On-Demand	Anodyne	GCK	25	46
CN(c1ccnc(-c2ccccc2)n1)C1CCN(CCC(F)(F)F)CC1	ZINC000450953353	FH	On-Demand	Anodyne	HTR4	24	41
Cc1noc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C)n1	ZINC000450953374	EE	On-Demand	Anodyne	DRD2	29	42
Cc1noc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C)n1	ZINC000450953374	EE	On-Demand	Anodyne	HTR3B	0	43
Cc1noc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C)n1	ZINC000450953374	EE	On-Demand	Anodyne	CYP2J2	51	38
Cc1noc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C)n1	ZINC000450953374	EE	On-Demand	Anodyne	AP2S1	0	42
Cc1noc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C)n1	ZINC000450953375	EE	On-Demand	Anodyne	DRD2	29	42
Cc1noc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C)n1	ZINC000450953375	EE	On-Demand	Anodyne	HTR3B	0	43
Cc1noc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C)n1	ZINC000450953375	EE	On-Demand	Anodyne	CYP2J2	51	38
Cc1noc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)CCN2C)n1	ZINC000450953375	EE	On-Demand	Anodyne	AP2S1	0	42
Cn1ccnc1[C@@H]1C[C@H](Nc2nccc(N[C@H]3CCCOC3)n2)CCO1	ZINC000450953394	FD	On-Demand	Anodyne	MAPK1	46	32
C[C@@H]1CN(CCO)CCN1c1nc(-c2cccc(Cl)c2)no1	ZINC000450953402	DD	On-Demand	Anodyne	GRM5	27	45
C[C@H]1CN(CCO)CCN1c1nc(-c2cccc(Cl)c2)no1	ZINC000450953403	DD	On-Demand	Anodyne	GRM5	27	45
C[C@@H]1CN(CCO)CCN1c1ccc2ccccc2n1	ZINC000450953410	CD	On-Demand	Anodyne	HTR3A	31	45
C[C@@H]1CN(CCO)CCN1c1ccc2ccccc2n1	ZINC000450953410	CD	On-Demand	Anodyne	SORD	25	42
C[C@H]1CN(CCO)CCN1c1ccc2ccccc2n1	ZINC000450953411	CD	On-Demand	Anodyne	HTR3A	31	45
C[C@H]1CN(CCO)CCN1c1ccc2ccccc2n1	ZINC000450953411	CD	On-Demand	Anodyne	SORD	25	42
O=C(Nc1ccccc1)c1ccc(N2CC[C@H](CCCO)C2)nn1	ZINC000450953412	EE	On-Demand	Anodyne	SCD1	40	44
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H](CCCO)C2)nn1	ZINC000450953413	EE	On-Demand	Anodyne	SCD1	40	44
O=[N+]([O-])c1ccccc1N1CC[C@@H](CCCO)C1	ZINC000450953418	CE	On-Demand	Bother	PQSD	0	40
O=[N+]([O-])c1ccccc1N1CC[C@H](CCCO)C1	ZINC000450953419	CE	On-Demand	Bother	PQSD	0	40
C[C@@H]1CN(CCO)CCN1c1ccc(C#N)c(C(F)(F)F)c1	ZINC000450953427	DE	On-Demand	Mild	AR	27	46
C[C@H]1CN(CCO)CCN1c1ccc(C#N)c(C(F)(F)F)c1	ZINC000450953428	DE	On-Demand	Mild	AR	27	46
Cc1cccc2c(N3CC[C@@H](CCCO)C3)ncnc12	ZINC000450953432	CF	On-Demand	Anodyne	PDE3A	42	32
Cc1cccc2c(N3CC[C@@H](CCCO)C3)ncnc12	ZINC000450953432	CF	On-Demand	Anodyne	PDE3B	63	32
Cc1cccc2c(N3CC[C@H](CCCO)C3)ncnc12	ZINC000450953433	CF	On-Demand	Anodyne	PDE3A	42	32
Cc1cccc2c(N3CC[C@H](CCCO)C3)ncnc12	ZINC000450953433	CF	On-Demand	Anodyne	PDE3B	63	32
COC(=O)[C@@H](NC(=O)CCc1nc2cnccc2[nH]1)c1ccc(OC)cc1OC	ZINC000450953456	GD	On-Demand	Anodyne	ENPP1	27	41
COC(=O)[C@H](NC(=O)CCc1nc2cnccc2[nH]1)c1ccc(OC)cc1OC	ZINC000450953457	GD	On-Demand	Anodyne	ENPP1	27	41
COC(=O)[C@@H](NC(=O)Cc1cn(C)nc1C)c1ccc(OC)cc1OC	ZINC000450953494	FD	On-Demand	Anodyne	PDGFRB	25	46
Cn1ccnc1[C@@H]1C[C@H](Nc2nccc(N[C@@H]3CCCOC3)n2)CCO1	ZINC000450953495	FD	On-Demand	Anodyne	MAPK1	46	32
Cn1ccnc1[C@@H]1C[C@@H](Nc2nccc(N[C@H]3CCCOC3)n2)CCO1	ZINC000450953496	FD	On-Demand	Anodyne	MAPK1	46	32
Cn1ccnc1[C@@H]1C[C@@H](Nc2nccc(N[C@@H]3CCCOC3)n2)CCO1	ZINC000450953497	FD	On-Demand	Anodyne	MAPK1	46	32
Cc1ccc2ncnc(NC(C)(C)CN3CCCC3)c2c1	ZINC000450953503	CG	On-Demand	Anodyne	HNMT	54	37
Cc1ccc2ncnc(NC(C)(C)CN3CCCC3)c2c1	ZINC000450953503	CG	On-Demand	Anodyne	CLK4	56	38
Cc1ccc2ncnc(NC(C)(C)CN3CCCC3)c2c1	ZINC000450953503	CG	On-Demand	Anodyne	CD38	59	39
COC(=O)c1cccc(CN2C[C@@H](OC)C[C@H]2C(=O)N2CCCC2)c1Cl	ZINC000450953517	GE	On-Demand	Anodyne	PREP	41	35
CN(c1nccc(C#N)c1Cl)C1CCN(CCC(F)(F)F)CC1	ZINC000450953541	EG	On-Demand	Mild	NOS3	15	40
CN(C)S(=O)(=O)c1ccc(NCCN2CCCC2(C)C)c([N+](=O)[O-])c1	ZINC000450953560	FE	On-Demand	Bother	BDKRB1	22	40
Cc1cc(NC(C)(C)CN2CCCC2)nc(-c2ccccn2)n1	ZINC000450953562	DG	On-Demand	Anodyne	METAP1	39	43
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450953576	GE	On-Demand	Anodyne	PREP	72	41
Clc1ccc(CCN2CCC[C@H]2Cn2ccnn2)cc1	ZINC000450953580	CF	On-Demand	Anodyne	HRH1	33	43
Clc1ccc(CCN2CCC[C@H]2Cn2ccnn2)cc1	ZINC000450953580	CF	On-Demand	Anodyne	ADRA1B	23	43
Clc1ccc(CCN2CCC[C@H]2Cn2ccnn2)cc1	ZINC000450953580	CF	On-Demand	Anodyne	HRH3	27	41
Clc1ccc(CCN2CCC[C@H]2Cn2ccnn2)cc1	ZINC000450953580	CF	On-Demand	Anodyne	SPHK2	26	41
CO[C@H](CSCC(=O)Nc1nc(C)cs1)Cc1ccccc1	ZINC000450953585	EG	On-Demand	Anodyne	CYSP_TRYCR	43	33
CO[C@H](CSCC(=O)Nc1nc(C)cs1)Cc1ccccc1	ZINC000450953585	EG	On-Demand	Anodyne	GCK	22	41
CO[C@@H](CSCC(=O)Nc1nc(C)cs1)Cc1ccccc1	ZINC000450953586	EG	On-Demand	Anodyne	CYSP_TRYCR	43	33
CO[C@@H](CSCC(=O)Nc1nc(C)cs1)Cc1ccccc1	ZINC000450953586	EG	On-Demand	Anodyne	GCK	22	41
O=C(N1CC[C@]2(C1)OCc1ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450953589	FI	On-Demand	Anodyne	AVPR1A	22	41
O=C(N1CC[C@@]2(C1)OCc1ccccc12)C1(Cc2cccc(Cl)c2)CC1	ZINC000450953590	FI	On-Demand	Anodyne	AVPR1A	22	41
COC(=O)[C@H](NC(=O)Cc1cn(C)nc1C)c1ccc(OC)cc1OC	ZINC000450953595	FD	On-Demand	Anodyne	PDGFRB	25	46
OCCC[C@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450953596	EH	On-Demand	Anodyne	LIPG	52	35
OCCC[C@@H]1CCN(c2nc3cc(C(F)(F)F)ccc3s2)C1	ZINC000450953597	EH	On-Demand	Anodyne	LIPG	52	35
CN1C[C@@H]2[C@@H](CCCN2CCCC(=O)c2ccc(F)cc2)C1=O	ZINC000450953605	DE	On-Demand	Anodyne	DRD2	30	42
CN1C[C@@H]2[C@@H](CCCN2CCCC(=O)c2ccc(F)cc2)C1=O	ZINC000450953605	DE	On-Demand	Anodyne	HTR2A	23	48
CN1C[C@@H]2[C@@H](CCCN2CCCC(=O)c2ccc(F)cc2)C1=O	ZINC000450953605	DE	On-Demand	Anodyne	HTR3B	0	42
CN1C[C@@H]2[C@@H](CCCN2CCCC(=O)c2ccc(F)cc2)C1=O	ZINC000450953605	DE	On-Demand	Anodyne	CYP2J2	49	37
C[C@@H]1CN(CCO)CCN1c1ncc(C(=O)N(C)C)cc1Cl	ZINC000450953613	EC	On-Demand	Anodyne	CXCR3	33	45
C[C@H]1CN(CCO)CCN1c1ncc(C(=O)N(C)C)cc1Cl	ZINC000450953614	EC	On-Demand	Anodyne	CXCR3	33	45
C[C@H]1CN(CCO)CCN1c1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450953615	FC	On-Demand	Anodyne	GCKR	70	40
C[C@@H]1CN(CCO)CCN1c1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000450953616	FC	On-Demand	Anodyne	GCKR	70	40
COC(=O)[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ccc(OC)cc1OC	ZINC000450953629	GF	On-Demand	Anodyne	MTNR1A	15	41
COC(=O)[C@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ccc(OC)cc1OC	ZINC000450953629	GF	On-Demand	Anodyne	MTNR1B	20	41
COC(=O)[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ccc(OC)cc1OC	ZINC000450953630	GF	On-Demand	Anodyne	MTNR1A	15	41
COC(=O)[C@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ccc(OC)cc1OC	ZINC000450953630	GF	On-Demand	Anodyne	MTNR1B	20	41
COC(=O)[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ccc(OC)cc1OC	ZINC000450953631	GF	On-Demand	Anodyne	MTNR1A	15	41
COC(=O)[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2)C1)c1ccc(OC)cc1OC	ZINC000450953631	GF	On-Demand	Anodyne	MTNR1B	20	41
COC(=O)[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ccc(OC)cc1OC	ZINC000450953632	GF	On-Demand	Anodyne	MTNR1A	15	41
COC(=O)[C@@H](NC(=O)[C@H]1CCN(c2ccccc2)C1)c1ccc(OC)cc1OC	ZINC000450953632	GF	On-Demand	Anodyne	MTNR1B	20	41
CC(C)N1CC[C@H](N(C)c2ccc(C#N)c([N+](=O)[O-])c2)C1	ZINC000450953633	CE	On-Demand	Mild	PGR	0	48
CC(C)N1CC[C@@H](N(C)c2ccc(C#N)c([N+](=O)[O-])c2)C1	ZINC000450953634	CE	On-Demand	Mild	PGR	0	48
OCCC[C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450953639	EE	On-Demand	Anodyne	PDE1B	0	45
OCCC[C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000450953640	EE	On-Demand	Anodyne	PDE1B	0	45
C[C@@H]1CN(CCO)CCN1c1ncc(C(F)(F)F)s1	ZINC000450953674	CD	On-Demand	Anodyne	MLYCD	43	32
C[C@H]1CN(CCO)CCN1c1ncc(C(F)(F)F)s1	ZINC000450953675	CD	On-Demand	Anodyne	MLYCD	43	32
COc1cc(OC)nc(N2CCN(CCO)C[C@@H]2C)n1	ZINC000450953680	CB	On-Demand	Anodyne	ALS	47	30
COc1cc(OC)nc(N2CCN(CCO)C[C@H]2C)n1	ZINC000450953681	CB	On-Demand	Anodyne	ALS	47	30
COC(=O)[C@@H](NC(=O)c1cc(C)c(C(N)=O)cn1)c1ccc(OC)cc1OC	ZINC000450953685	GD	On-Demand	Anodyne	CSF1R	43	42
COC(=O)[C@@H](NC(=O)c1cc(C)c(C(N)=O)cn1)c1ccc(OC)cc1OC	ZINC000450953685	GD	On-Demand	Anodyne	LUCI_LUCLA	15	41
COC(=O)[C@H](NC(=O)c1cc(C)c(C(N)=O)cn1)c1ccc(OC)cc1OC	ZINC000450953686	GD	On-Demand	Anodyne	CSF1R	43	42
COC(=O)[C@H](NC(=O)c1cc(C)c(C(N)=O)cn1)c1ccc(OC)cc1OC	ZINC000450953686	GD	On-Demand	Anodyne	LUCI_LUCLA	15	41
C[C@@H]1CCC[C@]1(C)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450953710	CG	On-Demand	Anodyne	AVPR1A	17	44
C[C@@H]1CCC[C@]1(C)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450953711	CG	On-Demand	Anodyne	AVPR1A	17	44
C[C@@H]1CCC[C@@]1(C)C(=O)N1CC[C@]2(C1)OCc1ccccc12	ZINC000450953712	CG	On-Demand	Anodyne	AVPR1A	17	44
C[C@@H]1CCC[C@@]1(C)C(=O)N1CC[C@@]2(C1)OCc1ccccc12	ZINC000450953713	CG	On-Demand	Anodyne	AVPR1A	17	44
Cn1c(C(C)(C)NC(=O)CCCC(=O)C2CC2)nc2ccccc21	ZINC000450953739	EG	On-Demand	Anodyne	FASN	15	40
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H](c1ccccc1)N(C)C	ZINC000450953761	GH	On-Demand	Anodyne	TIMP3	43	32
C[C@@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H](c1ccccc1)N(C)C	ZINC000450953762	GH	On-Demand	Anodyne	TIMP3	43	32
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@H](c1ccccc1)N(C)C	ZINC000450953763	GH	On-Demand	Anodyne	TIMP3	43	32
C[C@H](NC(=O)C1(Cc2ccccc2)CCOCC1)[C@@H](c1ccccc1)N(C)C	ZINC000450953764	GH	On-Demand	Anodyne	TIMP3	43	32
CC(C)N1CC[C@@H](N(C)c2ncnc3[nH]ccc23)C1	ZINC000450953774	CD	On-Demand	Anodyne	JAK3	30	69
CC(C)N1CC[C@H](N(C)c2ncnc3[nH]ccc23)C1	ZINC000450953775	CD	On-Demand	Anodyne	JAK3	30	69
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	DRD2	20	43
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	DRD4	47	40
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	ACHE	39	41
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	DRD3	24	40
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	ADORA2B	47	39
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	SIGMAR1	51	50
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	MMP13	26	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	ADAM17	23	43
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	MMP3	18	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	FAAH	29	41
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	MMP9	24	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	TRPV4	18	49
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	MMP1	23	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450953796	GD	On-Demand	Anodyne	F13A1	41	36
CCN(CC)CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450953797	ED	On-Demand	Anodyne	CA1	26	47
COC(=O)c1ncccc1S(=O)(=O)NC1CCCCC1	ZINC000450953804	CD	On-Demand	Anodyne	CCR8	40	31
COC(=O)c1ncccc1S(=O)(=O)NC1CCCCC1	ZINC000450953804	CD	On-Demand	Anodyne	SFRP1	85	33
COC(=O)c1ncccc1S(=O)(=O)NC1CCCCC1	ZINC000450953804	CD	On-Demand	Anodyne	WNT3	50	32
COc1ccc(CNC(=O)CCn2cnc3scc(C)c3c2=O)c(OC)c1	ZINC000450953805	GE	On-Demand	Anodyne	PDGFRB	34	40
CCN(c1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450953810	FE	On-Demand	Anodyne	RORC	23	43
CCN(c1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450953810	FE	On-Demand	Anodyne	RORB	0	43
OCCC[C@H]1CCN(c2ncccc2C(F)(F)F)C1	ZINC000450953815	CF	On-Demand	Anodyne	TRPV1	30	43
OCCC[C@@H]1CCN(c2ncccc2C(F)(F)F)C1	ZINC000450953817	CF	On-Demand	Anodyne	TRPV1	30	43
CN(CC1(c2ccccc2)CC1)C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450953820	FH	On-Demand	Anodyne	KCNA3	35	42
CN(CC1(c2ccccc2)CC1)C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450953822	FH	On-Demand	Anodyne	KCNA3	35	42
CN(C1CCCCC1)S(=O)(=O)CCOCc1ccccc1	ZINC000450953833	DF	On-Demand	Anodyne	AMY2	48	34
COc1ccc(OC(F)(F)F)c(C(=O)N2CCN(C[C@@H](C)O)CC2)c1	ZINC000450953835	FD	On-Demand	Anodyne	ABCB1	26	41
OCCC[C@@H]1CCN(c2nc(O)c3ccccc3n2)C1	ZINC000450953857	CD	On-Demand	Anodyne	TNKS	45	31
OCCC[C@H]1CCN(c2nc(O)c3ccccc3n2)C1	ZINC000450953858	CD	On-Demand	Anodyne	TNKS	45	31
COC(=O)[C@@H](NC(=O)c1cn(CC2CC2)nn1)c1ccc(OC)c(Cl)c1	ZINC000450953868	GD	On-Demand	Anodyne	HTR4	51	35
COC(=O)[C@@H](NC(=O)CSC1CC1)c1ccc(OC)cc1OC	ZINC000450953869	ED	On-Demand	Anodyne	MTNR1B	41	35
COC(=O)[C@@H](NC(=O)CSC1CC1)c1ccc(OC)cc1OC	ZINC000450953869	ED	On-Demand	Anodyne	QRFPR	41	33
COC(=O)[C@H](NC(=O)CSC1CC1)c1ccc(OC)cc1OC	ZINC000450953870	ED	On-Demand	Anodyne	MTNR1B	41	35
COC(=O)[C@H](NC(=O)CSC1CC1)c1ccc(OC)cc1OC	ZINC000450953870	ED	On-Demand	Anodyne	QRFPR	41	33
COC(=O)[C@H](NC(=O)c1cn(CC2CC2)nn1)c1ccc(OC)c(Cl)c1	ZINC000450953871	GD	On-Demand	Anodyne	HTR4	51	35
CCCCCNS(=O)(=O)CCC1CCCC1	ZINC000450953875	BF	On-Demand	Anodyne	RELA	20	45
CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450953903	DF	On-Demand	Anodyne	CA2	22	55
CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450953903	DF	On-Demand	Anodyne	CA1	30	46
CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450953903	DF	On-Demand	Anodyne	MMP13	24	40
CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450953903	DF	On-Demand	Anodyne	CA4	25	41
CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450953903	DF	On-Demand	Anodyne	ALOX15	47	41
CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450953903	DF	On-Demand	Anodyne	P96878_MYCTU	42	42
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953910	EH	On-Demand	Mild	HRH3	43	48
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953910	EH	On-Demand	Mild	CHRNA10	52	50
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953910	EH	On-Demand	Mild	MEN1	44	38
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953912	EH	On-Demand	Mild	HRH3	43	48
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953912	EH	On-Demand	Mild	CHRNA10	52	50
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953912	EH	On-Demand	Mild	MEN1	44	38
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953914	EH	On-Demand	Mild	HRH3	43	48
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953914	EH	On-Demand	Mild	CHRNA10	52	50
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953914	EH	On-Demand	Mild	MEN1	44	38
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953916	EH	On-Demand	Mild	HRH3	43	48
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953916	EH	On-Demand	Mild	CHRNA10	52	50
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOc1cccc(C#N)c1	ZINC000450953916	EH	On-Demand	Mild	MEN1	44	38
O=S(=O)(NCCCN1CCOCC1)c1cc2cc(F)ccc2o1	ZINC000450953918	ED	On-Demand	Anodyne	HTR7	31	42
O=S(=O)(NCCCN1CCOCC1)c1cc2cc(F)ccc2o1	ZINC000450953918	ED	On-Demand	Anodyne	HTR6	0	42
CC(C)[C@H]1N(c2ncnc3[nH]ccc23)CC12CCCC2	ZINC000450953926	CG	On-Demand	Anodyne	AKT2	48	42
CC(C)[C@H]1N(c2ncnc3[nH]ccc23)CC12CCCC2	ZINC000450953926	CG	On-Demand	Anodyne	ROCK2	42	42
CC(C)[C@H]1N(c2ncnc3[nH]ccc23)CC12CCCC2	ZINC000450953926	CG	On-Demand	Anodyne	AKT1	34	44
CC(C)[C@@H]1N(c2ncnc3[nH]ccc23)CC12CCCC2	ZINC000450953927	CG	On-Demand	Anodyne	AKT2	48	42
CC(C)[C@@H]1N(c2ncnc3[nH]ccc23)CC12CCCC2	ZINC000450953927	CG	On-Demand	Anodyne	ROCK2	42	42
CC(C)[C@@H]1N(c2ncnc3[nH]ccc23)CC12CCCC2	ZINC000450953927	CG	On-Demand	Anodyne	AKT1	34	44
CCOC(=O)c1ccc(CS(=O)(=O)N2CCN(C)CC2)cc1	ZINC000450953942	EC	On-Demand	Anodyne	Q4Q5W4_LEIMA	19	42
CCOC(=O)c1ccc(CS(=O)(=O)N2CCN(C)CC2)cc1	ZINC000450953942	EC	On-Demand	Anodyne	NOD2	17	41
COc1cc2c(N(C)[C@@H]3CCN(C(C)C)C3)ncnc2cc1F	ZINC000450953943	DF	On-Demand	Anodyne	PDE3A	47	36
COc1cc2c(N(C)[C@@H]3CCN(C(C)C)C3)ncnc2cc1F	ZINC000450953943	DF	On-Demand	Anodyne	PDE3B	69	36
COc1cc2c(N(C)[C@H]3CCN(C(C)C)C3)ncnc2cc1F	ZINC000450953944	DF	On-Demand	Anodyne	PDE3A	47	36
COc1cc2c(N(C)[C@H]3CCN(C(C)C)C3)ncnc2cc1F	ZINC000450953944	DF	On-Demand	Anodyne	PDE3B	69	36
CCOc1cc2nccc(N3CC[C@H](CCCO)C3)c2cc1OCC	ZINC000450953950	EH	On-Demand	Anodyne	PDE3A	46	41
CCOc1cc2nccc(N3CC[C@H](CCCO)C3)c2cc1OCC	ZINC000450953950	EH	On-Demand	Anodyne	PDE3B	69	41
CCOc1cc2nccc(N3CC[C@@H](CCCO)C3)c2cc1OCC	ZINC000450953951	EH	On-Demand	Anodyne	PDE3A	46	41
CCOc1cc2nccc(N3CC[C@@H](CCCO)C3)c2cc1OCC	ZINC000450953951	EH	On-Demand	Anodyne	PDE3B	69	41
OCCC[C@H]1CCN(c2cccc(C(F)(F)F)n2)C1	ZINC000450953952	CF	On-Demand	Anodyne	PRKCQ	0	46
OCCC[C@@H]1CCN(c2cccc(C(F)(F)F)n2)C1	ZINC000450953953	CF	On-Demand	Anodyne	PRKCQ	0	46
CC1(CC(F)(F)F)CN(c2ncnc3sc4c(c23)CCC4)C1	ZINC000450953954	EH	On-Demand	Anodyne	RBP4	21	52
OCCC[C@@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450953958	DG	On-Demand	Anodyne	RBP4	18	42
OCCC[C@H]1CCN(c2ncnc3sc4c(c23)CCCC4)C1	ZINC000450953959	DG	On-Demand	Anodyne	RBP4	18	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	CACNA1B	47	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	SLC6A9	26	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	EPHX2	17	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	MLYCD	20	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	LIPG	50	35
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	SFRP1	46	31
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	WNT3	40	31
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	L3MBTL1	0	44
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450953978	FG	On-Demand	Anodyne	L3MBTL3	61	44
CC[C@@H](CC(C)C)C(=O)N[C@H](C)c1ccc(Cl)cn1	ZINC000450953998	CH	On-Demand	Anodyne	FFAR2	24	40
CC[C@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450953999	CH	On-Demand	Anodyne	FFAR2	24	40
CC[C@@H](CC(C)C)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450954000	CH	On-Demand	Anodyne	FFAR2	24	40
CC[C@H](CC(C)C)C(=O)N[C@H](C)c1ccc(Cl)cn1	ZINC000450954001	CH	On-Demand	Anodyne	FFAR2	24	40
C[C@H](NC(=O)c1nn(C)c2c1CCCC2)c1ccc(Cl)cn1	ZINC000450954003	DF	On-Demand	Anodyne	CNR1	52	32
C[C@@H](NC(=O)c1nn(C)c2c1CCCC2)c1ccc(Cl)cn1	ZINC000450954004	DF	On-Demand	Anodyne	CNR1	52	32
CCCOc1ccc(C(=O)N[C@@H](C)c2cncs2)c(OC)c1	ZINC000450954016	DG	On-Demand	Anodyne	ACACA	38	40
CCCOc1ccc(C(=O)N[C@@H](C)c2cncs2)c(OC)c1	ZINC000450954016	DG	On-Demand	Anodyne	ACACB	17	40
CCC(CC)Oc1ccc(C(=O)N2CC(O)(C3CC3)C2)cc1	ZINC000450954017	DF	On-Demand	Anodyne	L3MBTL3	40	31
CCCCNC(=O)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450954018	CC	On-Demand	Bother	ASAH1	41	31
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450954019	FF	On-Demand	Bother	KCNMA1	19	46
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450954020	FF	On-Demand	Bother	KCNMA1	19	46
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1cccc(F)c1	ZINC000450954031	DH	On-Demand	Anodyne	OPRM1	15	44
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1cccc(F)c1	ZINC000450954031	DH	On-Demand	Anodyne	CHRNA10	60	47
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1cccc(F)c1	ZINC000450954032	DH	On-Demand	Anodyne	OPRM1	15	44
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1cccc(F)c1	ZINC000450954032	DH	On-Demand	Anodyne	CHRNA10	60	47
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1cccc(F)c1	ZINC000450954033	DH	On-Demand	Anodyne	OPRM1	15	44
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1cccc(F)c1	ZINC000450954033	DH	On-Demand	Anodyne	CHRNA10	60	47
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1cccc(F)c1	ZINC000450954034	DH	On-Demand	Anodyne	OPRM1	15	44
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1cccc(F)c1	ZINC000450954034	DH	On-Demand	Anodyne	CHRNA10	60	47
COc1nccc(CS(=O)(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n1	ZINC000450954043	GD	On-Demand	Anodyne	PKM	30	44
CO[C@H](CS(=O)(=O)N1c2ccccc2C[C@@H]1C)c1ccccc1	ZINC000450954052	EG	On-Demand	Anodyne	GLMU	0	42
CO[C@@H](CS(=O)(=O)N1c2ccccc2C[C@H]1C)c1ccccc1	ZINC000450954053	EG	On-Demand	Anodyne	GLMU	0	42
CO[C@@H](CS(=O)(=O)N1c2ccccc2C[C@@H]1C)c1ccccc1	ZINC000450954054	EG	On-Demand	Anodyne	GLMU	0	42
CO[C@H](CS(=O)(=O)N1c2ccccc2C[C@H]1C)c1ccccc1	ZINC000450954055	EG	On-Demand	Anodyne	GLMU	0	42
COc1ccc(C(=O)N[C@@H](C)c2ccc(Cl)cn2)cc1S(C)(=O)=O	ZINC000450954056	FF	On-Demand	Anodyne	COLA	89	39
COc1ccc(C(=O)N[C@@H](C)c2ccc(Cl)cn2)cc1S(C)(=O)=O	ZINC000450954056	FF	On-Demand	Anodyne	CPT1A	50	34
COc1ccc(C(=O)N[C@@H](C)c2ccc(Cl)cn2)cc1S(C)(=O)=O	ZINC000450954056	FF	On-Demand	Anodyne	CPT2	46	37
COc1ccc(C(=O)N[C@@H](C)c2ccc(Cl)cn2)cc1S(C)(=O)=O	ZINC000450954056	FF	On-Demand	Anodyne	CPT1B	81	36
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)on1	ZINC000450954057	GH	On-Demand	Anodyne	PRCP	39	56
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)on1	ZINC000450954057	GH	On-Demand	Anodyne	COLA	125	45
CCOC(=O)c1cc(C(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)on1	ZINC000450954057	GH	On-Demand	Anodyne	CPT1A	118	45
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)on1	ZINC000450954058	GH	On-Demand	Anodyne	PRCP	39	56
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)on1	ZINC000450954058	GH	On-Demand	Anodyne	COLA	125	45
CCOC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)on1	ZINC000450954058	GH	On-Demand	Anodyne	CPT1A	118	45
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000450954077	DH	On-Demand	Anodyne	HRH3	48	38
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000450954077	DH	On-Demand	Anodyne	ABCC1	57	32
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000450954078	DH	On-Demand	Anodyne	HRH3	48	38
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000450954078	DH	On-Demand	Anodyne	ABCC1	57	32
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000450954079	DH	On-Demand	Anodyne	HRH3	48	38
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000450954079	DH	On-Demand	Anodyne	ABCC1	57	32
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000450954080	DH	On-Demand	Anodyne	HRH3	48	38
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000450954080	DH	On-Demand	Anodyne	ABCC1	57	32
O=S(=O)(NC[C@H]1CCCO1)c1ccc2ccccc2c1F	ZINC000450954083	DE	On-Demand	Anodyne	TNK2	46	37
O=S(=O)(NC[C@@H]1CCCO1)c1ccc2ccccc2c1F	ZINC000450954084	DE	On-Demand	Anodyne	TNK2	46	37
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954139	FE	On-Demand	Anodyne	HTR1A	30	42
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954139	FE	On-Demand	Anodyne	DRD2	23	47
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954139	FE	On-Demand	Anodyne	HTR2A	22	40
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954139	FE	On-Demand	Anodyne	DRD3	29	47
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954139	FE	On-Demand	Anodyne	HTR7	39	40
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954140	FE	On-Demand	Anodyne	HTR1A	30	42
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954140	FE	On-Demand	Anodyne	DRD2	23	47
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954140	FE	On-Demand	Anodyne	HTR2A	22	40
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954140	FE	On-Demand	Anodyne	DRD3	29	47
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450954140	FE	On-Demand	Anodyne	HTR7	39	40
COC(=O)[C@H](NC(=O)C[C@@H]1CC[C@H]2C[C@@H]12)c1ccc(OC)c(Cl)c1	ZINC000450954146	FG	On-Demand	Anodyne	PDE6A	41	32
COC(=O)[C@H](NC(=O)C[C@@H]1CC[C@@H]2C[C@H]12)c1ccc(OC)c(Cl)c1	ZINC000450954147	FG	On-Demand	Anodyne	PDE6A	41	32
COC(=O)[C@H](NC(=O)C[C@@H]1CC[C@H]2C[C@H]12)c1ccc(OC)c(Cl)c1	ZINC000450954148	FG	On-Demand	Anodyne	PDE6A	41	32
COC(=O)[C@H](NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]12)c1ccc(OC)c(Cl)c1	ZINC000450954149	FG	On-Demand	Anodyne	PDE6A	41	32
CN1CCN(CCC(C)(C)NC(=O)c2ccn(CCc3ccccc3)n2)CC1	ZINC000450954155	GE	On-Demand	Anodyne	SIGMAR1	26	43
CCc1ccc(S(C)(=O)=O)cc1C(=O)NC(C)(C)CF	ZINC000450954159	DE	On-Demand	Anodyne	LOX1.1	40	33
CCc1ccc(S(C)(=O)=O)cc1C(=O)NC(C)(C)CF	ZINC000450954159	DE	On-Demand	Anodyne	O49150_SOLTU	47	33
Cc1cc(C)c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954170	GG	On-Demand	Anodyne	PRTN3	45	33
Cc1cc(C)c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954170	GG	On-Demand	Anodyne	FFAR4	41	54
Cc1cc(C)c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954170	GG	On-Demand	Anodyne	LUXN	0	51
Cc1cc(C)c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954170	GG	On-Demand	Anodyne	ADIPOR1	0	41
Cc1cc(C)c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954170	GG	On-Demand	Anodyne	ADIPOR2	0	41
CC(C)(CF)NC(=O)c1ccc(I)cc1F	ZINC000450954174	EF	On-Demand	Anodyne	MAP2K1	40	34
Cc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c(C)c1	ZINC000450954175	DH	On-Demand	Anodyne	FFAR4	37	50
C[C@H]1CN(CCO)CCN1c1ccnc(Cc2ccccc2)n1	ZINC000450954206	DD	On-Demand	Anodyne	SORD	58	37
C[C@@H]1CN(CCO)CCN1c1ccnc(Cc2ccccc2)n1	ZINC000450954207	DD	On-Demand	Anodyne	SORD	58	37
COc1ccccc1[C@@H](CNC(=O)c1c(C)cccc1Cl)OC(C)C	ZINC000450954212	FJ	On-Demand	Anodyne	ECR	26	43
COc1ccccc1[C@H](CNC(=O)c1c(C)cccc1Cl)OC(C)C	ZINC000450954213	FJ	On-Demand	Anodyne	ECR	26	43
C[C@H]1CN(CCO)CCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450954220	FF	On-Demand	Anodyne	ADRB3	31	47
C[C@@H]1CN(CCO)CCN1c1ncnc2scc(-c3ccccc3)c12	ZINC000450954221	FF	On-Demand	Anodyne	ADRB3	31	47
CC(C)c1nccc(N2CC(C)(CC(F)(F)F)C2)n1	ZINC000450954238	CG	On-Demand	Anodyne	SORD	57	41
OCCC[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450954239	CG	On-Demand	Anodyne	LUCI_LUCLA	18	42
OCCC[C@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000450954240	CG	On-Demand	Anodyne	LUCI_LUCLA	18	42
OCCC[C@@H]1CCN(c2ccnc3ccccc23)C1	ZINC000450954243	CF	On-Demand	Anodyne	HNMT	41	34
OCCC[C@H]1CCN(c2ccnc3ccccc23)C1	ZINC000450954244	CF	On-Demand	Anodyne	HNMT	41	34
CC(C)C[C@H](C)S(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450954282	FF	On-Demand	Anodyne	AKR1C3	52	35
CC(C)C[C@@H](C)S(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450954283	FF	On-Demand	Anodyne	AKR1C3	52	35
CN(CC1(c2ccccc2)CC1)C(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450954284	CG	On-Demand	Anodyne	KCNA3	24	42
C[C@@H](NC(=O)c1ccc2cnccc2c1)C1CCN(CC(F)(F)F)CC1	ZINC000450954287	FH	On-Demand	Anodyne	AKT1	26	57
C[C@@H](NC(=O)c1ccc2cnccc2c1)C1CCN(CC(F)(F)F)CC1	ZINC000450954287	FH	On-Demand	Anodyne	HPGDS	38	45
C[C@H](NC(=O)c1ccc2cnccc2c1)C1CCN(CC(F)(F)F)CC1	ZINC000450954288	FH	On-Demand	Anodyne	AKT1	26	57
C[C@H](NC(=O)c1ccc2cnccc2c1)C1CCN(CC(F)(F)F)CC1	ZINC000450954288	FH	On-Demand	Anodyne	HPGDS	38	45
CSc1cccc(C(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)c1	ZINC000450954297	FH	On-Demand	Anodyne	HPGDS	33	40
CSc1cccc(C(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)c1	ZINC000450954298	FH	On-Demand	Anodyne	HPGDS	33	40
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1Cc1nc(-c2cccc(Cl)c2)no1	ZINC000450954321	GI	On-Demand	Anodyne	GRM5	27	49
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1Cc1nc(-c2cccc(Cl)c2)no1	ZINC000450954322	GI	On-Demand	Anodyne	GRM5	27	49
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1Cc1nc(-c2cccc(Cl)c2)no1	ZINC000450954323	GI	On-Demand	Anodyne	GRM5	27	49
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1Cc1nc(-c2cccc(Cl)c2)no1	ZINC000450954324	GI	On-Demand	Anodyne	GRM5	27	49
CCC(=O)C1(C(=O)N(C)CC2(c3ccccc3)CC2)CC1	ZINC000450954329	CF	On-Demand	Anodyne	KCNA3	24	45
CCOC(=O)[C@H](NC(=O)[C@H]1CCC(=O)N1C)c1cccc(C)c1C	ZINC000450954341	ED	On-Demand	Anodyne	P2RX7	22	45
CCOC(=O)[C@H](NC(=O)[C@@H]1CCC(=O)N1C)c1cccc(C)c1C	ZINC000450954342	ED	On-Demand	Anodyne	P2RX7	22	45
CCOC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)c1cccc(C)c1C	ZINC000450954343	ED	On-Demand	Anodyne	P2RX7	22	45
CCOC(=O)[C@@H](NC(=O)[C@H]1CCC(=O)N1C)c1cccc(C)c1C	ZINC000450954344	ED	On-Demand	Anodyne	P2RX7	22	45
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954349	GI	On-Demand	Anodyne	MTTP	49	32
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954349	GI	On-Demand	Anodyne	CCR2	94	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954349	GI	On-Demand	Anodyne	LIPG	51	38
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954350	GI	On-Demand	Anodyne	MTTP	49	32
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954350	GI	On-Demand	Anodyne	CCR2	94	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954350	GI	On-Demand	Anodyne	LIPG	51	38
O=C(NCC1(CO)CCCC1)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000450954370	EE	On-Demand	Bother	NMBR	54	33
C[C@@H](Oc1ccccn1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954371	FF	On-Demand	Anodyne	HPGDS	33	40
C[C@@H](Oc1ccccn1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954371	FF	On-Demand	Anodyne	CCL5	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954372	FF	On-Demand	Anodyne	HPGDS	33	40
C[C@H](Oc1ccccn1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954372	FF	On-Demand	Anodyne	CCL5	0	40
C[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C1CCN(CC(F)(F)F)CC1	ZINC000450954373	FF	On-Demand	Anodyne	HPGDS	33	40
C[C@H](NC(=O)[C@@H](C)Oc1ccccn1)C1CCN(CC(F)(F)F)CC1	ZINC000450954373	FF	On-Demand	Anodyne	CCL5	0	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954374	FF	On-Demand	Anodyne	HPGDS	33	40
C[C@H](Oc1ccccn1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450954374	FF	On-Demand	Anodyne	CCL5	0	40
CN(c1ccccc1)S(=O)(=O)CCC1CCCC1	ZINC000450954376	CG	On-Demand	Anodyne	AMY2	45	32
O=S(=O)(NCCCN1CCOCC1)c1sccc1Cl	ZINC000450954383	DD	On-Demand	Anodyne	CCR1	19	45
N#CCc1ccc(S(=O)(=O)NCCCN2CCOCC2)c(Cl)c1	ZINC000450954388	FD	On-Demand	Mild	HTR7	29	40
N#CCc1ccc(S(=O)(=O)NCCCN2CCOCC2)c(Cl)c1	ZINC000450954388	FD	On-Demand	Mild	CCR1	17	48
Cc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450954389	EF	On-Demand	Anodyne	PPIA	26	44
Cc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450954389	EF	On-Demand	Anodyne	CA1	26	41
Cc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450954389	EF	On-Demand	Anodyne	CA4	25	43
Cc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450954389	EF	On-Demand	Anodyne	PFK	0	43
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954395	FF	On-Demand	Anodyne	PRTN3	55	35
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954395	FF	On-Demand	Anodyne	ADAMTS4	26	40
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954395	FF	On-Demand	Anodyne	FFAR4	31	40
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450954395	FF	On-Demand	Anodyne	LUXN	0	46
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954396	EI	On-Demand	Anodyne	SLC6A1	43	35
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954396	EI	On-Demand	Anodyne	PREP	22	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954396	EI	On-Demand	Anodyne	CYP2J2	54	38
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954397	EI	On-Demand	Anodyne	SLC6A1	43	35
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954397	EI	On-Demand	Anodyne	PREP	22	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954397	EI	On-Demand	Anodyne	CYP2J2	54	38
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954398	EI	On-Demand	Anodyne	SLC6A1	43	35
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954398	EI	On-Demand	Anodyne	PREP	22	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954398	EI	On-Demand	Anodyne	CYP2J2	54	38
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954399	EI	On-Demand	Anodyne	SLC6A1	43	35
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954399	EI	On-Demand	Anodyne	PREP	22	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccccc1	ZINC000450954399	EI	On-Demand	Anodyne	CYP2J2	54	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	CA2	16	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	LPL	55	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	HTR7	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	KCNQ2	22	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	MMP13	34	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	NPY2R	36	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	PRNP	51	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	MMP2	28	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	EPHX2	19	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	TGM2	85	67
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	F13A1	125	67
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	RAC1	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	RORC	22	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450954400	GF	On-Demand	Anodyne	NAMPT	39	46
CN(CC1(c2ccccc2)CC1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450954401	FH	On-Demand	Bother	CACNA1D	43	32
COc1ccc(S(=O)(=O)CCC(C)(F)F)cc1	ZINC000450954411	CF	On-Demand	Anodyne	MMP13	28	58
COc1ccc(S(=O)(=O)CCC(C)(F)F)cc1	ZINC000450954411	CF	On-Demand	Anodyne	MMP2	25	41
COc1ccc(S(=O)(=O)CCC(C)(F)F)cc1	ZINC000450954411	CF	On-Demand	Anodyne	MMP9	31	44
COc1ccc(S(=O)(=O)CCC(C)(F)F)cc1	ZINC000450954411	CF	On-Demand	Anodyne	MMP1	30	41
COc1cccc2c1nc(NC(=O)c1ccc(C)nc1C(C)C)n2C	ZINC000450954424	EH	On-Demand	Anodyne	KCNK3	32	41
COc1cccc2c1nc(NC(=O)c1ccc(C)nc1C(C)C)n2C	ZINC000450954424	EH	On-Demand	Anodyne	KCNK9	29	41
CCOC(=O)c1cc(S(=O)(=O)N2CCCC[C@H]2CC)cnc1C(F)F	ZINC000450954426	GG	On-Demand	Anodyne	CASP3	91	36
CCOC(=O)c1cc(S(=O)(=O)N2CCCC[C@H]2CC)cnc1C(F)F	ZINC000450954426	GG	On-Demand	Anodyne	CASP7	97	36
CCOC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2CC)cnc1C(F)F	ZINC000450954427	GG	On-Demand	Anodyne	CASP3	91	36
CCOC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2CC)cnc1C(F)F	ZINC000450954427	GG	On-Demand	Anodyne	CASP7	97	36
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	CA2	21	52
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	PPIA	25	42
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	CA1	25	41
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	MMP13	23	42
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	BDKRB1	0	45
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	CA4	21	40
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	GRM4	20	41
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	CA14	15	44
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	MMP2	16	41
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	RCE1	0	45
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	PRTN3	53	34
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	CA12	19	41
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	CA9	19	41
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	LEF	40	33
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	PFK	0	40
Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450954428	EH	On-Demand	Anodyne	LIMK2	18	40
CCCCc1nnc(NC(=O)CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)s1	ZINC000450954433	GG	On-Demand	Anodyne	GLS	0	40
CCCCc1nnc(NC(=O)CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)s1	ZINC000450954434	GG	On-Demand	Anodyne	GLS	0	40
CCCCc1nnc(NC(=O)CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)s1	ZINC000450954435	GG	On-Demand	Anodyne	GLS	0	40
CCCCc1nnc(NC(=O)CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)s1	ZINC000450954436	GG	On-Demand	Anodyne	GLS	0	40
O=C(COc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1)NC1CC1	ZINC000450954437	GE	On-Demand	Anodyne	TBXA2R	50	37
O=C(COc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1)NC1CC1	ZINC000450954437	GE	On-Demand	Anodyne	MMP2	15	40
O=C(COc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1)NC1CC1	ZINC000450954437	GE	On-Demand	Anodyne	MMP14	18	40
O=C(COc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1)NC1CC1	ZINC000450954437	GE	On-Demand	Anodyne	TRAR	32	47
O=C(COc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1)NC1CC1	ZINC000450954437	GE	On-Demand	Anodyne	LUXN	0	42
O=C(COc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1)NC1CC1	ZINC000450954437	GE	On-Demand	Anodyne	ADIPOR1	0	45
O=C(COc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1)NC1CC1	ZINC000450954437	GE	On-Demand	Anodyne	ADIPOR2	0	45
COc1nccc(COc2ccc3c(c2)CCNC3=O)n1	ZINC000450954444	CD	On-Demand	Anodyne	CSNK1D	29	43
COc1nccc(COc2ccc3c(c2)CCNC3=O)n1	ZINC000450954444	CD	On-Demand	Anodyne	CSNK1G2	69	43
CCCOc1cccc(COc2ccc3c(c2)CCNC3=O)c1	ZINC000450954446	DG	On-Demand	Anodyne	MAOA	26	47
CCCOc1cccc(COc2ccc3c(c2)CCNC3=O)c1	ZINC000450954446	DG	On-Demand	Anodyne	UPP1	45	38
CCCOc1cccc(COc2ccc3c(c2)CCNC3=O)c1	ZINC000450954446	DG	On-Demand	Anodyne	DFRA17	0	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCCN2CCOCC2)c1	ZINC000450954447	GD	On-Demand	Anodyne	HTR7	21	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCCN2CCOCC2)c1	ZINC000450954447	GD	On-Demand	Anodyne	CCR1	16	40
COC(=O)c1ncccc1S(=O)(=O)N1C[C@@]2(C)C[C@H]1CC(C)(C)C2	ZINC000450954465	FE	On-Demand	Anodyne	AVPR2	17	41
CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1cccc(C)c1C	ZINC000450954474	FF	On-Demand	Anodyne	TRPV1	40	49
CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1cccc(C)c1C	ZINC000450954474	FF	On-Demand	Anodyne	NCE103	30	40
CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1cccc(C)c1C	ZINC000450954474	FF	On-Demand	Anodyne	CAN2	0	40
CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1cccc(C)c1C	ZINC000450954475	FF	On-Demand	Anodyne	TRPV1	40	49
CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1cccc(C)c1C	ZINC000450954475	FF	On-Demand	Anodyne	NCE103	30	40
CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1cccc(C)c1C	ZINC000450954475	FF	On-Demand	Anodyne	CAN2	0	40
COC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(OC)c(O)c1	ZINC000450954482	FD	On-Demand	Anodyne	ENPP2	15	40
COC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc(OC)c(O)c1	ZINC000450954483	FD	On-Demand	Anodyne	ENPP2	15	40
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450954490	ED	On-Demand	Anodyne	MCHR1	0	40
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H](C)OCCc2ccccc2)CC1	ZINC000450954491	ED	On-Demand	Anodyne	MCHR1	0	40
C[C@H](O)CN(C)C1CCN(C(=O)[C@H](C)OCCc2ccccc2)CC1	ZINC000450954492	ED	On-Demand	Anodyne	MCHR1	0	40
C[C@H](OCCc1ccccc1)C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450954493	ED	On-Demand	Anodyne	MCHR1	0	40
COc1cc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)ccc1Cl	ZINC000450954502	EH	On-Demand	Anodyne	DRD4	27	48
COc1cc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)ccc1Cl	ZINC000450954502	EH	On-Demand	Anodyne	SSTR5	68	42
COc1cc(CN2CC[C@H](c3nc(C4CC4)no3)C2)ccc1Cl	ZINC000450954503	EH	On-Demand	Anodyne	DRD4	27	48
COc1cc(CN2CC[C@H](c3nc(C4CC4)no3)C2)ccc1Cl	ZINC000450954503	EH	On-Demand	Anodyne	SSTR5	68	42
COc1ccc(Oc2ccc(C(=O)N3CCC(N(C)C[C@H](C)O)CC3)nc2)cc1	ZINC000450954504	GF	On-Demand	Anodyne	TRPC6	46	41
COc1ccc(Oc2ccc(C(=O)N3CCC(N(C)C[C@H](C)O)CC3)nc2)cc1	ZINC000450954504	GF	On-Demand	Anodyne	TRPC3	22	41
COc1ccc(Oc2ccc(C(=O)N3CCC(N(C)C[C@@H](C)O)CC3)nc2)cc1	ZINC000450954505	GF	On-Demand	Anodyne	TRPC6	46	41
COc1ccc(Oc2ccc(C(=O)N3CCC(N(C)C[C@@H](C)O)CC3)nc2)cc1	ZINC000450954505	GF	On-Demand	Anodyne	TRPC3	22	41
COc1ccc(-c2ccnc(N3CC[C@H](CCCO)C3)n2)cc1	ZINC000450954528	DF	On-Demand	Anodyne	DKK1	0	48
COc1ccc(-c2ccnc(N3CC[C@@H](CCCO)C3)n2)cc1	ZINC000450954529	DF	On-Demand	Anodyne	DKK1	0	48
Cn1c(N2CC[C@@H](CCCO)C2)nc2ccc(F)cc21	ZINC000450954530	CE	On-Demand	Anodyne	HRH1	16	40
Cn1c(N2CC[C@H](CCCO)C2)nc2ccc(F)cc21	ZINC000450954531	CE	On-Demand	Anodyne	HRH1	16	40
OCCC[C@@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450954536	GF	On-Demand	Anodyne	PDE3B	49	31
OCCC[C@@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450954536	GF	On-Demand	Anodyne	SIRT3	52	32
OCCC[C@@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450954536	GF	On-Demand	Anodyne	SIRT2	44	32
OCCC[C@@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450954536	GF	On-Demand	Anodyne	SIRT1	41	32
OCCC[C@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450954537	GF	On-Demand	Anodyne	PDE3B	49	31
OCCC[C@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450954537	GF	On-Demand	Anodyne	SIRT3	52	32
OCCC[C@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450954537	GF	On-Demand	Anodyne	SIRT2	44	32
OCCC[C@H]1CCN(c2ncnc3cccc(I)c23)C1	ZINC000450954537	GF	On-Demand	Anodyne	SIRT1	41	32
CC(=O)NC[C@H](CC(=O)Nc1cccc(C)c1Br)CC(C)C	ZINC000450954546	FH	On-Demand	Anodyne	ANPEP	19	40
COc1cc(CC(=O)N(C)C[C@@H]2C[C@H](F)CN2c2ccncn2)ccc1Cl	ZINC000450954594	GF	On-Demand	Anodyne	ITGA4	46	37
CC(=O)c1cccc(CN2C(=O)N[C@](C)(C3CCCC3)C2=O)c1	ZINC000450954603	DF	On-Demand	Anodyne	CCR3	16	40
CC(=O)c1cccc(CN2C(=O)N[C@@](C)(C3CCCC3)C2=O)c1	ZINC000450954604	DF	On-Demand	Anodyne	CCR3	16	40
Cc1cc(N2CCN(CCO)C[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450954607	FD	On-Demand	Bother	KCNJ1	24	43
Cc1cc(N2CCN(CCO)C[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450954608	FD	On-Demand	Bother	KCNJ1	24	43
CNS(=O)(=O)NCC(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450954610	FC	On-Demand	Anodyne	NPFFR2	25	41
CNS(=O)(=O)NCC(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450954610	FC	On-Demand	Anodyne	NPFFR1	43	41
C[C@@H]1CN(CCO)CCN1c1ncnc2ccc(I)cc12	ZINC000450954623	GD	On-Demand	Anodyne	HTT	0	41
C[C@H]1CN(CCO)CCN1c1ncnc2ccc(I)cc12	ZINC000450954624	GD	On-Demand	Anodyne	HTT	0	41
CC1(CC(F)(F)F)CN(c2ccc(C(F)(F)F)cn2)C1	ZINC000450954627	CH	On-Demand	Anodyne	ADAM33	0	41
C[C@@H]1CN(CCO)CCN1c1ccc(S(=O)(=O)C(C)(C)C)nc1	ZINC000450954629	ED	On-Demand	Anodyne	GCKR	46	33
C[C@H]1CN(CCO)CCN1c1ccc(S(=O)(=O)C(C)(C)C)nc1	ZINC000450954630	ED	On-Demand	Anodyne	GCKR	46	33
COC(=O)[C@@H](NC(=O)[C@H]1Cc2c(C)cccc2O1)c1ccc(OC)cc1OC	ZINC000450954637	GE	On-Demand	Anodyne	MT-ND4	42	33
COC(=O)[C@@H](NC(=O)[C@@H]1Cc2c(C)cccc2O1)c1ccc(OC)cc1OC	ZINC000450954638	GE	On-Demand	Anodyne	MT-ND4	42	33
COC(=O)[C@H](NC(=O)[C@@H]1Cc2c(C)cccc2O1)c1ccc(OC)cc1OC	ZINC000450954639	GE	On-Demand	Anodyne	MT-ND4	42	33
COC(=O)[C@H](NC(=O)[C@H]1Cc2c(C)cccc2O1)c1ccc(OC)cc1OC	ZINC000450954640	GE	On-Demand	Anodyne	MT-ND4	42	33
C[C@@H]1CN(CCO)CCN1c1nc(-c2ccccc2F)cs1	ZINC000450954668	DE	On-Demand	Anodyne	GABRA3	54	36
C[C@H]1CN(CCO)CCN1c1nc(-c2ccccc2F)cs1	ZINC000450954669	DE	On-Demand	Anodyne	GABRA3	54	36
CCOC(=O)c1cc(S(=O)(=O)N2CCCc3ccccc32)cnc1C(F)F	ZINC000450954682	GG	On-Demand	Anodyne	GPR119	0	45
COc1ccccc1NC(=O)[C@H](C)n1cc([N+](=O)[O-])c(C)n1	ZINC000450954690	DE	On-Demand	Bother	COLA	46	32
COc1ccccc1NC(=O)[C@@H](C)n1cc([N+](=O)[O-])c(C)n1	ZINC000450954691	DE	On-Demand	Bother	COLA	46	32
CC(=O)N[C@H](C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1)C(C)(C)C	ZINC000450954692	FE	On-Demand	Anodyne	PROTEASE	15	41
CC(=O)N[C@H](C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1)C(C)(C)C	ZINC000450954693	FE	On-Demand	Anodyne	PROTEASE	15	41
CCOC(=O)c1ccc(C(=O)Cn2cc([N+](=O)[O-])c(C)n2)cc1	ZINC000450954694	DE	On-Demand	Bother	GSTM2	25	46
C[C@@H](CCN1CCN(C)CC1)NC(=O)Cc1cc2ccccc2s1	ZINC000450954700	EF	On-Demand	Anodyne	TACR2	43	37
C[C@H](CCN1CCN(C)CC1)NC(=O)Cc1cc2ccccc2s1	ZINC000450954701	EF	On-Demand	Anodyne	TACR2	43	37
COc1cccc(CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1	ZINC000450954704	DH	On-Demand	Anodyne	OPRM1	26	46
COc1cccc(CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1	ZINC000450954704	DH	On-Demand	Anodyne	OPRD1	24	46
COc1cccc(CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1	ZINC000450954704	DH	On-Demand	Anodyne	OPRK1	34	46
COc1cccc(CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1	ZINC000450954704	DH	On-Demand	Anodyne	SIGMAR1	23	44
COc1cccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1	ZINC000450954705	DH	On-Demand	Anodyne	OPRM1	26	46
COc1cccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1	ZINC000450954705	DH	On-Demand	Anodyne	OPRD1	24	46
COc1cccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1	ZINC000450954705	DH	On-Demand	Anodyne	OPRK1	34	46
COc1cccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1	ZINC000450954705	DH	On-Demand	Anodyne	SIGMAR1	23	44
COc1cccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1	ZINC000450954706	DH	On-Demand	Anodyne	OPRM1	26	46
COc1cccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1	ZINC000450954706	DH	On-Demand	Anodyne	OPRD1	24	46
COc1cccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1	ZINC000450954706	DH	On-Demand	Anodyne	OPRK1	34	46
COc1cccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1	ZINC000450954706	DH	On-Demand	Anodyne	SIGMAR1	23	44
COc1cccc(CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1	ZINC000450954707	DH	On-Demand	Anodyne	OPRM1	26	46
COc1cccc(CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1	ZINC000450954707	DH	On-Demand	Anodyne	OPRD1	24	46
COc1cccc(CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1	ZINC000450954707	DH	On-Demand	Anodyne	OPRK1	34	46
COc1cccc(CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1	ZINC000450954707	DH	On-Demand	Anodyne	SIGMAR1	23	44
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1Cc1ccc(F)cc1	ZINC000450954714	CH	On-Demand	Anodyne	SLC18A3	15	43
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1Cc1ccc(F)cc1	ZINC000450954715	CH	On-Demand	Anodyne	SLC18A3	15	43
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1Cc1ccc(F)cc1	ZINC000450954716	CH	On-Demand	Anodyne	SLC18A3	15	43
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1Cc1ccc(F)cc1	ZINC000450954717	CH	On-Demand	Anodyne	SLC18A3	15	43
C[C@@H](NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)c1ccc(Cl)cn1	ZINC000450954742	FJ	On-Demand	Anodyne	PRCP	52	38
C[C@H](NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1ccc(Cl)cn1	ZINC000450954743	FJ	On-Demand	Anodyne	PRCP	52	38
C[C@@H](NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)c1ccc(Cl)cn1	ZINC000450954744	FJ	On-Demand	Anodyne	PRCP	52	38
C[C@H](NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)c1ccc(Cl)cn1	ZINC000450954745	FJ	On-Demand	Anodyne	PRCP	52	38
C[C@@H](NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1ccc(Cl)cn1	ZINC000450954746	FJ	On-Demand	Anodyne	PRCP	52	38
C[C@H](NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)c1ccc(Cl)cn1	ZINC000450954747	FJ	On-Demand	Anodyne	PRCP	52	38
C[C@@H](NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1ccc(Cl)cn1	ZINC000450954748	FJ	On-Demand	Anodyne	PRCP	52	38
C[C@H](NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1ccc(Cl)cn1	ZINC000450954749	FJ	On-Demand	Anodyne	PRCP	52	38
C[C@@H](NC(=O)c1cc2ccncc2s1)C1CCN(CC(F)(F)F)CC1	ZINC000450954751	FH	On-Demand	Anodyne	TACR2	41	34
C[C@@H](NC(=O)c1cc2ccncc2s1)C1CCN(CC(F)(F)F)CC1	ZINC000450954751	FH	On-Demand	Anodyne	NAMPT	15	42
C[C@H](NC(=O)c1cc2ccncc2s1)C1CCN(CC(F)(F)F)CC1	ZINC000450954752	FH	On-Demand	Anodyne	TACR2	41	34
C[C@H](NC(=O)c1cc2ccncc2s1)C1CCN(CC(F)(F)F)CC1	ZINC000450954752	FH	On-Demand	Anodyne	NAMPT	15	42
COc1cc(CC(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450954757	GH	On-Demand	Anodyne	HTR4	48	36
COc1cc(CC(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450954757	GH	On-Demand	Anodyne	CCR3	27	41
COc1cc(CC(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450954758	GH	On-Demand	Anodyne	HTR4	48	36
COc1cc(CC(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450954758	GH	On-Demand	Anodyne	CCR3	27	41
Cc1cccc(Cl)c1C(=O)N[C@@H](C)CCN1CCN(C)CC1	ZINC000450954759	DE	On-Demand	Anodyne	DRD4	45	36
Cc1cccc(Cl)c1C(=O)N[C@H](C)CCN1CCN(C)CC1	ZINC000450954760	DE	On-Demand	Anodyne	DRD4	45	36
CO[C@@H](Cc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450954768	CD	On-Demand	Anodyne	ACE	56	35
CO[C@@H](Cc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450954768	CD	On-Demand	Anodyne	MME	46	37
CO[C@H](Cc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450954769	CD	On-Demand	Anodyne	ACE	56	35
CO[C@H](Cc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450954769	CD	On-Demand	Anodyne	MME	46	37
CO[C@H](Cc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450954769	CD	On-Demand	Anodyne	AGTR2	40	32
CN1CCN(CCC(C)(C)NC(=O)c2cncc(Cl)c2)CC1	ZINC000450954781	DD	On-Demand	Anodyne	CACNA1I	52	42
O=S(=O)(c1ccc2ccccc2c1F)N1CCCC1	ZINC000450954789	CF	On-Demand	Anodyne	PKM	16	40
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	ADRB2	42	43
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	ADRB1	32	47
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	ADRB3	43	43
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	KCNA5	24	40
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	PRTN3	45	32
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	ADAMTS4	41	33
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	LIMK2	45	43
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	LUXN	0	47
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	ADIPOR1	0	43
CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450954808	FF	On-Demand	Anodyne	ADIPOR2	0	43
CN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450954817	FE	On-Demand	Anodyne	MMP13	39	41
CN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450954817	FE	On-Demand	Anodyne	MMP2	23	41
CN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450954817	FE	On-Demand	Anodyne	MMP3	26	45
CN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450954817	FE	On-Demand	Anodyne	MMP9	25	41
CN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450954817	FE	On-Demand	Anodyne	EPHX2	28	42
CN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450954817	FE	On-Demand	Anodyne	MMP1	24	41
O=S(=O)(CC1CC(F)(F)C1)N1CCN(Cc2ccccc2)CC1	ZINC000450954818	EE	On-Demand	Anodyne	SIGMAR1	66	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1	ZINC000450954830	EG	On-Demand	Anodyne	COLA	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1	ZINC000450954830	EG	On-Demand	Anodyne	CPT1A	29	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1	ZINC000450954830	EG	On-Demand	Anodyne	TGM2	57	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1	ZINC000450954830	EG	On-Demand	Anodyne	F13A1	94	38
COC(=O)[C@@H](NC(=O)CCCC(=O)C(C)(C)C)c1ccc(OC)c(Cl)c1	ZINC000450954857	GG	On-Demand	Anodyne	PDE6A	42	35
COC(=O)[C@H](NC(=O)CCCC(=O)C(C)(C)C)c1ccc(OC)c(Cl)c1	ZINC000450954858	GG	On-Demand	Anodyne	PDE6A	42	35
COc1cccc2c(N3CC[C@H](CCCO)C3)c(C)cnc12	ZINC000450954861	DG	On-Demand	Anodyne	PDE3B	56	33
COc1cccc2c(N3CC[C@@H](CCCO)C3)c(C)cnc12	ZINC000450954863	DG	On-Demand	Anodyne	PDE3B	56	33
O=C(COc1ccc(S(=O)(=O)NCCCN2CCOCC2)cc1)NC1CC1	ZINC000450954866	GC	On-Demand	Anodyne	AVPR1B	21	40
O=C(COc1ccc(S(=O)(=O)NCCCN2CCOCC2)cc1)NC1CC1	ZINC000450954866	GC	On-Demand	Anodyne	HTR7	37	44
O=C(COc1ccc(S(=O)(=O)NCCCN2CCOCC2)cc1)NC1CC1	ZINC000450954866	GC	On-Demand	Anodyne	HRH3	21	48
O=C(COc1ccc(S(=O)(=O)NCCCN2CCOCC2)cc1)NC1CC1	ZINC000450954866	GC	On-Demand	Anodyne	EPHX2	27	50
O=C(COc1ccc(S(=O)(=O)NCCCN2CCOCC2)cc1)NC1CC1	ZINC000450954866	GC	On-Demand	Anodyne	ADIPOR1	0	44
O=C(COc1ccc(S(=O)(=O)NCCCN2CCOCC2)cc1)NC1CC1	ZINC000450954866	GC	On-Demand	Anodyne	ADIPOR2	0	44
CSc1cccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)c1	ZINC000450954878	DE	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)c1	ZINC000450954878	DE	On-Demand	Anodyne	L3MBTL3	46	42
CSc1cccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)c1	ZINC000450954879	DE	On-Demand	Anodyne	L3MBTL1	0	42
CSc1cccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)c1	ZINC000450954879	DE	On-Demand	Anodyne	L3MBTL3	46	42
Cc1cc(OCC[C@@H]2CCOC2)c(Cl)cc1[N+](=O)[O-]	ZINC000450954883	CG	On-Demand	Bother	S1PR4	0	40
Cc1cc(OCC[C@H]2CCOC2)c(Cl)cc1[N+](=O)[O-]	ZINC000450954885	CG	On-Demand	Bother	S1PR4	0	40
CC[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450954886	DF	On-Demand	Anodyne	FKBP1A	42	38
CC[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450954888	DF	On-Demand	Anodyne	FKBP1A	42	38
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2nc(C)cs2)c1	ZINC000450954891	FG	On-Demand	Anodyne	OXTR	19	43
COc1cccc(-n2cc(C(=O)Nc3c4c(nn3C(C)C)CCC4)nn2)c1	ZINC000450954892	FF	On-Demand	Anodyne	DRD4	43	33
CCOc1ccc(S(=O)(=O)CC[C@H](C)O)cc1	ZINC000450954893	CD	On-Demand	Anodyne	CA7	18	51
CCOc1ccc(S(=O)(=O)CC[C@H](C)O)cc1	ZINC000450954893	CD	On-Demand	Anodyne	MMP13	15	44
CCOc1ccc(S(=O)(=O)CC[C@H](C)O)cc1	ZINC000450954893	CD	On-Demand	Anodyne	MMP14	15	40
CCOc1ccc(S(=O)(=O)CC[C@@H](C)O)cc1	ZINC000450954894	CD	On-Demand	Anodyne	CA7	18	51
CCOc1ccc(S(=O)(=O)CC[C@@H](C)O)cc1	ZINC000450954894	CD	On-Demand	Anodyne	MMP13	15	44
CCOc1ccc(S(=O)(=O)CC[C@@H](C)O)cc1	ZINC000450954894	CD	On-Demand	Anodyne	MMP14	15	40
O=S(=O)(NCCCN1CCOCC1)c1cccc2ccoc12	ZINC000450954897	DD	On-Demand	Anodyne	HTR7	26	43
O=S(=O)(NCCCN1CCOCC1)c1cccc2ccoc12	ZINC000450954897	DD	On-Demand	Anodyne	HTR6	22	48
C[C@H](O)CN(C)C1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450954902	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
C[C@@H](O)CN(C)C1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450954903	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
CCS(=O)(=O)c1ccc(Cn2cnc(C(C)(C)C)cc2=O)cc1	ZINC000450954904	EE	On-Demand	Anodyne	NR1I2	40	39
CCOc1ccc(S(=O)(=O)Cc2c(C)nnn2CC)cc1	ZINC000450954932	DD	On-Demand	Anodyne	CACNA2D1	54	38
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450954936	GF	On-Demand	Anodyne	TRPV1	42	40
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450954936	GF	On-Demand	Anodyne	NCE103	29	46
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450954936	GF	On-Demand	Anodyne	P96878_MYCTU	17	46
COC(=O)[C@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450954936	GF	On-Demand	Anodyne	CAN2	0	46
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450954937	GF	On-Demand	Anodyne	TRPV1	42	40
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450954937	GF	On-Demand	Anodyne	NCE103	29	46
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450954937	GF	On-Demand	Anodyne	P96878_MYCTU	17	46
COC(=O)[C@@H](NC(=O)Cc1ccc(Cl)c(OC)c1)c1ccc(OC)c(O)c1	ZINC000450954937	GF	On-Demand	Anodyne	CAN2	0	46
CCOc1ccc(S(=O)(=O)CC2(C#N)CCC2)cc1	ZINC000450954942	CF	On-Demand	Mild	ADAM17	35	40
Cc1cccc(NC(=O)c2cc3n(n2)CCCC3)c1Br	ZINC000450954950	EH	On-Demand	Anodyne	CNR1	49	31
CCC(CC)Oc1ccc(C(=O)Nc2cnns2)cc1	ZINC000450954951	CG	On-Demand	Anodyne	AHK3	0	43
CC(C)(C)c1cc(=O)n(CCc2ccc(Cl)cc2)cn1	ZINC000450954968	CG	On-Demand	Anodyne	DNAE	53	31
CCC[C@H](O)CN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000450954969	CD	On-Demand	Anodyne	ETHR	22	41
CCC[C@@H](O)CN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000450954970	CD	On-Demand	Anodyne	ETHR	22	41
CCC[C@H](O)CN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000450954971	CD	On-Demand	Anodyne	ETHR	22	41
CCC[C@@H](O)CN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000450954972	CD	On-Demand	Anodyne	ETHR	22	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cnns1	ZINC000450954975	CE	On-Demand	Anodyne	AHK3	0	40
COc1cc2c(N3CC(C)(CC(F)(F)F)C3)ncnc2cc1F	ZINC000450955000	EH	On-Demand	Anodyne	PDE3A	54	43
COc1cc2c(N3CC(C)(CC(F)(F)F)C3)ncnc2cc1F	ZINC000450955000	EH	On-Demand	Anodyne	PDGFRB	67	38
COc1cc2c(N3CC(C)(CC(F)(F)F)C3)ncnc2cc1F	ZINC000450955000	EH	On-Demand	Anodyne	PDE3B	79	40
CCCNC(=O)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450955021	CD	On-Demand	Anodyne	SIRT3	42	35
CCCNC(=O)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450955022	CD	On-Demand	Anodyne	SIRT3	42	35
O=C(CS(=O)(=O)C1CC1)NCC1(Cc2ccccc2)CCCCC1	ZINC000450955023	EF	On-Demand	Anodyne	NPFFR1	33	44
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H](CCCO)C1	ZINC000450955034	DG	On-Demand	Bother	LIPG	62	44
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H](CCCO)C1	ZINC000450955035	DG	On-Demand	Bother	LIPG	62	44
OCCC[C@H]1CCN(c2ncncc2-c2ccccc2)C1	ZINC000450955040	CF	On-Demand	Anodyne	SLC9A1	0	49
OCCC[C@@H]1CCN(c2ncncc2-c2ccccc2)C1	ZINC000450955041	CF	On-Demand	Anodyne	SLC9A1	0	49
C[C@@H]1CN(CCO)CCN1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450955063	EE	On-Demand	Bother	KCNJ1	17	44
C[C@H]1CN(CCO)CCN1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1	ZINC000450955064	EE	On-Demand	Bother	KCNJ1	17	44
CCOC(=O)c1cccnc1N1CC[C@@H](CCCO)C1	ZINC000450955065	CD	On-Demand	Anodyne	SIRT2	43	30
CCOC(=O)c1cccnc1N1CC[C@H](CCCO)C1	ZINC000450955066	CD	On-Demand	Anodyne	SIRT2	43	30
Cc1ccn2ncc(C(=O)N[C@H](C)C3CCN(CC(F)(F)F)CC3)c2c1	ZINC000450955083	FG	On-Demand	Anodyne	EPHB3	31	44
Cc1ccn2ncc(C(=O)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)c2c1	ZINC000450955084	FG	On-Demand	Anodyne	EPHB3	31	44
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C1(C)CCC(=O)CC1	ZINC000450955088	FG	On-Demand	Anodyne	TIMP3	62	35
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C1(C)CCC(=O)CC1	ZINC000450955089	FG	On-Demand	Anodyne	TIMP3	62	35
Cc1cc(C)c(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1Br	ZINC000450955092	GG	On-Demand	Anodyne	L3MBTL1	0	50
Cc1cc(C)c(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1Br	ZINC000450955092	GG	On-Demand	Anodyne	L3MBTL3	65	50
Cc1cc(C)c(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1Br	ZINC000450955092	GG	On-Demand	Anodyne	MBTD1	0	42
COc1cc(CC(=O)N2CC(O)(C3CC3)C2)ccc1Cl	ZINC000450955111	CD	On-Demand	Anodyne	OPRM1	16	41
COc1cc(CC(=O)N2CC(O)(C3CC3)C2)ccc1Cl	ZINC000450955111	CD	On-Demand	Anodyne	OPRK1	41	42
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955117	GI	On-Demand	Anodyne	PRCP	41	64
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955117	GI	On-Demand	Anodyne	COLA	137	41
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955117	GI	On-Demand	Anodyne	CPT1A	128	41
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955117	GI	On-Demand	Anodyne	CPT2	43	37
Cc1cnc(CCCC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955117	GI	On-Demand	Anodyne	PREP	59	39
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955118	GI	On-Demand	Anodyne	PRCP	41	64
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955118	GI	On-Demand	Anodyne	COLA	137	41
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955118	GI	On-Demand	Anodyne	CPT1A	128	41
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955118	GI	On-Demand	Anodyne	CPT2	43	37
Cc1cnc(CCCC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)o1	ZINC000450955118	GI	On-Demand	Anodyne	PREP	59	39
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@]1(COC)CCOC1	ZINC000450955135	FD	On-Demand	Anodyne	TIMP3	82	36
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@]1(COC)CCOC1	ZINC000450955136	FD	On-Demand	Anodyne	TIMP3	82	36
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@]1(COC)CCOC1	ZINC000450955137	FD	On-Demand	Anodyne	TIMP3	82	36
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@]1(COC)CCOC1	ZINC000450955138	FD	On-Demand	Anodyne	TIMP3	82	36
Cc1[nH]c(C#N)cc1C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450955143	CF	On-Demand	Mild	KCNA3	17	45
CC(=O)[C@@H](Cc1ccccc1F)n1cc([N+](=O)[O-])c(C)n1	ZINC000450955158	CF	On-Demand	Bother	COLA	75	33
CC(=O)[C@H](Cc1ccccc1F)n1cc([N+](=O)[O-])c(C)n1	ZINC000450955159	CF	On-Demand	Bother	COLA	75	33
CC(=O)NC[C@H](CC(=O)N1CCCN(C(=O)C2CC2)CC1)CC(C)C	ZINC000450955169	FD	On-Demand	Anodyne	RIR1_HHV11	61	38
CCCCCC(=O)Nc1ccc(C(=O)Cn2cc([N+](=O)[O-])c(C)n2)cc1	ZINC000450955171	FH	On-Demand	Bother	ENPP2	22	41
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C(C)(C)C(C)(F)F	ZINC000450955175	FH	On-Demand	Anodyne	CTRB_BOVIN	55	42
O=C1C[C@@H](NCc2ccc(Cl)cc2Cl)[C@H](c2cccnc2)N1C1CC1	ZINC000450955177	GH	On-Demand	Anodyne	P2RX7	30	45
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nc3c(s2)CCCC3)cc1	ZINC000450955178	GG	On-Demand	Anodyne	SLC27A1	32	40
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	CASP3	91	38
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	MMP13	79	47
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	BDKRB1	23	41
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	ADAM17	70	39
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	MMP2	39	41
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	MMP3	74	47
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	MMP9	38	41
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	EPHX2	29	47
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	CASP7	101	39
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	MMP7	76	47
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955182	FE	On-Demand	Anodyne	MMP1	81	47
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	CASP3	91	38
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	MMP13	79	47
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	BDKRB1	23	41
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	ADAM17	70	39
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	MMP2	39	41
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	MMP3	74	47
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	MMP9	38	41
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	EPHX2	29	47
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	CASP7	101	39
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	MMP7	76	47
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450955183	FE	On-Demand	Anodyne	MMP1	81	47
COc1ccc(CC(=O)N(C)CC2(c3ccccc3)CC2)c(Cl)c1OC	ZINC000450955184	FI	On-Demand	Anodyne	KCNA3	43	47
CC(=O)CCCCCOc1ccc2c(c1)CCNC2=O	ZINC000450955185	CF	On-Demand	Anodyne	THRA	34	41
CC(=O)CCCCCOc1ccc2c(c1)CCNC2=O	ZINC000450955185	CF	On-Demand	Anodyne	P2RY12	46	46
CC(=O)CCCCCOc1ccc2c(c1)CCNC2=O	ZINC000450955185	CF	On-Demand	Anodyne	THRB	0	41
CC(=O)CCCCCOc1ccc2c(c1)CCNC2=O	ZINC000450955185	CF	On-Demand	Anodyne	PLA2G4B	62	34
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)N2CCCC2)c(F)c1	ZINC000450955186	FD	On-Demand	Anodyne	F13A1	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)CCCC3)cc1	ZINC000450955197	GG	On-Demand	Anodyne	CA2	17	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)CCCC3)cc1	ZINC000450955197	GG	On-Demand	Anodyne	CA1	20	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)CCCC3)cc1	ZINC000450955197	GG	On-Demand	Anodyne	CA4	23	42
C[C@@H]1CCCN(S(=O)(=O)c2sccc2Cl)C1	ZINC000450955199	CF	On-Demand	Anodyne	AKR1C3	0	46
C[C@H]1CCCN(S(=O)(=O)c2sccc2Cl)C1	ZINC000450955200	CF	On-Demand	Anodyne	AKR1C3	0	46
COC(=O)[C@@H](NC(=O)CCCC(C)C)c1ccc(OC)c(Cl)c1	ZINC000450955209	EH	On-Demand	Anodyne	FOLH1	46	39
COC(=O)[C@H](NC(=O)CCCC(C)C)c1ccc(OC)c(Cl)c1	ZINC000450955210	EH	On-Demand	Anodyne	FOLH1	46	39
O=S(=O)(NC1CCCCC1)c1sccc1Cl	ZINC000450955211	CG	On-Demand	Anodyne	BRD4	24	47
COc1cc(CC(=O)NC(C)(C)CF)ccc1O	ZINC000450955222	CD	On-Demand	Anodyne	TRPV1	24	60
COc1cc(CC(=O)NC(C)(C)CF)ccc1O	ZINC000450955222	CD	On-Demand	Anodyne	NCE103	39	48
COc1cc(CC(=O)NC(C)(C)CF)ccc1O	ZINC000450955222	CD	On-Demand	Anodyne	P96878_MYCTU	23	44
COc1cc(CC(=O)NC(C)(C)CF)ccc1O	ZINC000450955222	CD	On-Demand	Anodyne	CAN2	0	48
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCCCC2)c1	ZINC000450955237	DF	On-Demand	Anodyne	PKM	15	43
CC(C)(C)c1cc(CSc2cccc(C(N)=O)c2)no1	ZINC000450955244	CG	On-Demand	Anodyne	FLT3	19	40
O=S(=O)(c1sccc1Cl)N1CCN(Cc2ccccc2)CC1	ZINC000450955245	FF	On-Demand	Anodyne	DRD2	0	44
O=S(=O)(c1sccc1Cl)N1CCN(Cc2ccccc2)CC1	ZINC000450955245	FF	On-Demand	Anodyne	DRD3	0	49
O=S(=O)(c1sccc1Cl)N1CCN(Cc2ccccc2)CC1	ZINC000450955245	FF	On-Demand	Anodyne	ADORA2B	40	34
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)c(F)c1	ZINC000450955249	GF	On-Demand	Anodyne	CCR8	53	38
CCOC(=O)c1cc(S(=O)(=O)Nc2ccccc2C(C)C)cnc1C(F)F	ZINC000450955260	GI	On-Demand	Anodyne	PRTN3	46	36
OCCC[C@@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450955280	DH	On-Demand	Anodyne	LIPG	50	35
OCCC[C@H]1CCN(c2nccc3cc(C(F)(F)F)ccc23)C1	ZINC000450955281	DH	On-Demand	Anodyne	LIPG	50	35
COc1cccc(OCCC(=O)NCc2nnnn2CC2CC2)c1	ZINC000450955298	ED	On-Demand	Anodyne	MTNR1A	34	43
COc1cccc(OCCC(=O)NCc2nnnn2CC2CC2)c1	ZINC000450955298	ED	On-Demand	Anodyne	MTNR1B	29	43
CCOC(=O)CC[C@]1(C)NC(=O)N(Cc2cc(Cl)sc2Cl)C1=O	ZINC000450955322	GG	On-Demand	Anodyne	KAT2B	0	45
CCOC(=O)CC[C@@]1(C)NC(=O)N(Cc2cc(Cl)sc2Cl)C1=O	ZINC000450955323	GG	On-Demand	Anodyne	KAT2B	0	45
CN(CCN(C)C1CC1)C(=O)Cc1cc2ccccc2s1	ZINC000450955330	DF	On-Demand	Anodyne	AROQ	24	42
COc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2cc1F	ZINC000450955331	DE	On-Demand	Anodyne	PDE3A	65	48
COc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2cc1F	ZINC000450955331	DE	On-Demand	Anodyne	PDGFRB	68	40
COc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2cc1F	ZINC000450955331	DE	On-Demand	Anodyne	FLT1	22	41
COc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2cc1F	ZINC000450955331	DE	On-Demand	Anodyne	PDE3B	95	48
COc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2cc1F	ZINC000450955331	DE	On-Demand	Anodyne	SIRT3	44	34
COc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2cc1F	ZINC000450955331	DE	On-Demand	Anodyne	SIRT2	44	32
COc1cc2c(N3CC[C@H](CCCO)C3)ncnc2cc1F	ZINC000450955332	DE	On-Demand	Anodyne	PDE3A	65	48
COc1cc2c(N3CC[C@H](CCCO)C3)ncnc2cc1F	ZINC000450955332	DE	On-Demand	Anodyne	PDGFRB	68	40
COc1cc2c(N3CC[C@H](CCCO)C3)ncnc2cc1F	ZINC000450955332	DE	On-Demand	Anodyne	FLT1	22	41
COc1cc2c(N3CC[C@H](CCCO)C3)ncnc2cc1F	ZINC000450955332	DE	On-Demand	Anodyne	PDE3B	95	48
COc1cc2c(N3CC[C@H](CCCO)C3)ncnc2cc1F	ZINC000450955332	DE	On-Demand	Anodyne	SIRT3	44	34
COc1cc2c(N3CC[C@H](CCCO)C3)ncnc2cc1F	ZINC000450955332	DE	On-Demand	Anodyne	SIRT2	44	32
CCOc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450955349	DG	On-Demand	Anodyne	MMP13	27	41
CCOc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450955350	DG	On-Demand	Anodyne	MMP13	27	41
CCOc1ccc(S(=O)(=O)CC(=O)CC(C)(C)C2CC2)cc1	ZINC000450955351	DG	On-Demand	Anodyne	E1	0	40
CC1(CC(F)(F)F)CN(c2ncnc3cc(F)c(F)cc23)C1	ZINC000450955381	DH	On-Demand	Anodyne	PDE3B	54	31
CC1(CC(F)(F)F)CN(c2cc(C(F)(F)F)nc3ncnn23)C1	ZINC000450955383	EF	On-Demand	Anodyne	DHOD	0	41
CSc1ccc2ncnc(N3CC(C)(CC(F)(F)F)C3)c2c1	ZINC000450955420	EI	On-Demand	Anodyne	HTT	0	43
C[C@@H]1CN(CCO)CCN1c1cnc2ccccc2n1	ZINC000450955457	CD	On-Demand	Anodyne	SORD	25	53
C[C@H]1CN(CCO)CCN1c1cnc2ccccc2n1	ZINC000450955458	CD	On-Demand	Anodyne	SORD	25	53
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C(C)(C)C(C)(F)F	ZINC000450955476	FH	On-Demand	Anodyne	CTRB_BOVIN	55	42
CC(C)(C)C(=O)CCCC(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450955477	DE	On-Demand	Anodyne	PREP	41	49
CCSc1cccnc1C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450955478	GH	On-Demand	Anodyne	HPGDS	38	42
CCSc1cccnc1C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450955479	GH	On-Demand	Anodyne	HPGDS	38	42
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450955483	EJ	On-Demand	Anodyne	F10	29	45
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450955483	EJ	On-Demand	Anodyne	PTGER4	19	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450955483	EJ	On-Demand	Anodyne	ATF1	46	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450955483	EJ	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450955483	EJ	On-Demand	Anodyne	NFKB1	43	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450955483	EJ	On-Demand	Anodyne	PTGDR	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)c1ccc(Cl)cn1	ZINC000450955484	EJ	On-Demand	Anodyne	F10	29	45
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)c1ccc(Cl)cn1	ZINC000450955484	EJ	On-Demand	Anodyne	PTGER4	19	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)c1ccc(Cl)cn1	ZINC000450955484	EJ	On-Demand	Anodyne	ATF1	46	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)c1ccc(Cl)cn1	ZINC000450955484	EJ	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)c1ccc(Cl)cn1	ZINC000450955484	EJ	On-Demand	Anodyne	NFKB1	43	37
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)c1ccc(Cl)cn1	ZINC000450955484	EJ	On-Demand	Anodyne	PTGDR	0	41
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955487	GG	On-Demand	Anodyne	MC4R	54	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955487	GG	On-Demand	Anodyne	PRCP	57	41
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955487	GG	On-Demand	Anodyne	MC3R	44	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955487	GG	On-Demand	Anodyne	MC5R	36	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955488	GG	On-Demand	Anodyne	MC4R	54	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955488	GG	On-Demand	Anodyne	PRCP	57	41
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955488	GG	On-Demand	Anodyne	MC3R	44	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955488	GG	On-Demand	Anodyne	MC5R	36	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955489	GG	On-Demand	Anodyne	MC4R	54	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955489	GG	On-Demand	Anodyne	PRCP	57	41
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955489	GG	On-Demand	Anodyne	MC3R	44	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955489	GG	On-Demand	Anodyne	MC5R	36	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955490	GG	On-Demand	Anodyne	MC4R	54	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955490	GG	On-Demand	Anodyne	PRCP	57	41
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955490	GG	On-Demand	Anodyne	MC3R	44	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450955490	GG	On-Demand	Anodyne	MC5R	36	42
CC(=O)CCCCCS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450955497	GE	On-Demand	Anodyne	THRB	24	40
CC(=O)CCCCCS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450955497	GE	On-Demand	Anodyne	AKR1C3	57	37
COc1cc(CN2CCC[C@@](O)(C(N)=O)C2)ccc1Cl	ZINC000450955500	CD	On-Demand	Anodyne	HTR4	30	40
COc1cc(CN2CCC[C@](O)(C(N)=O)C2)ccc1Cl	ZINC000450955501	CD	On-Demand	Anodyne	HTR4	30	40
C[C@@H](NC(=O)c1cc2cccnc2s1)C1CCN(CC(F)(F)F)CC1	ZINC000450955502	FH	On-Demand	Anodyne	HPGDS	35	41
C[C@H](NC(=O)c1cc2cccnc2s1)C1CCN(CC(F)(F)F)CC1	ZINC000450955503	FH	On-Demand	Anodyne	HPGDS	35	41
Cc1nn([C@H](C)C(=O)NCC(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450955504	DD	On-Demand	Bother	COLA	80	33
Cc1nn([C@@H](C)C(=O)NCC(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000450955505	DD	On-Demand	Bother	COLA	80	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@]1(C#N)C[C@H]1C	ZINC000450955514	EE	On-Demand	Mild	TIMP3	62	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@]1(C#N)C[C@@H]1C	ZINC000450955515	EE	On-Demand	Mild	TIMP3	62	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@]1(C#N)C[C@H]1C	ZINC000450955516	EE	On-Demand	Mild	TIMP3	62	32
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@]1(C#N)C[C@@H]1C	ZINC000450955517	EE	On-Demand	Mild	TIMP3	62	32
Cc1nn([C@H](C)C(=O)N[C@@H](C)c2cccc3ccccc23)cc1[N+](=O)[O-]	ZINC000450955518	FH	On-Demand	Bother	COLA	52	31
Cc1nn([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc23)cc1[N+](=O)[O-]	ZINC000450955519	FH	On-Demand	Bother	COLA	52	31
Cc1nn([C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc23)cc1[N+](=O)[O-]	ZINC000450955520	FH	On-Demand	Bother	COLA	52	31
Cc1nn([C@H](C)C(=O)N[C@H](C)c2cccc3ccccc23)cc1[N+](=O)[O-]	ZINC000450955521	FH	On-Demand	Bother	COLA	52	31
CCOC(=O)C1(CNC(=O)c2nc3ccccc3nc2C2CC2)CC1	ZINC000450955526	EF	On-Demand	Anodyne	HCN4	41	32
CN(Cc1ccccc1[N+](=O)[O-])C[C@@H]1OCCN(C)[C@H]1c1ccccc1	ZINC000450955533	FG	On-Demand	Bother	COLA	87	34
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCC(=O)NCc1ccccc1Cl	ZINC000450955544	GH	On-Demand	Anodyne	P2RX7	35	42
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCC(=O)NCc1ccccc1Cl	ZINC000450955545	GH	On-Demand	Anodyne	P2RX7	35	42
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCC(=O)NCc1ccccc1Cl	ZINC000450955546	GH	On-Demand	Anodyne	P2RX7	35	42
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCC(=O)NCc1ccccc1Cl	ZINC000450955547	GH	On-Demand	Anodyne	P2RX7	35	42
COc1ccc(Cl)cc1CNC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450955553	GG	On-Demand	Anodyne	F2	22	44
COc1ccc(Cl)cc1CNC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450955554	GG	On-Demand	Anodyne	F2	22	44
COc1ccc(Cl)cc1CNC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450955555	GG	On-Demand	Anodyne	F2	22	44
COc1ccc(Cl)cc1CNC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450955556	GG	On-Demand	Anodyne	F2	22	44
COC(=O)[C@@H](NC(=O)CCCC(=O)C1CC1)c1ccc(OC)c(Cl)c1	ZINC000450955562	FF	On-Demand	Anodyne	HTR4	40	38
COC(=O)[C@H](NC(=O)CCCC(=O)C1CC1)c1ccc(OC)c(Cl)c1	ZINC000450955563	FF	On-Demand	Anodyne	HTR4	40	38
COc1ccc(CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)cc1	ZINC000450955572	DH	On-Demand	Anodyne	OPRK1	20	40
COc1ccc(CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)cc1	ZINC000450955572	DH	On-Demand	Anodyne	SIGMAR1	23	46
COc1ccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)cc1	ZINC000450955574	DH	On-Demand	Anodyne	OPRK1	20	40
COc1ccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)cc1	ZINC000450955574	DH	On-Demand	Anodyne	SIGMAR1	23	46
COc1ccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)cc1	ZINC000450955576	DH	On-Demand	Anodyne	OPRK1	20	40
COc1ccc(CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)cc1	ZINC000450955576	DH	On-Demand	Anodyne	SIGMAR1	23	46
COc1ccc(CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)cc1	ZINC000450955577	DH	On-Demand	Anodyne	OPRK1	20	40
COc1ccc(CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)cc1	ZINC000450955577	DH	On-Demand	Anodyne	SIGMAR1	23	46
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCCC2)c1	ZINC000450955591	DE	On-Demand	Anodyne	CNR2	15	46
CCOC(=O)c1ccc(CS(=O)(=O)N(CC)c2ccccc2)cc1	ZINC000450955592	EG	On-Demand	Anodyne	F2RL3	20	41
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	EGFR	0	41
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	HTR1A	34	58
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	DRD2	21	58
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	DRD4	51	41
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	HRH2	24	44
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	HTR1B	18	46
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	HTR2A	15	44
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	DRD3	27	44
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	HTR7	33	43
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	MTNR1A	32	45
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	MTNR1B	35	51
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	ABCB1	22	41
CCN1CCN(c2cccc(NC(=O)CCOc3cccc(OC)c3)c2)CC1	ZINC000450955601	GG	On-Demand	Anodyne	EPHX2	19	41
CCOC(=O)C1(CNC(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450955602	EE	On-Demand	Anodyne	TIMP3	47	32
CCOC(=O)C1(CNC(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450955602	EE	On-Demand	Anodyne	SLC12A5	48	36
CC[C@@H]1CCCCN1S(=O)(=O)c1cc(C)cs1	ZINC000450955611	CG	On-Demand	Anodyne	CASP7	43	34
CC[C@H]1CCCCN1S(=O)(=O)c1cc(C)cs1	ZINC000450955612	CG	On-Demand	Anodyne	CASP7	43	34
Cc1cccc(Cl)c1C(=O)N1CCCC2(CC2)C1	ZINC000450955635	CH	On-Demand	Anodyne	CCR5	22	41
CCCOc1ccc(C(=O)NC(C)(C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450955636	GF	On-Demand	Anodyne	THRA	0	40
CCCOc1ccc(C(=O)NC(C)(C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450955636	GF	On-Demand	Anodyne	HTR4	41	36
CCCOc1ccc(C(=O)NC(C)(C)CCN2CCN(C)CC2)c(OC)c1	ZINC000450955636	GF	On-Demand	Anodyne	THRB	0	40
COc1ccc(S(=O)(=O)C[C@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450955637	CE	On-Demand	Anodyne	MMP13	31	40
COc1ccc(S(=O)(=O)C[C@@H]2C[C@H]3CC[C@H]2O3)cc1	ZINC000450955638	CE	On-Demand	Anodyne	MMP13	31	40
Cc1cccc(CNC(=O)c2ccc(C(=O)NC(C)(C)CF)cc2)c1	ZINC000450955639	EG	On-Demand	Anodyne	KCNK3	40	35
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)CCN1CCN(C)CC1	ZINC000450955646	FG	On-Demand	Anodyne	CCR2	44	37
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)CCN1CCN(C)CC1	ZINC000450955646	FG	On-Demand	Anodyne	CACNA1I	28	40
O=S(=O)(NCCc1ccccc1)c1ccc(C2CC2)cc1	ZINC000450955651	DG	On-Demand	Anodyne	TBXA2R	49	45
O=S(=O)(NCCc1ccccc1)c1ccc(C2CC2)cc1	ZINC000450955651	DG	On-Demand	Anodyne	ALOX15	57	39
O=S(=O)(NCCc1ccccc1)c1ccc(C2CC2)cc1	ZINC000450955651	DG	On-Demand	Anodyne	LIMK2	41	36
O=S(=O)(NCCc1ccccc1)c1ccc(C2CC2)cc1	ZINC000450955651	DG	On-Demand	Anodyne	A6YCJ1_9METZ	23	48
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(C(C)C)cc1	ZINC000450955655	EF	On-Demand	Anodyne	ADRB2	18	44
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(C(C)C)cc1	ZINC000450955655	EF	On-Demand	Anodyne	ADRB3	20	44
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450955656	EG	On-Demand	Mild	CASP3	41	35
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450955656	EG	On-Demand	Mild	CASP7	43	35
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450955657	EG	On-Demand	Mild	CASP3	41	35
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450955657	EG	On-Demand	Mild	CASP7	43	35
COc1ccc(S(=O)(=O)C[C@H]2CCCCC2(F)F)cc1	ZINC000450955658	DG	On-Demand	Anodyne	MMP2	27	40
COc1ccc(S(=O)(=O)C[C@H]2CCCCC2(F)F)cc1	ZINC000450955658	DG	On-Demand	Anodyne	MMP3	38	40
COc1ccc(S(=O)(=O)C[C@H]2CCCCC2(F)F)cc1	ZINC000450955658	DG	On-Demand	Anodyne	MMP14	23	43
COc1ccc(S(=O)(=O)C[C@H]2CCCCC2(F)F)cc1	ZINC000450955658	DG	On-Demand	Anodyne	MMP9	33	40
COc1ccc(S(=O)(=O)C[C@H]2CCCCC2(F)F)cc1	ZINC000450955658	DG	On-Demand	Anodyne	MMP7	40	39
COc1ccc(S(=O)(=O)C[C@H]2CCCCC2(F)F)cc1	ZINC000450955658	DG	On-Demand	Anodyne	MMP1	43	42
COc1ccc(S(=O)(=O)C[C@@H]2CCCCC2(F)F)cc1	ZINC000450955659	DG	On-Demand	Anodyne	MMP2	27	40
COc1ccc(S(=O)(=O)C[C@@H]2CCCCC2(F)F)cc1	ZINC000450955659	DG	On-Demand	Anodyne	MMP3	38	40
COc1ccc(S(=O)(=O)C[C@@H]2CCCCC2(F)F)cc1	ZINC000450955659	DG	On-Demand	Anodyne	MMP14	23	43
COc1ccc(S(=O)(=O)C[C@@H]2CCCCC2(F)F)cc1	ZINC000450955659	DG	On-Demand	Anodyne	MMP9	33	40
COc1ccc(S(=O)(=O)C[C@@H]2CCCCC2(F)F)cc1	ZINC000450955659	DG	On-Demand	Anodyne	MMP7	40	39
COc1ccc(S(=O)(=O)C[C@@H]2CCCCC2(F)F)cc1	ZINC000450955659	DG	On-Demand	Anodyne	MMP1	43	42
COC(=O)c1ccccc1CCN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450955673	EG	On-Demand	Anodyne	HRH3	0	42
COC(=O)c1ccccc1CCN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450955674	EG	On-Demand	Anodyne	HRH3	0	42
COC(=O)c1ccccc1CCN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450955675	EG	On-Demand	Anodyne	HRH3	0	42
CC(C)CNC(=O)NC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450955695	CC	On-Demand	Anodyne	ADORA3	43	40
CC(C)CNC(=O)NC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450955695	CC	On-Demand	Anodyne	SCARB1	43	34
COc1cccc(Oc2ccc(C(=O)N3CCC(N(C)C[C@H](C)O)CC3)nc2)c1	ZINC000450955702	GF	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc(Oc2ccc(C(=O)N3CCC(N(C)C[C@H](C)O)CC3)nc2)c1	ZINC000450955702	GF	On-Demand	Anodyne	MTNR1B	27	40
COc1cccc(Oc2ccc(C(=O)N3CCC(N(C)C[C@@H](C)O)CC3)nc2)c1	ZINC000450955703	GF	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc(Oc2ccc(C(=O)N3CCC(N(C)C[C@@H](C)O)CC3)nc2)c1	ZINC000450955703	GF	On-Demand	Anodyne	MTNR1B	27	40
COc1cccc2c(N3CC[C@@H](CCCO)C3)ccnc12	ZINC000450955710	CF	On-Demand	Anodyne	PDE3A	41	32
COc1cccc2c(N3CC[C@@H](CCCO)C3)ccnc12	ZINC000450955710	CF	On-Demand	Anodyne	PDE3B	60	33
COc1cccc2c(N3CC[C@H](CCCO)C3)ccnc12	ZINC000450955711	CF	On-Demand	Anodyne	PDE3A	41	32
COc1cccc2c(N3CC[C@H](CCCO)C3)ccnc12	ZINC000450955711	CF	On-Demand	Anodyne	PDE3B	60	33
OCCC[C@H]1CCN(c2cc(C3CC3)nc(N3CC[C@@H](CCCO)C3)n2)C1	ZINC000450955715	FF	On-Demand	Anodyne	HRH4	23	42
OCCC[C@@H]1CCN(c2cc(C3CC3)nc(N3CC[C@@H](CCCO)C3)n2)C1	ZINC000450955716	FF	On-Demand	Anodyne	HRH4	23	42
OCCC[C@H]1CCN(c2cc(C3CC3)nc(N3CC[C@H](CCCO)C3)n2)C1	ZINC000450955717	FF	On-Demand	Anodyne	HRH4	23	42
OCCC[C@H]1CCN(c2nc(C3CC3)cc(N3CC[C@@H](CCCO)C3)n2)C1	ZINC000450955718	FF	On-Demand	Anodyne	HRH4	23	42
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450955742	EG	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450955742	EG	On-Demand	Anodyne	CYP2J2	47	33
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450955743	EG	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450955743	EG	On-Demand	Anodyne	CYP2J2	47	33
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450955744	EG	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccc(F)cc1	ZINC000450955744	EG	On-Demand	Anodyne	CYP2J2	47	33
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450955745	EG	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccc(F)cc1	ZINC000450955745	EG	On-Demand	Anodyne	CYP2J2	47	33
Cc1ccc(SC[C@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450955746	EH	On-Demand	Anodyne	ENPP2	15	40
Cc1ccc(SC[C@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450955746	EH	On-Demand	Anodyne	HPGDS	15	41
Cc1ccc(SC[C@@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450955747	EH	On-Demand	Anodyne	ENPP2	15	40
Cc1ccc(SC[C@@H](C)NC(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450955747	EH	On-Demand	Anodyne	HPGDS	15	41
C[C@@H](O)CN(C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450955764	GF	On-Demand	Bother	CACNA1B	40	39
C[C@@H](O)CN(C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450955764	GF	On-Demand	Bother	MCHR1	22	41
C[C@@H](O)CN(C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450955764	GF	On-Demand	Bother	LIPG	50	35
C[C@H](O)CN(C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450955765	GF	On-Demand	Bother	CACNA1B	40	39
C[C@H](O)CN(C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450955765	GF	On-Demand	Bother	MCHR1	22	41
C[C@H](O)CN(C)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1	ZINC000450955765	GF	On-Demand	Bother	LIPG	50	35
CS(=O)(=O)c1ccccc1OCC(=O)CC[C@@H]1CCCCO1	ZINC000450955768	EE	On-Demand	Anodyne	OXTR	24	45
CS(=O)(=O)c1ccccc1OCC(=O)CC[C@H]1CCCCO1	ZINC000450955769	EE	On-Demand	Anodyne	OXTR	24	45
C[C@@H]1CN(CCO)CCN1c1ccnc2cc(Cl)ccc12	ZINC000450955794	DE	On-Demand	Anodyne	HRP1_PLAFA	100	43
C[C@@H]1CN(CCO)CCN1c1ccnc2cc(Cl)ccc12	ZINC000450955794	DE	On-Demand	Anodyne	HNMT	57	40
C[C@H]1CN(CCO)CCN1c1ccnc2cc(Cl)ccc12	ZINC000450955795	DE	On-Demand	Anodyne	HRP1_PLAFA	100	43
C[C@H]1CN(CCO)CCN1c1ccnc2cc(Cl)ccc12	ZINC000450955795	DE	On-Demand	Anodyne	HNMT	57	40
Cc1nnc2c3ccccc3c(N3CCN(CCO)C[C@H]3C)nn12	ZINC000450955798	ED	On-Demand	Anodyne	CREBBP	40	31
Cc1nnc2c3ccccc3c(N3CCN(CCO)C[C@H]3C)nn12	ZINC000450955798	ED	On-Demand	Anodyne	BRD9	51	32
Cc1nnc2c3ccccc3c(N3CCN(CCO)C[C@@H]3C)nn12	ZINC000450955799	ED	On-Demand	Anodyne	CREBBP	40	31
Cc1nnc2c3ccccc3c(N3CCN(CCO)C[C@@H]3C)nn12	ZINC000450955799	ED	On-Demand	Anodyne	BRD9	51	32
Cc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450955808	CF	On-Demand	Anodyne	PDE3A	51	39
Cc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450955808	CF	On-Demand	Anodyne	PDE3B	76	39
Cc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450955808	CF	On-Demand	Anodyne	SIRT3	54	33
Cc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450955808	CF	On-Demand	Anodyne	SIRT2	55	34
Cc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450955808	CF	On-Demand	Anodyne	HTT	0	40
Cc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450955809	CF	On-Demand	Anodyne	PDE3A	51	39
Cc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450955809	CF	On-Demand	Anodyne	PDE3B	76	39
Cc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450955809	CF	On-Demand	Anodyne	SIRT3	54	33
Cc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450955809	CF	On-Demand	Anodyne	SIRT2	55	34
Cc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450955809	CF	On-Demand	Anodyne	HTT	0	40
OCCC[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450955824	BD	On-Demand	Anodyne	ROCK2	44	46
OCCC[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450955824	BD	On-Demand	Anodyne	AKT1	41	47
OCCC[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450955824	BD	On-Demand	Anodyne	SIRT1	50	31
OCCC[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450955825	BD	On-Demand	Anodyne	ROCK2	44	46
OCCC[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450955825	BD	On-Demand	Anodyne	AKT1	41	47
OCCC[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000450955825	BD	On-Demand	Anodyne	SIRT1	50	31
COC(=O)CNC(=O)c1ccc(N2CC[C@@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450955848	FD	On-Demand	Bother	TAAR1	20	45
COC(=O)CNC(=O)c1ccc(N2CC[C@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450955849	FD	On-Demand	Bother	TAAR1	20	45
CN(C)Cc1nc(N2CC[C@H](CCCO)C2)c2c(-c3ccccc3)csc2n1	ZINC000450955852	GI	On-Demand	Anodyne	ADRB3	24	43
CN(C)Cc1nc(N2CC[C@@H](CCCO)C2)c2c(-c3ccccc3)csc2n1	ZINC000450955853	GI	On-Demand	Anodyne	ADRB3	24	43
CC1(CC(F)(F)F)CN(c2nc(-c3ccccc3)ns2)C1	ZINC000450955854	DH	On-Demand	Anodyne	FAAH	0	43
COc1ccccc1[C@@H](CNC(=O)C1(C)CCC(=O)CC1)OC(C)C	ZINC000450955865	EG	On-Demand	Anodyne	KCNA3	17	42
COc1ccccc1[C@H](CNC(=O)C1(C)CCC(=O)CC1)OC(C)C	ZINC000450955866	EG	On-Demand	Anodyne	KCNA3	17	42
Cc1ccc(C(=O)NCC2(CCOCc3ccccc3)CC2)c(C(C)C)n1	ZINC000450955872	FJ	On-Demand	Anodyne	HCN1	65	33
Cc1ccc(C(=O)NCC2(CCOCc3ccccc3)CC2)c(C(C)C)n1	ZINC000450955872	FJ	On-Demand	Anodyne	HCN4	48	32
O=C(NC1(c2nn[nH]n2)CC1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450955876	FC	On-Demand	Anodyne	FKBP1A	26	47
O=C(NC1(c2nn[nH]n2)CC1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450955876	FC	On-Demand	Anodyne	ITGA4	41	43
O=C(NC1(c2nn[nH]n2)CC1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450955876	FC	On-Demand	Anodyne	MMP7	44	38
O=C(NC1(c2nn[nH]n2)CC1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450955876	FC	On-Demand	Anodyne	MMP1	32	41
O=C(NC1(c2nn[nH]n2)CC1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000450955876	FC	On-Demand	Anodyne	SFRP1	41	31
COC(=O)c1ccc(-c2csc(NC[C@H]3CCCO3)n2)o1	ZINC000450955877	DE	On-Demand	Anodyne	TNK2	42	35
COC(=O)c1ccc(-c2csc(NC[C@@H]3CCCO3)n2)o1	ZINC000450955878	DE	On-Demand	Anodyne	TNK2	42	35
C[C@@H]1Cc2cccc(C(=O)N3CCCN(C(=O)C4CC4)CC3)c2O1	ZINC000450955882	EE	On-Demand	Anodyne	NMUR2	0	42
C[C@@H]1Cc2cccc(C(=O)N3CCCN(C(=O)C4CC4)CC3)c2O1	ZINC000450955882	EE	On-Demand	Anodyne	NMUR1	0	42
C[C@H]1Cc2cccc(C(=O)N3CCCN(C(=O)C4CC4)CC3)c2O1	ZINC000450955883	EE	On-Demand	Anodyne	NMUR2	0	42
C[C@H]1Cc2cccc(C(=O)N3CCCN(C(=O)C4CC4)CC3)c2O1	ZINC000450955883	EE	On-Demand	Anodyne	NMUR1	0	42
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1Cc1ccccc1	ZINC000450955897	CH	On-Demand	Anodyne	SIGMAR1	35	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1Cc1ccccc1	ZINC000450955898	CH	On-Demand	Anodyne	SIGMAR1	35	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1Cc1ccccc1	ZINC000450955899	CH	On-Demand	Anodyne	SIGMAR1	35	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1Cc1ccccc1	ZINC000450955900	CH	On-Demand	Anodyne	SIGMAR1	35	41
CC(C)Cn1cc(C(=O)N[C@@H](C)c2ccc(Cl)cn2)c(C(F)F)n1	ZINC000450955901	FI	On-Demand	Anodyne	F10	46	30
CC(C)Cn1cc(C(=O)N[C@H](C)c2ccc(Cl)cn2)c(C(F)F)n1	ZINC000450955902	FI	On-Demand	Anodyne	F10	46	30
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2ccccc21	ZINC000450955913	EE	On-Demand	Anodyne	CYP11B2	30	43
COc1cc(CN2C[C@@H](C)[C@H](C(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450955929	FE	On-Demand	Anodyne	DRD4	30	42
COc1cc(CN2C[C@@H](C)[C@H](C(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450955929	FE	On-Demand	Anodyne	DRD3	16	40
COc1cc(CN2C[C@@H](C)[C@H](C(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450955929	FE	On-Demand	Anodyne	CCR1	43	39
COc1cc(CN2C[C@@H](C)[C@H](C(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450955929	FE	On-Demand	Anodyne	SSTR3	64	33
COc1cc(CN2C[C@@H](C)[C@H](C(=O)N3CCOCC3)C2)ccc1Cl	ZINC000450955929	FE	On-Demand	Anodyne	MCHR1	15	40
C[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C1CCN(CC(F)(F)F)CC1	ZINC000450955945	GG	On-Demand	Anodyne	MMP13	0	44
C[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)C1CCN(CC(F)(F)F)CC1	ZINC000450955946	GG	On-Demand	Anodyne	MMP13	0	44
Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c(C)c1	ZINC000450955953	FG	On-Demand	Anodyne	ABCB1	0	41
Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c(C)c1	ZINC000450955954	FG	On-Demand	Anodyne	ABCB1	0	41
Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c(C)c1	ZINC000450955955	FG	On-Demand	Anodyne	ABCB1	0	41
Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c(C)c1	ZINC000450955956	FG	On-Demand	Anodyne	ABCB1	0	41
C[C@@H]1CN(CC/C=C/c2ccccc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450955964	EF	On-Demand	Anodyne	ADAM10	22	40
C[C@@H]1CN(CC/C=C\c2ccccc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450955965	EF	On-Demand	Anodyne	ADAM10	22	40
COC(=O)c1ccccc1CCN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450955976	EG	On-Demand	Anodyne	HRH3	0	42
CCOC(=O)c1ccc(CS(=O)(=O)NC23CC4CC(CC(C4)C2)C3)cc1	ZINC000450955977	GG	On-Demand	Anodyne	EPHX2	60	55
CN1CCN(CCC(C)(C)NC(=O)c2cc3cccnc3s2)CC1	ZINC000450956024	EE	On-Demand	Anodyne	DRD3	18	54
O=S(=O)(CCC1CCCCC1)NCc1ccccc1	ZINC000450956033	CG	On-Demand	Anodyne	BMP1	21	41
CC(C)(CF)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450956038	CD	On-Demand	Anodyne	HPGDS	32	53
CN1CCN(CCC(C)(C)NC(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450956044	GG	On-Demand	Anodyne	MAPK13	43	30
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	BMP1	49	38
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	MMP13	46	51
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	MMP2	32	46
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	MMP3	44	46
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	MMP8	29	40
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	MMP14	20	40
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	MMP9	48	46
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	MMP12	28	40
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	CA12	17	42
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	CA9	23	42
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	MMP1	45	43
CCS(=O)(=O)c1ccc(CS(=O)(=O)c2ccc(OC)cc2)cc1	ZINC000450956047	FE	On-Demand	Anodyne	RORC	51	35
O=S1(=O)CC[C@@H](NS(=O)(=O)c2ccc3ccccc3c2F)C1	ZINC000450956048	ED	On-Demand	Anodyne	CCR8	62	34
O=S1(=O)CC[C@H](NS(=O)(=O)c2ccc3ccccc3c2F)C1	ZINC000450956049	ED	On-Demand	Anodyne	CCR8	62	34
COc1cc(CC(=O)N2CCN(C[C@@H](C)O)CC2)ccc1Cl	ZINC000450956051	ED	On-Demand	Anodyne	OPRM1	0	41
COc1cc(CC(=O)N2CCN(C[C@@H](C)O)CC2)ccc1Cl	ZINC000450956051	ED	On-Demand	Anodyne	OPRK1	22	41
COc1cc(CC(=O)N2CCN(C[C@@H](C)O)CC2)ccc1Cl	ZINC000450956051	ED	On-Demand	Anodyne	HTR4	45	34
COc1cc(CC(=O)N2CCN(C[C@@H](C)O)CC2)ccc1Cl	ZINC000450956051	ED	On-Demand	Anodyne	CCR1	22	45
COc1cc(CC(=O)N2CCN(C[C@@H](C)O)CC2)ccc1Cl	ZINC000450956051	ED	On-Demand	Anodyne	KCNJ1	43	38
CN1CCN(CCC(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450956052	GD	On-Demand	Anodyne	CACNA1H	24	43
CN1CCN(CCC(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450956052	GD	On-Demand	Anodyne	PYGL	0	40
CN1CCN(CCC(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450956052	GD	On-Demand	Anodyne	CCKBR	20	40
CN1CCN(CCC(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450956052	GD	On-Demand	Anodyne	EPHX2	37	46
CN1CCN(CCC(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450956052	GD	On-Demand	Anodyne	MCHR1	32	46
CN1CCN(CCC(C)(C)NC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450956052	GD	On-Demand	Anodyne	CACNA1I	39	56
CN(CC1(c2ccccc2)CC1)C(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450956053	GH	On-Demand	Anodyne	CCR5	26	42
COC(=O)c1ncccc1S(=O)(=O)N1CCc2ccccc2C1	ZINC000450956060	ED	On-Demand	Anodyne	AKR1C3	65	46
OCCC[C@H]1CCN(c2nccc(Oc3ccccc3)n2)C1	ZINC000450956116	CF	On-Demand	Anodyne	DKK1	0	40
OCCC[C@@H]1CCN(c2nccc(Oc3ccccc3)n2)C1	ZINC000450956117	CF	On-Demand	Anodyne	DKK1	0	40
OCCC[C@@H]1CCN(c2ccc3ccc(Cl)cc3n2)C1	ZINC000450956122	CG	On-Demand	Anodyne	PDE1B	0	41
OCCC[C@H]1CCN(c2ccc3ccc(Cl)cc3n2)C1	ZINC000450956123	CG	On-Demand	Anodyne	PDE1B	0	41
CCC[C@H](CC(C)C)C(=O)Nc1cnns1	ZINC000450956124	BF	On-Demand	Anodyne	AHK3	0	40
CCC[C@@H](CC(C)C)C(=O)Nc1cnns1	ZINC000450956125	BF	On-Demand	Anodyne	AHK3	0	40
COC(=O)c1cccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)c1Cl	ZINC000450956137	FG	On-Demand	Anodyne	ETHR	47	35
COC(=O)c1cccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)c1Cl	ZINC000450956138	FG	On-Demand	Anodyne	ETHR	47	35
OCCC[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450956165	EF	On-Demand	Anodyne	PDE3A	48	37
OCCC[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450956165	EF	On-Demand	Anodyne	PDE3B	71	37
OCCC[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450956165	EF	On-Demand	Anodyne	SIRT3	51	32
OCCC[C@@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450956165	EF	On-Demand	Anodyne	SIRT2	52	32
OCCC[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450956166	EF	On-Demand	Anodyne	PDE3A	48	37
OCCC[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450956166	EF	On-Demand	Anodyne	PDE3B	71	37
OCCC[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450956166	EF	On-Demand	Anodyne	SIRT3	51	32
OCCC[C@H]1CCN(c2ncnc3cc(Br)ccc23)C1	ZINC000450956166	EF	On-Demand	Anodyne	SIRT2	52	32
C[C@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956192	FD	On-Demand	Anodyne	DRD2	17	40
C[C@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956192	FD	On-Demand	Anodyne	DRD4	21	41
C[C@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956192	FD	On-Demand	Anodyne	DRD3	29	40
C[C@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956192	FD	On-Demand	Anodyne	CNR2	18	40
C[C@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956192	FD	On-Demand	Anodyne	ACACA	0	44
C[C@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956192	FD	On-Demand	Anodyne	ACACB	26	45
C[C@@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956193	FD	On-Demand	Anodyne	DRD2	17	40
C[C@@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956193	FD	On-Demand	Anodyne	DRD4	21	41
C[C@@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956193	FD	On-Demand	Anodyne	DRD3	29	40
C[C@@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956193	FD	On-Demand	Anodyne	CNR2	18	40
C[C@@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956193	FD	On-Demand	Anodyne	ACACA	0	44
C[C@@H]1CN(CCO)CCN1c1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000450956193	FD	On-Demand	Anodyne	ACACB	26	45
O=[N+]([O-])c1ccc2nc(N3CC[C@@H](CCCO)C3)ccc2c1	ZINC000450956214	DF	On-Demand	Bother	SLC6A4	0	52
O=[N+]([O-])c1ccc2nc(N3CC[C@H](CCCO)C3)ccc2c1	ZINC000450956215	DF	On-Demand	Bother	SLC6A4	0	52
OCCC[C@H]1CCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450956238	CF	On-Demand	Anodyne	SORD	51	36
OCCC[C@@H]1CCN(c2ccnc(-c3ccccc3)n2)C1	ZINC000450956239	CF	On-Demand	Anodyne	SORD	51	36
C[C@@H]1CN(CCO)CCN1c1nc2ccccc2[nH]1	ZINC000450956247	CD	On-Demand	Anodyne	KCNN3	30	43
C[C@H]1CN(CCO)CCN1c1nc2ccccc2[nH]1	ZINC000450956248	CD	On-Demand	Anodyne	KCNN3	30	43
CCc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2s1	ZINC000450956273	CF	On-Demand	Anodyne	SIRT3	52	33
CCc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2s1	ZINC000450956273	CF	On-Demand	Anodyne	SIRT2	52	33
CCc1cc2c(N3CC[C@@H](CCCO)C3)ncnc2s1	ZINC000450956273	CF	On-Demand	Anodyne	SIRT1	52	33
CCc1cc2c(N3CC[C@H](CCCO)C3)ncnc2s1	ZINC000450956274	CF	On-Demand	Anodyne	SIRT3	52	33
CCc1cc2c(N3CC[C@H](CCCO)C3)ncnc2s1	ZINC000450956274	CF	On-Demand	Anodyne	SIRT2	52	33
CCc1cc2c(N3CC[C@H](CCCO)C3)ncnc2s1	ZINC000450956274	CF	On-Demand	Anodyne	SIRT1	52	33
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccc(Cl)cn1	ZINC000450956286	GI	On-Demand	Anodyne	PRCP	22	51
CN(CC1(c2ccccc2)CC1)C(=O)CSC1CC1	ZINC000450956293	CG	On-Demand	Anodyne	KCNA3	32	43
CCN1CCN(c2cccc(NC(=O)CNS(=O)(=O)NC)c2)CC1	ZINC000450956304	FB	On-Demand	Anodyne	HTR1A	29	55
CCN1CCN(c2cccc(NC(=O)CNS(=O)(=O)NC)c2)CC1	ZINC000450956304	FB	On-Demand	Anodyne	HTR2A	26	41
CCN1CCN(c2cccc(NC(=O)CNS(=O)(=O)NC)c2)CC1	ZINC000450956304	FB	On-Demand	Anodyne	HTR7	37	48
CCN1CCN(c2cccc(NC(=O)CNS(=O)(=O)NC)c2)CC1	ZINC000450956304	FB	On-Demand	Anodyne	PRNP	24	40
CCOC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccccc2)cnc1C(F)F	ZINC000450956310	GG	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1cc(S(=O)(=O)N[C@H](C)c2ccccc2)cnc1C(F)F	ZINC000450956310	GG	On-Demand	Anodyne	ADAMTS4	47	39
CCOC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccccc2)cnc1C(F)F	ZINC000450956312	GG	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2ccccc2)cnc1C(F)F	ZINC000450956312	GG	On-Demand	Anodyne	ADAMTS4	47	39
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1ccccc1F	ZINC000450956323	DH	On-Demand	Anodyne	CHRNA10	25	45
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1ccccc1F	ZINC000450956324	DH	On-Demand	Anodyne	CHRNA10	25	45
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1ccccc1F	ZINC000450956325	DH	On-Demand	Anodyne	CHRNA10	25	45
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1ccccc1F	ZINC000450956326	DH	On-Demand	Anodyne	CHRNA10	25	45
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc(OC)c(OC)c2)c1	ZINC000450956333	GH	On-Demand	Anodyne	PFMRK	0	42
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc(OC)c(OC)c2)c1	ZINC000450956333	GH	On-Demand	Anodyne	MOGAT2	21	44
CCOC(=O)[C@H](NC(=O)c1cc(C)n(C(C)C)n1)c1cccc(C)c1C	ZINC000450956345	FG	On-Demand	Anodyne	CTSA	57	42
CCOC(=O)[C@@H](NC(=O)c1cc(C)n(C(C)C)n1)c1cccc(C)c1C	ZINC000450956348	FG	On-Demand	Anodyne	CTSA	57	42
C[C@@H](O)CN1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450956360	FC	On-Demand	Anodyne	AKR1C3	25	40
COc1ccc(S(=O)(=O)Cc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450956364	FI	On-Demand	Anodyne	BMP1	29	41
COc1ccc(S(=O)(=O)Cc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450956364	FI	On-Demand	Anodyne	MMP13	30	46
COc1ccc(S(=O)(=O)Cc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450956367	FI	On-Demand	Anodyne	BMP1	29	41
COc1ccc(S(=O)(=O)Cc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450956367	FI	On-Demand	Anodyne	MMP13	30	46
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000450956374	EE	On-Demand	Anodyne	PREP	52	43
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000450956375	EE	On-Demand	Anodyne	PREP	52	43
Cc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c2c1CCC2	ZINC000450956376	EF	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c2c1CCC2	ZINC000450956376	EF	On-Demand	Anodyne	L3MBTL3	70	41
Cc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c2c1CCC2	ZINC000450956376	EF	On-Demand	Anodyne	TP53BP1	0	41
CCOC(=O)c1ccc(CS(=O)(=O)NC(C)C)cc1	ZINC000450956378	CD	On-Demand	Anodyne	TMPRSS11D	83	38
CN(CCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450956387	ED	On-Demand	Anodyne	TACR3	38	41
CN(CCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450956387	ED	On-Demand	Anodyne	SLC12A5	55	33
CN(CCN1CCC[C@](O)(C(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450956388	ED	On-Demand	Anodyne	TACR3	38	41
CN(CCN1CCC[C@](O)(C(=O)N2CCCC2)C1)Cc1ccccc1	ZINC000450956388	ED	On-Demand	Anodyne	SLC12A5	55	33
CCOC(=O)c1cnc2ccccc2c1O[C@H]1C[C@H](C)CCC1=O	ZINC000450956399	EH	On-Demand	Anodyne	ADORA1	0	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1ccccc1	ZINC000450956400	DG	On-Demand	Anodyne	LTA4H	42	40
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1ccccc1	ZINC000450956400	DG	On-Demand	Anodyne	CHRNA10	43	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1ccccc1	ZINC000450956400	DG	On-Demand	Anodyne	PSMB2	46	35
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1ccccc1	ZINC000450956401	DG	On-Demand	Anodyne	LTA4H	42	40
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1ccccc1	ZINC000450956401	DG	On-Demand	Anodyne	CHRNA10	43	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1ccccc1	ZINC000450956401	DG	On-Demand	Anodyne	PSMB2	46	35
CCOC(=O)c1cnc2ccccc2c1O[C@H]1C[C@@H](C)CCC1=O	ZINC000450956402	EH	On-Demand	Anodyne	ADORA1	0	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1ccccc1	ZINC000450956403	DG	On-Demand	Anodyne	LTA4H	42	40
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1ccccc1	ZINC000450956403	DG	On-Demand	Anodyne	CHRNA10	43	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1ccccc1	ZINC000450956403	DG	On-Demand	Anodyne	PSMB2	46	35
CCOC(=O)c1cnc2ccccc2c1O[C@@H]1C[C@H](C)CCC1=O	ZINC000450956404	EH	On-Demand	Anodyne	ADORA1	0	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1ccccc1	ZINC000450956405	DG	On-Demand	Anodyne	LTA4H	42	40
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1ccccc1	ZINC000450956405	DG	On-Demand	Anodyne	CHRNA10	43	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1ccccc1	ZINC000450956405	DG	On-Demand	Anodyne	PSMB2	46	35
CCOC(=O)c1cnc2ccccc2c1O[C@@H]1C[C@@H](C)CCC1=O	ZINC000450956407	EH	On-Demand	Anodyne	ADORA1	0	41
CN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450956412	FE	On-Demand	Anodyne	RORC	26	47
CCOC(=O)c1cc(S(=O)(=O)Nc2ccccc2C)cnc1C(F)F	ZINC000450956413	FG	On-Demand	Anodyne	PRTN3	55	37
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956416	FJ	On-Demand	Anodyne	PRCP	21	55
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956416	FJ	On-Demand	Anodyne	CPT1A	107	41
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956417	FJ	On-Demand	Anodyne	PRCP	21	55
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956417	FJ	On-Demand	Anodyne	CPT1A	107	41
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956418	FJ	On-Demand	Anodyne	PRCP	21	55
O=C([C@H]1CCCCC1(F)F)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956418	FJ	On-Demand	Anodyne	CPT1A	107	41
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956420	FJ	On-Demand	Anodyne	PRCP	21	55
O=C([C@@H]1CCCCC1(F)F)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956420	FJ	On-Demand	Anodyne	CPT1A	107	41
COC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450956427	FG	On-Demand	Anodyne	HCN1	56	36
COC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450956427	FG	On-Demand	Anodyne	HCN4	55	37
COC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450956428	FG	On-Demand	Anodyne	HCN1	56	36
COC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450956428	FG	On-Demand	Anodyne	HCN4	55	37
COC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450956431	FG	On-Demand	Anodyne	HCN1	56	36
COC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450956431	FG	On-Demand	Anodyne	HCN4	55	37
COC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450956433	FG	On-Demand	Anodyne	HCN1	56	36
COC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450956433	FG	On-Demand	Anodyne	HCN4	55	37
CN(c1ccccc1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450956434	CG	On-Demand	Anodyne	NR1H3	0	51
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	CA2	27	56
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	CA1	33	44
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	MMP13	29	40
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	CA4	29	44
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	GRM4	15	59
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	CA14	16	47
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	MMP2	19	40
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	MMP12	40	35
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	CA12	21	56
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	CA9	24	43
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	LEF	39	41
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	IDO1	38	43
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	FFAR4	42	61
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	PFK	0	44
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450956438	FI	On-Demand	Anodyne	P96878_MYCTU	44	43
C[C@@H]1CN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450956443	GG	On-Demand	Anodyne	FKBP1A	16	44
C[C@@H]1CN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450956443	GG	On-Demand	Anodyne	SSTR3	108	35
C[C@@H]1CN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450956445	GG	On-Demand	Anodyne	FKBP1A	16	44
C[C@@H]1CN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450956445	GG	On-Demand	Anodyne	SSTR3	108	35
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C)cc2)c(F)c1	ZINC000450956455	GG	On-Demand	Anodyne	SGK1	53	39
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C)cc2)c(F)c1	ZINC000450956455	GG	On-Demand	Anodyne	ALPL	17	41
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	FKBP1A	22	45
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	ELANE	41	34
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	MMP13	34	44
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	ITGA4	72	40
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	CAPNS1	24	49
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	MMP3	34	41
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	MMP8	23	40
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	CAPN1	21	52
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	MMP9	22	44
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	MMP7	47	41
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	MMP1	38	44
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	SFRP1	54	34
C[C@H](NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1)c1cncs1	ZINC000450956458	FE	On-Demand	Anodyne	WNT3	55	34
CCOC(=O)[C@H](NC(=O)c1cn(-c2cccnc2)nn1)c1cccc(C)c1C	ZINC000450956465	GE	On-Demand	Anodyne	ESRRA	20	40
CCOC(=O)[C@@H](NC(=O)c1cn(-c2cccnc2)nn1)c1cccc(C)c1C	ZINC000450956466	GE	On-Demand	Anodyne	ESRRA	20	40
Cc1cccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1Br	ZINC000450956482	FI	On-Demand	Anodyne	HRH3	29	40
Cc1cccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1Br	ZINC000450956482	FI	On-Demand	Anodyne	EPHX2	17	45
Cc1cccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1Br	ZINC000450956483	FI	On-Demand	Anodyne	HRH3	29	40
Cc1cccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1Br	ZINC000450956483	FI	On-Demand	Anodyne	EPHX2	17	45
COC(=O)c1ccc(CN2CC[C@@H](c3nc(C)no3)C2)cc1Cl	ZINC000450956489	EF	On-Demand	Anodyne	SSTR5	56	36
COC(=O)c1ccc(CN2CC[C@@H](c3nc(C)no3)C2)cc1Cl	ZINC000450956489	EF	On-Demand	Anodyne	PDK1	47	37
COC(=O)c1ccc(CN2CC[C@@H](c3nc(C)no3)C2)cc1Cl	ZINC000450956489	EF	On-Demand	Anodyne	MCHR1	28	41
COC(=O)c1ccc(CN2CC[C@H](c3nc(C)no3)C2)cc1Cl	ZINC000450956490	EF	On-Demand	Anodyne	SSTR5	56	36
COC(=O)c1ccc(CN2CC[C@H](c3nc(C)no3)C2)cc1Cl	ZINC000450956490	EF	On-Demand	Anodyne	PDK1	47	37
COC(=O)c1ccc(CN2CC[C@H](c3nc(C)no3)C2)cc1Cl	ZINC000450956490	EF	On-Demand	Anodyne	MCHR1	28	41
CCOc1ccc(S(=O)(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450956497	EH	On-Demand	Anodyne	CA7	15	43
CO[C@H]1C[C@@H](CN(C)CCCC(=O)c2ccc(F)cc2)N(C)C1	ZINC000450956502	DE	On-Demand	Anodyne	DRD4	15	40
N#Cc1cncn(CCCCc2ccc(Cl)c(Cl)c2)c1=O	ZINC000450956510	DG	On-Demand	Mild	DNAE	42	32
O=[N+]([O-])c1cccc2ncnc(N3CC[C@@H](CCCO)C3)c12	ZINC000450956559	DE	On-Demand	Bother	SIRT3	43	32
O=[N+]([O-])c1cccc2ncnc(N3CC[C@@H](CCCO)C3)c12	ZINC000450956559	DE	On-Demand	Bother	SIRT2	44	31
O=[N+]([O-])c1cccc2ncnc(N3CC[C@@H](CCCO)C3)c12	ZINC000450956559	DE	On-Demand	Bother	SIRT1	40	31
O=[N+]([O-])c1cccc2ncnc(N3CC[C@H](CCCO)C3)c12	ZINC000450956560	DE	On-Demand	Bother	SIRT3	43	32
O=[N+]([O-])c1cccc2ncnc(N3CC[C@H](CCCO)C3)c12	ZINC000450956560	DE	On-Demand	Bother	SIRT2	44	31
O=[N+]([O-])c1cccc2ncnc(N3CC[C@H](CCCO)C3)c12	ZINC000450956560	DE	On-Demand	Bother	SIRT1	40	31
COc1ccccc1Oc1ccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)nc1	ZINC000450956561	GF	On-Demand	Anodyne	CCR8	28	41
COc1ccccc1Oc1ccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)nc1	ZINC000450956562	GF	On-Demand	Anodyne	CCR8	28	41
CC1CCN(C(=O)c2ccc(N3CC[C@H](CCCO)C3)nc2)CC1	ZINC000450956577	EF	On-Demand	Anodyne	ENPP2	20	40
CC1CCN(C(=O)c2ccc(N3CC[C@@H](CCCO)C3)nc2)CC1	ZINC000450956578	EF	On-Demand	Anodyne	ENPP2	20	40
COC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc(OC)cc1OC	ZINC000450956579	GF	On-Demand	Anodyne	GPR88	0	41
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc(OC)cc1OC	ZINC000450956580	GF	On-Demand	Anodyne	GPR88	0	41
O=S(=O)(c1ccc(N2CC[C@H](CCCO)C2)nc1)N1CCCC1	ZINC000450956591	ED	On-Demand	Anodyne	GCK	22	42
O=S(=O)(c1ccc(N2CC[C@@H](CCCO)C2)nc1)N1CCCC1	ZINC000450956592	ED	On-Demand	Anodyne	GCK	22	42
CC(C)NC(=O)c1ccc(N2CC[C@@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450956593	EE	On-Demand	Bother	TAAR1	18	45
CC(C)NC(=O)c1ccc(N2CC[C@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450956594	EE	On-Demand	Bother	TAAR1	18	45
OCCC[C@H]1CCN(c2nc3ccccc3nc2N2CCCC2)C1	ZINC000450956598	EF	On-Demand	Anodyne	PDE1B	0	45
OCCC[C@@H]1CCN(c2nc3ccccc3nc2N2CCCC2)C1	ZINC000450956599	EF	On-Demand	Anodyne	PDE1B	0	45
COC(=O)c1ccc(CN2C(=O)N[C@](C)(C3CCCC3)C2=O)cc1Cl	ZINC000450956610	FG	On-Demand	Anodyne	Q9FYV8_MAIZE	45	40
COC(=O)c1ccc(CN2C(=O)N[C@@](C)(C3CCCC3)C2=O)cc1Cl	ZINC000450956611	FG	On-Demand	Anodyne	Q9FYV8_MAIZE	45	40
N#Cc1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450956614	BD	On-Demand	Mild	SMO	0	42
N#Cc1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450956615	BD	On-Demand	Mild	SMO	0	42
N#Cc1ccc(N2CC[C@@H](CCCO)C2)cc1C(F)(F)F	ZINC000450956627	CG	On-Demand	Mild	AR	24	46
N#Cc1ccc(N2CC[C@H](CCCO)C2)cc1C(F)(F)F	ZINC000450956628	CG	On-Demand	Mild	AR	24	46
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](CCCO)C3)nc2)cc1	ZINC000450956629	EG	On-Demand	Anodyne	PRNP	53	38
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](CCCO)C3)nc2)cc1	ZINC000450956629	EG	On-Demand	Anodyne	HDAC1	29	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](CCCO)C3)nc2)cc1	ZINC000450956629	EG	On-Demand	Anodyne	P4HTM	0	47
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](CCCO)C3)nc2)cc1	ZINC000450956629	EG	On-Demand	Anodyne	DGAT1	42	43
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](CCCO)C3)nc2)cc1	ZINC000450956630	EG	On-Demand	Anodyne	PRNP	53	38
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](CCCO)C3)nc2)cc1	ZINC000450956630	EG	On-Demand	Anodyne	HDAC1	29	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](CCCO)C3)nc2)cc1	ZINC000450956630	EG	On-Demand	Anodyne	P4HTM	0	47
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](CCCO)C3)nc2)cc1	ZINC000450956630	EG	On-Demand	Anodyne	DGAT1	42	43
OCCC[C@@H]1CCN(c2ccc3cc(Br)ccc3n2)C1	ZINC000450956633	EH	On-Demand	Anodyne	PDE1B	0	40
OCCC[C@H]1CCN(c2ccc3cc(Br)ccc3n2)C1	ZINC000450956634	EH	On-Demand	Anodyne	PDE1B	0	40
CC(C)c1nccc(N2CCN(CCO)C[C@H]2C)n1	ZINC000450956653	CD	On-Demand	Anodyne	SORD	73	49
CC(C)c1nccc(N2CCN(CCO)C[C@@H]2C)n1	ZINC000450956654	CD	On-Demand	Anodyne	SORD	73	49
C[C@@H]1CN(CCO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450956655	CC	On-Demand	Anodyne	P2RY12	25	41
C[C@@H]1CN(CCO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450956655	CC	On-Demand	Anodyne	CXCR3	35	50
C[C@H]1CN(CCO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450956656	CC	On-Demand	Anodyne	P2RY12	25	41
C[C@H]1CN(CCO)CCN1c1ncc(C(N)=O)cc1Cl	ZINC000450956656	CC	On-Demand	Anodyne	CXCR3	35	50
COc1cc2c(N3CCN(CCO)C[C@H]3C)ncnc2cc1F	ZINC000450956670	DD	On-Demand	Anodyne	PDE3A	51	38
COc1cc2c(N3CCN(CCO)C[C@H]3C)ncnc2cc1F	ZINC000450956670	DD	On-Demand	Anodyne	PDGFRB	64	36
COc1cc2c(N3CCN(CCO)C[C@H]3C)ncnc2cc1F	ZINC000450956670	DD	On-Demand	Anodyne	PDE3B	75	38
COc1cc2c(N3CCN(CCO)C[C@@H]3C)ncnc2cc1F	ZINC000450956671	DD	On-Demand	Anodyne	PDE3A	51	38
COc1cc2c(N3CCN(CCO)C[C@@H]3C)ncnc2cc1F	ZINC000450956671	DD	On-Demand	Anodyne	PDGFRB	64	36
COc1cc2c(N3CCN(CCO)C[C@@H]3C)ncnc2cc1F	ZINC000450956671	DD	On-Demand	Anodyne	PDE3B	75	38
O=C(c1cnc(N2CC[C@@H](CCCO)C2)c(Cl)c1)N1CCOCC1	ZINC000450956672	FD	On-Demand	Anodyne	CXCR3	30	42
O=C(c1cnc(N2CC[C@H](CCCO)C2)c(Cl)c1)N1CCOCC1	ZINC000450956673	FD	On-Demand	Anodyne	CXCR3	30	42
COC(=O)[C@H](NC(=O)[C@H]1CCCCC1(F)F)c1ccc(OC)c(Cl)c1	ZINC000450956676	GH	On-Demand	Anodyne	HTR4	46	34
COC(=O)[C@@H](NC(=O)[C@@H]1CCCCC1(F)F)c1ccc(OC)c(Cl)c1	ZINC000450956677	GH	On-Demand	Anodyne	HTR4	46	34
COC(=O)[C@@H](NC(=O)[C@H]1CCCCC1(F)F)c1ccc(OC)c(Cl)c1	ZINC000450956678	GH	On-Demand	Anodyne	HTR4	46	34
COC(=O)[C@H](NC(=O)[C@@H]1CCCCC1(F)F)c1ccc(OC)c(Cl)c1	ZINC000450956679	GH	On-Demand	Anodyne	HTR4	46	34
COc1ccc(S(=O)(=O)C[C@H]2CCC(F)(F)C2)cc1	ZINC000450956698	CF	On-Demand	Anodyne	MMP2	23	42
COc1ccc(S(=O)(=O)C[C@H]2CCC(F)(F)C2)cc1	ZINC000450956698	CF	On-Demand	Anodyne	MMP14	25	42
COc1ccc(S(=O)(=O)C[C@H]2CCC(F)(F)C2)cc1	ZINC000450956698	CF	On-Demand	Anodyne	MMP9	30	41
COc1ccc(S(=O)(=O)C[C@@H]2CCC(F)(F)C2)cc1	ZINC000450956699	CF	On-Demand	Anodyne	MMP2	23	42
COc1ccc(S(=O)(=O)C[C@@H]2CCC(F)(F)C2)cc1	ZINC000450956699	CF	On-Demand	Anodyne	MMP14	25	42
COc1ccc(S(=O)(=O)C[C@@H]2CCC(F)(F)C2)cc1	ZINC000450956699	CF	On-Demand	Anodyne	MMP9	30	41
COC(=O)[C@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc(OC)c(Cl)c1	ZINC000450956704	FD	On-Demand	Anodyne	HTR4	57	36
COC(=O)[C@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc(OC)c(Cl)c1	ZINC000450956704	FD	On-Demand	Anodyne	P2RX7	24	45
COC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(OC)c(Cl)c1	ZINC000450956705	FD	On-Demand	Anodyne	HTR4	57	36
COC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(OC)c(Cl)c1	ZINC000450956705	FD	On-Demand	Anodyne	P2RX7	24	45
COC(=O)[C@@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc(OC)c(Cl)c1	ZINC000450956706	FD	On-Demand	Anodyne	HTR4	57	36
COC(=O)[C@@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc(OC)c(Cl)c1	ZINC000450956706	FD	On-Demand	Anodyne	P2RX7	24	45
COC(=O)[C@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(OC)c(Cl)c1	ZINC000450956707	FD	On-Demand	Anodyne	HTR4	57	36
COC(=O)[C@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(OC)c(Cl)c1	ZINC000450956707	FD	On-Demand	Anodyne	P2RX7	24	45
O=S(=O)(C[C@@H]1CCCCC1(F)F)N1CCN(Cc2ccccc2)CC1	ZINC000450956712	FF	On-Demand	Anodyne	SIGMAR1	66	46
O=S(=O)(C[C@@H]1CCCCC1(F)F)N1CCN(Cc2ccccc2)CC1	ZINC000450956712	FF	On-Demand	Anodyne	TRPV4	16	41
O=S(=O)(C[C@@H]1CCCCC1(F)F)N1CCN(Cc2ccccc2)CC1	ZINC000450956712	FF	On-Demand	Anodyne	CACNA1G	17	42
O=S(=O)(C[C@H]1CCCCC1(F)F)N1CCN(Cc2ccccc2)CC1	ZINC000450956713	FF	On-Demand	Anodyne	SIGMAR1	66	46
O=S(=O)(C[C@H]1CCCCC1(F)F)N1CCN(Cc2ccccc2)CC1	ZINC000450956713	FF	On-Demand	Anodyne	TRPV4	16	41
O=S(=O)(C[C@H]1CCCCC1(F)F)N1CCN(Cc2ccccc2)CC1	ZINC000450956713	FF	On-Demand	Anodyne	CACNA1G	17	42
CN(CC1(c2ccccc2)CC1)C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450956724	FH	On-Demand	Anodyne	NMBR	46	33
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	CA2	28	49
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	CA1	41	55
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	MMP13	40	40
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	SCN2A	22	46
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	CA4	36	46
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	CA14	24	54
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	MMP2	34	47
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	MMP9	26	42
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	MMP12	47	39
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	MMP7	23	40
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	ADAMTS4	51	37
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	LEF	59	42
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	IDO1	37	40
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956731	CE	On-Demand	Anodyne	P96878_MYCTU	44	40
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	CA2	28	49
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	CA1	41	55
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	MMP13	40	40
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	SCN2A	22	46
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	CA4	36	46
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	CA14	24	54
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	MMP2	34	47
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	MMP9	26	42
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	MMP12	47	39
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	MMP7	23	40
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	ADAMTS4	51	37
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	LEF	59	42
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	IDO1	37	40
CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450956732	CE	On-Demand	Anodyne	P96878_MYCTU	44	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	CA4	20	44
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	PKM	17	48
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	ALPL	20	52
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	MTNN	89	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	POL	0	45
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	IDO1	19	47
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	ALPI	15	42
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	LIMK2	48	53
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1	ZINC000450956741	GF	On-Demand	Anodyne	UQCRB	0	45
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	CA2	46	58
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	ADRB2	39	52
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	ADRB1	27	52
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	ADRB3	43	52
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	CA1	49	58
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	CA7	21	48
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	CA4	40	48
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	CA14	23	48
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	ACR	63	37
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	CA12	30	53
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	CA9	34	53
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	LEF	52	36
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	PFK	0	42
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	LIMK2	50	41
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450956746	GG	On-Demand	Anodyne	P96878_MYCTU	45	37
CSc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450956747	GF	On-Demand	Anodyne	GPR119	0	42
CSc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450956747	GF	On-Demand	Anodyne	LUXN	0	46
CSc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450956747	GF	On-Demand	Anodyne	ADIPOR1	0	40
CSc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450956747	GF	On-Demand	Anodyne	ADIPOR2	0	40
C[C@H](NC(=O)C1(C(F)(F)F)CCC1)c1ccc(Cl)cn1	ZINC000450956754	DH	On-Demand	Anodyne	SDH1	0	51
C[C@H]1OCCN(CCCC(=O)c2ccccc2)[C@@H]1C(N)=O	ZINC000450956792	CD	On-Demand	Anodyne	CYP2J2	56	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1	ZINC000450956793	GF	On-Demand	Anodyne	CA2	16	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1	ZINC000450956793	GF	On-Demand	Anodyne	CA1	21	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1	ZINC000450956793	GF	On-Demand	Anodyne	MMP13	24	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1	ZINC000450956793	GF	On-Demand	Anodyne	CA4	21	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1	ZINC000450956793	GF	On-Demand	Anodyne	MMP2	15	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1	ZINC000450956793	GF	On-Demand	Anodyne	PKM	41	38
CCOC(=O)c1ccc(Cn2cc([N+](=O)[O-])c(C)n2)nc1	ZINC000450956794	CD	On-Demand	Bother	GSTM2	17	41
CN1C(=O)CC[C@@H]1C(=O)NC(C)(C)c1cccc(Cl)c1F	ZINC000450956797	DE	On-Demand	Anodyne	P2RX7	62	53
CN1C(=O)CC[C@H]1C(=O)NC(C)(C)c1cccc(Cl)c1F	ZINC000450956798	DE	On-Demand	Anodyne	P2RX7	62	53
COc1cc(CC(=O)N2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450956802	FE	On-Demand	Anodyne	OPRK1	33	45
COc1cc(CC(=O)N2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450956802	FE	On-Demand	Anodyne	HTR4	41	40
COc1cc(CC(=O)N2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450956802	FE	On-Demand	Anodyne	CCR1	24	44
COc1cc(CC(=O)N2CCCN(C(=O)C3CC3)CC2)ccc1Cl	ZINC000450956802	FE	On-Demand	Anodyne	PREP	41	34
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956807	GJ	On-Demand	Anodyne	PRCP	50	65
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956807	GJ	On-Demand	Anodyne	CPT1A	130	43
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956807	GJ	On-Demand	Anodyne	CPT2	45	35
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956807	GJ	On-Demand	Anodyne	PREP	58	37
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956808	GJ	On-Demand	Anodyne	PRCP	50	65
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956808	GJ	On-Demand	Anodyne	CPT1A	130	43
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956808	GJ	On-Demand	Anodyne	CPT2	45	35
CC(C)(C)C(=O)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450956808	GJ	On-Demand	Anodyne	PREP	58	37
CNS(=O)(=O)NCC(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450956816	GC	On-Demand	Anodyne	UTS2	33	41
CNS(=O)(=O)NCC(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450956817	GC	On-Demand	Anodyne	UTS2	33	41
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450956823	FG	On-Demand	Anodyne	DRD4	30	46
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450956823	FG	On-Demand	Anodyne	TPP2	43	30
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450956824	FG	On-Demand	Anodyne	DRD4	30	46
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450956824	FG	On-Demand	Anodyne	TPP2	43	30
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450956825	FG	On-Demand	Anodyne	DRD4	30	46
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450956825	FG	On-Demand	Anodyne	TPP2	43	30
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450956826	FG	On-Demand	Anodyne	DRD4	30	46
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450956826	FG	On-Demand	Anodyne	TPP2	43	30
CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(CCCC(=O)c2ccccc2)C1	ZINC000450956853	FG	On-Demand	Anodyne	CYP2J2	48	36
NS(=O)(=O)c1ccc(N2CC[C@H](CCCO)C2)c(C(F)(F)F)c1	ZINC000450956855	FD	On-Demand	Anodyne	HSD11B1	22	42
NS(=O)(=O)c1ccc(N2CC[C@H](CCCO)C2)c(C(F)(F)F)c1	ZINC000450956855	FD	On-Demand	Anodyne	LIPG	46	35
NS(=O)(=O)c1ccc(N2CC[C@@H](CCCO)C2)c(C(F)(F)F)c1	ZINC000450956857	FD	On-Demand	Anodyne	HSD11B1	22	42
NS(=O)(=O)c1ccc(N2CC[C@@H](CCCO)C2)c(C(F)(F)F)c1	ZINC000450956857	FD	On-Demand	Anodyne	LIPG	46	35
NC(=O)[C@@H]1C[C@@H](F)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450956864	CD	On-Demand	Anodyne	DRD2	27	40
NC(=O)[C@@H]1C[C@@H](F)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450956864	CD	On-Demand	Anodyne	CYP2J2	43	31
CN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450956871	DD	On-Demand	Anodyne	DRD2	35	45
CN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450956871	DD	On-Demand	Anodyne	DRD4	25	56
CN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450956871	DD	On-Demand	Anodyne	HTR2A	35	56
CN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450956871	DD	On-Demand	Anodyne	HTR2C	30	59
CN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450956871	DD	On-Demand	Anodyne	SLC18A3	0	48
CN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450956871	DD	On-Demand	Anodyne	HTR3B	0	45
CN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450956871	DD	On-Demand	Anodyne	CYP2J2	59	42
CN(CC1(c2ccccc2)CC1)C(=O)C1(C(=O)C2CC2)CC1	ZINC000450956882	CF	On-Demand	Anodyne	SLC6A2	0	45
CN(CC1(c2ccccc2)CC1)C(=O)C1(C(=O)C2CC2)CC1	ZINC000450956882	CF	On-Demand	Anodyne	KCNA3	35	45
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	DRD2	33	56
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	DRD1	15	46
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	DRD4	23	48
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	HTR2A	45	55
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	HTR2C	24	54
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	PRCP	19	41
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956897	EH	On-Demand	Anodyne	ETHR	64	42
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	DRD2	33	56
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	DRD1	15	46
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	DRD4	23	48
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	HTR2A	45	55
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	HTR2C	24	54
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	ERG2	19	42
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	PRCP	19	41
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	SLC18A3	0	41
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	HTR3B	0	44
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	CYP2J2	56	40
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccc(F)cc1	ZINC000450956900	EH	On-Demand	Anodyne	ETHR	64	42
COc1cccc(OCCC(=O)NCC2(CO)CCCC2)c1	ZINC000450956906	DE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)NCC2(CO)CCCC2)c1	ZINC000450956906	DE	On-Demand	Anodyne	HRH2	28	40
COc1cccc(OCCC(=O)NCC2(CO)CCCC2)c1	ZINC000450956906	DE	On-Demand	Anodyne	MTNR1A	51	43
COc1cccc(OCCC(=O)NCC2(CO)CCCC2)c1	ZINC000450956906	DE	On-Demand	Anodyne	MTNR1B	48	43
COc1ccc(OC(F)(F)F)c(C(=O)N[C@H](C)c2ccc(Cl)cn2)c1	ZINC000450956908	FI	On-Demand	Anodyne	F10	49	32
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H](C)c2ccc(Cl)cn2)c1	ZINC000450956909	FI	On-Demand	Anodyne	F10	49	32
CC(=O)CCCCCn1nnn(C2CC2)c1=O	ZINC000450956919	BC	On-Demand	Anodyne	PAOX	40	38
Cc1cc(N2CC3(CCCC3)[C@@H]2C(C)C)n2ncnc2n1	ZINC000450956943	CF	On-Demand	Anodyne	DHOD	0	42
Cc1cc(N2CC3(CCCC3)[C@H]2C(C)C)n2ncnc2n1	ZINC000450956944	CF	On-Demand	Anodyne	DHOD	0	42
C[C@H]1CN(CCO)CCN1c1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450956991	FD	On-Demand	Anodyne	NPBWR1	37	40
C[C@@H]1CN(CCO)CCN1c1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000450956993	FD	On-Demand	Anodyne	NPBWR1	37	40
COC(=O)CC1(CNC(=O)Cc2scnc2-c2ccccc2)CCCCC1	ZINC000450956994	GH	On-Demand	Anodyne	HCN1	51	32
COC(=O)CC1(CNC(=O)Cc2scnc2-c2ccccc2)CCCCC1	ZINC000450956994	GH	On-Demand	Anodyne	HCN4	49	32
COc1cccc(Oc2ccc(C(=O)Nc3c4c(nn3C(C)C)CCC4)nc2)c1	ZINC000450956999	GI	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@H](NC(=O)c1cnn2ccc(C)cc12)c1ccc(OC)cc1OC	ZINC000450957010	GE	On-Demand	Anodyne	EPHB3	35	48
COC(=O)[C@@H](NC(=O)c1cnn2ccc(C)cc12)c1ccc(OC)cc1OC	ZINC000450957015	GE	On-Demand	Anodyne	EPHB3	35	48
COC(=O)[C@H](NC(=O)C(CC(C)C)CC(C)C)c1ccc(OC)c(O)c1	ZINC000450957034	FG	On-Demand	Anodyne	FOLH1	58	51
COC(=O)[C@@H](NC(=O)C(CC(C)C)CC(C)C)c1ccc(OC)c(O)c1	ZINC000450957036	FG	On-Demand	Anodyne	FOLH1	58	51
O=[N+]([O-])c1cc2c(N3CC[C@@H](CCCO)C3)ncnc2s1	ZINC000450957048	DE	On-Demand	Bother	SIRT3	45	34
O=[N+]([O-])c1cc2c(N3CC[C@@H](CCCO)C3)ncnc2s1	ZINC000450957048	DE	On-Demand	Bother	SIRT2	44	32
O=[N+]([O-])c1cc2c(N3CC[C@H](CCCO)C3)ncnc2s1	ZINC000450957050	DE	On-Demand	Bother	SIRT3	45	34
O=[N+]([O-])c1cc2c(N3CC[C@H](CCCO)C3)ncnc2s1	ZINC000450957050	DE	On-Demand	Bother	SIRT2	44	32
COC(=O)c1cccc(Cn2cnc(C(C)(C)C)cc2=O)c1Cl	ZINC000450957052	EG	On-Demand	Anodyne	MT-CYB	41	32
CCOc1ccc(S(=O)(=O)CC(=O)c2ccc(C(=O)OC)o2)cc1	ZINC000450957053	FE	On-Demand	Anodyne	MMP13	37	40
CCOc1ccc(S(=O)(=O)CC(=O)c2ccc(C(=O)OC)o2)cc1	ZINC000450957053	FE	On-Demand	Anodyne	MMP2	22	40
CCOc1ccc(S(=O)(=O)CC(=O)c2ccc(C(=O)OC)o2)cc1	ZINC000450957053	FE	On-Demand	Anodyne	MMP3	17	40
CCOc1ccc(S(=O)(=O)CC(=O)c2ccc(C(=O)OC)o2)cc1	ZINC000450957053	FE	On-Demand	Anodyne	MMP1	25	40
COc1cccc2c(N3CC[C@@H](CCCO)C3)nccc12	ZINC000450957054	CF	On-Demand	Anodyne	PDE3A	48	37
COc1cccc2c(N3CC[C@@H](CCCO)C3)nccc12	ZINC000450957054	CF	On-Demand	Anodyne	PDE3B	71	37
COc1cccc2c(N3CC[C@H](CCCO)C3)nccc12	ZINC000450957055	CF	On-Demand	Anodyne	PDE3A	48	37
COc1cccc2c(N3CC[C@H](CCCO)C3)nccc12	ZINC000450957055	CF	On-Demand	Anodyne	PDE3B	71	37
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450957086	FF	On-Demand	Anodyne	HTR1A	75	46
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450957086	FF	On-Demand	Anodyne	DRD2	66	45
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450957086	FF	On-Demand	Anodyne	ADRA1D	79	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450957086	FF	On-Demand	Anodyne	HTR2A	35	42
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450957086	FF	On-Demand	Anodyne	ADRA1A	60	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450957086	FF	On-Demand	Anodyne	ADRA1B	64	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450957086	FF	On-Demand	Anodyne	DRD3	53	42
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450957086	FF	On-Demand	Anodyne	HTR7	50	41
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450957087	FF	On-Demand	Anodyne	HTR1A	75	46
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450957087	FF	On-Demand	Anodyne	DRD2	66	45
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450957087	FF	On-Demand	Anodyne	ADRA1D	79	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450957087	FF	On-Demand	Anodyne	HTR2A	35	42
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450957087	FF	On-Demand	Anodyne	ADRA1A	60	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450957087	FF	On-Demand	Anodyne	ADRA1B	64	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450957087	FF	On-Demand	Anodyne	DRD3	53	42
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450957087	FF	On-Demand	Anodyne	HTR7	50	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	CA4	20	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	HSD17B1	41	46
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	ALPL	18	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	MTNN	82	38
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	HSD17B2	28	48
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	POL	0	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	PFK	0	51
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	LIMK2	48	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1	ZINC000450957088	GE	On-Demand	Anodyne	UQCRB	0	66
CCOC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)cnc1C(F)F	ZINC000450957091	GF	On-Demand	Anodyne	ADORA1	0	44
CCOC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)cnc1C(F)F	ZINC000450957091	GF	On-Demand	Anodyne	TBXA2R	44	36
CCOC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)cnc1C(F)F	ZINC000450957091	GF	On-Demand	Anodyne	ALOX15	51	36
CCOC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)cnc1C(F)F	ZINC000450957091	GF	On-Demand	Anodyne	PDS	49	38
COc1cccc(-n2cc(C(=O)N(C)CC3(c4ccccc4)CC3)nn2)c1	ZINC000450957094	FG	On-Demand	Anodyne	DRD4	40	30
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	CA2	27	60
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	CA1	34	60
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	KCNA5	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	BDKRB1	0	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	CA4	27	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	GRM4	22	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	CA14	15	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	MMP2	21	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	PRTN3	57	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	CA12	21	60
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	CA9	23	60
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	IDO1	30	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	MTCA1	32	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	P96878_MYCTU	41	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	DAC	20	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	ACAT	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1	ZINC000450957100	FI	On-Demand	Anodyne	UQCRB	0	42
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2)CC1	ZINC000450957110	FD	On-Demand	Anodyne	HTR7	19	41
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2)CC1	ZINC000450957110	FD	On-Demand	Anodyne	TGM2	26	40
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2)CC1	ZINC000450957110	FD	On-Demand	Anodyne	F13A1	34	45
Cc1csc(NS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)n1	ZINC000450957111	ED	On-Demand	Anodyne	GCK	15	47
CCS(=O)(=O)c1ccc(COc2ccc3c(c2)CCNC3=O)cc1	ZINC000450957112	EE	On-Demand	Anodyne	MAOB	41	48
CCS(=O)(=O)c1ccc(COc2ccc3c(c2)CCNC3=O)cc1	ZINC000450957112	EE	On-Demand	Anodyne	CSNK1G2	46	35
CCCCc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1	ZINC000450957113	FH	On-Demand	Anodyne	AGTR1B	0	40
C[C@@H](O)CN1CCN(C(=O)[C@@H](C)Oc2ccccn2)CC1	ZINC000450957120	CC	On-Demand	Anodyne	ABCB1	23	40
C[C@H](Oc1ccccn1)C(=O)N1CCN(C[C@@H](C)O)CC1	ZINC000450957121	CC	On-Demand	Anodyne	ABCB1	23	40
C=CCOc1ccc(CC(=O)NC(C)(C)CCN2CCN(C)CC2)cc1	ZINC000450957123	FE	On-Demand	Mild	LTA4H	20	40
O=c1cc(C(F)F)ncn1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450957127	EJ	On-Demand	Anodyne	DNAE	85	37
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)cc1	ZINC000450957141	FG	On-Demand	Anodyne	DHOD	0	44
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)cc1	ZINC000450957141	FG	On-Demand	Anodyne	NOD2	16	40
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)cc1	ZINC000450957141	FG	On-Demand	Anodyne	MGAT1	48	33
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOCc1ccccc1	ZINC000450957142	EH	On-Demand	Anodyne	UGCG	50	36
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOCc1ccccc1	ZINC000450957142	EH	On-Demand	Anodyne	GBA	28	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOCc1ccccc1	ZINC000450957142	EH	On-Demand	Anodyne	GBA2	63	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOCc1ccccc1	ZINC000450957142	EH	On-Demand	Anodyne	SLC12A5	49	34
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOCc1ccccc1	ZINC000450957143	EH	On-Demand	Anodyne	UGCG	50	36
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOCc1ccccc1	ZINC000450957143	EH	On-Demand	Anodyne	GBA	28	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOCc1ccccc1	ZINC000450957143	EH	On-Demand	Anodyne	GBA2	63	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOCc1ccccc1	ZINC000450957143	EH	On-Demand	Anodyne	SLC12A5	49	34
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOCc1ccccc1	ZINC000450957144	EH	On-Demand	Anodyne	UGCG	50	36
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOCc1ccccc1	ZINC000450957144	EH	On-Demand	Anodyne	GBA	28	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOCc1ccccc1	ZINC000450957144	EH	On-Demand	Anodyne	GBA2	63	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOCc1ccccc1	ZINC000450957144	EH	On-Demand	Anodyne	SLC12A5	49	34
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOCc1ccccc1	ZINC000450957145	EH	On-Demand	Anodyne	UGCG	50	36
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOCc1ccccc1	ZINC000450957145	EH	On-Demand	Anodyne	GBA	28	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOCc1ccccc1	ZINC000450957145	EH	On-Demand	Anodyne	GBA2	63	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOCc1ccccc1	ZINC000450957145	EH	On-Demand	Anodyne	SLC12A5	49	34
O=S(=O)(CCC1CCCC1)NCCc1ccccc1	ZINC000450957146	CF	On-Demand	Anodyne	SLC18A2	40	34
CCOC(=O)[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1cccc(C)c1C	ZINC000450957147	GG	On-Demand	Anodyne	MMP13	0	40
CCOC(=O)[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1cccc(C)c1C	ZINC000450957148	GG	On-Demand	Anodyne	MMP13	0	40
CC(=O)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450957156	GE	On-Demand	Anodyne	FAAH	0	43
CC(=O)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450957156	GE	On-Demand	Anodyne	PRTN3	52	35
CC(=O)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450957156	GE	On-Demand	Anodyne	HIF1A	23	42
CC(=O)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450957156	GE	On-Demand	Anodyne	GPR119	0	45
CC(=O)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450957156	GE	On-Demand	Anodyne	LIMK2	40	38
CC(=O)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450957156	GE	On-Demand	Anodyne	LUXN	0	47
CC(=O)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450957156	GE	On-Demand	Anodyne	ADIPOR1	0	45
CC(=O)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450957156	GE	On-Demand	Anodyne	ADIPOR2	0	45
COc1cc(CC(=O)NC(C)(C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450957157	FE	On-Demand	Anodyne	DRD4	41	32
COc1cc(CC(=O)NC(C)(C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450957157	FE	On-Demand	Anodyne	HTR4	64	39
COc1cc(CC(=O)NC(C)(C)CCN2CCN(C)CC2)ccc1Cl	ZINC000450957157	FE	On-Demand	Anodyne	SIGMAR1	18	43
Cc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1C	ZINC000450957159	GG	On-Demand	Anodyne	RCE1	0	43
Cc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1C	ZINC000450957159	GG	On-Demand	Anodyne	PRTN3	51	33
Cc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1C	ZINC000450957159	GG	On-Demand	Anodyne	MTNN	84	38
COc1ccc2nc(NS(=O)(=O)C[C@@H](C)OC)sc2c1	ZINC000450957165	DE	On-Demand	Anodyne	P2RY12	0	47
COc1ccc2nc(NS(=O)(=O)C[C@@H](C)OC)sc2c1	ZINC000450957165	DE	On-Demand	Anodyne	CSNK1D	33	52
COc1ccc2nc(NS(=O)(=O)C[C@@H](C)OC)sc2c1	ZINC000450957165	DE	On-Demand	Anodyne	LUCI_PHOPE	31	40
COc1ccc2nc(NS(=O)(=O)C[C@@H](C)OC)sc2c1	ZINC000450957165	DE	On-Demand	Anodyne	ISPD	0	45
COc1ccc2nc(NS(=O)(=O)C[C@H](C)OC)sc2c1	ZINC000450957166	DE	On-Demand	Anodyne	P2RY12	0	47
COc1ccc2nc(NS(=O)(=O)C[C@H](C)OC)sc2c1	ZINC000450957166	DE	On-Demand	Anodyne	CSNK1D	33	52
COc1ccc2nc(NS(=O)(=O)C[C@H](C)OC)sc2c1	ZINC000450957166	DE	On-Demand	Anodyne	LUCI_PHOPE	31	40
COc1ccc2nc(NS(=O)(=O)C[C@H](C)OC)sc2c1	ZINC000450957166	DE	On-Demand	Anodyne	ISPD	0	45
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(C)c(C)c2)cnc1C(F)F	ZINC000450957167	GH	On-Demand	Anodyne	ALPL	17	40
CO[C@H](COc1ccc2c(c1)CCNC2=O)Cc1ccccc1	ZINC000450957173	DF	On-Demand	Anodyne	CSNK1G2	45	36
CO[C@H](COc1ccc2c(c1)CCNC2=O)Cc1ccccc1	ZINC000450957173	DF	On-Demand	Anodyne	PDS	40	33
CO[C@@H](COc1ccc2c(c1)CCNC2=O)Cc1ccccc1	ZINC000450957174	DF	On-Demand	Anodyne	CSNK1G2	45	36
CO[C@@H](COc1ccc2c(c1)CCNC2=O)Cc1ccccc1	ZINC000450957174	DF	On-Demand	Anodyne	PDS	40	33
C[C@@H]1CN(CCO)CCN1c1ccnc2cc(Br)ccc12	ZINC000450957183	FF	On-Demand	Anodyne	HRP1_PLAFA	44	32
C[C@H]1CN(CCO)CCN1c1ccnc2cc(Br)ccc12	ZINC000450957184	FF	On-Demand	Anodyne	HRP1_PLAFA	44	32
OCCC[C@@H]1CCN(c2ccnc(C3CC3)n2)C1	ZINC000450957189	BD	On-Demand	Anodyne	SORD	54	38
OCCC[C@H]1CCN(c2ccnc(C3CC3)n2)C1	ZINC000450957190	BD	On-Demand	Anodyne	SORD	54	38
COc1cccc2c(N3CC[C@H](CCCO)C3)cc(C)nc12	ZINC000450957193	DG	On-Demand	Anodyne	PDE3B	44	30
COc1cccc2c(N3CC[C@@H](CCCO)C3)cc(C)nc12	ZINC000450957194	DG	On-Demand	Anodyne	PDE3B	44	30
COc1ccc(CNC(=O)CCN2C[C@@H](OC)C[C@H]2CO)c(OC)c1	ZINC000450957207	FC	On-Demand	Anodyne	MTNR1A	44	33
C[C@@H]1CN(CCc2c(Cl)cccc2Cl)C[C@H]1C(=O)N1CCOCC1	ZINC000450957262	FF	On-Demand	Anodyne	CTSS	15	43
C[C@@H]1CN(CCc2c(Cl)cccc2Cl)C[C@H]1C(=O)N1CCOCC1	ZINC000450957262	FF	On-Demand	Anodyne	AKR1C3	26	40
O=C(NC1CC1)c1cc(N2CC[C@H](CCCO)C2)nc2ccccc12	ZINC000450957287	EF	On-Demand	Anodyne	ACACA	0	55
O=C(NC1CC1)c1cc(N2CC[C@H](CCCO)C2)nc2ccccc12	ZINC000450957287	EF	On-Demand	Anodyne	ACACB	26	55
O=C(NC1CC1)c1cc(N2CC[C@H](CCCO)C2)nc2ccccc12	ZINC000450957287	EF	On-Demand	Anodyne	TNKS	59	33
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957288	GI	On-Demand	Anodyne	PRCP	53	60
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957288	GI	On-Demand	Anodyne	COLA	123	45
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957288	GI	On-Demand	Anodyne	CPT1A	117	45
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957288	GI	On-Demand	Anodyne	GRIN2D	51	32
O=C(NC1CC1)c1cc(N2CC[C@@H](CCCO)C2)nc2ccccc12	ZINC000450957289	EF	On-Demand	Anodyne	ACACA	0	55
O=C(NC1CC1)c1cc(N2CC[C@@H](CCCO)C2)nc2ccccc12	ZINC000450957289	EF	On-Demand	Anodyne	ACACB	26	55
O=C(NC1CC1)c1cc(N2CC[C@@H](CCCO)C2)nc2ccccc12	ZINC000450957289	EF	On-Demand	Anodyne	TNKS	59	33
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957290	GI	On-Demand	Anodyne	PRCP	53	60
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957290	GI	On-Demand	Anodyne	COLA	123	45
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957290	GI	On-Demand	Anodyne	CPT1A	117	45
O=C(Cc1ccc(O)c(F)c1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957290	GI	On-Demand	Anodyne	GRIN2D	51	32
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C(N)=O	ZINC000450957307	CD	On-Demand	Anodyne	DRD2	31	45
C[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H]1C(N)=O	ZINC000450957307	CD	On-Demand	Anodyne	CYP2J2	52	37
COc1ccc(-c2csc3ncnc(N4CCN(CCO)C[C@@H]4C)c23)cc1	ZINC000450957334	GF	On-Demand	Anodyne	ADRB3	28	42
COc1ccc(-c2csc3ncnc(N4CCN(CCO)C[C@H]4C)c23)cc1	ZINC000450957337	GF	On-Demand	Anodyne	ADRB3	28	42
O=C(c1ccc(I)cc1F)N1CC(O)(C2CC2)C1	ZINC000450957351	FE	On-Demand	Anodyne	MAP2K1	26	49
Cc1cccc2ncnc(N3CC[C@@H](CCCO)C3)c12	ZINC000450957352	CF	On-Demand	Anodyne	PDE3A	44	33
Cc1cccc2ncnc(N3CC[C@@H](CCCO)C3)c12	ZINC000450957352	CF	On-Demand	Anodyne	PDE3B	65	33
Cc1cccc2ncnc(N3CC[C@@H](CCCO)C3)c12	ZINC000450957352	CF	On-Demand	Anodyne	SIRT2	52	35
Cc1cccc2ncnc(N3CC[C@H](CCCO)C3)c12	ZINC000450957354	CF	On-Demand	Anodyne	PDE3A	44	33
Cc1cccc2ncnc(N3CC[C@H](CCCO)C3)c12	ZINC000450957354	CF	On-Demand	Anodyne	PDE3B	65	33
Cc1cccc2ncnc(N3CC[C@H](CCCO)C3)c12	ZINC000450957354	CF	On-Demand	Anodyne	SIRT2	52	35
O=C(CCCN1CCOC[C@@H]1[C@H]1CCC[C@@H]1O)c1ccc(F)cc1	ZINC000450957362	EF	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCOC[C@@H]1[C@H]1CCC[C@@H]1O)c1ccc(F)cc1	ZINC000450957362	EF	On-Demand	Anodyne	CYP2J2	47	33
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCC[C@@H]1O)c1ccc(F)cc1	ZINC000450957363	EF	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCC[C@@H]1O)c1ccc(F)cc1	ZINC000450957363	EF	On-Demand	Anodyne	CYP2J2	47	33
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCC[C@H]1O)c1ccc(F)cc1	ZINC000450957365	EF	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCC[C@H]1O)c1ccc(F)cc1	ZINC000450957365	EF	On-Demand	Anodyne	CYP2J2	47	33
O=C(CCCN1CCOC[C@@H]1[C@H]1CCC[C@H]1O)c1ccc(F)cc1	ZINC000450957368	EF	On-Demand	Anodyne	DRD4	0	41
O=C(CCCN1CCOC[C@@H]1[C@H]1CCC[C@H]1O)c1ccc(F)cc1	ZINC000450957368	EF	On-Demand	Anodyne	CYP2J2	47	33
OCCC[C@@H]1CCN(c2nc3ccccc3[nH]2)C1	ZINC000450957374	BE	On-Demand	Anodyne	KCNN3	36	43
OCCC[C@H]1CCN(c2nc3ccccc3[nH]2)C1	ZINC000450957377	BE	On-Demand	Anodyne	KCNN3	36	43
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	MME	61	37
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	ANPEP	40	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	BMP1	42	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	PAPA1_CARPA	43	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	CAPNS1	45	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	ACE2	57	39
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	POL	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	CYP3A4	43	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957393	CF	On-Demand	Anodyne	GPR142	78	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	MME	61	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	ANPEP	40	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	BMP1	42	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	PAPA1_CARPA	43	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	CAPNS1	45	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	ACE2	57	39
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	POL	0	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	CYP3A4	43	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1cncs1	ZINC000450957395	CF	On-Demand	Anodyne	GPR142	78	36
CCOC(=O)c1cnn(C)c1NC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450957401	EC	On-Demand	Anodyne	ADORA1	26	47
CCOC(=O)c1cnn(C)c1NC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450957401	EC	On-Demand	Anodyne	ADORA2A	23	47
CCOC(=O)c1cnn(C)c1NC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450957401	EC	On-Demand	Anodyne	ADORA3	33	48
Cc1cccc(NC(=O)CCCC(=O)C2CC2)c1Br	ZINC000450957405	DH	On-Demand	Anodyne	HDAC3	17	43
CCN1CCN(c2cccc(NC(=O)[C@@]3(C)CC=CCC3)c2)CC1	ZINC000450957415	EH	On-Demand	Anodyne	HTR1A	21	45
CCN1CCN(c2cccc(NC(=O)[C@]3(C)CC=CCC3)c2)CC1	ZINC000450957416	EH	On-Demand	Anodyne	HTR1A	21	45
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957420	EG	On-Demand	Anodyne	ERBB2	22	43
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957420	EG	On-Demand	Anodyne	VACHT_TETCF	0	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957420	EG	On-Demand	Anodyne	PREP	51	48
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957420	EG	On-Demand	Anodyne	MMP2	0	45
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957420	EG	On-Demand	Anodyne	ADAM10	41	38
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957420	EG	On-Demand	Anodyne	NMUR2	0	49
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957420	EG	On-Demand	Anodyne	NMUR1	0	49
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957421	EG	On-Demand	Anodyne	ERBB2	22	43
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957421	EG	On-Demand	Anodyne	VACHT_TETCF	0	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957421	EG	On-Demand	Anodyne	PREP	51	48
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957421	EG	On-Demand	Anodyne	MMP2	0	45
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957421	EG	On-Demand	Anodyne	ADAM10	41	38
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957421	EG	On-Demand	Anodyne	NMUR2	0	49
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957421	EG	On-Demand	Anodyne	NMUR1	0	49
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957422	EG	On-Demand	Anodyne	ERBB2	22	43
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957422	EG	On-Demand	Anodyne	VACHT_TETCF	0	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957422	EG	On-Demand	Anodyne	PREP	51	48
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957422	EG	On-Demand	Anodyne	MMP2	0	45
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957422	EG	On-Demand	Anodyne	ADAM10	41	38
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957422	EG	On-Demand	Anodyne	NMUR2	0	49
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450957422	EG	On-Demand	Anodyne	NMUR1	0	49
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957423	EG	On-Demand	Anodyne	ERBB2	22	43
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957423	EG	On-Demand	Anodyne	VACHT_TETCF	0	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957423	EG	On-Demand	Anodyne	PREP	51	48
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957423	EG	On-Demand	Anodyne	MMP2	0	45
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957423	EG	On-Demand	Anodyne	ADAM10	41	38
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957423	EG	On-Demand	Anodyne	NMUR2	0	49
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450957423	EG	On-Demand	Anodyne	NMUR1	0	49
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450957424	FF	On-Demand	Anodyne	CACNA1B	56	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450957424	FF	On-Demand	Anodyne	MCHR1	32	48
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450957424	FF	On-Demand	Anodyne	LIPG	51	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450957424	FF	On-Demand	Anodyne	L3MBTL1	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450957424	FF	On-Demand	Anodyne	L3MBTL3	40	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450957425	FF	On-Demand	Anodyne	CACNA1B	56	45
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450957425	FF	On-Demand	Anodyne	MCHR1	32	48
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450957425	FF	On-Demand	Anodyne	LIPG	51	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450957425	FF	On-Demand	Anodyne	L3MBTL1	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450957425	FF	On-Demand	Anodyne	L3MBTL3	40	40
OCCC[C@@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450957438	CF	On-Demand	Anodyne	PDE3B	45	32
OCCC[C@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1	ZINC000450957440	CF	On-Demand	Anodyne	PDE3B	45	32
CNS(=O)(=O)NCC(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450957442	EC	On-Demand	Anodyne	NQO2	23	42
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450957468	GG	On-Demand	Anodyne	TIMP3	80	36
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000450957471	GG	On-Demand	Anodyne	TIMP3	80	36
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NC2(c3nn[nH]n3)CC2)cc1	ZINC000450957474	GD	On-Demand	Anodyne	MMP2	18	44
CCN(CC)S(=O)(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450957490	GF	On-Demand	Anodyne	MGAT1	43	31
CN1CCN(CCC(C)(C)NC(=O)c2cn(CCc3ccccc3)nn2)CC1	ZINC000450957493	GD	On-Demand	Anodyne	SIGMAR1	24	43
CN1CCN(CCC(C)(C)NC(=O)CCCC(=O)C(C)(C)C)CC1	ZINC000450957494	EE	On-Demand	Anodyne	PAOX	17	40
CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450957505	DD	On-Demand	Anodyne	HTR6	27	41
CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450957505	DD	On-Demand	Anodyne	PKM	23	40
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCc1ccc2c(c1)CCO2	ZINC000450957507	EH	On-Demand	Anodyne	HRH3	40	39
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCc1ccc2c(c1)CCO2	ZINC000450957508	EH	On-Demand	Anodyne	HRH3	40	39
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCc1ccc2c(c1)CCO2	ZINC000450957509	EH	On-Demand	Anodyne	HRH3	40	39
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCc1ccc2c(c1)CCO2	ZINC000450957510	EH	On-Demand	Anodyne	HRH3	40	39
CN1CCN(CCC(C)(C)NC(=O)c2ccc3cnccc3c2)CC1	ZINC000450957517	EE	On-Demand	Anodyne	DRD4	41	31
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1Cl	ZINC000450957524	FG	On-Demand	Anodyne	PKM	31	44
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1Cl	ZINC000450957524	FG	On-Demand	Anodyne	NR1I2	52	38
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1Cl	ZINC000450957524	FG	On-Demand	Anodyne	PFMRK	0	43
C[C@@H](O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450957533	GD	On-Demand	Mild	HTR1D	16	45
C[C@@H](O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450957533	GD	On-Demand	Mild	HTR1B	19	45
C[C@@H](O)CN1CCN(C(=O)COc2ccc(C#N)c(Br)c2)CC1	ZINC000450957533	GD	On-Demand	Mild	GPR183	0	42
CCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450957541	EG	On-Demand	Anodyne	ADRB2	59	42
CCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450957541	EG	On-Demand	Anodyne	ADRB1	36	42
CCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450957541	EG	On-Demand	Anodyne	ADRB3	66	42
CCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450957541	EG	On-Demand	Anodyne	PTPRB	68	38
CC[C@@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450957545	DD	On-Demand	Anodyne	CASP3	73	37
CC[C@@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450957545	DD	On-Demand	Anodyne	CASP7	51	34
CC[C@@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450957545	DD	On-Demand	Anodyne	MMP7	29	40
CC[C@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450957546	DD	On-Demand	Anodyne	CASP3	73	37
CC[C@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450957546	DD	On-Demand	Anodyne	CASP7	51	34
CC[C@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450957546	DD	On-Demand	Anodyne	MMP7	29	40
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@H](C)C1	ZINC000450957547	CD	On-Demand	Anodyne	RAC1	0	43
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@@H](C)C1	ZINC000450957548	CD	On-Demand	Anodyne	RAC1	0	43
COc1ccc(CNC(=O)CCSc2cccc(C(N)=O)c2)c(OC)c1	ZINC000450957551	FF	On-Demand	Anodyne	MTNR1A	50	40
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	CA2	33	55
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	CA1	51	40
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	KCNA5	33	46
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	CA7	19	45
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	BDKRB1	0	51
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	CA4	27	42
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	CA14	17	42
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	PRTN3	68	48
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	CA12	29	55
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	CA9	30	55
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450957566	GG	On-Demand	Anodyne	LEF	40	34
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	CA2	19	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	CA1	18	42
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	KCNA5	0	42
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	CA4	26	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	PRTN3	59	37
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	ALPL	17	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	MTNN	80	39
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	CYNT	19	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	LIMK2	45	38
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2O)cc1	ZINC000450957569	GE	On-Demand	Anodyne	UQCRB	0	60
CCOC(=O)c1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450957570	GF	On-Demand	Anodyne	CA2	25	40
CCOC(=O)c1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450957570	GF	On-Demand	Anodyne	ADRB2	18	42
CCOC(=O)c1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450957570	GF	On-Demand	Anodyne	ADRB3	20	42
CCOC(=O)c1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450957570	GF	On-Demand	Anodyne	CA1	33	42
CCOC(=O)c1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450957570	GF	On-Demand	Anodyne	CA4	28	40
CCOC(=O)c1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450957570	GF	On-Demand	Anodyne	CA14	15	42
CCOC(=O)c1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450957570	GF	On-Demand	Anodyne	CA9	15	40
CCOC(=O)c1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450957570	GF	On-Demand	Anodyne	PFK	0	40
Cc1csc(S(=O)(=O)N2CCC[C@@H](C)C2)c1	ZINC000450957573	CE	On-Demand	Anodyne	AKR1C3	0	43
Cc1csc(S(=O)(=O)N2CCC[C@H](C)C2)c1	ZINC000450957574	CE	On-Demand	Anodyne	AKR1C3	0	43
O=C(NC1CCCC1)c1ccc(N2CC[C@@H](CCCO)C2)nn1	ZINC000450957578	DD	On-Demand	Anodyne	SIRT3	49	30
O=C(NC1CCCC1)c1ccc(N2CC[C@@H](CCCO)C2)nn1	ZINC000450957578	DD	On-Demand	Anodyne	SIRT2	43	31
O=C(NC1CCCC1)c1ccc(N2CC[C@@H](CCCO)C2)nn1	ZINC000450957578	DD	On-Demand	Anodyne	SCD1	45	43
O=C(NC1CCCC1)c1ccc(N2CC[C@H](CCCO)C2)nn1	ZINC000450957579	DD	On-Demand	Anodyne	SIRT3	49	30
O=C(NC1CCCC1)c1ccc(N2CC[C@H](CCCO)C2)nn1	ZINC000450957579	DD	On-Demand	Anodyne	SIRT2	43	31
O=C(NC1CCCC1)c1ccc(N2CC[C@H](CCCO)C2)nn1	ZINC000450957579	DD	On-Demand	Anodyne	SCD1	45	43
COc1cc2nc(N3CCN(CCO)C[C@H]3C)nc(N)c2cc1OC	ZINC000450957582	EC	On-Demand	Anodyne	ADRA1D	20	46
COc1cc2nc(N3CCN(CCO)C[C@H]3C)nc(N)c2cc1OC	ZINC000450957582	EC	On-Demand	Anodyne	ADRA1B	49	46
COc1cc2nc(N3CCN(CCO)C[C@H]3C)nc(N)c2cc1OC	ZINC000450957582	EC	On-Demand	Anodyne	PDE3A	42	33
COc1cc2nc(N3CCN(CCO)C[C@H]3C)nc(N)c2cc1OC	ZINC000450957582	EC	On-Demand	Anodyne	CCR4	43	39
COc1cc2nc(N3CCN(CCO)C[C@H]3C)nc(N)c2cc1OC	ZINC000450957582	EC	On-Demand	Anodyne	PDE3B	62	33
COc1cc2nc(N3CCN(CCO)C[C@H]3C)nc(N)c2cc1OC	ZINC000450957582	EC	On-Demand	Anodyne	EHMT2	68	32
COc1cc2nc(N3CCN(CCO)C[C@@H]3C)nc(N)c2cc1OC	ZINC000450957583	EC	On-Demand	Anodyne	ADRA1D	20	46
COc1cc2nc(N3CCN(CCO)C[C@@H]3C)nc(N)c2cc1OC	ZINC000450957583	EC	On-Demand	Anodyne	ADRA1B	49	46
COc1cc2nc(N3CCN(CCO)C[C@@H]3C)nc(N)c2cc1OC	ZINC000450957583	EC	On-Demand	Anodyne	PDE3A	42	33
COc1cc2nc(N3CCN(CCO)C[C@@H]3C)nc(N)c2cc1OC	ZINC000450957583	EC	On-Demand	Anodyne	CCR4	43	39
COc1cc2nc(N3CCN(CCO)C[C@@H]3C)nc(N)c2cc1OC	ZINC000450957583	EC	On-Demand	Anodyne	PDE3B	62	33
COc1cc2nc(N3CCN(CCO)C[C@@H]3C)nc(N)c2cc1OC	ZINC000450957583	EC	On-Demand	Anodyne	EHMT2	68	32
C[C@H]1CN(CCO)CCN1c1ccnc(-c2ccccc2)n1	ZINC000450957606	CD	On-Demand	Anodyne	SORD	49	41
C[C@@H]1CN(CCO)CCN1c1ccnc(-c2ccccc2)n1	ZINC000450957607	CD	On-Demand	Anodyne	SORD	49	41
CN(C)c1nccc(N2CC[C@@H](CCCO)C2)n1	ZINC000450957610	CD	On-Demand	Anodyne	SORD	43	37
CN(C)c1nccc(N2CC[C@H](CCCO)C2)n1	ZINC000450957611	CD	On-Demand	Anodyne	SORD	43	37
Cc1nc2c(c(N(C)[C@H]3CCN(C(C)C)C3)n1)CCCC2	ZINC000450957626	CF	On-Demand	Anodyne	TUBB3	19	42
Cc1nc2c(c(N(C)[C@@H]3CCN(C(C)C)C3)n1)CCCC2	ZINC000450957627	CF	On-Demand	Anodyne	TUBB3	19	42
COC(=O)[C@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ccc(OC)cc1OC	ZINC000450957641	GE	On-Demand	Anodyne	LRRK2	22	42
COC(=O)[C@@H](NC(=O)c1ccc(-c2cnn(C)c2)o1)c1ccc(OC)cc1OC	ZINC000450957642	GE	On-Demand	Anodyne	LRRK2	22	42
N#Cc1ccc(OCC(=O)N2CC(O)(C3CC3)C2)cc1Br	ZINC000450957676	FD	On-Demand	Mild	TRPV4	44	33
CC(C)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957682	EJ	On-Demand	Anodyne	PRCP	51	64
CC(C)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957682	EJ	On-Demand	Anodyne	COLA	140	44
CC(C)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957682	EJ	On-Demand	Anodyne	CPT1A	131	44
CC(C)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957682	EJ	On-Demand	Anodyne	CPT2	43	36
CC(C)CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957682	EJ	On-Demand	Anodyne	PREP	71	37
CC(C)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957683	EJ	On-Demand	Anodyne	PRCP	51	64
CC(C)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957683	EJ	On-Demand	Anodyne	COLA	140	44
CC(C)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957683	EJ	On-Demand	Anodyne	CPT1A	131	44
CC(C)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957683	EJ	On-Demand	Anodyne	CPT2	43	36
CC(C)CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450957683	EJ	On-Demand	Anodyne	PREP	71	37
CN(CC1(c2ccccc2)CC1)C(=O)c1cccc(C#N)c1Br	ZINC000450957689	FI	On-Demand	Mild	KCNA3	23	48
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000450957695	DD	On-Demand	Anodyne	OPRK1	0	40
C[C@@H](c1ccccc1)[C@H](O)CN1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000450957697	DD	On-Demand	Anodyne	OPRK1	0	40
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000450957699	DD	On-Demand	Anodyne	OPRK1	0	40
C[C@@H](c1ccccc1)[C@@H](O)CN1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000450957700	DD	On-Demand	Anodyne	OPRK1	0	40
C=CCOc1ccc(CC(=O)N[C@@H](C)c2cncs2)cc1	ZINC000450957734	DG	On-Demand	Mild	ACACA	61	34
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1C[C@@H](O)COc1ccc(Cl)cc1	ZINC000450957754	FG	On-Demand	Anodyne	EBP	17	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1C[C@@H](O)COc1ccc(Cl)cc1	ZINC000450957757	FG	On-Demand	Anodyne	EBP	17	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1C[C@H](O)COc1ccc(Cl)cc1	ZINC000450957758	FG	On-Demand	Anodyne	EBP	17	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1C[C@H](O)COc1ccc(Cl)cc1	ZINC000450957759	FG	On-Demand	Anodyne	EBP	17	41
COc1ccccc1Oc1ccc(C(=O)N(C)CC2(c3ccccc3)CC2)nc1	ZINC000450957762	GJ	On-Demand	Anodyne	KCNA3	49	52
Cc1ccc(C(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)c2c1CCC2	ZINC000450957771	FH	On-Demand	Anodyne	HPGDS	34	40
COc1ccc(-c2nnc(N3CC[C@H](CCCO)C3)c3ccccc23)cc1	ZINC000450957773	FH	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(-c2nnc(N3CC[C@H](CCCO)C3)c3ccccc23)cc1	ZINC000450957773	FH	On-Demand	Anodyne	SMO	44	41
Cc1ccc(C(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)c2c1CCC2	ZINC000450957774	FH	On-Demand	Anodyne	HPGDS	34	40
COc1ccc(-c2nnc(N3CC[C@@H](CCCO)C3)c3ccccc23)cc1	ZINC000450957775	FH	On-Demand	Anodyne	PDE3B	50	34
COc1ccc(-c2nnc(N3CC[C@@H](CCCO)C3)c3ccccc23)cc1	ZINC000450957775	FH	On-Demand	Anodyne	SMO	44	41
C[C@H]1OCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(N)=O	ZINC000450957776	DD	On-Demand	Anodyne	DRD2	28	40
C[C@H]1OCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(N)=O	ZINC000450957776	DD	On-Demand	Anodyne	DRD4	0	40
C[C@H]1OCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(N)=O	ZINC000450957776	DD	On-Demand	Anodyne	SLC18A3	0	41
C[C@H]1OCCN(CCCC(=O)c2ccc(F)cc2)[C@@H]1C(N)=O	ZINC000450957776	DD	On-Demand	Anodyne	CYP2J2	49	35
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	DRD2	36	43
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	DRD1	22	47
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	DRD4	23	51
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	HRH2	0	40
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	HTR2A	36	52
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	HTR2C	27	52
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	DRD3	16	48
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	ERG2	19	40
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	SLC18A3	0	43
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	HTR3B	0	41
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	CYP2J2	53	38
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450957778	FD	On-Demand	Anodyne	AP2S1	0	40
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000450957779	FG	On-Demand	Mild	TIMP3	56	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000450957781	FG	On-Demand	Mild	TIMP3	56	33
CCOC(=O)c1ccc(CN2CC[C@@H](c3nc(C)no3)C2)nc1	ZINC000450957783	DD	On-Demand	Anodyne	ETHR	46	35
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000450957784	FG	On-Demand	Mild	TIMP3	56	33
CCOC(=O)c1ccc(CN2CC[C@H](c3nc(C)no3)C2)nc1	ZINC000450957785	DD	On-Demand	Anodyne	ETHR	46	35
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000450957786	FG	On-Demand	Mild	TIMP3	56	33
C/C=C/COc1cccc(CC(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)c1	ZINC000450957795	GH	On-Demand	Anodyne	HPGDS	33	40
C/C=C\COc1cccc(CC(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)c1	ZINC000450957797	GH	On-Demand	Anodyne	HPGDS	33	40
C[C@@H](O)CCn1nnc(-c2ccco2)n1	ZINC000450957798	BC	On-Demand	Anodyne	ADORA3	42	39
C/C=C/COc1cccc(CC(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)c1	ZINC000450957799	GH	On-Demand	Anodyne	HPGDS	33	40
C[C@H](O)CCn1nnc(-c2ccco2)n1	ZINC000450957800	BC	On-Demand	Anodyne	ADORA3	42	39
C/C=C\COc1cccc(CC(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)c1	ZINC000450957802	GH	On-Demand	Anodyne	HPGDS	33	40
COC[C@]1(C(=O)N(C)CC2(c3ccccc3)CC2)CCOC1	ZINC000450957807	DE	On-Demand	Anodyne	KCNA3	19	43
COC[C@@]1(C(=O)N(C)CC2(c3ccccc3)CC2)CCOC1	ZINC000450957809	DE	On-Demand	Anodyne	KCNA3	19	43
C=CCCCCNC(=O)c1ccc(N2CCC2)nc1	ZINC000450957810	CE	On-Demand	Mild	HPGDS	21	46
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957828	DG	On-Demand	Anodyne	MME	54	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957828	DG	On-Demand	Anodyne	PAPA1_CARPA	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957828	DG	On-Demand	Anodyne	CAPNS1	45	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957828	DG	On-Demand	Anodyne	CAPN2	43	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957828	DG	On-Demand	Anodyne	ACE2	57	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957828	DG	On-Demand	Anodyne	ACPS	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957829	DG	On-Demand	Anodyne	MME	54	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957829	DG	On-Demand	Anodyne	PAPA1_CARPA	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957829	DG	On-Demand	Anodyne	CAPNS1	45	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957829	DG	On-Demand	Anodyne	CAPN2	43	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957829	DG	On-Demand	Anodyne	ACE2	57	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450957829	DG	On-Demand	Anodyne	ACPS	0	41
C[C@@H](CCN1CCN(C)CC1)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450957837	FF	On-Demand	Anodyne	CCKBR	42	37
C[C@H](CCN1CCN(C)CC1)NC(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000450957839	FF	On-Demand	Anodyne	CCKBR	42	37
C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1cncs1	ZINC000450957866	EI	On-Demand	Anodyne	RBP4	71	40
O=C(NCC1(CO)CCCC1)c1c(Cl)cc(Cl)cc1Cl	ZINC000450957868	EH	On-Demand	Anodyne	P2RX7	15	40
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957873	GG	On-Demand	Anodyne	MC4R	89	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957873	GG	On-Demand	Anodyne	PRCP	61	44
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957873	GG	On-Demand	Anodyne	MC3R	61	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957873	GG	On-Demand	Anodyne	MC5R	23	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957873	GG	On-Demand	Anodyne	MC1R	39	46
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957874	GG	On-Demand	Anodyne	MC4R	89	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957874	GG	On-Demand	Anodyne	PRCP	61	44
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957874	GG	On-Demand	Anodyne	MC3R	61	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957874	GG	On-Demand	Anodyne	MC5R	23	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957874	GG	On-Demand	Anodyne	MC1R	39	46
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957875	GG	On-Demand	Anodyne	MC4R	89	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957875	GG	On-Demand	Anodyne	PRCP	61	44
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957875	GG	On-Demand	Anodyne	MC3R	61	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957875	GG	On-Demand	Anodyne	MC5R	23	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450957875	GG	On-Demand	Anodyne	MC1R	39	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	CA2	15	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	EDNRB	26	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	EDNRA	27	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	BMP1	72	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	CA1	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	MMP13	18	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	NOS2	58	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	MMP12	20	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000450957881	GE	On-Demand	Anodyne	CA9	16	46
Cc1csc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1	ZINC000450957894	EF	On-Demand	Anodyne	DRD2	0	43
Cc1csc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1	ZINC000450957894	EF	On-Demand	Anodyne	DRD3	0	43
Cc1csc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1	ZINC000450957894	EF	On-Demand	Anodyne	ADORA2B	44	36
CCN(c1ccccc1)S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450957907	DH	On-Demand	Anodyne	AMY2	45	33
CCN(c1ccccc1)S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450957908	DH	On-Demand	Anodyne	AMY2	45	33
CN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450957909	FE	On-Demand	Anodyne	MMP13	62	40
CN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450957909	FE	On-Demand	Anodyne	ADAM17	46	40
CN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450957909	FE	On-Demand	Anodyne	MMP2	39	40
CN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450957909	FE	On-Demand	Anodyne	MMP3	39	40
CN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450957909	FE	On-Demand	Anodyne	MMP9	47	40
CN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450957909	FE	On-Demand	Anodyne	MMP1	40	38
CN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450957909	FE	On-Demand	Anodyne	TNKS	46	32
C[C@@H](O)CN1CCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)CC1	ZINC000450957940	EE	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	47
C[C@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1ccccc1	ZINC000450957942	DH	On-Demand	Anodyne	MMP13	22	41
C[C@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1ccccc1	ZINC000450957942	DH	On-Demand	Anodyne	MMP2	26	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCc1ccccc1F	ZINC000450957960	DH	On-Demand	Anodyne	HRH3	0	46
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCc1ccccc1F	ZINC000450957961	DH	On-Demand	Anodyne	HRH3	0	46
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCc1ccccc1F	ZINC000450957962	DH	On-Demand	Anodyne	HRH3	0	46
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCc1ccccc1F	ZINC000450957963	DH	On-Demand	Anodyne	HRH3	0	46
O=S(=O)(NCCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450957967	FD	On-Demand	Anodyne	HTR1A	19	50
O=S(=O)(NCCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450957967	FD	On-Demand	Anodyne	DRD2	20	47
O=S(=O)(NCCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450957967	FD	On-Demand	Anodyne	HTR2A	31	47
O=S(=O)(NCCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450957967	FD	On-Demand	Anodyne	HTR7	62	51
O=S(=O)(NCCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450957967	FD	On-Demand	Anodyne	CCR1	15	48
O=S(=O)(NCCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450957967	FD	On-Demand	Anodyne	HTR6	27	50
O=S(=O)(NCCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450957967	FD	On-Demand	Anodyne	HPGDS	23	40
C[C@H]1CN(CCO)CCN1c1ccc(C(F)(F)F)cn1	ZINC000450957982	CD	On-Demand	Anodyne	CXCR3	28	46
C[C@@H]1CN(CCO)CCN1c1ccc(C(F)(F)F)cn1	ZINC000450957983	CD	On-Demand	Anodyne	CXCR3	28	46
CNS(=O)(=O)NCC(=O)Nc1cc(F)c(Br)cc1C	ZINC000450958004	FC	On-Demand	Anodyne	CA1	15	42
CNS(=O)(=O)NCC(=O)Nc1cc(F)c(Br)cc1C	ZINC000450958004	FC	On-Demand	Anodyne	CA4	18	42
OCCC[C@H]1CCN(c2nc3cc(F)ccc3o2)C1	ZINC000450958014	CF	On-Demand	Anodyne	PTGES	33	41
OCCC[C@@H]1CCN(c2nc3cc(F)ccc3o2)C1	ZINC000450958015	CF	On-Demand	Anodyne	PTGES	33	41
COC(=O)[C@@H](NC(=O)c1cccc(SC)c1)c1ccc(OC)cc1OC	ZINC000450958029	GG	On-Demand	Anodyne	KCNK3	23	40
COC(=O)[C@H](NC(=O)c1cccc(SC)c1)c1ccc(OC)cc1OC	ZINC000450958030	GG	On-Demand	Anodyne	KCNK3	23	40
N#Cc1cc(F)cc(OC[C@H]2COCCO2)c1	ZINC000450958076	BD	On-Demand	Mild	CHRNA10	42	37
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450958077	GG	On-Demand	Anodyne	MC4R	89	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450958077	GG	On-Demand	Anodyne	PRCP	61	44
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450958077	GG	On-Demand	Anodyne	MC3R	61	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450958077	GG	On-Demand	Anodyne	MC5R	23	49
C[C@H](O)CN(C)C1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450958077	GG	On-Demand	Anodyne	MC1R	39	46
Cc1cccc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)c1Br	ZINC000450958081	GI	On-Demand	Anodyne	G2YM83_BOTF4	46	32
N#Cc1cc(F)cc(OC[C@@H]2COCCO2)c1	ZINC000450958083	BD	On-Demand	Mild	CHRNA10	42	37
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450958087	GK	On-Demand	Anodyne	PRCP	28	53
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450958087	GK	On-Demand	Anodyne	CPT1A	88	38
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450958088	GK	On-Demand	Anodyne	PRCP	28	53
CC[C@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450958088	GK	On-Demand	Anodyne	CPT1A	88	38
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450958089	GK	On-Demand	Anodyne	PRCP	28	53
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450958089	GK	On-Demand	Anodyne	CPT1A	88	38
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450958091	GK	On-Demand	Anodyne	PRCP	28	53
CC[C@@H](CC(F)(F)F)C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450958091	GK	On-Demand	Anodyne	CPT1A	88	38
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958097	GE	On-Demand	Anodyne	TACR1	19	42
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958097	GE	On-Demand	Anodyne	PAPA1_CARPA	36	41
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958097	GE	On-Demand	Anodyne	PAM	0	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958097	GE	On-Demand	Anodyne	ACE2	43	33
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958097	GE	On-Demand	Anodyne	CTRB_BOVIN	40	37
C[C@]1(O)CCOC[C@H]1[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450958099	DG	On-Demand	Anodyne	HRH3	30	40
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958100	GE	On-Demand	Anodyne	TACR1	19	42
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958100	GE	On-Demand	Anodyne	PAPA1_CARPA	36	41
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958100	GE	On-Demand	Anodyne	PAM	0	40
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958100	GE	On-Demand	Anodyne	ACE2	43	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](NC(C)=O)C(C)(C)C	ZINC000450958100	GE	On-Demand	Anodyne	CTRB_BOVIN	40	37
C[C@]1(O)CCOC[C@H]1[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450958101	DG	On-Demand	Anodyne	HRH3	30	40
C[C@]1(O)CCOC[C@@H]1[C@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450958103	DG	On-Demand	Anodyne	HRH3	30	40
C[C@]1(O)CCOC[C@@H]1[C@@H]1CCCN1CCc1ccc(Cl)cc1	ZINC000450958104	DG	On-Demand	Anodyne	HRH3	30	40
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	SLC6A1	0	45
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	ERBB2	22	46
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	MC4R	16	43
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	PREP	62	48
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	MMP2	0	46
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	ADAM10	41	38
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	NMUR2	0	52
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450958122	FG	On-Demand	Anodyne	NMUR1	0	52
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450958126	FF	On-Demand	Anodyne	TIMP3	69	39
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C1(C(=O)C2CC2)CC1	ZINC000450958128	FF	On-Demand	Anodyne	TIMP3	69	39
COC(=O)c1ccc(CC(=O)N2CCC(N(C)C[C@H](C)O)CC2)cc1	ZINC000450958131	ED	On-Demand	Anodyne	CCR5	24	48
COC(=O)c1ccc(CC(=O)N2CCC(N(C)C[C@H](C)O)CC2)cc1	ZINC000450958131	ED	On-Demand	Anodyne	MCHR1	24	40
COC(=O)c1ccc(CC(=O)N2CCC(N(C)C[C@@H](C)O)CC2)cc1	ZINC000450958138	ED	On-Demand	Anodyne	CCR5	24	48
COC(=O)c1ccc(CC(=O)N2CCC(N(C)C[C@@H](C)O)CC2)cc1	ZINC000450958138	ED	On-Demand	Anodyne	MCHR1	24	40
COc1cc(C(=O)N(C)CC2(c3ccccc3)CC2)c([N+](=O)[O-])cc1F	ZINC000450958150	FH	On-Demand	Bother	KCNA3	37	52
O=C(CCCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958160	FE	On-Demand	Anodyne	DRD2	34	52
O=C(CCCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958160	FE	On-Demand	Anodyne	DRD1	15	52
O=C(CCCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958160	FE	On-Demand	Anodyne	DRD4	15	55
O=C(CCCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958160	FE	On-Demand	Anodyne	HTR2A	20	55
O=C(CCCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958160	FE	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958160	FE	On-Demand	Anodyne	EBP	27	52
O=C(CCCN1CCC[C@@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958160	FE	On-Demand	Anodyne	CYP2J2	46	33
O=C(CCCN1CCC[C@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958161	FE	On-Demand	Anodyne	DRD2	34	52
O=C(CCCN1CCC[C@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958161	FE	On-Demand	Anodyne	DRD1	15	52
O=C(CCCN1CCC[C@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958161	FE	On-Demand	Anodyne	DRD4	15	55
O=C(CCCN1CCC[C@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958161	FE	On-Demand	Anodyne	HTR2A	20	55
O=C(CCCN1CCC[C@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958161	FE	On-Demand	Anodyne	ERG2	24	52
O=C(CCCN1CCC[C@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958161	FE	On-Demand	Anodyne	EBP	27	52
O=C(CCCN1CCC[C@](O)(C(=O)N2CCCC2)C1)c1ccc(F)cc1	ZINC000450958161	FE	On-Demand	Anodyne	CYP2J2	46	33
COc1cccc(OCCC(=O)NCCc2cn(C)c3cc(F)ccc23)c1	ZINC000450958178	FG	On-Demand	Anodyne	MTNR1A	84	52
COc1cccc(OCCC(=O)NCCc2cn(C)c3cc(F)ccc23)c1	ZINC000450958178	FG	On-Demand	Anodyne	MTNR1B	66	52
COCCN1C(=O)N[C@@H]2CN(Cc3ccc(Cl)c(OC)c3)CC[C@@H]21	ZINC000450958179	FD	On-Demand	Anodyne	DRD4	27	40
COCCN1C(=O)N[C@@H]2CN(Cc3ccc(Cl)c(OC)c3)CC[C@@H]21	ZINC000450958179	FD	On-Demand	Anodyne	DRD3	0	40
COCCN1C(=O)N[C@@H]2CN(Cc3ccc(Cl)c(OC)c3)CC[C@@H]21	ZINC000450958179	FD	On-Demand	Anodyne	HTR4	64	36
COCCN1C(=O)N[C@@H]2CN(Cc3ccc(Cl)c(OC)c3)CC[C@@H]21	ZINC000450958179	FD	On-Demand	Anodyne	CCR1	0	40
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C1(C(=O)CC)CC1	ZINC000450958195	FF	On-Demand	Anodyne	TIMP3	64	33
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C1(C(=O)CC)CC1	ZINC000450958196	FF	On-Demand	Anodyne	TIMP3	64	33
C[C@@H](O)CCS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450958201	ED	On-Demand	Anodyne	AKR1C3	61	39
C[C@H](O)CCS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450958202	ED	On-Demand	Anodyne	AKR1C3	61	39
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccc(Cl)cn1	ZINC000450958215	FJ	On-Demand	Anodyne	RBP4	70	40
CCOC(=O)C1(CNC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450958218	DD	On-Demand	Anodyne	HCN1	42	34
CCOC(=O)C1(CNC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450958218	DD	On-Demand	Anodyne	HCN4	42	34
C[C@@H](O)CN(C)C1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450958219	FD	On-Demand	Anodyne	L3MBTL3	66	39
C[C@H](O)CN(C)C1CCN(C(=O)c2ccc3c(c2)OC(F)(F)O3)CC1	ZINC000450958222	FD	On-Demand	Anodyne	L3MBTL3	66	39
Cc1cccc2c1O[C@@H](C(=O)Nc1cnns1)C2	ZINC000450958226	CD	On-Demand	Anodyne	AHK3	0	40
O=C(Cc1ccc(O)c(F)c1)N1CCCN(C(=O)C2CC2)CC1	ZINC000450958230	DD	On-Demand	Anodyne	PREP	47	35
O=C(Cc1ccc(O)c(F)c1)N1CCCN(C(=O)C2CC2)CC1	ZINC000450958230	DD	On-Demand	Anodyne	ECE2	0	45
Cc1cccc2c1O[C@H](C(=O)Nc1cnns1)C2	ZINC000450958232	CD	On-Demand	Anodyne	AHK3	0	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1	ZINC000450958237	GG	On-Demand	Anodyne	PKM	28	42
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1	ZINC000450958237	GG	On-Demand	Anodyne	FFAR4	20	41
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958245	EG	On-Demand	Anodyne	SLC6A1	48	35
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958245	EG	On-Demand	Anodyne	PRCP	25	41
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958245	EG	On-Demand	Anodyne	CYP2J2	64	45
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958245	EG	On-Demand	Anodyne	SMO	50	35
O=C(CCCN1CC[C@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958245	EG	On-Demand	Anodyne	ETHR	66	41
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1C(N)=O	ZINC000450958246	CD	On-Demand	Anodyne	SLC6A1	26	46
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958247	EG	On-Demand	Anodyne	SLC6A1	48	35
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958247	EG	On-Demand	Anodyne	PRCP	25	41
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958247	EG	On-Demand	Anodyne	CYP2J2	64	45
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958247	EG	On-Demand	Anodyne	SMO	50	35
O=C(CCCN1CC[C@@H](c2nc(C3CC3)no2)C1)c1ccccc1	ZINC000450958247	EG	On-Demand	Anodyne	ETHR	66	41
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450958254	EE	On-Demand	Anodyne	NMUR2	0	47
C[C@]1(c2ccccc2)C[C@@H]1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450958254	EE	On-Demand	Anodyne	NMUR1	0	47
CCOc1ccc(S(=O)(=O)Cc2ccc(S(=O)(=O)CC)cc2)cc1	ZINC000450958261	FF	On-Demand	Anodyne	CA7	20	56
CN1C(=O)CC[C@H]1C(=O)N1CCSC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450958273	FF	On-Demand	Anodyne	P2RX7	18	43
CN1C(=O)CC[C@@H]1C(=O)N1CCSC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000450958274	FF	On-Demand	Anodyne	P2RX7	18	43
CN1C(=O)CC[C@H]1C(=O)N1CCSC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450958275	FF	On-Demand	Anodyne	P2RX7	18	43
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	CA2	22	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	ADRB2	44	49
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	ADRB1	27	49
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	ADRB3	56	49
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	CASR	0	40
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	BMP1	78	43
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	CA1	22	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	KCNA5	0	40
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP13	58	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	HTR6	24	42
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	ADAM17	21	40
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	CA4	20	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP2	46	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP3	44	44
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP8	33	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP14	23	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	NPY5R	15	46
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	ALOX15	23	40
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP9	48	53
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP12	38	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	CA12	15	42
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP10	15	53
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP7	32	53
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	ALPL	22	50
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MTNN	80	41
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	CA9	21	40
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MMP1	45	44
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	IDO1	0	47
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	FFAR4	35	54
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	ALPI	15	49
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	GPR119	0	41
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	BRD4	0	47
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MGAT2	0	46
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cc1	ZINC000450958278	GE	On-Demand	Anodyne	MGAT1	51	46
CCOC(=O)c1ccccc1NS(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450958279	FF	On-Demand	Anodyne	KCNA5	0	47
CCOC(=O)c1ccccc1NS(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450958280	FF	On-Demand	Anodyne	KCNA5	0	47
CC[C@@H]1C[C@H]1C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450958287	CG	On-Demand	Anodyne	KCNA3	17	43
COc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450958302	GE	On-Demand	Anodyne	KCNA5	0	40
COc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450958302	GE	On-Demand	Anodyne	HTR6	17	41
COc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450958302	GE	On-Demand	Anodyne	PRTN3	57	35
COc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450958302	GE	On-Demand	Anodyne	MTNN	76	37
COc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450958302	GE	On-Demand	Anodyne	LIMK2	27	52
COc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450958302	GE	On-Demand	Anodyne	UQCRB	0	40
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	HTR1A	95	56
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	ADRA2A	15	42
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	DRD2	72	56
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	DRD1	30	50
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	DRD4	36	46
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	ADRA1D	77	42
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	HTR2A	36	44
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	ADRA1A	67	42
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	ADRA1B	65	42
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	DRD3	71	50
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	HTR7	56	44
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	TACR3	18	40
COc1ccccc1N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450958303	GE	On-Demand	Anodyne	ALPHA-1A	0	50
Cc1csc(NC2CCN(C(=O)[C@@]3(C)CCC[C@H]3C)CC2)n1	ZINC000450958310	DH	On-Demand	Anodyne	TRPC6	47	36
Cc1csc(NC2CCN(C(=O)[C@@]3(C)CCC[C@@H]3C)CC2)n1	ZINC000450958311	DH	On-Demand	Anodyne	TRPC6	47	36
Cc1csc(NC2CCN(C(=O)[C@]3(C)CCC[C@H]3C)CC2)n1	ZINC000450958312	DH	On-Demand	Anodyne	TRPC6	47	36
Cc1csc(NC2CCN(C(=O)[C@]3(C)CCC[C@@H]3C)CC2)n1	ZINC000450958313	DH	On-Demand	Anodyne	TRPC6	47	36
CCOC(=O)Cc1csc(NS(=O)(=O)c2sccc2Cl)n1	ZINC000450958325	FF	On-Demand	Anodyne	HSD17B1	15	53
CCOC(=O)Cc1csc(NS(=O)(=O)c2sccc2Cl)n1	ZINC000450958325	FF	On-Demand	Anodyne	HSD17B2	15	53
CCN1CCN(S(=O)(=O)c2cc(OC)cc(C(F)(F)F)c2)CC1	ZINC000450958332	FE	On-Demand	Anodyne	PKM	17	44
COc1ccc(NC(=O)CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)cc1Cl	ZINC000450958336	GH	On-Demand	Anodyne	ENPP1	63	35
COc1ccc(NC(=O)CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)cc1Cl	ZINC000450958337	GH	On-Demand	Anodyne	ENPP1	63	35
COc1ccc(NC(=O)CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)cc1Cl	ZINC000450958338	GH	On-Demand	Anodyne	ENPP1	63	35
COc1ccc(NC(=O)CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)cc1Cl	ZINC000450958339	GH	On-Demand	Anodyne	ENPP1	63	35
COc1cccc(OCCN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1	ZINC000450958342	EG	On-Demand	Anodyne	EBP	43	38
COc1cccc(OCCN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1	ZINC000450958343	EG	On-Demand	Anodyne	EBP	43	38
COc1cccc(OCCN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1	ZINC000450958344	EG	On-Demand	Anodyne	EBP	43	38
COc1cccc(OCCN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1	ZINC000450958345	EG	On-Demand	Anodyne	EBP	43	38
CCCOc1ccc(-c2csc(NS(=O)(=O)C[C@@H](C)OC)n2)cc1	ZINC000450958348	FG	On-Demand	Anodyne	ACACA	34	41
CCCOc1ccc(-c2csc(NS(=O)(=O)C[C@@H](C)OC)n2)cc1	ZINC000450958348	FG	On-Demand	Anodyne	ACACB	16	41
CCCOc1ccc(-c2csc(NS(=O)(=O)C[C@H](C)OC)n2)cc1	ZINC000450958349	FG	On-Demand	Anodyne	ACACA	34	41
CCCOc1ccc(-c2csc(NS(=O)(=O)C[C@H](C)OC)n2)cc1	ZINC000450958349	FG	On-Demand	Anodyne	ACACB	16	41
O=C1NCCc2cc(OCC3=CCCCC3)ccc21	ZINC000450958350	CF	On-Demand	Anodyne	MAOB	18	44
CCN(CC)CCNS(=O)(=O)c1cnccc1C	ZINC000450958357	CD	On-Demand	Anodyne	Q95J97_RABIT	0	40
CCOC(=O)c1cc(C(=O)N[C@H](C(=O)OC)c2ccc(OC)c(Cl)c2)on1	ZINC000450958365	GE	On-Demand	Anodyne	PDE5A	18	41
CCOC(=O)c1cc(C(=O)N[C@H](C(=O)OC)c2ccc(OC)c(Cl)c2)on1	ZINC000450958365	GE	On-Demand	Anodyne	PDE6A	43	34
CCOC(=O)c1cc(C(=O)N[C@@H](C(=O)OC)c2ccc(OC)c(Cl)c2)on1	ZINC000450958366	GE	On-Demand	Anodyne	PDE5A	18	41
CCOC(=O)c1cc(C(=O)N[C@@H](C(=O)OC)c2ccc(OC)c(Cl)c2)on1	ZINC000450958366	GE	On-Demand	Anodyne	PDE6A	43	34
C[C@H]1CN(CCO)CCN1c1ncc(C#N)cc1Cl	ZINC000450958384	CD	On-Demand	Mild	CXCR3	27	40
C[C@@H]1CN(CCO)CCN1c1ncc(C#N)cc1Cl	ZINC000450958385	CD	On-Demand	Mild	CXCR3	27	40
C[C@H]1CN(CCO)CCN1c1ccnc(C(=O)NCc2ccccc2)c1	ZINC000450958414	FD	On-Demand	Anodyne	DRD3	17	41
C[C@@H]1CN(CCO)CCN1c1ccnc(C(=O)NCc2ccccc2)c1	ZINC000450958415	FD	On-Demand	Anodyne	DRD3	17	41
CS(=O)(=O)c1ccc(N2CC[C@@H](CCCO)C2)cc1	ZINC000450958430	CD	On-Demand	Anodyne	GPR119	24	43
CS(=O)(=O)c1ccc(N2CC[C@H](CCCO)C2)cc1	ZINC000450958431	CD	On-Demand	Anodyne	GPR119	24	43
COC(=O)[C@@H](NC(=O)CCCC(C)C)c1ccc(OC)cc1OC	ZINC000450958435	EF	On-Demand	Anodyne	HDA106	0	43
COC(=O)[C@H](NC(=O)CCCC(C)C)c1ccc(OC)cc1OC	ZINC000450958436	EF	On-Demand	Anodyne	HDA106	0	43
Cc1cc(N2CC[C@H](CCCO)C2)c2ccccc2n1	ZINC000450958437	CG	On-Demand	Anodyne	HTR1D	54	36
Cc1cc(N2CC[C@H](CCCO)C2)c2ccccc2n1	ZINC000450958437	CG	On-Demand	Anodyne	HTR1B	49	36
Cc1cc(N2CC[C@@H](CCCO)C2)c2ccccc2n1	ZINC000450958438	CG	On-Demand	Anodyne	HTR1D	54	36
Cc1cc(N2CC[C@@H](CCCO)C2)c2ccccc2n1	ZINC000450958438	CG	On-Demand	Anodyne	HTR1B	49	36
C[C@H]1CN(CCO)CCN1c1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450958439	GB	On-Demand	Anodyne	GCKR	86	41
C[C@@H]1CN(CCO)CCN1c1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000450958440	GB	On-Demand	Anodyne	GCKR	86	41
C[C@@H]1CN(CCO)CCN1c1nc2ccccc2n1C	ZINC000450958460	CD	On-Demand	Anodyne	HRH1	17	48
C[C@@H]1CN(CCO)CCN1c1nc2ccccc2n1C	ZINC000450958460	CD	On-Demand	Anodyne	GRM2	16	41
C[C@H]1CN(CCO)CCN1c1nc2ccccc2n1C	ZINC000450958461	CD	On-Demand	Anodyne	HRH1	17	48
C[C@H]1CN(CCO)CCN1c1nc2ccccc2n1C	ZINC000450958461	CD	On-Demand	Anodyne	GRM2	16	41
CC1([C@@]2(C)NC(=O)N(CCc3ccc(Cl)cc3)C2=O)CC1	ZINC000450958468	DF	On-Demand	Anodyne	CACNA1D	57	45
CC1([C@]2(C)NC(=O)N(CCc3ccc(Cl)cc3)C2=O)CC1	ZINC000450958469	DF	On-Demand	Anodyne	CACNA1D	57	45
CN1C[C@@H]2[C@@H](CCCN2CC/C=C/c2ccccc2)C1=O	ZINC000450958473	CF	On-Demand	Anodyne	SLC6A1	40	32
CN1C[C@@H]2[C@@H](CCCN2CC/C=C\c2ccccc2)C1=O	ZINC000450958474	CF	On-Demand	Anodyne	SLC6A1	40	32
CN1C(=O)CC[C@@H]1C(=O)N1CCSC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000450958476	FF	On-Demand	Anodyne	P2RX7	18	43
CCCOc1cccc(Cn2c(C)nn(C(C)C)c2=O)c1	ZINC000450958495	CF	On-Demand	Anodyne	UPP1	44	38
COc1cccc(OCCC(=O)N[C@@]2(C#N)CCc3ccccc3C2)c1	ZINC000450958529	FG	On-Demand	Mild	MTNR1A	24	41
COc1cccc(OCCC(=O)N[C@]2(C#N)CCc3ccccc3C2)c1	ZINC000450958535	FG	On-Demand	Mild	MTNR1A	24	41
COC(=O)CC1(CNC(=O)c2c[nH]c3nccc-3c2)CCCCC1	ZINC000450958548	EF	On-Demand	Anodyne	HCN1	51	31
COC(=O)CC1(CNC(=O)c2c[nH]c3nccc-3c2)CCCCC1	ZINC000450958548	EF	On-Demand	Anodyne	HCN4	49	31
C/C=C\COc1cccc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)c1	ZINC000450958558	EI	On-Demand	Anodyne	PDS	50	34
C/C=C/COc1cccc(CC(=O)N[C@H](C)c2ccc(Cl)cn2)c1	ZINC000450958560	EI	On-Demand	Anodyne	PDS	50	34
C/C=C\COc1cccc(CC(=O)N[C@H](C)c2ccc(Cl)cn2)c1	ZINC000450958563	EI	On-Demand	Anodyne	PDS	50	34
C/C=C/COc1cccc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)c1	ZINC000450958565	EI	On-Demand	Anodyne	PDS	50	34
COc1ccc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)c(Cl)c1OC	ZINC000450958575	FH	On-Demand	Anodyne	F10	51	34
COc1ccc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)c(Cl)c1OC	ZINC000450958575	FH	On-Demand	Anodyne	CACNA1I	15	48
CO[C@@H](Cc1ccccc1)Cn1cnc(C(C)(C)C)cc1=O	ZINC000450958576	DF	On-Demand	Anodyne	CTSV	42	29
COc1ccc(CC(=O)N[C@H](C)c2ccc(Cl)cn2)c(Cl)c1OC	ZINC000450958577	FH	On-Demand	Anodyne	F10	51	34
COc1ccc(CC(=O)N[C@H](C)c2ccc(Cl)cn2)c(Cl)c1OC	ZINC000450958577	FH	On-Demand	Anodyne	CACNA1I	15	48
CO[C@H](Cc1ccccc1)Cn1cnc(C(C)(C)C)cc1=O	ZINC000450958578	DF	On-Demand	Anodyne	CTSV	42	29
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958581	GG	On-Demand	Anodyne	TIMP3	40	33
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958581	GG	On-Demand	Anodyne	CAPN2	41	33
C[C@H](OCCc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958581	GG	On-Demand	Anodyne	BIRC2	43	36
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958582	GG	On-Demand	Anodyne	TIMP3	40	33
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958582	GG	On-Demand	Anodyne	REN	48	37
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958582	GG	On-Demand	Anodyne	CAPN2	41	33
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958582	GG	On-Demand	Anodyne	BIRC2	43	36
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958584	GG	On-Demand	Anodyne	TIMP3	40	33
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958584	GG	On-Demand	Anodyne	REN	48	37
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958584	GG	On-Demand	Anodyne	CAPN2	41	33
C[C@@H](OCCc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450958584	GG	On-Demand	Anodyne	BIRC2	43	36
C[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450958586	GG	On-Demand	Anodyne	TIMP3	40	33
C[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450958586	GG	On-Demand	Anodyne	REN	48	37
C[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450958586	GG	On-Demand	Anodyne	CAPN2	41	33
C[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450958586	GG	On-Demand	Anodyne	BIRC2	43	36
COC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1C)c1ccc(OC)c(O)c1	ZINC000450958591	GG	On-Demand	Anodyne	PPARD	42	37
COC(=O)[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1C)c1ccc(OC)c(O)c1	ZINC000450958591	GG	On-Demand	Anodyne	MTTP	54	38
COC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1C)c1ccc(OC)c(O)c1	ZINC000450958593	GG	On-Demand	Anodyne	PPARD	42	37
COC(=O)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1C)c1ccc(OC)c(O)c1	ZINC000450958593	GG	On-Demand	Anodyne	MTTP	54	38
Cc1csc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000450958597	CG	On-Demand	Anodyne	CYP11B2	28	43
C[C@@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450958598	EF	On-Demand	Anodyne	CHRM4	17	41
C[C@@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450958598	EF	On-Demand	Anodyne	CHRM5	39	42
C[C@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450958599	EF	On-Demand	Anodyne	CHRM4	17	41
C[C@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCC1	ZINC000450958599	EF	On-Demand	Anodyne	CHRM5	39	42
CC(=O)CCCCCn1nnc(-c2ccco2)n1	ZINC000450958604	BE	On-Demand	Anodyne	ADORA3	47	38
CC[C@H](O)CC(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000450958615	CD	On-Demand	Anodyne	MTNR1A	58	44
CC[C@H](O)CC(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000450958615	CD	On-Demand	Anodyne	MTNR1B	39	43
CC[C@@H](O)CC(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000450958619	CD	On-Demand	Anodyne	MTNR1A	58	44
CC[C@@H](O)CC(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000450958619	CD	On-Demand	Anodyne	MTNR1B	39	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958645	ED	On-Demand	Bother	CMA1	44	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958645	ED	On-Demand	Bother	CTRA_BOVIN	53	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958645	ED	On-Demand	Bother	FCER2	42	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958645	ED	On-Demand	Bother	CTRC	45	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958645	ED	On-Demand	Bother	ACE2	40	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958645	ED	On-Demand	Bother	BLA1_STEMA	49	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958646	ED	On-Demand	Bother	CMA1	44	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958646	ED	On-Demand	Bother	CTRA_BOVIN	53	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958646	ED	On-Demand	Bother	FCER2	42	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958646	ED	On-Demand	Bother	CTRC	45	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958646	ED	On-Demand	Bother	ACE2	40	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000450958646	ED	On-Demand	Bother	BLA1_STEMA	49	42
CC(C)N1CCCC[C@H]1CN1C[C@@H](C)[C@H](C(=O)N2CCOCC2)C1	ZINC000450958650	ED	On-Demand	Anodyne	SSTR3	57	32
CC(C)N1CCCC[C@@H]1CN1C[C@@H](C)[C@H](C(=O)N2CCOCC2)C1	ZINC000450958651	ED	On-Demand	Anodyne	SSTR3	57	32
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450958653	GE	On-Demand	Anodyne	ADRB1	18	41
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450958653	GE	On-Demand	Anodyne	ADRB3	15	41
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450958653	GE	On-Demand	Anodyne	PRTN3	45	35
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450958653	GE	On-Demand	Anodyne	ADAMTS4	22	40
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450958653	GE	On-Demand	Anodyne	LIMK2	43	40
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450958653	GE	On-Demand	Anodyne	LUXN	0	47
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450958653	GE	On-Demand	Anodyne	ADIPOR1	0	45
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450958653	GE	On-Demand	Anodyne	ADIPOR2	0	45
COC(=O)c1ccc(CC(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)cc1	ZINC000450958655	GF	On-Demand	Anodyne	NPR1	40	31
COC(=O)c1ccc(CC(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)cc1	ZINC000450958655	GF	On-Demand	Anodyne	SIGMAR1	15	42
COC(=O)c1ccc(CC(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)cc1	ZINC000450958655	GF	On-Demand	Anodyne	HPGDS	36	41
COC(=O)c1ccc(CC(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)cc1	ZINC000450958656	GF	On-Demand	Anodyne	NPR1	40	31
COC(=O)c1ccc(CC(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)cc1	ZINC000450958656	GF	On-Demand	Anodyne	SIGMAR1	15	42
COC(=O)c1ccc(CC(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)cc1	ZINC000450958656	GF	On-Demand	Anodyne	HPGDS	36	41
COc1cc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1O	ZINC000450958657	DF	On-Demand	Anodyne	F10	54	35
COc1cc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1O	ZINC000450958657	DF	On-Demand	Anodyne	TRPV1	34	45
COc1cc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1O	ZINC000450958657	DF	On-Demand	Anodyne	TTR	0	43
COc1cc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1O	ZINC000450958657	DF	On-Demand	Anodyne	NCE103	37	43
COc1cc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1O	ZINC000450958657	DF	On-Demand	Anodyne	P96878_MYCTU	22	43
COc1cc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1O	ZINC000450958657	DF	On-Demand	Anodyne	CAN2	0	43
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)cnc1C(F)F	ZINC000450958661	GG	On-Demand	Anodyne	ADRB2	30	44
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)cnc1C(F)F	ZINC000450958661	GG	On-Demand	Anodyne	ADRB1	22	42
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)cnc1C(F)F	ZINC000450958661	GG	On-Demand	Anodyne	ADRB3	25	44
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)cnc1C(F)F	ZINC000450958661	GG	On-Demand	Anodyne	FFAR4	19	40
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCc3ccccc32)cc1	ZINC000450958665	FG	On-Demand	Anodyne	AVPR2	34	41
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCc3ccccc32)cc1	ZINC000450958665	FG	On-Demand	Anodyne	NOD1	17	45
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCc3ccccc32)cc1	ZINC000450958665	FG	On-Demand	Anodyne	NOD2	33	45
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1Cc1ccc(OCc2cccnc2)cc1	ZINC000450958669	GJ	On-Demand	Anodyne	VCP	51	35
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1Cc1ccc(OCc2cccnc2)cc1	ZINC000450958670	GJ	On-Demand	Anodyne	VCP	51	35
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1Cc1ccc(OCc2cccnc2)cc1	ZINC000450958671	GJ	On-Demand	Anodyne	VCP	51	35
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1Cc1ccc(OCc2cccnc2)cc1	ZINC000450958672	GJ	On-Demand	Anodyne	VCP	51	35
O=S(=O)(NCc1ccccc1)c1ccc(C2CC2)cc1	ZINC000450958683	CG	On-Demand	Anodyne	NPY2R	49	41
O=S(=O)(NCc1ccccc1)c1ccc(C2CC2)cc1	ZINC000450958683	CG	On-Demand	Anodyne	LIMK2	44	35
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2Cl)CC1	ZINC000450958684	GE	On-Demand	Anodyne	HSD11B1	18	51
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2Cl)CC1	ZINC000450958684	GE	On-Demand	Anodyne	NPY2R	21	44
O=C(CNC(=O)Nc1cccc(Cl)c1)NCC1(CO)CCCC1	ZINC000450958702	EE	On-Demand	Anodyne	ACAT	0	48
O=C(CNC(=O)Nc1cccc(Cl)c1)NCC1(CO)CCCC1	ZINC000450958702	EE	On-Demand	Anodyne	NPFFR1	54	37
COc1cnc(N2CC[C@H](CCCO)C2)nc1N1CC[C@@H](CCCO)C1	ZINC000450958722	FD	On-Demand	Anodyne	PDE3A	46	35
COc1cnc(N2CC[C@H](CCCO)C2)nc1N1CC[C@@H](CCCO)C1	ZINC000450958722	FD	On-Demand	Anodyne	PDE3B	68	35
COc1cnc(N2CC[C@H](CCCO)C2)nc1N1CC[C@H](CCCO)C1	ZINC000450958723	FD	On-Demand	Anodyne	PDE3A	46	35
COc1cnc(N2CC[C@H](CCCO)C2)nc1N1CC[C@H](CCCO)C1	ZINC000450958723	FD	On-Demand	Anodyne	PDE3B	68	35
COc1cnc(N2CC[C@@H](CCCO)C2)nc1N1CC[C@@H](CCCO)C1	ZINC000450958724	FD	On-Demand	Anodyne	PDE3A	46	35
COc1cnc(N2CC[C@@H](CCCO)C2)nc1N1CC[C@@H](CCCO)C1	ZINC000450958724	FD	On-Demand	Anodyne	PDE3B	68	35
COc1cnc(N2CC[C@@H](CCCO)C2)nc1N1CC[C@H](CCCO)C1	ZINC000450958725	FD	On-Demand	Anodyne	PDE3A	46	35
COc1cnc(N2CC[C@@H](CCCO)C2)nc1N1CC[C@H](CCCO)C1	ZINC000450958725	FD	On-Demand	Anodyne	PDE3B	68	35
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450958734	GD	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CC[C@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450958735	GD	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450958736	GD	On-Demand	Bother	TAAR1	20	45
COC(=O)[C@H](C)NC(=O)c1ccc(N2CC[C@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450958737	GD	On-Demand	Bother	TAAR1	20	45
CCc1cc(N2CCN(CCO)C[C@@H]2C)nc(-c2ccccn2)n1	ZINC000450958746	ED	On-Demand	Anodyne	METAP1	17	40
CCc1cc(N2CCN(CCO)C[C@H]2C)nc(-c2ccccn2)n1	ZINC000450958747	ED	On-Demand	Anodyne	METAP1	17	40
COCCNC(=O)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450958754	DD	On-Demand	Anodyne	SIRT3	40	32
COCCNC(=O)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450958755	DD	On-Demand	Anodyne	SIRT3	40	32
C[C@H]1CN(c2nc3ccccc3nc2N2CC[C@H](CCCO)C2)C[C@@H](C)O1	ZINC000450958771	FF	On-Demand	Anodyne	PDE1B	0	44
C[C@@H]1CN(c2nc3ccccc3nc2N2CC[C@@H](CCCO)C2)C[C@@H](C)O1	ZINC000450958772	FF	On-Demand	Anodyne	PDE1B	0	44
C[C@H]1CN(c2nc3ccccc3nc2N2CC[C@@H](CCCO)C2)C[C@@H](C)O1	ZINC000450958773	FF	On-Demand	Anodyne	PDE1B	0	44
C[C@@H]1CN(c2nc3ccccc3nc2N2CC[C@H](CCCO)C2)C[C@@H](C)O1	ZINC000450958774	FF	On-Demand	Anodyne	PDE1B	0	44
Cc1onc(C2CC2)c1C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450958793	DH	On-Demand	Anodyne	KCNA3	15	40
C[C@@H]1CN(CCO)CCN1c1ccnc2ccc(Cl)cc12	ZINC000450958808	DE	On-Demand	Anodyne	HRP1_PLAFA	82	36
C[C@@H]1CN(CCO)CCN1c1ccnc2ccc(Cl)cc12	ZINC000450958808	DE	On-Demand	Anodyne	HNMT	48	34
C[C@H]1CN(CCO)CCN1c1ccnc2ccc(Cl)cc12	ZINC000450958809	DE	On-Demand	Anodyne	HRP1_PLAFA	82	36
C[C@H]1CN(CCO)CCN1c1ccnc2ccc(Cl)cc12	ZINC000450958809	DE	On-Demand	Anodyne	HNMT	48	34
COc1cc(OC)c2ncnc(N3CC(C)(CC(F)(F)F)C3)c2c1	ZINC000450958810	EG	On-Demand	Anodyne	PDE3A	44	36
CCOC(=O)c1cc(S(=O)(=O)N2CCc3ccccc3C2)cnc1C(F)F	ZINC000450958814	GF	On-Demand	Anodyne	AKR1C3	65	49
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	HTR1A	26	42
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	DRD2	23	42
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	DRD4	50	38
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	HRH3	20	45
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	MTNR1A	36	44
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	MTNR1B	42	44
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	ABCB1	17	43
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	EPHX2	18	42
COc1cccc(OCCC(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450958820	FD	On-Demand	Anodyne	CHRNA10	21	40
CCOC(=O)[C@@H](NC(=O)c1cc(C)c(C(N)=O)cn1)c1cccc(C)c1C	ZINC000450958830	FE	On-Demand	Anodyne	CSF1R	17	40
CCOC(=O)[C@H](NC(=O)c1cc(C)c(C(N)=O)cn1)c1cccc(C)c1C	ZINC000450958831	FE	On-Demand	Anodyne	CSF1R	17	40
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	CA2	28	53
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	ADRB2	16	47
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	ADRB1	15	47
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	ADRB3	15	47
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	BMP1	50	36
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	CA1	36	48
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP13	58	46
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	CA4	25	48
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	CA14	16	45
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MTNR1A	15	49
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MTNR1B	20	55
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP2	45	48
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP3	33	46
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP8	32	48
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP14	18	41
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP9	28	48
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP12	61	45
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	CA12	33	44
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP7	34	45
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	CA9	29	42
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MMP1	18	46
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	LEF	26	46
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	IDO1	36	47
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	FFAR4	26	46
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	LIMK2	21	41
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	MTCA1	27	42
COc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc(OC)c1	ZINC000450958832	GG	On-Demand	Anodyne	P96878_MYCTU	33	42
CCOC(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)cnc1C(F)F	ZINC000450958840	GG	On-Demand	Anodyne	MMP13	18	41
CCOC(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)cnc1C(F)F	ZINC000450958840	GG	On-Demand	Anodyne	ADAM17	19	41
CCOC(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)cnc1C(F)F	ZINC000450958840	GG	On-Demand	Anodyne	MMP1	17	41
CCc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450958841	FH	On-Demand	Anodyne	CA2	24	42
CCc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450958841	FH	On-Demand	Anodyne	CA1	31	44
CCc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450958841	FH	On-Demand	Anodyne	MMP13	25	45
CCc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450958841	FH	On-Demand	Anodyne	CA4	27	42
CCc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450958841	FH	On-Demand	Anodyne	LEF	58	37
CCc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450958841	FH	On-Demand	Anodyne	PFK	0	42
COc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450958843	GE	On-Demand	Anodyne	KCNA5	23	42
COc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450958843	GE	On-Demand	Anodyne	MMP13	40	38
COc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450958843	GE	On-Demand	Anodyne	PRTN3	65	40
COc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450958843	GE	On-Demand	Anodyne	ADAMTS4	41	33
COc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450958843	GE	On-Demand	Anodyne	LIMK2	17	48
COc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450958843	GE	On-Demand	Anodyne	LUXN	0	51
COc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450958843	GE	On-Demand	Anodyne	ADIPOR1	0	44
COc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450958843	GE	On-Demand	Anodyne	ADIPOR2	0	44
Cc1ccc2cc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)ccc2c1	ZINC000450958844	DF	On-Demand	Anodyne	DDIT3	0	43
Cc1ccc2cc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)ccc2c1	ZINC000450958845	DF	On-Demand	Anodyne	DDIT3	0	43
Cc1ccc2cc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)ccc2c1	ZINC000450958846	DF	On-Demand	Anodyne	DDIT3	0	43
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958851	EI	On-Demand	Anodyne	DRD2	30	44
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958851	EI	On-Demand	Anodyne	HTR2A	18	47
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958851	EI	On-Demand	Anodyne	ERG2	21	44
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958851	EI	On-Demand	Anodyne	CYP2J2	47	33
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958853	EI	On-Demand	Anodyne	DRD2	30	44
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958853	EI	On-Demand	Anodyne	HTR2A	18	47
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958853	EI	On-Demand	Anodyne	ERG2	21	44
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958853	EI	On-Demand	Anodyne	CYP2J2	47	33
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958856	EI	On-Demand	Anodyne	DRD2	30	44
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958856	EI	On-Demand	Anodyne	HTR2A	18	47
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958856	EI	On-Demand	Anodyne	ERG2	21	44
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958856	EI	On-Demand	Anodyne	CYP2J2	47	33
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958857	EI	On-Demand	Anodyne	DRD2	30	44
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958857	EI	On-Demand	Anodyne	HTR2A	18	47
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958857	EI	On-Demand	Anodyne	ERG2	21	44
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958857	EI	On-Demand	Anodyne	CYP2J2	47	33
CS(=O)(=O)c1cccc(CS(=O)(=O)N2CCN(c3ccccc3)CC2)c1	ZINC000450958858	GD	On-Demand	Anodyne	HTR1A	22	41
CS(=O)(=O)c1cccc(CS(=O)(=O)N2CCN(c3ccccc3)CC2)c1	ZINC000450958858	GD	On-Demand	Anodyne	HTR2A	16	40
CS(=O)(=O)c1cccc(CS(=O)(=O)N2CCN(c3ccccc3)CC2)c1	ZINC000450958858	GD	On-Demand	Anodyne	HTR7	29	40
CS(=O)(=O)c1cccc(CS(=O)(=O)N2CCN(c3ccccc3)CC2)c1	ZINC000450958858	GD	On-Demand	Anodyne	RORC	23	42
CO[C@@H]1CCC[C@H]1[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958881	EG	On-Demand	Anodyne	DRD4	0	40
CO[C@@H]1CCC[C@H]1[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958881	EG	On-Demand	Anodyne	CYP2J2	47	33
CO[C@@H]1CCC[C@H]1[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958882	EG	On-Demand	Anodyne	DRD4	0	40
CO[C@@H]1CCC[C@H]1[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958882	EG	On-Demand	Anodyne	CYP2J2	47	33
CO[C@@H]1CCC[C@@H]1[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958884	EG	On-Demand	Anodyne	DRD4	0	40
CO[C@@H]1CCC[C@@H]1[C@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958884	EG	On-Demand	Anodyne	CYP2J2	47	33
CO[C@@H]1CCC[C@@H]1[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958885	EG	On-Demand	Anodyne	DRD4	0	40
CO[C@@H]1CCC[C@@H]1[C@@H]1COCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450958885	EG	On-Demand	Anodyne	CYP2J2	47	33
CC(C)(C)c1cc(COc2ccc3c(c2)CCNC3=O)no1	ZINC000450958891	DF	On-Demand	Anodyne	CSNK1G2	46	39
COc1cc(C(F)(F)F)cc(S(=O)(=O)NCCCN2CCOCC2)c1	ZINC000450958896	GD	On-Demand	Anodyne	HTR7	26	58
O=C([C@@H]1C[C@@H](F)CN1CCc1c(Cl)cccc1Cl)N1CCOCC1	ZINC000450958898	GF	On-Demand	Anodyne	ITGAL	40	31
O=C(NCc1nc(COc2ccccc2)n[nH]1)C1(Cc2cccc(Cl)c2)CC1	ZINC000450958930	GH	On-Demand	Anodyne	PDS	43	36
CC[C@@H]1C[C@H]1C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450958938	CF	On-Demand	Mild	CTSK	26	42
CC[C@@H]1C[C@H]1C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450958939	CF	On-Demand	Mild	CTSK	26	42
CCOC(=O)c1ccc2c(c1)nc(Cn1nnc(-c3ccco3)n1)n2CC	ZINC000450958959	FF	On-Demand	Anodyne	ADORA1	24	42
CCOC(=O)c1ccc2c(c1)nc(Cn1nnc(-c3ccco3)n1)n2CC	ZINC000450958959	FF	On-Demand	Anodyne	ADORA3	22	42
COc1cc(CC(=O)N[C@@H](C)c2cncs2)ccc1O	ZINC000450958976	CE	On-Demand	Anodyne	TRPV1	37	46
COc1cc(CC(=O)N[C@@H](C)c2cncs2)ccc1O	ZINC000450958976	CE	On-Demand	Anodyne	NCE103	23	47
COc1cc(CC(=O)N[C@@H](C)c2cncs2)ccc1O	ZINC000450958976	CE	On-Demand	Anodyne	CAN2	0	47
C[C@H](OCCc1ccccc1)C(=O)N[C@@H](C)c1ccc(Cl)cn1	ZINC000450958989	EH	On-Demand	Anodyne	CAPN2	41	31
C[C@H](NC(=O)[C@@H](C)OCCc1ccccc1)c1ccc(Cl)cn1	ZINC000450958990	EH	On-Demand	Anodyne	CAPN2	41	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	ACE	40	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	MME	55	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	PGC	53	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	CYSP_TRYCR	64	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	TIMP3	65	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	CAPNS1	59	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	REN	63	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	CAPN1	46	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	CAPN2	48	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	CTSE	47	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	ACE2	60	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	PGA5	40	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	FPR1	47	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	POL	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959019	FG	On-Demand	Anodyne	PSMB8	41	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	ACE	40	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	MME	55	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	PGC	53	33
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	CYSP_TRYCR	64	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	TIMP3	65	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	CAPNS1	59	32
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	REN	63	38
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	CAPN1	46	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	CAPN2	48	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	CTSE	47	31
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	ACE2	60	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	PGA5	40	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	FPR1	47	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959020	FG	On-Demand	Anodyne	PSMB8	41	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	ACE	40	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	MME	55	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	PGC	53	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	CYSP_TRYCR	64	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	TIMP3	65	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	CAPNS1	59	32
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	REN	63	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	CAPN1	46	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	CAPN2	48	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	CTSE	47	31
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	ACE2	60	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	PGA5	40	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	FPR1	47	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	POL	0	41
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959021	FG	On-Demand	Anodyne	PSMB8	41	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	ACE	40	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	MME	55	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	PGC	53	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	CYSP_TRYCR	64	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	TIMP3	65	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	CAPNS1	59	32
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	REN	63	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	CAPN1	46	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	CAPN2	48	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	CTSE	47	31
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	ACE2	60	35
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	PGA5	40	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	FPR1	47	36
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	POL	0	41
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450959022	FG	On-Demand	Anodyne	PSMB8	41	34
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959046	ED	On-Demand	Anodyne	ERBB2	24	47
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959046	ED	On-Demand	Anodyne	HRH3	33	48
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959046	ED	On-Demand	Anodyne	PREP	67	42
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959046	ED	On-Demand	Anodyne	MMP2	0	47
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959046	ED	On-Demand	Anodyne	SSTR1	26	41
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959046	ED	On-Demand	Anodyne	ADAM10	42	43
O=C(C1CC1)N1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959046	ED	On-Demand	Anodyne	AKR1C3	0	40
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959047	ED	On-Demand	Anodyne	ERBB2	24	47
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959047	ED	On-Demand	Anodyne	HRH3	33	48
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959047	ED	On-Demand	Anodyne	PREP	67	42
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959047	ED	On-Demand	Anodyne	MMP2	0	47
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959047	ED	On-Demand	Anodyne	SSTR1	26	41
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959047	ED	On-Demand	Anodyne	ADAM10	42	43
O=C(C1CC1)N1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450959047	ED	On-Demand	Anodyne	AKR1C3	0	40
CCOc1nc2ccc(C(=O)N[C@H](C)C3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450959063	GG	On-Demand	Anodyne	PLD1	47	36
CCOc1nc2ccc(C(=O)N[C@H](C)C3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450959063	GG	On-Demand	Anodyne	HPGDS	39	42
CCOc1nc2ccc(C(=O)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450959064	GG	On-Demand	Anodyne	PLD1	47	36
CCOc1nc2ccc(C(=O)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450959064	GG	On-Demand	Anodyne	HPGDS	39	42
C[C@H](NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1)c1ccc(Cl)cn1	ZINC000450959065	FH	On-Demand	Anodyne	F10	32	40
CN(CC1(c2ccccc2)CC1)C(=O)C(C)(C)C1CCC1	ZINC000450959074	CI	On-Demand	Anodyne	KCNA3	33	42
CN(CC1(c2ccccc2)CC1)C(=O)C(C)(C)C1CCC1	ZINC000450959074	CI	On-Demand	Anodyne	AMY2	49	35
Cc1ccc(F)c(CC(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450959075	DE	On-Demand	Anodyne	PREP	48	32
CC[C@H](O)CC(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450959083	DF	On-Demand	Anodyne	CAPN2	46	32
CC[C@@H](O)CC(=O)NCC1(CCOCc2ccccc2)CC1	ZINC000450959084	DF	On-Demand	Anodyne	CAPN2	46	32
COc1cc(N2CC[C@H](CCCO)C2)ncn1	ZINC000450959088	BD	On-Demand	Anodyne	PDE3B	52	32
COc1cc(N2CC[C@@H](CCCO)C2)ncn1	ZINC000450959089	BD	On-Demand	Anodyne	PDE3B	52	32
CCc1cccc(C(=O)N[C@H](C(=O)OC)c2ccc(OC)c(Cl)c2)n1	ZINC000450959093	FF	On-Demand	Anodyne	PDE5A	29	46
CCc1cccc(C(=O)N[C@@H](C(=O)OC)c2ccc(OC)c(Cl)c2)n1	ZINC000450959094	FF	On-Demand	Anodyne	PDE5A	29	46
OCCC[C@H]1CCN(c2cc(C(F)(F)F)ccn2)C1	ZINC000450959097	CF	On-Demand	Anodyne	LIPG	51	36
OCCC[C@@H]1CCN(c2cc(C(F)(F)F)ccn2)C1	ZINC000450959098	CF	On-Demand	Anodyne	LIPG	51	36
O=S(=O)(NCCCN1CCOCC1)c1sc2ccccc2c1Cl	ZINC000450959102	FF	On-Demand	Anodyne	HTR7	26	40
O=S(=O)(NCCCN1CCOCC1)c1sc2ccccc2c1Cl	ZINC000450959102	FF	On-Demand	Anodyne	HTR6	0	45
Cc1ccc2ncnc(N3CC(C)(CC(F)(F)F)C3)c2c1	ZINC000450959110	CH	On-Demand	Anodyne	HTT	0	42
Cc1ccc(F)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450959111	GF	On-Demand	Anodyne	MMP13	15	40
Cc1ccc(F)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450959111	GF	On-Demand	Anodyne	PRTN3	54	34
Cc1ccc(F)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450959111	GF	On-Demand	Anodyne	FFAR4	23	40
Cc1ccc(F)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450959111	GF	On-Demand	Anodyne	LUXN	0	44
Cc1csc(NC2CCN(C(=O)c3c(C)cccc3Cl)CC2)n1	ZINC000450959114	EI	On-Demand	Anodyne	CCR5	22	45
Cc1csc(NC2CCN(C(=O)c3c(C)cccc3Cl)CC2)n1	ZINC000450959114	EI	On-Demand	Anodyne	TRPC6	52	39
COc1cccc(OCCC(=O)N2CCC(Nc3nc(C)cs3)CC2)c1	ZINC000450959123	GG	On-Demand	Anodyne	TRPC6	48	39
Cc1ccc2oc(N3CC[C@@H](CCCO)C3)nc2c1	ZINC000450959133	CF	On-Demand	Anodyne	PTGES	34	42
Cc1ccc2oc(N3CC[C@H](CCCO)C3)nc2c1	ZINC000450959136	CF	On-Demand	Anodyne	PTGES	34	42
COc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450959147	CF	On-Demand	Anodyne	MMP13	40	37
COc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450959147	CF	On-Demand	Anodyne	MMP2	30	41
COc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450959147	CF	On-Demand	Anodyne	MMP3	42	39
COc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450959147	CF	On-Demand	Anodyne	MMP14	24	44
COc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450959147	CF	On-Demand	Anodyne	MMP9	35	42
COc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450959147	CF	On-Demand	Anodyne	MMP7	45	38
COc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450959147	CF	On-Demand	Anodyne	MMP1	46	40
COc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450959149	CF	On-Demand	Anodyne	MMP13	40	37
COc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450959149	CF	On-Demand	Anodyne	MMP2	30	41
COc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450959149	CF	On-Demand	Anodyne	MMP3	42	39
COc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450959149	CF	On-Demand	Anodyne	MMP14	24	44
COc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450959149	CF	On-Demand	Anodyne	MMP9	35	42
COc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450959149	CF	On-Demand	Anodyne	MMP7	45	38
COc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450959149	CF	On-Demand	Anodyne	MMP1	46	40
COc1cc2c(N3CCN(CCO)C[C@H]3C)ccnc2cc1F	ZINC000450959154	DD	On-Demand	Anodyne	FGFR2	42	35
COc1cc2c(N3CCN(CCO)C[C@H]3C)ccnc2cc1F	ZINC000450959154	DD	On-Demand	Anodyne	MET	57	34
COc1cc2c(N3CCN(CCO)C[C@@H]3C)ccnc2cc1F	ZINC000450959157	DD	On-Demand	Anodyne	FGFR2	42	35
COc1cc2c(N3CCN(CCO)C[C@@H]3C)ccnc2cc1F	ZINC000450959157	DD	On-Demand	Anodyne	MET	57	34
CCOC(=O)c1ccc(CS(=O)(=O)N2CCc3ccccc3C2)cc1	ZINC000450959164	FF	On-Demand	Anodyne	AKR1C3	61	42
CCOC(=O)c1ccc(CS(=O)(=O)N2CCc3ccccc3C2)cc1	ZINC000450959164	FF	On-Demand	Anodyne	NOD1	33	56
CCOC(=O)c1ccc(CS(=O)(=O)N2CCc3ccccc3C2)cc1	ZINC000450959164	FF	On-Demand	Anodyne	NOD2	51	56
Cc1csc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c1	ZINC000450959166	DF	On-Demand	Anodyne	GCKR	24	43
CNS(=O)(=O)NCC(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450959196	FD	On-Demand	Anodyne	NPFFR2	35	44
CNS(=O)(=O)NCC(=O)NCC1(Cc2ccccc2)CCCCC1	ZINC000450959196	FD	On-Demand	Anodyne	NPFFR1	54	48
CO[C@H]1C[C@@H](CO)N(Cc2ccccc2OC2CC2)C1	ZINC000450959197	CD	On-Demand	Anodyne	SLC5A4	56	34
Cc1nccc(N2CC[C@@H](CCCO)C2)n1	ZINC000450959204	BD	On-Demand	Anodyne	SORD	57	35
Cc1nccc(N2CC[C@H](CCCO)C2)n1	ZINC000450959206	BD	On-Demand	Anodyne	SORD	57	35
CC(C)c1noc(-c2ccnc(N3CCN(CCO)C[C@H]3C)c2)n1	ZINC000450959217	ED	On-Demand	Anodyne	SORD	33	41
CC(C)c1noc(-c2ccnc(N3CCN(CCO)C[C@@H]3C)c2)n1	ZINC000450959218	ED	On-Demand	Anodyne	SORD	33	41
CCc1cc(N2CC(C)(CC(F)(F)F)C2)n2ncnc2n1	ZINC000450959225	CE	On-Demand	Anodyne	DHOD	0	44
COc1cc(CC(=O)N2CCSC[C@@H]2c2nccs2)ccc1Cl	ZINC000450959234	FH	On-Demand	Anodyne	OPRK1	34	42
COc1cc(CC(=O)N2CCSC[C@H]2c2nccs2)ccc1Cl	ZINC000450959235	FH	On-Demand	Anodyne	OPRK1	34	42
CSc1cccc(C(=O)NC(C)(C)CCN2CCN(C)CC2)c1	ZINC000450959238	EF	On-Demand	Anodyne	DRD4	44	34
CCOC(=O)c1cc(S(=O)(=O)NCc2ccccc2)cnc1C(F)F	ZINC000450959239	FF	On-Demand	Anodyne	PDS	74	37
CC(C)C[C@H](C)Sc1cccc(C(N)=O)c1	ZINC000450959248	BG	On-Demand	Anodyne	MVFR	0	41
CC(C)C[C@@H](C)Sc1cccc(C(N)=O)c1	ZINC000450959249	BG	On-Demand	Anodyne	MVFR	0	41
COc1cccc(-n2cc(C(=O)NC(C)(C)CCN3CCN(C)CC3)nn2)c1	ZINC000450959250	GD	On-Demand	Anodyne	HTR1A	16	43
COc1cccc(-n2cc(C(=O)NC(C)(C)CCN3CCN(C)CC3)nn2)c1	ZINC000450959250	GD	On-Demand	Anodyne	DRD4	52	40
COc1cccc(-n2cc(C(=O)NC(C)(C)CCN3CCN(C)CC3)nn2)c1	ZINC000450959250	GD	On-Demand	Anodyne	DRD3	26	46
CC(=O)CCCCCSc1cccc(C(N)=O)c1	ZINC000450959251	CG	On-Demand	Anodyne	PARP10	0	48
CCOc1ccc(S(=O)(=O)C[C@@H]2CCC(F)(F)C2)cc1	ZINC000450959261	DG	On-Demand	Anodyne	MMP2	16	42
CCOc1ccc(S(=O)(=O)C[C@@H]2CCC(F)(F)C2)cc1	ZINC000450959261	DG	On-Demand	Anodyne	MMP14	19	42
CCOc1ccc(S(=O)(=O)C[C@H]2CCC(F)(F)C2)cc1	ZINC000450959262	DG	On-Demand	Anodyne	MMP2	16	42
CCOc1ccc(S(=O)(=O)C[C@H]2CCC(F)(F)C2)cc1	ZINC000450959262	DG	On-Demand	Anodyne	MMP14	19	42
CC[C@@H](CC(F)(F)F)C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450959264	DH	On-Demand	Mild	CTSF	24	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450959264	DH	On-Demand	Mild	CTSK	17	43
CC[C@@H](CC(F)(F)F)C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450959266	DH	On-Demand	Mild	CTSF	24	41
CC[C@@H](CC(F)(F)F)C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450959266	DH	On-Demand	Mild	CTSK	17	43
CC[C@H](CC(F)(F)F)C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450959268	DH	On-Demand	Mild	CTSF	24	41
CC[C@H](CC(F)(F)F)C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450959268	DH	On-Demand	Mild	CTSK	17	43
CC[C@H](CC(F)(F)F)C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450959270	DH	On-Demand	Mild	CTSF	24	41
CC[C@H](CC(F)(F)F)C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450959270	DH	On-Demand	Mild	CTSK	17	43
CC1=C(C(=O)Nc2cnns2)CCC(C)(C)C1	ZINC000450959275	CG	On-Demand	Anodyne	AHK3	0	42
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1c2c(nn1C(C)C)CCC2	ZINC000450959282	FJ	On-Demand	Anodyne	SORT1	17	42
CCCOc1cccc(CS(=O)(=O)c2ccc(OCC)cc2)c1	ZINC000450959289	EH	On-Demand	Anodyne	CA7	22	49
CCCOc1cccc(CS(=O)(=O)c2ccc(OCC)cc2)c1	ZINC000450959289	EH	On-Demand	Anodyne	PLA2G4B	31	41
COc1cc(CN2CC[C@H]3[C@@H](C2)NC(=O)N3C(C)C)ccc1Cl	ZINC000450959300	EF	On-Demand	Anodyne	SSTR5	42	35
COc1cc(CN2CC[C@H]3[C@@H](C2)NC(=O)N3C(C)C)ccc1Cl	ZINC000450959300	EF	On-Demand	Anodyne	CCR1	26	41
COc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450959313	CF	On-Demand	Anodyne	THRB	0	43
COc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450959313	CF	On-Demand	Anodyne	MMP13	43	61
COc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450959313	CF	On-Demand	Anodyne	ADAM17	25	40
COc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450959313	CF	On-Demand	Anodyne	MMP3	42	39
COc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450959313	CF	On-Demand	Anodyne	MMP8	26	41
COc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450959313	CF	On-Demand	Anodyne	MMP9	40	41
COc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450959313	CF	On-Demand	Anodyne	MMP1	50	44
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	CA2	34	57
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	CA1	39	47
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	MMP13	32	41
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	CA4	37	47
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	CA14	17	48
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	MMP2	21	41
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	MMP12	42	38
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	CA12	23	57
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	CA9	30	50
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	LEF	53	38
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	IDO1	47	45
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	FFAR4	30	43
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	PFK	0	40
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959315	EH	On-Demand	Anodyne	P96878_MYCTU	47	50
COC(=O)c1ccc(Cn2cnc(C(C)(C)C)cc2=O)cc1Cl	ZINC000450959340	EG	On-Demand	Anodyne	DNAE	70	35
COC(=O)c1ccc(Cn2cnc(C(C)(C)C)cc2=O)cc1Cl	ZINC000450959340	EG	On-Demand	Anodyne	SCD1	0	41
O=C1c2ccccc2C(=O)N1CCOCCSCc1cn(CC2CC2)nn1	ZINC000450959369	GE	On-Demand	Anodyne	HSP90AB1	0	47
COc1cc(CN2CCC[C@H]3C(=O)N(C)C[C@H]32)ccc1Cl	ZINC000450959381	DE	On-Demand	Anodyne	UTS2R	17	40
COC(=O)C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959455	EF	On-Demand	Anodyne	UTS2	36	46
COC(=O)C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959455	EF	On-Demand	Anodyne	METAP2	0	48
COC(=O)C[C@H](NC(=O)[C@@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959455	EF	On-Demand	Anodyne	GPR88	0	41
COC(=O)C[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959457	EF	On-Demand	Anodyne	UTS2	36	46
COC(=O)C[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959457	EF	On-Demand	Anodyne	METAP2	0	48
COC(=O)C[C@@H](NC(=O)[C@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959457	EF	On-Demand	Anodyne	GPR88	0	41
COC(=O)C[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959458	EF	On-Demand	Anodyne	UTS2	36	46
COC(=O)C[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959458	EF	On-Demand	Anodyne	METAP2	0	48
COC(=O)C[C@@H](NC(=O)[C@@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959458	EF	On-Demand	Anodyne	GPR88	0	41
COC(=O)C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959459	EF	On-Demand	Anodyne	UTS2	36	46
COC(=O)C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959459	EF	On-Demand	Anodyne	METAP2	0	48
COC(=O)C[C@H](NC(=O)[C@H](O)C1CCC1)c1ccc2ccccc2c1	ZINC000450959459	EF	On-Demand	Anodyne	GPR88	0	41
C[C@@H](CCN1CCN(C)CC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450959460	FE	On-Demand	Anodyne	TACR2	67	41
C[C@@H](CCN1CCN(C)CC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450959460	FE	On-Demand	Anodyne	SIGMAR1	23	40
C[C@H](CCN1CCN(C)CC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450959461	FE	On-Demand	Anodyne	TACR2	67	41
C[C@H](CCN1CCN(C)CC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450959461	FE	On-Demand	Anodyne	SIGMAR1	23	40
Cc1ccc(Br)cc1CC(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450959491	GF	On-Demand	Anodyne	PREP	47	32
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450959494	GJ	On-Demand	Anodyne	PRCP	20	50
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450959494	GJ	On-Demand	Anodyne	CPT1A	69	38
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450959496	FH	On-Demand	Anodyne	HDAC1	29	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](CCCO)C2)nc1	ZINC000450959496	FH	On-Demand	Anodyne	DGAT1	30	44
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450959497	GJ	On-Demand	Anodyne	PRCP	20	50
O=C(c1ccc(C(F)(F)F)[nH]1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450959497	GJ	On-Demand	Anodyne	CPT1A	69	38
Cc1cccc(-c2noc(CN3CCC[C@@H]3[C@H]3CCCC[C@@]3(C)O)n2)c1	ZINC000450959502	FH	On-Demand	Anodyne	GRM5	22	48
Cc1cccc(-c2noc(CN3CCC[C@@H]3[C@H]3CCCC[C@]3(C)O)n2)c1	ZINC000450959503	FH	On-Demand	Anodyne	GRM5	22	48
Cc1cccc(-c2noc(CN3CCC[C@@H]3[C@@H]3CCCC[C@]3(C)O)n2)c1	ZINC000450959504	FH	On-Demand	Anodyne	GRM5	22	48
Cc1cccc(-c2noc(CN3CCC[C@@H]3[C@@H]3CCCC[C@@]3(C)O)n2)c1	ZINC000450959505	FH	On-Demand	Anodyne	GRM5	22	48
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450959511	FH	On-Demand	Anodyne	HDAC1	29	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](CCCO)C2)nc1	ZINC000450959511	FH	On-Demand	Anodyne	DGAT1	30	44
COc1ccc(-c2nc(CC[C@@H]3CCCCO3)cs2)cc1	ZINC000450959512	DI	On-Demand	Anodyne	AVPR1B	23	47
COc1ccc(-c2nc(CC[C@@H]3CCCCO3)cs2)cc1	ZINC000450959512	DI	On-Demand	Anodyne	LUCI_PHOPY	29	40
COc1ccc(-c2nc(CC[C@H]3CCCCO3)cs2)cc1	ZINC000450959513	DI	On-Demand	Anodyne	AVPR1B	23	47
COc1ccc(-c2nc(CC[C@H]3CCCCO3)cs2)cc1	ZINC000450959513	DI	On-Demand	Anodyne	LUCI_PHOPY	29	40
C[C@@H]1CN(C[C@H](O)[C@@H](C)c2ccccc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450959515	ED	On-Demand	Anodyne	CASR	40	35
C[C@@H]1CN(C[C@@H](O)[C@H](C)c2ccccc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450959517	ED	On-Demand	Anodyne	CASR	40	35
C[C@@H]1CN(C[C@H](O)[C@H](C)c2ccccc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450959519	ED	On-Demand	Anodyne	CASR	40	35
C[C@@H]1CN(C[C@@H](O)[C@@H](C)c2ccccc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450959521	ED	On-Demand	Anodyne	CASR	40	35
C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1cncs1	ZINC000450959523	FH	On-Demand	Anodyne	PRCP	16	43
COCCNC(=O)c1ccc(N2CCN(CCO)C[C@H]2C)nc1	ZINC000450959526	DB	On-Demand	Anodyne	DRD4	41	32
CCc1cccc(NC(=O)CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1	ZINC000450959532	EH	On-Demand	Anodyne	P2RY14	43	33
CCc1cccc(NC(=O)CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1	ZINC000450959533	EH	On-Demand	Anodyne	P2RY14	43	33
CCc1cccc(NC(=O)CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1	ZINC000450959534	EH	On-Demand	Anodyne	P2RY14	43	33
CCc1cccc(NC(=O)CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1	ZINC000450959535	EH	On-Demand	Anodyne	P2RY14	43	33
COCCNC(=O)c1ccc(N2CCN(CCO)C[C@@H]2C)nc1	ZINC000450959541	DB	On-Demand	Anodyne	DRD4	41	32
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450959559	GH	On-Demand	Anodyne	PRCP	49	60
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450959559	GH	On-Demand	Anodyne	COLA	139	46
Cc1nc(C)n(CCCC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450959559	GH	On-Demand	Anodyne	CPT1A	131	46
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450959560	GH	On-Demand	Anodyne	PRCP	49	60
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450959560	GH	On-Demand	Anodyne	COLA	139	46
Cc1nc(C)n(CCCC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)n1	ZINC000450959560	GH	On-Demand	Anodyne	CPT1A	131	46
COc1cc2nc(N3CC[C@@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959564	ED	On-Demand	Anodyne	ADRA1D	17	53
COc1cc2nc(N3CC[C@@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959564	ED	On-Demand	Anodyne	ADRA1B	48	50
COc1cc2nc(N3CC[C@@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959564	ED	On-Demand	Anodyne	PDE3A	48	37
COc1cc2nc(N3CC[C@@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959564	ED	On-Demand	Anodyne	CCR4	48	44
COc1cc2nc(N3CC[C@@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959564	ED	On-Demand	Anodyne	PDE3B	71	37
COc1cc2nc(N3CC[C@@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959564	ED	On-Demand	Anodyne	EHMT2	75	38
COc1cc2nc(N3CC[C@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959565	ED	On-Demand	Anodyne	ADRA1D	17	53
COc1cc2nc(N3CC[C@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959565	ED	On-Demand	Anodyne	ADRA1B	48	50
COc1cc2nc(N3CC[C@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959565	ED	On-Demand	Anodyne	PDE3A	48	37
COc1cc2nc(N3CC[C@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959565	ED	On-Demand	Anodyne	CCR4	48	44
COc1cc2nc(N3CC[C@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959565	ED	On-Demand	Anodyne	PDE3B	71	37
COc1cc2nc(N3CC[C@H](CCCO)C3)nc(N)c2cc1OC	ZINC000450959565	ED	On-Demand	Anodyne	EHMT2	75	38
CCOC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)cnc1C(F)F	ZINC000450959572	FD	On-Demand	Anodyne	PDE5A	30	40
CCOC(=O)c1cc(S(=O)(=O)Nc2cc(F)ccc2C)cnc1C(F)F	ZINC000450959576	GG	On-Demand	Anodyne	TLR4	15	42
Cc1nn(C)cc1COc1ccc2c(c1)CCNC2=O	ZINC000450959577	CD	On-Demand	Anodyne	CSNK1G2	42	35
CC[C@@H]1CCCCN1S(=O)(=O)c1sccc1Cl	ZINC000450959588	CG	On-Demand	Anodyne	CASP7	54	34
CC[C@H]1CCCCN1S(=O)(=O)c1sccc1Cl	ZINC000450959589	CG	On-Demand	Anodyne	CASP7	54	34
CN1CCN(CCC(C)(C)NC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450959637	FE	On-Demand	Anodyne	P2RY12	98	36
CN1CCN(CCC(C)(C)NC(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450959637	FE	On-Demand	Anodyne	CTSV	45	30
COc1ccc(NC(=O)CCN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)cc1Cl	ZINC000450959643	GI	On-Demand	Anodyne	ENPP1	69	35
COc1ccc(NC(=O)CCN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)cc1Cl	ZINC000450959644	GI	On-Demand	Anodyne	ENPP1	69	35
COc1ccc(NC(=O)CCN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)cc1Cl	ZINC000450959645	GI	On-Demand	Anodyne	ENPP1	69	35
COc1ccc(NC(=O)CCN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)cc1Cl	ZINC000450959646	GI	On-Demand	Anodyne	ENPP1	69	35
Cc1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000450959655	CF	On-Demand	Anodyne	AKR1C3	72	51
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450959683	GG	On-Demand	Anodyne	TACR1	39	40
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450959683	GG	On-Demand	Anodyne	MC4R	38	42
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450959683	GG	On-Demand	Anodyne	MC3R	0	42
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450959683	GG	On-Demand	Anodyne	MC5R	0	42
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450959683	GG	On-Demand	Anodyne	LIPE	15	42
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450959683	GG	On-Demand	Anodyne	MCHR1	27	46
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1	ZINC000450959683	GG	On-Demand	Anodyne	GPR88	0	43
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1CC(C)C)c1ccc(OC)c(O)c1	ZINC000450959686	EE	On-Demand	Anodyne	FOLH1	47	42
COC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1CC(C)C)c1ccc(OC)c(O)c1	ZINC000450959687	EE	On-Demand	Anodyne	FOLH1	47	42
Cc1cccc(NC(=O)c2c3n(c(=O)n2C)CCCC3)c1Br	ZINC000450959693	FF	On-Demand	Anodyne	BRPF1	0	40
COc1cc(OC)c2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450959699	DE	On-Demand	Anodyne	PDE3A	54	43
COc1cc(OC)c2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450959699	DE	On-Demand	Anodyne	PDE3B	80	43
COc1cc(OC)c2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450959700	DE	On-Demand	Anodyne	PDE3A	54	43
COc1cc(OC)c2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450959700	DE	On-Demand	Anodyne	PDE3B	80	43
CC[C@@H](O)CC(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450959712	CE	On-Demand	Anodyne	MTNR1A	23	47
CC[C@H](O)CC(=O)NCCc1cn(C)c2cc(F)ccc12	ZINC000450959713	CE	On-Demand	Anodyne	MTNR1A	23	47
CC(C)N1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450959718	EF	On-Demand	Anodyne	DRD2	34	44
CC(C)N1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450959718	EF	On-Demand	Anodyne	DRD4	0	53
CC(C)N1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450959718	EF	On-Demand	Anodyne	HTR2A	32	56
CC(C)N1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450959718	EF	On-Demand	Anodyne	HTR2C	28	56
CC(C)N1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450959718	EF	On-Demand	Anodyne	SLC18A3	0	45
CC(C)N1C(=O)N[C@@H]2CN(CCCC(=O)c3ccc(F)cc3)CC[C@@H]21	ZINC000450959718	EF	On-Demand	Anodyne	CYP2J2	55	39
CN(CCN(C)C1CC1)C(=O)c1ccc(N2CCC2)nc1	ZINC000450959719	CD	On-Demand	Anodyne	HPGDS	15	42
COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc(OC)c(O)c1	ZINC000450959758	GF	On-Demand	Anodyne	GPR88	0	42
COC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1ccc(OC)c(O)c1	ZINC000450959759	GF	On-Demand	Anodyne	GPR88	0	42
C[C@H](O)CN(C)C1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450959762	GD	On-Demand	Anodyne	PIK3CD	17	42
C[C@H](O)CN(C)C1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450959762	GD	On-Demand	Anodyne	PIK3CB	32	42
C[C@@H](O)CN(C)C1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450959763	GD	On-Demand	Anodyne	PIK3CD	17	42
C[C@@H](O)CN(C)C1CCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CC1	ZINC000450959763	GD	On-Demand	Anodyne	PIK3CB	32	42
CC(C)(NC(=O)c1ccc(N2CCC2)nc1)c1cccc(Cl)c1F	ZINC000450959803	EH	On-Demand	Anodyne	DGAT1	30	41
CC(C)(NC(=O)c1ccc(N2CCC2)nc1)c1cccc(Cl)c1F	ZINC000450959803	EH	On-Demand	Anodyne	HPGDS	26	45
COc1ccc(CNC(=O)CCN2C[C@@H](C)[C@H](C(N)=O)C2)c(OC)c1	ZINC000450959856	EC	On-Demand	Anodyne	MTNR1A	45	36
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cn(C)nc1C(F)(F)F	ZINC000450959857	GE	On-Demand	Bother	KCNMA1	18	41
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cn(C)nc1C(F)(F)F	ZINC000450959857	GE	On-Demand	Bother	ALPL	17	42
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C1(CF)CCOCC1	ZINC000450959876	FF	On-Demand	Anodyne	TIMP3	68	35
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C1(CF)CCOCC1	ZINC000450959879	FF	On-Demand	Anodyne	TIMP3	68	35
CSc1cccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450959894	DE	On-Demand	Anodyne	PREP	33	45
CSc1cccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450959894	DE	On-Demand	Anodyne	RHOA	0	46
CSc1cccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450959894	DE	On-Demand	Anodyne	NMUR2	0	43
CSc1cccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450959894	DE	On-Demand	Anodyne	NMUR1	0	43
CSc1cccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450959894	DE	On-Demand	Anodyne	L3MBTL1	0	48
CSc1cccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450959894	DE	On-Demand	Anodyne	L3MBTL3	70	48
CSc1cccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450959894	DE	On-Demand	Anodyne	HPGD	44	35
N#Cc1ccc(N2CC[C@@H](CCCO)C2)cc1Cl	ZINC000450959895	CF	On-Demand	Mild	PGR	0	40
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1cncs1	ZINC000450959896	DH	On-Demand	Anodyne	SORT1	15	41
N#Cc1ccc(N2CC[C@H](CCCO)C2)cc1Cl	ZINC000450959897	CF	On-Demand	Mild	PGR	0	40
CCS(=O)(=O)c1ccc(CN2C[C@@H](C)[C@H](C(=O)N3CCOCC3)C2)cc1	ZINC000450959898	GD	On-Demand	Anodyne	SSTR3	52	33
C[C@H]1CN(CCO)CCN1c1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450959902	FC	On-Demand	Anodyne	GCKR	69	39
C[C@@H]1CN(CCO)CCN1c1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000450959905	FC	On-Demand	Anodyne	GCKR	69	39
CNC(=O)c1ccc(N2CC[C@@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450959909	DD	On-Demand	Bother	TAAR1	17	41
CNC(=O)c1ccc(N2CC[C@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000450959910	DD	On-Demand	Bother	TAAR1	17	41
CCOC(=O)[C@H](NC(=O)c1cc2n(n1)CCCC2)c1cccc(C)c1C	ZINC000450959911	FF	On-Demand	Anodyne	P2RY12	41	33
CN(CC1(c2ccccc2)CC1)C(=O)c1ccsc1Br	ZINC000450959920	FI	On-Demand	Anodyne	KCNA3	28	50
CCOC(=O)c1sc2ncnc(N3CC[C@@H](CCCO)C3)c2c1C	ZINC000450959923	EF	On-Demand	Anodyne	SIRT3	52	33
CCOC(=O)c1sc2ncnc(N3CC[C@@H](CCCO)C3)c2c1C	ZINC000450959923	EF	On-Demand	Anodyne	SIRT2	53	33
CCOC(=O)c1sc2ncnc(N3CC[C@H](CCCO)C3)c2c1C	ZINC000450959924	EF	On-Demand	Anodyne	SIRT3	52	33
CCOC(=O)c1sc2ncnc(N3CC[C@H](CCCO)C3)c2c1C	ZINC000450959924	EF	On-Demand	Anodyne	SIRT2	53	33
CCOC(=O)[C@@H](NC(=O)c1cc2n(n1)CCCC2)c1cccc(C)c1C	ZINC000450959927	FF	On-Demand	Anodyne	P2RY12	41	33
CC(=O)c1cn(CC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)nn1	ZINC000450959936	GF	On-Demand	Anodyne	PRCP	25	56
CC(=O)c1cn(CC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)nn1	ZINC000450959936	GF	On-Demand	Anodyne	COLA	117	41
CC(=O)c1cn(CC(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)nn1	ZINC000450959936	GF	On-Demand	Anodyne	CPT1A	111	41
CC(=O)c1cn(CC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)nn1	ZINC000450959940	GF	On-Demand	Anodyne	PRCP	25	56
CC(=O)c1cn(CC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)nn1	ZINC000450959940	GF	On-Demand	Anodyne	COLA	117	41
CC(=O)c1cn(CC(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)nn1	ZINC000450959940	GF	On-Demand	Anodyne	CPT1A	111	41
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	CA2	21	52
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	CA1	24	41
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	MMP13	23	40
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	GRM4	16	42
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	CA14	15	44
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	MMP2	15	40
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	CA12	18	41
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	CA9	20	41
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	LEF	58	37
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	IDO1	35	43
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	FFAR4	29	42
Cc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450959979	EH	On-Demand	Anodyne	PFK	0	42
Cc1nn([C@H](C(=O)NCc2cccnc2)C(C)C)cc1[N+](=O)[O-]	ZINC000450959980	DE	On-Demand	Bother	NAMPT	40	38
Cc1nn([C@@H](C(=O)NCc2cccnc2)C(C)C)cc1[N+](=O)[O-]	ZINC000450959989	DE	On-Demand	Bother	NAMPT	40	38
Cn1nc(-c2ccccc2)cc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450959993	FE	On-Demand	Anodyne	P2RY12	66	38
Cn1nc(-c2ccccc2)cc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450959993	FE	On-Demand	Anodyne	PREP	61	40
COc1ccc(S(=O)(=O)CCC2=CCCCC2)cc1	ZINC000450960006	CG	On-Demand	Anodyne	MMP13	15	49
Cc1csc(S(=O)(=O)Nc2c(C)cc(C)cc2C)c1	ZINC000450960008	CH	On-Demand	Anodyne	FFAR4	35	51
Cc1csc(S(=O)(=O)Nc2c(C)cc(C)cc2C)c1	ZINC000450960008	CH	On-Demand	Anodyne	RAPGEF4	49	31
O=C(N1CCCC2(CC2)C1)C1(Cc2ccccc2)CCOCC1	ZINC000450960011	DG	On-Demand	Anodyne	SLC12A5	54	36
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960013	GH	On-Demand	Anodyne	CSNK1D	44	45
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960013	GH	On-Demand	Anodyne	FABK	0	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960013	GH	On-Demand	Anodyne	SLC27A1	28	42
COc1ccc(CCN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)cc1	ZINC000450960014	DH	On-Demand	Anodyne	HRH3	44	44
COc1ccc(CCN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)cc1	ZINC000450960014	DH	On-Demand	Anodyne	SIGMAR1	18	45
COc1ccc(CCN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)cc1	ZINC000450960015	DH	On-Demand	Anodyne	HRH3	44	44
COc1ccc(CCN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)cc1	ZINC000450960015	DH	On-Demand	Anodyne	SIGMAR1	18	45
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960016	GH	On-Demand	Anodyne	CSNK1D	44	45
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960016	GH	On-Demand	Anodyne	FABK	0	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960016	GH	On-Demand	Anodyne	SLC27A1	28	42
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960017	GH	On-Demand	Anodyne	CSNK1D	44	45
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960017	GH	On-Demand	Anodyne	FABK	0	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960017	GH	On-Demand	Anodyne	SLC27A1	28	42
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960018	GH	On-Demand	Anodyne	CSNK1D	44	45
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960018	GH	On-Demand	Anodyne	FABK	0	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccc(F)cc2s1	ZINC000450960018	GH	On-Demand	Anodyne	SLC27A1	28	42
COC(=O)c1ccc(CC(=O)NC(C)(C)CCN2CCN(C)CC2)cc1	ZINC000450960030	FD	On-Demand	Anodyne	CACNA1I	33	41
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	CHRM2	47	46
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	BMP1	42	41
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP13	50	50
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	ADAM17	22	44
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP16	0	42
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP2	37	53
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP3	55	53
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP8	40	39
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP9	41	44
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP12	27	40
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP7	51	48
COc1ccc(S(=O)(=O)[C@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960031	DG	On-Demand	Anodyne	MMP1	53	49
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	CHRM2	47	46
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	BMP1	42	41
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP13	50	50
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	ADAM17	22	44
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP16	0	42
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP2	37	53
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP3	55	53
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP8	40	39
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP9	41	44
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP12	27	40
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP7	51	48
COc1ccc(S(=O)(=O)[C@@H](C)C(=O)C2CCCCC2)cc1	ZINC000450960032	DG	On-Demand	Anodyne	MMP1	53	49
CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(OC)c2)cnc1C(F)F	ZINC000450960039	GG	On-Demand	Anodyne	P2RY12	19	42
CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(OC)c2)cnc1C(F)F	ZINC000450960039	GG	On-Demand	Anodyne	MTNR1B	23	41
CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(OC)c2)cnc1C(F)F	ZINC000450960039	GG	On-Demand	Anodyne	GPR119	24	47
CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(OC)c2)cnc1C(F)F	ZINC000450960039	GG	On-Demand	Anodyne	LIMK2	15	43
Cc1cc(-c2nc(C(=O)NC(C)(C)CF)co2)ccn1	ZINC000450960048	CF	On-Demand	Anodyne	IRAK4	22	45
Cc1cc(-c2nc(C(=O)Nc3c4c(nn3C(C)C)CCC4)co2)ccn1	ZINC000450960088	FH	On-Demand	Anodyne	IRAK4	20	40
Cc1cccc(NC(=O)c2ccc(C3CC3)nc2C)c1Br	ZINC000450960108	EJ	On-Demand	Anodyne	G2YM83_BOTF4	52	34
O=C([C@@H]1C[C@@H](F)CN1CCc1ccc(Cl)cc1)N1CCOCC1	ZINC000450960122	EE	On-Demand	Anodyne	AKR1C3	15	44
CCOC(=O)CC[C@]1(C)NC(=O)N(CC/C=C\c2ccccc2)C1=O	ZINC000450960133	EF	On-Demand	Anodyne	CACNA1B	40	35
CCOC(=O)CC[C@@]1(C)NC(=O)N(CC/C=C/c2ccccc2)C1=O	ZINC000450960134	EF	On-Demand	Anodyne	CACNA1B	40	35
CCOC(=O)CC[C@@]1(C)NC(=O)N(CC/C=C\c2ccccc2)C1=O	ZINC000450960135	EF	On-Demand	Anodyne	CACNA1B	40	35
CCOC(=O)CC[C@]1(C)NC(=O)N(CC/C=C/c2ccccc2)C1=O	ZINC000450960136	EF	On-Demand	Anodyne	CACNA1B	40	35
Cc1ccn2ncc(C(=O)Nc3c4c(nn3C(C)C)CCC4)c2c1	ZINC000450960137	DG	On-Demand	Anodyne	EPHB3	36	50
C[C@]1(O)CCOC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960145	EG	On-Demand	Anodyne	DRD2	28	42
C[C@]1(O)CCOC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960145	EG	On-Demand	Anodyne	DRD4	0	42
C[C@]1(O)CCOC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960145	EG	On-Demand	Anodyne	SLC18A3	0	41
C[C@]1(O)CCOC[C@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960145	EG	On-Demand	Anodyne	CYP2J2	47	33
C[C@]1(O)CCOC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960146	EG	On-Demand	Anodyne	DRD2	28	42
C[C@]1(O)CCOC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960146	EG	On-Demand	Anodyne	DRD4	0	42
C[C@]1(O)CCOC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960146	EG	On-Demand	Anodyne	SLC18A3	0	41
C[C@]1(O)CCOC[C@@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960146	EG	On-Demand	Anodyne	CYP2J2	47	33
C[C@]1(O)CCOC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960147	EG	On-Demand	Anodyne	DRD2	28	42
C[C@]1(O)CCOC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960147	EG	On-Demand	Anodyne	DRD4	0	42
C[C@]1(O)CCOC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960147	EG	On-Demand	Anodyne	SLC18A3	0	41
C[C@]1(O)CCOC[C@@H]1[C@@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960147	EG	On-Demand	Anodyne	CYP2J2	47	33
C[C@]1(O)CCOC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960148	EG	On-Demand	Anodyne	DRD2	28	42
C[C@]1(O)CCOC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960148	EG	On-Demand	Anodyne	DRD4	0	42
C[C@]1(O)CCOC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960148	EG	On-Demand	Anodyne	SLC18A3	0	41
C[C@]1(O)CCOC[C@H]1[C@H]1CCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450960148	EG	On-Demand	Anodyne	CYP2J2	47	33
CC(=O)c1ccc(CN2CC[C@H](c3nc(C)no3)C2)cc1	ZINC000450960154	CF	On-Demand	Anodyne	SMO	41	33
CC(=O)c1ccc(CN2CC[C@H](c3nc(C)no3)C2)cc1	ZINC000450960154	CF	On-Demand	Anodyne	ETHR	55	38
CC(=O)c1ccc(CN2CC[C@@H](c3nc(C)no3)C2)cc1	ZINC000450960155	CF	On-Demand	Anodyne	SMO	41	33
CC(=O)c1ccc(CN2CC[C@@H](c3nc(C)no3)C2)cc1	ZINC000450960155	CF	On-Demand	Anodyne	ETHR	55	38
Cc1cc(C)c(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)cc1Br	ZINC000450960158	GF	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C)c(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)cc1Br	ZINC000450960158	GF	On-Demand	Anodyne	L3MBTL3	48	43
Cc1cc(C)c(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)cc1Br	ZINC000450960159	GF	On-Demand	Anodyne	L3MBTL1	0	43
Cc1cc(C)c(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)cc1Br	ZINC000450960159	GF	On-Demand	Anodyne	L3MBTL3	48	43
OCCC[C@@H]1CCN(c2ncnc3n[nH]cc23)C1	ZINC000450960177	BC	On-Demand	Anodyne	SIRT3	42	32
OCCC[C@H]1CCN(c2ncnc3n[nH]cc23)C1	ZINC000450960178	BC	On-Demand	Anodyne	SIRT3	42	32
OCCC[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450960186	CG	On-Demand	Anodyne	HNMT	41	32
OCCC[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C1	ZINC000450960187	CG	On-Demand	Anodyne	HNMT	41	32
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960209	GD	On-Demand	Anodyne	FOLH1	33	40
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960209	GD	On-Demand	Anodyne	TRPV1	52	48
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960209	GD	On-Demand	Anodyne	MTNR1A	38	42
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960209	GD	On-Demand	Anodyne	MTNR1B	34	42
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960209	GD	On-Demand	Anodyne	NCE103	33	43
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960209	GD	On-Demand	Anodyne	MTCA1	16	43
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960209	GD	On-Demand	Anodyne	P96878_MYCTU	19	40
COC(=O)[C@@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960209	GD	On-Demand	Anodyne	CAN2	0	43
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960210	GD	On-Demand	Anodyne	FOLH1	33	40
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960210	GD	On-Demand	Anodyne	TRPV1	52	48
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960210	GD	On-Demand	Anodyne	MTNR1A	38	42
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960210	GD	On-Demand	Anodyne	MTNR1B	34	42
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960210	GD	On-Demand	Anodyne	NCE103	33	43
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960210	GD	On-Demand	Anodyne	MTCA1	16	43
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960210	GD	On-Demand	Anodyne	P96878_MYCTU	19	40
COC(=O)[C@H](NC(=O)Cc1ccc(O)c(OC)c1)c1ccc(OC)cc1OC	ZINC000450960210	GD	On-Demand	Anodyne	CAN2	0	43
C[C@@H]1CN(CCO)CCN1c1ccc(S(C)(=O)=O)cc1F	ZINC000450960211	DC	On-Demand	Anodyne	SLC6A9	0	41
C[C@H]1CN(CCO)CCN1c1ccc(S(C)(=O)=O)cc1F	ZINC000450960212	DC	On-Demand	Anodyne	SLC6A9	0	41
CCc1cc(N2CCN(CCO)C[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450960220	FE	On-Demand	Bother	KCNJ1	23	42
CCc1cc(N2CCN(CCO)C[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000450960221	FE	On-Demand	Bother	KCNJ1	23	42
O=S(=O)(c1ccc(N2CC[C@H](CCCO)C2)nc1)N1CCCCC1	ZINC000450960224	FD	On-Demand	Anodyne	GCK	19	41
O=S(=O)(c1ccc(N2CC[C@@H](CCCO)C2)nc1)N1CCCCC1	ZINC000450960225	FD	On-Demand	Anodyne	GCK	19	41
CCCCCNS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450960245	CG	On-Demand	Anodyne	ALOX15	47	41
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1C	ZINC000450960252	EF	On-Demand	Anodyne	PKM	37	41
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1C	ZINC000450960252	EF	On-Demand	Anodyne	NR1I2	44	37
COc1ccc(CCN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)cc1	ZINC000450960275	DH	On-Demand	Anodyne	HRH3	44	44
COc1ccc(CCN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)cc1	ZINC000450960275	DH	On-Demand	Anodyne	SIGMAR1	18	45
COc1ccc(CCN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)cc1	ZINC000450960276	DH	On-Demand	Anodyne	HRH3	44	44
COc1ccc(CCN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)cc1	ZINC000450960276	DH	On-Demand	Anodyne	SIGMAR1	18	45
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C3CC3)cc2)C1	ZINC000450960284	CF	On-Demand	Anodyne	AKR1C3	41	61
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C3CC3)cc2)C1	ZINC000450960284	CF	On-Demand	Anodyne	RAC1	0	46
C[C@H]1CCCN(S(=O)(=O)c2ccc(C3CC3)cc2)C1	ZINC000450960285	CF	On-Demand	Anodyne	AKR1C3	41	61
C[C@H]1CCCN(S(=O)(=O)c2ccc(C3CC3)cc2)C1	ZINC000450960285	CF	On-Demand	Anodyne	RAC1	0	46
COC(=O)C[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc2ccccc2c1	ZINC000450960296	GG	On-Demand	Anodyne	DGAT1	27	42
COC(=O)C[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc2ccccc2c1	ZINC000450960296	GG	On-Demand	Anodyne	UTS2	50	44
COC(=O)C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc2ccccc2c1	ZINC000450960299	GG	On-Demand	Anodyne	DGAT1	27	42
COC(=O)C[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1ccc2ccccc2c1	ZINC000450960299	GG	On-Demand	Anodyne	UTS2	50	44
Cc1nn(CC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1[N+](=O)[O-]	ZINC000450960306	EF	On-Demand	Bother	COLA	65	35
Cc1nn(CC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1[N+](=O)[O-]	ZINC000450960306	EF	On-Demand	Bother	AADAC	0	44
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450960308	EE	On-Demand	Anodyne	SLC6A1	25	44
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450960308	EE	On-Demand	Anodyne	HRH3	19	42
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450960308	EE	On-Demand	Anodyne	SSTR3	57	35
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450960308	EE	On-Demand	Anodyne	AKR1C3	23	50
CSc1cccc(C(=O)N(C)CC2(c3ccccc3)CC2)c1	ZINC000450960314	DI	On-Demand	Anodyne	KCNA3	19	43
CCOC(=O)c1cc(S(=O)(=O)N2c3ccccc3C[C@H]2C)cnc1C(F)F	ZINC000450960317	GG	On-Demand	Anodyne	TPP2	44	33
CCOC(=O)c1cc(S(=O)(=O)N2c3ccccc3C[C@H]2C)cnc1C(F)F	ZINC000450960317	GG	On-Demand	Anodyne	GLMU	0	41
CCOC(=O)c1cc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)cnc1C(F)F	ZINC000450960318	GG	On-Demand	Anodyne	TPP2	44	33
CCOC(=O)c1cc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)cnc1C(F)F	ZINC000450960318	GG	On-Demand	Anodyne	GLMU	0	41
CCOC(=O)c1ccc(CS(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450960336	GF	On-Demand	Anodyne	P2RY12	47	38
CCOC(=O)c1ccc(CS(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450960336	GF	On-Demand	Anodyne	F2RL3	19	41
CCOC(=O)c1ccc(CS(=O)(=O)N2CCN(c3ccccc3)CC2)cc1	ZINC000450960336	GF	On-Demand	Anodyne	NOD2	23	40
C/C=C\C[C@H](CO)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450960337	ED	On-Demand	Anodyne	F7	26	40
C/C=C\C[C@@H](CO)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450960338	ED	On-Demand	Anodyne	F7	26	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450960341	FE	On-Demand	Anodyne	RIR1_HHV11	77	36
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450960341	FE	On-Demand	Anodyne	CACNA1B	16	40
CC(C)CCCC(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450960355	CE	On-Demand	Anodyne	PREP	45	47
Cc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1C	ZINC000450960362	DH	On-Demand	Anodyne	PRTN3	50	32
CN1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450960368	DD	On-Demand	Mild	TRPV4	43	35
CN1CCN(CCC(C)(C)NC(=O)c2cccc3c2CCCC3)CC1	ZINC000450960369	EF	On-Demand	Anodyne	FABP4	47	38
CCc1cccc(C(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)n1	ZINC000450960377	EG	On-Demand	Anodyne	HPGDS	36	48
CCc1cccc(C(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)n1	ZINC000450960379	EG	On-Demand	Anodyne	HPGDS	36	48
CC[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450960401	CG	On-Demand	Anodyne	NR3C1	0	40
CC[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450960401	CG	On-Demand	Anodyne	CTSL	0	41
CC[C@@H](C)NS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450960403	CG	On-Demand	Anodyne	NR3C1	0	40
CC[C@@H](C)NS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450960403	CG	On-Demand	Anodyne	CTSL	0	41
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(Cl)c1	ZINC000450960407	GG	On-Demand	Anodyne	PRTN3	53	33
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(Cl)c1	ZINC000450960407	GG	On-Demand	Anodyne	CCR2	0	42
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(Cl)c1	ZINC000450960407	GG	On-Demand	Anodyne	LUXN	0	44
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(Cl)c1	ZINC000450960407	GG	On-Demand	Anodyne	ADIPOR1	0	40
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(Cl)c1	ZINC000450960407	GG	On-Demand	Anodyne	ADIPOR2	0	40
Cc1cccc(Cl)c1C(=O)NCC1(CO)CCCC1	ZINC000450960415	CF	On-Demand	Anodyne	P2RX7	0	47
Cc1cccc(Cl)c1C(=O)NCC1(CO)CCCC1	ZINC000450960415	CF	On-Demand	Anodyne	SLC6A9	24	41
Cc1cccc(Cl)c1C(=O)NCC1(CO)CCCC1	ZINC000450960415	CF	On-Demand	Anodyne	ACAT	0	42
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960423	DI	On-Demand	Anodyne	PRCP	25	57
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960423	DI	On-Demand	Anodyne	COLA	118	39
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960423	DI	On-Demand	Anodyne	CPT1A	105	39
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960424	DI	On-Demand	Anodyne	PRCP	25	57
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960424	DI	On-Demand	Anodyne	COLA	118	39
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960424	DI	On-Demand	Anodyne	CPT1A	105	39
Cc1cc(N2CC[C@@H](CCCO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450960466	DG	On-Demand	Bother	GYRB	15	49
Cc1cc(N2CC[C@H](CCCO)C2)c2cc([N+](=O)[O-])ccc2n1	ZINC000450960467	DG	On-Demand	Bother	GYRB	15	49
CO[C@H]1C[C@@H](CN(C)CCCC(=O)c2ccc(Br)cc2)N(C)C1	ZINC000450960478	GG	On-Demand	Anodyne	LSS	25	42
CC(C)CC(CC(C)C)C(=O)Nc1cnns1	ZINC000450960498	CG	On-Demand	Anodyne	AHK3	0	44
C[C@H](O)CN(C)C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450960517	EE	On-Demand	Anodyne	FABP4	45	34
C[C@H](O)CN(C)C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450960517	EE	On-Demand	Anodyne	L3MBTL3	51	38
C[C@@H](O)CN(C)C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450960518	EE	On-Demand	Anodyne	FABP4	45	34
C[C@@H](O)CN(C)C1CCN(C(=O)c2cccc3c2CCCC3)CC1	ZINC000450960518	EE	On-Demand	Anodyne	L3MBTL3	51	38
CCOc1ccc(S(=O)(=O)CCC(C)(F)F)cc1	ZINC000450960527	CF	On-Demand	Anodyne	CA7	18	53
COc1cc(Cn2c(C)nn(C(C)C)c2=O)ccc1Cl	ZINC000450960531	CF	On-Demand	Anodyne	PROKR1	62	38
Cc1cc(CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c2ccccc2n1	ZINC000450960554	EI	On-Demand	Anodyne	ADAM17	75	39
Cc1cc(CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c2ccccc2n1	ZINC000450960555	EI	On-Demand	Anodyne	ADAM17	75	39
Cc1cc(CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c2ccccc2n1	ZINC000450960556	EI	On-Demand	Anodyne	ADAM17	75	39
Cc1cc(CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c2ccccc2n1	ZINC000450960557	EI	On-Demand	Anodyne	ADAM17	75	39
O=S(=O)(CC1CC(F)(F)C1)N1CCc2ccccc2C1	ZINC000450960589	DE	On-Demand	Anodyne	AKR1C3	40	41
Cc1csc(S(=O)(=O)NC2CCCCC2)c1	ZINC000450960615	CF	On-Demand	Anodyne	BRD4	28	44
CCCc1cc(C(=O)N[C@H](C(=O)OC)c2ccc(OC)c(Cl)c2)no1	ZINC000450960625	FF	On-Demand	Anodyne	ENR	0	42
CCCc1cc(C(=O)N[C@@H](C(=O)OC)c2ccc(OC)c(Cl)c2)no1	ZINC000450960626	FF	On-Demand	Anodyne	ENR	0	42
CCCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450960633	ED	On-Demand	Anodyne	MMP13	35	44
CCCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450960633	ED	On-Demand	Anodyne	PLA2G4B	69	37
CCCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450960633	ED	On-Demand	Anodyne	ALOX15	46	38
Cc1cnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450960638	GE	On-Demand	Anodyne	CA4	40	38
Cc1cnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450960638	GE	On-Demand	Anodyne	MTNN	78	39
CN(CC1(c2ccccc2)CC1)C(=O)c1cn(CCc2ccccc2)nn1	ZINC000450960639	FG	On-Demand	Anodyne	THYX_PBCV1	0	40
COC(=O)[C@@H](NC(=O)c1cnn2c1CCC2)c1ccc(OC)c(Cl)c1	ZINC000450960640	FE	On-Demand	Anodyne	MAPK1	20	40
COC(=O)[C@H](NC(=O)c1cnn2c1CCC2)c1ccc(OC)c(Cl)c1	ZINC000450960641	FE	On-Demand	Anodyne	MAPK1	20	40
CC[C@H](O)CC(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450960661	EF	On-Demand	Anodyne	UTS2	34	43
CC[C@@H](O)CC(=O)N[C@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450960662	EF	On-Demand	Anodyne	UTS2	34	43
CC[C@H](O)CC(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450960663	EF	On-Demand	Anodyne	UTS2	34	43
CC[C@@H](O)CC(=O)N[C@@H](CC(=O)OC)c1ccc2ccccc2c1	ZINC000450960664	EF	On-Demand	Anodyne	UTS2	34	43
COc1cc(CC(=O)NC(C)(C)c2cccc(Cl)c2F)ccc1O	ZINC000450960672	FH	On-Demand	Anodyne	TRPV1	42	49
COc1cc(CC(=O)NC(C)(C)c2cccc(Cl)c2F)ccc1O	ZINC000450960672	FH	On-Demand	Anodyne	NCE103	36	47
COc1cc(CC(=O)NC(C)(C)c2cccc(Cl)c2F)ccc1O	ZINC000450960672	FH	On-Demand	Anodyne	CAN2	0	47
O=C(Cn1nnc(-c2ccco2)n1)NC(=O)NC1CC1	ZINC000450960682	CB	On-Demand	Anodyne	ADORA3	33	40
O=C(Cn1nnc(-c2ccco2)n1)NC(=O)NC1CC1	ZINC000450960682	CB	On-Demand	Anodyne	SCARB1	50	40
CCc1cccc(C(=O)N[C@@H](C)c2cncs2)n1	ZINC000450960688	CF	On-Demand	Anodyne	PDE5A	27	40
CCOc1nc2ccc(C(=O)N3CCC(N(C)C[C@@H](C)O)CC3)cc2[nH]1	ZINC000450960713	FD	On-Demand	Anodyne	AKR1C3	0	42
CCOc1nc2ccc(C(=O)N3CCC(N(C)C[C@@H](C)O)CC3)cc2[nH]1	ZINC000450960713	FD	On-Demand	Anodyne	L3MBTL3	45	34
CCOc1nc2ccc(C(=O)N3CCC(N(C)C[C@H](C)O)CC3)cc2[nH]1	ZINC000450960714	FD	On-Demand	Anodyne	AKR1C3	0	42
CCOc1nc2ccc(C(=O)N3CCC(N(C)C[C@H](C)O)CC3)cc2[nH]1	ZINC000450960714	FD	On-Demand	Anodyne	L3MBTL3	45	34
O=C(CC1CC(F)(F)C1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960748	FJ	On-Demand	Anodyne	PRCP	37	58
O=C(CC1CC(F)(F)C1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960748	FJ	On-Demand	Anodyne	CPT1A	125	44
O=C(CC1CC(F)(F)C1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960748	FJ	On-Demand	Anodyne	PREP	62	38
O=C(CC1CC(F)(F)C1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960749	FJ	On-Demand	Anodyne	PRCP	37	58
O=C(CC1CC(F)(F)C1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960749	FJ	On-Demand	Anodyne	CPT1A	125	44
O=C(CC1CC(F)(F)C1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450960749	FJ	On-Demand	Anodyne	PREP	62	38
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000450960750	EG	On-Demand	Bother	LTA4H	15	47
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000450960751	EG	On-Demand	Bother	LTA4H	15	47
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000450960752	EG	On-Demand	Bother	LTA4H	15	47
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000450960753	EG	On-Demand	Bother	LTA4H	15	47
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000450960756	EG	On-Demand	Bother	OPRM1	15	42
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000450960756	EG	On-Demand	Bother	CACNA1D	46	34
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000450960757	EG	On-Demand	Bother	OPRM1	15	42
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000450960757	EG	On-Demand	Bother	CACNA1D	46	34
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000450960758	EG	On-Demand	Bother	OPRM1	15	42
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000450960758	EG	On-Demand	Bother	CACNA1D	46	34
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000450960759	EG	On-Demand	Bother	OPRM1	15	42
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000450960759	EG	On-Demand	Bother	CACNA1D	46	34
CCOC(=O)C1(CNC(=O)c2cccnc2-n2cc(Br)cn2)CC1	ZINC000450960762	GE	On-Demand	Anodyne	HCN1	70	36
CCOC(=O)C1(CNC(=O)c2cccnc2-n2cc(Br)cn2)CC1	ZINC000450960762	GE	On-Demand	Anodyne	HCN4	53	36
C[C@@H]1C[C@]1(C#N)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450960773	CF	On-Demand	Mild	SLC6A2	0	43
C[C@@H]1C[C@]1(C#N)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450960773	CF	On-Demand	Mild	KCNA3	31	43
C[C@@H]1C[C@@]1(C#N)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450960774	CF	On-Demand	Mild	SLC6A2	0	43
C[C@@H]1C[C@@]1(C#N)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450960774	CF	On-Demand	Mild	KCNA3	31	43
C[C@H]1C[C@@]1(C#N)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450960775	CF	On-Demand	Mild	SLC6A2	0	43
C[C@H]1C[C@@]1(C#N)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450960775	CF	On-Demand	Mild	KCNA3	31	43
C[C@H]1C[C@]1(C#N)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450960776	CF	On-Demand	Mild	SLC6A2	0	43
C[C@H]1C[C@]1(C#N)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450960776	CF	On-Demand	Mild	KCNA3	31	43
COc1ccc(-c2nc(C3CCOCC3)c(C)s2)cc1OC	ZINC000450960777	DI	On-Demand	Anodyne	GAK	36	44
COc1ccc2nc(N3CC[C@@H](CCCO)C3)c(C)nc2c1	ZINC000450960794	DF	On-Demand	Anodyne	PDE3B	59	37
COc1ccc2nc(N3CC[C@H](CCCO)C3)c(C)nc2c1	ZINC000450960795	DF	On-Demand	Anodyne	PDE3B	59	37
COCCN1C(=O)N[C@@H]2CN(Cc3ccc(C(=O)OC)c(Cl)c3)CC[C@@H]21	ZINC000450960798	GD	On-Demand	Anodyne	DRD3	0	40
COCCN1C(=O)N[C@@H]2CN(Cc3ccc(C(=O)OC)c(Cl)c3)CC[C@@H]21	ZINC000450960798	GD	On-Demand	Anodyne	HTR4	66	36
COCCN1C(=O)N[C@@H]2CN(Cc3ccc(C(=O)OC)c(Cl)c3)CC[C@@H]21	ZINC000450960798	GD	On-Demand	Anodyne	MCHR1	20	40
CCCOc1cccc(Cn2cnc(C(C)(C)C)cc2=O)c1	ZINC000450960831	DG	On-Demand	Anodyne	SQLE	52	34
Cc1csc(NC2CCN(C(=O)[C@H](O)C3CCC3)CC2)n1	ZINC000450960851	DE	On-Demand	Anodyne	TRPC6	47	35
Cc1csc(NC2CCN(C(=O)[C@@H](O)C3CCC3)CC2)n1	ZINC000450960852	DE	On-Demand	Anodyne	TRPC6	47	35
CCOC(=O)[C@@H](NC(=O)c1cncc(Cl)c1)c1cccc(C)c1C	ZINC000450960853	EG	On-Demand	Anodyne	SCN10A	45	39
CCOC(=O)[C@H](NC(=O)c1cncc(Cl)c1)c1cccc(C)c1C	ZINC000450960854	EG	On-Demand	Anodyne	SCN10A	45	39
N#CCc1ccc(S(=O)(=O)NC2CCCCC2)c(Cl)c1	ZINC000450960859	DG	On-Demand	Mild	BRD4	18	40
C[C@H]1Cc2ccccc2N1S(=O)(=O)CCOCc1ccccc1	ZINC000450960860	EF	On-Demand	Anodyne	GLMU	0	40
C[C@@H]1Cc2ccccc2N1S(=O)(=O)CCOCc1ccccc1	ZINC000450960861	EF	On-Demand	Anodyne	GLMU	0	40
CCOC(=O)c1cc(S(=O)(=O)Nc2ccccc2OC)cnc1C(F)F	ZINC000450960863	GG	On-Demand	Anodyne	PRTN3	47	36
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)c(F)c1	ZINC000450960866	GE	On-Demand	Anodyne	SCN9A	0	53
C[C@@H](c1ccccc1)[C@H](O)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccnn1C	ZINC000450960868	ED	On-Demand	Anodyne	HSD17B2	74	36
C[C@H](c1ccccc1)[C@@H](O)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccnn1C	ZINC000450960869	ED	On-Demand	Anodyne	HSD17B2	74	36
C[C@H](c1ccccc1)[C@H](O)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccnn1C	ZINC000450960870	ED	On-Demand	Anodyne	HSD17B2	74	36
C[C@@H](c1ccccc1)[C@@H](O)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccnn1C	ZINC000450960871	ED	On-Demand	Anodyne	HSD17B2	74	36
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)ccc21	ZINC000450960876	GE	On-Demand	Anodyne	HTR1A	61	43
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)ccc21	ZINC000450960876	GE	On-Demand	Anodyne	DRD2	45	43
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)ccc21	ZINC000450960876	GE	On-Demand	Anodyne	ADRA1D	40	39
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)ccc21	ZINC000450960876	GE	On-Demand	Anodyne	DRD3	51	40
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)ccc21	ZINC000450960876	GE	On-Demand	Anodyne	PDGFRB	23	42
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)ccc21	ZINC000450960876	GE	On-Demand	Anodyne	PLK1	68	34
COc1ccccc1-n1cnc2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)ccc21	ZINC000450960876	GE	On-Demand	Anodyne	HPGD	63	73
CCOC(=O)c1cc(C(=O)N(C)CC2(c3ccccc3)CC2)on1	ZINC000450960877	EF	On-Demand	Anodyne	KCNA3	25	44
CC(C)(CF)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450960883	BD	On-Demand	Anodyne	CAN2	0	52
O=C1NCCc2cc(OCc3ccn(CC(F)(F)F)n3)ccc21	ZINC000450960894	EE	On-Demand	Anodyne	CSNK1G2	44	37
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	ZINC000450960895	GF	On-Demand	Anodyne	PRTN3	55	34
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	ZINC000450960895	GF	On-Demand	Anodyne	ALPL	17	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	ZINC000450960895	GF	On-Demand	Anodyne	MTNN	81	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	ZINC000450960895	GF	On-Demand	Anodyne	LIMK2	39	50
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	ZINC000450960895	GF	On-Demand	Anodyne	UQCRB	0	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	ZINC000450960895	GF	On-Demand	Anodyne	MOGAT2	45	33
CC(F)(F)CCOc1ccc2c(c1)CCNC2=O	ZINC000450960902	CE	On-Demand	Anodyne	CSNK1G2	44	32
Cc1sc(-c2ccc(NC(=O)c3ccco3)cc2)nc1C1CCOCC1	ZINC000450960903	FJ	On-Demand	Anodyne	MTOR	53	35
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	MMP13	60	42
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	ADAM17	62	48
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	MMP3	58	42
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	EPHX2	22	48
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	TGM2	45	34
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	MMP7	62	38
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	MMP1	64	42
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	AKR1C3	24	47
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	RAC1	0	46
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	NAMPT	16	46
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	LUXN	0	46
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	ADIPOR1	0	44
C[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960941	FD	On-Demand	Anodyne	ADIPOR2	0	44
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	MMP13	60	42
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	ADAM17	62	48
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	MMP3	58	42
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	EPHX2	22	48
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	TGM2	45	34
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	MMP7	62	38
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	MMP1	64	42
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	AKR1C3	24	47
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	RAC1	0	46
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	NAMPT	16	46
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	LUXN	0	46
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	ADIPOR1	0	44
C[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450960942	FD	On-Demand	Anodyne	ADIPOR2	0	44
CCC(CC)Oc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1	ZINC000450960958	FG	On-Demand	Anodyne	HRH3	25	47
CCC(CC)Oc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1	ZINC000450960958	FG	On-Demand	Anodyne	PREP	32	41
CCC(CC)Oc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1	ZINC000450960958	FG	On-Demand	Anodyne	L3MBTL1	0	41
CCC(CC)Oc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1	ZINC000450960958	FG	On-Demand	Anodyne	L3MBTL3	78	41
CCC(CC)Oc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1	ZINC000450960958	FG	On-Demand	Anodyne	MBTD1	0	40
CS(=O)(=O)c1ccc(N2CC[C@@H](CCCO)C2)c(F)c1	ZINC000450960998	DD	On-Demand	Anodyne	SLC6A9	32	50
CS(=O)(=O)c1ccc(N2CC[C@H](CCCO)C2)c(F)c1	ZINC000450961000	DD	On-Demand	Anodyne	SLC6A9	32	50
COc1cc2c(N3CC[C@@H](CCCO)C3)ccnc2cc1F	ZINC000450961005	DF	On-Demand	Anodyne	PDE3A	49	38
COc1cc2c(N3CC[C@@H](CCCO)C3)ccnc2cc1F	ZINC000450961005	DF	On-Demand	Anodyne	PDE3B	73	38
COc1cc2c(N3CC[C@@H](CCCO)C3)ccnc2cc1F	ZINC000450961005	DF	On-Demand	Anodyne	MET	40	32
COc1cc2c(N3CC[C@H](CCCO)C3)ccnc2cc1F	ZINC000450961006	DF	On-Demand	Anodyne	PDE3A	49	38
COc1cc2c(N3CC[C@H](CCCO)C3)ccnc2cc1F	ZINC000450961006	DF	On-Demand	Anodyne	PDE3B	73	38
COc1cc2c(N3CC[C@H](CCCO)C3)ccnc2cc1F	ZINC000450961006	DF	On-Demand	Anodyne	MET	40	32
Cc1cc(C(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)ncc1C(N)=O	ZINC000450961041	FD	On-Demand	Anodyne	HPGDS	37	40
Cc1cc(C(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)ncc1C(N)=O	ZINC000450961043	FD	On-Demand	Anodyne	HPGDS	37	40
Cc1cc(C(=O)N[C@@]2(C#N)CCc3ccccc3C2)nn1C(C)C	ZINC000450961048	DF	On-Demand	Mild	TSPO	0	40
Cc1cc(C(=O)N[C@]2(C#N)CCc3ccccc3C2)nn1C(C)C	ZINC000450961050	DF	On-Demand	Mild	TSPO	0	40
CN(C)c1nc(N2CC[C@@H](CCCO)C2)nc2ccccc12	ZINC000450961058	DE	On-Demand	Anodyne	ADRA2A	15	41
CN(C)c1nc(N2CC[C@H](CCCO)C2)nc2ccccc12	ZINC000450961059	DE	On-Demand	Anodyne	ADRA2A	15	41
CC(=O)c1ccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)cc1	ZINC000450961089	DG	On-Demand	Anodyne	ETHR	61	40
CC(=O)c1ccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)cc1	ZINC000450961090	DG	On-Demand	Anodyne	ETHR	61	40
Cc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1Br	ZINC000450961093	EH	On-Demand	Anodyne	PRNP	31	40
Cc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1Br	ZINC000450961093	EH	On-Demand	Anodyne	HDAC1	29	48
Cc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1Br	ZINC000450961093	EH	On-Demand	Anodyne	MAPKAPK3	0	42
Cc1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1Br	ZINC000450961093	EH	On-Demand	Anodyne	HPGDS	18	41
CCCOc1cccc(Cn2cc(Br)cc(F)c2=O)c1	ZINC000450961102	EH	On-Demand	Anodyne	UPP1	54	42
O=C(c1c(Cl)cc(Cl)cc1Cl)N1CCn2ncnc2C1	ZINC000450961106	EF	On-Demand	Anodyne	P2RX7	0	56
Cc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c(Cl)c1Cl	ZINC000450961114	FG	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)c(Cl)c1Cl	ZINC000450961114	FG	On-Demand	Anodyne	L3MBTL3	52	41
COC(=O)[C@@H](NC(=O)CC1CC(F)(F)C1)c1ccc(OC)c(O)c1	ZINC000450961115	EE	On-Demand	Anodyne	FOLH1	40	39
COC(=O)[C@H](NC(=O)CC1CC(F)(F)C1)c1ccc(OC)c(O)c1	ZINC000450961116	EE	On-Demand	Anodyne	FOLH1	40	39
CCOC(=O)c1cc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)[nH]c1C	ZINC000450961118	FD	On-Demand	Anodyne	AKR1C3	17	40
CCOC(=O)c1cc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)[nH]c1C	ZINC000450961119	FD	On-Demand	Anodyne	AKR1C3	17	40
COc1ccc(OCCN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)cc1	ZINC000450961122	EG	On-Demand	Anodyne	LTA4H	27	42
COc1ccc(OCCN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)cc1	ZINC000450961122	EG	On-Demand	Anodyne	PSMB2	44	36
COc1ccc(OCCN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)cc1	ZINC000450961124	EG	On-Demand	Anodyne	LTA4H	27	42
COc1ccc(OCCN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)cc1	ZINC000450961124	EG	On-Demand	Anodyne	PSMB2	44	36
COc1ccc(OCCN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)cc1	ZINC000450961125	EG	On-Demand	Anodyne	LTA4H	27	42
COc1ccc(OCCN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)cc1	ZINC000450961125	EG	On-Demand	Anodyne	PSMB2	44	36
COc1ccc(OCCN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)cc1	ZINC000450961127	EG	On-Demand	Anodyne	LTA4H	27	42
COc1ccc(OCCN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)cc1	ZINC000450961127	EG	On-Demand	Anodyne	PSMB2	44	36
Cc1nc(C2CC2)ccc1C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450961156	DI	On-Demand	Anodyne	KCNA3	39	45
CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(C)c2)cnc1C(F)F	ZINC000450961162	FG	On-Demand	Anodyne	GPR119	0	44
CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(C)c2)cnc1C(F)F	ZINC000450961162	FG	On-Demand	Anodyne	LIMK2	15	40
CC(C)(CC#N)CS(=O)(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450961173	EE	On-Demand	Mild	SIGMAR1	43	49
CCOC(=O)c1cc(S(=O)(=O)N2CCN(CC)CC2)cnc1C(F)F	ZINC000450961176	GD	On-Demand	Anodyne	PDE5A	24	45
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	PPARA	18	42
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	MME	62	36
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	ANPEP	45	33
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	CTSB	45	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	PAPA1_CARPA	43	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	CYSP_TRYCR	41	32
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	CAPNS1	58	35
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	HLA-DRB1	48	33
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	SOAT1	22	42
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	PDE6A	41	31
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	CAPN1	80	38
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	CAPN2	82	37
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	POL	0	43
COC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961189	GF	On-Demand	Anodyne	BLA1_STEMA	41	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	PPARA	18	42
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	MME	62	36
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	ANPEP	45	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	CTSB	45	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	PAPA1_CARPA	43	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	CYSP_TRYCR	41	32
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	CAPNS1	58	35
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	HLA-DRB1	48	33
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	SOAT1	22	42
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	PDE6A	41	31
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	CAPN1	80	38
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	CAPN2	82	37
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	POL	0	43
COC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961190	GF	On-Demand	Anodyne	BLA1_STEMA	41	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	PPARA	18	42
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	MME	62	36
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	ANPEP	45	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	CTSB	45	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	PAPA1_CARPA	43	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	CYSP_TRYCR	41	32
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	CAPNS1	58	35
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	HLA-DRB1	48	33
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	SOAT1	22	42
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	PDE6A	41	31
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	CAPN1	80	38
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	CAPN2	82	37
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	POL	0	43
COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961191	GF	On-Demand	Anodyne	BLA1_STEMA	41	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	PPARA	18	42
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	MME	62	36
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	ANPEP	45	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	CTSB	45	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	PAPA1_CARPA	43	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	CYSP_TRYCR	41	32
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	CAPNS1	58	35
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	HLA-DRB1	48	33
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	SOAT1	22	42
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	PDE6A	41	31
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	CAPN1	80	38
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	CAPN2	82	37
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	POL	0	43
COC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(Cl)c1	ZINC000450961192	GF	On-Demand	Anodyne	BLA1_STEMA	41	33
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCN(C[C@@H](C)O)CC3)cc2)c1	ZINC000450961204	GE	On-Demand	Anodyne	CHRM3	17	46
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	HTR1A	98	50
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	ADRA2A	16	40
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	DRD2	71	46
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	DRD4	39	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	ADRA1D	100	51
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	HTR2A	40	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	HTR2C	15	43
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	ADRA1A	89	49
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	ADRA1B	71	42
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	DRD3	74	46
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	HTR7	65	50
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	HSD11B1	15	47
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	HTR6	22	49
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1	ZINC000450961205	GD	On-Demand	Anodyne	TACR3	19	40
O=C(COc1ccc(S(=O)(=O)NCc2ccco2)cc1)NC1CC1	ZINC000450961206	FD	On-Demand	Anodyne	LUXN	0	43
O=C(COc1ccc(S(=O)(=O)NCc2ccco2)cc1)NC1CC1	ZINC000450961206	FD	On-Demand	Anodyne	ADIPOR1	0	42
O=C(COc1ccc(S(=O)(=O)NCc2ccco2)cc1)NC1CC1	ZINC000450961206	FD	On-Demand	Anodyne	ADIPOR2	0	42
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	MMP13	64	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	ADAM17	66	42
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	MMP3	60	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	TGM2	42	32
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	MMP7	66	39
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	MMP1	67	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	LUXN	0	45
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	DDIT3	0	45
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	ADIPOR1	0	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961211	FD	On-Demand	Anodyne	ADIPOR2	0	43
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	MMP13	64	43
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	ADAM17	66	42
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	MMP3	60	43
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	TGM2	42	32
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	MMP7	66	39
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	MMP1	67	43
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	LUXN	0	45
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	DDIT3	0	45
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	ADIPOR1	0	43
C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@@H](C)O1	ZINC000450961212	FD	On-Demand	Anodyne	ADIPOR2	0	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	MMP13	64	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	ADAM17	66	42
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	MMP3	60	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	TGM2	42	32
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	MMP7	66	39
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	MMP1	67	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	LUXN	0	45
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	DDIT3	0	45
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	ADIPOR1	0	43
C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C[C@H](C)O1	ZINC000450961213	FD	On-Demand	Anodyne	ADIPOR2	0	43
Cc1csc(NC2CCN(C(=O)c3ccc(C)nc3C(C)C)CC2)n1	ZINC000450961216	FH	On-Demand	Anodyne	TRPC6	51	38
CC(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961220	GG	On-Demand	Anodyne	KCNA5	0	40
CC(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961220	GG	On-Demand	Anodyne	PRTN3	64	40
CC(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961220	GG	On-Demand	Anodyne	ADAMTS4	52	35
CC(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961220	GG	On-Demand	Anodyne	LUXN	0	50
CC(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961220	GG	On-Demand	Anodyne	ADIPOR1	0	45
CC(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961220	GG	On-Demand	Anodyne	ADIPOR2	0	45
CC(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450961227	GG	On-Demand	Anodyne	ADRB2	30	42
CC(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450961227	GG	On-Demand	Anodyne	ADRB1	24	43
CC(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450961227	GG	On-Demand	Anodyne	ADRB3	26	43
CC(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450961227	GG	On-Demand	Anodyne	ADAMTS4	48	32
CC(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450961227	GG	On-Demand	Anodyne	LUXN	0	47
CC(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450961227	GG	On-Demand	Anodyne	ADIPOR1	0	40
CC(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450961227	GG	On-Demand	Anodyne	ADIPOR2	0	40
CC[C@@H](C)NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450961231	CC	On-Demand	Anodyne	ADAMTS4	41	34
CC[C@H](C)NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450961232	CC	On-Demand	Anodyne	ADAMTS4	41	34
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@@H]2CC)cc1	ZINC000450961238	EF	On-Demand	Anodyne	FKBP1A	29	42
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@H]2CC)cc1	ZINC000450961239	EF	On-Demand	Anodyne	FKBP1A	29	42
O=C(CCCC(=O)C1CC1)Nc1cnns1	ZINC000450961258	BD	On-Demand	Anodyne	AHK3	0	40
CC(=O)c1cccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)c1	ZINC000450961267	DG	On-Demand	Anodyne	SMO	40	33
CC(=O)c1cccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)c1	ZINC000450961267	DG	On-Demand	Anodyne	ETHR	57	37
CC(=O)c1cccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)c1	ZINC000450961268	DG	On-Demand	Anodyne	SMO	40	33
CC(=O)c1cccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)c1	ZINC000450961268	DG	On-Demand	Anodyne	ETHR	57	37
COC(=O)c1nc(N2CC[C@H](CCCO)C2)sc1C	ZINC000450961269	CD	On-Demand	Anodyne	GYRB	0	40
COC(=O)c1nc(N2CC[C@H](CCCO)C2)sc1C	ZINC000450961269	CD	On-Demand	Anodyne	PARE	43	33
COC(=O)c1nc(N2CC[C@@H](CCCO)C2)sc1C	ZINC000450961270	CD	On-Demand	Anodyne	GYRB	0	40
COC(=O)c1nc(N2CC[C@@H](CCCO)C2)sc1C	ZINC000450961270	CD	On-Demand	Anodyne	PARE	43	33
COc1ccc(Nc2cc(N3CC[C@H](CCCO)C3)ncn2)c(OC)c1	ZINC000450961275	FF	On-Demand	Anodyne	PDE3A	45	37
COc1ccc(Nc2cc(N3CC[C@H](CCCO)C3)ncn2)c(OC)c1	ZINC000450961275	FF	On-Demand	Anodyne	PDE3B	66	37
COc1ccc(Nc2cc(N3CC[C@@H](CCCO)C3)ncn2)c(OC)c1	ZINC000450961276	FF	On-Demand	Anodyne	PDE3A	45	37
COc1ccc(Nc2cc(N3CC[C@@H](CCCO)C3)ncn2)c(OC)c1	ZINC000450961276	FF	On-Demand	Anodyne	PDE3B	66	37
CC[C@H](CC(C)C)C(=O)Nc1cnns1	ZINC000450961292	BF	On-Demand	Anodyne	AHK3	0	41
CC[C@@H](CC(C)C)C(=O)Nc1cnns1	ZINC000450961293	BF	On-Demand	Anodyne	AHK3	0	41
OCCC[C@H]1CCN(c2nc3ccccc3nc2N2CCCCC2)C1	ZINC000450961294	EG	On-Demand	Anodyne	PDE1B	0	44
OCCC[C@@H]1CCN(c2nc3ccccc3nc2N2CCCCC2)C1	ZINC000450961295	EG	On-Demand	Anodyne	PDE1B	0	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)c2cncs2)cc1	ZINC000450961315	GG	On-Demand	Anodyne	MMP2	19	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)c2cncs2)cc1	ZINC000450961315	GG	On-Demand	Anodyne	CAPN1	19	59
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)c2cncs2)cc1	ZINC000450961315	GG	On-Demand	Anodyne	MMP9	16	40
CCOc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450961318	CG	On-Demand	Anodyne	THRB	31	44
CCOc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450961318	CG	On-Demand	Anodyne	PLA2G4B	44	33
OCCC[C@H]1CCN(c2ccnc(N3CCCCC3)n2)C1	ZINC000450961325	CE	On-Demand	Anodyne	DKK1	0	40
OCCC[C@@H]1CCN(c2ccnc(N3CCCCC3)n2)C1	ZINC000450961326	CE	On-Demand	Anodyne	DKK1	0	40
Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)n1cc([N+](=O)[O-])c(C)n1	ZINC000450961350	FE	On-Demand	Bother	COLA	49	30
Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)n1cc([N+](=O)[O-])c(C)n1	ZINC000450961355	FE	On-Demand	Bother	COLA	49	30
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450961360	FG	On-Demand	Mild	CTSS	20	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450961361	FG	On-Demand	Mild	CTSS	20	42
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450961363	FG	On-Demand	Mild	CTSS	20	42
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450961365	FG	On-Demand	Mild	CTSS	20	42
Cc1ccn2ncc(C(=O)N3CCC(N(C)C[C@H](C)O)CC3)c2c1	ZINC000450961367	ED	On-Demand	Anodyne	EPHB3	24	41
Cc1ccn2ncc(C(=O)N3CCC(N(C)C[C@@H](C)O)CC3)c2c1	ZINC000450961370	ED	On-Demand	Anodyne	EPHB3	24	41
Cc1ccc(C(=O)N2CC(O)(C3CC3)C2)c2c1CCC2	ZINC000450961376	CE	On-Demand	Anodyne	L3MBTL3	41	34
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C[C@@H](O)CC	ZINC000450961383	EE	On-Demand	Anodyne	ACE2	41	34
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C[C@@H](O)CC	ZINC000450961384	EE	On-Demand	Anodyne	ACE2	41	34
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C[C@H](O)CC	ZINC000450961385	EE	On-Demand	Anodyne	ACE2	41	34
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C[C@H](O)CC	ZINC000450961386	EE	On-Demand	Anodyne	ACE2	41	34
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(C3CC3)C2)cc1	ZINC000450961399	GD	On-Demand	Anodyne	F2	23	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(C3CC3)C2)cc1	ZINC000450961399	GD	On-Demand	Anodyne	MMP13	21	45
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(C3CC3)C2)cc1	ZINC000450961399	GD	On-Demand	Anodyne	TRY2_BOVIN	72	35
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(C3CC3)C2)cc1	ZINC000450961399	GD	On-Demand	Anodyne	CAPNS1	19	44
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(C3CC3)C2)cc1	ZINC000450961399	GD	On-Demand	Anodyne	MMP2	28	45
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(C3CC3)C2)cc1	ZINC000450961399	GD	On-Demand	Anodyne	MMP3	15	45
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CC(O)(C3CC3)C2)cc1	ZINC000450961399	GD	On-Demand	Anodyne	ST14	42	41
O=C(c1c(Cl)cc(F)cc1Br)N1CCn2ncnc2C1	ZINC000450961420	FE	On-Demand	Anodyne	P2RX7	26	47
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961427	EJ	On-Demand	Anodyne	PRCP	27	56
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961427	EJ	On-Demand	Anodyne	COLA	128	45
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961427	EJ	On-Demand	Anodyne	CPT1A	120	45
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961427	EJ	On-Demand	Anodyne	CPT2	42	35
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961427	EJ	On-Demand	Anodyne	PREP	44	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961428	EJ	On-Demand	Anodyne	PRCP	27	56
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961428	EJ	On-Demand	Anodyne	COLA	128	45
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961428	EJ	On-Demand	Anodyne	CPT1A	120	45
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961428	EJ	On-Demand	Anodyne	CPT2	42	35
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961428	EJ	On-Demand	Anodyne	PREP	44	34
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961429	EJ	On-Demand	Anodyne	PRCP	27	56
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961429	EJ	On-Demand	Anodyne	COLA	128	45
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961429	EJ	On-Demand	Anodyne	CPT1A	120	45
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961429	EJ	On-Demand	Anodyne	CPT2	42	35
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961429	EJ	On-Demand	Anodyne	PREP	44	34
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961430	EJ	On-Demand	Anodyne	PRCP	27	56
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961430	EJ	On-Demand	Anodyne	COLA	128	45
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961430	EJ	On-Demand	Anodyne	CPT1A	120	45
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961430	EJ	On-Demand	Anodyne	CPT2	42	35
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961430	EJ	On-Demand	Anodyne	PREP	44	34
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961431	FJ	On-Demand	Anodyne	PRCP	29	56
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961431	FJ	On-Demand	Anodyne	CPT1A	111	39
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961432	FJ	On-Demand	Anodyne	PRCP	29	56
CC[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961432	FJ	On-Demand	Anodyne	CPT1A	111	39
CC[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961433	FJ	On-Demand	Anodyne	PRCP	29	56
CC[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961433	FJ	On-Demand	Anodyne	CPT1A	111	39
CC[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961434	FJ	On-Demand	Anodyne	PRCP	29	56
CC[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961434	FJ	On-Demand	Anodyne	CPT1A	111	39
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450961435	GF	On-Demand	Anodyne	P2RY12	62	39
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450961436	GF	On-Demand	Anodyne	P2RY12	62	39
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	DRD2	24	46
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	DRD4	34	42
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	ACHE	36	44
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	DRD3	29	46
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	VACHT_TETCF	0	43
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	SIGMAR1	33	40
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	BCHE	0	43
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	CCR5	22	43
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	SFRP1	100	39
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1ccc(C2CC2)cc1	ZINC000450961445	FH	On-Demand	Anodyne	WNT3	50	30
O=C(COc1ccc(S(=O)(=O)NCCC2=CCCCC2)cc1)NC1CC1	ZINC000450961448	GF	On-Demand	Anodyne	LUXN	0	41
COc1ccc(OC)c([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450961449	GH	On-Demand	Anodyne	FKBP1A	68	39
COc1ccc(OC)c([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450961449	GH	On-Demand	Anodyne	COLA	128	42
COc1ccc(OC)c([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450961449	GH	On-Demand	Anodyne	CPT1A	120	42
COc1ccc(OC)c([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450961449	GH	On-Demand	Anodyne	CPT2	40	42
COc1ccc(OC)c([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450961450	GH	On-Demand	Anodyne	FKBP1A	68	39
COc1ccc(OC)c([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450961450	GH	On-Demand	Anodyne	COLA	128	42
COc1ccc(OC)c([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450961450	GH	On-Demand	Anodyne	CPT1A	120	42
COc1ccc(OC)c([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450961450	GH	On-Demand	Anodyne	CPT2	40	42
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	MMP13	38	40
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	ADAM17	23	42
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	MMP2	31	40
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	MMP8	19	40
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	MMP14	22	40
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	MMP9	26	40
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	MMP12	20	40
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	MMP1	24	40
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	LUXN	0	47
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	GLMU	0	47
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	ADIPOR1	0	42
COc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961456	GD	On-Demand	Anodyne	ADIPOR2	0	42
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	CA2	25	48
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	CA1	38	53
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	MMP13	34	42
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	CA4	31	45
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	MMP2	31	46
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	MMP9	25	41
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	MMP12	44	38
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	MMP7	23	40
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	ADAMTS4	44	37
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	LEF	58	42
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	IDO1	36	40
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	P96878_MYCTU	43	39
CCC(CC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961457	DF	On-Demand	Anodyne	AADAC	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)CCCCC3)cc1	ZINC000450961458	GH	On-Demand	Anodyne	CA2	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)CCCCC3)cc1	ZINC000450961458	GH	On-Demand	Anodyne	CA1	18	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)CCCCC3)cc1	ZINC000450961458	GH	On-Demand	Anodyne	CA4	21	42
COc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961459	FF	On-Demand	Anodyne	KCNA5	26	42
COc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961459	FF	On-Demand	Anodyne	IAP	0	43
COc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961459	FF	On-Demand	Anodyne	IDO1	26	40
COc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450961459	FF	On-Demand	Anodyne	GLMU	0	55
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCn3nc(C)nc3C)c2)CC1	ZINC000450961484	GD	On-Demand	Anodyne	HRH2	44	34
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCn3nc(C)nc3C)c2)CC1	ZINC000450961484	GD	On-Demand	Anodyne	HTR1D	30	43
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCn3nc(C)nc3C)c2)CC1	ZINC000450961484	GD	On-Demand	Anodyne	HTR1B	25	41
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCn3nc(C)nc3C)c2)CC1	ZINC000450961484	GD	On-Demand	Anodyne	FAAH	22	40
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCn3nc(C)nc3C)c2)CC1	ZINC000450961484	GD	On-Demand	Anodyne	P2RY14	42	32
C[C@H]1CCc2ccccc2N1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450961490	EH	On-Demand	Anodyne	PTGIR	56	34
C[C@@H]1CCc2ccccc2N1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450961491	EH	On-Demand	Anodyne	PTGIR	56	34
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(C)c2)s1	ZINC000450961500	FG	On-Demand	Anodyne	SCD1	24	41
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(C)c2)s1	ZINC000450961500	FG	On-Demand	Anodyne	SCD	16	41
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(C)c2)s1	ZINC000450961501	FG	On-Demand	Anodyne	SCD1	24	41
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(C)c2)s1	ZINC000450961501	FG	On-Demand	Anodyne	SCD	16	41
CO[C@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961503	GF	On-Demand	Anodyne	P2RY12	34	55
CO[C@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961503	GF	On-Demand	Anodyne	PDGFRB	68	43
CO[C@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961503	GF	On-Demand	Anodyne	AKT2	30	49
CO[C@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961503	GF	On-Demand	Anodyne	AKT3	47	49
CO[C@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961503	GF	On-Demand	Anodyne	AKT1	40	49
CO[C@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961503	GF	On-Demand	Anodyne	AKT1S1	0	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961504	GF	On-Demand	Anodyne	P2RY12	34	55
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961504	GF	On-Demand	Anodyne	PDGFRB	68	43
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961504	GF	On-Demand	Anodyne	AKT2	30	49
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961504	GF	On-Demand	Anodyne	AKT3	47	49
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961504	GF	On-Demand	Anodyne	AKT1	40	49
CO[C@@H](Cc1ccccc1)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450961504	GF	On-Demand	Anodyne	AKT1S1	0	44
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	CA2	24	57
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	ADRB2	29	45
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	ADRB1	30	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	ADRB3	29	42
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	CA1	25	57
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	MMP13	27	47
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	MMP16	0	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	CA14	19	57
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	MMP2	16	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	MMP8	17	47
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	MMP9	28	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	MMP12	23	47
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	ACR	39	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	CA12	21	47
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	PTGDR	23	43
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	CA9	30	47
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(OC)cc2)cc1	ZINC000450961510	GF	On-Demand	Anodyne	MMP1	32	40
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	CHRM2	19	40
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	DRD2	29	48
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	DRD4	51	48
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	ACHE	48	45
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	HRH2	25	40
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	DRD3	33	48
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	HTR7	15	43
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	SIGMAR1	55	49
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	SSTR5	82	39
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	MMP13	21	41
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	NPY2R	47	37
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	BCHE	0	41
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	CCR3	30	42
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	HTR6	17	43
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	ADAM17	18	41
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	MMP9	16	41
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	MMP1	17	41
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	MCHR1	40	48
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	CCR8	117	43
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	SFRP1	135	41
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	WNT3	89	39
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	ADIPOR1	0	42
COC(=O)c1ncccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450961512	GD	On-Demand	Anodyne	ADIPOR2	0	42
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c(O)c1	ZINC000450961513	GE	On-Demand	Anodyne	ALPL	18	41
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c(O)c1	ZINC000450961513	GE	On-Demand	Anodyne	MTNN	57	37
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c(O)c1	ZINC000450961513	GE	On-Demand	Anodyne	FFAR4	29	41
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c(O)c1	ZINC000450961513	GE	On-Demand	Anodyne	UQCRB	0	43
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	BMP1	75	44
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP13	80	45
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	ADAM17	42	42
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP2	55	53
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP3	59	53
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP8	54	53
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP14	27	45
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	PTPN1	18	42
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP9	68	53
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP12	33	46
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP7	34	40
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	CXCR3	17	55
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	ADAMTS4	39	45
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	MMP1	69	53
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	DAGLA	37	41
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	RORC	25	41
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	LUXN	0	50
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	ADIPOR1	0	50
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961514	GF	On-Demand	Anodyne	ADIPOR2	0	50
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450961515	GG	On-Demand	Anodyne	HTR1A	18	44
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450961515	GG	On-Demand	Anodyne	HTR2A	15	44
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450961516	GG	On-Demand	Anodyne	HTR1A	18	44
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450961516	GG	On-Demand	Anodyne	HTR2A	15	44
CCO[C@H]1C[C@@H](NCCC(=O)Nc2cccnc2)C12CCCC2	ZINC000450961533	DF	On-Demand	Anodyne	TIMP3	30	41
CCO[C@H]1C[C@H](NCCC(=O)Nc2cccnc2)C12CCCC2	ZINC000450961534	DF	On-Demand	Anodyne	TIMP3	30	41
CCO[C@@H]1C[C@@H](NCCC(=O)Nc2cccnc2)C12CCCC2	ZINC000450961535	DF	On-Demand	Anodyne	TIMP3	30	41
CCO[C@@H]1C[C@H](NCCC(=O)Nc2cccnc2)C12CCCC2	ZINC000450961536	DF	On-Demand	Anodyne	TIMP3	30	41
CN1CCN(CCC(C)(C)NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)CC1	ZINC000450961550	GD	On-Demand	Anodyne	CACNA1I	45	37
COc1ccccc1N1CCN(S(=O)(=O)c2cc(C)cs2)CC1	ZINC000450961556	FF	On-Demand	Anodyne	DRD1	36	43
COc1ccccc1N1CCN(S(=O)(=O)c2cc(C)cs2)CC1	ZINC000450961556	FF	On-Demand	Anodyne	DRD4	23	40
COc1ccccc1N1CCN(S(=O)(=O)c2cc(C)cs2)CC1	ZINC000450961556	FF	On-Demand	Anodyne	DRD3	44	36
COc1ccccc1N1CCN(S(=O)(=O)c2cc(C)cs2)CC1	ZINC000450961556	FF	On-Demand	Anodyne	HTR6	0	45
CS(=O)(=O)c1ccc(N2CC[C@@H](CCCO)C2)c(C(F)(F)F)c1	ZINC000450961563	FF	On-Demand	Anodyne	HSD11B1	0	41
CS(=O)(=O)c1ccc(N2CC[C@@H](CCCO)C2)c(C(F)(F)F)c1	ZINC000450961563	FF	On-Demand	Anodyne	SLC6A9	35	40
CS(=O)(=O)c1ccc(N2CC[C@H](CCCO)C2)c(C(F)(F)F)c1	ZINC000450961564	FF	On-Demand	Anodyne	HSD11B1	0	41
CS(=O)(=O)c1ccc(N2CC[C@H](CCCO)C2)c(C(F)(F)F)c1	ZINC000450961564	FF	On-Demand	Anodyne	SLC6A9	35	40
CC(=O)c1cccc(CN2CC[C@H](c3nc(C)no3)C2)c1	ZINC000450961567	CF	On-Demand	Anodyne	GRM5	22	40
CC(=O)c1cccc(CN2CC[C@H](c3nc(C)no3)C2)c1	ZINC000450961567	CF	On-Demand	Anodyne	SMO	42	33
CC(=O)c1cccc(CN2CC[C@H](c3nc(C)no3)C2)c1	ZINC000450961567	CF	On-Demand	Anodyne	ETHR	60	38
CC(=O)c1cccc(CN2CC[C@@H](c3nc(C)no3)C2)c1	ZINC000450961568	CF	On-Demand	Anodyne	GRM5	22	40
CC(=O)c1cccc(CN2CC[C@@H](c3nc(C)no3)C2)c1	ZINC000450961568	CF	On-Demand	Anodyne	SMO	42	33
CC(=O)c1cccc(CN2CC[C@@H](c3nc(C)no3)C2)c1	ZINC000450961568	CF	On-Demand	Anodyne	ETHR	60	38
Cc1[nH]c(C#N)cc1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961585	FH	On-Demand	Mild	COLA	68	41
Cc1[nH]c(C#N)cc1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961585	FH	On-Demand	Mild	CPT1A	60	41
Cc1[nH]c(C#N)cc1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961586	FH	On-Demand	Mild	COLA	68	41
Cc1[nH]c(C#N)cc1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450961586	FH	On-Demand	Mild	CPT1A	60	41
Cc1c(Cl)cccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961600	GG	On-Demand	Anodyne	PRTN3	59	37
Cc1c(Cl)cccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961600	GG	On-Demand	Anodyne	LUXN	0	47
Cc1c(Cl)cccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961600	GG	On-Demand	Anodyne	ADIPOR1	0	42
Cc1c(Cl)cccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961600	GG	On-Demand	Anodyne	ADIPOR2	0	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1C(C)C	ZINC000450961607	EF	On-Demand	Anodyne	PRTN3	51	32
C[C@@H](O)CN1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000450961609	DD	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000450961611	DD	On-Demand	Anodyne	VACHT_TETCF	0	42
COc1cc(CC(=O)N(C)C[C@@H]2C[C@H](F)CN2c2nnc(C)o2)ccc1Cl	ZINC000450961629	GF	On-Demand	Anodyne	OPRK1	0	40
CC(=O)c1cccc(CN2C[C@H](F)C[C@H]2C(=O)N2CCOCC2)c1	ZINC000450961633	ED	On-Demand	Anodyne	ITGAL	40	31
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	CA2	18	59
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	ADRB2	38	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	ADRB1	20	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	ADRB3	52	42
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	CA1	17	59
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	HTR6	19	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	CA4	26	59
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	MLNR	0	42
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	GHSR	15	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	ALPL	20	49
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	MTNN	89	45
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	LEF	15	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	IDO1	21	42
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	ALPI	19	59
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	LIMK2	45	47
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	MGAT1	53	37
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000450961645	GF	On-Demand	Anodyne	MOGAT2	40	33
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)c(F)c1	ZINC000450961646	GC	On-Demand	Anodyne	F13A1	21	42
O=S(=O)(c1cc2cc(F)ccc2o1)N1CCCCC1	ZINC000450961669	CF	On-Demand	Anodyne	LPL	49	39
C[C@@H](O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961680	FE	On-Demand	Anodyne	MC4R	94	45
C[C@@H](O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961680	FE	On-Demand	Anodyne	PRCP	58	40
C[C@@H](O)CN1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961680	FE	On-Demand	Anodyne	MC5R	15	45
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961681	FE	On-Demand	Anodyne	MC4R	94	45
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961681	FE	On-Demand	Anodyne	PRCP	58	40
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961681	FE	On-Demand	Anodyne	MC5R	15	45
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961684	FE	On-Demand	Anodyne	MC4R	94	45
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961684	FE	On-Demand	Anodyne	PRCP	58	40
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961684	FE	On-Demand	Anodyne	MC5R	15	45
COc1ccc2c(N3CC[C@@H](CCCO)C3)c([N+](=O)[O-])cnc2c1	ZINC000450961685	EF	On-Demand	Bother	PDE3B	49	33
C[C@@H](O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961686	FE	On-Demand	Anodyne	MC4R	94	45
C[C@@H](O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961686	FE	On-Demand	Anodyne	PRCP	58	40
C[C@@H](O)CN1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450961686	FE	On-Demand	Anodyne	MC5R	15	45
COc1ccc2c(N3CC[C@H](CCCO)C3)c([N+](=O)[O-])cnc2c1	ZINC000450961687	EF	On-Demand	Bother	PDE3B	49	33
CO[C@H](Cc1ccccc1)CN1C[C@H](F)C[C@H]1C(N)=O	ZINC000450961705	CD	On-Demand	Anodyne	FAP	0	41
Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450961719	FF	On-Demand	Anodyne	RCE1	0	40
Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450961719	FF	On-Demand	Anodyne	ADAMTS4	43	32
Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450961719	FF	On-Demand	Anodyne	LUXN	0	48
Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450961719	FF	On-Demand	Anodyne	ADIPOR1	0	42
Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450961719	FF	On-Demand	Anodyne	ADIPOR2	0	42
CO[C@@H](Cc1ccccc1)CN1C[C@H](F)C[C@H]1C(N)=O	ZINC000450961721	CD	On-Demand	Anodyne	FAP	0	41
CCN1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450961762	ED	On-Demand	Mild	ADORA2B	41	37
CCN1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450961762	ED	On-Demand	Mild	TRPV4	42	34
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc(-c2ccncc2)c(F)c1	ZINC000450961804	GH	On-Demand	Anodyne	CACNA1I	82	45
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc(-c2ccncc2)c(F)c1	ZINC000450961804	GH	On-Demand	Anodyne	HSPB1	0	43
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc(-c2ccncc2)c(F)c1	ZINC000450961804	GH	On-Demand	Anodyne	HPGDS	38	44
CCOC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450961810	GG	On-Demand	Anodyne	HCN1	42	33
CCOC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450961810	GG	On-Demand	Anodyne	HCN4	43	34
C/C=C\COc1cccc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450961811	GH	On-Demand	Anodyne	HTR4	45	33
C/C=C\COc1cccc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450961811	GH	On-Demand	Anodyne	CACNA1I	81	42
C/C=C\COc1cccc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450961811	GH	On-Demand	Anodyne	HPGDS	34	41
C/C=C/COc1cccc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450961813	GH	On-Demand	Anodyne	HTR4	45	33
C/C=C/COc1cccc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450961813	GH	On-Demand	Anodyne	CACNA1I	81	42
C/C=C/COc1cccc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450961813	GH	On-Demand	Anodyne	HPGDS	34	41
CCOC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450961814	GG	On-Demand	Anodyne	HCN1	42	33
CCOC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450961814	GG	On-Demand	Anodyne	HCN4	43	34
CCOC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450961817	GG	On-Demand	Anodyne	HCN1	42	33
CCOC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450961817	GG	On-Demand	Anodyne	HCN4	43	34
CCOC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450961819	GG	On-Demand	Anodyne	HCN1	42	33
CCOC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450961819	GG	On-Demand	Anodyne	HCN4	43	34
COC(=O)c1ncccc1S(=O)(=O)N1CCCCCC1	ZINC000450961821	CD	On-Demand	Anodyne	EPHX2	23	43
COC(=O)c1ncccc1S(=O)(=O)N1CCCCCC1	ZINC000450961821	CD	On-Demand	Anodyne	NAMPT	26	41
C/C=C\C[C@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450961825	CD	On-Demand	Anodyne	MTNR1A	32	40
C/C=C\C[C@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450961825	CD	On-Demand	Anodyne	MTNR1B	34	40
CC[C@@H]1C[C@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450961828	CE	On-Demand	Anodyne	CACNA1I	55	36
C/C=C\C[C@@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450961832	CD	On-Demand	Anodyne	MTNR1A	32	40
C/C=C\C[C@@H](CO)NC(=O)CCOc1cccc(OC)c1	ZINC000450961832	CD	On-Demand	Anodyne	MTNR1B	34	40
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450961840	FJ	On-Demand	Anodyne	PPARG	59	40
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450961840	FJ	On-Demand	Anodyne	PPARA	63	41
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450961840	FJ	On-Demand	Anodyne	PDE8A	0	43
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450961840	FJ	On-Demand	Anodyne	PDE8B	66	40
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450961841	FJ	On-Demand	Anodyne	PPARG	59	40
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450961841	FJ	On-Demand	Anodyne	PPARA	63	41
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450961841	FJ	On-Demand	Anodyne	PDE8A	0	43
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450961841	FJ	On-Demand	Anodyne	PDE8B	66	40
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450961843	FJ	On-Demand	Anodyne	PPARG	59	40
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450961843	FJ	On-Demand	Anodyne	PPARA	63	41
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450961843	FJ	On-Demand	Anodyne	PDE8A	0	43
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450961843	FJ	On-Demand	Anodyne	PDE8B	66	40
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450961846	FJ	On-Demand	Anodyne	PPARG	59	40
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450961846	FJ	On-Demand	Anodyne	PPARA	63	41
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450961846	FJ	On-Demand	Anodyne	PDE8A	0	43
Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450961846	FJ	On-Demand	Anodyne	PDE8B	66	40
O=S(=O)(NCCCn1ccnc1)c1cc(C(F)(F)F)ccc1O	ZINC000450961848	ED	On-Demand	Anodyne	TBXAS1	39	53
O=S(=O)(NCCCn1ccnc1)c1cc(C(F)(F)F)ccc1O	ZINC000450961848	ED	On-Demand	Anodyne	QPCT	37	48
CC(=O)c1ccc(CS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1	ZINC000450961868	FF	On-Demand	Anodyne	AKR1C3	27	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA2	44	58
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	ADRB2	37	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	ADRB1	42	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	ADRB3	49	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	MME	31	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	TBXA2R	58	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	TBXAS1	41	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA1	57	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	KCNA5	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA7	31	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	MMP13	45	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	COLA	47	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA5B	54	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA4	42	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA5A	58	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA14	24	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	MMP2	55	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	MMP3	62	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	ALOX15	52	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CAPN1	27	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	MMP9	35	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	MMP12	51	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA12	35	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	ADAMTS4	63	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	CA9	37	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	MMP1	26	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	AMP1_PLAFQ	30	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	NCE103	27	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	PFK	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	LIMK2	51	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	MTCA1	29	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	P96878_MYCTU	34	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1	ZINC000450961874	EF	On-Demand	Anodyne	A6YCJ1_9METZ	22	43
Cc1noc(C)c1-c1nc(-c2ccc(NC(=O)C(C)(C)C)cc2)c(C)s1	ZINC000450961886	FK	On-Demand	Anodyne	BRD4	21	41
COc1ccc(CC(=O)NC(C)(C)CCN2CCN(C)CC2)c(Cl)c1OC	ZINC000450961888	GE	On-Demand	Anodyne	SLC9A1	61	35
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)c(OC)c1	ZINC000450961891	GD	On-Demand	Anodyne	TBXAS1	27	45
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)c(OC)c1	ZINC000450961891	GD	On-Demand	Anodyne	PTGDR	22	41
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)c(OC)c1	ZINC000450961891	GD	On-Demand	Anodyne	IAP	0	41
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)c(OC)c1	ZINC000450961891	GD	On-Demand	Anodyne	ABCG2	22	43
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)c(OC)c1	ZINC000450961891	GD	On-Demand	Anodyne	SCMU_MYCTU	0	41
COC(=O)c1cccc(Cc2cnc(NS(=O)(=O)C[C@@H](C)OC)s2)c1	ZINC000450961892	GE	On-Demand	Anodyne	SCD1	36	40
COC(=O)c1cccc(Cc2cnc(NS(=O)(=O)C[C@@H](C)OC)s2)c1	ZINC000450961892	GE	On-Demand	Anodyne	SCD	35	40
COC(=O)c1cccc(Cc2cnc(NS(=O)(=O)C[C@H](C)OC)s2)c1	ZINC000450961893	GE	On-Demand	Anodyne	SCD1	36	40
COC(=O)c1cccc(Cc2cnc(NS(=O)(=O)C[C@H](C)OC)s2)c1	ZINC000450961893	GE	On-Demand	Anodyne	SCD	35	40
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)NCCCOc1ccccc1F	ZINC000450961898	GG	On-Demand	Anodyne	HCN1	41	32
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)NCCCOc1ccccc1F	ZINC000450961898	GG	On-Demand	Anodyne	HCN4	41	33
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	ZINC000450961903	FG	On-Demand	Anodyne	NPY2R	53	41
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	ZINC000450961905	FG	On-Demand	Anodyne	NPY2R	53	41
CCOC(=O)c1sc(NS(=O)(=O)c2ccc(CC#N)cc2Cl)nc1C	ZINC000450961906	GG	On-Demand	Mild	DHODH	27	49
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)CS(=O)(=O)C1CC1	ZINC000450961912	FD	On-Demand	Anodyne	TIMP3	44	32
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cn(CC2CC2)nn1	ZINC000450961914	ED	On-Demand	Anodyne	CACNA1I	66	39
O=C(COc1ccc(S(=O)(=O)NCc2ccncc2)cc1)NC1CC1	ZINC000450961916	FD	On-Demand	Anodyne	MMP13	15	41
O=C(COc1ccc(S(=O)(=O)NCc2ccncc2)cc1)NC1CC1	ZINC000450961916	FD	On-Demand	Anodyne	LUXN	0	42
O=C(COc1ccc(S(=O)(=O)NCc2ccncc2)cc1)NC1CC1	ZINC000450961916	FD	On-Demand	Anodyne	ADIPOR1	0	43
O=C(COc1ccc(S(=O)(=O)NCc2ccncc2)cc1)NC1CC1	ZINC000450961916	FD	On-Demand	Anodyne	ADIPOR2	0	43
CCN(CC)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450961918	DD	On-Demand	Anodyne	RORB	0	48
CCC(=O)C1(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)CC1	ZINC000450961921	FE	On-Demand	Anodyne	P2RY12	23	47
CCC(=O)C1(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)CC1	ZINC000450961921	FE	On-Demand	Anodyne	SIRT3	50	31
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)CS(=O)(=O)C1CC1	ZINC000450961923	FD	On-Demand	Anodyne	TIMP3	44	32
CCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961934	FF	On-Demand	Anodyne	KCNA5	23	41
CCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961934	FF	On-Demand	Anodyne	LUXN	0	52
CCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961934	FF	On-Demand	Anodyne	ADIPOR1	0	44
CCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961934	FF	On-Demand	Anodyne	ADIPOR2	0	44
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961946	GG	On-Demand	Anodyne	P2RY12	81	32
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961946	GG	On-Demand	Anodyne	TACR2	0	40
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961946	GG	On-Demand	Anodyne	P2RX3	17	41
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961946	GG	On-Demand	Anodyne	CTSV	45	31
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961946	GG	On-Demand	Anodyne	HPGDS	44	51
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961946	GG	On-Demand	Anodyne	CCL5	0	40
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961948	GG	On-Demand	Anodyne	P2RY12	81	32
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961948	GG	On-Demand	Anodyne	TACR2	0	40
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961948	GG	On-Demand	Anodyne	P2RX3	17	41
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961948	GG	On-Demand	Anodyne	CTSV	45	31
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961948	GG	On-Demand	Anodyne	HPGDS	44	51
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)C1CCN(CC(F)(F)F)CC1	ZINC000450961948	GG	On-Demand	Anodyne	CCL5	0	40
C[C@@H](NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1)c1ccc(Cl)cn1	ZINC000450961958	GG	On-Demand	Anodyne	CACNA1I	15	47
C[C@H](NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1)c1ccc(Cl)cn1	ZINC000450961959	GG	On-Demand	Anodyne	CACNA1I	15	47
CCOC(=O)C1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1	ZINC000450961961	FF	On-Demand	Anodyne	FDFT1	22	41
COc1cccc(OCCC(=O)Nc2c(C)cccc2SC)c1	ZINC000450961971	EI	On-Demand	Anodyne	MTNR1A	40	46
COc1cccc(OCCC(=O)Nc2c(C)cccc2SC)c1	ZINC000450961971	EI	On-Demand	Anodyne	MTNR1B	39	46
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C(C)(C)OC(C)C	ZINC000450961982	FG	On-Demand	Anodyne	CTRB_BOVIN	54	41
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	AVPR1B	25	41
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	MMP13	28	40
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	MMP2	19	40
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	MMP3	23	45
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	MMP9	17	40
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	EPHX2	22	40
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	MMP1	18	40
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	LUXN	0	50
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	ADIPOR1	0	41
CCN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450961984	GF	On-Demand	Anodyne	ADIPOR2	0	41
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C(C)(C)OC(C)C	ZINC000450961985	FG	On-Demand	Anodyne	CTRB_BOVIN	54	41
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450961989	EE	On-Demand	Anodyne	HTR1D	22	40
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450961989	EE	On-Demand	Anodyne	CCR3	41	42
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450961989	EE	On-Demand	Anodyne	RHOA	0	41
CC(=O)N1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450962026	ED	On-Demand	Mild	TRPV4	44	35
CC(=O)N1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450962026	ED	On-Demand	Mild	F13A1	22	41
CCC[C@@H](CC(C)C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450962029	EH	On-Demand	Anodyne	CACNA1I	61	37
CCC[C@H](CC(C)C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450962030	EH	On-Demand	Anodyne	CACNA1I	61	37
C[C@@H]1Cc2cccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)c2O1	ZINC000450962032	FG	On-Demand	Anodyne	HTR4	58	42
C[C@@H]1Cc2cccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)c2O1	ZINC000450962032	FG	On-Demand	Anodyne	CACNA1I	60	38
C[C@H]1Cc2cccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)c2O1	ZINC000450962033	FG	On-Demand	Anodyne	HTR4	58	42
C[C@H]1Cc2cccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)c2O1	ZINC000450962033	FG	On-Demand	Anodyne	CACNA1I	60	38
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962034	FG	On-Demand	Anodyne	CA2	27	48
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962034	FG	On-Demand	Anodyne	PPIA	25	41
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962034	FG	On-Demand	Anodyne	CA1	33	48
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962034	FG	On-Demand	Anodyne	CA4	46	48
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962034	FG	On-Demand	Anodyne	CA9	19	48
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962034	FG	On-Demand	Anodyne	LEF	29	42
CNC(=O)[C@H]1CN(CCc2ccc(Cl)cc2)C[C@@H]1c1cnn(C)c1	ZINC000450962035	EE	On-Demand	Anodyne	SLC6A1	46	47
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	DRD2	40	37
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	DRD4	25	45
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	ACHE	25	41
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	DRD3	24	45
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	HTR4	97	46
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	SIGMAR1	19	45
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	SSTR5	46	37
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	CCR3	56	43
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	CCR2	25	45
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	MCHR1	32	42
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	CACNA1I	87	48
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	NCE103	19	41
COc1cc(CC(=O)NCC2CCN(CC(F)(F)F)CC2)ccc1Cl	ZINC000450962040	GG	On-Demand	Anodyne	CAN2	0	41
Cc1cccc2c1C[C@@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)O2	ZINC000450962041	FF	On-Demand	Anodyne	CACNA1I	45	37
Cc1cccc2c1C[C@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)O2	ZINC000450962042	FF	On-Demand	Anodyne	CACNA1I	45	37
CC[C@@H](O)CC(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450962050	DD	On-Demand	Anodyne	PDS	48	36
CC[C@H](O)CC(=O)NCc1nc(COc2ccccc2)n[nH]1	ZINC000450962051	DD	On-Demand	Anodyne	PDS	48	36
Cc1nc2ccnn2cc1C(=O)Nc1c2c(nn1C(C)C)CCC2	ZINC000450962054	DF	On-Demand	Anodyne	DDR1	42	36
COc1ccc2nc(C)nc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450962059	DF	On-Demand	Anodyne	PDE3A	48	41
COc1ccc2nc(C)nc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450962059	DF	On-Demand	Anodyne	PDE3B	71	41
COc1ccc2nc(C)nc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450962060	DF	On-Demand	Anodyne	PDE3A	48	41
COc1ccc2nc(C)nc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450962060	DF	On-Demand	Anodyne	PDE3B	71	41
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450962065	FG	On-Demand	Anodyne	PDE3A	47	39
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450962065	FG	On-Demand	Anodyne	PDE3B	68	39
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450962066	FG	On-Demand	Anodyne	PDE3A	47	39
COc1ccc2nc(C(F)(F)F)nc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450962066	FG	On-Demand	Anodyne	PDE3B	68	39
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)NCCCOc1ccccc1F	ZINC000450962067	GG	On-Demand	Anodyne	HCN1	41	32
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)NCCCOc1ccccc1F	ZINC000450962067	GG	On-Demand	Anodyne	HCN4	41	33
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)NCCCOc1ccccc1F	ZINC000450962069	GG	On-Demand	Anodyne	HCN1	41	32
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)NCCCOc1ccccc1F	ZINC000450962069	GG	On-Demand	Anodyne	HCN4	41	33
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)NCCCOc1ccccc1F	ZINC000450962070	GG	On-Demand	Anodyne	HCN1	41	32
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)NCCCOc1ccccc1F	ZINC000450962070	GG	On-Demand	Anodyne	HCN4	41	33
CCOC(=O)c1ccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)cc1	ZINC000450962071	FF	On-Demand	Anodyne	PTPRB	44	35
CCOC(=O)c1ccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)cc1	ZINC000450962072	FF	On-Demand	Anodyne	PTPRB	44	35
N#CCc1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000450962086	GF	On-Demand	Mild	ADORA2B	47	38
N#CCc1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000450962086	GF	On-Demand	Mild	SIGMAR1	50	50
N#CCc1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000450962086	GF	On-Demand	Mild	TRPV4	36	70
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccccc2s1	ZINC000450962087	FH	On-Demand	Anodyne	CSNK1D	32	45
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccccc2s1	ZINC000450962087	FH	On-Demand	Anodyne	ACOX1	40	32
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccccc2s1	ZINC000450962088	FH	On-Demand	Anodyne	CSNK1D	32	45
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccccc2s1	ZINC000450962088	FH	On-Demand	Anodyne	ACOX1	40	32
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccccc2s1	ZINC000450962090	FH	On-Demand	Anodyne	CSNK1D	32	45
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)Nc1nc2ccccc2s1	ZINC000450962090	FH	On-Demand	Anodyne	ACOX1	40	32
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccccc2s1	ZINC000450962091	FH	On-Demand	Anodyne	CSNK1D	32	45
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)Nc1nc2ccccc2s1	ZINC000450962091	FH	On-Demand	Anodyne	ACOX1	40	32
CC(C)CCC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450962122	BD	On-Demand	Anodyne	ADORA3	41	38
CC(C)CCC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450962122	BD	On-Demand	Anodyne	SCARB1	43	35
COc1ccc(S(=O)(=O)CC(=O)CC(C)(C)C2CC2)cc1	ZINC000450962126	DF	On-Demand	Anodyne	MMP13	46	45
COc1ccc(S(=O)(=O)CC(=O)CC(C)(C)C2CC2)cc1	ZINC000450962126	DF	On-Demand	Anodyne	MMP3	53	40
COc1ccc(S(=O)(=O)CC(=O)CC(C)(C)C2CC2)cc1	ZINC000450962126	DF	On-Demand	Anodyne	MMP9	41	45
COc1ccc(S(=O)(=O)CC(=O)CC(C)(C)C2CC2)cc1	ZINC000450962126	DF	On-Demand	Anodyne	MMP7	50	39
COc1ccc(S(=O)(=O)CC(=O)CC(C)(C)C2CC2)cc1	ZINC000450962126	DF	On-Demand	Anodyne	MMP1	54	45
COc1ccc(S(=O)(=O)CC(=O)CC(C)(C)C2CC2)cc1	ZINC000450962126	DF	On-Demand	Anodyne	E1	0	55
COc1ccc(CC(=O)N2CCN(C[C@@H](C)O)CC2)c(Cl)c1OC	ZINC000450962141	FD	On-Demand	Anodyne	SLC9A1	44	31
COC(=O)[C@@H](NC(=O)[C@@H]1CC[C@H](C)O1)c1ccc(OC)c(Cl)c1	ZINC000450962143	EE	On-Demand	Anodyne	HTR4	40	34
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450962147	FH	On-Demand	Anodyne	CCR3	37	41
CCC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450962147	FH	On-Demand	Anodyne	RHOA	0	40
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)C1	ZINC000450962148	DF	On-Demand	Mild	AKR1C3	0	42
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450962149	FH	On-Demand	Anodyne	CCR3	37	41
CCC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450962149	FH	On-Demand	Anodyne	RHOA	0	40
CCC[C@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450962150	FH	On-Demand	Anodyne	CCR3	37	41
CCC[C@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450962150	FH	On-Demand	Anodyne	RHOA	0	40
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450962151	FH	On-Demand	Anodyne	CCR3	37	41
CCC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450962151	FH	On-Demand	Anodyne	RHOA	0	40
C[C@H]1CCCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)C1	ZINC000450962153	DF	On-Demand	Mild	AKR1C3	0	42
CC(=O)N1CCN(c2cccc(NC(=O)Cc3ccc(O)c(F)c3)c2)CC1	ZINC000450962156	FE	On-Demand	Anodyne	MAPK1	30	42
CCc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962159	FG	On-Demand	Anodyne	CA2	19	43
CCc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962159	FG	On-Demand	Anodyne	CA1	22	43
CCc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962159	FG	On-Demand	Anodyne	CA4	31	43
CCc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)sc1C	ZINC000450962159	FG	On-Demand	Anodyne	LEF	18	46
CCC(=O)Nc1ccc(-c2csc(NC3CCC3)n2)cc1	ZINC000450962161	DH	On-Demand	Anodyne	SPHK2	50	36
CCC(=O)Nc1ccc(-c2csc(NC3CCC3)n2)cc1	ZINC000450962161	DH	On-Demand	Anodyne	HDAC9	16	45
CCC(=O)Nc1ccc(-c2csc(NC3CCC3)n2)cc1	ZINC000450962161	DH	On-Demand	Anodyne	SPHK1	47	38
CCOC(=O)c1ccc(CS(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962163	FF	On-Demand	Anodyne	SCN5A	0	43
CCO[C@H]1C[C@@H](NCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C12CCCC2	ZINC000450962172	GG	On-Demand	Bother	KCNMA1	19	42
CCO[C@@H]1C[C@@H](NCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C12CCCC2	ZINC000450962173	GG	On-Demand	Bother	KCNMA1	19	42
CCO[C@H]1C[C@H](NCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C12CCCC2	ZINC000450962174	GG	On-Demand	Bother	KCNMA1	19	42
CCO[C@@H]1C[C@H](NCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C12CCCC2	ZINC000450962176	GG	On-Demand	Bother	KCNMA1	19	42
Cc1ccc(F)cc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450962178	DH	On-Demand	Anodyne	FFAR4	30	41
Cc1ccc(F)cc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450962178	DH	On-Demand	Anodyne	PIK3C3	45	31
Cc1ccc(F)cc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450962178	DH	On-Demand	Anodyne	MOGAT2	42	36
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)CCN1CCN(C)CC1	ZINC000450962181	FE	On-Demand	Anodyne	SLC6A3	27	40
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)CCN1CCN(C)CC1	ZINC000450962181	FE	On-Demand	Anodyne	SIGMAR1	29	45
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)CCN1CCN(C)CC1	ZINC000450962183	FE	On-Demand	Anodyne	SLC6A3	27	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)CCN1CCN(C)CC1	ZINC000450962183	FE	On-Demand	Anodyne	SIGMAR1	29	45
Cc1cnc(CCCC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)o1	ZINC000450962204	GF	On-Demand	Anodyne	SIRT3	50	31
Cc1cnc(CCCC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)o1	ZINC000450962204	GF	On-Demand	Anodyne	SIRT2	41	31
O=S(=O)(CCC1CCCC1)N1CCc2ccccc2C1	ZINC000450962207	CF	On-Demand	Anodyne	AKR1C3	60	45
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000450962208	EF	On-Demand	Anodyne	CYNT	47	45
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000450962208	EF	On-Demand	Anodyne	UQCRB	0	41
CS(=O)(=O)NCCc1ccc(-c2csc(NC3CCC3)n2)cc1	ZINC000450962245	FE	On-Demand	Anodyne	MAOA	15	40
CS(=O)(=O)NCCc1ccc(-c2csc(NC3CCC3)n2)cc1	ZINC000450962245	FE	On-Demand	Anodyne	MAOB	27	41
CS(=O)(=O)NCCc1ccc(-c2csc(NC3CCC3)n2)cc1	ZINC000450962245	FE	On-Demand	Anodyne	SPHK2	68	38
CS(=O)(=O)NCCc1ccc(-c2csc(NC3CCC3)n2)cc1	ZINC000450962245	FE	On-Demand	Anodyne	SPHK1	58	38
CCO[C@@H]1C[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C12CCCC2	ZINC000450962250	FF	On-Demand	Anodyne	ABCB1	0	48
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCc1ccc2c(c1)OCCO2	ZINC000450962252	EG	On-Demand	Anodyne	HRH3	48	39
CCO[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C12CCCC2	ZINC000450962253	FF	On-Demand	Anodyne	ABCB1	0	48
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCc1ccc2c(c1)OCCO2	ZINC000450962255	EG	On-Demand	Anodyne	HRH3	48	39
CCO[C@@H]1C[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C12CCCC2	ZINC000450962256	FF	On-Demand	Anodyne	ABCB1	0	48
CCO[C@@H]1C[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C12CCCC2	ZINC000450962258	FF	On-Demand	Anodyne	ABCB1	0	48
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCc1ccc2c(c1)OCCO2	ZINC000450962260	EG	On-Demand	Anodyne	HRH3	48	39
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCc1ccc2c(c1)OCCO2	ZINC000450962265	EG	On-Demand	Anodyne	HRH3	48	39
Cc1ccn(-c2ccccc2C(=O)N(C)CC2(c3ccccc3)CC2)n1	ZINC000450962273	EH	On-Demand	Anodyne	KCNA3	18	49
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCN(Cc2ccccc2)CC1	ZINC000450962277	FF	On-Demand	Anodyne	DRD2	0	40
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCN(Cc2ccccc2)CC1	ZINC000450962279	FF	On-Demand	Anodyne	DRD2	0	40
COc1ccc(S(=O)(=O)CCC[C@H](C)O)cc1	ZINC000450962295	CD	On-Demand	Anodyne	MMP13	40	63
COc1ccc(S(=O)(=O)CCC[C@H](C)O)cc1	ZINC000450962295	CD	On-Demand	Anodyne	MMP3	28	40
COc1ccc(S(=O)(=O)CCC[C@H](C)O)cc1	ZINC000450962295	CD	On-Demand	Anodyne	MMP8	28	40
COc1ccc(S(=O)(=O)CCC[C@H](C)O)cc1	ZINC000450962295	CD	On-Demand	Anodyne	MMP9	43	43
COc1ccc(S(=O)(=O)CCC[C@H](C)O)cc1	ZINC000450962295	CD	On-Demand	Anodyne	MMP12	29	42
COc1ccc(S(=O)(=O)CCC[C@H](C)O)cc1	ZINC000450962295	CD	On-Demand	Anodyne	MMP7	39	42
COc1ccc(S(=O)(=O)CCC[C@H](C)O)cc1	ZINC000450962295	CD	On-Demand	Anodyne	MMP1	48	44
COc1ccc(S(=O)(=O)CCC[C@@H](C)O)cc1	ZINC000450962296	CD	On-Demand	Anodyne	MMP13	40	63
COc1ccc(S(=O)(=O)CCC[C@@H](C)O)cc1	ZINC000450962296	CD	On-Demand	Anodyne	MMP3	28	40
COc1ccc(S(=O)(=O)CCC[C@@H](C)O)cc1	ZINC000450962296	CD	On-Demand	Anodyne	MMP8	28	40
COc1ccc(S(=O)(=O)CCC[C@@H](C)O)cc1	ZINC000450962296	CD	On-Demand	Anodyne	MMP9	43	43
COc1ccc(S(=O)(=O)CCC[C@@H](C)O)cc1	ZINC000450962296	CD	On-Demand	Anodyne	MMP12	29	42
COc1ccc(S(=O)(=O)CCC[C@@H](C)O)cc1	ZINC000450962296	CD	On-Demand	Anodyne	MMP7	39	42
COc1ccc(S(=O)(=O)CCC[C@@H](C)O)cc1	ZINC000450962296	CD	On-Demand	Anodyne	MMP1	48	44
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(C)cc2)cnc1C(F)F	ZINC000450962304	FG	On-Demand	Anodyne	ADRB2	31	40
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(C)cc2)cnc1C(F)F	ZINC000450962304	FG	On-Demand	Anodyne	ADRB1	21	40
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(C)cc2)cnc1C(F)F	ZINC000450962304	FG	On-Demand	Anodyne	ALPL	18	52
CCSc1cccnc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450962308	EE	On-Demand	Anodyne	NMUR2	0	41
CCSc1cccnc1C(=O)N1CCCN(C(=O)C2CC2)CC1	ZINC000450962308	EE	On-Demand	Anodyne	NMUR1	0	41
COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)n2cc([N+](=O)[O-])c(C)n2)c1	ZINC000450962324	EE	On-Demand	Bother	MAPK14	15	40
Cc1[nH]nc(-c2ccccc2)c1NC(=O)CCCC(=O)C(C)(C)C	ZINC000450962336	EI	On-Demand	Anodyne	HDAC3	21	40
COC(=O)c1ccc(C)c(NC(=O)[C@H](C)n2cc([N+](=O)[O-])c(C)n2)c1	ZINC000450962339	EE	On-Demand	Bother	MAPK14	15	40
NC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450962346	ED	On-Demand	Anodyne	EPHX2	36	49
CCCN(CCC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962370	FE	On-Demand	Anodyne	BMP1	26	44
CCCN(CCC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962370	FE	On-Demand	Anodyne	MMP13	42	41
CCCN(CCC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962370	FE	On-Demand	Anodyne	MMP3	33	45
CCCN(CCC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962370	FE	On-Demand	Anodyne	MMP8	27	40
CCCN(CCC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962370	FE	On-Demand	Anodyne	PLA2G4B	44	34
CCCN(CCC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962370	FE	On-Demand	Anodyne	MMP12	17	40
CCCN(CCC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962370	FE	On-Demand	Anodyne	MMP1	30	41
CCCCc1ccc(C(=O)Cn2cc([N+](=O)[O-])c(C)n2)cc1	ZINC000450962408	DG	On-Demand	Bother	THRA	22	42
CCCCc1ccc(C(=O)Cn2cc([N+](=O)[O-])c(C)n2)cc1	ZINC000450962408	DG	On-Demand	Bother	PLM2_PLAFA	43	33
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc2cccnc2s1	ZINC000450962411	FG	On-Demand	Anodyne	HTR4	44	34
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc2cccnc2s1	ZINC000450962411	FG	On-Demand	Anodyne	CACNA1I	60	38
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc2cccnc2s1	ZINC000450962411	FG	On-Demand	Anodyne	SIRT3	43	35
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc2cccnc2s1	ZINC000450962411	FG	On-Demand	Anodyne	SIRT2	46	35
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc2cccnc2s1	ZINC000450962411	FG	On-Demand	Anodyne	SIRT1	43	35
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc2cccnc2s1	ZINC000450962411	FG	On-Demand	Anodyne	HPGDS	35	40
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	CA2	31	50
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	ADRB2	36	47
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	ADRB1	25	47
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	ADRB3	43	47
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	CA1	36	49
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	KCNA5	25	42
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	CA7	19	44
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	MMP13	31	41
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	HTR6	0	47
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	CA4	31	49
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	CA14	17	44
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	MMP2	26	41
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	CA12	21	50
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	CA9	23	50
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	POL	0	41
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	IDO1	38	40
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	PFK	0	48
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	LIMK2	53	45
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	UQCRB	0	42
CCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450962413	EH	On-Demand	Anodyne	NAMPT	21	42
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl)C1CCN(CC(F)(F)F)CC1	ZINC000450962416	GI	On-Demand	Anodyne	PYGM	32	40
COc1cc(CC(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)ccc1O	ZINC000450962417	FF	On-Demand	Anodyne	TRPV1	26	44
COc1cc(CC(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)ccc1O	ZINC000450962424	FF	On-Demand	Anodyne	TRPV1	26	44
O=C(c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)N1CCCN(C(=O)C2CC2)CC1	ZINC000450962426	GD	On-Demand	Bother	L3MBTL1	0	43
O=C(c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)N1CCCN(C(=O)C2CC2)CC1	ZINC000450962426	GD	On-Demand	Bother	L3MBTL3	53	43
CCOC(=O)C1(CNC(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000450962427	DF	On-Demand	Anodyne	HCN1	51	33
CCOC(=O)C1(CNC(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000450962427	DF	On-Demand	Anodyne	HCN4	48	33
CC(=O)N[C@H](C(=O)N(C)CC1(c2ccccc2)CC1)C(C)(C)C	ZINC000450962428	DF	On-Demand	Anodyne	ICMT	42	33
Cc1ccc(CC(=O)N2CCCN(C(=O)C3CC3)CC2)c(Br)c1	ZINC000450962448	GF	On-Demand	Anodyne	PREP	46	34
CCOC(=O)C1(CNC(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450962450	DG	On-Demand	Anodyne	HCN4	41	33
CN(CCN1CCC[C@@](O)(C(N)=O)C1)Cc1ccccc1	ZINC000450962457	CC	On-Demand	Anodyne	SIGMAR1	25	48
CN(CCN1CCC[C@@](O)(C(N)=O)C1)Cc1ccccc1	ZINC000450962457	CC	On-Demand	Anodyne	NPFFR1	40	35
CN(CCN1CCC[C@@](O)(C(N)=O)C1)Cc1ccccc1	ZINC000450962457	CC	On-Demand	Anodyne	SLC12A5	68	36
Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)n(C)n1	ZINC000450962458	GD	On-Demand	Anodyne	MTNN	51	33
Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)n(C)n1	ZINC000450962458	GD	On-Demand	Anodyne	PFK	0	52
CN(CCN1CCC[C@](O)(C(N)=O)C1)Cc1ccccc1	ZINC000450962459	CC	On-Demand	Anodyne	SIGMAR1	25	48
CN(CCN1CCC[C@](O)(C(N)=O)C1)Cc1ccccc1	ZINC000450962459	CC	On-Demand	Anodyne	NPFFR1	40	35
CN(CCN1CCC[C@](O)(C(N)=O)C1)Cc1ccccc1	ZINC000450962459	CC	On-Demand	Anodyne	SLC12A5	68	36
C[C@@H](O)CCS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450962476	CD	On-Demand	Anodyne	AKR1C3	28	51
C[C@H](O)CCS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450962481	CD	On-Demand	Anodyne	AKR1C3	28	51
CC(C)(CC(=O)CS(=O)(=O)c1ccc(N2CCCC2=O)cc1)C1CC1	ZINC000450962483	FF	On-Demand	Anodyne	AKR1C3	31	51
c1cc2c(cc1-c1nc(CC[C@@H]3CCCCO3)cs1)OCCO2	ZINC000450962492	EI	On-Demand	Anodyne	CLK4	20	42
c1cc2c(cc1-c1nc(CC[C@H]3CCCCO3)cs1)OCCO2	ZINC000450962494	EI	On-Demand	Anodyne	CLK4	20	42
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccsc1Br	ZINC000450962498	GH	On-Demand	Anodyne	HTR4	51	39
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccsc1Br	ZINC000450962498	GH	On-Demand	Anodyne	CACNA1I	71	40
CCOc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962514	GF	On-Demand	Anodyne	KCNA5	0	40
CCOc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962514	GF	On-Demand	Anodyne	PRTN3	64	41
CCOc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962514	GF	On-Demand	Anodyne	LUXN	0	50
CCOc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962514	GF	On-Demand	Anodyne	ADIPOR1	0	45
CCOc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450962514	GF	On-Demand	Anodyne	ADIPOR2	0	45
CCn1nccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450962515	GD	On-Demand	Anodyne	MTNN	42	36
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450962525	FG	On-Demand	Anodyne	F2	17	45
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450962525	FG	On-Demand	Anodyne	FKBP1A	15	40
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450962525	FG	On-Demand	Anodyne	F10	21	40
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450962525	FG	On-Demand	Anodyne	CHRM5	22	45
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450962525	FG	On-Demand	Anodyne	EPHX2	39	45
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450962525	FG	On-Demand	Anodyne	MMP7	23	41
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450962525	FG	On-Demand	Anodyne	AKR1C3	15	43
COC(=O)[C@@H](NS(=O)(=O)c1cccc2c(Cl)ccnc12)C(C)C	ZINC000450962545	FE	On-Demand	Anodyne	ADAMTS4	49	37
CO[C@@H](CS(=O)(=O)Nc1ccc(CS(N)(=O)=O)cc1)c1ccccc1	ZINC000450962550	GD	On-Demand	Anodyne	PTPRB	47	36
CO[C@H](CS(=O)(=O)Nc1ccc(CS(N)(=O)=O)cc1)c1ccccc1	ZINC000450962551	GD	On-Demand	Anodyne	PTPRB	47	36
CC(C)(C)NC(=O)N1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450962564	GG	On-Demand	Anodyne	CACNA1H	42	32
CC(C)(C)NC(=O)N1CCN(C(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450962565	GF	On-Demand	Anodyne	CTSS	16	40
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450962583	GF	On-Demand	Anodyne	DRD4	44	34
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450962583	GF	On-Demand	Anodyne	CHRNA7	20	42
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450962583	GF	On-Demand	Anodyne	PLD1	41	37
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450962583	GF	On-Demand	Anodyne	PLD2	63	39
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450962583	GF	On-Demand	Anodyne	PFG6PD	0	41
Cc1csc(S(=O)(=O)Nc2cccc(Cl)c2N2CCOCC2)c1	ZINC000450962590	FG	On-Demand	Anodyne	CREBBP	37	41
Cc1csc(S(=O)(=O)Nc2cccc(Cl)c2N2CCOCC2)c1	ZINC000450962590	FG	On-Demand	Anodyne	BRD9	37	41
COc1cc2c(cc1OC)CN(S(=O)(=O)c1sccc1Cl)CC2	ZINC000450962593	FG	On-Demand	Anodyne	AKR1C3	53	39
O=C(c1ccc(NS(=O)(=O)c2sccc2Cl)cc1)N1CCCC1	ZINC000450962598	FG	On-Demand	Anodyne	L3MBTL3	58	37
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	BMP1	119	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP13	74	44
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	ADAM17	53	44
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP16	0	42
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP2	43	46
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP3	51	49
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP8	48	46
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP14	16	42
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP9	76	46
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP12	34	42
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP7	24	42
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	CA9	20	40
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1	ZINC000450962605	FD	On-Demand	Anodyne	MMP1	75	46
CCCOc1ccc(C(=O)Nc2ccc(F)c(OC)c2)c(OC)c1	ZINC000450962621	EH	On-Demand	Anodyne	GRM4	21	52
CCCOc1ccc(C(=O)Nc2ccc(F)c(OC)c2)c(OC)c1	ZINC000450962621	EH	On-Demand	Anodyne	FAAH	16	41
CCCOc1ccc(C(=O)Nc2ccc(F)c(OC)c2)c(OC)c1	ZINC000450962621	EH	On-Demand	Anodyne	MET	26	49
CCCOc1ccc(C(=O)Nc2ccc(F)c(OC)c2)c(OC)c1	ZINC000450962621	EH	On-Demand	Anodyne	ENPP1	67	32
CCCOc1ccc(C(=O)Nc2ccc(F)c(OC)c2)c(OC)c1	ZINC000450962621	EH	On-Demand	Anodyne	KCNK3	57	45
CCCOc1ccc(C(=O)Nc2ccc(F)c(OC)c2)c(OC)c1	ZINC000450962621	EH	On-Demand	Anodyne	KCNK9	56	45
COC(=O)COc1ccc(CN(C)C(=O)[C@H](C)Oc2ccccn2)cc1	ZINC000450962622	FE	On-Demand	Anodyne	ADAMTS4	15	40
COC(=O)COc1ccc(CN(C)C(=O)[C@@H](C)Oc2ccccn2)cc1	ZINC000450962623	FE	On-Demand	Anodyne	ADAMTS4	15	40
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962632	ED	On-Demand	Anodyne	FKBP1A	43	45
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962632	ED	On-Demand	Anodyne	GHRHR	40	31
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962632	ED	On-Demand	Anodyne	SIGMAR1	28	41
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962632	ED	On-Demand	Anodyne	PREP	52	42
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962632	ED	On-Demand	Anodyne	CYP2J2	46	36
CC(=O)[C@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962632	ED	On-Demand	Anodyne	BIRC2	56	48
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962633	ED	On-Demand	Anodyne	FKBP1A	43	45
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962633	ED	On-Demand	Anodyne	GHRHR	40	31
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962633	ED	On-Demand	Anodyne	SIGMAR1	28	41
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962633	ED	On-Demand	Anodyne	PREP	52	42
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962633	ED	On-Demand	Anodyne	CYP2J2	46	36
CC(=O)[C@@](C)(O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962633	ED	On-Demand	Anodyne	BIRC2	56	48
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962634	ED	On-Demand	Anodyne	FKBP1A	43	45
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962634	ED	On-Demand	Anodyne	GHRHR	40	31
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962634	ED	On-Demand	Anodyne	SIGMAR1	28	41
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962634	ED	On-Demand	Anodyne	PREP	52	42
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962634	ED	On-Demand	Anodyne	CYP2J2	46	36
CC(=O)[C@@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962634	ED	On-Demand	Anodyne	BIRC2	56	48
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962635	ED	On-Demand	Anodyne	FKBP1A	43	45
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962635	ED	On-Demand	Anodyne	GHRHR	40	31
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962635	ED	On-Demand	Anodyne	SIGMAR1	28	41
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962635	ED	On-Demand	Anodyne	PREP	52	42
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962635	ED	On-Demand	Anodyne	CYP2J2	46	36
CC(=O)[C@](C)(O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450962635	ED	On-Demand	Anodyne	BIRC2	56	48
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	TBXA2R	46	33
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	MMP13	15	44
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	NPY2R	49	41
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	PTPN12	0	45
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	MMP14	17	41
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	NPY5R	17	41
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	PTPN13	0	45
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	PTPN22	22	45
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	ADAMTS4	43	44
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	ADAMTS5	15	40
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	TRAR	29	40
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	LUXN	0	42
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	DUSP23	0	45
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	DUSP15	0	45
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	ADIPOR1	0	47
O=C(COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1)NC1CC1	ZINC000450962646	GE	On-Demand	Anodyne	ADIPOR2	0	47
Cc1cc(F)ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450962675	DH	On-Demand	Anodyne	FFAR4	30	44
Cc1cc(F)ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450962675	DH	On-Demand	Anodyne	PIK3C3	45	32
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(F)c2)s1	ZINC000450962676	FF	On-Demand	Anodyne	SCD1	25	49
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(F)c2)s1	ZINC000450962677	FF	On-Demand	Anodyne	SCD1	25	49
Cc1cc2c(N3CCN(C(=O)CCCC(=O)C(C)(C)C)CC3)ncnc2s1	ZINC000450962687	GG	On-Demand	Anodyne	P2RY12	15	48
Cc1cc2c(N3CCN(C(=O)CCCC(=O)C(C)(C)C)CC3)ncnc2s1	ZINC000450962687	GG	On-Demand	Anodyne	SIRT3	60	35
Cc1cc2c(N3CCN(C(=O)CCCC(=O)C(C)(C)C)CC3)ncnc2s1	ZINC000450962687	GG	On-Demand	Anodyne	SIRT2	44	35
COCc1nn(C)cc1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450962688	GD	On-Demand	Anodyne	PDGFRB	57	36
CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450962697	FG	On-Demand	Anodyne	PRTN3	64	45
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	CA2	40	56
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	ADRB2	54	56
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	ADRB1	32	56
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	ADRB3	72	56
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	CA1	47	48
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	CA7	19	49
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	MMP13	31	40
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	CA4	39	48
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	CA14	21	49
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	MMP2	26	40
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	PTPRB	48	36
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	CA12	28	45
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	CA9	33	45
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	LEF	25	40
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	PFK	0	46
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	LIMK2	53	50
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	P96878_MYCTU	43	39
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	NAMPT	16	40
CCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450962698	EH	On-Demand	Anodyne	MGAT1	43	30
CCOC(=O)[C@@H](NC(=O)c1ccc(C(C)(F)F)nc1)c1cccc(C)c1C	ZINC000450962702	GH	On-Demand	Anodyne	P4HTM	0	40
CCOC(=O)[C@H](NC(=O)c1ccc(C(C)(F)F)nc1)c1cccc(C)c1C	ZINC000450962703	GH	On-Demand	Anodyne	P4HTM	0	40
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	BMP1	55	41
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	CA1	15	48
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	KCNA5	30	40
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP13	86	48
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	NPY2R	44	41
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	ADAM17	46	42
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP2	54	48
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP3	70	45
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP8	42	48
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP14	27	48
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	NPY5R	17	41
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP9	65	48
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP12	31	48
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP10	23	41
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP7	58	41
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	IAP	0	41
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	ADAMTS4	46	34
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	CA9	23	45
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	MMP1	71	40
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	LUXN	0	45
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	ADIPOR1	0	43
COc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450962722	GD	On-Demand	Anodyne	ADIPOR2	0	43
Cc1cc2c(N3CCN(C(=O)CCCC(C)C)CC3)ncnc2s1	ZINC000450962724	EG	On-Demand	Anodyne	SIRT3	48	30
Cc1cc2c(N3CCN(C(=O)CCCC(C)C)CC3)ncnc2s1	ZINC000450962724	EG	On-Demand	Anodyne	SIRT2	41	31
COc1cccc(F)c1-c1nc(-c2cc3c(s2)CCN(C(C)=O)C3)cs1	ZINC000450962726	GJ	On-Demand	Anodyne	GABRA3	42	37
C[C@@H](O)CN1CCN(C(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450962733	CC	On-Demand	Anodyne	OPRK1	0	42
C[C@@H](O)CN1CCN(C(=O)Cc2ccc(O)c(F)c2)CC1	ZINC000450962733	CC	On-Demand	Anodyne	KCNJ1	47	36
COc1cc(CC(=O)NC(C)(C)CF)ccc1Cl	ZINC000450962745	CF	On-Demand	Anodyne	TRPV1	34	45
COc1cc(CC(=O)NC(C)(C)CF)ccc1Cl	ZINC000450962745	CF	On-Demand	Anodyne	NCE103	29	47
COc1cc(CC(=O)NC(C)(C)CF)ccc1Cl	ZINC000450962745	CF	On-Demand	Anodyne	CAN2	0	47
Cn1cc(CCNC(=O)CS(=O)(=O)C2CC2)c2ccc(F)cc21	ZINC000450962759	ED	On-Demand	Anodyne	NQO2	17	41
Cc1cc(OCCC(C)(F)F)c(Cl)cc1[N+](=O)[O-]	ZINC000450962761	CH	On-Demand	Bother	S1PR4	20	47
COc1ccc(CNC(=O)CCSc2ncccc2C)c(OC)c1	ZINC000450962769	EG	On-Demand	Anodyne	MTNR1A	45	39
CCOC(=O)c1ccc(CS(=O)(=O)N2CCC[C@H](C(=O)OCC)C2)cc1	ZINC000450962776	GD	On-Demand	Anodyne	Q4Q5W4_LEIMA	19	41
CO[C@@H](Cc1ccccc1)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450962778	DG	On-Demand	Anodyne	KCNA3	37	44
CCOC(=O)c1ccc(CS(=O)(=O)N2CCC[C@@H](C(=O)OCC)C2)cc1	ZINC000450962779	GD	On-Demand	Anodyne	Q4Q5W4_LEIMA	19	41
CO[C@H](Cc1ccccc1)C(=O)N(C)CC1(c2ccccc2)CC1	ZINC000450962781	DG	On-Demand	Anodyne	KCNA3	37	44
CCCOc1ccc(C(=O)Nc2cnns2)c(OC)c1	ZINC000450962783	CF	On-Demand	Anodyne	LUCI_LUCLA	18	48
COc1cccc2c1nc(NC(=O)[C@H](O)C1CCC1)n2C	ZINC000450962805	CD	On-Demand	Anodyne	HTR3A	19	42
COc1cccc2c1nc(NC(=O)[C@@H](O)C1CCC1)n2C	ZINC000450962806	CD	On-Demand	Anodyne	HTR3A	19	42
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	HTR1A	19	41
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	HTR1D	29	41
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	HTR1B	25	41
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	PTGER1	24	41
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	NPY2R	21	40
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	FAAH	26	41
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	MCHR1	21	40
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	MGLL	0	41
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450962813	GF	On-Demand	Anodyne	P2RY14	41	31
CC(=O)CCCCCOc1cc(Cl)cc(C#N)c1	ZINC000450962823	CH	On-Demand	Mild	PLA2G4B	54	31
Cc1cc(C(=O)Nc2cnns2)nn1C(C)C	ZINC000450962845	CD	On-Demand	Anodyne	AHK3	0	41
N#CCc1ccc(S(=O)(=O)NC2CCCCCC2)c(Cl)c1	ZINC000450962849	EG	On-Demand	Mild	BRD4	18	40
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	DRD2	22	47
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	DRD4	40	41
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	ACHE	46	47
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	DRD3	30	47
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	CHRM3	24	49
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	LTA4H	16	41
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	SIGMAR1	73	51
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	BCHE	21	41
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	CCR3	30	46
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	MCHR1	25	41
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	CACNA1G	15	43
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	SFRP1	46	35
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	ADIPOR1	0	40
O=S(=O)(CCC1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000450962852	FG	On-Demand	Anodyne	ADIPOR2	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	CA2	30	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	ADRB2	24	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	ADRB1	27	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	ADRB3	26	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MME	27	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	TBXA2R	51	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	TBXAS1	42	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	SDH1	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	BMP1	23	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	CA1	44	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	KCNA5	22	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	CA7	23	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	CA5B	52	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	CA4	34	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	CA5A	55	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	CA14	17	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MTNR1A	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MTNR1B	29	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MMP2	48	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MMP3	64	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MMP8	31	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MMP14	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	ALOX15	57	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MMP9	31	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	CA12	22	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	TPSAB1	18	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	ADAMTS4	57	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	MMP1	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	AMP1_PLAFQ	28	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	NCE103	23	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1	ZINC000450962855	FG	On-Demand	Anodyne	LIMK2	50	39
CCS(=O)(=O)c1ccc(CN[C@@H]2CC(=O)N(C3CC3)[C@H]2c2cccnc2)cc1	ZINC000450962863	GE	On-Demand	Anodyne	NAMPT	46	34
CCC(CC)Oc1ccc(C(=O)N2CCN(C[C@@H](C)O)CC2)cc1	ZINC000450962873	EE	On-Demand	Anodyne	HRH3	15	49
CCC(CC)Oc1ccc(C(=O)N2CCN(C[C@@H](C)O)CC2)cc1	ZINC000450962873	EE	On-Demand	Anodyne	ABCB1	18	41
CCCOc1cccc(CNC(=O)CN2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c1	ZINC000450962886	GG	On-Demand	Anodyne	HRH2	28	40
CCCOc1cccc(CNC(=O)CN2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c1	ZINC000450962887	GG	On-Demand	Anodyne	HRH2	28	40
CCCOc1cccc(CNC(=O)CN2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c1	ZINC000450962888	GG	On-Demand	Anodyne	HRH2	28	40
CCCOc1cccc(CNC(=O)CN2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c1	ZINC000450962889	GG	On-Demand	Anodyne	HRH2	28	40
CCOC(=O)[C@@H](NC(=O)c1ccc(N2CCC2)nc1)c1cccc(C)c1C	ZINC000450962894	FF	On-Demand	Anodyne	HPGDS	23	40
CCOC(=O)[C@H](NC(=O)c1ccc(N2CCC2)nc1)c1cccc(C)c1C	ZINC000450962895	FF	On-Demand	Anodyne	HPGDS	23	40
COc1ccc(S(=O)(=O)CC2=CCCCC2)cc1	ZINC000450962896	CF	On-Demand	Anodyne	MMP2	17	40
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	ADRB3	32	40
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	KCNA5	0	45
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MMP13	25	41
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	HTR6	18	42
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	CA4	16	42
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MTNR1A	32	40
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MTNR1B	31	41
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MMP2	21	41
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MMP14	15	41
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MMP9	19	41
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MMP12	21	41
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MMP7	16	44
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	ALPL	32	44
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	MTNN	80	37
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	POL	0	44
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	FFAR4	30	43
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	GPR119	17	48
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	LIMK2	42	37
COc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450962897	GE	On-Demand	Anodyne	UQCRB	0	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	HTR1A	94	48
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	DRD2	70	47
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	DRD4	33	41
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	ADRA1D	86	44
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	HTR2A	34	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	ADRA1A	73	44
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	ADRA1B	67	44
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	DRD3	66	44
COc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450962898	GF	On-Demand	Anodyne	HTR7	54	41
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	HTR1A	94	48
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	DRD2	70	47
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	DRD4	33	41
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	ADRA1D	86	44
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	HTR2A	34	43
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	ADRA1A	73	44
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	ADRA1B	67	44
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	DRD3	66	44
COc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450962900	GF	On-Demand	Anodyne	HTR7	54	41
COc1cccc(OCCC(=O)N[C@@H](CO)c2ccsc2)c1	ZINC000450962908	DE	On-Demand	Anodyne	MTNR1B	29	42
COc1cccc(OCCC(=O)N[C@@H](CO)c2ccsc2)c1	ZINC000450962908	DE	On-Demand	Anodyne	GPR88	0	40
COc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450962909	FF	On-Demand	Anodyne	DRD1	36	42
COc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450962909	FF	On-Demand	Anodyne	ADRA1A	51	39
COc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450962909	FF	On-Demand	Anodyne	DRD3	22	50
COc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450962909	FF	On-Demand	Anodyne	HTR6	0	46
COc1cccc(OCCC(=O)N[C@H](CO)c2ccsc2)c1	ZINC000450962910	DE	On-Demand	Anodyne	MTNR1B	29	42
COc1cccc(OCCC(=O)N[C@H](CO)c2ccsc2)c1	ZINC000450962910	DE	On-Demand	Anodyne	GPR88	0	40
N#CCc1ccc(S(=O)(=O)N2CCCCCC2)c(Cl)c1	ZINC000450962916	DF	On-Demand	Mild	TRPV4	45	36
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCCCC2)c1	ZINC000450962924	EF	On-Demand	Anodyne	CNR2	0	48
CC(=O)CCCCCn1c(C)nn(C(C)C)c1=O	ZINC000450962931	CE	On-Demand	Anodyne	PAOX	41	38
CC(C)n1ncc2cc(Cn3nnc(-c4ccco4)n3)cnc21	ZINC000450962933	DE	On-Demand	Anodyne	ADORA2A	56	35
COC(=O)[C@@H](NC(=O)CC1(O)CCC1)c1ccc(OC)c(O)c1	ZINC000450962943	DD	On-Demand	Anodyne	FOLH1	35	41
COC(=O)[C@H](NC(=O)CC1(O)CCC1)c1ccc(OC)c(O)c1	ZINC000450962944	DD	On-Demand	Anodyne	FOLH1	35	41
Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)no1	ZINC000450962953	FD	On-Demand	Anodyne	PPIA	25	54
Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)no1	ZINC000450962953	FD	On-Demand	Anodyne	DYR_PNECA	0	66
Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)no1	ZINC000450962953	FD	On-Demand	Anodyne	MTNN	60	38
Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)no1	ZINC000450962953	FD	On-Demand	Anodyne	PFK	0	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncc(C(C)C)s2)cc1	ZINC000450962956	FH	On-Demand	Anodyne	PPIA	24	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncc(C(C)C)s2)cc1	ZINC000450962956	FH	On-Demand	Anodyne	CA4	29	45
C[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1C(=O)N1CCOCC1	ZINC000450962974	FF	On-Demand	Anodyne	MC4R	49	38
C[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1C(=O)N1CCOCC1	ZINC000450962974	FF	On-Demand	Anodyne	P2RX7	34	48
C[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1C(=O)N1CCOCC1	ZINC000450962974	FF	On-Demand	Anodyne	MC5R	50	33
C[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1C(=O)N1CCOCC1	ZINC000450962974	FF	On-Demand	Anodyne	EPHX2	28	43
C[C@@H]1CN(Cc2ccc(Cl)cc2Cl)C[C@H]1C(=O)N1CCOCC1	ZINC000450962974	FF	On-Demand	Anodyne	AKR1C3	0	44
COc1ccc2c(c1)nc(CNC(=O)[C@]1(C)CCC[C@@H]1C)n2C	ZINC000450962977	DG	On-Demand	Anodyne	NPBWR1	52	30
COc1ccc2c(c1)nc(CNC(=O)[C@]1(C)CCC[C@H]1C)n2C	ZINC000450962981	DG	On-Demand	Anodyne	NPBWR1	52	30
CC(C)Cn1cc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c(C(F)F)n1	ZINC000450962982	GG	On-Demand	Anodyne	HTR4	50	47
CC(C)Cn1cc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c(C(F)F)n1	ZINC000450962982	GG	On-Demand	Anodyne	CACNA1I	68	41
COc1ccc2c(c1)nc(CNC(=O)[C@@]1(C)CCC[C@@H]1C)n2C	ZINC000450962983	DG	On-Demand	Anodyne	NPBWR1	52	30
COc1ccc2c(c1)nc(CNC(=O)[C@@]1(C)CCC[C@H]1C)n2C	ZINC000450962984	DG	On-Demand	Anodyne	NPBWR1	52	30
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000450962989	GJ	On-Demand	Anodyne	PRCP	19	52
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000450962989	GJ	On-Demand	Anodyne	CPT1A	69	38
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000450962989	GJ	On-Demand	Anodyne	SFRP1	78	38
CC(F)(F)c1ccc(C(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000450962989	GJ	On-Demand	Anodyne	WNT3	60	33
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000450962990	GJ	On-Demand	Anodyne	PRCP	19	52
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000450962990	GJ	On-Demand	Anodyne	CPT1A	69	38
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000450962990	GJ	On-Demand	Anodyne	SFRP1	78	38
CC(F)(F)c1ccc(C(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000450962990	GJ	On-Demand	Anodyne	WNT3	60	33
CCN1CCN(c2cccc(NC(=O)c3ccc(C)nc3C(C)C)c2)CC1	ZINC000450963001	FH	On-Demand	Anodyne	HTR1D	41	44
CCN1CCN(c2cccc(NC(=O)c3ccc(C)nc3C(C)C)c2)CC1	ZINC000450963001	FH	On-Demand	Anodyne	HTR1B	36	44
CCN1CCN(c2cccc(NC(=O)c3ccc(C)nc3C(C)C)c2)CC1	ZINC000450963001	FH	On-Demand	Anodyne	PRNP	50	42
CCN1CCN(c2cccc(NC(=O)c3ccc(C)nc3C(C)C)c2)CC1	ZINC000450963001	FH	On-Demand	Anodyne	KCNK3	40	34
CCN1CCN(c2cccc(NC(=O)c3ccc(C)nc3C(C)C)c2)CC1	ZINC000450963001	FH	On-Demand	Anodyne	KCNK9	48	34
O=S(=O)(c1ccc(Cl)cc1I)N1CCOCC1	ZINC000450963010	GD	On-Demand	Anodyne	CNR2	0	44
O=S(=O)(c1ccc(Cl)cc1I)N1CCOCC1	ZINC000450963010	GD	On-Demand	Anodyne	AKR1C3	15	43
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	BMP1	53	38
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	MMP13	19	42
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	COLA	61	39
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	CA5B	21	46
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	CA5A	24	46
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	MMP8	43	39
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	MMP9	22	41
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	MMP12	42	39
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963011	FF	On-Demand	Anodyne	MMP1	23	41
CCn1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963013	FD	On-Demand	Anodyne	LUXN	0	44
CCn1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963013	FD	On-Demand	Anodyne	ADIPOR1	0	40
CCn1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963013	FD	On-Demand	Anodyne	ADIPOR2	0	40
COc1ccc(C(=O)NC(C)(C)c2cccc(Cl)c2F)cc1S(C)(=O)=O	ZINC000450963021	GH	On-Demand	Anodyne	COLA	60	39
COc1ccc(C(=O)NC(C)(C)c2cccc(Cl)c2F)cc1S(C)(=O)=O	ZINC000450963021	GH	On-Demand	Anodyne	CPT1A	58	39
COc1ccc(C(=O)NC(C)(C)c2cccc(Cl)c2F)cc1S(C)(=O)=O	ZINC000450963021	GH	On-Demand	Anodyne	CPT2	45	35
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450963023	GH	On-Demand	Anodyne	SDH1	0	42
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450963023	GH	On-Demand	Anodyne	TIMP3	79	35
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450963024	GH	On-Demand	Anodyne	SDH1	0	42
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)C1(C(F)(F)F)CCC1	ZINC000450963024	GH	On-Demand	Anodyne	TIMP3	79	35
Cc1ccc2cc(S(=O)(=O)NCCCN(C)C)ccc2c1	ZINC000450963026	DE	On-Demand	Anodyne	ADORA1	23	40
Cc1ccc2cc(S(=O)(=O)NCCCN(C)C)ccc2c1	ZINC000450963026	DE	On-Demand	Anodyne	NPY1R	0	45
CCCn1ccc2cc(NS(=O)(=O)c3cn(C)nc3C(F)(F)F)ccc21	ZINC000450963037	GH	On-Demand	Anodyne	NR1I2	55	39
CCCn1ccc2cc(NS(=O)(=O)c3cn(C)nc3C(F)(F)F)ccc21	ZINC000450963037	GH	On-Demand	Anodyne	RORC	37	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963040	DH	On-Demand	Anodyne	OPRM1	20	48
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963040	DH	On-Demand	Anodyne	OPRD1	16	48
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963040	DH	On-Demand	Anodyne	LTA4H	30	40
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963040	DH	On-Demand	Anodyne	HRH3	61	43
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963040	DH	On-Demand	Anodyne	CHRNA10	44	40
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963042	DH	On-Demand	Anodyne	OPRM1	20	48
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963042	DH	On-Demand	Anodyne	OPRD1	16	48
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963042	DH	On-Demand	Anodyne	LTA4H	30	40
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963042	DH	On-Demand	Anodyne	HRH3	61	43
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963042	DH	On-Demand	Anodyne	CHRNA10	44	40
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963044	DH	On-Demand	Anodyne	OPRM1	20	48
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963044	DH	On-Demand	Anodyne	OPRD1	16	48
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963044	DH	On-Demand	Anodyne	LTA4H	30	40
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963044	DH	On-Demand	Anodyne	HRH3	61	43
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCCOc1ccccc1	ZINC000450963044	DH	On-Demand	Anodyne	CHRNA10	44	40
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963045	DH	On-Demand	Anodyne	OPRM1	20	48
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963045	DH	On-Demand	Anodyne	OPRD1	16	48
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963045	DH	On-Demand	Anodyne	LTA4H	30	40
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963045	DH	On-Demand	Anodyne	HRH3	61	43
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCCOc1ccccc1	ZINC000450963045	DH	On-Demand	Anodyne	CHRNA10	44	40
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450963053	EH	On-Demand	Anodyne	ABCB1	0	41
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450963053	EH	On-Demand	Anodyne	HCN1	69	36
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450963053	EH	On-Demand	Anodyne	HCN4	54	36
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450963054	EH	On-Demand	Anodyne	ABCB1	0	41
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450963054	EH	On-Demand	Anodyne	HCN1	69	36
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450963054	EH	On-Demand	Anodyne	HCN4	54	36
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450963055	EH	On-Demand	Anodyne	ABCB1	0	41
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450963055	EH	On-Demand	Anodyne	HCN1	69	36
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450963055	EH	On-Demand	Anodyne	HCN4	54	36
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450963056	EH	On-Demand	Anodyne	ABCB1	0	41
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450963056	EH	On-Demand	Anodyne	HCN1	69	36
CC(=O)c1ccccc1OCCN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450963056	EH	On-Demand	Anodyne	HCN4	54	36
Cc1ccc(F)c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450963058	GF	On-Demand	Anodyne	PRTN3	55	33
Cc1ccc(F)c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450963058	GF	On-Demand	Anodyne	CCR2	15	40
Cc1ccc(F)c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450963058	GF	On-Demand	Anodyne	LUXN	0	44
CC(C)OC(C)(C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450963063	DF	On-Demand	Anodyne	CACNA1I	59	39
C[C@@H]1Cc2cccc(C(=O)N[C@H](C)c3ccc(Cl)cn3)c2O1	ZINC000450963083	DH	On-Demand	Anodyne	G2YM83_BOTF4	46	34
C[C@H](NC(=O)c1cccc2c1O[C@H](C)C2)c1ccc(Cl)cn1	ZINC000450963084	DH	On-Demand	Anodyne	G2YM83_BOTF4	46	34
C[C@H]1Cc2cccc(C(=O)N[C@@H](C)c3ccc(Cl)cn3)c2O1	ZINC000450963085	DH	On-Demand	Anodyne	G2YM83_BOTF4	46	34
C[C@H]1Cc2cccc(C(=O)N[C@H](C)c3ccc(Cl)cn3)c2O1	ZINC000450963086	DH	On-Demand	Anodyne	G2YM83_BOTF4	46	34
COc1cc(Br)c(C(=O)N[C@@H](C)c2ccc(Cl)cn2)cc1OC	ZINC000450963087	GI	On-Demand	Anodyne	F10	53	35
Cc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450963088	EF	On-Demand	Anodyne	CA2	23	45
Cc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450963088	EF	On-Demand	Anodyne	PPIA	26	44
Cc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450963088	EF	On-Demand	Anodyne	CA1	26	43
Cc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450963088	EF	On-Demand	Anodyne	CA4	36	45
Cc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450963088	EF	On-Demand	Anodyne	LEF	29	42
Cc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450963088	EF	On-Demand	Anodyne	PFK	0	40
Cc1ccccc1NC(=O)Cc1nc(C2CCCCC2)c(C)s1	ZINC000450963091	EJ	On-Demand	Anodyne	CDK5	45	41
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccccc1	ZINC000450963092	FD	On-Demand	Anodyne	LTA4H	22	41
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccccc1	ZINC000450963092	FD	On-Demand	Anodyne	MMP3	21	40
COc1cccc(F)c1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450963093	CF	On-Demand	Anodyne	KCNK3	43	40
COc1cccc(F)c1NC(=O)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450963093	CF	On-Demand	Anodyne	KCNK9	42	40
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCOCC2)c1	ZINC000450963099	FE	On-Demand	Anodyne	LPL	39	40
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCOCC2)c1	ZINC000450963099	FE	On-Demand	Anodyne	LIPG	15	40
C[C@@H]1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)C1	ZINC000450963100	GG	On-Demand	Anodyne	ESR1	28	41
C[C@@H]1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)C1	ZINC000450963100	GG	On-Demand	Anodyne	HTR6	16	43
C[C@@H]1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)C1	ZINC000450963100	GG	On-Demand	Anodyne	EBP	16	46
CSc1cccc(C)c1NC(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC000450963101	EI	On-Demand	Anodyne	ACAT	0	40
C[C@H]1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)C1	ZINC000450963102	GG	On-Demand	Anodyne	ESR1	28	41
C[C@H]1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)C1	ZINC000450963102	GG	On-Demand	Anodyne	HTR6	16	43
C[C@H]1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)C1	ZINC000450963102	GG	On-Demand	Anodyne	EBP	16	46
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NC3CC3)cc2)c1	ZINC000450963103	EF	On-Demand	Anodyne	MAPK14	34	40
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NC3CC3)cc2)c1	ZINC000450963103	EF	On-Demand	Anodyne	MAPK13	48	32
CSc1cccc(C)c1NC(=O)[C@H](C)OCc1ccc(F)cc1	ZINC000450963104	EI	On-Demand	Anodyne	ACAT	0	40
CCOC(=O)C1CCN(S(=O)(=O)c2cc(C)cs2)CC1	ZINC000450963106	DE	On-Demand	Anodyne	EPHX2	36	40
N#C[C@@]1(NC(=O)c2cc3c(Br)cccc3cn2)CCOC1	ZINC000450963112	EE	On-Demand	Mild	TSPO	0	49
N#C[C@]1(NC(=O)c2cc3c(Br)cccc3cn2)CCOC1	ZINC000450963113	EE	On-Demand	Mild	TSPO	0	49
CCOC(=O)c1cc(S(=O)(=O)NCc2ccccc2F)cnc1C(F)F	ZINC000450963114	GF	On-Demand	Anodyne	LEF	41	34
O=C1CCC(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450963124	FG	On-Demand	Anodyne	CHRM1	15	41
O=C1CCC(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450963124	FG	On-Demand	Anodyne	SIGMAR1	32	40
O=C1CCC(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450963124	FG	On-Demand	Anodyne	PREP	53	41
O=C1CCC(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450963124	FG	On-Demand	Anodyne	BIRC2	51	42
O=C1CCC(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450963125	FG	On-Demand	Anodyne	CHRM1	15	41
O=C1CCC(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450963125	FG	On-Demand	Anodyne	SIGMAR1	32	40
O=C1CCC(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450963125	FG	On-Demand	Anodyne	PREP	53	41
O=C1CCC(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450963125	FG	On-Demand	Anodyne	BIRC2	51	42
COc1cc(NS(=O)(=O)c2sccc2F)ccc1N1CCCC1=O	ZINC000450963131	FF	On-Demand	Anodyne	GHSR	0	48
COc1cc(NS(=O)(=O)c2sccc2F)ccc1N1CCCC1=O	ZINC000450963131	FF	On-Demand	Anodyne	PKM	24	47
C/C=C/C[C@@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450963135	CF	On-Demand	Anodyne	PIN1	25	40
O=S(=O)(Cc1c(F)cccc1Cl)Nc1c(F)cccc1N1CCCC1	ZINC000450963136	GI	On-Demand	Anodyne	KCNQ2	47	36
C/C=C\C[C@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450963138	CF	On-Demand	Anodyne	PIN1	25	40
C/C=C/C[C@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450963140	CF	On-Demand	Anodyne	PIN1	25	40
C/C=C\C[C@@H](CO)NC(=O)Cc1cc2ccccc2s1	ZINC000450963143	CF	On-Demand	Anodyne	PIN1	25	40
CCCOc1ccc(C(=O)N[C@H](C)c2ccc(Cl)cn2)c(OC)c1	ZINC000450963145	EI	On-Demand	Anodyne	F10	51	34
CCCOc1ccc(C(=O)N[C@@H](C)c2ccc(Cl)cn2)c(OC)c1	ZINC000450963146	EI	On-Demand	Anodyne	F10	51	34
CO[C@@H](Cc1ccccc1)C(=O)Nc1c(C)cccc1SC	ZINC000450963147	DH	On-Demand	Anodyne	MME	48	36
CO[C@H](Cc1ccccc1)C(=O)Nc1c(C)cccc1SC	ZINC000450963149	DH	On-Demand	Anodyne	MME	48	36
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCCCC1(F)F	ZINC000450963150	EG	On-Demand	Anodyne	CACNA1I	46	36
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCCCC1(F)F	ZINC000450963152	EG	On-Demand	Anodyne	CACNA1I	46	36
CCOc1ccccc1N1CCN(S(=O)(=O)CC2CC(F)(F)C2)CC1	ZINC000450963154	FF	On-Demand	Anodyne	HTR1A	35	47
CCOc1ccccc1N1CCN(S(=O)(=O)CC2CC(F)(F)C2)CC1	ZINC000450963154	FF	On-Demand	Anodyne	ADRA1D	47	41
CCOc1ccccc1N1CCN(S(=O)(=O)CC2CC(F)(F)C2)CC1	ZINC000450963154	FF	On-Demand	Anodyne	ADRA1A	34	41
CCOc1ccccc1N1CCN(S(=O)(=O)CC2CC(F)(F)C2)CC1	ZINC000450963154	FF	On-Demand	Anodyne	ADRA1B	46	41
CCOc1ccccc1N1CCN(S(=O)(=O)CC2CC(F)(F)C2)CC1	ZINC000450963154	FF	On-Demand	Anodyne	HTR7	29	42
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963157	DF	On-Demand	Anodyne	PRCP	49	37
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963157	DF	On-Demand	Anodyne	MC3R	39	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963157	DF	On-Demand	Anodyne	MC5R	26	41
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963159	DF	On-Demand	Anodyne	PRCP	49	37
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963159	DF	On-Demand	Anodyne	MC3R	39	41
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963159	DF	On-Demand	Anodyne	MC5R	26	41
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963161	DF	On-Demand	Anodyne	PRCP	49	37
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963161	DF	On-Demand	Anodyne	MC3R	39	41
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963161	DF	On-Demand	Anodyne	MC5R	26	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963162	DF	On-Demand	Anodyne	PRCP	49	37
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963162	DF	On-Demand	Anodyne	MC3R	39	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(O)(C2CC2)C1	ZINC000450963162	DF	On-Demand	Anodyne	MC5R	26	41
CC(=O)CCCCCn1cc([N+](=O)[O-])c(=O)c2ccccc21	ZINC000450963176	DG	On-Demand	Bother	CNR1	23	52
CC(=O)CCCCCn1cc([N+](=O)[O-])c(=O)c2ccccc21	ZINC000450963176	DG	On-Demand	Bother	CNR2	21	41
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2cc(C)c(C)nn2)c1	ZINC000450963179	FF	On-Demand	Anodyne	FFAR4	25	42
CC[C@@H](CC(C)C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450963185	DG	On-Demand	Anodyne	CACNA1I	40	37
CC[C@H](CC(C)C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450963187	DG	On-Demand	Anodyne	CACNA1I	40	37
COCc1nn(C)cc1C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450963193	CD	On-Demand	Anodyne	CNR2	15	40
COCc1nn(C)cc1C(=O)N[C@H]1CC[C@H](C)C1	ZINC000450963195	CD	On-Demand	Anodyne	CNR2	15	40
COCc1nn(C)cc1C(=O)N[C@@H]1CC[C@H](C)C1	ZINC000450963196	CD	On-Demand	Anodyne	CNR2	15	40
COCc1nn(C)cc1C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450963197	CD	On-Demand	Anodyne	CNR2	15	40
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nc(C)c(C)s2)cc1	ZINC000450963218	FF	On-Demand	Anodyne	CA4	15	40
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	FKBP1A	30	40
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	CASP3	48	35
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	MMP13	79	48
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	BDKRB1	23	40
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	ADAM17	74	41
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	MMP2	41	41
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	MMP3	76	48
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	MMP8	28	40
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	MMP9	38	42
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	EPHX2	30	48
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	CASP7	55	35
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	MMP7	79	48
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	MMP1	83	48
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	AKR1C3	30	54
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	LUXN	0	49
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	ADIPOR1	0	44
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963246	FD	On-Demand	Anodyne	ADIPOR2	0	44
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	FKBP1A	30	40
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	CASP3	48	35
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	MMP13	79	48
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	BDKRB1	23	40
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	ADAM17	74	41
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	MMP2	41	41
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	MMP3	76	48
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	MMP8	28	40
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	MMP9	38	42
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	EPHX2	30	48
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	CASP7	55	35
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	MMP7	79	48
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	MMP1	83	48
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	AKR1C3	30	54
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	LUXN	0	49
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	ADIPOR1	0	44
C[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963247	FD	On-Demand	Anodyne	ADIPOR2	0	44
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	CA2	27	58
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	CA1	37	44
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	CA4	27	46
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	MMP2	28	46
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	CA12	24	43
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	ADAMTS4	54	43
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	CA9	26	57
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	LEF	43	36
Cc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963252	EG	On-Demand	Anodyne	P96878_MYCTU	43	38
CC(=O)N1CCc2cc(NS(=O)(=O)CCCCF)ccc21	ZINC000450963253	DE	On-Demand	Anodyne	HSD17B3	42	29
CC(C)(C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)C1CCC1	ZINC000450963257	FI	On-Demand	Anodyne	NAMPT	25	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(C)(C)CN(C)C)cc1	ZINC000450963268	FE	On-Demand	Anodyne	CA1	16	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	F2	26	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	MME	67	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	ANPEP	55	34
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	FCER2	60	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	BMP1	28	43
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	CTSB	53	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	TRY2_BOVIN	82	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	PAPA1_CARPA	64	39
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	CYSP_TRYCR	55	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	TIMP3	46	34
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	CAPNS1	71	41
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	HLA-DRB1	44	32
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	CTSS	29	41
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	CAPN1	66	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	MMP9	26	45
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	CAPN2	63	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	ACE2	53	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	ITGAV	56	35
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	ST14	49	33
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	FPR1	43	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	NPR	50	43
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	HDA106	0	47
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	TMPRSS6	50	31
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)cs1	ZINC000450963269	EE	On-Demand	Anodyne	GPR142	72	34
CCOC(=O)c1ccc(CS(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450963281	GD	On-Demand	Anodyne	TBXAS1	27	41
CCOC(=O)c1ccc(CS(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450963281	GD	On-Demand	Anodyne	NAMPT	25	45
CC(F)(F)c1cccc(NC(=O)c2cc3n(n2)CCCC3)c1	ZINC000450963282	DH	On-Demand	Anodyne	TAAR1	28	40
CC(F)(F)c1cccc(NC(=O)c2cc3n(n2)CCCC3)c1	ZINC000450963282	DH	On-Demand	Anodyne	KCNK3	52	33
CC(F)(F)c1cccc(NC(=O)c2cc3n(n2)CCCC3)c1	ZINC000450963282	DH	On-Demand	Anodyne	KCNK9	43	32
O=C(CCNS(=O)(=O)CCC1CCCCC1)Nc1cccnc1	ZINC000450963287	EE	On-Demand	Anodyne	BMP1	62	43
O=C(CCNS(=O)(=O)CCC1CCCCC1)Nc1cccnc1	ZINC000450963287	EE	On-Demand	Anodyne	LDLR	0	50
COc1ccc(C(=O)N[C@H]2CCC[C@@H](C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450963288	GH	On-Demand	Anodyne	MAPK13	55	33
COc1ccc(C(=O)N[C@H]2CCC[C@H](C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450963289	GH	On-Demand	Anodyne	MAPK13	55	33
COc1ccc(C(=O)N[C@@H]2CCC[C@@H](C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450963290	GH	On-Demand	Anodyne	MAPK13	55	33
COc1ccc(C(=O)N[C@@H]2CCC[C@H](C(C)(C)C)CC2)cc1S(C)(=O)=O	ZINC000450963291	GH	On-Demand	Anodyne	MAPK13	55	33
Cc1csc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)c1	ZINC000450963293	FI	On-Demand	Anodyne	NOS1	15	44
Cc1csc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)c1	ZINC000450963293	FI	On-Demand	Anodyne	NAMPT	31	44
CC(C)[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963297	ED	On-Demand	Anodyne	MMP13	43	42
CC(C)[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963297	ED	On-Demand	Anodyne	MMP2	35	40
CC(C)[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963297	ED	On-Demand	Anodyne	MMP3	23	44
CC(C)[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963297	ED	On-Demand	Anodyne	MMP9	29	41
CC(C)[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963297	ED	On-Demand	Anodyne	MMP7	26	44
CC(C)[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963297	ED	On-Demand	Anodyne	ADAMTS4	80	41
CC(C)[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963297	ED	On-Demand	Anodyne	MMP1	23	44
CC(C)[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963298	ED	On-Demand	Anodyne	MMP13	43	42
CC(C)[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963298	ED	On-Demand	Anodyne	MMP2	35	40
CC(C)[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963298	ED	On-Demand	Anodyne	MMP3	23	44
CC(C)[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963298	ED	On-Demand	Anodyne	MMP9	29	41
CC(C)[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963298	ED	On-Demand	Anodyne	MMP7	26	44
CC(C)[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963298	ED	On-Demand	Anodyne	ADAMTS4	80	41
CC(C)[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963298	ED	On-Demand	Anodyne	MMP1	23	44
CC(C)c1ccc(NC(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450963313	DH	On-Demand	Anodyne	GUAB	0	42
CCO[C@@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450963319	GF	On-Demand	Bother	CACNA1D	44	32
CCO[C@@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450963319	GF	On-Demand	Bother	KCNMA1	20	44
CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450963321	GF	On-Demand	Bother	CACNA1D	44	32
CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450963321	GF	On-Demand	Bother	KCNMA1	20	44
CCO[C@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450963322	GF	On-Demand	Bother	CACNA1D	44	32
CCO[C@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450963322	GF	On-Demand	Bother	KCNMA1	20	44
CCO[C@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450963323	GF	On-Demand	Bother	CACNA1D	44	32
CCO[C@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450963323	GF	On-Demand	Bother	KCNMA1	20	44
CCc1ccc(NC(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450963331	DG	On-Demand	Anodyne	NOD2	40	35
CC(F)(F)c1cccc(NC(=O)CC[C@H]2CCC(=O)N2)c1	ZINC000450963342	CF	On-Demand	Anodyne	HDAC10	22	41
CC(F)(F)c1cccc(NC(=O)CC[C@H]2CCC(=O)N2)c1	ZINC000450963342	CF	On-Demand	Anodyne	HDAC11	32	44
Cc1cc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)ccc1Br	ZINC000450963344	GG	On-Demand	Anodyne	NR1I2	42	35
CC(F)(F)c1cccc(NC(=O)CC[C@@H]2CCC(=O)N2)c1	ZINC000450963345	CF	On-Demand	Anodyne	HDAC10	22	41
CC(F)(F)c1cccc(NC(=O)CC[C@@H]2CCC(=O)N2)c1	ZINC000450963345	CF	On-Demand	Anodyne	HDAC11	32	44
COC(=O)c1ccccc1OCCOc1cccc2c1C(=O)CC2	ZINC000450963347	EG	On-Demand	Anodyne	TRPA1	35	40
COC(=O)[C@@H](NC(=O)c1cc2n(n1)CCCC2)c1ccc(OC)c(Cl)c1	ZINC000450963350	GF	On-Demand	Anodyne	PDE6A	40	30
COC(=O)[C@H](NC(=O)c1cc2n(n1)CCCC2)c1ccc(OC)c(Cl)c1	ZINC000450963353	GF	On-Demand	Anodyne	PDE6A	40	30
Cc1cc2cc(S(=O)(=O)Nc3cc(C(C)(C)C)ccc3O)ccc2[nH]c1=O	ZINC000450963355	GH	On-Demand	Anodyne	UQCRB	0	47
Cc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450963356	GF	On-Demand	Anodyne	PRTN3	56	36
Cc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450963356	GF	On-Demand	Anodyne	ALPL	17	44
Cc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450963356	GF	On-Demand	Anodyne	MTNN	82	39
Cc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450963356	GF	On-Demand	Anodyne	FFAR4	34	40
Cc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450963356	GF	On-Demand	Anodyne	LIMK2	29	49
Cc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450963356	GF	On-Demand	Anodyne	UQCRB	0	42
O=C1CN(C(=O)CSc2ccc(Br)c(Cl)c2)CCN1	ZINC000450963359	FE	On-Demand	Anodyne	THRB	15	44
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000450963365	EE	On-Demand	Anodyne	MC4R	38	43
COc1ccc(S(=O)(=O)[C@H]2C[C@@H](C)CCC2=O)cc1	ZINC000450963374	CE	On-Demand	Anodyne	MMP1	20	47
COc1ccc(S(=O)(=O)[C@@H]2C[C@@H](C)CCC2=O)cc1	ZINC000450963375	CE	On-Demand	Anodyne	MMP1	20	47
COc1ccc(S(=O)(=O)[C@@H]2C[C@H](C)CCC2=O)cc1	ZINC000450963377	CE	On-Demand	Anodyne	MMP1	20	47
COc1ccc(S(=O)(=O)[C@H]2C[C@H](C)CCC2=O)cc1	ZINC000450963379	CE	On-Demand	Anodyne	MMP1	20	47
CCSc1cccnc1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450963385	GG	On-Demand	Anodyne	HRH2	43	38
CCSc1cccnc1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450963385	GG	On-Demand	Anodyne	HTR1D	23	42
CCSc1cccnc1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450963385	GG	On-Demand	Anodyne	FAAH	27	40
CCSc1cccnc1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450963385	GG	On-Demand	Anodyne	P2RY14	42	32
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	PRTN3	53	34
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	CCR2	0	40
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	MCHR1	16	41
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	PTGDR2	27	43
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	FFAR4	29	42
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	TRAR	29	42
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	LUXN	0	44
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	ADIPOR1	0	40
Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963402	GG	On-Demand	Anodyne	ADIPOR2	0	40
COC(=O)c1ncccc1S(=O)(=O)NC1CCCC1	ZINC000450963407	CD	On-Demand	Anodyne	CCR8	40	32
COC(=O)c1ncccc1S(=O)(=O)NC1CCCC1	ZINC000450963407	CD	On-Demand	Anodyne	SFRP1	89	33
COC(=O)c1ncccc1S(=O)(=O)NC1CCCC1	ZINC000450963407	CD	On-Demand	Anodyne	WNT3	51	32
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000450963408	FG	On-Demand	Anodyne	SCD1	30	41
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000450963408	FG	On-Demand	Anodyne	SCD	22	41
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000450963418	FG	On-Demand	Anodyne	SCD1	30	41
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000450963418	FG	On-Demand	Anodyne	SCD	22	41
CCOC(=O)c1cc(S(=O)(=O)Nc2c(C)cc(C)cc2C)cnc1C(F)F	ZINC000450963435	GH	On-Demand	Anodyne	FFAR4	32	42
COc1ccc(S(=O)(=O)CC2(C#N)CCC2)cc1	ZINC000450963440	CE	On-Demand	Mild	MMP13	33	44
CCc1cccc(C(=O)N[C@H](C(=O)OC)c2ccc(OC)c(O)c2)n1	ZINC000450963441	EE	On-Demand	Anodyne	PDE5A	33	51
CCc1cccc(C(=O)N[C@@H](C(=O)OC)c2ccc(OC)c(O)c2)n1	ZINC000450963443	EE	On-Demand	Anodyne	PDE5A	33	51
O=C(CCCN1C[C@H](F)C[C@H]1C(=O)N1CCOCC1)c1ccccc1	ZINC000450963445	ED	On-Demand	Anodyne	CYP2J2	51	36
COc1ccc(-c2csc(NS(=O)(=O)C[C@H](C)OC)n2)cc1	ZINC000450963451	EF	On-Demand	Anodyne	MAOA	0	53
COc1ccc(-c2csc(NS(=O)(=O)C[C@H](C)OC)n2)cc1	ZINC000450963451	EF	On-Demand	Anodyne	MAOB	28	48
COc1ccc(-c2csc(NS(=O)(=O)C[C@@H](C)OC)n2)cc1	ZINC000450963453	EF	On-Demand	Anodyne	MAOA	0	53
COc1ccc(-c2csc(NS(=O)(=O)C[C@@H](C)OC)n2)cc1	ZINC000450963453	EF	On-Demand	Anodyne	MAOB	28	48
CC[C@@H](C)NS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450963455	CG	On-Demand	Anodyne	NR3C1	0	40
CC[C@@H](C)NS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450963455	CG	On-Demand	Anodyne	TRY2_BOVIN	57	36
CC[C@@H](C)NS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450963455	CG	On-Demand	Anodyne	CYP2A5	0	41
CCOC(=O)c1sc(N(C)S(=O)(=O)c2sc(C)cc2C)nc1C	ZINC000450963461	FG	On-Demand	Anodyne	DHODH	17	40
CC[C@H](C)NS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450963470	CG	On-Demand	Anodyne	NR3C1	0	40
CC[C@H](C)NS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450963470	CG	On-Demand	Anodyne	TRY2_BOVIN	57	36
CC[C@H](C)NS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450963470	CG	On-Demand	Anodyne	CYP2A5	0	41
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)c1	ZINC000450963474	EG	On-Demand	Anodyne	LPL	43	35
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)c1	ZINC000450963474	EG	On-Demand	Anodyne	EPHX2	28	44
COc1ccc2c(N3CC[C@@H](CCCO)C3)ncnc2c1F	ZINC000450963484	DE	On-Demand	Anodyne	PDE3A	51	40
O=C(O)c1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC(c3ccccc3)CC2)c1	ZINC000450963485	GF	On-Demand	Bother	SLC18A3	41	36
O=C(O)c1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC(c3ccccc3)CC2)c1	ZINC000450963485	GF	On-Demand	Bother	EPHX2	23	48
O=C(O)c1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC(c3ccccc3)CC2)c1	ZINC000450963485	GF	On-Demand	Bother	AKR1C3	43	41
COc1ccc2c(N3CC[C@H](CCCO)C3)ncnc2c1F	ZINC000450963486	DE	On-Demand	Anodyne	PDE3A	51	40
Cc1cc2c(N3CCN(C(=O)[C@H]4CC4(F)F)CC3)ncnc2s1	ZINC000450963491	EE	On-Demand	Anodyne	SIRT3	48	31
Cc1cc2c(N3CCN(C(=O)[C@H]4CC4(F)F)CC3)ncnc2s1	ZINC000450963491	EE	On-Demand	Anodyne	SIRT2	41	30
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450963497	GH	On-Demand	Anodyne	PRCP	45	35
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450963497	GH	On-Demand	Anodyne	CACNA1I	44	39
Cc1cc2c(N3CCN(C(=O)[C@@H]4CC4(F)F)CC3)ncnc2s1	ZINC000450963499	EE	On-Demand	Anodyne	SIRT3	48	31
Cc1cc2c(N3CCN(C(=O)[C@@H]4CC4(F)F)CC3)ncnc2s1	ZINC000450963499	EE	On-Demand	Anodyne	SIRT2	41	30
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450963501	GH	On-Demand	Anodyne	PRCP	45	35
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450963501	GH	On-Demand	Anodyne	CACNA1I	44	39
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450963503	GH	On-Demand	Anodyne	PRCP	45	35
CN1CCN(CCC(C)(C)NC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC1	ZINC000450963503	GH	On-Demand	Anodyne	CACNA1I	44	39
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450963505	GH	On-Demand	Anodyne	PRCP	45	35
CN1CCN(CCC(C)(C)NC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CC1	ZINC000450963505	GH	On-Demand	Anodyne	CACNA1I	44	39
CCCCCNS(=O)(=O)CCOCc1ccccc1	ZINC000450963509	CE	On-Demand	Anodyne	RELA	17	40
CCSCn1nnc(-c2ccco2)n1	ZINC000450963513	BD	On-Demand	Anodyne	ADORA3	41	37
CS(=O)(=O)c1cccc(CS(=O)(=O)N2CCCc3ccccc32)c1	ZINC000450963528	FE	On-Demand	Anodyne	CYP11B2	28	40
CN(C)CCOc1ccc(NS(=O)(=O)c2sccc2Cl)cc1Cl	ZINC000450963555	GH	On-Demand	Anodyne	UTS2R	31	52
CC(C)n1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]2CO)cn1	ZINC000450963560	FG	On-Demand	Anodyne	DRD2	29	41
CC(C)n1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]2CO)cn1	ZINC000450963560	FG	On-Demand	Anodyne	DRD4	0	44
CC(C)n1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]2CO)cn1	ZINC000450963560	FG	On-Demand	Anodyne	HTR2A	17	46
CC(C)n1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]2CO)cn1	ZINC000450963560	FG	On-Demand	Anodyne	HTR2C	15	45
CC(C)n1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]2CO)cn1	ZINC000450963560	FG	On-Demand	Anodyne	SLC18A3	0	42
CC(C)n1cc([C@@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@H]2CO)cn1	ZINC000450963560	FG	On-Demand	Anodyne	CYP2J2	46	33
Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450963561	EH	On-Demand	Bother	NFKBIA	0	43
CN(CC1(c2ccccc2)CC1)C(=O)c1ccn(CCc2ccccc2)n1	ZINC000450963567	FH	On-Demand	Anodyne	KCNA3	17	44
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450963577	BF	On-Demand	Anodyne	GRM4	18	47
CC[C@@H]1C[C@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450963577	BF	On-Demand	Anodyne	ENPP1	53	30
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccs2)cc1	ZINC000450963584	EF	On-Demand	Anodyne	CA1	27	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccs2)cc1	ZINC000450963584	EF	On-Demand	Anodyne	MMP13	23	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccs2)cc1	ZINC000450963584	EF	On-Demand	Anodyne	CA5B	47	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccs2)cc1	ZINC000450963584	EF	On-Demand	Anodyne	CA5A	49	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccs2)cc1	ZINC000450963584	EF	On-Demand	Anodyne	MMP12	25	41
CCOC(=O)c1sc(N(C)S(=O)(=O)c2cc(C)cs2)nc1C	ZINC000450963601	FF	On-Demand	Anodyne	DHODH	18	40
O=S(=O)(C[C@@H]1CCCCC1(F)F)NCCCc1ccccc1	ZINC000450963614	EG	On-Demand	Anodyne	FKBP1A	27	41
O=S(=O)(C[C@H]1CCCCC1(F)F)NCCCc1ccccc1	ZINC000450963616	EG	On-Demand	Anodyne	FKBP1A	27	41
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2c(F)cccc2Cl)C1	ZINC000450963617	FF	On-Demand	Anodyne	FDFT1	23	41
CCOC(=O)[C@H]1CCCN(S(=O)(=O)Cc2c(F)cccc2Cl)C1	ZINC000450963618	FF	On-Demand	Anodyne	FDFT1	23	41
CCC(CC)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963619	ED	On-Demand	Anodyne	MMP13	42	42
CCC(CC)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963619	ED	On-Demand	Anodyne	MMP3	24	42
CCC(CC)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963619	ED	On-Demand	Anodyne	MMP9	28	40
CCC(CC)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963619	ED	On-Demand	Anodyne	MMP7	32	42
CCC(CC)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963619	ED	On-Demand	Anodyne	ADAMTS4	66	37
CCC(CC)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963619	ED	On-Demand	Anodyne	MMP1	26	42
Cc1ccc(F)c(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450963620	GG	On-Demand	Anodyne	P2RY12	22	54
Cc1ccc(F)c(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450963620	GG	On-Demand	Anodyne	PDGFRB	50	37
Cc1ccc(F)c(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450963620	GG	On-Demand	Anodyne	AKT3	42	38
Cc1ccc(F)c(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450963620	GG	On-Demand	Anodyne	AKT1	33	43
O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450963621	FI	On-Demand	Anodyne	SCN9A	0	40
O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450963636	FI	On-Demand	Anodyne	SCN9A	0	40
O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450963638	FI	On-Demand	Anodyne	SCN9A	0	40
O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450963640	FI	On-Demand	Anodyne	SCN9A	0	40
CCCCN(c1ccccc1)S(=O)(=O)c1ccc2[nH]c(=O)c(C)cc2c1	ZINC000450963652	FH	On-Demand	Anodyne	NPY5R	0	45
N#C[C@]1(NC(=O)c2ccc(I)cc2F)CCOC1	ZINC000450963653	FD	On-Demand	Mild	MAP2K1	52	33
N#C[C@@]1(NC(=O)c2ccc(I)cc2F)CCOC1	ZINC000450963654	FD	On-Demand	Mild	MAP2K1	52	33
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	CA2	18	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	ADRB1	17	44
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	LTA4H	24	40
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	BMP1	108	47
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	CA7	15	43
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	MMP13	65	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	ADAM17	30	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	CA14	15	43
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	MMP2	45	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	MMP3	35	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	MMP8	50	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	MMP9	58	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	MMP12	45	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	CA12	19	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	ADAMTS4	47	40
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	CA9	31	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	MMP1	41	42
CCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450963661	GH	On-Demand	Anodyne	P96878_MYCTU	21	40
CC[C@H]1c2ccsc2CCN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450963686	FH	On-Demand	Anodyne	TRPM8	16	41
CC[C@@H]1c2ccsc2CCN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450963690	FH	On-Demand	Anodyne	TRPM8	16	41
COc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)ccc1F	ZINC000450963692	EG	On-Demand	Anodyne	ANPEP	34	43
COc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)ccc1F	ZINC000450963692	EG	On-Demand	Anodyne	MMP3	23	40
Cc1ccn2ncc(C(=O)N3C[C@H](c4cccc(Cl)c4)OC[C@H]3C)c2c1	ZINC000450963693	FH	On-Demand	Anodyne	EPHB3	25	42
Cc1ccc(I)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450963724	GG	On-Demand	Anodyne	MAPK14	40	38
Cc1ccc(I)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450963724	GG	On-Demand	Anodyne	HDAC1	26	44
Cc1ccc(I)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450963724	GG	On-Demand	Anodyne	FASN	23	55
Cc1ccc(I)cc1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450963724	GG	On-Demand	Anodyne	HPGDS	19	44
COc1cc(CC(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1O	ZINC000450963740	FF	On-Demand	Anodyne	TRPV1	30	48
COc1cc(CC(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1O	ZINC000450963740	FF	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1O	ZINC000450963741	FF	On-Demand	Anodyne	TRPV1	30	48
COc1cc(CC(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1O	ZINC000450963741	FF	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1O	ZINC000450963742	FF	On-Demand	Anodyne	TRPV1	30	48
COc1cc(CC(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1O	ZINC000450963742	FF	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1O	ZINC000450963743	FF	On-Demand	Anodyne	CAN2	0	41
CN(CCOc1ccccc1)S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450963744	EG	On-Demand	Anodyne	AMY2	44	30
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	CA2	16	56
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	LPL	47	36
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	CA1	16	41
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	EPHX2	23	52
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	PKM	22	42
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	TGM2	94	52
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	F13A1	126	54
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	NAMPT	34	45
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	TGM6	0	46
CC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450963760	FD	On-Demand	Anodyne	DDIT3	0	41
COC(=O)c1ncccc1S(=O)(=O)Nc1cccc2c1CCCC2	ZINC000450963761	EF	On-Demand	Anodyne	PRTN3	52	32
CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963762	CC	On-Demand	Anodyne	MMP13	41	41
CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963762	CC	On-Demand	Anodyne	MMP9	23	42
CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963762	CC	On-Demand	Anodyne	ADAMTS4	43	38
CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963762	CC	On-Demand	Anodyne	MMP1	28	47
CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963762	CC	On-Demand	Anodyne	TRAR	33	40
CSc1cccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450963765	EG	On-Demand	Anodyne	DRD4	43	32
CSc1cccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450963765	EG	On-Demand	Anodyne	CCR3	34	42
CSc1cccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450963765	EG	On-Demand	Anodyne	CCR2	46	39
CSc1cccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450963765	EG	On-Demand	Anodyne	CACNA1I	78	47
CSc1cccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450963765	EG	On-Demand	Anodyne	HPGDS	34	41
CC(=O)NC[C@H](CC(=O)NCC1CCN(CC(F)(F)F)CC1)CC(C)C	ZINC000450963769	GF	On-Demand	Anodyne	CACNA1I	49	34
Cn1cc(-c2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)o2)cn1	ZINC000450963770	FF	On-Demand	Anodyne	HTR4	57	37
Cn1cc(-c2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)o2)cn1	ZINC000450963770	FF	On-Demand	Anodyne	CACNA1I	73	44
Cn1cc(-c2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)o2)cn1	ZINC000450963770	FF	On-Demand	Anodyne	HPGDS	33	41
Cc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c(Cl)c1Cl	ZINC000450963774	GI	On-Demand	Anodyne	HTR4	78	41
Cc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c(Cl)c1Cl	ZINC000450963774	GI	On-Demand	Anodyne	CACNA1I	88	44
CCCOc1cccc(CS(=O)(=O)c2ccc(N3CCCC3=O)cc2)c1	ZINC000450963775	FH	On-Demand	Anodyne	AKR1C3	24	43
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450963787	GD	On-Demand	Anodyne	PIK3CB	0	40
COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450963787	GD	On-Demand	Anodyne	MTNN	75	38
Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963812	GH	On-Demand	Bother	NADE	0	40
Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963812	GH	On-Demand	Bother	COLA	102	39
Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963812	GH	On-Demand	Bother	LEF	40	34
Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450963812	GH	On-Demand	Bother	AADAC	0	47
CCOC(=O)c1[nH]c(C)c(-c2csc(-c3cccc(NC(C)=O)c3)n2)c1C	ZINC000450963814	GJ	On-Demand	Anodyne	SREBF2	0	42
O=C(C[C@H]1CSc2ccccc2O1)N1CCCN(C(=O)C2CC2)CC1	ZINC000450963815	FE	On-Demand	Anodyne	PREP	41	38
O=C(C[C@@H]1CSc2ccccc2O1)N1CCCN(C(=O)C2CC2)CC1	ZINC000450963816	FE	On-Demand	Anodyne	PREP	41	38
Cn1c(C#N)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450963820	ED	On-Demand	Mild	HTR4	48	35
Cn1c(C#N)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450963820	ED	On-Demand	Mild	CACNA1I	69	42
CC(C)Cn1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963828	GD	On-Demand	Anodyne	TNKS	40	31
CC(C)Cn1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963828	GD	On-Demand	Anodyne	LUXN	0	42
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(F)c1	ZINC000450963840	GF	On-Demand	Anodyne	TRPV1	63	34
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(F)c1	ZINC000450963840	GF	On-Demand	Anodyne	PRTN3	53	33
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(F)c1	ZINC000450963840	GF	On-Demand	Anodyne	LUXN	0	44
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(F)c1	ZINC000450963840	GF	On-Demand	Anodyne	MOGAT2	44	31
CSc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963845	GF	On-Demand	Anodyne	KCNA5	0	40
CSc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963845	GF	On-Demand	Anodyne	PRTN3	65	40
CSc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963845	GF	On-Demand	Anodyne	ADAMTS4	55	36
CSc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963845	GF	On-Demand	Anodyne	LUXN	0	51
CSc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963845	GF	On-Demand	Anodyne	ADIPOR1	0	44
CSc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450963845	GF	On-Demand	Anodyne	ADIPOR2	0	44
CCOc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450963847	GG	On-Demand	Anodyne	PDE5A	15	41
CCOc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450963847	GG	On-Demand	Anodyne	HTR1A	44	49
CCOc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450963847	GG	On-Demand	Anodyne	DRD2	32	52
CCOc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450963847	GG	On-Demand	Anodyne	DRD4	23	41
CCOc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450963847	GG	On-Demand	Anodyne	ADRA1D	42	38
CCOc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450963847	GG	On-Demand	Anodyne	HTR2A	16	40
CCOc1ccccc1N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450963847	GG	On-Demand	Anodyne	DRD3	24	52
C[C@@H]1CCO[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450963875	DD	On-Demand	Anodyne	CACNA1I	54	37
CCCOc1ccc(C(=O)N2CC(O)(C3CC3)C2)c(OC)c1	ZINC000450963876	DE	On-Demand	Anodyne	OXTR	23	43
CC(=O)c1cccc(Cn2nnn(C3CC3)c2=O)c1	ZINC000450963898	CD	On-Demand	Anodyne	POL	15	46
CCn1nnc(C)c1COc1cc(Br)cc(C(F)(F)F)c1	ZINC000450963908	FH	On-Demand	Anodyne	GABRB3	0	40
Cn1c(C#N)ccc1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450963923	FH	On-Demand	Mild	COLA	69	41
Cn1c(C#N)ccc1C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450963923	FH	On-Demand	Mild	CPT1A	62	41
Cn1c(C#N)ccc1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450963924	FH	On-Demand	Mild	COLA	69	41
Cn1c(C#N)ccc1C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450963924	FH	On-Demand	Mild	CPT1A	62	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC1CCCC1	ZINC000450963928	CH	On-Demand	Anodyne	OPRD1	25	40
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC1CCCC1	ZINC000450963928	CH	On-Demand	Anodyne	OPRK1	35	42
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC1CCCC1	ZINC000450963929	CH	On-Demand	Anodyne	OPRD1	25	40
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC1CCCC1	ZINC000450963929	CH	On-Demand	Anodyne	OPRK1	35	42
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC1CCCC1	ZINC000450963930	CH	On-Demand	Anodyne	OPRM1	27	42
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC1CCCC1	ZINC000450963930	CH	On-Demand	Anodyne	OPRD1	26	42
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC1CCCC1	ZINC000450963930	CH	On-Demand	Anodyne	OPRK1	41	42
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC1CCCC1	ZINC000450963931	CH	On-Demand	Anodyne	OPRM1	27	42
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC1CCCC1	ZINC000450963931	CH	On-Demand	Anodyne	OPRD1	26	42
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC1CCCC1	ZINC000450963931	CH	On-Demand	Anodyne	OPRK1	41	42
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(O)(C2CC2)C1	ZINC000450963936	CF	On-Demand	Anodyne	CACNA1B	46	41
C[C@@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)c1ccc(Cl)cn1	ZINC000450963943	FH	On-Demand	Anodyne	CACNA1I	15	47
C[C@H](NC(=O)Cc1ccc(OC(F)F)c(F)c1)c1ccc(Cl)cn1	ZINC000450963944	FH	On-Demand	Anodyne	CACNA1I	15	47
CN(CCOc1ccccc1)S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450963945	EG	On-Demand	Anodyne	AMY2	44	30
Cc1ccn(-c2ccccc2C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)n1	ZINC000450963951	GG	On-Demand	Anodyne	HCN1	42	30
Cc1ccn(-c2ccccc2C(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)n1	ZINC000450963952	GG	On-Demand	Anodyne	HCN1	42	30
Cc1ccn(-c2ccccc2C(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)n1	ZINC000450963955	GG	On-Demand	Anodyne	HCN1	42	30
Cc1ccn(-c2ccccc2C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)n1	ZINC000450963956	GG	On-Demand	Anodyne	HCN1	42	30
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	LPL	44	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	TRPV1	15	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	PRNP	44	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	GRM4	32	55
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	EPHX2	18	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	TGM2	82	70
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	GCK	40	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	F13A1	108	70
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000450963964	GE	On-Demand	Anodyne	NAMPT	44	42
Cc1ccn2ncc(C(=O)N[C@@H]3CC[C@H](C)C3)c2c1	ZINC000450963965	CF	On-Demand	Anodyne	EPHB3	38	54
Cc1ccn2ncc(C(=O)N[C@H]3CC[C@H](C)C3)c2c1	ZINC000450963967	CF	On-Demand	Anodyne	EPHB3	38	54
Cc1ccn2ncc(C(=O)N[C@H]3CC[C@@H](C)C3)c2c1	ZINC000450963969	CF	On-Demand	Anodyne	EPHB3	38	54
CCOc1ccc(OCC)c(NS(=O)(=O)c2ccc(CC#N)cc2Cl)c1	ZINC000450963970	GI	On-Demand	Mild	PTGDR	33	42
CCOc1ccc(OCC)c(NS(=O)(=O)c2ccc(CC#N)cc2Cl)c1	ZINC000450963970	GI	On-Demand	Mild	PTGDR2	25	44
Cc1ccn2ncc(C(=O)N[C@@H]3CC[C@@H](C)C3)c2c1	ZINC000450963971	CF	On-Demand	Anodyne	EPHB3	38	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccn(C)n2)cc1	ZINC000450963972	DD	On-Demand	Anodyne	PFK	0	42
COC(=O)COc1ccc(CN(C)C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)cc1	ZINC000450963976	GG	On-Demand	Anodyne	GPR88	0	43
COc1cc2c(cc1OC)CN(S(=O)(=O)Cc1c(F)cccc1Cl)CC2	ZINC000450963978	GG	On-Demand	Anodyne	ABCB1B	54	37
COc1cc2c(cc1OC)CN(S(=O)(=O)Cc1c(F)cccc1Cl)CC2	ZINC000450963978	GG	On-Demand	Anodyne	ABCB1	23	41
CCOC(=O)c1c(NC(=O)Cn2cnc3c2CCCC3)sc(C)c1C	ZINC000450963981	FG	On-Demand	Anodyne	NS5B	0	42
COC(=O)COc1ccc(CN(C)C(=O)c2cccc(SC)c2)cc1	ZINC000450963982	FG	On-Demand	Anodyne	HSD17B2	22	40
COC(=O)COc1ccc(CN(C)C(=O)c2cccc(SC)c2)cc1	ZINC000450963982	FG	On-Demand	Anodyne	LIMK2	35	42
CCCc1cc(C(=O)Nc2c(F)cccc2OC)no1	ZINC000450963986	CG	On-Demand	Anodyne	PYGL	0	43
O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1c(Cl)ccc(F)c1F	ZINC000450963993	GF	On-Demand	Anodyne	ADK	18	41
O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1c(Cl)ccc(F)c1F	ZINC000450963993	GF	On-Demand	Anodyne	ERBB4	17	40
O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1c(Cl)ccc(F)c1F	ZINC000450963993	GF	On-Demand	Anodyne	STAT6	40	35
O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1c(Cl)ccc(F)c1F	ZINC000450963993	GF	On-Demand	Anodyne	DGAT1	26	45
O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1c(Cl)ccc(F)c1F	ZINC000450963993	GF	On-Demand	Anodyne	NCOA1	0	40
Cc1csc(S(=O)(=O)Nc2ccc(N3CCCC3)cc2C)c1	ZINC000450964001	EH	On-Demand	Anodyne	GHSR	24	44
CC(C)Oc1cccc(CNC(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450964020	FG	On-Demand	Anodyne	PDS	40	33
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cnns2)C1	ZINC000450964021	EF	On-Demand	Anodyne	SIGMAR1	27	42
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cnns2)C1	ZINC000450964021	EF	On-Demand	Anodyne	PREP	60	39
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cnns2)C1	ZINC000450964021	EF	On-Demand	Anodyne	BIRC2	49	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cnns2)C1	ZINC000450964022	EF	On-Demand	Anodyne	SIGMAR1	27	42
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cnns2)C1	ZINC000450964022	EF	On-Demand	Anodyne	PREP	60	39
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cnns2)C1	ZINC000450964022	EF	On-Demand	Anodyne	BIRC2	49	40
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000450964025	EF	On-Demand	Anodyne	PRTN3	46	34
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	NR3C1	0	44
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	NR3C2	0	42
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	ACE	20	45
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	SSTR2	28	44
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	OPRM1	0	45
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	OPRD1	0	45
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	GHRHR	31	42
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MME	27	46
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	EDNRB	50	35
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	EDNRA	40	39
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	TACR1	33	46
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MC4R	48	40
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	BMP1	29	42
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	TACR2	30	43
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	KCNA5	0	63
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	CCKAR	123	43
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	CTSL	29	43
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	BRS3	28	43
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	NMBR	74	36
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MC3R	66	40
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MC5R	69	34
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MMP2	30	49
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MMP8	36	41
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MMP14	23	43
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	GRPR	98	35
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	ECE1	65	46
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MMP11	85	39
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	CCKBR	101	39
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	GHSR	70	44
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MMP9	27	49
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MC1R	96	40
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	ADAM9	40	41
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	MMP1	22	45
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	NPR	33	46
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	SLC15A2	0	49
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	KISS1R	74	35
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	ERAP2	43	38
COCC1(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)OC)CC1	ZINC000450964027	FD	On-Demand	Anodyne	LASB	0	46
N#C[C@]1(NC(=O)c2cccc(C(F)(F)F)n2)CCOC1	ZINC000450964032	CD	On-Demand	Mild	TSPO	15	40
CC(C)CNC(=O)c1ccccc1NS(=O)(=O)c1sccc1Cl	ZINC000450964033	FH	On-Demand	Anodyne	KCNA5	0	41
CC(C)CNC(=O)c1ccccc1NS(=O)(=O)c1sccc1Cl	ZINC000450964033	FH	On-Demand	Anodyne	PRTN3	48	38
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450964034	FI	On-Demand	Anodyne	NAMPT	24	41
N#C[C@@]1(NC(=O)c2cccc(C(F)(F)F)n2)CCOC1	ZINC000450964036	CD	On-Demand	Mild	TSPO	15	40
O=C(Nc1ccc(NS(=O)(=O)CCCCF)cc1)NC1CC1	ZINC000450964039	EE	On-Demand	Anodyne	EPHX2	52	45
O=C(Nc1ccc(NS(=O)(=O)CCCCF)cc1)NC1CC1	ZINC000450964039	EE	On-Demand	Anodyne	NCE103	23	52
CN1CCN(CCOc2ccc(NS(=O)(=O)CCC3CCCC3)cc2)CC1	ZINC000450964041	GF	On-Demand	Anodyne	LTA4H	53	47
CN1CCN(CCOc2ccc(NS(=O)(=O)CCC3CCCC3)cc2)CC1	ZINC000450964041	GF	On-Demand	Anodyne	HRH3	53	40
CN1CCN(CCOc2ccc(NS(=O)(=O)CCC3CCCC3)cc2)CC1	ZINC000450964041	GF	On-Demand	Anodyne	EBP	18	40
CN1CCN(CCOc2ccc(NS(=O)(=O)CCC3CCCC3)cc2)CC1	ZINC000450964041	GF	On-Demand	Anodyne	PSMB2	49	38
CN1CCN(CCOc2ccc(NS(=O)(=O)CCC3CCCC3)cc2)CC1	ZINC000450964041	GF	On-Demand	Anodyne	PSMB5	17	41
CN1CCN(CCOc2ccc(NS(=O)(=O)CCC3CCCC3)cc2)CC1	ZINC000450964041	GF	On-Demand	Anodyne	PSMB1	44	41
COc1cccc(F)c1NC(=O)CCCC(C)C	ZINC000450964042	CH	On-Demand	Anodyne	ACAT	0	47
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	ACE	47	40
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	FKBP1A	56	40
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	SLC6A1	59	32
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	SIGMAR1	28	44
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	PREP	55	48
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	MMP2	54	29
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	MMP3	22	40
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	EPHX2	15	58
C[C@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964047	FE	On-Demand	Anodyne	BIRC2	63	49
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	ACE	47	40
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	FKBP1A	56	40
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	SLC6A1	59	32
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	SIGMAR1	28	44
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	PREP	55	48
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	MMP2	54	29
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	MMP3	22	40
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	EPHX2	15	58
C[C@@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964049	FE	On-Demand	Anodyne	BIRC2	63	49
C[C@@H](Oc1ccccn1)C(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450964050	FG	On-Demand	Anodyne	MTNR1A	16	40
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	ACE	47	40
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	FKBP1A	56	40
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	SLC6A1	59	32
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	SIGMAR1	28	44
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	PREP	55	48
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	MMP2	54	29
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	MMP3	22	40
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	EPHX2	15	58
C[C@H](CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964051	FE	On-Demand	Anodyne	BIRC2	63	49
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	ACE	47	40
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	FKBP1A	56	40
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	SLC6A1	59	32
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	SIGMAR1	28	44
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	PREP	55	48
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	MMP2	54	29
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	MMP3	22	40
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	EPHX2	15	58
C[C@@H](CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1)S(C)(=O)=O	ZINC000450964052	FE	On-Demand	Anodyne	BIRC2	63	49
C[C@H](Oc1ccccn1)C(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450964053	FG	On-Demand	Anodyne	MTNR1A	16	40
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCC(C)CC1	ZINC000450964055	FD	On-Demand	Anodyne	HTR1A	21	49
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCC(C)CC1	ZINC000450964055	FD	On-Demand	Anodyne	ADRA1D	25	41
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCC(C)CC1	ZINC000450964055	FD	On-Demand	Anodyne	HTR2A	26	44
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCC(C)CC1	ZINC000450964055	FD	On-Demand	Anodyne	ADRA1A	32	40
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCC(C)CC1	ZINC000450964055	FD	On-Demand	Anodyne	HTR7	59	49
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCC(C)CC1	ZINC000450964055	FD	On-Demand	Anodyne	HTR6	26	43
COc1cccc(CN(C)S(=O)(=O)c2cc(C)cs2)c1	ZINC000450964059	DF	On-Demand	Anodyne	SQLE	51	41
Cc1ccc(C(=O)N2CCC(n3cncc3C)CC2)c(C(C)C)n1	ZINC000450964064	EG	On-Demand	Anodyne	L3MBTL3	45	36
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	LPL	45	37
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	MMP13	30	42
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	MMP2	21	42
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	MMP3	29	42
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	MMP8	23	42
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	TGM1	24	42
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	MMP9	16	42
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	EPHX2	48	47
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	TGM2	94	46
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	MMP7	27	42
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	MMP1	21	43
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	F13A1	116	46
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	AKR1C3	22	41
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	NAMPT	43	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	TGM6	0	42
COC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450964072	FD	On-Demand	Anodyne	DDIT3	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	ZINC000450964075	GF	On-Demand	Anodyne	CA2	20	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	ZINC000450964075	GF	On-Demand	Anodyne	CA1	25	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	ZINC000450964075	GF	On-Demand	Anodyne	CA4	25	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	ZINC000450964075	GF	On-Demand	Anodyne	IDO1	32	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	ZINC000450964075	GF	On-Demand	Anodyne	PFK	0	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	ZINC000450964075	GF	On-Demand	Anodyne	LIMK2	52	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	ZINC000450964075	GF	On-Demand	Anodyne	UQCRB	0	41
COc1ncccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450964076	FF	On-Demand	Anodyne	P2RY1	43	39
COc1ncccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450964076	FF	On-Demand	Anodyne	GRM4	20	46
COc1ncccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450964076	FF	On-Demand	Anodyne	MMP8	15	43
CNS(=O)(=O)NCC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450964080	ED	On-Demand	Anodyne	ATF1	42	37
NC(=O)CCCCSc1ccc(Br)c(Cl)c1	ZINC000450964093	DH	On-Demand	Anodyne	THRB	0	43
NC(=O)CCCCSc1ccc(Br)c(Cl)c1	ZINC000450964093	DH	On-Demand	Anodyne	PMI1	0	42
Cc1cc(N2CCCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450964103	EH	On-Demand	Anodyne	GHSR	25	44
O=C(COc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450964104	GD	On-Demand	Anodyne	MMP13	22	41
O=C(COc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450964104	GD	On-Demand	Anodyne	MMP14	18	52
O=C(COc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450964104	GD	On-Demand	Anodyne	ADAMTS4	19	40
O=C(COc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450964104	GD	On-Demand	Anodyne	MMP1	15	40
O=C(COc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450964104	GD	On-Demand	Anodyne	LUXN	0	42
O=C(COc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450964104	GD	On-Demand	Anodyne	ADIPOR1	0	43
O=C(COc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450964104	GD	On-Demand	Anodyne	ADIPOR2	0	43
O=C(c1ccccc1NS(=O)(=O)c1sccc1Cl)N1CCCCC1	ZINC000450964106	GH	On-Demand	Anodyne	GRM4	15	42
O=C(c1ccccc1NS(=O)(=O)c1sccc1Cl)N1CCCCC1	ZINC000450964106	GH	On-Demand	Anodyne	PRTN3	43	32
O=C(c1ccccc1NS(=O)(=O)c1sccc1Cl)N1CCCCC1	ZINC000450964106	GH	On-Demand	Anodyne	NPSR1	15	43
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCCC2)c1	ZINC000450964107	FG	On-Demand	Anodyne	LPL	52	39
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCCC2)c1	ZINC000450964107	FG	On-Demand	Anodyne	PRTN3	45	33
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCCC2)c1	ZINC000450964107	FG	On-Demand	Anodyne	CCR8	44	36
O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1sccc1Cl	ZINC000450964115	FE	On-Demand	Anodyne	DGAT1	21	42
Cn1cc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c(C(F)(F)F)n1	ZINC000450964117	GE	On-Demand	Anodyne	PRTN3	48	35
Cn1cc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c(C(F)(F)F)n1	ZINC000450964117	GE	On-Demand	Anodyne	CCR8	63	34
Cn1cc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c(C(F)(F)F)n1	ZINC000450964117	GE	On-Demand	Anodyne	SFRP1	71	35
Cn1cc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c(C(F)(F)F)n1	ZINC000450964117	GE	On-Demand	Anodyne	WNT3	59	35
O=C(CSc1ccc(Br)c(Cl)c1)NCC1CC1	ZINC000450964120	EH	On-Demand	Anodyne	CACNA1I	55	35
Cc1cc(N2CCN(C)CC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450964121	FF	On-Demand	Anodyne	GHSR	0	42
CCCN(CC1CC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964126	FE	On-Demand	Anodyne	BMP1	18	52
CCCN(CC1CC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964126	FE	On-Demand	Anodyne	MMP3	20	47
CCc1csc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450964127	GE	On-Demand	Anodyne	AVPR1B	18	42
CCc1csc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450964127	GE	On-Demand	Anodyne	LUXN	0	44
O=C(Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)[C@@H]1CC12CCSCC2	ZINC000450964130	GH	On-Demand	Anodyne	NAMPT	0	41
O=C(Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)[C@H]1CC12CCSCC2	ZINC000450964131	GH	On-Demand	Anodyne	NAMPT	0	41
COC[C@]1(C(=O)NCCc2cn(C)c3cc(Cl)ccc23)CCOC1	ZINC000450964132	FF	On-Demand	Anodyne	MTNR1A	18	43
COC[C@@]1(C(=O)NCCc2cn(C)c3cc(Cl)ccc23)CCOC1	ZINC000450964133	FF	On-Demand	Anodyne	MTNR1A	18	43
CCC[C@H](OC)C(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450964136	DG	On-Demand	Anodyne	MTNR1A	28	44
CCC[C@@H](OC)C(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450964137	DG	On-Demand	Anodyne	MTNR1A	28	44
Cc1nn(C)c(C)c1NS(=O)(=O)c1sccc1Cl	ZINC000450964138	DF	On-Demand	Anodyne	NMT1	39	45
Cc1nn(C)c(C)c1NS(=O)(=O)c1sccc1Cl	ZINC000450964138	DF	On-Demand	Anodyne	NMT2	0	45
Cc1nn(C)c(C)c1NS(=O)(=O)c1sccc1Cl	ZINC000450964138	DF	On-Demand	Anodyne	NMT	0	45
Cc1ccn2ncc(C(=O)N3C[C@H](c4cccc(Cl)c4)OC[C@@H]3C)c2c1	ZINC000450964145	FH	On-Demand	Anodyne	EPHB3	25	42
Cc1ccn2ncc(C(=O)N3C[C@@H](c4cccc(Cl)c4)OC[C@H]3C)c2c1	ZINC000450964146	FH	On-Demand	Anodyne	EPHB3	25	42
Cc1ccn2ncc(C(=O)N3C[C@@H](c4cccc(Cl)c4)OC[C@@H]3C)c2c1	ZINC000450964147	FH	On-Demand	Anodyne	EPHB3	25	42
CC(=O)N1CCN(c2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)CC1	ZINC000450964152	FF	On-Demand	Anodyne	EPHX2	16	43
CCO[C@@H]1C[C@H](NCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)C12CCCC2	ZINC000450964170	GD	On-Demand	Anodyne	CA4	40	39
CCO[C@@H]1C[C@@H](NCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)C12CCCC2	ZINC000450964172	GD	On-Demand	Anodyne	CA4	40	39
CCO[C@H]1C[C@H](NCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)C12CCCC2	ZINC000450964174	GD	On-Demand	Anodyne	CA4	40	39
COc1cc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc(OC)c1OC	ZINC000450964175	FG	On-Demand	Anodyne	HTR6	22	40
COc1cc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc(OC)c1OC	ZINC000450964175	FG	On-Demand	Anodyne	GHSR	25	42
CCO[C@H]1C[C@@H](NCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)C12CCCC2	ZINC000450964176	GD	On-Demand	Anodyne	CA4	40	39
O=S(=O)(Nc1cc(Cl)ccc1N1CCOCC1)c1sccc1F	ZINC000450964181	GG	On-Demand	Anodyne	CREBBP	40	44
O=S(=O)(Nc1cc(Cl)ccc1N1CCOCC1)c1sccc1F	ZINC000450964181	GG	On-Demand	Anodyne	BRD9	40	44
Cc1csc(NC2CCN(C(=O)Cc3cc4ccccc4s3)CC2)n1	ZINC000450964197	FI	On-Demand	Anodyne	TRPC6	44	32
CC(=O)N1CCN(Cc2cccc(NC(=O)Cn3ccc(C)n3)c2)CC1	ZINC000450964198	FD	On-Demand	Anodyne	HRH2	43	35
CC(=O)N1CCN(Cc2cccc(NC(=O)Cn3ccc(C)n3)c2)CC1	ZINC000450964198	FD	On-Demand	Anodyne	HTR1D	29	45
CC(=O)N1CCN(Cc2cccc(NC(=O)Cn3ccc(C)n3)c2)CC1	ZINC000450964198	FD	On-Demand	Anodyne	HTR1B	23	40
CC(=O)N1CCN(Cc2cccc(NC(=O)Cn3ccc(C)n3)c2)CC1	ZINC000450964198	FD	On-Demand	Anodyne	FAAH	27	44
CC(=O)N1CCN(Cc2cccc(NC(=O)Cn3ccc(C)n3)c2)CC1	ZINC000450964198	FD	On-Demand	Anodyne	P2RY14	43	33
CCN(CC)CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964200	FC	On-Demand	Anodyne	MMP13	17	40
CS(=O)(=O)c1cccc(CS(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000450964202	FD	On-Demand	Anodyne	AKR1C3	69	48
C[C@@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccc(Br)cc1	ZINC000450964209	GH	On-Demand	Anodyne	SDH1	0	40
C[C@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccc(Br)cc1	ZINC000450964210	GH	On-Demand	Anodyne	SDH1	0	40
O=S(=O)(C1CCC(C(F)(F)F)CC1)N1CCCc2ccccc21	ZINC000450964214	EH	On-Demand	Anodyne	CYP11B2	16	44
CCC[C@H](OC)C(=O)N1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C	ZINC000450964233	EG	On-Demand	Anodyne	MDM2	42	31
CCC[C@H](OC)C(=O)N1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C	ZINC000450964234	EG	On-Demand	Anodyne	MDM2	42	31
CCC[C@H](OC)C(=O)N1C[C@H](c2cccc(Cl)c2)OC[C@H]1C	ZINC000450964235	EG	On-Demand	Anodyne	MDM2	42	31
CCC[C@H](OC)C(=O)N1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C	ZINC000450964237	EG	On-Demand	Anodyne	MDM2	42	31
C=CCC1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CCCC1	ZINC000450964242	FG	On-Demand	Mild	FAAH	24	42
C=CCC1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CCCC1	ZINC000450964242	FG	On-Demand	Mild	NPFFR1	48	32
Cc1csc(S(=O)(=O)N2CCCCCC2)c1	ZINC000450964251	CF	On-Demand	Anodyne	LPL	48	39
CC(=O)CCCCCS(=O)(=O)c1ccc(Cl)cc1Cl	ZINC000450964263	DH	On-Demand	Anodyne	THRB	25	40
COc1ccc(Cl)cc1NS(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450964271	FG	On-Demand	Anodyne	CPT1A	46	32
COc1ccc(Cl)cc1NS(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450964272	FG	On-Demand	Anodyne	CPT1A	46	32
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)CF	ZINC000450964275	CG	On-Demand	Anodyne	PPARA	16	41
Cc1cc(C(F)(F)F)ccc1C(=O)NC(C)(C)CF	ZINC000450964275	CG	On-Demand	Anodyne	SORT1	16	42
CC(=O)NC[C@H](CC(=O)N(C)CC1(c2ccccc2)CC1)CC(C)C	ZINC000450964276	EG	On-Demand	Anodyne	KCNA3	15	40
Cc1ccc(C(=O)N2CCCC3(CC3)C2)cc1C(=O)N1CCCC2(CC2)C1	ZINC000450964281	FI	On-Demand	Anodyne	L3MBTL3	49	39
Cc1ccc(C(=O)N2CCCC3(CC3)C2)cc1C(=O)N1CCCC2(CC2)C1	ZINC000450964281	FI	On-Demand	Anodyne	HPGD	36	40
Cc1ccc(C(=O)N2CCN(C[C@@H](C)O)CC2)c(Cl)c1Cl	ZINC000450964282	EE	On-Demand	Anodyne	P2RX7	36	44
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)N2CCN(CC)CC2)c(F)c1	ZINC000450964286	GD	On-Demand	Anodyne	F13A1	21	42
CC(C)CNS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450964306	DD	On-Demand	Anodyne	RORB	0	41
O=C(COc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NC1CC1	ZINC000450964309	FC	On-Demand	Anodyne	TRAR	33	40
O=C(COc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NC1CC1	ZINC000450964312	FC	On-Demand	Anodyne	TRAR	33	40
N#CCc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c(Cl)c1	ZINC000450964314	GF	On-Demand	Mild	TRPV4	34	50
C[C@@H](O)CCSc1cccc(C(N)=O)c1	ZINC000450964317	BD	On-Demand	Anodyne	MVFR	0	40
C[C@@H](O)CCSc1cccc(C(N)=O)c1	ZINC000450964317	BD	On-Demand	Anodyne	PARP10	0	40
C[C@H](O)CCSc1cccc(C(N)=O)c1	ZINC000450964318	BD	On-Demand	Anodyne	MVFR	0	40
C[C@H](O)CCSc1cccc(C(N)=O)c1	ZINC000450964318	BD	On-Demand	Anodyne	PARP10	0	40
O=S(=O)(NCCN1CCOCC1)c1sc2ccccc2c1Cl	ZINC000450964323	FE	On-Demand	Anodyne	HTR2A	16	41
O=S(=O)(NCCN1CCOCC1)c1sc2ccccc2c1Cl	ZINC000450964323	FE	On-Demand	Anodyne	HTR7	37	41
O=S(=O)(NCCN1CCOCC1)c1sc2ccccc2c1Cl	ZINC000450964323	FE	On-Demand	Anodyne	PRKDC	57	37
O=S(=O)(NCCN1CCOCC1)c1sc2ccccc2c1Cl	ZINC000450964323	FE	On-Demand	Anodyne	HTR6	19	41
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1)NC1CC1	ZINC000450964339	GE	On-Demand	Anodyne	MMP13	17	40
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1)NC1CC1	ZINC000450964339	GE	On-Demand	Anodyne	ADAM17	15	40
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1)NC1CC1	ZINC000450964339	GE	On-Demand	Anodyne	ADAMTS4	27	40
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1)NC1CC1	ZINC000450964339	GE	On-Demand	Anodyne	SFRP1	41	32
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1)NC1CC1	ZINC000450964339	GE	On-Demand	Anodyne	LUXN	0	46
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1)NC1CC1	ZINC000450964339	GE	On-Demand	Anodyne	ADIPOR1	0	46
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2Cl)cc1)NC1CC1	ZINC000450964339	GE	On-Demand	Anodyne	ADIPOR2	0	46
Cn1cc(S(=O)(=O)Nc2ccc(C(C)(C)C)cc2)c(C(F)(F)F)n1	ZINC000450964367	FH	On-Demand	Anodyne	SGK1	24	59
Cn1cc(S(=O)(=O)Nc2ccc(C(C)(C)C)cc2)c(C(F)(F)F)n1	ZINC000450964367	FH	On-Demand	Anodyne	CYNT	29	43
OCCC[C@H]1CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450964383	CF	On-Demand	Anodyne	PDE1B	0	40
OCCC[C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C1	ZINC000450964384	CF	On-Demand	Anodyne	PDE1B	0	40
CC(C)(CC(=O)Cn1nnc(-c2ccco2)n1)C1CC1	ZINC000450964385	CE	On-Demand	Anodyne	SCARB1	43	35
CCOc1ccc(S(=O)(=O)[C@H](C)CC(C)C)cc1	ZINC000450964427	CG	On-Demand	Anodyne	CA7	19	54
CCOc1ccc(S(=O)(=O)[C@@H](C)CC(C)C)cc1	ZINC000450964428	CG	On-Demand	Anodyne	CA7	19	54
COc1ccc(C(=O)Nc2c3c(nn2C(C)C)CCC3)cc1S(C)(=O)=O	ZINC000450964433	GF	On-Demand	Anodyne	COLA	75	38
COc1ccc(C(=O)Nc2c3c(nn2C(C)C)CCC3)cc1S(C)(=O)=O	ZINC000450964433	GF	On-Demand	Anodyne	CPT1A	70	38
COc1ccc(C(=O)Nc2c3c(nn2C(C)C)CCC3)cc1S(C)(=O)=O	ZINC000450964433	GF	On-Demand	Anodyne	CPT2	47	37
COc1ccc(C(=O)Nc2c3c(nn2C(C)C)CCC3)cc1S(C)(=O)=O	ZINC000450964433	GF	On-Demand	Anodyne	CPT1B	61	37
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(CC#N)cc2Cl)C1	ZINC000450964449	EG	On-Demand	Mild	TRPV4	43	36
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(CC#N)cc2Cl)C1	ZINC000450964450	EG	On-Demand	Mild	TRPV4	43	36
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(CC#N)cc2Cl)C1	ZINC000450964451	EG	On-Demand	Mild	TRPV4	43	36
CO[C@H]1C[C@@H](CN2CCCC2)N(CCCC(=O)c2ccccc2)C1	ZINC000450964456	EF	On-Demand	Anodyne	SLC6A1	94	39
CO[C@H]1C[C@@H](CN2CCCC2)N(CCCC(=O)c2ccccc2)C1	ZINC000450964456	EF	On-Demand	Anodyne	CYP2J2	54	40
CCOCc1nc(C)c(C(=O)NCC2CCN(CC(F)(F)F)CC2)s1	ZINC000450964463	GF	On-Demand	Anodyne	CACNA1I	62	36
CCOCc1nc(C)c(C(=O)NCC2CCN(CC(F)(F)F)CC2)s1	ZINC000450964463	GF	On-Demand	Anodyne	SCD1	22	43
CCOC(=O)c1cc(S(=O)(=O)NCc2cccnc2)cnc1C(F)F	ZINC000450964465	FE	On-Demand	Anodyne	NAMPT	43	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450964466	GG	On-Demand	Anodyne	MC4R	27	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450964466	GG	On-Demand	Anodyne	PRCP	49	39
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450964466	GG	On-Demand	Anodyne	MC3R	34	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450964466	GG	On-Demand	Anodyne	MC5R	29	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450964467	GG	On-Demand	Anodyne	MC4R	27	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450964467	GG	On-Demand	Anodyne	PRCP	49	39
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450964467	GG	On-Demand	Anodyne	MC3R	34	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450964467	GG	On-Demand	Anodyne	MC5R	29	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450964468	GG	On-Demand	Anodyne	MC4R	27	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450964468	GG	On-Demand	Anodyne	PRCP	49	39
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450964468	GG	On-Demand	Anodyne	MC3R	34	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450964468	GG	On-Demand	Anodyne	MC5R	29	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450964469	GG	On-Demand	Anodyne	MC4R	27	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450964469	GG	On-Demand	Anodyne	PRCP	49	39
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450964469	GG	On-Demand	Anodyne	MC3R	34	40
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450964469	GG	On-Demand	Anodyne	MC5R	29	40
COC(=O)c1ccc(-c2nc(CC[C@@H]3CCCCO3)cs2)cc1	ZINC000450964474	EI	On-Demand	Anodyne	AVPR1B	21	42
COC(=O)c1ccc(-c2nc(CC[C@H]3CCCCO3)cs2)cc1	ZINC000450964475	EI	On-Demand	Anodyne	AVPR1B	21	42
COc1cc(CSc2nc(C)c(C)[nH]2)ccc1Cl	ZINC000450964477	CH	On-Demand	Anodyne	CYP2C8	23	43
COc1cc(CSc2nc(C)c(C)[nH]2)ccc1Cl	ZINC000450964477	CH	On-Demand	Anodyne	CYP2C19	29	44
Cc1ccc(F)c(CC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450964487	EG	On-Demand	Anodyne	CCR2	29	42
Cc1ccc(F)c(CC(=O)NCC2CCN(CC(F)(F)F)CC2)c1	ZINC000450964487	EG	On-Demand	Anodyne	CACNA1I	74	45
COC(=O)c1ccc(I)c(OCCCCCC(C)=O)c1	ZINC000450964488	GH	On-Demand	Anodyne	THRB	22	42
COC(=O)c1ccc(I)c(OCCCCCC(C)=O)c1	ZINC000450964488	GH	On-Demand	Anodyne	PLA2G4B	45	34
COC(=O)c1ccc(I)c(OCCCCCC(C)=O)c1	ZINC000450964488	GH	On-Demand	Anodyne	ACR	30	40
CCN(c1ccccc1C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450964489	FH	On-Demand	Anodyne	COLA	65	40
CC(C)(Cc1csc(-c2ccc(S(C)(=O)=O)cc2)n1)C1CC1	ZINC000450964490	EI	On-Demand	Anodyne	PTGS2	61	39
CC(C)(Cc1csc(-c2ccc(S(C)(=O)=O)cc2)n1)C1CC1	ZINC000450964490	EI	On-Demand	Anodyne	AVPR1B	17	40
CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964510	CC	On-Demand	Anodyne	MMP13	38	40
CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964510	CC	On-Demand	Anodyne	MMP2	24	40
CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964510	CC	On-Demand	Anodyne	MMP3	24	40
CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964510	CC	On-Demand	Anodyne	ADAMTS4	55	34
CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964510	CC	On-Demand	Anodyne	MMP1	32	40
CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964510	CC	On-Demand	Anodyne	TRAR	34	41
CN(C)CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964518	EC	On-Demand	Anodyne	MMP13	24	42
CN(C)CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964518	EC	On-Demand	Anodyne	LUXN	0	46
CN(C)CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964518	EC	On-Demand	Anodyne	ADIPOR1	0	41
CN(C)CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964518	EC	On-Demand	Anodyne	ADIPOR2	0	41
CS(=O)(=O)c1cccc(COc2ccc(OCC3CC3)c(Cl)c2)c1	ZINC000450964527	FI	On-Demand	Anodyne	MAOB	50	37
CS(=O)(=O)c1cccc(COc2ccc(OCC3CC3)c(Cl)c2)c1	ZINC000450964527	FI	On-Demand	Anodyne	FFAR1	33	43
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1	ZINC000450964535	GF	On-Demand	Anodyne	DRD4	48	37
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1	ZINC000450964535	GF	On-Demand	Anodyne	DRD3	30	41
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1	ZINC000450964535	GF	On-Demand	Anodyne	PLD1	42	39
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1	ZINC000450964535	GF	On-Demand	Anodyne	PLD2	57	39
Cc1csc(S(=O)(=O)Nc2ccc(N3CCOCC3)cc2C(N)=O)c1	ZINC000450964539	GD	On-Demand	Anodyne	STAT6	55	34
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450964542	GF	On-Demand	Anodyne	DRD2	22	42
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450964542	GF	On-Demand	Anodyne	DRD4	45	35
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450964542	GF	On-Demand	Anodyne	CHRNA7	16	44
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450964542	GF	On-Demand	Anodyne	PLD1	56	38
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450964542	GF	On-Demand	Anodyne	HTR3B	0	41
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450964542	GF	On-Demand	Anodyne	PLD2	70	38
O=C(NCCN1CCCC1)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450964542	GF	On-Demand	Anodyne	TGM2	20	43
COC(=O)c1ccnc(NS(=O)(=O)CCC2CCCC2)c1	ZINC000450964548	DE	On-Demand	Anodyne	KDM5C	0	44
COC(=O)c1c(C)cccc1NS(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450964553	FG	On-Demand	Anodyne	PRTN3	50	31
C[C@H](NC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O)c1ccc(Cl)cc1	ZINC000450964557	GH	On-Demand	Anodyne	PRCP	15	43
C[C@H](NC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O)c1ccc(Cl)cc1	ZINC000450964557	GH	On-Demand	Anodyne	CCR1	50	36
C[C@H](NC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O)c1ccc(Cl)cc1	ZINC000450964558	GH	On-Demand	Anodyne	PRCP	15	43
C[C@H](NC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O)c1ccc(Cl)cc1	ZINC000450964558	GH	On-Demand	Anodyne	CCR1	50	36
C[C@H](NC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O)c1ccc(Cl)cc1	ZINC000450964559	GH	On-Demand	Anodyne	PRCP	15	43
C[C@H](NC(=O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O)c1ccc(Cl)cc1	ZINC000450964559	GH	On-Demand	Anodyne	CCR1	50	36
C[C@H](NC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O)c1ccc(Cl)cc1	ZINC000450964560	GH	On-Demand	Anodyne	PRCP	15	43
C[C@H](NC(=O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O)c1ccc(Cl)cc1	ZINC000450964560	GH	On-Demand	Anodyne	CCR1	50	36
COc1cc(CN2C[C@@H](OC)C[C@H]2CN2CCCC2)ccc1Cl	ZINC000450964562	EG	On-Demand	Anodyne	OPRK1	32	41
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450964567	EG	On-Demand	Bother	GHSR	35	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1ccc(F)cc1	ZINC000450964583	DH	On-Demand	Anodyne	LTA4H	26	42
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCOc1ccc(F)cc1	ZINC000450964583	DH	On-Demand	Anodyne	HRH3	34	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1ccc(F)cc1	ZINC000450964585	DH	On-Demand	Anodyne	LTA4H	26	42
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCOc1ccc(F)cc1	ZINC000450964585	DH	On-Demand	Anodyne	HRH3	34	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1ccc(F)cc1	ZINC000450964586	DH	On-Demand	Anodyne	LTA4H	26	42
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCOc1ccc(F)cc1	ZINC000450964586	DH	On-Demand	Anodyne	HRH3	34	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1ccc(F)cc1	ZINC000450964587	DH	On-Demand	Anodyne	LTA4H	26	42
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCOc1ccc(F)cc1	ZINC000450964587	DH	On-Demand	Anodyne	HRH3	34	41
C[C@@H]1CC[C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450964602	CF	On-Demand	Anodyne	ACE	47	38
C[C@@H]1CC[C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450964602	CF	On-Demand	Anodyne	NAAA	42	40
C[C@@H]1CC[C@H](NC(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450964602	CF	On-Demand	Anodyne	TRPM8	0	47
C[C@@H]1CC[C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450964603	CF	On-Demand	Anodyne	ACE	47	38
C[C@@H]1CC[C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450964603	CF	On-Demand	Anodyne	NAAA	42	40
C[C@@H]1CC[C@@H](NC(=O)[C@@H](C)OCCc2ccccc2)C1	ZINC000450964603	CF	On-Demand	Anodyne	TRPM8	0	47
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450964604	CF	On-Demand	Anodyne	ACE	47	38
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450964604	CF	On-Demand	Anodyne	NAAA	42	40
C[C@H](OCCc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450964604	CF	On-Demand	Anodyne	TRPM8	0	47
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450964605	CF	On-Demand	Anodyne	ACE	47	38
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450964605	CF	On-Demand	Anodyne	NAAA	42	40
C[C@H](OCCc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450964605	CF	On-Demand	Anodyne	TRPM8	0	47
Cc1csc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000450964626	CG	On-Demand	Anodyne	GLMU	0	46
Cc1csc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000450964628	CG	On-Demand	Anodyne	GLMU	0	46
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964629	EG	On-Demand	Anodyne	MC4R	26	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964629	EG	On-Demand	Anodyne	MC3R	44	41
O=C([C@@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964629	EG	On-Demand	Anodyne	MC5R	31	41
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964633	EG	On-Demand	Anodyne	MC4R	26	41
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964633	EG	On-Demand	Anodyne	MC3R	44	41
O=C([C@H]1CC[C@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964633	EG	On-Demand	Anodyne	MC5R	31	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCCN(C(=O)C3CC3)CC2)cn1	ZINC000450964634	FE	On-Demand	Anodyne	L3MBTL3	78	42
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964635	EG	On-Demand	Anodyne	MC4R	26	41
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964635	EG	On-Demand	Anodyne	MC3R	44	41
O=C([C@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964635	EG	On-Demand	Anodyne	MC5R	31	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964637	EG	On-Demand	Anodyne	MC4R	26	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964637	EG	On-Demand	Anodyne	MC3R	44	41
O=C([C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)N1CC(OC(F)F)C1	ZINC000450964637	EG	On-Demand	Anodyne	MC5R	31	41
C[C@H](NC(=O)c1ccnc(OC(F)F)c1)C1CCN(CC(F)(F)F)CC1	ZINC000450964638	GG	On-Demand	Anodyne	CACNA1I	41	33
C[C@H](NC(=O)c1ccnc(OC(F)F)c1)C1CCN(CC(F)(F)F)CC1	ZINC000450964638	GG	On-Demand	Anodyne	HPGDS	38	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1	ZINC000450964639	CE	On-Demand	Anodyne	CA2	26	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1	ZINC000450964639	CE	On-Demand	Anodyne	CA4	27	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1	ZINC000450964639	CE	On-Demand	Anodyne	CA12	24	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1	ZINC000450964639	CE	On-Demand	Anodyne	IDO1	31	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1	ZINC000450964639	CE	On-Demand	Anodyne	P96878_MYCTU	49	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1	ZINC000450964639	CE	On-Demand	Anodyne	AADAC	0	41
C[C@@H](NC(=O)c1ccnc(OC(F)F)c1)C1CCN(CC(F)(F)F)CC1	ZINC000450964640	GG	On-Demand	Anodyne	CACNA1I	41	33
C[C@@H](NC(=O)c1ccnc(OC(F)F)c1)C1CCN(CC(F)(F)F)CC1	ZINC000450964640	GG	On-Demand	Anodyne	HPGDS	38	42
CCCCO[C@@H]1C[C@H](NCC(=O)Nc2ccccc2OC)C1(C)C	ZINC000450964644	EG	On-Demand	Anodyne	ACAT	0	49
CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2ccccc2OC)C1(C)C	ZINC000450964645	EG	On-Demand	Anodyne	ACAT	0	49
CCCCO[C@H]1C[C@H](NCC(=O)Nc2ccccc2OC)C1(C)C	ZINC000450964646	EG	On-Demand	Anodyne	ACAT	0	49
CCCCO[C@H]1C[C@@H](NCC(=O)Nc2ccccc2OC)C1(C)C	ZINC000450964647	EG	On-Demand	Anodyne	ACAT	0	49
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@]1(OC(C)C)CCOC1	ZINC000450964650	GF	On-Demand	Anodyne	TIMP3	68	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@]1(OC(C)C)CCOC1	ZINC000450964654	GF	On-Demand	Anodyne	TIMP3	68	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000450964657	GF	On-Demand	Anodyne	TIMP3	68	33
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@]1(OC(C)C)CCOC1	ZINC000450964660	GF	On-Demand	Anodyne	TIMP3	68	33
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1C(F)(F)F	ZINC000450964661	GH	On-Demand	Anodyne	NR1I2	43	36
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1C(F)(F)F	ZINC000450964661	GH	On-Demand	Anodyne	SGK1	15	55
CN(CC1(c2ccccc2)CC1)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000450964667	GI	On-Demand	Bother	NMBR	49	35
COc1cc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1Cl	ZINC000450964668	EH	On-Demand	Anodyne	F10	54	36
COc1cc(CC(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1Cl	ZINC000450964668	EH	On-Demand	Anodyne	CACNA1I	16	55
COc1cc(CC(=O)N[C@H](C)c2ccc(Cl)cn2)ccc1Cl	ZINC000450964669	EH	On-Demand	Anodyne	F10	54	36
COc1cc(CC(=O)N[C@H](C)c2ccc(Cl)cn2)ccc1Cl	ZINC000450964669	EH	On-Demand	Anodyne	CACNA1I	16	55
CCOC(=O)C1(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)CC1	ZINC000450964673	FH	On-Demand	Anodyne	SLC6A9	40	34
COc1cc(NC(=O)CC[C@H]2CCC(=O)N2)ccc1F	ZINC000450964684	CD	On-Demand	Anodyne	ENPP1	54	33
COc1cc(NC(=O)CC[C@@H]2CCC(=O)N2)ccc1F	ZINC000450964685	CD	On-Demand	Anodyne	ENPP1	54	33
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2cc(C)on2)c(F)c1	ZINC000450964686	GE	On-Demand	Anodyne	PPIA	20	47
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2cc(C)on2)c(F)c1	ZINC000450964686	GE	On-Demand	Anodyne	PFK	0	46
C[C@H](NC(=O)[C@H]1CCC[C@@H]1c1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450964691	GI	On-Demand	Anodyne	CCR5	56	40
C[C@H](NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450964693	GI	On-Demand	Anodyne	CCR5	56	40
C[C@H](NC(=O)[C@H]1CCC[C@H]1c1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450964696	GI	On-Demand	Anodyne	CCR5	56	40
C[C@H](NC(=O)[C@@H]1CCC[C@H]1c1ccccc1)C1CCN(CC(F)(F)F)CC1	ZINC000450964698	GI	On-Demand	Anodyne	CCR5	56	40
Cc1nc2ccnn2cc1C(=O)N1CCN(CC(C)(C)O)C[C@H]1C	ZINC000450964707	EC	On-Demand	Anodyne	HCRTR2	40	36
Cc1nc2ccnn2cc1C(=O)N1CCN(CC(C)(C)O)C[C@@H]1C	ZINC000450964710	EC	On-Demand	Anodyne	HCRTR2	40	36
CCOC(=O)c1ccc(CS(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	ZINC000450964716	EF	On-Demand	Anodyne	Q4Q5W4_LEIMA	18	40
CCOC(=O)c1ccc(CS(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	ZINC000450964718	EF	On-Demand	Anodyne	Q4Q5W4_LEIMA	18	40
CCOC(=O)c1ccc(CS(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	ZINC000450964720	EF	On-Demand	Anodyne	Q4Q5W4_LEIMA	18	40
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964727	FI	On-Demand	Anodyne	PRCP	24	53
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964727	FI	On-Demand	Anodyne	COLA	103	39
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964727	FI	On-Demand	Anodyne	CPT1A	99	39
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964730	FI	On-Demand	Anodyne	PRCP	24	53
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964730	FI	On-Demand	Anodyne	COLA	103	39
O=C([C@@H]1C[C@H]1C(F)(F)F)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964730	FI	On-Demand	Anodyne	CPT1A	99	39
Cn1cc(CCNC(=O)c2cnc(C3CC3)nc2)c2ccc(Cl)cc21	ZINC000450964733	FG	On-Demand	Anodyne	MC5R	36	41
Cc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450964736	FE	On-Demand	Anodyne	MMP13	41	40
Cc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450964736	FE	On-Demand	Anodyne	ADAM17	21	40
Cc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450964736	FE	On-Demand	Anodyne	MMP2	27	42
Cc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450964736	FE	On-Demand	Anodyne	MMP14	19	40
Cc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450964736	FE	On-Demand	Anodyne	MMP9	17	40
Cc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450964736	FE	On-Demand	Anodyne	ADAMTS4	63	35
Cc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450964736	FE	On-Demand	Anodyne	MMP1	23	40
C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CCC[C@H]1C	ZINC000450964755	GE	On-Demand	Anodyne	MMP13	19	42
C[C@@H]1[C@@H](NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CCC[C@H]1C	ZINC000450964755	GE	On-Demand	Anodyne	LUXN	0	46
C[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)[C@@H]1C	ZINC000450964756	GE	On-Demand	Anodyne	MMP13	19	42
C[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)[C@@H]1C	ZINC000450964756	GE	On-Demand	Anodyne	LUXN	0	46
C[C@@H]1CCC[C@H](NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)[C@@H]1C	ZINC000450964757	GE	On-Demand	Anodyne	MMP13	19	42
C[C@@H]1CCC[C@H](NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)[C@@H]1C	ZINC000450964757	GE	On-Demand	Anodyne	LUXN	0	46
C[C@H](NC(=O)c1cncc(Cl)c1)C1CCN(CC(F)(F)F)CC1	ZINC000450964758	EG	On-Demand	Anodyne	CACNA1I	53	37
C[C@H](NC(=O)c1cncc(Cl)c1)C1CCN(CC(F)(F)F)CC1	ZINC000450964758	EG	On-Demand	Anodyne	HPGDS	34	40
C[C@H]1[C@H](C)CCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964759	GE	On-Demand	Anodyne	MMP13	19	42
C[C@H]1[C@H](C)CCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964759	GE	On-Demand	Anodyne	LUXN	0	46
CO[C@H](CS(=O)(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccccc1	ZINC000450964762	FF	On-Demand	Anodyne	AKR1C3	22	40
CO[C@@H](CS(=O)(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccccc1	ZINC000450964763	FF	On-Demand	Anodyne	AKR1C3	22	40
C[C@@H](NC(=O)c1cncc(Cl)c1)C1CCN(CC(F)(F)F)CC1	ZINC000450964768	EG	On-Demand	Anodyne	CACNA1I	53	37
C[C@@H](NC(=O)c1cncc(Cl)c1)C1CCN(CC(F)(F)F)CC1	ZINC000450964768	EG	On-Demand	Anodyne	HPGDS	34	40
Cc1nn(C)cc1CC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964770	FG	On-Demand	Anodyne	PRCP	44	59
Cc1nn(C)cc1CC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964770	FG	On-Demand	Anodyne	COLA	121	42
Cc1nn(C)cc1CC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964770	FG	On-Demand	Anodyne	CPT1A	105	42
Cc1nn(C)cc1CC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964771	FG	On-Demand	Anodyne	PRCP	44	59
Cc1nn(C)cc1CC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964771	FG	On-Demand	Anodyne	COLA	121	42
Cc1nn(C)cc1CC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450964771	FG	On-Demand	Anodyne	CPT1A	105	42
O=c1n(CCc2ccc(Cl)cc2)nnn1C1CC1	ZINC000450964776	CD	On-Demand	Anodyne	CACNA1D	50	42
CC(=O)CCCCCOc1cc(F)cc(C#N)c1	ZINC000450964779	BG	On-Demand	Mild	PLA2G4B	52	30
Cc1cc(C)c(NS(=O)(=O)c2ccc(C3CC3)cc2)c(C)c1	ZINC000450964790	DI	On-Demand	Anodyne	FFAR4	49	68
CN1CCN(c2ccc(Cl)cc2NS(=O)(=O)c2sccc2F)CC1	ZINC000450964802	GG	On-Demand	Anodyne	DRD1	62	39
CN1CCN(c2ccc(Cl)cc2NS(=O)(=O)c2sccc2F)CC1	ZINC000450964802	GG	On-Demand	Anodyne	HTR6	15	45
CN1CCN(c2ccc(Cl)cc2NS(=O)(=O)c2sccc2F)CC1	ZINC000450964802	GG	On-Demand	Anodyne	WDR5	33	40
COCc1noc(CN2CCN(C(=O)Cc3ccc(Cl)c(OC)c3)CC2)n1	ZINC000450964813	GD	On-Demand	Anodyne	CCR1	36	44
CCc1ccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)cc1	ZINC000450964827	DG	On-Demand	Anodyne	PTPRB	61	38
CCc1ccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)cc1	ZINC000450964829	DG	On-Demand	Anodyne	PTPRB	61	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc[nH]n2)cc1	ZINC000450964830	DD	On-Demand	Anodyne	ADRB2	22	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc[nH]n2)cc1	ZINC000450964830	DD	On-Demand	Anodyne	CA1	34	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc[nH]n2)cc1	ZINC000450964830	DD	On-Demand	Anodyne	ADAMTS4	41	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc[nH]n2)cc1	ZINC000450964830	DD	On-Demand	Anodyne	MTNN	48	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc[nH]n2)cc1	ZINC000450964830	DD	On-Demand	Anodyne	PFK	0	42
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	CA2	23	52
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	CA1	26	43
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	MMP13	23	40
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	GRM4	16	45
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	CA14	15	44
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	MMP2	15	40
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	CA12	18	43
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	CA9	19	43
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	LEF	57	37
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	IDO1	36	43
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	FFAR4	31	45
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	MTCA1	24	41
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450964831	EH	On-Demand	Anodyne	P96878_MYCTU	30	41
CCc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964833	GG	On-Demand	Anodyne	ADAM17	22	44
CCc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964833	GG	On-Demand	Anodyne	PRTN3	45	35
CCc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964833	GG	On-Demand	Anodyne	ADAMTS4	40	31
CCc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964833	GG	On-Demand	Anodyne	LUXN	0	47
CCc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964833	GG	On-Demand	Anodyne	ADIPOR1	0	41
CCc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450964833	GG	On-Demand	Anodyne	ADIPOR2	0	41
Cc1ccc2cc(S(=O)(=O)N3CCN(C)CC3)ccc2c1	ZINC000450964838	DE	On-Demand	Anodyne	PDE5A	22	42
Cc1ccc2cc(S(=O)(=O)N3CCN(C)CC3)ccc2c1	ZINC000450964838	DE	On-Demand	Anodyne	PKM	41	49
Cc1ccc2cc(S(=O)(=O)N3CCN(C)CC3)ccc2c1	ZINC000450964838	DE	On-Demand	Anodyne	CYP2A5	0	41
Cc1ccc2cc(S(=O)(=O)N3CCN(C)CC3)ccc2c1	ZINC000450964838	DE	On-Demand	Anodyne	AKR1C3	30	40
CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(C)c2C)cnc1C(F)F	ZINC000450964839	GH	On-Demand	Anodyne	RCE1	0	40
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450964846	DE	On-Demand	Anodyne	MC4R	36	43
C[C@@H](O)CN1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450964848	DE	On-Demand	Anodyne	MC4R	36	43
C[C@@H](O)CN1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000450964849	DE	On-Demand	Anodyne	MC4R	36	43
C[C@@H](O)CN1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000450964850	DE	On-Demand	Anodyne	MC4R	36	43
Cc1cc(F)c(CC(=O)N2CCN(C[C@@H](C)O)CC2)cc1F	ZINC000450964855	DD	On-Demand	Anodyne	DPP4	24	40
Cc1cc(F)c(CC(=O)N2CCN(C[C@@H](C)O)CC2)cc1F	ZINC000450964855	DD	On-Demand	Anodyne	GPR183	0	41
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	KCNA5	22	49
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP13	79	42
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	NPY2R	71	40
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	ADAM17	47	42
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP2	40	42
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP3	52	42
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP8	25	41
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP14	20	41
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	NPY5R	24	40
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP9	49	42
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP12	26	41
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP7	44	38
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	IAP	0	44
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	MMP1	56	39
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	LUXN	0	44
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	ADIPOR1	0	44
COc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450964876	GD	On-Demand	Anodyne	ADIPOR2	0	44
CCc1csc(NS(=O)(=O)c2cc(C(=O)OC)cc(Cl)c2C)n1	ZINC000450964877	FG	On-Demand	Anodyne	HSD17B2	15	52
COc1cc(CC(=O)N2CCN(c3nc4ccccc4o3)[C@@H](C)C2)ccc1O	ZINC000450964885	GF	On-Demand	Anodyne	SSTR5	64	43
COc1cc(CC(=O)N2CCN(c3nc4ccccc4o3)[C@@H](C)C2)ccc1O	ZINC000450964885	GF	On-Demand	Anodyne	RORC	41	32
COc1cc(CC(=O)N2CCN(c3nc4ccccc4o3)[C@H](C)C2)ccc1O	ZINC000450964886	GF	On-Demand	Anodyne	SSTR5	64	43
COc1cc(CC(=O)N2CCN(c3nc4ccccc4o3)[C@H](C)C2)ccc1O	ZINC000450964886	GF	On-Demand	Anodyne	RORC	41	32
CCOC(=O)c1ccc(CS(=O)(=O)Nc2ccc(N3CCCC3)nc2)cc1	ZINC000450964887	GF	On-Demand	Anodyne	DGAT1	29	42
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc[nH]n2)cc1	ZINC000450964892	FC	On-Demand	Anodyne	MTNN	79	38
CCCCN(CC)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450964899	EE	On-Demand	Anodyne	RORB	0	43
CCc1ccccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450964918	DH	On-Demand	Anodyne	PRTN3	55	36
CCc1ccccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450964918	DH	On-Demand	Anodyne	UQCRB	0	41
C=CC(C)(C)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450964923	EF	On-Demand	Mild	SIRT3	58	33
CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964924	FG	On-Demand	Anodyne	CCR3	44	44
CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964924	FG	On-Demand	Anodyne	FAAH	21	42
CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964924	FG	On-Demand	Anodyne	MCHR1	19	40
CC[C@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964924	FG	On-Demand	Anodyne	RHOA	0	41
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964926	FG	On-Demand	Anodyne	CCR3	44	44
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964926	FG	On-Demand	Anodyne	FAAH	21	42
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964926	FG	On-Demand	Anodyne	MCHR1	19	40
CC[C@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964926	FG	On-Demand	Anodyne	RHOA	0	41
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964929	FG	On-Demand	Anodyne	CCR3	44	44
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964929	FG	On-Demand	Anodyne	FAAH	21	42
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964929	FG	On-Demand	Anodyne	MCHR1	19	40
CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964929	FG	On-Demand	Anodyne	RHOA	0	41
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964931	FG	On-Demand	Anodyne	CCR3	44	44
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964931	FG	On-Demand	Anodyne	FAAH	21	42
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964931	FG	On-Demand	Anodyne	MCHR1	19	40
CC[C@@H]1CCC[C@H]1C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450964931	FG	On-Demand	Anodyne	RHOA	0	41
COC(=O)CC1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450964934	EH	On-Demand	Anodyne	P2RX7	15	43
COC(=O)CC1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450964934	EH	On-Demand	Anodyne	SLC6A9	18	44
COC(=O)CC1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450964934	EH	On-Demand	Anodyne	HCN1	53	33
COC(=O)CC1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450964934	EH	On-Demand	Anodyne	HCN4	51	33
Cc1csc(S(=O)(=O)Nc2cc(Cl)ccc2N2CCOCC2)c1	ZINC000450964937	FG	On-Demand	Anodyne	CREBBP	42	45
Cc1csc(S(=O)(=O)Nc2cc(Cl)ccc2N2CCOCC2)c1	ZINC000450964937	FG	On-Demand	Anodyne	BRD9	42	45
NC(=O)c1ncc(Br)cc1N1CC[C@@H](CCCO)C1	ZINC000450964953	ED	On-Demand	Anodyne	SIRT3	43	33
NC(=O)c1ncc(Br)cc1N1CC[C@H](CCCO)C1	ZINC000450964954	ED	On-Demand	Anodyne	SIRT3	43	33
C[C@@H](O)CN(C)C1CCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)CC1	ZINC000450964955	GD	On-Demand	Anodyne	PDE4D	15	41
C[C@H](O)CN(C)C1CCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)CC1	ZINC000450964957	GD	On-Demand	Anodyne	PDE4D	15	41
C[C@H](O)CN(C)C1CCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)CC1	ZINC000450964959	GD	On-Demand	Anodyne	PDE4D	15	41
C[C@@H](O)CN(C)C1CCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)CC1	ZINC000450964961	GD	On-Demand	Anodyne	PDE4D	15	41
CC(C)N1C(=O)N[C@@H]2CN(CCc3ccc(Cl)cc3)CC[C@@H]21	ZINC000450964972	DF	On-Demand	Anodyne	BIRC2	58	42
CCCn1nccc1NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1	ZINC000450964976	FG	On-Demand	Anodyne	OXTR	41	41
CC(C)n1nc2c(c1NC(=O)c1ccc(-c3ccncc3)c(F)c1)CCC2	ZINC000450964982	FI	On-Demand	Anodyne	ROCK2	37	41
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000450964989	GD	On-Demand	Anodyne	HTR7	15	40
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000450964989	GD	On-Demand	Anodyne	HSD11B1	18	50
CCCn1nccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450964999	FF	On-Demand	Anodyne	PFK	0	43
C=CC(C)(C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450965000	EF	On-Demand	Mild	HTR1D	22	41
C=CC(C)(C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450965000	EF	On-Demand	Mild	NPY2R	25	46
C=CC(C)(C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450965000	EF	On-Demand	Mild	CCR3	27	40
C=CC(C)(C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450965000	EF	On-Demand	Mild	FAAH	23	46
COC(=O)CC1(CNC(=O)c2ccc(N3CCC3)nc2)CCCCC1	ZINC000450965013	EF	On-Demand	Anodyne	HCN1	55	33
COC(=O)CC1(CNC(=O)c2ccc(N3CCC3)nc2)CCCCC1	ZINC000450965013	EF	On-Demand	Anodyne	HCN4	53	33
CC[C@H](CC(F)(F)F)C(=O)N[C@@H](C(=O)OC)c1ccc(OC)c(O)c1	ZINC000450965045	FF	On-Demand	Anodyne	FOLH1	35	40
O=C(COc1cccc2c1C(=O)CC2)NCc1ccc(OC(F)(F)F)cc1	ZINC000450965047	GG	On-Demand	Anodyne	TRPV1	0	42
O=C(COc1cccc2c1C(=O)CC2)NCc1ccc(OC(F)(F)F)cc1	ZINC000450965047	GG	On-Demand	Anodyne	SCN9A	0	44
CC[C@H](CC(F)(F)F)C(=O)N[C@H](C(=O)OC)c1ccc(OC)c(O)c1	ZINC000450965048	FF	On-Demand	Anodyne	FOLH1	35	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](C(=O)OC)c1ccc(OC)c(O)c1	ZINC000450965050	FF	On-Demand	Anodyne	FOLH1	35	40
CC[C@@H](CC(F)(F)F)C(=O)N[C@H](C(=O)OC)c1ccc(OC)c(O)c1	ZINC000450965053	FF	On-Demand	Anodyne	FOLH1	35	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450965063	GF	On-Demand	Anodyne	SIGMAR1	23	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450965063	GF	On-Demand	Anodyne	CCR3	22	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450965063	GF	On-Demand	Anodyne	PREP	49	42
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450965063	GF	On-Demand	Anodyne	BIRC2	44	38
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450965066	GF	On-Demand	Anodyne	SIGMAR1	23	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450965066	GF	On-Demand	Anodyne	CCR3	22	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450965066	GF	On-Demand	Anodyne	PREP	49	42
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450965066	GF	On-Demand	Anodyne	BIRC2	44	38
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965076	FG	On-Demand	Anodyne	CCR3	42	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965076	FG	On-Demand	Anodyne	FAAH	19	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965076	FG	On-Demand	Anodyne	MCHR1	24	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965076	FG	On-Demand	Anodyne	RHOA	0	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965076	FG	On-Demand	Anodyne	BRD4	17	46
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965076	FG	On-Demand	Anodyne	BRD2	30	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965076	FG	On-Demand	Anodyne	BRD3	25	46
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965079	FG	On-Demand	Anodyne	CCR3	42	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965079	FG	On-Demand	Anodyne	FAAH	19	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965079	FG	On-Demand	Anodyne	MCHR1	24	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965079	FG	On-Demand	Anodyne	RHOA	0	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965079	FG	On-Demand	Anodyne	BRD4	17	46
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965079	FG	On-Demand	Anodyne	BRD2	30	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@@H](C)C3)c2)CC1	ZINC000450965079	FG	On-Demand	Anodyne	BRD3	25	46
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)c2)CC1	ZINC000450965082	FG	On-Demand	Anodyne	CCR3	42	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)c2)CC1	ZINC000450965082	FG	On-Demand	Anodyne	FAAH	19	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)c2)CC1	ZINC000450965082	FG	On-Demand	Anodyne	MCHR1	24	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)c2)CC1	ZINC000450965082	FG	On-Demand	Anodyne	RHOA	0	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)c2)CC1	ZINC000450965082	FG	On-Demand	Anodyne	BRD4	17	46
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)c2)CC1	ZINC000450965082	FG	On-Demand	Anodyne	BRD2	30	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@@H](C)[C@H](C)C3)c2)CC1	ZINC000450965082	FG	On-Demand	Anodyne	BRD3	25	46
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc2c(c1)OCCO2	ZINC000450965083	GD	On-Demand	Anodyne	BMP1	57	35
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)c2)CC1	ZINC000450965085	FG	On-Demand	Anodyne	CCR3	42	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)c2)CC1	ZINC000450965085	FG	On-Demand	Anodyne	FAAH	19	43
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)c2)CC1	ZINC000450965085	FG	On-Demand	Anodyne	MCHR1	24	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)c2)CC1	ZINC000450965085	FG	On-Demand	Anodyne	RHOA	0	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)c2)CC1	ZINC000450965085	FG	On-Demand	Anodyne	BRD4	17	46
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)c2)CC1	ZINC000450965085	FG	On-Demand	Anodyne	BRD2	30	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)c2)CC1	ZINC000450965085	FG	On-Demand	Anodyne	BRD3	25	46
COCCn1cc(N2C[C@H](C(=O)Nc3c(F)cccc3OC)CC2=O)cn1	ZINC000450965086	GD	On-Demand	Anodyne	SSTR2	40	35
COCCn1cc(N2C[C@H](C(=O)Nc3c(F)cccc3OC)CC2=O)cn1	ZINC000450965086	GD	On-Demand	Anodyne	SSTR1	51	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC2CCCCCC2)cc1	ZINC000450965088	EG	On-Demand	Anodyne	MMP13	24	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC2CCCCCC2)cc1	ZINC000450965088	EG	On-Demand	Anodyne	F13A1	27	41
COCCn1cc(N2C[C@@H](C(=O)Nc3c(F)cccc3OC)CC2=O)cn1	ZINC000450965090	GD	On-Demand	Anodyne	SSTR2	40	35
COCCn1cc(N2C[C@@H](C(=O)Nc3c(F)cccc3OC)CC2=O)cn1	ZINC000450965090	GD	On-Demand	Anodyne	SSTR1	51	36
CN(C)CCn1ccc2ccc(NS(=O)(=O)c3sccc3Cl)cc21	ZINC000450965114	GH	On-Demand	Anodyne	HTR6	16	66
CN(C)CCn1ccc2ccc(NS(=O)(=O)c3sccc3Cl)cc21	ZINC000450965114	GH	On-Demand	Anodyne	NAMPT	0	52
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2OC(F)F)c(OC)c1	ZINC000450965117	FE	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc(CNC(=O)CCN[C@@H]2CCC[C@H]2OC(F)F)c(OC)c1	ZINC000450965117	FE	On-Demand	Anodyne	MTNR1B	40	36
COc1cc(CC(=O)N[C@@H]2CC[C@H](C)C2)ccc1Cl	ZINC000450965142	CG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N[C@@H]2CC[C@H](C)C2)ccc1Cl	ZINC000450965142	CG	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@H]2CC[C@H](C)C2)ccc1Cl	ZINC000450965143	CG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N[C@H]2CC[C@H](C)C2)ccc1Cl	ZINC000450965143	CG	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@H]2CC[C@@H](C)C2)ccc1Cl	ZINC000450965144	CG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N[C@H]2CC[C@@H](C)C2)ccc1Cl	ZINC000450965144	CG	On-Demand	Anodyne	CAN2	0	41
COc1cc(CC(=O)N[C@@H]2CC[C@@H](C)C2)ccc1Cl	ZINC000450965145	CG	On-Demand	Anodyne	TRPV1	0	42
COc1cc(CC(=O)N[C@@H]2CC[C@@H](C)C2)ccc1Cl	ZINC000450965145	CG	On-Demand	Anodyne	CAN2	0	41
COc1ccc(C)nc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450965150	GD	On-Demand	Anodyne	LUXN	0	43
C[C@@H]1CC[C@@H](NC(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450965191	DF	On-Demand	Anodyne	PDEC	0	41
C[C@@H]1CC[C@@H](NC(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450965192	DF	On-Demand	Anodyne	PDEC	0	41
C[C@@H]1CC[C@H](NC(=O)Cc2ccccc2O[C@H]2CCOC2)C1	ZINC000450965193	DF	On-Demand	Anodyne	PDEC	0	41
C[C@@H]1CC[C@H](NC(=O)Cc2ccccc2O[C@@H]2CCOC2)C1	ZINC000450965194	DF	On-Demand	Anodyne	PDEC	0	41
COC(=O)[C@@H](NS(=O)(=O)c1cc(C)cs1)C(C)C	ZINC000450965197	CD	On-Demand	Anodyne	LEF	26	44
C=CCN(CC=C)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450965204	ED	On-Demand	Mild	RORC	17	44
C=CCN(CC=C)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450965204	ED	On-Demand	Mild	RORB	0	44
O=C(CCc1nc2cnccc2[nH]1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965219	FE	On-Demand	Anodyne	CACNA1I	42	33
Cc1sc(-c2ccc3c(c2)OCO3)nc1C1CCOCC1	ZINC000450965222	DH	On-Demand	Anodyne	CLK4	49	35
CC(C)C[C@@H]1C[C@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965228	DG	On-Demand	Anodyne	CACNA1I	53	34
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1cnn(C)c1	ZINC000450965229	FD	On-Demand	Anodyne	DRD2	29	40
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1cnn(C)c1	ZINC000450965229	FD	On-Demand	Anodyne	DRD4	0	45
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1cnn(C)c1	ZINC000450965229	FD	On-Demand	Anodyne	HTR2A	19	44
CNC(=O)[C@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H]1c1cnn(C)c1	ZINC000450965229	FD	On-Demand	Anodyne	SLC18A3	0	43
O=S(=O)(CCC1CCCCC1)NCCCn1ccnc1	ZINC000450965232	CE	On-Demand	Anodyne	CAMC	0	48
O=S(=O)(CCC1CCCCC1)NCCCn1ccnc1	ZINC000450965232	CE	On-Demand	Anodyne	QPCT	35	47
Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n(C)n1	ZINC000450965239	EE	On-Demand	Anodyne	PFK	0	65
C=CC(C)(C)C(=O)N[C@@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450965242	DG	On-Demand	Mild	CTRB_BOVIN	53	41
C=CC(C)(C)C(=O)N[C@H](Cc1ccccc1Cl)C(=O)OCC	ZINC000450965244	DG	On-Demand	Mild	CTRB_BOVIN	53	41
COCCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450965245	CE	On-Demand	Anodyne	HTR7	17	44
COCCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450965245	CE	On-Demand	Anodyne	NPY1R	20	45
COC(=O)c1cccc(CSc2nc(C)c(C)[nH]2)c1Cl	ZINC000450965267	DH	On-Demand	Anodyne	METAP2	0	42
COC(=O)c1ccc(-c2csc(=NC3CCCC3)[nH]2)o1	ZINC000450965272	CF	On-Demand	Anodyne	PDE7A	26	44
CCOC(=O)C1(CNC(=O)c2ccc(Br)cc2C#N)CC1	ZINC000450965279	FE	On-Demand	Mild	RPS27	42	34
CC(C)(C(=O)NCC1CCN(CC(F)(F)F)CC1)c1cccc2ccccc12	ZINC000450965285	GJ	On-Demand	Anodyne	HTR4	70	37
CC(C)(C(=O)NCC1CCN(CC(F)(F)F)CC1)c1cccc2ccccc12	ZINC000450965285	GJ	On-Demand	Anodyne	KCNJ11	62	33
CC(C)(C(=O)NCC1CCN(CC(F)(F)F)CC1)c1cccc2ccccc12	ZINC000450965285	GJ	On-Demand	Anodyne	CACNA1I	64	39
CCOC(=O)C1(CNC(=O)CCOc2cccc(OC)c2)CC1	ZINC000450965289	DD	On-Demand	Anodyne	MTNR1A	51	43
CCOC(=O)C1(CNC(=O)CCOc2cccc(OC)c2)CC1	ZINC000450965289	DD	On-Demand	Anodyne	MTNR1B	48	43
CN(CC1(c2ccccc2)CC1)C(=O)C1CC(C)(O)C1	ZINC000450965297	CE	On-Demand	Anodyne	SLC6A2	0	44
O=C(NCC1CCN(CC(F)(F)F)CC1)C1(C(F)(F)F)CCC1	ZINC000450965310	EG	On-Demand	Anodyne	CACNA1I	55	40
O=S(=O)(CCC1CCCCC1)Nc1ccccc1OCCn1ccnc1	ZINC000450965317	GH	On-Demand	Anodyne	TBXAS1	26	44
O=S(=O)(CCC1CCCCC1)Nc1ccccc1OCCn1ccnc1	ZINC000450965317	GH	On-Demand	Anodyne	CAMC	0	42
CC(=O)c1cccc(CS(=O)(=O)c2ccc(N3CCCC3=O)cc2)c1	ZINC000450965323	FF	On-Demand	Anodyne	AKR1C3	25	46
C/C=C/C[C@@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450965337	CD	On-Demand	Anodyne	HPGDS	15	42
CCNS(=O)(=O)c1cnccc1OCC	ZINC000450965340	BC	On-Demand	Anodyne	CA14	22	66
CCNS(=O)(=O)c1cnccc1OCC	ZINC000450965340	BC	On-Demand	Anodyne	Q95J97_RABIT	0	40
C/C=C\C[C@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450965344	CD	On-Demand	Anodyne	HPGDS	15	42
COc1ccc(CC(=O)Nc2cccc(C(C)(F)F)c2)c(Cl)c1OC	ZINC000450965345	FJ	On-Demand	Anodyne	CPT1A	43	30
COc1ccc(CC(=O)Nc2cccc(C(C)(F)F)c2)c(Cl)c1OC	ZINC000450965345	FJ	On-Demand	Anodyne	IMDH_CRYPV	43	38
COc1ccc(CC(=O)Nc2cccc(C(C)(F)F)c2)c(Cl)c1OC	ZINC000450965345	FJ	On-Demand	Anodyne	KCNK3	54	37
COc1ccc(CC(=O)Nc2cccc(C(C)(F)F)c2)c(Cl)c1OC	ZINC000450965345	FJ	On-Demand	Anodyne	KCNK9	45	37
C/C=C/C[C@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450965346	CD	On-Demand	Anodyne	HPGDS	15	42
C/C=C\C[C@@H](CO)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450965347	CD	On-Demand	Anodyne	HPGDS	15	42
CCc1ccc(S(=O)(=O)CCCCCC(C)=O)cc1	ZINC000450965352	CG	On-Demand	Anodyne	THRB	39	47
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@H]2C)cc1	ZINC000450965353	EF	On-Demand	Anodyne	FKBP1A	32	43
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@H]2C)cc1	ZINC000450965353	EF	On-Demand	Anodyne	MIP	0	40
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@@H]2C)cc1	ZINC000450965355	EF	On-Demand	Anodyne	FKBP1A	32	43
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@@H]2C)cc1	ZINC000450965355	EF	On-Demand	Anodyne	MIP	0	40
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](O)C1CCC1	ZINC000450965361	EE	On-Demand	Anodyne	TIMP3	51	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](O)C1CCC1	ZINC000450965363	EE	On-Demand	Anodyne	TIMP3	51	33
CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](O)C1CCC1	ZINC000450965365	EE	On-Demand	Anodyne	TIMP3	51	33
CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)[C@H](O)C1CCC1	ZINC000450965367	EE	On-Demand	Anodyne	TIMP3	51	33
Cn1cc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)nc2)c(C(F)(F)F)n1	ZINC000450965373	GD	On-Demand	Anodyne	SFRP1	49	30
Cn1cc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)nc2)c(C(F)(F)F)n1	ZINC000450965373	GD	On-Demand	Anodyne	WNT3	51	32
CC(F)(F)c1cccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)c1	ZINC000450965383	CH	On-Demand	Anodyne	KCNK3	56	33
CC(F)(F)c1cccc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)c1	ZINC000450965383	CH	On-Demand	Anodyne	KCNK9	53	34
CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450965387	FF	On-Demand	Anodyne	LDLR	0	44
C[C@@H]1CCCCN1S(=O)(=O)c1sccc1Cl	ZINC000450965414	CF	On-Demand	Anodyne	AKR1C3	25	46
C[C@H]1CCCCN1S(=O)(=O)c1sccc1Cl	ZINC000450965415	CF	On-Demand	Anodyne	AKR1C3	25	46
N#CCc1ccc(S(=O)(=O)N2CCOCC2)c(Cl)c1	ZINC000450965425	DD	On-Demand	Mild	TRPV4	32	40
N#CCc1ccc(S(=O)(=O)N2CCOCC2)c(Cl)c1	ZINC000450965425	DD	On-Demand	Mild	MURF	0	40
COCc1nn(C)cc1C(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450965426	FF	On-Demand	Anodyne	NQO2	17	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	F2	16	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	NR3C1	0	54
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	NR3C2	0	52
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	ACE	21	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	SSTR2	40	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	OPRM1	0	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	OPRD1	0	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MME	26	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	EDNRB	48	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	EDNRA	40	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	TACR1	35	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MC4R	41	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	BMP1	27	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	TACR2	30	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	KCNA5	0	77
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	CCKAR	113	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	CTSL	30	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	BRS3	27	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	NMBR	66	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MC3R	61	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MC5R	61	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MMP2	45	64
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MMP8	37	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MMP14	24	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	GRPR	70	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	ECE1	63	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MMP11	73	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	CCKBR	93	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	GHSR	68	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	ALOX15	25	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MMP9	35	64
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MC1R	83	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MMP7	16	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	MMP1	20	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	NPR	31	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	SLC15A2	0	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	KISS1R	60	31
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	ERAP2	40	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450965466	GG	On-Demand	Anodyne	LASB	0	40
CC(C)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450965467	GG	On-Demand	Anodyne	ADAMTS4	47	35
CC(C)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450965467	GG	On-Demand	Anodyne	POL	0	46
CC(C)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450965467	GG	On-Demand	Anodyne	GPR119	22	42
CC(C)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450965467	GG	On-Demand	Anodyne	LUXN	0	46
CC(C)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450965467	GG	On-Demand	Anodyne	ADIPOR1	0	40
CC(C)c1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450965467	GG	On-Demand	Anodyne	ADIPOR2	0	40
CN(C)C(=O)CCCSc1ccc(Br)c(Cl)c1	ZINC000450965481	EI	On-Demand	Anodyne	THRB	20	46
CN(C)C(=O)CCCCSc1ccc(Br)c(Cl)c1	ZINC000450965482	FI	On-Demand	Anodyne	THRB	0	48
C=Cc1ccc(S(=O)(=O)N(CCCN(C)C)CCCN(C)C)cc1	ZINC000450965493	FE	On-Demand	Anodyne	BDKRB1	17	40
CCCOc1cccc(CNC(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450965494	FG	On-Demand	Anodyne	PDS	42	35
C[C@H]1CN(C(=O)[C@@H]2CCCCC2(F)F)CCN1c1nc2ccccc2o1	ZINC000450965499	FH	On-Demand	Anodyne	NPBWR1	40	38
C[C@@H]1CN(C(=O)[C@@H]2CCCCC2(F)F)CCN1c1nc2ccccc2o1	ZINC000450965500	FH	On-Demand	Anodyne	NPBWR1	40	38
CCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)cc(Cl)c2C)CC1	ZINC000450965507	FE	On-Demand	Anodyne	HTR4	36	42
CCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)cc(Cl)c2C)CC1	ZINC000450965507	FE	On-Demand	Anodyne	CACNA1I	53	36
CCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)cc(Cl)c2C)CC1	ZINC000450965507	FE	On-Demand	Anodyne	CCR8	93	40
CCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)cc(Cl)c2C)CC1	ZINC000450965507	FE	On-Demand	Anodyne	SFRP1	94	35
CCN1CCC(NS(=O)(=O)c2cc(C(=O)OC)cc(Cl)c2C)CC1	ZINC000450965507	FE	On-Demand	Anodyne	WNT3	55	32
COC(=O)CNC(=O)CSc1ccc(Br)c(Cl)c1	ZINC000450965543	FE	On-Demand	Anodyne	FAS	52	41
CCOC(=O)c1ccc(CS(=O)(=O)NCCN2CCOCC2)cc1	ZINC000450965544	FC	On-Demand	Anodyne	CNR1	0	43
CCOC(=O)c1ccc(CS(=O)(=O)NCCN2CCOCC2)cc1	ZINC000450965544	FC	On-Demand	Anodyne	THRB	0	42
CCOC(=O)c1ccc(CS(=O)(=O)NCCN2CCOCC2)cc1	ZINC000450965544	FC	On-Demand	Anodyne	CASR	22	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCN2CCOCC2)cc1	ZINC000450965544	FC	On-Demand	Anodyne	NOD2	24	41
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450965546	FF	On-Demand	Anodyne	KCNA5	39	47
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450965546	FF	On-Demand	Anodyne	MMP16	0	42
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450965546	FF	On-Demand	Anodyne	IAP	0	41
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450965546	FF	On-Demand	Anodyne	IDO1	31	50
CO[C@H](C)CS(=O)(=O)Nc1nc2ccc(OCC(F)(F)F)cc2s1	ZINC000450965547	GG	On-Demand	Anodyne	CSNK1D	40	42
CO[C@@H](C)CS(=O)(=O)Nc1nc2ccc(OCC(F)(F)F)cc2s1	ZINC000450965548	GG	On-Demand	Anodyne	CSNK1D	40	42
COC(=O)c1ccc(C)c(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450965551	EG	On-Demand	Anodyne	PRTN3	44	31
CCC(=O)CCCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965552	EG	On-Demand	Anodyne	ACE	42	38
CCC(=O)CCCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965552	EG	On-Demand	Anodyne	SLC6A1	117	40
CCC(=O)CCCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965552	EG	On-Demand	Anodyne	SIGMAR1	40	49
CCC(=O)CCCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965552	EG	On-Demand	Anodyne	PREP	54	45
CCC(=O)CCCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965552	EG	On-Demand	Anodyne	ABCB1	0	40
CCC(=O)CCCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965552	EG	On-Demand	Anodyne	CYP2J2	50	39
CCC(=O)CCCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965552	EG	On-Demand	Anodyne	BIRC2	66	51
CCC(=O)CCCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965553	EG	On-Demand	Anodyne	ACE	42	38
CCC(=O)CCCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965553	EG	On-Demand	Anodyne	SLC6A1	117	40
CCC(=O)CCCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965553	EG	On-Demand	Anodyne	SIGMAR1	40	49
CCC(=O)CCCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965553	EG	On-Demand	Anodyne	PREP	54	45
CCC(=O)CCCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965553	EG	On-Demand	Anodyne	ABCB1	0	40
CCC(=O)CCCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965553	EG	On-Demand	Anodyne	CYP2J2	50	39
CCC(=O)CCCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965553	EG	On-Demand	Anodyne	BIRC2	66	51
CCOC(=O)c1cc(S(=O)(=O)Nc2ccccc2CC)cnc1C(F)F	ZINC000450965557	GH	On-Demand	Anodyne	PRTN3	54	37
Nc1ncccc1CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965558	FF	On-Demand	Anodyne	SIGMAR1	27	42
Nc1ncccc1CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965558	FF	On-Demand	Anodyne	CCR3	25	43
Nc1ncccc1CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965558	FF	On-Demand	Anodyne	PREP	54	40
Nc1ncccc1CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965558	FF	On-Demand	Anodyne	BIRC2	51	42
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@@H]2C[C@@H](OCC)C23CCCC3)C1	ZINC000450965559	GF	On-Demand	Anodyne	RHODESAIN	0	44
Nc1ncccc1CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965560	FF	On-Demand	Anodyne	SIGMAR1	27	42
Nc1ncccc1CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965560	FF	On-Demand	Anodyne	CCR3	25	43
Nc1ncccc1CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965560	FF	On-Demand	Anodyne	PREP	54	40
Nc1ncccc1CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450965560	FF	On-Demand	Anodyne	BIRC2	51	42
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@H]2C[C@H](OCC)C23CCCC3)C1	ZINC000450965561	GF	On-Demand	Anodyne	RHODESAIN	0	44
COC(=O)[C@@H](NS(=O)(=O)c1cc(C(F)(F)F)ccc1O)C(C)C	ZINC000450965562	FD	On-Demand	Anodyne	ADAMTS4	31	41
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@@H]2C[C@H](OCC)C23CCCC3)C1	ZINC000450965563	GF	On-Demand	Anodyne	RHODESAIN	0	44
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@H]2C[C@@H](OCC)C23CCCC3)C1	ZINC000450965564	GF	On-Demand	Anodyne	RHODESAIN	0	44
CC(=O)N1CCN(C(=O)CSc2ccc(Br)c(Cl)c2)CC1	ZINC000450965572	GF	On-Demand	Anodyne	THRB	15	43
Cc1cc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c2cccnc2c1C	ZINC000450965577	GG	On-Demand	Anodyne	NFKBIA	0	40
Cc1cc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c2cccnc2c1C	ZINC000450965577	GG	On-Demand	Anodyne	C0L093_TOBAC	59	37
COc1cc(NC(=O)CC2(O)CCC2)ccc1F	ZINC000450965580	CE	On-Demand	Anodyne	ENPP1	65	39
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965583	FG	On-Demand	Anodyne	P2RY12	22	46
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965583	FG	On-Demand	Anodyne	SIRT3	71	36
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965583	FG	On-Demand	Anodyne	SIRT2	67	35
CC[C@@H]1CCC[C@@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965583	FG	On-Demand	Anodyne	SIRT1	54	34
CC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965585	FG	On-Demand	Anodyne	P2RY12	22	46
CC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965585	FG	On-Demand	Anodyne	SIRT3	71	36
CC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965585	FG	On-Demand	Anodyne	SIRT2	67	35
CC[C@H]1CCC[C@@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965585	FG	On-Demand	Anodyne	SIRT1	54	34
CC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965587	FG	On-Demand	Anodyne	P2RY12	22	46
CC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965587	FG	On-Demand	Anodyne	SIRT3	71	36
CC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965587	FG	On-Demand	Anodyne	SIRT2	67	35
CC[C@@H]1CCC[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965587	FG	On-Demand	Anodyne	SIRT1	54	34
CC[C@H]1CCC[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965588	FG	On-Demand	Anodyne	P2RY12	22	46
CC[C@H]1CCC[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965588	FG	On-Demand	Anodyne	SIRT3	71	36
CC[C@H]1CCC[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965588	FG	On-Demand	Anodyne	SIRT2	67	35
CC[C@H]1CCC[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450965588	FG	On-Demand	Anodyne	SIRT1	54	34
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccnn2C)c1	ZINC000450965590	EE	On-Demand	Anodyne	SCN9A	0	41
CCO[C@@H]1C[C@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965592	FF	On-Demand	Anodyne	TIMP3	79	43
CCO[C@@H]1C[C@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965592	FF	On-Demand	Anodyne	CAPNS1	52	33
CCO[C@@H]1C[C@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965592	FF	On-Demand	Anodyne	HLA-DRB1	45	34
CCO[C@@H]1C[C@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965592	FF	On-Demand	Anodyne	MMP9	18	43
CCO[C@@H]1C[C@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965592	FF	On-Demand	Anodyne	ACE2	66	34
CCO[C@@H]1C[C@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965593	FF	On-Demand	Anodyne	TIMP3	79	43
CCO[C@@H]1C[C@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965593	FF	On-Demand	Anodyne	CAPNS1	52	33
CCO[C@@H]1C[C@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965593	FF	On-Demand	Anodyne	HLA-DRB1	45	34
CCO[C@@H]1C[C@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965593	FF	On-Demand	Anodyne	MMP9	18	43
CCO[C@@H]1C[C@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965593	FF	On-Demand	Anodyne	ACE2	66	34
CCO[C@@H]1C[C@@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965594	FF	On-Demand	Anodyne	TIMP3	79	43
CCO[C@@H]1C[C@@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965594	FF	On-Demand	Anodyne	CAPNS1	52	33
CCO[C@@H]1C[C@@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965594	FF	On-Demand	Anodyne	HLA-DRB1	45	34
CCO[C@@H]1C[C@@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965594	FF	On-Demand	Anodyne	MMP9	18	43
CCO[C@@H]1C[C@@H](NCC(=O)N[C@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965594	FF	On-Demand	Anodyne	ACE2	66	34
CCO[C@@H]1C[C@@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965595	FF	On-Demand	Anodyne	TIMP3	79	43
CCO[C@@H]1C[C@@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965595	FF	On-Demand	Anodyne	CAPNS1	52	33
CCO[C@@H]1C[C@@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965595	FF	On-Demand	Anodyne	HLA-DRB1	45	34
CCO[C@@H]1C[C@@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965595	FF	On-Demand	Anodyne	MMP9	18	43
CCO[C@@H]1C[C@@H](NCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)C12CCCC2	ZINC000450965595	FF	On-Demand	Anodyne	ACE2	66	34
COC(=O)c1ncccc1S(=O)(=O)N1Cc2ccccc2C[C@H]1C(=O)OC	ZINC000450965599	GD	On-Demand	Anodyne	MMP3	47	51
COC(=O)c1ncccc1S(=O)(=O)N1Cc2ccccc2C[C@H]1C(=O)OC	ZINC000450965599	GD	On-Demand	Anodyne	MMP8	42	51
COC(=O)c1ncccc1S(=O)(=O)N1Cc2ccccc2C[C@H]1C(=O)OC	ZINC000450965599	GD	On-Demand	Anodyne	ADAM9	64	37
COC(=O)c1ncccc1S(=O)(=O)N1Cc2ccccc2C[C@@H]1C(=O)OC	ZINC000450965602	GD	On-Demand	Anodyne	MMP3	47	51
COC(=O)c1ncccc1S(=O)(=O)N1Cc2ccccc2C[C@@H]1C(=O)OC	ZINC000450965602	GD	On-Demand	Anodyne	MMP8	42	51
COC(=O)c1ncccc1S(=O)(=O)N1Cc2ccccc2C[C@@H]1C(=O)OC	ZINC000450965602	GD	On-Demand	Anodyne	ADAM9	64	37
COc1cccc(F)c1NC(=O)c1cccc2c1CCCC2	ZINC000450965604	CH	On-Demand	Anodyne	KCNK3	57	41
COc1cccc(F)c1NC(=O)c1cccc2c1CCCC2	ZINC000450965604	CH	On-Demand	Anodyne	KCNK9	53	41
CCN1CCC[C@@H]1CNS(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450965612	EE	On-Demand	Anodyne	PFG6PD	0	42
CCN1CCC[C@H]1CNS(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450965613	EE	On-Demand	Anodyne	PFG6PD	0	42
CCC[C@@H](OC)C(=O)Nc1c(F)cccc1OC	ZINC000450965624	CF	On-Demand	Anodyne	ACAT	0	40
CCC[C@H](OC)C(=O)Nc1c(F)cccc1OC	ZINC000450965625	CF	On-Demand	Anodyne	ACAT	0	40
COc1cc(NC(=O)c2nn(C)c3c2CCCC3)ccc1F	ZINC000450965628	DF	On-Demand	Anodyne	COLA	53	37
COc1cc(NC(=O)c2nn(C)c3c2CCCC3)ccc1F	ZINC000450965628	DF	On-Demand	Anodyne	CPT1A	44	36
COc1cc(NC(=O)c2nn(C)c3c2CCCC3)ccc1F	ZINC000450965628	DF	On-Demand	Anodyne	CPT2	44	36
COc1cc(NC(=O)c2nn(C)c3c2CCCC3)ccc1F	ZINC000450965628	DF	On-Demand	Anodyne	MET	43	36
COc1cc(NC(=O)c2nn(C)c3c2CCCC3)ccc1F	ZINC000450965628	DF	On-Demand	Anodyne	ENPP1	55	33
CCOC(=O)[C@H]1CCCN(S(=O)(=O)CCOCc2ccccc2)C1	ZINC000450965641	FD	On-Demand	Anodyne	FKBP1A	45	38
CCOC(=O)[C@H]1CCCN(S(=O)(=O)CCOCc2ccccc2)C1	ZINC000450965641	FD	On-Demand	Anodyne	SLC6A1	75	37
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)CCOCc2ccccc2)C1	ZINC000450965643	FD	On-Demand	Anodyne	FKBP1A	45	38
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)CCOCc2ccccc2)C1	ZINC000450965643	FD	On-Demand	Anodyne	SLC6A1	75	37
Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)nnc1C	ZINC000450965645	GD	On-Demand	Anodyne	MTNN	54	37
Cc1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)nnc1C	ZINC000450965645	GD	On-Demand	Anodyne	FFAR4	32	41
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450965652	FH	On-Demand	Anodyne	CCR3	31	41
CCC[C@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450965653	FH	On-Demand	Anodyne	CCR3	31	41
C[C@@H](CCc1ccccc1)NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450965654	GF	On-Demand	Anodyne	CAPN2	43	31
C[C@@H](CCc1ccccc1)NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450965654	GF	On-Demand	Anodyne	RORB	0	41
C[C@H](CCc1ccccc1)NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450965655	GF	On-Demand	Anodyne	CAPN2	43	31
C[C@H](CCc1ccccc1)NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450965655	GF	On-Demand	Anodyne	RORB	0	41
Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nnc1C	ZINC000450965671	EE	On-Demand	Anodyne	PPIA	28	41
Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nnc1C	ZINC000450965671	EE	On-Demand	Anodyne	LEF	55	34
Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nnc1C	ZINC000450965671	EE	On-Demand	Anodyne	PFK	0	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	CA2	15	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	PPIA	23	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	CA1	17	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	GRM4	21	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	CCR2	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	CA12	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	LEF	43	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	IDO1	30	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	PFK	0	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cc1	ZINC000450965672	GH	On-Demand	Anodyne	PSBA	0	40
CC(C)CC(=O)Nc1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450965673	FI	On-Demand	Anodyne	SLC1A2	44	35
CC(C)CC(=O)Nc1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450965673	FI	On-Demand	Anodyne	PFK	0	40
CC(C)Cn1c(N)c(-c2csc(-c3ccc[nH]3)n2)c(=O)n(C)c1=O	ZINC000450965682	ED	On-Demand	Anodyne	SLC16A1	45	32
Cc1ncccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450965699	GE	On-Demand	Anodyne	GRM4	17	40
Cc1ncccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450965699	GE	On-Demand	Anodyne	PRTN3	43	31
Cc1ncccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450965699	GE	On-Demand	Anodyne	MTNN	85	41
Cc1ncccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450965699	GE	On-Demand	Anodyne	NFKBIA	0	42
C[C@@H](O)CN(C)C1CCN(C(=O)c2cc(Cl)c3ccccc3n2)CC1	ZINC000450965708	FF	On-Demand	Anodyne	TSPO	22	40
C[C@H](O)CN(C)C1CCN(C(=O)c2cc(Cl)c3ccccc3n2)CC1	ZINC000450965709	FF	On-Demand	Anodyne	TSPO	22	40
O=C(CC1CC1)Cn1nnc(-c2ccco2)n1	ZINC000450965730	BD	On-Demand	Anodyne	ADORA3	41	36
O=C(CC1CC1)Cn1nnc(-c2ccco2)n1	ZINC000450965730	BD	On-Demand	Anodyne	SCARB1	43	35
CN1C(=O)N[C@@H]2CN(CC/C=C\c3ccccc3)CC[C@@H]21	ZINC000450965736	CE	On-Demand	Anodyne	SLC6A1	45	34
CN1C(=O)N[C@@H]2CN(CC/C=C/c3ccccc3)CC[C@@H]21	ZINC000450965737	CE	On-Demand	Anodyne	SLC6A1	45	34
COc1cccc(OCCC(=O)Nc2c3c(nn2C(C)C)CCC3)c1	ZINC000450965739	EG	On-Demand	Anodyne	DRD4	40	31
CSc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450965747	DF	On-Demand	Anodyne	PDE3A	50	38
CSc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450965747	DF	On-Demand	Anodyne	PDE3B	74	38
CSc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450965747	DF	On-Demand	Anodyne	SIRT3	56	34
CSc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450965747	DF	On-Demand	Anodyne	SIRT2	57	35
CSc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450965747	DF	On-Demand	Anodyne	SIRT1	56	34
CSc1ccc2ncnc(N3CC[C@@H](CCCO)C3)c2c1	ZINC000450965747	DF	On-Demand	Anodyne	HTT	0	41
CSc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450965748	DF	On-Demand	Anodyne	PDE3A	50	38
CSc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450965748	DF	On-Demand	Anodyne	PDE3B	74	38
CSc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450965748	DF	On-Demand	Anodyne	SIRT3	56	34
CSc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450965748	DF	On-Demand	Anodyne	SIRT2	57	35
CSc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450965748	DF	On-Demand	Anodyne	SIRT1	56	34
CSc1ccc2ncnc(N3CC[C@H](CCCO)C3)c2c1	ZINC000450965748	DF	On-Demand	Anodyne	HTT	0	41
CCC(CC)Oc1ccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)cc1	ZINC000450965756	FG	On-Demand	Anodyne	HRH3	0	48
CCC(CC)Oc1ccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)cc1	ZINC000450965756	FG	On-Demand	Anodyne	LSS	28	49
CCC(CC)Oc1ccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)cc1	ZINC000450965756	FG	On-Demand	Anodyne	L3MBTL1	0	43
CCC(CC)Oc1ccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)cc1	ZINC000450965756	FG	On-Demand	Anodyne	L3MBTL3	63	43
CCC(CC)Oc1ccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)cc1	ZINC000450965757	FG	On-Demand	Anodyne	HRH3	0	48
CCC(CC)Oc1ccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)cc1	ZINC000450965757	FG	On-Demand	Anodyne	LSS	28	49
CCC(CC)Oc1ccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)cc1	ZINC000450965757	FG	On-Demand	Anodyne	L3MBTL1	0	43
CCC(CC)Oc1ccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)cc1	ZINC000450965757	FG	On-Demand	Anodyne	L3MBTL3	63	43
CCOc1ccc(S(=O)(=O)Cc2ccc([C@@H](C)C(F)(F)F)cc2)cc1	ZINC000450965766	FJ	On-Demand	Anodyne	ACACA	26	42
CCOc1ccc(S(=O)(=O)Cc2ccc([C@H](C)C(F)(F)F)cc2)cc1	ZINC000450965767	FJ	On-Demand	Anodyne	ACACA	26	42
CC(C)n1nc2c(c1NC(=O)c1ccc3cnccc3c1)CCC2	ZINC000450965770	DH	On-Demand	Anodyne	AKT1	0	40
CC(C)n1nc2c(c1NC(=O)c1ccc3cnccc3c1)CCC2	ZINC000450965770	DH	On-Demand	Anodyne	RPS6KA3	46	37
OCCC[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450965771	DH	On-Demand	Anodyne	LIPG	58	39
OCCC[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000450965772	DH	On-Demand	Anodyne	LIPG	58	39
C[C@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450965808	GG	On-Demand	Anodyne	RBP4	84	37
Cc1ccn(-c2ccccc2C(=O)NCC2CCN(CC(F)(F)F)CC2)n1	ZINC000450965820	GG	On-Demand	Anodyne	HTR4	63	40
Cc1ccn(-c2ccccc2C(=O)NCC2CCN(CC(F)(F)F)CC2)n1	ZINC000450965820	GG	On-Demand	Anodyne	CACNA1I	67	37
O=S(=O)(c1sc2ccccc2c1Cl)N1CCOCC1	ZINC000450965824	DF	On-Demand	Anodyne	PHOSPHO1	0	51
O=S(=O)(c1sc2ccccc2c1Cl)N1CCOCC1	ZINC000450965824	DF	On-Demand	Anodyne	PMM2	0	44
C[C@H]1CN(C(=O)[C@H]2CCCCC2(F)F)CCN1c1nc2ccccc2o1	ZINC000450965828	FH	On-Demand	Anodyne	NPBWR1	40	38
C[C@@H]1CN(C(=O)[C@H]2CCCCC2(F)F)CCN1c1nc2ccccc2o1	ZINC000450965829	FH	On-Demand	Anodyne	NPBWR1	40	38
Cn1nc(C(C)(C)C)cc1NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450965830	EF	On-Demand	Anodyne	TNF	44	32
CC(=O)CCCCCSc1nc2c([nH]1)CCC2	ZINC000450965833	CG	On-Demand	Anodyne	HDA106	0	41
CCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965835	CE	On-Demand	Anodyne	CA2	23	56
CCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965835	CE	On-Demand	Anodyne	CA1	32	47
CCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965835	CE	On-Demand	Anodyne	MMP13	24	41
CCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965835	CE	On-Demand	Anodyne	CA4	27	42
CCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965835	CE	On-Demand	Anodyne	ALOX15	45	39
CCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965835	CE	On-Demand	Anodyne	IDO1	31	40
CCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965835	CE	On-Demand	Anodyne	MTCA1	27	41
CS(=O)(=O)c1cccc(CS(=O)(=O)NCC2CCCCC2)c1	ZINC000450965843	EE	On-Demand	Anodyne	NPY2R	46	36
CC(C)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450965847	GF	On-Demand	Anodyne	RORC	36	51
CC(C)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450965847	GF	On-Demand	Anodyne	RORB	0	51
Cn1nc(C(=O)Nc2cccc(C(C)(F)F)c2)c2c1CCCC2	ZINC000450965848	DH	On-Demand	Anodyne	KCNK3	66	33
Cn1nc(C(=O)Nc2cccc(C(C)(F)F)c2)c2c1CCCC2	ZINC000450965848	DH	On-Demand	Anodyne	KCNK9	48	33
O=C(CSc1ccc(Br)c(Cl)c1)NC1CCOCC1	ZINC000450965855	FG	On-Demand	Anodyne	MAPK1	46	33
CCCCO[C@H]1C[C@@H](NCC(=O)Nc2ccc(OC)cc2OC)C1(C)C	ZINC000450965857	FG	On-Demand	Anodyne	ACAT	0	53
CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc(OC)cc2OC)C1(C)C	ZINC000450965859	FG	On-Demand	Anodyne	ACAT	0	53
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cccc2c1CCCC2	ZINC000450965860	FH	On-Demand	Anodyne	FABP4	43	33
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cccc2c1CCCC2	ZINC000450965860	FH	On-Demand	Anodyne	CACNA1I	69	43
CCCCO[C@H]1C[C@H](NCC(=O)Nc2ccc(OC)cc2OC)C1(C)C	ZINC000450965861	FG	On-Demand	Anodyne	ACAT	0	53
CCC[C@@H](OC)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965862	DE	On-Demand	Anodyne	CACNA1I	54	35
CCCCO[C@@H]1C[C@H](NCC(=O)Nc2ccc(OC)cc2OC)C1(C)C	ZINC000450965863	FG	On-Demand	Anodyne	ACAT	0	53
CCC[C@H](OC)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965864	DE	On-Demand	Anodyne	CACNA1I	54	35
C=Cc1ccc(S(=O)(=O)NCCCOCCCC)cc1	ZINC000450965866	CF	On-Demand	Anodyne	ALOX15	40	36
COCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965869	DD	On-Demand	Anodyne	CA1	26	44
COCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965869	DD	On-Demand	Anodyne	MMP13	28	44
COCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965869	DD	On-Demand	Anodyne	MMP2	24	41
COCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965869	DD	On-Demand	Anodyne	MMP7	22	40
O=S(=O)(C[C@H]1CCCCC1(F)F)NCCCn1ccnc1	ZINC000450965870	DE	On-Demand	Anodyne	QPCT	27	42
O=S(=O)(C[C@@H]1CCCCC1(F)F)NCCCn1ccnc1	ZINC000450965871	DE	On-Demand	Anodyne	QPCT	27	42
Cn1nc(-c2ccccc2)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965872	GG	On-Demand	Anodyne	HTR4	67	42
Cn1nc(-c2ccccc2)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965872	GG	On-Demand	Anodyne	P2RY12	56	34
Cn1nc(-c2ccccc2)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965872	GG	On-Demand	Anodyne	ACACB	25	41
Cn1nc(-c2ccccc2)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965872	GG	On-Demand	Anodyne	CTSV	44	31
Cn1nc(-c2ccccc2)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965872	GG	On-Demand	Anodyne	CACNA1I	81	42
Cn1nc(-c2ccccc2)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965872	GG	On-Demand	Anodyne	HPGDS	39	49
Cn1nc(-c2ccccc2)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965872	GG	On-Demand	Anodyne	VCP	56	35
O=C(CC[C@@H]1CCCCO1)CS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450965884	GF	On-Demand	Anodyne	AKR1C3	26	47
O=C(CC[C@H]1CCCCO1)CS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450965885	GF	On-Demand	Anodyne	AKR1C3	26	47
Cc1csc(S(=O)(=O)Nc2ccc(N3CCOCC3)nc2)c1	ZINC000450965890	EE	On-Demand	Anodyne	DGAT1	22	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	CA2	18	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	CA1	23	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	MMP13	19	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	BDKRB1	0	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	COLA	43	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	GRM4	22	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	MMP2	16	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	PRTN3	56	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	LIMK2	43	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450965892	FG	On-Demand	Anodyne	UQCRB	0	40
Cc1ccc2cc(S(=O)(=O)NC(C)(C)C)ccc2c1	ZINC000450965903	CG	On-Demand	Anodyne	CYP2A5	0	45
O=C(Nc1ccc(NS(=O)(=O)Cc2c(F)cccc2Cl)cn1)C1CC1	ZINC000450965904	GG	On-Demand	Anodyne	TYK2	57	40
CCCCNS(=O)(=O)CCOCCN1C(=O)c2ccccc2C1=O	ZINC000450965905	FD	On-Demand	Anodyne	ALDH1A1	15	40
CCCCNS(=O)(=O)CCOCCN1C(=O)c2ccccc2C1=O	ZINC000450965905	FD	On-Demand	Anodyne	FBPC	0	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	CA2	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	CA1	33	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	MMP13	37	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	CA4	31	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	MMP2	31	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	CAPN1	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	MMP12	48	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	MMP7	23	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	ADAMTS4	56	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	LEF	53	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	IDO1	36	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450965908	DF	On-Demand	Anodyne	P96878_MYCTU	46	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	CA2	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	CA1	33	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	MMP13	37	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	CA4	31	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	MMP2	31	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	CAPN1	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	MMP12	48	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	MMP7	23	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	ADAMTS4	56	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	LEF	53	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	IDO1	36	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450965909	DF	On-Demand	Anodyne	P96878_MYCTU	46	41
CC(=O)NCCCSc1ccc(Br)c(Cl)c1	ZINC000450965918	DH	On-Demand	Anodyne	MTNR1B	27	45
CCOC(=O)c1cc(C(=O)NCC2CCN(CC(F)(F)F)CC2)on1	ZINC000450965929	FD	On-Demand	Anodyne	HTR4	73	36
CCOC(=O)c1cc(C(=O)NCC2CCN(CC(F)(F)F)CC2)on1	ZINC000450965929	FD	On-Demand	Anodyne	CACNA1I	79	41
Cc1cccc(C)c1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450965936	GG	On-Demand	Anodyne	ALPL	18	43
Cc1cccc(C)c1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450965936	GG	On-Demand	Anodyne	MTNN	84	38
Cc1cccc(C)c1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450965936	GG	On-Demand	Anodyne	FFAR4	38	50
Cc1cccc(C)c1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450965936	GG	On-Demand	Anodyne	UQCRB	0	41
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c1	ZINC000450965937	EH	On-Demand	Anodyne	LPL	44	37
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c1	ZINC000450965937	EH	On-Demand	Anodyne	KCNQ2	82	41
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c1	ZINC000450965937	EH	On-Demand	Anodyne	CREBBP	43	34
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c1	ZINC000450965937	EH	On-Demand	Anodyne	BRD9	43	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccn2)cc1	ZINC000450965939	EE	On-Demand	Anodyne	CA1	24	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccn2)cc1	ZINC000450965939	EE	On-Demand	Anodyne	GRM4	32	44
CCC[C@@H]1CCC[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965945	EH	On-Demand	Anodyne	CACNA1I	53	34
CCC[C@H]1CCC[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965947	EH	On-Demand	Anodyne	CACNA1I	53	34
CCC[C@@H]1CCC[C@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965949	EH	On-Demand	Anodyne	CACNA1I	53	34
CCC[C@H]1CCC[C@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450965951	EH	On-Demand	Anodyne	CACNA1I	53	34
O=C(Cc1cc2ccccc2s1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450965959	GI	On-Demand	Anodyne	PIN1	16	40
COC(=O)c1ncccc1S(=O)(=O)Nc1cccc(C(C)C)c1	ZINC000450965963	EF	On-Demand	Anodyne	POL	0	43
Cc1ccnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450965989	GE	On-Demand	Anodyne	MTNN	82	39
Cc1ccnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450965989	GE	On-Demand	Anodyne	FFAR4	31	41
Cc1cccnc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965992	EF	On-Demand	Anodyne	PPIA	36	44
Cc1cccnc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450965992	EF	On-Demand	Anodyne	GRM4	26	48
C[C@H](NC(=O)c1cccc(C(F)(F)F)n1)C1CCN(CC(F)(F)F)CC1	ZINC000450965994	GG	On-Demand	Anodyne	CCR2	21	41
C[C@H](NC(=O)c1cccc(C(F)(F)F)n1)C1CCN(CC(F)(F)F)CC1	ZINC000450965994	GG	On-Demand	Anodyne	HPGDS	38	46
C[C@@H](NC(=O)c1cccc(C(F)(F)F)n1)C1CCN(CC(F)(F)F)CC1	ZINC000450965995	GG	On-Demand	Anodyne	CCR2	21	41
C[C@@H](NC(=O)c1cccc(C(F)(F)F)n1)C1CCN(CC(F)(F)F)CC1	ZINC000450965995	GG	On-Demand	Anodyne	HPGDS	38	46
O=C(c1ccsc1Br)N1CCCN(C(=O)C2CC2)CC1	ZINC000450966003	FF	On-Demand	Anodyne	L3MBTL3	51	38
COc1ccc(-c2nc(CC[C@@H]3CCCCO3)cs2)cc1OC	ZINC000450966005	EI	On-Demand	Anodyne	DCK	43	41
COc1ccc(-c2nc(CC[C@H]3CCCCO3)cs2)cc1OC	ZINC000450966007	EI	On-Demand	Anodyne	DCK	43	41
CC(C)c1ncsc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966020	DJ	On-Demand	Anodyne	KIT	22	42
CC(C)c1ncsc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966020	DJ	On-Demand	Anodyne	FLT1	23	41
CC(C)c1ncsc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966020	DJ	On-Demand	Anodyne	KDR	19	42
CC(C)c1ncsc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966020	DJ	On-Demand	Anodyne	KCNK3	98	41
CC(C)c1ncsc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966020	DJ	On-Demand	Anodyne	KCNK9	74	41
O=C(CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966023	FI	On-Demand	Anodyne	PRCP	44	63
O=C(CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966023	FI	On-Demand	Anodyne	COLA	140	45
O=C(CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966023	FI	On-Demand	Anodyne	CPT1A	132	45
O=C(CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966023	FI	On-Demand	Anodyne	CPT2	44	37
O=C(CCCC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966023	FI	On-Demand	Anodyne	PREP	76	38
O=C(CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966025	FI	On-Demand	Anodyne	PRCP	44	63
O=C(CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966025	FI	On-Demand	Anodyne	COLA	140	45
O=C(CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966025	FI	On-Demand	Anodyne	CPT1A	132	45
O=C(CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966025	FI	On-Demand	Anodyne	CPT2	44	37
O=C(CCCC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)C1CC1	ZINC000450966025	FI	On-Demand	Anodyne	PREP	76	38
O=S(=O)(Nc1ccc(N2CCOCC2)cn1)c1sccc1Cl	ZINC000450966031	FE	On-Demand	Anodyne	STAT6	51	35
C[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450966037	ED	On-Demand	Anodyne	CASR	46	37
C[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H]1C(=O)N1CCOCC1	ZINC000450966037	ED	On-Demand	Anodyne	SSTR3	57	33
COC(=O)CC[C@@]1(C)NC(=O)N(Cc2cc(Cl)sc2Cl)C1=O	ZINC000450966039	FF	On-Demand	Anodyne	KAT2B	0	43
COC(=O)CC[C@]1(C)NC(=O)N(Cc2cc(Cl)sc2Cl)C1=O	ZINC000450966043	FF	On-Demand	Anodyne	KAT2B	0	43
C[C@@H](OCCc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450966046	CD	On-Demand	Anodyne	ACE	42	39
C[C@@H](OCCc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450966046	CD	On-Demand	Anodyne	SLC18A2	44	43
C[C@H](OCCc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450966047	CD	On-Demand	Anodyne	ACE	42	39
C[C@H](OCCc1ccccc1)C(=O)N1CC(O)(C2CC2)C1	ZINC000450966047	CD	On-Demand	Anodyne	SLC18A2	44	43
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC(O)(C2CC2)C1	ZINC000450966053	EE	On-Demand	Bother	PPXII	0	40
Cc1cccc(Cl)c1C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450966056	FH	On-Demand	Anodyne	CCR5	51	41
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)Nc1cccc(Cl)c1	ZINC000450966062	FH	On-Demand	Anodyne	MCHR1	29	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)Nc1cccc(Cl)c1	ZINC000450966063	FH	On-Demand	Anodyne	MCHR1	29	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)Nc1cccc(Cl)c1	ZINC000450966064	FH	On-Demand	Anodyne	MCHR1	29	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)Nc1cccc(Cl)c1	ZINC000450966065	FH	On-Demand	Anodyne	MCHR1	29	41
CC(F)(F)CCS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450966067	FE	On-Demand	Anodyne	PKM	43	45
CC(F)(F)CCS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450966067	FE	On-Demand	Anodyne	AKR1C3	53	37
C[C@@H](NC(=O)c1ccc(C(C)(F)F)nc1)C1CCN(CC(F)(F)F)CC1	ZINC000450966068	GH	On-Demand	Anodyne	HPGDS	46	50
C[C@H](NC(=O)c1ccc(C(C)(F)F)nc1)C1CCN(CC(F)(F)F)CC1	ZINC000450966069	GH	On-Demand	Anodyne	HPGDS	46	50
C/C=C\COc1cccc(CC(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450966082	FF	On-Demand	Anodyne	GPR183	0	41
Cc1nn(CC(=O)N2CCN([C@H](C#N)c3cccs3)CC2)cc1[N+](=O)[O-]	ZINC000450966088	FD	On-Demand	Mild	PTAFR	47	44
Cc1nn(CC(=O)N2CCN([C@@H](C#N)c3cccs3)CC2)cc1[N+](=O)[O-]	ZINC000450966089	FD	On-Demand	Mild	PTAFR	47	44
COc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1F	ZINC000450966113	DG	On-Demand	Anodyne	TRPV1	0	43
COc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1F	ZINC000450966113	DG	On-Demand	Anodyne	NPY2R	49	38
COc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)ccc1F	ZINC000450966113	DG	On-Demand	Anodyne	MAPK1	30	40
COc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1F	ZINC000450966114	DG	On-Demand	Anodyne	TRPV1	0	43
COc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1F	ZINC000450966114	DG	On-Demand	Anodyne	NPY2R	49	38
COc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)ccc1F	ZINC000450966114	DG	On-Demand	Anodyne	MAPK1	30	40
Cn1nc(-c2ccccc2)cc1C(=O)N[C@]1(C#N)CCOC1	ZINC000450966123	CD	On-Demand	Mild	CTSV	45	32
Cn1nc(-c2ccccc2)cc1C(=O)N[C@@]1(C#N)CCOC1	ZINC000450966124	CD	On-Demand	Mild	CTSV	45	32
O=C(COc1ccc(S(=O)(=O)NCc2cccs2)cc1)NC1CC1	ZINC000450966125	FD	On-Demand	Anodyne	NPY2R	25	40
O=C(COc1ccc(S(=O)(=O)NCc2cccs2)cc1)NC1CC1	ZINC000450966125	FD	On-Demand	Anodyne	LUXN	0	43
O=C(COc1ccc(S(=O)(=O)NCc2cccs2)cc1)NC1CC1	ZINC000450966125	FD	On-Demand	Anodyne	ADIPOR1	0	42
O=C(COc1ccc(S(=O)(=O)NCc2cccs2)cc1)NC1CC1	ZINC000450966125	FD	On-Demand	Anodyne	ADIPOR2	0	42
CCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n(C)n1	ZINC000450966130	GD	On-Demand	Anodyne	INHA	48	34
CCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n(C)n1	ZINC000450966130	GD	On-Demand	Anodyne	LUXN	0	44
CCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n(C)n1	ZINC000450966130	GD	On-Demand	Anodyne	ADIPOR1	0	40
CCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n(C)n1	ZINC000450966130	GD	On-Demand	Anodyne	ADIPOR2	0	40
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)c1	ZINC000450966167	FE	On-Demand	Anodyne	BRD4	16	44
Cc1csc(S(=O)(=O)N(C)CCOc2ccccc2)c1	ZINC000450966177	DF	On-Demand	Anodyne	SQLE	38	42
COc1cccc(F)c1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450966178	EG	On-Demand	Anodyne	F10	26	40
COc1cccc(F)c1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450966178	EG	On-Demand	Anodyne	GCK	25	42
CN(C)CCCOc1cccc(NS(=O)(=O)c2sccc2Cl)c1	ZINC000450966185	FH	On-Demand	Anodyne	UTS2R	0	41
Cc1ccc(NS(=O)(=O)c2sccc2Cl)c(OCCN(C)C)c1	ZINC000450966186	FG	On-Demand	Anodyne	UTS2R	26	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	CA2	25	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	LPL	20	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	LTA4H	45	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	BMP1	43	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	CA1	49	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	CA7	16	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP13	70	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	ADAM17	21	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	COLA	63	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP16	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP2	57	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP3	36	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP8	43	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP14	28	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP9	51	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP12	56	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	CA12	25	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	ADAMTS4	53	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	CA9	29	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MMP1	31	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	F13A1	16	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	MTCA1	18	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450966195	GF	On-Demand	Anodyne	P96878_MYCTU	23	41
CCOC(=O)c1cc(S(=O)(=O)N[C@H](C(=O)OC)C(C)C)cnc1C(F)F	ZINC000450966196	GD	On-Demand	Anodyne	MMP13	20	40
CCOC(=O)c1cc(S(=O)(=O)N[C@H](C(=O)OC)C(C)C)cnc1C(F)F	ZINC000450966196	GD	On-Demand	Anodyne	ADAMTS4	61	40
COc1ccc(NC(C)=O)cc1NS(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450966207	GF	On-Demand	Anodyne	TSHR	64	31
COc1ccc(NC(C)=O)cc1NS(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450966208	GF	On-Demand	Anodyne	TSHR	64	31
COC(=O)c1ncccc1S(=O)(=O)NCc1ccc(OC)c(OC)c1	ZINC000450966217	FD	On-Demand	Anodyne	DRTS_TRYCR	47	35
CCC(=O)N1CCc2cc(-c3csc(=NC4CCC4)[nH]3)ccc21	ZINC000450966224	EG	On-Demand	Anodyne	EIF2AK3	71	37
CC(=O)N1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450966225	GF	On-Demand	Anodyne	PRNP	58	36
CC(=O)N1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450966225	GF	On-Demand	Anodyne	TAAR1	44	42
CC(=O)N1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450966225	GF	On-Demand	Anodyne	KCNK3	86	47
CC(=O)N1CCN(c2cccc(NC(=O)c3ccnc(OC(F)F)c3)c2)CC1	ZINC000450966225	GF	On-Demand	Anodyne	KCNK9	52	34
COc1ccc(CN(C)C(=O)COc2cccc3c2C(=O)CC3)cc1OC	ZINC000450966231	FF	On-Demand	Anodyne	MT-ND1	24	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)ccc2O)cc1	ZINC000450966268	GI	On-Demand	Anodyne	CA2	27	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)ccc2O)cc1	ZINC000450966268	GI	On-Demand	Anodyne	PRTN3	51	32
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)ccc2O)cc1	ZINC000450966268	GI	On-Demand	Anodyne	CYNT	44	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)ccc2O)cc1	ZINC000450966268	GI	On-Demand	Anodyne	UQCRB	0	53
CO[C@@H](C)CS(=O)(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	ZINC000450966274	FG	On-Demand	Anodyne	TNF	43	37
CO[C@@H](C)CS(=O)(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	ZINC000450966274	FG	On-Demand	Anodyne	PTK2	32	44
CO[C@@H](C)CS(=O)(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	ZINC000450966274	FG	On-Demand	Anodyne	PTK2B	35	44
CO[C@@H](C)CS(=O)(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	ZINC000450966274	FG	On-Demand	Anodyne	DDR2	28	44
CO[C@H](C)CS(=O)(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	ZINC000450966275	FG	On-Demand	Anodyne	TNF	43	37
CO[C@H](C)CS(=O)(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	ZINC000450966275	FG	On-Demand	Anodyne	PTK2	32	44
CO[C@H](C)CS(=O)(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	ZINC000450966275	FG	On-Demand	Anodyne	PTK2B	35	44
CO[C@H](C)CS(=O)(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1	ZINC000450966275	FG	On-Demand	Anodyne	DDR2	28	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	CA2	39	59
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	ADRB2	32	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	ADRB1	37	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	ADRB3	46	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	TBXA2R	62	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	TBXAS1	45	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	CA1	43	59
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	CA7	23	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	MMP13	22	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	CA4	27	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	CA14	23	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	MMP2	28	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	MMP3	18	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	ALOX15	44	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	MMP9	16	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	CA12	35	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	CA9	37	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	LEF	51	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	IDO1	33	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	CYNT	18	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	NCE103	16	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	PFK	0	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	MTCA1	19	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	P96878_MYCTU	28	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	RORC	52	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000450966276	GG	On-Demand	Anodyne	A6YCJ1_9METZ	22	44
CCCOc1cccc(Cn2nnc(-c3ccco3)n2)c1	ZINC000450966282	CF	On-Demand	Anodyne	ADORA1	23	45
CCCOc1cccc(Cn2nnc(-c3ccco3)n2)c1	ZINC000450966282	CF	On-Demand	Anodyne	ADORA3	23	45
N#CCc1ccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c(Cl)c1	ZINC000450966288	GG	On-Demand	Mild	TRPV4	45	37
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450966294	GG	On-Demand	Anodyne	ABL1	26	42
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450966294	GG	On-Demand	Anodyne	LCK	36	43
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450966294	GG	On-Demand	Anodyne	MAPK14	15	43
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450966294	GG	On-Demand	Anodyne	PRNP	65	35
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450966294	GG	On-Demand	Anodyne	HCK	21	44
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450966294	GG	On-Demand	Anodyne	TAAR1	47	42
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450966294	GG	On-Demand	Anodyne	KCNK3	78	37
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(F)F)nc3)c2)CC1	ZINC000450966294	GG	On-Demand	Anodyne	KCNK9	43	33
CC(=O)N[C@H](C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1)C(C)(C)C	ZINC000450966296	GD	On-Demand	Anodyne	HTR1A	16	42
CC(=O)N[C@H](C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1)C(C)(C)C	ZINC000450966296	GD	On-Demand	Anodyne	HTR1D	22	42
CC(=O)N[C@H](C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1)C(C)(C)C	ZINC000450966296	GD	On-Demand	Anodyne	CCR3	26	40
CC(=O)N[C@H](C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1)C(C)(C)C	ZINC000450966296	GD	On-Demand	Anodyne	FAAH	22	48
CC(=O)N[C@H](C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1)C(C)(C)C	ZINC000450966296	GD	On-Demand	Anodyne	MCHR1	18	43
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450966312	GE	On-Demand	Anodyne	HTR1A	24	47
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450966312	GE	On-Demand	Anodyne	DRD4	40	33
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450966312	GE	On-Demand	Anodyne	HTR2A	25	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450966312	GE	On-Demand	Anodyne	HTR7	23	47
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450966312	GE	On-Demand	Anodyne	CCKAR	0	40
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	CA2	18	50
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	ADRB2	39	46
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	ADRB1	39	46
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	ADRB3	49	46
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	TBXA2R	28	40
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	TBXAS1	33	47
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	BMP1	57	38
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	CA1	21	50
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	MMP13	48	42
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	ADAM17	40	35
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	CA14	15	50
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	MMP8	22	42
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	ALOX15	41	39
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	MMP9	46	39
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	MMP12	30	42
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	CA12	15	45
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	PTGDR	25	43
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	CA9	27	45
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccc(OC)cc1	ZINC000450966314	FD	On-Demand	Anodyne	MMP1	47	39
Cc1noc([C@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966332	CF	On-Demand	Anodyne	DRD4	22	44
Cc1noc([C@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966332	CF	On-Demand	Anodyne	HTR2A	24	47
Cc1noc([C@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966332	CF	On-Demand	Anodyne	HTR2C	22	47
Cc1noc([C@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966332	CF	On-Demand	Anodyne	SLC6A1	79	36
Cc1noc([C@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966332	CF	On-Demand	Anodyne	PRCP	28	43
Cc1noc([C@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966332	CF	On-Demand	Anodyne	CYP2J2	68	49
Cc1noc([C@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966332	CF	On-Demand	Anodyne	SMO	52	36
Cc1noc([C@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966332	CF	On-Demand	Anodyne	ETHR	64	41
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966333	CF	On-Demand	Anodyne	DRD4	22	44
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966333	CF	On-Demand	Anodyne	HTR2A	24	47
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966333	CF	On-Demand	Anodyne	HTR2C	22	47
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966333	CF	On-Demand	Anodyne	SLC6A1	79	36
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966333	CF	On-Demand	Anodyne	PRCP	28	43
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966333	CF	On-Demand	Anodyne	CYP2J2	68	49
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966333	CF	On-Demand	Anodyne	SMO	52	36
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccccc3)C2)n1	ZINC000450966333	CF	On-Demand	Anodyne	ETHR	64	41
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	DRD2	32	42
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	DRD1	0	45
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	DRD4	26	48
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	HTR2A	47	55
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	HTR2C	25	54
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	DRD3	0	43
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	HTR1F	38	41
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	SLC18A3	0	42
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	GRM5	0	45
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	CYP2J2	59	43
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966338	DF	On-Demand	Anodyne	ETHR	62	38
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	DRD2	32	42
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	DRD1	0	45
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	DRD4	26	48
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	HTR2A	47	55
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	HTR2C	25	54
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	DRD3	0	43
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	HTR1F	38	41
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	SLC18A3	0	42
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	GRM5	0	45
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	CYP2J2	59	43
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(F)cc3)C2)n1	ZINC000450966339	DF	On-Demand	Anodyne	ETHR	62	38
CC(=O)CCCCCOc1ccccc1S(C)(=O)=O	ZINC000450966340	CF	On-Demand	Anodyne	THRA	23	44
CO[C@@H]1CCC[C@@H]1[C@@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450966343	DG	On-Demand	Anodyne	CACNA1D	38	40
CO[C@@H]1CCC[C@@H]1[C@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450966344	DG	On-Demand	Anodyne	CACNA1D	38	40
CO[C@@H]1CCC[C@H]1[C@@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450966345	DG	On-Demand	Anodyne	CACNA1D	38	40
CO[C@@H]1CCC[C@H]1[C@H]1COCCN1CCc1ccc(Cl)cc1	ZINC000450966346	DG	On-Demand	Anodyne	CACNA1D	38	40
N#C[C@@]1(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CCc2ccccc2C1	ZINC000450966362	GF	On-Demand	Mild	TSPO	0	42
N#C[C@]1(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)CCc2ccccc2C1	ZINC000450966363	GF	On-Demand	Mild	TSPO	0	42
Clc1ccc(CCN2CC[C@H](c3nc(C4CC4)no3)C2)cc1	ZINC000450966366	DH	On-Demand	Anodyne	DRD4	17	46
Clc1ccc(CCN2CC[C@@H](c3nc(C4CC4)no3)C2)cc1	ZINC000450966367	DH	On-Demand	Anodyne	DRD4	17	46
Cc1ccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)c2c1CCC2	ZINC000450966377	EE	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)c2c1CCC2	ZINC000450966377	EE	On-Demand	Anodyne	L3MBTL3	66	41
Cc1ccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)c2c1CCC2	ZINC000450966378	EE	On-Demand	Anodyne	L3MBTL1	0	41
Cc1ccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)c2c1CCC2	ZINC000450966378	EE	On-Demand	Anodyne	L3MBTL3	66	41
COc1cc(CN2CC[C@H]3[C@@H](C2)NC(=O)N3C)ccc1Cl	ZINC000450966388	DD	On-Demand	Anodyne	DRD4	34	41
COc1cc(CN2CC[C@H]3[C@@H](C2)NC(=O)N3C)ccc1Cl	ZINC000450966388	DD	On-Demand	Anodyne	DRD3	22	41
COc1cc(CN2CC[C@H]3[C@@H](C2)NC(=O)N3C)ccc1Cl	ZINC000450966388	DD	On-Demand	Anodyne	HTR4	50	34
COc1cc(CN2CC[C@H]3[C@@H](C2)NC(=O)N3C)ccc1Cl	ZINC000450966388	DD	On-Demand	Anodyne	SSTR5	46	36
COc1cc(CN2CC[C@H]3[C@@H](C2)NC(=O)N3C)ccc1Cl	ZINC000450966388	DD	On-Demand	Anodyne	CCR1	30	42
O=C(NC1(c2nn[nH]n2)CC1)c1ccc(I)cc1F	ZINC000450966395	FD	On-Demand	Anodyne	MAP2K1	46	32
C[C@H]1C[C@@H](C(=O)NCC2CCN(CC(F)(F)F)CC2)CC[C@H]1C	ZINC000450966408	EG	On-Demand	Anodyne	CACNA1I	54	35
C[C@@H]1CC[C@H](C(=O)NCC2CCN(CC(F)(F)F)CC2)C[C@H]1C	ZINC000450966409	EG	On-Demand	Anodyne	CACNA1I	54	35
C[C@@H]1CC[C@@H](C(=O)NCC2CCN(CC(F)(F)F)CC2)C[C@H]1C	ZINC000450966410	EG	On-Demand	Anodyne	CACNA1I	54	35
C[C@H]1C[C@H](C(=O)NCC2CCN(CC(F)(F)F)CC2)CC[C@H]1C	ZINC000450966411	EG	On-Demand	Anodyne	CACNA1I	54	35
O=C1CC[C@@H](COc2ccc(OCC3CC3)c(Cl)c2)CCN1	ZINC000450966421	DG	On-Demand	Anodyne	HPGD	41	44
O=C1CC[C@H](COc2ccc(OCC3CC3)c(Cl)c2)CCN1	ZINC000450966422	DG	On-Demand	Anodyne	HPGD	41	44
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	CA2	36	53
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	ADRB2	20	44
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	ADRB1	16	44
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	ADRB3	22	44
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	CA1	44	53
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	CA7	18	44
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	MMP13	26	40
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	TRY2_BOVIN	40	35
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	CA4	36	49
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	CA14	18	44
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	MMP2	18	41
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	CA12	25	53
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	ALPL	17	42
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	CA9	27	53
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	LEF	52	35
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	GPR119	24	52
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	PFK	0	48
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966427	GG	On-Demand	Anodyne	LIMK2	44	40
O=S(=O)(Cc1c(F)cccc1Cl)Nc1ccc(N2CCOCC2)cn1	ZINC000450966428	GF	On-Demand	Anodyne	STAT6	59	42
CC1CCN(CCCNS(=O)(=O)c2cccc3ccoc23)CC1	ZINC000450966435	EF	On-Demand	Anodyne	HTR7	32	47
CC1CCN(CCCNS(=O)(=O)c2cccc3ccoc23)CC1	ZINC000450966435	EF	On-Demand	Anodyne	HTR6	23	45
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cn1	ZINC000450966447	GD	On-Demand	Anodyne	LUXN	0	44
O=C(Cc1ccc(OC(F)F)c(F)c1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450966450	GG	On-Demand	Anodyne	CACNA1I	79	44
COCCOc1ccc(-c2nc(CC[C@@H]3CCCCO3)cs2)cc1	ZINC000450966451	EI	On-Demand	Anodyne	AVPR1B	15	41
COCCOc1ccc(-c2nc(CC[C@H]3CCCCO3)cs2)cc1	ZINC000450966452	EI	On-Demand	Anodyne	AVPR1B	15	41
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450966469	GI	On-Demand	Anodyne	HTR4	43	36
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450966469	GI	On-Demand	Anodyne	CACNA1I	59	35
O=S(=O)(Cc1c(F)cccc1Cl)N1CCN(c2ccccn2)CC1	ZINC000450966473	FF	On-Demand	Anodyne	EBP	24	41
CCCCN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450966474	EG	On-Demand	Anodyne	COLA	42	38
CCCCN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450966474	EG	On-Demand	Anodyne	P96878_MYCTU	32	40
CCCCN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450966474	EG	On-Demand	Anodyne	Q9JN24_ECOLX	0	44
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@H](C)c1ncn(C)n1	ZINC000450966475	DF	On-Demand	Anodyne	SORT1	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ncn(C)n1	ZINC000450966477	DF	On-Demand	Anodyne	SORT1	15	41
COc1cccc(OCCC(=O)NC(C)(C)CF)c1	ZINC000450966478	CE	On-Demand	Anodyne	MTNR1A	41	41
COc1cccc(OCCC(=O)NC(C)(C)CF)c1	ZINC000450966478	CE	On-Demand	Anodyne	MTNR1B	40	41
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	ZINC000450966482	GF	On-Demand	Anodyne	MTNN	41	32
CC(C)(CF)NC(=O)c1cccc2c1CCCC2	ZINC000450966485	BG	On-Demand	Anodyne	FABP4	45	34
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C)c(F)c1	ZINC000450966488	GF	On-Demand	Anodyne	AKR1C3	0	46
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)c(F)c1	ZINC000450966490	GF	On-Demand	Anodyne	AKR1C3	0	46
CCOC(=O)c1sc(NS(=O)(=O)c2sccc2Cl)nc1C	ZINC000450966498	FG	On-Demand	Anodyne	DHODH	29	54
O=S(=O)(CCCCF)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000450966514	GI	On-Demand	Anodyne	KCNQ2	18	40
CO[C@@H](CS(=O)(=O)Nc1ccc2c(c1)CCN2C(C)=O)c1ccccc1	ZINC000450966516	FF	On-Demand	Anodyne	HSD17B3	47	33
CO[C@H](CS(=O)(=O)Nc1ccc2c(c1)CCN2C(C)=O)c1ccccc1	ZINC000450966517	FF	On-Demand	Anodyne	HSD17B3	47	33
CCOC(=O)c1ccc(CS(=O)(=O)NCc2ccccn2)cc1	ZINC000450966528	ED	On-Demand	Anodyne	TMPRSS11D	46	32
Cc1ccc(F)c(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450966536	DH	On-Demand	Anodyne	FFAR4	29	41
O=S(=O)(Cc1c(F)cccc1Cl)Nc1ccc(N2CCOCC2)nc1	ZINC000450966537	GF	On-Demand	Anodyne	STAT6	45	38
O=S(=O)(Cc1c(F)cccc1Cl)Nc1ccc(N2CCOCC2)nc1	ZINC000450966537	GF	On-Demand	Anodyne	DGAT1	32	44
Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966544	EF	On-Demand	Anodyne	PPIA	29	41
Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966544	EF	On-Demand	Anodyne	IDO1	28	40
Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966544	EF	On-Demand	Anodyne	PFK	0	43
CCCOc1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450966545	FE	On-Demand	Anodyne	PRTN3	52	34
CCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450966547	ED	On-Demand	Anodyne	CA1	19	48
Cc1cnc(CCCC(=O)Nc2cccc(C(C)(F)F)c2)o1	ZINC000450966548	DI	On-Demand	Anodyne	HDAC10	29	47
Cc1cnc(CCCC(=O)Nc2cccc(C(C)(F)F)c2)o1	ZINC000450966548	DI	On-Demand	Anodyne	HDAC6	27	47
CC1=C(C(=O)NCC2CCN(CC(F)(F)F)CC2)CCC(C)(C)C1	ZINC000450966549	EH	On-Demand	Anodyne	CACNA1I	77	40
COC(=O)[C@@H](NC(=O)COc1cccc2c1C(=O)CC2)C(C)C	ZINC000450966552	DD	On-Demand	Anodyne	CAPN2	23	42
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCCn2ccnc2)c1	ZINC000450966568	FE	On-Demand	Anodyne	TBXAS1	49	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCCn2ccnc2)c1	ZINC000450966568	FE	On-Demand	Anodyne	QPCT	40	42
CCN(CC)C(=O)c1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450966581	GE	On-Demand	Anodyne	LIMK2	45	40
C[C@H]1CN(C(=O)CCCC(=O)C2CC2)CCN1c1nc2ccccc2o1	ZINC000450966582	FG	On-Demand	Anodyne	HTR3A	0	46
C[C@@H]1CN(C(=O)CCCC(=O)C2CC2)CCN1c1nc2ccccc2o1	ZINC000450966583	FG	On-Demand	Anodyne	HTR3A	0	46
O=S(=O)(Nc1ccccc1N1CCCC1)c1sccc1F	ZINC000450966587	EG	On-Demand	Anodyne	KCNQ2	84	42
CC(=O)N1CCc2cc(NS(=O)(=O)c3cn(C)nc3C(F)(F)F)ccc21	ZINC000450966592	GE	On-Demand	Anodyne	HSD17B3	44	36
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966593	EI	On-Demand	Anodyne	LEF	41	30
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966593	EI	On-Demand	Anodyne	KCNK3	41	35
C[C@@H](OCc1ccc(F)cc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966593	EI	On-Demand	Anodyne	KCNK9	40	35
CCCOc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c(OC)c1	ZINC000450966595	GG	On-Demand	Anodyne	DRD3	23	43
CCCOc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c(OC)c1	ZINC000450966595	GG	On-Demand	Anodyne	HTR4	81	47
CCCOc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c(OC)c1	ZINC000450966595	GG	On-Demand	Anodyne	CACNA1I	69	39
CCCOc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c(OC)c1	ZINC000450966595	GG	On-Demand	Anodyne	HPGDS	34	40
O=C(COc1ccc(S(=O)(=O)NCc2ccccn2)cc1)NC1CC1	ZINC000450966596	FD	On-Demand	Anodyne	LUXN	0	46
O=C(COc1ccc(S(=O)(=O)NCc2ccccn2)cc1)NC1CC1	ZINC000450966596	FD	On-Demand	Anodyne	ADIPOR1	0	44
O=C(COc1ccc(S(=O)(=O)NCc2ccccn2)cc1)NC1CC1	ZINC000450966596	FD	On-Demand	Anodyne	ADIPOR2	0	44
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966598	EI	On-Demand	Anodyne	LEF	41	30
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966598	EI	On-Demand	Anodyne	KCNK3	41	35
C[C@H](OCc1ccc(F)cc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966598	EI	On-Demand	Anodyne	KCNK9	40	35
Cc1nn(CC(=O)N2CCN([C@@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-]	ZINC000450966612	FE	On-Demand	Bother	PTAFR	41	40
Cc1nn(CC(=O)N2CCN([C@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-]	ZINC000450966613	FE	On-Demand	Bother	PTAFR	41	40
COc1ccc(OC(F)(F)F)c(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450966628	GF	On-Demand	Anodyne	MTNR1B	19	51
COc1ccc(OC(F)(F)F)c(C(=O)N2CCCN(C(=O)C3CC3)CC2)c1	ZINC000450966628	GF	On-Demand	Anodyne	EPHX2	34	44
Cc1nn([C@H](C(=O)Nc2cccc(C(F)(F)F)c2)C(C)C)cc1[N+](=O)[O-]	ZINC000450966631	FH	On-Demand	Bother	AADAC	0	44
COC(=O)[C@@H](NS(=O)(=O)c1cc(Br)c(C#N)cc1F)C(C)C	ZINC000450966632	GD	On-Demand	Mild	LEF	25	40
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC(C)C)cc2)c1	ZINC000450966634	FG	On-Demand	Anodyne	CA2	15	42
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC(C)C)cc2)c1	ZINC000450966634	FG	On-Demand	Anodyne	LPL	59	40
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC(C)C)cc2)c1	ZINC000450966634	FG	On-Demand	Anodyne	CA1	25	42
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC(C)C)cc2)c1	ZINC000450966634	FG	On-Demand	Anodyne	CA12	19	42
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC(C)C)cc2)c1	ZINC000450966634	FG	On-Demand	Anodyne	CA9	17	42
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC(C)C)cc2)c1	ZINC000450966634	FG	On-Demand	Anodyne	NCE103	19	42
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC(C)C)cc2)c1	ZINC000450966634	FG	On-Demand	Anodyne	LIPG	25	40
CO[C@@H](CS(=O)(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000450966635	GG	On-Demand	Anodyne	LTA4H	15	40
CO[C@@H](CS(=O)(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000450966635	GG	On-Demand	Anodyne	HRH3	22	43
CO[C@@H](CS(=O)(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000450966635	GG	On-Demand	Anodyne	SIGMAR1	32	44
CO[C@@H](CS(=O)(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000450966635	GG	On-Demand	Anodyne	LEF	19	42
Cc1nn([C@@H](C(=O)Nc2cccc(C(F)(F)F)c2)C(C)C)cc1[N+](=O)[O-]	ZINC000450966636	FH	On-Demand	Bother	AADAC	0	44
Cc1nn(C)cc1CC(=O)NC(C)(C)c1cccc(Cl)c1F	ZINC000450966637	DG	On-Demand	Anodyne	P2RX7	46	42
CCOC(=O)C1(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450966645	FD	On-Demand	Anodyne	NPFFR1	48	36
CO[C@H](CS(=O)(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000450966647	GG	On-Demand	Anodyne	LTA4H	15	40
CO[C@H](CS(=O)(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000450966647	GG	On-Demand	Anodyne	HRH3	22	43
CO[C@H](CS(=O)(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000450966647	GG	On-Demand	Anodyne	SIGMAR1	32	44
CO[C@H](CS(=O)(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000450966647	GG	On-Demand	Anodyne	LEF	19	42
C[C@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450966648	FG	On-Demand	Anodyne	CHRM4	17	41
C[C@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450966648	FG	On-Demand	Anodyne	CHRM5	40	42
C[C@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450966648	FG	On-Demand	Anodyne	TACR2	40	33
C[C@@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450966649	FG	On-Demand	Anodyne	CHRM4	17	41
C[C@@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450966649	FG	On-Demand	Anodyne	CHRM5	40	42
C[C@@H](CCN1CCN(C)CC1)NC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450966649	FG	On-Demand	Anodyne	TACR2	40	33
C[C@H]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450966650	DF	On-Demand	Bother	MAPK13	50	38
C[C@@H]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450966652	DF	On-Demand	Bother	MAPK13	50	38
C[C@H]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450966653	DF	On-Demand	Bother	MAPK13	50	38
C[C@@H]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450966654	DF	On-Demand	Bother	MAPK13	50	38
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cccc(N3CCCC3)c2)cc1	ZINC000450966655	GG	On-Demand	Anodyne	P2RY12	42	39
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)NCCc1ccc(Cl)cc1	ZINC000450966664	GG	On-Demand	Anodyne	GPBAR1	22	41
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)NCCc1ccc(Cl)cc1	ZINC000450966665	GG	On-Demand	Anodyne	GPBAR1	22	41
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)NCCc1ccc(Cl)cc1	ZINC000450966666	GG	On-Demand	Anodyne	GPBAR1	22	41
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)NCCc1ccc(Cl)cc1	ZINC000450966667	GG	On-Demand	Anodyne	GPBAR1	22	41
CCOc1ccc(-c2nc(C3CCOCC3)c(C)s2)cc1OC	ZINC000450966675	EI	On-Demand	Anodyne	DCK	42	39
CCOc1ccc(-c2nc(C3CCOCC3)c(C)s2)cc1OC	ZINC000450966675	EI	On-Demand	Anodyne	GAK	30	40
CNS(=O)(=O)NCC(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000450966678	EB	On-Demand	Anodyne	MTNR1A	53	39
COc1cc(NS(=O)(=O)c2sccc2Cl)ccc1N1CCCC1=O	ZINC000450966682	GG	On-Demand	Anodyne	GHSR	0	47
COc1cc(NS(=O)(=O)c2sccc2Cl)ccc1N1CCCC1=O	ZINC000450966682	GG	On-Demand	Anodyne	PKM	21	46
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450966685	GH	On-Demand	Anodyne	CCR3	42	34
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450966687	GH	On-Demand	Anodyne	CCR3	42	34
C[C@H](NC(=O)[C@@H](C)OCc1ccc(F)cc1)C1CCN(CC(F)(F)F)CC1	ZINC000450966688	GH	On-Demand	Anodyne	CCR3	42	34
C[C@@H](OCc1ccc(F)cc1)C(=O)N[C@H](C)C1CCN(CC(F)(F)F)CC1	ZINC000450966689	GH	On-Demand	Anodyne	CCR3	42	34
CCOC(=O)c1ccc(CS(=O)(=O)N(C)Cc2cccc(OC)c2)cc1	ZINC000450966701	GF	On-Demand	Anodyne	HSD17B2	24	47
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1cc(C)cs1	ZINC000450966702	EF	On-Demand	Anodyne	SRD5A1	37	47
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1cc(C)cs1	ZINC000450966702	EF	On-Demand	Anodyne	SRD5A2	36	47
Cc1ccc(C)c(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450966706	DH	On-Demand	Anodyne	FFAR4	35	46
CCC[C@H](O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966715	EF	On-Demand	Anodyne	SIGMAR1	33	41
CCC[C@H](O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966715	EF	On-Demand	Anodyne	PREP	56	44
CCC[C@H](O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966715	EF	On-Demand	Anodyne	ABCB1	49	40
CCC[C@H](O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966715	EF	On-Demand	Anodyne	BIRC2	56	48
CCC[C@H](O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966716	EF	On-Demand	Anodyne	SIGMAR1	33	41
CCC[C@H](O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966716	EF	On-Demand	Anodyne	PREP	56	44
CCC[C@H](O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966716	EF	On-Demand	Anodyne	ABCB1	49	40
CCC[C@H](O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966716	EF	On-Demand	Anodyne	BIRC2	56	48
CCC[C@@H](O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966717	EF	On-Demand	Anodyne	SIGMAR1	33	41
CCC[C@@H](O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966717	EF	On-Demand	Anodyne	PREP	56	44
CCC[C@@H](O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966717	EF	On-Demand	Anodyne	ABCB1	49	40
CCC[C@@H](O)CN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966717	EF	On-Demand	Anodyne	BIRC2	56	48
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966718	EF	On-Demand	Anodyne	SIGMAR1	33	41
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966718	EF	On-Demand	Anodyne	PREP	56	44
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966718	EF	On-Demand	Anodyne	ABCB1	49	40
CCC[C@@H](O)CN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450966718	EF	On-Demand	Anodyne	BIRC2	56	48
O=C(NCC1(CO)CCCC1)c1cccnc1-n1cc(Br)cn1	ZINC000450966727	GE	On-Demand	Anodyne	HCN1	59	34
O=C(NCC1(CO)CCCC1)c1cccnc1-n1cc(Br)cn1	ZINC000450966727	GE	On-Demand	Anodyne	HCN4	51	33
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCc1ccccc1	ZINC000450966730	CH	On-Demand	Anodyne	HRH3	46	46
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CCc1ccccc1	ZINC000450966730	CH	On-Demand	Anodyne	SIGMAR1	24	45
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCc1ccccc1	ZINC000450966731	CH	On-Demand	Anodyne	HRH3	46	46
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CCc1ccccc1	ZINC000450966731	CH	On-Demand	Anodyne	SIGMAR1	24	45
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCc1ccccc1	ZINC000450966732	CH	On-Demand	Anodyne	HRH3	46	46
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CCc1ccccc1	ZINC000450966732	CH	On-Demand	Anodyne	SIGMAR1	24	45
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCc1ccccc1	ZINC000450966733	CH	On-Demand	Anodyne	HRH3	46	46
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CCc1ccccc1	ZINC000450966733	CH	On-Demand	Anodyne	SIGMAR1	24	45
CC(C)CCC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966735	GF	On-Demand	Anodyne	MMP13	43	41
CC(C)CCC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966735	GF	On-Demand	Anodyne	MMP2	32	41
CC(C)CCC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966735	GF	On-Demand	Anodyne	MMP3	25	41
CC(C)CCC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966735	GF	On-Demand	Anodyne	ADAMTS4	60	36
CC(C)CCC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966735	GF	On-Demand	Anodyne	LUXN	0	43
CC(C)CCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966736	GF	On-Demand	Anodyne	MMP13	43	41
CC(C)CCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966736	GF	On-Demand	Anodyne	MMP2	32	41
CC(C)CCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966736	GF	On-Demand	Anodyne	MMP3	25	41
CC(C)CCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966736	GF	On-Demand	Anodyne	ADAMTS4	60	36
CC(C)CCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966736	GF	On-Demand	Anodyne	LUXN	0	43
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccc(Cl)cn1	ZINC000450966742	FJ	On-Demand	Anodyne	SLC6A1	17	40
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450966779	EG	On-Demand	Anodyne	LPL	42	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	F2	49	48
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	PLG	54	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	ACE	54	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	MME	75	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CTSD	43	41
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	PGC	71	35
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CTRA_BOVIN	27	41
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CTSB	45	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	TRY2_BOVIN	86	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	PAPA1_CARPA	52	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CYSP_TRYCR	57	41
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CACNA1B	40	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	TIMP3	71	39
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	AMY2	46	31
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CAPNS1	72	39
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	MMP3	22	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	REN	85	43
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CAPN1	68	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	MMP9	23	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CAPN2	62	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	CTSE	50	34
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	ACE2	64	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	PGA5	50	35
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	ST14	89	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	FPR1	39	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	POL	0	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	NPR	50	41
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	HDA106	0	43
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	BIRC2	22	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	TMPRSS11D	81	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCC1CCCC1	ZINC000450966780	EE	On-Demand	Anodyne	TMPRSS6	75	36
CC(C)OC(C)(C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966783	CH	On-Demand	Anodyne	KCNK3	66	40
CC(C)OC(C)(C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450966783	CH	On-Demand	Anodyne	KCNK9	71	43
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966797	GE	On-Demand	Anodyne	TGM2	58	45
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966797	GE	On-Demand	Anodyne	F13A1	96	45
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966797	GE	On-Demand	Anodyne	AKR1C3	24	41
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966797	GE	On-Demand	Anodyne	ELOVL6	0	48
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966797	GE	On-Demand	Anodyne	RAC1	0	40
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966797	GE	On-Demand	Anodyne	NAMPT	27	42
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966798	GE	On-Demand	Anodyne	TGM2	58	45
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966798	GE	On-Demand	Anodyne	F13A1	96	45
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966798	GE	On-Demand	Anodyne	AKR1C3	24	41
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966798	GE	On-Demand	Anodyne	ELOVL6	0	48
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966798	GE	On-Demand	Anodyne	RAC1	0	40
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000450966798	GE	On-Demand	Anodyne	NAMPT	27	42
Cc1csc(S(=O)(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)c1	ZINC000450966812	GF	On-Demand	Anodyne	KCNQ2	41	33
CCOCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966813	FD	On-Demand	Anodyne	MMP13	34	41
CCOCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966813	FD	On-Demand	Anodyne	MMP2	20	46
CCOCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966813	FD	On-Demand	Anodyne	MMP3	21	41
CCOCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966813	FD	On-Demand	Anodyne	MMP1	15	46
CCOCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966813	FD	On-Demand	Anodyne	LUXN	0	44
CCOCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966813	FD	On-Demand	Anodyne	ADIPOR1	0	40
CCOCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450966813	FD	On-Demand	Anodyne	ADIPOR2	0	40
CCO[C@H]1C[C@@H](NCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450966819	GG	On-Demand	Bother	KCNMA1	20	43
CCO[C@@H]1C[C@@H](NCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450966820	GG	On-Demand	Bother	KCNMA1	20	43
CCO[C@H]1C[C@H](NCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450966821	GG	On-Demand	Bother	KCNMA1	20	43
CCO[C@@H]1C[C@H](NCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C12CCCC2	ZINC000450966822	GG	On-Demand	Bother	KCNMA1	20	43
CCOC(=O)c1ccc(CS(=O)(=O)N(CC)Cc2ccccc2)cc1	ZINC000450966823	FG	On-Demand	Anodyne	F2RL3	21	43
CCOC(=O)c1ccc(CS(=O)(=O)N(CC)Cc2ccccc2)cc1	ZINC000450966823	FG	On-Demand	Anodyne	RORC	23	45
CCOC(=O)c1ccc(CS(=O)(=O)N(CC)Cc2ccccc2)cc1	ZINC000450966823	FG	On-Demand	Anodyne	RORB	0	43
Cc1csc(S(=O)(=O)N2CCC(C)CC2)c1	ZINC000450966825	CE	On-Demand	Anodyne	EPHX2	22	40
CC(=O)N[C@H](C)CCc1ccc(-c2csc(-c3ccc[nH]3)n2)cc1	ZINC000450966838	EI	On-Demand	Anodyne	ACACA	25	42
CC(=O)N[C@@H](C)CCc1ccc(-c2csc(-c3ccc[nH]3)n2)cc1	ZINC000450966839	EI	On-Demand	Anodyne	ACACA	25	42
CC[C@@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450966850	FG	On-Demand	Anodyne	HTR1A	16	40
CC[C@@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450966850	FG	On-Demand	Anodyne	HTR1D	22	40
CC[C@@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450966850	FG	On-Demand	Anodyne	CCR3	24	40
CC[C@@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450966850	FG	On-Demand	Anodyne	FAAH	23	44
CC[C@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450966851	FG	On-Demand	Anodyne	HTR1A	16	40
CC[C@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450966851	FG	On-Demand	Anodyne	HTR1D	22	40
CC[C@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450966851	FG	On-Demand	Anodyne	CCR3	24	40
CC[C@H](CC(C)C)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450966851	FG	On-Demand	Anodyne	FAAH	23	44
Cc1cc2c(N3CCN(C(=O)c4cc(C#N)[nH]c4C)CC3)ncnc2s1	ZINC000450966852	FE	On-Demand	Mild	P2RY12	20	41
Nc1ncnc(N2CC[C@@H](CCCO)C2)c1Cl	ZINC000450966872	CD	On-Demand	Anodyne	SIRT3	43	33
Nc1ncnc(N2CC[C@H](CCCO)C2)c1Cl	ZINC000450966873	CD	On-Demand	Anodyne	SIRT3	43	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(C(=O)O)ccc32)cc1	ZINC000450966884	GF	On-Demand	Anodyne	COLA	46	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(C(=O)O)ccc32)cc1	ZINC000450966884	GF	On-Demand	Anodyne	CPT1A	62	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(C(=O)O)ccc32)cc1	ZINC000450966884	GF	On-Demand	Anodyne	CPT2	41	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(C(=O)O)ccc32)cc1	ZINC000450966884	GF	On-Demand	Anodyne	TGM2	50	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(C(=O)O)ccc32)cc1	ZINC000450966884	GF	On-Demand	Anodyne	CPT1B	50	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(C(=O)O)ccc32)cc1	ZINC000450966884	GF	On-Demand	Anodyne	F13A1	81	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(C(=O)O)ccc32)cc1	ZINC000450966884	GF	On-Demand	Anodyne	AKR1C3	50	34
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	HTR1A	0	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	HTR1D	25	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	EDNRB	49	34
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	TACR1	31	43
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	MC4R	39	45
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	TACR2	0	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	CCKAR	65	44
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	MPO	36	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	NMBR	19	44
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	MMP14	69	36
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	MMP11	56	32
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	CCKBR	70	37
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	GHSR	60	38
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	ALOX15	40	56
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	MMP9	18	46
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450966899	GG	On-Demand	Anodyne	MC1R	43	38
CCOc1cc(N2CCN(C)CC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450966901	GF	On-Demand	Anodyne	GHSR	22	44
COC(=O)c1sc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1C	ZINC000450966910	GF	On-Demand	Anodyne	CA2	19	42
COC(=O)c1sc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1C	ZINC000450966910	GF	On-Demand	Anodyne	CA1	24	42
COC(=O)c1sc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1C	ZINC000450966910	GF	On-Demand	Anodyne	CA4	26	42
CC(C)CNS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450966923	CF	On-Demand	Anodyne	MTNN	73	33
C[C@H]1C[C@@]1(C#N)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450966925	DD	On-Demand	Mild	CACNA1I	43	34
CC(C)CC(=O)Nc1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450966929	FH	On-Demand	Anodyne	SLC1A2	41	36
FC1(F)CCCC[C@@H]1CN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000450966937	DH	On-Demand	Anodyne	ETHR	17	43
C[C@H]1C[C@]1(C#N)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450966938	DD	On-Demand	Mild	CACNA1I	43	34
FC1(F)CCCC[C@H]1CN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000450966940	DH	On-Demand	Anodyne	ETHR	17	43
C[C@@H]1C[C@@]1(C#N)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450966941	DD	On-Demand	Mild	CACNA1I	43	34
FC1(F)CCCC[C@@H]1CN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000450966943	DH	On-Demand	Anodyne	ETHR	17	43
C[C@@H]1C[C@]1(C#N)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450966944	DD	On-Demand	Mild	CACNA1I	43	34
FC1(F)CCCC[C@H]1CN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000450966946	DH	On-Demand	Anodyne	ETHR	17	43
C=CCC1(C(=O)NCC2CCN(CC(F)(F)F)CC2)CCCCC1	ZINC000450966947	EH	On-Demand	Mild	CACNA1I	37	41
C[C@@H](c1ccccc1)N1CCN(C(=O)COc2cccc3c2C(=O)CC3)CC1	ZINC000450966956	GG	On-Demand	Anodyne	PTGIR	43	34
C[C@@H](c1ccccc1)N1CCN(C(=O)COc2cccc3c2C(=O)CC3)CC1	ZINC000450966956	GG	On-Demand	Anodyne	VDAC2	0	40
C[C@H](c1ccccc1)N1CCN(C(=O)COc2cccc3c2C(=O)CC3)CC1	ZINC000450966959	GG	On-Demand	Anodyne	PTGIR	43	34
C[C@H](c1ccccc1)N1CCN(C(=O)COc2cccc3c2C(=O)CC3)CC1	ZINC000450966959	GG	On-Demand	Anodyne	VDAC2	0	40
COC(=O)c1ccnc(NS(=O)(=O)CCC2CCCCC2)c1	ZINC000450966975	EF	On-Demand	Anodyne	KDM5C	0	43
COc1cccc(F)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450966980	GH	On-Demand	Anodyne	PDE4D	20	53
COc1cccc(F)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450966980	GH	On-Demand	Anodyne	TAAR1	22	42
COc1cccc(F)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450966980	GH	On-Demand	Anodyne	PDEC	0	40
CC[C@H](CC(F)(F)F)C(=O)Nc1cnns1	ZINC000450966990	CE	On-Demand	Anodyne	AHK3	0	40
CC[C@@H](CC(F)(F)F)C(=O)Nc1cnns1	ZINC000450966992	CE	On-Demand	Anodyne	AHK3	0	40
CO[C@H]1C[C@@H](CN2CCCC2)N(CCc2ccc(Cl)cc2)C1	ZINC000450967005	DG	On-Demand	Anodyne	HRH3	18	42
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450967009	GF	On-Demand	Anodyne	ADRB2	20	44
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450967009	GF	On-Demand	Anodyne	ADRB1	15	44
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450967009	GF	On-Demand	Anodyne	ADRB3	15	44
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450967009	GF	On-Demand	Anodyne	CA1	19	40
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450967009	GF	On-Demand	Anodyne	GRM4	17	40
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450967009	GF	On-Demand	Anodyne	CA14	15	40
Cc1cc(N2CCCC2)ccc1NS(=O)(=O)c1sccc1Cl	ZINC000450967024	FI	On-Demand	Anodyne	GHSR	23	41
C[C@@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccc(OC(F)(F)F)cc1	ZINC000450967025	GH	On-Demand	Anodyne	PTGER4	15	45
C[C@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccc(OC(F)(F)F)cc1	ZINC000450967026	GH	On-Demand	Anodyne	PTGER4	15	45
CCOC(=O)c1cc(S(=O)(=O)NCCCc2ccccc2)cnc1C(F)F	ZINC000450967029	GG	On-Demand	Anodyne	ALOX15	51	38
CCOC(=O)c1cc(S(=O)(=O)NCCCc2ccccc2)cnc1C(F)F	ZINC000450967029	GG	On-Demand	Anodyne	PDS	46	38
CC[C@H](CC(F)(F)F)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967047	EG	On-Demand	Anodyne	CACNA1I	59	39
CC[C@@H](CC(F)(F)F)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967049	EG	On-Demand	Anodyne	CACNA1I	59	39
CCSc1cccnc1C(=O)N1CC(OC(F)F)C1	ZINC000450967051	CE	On-Demand	Anodyne	FAAH	27	40
CCOC(=O)c1sc(NS(=O)(=O)c2ccc(C3CC3)cc2)nc1C	ZINC000450967053	FG	On-Demand	Anodyne	DHODH	28	46
CC(C)(CF)NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000450967054	DH	On-Demand	Anodyne	RBP4	77	41
CC(C)(C)OC(=O)c1cccc(N2CC[C@@H](CCCO)C2)n1	ZINC000450967062	DF	On-Demand	Anodyne	PRKCQ	0	43
CC(C)(C)OC(=O)c1cccc(N2CC[C@H](CCCO)C2)n1	ZINC000450967064	DF	On-Demand	Anodyne	PRKCQ	0	43
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450967072	DF	On-Demand	Mild	AKR1C3	0	41
C[C@H]1CCCCN1S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450967081	DF	On-Demand	Mild	AKR1C3	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1	ZINC000450967090	EE	On-Demand	Anodyne	CA1	31	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1	ZINC000450967090	EE	On-Demand	Anodyne	MMP13	25	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1	ZINC000450967090	EE	On-Demand	Anodyne	FLT1	40	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1	ZINC000450967090	EE	On-Demand	Anodyne	CA5B	30	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1	ZINC000450967090	EE	On-Demand	Anodyne	CA4	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1	ZINC000450967090	EE	On-Demand	Anodyne	CA5A	35	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1	ZINC000450967090	EE	On-Demand	Anodyne	P96878_MYCTU	44	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1	ZINC000450967090	EE	On-Demand	Anodyne	NAMPT	60	47
CN1CCCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450967096	DD	On-Demand	Anodyne	LPL	46	39
O=C([C@@H]1C[C@@H](F)CN1Cc1ccc(Cl)cc1Cl)N1CCOCC1	ZINC000450967112	FF	On-Demand	Anodyne	AKR1C3	0	42
COc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967113	FG	On-Demand	Anodyne	CA2	17	57
COc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967113	FG	On-Demand	Anodyne	CA1	19	43
COc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967113	FG	On-Demand	Anodyne	COLA	0	40
COc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967113	FG	On-Demand	Anodyne	CPT1A	19	40
COc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967113	FG	On-Demand	Anodyne	MMP2	17	42
COc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967113	FG	On-Demand	Anodyne	GHSR	29	41
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)Nc2cccc(C(C)(F)F)c2)CC3)c1	ZINC000450967120	GJ	On-Demand	Anodyne	EPHX2	20	42
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)Nc2cccc(C(C)(F)F)c2)CC3)c1	ZINC000450967120	GJ	On-Demand	Anodyne	RHOA	0	43
Cc1cccc(-c2nnc3n2C[C@H](C(=O)Nc2cccc(C(C)(F)F)c2)CC3)c1	ZINC000450967125	GJ	On-Demand	Anodyne	EPHX2	20	42
Cc1cccc(-c2nnc3n2C[C@H](C(=O)Nc2cccc(C(C)(F)F)c2)CC3)c1	ZINC000450967125	GJ	On-Demand	Anodyne	RHOA	0	43
CN1CCN(c2nc3ccccc3nc2N2CC[C@H](CCCO)C2)CC1	ZINC000450967130	FD	On-Demand	Anodyne	HTR3A	29	54
CN1CCN(c2nc3ccccc3nc2N2CC[C@H](CCCO)C2)CC1	ZINC000450967130	FD	On-Demand	Anodyne	HRH4	21	54
CN1CCN(c2nc3ccccc3nc2N2CC[C@H](CCCO)C2)CC1	ZINC000450967130	FD	On-Demand	Anodyne	PDE1B	0	43
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H](CCCO)C2)CC1	ZINC000450967131	FD	On-Demand	Anodyne	HTR3A	29	54
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H](CCCO)C2)CC1	ZINC000450967131	FD	On-Demand	Anodyne	HRH4	21	54
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H](CCCO)C2)CC1	ZINC000450967131	FD	On-Demand	Anodyne	PDE1B	0	43
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)c1	ZINC000450967144	GF	On-Demand	Anodyne	CACNA1B	34	41
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CC1(F)F	ZINC000450967146	DE	On-Demand	Anodyne	CACNA1I	54	36
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CC1(F)F	ZINC000450967147	DE	On-Demand	Anodyne	CACNA1I	54	36
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	BMP1	47	37
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	MMP13	38	41
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	ADAM17	18	41
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	MMP2	24	42
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	MMP3	32	55
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	MMP8	31	42
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	MMP9	34	42
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	MMP1	38	42
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	LUXN	0	41
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	ADIPOR1	0	40
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967150	GD	On-Demand	Anodyne	ADIPOR2	0	40
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	CA2	21	53
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	BMP1	45	43
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	CA1	23	45
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	MMP13	39	41
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	COLA	43	38
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	CA14	17	45
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	MMP2	35	41
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	MMP3	25	41
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	MMP8	38	41
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	MMP14	15	41
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	MMP9	28	41
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	MMP12	44	41
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	CA12	20	53
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	CA9	20	53
COCCN(CCOC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967158	FD	On-Demand	Anodyne	MMP1	16	41
CC(F)(F)c1cccc(NC(=O)C(C)(C)C(C)(F)F)c1	ZINC000450967161	CI	On-Demand	Anodyne	HDAH	36	40
CC(F)(F)c1cccc(NC(=O)C(C)(C)C(C)(F)F)c1	ZINC000450967161	CI	On-Demand	Anodyne	IMDH_CRYPV	46	35
CC(F)(F)c1cccc(NC(=O)C(C)(C)C(C)(F)F)c1	ZINC000450967161	CI	On-Demand	Anodyne	PSBA	0	50
CC(F)(F)c1cccc(NC(=O)C(C)(C)C(C)(F)F)c1	ZINC000450967161	CI	On-Demand	Anodyne	KCNK3	63	37
CC(F)(F)c1cccc(NC(=O)C(C)(C)C(C)(F)F)c1	ZINC000450967161	CI	On-Demand	Anodyne	KCNK9	57	37
O=C(c1ccccc1NS(=O)(=O)c1sccc1F)N1CCCC1	ZINC000450967163	FF	On-Demand	Anodyne	PRTN3	47	34
CC(F)(F)c1cccc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450967176	GI	On-Demand	Anodyne	EPHX2	16	46
CC(F)(F)c1cccc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450967176	GI	On-Demand	Anodyne	RHOA	0	41
CC(F)(F)c1cccc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450967177	GI	On-Demand	Anodyne	EPHX2	16	46
CC(F)(F)c1cccc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)c1	ZINC000450967177	GI	On-Demand	Anodyne	RHOA	0	41
Cn1cc(CCNC(=O)c2ccnn2CC(F)(F)F)c2ccc(Cl)cc21	ZINC000450967181	GH	On-Demand	Anodyne	P2RX7	15	40
Cc1cccc2c1O[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)C2	ZINC000450967182	DI	On-Demand	Anodyne	MTTP	42	36
Cc1cccc2c1O[C@@H](C(=O)Nc1cccc(C(C)(F)F)c1)C2	ZINC000450967183	DI	On-Demand	Anodyne	MTTP	42	36
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCC2)c1	ZINC000450967189	FG	On-Demand	Anodyne	LPL	51	38
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCC2)c1	ZINC000450967189	FG	On-Demand	Anodyne	PRTN3	46	33
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCC2)c1	ZINC000450967189	FG	On-Demand	Anodyne	CCR8	47	35
CCCCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967190	FE	On-Demand	Anodyne	MMP13	35	43
CCCCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967190	FE	On-Demand	Anodyne	MMP2	18	42
CCCCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967190	FE	On-Demand	Anodyne	MMP3	28	47
CCCCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967190	FE	On-Demand	Anodyne	MMP8	17	41
CCCCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967190	FE	On-Demand	Anodyne	PLA2G4B	66	34
CCCCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967190	FE	On-Demand	Anodyne	MMP9	23	40
CCCCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967190	FE	On-Demand	Anodyne	MMP12	15	41
CCCCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967190	FE	On-Demand	Anodyne	MMP1	28	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450967193	FF	On-Demand	Anodyne	F2	0	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450967193	FF	On-Demand	Anodyne	KCNA5	27	48
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450967193	FF	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450967193	FF	On-Demand	Anodyne	HDA106	0	42
O=C(C1=C(c2ccccc2)CCC1)N1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000450967222	GI	On-Demand	Anodyne	CHRM5	18	44
COC(=O)c1ncccc1S(=O)(=O)N1c2ccccc2C[C@H]1C	ZINC000450967225	EE	On-Demand	Anodyne	GLMU	0	55
COC(=O)c1ncccc1S(=O)(=O)N1c2ccccc2C[C@@H]1C	ZINC000450967226	EE	On-Demand	Anodyne	GLMU	0	55
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967229	FI	On-Demand	Anodyne	PRCP	43	56
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967229	FI	On-Demand	Anodyne	COLA	104	40
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967229	FI	On-Demand	Anodyne	CPT1A	101	40
O=C(c1cncc(Cl)c1)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967229	FI	On-Demand	Anodyne	GRM5	18	44
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967230	FI	On-Demand	Anodyne	PRCP	43	56
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967230	FI	On-Demand	Anodyne	COLA	104	40
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967230	FI	On-Demand	Anodyne	CPT1A	101	40
O=C(c1cncc(Cl)c1)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967230	FI	On-Demand	Anodyne	GRM5	18	44
C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450967231	GF	On-Demand	Anodyne	SIGMAR1	54	38
C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450967232	GF	On-Demand	Anodyne	SIGMAR1	54	38
C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450967233	GF	On-Demand	Anodyne	SIGMAR1	54	38
C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000450967234	GF	On-Demand	Anodyne	SIGMAR1	54	38
COc1cc(CN2C[C@@H](C)[C@H](C(N)=O)C2)ccc1Cl	ZINC000450967269	CD	On-Demand	Anodyne	DRD4	23	42
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967272	GJ	On-Demand	Anodyne	PRCP	18	50
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967272	GJ	On-Demand	Anodyne	CPT1A	94	38
O=C([C@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967273	GJ	On-Demand	Anodyne	PRCP	18	50
O=C([C@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967273	GJ	On-Demand	Anodyne	CPT1A	94	38
O=C([C@H]1CC12CCSCC2)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967274	GJ	On-Demand	Anodyne	PRCP	18	50
O=C([C@H]1CC12CCSCC2)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967274	GJ	On-Demand	Anodyne	CPT1A	94	38
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967275	GJ	On-Demand	Anodyne	PRCP	18	50
O=C([C@@H]1CC12CCSCC2)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1	ZINC000450967275	GJ	On-Demand	Anodyne	CPT1A	94	38
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450967276	FH	On-Demand	Mild	ADRB2	38	52
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450967276	FH	On-Demand	Mild	ADRB1	0	46
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@@H]1CCCC[C@@]1(C)O	ZINC000450967276	FH	On-Demand	Mild	ADRB3	41	52
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450967277	FH	On-Demand	Mild	ADRB2	38	52
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450967277	FH	On-Demand	Mild	ADRB1	0	46
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@H]1CCCC[C@]1(C)O	ZINC000450967277	FH	On-Demand	Mild	ADRB3	41	52
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450967278	FH	On-Demand	Mild	ADRB2	38	52
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450967278	FH	On-Demand	Mild	ADRB1	0	46
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@@H]1CCCC[C@]1(C)O	ZINC000450967278	FH	On-Demand	Mild	ADRB3	41	52
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450967279	FH	On-Demand	Mild	ADRB2	38	52
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450967279	FH	On-Demand	Mild	ADRB1	0	46
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@H]1CCCC[C@@]1(C)O	ZINC000450967279	FH	On-Demand	Mild	ADRB3	41	52
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450967283	DD	On-Demand	Anodyne	HTR1A	24	47
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450967283	DD	On-Demand	Anodyne	HTR7	25	41
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450967283	DD	On-Demand	Anodyne	NPY2R	44	33
CC[C@H](O)CC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450967283	DD	On-Demand	Anodyne	PRNP	39	42
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450967284	DD	On-Demand	Anodyne	HTR1A	24	47
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450967284	DD	On-Demand	Anodyne	HTR7	25	41
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450967284	DD	On-Demand	Anodyne	NPY2R	44	33
CC[C@@H](O)CC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000450967284	DD	On-Demand	Anodyne	PRNP	39	42
C=CCC1(C(=O)Nc2ccc(F)c(OC)c2)CCCC1	ZINC000450967288	CH	On-Demand	Mild	ENPP1	49	30
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CC[C@H](C)C2)c(F)c1	ZINC000450967292	DE	On-Demand	Anodyne	MAPK13	72	33
Cc1nnnn1-c1ccc(C(=O)N[C@H]2CC[C@@H](C)C2)c(F)c1	ZINC000450967293	DE	On-Demand	Anodyne	MAPK13	72	33
Cc1nnnn1-c1ccc(C(=O)N[C@@H]2CC[C@@H](C)C2)c(F)c1	ZINC000450967294	DE	On-Demand	Anodyne	MAPK13	72	33
Cc1nnnn1-c1ccc(C(=O)N[C@H]2CC[C@H](C)C2)c(F)c1	ZINC000450967295	DE	On-Demand	Anodyne	MAPK13	72	33
COC(=O)c1ncccc1S(=O)(=O)N(C)[C@H](C)c1ccccc1	ZINC000450967296	EE	On-Demand	Anodyne	KCNA5	41	38
COC(=O)c1ncccc1S(=O)(=O)N(C)[C@@H](C)c1ccccc1	ZINC000450967297	EE	On-Demand	Anodyne	KCNA5	41	38
C[C@@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967303	DE	On-Demand	Anodyne	ACE	50	39
C[C@@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967303	DE	On-Demand	Anodyne	FKBP1A	42	43
C[C@@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967303	DE	On-Demand	Anodyne	SLC6A1	109	37
C[C@@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967303	DE	On-Demand	Anodyne	SIGMAR1	44	48
C[C@@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967303	DE	On-Demand	Anodyne	PREP	61	48
C[C@@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967303	DE	On-Demand	Anodyne	MMP3	26	40
C[C@@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967303	DE	On-Demand	Anodyne	XIAP	28	41
C[C@@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967303	DE	On-Demand	Anodyne	BIRC2	105	55
C[C@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967304	DE	On-Demand	Anodyne	ACE	50	39
C[C@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967304	DE	On-Demand	Anodyne	FKBP1A	42	43
C[C@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967304	DE	On-Demand	Anodyne	SLC6A1	109	37
C[C@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967304	DE	On-Demand	Anodyne	SIGMAR1	44	48
C[C@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967304	DE	On-Demand	Anodyne	PREP	61	48
C[C@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967304	DE	On-Demand	Anodyne	MMP3	26	40
C[C@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967304	DE	On-Demand	Anodyne	XIAP	28	41
C[C@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967304	DE	On-Demand	Anodyne	BIRC2	105	55
C[C@@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967305	DE	On-Demand	Anodyne	ACE	50	39
C[C@@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967305	DE	On-Demand	Anodyne	FKBP1A	42	43
C[C@@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967305	DE	On-Demand	Anodyne	SLC6A1	109	37
C[C@@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967305	DE	On-Demand	Anodyne	SIGMAR1	44	48
C[C@@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967305	DE	On-Demand	Anodyne	PREP	61	48
C[C@@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967305	DE	On-Demand	Anodyne	MMP3	26	40
C[C@@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967305	DE	On-Demand	Anodyne	XIAP	28	41
C[C@@H](O)CCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967305	DE	On-Demand	Anodyne	BIRC2	105	55
C[C@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967306	DE	On-Demand	Anodyne	ACE	50	39
C[C@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967306	DE	On-Demand	Anodyne	FKBP1A	42	43
C[C@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967306	DE	On-Demand	Anodyne	SLC6A1	109	37
C[C@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967306	DE	On-Demand	Anodyne	SIGMAR1	44	48
C[C@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967306	DE	On-Demand	Anodyne	PREP	61	48
C[C@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967306	DE	On-Demand	Anodyne	MMP3	26	40
C[C@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967306	DE	On-Demand	Anodyne	XIAP	28	41
C[C@H](O)CCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450967306	DE	On-Demand	Anodyne	BIRC2	105	55
COc1cc(NC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)ccc1F	ZINC000450967319	CG	On-Demand	Anodyne	ENPP1	52	31
COc1cc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)ccc1F	ZINC000450967320	CG	On-Demand	Anodyne	ENPP1	69	34
COc1cc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]23)ccc1F	ZINC000450967321	CG	On-Demand	Anodyne	ENPP1	69	34
COc1cc(NC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)ccc1F	ZINC000450967322	CG	On-Demand	Anodyne	ENPP1	52	31
O=C(c1ccc(NS(=O)(=O)c2sccc2F)cc1)N1CCCC1	ZINC000450967323	FF	On-Demand	Anodyne	MLYCD	18	40
O=C(c1ccc(NS(=O)(=O)c2sccc2F)cc1)N1CCCC1	ZINC000450967323	FF	On-Demand	Anodyne	L3MBTL3	66	37
NC(=O)C1CCN(c2ccccc2NS(=O)(=O)c2sccc2Cl)CC1	ZINC000450967324	GF	On-Demand	Anodyne	KCNQ2	53	38
O=C(CSc1ccc(Br)c(Cl)c1)N1CCOCC1	ZINC000450967325	FG	On-Demand	Anodyne	AKR1C3	30	41
COc1ccc(C)nc1NS(=O)(=O)c1cc(C)cs1	ZINC000450967326	CF	On-Demand	Anodyne	GHSR	0	45
Cc1ccn(-c2ccccc2C(=O)N[C@@H]2CC[C@H](C)C2)n1	ZINC000450967327	CG	On-Demand	Anodyne	CNR2	16	45
Cc1ccn(-c2ccccc2C(=O)N[C@H]2CC[C@H](C)C2)n1	ZINC000450967328	CG	On-Demand	Anodyne	CNR2	16	45
Cc1ccn(-c2ccccc2C(=O)N[C@H]2CC[C@@H](C)C2)n1	ZINC000450967329	CG	On-Demand	Anodyne	CNR2	16	45
Cc1ccn(-c2ccccc2C(=O)N[C@@H]2CC[C@@H](C)C2)n1	ZINC000450967330	CG	On-Demand	Anodyne	CNR2	16	45
CCOC(=O)c1cc(S(N)(=O)=O)cnc1C(F)F	ZINC000450967331	CC	On-Demand	Anodyne	CA2	15	41
CCOC(=O)c1cc(S(N)(=O)=O)cnc1C(F)F	ZINC000450967331	CC	On-Demand	Anodyne	CA7	21	41
COc1cc(NC(=O)[C@@H]2CCCCN2C2CCCC2)ccc1F	ZINC000450967334	DH	On-Demand	Anodyne	GRM4	17	43
COc1cc(NC(=O)[C@H]2CCCCN2C2CCCC2)ccc1F	ZINC000450967335	DH	On-Demand	Anodyne	GRM4	17	43
COc1ncccc1N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967348	GD	On-Demand	Anodyne	MMP13	31	41
COc1ncccc1N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967348	GD	On-Demand	Anodyne	MMP9	31	41
COc1ncccc1N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967348	GD	On-Demand	Anodyne	LUXN	0	42
NC(=O)c1cc(N2CCOCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450967350	GD	On-Demand	Anodyne	MAPK9	33	43
NC(=O)c1cc(N2CCOCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450967350	GD	On-Demand	Anodyne	MAPK10	36	43
NC(=O)c1cc(N2CCOCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450967350	GD	On-Demand	Anodyne	STAT6	60	38
CC1(S(=O)(=O)NC[C@H]2COc3ccccc3O2)CC1	ZINC000450967355	CD	On-Demand	Anodyne	ADRA2B	16	42
CC1(S(=O)(=O)NC[C@@H]2COc3ccccc3O2)CC1	ZINC000450967356	CD	On-Demand	Anodyne	ADRA2B	16	42
CCN1CCC(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)CC1	ZINC000450967359	FE	On-Demand	Anodyne	CCR8	87	38
CCN1CCC(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)CC1	ZINC000450967359	FE	On-Demand	Anodyne	SFRP1	143	45
CCN1CCC(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)CC1	ZINC000450967359	FE	On-Demand	Anodyne	WNT3	95	43
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967360	GE	On-Demand	Anodyne	ACE	23	40
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967360	GE	On-Demand	Anodyne	AGTR2	73	38
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967360	GE	On-Demand	Anodyne	ADAM17	18	43
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967360	GE	On-Demand	Anodyne	MMP3	37	58
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967360	GE	On-Demand	Anodyne	MMP8	37	58
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967360	GE	On-Demand	Anodyne	MMP9	18	43
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967360	GE	On-Demand	Anodyne	ADAM9	79	41
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967360	GE	On-Demand	Anodyne	MMP1	25	43
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967361	GE	On-Demand	Anodyne	ACE	23	40
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967361	GE	On-Demand	Anodyne	AGTR2	73	38
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967361	GE	On-Demand	Anodyne	ADAM17	18	43
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967361	GE	On-Demand	Anodyne	MMP3	37	58
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967361	GE	On-Demand	Anodyne	MMP8	37	58
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967361	GE	On-Demand	Anodyne	MMP9	18	43
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967361	GE	On-Demand	Anodyne	ADAM9	79	41
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCOCc1ccccc1	ZINC000450967361	GE	On-Demand	Anodyne	MMP1	25	43
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	DRD2	19	50
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	FKBP1A	40	41
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	DRD4	40	50
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	ACHE	27	45
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	SLC6A1	78	35
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	DRD3	0	47
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	LTA4H	30	41
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	CYSLTR2	48	34
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	HRH3	24	43
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	SIGMAR1	56	46
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	CCR3	46	46
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	UTS2R	20	41
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	PREP	53	42
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	CCR2	19	45
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	SLC6A5	21	40
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	MCHR1	27	50
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	CACNA1G	20	40
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	CYP2J2	47	36
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	BIRC2	54	44
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	ADIPOR1	0	44
CC(=O)c1ccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967375	GH	On-Demand	Anodyne	ADIPOR2	0	44
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	DRD2	19	50
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	FKBP1A	40	41
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	DRD4	40	50
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	ACHE	27	45
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	SLC6A1	78	35
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	DRD3	0	47
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	LTA4H	30	41
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	CYSLTR2	48	34
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	HRH3	24	43
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	SIGMAR1	56	46
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	CCR3	46	46
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	UTS2R	20	41
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	PREP	53	42
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	CCR2	19	45
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	SLC6A5	21	40
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	MCHR1	27	50
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	CACNA1G	20	40
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	CYP2J2	47	36
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	BIRC2	54	44
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	ADIPOR1	0	44
CC(=O)c1ccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)cc1	ZINC000450967376	GH	On-Demand	Anodyne	ADIPOR2	0	44
CCc1cccc(C(=O)N[C@@]2(C#N)CCOC2)n1	ZINC000450967378	BD	On-Demand	Mild	TSPO	18	40
CCc1cccc(C(=O)N[C@]2(C#N)CCOC2)n1	ZINC000450967379	BD	On-Demand	Mild	TSPO	18	40
COc1ccccc1-n1cnc2cc(C(=O)N[C@]3(C#N)CCOC3)ccc21	ZINC000450967384	FE	On-Demand	Mild	HPGD	42	54
C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)CC1CC(F)(F)C1	ZINC000450967404	EI	On-Demand	Anodyne	MDM2	75	34
C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)CC1CC(F)(F)C1	ZINC000450967405	EI	On-Demand	Anodyne	MDM2	75	34
C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)CC1CC(F)(F)C1	ZINC000450967406	EI	On-Demand	Anodyne	MDM2	75	34
C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)CC1CC(F)(F)C1	ZINC000450967407	EI	On-Demand	Anodyne	MDM2	75	34
CCOC(=O)CN(C(=O)COc1cccc2c1C(=O)CC2)c1ccccc1	ZINC000450967412	FF	On-Demand	Anodyne	TDP1	0	41
CCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450967418	EE	On-Demand	Anodyne	PTGER2	22	40
CCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450967418	EE	On-Demand	Anodyne	MMP8	32	46
CCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450967418	EE	On-Demand	Anodyne	MMP9	30	46
CCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450967418	EE	On-Demand	Anodyne	MMP12	23	40
CCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450967418	EE	On-Demand	Anodyne	MMP1	28	46
CCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450967418	EE	On-Demand	Anodyne	LIMK2	41	34
C=CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967420	DC	On-Demand	Mild	LUXN	0	45
C=CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967420	DC	On-Demand	Mild	ADIPOR1	0	43
C=CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967420	DC	On-Demand	Mild	ADIPOR2	0	43
CC(C)[C@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccccc1	ZINC000450967429	EH	On-Demand	Anodyne	PTGIR	41	35
CC(C)[C@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccccc1	ZINC000450967429	EH	On-Demand	Anodyne	CAPN2	27	41
CC(C)[C@@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccccc1	ZINC000450967430	EH	On-Demand	Anodyne	PTGIR	41	35
CC(C)[C@@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccccc1	ZINC000450967430	EH	On-Demand	Anodyne	CAPN2	27	41
CCC(=O)C1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CC1	ZINC000450967437	FE	On-Demand	Anodyne	HTR1A	15	40
CCC(=O)C1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CC1	ZINC000450967437	FE	On-Demand	Anodyne	HTR1D	24	40
CCC(=O)C1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CC1	ZINC000450967437	FE	On-Demand	Anodyne	CCR3	31	40
CCC(=O)C1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CC1	ZINC000450967437	FE	On-Demand	Anodyne	FAAH	28	46
CCC(=O)C1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CC1	ZINC000450967437	FE	On-Demand	Anodyne	MCHR2	51	34
CCC(=O)C1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CC1	ZINC000450967437	FE	On-Demand	Anodyne	P2RY14	42	32
CCC(=O)C1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CC1	ZINC000450967437	FE	On-Demand	Anodyne	NPFFR1	51	34
O=C(CCCC(=O)C1CC1)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450967442	GH	On-Demand	Anodyne	NAMPT	26	42
CCCCO[C@@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967443	FE	On-Demand	Anodyne	CA2	15	55
CCCCO[C@@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967443	FE	On-Demand	Anodyne	CA1	15	55
CCCCO[C@@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967443	FE	On-Demand	Anodyne	CA7	34	55
CCCCO[C@@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967443	FE	On-Demand	Anodyne	CA12	15	55
CCCCO[C@@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967443	FE	On-Demand	Anodyne	CA9	20	55
CCCCO[C@@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967444	FE	On-Demand	Anodyne	CA2	15	55
CCCCO[C@@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967444	FE	On-Demand	Anodyne	CA1	15	55
CCCCO[C@@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967444	FE	On-Demand	Anodyne	CA7	34	55
CCCCO[C@@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967444	FE	On-Demand	Anodyne	CA12	15	55
CCCCO[C@@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967444	FE	On-Demand	Anodyne	CA9	20	55
CCCCO[C@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967445	FE	On-Demand	Anodyne	CA2	15	55
CCCCO[C@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967445	FE	On-Demand	Anodyne	CA1	15	55
CCCCO[C@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967445	FE	On-Demand	Anodyne	CA7	34	55
CCCCO[C@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967445	FE	On-Demand	Anodyne	CA12	15	55
CCCCO[C@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967445	FE	On-Demand	Anodyne	CA9	20	55
CCCCO[C@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967446	FE	On-Demand	Anodyne	CA2	15	55
CCCCO[C@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967446	FE	On-Demand	Anodyne	CA1	15	55
CCCCO[C@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967446	FE	On-Demand	Anodyne	CA7	34	55
CCCCO[C@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967446	FE	On-Demand	Anodyne	CA12	15	55
CCCCO[C@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C1(C)C	ZINC000450967446	FE	On-Demand	Anodyne	CA9	20	55
CCCNS(=O)(=O)CCOCCN1C(=O)c2ccccc2C1=O	ZINC000450967452	EC	On-Demand	Anodyne	FBPC	0	44
COc1ccc(OC(F)(F)F)c(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)c1	ZINC000450967463	GF	On-Demand	Anodyne	CACNA1B	34	41
CCOC(=O)c1ccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)nc1	ZINC000450967483	EF	On-Demand	Anodyne	ETHR	56	35
CCOC(=O)c1ccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)nc1	ZINC000450967484	EF	On-Demand	Anodyne	ETHR	56	35
COCCN1C(=O)N[C@@H]2CN(Cc3ccc(C(C)=O)cc3)CC[C@@H]21	ZINC000450967490	ED	On-Demand	Anodyne	SLC18A3	17	41
COCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967503	EC	On-Demand	Anodyne	MMP13	25	43
COCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967503	EC	On-Demand	Anodyne	LUXN	0	45
COCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967503	EC	On-Demand	Anodyne	ADIPOR1	0	41
COCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967503	EC	On-Demand	Anodyne	ADIPOR2	0	41
CSc1cccc(C)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450967507	GJ	On-Demand	Anodyne	LCK	36	42
CSc1cccc(C)c1NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1	ZINC000450967507	GJ	On-Demand	Anodyne	SHH	40	34
O=C(COc1cccc2c1C(=O)CC2)N[C@H]1CCCc2ccccc21	ZINC000450967525	EG	On-Demand	Anodyne	BDKRB1	54	35
O=C(COc1cccc2c1C(=O)CC2)N[C@@H]1CCCc2ccccc21	ZINC000450967529	EG	On-Demand	Anodyne	BDKRB1	54	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	NR3C1	0	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	NR3C2	0	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	SSTR2	28	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	OPRM1	0	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	OPRD1	0	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	GHRHR	32	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MME	27	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	EDNRB	52	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	EDNRA	40	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	TACR1	25	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MC4R	40	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	BMP1	30	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	TACR2	28	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	KCNA5	0	66
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	CCKAR	98	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	CTSL	31	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	BRS3	24	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	NMBR	68	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MC3R	55	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MC5R	58	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MMP2	25	49
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MMP8	36	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MMP14	25	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	GRPR	87	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	ECE1	63	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MMP11	79	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	CCKBR	80	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	GHSR	73	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MMP9	25	52
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MC1R	78	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	ADAM9	40	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MMP7	29	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	MMP1	0	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	NPR	34	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	KISS1R	63	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)C1(C)CC1	ZINC000450967533	ED	On-Demand	Anodyne	ERAP2	44	41
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)c4ccco4)CC3)ccc2c1	ZINC000450967537	GF	On-Demand	Anodyne	TRY2_BOVIN	60	43
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)c4ccco4)CC3)ccc2c1	ZINC000450967537	GF	On-Demand	Anodyne	ALDH1A1	18	42
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)c4ccco4)CC3)ccc2c1	ZINC000450967537	GF	On-Demand	Anodyne	PKM	40	40
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)c4ccco4)CC3)ccc2c1	ZINC000450967537	GF	On-Demand	Anodyne	TGM2	59	35
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)c4ccco4)CC3)ccc2c1	ZINC000450967537	GF	On-Demand	Anodyne	MMP7	15	48
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)c4ccco4)CC3)ccc2c1	ZINC000450967537	GF	On-Demand	Anodyne	F13A1	73	38
CCOc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450967540	DG	On-Demand	Anodyne	MMP2	20	44
CCOc1ccc(S(=O)(=O)C[C@H]2CCCC2(F)F)cc1	ZINC000450967540	DG	On-Demand	Anodyne	MMP14	21	42
CCOc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450967542	DG	On-Demand	Anodyne	MMP2	20	44
CCOc1ccc(S(=O)(=O)C[C@@H]2CCCC2(F)F)cc1	ZINC000450967542	DG	On-Demand	Anodyne	MMP14	21	42
C[C@@H]1CN(C(=O)c2cccc(C(F)(F)F)n2)CCN1c1nc2ccccc2o1	ZINC000450967549	GH	On-Demand	Anodyne	SMO	33	40
C[C@H]1CN(C(=O)c2cccc(C(F)(F)F)n2)CCN1c1nc2ccccc2o1	ZINC000450967552	GH	On-Demand	Anodyne	SMO	33	40
CCOc1ccc(NS(=O)(=O)c2cc(C)cs2)cc1OC	ZINC000450967554	EG	On-Demand	Anodyne	GHSR	0	45
CCOc1ccc(NS(=O)(=O)c2cc(C)cs2)cc1OC	ZINC000450967554	EG	On-Demand	Anodyne	ALPL	28	40
CCOC(=O)c1cc(S(=O)(=O)N(C)CCc2ccccn2)cnc1C(F)F	ZINC000450967561	GE	On-Demand	Anodyne	GNRHR	15	40
C[C@@H](Oc1ccccn1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450967562	DH	On-Demand	Anodyne	GUAB	0	41
C[C@H](Oc1ccccn1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450967564	DH	On-Demand	Anodyne	GUAB	0	41
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450967565	GF	On-Demand	Anodyne	HTR1A	44	44
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450967565	GF	On-Demand	Anodyne	DRD2	29	44
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450967565	GF	On-Demand	Anodyne	ADRA1D	49	40
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450967565	GF	On-Demand	Anodyne	ADRA1B	39	40
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450967565	GF	On-Demand	Anodyne	DRD3	19	43
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450967565	GF	On-Demand	Anodyne	HCN1	43	33
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450967565	GF	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450967568	GF	On-Demand	Anodyne	HTR1A	44	44
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450967568	GF	On-Demand	Anodyne	DRD2	29	44
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450967568	GF	On-Demand	Anodyne	ADRA1D	49	40
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450967568	GF	On-Demand	Anodyne	ADRA1B	39	40
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450967568	GF	On-Demand	Anodyne	DRD3	19	43
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450967568	GF	On-Demand	Anodyne	HCN1	43	33
CCOc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450967568	GF	On-Demand	Anodyne	HCN4	43	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncccc2OC(F)F)cc1	ZINC000450967573	GG	On-Demand	Anodyne	PPIA	45	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncccc2OC(F)F)cc1	ZINC000450967573	GG	On-Demand	Anodyne	GRM4	22	41
C[C@@H]1CCO[C@@H]1C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000450967577	FI	On-Demand	Anodyne	TRAR	18	40
C[C@@H]1CCO[C@@H]1C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000450967579	FI	On-Demand	Anodyne	TRAR	18	40
CCc1cccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)n1	ZINC000450967586	FF	On-Demand	Anodyne	PDE5A	23	40
CCc1cccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)n1	ZINC000450967586	FF	On-Demand	Anodyne	KCNK3	45	32
Cc1csc(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450967592	FG	On-Demand	Anodyne	P2RY12	18	44
Cc1csc(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450967592	FG	On-Demand	Anodyne	SIRT3	59	33
Cc1csc(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450967592	FG	On-Demand	Anodyne	SIRT2	44	31
CSc1cccc(C(=O)N2CCN(c3nc4ccccc4o3)[C@@H](C)C2)c1	ZINC000450967602	FH	On-Demand	Anodyne	SMO	32	41
CSc1cccc(C(=O)N2CCN(c3nc4ccccc4o3)[C@H](C)C2)c1	ZINC000450967605	FH	On-Demand	Anodyne	SMO	32	41
CC1CCN(CCCNS(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450967613	FF	On-Demand	Mild	CCR1	16	46
CC(=O)N1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450967614	ED	On-Demand	Anodyne	LPL	49	38
O=C1CCc2cccc(OCC(=O)N3CCC(Cc4ccccc4)CC3)c21	ZINC000450967619	FH	On-Demand	Anodyne	PTGIR	44	35
O=C1CCc2cccc(OCC(=O)N3CCC(Cc4ccccc4)CC3)c21	ZINC000450967619	FH	On-Demand	Anodyne	GRIN2B	66	42
O=C1CCc2cccc(OCC(=O)N3CCC(Cc4ccccc4)CC3)c21	ZINC000450967619	FH	On-Demand	Anodyne	CCR3	44	41
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	MMP13	61	41
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	MMP2	45	41
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	MMP3	39	41
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	MMP8	18	40
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	MMP14	26	40
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	MMP9	26	40
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	MMP7	33	40
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	ADAMTS4	70	37
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967625	FE	On-Demand	Anodyne	MMP1	34	40
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	MMP13	61	41
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	MMP2	45	41
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	MMP3	39	41
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	MMP8	18	40
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	MMP14	26	40
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	MMP9	26	40
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	MMP7	33	40
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	ADAMTS4	70	37
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967627	FE	On-Demand	Anodyne	MMP1	34	40
CC(C)(C)C(=O)CCCC(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967641	FG	On-Demand	Anodyne	CACNA1I	61	44
CCCn1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967652	GD	On-Demand	Anodyne	ADORA2B	29	41
CCCn1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450967652	GD	On-Demand	Anodyne	LUXN	0	42
CCOCc1nc(C)c(C(=O)Nc2cccc(C(C)(F)F)c2)s1	ZINC000450967658	EI	On-Demand	Anodyne	KCNK3	60	37
CCOCc1nc(C)c(C(=O)Nc2cccc(C(C)(F)F)c2)s1	ZINC000450967658	EI	On-Demand	Anodyne	KCNK9	53	35
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450967676	GG	On-Demand	Anodyne	RBP4	95	45
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450967676	GG	On-Demand	Anodyne	SFRP1	57	34
C[C@@H](O)CN(C)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000450967676	GG	On-Demand	Anodyne	WNT3	62	34
CC(C)[C@@H](C)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450967691	CF	On-Demand	Anodyne	LEF	27	40
CC(C)[C@H](C)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450967693	CF	On-Demand	Anodyne	LEF	27	40
CCC(=O)CCCN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000450967706	CE	On-Demand	Anodyne	ETHR	54	44
CC(C)Cn1nccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450967708	FF	On-Demand	Anodyne	PFK	0	42
CCC(=O)CCCN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000450967709	CE	On-Demand	Anodyne	ETHR	54	44
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCCCN1C1CCCC1	ZINC000450967720	GG	On-Demand	Anodyne	CACNA1I	46	33
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCCCN1C1CCCC1	ZINC000450967721	GG	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(CF)NC(=O)COc1ccc(C#N)c(Br)c1	ZINC000450967738	EF	On-Demand	Mild	TRPV4	40	31
C[C@@H](Oc1ccccn1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967749	EE	On-Demand	Anodyne	HTR4	49	38
C[C@@H](Oc1ccccn1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967749	EE	On-Demand	Anodyne	CACNA1I	56	35
C[C@@H](Oc1ccccn1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967749	EE	On-Demand	Anodyne	HPGDS	34	41
C[C@H](Oc1ccccn1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967750	EE	On-Demand	Anodyne	HTR4	49	38
C[C@H](Oc1ccccn1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967750	EE	On-Demand	Anodyne	CACNA1I	56	35
C[C@H](Oc1ccccn1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450967750	EE	On-Demand	Anodyne	HPGDS	34	41
CCOc1nc2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450967772	GF	On-Demand	Anodyne	HTR4	59	39
CCOc1nc2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450967772	GF	On-Demand	Anodyne	SSTR5	43	39
CCOc1nc2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450967772	GF	On-Demand	Anodyne	CCR3	17	40
CCOc1nc2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450967772	GF	On-Demand	Anodyne	PLD1	64	38
CCOc1nc2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450967772	GF	On-Demand	Anodyne	CCR2	24	40
CCOc1nc2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450967772	GF	On-Demand	Anodyne	CACNA1I	83	46
CCOc1nc2ccc(C(=O)NCC3CCN(CC(F)(F)F)CC3)cc2[nH]1	ZINC000450967772	GF	On-Demand	Anodyne	HPGDS	38	41
COc1ccccc1-n1cnc2cc(C(=O)N[C@@]3(C#N)CCOC3)ccc21	ZINC000450967785	FE	On-Demand	Mild	HPGD	42	54
COc1cccc(OCCC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450967786	FE	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450967786	FE	On-Demand	Anodyne	MTNR1A	35	46
COc1cccc(OCCC(=O)N2CCN(C(=O)NC(C)(C)C)CC2)c1	ZINC000450967786	FE	On-Demand	Anodyne	MTNR1B	42	46
CCOC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccc(OC)cc2)cc1	ZINC000450967787	GF	On-Demand	Anodyne	BMP1	43	37
CCOC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccc(OC)cc2)cc1	ZINC000450967787	GF	On-Demand	Anodyne	MMP13	17	42
CCOC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccc(OC)cc2)cc1	ZINC000450967787	GF	On-Demand	Anodyne	MMP3	17	41
CCOC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccc(OC)cc2)cc1	ZINC000450967787	GF	On-Demand	Anodyne	MMP9	21	42
CCOC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccc(OC)cc2)cc1	ZINC000450967787	GF	On-Demand	Anodyne	MMP1	22	42
COc1cc(NC(=O)c2c(C3CC3)noc2C)ccc1F	ZINC000450967789	CG	On-Demand	Anodyne	GRM4	17	49
COc1cc2c(cc1OC)CN(S(=O)(=O)c1cc3cc(F)ccc3o1)CC2	ZINC000450967791	GG	On-Demand	Anodyne	ABCB1	22	43
CO[C@@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967820	FD	On-Demand	Anodyne	DRD2	17	45
CO[C@@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967820	FD	On-Demand	Anodyne	DRD4	49	38
CO[C@@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967820	FD	On-Demand	Anodyne	DRD3	33	45
CO[C@@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967820	FD	On-Demand	Anodyne	HTR4	19	40
CO[C@@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967820	FD	On-Demand	Anodyne	PLD2	53	35
CO[C@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967821	FD	On-Demand	Anodyne	DRD2	17	45
CO[C@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967821	FD	On-Demand	Anodyne	DRD4	49	38
CO[C@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967821	FD	On-Demand	Anodyne	DRD3	33	45
CO[C@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967821	FD	On-Demand	Anodyne	HTR4	19	40
CO[C@H](C)CS(=O)(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000450967821	FD	On-Demand	Anodyne	PLD2	53	35
COc1cccc(F)c1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450967822	DG	On-Demand	Anodyne	SSTR1	52	38
COc1cccc(F)c1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450967823	DG	On-Demand	Anodyne	SSTR1	52	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	ZINC000450967825	GF	On-Demand	Anodyne	CA2	25	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	ZINC000450967825	GF	On-Demand	Anodyne	CA1	27	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	ZINC000450967825	GF	On-Demand	Anodyne	CA4	26	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	ZINC000450967825	GF	On-Demand	Anodyne	CA14	15	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	ZINC000450967825	GF	On-Demand	Anodyne	MMP2	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	ZINC000450967825	GF	On-Demand	Anodyne	CA9	19	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	ZINC000450967825	GF	On-Demand	Anodyne	PFK	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1	ZINC000450967825	GF	On-Demand	Anodyne	LIMK2	60	49
COC(=O)c1ccc(CN[C@@H]2CCC[C@H]2OC(F)F)cc1Cl	ZINC000450967828	EG	On-Demand	Anodyne	SSTR3	23	45
CN(C)CC(=O)Nc1ccc(NS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450967843	FF	On-Demand	Anodyne	LDLR	0	40
CCC(=O)C1(C(=O)Nc2ccc(F)c(OC)c2)CC1	ZINC000450967850	CF	On-Demand	Anodyne	ENPP1	49	31
CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)S(=O)(=O)CCC1CCCC1	ZINC000450967864	GF	On-Demand	Anodyne	LDLR	0	40
O=C(Cn1cnc2c1CCCC2)Nc1c(Cl)cccc1C(F)(F)F	ZINC000450967865	FI	On-Demand	Anodyne	P2RX7	41	34
CC(C)(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)on1	ZINC000450967881	GE	On-Demand	Anodyne	PRTN3	51	32
CC(C)(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)on1	ZINC000450967881	GE	On-Demand	Anodyne	LUXN	0	48
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450967882	GG	On-Demand	Anodyne	CTSV	43	30
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450967883	GG	On-Demand	Anodyne	CTSV	43	30
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450967884	GG	On-Demand	Anodyne	CTSV	43	30
CC(C)(C)NS(=O)(=O)c1cccc(NS(=O)(=O)c2cnc(O)s2)c1	ZINC000450967891	GD	On-Demand	Anodyne	UQCRB	0	41
O=C(COc1cccc2c1C(=O)CC2)NCc1cccc(OCC(F)(F)F)c1	ZINC000450967892	GG	On-Demand	Anodyne	PDS	43	38
CCOC(=O)c1cc(C(=O)Nc2cccc(C(C)(F)F)c2)[nH]c1C	ZINC000450967900	EH	On-Demand	Anodyne	NR1H4	0	40
CCOC(=O)c1cc(C(=O)Nc2cccc(C(C)(F)F)c2)[nH]c1C	ZINC000450967900	EH	On-Demand	Anodyne	KCNK3	93	39
CCOC(=O)c1cc(C(=O)Nc2cccc(C(C)(F)F)c2)[nH]c1C	ZINC000450967900	EH	On-Demand	Anodyne	KCNK9	71	39
N#CCc1ccc(S(=O)(=O)Nc2ccc(N3CCCC3)nc2)c(Cl)c1	ZINC000450967934	GG	On-Demand	Mild	PAK1	43	35
COc1cc(CC(=O)N2CCC(N(C)C[C@@H](C)O)CC2)ccc1Cl	ZINC000450967936	FE	On-Demand	Anodyne	OPRK1	31	45
COc1cc(CC(=O)N2CCC(N(C)C[C@@H](C)O)CC2)ccc1Cl	ZINC000450967936	FE	On-Demand	Anodyne	CCR1	33	45
COc1cc(CC(=O)N2CCC(N(C)C[C@@H](C)O)CC2)ccc1Cl	ZINC000450967936	FE	On-Demand	Anodyne	CCR5	20	41
COc1cc(CC(=O)N2CCC(N(C)C[C@H](C)O)CC2)ccc1Cl	ZINC000450967937	FE	On-Demand	Anodyne	OPRK1	31	45
COc1cc(CC(=O)N2CCC(N(C)C[C@H](C)O)CC2)ccc1Cl	ZINC000450967937	FE	On-Demand	Anodyne	CCR1	33	45
COc1cc(CC(=O)N2CCC(N(C)C[C@H](C)O)CC2)ccc1Cl	ZINC000450967937	FE	On-Demand	Anodyne	CCR5	20	41
CC(F)(F)c1cccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450967942	GJ	On-Demand	Anodyne	KIT	19	40
CC(F)(F)c1cccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450967942	GJ	On-Demand	Anodyne	LCK	35	40
CC(F)(F)c1cccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450967942	GJ	On-Demand	Anodyne	KDR	19	40
CC(F)(F)c1cccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450967942	GJ	On-Demand	Anodyne	TYK2	55	35
CC(F)(F)c1cccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450967942	GJ	On-Demand	Anodyne	CSF1R	26	40
CC(F)(F)c1cccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450967942	GJ	On-Demand	Anodyne	BTK	32	40
CC(F)(F)c1cccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450967942	GJ	On-Demand	Anodyne	TAAR1	47	41
CC(F)(F)c1cccc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)c1	ZINC000450967942	GJ	On-Demand	Anodyne	KCNK3	73	36
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(Br)cc3)C2)n1	ZINC000450967943	GH	On-Demand	Anodyne	HTR2A	16	44
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(Br)cc3)C2)n1	ZINC000450967943	GH	On-Demand	Anodyne	CYP2J2	59	43
Cc1noc([C@H]2CCN(CCCC(=O)c3ccc(Br)cc3)C2)n1	ZINC000450967943	GH	On-Demand	Anodyne	ETHR	54	38
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(Br)cc3)C2)n1	ZINC000450967944	GH	On-Demand	Anodyne	HTR2A	16	44
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(Br)cc3)C2)n1	ZINC000450967944	GH	On-Demand	Anodyne	CYP2J2	59	43
Cc1noc([C@@H]2CCN(CCCC(=O)c3ccc(Br)cc3)C2)n1	ZINC000450967944	GH	On-Demand	Anodyne	ETHR	54	38
CC(C)Cn1cc(C(=O)Nc2cccc(C(C)(F)F)c2)c(C(F)F)n1	ZINC000450967955	FJ	On-Demand	Anodyne	KCNK3	61	37
CC(C)Cn1cc(C(=O)Nc2cccc(C(C)(F)F)c2)c(C(F)F)n1	ZINC000450967955	FJ	On-Demand	Anodyne	KCNK9	56	37
Cc1nc(C)n(CCCC(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450967967	DG	On-Demand	Anodyne	HDAC6	29	47
Cc1nc(C)n(CCCC(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450967967	DG	On-Demand	Anodyne	PANK1	0	41
Cc1nc(C)n(CCCC(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450967967	DG	On-Demand	Anodyne	PANK3	0	41
COc1ccc(CNC(=O)CCN2CC[C@H]3[C@@H](C2)NC(=O)N3C)c(OC)c1	ZINC000450967975	GC	On-Demand	Anodyne	HTR7	26	40
CC(C)n1nc2c(c1NC(=O)c1ccc(N3CCC3)nc1)CCC2	ZINC000450967977	EF	On-Demand	Anodyne	PRNP	30	40
CC(C)n1nc2c(c1NC(=O)c1ccc(N3CCC3)nc1)CCC2	ZINC000450967977	EF	On-Demand	Anodyne	HDAC1	28	41
O=S(=O)(Nc1ccccc1N1CCCC1)c1ccc(C2CC2)cc1	ZINC000450967983	EH	On-Demand	Anodyne	KCNQ2	78	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450967986	ED	On-Demand	Anodyne	MME	35	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450967986	ED	On-Demand	Anodyne	REN	29	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450967988	ED	On-Demand	Anodyne	MME	35	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450967988	ED	On-Demand	Anodyne	REN	29	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450967989	ED	On-Demand	Anodyne	MME	35	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450967989	ED	On-Demand	Anodyne	REN	29	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450967991	ED	On-Demand	Anodyne	MME	35	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450967991	ED	On-Demand	Anodyne	REN	29	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(CC(C)(C)O)C[C@H]1C	ZINC000450967995	FF	On-Demand	Anodyne	LIPG	49	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(CC(C)(C)O)C[C@@H]1C	ZINC000450967996	FF	On-Demand	Anodyne	LIPG	49	34
CCOC(=O)c1[nH]c(C)c(-c2csc(COCc3ccccc3)n2)c1C	ZINC000450968001	FJ	On-Demand	Anodyne	HISB	0	42
CC(C)c1ncsc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968006	EG	On-Demand	Anodyne	HTR4	45	41
CC(C)c1ncsc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968006	EG	On-Demand	Anodyne	CACNA1I	61	42
CC(C)c1ncsc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968006	EG	On-Demand	Anodyne	HPGDS	34	41
O=C1CCc2cccc(OCC(=O)N3CCN(c4ccccc4F)CC3)c21	ZINC000450968021	FF	On-Demand	Anodyne	HTR1A	23	42
O=C1CCc2cccc(OCC(=O)N3CCN(c4ccccc4F)CC3)c21	ZINC000450968021	FF	On-Demand	Anodyne	HTR1B	15	42
O=S(=O)(Cc1ccc(C(F)F)cc1)Nc1ccc(N2CCOCC2)cn1	ZINC000450968024	GF	On-Demand	Anodyne	STAT6	53	33
CC1CCN(CCCNS(=O)(=O)c2sccc2Cl)CC1	ZINC000450968050	EF	On-Demand	Anodyne	CCR1	18	44
CC1CCN(CCCNS(=O)(=O)c2sccc2Cl)CC1	ZINC000450968050	EF	On-Demand	Anodyne	EBP	19	42
C/C=C/COc1cccc(CC(=O)N2CCC(N(C)C[C@H](C)O)CC2)c1	ZINC000450968053	FE	On-Demand	Anodyne	BRS3	26	41
C/C=C\COc1cccc(CC(=O)N2CCC(N(C)C[C@H](C)O)CC2)c1	ZINC000450968054	FE	On-Demand	Anodyne	BRS3	26	41
C/C=C/COc1cccc(CC(=O)N2CCC(N(C)C[C@@H](C)O)CC2)c1	ZINC000450968056	FE	On-Demand	Anodyne	BRS3	26	41
C/C=C\COc1cccc(CC(=O)N2CCC(N(C)C[C@@H](C)O)CC2)c1	ZINC000450968058	FE	On-Demand	Anodyne	BRS3	26	41
CC1CCN(c2nc3ccccc3nc2N2CC[C@H](CCCO)C2)CC1	ZINC000450968059	FG	On-Demand	Anodyne	PDE1B	0	44
CC1CCN(c2nc3ccccc3nc2N2CC[C@@H](CCCO)C2)CC1	ZINC000450968061	FG	On-Demand	Anodyne	PDE1B	0	44
Cc1cc(C)c(S(=O)(=O)Nc2ccc(N3CCOCC3)nc2)s1	ZINC000450968075	FE	On-Demand	Anodyne	DGAT1	19	44
Cc1nn(C)cc1CC(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450968084	EF	On-Demand	Anodyne	P2RX7	55	42
CCCCNS(=O)(=O)c1cnccc1C	ZINC000450968090	BD	On-Demand	Anodyne	Q95J97_RABIT	0	43
c1ccc(CN2CCO[C@H](c3nc(CC[C@@H]4CCCCO4)cs3)C2)cc1	ZINC000450968092	FI	On-Demand	Anodyne	DRD4	18	51
c1ccc(CN2CCO[C@H](c3nc(CC[C@H]4CCCCO4)cs3)C2)cc1	ZINC000450968095	FI	On-Demand	Anodyne	DRD4	18	51
c1ccc(CN2CCO[C@@H](c3nc(CC[C@@H]4CCCCO4)cs3)C2)cc1	ZINC000450968096	FI	On-Demand	Anodyne	DRD4	18	51
c1ccc(CN2CCO[C@@H](c3nc(CC[C@H]4CCCCO4)cs3)C2)cc1	ZINC000450968101	FI	On-Demand	Anodyne	DRD4	18	51
C[C@@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccc(Cl)cc1	ZINC000450968106	EH	On-Demand	Anodyne	PTGER4	24	40
C[C@H](NC(=O)COc1cccc2c1C(=O)CC2)c1ccc(Cl)cc1	ZINC000450968109	EH	On-Demand	Anodyne	PTGER4	24	40
CC(F)(F)c1cccc(NC(=O)[C@H]2CC23CCSCC3)c1	ZINC000450968125	DI	On-Demand	Anodyne	SRD5A1	17	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccnn2C)cc1	ZINC000450968126	FD	On-Demand	Anodyne	SCN9A	0	45
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccnn2C)cc1	ZINC000450968126	FD	On-Demand	Anodyne	MTNN	43	37
O=C(CSC1CC1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968130	DE	On-Demand	Anodyne	CACNA1I	57	38
CC(F)(F)c1cccc(NC(=O)[C@@H]2CC23CCSCC3)c1	ZINC000450968132	DI	On-Demand	Anodyne	SRD5A1	17	40
CC(F)(F)c1cccc(NC(=O)[C@@H]2CC23CCSCC3)c1	ZINC000450968132	DI	On-Demand	Anodyne	SRD5A2	20	40
CC(F)(F)c1cccc(NC(=O)[C@@H]2CC23CCSCC3)c1	ZINC000450968132	DI	On-Demand	Anodyne	EPHX2	15	46
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450968134	GG	On-Demand	Anodyne	CTSV	43	30
N#C[C@@]1(NC(=O)c2cc3ccc(Br)cc3s2)CCOC1	ZINC000450968148	FG	On-Demand	Mild	TSPO	0	42
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450968149	FF	On-Demand	Anodyne	PDE8B	17	40
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450968149	FF	On-Demand	Anodyne	CACNA1I	55	36
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450968149	FF	On-Demand	Anodyne	LIPG	46	34
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450968149	FF	On-Demand	Anodyne	HPGDS	31	40
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450968154	FF	On-Demand	Anodyne	PDE8B	17	40
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450968154	FF	On-Demand	Anodyne	CACNA1I	55	36
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450968154	FF	On-Demand	Anodyne	LIPG	46	34
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450968154	FF	On-Demand	Anodyne	HPGDS	31	40
c1cc2c(cc1-c1nc(CC[C@@H]3CCCCO3)cs1)OCO2	ZINC000450968156	DI	On-Demand	Anodyne	DYRK1A	39	47
c1cc2c(cc1-c1nc(CC[C@@H]3CCCCO3)cs1)OCO2	ZINC000450968156	DI	On-Demand	Anodyne	TGFBR1	25	42
c1cc2c(cc1-c1nc(CC[C@@H]3CCCCO3)cs1)OCO2	ZINC000450968156	DI	On-Demand	Anodyne	CLK1	32	47
c1cc2c(cc1-c1nc(CC[C@@H]3CCCCO3)cs1)OCO2	ZINC000450968156	DI	On-Demand	Anodyne	CLK2	42	37
c1cc2c(cc1-c1nc(CC[C@@H]3CCCCO3)cs1)OCO2	ZINC000450968156	DI	On-Demand	Anodyne	CLK4	58	47
c1cc2c(cc1-c1nc(CC[C@@H]3CCCCO3)cs1)OCO2	ZINC000450968156	DI	On-Demand	Anodyne	DYRK1B	32	47
c1cc2c(cc1-c1nc(CC[C@H]3CCCCO3)cs1)OCO2	ZINC000450968158	DI	On-Demand	Anodyne	DYRK1A	39	47
c1cc2c(cc1-c1nc(CC[C@H]3CCCCO3)cs1)OCO2	ZINC000450968158	DI	On-Demand	Anodyne	TGFBR1	25	42
c1cc2c(cc1-c1nc(CC[C@H]3CCCCO3)cs1)OCO2	ZINC000450968158	DI	On-Demand	Anodyne	CLK1	32	47
c1cc2c(cc1-c1nc(CC[C@H]3CCCCO3)cs1)OCO2	ZINC000450968158	DI	On-Demand	Anodyne	CLK2	42	37
c1cc2c(cc1-c1nc(CC[C@H]3CCCCO3)cs1)OCO2	ZINC000450968158	DI	On-Demand	Anodyne	CLK4	58	47
c1cc2c(cc1-c1nc(CC[C@H]3CCCCO3)cs1)OCO2	ZINC000450968158	DI	On-Demand	Anodyne	DYRK1B	32	47
N#C[C@]1(NC(=O)c2cc3ccc(Br)cc3s2)CCOC1	ZINC000450968159	FG	On-Demand	Mild	TSPO	0	42
O=C(Cc1ccc(O)c(F)c1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968160	EE	On-Demand	Anodyne	CACNA1I	71	48
COc1cc(NC(=O)[C@@H]2CCCCC2(F)F)ccc1F	ZINC000450968164	CH	On-Demand	Anodyne	QRFPR	41	37
CCC[C@H](CC(C)C)C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	ZINC000450968168	FH	On-Demand	Anodyne	NPY2R	40	35
CCC[C@@H](CC(C)C)C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	ZINC000450968170	FH	On-Demand	Anodyne	NPY2R	40	35
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450968172	FE	On-Demand	Mild	CCR3	25	44
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450968172	FE	On-Demand	Mild	FAAH	20	42
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450968172	FE	On-Demand	Mild	KCNK3	45	32
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450968172	FE	On-Demand	Mild	KCNK9	51	32
CSc1cccc(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450968174	GH	On-Demand	Anodyne	P2RY12	27	48
CSc1cccc(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)c1	ZINC000450968174	GH	On-Demand	Anodyne	SLC6A7	0	42
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450968175	EF	On-Demand	Anodyne	CACNA1I	44	36
COc1cc(NC(=O)[C@H]2CCCCC2(F)F)ccc1F	ZINC000450968177	CH	On-Demand	Anodyne	QRFPR	41	37
CCc1cccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)n1	ZINC000450968181	EF	On-Demand	Anodyne	CACNA1I	71	43
CCc1cccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)n1	ZINC000450968181	EF	On-Demand	Anodyne	HPGDS	36	46
CC(=O)CCCCCS(=O)(=O)c1ccc(Br)cc1	ZINC000450968190	EG	On-Demand	Anodyne	THRB	24	45
CC(=O)CCCCCS(=O)(=O)c1ccc(Br)cc1	ZINC000450968190	EG	On-Demand	Anodyne	LIG1	0	42
O=C(CCCN1C[C@H](F)C[C@H]1C(=O)N1CCOCC1)c1ccc(F)cc1	ZINC000450968191	FE	On-Demand	Anodyne	CYP2J2	45	31
COC(=O)c1ccc(-c2csc(-c3ccc(N4CCCC4)nc3)n2)o1	ZINC000450968223	FH	On-Demand	Anodyne	COLA	0	41
CCO[C@H]1C[C@@H](NCC(=O)NCC(=O)Nc2ccccc2CC)C12CCCC2	ZINC000450968229	GF	On-Demand	Anodyne	TIMP3	56	31
CCO[C@H]1C[C@H](NCC(=O)NCC(=O)Nc2ccccc2CC)C12CCCC2	ZINC000450968230	GF	On-Demand	Anodyne	TIMP3	56	31
CCO[C@@H]1C[C@H](NCC(=O)NCC(=O)Nc2ccccc2CC)C12CCCC2	ZINC000450968231	GF	On-Demand	Anodyne	TIMP3	56	31
CCO[C@@H]1C[C@@H](NCC(=O)NCC(=O)Nc2ccccc2CC)C12CCCC2	ZINC000450968232	GF	On-Demand	Anodyne	TIMP3	56	31
Cc1cc2c(N3CCN(C(=O)c4cncc(Cl)c4)CC3)ncnc2s1	ZINC000450968235	FG	On-Demand	Anodyne	P2RY12	28	43
CC(C)c1csc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450968246	GF	On-Demand	Anodyne	LUXN	0	42
CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccc(C#N)n3C)c2)CC1	ZINC000450968249	FD	On-Demand	Mild	HTR1D	24	40
CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccc(C#N)n3C)c2)CC1	ZINC000450968249	FD	On-Demand	Mild	CCR3	24	46
Cc1csc(S(=O)(=O)N2CCN(c3ccccc3F)CC2)c1	ZINC000450968255	EF	On-Demand	Anodyne	PKM	34	41
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3cc(C)ccc3F)c2)CC1	ZINC000450968260	GF	On-Demand	Anodyne	DRD4	23	44
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3cc(C)ccc3F)c2)CC1	ZINC000450968260	GF	On-Demand	Anodyne	HTR1D	24	41
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3cc(C)ccc3F)c2)CC1	ZINC000450968260	GF	On-Demand	Anodyne	SIGMAR1	21	44
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3cc(C)ccc3F)c2)CC1	ZINC000450968260	GF	On-Demand	Anodyne	FAAH	28	49
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3cc(C)ccc3F)c2)CC1	ZINC000450968260	GF	On-Demand	Anodyne	MCHR1	34	46
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3cc(C)ccc3F)c2)CC1	ZINC000450968260	GF	On-Demand	Anodyne	MGLL	0	40
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3cc(C)ccc3F)c2)CC1	ZINC000450968260	GF	On-Demand	Anodyne	ABHD6	0	40
O=S(=O)(NCCCn1ccnc1)C1CCC(C(F)(F)F)CC1	ZINC000450968264	EE	On-Demand	Anodyne	TBXAS1	27	40
COC(=O)c1ccc(CN2C[C@@H](OC)C[C@H]2CN2CCCC2)cc1Cl	ZINC000450968266	FF	On-Demand	Anodyne	OPRK1	50	49
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(C)c2C)CC1	ZINC000450968282	GD	On-Demand	Anodyne	HTR2A	22	41
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(C)c2C)CC1	ZINC000450968282	GD	On-Demand	Anodyne	HTR2C	26	41
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(C)c2C)CC1	ZINC000450968282	GD	On-Demand	Anodyne	TGM2	20	43
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(C)c2C)CC1	ZINC000450968282	GD	On-Demand	Anodyne	F13A1	24	43
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C3CC3)cc2)C1	ZINC000450968284	EF	On-Demand	Anodyne	AKR1C3	29	45
O=C(CCCc1ccccc1)N[C@@H]1CCCN(CCc2cscn2)C1	ZINC000450968286	FG	On-Demand	Anodyne	SLC6A1	81	34
O=C(CCCc1ccccc1)N[C@@H]1CCCN(CCc2cscn2)C1	ZINC000450968286	FG	On-Demand	Anodyne	SIGMAR1	25	42
O=C(CCCc1ccccc1)N[C@@H]1CCCN(CCc2cscn2)C1	ZINC000450968286	FG	On-Demand	Anodyne	PREP	58	46
O=C(CCCc1ccccc1)N[C@@H]1CCCN(CCc2cscn2)C1	ZINC000450968286	FG	On-Demand	Anodyne	BIRC2	54	44
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C3CC3)cc2)C1	ZINC000450968287	EF	On-Demand	Anodyne	AKR1C3	29	45
O=C(CCCc1ccccc1)N[C@H]1CCCN(CCc2cscn2)C1	ZINC000450968288	FG	On-Demand	Anodyne	SLC6A1	81	34
O=C(CCCc1ccccc1)N[C@H]1CCCN(CCc2cscn2)C1	ZINC000450968288	FG	On-Demand	Anodyne	SIGMAR1	25	42
O=C(CCCc1ccccc1)N[C@H]1CCCN(CCc2cscn2)C1	ZINC000450968288	FG	On-Demand	Anodyne	PREP	58	46
O=C(CCCc1ccccc1)N[C@H]1CCCN(CCc2cscn2)C1	ZINC000450968288	FG	On-Demand	Anodyne	BIRC2	54	44
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	DRD2	27	42
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	DRD4	44	43
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	ACHE	44	46
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	DRD3	28	41
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	KCNH2	15	49
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	HTR7	27	41
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	SIGMAR1	61	50
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	SSTR5	62	39
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	NPY2R	27	40
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	BCHE	16	42
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	CCR3	44	63
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	HTR6	20	41
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	MCHR1	32	49
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	CACNA1G	25	42
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	SFRP1	92	37
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cc2cc(F)ccc2o1	ZINC000450968291	GH	On-Demand	Anodyne	WNT3	56	35
Cc1csc(S(=O)(=O)NC2CCCCCC2)c1	ZINC000450968294	CG	On-Demand	Anodyne	BRD4	28	44
COC(=O)COc1ccc(CN(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450968300	GF	On-Demand	Anodyne	LTA4H	31	40
COC(=O)COc1ccc(CN(C)C(=O)[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000450968300	GF	On-Demand	Anodyne	COLA	30	49
COC(=O)COc1ccc(CN(C)C(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450968301	GF	On-Demand	Anodyne	LTA4H	31	40
COC(=O)COc1ccc(CN(C)C(=O)[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000450968301	GF	On-Demand	Anodyne	COLA	30	49
COc1cc(Cl)c(C)cc1NS(=O)(=O)c1cn(C)nc1C(F)(F)F	ZINC000450968305	GG	On-Demand	Anodyne	CCR4	25	44
COc1cc(Cl)c(C)cc1NS(=O)(=O)c1cn(C)nc1C(F)(F)F	ZINC000450968305	GG	On-Demand	Anodyne	GHSR	0	40
CCOC(=O)c1cc(S(=O)(=O)Nc2cc(C)on2)cnc1C(F)F	ZINC000450968311	FE	On-Demand	Anodyne	PPIA	18	40
C=CCC1(C(=O)NCC2CCN(CC(F)(F)F)CC2)CCCC1	ZINC000450968315	EH	On-Demand	Mild	CACNA1I	42	39
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	PRTN3	54	34
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	CCR2	19	40
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	PTGDR2	31	45
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	FFAR4	26	40
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	GPR119	0	41
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	TRAR	29	42
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	LUXN	0	44
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	ADIPOR1	0	40
Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450968316	GG	On-Demand	Anodyne	ADIPOR2	0	40
CCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450968327	FF	On-Demand	Anodyne	GPR119	22	43
CCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450968327	FF	On-Demand	Anodyne	LUXN	0	47
CCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450968327	FF	On-Demand	Anodyne	ADIPOR1	0	45
CCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450968327	FF	On-Demand	Anodyne	ADIPOR2	0	45
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)CN(C)C)cc2)c1	ZINC000450968345	FE	On-Demand	Anodyne	CA1	15	44
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)CN(C)C)cc2)c1	ZINC000450968345	FE	On-Demand	Anodyne	CA4	19	44
CSc1cccc(C)c1NC(=O)c1cnc(C2CC2)nc1	ZINC000450968346	CH	On-Demand	Anodyne	SHH	38	40
Cc1csc(S(=O)(=O)NCCCc2ccccc2)c1	ZINC000450968350	CF	On-Demand	Anodyne	TPSAB1	18	43
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450968353	FG	On-Demand	Anodyne	HTR4	49	35
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450968353	FG	On-Demand	Anodyne	CACNA1I	68	43
COC(=O)c1cccc(-c2nc(CC[C@@H]3CCCCO3)cs2)c1	ZINC000450968356	EI	On-Demand	Anodyne	COLA	19	41
COC(=O)c1cccc(-c2nc(CC[C@@H]3CCCCO3)cs2)c1	ZINC000450968356	EI	On-Demand	Anodyne	CPT1A	19	41
COC(=O)c1cccc(-c2nc(CC[C@@H]3CCCCO3)cs2)c1	ZINC000450968356	EI	On-Demand	Anodyne	ROCK2	17	42
Cc1csc(S(=O)(=O)Nc2c(F)cccc2N2CCCC2)c1	ZINC000450968362	EH	On-Demand	Anodyne	KCNQ2	50	34
CC(=O)N[C@H](C)CCc1ccc(-c2csc(=NC3CCC3)[nH]2)cc1	ZINC000450968370	EH	On-Demand	Anodyne	ACACA	24	43
CC(=O)N[C@@H](C)CCc1ccc(-c2csc(=NC3CCC3)[nH]2)cc1	ZINC000450968371	EH	On-Demand	Anodyne	ACACA	24	43
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000450968388	FF	On-Demand	Anodyne	MMP16	0	41
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C1CC1	ZINC000450968389	FF	On-Demand	Anodyne	MMP16	0	41
CO[C@@H](CS(=O)(=O)N1CCc2cc(C(=O)O)ccc21)c1ccccc1	ZINC000450968392	FE	On-Demand	Anodyne	SRD5A2	41	38
CO[C@@H](CS(=O)(=O)N1CCc2cc(C(=O)O)ccc21)c1ccccc1	ZINC000450968392	FE	On-Demand	Anodyne	CYP11B2	19	42
CO[C@H](CS(=O)(=O)N1CCc2cc(C(=O)O)ccc21)c1ccccc1	ZINC000450968393	FE	On-Demand	Anodyne	SRD5A2	41	38
CO[C@H](CS(=O)(=O)N1CCc2cc(C(=O)O)ccc21)c1ccccc1	ZINC000450968393	FE	On-Demand	Anodyne	CYP11B2	19	42
C[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450968406	DI	On-Demand	Anodyne	RBP4	73	40
C[C@@H]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450968407	DI	On-Demand	Anodyne	RBP4	86	40
C[C@@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450968408	DI	On-Demand	Anodyne	RBP4	73	40
C[C@H]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450968409	DI	On-Demand	Anodyne	RBP4	86	40
Cc1csc(S(=O)(=O)N2CCCc3cc(S(N)(=O)=O)ccc32)c1	ZINC000450968414	FD	On-Demand	Anodyne	CYP11B2	29	45
COc1cc(NC(=O)c2nn3c(c2C)OCCC3)ccc1F	ZINC000450968415	DE	On-Demand	Anodyne	CPT1A	44	39
COc1cc(NC(=O)c2nn3c(c2C)OCCC3)ccc1F	ZINC000450968415	DE	On-Demand	Anodyne	CPT1B	40	36
COC(=O)CCC(=O)CSc1ccc(Br)c(Cl)c1	ZINC000450968418	FH	On-Demand	Anodyne	FAS	41	37
C[C@H]1CN(C(=O)[C@H]2CCCN(C)C2=O)CCN1c1nc2ccccc2o1	ZINC000450968433	FD	On-Demand	Anodyne	HTR3A	0	43
C[C@@H]1CN(C(=O)[C@H]2CCCN(C)C2=O)CCN1c1nc2ccccc2o1	ZINC000450968436	FD	On-Demand	Anodyne	HTR3A	0	43
C[C@H]1CN(C(=O)[C@@H]2CCCN(C)C2=O)CCN1c1nc2ccccc2o1	ZINC000450968437	FD	On-Demand	Anodyne	HTR3A	0	43
C[C@@H]1CN(C(=O)[C@@H]2CCCN(C)C2=O)CCN1c1nc2ccccc2o1	ZINC000450968439	FD	On-Demand	Anodyne	HTR3A	0	43
CCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1OC	ZINC000450968447	FE	On-Demand	Anodyne	GRM4	17	42
CCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1OC	ZINC000450968447	FE	On-Demand	Anodyne	ALPL	32	45
CCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1OC	ZINC000450968447	FE	On-Demand	Anodyne	ENPP1	58	37
COc1cccc(F)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450968470	FG	On-Demand	Anodyne	DRD4	41	33
COc1cccc(F)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450968470	FG	On-Demand	Anodyne	PRKDC	35	40
COc1cccc(F)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450968470	FG	On-Demand	Anodyne	DGAT1	34	41
COc1cccc(F)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450968470	FG	On-Demand	Anodyne	BRPF1	0	45
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	BMP1	93	38
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	MMP13	40	40
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	ADAM17	36	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	ROCK1	30	42
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	MMP16	0	40
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	MTNR1A	35	40
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	MTNR1B	32	40
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	ROCK2	43	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	SQLE	50	35
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	MMP9	29	43
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	MMP12	24	40
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	MMP1	34	43
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cccc(OC)c1	ZINC000450968471	FD	On-Demand	Anodyne	CDC42BPA	0	41
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	CA2	19	43
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	CA1	26	45
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	CA7	16	45
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	BDKRB1	0	43
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	CA4	18	42
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	GRM4	20	42
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	CA14	15	45
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	PRTN3	58	38
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	CA12	16	46
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	LIMK2	28	41
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	MTCA1	17	41
CCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968476	GH	On-Demand	Anodyne	P96878_MYCTU	27	41
C[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450968479	DI	On-Demand	Anodyne	TRPM8	45	44
C[C@H]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450968480	DI	On-Demand	Anodyne	TRPM8	45	44
C[C@@H]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450968482	DI	On-Demand	Anodyne	TRPM8	50	44
C[C@@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450968484	DI	On-Demand	Anodyne	TRPM8	50	44
Cc1cc(N2CCCC2)ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450968489	FI	On-Demand	Anodyne	GHSR	29	45
CC(C)OCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968504	EE	On-Demand	Anodyne	CA1	23	43
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2nnc(C3CC3)s2)C1	ZINC000450968506	GH	On-Demand	Anodyne	SIGMAR1	22	41
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2nnc(C3CC3)s2)C1	ZINC000450968506	GH	On-Demand	Anodyne	PREP	51	37
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2nnc(C3CC3)s2)C1	ZINC000450968506	GH	On-Demand	Anodyne	BIRC2	47	39
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2nnc(C3CC3)s2)C1	ZINC000450968507	GH	On-Demand	Anodyne	SIGMAR1	22	41
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2nnc(C3CC3)s2)C1	ZINC000450968507	GH	On-Demand	Anodyne	PREP	51	37
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2nnc(C3CC3)s2)C1	ZINC000450968507	GH	On-Demand	Anodyne	BIRC2	47	39
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2nc(C)ccc2OC)c1	ZINC000450968508	GG	On-Demand	Anodyne	FFAR4	22	41
COC(=O)c1sccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968509	GF	On-Demand	Anodyne	GRM4	15	40
CCc1cnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450968510	GE	On-Demand	Anodyne	LUXN	0	44
CO[C@H](C)CS(=O)(=O)Nc1nc(-c2ccccc2C(F)(F)F)cs1	ZINC000450968519	GH	On-Demand	Anodyne	MPL	40	36
CO[C@@H](C)CS(=O)(=O)Nc1nc(-c2ccccc2C(F)(F)F)cs1	ZINC000450968520	GH	On-Demand	Anodyne	MPL	40	36
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CC1(CC#N)CC1	ZINC000450968528	ED	On-Demand	Mild	MMP3	48	37
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CC1(CC#N)CC1	ZINC000450968528	ED	On-Demand	Mild	MMP8	22	41
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CC1(CC#N)CC1	ZINC000450968528	ED	On-Demand	Mild	ADAM9	63	35
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CC1(CC#N)CC1	ZINC000450968530	ED	On-Demand	Mild	MMP3	48	37
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CC1(CC#N)CC1	ZINC000450968530	ED	On-Demand	Mild	MMP8	22	41
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CC1(CC#N)CC1	ZINC000450968530	ED	On-Demand	Mild	ADAM9	63	35
CC[C@H](O)CC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450968533	CG	On-Demand	Anodyne	SLC1A1	40	37
CC[C@@H](O)CC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450968534	CG	On-Demand	Anodyne	SLC1A1	40	37
CC(C)NC(=O)Nc1ccc(NS(=O)(=O)CCCCF)cc1	ZINC000450968535	EF	On-Demand	Anodyne	CA1	31	40
CCCOc1ccc(C(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968544	GH	On-Demand	Anodyne	KCNA3	43	37
CCCOc1ccc(C(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968544	GH	On-Demand	Anodyne	HCN1	51	32
CCCOc1ccc(C(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968544	GH	On-Demand	Anodyne	HCN4	49	32
CCCOc1ccc(C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968545	GH	On-Demand	Anodyne	KCNA3	43	37
CCCOc1ccc(C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968545	GH	On-Demand	Anodyne	HCN1	51	32
CCCOc1ccc(C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968545	GH	On-Demand	Anodyne	HCN4	49	32
Cc1csc(S(=O)(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)c1	ZINC000450968549	GH	On-Demand	Anodyne	MAPK14	0	51
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)NCC(C)C)c1	ZINC000450968551	FG	On-Demand	Anodyne	KCNA5	0	44
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)NCC(C)C)c1	ZINC000450968551	FG	On-Demand	Anodyne	PRTN3	48	38
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)NCC(C)C)c1	ZINC000450968551	FG	On-Demand	Anodyne	MTNN	45	33
CC(F)(F)c1cccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450968554	EI	On-Demand	Anodyne	NPY2R	47	40
CC(F)(F)c1cccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450968554	EI	On-Demand	Anodyne	MAPK1	28	40
CC(F)(F)c1cccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450968554	EI	On-Demand	Anodyne	EPHX2	33	52
CC(F)(F)c1cccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450968554	EI	On-Demand	Anodyne	LIPG	48	31
CC(F)(F)c1cccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450968554	EI	On-Demand	Anodyne	RHOA	0	44
CC(F)(F)c1cccc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c1	ZINC000450968554	EI	On-Demand	Anodyne	KCNK3	31	40
CC(F)(F)c1cccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450968555	EI	On-Demand	Anodyne	NPY2R	47	40
CC(F)(F)c1cccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450968555	EI	On-Demand	Anodyne	MAPK1	28	40
CC(F)(F)c1cccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450968555	EI	On-Demand	Anodyne	EPHX2	33	52
CC(F)(F)c1cccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450968555	EI	On-Demand	Anodyne	LIPG	48	31
CC(F)(F)c1cccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450968555	EI	On-Demand	Anodyne	RHOA	0	44
CC(F)(F)c1cccc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c1	ZINC000450968555	EI	On-Demand	Anodyne	KCNK3	31	40
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)NC1CC1)c1ccccc1	ZINC000450968558	FF	On-Demand	Anodyne	KCNA5	0	48
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)NC1CC1)c1ccccc1	ZINC000450968559	FF	On-Demand	Anodyne	KCNA5	0	48
Cc1cc(CN2CCN(S(=O)(=O)c3ccc(CC#N)cc3Cl)CC2)no1	ZINC000450968563	GE	On-Demand	Mild	ADORA2B	44	36
Cc1cc(CN2CCN(S(=O)(=O)c3ccc(CC#N)cc3Cl)CC2)no1	ZINC000450968563	GE	On-Demand	Mild	AURKA	0	42
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450968564	DJ	On-Demand	Anodyne	LCK	28	40
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450968564	DJ	On-Demand	Anodyne	FLT1	15	42
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450968564	DJ	On-Demand	Anodyne	KDR	19	42
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450968564	DJ	On-Demand	Anodyne	MTTP	48	36
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450968564	DJ	On-Demand	Anodyne	SHH	33	45
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450968564	DJ	On-Demand	Anodyne	KCNK3	90	39
Cc1nc(C2CC2)ccc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450968564	DJ	On-Demand	Anodyne	KCNK9	70	35
C[C@@H]1CN(C(=O)c2ccc(C(C)(F)F)nc2)CCN1c1nc2ccccc2o1	ZINC000450968574	GH	On-Demand	Anodyne	SLC6A7	0	43
C[C@H]1CN(C(=O)c2ccc(C(C)(F)F)nc2)CCN1c1nc2ccccc2o1	ZINC000450968576	GH	On-Demand	Anodyne	SLC6A7	0	43
CC(=O)CCCCCOc1cc(C)c([N+](=O)[O-])cc1Cl	ZINC000450968577	CI	On-Demand	Bother	S1PR4	0	43
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)nc1	ZINC000450968578	GE	On-Demand	Anodyne	ALPL	15	41
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)nc1	ZINC000450968578	GE	On-Demand	Anodyne	MTNN	57	37
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)nc1	ZINC000450968578	GE	On-Demand	Anodyne	FFAR4	30	41
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)nc1	ZINC000450968578	GE	On-Demand	Anodyne	BRD4	0	45
CCOc1ccc(S(=O)(=O)Cc2cn(C)nc2C)cc1	ZINC000450968589	CE	On-Demand	Anodyne	CACNA2D1	42	36
Cc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)n1	ZINC000450968596	GE	On-Demand	Anodyne	MTNN	83	38
CCOCCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450968615	DF	On-Demand	Anodyne	NPY1R	0	43
COC(=O)c1ccc(Cn2c(C)nn(C(C)C)c2=O)cc1Cl	ZINC000450968618	DE	On-Demand	Anodyne	PROKR1	63	38
COC(=O)c1cccc(-c2nc(CC[C@H]3CCCCO3)cs2)c1	ZINC000450968621	EI	On-Demand	Anodyne	COLA	19	41
COC(=O)c1cccc(-c2nc(CC[C@H]3CCCCO3)cs2)c1	ZINC000450968621	EI	On-Demand	Anodyne	CPT1A	19	41
COC(=O)c1cccc(-c2nc(CC[C@H]3CCCCO3)cs2)c1	ZINC000450968621	EI	On-Demand	Anodyne	ROCK2	17	42
CC(C)(C)c1csc(NS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)n1	ZINC000450968622	GF	On-Demand	Anodyne	CCR4	0	44
COc1cc(CC(=O)N2CCN(CC(C)(C)O)C[C@H]2C)ccc1Cl	ZINC000450968625	FE	On-Demand	Anodyne	OPRK1	23	43
COc1cc(CC(=O)N2CCN(CC(C)(C)O)C[C@H]2C)ccc1Cl	ZINC000450968625	FE	On-Demand	Anodyne	CCR1	41	43
COc1cc(CC(=O)N2CCN(CC(C)(C)O)C[C@@H]2C)ccc1Cl	ZINC000450968626	FE	On-Demand	Anodyne	OPRK1	23	43
COc1cc(CC(=O)N2CCN(CC(C)(C)O)C[C@@H]2C)ccc1Cl	ZINC000450968626	FE	On-Demand	Anodyne	CCR1	41	43
O=C(CC1CC(F)(F)C1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968630	EF	On-Demand	Anodyne	CACNA1I	56	39
O=S(=O)(C[C@H]1CCCCC1(F)F)NCc1cccnc1	ZINC000450968632	DE	On-Demand	Anodyne	NAMPT	35	42
O=S(=O)(C[C@@H]1CCCCC1(F)F)NCc1cccnc1	ZINC000450968633	DE	On-Demand	Anodyne	NAMPT	35	42
OCCC[C@@H]1CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450968649	CF	On-Demand	Anodyne	MLYCD	62	42
OCCC[C@H]1CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000450968651	CF	On-Demand	Anodyne	MLYCD	62	42
Cc1csc2c(N3CC[C@@H](CCCO)C3)ncnc12	ZINC000450968665	CF	On-Demand	Anodyne	SIRT3	51	33
Cc1csc2c(N3CC[C@@H](CCCO)C3)ncnc12	ZINC000450968665	CF	On-Demand	Anodyne	SIRT2	52	33
Cc1csc2c(N3CC[C@H](CCCO)C3)ncnc12	ZINC000450968667	CF	On-Demand	Anodyne	SIRT3	51	33
Cc1csc2c(N3CC[C@H](CCCO)C3)ncnc12	ZINC000450968667	CF	On-Demand	Anodyne	SIRT2	52	33
O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968668	DF	On-Demand	Anodyne	CACNA1I	47	35
O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968670	DF	On-Demand	Anodyne	CACNA1I	47	35
O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968672	DF	On-Demand	Anodyne	CACNA1I	47	35
O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968674	DF	On-Demand	Anodyne	CACNA1I	47	35
CC[C@@H](NC(=O)c1ccccc1)c1nc2c(s1)CCCC2	ZINC000450968679	DH	On-Demand	Anodyne	TACR3	52	37
CC[C@H](NC(=O)c1ccccc1)c1nc2c(s1)CCCC2	ZINC000450968681	DH	On-Demand	Anodyne	TACR3	52	37
COC(=O)c1ccc(-c2csc([C@H]3CN(Cc4ccccc4)CCO3)n2)o1	ZINC000450968682	GH	On-Demand	Anodyne	DRD4	35	43
COC(=O)c1ccc(-c2csc([C@H]3CN(Cc4ccccc4)CCO3)n2)o1	ZINC000450968682	GH	On-Demand	Anodyne	DRD3	0	43
COC(=O)c1ccc(-c2csc([C@@H]3CN(Cc4ccccc4)CCO3)n2)o1	ZINC000450968683	GH	On-Demand	Anodyne	DRD4	35	43
COC(=O)c1ccc(-c2csc([C@@H]3CN(Cc4ccccc4)CCO3)n2)o1	ZINC000450968683	GH	On-Demand	Anodyne	DRD3	0	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450968686	FD	On-Demand	Anodyne	CACNA1B	22	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(N(C)C[C@H](C)O)CC1	ZINC000450968686	FD	On-Demand	Anodyne	RHODESAIN	0	42
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450968687	FD	On-Demand	Anodyne	CACNA1B	22	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)N1CCC(N(C)C[C@@H](C)O)CC1	ZINC000450968687	FD	On-Demand	Anodyne	RHODESAIN	0	42
Cc1nnc2c3ccccc3c(N3CC[C@@H](CCCO)C3)nn12	ZINC000450968689	DE	On-Demand	Anodyne	CREBBP	42	33
Cc1nnc2c3ccccc3c(N3CC[C@@H](CCCO)C3)nn12	ZINC000450968689	DE	On-Demand	Anodyne	BRD9	53	33
Cc1nnc2c3ccccc3c(N3CC[C@H](CCCO)C3)nn12	ZINC000450968690	DE	On-Demand	Anodyne	CREBBP	42	33
Cc1nnc2c3ccccc3c(N3CC[C@H](CCCO)C3)nn12	ZINC000450968690	DE	On-Demand	Anodyne	BRD9	53	33
COC(=O)c1ccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)cc1Cl	ZINC000450968695	FG	On-Demand	Anodyne	SSTR5	58	34
COC(=O)c1ccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)cc1Cl	ZINC000450968695	FG	On-Demand	Anodyne	PDK1	47	36
COC(=O)c1ccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)cc1Cl	ZINC000450968695	FG	On-Demand	Anodyne	MCHR1	26	42
COC(=O)c1ccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)cc1Cl	ZINC000450968695	FG	On-Demand	Anodyne	ETHR	46	37
COC(=O)c1ccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)cc1Cl	ZINC000450968696	FG	On-Demand	Anodyne	SSTR5	58	34
COC(=O)c1ccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)cc1Cl	ZINC000450968696	FG	On-Demand	Anodyne	PDK1	47	36
COC(=O)c1ccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)cc1Cl	ZINC000450968696	FG	On-Demand	Anodyne	MCHR1	26	42
COC(=O)c1ccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)cc1Cl	ZINC000450968696	FG	On-Demand	Anodyne	ETHR	46	37
CCOC(=O)c1sc(NS(=O)(=O)c2sccc2F)nc1C	ZINC000450968700	FF	On-Demand	Anodyne	DHODH	29	48
COC(=O)c1sc(NS(=O)(=O)Cc2c(C)cccc2C)nc1C	ZINC000450968713	FF	On-Demand	Anodyne	DHODH	21	40
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCC(Cc2ccccc2)CC1	ZINC000450968717	FH	On-Demand	Anodyne	GRIN2B	52	39
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCC(Cc2ccccc2)CC1	ZINC000450968717	FH	On-Demand	Anodyne	CCR3	27	40
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCC(Cc2ccccc2)CC1	ZINC000450968719	FH	On-Demand	Anodyne	GRIN2B	52	39
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCC(Cc2ccccc2)CC1	ZINC000450968719	FH	On-Demand	Anodyne	CCR3	27	40
Cc1sc(-c2ccc(S(N)(=O)=O)cc2)nc1C1CCCCC1	ZINC000450968728	EH	On-Demand	Anodyne	CA2	20	42
Cc1sc(-c2ccc(S(N)(=O)=O)cc2)nc1C1CCCCC1	ZINC000450968728	EH	On-Demand	Anodyne	CA1	19	42
Cc1sc(-c2ccc(S(N)(=O)=O)cc2)nc1C1CCCCC1	ZINC000450968728	EH	On-Demand	Anodyne	CA12	22	42
Cc1sc(-c2ccc(S(N)(=O)=O)cc2)nc1C1CCCCC1	ZINC000450968728	EH	On-Demand	Anodyne	CA9	26	42
Cc1sc(-c2ccc(S(N)(=O)=O)cc2)nc1C1CCCCC1	ZINC000450968728	EH	On-Demand	Anodyne	ACCASE	0	45
Cc1sc(Cn2ncc3ccccc3c2=O)nc1C1CCCCC1	ZINC000450968730	EI	On-Demand	Anodyne	NPBWR1	49	35
O=S(=O)(c1sccc1Cl)N1CCN(c2ccccc2F)CC1	ZINC000450968747	FG	On-Demand	Anodyne	PKM	26	43
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3ccc(O)c(F)c3)c2)CC1	ZINC000450968750	GE	On-Demand	Anodyne	SIGMAR1	21	44
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3ccc(O)c(F)c3)c2)CC1	ZINC000450968750	GE	On-Demand	Anodyne	CCR3	49	40
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3ccc(O)c(F)c3)c2)CC1	ZINC000450968750	GE	On-Demand	Anodyne	FAAH	26	44
CC(=O)N1CCN(Cc2cccc(NC(=O)Cc3ccc(O)c(F)c3)c2)CC1	ZINC000450968750	GE	On-Demand	Anodyne	MCHR1	23	41
CCCc1cc(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)no1	ZINC000450968754	FF	On-Demand	Anodyne	P2RY12	19	47
CS(=O)(=O)c1cccc(CS(=O)(=O)N[C@@H]2CCCc3ccccc32)c1	ZINC000450968755	GF	On-Demand	Anodyne	HTR6	41	37
CS(=O)(=O)c1cccc(CS(=O)(=O)N[C@H]2CCCc3ccccc32)c1	ZINC000450968756	GF	On-Demand	Anodyne	HTR6	41	37
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCc3ncc(C)o3)c2)CC1	ZINC000450968758	GF	On-Demand	Anodyne	HRH2	45	35
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCc3ncc(C)o3)c2)CC1	ZINC000450968758	GF	On-Demand	Anodyne	HTR1D	25	41
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCc3ncc(C)o3)c2)CC1	ZINC000450968758	GF	On-Demand	Anodyne	FAAH	30	41
Cc1c(NS(=O)(=O)c2ccc(C3CC3)cc2)cccc1[N+](=O)[O-]	ZINC000450968761	EH	On-Demand	Bother	NFKBIA	0	41
COc1ccccc1NC(=O)c1ccc(NS(=O)(=O)CCCCF)cc1	ZINC000450968766	GG	On-Demand	Anodyne	CPT1A	46	32
O=C(COc1ccc(S(=O)(=O)NCc2cccnc2)cc1)NC1CC1	ZINC000450968774	FD	On-Demand	Anodyne	TBXAS1	57	40
O=C(COc1ccc(S(=O)(=O)NCc2cccnc2)cc1)NC1CC1	ZINC000450968774	FD	On-Demand	Anodyne	NPY2R	59	41
O=C(COc1ccc(S(=O)(=O)NCc2cccnc2)cc1)NC1CC1	ZINC000450968774	FD	On-Demand	Anodyne	NAMPT	54	43
O=C(COc1ccc(S(=O)(=O)NCc2cccnc2)cc1)NC1CC1	ZINC000450968774	FD	On-Demand	Anodyne	LUXN	0	42
O=C(COc1ccc(S(=O)(=O)NCc2cccnc2)cc1)NC1CC1	ZINC000450968774	FD	On-Demand	Anodyne	ADIPOR1	0	45
O=C(COc1ccc(S(=O)(=O)NCc2cccnc2)cc1)NC1CC1	ZINC000450968774	FD	On-Demand	Anodyne	ADIPOR2	0	45
Cn1nc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c2c1CCCC2	ZINC000450968776	FE	On-Demand	Anodyne	HTR4	43	39
Cn1nc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c2c1CCCC2	ZINC000450968776	FE	On-Demand	Anodyne	CACNA1I	79	42
CCSc1cccnc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968778	FG	On-Demand	Anodyne	HTR4	59	39
CCSc1cccnc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968778	FG	On-Demand	Anodyne	CACNA1I	61	39
CCSc1cccnc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968778	FG	On-Demand	Anodyne	HPGDS	36	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968779	GF	On-Demand	Anodyne	CACNA1I	61	37
CC(C)(CF)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450968780	CE	On-Demand	Bother	CACNA1D	49	32
COc1ccc(CCNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450968785	GD	On-Demand	Anodyne	BMP1	30	40
COc1ccc(CCNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450968785	GD	On-Demand	Anodyne	MMP13	25	42
COc1ccc(CCNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450968785	GD	On-Demand	Anodyne	MMP12	21	42
COc1ccc(CCNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450968785	GD	On-Demand	Anodyne	PTGDR	24	55
COc1ccc(CCNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450968785	GD	On-Demand	Anodyne	CA9	21	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1	ZINC000450968800	FC	On-Demand	Anodyne	TACR2	29	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1	ZINC000450968800	FC	On-Demand	Anodyne	CAPN1	0	43
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NCC(C)C)c(F)c1	ZINC000450968801	FD	On-Demand	Anodyne	MTNN	50	32
O=S(=O)(C[C@@H]1CCCC1(F)F)NCc1ccc(Cl)cc1Cl	ZINC000450968808	FH	On-Demand	Anodyne	P2RX7	30	41
O=S(=O)(C[C@H]1CCCC1(F)F)NCc1ccc(Cl)cc1Cl	ZINC000450968810	FH	On-Demand	Anodyne	P2RX7	30	41
Cc1[nH]c(C#N)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968818	EE	On-Demand	Mild	HTR4	45	41
Cc1[nH]c(C#N)cc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450968818	EE	On-Demand	Mild	CACNA1I	56	40
CCO[C@@H]1C[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2OC)C12CCCC2	ZINC000450968821	GF	On-Demand	Anodyne	ADRB2	0	40
CCO[C@@H]1C[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2OC)C12CCCC2	ZINC000450968822	GF	On-Demand	Anodyne	ADRB2	0	40
CCO[C@@H]1C[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2OC)C12CCCC2	ZINC000450968823	GF	On-Demand	Anodyne	ADRB2	0	40
CCO[C@@H]1C[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2OC)C12CCCC2	ZINC000450968824	GF	On-Demand	Anodyne	ADRB2	0	40
CCOC(=O)c1ccc(CS(=O)(=O)NC2CCCCCC2)cc1	ZINC000450968835	EG	On-Demand	Anodyne	TMPRSS11D	42	32
CO[C@H](C)CS(=O)(=O)Nc1nc(-c2ccc(NC(C)=O)cc2F)cs1	ZINC000450968836	GF	On-Demand	Anodyne	MPL	38	40
CO[C@@H](C)CS(=O)(=O)Nc1nc(-c2ccc(NC(C)=O)cc2F)cs1	ZINC000450968837	GF	On-Demand	Anodyne	MPL	38	40
CCSc1cccnc1C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	ZINC000450968842	GG	On-Demand	Anodyne	NPY2R	44	35
CCSc1cccnc1C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	ZINC000450968842	GG	On-Demand	Anodyne	PRNP	57	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCC3)cc1	ZINC000450968843	FH	On-Demand	Anodyne	CA4	22	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCC3)cc1	ZINC000450968843	FH	On-Demand	Anodyne	MLNR	26	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCC3)cc1	ZINC000450968843	FH	On-Demand	Anodyne	P96878_MYCTU	23	54
O=S(=O)(CC1CC(F)(F)C1)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450968844	FF	On-Demand	Anodyne	HTR1A	18	45
O=S(=O)(CC1CC(F)(F)C1)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450968844	FF	On-Demand	Anodyne	HTR2A	17	45
CC(=O)N1CCN(Cc2cccc(NC(=O)C(C)(C)OC(C)C)c2)CC1	ZINC000450968851	FE	On-Demand	Anodyne	HTR1A	18	42
CC(=O)N1CCN(Cc2cccc(NC(=O)C(C)(C)OC(C)C)c2)CC1	ZINC000450968851	FE	On-Demand	Anodyne	HTR1D	24	42
CC(=O)N1CCN(Cc2cccc(NC(=O)C(C)(C)OC(C)C)c2)CC1	ZINC000450968851	FE	On-Demand	Anodyne	NPY2R	29	45
CC(=O)N1CCN(Cc2cccc(NC(=O)C(C)(C)OC(C)C)c2)CC1	ZINC000450968851	FE	On-Demand	Anodyne	FAAH	26	47
CC(=O)N1CCN(Cc2cccc(NC(=O)C(C)(C)OC(C)C)c2)CC1	ZINC000450968851	FE	On-Demand	Anodyne	MCHR1	20	44
CCc1ccc([C@H](C)NC(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450968865	EH	On-Demand	Anodyne	ACACA	45	36
CCc1ccc([C@@H](C)NC(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450968866	EH	On-Demand	Anodyne	ACACA	45	36
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	HTR1A	15	41
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	HRH2	50	39
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	HTR1D	27	41
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	SIGMAR1	26	41
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	CCR3	49	43
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	HDAC8	16	40
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	HDAC1	16	46
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	HDAC2	23	40
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	HDAC3	41	39
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	FAAH	22	44
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	EPHX2	16	42
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	MCHR1	39	41
CC(=O)N1CCN(Cc2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450968879	FE	On-Demand	Anodyne	CACNA1G	27	43
COC(=O)c1ncccc1S(=O)(=O)Nc1cc(C(C)(C)C)ccc1O	ZINC000450968880	FF	On-Demand	Anodyne	UQCRB	0	45
CCCOc1ccc(C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968885	GH	On-Demand	Anodyne	KCNA3	43	37
CCCOc1ccc(C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968885	GH	On-Demand	Anodyne	HCN1	51	32
CCCOc1ccc(C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968885	GH	On-Demand	Anodyne	HCN4	49	32
CCCOc1ccc(C(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968886	GH	On-Demand	Anodyne	KCNA3	43	37
CCCOc1ccc(C(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968886	GH	On-Demand	Anodyne	HCN1	51	32
CCCOc1ccc(C(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c(OC)c1	ZINC000450968886	GH	On-Demand	Anodyne	HCN4	49	32
COc1cc2c(cc1OC)CN(S(=O)(=O)CCOCc1ccccc1)CC2	ZINC000450968887	GF	On-Demand	Anodyne	ABCB1B	63	40
COc1cc2c(cc1OC)CN(S(=O)(=O)CCOCc1ccccc1)CC2	ZINC000450968887	GF	On-Demand	Anodyne	MTNR1B	19	41
COc1cc2c(cc1OC)CN(S(=O)(=O)CCOCc1ccccc1)CC2	ZINC000450968887	GF	On-Demand	Anodyne	ABCB1	25	42
COc1cc2c(cc1OC)CN(S(=O)(=O)CCOCc1ccccc1)CC2	ZINC000450968887	GF	On-Demand	Anodyne	HCRTR2	16	46
COc1cc2c(cc1OC)CN(S(=O)(=O)CCOCc1ccccc1)CC2	ZINC000450968887	GF	On-Demand	Anodyne	AKR1C3	40	37
N#Cc1ccc(OCC(=O)N[C@]2(C#N)CCOC2)cc1Br	ZINC000450968894	FD	On-Demand	Mild	TRPV4	40	30
N#Cc1ccc(OCC(=O)N[C@@]2(C#N)CCOC2)cc1Br	ZINC000450968895	FD	On-Demand	Mild	TRPV4	40	30
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	CA2	29	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	CA7	18	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	COLA	65	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	CA5B	35	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	CA5A	40	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	CA14	15	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	MMP2	30	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	CA12	23	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)cc1	ZINC000450968915	GE	On-Demand	Anodyne	CA9	23	51
CC(=O)Nc1ccc(F)c(NS(=O)(=O)CCCCF)c1	ZINC000450968917	DE	On-Demand	Anodyne	IDO1	25	40
COc1cccc(F)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450968924	DF	On-Demand	Anodyne	F10	0	48
COc1cccc(F)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450968924	DF	On-Demand	Anodyne	DGAT1	49	43
COc1ccc(C)nc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968934	FF	On-Demand	Anodyne	CA1	17	41
COc1ccc(C)nc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968934	FF	On-Demand	Anodyne	MMP2	19	41
COc1ccc(C)nc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968934	FF	On-Demand	Anodyne	MMP12	27	40
COc1ccc(C)nc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968934	FF	On-Demand	Anodyne	MMP7	16	40
COc1ccc(C)nc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450968934	FF	On-Demand	Anodyne	LEF	27	41
COc1cc(NC(=O)CCCC(=O)C2CC2)ccc1F	ZINC000450968937	CF	On-Demand	Anodyne	HDAC3	23	43
COc1cc(NC(=O)CCCC(=O)C2CC2)ccc1F	ZINC000450968937	CF	On-Demand	Anodyne	HDAC6	23	44
COc1cc(NC(=O)CCCC(=O)C2CC2)ccc1F	ZINC000450968937	CF	On-Demand	Anodyne	ENPP1	58	33
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(CN(C)C)c1	ZINC000450968945	GG	On-Demand	Anodyne	CA2	19	47
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(CN(C)C)c1	ZINC000450968945	GG	On-Demand	Anodyne	LEF	40	37
COC(=O)c1ncccc1S(=O)(=O)NCC1(N2CCCCC2)CCCCC1	ZINC000450968946	GE	On-Demand	Anodyne	HCN1	60	37
COC(=O)c1ncccc1S(=O)(=O)NCC1(N2CCCCC2)CCCCC1	ZINC000450968946	GE	On-Demand	Anodyne	HCN4	57	37
CCCCO[C@H]1C[C@@H](NCCc2c(C)nc3ccccn3c2=O)C1(C)C	ZINC000450968954	FG	On-Demand	Anodyne	ADRA2A	23	43
CCCCO[C@H]1C[C@@H](NCCc2c(C)nc3ccccn3c2=O)C1(C)C	ZINC000450968954	FG	On-Demand	Anodyne	ADRA2B	28	43
CCCCO[C@@H]1C[C@@H](NCCc2c(C)nc3ccccn3c2=O)C1(C)C	ZINC000450968956	FG	On-Demand	Anodyne	ADRA2A	23	43
CCCCO[C@@H]1C[C@@H](NCCc2c(C)nc3ccccn3c2=O)C1(C)C	ZINC000450968956	FG	On-Demand	Anodyne	ADRA2B	28	43
CCCCO[C@H]1C[C@H](NCCc2c(C)nc3ccccn3c2=O)C1(C)C	ZINC000450968957	FG	On-Demand	Anodyne	ADRA2A	23	43
CCCCO[C@H]1C[C@H](NCCc2c(C)nc3ccccn3c2=O)C1(C)C	ZINC000450968957	FG	On-Demand	Anodyne	ADRA2B	28	43
CCCCO[C@@H]1C[C@H](NCCc2c(C)nc3ccccn3c2=O)C1(C)C	ZINC000450968958	FG	On-Demand	Anodyne	ADRA2A	23	43
CCCCO[C@@H]1C[C@H](NCCc2c(C)nc3ccccn3c2=O)C1(C)C	ZINC000450968958	FG	On-Demand	Anodyne	ADRA2B	28	43
Cc1csc(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)c1	ZINC000450968966	EG	On-Demand	Anodyne	TYK2	49	37
Cc1csc(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)c1	ZINC000450968966	EG	On-Demand	Anodyne	KCNK9	40	35
O=C(c1cccc(NS(=O)(=O)c2sccc2Cl)c1)N1CCCC1	ZINC000450968973	FG	On-Demand	Anodyne	PFK	0	40
O=C(c1cccc(NS(=O)(=O)c2sccc2Cl)c1)N1CCCC1	ZINC000450968973	FG	On-Demand	Anodyne	RHOA	0	43
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	EGFR	21	43
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	MAOB	17	40
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	PDE4D	18	46
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	COLA	72	40
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	CPT1A	68	40
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	CPT2	49	36
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	GRM4	27	49
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	CPT1B	61	35
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	TAAR1	23	44
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	ENPP1	47	36
COc1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)ccc1F	ZINC000450968981	GH	On-Demand	Anodyne	PDEC	0	40
CCCOc1ccc(C(=O)N2CC[C@H](OCCOC)C2)c(OC)c1	ZINC000450968985	EE	On-Demand	Anodyne	OXTR	25	40
CCCOc1ccc(C(=O)N2CC[C@@H](OCCOC)C2)c(OC)c1	ZINC000450968987	EE	On-Demand	Anodyne	OXTR	25	40
COCCO[C@@H]1CCN(C(=O)c2cc(OC)ccc2OC(F)(F)F)C1	ZINC000450968989	FE	On-Demand	Anodyne	LIPG	43	43
COCCO[C@H]1CCN(C(=O)c2cc(OC)ccc2OC(F)(F)F)C1	ZINC000450968991	FE	On-Demand	Anodyne	LIPG	43	43
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(C)c1O	ZINC000450968995	CF	On-Demand	Anodyne	PRNP	51	42
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(C)c1O	ZINC000450968995	CF	On-Demand	Anodyne	HDAC1	22	40
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(C)c1O	ZINC000450968995	CF	On-Demand	Anodyne	FASN	22	46
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(C)c1O	ZINC000450968995	CF	On-Demand	Anodyne	P4HTM	0	45
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)cc(C)c1O	ZINC000450968995	CF	On-Demand	Anodyne	DGAT1	47	39
O=C(NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450968996	EF	On-Demand	Anodyne	CACNA1I	40	33
O=C(NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450968997	EF	On-Demand	Anodyne	CACNA1I	40	33
COc1cccc2c1N(S(=O)(=O)c1cc(C)cs1)CCC2	ZINC000450968998	DG	On-Demand	Anodyne	CYP11B2	22	42
O=C(NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450968999	EF	On-Demand	Anodyne	CACNA1I	40	33
O=C(NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1cncc(Cl)c1	ZINC000450969000	EF	On-Demand	Anodyne	CACNA1I	40	33
O=S(=O)(CCOCc1ccccc1)NCc1cccc(C(F)(F)F)c1	ZINC000450969010	FG	On-Demand	Anodyne	TACR1	23	43
O=S(=O)(CCOCc1ccccc1)NCc1cccc(C(F)(F)F)c1	ZINC000450969010	FG	On-Demand	Anodyne	PHES	0	40
O=S(=O)(CCOCc1ccccc1)NCc1cccc(C(F)(F)F)c1	ZINC000450969010	FG	On-Demand	Anodyne	PDS	36	41
Cc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450969016	EF	On-Demand	Anodyne	CA4	22	41
Cc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450969016	EF	On-Demand	Anodyne	IDO1	32	41
Cc1cncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450969016	EF	On-Demand	Anodyne	PFK	0	46
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@H](C)C1	ZINC000450969019	CF	On-Demand	Anodyne	ACE	60	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@H](C)C1	ZINC000450969019	CF	On-Demand	Anodyne	MME	81	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@H](C)C1	ZINC000450969019	CF	On-Demand	Anodyne	TIMP3	66	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@H](C)C1	ZINC000450969019	CF	On-Demand	Anodyne	CAPNS1	43	30
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@H](C)C1	ZINC000450969019	CF	On-Demand	Anodyne	ACE2	53	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@H](C)C1	ZINC000450969019	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450969020	CF	On-Demand	Anodyne	ACE	60	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450969020	CF	On-Demand	Anodyne	MME	81	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450969020	CF	On-Demand	Anodyne	TIMP3	66	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450969020	CF	On-Demand	Anodyne	CAPNS1	43	30
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450969020	CF	On-Demand	Anodyne	ACE2	53	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450969020	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)C1	ZINC000450969021	CF	On-Demand	Anodyne	ACE	60	36
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)C1	ZINC000450969021	CF	On-Demand	Anodyne	MME	81	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)C1	ZINC000450969021	CF	On-Demand	Anodyne	TIMP3	66	37
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)C1	ZINC000450969021	CF	On-Demand	Anodyne	CAPNS1	43	30
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)C1	ZINC000450969021	CF	On-Demand	Anodyne	ACE2	53	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@H](C)C1	ZINC000450969021	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450969023	CF	On-Demand	Anodyne	ACE	60	36
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450969023	CF	On-Demand	Anodyne	MME	81	35
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450969023	CF	On-Demand	Anodyne	TIMP3	66	37
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450969023	CF	On-Demand	Anodyne	CAPNS1	43	30
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450969023	CF	On-Demand	Anodyne	ACE2	53	34
CO[C@H](Cc1ccccc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450969023	CF	On-Demand	Anodyne	AMP1_PLAFQ	49	34
COc1ccc(CNC(=O)CCN2CCC(F)(C#N)CC2)c(OC)c1	ZINC000450969028	EE	On-Demand	Mild	DRD4	42	32
COc1ccc(CNC(=O)CCN2CCC(F)(C#N)CC2)c(OC)c1	ZINC000450969028	EE	On-Demand	Mild	HTR7	26	41
COc1ccc(CNC(=O)CCN2CCC(F)(C#N)CC2)c(OC)c1	ZINC000450969028	EE	On-Demand	Mild	MTNR1A	44	35
CO[C@H](CS(=O)(=O)Nc1cc(C(C)(C)C)on1)c1ccccc1	ZINC000450969030	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
CO[C@@H](CS(=O)(=O)Nc1cc(C(C)(C)C)on1)c1ccccc1	ZINC000450969031	EG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
CN(CCc1ccccc1[N+](=O)[O-])Cc1ccn(CC(F)(F)F)n1	ZINC000450969032	EG	On-Demand	Bother	COLA	79	37
C[C@H](c1ccc(CN2CCC(F)(C#N)CC2)cc1)C(F)(F)F	ZINC000450969044	DI	On-Demand	Mild	SIGMAR1	23	43
C[C@@H](c1ccc(CN2CCC(F)(C#N)CC2)cc1)C(F)(F)F	ZINC000450969045	DI	On-Demand	Mild	SIGMAR1	21	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)C)on2)cc1	ZINC000450969048	FG	On-Demand	Anodyne	PPIA	31	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)C)on2)cc1	ZINC000450969048	FG	On-Demand	Anodyne	PFK	0	51
CN(C[C@H]1CCCN(CCc2c(Cl)cccc2Cl)C1)S(C)(=O)=O	ZINC000450969049	GG	On-Demand	Anodyne	SLC6A1	41	34
CN(C[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)C1)S(C)(=O)=O	ZINC000450969050	GG	On-Demand	Anodyne	SLC6A1	41	34
COCCO[C@H]1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450969058	GD	On-Demand	Mild	HTR1D	15	41
COCCO[C@H]1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450969058	GD	On-Demand	Mild	HTR1B	17	41
COCCO[C@@H]1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450969060	GD	On-Demand	Mild	HTR1D	15	41
COCCO[C@@H]1CCN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450969060	GD	On-Demand	Mild	HTR1B	17	41
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	CA2	23	48
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	ADRB2	15	48
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	ADRB1	25	48
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	ADRB3	16	48
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	CA1	30	44
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	KCNA5	0	42
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	CA7	16	41
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	MMP13	60	44
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	ADAM17	22	40
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	CA14	16	41
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	MMP2	54	45
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	MMP3	24	43
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	MMP14	24	41
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	MMP9	37	41
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	CA12	27	44
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	MMP7	33	40
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	ADAMTS4	68	41
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	CA9	27	44
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	MMP1	17	44
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	IDO1	31	42
Cc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450969062	GF	On-Demand	Anodyne	P96878_MYCTU	17	44
O=S(=O)(Nc1ccc2nc(N3CCOCC3)sc2c1)c1sccc1F	ZINC000450969063	GG	On-Demand	Anodyne	CASR	15	41
Fc1ccc(OCCCn2cnc3c2CCCC3)cc1	ZINC000450969066	CG	On-Demand	Anodyne	HRH3	55	41
COCc1cccc(NS(=O)(=O)c2cc(OC)cc(C(F)(F)F)c2)c1	ZINC000450969075	GH	On-Demand	Anodyne	UQCRB	0	40
COCCO[C@H]1CCN(C(=O)Cc2cc(C)ccc2F)C1	ZINC000450969086	CD	On-Demand	Anodyne	LIPG	34	42
COCCO[C@@H]1CCN(C(=O)Cc2cc(C)ccc2F)C1	ZINC000450969087	CD	On-Demand	Anodyne	LIPG	34	42
Cc1ccc(Cn2nccc2NS(=O)(=O)c2ccc(C3CC3)cc2)o1	ZINC000450969089	FH	On-Demand	Anodyne	OXTR	0	41
CO[C@H](C)CS(=O)(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000450969090	FG	On-Demand	Anodyne	KCNQ2	39	40
CO[C@H](C)CS(=O)(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000450969090	FG	On-Demand	Anodyne	TEK	19	41
CC[C@H](O)CC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450969091	EE	On-Demand	Anodyne	RBP4	57	34
CC[C@H](O)CC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450969092	EE	On-Demand	Anodyne	RBP4	57	34
CC[C@@H](O)CC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450969093	EE	On-Demand	Anodyne	RBP4	57	34
CC[C@@H](O)CC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450969094	EE	On-Demand	Anodyne	RBP4	57	34
CO[C@@H](C)CS(=O)(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000450969098	FG	On-Demand	Anodyne	KCNQ2	39	40
CO[C@@H](C)CS(=O)(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000450969098	FG	On-Demand	Anodyne	TEK	19	41
COc1cc(CN2CC=C(c3ccnn3C)CC2)ccc1Cl	ZINC000450969105	DG	On-Demand	Anodyne	SSTR5	42	35
Cc1ccncc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450969106	DF	On-Demand	Anodyne	CA14	0	42
CO[C@H](C)CS(=O)(=O)Nc1ccc(NC(=O)CCN(C)C)cc1	ZINC000450969115	ED	On-Demand	Anodyne	LTA4H	22	40
CO[C@@H](C)CS(=O)(=O)Nc1ccc(NC(=O)CCN(C)C)cc1	ZINC000450969116	ED	On-Demand	Anodyne	LTA4H	22	40
CC1CCN(CCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450969117	GF	On-Demand	Anodyne	HTR2A	15	40
CC1CCN(CCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450969117	GF	On-Demand	Anodyne	HTR7	41	42
CC1CCN(CCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450969117	GF	On-Demand	Anodyne	CCR1	15	43
CC1CCN(CCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450969117	GF	On-Demand	Anodyne	CCR3	16	45
CC1CCN(CCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450969117	GF	On-Demand	Anodyne	EPHX2	17	43
CC[C@@H]1C[C@H]1C(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450969119	DH	On-Demand	Anodyne	NQO2	17	40
N#Cc1cccc(OCCCOc2cccc3c2C(=O)CC3)c1	ZINC000450969126	DH	On-Demand	Mild	CHRNA10	15	40
Cc1sccc1C(=O)N1CCN(c2nc3ccccc3o2)[C@H](C)C1	ZINC000450969138	EH	On-Demand	Anodyne	HTR3A	18	45
Cc1sccc1C(=O)N1CCN(c2nc3ccccc3o2)[C@@H](C)C1	ZINC000450969139	EH	On-Demand	Anodyne	HTR3A	18	45
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450969141	CG	On-Demand	Anodyne	CASP3	40	36
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450969141	CG	On-Demand	Anodyne	CASP7	50	36
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450969141	CG	On-Demand	Anodyne	AKR1C3	42	61
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450969142	CG	On-Demand	Anodyne	CASP3	40	36
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450969142	CG	On-Demand	Anodyne	CASP7	50	36
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450969142	CG	On-Demand	Anodyne	AKR1C3	42	61
CO[C@H](C)CS(=O)(=O)Nc1ccc(N2CCOCC2)nc1	ZINC000450969151	DC	On-Demand	Anodyne	DGAT1	21	40
CO[C@@H](C)CS(=O)(=O)Nc1ccc(N2CCOCC2)nc1	ZINC000450969152	DC	On-Demand	Anodyne	DGAT1	21	40
C=C(C)CN(CC)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450969153	ED	On-Demand	Mild	RORC	16	44
C=C(C)CN(CC)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450969153	ED	On-Demand	Mild	RORB	0	44
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCC[C@@H]1O)c1ccccc1	ZINC000450969162	EF	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCC[C@H]1O)c1ccccc1	ZINC000450969163	EF	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCC[C@@H]1O)c1ccccc1	ZINC000450969164	EF	On-Demand	Anodyne	CYP2J2	54	38
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCC[C@H]1O)c1ccccc1	ZINC000450969165	EF	On-Demand	Anodyne	CYP2J2	54	38
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450969173	DH	On-Demand	Mild	CTSK	27	44
CCC[C@@H]1CCC[C@@H]1C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450969178	DH	On-Demand	Mild	CTSK	25	41
CCC[C@@H]1CCC[C@H]1C(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000450969179	DH	On-Demand	Mild	CTSK	27	44
CCC[C@@H]1CCC[C@H]1C(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000450969180	DH	On-Demand	Mild	CTSK	27	44
Cc1noc([C@@H]2CCN(CCc3ccc(Cl)cc3)C2)n1	ZINC000450969182	CG	On-Demand	Anodyne	DRD4	17	51
Cc1noc([C@@H]2CCN(CCc3ccc(Cl)cc3)C2)n1	ZINC000450969182	CG	On-Demand	Anodyne	SIGMAR1	16	41
Cc1ccc2c(c1)CCCN2S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450969192	FH	On-Demand	Mild	CYP11B2	25	40
Cc1noc([C@H]2CCN(CCc3ccc(Cl)cc3)C2)n1	ZINC000450969193	CG	On-Demand	Anodyne	DRD4	17	51
Cc1noc([C@H]2CCN(CCc3ccc(Cl)cc3)C2)n1	ZINC000450969193	CG	On-Demand	Anodyne	SIGMAR1	16	41
COc1cc(CC(=O)NCCc2cn(C)c3cc(Cl)ccc23)ccc1O	ZINC000450969196	FG	On-Demand	Anodyne	NQO2	22	47
COc1cc(CC(=O)NCCc2cn(C)c3cc(Cl)ccc23)ccc1O	ZINC000450969196	FG	On-Demand	Anodyne	TRPV1	34	52
COc1cc(CC(=O)NCCc2cn(C)c3cc(Cl)ccc23)ccc1O	ZINC000450969196	FG	On-Demand	Anodyne	COLA	0	44
COc1cc(CC(=O)NCCc2cn(C)c3cc(Cl)ccc23)ccc1O	ZINC000450969196	FG	On-Demand	Anodyne	CPT1A	45	32
COc1cc(CC(=O)NCCc2cn(C)c3cc(Cl)ccc23)ccc1O	ZINC000450969196	FG	On-Demand	Anodyne	MTNR1A	33	47
COc1cc(CC(=O)NCCc2cn(C)c3cc(Cl)ccc23)ccc1O	ZINC000450969196	FG	On-Demand	Anodyne	NCE103	33	53
COc1cc(CC(=O)NCCc2cn(C)c3cc(Cl)ccc23)ccc1O	ZINC000450969196	FG	On-Demand	Anodyne	P96878_MYCTU	21	53
COc1cc(CC(=O)NCCc2cn(C)c3cc(Cl)ccc23)ccc1O	ZINC000450969196	FG	On-Demand	Anodyne	CAN2	0	53
COc1cc(CN2CC[C@@H](c3nc(C)no3)C2)ccc1Cl	ZINC000450969212	DG	On-Demand	Anodyne	DRD4	26	41
COc1cc(CN2CC[C@@H](c3nc(C)no3)C2)ccc1Cl	ZINC000450969212	DG	On-Demand	Anodyne	SSTR5	69	44
COc1cc(CN2CC[C@H](c3nc(C)no3)C2)ccc1Cl	ZINC000450969213	DG	On-Demand	Anodyne	DRD4	26	41
COc1cc(CN2CC[C@H](c3nc(C)no3)C2)ccc1Cl	ZINC000450969213	DG	On-Demand	Anodyne	SSTR5	69	44
CCCOc1ccc(C(=O)N2CCC(N(C)C[C@H](C)O)CC2)c(OC)c1	ZINC000450969229	FE	On-Demand	Anodyne	OXTR	27	42
CCCOc1ccc(C(=O)N2CCC(N(C)C[C@@H](C)O)CC2)c(OC)c1	ZINC000450969230	FE	On-Demand	Anodyne	OXTR	27	42
C=CCN(CC=C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450969234	FD	On-Demand	Mild	TRAR	33	40
C=CCN(CC=C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450969234	FD	On-Demand	Mild	LUXN	0	45
C=CCN(CC=C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450969234	FD	On-Demand	Mild	ADIPOR1	0	43
C=CCN(CC=C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450969234	FD	On-Demand	Mild	ADIPOR2	0	43
CC(F)(F)C(C)(C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450969256	EG	On-Demand	Anodyne	CACNA1I	41	38
CC[C@@H](c1ccc(Cl)cc1Cl)N1C[C@H](c2cnn(C)c2)[C@@H](C(=O)NC)C1	ZINC000450969260	GH	On-Demand	Anodyne	SLC6A1	22	42
CC[C@H](c1ccc(Cl)cc1Cl)N1C[C@H](c2cnn(C)c2)[C@@H](C(=O)NC)C1	ZINC000450969261	GH	On-Demand	Anodyne	SLC6A1	22	42
COc1cc(CC(=O)Nc2c3c(nn2C(C)C)CCC3)ccc1O	ZINC000450969287	EF	On-Demand	Anodyne	TRPV1	0	42
CCOC(=O)C1CCN(S(=O)(=O)c2cc(OC)cc(C(F)(F)F)c2)CC1	ZINC000450969304	GF	On-Demand	Anodyne	EPHX2	27	40
CC(C)(C)OC(=O)CCCn1nnc(-c2ccco2)n1	ZINC000450969307	CE	On-Demand	Anodyne	ADORA1	28	41
CC(C)(C)OC(=O)CCCn1nnc(-c2ccco2)n1	ZINC000450969307	CE	On-Demand	Anodyne	ADORA3	28	41
Cc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450969311	FF	On-Demand	Anodyne	LUXN	0	55
Cc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450969311	FF	On-Demand	Anodyne	ADIPOR1	0	44
Cc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450969311	FF	On-Demand	Anodyne	ADIPOR2	0	44
CNS(=O)(=O)c1ccc(N2CC[C@@H](CCCO)C2)c(F)c1	ZINC000450969314	DD	On-Demand	Anodyne	SLC6A9	0	41
CNS(=O)(=O)c1ccc(N2CC[C@H](CCCO)C2)c(F)c1	ZINC000450969320	DD	On-Demand	Anodyne	SLC6A9	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(OC(F)F)C1	ZINC000450969321	DG	On-Demand	Anodyne	CACNA1B	43	36
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(OC(F)F)C1	ZINC000450969321	DG	On-Demand	Anodyne	LIPG	54	35
CCOc1ccc(S(=O)(=O)C[C@H](Cc2ccccc2)OC)cc1	ZINC000450969329	EG	On-Demand	Anodyne	MMP9	16	40
CCOc1ccc(S(=O)(=O)C[C@@H](Cc2ccccc2)OC)cc1	ZINC000450969331	EG	On-Demand	Anodyne	MMP9	16	40
CCCN(CCC)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450969335	EE	On-Demand	Anodyne	RORB	0	46
c1ccn2c(-c3nc4c(s3)CCCC4)cnc2c1	ZINC000450969337	CG	On-Demand	Anodyne	IRAK4	28	42
CCCCNC(=O)NC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450969339	CC	On-Demand	Anodyne	ADORA1	32	46
CCCCNC(=O)NC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450969339	CC	On-Demand	Anodyne	ADORA2A	22	40
CCCCNC(=O)NC(=O)Cn1nnc(-c2ccco2)n1	ZINC000450969339	CC	On-Demand	Anodyne	ADORA3	42	44
Cn1nc(-c2ccccc2)cc1C(=O)NC(C)(C)CF	ZINC000450969351	CF	On-Demand	Anodyne	CTSV	48	33
Cc1nc(C)n(CCCC(=O)NCC2CCN(CC(F)(F)F)CC2)n1	ZINC000450969352	FE	On-Demand	Anodyne	CACNA1I	55	37
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450969360	CE	On-Demand	Anodyne	SDH1	0	40
C[C@@H](OCCc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450969360	CE	On-Demand	Anodyne	POL	0	41
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450969362	CE	On-Demand	Anodyne	SDH1	0	40
C[C@H](OCCc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450969362	CE	On-Demand	Anodyne	POL	0	41
COC(=O)c1ncccc1S(=O)(=O)Nc1cc(OC)c(OC)cc1C	ZINC000450969364	FD	On-Demand	Anodyne	ALPL	26	42
COC(=O)c1ncccc1S(=O)(=O)Nc1cc(OC)c(OC)cc1C	ZINC000450969364	FD	On-Demand	Anodyne	NFKBIA	0	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450969389	FF	On-Demand	Anodyne	PAM	0	42
CCO[C@H]1C[C@@H](NCC(=O)Nc2ccccc2N2CCCC2=O)C12CCCC2	ZINC000450969390	GG	On-Demand	Anodyne	KCNQ2	50	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450969391	FF	On-Demand	Anodyne	PAM	0	42
CCO[C@H]1C[C@H](NCC(=O)Nc2ccccc2N2CCCC2=O)C12CCCC2	ZINC000450969392	GG	On-Demand	Anodyne	KCNQ2	50	33
CCO[C@@H]1C[C@H](NCC(=O)Nc2ccccc2N2CCCC2=O)C12CCCC2	ZINC000450969394	GG	On-Demand	Anodyne	KCNQ2	50	33
CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccccc2N2CCCC2=O)C12CCCC2	ZINC000450969396	GG	On-Demand	Anodyne	KCNQ2	50	33
CCn1nccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450969398	EE	On-Demand	Anodyne	PFK	0	42
O=C(C[C@H]1CSc2ccccc2O1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450969407	GG	On-Demand	Anodyne	CACNA1I	55	35
O=C(C[C@@H]1CSc2ccccc2O1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450969409	GG	On-Demand	Anodyne	CACNA1I	55	35
CCO[C@H]1C[C@H](NC[C@H](O)COCc2ccccc2)C12CCCC2	ZINC000450969426	EF	On-Demand	Anodyne	TIMP3	40	31
CCO[C@H]1C[C@@H](NC[C@H](O)COCc2ccccc2)C12CCCC2	ZINC000450969427	EF	On-Demand	Anodyne	TIMP3	40	31
CCO[C@H]1C[C@@H](NC[C@@H](O)COCc2ccccc2)C12CCCC2	ZINC000450969428	EF	On-Demand	Anodyne	TIMP3	40	31
CCO[C@H]1C[C@H](NC[C@@H](O)COCc2ccccc2)C12CCCC2	ZINC000450969429	EF	On-Demand	Anodyne	TIMP3	40	31
Cc1cc2c(N3CCN(C(=O)C(C)(C)OC(C)C)CC3)ncnc2s1	ZINC000450969443	FF	On-Demand	Anodyne	P2RY12	25	43
Cc1cc2c(N3CCN(C(=O)C(C)(C)OC(C)C)CC3)ncnc2s1	ZINC000450969443	FF	On-Demand	Anodyne	PDGFRB	41	36
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H]2CCCc3ccccc32)cc1	ZINC000450969444	FG	On-Demand	Anodyne	PLG	54	35
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H]2CCCc3ccccc32)cc1	ZINC000450969444	FG	On-Demand	Anodyne	TRYP_PIG	50	34
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H]2CCCc3ccccc32)cc1	ZINC000450969444	FG	On-Demand	Anodyne	BDKRB1	47	33
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H]2CCCc3ccccc32)cc1	ZINC000450969444	FG	On-Demand	Anodyne	NOD2	17	41
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000450969445	FG	On-Demand	Anodyne	PLG	54	35
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000450969445	FG	On-Demand	Anodyne	TRYP_PIG	50	34
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000450969445	FG	On-Demand	Anodyne	BDKRB1	47	33
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000450969445	FG	On-Demand	Anodyne	NOD2	17	41
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450969446	GE	On-Demand	Anodyne	AGTR2	95	42
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450969446	GE	On-Demand	Anodyne	PREP	16	40
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450969446	GE	On-Demand	Anodyne	CFTR	58	34
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450969446	GE	On-Demand	Anodyne	ADAM9	60	32
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450969447	GE	On-Demand	Anodyne	AGTR2	95	42
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450969447	GE	On-Demand	Anodyne	PREP	16	40
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450969447	GE	On-Demand	Anodyne	CFTR	58	34
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450969447	GE	On-Demand	Anodyne	ADAM9	60	32
O=C(CS(=O)(=O)C1CC1)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000450969462	EF	On-Demand	Anodyne	ATF1	40	37
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1cn(C)nc1C(F)(F)F	ZINC000450969492	GD	On-Demand	Anodyne	SRD5A1	29	40
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1cn(C)nc1C(F)(F)F	ZINC000450969492	GD	On-Demand	Anodyne	SRD5A2	32	40
O=S(=O)(Cc1ccc(C(F)F)cc1)Nc1c(F)cccc1N1CCCC1	ZINC000450969493	GI	On-Demand	Anodyne	KCNQ2	65	36
C[C@H]1CC[C@@H](NC(=O)c2cccc(C#N)c2Br)C1	ZINC000450969494	DG	On-Demand	Mild	EZH2	44	36
C[C@@H]1CC[C@H](NC(=O)c2cccc(C#N)c2Br)C1	ZINC000450969495	DG	On-Demand	Mild	EZH2	44	36
C[C@@H]1CC[C@@H](NC(=O)c2cccc(C#N)c2Br)C1	ZINC000450969496	DG	On-Demand	Mild	EZH2	44	36
C[C@H]1CC[C@H](NC(=O)c2cccc(C#N)c2Br)C1	ZINC000450969497	DG	On-Demand	Mild	EZH2	44	36
O=S(=O)(C[C@@H]1CCCCC1(F)F)N1CCN(c2ccc(F)cc2)CC1	ZINC000450969513	GG	On-Demand	Anodyne	MMP14	15	42
O=S(=O)(C[C@H]1CCCCC1(F)F)N1CCN(c2ccc(F)cc2)CC1	ZINC000450969514	GG	On-Demand	Anodyne	MMP14	15	42
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(C)cs1	ZINC000450969523	FE	On-Demand	Anodyne	MMP3	34	52
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(C)cs1	ZINC000450969523	FE	On-Demand	Anodyne	MMP8	39	52
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(C)cs1	ZINC000450969523	FE	On-Demand	Anodyne	ADAM9	65	38
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(C)cs1	ZINC000450969523	FE	On-Demand	Anodyne	AKR1C3	17	41
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(C)cs1	ZINC000450969524	FE	On-Demand	Anodyne	MMP3	34	52
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(C)cs1	ZINC000450969524	FE	On-Demand	Anodyne	MMP8	39	52
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(C)cs1	ZINC000450969524	FE	On-Demand	Anodyne	ADAM9	65	38
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(C)cs1	ZINC000450969524	FE	On-Demand	Anodyne	AKR1C3	17	41
COc1cccc(F)c1NC(=O)c1nn(C)c2c1CCCC2	ZINC000450969531	DF	On-Demand	Anodyne	TTK	0	42
CN(C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)c1ccn(C)n1	ZINC000450969536	FD	On-Demand	Mild	NR3C2	18	41
CN(C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1)c1ccn(C)n1	ZINC000450969537	FD	On-Demand	Mild	NR3C2	18	41
COC(=O)c1ncccc1S(=O)(=O)N1CCc2cc(OC)c(OC)cc2C1	ZINC000450969547	GD	On-Demand	Anodyne	ABCB1B	59	33
COC(=O)c1ncccc1S(=O)(=O)N1CCc2cc(OC)c(OC)cc2C1	ZINC000450969547	GD	On-Demand	Anodyne	ABCB1	26	40
COC(=O)c1ncccc1S(=O)(=O)N1CCc2cc(OC)c(OC)cc2C1	ZINC000450969547	GD	On-Demand	Anodyne	AKR1C3	60	44
COc1cc(NC(=O)CCCc2ncc(C)o2)ccc1F	ZINC000450969552	CG	On-Demand	Anodyne	IMPDH2	0	43
COc1cc(NC(=O)CCCc2ncc(C)o2)ccc1F	ZINC000450969552	CG	On-Demand	Anodyne	ENPP1	61	36
COC(=O)[C@@H](NS(=O)(=O)c1ccc(CC#N)cc1Cl)C(C)C	ZINC000450969562	ED	On-Demand	Mild	ADAMTS4	57	37
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccccc3)CC[C@@H]21	ZINC000450969566	ED	On-Demand	Anodyne	DRD4	0	44
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccccc3)CC[C@@H]21	ZINC000450969566	ED	On-Demand	Anodyne	HTR2C	23	47
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccccc3)CC[C@@H]21	ZINC000450969566	ED	On-Demand	Anodyne	SLC6A1	79	39
COCCN1C(=O)N[C@@H]2CN(CCCC(=O)c3ccccc3)CC[C@@H]21	ZINC000450969566	ED	On-Demand	Anodyne	CYP2J2	60	42
CC(C)(C)c1cc(=O)n(Cc2cccc(S(C)(=O)=O)c2)cn1	ZINC000450969575	DD	On-Demand	Anodyne	NR1I2	44	40
CCc1nc(C)c(COc2ccc(Br)cc2C(N)=O)o1	ZINC000450969585	EF	On-Demand	Anodyne	SLC22A12	56	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCSc3ccccc32)cc1	ZINC000450969589	GH	On-Demand	Anodyne	CPT1A	18	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCSc3ccccc32)cc1	ZINC000450969589	GH	On-Demand	Anodyne	TGM2	62	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCSc3ccccc32)cc1	ZINC000450969589	GH	On-Demand	Anodyne	F13A1	101	39
CCc1cc(CCCN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969591	GH	On-Demand	Anodyne	DRD4	19	40
CCc1cc(CCCN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969591	GH	On-Demand	Anodyne	SLC6A1	72	33
CCc1cc(CCCN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969591	GH	On-Demand	Anodyne	SIGMAR1	34	44
CCc1cc(CCCN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969591	GH	On-Demand	Anodyne	CCR3	17	42
CCc1cc(CCCN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969591	GH	On-Demand	Anodyne	PREP	50	39
CCc1cc(CCCN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969591	GH	On-Demand	Anodyne	BIRC2	61	43
CCc1cc(CCCN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969592	GH	On-Demand	Anodyne	DRD4	19	40
CCc1cc(CCCN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969592	GH	On-Demand	Anodyne	SLC6A1	72	33
CCc1cc(CCCN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969592	GH	On-Demand	Anodyne	SIGMAR1	34	44
CCc1cc(CCCN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969592	GH	On-Demand	Anodyne	CCR3	17	42
CCc1cc(CCCN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969592	GH	On-Demand	Anodyne	PREP	50	39
CCc1cc(CCCN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)on1	ZINC000450969592	GH	On-Demand	Anodyne	BIRC2	61	43
Cc1cccc(NC(=O)c2cc(C)n(C(C)C)n2)c1Br	ZINC000450969601	EI	On-Demand	Anodyne	NPY5R	15	45
COc1cccc(-n2cc(C(=O)NC3(c4nn[nH]n4)CC3)nn2)c1	ZINC000450969613	EC	On-Demand	Anodyne	DRD4	40	32
OCCC[C@@H]1CCN(c2nccnc2OC(F)F)C1	ZINC000450969616	CD	On-Demand	Anodyne	PDE1B	0	42
OCCC[C@H]1CCN(c2nccnc2OC(F)F)C1	ZINC000450969617	CD	On-Demand	Anodyne	PDE1B	0	42
CCOc1ccc(-c2nc(Cn3cnc4c3CCCC4)cs2)cc1OC	ZINC000450969620	FI	On-Demand	Anodyne	DCK	51	45
CCOc1ccc(-c2nc(Cn3cnc4c3CCCC4)cs2)cc1OC	ZINC000450969620	FI	On-Demand	Anodyne	PPARD	18	43
Cc1ccc(C2=NN(C(=O)Cn3cnc4c3CCCC4)[C@H](c3ccco3)C2)cc1	ZINC000450969621	GI	On-Demand	Anodyne	MAOB	25	56
Cc1ccc(C2=NN(C(=O)Cn3cnc4c3CCCC4)[C@@H](c3ccco3)C2)cc1	ZINC000450969622	GI	On-Demand	Anodyne	MAOB	25	56
CC[C@H](O)CC(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450969627	GE	On-Demand	Anodyne	LTA4H	32	44
CC[C@H](O)CC(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450969627	GE	On-Demand	Anodyne	ADORA2B	46	35
CC[C@@H](O)CC(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450969628	GE	On-Demand	Anodyne	LTA4H	32	44
CC[C@@H](O)CC(=O)Nc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000450969628	GE	On-Demand	Anodyne	ADORA2B	46	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccccc2F)cc1	ZINC000450969630	GF	On-Demand	Anodyne	CA2	15	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccccc2F)cc1	ZINC000450969630	GF	On-Demand	Anodyne	LEF	52	35
N#CC1(F)CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450969631	DF	On-Demand	Mild	SIGMAR1	39	45
CCn1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1=O	ZINC000450969632	GD	On-Demand	Anodyne	ADORA2B	19	42
CCn1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1=O	ZINC000450969632	GD	On-Demand	Anodyne	LUXN	0	43
CCn1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1=O	ZINC000450969632	GD	On-Demand	Anodyne	ADIPOR1	0	41
CCn1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1=O	ZINC000450969632	GD	On-Demand	Anodyne	ADIPOR2	0	41
C[C@@H](c1ccccc1)N1CCN(C(=O)Cn2cnc3c2CCCC3)CC1	ZINC000450969633	FF	On-Demand	Anodyne	PTAFR	41	38
C[C@H](c1ccccc1)N1CCN(C(=O)Cn2cnc3c2CCCC3)CC1	ZINC000450969634	FF	On-Demand	Anodyne	PTAFR	41	38
COCCO[C@H]1CCN(C(=O)Cc2cc(Br)ccc2C)C1	ZINC000450969637	FF	On-Demand	Anodyne	LIPG	21	40
COCCO[C@@H]1CCN(C(=O)Cc2cc(Br)ccc2C)C1	ZINC000450969638	FF	On-Demand	Anodyne	LIPG	21	40
CCc1cccc(C(=O)N2CCN(C3CC3)c3c(C)cccc32)n1	ZINC000450969640	DH	On-Demand	Anodyne	GPBAR1	42	39
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450969641	GI	On-Demand	Anodyne	AVPR2	61	44
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450969641	GI	On-Demand	Anodyne	AVPR1A	29	44
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450969641	GI	On-Demand	Anodyne	GPBAR1	43	41
CC(C)(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450969644	GE	On-Demand	Anodyne	PRTN3	52	32
CC(C)(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450969644	GE	On-Demand	Anodyne	FLT3	42	37
CC(C)(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450969644	GE	On-Demand	Anodyne	PFK	0	40
CC(C)(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450969644	GE	On-Demand	Anodyne	LUXN	0	48
Cc1csc(S(=O)(=O)Nc2cccc(NC(=O)C(C)C)c2)c1	ZINC000450969652	EG	On-Demand	Anodyne	KCNK3	47	35
Cc1csc(S(=O)(=O)Nc2cccc(NC(=O)C(C)C)c2)c1	ZINC000450969652	EG	On-Demand	Anodyne	KCNK9	59	37
COc1ccc(-c2nc(Cn3cnc4c3CCCC4)cs2)cc1OC	ZINC000450969664	FH	On-Demand	Anodyne	DCK	48	45
CCCNS(=O)(=O)c1ccc(NS(=O)(=O)c2cc(C)cs2)cc1	ZINC000450969669	FF	On-Demand	Anodyne	SREBF2	0	41
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1cc(C#N)[nH]c1C	ZINC000450969674	DG	On-Demand	Mild	GPBAR1	43	44
COc1cccc2c1N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CCC2	ZINC000450969676	GG	On-Demand	Anodyne	COLA	39	41
COc1cccc2c1N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CCC2	ZINC000450969676	GG	On-Demand	Anodyne	CPT1A	41	41
COc1cccc2c1N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CCC2	ZINC000450969676	GG	On-Demand	Anodyne	CPT2	43	36
COc1cccc2c1N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CCC2	ZINC000450969676	GG	On-Demand	Anodyne	TGM2	49	35
COc1cccc2c1N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CCC2	ZINC000450969676	GG	On-Demand	Anodyne	F13A1	81	36
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)N3CCCC3)c2)c1	ZINC000450969677	FG	On-Demand	Anodyne	LPL	50	36
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)N3CCCC3)c2)c1	ZINC000450969677	FG	On-Demand	Anodyne	HPGD	46	39
Cn1nccc1C1=CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450969684	GH	On-Demand	Anodyne	CYP2J2	51	37
CC[C@@H](O)CC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450969694	FF	On-Demand	Anodyne	P2RX7	33	40
CC[C@H](O)CC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450969695	FF	On-Demand	Anodyne	P2RX7	33	40
Clc1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450969697	CG	On-Demand	Anodyne	LTA4H	44	39
C[C@@H](NC(=O)c1cc(-c2ccccc2)nn1C)c1ncn(C)n1	ZINC000450969706	DD	On-Demand	Anodyne	CTSV	44	30
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(C)cc2)cc1	ZINC000450969707	GF	On-Demand	Anodyne	FOLP	0	47
C[C@H](NC(=O)c1cc(-c2ccccc2)nn1C)c1ncn(C)n1	ZINC000450969708	DD	On-Demand	Anodyne	CTSV	44	30
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4cc(C)on4)CC3)ccc2c1	ZINC000450969720	GF	On-Demand	Anodyne	ADORA2B	53	40
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4cc(C)on4)CC3)ccc2c1	ZINC000450969720	GF	On-Demand	Anodyne	PKM	36	44
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4cc(C)on4)CC3)ccc2c1	ZINC000450969720	GF	On-Demand	Anodyne	AURKA	0	40
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969722	EI	On-Demand	Anodyne	MMP2	22	40
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969722	EI	On-Demand	Anodyne	MMP3	40	40
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969722	EI	On-Demand	Anodyne	KCNK3	56	37
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969722	EI	On-Demand	Anodyne	KCNK9	40	35
C[C@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969722	EI	On-Demand	Anodyne	PDS	42	38
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969724	EI	On-Demand	Anodyne	MMP2	22	40
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969724	EI	On-Demand	Anodyne	MMP3	40	40
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969724	EI	On-Demand	Anodyne	KCNK3	56	37
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969724	EI	On-Demand	Anodyne	KCNK9	40	35
C[C@@H](OCCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450969724	EI	On-Demand	Anodyne	PDS	42	38
CC(C)CNC(=O)c1ccccc1NS(=O)(=O)c1sccc1F	ZINC000450969726	FG	On-Demand	Anodyne	PRTN3	48	38
CC(C)CNC(=O)c1ccccc1NS(=O)(=O)c1sccc1F	ZINC000450969726	FG	On-Demand	Anodyne	DAC	29	42
CCOC(=O)c1cc(C(=O)Nc2cccc(C(C)(F)F)c2)on1	ZINC000450969730	DG	On-Demand	Anodyne	KCNK3	72	34
CCOC(=O)c1cc(C(=O)Nc2cccc(C(C)(F)F)c2)on1	ZINC000450969730	DG	On-Demand	Anodyne	KCNK9	71	39
Cc1cnc(CCCC(=O)NCCc2cn(C)c3cc(Cl)ccc23)o1	ZINC000450969734	FH	On-Demand	Anodyne	MTNR1A	15	40
O=C(c1ccccc1NS(=O)(=O)c1sccc1Cl)N1CCCC1	ZINC000450969739	FG	On-Demand	Anodyne	GRM4	15	43
O=C(c1ccccc1NS(=O)(=O)c1sccc1Cl)N1CCCC1	ZINC000450969739	FG	On-Demand	Anodyne	PRTN3	44	32
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1ccc2cnccc2c1	ZINC000450969740	EI	On-Demand	Anodyne	GPBAR1	63	49
CCOC(=O)c1cc(C(=O)N2CCN(c3nc4ccccc4o3)[C@H](C)C2)on1	ZINC000450969765	GE	On-Demand	Anodyne	SSTR5	25	43
CCOC(=O)c1cc(C(=O)N2CCN(c3nc4ccccc4o3)[C@@H](C)C2)on1	ZINC000450969766	GE	On-Demand	Anodyne	SSTR5	25	43
Cc1csc(S(=O)(=O)N2CCN(c3ccccn3)CC2)c1	ZINC000450969768	DD	On-Demand	Anodyne	DRD4	26	40
Cc1csc(S(=O)(=O)N2CCN(c3ccccn3)CC2)c1	ZINC000450969768	DD	On-Demand	Anodyne	SLC6A7	0	41
CCS[C@H]1CCC[C@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450969770	EH	On-Demand	Anodyne	SSTR3	24	48
CCS[C@H]1CCC[C@@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450969771	EH	On-Demand	Anodyne	SSTR3	24	48
CCS[C@@H]1CCC[C@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450969772	EH	On-Demand	Anodyne	SSTR3	24	48
CCS[C@@H]1CCC[C@@H]1NCc1ccc(C(=O)OC)c(Cl)c1	ZINC000450969773	EH	On-Demand	Anodyne	SSTR3	24	48
Cc1ccc2cc(S(=O)(=O)Nc3ccc(N4CCOCC4)cn3)ccc2c1	ZINC000450969784	GG	On-Demand	Anodyne	STAT6	46	30
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	PDE5A	25	43
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	LCK	29	40
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	ATF1	46	33
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	FLT1	19	41
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	KDR	17	41
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	NPY5R	18	44
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	NFKB1	42	33
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	CSF1R	0	41
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	BTK	29	40
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	TAAR1	31	41
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	IMDH_CRYPV	41	34
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	PSBA	0	41
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	KCNK3	86	40
CCc1cccc(C(=O)Nc2cccc(C(C)(F)F)c2)n1	ZINC000450969790	CI	On-Demand	Anodyne	KCNK9	80	37
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2c(C)cccc2C)c1	ZINC000450969793	FI	On-Demand	Anodyne	FFAR4	37	52
CC(C)(C)C(=O)CCCC(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450969797	GI	On-Demand	Anodyne	NAMPT	0	41
COC(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c2sccc2F)c1	ZINC000450969807	GG	On-Demand	Anodyne	KCNQ2	44	34
O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC(OC(F)F)C1	ZINC000450969813	ED	On-Demand	Anodyne	PDE4D	15	44
O=C(Cc1ccccc1O[C@H]1CCOC1)N1CC(OC(F)F)C1	ZINC000450969814	ED	On-Demand	Anodyne	PDE4D	15	44
COC(=O)c1ccc(C(=O)CSc2nc(C)c(C)[nH]2)o1	ZINC000450969827	CE	On-Demand	Anodyne	ENPP1	48	32
CC(F)(F)c1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)cn1	ZINC000450969836	FG	On-Demand	Anodyne	HTR4	56	39
CC(F)(F)c1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)cn1	ZINC000450969836	FG	On-Demand	Anodyne	CACNA1I	78	49
CC(F)(F)c1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)cn1	ZINC000450969836	FG	On-Demand	Anodyne	HPGDS	42	49
CC(C)CC(CC(C)C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450969846	FI	On-Demand	Anodyne	CACNA1I	65	39
COc1cccc(-n2cc(C(=O)NCC3CCN(CC(F)(F)F)CC3)nn2)c1	ZINC000450969850	GE	On-Demand	Anodyne	DRD4	46	36
COc1cccc(-n2cc(C(=O)NCC3CCN(CC(F)(F)F)CC3)nn2)c1	ZINC000450969850	GE	On-Demand	Anodyne	HTR4	43	36
COc1cccc(-n2cc(C(=O)NCC3CCN(CC(F)(F)F)CC3)nn2)c1	ZINC000450969850	GE	On-Demand	Anodyne	CACNA1I	76	40
COc1cccc(-n2cc(C(=O)NCC3CCN(CC(F)(F)F)CC3)nn2)c1	ZINC000450969850	GE	On-Demand	Anodyne	HPGDS	35	47
CCOC(=O)C1CCN(S(=O)(=O)c2cccc3ccoc23)CC1	ZINC000450969851	EE	On-Demand	Anodyne	EPHX2	34	42
CC(C)(CF)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450969855	DH	On-Demand	Anodyne	MC3R	26	40
CC(C)(CF)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450969855	DH	On-Demand	Anodyne	MC5R	0	40
CC(C)(CF)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450969857	DH	On-Demand	Anodyne	MC3R	26	40
CC(C)(CF)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450969857	DH	On-Demand	Anodyne	MC5R	0	40
CC(C)(CF)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450969859	DH	On-Demand	Anodyne	MC3R	26	40
CC(C)(CF)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450969859	DH	On-Demand	Anodyne	MC5R	0	40
CC(C)(CF)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450969861	DH	On-Demand	Anodyne	MC3R	26	40
CC(C)(CF)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450969861	DH	On-Demand	Anodyne	MC5R	0	40
COC(=O)COc1ccc(CN(C)C(=O)c2cccc3c2CCCC3)cc1	ZINC000450969875	FG	On-Demand	Anodyne	LIMK2	33	41
CC(=O)CCCCCS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450969882	EF	On-Demand	Anodyne	AKR1C3	26	48
O=C(NCC1CCN(CC(F)(F)F)CC1)C1(C(=O)C2CC2)CC1	ZINC000450969884	EE	On-Demand	Anodyne	CACNA1I	53	37
Cc1cncn1C1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450969889	GF	On-Demand	Anodyne	EPHX2	27	52
CC(C)(CF)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450969890	DE	On-Demand	Anodyne	PSBA	0	47
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	KIT	28	54
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	JUN	20	40
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	LCK	37	45
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	TRPV1	18	40
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	ATF1	44	32
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	KDR	22	54
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	NR1H4	16	40
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	NFKB1	40	32
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	CSF1R	27	48
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	TEK	38	45
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	BTK	32	44
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	BRAF	44	41
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	TAAR1	41	39
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	KCNK3	118	43
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)(F)F)c2)cn1	ZINC000450969891	FI	On-Demand	Anodyne	KCNK9	81	37
COC(=O)c1csc(COc2ccc(OCC3CC3)c(Cl)c2)n1	ZINC000450969909	FH	On-Demand	Anodyne	PPARD	17	41
CC(C)(C)c1cc(NS(=O)(=O)c2sccc2F)n(-c2ncccn2)n1	ZINC000450969913	GF	On-Demand	Anodyne	DDR2	16	41
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCC1CCCC1	ZINC000450969914	FE	On-Demand	Anodyne	MMP3	30	54
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCC1CCCC1	ZINC000450969914	FE	On-Demand	Anodyne	MMP8	34	54
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCC1CCCC1	ZINC000450969914	FE	On-Demand	Anodyne	ADAM9	67	37
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)CCC1CCCC1	ZINC000450969914	FE	On-Demand	Anodyne	MMP1	19	42
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCC1CCCC1	ZINC000450969915	FE	On-Demand	Anodyne	MMP3	30	54
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCC1CCCC1	ZINC000450969915	FE	On-Demand	Anodyne	MMP8	34	54
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCC1CCCC1	ZINC000450969915	FE	On-Demand	Anodyne	ADAM9	67	37
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)CCC1CCCC1	ZINC000450969915	FE	On-Demand	Anodyne	MMP1	19	42
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccnn2C(C)C)c1	ZINC000450969920	FG	On-Demand	Anodyne	OXTR	43	42
O=S(=O)(Nc1ccccc1N1CCCCC1)c1sccc1F	ZINC000450969921	EH	On-Demand	Anodyne	KCNQ2	82	42
CCOC(=O)C1CCN(S(=O)(=O)c2sc3ccccc3c2Cl)CC1	ZINC000450969935	GH	On-Demand	Anodyne	PDE6D	41	31
CCOC(=O)c1nc(C2CCCCC2)c(C)s1	ZINC000450969937	CH	On-Demand	Anodyne	DHODH	17	43
Cn1cc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)c(C(F)(F)F)n1	ZINC000450969945	GF	On-Demand	Anodyne	EPHX2	22	42
Cn1cc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)c(C(F)(F)F)n1	ZINC000450969945	GF	On-Demand	Anodyne	SFRP1	56	32
Cn1cc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)cc2)c(C(F)(F)F)n1	ZINC000450969945	GF	On-Demand	Anodyne	WNT3	61	32
COc1cc(NC(=O)[C@@H](NC(C)=O)C(C)(C)C)ccc1F	ZINC000450969947	CE	On-Demand	Anodyne	GRM4	15	47
Cc1csc(S(=O)(=O)Nc2ccc3ccn(CCN(C)C)c3c2)c1	ZINC000450969949	FG	On-Demand	Anodyne	HTR6	15	62
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450969953	FI	On-Demand	Anodyne	JUN	28	54
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450969953	FI	On-Demand	Anodyne	TRPV1	18	48
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450969953	FI	On-Demand	Anodyne	ATF1	66	44
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450969953	FI	On-Demand	Anodyne	NFKB1	61	44
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450969953	FI	On-Demand	Anodyne	TAAR1	29	46
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450969953	FI	On-Demand	Anodyne	PTPA	0	43
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450969953	FI	On-Demand	Anodyne	DGAT1	40	44
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCC2)nc1	ZINC000450969953	FI	On-Demand	Anodyne	HPGDS	22	45
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccnc(OC(F)F)c1	ZINC000450969954	FF	On-Demand	Anodyne	HTR4	38	41
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccnc(OC(F)F)c1	ZINC000450969954	FF	On-Demand	Anodyne	CACNA1I	74	45
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccnc(OC(F)F)c1	ZINC000450969954	FF	On-Demand	Anodyne	HPGDS	36	43
O=C(COc1ccc(S(=O)(=O)NCC2CCCCC2)cc1)NC1CC1	ZINC000450969956	FE	On-Demand	Anodyne	NPY2R	69	41
O=C(COc1ccc(S(=O)(=O)NCC2CCCCC2)cc1)NC1CC1	ZINC000450969956	FE	On-Demand	Anodyne	NPY5R	22	41
O=C(COc1ccc(S(=O)(=O)NCC2CCCCC2)cc1)NC1CC1	ZINC000450969956	FE	On-Demand	Anodyne	ADAMTS4	15	40
Cc1cncn1C1CCN(C(=O)c2c(Cl)cc(Cl)cc2Cl)CC1	ZINC000450969958	FJ	On-Demand	Anodyne	L3MBTL3	43	36
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CF)nc2)c1	ZINC000450969960	DG	On-Demand	Anodyne	RAF1	35	42
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CF)nc2)c1	ZINC000450969960	DG	On-Demand	Anodyne	MTNR1A	26	43
COc1cccc(Oc2ccc(C(=O)NC(C)(C)CF)nc2)c1	ZINC000450969960	DG	On-Demand	Anodyne	MTNR1B	27	43
COc1cc(Br)c(C(=O)N[C@@H]2CC[C@@H](C)C2)cc1OC	ZINC000450969970	EG	On-Demand	Anodyne	HTR4	22	41
COc1cc(Br)c(C(=O)N[C@H]2CC[C@H](C)C2)cc1OC	ZINC000450969973	EG	On-Demand	Anodyne	HTR4	22	41
COc1cc(Br)c(C(=O)N[C@@H]2CC[C@H](C)C2)cc1OC	ZINC000450969974	EG	On-Demand	Anodyne	HTR4	22	41
COc1cc(Br)c(C(=O)N[C@H]2CC[C@@H](C)C2)cc1OC	ZINC000450969975	EG	On-Demand	Anodyne	HTR4	22	41
CSc1cccc(C)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450969986	DH	On-Demand	Anodyne	PRNP	44	39
CSc1cccc(C)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450969986	DH	On-Demand	Anodyne	HDAC1	31	41
CSc1cccc(C)c1NC(=O)c1ccc(N2CCC2)nc1	ZINC000450969986	DH	On-Demand	Anodyne	SHH	44	36
O=C(CCCC(=O)C1CC1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450969988	EF	On-Demand	Anodyne	CACNA1I	55	36
NC(=O)C1CCN(c2ccccc2NS(=O)(=O)c2sccc2F)CC1	ZINC000450969993	GE	On-Demand	Anodyne	KCNQ2	73	36
COCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450970011	FF	On-Demand	Anodyne	PFK	0	41
O=S(=O)(Nc1ccccc1C(F)(F)F)c1ccc(C2CC2)cc1	ZINC000450970015	EI	On-Demand	Anodyne	PRTN3	52	33
O=S(=O)(Nc1ccccc1C(F)(F)F)c1ccc(C2CC2)cc1	ZINC000450970015	EI	On-Demand	Anodyne	RBP4	44	39
O=S(=O)(Nc1ccccc1C(F)(F)F)c1ccc(C2CC2)cc1	ZINC000450970015	EI	On-Demand	Anodyne	SFRP1	112	36
O=S(=O)(Nc1ccccc1C(F)(F)F)c1ccc(C2CC2)cc1	ZINC000450970015	EI	On-Demand	Anodyne	WNT3	81	36
O=S(=O)(Nc1ccccc1C(F)(F)F)c1ccc(C2CC2)cc1	ZINC000450970015	EI	On-Demand	Anodyne	UQCRB	0	40
COc1cc(CN[C@@H]2CCC[C@H]2OC(F)F)ccc1Cl	ZINC000450970019	DH	On-Demand	Anodyne	SSTR3	19	43
O=S(=O)(NC1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450970021	DG	On-Demand	Anodyne	CCR8	31	40
O=S(=O)(NC1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450970021	DG	On-Demand	Anodyne	BRD4	22	41
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	CHRM2	19	40
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	DRD2	19	46
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	DRD4	39	46
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	ACHE	35	46
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	DRD3	29	46
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	CHRM3	25	42
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	SIGMAR1	75	52
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	CCR3	21	49
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	HTR6	15	46
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	TRPV4	16	40
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	MCHR1	20	42
O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1sccc1Cl	ZINC000450970022	FG	On-Demand	Anodyne	SFRP1	56	36
Cc1noc(C)c1-c1nc(-c2ccc(NC(=O)C(C)C)cc2)cs1	ZINC000450970033	EJ	On-Demand	Anodyne	SREBF2	0	43
CCO[C@H]1C[C@H](NCCC(=O)NCc2ccc(OC)cc2OC)C12CCCC2	ZINC000450970036	GG	On-Demand	Anodyne	MTNR1A	50	39
CCO[C@H]1C[C@@H](NCCC(=O)NCc2ccc(OC)cc2OC)C12CCCC2	ZINC000450970037	GG	On-Demand	Anodyne	MTNR1A	50	39
CCO[C@@H]1C[C@H](NCCC(=O)NCc2ccc(OC)cc2OC)C12CCCC2	ZINC000450970038	GG	On-Demand	Anodyne	MTNR1A	50	39
CCO[C@@H]1C[C@@H](NCCC(=O)NCc2ccc(OC)cc2OC)C12CCCC2	ZINC000450970039	GG	On-Demand	Anodyne	MTNR1A	50	39
CC(C)c1ccccc1NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450970041	DH	On-Demand	Anodyne	ACAT	0	40
COc1ccc(CCNS(=O)(=O)c2cc(C)cs2)cc1	ZINC000450970042	DF	On-Demand	Anodyne	PTGDR	23	40
N#CCc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)c(Cl)c1	ZINC000450970050	GD	On-Demand	Mild	TRPV4	42	34
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450970053	GG	On-Demand	Anodyne	NPY2R	41	40
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450970053	GG	On-Demand	Anodyne	FAAH	22	43
CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450970053	GG	On-Demand	Anodyne	MGLL	0	42
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450970054	GG	On-Demand	Anodyne	NPY2R	41	40
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450970054	GG	On-Demand	Anodyne	FAAH	22	43
CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(CN2CCN(C(C)=O)CC2)c1	ZINC000450970054	GG	On-Demand	Anodyne	MGLL	0	42
Cc1cccc(N2CCN(C(=O)COc3cccc4c3C(=O)CC4)CC2)c1	ZINC000450970059	FF	On-Demand	Anodyne	CCR1	23	41
CCOC(=O)c1sc(-c2c(F)cccc2OC(F)F)nc1C	ZINC000450970061	EI	On-Demand	Anodyne	DHODH	24	43
CC(=O)N1CCN(c2cccc(NC(=O)C(CC(C)C)CC(C)C)c2)CC1	ZINC000450970067	FI	On-Demand	Anodyne	NPY2R	59	38
CCOc1ccc(-c2csc(NS(=O)(=O)C[C@@H](C)OC)n2)cc1	ZINC000450970068	FF	On-Demand	Anodyne	MAOB	0	40
CCOc1ccc(-c2csc(NS(=O)(=O)C[C@H](C)OC)n2)cc1	ZINC000450970069	FF	On-Demand	Anodyne	MAOB	0	40
CN(CCc1ccccn1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970074	GD	On-Demand	Anodyne	MMP13	19	40
CN(CCc1ccccn1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970074	GD	On-Demand	Anodyne	LUXN	0	44
CN(CCc1ccccn1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970074	GD	On-Demand	Anodyne	ADIPOR1	0	41
CN(CCc1ccccn1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970074	GD	On-Demand	Anodyne	ADIPOR2	0	41
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCCc2ccccc2)c1	ZINC000450970079	FE	On-Demand	Anodyne	TPSAB1	18	44
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970082	ED	On-Demand	Mild	CCR3	47	48
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970082	ED	On-Demand	Mild	FAAH	27	44
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970082	ED	On-Demand	Mild	MCHR1	25	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970082	ED	On-Demand	Mild	NPFFR1	53	34
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970082	ED	On-Demand	Mild	BRD3	18	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970083	ED	On-Demand	Mild	CCR3	47	48
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970083	ED	On-Demand	Mild	FAAH	27	44
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970083	ED	On-Demand	Mild	MCHR1	25	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970083	ED	On-Demand	Mild	NPFFR1	53	34
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970083	ED	On-Demand	Mild	BRD3	18	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970084	ED	On-Demand	Mild	CCR3	47	48
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970084	ED	On-Demand	Mild	FAAH	27	44
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970084	ED	On-Demand	Mild	MCHR1	25	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970084	ED	On-Demand	Mild	NPFFR1	53	34
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@H]3C)c2)CC1	ZINC000450970084	ED	On-Demand	Mild	BRD3	18	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970085	ED	On-Demand	Mild	CCR3	47	48
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970085	ED	On-Demand	Mild	FAAH	27	44
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970085	ED	On-Demand	Mild	MCHR1	25	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970085	ED	On-Demand	Mild	NPFFR1	53	34
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@]3(C#N)C[C@@H]3C)c2)CC1	ZINC000450970085	ED	On-Demand	Mild	BRD3	18	41
CCc1cccc(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)n1	ZINC000450970090	FF	On-Demand	Anodyne	P2RY12	39	51
CC(=O)N1CCN(c2cccc(NC(=O)C(C)(C)OC(C)C)c2)CC1	ZINC000450970103	EE	On-Demand	Anodyne	NPY2R	35	40
COC(=O)c1ncccc1S(=O)(=O)NCC(C)C	ZINC000450970104	CC	On-Demand	Anodyne	MTNN	40	30
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450970110	GD	On-Demand	Anodyne	HTR1D	24	42
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450970110	GD	On-Demand	Anodyne	IKBKB	43	33
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450970110	GD	On-Demand	Anodyne	FAAH	30	43
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450970110	GD	On-Demand	Anodyne	MGLL	0	41
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450970110	GD	On-Demand	Anodyne	P2RY14	44	34
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450970110	GD	On-Demand	Anodyne	STAT6	45	32
CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450970110	GD	On-Demand	Anodyne	NPFFR1	50	34
COc1ccccc1CCNC(=O)COc1cccc2c1C(=O)CC2	ZINC000450970119	EF	On-Demand	Anodyne	MT-CYB	44	34
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](S(=O)(=O)N(C)C)C1	ZINC000450970124	ED	On-Demand	Anodyne	OPRK1	25	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](S(=O)(=O)N(C)C)C1	ZINC000450970124	ED	On-Demand	Anodyne	CCR5	40	37
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](S(=O)(=O)N(C)C)C1	ZINC000450970125	ED	On-Demand	Anodyne	OPRK1	25	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](S(=O)(=O)N(C)C)C1	ZINC000450970125	ED	On-Demand	Anodyne	CCR5	40	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](S(=O)(=O)N(C)C)C1	ZINC000450970126	ED	On-Demand	Anodyne	OPRK1	25	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](S(=O)(=O)N(C)C)C1	ZINC000450970126	ED	On-Demand	Anodyne	CCR5	40	37
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](S(=O)(=O)N(C)C)C1	ZINC000450970127	ED	On-Demand	Anodyne	OPRK1	25	40
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](S(=O)(=O)N(C)C)C1	ZINC000450970127	ED	On-Demand	Anodyne	CCR5	40	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ccncc32)cc1	ZINC000450970131	FE	On-Demand	Anodyne	CPT1A	28	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ccncc32)cc1	ZINC000450970131	FE	On-Demand	Anodyne	TGM2	53	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ccncc32)cc1	ZINC000450970131	FE	On-Demand	Anodyne	F13A1	67	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ccncc32)cc1	ZINC000450970131	FE	On-Demand	Anodyne	NAMPT	49	38
CC(=O)c1ccc(CN(C)Cc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000450970133	FI	On-Demand	Anodyne	LTA4H	25	40
CC(=O)c1ccc(CN(C)Cc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000450970133	FI	On-Demand	Anodyne	LSS	24	40
Cn1nccc1C1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450970134	EG	On-Demand	Anodyne	DRD2	30	42
Cn1nccc1C1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450970134	EG	On-Demand	Anodyne	DRD4	0	42
Cn1nccc1C1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450970134	EG	On-Demand	Anodyne	SLC18A3	0	44
Cn1nccc1C1=CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450970134	EG	On-Demand	Anodyne	CYP2J2	51	37
CN(C[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)S(C)(=O)=O	ZINC000450970135	EE	On-Demand	Anodyne	BIRC2	37	44
CN(C[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)S(C)(=O)=O	ZINC000450970136	EE	On-Demand	Anodyne	BIRC2	37	44
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccccc1OC	ZINC000450970144	FD	On-Demand	Anodyne	MMP16	0	40
O=C(CC(F)(F)F)NC[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970149	FE	On-Demand	Anodyne	CHRM4	18	53
O=C(CC(F)(F)F)NC[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970149	FE	On-Demand	Anodyne	CCR3	31	44
O=C(CC(F)(F)F)NC[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970150	FE	On-Demand	Anodyne	CHRM4	18	53
O=C(CC(F)(F)F)NC[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970150	FE	On-Demand	Anodyne	CCR3	31	44
CCCCCc1nnc(NS(=O)(=O)Cc2ccc(C(=O)OCC)cc2)s1	ZINC000450970152	GG	On-Demand	Anodyne	CA4	18	42
CCCCCc1nnc(NS(=O)(=O)Cc2ccc(C(=O)OCC)cc2)s1	ZINC000450970152	GG	On-Demand	Anodyne	GLS	0	42
N#CC1(F)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450970172	CG	On-Demand	Mild	SIGMAR1	24	49
N#CC1(F)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450970172	CG	On-Demand	Mild	CCR1	40	40
N#CC1(F)CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450970172	CG	On-Demand	Mild	KCNJ1	51	39
COCCN(Cc1ccccc1)S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450970175	FG	On-Demand	Anodyne	AMY2	42	29
COCCN(Cc1ccccc1)S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450970176	FG	On-Demand	Anodyne	AMY2	42	29
CN(CCN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1)Cc1ccccc1	ZINC000450970181	FF	On-Demand	Anodyne	SLC6A1	103	34
CN(CCN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1)Cc1ccccc1	ZINC000450970181	FF	On-Demand	Anodyne	CHRM4	22	49
CN(CCN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1)Cc1ccccc1	ZINC000450970181	FF	On-Demand	Anodyne	CCR3	40	39
CN(CCN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1)Cc1ccccc1	ZINC000450970181	FF	On-Demand	Anodyne	BIRC2	41	37
CN(CCN1CCC[C@H](CNC(=O)CC(F)(F)F)C1)Cc1ccccc1	ZINC000450970182	FF	On-Demand	Anodyne	SLC6A1	103	34
CN(CCN1CCC[C@H](CNC(=O)CC(F)(F)F)C1)Cc1ccccc1	ZINC000450970182	FF	On-Demand	Anodyne	CHRM4	22	49
CN(CCN1CCC[C@H](CNC(=O)CC(F)(F)F)C1)Cc1ccccc1	ZINC000450970182	FF	On-Demand	Anodyne	CCR3	40	39
CN(CCN1CCC[C@H](CNC(=O)CC(F)(F)F)C1)Cc1ccccc1	ZINC000450970182	FF	On-Demand	Anodyne	BIRC2	41	37
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	CA2	21	51
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	CA1	24	40
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	MMP13	22	46
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	BDKRB1	0	50
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	CA4	22	44
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	GRM4	18	40
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	MMP2	16	40
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	PRTN3	53	36
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	CA12	15	40
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	CA9	18	51
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970189	GG	On-Demand	Anodyne	IDO1	35	43
CC(=O)[C@@](C)(O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450970190	CD	On-Demand	Bother	COLA	99	39
CC(=O)[C@@](C)(O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450970190	CD	On-Demand	Bother	PQSD	0	44
CC(=O)[C@](C)(O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450970191	CD	On-Demand	Bother	COLA	99	39
CC(=O)[C@](C)(O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450970191	CD	On-Demand	Bother	PQSD	0	44
COCCO[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450970199	DD	On-Demand	Anodyne	LIPG	43	45
COCCO[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)[nH]2)C1	ZINC000450970200	DD	On-Demand	Anodyne	LIPG	43	45
CCc1cccc(OCCn2cnc3c2CCCC3)c1	ZINC000450970210	CG	On-Demand	Anodyne	SQLE	40	30
Cc1cccnc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450970220	GE	On-Demand	Anodyne	MTNN	79	37
CO[C@H](C)CS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2)cn1	ZINC000450970221	EF	On-Demand	Anodyne	ACAT	41	35
CO[C@@H](C)CS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2)cn1	ZINC000450970222	EF	On-Demand	Anodyne	ACAT	41	35
CO[C@H](C)CS(=O)(=O)Nc1ccccc1OCCn1ccnc1	ZINC000450970223	ED	On-Demand	Anodyne	TBXAS1	28	45
CO[C@@H](C)CS(=O)(=O)Nc1ccccc1OCCn1ccnc1	ZINC000450970224	ED	On-Demand	Anodyne	TBXAS1	28	45
Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970226	FE	On-Demand	Anodyne	CA2	22	51
Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970226	FE	On-Demand	Anodyne	CA1	27	41
Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970226	FE	On-Demand	Anodyne	NMT1	28	45
Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970226	FE	On-Demand	Anodyne	CA9	17	51
CCCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450970234	FG	On-Demand	Anodyne	ADRB2	57	42
CCCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450970234	FG	On-Demand	Anodyne	ADRB1	36	42
CCCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450970234	FG	On-Demand	Anodyne	INHA	71	37
CCCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450970234	FG	On-Demand	Anodyne	ADRB3	64	42
CCCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450970234	FG	On-Demand	Anodyne	PTPRB	64	37
CCCCCc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450970234	FG	On-Demand	Anodyne	ALOX15	46	38
Cc1cccc(C)c1CS(=O)(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000450970238	FE	On-Demand	Anodyne	STAT6	55	39
CCN1CCC(NS(=O)(=O)c2sc3ccccc3c2Cl)CC1	ZINC000450970244	FG	On-Demand	Anodyne	CCR8	78	34
Cc1csc(S(=O)(=O)Nc2cc(Cl)ccc2N2CCN(C)CC2)c1	ZINC000450970246	GG	On-Demand	Anodyne	DRD1	58	38
Cc1csc(S(=O)(=O)Nc2cc(Cl)ccc2N2CCN(C)CC2)c1	ZINC000450970246	GG	On-Demand	Anodyne	HRH4	22	41
NC(=O)NC(=O)CCCSc1ccc(Br)c(Cl)c1	ZINC000450970265	FG	On-Demand	Anodyne	PMI1	0	48
CCOC(=O)c1cc(C(=O)N2CCN(c3nc4ccccc4o3)[C@H](C)C2)[nH]c1C	ZINC000450970280	GF	On-Demand	Anodyne	SSTR5	20	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H]2COCCO2)C1	ZINC000450970281	EE	On-Demand	Anodyne	PREP	45	38
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H]2COCCO2)C1	ZINC000450970281	EE	On-Demand	Anodyne	BIRC2	48	40
CCOC(=O)c1cc(C(=O)N2CCN(c3nc4ccccc4o3)[C@@H](C)C2)[nH]c1C	ZINC000450970282	GF	On-Demand	Anodyne	SSTR5	20	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H]2COCCO2)C1	ZINC000450970286	EE	On-Demand	Anodyne	PREP	45	38
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H]2COCCO2)C1	ZINC000450970286	EE	On-Demand	Anodyne	BIRC2	48	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@@H]2COCCO2)C1	ZINC000450970287	EE	On-Demand	Anodyne	PREP	45	38
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@@H]2COCCO2)C1	ZINC000450970287	EE	On-Demand	Anodyne	BIRC2	48	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@@H]2COCCO2)C1	ZINC000450970289	EE	On-Demand	Anodyne	PREP	45	38
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@@H]2COCCO2)C1	ZINC000450970289	EE	On-Demand	Anodyne	BIRC2	48	40
COc1cc(CC(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1Cl	ZINC000450970294	GG	On-Demand	Anodyne	NCE103	16	40
COc1cc(CC(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1Cl	ZINC000450970294	GG	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1Cl	ZINC000450970295	GG	On-Demand	Anodyne	NCE103	16	40
COc1cc(CC(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1Cl	ZINC000450970295	GG	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1Cl	ZINC000450970297	GG	On-Demand	Anodyne	NCE103	16	40
COc1cc(CC(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1Cl	ZINC000450970297	GG	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1Cl	ZINC000450970298	GG	On-Demand	Anodyne	NCE103	16	40
COc1cc(CC(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1Cl	ZINC000450970298	GG	On-Demand	Anodyne	CAN2	0	40
Cc1cncn1C1CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450970305	EH	On-Demand	Anodyne	L3MBTL3	53	36
O=C1CCc2cccc(OCC(=O)N(Cc3ccccc3)C3CC3)c21	ZINC000450970315	EG	On-Demand	Anodyne	PTGIR	43	36
CCOc1cc(C(=O)N2CCN(c3nc4ccccc4o3)[C@H](C)C2)on1	ZINC000450970321	FF	On-Demand	Anodyne	SSTR5	24	40
CCOc1cc(C(=O)N2CCN(c3nc4ccccc4o3)[C@@H](C)C2)on1	ZINC000450970322	FF	On-Demand	Anodyne	SSTR5	24	40
C[C@@H]1CC[C@H](NC(=O)c2ccc3cnccc3c2)C1	ZINC000450970323	CG	On-Demand	Anodyne	AKT1	24	47
C[C@@H]1CC[C@@H](NC(=O)c2ccc3cnccc3c2)C1	ZINC000450970326	CG	On-Demand	Anodyne	AKT1	24	47
C[C@H]1CC[C@H](NC(=O)c2ccc3cnccc3c2)C1	ZINC000450970327	CG	On-Demand	Anodyne	AKT1	24	47
C[C@H]1CC[C@@H](NC(=O)c2ccc3cnccc3c2)C1	ZINC000450970329	CG	On-Demand	Anodyne	AKT1	24	47
Cc1csc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000450970330	GD	On-Demand	Anodyne	LPL	41	38
Cc1csc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000450970330	GD	On-Demand	Anodyne	HSD11B1	16	46
Cc1csc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000450970330	GD	On-Demand	Anodyne	F13A1	46	35
Cc1csc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000450970330	GD	On-Demand	Anodyne	AKR1C3	52	38
Cc1cc(CN2CCN(S(=O)(=O)c3sccc3Cl)CC2)no1	ZINC000450970349	FE	On-Demand	Anodyne	AURKA	16	43
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)[C@H](O)C1CCC1	ZINC000450970380	DG	On-Demand	Anodyne	JUN	24	41
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)[C@H](O)C1CCC1	ZINC000450970380	DG	On-Demand	Anodyne	ATF1	57	40
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)[C@H](O)C1CCC1	ZINC000450970380	DG	On-Demand	Anodyne	NFKB1	53	40
Cc1cc(C(=O)NCC2CCN(CC(F)(F)F)CC2)nn1C(C)C	ZINC000450970381	EF	On-Demand	Anodyne	HTR4	28	43
Cc1cc(C(=O)NCC2CCN(CC(F)(F)F)CC2)nn1C(C)C	ZINC000450970381	EF	On-Demand	Anodyne	CACNA1I	69	42
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)[C@@H](O)C1CCC1	ZINC000450970382	DG	On-Demand	Anodyne	JUN	24	41
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)[C@@H](O)C1CCC1	ZINC000450970382	DG	On-Demand	Anodyne	ATF1	57	40
O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)[C@@H](O)C1CCC1	ZINC000450970382	DG	On-Demand	Anodyne	NFKB1	53	40
COC(=O)c1ncccc1S(=O)(=O)NC[C@@H]1COc2ccccc2O1	ZINC000450970386	FC	On-Demand	Anodyne	ADRA2B	22	43
O=S(=O)(Cc1ccc(C(F)F)cc1)Nc1ccc(N2CCOCC2)nc1	ZINC000450970387	GF	On-Demand	Anodyne	DGAT1	21	42
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCc2ccc(F)cc2)c1	ZINC000450970393	FD	On-Demand	Anodyne	PTGS2	26	40
COC(=O)c1ncccc1S(=O)(=O)NC[C@H]1COc2ccccc2O1	ZINC000450970396	FC	On-Demand	Anodyne	ADRA2B	22	43
CCC(CC)Oc1ccc(C(=O)Nc2c(F)cccc2OC)cc1	ZINC000450970398	EJ	On-Demand	Anodyne	KCNJ11	26	40
CCC(CC)Oc1ccc(C(=O)Nc2c(F)cccc2OC)cc1	ZINC000450970398	EJ	On-Demand	Anodyne	TAAR1	30	42
CCC(CC)Oc1ccc(C(=O)Nc2c(F)cccc2OC)cc1	ZINC000450970398	EJ	On-Demand	Anodyne	KCNK3	47	34
CCC(CC)Oc1ccc(C(=O)Nc2c(F)cccc2OC)cc1	ZINC000450970398	EJ	On-Demand	Anodyne	KCNK9	40	34
O=C(COc1ccc(S(=O)(=O)NCCCn2ccnc2)cc1)NC1CC1	ZINC000450970400	GC	On-Demand	Anodyne	TBXAS1	49	48
O=C(COc1ccc(S(=O)(=O)NCCCn2ccnc2)cc1)NC1CC1	ZINC000450970400	GC	On-Demand	Anodyne	HMOX2	25	41
O=C(COc1ccc(S(=O)(=O)NCCCn2ccnc2)cc1)NC1CC1	ZINC000450970400	GC	On-Demand	Anodyne	QPCT	38	43
COC(=O)c1ncccc1S(=O)(=O)N(CCC(C)C)CCC(C)C	ZINC000450970418	FF	On-Demand	Anodyne	MMP13	16	43
COC(=O)c1ncccc1S(=O)(=O)N(CCC(C)C)CCC(C)C	ZINC000450970418	FF	On-Demand	Anodyne	MMP3	17	47
CCN(CC)C(=O)c1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450970424	GG	On-Demand	Anodyne	OPRM1	0	40
CCN(CC)C(=O)c1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450970424	GG	On-Demand	Anodyne	OPRD1	25	40
CCN(CC)C(=O)c1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450970424	GG	On-Demand	Anodyne	LIMK2	20	41
CCN(CC)C(=O)c1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450970426	GG	On-Demand	Anodyne	OPRM1	0	40
CCN(CC)C(=O)c1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450970426	GG	On-Demand	Anodyne	OPRD1	25	40
CCN(CC)C(=O)c1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450970426	GG	On-Demand	Anodyne	LIMK2	20	41
CCOC(=O)c1sc(NS(=O)(=O)c2cc(C)cs2)nc1C	ZINC000450970427	EF	On-Demand	Anodyne	DHODH	28	50
C[C@H]1CN(C(=O)C(C)(C)C2CCC2)CCN1c1nc2ccccc2o1	ZINC000450970428	EH	On-Demand	Anodyne	HTR3A	20	46
Cc1cccc2c1O[C@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)C2	ZINC000450970434	FF	On-Demand	Anodyne	CACNA1I	54	35
Cc1cccc2c1O[C@@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)C2	ZINC000450970436	FF	On-Demand	Anodyne	CACNA1I	54	35
COC[C@@]1(C(=O)NCC2CCN(CC(F)(F)F)CC2)CCOC1	ZINC000450970440	ED	On-Demand	Anodyne	CACNA1I	49	38
COC[C@]1(C(=O)NCC2CCN(CC(F)(F)F)CC2)CCOC1	ZINC000450970441	ED	On-Demand	Anodyne	CACNA1I	49	38
Cn1cc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]2C(N)=O)cn1	ZINC000450970442	FD	On-Demand	Anodyne	DRD2	30	41
Cn1cc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]2C(N)=O)cn1	ZINC000450970442	FD	On-Demand	Anodyne	DRD4	0	46
Cn1cc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]2C(N)=O)cn1	ZINC000450970442	FD	On-Demand	Anodyne	SLC18A3	0	44
Cn1cc([C@H]2CN(CCCC(=O)c3ccc(F)cc3)C[C@@H]2C(N)=O)cn1	ZINC000450970442	FD	On-Demand	Anodyne	CYP2J2	45	32
C[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450970445	DH	On-Demand	Anodyne	SLC6A1	0	42
C[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450970445	DH	On-Demand	Anodyne	PRCP	17	44
C[C@H]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450970447	DH	On-Demand	Anodyne	SLC6A1	0	42
C[C@H]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450970447	DH	On-Demand	Anodyne	PRCP	17	44
C[C@@H]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450970449	DH	On-Demand	Anodyne	SLC6A1	0	42
C[C@@H]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450970449	DH	On-Demand	Anodyne	PRCP	17	44
C[C@@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450970451	DH	On-Demand	Anodyne	SLC6A1	0	42
C[C@@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000450970451	DH	On-Demand	Anodyne	PRCP	17	44
C[C@@H]1CN(C(=O)C(C)(C)C2CCC2)CCN1c1nc2ccccc2o1	ZINC000450970452	EH	On-Demand	Anodyne	HTR3A	20	46
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	CA2	33	52
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	ADRB2	34	53
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	ADRB1	25	53
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	ADRB3	36	53
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	CA1	40	45
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	CA7	17	44
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	CA4	30	45
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	CA14	21	44
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	PTPRB	60	39
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	CA12	27	44
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	ADAMTS4	47	37
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	CA9	30	44
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	IDO1	35	41
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	PFK	0	44
COC(=O)Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970454	GF	On-Demand	Anodyne	LIMK2	50	38
COC(=O)c1coc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450970456	GF	On-Demand	Anodyne	DRD4	20	42
COC(=O)c1coc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450970456	GF	On-Demand	Anodyne	PREP	47	37
COC(=O)c1coc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450970456	GF	On-Demand	Anodyne	FAAH	28	46
COC(=O)c1coc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450970456	GF	On-Demand	Anodyne	BIRC2	52	42
CCCN(CC1CC1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970458	EG	On-Demand	Anodyne	BMP1	20	46
CCCN(CC1CC1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970458	EG	On-Demand	Anodyne	CA9	15	49
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450970460	GF	On-Demand	Anodyne	DRD4	20	42
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450970460	GF	On-Demand	Anodyne	PREP	47	37
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450970460	GF	On-Demand	Anodyne	FAAH	28	46
COC(=O)c1coc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)n1	ZINC000450970460	GF	On-Demand	Anodyne	BIRC2	52	42
CC(C)CCNS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450970462	DD	On-Demand	Anodyne	RORB	0	42
Cc1ccn(CC(=O)NCC2CCN(CC(F)(F)F)CC2)n1	ZINC000450970464	DD	On-Demand	Anodyne	CACNA1I	61	40
CCCc1cc(C(=O)Nc2c(C)cccc2SC)no1	ZINC000450970478	CH	On-Demand	Anodyne	HSP90AB1	22	40
CN(C)CCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970480	FC	On-Demand	Anodyne	SLC6A5	20	40
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc2ccncc2s1	ZINC000450970491	FG	On-Demand	Anodyne	CACNA1I	59	38
O=C(NCC1CCN(CC(F)(F)F)CC1)c1cc2ccncc2s1	ZINC000450970491	FG	On-Demand	Anodyne	NAMPT	18	54
CCCCN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970492	ED	On-Demand	Anodyne	MMP13	36	43
CCCCN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970492	ED	On-Demand	Anodyne	MMP3	25	43
CCCCN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970492	ED	On-Demand	Anodyne	PLA2G4B	59	34
CCCCN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450970492	ED	On-Demand	Anodyne	MMP1	25	40
CCCCNS(=O)(=O)CCC1CCCC1	ZINC000450970508	BE	On-Demand	Anodyne	RELA	17	40
CC(C)(CF)NC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450970509	EE	On-Demand	Mild	AR	24	44
CC(C)(CF)NC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450970510	EE	On-Demand	Mild	AR	24	44
Cn1cc([C@H]2CN(CCCC(=O)c3ccccc3)C[C@@H]2C(N)=O)cn1	ZINC000450970512	ED	On-Demand	Anodyne	CYP2J2	52	37
O=S(=O)(CCC1CCCC1)NCCCn1ccnc1	ZINC000450970516	CD	On-Demand	Anodyne	CAMC	0	45
O=S(=O)(CCC1CCCC1)NCCCn1ccnc1	ZINC000450970516	CD	On-Demand	Anodyne	QPCT	39	46
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	CHRM5	19	43
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	LPL	45	35
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	CA14	15	44
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	TGM1	23	41
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	EPHX2	48	45
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	TGM2	89	51
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	F13A1	112	51
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	NAMPT	41	43
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	TGM6	0	41
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450970518	GE	On-Demand	Anodyne	DDIT3	0	41
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	MME	76	39
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	ANPEP	48	34
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	PAPA1_CARPA	52	38
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	CYSP_TRYCR	51	35
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	CPA1	44	36
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	CAPN1	40	35
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	CAPN2	46	32
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	ACE2	48	36
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	POL	0	43
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	AMP1_PLAFQ	59	36
CO[C@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970519	CE	On-Demand	Anodyne	BLAIMP-1	0	40
O=S(=O)(Nc1cc(Cl)ccc1N1CCOCC1)c1sccc1Cl	ZINC000450970524	GH	On-Demand	Anodyne	CREBBP	39	42
O=S(=O)(Nc1cc(Cl)ccc1N1CCOCC1)c1sccc1Cl	ZINC000450970524	GH	On-Demand	Anodyne	BRD9	39	42
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	CA2	37	55
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	CA1	45	46
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	KCNA5	38	43
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	CA7	18	48
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	MMP13	40	42
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	BDKRB1	0	50
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	COLA	64	37
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	CA4	37	46
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	GRM4	24	45
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	CA14	19	48
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	MMP2	35	45
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	PRTN3	61	39
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	MMP9	25	40
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	MMP12	44	37
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	CA12	30	55
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	CA9	32	55
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	LEF	25	40
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	IDO1	32	42
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	NCE103	15	42
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	LIMK2	44	39
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	MTCA1	39	40
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	P96878_MYCTU	50	40
CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970534	EH	On-Demand	Anodyne	UQCRB	0	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000450970539	GD	On-Demand	Anodyne	LPL	44	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000450970539	GD	On-Demand	Anodyne	TRPV1	16	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000450970539	GD	On-Demand	Anodyne	IKBKB	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000450970539	GD	On-Demand	Anodyne	PRNP	50	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000450970539	GD	On-Demand	Anodyne	GRM4	17	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000450970539	GD	On-Demand	Anodyne	TGM2	84	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000450970539	GD	On-Demand	Anodyne	F13A1	109	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000450970539	GD	On-Demand	Anodyne	NAMPT	54	42
CCOC(=O)c1ccc(CS(=O)(=O)N2CCc3ccccc32)cc1	ZINC000450970540	EF	On-Demand	Anodyne	NOD1	28	48
CCOC(=O)c1ccc(CS(=O)(=O)N2CCc3ccccc32)cc1	ZINC000450970540	EF	On-Demand	Anodyne	NOD2	43	48
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000450970542	GH	On-Demand	Anodyne	SCD1	40	47
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000450970542	GH	On-Demand	Anodyne	SCD	40	54
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000450970543	GH	On-Demand	Anodyne	SCD1	40	47
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000450970543	GH	On-Demand	Anodyne	SCD	40	54
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCN(c2ccc(F)cc2)CC1	ZINC000450970544	FF	On-Demand	Anodyne	MMP14	15	43
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCN(c2ccc(F)cc2)CC1	ZINC000450970545	FF	On-Demand	Anodyne	MMP14	15	43
CCO[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970551	FG	On-Demand	Anodyne	ADRB2	25	62
CCO[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970551	FG	On-Demand	Anodyne	ADRB1	17	57
CCO[C@@H]1C[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970551	FG	On-Demand	Anodyne	HTR1A	23	62
CCO[C@@H]1C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970552	FG	On-Demand	Anodyne	ADRB2	25	62
CCO[C@@H]1C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970552	FG	On-Demand	Anodyne	ADRB1	17	57
CCO[C@@H]1C[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970552	FG	On-Demand	Anodyne	HTR1A	23	62
CCO[C@@H]1C[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970553	FG	On-Demand	Anodyne	ADRB2	25	62
CCO[C@@H]1C[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970553	FG	On-Demand	Anodyne	ADRB1	17	57
CCO[C@@H]1C[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970553	FG	On-Demand	Anodyne	HTR1A	23	62
CCO[C@@H]1C[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970554	FG	On-Demand	Anodyne	ADRB2	25	62
CCO[C@@H]1C[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970554	FG	On-Demand	Anodyne	ADRB1	17	57
CCO[C@@H]1C[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C12CCCC2	ZINC000450970554	FG	On-Demand	Anodyne	HTR1A	23	62
COc1ccc(-c2csc(=NC3CCC3)[nH]2)cc1OC	ZINC000450970559	CG	On-Demand	Anodyne	PDE7A	18	43
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	CHRM2	19	43
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	DRD2	15	44
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	DRD4	38	45
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	ACHE	36	42
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	DRD3	15	44
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	CHRM3	23	44
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	SIGMAR1	67	47
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	CCR3	24	43
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	CACNA1G	26	47
O=S(=O)(C[C@@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970564	GG	On-Demand	Anodyne	NPFFR1	46	34
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	CHRM2	19	43
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	DRD2	15	44
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	DRD4	38	45
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	ACHE	36	42
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	DRD3	15	44
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	CHRM3	23	44
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	SIGMAR1	67	47
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	CCR3	24	43
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	CACNA1G	26	47
O=S(=O)(C[C@H]1CCCCC1(F)F)NC1CCN(Cc2ccccc2)CC1	ZINC000450970565	GG	On-Demand	Anodyne	NPFFR1	46	34
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	CA2	42	57
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	ADRB2	43	55
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	ADRB1	48	55
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	ADRB3	65	55
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	TBXA2R	54	47
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	TBXAS1	26	45
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	BMP1	118	44
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	NQO2	26	43
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	CA1	48	53
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	CA7	24	42
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP13	89	51
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	ALOX15B	0	41
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	CA4	23	49
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP16	0	40
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	CA14	31	53
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MTNR1A	37	43
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MTNR1B	31	47
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP2	72	51
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP3	73	54
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP8	49	51
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP14	27	47
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	NPY5R	15	40
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	ALOX15	61	45
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP9	69	51
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP12	50	47
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	PLAU	19	43
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	CA12	40	55
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP10	19	50
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP7	51	50
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	IAP	0	43
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	ADAMTS4	56	39
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	CA9	45	55
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MMP1	68	47
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	LEF	18	47
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	IDO1	35	48
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	MTCA1	18	42
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	P96878_MYCTU	28	42
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	RORC	43	41
COc1ccc(CCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450970578	GF	On-Demand	Anodyne	A6YCJ1_9METZ	22	42
COC(=O)c1ncccc1S(=O)(=O)NC1CCCCCC1	ZINC000450970597	DD	On-Demand	Anodyne	CCR8	40	31
COC(=O)c1ncccc1S(=O)(=O)NC1CCCCCC1	ZINC000450970597	DD	On-Demand	Anodyne	SFRP1	85	33
COC(=O)c1ncccc1S(=O)(=O)NC1CCCCCC1	ZINC000450970597	DD	On-Demand	Anodyne	WNT3	50	32
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C#N)n3C)c2)CC1	ZINC000450970609	FD	On-Demand	Mild	CSF1R	19	40
CCNC(=O)c1cccc(NC(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450970614	FF	On-Demand	Anodyne	KCNK3	53	37
Cc1cncc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450970623	GE	On-Demand	Anodyne	ALPL	24	42
Cc1cncc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450970623	GE	On-Demand	Anodyne	MTNN	80	40
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(OC)c2)CC1	ZINC000450970636	GD	On-Demand	Anodyne	HTR1A	16	46
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(OC)c2)CC1	ZINC000450970636	GD	On-Demand	Anodyne	DRD4	46	36
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(OC)c2)CC1	ZINC000450970636	GD	On-Demand	Anodyne	HTR7	18	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(OC)c2)CC1	ZINC000450970636	GD	On-Demand	Anodyne	MMP13	16	47
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2cccc(OC)c2)CC1	ZINC000450970636	GD	On-Demand	Anodyne	CCKAR	32	43
CN(C[C@H]1CCCN(CC/C=C\c2ccccc2)C1)S(C)(=O)=O	ZINC000450970644	EF	On-Demand	Anodyne	SLC6A1	69	38
CN(C[C@H]1CCCN(CC/C=C/c2ccccc2)C1)S(C)(=O)=O	ZINC000450970645	EF	On-Demand	Anodyne	SLC6A1	69	38
CN(C[C@@H]1CCCN(CC/C=C/c2ccccc2)C1)S(C)(=O)=O	ZINC000450970646	EF	On-Demand	Anodyne	SLC6A1	69	38
CN(C[C@@H]1CCCN(CC/C=C\c2ccccc2)C1)S(C)(=O)=O	ZINC000450970647	EF	On-Demand	Anodyne	SLC6A1	69	38
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	CA2	43	42
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	PPIA	26	42
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	CA1	50	55
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	CA4	71	55
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	CA9	28	55
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	LEF	30	50
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	CYNT	29	41
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	ALPI	26	41
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	PFK	0	41
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	MTCA1	22	40
Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450970652	EE	On-Demand	Anodyne	A6YCJ1_9METZ	29	40
O=C(CCCN1CCC=C(c2ccco2)C1)c1ccccc1	ZINC000450970653	CI	On-Demand	Anodyne	SLC6A1	15	41
O=C(CCCN1CCC=C(c2ccco2)C1)c1ccccc1	ZINC000450970653	CI	On-Demand	Anodyne	CYP2J2	57	40
CCOC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccccc2OC)cc1	ZINC000450970656	GF	On-Demand	Anodyne	MBTPS1	54	39
Cc1cccc2c1N(C1CC1)CCN2C(=O)[C@H]1OCC[C@H]1C	ZINC000450970667	DF	On-Demand	Anodyne	GPBAR1	40	39
COc1ccc(CC(=O)Nc2cc(C)c(O)c(C)c2)c(Cl)c1OC	ZINC000450970669	EH	On-Demand	Anodyne	ENPP1	55	32
COC(=O)c1ccc(CN2CCC(F)(C#N)CC2)cc1Cl	ZINC000450970676	DF	On-Demand	Mild	ADAM17	16	43
COC(=O)c1ccc(CN2CCC(F)(C#N)CC2)cc1Cl	ZINC000450970676	DF	On-Demand	Mild	MCHR1	18	42
COC(=O)c1ccc(CN2CCC(F)(C#N)CC2)cc1Cl	ZINC000450970676	DF	On-Demand	Mild	MCHR2	48	36
Cc1cc(NC(=O)c2ccnn2CC(F)(F)F)cc(C)c1O	ZINC000450970679	DG	On-Demand	Anodyne	FLT1	23	45
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(C)cc1	ZINC000450970688	ED	On-Demand	Anodyne	BMP1	57	39
O=C(CC(F)(F)F)NC[C@H]1CCCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450970698	FH	On-Demand	Anodyne	CHRM4	15	48
O=C(CC(F)(F)F)NC[C@H]1CCCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450970699	FH	On-Demand	Anodyne	CHRM4	15	48
O=C(CC(F)(F)F)NC[C@@H]1CCCN(C[C@H]2CCCCC2(F)F)C1	ZINC000450970700	FH	On-Demand	Anodyne	CHRM4	15	48
O=C(CC(F)(F)F)NC[C@@H]1CCCN(C[C@@H]2CCCCC2(F)F)C1	ZINC000450970701	FH	On-Demand	Anodyne	CHRM4	15	48
C[C@]1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC=CCC1	ZINC000450970702	GI	On-Demand	Anodyne	RBP4	59	41
C[C@]1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC=CCC1	ZINC000450970702	GI	On-Demand	Anodyne	SCD1	26	43
C[C@]1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC=CCC1	ZINC000450970702	GI	On-Demand	Anodyne	SFRP1	101	39
C[C@]1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC=CCC1	ZINC000450970702	GI	On-Demand	Anodyne	WNT3	63	32
C[C@@]1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC=CCC1	ZINC000450970703	GI	On-Demand	Anodyne	RBP4	59	41
C[C@@]1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC=CCC1	ZINC000450970703	GI	On-Demand	Anodyne	SCD1	26	43
C[C@@]1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC=CCC1	ZINC000450970703	GI	On-Demand	Anodyne	SFRP1	101	39
C[C@@]1(C(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)CC=CCC1	ZINC000450970703	GI	On-Demand	Anodyne	WNT3	63	32
COc1cccc(N2CCN(S(=O)(=O)C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450970706	GF	On-Demand	Anodyne	HTR1A	15	45
COc1cccc(N2CCN(S(=O)(=O)C[C@@H]3CCCCC3(F)F)CC2)c1	ZINC000450970706	GF	On-Demand	Anodyne	DRD4	41	33
COc1cccc(N2CCN(S(=O)(=O)C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450970707	GF	On-Demand	Anodyne	HTR1A	15	45
COc1cccc(N2CCN(S(=O)(=O)C[C@H]3CCCCC3(F)F)CC2)c1	ZINC000450970707	GF	On-Demand	Anodyne	DRD4	41	33
COc1cc(NS(=O)(=O)c2cc(C)cs2)ccc1N1CCCC1=O	ZINC000450970728	FF	On-Demand	Anodyne	GHSR	0	47
COc1cc(NS(=O)(=O)c2cc(C)cs2)ccc1N1CCCC1=O	ZINC000450970728	FF	On-Demand	Anodyne	PKM	25	48
COC(=O)[C@@H](NS(=O)(=O)c1cccc2ccoc12)C(C)C	ZINC000450970734	DD	On-Demand	Anodyne	ADAMTS4	44	36
COC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1F)C(C)C	ZINC000450970739	EE	On-Demand	Anodyne	MMP13	30	46
COC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1F)C(C)C	ZINC000450970739	EE	On-Demand	Anodyne	MMP2	24	44
COC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1F)C(C)C	ZINC000450970739	EE	On-Demand	Anodyne	ADAMTS4	73	44
COC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1F)C(C)C	ZINC000450970739	EE	On-Demand	Anodyne	LEF	28	52
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	F2	26	41
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	BMP1	27	43
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	MMP13	46	56
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	TRY2_BOVIN	50	35
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	MMP2	36	56
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	MMP12	51	40
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	MMP7	23	45
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	ADAMTS4	72	43
COC(=O)[C@@H](NS(=O)(=O)c1ccc2cc(C)ccc2c1)C(C)C	ZINC000450970743	EF	On-Demand	Anodyne	LEF	57	43
O=C1CC[C@H](CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CCN1	ZINC000450970748	FF	On-Demand	Anodyne	PREP	45	37
O=C1CC[C@H](CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CCN1	ZINC000450970748	FF	On-Demand	Anodyne	BIRC2	50	39
O=C1CC[C@@H](CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CCN1	ZINC000450970749	FF	On-Demand	Anodyne	PREP	45	37
O=C1CC[C@@H](CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CCN1	ZINC000450970749	FF	On-Demand	Anodyne	BIRC2	50	39
O=C1CC[C@H](CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CCN1	ZINC000450970751	FF	On-Demand	Anodyne	PREP	45	37
O=C1CC[C@H](CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CCN1	ZINC000450970751	FF	On-Demand	Anodyne	BIRC2	50	39
O=C1CC[C@@H](CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CCN1	ZINC000450970753	FF	On-Demand	Anodyne	PREP	45	37
O=C1CC[C@@H](CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CCN1	ZINC000450970753	FF	On-Demand	Anodyne	BIRC2	50	39
COC(=O)CCNC(=O)CSc1ccc(Br)c(Cl)c1	ZINC000450970765	FF	On-Demand	Anodyne	FAS	47	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	ACE	61	36
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	FKBP1A	41	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	SLC6A1	40	33
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	SIGMAR1	33	46
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	C3AR1	43	34
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	PREP	62	43
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	ABCB1	52	41
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	EPHX2	15	62
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	FKBP12.6	0	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970766	GG	On-Demand	Anodyne	BIRC2	55	47
CCc1cccc(C(=O)N[C@H](C)c2ncn(C)n2)n1	ZINC000450970767	CD	On-Demand	Anodyne	PDE5A	27	42
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	ACE	61	36
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	FKBP1A	41	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	SLC6A1	40	33
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	SIGMAR1	33	46
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	C3AR1	43	34
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	PREP	62	43
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	ABCB1	52	41
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	EPHX2	15	62
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	FKBP12.6	0	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000450970768	GG	On-Demand	Anodyne	BIRC2	55	47
CCc1cccc(C(=O)N[C@@H](C)c2ncn(C)n2)n1	ZINC000450970769	CD	On-Demand	Anodyne	PDE5A	27	42
O=S(=O)(CCC1CCCC1)Nc1ccccc1OCCn1ccnc1	ZINC000450970771	FG	On-Demand	Anodyne	TBXAS1	26	44
O=S(=O)(CCC1CCCC1)Nc1ccccc1OCCn1ccnc1	ZINC000450970771	FG	On-Demand	Anodyne	CAMC	0	40
CC(C)OC(C)(C)C(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450970773	EH	On-Demand	Anodyne	NQO2	22	42
COc1cc(NC(=O)CCCn2nc(C)nc2C)ccc1F	ZINC000450970777	DE	On-Demand	Anodyne	IMPDH2	0	41
COc1cc(NC(=O)CCCn2nc(C)nc2C)ccc1F	ZINC000450970777	DE	On-Demand	Anodyne	ENPP1	63	36
CCN(CC)C(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450970780	FG	On-Demand	Anodyne	LIMK2	42	41
Cc1cc2cc[nH]c2cc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450970795	DH	On-Demand	Anodyne	HRH3	22	41
Cc1cc2cc[nH]c2cc1NC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450970795	DH	On-Demand	Anodyne	LIMK2	23	41
Cc1cc2cc[nH]c2cc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450970796	DH	On-Demand	Anodyne	HRH3	22	41
Cc1cc2cc[nH]c2cc1NC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450970796	DH	On-Demand	Anodyne	LIMK2	23	41
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(C)ccc21	ZINC000450970799	EE	On-Demand	Anodyne	CYP11B2	40	50
Cc1csc(S(=O)(=O)N2CCN(Cc3cc(C)on3)CC2)c1	ZINC000450970816	ED	On-Demand	Anodyne	AURKA	0	42
O=S(=O)(c1sccc1Cl)N1CCN(c2ccccn2)CC1	ZINC000450970821	EE	On-Demand	Anodyne	DRD4	27	40
O=S(=O)(c1sccc1Cl)N1CCN(c2ccccn2)CC1	ZINC000450970821	EE	On-Demand	Anodyne	EBP	26	43
O=S(=O)(CCC1CCCC1)Nc1cccc(N2CCCC2)c1	ZINC000450970838	DH	On-Demand	Anodyne	HTR1A	18	49
O=S(=O)(CCC1CCCC1)Nc1cccc(N2CCCC2)c1	ZINC000450970838	DH	On-Demand	Anodyne	HTR7	19	48
C[C@@H](c1csnn1)N1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450970854	FG	On-Demand	Anodyne	PREP	49	42
C[C@@H](c1csnn1)N1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450970854	FG	On-Demand	Anodyne	BIRC2	53	40
C[C@H](c1csnn1)N1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450970856	FG	On-Demand	Anodyne	PREP	49	42
C[C@H](c1csnn1)N1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000450970856	FG	On-Demand	Anodyne	BIRC2	53	40
C[C@@H](c1csnn1)N1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450970858	FG	On-Demand	Anodyne	PREP	49	42
C[C@@H](c1csnn1)N1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450970858	FG	On-Demand	Anodyne	BIRC2	53	40
C[C@H](c1csnn1)N1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450970860	FG	On-Demand	Anodyne	PREP	49	42
C[C@H](c1csnn1)N1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000450970860	FG	On-Demand	Anodyne	BIRC2	53	40
O=S(=O)(Nc1ccc(N2CCOCC2)cn1)c1sccc1F	ZINC000450970873	ED	On-Demand	Anodyne	STAT6	50	33
COc1cc(NC(=O)c2c(F)ccc(SCC3CC3)c2F)ccc1F	ZINC000450970881	FJ	On-Demand	Anodyne	GRM4	16	47
COc1cc(NC(=O)c2c(F)ccc(SCC3CC3)c2F)ccc1F	ZINC000450970881	FJ	On-Demand	Anodyne	ENPP1	69	33
CN1CCN(CCCSc2ccc(Br)c(Cl)c2)CC1	ZINC000450970889	FH	On-Demand	Anodyne	THRB	0	43
Cc1nn(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970898	FE	On-Demand	Anodyne	CA2	15	49
Cc1nn(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450970898	FE	On-Demand	Anodyne	FPR1	42	39
Cc1csc(S(=O)(=O)N2CCCC[C@@H]2C)c1	ZINC000450970900	CF	On-Demand	Anodyne	AKR1C3	0	43
Cc1csc(S(=O)(=O)N2CCCC[C@H]2C)c1	ZINC000450970903	CF	On-Demand	Anodyne	AKR1C3	0	43
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450970904	EF	On-Demand	Anodyne	PPIA	27	42
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450970904	EF	On-Demand	Anodyne	PFK	0	41
Cn1cc(S(=O)(=O)Nc2ccc3c(c2)OC(F)(F)O3)c(C(F)(F)F)n1	ZINC000450970910	GF	On-Demand	Anodyne	KIF11	17	40
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	MME	76	39
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	ANPEP	48	34
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	PAPA1_CARPA	52	38
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	CYSP_TRYCR	51	35
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	CPA1	44	36
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	CAPN1	40	35
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	CAPN2	46	32
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	ACE2	48	36
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	POL	0	43
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	AMP1_PLAFQ	59	36
CO[C@@H](Cc1ccccc1)C(=O)NC(C)(C)CF	ZINC000450970920	CE	On-Demand	Anodyne	BLAIMP-1	0	40
CO[C@H](C)CS(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1	ZINC000450970921	FG	On-Demand	Anodyne	MAOA	0	41
CO[C@@H](C)CS(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1	ZINC000450970922	FG	On-Demand	Anodyne	MAOA	0	41
CO[C@H](C)CS(=O)(=O)Nc1nc(-c2cccc(F)c2)cs1	ZINC000450970923	EF	On-Demand	Anodyne	MAOA	0	42
CO[C@@H](C)CS(=O)(=O)Nc1nc(-c2cccc(F)c2)cs1	ZINC000450970924	EF	On-Demand	Anodyne	MAOA	0	42
COc1cc(CC(=O)N2CC(OC(F)F)C2)ccc1Cl	ZINC000450970930	DE	On-Demand	Anodyne	OPRK1	40	41
COc1cc(CC(=O)N2CC(OC(F)F)C2)ccc1Cl	ZINC000450970930	DE	On-Demand	Anodyne	CCR1	31	41
COc1cc(CC(=O)N2CC(OC(F)F)C2)ccc1Cl	ZINC000450970930	DE	On-Demand	Anodyne	MLNR	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)(C)C)cs2)cc1	ZINC000450970940	GH	On-Demand	Anodyne	CA2	19	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)(C)C)cs2)cc1	ZINC000450970940	GH	On-Demand	Anodyne	PPIA	24	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)(C)C)cs2)cc1	ZINC000450970940	GH	On-Demand	Anodyne	CA1	24	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)(C)C)cs2)cc1	ZINC000450970940	GH	On-Demand	Anodyne	CA4	24	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)(C)C)cs2)cc1	ZINC000450970940	GH	On-Demand	Anodyne	PFK	0	41
CC[C@H]1CCC[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450970943	DG	On-Demand	Anodyne	CACNA1I	53	35
CC[C@@H]1CCC[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450970944	DG	On-Demand	Anodyne	CACNA1I	53	35
CC[C@H]1CCC[C@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450970945	DG	On-Demand	Anodyne	CACNA1I	53	35
CC[C@@H]1CCC[C@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450970946	DG	On-Demand	Anodyne	CACNA1I	53	35
CC(=O)N1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1	ZINC000450970952	ED	On-Demand	Anodyne	PKM	20	41
COCCOc1ccc(-c2nc(C3CCOCC3)c(C)s2)cc1	ZINC000450970955	EI	On-Demand	Anodyne	PPARD	16	41
CCc1cccc(C(=O)NC(C)(C)CF)n1	ZINC000450970965	BE	On-Demand	Anodyne	PDE5A	0	40
CSc1cccc(C)c1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1	ZINC000450970967	FI	On-Demand	Anodyne	SHH	48	37
C=CCN(CC=C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970971	DF	On-Demand	Mild	CA2	15	55
C=CCN(CC=C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970971	DF	On-Demand	Mild	CA1	17	43
C=CCN(CC=C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970971	DF	On-Demand	Mild	COLA	42	39
C=CCN(CC=C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450970971	DF	On-Demand	Mild	F13A1	47	38
Cc1sc(=NC2CCN(Cc3ccccc3)CC2)[nH]c1C1CCOCC1	ZINC000450970972	FH	On-Demand	Anodyne	DRD4	26	40
Cc1sc(=NC2CCN(Cc3ccccc3)CC2)[nH]c1C1CCOCC1	ZINC000450970972	FH	On-Demand	Anodyne	DRD3	0	40
Cc1sc(=NC2CCN(Cc3ccccc3)CC2)[nH]c1C1CCOCC1	ZINC000450970972	FH	On-Demand	Anodyne	SIGMAR1	49	37
Cc1sc(=NC2CCN(Cc3ccccc3)CC2)[nH]c1C1CCOCC1	ZINC000450970972	FH	On-Demand	Anodyne	SCN5A	41	35
O=C(CC1(O)CCC1)NCC1CCN(CC(F)(F)F)CC1	ZINC000450970982	DD	On-Demand	Anodyne	CACNA1I	55	37
CCOC(=O)c1ccc(CS(=O)(=O)NCC2CCCCC2)cc1	ZINC000450970983	EF	On-Demand	Anodyne	TMPRSS11D	45	32
CCOC(=O)c1sc(NS(=O)(=O)C[C@@H](C)OC)nc1-c1ccccc1	ZINC000450970985	GF	On-Demand	Anodyne	DHODH	32	61
CCOC(=O)c1sc(NS(=O)(=O)C[C@@H](C)OC)nc1-c1ccccc1	ZINC000450970985	GF	On-Demand	Anodyne	ADORA3	0	48
CCOC(=O)c1sc(NS(=O)(=O)C[C@H](C)OC)nc1-c1ccccc1	ZINC000450970986	GF	On-Demand	Anodyne	DHODH	32	61
CCOC(=O)c1sc(NS(=O)(=O)C[C@H](C)OC)nc1-c1ccccc1	ZINC000450970986	GF	On-Demand	Anodyne	ADORA3	0	48
COC(=O)c1ncccc1S(=O)(=O)NCC1CCCCC1	ZINC000450970994	DD	On-Demand	Anodyne	NPY2R	95	42
COC(=O)c1ncccc1S(=O)(=O)NCC1CCCCC1	ZINC000450970994	DD	On-Demand	Anodyne	NPY5R	31	40
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(C)cc2F)cnc1C(F)F	ZINC000450971007	GG	On-Demand	Anodyne	TRPV1	52	34
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(C)cc2F)cnc1C(F)F	ZINC000450971007	GG	On-Demand	Anodyne	TLR4	15	44
COC(=O)c1ccc(-c2csc(CCNC(C)=O)n2)o1	ZINC000450971018	CD	On-Demand	Anodyne	NQO2	45	32
COC(=O)c1ccc(-c2csc(CCNC(C)=O)n2)o1	ZINC000450971018	CD	On-Demand	Anodyne	MTNR1A	49	40
COC(=O)c1ccc(-c2csc(CCNC(C)=O)n2)o1	ZINC000450971018	CD	On-Demand	Anodyne	MTNR1B	41	40
C=CCC1(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)CCCC1	ZINC000450971046	FH	On-Demand	Mild	SIRT3	47	30
C=CCC1(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)CCCC1	ZINC000450971046	FH	On-Demand	Mild	SIRT2	41	32
CC[C@@H](CC(C)C)C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	ZINC000450971047	EG	On-Demand	Anodyne	KCNQ2	49	41
CC[C@H](CC(C)C)C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1	ZINC000450971048	EG	On-Demand	Anodyne	KCNQ2	49	41
Cc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971053	GF	On-Demand	Anodyne	PRTN3	53	34
Cc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971053	GF	On-Demand	Anodyne	FFAR4	26	42
Cc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971053	GF	On-Demand	Anodyne	LUXN	0	44
Cc1ccncc1S(=O)(=O)NCCCNS(=O)(=O)c1cnccc1C	ZINC000450971057	GC	On-Demand	Anodyne	Q95J97_RABIT	0	49
O=C(Nc1ccc2c(c1)OCO2)c1ccccc1NS(=O)(=O)CCCCF	ZINC000450971062	GG	On-Demand	Anodyne	KIT	19	44
O=C(Nc1ccc2c(c1)OCO2)c1ccccc1NS(=O)(=O)CCCCF	ZINC000450971062	GG	On-Demand	Anodyne	BRAF	18	44
Cc1cnc(CCCC(=O)Nc2c(-c3ccccc3)n[nH]c2C)o1	ZINC000450971063	DH	On-Demand	Anodyne	FAAH	52	36
Cc1cnc(CCCC(=O)Nc2c(-c3ccccc3)n[nH]c2C)o1	ZINC000450971063	DH	On-Demand	Anodyne	CES1D	46	33
COC(=O)[C@@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971070	ED	On-Demand	Anodyne	FOLH1	47	37
COC(=O)[C@@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971070	ED	On-Demand	Anodyne	CASP3	31	47
COC(=O)[C@@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971070	ED	On-Demand	Anodyne	CASP1	24	44
COC(=O)[C@@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971070	ED	On-Demand	Anodyne	CAPN2	44	47
COC(=O)[C@@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971070	ED	On-Demand	Anodyne	CASP6	30	44
COC(=O)[C@@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971070	ED	On-Demand	Anodyne	CASP7	0	47
COC(=O)[C@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971071	ED	On-Demand	Anodyne	FOLH1	47	37
COC(=O)[C@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971071	ED	On-Demand	Anodyne	CASP3	31	47
COC(=O)[C@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971071	ED	On-Demand	Anodyne	CASP1	24	44
COC(=O)[C@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971071	ED	On-Demand	Anodyne	CAPN2	44	47
COC(=O)[C@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971071	ED	On-Demand	Anodyne	CASP6	30	44
COC(=O)[C@H](CC(C)C)NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450971071	ED	On-Demand	Anodyne	CASP7	0	47
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971075	EF	On-Demand	Anodyne	P2RY12	27	48
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971075	EF	On-Demand	Anodyne	PDGFRB	52	38
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971075	EF	On-Demand	Anodyne	SIRT3	59	31
CC[C@@H]1C[C@H]1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971075	EF	On-Demand	Anodyne	SIRT2	44	31
CC(=O)c1cn(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)nn1	ZINC000450971076	GD	On-Demand	Anodyne	SIRT3	51	32
CC(=O)c1cn(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)nn1	ZINC000450971076	GD	On-Demand	Anodyne	SIRT2	41	31
CCC[C@H](OC)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971077	EE	On-Demand	Anodyne	P2RY12	27	46
CCC[C@H](OC)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971077	EE	On-Demand	Anodyne	PDGFRB	53	39
CCC[C@H](OC)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971077	EE	On-Demand	Anodyne	SIRT3	52	30
CCC[C@H](OC)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971077	EE	On-Demand	Anodyne	SIRT2	40	30
CCC[C@@H](OC)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971078	EE	On-Demand	Anodyne	P2RY12	27	46
CCC[C@@H](OC)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971078	EE	On-Demand	Anodyne	PDGFRB	53	39
CCC[C@@H](OC)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971078	EE	On-Demand	Anodyne	SIRT3	52	30
CCC[C@@H](OC)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450971078	EE	On-Demand	Anodyne	SIRT2	40	30
CCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450971079	FE	On-Demand	Anodyne	NR1H3	18	52
CCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450971079	FE	On-Demand	Anodyne	NR1H2	20	52
CCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450971079	FE	On-Demand	Anodyne	RORC	37	51
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450971087	FF	On-Demand	Anodyne	NPY2R	66	35
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450971087	FF	On-Demand	Anodyne	PRNP	45	35
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)n(C(C)C)n3)c2)CC1	ZINC000450971087	FF	On-Demand	Anodyne	NPY5R	17	45
Cc1ccn(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)n1	ZINC000450971098	FD	On-Demand	Anodyne	P2RY12	22	50
Cc1ccn(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)n1	ZINC000450971098	FD	On-Demand	Anodyne	PDGFRB	47	35
Cc1ccn(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)n1	ZINC000450971098	FD	On-Demand	Anodyne	SIRT3	47	30
CCOC(=O)c1ccc(NC(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450971103	FG	On-Demand	Anodyne	ACR	57	34
CCOC(=O)c1ccc(NC(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450971103	FG	On-Demand	Anodyne	NOD1	26	45
CCOC(=O)c1ccc(NC(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450971103	FG	On-Demand	Anodyne	NOD2	41	45
CCOC(=O)c1ccccc1NC(=O)Cn1cnc2c1CCCC2	ZINC000450971123	EF	On-Demand	Anodyne	FAS	17	43
C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971124	DF	On-Demand	Anodyne	ACE	28	44
C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971124	DF	On-Demand	Anodyne	ELANE	43	40
C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971124	DF	On-Demand	Anodyne	PREP	62	49
C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971124	DF	On-Demand	Anodyne	XIAP	41	38
C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971124	DF	On-Demand	Anodyne	SFRP1	41	39
C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971124	DF	On-Demand	Anodyne	WNT3	41	31
C[C@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971124	DF	On-Demand	Anodyne	TMPRSS11D	55	36
C[C@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971125	DF	On-Demand	Anodyne	ACE	28	44
C[C@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971125	DF	On-Demand	Anodyne	ELANE	43	40
C[C@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971125	DF	On-Demand	Anodyne	PREP	62	49
C[C@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971125	DF	On-Demand	Anodyne	XIAP	41	38
C[C@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971125	DF	On-Demand	Anodyne	SFRP1	41	39
C[C@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971125	DF	On-Demand	Anodyne	WNT3	41	31
C[C@H]1CC[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)C1	ZINC000450971125	DF	On-Demand	Anodyne	TMPRSS11D	55	36
CCN1CCC[C@H]1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971148	GD	On-Demand	Anodyne	LUXN	0	43
CCN1CCC[C@H]1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971148	GD	On-Demand	Anodyne	ADIPOR1	0	41
CCN1CCC[C@H]1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971148	GD	On-Demand	Anodyne	ADIPOR2	0	41
CCN1CCC[C@@H]1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971149	GD	On-Demand	Anodyne	LUXN	0	43
CCN1CCC[C@@H]1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971149	GD	On-Demand	Anodyne	ADIPOR1	0	41
CCN1CCC[C@@H]1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971149	GD	On-Demand	Anodyne	ADIPOR2	0	41
CCCCO[C@H]1C[C@@H](NCc2cn(CC3CC3)nn2)C1(C)C	ZINC000450971150	DF	On-Demand	Anodyne	GBA	20	43
CCCCO[C@H]1C[C@H](NCc2cn(CC3CC3)nn2)C1(C)C	ZINC000450971151	DF	On-Demand	Anodyne	GBA	20	43
CCCCO[C@@H]1C[C@@H](NCc2cn(CC3CC3)nn2)C1(C)C	ZINC000450971153	DF	On-Demand	Anodyne	GBA	20	43
CCCCO[C@@H]1C[C@H](NCc2cn(CC3CC3)nn2)C1(C)C	ZINC000450971155	DF	On-Demand	Anodyne	GBA	20	43
CCCCc1nnc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)s1	ZINC000450971164	FG	On-Demand	Anodyne	CA1	33	40
CCCCc1nnc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)s1	ZINC000450971164	FG	On-Demand	Anodyne	CA4	54	40
COCCO[C@H]1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450971173	GF	On-Demand	Anodyne	HRH4	25	45
COCCO[C@@H]1CCN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450971176	GF	On-Demand	Anodyne	HRH4	25	45
CCN1CCC(NS(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450971187	EF	On-Demand	Anodyne	SFRP1	67	36
CCN1CCC(NS(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450971187	EF	On-Demand	Anodyne	WNT3	40	30
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	CA2	24	53
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	AVPR1B	19	47
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	LTA4H	22	40
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	PTGER1	0	41
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	BMP1	148	53
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	CA1	45	36
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	CA7	15	43
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP13	113	45
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	ADAM17	54	45
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	COLA	49	44
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP16	0	43
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	CA14	19	43
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MTNR1A	17	48
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MTNR1B	15	48
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP2	78	52
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP3	73	52
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP8	81	52
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP14	21	46
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	NPY5R	25	46
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP9	98	52
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP12	64	52
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	PLAU	29	40
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	CA12	29	53
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP7	46	42
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	ADAMTS4	47	38
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	CA9	36	53
COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450971194	GG	On-Demand	Anodyne	MMP1	91	52
CCC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971203	ED	On-Demand	Anodyne	MMP13	29	41
CCC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971203	ED	On-Demand	Anodyne	PRTN3	52	34
CCC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971203	ED	On-Demand	Anodyne	ADAMTS4	41	32
CCC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971203	ED	On-Demand	Anodyne	TRAR	33	41
CCOC(=O)c1cc(S(=O)(=O)NC2CCN(CC)CC2)cnc1C(F)F	ZINC000450971214	GD	On-Demand	Anodyne	SSTR5	41	33
CCOC(=O)c1cc(S(=O)(=O)NC2CCN(CC)CC2)cnc1C(F)F	ZINC000450971214	GD	On-Demand	Anodyne	SFRP1	54	35
COc1cccc(CN(C)S(=O)(=O)c2cnccc2C)c1	ZINC000450971223	DE	On-Demand	Anodyne	ROCK1	28	42
C[C@@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971226	GI	On-Demand	Anodyne	RBP4	62	41
C[C@@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971226	GI	On-Demand	Anodyne	CCR8	41	32
C[C@@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971226	GI	On-Demand	Anodyne	SCD1	21	43
C[C@@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971226	GI	On-Demand	Anodyne	SFRP1	121	41
C[C@@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971226	GI	On-Demand	Anodyne	WNT3	83	34
C[C@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971227	GI	On-Demand	Anodyne	RBP4	62	41
C[C@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971227	GI	On-Demand	Anodyne	CCR8	41	32
C[C@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971227	GI	On-Demand	Anodyne	SCD1	21	43
C[C@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971227	GI	On-Demand	Anodyne	SFRP1	121	41
C[C@H]1CCC[C@@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971227	GI	On-Demand	Anodyne	WNT3	83	34
C[C@@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971228	GI	On-Demand	Anodyne	RBP4	62	41
C[C@@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971228	GI	On-Demand	Anodyne	CCR8	41	32
C[C@@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971228	GI	On-Demand	Anodyne	SCD1	21	43
C[C@@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971228	GI	On-Demand	Anodyne	SFRP1	121	41
C[C@@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971228	GI	On-Demand	Anodyne	WNT3	83	34
C[C@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971229	GI	On-Demand	Anodyne	RBP4	62	41
C[C@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971229	GI	On-Demand	Anodyne	CCR8	41	32
C[C@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971229	GI	On-Demand	Anodyne	SCD1	21	43
C[C@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971229	GI	On-Demand	Anodyne	SFRP1	121	41
C[C@H]1CCC[C@]1(C)C(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000450971229	GI	On-Demand	Anodyne	WNT3	83	34
COC(=O)COc1ccc(CN(C)C(=O)[C@H](C)OCc2ccc(F)cc2)cc1	ZINC000450971230	GF	On-Demand	Anodyne	MTTP	40	36
COC(=O)COc1ccc(CN(C)C(=O)[C@@H](C)OCc2ccc(F)cc2)cc1	ZINC000450971231	GF	On-Demand	Anodyne	MTTP	40	36
CN(C)S(=O)(=O)[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450971240	DE	On-Demand	Anodyne	SLC6A1	78	39
CN(C)S(=O)(=O)[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450971241	DE	On-Demand	Anodyne	SLC6A1	78	39
CN(C)S(=O)(=O)[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450971242	DE	On-Demand	Anodyne	SLC6A1	78	39
CN(C)S(=O)(=O)[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450971243	DE	On-Demand	Anodyne	SLC6A1	78	39
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCOc3ccccc32)c1	ZINC000450971244	FG	On-Demand	Anodyne	PKM	31	43
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)c1	ZINC000450971248	FG	On-Demand	Anodyne	PKM	18	42
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)c1	ZINC000450971248	FG	On-Demand	Anodyne	GPR119	0	46
COC(=O)C1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450971252	FD	On-Demand	Mild	EPHX2	40	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncc(C(C)(C)C)s2)cc1	ZINC000450971254	GH	On-Demand	Anodyne	CA2	19	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncc(C(C)(C)C)s2)cc1	ZINC000450971254	GH	On-Demand	Anodyne	CA1	23	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncc(C(C)(C)C)s2)cc1	ZINC000450971254	GH	On-Demand	Anodyne	CA4	26	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncc(C(C)(C)C)s2)cc1	ZINC000450971254	GH	On-Demand	Anodyne	LEF	24	40
C=CCN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971264	GF	On-Demand	Mild	LUXN	0	47
C=CCN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971264	GF	On-Demand	Mild	ADIPOR1	0	45
C=CCN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971264	GF	On-Demand	Mild	ADIPOR2	0	45
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	CHRM5	18	45
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	MMP13	75	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	ADAM17	64	40
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	MMP2	36	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	MMP3	64	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	MMP8	24	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	MMP9	35	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	EPHX2	43	59
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	TGM2	73	43
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	MMP7	66	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	MMP1	69	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	F13A1	71	39
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	LUXN	0	44
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	ADIPOR1	0	47
COC(=O)C1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450971265	GC	On-Demand	Anodyne	ADIPOR2	0	47
CC(C)(CNC(=O)c1ccc(N2CCC2)nc1)C1=CCCCC1	ZINC000450971266	DH	On-Demand	Anodyne	HPGDS	15	42
CCC(C)(C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971271	DF	On-Demand	Anodyne	CA1	30	47
CCC(C)(C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971271	DF	On-Demand	Anodyne	CA4	26	42
CCC(C)(C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971271	DF	On-Demand	Anodyne	P96878_MYCTU	40	37
O=S(=O)(Nc1cccnc1N1CCCCC1)c1sccc1Cl	ZINC000450971273	FH	On-Demand	Anodyne	GRM4	16	43
Cc1cc(N(C)C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971277	GG	On-Demand	Anodyne	CA1	15	40
Cc1cc(N(C)C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971277	GG	On-Demand	Anodyne	LEF	43	33
COC(=O)c1ccccc1NC(=O)Cn1cnc2c1CCCC2	ZINC000450971279	DE	On-Demand	Anodyne	FAS	72	54
CCN(CC)CCNC(=O)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450971301	GG	On-Demand	Anodyne	KCNQ1	0	43
CCN(CC)CCNC(=O)c1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450971301	GG	On-Demand	Anodyne	LDLR	0	40
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971302	FG	On-Demand	Anodyne	HTR4	40	35
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971302	FG	On-Demand	Anodyne	CACNA1I	57	37
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971302	FG	On-Demand	Anodyne	HPGDS	30	41
CCN(CC)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450971310	GG	On-Demand	Anodyne	CA2	16	47
CCN(CC)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450971310	GG	On-Demand	Anodyne	ADRB2	20	43
CCN(CC)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450971310	GG	On-Demand	Anodyne	ADRB3	17	43
CCN(CC)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450971310	GG	On-Demand	Anodyne	CA1	19	40
COc1ccc(C)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971317	GE	On-Demand	Anodyne	KCNA5	0	40
COc1ccc(C)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971317	GE	On-Demand	Anodyne	PRTN3	54	33
COc1ccc(C)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971317	GE	On-Demand	Anodyne	LUXN	0	44
COCCO[C@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450971325	DE	On-Demand	Anodyne	L3MBTL3	45	33
COCCO[C@@H]1CCN(C(=O)c2ccc(C)c3c2CCC3)C1	ZINC000450971328	DE	On-Demand	Anodyne	L3MBTL3	45	33
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOCC2)c1	ZINC000450971329	ED	On-Demand	Anodyne	CNR1	0	51
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOCC2)c1	ZINC000450971329	ED	On-Demand	Anodyne	CNR2	0	53
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1C(=O)NCC(C)C	ZINC000450971344	GE	On-Demand	Anodyne	KCNA5	0	46
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1C(=O)NCC(C)C	ZINC000450971344	GE	On-Demand	Anodyne	BDKRB1	0	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1C(=O)NCC(C)C	ZINC000450971344	GE	On-Demand	Anodyne	PRTN3	54	41
O=C(c1cccc(NS(=O)(=O)c2sccc2F)c1)N1CCCC1	ZINC000450971352	FF	On-Demand	Anodyne	RHOA	0	41
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1cc2cccnc2s1	ZINC000450971354	EI	On-Demand	Anodyne	GPBAR1	52	42
O=C(c1ccccc1NS(=O)(=O)c1sccc1F)N1CCCCC1	ZINC000450971369	FG	On-Demand	Anodyne	PRTN3	46	34
COc1ccccc1Oc1ccc(C(=O)NC(C)(C)CF)nc1	ZINC000450971382	DG	On-Demand	Anodyne	PDGFRA	47	33
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CF)ccc21	ZINC000450971384	EH	On-Demand	Anodyne	DRD2	17	41
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CF)ccc21	ZINC000450971384	EH	On-Demand	Anodyne	DRD3	26	41
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CF)ccc21	ZINC000450971384	EH	On-Demand	Anodyne	PDGFRB	0	47
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CF)ccc21	ZINC000450971384	EH	On-Demand	Anodyne	CPT1A	48	33
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CF)ccc21	ZINC000450971384	EH	On-Demand	Anodyne	PLK1	54	38
COc1ccccc1-n1cnc2cc(C(=O)NC(C)(C)CF)ccc21	ZINC000450971384	EH	On-Demand	Anodyne	HPGD	49	59
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccnn2CC(C)C)c1	ZINC000450971395	GG	On-Demand	Anodyne	OXTR	36	40
C=CC(C)(C)C(=O)NCCc1cn(C)c2cc(Cl)ccc12	ZINC000450971396	DH	On-Demand	Mild	NQO2	22	41
CC(F)(F)CCS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450971397	DF	On-Demand	Anodyne	AKR1C3	29	53
COc1ccc(OC(F)(F)F)c(C(=O)N2CC(OC(F)F)C2)c1	ZINC000450971408	EF	On-Demand	Anodyne	SLC6A9	24	43
CCOc1ccc(NS(=O)(=O)c2cnc(O)s2)cc1OC	ZINC000450971441	EE	On-Demand	Anodyne	ENPP1	48	32
COc1cccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450971444	DG	On-Demand	Anodyne	KCNA5	25	53
COc1cccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450971444	DG	On-Demand	Anodyne	IAP	0	44
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	CA2	26	52
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	ADRB2	17	43
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	ADRB1	15	43
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	PPIA	31	42
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	CA1	34	52
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	MMP13	26	44
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	BDKRB1	0	45
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	GRM4	19	42
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	MMP2	20	40
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	PRTN3	59	38
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	CA12	19	52
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	ADAMTS4	46	33
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	CA9	21	43
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	LIMK2	41	34
CCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450971445	FG	On-Demand	Anodyne	MTCA1	19	43
O=S(=O)(Cc1ccc(Br)c(F)c1)NCCCn1ccnc1	ZINC000450971447	GE	On-Demand	Anodyne	CYP19A1	15	46
O=S(=O)(Cc1ccc(Br)c(F)c1)NCCCn1ccnc1	ZINC000450971447	GE	On-Demand	Anodyne	TBXAS1	47	44
O=S(=O)(Cc1ccc(Br)c(F)c1)NCCCn1ccnc1	ZINC000450971447	GE	On-Demand	Anodyne	CYP17A1	22	45
O=S(=O)(Cc1ccc(Br)c(F)c1)NCCCn1ccnc1	ZINC000450971447	GE	On-Demand	Anodyne	HMOX2	49	37
CC1(C)[C@H]2CC[C@@]1(C(=O)NCC1CCN(CC(F)(F)F)CC1)C(=O)C2	ZINC000450971450	FF	On-Demand	Anodyne	CACNA1I	54	39
CO[C@H](Cc1ccccc1)CS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450971465	FF	On-Demand	Anodyne	AKR1C3	25	46
CCOC(=O)c1cc(S(=O)(=O)Nc2ccccc2N(C)C)cnc1C(F)F	ZINC000450971466	GG	On-Demand	Anodyne	PRTN3	46	35
CO[C@@H](Cc1ccccc1)CS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450971467	FF	On-Demand	Anodyne	AKR1C3	25	46
CN(C)CC(C)(C)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971468	GD	On-Demand	Anodyne	LUXN	0	47
CC(=O)N[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)C(C)(C)C	ZINC000450971470	DG	On-Demand	Anodyne	IMDH_CRYPV	49	34
CC(=O)N[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)C(C)(C)C	ZINC000450971470	DG	On-Demand	Anodyne	KCNK3	52	36
CC(=O)N[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)C(C)(C)C	ZINC000450971470	DG	On-Demand	Anodyne	KCNK9	54	36
COc1cccc(OCCOc2cccc3c2C(=O)CC3)c1	ZINC000450971472	CG	On-Demand	Anodyne	ABCB1	0	43
Cc1cc(C(=O)Nc2cccc(C(C)(F)F)c2)nn1C(C)C	ZINC000450971474	DI	On-Demand	Anodyne	NPY5R	21	54
Cc1cc(C(=O)Nc2cccc(C(C)(F)F)c2)nn1C(C)C	ZINC000450971474	DI	On-Demand	Anodyne	KCNK3	69	36
Cc1cc(C(=O)Nc2cccc(C(C)(F)F)c2)nn1C(C)C	ZINC000450971474	DI	On-Demand	Anodyne	KCNK9	60	36
Cc1csc(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)c1	ZINC000450971505	ED	On-Demand	Anodyne	LPL	43	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2)cc1	ZINC000450971506	EE	On-Demand	Anodyne	ADRB2	36	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2)cc1	ZINC000450971506	EE	On-Demand	Anodyne	ADRB3	67	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2)cc1	ZINC000450971506	EE	On-Demand	Anodyne	TBXA2R	24	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2)cc1	ZINC000450971506	EE	On-Demand	Anodyne	TBXAS1	35	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2)cc1	ZINC000450971506	EE	On-Demand	Anodyne	MMP13	29	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2cccnc2)cc1	ZINC000450971506	EE	On-Demand	Anodyne	NAMPT	94	55
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	CA2	19	46
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	ADRB1	15	44
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	CA1	26	42
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	MMP13	36	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	CA14	16	42
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	MMP12	58	38
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	ALPL	27	43
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	ADAMTS4	41	34
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450971507	GG	On-Demand	Anodyne	ENPP1	61	33
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2F)CC1	ZINC000450971508	GD	On-Demand	Anodyne	DRD2	17	42
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2F)CC1	ZINC000450971508	GD	On-Demand	Anodyne	DRD3	19	42
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2F)CC1	ZINC000450971508	GD	On-Demand	Anodyne	HTR7	17	43
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2F)CC1	ZINC000450971508	GD	On-Demand	Anodyne	HSD11B1	15	54
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2F)CC1	ZINC000450971508	GD	On-Demand	Anodyne	PKM	32	40
Cc1cc2c(N3CCN(C(=O)C(C)(C)C4CCC4)CC3)ncnc2s1	ZINC000450971512	FG	On-Demand	Anodyne	P2RY12	15	43
Cc1cc2c(N3CCN(C(=O)C(C)(C)C4CCC4)CC3)ncnc2s1	ZINC000450971512	FG	On-Demand	Anodyne	SIRT3	58	34
Cc1cc2c(N3CCN(C(=O)C(C)(C)C4CCC4)CC3)ncnc2s1	ZINC000450971512	FG	On-Demand	Anodyne	SIRT2	52	34
Cc1cc2c(N3CCN(C(=O)C(C)(C)C4CCC4)CC3)ncnc2s1	ZINC000450971512	FG	On-Demand	Anodyne	SIRT1	50	32
COC(=O)c1ncccc1S(=O)(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450971520	FF	On-Demand	Anodyne	GRIN2B	75	42
COC(=O)c1ncccc1S(=O)(=O)N1CCC(Cc2ccccc2)CC1	ZINC000450971520	FF	On-Demand	Anodyne	CCR3	46	41
CSc1cccc(C)c1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450971522	GI	On-Demand	Anodyne	RORC	56	33
CCOC(=O)c1cc(S(=O)(=O)N(CC)Cc2ccccc2)cnc1C(F)F	ZINC000450971547	GG	On-Demand	Anodyne	MMP13	16	40
CCOC(=O)c1cc(S(=O)(=O)N(CC)Cc2ccccc2)cnc1C(F)F	ZINC000450971547	GG	On-Demand	Anodyne	ADAM17	18	40
CCOC(=O)c1cc(S(=O)(=O)N(CC)Cc2ccccc2)cnc1C(F)F	ZINC000450971547	GG	On-Demand	Anodyne	MMP1	16	40
COc1cccc(F)c1-c1nc(C2CCC2)cs1	ZINC000450971549	CI	On-Demand	Anodyne	RPS6KA2	30	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccn2)cc1	ZINC000450971554	EE	On-Demand	Anodyne	CA5A	22	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccn2)cc1	ZINC000450971554	EE	On-Demand	Anodyne	GRM4	30	44
CCOc1ccc(-c2csc(-c3c(C)noc3C)n2)cc1	ZINC000450971558	DI	On-Demand	Anodyne	BRD4	28	47
CCOc1ccc(-c2csc(-c3c(C)noc3C)n2)cc1	ZINC000450971558	DI	On-Demand	Anodyne	SREBF2	0	42
CCOc1cc(C(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)on1	ZINC000450971561	FE	On-Demand	Anodyne	P2RY12	26	48
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2ccnn2C)c(F)c1	ZINC000450971562	GD	On-Demand	Anodyne	SCN9A	0	41
Cc1noc(C)c1-c1nc(-c2ccc(NC(=O)C(C)(C)C)cc2)cs1	ZINC000450971570	FK	On-Demand	Anodyne	SREBF2	0	43
NC(=O)C1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450971575	ED	On-Demand	Anodyne	LPL	43	32
NC(=O)C1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450971575	ED	On-Demand	Anodyne	EPHX2	23	40
Cc1noc(C)c1-c1nc(-c2ccc(NC(=O)CC(C)C)cc2)cs1	ZINC000450971610	FK	On-Demand	Anodyne	SREBF2	0	42
COC(=O)c1ncccc1S(=O)(=O)NCCCc1ccccc1	ZINC000450971614	ED	On-Demand	Anodyne	TBXAS1	42	43
COC(=O)c1ncccc1S(=O)(=O)NCCCc1ccccc1	ZINC000450971614	ED	On-Demand	Anodyne	FAAH	39	40
COC(=O)c1ncccc1S(=O)(=O)NCCCc1ccccc1	ZINC000450971614	ED	On-Demand	Anodyne	CES1	48	40
CCc1nc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)sc1C	ZINC000450971615	GE	On-Demand	Anodyne	LUXN	0	42
CC(=O)N[C@H](C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1)C(C)(C)C	ZINC000450971619	GE	On-Demand	Anodyne	SIRT3	49	32
Cc1csc(S(=O)(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)c1	ZINC000450971627	FG	On-Demand	Anodyne	UTS2R	31	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)c2cccnc2)cc1	ZINC000450971642	EF	On-Demand	Anodyne	COLA	41	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)c2cccnc2)cc1	ZINC000450971642	EF	On-Demand	Anodyne	NAMPT	59	39
CN(C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)c1ccn(C)n1	ZINC000450971649	DG	On-Demand	Anodyne	PRCP	48	37
CN(C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1ccn(C)n1	ZINC000450971650	DG	On-Demand	Anodyne	PRCP	48	37
CN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)c1ccn(C)n1	ZINC000450971651	DG	On-Demand	Anodyne	PRCP	48	37
CN(C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1ccn(C)n1	ZINC000450971652	DG	On-Demand	Anodyne	PRCP	48	37
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	MMP13	65	43
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	CCR5	36	43
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	ADAM17	38	43
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	MMP2	40	42
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	MMP3	45	42
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	MMP14	24	41
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	MMP9	45	43
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	ADAMTS4	42	41
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	MMP1	42	43
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	TNKS	57	33
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	LUXN	0	50
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	ADIPOR1	0	45
C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971687	GF	On-Demand	Anodyne	ADIPOR2	0	45
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	MMP13	65	43
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	CCR5	36	43
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	ADAM17	38	43
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	MMP2	40	42
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	MMP3	45	42
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	MMP14	24	41
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	MMP9	45	43
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	ADAMTS4	42	41
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	MMP1	42	43
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	TNKS	57	33
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	LUXN	0	50
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	ADIPOR1	0	45
C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971688	GF	On-Demand	Anodyne	ADIPOR2	0	45
Cc1csc(S(=O)(=O)Nc2cccc(N3CCCC3)c2)c1	ZINC000450971689	DG	On-Demand	Anodyne	GHSR	16	46
COc1cccc(-n2cc(C(=O)N[C@H]3CC[C@@H](C)C3)nn2)c1	ZINC000450971690	DE	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@@H]3CC[C@H](C)C3)nn2)c1	ZINC000450971691	DE	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@H]3CC[C@H](C)C3)nn2)c1	ZINC000450971692	DE	On-Demand	Anodyne	DRD4	43	33
COc1cccc(-n2cc(C(=O)N[C@@H]3CC[C@@H](C)C3)nn2)c1	ZINC000450971693	DE	On-Demand	Anodyne	DRD4	43	33
C[C@H](OCCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450971711	FG	On-Demand	Anodyne	TIMP3	40	32
C[C@H](OCCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450971711	FG	On-Demand	Anodyne	AMY2	44	30
C[C@H](OCCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450971712	FG	On-Demand	Anodyne	TIMP3	40	32
C[C@H](OCCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450971712	FG	On-Demand	Anodyne	AMY2	44	30
C[C@H](OCCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450971713	FG	On-Demand	Anodyne	TIMP3	40	32
C[C@H](OCCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450971713	FG	On-Demand	Anodyne	AMY2	44	30
C[C@H](OCCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450971714	FG	On-Demand	Anodyne	TIMP3	40	32
C[C@H](OCCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450971714	FG	On-Demand	Anodyne	AMY2	44	30
O=S(=O)(Nc1cccc(N2CCCC2)c1)c1sccc1F	ZINC000450971719	EG	On-Demand	Anodyne	GHSR	0	52
CC(=O)N[C@@H](C)C1CCN(C(=O)Cc2scnc2-c2ccccc2)CC1	ZINC000450971722	FG	On-Demand	Anodyne	VHL	56	32
CC(=O)N[C@H](C)C1CCN(C(=O)Cc2scnc2-c2ccccc2)CC1	ZINC000450971723	FG	On-Demand	Anodyne	VHL	56	32
CC(=O)c1cccc(CN(C)Cc2ccc(OCC(F)(F)F)cc2)c1	ZINC000450971729	FI	On-Demand	Anodyne	ACHE	0	44
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	ADAM17	24	40
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	MMP2	22	41
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	PRTN3	44	30
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	ADAMTS4	54	38
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	GPR119	0	42
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	LIMK2	47	41
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	LUXN	0	46
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	ADIPOR1	0	44
COCc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450971731	GE	On-Demand	Anodyne	ADIPOR2	0	44
CN(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccn1	ZINC000450971737	GD	On-Demand	Anodyne	LUXN	0	43
COCCO[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450971742	DF	On-Demand	Anodyne	EPHX2	15	41
COCCO[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450971743	DF	On-Demand	Anodyne	EPHX2	15	41
COCCO[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)C1	ZINC000450971744	DF	On-Demand	Anodyne	EPHX2	15	41
COCCO[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2c2ccccc2)C1	ZINC000450971745	DF	On-Demand	Anodyne	EPHX2	15	41
CN(CCc1ccccc1[N+](=O)[O-])CC1(C#N)CCC1	ZINC000450971748	CF	On-Demand	Mild	COLA	82	35
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC(F)F)cc1	ZINC000450971750	GE	On-Demand	Anodyne	BMP1	95	37
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC(F)F)cc1	ZINC000450971750	GE	On-Demand	Anodyne	MMP13	36	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC(F)F)cc1	ZINC000450971750	GE	On-Demand	Anodyne	MMP2	23	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC(F)F)cc1	ZINC000450971750	GE	On-Demand	Anodyne	MMP3	24	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC(F)F)cc1	ZINC000450971750	GE	On-Demand	Anodyne	MMP8	28	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC(F)F)cc1	ZINC000450971750	GE	On-Demand	Anodyne	MMP9	39	41
Cc1cc(NC(=O)[C@@H](C)OCc2ccc(F)cc2)cc(C)c1O	ZINC000450971751	DH	On-Demand	Anodyne	LEF	69	36
Cc1cc(NC(=O)[C@H](C)OCc2ccc(F)cc2)cc(C)c1O	ZINC000450971752	DH	On-Demand	Anodyne	LEF	69	36
COC(=O)c1coc(CN(Cc2ccc(F)cc2Cl)CC2CC2)n1	ZINC000450971763	FH	On-Demand	Anodyne	P2RX7	40	36
COCCO[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)C1	ZINC000450971768	FG	On-Demand	Anodyne	LIPG	58	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	CA2	40	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	PPIA	24	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	CA6	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	CA1	49	55
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	CA4	70	55
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	CA9	26	55
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	LEF	19	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	CYNT	28	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	NCE103	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	PFK	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	MTCA2	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1	ZINC000450971773	FG	On-Demand	Anodyne	A6YCJ1_9METZ	29	40
CN(CCN1CC=C(c2ccnn2C)CC1)Cc1ccccc1	ZINC000450971778	DF	On-Demand	Anodyne	SIGMAR1	16	41
C[C@@H](O)CN1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450971784	ED	On-Demand	Anodyne	P2RY12	45	35
C[C@@H](O)CN1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1	ZINC000450971784	ED	On-Demand	Anodyne	P2RX3	22	45
CC(C)(C(=O)NCC1CCN(CC(F)(F)F)CC1)C1CCC1	ZINC000450971790	DG	On-Demand	Anodyne	CACNA1I	40	37
CCOC(=O)c1ccc(CS(=O)(=O)NCc2ccncc2)cc1	ZINC000450971806	ED	On-Demand	Anodyne	TMPRSS11D	40	32
CC(C)c1nnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450971809	GE	On-Demand	Anodyne	CA4	47	41
CC(C)c1nnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450971809	GE	On-Demand	Anodyne	LUXN	0	44
CCn1nccc1NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1	ZINC000450971817	EF	On-Demand	Anodyne	OXTR	47	42
CC(C)c1nnc(NS(=O)(=O)c2sccc2F)s1	ZINC000450971818	DF	On-Demand	Anodyne	CA4	40	37
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1cc(C)cs1	ZINC000450971828	FF	On-Demand	Anodyne	MTNR1A	25	44
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1cc(C)cs1	ZINC000450971828	FF	On-Demand	Anodyne	MTNR1B	22	44
Cc1nc(C2CC2)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971831	FG	On-Demand	Anodyne	HTR4	55	38
Cc1nc(C2CC2)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971831	FG	On-Demand	Anodyne	CACNA1I	61	39
CC(C)(CF)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450971839	DH	On-Demand	Anodyne	FFAR1	0	45
CC(C)(CF)NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000450971839	DH	On-Demand	Anodyne	GPR88	0	40
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	CA2	21	57
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	BMP1	56	38
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	CA1	30	57
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	KCNA5	29	42
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP13	55	48
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	COLA	25	40
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	CPT1A	25	40
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	CA4	15	47
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	CA14	15	40
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MTNR1A	24	47
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MTNR1B	28	53
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP2	42	48
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP3	29	47
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP8	28	47
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP14	15	44
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	PRTN3	54	34
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP9	25	47
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP12	61	46
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	CA12	30	43
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP7	29	46
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	ADAMTS4	41	35
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	CA9	29	41
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MMP1	16	47
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	LEF	27	47
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	IDO1	32	45
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	FFAR4	25	41
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	AKR1C2	52	37
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	MTCA1	16	46
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450971842	GG	On-Demand	Anodyne	P96878_MYCTU	19	46
CCCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450971844	EE	On-Demand	Anodyne	PTGER2	22	40
CCCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450971844	EE	On-Demand	Anodyne	BMP1	29	40
CCCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450971844	EE	On-Demand	Anodyne	MMP8	22	44
CCCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450971844	EE	On-Demand	Anodyne	MMP9	22	44
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450971858	FF	On-Demand	Anodyne	EPHX2	39	45
CCOC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450971858	FF	On-Demand	Anodyne	CCR8	49	35
CO[C@H]1C[C@@H](CN2CCCC2)N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450971863	EF	On-Demand	Anodyne	DRD4	0	42
CO[C@H]1C[C@@H](CN2CCCC2)N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450971863	EF	On-Demand	Anodyne	SLC18A3	0	40
CO[C@H]1C[C@@H](CN2CCCC2)N(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450971863	EF	On-Demand	Anodyne	CYP2J2	47	35
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ccccn4)CC3)ccc2c1	ZINC000450971866	FG	On-Demand	Anodyne	DRD4	26	41
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ccccn4)CC3)ccc2c1	ZINC000450971866	FG	On-Demand	Anodyne	HSD11B1	18	55
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ccccn4)CC3)ccc2c1	ZINC000450971866	FG	On-Demand	Anodyne	PKM	32	45
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ccccn4)CC3)ccc2c1	ZINC000450971866	FG	On-Demand	Anodyne	TGM2	15	52
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ccccn4)CC3)ccc2c1	ZINC000450971866	FG	On-Demand	Anodyne	GCK	44	37
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ccccn4)CC3)ccc2c1	ZINC000450971866	FG	On-Demand	Anodyne	F13A1	16	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCN(C)CC2)cc1	ZINC000450971867	ED	On-Demand	Anodyne	LPL	50	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCN(C)CC2)cc1	ZINC000450971867	ED	On-Demand	Anodyne	TGM2	73	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCN(C)CC2)cc1	ZINC000450971867	ED	On-Demand	Anodyne	F13A1	108	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCN(C)CC2)cc1	ZINC000450971867	ED	On-Demand	Anodyne	NAMPT	38	47
Cc1ccncc1S(=O)(=O)NCCCn1ccnc1	ZINC000450971892	CC	On-Demand	Anodyne	TBXAS1	45	42
Cc1ccncc1S(=O)(=O)NCCCn1ccnc1	ZINC000450971892	CC	On-Demand	Anodyne	HMOX2	46	35
Cc1ccncc1S(=O)(=O)NCCCn1ccnc1	ZINC000450971892	CC	On-Demand	Anodyne	QPCT	42	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N(C)C)nc2)cc1	ZINC000450971893	FF	On-Demand	Anodyne	CA4	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N(C)C)nc2)cc1	ZINC000450971893	FF	On-Demand	Anodyne	GRM4	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCn2ccnc2)cc1	ZINC000450971905	FD	On-Demand	Anodyne	TBXAS1	60	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCn2ccnc2)cc1	ZINC000450971905	FD	On-Demand	Anodyne	HMOX2	47	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCn2ccnc2)cc1	ZINC000450971905	FD	On-Demand	Anodyne	QPCT	48	46
CCOC(=O)COc1cccc(-c2nc(C3CCOCC3)c(C)s2)c1	ZINC000450971913	FH	On-Demand	Anodyne	COLA	43	37
CCc1cccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c1	ZINC000450971917	EF	On-Demand	Anodyne	NR1I2	48	36
C=C(C)CN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450971919	FD	On-Demand	Mild	LUXN	0	43
Cn1nc(C(=O)NCCc2cn(C)c3cc(Cl)ccc23)c2c1CCCC2	ZINC000450971927	FG	On-Demand	Anodyne	CNR1	53	32
C[C@@H]1CCCCN1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450971932	ED	On-Demand	Anodyne	FKBP1A	28	40
C[C@H]1CCCCN1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450971933	ED	On-Demand	Anodyne	FKBP1A	28	40
C=CC(C)(C)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971947	CF	On-Demand	Mild	CACNA1I	59	39
N#CCc1ccc(S(=O)(=O)Nc2ccc(N3CCCCC3)nc2)c(Cl)c1	ZINC000450971949	GH	On-Demand	Mild	PAK1	42	34
CCO[C@@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C12CCCC2	ZINC000450971958	FE	On-Demand	Anodyne	CA7	26	45
CCO[C@@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C12CCCC2	ZINC000450971958	FE	On-Demand	Anodyne	CA9	18	40
CCO[C@@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C12CCCC2	ZINC000450971959	FE	On-Demand	Anodyne	CA7	26	45
CCO[C@@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C12CCCC2	ZINC000450971959	FE	On-Demand	Anodyne	CA9	18	40
CCO[C@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C12CCCC2	ZINC000450971962	FE	On-Demand	Anodyne	CA7	26	45
CCO[C@H]1C[C@H](NCCOc2ccc(S(N)(=O)=O)cc2)C12CCCC2	ZINC000450971962	FE	On-Demand	Anodyne	CA9	18	40
CCO[C@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C12CCCC2	ZINC000450971965	FE	On-Demand	Anodyne	CA7	26	45
CCO[C@H]1C[C@@H](NCCOc2ccc(S(N)(=O)=O)cc2)C12CCCC2	ZINC000450971965	FE	On-Demand	Anodyne	CA9	18	40
CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450971978	FI	On-Demand	Anodyne	NAMPT	28	41
CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450971981	FI	On-Demand	Anodyne	NAMPT	28	41
CC[C@H]1CCC[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450971982	FI	On-Demand	Anodyne	NAMPT	28	41
CC[C@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450971983	FI	On-Demand	Anodyne	NAMPT	28	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1	ZINC000450971985	FF	On-Demand	Anodyne	TBXA2R	58	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1	ZINC000450971985	FF	On-Demand	Anodyne	IDO1	27	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1	ZINC000450971985	FF	On-Demand	Anodyne	PFK	0	41
CO[C@@H](Cc1ccccc1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971992	FF	On-Demand	Anodyne	DRD3	0	40
CO[C@@H](Cc1ccccc1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971992	FF	On-Demand	Anodyne	HTR4	41	39
CO[C@H](Cc1ccccc1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971993	FF	On-Demand	Anodyne	DRD3	0	40
CO[C@H](Cc1ccccc1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450971993	FF	On-Demand	Anodyne	HTR4	41	39
Cc1cc2c(N3CCN(C(=O)c4ccsc4C)CC3)ncnc2s1	ZINC000450971994	FG	On-Demand	Anodyne	P2RY12	15	45
Cc1cc2c(N3CCN(C(=O)c4ccsc4C)CC3)ncnc2s1	ZINC000450971994	FG	On-Demand	Anodyne	SIRT3	41	29
CCCCOCCCNS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972009	DG	On-Demand	Anodyne	ALOX15	42	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)C)cs2)cc1	ZINC000450972015	FH	On-Demand	Anodyne	CA2	22	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)C)cs2)cc1	ZINC000450972015	FH	On-Demand	Anodyne	PPIA	24	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)C)cs2)cc1	ZINC000450972015	FH	On-Demand	Anodyne	CA1	23	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)C)cs2)cc1	ZINC000450972015	FH	On-Demand	Anodyne	CA4	30	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C(C)C)cs2)cc1	ZINC000450972015	FH	On-Demand	Anodyne	PFK	0	44
Cc1cccc(C)c1CS(=O)(=O)Nc1ccccc1OCCn1ccnc1	ZINC000450972019	GH	On-Demand	Anodyne	TBXAS1	28	45
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCc2ccc(Cl)cc2)c1	ZINC000450972020	GE	On-Demand	Anodyne	TBXA2R	49	45
COc1ccc2c(c1)CCCN2C(=O)COc1cccc2c1C(=O)CC2	ZINC000450972022	FG	On-Demand	Anodyne	SRD5A1	34	40
COc1ccc2c(c1)CCCN2C(=O)COc1cccc2c1C(=O)CC2	ZINC000450972022	FG	On-Demand	Anodyne	HSD17B3	45	32
COc1cc(CSc2nc3c([nH]2)CCC3)ccc1Cl	ZINC000450972023	CH	On-Demand	Anodyne	CYP2C19	19	40
CC(=O)CCCCCSc1nc(C)c(C)[nH]1	ZINC000450972026	BG	On-Demand	Anodyne	HDA106	0	48
C[C@@H]1CN(C(=O)CSC2CC2)CCN1c1nc2ccccc2o1	ZINC000450972029	EF	On-Demand	Anodyne	HTR3A	0	46
C[C@H]1CN(C(=O)CSC2CC2)CCN1c1nc2ccccc2o1	ZINC000450972032	EF	On-Demand	Anodyne	HTR3A	0	46
CCc1cc(CC)c(S(=O)(=O)N2CCC(C(N)=O)CC2)c(CC)c1	ZINC000450972033	FE	On-Demand	Anodyne	EPHX2	38	41
COC(=O)C1CCN(S(=O)(=O)c2cccc3ccoc23)CC1	ZINC000450972034	DE	On-Demand	Anodyne	EPHX2	37	44
C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)CC1(O)CCC1	ZINC000450972036	DF	On-Demand	Anodyne	MDM2	67	32
CCN(CC)c1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cn1	ZINC000450972037	GE	On-Demand	Anodyne	SGK1	18	48
Cc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c(F)c1	ZINC000450972038	DH	On-Demand	Anodyne	TRPV1	46	34
Cc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c(F)c1	ZINC000450972038	DH	On-Demand	Anodyne	FFAR4	29	41
Cc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c(F)c1	ZINC000450972038	DH	On-Demand	Anodyne	MOGAT2	48	36
O=C(c1csc(Nc2cc(F)cc(F)c2)n1)N1CC(OC(F)F)C1	ZINC000450972040	FF	On-Demand	Anodyne	TRPC6	81	44
O=C(c1csc(Nc2cc(F)cc(F)c2)n1)N1CC(OC(F)F)C1	ZINC000450972040	FF	On-Demand	Anodyne	TRPC3	61	44
C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)CC1(O)CCC1	ZINC000450972041	DF	On-Demand	Anodyne	MDM2	67	32
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	MMP13	76	48
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	ADAM17	71	43
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	MMP2	39	42
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	MMP3	73	48
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	MMP8	23	40
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	MMP9	34	41
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	EPHX2	17	45
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	TGM2	51	36
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	MMP7	72	40
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	MMP1	77	48
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972042	FE	On-Demand	Anodyne	F13A1	41	34
C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)CC1(O)CCC1	ZINC000450972043	DF	On-Demand	Anodyne	MDM2	67	32
C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)CC1(O)CCC1	ZINC000450972044	DF	On-Demand	Anodyne	MDM2	67	32
CC[C@H](CC(F)(F)F)C(=O)N1C[C@@H](c2cccc(Cl)c2)OC[C@H]1C	ZINC000450972046	FJ	On-Demand	Anodyne	MDM2	88	38
CC[C@H](CC(F)(F)F)C(=O)N1C[C@H](c2cccc(Cl)c2)OC[C@H]1C	ZINC000450972048	FJ	On-Demand	Anodyne	MDM2	88	38
CC[C@H](CC(F)(F)F)C(=O)N1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C	ZINC000450972049	FJ	On-Demand	Anodyne	MDM2	88	38
CC[C@H](CC(F)(F)F)C(=O)N1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C	ZINC000450972050	FJ	On-Demand	Anodyne	MDM2	88	38
CN(C)CCCN(CCCN(C)C)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972053	FE	On-Demand	Anodyne	BDKRB1	17	40
COc1ccccc1CNS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972062	DG	On-Demand	Anodyne	GLMU	0	54
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	HRH2	18	48
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	MMP13	51	41
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	ADAM17	36	41
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	MMP9	24	40
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	MMP1	27	41
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	CCR8	60	39
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	SFRP1	109	39
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	WNT3	68	34
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	LUXN	0	44
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	ADIPOR1	0	52
CCN1CCC(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450972065	GD	On-Demand	Anodyne	ADIPOR2	0	52
COC(=O)c1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972075	GG	On-Demand	Anodyne	LEF	47	34
O=C1CCc2cccc(OCC(=O)N3CCN(Cc4ccccc4)CC3)c21	ZINC000450972078	FF	On-Demand	Anodyne	ABCB1	0	47
O=C1CCc2cccc(OCC(=O)N3CCN(Cc4ccccc4)CC3)c21	ZINC000450972078	FF	On-Demand	Anodyne	MGLL	0	40
O=C1CCc2cccc(OCC(=O)N3CCN(Cc4ccccc4)CC3)c21	ZINC000450972078	FF	On-Demand	Anodyne	GPR183	0	43
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450972084	GF	On-Demand	Anodyne	MMP3	48	36
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450972084	GF	On-Demand	Anodyne	MMP8	30	45
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450972084	GF	On-Demand	Anodyne	ADAM9	63	35
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450972089	GF	On-Demand	Anodyne	MMP3	48	36
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450972089	GF	On-Demand	Anodyne	MMP8	30	45
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450972089	GF	On-Demand	Anodyne	ADAM9	63	35
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450972091	GF	On-Demand	Anodyne	MMP3	48	36
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450972091	GF	On-Demand	Anodyne	MMP8	30	45
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450972091	GF	On-Demand	Anodyne	ADAM9	63	35
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450972092	GF	On-Demand	Anodyne	MMP3	48	36
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450972092	GF	On-Demand	Anodyne	MMP8	30	45
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450972092	GF	On-Demand	Anodyne	ADAM9	63	35
CO[C@H](C)CS(=O)(=O)Nc1cc(-c2ccccc2)nn1C(C)(C)C	ZINC000450972093	FG	On-Demand	Anodyne	P2RY12	45	31
CO[C@@H](C)CS(=O)(=O)Nc1cc(-c2ccccc2)nn1C(C)(C)C	ZINC000450972094	FG	On-Demand	Anodyne	P2RY12	45	31
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	CHRM2	15	40
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	DRD2	18	49
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	DRD4	40	48
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	ACHE	45	43
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	DRD3	25	48
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	CHRM3	21	40
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	LTA4H	19	40
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	SIGMAR1	64	53
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	BCHE	0	40
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	CCR3	19	44
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	MCHR1	20	42
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	ADIPOR1	0	41
O=S(=O)(CCOCc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000450972095	GF	On-Demand	Anodyne	ADIPOR2	0	41
CN(C)CCn1ccc2ccc(NS(=O)(=O)c3sccc3F)cc21	ZINC000450972098	FG	On-Demand	Anodyne	HTR6	15	63
CN(C)CCn1ccc2ccc(NS(=O)(=O)c3sccc3F)cc21	ZINC000450972098	FG	On-Demand	Anodyne	NAMPT	0	53
Cc1[nH]nc(-c2ccccc2)c1NC(=O)CCCC(C)C	ZINC000450972099	CI	On-Demand	Anodyne	HDAC3	24	40
COC(=O)COc1ccc(CN(C)C(=O)c2ccc(N3CCC3)nc2)cc1	ZINC000450972117	FE	On-Demand	Anodyne	LIMK2	34	41
COCCCNC(=O)CSc1ccc(Br)c(Cl)c1	ZINC000450972118	FG	On-Demand	Anodyne	NCE103	16	41
COCCCNC(=O)CSc1ccc(Br)c(Cl)c1	ZINC000450972118	FG	On-Demand	Anodyne	CAN2	0	41
COCCCNC(=O)CSc1ccc(Br)c(Cl)c1	ZINC000450972118	FG	On-Demand	Anodyne	FAS	42	39
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	BMP1	103	46
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	KCNA5	24	48
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	MMP13	46	42
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	ADAM17	32	42
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	MMP8	36	40
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	MMP9	47	42
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	MMP12	28	43
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	MMP1	59	43
COc1ccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450972122	EG	On-Demand	Anodyne	STAT5B	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	CA2	31	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	ADRB2	27	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	ADRB1	30	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MME	32	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	SDH1	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	BMP1	25	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	CA1	45	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MMP13	52	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	COLA	47	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	CA5B	43	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	CA4	33	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	CA5A	49	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	CAPNS1	24	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MMP2	58	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MMP3	66	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MMP8	42	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	CAPN1	40	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MMP9	42	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	CAPN2	54	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MMP12	63	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	LAP3	43	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MMP7	24	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	ADAMTS4	70	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	MMP1	32	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	LEF	47	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccccc2)cc1	ZINC000450972138	FH	On-Demand	Anodyne	LIMK2	54	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	CA2	31	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	ADRB2	27	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	ADRB1	30	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MME	32	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	SDH1	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	BMP1	25	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	CA1	45	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MMP13	52	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	COLA	47	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	CA5B	43	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	CA4	33	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	CA5A	49	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	CAPNS1	24	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MMP2	58	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MMP3	66	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MMP8	42	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	CAPN1	40	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MMP9	42	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	CAPN2	54	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MMP12	63	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	LAP3	43	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MMP7	24	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	ADAMTS4	70	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	MMP1	32	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	LEF	47	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccccc2)cc1	ZINC000450972139	FH	On-Demand	Anodyne	LIMK2	54	40
CC[C@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972141	GH	On-Demand	Anodyne	P2RY12	19	45
CC[C@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972141	GH	On-Demand	Anodyne	AKT2	19	40
CC[C@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972141	GH	On-Demand	Anodyne	AKT3	36	40
CC[C@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972141	GH	On-Demand	Anodyne	AKT1	32	40
CC[C@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972141	GH	On-Demand	Anodyne	SIRT3	47	31
CC[C@@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972143	GH	On-Demand	Anodyne	P2RY12	19	45
CC[C@@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972143	GH	On-Demand	Anodyne	AKT2	19	40
CC[C@@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972143	GH	On-Demand	Anodyne	AKT3	36	40
CC[C@@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972143	GH	On-Demand	Anodyne	AKT1	32	40
CC[C@@H](CC(F)(F)F)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450972143	GH	On-Demand	Anodyne	SIRT3	47	31
COc1cccc(F)c1NC(=O)c1cnc(C2CC2)nc1	ZINC000450972164	CF	On-Demand	Anodyne	PYGL	0	40
CC(C)c1nnc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)s1	ZINC000450972173	GH	On-Demand	Anodyne	SIGMAR1	22	41
CC(C)c1nnc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)s1	ZINC000450972173	GH	On-Demand	Anodyne	PREP	50	42
CC(C)c1nnc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)s1	ZINC000450972173	GH	On-Demand	Anodyne	BIRC2	54	44
CC(C)c1nnc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)s1	ZINC000450972175	GH	On-Demand	Anodyne	SIGMAR1	22	41
CC(C)c1nnc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)s1	ZINC000450972175	GH	On-Demand	Anodyne	PREP	50	42
CC(C)c1nnc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)s1	ZINC000450972175	GH	On-Demand	Anodyne	BIRC2	54	44
Cc1cccc(Cl)c1C(=O)N1CCC(n2cncc2C)CC1	ZINC000450972179	DH	On-Demand	Anodyne	CCR3	24	41
Cc1cccc(Cl)c1C(=O)N1CCC(n2cncc2C)CC1	ZINC000450972179	DH	On-Demand	Anodyne	CCR5	28	47
Cc1cccc(Cl)c1C(=O)N1CCC(n2cncc2C)CC1	ZINC000450972179	DH	On-Demand	Anodyne	L3MBTL3	78	39
C[C@@H]1CC[C@@H](NC(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450972185	CF	On-Demand	Anodyne	MAPK13	43	33
C[C@@H]1CC[C@H](NC(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450972186	CF	On-Demand	Anodyne	MAPK13	43	33
C[C@H]1CC[C@@H](NC(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450972187	CF	On-Demand	Anodyne	MAPK13	43	33
C[C@H]1CC[C@H](NC(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450972188	CF	On-Demand	Anodyne	MAPK13	43	33
C[C@@H]1CC[C@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450972197	CG	On-Demand	Anodyne	NAAA	23	40
C[C@@H]1CC[C@@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C1	ZINC000450972198	CG	On-Demand	Anodyne	NAAA	23	40
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000450972199	CG	On-Demand	Anodyne	NAAA	23	40
C[C@H](OCc1ccc(F)cc1)C(=O)N[C@H]1CC[C@@H](C)C1	ZINC000450972200	CG	On-Demand	Anodyne	NAAA	23	40
COC(=O)COc1ccc(CN(C)C(=O)c2ccc(C)nc2C(C)C)cc1	ZINC000450972202	FG	On-Demand	Anodyne	ACAT	45	32
COc1cc(NC(=O)c2cc(C)n(C(C)C)n2)ccc1F	ZINC000450972207	CG	On-Demand	Anodyne	COLA	58	36
CCc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450972220	GF	On-Demand	Anodyne	RORB	0	40
CCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450972222	GG	On-Demand	Anodyne	CA2	35	49
CCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450972222	GG	On-Demand	Anodyne	ADRB2	19	42
CCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450972222	GG	On-Demand	Anodyne	ADRB3	23	42
CCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450972222	GG	On-Demand	Anodyne	CA1	45	49
CCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450972222	GG	On-Demand	Anodyne	CA4	63	49
CCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450972222	GG	On-Demand	Anodyne	CA9	19	49
CCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450972222	GG	On-Demand	Anodyne	P96878_MYCTU	15	40
CCCCc1nnc(NS(=O)(=O)c2c(Cl)ccc(F)c2F)s1	ZINC000450972230	FH	On-Demand	Anodyne	CA2	15	41
O=C(COc1ccc(S(=O)(=O)Nc2cc(Cl)ccn2)cc1)NC1CC1	ZINC000450972243	GE	On-Demand	Anodyne	TRAR	29	40
O=C(COc1ccc(S(=O)(=O)Nc2cc(Cl)ccn2)cc1)NC1CC1	ZINC000450972243	GE	On-Demand	Anodyne	LUXN	0	45
O=C(COc1ccc(S(=O)(=O)Nc2cc(Cl)ccn2)cc1)NC1CC1	ZINC000450972243	GE	On-Demand	Anodyne	ADIPOR1	0	41
O=C(COc1ccc(S(=O)(=O)Nc2cc(Cl)ccn2)cc1)NC1CC1	ZINC000450972243	GE	On-Demand	Anodyne	ADIPOR2	0	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000450972262	FF	On-Demand	Anodyne	BMP1	67	48
CCCc1nnc(NS(=O)(=O)c2c(Cl)ccc(F)c2F)s1	ZINC000450972263	FG	On-Demand	Anodyne	CA2	15	43
COCCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450972265	GE	On-Demand	Anodyne	NR1H3	0	48
COCCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450972265	GE	On-Demand	Anodyne	NR1H2	0	48
COCCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450972265	GE	On-Demand	Anodyne	RORC	27	48
COCCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450972265	GE	On-Demand	Anodyne	RORB	0	48
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	MMP13	76	48
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	ADAM17	71	43
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	MMP2	39	42
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	MMP3	73	48
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	MMP8	23	40
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	MMP9	34	41
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	EPHX2	17	45
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	TGM2	51	36
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	MMP7	72	40
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	MMP1	77	48
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972268	FE	On-Demand	Anodyne	F13A1	41	34
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	MMP13	76	48
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	ADAM17	71	43
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	MMP2	39	42
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	MMP3	73	48
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	MMP8	23	40
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	MMP9	34	41
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	EPHX2	17	45
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	TGM2	51	36
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	MMP7	72	40
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	MMP1	77	48
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450972270	FE	On-Demand	Anodyne	F13A1	41	34
CC(=O)N1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450972284	EE	On-Demand	Anodyne	PKM	39	46
CC(=O)N1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450972284	EE	On-Demand	Anodyne	TGM2	66	39
CC(=O)N1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450972284	EE	On-Demand	Anodyne	CYP2A5	0	40
CC(=O)N1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450972284	EE	On-Demand	Anodyne	F13A1	78	39
CC(=O)N1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450972284	EE	On-Demand	Anodyne	AKR1C3	45	42
COC(=O)c1ccc(I)c(OCc2cn(C)nc2C)c1	ZINC000450972290	GF	On-Demand	Anodyne	MT-CYB	41	31
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	CA2	24	49
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	BMP1	58	38
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	CYP1B1	16	45
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	CA1	34	49
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	KCNA5	30	42
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP13	59	45
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	CA4	18	47
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	CA14	17	41
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MTNR1A	26	48
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MTNR1B	29	54
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP2	49	47
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP3	41	45
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP8	35	47
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP14	15	43
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	PRTN3	54	34
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP9	35	47
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP12	55	44
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	CA12	29	44
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP7	36	44
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	CA9	27	42
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MMP1	28	45
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	LEF	30	45
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	IDO1	34	46
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	FFAR4	26	42
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	AKR1C2	46	35
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	MTCA1	18	49
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(OC)c1	ZINC000450972300	GG	On-Demand	Anodyne	P96878_MYCTU	21	49
O=S(=O)(Nc1ccc(-c2nnc3n2CCCCC3)cc1)c1sccc1F	ZINC000450972302	GH	On-Demand	Anodyne	HSD11B2	15	41
CN(CCc1ccccc1[N+](=O)[O-])Cc1nnc(C2CC2)s1	ZINC000450972313	DF	On-Demand	Bother	COLA	75	33
CCOCc1nc(C)c(C(=O)Nc2ccc(F)c(OC)c2)s1	ZINC000450972326	DG	On-Demand	Anodyne	ENPP1	52	32
CCOCc1nc(C)c(C(=O)Nc2ccc(F)c(OC)c2)s1	ZINC000450972326	DG	On-Demand	Anodyne	DRTS_TRYCR	44	33
CCOCc1nc(C)c(C(=O)Nc2ccc(F)c(OC)c2)s1	ZINC000450972326	DG	On-Demand	Anodyne	KCNK3	40	35
COCCO[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450972329	GF	On-Demand	Anodyne	CHRM3	15	41
COCCO[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450972329	GF	On-Demand	Anodyne	MMP13	16	41
COCCO[C@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450972329	GF	On-Demand	Anodyne	L3MBTL3	41	34
COCCO[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450972334	GF	On-Demand	Anodyne	CHRM3	15	41
COCCO[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450972334	GF	On-Demand	Anodyne	MMP13	16	41
COCCO[C@@H]1CCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1	ZINC000450972334	GF	On-Demand	Anodyne	L3MBTL3	41	34
COCCO[C@@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450972336	DD	On-Demand	Anodyne	LIPG	39	45
CCOc1ccncc1S(=O)(=O)NC[C@@H]1COc2ccccc2O1	ZINC000450972337	FD	On-Demand	Anodyne	ADRA2B	20	41
COCCO[C@@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450972338	DD	On-Demand	Anodyne	LIPG	39	45
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450972339	FE	On-Demand	Mild	EPHX2	38	41
CCOC(=O)C1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450972339	FE	On-Demand	Mild	TRPV4	42	33
COCCO[C@H]1CCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450972340	DD	On-Demand	Anodyne	LIPG	39	45
COCCO[C@H]1CCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450972341	DD	On-Demand	Anodyne	LIPG	39	45
COc1cccc(N2CCN(S(=O)(=O)c3sccc3Cl)CC2)c1	ZINC000450972345	FF	On-Demand	Anodyne	DRD4	46	37
CCOc1ccncc1S(=O)(=O)NC[C@H]1COc2ccccc2O1	ZINC000450972346	FD	On-Demand	Anodyne	ADRA2B	20	41
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	BMP1	43	39
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	KCNA5	0	40
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MMP13	23	41
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	CA4	15	42
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MMP16	0	42
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MTNR1A	24	43
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MTNR1B	27	44
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MMP2	21	42
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MMP3	27	48
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MMP8	33	42
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MMP9	27	42
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MMP12	23	41
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450972351	GG	On-Demand	Anodyne	MMP1	26	42
Fc1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450972354	CF	On-Demand	Anodyne	LTA4H	43	51
Fc1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450972354	CF	On-Demand	Anodyne	PSMB2	46	40
Fc1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450972354	CF	On-Demand	Anodyne	PSMB1	41	40
COc1cccc(-n2cc(C(=O)N3CCN(CC(C)(C)O)C[C@@H]3C)nn2)c1	ZINC000450972366	FD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(-n2cc(C(=O)N3CCN(CC(C)(C)O)C[C@H]3C)nn2)c1	ZINC000450972368	FD	On-Demand	Anodyne	DRD4	42	32
CCC(=O)C1(C(=O)NCC2CCN(CC(F)(F)F)CC2)CC1	ZINC000450972370	DE	On-Demand	Anodyne	CACNA1I	56	38
COCCO[C@@H]1CCN(C(=O)[C@@H]2C(C)[C@H]2C(=O)N2CC[C@@H](OCCOC)C2)C1	ZINC000450972375	GC	On-Demand	Anodyne	LIPG	15	40
COCCO[C@H]1CCN(C(=O)[C@@H]2[C@H](C)[C@H]2C(=O)N2CC[C@@H](OCCOC)C2)C1	ZINC000450972377	GC	On-Demand	Anodyne	LIPG	15	40
COCCO[C@H]1CCN(C(=O)[C@@H]2C(C)[C@H]2C(=O)N2CC[C@H](OCCOC)C2)C1	ZINC000450972378	GC	On-Demand	Anodyne	LIPG	15	40
CCCCc1nnc(NS(=O)(=O)Cc2ccc(C(=O)OCC)cc2)s1	ZINC000450972380	GF	On-Demand	Anodyne	CA4	23	44
CCCCc1nnc(NS(=O)(=O)Cc2ccc(C(=O)OCC)cc2)s1	ZINC000450972380	GF	On-Demand	Anodyne	GLS	0	41
COc1ccc(C(=O)N[C@@H]2CC[C@H](C)C2)cc1S(C)(=O)=O	ZINC000450972385	DE	On-Demand	Anodyne	EZH2	40	34
COc1ccc(C(=O)N[C@H]2CC[C@H](C)C2)cc1S(C)(=O)=O	ZINC000450972387	DE	On-Demand	Anodyne	EZH2	40	34
COc1ccc(C(=O)N[C@H]2CC[C@@H](C)C2)cc1S(C)(=O)=O	ZINC000450972390	DE	On-Demand	Anodyne	EZH2	40	34
COc1ccc(C(=O)N[C@@H]2CC[C@@H](C)C2)cc1S(C)(=O)=O	ZINC000450972391	DE	On-Demand	Anodyne	EZH2	40	34
N#CCc1ccc(S(=O)(=O)NCCCn2ccnc2)c(Cl)c1	ZINC000450972403	ED	On-Demand	Mild	TBXAS1	32	41
N#CCc1ccc(S(=O)(=O)NCCCn2ccnc2)c(Cl)c1	ZINC000450972403	ED	On-Demand	Mild	CYP17A1	0	42
COc1cc(NC(=O)Cc2cn(C)nc2C)ccc1F	ZINC000450972410	CE	On-Demand	Anodyne	PDGFRB	31	44
COc1cc(NC(=O)Cc2cn(C)nc2C)ccc1F	ZINC000450972410	CE	On-Demand	Anodyne	IMPDH2	0	41
COc1cc(NC(=O)Cc2cn(C)nc2C)ccc1F	ZINC000450972410	CE	On-Demand	Anodyne	ENPP1	59	36
COc1cc(NC(=O)Cc2cn(C)nc2C)ccc1F	ZINC000450972410	CE	On-Demand	Anodyne	IMDH_CRYPV	29	43
COc1cc(NC(=O)Cc2cn(C)nc2C)ccc1F	ZINC000450972410	CE	On-Demand	Anodyne	DRTS_TRYCR	51	29
COC(=O)C1(CN[C@@H]2CCC[C@@H]2OCc2ccccc2)CC1	ZINC000450972413	DF	On-Demand	Anodyne	TIMP3	50	32
COC(=O)C1(CN[C@@H]2CCC[C@@H]2OCc2ccccc2)CC1	ZINC000450972413	DF	On-Demand	Anodyne	SLC12A5	63	37
COC(=O)C1(CN[C@H]2CCC[C@@H]2OCc2ccccc2)CC1	ZINC000450972415	DF	On-Demand	Anodyne	TIMP3	50	32
COC(=O)C1(CN[C@H]2CCC[C@@H]2OCc2ccccc2)CC1	ZINC000450972415	DF	On-Demand	Anodyne	SLC12A5	63	37
COC(=O)C1(CN[C@@H]2CCC[C@H]2OCc2ccccc2)CC1	ZINC000450972416	DF	On-Demand	Anodyne	TIMP3	50	32
COC(=O)C1(CN[C@@H]2CCC[C@H]2OCc2ccccc2)CC1	ZINC000450972416	DF	On-Demand	Anodyne	SLC12A5	63	37
COC(=O)C1(CN[C@H]2CCC[C@H]2OCc2ccccc2)CC1	ZINC000450972417	DF	On-Demand	Anodyne	TIMP3	50	32
COC(=O)C1(CN[C@H]2CCC[C@H]2OCc2ccccc2)CC1	ZINC000450972417	DF	On-Demand	Anodyne	SLC12A5	63	37
COCC1(S(=O)(=O)N2Cc3ccccc3C[C@H]2C(=O)OC)CC1	ZINC000450972420	ED	On-Demand	Anodyne	MMP3	26	44
COCC1(S(=O)(=O)N2Cc3ccccc3C[C@H]2C(=O)OC)CC1	ZINC000450972420	ED	On-Demand	Anodyne	MMP8	26	44
COCC1(S(=O)(=O)N2Cc3ccccc3C[C@H]2C(=O)OC)CC1	ZINC000450972420	ED	On-Demand	Anodyne	ADAM9	68	38
COCC1(S(=O)(=O)N2Cc3ccccc3C[C@@H]2C(=O)OC)CC1	ZINC000450972421	ED	On-Demand	Anodyne	MMP3	26	44
COCC1(S(=O)(=O)N2Cc3ccccc3C[C@@H]2C(=O)OC)CC1	ZINC000450972421	ED	On-Demand	Anodyne	MMP8	26	44
COCC1(S(=O)(=O)N2Cc3ccccc3C[C@@H]2C(=O)OC)CC1	ZINC000450972421	ED	On-Demand	Anodyne	ADAM9	68	38
CC(C)CCCC(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450972431	DG	On-Demand	Anodyne	CACNA1I	58	38
Cc1cc(NS(=O)(=O)Cc2ccc(C(F)F)cc2)no1	ZINC000450972432	DF	On-Demand	Anodyne	PFK	0	54
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	DRD2	21	48
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	FKBP1A	37	40
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	DRD4	35	48
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	HRH2	45	39
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	HTR2A	15	43
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	SLC6A1	94	36
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	DRD3	0	46
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	OPRD1	15	41
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	SIGMAR1	43	44
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	CCR3	63	47
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	PREP	55	41
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	CCR2	24	46
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	MCHR1	27	48
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	CCR8	17	42
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	BIRC2	52	42
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1cccc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972434	GH	On-Demand	Anodyne	ADIPOR2	0	41
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	DRD2	21	48
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	FKBP1A	37	40
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	DRD4	35	48
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	HRH2	45	39
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	HTR2A	15	43
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	SLC6A1	94	36
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	DRD3	0	46
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	OPRD1	15	41
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	SIGMAR1	43	44
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	CCR3	63	47
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	PREP	55	41
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	CCR2	24	46
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	MCHR1	27	48
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	CCR8	17	42
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	BIRC2	52	42
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1cccc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1	ZINC000450972436	GH	On-Demand	Anodyne	ADIPOR2	0	41
Cc1cc(C)c(C(=O)N[C@]2(C#N)CCOC2)cc1Br	ZINC000450972438	DE	On-Demand	Mild	TSPO	0	42
Cc1cc(C)c(C(=O)N[C@@]2(C#N)CCOC2)cc1Br	ZINC000450972439	DE	On-Demand	Mild	TSPO	0	42
COc1cccc(F)c1NC(=O)c1ccc(C)c2c1CCC2	ZINC000450972440	CH	On-Demand	Anodyne	KCNK3	26	40
COc1cccc(F)c1NC(=O)c1ccc(C)c2c1CCC2	ZINC000450972440	CH	On-Demand	Anodyne	KCNK9	46	38
CSc1cccc(C)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450972442	GI	On-Demand	Anodyne	SHH	16	40
CSc1cccc(C)c1NC(=O)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450972442	GI	On-Demand	Anodyne	DGAT1	21	40
CO[C@H]1COCC[C@H]1CC(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450972446	FD	On-Demand	Anodyne	CACNA1I	42	34
CO[C@H]1COCC[C@@H]1CC(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450972448	FD	On-Demand	Anodyne	CACNA1I	42	34
CO[C@@H]1COCC[C@H]1CC(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450972450	FD	On-Demand	Anodyne	CACNA1I	42	34
CO[C@@H]1COCC[C@@H]1CC(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450972452	FD	On-Demand	Anodyne	CACNA1I	42	34
CCOC(=O)c1ccc(CS(=O)(=O)NCCCn2ccnc2)cc1	ZINC000450972467	FD	On-Demand	Anodyne	TBXAS1	72	53
CCOC(=O)c1ccc(CS(=O)(=O)NCCCn2ccnc2)cc1	ZINC000450972467	FD	On-Demand	Anodyne	HMOX2	46	37
CCOC(=O)c1ccc(CS(=O)(=O)NCCCn2ccnc2)cc1	ZINC000450972467	FD	On-Demand	Anodyne	QPCT	44	44
CCOC(=O)c1ccc(CS(=O)(=O)NCCCn2ccnc2)cc1	ZINC000450972467	FD	On-Demand	Anodyne	CYP27B1	43	31
COc1ccc(CCNC(=O)COc2cccc3c2C(=O)CC3)cc1OC	ZINC000450972471	FF	On-Demand	Anodyne	ABCB1	0	40
COc1ccc(CCNC(=O)COc2cccc3c2C(=O)CC3)cc1OC	ZINC000450972471	FF	On-Demand	Anodyne	CAN2	0	48
CSc1cccc(C)c1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450972483	DI	On-Demand	Anodyne	LCK	40	34
CSc1cccc(C)c1NC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450972483	DI	On-Demand	Anodyne	SHH	55	39
COc1cccc(NC(=O)CN(C)C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450972484	GE	On-Demand	Anodyne	MTNR1A	16	40
COc1cccc(NC(=O)CN(C)C(=O)COc2cccc3c2C(=O)CC3)c1	ZINC000450972484	GE	On-Demand	Anodyne	MTNR1B	20	41
Cc1cc(C(=O)NCC2CCN(CC(F)(F)F)CC2)ncc1C(N)=O	ZINC000450972486	FD	On-Demand	Anodyne	CACNA1I	67	40
CC(C)(C)CCC1(O)CC(C(=O)NCC2CCN(CC(F)(F)F)CC2)C1	ZINC000450972489	GG	On-Demand	Anodyne	CACNA1I	70	43
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccc3ccoc23)C1	ZINC000450972501	EE	On-Demand	Anodyne	AKR1C3	18	40
CC(C)n1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972502	GD	On-Demand	Anodyne	SCARB1	42	31
CC(C)n1nccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972502	GD	On-Demand	Anodyne	LUXN	0	43
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2cccc3ccoc23)C1	ZINC000450972503	EE	On-Demand	Anodyne	AKR1C3	18	40
CNC(=O)c1ccc(CS(=O)(=O)N(CCC(C)C)CCC(C)C)cc1	ZINC000450972504	FG	On-Demand	Anodyne	RORC	15	41
CC(C)(C)CC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972505	GF	On-Demand	Anodyne	PRTN3	45	32
CC(C)(C)CC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972505	GF	On-Demand	Anodyne	TRAR	33	40
CC(C)(C)CC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972505	GF	On-Demand	Anodyne	LUXN	0	52
CC(C)(C)CC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972505	GF	On-Demand	Anodyne	ADIPOR1	0	42
CC(C)(C)CC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972505	GF	On-Demand	Anodyne	ADIPOR2	0	42
CCN1CCC(NS(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450972521	EE	On-Demand	Anodyne	SSTR5	52	34
C[C@@H](CCc1ccccc1)NS(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450972540	FH	On-Demand	Mild	SDH1	0	45
C[C@H](CCc1ccccc1)NS(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450972542	FH	On-Demand	Mild	SDH1	0	45
CC(C)c1cnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450972555	GF	On-Demand	Anodyne	LUXN	0	43
Cc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450972556	DE	On-Demand	Anodyne	PFK	0	41
O=C(Cn1cnc2c1CCCC2)Nc1cc(Cl)c(Cl)cc1Cl	ZINC000450972557	FI	On-Demand	Anodyne	HEMY	42	34
COC(=O)c1ncccc1S(=O)(=O)N[C@H](C(=O)OC)C(C)C	ZINC000450972561	EC	On-Demand	Anodyne	ADAMTS4	61	38
COC(=O)c1ncccc1S(=O)(=O)N[C@H](C(=O)OC)C(C)C	ZINC000450972561	EC	On-Demand	Anodyne	LEF	22	42
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCC(C(N)=O)CC2)c1	ZINC000450972577	FD	On-Demand	Anodyne	EPHX2	40	41
CCOC(=O)COc1ccc(OCCOc2cccc3c2C(=O)CC3)cc1	ZINC000450972586	FG	On-Demand	Anodyne	PLA2G4B	49	35
O=S(=O)(Cc1c(F)cccc1Cl)N1CCN(c2ccccc2O)CC1	ZINC000450972587	GF	On-Demand	Anodyne	DRD2	18	40
CC(=O)CCCCCS(=O)(=O)c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000450972601	FD	On-Demand	Anodyne	THRB	25	49
O=C(COc1cccc2c1C(=O)CC2)NCCCN1CCCC1=O	ZINC000450972607	ED	On-Demand	Anodyne	TYRO3	25	42
CCOC(=O)c1ccc(CS(=O)(=O)Nc2ccccc2N(C)C)cc1	ZINC000450972624	FF	On-Demand	Anodyne	TMPRSS11D	40	34
N#CCc1ccc(S(=O)(=O)Nc2ccc(N3CCOCC3)nc2)c(Cl)c1	ZINC000450972627	GE	On-Demand	Mild	PAK1	42	34
COC(=O)C1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450972669	EE	On-Demand	Anodyne	EPHX2	15	41
COC(=O)C1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450972670	EE	On-Demand	Anodyne	EPHX2	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCn3ncnc32)cc1	ZINC000450972671	ED	On-Demand	Anodyne	TGM2	46	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCn3ncnc32)cc1	ZINC000450972671	ED	On-Demand	Anodyne	F13A1	65	38
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCCC2)c1	ZINC000450972674	DG	On-Demand	Anodyne	KCNQ2	83	42
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCCC2)c1	ZINC000450972674	DG	On-Demand	Anodyne	CREBBP	44	35
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCCC2)c1	ZINC000450972674	DG	On-Demand	Anodyne	BRD9	44	35
Cc1cccc(C)c1CS(=O)(=O)Nc1ccc(N2CCOCC2)nc1	ZINC000450972676	FE	On-Demand	Anodyne	ADK	40	36
Cc1cccc(C)c1CS(=O)(=O)Nc1ccc(N2CCOCC2)nc1	ZINC000450972676	FE	On-Demand	Anodyne	DGAT1	33	44
O=C(CCNS(=O)(=O)CCC1CCCC1)Nc1cccnc1	ZINC000450972680	ED	On-Demand	Anodyne	BMP1	50	42
COC(=O)C1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450972691	EE	On-Demand	Anodyne	LPL	47	39
COC(=O)C1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450972691	EE	On-Demand	Anodyne	EPHX2	35	42
CCOc1ccc(CCNS(=O)(=O)C[C@@H]2CCCC2(F)F)cc1OCC	ZINC000450972707	GG	On-Demand	Anodyne	SSTR5	59	33
CCOc1ccc(CCNS(=O)(=O)C[C@H]2CCCC2(F)F)cc1OCC	ZINC000450972708	GG	On-Demand	Anodyne	SSTR5	59	33
N#CCc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)c(Cl)c1	ZINC000450972709	GH	On-Demand	Mild	KCNQ2	76	42
N#CCc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)c(Cl)c1	ZINC000450972709	GH	On-Demand	Mild	CSF1R	0	40
COC(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450972712	GG	On-Demand	Anodyne	KCNQ2	47	33
COC(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450972712	GG	On-Demand	Anodyne	CREBBP	43	34
COC(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450972712	GG	On-Demand	Anodyne	BRD9	43	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450972724	FF	On-Demand	Anodyne	TIMP3	60	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450972725	FF	On-Demand	Anodyne	TIMP3	60	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450972726	FF	On-Demand	Anodyne	TIMP3	60	34
CO[C@H](Cc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450972727	FF	On-Demand	Anodyne	TIMP3	60	34
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450972732	GI	On-Demand	Anodyne	CCR2	48	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1	ZINC000450972733	GI	On-Demand	Anodyne	CCR2	48	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450972734	GI	On-Demand	Anodyne	CCR2	48	38
Cc1cc(C(F)(F)F)ccc1C(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1	ZINC000450972735	GI	On-Demand	Anodyne	CCR2	48	38
CCN1CCC(NS(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450972764	EF	On-Demand	Anodyne	ADRA1B	29	40
CCN1CCC(NS(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450972764	EF	On-Demand	Anodyne	CCR8	52	42
CCN1CCC(NS(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450972764	EF	On-Demand	Anodyne	SFRP1	100	38
CCN1CCC(NS(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450972764	EF	On-Demand	Anodyne	WNT3	77	37
COCc1csc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450972765	GD	On-Demand	Anodyne	AVPR1B	17	43
COCc1csc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450972765	GD	On-Demand	Anodyne	LUXN	0	42
COc1cc(NC(=O)C[C@@H](CNC(C)=O)CC(C)C)ccc1F	ZINC000450972784	DF	On-Demand	Anodyne	SLC1A3	44	32
COc1cc(NC(=O)C[C@@H](CNC(C)=O)CC(C)C)ccc1F	ZINC000450972784	DF	On-Demand	Anodyne	SLC1A2	44	35
COc1cc(NC(=O)C[C@@H](CNC(C)=O)CC(C)C)ccc1F	ZINC000450972784	DF	On-Demand	Anodyne	ENPP1	58	33
N#CC1(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CCC1	ZINC000450972785	EG	On-Demand	Mild	SLC6A1	50	32
N#CC1(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CCC1	ZINC000450972785	EG	On-Demand	Mild	PREP	52	41
N#CC1(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CCC1	ZINC000450972785	EG	On-Demand	Mild	BIRC2	51	42
N#CC1(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CCC1	ZINC000450972786	EG	On-Demand	Mild	SLC6A1	50	32
N#CC1(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CCC1	ZINC000450972786	EG	On-Demand	Mild	PREP	52	41
N#CC1(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CCC1	ZINC000450972786	EG	On-Demand	Mild	BIRC2	51	42
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	HTR1B	16	43
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	PIK3CA	20	41
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	COLA	77	43
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	CPT1A	68	43
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	CPT2	50	39
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	PRNP	44	34
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	GRM4	16	48
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	NR1H4	0	41
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	EPHX2	16	46
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	CPT1B	59	41
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	TAAR1	30	43
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	ENPP1	48	29
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	DGAT1	31	44
COc1cc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)ccc1F	ZINC000450972787	FG	On-Demand	Anodyne	BRPF1	0	41
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	CA2	17	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	BMP1	132	48
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	NQO2	19	41
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP13	83	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	ADAM17	40	40
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	COLA	67	40
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	ROCK1	32	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP16	0	43
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	CA14	15	41
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MTNR1A	39	58
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MTNR1B	41	58
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP2	50	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP3	44	53
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP8	47	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	ROCK2	44	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP14	18	43
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	NPY5R	24	40
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	PTPRB	20	41
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP9	59	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP12	60	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	CA12	19	41
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	CA9	26	41
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	MMP1	48	45
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	FPR2	23	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	CDC42BPA	0	46
COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450972789	GG	On-Demand	Anodyne	LIMK2	19	45
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000450972806	FG	On-Demand	Anodyne	LPL	49	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000450972806	FG	On-Demand	Anodyne	L3MBTL3	67	37
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000450972806	FG	On-Demand	Anodyne	HPGD	42	38
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000450972806	FG	On-Demand	Anodyne	SLC6A7	0	42
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450972807	ED	On-Demand	Anodyne	SLC6A1	41	33
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450972807	ED	On-Demand	Anodyne	PREP	56	39
O=C(CCCc1ccccc1)N[C@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450972807	ED	On-Demand	Anodyne	BIRC2	50	42
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450972808	ED	On-Demand	Anodyne	SLC6A1	41	33
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450972808	ED	On-Demand	Anodyne	PREP	56	39
O=C(CCCc1ccccc1)N[C@@H]1CCCN(Cc2cnn[nH]2)C1	ZINC000450972808	ED	On-Demand	Anodyne	BIRC2	50	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	CA2	19	49
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	BMP1	86	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	CA1	40	35
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	MMP13	49	39
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	COLA	92	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	CA14	15	41
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	MMP2	40	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	MMP3	31	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	MMP8	41	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	MMP9	38	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	MMP12	54	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	MMP1	25	42
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	MTCA1	21	46
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	P96878_MYCTU	28	46
COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450972822	GG	On-Demand	Anodyne	GLMU	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(=O)n(C)c2)cc1	ZINC000450972823	ED	On-Demand	Anodyne	CA4	23	42
COC(=O)c1coc(CN2c3ccccc3[C@]3(C)CCCC[C@H]23)n1	ZINC000450972825	EH	On-Demand	Anodyne	NPPA	41	35
CN(CCc1ccccc1[N+](=O)[O-])Cc1cnn[nH]1	ZINC000450972835	CD	On-Demand	Bother	COLA	93	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCCC2)cc1	ZINC000450972841	EG	On-Demand	Anodyne	CA1	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCCC2)cc1	ZINC000450972841	EG	On-Demand	Anodyne	NPY2R	61	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC2CCCCC2)cc1	ZINC000450972841	EG	On-Demand	Anodyne	F13A1	43	45
Cc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c2c1CCC2	ZINC000450972852	FG	On-Demand	Anodyne	HTR4	58	38
Cc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c2c1CCC2	ZINC000450972852	FG	On-Demand	Anodyne	CACNA1I	71	43
Cc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)c2c1CCC2	ZINC000450972852	FG	On-Demand	Anodyne	HPGDS	34	41
N#CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450972855	GE	On-Demand	Mild	ADRB1	20	43
N#CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450972855	GE	On-Demand	Mild	ADRB3	17	43
N#CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450972855	GE	On-Demand	Mild	LUXN	0	43
N#CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450972855	GE	On-Demand	Mild	ADIPOR1	0	41
N#CCc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450972855	GE	On-Demand	Mild	ADIPOR2	0	41
COc1cc(CN2CCC(F)(C#N)CC2)ccc1Cl	ZINC000450972857	CG	On-Demand	Mild	SSTR5	40	35
COc1cc(CN2CCC(F)(C#N)CC2)ccc1Cl	ZINC000450972857	CG	On-Demand	Mild	MCHR2	40	31
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc2cnccc2c1	ZINC000450972877	FG	On-Demand	Anodyne	HTR4	41	35
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc2cnccc2c1	ZINC000450972877	FG	On-Demand	Anodyne	GRIN2B	17	40
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc2cnccc2c1	ZINC000450972877	FG	On-Demand	Anodyne	AKT1	0	46
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc2cnccc2c1	ZINC000450972877	FG	On-Demand	Anodyne	CACNA1I	73	48
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc2cnccc2c1	ZINC000450972877	FG	On-Demand	Anodyne	HPGDS	39	46
CC(C)(CF)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450972887	CE	On-Demand	Anodyne	PDEC	0	41
CC(C)(CF)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450972888	CE	On-Demand	Anodyne	PDEC	0	41
CN(Cc1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972895	GE	On-Demand	Anodyne	BMP1	55	34
CN(Cc1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972895	GE	On-Demand	Anodyne	MMP13	43	39
CN(Cc1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972895	GE	On-Demand	Anodyne	LUXN	0	48
CN(Cc1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972895	GE	On-Demand	Anodyne	ADIPOR1	0	42
CN(Cc1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450972895	GE	On-Demand	Anodyne	ADIPOR2	0	42
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1F	ZINC000450972909	GF	On-Demand	Anodyne	PKM	20	43
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1F	ZINC000450972909	GF	On-Demand	Anodyne	ADAMTS4	40	32
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1F	ZINC000450972909	GF	On-Demand	Anodyne	MCHR1	18	41
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1F	ZINC000450972909	GF	On-Demand	Anodyne	GPR119	0	41
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1F	ZINC000450972909	GF	On-Demand	Anodyne	PFK	0	44
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1F	ZINC000450972909	GF	On-Demand	Anodyne	LUXN	0	44
CCOC(=O)c1ccc(CN2CCC(F)(C#N)CC2)nc1	ZINC000450972911	CE	On-Demand	Mild	P2RY12	41	39
COc1cccc(-n2cc(C(=O)NC(C)(C)CF)nn2)c1	ZINC000450972913	CD	On-Demand	Anodyne	DRD4	42	33
COc1cccc(OCCC(=O)N2CCC([C@H](C)NC(C)=O)CC2)c1	ZINC000450972919	EE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CCC([C@H](C)NC(C)=O)CC2)c1	ZINC000450972919	EE	On-Demand	Anodyne	ACACB	28	41
COc1cccc(OCCC(=O)N2CCC([C@H](C)NC(C)=O)CC2)c1	ZINC000450972919	EE	On-Demand	Anodyne	MTNR1A	37	47
COc1cccc(OCCC(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c1	ZINC000450972920	EE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(OCCC(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c1	ZINC000450972920	EE	On-Demand	Anodyne	ACACB	28	41
COc1cccc(OCCC(=O)N2CCC([C@@H](C)NC(C)=O)CC2)c1	ZINC000450972920	EE	On-Demand	Anodyne	MTNR1A	37	47
N#CC1(F)CCN(Cc2cc(Cl)cc(CN3CCC(F)(C#N)CC3)c2)CC1	ZINC000450972932	GH	On-Demand	Mild	SIGMAR1	15	43
O=S(=O)(CCCCF)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000450972934	FH	On-Demand	Anodyne	F10	0	44
CCOC(=O)c1sc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)nc1C	ZINC000450972938	GF	On-Demand	Anodyne	DHODH	29	49
CCOC(=O)c1sc(NS(=O)(=O)C[C@H](OC)c2ccccc2)nc1C	ZINC000450972943	GF	On-Demand	Anodyne	DHODH	29	49
CCOC(=O)c1cc(S(=O)(=O)NCCCn2ccnc2)cnc1C(F)F	ZINC000450972954	GD	On-Demand	Anodyne	TBXAS1	47	39
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450972960	GD	On-Demand	Mild	AR	18	40
COCCO[C@@H]1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450972963	GD	On-Demand	Mild	AR	18	40
COCCO[C@H]1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450972965	GD	On-Demand	Mild	AR	18	40
COCCO[C@H]1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450972967	GD	On-Demand	Mild	AR	18	40
O=C(NCCc1ccccc1)c1ccccc1NS(=O)(=O)CCCCF	ZINC000450972977	GG	On-Demand	Anodyne	CA5B	16	40
O=C(NCCc1ccccc1)c1ccccc1NS(=O)(=O)CCCCF	ZINC000450972977	GG	On-Demand	Anodyne	SLC6A5	28	42
O=C(NCCc1ccccc1)c1ccccc1NS(=O)(=O)CCCCF	ZINC000450972977	GG	On-Demand	Anodyne	NCE103	18	44
CN(CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCCCC1(F)F	ZINC000450972978	DH	On-Demand	Bother	COLA	95	35
CN(CCc1ccccc1[N+](=O)[O-])C[C@H]1CCCCC1(F)F	ZINC000450972981	DH	On-Demand	Bother	COLA	95	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450972990	FG	On-Demand	Anodyne	PPIA	30	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450972990	FG	On-Demand	Anodyne	RAF1	20	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450972990	FG	On-Demand	Anodyne	FLT3	50	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450972990	FG	On-Demand	Anodyne	CSF1R	15	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450972990	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	26	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450972990	FG	On-Demand	Anodyne	RET	16	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450972990	FG	On-Demand	Anodyne	PFK	0	48
COc1ccccc1-n1cnc2cc(C(=O)N3CC(OC(F)F)C3)ccc21	ZINC000450972993	FG	On-Demand	Anodyne	PDGFRB	0	43
COc1ccccc1-n1cnc2cc(C(=O)N3CC(OC(F)F)C3)ccc21	ZINC000450972993	FG	On-Demand	Anodyne	HPGD	60	69
C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450973020	FE	On-Demand	Anodyne	CCR1	27	40
C[C@H]1CN(CC(C)(C)O)CCN1C(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450973021	FE	On-Demand	Anodyne	CCR1	27	40
COc1ccc(CNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450973033	FD	On-Demand	Anodyne	CA9	16	40
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA2	78	56
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA6	23	50
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA1	70	48
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA7	40	50
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA5B	39	52
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA4	46	48
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA5A	34	52
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA14	36	40
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA12	51	50
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA9	57	45
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CAH_METTE	25	43
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CYNT	39	50
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	NCE103	27	43
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	CA	0	50
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	A6YCJ1_9METZ	28	50
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973038	FD	On-Demand	Anodyne	Q5TU56_ANOGA	0	50
COc1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973040	DF	On-Demand	Anodyne	SLC18A2	22	41
COc1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973040	DF	On-Demand	Anodyne	BMP1	26	40
COc1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973040	DF	On-Demand	Anodyne	MMP3	33	45
COc1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973040	DF	On-Demand	Anodyne	MMP9	26	45
COc1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973040	DF	On-Demand	Anodyne	MMP1	40	45
COC(=O)c1cc(OC)c(OC)cc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450973043	GG	On-Demand	Anodyne	PRTN3	51	32
C=CCC1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CCCCC1	ZINC000450973046	GH	On-Demand	Mild	HRH2	41	37
C=CCC1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CCCCC1	ZINC000450973046	GH	On-Demand	Mild	FAAH	24	42
C=CCC1(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)CCCCC1	ZINC000450973046	GH	On-Demand	Mild	NPFFR1	47	32
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	DRD2	21	42
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	DRD4	46	44
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	ACHE	34	44
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	DRD3	26	42
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	SIGMAR1	53	57
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	CCR3	24	46
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	TRPV4	16	40
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	MCHR1	22	41
O=S(=O)(Cc1c(F)cccc1Cl)NC1CCN(Cc2ccccc2)CC1	ZINC000450973051	GH	On-Demand	Anodyne	SFRP1	48	34
COc1cc(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)ccc1O	ZINC000450973058	GF	On-Demand	Anodyne	P2RY12	21	55
COc1cc(CC(=O)N2CCN(c3ncnc4sc(C)cc34)CC2)ccc1O	ZINC000450973058	GF	On-Demand	Anodyne	PDGFRB	76	42
O=C(COc1ccc(S(=O)(=O)Nc2nc(C3CC3)cs2)cc1)NC1CC1	ZINC000450973059	GE	On-Demand	Anodyne	TNKS	40	31
O=C(COc1ccc(S(=O)(=O)Nc2nc(C3CC3)cs2)cc1)NC1CC1	ZINC000450973059	GE	On-Demand	Anodyne	LUXN	0	42
COc1ccc(-c2nc(NC3CCC3)sc2C)cc1OC	ZINC000450973083	DH	On-Demand	Anodyne	PDE4A	29	40
COc1ccc(-c2nc(NC3CCC3)sc2C)cc1OC	ZINC000450973083	DH	On-Demand	Anodyne	PRKDC	15	43
COc1ccc(-c2nc(NC3CCC3)sc2C)cc1OC	ZINC000450973083	DH	On-Demand	Anodyne	SSTR5	33	40
COc1ccc(-c2nc(NC3CCC3)sc2C)cc1OC	ZINC000450973083	DH	On-Demand	Anodyne	GAK	25	44
COc1ccc(-c2nc(NC3CCC3)sc2C)cc1OC	ZINC000450973083	DH	On-Demand	Anodyne	STK17B	42	37
Cc1csc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1	ZINC000450973104	EF	On-Demand	Anodyne	GCKR	19	44
O=S(=O)(C[C@@H]1CCCCC1(F)F)NCCc1c[nH]c2ccccc12	ZINC000450973119	FG	On-Demand	Anodyne	MC4R	29	41
O=S(=O)(C[C@@H]1CCCCC1(F)F)NCCc1c[nH]c2ccccc12	ZINC000450973119	FG	On-Demand	Anodyne	NMBR	40	30
O=S(=O)(C[C@@H]1CCCCC1(F)F)NCCc1c[nH]c2ccccc12	ZINC000450973119	FG	On-Demand	Anodyne	ALOX15	28	45
CCOc1ccc(OCC)c(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450973132	GE	On-Demand	Anodyne	PRTN3	50	31
CCOc1ccc(OCC)c(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450973132	GE	On-Demand	Anodyne	ALPL	25	41
C[C@@H]1CN(C(=O)c2cncc(Cl)c2)CCN1c1nc2ccccc2o1	ZINC000450973143	FG	On-Demand	Anodyne	SMO	36	41
C[C@H]1CN(C(=O)c2cncc(Cl)c2)CCN1c1nc2ccccc2o1	ZINC000450973144	FG	On-Demand	Anodyne	SMO	36	41
CCCCN(CC)S(=O)(=O)CCOCCN1C(=O)c2ccccc2C1=O	ZINC000450973147	GD	On-Demand	Anodyne	FBPC	0	46
COC(=O)C1CCN(S(=O)(=O)c2cc(C)cs2)CC1	ZINC000450973149	DD	On-Demand	Anodyne	LPL	44	35
COC(=O)C1CCN(S(=O)(=O)c2cc(C)cs2)CC1	ZINC000450973149	DD	On-Demand	Anodyne	EPHX2	42	42
COCc1cccc(COc2cccc3c2C(=O)CC3)c1	ZINC000450973155	CH	On-Demand	Anodyne	MAOB	22	40
C[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973158	FE	On-Demand	Anodyne	MMP13	22	41
C[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973158	FE	On-Demand	Anodyne	MMP2	17	41
C[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973158	FE	On-Demand	Anodyne	MMP14	16	41
C[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973158	FE	On-Demand	Anodyne	TRAR	32	40
C[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973159	FE	On-Demand	Anodyne	MMP13	22	41
C[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973159	FE	On-Demand	Anodyne	MMP2	17	41
C[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973159	FE	On-Demand	Anodyne	MMP14	16	41
C[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973159	FE	On-Demand	Anodyne	TRAR	32	40
C[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973160	FE	On-Demand	Anodyne	MMP13	22	41
C[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973160	FE	On-Demand	Anodyne	MMP2	17	41
C[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973160	FE	On-Demand	Anodyne	MMP14	16	41
C[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973160	FE	On-Demand	Anodyne	TRAR	32	40
C[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973161	FE	On-Demand	Anodyne	MMP13	22	41
C[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973161	FE	On-Demand	Anodyne	MMP2	17	41
C[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973161	FE	On-Demand	Anodyne	MMP14	16	41
C[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450973161	FE	On-Demand	Anodyne	TRAR	32	40
O=S(=O)(Nc1ccccc1N1CCCC1)c1c(Cl)ccc(F)c1F	ZINC000450973170	FI	On-Demand	Anodyne	KCNQ2	81	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	CA2	17	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	ADRB3	54	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	TBXAS1	52	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	CA1	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	CA5B	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	CA5A	21	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	CYP2C9	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	PFK	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCC(=O)Nc2cccnc2)cc1	ZINC000450973172	GD	On-Demand	Anodyne	NAMPT	65	48
Cc1cc(CN2CCN(S(=O)(=O)c3ccc4ccccc4c3F)CC2)no1	ZINC000450973175	GF	On-Demand	Anodyne	ADORA2B	40	35
Cc1cc(CN2CCN(S(=O)(=O)c3ccc4ccccc4c3F)CC2)no1	ZINC000450973175	GF	On-Demand	Anodyne	AURKA	0	40
O=C1CCCN1c1ccc(NS(=O)(=O)CCCCF)cc1	ZINC000450973186	DE	On-Demand	Anodyne	AKR1C3	23	45
O=C(Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450973190	GH	On-Demand	Anodyne	NAMPT	27	42
CCCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973195	FF	On-Demand	Anodyne	CA2	15	44
CCCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973195	FF	On-Demand	Anodyne	CA1	18	44
CCCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973195	FF	On-Demand	Anodyne	MMP13	24	44
CCCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973195	FF	On-Demand	Anodyne	P96878_MYCTU	25	44
CC(F)(F)c1cccc(NC(=O)Cc2ccccc2O[C@H]2CCOC2)c1	ZINC000450973199	FI	On-Demand	Anodyne	PDE4D	15	43
CC(F)(F)c1cccc(NC(=O)Cc2ccccc2O[C@@H]2CCOC2)c1	ZINC000450973200	FI	On-Demand	Anodyne	PDE4D	15	43
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)NCC(C)C)c1ccccc1	ZINC000450973201	GG	On-Demand	Anodyne	KCNA5	0	49
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)NCC(C)C)c1ccccc1	ZINC000450973201	GG	On-Demand	Anodyne	PRTN3	40	38
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)NCC(C)C)c1ccccc1	ZINC000450973202	GG	On-Demand	Anodyne	KCNA5	0	49
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)NCC(C)C)c1ccccc1	ZINC000450973202	GG	On-Demand	Anodyne	PRTN3	40	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(Cl)c2N(C)C)cc1	ZINC000450973203	GH	On-Demand	Anodyne	GRM4	25	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(Cl)c2N(C)C)cc1	ZINC000450973203	GH	On-Demand	Anodyne	PRTN3	49	31
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	ABL1	15	43
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	KIT	24	52
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	JUN	20	43
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	LCK	41	48
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	TRPV1	24	44
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	ATF1	45	32
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	CPT1A	0	44
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	FLT1	19	42
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	KDR	28	52
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	NR1H4	15	40
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	NFKB1	41	32
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	EPHB2	20	44
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	LYN	27	40
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	CSF1R	24	43
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	TEK	41	48
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	BTK	38	45
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	BRAF	42	45
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	EPHB4	21	40
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	TAAR1	52	42
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	AKR1C3	15	40
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	DDR1	39	41
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	SHH	45	35
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	DDR2	18	41
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	IMDH_CRYPV	55	35
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	NAMPT	16	42
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	KCNK3	124	49
CC(F)(F)c1cccc(NC(=O)c2ccc(C(C)(F)F)nc2)c1	ZINC000450973217	EJ	On-Demand	Anodyne	KCNK9	83	40
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1	ZINC000450973220	GF	On-Demand	Anodyne	KCNQ2	72	36
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1	ZINC000450973220	GF	On-Demand	Anodyne	SFRP1	59	33
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1	ZINC000450973220	GF	On-Demand	Anodyne	CREBBP	40	33
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1	ZINC000450973220	GF	On-Demand	Anodyne	WNT3	48	29
Cc1csc(S(=O)(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1	ZINC000450973220	GF	On-Demand	Anodyne	BRD9	40	33
CC[C@H](CC(F)(F)F)C(=O)Nc1c(F)cccc1OC	ZINC000450973221	CH	On-Demand	Anodyne	ACAT	0	43
CC[C@@H](CC(F)(F)F)C(=O)Nc1c(F)cccc1OC	ZINC000450973222	CH	On-Demand	Anodyne	ACAT	0	43
CSc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450973224	GF	On-Demand	Anodyne	ADRB1	16	41
CSc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450973224	GF	On-Demand	Anodyne	LUXN	0	47
CSc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450973224	GF	On-Demand	Anodyne	ADIPOR1	0	40
CSc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450973224	GF	On-Demand	Anodyne	ADIPOR2	0	40
CC1(S(=O)(=O)N2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)CC1	ZINC000450973237	GC	On-Demand	Bother	PKM	39	40
CC1(S(=O)(=O)N2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)CC1	ZINC000450973237	GC	On-Demand	Bother	AKR1C3	44	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)COCC3)cc1	ZINC000450973240	GF	On-Demand	Anodyne	CA2	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)COCC3)cc1	ZINC000450973240	GF	On-Demand	Anodyne	CA1	19	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)COCC3)cc1	ZINC000450973240	GF	On-Demand	Anodyne	CA4	23	41
COC(=O)[C@@H](NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1)C(C)C	ZINC000450973244	FC	On-Demand	Anodyne	ADAMTS4	57	39
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000450973246	FG	On-Demand	Anodyne	LPL	52	39
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000450973246	FG	On-Demand	Anodyne	CA1	17	40
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000450973246	FG	On-Demand	Anodyne	EPHX2	52	44
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1	ZINC000450973246	FG	On-Demand	Anodyne	NCE103	17	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCn3cccc3[C@@H]2C)cc1	ZINC000450973260	FF	On-Demand	Anodyne	F13A1	60	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCn3cccc3[C@H]2C)cc1	ZINC000450973261	FF	On-Demand	Anodyne	F13A1	60	33
Cc1cncn1C1CCN(C(=O)C2=C(c3ccccc3)CCCC2)CC1	ZINC000450973264	EI	On-Demand	Anodyne	L3MBTL3	55	36
COC(=O)COc1ccc(CN(C)C(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450973278	GG	On-Demand	Anodyne	MT-ND1	23	40
COC(=O)COc1ccc(CN(C)C(=O)c2ccc(C(C)(F)F)nc2)cc1	ZINC000450973278	GG	On-Demand	Anodyne	LIMK2	37	45
CO[C@@H](C)CS(=O)(=O)Nc1cc(-c2ccncc2)nn1C	ZINC000450973279	DD	On-Demand	Anodyne	GPR142	26	42
CO[C@H](C)CS(=O)(=O)Nc1cc(-c2ccncc2)nn1C	ZINC000450973280	DD	On-Demand	Anodyne	GPR142	26	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)no2)cc1	ZINC000450973297	FG	On-Demand	Anodyne	PPIA	27	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)no2)cc1	ZINC000450973297	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)(C)C)no2)cc1	ZINC000450973297	FG	On-Demand	Anodyne	PFK	0	42
CC(C)(C)NC(=O)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450973308	GE	On-Demand	Anodyne	CACNA1H	43	38
CC(C)(C)NC(=O)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450973308	GE	On-Demand	Anodyne	P2RY12	15	41
CC(C)(C)NC(=O)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450973308	GE	On-Demand	Anodyne	CCKAR	22	40
CC(C)(C)NC(=O)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450973308	GE	On-Demand	Anodyne	CCKBR	24	43
CC(C)(C)NC(=O)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450973308	GE	On-Demand	Anodyne	EPHX2	34	51
CC(C)(C)NC(=O)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450973308	GE	On-Demand	Anodyne	MCHR1	15	43
CC(C)(C)NC(=O)N1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450973308	GE	On-Demand	Anodyne	CACNA1I	27	47
COC(=O)C1(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450973309	FF	On-Demand	Anodyne	GHRHR	40	30
COC(=O)C1(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)CC1	ZINC000450973310	FF	On-Demand	Anodyne	GHRHR	40	30
COC(=O)c1ccccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973313	GF	On-Demand	Anodyne	CA1	49	38
COC(=O)c1ccccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973313	GF	On-Demand	Anodyne	MMP13	23	45
COC(=O)c1ccccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973313	GF	On-Demand	Anodyne	COLA	49	37
COC(=O)c1ccccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973313	GF	On-Demand	Anodyne	MMP9	24	45
COC(=O)c1ccccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973313	GF	On-Demand	Anodyne	MMP1	17	40
COC(=O)c1ccccc1N(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450973313	GF	On-Demand	Anodyne	P96878_MYCTU	40	38
CCN1CCC(NS(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450973316	EE	On-Demand	Mild	CCR8	57	32
CC(C)(CF)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450973324	EH	On-Demand	Anodyne	PYGL	43	36
CC(C)(CF)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450973324	EH	On-Demand	Anodyne	PYK	32	41
Cc1csc(S(=O)(=O)NCCCn2ccnc2)c1	ZINC000450973328	CD	On-Demand	Anodyne	TBXAS1	39	42
Cc1csc(S(=O)(=O)NCCCn2ccnc2)c1	ZINC000450973328	CD	On-Demand	Anodyne	HMOX2	45	32
CO[C@H](C)CS(=O)(=O)Nc1nc(-c2ccc(CCNC(C)=O)cc2)cs1	ZINC000450973331	GE	On-Demand	Anodyne	ROCK1	19	42
CO[C@H](C)CS(=O)(=O)Nc1nc(-c2ccc(CCNC(C)=O)cc2)cs1	ZINC000450973331	GE	On-Demand	Anodyne	SPHK2	49	38
CO[C@@H](C)CS(=O)(=O)Nc1nc(-c2ccc(CCNC(C)=O)cc2)cs1	ZINC000450973332	GE	On-Demand	Anodyne	ROCK1	19	42
CO[C@@H](C)CS(=O)(=O)Nc1nc(-c2ccc(CCNC(C)=O)cc2)cs1	ZINC000450973332	GE	On-Demand	Anodyne	SPHK2	49	38
N#CCc1ccc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c(Cl)c1	ZINC000450973355	GI	On-Demand	Mild	KCNQ2	75	42
N#CCc1ccc(S(=O)(=O)Nc2ccccc2N2CCCCC2)c(Cl)c1	ZINC000450973355	GI	On-Demand	Mild	CSF1R	0	42
Cn1cc([C@H]2CN(CCc3ccc(Cl)cc3)C[C@@H]2C(N)=O)cn1	ZINC000450973365	ED	On-Demand	Anodyne	SLC6A1	37	44
CC(=O)N[C@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)C(C)(C)C	ZINC000450973371	FD	On-Demand	Anodyne	CACNA1I	56	37
c1ccc(OCCOCCn2cnc3c2CCCC3)cc1	ZINC000450973378	CF	On-Demand	Anodyne	LTA4H	42	39
c1ccc(OCCOCCn2cnc3c2CCCC3)cc1	ZINC000450973378	CF	On-Demand	Anodyne	HNMT	45	36
O=C(c1ccccc1-n1cc(Br)cn1)N1CC(OC(F)F)C1	ZINC000450973385	FF	On-Demand	Anodyne	HCRTR1	46	35
O=C(c1ccccc1-n1cc(Br)cn1)N1CC(OC(F)F)C1	ZINC000450973385	FF	On-Demand	Anodyne	HCRTR2	49	35
CN(CCCC(=O)c1ccccc1)CCc1ccccc1[N+](=O)[O-]	ZINC000450973388	EH	On-Demand	Bother	THRA	25	44
CN(CCCC(=O)c1ccccc1)CCc1ccccc1[N+](=O)[O-]	ZINC000450973388	EH	On-Demand	Bother	COLA	120	40
CN(CCCC(=O)c1ccccc1)CCc1ccccc1[N+](=O)[O-]	ZINC000450973388	EH	On-Demand	Bother	PQSD	0	43
Cc1ccn(-c2ccccc2C(=O)N2CC(OC(F)F)C2)n1	ZINC000450973394	DE	On-Demand	Anodyne	HCRTR1	45	35
Cc1ccn(-c2ccccc2C(=O)N2CC(OC(F)F)C2)n1	ZINC000450973394	DE	On-Demand	Anodyne	HCRTR2	48	35
CCOC(=O)c1c(Cn2cnc3c2CCCC3)nc2ccccc2c1C	ZINC000450973396	EH	On-Demand	Anodyne	TSPO	17	42
CCCOc1ccc(C(=O)N2CC(OC(F)F)C2)c(OC)c1	ZINC000450973400	DF	On-Demand	Anodyne	OXTR	0	40
N#CCc1ccc(S(=O)(=O)N2CCN(c3ccccc3F)CC2)c(Cl)c1	ZINC000450973408	GG	On-Demand	Mild	TRPV4	46	38
CC(C)C[C@@H](C)S(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450973413	DG	On-Demand	Anodyne	AKR1C3	29	53
CC(C)C[C@H](C)S(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000450973414	DG	On-Demand	Anodyne	AKR1C3	29	53
O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccsn1	ZINC000450973418	DE	On-Demand	Anodyne	CACNA1I	68	40
O=S(=O)(Nc1ccccc1N1CCCCC1)c1cnc(O)s1	ZINC000450973420	EF	On-Demand	Anodyne	KCNQ2	77	39
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	HTR4	66	39
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	CACNA1B	44	32
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	CETP	0	43
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	LIPC	0	45
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	MTTP	41	38
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	CCR2	87	49
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	MCHR1	23	41
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	CACNA1I	86	51
Cc1cc(C(F)(F)F)ccc1C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000450973422	GI	On-Demand	Anodyne	LIPG	56	45
COCCO[C@H]1CCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450973438	ED	On-Demand	Anodyne	P2RY12	149	40
COCCO[C@@H]1CCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450973439	ED	On-Demand	Anodyne	P2RY12	149	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(C)Cc2cccs2)c1	ZINC000450973447	FH	On-Demand	Anodyne	BMP1	30	49
O=S(=O)(NCCCn1ccnc1)c1sccc1Cl	ZINC000450973450	DD	On-Demand	Anodyne	TBXAS1	44	47
O=S(=O)(NCCCn1ccnc1)c1sccc1Cl	ZINC000450973450	DD	On-Demand	Anodyne	CYP17A1	23	43
O=S(=O)(NCCCn1ccnc1)c1sccc1Cl	ZINC000450973450	DD	On-Demand	Anodyne	HMOX2	52	38
O=S(=O)(NCCCn1ccnc1)c1sccc1Cl	ZINC000450973450	DD	On-Demand	Anodyne	QPCT	40	40
Cc1ccn2ncc(C(=O)N3CCN(C4CC4)c4c(C)cccc43)c2c1	ZINC000450973451	EH	On-Demand	Anodyne	EPHB3	27	40
Cc1ccn2ncc(C(=O)N3CCN(C4CC4)c4c(C)cccc43)c2c1	ZINC000450973451	EH	On-Demand	Anodyne	GPBAR1	54	45
CN(CCN1CCC(F)(C#N)CC1)Cc1ccccc1	ZINC000450973454	CE	On-Demand	Mild	SIGMAR1	37	42
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1	ZINC000450973455	FF	On-Demand	Anodyne	LPL	42	33
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1	ZINC000450973456	FF	On-Demand	Anodyne	LPL	42	33
N#CC1(F)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450973461	FH	On-Demand	Mild	DRD2	33	47
N#CC1(F)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450973461	FH	On-Demand	Mild	DRD1	15	46
N#CC1(F)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450973461	FH	On-Demand	Mild	DRD4	0	47
N#CC1(F)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450973461	FH	On-Demand	Mild	ERG2	22	47
N#CC1(F)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450973461	FH	On-Demand	Mild	SLC18A3	25	47
N#CC1(F)CCN(CCCC(=O)c2ccc(Br)cc2)CC1	ZINC000450973461	FH	On-Demand	Mild	CYP2J2	52	37
C[C@@H](CN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O	ZINC000450973462	EG	On-Demand	Anodyne	CACNA1B	55	38
C[C@@H](CN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O	ZINC000450973463	EG	On-Demand	Anodyne	CACNA1B	55	38
C[C@H](CN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O	ZINC000450973464	EG	On-Demand	Anodyne	CACNA1B	55	38
C[C@H](CN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O	ZINC000450973465	EG	On-Demand	Anodyne	CACNA1B	55	38
COCCO[C@H]1CCN(C(=O)c2ccccc2-n2cc(Br)cn2)C1	ZINC000450973466	GF	On-Demand	Anodyne	HCRTR1	44	34
COCCO[C@@H]1CCN(C(=O)c2ccccc2-n2cc(Br)cn2)C1	ZINC000450973467	GF	On-Demand	Anodyne	HCRTR1	44	34
O=S(=O)(C[C@H]1CCCCC1(F)F)NCCc1c[nH]c2ccccc12	ZINC000450973473	FG	On-Demand	Anodyne	MC4R	29	41
O=S(=O)(C[C@H]1CCCCC1(F)F)NCCc1c[nH]c2ccccc12	ZINC000450973473	FG	On-Demand	Anodyne	NMBR	40	30
O=S(=O)(C[C@H]1CCCCC1(F)F)NCCc1c[nH]c2ccccc12	ZINC000450973473	FG	On-Demand	Anodyne	ALOX15	28	45
CCn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1=O	ZINC000450973480	FE	On-Demand	Anodyne	CA2	19	49
CCn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1=O	ZINC000450973480	FE	On-Demand	Anodyne	CA1	25	42
CN(CCc1ccccn1)S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450973485	EF	On-Demand	Anodyne	GNRHR	25	44
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	TBXA2R	43	36
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	TBXAS1	40	39
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	CYSLTR2	59	36
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	MMP13	34	47
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	ADAM17	19	47
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	MMP2	32	47
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	MMP14	22	47
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	ALOX15	51	39
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	MMP9	22	47
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	TGM2	21	40
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	ADAMTS4	50	40
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	MMP1	18	40
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	TNKS	57	33
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	LUXN	0	48
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	ADIPOR1	0	51
O=C(COc1ccc(S(=O)(=O)NCCCc2ccccc2)cc1)NC1CC1	ZINC000450973487	GE	On-Demand	Anodyne	ADIPOR2	0	51
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450973488	GF	On-Demand	Anodyne	MMP13	0	41
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450973488	GF	On-Demand	Anodyne	MAPK10	15	40
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450973488	GF	On-Demand	Anodyne	SCN10A	19	44
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-c4cnn(C)c4)o3)c2)CC1	ZINC000450973488	GF	On-Demand	Anodyne	MAP3K7	42	33
Cc1ccc2cc(S(=O)(=O)N(C)C(C)C)ccc2c1	ZINC000450973490	CG	On-Demand	Anodyne	CYP2A5	0	45
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000450973491	FF	On-Demand	Anodyne	DRD2	0	46
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000450973491	FF	On-Demand	Anodyne	DRD3	32	45
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000450973491	FF	On-Demand	Anodyne	BCHE	0	42
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000450973491	FF	On-Demand	Anodyne	CCR8	43	34
N#CC1(CS(=O)(=O)c2ccc(Cl)cc2Cl)CCC1	ZINC000450973506	DG	On-Demand	Mild	TRPV4	43	36
CCC[C@H](O)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450973507	DD	On-Demand	Anodyne	CHRM4	18	46
CCC[C@@H](O)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450973508	DD	On-Demand	Anodyne	CHRM4	18	46
CCC[C@H](O)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450973509	DD	On-Demand	Anodyne	CHRM4	18	46
CCC[C@@H](O)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450973511	DD	On-Demand	Anodyne	CHRM4	18	46
CC(=O)c1cccc(CN2CCC(F)(C#N)CC2)c1	ZINC000450973515	CF	On-Demand	Mild	CHRM3	19	47
CC(=O)c1cccc(CN2CCC(F)(C#N)CC2)c1	ZINC000450973515	CF	On-Demand	Mild	SIGMAR1	25	41
CC(=O)c1cccc(CN2CCC(F)(C#N)CC2)c1	ZINC000450973515	CF	On-Demand	Mild	MCHR2	56	35
CC(=O)c1cccc(CN2CCC(F)(C#N)CC2)c1	ZINC000450973515	CF	On-Demand	Mild	CCR8	39	41
CC(=O)c1cccc(CN2CCC(F)(C#N)CC2)c1	ZINC000450973515	CF	On-Demand	Mild	NPFFR1	44	34
COC(=O)COc1ccc(CN(C)C(=O)c2ccc(C)c3c2CCC3)cc1	ZINC000450973520	FG	On-Demand	Anodyne	LIMK2	23	40
CCO[C@@H]1C[C@@H](NCC(=O)N[C@@H](CC(C)C)C(=O)OC)C12CCCC2	ZINC000450973527	FE	On-Demand	Anodyne	FOLH1	40	36
CCO[C@@H]1C[C@@H](NCC(=O)N[C@H](CC(C)C)C(=O)OC)C12CCCC2	ZINC000450973528	FE	On-Demand	Anodyne	FOLH1	40	36
CCO[C@@H]1C[C@H](NCC(=O)N[C@@H](CC(C)C)C(=O)OC)C12CCCC2	ZINC000450973529	FE	On-Demand	Anodyne	FOLH1	40	36
CCO[C@@H]1C[C@H](NCC(=O)N[C@H](CC(C)C)C(=O)OC)C12CCCC2	ZINC000450973530	FE	On-Demand	Anodyne	FOLH1	40	36
CN(Cc1ccccc1F)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450973547	FE	On-Demand	Anodyne	NR1H3	15	41
CN(Cc1ccccc1F)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450973547	FE	On-Demand	Anodyne	NR1H2	19	41
CC(=O)[C@](C)(O)CN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450973548	EG	On-Demand	Anodyne	CACNA1B	52	35
CC(=O)[C@](C)(O)CN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450973549	EG	On-Demand	Anodyne	CACNA1B	52	35
CC(=O)[C@@](C)(O)CN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450973551	EG	On-Demand	Anodyne	CACNA1B	52	35
CC(=O)[C@@](C)(O)CN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450973553	EG	On-Demand	Anodyne	CACNA1B	52	35
Cc1nc(-c2c(C)noc2C)sc1Cc1ccccc1F	ZINC000450973568	DI	On-Demand	Anodyne	BRD4	16	41
O=C(CC(F)(F)F)NC[C@@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450973571	EG	On-Demand	Anodyne	CHRM4	16	48
O=C(CC(F)(F)F)NC[C@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450973572	EG	On-Demand	Anodyne	CHRM4	16	48
O=C(CC(F)(F)F)NC[C@@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1	ZINC000450973573	EG	On-Demand	Anodyne	CHRM4	16	48
O=C(CC(F)(F)F)NC[C@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC000450973574	EG	On-Demand	Anodyne	CHRM4	16	48
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450973577	FE	On-Demand	Anodyne	HTR1D	19	40
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450973577	FE	On-Demand	Anodyne	SIGMAR1	24	42
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450973577	FE	On-Demand	Anodyne	CCR3	51	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450973577	FE	On-Demand	Anodyne	FAAH	23	50
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450973577	FE	On-Demand	Anodyne	EPHX2	21	41
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450973577	FE	On-Demand	Anodyne	MCHR1	22	42
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3C(F)(F)F)c2)CC1	ZINC000450973577	FE	On-Demand	Anodyne	BRD3	15	41
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)on1	ZINC000450973585	GD	On-Demand	Anodyne	GYRB	0	44
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)on1	ZINC000450973585	GD	On-Demand	Anodyne	P2RY12	67	42
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)on1	ZINC000450973585	GD	On-Demand	Anodyne	P2RY14	42	34
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)on1	ZINC000450973585	GD	On-Demand	Anodyne	LIMK2	40	31
CCOC(=O)c1cc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)on1	ZINC000450973585	GD	On-Demand	Anodyne	KCNK3	40	33
CO[C@H](C)CS(=O)(=O)Nc1nc2ccc(OC(F)(F)F)cc2s1	ZINC000450973589	FF	On-Demand	Anodyne	CSNK1D	34	49
CO[C@@H](C)CS(=O)(=O)Nc1nc2ccc(OC(F)(F)F)cc2s1	ZINC000450973590	FF	On-Demand	Anodyne	CSNK1D	34	49
Cc1cc2c(N3CCN(C(=O)C[C@@H]4CC[C@@H]5C[C@H]45)CC3)ncnc2s1	ZINC000450973606	FG	On-Demand	Anodyne	SIRT3	48	31
Cc1cc2c(N3CCN(C(=O)C[C@@H]4CC[C@H]5C[C@H]45)CC3)ncnc2s1	ZINC000450973607	FG	On-Demand	Anodyne	SIRT3	52	32
Cc1cc2c(N3CCN(C(=O)C[C@@H]4CC[C@@H]5C[C@@H]45)CC3)ncnc2s1	ZINC000450973608	FG	On-Demand	Anodyne	SIRT3	52	32
Cc1cc2c(N3CCN(C(=O)C[C@@H]4CC[C@H]5C[C@@H]45)CC3)ncnc2s1	ZINC000450973609	FG	On-Demand	Anodyne	SIRT3	48	31
CCCC(=O)Nc1ccc(-c2csc(-c3c(C)noc3C)n2)cc1	ZINC000450973612	EJ	On-Demand	Anodyne	SREBF2	0	48
O=C(CN1CCOCC1)Nc1ccc(NS(=O)(=O)CCC2CCCC2)cc1	ZINC000450973637	GE	On-Demand	Anodyne	EPHX2	26	41
COc1cccc(F)c1NC(=O)Cc1ccc(S(=O)(=O)CC2CC2)cc1	ZINC000450973642	GG	On-Demand	Anodyne	RORC	58	37
CCN1CCC[C@@H]1CNS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450973644	EC	On-Demand	Anodyne	NPY2R	44	36
CCN1CCC[C@H]1CNS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450973645	EC	On-Demand	Anodyne	NPY2R	44	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)[C@@H](C)c2ccccc2)cc1	ZINC000450973647	FH	On-Demand	Anodyne	COLA	75	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)[C@@H](C)c2ccccc2)cc1	ZINC000450973647	FH	On-Demand	Anodyne	MMP2	26	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)[C@H](C)c2ccccc2)cc1	ZINC000450973648	FH	On-Demand	Anodyne	COLA	75	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)[C@H](C)c2ccccc2)cc1	ZINC000450973648	FH	On-Demand	Anodyne	MMP2	26	42
O=C(CSc1ccc(Br)c(Cl)c1)NC1CC1	ZINC000450973654	DG	On-Demand	Anodyne	SIGMAR1	18	41
COC(=O)[C@@H](NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1)C(C)C	ZINC000450973662	FE	On-Demand	Anodyne	MMP13	28	48
COC(=O)[C@@H](NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1)C(C)C	ZINC000450973662	FE	On-Demand	Anodyne	MMP2	17	48
COC(=O)[C@@H](NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1)C(C)C	ZINC000450973662	FE	On-Demand	Anodyne	MMP12	51	40
COC(=O)[C@@H](NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1)C(C)C	ZINC000450973662	FE	On-Demand	Anodyne	ADAMTS4	58	43
COC(=O)[C@@H](NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1)C(C)C	ZINC000450973662	FE	On-Demand	Anodyne	LEF	26	46
CN1CCCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1	ZINC000450973667	DD	On-Demand	Anodyne	PKM	20	40
CCOC(=O)CC1(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)CC1	ZINC000450973676	FG	On-Demand	Anodyne	TIMP3	44	32
CCOC(=O)CC1(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C2CC2)CC1	ZINC000450973677	FG	On-Demand	Anodyne	TIMP3	44	32
CCCOc1ccc(C(=O)Nc2c(F)cccc2OC)c(OC)c1	ZINC000450973698	EH	On-Demand	Anodyne	PYGL	0	47
CCCOc1ccc(C(=O)Nc2c(F)cccc2OC)c(OC)c1	ZINC000450973698	EH	On-Demand	Anodyne	PDGFRA	32	40
CCCOc1ccc(C(=O)Nc2c(F)cccc2OC)c(OC)c1	ZINC000450973698	EH	On-Demand	Anodyne	LUCI_LUCLA	16	43
CCCOc1ccc(C(=O)Nc2c(F)cccc2OC)c(OC)c1	ZINC000450973698	EH	On-Demand	Anodyne	KCNK3	61	44
CCCOc1ccc(C(=O)Nc2c(F)cccc2OC)c(OC)c1	ZINC000450973698	EH	On-Demand	Anodyne	KCNK9	51	44
CCN1CCN(c2ccccc2NS(=O)(=O)c2cc(C)cs2)CC1	ZINC000450973699	FF	On-Demand	Anodyne	BRD9	40	31
CN(C)CCCN(CCCN(C)C)S(=O)(=O)c1ccc2[nH]c(=O)cnc2c1	ZINC000450973709	GC	On-Demand	Anodyne	BDKRB1	0	41
COc1cc2c(cc1OC)CN(S(=O)(=O)c1cc(C)cs1)CC2	ZINC000450973710	FF	On-Demand	Anodyne	ABCB1B	48	34
O=S(=O)(CC1CC(F)(F)C1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000450973729	GG	On-Demand	Anodyne	ME1	0	43
CO[C@H](C)CS(=O)(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1	ZINC000450973734	GH	On-Demand	Anodyne	RPA1	67	34
CO[C@@H](C)CS(=O)(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1	ZINC000450973739	GH	On-Demand	Anodyne	RPA1	67	34
CN(CCOc1ccccc1)S(=O)(=O)CCOCc1ccccc1	ZINC000450973750	EF	On-Demand	Anodyne	ESRRG	45	33
CCN1CCC(NS(=O)(=O)c2cc(OC)cc(C(F)(F)F)c2)CC1	ZINC000450973765	FE	On-Demand	Anodyne	SFRP1	110	38
CCN1CCC(NS(=O)(=O)c2cc(OC)cc(C(F)(F)F)c2)CC1	ZINC000450973765	FE	On-Demand	Anodyne	WNT3	71	34
COc1cc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)ccc1F	ZINC000450973783	CF	On-Demand	Anodyne	KCNK3	42	38
COc1cc(NC(=O)[C@@H]2C[C@H]2C(F)(F)F)ccc1F	ZINC000450973783	CF	On-Demand	Anodyne	KCNK9	40	38
CNC(=O)c1ccc(CS(=O)(=O)N(Cc2ccccc2)C(C)C)cc1	ZINC000450973787	FF	On-Demand	Anodyne	RORB	0	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	NR3C1	0	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	NR3C2	0	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	ACE	20	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	SSTR2	43	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	OPRM1	0	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	OPRD1	0	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	GHRHR	31	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MME	27	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	EDNRB	50	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	EDNRA	42	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	TACR1	35	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MC4R	40	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	BMP1	28	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	TACR2	34	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	KCNA5	0	62
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	CCKAR	113	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	CTSL	30	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	BRS3	26	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	NMBR	59	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MC3R	59	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MC5R	57	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MMP2	29	49
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MMP8	34	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MMP14	22	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	GRPR	80	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	ECE1	64	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MMP11	77	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	CCKBR	94	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	GHSR	70	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MMP9	26	49
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MC1R	85	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	ADAM9	39	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	MMP1	20	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	NPR	33	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	SLC15A2	0	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	KISS1R	68	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	ERAP2	42	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1CC(F)(F)C1	ZINC000450973792	GE	On-Demand	Anodyne	LASB	0	42
CN(C)[C@@H](CNS(=O)(=O)CCC1CCCC1)c1ccccc1	ZINC000450973801	DF	On-Demand	Anodyne	OPRK1	22	43
CN(C)[C@H](CNS(=O)(=O)CCC1CCCC1)c1ccccc1	ZINC000450973802	DF	On-Demand	Anodyne	OPRK1	22	43
CC(C)C(=O)Nc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1	ZINC000450973803	GF	On-Demand	Anodyne	AADAC	0	40
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	CA2	16	52
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	ADRB1	21	42
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	ADRB3	18	40
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	TBXA2R	54	43
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	TBXAS1	18	41
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	CA1	16	42
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	MMP13	18	40
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	ALOX15	42	36
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	CA12	19	42
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	CA9	15	41
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	LUXN	0	41
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	ADIPOR1	0	42
O=C(COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1)NC1CC1	ZINC000450973804	GE	On-Demand	Anodyne	ADIPOR2	0	42
Cc1csc(S(=O)(=O)Nc2cc(C(N)=O)ccc2N2CCCC2)c1	ZINC000450973805	FF	On-Demand	Anodyne	KCNQ2	44	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N3CCCC3)nc2)cc1	ZINC000450973809	GG	On-Demand	Anodyne	TGM2	24	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N3CCCC3)nc2)cc1	ZINC000450973809	GG	On-Demand	Anodyne	F13A1	30	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N3CCCC3)nc2)cc1	ZINC000450973809	GG	On-Demand	Anodyne	DGAT1	29	41
Cn1cc(S(=O)(=O)Nc2ccc(N3CCOCC3)cn2)c(C(F)(F)F)n1	ZINC000450973810	GD	On-Demand	Anodyne	STAT6	47	31
CN(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cn1	ZINC000450973813	GD	On-Demand	Anodyne	LUXN	0	44
COC(=O)c1ncccc1S(=O)(=O)N1CCCC[C@@H]1C	ZINC000450973817	CD	On-Demand	Anodyne	MMP7	26	42
COC(=O)c1ncccc1S(=O)(=O)N1CCCC[C@H]1C	ZINC000450973818	CD	On-Demand	Anodyne	MMP7	26	42
COC(=O)c1ccc(C(=O)CS(=O)(=O)c2ccc(N3CCCC3=O)cc2)o1	ZINC000450973826	GD	On-Demand	Anodyne	AKR1C3	25	44
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC(OC(F)F)C1	ZINC000450973843	EF	On-Demand	Bother	LIPG	53	35
O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC(OC(F)F)C1	ZINC000450973843	EF	On-Demand	Bother	PPXII	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccnn2C(C)C)cc1	ZINC000450973853	FF	On-Demand	Anodyne	OXTR	44	36
CCOC(=O)C1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450973854	FF	On-Demand	Anodyne	GYRB	0	40
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1F	ZINC000450973855	EF	On-Demand	Anodyne	NR1I2	43	36
CCOC(=O)C1CCN(S(=O)(=O)c2cccc3c(Cl)ccnc23)CC1	ZINC000450973857	GF	On-Demand	Anodyne	EPHX2	35	42
CCOCc1nc(C)c(C(=O)Nc2c(C)cccc2SC)s1	ZINC000450973864	EI	On-Demand	Anodyne	LCK	19	42
CC(C)O[C@@]1(C(=O)NCC2CCN(CC(F)(F)F)CC2)CCOC1	ZINC000450973865	FD	On-Demand	Anodyne	CACNA1I	53	37
CC(C)O[C@]1(C(=O)NCC2CCN(CC(F)(F)F)CC2)CCOC1	ZINC000450973866	FD	On-Demand	Anodyne	CACNA1I	53	37
CCOC(=O)c1sc(NS(=O)(=O)c2sc(C)cc2C)nc1C	ZINC000450973867	FG	On-Demand	Anodyne	DHODH	28	51
O=S(=O)(Nc1ccccc1N1CCCCC1)c1sccc1Cl	ZINC000450973875	FI	On-Demand	Anodyne	KCNQ2	78	44
O=S(=O)(Nc1ccccc1N1CCCCC1)c1sccc1Cl	ZINC000450973875	FI	On-Demand	Anodyne	GRM4	15	40
CC(C)CCN(CCC(C)C)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450973880	GG	On-Demand	Anodyne	RORC	30	54
CC(C)CCN(CCC(C)C)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450973880	GG	On-Demand	Anodyne	RORB	0	54
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450973882	EE	On-Demand	Anodyne	CA1	24	40
CC(C)(CF)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450973883	EH	On-Demand	Anodyne	AVPR1B	42	44
CC(C)(CF)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450973883	EH	On-Demand	Anodyne	PDE6D	90	40
CC(C)(CF)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450973883	EH	On-Demand	Anodyne	HDAC8	26	42
CC(C)(CF)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450973883	EH	On-Demand	Anodyne	HDAC6	15	42
CC(C)(CF)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450973883	EH	On-Demand	Anodyne	PLM2_PLAFA	0	48
CC(C)(CF)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450973883	EH	On-Demand	Anodyne	PTGES2	44	32
CC(C)(CF)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450973883	EH	On-Demand	Anodyne	IMDH_CRYPV	38	57
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450973892	FH	On-Demand	Anodyne	HTR4	40	34
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450973892	FH	On-Demand	Anodyne	SCN9A	0	42
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450973893	FH	On-Demand	Anodyne	HTR4	40	34
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450973893	FH	On-Demand	Anodyne	SCN9A	0	42
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450973894	FH	On-Demand	Anodyne	HTR4	40	34
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450973894	FH	On-Demand	Anodyne	SCN9A	0	42
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450973895	FH	On-Demand	Anodyne	HTR4	40	34
O=C(NCC1CCN(CC(F)(F)F)CC1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450973895	FH	On-Demand	Anodyne	SCN9A	0	42
CCc1c(C(=O)NCC2CCN(CC(F)(F)F)CC2)oc2ccccc12	ZINC000450973897	FH	On-Demand	Anodyne	HTR4	68	43
CCc1c(C(=O)NCC2CCN(CC(F)(F)F)CC2)oc2ccccc12	ZINC000450973897	FH	On-Demand	Anodyne	CACNA1I	60	39
CSc1cccc(C)c1NC(=O)CCCC(C)C	ZINC000450973907	CI	On-Demand	Anodyne	ACAT	0	47
Cc1cccc(Cl)c1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450973925	GI	On-Demand	Anodyne	P2RX7	47	43
Cc1cccc(Cl)c1C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450973925	GI	On-Demand	Anodyne	RBP4	42	35
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450973926	GI	On-Demand	Anodyne	P2RX7	47	43
Cc1cccc(Cl)c1C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450973926	GI	On-Demand	Anodyne	RBP4	42	35
CCOC(=O)c1cc(C(=O)N2CCN(C3CC3)c3c(C)cccc32)[nH]c1C	ZINC000450973932	FG	On-Demand	Anodyne	GPBAR1	43	42
CC(=O)N1CCN(Cc2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)CC1	ZINC000450973935	FF	On-Demand	Anodyne	HTR1D	23	41
CC(=O)N1CCN(Cc2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)CC1	ZINC000450973935	FF	On-Demand	Anodyne	MGLL	0	41
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	HTR1A	18	44
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	HTR7	24	43
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	HDAC8	17	41
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	HDAC10	40	44
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	MAPK1	16	40
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	HDAC1	17	44
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	HDAC2	28	44
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	HDAC3	47	44
CC(=O)N1CCN(c2cccc(NC(=O)CCCC(=O)C3CC3)c2)CC1	ZINC000450973939	FE	On-Demand	Anodyne	HDAC6	38	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccnn2C)cc1	ZINC000450973944	DD	On-Demand	Anodyne	SCN9A	0	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccnn2C)cc1	ZINC000450973944	DD	On-Demand	Anodyne	PFK	0	44
CCCCCc1nnc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)s1	ZINC000450973953	GH	On-Demand	Anodyne	CA4	52	39
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1ocnc1-c1ccccc1	ZINC000450973974	FI	On-Demand	Anodyne	GPBAR1	44	37
CC1CCN(S(=O)(=O)c2ccc(C3CC3)cc2)CC1	ZINC000450973976	CF	On-Demand	Anodyne	AKR1C3	33	56
CC1CCN(S(=O)(=O)c2ccc(C3CC3)cc2)CC1	ZINC000450973976	CF	On-Demand	Anodyne	DDIT3	0	47
O=C1CCC(CN2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450973983	EJ	On-Demand	Anodyne	CCR2	23	41
O=C1CCC(CN2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000450973985	EJ	On-Demand	Anodyne	CCR2	23	41
CN(CCN1CCC[C@H](S(=O)(=O)N(C)C)C1)Cc1ccccc1	ZINC000450974005	ED	On-Demand	Anodyne	SLC6A1	86	37
CN(CCN1CCC[C@H](S(=O)(=O)N(C)C)C1)Cc1ccccc1	ZINC000450974005	ED	On-Demand	Anodyne	SIGMAR1	28	47
CN(CCN1CCC[C@@H](S(=O)(=O)N(C)C)C1)Cc1ccccc1	ZINC000450974007	ED	On-Demand	Anodyne	SLC6A1	86	37
CN(CCN1CCC[C@@H](S(=O)(=O)N(C)C)C1)Cc1ccccc1	ZINC000450974007	ED	On-Demand	Anodyne	SIGMAR1	28	47
CCOC(=O)c1cnn(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1C	ZINC000450974021	FG	On-Demand	Anodyne	SIGMAR1	24	40
CCOC(=O)c1cnn(C2CCN(Cc3ccc(C(C)=O)cc3)CC2)c1C	ZINC000450974021	FG	On-Demand	Anodyne	SSTR5	48	37
Cc1ccc(OCCNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450974023	GD	On-Demand	Anodyne	DRD4	16	43
C[C@H]1CC[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450974025	DF	On-Demand	Bother	CACNA1D	70	36
C[C@@H]1CC[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450974027	DF	On-Demand	Bother	CACNA1D	70	36
C[C@H]1CC[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450974029	DF	On-Demand	Bother	CACNA1D	70	36
C[C@@H]1CC[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450974031	DF	On-Demand	Bother	CACNA1D	70	36
COC(=O)c1cc(Cl)c(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1OC	ZINC000450974033	GH	On-Demand	Anodyne	HTR4	67	37
COc1cccc(F)c1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000450974041	CG	On-Demand	Anodyne	PYGL	0	43
CCOC(=O)c1sc(N(C)S(=O)(=O)c2sccc2Cl)nc1C	ZINC000450974045	GG	On-Demand	Anodyne	DHODH	20	44
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974047	FG	On-Demand	Anodyne	CA2	17	51
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974047	FG	On-Demand	Anodyne	BMP1	46	39
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974047	FG	On-Demand	Anodyne	COLA	88	44
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974047	FG	On-Demand	Anodyne	MMP2	27	40
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974047	FG	On-Demand	Anodyne	MMP12	41	38
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974047	FG	On-Demand	Anodyne	CA12	16	40
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974047	FG	On-Demand	Anodyne	CA9	20	40
O=S(=O)(Cc1c(F)cccc1Cl)NCCc1ccc2c(c1)OCCO2	ZINC000450974050	GF	On-Demand	Anodyne	PKM	32	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1	ZINC000450974053	GH	On-Demand	Mild	CA2	17	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1	ZINC000450974053	GH	On-Demand	Mild	CA1	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1	ZINC000450974053	GH	On-Demand	Mild	CA4	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1	ZINC000450974053	GH	On-Demand	Mild	CYNT	25	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1	ZINC000450974053	GH	On-Demand	Mild	UQCRB	0	40
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)CCC1CCCC1	ZINC000450974054	FF	On-Demand	Anodyne	CCR3	16	40
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)CCC1CCCC1	ZINC000450974054	FF	On-Demand	Anodyne	MTNR1A	28	43
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)CCC1CCCC1	ZINC000450974054	FF	On-Demand	Anodyne	MTNR1B	28	43
COc1ccc(CN(C)S(=O)(=O)c2cc(C)cs2)cc1	ZINC000450974069	DF	On-Demand	Anodyne	BMP1	84	42
CCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n(C)n1	ZINC000450974072	FE	On-Demand	Anodyne	CA2	18	48
CCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n(C)n1	ZINC000450974072	FE	On-Demand	Anodyne	CA1	22	41
CCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n(C)n1	ZINC000450974072	FE	On-Demand	Anodyne	LEF	48	35
CCN(CC)CCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974084	FE	On-Demand	Anodyne	CA2	19	50
CCN(CC)CCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974084	FE	On-Demand	Anodyne	CA1	21	43
CCN(CC)CCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974084	FE	On-Demand	Anodyne	CA4	18	42
CCN(CC)CCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974084	FE	On-Demand	Anodyne	CA14	15	44
O=S(=O)(NCCN1CCOCC1)c1cc2cc(F)ccc2o1	ZINC000450974085	ED	On-Demand	Anodyne	HTR7	25	41
CC(C)c1cc(NS(=O)(=O)c2ccc(CC#N)cc2Cl)no1	ZINC000450974103	EG	On-Demand	Mild	PFK	0	40
Cc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450974109	FE	On-Demand	Anodyne	NR1H3	15	43
Cc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450974109	FE	On-Demand	Anodyne	RORC	16	41
CCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)CCC1CCCC1	ZINC000450974133	FF	On-Demand	Anodyne	DEF	0	47
CCS(=O)(=O)c1ccc(CN2CCC([C@H](F)c3ccccc3F)CC2)cc1	ZINC000450974137	GJ	On-Demand	Anodyne	ACHE	15	40
CCS(=O)(=O)c1ccc(CN2CCC([C@H](F)c3ccccc3F)CC2)cc1	ZINC000450974137	GJ	On-Demand	Anodyne	SIGMAR1	42	45
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(O)c1	ZINC000450974139	GE	On-Demand	Anodyne	PRTN3	54	33
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(O)c1	ZINC000450974139	GE	On-Demand	Anodyne	LUXN	0	45
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](F)c3ccccc3F)CC2)cc1	ZINC000450974143	GJ	On-Demand	Anodyne	ACHE	15	40
CCS(=O)(=O)c1ccc(CN2CCC([C@@H](F)c3ccccc3F)CC2)cc1	ZINC000450974143	GJ	On-Demand	Anodyne	SIGMAR1	42	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccc(F)c2)cc1	ZINC000450974146	FG	On-Demand	Anodyne	BMP1	76	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccc(F)c2)cc1	ZINC000450974146	FG	On-Demand	Anodyne	MMP13	26	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccc(F)c2)cc1	ZINC000450974146	FG	On-Demand	Anodyne	COLA	71	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccc(F)c2)cc1	ZINC000450974146	FG	On-Demand	Anodyne	MMP2	22	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccc(F)c2)cc1	ZINC000450974146	FG	On-Demand	Anodyne	MMP3	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccc(F)c2)cc1	ZINC000450974146	FG	On-Demand	Anodyne	MMP8	26	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccc(F)c2)cc1	ZINC000450974146	FG	On-Demand	Anodyne	LIMK2	28	42
Cc1cnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)o1	ZINC000450974150	FD	On-Demand	Anodyne	MTNN	51	33
CCc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)n1	ZINC000450974151	FF	On-Demand	Anodyne	PDE5A	0	45
CCc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)n1	ZINC000450974151	FF	On-Demand	Anodyne	FAAH	0	47
CCc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)n1	ZINC000450974151	FF	On-Demand	Anodyne	MGLL	0	44
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	P2RX7	43	36
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	EPHX2	43	40
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	RBP4	93	47
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	SCD1	31	47
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	SFRP1	124	44
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	SCD	34	44
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	WNT3	84	36
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	L3MBTL1	0	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	L3MBTL3	46	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@@H](O)C1CCC1	ZINC000450974157	GF	On-Demand	Anodyne	TP53BP1	0	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	P2RX7	43	36
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	EPHX2	43	40
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	RBP4	93	47
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	SCD1	31	47
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	SFRP1	124	44
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	SCD	34	44
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	WNT3	84	36
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	L3MBTL1	0	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	L3MBTL3	46	42
O=C(NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)[C@H](O)C1CCC1	ZINC000450974160	GF	On-Demand	Anodyne	TP53BP1	0	42
Cc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc(C)c1O	ZINC000450974163	EH	On-Demand	Anodyne	P4HTM	0	43
Cc1cc(NC(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc(C)c1O	ZINC000450974163	EH	On-Demand	Anodyne	KCNK3	41	35
CCc1cccc(C(=O)N(C)Cc2ccc(OCC(=O)OC)cc2)n1	ZINC000450974171	EE	On-Demand	Anodyne	LIMK2	32	40
Cc1csc(S(=O)(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c1	ZINC000450974179	FE	On-Demand	Anodyne	CASR	46	36
Cc1csc(S(=O)(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1	ZINC000450974181	FE	On-Demand	Anodyne	CASR	46	36
COC(=O)[C@@H](NS(=O)(=O)c1cc2cc(F)ccc2o1)C(C)C	ZINC000450974190	EE	On-Demand	Anodyne	MMP13	22	42
COC(=O)[C@@H](NS(=O)(=O)c1cc2cc(F)ccc2o1)C(C)C	ZINC000450974190	EE	On-Demand	Anodyne	MMP12	46	34
CN(C)CCOc1ccc(NS(=O)(=O)c2sccc2F)cc1Cl	ZINC000450974191	GG	On-Demand	Anodyne	UTS2R	31	52
COC(=O)COc1ccc(CN(C)C(=O)c2cc(C)cs2)cc1	ZINC000450974197	EF	On-Demand	Anodyne	HSD17B2	19	40
COc1cccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450974219	EG	On-Demand	Anodyne	BMP1	81	43
COc1cccc(CN(C)S(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450974219	EG	On-Demand	Anodyne	MMP3	21	49
CO[C@@H](CS(=O)(=O)Nc1ccccc1N1CCCCC1)c1ccccc1	ZINC000450974237	FH	On-Demand	Anodyne	KCNQ2	90	46
CO[C@@H](CS(=O)(=O)Nc1ccccc1N1CCCCC1)c1ccccc1	ZINC000450974237	FH	On-Demand	Anodyne	KCNQ4	0	46
CO[C@H](CS(=O)(=O)Nc1ccccc1N1CCCCC1)c1ccccc1	ZINC000450974238	FH	On-Demand	Anodyne	KCNQ2	90	46
CO[C@H](CS(=O)(=O)Nc1ccccc1N1CCCCC1)c1ccccc1	ZINC000450974238	FH	On-Demand	Anodyne	KCNQ4	0	46
CSc1cccc(C)c1NC(=O)CCCn1nc(C)nc1C	ZINC000450974239	DG	On-Demand	Anodyne	ACAT	0	40
CCN(c1ccccc1C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974240	GF	On-Demand	Anodyne	MMP13	31	40
CCN(c1ccccc1C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974240	GF	On-Demand	Anodyne	MMP2	16	42
CCN(c1ccccc1C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974240	GF	On-Demand	Anodyne	MMP9	27	42
CCN(c1ccccc1C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974240	GF	On-Demand	Anodyne	LUXN	0	47
CCN(c1ccccc1C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974240	GF	On-Demand	Anodyne	ADIPOR1	0	42
CCN(c1ccccc1C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974240	GF	On-Demand	Anodyne	ADIPOR2	0	42
O=C(c1cc2c(Br)c(F)ccc2[nH]1)N1CC(OC(F)F)C1	ZINC000450974244	FG	On-Demand	Anodyne	HRH4	26	46
CCc1cccc(C(=O)Nc2c(C)cccc2SC)n1	ZINC000450974253	CH	On-Demand	Anodyne	LCK	25	40
CCc1cccc(C(=O)Nc2c(C)cccc2SC)n1	ZINC000450974253	CH	On-Demand	Anodyne	SHH	42	38
C[C@H]1CN(c2ccccc2NS(=O)(=O)c2sccc2F)C[C@H](C)O1	ZINC000450974257	FG	On-Demand	Anodyne	GHSR	0	41
C[C@H]1CN(c2ccccc2NS(=O)(=O)c2sccc2F)C[C@@H](C)O1	ZINC000450974258	FG	On-Demand	Anodyne	GHSR	0	41
C[C@@H]1CN(c2ccccc2NS(=O)(=O)c2sccc2F)C[C@@H](C)O1	ZINC000450974259	FG	On-Demand	Anodyne	GHSR	0	41
O=C(Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)[C@H]1CCCCC1(F)F	ZINC000450974271	GI	On-Demand	Anodyne	NAMPT	25	41
O=C(Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)[C@@H]1CCCCC1(F)F	ZINC000450974272	GI	On-Demand	Anodyne	NAMPT	25	41
Cn1cc(S(=O)(=O)Nc2ccc(N3CCCC3=O)cc2)c(C(F)(F)F)n1	ZINC000450974278	GE	On-Demand	Anodyne	AKR1C3	22	40
CCCOc1ccc(CNC(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450974283	FG	On-Demand	Anodyne	PLA2G4B	48	32
Cc1cccc(N2CCN(S(=O)(=O)C3(C)CC3)CC2)c1C	ZINC000450974288	DE	On-Demand	Anodyne	HTR2C	16	40
CC(F)(F)c1cccc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450974295	GI	On-Demand	Anodyne	CA5B	40	37
CC(F)(F)c1cccc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450974295	GI	On-Demand	Anodyne	CA5A	45	37
CC(F)(F)c1cccc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450974295	GI	On-Demand	Anodyne	E1	0	43
CC(F)(F)c1cccc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)c1	ZINC000450974295	GI	On-Demand	Anodyne	RORC	76	48
Cc1ccc(CNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450974296	FE	On-Demand	Anodyne	PTGS2	17	41
Cc1ccc(CNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450974296	FE	On-Demand	Anodyne	FBP1	19	40
O=C(Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)[C@@H]1CC1(F)F	ZINC000450974297	EG	On-Demand	Anodyne	NAMPT	26	43
O=C(Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)[C@H]1CC1(F)F	ZINC000450974298	EG	On-Demand	Anodyne	NAMPT	26	43
CCOC(=O)c1cc(S(=O)(=O)NCc2ccc(F)cc2)cnc1C(F)F	ZINC000450974299	GF	On-Demand	Anodyne	GNRHR	16	44
CCOC(=O)c1ccc(CS(=O)(=O)Nc2ncccc2OC(F)F)cc1	ZINC000450974300	GF	On-Demand	Anodyne	PPIA	26	46
O=S(=O)(Nc1ccccc1N1CCCC1)c1sccc1Cl	ZINC000450974302	EH	On-Demand	Anodyne	KCNQ2	79	45
NC(=O)c1ccc(N2CCCC2)c(NS(=O)(=O)c2sccc2F)c1	ZINC000450974308	FE	On-Demand	Anodyne	KCNQ2	50	35
CN(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974314	GE	On-Demand	Anodyne	PRTN3	64	40
CN(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974314	GE	On-Demand	Anodyne	LUXN	0	50
CN(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974314	GE	On-Demand	Anodyne	ADIPOR1	0	43
CN(C)c1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974314	GE	On-Demand	Anodyne	ADIPOR2	0	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cn2)cc1	ZINC000450974325	GD	On-Demand	Anodyne	MTNN	65	31
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cn2)cc1	ZINC000450974325	GD	On-Demand	Anodyne	BRD4	0	42
CCCCOCCCNS(=O)(=O)c1cnccc1C	ZINC000450974326	CD	On-Demand	Anodyne	Q95J97_RABIT	0	41
CC(C)(C)c1cc(NS(=O)(=O)c2sccc2F)n(-c2ccccn2)n1	ZINC000450974332	GH	On-Demand	Anodyne	OXTR	38	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(CC(C)(C)C)nn2C)cc1	ZINC000450974345	GG	On-Demand	Anodyne	PFK	0	48
CSc1n[nH]c(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450974352	GC	On-Demand	Anodyne	LUXN	0	43
CCN(C(=O)Cn1cnc2c1CCCC2)c1cccc2ccccc12	ZINC000450974360	EH	On-Demand	Anodyne	FABP4	47	37
CSc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450974367	GE	On-Demand	Anodyne	LUXN	0	44
COc1cc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1F	ZINC000450974373	FG	On-Demand	Anodyne	COLA	46	35
COc1cc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1F	ZINC000450974373	FG	On-Demand	Anodyne	CPT1A	44	35
COc1cc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1F	ZINC000450974373	FG	On-Demand	Anodyne	CPT2	41	35
COc1cc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1F	ZINC000450974373	FG	On-Demand	Anodyne	GRM4	18	46
COc1cc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1F	ZINC000450974374	FG	On-Demand	Anodyne	COLA	46	35
COc1cc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1F	ZINC000450974374	FG	On-Demand	Anodyne	CPT1A	44	35
COc1cc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1F	ZINC000450974374	FG	On-Demand	Anodyne	CPT2	41	35
COc1cc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)ccc1F	ZINC000450974374	FG	On-Demand	Anodyne	GRM4	18	46
CC[C@H]1CCC[C@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974379	CH	On-Demand	Anodyne	QRFPR	40	35
CC[C@H]1CCC[C@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974379	CH	On-Demand	Anodyne	ENPP1	49	30
CC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974380	CH	On-Demand	Anodyne	GRM4	15	45
CC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974380	CH	On-Demand	Anodyne	QRFPR	40	35
CC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974380	CH	On-Demand	Anodyne	ENPP1	66	31
CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974381	CH	On-Demand	Anodyne	QRFPR	40	35
CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974381	CH	On-Demand	Anodyne	ENPP1	49	30
CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974382	CH	On-Demand	Anodyne	GRM4	15	45
CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974382	CH	On-Demand	Anodyne	QRFPR	40	35
CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(F)c(OC)c1	ZINC000450974382	CH	On-Demand	Anodyne	ENPP1	66	31
COCC1(S(=O)(=O)NC[C@@H]2COc3ccccc3O2)CC1	ZINC000450974413	DC	On-Demand	Anodyne	ADRA2B	15	43
COCC1(S(=O)(=O)NC[C@H]2COc3ccccc3O2)CC1	ZINC000450974414	DC	On-Demand	Anodyne	ADRA2B	15	43
Cc1cccc(Cl)c1C(=O)N1CCN(C(=O)NC(C)(C)C)CC1	ZINC000450974417	EF	On-Demand	Anodyne	CCR5	32	41
COc1cc(NC(=O)C(C)(C)C(C)(F)F)ccc1F	ZINC000450974441	CG	On-Demand	Anodyne	ENPP1	49	31
CCCNc1ccc(S(N)(=O)=O)cc1NS(=O)(=O)c1cc(C)cs1	ZINC000450974443	GE	On-Demand	Anodyne	CA2	36	41
CCCNc1ccc(S(N)(=O)=O)cc1NS(=O)(=O)c1cc(C)cs1	ZINC000450974443	GE	On-Demand	Anodyne	CA1	33	41
CCCNc1ccc(S(N)(=O)=O)cc1NS(=O)(=O)c1cc(C)cs1	ZINC000450974443	GE	On-Demand	Anodyne	CA4	37	41
CN1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)CC1	ZINC000450974444	GE	On-Demand	Anodyne	LTA4H	45	45
CN1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)CC1	ZINC000450974444	GE	On-Demand	Anodyne	KCNA5	0	43
CN1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)CC1	ZINC000450974444	GE	On-Demand	Anodyne	HRH3	25	41
CN1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)CC1	ZINC000450974444	GE	On-Demand	Anodyne	PSMB2	46	36
CN1CCN(CCOc2ccc(NS(=O)(=O)c3sccc3F)cc2)CC1	ZINC000450974444	GE	On-Demand	Anodyne	PSMB1	41	36
COC(=O)c1c(C)cccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974455	GG	On-Demand	Anodyne	PPIA	22	41
COC(=O)c1c(C)cccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974455	GG	On-Demand	Anodyne	BDKRB1	0	41
COC(=O)c1c(C)cccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450974455	GG	On-Demand	Anodyne	PRTN3	54	33
Cc1cc2c(N3CCN(C(=O)Cc4ccc(O)c(F)c4)CC3)ncnc2s1	ZINC000450974457	GF	On-Demand	Anodyne	P2RY12	17	57
Cc1cc2c(N3CCN(C(=O)Cc4ccc(O)c(F)c4)CC3)ncnc2s1	ZINC000450974457	GF	On-Demand	Anodyne	AKT2	28	41
Cc1cc2c(N3CCN(C(=O)Cc4ccc(O)c(F)c4)CC3)ncnc2s1	ZINC000450974457	GF	On-Demand	Anodyne	AKT3	39	41
Cc1cc2c(N3CCN(C(=O)Cc4ccc(O)c(F)c4)CC3)ncnc2s1	ZINC000450974457	GF	On-Demand	Anodyne	ABCC1	68	34
Cc1cc2c(N3CCN(C(=O)Cc4ccc(O)c(F)c4)CC3)ncnc2s1	ZINC000450974457	GF	On-Demand	Anodyne	AKT1	33	41
c1cc(N2CCCC2)ncc1-c1nc2c(s1)CCCC2	ZINC000450974475	CH	On-Demand	Anodyne	SLC27A1	50	45
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974493	FG	On-Demand	Anodyne	CHRM4	18	46
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974493	FG	On-Demand	Anodyne	CCR3	78	41
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974493	FG	On-Demand	Anodyne	CCR2	15	40
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974493	FG	On-Demand	Anodyne	MCHR1	17	42
CC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974493	FG	On-Demand	Anodyne	CACNA1I	61	37
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974496	FG	On-Demand	Anodyne	CHRM4	18	46
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974496	FG	On-Demand	Anodyne	CCR3	78	41
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974496	FG	On-Demand	Anodyne	CCR2	15	40
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974496	FG	On-Demand	Anodyne	MCHR1	17	42
CC(=O)c1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)cc1	ZINC000450974496	FG	On-Demand	Anodyne	CACNA1I	61	37
COc1ccc(CCNS(=O)(=O)CCOCc2ccccc2)cc1OC	ZINC000450974501	GE	On-Demand	Anodyne	DRTS_PLAFK	27	40
CCc1sc(-c2c(C)noc2C)nc1-c1ccc(OC)cc1	ZINC000450974507	DJ	On-Demand	Anodyne	BRD4	28	42
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA2	72	55
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA6	23	49
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA1	66	47
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA7	38	49
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA5B	34	51
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA4	42	47
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA5A	29	51
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA12	48	49
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA9	51	44
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CAH_METTE	24	42
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CYNT	38	49
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	NCE103	27	42
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	CA	0	49
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	A6YCJ1_9METZ	27	49
NS(=O)(=O)c1ccc(CCNS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450974512	FD	On-Demand	Anodyne	Q5TU56_ANOGA	0	49
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1sccc1Cl	ZINC000450974523	GG	On-Demand	Anodyne	PTGER3	15	40
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1sccc1Cl	ZINC000450974523	GG	On-Demand	Anodyne	MTNR1A	24	44
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1sccc1Cl	ZINC000450974523	GG	On-Demand	Anodyne	MTNR1B	25	46
CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1sccc1Cl	ZINC000450974523	GG	On-Demand	Anodyne	TAAR1	29	43
O=C(CC(F)(F)F)NC[C@H]1CCCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450974525	GF	On-Demand	Anodyne	CHRM4	15	44
O=C(CC(F)(F)F)NC[C@@H]1CCCN(Cc2ccn(CC(F)(F)F)n2)C1	ZINC000450974527	GF	On-Demand	Anodyne	CHRM4	15	44
CCSc1cccnc1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450974533	GG	On-Demand	Anodyne	P2RY12	24	47
CCSc1cccnc1C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450974533	GG	On-Demand	Anodyne	PDGFRB	46	35
CCc1nnc(NS(=O)(=O)c2sccc2F)s1	ZINC000450974542	CE	On-Demand	Anodyne	CA4	43	37
C[C@@H]1Cc2ccccc2N1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450974546	DG	On-Demand	Anodyne	DRD4	28	44
C[C@H]1Cc2ccccc2N1C(=O)COc1cccc2c1C(=O)CC2	ZINC000450974547	DG	On-Demand	Anodyne	DRD4	28	44
CNC(=O)c1ccc(CS(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450974554	GF	On-Demand	Anodyne	PLA2G4A	41	36
CNC(=O)c1ccc(CS(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450974554	GF	On-Demand	Anodyne	TMPRSS11D	41	34
COc1ccc(CCNS(=O)(=O)c2ccc(C3CC3)cc2)cc1OC	ZINC000450974555	FG	On-Demand	Anodyne	TBXA2R	50	40
COc1ccc(CCNS(=O)(=O)c2ccc(C3CC3)cc2)cc1OC	ZINC000450974555	FG	On-Demand	Anodyne	ALOX15	40	34
COc1ccc(CCNS(=O)(=O)c2ccc(C3CC3)cc2)cc1OC	ZINC000450974555	FG	On-Demand	Anodyne	IAP	0	44
COc1ccc(CCNS(=O)(=O)c2ccc(C3CC3)cc2)cc1OC	ZINC000450974555	FG	On-Demand	Anodyne	A6YCJ1_9METZ	15	40
COc1ccc(CCNS(=O)(=O)c2ccc(C3CC3)cc2)cc1OC	ZINC000450974555	FG	On-Demand	Anodyne	Q5TU56_ANOGA	0	40
O=C1CCC(CN(Cc2ccc(F)cc2Cl)CC2CC2)CC1	ZINC000450974564	DI	On-Demand	Anodyne	P2RX7	38	41
O=C1CCc2cccc(OCC(=O)N3CCN(c4ccc(F)cc4)CC3)c21	ZINC000450974566	FF	On-Demand	Anodyne	SSTR1	25	41
CC(C)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974604	ED	On-Demand	Anodyne	MMP13	37	48
CC(C)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974604	ED	On-Demand	Anodyne	ADAM17	35	48
CC(C)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974604	ED	On-Demand	Anodyne	MMP3	32	44
CC(C)N(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450974604	ED	On-Demand	Anodyne	MMP1	31	48
CO[C@H](C)CS(=O)(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000450974610	GH	On-Demand	Anodyne	SPHK2	35	44
CO[C@H](C)CS(=O)(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000450974610	GH	On-Demand	Anodyne	SPHK1	28	44
CO[C@@H](C)CS(=O)(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000450974611	GH	On-Demand	Anodyne	SPHK2	35	44
CO[C@@H](C)CS(=O)(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000450974611	GH	On-Demand	Anodyne	SPHK1	28	44
COc1ccc(-c2noc(CN(C)CCc3ccccc3[N+](=O)[O-])n2)nn1	ZINC000450974615	FE	On-Demand	Bother	COLA	81	35
COC(=O)c1csc(CN2CCN(Cc3ccc(Cl)cc3C)CC2)n1	ZINC000450974622	GG	On-Demand	Anodyne	PTGER1	25	42
COC(=O)c1csc(CN2CCN(Cc3ccc(Cl)cc3C)CC2)n1	ZINC000450974622	GG	On-Demand	Anodyne	TRPC6	42	33
COC(=O)c1csc(CN2CCN(Cc3ccc(Cl)cc3C)CC2)n1	ZINC000450974622	GG	On-Demand	Anodyne	TRPC3	40	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccs2)cc1	ZINC000450974625	FG	On-Demand	Anodyne	BMP1	72	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccs2)cc1	ZINC000450974625	FG	On-Demand	Anodyne	CA7	18	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccs2)cc1	ZINC000450974625	FG	On-Demand	Anodyne	MMP13	21	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccs2)cc1	ZINC000450974625	FG	On-Demand	Anodyne	ADAM17	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccs2)cc1	ZINC000450974625	FG	On-Demand	Anodyne	COLA	60	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccs2)cc1	ZINC000450974625	FG	On-Demand	Anodyne	CA5B	46	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccs2)cc1	ZINC000450974625	FG	On-Demand	Anodyne	CA5A	47	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccs2)cc1	ZINC000450974625	FG	On-Demand	Anodyne	MMP12	33	41
O=S(=O)(Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(Cl)c1O	ZINC000450974638	GG	On-Demand	Anodyne	POL	0	41
O=S(=O)(Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc(Cl)c1O	ZINC000450974639	GG	On-Demand	Anodyne	POL	0	41
COc1ccc(CNC(=O)CCN2CCC=C(c3ccco3)C2)c(OC)c1	ZINC000450974645	FG	On-Demand	Anodyne	HTR7	24	41
COc1ccc([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c(OC)c1	ZINC000450974657	GH	On-Demand	Anodyne	FKBP1A	60	40
COc1ccc([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c(OC)c1	ZINC000450974657	GH	On-Demand	Anodyne	COLA	129	42
COc1ccc([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c(OC)c1	ZINC000450974657	GH	On-Demand	Anodyne	CPT1A	120	42
COc1ccc([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c(OC)c1	ZINC000450974657	GH	On-Demand	Anodyne	CPT2	41	42
COc1ccc([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c(OC)c1	ZINC000450974658	GH	On-Demand	Anodyne	FKBP1A	60	40
COc1ccc([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c(OC)c1	ZINC000450974658	GH	On-Demand	Anodyne	COLA	129	42
COc1ccc([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c(OC)c1	ZINC000450974658	GH	On-Demand	Anodyne	CPT1A	120	42
COc1ccc([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)c(OC)c1	ZINC000450974658	GH	On-Demand	Anodyne	CPT2	41	42
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)COc1cccc2c1C(=O)CC2	ZINC000450974659	FI	On-Demand	Anodyne	UTS2	40	31
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)COc1cccc2c1C(=O)CC2	ZINC000450974660	FI	On-Demand	Anodyne	UTS2	40	31
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	NR3C1	0	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	NR3C2	0	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	ACE	21	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	SSTR2	70	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	OPRM1	17	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	OPRD1	0	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	GHRHR	30	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MME	28	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	EDNRB	49	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	EDNRA	43	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	TACR1	39	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MC4R	54	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	BMP1	29	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	TACR2	52	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	KCNA5	0	66
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	CCKAR	132	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	CTSL	29	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	BRS3	26	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	NMBR	83	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MC3R	86	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MC5R	88	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MMP2	29	50
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MMP8	34	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MMP14	22	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	GRPR	104	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	ECE1	67	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	SSTR3	38	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MMP11	80	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	CCKBR	112	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	GHSR	73	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MMP9	26	50
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MC1R	102	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	C5AR1	44	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	MMP1	20	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	NPR	32	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	SLC15A2	0	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	KISS1R	65	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	ERAP2	43	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	PSMB8	23	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	LASB	0	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CCC1CCCC1	ZINC000450974663	GF	On-Demand	Anodyne	PSMB9	0	41
Cc1sccc1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450974671	FI	On-Demand	Anodyne	NOS1	16	44
Cc1sccc1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450974671	FI	On-Demand	Anodyne	NAMPT	33	44
COC(=O)C1CCN(S(=O)(=O)CCC2CCCCC2)CC1	ZINC000450974672	DE	On-Demand	Anodyne	EPHX2	18	47
Cc1csc(S(=O)(=O)Nc2ccc(N3CCN(C)CC3)cc2C)c1	ZINC000450974692	FF	On-Demand	Anodyne	GHSR	0	40
COC(=O)C1CCN(S(=O)(=O)Cc2ccc(Br)c(F)c2)CC1	ZINC000450974703	GE	On-Demand	Anodyne	PTPN2	43	35
CCOc1ccc(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)cc1OC	ZINC000450974704	GH	On-Demand	Anodyne	UTS2R	15	44
O=S(=O)(NCc1ccc(F)cc1)c1ccc(C2CC2)cc1	ZINC000450974705	DG	On-Demand	Anodyne	GNRHR	0	52
Cc1nn(C)cc1CC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450974710	CG	On-Demand	Anodyne	IMDH_CRYPV	40	31
Cc1nn(C)cc1CC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450974710	CG	On-Demand	Anodyne	PANK1	0	40
Cc1nn(C)cc1CC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450974710	CG	On-Demand	Anodyne	PANK3	0	40
CSc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)c1	ZINC000450974716	GJ	On-Demand	Anodyne	KCNK3	86	37
CSc1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)c1	ZINC000450974716	GJ	On-Demand	Anodyne	KCNK9	44	34
CC(C)(C)c1cc(NS(=O)(=O)c2sccc2Cl)n(-c2ccccn2)n1	ZINC000450974717	GI	On-Demand	Anodyne	OXTR	0	44
CCOCCCn1c(NS(=O)(=O)c2sccc2F)nc2ccccc21	ZINC000450974720	GG	On-Demand	Anodyne	HRH1	17	41
Cc1onc(C2CC2)c1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450974728	DI	On-Demand	Anodyne	TYK2	45	34
Cc1onc(C2CC2)c1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450974728	DI	On-Demand	Anodyne	KCNK3	63	38
Cc1onc(C2CC2)c1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450974728	DI	On-Demand	Anodyne	KCNK9	47	32
Cn1cc(S(=O)(=O)Nc2ccc(N3CCCCC3)nc2)c(C(F)(F)F)n1	ZINC000450974744	GF	On-Demand	Anodyne	DGAT1	19	45
CC(C)N(C(=O)COc1cccc2c1C(=O)CC2)C1CCCC1	ZINC000450974755	DG	On-Demand	Anodyne	SCARB1	41	33
Cc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1Br	ZINC000450974765	GG	On-Demand	Anodyne	NR1I2	42	35
Cc1cccc(C)c1CS(=O)(=O)Nc1c(F)cccc1N1CCCC1	ZINC000450974786	FH	On-Demand	Anodyne	KCNQ2	53	35
CCN(CC(=O)NCc1ccc(F)cc1)S(=O)(=O)c1cnccc1C	ZINC000450974804	FD	On-Demand	Anodyne	NAMPT	48	40
C[C@H]1CC[C@H](NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450974810	DF	On-Demand	Anodyne	MAPK13	69	34
C[C@@H]1CC[C@@H](NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450974811	DF	On-Demand	Anodyne	MAPK13	69	34
C[C@H]1CC[C@@H](NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450974812	DF	On-Demand	Anodyne	MAPK13	69	34
C[C@@H]1CC[C@H](NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450974813	DF	On-Demand	Anodyne	MAPK13	69	34
C[C@@H]1CC[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450974830	CH	On-Demand	Anodyne	MAPK11	38	44
C[C@@H]1CC[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450974830	CH	On-Demand	Anodyne	MAPK14	56	43
C[C@@H]1CC[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450974831	CH	On-Demand	Anodyne	MAPK11	38	44
C[C@@H]1CC[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450974831	CH	On-Demand	Anodyne	MAPK14	56	43
C[C@H]1CC[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450974832	CH	On-Demand	Anodyne	MAPK11	38	44
C[C@H]1CC[C@@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450974832	CH	On-Demand	Anodyne	MAPK14	56	43
C[C@H]1CC[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450974833	CH	On-Demand	Anodyne	MAPK11	38	44
C[C@H]1CC[C@H](NC(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450974833	CH	On-Demand	Anodyne	MAPK14	56	43
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450974840	GF	On-Demand	Anodyne	SRD5A1	33	42
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450974841	GF	On-Demand	Anodyne	SRD5A1	33	42
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C1(C)CC1	ZINC000450974843	DD	On-Demand	Anodyne	MMP3	29	48
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C1(C)CC1	ZINC000450974843	DD	On-Demand	Anodyne	MMP8	32	48
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C1(C)CC1	ZINC000450974843	DD	On-Demand	Anodyne	CFTR	43	33
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)C1(C)CC1	ZINC000450974843	DD	On-Demand	Anodyne	ADAM9	70	39
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C1(C)CC1	ZINC000450974844	DD	On-Demand	Anodyne	MMP3	29	48
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C1(C)CC1	ZINC000450974844	DD	On-Demand	Anodyne	MMP8	32	48
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C1(C)CC1	ZINC000450974844	DD	On-Demand	Anodyne	CFTR	43	33
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)C1(C)CC1	ZINC000450974844	DD	On-Demand	Anodyne	ADAM9	70	39
CCNC(=O)COc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450974867	FF	On-Demand	Anodyne	PRTN3	45	32
CCNC(=O)COc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450974867	FF	On-Demand	Anodyne	LIMK2	40	40
CCOC(=O)c1cc(S(=O)(=O)Nc2nnc(CC)s2)cnc1C(F)F	ZINC000450974872	GE	On-Demand	Anodyne	CA4	49	36
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCN2CCOCC2)c1	ZINC000450974889	GD	On-Demand	Anodyne	DRD4	41	32
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCN2CCOCC2)c1	ZINC000450974889	GD	On-Demand	Anodyne	NPY2R	0	40
COCCO[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450974899	EE	On-Demand	Anodyne	CCR1	23	41
COCCO[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450974899	EE	On-Demand	Anodyne	UTS2R	22	40
COCCO[C@@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450974899	EE	On-Demand	Anodyne	MLNR	28	41
COCCO[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450974900	EE	On-Demand	Anodyne	CCR1	23	41
COCCO[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450974900	EE	On-Demand	Anodyne	UTS2R	22	40
COCCO[C@H]1CCN(C(=O)Cc2ccc(Cl)c(OC)c2)C1	ZINC000450974900	EE	On-Demand	Anodyne	MLNR	28	41
CCO[C@H]1C[C@@H](NCc2csc(-c3ccc(C(N)=O)cc3)n2)C12CCCC2	ZINC000450974910	GH	On-Demand	Anodyne	AVPR1B	18	45
CCO[C@@H]1C[C@@H](NCc2csc(-c3ccc(C(N)=O)cc3)n2)C12CCCC2	ZINC000450974914	GH	On-Demand	Anodyne	AVPR1B	18	45
CCO[C@H]1C[C@H](NCc2csc(-c3ccc(C(N)=O)cc3)n2)C12CCCC2	ZINC000450974917	GH	On-Demand	Anodyne	AVPR1B	18	45
CCO[C@@H]1C[C@H](NCc2csc(-c3ccc(C(N)=O)cc3)n2)C12CCCC2	ZINC000450974920	GH	On-Demand	Anodyne	AVPR1B	18	45
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1c(Br)cnn1C	ZINC000450974928	GG	On-Demand	Anodyne	GPBAR1	41	39
COc1ccc([C@H](CNS(=O)(=O)c2cc(C)cs2)N2CCCC2)cc1	ZINC000450974935	GG	On-Demand	Anodyne	CCR3	15	43
COc1ccc([C@@H](CNS(=O)(=O)c2cc(C)cs2)N2CCCC2)cc1	ZINC000450974936	GG	On-Demand	Anodyne	CCR3	15	43
Cc1ccc(OCCNS(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450974943	EF	On-Demand	Anodyne	PIR	0	42
CCOC(=O)c1ccc(CS(=O)(=O)N2CCN(C)c3ncccc32)cc1	ZINC000450974950	GE	On-Demand	Anodyne	P2RY12	46	36
Clc1cccc(OCCn2cnc3c2CCCC3)c1	ZINC000450974957	CG	On-Demand	Anodyne	LTA4H	22	45
CO[C@H](C)CS(=O)(=O)Nc1ccc2c(c1)ncn2C	ZINC000450974992	CD	On-Demand	Anodyne	NR1I2	65	43
CC1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450974996	DF	On-Demand	Mild	TRPV4	42	34
CO[C@@H](C)CS(=O)(=O)Nc1ccc2c(c1)ncn2C	ZINC000450974997	CD	On-Demand	Anodyne	NR1I2	65	43
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000450975005	FG	On-Demand	Anodyne	SCD1	36	48
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000450975005	FG	On-Demand	Anodyne	SCD	26	48
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000450975006	FG	On-Demand	Anodyne	SCD1	36	48
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000450975006	FG	On-Demand	Anodyne	SCD	26	48
CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450975019	GF	On-Demand	Anodyne	FAAH	21	45
CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450975019	GF	On-Demand	Anodyne	MCHR1	18	40
CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450975019	GF	On-Demand	Anodyne	MGLL	0	41
CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450975019	GF	On-Demand	Anodyne	TAAR1	21	40
CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450975019	GF	On-Demand	Anodyne	KCNK3	42	34
CC(=O)N1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3CC(C)C)c2)CC1	ZINC000450975022	FF	On-Demand	Anodyne	HTR1D	25	41
COC(=O)c1ncccc1S(=O)(=O)N1CCC(C)CC1	ZINC000450975023	CD	On-Demand	Anodyne	EPHX2	29	41
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2sccc2Cl)C1	ZINC000450975024	EE	On-Demand	Anodyne	SLC6A1	40	36
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2sccc2Cl)C1	ZINC000450975025	EE	On-Demand	Anodyne	SLC6A1	40	36
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450975028	FE	On-Demand	Mild	KCNK3	65	34
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C#N)[nH]c3C)c2)CC1	ZINC000450975028	FE	On-Demand	Mild	KCNK9	65	34
CC(C)(C)c1ccc(O)c(NS(=O)(=O)c2sccc2F)c1	ZINC000450975050	EH	On-Demand	Anodyne	UQCRB	0	46
O=C(COc1cccc2c1C(=O)CC2)NCCCc1ccccc1	ZINC000450975051	DF	On-Demand	Anodyne	CRTM	47	42
CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(F)cc2C)cnc1C(F)F	ZINC000450975053	GG	On-Demand	Anodyne	TLR4	16	44
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450975054	GD	On-Demand	Anodyne	LCK	24	40
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450975054	GD	On-Demand	Anodyne	PRNP	58	31
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450975054	GD	On-Demand	Anodyne	STAT6	60	36
CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)c(C(N)=O)cn3)c2)CC1	ZINC000450975054	GD	On-Demand	Anodyne	LIMK2	47	39
Cc1cc2c(N3CCN(C(=O)[C@@H]4C[C@H]4CC(C)C)CC3)ncnc2s1	ZINC000450975055	FG	On-Demand	Anodyne	SIRT3	54	32
Cc1cc2c(N3CCN(C(=O)[C@@H]4C[C@H]4CC(C)C)CC3)ncnc2s1	ZINC000450975055	FG	On-Demand	Anodyne	SIRT2	42	32
O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1sccc1F	ZINC000450975056	ED	On-Demand	Anodyne	DGAT1	27	43
Cn1cc(CCNC(=O)CCCC(=O)C2CC2)c2ccc(Cl)cc21	ZINC000450975057	EH	On-Demand	Anodyne	MTNR1A	20	41
Cc1csc(S(=O)(=O)Nc2cccc(Cn3ccnc3C(C)C)c2)c1	ZINC000450975060	GI	On-Demand	Anodyne	NR1I2	44	39
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	F2	35	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	ACE	40	35
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	MME	49	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	TRY2_BOVIN	54	33
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	CYSP_TRYCR	42	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	TIMP3	79	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	AMY2	42	29
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	CAPNS1	76	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	CAPN1	61	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	CAPN2	57	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450975065	GF	On-Demand	Anodyne	TMPRSS11D	47	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	F2	35	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	ACE	40	35
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	MME	49	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	TRY2_BOVIN	54	33
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	CYSP_TRYCR	42	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	TIMP3	79	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	AMY2	42	29
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	CAPNS1	76	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	CAPN1	61	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	CAPN2	57	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450975066	GF	On-Demand	Anodyne	TMPRSS11D	47	36
Cc1cc(C)c(S(=O)(=O)Nc2ccccc2N2CCCC2)s1	ZINC000450975076	EH	On-Demand	Anodyne	KCNQ2	79	38
Cc1cc(C)c(S(=O)(=O)Nc2ccccc2N2CCCC2)s1	ZINC000450975076	EH	On-Demand	Anodyne	CREBBP	43	33
Cc1cc(C)c(S(=O)(=O)Nc2ccccc2N2CCCC2)s1	ZINC000450975076	EH	On-Demand	Anodyne	BRD9	43	33
Cc1csc(S(=O)(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1	ZINC000450975081	GF	On-Demand	Anodyne	MTNN	54	34
CCc1cccc(C(=O)N2CCN(c3nc4ccccc4o3)[C@@H](C)C2)n1	ZINC000450975089	FG	On-Demand	Anodyne	SMO	34	41
CCc1cccc(C(=O)N2CCN(c3nc4ccccc4o3)[C@H](C)C2)n1	ZINC000450975090	FG	On-Demand	Anodyne	SMO	34	41
C[C@H]1CCCCN1S(=O)(=O)c1cc2cc(F)ccc2o1	ZINC000450975091	CG	On-Demand	Anodyne	AKR1C3	0	41
C[C@@H]1CCCCN1S(=O)(=O)c1cc2cc(F)ccc2o1	ZINC000450975092	CG	On-Demand	Anodyne	AKR1C3	0	41
Cc1ccc2cc(S(=O)(=O)N3CCCN(C)CC3)ccc2c1	ZINC000450975107	DE	On-Demand	Anodyne	PKM	39	45
Cc1ccc2cc(S(=O)(=O)N3CCCN(C)CC3)ccc2c1	ZINC000450975107	DE	On-Demand	Anodyne	AKR1C3	25	41
CCOc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450975110	FE	On-Demand	Anodyne	BMP1	86	37
CCOc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450975110	FE	On-Demand	Anodyne	MMP13	50	41
CCOc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450975110	FE	On-Demand	Anodyne	ADAM17	44	41
CCOc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450975110	FE	On-Demand	Anodyne	MMP2	25	41
CCOc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450975110	FE	On-Demand	Anodyne	MMP3	27	43
CCOc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450975110	FE	On-Demand	Anodyne	MMP8	33	41
CCOc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450975110	FE	On-Demand	Anodyne	MMP9	53	41
CCOc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450975110	FE	On-Demand	Anodyne	MMP1	44	41
CCOCCCn1c(NS(=O)(=O)c2sccc2Cl)nc2ccccc21	ZINC000450975119	GH	On-Demand	Anodyne	HRH1	15	40
CC1(O)CC(C(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)C1	ZINC000450975130	FF	On-Demand	Anodyne	NAMPT	27	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	CA2	16	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	LPL	51	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	KCNQ2	101	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	CA1	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	HTR6	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	GRM4	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	MMP2	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	KCNQ4	0	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	PRTN3	53	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	CSF1R	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2)cc1	ZINC000450975131	GH	On-Demand	Anodyne	F13A1	56	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	NR3C1	0	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	ACE	19	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	SSTR2	27	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MME	25	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	EDNRB	50	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	EDNRA	51	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	TACR1	41	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	KCNA5	0	58
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	CCKAR	91	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	CTSL	28	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	NMBR	51	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MC3R	50	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MC5R	51	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MMP2	26	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MMP8	45	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MMP14	77	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	GRPR	52	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	ECE1	61	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MMP11	69	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	CCKBR	66	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	GHSR	61	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MMP9	24	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	MC1R	72	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	NPR	30	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	SLC15A2	0	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	KISS1R	53	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)CC1(CC#N)CC1	ZINC000450975140	GD	On-Demand	Mild	ERAP2	40	35
CC[C@@H]1C[C@H]1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450975143	CH	On-Demand	Anodyne	RHOA	0	40
CC(C)(C)NC(=O)N1CCN(C(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450975146	ED	On-Demand	Anodyne	FASN	22	42
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(C)c2cccnc2OC)c1	ZINC000450975150	GF	On-Demand	Anodyne	P2RY1	15	44
C[C@@H]1CN(C(=O)c2ccc(C#N)n2C)CCN1c1nc2ccccc2o1	ZINC000450975156	EE	On-Demand	Mild	SMO	31	41
C[C@H]1CN(C(=O)c2ccc(C#N)n2C)CCN1c1nc2ccccc2o1	ZINC000450975157	EE	On-Demand	Mild	SMO	31	41
CCOC(=O)c1cccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c1	ZINC000450975178	GE	On-Demand	Anodyne	P2RY12	43	37
CCN1CCC(NC(=O)CSc2ccc(Br)c(Cl)c2)CC1	ZINC000450975201	GH	On-Demand	Anodyne	HTR4	25	43
CCN1CCC(NC(=O)CSc2ccc(Br)c(Cl)c2)CC1	ZINC000450975201	GH	On-Demand	Anodyne	SIGMAR1	23	45
CCN1CCC(NC(=O)CSc2ccc(Br)c(Cl)c2)CC1	ZINC000450975201	GH	On-Demand	Anodyne	SSTR5	42	37
COc1cc(NC(=O)c2scnc2C(C)C)ccc1F	ZINC000450975210	CH	On-Demand	Anodyne	F10	47	31
COc1cc(NC(=O)c2scnc2C(C)C)ccc1F	ZINC000450975210	CH	On-Demand	Anodyne	ENPP1	51	32
COc1cc(NC(=O)c2scnc2C(C)C)ccc1F	ZINC000450975210	CH	On-Demand	Anodyne	KCNK3	45	40
COc1cc(NC(=O)c2scnc2C(C)C)ccc1F	ZINC000450975210	CH	On-Demand	Anodyne	KCNK9	39	40
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975219	GG	On-Demand	Anodyne	LPL	42	34
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975219	GG	On-Demand	Anodyne	CA1	49	38
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975219	GG	On-Demand	Anodyne	EPHX2	48	45
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975219	GG	On-Demand	Anodyne	CA12	17	45
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975219	GG	On-Demand	Anodyne	CA9	17	45
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975219	GG	On-Demand	Anodyne	NCE103	28	45
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975219	GG	On-Demand	Anodyne	P96878_MYCTU	20	41
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975220	GG	On-Demand	Anodyne	LPL	42	34
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975220	GG	On-Demand	Anodyne	CA1	49	38
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975220	GG	On-Demand	Anodyne	EPHX2	48	45
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975220	GG	On-Demand	Anodyne	CA12	17	45
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975220	GG	On-Demand	Anodyne	CA9	17	45
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975220	GG	On-Demand	Anodyne	NCE103	28	45
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450975220	GG	On-Demand	Anodyne	P96878_MYCTU	20	41
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975225	GG	On-Demand	Anodyne	CA2	18	43
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975225	GG	On-Demand	Anodyne	LPL	44	36
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975225	GG	On-Demand	Anodyne	CA1	56	43
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975225	GG	On-Demand	Anodyne	CA12	21	43
CO[C@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975225	GG	On-Demand	Anodyne	CA9	22	43
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975226	GG	On-Demand	Anodyne	CA2	18	43
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975226	GG	On-Demand	Anodyne	LPL	44	36
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975226	GG	On-Demand	Anodyne	CA1	56	43
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975226	GG	On-Demand	Anodyne	CA12	21	43
CO[C@@H](CS(=O)(=O)Nc1ccc(NC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975226	GG	On-Demand	Anodyne	CA9	22	43
CCOC(=O)c1sc(NS(=O)(=O)c2sccc2Cl)cc1C	ZINC000450975232	FH	On-Demand	Anodyne	DHODH	19	40
CCOC(=O)c1cc(C(=O)Nc2c(F)cccc2OC)[nH]c1C	ZINC000450975233	DF	On-Demand	Anodyne	KCNK3	43	38
Cc1ccc(C(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c(Cl)c1Cl	ZINC000450975234	GJ	On-Demand	Anodyne	P2RX7	17	40
Cc1ccc(C(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c(Cl)c1Cl	ZINC000450975235	GJ	On-Demand	Anodyne	P2RX7	17	40
Cc1ccc(C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c(Cl)c1Cl	ZINC000450975236	GJ	On-Demand	Anodyne	P2RX7	17	40
Cc1ccc(C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c(Cl)c1Cl	ZINC000450975237	GJ	On-Demand	Anodyne	P2RX7	17	40
COc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450975243	GE	On-Demand	Anodyne	BMP1	46	37
COc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450975243	GE	On-Demand	Anodyne	MMP13	19	42
COc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450975243	GE	On-Demand	Anodyne	ADAM17	17	42
COc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450975243	GE	On-Demand	Anodyne	MMP3	15	40
COc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450975243	GE	On-Demand	Anodyne	MMP9	20	42
COc1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450975243	GE	On-Demand	Anodyne	MMP1	22	42
CCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450975246	FG	On-Demand	Anodyne	CA2	21	43
CCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450975246	FG	On-Demand	Anodyne	ADRB2	20	43
CCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450975246	FG	On-Demand	Anodyne	ADRB1	15	43
CCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450975246	FG	On-Demand	Anodyne	CA1	24	41
CCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450975246	FG	On-Demand	Anodyne	CA4	32	43
CCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450975246	FG	On-Demand	Anodyne	LEF	18	47
CCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450975246	FG	On-Demand	Anodyne	PFK	0	40
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450975257	GI	On-Demand	Anodyne	SLC6A1	85	36
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450975257	GI	On-Demand	Anodyne	CHRM4	18	47
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450975257	GI	On-Demand	Anodyne	CACNA1I	53	34
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450975258	GI	On-Demand	Anodyne	SLC6A1	85	36
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450975258	GI	On-Demand	Anodyne	CHRM4	18	47
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCc2c(Cl)cccc2Cl)C1	ZINC000450975258	GI	On-Demand	Anodyne	CACNA1I	53	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ncccc32)cc1	ZINC000450975259	FE	On-Demand	Anodyne	CPT1A	24	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ncccc32)cc1	ZINC000450975259	FE	On-Demand	Anodyne	TGM2	40	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ncccc32)cc1	ZINC000450975259	FE	On-Demand	Anodyne	F13A1	56	41
CC(=O)[C@](C)(O)CN(C)Cc1nc(-c2cccs2)no1	ZINC000450975267	CD	On-Demand	Anodyne	ETHR	31	40
CC(=O)[C@@](C)(O)CN(C)Cc1nc(-c2cccs2)no1	ZINC000450975268	CD	On-Demand	Anodyne	ETHR	31	40
CCOC(=O)c1cnn(C2CCN(Cc3cccc(C(C)=O)c3)CC2)c1C	ZINC000450975276	FG	On-Demand	Anodyne	DRD3	0	47
CCOC(=O)c1cnn(C2CCN(Cc3cccc(C(C)=O)c3)CC2)c1C	ZINC000450975276	FG	On-Demand	Anodyne	SSTR5	47	37
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1ccnc(OC(F)F)c1	ZINC000450975277	FH	On-Demand	Anodyne	GPBAR1	29	41
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	DRD2	40	35
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	DRD4	28	47
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	ACHE	16	40
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	DRD3	24	47
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	HTR4	50	40
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	CHRM4	18	43
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	SSTR5	48	40
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	CCR3	57	51
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	CCR2	21	42
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	MCHR1	25	44
COc1cc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975279	GH	On-Demand	Anodyne	CACNA1I	71	38
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	DRD2	40	35
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	DRD4	28	47
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	ACHE	16	40
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	DRD3	24	47
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	AVPR1B	41	34
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	HTR4	50	40
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	CHRM4	18	43
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	SSTR5	48	40
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	CCR3	57	51
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	CCR2	21	42
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	MCHR1	25	44
COc1cc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)ccc1Cl	ZINC000450975280	GH	On-Demand	Anodyne	CACNA1I	71	38
CC[C@@H](CC(C)C)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450975282	FH	On-Demand	Anodyne	P2RY12	24	47
CC[C@@H](CC(C)C)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450975282	FH	On-Demand	Anodyne	SIRT3	47	30
CC[C@H](CC(C)C)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450975283	FH	On-Demand	Anodyne	P2RY12	24	47
CC[C@H](CC(C)C)C(=O)N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000450975283	FH	On-Demand	Anodyne	SIRT3	47	30
COc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975291	GG	On-Demand	Anodyne	CA2	18	41
COc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975291	GG	On-Demand	Anodyne	CA1	23	44
COc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975291	GG	On-Demand	Anodyne	CA14	15	41
COc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975291	GG	On-Demand	Anodyne	PRTN3	51	32
COc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975291	GG	On-Demand	Anodyne	LEF	51	35
COc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975291	GG	On-Demand	Anodyne	PFK	0	40
COc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975291	GG	On-Demand	Anodyne	P96878_MYCTU	15	44
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	HTR1A	17	43
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	HTR1D	25	42
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	HTR1B	21	42
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	CHRM3	15	47
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	SIGMAR1	15	40
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	CCR3	37	40
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	FAAH	21	49
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	MCHR1	23	40
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	MGLL	0	49
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	TAAR1	43	40
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	P2RY14	41	32
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	NOD1	27	43
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	NOD2	41	43
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	KCNK3	100	40
CSc1cccc(C(=O)Nc2cccc(CN3CCN(C(C)=O)CC3)c2)c1	ZINC000450975294	GG	On-Demand	Anodyne	KCNK9	53	40
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450975295	GF	On-Demand	Anodyne	PRNP	43	33
CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)c2)CC1	ZINC000450975295	GF	On-Demand	Anodyne	KCNK3	58	36
CN(C(=O)Cn1cnc2c1CCCC2)[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000450975296	GI	On-Demand	Anodyne	OPRK1	22	40
CN(C(=O)Cn1cnc2c1CCCC2)[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000450975297	GI	On-Demand	Anodyne	OPRK1	22	40
CC(=O)c1cccc(CN2C[C@H]3CCC[C@@H](C3)C2)c1	ZINC000450975299	CH	On-Demand	Anodyne	CHRM3	15	42
Cc1oc2ccc(NC(=O)CC[C@H]3CCC(=O)N3)cc2c1C	ZINC000450975301	DG	On-Demand	Anodyne	PTPRF	40	31
O=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450975310	ED	On-Demand	Anodyne	CNR1	0	40
O=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450975310	ED	On-Demand	Anodyne	HTR2A	23	41
O=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450975310	ED	On-Demand	Anodyne	HTR7	34	46
O=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450975310	ED	On-Demand	Anodyne	NPY2R	35	41
O=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450975310	ED	On-Demand	Anodyne	HTR6	25	46
O=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450975310	ED	On-Demand	Anodyne	PTGDS	31	40
O=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1F	ZINC000450975310	ED	On-Demand	Anodyne	HPGDS	25	43
Cc1csc(S(=O)(=O)N2CCN(c3ncccn3)CC2)c1	ZINC000450975311	DD	On-Demand	Anodyne	SLC6A7	0	51
Cc1oc2ccc(NC(=O)CC[C@@H]3CCC(=O)N3)cc2c1C	ZINC000450975312	DG	On-Demand	Anodyne	PTPRF	40	31
CC[C@@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450975314	CF	On-Demand	Anodyne	MTTP	55	37
CC[C@@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450975314	CF	On-Demand	Anodyne	CCR2	31	42
Cc1cc2c(N3CCN(C(=O)c4cc(C)c(C(N)=O)cn4)CC3)ncnc2s1	ZINC000450975332	GD	On-Demand	Anodyne	SIRT3	72	33
Cc1cc2c(N3CCN(C(=O)c4cc(C)c(C(N)=O)cn4)CC3)ncnc2s1	ZINC000450975332	GD	On-Demand	Anodyne	SIRT2	56	33
Cc1cc2c(N3CCN(C(=O)c4cc(C)c(C(N)=O)cn4)CC3)ncnc2s1	ZINC000450975332	GD	On-Demand	Anodyne	SIRT1	46	33
CCCCCn1nc(C)cc1NS(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450975334	GH	On-Demand	Mild	PFK	0	40
Cc1cc2c(N3CCN(C(=O)CCCC(=O)C4CC4)CC3)ncnc2s1	ZINC000450975336	FF	On-Demand	Anodyne	SIRT3	49	32
CC(C)(C)c1cc(NS(=O)(=O)c2ccc(CC#N)cc2Cl)no1	ZINC000450975347	FG	On-Demand	Mild	PFK	0	40
CCCOC[C@@H](Cc1cccc(Br)c1)NC(=O)C[C@@H](O)CC	ZINC000450975355	FG	On-Demand	Anodyne	PDS	52	38
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA2	96	68
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA6	33	68
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA1	82	66
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA7	63	68
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA13	24	43
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA5B	35	68
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA4	57	56
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA5A	30	41
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA12	62	68
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA9	66	52
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CAH_METTE	31	68
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CYNT	43	49
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	NCE103	27	43
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	P96878_MYCTU	44	36
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	CA	0	68
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	A6YCJ1_9METZ	38	68
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975357	FD	On-Demand	Anodyne	Q5TU56_ANOGA	0	68
CCCOC[C@H](Cc1cccc(Br)c1)NC(=O)C[C@@H](O)CC	ZINC000450975358	FG	On-Demand	Anodyne	PDS	52	38
CCCOC[C@@H](Cc1cccc(Br)c1)NC(=O)C[C@H](O)CC	ZINC000450975359	FG	On-Demand	Anodyne	PDS	52	38
CCCOC[C@H](Cc1cccc(Br)c1)NC(=O)C[C@H](O)CC	ZINC000450975361	FG	On-Demand	Anodyne	PDS	52	38
CCCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)CCC1CCCC1	ZINC000450975364	GG	On-Demand	Anodyne	DEF	0	48
CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2cc(C)cs2)C1	ZINC000450975370	DE	On-Demand	Anodyne	AKR1C3	16	41
COc1cccc(N2CCN(S(=O)(=O)CC3CC(F)(F)C3)CC2)c1	ZINC000450975374	FE	On-Demand	Anodyne	DRD4	42	34
CO[C@@H](CS(=O)(=O)Nc1ccc(CC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975375	GF	On-Demand	Anodyne	PTPRB	62	38
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975376	FG	On-Demand	Anodyne	ACHE	15	40
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975376	FG	On-Demand	Anodyne	CCR3	62	45
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975376	FG	On-Demand	Anodyne	CCR2	27	42
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975376	FG	On-Demand	Anodyne	MCHR1	15	43
CC(=O)c1cccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975376	FG	On-Demand	Anodyne	CACNA1I	54	42
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975377	FG	On-Demand	Anodyne	ACHE	15	40
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975377	FG	On-Demand	Anodyne	CCR3	62	45
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975377	FG	On-Demand	Anodyne	CCR2	27	42
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975377	FG	On-Demand	Anodyne	MCHR1	15	43
CC(=O)c1cccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c1	ZINC000450975377	FG	On-Demand	Anodyne	CACNA1I	54	42
CO[C@H](CS(=O)(=O)Nc1ccc(CC(=O)NC(C)C)cc1)c1ccccc1	ZINC000450975378	GF	On-Demand	Anodyne	PTPRB	62	38
CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2cc(C)cs2)C1	ZINC000450975379	DE	On-Demand	Anodyne	AKR1C3	16	41
CC(=O)c1ccc(CN2CCC(F)(C#N)CC2)cc1	ZINC000450975380	CF	On-Demand	Mild	MCHR2	42	34
CC(=O)c1ccc(CN2CCC(F)(C#N)CC2)cc1	ZINC000450975380	CF	On-Demand	Mild	NPFFR1	44	37
O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)C1(C(F)(F)F)CCC1	ZINC000450975384	FJ	On-Demand	Anodyne	ACAT	0	50
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2c2cc[nH]n2)c(OC)c1	ZINC000450975385	FF	On-Demand	Anodyne	MTNR1A	45	35
CO[C@@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000450975386	GH	On-Demand	Anodyne	SCD	31	40
COc1ccc(CNC(=O)CCN2CCCC[C@H]2c2cc[nH]n2)c(OC)c1	ZINC000450975387	FF	On-Demand	Anodyne	MTNR1A	45	35
CO[C@H](C)CS(=O)(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000450975388	GH	On-Demand	Anodyne	SCD	31	40
CCN1CCN(c2ccccc2NS(=O)(=O)c2sccc2Cl)CC1	ZINC000450975393	GG	On-Demand	Anodyne	DRD3	21	40
CCN1CCN(c2ccccc2NS(=O)(=O)c2sccc2Cl)CC1	ZINC000450975393	GG	On-Demand	Anodyne	KCNQ2	54	36
Cc1cc(C(=O)NCCc2cn(C)c3cc(Cl)ccc23)nn1C(C)C	ZINC000450975402	FH	On-Demand	Anodyne	CNR1	18	41
O=S(=O)(c1cnc(O)s1)N1CCCc2cc(Cl)ccc21	ZINC000450975405	EF	On-Demand	Anodyne	CNR1	52	33
O=S(=O)(c1cnc(O)s1)N1CCCc2cc(Cl)ccc21	ZINC000450975405	EF	On-Demand	Anodyne	CYP11B2	32	48
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1ccc(C(C)(F)F)nc1	ZINC000450975406	FI	On-Demand	Anodyne	GPBAR1	44	42
CCN(CCC(=O)NCc1ccc(OC)cc1OC)C[C@H](C)O	ZINC000450975407	DD	On-Demand	Anodyne	MTNR1A	60	42
CCN(CCC(=O)NCc1ccc(OC)cc1OC)C[C@H](C)O	ZINC000450975407	DD	On-Demand	Anodyne	MTNR1B	41	42
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	DRD2	40	60
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	DRD1	25	57
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	DRD4	27	60
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	HTR2A	24	61
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	HTR2C	18	60
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	ADRA1A	16	42
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	HRH1	15	60
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	DRD3	15	55
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	DRD5	16	44
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	ERG2	28	60
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	CCR1	20	42
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	SLC18A3	24	58
N#CC1(F)CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450975409	CG	On-Demand	Mild	CYP2J2	53	38
Cc1nn(C)c(C)c1NC(=O)CSc1ccc(Br)c(Cl)c1	ZINC000450975410	GI	On-Demand	Anodyne	FAS	55	38
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	BMP1	63	38
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	MMP13	51	40
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	ADAM17	26	41
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	MMP2	34	40
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	MMP3	33	42
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	MMP8	39	40
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	MMP9	42	40
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	LUXN	0	43
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	ADIPOR1	0	42
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000450975411	GE	On-Demand	Anodyne	ADIPOR2	0	42
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)Nc2c(C)nn(C)c2C)c1	ZINC000450975423	FF	On-Demand	Anodyne	NMT1	27	41
COc1ccccc1[C@H]1CCC[C@@H](C)N1CC1CCC(=O)CC1	ZINC000450975427	DI	On-Demand	Anodyne	HCRTR2	17	42
O=C(COc1cccc2c1C(=O)CC2)NCc1ccc(F)cc1C(F)(F)F	ZINC000450975428	GH	On-Demand	Anodyne	P2RX7	45	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCO3)cc1	ZINC000450975440	FG	On-Demand	Anodyne	CA4	18	41
COc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1F	ZINC000450975441	GG	On-Demand	Anodyne	CA12	20	46
COc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1F	ZINC000450975441	GG	On-Demand	Anodyne	CPT1B	41	36
COc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1F	ZINC000450975441	GG	On-Demand	Anodyne	CA9	24	46
COc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1F	ZINC000450975441	GG	On-Demand	Anodyne	ENPP1	65	31
COc1cc(NC(=O)Cc2ccc(S(=O)(=O)CC3CC3)cc2)ccc1F	ZINC000450975441	GG	On-Demand	Anodyne	RORC	69	42
O=S(=O)(Nc1ccccc1OCCn1ccnc1)c1ccc(C2CC2)cc1	ZINC000450975442	GH	On-Demand	Anodyne	TBXAS1	24	44
COC(=O)c1ncccc1S(=O)(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000450975446	FD	On-Demand	Anodyne	KCNA5	49	39
COC(=O)c1ncccc1S(=O)(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000450975450	FD	On-Demand	Anodyne	KCNA5	49	39
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCC(C(=O)OC)CC2)c1	ZINC000450975453	GE	On-Demand	Anodyne	EPHX2	40	42
CC[C@@H](CO)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450975459	CE	On-Demand	Anodyne	SCN9A	0	40
CC[C@@H](CO)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450975459	CE	On-Demand	Anodyne	GPR88	0	42
COC(=O)c1ccc(-c2csc(=NC3CCC3)[nH]2)o1	ZINC000450975464	CF	On-Demand	Anodyne	PDE7A	20	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	F2	20	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	ACE	37	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	MME	103	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	ANPEP	50	33
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	TACR1	20	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	FCER2	53	34
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CTSB	68	52
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	TRY2_BOVIN	68	34
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	PAPA1_CARPA	70	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CYSP_TRYCR	56	38
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CTSK	28	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CTSL	49	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CPA1	36	48
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	TIMP3	74	37
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CAPNS1	73	43
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	MMP2	18	45
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	MMP3	20	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	MMP8	16	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	PAM	0	41
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CTSS	26	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CAPN1	100	52
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	MMP9	26	41
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	CAPN2	98	52
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	ACE2	59	36
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	MMP1	22	47
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	POL	0	42
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	NPR	66	44
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	HDA106	0	45
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	RHODESAIN	0	47
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)CCOCc1ccccc1	ZINC000450975484	GD	On-Demand	Anodyne	TMPRSS11D	61	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	CA2	21	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	ACE	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	EDNRB	28	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	TACR1	30	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	MC4R	25	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	CA1	27	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	KCNA5	0	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	CCKAR	35	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	CTSL	29	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	HTR6	24	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	BRS3	26	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	NMBR	86	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	CA4	18	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	CA5A	41	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	CA14	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	MMP2	38	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	MMP8	31	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	MMP14	23	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	GRPR	73	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	ECE1	48	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	MMP11	52	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	GHSR	53	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	CFTR	33	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	ALOX15	62	67
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	MMP9	31	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	MC1R	23	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	MMP1	22	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	SLC15A2	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000450975491	GG	On-Demand	Anodyne	RUVBL1	0	40
CC[C@@H](CO)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450975493	CE	On-Demand	Anodyne	SCN9A	0	40
CC[C@@H](CO)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450975493	CE	On-Demand	Anodyne	GPR88	0	42
O=C(COc1cccc2c1C(=O)CC2)N[C@H]1CCOc2ccccc21	ZINC000450975495	EF	On-Demand	Anodyne	LUXR	65	36
O=C(COc1cccc2c1C(=O)CC2)N[C@H]1CCOc2ccccc21	ZINC000450975495	EF	On-Demand	Anodyne	TRAR	84	41
O=C(COc1cccc2c1C(=O)CC2)N[C@H]1CCOc2ccccc21	ZINC000450975495	EF	On-Demand	Anodyne	LASR	47	36
CC[C@@H](CO)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450975497	CE	On-Demand	Anodyne	SCN9A	0	40
CC[C@@H](CO)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450975497	CE	On-Demand	Anodyne	GPR88	0	42
CC[C@@H](CO)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450975499	CE	On-Demand	Anodyne	SCN9A	0	40
CC[C@@H](CO)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450975499	CE	On-Demand	Anodyne	GPR88	0	42
O=C(COc1cccc2c1C(=O)CC2)N[C@@H]1CCOc2ccccc21	ZINC000450975500	EF	On-Demand	Anodyne	LUXR	65	36
O=C(COc1cccc2c1C(=O)CC2)N[C@@H]1CCOc2ccccc21	ZINC000450975500	EF	On-Demand	Anodyne	TRAR	84	41
O=C(COc1cccc2c1C(=O)CC2)N[C@@H]1CCOc2ccccc21	ZINC000450975500	EF	On-Demand	Anodyne	LASR	47	36
C/C=C\COc1cccc(CC(=O)Nc2ccc(OC3COC3)cc2)c1	ZINC000450975509	FH	On-Demand	Anodyne	MTNR1A	22	41
CCCCCn1nc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450975511	GH	On-Demand	Anodyne	CA1	17	40
CCCCCn1nc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450975511	GH	On-Demand	Anodyne	PFK	0	51
C/C=C/COc1cccc(CC(=O)Nc2ccc(OC3COC3)cc2)c1	ZINC000450975512	FH	On-Demand	Anodyne	MTNR1A	22	41
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1cc(C)n(C(C)C)n1	ZINC000450975520	EH	On-Demand	Anodyne	GPBAR1	41	39
N#CCc1ccc(S(=O)(=O)Nc2ccc(N3CCOCC3)cn2)c(Cl)c1	ZINC000450975527	GE	On-Demand	Mild	STAT6	47	33
COCCO[C@H]1CCN(C(=O)Cc2ccc(C)cc2Br)C1	ZINC000450975547	FF	On-Demand	Anodyne	LIPG	21	40
Cc1csc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000450975549	FE	On-Demand	Anodyne	LPL	48	39
Cc1csc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000450975549	FE	On-Demand	Anodyne	AKR1C3	57	39
Cc1csc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000450975549	FE	On-Demand	Anodyne	SMO	32	41
COCCO[C@@H]1CCN(C(=O)Cc2ccc(C)cc2Br)C1	ZINC000450975551	FF	On-Demand	Anodyne	LIPG	21	40
CCC[C@@H](O)CN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450975554	CH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
Cn1cc(S(=O)(=O)Nc2ccc(N3CCOCC3)nc2)c(C(F)(F)F)n1	ZINC000450975556	GD	On-Demand	Anodyne	DGAT1	30	44
CCC[C@@H](O)CN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450975560	CH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCC[C@H](O)CN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450975564	CH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCC[C@H](O)CN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450975568	CH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COc1cc(NC(=O)C(C)(C)C2CCC2)ccc1F	ZINC000450975579	CH	On-Demand	Anodyne	QRFPR	40	35
Cc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc(C)c1O	ZINC000450975585	EH	On-Demand	Anodyne	FOLH1	40	31
Cc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc(C)c1O	ZINC000450975585	EH	On-Demand	Anodyne	ANPEP	35	42
Cc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc(C)c1O	ZINC000450975585	EH	On-Demand	Anodyne	MMP3	35	40
Cc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc(C)c1O	ZINC000450975585	EH	On-Demand	Anodyne	MMP8	19	40
Cc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc(C)c1O	ZINC000450975585	EH	On-Demand	Anodyne	CAPN1	28	43
CCOc1ccncc1S(=O)(=O)N(C)Cc1ccccc1Br	ZINC000450975593	GG	On-Demand	Anodyne	CA14	0	55
O=C(CCCc1ccccc1)N[C@@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450975612	FH	On-Demand	Anodyne	PREP	49	42
O=C(CCCc1ccccc1)N[C@@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450975612	FH	On-Demand	Anodyne	BIRC2	53	44
O=C(CCCc1ccccc1)N[C@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450975613	FH	On-Demand	Anodyne	PREP	49	42
O=C(CCCc1ccccc1)N[C@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450975613	FH	On-Demand	Anodyne	BIRC2	53	44
CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975634	GG	On-Demand	Anodyne	CA2	19	47
CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975634	GG	On-Demand	Anodyne	CA1	20	47
CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975634	GG	On-Demand	Anodyne	CA4	21	47
CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975634	GG	On-Demand	Anodyne	CA9	15	47
CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975634	GG	On-Demand	Anodyne	IDO1	27	40
CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975634	GG	On-Demand	Anodyne	LIMK2	42	40
c1ccc(CO[C@H]2CCC[C@H]2NCc2cn(CC3CC3)nn2)cc1	ZINC000450975635	EF	On-Demand	Anodyne	GBA	15	41
c1ccc(CO[C@H]2CCC[C@@H]2NCc2cn(CC3CC3)nn2)cc1	ZINC000450975637	EF	On-Demand	Anodyne	GBA	15	41
c1ccc(CO[C@@H]2CCC[C@@H]2NCc2cn(CC3CC3)nn2)cc1	ZINC000450975638	EF	On-Demand	Anodyne	GBA	15	41
c1ccc(CO[C@@H]2CCC[C@H]2NCc2cn(CC3CC3)nn2)cc1	ZINC000450975639	EF	On-Demand	Anodyne	GBA	15	41
COc1cc(CC(=O)N(C)c2ccn(C)n2)ccc1Cl	ZINC000450975640	CE	On-Demand	Anodyne	OPRK1	28	45
COc1cccc(F)c1NC(=O)CSC1CC1	ZINC000450975643	CF	On-Demand	Anodyne	QRFPR	42	35
Cc1cc(NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)cc(C)c1O	ZINC000450975647	GH	On-Demand	Mild	AR	21	42
Cc1cc(NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)cc(C)c1O	ZINC000450975647	GH	On-Demand	Mild	INHA	27	40
Cc1cc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)cc(C)c1O	ZINC000450975651	GH	On-Demand	Mild	AR	21	42
Cc1cc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)cc(C)c1O	ZINC000450975651	GH	On-Demand	Mild	INHA	27	40
Cc1csc(S(=O)(=O)Nc2ccc(OCCN3CCN(C)CC3)cc2)c1	ZINC000450975662	GE	On-Demand	Anodyne	LTA4H	38	43
Cc1csc(S(=O)(=O)Nc2ccc(OCCN3CCN(C)CC3)cc2)c1	ZINC000450975662	GE	On-Demand	Anodyne	KCNA5	0	45
Cc1csc(S(=O)(=O)Nc2ccc(OCCN3CCN(C)CC3)cc2)c1	ZINC000450975662	GE	On-Demand	Anodyne	SRC	15	43
Cc1csc(S(=O)(=O)Nc2ccc(OCCN3CCN(C)CC3)cc2)c1	ZINC000450975662	GE	On-Demand	Anodyne	PSMB2	44	34
CC1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCC(=O)CC1	ZINC000450975664	EI	On-Demand	Anodyne	JUN	25	40
CC1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCC(=O)CC1	ZINC000450975664	EI	On-Demand	Anodyne	ATF1	58	40
CC1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CCC(=O)CC1	ZINC000450975664	EI	On-Demand	Anodyne	NFKB1	54	40
COc1ccc(CC(=O)Nc2ccc(OC3COC3)cc2)c(Cl)c1OC	ZINC000450975669	GG	On-Demand	Anodyne	TSHR	55	33
Cc1ccc2cc(S(=O)(=O)NCCCOC(C)C)ccc2c1	ZINC000450975686	DG	On-Demand	Anodyne	NPY1R	0	43
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccccc1	ZINC000450975687	GG	On-Demand	Anodyne	KCNQ2	43	35
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccccc1	ZINC000450975687	GG	On-Demand	Anodyne	PRTN3	44	31
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccccc1	ZINC000450975687	GG	On-Demand	Anodyne	NPSR1	15	41
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccccc1	ZINC000450975688	GG	On-Demand	Anodyne	KCNQ2	43	35
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccccc1	ZINC000450975688	GG	On-Demand	Anodyne	PRTN3	44	31
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)N1CCCC1)c1ccccc1	ZINC000450975688	GG	On-Demand	Anodyne	NPSR1	15	41
CN1CCC[C@H](C(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000450975689	GH	On-Demand	Anodyne	CCR5	15	43
CN1CCC[C@H](C(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000450975690	GH	On-Demand	Anodyne	CCR5	15	43
CN1CCC[C@@H](C(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000450975691	GH	On-Demand	Anodyne	CCR5	15	43
CN1CCC[C@@H](C(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000450975692	GH	On-Demand	Anodyne	CCR5	15	43
Cc1ccc(NC(=O)CN(C)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450975700	GE	On-Demand	Anodyne	LTA4H	36	42
CCOC(=O)c1ccc(CN2CCC(C(C)(C)C(=O)OCC)CC2)nc1	ZINC000450975708	FG	On-Demand	Anodyne	SSTR5	44	36
CCOc1ccc([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450975720	GH	On-Demand	Anodyne	COLA	136	41
CCOc1ccc([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450975720	GH	On-Demand	Anodyne	CPT1A	127	41
CCOc1ccc([C@@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450975720	GH	On-Demand	Anodyne	CPT2	46	41
CCOc1ccc([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450975722	GH	On-Demand	Anodyne	COLA	136	41
CCOc1ccc([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450975722	GH	On-Demand	Anodyne	CPT1A	127	41
CCOc1ccc([C@H]2CCCN2C(=O)COc2cccc3c2C(=O)CC3)cc1	ZINC000450975722	GH	On-Demand	Anodyne	CPT2	46	41
CO[C@@H]1C[C@H](N(C)CCCC(=O)c2ccc(F)cc2)C1	ZINC000450975723	CF	On-Demand	Anodyne	THRA	53	37
CO[C@@H]1C[C@H](N(C)CCCC(=O)c2ccc(F)cc2)C1	ZINC000450975723	CF	On-Demand	Anodyne	DRD4	0	40
CCc1cc(CC)c(S(=O)(=O)Nc2c(C)nn(C)c2C)c(CC)c1	ZINC000450975724	EH	On-Demand	Anodyne	NMT1	45	49
CCc1cc(CC)c(S(=O)(=O)Nc2c(C)nn(C)c2C)c(CC)c1	ZINC000450975724	EH	On-Demand	Anodyne	NMT2	0	40
CCc1cc(CC)c(S(=O)(=O)Nc2c(C)nn(C)c2C)c(CC)c1	ZINC000450975724	EH	On-Demand	Anodyne	NMT	0	40
COc1cccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450975728	FF	On-Demand	Anodyne	KCNA5	31	58
COc1cccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450975728	FF	On-Demand	Anodyne	IAP	0	45
COc1cccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450975728	FF	On-Demand	Anodyne	IDO1	27	41
Cc1cncn1C1CCN(C(=O)c2ccc(Br)cc2C#N)CC1	ZINC000450975736	FG	On-Demand	Mild	L3MBTL3	47	39
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	BMP1	19	41
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP13	69	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	ADAM17	22	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP2	50	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP3	32	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP8	26	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP14	23	43
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	CAPN1	0	41
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP9	26	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP12	65	41
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP7	27	42
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	ADAMTS4	85	45
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	MMP1	21	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	LEF	23	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	LUXN	0	44
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	ADIPOR1	0	40
COC(=O)[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450975742	GC	On-Demand	Anodyne	ADIPOR2	0	40
COc1cccc(OCCC(=O)N[C@]2(C#N)CCOC2)c1	ZINC000450975744	CD	On-Demand	Mild	MTNR1A	25	42
COc1cccc(OCCC(=O)N[C@@]2(C#N)CCOC2)c1	ZINC000450975745	CD	On-Demand	Mild	MTNR1A	25	42
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1sccc1Cl	ZINC000450975746	FF	On-Demand	Anodyne	MMP3	61	45
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1sccc1Cl	ZINC000450975746	FF	On-Demand	Anodyne	MMP8	26	43
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1sccc1Cl	ZINC000450975747	FF	On-Demand	Anodyne	MMP3	61	45
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1sccc1Cl	ZINC000450975747	FF	On-Demand	Anodyne	MMP8	26	43
COc1cc(NC(=O)c2cn(CC(C)C)nc2C(F)F)ccc1F	ZINC000450975755	EH	On-Demand	Anodyne	GRM4	19	48
COc1cc(NC(=O)c2cn(CC(C)C)nc2C(F)F)ccc1F	ZINC000450975755	EH	On-Demand	Anodyne	ENPP1	68	32
COc1cc(NC(=O)c2cn(CC(C)C)nc2C(F)F)ccc1F	ZINC000450975755	EH	On-Demand	Anodyne	KCNK3	44	38
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450975756	EG	On-Demand	Bother	PQSD	0	42
C[C@H](c1ccccc1)[C@H](O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450975757	EG	On-Demand	Bother	PQSD	0	42
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450975758	EG	On-Demand	Bother	PQSD	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450975759	EG	On-Demand	Bother	PQSD	0	42
Cc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450975770	EF	On-Demand	Anodyne	PPIA	28	42
Cc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450975770	EF	On-Demand	Anodyne	BDKRB1	0	51
Cc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450975770	EF	On-Demand	Anodyne	GRM4	29	50
Cc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450975770	EF	On-Demand	Anodyne	PRTN3	52	33
COCC1(S(=O)(=O)NCC2(N3CCCCC3)CCCCC2)CC1	ZINC000450975775	EE	On-Demand	Anodyne	HCN1	51	31
COCC1(S(=O)(=O)NCC2(N3CCCCC3)CCCCC2)CC1	ZINC000450975775	EE	On-Demand	Anodyne	HCN4	49	31
COC(=O)c1ncccc1S(=O)(=O)N1CCC(c2ccccc2)CC1	ZINC000450975789	FE	On-Demand	Anodyne	EPHX2	32	40
Cc1cccc2c1N(C1CC1)CCN2C(=O)c1cc2ccncc2s1	ZINC000450975792	EI	On-Demand	Anodyne	GPBAR1	59	46
COc1cc(C(F)(F)F)cc(S(=O)(=O)NC2CCCC2)c1	ZINC000450975813	DF	On-Demand	Anodyne	SFRP1	61	32
COc1cc(C(F)(F)F)cc(S(=O)(=O)NC2CCCC2)c1	ZINC000450975813	DF	On-Demand	Anodyne	WNT3	47	32
O=S(=O)(c1ccc(C2CC2)cc1)N1CCOc2ccccc21	ZINC000450975821	DG	On-Demand	Anodyne	PKM	31	43
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)c(F)c1	ZINC000450975822	FE	On-Demand	Anodyne	CCR8	54	37
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)c(F)c1	ZINC000450975822	FE	On-Demand	Anodyne	BRD4	24	40
Cc1cc2c(N3CCN(C(=O)C(C)(C)C(C)(F)F)CC3)ncnc2s1	ZINC000450975830	FG	On-Demand	Anodyne	P2RY12	38	45
Cc1cc2c(N3CCN(C(=O)C(C)(C)C(C)(F)F)CC3)ncnc2s1	ZINC000450975830	FG	On-Demand	Anodyne	SIRT3	49	32
Cc1cc2c(N3CCN(C(=O)C(C)(C)C(C)(F)F)CC3)ncnc2s1	ZINC000450975830	FG	On-Demand	Anodyne	SIRT2	42	33
CC(C)c1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450975831	GG	On-Demand	Anodyne	RORC	17	43
CC(C)c1ccc(CN(C)S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cc1	ZINC000450975831	GG	On-Demand	Anodyne	RORB	0	43
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	DRD2	37	53
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	DRD1	17	53
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	DRD4	20	41
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	ADRA1D	21	40
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	HTR2A	15	47
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	ADRA1A	19	53
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	ADRA1B	26	42
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	ERG2	22	46
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	SIGMAR1	27	46
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	CCR1	45	40
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	SLC18A3	0	51
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	EBP	18	46
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	CYP2J2	61	43
N#CC1(F)CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975832	CF	On-Demand	Mild	AP2S1	0	46
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	GNRHR	0	40
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	AVPR1B	26	42
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	BMP1	52	37
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	KCNA5	26	50
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	MMP13	50	42
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	ADAM17	28	41
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	KCND3	0	41
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	MMP9	41	41
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	MMP7	52	42
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	IAP	0	40
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	MMP1	55	41
COc1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450975839	DG	On-Demand	Anodyne	FFAR4	22	41
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	CA2	20	51
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	CA1	27	41
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	KCNA5	25	45
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	MMP13	37	41
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	P2RX7	0	40
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	CA14	21	43
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	MMP2	27	41
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	MMP12	56	38
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	CA12	22	40
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	IAP	0	40
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	ADAMTS4	52	37
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	CA9	26	40
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	ENPP1	60	31
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	MTCA1	27	40
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1ccc(CNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1OC	ZINC000450975851	GF	On-Demand	Anodyne	GLMU	0	41
C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)C1CC(C)(O)C1	ZINC000450975856	DF	On-Demand	Anodyne	MDM2	67	33
C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)C1CC(C)(O)C1	ZINC000450975857	DF	On-Demand	Anodyne	MDM2	67	33
C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)C1CC(C)(O)C1	ZINC000450975859	DF	On-Demand	Anodyne	MDM2	67	33
C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)C1CC(C)(O)C1	ZINC000450975861	DF	On-Demand	Anodyne	MDM2	67	33
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975880	FG	On-Demand	Anodyne	SIGMAR1	17	42
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975880	FG	On-Demand	Anodyne	PREP	54	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975880	FG	On-Demand	Anodyne	BIRC2	48	39
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975883	FG	On-Demand	Anodyne	SIGMAR1	17	42
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975883	FG	On-Demand	Anodyne	PREP	54	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975883	FG	On-Demand	Anodyne	BIRC2	48	39
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975885	FG	On-Demand	Anodyne	SIGMAR1	17	42
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975885	FG	On-Demand	Anodyne	PREP	54	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(C[C@@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975885	FG	On-Demand	Anodyne	BIRC2	48	39
CCc1cccc(Cc2cnc(NS(=O)(=O)C[C@@H](C)OC)s2)c1	ZINC000450975886	FG	On-Demand	Anodyne	SCD	26	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975887	FG	On-Demand	Anodyne	SIGMAR1	17	42
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975887	FG	On-Demand	Anodyne	PREP	54	40
O=C(CCCc1ccccc1)N[C@@H]1CCCN(C[C@H]2C[C@H]3CC[C@H]2O3)C1	ZINC000450975887	FG	On-Demand	Anodyne	BIRC2	48	39
CCc1cccc(Cc2cnc(NS(=O)(=O)C[C@H](C)OC)s2)c1	ZINC000450975889	FG	On-Demand	Anodyne	SCD	26	40
CCc1cccc(C(=O)N[C@@H]2CC[C@H](C)C2)n1	ZINC000450975890	BF	On-Demand	Anodyne	PDE5A	0	40
CCc1cccc(C(=O)N[C@@H]2CC[C@H](C)C2)n1	ZINC000450975890	BF	On-Demand	Anodyne	INHA	46	32
Cc1cc2c(N3CCN(C(=O)CC4CC(F)(F)C4)CC3)ncnc2s1	ZINC000450975891	FG	On-Demand	Anodyne	SIRT3	48	31
Cc1cc2c(N3CCN(C(=O)CC4CC(F)(F)C4)CC3)ncnc2s1	ZINC000450975891	FG	On-Demand	Anodyne	SIRT2	41	31
CCc1cccc(C(=O)N[C@H]2CC[C@H](C)C2)n1	ZINC000450975892	BF	On-Demand	Anodyne	PDE5A	0	40
CCc1cccc(C(=O)N[C@H]2CC[C@H](C)C2)n1	ZINC000450975892	BF	On-Demand	Anodyne	INHA	46	32
CCc1cccc(C(=O)N[C@H]2CC[C@@H](C)C2)n1	ZINC000450975894	BF	On-Demand	Anodyne	PDE5A	0	40
CCc1cccc(C(=O)N[C@H]2CC[C@@H](C)C2)n1	ZINC000450975894	BF	On-Demand	Anodyne	INHA	46	32
CCc1cccc(C(=O)N[C@@H]2CC[C@@H](C)C2)n1	ZINC000450975896	BF	On-Demand	Anodyne	PDE5A	0	40
CCc1cccc(C(=O)N[C@@H]2CC[C@@H](C)C2)n1	ZINC000450975896	BF	On-Demand	Anodyne	INHA	46	32
CCOc1ccccc1NC(=O)CN[C@@H]1C[C@H](OCC)C12CCCC2	ZINC000450975913	EG	On-Demand	Anodyne	HCN1	44	35
CCOc1ccccc1NC(=O)CN[C@@H]1C[C@H](OCC)C12CCCC2	ZINC000450975913	EG	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1NC(=O)CN[C@@H]1C[C@@H](OCC)C12CCCC2	ZINC000450975916	EG	On-Demand	Anodyne	HCN1	44	35
CCOc1ccccc1NC(=O)CN[C@@H]1C[C@@H](OCC)C12CCCC2	ZINC000450975916	EG	On-Demand	Anodyne	HCN4	44	35
CO[C@@H](CS(=O)(=O)NCCC(=O)Nc1cccnc1)c1ccccc1	ZINC000450975919	FD	On-Demand	Anodyne	ADRB3	31	40
CO[C@@H](CS(=O)(=O)NCCC(=O)Nc1cccnc1)c1ccccc1	ZINC000450975919	FD	On-Demand	Anodyne	KCNA5	44	37
CCOc1ccccc1NC(=O)CN[C@H]1C[C@H](OCC)C12CCCC2	ZINC000450975920	EG	On-Demand	Anodyne	HCN1	44	35
CCOc1ccccc1NC(=O)CN[C@H]1C[C@H](OCC)C12CCCC2	ZINC000450975920	EG	On-Demand	Anodyne	HCN4	44	35
CO[C@H](CS(=O)(=O)NCCC(=O)Nc1cccnc1)c1ccccc1	ZINC000450975922	FD	On-Demand	Anodyne	ADRB3	31	40
CO[C@H](CS(=O)(=O)NCCC(=O)Nc1cccnc1)c1ccccc1	ZINC000450975922	FD	On-Demand	Anodyne	KCNA5	44	37
CCOc1ccccc1NC(=O)CN[C@H]1C[C@@H](OCC)C12CCCC2	ZINC000450975923	EG	On-Demand	Anodyne	HCN1	44	35
CCOc1ccccc1NC(=O)CN[C@H]1C[C@@H](OCC)C12CCCC2	ZINC000450975923	EG	On-Demand	Anodyne	HCN4	44	35
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2	ZINC000450975927	GE	On-Demand	Anodyne	ADAMTS4	40	34
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2	ZINC000450975927	GE	On-Demand	Anodyne	LUXN	0	41
CCOC(=O)c1cc(S(=O)(=O)Nc2c(C)nn(C)c2C)cnc1C(F)F	ZINC000450975930	GE	On-Demand	Anodyne	NMT1	25	41
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2	ZINC000450975931	GE	On-Demand	Anodyne	ADAMTS4	40	34
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2	ZINC000450975931	GE	On-Demand	Anodyne	LUXN	0	41
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2	ZINC000450975936	GE	On-Demand	Anodyne	ADAMTS4	40	34
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2	ZINC000450975936	GE	On-Demand	Anodyne	LUXN	0	41
COc1cc(CC(=O)N(C)CC2(O)CCOCC2)ccc1Cl	ZINC000450975937	ED	On-Demand	Anodyne	OPRK1	0	47
CCN(CC)C(=O)c1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450975938	GE	On-Demand	Anodyne	LIMK2	22	42
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2	ZINC000450975940	GE	On-Demand	Anodyne	ADAMTS4	40	34
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2	ZINC000450975940	GE	On-Demand	Anodyne	LUXN	0	41
CCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450975942	FE	On-Demand	Anodyne	CA2	16	48
CCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450975942	FE	On-Demand	Anodyne	CA1	19	41
CCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450975942	FE	On-Demand	Anodyne	CA14	15	42
CCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450975942	FE	On-Demand	Anodyne	TGM2	21	43
CCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450975942	FE	On-Demand	Anodyne	F13A1	39	44
CCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450975942	FE	On-Demand	Anodyne	CCR8	96	41
CCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450975942	FE	On-Demand	Anodyne	SFRP1	97	37
CCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450975942	FE	On-Demand	Anodyne	WNT3	65	35
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ncccn4)CC3)ccc2c1	ZINC000450975946	FE	On-Demand	Anodyne	PKM	45	45
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ncccn4)CC3)ccc2c1	ZINC000450975946	FE	On-Demand	Anodyne	TGM2	15	40
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ncccn4)CC3)ccc2c1	ZINC000450975946	FE	On-Demand	Anodyne	GCK	43	36
Cc1ccc2cc(S(=O)(=O)N3CCN(c4ncccn4)CC3)ccc2c1	ZINC000450975946	FE	On-Demand	Anodyne	F13A1	15	40
O=C(COc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1)NC1CC1	ZINC000450975948	GB	On-Demand	Anodyne	EPHX2	27	52
O=C(COc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1)NC1CC1	ZINC000450975948	GB	On-Demand	Anodyne	LUXN	0	40
O=C(COc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1)NC1CC1	ZINC000450975948	GB	On-Demand	Anodyne	ADIPOR1	0	47
O=C(COc1ccc(S(=O)(=O)NCCN2CCOCC2)cc1)NC1CC1	ZINC000450975948	GB	On-Demand	Anodyne	ADIPOR2	0	47
COc1cc(NC(=O)CC2CC(F)(F)C2)ccc1F	ZINC000450975960	CG	On-Demand	Anodyne	ENV	42	34
COc1cc(NC(=O)CC2CC(F)(F)C2)ccc1F	ZINC000450975960	CG	On-Demand	Anodyne	ENPP1	60	36
Cc1cc2c(N3CCN(C(=O)[C@@H]4CCCCC4(F)F)CC3)ncnc2s1	ZINC000450975963	GG	On-Demand	Anodyne	SIRT3	42	32
Cc1cc2c(N3CCN(C(=O)[C@H]4CCCCC4(F)F)CC3)ncnc2s1	ZINC000450975965	GG	On-Demand	Anodyne	SIRT3	42	32
C[C@@H]1C[C@]1(C#N)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450975970	DG	On-Demand	Mild	ACAT	0	45
C[C@@H]1C[C@@]1(C#N)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450975971	DG	On-Demand	Mild	ACAT	0	45
C[C@H]1C[C@]1(C#N)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450975972	DG	On-Demand	Mild	ACAT	0	45
C[C@H]1C[C@@]1(C#N)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450975973	DG	On-Demand	Mild	ACAT	0	45
CC(C)c1cccc(C(C)C)c1NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450975981	FK	On-Demand	Anodyne	SOAT1	53	40
CC(C)c1cccc(C(C)C)c1NC(=O)COc1cccc2c1C(=O)CC2	ZINC000450975981	FK	On-Demand	Anodyne	ACAT	0	47
Cc1cc2c(N3CCN(C(=O)CSC4CC4)CC3)ncnc2s1	ZINC000450975982	EF	On-Demand	Anodyne	SIRT3	51	34
Cc1cc2c(N3CCN(C(=O)CSC4CC4)CC3)ncnc2s1	ZINC000450975982	EF	On-Demand	Anodyne	SIRT2	51	33
Cc1cc2c(N3CCN(C(=O)CSC4CC4)CC3)ncnc2s1	ZINC000450975982	EF	On-Demand	Anodyne	SIRT1	50	32
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	CHRM2	22	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	HTR1A	20	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	THRA	0	40
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	CHRM1	27	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	DRD2	28	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	DRD4	19	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	ACHE	22	49
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	HTR2A	27	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	HTR2C	23	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	SLC6A1	78	37
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	ADRA1A	17	50
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	HRH1	29	50
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	DRD3	17	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	HTR4	56	40
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	CHRM4	33	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	CHRM5	32	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	ADRA2B	0	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	CHRM3	30	52
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	THRB	0	40
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	HTR7	28	46
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	SIGMAR1	30	47
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	AMY2	48	33
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	CYP2J2	82	59
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)c2ccccc2)CC1	ZINC000450975987	EH	On-Demand	Anodyne	MEN1	47	35
O=C1CCc2cccc(OCC(=O)N3CCC(c4ccccc4)=N3)c21	ZINC000450975988	EF	On-Demand	Anodyne	PTGIR	49	36
Cc1csc(S(=O)(=O)Nc2ccc(N3CCCC3=O)cc2)c1	ZINC000450976006	EF	On-Demand	Anodyne	AKR1C3	23	44
O=C(COc1cccc2c1C(=O)CC2)NCCc1ccc(F)cc1	ZINC000450976007	EF	On-Demand	Anodyne	CYSP_TRYCR	0	40
CC(F)(F)c1cccc(NC(=O)C2(C(=O)C3CC3)CC2)c1	ZINC000450976010	CG	On-Demand	Anodyne	DHODH	0	44
CC(C)CC[C@@H](C)NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450976014	EE	On-Demand	Anodyne	RORB	0	41
CCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)CCC1CCCCC1	ZINC000450976020	GG	On-Demand	Anodyne	DEF	0	47
Cc1csc(S(=O)(=O)NCCCN2CCC(C)CC2)c1	ZINC000450976025	DE	On-Demand	Anodyne	HTR7	32	40
CC(C)CC[C@H](C)NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450976027	EE	On-Demand	Anodyne	RORB	0	41
Fc1cccc(OCCn2cnc3c2CCCC3)c1	ZINC000450976029	CF	On-Demand	Anodyne	CHRNA10	34	42
CC(=O)N1CCN(Cc2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450976030	GG	On-Demand	Anodyne	HTR1A	16	46
CC(=O)N1CCN(Cc2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450976030	GG	On-Demand	Anodyne	HTR1D	26	46
CC(=O)N1CCN(Cc2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450976030	GG	On-Demand	Anodyne	HTR1B	22	46
CC(=O)N1CCN(Cc2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450976030	GG	On-Demand	Anodyne	FAAH	23	42
CC(=O)N1CCN(Cc2cccc(NC(=O)c3scnc3C(C)C)c2)CC1	ZINC000450976030	GG	On-Demand	Anodyne	MCHR1	21	41
COc1cccc(CNS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)c1	ZINC000450976039	FD	On-Demand	Anodyne	MTNR1A	19	40
CN(C)CCC(=O)Nc1ccc(NS(=O)(=O)CCC2CCCCC2)cc1	ZINC000450976042	GG	On-Demand	Anodyne	LDLR	0	46
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	CA2	23	50
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	MME	26	41
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	CNR2	0	63
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	BMP1	78	45
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	CA7	17	44
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	MMP13	46	44
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	COLA	84	43
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	CA5B	41	44
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	CA4	24	49
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	CA5A	47	44
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	CA14	15	43
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	MMP2	54	49
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	MMP3	48	46
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	MMP8	61	49
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	MMP9	44	49
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	MMP12	58	47
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	PLAU	41	37
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	CXCR3	19	46
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	ADAMTS4	42	41
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	MMP1	40	49
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	POL	0	41
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	F13A1	27	40
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	LIMK2	45	39
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	RORC	47	47
CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976057	FG	On-Demand	Anodyne	NAMPT	17	48
Cc1cc2c(N3CCN(C(=O)[C@@H]4C[C@H]4C(F)(F)F)CC3)ncnc2s1	ZINC000450976064	FF	On-Demand	Anodyne	SIRT3	48	31
CCOC(=O)c1cnn(C2CCN(Cc3ccccc3OC3CC3)CC2)c1C	ZINC000450976075	GH	On-Demand	Anodyne	SSTR5	49	34
CCN(CCCC(=O)c1ccc(F)cc1)C[C@H](C)O	ZINC000450976077	CE	On-Demand	Anodyne	THRA	42	40
CCN(CCCC(=O)c1ccc(F)cc1)C[C@H](C)O	ZINC000450976077	CE	On-Demand	Anodyne	THRB	0	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc(C)nc2C)c1	ZINC000450976086	FH	On-Demand	Anodyne	NFKBIA	0	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc(C)nc2C)c1	ZINC000450976086	FH	On-Demand	Anodyne	FFAR4	22	42
CN(C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976087	FE	On-Demand	Anodyne	DRD2	29	43
CN(C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976087	FE	On-Demand	Anodyne	HTR2A	28	52
CN(C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976087	FE	On-Demand	Anodyne	HTR2C	22	50
CN(C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976087	FE	On-Demand	Anodyne	SLC6A1	106	36
CN(C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976087	FE	On-Demand	Anodyne	ERG2	19	43
CN(C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976087	FE	On-Demand	Anodyne	CCR3	70	43
CN(C[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976087	FE	On-Demand	Anodyne	CYP2J2	51	36
CN(C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976088	FE	On-Demand	Anodyne	DRD2	29	43
CN(C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976088	FE	On-Demand	Anodyne	HTR2A	28	52
CN(C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976088	FE	On-Demand	Anodyne	HTR2C	22	50
CN(C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976088	FE	On-Demand	Anodyne	SLC6A1	106	36
CN(C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976088	FE	On-Demand	Anodyne	ERG2	19	43
CN(C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976088	FE	On-Demand	Anodyne	CCR3	70	43
CN(C[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1)S(C)(=O)=O	ZINC000450976088	FE	On-Demand	Anodyne	CYP2J2	51	36
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450976089	FG	On-Demand	Anodyne	RAF1	16	40
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450976089	FG	On-Demand	Anodyne	FLT3	40	37
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450976089	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C(C)(C)C)on2)cc1	ZINC000450976089	FG	On-Demand	Anodyne	PFK	0	42
COC[C@@]1(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)CCOC1	ZINC000450976094	FF	On-Demand	Anodyne	ACAT	0	47
COC[C@]1(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)CCOC1	ZINC000450976095	FF	On-Demand	Anodyne	ACAT	0	47
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCn3ncnc32)cc1	ZINC000450976110	GC	On-Demand	Anodyne	MTNN	40	35
COC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450976116	FF	On-Demand	Anodyne	NPY2R	25	46
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@@H](c2ccccc2)N(C)C)cc1	ZINC000450976118	GF	On-Demand	Anodyne	TMPRSS11D	55	34
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@H](c2ccccc2)N(C)C)cc1	ZINC000450976120	GF	On-Demand	Anodyne	TMPRSS11D	55	34
COc1c(C)ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450976126	GH	On-Demand	Anodyne	CA1	17	41
COc1c(C)ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450976126	GH	On-Demand	Anodyne	MMP13	23	46
COc1c(C)ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450976126	GH	On-Demand	Anodyne	MMP7	16	46
COc1ccccc1-n1cnc2cc(C(=O)N(C)CC3(O)CCOCC3)ccc21	ZINC000450976127	GF	On-Demand	Anodyne	HPGD	47	57
CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450976135	GB	On-Demand	Anodyne	RBP4	77	35
CNS(=O)(=O)NCC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450976135	GB	On-Demand	Anodyne	SFRP1	67	35
CC1(O)CC(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)C1	ZINC000450976143	EG	On-Demand	Anodyne	ACAT	0	48
CC(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n[nH]1	ZINC000450976145	GD	On-Demand	Anodyne	ADAMTS4	43	33
CC(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n[nH]1	ZINC000450976145	GD	On-Demand	Anodyne	LUXN	0	44
CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450976149	GB	On-Demand	Anodyne	RBP4	77	35
CNS(=O)(=O)NCC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000450976149	GB	On-Demand	Anodyne	SFRP1	67	35
CC[C@@H](C#N)NC(=O)[C@H]1CCC[C@@H]1CC	ZINC000450976161	BE	On-Demand	Mild	LGMN	43	31
CC[C@@H](C#N)NC(=O)[C@@H]1CCC[C@@H]1CC	ZINC000450976162	BE	On-Demand	Mild	LGMN	43	31
CC[C@@H](C#N)NC(=O)[C@@H]1CCC[C@H]1CC	ZINC000450976163	BE	On-Demand	Mild	LGMN	43	31
CC[C@@H](C#N)NC(=O)[C@H]1CCC[C@H]1CC	ZINC000450976164	BE	On-Demand	Mild	LGMN	43	31
CCS[C@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450976174	FF	On-Demand	Anodyne	MTR1B_CHICK	0	41
CCS[C@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450976174	FF	On-Demand	Anodyne	MTNR1A	40	36
CCS[C@@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450976175	FF	On-Demand	Anodyne	MTR1B_CHICK	0	41
CCS[C@@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450976175	FF	On-Demand	Anodyne	MTNR1A	40	36
CCS[C@@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450976177	FF	On-Demand	Anodyne	MTR1B_CHICK	0	41
CCS[C@@H]1CCC[C@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450976177	FF	On-Demand	Anodyne	MTNR1A	40	36
CCS[C@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450976179	FF	On-Demand	Anodyne	MTR1B_CHICK	0	41
CCS[C@H]1CCC[C@@H]1NCCC(=O)NCc1ccc(OC)cc1OC	ZINC000450976179	FF	On-Demand	Anodyne	MTNR1A	40	36
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c1	ZINC000450976180	FF	On-Demand	Anodyne	CA4	17	40
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c1	ZINC000450976180	FF	On-Demand	Anodyne	MTNN	43	33
O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)C1(C(=O)C2CC2)CC1	ZINC000450976183	FH	On-Demand	Anodyne	ACAT	0	47
CCOC(=O)c1cnn(C2CCN(CCc3ccc(Cl)cc3)CC2)c1C	ZINC000450976184	GH	On-Demand	Anodyne	SLC6A1	24	41
CCOC(=O)c1cnn(C2CCN(CCc3ccc(Cl)cc3)CC2)c1C	ZINC000450976184	GH	On-Demand	Anodyne	HTR4	44	34
Cc1csc(S(=O)(=O)Nc2ccc(CC(=O)NC(C)C)cc2)c1	ZINC000450976195	FF	On-Demand	Anodyne	MTNN	42	33
COCCO[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450976211	GF	On-Demand	Anodyne	AVPR1B	40	39
COCCO[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450976211	GF	On-Demand	Anodyne	PDE6D	99	44
COCCO[C@@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450976211	GF	On-Demand	Anodyne	IMDH_CRYPV	28	43
COCCO[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450976212	GF	On-Demand	Anodyne	AVPR1B	40	39
COCCO[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450976212	GF	On-Demand	Anodyne	PDE6D	99	44
COCCO[C@H]1CCN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450976212	GF	On-Demand	Anodyne	IMDH_CRYPV	28	43
CC[C@@H]1C[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F	ZINC000450976227	EH	On-Demand	Anodyne	NAMPT	29	43
FC(F)(F)c1cccc([C@H]2CCCN(CCc3cscn3)C2)c1	ZINC000450976228	EJ	On-Demand	Anodyne	CCR2	16	40
FC(F)(F)c1cccc([C@@H]2CCCN(CCc3cscn3)C2)c1	ZINC000450976231	EJ	On-Demand	Anodyne	CCR2	16	40
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450976236	DE	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C)C(C)C)cc1	ZINC000450976236	DE	On-Demand	Anodyne	TMPRSS11D	59	38
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450976238	DE	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)C(C)C)cc1	ZINC000450976238	DE	On-Demand	Anodyne	TMPRSS11D	59	38
CC(=O)N[C@@H](C)C1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450976244	FG	On-Demand	Anodyne	CCR1	41	45
CC(=O)N[C@@H](C)C1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450976244	FG	On-Demand	Anodyne	TIMP3	41	33
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976249	FI	On-Demand	Anodyne	ANPEP	27	46
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976249	FI	On-Demand	Anodyne	MMP2	16	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976249	FI	On-Demand	Anodyne	MMP3	38	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976249	FI	On-Demand	Anodyne	CAPN1	29	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976249	FI	On-Demand	Anodyne	MMP1	0	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976249	FI	On-Demand	Anodyne	FPR1	56	41
Cc1nn(C)c(C)c1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450976251	DE	On-Demand	Anodyne	NMT1	35	45
Cc1nn(C)c(C)c1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450976251	DE	On-Demand	Anodyne	NMT2	0	41
Cc1nn(C)c(C)c1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450976251	DE	On-Demand	Anodyne	NMT	0	41
CCOC(=O)CC1(S(=O)(=O)N(C)Cc2cccc(OC)c2)CC1	ZINC000450976261	ED	On-Demand	Anodyne	HSD17B2	19	42
CN(C(=O)C1(Cc2cccc(Cl)c2)CC1)c1ccn(C)n1	ZINC000450976262	DG	On-Demand	Anodyne	SLC6A9	0	42
COc1cc(NC(=O)CCCC(C)C)ccc1F	ZINC000450976274	CH	On-Demand	Anodyne	ENPP1	60	35
COc1cc(NC(=O)CCCC(C)C)ccc1F	ZINC000450976274	CH	On-Demand	Anodyne	ACAT	0	49
CCOC(=O)c1ccc(CS(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450976275	GF	On-Demand	Anodyne	PPARG	27	43
CCOC(=O)c1ccc(CS(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450976275	GF	On-Demand	Anodyne	LTA4H	29	45
CCOC(=O)c1ccc(CS(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450976275	GF	On-Demand	Anodyne	PLA2G4B	44	32
CCOC(=O)c1ccc(CS(=O)(=O)N(C)CCOc2ccccc2)cc1	ZINC000450976275	GF	On-Demand	Anodyne	ESRRG	46	36
C[C@H]1CC[C@@H](NC(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450976281	CG	On-Demand	Anodyne	INHA	85	36
C[C@H]1CC[C@H](NC(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450976282	CG	On-Demand	Anodyne	INHA	85	36
C[C@@H]1CC[C@H](NC(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450976283	CG	On-Demand	Anodyne	INHA	85	36
C[C@@H]1CC[C@@H](NC(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450976284	CG	On-Demand	Anodyne	INHA	85	36
Cc1ccn2ncc(C(=O)NC[C@@]3(O)CCC[C@H](C(F)(F)F)C3)c2c1	ZINC000450976287	FF	On-Demand	Anodyne	EPHB3	25	43
Cc1ccn2ncc(C(=O)NC[C@]3(O)CCC[C@H](C(F)(F)F)C3)c2c1	ZINC000450976288	FF	On-Demand	Anodyne	EPHB3	25	43
Cc1ccn2ncc(C(=O)NC[C@@]3(O)CCC[C@@H](C(F)(F)F)C3)c2c1	ZINC000450976289	FF	On-Demand	Anodyne	EPHB3	25	43
Cc1ccn2ncc(C(=O)NC[C@]3(O)CCC[C@@H](C(F)(F)F)C3)c2c1	ZINC000450976290	FF	On-Demand	Anodyne	EPHB3	25	43
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	CA2	34	60
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	CA1	43	54
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	CA7	15	51
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MMP13	59	54
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	CA4	30	54
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	CA14	21	53
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MMP2	45	55
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MMP3	21	54
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MMP8	23	54
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MMP14	19	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	CAPN1	0	45
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MMP9	28	54
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MMP12	93	47
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	CA12	30	40
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MMP7	26	48
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	ADAMTS4	70	44
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	CA9	30	43
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	LEF	55	39
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	IDO1	35	40
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	MTCA1	40	36
COC(=O)[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(C)C	ZINC000450976308	FD	On-Demand	Anodyne	P96878_MYCTU	51	40
C[C@@H]1CC[C@H](NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450976309	EF	On-Demand	Mild	AR	16	46
C[C@@H]1CC[C@@H](NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450976310	EF	On-Demand	Mild	AR	16	46
C[C@@H]1CC[C@@H](NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450976311	EF	On-Demand	Mild	AR	16	46
C[C@@H]1CC[C@H](NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450976312	EF	On-Demand	Mild	AR	16	46
CCOc1cc(N2CCN(C)CC2)ccc1NS(=O)(=O)c1cc(C)cs1	ZINC000450976318	GG	On-Demand	Anodyne	GHSR	0	40
CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(F)c(OC)c1	ZINC000450976319	CH	On-Demand	Anodyne	ENPP1	48	29
CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(F)c(OC)c1	ZINC000450976320	CH	On-Demand	Anodyne	ENPP1	48	29
C[C@@H]1CC[C@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450976327	CF	On-Demand	Anodyne	EPHX2	27	42
C[C@@H]1CC[C@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450976328	CF	On-Demand	Anodyne	EPHX2	27	42
C[C@@H]1CC[C@@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450976329	CF	On-Demand	Anodyne	EPHX2	27	42
C[C@@H]1CC[C@@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450976330	CF	On-Demand	Anodyne	EPHX2	27	42
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2F)cc1)NC1CC1	ZINC000450976331	GD	On-Demand	Anodyne	MMP13	17	42
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2F)cc1)NC1CC1	ZINC000450976331	GD	On-Demand	Anodyne	ADAM17	15	40
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2F)cc1)NC1CC1	ZINC000450976331	GD	On-Demand	Anodyne	LUXN	0	48
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2F)cc1)NC1CC1	ZINC000450976331	GD	On-Demand	Anodyne	ADIPOR1	0	44
O=C(COc1ccc(S(=O)(=O)NCc2ccccc2F)cc1)NC1CC1	ZINC000450976331	GD	On-Demand	Anodyne	ADIPOR2	0	44
CCCCO[C@@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976332	GG	On-Demand	Bother	CACNA1C	48	36
CCCCO[C@@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976332	GG	On-Demand	Bother	CACNA1D	79	34
CCCCO[C@@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976332	GG	On-Demand	Bother	KCNMA1	20	44
CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976333	GG	On-Demand	Bother	CACNA1C	48	36
CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976333	GG	On-Demand	Bother	CACNA1D	79	34
CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976333	GG	On-Demand	Bother	KCNMA1	20	44
CCCCO[C@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976334	GG	On-Demand	Bother	CACNA1C	48	36
CCCCO[C@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976334	GG	On-Demand	Bother	CACNA1D	79	34
CCCCO[C@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976334	GG	On-Demand	Bother	KCNMA1	20	44
CCCCO[C@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976335	GG	On-Demand	Bother	CACNA1C	48	36
CCCCO[C@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976335	GG	On-Demand	Bother	CACNA1D	79	34
CCCCO[C@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C	ZINC000450976335	GG	On-Demand	Bother	KCNMA1	20	44
Cc1ccc2cc(S(=O)(=O)N3CCC(C(N)=O)CC3)ccc2c1	ZINC000450976357	EE	On-Demand	Anodyne	CHRM5	22	45
Cc1ccc2cc(S(=O)(=O)N3CCC(C(N)=O)CC3)ccc2c1	ZINC000450976357	EE	On-Demand	Anodyne	EPHX2	42	46
Cc1ccc2cc(S(=O)(=O)N3CCC(C(N)=O)CC3)ccc2c1	ZINC000450976357	EE	On-Demand	Anodyne	PKM	29	40
Cc1ccc2cc(S(=O)(=O)N3CCC(C(N)=O)CC3)ccc2c1	ZINC000450976357	EE	On-Demand	Anodyne	AKR1C3	22	46
COc1ccc(CNC(=O)COc2cccc3c2C(=O)CC3)cc1OC	ZINC000450976387	FF	On-Demand	Anodyne	TRPV1	22	42
COc1ccc(CNC(=O)COc2cccc3c2C(=O)CC3)cc1OC	ZINC000450976387	FF	On-Demand	Anodyne	DRTS_TRYCR	47	32
COC(=O)c1ncccc1S(=O)(=O)N[C@H](C)CCc1ccccc1	ZINC000450976393	EE	On-Demand	Anodyne	SDH1	0	42
COC(=O)c1ncccc1S(=O)(=O)N[C@H](C)CCc1ccccc1	ZINC000450976393	EE	On-Demand	Anodyne	MMP2	25	40
COC(=O)c1ncccc1S(=O)(=O)N[C@H](C)CCc1ccccc1	ZINC000450976393	EE	On-Demand	Anodyne	MMP3	33	40
COC(=O)c1ncccc1S(=O)(=O)N[C@H](C)CCc1ccccc1	ZINC000450976393	EE	On-Demand	Anodyne	CAPN2	47	34
COC(=O)c1ncccc1S(=O)(=O)N[C@H](C)CCc1ccccc1	ZINC000450976393	EE	On-Demand	Anodyne	ADAMTS4	46	35
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](C)CCc1ccccc1	ZINC000450976394	EE	On-Demand	Anodyne	SDH1	0	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](C)CCc1ccccc1	ZINC000450976394	EE	On-Demand	Anodyne	MMP2	25	40
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](C)CCc1ccccc1	ZINC000450976394	EE	On-Demand	Anodyne	MMP3	33	40
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](C)CCc1ccccc1	ZINC000450976394	EE	On-Demand	Anodyne	CAPN2	47	34
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](C)CCc1ccccc1	ZINC000450976394	EE	On-Demand	Anodyne	ADAMTS4	46	35
COc1ccc(NC(=O)c2ccccc2NS(=O)(=O)CCCCF)cc1	ZINC000450976399	GG	On-Demand	Anodyne	CA1	51	38
COc1ccc(NC(=O)c2ccccc2NS(=O)(=O)CCCCF)cc1	ZINC000450976399	GG	On-Demand	Anodyne	PRTN3	48	35
COc1ccc(NC(=O)c2ccccc2NS(=O)(=O)CCCCF)cc1	ZINC000450976399	GG	On-Demand	Anodyne	CA12	23	40
COc1ccc(NC(=O)c2ccccc2NS(=O)(=O)CCCCF)cc1	ZINC000450976399	GG	On-Demand	Anodyne	CA9	23	40
COc1ccc(NC(=O)c2ccccc2NS(=O)(=O)CCCCF)cc1	ZINC000450976399	GG	On-Demand	Anodyne	AKR1C2	31	43
COc1ccc(NC(=O)c2ccccc2NS(=O)(=O)CCCCF)cc1	ZINC000450976399	GG	On-Demand	Anodyne	KCNK3	54	36
COc1ccc(NC(=O)c2ccccc2NS(=O)(=O)CCCCF)cc1	ZINC000450976399	GG	On-Demand	Anodyne	KCNK9	41	36
Cc1cc2c(N3CCN(C(=O)Cc4cn(C)nc4C)CC3)ncnc2s1	ZINC000450976404	FD	On-Demand	Anodyne	SIRT3	47	31
CC(=O)N[C@H](C)C1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450976405	FG	On-Demand	Anodyne	CCR1	41	45
CC(=O)N[C@H](C)C1CCN(C(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450976405	FG	On-Demand	Anodyne	TIMP3	41	33
COC(=O)c1coc(CN(C)CCc2ccccc2[N+](=O)[O-])n1	ZINC000450976410	DE	On-Demand	Bother	COLA	97	39
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	CA2	15	51
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	BMP1	65	42
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	CA1	19	41
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	CA7	17	42
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	COLA	58	41
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	MMP2	35	43
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	MMP8	43	43
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	MMP9	32	43
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	MMP1	22	43
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450976427	FG	On-Demand	Anodyne	RORC	22	48
COc1cc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450976431	EE	On-Demand	Anodyne	AVPR1B	45	38
COc1cc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450976431	EE	On-Demand	Anodyne	SSTR5	43	40
COc1cc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450976431	EE	On-Demand	Anodyne	UTS2R	30	42
COc1cc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450976432	EE	On-Demand	Anodyne	AVPR1B	45	38
COc1cc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450976432	EE	On-Demand	Anodyne	SSTR5	43	40
COc1cc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)ccc1Cl	ZINC000450976432	EE	On-Demand	Anodyne	UTS2R	30	42
FC(F)(F)c1ccccc1CN(Cc1cn(CC2CC2)nn1)CC1CC1	ZINC000450976436	FI	On-Demand	Anodyne	HSP90AB1	17	40
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	CA2	20	47
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	LPL	20	43
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MME	19	42
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	BMP1	82	46
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	CA7	15	40
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MMP13	60	42
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	COLA	85	40
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	CA5B	35	40
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	CA4	15	47
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	CA5A	40	40
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MMP2	56	47
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MMP3	44	47
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MMP8	56	47
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MMP14	16	40
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MMP9	52	47
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MMP12	59	46
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	PLAU	41	36
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	CA12	15	46
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	CXCR3	15	47
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	ADAMTS4	38	40
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	CA9	17	46
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	MMP1	42	47
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	F13A1	25	41
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	LIMK2	40	38
COCCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976437	GG	On-Demand	Anodyne	RORC	39	44
Cc1ccccc1CN1CCN(C(=O)COc2cccc3c2C(=O)CC3)CC1	ZINC000450976439	GF	On-Demand	Anodyne	GPR183	0	41
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450976440	EF	On-Demand	Anodyne	CHRM4	18	50
O=C(CC(F)(F)F)NC[C@H]1CCCN(CC2CC(F)(F)C2)C1	ZINC000450976441	EF	On-Demand	Anodyne	CHRM4	18	50
O=C(O)CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450976442	GF	On-Demand	Anodyne	CA2	25	40
O=C(O)CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450976442	GF	On-Demand	Anodyne	GCGR	58	45
O=C(O)CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450976442	GF	On-Demand	Anodyne	CA4	15	54
O=C(O)CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450976442	GF	On-Demand	Anodyne	GIPR	47	39
O=C(O)CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450976442	GF	On-Demand	Anodyne	LIMK2	52	45
O=C(COc1ccc(S(=O)(=O)NCCc2ccccn2)cc1)NC1CC1	ZINC000450976453	GD	On-Demand	Anodyne	TBXA2R	22	48
O=C(COc1ccc(S(=O)(=O)NCCc2ccccn2)cc1)NC1CC1	ZINC000450976453	GD	On-Demand	Anodyne	LUXN	0	44
O=C(COc1ccc(S(=O)(=O)NCCc2ccccn2)cc1)NC1CC1	ZINC000450976453	GD	On-Demand	Anodyne	ADIPOR1	0	42
O=C(COc1ccc(S(=O)(=O)NCCc2ccccn2)cc1)NC1CC1	ZINC000450976453	GD	On-Demand	Anodyne	ADIPOR2	0	42
CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccc(-c3cnc[nH]3)cc2)C12CCCC2	ZINC000450976457	GH	On-Demand	Anodyne	TIMP3	54	31
CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccc(-c3cnc[nH]3)cc2)C12CCCC2	ZINC000450976458	GH	On-Demand	Anodyne	TIMP3	54	31
CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccc(-c3cnc[nH]3)cc2)C12CCCC2	ZINC000450976460	GH	On-Demand	Anodyne	TIMP3	54	31
CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccc(-c3cnc[nH]3)cc2)C12CCCC2	ZINC000450976462	GH	On-Demand	Anodyne	TIMP3	54	31
COC(=O)C1CCN(S(=O)(=O)c2cccc3c(Cl)ccnc23)CC1	ZINC000450976463	FE	On-Demand	Anodyne	EPHX2	37	44
Cc1csc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)nc2)c1	ZINC000450976476	EF	On-Demand	Anodyne	TYK2	48	35
CCc1ccc(CN(C)S(=O)(=O)Cc2ccc(C(=O)NC)cc2)cc1	ZINC000450976477	FF	On-Demand	Anodyne	LIMK2	29	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCCc3ccccc32)cc1	ZINC000450976482	FH	On-Demand	Anodyne	KCNA5	24	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCCc3ccccc32)cc1	ZINC000450976482	FH	On-Demand	Anodyne	BIRC3	27	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCCc3ccccc32)cc1	ZINC000450976482	FH	On-Demand	Anodyne	BIRC2	42	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000450976485	FH	On-Demand	Anodyne	KCNA5	24	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000450976485	FH	On-Demand	Anodyne	BIRC3	27	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000450976485	FH	On-Demand	Anodyne	BIRC2	42	40
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976493	EG	On-Demand	Anodyne	CA2	22	41
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976493	EG	On-Demand	Anodyne	CA1	33	45
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976493	EG	On-Demand	Anodyne	CA4	27	43
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976493	EG	On-Demand	Anodyne	MMP2	32	44
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976493	EG	On-Demand	Anodyne	MMP12	43	37
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976493	EG	On-Demand	Anodyne	ADAMTS4	47	38
CC(C)CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976493	EG	On-Demand	Anodyne	LEF	57	35
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976494	EG	On-Demand	Anodyne	CA2	22	41
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976494	EG	On-Demand	Anodyne	CA1	33	45
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976494	EG	On-Demand	Anodyne	CA4	27	43
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976494	EG	On-Demand	Anodyne	MMP2	32	44
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976494	EG	On-Demand	Anodyne	MMP12	43	37
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976494	EG	On-Demand	Anodyne	ADAMTS4	47	38
CC(C)CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976494	EG	On-Demand	Anodyne	LEF	57	35
N#CC1(F)CCN(Cc2ccc(F)c(CN3CCC(F)(C#N)CC3)c2)CC1	ZINC000450976497	GG	On-Demand	Mild	SIGMAR1	15	40
COCc1nn(C)cc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976501	DF	On-Demand	Anodyne	KIT	0	44
COCc1nn(C)cc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976501	DF	On-Demand	Anodyne	FLT1	36	46
COCc1nn(C)cc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976501	DF	On-Demand	Anodyne	PSBA	0	40
COCc1nn(C)cc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976501	DF	On-Demand	Anodyne	KCNK3	67	40
COCc1nn(C)cc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976501	DF	On-Demand	Anodyne	KCNK9	73	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CCc2ccccn2)cc1	ZINC000450976504	FF	On-Demand	Anodyne	COLA	49	38
COC(=O)c1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])cc1Cl	ZINC000450976510	FH	On-Demand	Bother	COLA	101	39
CC(C)c1nnc(NS(=O)(=O)Cc2ccc(Br)c(F)c2)s1	ZINC000450976514	GH	On-Demand	Anodyne	CA4	15	42
COC(=O)c1sccc1NS(=O)(=O)c1cn(C)nc1C(F)(F)F	ZINC000450976519	FE	On-Demand	Anodyne	FAS	26	42
CCOC(=O)c1cc(S(=O)(=O)Nc2nnc(C)s2)cnc1C(F)F	ZINC000450976520	GE	On-Demand	Anodyne	CA4	51	38
CCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450976522	FG	On-Demand	Anodyne	CA2	21	41
CCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450976522	FG	On-Demand	Anodyne	ADRB2	20	45
CCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450976522	FG	On-Demand	Anodyne	PPIA	24	40
CCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450976522	FG	On-Demand	Anodyne	ADRB3	22	43
CCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450976522	FG	On-Demand	Anodyne	CA1	28	41
CCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450976522	FG	On-Demand	Anodyne	CA4	26	41
CCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450976522	FG	On-Demand	Anodyne	LEF	24	45
CCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450976522	FG	On-Demand	Anodyne	PFK	0	44
Cn1cc(CCNC(=O)C2CC(C)(O)C2)c2ccc(Cl)cc21	ZINC000450976523	DF	On-Demand	Anodyne	NQO2	16	40
CCSc1cccnc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976527	DJ	On-Demand	Anodyne	FLT1	21	42
CCSc1cccnc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976527	DJ	On-Demand	Anodyne	KDR	15	42
CCSc1cccnc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976527	DJ	On-Demand	Anodyne	KCNK3	53	37
CCSc1cccnc1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976527	DJ	On-Demand	Anodyne	KCNK9	57	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccnc(N(C)C)c2)cc1	ZINC000450976534	FF	On-Demand	Anodyne	GRM4	20	41
CCCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450976539	GF	On-Demand	Anodyne	PTGER2	20	40
CCCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450976539	GF	On-Demand	Anodyne	RORC	33	50
CCCN(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450976539	GF	On-Demand	Anodyne	RORB	0	51
CC(=O)N[C@H](C)C1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450976540	GE	On-Demand	Anodyne	EPHX2	37	58
CC(=O)N[C@H](C)C1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450976540	GE	On-Demand	Anodyne	MCHR1	26	40
CC(=O)N[C@H](C)C1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450976540	GE	On-Demand	Anodyne	CACNA1I	20	40
CC(=O)N[C@@H](C)C1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450976541	GE	On-Demand	Anodyne	EPHX2	37	58
CC(=O)N[C@@H](C)C1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450976541	GE	On-Demand	Anodyne	MCHR1	26	40
CC(=O)N[C@@H](C)C1CCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)CC1	ZINC000450976541	GE	On-Demand	Anodyne	CACNA1I	20	40
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450976542	FH	On-Demand	Anodyne	MMP2	47	34
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450976542	FH	On-Demand	Anodyne	CACNA1I	45	34
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450976542	FH	On-Demand	Anodyne	BIRC2	60	48
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450976544	FH	On-Demand	Anodyne	MMP2	47	34
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450976544	FH	On-Demand	Anodyne	CACNA1I	45	34
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450976544	FH	On-Demand	Anodyne	BIRC2	60	48
C[C@@H](c1csnn1)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450976546	CF	On-Demand	Bother	COLA	97	39
CN(C)c1ccccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450976547	DG	On-Demand	Anodyne	PRTN3	52	33
CN(C)c1ccccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450976547	DG	On-Demand	Anodyne	UQCRB	0	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(F)cc2)cc1	ZINC000450976549	FF	On-Demand	Anodyne	CA2	19	46
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(F)cc2)cc1	ZINC000450976549	FF	On-Demand	Anodyne	CA12	20	42
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccc(F)cc2)cc1	ZINC000450976549	FF	On-Demand	Anodyne	CA9	20	42
C[C@H](c1csnn1)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000450976556	CF	On-Demand	Bother	COLA	97	39
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	HDAC10	32	57
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	HDAC2	20	57
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	HDAC3	42	40
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	HDAC6	32	57
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	MSR1	0	41
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	HDAC11	15	57
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	KCNK3	43	37
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	KCNK9	42	31
CC(C)(C)C(=O)CCCC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000450976562	DJ	On-Demand	Anodyne	PARP10	0	45
COC(=O)c1cccc(CN(C)CCc2ccccc2[N+](=O)[O-])c1Cl	ZINC000450976579	FH	On-Demand	Bother	COLA	104	40
N#CCc1ccc(S(=O)(=O)N2CCNC(=O)C2)c(Cl)c1	ZINC000450976584	DC	On-Demand	Mild	TRPV4	44	37
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	CHRM2	22	40
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	CASP3	30	43
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	MMP13	30	42
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	MMP3	30	40
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	MMP8	22	45
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	EPHX2	43	52
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	TGM2	43	34
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	MMP7	39	45
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	F13A1	49	34
COC(=O)C1CCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450976592	EF	On-Demand	Anodyne	AKR1C3	24	52
CN(CCc1ccccc1[N+](=O)[O-])Cc1ccn(CCc2ccccc2)n1	ZINC000450976601	FH	On-Demand	Bother	COLA	78	35
COC(=O)c1cccc(OCCOc2cccc3c2C(=O)CC3)c1	ZINC000450976608	EG	On-Demand	Anodyne	SRD5A1	28	44
COC(=O)c1cccc(OCCOc2cccc3c2C(=O)CC3)c1	ZINC000450976608	EG	On-Demand	Anodyne	SRD5A2	33	44
CCC(CC)Oc1ccc(C(=O)N[C@@H](CC)CO)cc1	ZINC000450976609	CF	On-Demand	Anodyne	UTS2	41	34
Cc1ccncc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450976615	GE	On-Demand	Anodyne	MTNN	79	40
CCC(CC)c1nnc(NS(=O)(=O)c2c(Cl)ccc(F)c2F)s1	ZINC000450976618	GI	On-Demand	Anodyne	CA2	15	41
CC(C)Oc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1Cl	ZINC000450976619	GH	On-Demand	Anodyne	SGK1	15	49
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	CASR	31	42
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	LCK	32	43
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	MAPK14	17	43
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	NR1H4	23	42
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	EPHX2	28	46
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	BTK	25	43
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	BRAF	29	45
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	TAAR1	42	41
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	DGAT1	26	40
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	KCNK3	97	41
CC(F)(F)c1cccc(NC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000450976622	GI	On-Demand	Anodyne	KCNK9	62	36
O=C(Nc1ccc(OC2COC2)cc1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450976628	EH	On-Demand	Anodyne	EPHX2	19	41
Cc1cccc2c1C[C@@H](C(=O)Nc1cccc(C(C)(F)F)c1)O2	ZINC000450976636	DI	On-Demand	Anodyne	KCNK3	43	32
O=C(Nc1ccc(OC2COC2)cc1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450976637	EH	On-Demand	Anodyne	EPHX2	19	41
O=C(Nc1ccc(OC2COC2)cc1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450976638	EH	On-Demand	Anodyne	EPHX2	19	41
O=C(Nc1ccc(OC2COC2)cc1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450976639	EH	On-Demand	Anodyne	EPHX2	19	41
Cc1cccc2c1C[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)O2	ZINC000450976641	DI	On-Demand	Anodyne	KCNK3	43	32
O=C1CCCCN1c1cccc(NS(=O)(=O)c2sccc2F)c1	ZINC000450976643	FG	On-Demand	Anodyne	PKM	19	46
O=C(CCCN1CCCC[C@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976646	DH	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1CCCC[C@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976646	DH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCCC[C@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976646	DH	On-Demand	Anodyne	HTR2A	22	44
O=C(CCCN1CCCC[C@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976646	DH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1CCCC[C@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976646	DH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCCC[C@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976646	DH	On-Demand	Anodyne	CYP2J2	46	32
O=C(CCCN1CCCC[C@@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976648	DH	On-Demand	Anodyne	DRD2	27	41
O=C(CCCN1CCCC[C@@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976648	DH	On-Demand	Anodyne	DRD4	0	44
O=C(CCCN1CCCC[C@@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976648	DH	On-Demand	Anodyne	HTR2A	22	44
O=C(CCCN1CCCC[C@@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976648	DH	On-Demand	Anodyne	ERG2	19	41
O=C(CCCN1CCCC[C@@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976648	DH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCCC[C@@H]1c1cc[nH]n1)c1ccc(F)cc1	ZINC000450976648	DH	On-Demand	Anodyne	CYP2J2	46	32
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000450976657	GG	On-Demand	Anodyne	EPHX2	28	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000450976657	GG	On-Demand	Anodyne	TGM2	57	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000450976657	GG	On-Demand	Anodyne	F13A1	88	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000450976657	GG	On-Demand	Anodyne	AKR1C3	25	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000450976657	GG	On-Demand	Anodyne	RAC1	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000450976657	GG	On-Demand	Anodyne	NAMPT	22	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000450976658	GG	On-Demand	Anodyne	EPHX2	28	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000450976658	GG	On-Demand	Anodyne	TGM2	57	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000450976658	GG	On-Demand	Anodyne	F13A1	88	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000450976658	GG	On-Demand	Anodyne	AKR1C3	25	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000450976658	GG	On-Demand	Anodyne	RAC1	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000450976658	GG	On-Demand	Anodyne	NAMPT	22	42
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450976659	EH	On-Demand	Anodyne	ACHE	39	49
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450976659	EH	On-Demand	Anodyne	SIGMAR1	40	44
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450976659	EH	On-Demand	Anodyne	SSTR5	51	40
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450976659	EH	On-Demand	Anodyne	CCR3	18	41
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450976659	EH	On-Demand	Anodyne	MCHR1	21	41
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450976659	EH	On-Demand	Anodyne	CACNA1I	55	42
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450976659	EH	On-Demand	Anodyne	CYP2J2	49	35
CC(F)(F)c1cccc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450976665	CH	On-Demand	Anodyne	HDAC10	34	40
CC(F)(F)c1cccc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450976665	CH	On-Demand	Anodyne	HDAC3	43	40
CC(F)(F)c1cccc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450976665	CH	On-Demand	Anodyne	HDAC6	35	56
CC(F)(F)c1cccc(NC(=O)CCCC(=O)C2CC2)c1	ZINC000450976665	CH	On-Demand	Anodyne	PARP10	0	42
O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)[C@@H]1CC12CCSCC2	ZINC000450976672	FI	On-Demand	Anodyne	ACAT	0	45
O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)[C@H]1CC12CCSCC2	ZINC000450976674	FI	On-Demand	Anodyne	ACAT	0	45
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	HTR1A	17	42
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	DRD2	26	44
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	DRD4	44	40
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	ACHE	30	45
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	HTR2A	24	44
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	DRD3	23	40
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	HTR7	45	59
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	SIGMAR1	62	44
Cc1csc(S(=O)(=O)NCCN2CCN(Cc3ccccc3)CC2)c1	ZINC000450976681	GE	On-Demand	Anodyne	HTR6	27	44
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	CA2	39	45
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	CA6	17	43
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	CA1	45	48
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	CA4	72	48
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	MTNN	46	33
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	CA9	22	45
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	NCE103	19	43
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	ALPI	28	43
Cc1nnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)s1	ZINC000450976683	GD	On-Demand	Anodyne	A6YCJ1_9METZ	24	43
CNC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450976685	GE	On-Demand	Anodyne	MMP8	16	45
CNC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450976685	GE	On-Demand	Anodyne	NR1H3	0	42
CNC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450976685	GE	On-Demand	Anodyne	MMP1	15	45
CNC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450976685	GE	On-Demand	Anodyne	LIMK2	40	40
CNC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450976685	GE	On-Demand	Anodyne	RORC	21	45
CNC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450976685	GE	On-Demand	Anodyne	RORB	0	42
C=Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000450976689	DG	On-Demand	Anodyne	F13A1	42	38
C=Cc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000450976690	DG	On-Demand	Anodyne	F13A1	42	38
Clc1ccc(CCN2CCCC[C@H]2c2cc[nH]n2)cc1	ZINC000450976693	CH	On-Demand	Anodyne	HRH3	27	40
Clc1ccc(CCN2CCCC[C@@H]2c2cc[nH]n2)cc1	ZINC000450976694	CH	On-Demand	Anodyne	HRH3	27	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)c3ccncc32)cc1	ZINC000450976697	FE	On-Demand	Anodyne	TGM2	56	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)c3ccncc32)cc1	ZINC000450976697	FE	On-Demand	Anodyne	F13A1	85	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)c3ccncc32)cc1	ZINC000450976697	FE	On-Demand	Anodyne	NAMPT	53	39
CC[C@@H](c1ccc(Cl)cc1Cl)N1CCC(CNS(C)(=O)=O)CC1	ZINC000450976698	GH	On-Demand	Anodyne	CACNA1I	53	38
CC[C@H](c1ccc(Cl)cc1Cl)N1CCC(CNS(C)(=O)=O)CC1	ZINC000450976699	GH	On-Demand	Anodyne	CACNA1I	53	38
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	MMP13	37	44
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	COLA	55	37
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	MMP16	0	43
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	MMP2	25	46
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	MMP3	28	49
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	MMP8	25	49
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	MMP9	33	46
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	MMP12	25	49
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	ADAMTS4	40	36
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccccc1)C(C)C	ZINC000450976701	EE	On-Demand	Anodyne	LIMK2	42	36
CC(C)OCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450976702	FD	On-Demand	Anodyne	MMP13	30	42
CC(C)OCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450976702	FD	On-Demand	Anodyne	MMP2	22	42
CC(C)OCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450976702	FD	On-Demand	Anodyne	MMP14	15	42
CC(C)OCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450976702	FD	On-Demand	Anodyne	LUXN	0	43
CC(C)OCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450976702	FD	On-Demand	Anodyne	ADIPOR1	0	41
CC(C)OCCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450976702	FD	On-Demand	Anodyne	ADIPOR2	0	41
C[C@H](O)CCN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000450976714	CG	On-Demand	Anodyne	OPRK1	17	41
C[C@H](O)CCN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000450976714	CG	On-Demand	Anodyne	OPRL1	23	48
C[C@H](O)CCN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000450976714	CG	On-Demand	Anodyne	SIGMAR1	27	42
C[C@H](O)CCN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000450976714	CG	On-Demand	Anodyne	KCNA3	21	44
C[C@@H](O)CCN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000450976715	CG	On-Demand	Anodyne	OPRK1	17	41
C[C@@H](O)CCN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000450976715	CG	On-Demand	Anodyne	OPRL1	23	48
C[C@@H](O)CCN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000450976715	CG	On-Demand	Anodyne	SIGMAR1	27	42
C[C@@H](O)CCN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000450976715	CG	On-Demand	Anodyne	KCNA3	21	44
C[C@H](O)CCN1CCC[C@](C)(c2ccccc2)CC1	ZINC000450976716	CG	On-Demand	Anodyne	OPRK1	17	41
C[C@H](O)CCN1CCC[C@](C)(c2ccccc2)CC1	ZINC000450976716	CG	On-Demand	Anodyne	OPRL1	23	48
C[C@H](O)CCN1CCC[C@](C)(c2ccccc2)CC1	ZINC000450976716	CG	On-Demand	Anodyne	SIGMAR1	27	42
C[C@H](O)CCN1CCC[C@](C)(c2ccccc2)CC1	ZINC000450976716	CG	On-Demand	Anodyne	KCNA3	21	44
C[C@@H](O)CCN1CCC[C@](C)(c2ccccc2)CC1	ZINC000450976718	CG	On-Demand	Anodyne	OPRK1	17	41
C[C@@H](O)CCN1CCC[C@](C)(c2ccccc2)CC1	ZINC000450976718	CG	On-Demand	Anodyne	OPRL1	23	48
C[C@@H](O)CCN1CCC[C@](C)(c2ccccc2)CC1	ZINC000450976718	CG	On-Demand	Anodyne	SIGMAR1	27	42
C[C@@H](O)CCN1CCC[C@](C)(c2ccccc2)CC1	ZINC000450976718	CG	On-Demand	Anodyne	KCNA3	21	44
CC(C)CNS(=O)(=O)c1cccc2c(Cl)ccnc12	ZINC000450976723	CF	On-Demand	Anodyne	MTNN	84	40
CCOC(=O)C(C)(C)C1CCN(CCCc2cc(CC)no2)CC1	ZINC000450976732	EG	On-Demand	Anodyne	CYP2J2	47	34
CCC(CC)NS(=O)(=O)c1cc(C)cs1	ZINC000450976747	BF	On-Demand	Anodyne	NR3C2	0	43
CN(C)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450976751	GD	On-Demand	Anodyne	LUXN	0	44
COCCOc1cc(NS(=O)(=O)c2cccnc2C(=O)OC)ccc1OC	ZINC000450976759	GD	On-Demand	Anodyne	GRM4	23	44
COCCOc1cc(NS(=O)(=O)c2cccnc2C(=O)OC)ccc1OC	ZINC000450976759	GD	On-Demand	Anodyne	ENPP1	52	36
CN(CC(=O)Nc1cccc(F)c1)S(=O)(=O)CCOCc1ccccc1	ZINC000450976762	GE	On-Demand	Anodyne	LIMK2	18	42
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	CA2	28	51
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	ADRB3	18	43
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	CA1	35	43
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	KCNA5	27	40
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	CA7	18	45
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	BDKRB1	0	50
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	CA4	28	46
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	GRM4	20	43
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	CA14	18	45
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	MMP2	27	43
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	PRTN3	58	39
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	CA12	23	51
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	CA9	24	51
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	P96878_MYCTU	41	38
CCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450976766	FI	On-Demand	Anodyne	UQCRB	0	40
CCOc1ccc(CN(C)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450976768	FG	On-Demand	Anodyne	LTA4H	26	40
C[C@H]1CC[C@H](NC(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450976770	CH	On-Demand	Anodyne	TNKS	58	33
C[C@@H]1CC[C@H](NC(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450976772	CH	On-Demand	Anodyne	TNKS	58	33
C[C@@H]1CC[C@@H](NC(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450976773	CH	On-Demand	Anodyne	TNKS	58	33
C[C@H]1CC[C@@H](NC(=O)CCc2ccc3ccccc3c2O)C1	ZINC000450976774	CH	On-Demand	Anodyne	TNKS	58	33
CSc1cccc(C(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c1	ZINC000450976775	EH	On-Demand	Anodyne	CCR2	40	41
CSc1cccc(C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c1	ZINC000450976777	EH	On-Demand	Anodyne	CCR2	40	41
CSc1cccc(C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c1	ZINC000450976778	EH	On-Demand	Anodyne	CCR2	40	41
CSc1cccc(C(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c1	ZINC000450976780	EH	On-Demand	Anodyne	CCR2	40	41
O=C1CCc2cc(F)c(NS(=O)(=O)CCCCF)cc2N1	ZINC000450976785	DE	On-Demand	Anodyne	PKM	45	42
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1	ZINC000450976790	EF	On-Demand	Anodyne	MAPK14	37	43
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1	ZINC000450976790	EF	On-Demand	Anodyne	MAPK13	43	31
CCN1CCC[C@@H]1CNS(=O)(=O)c1sccc1Cl	ZINC000450976791	DE	On-Demand	Anodyne	ADAMTS5	27	40
CCN1CCC[C@H]1CNS(=O)(=O)c1sccc1Cl	ZINC000450976792	DE	On-Demand	Anodyne	ADAMTS5	17	40
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450976830	GF	On-Demand	Anodyne	SRD5A1	40	47
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450976830	GF	On-Demand	Anodyne	CNR1	52	32
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450976830	GF	On-Demand	Anodyne	SRD5A2	22	45
COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450976830	GF	On-Demand	Anodyne	BETA-TUBULIN	0	40
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cnccc1C	ZINC000450976833	ED	On-Demand	Anodyne	MMP3	26	47
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cnccc1C	ZINC000450976833	ED	On-Demand	Anodyne	MMP8	33	47
COC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cnccc1C	ZINC000450976833	ED	On-Demand	Anodyne	ADAM9	63	36
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cnccc1C	ZINC000450976834	ED	On-Demand	Anodyne	MMP3	26	47
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cnccc1C	ZINC000450976834	ED	On-Demand	Anodyne	MMP8	33	47
COC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cnccc1C	ZINC000450976834	ED	On-Demand	Anodyne	ADAM9	63	36
CN(C)CC(=O)Nc1ccc(NS(=O)(=O)Cc2ccc(C(F)F)cc2)cc1	ZINC000450976840	GG	On-Demand	Anodyne	PFK	0	40
COCCO[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450976850	FG	On-Demand	Anodyne	RBP4	81	42
COCCO[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450976850	FG	On-Demand	Anodyne	LIPG	36	41
COCCO[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)C1	ZINC000450976850	FG	On-Demand	Anodyne	SFRP1	41	32
COCCO[C@H]1CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450976856	GF	On-Demand	Anodyne	HPGD	59	67
COCCO[C@@H]1CCN(C(=O)c2ccc3c(c2)ncn3-c2ccccc2OC)C1	ZINC000450976857	GF	On-Demand	Anodyne	HPGD	59	67
O=C(c1cccc(NS(=O)(=O)CCCCF)c1)N1CCCC1	ZINC000450976876	EE	On-Demand	Anodyne	L3MBTL1	0	40
COC(=O)c1csc(CN2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450976889	GI	On-Demand	Anodyne	CCR2	53	38
COC(=O)c1csc(CN2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450976889	GI	On-Demand	Anodyne	LIPG	41	31
COC(=O)c1csc(CN2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450976890	GI	On-Demand	Anodyne	CCR2	53	38
COC(=O)c1csc(CN2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450976890	GI	On-Demand	Anodyne	LIPG	41	31
CCOC(=O)c1cnn(C2CCN(C[C@@H](O)[C@@H](C)c3ccccc3)CC2)c1C	ZINC000450976902	GG	On-Demand	Anodyne	ADORA1	0	41
CCOC(=O)c1cnn(C2CCN(C[C@H](O)[C@H](C)c3ccccc3)CC2)c1C	ZINC000450976903	GG	On-Demand	Anodyne	ADORA1	0	41
CCOC(=O)c1cnn(C2CCN(C[C@@H](O)[C@H](C)c3ccccc3)CC2)c1C	ZINC000450976904	GG	On-Demand	Anodyne	ADORA1	0	41
CCOC(=O)c1cnn(C2CCN(C[C@H](O)[C@@H](C)c3ccccc3)CC2)c1C	ZINC000450976905	GG	On-Demand	Anodyne	ADORA1	0	41
Cc1cc(NC(=O)C(C)(C)C(C)(F)F)cc(C)c1O	ZINC000450976906	CH	On-Demand	Anodyne	HDAH	39	43
CCc1cc(CCCN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)on1	ZINC000450976913	FF	On-Demand	Anodyne	CCR3	23	40
Cc1oc2ccc(NC(=O)CCCC(=O)C3CC3)cc2c1C	ZINC000450976916	CI	On-Demand	Anodyne	HDAC3	15	42
CCc1cc(CCCN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)on1	ZINC000450976917	FF	On-Demand	Anodyne	CCR3	23	40
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@H](O)C1CCC1	ZINC000450976918	FE	On-Demand	Anodyne	RBP4	74	36
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@H](O)C1CCC1	ZINC000450976918	FE	On-Demand	Anodyne	SFRP1	50	30
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@@H](O)C1CCC1	ZINC000450976919	FE	On-Demand	Anodyne	RBP4	74	36
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@@H](O)C1CCC1	ZINC000450976919	FE	On-Demand	Anodyne	SFRP1	50	30
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@@H](O)C1CCC1	ZINC000450976920	FE	On-Demand	Anodyne	RBP4	74	36
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@@H](O)C1CCC1	ZINC000450976920	FE	On-Demand	Anodyne	SFRP1	50	30
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@H](O)C1CCC1	ZINC000450976921	FE	On-Demand	Anodyne	RBP4	74	36
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)[C@H](O)C1CCC1	ZINC000450976921	FE	On-Demand	Anodyne	SFRP1	50	30
CCOC(=O)c1cnn(C2CCN(Cc3cccnc3N)CC2)c1C	ZINC000450976922	EE	On-Demand	Anodyne	SSTR5	42	34
COC(=O)c1csc(CN(C)CCc2ccccc2[N+](=O)[O-])n1	ZINC000450976945	EF	On-Demand	Bother	COLA	97	39
CCC(=O)CCCN1CCC(CNS(C)(=O)=O)CC1	ZINC000450976957	CD	On-Demand	Anodyne	HTR4	44	38
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)C1(C)CC1	ZINC000450976963	EE	On-Demand	Anodyne	CPT1A	40	33
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)C1(C)CC1	ZINC000450976963	EE	On-Demand	Anodyne	CPT2	42	33
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)C1(C)CC1	ZINC000450976963	EE	On-Demand	Anodyne	CPT1B	74	33
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)C1(C)CC1	ZINC000450976963	EE	On-Demand	Anodyne	RBP4	24	41
COCCO[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450976967	EF	On-Demand	Anodyne	LIPG	71	58
COCCO[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)C1	ZINC000450976968	EF	On-Demand	Anodyne	LIPG	71	58
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1OC	ZINC000450976980	GD	On-Demand	Anodyne	BMP1	74	38
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1OC	ZINC000450976980	GD	On-Demand	Anodyne	MMP13	28	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1OC	ZINC000450976980	GD	On-Demand	Anodyne	MMP3	19	42
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1OC	ZINC000450976980	GD	On-Demand	Anodyne	MMP8	22	41
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc(OC)cc1OC	ZINC000450976980	GD	On-Demand	Anodyne	MMP9	31	41
O=C(c1ccccc1)N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450976988	FF	On-Demand	Anodyne	SLC6A7	0	46
CC[C@@H](CO)NC(=O)c1ccc(Oc2ccc(Cl)cc2)cn1	ZINC000450976990	DG	On-Demand	Anodyne	ACACA	56	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1	ZINC000450977004	FE	On-Demand	Anodyne	CA2	22	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1	ZINC000450977004	FE	On-Demand	Anodyne	CA7	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1	ZINC000450977004	FE	On-Demand	Anodyne	COLA	79	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1	ZINC000450977004	FE	On-Demand	Anodyne	MMP9	30	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1	ZINC000450977004	FE	On-Demand	Anodyne	MMP12	49	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1	ZINC000450977004	FE	On-Demand	Anodyne	CA12	18	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1	ZINC000450977004	FE	On-Demand	Anodyne	CA9	18	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1	ZINC000450977004	FE	On-Demand	Anodyne	RORC	23	46
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	DRD4	39	41
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	ACHE	34	44
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	AVPR1B	44	36
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	HTR4	52	44
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	CHAT	25	41
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	SIGMAR1	38	40
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	SSTR5	76	46
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	CCR3	39	47
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	UTS2R	25	42
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	MCHR1	36	45
COc1cc(CN2CCC(CNS(C)(=O)=O)CC2)ccc1Cl	ZINC000450977005	EE	On-Demand	Anodyne	CACNA1I	43	37
COc1cccc(OCCC(=O)NCCc2nn(C)c3ccccc23)c1	ZINC000450977017	FF	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCC(=O)NCCc2nn(C)c3ccccc23)c1	ZINC000450977017	FF	On-Demand	Anodyne	MTNR1B	75	40
CO[C@@H]1C[C@H](N(C)Cc2ccccc2OC2CC2)C1	ZINC000450977025	CF	On-Demand	Anodyne	SLC5A4	50	32
CN(C)S(=O)(=O)[C@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450977047	EE	On-Demand	Anodyne	BIRC2	43	46
CN(C)S(=O)(=O)[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC000450977048	EE	On-Demand	Anodyne	BIRC2	43	46
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3ncccc32)c1	ZINC000450977050	GE	On-Demand	Anodyne	COLA	36	46
CC(C)c1cc(NS(=O)(=O)c2sccc2Cl)no1	ZINC000450977059	DG	On-Demand	Anodyne	EDNRA	20	42
COCCO[C@@H]1CCN(C(=O)c2cccc(SC)c2)C1	ZINC000450977064	CE	On-Demand	Anodyne	RHOA	0	41
COCCO[C@H]1CCN(C(=O)c2cccc(SC)c2)C1	ZINC000450977065	CE	On-Demand	Anodyne	RHOA	0	41
CN(C(=O)Cn1cnc2c1CCCC2)C(c1ccccc1)c1ccccc1	ZINC000450977066	FI	On-Demand	Anodyne	OPRK1	29	41
CCCc1nnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450977068	GD	On-Demand	Anodyne	CA4	46	39
CCCc1nnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450977068	GD	On-Demand	Anodyne	LUXN	0	42
CCOC(=O)c1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])nc1	ZINC000450977073	EF	On-Demand	Bother	COLA	92	37
Cc1cc(NC(=O)C[C@H]2COc3ccccc3O2)cc(C)c1O	ZINC000450977078	DG	On-Demand	Anodyne	PTGDR	24	41
Cc1cc(NC(=O)C[C@@H]2COc3ccccc3O2)cc(C)c1O	ZINC000450977079	DG	On-Demand	Anodyne	PTGDR	24	41
CC(C)N1CCCC[C@H]1CN(C)Cc1nc(-c2cccs2)no1	ZINC000450977084	EG	On-Demand	Anodyne	ETHR	30	41
CC(C)N1CCCC[C@@H]1CN(C)Cc1nc(-c2cccs2)no1	ZINC000450977085	EG	On-Demand	Anodyne	ETHR	30	41
CCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450977088	GG	On-Demand	Anodyne	MMP3	15	41
CCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450977088	GG	On-Demand	Anodyne	MMP8	21	41
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	CA2	25	47
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	ADRB2	25	48
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	ADRB1	22	48
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	ADRB3	25	48
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	CA1	31	47
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	MMP13	33	42
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	HTR6	0	49
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	CA4	27	47
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	MMP2	28	40
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	GHSR	15	47
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	MMP12	40	37
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	ADAMTS4	60	42
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	PFK	0	49
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	LIMK2	54	44
COCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977101	FG	On-Demand	Anodyne	UQCRB	0	43
CN(CCc1ccccc1[N+](=O)[O-])Cc1cn(CC2CC2)nn1	ZINC000450977105	DE	On-Demand	Bother	COLA	88	35
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2cc(C(C)(C)C)on2)c1	ZINC000450977127	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
C[C@H](CN(C)Cc1nc(-c2cccs2)no1)S(C)(=O)=O	ZINC000450977128	DD	On-Demand	Anodyne	ETHR	23	40
C[C@@H](CN(C)Cc1nc(-c2cccs2)no1)S(C)(=O)=O	ZINC000450977129	DD	On-Demand	Anodyne	ETHR	23	40
COc1cccc2c1N(S(=O)(=O)c1ccc(CC#N)cc1Cl)CCC2	ZINC000450977133	GH	On-Demand	Mild	CPT1B	19	41
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	HTR1A	15	42
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	ADRA1D	15	42
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	HTR2A	25	41
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	HTR2C	18	41
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	HRH1	18	42
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	ADRA1B	21	42
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	MC4R	23	40
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	SIGMAR1	19	42
CCC(=O)CCCN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977134	DI	On-Demand	Anodyne	CYP2J2	53	39
CCC(=O)CCCN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450977135	DI	On-Demand	Anodyne	HTR1A	15	42
CCC(=O)CCCN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450977135	DI	On-Demand	Anodyne	HTR2C	18	41
CCC(=O)CCCN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450977135	DI	On-Demand	Anodyne	HRH1	18	42
CCC(=O)CCCN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450977135	DI	On-Demand	Anodyne	ADRA1B	17	42
CCC(=O)CCCN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450977135	DI	On-Demand	Anodyne	MC4R	23	40
CCC(=O)CCCN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450977135	DI	On-Demand	Anodyne	CYP2J2	53	39
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	DRD2	27	42
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	DRD1	15	46
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	DRD4	0	46
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	HTR2A	23	47
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	HTR2C	20	49
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	SLC6A1	70	35
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	CHRM4	27	46
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	ERG2	20	42
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	CCR3	75	43
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	HTR3B	0	43
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977136	GH	On-Demand	Anodyne	CYP2J2	51	36
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	DRD2	27	42
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	DRD1	15	46
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	DRD4	0	46
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	HTR2A	23	47
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	HTR2C	20	49
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	SLC6A1	70	35
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	CHRM4	27	46
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	ERG2	20	42
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	CCR3	75	43
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	SLC18A3	0	40
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	HTR3B	0	43
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450977137	GH	On-Demand	Anodyne	CYP2J2	51	36
COCCOC[C@H](O)CN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977138	EF	On-Demand	Anodyne	HSP90AB1	39	41
COCCOC[C@@H](O)CN1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000450977139	EF	On-Demand	Anodyne	HSP90AB1	39	41
COCCOC[C@H](O)CN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450977140	EF	On-Demand	Anodyne	HSP90AB1	39	41
COCCOC[C@@H](O)CN1CCC([C@H](F)c2ccccc2F)CC1	ZINC000450977141	EF	On-Demand	Anodyne	HSP90AB1	39	41
CC[C@@H](CO)NC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450977154	DE	On-Demand	Anodyne	KCNK3	37	42
CC[C@@H](CO)NC(=O)c1cc(OC)ccc1OC(F)(F)F	ZINC000450977154	DE	On-Demand	Anodyne	KCNK9	38	42
O=C(Nc1ccc(OC2COC2)cc1)c1cccc2c1CCCC2	ZINC000450977172	DH	On-Demand	Anodyne	AVPR2	40	41
O=S(=O)(CCC1CCCC1)Nc1nc(SCc2ccccc2)n[nH]1	ZINC000450977176	FG	On-Demand	Anodyne	METAP2	33	46
Cc1cccc(C(=O)N2CCCC2)c1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450977177	GG	On-Demand	Anodyne	CCR8	45	35
CC[C@@H]1C[C@H]1C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450977178	DH	On-Demand	Anodyne	ACAT	0	49
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977184	FI	On-Demand	Anodyne	APOB	0	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977184	FI	On-Demand	Anodyne	RAF1	23	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977184	FI	On-Demand	Anodyne	MTTP	63	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977184	FI	On-Demand	Anodyne	EPHX2	44	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977184	FI	On-Demand	Anodyne	TEK	46	33
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977184	FI	On-Demand	Anodyne	Q8MMZ8_EIMTE	34	41
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977184	FI	On-Demand	Anodyne	SMO	27	40
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(CC(=O)NC(C)C)cc1	ZINC000450977187	GD	On-Demand	Anodyne	ADRB2	47	43
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(CC(=O)NC(C)C)cc1	ZINC000450977187	GD	On-Demand	Anodyne	ADRB1	35	43
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(CC(=O)NC(C)C)cc1	ZINC000450977187	GD	On-Demand	Anodyne	ADRB3	63	43
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(CC(=O)NC(C)C)cc1	ZINC000450977187	GD	On-Demand	Anodyne	PTPRB	45	34
COC(=O)c1cccc(Br)c1Cn1cnc2c1CCCC2	ZINC000450977188	EG	On-Demand	Anodyne	FABP4	43	35
Cc1ccc(CN(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)o1	ZINC000450977189	GE	On-Demand	Anodyne	LUXN	0	42
CCOC(=O)COc1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450977190	EF	On-Demand	Anodyne	PLA2G4B	42	32
CCOC(=O)COc1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450977190	EF	On-Demand	Anodyne	PSMB2	45	34
CC(=O)N[C@H](C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1)C(C)(C)C	ZINC000450977191	FG	On-Demand	Anodyne	ACAT	0	48
COc1ccc(CNC(=O)CCn2nnc(-c3ccncn3)n2)c(OC)c1	ZINC000450977202	FC	On-Demand	Anodyne	PDGFRB	37	44
CCN(CC)C(=O)Cc1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450977205	GH	On-Demand	Anodyne	PTPRB	41	32
CCc1cc(CC)c(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)c(CC)c1	ZINC000450977214	FG	On-Demand	Anodyne	PTPRB	53	37
CCc1cc(CC)c(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)c(CC)c1	ZINC000450977214	FG	On-Demand	Anodyne	NCE103	19	45
COc1cccc(OCCC(=O)NCc2nc3cccc(Cl)c3n2C)c1	ZINC000450977219	FG	On-Demand	Anodyne	DRD4	43	35
COc1cccc(OCCC(=O)NCc2nc3cccc(Cl)c3n2C)c1	ZINC000450977219	FG	On-Demand	Anodyne	HTR7	17	40
COc1cccc(OCCC(=O)NCc2nc3cccc(Cl)c3n2C)c1	ZINC000450977219	FG	On-Demand	Anodyne	MTNR1A	47	41
COc1cccc(OCCC(=O)NCc2nc3cccc(Cl)c3n2C)c1	ZINC000450977219	FG	On-Demand	Anodyne	MTNR1B	38	41
CC[C@@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450977220	CD	On-Demand	Anodyne	AKT1	53	33
CC[C@@H](CO)NC(=O)c1cc2cccnc2s1	ZINC000450977220	CD	On-Demand	Anodyne	PIN1	28	44
COc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977251	GE	On-Demand	Anodyne	PRTN3	53	33
COc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977251	GE	On-Demand	Anodyne	MMP1	16	40
COc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977251	GE	On-Demand	Anodyne	FFAR4	20	40
COc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977251	GE	On-Demand	Anodyne	LUXN	0	44
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977270	FG	On-Demand	Anodyne	DRD4	0	42
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977270	FG	On-Demand	Anodyne	HTR2A	18	45
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977270	FG	On-Demand	Anodyne	HTR2C	20	44
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977270	FG	On-Demand	Anodyne	SLC6A1	123	39
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977270	FG	On-Demand	Anodyne	CHRM4	20	53
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977270	FG	On-Demand	Anodyne	CYP2J2	57	40
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977271	FG	On-Demand	Anodyne	DRD4	0	42
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977271	FG	On-Demand	Anodyne	HTR2A	18	45
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977271	FG	On-Demand	Anodyne	HTR2C	20	44
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977271	FG	On-Demand	Anodyne	SLC6A1	123	39
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977271	FG	On-Demand	Anodyne	CHRM4	20	53
O=C(CC(F)(F)F)NC[C@H]1CCCN(CCCC(=O)c2ccccc2)C1	ZINC000450977271	FG	On-Demand	Anodyne	CYP2J2	57	40
COc1cccc(N2CCN(S(=O)(=O)c3cc(C)cs3)CC2)c1	ZINC000450977272	FF	On-Demand	Anodyne	DRD4	44	38
COc1cccc(N2CCN(S(=O)(=O)c3cc(C)cs3)CC2)c1	ZINC000450977272	FF	On-Demand	Anodyne	PKM	23	42
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450977290	FH	On-Demand	Anodyne	SLC6A1	64	37
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450977290	FH	On-Demand	Anodyne	CCR3	23	44
Cc1cccc(Cl)c1CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450977290	FH	On-Demand	Anodyne	CACNA1I	51	34
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450977291	FH	On-Demand	Anodyne	SLC6A1	64	37
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450977291	FH	On-Demand	Anodyne	CCR3	23	44
Cc1cccc(Cl)c1CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450977291	FH	On-Demand	Anodyne	CACNA1I	51	34
Cc1ccc2cc(S(=O)(=O)Nc3nnc(C(C)C)s3)ccc2c1	ZINC000450977302	EH	On-Demand	Anodyne	CA2	32	44
Cc1ccc2cc(S(=O)(=O)Nc3nnc(C(C)C)s3)ccc2c1	ZINC000450977302	EH	On-Demand	Anodyne	CA1	40	49
Cc1ccc2cc(S(=O)(=O)Nc3nnc(C(C)C)s3)ccc2c1	ZINC000450977302	EH	On-Demand	Anodyne	CA4	65	49
O=C(CCCN1CCO[C@]2(CCCOC2)C1)c1ccc(Br)cc1	ZINC000450977303	GG	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCO[C@@]2(CCCOC2)C1)c1ccc(Br)cc1	ZINC000450977304	GG	On-Demand	Anodyne	CYP2J2	49	34
CCCCc1nnc(NS(=O)(=O)c2ccc(C3CC3)cc2)s1	ZINC000450977308	EH	On-Demand	Anodyne	CA1	37	43
CCCCc1nnc(NS(=O)(=O)c2ccc(C3CC3)cc2)s1	ZINC000450977308	EH	On-Demand	Anodyne	CA4	59	42
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C)s2)c(F)c1	ZINC000450977309	GD	On-Demand	Anodyne	ALPI	26	40
CO[C@@H](CS(=O)(=O)Nc1cccc(C(=O)N2CCCC2)c1)c1ccccc1	ZINC000450977311	GG	On-Demand	Anodyne	TRY2_BOVIN	44	33
CO[C@H](CS(=O)(=O)Nc1cccc(C(=O)N2CCCC2)c1)c1ccccc1	ZINC000450977312	GG	On-Demand	Anodyne	TRY2_BOVIN	44	33
CN(Cc1cccs1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977314	GE	On-Demand	Anodyne	BMP1	73	40
CN(Cc1cccs1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977314	GE	On-Demand	Anodyne	LUXN	0	44
CN(Cc1cccs1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977314	GE	On-Demand	Anodyne	ADIPOR1	0	40
CN(Cc1cccs1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977314	GE	On-Demand	Anodyne	ADIPOR2	0	40
CN(CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCC(F)(F)C1	ZINC000450977319	CH	On-Demand	Bother	COLA	87	34
CN(CCc1ccccc1[N+](=O)[O-])C[C@H]1CCC(F)(F)C1	ZINC000450977320	CH	On-Demand	Bother	COLA	90	34
CC(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450977335	GE	On-Demand	Anodyne	ADAMTS4	45	33
CC(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450977335	GE	On-Demand	Anodyne	PFK	0	42
CC(C)c1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450977335	GE	On-Demand	Anodyne	LUXN	0	47
CCCc1cc(C(=O)N2CCN(C3CC3)c3c(C)cccc32)no1	ZINC000450977336	EH	On-Demand	Anodyne	GPBAR1	53	41
COc1ccc(-c2nc(Cn3cnc4c3CCCC4)cs2)cc1	ZINC000450977337	EH	On-Demand	Anodyne	AVPR1B	0	41
COCCOC[C@H](O)CN1CCN(Cc2ccc(Cl)cc2C)CC1	ZINC000450977338	FD	On-Demand	Anodyne	ACOX1	43	36
COCCOC[C@H](O)CN1CCN(Cc2ccc(Cl)cc2C)CC1	ZINC000450977338	FD	On-Demand	Anodyne	ABCB1	46	41
COCCOC[C@H](O)CN1CCN(Cc2ccc(Cl)cc2C)CC1	ZINC000450977338	FD	On-Demand	Anodyne	HSP90AB1	38	43
COCCOC[C@@H](O)CN1CCN(Cc2ccc(Cl)cc2C)CC1	ZINC000450977339	FD	On-Demand	Anodyne	ACOX1	43	36
COCCOC[C@@H](O)CN1CCN(Cc2ccc(Cl)cc2C)CC1	ZINC000450977339	FD	On-Demand	Anodyne	ABCB1	46	41
COCCOC[C@@H](O)CN1CCN(Cc2ccc(Cl)cc2C)CC1	ZINC000450977339	FD	On-Demand	Anodyne	HSP90AB1	38	43
COc1cc(CN2CCC[C@@H](CN(C)S(C)(=O)=O)C2)ccc1Cl	ZINC000450977340	FE	On-Demand	Anodyne	AVPR1B	45	38
COc1cc(CN2CCC[C@@H](CN(C)S(C)(=O)=O)C2)ccc1Cl	ZINC000450977340	FE	On-Demand	Anodyne	SSTR5	40	37
COc1cc(CN2CCC[C@@H](CN(C)S(C)(=O)=O)C2)ccc1Cl	ZINC000450977340	FE	On-Demand	Anodyne	UTS2R	29	40
COc1cc(CN2CCC[C@H](CN(C)S(C)(=O)=O)C2)ccc1Cl	ZINC000450977341	FE	On-Demand	Anodyne	AVPR1B	45	38
COc1cc(CN2CCC[C@H](CN(C)S(C)(=O)=O)C2)ccc1Cl	ZINC000450977341	FE	On-Demand	Anodyne	SSTR5	40	37
COc1cc(CN2CCC[C@H](CN(C)S(C)(=O)=O)C2)ccc1Cl	ZINC000450977341	FE	On-Demand	Anodyne	UTS2R	29	40
CS(=O)(=O)c1cccc(CS(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000450977358	GE	On-Demand	Anodyne	CACNA1B	42	34
CS(=O)(=O)c1cccc(CS(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)c1	ZINC000450977359	GE	On-Demand	Anodyne	CACNA1B	42	34
CCC[C@H](OC)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450977360	EH	On-Demand	Anodyne	ACAT	0	48
CCC[C@@H](OC)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450977361	EH	On-Demand	Anodyne	ACAT	0	48
CCN(C[C@H](C)O)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450977380	CD	On-Demand	Anodyne	AOC3	24	42
CCN(C[C@H](C)O)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450977381	CD	On-Demand	Anodyne	AOC3	24	42
CCN(C[C@H](C)O)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450977382	CD	On-Demand	Anodyne	AOC3	24	42
CCN(C[C@H](C)O)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450977383	CD	On-Demand	Anodyne	AOC3	24	42
C/C=C\COc1cccc(CC(=O)N[C@@H](CC)CO)c1	ZINC000450977384	CE	On-Demand	Anodyne	PDS	80	37
CC[C@@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450977385	CD	On-Demand	Anodyne	NCE103	28	43
CC[C@@H](CO)NC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450977385	CD	On-Demand	Anodyne	CAN2	0	43
Cn1nc(CCNC(=O)[C@@H](O)C2CCC2)c2ccccc21	ZINC000450977390	CD	On-Demand	Anodyne	HTR3A	17	49
Cn1nc(CCNC(=O)[C@H](O)C2CCC2)c2ccccc21	ZINC000450977391	CD	On-Demand	Anodyne	HTR3A	17	49
CCOC[C@@H](C)CS(=O)(=O)N(C)CC(=O)Nc1cc(Cl)ccc1OC	ZINC000450977395	GE	On-Demand	Anodyne	CPT1A	42	29
CCOC[C@H](C)CS(=O)(=O)N(C)CC(=O)Nc1cc(Cl)ccc1OC	ZINC000450977396	GE	On-Demand	Anodyne	CPT1A	42	29
CNC(=O)c1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977397	GF	On-Demand	Anodyne	CPT1A	29	41
CNC(=O)c1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450977397	GF	On-Demand	Anodyne	LEF	47	33
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000450977402	GG	On-Demand	Anodyne	GRM4	37	43
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCSc3ccncc32)c1	ZINC000450977414	GG	On-Demand	Anodyne	CYP11B2	26	41
C[C@@H](Oc1ccccn1)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450977436	FH	On-Demand	Anodyne	ACAT	0	48
C[C@H](Oc1ccccn1)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450977437	FH	On-Demand	Anodyne	ACAT	0	48
CC[C@H](CC(F)(F)F)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450977444	FJ	On-Demand	Anodyne	ACAT	0	50
CC[C@@H](CC(F)(F)F)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450977445	FJ	On-Demand	Anodyne	ACAT	0	50
CC(C)Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n[nH]1	ZINC000450977475	FG	On-Demand	Anodyne	PPIA	26	40
CC(C)Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n[nH]1	ZINC000450977475	FG	On-Demand	Anodyne	MTNN	65	31
CC(C)Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n[nH]1	ZINC000450977475	FG	On-Demand	Anodyne	PFK	0	43
COC(=O)CCCNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450977484	GC	On-Demand	Anodyne	HTR7	22	40
COC(=O)CCCNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450977484	GC	On-Demand	Anodyne	PKM	21	40
COC(=O)CCCNS(=O)(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000450977484	GC	On-Demand	Anodyne	AKR1C3	58	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)c(=O)n(C)c2)cc1	ZINC000450977485	GE	On-Demand	Anodyne	CA2	15	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)c(=O)n(C)c2)cc1	ZINC000450977485	GE	On-Demand	Anodyne	NADE	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)c(=O)n(C)c2)cc1	ZINC000450977485	GE	On-Demand	Anodyne	IDO1	29	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)c(=O)n(C)c2)cc1	ZINC000450977485	GE	On-Demand	Anodyne	PFK	0	42
COC(=O)c1csc(CN(C)CCN2CCN(Cc3ccccc3)CC2)n1	ZINC000450977486	GE	On-Demand	Anodyne	SIGMAR1	68	45
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977494	FI	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977494	FI	On-Demand	Anodyne	DRD4	0	50
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977494	FI	On-Demand	Anodyne	HTR2A	17	44
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977494	FI	On-Demand	Anodyne	SLC18A3	16	50
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977494	FI	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977495	FI	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977495	FI	On-Demand	Anodyne	DRD4	0	50
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977495	FI	On-Demand	Anodyne	HTR2A	17	44
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977495	FI	On-Demand	Anodyne	SLC18A3	16	50
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977495	FI	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977496	FI	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977496	FI	On-Demand	Anodyne	DRD4	0	50
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977496	FI	On-Demand	Anodyne	HTR2A	17	44
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977496	FI	On-Demand	Anodyne	SLC18A3	16	50
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1ccc(F)cc1	ZINC000450977496	FI	On-Demand	Anodyne	CYP2J2	51	36
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977497	FI	On-Demand	Anodyne	DRD2	29	41
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977497	FI	On-Demand	Anodyne	DRD4	0	50
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977497	FI	On-Demand	Anodyne	HTR2A	17	44
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977497	FI	On-Demand	Anodyne	SLC18A3	16	50
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1ccc(F)cc1	ZINC000450977497	FI	On-Demand	Anodyne	CYP2J2	51	36
COc1ccccc1[C@@H](C)N(C)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450977498	FD	On-Demand	Anodyne	SCARB1	49	40
COc1ccccc1[C@H](C)N(C)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450977499	FD	On-Demand	Anodyne	SCARB1	49	40
CCOC(C)(C)CNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450977513	FE	On-Demand	Mild	AR	22	41
CCOC(C)(C)CNC(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450977514	FE	On-Demand	Mild	AR	22	41
CCCN(CCN1CCCC1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450977521	EF	On-Demand	Anodyne	SIGMAR1	15	49
CCCN(CCN1CCCC1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450977521	EF	On-Demand	Anodyne	RORC	15	48
O=C(CC(F)(F)F)NC[C@@H]1CCCN(Cc2ccccc2OC2CC2)C1	ZINC000450977544	FH	On-Demand	Anodyne	CHRM4	28	49
O=C(CC(F)(F)F)NC[C@H]1CCCN(Cc2ccccc2OC2CC2)C1	ZINC000450977546	FH	On-Demand	Anodyne	CHRM4	28	49
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	BMP1	62	36
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	MMP13	51	40
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	ADAM17	40	38
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	MMP2	26	40
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	MMP3	31	40
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	MMP9	38	40
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	ADAMTS4	15	40
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	MMP1	34	40
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	LUXN	0	47
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	ADIPOR1	0	42
Cc1ccccc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977548	GE	On-Demand	Anodyne	ADIPOR2	0	42
CN(CC1(O)CCOCC1)C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450977554	GD	On-Demand	Mild	TRPV4	42	32
COC1(CNC(=O)c2ccc(C)nc2C(C)C)CCCCC1	ZINC000450977560	DH	On-Demand	Anodyne	HCN1	40	35
COC1(CNC(=O)c2ccc(C)nc2C(C)C)CCCCC1	ZINC000450977560	DH	On-Demand	Anodyne	HCN4	52	37
CCN(CCCC(=O)c1ccc(Br)cc1)C[C@H](C)O	ZINC000450977569	EG	On-Demand	Anodyne	THRA	41	39
Fc1ccccc1[C@@H](F)C1CCN(CCc2cscn2)CC1	ZINC000450977570	DI	On-Demand	Anodyne	SCN5A	44	38
Fc1ccccc1[C@H](F)C1CCN(CCc2cscn2)CC1	ZINC000450977571	DI	On-Demand	Anodyne	SCN5A	44	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)c3ncccc32)cc1	ZINC000450977572	FE	On-Demand	Anodyne	TGM2	55	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)c3ncccc32)cc1	ZINC000450977572	FE	On-Demand	Anodyne	F13A1	85	46
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2cnccc2C)c(F)c1	ZINC000450977575	GE	On-Demand	Anodyne	PTGS1	0	42
CCS(=O)(=O)c1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])cc1	ZINC000450977580	FG	On-Demand	Bother	COLA	104	41
CCS(=O)(=O)c1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])cc1	ZINC000450977580	FG	On-Demand	Bother	RORC	20	41
C[C@H](O)CCN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450977581	DH	On-Demand	Anodyne	DRD2	0	76
C[C@H](O)CCN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450977581	DH	On-Demand	Anodyne	CCR2	61	41
C[C@H](O)CCN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450977583	DH	On-Demand	Anodyne	DRD2	0	76
C[C@H](O)CCN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450977583	DH	On-Demand	Anodyne	CCR2	61	41
C[C@@H](O)CCN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450977584	DH	On-Demand	Anodyne	DRD2	0	76
C[C@@H](O)CCN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450977584	DH	On-Demand	Anodyne	CCR2	61	41
C[C@@H](O)CCN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450977585	DH	On-Demand	Anodyne	DRD2	0	76
C[C@@H](O)CCN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000450977585	DH	On-Demand	Anodyne	CCR2	61	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CN(C)S(C)(=O)=O)C1	ZINC000450977586	FD	On-Demand	Anodyne	CCR5	41	38
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CN(C)S(C)(=O)=O)C1	ZINC000450977587	FD	On-Demand	Anodyne	CCR5	41	38
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CN(C)S(C)(=O)=O)C1	ZINC000450977589	FD	On-Demand	Anodyne	CCR5	41	38
COc1ccc(CNC(=O)CCN2C[C@H]3CCC[C@@H](C3)C2)c(OC)c1	ZINC000450977590	EF	On-Demand	Anodyne	MTNR1A	78	39
COc1ccc(CNC(=O)CCN2C[C@H]3CCC[C@@H](C3)C2)c(OC)c1	ZINC000450977590	EF	On-Demand	Anodyne	MTNR1B	65	39
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CN(C)S(C)(=O)=O)C1	ZINC000450977591	FD	On-Demand	Anodyne	CCR5	41	38
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	DRD4	36	44
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	ACHE	17	42
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	HRH1	19	49
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	DRD3	25	44
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	HTR4	85	42
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	SIGMAR1	18	41
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	SSTR5	88	49
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	CCR3	42	47
CCOC(=O)c1cnn(C2CCN(Cc3ccc(Cl)c(OC)c3)CC2)c1C	ZINC000450977595	GH	On-Demand	Anodyne	MCHR1	31	44
CCCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n[nH]1	ZINC000450977617	GD	On-Demand	Anodyne	LUXN	0	43
Cc1csc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)c1	ZINC000450977618	DG	On-Demand	Anodyne	CA4	36	41
COc1cccc(N2CCN(S(=O)(=O)C[C@@H]3CCCC3(F)F)CC2)c1	ZINC000450977620	FF	On-Demand	Anodyne	DRD4	42	34
COc1cccc(N2CCN(S(=O)(=O)C[C@H]3CCCC3(F)F)CC2)c1	ZINC000450977621	FF	On-Demand	Anodyne	DRD4	42	34
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccccc1C	ZINC000450977644	ED	On-Demand	Anodyne	BMP1	41	36
COCCO[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450977652	FG	On-Demand	Anodyne	MC4R	30	43
COCCO[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450977652	FG	On-Demand	Anodyne	PRCP	53	40
COCCO[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450977652	FG	On-Demand	Anodyne	MC3R	45	45
COCCO[C@@H]1CCN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450977652	FG	On-Demand	Anodyne	MC5R	34	45
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450977653	FG	On-Demand	Anodyne	MC4R	30	43
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450977653	FG	On-Demand	Anodyne	PRCP	53	40
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450977653	FG	On-Demand	Anodyne	MC3R	45	45
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450977653	FG	On-Demand	Anodyne	MC5R	34	45
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450977654	FG	On-Demand	Anodyne	MC4R	30	43
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450977654	FG	On-Demand	Anodyne	PRCP	53	40
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450977654	FG	On-Demand	Anodyne	MC3R	45	45
COCCO[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450977654	FG	On-Demand	Anodyne	MC5R	34	45
COCCO[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450977655	FG	On-Demand	Anodyne	MC4R	30	43
COCCO[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450977655	FG	On-Demand	Anodyne	PRCP	53	40
COCCO[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450977655	FG	On-Demand	Anodyne	MC3R	45	45
COCCO[C@@H]1CCN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450977655	FG	On-Demand	Anodyne	MC5R	34	45
CCOC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450977656	GF	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450977656	GF	On-Demand	Anodyne	RORC	19	50
CCOC(=O)c1ccc(CS(=O)(=O)N(CCOC)Cc2ccccc2)cc1	ZINC000450977656	GF	On-Demand	Anodyne	RORB	0	40
COCCO[C@@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450977657	CD	On-Demand	Anodyne	MLNR	30	41
COCCO[C@@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450977657	CD	On-Demand	Anodyne	LIPG	34	42
COCCO[C@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450977658	CD	On-Demand	Anodyne	MLNR	30	41
COCCO[C@H]1CCN(C(=O)Cc2ccc(O)c(F)c2)C1	ZINC000450977658	CD	On-Demand	Anodyne	LIPG	34	42
O=C(CCCN1CCO[C@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977659	DF	On-Demand	Anodyne	DRD2	32	48
O=C(CCCN1CCO[C@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977659	DF	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1CCO[C@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977659	DF	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCO[C@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977659	DF	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CCO[C@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977659	DF	On-Demand	Anodyne	CYP2J2	49	34
O=C(CCCN1CCO[C@@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977660	DF	On-Demand	Anodyne	DRD2	32	48
O=C(CCCN1CCO[C@@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977660	DF	On-Demand	Anodyne	DRD4	0	52
O=C(CCCN1CCO[C@@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977660	DF	On-Demand	Anodyne	ERG2	22	48
O=C(CCCN1CCO[C@@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977660	DF	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CCO[C@@]2(CCCOC2)C1)c1ccc(F)cc1	ZINC000450977660	DF	On-Demand	Anodyne	CYP2J2	49	34
CCc1ccc(CN(C)S(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450977676	EE	On-Demand	Anodyne	BMP1	60	35
Cc1nc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)oc1C	ZINC000450977677	GE	On-Demand	Anodyne	FBP1	0	43
Cc1nc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)oc1C	ZINC000450977677	GE	On-Demand	Anodyne	MTNN	54	37
CC(C)N(C(=O)Cn1cnc2c1CCCC2)C1CCCC1	ZINC000450977678	CF	On-Demand	Anodyne	SCARB1	55	40
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450977682	EH	On-Demand	Anodyne	CASR	0	41
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450977685	EH	On-Demand	Anodyne	CASR	0	41
CCN(CC)C(=O)Cc1ccc(NS(=O)(=O)c2cccc(Cl)c2O)cc1	ZINC000450977687	GG	On-Demand	Anodyne	PTPRB	50	32
O=C(Cn1cnc2c1CCCC2)N1CCc2sccc2[C@H]1c1ccccc1	ZINC000450977693	GH	On-Demand	Anodyne	TRPM8	21	46
O=C(Cn1cnc2c1CCCC2)N1CCc2sccc2[C@@H]1c1ccccc1	ZINC000450977695	GH	On-Demand	Anodyne	TRPM8	21	46
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OC3COC3)cc2)c1	ZINC000450977712	GH	On-Demand	Anodyne	EPHX2	51	41
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OC3COC3)cc2)c1	ZINC000450977712	GH	On-Demand	Anodyne	KCNK3	39	46
COc1ccc(OC(F)(F)F)c(C(=O)Nc2ccc(OC3COC3)cc2)c1	ZINC000450977712	GH	On-Demand	Anodyne	KCNK9	41	46
CCc1cccc(C(=O)N[C@@H](CC)CO)n1	ZINC000450977727	BD	On-Demand	Anodyne	PDE5A	28	49
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1cc(C)cs1	ZINC000450977728	GF	On-Demand	Anodyne	COLA	49	38
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1cc(C)cs1	ZINC000450977728	GF	On-Demand	Anodyne	CPT1A	52	38
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1cc(C)cs1	ZINC000450977728	GF	On-Demand	Anodyne	CPT1B	55	33
CS(=O)(=O)NCC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450977729	EE	On-Demand	Anodyne	SIGMAR1	38	53
CS(=O)(=O)NCC1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450977729	EE	On-Demand	Anodyne	CACNA1I	58	39
CO[C@@H](CS(=O)(=O)Nc1cc2c(cc1F)CCC(=O)N2)c1ccccc1	ZINC000450977737	GF	On-Demand	Anodyne	PKM	45	43
CO[C@H](CS(=O)(=O)Nc1cc2c(cc1F)CCC(=O)N2)c1ccccc1	ZINC000450977738	GF	On-Demand	Anodyne	PKM	45	43
OC[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1C(F)(F)F	ZINC000450977747	DG	On-Demand	Anodyne	SLC6A1	30	45
OC[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1C(F)(F)F	ZINC000450977747	DG	On-Demand	Anodyne	SIGMAR1	19	45
OC[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@@H]1C(F)(F)F	ZINC000450977748	DG	On-Demand	Anodyne	SLC6A1	30	45
OC[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@@H]1C(F)(F)F	ZINC000450977748	DG	On-Demand	Anodyne	SIGMAR1	19	45
OC[C@H]1CN(CCc2ccc(Cl)cc2)CC[C@@H]1C(F)(F)F	ZINC000450977749	DG	On-Demand	Anodyne	SLC6A1	30	45
OC[C@H]1CN(CCc2ccc(Cl)cc2)CC[C@@H]1C(F)(F)F	ZINC000450977749	DG	On-Demand	Anodyne	SIGMAR1	19	45
OC[C@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1C(F)(F)F	ZINC000450977750	DG	On-Demand	Anodyne	SLC6A1	30	45
OC[C@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1C(F)(F)F	ZINC000450977750	DG	On-Demand	Anodyne	SIGMAR1	19	45
COc1ccc(NS(=O)(=O)c2cc(C)cs2)cc1N1CCCC1=O	ZINC000450977756	FF	On-Demand	Anodyne	HTR6	0	42
COc1ccc(NS(=O)(=O)c2cc(C)cs2)cc1N1CCCC1=O	ZINC000450977756	FF	On-Demand	Anodyne	GHSR	22	53
CCOC(C)(C)CNC(=O)c1ccc(I)cc1F	ZINC000450977772	FF	On-Demand	Anodyne	MAP2K1	41	34
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	BMP1	52	36
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	MMP13	44	39
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	ADAM17	23	40
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	MMP2	29	40
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	MMP3	30	41
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	MMP14	15	40
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	MMP9	36	40
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	LUXN	0	43
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	ADIPOR1	0	41
CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450977788	GE	On-Demand	Anodyne	ADIPOR2	0	41
CCC[C@H](O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450977799	DD	On-Demand	Anodyne	ACHE	25	42
CCC[C@H](O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450977799	DD	On-Demand	Anodyne	SIGMAR1	52	43
CCC[C@H](O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450977799	DD	On-Demand	Anodyne	ABCB1	0	40
CCC[C@@H](O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450977800	DD	On-Demand	Anodyne	ACHE	25	42
CCC[C@@H](O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450977800	DD	On-Demand	Anodyne	SIGMAR1	52	43
CCC[C@@H](O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450977800	DD	On-Demand	Anodyne	ABCB1	0	40
CC(C)N(CC(F)(F)F)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450977816	EC	On-Demand	Anodyne	SCARB1	47	36
COC(=O)c1csc(CN2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)n1	ZINC000450977832	FH	On-Demand	Anodyne	CCR3	32	40
CCC[C@@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450977854	CC	On-Demand	Anodyne	HTR4	19	41
CCC[C@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450977855	CC	On-Demand	Anodyne	HTR4	19	41
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450977866	FG	On-Demand	Anodyne	BMP1	48	36
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450977866	FG	On-Demand	Anodyne	CA1	21	41
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450977866	FG	On-Demand	Anodyne	COLA	42	37
Cc1ccc(CN(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450977866	FG	On-Demand	Anodyne	MMP12	41	35
COC1(CNC(=O)c2c(Cl)cc(Cl)cc2Cl)CCCCC1	ZINC000450977872	FJ	On-Demand	Anodyne	SLC6A9	44	34
CCc1c(C(=O)Nc2cc(C)c(O)c(C)c2C)oc2ccccc12	ZINC000450977874	DJ	On-Demand	Anodyne	NQO1	32	40
CCCN(CCN1CCCC1)Cc1cccc(C(C)=O)c1	ZINC000450977889	CG	On-Demand	Anodyne	HRH3	15	44
CCCN(CCN1CCCC1)Cc1cccc(C(C)=O)c1	ZINC000450977889	CG	On-Demand	Anodyne	SIGMAR1	19	47
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	DRD2	30	47
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	DRD4	25	51
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	HTR2A	31	52
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	SLC6A1	45	34
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977895	EG	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	DRD2	30	47
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	DRD4	25	51
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	HTR2A	31	52
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	SLC6A1	45	34
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977896	EG	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	DRD2	30	47
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	DRD4	25	51
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	HTR2A	31	52
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	SLC6A1	45	34
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)c1ccc(F)cc1	ZINC000450977897	EG	On-Demand	Anodyne	CYP2J2	59	42
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	DRD2	30	47
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	DRD4	25	51
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	HTR2A	31	52
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	HTR2C	25	59
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	SLC6A1	45	34
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	ERG2	22	47
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	SLC18A3	0	44
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H](C(F)(F)F)[C@H](CO)C1)c1ccc(F)cc1	ZINC000450977898	EG	On-Demand	Anodyne	CYP2J2	59	42
O=C(Cn1nnc(-c2ccncn2)n1)NCc1ccccc1OC1CCCC1	ZINC000450977899	GD	On-Demand	Anodyne	SCARB1	51	40
c1ccc(N2CCN(CCCn3nnc(-c4ccncn4)n3)CC2)cc1	ZINC000450977909	FD	On-Demand	Anodyne	HTR1A	39	46
c1ccc(N2CCN(CCCn3nnc(-c4ccncn4)n3)CC2)cc1	ZINC000450977909	FD	On-Demand	Anodyne	DRD2	27	46
c1ccc(N2CCN(CCCn3nnc(-c4ccncn4)n3)CC2)cc1	ZINC000450977909	FD	On-Demand	Anodyne	DRD4	28	46
c1ccc(N2CCN(CCCn3nnc(-c4ccncn4)n3)CC2)cc1	ZINC000450977909	FD	On-Demand	Anodyne	HTR2A	27	46
c1ccc(N2CCN(CCCn3nnc(-c4ccncn4)n3)CC2)cc1	ZINC000450977909	FD	On-Demand	Anodyne	DRD3	30	46
c1ccc(N2CCN(CCCn3nnc(-c4ccncn4)n3)CC2)cc1	ZINC000450977909	FD	On-Demand	Anodyne	HTR7	39	40
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)CCC1CCCC1	ZINC000450977911	GG	On-Demand	Anodyne	COLA	48	34
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)CCC1CCCC1	ZINC000450977911	GG	On-Demand	Anodyne	CPT1A	44	34
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)CCC1CCCC1	ZINC000450977911	GG	On-Demand	Anodyne	RBP4	24	40
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)CCC1CCCC1	ZINC000450977911	GG	On-Demand	Anodyne	QRFPR	15	41
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(C(C)C)ccc21	ZINC000450977929	FG	On-Demand	Anodyne	CYP11B2	38	46
CC[C@H](CC(C)C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977932	CG	On-Demand	Anodyne	TIMP3	40	32
CC[C@@H](CC(C)C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450977933	CG	On-Demand	Anodyne	TIMP3	40	32
CCN(Cc1ccccc1OC1CC1)C[C@H](C)O	ZINC000450977935	BE	On-Demand	Anodyne	ADRA2A	15	42
CCN(Cc1ccccc1OC1CC1)C[C@H](C)O	ZINC000450977935	BE	On-Demand	Anodyne	ADRA2C	15	42
CCN(CCCC(=O)c1ccccc1)C[C@H](C)O	ZINC000450977936	BE	On-Demand	Anodyne	THRA	36	40
CCN(CCCC(=O)c1ccccc1)C[C@H](C)O	ZINC000450977936	BE	On-Demand	Anodyne	THRB	0	40
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450977943	CF	On-Demand	Anodyne	DRD2	32	45
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450977943	CF	On-Demand	Anodyne	DRD1	0	50
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450977943	CF	On-Demand	Anodyne	DRD4	0	51
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450977943	CF	On-Demand	Anodyne	HTR2A	24	48
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450977943	CF	On-Demand	Anodyne	SLC18A3	0	46
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450977943	CF	On-Demand	Anodyne	HTR3B	0	45
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000450977943	CF	On-Demand	Anodyne	CYP2J2	54	40
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450977944	CF	On-Demand	Anodyne	DRD2	32	45
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450977944	CF	On-Demand	Anodyne	DRD1	0	50
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450977944	CF	On-Demand	Anodyne	DRD4	0	51
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450977944	CF	On-Demand	Anodyne	HTR2A	24	48
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450977944	CF	On-Demand	Anodyne	SLC18A3	0	46
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450977944	CF	On-Demand	Anodyne	HTR3B	0	45
CCN1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450977944	CF	On-Demand	Anodyne	CYP2J2	54	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCSc3ccncc32)c1	ZINC000450977945	GG	On-Demand	Anodyne	COLA	27	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCSc3ccncc32)c1	ZINC000450977945	GG	On-Demand	Anodyne	CPT1A	29	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCSc3ccncc32)c1	ZINC000450977945	GG	On-Demand	Anodyne	CPT1B	20	40
CC[C@@H](CO)NC(=O)[C@H](C)Oc1ccccn1	ZINC000450977947	BC	On-Demand	Anodyne	ACE2	49	34
CC[C@@H](CO)NC(=O)[C@@H](C)Oc1ccccn1	ZINC000450977949	BC	On-Demand	Anodyne	ACE2	49	34
COc1ccc(NS(=O)(=O)c2sccc2Cl)cc1N1CCCC1=O	ZINC000450977959	GG	On-Demand	Anodyne	HTR6	21	46
COc1ccc(NS(=O)(=O)c2sccc2Cl)cc1N1CCCC1=O	ZINC000450977959	GG	On-Demand	Anodyne	GHSR	23	53
COC(=O)CCCNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000450977962	DD	On-Demand	Bother	NFKBIA	0	42
COC(=O)CCCNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000450977962	DD	On-Demand	Bother	KAT2B	0	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)NCC#N)cc1	ZINC000450977967	EC	On-Demand	Mild	MMP10	15	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)NCC#N)cc1	ZINC000450977967	EC	On-Demand	Mild	MMP7	15	43
CN(CCN1CCN(Cc2ccccc2)CC1)CC1(C#N)CCC1	ZINC000450977968	EE	On-Demand	Mild	SIGMAR1	62	47
CC(C)CN(C(=O)Cn1nnc(-c2ccncn2)n1)C(C)C	ZINC000450977976	DD	On-Demand	Anodyne	SCARB1	51	39
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)c(C)c(C)c1O	ZINC000450977985	DI	On-Demand	Anodyne	P4HTM	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C3CCOCC3)[nH]n2)cc1	ZINC000450977987	GF	On-Demand	Anodyne	CDK2	0	44
CCN(Cc1cccc(NS(=O)(=O)c2sccc2F)c1)C(C)=O	ZINC000450978002	FG	On-Demand	Anodyne	LIMK2	39	42
CC(C)OCc1ccccc1CNC(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450978003	FD	On-Demand	Anodyne	SCARB1	43	34
COC(=O)CCCNS(=O)(=O)c1cc(Cl)cc(C(=O)OC)c1	ZINC000450978009	ED	On-Demand	Anodyne	TBXA2R	43	36
COC(=O)CCCNS(=O)(=O)c1cc(Cl)cc(C(=O)OC)c1	ZINC000450978009	ED	On-Demand	Anodyne	TBXAS1	0	40
CO[C@@H](Cc1ccccc1)C(=O)Nc1cc(C)c(O)c(C)c1	ZINC000450978022	CG	On-Demand	Anodyne	OPRD1	0	40
CO[C@@H](Cc1ccccc1)C(=O)Nc1cc(C)c(O)c(C)c1	ZINC000450978022	CG	On-Demand	Anodyne	PARP10	0	43
CO[C@H](Cc1ccccc1)C(=O)Nc1cc(C)c(O)c(C)c1	ZINC000450978028	CG	On-Demand	Anodyne	OPRD1	0	40
CO[C@H](Cc1ccccc1)C(=O)Nc1cc(C)c(O)c(C)c1	ZINC000450978028	CG	On-Demand	Anodyne	PARP10	0	43
CCN(CC(F)(F)F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978030	GD	On-Demand	Anodyne	MMP3	17	40
CCN(CC(F)(F)F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978030	GD	On-Demand	Anodyne	TRAR	30	40
CCN(CC(F)(F)F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978030	GD	On-Demand	Anodyne	LUXN	0	46
COCCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450978047	FD	On-Demand	Anodyne	MMP3	17	43
COCCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450978047	FD	On-Demand	Anodyne	MMP8	18	43
COCCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450978047	FD	On-Demand	Anodyne	MMP9	26	43
COCCN(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450978047	FD	On-Demand	Anodyne	MMP1	24	43
CCOC(=O)c1ccc(CN(C)Cc2nc(-c3cccs3)no2)nc1	ZINC000450978051	FG	On-Demand	Anodyne	JUN	16	45
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978058	FF	On-Demand	Anodyne	CHRM4	19	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978058	FF	On-Demand	Anodyne	CHRM5	15	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978059	FF	On-Demand	Anodyne	CHRM4	19	51
C[C@H](c1ccccc1)[C@H](O)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978059	FF	On-Demand	Anodyne	CHRM5	15	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978060	FF	On-Demand	Anodyne	CHRM4	19	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978060	FF	On-Demand	Anodyne	CHRM5	15	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978061	FF	On-Demand	Anodyne	CHRM4	19	51
C[C@H](c1ccccc1)[C@@H](O)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978061	FF	On-Demand	Anodyne	CHRM5	15	51
COC(=O)c1csc(CN2CCC([C@H](F)c3ccccc3F)CC2)n1	ZINC000450978062	FH	On-Demand	Anodyne	TRPC6	44	31
COC(=O)c1csc(CN2CCC([C@@H](F)c3ccccc3F)CC2)n1	ZINC000450978063	FH	On-Demand	Anodyne	TRPC6	44	31
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978067	FG	On-Demand	Anodyne	CHRM4	20	50
CO[C@H](Cc1ccccc1)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978067	FG	On-Demand	Anodyne	REN	40	33
CO[C@H](Cc1ccccc1)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978068	FG	On-Demand	Anodyne	CHRM4	20	50
CO[C@H](Cc1ccccc1)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978068	FG	On-Demand	Anodyne	REN	40	33
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978069	FG	On-Demand	Anodyne	CHRM4	20	50
CO[C@@H](Cc1ccccc1)CN1CCC[C@@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978069	FG	On-Demand	Anodyne	REN	40	33
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978070	FG	On-Demand	Anodyne	CHRM4	20	50
CO[C@@H](Cc1ccccc1)CN1CCC[C@H](CNC(=O)CC(F)(F)F)C1	ZINC000450978070	FG	On-Demand	Anodyne	REN	40	33
COc1cccc(N2CCN(S(=O)(=O)CCOCc3ccccc3)CC2)c1	ZINC000450978072	GE	On-Demand	Anodyne	DRD4	42	33
COc1cccc(N2CCN(S(=O)(=O)CCOCc3ccccc3)CC2)c1	ZINC000450978072	GE	On-Demand	Anodyne	HTR7	15	43
COc1cccc(N2CCN(S(=O)(=O)CCOCc3ccccc3)CC2)c1	ZINC000450978072	GE	On-Demand	Anodyne	ABCB1	0	42
CCOC(=O)c1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)nc1	ZINC000450978076	GF	On-Demand	Anodyne	CHRM4	22	43
CCOC(=O)c1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)nc1	ZINC000450978077	GF	On-Demand	Anodyne	CHRM4	22	43
COC(=O)c1ncccc1S(=O)(=O)NCCCSc1ccccc1	ZINC000450978086	FE	On-Demand	Anodyne	FAS	45	38
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	BMP1	68	38
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	MMP13	41	42
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	ADAM17	31	43
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	MMP2	21	43
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	MMP3	28	41
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	MMP9	33	43
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	LUXN	0	42
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	ADIPOR1	0	43
CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450978089	GE	On-Demand	Anodyne	ADIPOR2	0	43
CC(C)c1cc(NS(=O)(=O)Cc2ccc(C(F)F)cc2)no1	ZINC000450978101	EH	On-Demand	Anodyne	PFK	0	40
CN(CCN1CCC[C@H](CN(C)S(C)(=O)=O)C1)Cc1ccccc1	ZINC000450978118	FD	On-Demand	Anodyne	SLC6A1	79	35
CN(CCN1CCC[C@H](CN(C)S(C)(=O)=O)C1)Cc1ccccc1	ZINC000450978118	FD	On-Demand	Anodyne	SIGMAR1	26	44
CN(CCN1CCC[C@@H](CN(C)S(C)(=O)=O)C1)Cc1ccccc1	ZINC000450978119	FD	On-Demand	Anodyne	SLC6A1	79	35
CN(CCN1CCC[C@@H](CN(C)S(C)(=O)=O)C1)Cc1ccccc1	ZINC000450978119	FD	On-Demand	Anodyne	SIGMAR1	26	44
COC(=O)C1(CN2CCC(C)(c3nc4ccccc4s3)CC2)CC1	ZINC000450978120	EH	On-Demand	Anodyne	BCL2L1	50	35
CCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978124	FF	On-Demand	Anodyne	PFK	0	42
COCCO[C@@H]1CCN(C(=O)c2ccsc2Br)C1	ZINC000450978126	EE	On-Demand	Anodyne	LIPG	24	42
COCCO[C@H]1CCN(C(=O)c2ccsc2Br)C1	ZINC000450978127	EE	On-Demand	Anodyne	LIPG	24	42
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nnc(C(CC)CC)s2)cc1	ZINC000450978144	GH	On-Demand	Anodyne	CA4	23	42
CCc1nnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450978145	GD	On-Demand	Anodyne	CA4	49	39
CCc1nnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450978145	GD	On-Demand	Anodyne	LUXN	0	44
CCOC(C)(C)CNC(=O)c1coc(-c2ccnc(C)c2)n1	ZINC000450978151	DF	On-Demand	Anodyne	IRAK4	22	44
O=C(Cn1nnc(-c2ccncn2)n1)Nc1nc2c(s1)CCCC2	ZINC000450978153	ED	On-Demand	Anodyne	SLC27A1	50	46
COC(=O)CCCNS(=O)(=O)c1cccc(-c2nnnn2C)c1	ZINC000450978164	EC	On-Demand	Anodyne	CCR3	46	36
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450978180	GC	On-Demand	Anodyne	AGTR2	46	37
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450978180	GC	On-Demand	Anodyne	CFTR	46	33
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450978181	GC	On-Demand	Anodyne	AGTR2	46	37
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450978181	GC	On-Demand	Anodyne	CFTR	46	33
CCS(=O)(=O)c1ccc(CN(C)[C@@H]2CCC[C@H]2O)cc1	ZINC000450978182	CD	On-Demand	Anodyne	RORC	17	43
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	CA2	30	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	ADRB2	36	56
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	ADRB1	30	56
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	ADRB3	28	56
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	CA1	39	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	CA7	15	43
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP13	72	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	ADAM17	21	41
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	CA4	27	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	GRM4	15	43
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	CA14	15	43
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP2	58	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP3	34	41
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP8	35	42
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP14	27	40
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	PRTN3	51	31
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP9	38	42
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP12	46	40
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	CA12	30	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP7	36	41
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	ADAMTS4	58	40
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	CA9	32	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MMP1	24	41
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	LEF	18	41
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	IDO1	33	42
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	NCE103	15	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	LIMK2	39	53
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	MTCA1	19	45
COCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450978199	GG	On-Demand	Anodyne	P96878_MYCTU	25	45
CC[C@@H](C(=O)OC)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450978206	FG	On-Demand	Anodyne	DRD4	44	36
CC[C@H](C(=O)OC)N1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450978207	FG	On-Demand	Anodyne	DRD4	44	36
COc1cccc(OCCC(=O)NCC2(OC)CCCCC2)c1	ZINC000450978217	DF	On-Demand	Anodyne	HRH2	22	41
COc1cccc(OCCC(=O)NCC2(OC)CCCCC2)c1	ZINC000450978217	DF	On-Demand	Anodyne	MTNR1A	48	42
COc1cccc(OCCC(=O)NCC2(OC)CCCCC2)c1	ZINC000450978217	DF	On-Demand	Anodyne	MTNR1B	45	42
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@@H]1CCNC(=O)CC1	ZINC000450978226	FD	On-Demand	Anodyne	DRD4	45	39
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@@H]1CCNC(=O)CC1	ZINC000450978226	FD	On-Demand	Anodyne	ACHE	48	43
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@@H]1CCNC(=O)CC1	ZINC000450978226	FD	On-Demand	Anodyne	SIGMAR1	81	45
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@H]1CCNC(=O)CC1	ZINC000450978227	FD	On-Demand	Anodyne	DRD4	45	39
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@H]1CCNC(=O)CC1	ZINC000450978227	FD	On-Demand	Anodyne	ACHE	48	43
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@H]1CCNC(=O)CC1	ZINC000450978227	FD	On-Demand	Anodyne	SIGMAR1	81	45
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	CA2	17	49
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MAOB	23	41
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	LTA4H	35	46
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	TBXA2R	52	39
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	TBXAS1	41	44
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	BMP1	29	40
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	CA1	18	49
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	CA7	24	49
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP13	64	60
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	ADAM17	50	60
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP2	44	60
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP3	37	41
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP8	20	40
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP14	31	60
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	PRTN3	51	32
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	ALOX15	47	43
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	CAPN1	15	41
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP9	43	60
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP12	25	40
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	CA12	15	49
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP10	16	40
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	ADAMTS4	84	47
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	MMP1	38	42
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	FFAR1	49	45
COC(=O)CCCNS(=O)(=O)c1ccc(OCc2ccccc2)cc1	ZINC000450978241	FE	On-Demand	Anodyne	FFAR4	49	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1	ZINC000450978247	EC	On-Demand	Anodyne	TGM2	60	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1	ZINC000450978247	EC	On-Demand	Anodyne	F13A1	92	42
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	HTR1A	20	46
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	DRD1	15	43
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	DRD4	24	43
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	ADRA1D	15	43
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	HTR2A	25	45
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	HTR2C	26	48
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	HRH1	22	42
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	DRD3	21	43
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	HTR4	43	40
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	HTR7	30	43
CCOC(=O)c1cnn(C2CCN(CCCC(=O)c3ccccc3)CC2)c1C	ZINC000450978250	GH	On-Demand	Anodyne	CYP2J2	63	46
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3ccncc32)c1	ZINC000450978255	GE	On-Demand	Anodyne	COLA	44	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3ccncc32)c1	ZINC000450978255	GE	On-Demand	Anodyne	CPT1A	45	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3ccncc32)c1	ZINC000450978255	GE	On-Demand	Anodyne	CPT1B	45	39
CC(=O)N[C@H](C)C1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450978256	DG	On-Demand	Anodyne	CCR5	24	43
CC(=O)N[C@@H](C)C1CCN(C(=O)c2c(C)cccc2Cl)CC1	ZINC000450978257	DG	On-Demand	Anodyne	CCR5	24	43
CCC(CC)c1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978259	GH	On-Demand	Anodyne	CA2	37	50
CCC(CC)c1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978259	GH	On-Demand	Anodyne	CA1	43	50
CCC(CC)c1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978259	GH	On-Demand	Anodyne	CA4	66	50
CCC(CC)c1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978259	GH	On-Demand	Anodyne	CA14	15	43
CCC(CC)c1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978259	GH	On-Demand	Anodyne	CA9	20	50
CCC(CC)c1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978259	GH	On-Demand	Anodyne	LEF	15	51
CCC(CC)c1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978259	GH	On-Demand	Anodyne	PFK	0	40
Cc1cc(Cl)ccc1CN1CCN(CC2CCC(=O)CC2)CC1	ZINC000450978260	EH	On-Demand	Anodyne	P2RX7	19	41
Cc1cc(Cl)ccc1CN1CCN(CC2CCC(=O)CC2)CC1	ZINC000450978260	EH	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	32
CCCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978261	GH	On-Demand	Anodyne	CA2	31	47
CCCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978261	GH	On-Demand	Anodyne	ADRB2	20	42
CCCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978261	GH	On-Demand	Anodyne	ADRB3	25	42
CCCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978261	GH	On-Demand	Anodyne	CA1	39	47
CCCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978261	GH	On-Demand	Anodyne	CA4	56	47
CCCCCc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978261	GH	On-Demand	Anodyne	CA9	17	47
C[C@@H](O)CCN(Cc1ccccc1C(F)(F)F)CC1CC1	ZINC000450978262	DH	On-Demand	Anodyne	SLC6A2	19	53
C[C@H](O)CCN(Cc1ccccc1C(F)(F)F)CC1CC1	ZINC000450978263	DH	On-Demand	Anodyne	SLC6A2	19	53
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nnc(CC(C)C)s2)cc1	ZINC000450978264	GF	On-Demand	Anodyne	CA4	20	41
Cc1csc(S(=O)(=O)Nc2nnc(C)s2)c1	ZINC000450978271	CE	On-Demand	Anodyne	CA1	23	40
Cc1csc(S(=O)(=O)Nc2nnc(C)s2)c1	ZINC000450978271	CE	On-Demand	Anodyne	CA4	36	40
Cc1cncc(-c2nc(CN(C)CCc3ccccc3[N+](=O)[O-])no2)c1	ZINC000450978276	FG	On-Demand	Bother	COLA	78	34
C[C@H](CN(C)CCc1ccccc1[N+](=O)[O-])S(C)(=O)=O	ZINC000450978277	DD	On-Demand	Bother	COLA	22	41
C[C@H](CN(C)CCc1ccccc1[N+](=O)[O-])S(C)(=O)=O	ZINC000450978277	DD	On-Demand	Bother	PQSD	0	42
C[C@@H](CN(C)CCc1ccccc1[N+](=O)[O-])S(C)(=O)=O	ZINC000450978278	DD	On-Demand	Bother	COLA	22	41
C[C@@H](CN(C)CCc1ccccc1[N+](=O)[O-])S(C)(=O)=O	ZINC000450978278	DD	On-Demand	Bother	PQSD	0	42
COC(=O)COc1ccc(CN(C)C(=O)[C@@H]2C[C@@]2(C)c2ccccc2)cc1	ZINC000450978282	FG	On-Demand	Anodyne	TACR3	40	37
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](OCCOC)C2)cc1	ZINC000450978288	EG	On-Demand	Anodyne	L3MBTL3	51	36
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](OCCOC)C2)cc1	ZINC000450978289	EG	On-Demand	Anodyne	L3MBTL3	51	36
CN(CCc1ccccc1[N+](=O)[O-])C[C@@H]1COCCO1	ZINC000450978299	CD	On-Demand	Bother	COLA	60	32
CN(CCc1ccccc1[N+](=O)[O-])C[C@H]1COCCO1	ZINC000450978300	CD	On-Demand	Bother	COLA	60	32
CN(C)S(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978304	FE	On-Demand	Anodyne	DRD2	32	43
CN(C)S(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978304	FE	On-Demand	Anodyne	HTR2A	32	54
CN(C)S(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978304	FE	On-Demand	Anodyne	HTR2C	26	53
CN(C)S(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978304	FE	On-Demand	Anodyne	SLC6A1	120	38
CN(C)S(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978304	FE	On-Demand	Anodyne	ERG2	20	43
CN(C)S(=O)(=O)[C@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978304	FE	On-Demand	Anodyne	CYP2J2	53	38
CN(C)S(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978305	FE	On-Demand	Anodyne	DRD2	32	43
CN(C)S(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978305	FE	On-Demand	Anodyne	HTR2A	32	54
CN(C)S(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978305	FE	On-Demand	Anodyne	HTR2C	26	53
CN(C)S(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978305	FE	On-Demand	Anodyne	SLC6A1	120	38
CN(C)S(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978305	FE	On-Demand	Anodyne	ERG2	20	43
CN(C)S(=O)(=O)[C@@H]1CCCN(CCCC(=O)c2ccc(F)cc2)C1	ZINC000450978305	FE	On-Demand	Anodyne	CYP2J2	53	38
CC[C@@H](CO)NC(=O)c1ccc(S(=O)(=O)C2CC2)cc1	ZINC000450978311	CD	On-Demand	Anodyne	CA2	25	43
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(OCC(C)C)c(Cl)c1	ZINC000450978313	GG	On-Demand	Anodyne	GRM4	19	40
COC(=O)CCc1nnc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)s1	ZINC000450978327	GD	On-Demand	Anodyne	CA4	44	38
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)c1	ZINC000450978335	GH	On-Demand	Anodyne	CA4	40	34
CC[C@@H](CC(C)C)C(=O)Nc1ccc(N2CCS(=O)(=O)CC2)cc1OC	ZINC000450978336	GF	On-Demand	Anodyne	KCNQ2	44	34
CC[C@H](CC(C)C)C(=O)Nc1ccc(N2CCS(=O)(=O)CC2)cc1OC	ZINC000450978337	GF	On-Demand	Anodyne	KCNQ2	44	34
O=C(CCCC(=O)C1CC1)Nc1ccc(OC2COC2)cc1	ZINC000450978345	DF	On-Demand	Anodyne	HDAC10	29	40
CC[C@@H](CO)NC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450978346	EF	On-Demand	Anodyne	PYGL	50	37
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)n1	ZINC000450978350	EG	On-Demand	Anodyne	GRM4	20	42
CO[C@H](C)CS(=O)(=O)Nc1nnc(-c2ccccc2)s1	ZINC000450978358	DD	On-Demand	Anodyne	CA4	23	43
CCCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n[nH]1	ZINC000450978359	FF	On-Demand	Anodyne	PFK	0	42
CO[C@@H](C)CS(=O)(=O)Nc1nnc(-c2ccccc2)s1	ZINC000450978360	DD	On-Demand	Anodyne	CA4	23	43
COCC1(S(=O)(=O)N(C)CC(=O)Nc2cc(Cl)ccc2OC)CC1	ZINC000450978377	GD	On-Demand	Anodyne	COLA	62	33
COCC1(S(=O)(=O)N(C)CC(=O)Nc2cc(Cl)ccc2OC)CC1	ZINC000450978377	GD	On-Demand	Anodyne	CPT1A	56	33
COCC1(S(=O)(=O)N(C)CC(=O)Nc2cc(Cl)ccc2OC)CC1	ZINC000450978377	GD	On-Demand	Anodyne	CPT1B	59	33
CCN(Cc1ccc(S(=O)(=O)CC)cc1)C[C@H](C)O	ZINC000450978385	CD	On-Demand	Anodyne	RORC	30	47
CC(=O)N[C@H](C)C1CCN(C(=O)Cc2cc3ccccc3s2)CC1	ZINC000450978386	EG	On-Demand	Anodyne	CCR1	19	40
CC(=O)N[C@@H](C)C1CCN(C(=O)Cc2cc3ccccc3s2)CC1	ZINC000450978387	EG	On-Demand	Anodyne	CCR1	19	40
C=CC(C)(C)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450978402	DI	On-Demand	Mild	ACAT	0	48
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1	ZINC000450978415	GF	On-Demand	Anodyne	NPY2R	54	46
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1	ZINC000450978415	GF	On-Demand	Anodyne	NPY5R	22	46
COC(=O)CCc1nnc(NS(=O)(=O)c2ccc(C3CC3)cc2)s1	ZINC000450978419	FE	On-Demand	Anodyne	CA4	54	44
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450978430	FF	On-Demand	Anodyne	ANPEP	27	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450978430	FF	On-Demand	Anodyne	CTSK	25	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450978430	FF	On-Demand	Anodyne	TIMP3	57	34
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450978430	FF	On-Demand	Anodyne	MMP3	26	41
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450978430	FF	On-Demand	Anodyne	CAPN1	17	45
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450978430	FF	On-Demand	Anodyne	CAPN2	18	42
Cc1cc(N2CCOCC2)ccc1NS(=O)(=O)c1sccc1Cl	ZINC000450978439	FG	On-Demand	Anodyne	TTK	0	43
CC(C)(CNS(=O)(=O)c1sc2ccccc2c1Cl)N1CCOCC1	ZINC000450978449	GF	On-Demand	Anodyne	PRKDC	42	33
COC(=O)CCCNS(=O)(=O)c1cccc2ncccc12	ZINC000450978454	DD	On-Demand	Anodyne	NPY5R	15	41
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cc(C)cs1	ZINC000450978458	DE	On-Demand	Anodyne	FKBP1A	54	45
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cc(C)cs1	ZINC000450978458	DE	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cc(C)cs1	ZINC000450978459	DE	On-Demand	Anodyne	FKBP1A	54	45
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cc(C)cs1	ZINC000450978459	DE	On-Demand	Anodyne	FKBP12.6	0	41
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccc2ccoc12	ZINC000450978476	EF	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc2ccoc12	ZINC000450978477	EF	On-Demand	Anodyne	FKBP12.6	0	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	FKBP1A	64	51
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	CASP3	0	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	MMP13	61	47
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	ADAM17	44	39
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	ITGA4	37	40
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	CA14	15	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	CAPNS1	21	43
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	MMP3	66	47
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	MMP8	35	40
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	MMP9	28	43
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	TGM2	50	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	MMP7	73	47
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	MMP1	59	47
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	F13A1	83	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978480	GE	On-Demand	Anodyne	NAMPT	17	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	FKBP1A	64	51
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	CASP3	0	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	MMP13	61	47
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	ADAM17	44	39
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	ITGA4	37	40
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	CA14	15	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	CAPNS1	21	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	MMP3	66	47
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	MMP8	35	40
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	MMP9	28	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	TGM2	50	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	MMP7	73	47
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	MMP1	59	47
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	F13A1	83	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450978481	GE	On-Demand	Anodyne	NAMPT	17	42
CC(C)[C@H]1CCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450978485	EI	On-Demand	Anodyne	HPGD	35	48
CC(C)[C@@H]1CCCN(C(=O)c2ccc(-c3ccncc3)c(F)c2)C1	ZINC000450978486	EI	On-Demand	Anodyne	HPGD	35	48
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450978487	DF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450978487	DF	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450978487	DF	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCOC[C@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450978488	DF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCOC[C@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450978488	DF	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCOC[C@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450978488	DF	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450978489	DF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450978489	DF	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCO1)c1ccc(F)cc1	ZINC000450978489	DF	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCOC[C@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450978490	DF	On-Demand	Anodyne	DRD4	0	42
O=C(CCCN1CCOC[C@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450978490	DF	On-Demand	Anodyne	HTR3B	0	42
O=C(CCCN1CCOC[C@H]1[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000450978490	DF	On-Demand	Anodyne	CYP2J2	49	35
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450978496	EE	On-Demand	Anodyne	ACHE	22	43
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@H]1C[C@H]2CC[C@H]1O2	ZINC000450978496	EE	On-Demand	Anodyne	SIGMAR1	63	42
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450978497	EE	On-Demand	Anodyne	ACHE	22	43
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000450978497	EE	On-Demand	Anodyne	SIGMAR1	63	42
CCOC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450978510	FG	On-Demand	Anodyne	MMP13	16	52
CCOC(C)(C)CNC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450978510	FG	On-Demand	Anodyne	MT-ND1	17	40
CCCCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n[nH]1	ZINC000450978520	GE	On-Demand	Anodyne	LUXN	0	42
O=C(Cn1nnc(-c2ccncn2)n1)Nc1ccnn1CC1CCCCC1	ZINC000450978533	FD	On-Demand	Anodyne	SCARB1	47	36
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)c1	ZINC000450978534	FF	On-Demand	Anodyne	CDK2	0	47
CC[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)[S@]1=O	ZINC000450978535	GH	On-Demand	Anodyne	CYP2J2	53	39
CC[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@H](C)[S@@]1=O	ZINC000450978536	GH	On-Demand	Anodyne	CYP2J2	53	39
CC[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@H](C)[S@]1=O	ZINC000450978537	GH	On-Demand	Anodyne	CYP2J2	53	39
CC[C@@H]1CN(CCCC(=O)c2ccc(Br)cc2)C[C@@H](C)[S@@]1=O	ZINC000450978538	GH	On-Demand	Anodyne	CYP2J2	53	39
COCCOc1ccc(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)cc1	ZINC000450978543	GG	On-Demand	Anodyne	PPARD	28	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(=O)n(C)c2)cc1	ZINC000450978552	GD	On-Demand	Anodyne	MTNN	42	37
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(=O)n(C)c2)cc1	ZINC000450978552	GD	On-Demand	Anodyne	MGAT1	43	32
COCCOC[C@@H](O)CN1CCC(C)(c2nc3ccccc3s2)CC1	ZINC000450978555	FF	On-Demand	Anodyne	ACOX1	81	37
COCCOC[C@H](O)CN1CCC(C)(c2nc3ccccc3s2)CC1	ZINC000450978556	FF	On-Demand	Anodyne	ACOX1	81	37
CCN(CC(=O)Nc1ccc2c(c1)OCCO2)S(=O)(=O)CCC1CCCC1	ZINC000450978565	GF	On-Demand	Anodyne	LDLR	0	45
CC(C)Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978568	GG	On-Demand	Anodyne	CA2	37	51
CC(C)Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978568	GG	On-Demand	Anodyne	PPIA	23	42
CC(C)Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978568	GG	On-Demand	Anodyne	CA1	45	51
CC(C)Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978568	GG	On-Demand	Anodyne	CA4	66	51
CC(C)Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978568	GG	On-Demand	Anodyne	CA14	15	40
CC(C)Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978568	GG	On-Demand	Anodyne	CA9	21	51
CC(C)Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978568	GG	On-Demand	Anodyne	LEF	19	57
CC(C)Cc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450978568	GG	On-Demand	Anodyne	PFK	0	41
COC(=O)COc1ccc(CN(C)C(=O)C2=C(c3ccccc3)CCC2)cc1	ZINC000450978569	GH	On-Demand	Anodyne	HSD17B2	16	41
COC(=O)COc1ccc(CN(C)C(=O)C2=C(c3ccccc3)CCC2)cc1	ZINC000450978569	GH	On-Demand	Anodyne	LIMK2	34	43
CCS(=O)(=O)c1ccc(CN2CCC(F)(C#N)CC2)cc1	ZINC000450978573	DE	On-Demand	Mild	SIGMAR1	18	41
CCS(=O)(=O)c1ccc(CN2CCC(F)(C#N)CC2)cc1	ZINC000450978573	DE	On-Demand	Mild	ADAM17	19	40
COCCO[C@H]1CCN(C(=O)C(C)(C)C(C)(F)F)C1	ZINC000450978579	CD	On-Demand	Anodyne	LIPG	22	42
COCCO[C@@H]1CCN(C(=O)C(C)(C)C(C)(F)F)C1	ZINC000450978580	CD	On-Demand	Anodyne	LIPG	22	42
CCOC(=O)c1cc(C(=O)N2CCN(C3CC3)c3c(C)cccc32)on1	ZINC000450978583	FF	On-Demand	Anodyne	GPBAR1	30	40
O=C(Cn1cnc2c1CCCC2)N(Cc1ccccc1)c1ccccc1	ZINC000450978589	EH	On-Demand	Anodyne	FABP4	48	37
Cc1ccnc(-c2noc(CN3CCC[C@H](CNC(=O)CC(F)(F)F)C3)n2)c1	ZINC000450978591	GF	On-Demand	Anodyne	BMP1	23	40
Cc1ccnc(-c2noc(CN3CCC[C@H](CNC(=O)CC(F)(F)F)C3)n2)c1	ZINC000450978591	GF	On-Demand	Anodyne	CCR3	17	40
Cc1ccnc(-c2noc(CN3CCC[C@@H](CNC(=O)CC(F)(F)F)C3)n2)c1	ZINC000450978592	GF	On-Demand	Anodyne	BMP1	23	40
Cc1ccnc(-c2noc(CN3CCC[C@@H](CNC(=O)CC(F)(F)F)C3)n2)c1	ZINC000450978592	GF	On-Demand	Anodyne	CCR3	17	40
Cc1cccc(Cl)c1CN1CCC[C@@H](S(=O)(=O)N(C)C)C1	ZINC000450978594	EF	On-Demand	Anodyne	SLC6A1	49	37
Cc1cccc(Cl)c1CN1CCC[C@H](S(=O)(=O)N(C)C)C1	ZINC000450978595	EF	On-Demand	Anodyne	SLC6A1	49	37
COC(=O)COc1ccc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450978598	GH	On-Demand	Anodyne	PPARA	30	44
COC(=O)COc1ccc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450978598	GH	On-Demand	Anodyne	PPARD	66	48
COC(=O)COc1ccc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2C)cc1	ZINC000450978598	GH	On-Demand	Anodyne	MT-ND1	24	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	CA2	23	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	COLA	43	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	CA4	23	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	MMP2	33	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	MMP3	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	MMP9	17	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	MMP12	44	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	ADAMTS4	46	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	CA9	15	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCSc2ccccc2)cc1	ZINC000450978603	GH	On-Demand	Anodyne	MCL1	0	44
CCC(=O)CCCN(C)Cc1ccc(OCC(F)(F)F)cc1	ZINC000450978605	DH	On-Demand	Anodyne	FDPS	15	41
CCC(=O)CCCN(C)Cc1ccc(OCC(F)(F)F)cc1	ZINC000450978605	DH	On-Demand	Anodyne	ACHE	0	46
CCC(=O)CCCN(C)Cc1ccc(OCC(F)(F)F)cc1	ZINC000450978605	DH	On-Demand	Anodyne	LTA4H	38	43
COCCO[C@@H]1CCN(C(=O)CCCC(C)C)C1	ZINC000450978606	CE	On-Demand	Anodyne	GNAI1	0	40
COCCO[C@H]1CCN(C(=O)CCCC(C)C)C1	ZINC000450978607	CE	On-Demand	Anodyne	GNAI1	0	40
COC(=O)c1coc(CN2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450978608	FH	On-Demand	Anodyne	CCR2	42	39
COC(=O)c1coc(CN2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)n1	ZINC000450978609	FH	On-Demand	Anodyne	CCR2	42	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2F)cc1	ZINC000450978616	FG	On-Demand	Anodyne	CA2	15	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2F)cc1	ZINC000450978616	FG	On-Demand	Anodyne	BMP1	42	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2F)cc1	ZINC000450978616	FG	On-Demand	Anodyne	COLA	89	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2F)cc1	ZINC000450978616	FG	On-Demand	Anodyne	MMP8	30	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2F)cc1	ZINC000450978616	FG	On-Demand	Anodyne	LEF	47	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ccccc32)cc1	ZINC000450978617	FF	On-Demand	Anodyne	COLA	24	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOc3ccccc32)cc1	ZINC000450978617	FF	On-Demand	Anodyne	CPT1A	27	43
CCCN(Cc1ccc(C)cc1)C(=O)Cn1cnc2c1CCCC2	ZINC000450978623	EH	On-Demand	Anodyne	PLA2G7	62	37
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCOc3ccncc32)c1	ZINC000450978627	FF	On-Demand	Anodyne	CYP11B2	27	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	CA2	36	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	CA1	45	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	MMP13	24	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	CA4	67	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	MMP2	17	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	CA9	23	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	LEF	21	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	CYNT	28	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1	ZINC000450978630	GF	On-Demand	Anodyne	AADAC	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(CN(C)C)ccn2)cc1	ZINC000450978631	GF	On-Demand	Anodyne	MMP12	40	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(CN(C)C)ccn2)cc1	ZINC000450978631	GF	On-Demand	Anodyne	ADAMTS4	45	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(CN(C)C)ccn2)cc1	ZINC000450978631	GF	On-Demand	Anodyne	PFK	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(CN(C)C)ccn2)cc1	ZINC000450978631	GF	On-Demand	Anodyne	LIMK2	42	35
COC(=O)COc1ccc(CN(C)C(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450978632	GG	On-Demand	Anodyne	OPRK1	0	40
COC(=O)COc1ccc(CN(C)C(=O)Cc2ccc(Cl)c(OC)c2)cc1	ZINC000450978632	GG	On-Demand	Anodyne	PDE6A	42	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	MME	70	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	CMA1	47	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	CTRA_BOVIN	61	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	FCER2	53	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	PAPA1_CARPA	48	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	TIMP3	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	CTRC	46	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	ACE2	76	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	FPR1	41	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	SLC15A2	0	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	BLA1_STEMA	43	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	QRFPR	45	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978638	EE	On-Demand	Anodyne	PSMB8	46	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	MME	70	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	CMA1	47	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	CTRA_BOVIN	61	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	FCER2	53	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	PAPA1_CARPA	48	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	TIMP3	42	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	CTRC	46	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	ACE2	76	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	FPR1	41	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	SLC15A2	0	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	BLA1_STEMA	43	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	QRFPR	45	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1cnc2c1CCCC2	ZINC000450978639	EE	On-Demand	Anodyne	PSMB8	46	34
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450978644	FH	On-Demand	Anodyne	SLC6A1	110	40
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450978644	FH	On-Demand	Anodyne	CHRM4	23	50
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450978644	FH	On-Demand	Anodyne	CACNA1I	40	31
O=C(CC(F)(F)F)NC[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450978645	FH	On-Demand	Anodyne	SLC6A1	110	40
O=C(CC(F)(F)F)NC[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450978645	FH	On-Demand	Anodyne	CHRM4	23	50
O=C(CC(F)(F)F)NC[C@H]1CCCN(CC/C=C\c2ccccc2)C1	ZINC000450978645	FH	On-Demand	Anodyne	CACNA1I	40	31
O=C(CC(F)(F)F)NC[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450978646	FH	On-Demand	Anodyne	SLC6A1	110	40
O=C(CC(F)(F)F)NC[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450978646	FH	On-Demand	Anodyne	CHRM4	23	50
O=C(CC(F)(F)F)NC[C@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450978646	FH	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)c1nnc(NS(=O)(=O)Cc2c(F)cccc2Cl)s1	ZINC000450978647	FH	On-Demand	Anodyne	INHA	18	41
CN1CCC[C@@H](C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)C1=O	ZINC000450978663	FF	On-Demand	Anodyne	ACAT	0	47
CN1CCC[C@H](C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)C1=O	ZINC000450978664	FF	On-Demand	Anodyne	ACAT	0	47
Cc1cc(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)nn1C(C)C	ZINC000450978668	FI	On-Demand	Anodyne	ACAT	0	47
Cc1cc(C)c(C(=O)Nc2ccc(OC3COC3)cc2)cc1Br	ZINC000450978669	GI	On-Demand	Anodyne	Q25615_ONCVO	44	33
CC(C)(C)c1nnc(NS(=O)(=O)c2cc3cc(F)ccc3o2)s1	ZINC000450978674	FH	On-Demand	Anodyne	CA4	40	36
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450978676	GG	On-Demand	Anodyne	ACHE	29	46
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450978676	GG	On-Demand	Anodyne	SIGMAR1	30	41
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450978676	GG	On-Demand	Anodyne	SSTR5	42	36
CNC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)c2ccc(CC(C)C)cc2)cc1	ZINC000450978708	GG	On-Demand	Anodyne	SLC22A20	0	41
CNC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)c2ccc(CC(C)C)cc2)cc1	ZINC000450978708	GG	On-Demand	Anodyne	TMPRSS11D	41	33
CNC(=O)c1ccc(CS(=O)(=O)N[C@H](C)c2ccc(CC(C)C)cc2)cc1	ZINC000450978709	GG	On-Demand	Anodyne	SLC22A20	0	41
CNC(=O)c1ccc(CS(=O)(=O)N[C@H](C)c2ccc(CC(C)C)cc2)cc1	ZINC000450978709	GG	On-Demand	Anodyne	TMPRSS11D	41	33
Cc1[nH]c(C#N)cc1C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450978714	EH	On-Demand	Mild	KCNA3	43	36
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc(C)c1O	ZINC000450978717	DH	On-Demand	Anodyne	JUN	21	41
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc(C)c1O	ZINC000450978717	DH	On-Demand	Anodyne	TRPV1	17	43
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc(C)c1O	ZINC000450978717	DH	On-Demand	Anodyne	ATF1	52	32
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc(C)c1O	ZINC000450978717	DH	On-Demand	Anodyne	NFKB1	48	32
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc(C)c1O	ZINC000450978717	DH	On-Demand	Anodyne	P4HTM	0	44
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc(C)c1O	ZINC000450978717	DH	On-Demand	Anodyne	SHH	44	34
Cc1cc(NC(=O)c2ccc(C(C)(F)F)nc2)cc(C)c1O	ZINC000450978717	DH	On-Demand	Anodyne	KCNK3	45	36
COC(=O)c1ncccc1S(=O)(=O)N[C@H](C)c1ccccc1OC	ZINC000450978718	FD	On-Demand	Anodyne	MMP16	0	40
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](C)c1ccccc1OC	ZINC000450978719	FD	On-Demand	Anodyne	MMP16	0	40
CS(=O)(=O)NCC1CCN(CC/C=C\c2ccccc2)CC1	ZINC000450978723	DE	On-Demand	Anodyne	CACNA1I	41	33
CS(=O)(=O)NCC1CCN(CC/C=C/c2ccccc2)CC1	ZINC000450978724	DE	On-Demand	Anodyne	CACNA1I	41	33
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)c2ccccc2OC)cc1	ZINC000450978729	GG	On-Demand	Anodyne	ACR	24	40
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)c2ccccc2OC)cc1	ZINC000450978729	GG	On-Demand	Anodyne	TMPRSS11D	65	37
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C)c2ccccc2OC)cc1	ZINC000450978730	GG	On-Demand	Anodyne	ACR	24	40
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C)c2ccccc2OC)cc1	ZINC000450978730	GG	On-Demand	Anodyne	TMPRSS11D	65	37
c1cc2c(cc1-c1nc(Cn3cnc4c3CCCC4)cs1)OCO2	ZINC000450978735	EH	On-Demand	Anodyne	DYRK1A	41	39
c1cc2c(cc1-c1nc(Cn3cnc4c3CCCC4)cs1)OCO2	ZINC000450978735	EH	On-Demand	Anodyne	TGFBR1	23	40
c1cc2c(cc1-c1nc(Cn3cnc4c3CCCC4)cs1)OCO2	ZINC000450978735	EH	On-Demand	Anodyne	CLK2	47	39
c1cc2c(cc1-c1nc(Cn3cnc4c3CCCC4)cs1)OCO2	ZINC000450978735	EH	On-Demand	Anodyne	CLK4	72	39
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	ACE	25	43
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	OPRD1	0	41
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	HRH3	0	43
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	PREP	54	47
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	CFTR	57	37
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	XIAP	40	37
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	SFRP1	41	38
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	WNT3	41	32
Cc1cc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc(C)c1O	ZINC000450978742	EG	On-Demand	Anodyne	TMPRSS11D	46	33
CN(Cc1ccc(F)cc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450978748	FE	On-Demand	Anodyne	PTGS2	20	40
CN(Cc1ccc(F)cc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450978748	FE	On-Demand	Anodyne	NR1H2	15	42
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450978753	FH	On-Demand	Anodyne	SLC6A1	110	40
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450978753	FH	On-Demand	Anodyne	CHRM4	23	50
O=C(CC(F)(F)F)NC[C@@H]1CCCN(CC/C=C/c2ccccc2)C1	ZINC000450978753	FH	On-Demand	Anodyne	CACNA1I	40	31
Cc1csc(S(=O)(=O)Nc2nnc(C(C)(C)c3ccccc3)s2)c1	ZINC000450978764	GI	On-Demand	Anodyne	NCE103	15	40
COC(=O)CCCNS(=O)(=O)c1csc(-c2ccccc2)n1	ZINC000450978768	EE	On-Demand	Anodyne	HDAC6	16	42
C[C@H](c1ccccc1)[C@@H](O)CN1C[C@H]2CCC[C@@H](C2)C1	ZINC000450978771	CG	On-Demand	Anodyne	SLC6A3	15	40
C[C@H](c1ccccc1)[C@@H](O)CN1C[C@H]2CCC[C@@H](C2)C1	ZINC000450978771	CG	On-Demand	Anodyne	SLC18A2	40	39
C[C@H](c1ccccc1)[C@H](O)CN1C[C@H]2CCC[C@@H](C2)C1	ZINC000450978772	CG	On-Demand	Anodyne	SLC6A3	15	40
C[C@H](c1ccccc1)[C@H](O)CN1C[C@H]2CCC[C@@H](C2)C1	ZINC000450978772	CG	On-Demand	Anodyne	SLC18A2	40	39
C[C@@H](c1ccccc1)[C@H](O)CN1C[C@H]2CCC[C@@H](C2)C1	ZINC000450978774	CG	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H](c1ccccc1)[C@H](O)CN1C[C@H]2CCC[C@@H](C2)C1	ZINC000450978774	CG	On-Demand	Anodyne	SLC18A2	40	39
C[C@@H](c1ccccc1)[C@@H](O)CN1C[C@H]2CCC[C@@H](C2)C1	ZINC000450978776	CG	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H](c1ccccc1)[C@@H](O)CN1C[C@H]2CCC[C@@H](C2)C1	ZINC000450978776	CG	On-Demand	Anodyne	SLC18A2	40	39
COc1ccccc1CN(C)S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450978777	EG	On-Demand	Anodyne	GLMU	0	40
N#Cc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450978786	GD	On-Demand	Mild	IAP	0	42
N#Cc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450978786	GD	On-Demand	Mild	ADAMTS4	25	46
N#Cc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450978786	GD	On-Demand	Mild	LUXN	0	41
N#Cc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450978786	GD	On-Demand	Mild	ADIPOR1	0	43
N#Cc1cccc(CNS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450978786	GD	On-Demand	Mild	ADIPOR2	0	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N(C)Cc2cccs2)c1	ZINC000450978788	FG	On-Demand	Anodyne	BMP1	27	41
CC(=O)N[C@H](C)C1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1	ZINC000450978789	GE	On-Demand	Bother	ABHD6	0	40
CC(=O)N[C@@H](C)C1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1	ZINC000450978791	GE	On-Demand	Bother	ABHD6	0	40
COc1ccc([C@@H](NC(=O)Cn2nnc(-c3ccncn3)n2)C2CC2)cc1	ZINC000450978806	FD	On-Demand	Anodyne	SCARB1	47	41
COc1ccc([C@H](NC(=O)Cn2nnc(-c3ccncn3)n2)C2CC2)cc1	ZINC000450978807	FD	On-Demand	Anodyne	SCARB1	47	41
CCCCn1ccnc1-c1cccc(NS(=O)(=O)C[C@H](C)OC)c1	ZINC000450978817	FG	On-Demand	Anodyne	ACAT	0	40
CCCCn1ccnc1-c1cccc(NS(=O)(=O)C[C@@H](C)OC)c1	ZINC000450978818	FG	On-Demand	Anodyne	ACAT	0	40
CC(C)[C@@H]1CCCN(C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)C1	ZINC000450978856	ED	On-Demand	Anodyne	SLC16A1	43	34
CC(C)[C@H]1CCCN(C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)C1	ZINC000450978857	ED	On-Demand	Anodyne	SLC16A1	43	34
COc1ccc(NS(=O)(=O)c2sccc2F)cc1N1CCCCC1=O	ZINC000450978895	GG	On-Demand	Anodyne	HTR6	17	45
COc1ccc(NS(=O)(=O)c2sccc2F)cc1N1CCCCC1=O	ZINC000450978895	GG	On-Demand	Anodyne	GHSR	15	51
COc1ccc(NS(=O)(=O)c2sccc2F)cc1N1CCCCC1=O	ZINC000450978895	GG	On-Demand	Anodyne	PKM	16	43
CCC[C@@H](C)c1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n[nH]1	ZINC000450978898	GH	On-Demand	Anodyne	PFK	0	42
CCC[C@H](C)c1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n[nH]1	ZINC000450978899	GH	On-Demand	Anodyne	PFK	0	42
CN(CCN1CCN(Cc2ccccc2)CC1)Cc1cn(CC2CC2)nn1	ZINC000450978916	FD	On-Demand	Anodyne	DRD4	41	36
CN(CCN1CCN(Cc2ccccc2)CC1)Cc1cn(CC2CC2)nn1	ZINC000450978916	FD	On-Demand	Anodyne	ACHE	41	42
CN(CCN1CCN(Cc2ccccc2)CC1)Cc1cn(CC2CC2)nn1	ZINC000450978916	FD	On-Demand	Anodyne	SIGMAR1	71	41
CN(CCN1CCN(Cc2ccccc2)CC1)Cc1cn(CC2CC2)nn1	ZINC000450978916	FD	On-Demand	Anodyne	HSP90AB1	0	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc(OC)nc2C)c1	ZINC000450978929	GG	On-Demand	Anodyne	FFAR4	18	40
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450978940	FF	On-Demand	Mild	FKBP1A	56	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450978941	FF	On-Demand	Mild	FKBP1A	56	42
O=S(=O)(CCC1CCCC1)NCCOc1ccccc1	ZINC000450978962	CF	On-Demand	Anodyne	PLA2G4A	41	37
CC[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450978970	DF	On-Demand	Anodyne	ELANE	41	41
CC[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450978970	DF	On-Demand	Anodyne	CTRA_BOVIN	48	34
CC[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450978970	DF	On-Demand	Anodyne	PDE6D	68	41
CC[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450978970	DF	On-Demand	Anodyne	HDAC8	29	42
CC[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450978970	DF	On-Demand	Anodyne	TACR3	53	38
CC[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450978970	DF	On-Demand	Anodyne	HDAC6	22	42
CC[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450978970	DF	On-Demand	Anodyne	PLM2_PLAFA	0	42
CC[C@@H](CO)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21	ZINC000450978970	DF	On-Demand	Anodyne	IMDH_CRYPV	38	59
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000450978973	GG	On-Demand	Anodyne	EPHX2	21	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)c1	ZINC000450978974	GG	On-Demand	Anodyne	EPHX2	21	40
CCc1cccc(C(=O)Nc2cc(C)c(O)c(C)c2)n1	ZINC000450978977	CG	On-Demand	Anodyne	PDE5A	31	44
CCN(C[C@@H]1COc2ccccc2O1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450978982	GD	On-Demand	Anodyne	ADRA2B	20	40
CCN(C[C@@H]1COc2ccccc2O1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450978982	GD	On-Demand	Anodyne	ADRA2C	15	40
CCN(C[C@H]1COc2ccccc2O1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450978983	GD	On-Demand	Anodyne	ADRA2B	20	40
CCN(C[C@H]1COc2ccccc2O1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450978983	GD	On-Demand	Anodyne	ADRA2C	15	40
O=C(CSC1CC1)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450978984	EH	On-Demand	Anodyne	ACAT	0	45
COC(=O)c1csc(CN2CCC[C@](C)(c3ccccc3)CC2)n1	ZINC000450979001	EH	On-Demand	Anodyne	SIGMAR1	33	41
COC(=O)c1csc(CN2CCC[C@](C)(c3ccccc3)CC2)n1	ZINC000450979001	EH	On-Demand	Anodyne	NPFFR1	45	36
COC(=O)c1csc(CN2CCC[C@@](C)(c3ccccc3)CC2)n1	ZINC000450979002	EH	On-Demand	Anodyne	SIGMAR1	33	41
COC(=O)c1csc(CN2CCC[C@@](C)(c3ccccc3)CC2)n1	ZINC000450979002	EH	On-Demand	Anodyne	NPFFR1	45	36
CC[C@@H](CO)NC(=O)c1ccc2scc(Br)c2c1	ZINC000450979004	EG	On-Demand	Anodyne	AKT1	40	31
Cc1cccc(Cl)c1NC(=O)Cn1cnc2c1CCCC2	ZINC000450979014	DG	On-Demand	Anodyne	LCK	45	39
Cc1cccc(Cl)c1NC(=O)Cn1cnc2c1CCCC2	ZINC000450979014	DG	On-Demand	Anodyne	FYN	36	40
Cc1cccc(Cl)c1NC(=O)Cn1cnc2c1CCCC2	ZINC000450979014	DG	On-Demand	Anodyne	ACAT	0	42
CC[C@@H](C)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450979015	BC	On-Demand	Anodyne	SCARB1	43	35
CC[C@H](C)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450979016	BC	On-Demand	Anodyne	SCARB1	43	35
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(CCO)c2ccccc2)c1	ZINC000450979035	GF	On-Demand	Anodyne	NR1I2	21	41
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(CCO)c2ccccc2)c1	ZINC000450979035	GF	On-Demand	Anodyne	NR1H2	23	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(CCO)c2ccccc2)c1	ZINC000450979035	GF	On-Demand	Anodyne	RORC	17	52
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(CCO)c2ccccc2)c1	ZINC000450979035	GF	On-Demand	Anodyne	RORB	0	40
COc1cccc(OCCC(=O)Nc2cc(C)c(O)c(C)c2)c1	ZINC000450979038	DG	On-Demand	Anodyne	MTNR1A	46	51
COc1cccc(OCCC(=O)Nc2cc(C)c(O)c(C)c2)c1	ZINC000450979038	DG	On-Demand	Anodyne	MTNR1B	42	47
CCC(=O)C1(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)CC1	ZINC000450979041	EH	On-Demand	Anodyne	ACAT	0	51
CCOC(=O)C(C)(C)C1CCN(CCCC(=O)CC)CC1	ZINC000450979057	CG	On-Demand	Anodyne	CYP2J2	51	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(C)C)[nH]n2)cc1	ZINC000450979062	FF	On-Demand	Anodyne	PFK	0	43
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	DRD2	22	41
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	OPRD1	19	41
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	P2RY12	30	40
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	HRH3	17	41
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	SIGMAR1	51	38
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	SSTR5	47	39
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	MLNR	40	35
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	FAAH	27	41
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	CACNA1G	18	42
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	NOD1	16	42
CCOC(=O)c1ccc(CN(C)CCN2CCN(Cc3ccccc3)CC2)nc1	ZINC000450979132	GF	On-Demand	Anodyne	NOD2	33	42
COC(=O)CCCNS(=O)(=O)Cc1cc(Cl)ccc1OC	ZINC000450979147	ED	On-Demand	Anodyne	COLA	59	35
COC(=O)CCCNS(=O)(=O)Cc1cc(Cl)ccc1OC	ZINC000450979147	ED	On-Demand	Anodyne	CPT1A	55	35
COC(=O)CCCNS(=O)(=O)Cc1cc(Cl)ccc1OC	ZINC000450979147	ED	On-Demand	Anodyne	CPT1B	60	33
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450979160	FF	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450979160	FF	On-Demand	Anodyne	MIP	0	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450979161	FF	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450979161	FF	On-Demand	Anodyne	MIP	0	43
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(Cl)ccc21	ZINC000450979168	FF	On-Demand	Anodyne	CNR1	56	35
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(Cl)ccc21	ZINC000450979168	FF	On-Demand	Anodyne	COLA	59	45
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(Cl)ccc21	ZINC000450979168	FF	On-Demand	Anodyne	GPR119	24	45
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)[C@@H]4CCCO4)CC3)ccc2c1	ZINC000450979169	GE	On-Demand	Anodyne	TRY2_BOVIN	31	40
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)[C@@H]4CCCO4)CC3)ccc2c1	ZINC000450979169	GE	On-Demand	Anodyne	AKR1C3	24	40
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)[C@H]4CCCO4)CC3)ccc2c1	ZINC000450979170	GE	On-Demand	Anodyne	TRY2_BOVIN	31	40
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)[C@H]4CCCO4)CC3)ccc2c1	ZINC000450979170	GE	On-Demand	Anodyne	AKR1C3	24	40
CC(C)(C(=O)Nc1ccc(OC2COC2)cc1)C1CCC1	ZINC000450979171	CG	On-Demand	Anodyne	EPHX2	36	41
CCc1cc(CCCN2CCC(CNS(C)(=O)=O)CC2)on1	ZINC000450979200	ED	On-Demand	Anodyne	HTR4	41	36
CC(C)CCC(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450979212	CD	On-Demand	Anodyne	SCARB1	43	33
CCOC(=O)C(C)(C)C1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450979213	EF	On-Demand	Anodyne	VACHT_TETCF	0	46
CCOC(=O)C(C)(C)C1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450979213	EF	On-Demand	Anodyne	AMY2	48	34
CCOC(=O)C(C)(C)C1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450979213	EF	On-Demand	Anodyne	ABCB1	51	44
CCOC(=O)C(C)(C)C1CCN(C[C@H](O)Cc2ccccc2)CC1	ZINC000450979213	EF	On-Demand	Anodyne	CYP2J2	47	34
Cn1c(CNC(=O)[C@@H](O)C2CCC2)nc2cccc(Cl)c21	ZINC000450979214	DE	On-Demand	Anodyne	SMO	40	37
Cn1c(CNC(=O)[C@H](O)C2CCC2)nc2cccc(Cl)c21	ZINC000450979215	DE	On-Demand	Anodyne	SMO	40	37
CC[C@@H](NCc1ccccc1OC1CC1)c1ccc(OC)c(OC)c1	ZINC000450979216	EI	On-Demand	Anodyne	PDE4A	35	43
CC[C@@H](NCc1ccccc1OC1CC1)c1ccc(OC)c(OC)c1	ZINC000450979216	EI	On-Demand	Anodyne	PDE4B	16	42
CC[C@H](NCc1ccccc1OC1CC1)c1ccc(OC)c(OC)c1	ZINC000450979217	EI	On-Demand	Anodyne	PDE4A	35	43
CC[C@H](NCc1ccccc1OC1CC1)c1ccc(OC)c(OC)c1	ZINC000450979217	EI	On-Demand	Anodyne	PDE4B	16	42
Cc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc(C)c1O	ZINC000450979228	DG	On-Demand	Anodyne	INHA	22	40
Cc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)cc(C)c1O	ZINC000450979228	DG	On-Demand	Anodyne	EPHX2	32	44
Cc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc(C)c1O	ZINC000450979229	DG	On-Demand	Anodyne	INHA	22	40
Cc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)cc(C)c1O	ZINC000450979229	DG	On-Demand	Anodyne	EPHX2	32	44
COc1cc(CC(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)ccc1O	ZINC000450979251	GH	On-Demand	Anodyne	TRPV1	44	56
COc1cc(CC(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)ccc1O	ZINC000450979251	GH	On-Demand	Anodyne	KCNA3	48	41
COc1cc(CC(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)ccc1O	ZINC000450979251	GH	On-Demand	Anodyne	PPARD	21	41
COc1cc(CC(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)ccc1O	ZINC000450979251	GH	On-Demand	Anodyne	NCE103	25	41
COc1cc(CC(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)ccc1O	ZINC000450979251	GH	On-Demand	Anodyne	ACAT	0	45
COc1cc(CC(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)ccc1O	ZINC000450979251	GH	On-Demand	Anodyne	CAN2	0	41
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450979264	GD	On-Demand	Anodyne	FKBP1A	87	54
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450979264	GD	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450979264	GD	On-Demand	Anodyne	MIP	0	54
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450979265	GD	On-Demand	Anodyne	FKBP1A	87	54
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450979265	GD	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450979265	GD	On-Demand	Anodyne	MIP	0	54
CC[C@@H](CO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450979266	CF	On-Demand	Anodyne	MC3R	0	43
CC[C@@H](CO)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450979266	CF	On-Demand	Anodyne	MC5R	0	43
CC[C@@H](CO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450979268	CF	On-Demand	Anodyne	MC3R	0	43
CC[C@@H](CO)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450979268	CF	On-Demand	Anodyne	MC5R	0	43
CC[C@@H](CO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450979270	CF	On-Demand	Anodyne	MC3R	0	43
CC[C@@H](CO)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450979270	CF	On-Demand	Anodyne	MC5R	0	43
CC[C@@H](CO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450979271	CF	On-Demand	Anodyne	MC3R	0	43
CC[C@@H](CO)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450979271	CF	On-Demand	Anodyne	MC5R	0	43
COC1(CNC(=O)Cc2scnc2-c2ccccc2)CCCCC1	ZINC000450979276	EH	On-Demand	Anodyne	HCN1	50	32
COC1(CNC(=O)Cc2scnc2-c2ccccc2)CCCCC1	ZINC000450979276	EH	On-Demand	Anodyne	HCN4	48	32
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	FKBP1A	93	56
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	CTRA_BOVIN	52	30
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	PREP	48	43
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	CELA2A	40	30
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	CAPN1	24	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	SLC12A5	61	36
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979293	FD	On-Demand	Anodyne	MIP	0	50
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	FKBP1A	93	56
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	CTRA_BOVIN	52	30
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	PREP	48	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	CELA2A	40	30
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	CAPN1	24	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	SLC12A5	61	36
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)CCOCc1ccccc1	ZINC000450979295	FD	On-Demand	Anodyne	MIP	0	50
CCOc1ccc([C@@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)cc1	ZINC000450979301	GD	On-Demand	Anodyne	COLA	116	39
CCOc1ccc([C@@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)cc1	ZINC000450979301	GD	On-Demand	Anodyne	CPT1A	110	39
CCOc1ccc([C@@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)cc1	ZINC000450979301	GD	On-Demand	Anodyne	SCARB1	45	35
CCOc1ccc([C@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)cc1	ZINC000450979302	GD	On-Demand	Anodyne	COLA	116	39
CCOc1ccc([C@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)cc1	ZINC000450979302	GD	On-Demand	Anodyne	CPT1A	110	39
CCOc1ccc([C@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)cc1	ZINC000450979302	GD	On-Demand	Anodyne	SCARB1	45	35
CC(C)[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450979303	DH	On-Demand	Anodyne	P2RY12	44	33
CC(C)[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450979303	DH	On-Demand	Anodyne	HPGD	15	47
CC(C)[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450979304	DH	On-Demand	Anodyne	P2RY12	44	33
CC(C)[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)nn2C)C1	ZINC000450979304	DH	On-Demand	Anodyne	HPGD	15	47
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450979306	FF	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450979307	FF	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450979308	FF	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450979309	FF	On-Demand	Anodyne	FKBP12.6	0	43
O=C(Cn1nnc(-c2ccncn2)n1)NCCCOC1CCCCC1	ZINC000450979319	EC	On-Demand	Anodyne	SCARB1	48	36
O=S(=O)(CCOCc1ccccc1)NCC1(N2CCOCC2)CCCCC1	ZINC000450979333	GE	On-Demand	Anodyne	HCN1	57	33
O=S(=O)(CCOCc1ccccc1)NCC1(N2CCOCC2)CCCCC1	ZINC000450979333	GE	On-Demand	Anodyne	HCN4	49	32
C[C@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979347	DF	On-Demand	Anodyne	SLC6A3	16	51
C[C@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979347	DF	On-Demand	Anodyne	SLC18A2	22	40
C[C@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979347	DF	On-Demand	Anodyne	GRIN2B	32	42
C[C@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979347	DF	On-Demand	Anodyne	GALR1	45	33
C[C@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979347	DF	On-Demand	Anodyne	GRIN2C	16	41
C[C@@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979348	DF	On-Demand	Anodyne	SLC6A3	16	51
C[C@@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979348	DF	On-Demand	Anodyne	SLC18A2	22	40
C[C@@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979348	DF	On-Demand	Anodyne	GRIN2B	32	42
C[C@@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979348	DF	On-Demand	Anodyne	GALR1	45	33
C[C@@H](CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)S(C)(=O)=O	ZINC000450979348	DF	On-Demand	Anodyne	GRIN2C	16	41
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2C[C@@H](C)C[C@H](C)C2)c1	ZINC000450979360	GH	On-Demand	Anodyne	CCR8	56	34
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	ZINC000450979361	GH	On-Demand	Anodyne	CCR8	56	34
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2C[C@H](C)C[C@@H](C)C2)c1	ZINC000450979362	GH	On-Demand	Anodyne	CCR8	56	34
COC(=O)CCCNS(=O)(=O)c1cccc(C)c1Cl	ZINC000450979368	DD	On-Demand	Anodyne	ABG	0	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	ACE	34	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	MME	80	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	ANPEP	50	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	FCER2	53	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	BMP1	37	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	PAPA1_CARPA	50	38
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	CPA1	26	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	CAPNS1	47	33
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	CAPN1	48	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	CAPN2	46	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	ACE2	62	40
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	FPR1	42	34
CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979373	FH	On-Demand	Anodyne	AMP1_PLAFQ	56	35
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	ACE	34	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	MME	80	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	ANPEP	50	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	FCER2	53	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	BMP1	37	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	PAPA1_CARPA	50	38
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	CPA1	26	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	CAPNS1	47	33
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	CAPN1	48	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	CAPN2	46	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	ACE2	62	40
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	FPR1	42	34
CO[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Br)s1	ZINC000450979374	FH	On-Demand	Anodyne	AMP1_PLAFQ	56	35
Cc1ccc(NC(=O)C(C)C)cc1NS(=O)(=O)c1sccc1F	ZINC000450979379	FH	On-Demand	Anodyne	LEF	57	35
Cc1nc(N2CCOCC2)ccc1NS(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450979394	GF	On-Demand	Anodyne	PIK3CB	48	35
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	CA2	21	51
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	ADRB1	15	45
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	CA1	23	42
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	CA4	23	44
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	CA12	15	51
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	CA9	18	51
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	LEF	53	34
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	IDO1	34	43
CC(=O)Nc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1C	ZINC000450979399	GG	On-Demand	Anodyne	PFK	0	41
Cc1nc([C@H]2CCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)cs1	ZINC000450979400	GH	On-Demand	Anodyne	ADAM17	33	41
Cc1nc([C@H]2CCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)cs1	ZINC000450979400	GH	On-Demand	Anodyne	COLA	64	41
Cc1nc([C@H]2CCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)cs1	ZINC000450979400	GH	On-Demand	Anodyne	CPT1A	63	41
Cc1nc([C@H]2CCCN2C(=O)CNC(=O)Nc2cccc(Cl)c2)cs1	ZINC000450979400	GH	On-Demand	Anodyne	GRM5	19	49
CC(=O)NC[C@H](CC(=O)N1CCC[C@@H](C(C)C)C1)CC(C)C	ZINC000450979407	DG	On-Demand	Anodyne	RIR1_HHV11	47	33
CC(=O)NC[C@H](CC(=O)N1CCC[C@H](C(C)C)C1)CC(C)C	ZINC000450979408	DG	On-Demand	Anodyne	RIR1_HHV11	47	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)[nH]n2)cc1	ZINC000450979409	GF	On-Demand	Anodyne	PPIA	25	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)[nH]n2)cc1	ZINC000450979409	GF	On-Demand	Anodyne	PFK	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)[nH]n2)cc1	ZINC000450979409	GF	On-Demand	Anodyne	AADAC	0	44
c1ccc(CN2CC[C@H](N3CCN(C[C@H]4COCCO4)CC3)C2)cc1	ZINC000450979410	ED	On-Demand	Anodyne	DRD3	0	40
c1ccc(CN2CC[C@@H](N3CCN(C[C@H]4COCCO4)CC3)C2)cc1	ZINC000450979411	ED	On-Demand	Anodyne	DRD3	0	40
c1ccc(CN2CC[C@H](N3CCN(C[C@@H]4COCCO4)CC3)C2)cc1	ZINC000450979412	ED	On-Demand	Anodyne	DRD3	0	40
c1ccc(CN2CC[C@@H](N3CCN(C[C@@H]4COCCO4)CC3)C2)cc1	ZINC000450979413	ED	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1coc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450979426	FF	On-Demand	Anodyne	SIGMAR1	31	40
COC(=O)c1coc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450979427	FF	On-Demand	Anodyne	SIGMAR1	31	40
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2cn[nH]c2)c(F)c1	ZINC000450979434	FD	On-Demand	Anodyne	SGK1	41	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1	ZINC000450979437	GD	On-Demand	Anodyne	CA2	17	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1	ZINC000450979437	GD	On-Demand	Anodyne	ADRB2	16	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1	ZINC000450979437	GD	On-Demand	Anodyne	CA1	20	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1	ZINC000450979437	GD	On-Demand	Anodyne	CA4	20	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1	ZINC000450979437	GD	On-Demand	Anodyne	GRM4	18	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1	ZINC000450979437	GD	On-Demand	Anodyne	CA12	18	41
COC(=O)C1(CN(C)C2C[C@@H]3CC[C@H](C2)N3C)CC1	ZINC000450979439	CD	On-Demand	Anodyne	GLRA1	45	35
COC(=O)CCCNS(=O)(=O)c1cc(Cl)ccc1OCCC1CC1	ZINC000450979450	GF	On-Demand	Anodyne	PTGDR2	28	40
COC(=O)CCCNS(=O)(=O)c1cnn(-c2ccccc2OC)c1	ZINC000450979470	FD	On-Demand	Anodyne	HTR1A	26	45
COC(=O)CCCNS(=O)(=O)c1cnn(-c2ccccc2OC)c1	ZINC000450979470	FD	On-Demand	Anodyne	DRD2	23	45
COC(=O)CCCNS(=O)(=O)c1cnn(-c2ccccc2OC)c1	ZINC000450979470	FD	On-Demand	Anodyne	DRD1	0	45
COC(=O)CCCNS(=O)(=O)c1cnn(-c2ccccc2OC)c1	ZINC000450979470	FD	On-Demand	Anodyne	DRD3	33	43
COC(=O)CCCNS(=O)(=O)c1cnn(-c2ccccc2OC)c1	ZINC000450979470	FD	On-Demand	Anodyne	HTR7	29	45
COC(=O)CCCNS(=O)(=O)c1cnn(-c2ccccc2OC)c1	ZINC000450979470	FD	On-Demand	Anodyne	IAP	0	40
O=S(=O)(Nc1cc(C2CCOCC2)[nH]n1)c1sccc1F	ZINC000450979471	EE	On-Demand	Anodyne	PKNB	61	36
O=C(Cn1nnc(-c2ccncn2)n1)NCCOc1ccc2c(c1)OCO2	ZINC000450979510	FC	On-Demand	Anodyne	NOS2	75	33
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@H]1COCCO1	ZINC000450979518	ED	On-Demand	Anodyne	SIGMAR1	60	43
CN(CCN1CCN(Cc2ccccc2)CC1)C[C@@H]1COCCO1	ZINC000450979519	ED	On-Demand	Anodyne	SIGMAR1	60	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979520	FC	On-Demand	Anodyne	FKBP1A	73	46
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979520	FC	On-Demand	Anodyne	MMP13	26	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979520	FC	On-Demand	Anodyne	MMP3	26	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979520	FC	On-Demand	Anodyne	MMP7	42	43
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979521	FC	On-Demand	Anodyne	FKBP1A	73	46
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979521	FC	On-Demand	Anodyne	MMP13	26	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979521	FC	On-Demand	Anodyne	MMP3	26	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979521	FC	On-Demand	Anodyne	MMP7	42	43
COC(=O)CCCNS(=O)(=O)c1ccc(C(=O)C(C)C)cc1	ZINC000450979528	ED	On-Demand	Anodyne	TBXA2R	45	38
COC(=O)CCCNS(=O)(=O)c1ccc(C(=O)C(C)C)cc1	ZINC000450979528	ED	On-Demand	Anodyne	TBXAS1	34	40
COC1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450979530	CH	On-Demand	Anodyne	SLC6A9	28	41
COC1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450979530	CH	On-Demand	Anodyne	HCN1	52	33
COC1(CNC(=O)c2c(C)cccc2Cl)CCCCC1	ZINC000450979530	CH	On-Demand	Anodyne	HCN4	50	33
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)n1	ZINC000450979531	FF	On-Demand	Anodyne	CA1	20	43
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)n1	ZINC000450979531	FF	On-Demand	Anodyne	TRPV1	51	33
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)n1	ZINC000450979531	FF	On-Demand	Anodyne	CA4	15	43
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)n1	ZINC000450979531	FF	On-Demand	Anodyne	MMP2	16	43
COC(=O)CCCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1	ZINC000450979536	EE	On-Demand	Anodyne	CACNA1B	45	31
COC(=O)CCCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1	ZINC000450979536	EE	On-Demand	Anodyne	PDS	43	38
c1ccc(CC2C[C@@H]3CC[C@H](C2)N3CCc2cscn2)cc1	ZINC000450979537	DI	On-Demand	Anodyne	ACHP_LYMST	18	40
CC(=O)NCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450979538	DD	On-Demand	Anodyne	NQO2	28	47
COCCOc1cc(NS(=O)(=O)c2cccc(Cl)c2O)ccc1OC	ZINC000450979548	GF	On-Demand	Anodyne	COLA	41	44
COCCOc1cc(NS(=O)(=O)c2cccc(Cl)c2O)ccc1OC	ZINC000450979548	GF	On-Demand	Anodyne	CPT1A	43	30
COCCOc1cc(NS(=O)(=O)c2cccc(Cl)c2O)ccc1OC	ZINC000450979548	GF	On-Demand	Anodyne	CPT1B	27	44
CCN(CC(F)(F)F)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450979554	FF	On-Demand	Anodyne	AADAC	0	40
CC[C@@H](CO)NC(=O)c1ccc(Oc2ccccc2OC)cn1	ZINC000450979555	DE	On-Demand	Anodyne	PDGFRA	41	33
COc1ccc(NS(=O)(=O)c2cc(C)cs2)cc1N1CCCCC1=O	ZINC000450979568	GG	On-Demand	Anodyne	HTR6	16	42
COc1ccc(NS(=O)(=O)c2cc(C)cs2)cc1N1CCCCC1=O	ZINC000450979568	GG	On-Demand	Anodyne	GHSR	15	51
CC(C)NC(=O)c1ccccc1NS(=O)(=O)CCCCF	ZINC000450979573	DE	On-Demand	Anodyne	PRTN3	49	36
CC(C)NC(=O)c1ccccc1NS(=O)(=O)CCCCF	ZINC000450979573	DE	On-Demand	Anodyne	DAC	23	47
CC(C)NC(=O)Cc1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450979585	FF	On-Demand	Anodyne	PFK	0	40
CC[C@@H](CO)NC(=O)C(CC(C)C)CC(C)C	ZINC000450979586	BF	On-Demand	Anodyne	NPR	17	41
C[C@H]1CCCC[C@H]1OCCNC(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450979588	EC	On-Demand	Anodyne	SCARB1	45	34
C[C@H]1CCCC[C@@H]1OCCNC(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450979589	EC	On-Demand	Anodyne	SCARB1	45	34
C[C@@H]1CCCC[C@@H]1OCCNC(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450979590	EC	On-Demand	Anodyne	SCARB1	45	34
CCOC(=O)C(C)(C)C1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450979592	EG	On-Demand	Anodyne	AMY2	58	35
CCOC(=O)C(C)(C)C1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450979593	EG	On-Demand	Anodyne	AMY2	58	35
CCOC(=O)C(C)(C)C1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450979594	EG	On-Demand	Anodyne	AMY2	58	35
CCOC(=O)C(C)(C)C1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450979595	EG	On-Demand	Anodyne	AMY2	58	35
CCCc1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450979601	EF	On-Demand	Anodyne	PRTN3	52	35
Cc1cc(O)ncc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450979602	EE	On-Demand	Anodyne	LEF	47	34
O=C(COc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1)NC1CC1	ZINC000450979606	GD	On-Demand	Anodyne	OXTR	31	41
O=C(COc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1)NC1CC1	ZINC000450979606	GD	On-Demand	Anodyne	LUXN	0	48
O=C(COc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1)NC1CC1	ZINC000450979606	GD	On-Demand	Anodyne	ADIPOR1	0	46
O=C(COc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1)NC1CC1	ZINC000450979606	GD	On-Demand	Anodyne	ADIPOR2	0	46
COc1ccc(CNC(=O)CCNC2(C(F)F)CCCCC2)c(OC)c1	ZINC000450979615	FG	On-Demand	Anodyne	MTNR1A	50	36
CC[C@@H](NCc1nc(C(=O)OC)cs1)c1ccc(OC)c(OC)c1	ZINC000450979616	FG	On-Demand	Anodyne	ENPP1	50	32
CC[C@H](NCc1nc(C(=O)OC)cs1)c1ccc(OC)c(OC)c1	ZINC000450979617	FG	On-Demand	Anodyne	ENPP1	50	32
CC(F)(F)C(C)(C)C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450979618	CG	On-Demand	Anodyne	EPHX2	22	42
CCOc1cc(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)on1	ZINC000450979621	FH	On-Demand	Anodyne	ACAT	0	44
CCn1cc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450979625	GD	On-Demand	Anodyne	MTNN	65	32
CS(=O)(=O)NCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450979635	GD	On-Demand	Anodyne	DRD2	0	41
CS(=O)(=O)NCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450979635	GD	On-Demand	Anodyne	ACHE	47	42
CS(=O)(=O)NCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450979635	GD	On-Demand	Anodyne	HTR4	35	41
CS(=O)(=O)NCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450979635	GD	On-Demand	Anodyne	GRIN2B	27	40
CS(=O)(=O)NCC1CCN(Cc2ccn(CCc3ccccc3)n2)CC1	ZINC000450979635	GD	On-Demand	Anodyne	SIGMAR1	50	41
Cc1cc(N2CCOCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450979657	FF	On-Demand	Anodyne	GHSR	0	41
Cc1cc(N2CCOCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450979657	FF	On-Demand	Anodyne	TTK	0	42
Cc1ccncc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450979660	EF	On-Demand	Anodyne	ADRB2	15	41
Cc1ccncc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450979660	EF	On-Demand	Anodyne	GRM4	19	42
CCn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450979662	EE	On-Demand	Anodyne	ADRB2	30	43
CCn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450979662	EE	On-Demand	Anodyne	CA1	22	41
CCn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450979662	EE	On-Demand	Anodyne	NAMPT	31	40
COC(=O)CCCNS(=O)(=O)CC1Cc2ccccc2C1	ZINC000450979678	DD	On-Demand	Anodyne	NPY1R	40	36
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc2ccccc2c1F	ZINC000450979679	EE	On-Demand	Anodyne	FKBP1A	38	42
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc2ccccc2c1F	ZINC000450979680	EE	On-Demand	Anodyne	FKBP1A	38	42
Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450979697	GD	On-Demand	Anodyne	MTNN	83	44
COC(=O)CCCNS(=O)(=O)c1ccc(C(=O)N2CCCC2)c(F)c1	ZINC000450979700	FD	On-Demand	Anodyne	SLC6A9	27	41
Cc1conc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450979708	DE	On-Demand	Anodyne	PFK	0	43
COC(=O)c1ncccc1S(=O)(=O)Nc1cc(NC(=O)C(C)C)ccc1C	ZINC000450979724	GF	On-Demand	Anodyne	GRM4	24	45
Cc1csc(S(=O)(=O)Nc2cc(NC(=O)C3CC3)ccc2C)c1	ZINC000450979730	FH	On-Demand	Anodyne	EPHX2	26	42
COC[C@@]1(C(=O)NCCc2cn(C)c3cc(C)ccc23)CCOC1	ZINC000450979743	EE	On-Demand	Anodyne	MTNR1A	19	44
COC[C@]1(C(=O)NCCc2cn(C)c3cc(C)ccc23)CCOC1	ZINC000450979744	EE	On-Demand	Anodyne	MTNR1A	19	44
COC(=O)c1ccc(CN2CCCCC[C@@H]2C[C@H](C)O)cc1Cl	ZINC000450979758	EH	On-Demand	Anodyne	DRD2	42	39
COC(=O)c1ccc(CN2CCCCC[C@@H]2C[C@H](C)O)cc1Cl	ZINC000450979758	EH	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CCCCC[C@@H]2C[C@H](C)O)cc1Cl	ZINC000450979758	EH	On-Demand	Anodyne	OPRK1	34	44
COC(=O)c1ccc(CN2CCCCC[C@H]2C[C@@H](C)O)cc1Cl	ZINC000450979759	EH	On-Demand	Anodyne	DRD2	42	39
COC(=O)c1ccc(CN2CCCCC[C@H]2C[C@@H](C)O)cc1Cl	ZINC000450979759	EH	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CCCCC[C@H]2C[C@@H](C)O)cc1Cl	ZINC000450979759	EH	On-Demand	Anodyne	OPRK1	34	44
COC(=O)c1ccc(CN2CCCCC[C@@H]2C[C@@H](C)O)cc1Cl	ZINC000450979760	EH	On-Demand	Anodyne	DRD2	42	39
COC(=O)c1ccc(CN2CCCCC[C@@H]2C[C@@H](C)O)cc1Cl	ZINC000450979760	EH	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CCCCC[C@@H]2C[C@@H](C)O)cc1Cl	ZINC000450979760	EH	On-Demand	Anodyne	OPRK1	34	44
COC(=O)c1ccc(CN2CCCCC[C@H]2C[C@H](C)O)cc1Cl	ZINC000450979761	EH	On-Demand	Anodyne	DRD2	42	39
COC(=O)c1ccc(CN2CCCCC[C@H]2C[C@H](C)O)cc1Cl	ZINC000450979761	EH	On-Demand	Anodyne	DRD3	0	40
COC(=O)c1ccc(CN2CCCCC[C@H]2C[C@H](C)O)cc1Cl	ZINC000450979761	EH	On-Demand	Anodyne	OPRK1	34	44
COC(=O)CCCNS(=O)(=O)c1cnn(-c2cc(Cl)ccc2OC)c1	ZINC000450979763	GD	On-Demand	Anodyne	TBXAS1	27	43
COC(=O)CCCNS(=O)(=O)c1cnn(-c2cc(Cl)ccc2OC)c1	ZINC000450979763	GD	On-Demand	Anodyne	CPT1A	46	33
Cc1ccc2c(CCNC(=O)Cc3ccc(O)c(F)c3)cn(C)c2c1	ZINC000450979764	EG	On-Demand	Anodyne	NQO2	16	42
C[C@@H]1CCCC[C@H]1OCCNC(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450979767	EC	On-Demand	Anodyne	SCARB1	45	34
CCN(Cc1cccc(NS(=O)(=O)c2cc(C)cs2)c1)C(C)=O	ZINC000450979787	FG	On-Demand	Anodyne	LIMK2	31	42
CC[C@@H](C(=O)OC)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450979789	EE	On-Demand	Anodyne	DRD4	28	40
CC[C@@H](C(=O)OC)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450979789	EE	On-Demand	Anodyne	HTR4	52	33
CC[C@H](C(=O)OC)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450979790	EE	On-Demand	Anodyne	DRD4	28	40
CC[C@H](C(=O)OC)N1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450979790	EE	On-Demand	Anodyne	HTR4	52	33
COC(=O)CCCNS(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1	ZINC000450979793	FF	On-Demand	Anodyne	TBXAS1	28	41
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	BMP1	53	39
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	MMP13	44	49
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	ADAM17	36	47
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	MMP2	20	49
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	MMP3	30	52
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	MMP8	21	49
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	SLC6A5	15	40
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	MMP9	38	49
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	MMP12	21	49
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	MMP1	39	47
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	NAMPT	41	41
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	LUXN	0	42
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	ADIPOR1	0	43
CN(Cc1cccnc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450979837	GD	On-Demand	Anodyne	ADIPOR2	0	43
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@H]2C(=O)OCC)cc1	ZINC000450979847	GE	On-Demand	Anodyne	FKBP1A	64	54
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@H]2C(=O)OCC)cc1	ZINC000450979847	GE	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@H]2C(=O)OCC)cc1	ZINC000450979847	GE	On-Demand	Anodyne	Q4Q5W4_LEIMA	19	42
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@H]2C(=O)OCC)cc1	ZINC000450979847	GE	On-Demand	Anodyne	MIP	0	50
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@H]2C(=O)OCC)cc1	ZINC000450979847	GE	On-Demand	Anodyne	TMPRSS11D	45	33
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@@H]2C(=O)OCC)cc1	ZINC000450979848	GE	On-Demand	Anodyne	FKBP1A	64	54
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@@H]2C(=O)OCC)cc1	ZINC000450979848	GE	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@@H]2C(=O)OCC)cc1	ZINC000450979848	GE	On-Demand	Anodyne	Q4Q5W4_LEIMA	19	42
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@@H]2C(=O)OCC)cc1	ZINC000450979848	GE	On-Demand	Anodyne	MIP	0	50
CCOC(=O)c1ccc(CS(=O)(=O)N2CCCC[C@@H]2C(=O)OCC)cc1	ZINC000450979848	GE	On-Demand	Anodyne	TMPRSS11D	45	33
CS(=O)(=O)NCC1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450979876	FF	On-Demand	Anodyne	HTR4	40	40
CS(=O)(=O)NCC1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450979876	FF	On-Demand	Anodyne	HTR7	17	44
CS(=O)(=O)NCC1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450979876	FF	On-Demand	Anodyne	HTR6	18	44
CS(=O)(=O)NCC1CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450979876	FF	On-Demand	Anodyne	CACNA1I	54	38
Cc1cc(NC(=O)[C@H](C)OCCc2ccccc2)cc(C)c1O	ZINC000450979880	DH	On-Demand	Anodyne	MMP3	40	37
Cc1cc(NC(=O)[C@@H](C)OCCc2ccccc2)cc(C)c1O	ZINC000450979881	DH	On-Demand	Anodyne	MMP3	40	37
O=S(=O)(NCC1CC1)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450979886	GE	On-Demand	Anodyne	NPY2R	67	45
O=S(=O)(NCC1CC1)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450979886	GE	On-Demand	Anodyne	NPY5R	22	45
O=S(=O)(c1ccc(C2CC2)cc1)N1CCC[C@@H](C(F)(F)F)C1	ZINC000450979891	EH	On-Demand	Anodyne	AKR1C3	30	43
O=S(=O)(c1ccc(C2CC2)cc1)N1CCC[C@H](C(F)(F)F)C1	ZINC000450979892	EH	On-Demand	Anodyne	AKR1C3	30	43
CCOC(=O)COc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450979899	GG	On-Demand	Anodyne	ALPL	17	40
CCOC(=O)COc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450979899	GG	On-Demand	Anodyne	GPR119	27	50
CCOC(=O)COc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450979899	GG	On-Demand	Anodyne	LIMK2	28	43
COC(=O)CCCNS(=O)(=O)c1ccc(C(=O)N(C)C)cc1	ZINC000450979909	EC	On-Demand	Anodyne	LIMK2	44	38
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450979913	GF	On-Demand	Anodyne	CA1	15	45
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450979913	GF	On-Demand	Anodyne	CA4	29	45
C[C@@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450979925	GH	On-Demand	Anodyne	CYP2J2	47	33
C[C@@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450979925	GH	On-Demand	Anodyne	L3MBTL3	57	34
C[C@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450979926	GH	On-Demand	Anodyne	CYP2J2	47	33
C[C@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450979926	GH	On-Demand	Anodyne	L3MBTL3	57	34
C[C@@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450979927	GH	On-Demand	Anodyne	CYP2J2	47	33
C[C@@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450979927	GH	On-Demand	Anodyne	L3MBTL3	57	34
C[C@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450979929	GH	On-Demand	Anodyne	CYP2J2	47	33
C[C@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(Br)cc1	ZINC000450979929	GH	On-Demand	Anodyne	L3MBTL3	57	34
FC(F)(F)c1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450979933	DH	On-Demand	Anodyne	LTA4H	41	54
FC(F)(F)c1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450979933	DH	On-Demand	Anodyne	HRH3	15	43
FC(F)(F)c1ccc(OCCn2cnc3c2CCCC3)cc1	ZINC000450979933	DH	On-Demand	Anodyne	PSMB1	37	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc3oc(C4CC4)nc3c2)cc1	ZINC000450979936	GI	On-Demand	Anodyne	MMP13	18	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450979963	ED	On-Demand	Anodyne	OPRK1	0	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450979963	ED	On-Demand	Anodyne	HTR4	51	46
COC(=O)CCCNS(=O)(=O)c1ccc(C#N)cc1Cl	ZINC000450979965	DD	On-Demand	Mild	TRPV4	33	40
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450979966	ED	On-Demand	Anodyne	OPRK1	0	41
C[C@H](c1ccccc1)[C@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450979966	ED	On-Demand	Anodyne	HTR4	51	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450979967	ED	On-Demand	Anodyne	OPRK1	0	41
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450979967	ED	On-Demand	Anodyne	HTR4	51	46
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450979968	ED	On-Demand	Anodyne	OPRK1	0	41
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450979968	ED	On-Demand	Anodyne	HTR4	51	46
Cc1ccc(C(=O)Nc2cc(C)c(O)c(C)c2)c(C(C)C)n1	ZINC000450979990	CI	On-Demand	Anodyne	Q25615_ONCVO	43	33
O=C(CCCN1CCOc2cc(O)ccc2C1)c1ccc(F)cc1	ZINC000450979997	EG	On-Demand	Anodyne	DRD2	32	44
O=C(CCCN1CCOc2cc(O)ccc2C1)c1ccc(F)cc1	ZINC000450979997	EG	On-Demand	Anodyne	DRD4	0	47
O=C(CCCN1CCOc2cc(O)ccc2C1)c1ccc(F)cc1	ZINC000450979997	EG	On-Demand	Anodyne	SLC18A3	0	49
O=C(CCCN1CCOc2cc(O)ccc2C1)c1ccc(F)cc1	ZINC000450979997	EG	On-Demand	Anodyne	CYP2J2	51	36
COC(=O)CCCNS(=O)(=O)c1ccc(CC(F)(F)F)cc1	ZINC000450980011	EE	On-Demand	Anodyne	TBXA2R	49	35
COC(=O)CCCNS(=O)(=O)c1ccc(CC(F)(F)F)cc1	ZINC000450980011	EE	On-Demand	Anodyne	TBXAS1	31	41
COC(=O)CCCNS(=O)(=O)c1ccc(CC(F)(F)F)cc1	ZINC000450980011	EE	On-Demand	Anodyne	PTPRB	47	43
CCCOc1ccc(C(=O)Nc2ccc(OC3COC3)cc2)c(OC)c1	ZINC000450980013	FH	On-Demand	Anodyne	KCNK3	43	39
COc1ccc(CNC(=O)CCN[C@@H](c2nncn2C)C(C)C)c(OC)c1	ZINC000450980019	GD	On-Demand	Anodyne	MTNR1A	42	40
COc1ccc(CNC(=O)CCN[C@@H](c2nncn2C)C(C)C)c(OC)c1	ZINC000450980019	GD	On-Demand	Anodyne	MTNR1B	27	40
COc1ccc(CNC(=O)CCN[C@H](c2nncn2C)C(C)C)c(OC)c1	ZINC000450980020	GD	On-Demand	Anodyne	MTNR1A	42	40
COc1ccc(CNC(=O)CCN[C@H](c2nncn2C)C(C)C)c(OC)c1	ZINC000450980020	GD	On-Demand	Anodyne	MTNR1B	27	40
CO[C@H](Cc1ccccc1)CN1CCCCC[C@@H]1C[C@@H](C)O	ZINC000450980022	DG	On-Demand	Anodyne	SLC18A2	65	36
CO[C@H](Cc1ccccc1)CN1CCCCC[C@@H]1C[C@@H](C)O	ZINC000450980022	DG	On-Demand	Anodyne	PGC	44	31
CO[C@H](Cc1ccccc1)CN1CCCCC[C@H]1C[C@@H](C)O	ZINC000450980023	DG	On-Demand	Anodyne	SLC18A2	65	36
CO[C@H](Cc1ccccc1)CN1CCCCC[C@H]1C[C@@H](C)O	ZINC000450980023	DG	On-Demand	Anodyne	PGC	44	31
CO[C@H](Cc1ccccc1)CN1CCCCC[C@@H]1C[C@H](C)O	ZINC000450980024	DG	On-Demand	Anodyne	SLC18A2	65	36
CO[C@H](Cc1ccccc1)CN1CCCCC[C@@H]1C[C@H](C)O	ZINC000450980024	DG	On-Demand	Anodyne	PGC	44	31
CO[C@H](Cc1ccccc1)CN1CCCCC[C@H]1C[C@H](C)O	ZINC000450980025	DG	On-Demand	Anodyne	SLC18A2	65	36
CO[C@H](Cc1ccccc1)CN1CCCCC[C@H]1C[C@H](C)O	ZINC000450980025	DG	On-Demand	Anodyne	PGC	44	31
C[C@H](O)C[C@@H]1CCCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450980026	DG	On-Demand	Anodyne	SLC18A2	55	40
C[C@H](O)C[C@@H]1CCCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450980027	DG	On-Demand	Anodyne	SLC18A2	55	40
C[C@H](O)C[C@@H]1CCCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450980028	DG	On-Demand	Anodyne	SLC18A2	55	40
C[C@H](O)C[C@@H]1CCCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450980029	DG	On-Demand	Anodyne	SLC18A2	55	40
C1=C(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980039	EG	On-Demand	Anodyne	DRD2	0	46
C1=C(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980039	EG	On-Demand	Anodyne	DRD4	27	40
C1=C(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980039	EG	On-Demand	Anodyne	DRD3	0	43
C1=C(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980039	EG	On-Demand	Anodyne	VACHT_TETCF	0	41
C1=C(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980039	EG	On-Demand	Anodyne	SIGMAR1	55	43
C1=C(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980039	EG	On-Demand	Anodyne	CXCR3	25	42
C1=C(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980040	EG	On-Demand	Anodyne	DRD2	0	46
C1=C(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980040	EG	On-Demand	Anodyne	DRD4	27	40
C1=C(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980040	EG	On-Demand	Anodyne	DRD3	0	43
C1=C(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980040	EG	On-Demand	Anodyne	VACHT_TETCF	0	41
C1=C(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980040	EG	On-Demand	Anodyne	SIGMAR1	55	43
C1=C(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450980040	EG	On-Demand	Anodyne	CXCR3	25	42
CCNC(=O)c1ccc(C)c(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450980047	EF	On-Demand	Anodyne	ITGAV	40	36
CCNC(=O)c1ccc(C)c(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450980047	EF	On-Demand	Anodyne	PTGDR2	16	42
CCc1cc(CCCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)on1	ZINC000450980050	GG	On-Demand	Anodyne	DRD2	17	40
CCc1cc(CCCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)on1	ZINC000450980050	GG	On-Demand	Anodyne	DRD4	40	40
CCc1cc(CCCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)on1	ZINC000450980050	GG	On-Demand	Anodyne	DRD3	18	40
CCc1cc(CCCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)on1	ZINC000450980050	GG	On-Demand	Anodyne	SIGMAR1	52	43
CCc1cc(CCCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)on1	ZINC000450980051	GG	On-Demand	Anodyne	DRD2	17	40
CCc1cc(CCCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)on1	ZINC000450980051	GG	On-Demand	Anodyne	DRD4	40	40
CCc1cc(CCCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)on1	ZINC000450980051	GG	On-Demand	Anodyne	DRD3	18	40
CCc1cc(CCCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)on1	ZINC000450980051	GG	On-Demand	Anodyne	SIGMAR1	52	43
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	CHRM2	15	43
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	DRD2	36	54
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	DRD4	77	51
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	ACHE	26	49
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	HTR2A	20	54
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	SLC6A1	24	46
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	SLC6A4	24	54
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	DRD3	30	46
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	SLC6A3	30	54
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	VACHT_TETCF	0	43
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	HRH3	23	43
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	SIGMAR1	100	54
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	PRCP	16	43
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	SLC18A3	27	43
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	EBP	16	43
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	CXCR3	27	47
Clc1ccc(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980063	GH	On-Demand	Anodyne	L3MBTL3	41	43
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	CHRM2	15	43
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	DRD2	36	54
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	DRD4	77	51
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	ACHE	26	49
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	HTR2A	20	54
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	SLC6A1	24	46
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	SLC6A4	24	54
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	DRD3	30	46
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	SLC6A3	30	54
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	VACHT_TETCF	0	43
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	HRH3	23	43
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	SIGMAR1	100	54
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	PRCP	16	43
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	SLC18A3	27	43
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	EBP	16	43
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	CXCR3	27	47
Clc1ccc(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980064	GH	On-Demand	Anodyne	L3MBTL3	41	43
O=C(Cn1nnc(-c2ccncn2)n1)NC[C@H]1Cc2ccccc2O1	ZINC000450980067	EC	On-Demand	Anodyne	SCARB1	46	37
O=C(Cn1nnc(-c2ccncn2)n1)NC[C@@H]1Cc2ccccc2O1	ZINC000450980068	EC	On-Demand	Anodyne	SCARB1	46	37
CCOC(C)(C)CNC(=O)c1cccc(CC)n1	ZINC000450980069	CE	On-Demand	Anodyne	PDE5A	25	40
CCN1CCN(CCCC(=O)c2ccc(Br)cc2)[C@@H](C)C1	ZINC000450980075	FG	On-Demand	Anodyne	CYP2J2	54	40
CCN1CCN(CCCC(=O)c2ccc(Br)cc2)[C@H](C)C1	ZINC000450980076	FG	On-Demand	Anodyne	CYP2J2	54	40
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1sccc1Cl	ZINC000450980084	EF	On-Demand	Anodyne	FKBP12.6	0	40
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1sccc1Cl	ZINC000450980085	EF	On-Demand	Anodyne	FKBP12.6	0	40
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000450980086	EF	On-Demand	Anodyne	KCNA5	0	54
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000450980086	EF	On-Demand	Anodyne	PRTN3	58	37
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000450980086	EF	On-Demand	Anodyne	DAC	34	54
C[C@@H](CN(C)CCN1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000450980089	FD	On-Demand	Anodyne	DRD2	18	45
C[C@@H](CN(C)CCN1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000450980089	FD	On-Demand	Anodyne	SIGMAR1	81	47
C[C@H](CN(C)CCN1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000450980090	FD	On-Demand	Anodyne	DRD2	18	45
C[C@H](CN(C)CCN1CCN(Cc2ccccc2)CC1)S(C)(=O)=O	ZINC000450980090	FD	On-Demand	Anodyne	SIGMAR1	81	47
CC[C@@H](C(=O)OC)N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450980097	ED	On-Demand	Anodyne	ACE2	47	36
CC[C@H](C(=O)OC)N1CCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC000450980098	ED	On-Demand	Anodyne	ACE2	47	36
CC[C@@H](C(=O)OC)N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450980099	ED	On-Demand	Anodyne	ACE2	47	36
CC[C@H](C(=O)OC)N1CCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC000450980100	ED	On-Demand	Anodyne	ACE2	47	36
Cc1cc(NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)c(C)c(C)c1O	ZINC000450980111	GH	On-Demand	Mild	AR	21	40
Cc1cc(NC(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)c(C)c(C)c1O	ZINC000450980111	GH	On-Demand	Mild	INHA	15	41
Cc1cc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)c(C)c(C)c1O	ZINC000450980112	GH	On-Demand	Mild	AR	21	40
Cc1cc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)c(C)c(C)c1O	ZINC000450980112	GH	On-Demand	Mild	INHA	15	41
CC(C)Cc1cc(NS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)n[nH]1	ZINC000450980115	FD	On-Demand	Anodyne	MTNN	41	32
COc1cc(CN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1Cl	ZINC000450980120	EG	On-Demand	Anodyne	DRD4	24	41
COc1cc(CN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1Cl	ZINC000450980120	EG	On-Demand	Anodyne	DRD3	0	40
COc1cc(CN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1Cl	ZINC000450980120	EG	On-Demand	Anodyne	SSTR5	49	37
COc1cc(CN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1Cl	ZINC000450980120	EG	On-Demand	Anodyne	UTS2R	36	40
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1Cl	ZINC000450980121	EG	On-Demand	Anodyne	DRD4	24	41
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1Cl	ZINC000450980121	EG	On-Demand	Anodyne	DRD3	0	40
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1Cl	ZINC000450980121	EG	On-Demand	Anodyne	SSTR5	49	37
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1Cl	ZINC000450980121	EG	On-Demand	Anodyne	UTS2R	36	40
COc1cc(CN2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1Cl	ZINC000450980122	EG	On-Demand	Anodyne	DRD4	24	41
COc1cc(CN2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1Cl	ZINC000450980122	EG	On-Demand	Anodyne	DRD3	0	40
COc1cc(CN2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1Cl	ZINC000450980122	EG	On-Demand	Anodyne	SSTR5	49	37
COc1cc(CN2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1Cl	ZINC000450980122	EG	On-Demand	Anodyne	UTS2R	36	40
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)ccc1Cl	ZINC000450980123	EG	On-Demand	Anodyne	DRD4	24	41
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)ccc1Cl	ZINC000450980123	EG	On-Demand	Anodyne	DRD3	0	40
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)ccc1Cl	ZINC000450980123	EG	On-Demand	Anodyne	SSTR5	49	37
COc1cc(CN2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)ccc1Cl	ZINC000450980123	EG	On-Demand	Anodyne	UTS2R	36	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N(C)Cc2cccnc2)c1	ZINC000450980147	FF	On-Demand	Anodyne	TBXAS1	25	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N(C)Cc2cccnc2)c1	ZINC000450980147	FF	On-Demand	Anodyne	ADAM17	16	43
CC[C@H](O)CC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450980151	FG	On-Demand	Anodyne	RBP4	59	38
CC[C@H](O)CC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450980151	FG	On-Demand	Anodyne	SCD1	28	40
CC[C@H](O)CC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450980151	FG	On-Demand	Anodyne	SCD	39	46
CC[C@@H](O)CC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450980152	FG	On-Demand	Anodyne	RBP4	59	38
CC[C@@H](O)CC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450980152	FG	On-Demand	Anodyne	SCD1	28	40
CC[C@@H](O)CC(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450980152	FG	On-Demand	Anodyne	SCD	39	46
CN(CCN1CCN(Cc2ccccc2)CC1)CC1CC(F)(F)C1	ZINC000450980162	EF	On-Demand	Anodyne	SIGMAR1	88	46
COc1cc(CC(=O)NCCc2cn(C)c3cc(C)ccc23)ccc1O	ZINC000450980167	FG	On-Demand	Anodyne	NQO2	30	42
COc1cc(CC(=O)NCCc2cn(C)c3cc(C)ccc23)ccc1O	ZINC000450980167	FG	On-Demand	Anodyne	TRPV1	31	55
COc1cc(CC(=O)NCCc2cn(C)c3cc(C)ccc23)ccc1O	ZINC000450980167	FG	On-Demand	Anodyne	MTNR1A	33	48
COc1cc(CC(=O)NCCc2cn(C)c3cc(C)ccc23)ccc1O	ZINC000450980167	FG	On-Demand	Anodyne	NCE103	28	49
COc1cc(CC(=O)NCCc2cn(C)c3cc(C)ccc23)ccc1O	ZINC000450980167	FG	On-Demand	Anodyne	P96878_MYCTU	19	49
COc1cc(CC(=O)NCCc2cn(C)c3cc(C)ccc23)ccc1O	ZINC000450980167	FG	On-Demand	Anodyne	CAN2	0	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)c3ccccc32)cc1	ZINC000450980172	FH	On-Demand	Anodyne	TGM2	48	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)c3ccccc32)cc1	ZINC000450980172	FH	On-Demand	Anodyne	F13A1	82	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)c3ccccc32)cc1	ZINC000450980173	FH	On-Demand	Anodyne	TGM2	48	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)c3ccccc32)cc1	ZINC000450980173	FH	On-Demand	Anodyne	F13A1	82	37
O=C(Cn1nnc(-c2ccncn2)n1)NCCCc1ccccc1	ZINC000450980188	DC	On-Demand	Anodyne	FAAH	21	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)c1	ZINC000450980210	FD	On-Demand	Anodyne	EPHX2	21	41
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)c1	ZINC000450980211	FD	On-Demand	Anodyne	EPHX2	21	41
c1ccc(CN2CC[C@@H](N3CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450980213	GE	On-Demand	Anodyne	DRD2	0	46
c1ccc(CN2CC[C@@H](N3CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450980213	GE	On-Demand	Anodyne	DRD4	35	46
c1ccc(CN2CC[C@@H](N3CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450980213	GE	On-Demand	Anodyne	DRD3	23	46
c1ccc(CN2CC[C@@H](N3CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450980213	GE	On-Demand	Anodyne	SIGMAR1	40	40
c1ccc(CN2CC[C@H](N3CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450980214	GE	On-Demand	Anodyne	DRD2	0	46
c1ccc(CN2CC[C@H](N3CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450980214	GE	On-Demand	Anodyne	DRD4	35	46
c1ccc(CN2CC[C@H](N3CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450980214	GE	On-Demand	Anodyne	DRD3	23	46
c1ccc(CN2CC[C@H](N3CCN(Cc4cn(CC5CC5)nn4)CC3)C2)cc1	ZINC000450980214	GE	On-Demand	Anodyne	SIGMAR1	40	40
COCc1ccccc1NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1	ZINC000450980219	GH	On-Demand	Anodyne	PRTN3	51	31
CO[C@@H](Cc1ccccc1)C(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450980225	FG	On-Demand	Anodyne	MTNR1A	24	43
CO[C@H](Cc1ccccc1)C(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450980226	FG	On-Demand	Anodyne	MTNR1A	24	43
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	CHRM2	36	43
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	CHRM1	16	40
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	DRD2	32	47
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	DRD4	82	47
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	ACHE	54	56
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	HRH1	17	40
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	OPRM1	20	42
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	DRD3	24	45
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	OPRD1	20	45
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	OPRK1	17	41
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	OPRL1	15	42
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	CHRM3	34	44
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	LTA4H	36	45
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	VACHT_TETCF	0	44
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	HRH3	33	45
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	SIGMAR1	88	49
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	BCHE	0	46
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	CCR3	55	40
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	CCR5	34	46
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	SLC18A3	38	48
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	MLNR	49	35
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	SLC6A5	19	46
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	CXCR3	39	43
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	MCHR1	37	42
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	NPFFR1	47	35
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	L3MBTL1	0	51
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	L3MBTL3	69	51
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	MBTD1	0	51
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1ccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980227	GG	On-Demand	Anodyne	ADIPOR2	0	41
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	CHRM2	36	43
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	CHRM1	16	40
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	DRD2	32	47
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	DRD4	82	47
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	ACHE	54	56
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	HRH1	17	40
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	OPRM1	20	42
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	DRD3	24	45
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	OPRD1	20	45
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	OPRK1	17	41
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	OPRL1	15	42
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	CHRM3	34	44
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	LTA4H	36	45
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	VACHT_TETCF	0	44
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	HRH3	33	45
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	SIGMAR1	88	49
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	BCHE	0	46
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	CCR3	55	40
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	CCR5	34	46
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	SLC18A3	38	48
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	MLNR	49	35
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	SLC6A5	19	46
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	CXCR3	39	43
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	MCHR1	37	42
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	NPFFR1	47	35
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	L3MBTL1	0	51
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	L3MBTL3	69	51
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	MBTD1	0	51
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	ADIPOR1	0	41
CC(=O)c1ccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cc1	ZINC000450980228	GG	On-Demand	Anodyne	ADIPOR2	0	41
N#CC1(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)CCC1	ZINC000450980235	DG	On-Demand	Mild	SIGMAR1	32	50
N#CC1(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)CCC1	ZINC000450980235	DG	On-Demand	Mild	NPFFR1	46	34
N#CC1(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)CCC1	ZINC000450980236	DG	On-Demand	Mild	SIGMAR1	32	50
N#CC1(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)CCC1	ZINC000450980236	DG	On-Demand	Mild	NPFFR1	46	34
Cc1ccc2c(CCNC(=O)CCCc3ncc(C)o3)cn(C)c2c1	ZINC000450980238	EG	On-Demand	Anodyne	MTNR1A	20	42
CN(CCc1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450980241	CG	On-Demand	Anodyne	SLC6A1	57	44
CN(CCc1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450980241	CG	On-Demand	Anodyne	SLC6A3	22	40
CN(CCc1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450980241	CG	On-Demand	Anodyne	CHRNA9	0	44
CN(CCc1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450980241	CG	On-Demand	Anodyne	CACNA1D	41	40
CCc1cc(CCCN2CCOc3cc(O)ccc3C2)on1	ZINC000450980242	DF	On-Demand	Anodyne	DRD5	15	42
NC(=O)[C@H]1CCCCN1S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450980246	ED	On-Demand	Anodyne	FKBP1A	26	45
NC(=O)[C@@H]1CCCCN1S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450980247	ED	On-Demand	Anodyne	FKBP1A	26	45
CC1(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)CCC(=O)CC1	ZINC000450980250	GI	On-Demand	Anodyne	RBP4	68	38
COC(=O)CCCNS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450980260	GC	On-Demand	Anodyne	TBXA2R	45	36
COC(=O)CCCNS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450980260	GC	On-Demand	Anodyne	TBXAS1	29	43
COC(=O)CCCNS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450980260	GC	On-Demand	Anodyne	MMP7	16	42
C(=C\c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980261	GH	On-Demand	Anodyne	DRD2	17	44
C(=C\c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980261	GH	On-Demand	Anodyne	ACHE	21	40
C(=C\c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980261	GH	On-Demand	Anodyne	DRD3	0	41
C(=C\c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980261	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
C(=C\c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980261	GH	On-Demand	Anodyne	SIGMAR1	65	52
C(=C\c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980261	GH	On-Demand	Anodyne	SLC18A3	23	41
C(=C/c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980262	GH	On-Demand	Anodyne	DRD2	17	44
C(=C/c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980262	GH	On-Demand	Anodyne	ACHE	21	40
C(=C/c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980262	GH	On-Demand	Anodyne	DRD3	0	41
C(=C/c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980262	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
C(=C/c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980262	GH	On-Demand	Anodyne	SIGMAR1	65	52
C(=C/c1ccccc1)\CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980262	GH	On-Demand	Anodyne	SLC18A3	23	41
C(=C/c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980263	GH	On-Demand	Anodyne	DRD2	17	44
C(=C/c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980263	GH	On-Demand	Anodyne	ACHE	21	40
C(=C/c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980263	GH	On-Demand	Anodyne	DRD3	0	41
C(=C/c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980263	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
C(=C/c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980263	GH	On-Demand	Anodyne	SIGMAR1	65	52
C(=C/c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980263	GH	On-Demand	Anodyne	SLC18A3	23	41
C(=C\c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980264	GH	On-Demand	Anodyne	DRD2	17	44
C(=C\c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980264	GH	On-Demand	Anodyne	ACHE	21	40
C(=C\c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980264	GH	On-Demand	Anodyne	DRD3	0	41
C(=C\c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980264	GH	On-Demand	Anodyne	VACHT_TETCF	0	41
C(=C\c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980264	GH	On-Demand	Anodyne	SIGMAR1	65	52
C(=C\c1ccccc1)\CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450980264	GH	On-Demand	Anodyne	SLC18A3	23	41
CNS(=O)(=O)c1ccc(S(=O)(=O)NCCCC(=O)OC)cc1C	ZINC000450980265	FC	On-Demand	Anodyne	LEF	51	34
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)CC(C)(C)CC#N	ZINC000450980301	GE	On-Demand	Mild	COLA	62	35
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)CC(C)(C)CC#N	ZINC000450980301	GE	On-Demand	Mild	CPT1A	60	35
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)CC(C)(C)CC#N	ZINC000450980301	GE	On-Demand	Mild	CPT1B	63	35
O=C(CC1(O)CCC1)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450980303	EG	On-Demand	Anodyne	ACAT	0	49
Cc1cccc(Cl)c1CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450980314	EE	On-Demand	Anodyne	HTR4	25	40
CC(C)NC(=O)Cc1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450980317	FG	On-Demand	Anodyne	PFK	0	42
CO[C@@H](Cc1ccccc1)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450980320	ED	On-Demand	Anodyne	HTR4	29	41
CO[C@@H](Cc1ccccc1)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450980320	ED	On-Demand	Anodyne	NPY2R	45	37
CO[C@H](Cc1ccccc1)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450980321	ED	On-Demand	Anodyne	HTR4	29	41
CO[C@H](Cc1ccccc1)CN1CCC(CNS(C)(=O)=O)CC1	ZINC000450980321	ED	On-Demand	Anodyne	NPY2R	45	37
CC[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450980328	EE	On-Demand	Anodyne	CTSV	27	40
CC[C@@H](CO)NC(=O)c1ccc(C(=O)NCc2cccc(C)c2)cc1	ZINC000450980328	EE	On-Demand	Anodyne	PIN1	28	46
O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)C1(CF)CCOCC1	ZINC000450980329	FH	On-Demand	Anodyne	ACAT	0	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C#N)C(C)(C)C)cc1	ZINC000450980333	EE	On-Demand	Mild	CA1	20	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C#N)C(C)(C)C)cc1	ZINC000450980333	EE	On-Demand	Mild	CA14	15	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C#N)C(C)(C)C)cc1	ZINC000450980333	EE	On-Demand	Mild	MMP2	18	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C#N)C(C)(C)C)cc1	ZINC000450980333	EE	On-Demand	Mild	MMP12	40	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C#N)C(C)(C)C)cc1	ZINC000450980333	EE	On-Demand	Mild	MMP7	21	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C#N)C(C)(C)C)cc1	ZINC000450980334	EE	On-Demand	Mild	CA1	20	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C#N)C(C)(C)C)cc1	ZINC000450980334	EE	On-Demand	Mild	CA14	15	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C#N)C(C)(C)C)cc1	ZINC000450980334	EE	On-Demand	Mild	MMP2	18	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C#N)C(C)(C)C)cc1	ZINC000450980334	EE	On-Demand	Mild	MMP12	40	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C#N)C(C)(C)C)cc1	ZINC000450980334	EE	On-Demand	Mild	MMP7	21	43
CC[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450980341	CD	On-Demand	Anodyne	SELE	70	38
CC[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450980341	CD	On-Demand	Anodyne	ICAM1	47	31
CC[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450980341	CD	On-Demand	Anodyne	VCAM1	44	32
CC[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450980341	CD	On-Demand	Anodyne	AKT1	54	34
CC[C@@H](CO)NC(=O)c1cc2ccncc2s1	ZINC000450980341	CD	On-Demand	Anodyne	PIN1	30	47
CCN(CC)C(=O)Cc1ccc(NS(=O)(=O)c2cc(C)cs2)cc1	ZINC000450980364	FG	On-Demand	Anodyne	PTPRB	48	34
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1cnccc1C	ZINC000450980371	GE	On-Demand	Anodyne	COLA	80	37
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1cnccc1C	ZINC000450980371	GE	On-Demand	Anodyne	CPT1A	75	37
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1cnccc1C	ZINC000450980371	GE	On-Demand	Anodyne	CPT2	40	33
COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1cnccc1C	ZINC000450980371	GE	On-Demand	Anodyne	CPT1B	73	33
COC(=O)C1(CN(C)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000450980373	ED	On-Demand	Anodyne	DRD4	46	37
COC(=O)C1(CN(C)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000450980373	ED	On-Demand	Anodyne	ACHE	33	41
COC(=O)C1(CN(C)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000450980373	ED	On-Demand	Anodyne	SIGMAR1	94	42
COC(=O)C1(CN(C)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000450980373	ED	On-Demand	Anodyne	NPFFR1	53	38
COC(=O)C1(CN(C)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000450980373	ED	On-Demand	Anodyne	SLC12A5	62	37
CNC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450980389	GF	On-Demand	Anodyne	MMP13	18	41
CNC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450980389	GF	On-Demand	Anodyne	BDKRB1	0	50
CNC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450980389	GF	On-Demand	Anodyne	GRM4	18	40
CNC(=O)c1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450980389	GF	On-Demand	Anodyne	PRTN3	56	35
CCOC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450980392	CE	On-Demand	Anodyne	MME	68	39
CCOC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450980392	CE	On-Demand	Anodyne	PAPA1_CARPA	53	38
CCOC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450980392	CE	On-Demand	Anodyne	CTSL	20	41
CCOC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450980392	CE	On-Demand	Anodyne	TIMP3	49	33
CCOC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450980392	CE	On-Demand	Anodyne	CTSS	18	41
CCOC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450980392	CE	On-Demand	Anodyne	CAPN2	44	31
CCOC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450980392	CE	On-Demand	Anodyne	ACE2	54	36
CCOC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC	ZINC000450980392	CE	On-Demand	Anodyne	AMP1_PLAFQ	49	37
CCOC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450980393	CE	On-Demand	Anodyne	MME	68	39
CCOC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450980393	CE	On-Demand	Anodyne	PAPA1_CARPA	53	38
CCOC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450980393	CE	On-Demand	Anodyne	CTSL	20	41
CCOC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450980393	CE	On-Demand	Anodyne	TIMP3	49	33
CCOC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450980393	CE	On-Demand	Anodyne	CTSS	18	41
CCOC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450980393	CE	On-Demand	Anodyne	CAPN2	44	31
CCOC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450980393	CE	On-Demand	Anodyne	ACE2	54	36
CCOC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC	ZINC000450980393	CE	On-Demand	Anodyne	AMP1_PLAFQ	49	37
COc1ccc(NS(=O)(=O)c2cnc(O)s2)cc1N1CCCC1=O	ZINC000450980407	FD	On-Demand	Anodyne	HTR6	15	41
COc1ccc(NS(=O)(=O)c2cnc(O)s2)cc1N1CCCC1=O	ZINC000450980407	FD	On-Demand	Anodyne	GHSR	15	51
CCc1cccc(C(=O)Nc2cc(C)c(O)c(C)c2C)n1	ZINC000450980413	CH	On-Demand	Anodyne	PLA2G7	43	40
Cc1cccc(-c2nnc3n2C[C@H](C(=O)Nc2cc(C)c(O)c(C)c2C)CC3)c1	ZINC000450980418	GI	On-Demand	Anodyne	CRK3	0	40
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)Nc2cc(C)c(O)c(C)c2C)CC3)c1	ZINC000450980419	GI	On-Demand	Anodyne	CRK3	0	40
CC[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@@H](C)[S@@]1=O	ZINC000450980422	DE	On-Demand	Anodyne	SIGMAR1	23	43
CC[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H](C)[S@]1=O	ZINC000450980423	DE	On-Demand	Anodyne	SIGMAR1	23	43
CC[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@@H](C)[S@]1=O	ZINC000450980424	DE	On-Demand	Anodyne	SIGMAR1	23	43
CC[C@@H]1CN(CCN(C)Cc2ccccc2)C[C@H](C)[S@@]1=O	ZINC000450980425	DE	On-Demand	Anodyne	SIGMAR1	23	43
COC(=O)CCCNS(=O)(=O)c1ccc(C)c(Br)c1	ZINC000450980427	FD	On-Demand	Anodyne	LEF	51	34
COC(=O)CCCNS(=O)(=O)c1ccc(SC)cc1	ZINC000450980433	DD	On-Demand	Anodyne	TBXAS1	26	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccccc2)cc1	ZINC000450980438	FE	On-Demand	Anodyne	PPARG	40	32
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccccc2)cc1	ZINC000450980438	FE	On-Demand	Anodyne	LTA4H	32	46
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccccc2)cc1	ZINC000450980438	FE	On-Demand	Anodyne	PLA2G4A	60	38
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccccc2)cc1	ZINC000450980438	FE	On-Demand	Anodyne	PLA2G4B	55	33
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccccc2)cc1	ZINC000450980438	FE	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccccc2)cc1	ZINC000450980438	FE	On-Demand	Anodyne	TMPRSS11D	53	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnn(C)c2)cc1	ZINC000450980448	DD	On-Demand	Anodyne	CA2	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnn(C)c2)cc1	ZINC000450980448	DD	On-Demand	Anodyne	CA4	20	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2n[nH]cc2C#N)cc1	ZINC000450980470	GD	On-Demand	Mild	MTNN	66	32
COC(=O)c1ncccc1S(=O)(=O)N(CCCN(C)C)Cc1ccccc1	ZINC000450980475	GE	On-Demand	Anodyne	MMP3	15	45
COC(=O)c1ncccc1S(=O)(=O)N(CCCN(C)C)Cc1ccccc1	ZINC000450980475	GE	On-Demand	Anodyne	MMP8	16	43
COC(=O)c1ncccc1S(=O)(=O)N(CCCN(C)C)Cc1ccccc1	ZINC000450980475	GE	On-Demand	Anodyne	MMP9	25	43
COC(=O)c1ncccc1S(=O)(=O)N(CCCN(C)C)Cc1ccccc1	ZINC000450980475	GE	On-Demand	Anodyne	MMP1	22	43
Cc1csc(S(=O)(=O)N(C)c2ccc(OCCN3CCCC3)cc2)c1	ZINC000450980483	GG	On-Demand	Anodyne	ESR1	92	39
Cc1csc(S(=O)(=O)N(C)c2ccc(OCCN3CCCC3)cc2)c1	ZINC000450980483	GG	On-Demand	Anodyne	ESR2	64	40
Cc1csc(S(=O)(=O)N(C)c2ccc(OCCN3CCCC3)cc2)c1	ZINC000450980483	GG	On-Demand	Anodyne	LTA4H	47	43
Cc1csc(S(=O)(=O)N(C)c2ccc(OCCN3CCCC3)cc2)c1	ZINC000450980483	GG	On-Demand	Anodyne	HRH3	61	41
Cc1csc(S(=O)(=O)N(C)c2ccc(OCCN3CCCC3)cc2)c1	ZINC000450980483	GG	On-Demand	Anodyne	PSMB2	54	42
Cc1csc(S(=O)(=O)N(C)c2ccc(OCCN3CCCC3)cc2)c1	ZINC000450980483	GG	On-Demand	Anodyne	PSMB5	19	42
Cc1csc(S(=O)(=O)N(C)c2ccc(OCCN3CCCC3)cc2)c1	ZINC000450980483	GG	On-Demand	Anodyne	PSMB1	47	42
COC(=O)CNC(=O)Cc1ccc(NS(=O)(=O)c2cc(C)cs2)cc1	ZINC000450980484	GD	On-Demand	Anodyne	PTPRB	67	37
COC(=O)CCCNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1	ZINC000450980491	GC	On-Demand	Anodyne	NPY2R	43	38
COC(=O)CCCNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1	ZINC000450980491	GC	On-Demand	Anodyne	CCR8	79	36
COC(=O)CCCNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1	ZINC000450980491	GC	On-Demand	Anodyne	SFRP1	81	34
COC(=O)CCCNS(=O)(=O)c1ccccc1S(=O)(=O)NC1CC1	ZINC000450980491	GC	On-Demand	Anodyne	WNT3	48	33
CC(=O)[C@@](C)(O)CN1CCOc2cc(O)ccc2C1	ZINC000450980500	CC	On-Demand	Anodyne	DRD5	17	44
CC(=O)[C@](C)(O)CN1CCOc2cc(O)ccc2C1	ZINC000450980501	CC	On-Demand	Anodyne	DRD5	17	44
COC(=O)CCCNS(=O)(=O)c1ccc2c(c1)ncn2C	ZINC000450980507	DC	On-Demand	Anodyne	NR1I2	47	36
COC(=O)CCCNS(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2C	ZINC000450980515	FD	On-Demand	Anodyne	RIBH	0	41
COC(=O)CCCNS(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2C	ZINC000450980515	FD	On-Demand	Anodyne	RORC	29	49
Cc1ccc2c(CCNC(=O)c3ccsn3)cn(C)c2c1	ZINC000450980518	CF	On-Demand	Anodyne	NQO2	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3c(F)cc(F)cc32)cc1	ZINC000450980520	GG	On-Demand	Anodyne	CPT1A	47	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3c(F)cc(F)cc32)cc1	ZINC000450980520	GG	On-Demand	Anodyne	TGM2	47	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3c(F)cc(F)cc32)cc1	ZINC000450980520	GG	On-Demand	Anodyne	F13A1	62	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3c(F)cc(F)cc32)cc1	ZINC000450980520	GG	On-Demand	Anodyne	LEF	50	32
Cc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1sccc1Cl	ZINC000450980521	FG	On-Demand	Anodyne	MAPK11	39	48
Cc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1sccc1Cl	ZINC000450980521	FG	On-Demand	Anodyne	MAPK14	57	48
Cc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1sccc1Cl	ZINC000450980521	FG	On-Demand	Anodyne	MAPK13	52	36
Cc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1sccc1Cl	ZINC000450980521	FG	On-Demand	Anodyne	PTGDR	23	42
Cc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1sccc1Cl	ZINC000450980521	FG	On-Demand	Anodyne	PTGDR2	17	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	CA2	20	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	CA1	25	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	MMP13	33	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	GRM4	23	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	CA14	16	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	MMP2	28	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	CA12	21	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	CA9	19	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2Cl)cc1	ZINC000450980532	GH	On-Demand	Anodyne	IDO1	31	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	CA2	20	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	CA1	25	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	MMP13	33	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	GRM4	23	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	CA14	16	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	MMP2	28	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	CA12	21	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	CA9	19	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)cc1	ZINC000450980533	GH	On-Demand	Anodyne	IDO1	31	40
Cc1nc([C@H]2CCCN2C(=O)Cc2cc3ccccc3s2)cs1	ZINC000450980539	EJ	On-Demand	Anodyne	ADAM17	22	41
Cc1nc([C@H]2CCCN2C(=O)Cc2cc3ccccc3s2)cs1	ZINC000450980539	EJ	On-Demand	Anodyne	COLA	110	43
Cc1nc([C@H]2CCCN2C(=O)Cc2cc3ccccc3s2)cs1	ZINC000450980539	EJ	On-Demand	Anodyne	CPT1A	104	43
COC(=O)c1coc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980562	GD	On-Demand	Anodyne	CHRM2	16	41
COC(=O)c1coc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980562	GD	On-Demand	Anodyne	DRD2	17	43
COC(=O)c1coc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980562	GD	On-Demand	Anodyne	DRD4	50	41
COC(=O)c1coc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980562	GD	On-Demand	Anodyne	ACHE	42	39
COC(=O)c1coc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980562	GD	On-Demand	Anodyne	DRD3	16	41
COC(=O)c1coc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980562	GD	On-Demand	Anodyne	SIGMAR1	57	43
COC(=O)c1coc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980562	GD	On-Demand	Anodyne	SLC18A3	22	42
COC(=O)c1coc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980562	GD	On-Demand	Anodyne	CACNA1G	17	47
COC(=O)c1coc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980565	GD	On-Demand	Anodyne	CHRM2	16	41
COC(=O)c1coc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980565	GD	On-Demand	Anodyne	DRD2	17	43
COC(=O)c1coc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980565	GD	On-Demand	Anodyne	DRD4	50	41
COC(=O)c1coc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980565	GD	On-Demand	Anodyne	ACHE	42	39
COC(=O)c1coc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980565	GD	On-Demand	Anodyne	DRD3	16	41
COC(=O)c1coc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980565	GD	On-Demand	Anodyne	SIGMAR1	57	43
COC(=O)c1coc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980565	GD	On-Demand	Anodyne	SLC18A3	22	42
COC(=O)c1coc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)n1	ZINC000450980565	GD	On-Demand	Anodyne	CACNA1G	17	47
COc1ccc(OC)c([C@@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c1	ZINC000450980566	GD	On-Demand	Anodyne	COLA	96	40
COc1ccc(OC)c([C@@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c1	ZINC000450980566	GD	On-Demand	Anodyne	CPT1A	92	40
COc1ccc(OC)c([C@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c1	ZINC000450980568	GD	On-Demand	Anodyne	COLA	96	40
COc1ccc(OC)c([C@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c1	ZINC000450980568	GD	On-Demand	Anodyne	CPT1A	92	40
Cc1ccc2cc(S(=O)(=O)Nc3ccc(N4CCOCC4)cc3C)ccc2c1	ZINC000450980570	GI	On-Demand	Anodyne	GHSR	0	47
Cc1ccc2cc(S(=O)(=O)Nc3ccc(N4CCOCC4)cc3C)ccc2c1	ZINC000450980570	GI	On-Demand	Anodyne	TTK	15	41
CC[C@H](CC(F)(F)F)C(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450980573	EI	On-Demand	Anodyne	NQO2	17	40
CC(C)CN(CC(F)(F)F)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450980584	ED	On-Demand	Anodyne	SCARB1	48	37
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)cc1	ZINC000450980588	GG	On-Demand	Anodyne	PLG	44	33
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)cc1	ZINC000450980588	GG	On-Demand	Anodyne	CDK2	0	48
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)cc1	ZINC000450980588	GG	On-Demand	Anodyne	TMPRSS11D	54	32
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)cc1	ZINC000450980588	GG	On-Demand	Anodyne	PKNB	68	39
CCc1cc(CCCN(C)CCN2CCN(Cc3ccccc3)CC2)on1	ZINC000450980589	FF	On-Demand	Anodyne	SIGMAR1	51	43
O=C(Cn1nnc(-c2ccncn2)n1)Nc1nc2c(s1)CCC2	ZINC000450980599	EC	On-Demand	Anodyne	SLC27A1	33	47
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cc(C)c(O)c(C)c2)c1	ZINC000450980623	DH	On-Demand	Anodyne	MTNR1A	20	43
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cc(C)c(O)c(C)c2)c1	ZINC000450980623	DH	On-Demand	Anodyne	MTNR1B	26	43
COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cc(C)c(O)c(C)c2)c1	ZINC000450980623	DH	On-Demand	Anodyne	NAMPT	23	40
CSc1cccc(C(=O)N2CCC[C@H](C(C)C)C2)c1	ZINC000450980625	CH	On-Demand	Anodyne	PREP	23	41
CSc1cccc(C(=O)N2CCC[C@H](C(C)C)C2)c1	ZINC000450980625	CH	On-Demand	Anodyne	RHOA	0	49
CSc1cccc(C(=O)N2CCC[C@H](C(C)C)C2)c1	ZINC000450980625	CH	On-Demand	Anodyne	L3MBTL1	0	40
CSc1cccc(C(=O)N2CCC[C@H](C(C)C)C2)c1	ZINC000450980625	CH	On-Demand	Anodyne	HPGD	36	52
CSc1cccc(C(=O)N2CCC[C@@H](C(C)C)C2)c1	ZINC000450980626	CH	On-Demand	Anodyne	PREP	23	41
CSc1cccc(C(=O)N2CCC[C@@H](C(C)C)C2)c1	ZINC000450980626	CH	On-Demand	Anodyne	RHOA	0	49
CSc1cccc(C(=O)N2CCC[C@@H](C(C)C)C2)c1	ZINC000450980626	CH	On-Demand	Anodyne	L3MBTL1	0	40
CSc1cccc(C(=O)N2CCC[C@@H](C(C)C)C2)c1	ZINC000450980626	CH	On-Demand	Anodyne	HPGD	36	52
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	CA2	22	45
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	ADRB2	30	46
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	ADRB1	23	46
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	ADRB3	34	46
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	CA1	27	45
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	CA7	18	41
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	MMP13	37	40
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	CA4	23	45
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	CA14	17	41
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	MTNR1A	30	40
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	MTNR1B	29	50
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	MMP2	23	40
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	CA12	15	41
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	ADAMTS4	46	37
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	CA9	17	41
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	GPR119	27	43
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	PFK	0	42
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	LIMK2	40	38
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	MTCA1	18	41
CCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450980627	GH	On-Demand	Anodyne	P96878_MYCTU	20	41
CC[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450980628	CD	On-Demand	Anodyne	P2RY12	44	33
CC[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450980628	CD	On-Demand	Anodyne	TACR3	41	37
CC[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450980628	CD	On-Demand	Anodyne	CTSV	51	36
CC[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450980628	CD	On-Demand	Anodyne	GPR142	23	40
CC[C@@H](CO)NC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450980628	CD	On-Demand	Anodyne	AGER	0	40
CCOC(C)(C)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000450980646	CH	On-Demand	Anodyne	SCN9A	0	43
CCOC(C)(C)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000450980648	CH	On-Demand	Anodyne	SCN9A	0	43
CCOC(C)(C)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000450980649	CH	On-Demand	Anodyne	SCN9A	0	43
CCOC(C)(C)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000450980650	CH	On-Demand	Anodyne	SCN9A	0	43
CC[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450980655	CD	On-Demand	Anodyne	KLK3	40	31
CC[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450980655	CD	On-Demand	Anodyne	RIR1_HHV11	59	40
CC[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450980655	CD	On-Demand	Anodyne	CAPNS1	43	31
CC[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450980655	CD	On-Demand	Anodyne	CAPN1	58	38
CC[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450980655	CD	On-Demand	Anodyne	CAPN2	72	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)F)s2)cc1	ZINC000450980659	GF	On-Demand	Anodyne	CA2	36	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)F)s2)cc1	ZINC000450980659	GF	On-Demand	Anodyne	CA1	43	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)F)s2)cc1	ZINC000450980659	GF	On-Demand	Anodyne	CA4	65	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)F)s2)cc1	ZINC000450980659	GF	On-Demand	Anodyne	CA9	22	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(F)F)s2)cc1	ZINC000450980659	GF	On-Demand	Anodyne	LEF	24	47
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2onc(C)c2C)c(F)c1	ZINC000450980662	GE	On-Demand	Anodyne	EDNRB	54	46
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2onc(C)c2C)c(F)c1	ZINC000450980662	GE	On-Demand	Anodyne	EDNRA	88	60
O=C(c1ccccc1)N1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1	ZINC000450980664	GF	On-Demand	Anodyne	NPY2R	21	41
O=C(c1ccccc1)N1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1	ZINC000450980664	GF	On-Demand	Anodyne	SMO	33	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(N2CCOCC2)cc1C	ZINC000450980673	GD	On-Demand	Anodyne	TTK	18	40
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(N2CCOCC2)cc1C	ZINC000450980673	GD	On-Demand	Anodyne	EPHB4	50	32
C[C@H](O)CCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450980696	DD	On-Demand	Anodyne	DRD2	0	44
C[C@H](O)CCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450980696	DD	On-Demand	Anodyne	ACHE	24	42
C[C@H](O)CCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450980696	DD	On-Demand	Anodyne	SIGMAR1	84	52
C[C@@H](O)CCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450980698	DD	On-Demand	Anodyne	DRD2	0	44
C[C@@H](O)CCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450980698	DD	On-Demand	Anodyne	ACHE	24	42
C[C@@H](O)CCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450980698	DD	On-Demand	Anodyne	SIGMAR1	84	52
CCC(C)(C)c1ccc(S(=O)(=O)NCCCC(=O)OC)cc1	ZINC000450980699	EF	On-Demand	Anodyne	TBXA2R	42	34
CCC(C)(C)c1ccc(S(=O)(=O)NCCCC(=O)OC)cc1	ZINC000450980699	EF	On-Demand	Anodyne	TBXAS1	23	41
Cc1ccccc1CN1CCC(NC(=O)Cn2nnc(-c3ccncn3)n2)CC1	ZINC000450980705	GD	On-Demand	Anodyne	SIGMAR1	17	42
Cc1ccccc1CN1CCC(NC(=O)Cn2nnc(-c3ccncn3)n2)CC1	ZINC000450980705	GD	On-Demand	Anodyne	SCARB1	48	39
CC[C@@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450980719	EF	On-Demand	Anodyne	PDGFRB	0	47
CC[C@@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450980719	EF	On-Demand	Anodyne	CPT1A	46	32
CC[C@@H](CO)NC(=O)c1ccc2c(c1)ncn2-c1ccccc1OC	ZINC000450980719	EF	On-Demand	Anodyne	HPGD	47	58
CC(=O)c1ccc(CN2C[C@H]3CCC[C@@H](C3)C2)cc1	ZINC000450980727	CH	On-Demand	Anodyne	HRH3	15	49
CC(=O)c1ccc(CN2C[C@H]3CCC[C@@H](C3)C2)cc1	ZINC000450980727	CH	On-Demand	Anodyne	S1PR5	40	34
CC[C@@H](C#N)NC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450980731	CG	On-Demand	Mild	LGMN	62	36
CC[C@@H](C#N)NC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450980738	CG	On-Demand	Mild	LGMN	62	36
CC[C@@H](C#N)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450980739	CG	On-Demand	Mild	LGMN	62	36
CC[C@@H](C#N)NC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450980740	CG	On-Demand	Mild	LGMN	62	36
C[C@]1(c2ccccc2)C[C@@H]1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450980742	DG	On-Demand	Anodyne	TAT_HV112	0	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)Nc2onc(C)c2C)c1	ZINC000450980743	FF	On-Demand	Anodyne	EDNRB	49	42
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)Nc2onc(C)c2C)c1	ZINC000450980743	FF	On-Demand	Anodyne	EDNRA	35	44
C[C@]1(c2ccccc2)CCCN(CC2CCC(=O)CC2)CC1	ZINC000450980744	CI	On-Demand	Anodyne	OPRK1	16	45
C[C@]1(c2ccccc2)CCCN(CC2CCC(=O)CC2)CC1	ZINC000450980744	CI	On-Demand	Anodyne	OPRL1	20	44
C[C@]1(c2ccccc2)CCCN(CC2CCC(=O)CC2)CC1	ZINC000450980744	CI	On-Demand	Anodyne	SIGMAR1	28	41
C[C@@]1(c2ccccc2)CCCN(CC2CCC(=O)CC2)CC1	ZINC000450980746	CI	On-Demand	Anodyne	OPRK1	16	45
C[C@@]1(c2ccccc2)CCCN(CC2CCC(=O)CC2)CC1	ZINC000450980746	CI	On-Demand	Anodyne	OPRL1	20	44
C[C@@]1(c2ccccc2)CCCN(CC2CCC(=O)CC2)CC1	ZINC000450980746	CI	On-Demand	Anodyne	SIGMAR1	28	41
COc1ccc(CN(C)C(=O)Cn2nnc(-c3ccncn3)n2)cc1F	ZINC000450980747	FC	On-Demand	Anodyne	SCARB1	42	38
CC[C@@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450980748	DE	On-Demand	Anodyne	MTNR1B	37	47
CC[C@@H](CO)NC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450980748	DE	On-Demand	Anodyne	ROCK2	40	38
Cc1cc(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)c(C)c(C)c1O	ZINC000450980749	EH	On-Demand	Anodyne	ANPEP	33	42
O=C(CCCN1CCCC[C@H]1c1cc[nH]n1)c1ccc(Br)cc1	ZINC000450980750	GI	On-Demand	Anodyne	CYP2J2	45	32
O=C(CCCN1CCCC[C@@H]1c1cc[nH]n1)c1ccc(Br)cc1	ZINC000450980753	GI	On-Demand	Anodyne	CYP2J2	45	32
COc1ccc(CNC(=O)CCN(C)[C@H]2CCCOC2)c(OC)c1	ZINC000450980755	ED	On-Demand	Anodyne	MTNR1A	48	36
COc1ccc(CNC(=O)CCN(C)[C@@H]2CCCOC2)c(OC)c1	ZINC000450980756	ED	On-Demand	Anodyne	MTNR1A	48	36
CC[C@@H](CC(F)(F)F)C(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450980767	EI	On-Demand	Anodyne	NQO2	17	40
C[C@H](O)CCN1CCOc2cc(O)ccc2C1	ZINC000450980770	BD	On-Demand	Anodyne	DRD5	19	50
C[C@@H](O)CCN1CCOc2cc(O)ccc2C1	ZINC000450980771	BD	On-Demand	Anodyne	DRD5	19	50
COC(=O)CCCNS(=O)(=O)C[C@@H](C)c1ccccc1	ZINC000450980773	CD	On-Demand	Anodyne	KCNA5	25	40
COC(=O)CCCNS(=O)(=O)C[C@@H](C)c1ccccc1	ZINC000450980773	CD	On-Demand	Anodyne	GRIA4	20	40
COC(=O)CCCNS(=O)(=O)C[C@H](C)c1ccccc1	ZINC000450980774	CD	On-Demand	Anodyne	KCNA5	25	40
COC(=O)CCCNS(=O)(=O)C[C@H](C)c1ccccc1	ZINC000450980774	CD	On-Demand	Anodyne	GRIA4	20	40
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	CHRM2	18	56
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	DRD2	18	48
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	DRD4	44	48
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	ACHE	27	49
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	DRD3	22	48
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	CHRM3	17	56
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	SIGMAR1	87	46
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	SLC18A3	40	35
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	MCHR2	71	37
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	CCR8	48	44
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	NPFFR1	57	40
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	SLC12A5	53	34
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	PA	22	41
CC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980787	EH	On-Demand	Anodyne	NOD2	41	34
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	CHRM2	18	56
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	DRD2	18	48
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	DRD4	44	48
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	ACHE	27	49
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	DRD3	22	48
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	CHRM3	17	56
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	SIGMAR1	87	46
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	SLC18A3	40	35
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	MCHR2	71	37
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	CCR8	48	44
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	NPFFR1	57	40
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	SLC12A5	53	34
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	PA	22	41
CC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450980788	EH	On-Demand	Anodyne	NOD2	41	34
COC(=O)CCCNS(=O)(=O)Cc1ccc2ccccc2c1	ZINC000450980809	DE	On-Demand	Anodyne	NPY1R	0	43
N#CCc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)c(Cl)c1	ZINC000450980813	ED	On-Demand	Mild	LGMN	50	30
N#CCc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)c(Cl)c1	ZINC000450980816	ED	On-Demand	Mild	LGMN	50	30
FC1(F)CC[C@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980827	FG	On-Demand	Anodyne	CHRM2	17	40
FC1(F)CC[C@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980827	FG	On-Demand	Anodyne	DRD2	0	41
FC1(F)CC[C@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980827	FG	On-Demand	Anodyne	CHRM3	20	40
FC1(F)CC[C@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980827	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
FC1(F)CC[C@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980827	FG	On-Demand	Anodyne	SIGMAR1	48	38
FC1(F)CC[C@@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980829	FG	On-Demand	Anodyne	CHRM2	17	40
FC1(F)CC[C@@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980829	FG	On-Demand	Anodyne	DRD2	0	41
FC1(F)CC[C@@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980829	FG	On-Demand	Anodyne	CHRM3	20	40
FC1(F)CC[C@@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980829	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
FC1(F)CC[C@@H](CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980829	FG	On-Demand	Anodyne	SIGMAR1	48	38
FC1(F)CC[C@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980830	FG	On-Demand	Anodyne	CHRM2	17	40
FC1(F)CC[C@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980830	FG	On-Demand	Anodyne	DRD2	0	41
FC1(F)CC[C@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980830	FG	On-Demand	Anodyne	CHRM3	20	40
FC1(F)CC[C@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980830	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
FC1(F)CC[C@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980830	FG	On-Demand	Anodyne	SIGMAR1	48	38
FC1(F)CC[C@@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980831	FG	On-Demand	Anodyne	CHRM2	17	40
FC1(F)CC[C@@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980831	FG	On-Demand	Anodyne	DRD2	0	41
FC1(F)CC[C@@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980831	FG	On-Demand	Anodyne	CHRM3	20	40
FC1(F)CC[C@@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980831	FG	On-Demand	Anodyne	VACHT_TETCF	0	40
FC1(F)CC[C@@H](CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1	ZINC000450980831	FG	On-Demand	Anodyne	SIGMAR1	48	38
COC(=O)CCCNS(=O)(=O)c1ccc(NC(=O)C2CC2)cc1OC	ZINC000450980834	FD	On-Demand	Anodyne	IAP	0	41
Cc1cccc(N2CCN(C(=O)Cn3nnc(-c4ccncn4)n3)CC2)c1	ZINC000450980840	FC	On-Demand	Anodyne	CCR1	34	46
N#CCc1ccc(S(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)c(Cl)c1	ZINC000450980841	FH	On-Demand	Mild	PKNB	40	35
COc1ccc([C@@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c(OC)c1	ZINC000450980843	GD	On-Demand	Anodyne	COLA	103	40
COc1ccc([C@@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c(OC)c1	ZINC000450980843	GD	On-Demand	Anodyne	CPT1A	98	40
COc1ccc([C@@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c(OC)c1	ZINC000450980843	GD	On-Demand	Anodyne	SCARB1	35	40
COc1ccc([C@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c(OC)c1	ZINC000450980844	GD	On-Demand	Anodyne	COLA	103	40
COc1ccc([C@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c(OC)c1	ZINC000450980844	GD	On-Demand	Anodyne	CPT1A	98	40
COc1ccc([C@H]2CCCN2C(=O)Cn2nnc(-c3ccncn3)n2)c(OC)c1	ZINC000450980844	GD	On-Demand	Anodyne	SCARB1	35	40
CC(C)[C@H]1CCCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450980854	FG	On-Demand	Anodyne	PIK3CD	17	40
CC(C)[C@H]1CCCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450980854	FG	On-Demand	Anodyne	PIK3CB	23	40
CC(C)[C@@H]1CCCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450980855	FG	On-Demand	Anodyne	PIK3CD	17	40
CC(C)[C@@H]1CCCN(C(=O)c2cc(F)c(N3CCOCC3)c(F)c2)C1	ZINC000450980855	FG	On-Demand	Anodyne	PIK3CB	23	40
CC(=O)NCCNS(=O)(=O)CCC1CCCCC1	ZINC000450980871	CD	On-Demand	Anodyne	BMP1	50	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	CA2	15	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	BMP1	63	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	CA1	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	COLA	58	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	MMP8	38	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	NPY5R	20	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	MMP9	28	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	MMP1	22	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	IDO1	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	LIMK2	35	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	MTCA1	18	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1	ZINC000450980872	FG	On-Demand	Anodyne	P96878_MYCTU	31	41
CCOC(C)(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450980883	CF	On-Demand	Anodyne	TRPV1	39	48
CCOC(C)(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450980883	CF	On-Demand	Anodyne	NCE103	30	46
CCOC(C)(C)CNC(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450980883	CF	On-Demand	Anodyne	CAN2	0	46
Cc1n[nH]c(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450980885	EE	On-Demand	Anodyne	MTNN	43	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(CC(C)(C)C)[nH]n2)cc1	ZINC000450980890	GG	On-Demand	Anodyne	MTNN	59	30
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(CC(C)(C)C)[nH]n2)cc1	ZINC000450980890	GG	On-Demand	Anodyne	PFK	0	42
COC(=O)CCCNS(=O)(=O)c1ccccc1Cn1ccnc1	ZINC000450980894	ED	On-Demand	Anodyne	CYP19A1	37	48
COC(=O)CCCNS(=O)(=O)c1ccccc1Cn1ccnc1	ZINC000450980894	ED	On-Demand	Anodyne	CYP11B1	49	43
COC(=O)CCCNS(=O)(=O)c1ccccc1Cn1ccnc1	ZINC000450980894	ED	On-Demand	Anodyne	TBXAS1	47	46
COC(=O)CCCNS(=O)(=O)c1ccccc1Cn1ccnc1	ZINC000450980894	ED	On-Demand	Anodyne	CYP11B2	43	37
COC(=O)CCCNS(=O)(=O)c1ccccc1Cn1ccnc1	ZINC000450980894	ED	On-Demand	Anodyne	CYP26A1	40	33
COC(=O)CCCNS(=O)(=O)c1ccc2cc(Br)ccc2c1	ZINC000450980895	GF	On-Demand	Anodyne	MMP13	20	43
COC(=O)CCCNS(=O)(=O)c1ccc2cc(Br)ccc2c1	ZINC000450980895	GF	On-Demand	Anodyne	MMP14	15	41
COC(=O)CCCNS(=O)(=O)c1ccc2cc(Br)ccc2c1	ZINC000450980895	GF	On-Demand	Anodyne	MMP9	15	41
COC(=O)CCCNS(=O)(=O)c1ccc2cc(Br)ccc2c1	ZINC000450980895	GF	On-Demand	Anodyne	IAP	0	41
COC(=O)CCCNS(=O)(=O)c1ccc2cc(Br)ccc2c1	ZINC000450980895	GF	On-Demand	Anodyne	IDO1	15	43
CCN(Cc1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1)C(C)=O	ZINC000450980906	GG	On-Demand	Anodyne	PTGES	0	45
CCN(Cc1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1)C(C)=O	ZINC000450980906	GG	On-Demand	Anodyne	LIMK2	23	41
CCN(Cc1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1)C(C)=O	ZINC000450980907	GG	On-Demand	Anodyne	PTGES	0	45
CCN(Cc1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1)C(C)=O	ZINC000450980907	GG	On-Demand	Anodyne	LIMK2	23	41
CC(C)C[C@@H](C)N(C)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450980918	DD	On-Demand	Anodyne	SCARB1	49	37
CC(C)C[C@H](C)N(C)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450980920	DD	On-Demand	Anodyne	SCARB1	49	37
CCOC(C)(C)CNC(=O)c1ccc2cnccc2c1	ZINC000450980922	CF	On-Demand	Anodyne	AKT1	0	41
O=C1CCC(CN2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)CC1	ZINC000450980924	DI	On-Demand	Anodyne	GRIN2B	28	40
C[C@H]1C[C@H](N2CCCC2)CN1CCN(C)Cc1ccccc1	ZINC000450980925	DF	On-Demand	Anodyne	SIGMAR1	18	42
C[C@@H]1C[C@@H](N2CCCC2)CN1CCN(C)Cc1ccccc1	ZINC000450980926	DF	On-Demand	Anodyne	SIGMAR1	18	42
C[C@@H]1C[C@H](N2CCCC2)CN1CCN(C)Cc1ccccc1	ZINC000450980927	DF	On-Demand	Anodyne	SIGMAR1	18	42
C[C@H]1C[C@@H](N2CCCC2)CN1CCN(C)Cc1ccccc1	ZINC000450980928	DF	On-Demand	Anodyne	SIGMAR1	18	42
COc1cccc(OCCC(=O)NC2(Cc3ccccc3)CC2)c1	ZINC000450980929	EG	On-Demand	Anodyne	TSPAN17	0	40
COc1cccc(OCCC(=O)NC2(Cc3ccccc3)CC2)c1	ZINC000450980929	EG	On-Demand	Anodyne	PDS	56	35
CCC[C@]1(NCCC(=O)NCc2ccc(OC)cc2OC)CCOC1	ZINC000450980930	FE	On-Demand	Anodyne	MTNR1A	58	41
CCC[C@]1(NCCC(=O)NCc2ccc(OC)cc2OC)CCOC1	ZINC000450980930	FE	On-Demand	Anodyne	MTNR1B	47	38
CCC[C@@]1(NCCC(=O)NCc2ccc(OC)cc2OC)CCOC1	ZINC000450980932	FE	On-Demand	Anodyne	MTNR1A	58	41
CCC[C@@]1(NCCC(=O)NCc2ccc(OC)cc2OC)CCOC1	ZINC000450980932	FE	On-Demand	Anodyne	MTNR1B	47	38
O=C(COc1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1)NC1CC1	ZINC000450980934	GD	On-Demand	Anodyne	CDK2	0	46
O=C(COc1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1)NC1CC1	ZINC000450980934	GD	On-Demand	Anodyne	LUXN	0	43
O=C(COc1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1)NC1CC1	ZINC000450980934	GD	On-Demand	Anodyne	PKNB	67	37
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCCC(=O)OC	ZINC000450980938	ED	On-Demand	Bother	TBXA2R	33	41
O=C(Cn1nnc(-c2ccncn2)n1)Nc1ccc2c(c1)OC1(CCCCC1)O2	ZINC000450980943	GE	On-Demand	Anodyne	SCARB1	42	39
O=S(=O)(Nc1cc(C2CCCC2)[nH]n1)c1sccc1Cl	ZINC000450980952	EH	On-Demand	Anodyne	CDK2	0	43
O=S(=O)(Nc1cc(C2CCCC2)[nH]n1)c1sccc1Cl	ZINC000450980952	EH	On-Demand	Anodyne	PKNB	59	38
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(F)c(F)cc21	ZINC000450980967	FE	On-Demand	Anodyne	CYP11B2	34	43
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(F)c(F)cc21	ZINC000450980967	FE	On-Demand	Anodyne	CPT1A	27	40
CO[C@@H](CS(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2)c1ccccc1	ZINC000450980969	FF	On-Demand	Anodyne	PKM	51	46
CO[C@@H](CS(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2)c1ccccc1	ZINC000450980969	FF	On-Demand	Anodyne	KIF11	17	50
CO[C@H](CS(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2)c1ccccc1	ZINC000450980970	FF	On-Demand	Anodyne	PKM	51	46
CO[C@H](CS(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2)c1ccccc1	ZINC000450980970	FF	On-Demand	Anodyne	KIF11	17	50
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	HTR1A	25	63
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	DRD2	47	58
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	DRD1	29	50
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	DRD4	29	53
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	ADRA1D	26	44
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	HTR2A	53	60
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	HTR2C	29	62
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	ADRA1A	27	40
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	HRH1	20	53
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	ADRA1B	21	47
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	DRD3	24	53
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	SLC6A3	16	44
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	HTR4	76	39
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	GRIN2B	20	40
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	ERG2	22	47
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	HTR7	39	47
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	HRH3	17	40
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	SIGMAR1	30	57
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	CCR3	71	47
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	CCR5	15	40
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	MCHR1	15	48
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	CACNA1I	57	40
CS(=O)(=O)NCC1CCN(CCCC(=O)c2ccc(F)cc2)CC1	ZINC000450980972	FE	On-Demand	Anodyne	CYP2J2	62	44
COc1cc([N+](=O)[O-])ccc1Cn1cnc2c1CCCC2	ZINC000450980976	CF	On-Demand	Bother	SLC29A1	39	43
Cc1ccccc1OCCCn1cnc2c1CCCC2	ZINC000450980982	CH	On-Demand	Anodyne	ACAT	0	40
Cc1ccccc1OCCCn1cnc2c1CCCC2	ZINC000450980982	CH	On-Demand	Anodyne	SCARB1	41	32
c1ccc2cc(Cn3cnc4c3CCCC4)ccc2c1	ZINC000450980983	CH	On-Demand	Anodyne	NR1I2	18	40
CCN(CC)C(=O)Cc1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450980984	FG	On-Demand	Anodyne	PTPRB	41	32
COC(=O)c1csc(CN2CCCC[C@@H]2c2cc[nH]n2)n1	ZINC000450980985	DE	On-Demand	Anodyne	COLA	30	40
COC(=O)c1csc(CN2CCCC[C@H]2c2cc[nH]n2)n1	ZINC000450980986	DE	On-Demand	Anodyne	COLA	30	40
COCCOc1cc(NS(=O)(=O)c2sccc2F)ccc1OC	ZINC000450980990	FF	On-Demand	Anodyne	DRTS_TRYCR	48	36
CN1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)c2cnccc21	ZINC000450981000	FE	On-Demand	Mild	PAK1	40	33
Clc1ccccc1CN(Cc1cn(CC2CC2)nn1)CC1CC1	ZINC000450981007	EH	On-Demand	Anodyne	HSP90AB1	0	43
O=C(CC1CC(F)(F)C1)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450981008	EI	On-Demand	Anodyne	ACAT	0	49
CCn1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cn1	ZINC000450981012	FD	On-Demand	Anodyne	LUXN	0	43
CCn1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cn1	ZINC000450981012	FD	On-Demand	Anodyne	ADIPOR1	0	41
CCn1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cn1	ZINC000450981012	FD	On-Demand	Anodyne	ADIPOR2	0	41
CCN(CCN(C)Cc1ccccc1)C[C@H](C)O	ZINC000450981013	CD	On-Demand	Anodyne	GALR1	45	32
COCCOc1cc(NS(=O)(=O)c2ccc(C3CC3)cc2)ccc1OC	ZINC000450981028	GG	On-Demand	Anodyne	SSTR5	15	40
COCCOc1cc(NS(=O)(=O)c2ccc(C3CC3)cc2)ccc1OC	ZINC000450981028	GG	On-Demand	Anodyne	HTR6	25	41
COCCOc1cc(NS(=O)(=O)c2ccc(C3CC3)cc2)ccc1OC	ZINC000450981028	GG	On-Demand	Anodyne	GHSR	22	42
COC(=O)COc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450981029	FF	On-Demand	Anodyne	PRTN3	43	30
COC(=O)COc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450981029	FF	On-Demand	Anodyne	GPR119	26	44
COC(=O)COc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450981029	FF	On-Demand	Anodyne	LIMK2	46	38
CC[C@@H](CO)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000450981030	CF	On-Demand	Anodyne	GPR88	0	42
CCCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981038	GG	On-Demand	Anodyne	PRTN3	64	42
CCCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981038	GG	On-Demand	Anodyne	LUXN	0	49
CCCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981038	GG	On-Demand	Anodyne	ADIPOR1	0	42
CCCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981038	GG	On-Demand	Anodyne	ADIPOR2	0	42
COc1cc(N2CCS(=O)(=O)CC2)ccc1NC(=O)C(C)(C)C(C)(F)F	ZINC000450981042	GF	On-Demand	Anodyne	IGF1R	40	35
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCN(C)c3ccncc32)c1	ZINC000450981043	GF	On-Demand	Anodyne	CYP11B2	29	42
CC[C@H](NC[C@@H](O)[C@H](C)c1ccccc1)c1ccc(OC)c(OC)c1	ZINC000450981044	EH	On-Demand	Anodyne	SLC22A3	0	40
CC[C@H](NC[C@H](O)[C@H](C)c1ccccc1)c1ccc(OC)c(OC)c1	ZINC000450981045	EH	On-Demand	Anodyne	SLC22A3	0	40
CC[C@H](NC[C@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)c(OC)c1	ZINC000450981046	EH	On-Demand	Anodyne	SLC22A3	0	40
CC[C@H](NC[C@@H](O)[C@@H](C)c1ccccc1)c1ccc(OC)c(OC)c1	ZINC000450981047	EH	On-Demand	Anodyne	SLC22A3	0	40
CC(C)(C)c1nnc(NS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)s1	ZINC000450981054	GE	On-Demand	Anodyne	CA4	19	47
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	CA2	25	47
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	CA1	30	40
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	KCNA5	31	50
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	CA7	15	42
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	BDKRB1	0	55
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	CA4	24	40
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	GRM4	20	42
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	CA14	16	42
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	MMP2	22	42
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	PRTN3	67	47
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	CA12	18	47
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	CA9	22	40
CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981088	GF	On-Demand	Anodyne	DAC	23	49
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2nncs2)cc1	ZINC000450981109	GD	On-Demand	Anodyne	CA4	50	37
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2nncs2)cc1	ZINC000450981109	GD	On-Demand	Anodyne	MTNN	45	31
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2nncs2)cc1	ZINC000450981109	GD	On-Demand	Anodyne	PFK	0	49
COC(=O)CCCNS(=O)(=O)c1cc(Cl)ccc1C(F)(F)F	ZINC000450981111	FF	On-Demand	Anodyne	SFRP1	42	33
COCCOC[C@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981120	EE	On-Demand	Anodyne	SLC6A3	28	54
COCCOC[C@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981120	EE	On-Demand	Anodyne	SLC18A2	42	36
COCCOC[C@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981120	EE	On-Demand	Anodyne	ABCB1	16	43
COCCOC[C@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981120	EE	On-Demand	Anodyne	ACHP_LYMST	19	40
COCCOC[C@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981120	EE	On-Demand	Anodyne	Q8WSF8_APLCA	34	40
COCCOC[C@@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981121	EE	On-Demand	Anodyne	SLC6A3	28	54
COCCOC[C@@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981121	EE	On-Demand	Anodyne	SLC18A2	42	36
COCCOC[C@@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981121	EE	On-Demand	Anodyne	ABCB1	16	43
COCCOC[C@@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981121	EE	On-Demand	Anodyne	ACHP_LYMST	19	40
COCCOC[C@@H](O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981121	EE	On-Demand	Anodyne	Q8WSF8_APLCA	34	40
COC(=O)CCCNS(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000450981139	DC	On-Demand	Anodyne	TBXA2R	49	35
COC(=O)CCCNS(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000450981139	DC	On-Demand	Anodyne	TBXAS1	32	41
COC(=O)CCCNS(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000450981139	DC	On-Demand	Anodyne	ALOX15	40	35
COC(=O)CCCNS(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000450981139	DC	On-Demand	Anodyne	LIMK2	40	37
COC(=O)COc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450981160	FF	On-Demand	Anodyne	PRTN3	52	32
COC(=O)COc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450981160	FF	On-Demand	Anodyne	LIMK2	44	42
COC(=O)c1ccc(CN[C@@H]2CSC[C@H]2C)cc1Cl	ZINC000450981172	CF	On-Demand	Anodyne	SSTR3	0	42
COC(=O)c1ccc(CN[C@H]2CSC[C@H]2C)cc1Cl	ZINC000450981174	CF	On-Demand	Anodyne	SSTR3	0	42
COC(=O)c1ccc(CN[C@@H]2CSC[C@@H]2C)cc1Cl	ZINC000450981176	CF	On-Demand	Anodyne	SSTR3	0	42
COC(=O)c1ccc(CN[C@H]2CSC[C@@H]2C)cc1Cl	ZINC000450981177	CF	On-Demand	Anodyne	SSTR3	0	42
Cc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c(C)c(C)c1O	ZINC000450981179	DH	On-Demand	Anodyne	HRH3	38	43
Cc1cc(NC(=O)[C@H]2CCN(c3ccccc3)C2)c(C)c(C)c1O	ZINC000450981179	DH	On-Demand	Anodyne	EPHX2	26	43
COC(=O)CCCNS(=O)(=O)c1cc(Br)sc1Cl	ZINC000450981183	GE	On-Demand	Anodyne	KAT2B	0	40
COC(=O)CCCNS(=O)(=O)c1ccc(C(=O)OC)nc1	ZINC000450981184	DC	On-Demand	Anodyne	TBXAS1	25	41
Cc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c(C)c(C)c1O	ZINC000450981186	DH	On-Demand	Anodyne	HRH3	38	43
Cc1cc(NC(=O)[C@@H]2CCN(c3ccccc3)C2)c(C)c(C)c1O	ZINC000450981186	DH	On-Demand	Anodyne	EPHX2	26	43
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	CHRM2	27	43
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	HTR1A	17	49
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	DRD2	37	49
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	DRD4	82	47
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	ACHE	53	48
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	HRH1	22	43
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	OPRM1	17	44
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	DRD3	29	42
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	OPRK1	20	44
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	CHRM3	35	42
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	VACHT_TETCF	0	44
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	HRH3	24	46
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	SIGMAR1	77	46
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	CCR3	64	42
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	CCR5	23	44
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	SLC18A3	33	44
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	FAAH	20	40
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	CXCR3	35	44
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	MCHR1	36	43
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	MGLL	0	41
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	NPFFR1	42	32
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	L3MBTL1	0	43
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	L3MBTL3	42	43
CC(=O)c1cccc(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981202	GG	On-Demand	Anodyne	MBTD1	0	43
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	CHRM2	27	43
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	HTR1A	17	49
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	DRD2	37	49
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	DRD4	82	47
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	ACHE	53	48
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	HRH1	22	43
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	OPRM1	17	44
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	DRD3	29	42
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	OPRK1	20	44
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	CHRM3	35	42
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	VACHT_TETCF	0	44
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	HRH3	24	46
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	SIGMAR1	77	46
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	CCR3	64	42
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	CCR5	23	44
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	SLC18A3	33	44
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	FAAH	20	40
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	CXCR3	35	44
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	MCHR1	36	43
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	MGLL	0	41
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	NPFFR1	42	32
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	L3MBTL1	0	43
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	L3MBTL3	42	43
CC(=O)c1cccc(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)c1	ZINC000450981205	GG	On-Demand	Anodyne	MBTD1	0	43
Cc1ccc2c(CCNC(=O)[C@H](C)Oc3ccccn3)cn(C)c2c1	ZINC000450981208	EG	On-Demand	Anodyne	MTNR1A	24	42
Cc1ccc2c(CCNC(=O)[C@@H](C)Oc3ccccn3)cn(C)c2c1	ZINC000450981210	EG	On-Demand	Anodyne	MTNR1A	24	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(F)c(F)cc32)cc1	ZINC000450981227	GG	On-Demand	Anodyne	COLA	38	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(F)c(F)cc32)cc1	ZINC000450981227	GG	On-Demand	Anodyne	CPT1A	48	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(F)c(F)cc32)cc1	ZINC000450981227	GG	On-Demand	Anodyne	CPT2	35	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(F)c(F)cc32)cc1	ZINC000450981227	GG	On-Demand	Anodyne	TGM2	50	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(F)c(F)cc32)cc1	ZINC000450981227	GG	On-Demand	Anodyne	CPT1B	32	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(F)c(F)cc32)cc1	ZINC000450981227	GG	On-Demand	Anodyne	F13A1	67	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3cc(F)c(F)cc32)cc1	ZINC000450981227	GG	On-Demand	Anodyne	LEF	43	33
Cc1ccn2ncc(C(=O)N3CCC[C@H](C(C)C)C3)c2c1	ZINC000450981228	CG	On-Demand	Anodyne	EPHB3	24	41
Cc1ccn2ncc(C(=O)N3CCC[C@@H](C(C)C)C3)c2c1	ZINC000450981229	CG	On-Demand	Anodyne	EPHB3	24	41
COC(=O)CCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl	ZINC000450981230	FF	On-Demand	Anodyne	PTGDR	15	42
COC1(CNC(=O)c2ccc(Br)cc2C#N)CCCCC1	ZINC000450981236	FG	On-Demand	Mild	HCN1	51	33
COC1(CNC(=O)c2ccc(Br)cc2C#N)CCCCC1	ZINC000450981236	FG	On-Demand	Mild	HCN4	49	33
CCCCOc1ccc(OC)cc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450981243	GF	On-Demand	Anodyne	MTNR1A	23	41
CCCCOc1ccc(OC)cc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450981243	GF	On-Demand	Anodyne	MTNR1B	23	41
CCCCOc1ccc(OC)cc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450981243	GF	On-Demand	Anodyne	AKR1C2	40	31
CC[C@@H](C(=O)OC)N1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450981245	FD	On-Demand	Anodyne	MMP13	26	42
CC[C@@H](C(=O)OC)N1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450981245	FD	On-Demand	Anodyne	ADAM17	23	42
CC[C@@H](C(=O)OC)N1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450981245	FD	On-Demand	Anodyne	MMP9	21	42
CC[C@@H](C(=O)OC)N1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450981245	FD	On-Demand	Anodyne	MMP1	18	42
CC[C@H](C(=O)OC)N1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450981246	FD	On-Demand	Anodyne	MMP13	26	42
CC[C@H](C(=O)OC)N1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450981246	FD	On-Demand	Anodyne	ADAM17	23	42
CC[C@H](C(=O)OC)N1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450981246	FD	On-Demand	Anodyne	MMP9	21	42
CC[C@H](C(=O)OC)N1CCN(Cc2ccc(S(=O)(=O)CC)cc2)CC1	ZINC000450981246	FD	On-Demand	Anodyne	MMP1	18	42
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)NC(C)C)c1ccccc1	ZINC000450981248	GF	On-Demand	Anodyne	KCNA5	25	57
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)NC(C)C)c1ccccc1	ZINC000450981248	GF	On-Demand	Anodyne	PRTN3	48	37
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)NC(C)C)c1ccccc1	ZINC000450981248	GF	On-Demand	Anodyne	DAC	26	48
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)NC(C)C)c1ccccc1	ZINC000450981249	GF	On-Demand	Anodyne	KCNA5	25	57
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)NC(C)C)c1ccccc1	ZINC000450981249	GF	On-Demand	Anodyne	PRTN3	48	37
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)NC(C)C)c1ccccc1	ZINC000450981249	GF	On-Demand	Anodyne	DAC	26	48
C[C@@H](c1csnn1)N(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450981250	EE	On-Demand	Anodyne	SIGMAR1	32	40
C[C@H](c1csnn1)N(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450981251	EE	On-Demand	Anodyne	SIGMAR1	32	40
Cc1c(C#N)c(NC(=O)Cn2nnc(-c3ccncn3)n2)n(C2CCCC2)c1C	ZINC000450981256	GE	On-Demand	Mild	SCARB1	44	35
COCCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1	ZINC000450981263	FD	On-Demand	Anodyne	LIMK2	20	46
CCOC(C)(C)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450981264	EE	On-Demand	Anodyne	PDE8B	48	34
CCOC(C)(C)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450981265	EE	On-Demand	Anodyne	PDE8B	48	34
COc1ccc([C@H](CNS(=O)(=O)CCC2CCCC2)N2CCOCC2)cc1	ZINC000450981266	GF	On-Demand	Anodyne	CCR3	21	41
Cc1nn(C)cc1CC(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450981267	FG	On-Demand	Anodyne	ACAT	0	45
CCN(CC)C(=O)Cc1ccc(NS(=O)(=O)CCCCF)cc1	ZINC000450981278	EF	On-Demand	Anodyne	PTPRB	49	33
CC[C@@H](CO)NC(=O)CCCC(C)C	ZINC000450981289	BD	On-Demand	Anodyne	PLA2G2C	0	41
CC[C@@H](CO)NC(=O)CCCC(C)C	ZINC000450981289	BD	On-Demand	Anodyne	Q6UB75_PIG	0	48
CC[C@@H](CO)NC(=O)CCCC(C)C	ZINC000450981289	BD	On-Demand	Anodyne	NOD1	61	38
CC[C@@H](CO)NC(=O)CCCC(C)C	ZINC000450981289	BD	On-Demand	Anodyne	COL4A3BP	0	40
Cn1nc(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)c2c1CCCC2	ZINC000450981290	GH	On-Demand	Anodyne	ACAT	0	46
O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)[C@@H]1C[C@H]1C(F)(F)F	ZINC000450981310	FI	On-Demand	Anodyne	ACAT	0	47
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c(C)n1	ZINC000450981316	GE	On-Demand	Anodyne	MTNN	80	39
CCOC(=O)COc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450981337	FF	On-Demand	Anodyne	GPR119	0	42
Cc1cc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)cc(C)c1O	ZINC000450981352	FG	On-Demand	Anodyne	INHA	22	40
Cc1cc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)cc(C)c1O	ZINC000450981353	FG	On-Demand	Anodyne	INHA	22	40
CC[S@@](=O)CC(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450981355	EF	On-Demand	Anodyne	ACAT	0	47
CC[S@](=O)CC(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450981356	EF	On-Demand	Anodyne	ACAT	0	47
COC(=O)CCCNS(=O)(=O)c1ccc2c(c1)N(C)CC2	ZINC000450981368	DC	On-Demand	Anodyne	HTR7	22	49
Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2c(C)cccc2Cl)cc1	ZINC000450981370	FH	On-Demand	Anodyne	FPR1	28	41
Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2c(C)cccc2Cl)cc1	ZINC000450981371	FH	On-Demand	Anodyne	FPR1	28	41
CC(=O)[C@](C)(O)CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450981372	DD	On-Demand	Anodyne	SIGMAR1	39	43
CC(=O)[C@](C)(O)CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450981372	DD	On-Demand	Anodyne	NPFFR1	52	35
CC(=O)[C@@](C)(O)CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450981373	DD	On-Demand	Anodyne	SIGMAR1	39	43
CC(=O)[C@@](C)(O)CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450981373	DD	On-Demand	Anodyne	NPFFR1	52	35
CC(=O)[C@@](C)(O)CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450981374	DD	On-Demand	Anodyne	SIGMAR1	39	43
CC(=O)[C@@](C)(O)CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450981374	DD	On-Demand	Anodyne	NPFFR1	52	35
CC(=O)[C@](C)(O)CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450981375	DD	On-Demand	Anodyne	SIGMAR1	39	43
CC(=O)[C@](C)(O)CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450981375	DD	On-Demand	Anodyne	NPFFR1	52	35
Cc1cccc2nc(C3CCN(C(=O)c4cccc(C(F)(F)F)n4)CC3)oc12	ZINC000450981392	GJ	On-Demand	Anodyne	ETHR	45	32
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2sccc2Cl)C1	ZINC000450981393	DD	On-Demand	Anodyne	AKR1C3	0	47
NC(=O)[C@H]1CCCN(S(=O)(=O)c2sccc2Cl)C1	ZINC000450981394	DD	On-Demand	Anodyne	AKR1C3	0	47
CC(C)[C@H]1CCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450981396	CG	On-Demand	Anodyne	HRH4	23	60
CC(C)[C@@H]1CCCN(C(=O)c2cc3c([nH]2)CCCC3)C1	ZINC000450981398	CG	On-Demand	Anodyne	HRH4	23	60
COc1cc(Br)c(C(=O)NC2(Cc3ccccc3)CC2)cc1OC	ZINC000450981402	GH	On-Demand	Anodyne	KCNA3	46	38
COc1cc(Br)c(C(=O)NC2(Cc3ccccc3)CC2)cc1OC	ZINC000450981402	GH	On-Demand	Anodyne	SLC12A5	51	36
COC(=O)CCCNS(=O)(=O)c1ccc(OC)cc1Cl	ZINC000450981411	DD	On-Demand	Anodyne	MTNR1A	44	34
Cc1csc(S(=O)(=O)Nc2ccc(CC(=O)N(C)C)cc2)c1	ZINC000450981413	EE	On-Demand	Anodyne	PTPRB	48	32
COc1ccc([C@@H](CNS(=O)(=O)CCC2CCCC2)N2CCOCC2)cc1	ZINC000450981416	GF	On-Demand	Anodyne	CCR3	21	41
CCOC(=O)c1c(CN2CCCC[C@H]2c2nc(O)n[nH]2)nc2ccccc2c1C	ZINC000450981427	GG	On-Demand	Anodyne	COLA	45	36
CCOC(=O)c1c(CN2CCCC[C@H]2c2nc(O)n[nH]2)nc2ccccc2c1C	ZINC000450981427	GG	On-Demand	Anodyne	CPT1A	44	36
CCOC(=O)c1c(CN2CCCC[C@@H]2c2nc(O)n[nH]2)nc2ccccc2c1C	ZINC000450981430	GG	On-Demand	Anodyne	COLA	45	36
CCOC(=O)c1c(CN2CCCC[C@@H]2c2nc(O)n[nH]2)nc2ccccc2c1C	ZINC000450981430	GG	On-Demand	Anodyne	CPT1A	44	36
Cc1nc(C)n(CCCC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)n1	ZINC000450981432	EE	On-Demand	Anodyne	TPP2	43	31
Cc1nc(C)n(CCCC(=O)NC[C@H]2Cc3ccccc3N(C)C2)n1	ZINC000450981444	EE	On-Demand	Anodyne	TPP2	43	31
CCCCOc1cccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450981462	GF	On-Demand	Anodyne	HRH2	40	42
CCCCOc1cccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450981462	GF	On-Demand	Anodyne	COLA	76	48
CCCCOc1cccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450981462	GF	On-Demand	Anodyne	CPT1A	74	48
CCCCOc1cccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450981462	GF	On-Demand	Anodyne	NOS2	15	40
CCCCOc1cccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450981465	GF	On-Demand	Anodyne	HRH2	40	42
CCCCOc1cccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450981465	GF	On-Demand	Anodyne	COLA	76	48
CCCCOc1cccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450981465	GF	On-Demand	Anodyne	CPT1A	74	48
CCCCOc1cccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450981465	GF	On-Demand	Anodyne	NOS2	15	40
CC(C)Oc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981466	GG	On-Demand	Anodyne	P2RY1	50	41
CC(C)Oc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981466	GG	On-Demand	Anodyne	BDKRB1	0	47
CC(C)Oc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981466	GG	On-Demand	Anodyne	GRM4	34	50
CC(C)Oc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981466	GG	On-Demand	Anodyne	MMP2	15	40
CC(C)Oc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981466	GG	On-Demand	Anodyne	PRTN3	54	35
O=S(=O)(CCOCc1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450981467	FE	On-Demand	Anodyne	DRD2	16	46
O=S(=O)(CCOCc1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450981467	FE	On-Demand	Anodyne	DRD4	39	46
O=S(=O)(CCOCc1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450981467	FE	On-Demand	Anodyne	SIGMAR1	49	48
O=S(=O)(CCOCc1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450981467	FE	On-Demand	Anodyne	CCR3	15	40
O=S(=O)(CCOCc1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450981469	FE	On-Demand	Anodyne	DRD2	16	46
O=S(=O)(CCOCc1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450981469	FE	On-Demand	Anodyne	DRD4	39	46
O=S(=O)(CCOCc1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450981469	FE	On-Demand	Anodyne	SIGMAR1	49	48
O=S(=O)(CCOCc1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450981469	FE	On-Demand	Anodyne	CCR3	15	40
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCCc1ccccc1	ZINC000450981476	ED	On-Demand	Anodyne	FKBP1A	34	43
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCCc1ccccc1	ZINC000450981476	ED	On-Demand	Anodyne	COLA	45	39
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCCc1ccccc1	ZINC000450981476	ED	On-Demand	Anodyne	CPT1A	41	39
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCCc1ccccc1	ZINC000450981476	ED	On-Demand	Anodyne	PREP	49	38
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCCc1ccccc1	ZINC000450981477	ED	On-Demand	Anodyne	FKBP1A	34	43
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCCc1ccccc1	ZINC000450981477	ED	On-Demand	Anodyne	COLA	45	39
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCCc1ccccc1	ZINC000450981477	ED	On-Demand	Anodyne	CPT1A	41	39
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCCc1ccccc1	ZINC000450981477	ED	On-Demand	Anodyne	PREP	49	38
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450981484	FD	On-Demand	Anodyne	SCARB1	51	43
C[C@H](C1CC1)N(Cc1ccccc1)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450981487	FD	On-Demand	Anodyne	SCARB1	51	43
CC(C)[C@@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450981496	DH	On-Demand	Anodyne	SFRP1	79	36
CC(C)[C@@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450981496	DH	On-Demand	Anodyne	WNT3	59	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1	ZINC000450981497	EF	On-Demand	Anodyne	CDK2	0	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1	ZINC000450981497	EF	On-Demand	Anodyne	PFK	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1	ZINC000450981497	EF	On-Demand	Anodyne	PKNB	64	39
CC(C)[C@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450981498	DH	On-Demand	Anodyne	SFRP1	99	36
CC(C)[C@H]1CCCN(C(=O)c2cccc(C(F)(F)F)n2)C1	ZINC000450981498	DH	On-Demand	Anodyne	WNT3	67	33
CCOC(=O)c1cc(S(=O)(=O)N(C)Cc2cccnc2)cnc1C(F)F	ZINC000450981502	GE	On-Demand	Anodyne	MMP13	16	43
CCOC(=O)c1cc(S(=O)(=O)N(C)Cc2cccnc2)cnc1C(F)F	ZINC000450981502	GE	On-Demand	Anodyne	ADAM17	22	43
CCOC(=O)c1cc(S(=O)(=O)N(C)Cc2cccnc2)cnc1C(F)F	ZINC000450981502	GE	On-Demand	Anodyne	MMP9	18	43
CCOC(=O)c1cc(S(=O)(=O)N(C)Cc2cccnc2)cnc1C(F)F	ZINC000450981502	GE	On-Demand	Anodyne	MMP1	16	43
CCOC(=O)c1cc(S(=O)(=O)Nc2onc(C)c2C)cnc1C(F)F	ZINC000450981514	GF	On-Demand	Anodyne	EDNRB	40	41
CCOC(=O)c1cc(S(=O)(=O)Nc2onc(C)c2C)cnc1C(F)F	ZINC000450981514	GF	On-Demand	Anodyne	EDNRA	66	48
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	CA2	21	55
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	LPL	44	33
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	CA1	23	43
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	CA4	19	43
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	CA14	15	46
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	EPHX2	16	48
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	TGM2	78	46
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	CA12	16	40
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	CA9	16	55
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	F13A1	110	46
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	P96878_MYCTU	44	37
CC(C)CN1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450981526	FE	On-Demand	Anodyne	NAMPT	38	44
CCC(=O)CCCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450981527	EE	On-Demand	Anodyne	DRD4	43	38
CCC(=O)CCCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450981527	EE	On-Demand	Anodyne	ACHE	35	40
CCC(=O)CCCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450981527	EE	On-Demand	Anodyne	HTR7	32	40
CCC(=O)CCCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450981527	EE	On-Demand	Anodyne	CACNA1G	48	41
CCC(=O)CCCN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450981527	EE	On-Demand	Anodyne	NET	0	40
CC[C@@H](CC(C)C)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450981532	EJ	On-Demand	Anodyne	SMO	44	36
CC[C@H](CC(C)C)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450981534	EJ	On-Demand	Anodyne	SMO	44	36
CCOC(C)(C)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450981539	DF	On-Demand	Anodyne	P2RY12	41	34
CCOC(C)(C)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450981539	DF	On-Demand	Anodyne	CTSV	49	33
CCOC(C)(C)CNC(=O)c1cc(-c2ccccc2)nn1C	ZINC000450981539	DF	On-Demand	Anodyne	AGER	0	40
Cc1noc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1C	ZINC000450981548	GE	On-Demand	Anodyne	EDNRB	62	62
Cc1noc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1C	ZINC000450981548	GE	On-Demand	Anodyne	EDNRA	90	65
Cc1noc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1C	ZINC000450981548	GE	On-Demand	Anodyne	MTNN	71	37
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	MMP13	61	42
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	ADAM17	54	38
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	MMP2	30	40
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	MMP3	49	42
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	MMP8	15	40
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	MMP9	23	40
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	EPHX2	23	47
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	TGM2	74	38
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	MMP7	48	40
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	MMP1	53	42
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	F13A1	76	36
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	LUXN	0	43
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	ADIPOR1	0	45
CC(C)CN1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450981558	GD	On-Demand	Anodyne	ADIPOR2	0	45
FC1(F)CC[C@@H](CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981559	EI	On-Demand	Anodyne	CHRM2	16	41
FC1(F)CC[C@@H](CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981559	EI	On-Demand	Anodyne	CHRM3	18	41
FC1(F)CC[C@@H](CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981559	EI	On-Demand	Anodyne	SIGMAR1	62	42
C[C@H](C(=O)NC1(C#N)CCCCC1)S(=O)(=O)c1cccc(Br)c1	ZINC000450981571	GF	On-Demand	Mild	CTSK	19	49
C[C@H](C(=O)NC1(C#N)CCCCC1)S(=O)(=O)c1cccc(Br)c1	ZINC000450981571	GF	On-Demand	Mild	CTSS	35	49
FC1(F)CC[C@H](CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981577	EI	On-Demand	Anodyne	CHRM2	16	41
FC1(F)CC[C@H](CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981577	EI	On-Demand	Anodyne	CHRM3	18	41
FC1(F)CC[C@H](CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981577	EI	On-Demand	Anodyne	SIGMAR1	62	42
FC1(F)CC[C@H](CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981579	EI	On-Demand	Anodyne	CHRM2	16	41
FC1(F)CC[C@H](CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981579	EI	On-Demand	Anodyne	CHRM3	18	41
FC1(F)CC[C@H](CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981579	EI	On-Demand	Anodyne	SIGMAR1	62	42
FC1(F)CC[C@@H](CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981581	EI	On-Demand	Anodyne	CHRM2	16	41
FC1(F)CC[C@@H](CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981581	EI	On-Demand	Anodyne	CHRM3	18	41
FC1(F)CC[C@@H](CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450981581	EI	On-Demand	Anodyne	SIGMAR1	62	42
COC(=O)CCCNS(=O)(=O)c1cc(Cl)ccc1Br	ZINC000450981588	FE	On-Demand	Anodyne	TBXA2R	42	34
C[C@@H](C(=O)NC1(C#N)CCCCC1)S(=O)(=O)c1cccc(Br)c1	ZINC000450981589	GF	On-Demand	Mild	CTSK	19	49
C[C@@H](C(=O)NC1(C#N)CCCCC1)S(=O)(=O)c1cccc(Br)c1	ZINC000450981589	GF	On-Demand	Mild	CTSS	35	49
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450981599	FG	On-Demand	Anodyne	ACE	45	42
C[C@H](OCCc1ccccc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450981599	FG	On-Demand	Anodyne	TPP2	54	33
C[C@@H](OCCc1ccccc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450981602	FG	On-Demand	Anodyne	ACE	45	42
C[C@@H](OCCc1ccccc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450981602	FG	On-Demand	Anodyne	TPP2	54	33
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450981604	FG	On-Demand	Anodyne	ACE	45	42
C[C@@H](OCCc1ccccc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450981604	FG	On-Demand	Anodyne	TPP2	54	33
C[C@H](OCCc1ccccc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450981605	FG	On-Demand	Anodyne	ACE	45	42
C[C@H](OCCc1ccccc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450981605	FG	On-Demand	Anodyne	TPP2	54	33
Cc1ccc(Nc2nc(CN3CCCC[C@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450981606	FH	On-Demand	Anodyne	SPHK2	51	32
Cc1ccc(Nc2nc(CN3CCCC[C@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450981606	FH	On-Demand	Anodyne	SPHK1	48	38
Cc1ccc(Nc2nc(CN3CCCC[C@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450981606	FH	On-Demand	Anodyne	TRPC6	43	44
Cc1ccc(Nc2nc(CN3CCCC[C@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450981606	FH	On-Demand	Anodyne	TRPC3	41	44
Cc1ccc(Nc2nc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450981608	FH	On-Demand	Anodyne	SPHK2	51	32
Cc1ccc(Nc2nc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450981608	FH	On-Demand	Anodyne	SPHK1	48	38
Cc1ccc(Nc2nc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450981608	FH	On-Demand	Anodyne	TRPC6	43	44
Cc1ccc(Nc2nc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450981608	FH	On-Demand	Anodyne	TRPC3	41	44
CCS(=O)(=O)c1ccc(CN[C@@](C)(CC(=O)OC)c2cccc(F)c2)cc1	ZINC000450981610	GG	On-Demand	Anodyne	RORC	43	41
CC(C)(CNS(=O)(=O)c1cccc2c(Cl)ccnc12)N1CCOCC1	ZINC000450981612	GE	On-Demand	Anodyne	BDKRB2	42	32
CCS(=O)(=O)c1ccc(CN[C@](C)(CC(=O)OC)c2cccc(F)c2)cc1	ZINC000450981613	GG	On-Demand	Anodyne	RORC	43	41
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)n1	ZINC000450981622	GD	On-Demand	Anodyne	PRTN3	52	32
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)n1	ZINC000450981622	GD	On-Demand	Anodyne	LUXN	0	43
CSc1cccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)c1	ZINC000450981623	EG	On-Demand	Anodyne	DRD4	42	36
CSc1cccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)c1	ZINC000450981626	EG	On-Demand	Anodyne	DRD4	42	36
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450981628	DG	On-Demand	Anodyne	TPP2	46	34
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450981629	DG	On-Demand	Anodyne	TPP2	46	34
Cc1cc(C)cc(-c2cc(NS(=O)(=O)c3cn(C)nc3C(F)(F)F)n[nH]2)c1	ZINC000450981641	GG	On-Demand	Anodyne	SGK1	16	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(C)(C)N2CCOCC2)cc1	ZINC000450981651	GD	On-Demand	Anodyne	EPHX2	15	45
CC[C@@H](CO)NC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450981670	CD	On-Demand	Anodyne	MMP13	19	45
Cc1[nH]c(C#N)cc1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000450981678	CE	On-Demand	Mild	PFKFB3	47	32
CN(Cc1ccccc1Cl)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450981682	GF	On-Demand	Anodyne	NR1H3	21	43
CN(Cc1ccccc1Cl)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450981682	GF	On-Demand	Anodyne	NR1H2	18	43
CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)S(=O)(=O)CC(C)(C)CC#N	ZINC000450981688	GG	On-Demand	Mild	PFK	0	40
CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)S(=O)(=O)CC(C)(C)CC#N	ZINC000450981688	GG	On-Demand	Mild	PPX1	0	43
Cc1ccc(CN(C(=O)Cn2nnc(-c3ccncn3)n2)C2CC2)o1	ZINC000450981697	ED	On-Demand	Anodyne	SCARB1	48	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)cc1	ZINC000450981702	GG	On-Demand	Anodyne	CDK2	15	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)cc1	ZINC000450981702	GG	On-Demand	Anodyne	PKNB	53	37
CC(C)Cc1ccc([C@@H](C)NS(=O)(=O)C2(C)CC2)cc1	ZINC000450981712	CG	On-Demand	Anodyne	SLC22A20	0	40
CCOC(C)(C)CNC(=O)c1cc2c(Br)c(F)ccc2[nH]1	ZINC000450981713	FH	On-Demand	Anodyne	PYGL	56	40
CC(C)Cc1ccc([C@H](C)NS(=O)(=O)C2(C)CC2)cc1	ZINC000450981714	CG	On-Demand	Anodyne	SLC22A20	0	40
CC(C)OC(C)(C)C(=O)NCC1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000450981716	EI	On-Demand	Anodyne	ACAT	0	52
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	CA2	19	43
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	BMP1	17	40
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	CA1	27	48
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	MMP13	47	43
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	CA14	20	43
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	MMP2	43	45
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	MMP3	22	42
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	MMP8	21	43
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	MMP9	28	43
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	MMP12	49	41
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	MMP7	24	41
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	ADAMTS4	46	33
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	CA9	18	43
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	LEF	30	42
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	IDO1	32	40
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	MTCA1	25	48
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	P96878_MYCTU	31	48
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	KCNK3	38	41
COc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981722	GG	On-Demand	Anodyne	KCNK9	33	41
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	CA2	19	43
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	BMP1	17	40
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	CA1	27	48
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	MMP13	47	43
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	CA14	20	43
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	MMP2	43	45
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	MMP3	22	42
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	MMP8	21	43
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	MMP9	28	43
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	MMP12	49	41
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	MMP7	24	41
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	ADAMTS4	46	33
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	CA9	18	43
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	LEF	30	42
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	IDO1	32	40
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	MTCA1	25	48
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	P96878_MYCTU	31	48
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	KCNK3	38	41
COc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981723	GG	On-Demand	Anodyne	KCNK9	33	41
CC(C)(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981725	FD	On-Demand	Mild	MMP13	35	42
CC(C)(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981725	FD	On-Demand	Mild	ADAM17	16	42
CC(C)(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981725	FD	On-Demand	Mild	ADAMTS4	58	38
CC(C)(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981725	FD	On-Demand	Mild	LUXN	0	47
CC(C)(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981727	FD	On-Demand	Mild	MMP13	35	42
CC(C)(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981727	FD	On-Demand	Mild	ADAM17	16	42
CC(C)(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981727	FD	On-Demand	Mild	ADAMTS4	58	38
CC(C)(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450981727	FD	On-Demand	Mild	LUXN	0	47
CCN(CC)C(=O)Cc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450981733	GH	On-Demand	Anodyne	CCR5	20	46
CCN(CC)C(=O)Cc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450981733	GH	On-Demand	Anodyne	LIMK2	52	42
Cc1cccc2nc(C3CCN(C(=O)CCCC(=O)C4CC4)CC3)oc12	ZINC000450981734	FH	On-Demand	Anodyne	ETHR	69	37
CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450981737	EH	On-Demand	Anodyne	DRD2	18	43
CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450981737	EH	On-Demand	Anodyne	ACHE	44	46
CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450981737	EH	On-Demand	Anodyne	CHRM3	24	41
CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450981737	EH	On-Demand	Anodyne	PRSS2	45	33
CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450981737	EH	On-Demand	Anodyne	SIGMAR1	36	41
CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450981737	EH	On-Demand	Anodyne	SSTR5	55	38
CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450981737	EH	On-Demand	Anodyne	CCR3	42	45
CCOC(=O)C(C)(C)C1CCN(Cc2cccc(C(C)=O)c2)CC1	ZINC000450981737	EH	On-Demand	Anodyne	CACNA1I	46	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCSc3ccncc32)cc1	ZINC000450981740	GF	On-Demand	Anodyne	CPT1A	0	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCSc3ccncc32)cc1	ZINC000450981740	GF	On-Demand	Anodyne	TGM2	59	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCSc3ccncc32)cc1	ZINC000450981740	GF	On-Demand	Anodyne	F13A1	91	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCSc3ccncc32)cc1	ZINC000450981740	GF	On-Demand	Anodyne	NAMPT	47	36
C[C@@H]1C[C@@H](N2CCOCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450981741	EF	On-Demand	Anodyne	DRD4	0	44
C[C@@H]1C[C@@H](N2CCOCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450981741	EF	On-Demand	Anodyne	CYP2J2	47	34
C[C@H]1C[C@@H](N2CCOCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450981743	EF	On-Demand	Anodyne	DRD4	0	44
C[C@H]1C[C@@H](N2CCOCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450981743	EF	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1C[C@H](N2CCOCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450981745	EF	On-Demand	Anodyne	DRD4	0	44
C[C@@H]1C[C@H](N2CCOCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450981745	EF	On-Demand	Anodyne	CYP2J2	47	34
C[C@H]1C[C@H](N2CCOCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450981748	EF	On-Demand	Anodyne	DRD4	0	44
C[C@H]1C[C@H](N2CCOCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450981748	EF	On-Demand	Anodyne	CYP2J2	47	34
COC(=O)c1ncccc1S(=O)(=O)N(C)C[C@@H]1COc2ccccc2O1	ZINC000450981755	GD	On-Demand	Anodyne	ADRA1D	15	41
COC(=O)c1ncccc1S(=O)(=O)N(C)C[C@@H]1COc2ccccc2O1	ZINC000450981755	GD	On-Demand	Anodyne	ADRA2B	22	41
COC(=O)c1ncccc1S(=O)(=O)N(C)C[C@@H]1COc2ccccc2O1	ZINC000450981755	GD	On-Demand	Anodyne	ADRA2C	15	41
COC(=O)c1ncccc1S(=O)(=O)N(C)C[C@H]1COc2ccccc2O1	ZINC000450981756	GD	On-Demand	Anodyne	ADRA1D	15	41
COC(=O)c1ncccc1S(=O)(=O)N(C)C[C@H]1COc2ccccc2O1	ZINC000450981756	GD	On-Demand	Anodyne	ADRA2B	22	41
COC(=O)c1ncccc1S(=O)(=O)N(C)C[C@H]1COc2ccccc2O1	ZINC000450981756	GD	On-Demand	Anodyne	ADRA2C	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)C)cc1	ZINC000450981758	GF	On-Demand	Anodyne	CA2	17	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)C)cc1	ZINC000450981758	GF	On-Demand	Anodyne	KCNA5	0	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)C)cc1	ZINC000450981758	GF	On-Demand	Anodyne	BDKRB1	0	58
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)C)cc1	ZINC000450981758	GF	On-Demand	Anodyne	GRM4	22	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)C)cc1	ZINC000450981758	GF	On-Demand	Anodyne	PRTN3	64	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)C)cc1	ZINC000450981758	GF	On-Demand	Anodyne	LIMK2	44	39
Cn1cc(S(=O)(=O)Nc2cc3c(cc2F)CCC(=O)N3)c(C(F)(F)F)n1	ZINC000450981764	GE	On-Demand	Anodyne	PKM	47	45
Oc1n[nH]c([C@@H]2CCCCN2CCCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450981770	GH	On-Demand	Anodyne	HRH3	15	40
Oc1n[nH]c([C@@H]2CCCCN2CCCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450981770	GH	On-Demand	Anodyne	COLA	73	45
Oc1n[nH]c([C@@H]2CCCCN2CCCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450981770	GH	On-Demand	Anodyne	CPT1A	70	45
Oc1n[nH]c([C@@H]2CCCCN2CCCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450981770	GH	On-Demand	Anodyne	CHRNA10	23	45
Oc1n[nH]c([C@H]2CCCCN2CCCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450981773	GH	On-Demand	Anodyne	HRH3	15	40
Oc1n[nH]c([C@H]2CCCCN2CCCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450981773	GH	On-Demand	Anodyne	COLA	73	45
Oc1n[nH]c([C@H]2CCCCN2CCCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450981773	GH	On-Demand	Anodyne	CPT1A	70	45
Oc1n[nH]c([C@H]2CCCCN2CCCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450981773	GH	On-Demand	Anodyne	CHRNA10	23	45
Cc1cc(O)ncc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450981774	GD	On-Demand	Anodyne	MTNN	73	38
CCOC(C)(C)CNC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC000450981798	DE	On-Demand	Anodyne	CAPN1	30	41
COc1ccc(CNC(=O)CCN(C)[C@H]2C[C@@H](OC)C2)c(OC)c1	ZINC000450981829	ED	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CCN(C)[C@H]2C[C@@H](OC)C2)c(OC)c1	ZINC000450981829	ED	On-Demand	Anodyne	MTNR1B	40	35
COc1ccc(NS(=O)(=O)c2cnc(O)s2)cc1OCC(F)(F)F	ZINC000450981833	GF	On-Demand	Anodyne	DRTS_TRYCR	44	31
COC(=O)CCCCCNS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450981837	FF	On-Demand	Anodyne	NPY2R	0	41
CC(C)O[C@]1(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)CCOC1	ZINC000450981851	FG	On-Demand	Anodyne	ACAT	0	49
CC(C)O[C@@]1(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)CCOC1	ZINC000450981854	FG	On-Demand	Anodyne	ACAT	0	49
COC(=O)CCCNS(=O)(=O)c1cncc(F)c1	ZINC000450981856	CC	On-Demand	Anodyne	TBXAS1	19	41
CCOC(=O)c1ccc(CN2CCC(CNS(C)(=O)=O)CC2)nc1	ZINC000450981860	FD	On-Demand	Anodyne	HTR4	41	37
CCOC(=O)c1ccc(CN2CCC(CNS(C)(=O)=O)CC2)nc1	ZINC000450981860	FD	On-Demand	Anodyne	SSTR5	57	43
COc1ccccc1[C@H]1CCC[C@@H](C)N1Cc1cccc(S(C)(=O)=O)c1	ZINC000450981862	FI	On-Demand	Anodyne	HCRTR1	27	40
COc1ccccc1[C@H]1CCC[C@@H](C)N1Cc1cccc(S(C)(=O)=O)c1	ZINC000450981862	FI	On-Demand	Anodyne	HCRTR2	25	40
Cc1cc(C)nc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450981864	GE	On-Demand	Anodyne	MTNN	54	37
Cc1cc(C)nc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450981864	GE	On-Demand	Anodyne	FFAR4	31	41
O=S(=O)(Nc1cc(C2CCCC2)[nH]n1)c1sccc1F	ZINC000450981873	DG	On-Demand	Anodyne	PKNB	64	38
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@H]3C(N)=O)ccc2c1	ZINC000450981877	EE	On-Demand	Anodyne	FKBP1A	39	50
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@H]3C(N)=O)ccc2c1	ZINC000450981877	EE	On-Demand	Anodyne	CASP3	31	43
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@H]3C(N)=O)ccc2c1	ZINC000450981877	EE	On-Demand	Anodyne	MMP13	23	50
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@H]3C(N)=O)ccc2c1	ZINC000450981877	EE	On-Demand	Anodyne	MMP3	32	49
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@H]3C(N)=O)ccc2c1	ZINC000450981877	EE	On-Demand	Anodyne	MMP9	24	43
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@H]3C(N)=O)ccc2c1	ZINC000450981877	EE	On-Demand	Anodyne	MMP7	47	50
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@H]3C(N)=O)ccc2c1	ZINC000450981877	EE	On-Demand	Anodyne	MMP1	35	45
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	FKBP1A	75	56
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	CASP3	32	44
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	MMP13	50	49
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	ADAM17	42	39
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	MMP9	27	42
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	FKBP12.6	0	44
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	MMP7	72	49
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	MMP1	48	45
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981879	EF	On-Demand	Anodyne	AKR1C3	0	41
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	FKBP1A	75	56
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	CASP3	32	44
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	MMP13	50	49
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	ADAM17	42	39
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	MMP9	27	42
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	FKBP12.6	0	44
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	MMP7	72	49
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	MMP1	48	45
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450981880	EF	On-Demand	Anodyne	AKR1C3	0	41
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@@H]3C(N)=O)ccc2c1	ZINC000450981882	EE	On-Demand	Anodyne	FKBP1A	39	50
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@@H]3C(N)=O)ccc2c1	ZINC000450981882	EE	On-Demand	Anodyne	CASP3	31	43
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@@H]3C(N)=O)ccc2c1	ZINC000450981882	EE	On-Demand	Anodyne	MMP13	23	50
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@@H]3C(N)=O)ccc2c1	ZINC000450981882	EE	On-Demand	Anodyne	MMP3	32	49
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@@H]3C(N)=O)ccc2c1	ZINC000450981882	EE	On-Demand	Anodyne	MMP9	24	43
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@@H]3C(N)=O)ccc2c1	ZINC000450981882	EE	On-Demand	Anodyne	MMP7	47	50
Cc1ccc2cc(S(=O)(=O)N3CCCC[C@@H]3C(N)=O)ccc2c1	ZINC000450981882	EE	On-Demand	Anodyne	MMP1	35	45
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCOc2ccccc2)c1	ZINC000450981883	FD	On-Demand	Anodyne	DRD4	17	41
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCOc2ccccc2)c1	ZINC000450981883	FD	On-Demand	Anodyne	NR1H3	42	37
CC(C)Cc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n[nH]1	ZINC000450981886	GE	On-Demand	Anodyne	LUXN	0	43
O=C(Cn1nnc(-c2ccncn2)n1)Nc1ccc2c(c1)OCCCO2	ZINC000450981889	FC	On-Demand	Anodyne	SCARB1	42	38
CC(C)[C@H]1CCCN(C(=O)Cc2cc3ccccc3c(O)n2)C1	ZINC000450981893	DG	On-Demand	Anodyne	BIRC2	28	40
CC(C)[C@@H]1CCCN(C(=O)Cc2cc3ccccc3c(O)n2)C1	ZINC000450981894	DG	On-Demand	Anodyne	BIRC2	28	40
Cc1csc(S(=O)(=O)Nc2cc(C3CCCC3)[nH]n2)c1	ZINC000450981900	DG	On-Demand	Anodyne	PKNB	56	36
O=C(CCN1CCCC[C@H]1c1nc(O)n[nH]1)NC(=O)NCc1ccccc1	ZINC000450981905	FD	On-Demand	Anodyne	COLA	33	41
O=C(CCN1CCCC[C@H]1c1nc(O)n[nH]1)NC(=O)NCc1ccccc1	ZINC000450981905	FD	On-Demand	Anodyne	CPT1A	33	41
O=C(CCN1CCCC[C@@H]1c1nc(O)n[nH]1)NC(=O)NCc1ccccc1	ZINC000450981907	FD	On-Demand	Anodyne	COLA	33	41
O=C(CCN1CCCC[C@@H]1c1nc(O)n[nH]1)NC(=O)NCc1ccccc1	ZINC000450981907	FD	On-Demand	Anodyne	CPT1A	33	41
CCCN(CCN1CCCC1)Cc1ccc(C(C)=O)cc1	ZINC000450981911	CG	On-Demand	Anodyne	PLM2_PLAFA	51	47
Cc1csc(S(=O)(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)c1	ZINC000450981912	FF	On-Demand	Anodyne	CYP11B2	30	46
CC(C)c1ccccc1NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450981918	EF	On-Demand	Anodyne	KCNQ2	57	35
CC(C)c1ccccc1NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450981920	EF	On-Demand	Anodyne	KCNQ2	57	35
Cc1cc(N(C)C)cc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981921	GH	On-Demand	Anodyne	CA2	17	51
Cc1cc(N(C)C)cc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981921	GH	On-Demand	Anodyne	LEF	53	34
Cc1cc(N(C)C)cc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981921	GH	On-Demand	Anodyne	FFAR4	35	44
Cc1cc(N(C)C)cc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450981921	GH	On-Demand	Anodyne	PFK	0	41
CN(CC/C=C\c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450981930	CH	On-Demand	Anodyne	SLC6A1	15	40
CN(CC/C=C/c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450981933	CH	On-Demand	Anodyne	SLC6A1	15	40
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	CHRM1	20	45
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	SLC6A4	19	43
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	SLC6A3	47	61
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	SLC18A2	50	37
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	GRIN2B	48	46
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	GALR1	40	34
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	SIGMAR1	19	50
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	SLC18A3	22	45
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	GRIN2C	22	46
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	ACHP_LYMST	30	44
C[C@@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981944	CG	On-Demand	Anodyne	Q8WSF8_APLCA	34	44
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	CHRM1	20	45
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	SLC6A4	19	43
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	SLC6A3	47	61
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	SLC18A2	50	37
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	GRIN2B	48	46
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	GALR1	40	34
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	SIGMAR1	19	50
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	SLC18A3	22	45
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	GRIN2C	22	46
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	ACHP_LYMST	30	44
C[C@H](O)CCN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450981946	CG	On-Demand	Anodyne	Q8WSF8_APLCA	34	44
Cc1noc(NS(=O)(=O)Cc2ccc(C(F)F)cc2)c1C	ZINC000450981948	DG	On-Demand	Anodyne	EDNRA	49	47
CC(=O)N[C@H](C(=O)NC[C@H]1Cc2ccccc2N(C)C1)C(C)(C)C	ZINC000450981969	ED	On-Demand	Anodyne	TPP2	52	33
CC(=O)N[C@H](C(=O)NC[C@@H]1Cc2ccccc2N(C)C1)C(C)(C)C	ZINC000450981971	ED	On-Demand	Anodyne	TPP2	52	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	FKBP1A	37	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	MMP13	44	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	UL80	17	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	CAPNS1	16	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	MMP3	52	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	MMP8	34	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	MMP9	25	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	TGM2	54	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	MMP7	59	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	MMP1	46	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	F13A1	90	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	AKR1C3	0	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2C(N)=O)cc1	ZINC000450981974	FD	On-Demand	Anodyne	NAMPT	19	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	FKBP1A	37	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	MMP13	44	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	UL80	17	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	CAPNS1	16	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	MMP3	52	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	MMP8	34	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	MMP9	25	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	TGM2	54	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	MMP7	59	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	MMP1	46	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	F13A1	90	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	AKR1C3	0	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(N)=O)cc1	ZINC000450981976	FD	On-Demand	Anodyne	NAMPT	19	43
CC(C)[C@@H](NC(=O)Cn1nnc(-c2ccncn2)n1)c1ccc2c(c1)OCCO2	ZINC000450981979	GD	On-Demand	Anodyne	SCARB1	45	39
CC(C)[C@H](NC(=O)Cn1nnc(-c2ccncn2)n1)c1ccc2c(c1)OCCO2	ZINC000450981982	GD	On-Demand	Anodyne	SCARB1	45	39
c1ccc(CN2CC[C@H](N3CCN(CC45CCC(CC4)C5)CC3)C2)cc1	ZINC000450981983	FG	On-Demand	Anodyne	DRD2	0	44
c1ccc(CN2CC[C@H](N3CCN(CC45CCC(CC4)C5)CC3)C2)cc1	ZINC000450981983	FG	On-Demand	Anodyne	DRD3	0	41
c1ccc(CN2CC[C@H](N3CCN(CC45CCC(CC4)C5)CC3)C2)cc1	ZINC000450981983	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
c1ccc(CN2CC[C@H](N3CCN(CC45CCC(CC4)C5)CC3)C2)cc1	ZINC000450981983	FG	On-Demand	Anodyne	SIGMAR1	47	40
COC1(CNC(=O)c2cccnc2-n2cc(Br)cn2)CCCCC1	ZINC000450981984	GG	On-Demand	Anodyne	HCN1	78	38
COC1(CNC(=O)c2cccnc2-n2cc(Br)cn2)CCCCC1	ZINC000450981984	GG	On-Demand	Anodyne	HCN4	57	36
c1ccc(CN2CC[C@@H](N3CCN(CC45CCC(CC4)C5)CC3)C2)cc1	ZINC000450981985	FG	On-Demand	Anodyne	DRD2	0	44
c1ccc(CN2CC[C@@H](N3CCN(CC45CCC(CC4)C5)CC3)C2)cc1	ZINC000450981985	FG	On-Demand	Anodyne	DRD3	0	41
c1ccc(CN2CC[C@@H](N3CCN(CC45CCC(CC4)C5)CC3)C2)cc1	ZINC000450981985	FG	On-Demand	Anodyne	VACHT_TETCF	0	42
c1ccc(CN2CC[C@@H](N3CCN(CC45CCC(CC4)C5)CC3)C2)cc1	ZINC000450981985	FG	On-Demand	Anodyne	SIGMAR1	47	40
Oc1n[nH]c([C@@H]2CCCCN2CCCCCn2nnc(-c3ccccc3)n2)n1	ZINC000450981993	GF	On-Demand	Anodyne	COLA	55	40
Oc1n[nH]c([C@@H]2CCCCN2CCCCCn2nnc(-c3ccccc3)n2)n1	ZINC000450981993	GF	On-Demand	Anodyne	CPT1A	54	40
Oc1n[nH]c([C@H]2CCCCN2CCCCCn2nnc(-c3ccccc3)n2)n1	ZINC000450981996	GF	On-Demand	Anodyne	COLA	55	40
Oc1n[nH]c([C@H]2CCCCN2CCCCCn2nnc(-c3ccccc3)n2)n1	ZINC000450981996	GF	On-Demand	Anodyne	CPT1A	54	40
O=C(NC1CCCC1)c1ccc(NS(=O)(=O)c2cccc(Cl)c2O)cc1	ZINC000450981998	GH	On-Demand	Anodyne	CTSK	15	40
O=C(NC1CCCC1)c1ccc(NS(=O)(=O)c2cccc(Cl)c2O)cc1	ZINC000450981998	GH	On-Demand	Anodyne	CTSS	20	40
COc1ccc(CNC(=O)CCN(C)[C@@H]2CCC[C@H]2O)c(OC)c1	ZINC000450982014	ED	On-Demand	Anodyne	MTNR1A	51	35
CC[S@](=O)CC(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450982020	DD	On-Demand	Anodyne	MTNR1A	19	44
CN1C[C@@H](CNC(=O)CC2CC(F)(F)C2)Cc2ccccc21	ZINC000450982021	DF	On-Demand	Anodyne	TPP2	43	31
CN1C[C@H](CNC(=O)CC2CC(F)(F)C2)Cc2ccccc21	ZINC000450982022	DF	On-Demand	Anodyne	TPP2	43	31
CC[S@@](=O)CC(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450982025	DD	On-Demand	Anodyne	MTNR1A	19	44
Cc1ccc(F)c(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)c1	ZINC000450982037	FJ	On-Demand	Anodyne	ETHR	59	36
COC(=O)c1ccc(CC(=O)N2CCC[C@H](C(C)C)C2)cc1	ZINC000450982045	DF	On-Demand	Anodyne	BIRC2	40	34
COC(=O)c1ccc(CC(=O)N2CCC[C@@H](C(C)C)C2)cc1	ZINC000450982046	DF	On-Demand	Anodyne	BIRC2	40	34
CC[C@@H](CO)NC(=O)c1ccc(Oc2ccc(OC)cc2)cn1	ZINC000450982069	DE	On-Demand	Anodyne	ACACA	54	37
CN(Cc1ccc(Cl)cc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450982075	GF	On-Demand	Anodyne	RORB	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	CA2	39	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	CA6	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	CA1	48	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	MMP13	26	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	CA4	69	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	CA14	16	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	MMP2	17	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	CA9	24	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	LEF	18	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	CYNT	32	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	NCE103	17	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	PFK	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	MTCA1	17	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	MTCA2	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)cc1	ZINC000450982082	GG	On-Demand	Anodyne	A6YCJ1_9METZ	23	40
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)Nc2cc(C)c(O)c(C)c2)CC3)c1	ZINC000450982086	GH	On-Demand	Anodyne	EPHX2	17	40
Cc1cccc(-c2nnc3n2C[C@@H](C(=O)Nc2cc(C)c(O)c(C)c2)CC3)c1	ZINC000450982086	GH	On-Demand	Anodyne	CRK3	0	41
Cc1cccc(-c2nnc3n2C[C@H](C(=O)Nc2cc(C)c(O)c(C)c2)CC3)c1	ZINC000450982087	GH	On-Demand	Anodyne	EPHX2	17	40
Cc1cccc(-c2nnc3n2C[C@H](C(=O)Nc2cc(C)c(O)c(C)c2)CC3)c1	ZINC000450982087	GH	On-Demand	Anodyne	CRK3	0	41
CC[C@@H](CO)NC(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450982117	CE	On-Demand	Anodyne	ROCK2	34	42
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCO1)c1ccc(Br)cc1	ZINC000450982129	GG	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCOC[C@H]1[C@H]1CCCO1)c1ccc(Br)cc1	ZINC000450982130	GG	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCO1)c1ccc(Br)cc1	ZINC000450982131	GG	On-Demand	Anodyne	CYP2J2	49	35
O=C(CCCN1CCOC[C@H]1[C@@H]1CCCO1)c1ccc(Br)cc1	ZINC000450982132	GG	On-Demand	Anodyne	CYP2J2	49	35
COC(=O)CCCNS(=O)(=O)c1ccc2ncccc2c1	ZINC000450982136	DD	On-Demand	Anodyne	TBXA2R	25	42
COC(=O)CCCNS(=O)(=O)c1ccc2ncccc2c1	ZINC000450982136	DD	On-Demand	Anodyne	TBXAS1	44	44
Cc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1sccc1F	ZINC000450982165	FF	On-Demand	Anodyne	MAPK11	43	48
Cc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1sccc1F	ZINC000450982165	FF	On-Demand	Anodyne	MAPK14	64	48
Cc1ccc(C(=O)NC2CC2)cc1NS(=O)(=O)c1sccc1F	ZINC000450982165	FF	On-Demand	Anodyne	MAPK13	78	33
OC[C@@H]1CN(CC/C=C\c2ccccc2)CC[C@H]1C(F)(F)F	ZINC000450982173	DH	On-Demand	Anodyne	SLC6A1	65	37
OC[C@@H]1CN(CC/C=C/c2ccccc2)CC[C@@H]1C(F)(F)F	ZINC000450982174	DH	On-Demand	Anodyne	SLC6A1	65	37
OC[C@@H]1CN(CC/C=C/c2ccccc2)CC[C@H]1C(F)(F)F	ZINC000450982175	DH	On-Demand	Anodyne	SLC6A1	65	37
OC[C@@H]1CN(CC/C=C\c2ccccc2)CC[C@@H]1C(F)(F)F	ZINC000450982176	DH	On-Demand	Anodyne	SLC6A1	65	37
COC(=O)c1ncccc1S(=O)(=O)Nc1cc(NC(=O)C2CC2)ccc1C	ZINC000450982177	GE	On-Demand	Anodyne	GRM4	26	41
COC1(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)CCCCC1	ZINC000450982182	FF	On-Demand	Anodyne	ACAT	0	46
CC[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H](C)[S@@]1=O	ZINC000450982187	CG	On-Demand	Anodyne	CACNA1D	39	40
CC[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H](C)[S@]1=O	ZINC000450982189	CG	On-Demand	Anodyne	CACNA1D	39	40
CC[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)[S@]1=O	ZINC000450982190	CG	On-Demand	Anodyne	CACNA1D	39	40
CC[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@@H](C)[S@@]1=O	ZINC000450982191	CG	On-Demand	Anodyne	CACNA1D	39	40
CCOC(C)(C)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450982193	EG	On-Demand	Anodyne	DRD4	40	30
CCOC(C)(C)CNC(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450982193	EG	On-Demand	Anodyne	MTNR1B	43	44
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H](C)C1	ZINC000450982194	ED	On-Demand	Anodyne	DRD4	40	31
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H](C)C1	ZINC000450982194	ED	On-Demand	Anodyne	HTR7	28	41
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@@H](C)C1	ZINC000450982194	ED	On-Demand	Anodyne	MTNR1A	47	36
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H](C)C1	ZINC000450982195	ED	On-Demand	Anodyne	DRD4	40	31
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H](C)C1	ZINC000450982195	ED	On-Demand	Anodyne	HTR7	28	41
CCN1CCN(CCC(=O)NCc2ccc(OC)cc2OC)[C@H](C)C1	ZINC000450982195	ED	On-Demand	Anodyne	MTNR1A	47	36
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	CA2	22	45
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	ADRB2	26	46
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	ADRB1	21	46
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	ADRB3	30	46
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	CA1	28	45
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	MMP13	43	44
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	CA4	24	45
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	GRM4	19	41
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	MTNR1B	29	53
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	MMP2	31	44
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	MMP12	45	36
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	ADAMTS4	46	37
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	GPR119	26	41
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	PFK	0	42
COCCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982244	GG	On-Demand	Anodyne	LIMK2	41	46
C[C@H](O)C[C@H]1CCCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450982259	EH	On-Demand	Anodyne	SLC18A2	48	38
C[C@@H](O)C[C@@H]1CCCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450982261	EH	On-Demand	Anodyne	SLC18A2	48	38
C[C@H](O)C[C@@H]1CCCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450982262	EH	On-Demand	Anodyne	SLC18A2	48	38
C[C@@H](O)C[C@H]1CCCCCN1Cc1ccn(CCc2ccccc2)n1	ZINC000450982264	EH	On-Demand	Anodyne	SLC18A2	48	38
COc1ccc(NS(=O)(=O)c2sccc2F)cc1N1CCCC1=O	ZINC000450982265	FF	On-Demand	Anodyne	HTR6	0	45
COc1ccc(NS(=O)(=O)c2sccc2F)cc1N1CCCC1=O	ZINC000450982265	FF	On-Demand	Anodyne	GHSR	0	54
COC(=O)CCCNS(=O)(=O)CCC1CCCCC1	ZINC000450982266	CD	On-Demand	Anodyne	BMP1	40	36
O=C(CNC(=O)Nc1cccc(Cl)c1)NC1(Cc2ccccc2)CC1	ZINC000450982268	FG	On-Demand	Anodyne	PPIA	32	45
O=C(CNC(=O)Nc1cccc(Cl)c1)NC1(Cc2ccccc2)CC1	ZINC000450982268	FG	On-Demand	Anodyne	NPFFR2	41	39
O=C(CNC(=O)Nc1cccc(Cl)c1)NC1(Cc2ccccc2)CC1	ZINC000450982268	FG	On-Demand	Anodyne	EPHX2	15	44
O=C(CNC(=O)Nc1cccc(Cl)c1)NC1(Cc2ccccc2)CC1	ZINC000450982268	FG	On-Demand	Anodyne	CACNA1I	15	52
O=C(CNC(=O)Nc1cccc(Cl)c1)NC1(Cc2ccccc2)CC1	ZINC000450982268	FG	On-Demand	Anodyne	ACAT	0	43
O=C(CNC(=O)Nc1cccc(Cl)c1)NC1(Cc2ccccc2)CC1	ZINC000450982268	FG	On-Demand	Anodyne	NPFFR1	58	39
COC(=O)CCCNS(=O)(=O)c1cnc2ccccc2c1	ZINC000450982273	DD	On-Demand	Anodyne	HTR7	22	57
COC(=O)CCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450982275	DE	On-Demand	Anodyne	NPY1R	0	43
COC(=O)CCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450982275	DE	On-Demand	Anodyne	IAP	0	41
O=S(=O)(CCCCF)Nc1cccc(OCCc2ccccc2)c1	ZINC000450982276	FH	On-Demand	Anodyne	TSPAN17	0	45
CCCc1cc(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)no1	ZINC000450982277	FI	On-Demand	Anodyne	SMO	48	37
CCCc1cc(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)no1	ZINC000450982277	FI	On-Demand	Anodyne	ETHR	51	33
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	TBXA2R	39	44
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	TBXAS1	28	45
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	BMP1	74	39
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP13	80	53
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	ADAM17	31	42
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP16	0	43
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP2	63	53
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP3	63	43
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP8	44	53
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP14	47	53
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	ALOX15	30	40
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP9	73	53
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP12	36	53
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP10	41	37
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP7	53	47
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	IAP	0	45
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	CA9	22	40
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	MMP1	63	53
COC(=O)CCCNS(=O)(=O)c1ccc(Oc2ccc(OC)cc2)cc1	ZINC000450982280	GF	On-Demand	Anodyne	FFAR4	19	40
COc1cc(CC(=O)Nc2cc(C)c(O)c(C)c2C)ccc1Cl	ZINC000450982285	EI	On-Demand	Anodyne	NCE103	29	44
COc1cc(CC(=O)Nc2cc(C)c(O)c(C)c2C)ccc1Cl	ZINC000450982285	EI	On-Demand	Anodyne	PFK	0	41
COc1cc(CC(=O)Nc2cc(C)c(O)c(C)c2C)ccc1Cl	ZINC000450982285	EI	On-Demand	Anodyne	CAN2	0	44
COC(=O)CCCCCNS(=O)(=O)c1cccc2c(Cl)ccnc12	ZINC000450982288	FF	On-Demand	Anodyne	ABG	0	40
CC[C@H](O)CC(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450982289	DD	On-Demand	Anodyne	S1PR2	26	41
CC[C@@H](O)CC(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450982290	DD	On-Demand	Anodyne	S1PR2	26	41
CCSc1cccnc1C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450982296	EG	On-Demand	Anodyne	TPP2	53	32
CCSc1cccnc1C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450982297	EG	On-Demand	Anodyne	TPP2	53	32
CC(=O)c1cn(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)nn1	ZINC000450982326	FE	On-Demand	Anodyne	ETHR	41	32
C[C@H](NS(=O)(=O)CC(C)(C)CC#N)c1ccc(-c2ccccc2)cc1	ZINC000450982327	FI	On-Demand	Mild	CTSF	63	38
C[C@H](NS(=O)(=O)CC(C)(C)CC#N)c1ccc(-c2ccccc2)cc1	ZINC000450982327	FI	On-Demand	Mild	CTSK	33	40
C[C@H](NS(=O)(=O)CC(C)(C)CC#N)c1ccc(-c2ccccc2)cc1	ZINC000450982327	FI	On-Demand	Mild	CTSS	19	40
C[C@H](NS(=O)(=O)CC(C)(C)CC#N)c1ccc(-c2ccccc2)cc1	ZINC000450982327	FI	On-Demand	Mild	GRIA4	16	40
C[C@@H](NS(=O)(=O)CC(C)(C)CC#N)c1ccc(-c2ccccc2)cc1	ZINC000450982333	FI	On-Demand	Mild	CTSF	63	38
C[C@@H](NS(=O)(=O)CC(C)(C)CC#N)c1ccc(-c2ccccc2)cc1	ZINC000450982333	FI	On-Demand	Mild	CTSK	33	40
C[C@@H](NS(=O)(=O)CC(C)(C)CC#N)c1ccc(-c2ccccc2)cc1	ZINC000450982333	FI	On-Demand	Mild	CTSS	19	40
C[C@@H](NS(=O)(=O)CC(C)(C)CC#N)c1ccc(-c2ccccc2)cc1	ZINC000450982333	FI	On-Demand	Mild	GRIA4	16	40
Cc1csc(S(=O)(=O)Nc2cccc(C)c2C(=O)N2CCCC2)c1	ZINC000450982359	FG	On-Demand	Anodyne	LPL	42	34
COc1cc(CN2CCOc3cc(O)ccc3C2)ccc1Cl	ZINC000450982362	DG	On-Demand	Anodyne	DRD5	15	40
O=S(=O)(c1cnc(O)s1)N1CCCc2ccc(F)cc21	ZINC000450982363	DE	On-Demand	Anodyne	CYP11B2	24	40
Cc1cccc2nc(C3CCN(C(=O)[C@]4(OC(C)C)CCOC4)CC3)oc12	ZINC000450982366	FG	On-Demand	Anodyne	SMO	41	36
Cc1cccc2nc(C3CCN(C(=O)[C@@]4(OC(C)C)CCOC4)CC3)oc12	ZINC000450982367	FG	On-Demand	Anodyne	SMO	41	36
N#CCc1ccc(OCc2cccc(NS(=O)(=O)CCCCF)c2)cc1	ZINC000450982369	GH	On-Demand	Mild	MAOB	19	41
O=C(Nc1ccccc1NS(=O)(=O)c1sccc1Cl)N1CCCC1	ZINC000450982374	GH	On-Demand	Anodyne	GRM4	19	46
CC(C)(CC#N)CS(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450982379	FF	On-Demand	Mild	LSS	20	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccs2)cc1	ZINC000450982380	FG	On-Demand	Anodyne	CA1	19	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccs2)cc1	ZINC000450982380	FG	On-Demand	Anodyne	CA7	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccs2)cc1	ZINC000450982380	FG	On-Demand	Anodyne	CA5B	36	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccs2)cc1	ZINC000450982380	FG	On-Demand	Anodyne	CA5A	37	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccs2)cc1	ZINC000450982380	FG	On-Demand	Anodyne	CA14	16	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccs2)cc1	ZINC000450982380	FG	On-Demand	Anodyne	MMP2	20	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccs2)cc1	ZINC000450982381	FG	On-Demand	Anodyne	CA1	19	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccs2)cc1	ZINC000450982381	FG	On-Demand	Anodyne	CA7	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccs2)cc1	ZINC000450982381	FG	On-Demand	Anodyne	CA5B	36	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccs2)cc1	ZINC000450982381	FG	On-Demand	Anodyne	CA5A	37	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccs2)cc1	ZINC000450982381	FG	On-Demand	Anodyne	CA14	16	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccs2)cc1	ZINC000450982381	FG	On-Demand	Anodyne	MMP2	20	44
Cc1cccc(Cl)c1C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450982382	FH	On-Demand	Anodyne	CCR5	26	45
Cc1csc(S(=O)(=O)Nc2cccnc2OC(C)C)c1	ZINC000450982389	DG	On-Demand	Anodyne	NFKBIA	0	42
CCCOc1cc(C)ccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450982390	FF	On-Demand	Anodyne	NFKBIA	0	42
Oc1n[nH]c([C@H]2CCCCN2CCOc2cccc(F)c2)n1	ZINC000450982391	DE	On-Demand	Anodyne	CPT1A	79	42
Oc1n[nH]c([C@H]2CCCCN2CCOc2cccc(F)c2)n1	ZINC000450982391	DE	On-Demand	Anodyne	CHRNA10	49	43
Oc1n[nH]c([C@@H]2CCCCN2CCOc2cccc(F)c2)n1	ZINC000450982392	DE	On-Demand	Anodyne	CPT1A	79	42
Oc1n[nH]c([C@@H]2CCCCN2CCOc2cccc(F)c2)n1	ZINC000450982392	DE	On-Demand	Anodyne	CHRNA10	49	43
COCCOc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c(C)c1	ZINC000450982394	FH	On-Demand	Anodyne	PRTN3	52	32
COCCOc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c(C)c1	ZINC000450982394	FH	On-Demand	Anodyne	FFAR4	28	42
Cc1ccc2cc(S(=O)(=O)Nc3ccc(=O)n(CCN(C)C)c3)ccc2c1	ZINC000450982396	GF	On-Demand	Anodyne	HTR6	15	56
Cc1ccc2cc(S(=O)(=O)Nc3ccc(=O)n(CCN(C)C)c3)ccc2c1	ZINC000450982396	GF	On-Demand	Anodyne	MGAT1	44	32
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccs1	ZINC000450982400	GE	On-Demand	Anodyne	ADAMTS4	60	37
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccs1	ZINC000450982400	GE	On-Demand	Anodyne	LUXN	0	44
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccs1	ZINC000450982400	GE	On-Demand	Anodyne	ADIPOR1	0	40
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccs1	ZINC000450982400	GE	On-Demand	Anodyne	ADIPOR2	0	40
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccs1	ZINC000450982401	GE	On-Demand	Anodyne	ADAMTS4	60	37
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccs1	ZINC000450982401	GE	On-Demand	Anodyne	LUXN	0	44
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccs1	ZINC000450982401	GE	On-Demand	Anodyne	ADIPOR1	0	40
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccs1	ZINC000450982401	GE	On-Demand	Anodyne	ADIPOR2	0	40
Oc1n[nH]c([C@H]2CCCCN2CCOc2ccccc2Cl)n1	ZINC000450982408	DF	On-Demand	Anodyne	COLA	47	38
Oc1n[nH]c([C@H]2CCCCN2CCOc2ccccc2Cl)n1	ZINC000450982408	DF	On-Demand	Anodyne	CPT1A	44	38
Oc1n[nH]c([C@@H]2CCCCN2CCOc2ccccc2Cl)n1	ZINC000450982409	DF	On-Demand	Anodyne	COLA	47	38
Oc1n[nH]c([C@@H]2CCCCN2CCOc2ccccc2Cl)n1	ZINC000450982409	DF	On-Demand	Anodyne	CPT1A	44	38
COC(=O)c1ccoc1CSC1CCC1	ZINC000450982415	BF	On-Demand	Anodyne	QRFPR	40	33
CCOC(=O)CSc1nnc(NS(=O)(=O)c2ccc(C3CC3)cc2)s1	ZINC000450982443	GF	On-Demand	Anodyne	CA1	34	40
CCOC(=O)CSc1nnc(NS(=O)(=O)c2ccc(C3CC3)cc2)s1	ZINC000450982443	GF	On-Demand	Anodyne	CA4	57	40
CCOC(C)(C)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450982450	DH	On-Demand	Anodyne	PPARA	0	41
CCOC(C)(C)CNC(=O)c1ccc(C(F)(F)F)cc1C	ZINC000450982450	DH	On-Demand	Anodyne	PPARD	29	45
COC(=O)CCCNS(=O)(=O)c1cc(Cl)c(NC(C)=O)cc1OC	ZINC000450982457	GD	On-Demand	Anodyne	GLMU	0	46
CCOC(C)(C)CNC(=O)c1cc2ccncc2s1	ZINC000450982466	CF	On-Demand	Anodyne	SELE	46	36
CCOC(C)(C)CNC(=O)c1cc2ccncc2s1	ZINC000450982466	CF	On-Demand	Anodyne	VCAM1	46	34
COC(=O)CCCNS(=O)(=O)CCCN1CCOCC1	ZINC000450982468	DB	On-Demand	Anodyne	PAOX	19	47
CO[C@H](C)CS(=O)(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000450982471	GE	On-Demand	Anodyne	DRD4	28	48
CO[C@H](C)CS(=O)(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000450982471	GE	On-Demand	Anodyne	DRD3	23	48
CO[C@@H](C)CS(=O)(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450982473	GE	On-Demand	Anodyne	DRD4	28	48
CO[C@@H](C)CS(=O)(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450982473	GE	On-Demand	Anodyne	DRD3	23	48
CO[C@H](C)CS(=O)(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450982474	GE	On-Demand	Anodyne	DRD4	28	48
CO[C@H](C)CS(=O)(=O)Nc1cc(C)nn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450982474	GE	On-Demand	Anodyne	DRD3	23	48
CO[C@@H](C)CS(=O)(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000450982475	GE	On-Demand	Anodyne	DRD4	28	48
CO[C@@H](C)CS(=O)(=O)Nc1cc(C)nn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000450982475	GE	On-Demand	Anodyne	DRD3	23	48
CCOC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982478	GG	On-Demand	Anodyne	P2RY12	27	41
CCOC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982478	GG	On-Demand	Anodyne	SIGMAR1	30	41
CCOC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982478	GG	On-Demand	Anodyne	FAAH	17	41
CCOC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982478	GG	On-Demand	Anodyne	F2RL3	19	41
CCOC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982478	GG	On-Demand	Anodyne	CCR8	41	40
CCOC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982478	GG	On-Demand	Anodyne	NPFFR1	51	36
CCOC(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982478	GG	On-Demand	Anodyne	NOD2	25	41
CCN(Cc1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1)C(C)=O	ZINC000450982479	GE	On-Demand	Anodyne	NR1I2	43	34
CCN(Cc1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1)C(C)=O	ZINC000450982479	GE	On-Demand	Anodyne	LIMK2	42	37
CCOC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982480	GG	On-Demand	Anodyne	P2RY12	27	41
CCOC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982480	GG	On-Demand	Anodyne	SIGMAR1	30	41
CCOC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982480	GG	On-Demand	Anodyne	FAAH	17	41
CCOC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982480	GG	On-Demand	Anodyne	F2RL3	19	41
CCOC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982480	GG	On-Demand	Anodyne	CCR8	41	40
CCOC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982480	GG	On-Demand	Anodyne	NPFFR1	51	36
CCOC(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)nc1	ZINC000450982480	GG	On-Demand	Anodyne	NOD2	25	41
Cc1cccc(C)c1NC(=O)CNS(=O)(=O)C1(C)CC1	ZINC000450982486	CD	On-Demand	Anodyne	ACAT	0	43
COC(=O)CCCNS(=O)(=O)c1ccc(C)c(C(=O)OC(C)C)c1	ZINC000450982488	FD	On-Demand	Anodyne	LEF	55	35
Oc1ccc2c(c1)OCCN(CC1=CCCCC1)C2	ZINC000450982496	CG	On-Demand	Anodyne	DRD5	16	44
c1ccc(CN2CC[C@]3(CCN(Cc4nnc(C5CC5)s4)C3)C2)cc1	ZINC000450982503	FH	On-Demand	Anodyne	SIGMAR1	43	37
c1ccc(CN2CC[C@@]3(CCN(Cc4nnc(C5CC5)s4)C3)C2)cc1	ZINC000450982512	FH	On-Demand	Anodyne	SIGMAR1	43	37
COC(=O)CCCNS(=O)(=O)c1cnn(-c2ccc(Cl)cc2)c1C	ZINC000450982519	FE	On-Demand	Anodyne	TBXAS1	30	41
CCOC(=O)c1cc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cnc1C(F)F	ZINC000450982525	GF	On-Demand	Anodyne	CDK2	0	41
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@]1=O	ZINC000450982526	EG	On-Demand	Anodyne	DRD2	31	43
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@]1=O	ZINC000450982526	EG	On-Demand	Anodyne	DRD4	0	51
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@]1=O	ZINC000450982526	EG	On-Demand	Anodyne	HTR2A	22	47
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@]1=O	ZINC000450982526	EG	On-Demand	Anodyne	SLC18A3	0	46
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@]1=O	ZINC000450982526	EG	On-Demand	Anodyne	CYP2J2	53	39
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@@]1=O	ZINC000450982527	EG	On-Demand	Anodyne	DRD2	31	43
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@@]1=O	ZINC000450982527	EG	On-Demand	Anodyne	DRD4	0	51
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@@]1=O	ZINC000450982527	EG	On-Demand	Anodyne	HTR2A	22	47
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@@]1=O	ZINC000450982527	EG	On-Demand	Anodyne	SLC18A3	0	46
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@@]1=O	ZINC000450982527	EG	On-Demand	Anodyne	CYP2J2	53	39
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@]1=O	ZINC000450982528	EG	On-Demand	Anodyne	DRD2	31	43
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@]1=O	ZINC000450982528	EG	On-Demand	Anodyne	DRD4	0	51
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@]1=O	ZINC000450982528	EG	On-Demand	Anodyne	HTR2A	22	47
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@]1=O	ZINC000450982528	EG	On-Demand	Anodyne	SLC18A3	0	46
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@H](C)[S@]1=O	ZINC000450982528	EG	On-Demand	Anodyne	CYP2J2	53	39
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450982529	EG	On-Demand	Anodyne	DRD2	31	43
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450982529	EG	On-Demand	Anodyne	DRD4	0	51
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450982529	EG	On-Demand	Anodyne	HTR2A	22	47
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450982529	EG	On-Demand	Anodyne	SLC18A3	0	46
CC[C@@H]1CN(CCCC(=O)c2ccc(F)cc2)C[C@@H](C)[S@@]1=O	ZINC000450982529	EG	On-Demand	Anodyne	CYP2J2	53	39
FC1(F)CCCC[C@H]1CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982533	GH	On-Demand	Anodyne	SIGMAR1	56	39
FC1(F)CCCC[C@@H]1CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982535	GH	On-Demand	Anodyne	SIGMAR1	56	39
FC1(F)CCCC[C@@H]1CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982536	GH	On-Demand	Anodyne	SIGMAR1	56	39
FC1(F)CCCC[C@H]1CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982537	GH	On-Demand	Anodyne	SIGMAR1	56	39
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982550	GG	On-Demand	Anodyne	ACHE	19	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982550	GG	On-Demand	Anodyne	SLC6A3	29	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982550	GG	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982550	GG	On-Demand	Anodyne	SIGMAR1	41	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982550	GG	On-Demand	Anodyne	SLC18A3	28	42
COC(=O)CCCNS(=O)(=O)Cc1ccc(Cl)c(Cl)c1	ZINC000450982551	EE	On-Demand	Anodyne	PFK	0	40
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982554	GG	On-Demand	Anodyne	ACHE	19	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982554	GG	On-Demand	Anodyne	SLC6A3	29	41
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982554	GG	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982554	GG	On-Demand	Anodyne	SIGMAR1	41	42
C[C@H](c1ccccc1)[C@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982554	GG	On-Demand	Anodyne	SLC18A3	28	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982555	GG	On-Demand	Anodyne	ACHE	19	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982555	GG	On-Demand	Anodyne	SLC6A3	29	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982555	GG	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982555	GG	On-Demand	Anodyne	SIGMAR1	41	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982555	GG	On-Demand	Anodyne	SLC18A3	28	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982556	GG	On-Demand	Anodyne	ACHE	19	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982556	GG	On-Demand	Anodyne	SLC6A3	29	41
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982556	GG	On-Demand	Anodyne	VACHT_TETCF	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982556	GG	On-Demand	Anodyne	SIGMAR1	41	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982556	GG	On-Demand	Anodyne	SLC18A3	28	42
COC(=O)c1csc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450982570	FG	On-Demand	Anodyne	SIGMAR1	53	42
COC(=O)c1csc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450982570	FG	On-Demand	Anodyne	CCR8	40	35
COC(=O)c1csc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450982570	FG	On-Demand	Anodyne	NPFFR1	57	39
COC(=O)c1csc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450982571	FG	On-Demand	Anodyne	SIGMAR1	53	42
COC(=O)c1csc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450982571	FG	On-Demand	Anodyne	CCR8	40	35
COC(=O)c1csc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450982571	FG	On-Demand	Anodyne	NPFFR1	57	39
CN(CCN1CCN(Cc2ccccc2)CC1)Cc1ccn(CC(F)(F)F)n1	ZINC000450982592	GF	On-Demand	Anodyne	SIGMAR1	49	42
CCC[C@H](OC)C(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450982595	DF	On-Demand	Anodyne	MTNR1A	33	45
CCC[C@@H](OC)C(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450982596	DF	On-Demand	Anodyne	MTNR1A	33	45
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1OC(C)C	ZINC000450982611	FE	On-Demand	Anodyne	PRTN3	50	33
CCOC(=O)CSc1nnc(NS(=O)(=O)c2sccc2F)s1	ZINC000450982612	GE	On-Demand	Anodyne	PPOX	29	40
Cc1csc(S(=O)(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1	ZINC000450982614	FG	On-Demand	Anodyne	MAPK11	39	46
Cc1csc(S(=O)(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1	ZINC000450982614	FG	On-Demand	Anodyne	MAPK14	53	45
Cc1csc(S(=O)(=O)Nc2cc(C(=O)NC3CC3)ccc2C)c1	ZINC000450982614	FG	On-Demand	Anodyne	MAPK13	48	35
COc1ccc(CNC(=O)CCN(C)C2C[C@@H]3CC[C@H](C2)N3C)c(OC)c1	ZINC000450982620	GE	On-Demand	Anodyne	SLC6A1	49	38
COc1ccc(CNC(=O)CCN(C)C2C[C@@H]3CC[C@H](C2)N3C)c(OC)c1	ZINC000450982620	GE	On-Demand	Anodyne	MTNR1A	53	36
FC1(F)CC(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450982625	DH	On-Demand	Anodyne	SIGMAR1	70	45
FC1(F)CC(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000450982626	DH	On-Demand	Anodyne	SIGMAR1	70	45
COc1cccc(-n2cc(C(=O)N3CCC[C@H](C(C)C)C3)nn2)c1	ZINC000450982627	EF	On-Demand	Anodyne	HPGD	20	47
COc1cccc(-n2cc(C(=O)N3CCC[C@@H](C(C)C)C3)nn2)c1	ZINC000450982628	EF	On-Demand	Anodyne	HPGD	20	47
Cc1cc(C)c(NC(=O)CNS(=O)(=O)c2sccc2Cl)c(C)c1	ZINC000450982636	FG	On-Demand	Anodyne	EDNRA	34	40
CO[C@@H](C)CS(=O)(=O)Nc1n[nH]c(C)c1-c1ccc2c(c1)OCCO2	ZINC000450982637	FD	On-Demand	Anodyne	HSP82	0	48
CO[C@H](C)CS(=O)(=O)Nc1n[nH]c(C)c1-c1ccc2c(c1)OCCO2	ZINC000450982638	FD	On-Demand	Anodyne	HSP82	0	48
COC(=O)CCCNS(=O)(=O)c1sccc1Cl	ZINC000450982648	CD	On-Demand	Anodyne	KAT2B	0	40
Cc1ccc(NC(=O)C2CC2)cc1NS(=O)(=O)c1sccc1Cl	ZINC000450982680	FH	On-Demand	Anodyne	EPHX2	23	44
Cc1ccc(NC(=O)C2CC2)cc1NS(=O)(=O)c1sccc1Cl	ZINC000450982680	FH	On-Demand	Anodyne	TYK2	40	37
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)c(C)c(C)c1O	ZINC000450982724	DG	On-Demand	Anodyne	HDAC1	27	43
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)c(C)c(C)c1O	ZINC000450982724	DG	On-Demand	Anodyne	FASN	22	49
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1O	ZINC000450982725	GE	On-Demand	Anodyne	PRTN3	55	35
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1O	ZINC000450982725	GE	On-Demand	Anodyne	LUXN	0	45
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1O	ZINC000450982725	GE	On-Demand	Anodyne	ADIPOR1	0	41
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1O	ZINC000450982725	GE	On-Demand	Anodyne	ADIPOR2	0	41
Cc1ccc2c(CCNC(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)cn(C)c2c1	ZINC000450982726	GH	On-Demand	Bother	NQO2	30	40
CCOc1ccc(S(=O)(=O)NCCCC(=O)OC)cc1Br	ZINC000450982728	GE	On-Demand	Anodyne	IAP	0	40
CCN(Cc1cccc(NS(=O)(=O)c2sccc2Cl)c1)C(C)=O	ZINC000450982730	FH	On-Demand	Anodyne	LIMK2	35	42
CCOC(=O)c1ccc(CN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)nc1	ZINC000450982737	EE	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1ccc(CN2CC[C@H](C(F)(F)F)[C@H](CO)C2)nc1	ZINC000450982741	EE	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1ccc(CN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)nc1	ZINC000450982742	EE	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1ccc(CN2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)nc1	ZINC000450982743	EE	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1ccc(CN2CCCCC[C@H]2C[C@@H](C)O)nc1	ZINC000450982752	DF	On-Demand	Anodyne	SCARB1	45	33
CCOC(=O)c1ccc(CN2CCCCC[C@@H]2C[C@@H](C)O)nc1	ZINC000450982754	DF	On-Demand	Anodyne	SCARB1	45	33
CCOC(=O)c1ccc(CN2CCCCC[C@@H]2C[C@H](C)O)nc1	ZINC000450982755	DF	On-Demand	Anodyne	SCARB1	45	33
CCOC(=O)c1ccc(CN2CCCCC[C@H]2C[C@H](C)O)nc1	ZINC000450982756	DF	On-Demand	Anodyne	SCARB1	45	33
COCCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n(C)n1	ZINC000450982759	GE	On-Demand	Anodyne	PFK	0	47
CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982761	GG	On-Demand	Anodyne	CA2	20	51
CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982761	GG	On-Demand	Anodyne	CA1	22	41
CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982761	GG	On-Demand	Anodyne	CA4	22	48
CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982761	GG	On-Demand	Anodyne	CA12	15	40
CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982761	GG	On-Demand	Anodyne	CA9	17	51
CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982761	GG	On-Demand	Anodyne	LEF	53	34
CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982761	GG	On-Demand	Anodyne	IDO1	36	45
CC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982761	GG	On-Demand	Anodyne	PFK	0	41
Cc1noc(NS(=O)(=O)Cc2ccc(Br)c(F)c2)c1C	ZINC000450982764	FG	On-Demand	Anodyne	EDNRB	50	46
Cc1noc(NS(=O)(=O)Cc2ccc(Br)c(F)c2)c1C	ZINC000450982764	FG	On-Demand	Anodyne	EDNRA	61	57
O=S(=O)(Nc1cc(C2CCOCC2)[nH]n1)c1sccc1Cl	ZINC000450982765	EF	On-Demand	Anodyne	PKNB	55	34
CCCOc1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450982769	FE	On-Demand	Anodyne	GPR119	22	42
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982772	GD	On-Demand	Anodyne	MMP13	40	39
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982772	GD	On-Demand	Anodyne	ADAMTS4	65	41
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982772	GD	On-Demand	Anodyne	LUXN	0	46
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982772	GD	On-Demand	Anodyne	ADIPOR1	0	42
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982772	GD	On-Demand	Anodyne	ADIPOR2	0	42
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982773	GD	On-Demand	Anodyne	MMP13	40	39
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982773	GD	On-Demand	Anodyne	ADAMTS4	65	41
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982773	GD	On-Demand	Anodyne	LUXN	0	46
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982773	GD	On-Demand	Anodyne	ADIPOR1	0	42
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccn1	ZINC000450982773	GD	On-Demand	Anodyne	ADIPOR2	0	42
Cc1noc(NS(=O)(=O)Cc2c(F)cccc2Cl)c1C	ZINC000450982785	DG	On-Demand	Anodyne	EDNRB	34	44
Cc1noc(NS(=O)(=O)Cc2c(F)cccc2Cl)c1C	ZINC000450982785	DG	On-Demand	Anodyne	EDNRA	49	57
CCN1CCN(CCc2ccc(Cl)cc2)[C@H](C)C1	ZINC000450982787	CF	On-Demand	Anodyne	HRH3	31	40
CCN1CCN(CCc2ccc(Cl)cc2)[C@@H](C)C1	ZINC000450982788	CF	On-Demand	Anodyne	HRH3	31	40
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	LTA4H	18	40
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	TBXA2R	23	50
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	MMP13	38	48
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	ADAM17	19	44
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	MMP2	32	48
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	MMP14	26	48
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	PRTN3	44	30
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	MMP9	21	44
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	ADAMTS4	47	44
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	MMP1	16	43
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	SFRP1	47	31
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	TNKS	47	32
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	LUXN	0	51
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	ADIPOR1	0	48
O=C(COc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1)NC1CC1	ZINC000450982789	GD	On-Demand	Anodyne	ADIPOR2	0	48
C/C=C\COc1cccc(CC(=O)NCC(C)(C)OCC)c1	ZINC000450982790	DG	On-Demand	Anodyne	PDS	47	31
CCCN(Cc1ccc(C)cc1)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450982796	FD	On-Demand	Anodyne	SCARB1	45	40
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21	ZINC000450982807	CG	On-Demand	Anodyne	HSD17B2	74	36
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21	ZINC000450982808	CG	On-Demand	Anodyne	HSD17B2	74	36
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21	ZINC000450982809	CG	On-Demand	Anodyne	HSD17B2	74	36
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21	ZINC000450982810	CG	On-Demand	Anodyne	HSD17B2	74	36
COc1cc(C)c(NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C)cc1F	ZINC000450982822	FH	On-Demand	Anodyne	ANPEP	30	43
COc1ccc(C(=O)N2CCC[C@H](C(C)C)C2)cc1S(C)(=O)=O	ZINC000450982830	EF	On-Demand	Anodyne	GRM3	25	40
COc1ccc(C(=O)N2CCC[C@H](C(C)C)C2)cc1S(C)(=O)=O	ZINC000450982830	EF	On-Demand	Anodyne	L3MBTL3	62	38
COc1ccc(C(=O)N2CCC[C@H](C(C)C)C2)cc1S(C)(=O)=O	ZINC000450982830	EF	On-Demand	Anodyne	HPGD	24	46
COc1ccc(C(=O)N2CCC[C@@H](C(C)C)C2)cc1S(C)(=O)=O	ZINC000450982831	EF	On-Demand	Anodyne	GRM3	25	40
COc1ccc(C(=O)N2CCC[C@@H](C(C)C)C2)cc1S(C)(=O)=O	ZINC000450982831	EF	On-Demand	Anodyne	L3MBTL3	62	38
COc1ccc(C(=O)N2CCC[C@@H](C(C)C)C2)cc1S(C)(=O)=O	ZINC000450982831	EF	On-Demand	Anodyne	HPGD	24	46
COC(=O)CCCNS(=O)(=O)c1ccc(Cl)cc1Br	ZINC000450982838	FE	On-Demand	Anodyne	TBXA2R	42	34
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C1CC1	ZINC000450982843	DH	On-Demand	Anodyne	MAPK14	22	44
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C1CC1	ZINC000450982843	DH	On-Demand	Anodyne	PRNP	51	41
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C1CC1	ZINC000450982843	DH	On-Demand	Anodyne	HDAC1	32	40
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C1CC1	ZINC000450982843	DH	On-Demand	Anodyne	FASN	27	48
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C1CC1	ZINC000450982843	DH	On-Demand	Anodyne	P4HTM	0	43
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C1CC1	ZINC000450982843	DH	On-Demand	Anodyne	MCHR1	0	54
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C1CC1	ZINC000450982843	DH	On-Demand	Anodyne	DGAT1	49	43
Cc1cc(NC(=O)c2ccc(N3CCC3)nc2)ccc1C1CC1	ZINC000450982843	DH	On-Demand	Anodyne	HSPB1	0	44
CC(=O)[C@@](C)(O)CN(C)CCc1nc(-c2ccccc2)no1	ZINC000450982845	DD	On-Demand	Anodyne	TSPO	16	49
CC(=O)[C@](C)(O)CN(C)CCc1nc(-c2ccccc2)no1	ZINC000450982846	DD	On-Demand	Anodyne	TSPO	16	49
O=C(NC1(Cc2ccccc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450982851	DF	On-Demand	Anodyne	HDAC1	23	45
O=C(NC1(Cc2ccccc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450982851	DF	On-Demand	Anodyne	SMO	22	46
O=C(NC1(Cc2ccccc2)CC1)c1ccc(N2CCC2)nc1	ZINC000450982851	DF	On-Demand	Anodyne	SLC12A5	50	35
COC(=O)CCCNS(=O)(=O)c1ccc2nc(C)sc2c1	ZINC000450982856	ED	On-Demand	Anodyne	CA2	20	41
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450982868	GF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450982868	GF	On-Demand	Anodyne	MTNR1A	50	36
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450982868	GF	On-Demand	Anodyne	MTNR1B	47	36
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2C[C@@H](C)O)c(OC)c1	ZINC000450982868	GF	On-Demand	Anodyne	ACKR3	68	35
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450982869	GF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450982869	GF	On-Demand	Anodyne	MTNR1A	50	36
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450982869	GF	On-Demand	Anodyne	MTNR1B	47	36
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2C[C@H](C)O)c(OC)c1	ZINC000450982869	GF	On-Demand	Anodyne	ACKR3	68	35
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450982870	GF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450982870	GF	On-Demand	Anodyne	MTNR1A	50	36
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450982870	GF	On-Demand	Anodyne	MTNR1B	47	36
COc1ccc(CNC(=O)CCN2CCCCC[C@@H]2C[C@@H](C)O)c(OC)c1	ZINC000450982870	GF	On-Demand	Anodyne	ACKR3	68	35
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450982871	GF	On-Demand	Anodyne	HTR7	27	40
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450982871	GF	On-Demand	Anodyne	MTNR1A	50	36
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450982871	GF	On-Demand	Anodyne	MTNR1B	47	36
COc1ccc(CNC(=O)CCN2CCCCC[C@H]2C[C@H](C)O)c(OC)c1	ZINC000450982871	GF	On-Demand	Anodyne	ACKR3	68	35
COC(=O)CCCNS(=O)(=O)Cc1cc(OC)ccc1Br	ZINC000450982875	GD	On-Demand	Anodyne	BMP1	45	35
COC(=O)CCCNS(=O)(=O)Cc1cc(OC)ccc1Br	ZINC000450982875	GD	On-Demand	Anodyne	MTNR1A	43	38
CCc1cc(CCCN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)on1	ZINC000450982877	FH	On-Demand	Anodyne	SIGMAR1	40	40
CCc1cc(CCCN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)on1	ZINC000450982878	FH	On-Demand	Anodyne	SIGMAR1	40	40
Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982888	EG	On-Demand	Anodyne	PPIA	28	41
Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450982888	EG	On-Demand	Anodyne	PFK	0	43
CCOC(=O)c1ccc(CN(C)C2C[C@@H]3CC[C@H](C2)N3C)nc1	ZINC000450982892	DE	On-Demand	Anodyne	GLRA1	48	41
C[C@@H](O)CCN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450982893	CE	On-Demand	Anodyne	SIGMAR1	64	42
C[C@@H](O)CCN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450982893	CE	On-Demand	Anodyne	NPFFR1	47	33
C[C@H](O)CCN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450982894	CE	On-Demand	Anodyne	SIGMAR1	64	42
C[C@H](O)CCN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450982894	CE	On-Demand	Anodyne	NPFFR1	47	33
C[C@@H](O)CCN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450982895	CE	On-Demand	Anodyne	SIGMAR1	64	42
C[C@@H](O)CCN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450982895	CE	On-Demand	Anodyne	NPFFR1	47	33
C[C@H](O)CCN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450982896	CE	On-Demand	Anodyne	SIGMAR1	64	42
C[C@H](O)CCN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450982896	CE	On-Demand	Anodyne	NPFFR1	47	33
CC(=O)[C@@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982904	ED	On-Demand	Anodyne	DRD2	0	41
CC(=O)[C@@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982904	ED	On-Demand	Anodyne	DRD4	44	40
CC(=O)[C@@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982904	ED	On-Demand	Anodyne	ACHE	35	46
CC(=O)[C@@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982904	ED	On-Demand	Anodyne	SIGMAR1	55	41
CC(=O)[C@@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982904	ED	On-Demand	Anodyne	SLC18A3	26	42
CC(=O)[C@@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982905	ED	On-Demand	Anodyne	DRD2	0	41
CC(=O)[C@@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982905	ED	On-Demand	Anodyne	DRD4	44	40
CC(=O)[C@@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982905	ED	On-Demand	Anodyne	ACHE	35	46
CC(=O)[C@@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982905	ED	On-Demand	Anodyne	SIGMAR1	55	41
CC(=O)[C@@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982905	ED	On-Demand	Anodyne	SLC18A3	26	42
CC(=O)[C@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982906	ED	On-Demand	Anodyne	DRD2	0	41
CC(=O)[C@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982906	ED	On-Demand	Anodyne	DRD4	44	40
CC(=O)[C@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982906	ED	On-Demand	Anodyne	ACHE	35	46
CC(=O)[C@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982906	ED	On-Demand	Anodyne	SIGMAR1	55	41
CC(=O)[C@](C)(O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982906	ED	On-Demand	Anodyne	SLC18A3	26	42
CC(=O)[C@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982907	ED	On-Demand	Anodyne	DRD2	0	41
CC(=O)[C@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982907	ED	On-Demand	Anodyne	DRD4	44	40
CC(=O)[C@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982907	ED	On-Demand	Anodyne	ACHE	35	46
CC(=O)[C@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982907	ED	On-Demand	Anodyne	SIGMAR1	55	41
CC(=O)[C@](C)(O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450982907	ED	On-Demand	Anodyne	SLC18A3	26	42
Cc1csc(S(=O)(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)c1	ZINC000450982908	GJ	On-Demand	Anodyne	EPHX2	19	40
Cc1cc(NS(=O)(=O)c2ccc(C3CC3)cc2)n(C2CCOCC2)n1	ZINC000450982909	FG	On-Demand	Anodyne	FPR1	16	54
COC(=O)CCCNS(=O)(=O)c1ccccc1Cn1cncn1	ZINC000450982910	EC	On-Demand	Anodyne	HIS3	55	41
COC(=O)CCCNS(=O)(=O)c1ccccc1Cn1cncn1	ZINC000450982910	EC	On-Demand	Anodyne	CYP74A	0	47
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450982911	GE	On-Demand	Anodyne	ADRB3	48	38
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450982911	GE	On-Demand	Anodyne	ALPL	27	42
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450982911	GE	On-Demand	Anodyne	MTNN	80	40
Cc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450982911	GE	On-Demand	Anodyne	ALPI	15	41
CC[C@@H](O)CC(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000450982925	BF	On-Demand	Anodyne	SLC1A1	58	40
CC[C@@H](O)CC(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000450982925	BF	On-Demand	Anodyne	SLC1A3	62	40
CC[C@@H](O)CC(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000450982925	BF	On-Demand	Anodyne	SLC1A2	68	40
CC[C@H](O)CC(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000450982926	BF	On-Demand	Anodyne	SLC1A1	58	40
CC[C@H](O)CC(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000450982926	BF	On-Demand	Anodyne	SLC1A3	62	40
CC[C@H](O)CC(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000450982926	BF	On-Demand	Anodyne	SLC1A2	68	40
FC(F)(F)Cn1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450982928	GH	On-Demand	Anodyne	SIGMAR1	26	40
FC(F)(F)Cn1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000450982929	GH	On-Demand	Anodyne	SIGMAR1	26	40
COC(=O)CCCNS(=O)(=O)c1c(C(=O)OC)sc2ccccc12	ZINC000450982973	FD	On-Demand	Anodyne	FAS	20	41
O=S(=O)(c1cnc(O)s1)N1CCCc2cc(OC(F)(F)F)ccc21	ZINC000450982975	GF	On-Demand	Anodyne	CYP11B2	29	52
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](C(C)C)C2)c1	ZINC000450982980	DH	On-Demand	Anodyne	SLC6A1	0	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](C(C)C)C2)c1	ZINC000450982980	DH	On-Demand	Anodyne	NPBWR1	56	32
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](C(C)C)C2)c1	ZINC000450982980	DH	On-Demand	Anodyne	GPR88	0	42
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H](C(C)C)C2)c1	ZINC000450982981	DH	On-Demand	Anodyne	SLC6A1	0	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H](C(C)C)C2)c1	ZINC000450982981	DH	On-Demand	Anodyne	NPBWR1	56	32
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H](C(C)C)C2)c1	ZINC000450982981	DH	On-Demand	Anodyne	GPR88	0	42
CCSc1cccnc1C(=O)Nc1cc(F)c(OC)cc1C	ZINC000450982991	DH	On-Demand	Anodyne	MAP1	50	36
COC(=O)c1coc(CN(C)CCN2CCN(Cc3ccccc3)CC2)n1	ZINC000450983000	FD	On-Demand	Anodyne	CASR	47	38
COC(=O)c1coc(CN(C)CCN2CCN(Cc3ccccc3)CC2)n1	ZINC000450983000	FD	On-Demand	Anodyne	SIGMAR1	65	40
COC(=O)c1coc(CN(C)CCN2CCN(Cc3ccccc3)CC2)n1	ZINC000450983000	FD	On-Demand	Anodyne	FAAH	27	42
COC(=O)c1coc(CN(C)CCN2CCN(Cc3ccccc3)CC2)n1	ZINC000450983000	FD	On-Demand	Anodyne	CACNA1G	28	47
COC(=O)c1coc(CN2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)n1	ZINC000450983011	EG	On-Demand	Anodyne	SLC6A3	17	45
CC[C@@H](C(=O)OC)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450983013	DE	On-Demand	Anodyne	CACNA1H	23	40
CC[C@@H](C(=O)OC)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450983013	DE	On-Demand	Anodyne	ABCC1	41	34
CC[C@H](C(=O)OC)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450983014	DE	On-Demand	Anodyne	CACNA1H	23	40
CC[C@H](C(=O)OC)N1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450983014	DE	On-Demand	Anodyne	ABCC1	41	34
N#CCc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)c(Cl)c1	ZINC000450983042	ED	On-Demand	Mild	AKR1C3	0	42
N#CCc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)c(Cl)c1	ZINC000450983043	ED	On-Demand	Mild	AKR1C3	0	42
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	CHRM2	21	56
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	DRD2	20	43
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	DRD4	36	43
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	ACHE	24	42
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	DRD3	0	43
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	OPRD1	15	44
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	OPRK1	17	46
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	CHRM3	30	56
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	SIGMAR1	73	43
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	FAAH	22	42
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	MCHR2	74	37
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	CCR8	51	47
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	NPFFR1	57	37
CC(=O)c1cccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983046	EH	On-Demand	Anodyne	SLC12A5	45	32
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	CHRM2	21	56
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	DRD2	20	43
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	DRD4	36	43
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	ACHE	24	42
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	DRD3	0	43
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	OPRD1	15	44
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	OPRK1	17	46
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	CHRM3	30	56
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	SIGMAR1	73	43
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	FAAH	22	42
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	MCHR2	74	37
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	CCR8	51	47
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	NPFFR1	57	37
CC(=O)c1cccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000450983047	EH	On-Demand	Anodyne	SLC12A5	45	32
COC(=O)CCCNS(=O)(=O)c1ccc(OC)cc1F	ZINC000450983062	DD	On-Demand	Anodyne	MTNR1A	42	34
CCN(C)C(=O)c1cccc(S(=O)(=O)NCCCC(=O)OC)c1	ZINC000450983069	ED	On-Demand	Anodyne	AKR1C3	15	45
C[C@H](CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1)S(C)(=O)=O	ZINC000450983082	EE	On-Demand	Anodyne	SIGMAR1	25	42
C[C@H](CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1)S(C)(=O)=O	ZINC000450983082	EE	On-Demand	Anodyne	NPFFR1	42	32
C[C@@H](CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)S(C)(=O)=O	ZINC000450983083	EE	On-Demand	Anodyne	SIGMAR1	25	42
C[C@@H](CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)S(C)(=O)=O	ZINC000450983083	EE	On-Demand	Anodyne	NPFFR1	42	32
C[C@H](CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)S(C)(=O)=O	ZINC000450983084	EE	On-Demand	Anodyne	SIGMAR1	25	42
C[C@H](CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1)S(C)(=O)=O	ZINC000450983084	EE	On-Demand	Anodyne	NPFFR1	42	32
C[C@@H](CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1)S(C)(=O)=O	ZINC000450983085	EE	On-Demand	Anodyne	SIGMAR1	25	42
C[C@@H](CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1)S(C)(=O)=O	ZINC000450983085	EE	On-Demand	Anodyne	NPFFR1	42	32
CC(C)[C@@H]1CCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450983097	CG	On-Demand	Anodyne	HPGD	43	50
CC(C)[C@H]1CCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450983098	CG	On-Demand	Anodyne	HPGD	43	50
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450983114	EF	On-Demand	Anodyne	CA1	23	42
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450983114	EF	On-Demand	Anodyne	CA4	23	43
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450983114	EF	On-Demand	Anodyne	PFK	0	40
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450983114	EF	On-Demand	Anodyne	NAMPT	24	42
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2ccc(F)cc21	ZINC000450983116	FE	On-Demand	Anodyne	CYP11B2	29	42
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2ccc(F)cc21	ZINC000450983116	FE	On-Demand	Anodyne	CPT1A	20	41
CC(=O)[C@@](C)(O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450983130	ED	On-Demand	Anodyne	DRD4	40	35
CC(=O)[C@@](C)(O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450983130	ED	On-Demand	Anodyne	ACHE	32	45
CC(=O)[C@@](C)(O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450983130	ED	On-Demand	Anodyne	SIGMAR1	73	45
CC(=O)[C@](C)(O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450983131	ED	On-Demand	Anodyne	DRD4	40	35
CC(=O)[C@](C)(O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450983131	ED	On-Demand	Anodyne	ACHE	32	45
CC(=O)[C@](C)(O)CN(C)CCN1CCN(Cc2ccccc2)CC1	ZINC000450983131	ED	On-Demand	Anodyne	SIGMAR1	73	45
Cc1csc(S(=O)(=O)Nc2c(C)cccc2C(=O)N2CCC(O)CC2)c1	ZINC000450983132	GF	On-Demand	Anodyne	CCR8	61	36
COC(=O)CCCNS(=O)(=O)c1ccc(OC)c(C(=O)OC)c1	ZINC000450983145	EC	On-Demand	Anodyne	IAP	0	45
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21	ZINC000450983155	CE	On-Demand	Anodyne	HSD17B2	46	33
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21	ZINC000450983156	CE	On-Demand	Anodyne	HSD17B2	46	33
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21	ZINC000450983157	CE	On-Demand	Anodyne	HSD17B2	46	33
C[C@H](O)CCN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21	ZINC000450983158	CE	On-Demand	Anodyne	HSD17B2	46	33
CC(C)c1ccc(CN(C(=O)Cn2nnc(-c3ccncn3)n2)C2CC2)cc1	ZINC000450983163	GE	On-Demand	Anodyne	SCARB1	53	42
CN(CCCC(=O)c1ccc(F)cc1)[C@@H]1CCC[C@H]1O	ZINC000450983168	CF	On-Demand	Anodyne	DRD4	0	42
CCSc1cccnc1C(=O)Nc1cc(C)c(O)c(C)c1C	ZINC000450983190	DI	On-Demand	Anodyne	MAP1	48	38
COc1cccc(OCCC(=O)Nc2cc(C)c(O)c(C)c2C)c1	ZINC000450983217	EH	On-Demand	Anodyne	MTNR1A	44	48
COc1cccc(OCCC(=O)Nc2cc(C)c(O)c(C)c2C)c1	ZINC000450983217	EH	On-Demand	Anodyne	MTNR1B	44	48
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cnn(C)c2)cc1	ZINC000450983223	FD	On-Demand	Anodyne	MTNN	79	39
CC(C)c1nnc(CN(C)CCN2CCN(Cc3ccccc3)CC2)s1	ZINC000450983225	FF	On-Demand	Anodyne	SIGMAR1	45	42
O=C(Cn1nnc(-c2ccncn2)n1)NC(=O)NC1CCCCC1	ZINC000450983227	EC	On-Demand	Anodyne	SCARB1	55	43
CN(Cc1ccco1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450983241	FD	On-Demand	Anodyne	LUXN	0	44
CN(Cc1ccco1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450983241	FD	On-Demand	Anodyne	ADIPOR1	0	40
CN(Cc1ccco1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450983241	FD	On-Demand	Anodyne	ADIPOR2	0	40
COCc1cc(Cl)cc(S(=O)(=O)NCCCC(=O)OC)c1	ZINC000450983245	ED	On-Demand	Anodyne	TBXA2R	45	36
COCc1cc(Cl)cc(S(=O)(=O)NCCCC(=O)OC)c1	ZINC000450983245	ED	On-Demand	Anodyne	TBXAS1	25	42
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2cc(C)cc(C)n2)c1	ZINC000450983250	FH	On-Demand	Anodyne	FFAR4	24	42
CCCCCS(=O)(=O)NCCCC(=O)OC	ZINC000450983265	CD	On-Demand	Anodyne	RELA	21	49
COc1ccc(CNC(=O)CCN[C@H]2CSC[C@H]2C)c(OC)c1	ZINC000450983274	EE	On-Demand	Anodyne	MTNR1A	51	36
COc1ccc(CNC(=O)CCN[C@@H]2CSC[C@H]2C)c(OC)c1	ZINC000450983275	EE	On-Demand	Anodyne	MTNR1A	51	36
COc1ccc(CNC(=O)CCN[C@@H]2CSC[C@@H]2C)c(OC)c1	ZINC000450983276	EE	On-Demand	Anodyne	MTNR1A	51	36
COc1ccc(CNC(=O)CCN[C@H]2CSC[C@@H]2C)c(OC)c1	ZINC000450983277	EE	On-Demand	Anodyne	MTNR1A	51	36
Cc1nc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)cs1	ZINC000450983290	FI	On-Demand	Anodyne	PRCP	22	40
Cc1nc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)cs1	ZINC000450983290	FI	On-Demand	Anodyne	ADAM17	0	40
Cc1nc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)cs1	ZINC000450983290	FI	On-Demand	Anodyne	COLA	137	50
Cc1nc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)cs1	ZINC000450983290	FI	On-Demand	Anodyne	CPT1A	128	50
Cc1nc([C@H]2CCCN2C(=O)Cc2scnc2-c2ccccc2)cs1	ZINC000450983290	FI	On-Demand	Anodyne	PREP	48	34
C[C@@H](CN1CCOc2cc(O)ccc2C1)S(C)(=O)=O	ZINC000450983291	CD	On-Demand	Anodyne	DRD5	16	44
C[C@H](CN1CCOc2cc(O)ccc2C1)S(C)(=O)=O	ZINC000450983292	CD	On-Demand	Anodyne	DRD5	16	44
CC(C)[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450983293	CH	On-Demand	Anodyne	L3MBTL1	0	42
CC(C)[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450983293	CH	On-Demand	Anodyne	L3MBTL3	49	42
CC(C)[C@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450983293	CH	On-Demand	Anodyne	HPGD	43	51
CC(C)[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450983294	CH	On-Demand	Anodyne	L3MBTL1	0	42
CC(C)[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450983294	CH	On-Demand	Anodyne	L3MBTL3	49	42
CC(C)[C@@H]1CCCN(C(=O)c2ccc3cnccc3c2)C1	ZINC000450983294	CH	On-Demand	Anodyne	HPGD	43	51
N#CC1(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCC1	ZINC000450983297	EF	On-Demand	Mild	VACHT_TETCF	0	40
N#CC1(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCC1	ZINC000450983298	EF	On-Demand	Mild	VACHT_TETCF	0	40
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1F	ZINC000450983303	GE	On-Demand	Anodyne	GHSR	0	41
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1F	ZINC000450983303	GE	On-Demand	Anodyne	LUXN	0	43
CC[C@@H](O)CC(=O)NC1(Cc2ccccc2)CC1	ZINC000450983304	BE	On-Demand	Anodyne	PDS	40	33
CC[C@H](O)CC(=O)NC1(Cc2ccccc2)CC1	ZINC000450983305	BE	On-Demand	Anodyne	PDS	40	33
COC(=O)CCCNS(=O)(=O)c1ccc(Br)c(OC)c1	ZINC000450983310	FD	On-Demand	Anodyne	IAP	0	43
COC(=O)CCCNS(=O)(=O)c1ccc(C(F)(F)F)c(F)c1	ZINC000450983315	EE	On-Demand	Anodyne	SFRP1	73	33
Cn1nc(C(C)(C)C)cc1NC(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450983326	EC	On-Demand	Anodyne	MAPK14	0	45
N#CCc1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)c(Cl)c1	ZINC000450983327	EF	On-Demand	Mild	PKNB	45	39
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)C[C@H]1CCCC1(F)F	ZINC000450983334	EE	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)C[C@@H]1CCCC1(F)F	ZINC000450983335	EE	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)C[C@@H]1CCCC1(F)F	ZINC000450983336	EE	On-Demand	Anodyne	FKBP12.6	0	43
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)C[C@H]1CCCC1(F)F	ZINC000450983337	EE	On-Demand	Anodyne	FKBP12.6	0	43
CC(C)[C@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450983349	EG	On-Demand	Anodyne	BIRC2	52	42
CC(C)[C@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450983349	EG	On-Demand	Anodyne	THYX_PBCV1	0	41
CC(C)[C@@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450983351	EG	On-Demand	Anodyne	BIRC2	52	42
CC(C)[C@@H]1CCCN(C(=O)c2cn(CCc3ccccc3)nn2)C1	ZINC000450983351	EG	On-Demand	Anodyne	THYX_PBCV1	0	41
COc1cc(NS(=O)(=O)CCCCF)ccc1NC(=O)c1cccnc1	ZINC000450983358	GF	On-Demand	Anodyne	LDLR	0	44
COc1cc(NS(=O)(=O)CCCCF)ccc1NC(=O)c1cccnc1	ZINC000450983358	GF	On-Demand	Anodyne	ROCK2	40	37
COc1cc(C)c(NC(=O)c2ccc(N3CCC3)nc2)cc1F	ZINC000450983359	DG	On-Demand	Anodyne	HDAC1	26	40
CCSc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450983371	GG	On-Demand	Anodyne	CA2	36	50
CCSc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450983371	GG	On-Demand	Anodyne	CA1	43	50
CCSc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450983371	GG	On-Demand	Anodyne	CA4	65	50
CCSc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450983371	GG	On-Demand	Anodyne	CA14	15	42
CCSc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450983371	GG	On-Demand	Anodyne	CA9	20	50
CCSc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450983371	GG	On-Demand	Anodyne	LEF	19	51
CCSc1nnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450983371	GG	On-Demand	Anodyne	PFK	0	40
COC(=O)c1ncccc1S(=O)(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000450983384	GD	On-Demand	Anodyne	HCN1	63	36
COC(=O)c1ncccc1S(=O)(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000450983384	GD	On-Demand	Anodyne	HCN4	54	35
CN(CCN1CCOc2cc(O)ccc2C1)Cc1ccccc1	ZINC000450983407	DF	On-Demand	Anodyne	DRD5	18	48
CN(CCN1CCOc2cc(O)ccc2C1)Cc1ccccc1	ZINC000450983407	DF	On-Demand	Anodyne	SIGMAR1	19	45
CNC(=O)c1ccc(OC)c(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450983420	GE	On-Demand	Anodyne	CPT1A	46	32
CNC(=O)c1ccc(OC)c(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450983421	GE	On-Demand	Anodyne	CPT1A	46	32
CC(=O)c1ccc(CN2CCOc3ccc(C)cc3C2)cc1	ZINC000450983428	CH	On-Demand	Anodyne	NOD2	42	36
COc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983438	EE	On-Demand	Anodyne	P2RY1	51	41
COc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983438	EE	On-Demand	Anodyne	GRM4	28	47
COc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983438	EE	On-Demand	Anodyne	PRTN3	53	33
CCc1ccc(S(=O)(=O)NCCCC(=O)OC)cc1CC	ZINC000450983442	DE	On-Demand	Anodyne	IAP	0	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983444	CG	On-Demand	Anodyne	ACE	67	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983444	CG	On-Demand	Anodyne	MME	44	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983444	CG	On-Demand	Anodyne	REN	39	43
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983444	CG	On-Demand	Anodyne	ACE2	40	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983444	CG	On-Demand	Anodyne	XIAP	41	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983444	CG	On-Demand	Anodyne	BIRC2	38	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983444	CG	On-Demand	Anodyne	BRCA1	52	32
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983445	CG	On-Demand	Anodyne	ACE	67	41
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983445	CG	On-Demand	Anodyne	MME	44	42
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983445	CG	On-Demand	Anodyne	REN	39	43
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983445	CG	On-Demand	Anodyne	ACE2	40	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983445	CG	On-Demand	Anodyne	XIAP	41	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983445	CG	On-Demand	Anodyne	BIRC2	38	40
CO[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983445	CG	On-Demand	Anodyne	BRCA1	52	32
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983446	CG	On-Demand	Anodyne	ACE	67	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983446	CG	On-Demand	Anodyne	MME	44	42
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983446	CG	On-Demand	Anodyne	REN	39	43
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983446	CG	On-Demand	Anodyne	ACE2	40	37
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983446	CG	On-Demand	Anodyne	XIAP	41	37
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983446	CG	On-Demand	Anodyne	BIRC2	38	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)C)C1	ZINC000450983446	CG	On-Demand	Anodyne	BRCA1	52	32
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983447	CG	On-Demand	Anodyne	ACE	67	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983447	CG	On-Demand	Anodyne	MME	44	42
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983447	CG	On-Demand	Anodyne	REN	39	43
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983447	CG	On-Demand	Anodyne	ACE2	40	37
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983447	CG	On-Demand	Anodyne	XIAP	41	37
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983447	CG	On-Demand	Anodyne	BIRC2	38	40
CO[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](C(C)C)C1	ZINC000450983447	CG	On-Demand	Anodyne	BRCA1	52	32
COc1cc(CC(=O)N2CCC[C@H](C(C)C)C2)ccc1O	ZINC000450983452	CF	On-Demand	Anodyne	TRPV1	0	45
COc1cc(CC(=O)N2CCC[C@H](C(C)C)C2)ccc1O	ZINC000450983452	CF	On-Demand	Anodyne	RORC	54	42
COc1cc(CC(=O)N2CCC[C@H](C(C)C)C2)ccc1O	ZINC000450983452	CF	On-Demand	Anodyne	CAN2	0	43
COc1cc(CC(=O)N2CCC[C@@H](C(C)C)C2)ccc1O	ZINC000450983453	CF	On-Demand	Anodyne	TRPV1	0	45
COc1cc(CC(=O)N2CCC[C@@H](C(C)C)C2)ccc1O	ZINC000450983453	CF	On-Demand	Anodyne	RORC	54	42
COc1cc(CC(=O)N2CCC[C@@H](C(C)C)C2)ccc1O	ZINC000450983453	CF	On-Demand	Anodyne	CAN2	0	43
O=C(CCCN1CCOC[C@@H]1[C@@H]1CCCO1)c1ccccc1	ZINC000450983454	DF	On-Demand	Anodyne	CYP2J2	57	41
O=C(CCCN1CCOC[C@H]1[C@H]1CCCO1)c1ccccc1	ZINC000450983456	DF	On-Demand	Anodyne	CYP2J2	57	41
O=C(CCCN1CCOC[C@@H]1[C@H]1CCCO1)c1ccccc1	ZINC000450983457	DF	On-Demand	Anodyne	CYP2J2	57	41
O=C(CCCN1CCOC[C@H]1[C@@H]1CCCO1)c1ccccc1	ZINC000450983458	DF	On-Demand	Anodyne	CYP2J2	57	41
CC[C@H](C(=O)OC)N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450983474	ED	On-Demand	Anodyne	NPY2R	23	41
CC[C@H](C(=O)OC)N1CCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450983474	ED	On-Demand	Anodyne	CYP2D6	25	40
CC[C@H](C(=O)OC)N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450983475	ED	On-Demand	Anodyne	NPY2R	23	41
CC[C@H](C(=O)OC)N1CCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC000450983475	ED	On-Demand	Anodyne	CYP2D6	25	40
CC[C@H](C(=O)OC)N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450983476	ED	On-Demand	Anodyne	NPY2R	23	41
CC[C@H](C(=O)OC)N1CCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450983476	ED	On-Demand	Anodyne	CYP2D6	25	40
CC[C@H](C(=O)OC)N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450983477	ED	On-Demand	Anodyne	NPY2R	23	41
CC[C@H](C(=O)OC)N1CCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC000450983477	ED	On-Demand	Anodyne	CYP2D6	25	40
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(Cl)cc1	ZINC000450983480	GE	On-Demand	Anodyne	MMP13	23	40
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(Cl)cc1	ZINC000450983480	GE	On-Demand	Anodyne	MMP3	16	40
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(Cl)cc1	ZINC000450983480	GE	On-Demand	Anodyne	MMP9	25	40
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(Cl)cc1	ZINC000450983480	GE	On-Demand	Anodyne	MMP1	18	40
CO[C@@H](C)CS(=O)(=O)Nc1cc(C2CCCCC2)[nH]n1	ZINC000450983489	DE	On-Demand	Anodyne	CDK2	15	42
CO[C@@H](C)CS(=O)(=O)Nc1cc(C2CCCCC2)[nH]n1	ZINC000450983489	DE	On-Demand	Anodyne	PKNB	50	36
CO[C@H](C)CS(=O)(=O)Nc1cc(C2CCCCC2)[nH]n1	ZINC000450983491	DE	On-Demand	Anodyne	CDK2	15	42
CO[C@H](C)CS(=O)(=O)Nc1cc(C2CCCCC2)[nH]n1	ZINC000450983491	DE	On-Demand	Anodyne	PKNB	50	36
C[C@H](NC(=O)C1CC(C)(O)C1)c1ccc(Br)s1	ZINC000450983507	DF	On-Demand	Anodyne	SDH1	0	49
CCCNC(=O)c1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450983508	EF	On-Demand	Anodyne	KCNK3	41	36
Cc1ccc2c(CCNC(=O)Cc3cn(C)nc3C)cn(C)c2c1	ZINC000450983516	DE	On-Demand	Anodyne	P2RX7	29	40
COCc1ccc(S(=O)(=O)NCCCC(=O)OC)cc1	ZINC000450983522	DD	On-Demand	Anodyne	TBXA2R	51	37
COCc1ccc(S(=O)(=O)NCCCC(=O)OC)cc1	ZINC000450983522	DD	On-Demand	Anodyne	TBXAS1	36	43
COCc1ccc(S(=O)(=O)NCCCC(=O)OC)cc1	ZINC000450983522	DD	On-Demand	Anodyne	ALOX15	40	35
COC(=O)CCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983527	ED	On-Demand	Anodyne	CA1	26	43
COC(=O)CCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983527	ED	On-Demand	Anodyne	IDO1	32	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cn[nH]c2)cc1	ZINC000450983528	FD	On-Demand	Anodyne	MTNN	85	42
CCOC(=O)c1ccc(CN(C)CCc2nc(-c3ccccc3)no2)nc1	ZINC000450983543	FF	On-Demand	Anodyne	CACNA1C	16	40
CCOC(=O)c1ccc(CN(C)CCc2nc(-c3ccccc3)no2)nc1	ZINC000450983543	FF	On-Demand	Anodyne	TSPO	20	48
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cc2cc(F)ccc2o1	ZINC000450983546	FF	On-Demand	Anodyne	FKBP1A	43	46
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cc2cc(F)ccc2o1	ZINC000450983547	FF	On-Demand	Anodyne	FKBP1A	43	46
CCCCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n[nH]1	ZINC000450983554	FG	On-Demand	Anodyne	ADRB2	16	41
CCCCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n[nH]1	ZINC000450983554	FG	On-Demand	Anodyne	PFK	0	41
C=C(C)CN(CCCC(=O)c1ccccc1)Cc1ccc(CO)o1	ZINC000450983578	EH	On-Demand	Mild	CYP2J2	47	33
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21)c1ccccc1	ZINC000450983584	EI	On-Demand	Anodyne	CYP2J2	52	36
O=C(CCCN1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21)c1ccccc1	ZINC000450983585	EI	On-Demand	Anodyne	CYP2J2	52	36
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21)c1ccccc1	ZINC000450983586	EI	On-Demand	Anodyne	CYP2J2	52	36
O=C(CCCN1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21)c1ccccc1	ZINC000450983588	EI	On-Demand	Anodyne	CYP2J2	52	36
CN(CCN1CCN(Cc2ccccc2)CC1)Cc1nnc(C2CC2)s1	ZINC000450983591	FF	On-Demand	Anodyne	SIGMAR1	60	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1	ZINC000450983593	GE	On-Demand	Anodyne	CDK2	0	44
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1	ZINC000450983593	GE	On-Demand	Anodyne	MTNN	85	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)cc1	ZINC000450983593	GE	On-Demand	Anodyne	PKNB	81	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccnc2)cc1	ZINC000450983595	EE	On-Demand	Anodyne	BMP1	61	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccnc2)cc1	ZINC000450983595	EE	On-Demand	Anodyne	MMP13	30	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccnc2)cc1	ZINC000450983595	EE	On-Demand	Anodyne	ADAM17	22	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccnc2)cc1	ZINC000450983595	EE	On-Demand	Anodyne	MMP3	22	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccnc2)cc1	ZINC000450983595	EE	On-Demand	Anodyne	MMP8	22	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccnc2)cc1	ZINC000450983595	EE	On-Demand	Anodyne	MMP9	26	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccnc2)cc1	ZINC000450983595	EE	On-Demand	Anodyne	MMP1	26	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cccnc2)cc1	ZINC000450983595	EE	On-Demand	Anodyne	NAMPT	70	53
CC(C)[C@H]1CCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450983613	CG	On-Demand	Anodyne	PREP	23	42
CC(C)[C@@H]1CCCN(C(=O)CCCC(=O)C2CC2)C1	ZINC000450983614	CG	On-Demand	Anodyne	PREP	23	42
CCS(=O)(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983619	GH	On-Demand	Anodyne	SIGMAR1	61	45
CCS(=O)(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983619	GH	On-Demand	Anodyne	MMP13	15	45
CCS(=O)(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983619	GH	On-Demand	Anodyne	ADAM17	22	45
CCS(=O)(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983619	GH	On-Demand	Anodyne	MCHR2	52	32
CCS(=O)(=O)c1ccc(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983619	GH	On-Demand	Anodyne	NPFFR1	48	35
CCS(=O)(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983620	GH	On-Demand	Anodyne	SIGMAR1	61	45
CCS(=O)(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983620	GH	On-Demand	Anodyne	MMP13	15	45
CCS(=O)(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983620	GH	On-Demand	Anodyne	ADAM17	22	45
CCS(=O)(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983620	GH	On-Demand	Anodyne	MCHR2	52	32
CCS(=O)(=O)c1ccc(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000450983620	GH	On-Demand	Anodyne	NPFFR1	48	35
COC(=O)CCCNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000450983624	DC	On-Demand	Bother	CACNA1C	51	38
COC(=O)CCCNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000450983624	DC	On-Demand	Bother	CACNA1D	88	38
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2c(C)n[nH]c2C)c(F)c1	ZINC000450983646	GE	On-Demand	Anodyne	SGK1	50	37
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2cc(C3CC3)[nH]n2)c1	ZINC000450983688	FG	On-Demand	Anodyne	PKNB	52	35
Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn(C)c1=O	ZINC000450983691	FE	On-Demand	Anodyne	CA2	15	48
Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn(C)c1=O	ZINC000450983691	FE	On-Demand	Anodyne	LEF	47	33
CCCCN(CC)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450983692	CC	On-Demand	Anodyne	SCARB1	45	35
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983711	DF	On-Demand	Anodyne	CHRM2	16	40
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983711	DF	On-Demand	Anodyne	SLC6A3	27	47
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983711	DF	On-Demand	Anodyne	CHRM3	15	40
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983711	DF	On-Demand	Anodyne	GRIN2B	57	40
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983711	DF	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983711	DF	On-Demand	Anodyne	GRIN2C	16	40
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983711	DF	On-Demand	Anodyne	ACHP_LYMST	22	41
CC(=O)[C@@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983711	DF	On-Demand	Anodyne	Q8WSF8_APLCA	39	41
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983712	DF	On-Demand	Anodyne	CHRM2	16	40
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983712	DF	On-Demand	Anodyne	SLC6A3	27	47
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983712	DF	On-Demand	Anodyne	CHRM3	15	40
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983712	DF	On-Demand	Anodyne	GRIN2B	57	40
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983712	DF	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983712	DF	On-Demand	Anodyne	GRIN2C	16	40
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983712	DF	On-Demand	Anodyne	ACHP_LYMST	22	41
CC(=O)[C@](C)(O)CN1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000450983712	DF	On-Demand	Anodyne	Q8WSF8_APLCA	39	41
COC(=O)CCCNS(=O)(=O)Cc1cccc(OC)c1	ZINC000450983723	DD	On-Demand	Anodyne	DRD4	42	32
COC(=O)CCCNS(=O)(=O)Cc1cccc(OC)c1	ZINC000450983723	DD	On-Demand	Anodyne	MTNR1A	61	50
COC(=O)CCCNS(=O)(=O)Cc1cccc(OC)c1	ZINC000450983723	DD	On-Demand	Anodyne	MTNR1B	52	49
COC(=O)CCCNS(=O)(=O)Cc1cccc(OC)c1	ZINC000450983723	DD	On-Demand	Anodyne	ROCK2	40	35
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000450983727	GD	On-Demand	Anodyne	COLA	0	43
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000450983727	GD	On-Demand	Anodyne	CPT1A	18	43
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000450983728	GD	On-Demand	Anodyne	COLA	0	43
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000450983728	GD	On-Demand	Anodyne	CPT1A	18	43
CCOc1ccccc1[C@H](CC)NC(=O)CSC1CCC1	ZINC000450983729	DH	On-Demand	Anodyne	HCN1	45	36
CCOc1ccccc1[C@H](CC)NC(=O)CSC1CCC1	ZINC000450983729	DH	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1[C@@H](CC)NC(=O)CSC1CCC1	ZINC000450983730	DH	On-Demand	Anodyne	HCN1	45	36
CCOc1ccccc1[C@@H](CC)NC(=O)CSC1CCC1	ZINC000450983730	DH	On-Demand	Anodyne	HCN4	45	36
O=C(CCc1ccccc1)NC1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983753	FG	On-Demand	Anodyne	GRIN2B	22	44
O=C(CCc1ccccc1)NC1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983753	FG	On-Demand	Anodyne	SIGMAR1	23	46
O=C(CCc1ccccc1)NC1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983753	FG	On-Demand	Anodyne	C3AR1	52	46
O=C(CCc1ccccc1)NC1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983753	FG	On-Demand	Anodyne	PREP	42	38
O=C(CCc1ccccc1)NC1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983753	FG	On-Demand	Anodyne	EPHX2	21	41
O=C(CCc1ccccc1)NC1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983753	FG	On-Demand	Anodyne	TNKS	40	31
CC1(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450983759	EE	On-Demand	Anodyne	DRD4	27	43
CC1(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450983759	EE	On-Demand	Anodyne	ADORA2B	28	43
CC1(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450983759	EE	On-Demand	Anodyne	SIGMAR1	30	59
C[C@@H](CNS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450983761	FE	On-Demand	Anodyne	GRIA4	23	44
C[C@H](CNS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450983762	FE	On-Demand	Anodyne	GRIA4	23	44
Cc1ccncc1S(=O)(=O)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000450983766	GE	On-Demand	Anodyne	LTA4H	43	45
Cc1ccncc1S(=O)(=O)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000450983766	GE	On-Demand	Anodyne	HRH3	26	41
Cc1ccncc1S(=O)(=O)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000450983766	GE	On-Demand	Anodyne	PSMB2	44	34
Cn1c(CSC2CCC2)nnc1-c1ccccc1	ZINC000450983771	CG	On-Demand	Anodyne	TXN	17	41
Cc1ccccc1C(=O)NC1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983774	EG	On-Demand	Anodyne	CCR8	85	45
O=C(CSC1CCC1)NCc1cccnc1	ZINC000450983775	BD	On-Demand	Anodyne	CHRNA7	40	39
O=C(CSC1CCC1)NCc1cccnc1	ZINC000450983775	BD	On-Demand	Anodyne	C3AR1	43	38
O=C(CSC1CCC1)NCc1cccnc1	ZINC000450983775	BD	On-Demand	Anodyne	NAMPT	67	46
CC(C)Oc1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450983787	DG	On-Demand	Anodyne	MMP2	45	31
CC(C)Oc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450983790	CG	On-Demand	Anodyne	PDS	43	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCn2ccc3ccccc32)cc1	ZINC000450983791	GH	On-Demand	Anodyne	CYP24A1	37	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCn2ccc3ccccc32)cc1	ZINC000450983791	GH	On-Demand	Anodyne	RORC	40	44
O=C(CCCSC1CCC1)N1CCCCC1	ZINC000450983802	BG	On-Demand	Anodyne	PREP	31	48
N#C[C@@H](c1cccs1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983805	EF	On-Demand	Mild	PTAFR	47	46
N#C[C@H](c1cccs1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450983806	EF	On-Demand	Mild	PTAFR	47	46
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983807	EG	On-Demand	Anodyne	MC4R	59	47
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983807	EG	On-Demand	Anodyne	PRCP	56	44
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983807	EG	On-Demand	Anodyne	MC3R	50	47
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983807	EG	On-Demand	Anodyne	MC5R	36	47
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983807	EG	On-Demand	Anodyne	MC1R	34	43
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983808	EG	On-Demand	Anodyne	MC4R	59	47
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983808	EG	On-Demand	Anodyne	PRCP	56	44
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983808	EG	On-Demand	Anodyne	MC3R	50	47
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983808	EG	On-Demand	Anodyne	MC5R	36	47
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)C1	ZINC000450983808	EG	On-Demand	Anodyne	MC1R	34	43
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983809	EG	On-Demand	Anodyne	MC4R	59	47
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983809	EG	On-Demand	Anodyne	PRCP	56	44
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983809	EG	On-Demand	Anodyne	MC3R	50	47
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983809	EG	On-Demand	Anodyne	MC5R	36	47
CC(C)(O)C1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983809	EG	On-Demand	Anodyne	MC1R	34	43
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983810	EG	On-Demand	Anodyne	MC4R	59	47
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983810	EG	On-Demand	Anodyne	PRCP	56	44
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983810	EG	On-Demand	Anodyne	MC3R	50	47
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983810	EG	On-Demand	Anodyne	MC5R	36	47
CC(C)(O)C1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)C1	ZINC000450983810	EG	On-Demand	Anodyne	MC1R	34	43
CCN(CC)C(=O)CN(C)S(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1	ZINC000450983811	GE	On-Demand	Anodyne	HCRTR2	0	45
CN(C)c1ccccc1CSC1CCC1	ZINC000450983814	BH	On-Demand	Anodyne	QRFPR	44	40
CCCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450983819	FG	On-Demand	Anodyne	ADRB2	22	50
CCCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450983819	FG	On-Demand	Anodyne	ADRB1	16	50
CCCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450983819	FG	On-Demand	Anodyne	ADRB3	25	44
CCCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450983819	FG	On-Demand	Anodyne	AOC3	22	41
CCCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450983819	FG	On-Demand	Anodyne	PFK	0	42
CCCc1csc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450983819	FG	On-Demand	Anodyne	SREBF2	0	43
CCOC(C)(C)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450983820	CE	On-Demand	Anodyne	TRPV1	23	60
CCOC(C)(C)CNC(=O)Cc1ccc(O)c(F)c1	ZINC000450983820	CE	On-Demand	Anodyne	CAN2	0	40
O=C(CSC1CCC1)Nc1cccc(CSc2ccccn2)c1	ZINC000450983821	EJ	On-Demand	Anodyne	QRFPR	23	42
COc1cc(CN[C@@](C)(CO)c2ccc(Br)cc2)ccc1Cl	ZINC000450983830	GI	On-Demand	Anodyne	TRPV1	0	41
COc1cc(CN[C@](C)(CO)c2ccc(Br)cc2)ccc1Cl	ZINC000450983831	GI	On-Demand	Anodyne	TRPV1	0	41
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H](C)[S@@]1=O	ZINC000450983833	GD	On-Demand	Anodyne	MTNR1A	53	38
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H](C)[S@@]1=O	ZINC000450983833	GD	On-Demand	Anodyne	MTNR1B	41	38
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)[S@@]1=O	ZINC000450983834	GD	On-Demand	Anodyne	MTNR1A	53	38
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)[S@@]1=O	ZINC000450983834	GD	On-Demand	Anodyne	MTNR1B	41	38
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)[S@]1=O	ZINC000450983837	GD	On-Demand	Anodyne	MTNR1A	53	38
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@@H](C)[S@]1=O	ZINC000450983837	GD	On-Demand	Anodyne	MTNR1B	41	38
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H](C)[S@]1=O	ZINC000450983839	GD	On-Demand	Anodyne	MTNR1A	53	38
CC[C@@H]1CN(CCC(=O)NCc2ccc(OC)cc2OC)C[C@H](C)[S@]1=O	ZINC000450983839	GD	On-Demand	Anodyne	MTNR1B	41	38
CC(C)[C@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450983859	DG	On-Demand	Anodyne	PREP	46	37
CC(C)[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450983860	DG	On-Demand	Anodyne	PREP	46	37
CC(C)[C@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450983861	DG	On-Demand	Anodyne	PREP	46	37
CC(C)[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450983862	DG	On-Demand	Anodyne	PREP	46	37
c1ccc(CN2CC[C@]3(CCN(Cc4cn(CC5CC5)nn4)C3)C2)cc1	ZINC000450983865	FF	On-Demand	Anodyne	SIGMAR1	41	37
c1ccc(CN2CC[C@@]3(CCN(Cc4cn(CC5CC5)nn4)C3)C2)cc1	ZINC000450983866	FF	On-Demand	Anodyne	SIGMAR1	41	37
CC[C@@H](C(=O)OC)N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450983874	DD	On-Demand	Anodyne	NOD2	40	35
CC[C@H](C(=O)OC)N1CCN(Cc2ccc(C(C)=O)cc2)CC1	ZINC000450983875	DD	On-Demand	Anodyne	NOD2	40	35
C=C(C)CN(Cc1ccc(S(=O)(=O)CC)cc1)Cc1ccc(CO)o1	ZINC000450983894	FG	On-Demand	Mild	RORC	18	42
COc1ccc(CNC(=O)CCN2CCOc3ccc(C)cc3C2)c(OC)c1	ZINC000450983896	GF	On-Demand	Anodyne	MTNR1A	30	41
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	ADAM17	45	44
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	EPHX2	22	46
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	TGM2	51	35
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	MMP7	44	35
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	F13A1	51	35
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	AKR1C3	25	46
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	LUXN	0	42
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	ADIPOR1	0	42
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983909	GC	On-Demand	Anodyne	ADIPOR2	0	42
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	ADAM17	45	44
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	EPHX2	22	46
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	TGM2	51	35
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	MMP7	44	35
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	F13A1	51	35
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	AKR1C3	25	46
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	LUXN	0	42
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	ADIPOR1	0	42
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450983911	GC	On-Demand	Anodyne	ADIPOR2	0	42
COc1ncccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450983921	GD	On-Demand	Anodyne	PRTN3	51	31
COc1ncccc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450983921	GD	On-Demand	Anodyne	MTNN	78	37
CN(CCc1nc(-c2ccccc2)no1)CCN(C)Cc1ccccc1	ZINC000450983924	FG	On-Demand	Anodyne	TSPO	19	49
CC[C@@H](CO)NC(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450983928	CD	On-Demand	Anodyne	PDEC	0	41
CC[C@@H](CO)NC(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450983930	CD	On-Demand	Anodyne	PDEC	0	41
Cc1ccc(CN2CCCC2)cc1NS(=O)(=O)c1cc2cc(F)ccc2o1	ZINC000450983932	GI	On-Demand	Anodyne	CCR3	15	41
CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc2c(Cl)ccnc12	ZINC000450983935	GF	On-Demand	Anodyne	FKBP1A	51	41
CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccc2c(Cl)ccnc12	ZINC000450983938	GF	On-Demand	Anodyne	FKBP1A	51	41
CCn1c(=O)oc2cc(S(=O)(=O)NCCCC(=O)OC)ccc21	ZINC000450983949	EC	On-Demand	Anodyne	IAP	0	44
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1O	ZINC000450983951	FG	On-Demand	Anodyne	LEF	44	34
COc1ccc(CNC(=O)CCN(C)[C@@H]2COC[C@H]2O)c(OC)c1	ZINC000450983966	EC	On-Demand	Anodyne	MTNR1A	48	37
COC(=O)CCCNS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000450983968	FC	On-Demand	Anodyne	LEF	51	34
CC(C)N(C(=O)Cn1nnc(-c2ccncn2)n1)C(C)C	ZINC000450983975	CC	On-Demand	Anodyne	SCARB1	53	41
c1ccc(CN2CC[C@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983978	GF	On-Demand	Anodyne	DRD2	0	43
c1ccc(CN2CC[C@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983978	GF	On-Demand	Anodyne	DRD4	26	42
c1ccc(CN2CC[C@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983978	GF	On-Demand	Anodyne	ACHE	21	40
c1ccc(CN2CC[C@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983978	GF	On-Demand	Anodyne	DRD3	15	40
c1ccc(CN2CC[C@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983978	GF	On-Demand	Anodyne	VACHT_TETCF	0	44
c1ccc(CN2CC[C@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983978	GF	On-Demand	Anodyne	SIGMAR1	42	41
c1ccc(CN2CC[C@@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983979	GF	On-Demand	Anodyne	DRD2	0	43
c1ccc(CN2CC[C@@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983979	GF	On-Demand	Anodyne	DRD4	26	42
c1ccc(CN2CC[C@@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983979	GF	On-Demand	Anodyne	ACHE	21	40
c1ccc(CN2CC[C@@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983979	GF	On-Demand	Anodyne	DRD3	15	40
c1ccc(CN2CC[C@@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983979	GF	On-Demand	Anodyne	VACHT_TETCF	0	44
c1ccc(CN2CC[C@@H](N3CCN(Cc4nnc(C5CC5)s4)CC3)C2)cc1	ZINC000450983979	GF	On-Demand	Anodyne	SIGMAR1	42	41
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	CA2	26	42
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	KCNA5	25	40
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	BDKRB1	0	48
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	COLA	65	36
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	GRM4	18	42
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	MMP2	35	44
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	PRTN3	60	37
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	MMP12	52	36
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	ADAMTS4	63	36
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	CA9	21	42
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	LIMK2	44	38
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	MTCA1	20	42
COCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450983980	FG	On-Demand	Anodyne	P96878_MYCTU	23	42
C1=C(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450983981	FH	On-Demand	Anodyne	DRD2	0	41
C1=C(CCN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450983981	FH	On-Demand	Anodyne	DRD3	0	41
C1=C(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450983982	FH	On-Demand	Anodyne	DRD2	0	41
C1=C(CCN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)CCCC1	ZINC000450983982	FH	On-Demand	Anodyne	DRD3	0	41
Cc1ccc2cc(S(=O)(=O)N3CCC[C@H](C(N)=O)C3)ccc2c1	ZINC000450983990	EE	On-Demand	Anodyne	F10	15	42
Cc1ccc2cc(S(=O)(=O)N3CCC[C@H](C(N)=O)C3)ccc2c1	ZINC000450983990	EE	On-Demand	Anodyne	AKR1C3	36	63
Cc1ccc2cc(S(=O)(=O)N3CCC[C@@H](C(N)=O)C3)ccc2c1	ZINC000450983991	EE	On-Demand	Anodyne	F10	15	42
Cc1ccc2cc(S(=O)(=O)N3CCC[C@@H](C(N)=O)C3)ccc2c1	ZINC000450983991	EE	On-Demand	Anodyne	AKR1C3	36	63
COc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1OCC(N)=O	ZINC000450984003	GE	On-Demand	Anodyne	HTR6	27	40
COc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1OCC(N)=O	ZINC000450984003	GE	On-Demand	Anodyne	GHSR	22	40
COc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1OCC(N)=O	ZINC000450984003	GE	On-Demand	Anodyne	DRTS_TRYCR	47	33
CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450984012	FD	On-Demand	Mild	HCRTR2	0	42
CCOC(=O)c1ncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450984015	GF	On-Demand	Anodyne	ADRB2	25	44
CCOC(=O)c1ncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450984015	GF	On-Demand	Anodyne	ADRB1	19	44
CCOC(=O)c1ncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450984015	GF	On-Demand	Anodyne	ADRB3	19	44
CCOC(=O)c1ncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450984015	GF	On-Demand	Anodyne	CA1	33	42
CCOC(=O)c1ncc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450984015	GF	On-Demand	Anodyne	CA7	15	42
COC(=O)c1cc(F)ccc1CSC1CCC1	ZINC000450984019	CG	On-Demand	Anodyne	QRFPR	46	38
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCc2ccccc2C1	ZINC000450984030	ED	On-Demand	Anodyne	NPY2R	41	39
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCc2ccccc2C1	ZINC000450984031	ED	On-Demand	Anodyne	NPY2R	41	39
NC(=O)c1ccc(NC(=O)CCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1Cl	ZINC000450984032	GD	On-Demand	Anodyne	TERT	19	42
NC(=O)c1ccc(NC(=O)CCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1Cl	ZINC000450984033	GD	On-Demand	Anodyne	TERT	19	42
CC(C)c1cccc(CNC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450984038	DG	On-Demand	Anodyne	CHRM3	15	41
CC(C)c1cccc(CNC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450984038	DG	On-Demand	Anodyne	HDAC1	28	41
CC(C)c1cccc(CNC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450984038	DG	On-Demand	Anodyne	SCD1	16	42
CC(C)c1cccc(CNC(=O)c2ccc(N3CCC3)nc2)c1	ZINC000450984038	DG	On-Demand	Anodyne	HPGDS	17	40
CN(CCCOc1ccc(F)cc1)C(=O)CSC1CCC1	ZINC000450984039	DG	On-Demand	Anodyne	LTA4H	20	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CC#N)cc1	ZINC000450984045	CD	On-Demand	Mild	CA1	23	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CC#N)cc1	ZINC000450984045	CD	On-Demand	Mild	COLA	49	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CC#N)cc1	ZINC000450984045	CD	On-Demand	Mild	P96878_MYCTU	40	36
CCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450984046	CF	On-Demand	Anodyne	HRH2	27	41
CCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450984046	CF	On-Demand	Anodyne	PDS	89	43
COCC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450984047	FD	On-Demand	Anodyne	LTA4H	59	46
COCC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450984047	FD	On-Demand	Anodyne	HRH3	28	48
COCC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450984047	FD	On-Demand	Anodyne	PSMB2	51	39
COCC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450984047	FD	On-Demand	Anodyne	PSMB1	44	40
Cc1ccc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450984054	FH	On-Demand	Anodyne	P96878_MYCTU	40	36
CC(C)CNC(=O)c1cccc(CSC2CCC2)c1	ZINC000450984055	CH	On-Demand	Anodyne	F3	67	37
COc1ccc2[nH]nc(NS(=O)(=O)C[C@@H](C)OC)c2c1	ZINC000450984059	CD	On-Demand	Anodyne	TTK	17	45
COc1ccc2[nH]nc(NS(=O)(=O)C[C@H](C)OC)c2c1	ZINC000450984060	CD	On-Demand	Anodyne	TTK	17	45
COc1ccc(-c2nc(CSC3CCC3)cs2)cc1OC	ZINC000450984063	DJ	On-Demand	Anodyne	AVPR1B	0	43
COc1ccc(-c2nc(CSC3CCC3)cs2)cc1OC	ZINC000450984063	DJ	On-Demand	Anodyne	DCK	58	51
COc1ccc(-c2nc(CSC3CCC3)cs2)cc1OC	ZINC000450984063	DJ	On-Demand	Anodyne	PPARD	19	44
COc1ccc(-c2nc(CSC3CCC3)cs2)cc1OC	ZINC000450984063	DJ	On-Demand	Anodyne	QRFPR	50	42
COc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984066	FG	On-Demand	Anodyne	CA2	18	49
COc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984066	FG	On-Demand	Anodyne	CA1	21	41
COc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984066	FG	On-Demand	Anodyne	KCNA5	25	40
COc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984066	FG	On-Demand	Anodyne	GHSR	23	41
COc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984066	FG	On-Demand	Anodyne	LEF	40	35
O=C(CCSC1CCC1)Nc1cccc(Cl)c1	ZINC000450984074	CH	On-Demand	Anodyne	MCHR1	22	40
O=C(CCSC1CCC1)Nc1cccc(Cl)c1	ZINC000450984074	CH	On-Demand	Anodyne	NADD	0	43
O=C(CSC1CCC1)NCCOc1cccc(C(F)(F)F)c1	ZINC000450984077	EG	On-Demand	Anodyne	HRH2	23	46
O=C(CSC1CCC1)NCCOc1cccc(C(F)(F)F)c1	ZINC000450984077	EG	On-Demand	Anodyne	PDS	48	46
Cc1ccc(CSC2CCC2)c(C)n1	ZINC000450984080	BG	On-Demand	Anodyne	QRFPR	42	35
Cc1ccn2ncc(C(=O)N3CCN(C4CC4)c4cc(F)ccc43)c2c1	ZINC000450984086	FG	On-Demand	Anodyne	HCRTR1	35	40
Cc1ccn2ncc(C(=O)N3CCN(C4CC4)c4cc(F)ccc43)c2c1	ZINC000450984086	FG	On-Demand	Anodyne	HCRTR2	24	40
Cc1ccn2ncc(C(=O)N3CCN(C4CC4)c4cc(F)ccc43)c2c1	ZINC000450984086	FG	On-Demand	Anodyne	GPBAR1	43	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc3c2OCCO3)cc1	ZINC000450984091	GF	On-Demand	Anodyne	PRTN3	52	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	CA2	26	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	ADRB2	16	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	CA1	36	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	KCNA5	26	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	CA7	15	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	COLA	57	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	CA5B	36	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	CA4	31	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	CA5A	41	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	GRM4	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	MMP2	38	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	MMP9	30	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	GRIA4	25	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	MMP12	45	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	CA12	20	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	MMP10	16	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	MMP7	21	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	ADAMTS4	52	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450984097	FG	On-Demand	Anodyne	LIMK2	42	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	CA2	26	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	ADRB2	16	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	CA1	36	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	KCNA5	26	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	CA7	15	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	COLA	57	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	CA5B	36	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	CA4	31	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	CA5A	41	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	GRM4	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	MMP2	38	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	MMP9	30	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	GRIA4	25	54
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	MMP12	45	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	CA12	20	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	MMP10	16	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	MMP7	21	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	ADAMTS4	52	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450984098	FG	On-Demand	Anodyne	LIMK2	42	36
C[C@@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984115	DG	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984115	DG	On-Demand	Anodyne	HTR3B	0	43
C[C@@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984115	DG	On-Demand	Anodyne	CYP2J2	47	33
C[C@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984116	DG	On-Demand	Anodyne	DRD2	28	40
C[C@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984116	DG	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1C[C@@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984116	DG	On-Demand	Anodyne	CYP2J2	47	33
C[C@@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984117	DG	On-Demand	Anodyne	DRD2	28	40
C[C@@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984117	DG	On-Demand	Anodyne	HTR3B	0	43
C[C@@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984117	DG	On-Demand	Anodyne	CYP2J2	47	33
C[C@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984118	DG	On-Demand	Anodyne	DRD2	28	40
C[C@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984118	DG	On-Demand	Anodyne	HTR3B	0	43
C[C@H]1C[C@H](N2CCCC2)CN1CCCC(=O)c1ccc(F)cc1	ZINC000450984118	DG	On-Demand	Anodyne	CYP2J2	47	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccn2)cc1	ZINC000450984124	EF	On-Demand	Anodyne	GRM4	36	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccccn2)cc1	ZINC000450984124	EF	On-Demand	Anodyne	ADAMTS4	46	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccn2)cc1	ZINC000450984125	EF	On-Demand	Anodyne	GRM4	36	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccn2)cc1	ZINC000450984125	EF	On-Demand	Anodyne	ADAMTS4	46	37
COc1cccc(OCCC(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	ZINC000450984126	GF	On-Demand	Anodyne	MTNR1A	38	49
COc1cccc(OCCC(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	ZINC000450984126	GF	On-Demand	Anodyne	MTNR1B	38	49
COc1cccc(OCCC(=O)N[C@@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	ZINC000450984126	GF	On-Demand	Anodyne	E1	0	42
COc1cccc(OCCC(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	ZINC000450984127	GF	On-Demand	Anodyne	MTNR1A	38	49
COc1cccc(OCCC(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	ZINC000450984127	GF	On-Demand	Anodyne	MTNR1B	38	49
COc1cccc(OCCC(=O)N[C@H](C)CS(=O)(=O)c2ccc(C)cc2)c1	ZINC000450984127	GF	On-Demand	Anodyne	E1	0	42
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2cc3cc(F)ccc3o2)C1	ZINC000450984135	ED	On-Demand	Anodyne	AKR1C3	0	40
NC(=O)[C@H]1CCCN(S(=O)(=O)c2cc3cc(F)ccc3o2)C1	ZINC000450984136	ED	On-Demand	Anodyne	AKR1C3	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccco2)cc1	ZINC000450984138	EF	On-Demand	Anodyne	BMP1	40	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccco2)cc1	ZINC000450984138	EF	On-Demand	Anodyne	CA1	22	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccco2)cc1	ZINC000450984138	EF	On-Demand	Anodyne	COLA	54	39
CC(C)[C@@H]1CCCN(C(=O)c2ccn(CCc3ccccc3)n2)C1	ZINC000450984156	EH	On-Demand	Anodyne	BIRC2	51	42
CC(C)[C@H]1CCCN(C(=O)c2ccn(CCc3ccccc3)n2)C1	ZINC000450984157	EH	On-Demand	Anodyne	BIRC2	51	42
COc1ccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)cc1OCC(N)=O	ZINC000450984161	GD	On-Demand	Anodyne	ENPP1	48	32
COc1ccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)cc1OCC(N)=O	ZINC000450984161	GD	On-Demand	Anodyne	DRTS_TRYCR	48	34
COc1ccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)cc1OCC(N)=O	ZINC000450984162	GD	On-Demand	Anodyne	ENPP1	48	32
COc1ccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)cc1OCC(N)=O	ZINC000450984162	GD	On-Demand	Anodyne	DRTS_TRYCR	48	34
CO[C@H](C)CS(=O)(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000450984174	GE	On-Demand	Anodyne	DRD4	29	42
CO[C@H](C)CS(=O)(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000450984174	GE	On-Demand	Anodyne	DRD3	24	42
CO[C@@H](C)CS(=O)(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450984175	GE	On-Demand	Anodyne	DRD4	29	42
CO[C@@H](C)CS(=O)(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450984175	GE	On-Demand	Anodyne	DRD3	24	42
CO[C@H](C)CS(=O)(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450984176	GE	On-Demand	Anodyne	DRD4	29	42
CO[C@H](C)CS(=O)(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450984176	GE	On-Demand	Anodyne	DRD3	24	42
CO[C@@H](C)CS(=O)(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000450984177	GE	On-Demand	Anodyne	DRD4	29	42
CO[C@@H](C)CS(=O)(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000450984177	GE	On-Demand	Anodyne	DRD3	24	42
OCC[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(Cl)c(Cl)c1	ZINC000450984178	FH	On-Demand	Anodyne	ADRB3	22	57
OCC[C@@H](NC[C@H](O)Cc1ccccc1)c1ccc(Cl)c(Cl)c1	ZINC000450984178	FH	On-Demand	Anodyne	PFMRK	0	43
OCC[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(Cl)c(Cl)c1	ZINC000450984179	FH	On-Demand	Anodyne	ADRB3	22	57
OCC[C@H](NC[C@H](O)Cc1ccccc1)c1ccc(Cl)c(Cl)c1	ZINC000450984179	FH	On-Demand	Anodyne	PFMRK	0	43
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc(C)c(O)c2C)c1	ZINC000450984184	GH	On-Demand	Anodyne	FFAR4	21	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc(C)c(O)c2C)c1	ZINC000450984184	GH	On-Demand	Anodyne	MOGAT2	40	32
CN(CCCC(=O)c1ccccc1)CCc1nc(-c2ccccc2)no1	ZINC000450984187	EH	On-Demand	Anodyne	FAAH	63	39
CN(CCCC(=O)c1ccccc1)CCc1nc(-c2ccccc2)no1	ZINC000450984187	EH	On-Demand	Anodyne	CES1	55	39
COC(=O)c1csc(CN2C[C@@H](C)CC[C@H]2c2ccccc2)n1	ZINC000450984189	EH	On-Demand	Anodyne	TRPC6	46	35
COC(=O)c1csc(CN2C[C@H](C)CC[C@H]2c2ccccc2)n1	ZINC000450984190	EH	On-Demand	Anodyne	TRPC6	46	35
COC(=O)c1csc(CN2C[C@H](C)CC[C@@H]2c2ccccc2)n1	ZINC000450984191	EH	On-Demand	Anodyne	TRPC6	46	35
COC(=O)c1csc(CN2C[C@@H](C)CC[C@@H]2c2ccccc2)n1	ZINC000450984192	EH	On-Demand	Anodyne	TRPC6	46	35
COC(=O)CCCNS(=O)(=O)c1ccc(C)nc1	ZINC000450984195	CC	On-Demand	Anodyne	TBXAS1	40	44
CCS(=O)(=O)c1ccc(CN(C)CCc2nc(-c3ccccc3)no2)cc1	ZINC000450984198	GG	On-Demand	Anodyne	RORC	40	44
COc1cc(CC(=O)N[C@@H](C)c2ccc(Br)s2)ccc1O	ZINC000450984203	FH	On-Demand	Anodyne	TRPV1	42	47
COc1cc(CC(=O)N[C@@H](C)c2ccc(Br)s2)ccc1O	ZINC000450984203	FH	On-Demand	Anodyne	NCE103	28	46
COc1cc(CC(=O)N[C@@H](C)c2ccc(Br)s2)ccc1O	ZINC000450984203	FH	On-Demand	Anodyne	CAN2	0	46
COCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984208	GE	On-Demand	Anodyne	PRTN3	63	39
COCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984208	GE	On-Demand	Anodyne	ADAMTS4	59	35
COCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984208	GE	On-Demand	Anodyne	LUXN	0	49
COCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984208	GE	On-Demand	Anodyne	ADIPOR1	0	42
COCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984208	GE	On-Demand	Anodyne	ADIPOR2	0	42
C[C@H](CNS(=O)(=O)C1(C)CC1)c1ccccc1	ZINC000450984215	CE	On-Demand	Anodyne	GRIA4	26	50
C[C@@H](CNS(=O)(=O)C1(C)CC1)c1ccccc1	ZINC000450984216	CE	On-Demand	Anodyne	GRIA4	26	50
CC1CCN(C(=O)c2ccccc2NS(=O)(=O)c2sccc2F)CC1	ZINC000450984219	GH	On-Demand	Anodyne	CCR8	52	32
CC1CCN(C(=O)c2ccccc2NS(=O)(=O)c2sccc2F)CC1	ZINC000450984219	GH	On-Demand	Anodyne	TRPC6	43	40
Cc1cccc(C)c1CS(=O)(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1	ZINC000450984221	GI	On-Demand	Mild	PHES	0	40
Cc1cccc(C)c1CS(=O)(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1	ZINC000450984222	GI	On-Demand	Mild	PHES	0	40
COc1ccc(CSC2CCC2)cc1F	ZINC000450984224	BH	On-Demand	Anodyne	QRFPR	51	43
COC(=O)c1ccccc1OCCSC1CCC1	ZINC000450984230	CG	On-Demand	Anodyne	HCN1	42	34
COC(=O)c1ccccc1OCCSC1CCC1	ZINC000450984230	CG	On-Demand	Anodyne	HCN4	42	34
COC(=O)c1cc(CSC2CCC2)c(C)s1	ZINC000450984236	CH	On-Demand	Anodyne	QRFPR	48	41
CCOC(=O)[C@H](NC(=O)c1cnn2ccc(C)cc12)c1ccc(OC)c(F)c1	ZINC000450984240	GF	On-Demand	Anodyne	EPHB3	29	43
CCOC(=O)[C@@H](NC(=O)c1cnn2ccc(C)cc12)c1ccc(OC)c(F)c1	ZINC000450984241	GF	On-Demand	Anodyne	EPHB3	29	43
O=C(CSC1CCC1)NCC1(c2ccccc2)CCOCC1	ZINC000450984249	DG	On-Demand	Anodyne	ACAT	0	44
CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450984252	EF	On-Demand	Anodyne	HCRTR2	25	53
COc1cccc(OCCSC2CCC2)c1	ZINC000450984258	BG	On-Demand	Anodyne	CHRNA10	41	33
COc1cccc(OCCSC2CCC2)c1	ZINC000450984258	BG	On-Demand	Anodyne	VCP	16	41
N#CCC1(CS(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450984265	FD	On-Demand	Mild	LTA4H	46	42
N#CCC1(CS(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450984265	FD	On-Demand	Mild	PSMB2	47	38
N#CCC1(CS(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450984265	FD	On-Demand	Mild	PSMB1	40	37
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)c1	ZINC000450984270	GH	On-Demand	Anodyne	SFRP1	48	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)c1	ZINC000450984270	GH	On-Demand	Anodyne	WNT3	41	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)c1	ZINC000450984270	GH	On-Demand	Anodyne	TRPC6	42	51
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)c1	ZINC000450984270	GH	On-Demand	Anodyne	TRPC3	41	51
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)c1	ZINC000450984271	GH	On-Demand	Anodyne	SFRP1	48	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)c1	ZINC000450984271	GH	On-Demand	Anodyne	WNT3	41	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)c1	ZINC000450984271	GH	On-Demand	Anodyne	TRPC6	42	51
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)c1	ZINC000450984271	GH	On-Demand	Anodyne	TRPC3	41	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)s2)cc1	ZINC000450984272	GH	On-Demand	Anodyne	BMP1	40	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc(Cl)s2)cc1	ZINC000450984272	GH	On-Demand	Anodyne	COLA	45	37
C[C@@H](NC(=O)CNC(=O)CSC1CCC1)c1ccc(F)cc1	ZINC000450984274	DE	On-Demand	Anodyne	SDH1	0	40
C[C@H](NC(=O)CNC(=O)CSC1CCC1)c1ccc(F)cc1	ZINC000450984275	DE	On-Demand	Anodyne	SDH1	0	40
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000450984277	GF	On-Demand	Anodyne	DRD4	19	44
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000450984277	GF	On-Demand	Anodyne	ADORA2B	47	46
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000450984277	GF	On-Demand	Anodyne	SIGMAR1	15	41
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000450984277	GF	On-Demand	Anodyne	SSTR5	65	40
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000450984277	GF	On-Demand	Anodyne	FAAH	20	41
COc1ccnc(CSC2CCC2)c1OC	ZINC000450984288	BF	On-Demand	Anodyne	QRFPR	44	36
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2C)CC1	ZINC000450984290	GD	On-Demand	Anodyne	ADRA1D	28	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2C)CC1	ZINC000450984290	GD	On-Demand	Anodyne	ADRA1A	24	44
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2C)CC1	ZINC000450984290	GD	On-Demand	Anodyne	TGM2	22	45
COC(=O)c1ncccc1S(=O)(=O)N1CCN(c2ccccc2C)CC1	ZINC000450984290	GD	On-Demand	Anodyne	F13A1	25	45
C[C@@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450984294	GI	On-Demand	Anodyne	TRPC6	26	45
C[C@@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450984294	GI	On-Demand	Anodyne	TRPC3	28	45
C[C@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450984295	GI	On-Demand	Anodyne	TRPC6	26	45
C[C@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450984295	GI	On-Demand	Anodyne	TRPC3	28	45
COc1ccc(Cl)cc1CNC(=O)CSC1CCC1	ZINC000450984309	CG	On-Demand	Anodyne	COLA	41	38
COC(=O)CCCNS(=O)(=O)c1ccc(Br)c(Cl)c1	ZINC000450984335	FE	On-Demand	Anodyne	TBXA2R	45	36
COC(=O)CCCNS(=O)(=O)c1ccc(Br)c(Cl)c1	ZINC000450984335	FE	On-Demand	Anodyne	TBXAS1	26	42
NC(=O)[C@H]1CCCCN1S(=O)(=O)Cc1ccc(Br)c(F)c1	ZINC000450984336	GD	On-Demand	Anodyne	FKBP1A	26	47
NC(=O)[C@@H]1CCCCN1S(=O)(=O)Cc1ccc(Br)c(F)c1	ZINC000450984337	GD	On-Demand	Anodyne	FKBP1A	26	47
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NCCCC(=O)OC	ZINC000450984343	GD	On-Demand	Anodyne	PTGDR2	25	41
COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NCCCC(=O)OC	ZINC000450984344	GD	On-Demand	Anodyne	PTGDR2	25	41
CN(CCCC(=O)c1ccc(F)cc1)CCc1nc(-c2ccccc2)no1	ZINC000450984349	FI	On-Demand	Anodyne	TSPO	21	49
CC(C)[C@H]1CCCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450984359	EH	On-Demand	Anodyne	HPGD	17	46
CC(C)[C@@H]1CCCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450984360	EH	On-Demand	Anodyne	HPGD	17	46
C[C@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984386	DD	On-Demand	Anodyne	DRD2	23	41
C[C@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984386	DD	On-Demand	Anodyne	SLC6A4	25	40
C[C@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984386	DD	On-Demand	Anodyne	DRD3	22	43
C[C@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984386	DD	On-Demand	Anodyne	VACHT_TETCF	0	46
C[C@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984386	DD	On-Demand	Anodyne	SIGMAR1	76	43
C[C@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984386	DD	On-Demand	Anodyne	CCR5	57	43
C[C@@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984387	DD	On-Demand	Anodyne	DRD2	23	41
C[C@@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984387	DD	On-Demand	Anodyne	SLC6A4	25	40
C[C@@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984387	DD	On-Demand	Anodyne	DRD3	22	43
C[C@@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984387	DD	On-Demand	Anodyne	VACHT_TETCF	0	46
C[C@@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984387	DD	On-Demand	Anodyne	SIGMAR1	76	43
C[C@@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984387	DD	On-Demand	Anodyne	CCR5	57	43
C[C@@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984388	DD	On-Demand	Anodyne	DRD2	23	41
C[C@@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984388	DD	On-Demand	Anodyne	SLC6A4	25	40
C[C@@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984388	DD	On-Demand	Anodyne	DRD3	22	43
C[C@@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984388	DD	On-Demand	Anodyne	VACHT_TETCF	0	46
C[C@@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984388	DD	On-Demand	Anodyne	SIGMAR1	76	43
C[C@@H](O)CCN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984388	DD	On-Demand	Anodyne	CCR5	57	43
C[C@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984389	DD	On-Demand	Anodyne	DRD2	23	41
C[C@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984389	DD	On-Demand	Anodyne	SLC6A4	25	40
C[C@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984389	DD	On-Demand	Anodyne	DRD3	22	43
C[C@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984389	DD	On-Demand	Anodyne	VACHT_TETCF	0	46
C[C@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984389	DD	On-Demand	Anodyne	SIGMAR1	76	43
C[C@H](O)CCN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984389	DD	On-Demand	Anodyne	CCR5	57	43
COC(=O)CCCNS(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2	ZINC000450984400	FD	On-Demand	Anodyne	CYP11B1	17	43
COC(=O)CCCNS(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2	ZINC000450984400	FD	On-Demand	Anodyne	CYP11B2	18	43
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nn(C(C)C)cc2C#N)cc1	ZINC000450984402	GE	On-Demand	Mild	P2RY12	26	41
CS(=O)(=O)c1cccc(CS(=O)(=O)Nc2cc(C(F)(F)F)[nH]n2)c1	ZINC000450984409	GD	On-Demand	Anodyne	PTK2	22	41
COC(=O)CCCNS(=O)(=O)CC12CCC(CC1)C2	ZINC000450984410	CD	On-Demand	Anodyne	EPHX2	15	42
C[C@@H]1C[C@H](N2CCCC2)CN1CCc1ccc(Cl)cc1	ZINC000450984411	CG	On-Demand	Anodyne	CACNA1D	33	40
C[C@@H]1C[C@@H](N2CCCC2)CN1CCc1ccc(Cl)cc1	ZINC000450984418	CG	On-Demand	Anodyne	CACNA1D	33	40
C[C@H]1C[C@@H](N2CCCC2)CN1CCc1ccc(Cl)cc1	ZINC000450984419	CG	On-Demand	Anodyne	CACNA1D	33	40
C[C@H]1C[C@H](N2CCCC2)CN1CCc1ccc(Cl)cc1	ZINC000450984420	CG	On-Demand	Anodyne	CACNA1D	33	40
O=C(CSC1CCC1)Nc1nc(-c2cccs2)cs1	ZINC000450984424	DI	On-Demand	Anodyne	ETHR	32	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984434	CD	On-Demand	Mild	CA1	31	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984434	CD	On-Demand	Mild	MMP13	31	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984434	CD	On-Demand	Mild	MMP2	23	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984434	CD	On-Demand	Mild	MMP12	40	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984434	CD	On-Demand	Mild	MMP7	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984434	CD	On-Demand	Mild	LEF	47	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984434	CD	On-Demand	Mild	P96878_MYCTU	41	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984435	CD	On-Demand	Mild	CA1	31	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984435	CD	On-Demand	Mild	MMP13	31	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984435	CD	On-Demand	Mild	MMP2	23	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984435	CD	On-Demand	Mild	MMP12	40	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984435	CD	On-Demand	Mild	MMP7	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984435	CD	On-Demand	Mild	LEF	47	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984435	CD	On-Demand	Mild	P96878_MYCTU	41	38
CC[C@H](O)CC(=O)NCc1cccc(C(C)C)c1	ZINC000450984440	BF	On-Demand	Anodyne	ACAT	0	40
CC[C@H](O)CC(=O)NCc1cccc(C(C)C)c1	ZINC000450984440	BF	On-Demand	Anodyne	PDS	63	36
CC[C@@H](O)CC(=O)NCc1cccc(C(C)C)c1	ZINC000450984441	BF	On-Demand	Anodyne	ACAT	0	40
CC[C@@H](O)CC(=O)NCc1cccc(C(C)C)c1	ZINC000450984441	BF	On-Demand	Anodyne	PDS	63	36
Cc1cccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450984444	GF	On-Demand	Anodyne	MMP13	25	43
Cc1cccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450984444	GF	On-Demand	Anodyne	ADAM17	31	43
Cc1cccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450984444	GF	On-Demand	Anodyne	LUXN	0	45
Cc1cccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450984444	GF	On-Demand	Anodyne	ADIPOR1	0	41
Cc1cccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C	ZINC000450984444	GF	On-Demand	Anodyne	ADIPOR2	0	41
COc1cc(-c2noc(CSC3CCC3)n2)ccc1C	ZINC000450984450	CH	On-Demand	Anodyne	QRFPR	44	37
COc1cc(-c2noc(CSC3CCC3)n2)ccc1C	ZINC000450984450	CH	On-Demand	Anodyne	AXIN2	0	47
CCCN(CCN1CCCCC1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450984463	FG	On-Demand	Anodyne	SIGMAR1	15	48
CCCN(CCN1CCCCC1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450984463	FG	On-Demand	Anodyne	RORC	16	47
COCCOc1cc(C)ccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450984470	GE	On-Demand	Anodyne	NFKBIA	0	42
O=C(CSC1CCC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000450984475	DE	On-Demand	Anodyne	MAPK14	32	44
CC(C)(O)C1CN(C(=O)c2cc3c(Br)c(F)ccc3[nH]2)C1	ZINC000450984489	FF	On-Demand	Anodyne	HRH4	29	48
CCOC[C@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984496	FD	On-Demand	Anodyne	LTA4H	49	42
CCOC[C@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984496	FD	On-Demand	Anodyne	THRB	0	40
CCOC[C@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984496	FD	On-Demand	Anodyne	HRH3	17	44
CCOC[C@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984496	FD	On-Demand	Anodyne	PSMB2	48	38
CCOC[C@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984496	FD	On-Demand	Anodyne	PSMB1	42	38
CCOC[C@@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984497	FD	On-Demand	Anodyne	LTA4H	49	42
CCOC[C@@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984497	FD	On-Demand	Anodyne	THRB	0	40
CCOC[C@@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984497	FD	On-Demand	Anodyne	HRH3	17	44
CCOC[C@@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984497	FD	On-Demand	Anodyne	PSMB2	48	38
CCOC[C@@H](C)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450984497	FD	On-Demand	Anodyne	PSMB1	42	38
C[C@@H](Oc1ccccn1)C(=O)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450984506	EG	On-Demand	Anodyne	GPBAR1	40	37
C[C@H](Oc1ccccn1)C(=O)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450984507	EG	On-Demand	Anodyne	GPBAR1	40	37
CCOc1ccc([C@@H]2CCCN2C(=O)CSC2CCC2)cc1	ZINC000450984508	DI	On-Demand	Anodyne	COLA	93	37
CCOc1ccc([C@@H]2CCCN2C(=O)CSC2CCC2)cc1	ZINC000450984508	DI	On-Demand	Anodyne	CPT1A	88	37
CCOc1ccc([C@H]2CCCN2C(=O)CSC2CCC2)cc1	ZINC000450984510	DI	On-Demand	Anodyne	COLA	93	37
CCOc1ccc([C@H]2CCCN2C(=O)CSC2CCC2)cc1	ZINC000450984510	DI	On-Demand	Anodyne	CPT1A	87	37
COc1ccccc1-c1nc(CSC2CCC2)cs1	ZINC000450984526	CJ	On-Demand	Anodyne	QRFPR	45	38
COC(=O)c1c(NC(=O)Cn2nnc(-c3ccncn3)n2)sc(C)c1C	ZINC000450984532	FD	On-Demand	Anodyne	SCARB1	40	33
COC(=O)CCCNS(=O)(=O)c1cnccc1C	ZINC000450984534	CC	On-Demand	Anodyne	TBXAS1	23	41
C[C@H](NC(=O)C1(C(F)(F)F)CCC1)c1ccc(Br)s1	ZINC000450984536	FI	On-Demand	Anodyne	SDH1	0	47
CCOC(=O)CC1(S(=O)(=O)NC[C@@H](C)c2ccccc2)CC1	ZINC000450984538	EE	On-Demand	Anodyne	GRIA4	22	40
CCOC(=O)CC1(S(=O)(=O)NC[C@H](C)c2ccccc2)CC1	ZINC000450984539	EE	On-Demand	Anodyne	GRIA4	22	40
COc1ccc(CSC2CCC2)nn1	ZINC000450984542	BE	On-Demand	Anodyne	QRFPR	41	34
COc1n[nH]c(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)n1	ZINC000450984543	GC	On-Demand	Anodyne	MTNN	80	36
N#Cc1ccc(NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450984556	ED	On-Demand	Mild	DHODH	32	40
N#Cc1ccc(NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450984556	ED	On-Demand	Mild	COLA	24	41
N#Cc1ccc(NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450984556	ED	On-Demand	Mild	CPT1A	25	41
N#Cc1ccc(NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450984560	ED	On-Demand	Mild	DHODH	32	40
N#Cc1ccc(NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450984560	ED	On-Demand	Mild	COLA	24	41
N#Cc1ccc(NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450984560	ED	On-Demand	Mild	CPT1A	25	41
O=C(CCSC1CCC1)Nc1cccc(F)c1	ZINC000450984565	CG	On-Demand	Anodyne	FUCA1	17	47
O=C(c1cccc(NS(=O)(=O)c2sccc2Cl)c1)N1CCCCC1	ZINC000450984575	GH	On-Demand	Anodyne	RHOA	0	45
Cc1csc(S(=O)(=O)NC[C@@H](C)c2ccccc2)c1	ZINC000450984578	CG	On-Demand	Anodyne	GRIA4	24	46
Cc1csc(S(=O)(=O)NC[C@H](C)c2ccccc2)c1	ZINC000450984580	CG	On-Demand	Anodyne	GRIA4	24	46
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984590	DF	On-Demand	Anodyne	SLC6A1	30	43
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984590	DF	On-Demand	Anodyne	SLC6A3	33	45
C[C@@H](c1ccccc1)[C@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984590	DF	On-Demand	Anodyne	GLRA1	43	33
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984591	DF	On-Demand	Anodyne	SLC6A1	30	43
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984591	DF	On-Demand	Anodyne	SLC6A3	33	45
C[C@@H](c1ccccc1)[C@@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984591	DF	On-Demand	Anodyne	GLRA1	43	33
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984592	DF	On-Demand	Anodyne	SLC6A1	30	43
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984592	DF	On-Demand	Anodyne	SLC6A3	33	45
C[C@H](c1ccccc1)[C@@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984592	DF	On-Demand	Anodyne	GLRA1	43	33
C[C@H](c1ccccc1)[C@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984593	DF	On-Demand	Anodyne	SLC6A1	30	43
C[C@H](c1ccccc1)[C@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984593	DF	On-Demand	Anodyne	SLC6A3	33	45
C[C@H](c1ccccc1)[C@H](O)CN(C)C1C[C@@H]2CC[C@H](C1)N2C	ZINC000450984593	DF	On-Demand	Anodyne	GLRA1	43	33
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA2	41	56
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	ADRB2	24	48
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	ADRB1	20	48
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	ADRB3	23	48
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA1	47	53
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA7	18	49
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA5B	18	40
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA4	41	53
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA5A	21	40
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA14	19	49
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	MMP2	24	40
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA12	25	56
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	CA9	28	56
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	IDO1	35	42
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	PFK	0	46
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	LIMK2	46	37
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	P96878_MYCTU	42	37
CCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984609	GG	On-Demand	Anodyne	MGAT1	43	30
CCOC(=O)COc1ccc(OCCSC2CCC2)cc1	ZINC000450984617	DG	On-Demand	Anodyne	PLA2G4B	51	34
COCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450984639	DF	On-Demand	Anodyne	HRH2	32	41
COCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450984639	DF	On-Demand	Anodyne	PDS	52	38
COc1cc(C(=O)NCCc2cn(C)c3cc(C)ccc23)c([N+](=O)[O-])cc1F	ZINC000450984648	GH	On-Demand	Bother	NQO2	33	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	CA14	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	EPHX2	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	TGM2	63	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	F13A1	98	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	AKR1C3	28	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	ELOVL6	0	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	RAC1	0	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	NAMPT	29	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000450984661	FD	On-Demand	Anodyne	DDIT3	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	CA14	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	EPHX2	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	TGM2	63	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	F13A1	98	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	AKR1C3	28	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	ELOVL6	0	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	RAC1	0	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	NAMPT	29	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(N)=O)C2)cc1	ZINC000450984662	FD	On-Demand	Anodyne	DDIT3	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)cc1	ZINC000450984663	GD	On-Demand	Anodyne	CHRM5	21	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)cc1	ZINC000450984663	GD	On-Demand	Anodyne	LPL	43	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)cc1	ZINC000450984663	GD	On-Demand	Anodyne	EPHX2	42	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)cc1	ZINC000450984663	GD	On-Demand	Anodyne	TGM2	77	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)cc1	ZINC000450984663	GD	On-Demand	Anodyne	F13A1	96	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)cc1	ZINC000450984663	GD	On-Demand	Anodyne	AKR1C3	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)cc1	ZINC000450984663	GD	On-Demand	Anodyne	NAMPT	40	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)cc1	ZINC000450984663	GD	On-Demand	Anodyne	DDIT3	0	43
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450984665	GH	On-Demand	Anodyne	L3MBTL3	47	33
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450984665	GH	On-Demand	Anodyne	TRPC6	43	42
CC1(S(=O)(=O)N2CCN(S(=O)(=O)Cc3ccccc3)CC2)CC1	ZINC000450984666	FD	On-Demand	Anodyne	OXTR	41	35
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@H](C(C)C)C2)n1	ZINC000450984669	DH	On-Demand	Anodyne	AVPR2	26	40
COC(=O)[C@@H](Cc1ccc(Cl)cc1)SC1CCC1	ZINC000450984671	CH	On-Demand	Anodyne	SLC6A1	24	41
Cc1ccn(-c2ccccc2C(=O)N2CCC[C@@H](C(C)C)C2)n1	ZINC000450984672	DH	On-Demand	Anodyne	AVPR2	26	40
COC(=O)[C@H](Cc1ccc(Cl)cc1)SC1CCC1	ZINC000450984674	CH	On-Demand	Anodyne	SLC6A1	24	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984679	EC	On-Demand	Mild	MMP10	15	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984679	EC	On-Demand	Mild	MMP7	19	40
Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1C	ZINC000450984683	GF	On-Demand	Anodyne	MMP13	22	40
Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1C	ZINC000450984683	GF	On-Demand	Anodyne	ADAM17	22	40
Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1C	ZINC000450984683	GF	On-Demand	Anodyne	MMP9	17	40
Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cc1C	ZINC000450984683	GF	On-Demand	Anodyne	LUXN	0	43
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984684	EC	On-Demand	Mild	MMP10	15	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984684	EC	On-Demand	Mild	MMP7	19	40
O=C(c1cccc(NS(=O)(=O)c2sccc2F)c1)N1CCCCC1	ZINC000450984692	FG	On-Demand	Anodyne	RHOA	0	43
O=C(CSC1CCC1)N1CCC(C(=O)N2CCCCCC2)CC1	ZINC000450984717	EF	On-Demand	Anodyne	PREP	33	42
Cc1ccc2c(CCNC(=O)c3ccsc3C)cn(C)c2c1	ZINC000450984739	DH	On-Demand	Anodyne	NQO2	17	42
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)C#N)cc1	ZINC000450984746	CD	On-Demand	Mild	TMPRSS11D	56	38
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C)C#N)cc1	ZINC000450984749	CD	On-Demand	Mild	TMPRSS11D	56	38
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2cccs2)cc1	ZINC000450984750	FF	On-Demand	Anodyne	BMP1	23	41
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2cccs2)cc1	ZINC000450984750	FF	On-Demand	Anodyne	CA7	15	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2cccs2)cc1	ZINC000450984750	FF	On-Demand	Anodyne	CA5B	29	40
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCN(CCOc2ccccc2)CC1	ZINC000450984751	GE	On-Demand	Anodyne	LTA4H	59	44
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCN(CCOc2ccccc2)CC1	ZINC000450984751	GE	On-Demand	Anodyne	HRH3	33	43
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCN(CCOc2ccccc2)CC1	ZINC000450984751	GE	On-Demand	Anodyne	PSMB2	49	37
O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCN(CCOc2ccccc2)CC1	ZINC000450984751	GE	On-Demand	Anodyne	PSMB1	42	39
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCN(CCOc2ccccc2)CC1	ZINC000450984752	GE	On-Demand	Anodyne	LTA4H	59	44
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCN(CCOc2ccccc2)CC1	ZINC000450984752	GE	On-Demand	Anodyne	HRH3	33	43
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCN(CCOc2ccccc2)CC1	ZINC000450984752	GE	On-Demand	Anodyne	PSMB2	49	37
O=S(=O)(C[C@H]1CCCC1(F)F)N1CCN(CCOc2ccccc2)CC1	ZINC000450984752	GE	On-Demand	Anodyne	PSMB1	42	39
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	CA2	24	57
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	ADRB1	15	41
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	TBXA2R	41	51
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	BMP1	23	40
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	CA1	32	45
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	KCNA5	0	50
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	CA7	15	41
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	MMP13	41	41
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	CA4	15	45
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	CA14	22	57
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	MMP2	38	41
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	MMP3	20	45
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	ALOX15	52	41
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	MMP9	23	40
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	MMP12	49	36
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	MMP7	22	40
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	IAP	0	43
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	MTCA1	23	45
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	P96878_MYCTU	32	45
COc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450984758	GF	On-Demand	Anodyne	GLMU	0	44
CCOC(=O)c1c(NC(=O)Cn2nnc(-c3ccncn3)n2)sc2c1CCC2	ZINC000450984764	GD	On-Demand	Anodyne	NS5B	0	49
CCOC(=O)c1c(NC(=O)Cn2nnc(-c3ccncn3)n2)sc2c1CCC2	ZINC000450984764	GD	On-Demand	Anodyne	FLT3	15	41
CCOC(=O)c1c(NC(=O)Cn2nnc(-c3ccncn3)n2)sc2c1CCC2	ZINC000450984764	GD	On-Demand	Anodyne	SCARB1	43	33
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	CA2	33	47
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	ADRB2	26	52
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	ADRB1	21	52
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	ADRB3	20	52
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	CA1	44	37
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	MMP13	48	47
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	GUAB	0	40
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	CA4	28	47
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	CA14	16	46
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	MMP2	38	47
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	MMP3	18	47
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	MMP8	19	47
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	MMP14	22	47
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	PRTN3	52	35
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	MMP9	25	43
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	MMP12	41	40
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	CA12	32	40
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	MMP7	24	40
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	ADAMTS4	44	36
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	CA9	33	41
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	LEF	30	41
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	IDO1	35	42
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450984773	GH	On-Demand	Anodyne	ELOVL6	0	40
Cc1conc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450984775	FD	On-Demand	Anodyne	MTNN	52	37
CCN(c1cccc(F)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984776	GF	On-Demand	Anodyne	LUXN	0	42
COC(=O)CCCNS(=O)(=O)Cc1ccc(C#N)cc1F	ZINC000450984777	DD	On-Demand	Mild	MURD	0	40
COC(=O)CCCNS(=O)(=O)c1c(C)ccc2cccnc12	ZINC000450984781	DD	On-Demand	Anodyne	C0L093_TOBAC	56	31
CC(C)N1CCCC[C@@H]1CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984791	GG	On-Demand	Anodyne	DRD3	0	40
CC(C)N1CCCC[C@@H]1CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984791	GG	On-Demand	Anodyne	SIGMAR1	35	40
CC(C)N1CCCC[C@@H]1CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984796	GG	On-Demand	Anodyne	DRD3	0	40
CC(C)N1CCCC[C@@H]1CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984796	GG	On-Demand	Anodyne	SIGMAR1	35	40
CC(C)N1CCCC[C@H]1CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984797	GG	On-Demand	Anodyne	DRD3	0	40
CC(C)N1CCCC[C@H]1CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984797	GG	On-Demand	Anodyne	SIGMAR1	35	40
CC(C)N1CCCC[C@H]1CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984798	GG	On-Demand	Anodyne	DRD3	0	40
CC(C)N1CCCC[C@H]1CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984798	GG	On-Demand	Anodyne	SIGMAR1	35	40
Cc1ccccc1CN1CCC(NC(=O)CSC2CCC2)CC1	ZINC000450984804	EG	On-Demand	Anodyne	SIGMAR1	27	52
Cc1ccccc1CN1CCC(NC(=O)CSC2CCC2)CC1	ZINC000450984804	EG	On-Demand	Anodyne	CCR3	25	43
Cc1ccccc1CN1CCC(NC(=O)CSC2CCC2)CC1	ZINC000450984804	EG	On-Demand	Anodyne	MCHR1	27	42
Cc1ccccc1CN1CCC(NC(=O)CSC2CCC2)CC1	ZINC000450984804	EG	On-Demand	Anodyne	CCR8	43	32
O=C(CSC1CCC1)N1CCC(OCc2ccccc2)CC1	ZINC000450984809	DG	On-Demand	Anodyne	GRIN2B	30	48
O=C(CSC1CCC1)N1CCC(OCc2ccccc2)CC1	ZINC000450984809	DG	On-Demand	Anodyne	PREP	41	37
O=C(CSC1CCC1)N1CCC(OCc2ccccc2)CC1	ZINC000450984809	DG	On-Demand	Anodyne	SCD	20	40
Cc1ccc2c(CCNC(=O)CCCC(=O)C(C)(C)C)cn(C)c2c1	ZINC000450984814	EH	On-Demand	Anodyne	NQO2	18	43
COc1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984817	GD	On-Demand	Anodyne	PRTN3	60	37
COc1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984817	GD	On-Demand	Anodyne	LUXN	0	46
COc1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984817	GD	On-Demand	Anodyne	ADIPOR1	0	40
COc1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984817	GD	On-Demand	Anodyne	ADIPOR2	0	40
Cc1ccc2c(CCNC(=O)c3cn4nccc4nc3C)cn(C)c2c1	ZINC000450984822	EF	On-Demand	Anodyne	DDR1	50	36
COc1ccccc1CCNS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450984829	GD	On-Demand	Anodyne	NQO2	16	42
Cn1ccnc1COc1ccc(CSC2CCC2)cc1	ZINC000450984834	CH	On-Demand	Anodyne	VCP	55	37
COC(=O)c1ccccc1NC(=O)CSC1CCC1	ZINC000450984835	CF	On-Demand	Anodyne	QRFPR	40	36
COC(=O)c1ccccc1NC(=O)CSC1CCC1	ZINC000450984835	CF	On-Demand	Anodyne	FAS	83	61
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000450984836	GE	On-Demand	Anodyne	MMP13	63	44
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000450984836	GE	On-Demand	Anodyne	MMP3	59	44
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000450984836	GE	On-Demand	Anodyne	MMP8	34	40
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000450984836	GE	On-Demand	Anodyne	MMP9	43	43
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000450984836	GE	On-Demand	Anodyne	MMP12	20	40
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000450984836	GE	On-Demand	Anodyne	MMP7	54	44
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000450984836	GE	On-Demand	Anodyne	MMP1	63	47
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000450984837	GE	On-Demand	Anodyne	MMP13	63	44
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000450984837	GE	On-Demand	Anodyne	MMP3	59	44
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000450984837	GE	On-Demand	Anodyne	MMP8	34	40
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000450984837	GE	On-Demand	Anodyne	MMP9	43	43
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000450984837	GE	On-Demand	Anodyne	MMP12	20	40
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000450984837	GE	On-Demand	Anodyne	MMP7	54	44
COC(=O)c1ncccc1S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000450984837	GE	On-Demand	Anodyne	MMP1	63	47
CCOC(=O)[C@@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc(OC)c(F)c1	ZINC000450984842	FD	On-Demand	Anodyne	P2RX7	24	43
CCOC(=O)[C@H](NC(=O)[C@H]1CCC(=O)N1C)c1ccc(OC)c(F)c1	ZINC000450984843	FD	On-Demand	Anodyne	P2RX7	24	43
CCOC(=O)[C@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(OC)c(F)c1	ZINC000450984844	FD	On-Demand	Anodyne	P2RX7	24	43
CCOC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(OC)c(F)c1	ZINC000450984845	FD	On-Demand	Anodyne	P2RX7	24	43
O=C([C@@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984852	FG	On-Demand	Anodyne	RBP4	58	38
O=C([C@@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984852	FG	On-Demand	Anodyne	SCD1	30	40
O=C([C@@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984852	FG	On-Demand	Anodyne	SFRP1	52	30
O=C([C@@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984852	FG	On-Demand	Anodyne	SCD	33	41
O=C([C@@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984852	FG	On-Demand	Anodyne	WNT3	55	32
O=C([C@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984854	FG	On-Demand	Anodyne	RBP4	58	38
O=C([C@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984854	FG	On-Demand	Anodyne	SCD1	30	40
O=C([C@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984854	FG	On-Demand	Anodyne	SFRP1	52	30
O=C([C@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984854	FG	On-Demand	Anodyne	SCD	33	41
O=C([C@H](O)C1CCC1)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000450984854	FG	On-Demand	Anodyne	WNT3	55	32
CC(F)(F)c1ccc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)cn1	ZINC000450984860	FH	On-Demand	Anodyne	SCD1	28	41
CC(F)(F)c1ccc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)cn1	ZINC000450984860	FH	On-Demand	Anodyne	SCD	24	41
Nc1ncnc2c1ncn2CCCSC1CCC1	ZINC000450984863	CE	On-Demand	Anodyne	AHCY	32	40
Nc1ncnc2c1ncn2CCCSC1CCC1	ZINC000450984863	CE	On-Demand	Anodyne	HSP90B1	54	31
O=C(c1ccc(NS(=O)(=O)c2cnc(O)s2)cc1)N1CCCCCC1	ZINC000450984864	GF	On-Demand	Anodyne	L3MBTL3	54	37
COCc1cccc(OCC2(CN3CCCC[C@H]3c3nc(O)n[nH]3)CC2)c1	ZINC000450984866	FG	On-Demand	Anodyne	COLA	55	39
COCc1cccc(OCC2(CN3CCCC[C@H]3c3nc(O)n[nH]3)CC2)c1	ZINC000450984866	FG	On-Demand	Anodyne	CPT1A	49	39
COCc1cccc(OCC2(CN3CCCC[C@@H]3c3nc(O)n[nH]3)CC2)c1	ZINC000450984867	FG	On-Demand	Anodyne	COLA	55	39
COCc1cccc(OCC2(CN3CCCC[C@@H]3c3nc(O)n[nH]3)CC2)c1	ZINC000450984867	FG	On-Demand	Anodyne	CPT1A	49	39
C=CC(C)(C)C(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000450984877	CG	On-Demand	Mild	NQO2	17	42
O[C@H](Cc1ccccc1)CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450984878	FG	On-Demand	Anodyne	VACHT_TETCF	0	44
O[C@H](Cc1ccccc1)CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450984878	FG	On-Demand	Anodyne	SIGMAR1	49	44
O[C@H](Cc1ccccc1)CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450984878	FG	On-Demand	Anodyne	SLC18A3	39	45
O[C@H](Cc1ccccc1)CN1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450984878	FG	On-Demand	Anodyne	NPFFR1	43	33
O[C@H](Cc1ccccc1)CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450984879	FG	On-Demand	Anodyne	VACHT_TETCF	0	44
O[C@H](Cc1ccccc1)CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450984879	FG	On-Demand	Anodyne	SIGMAR1	49	44
O[C@H](Cc1ccccc1)CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450984879	FG	On-Demand	Anodyne	SLC18A3	39	45
O[C@H](Cc1ccccc1)CN1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000450984879	FG	On-Demand	Anodyne	NPFFR1	43	33
N#CCN(C1CC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984888	ED	On-Demand	Mild	TRAR	32	40
N#CCN(C1CC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984888	ED	On-Demand	Mild	LUXN	0	42
N#CCN(C1CC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984888	ED	On-Demand	Mild	ADIPOR1	0	43
N#CCN(C1CC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450984888	ED	On-Demand	Mild	ADIPOR2	0	43
COc1ccc(-c2noc([C@H](C)SC3CCC3)n2)cc1	ZINC000450984898	CI	On-Demand	Anodyne	LUCI_PHOPE	15	40
COc1ccc(-c2noc([C@@H](C)SC3CCC3)n2)cc1	ZINC000450984900	CI	On-Demand	Anodyne	LUCI_PHOPE	15	40
CC(C)CN(CC(C)C)C(=O)Cn1nnc(-c2ccncn2)n1	ZINC000450984909	DD	On-Demand	Anodyne	SCARB1	52	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984928	GG	On-Demand	Anodyne	DRD2	0	42
CO[C@@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984928	GG	On-Demand	Anodyne	DRD4	42	41
CO[C@@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984928	GG	On-Demand	Anodyne	ACHE	23	42
CO[C@@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984928	GG	On-Demand	Anodyne	DRD3	28	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984928	GG	On-Demand	Anodyne	SLC6A3	22	50
CO[C@@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984928	GG	On-Demand	Anodyne	VACHT_TETCF	0	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984928	GG	On-Demand	Anodyne	SIGMAR1	49	42
CO[C@@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984928	GG	On-Demand	Anodyne	SLC18A3	26	40
CO[C@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984929	GG	On-Demand	Anodyne	DRD2	0	42
CO[C@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984929	GG	On-Demand	Anodyne	DRD4	42	41
CO[C@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984929	GG	On-Demand	Anodyne	ACHE	23	42
CO[C@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984929	GG	On-Demand	Anodyne	DRD3	28	40
CO[C@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984929	GG	On-Demand	Anodyne	SLC6A3	22	50
CO[C@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984929	GG	On-Demand	Anodyne	VACHT_TETCF	0	40
CO[C@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984929	GG	On-Demand	Anodyne	SIGMAR1	49	42
CO[C@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984929	GG	On-Demand	Anodyne	SLC18A3	26	40
CO[C@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984930	GG	On-Demand	Anodyne	DRD2	0	42
CO[C@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984930	GG	On-Demand	Anodyne	DRD4	42	41
CO[C@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984930	GG	On-Demand	Anodyne	ACHE	23	42
CO[C@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984930	GG	On-Demand	Anodyne	DRD3	28	40
CO[C@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984930	GG	On-Demand	Anodyne	SLC6A3	22	50
CO[C@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984930	GG	On-Demand	Anodyne	VACHT_TETCF	0	40
CO[C@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984930	GG	On-Demand	Anodyne	SIGMAR1	49	42
CO[C@H](Cc1ccccc1)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984930	GG	On-Demand	Anodyne	SLC18A3	26	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984931	GG	On-Demand	Anodyne	DRD2	0	42
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984931	GG	On-Demand	Anodyne	DRD4	42	41
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984931	GG	On-Demand	Anodyne	ACHE	23	42
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984931	GG	On-Demand	Anodyne	DRD3	28	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984931	GG	On-Demand	Anodyne	SLC6A3	22	50
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984931	GG	On-Demand	Anodyne	VACHT_TETCF	0	40
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984931	GG	On-Demand	Anodyne	SIGMAR1	49	42
CO[C@@H](Cc1ccccc1)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000450984931	GG	On-Demand	Anodyne	SLC18A3	26	40
COc1ccc(CNC(=O)CCN2C[C@@H](N3CCCC3)C[C@H]2C)c(OC)c1	ZINC000450984935	GE	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2C[C@H](N3CCCC3)C[C@@H]2C)c(OC)c1	ZINC000450984936	GE	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2C[C@H](N3CCCC3)C[C@H]2C)c(OC)c1	ZINC000450984938	GE	On-Demand	Anodyne	MTNR1A	47	36
COc1ccc(CNC(=O)CCN2C[C@@H](N3CCCC3)C[C@@H]2C)c(OC)c1	ZINC000450984939	GE	On-Demand	Anodyne	MTNR1A	47	36
c1ccc(CN2CC[C@]3(CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)C2)cc1	ZINC000450984961	EG	On-Demand	Anodyne	SIGMAR1	47	40
c1ccc(CN2CC[C@@]3(CCN(C[C@@H]4C[C@H]5CC[C@H]4O5)C3)C2)cc1	ZINC000450984962	EG	On-Demand	Anodyne	SIGMAR1	47	40
c1ccc(CN2CC[C@]3(CCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)C2)cc1	ZINC000450984963	EG	On-Demand	Anodyne	SIGMAR1	47	40
c1ccc(CN2CC[C@@]3(CCN(C[C@H]4C[C@H]5CC[C@H]4O5)C3)C2)cc1	ZINC000450984964	EG	On-Demand	Anodyne	SIGMAR1	47	40
COC(=O)c1ccc(CC(=O)NCCc2cn(C)c3cc(C)ccc23)cc1	ZINC000450984970	FG	On-Demand	Anodyne	MTNR1A	30	47
O=S(=O)(c1sccc1Cl)N1CCN(CCOc2ccccc2)CC1	ZINC000450984987	GF	On-Demand	Anodyne	LTA4H	60	46
O=S(=O)(c1sccc1Cl)N1CCN(CCOc2ccccc2)CC1	ZINC000450984987	GF	On-Demand	Anodyne	KCNA5	0	45
O=S(=O)(c1sccc1Cl)N1CCN(CCOc2ccccc2)CC1	ZINC000450984987	GF	On-Demand	Anodyne	HRH3	23	48
O=S(=O)(c1sccc1Cl)N1CCN(CCOc2ccccc2)CC1	ZINC000450984987	GF	On-Demand	Anodyne	HTR6	15	48
O=S(=O)(c1sccc1Cl)N1CCN(CCOc2ccccc2)CC1	ZINC000450984987	GF	On-Demand	Anodyne	PSMB2	49	36
O=S(=O)(c1sccc1Cl)N1CCN(CCOc2ccccc2)CC1	ZINC000450984987	GF	On-Demand	Anodyne	PSMB1	42	40
CCc1ccc(NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450984989	EE	On-Demand	Anodyne	COLA	19	40
CCc1ccc(NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450984990	EE	On-Demand	Anodyne	COLA	19	40
O=[N+]([O-])c1ccc2nc(CSC3CCC3)[nH]c2c1	ZINC000450984991	CG	On-Demand	Bother	TXN	22	58
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc3ccccc3c2F)C1	ZINC000450984994	ED	On-Demand	Anodyne	AKR1C3	0	49
NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc3ccccc3c2F)C1	ZINC000450984995	ED	On-Demand	Anodyne	AKR1C3	0	49
CC(C)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450984996	EG	On-Demand	Bother	HPGD	25	45
CC(C)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1	ZINC000450984997	EG	On-Demand	Bother	HPGD	25	45
Cc1nc([C@H]2CCCN2C(=O)Cc2sccc2Br)cs1	ZINC000450985008	FI	On-Demand	Anodyne	COLA	47	42
Cc1nc([C@H]2CCCN2C(=O)Cc2sccc2Br)cs1	ZINC000450985008	FI	On-Demand	Anodyne	CPT1A	45	42
C[C@H](SC1CCC1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000450985010	DG	On-Demand	Anodyne	ERBB2	19	44
C[C@H](SC1CCC1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000450985010	DG	On-Demand	Anodyne	CCR1	18	43
C[C@H](SC1CCC1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000450985010	DG	On-Demand	Anodyne	AKR1C3	18	43
C[C@@H](SC1CCC1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000450985011	DG	On-Demand	Anodyne	ERBB2	19	44
C[C@@H](SC1CCC1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000450985011	DG	On-Demand	Anodyne	CCR1	18	43
C[C@@H](SC1CCC1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000450985011	DG	On-Demand	Anodyne	AKR1C3	18	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	CA2	18	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	PPIA	25	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	MMP13	33	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	GUAB	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	CA14	16	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	MMP2	22	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	MMP12	40	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	CA12	20	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	ADAMTS4	33	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	CA9	18	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	LEF	53	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	IDO1	33	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	PFK	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)cc1	ZINC000450985023	GH	On-Demand	Anodyne	IMDH_CRYPV	27	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	CA2	18	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	PPIA	25	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	MMP13	33	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	GUAB	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	CA14	16	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	MMP2	22	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	MMP12	40	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	CA12	20	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	ADAMTS4	33	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	CA9	18	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	LEF	53	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	IDO1	33	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	PFK	0	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccc(Cl)c2)cc1	ZINC000450985024	GH	On-Demand	Anodyne	IMDH_CRYPV	27	44
Cc1csc(S(=O)(=O)Nc2ccccc2NC(=O)NC(C)C)c1	ZINC000450985029	FG	On-Demand	Anodyne	LPL	53	39
CC(C)C[C@@H](C)N1CCOc2cc(O)ccc2C1	ZINC000450985033	BG	On-Demand	Anodyne	DRD5	17	44
CC(C)C[C@H](C)N1CCOc2cc(O)ccc2C1	ZINC000450985034	BG	On-Demand	Anodyne	DRD5	17	44
NC(=O)[C@@H]1CCCN(S(=O)(=O)c2sc3ccccc3c2Cl)C1	ZINC000450985035	FE	On-Demand	Anodyne	AKR1C3	17	44
NC(=O)[C@H]1CCCN(S(=O)(=O)c2sc3ccccc3c2Cl)C1	ZINC000450985036	FE	On-Demand	Anodyne	AKR1C3	17	44
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	CA2	20	42
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	CA1	27	44
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	BDKRB1	0	46
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	GRM4	23	45
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	CA14	15	42
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	MMP2	22	44
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	PRTN3	59	40
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	CA12	17	50
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	CA9	18	42
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	LIMK2	25	41
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	MTCA1	21	44
CC(C)Oc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985038	GH	On-Demand	Anodyne	P96878_MYCTU	27	44
CCCS(=O)(=O)Nc1ccc(S(=O)(=O)Nc2nncs2)c(F)c1	ZINC000450985043	GD	On-Demand	Anodyne	SCN9A	0	45
Cc1cccc(Cl)c1CN[C@H]1CSC[C@@H]1C	ZINC000450985072	CG	On-Demand	Anodyne	EIF2AK1	41	36
Cc1cccc(Cl)c1CN[C@@H]1CSC[C@@H]1C	ZINC000450985073	CG	On-Demand	Anodyne	EIF2AK1	41	36
Cc1cccc(Cl)c1CN[C@H]1CSC[C@H]1C	ZINC000450985074	CG	On-Demand	Anodyne	EIF2AK1	41	36
Cc1cccc(Cl)c1CN[C@@H]1CSC[C@H]1C	ZINC000450985075	CG	On-Demand	Anodyne	EIF2AK1	41	36
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	FKBP1A	39	43
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	MMP13	72	50
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	CCR4	0	41
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	ADAM17	67	42
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	MMP2	37	40
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	MMP3	72	50
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	MMP8	28	40
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	MMP9	34	43
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	EPHX2	27	45
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	MMP7	77	50
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	MMP1	79	50
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	LUXN	0	46
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	ADIPOR1	0	44
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985078	GC	On-Demand	Anodyne	ADIPOR2	0	44
O=C(CSC1CCC1)NCCOc1ccc2c(c1)OCO2	ZINC000450985080	DE	On-Demand	Anodyne	NOS2	76	35
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	FKBP1A	39	43
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	MMP13	72	50
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	CCR4	0	41
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	ADAM17	67	42
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	MMP2	37	40
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	MMP3	72	50
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	MMP8	28	40
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	MMP9	34	43
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	EPHX2	27	45
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	MMP7	77	50
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	MMP1	79	50
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	LUXN	0	46
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	ADIPOR1	0	44
NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985082	GC	On-Demand	Anodyne	ADIPOR2	0	44
O=S(=O)(c1sccc1Cl)N1CCC[C@@H]1c1ccc2c(c1)OCCO2	ZINC000450985103	GH	On-Demand	Anodyne	PKM	34	40
O=S(=O)(c1sccc1Cl)N1CCC[C@H]1c1ccc2c(c1)OCCO2	ZINC000450985104	GH	On-Demand	Anodyne	PKM	34	40
CCOC(=O)CC1(S(=O)(=O)NCCc2cccc(Cl)c2)CC1	ZINC000450985109	EE	On-Demand	Anodyne	TBXA2R	42	34
COC(=O)CCCNS(=O)(=O)c1ccc(C(=O)OC)c(OC)c1	ZINC000450985117	EC	On-Demand	Anodyne	IAP	0	43
CS(=O)(=O)c1ccc(CSC2CCC2)cc1	ZINC000450985135	CF	On-Demand	Anodyne	O49150_SOLTU	49	33
CC(C)[C@H](CNC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450985140	FF	On-Demand	Anodyne	COLA	43	39
CC(C)[C@@H](CNC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450985141	FF	On-Demand	Anodyne	COLA	43	39
CC(C)[C@H](CNC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450985143	FF	On-Demand	Anodyne	COLA	43	39
CC(C)[C@@H](CNC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450985145	FF	On-Demand	Anodyne	COLA	43	39
CCOC(=O)c1ccc(CS(=O)(=O)N2CCN(C)Cc3ccccc32)cc1	ZINC000450985155	GF	On-Demand	Anodyne	NOD1	26	45
CCOC(=O)c1ccc(CS(=O)(=O)N2CCN(C)Cc3ccccc32)cc1	ZINC000450985155	GF	On-Demand	Anodyne	NOD2	41	45
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	CA2	20	46
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	ADRB2	15	44
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	ADRB1	15	44
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	CA1	24	42
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	MMP13	31	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	CA4	26	40
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	ALPL	16	43
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	ADAMTS4	54	36
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1F	ZINC000450985157	GH	On-Demand	Anodyne	LEF	60	43
COc1cc([N+](=O)[O-])ccc1CSC1CCC1	ZINC000450985158	CG	On-Demand	Bother	QRFPR	49	41
COCc1cccc(OCC2(CN3CCCC[C@@H]3c3nc(O)n[nH]3)CCC2)c1	ZINC000450985164	GG	On-Demand	Anodyne	COLA	50	38
COCc1cccc(OCC2(CN3CCCC[C@@H]3c3nc(O)n[nH]3)CCC2)c1	ZINC000450985164	GG	On-Demand	Anodyne	CPT1A	50	38
COCc1cccc(OCC2(CN3CCCC[C@H]3c3nc(O)n[nH]3)CCC2)c1	ZINC000450985165	GG	On-Demand	Anodyne	COLA	50	38
COCc1cccc(OCC2(CN3CCCC[C@H]3c3nc(O)n[nH]3)CCC2)c1	ZINC000450985165	GG	On-Demand	Anodyne	CPT1A	50	38
C[C@H](SC1CCC1)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000450985170	EF	On-Demand	Anodyne	DPOL_HHV11	0	41
C[C@H](SC1CCC1)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000450985170	EF	On-Demand	Anodyne	DPOL_VZVD	23	41
C[C@@H](SC1CCC1)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000450985172	EF	On-Demand	Anodyne	DPOL_HHV11	0	41
C[C@@H](SC1CCC1)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000450985172	EF	On-Demand	Anodyne	DPOL_VZVD	23	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CC#N)CC#N)cc1	ZINC000450985173	DD	On-Demand	Mild	CA1	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CC#N)CC#N)cc1	ZINC000450985173	DD	On-Demand	Mild	COLA	68	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CC#N)CC#N)cc1	ZINC000450985173	DD	On-Demand	Mild	P96878_MYCTU	40	36
C[C@@H](CNS(=O)(=O)C[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450985178	EH	On-Demand	Anodyne	GRIA4	24	42
C[C@H](CNS(=O)(=O)C[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450985179	EH	On-Demand	Anodyne	GRIA4	24	42
C[C@H](CNS(=O)(=O)C[C@H]1CCCCC1(F)F)c1ccccc1	ZINC000450985181	EH	On-Demand	Anodyne	GRIA4	24	42
C[C@@H](CNS(=O)(=O)C[C@@H]1CCCCC1(F)F)c1ccccc1	ZINC000450985182	EH	On-Demand	Anodyne	GRIA4	24	42
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	CA2	22	40
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	ADRB1	15	44
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	CA1	28	42
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	SSTR5	20	42
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	MMP13	34	41
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	CA4	24	40
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	CA14	16	42
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	MMP12	43	37
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	ALPL	27	43
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	ADAMTS4	41	34
CCOc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1OC	ZINC000450985189	GG	On-Demand	Anodyne	ENPP1	61	33
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCc2ccccc2F)c1	ZINC000450985191	FD	On-Demand	Anodyne	NQO2	21	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCn2ccnc2)cc1	ZINC000450985192	ED	On-Demand	Anodyne	TBXAS1	59	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCn2ccnc2)cc1	ZINC000450985192	ED	On-Demand	Anodyne	QPCT	40	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCn2ccnc2)cc1	ZINC000450985192	ED	On-Demand	Anodyne	NAMPT	25	42
CCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450985201	CG	On-Demand	Anodyne	HRH2	26	41
CCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450985201	CG	On-Demand	Anodyne	MTNR1A	24	40
CCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450985201	CG	On-Demand	Anodyne	PDS	65	37
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccon2)cc1	ZINC000450985212	FD	On-Demand	Anodyne	MTNN	55	38
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccon2)cc1	ZINC000450985212	FD	On-Demand	Anodyne	PFK	0	49
CCOC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1cc(C)cs1	ZINC000450985216	FF	On-Demand	Anodyne	HCRTR2	23	55
CCOC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1cc(C)cs1	ZINC000450985216	FF	On-Demand	Anodyne	TDP1	0	42
O=C(NC1CCN(C(=O)CSC2CCC2)CC1)c1ccccc1	ZINC000450985217	EF	On-Demand	Anodyne	C3AR1	42	38
O=C(NC1CCN(C(=O)CSC2CCC2)CC1)c1ccccc1	ZINC000450985217	EF	On-Demand	Anodyne	EPHX2	32	41
O=C(NC1CCN(C(=O)CSC2CCC2)CC1)c1ccccc1	ZINC000450985217	EF	On-Demand	Anodyne	FAP	0	40
CN1C[C@@H](CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])Cc2ccccc21	ZINC000450985222	GH	On-Demand	Bother	LIPG	40	34
CN1C[C@H](CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])Cc2ccccc21	ZINC000450985223	GH	On-Demand	Bother	LIPG	40	34
O=C(Cc1nc(CSC2CCC2)cs1)Nc1ccccc1	ZINC000450985225	DI	On-Demand	Anodyne	QRFPR	40	35
Cc1cccc2nc(C3CCN(C(=O)CC4(O)CCC4)CC3)oc12	ZINC000450985256	EG	On-Demand	Anodyne	SMO	48	42
Cc1cccc2nc(C3CCN(C(=O)CC4(O)CCC4)CC3)oc12	ZINC000450985256	EG	On-Demand	Anodyne	ETHR	53	33
CS(=O)(=O)c1ccc2c(c1)CCCN2S(=O)(=O)c1sccc1F	ZINC000450985275	GE	On-Demand	Anodyne	CYP11B2	33	44
COc1ccc([C@@H](NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)C2CC2)cc1	ZINC000450985278	GE	On-Demand	Anodyne	COLA	41	37
COc1ccc([C@@H](NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)C2CC2)cc1	ZINC000450985278	GE	On-Demand	Anodyne	CPT1A	42	36
COc1ccc([C@H](NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)C2CC2)cc1	ZINC000450985279	GE	On-Demand	Anodyne	COLA	41	37
COc1ccc([C@H](NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)C2CC2)cc1	ZINC000450985279	GE	On-Demand	Anodyne	CPT1A	42	36
COc1ccc([C@H](NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)C2CC2)cc1	ZINC000450985280	GE	On-Demand	Anodyne	COLA	41	37
COc1ccc([C@H](NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)C2CC2)cc1	ZINC000450985280	GE	On-Demand	Anodyne	CPT1A	42	36
COc1ccc([C@@H](NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)C2CC2)cc1	ZINC000450985281	GE	On-Demand	Anodyne	COLA	41	37
COc1ccc([C@@H](NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)C2CC2)cc1	ZINC000450985281	GE	On-Demand	Anodyne	CPT1A	42	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)cc2F)cc1	ZINC000450985288	GH	On-Demand	Anodyne	MMP13	28	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)cc2F)cc1	ZINC000450985288	GH	On-Demand	Anodyne	MMP2	19	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)cc2F)cc1	ZINC000450985288	GH	On-Demand	Anodyne	LEF	62	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)cc2F)cc1	ZINC000450985288	GH	On-Demand	Anodyne	IDO1	32	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)cc2F)cc1	ZINC000450985289	GH	On-Demand	Anodyne	MMP13	28	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)cc2F)cc1	ZINC000450985289	GH	On-Demand	Anodyne	MMP2	19	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)cc2F)cc1	ZINC000450985289	GH	On-Demand	Anodyne	LEF	62	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)cc2F)cc1	ZINC000450985289	GH	On-Demand	Anodyne	IDO1	32	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(=O)N(C)C)ccn2)cc1	ZINC000450985302	GE	On-Demand	Anodyne	GRM4	16	40
Oc1n[nH]c([C@@H]2CCCCN2CCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450985303	FH	On-Demand	Anodyne	HRH3	27	42
Oc1n[nH]c([C@@H]2CCCCN2CCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450985303	FH	On-Demand	Anodyne	COLA	52	44
Oc1n[nH]c([C@@H]2CCCCN2CCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450985303	FH	On-Demand	Anodyne	CPT1A	47	40
Oc1n[nH]c([C@H]2CCCCN2CCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450985304	FH	On-Demand	Anodyne	HRH3	27	42
Oc1n[nH]c([C@H]2CCCCN2CCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450985304	FH	On-Demand	Anodyne	COLA	52	44
Oc1n[nH]c([C@H]2CCCCN2CCCOc2cccc(C(F)(F)F)c2)n1	ZINC000450985304	FH	On-Demand	Anodyne	CPT1A	47	40
COc1cc(CC(=O)N2CCN(CC(C)(C)O)[C@H](C)C2)ccc1Cl	ZINC000450985305	FE	On-Demand	Anodyne	CCR1	27	43
COc1cc(CC(=O)N2CCN(CC(C)(C)O)[C@@H](C)C2)ccc1Cl	ZINC000450985306	FE	On-Demand	Anodyne	CCR1	27	43
COCC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985317	GD	On-Demand	Anodyne	LTA4H	42	49
COCC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985317	GD	On-Demand	Anodyne	KCNA5	0	50
COCC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985317	GD	On-Demand	Anodyne	PSMB2	48	39
COCC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985317	GD	On-Demand	Anodyne	PSMB1	42	37
Cc1cccc(CN2CCN(S(=O)(=O)CC3CC(F)(F)C3)CC2)c1	ZINC000450985323	FE	On-Demand	Anodyne	DRD4	15	42
N#CC1(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CCCCC1	ZINC000450985326	GD	On-Demand	Mild	LUXN	0	43
COC(=O)c1coc(CSC2CCC2)c1	ZINC000450985328	BF	On-Demand	Anodyne	QRFPR	41	35
O=C(c1cc2ccncc2s1)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450985329	FI	On-Demand	Anodyne	GPBAR1	52	45
COc1n[nH]c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450985331	ED	On-Demand	Anodyne	CA1	16	40
COc1n[nH]c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450985331	ED	On-Demand	Anodyne	MMP2	15	40
COc1n[nH]c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450985331	ED	On-Demand	Anodyne	CA12	15	40
Cc1csc(S(=O)(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450985334	FG	On-Demand	Anodyne	HTR1D	30	43
Cc1csc(S(=O)(=O)Nc2cccc(CCN3CCCC3)c2)c1	ZINC000450985334	FG	On-Demand	Anodyne	HTR1B	26	42
CSc1ccc(NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450985337	EE	On-Demand	Anodyne	AURKC	49	39
CSc1ccc(NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450985338	EE	On-Demand	Anodyne	AURKC	49	39
N#Cc1cccc(OCCSC2CCC2)c1	ZINC000450985345	BG	On-Demand	Mild	CHRNA10	53	53
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(C(C)(C)O)C1	ZINC000450985346	DF	On-Demand	Anodyne	CACNA1B	45	40
Cc1cc(C(F)(F)F)ccc1C(=O)N1CC(C(C)(C)O)C1	ZINC000450985346	DF	On-Demand	Anodyne	LIPG	49	38
CN(C)C(=O)CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985353	FC	On-Demand	Anodyne	MMP13	18	47
CN(C)C(=O)CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985353	FC	On-Demand	Anodyne	ADAM17	20	40
CN(C)C(=O)CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985353	FC	On-Demand	Anodyne	MMP8	16	47
CN(C)C(=O)CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985353	FC	On-Demand	Anodyne	MMP9	18	47
CC(C)[C@H](SC1CCC1)C(=O)NCc1cccnc1	ZINC000450985354	CG	On-Demand	Anodyne	C3AR1	41	37
CC(C)[C@H](SC1CCC1)C(=O)NCc1cccnc1	ZINC000450985354	CG	On-Demand	Anodyne	NAMPT	54	40
CC(C)[C@@H](SC1CCC1)C(=O)NCc1cccnc1	ZINC000450985355	CG	On-Demand	Anodyne	C3AR1	41	37
CC(C)[C@@H](SC1CCC1)C(=O)NCc1cccnc1	ZINC000450985355	CG	On-Demand	Anodyne	NAMPT	54	40
N#Cc1ccccc1OCCSC1CCC1	ZINC000450985356	BG	On-Demand	Mild	ADRB1	40	31
Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985362	GF	On-Demand	Anodyne	MMP13	35	40
Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985362	GF	On-Demand	Anodyne	ADAM17	38	40
Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985362	GF	On-Demand	Anodyne	MMP9	25	40
Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985362	GF	On-Demand	Anodyne	LUXN	0	45
Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985362	GF	On-Demand	Anodyne	ADIPOR1	0	41
Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985362	GF	On-Demand	Anodyne	ADIPOR2	0	41
O=C(CSC1CCC1)NCCc1ccc(OC(F)(F)F)cc1	ZINC000450985370	EH	On-Demand	Anodyne	SCN9A	0	45
O=C(CSC1CCC1)NCCc1ccc(OC(F)(F)F)cc1	ZINC000450985370	EH	On-Demand	Anodyne	SLC6A5	17	41
COc1ccc(CSC2CCC2)cc1C#N	ZINC000450985372	BG	On-Demand	Mild	QRFPR	49	42
c1ccc(OCCCSC2CCC2)cc1	ZINC000450985374	BH	On-Demand	Anodyne	LTA4H	35	40
CCNC(=O)c1ccc(NS(=O)(=O)c2cc(C)cs2)c(C)c1	ZINC000450985381	EF	On-Demand	Anodyne	ITGAV	47	38
c1ccc(CN2CCCO[C@H](CSC3CCC3)C2)cc1	ZINC000450985386	CH	On-Demand	Anodyne	DRD4	25	47
c1ccc(CN2CCCO[C@H](CSC3CCC3)C2)cc1	ZINC000450985386	CH	On-Demand	Anodyne	SIGMAR1	25	41
c1ccc(CN2CCCO[C@@H](CSC3CCC3)C2)cc1	ZINC000450985387	CH	On-Demand	Anodyne	DRD4	25	47
c1ccc(CN2CCCO[C@@H](CSC3CCC3)C2)cc1	ZINC000450985387	CH	On-Demand	Anodyne	SIGMAR1	25	41
Cc1nc(C2CC2)ccc1C(=O)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450985389	FI	On-Demand	Anodyne	GPBAR1	46	42
O=C(CSC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000450985390	CH	On-Demand	Anodyne	SLC1A1	28	40
O=C(CSC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000450985390	CH	On-Demand	Anodyne	SLC1A3	31	40
O=C(CSC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000450985390	CH	On-Demand	Anodyne	SLC1A2	33	40
O=C(CSC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000450985390	CH	On-Demand	Anodyne	ERBB4	49	35
O=C(CSC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000450985390	CH	On-Demand	Anodyne	ENV	46	37
O=C(CSC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000450985390	CH	On-Demand	Anodyne	MCHR1	31	47
O=C(CSC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000450985390	CH	On-Demand	Anodyne	QRFPR	43	42
O=C(CSC1CCC1)N1CCc2sccc2[C@@H]1c1ccccc1	ZINC000450985396	EJ	On-Demand	Anodyne	TRPM8	24	50
O=C(CSC1CCC1)N1CCc2sccc2[C@H]1c1ccccc1	ZINC000450985397	EJ	On-Demand	Anodyne	TRPM8	24	50
CN(C1(C#N)CCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985401	GD	On-Demand	Mild	LUXN	0	44
COC(=O)C1(CN[C@H](c2c[nH]c3ccccc23)C(F)(F)F)CC1	ZINC000450985414	EG	On-Demand	Anodyne	SSTR2	43	31
COC(=O)C1(CN[C@H](c2c[nH]c3ccccc23)C(F)(F)F)CC1	ZINC000450985414	EG	On-Demand	Anodyne	NMBR	41	31
COC(=O)C1(CN[C@@H](c2c[nH]c3ccccc23)C(F)(F)F)CC1	ZINC000450985415	EG	On-Demand	Anodyne	SSTR2	43	31
COC(=O)C1(CN[C@@H](c2c[nH]c3ccccc23)C(F)(F)F)CC1	ZINC000450985415	EG	On-Demand	Anodyne	NMBR	41	31
Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985424	FJ	On-Demand	Anodyne	CA2	20	51
Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985424	FJ	On-Demand	Anodyne	CA1	25	45
Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985424	FJ	On-Demand	Anodyne	MMP13	22	42
Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985424	FJ	On-Demand	Anodyne	MMP2	15	40
Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985424	FJ	On-Demand	Anodyne	SOAT1	36	40
Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985424	FJ	On-Demand	Anodyne	CA12	16	45
Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985424	FJ	On-Demand	Anodyne	CA9	17	51
Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985424	FJ	On-Demand	Anodyne	ACAT	0	48
O=C(c1ccc(NS(=O)(=O)c2sccc2F)cc1)N1CCOCC1	ZINC000450985428	FE	On-Demand	Anodyne	MTOR	17	40
O=C(c1ccc(NS(=O)(=O)c2sccc2F)cc1)N1CCOCC1	ZINC000450985428	FE	On-Demand	Anodyne	AKR1C3	15	45
CC(=O)NC[C@H](CC(=O)N1CCC(c2nc3cccc(C)c3o2)CC1)CC(C)C	ZINC000450985429	GI	On-Demand	Anodyne	SMO	44	35
COc1cccc(-n2cc(C(=O)NC[C@@H]3Cc4ccccc4N(C)C3)nn2)c1	ZINC000450985432	GE	On-Demand	Anodyne	DRD4	47	38
COc1cccc(-n2cc(C(=O)NC[C@@H]3Cc4ccccc4N(C)C3)nn2)c1	ZINC000450985432	GE	On-Demand	Anodyne	DRD3	23	46
COc1cccc(-n2cc(C(=O)NC[C@H]3Cc4ccccc4N(C)C3)nn2)c1	ZINC000450985433	GE	On-Demand	Anodyne	DRD4	47	38
COc1cccc(-n2cc(C(=O)NC[C@H]3Cc4ccccc4N(C)C3)nn2)c1	ZINC000450985433	GE	On-Demand	Anodyne	DRD3	23	46
CN1C[C@@H](CNC(=O)c2ccc(C(C)(F)F)nc2)Cc2ccccc21	ZINC000450985437	EG	On-Demand	Anodyne	CACNA1I	41	33
CN1C[C@H](CNC(=O)c2ccc(C(C)(F)F)nc2)Cc2ccccc21	ZINC000450985438	EG	On-Demand	Anodyne	CACNA1I	41	33
C[C@H]1CN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CCN1CC(C)(C)O	ZINC000450985444	ED	On-Demand	Anodyne	HRH3	34	42
C[C@@H]1CN(C(=O)[C@@H]2CCN(c3ccccc3)C2)CCN1CC(C)(C)O	ZINC000450985445	ED	On-Demand	Anodyne	HRH3	34	42
C[C@H]1CN(C(=O)[C@H]2CCN(c3ccccc3)C2)CCN1CC(C)(C)O	ZINC000450985446	ED	On-Demand	Anodyne	HRH3	34	42
C[C@@H]1CN(C(=O)[C@H]2CCN(c3ccccc3)C2)CCN1CC(C)(C)O	ZINC000450985447	ED	On-Demand	Anodyne	HRH3	34	42
CC(C)Oc1cccc(CS(=O)(=O)c2cccc(Br)c2)c1	ZINC000450985451	FI	On-Demand	Anodyne	AO-ACHE	0	40
Cc1cccc2nc(C3CCN(C(=O)CCCC(=O)C(C)(C)C)CC3)oc12	ZINC000450985479	FJ	On-Demand	Anodyne	ETHR	71	38
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)CCC1CCCC1	ZINC000450985511	EF	On-Demand	Bother	CYP19A1	16	56
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)CCC1CCCC1	ZINC000450985511	EF	On-Demand	Bother	KCNMA1	20	44
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H]2CCc3ccccc3C2)cc1	ZINC000450985512	FF	On-Demand	Anodyne	PLG	45	32
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H]2CCc3ccccc3C2)cc1	ZINC000450985512	FF	On-Demand	Anodyne	TRYP_PIG	46	32
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H]2CCc3ccccc3C2)cc1	ZINC000450985513	FF	On-Demand	Anodyne	PLG	45	32
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H]2CCc3ccccc3C2)cc1	ZINC000450985513	FF	On-Demand	Anodyne	TRYP_PIG	46	32
CCN(CC)C(=O)CN(C)S(=O)(=O)c1cc(C)cs1	ZINC000450985514	DD	On-Demand	Anodyne	HCRTR2	23	46
Cn1c(CCSC2CCC2)nc2ccccc21	ZINC000450985515	BG	On-Demand	Anodyne	GRM2	15	44
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccccc2C)cc1	ZINC000450985516	FF	On-Demand	Anodyne	TMPRSS11D	41	33
O=C(CCSC1CCC1)Nc1cccc(Br)c1	ZINC000450985520	DI	On-Demand	Anodyne	EGFR	28	42
O=C(CCSC1CCC1)Nc1cccc(Br)c1	ZINC000450985520	DI	On-Demand	Anodyne	NADD	0	43
O=C(CCSC1CCC1)Nc1cccc(Br)c1	ZINC000450985520	DI	On-Demand	Anodyne	PARP10	0	41
CCOc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1F	ZINC000450985524	FF	On-Demand	Anodyne	NR1I2	43	37
CCOc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1F	ZINC000450985524	FF	On-Demand	Anodyne	ALPL	24	42
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1c(C)cccc1C	ZINC000450985525	FG	On-Demand	Bother	CYP19A1	17	47
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1c(C)cccc1C	ZINC000450985525	FG	On-Demand	Bother	CACNA1C	46	33
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1c(C)cccc1C	ZINC000450985525	FG	On-Demand	Bother	TBXA2R	25	41
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1c(C)cccc1C	ZINC000450985525	FG	On-Demand	Bother	CACNA1D	80	33
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1c(C)cccc1C	ZINC000450985525	FG	On-Demand	Bother	KCNMA1	21	46
C[C@H](NC(=O)CSC1CCC1)c1ccc(OC(F)(F)F)cc1	ZINC000450985531	EI	On-Demand	Anodyne	EPHX2	33	40
C[C@@H](NC(=O)CSC1CCC1)c1ccc(OC(F)(F)F)cc1	ZINC000450985532	EI	On-Demand	Anodyne	EPHX2	33	40
O=C(c1ccccc1)N1CC[C@@H](CSC2CCC2)C1	ZINC000450985533	CG	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccccc1)N1CC[C@@H](CSC2CCC2)C1	ZINC000450985533	CG	On-Demand	Anodyne	MBTD1	0	40
O=C(c1ccccc1)N1CC[C@H](CSC2CCC2)C1	ZINC000450985534	CG	On-Demand	Anodyne	L3MBTL1	0	41
O=C(c1ccccc1)N1CC[C@H](CSC2CCC2)C1	ZINC000450985534	CG	On-Demand	Anodyne	MBTD1	0	40
COC(=O)c1ccc(CSC2CCC2)s1	ZINC000450985540	BG	On-Demand	Anodyne	QRFPR	47	40
O=C(COc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1)NC1CC1	ZINC000450985549	GE	On-Demand	Anodyne	TBXA2R	49	35
O=C(COc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1)NC1CC1	ZINC000450985549	GE	On-Demand	Anodyne	MMP13	16	41
O=C(COc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1)NC1CC1	ZINC000450985549	GE	On-Demand	Anodyne	MMP14	18	40
O=C(COc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1)NC1CC1	ZINC000450985549	GE	On-Demand	Anodyne	LUXN	0	47
O=C(COc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1)NC1CC1	ZINC000450985549	GE	On-Demand	Anodyne	ADIPOR1	0	43
O=C(COc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1)NC1CC1	ZINC000450985549	GE	On-Demand	Anodyne	ADIPOR2	0	43
CO[C@H](CS(=O)(=O)N(C)c1cc(C)ccc1C)c1ccccc1	ZINC000450985553	EG	On-Demand	Anodyne	AOC3	17	40
CO[C@@H](CS(=O)(=O)N(C)c1cc(C)ccc1C)c1ccccc1	ZINC000450985554	EG	On-Demand	Anodyne	AOC3	17	40
CCCN(CC#N)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985560	DE	On-Demand	Mild	COLA	45	38
CCCN(CC#N)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450985560	DE	On-Demand	Mild	RORC	15	40
COc1ccc([C@@H]2CCCN2C(=O)CSC2CCC2)c(OC)c1	ZINC000450985561	EH	On-Demand	Anodyne	FKBP1A	60	37
COc1ccc([C@H]2CCCN2C(=O)CSC2CCC2)c(OC)c1	ZINC000450985562	EH	On-Demand	Anodyne	FKBP1A	60	37
O=C(CCSC1CCC1)NCc1ccc(F)cc1	ZINC000450985566	CG	On-Demand	Anodyne	TPSAB1	17	43
COc1cc(-c2nc(CSC3CCC3)cs2)ccc1O	ZINC000450985568	DI	On-Demand	Anodyne	DCK	47	44
COc1cc(-c2nc(CSC3CCC3)cs2)ccc1O	ZINC000450985568	DI	On-Demand	Anodyne	QRFPR	48	40
COc1cc(-c2noc(CSC3CCC3)n2)cc(OC)c1OC	ZINC000450985574	EH	On-Demand	Anodyne	QRFPR	43	37
COc1cc(-c2noc(CSC3CCC3)n2)cc(OC)c1OC	ZINC000450985574	EH	On-Demand	Anodyne	AXIN2	0	40
COCCOc1ccc(CNC(=O)CSC2CCC2)cc1	ZINC000450985582	DF	On-Demand	Anodyne	LTA4H	27	41
COCC1(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450985586	FD	On-Demand	Anodyne	DRD4	19	41
COCC1(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450985586	FD	On-Demand	Anodyne	ADORA2B	26	41
COCC1(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450985586	FD	On-Demand	Anodyne	SIGMAR1	25	56
COCC1(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)CC1	ZINC000450985586	FD	On-Demand	Anodyne	FAAH	15	42
COc1cc(NC(=O)CCSC2CCC2)c(OC)cc1Cl	ZINC000450985588	EH	On-Demand	Anodyne	QRFPR	44	38
Cc1sccc1C(=O)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450985589	DH	On-Demand	Anodyne	GPBAR1	43	41
Cc1sccc1C(=O)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450985589	DH	On-Demand	Anodyne	SCD1	0	41
CN(C(=O)CSC1CCC1)c1nc2ccccc2s1	ZINC000450985590	CH	On-Demand	Anodyne	TXN	17	41
O=C(CSC1CCC1)NCC(=O)c1cccs1	ZINC000450985594	CE	On-Demand	Anodyne	QRFPR	15	42
Cn1cc(-c2ccc(C(=O)N3CCN(C4CC4)c4cc(F)ccc43)o2)cn1	ZINC000450985595	FG	On-Demand	Anodyne	SCD1	25	44
Cn1cc(-c2ccc(C(=O)N3CCN(C4CC4)c4cc(F)ccc43)o2)cn1	ZINC000450985595	FG	On-Demand	Anodyne	SCD	32	44
COC(=O)c1ccc(CSC2CCC2)cc1F	ZINC000450985596	CG	On-Demand	Anodyne	QRFPR	41	35
CCOc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985602	GF	On-Demand	Anodyne	PRTN3	44	32
CCOc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985602	GF	On-Demand	Anodyne	ALPL	17	47
CCOc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985602	GF	On-Demand	Anodyne	GPR119	26	47
CCOc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985602	GF	On-Demand	Anodyne	LIMK2	23	41
CCOc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985602	GF	On-Demand	Anodyne	LUXN	0	47
CCOc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985602	GF	On-Demand	Anodyne	ADIPOR1	0	42
CCOc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985602	GF	On-Demand	Anodyne	ADIPOR2	0	42
CCOC(=O)CN(c1ccccc1F)S(=O)(=O)c1cc(C)cs1	ZINC000450985607	FF	On-Demand	Anodyne	HCRTR2	0	41
O=C(Nc1ccccc1NS(=O)(=O)c1sccc1F)N1CCCC1	ZINC000450985704	FG	On-Demand	Anodyne	KCNQ2	42	33
CC(C)c1cccnc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985705	GF	On-Demand	Anodyne	ADAMTS4	42	34
CC(C)c1cccnc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985705	GF	On-Demand	Anodyne	LUXN	0	46
CC(C)c1cccnc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985705	GF	On-Demand	Anodyne	ADIPOR1	0	42
CC(C)c1cccnc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985705	GF	On-Demand	Anodyne	ADIPOR2	0	42
Cc1cccc(C)c1CS(=O)(=O)Nc1cnc2n[nH]c(C)c2c1	ZINC000450985719	EF	On-Demand	Anodyne	MTNN	51	32
O=S(=O)(NCCc1cccs1)c1ccc(C2CC2)cc1	ZINC000450985741	DG	On-Demand	Anodyne	ADAM17	16	41
Cc1cccc2nc(C3CCN(C(=O)CSC4CC4)CC3)oc12	ZINC000450985746	EH	On-Demand	Anodyne	SMO	42	38
Cc1cccc2nc(C3CCN(C(=O)CSC4CC4)CC3)oc12	ZINC000450985746	EH	On-Demand	Anodyne	ETHR	59	35
COC(=O)c1ccc(CN2CCCC[C@@H]2c2nc(O)n[nH]2)c(F)c1	ZINC000450985748	EE	On-Demand	Anodyne	CPT1A	27	40
COC(=O)c1ccc(CN2CCCC[C@H]2c2nc(O)n[nH]2)c(F)c1	ZINC000450985749	EE	On-Demand	Anodyne	CPT1A	27	40
Cc1csc(S(=O)(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1	ZINC000450985750	GG	On-Demand	Anodyne	MTNN	46	32
O=S(=O)(Cc1c(F)cccc1Cl)NCCn1ccnc1	ZINC000450985758	DD	On-Demand	Anodyne	CYP17A1	22	40
O=S(=O)(Cc1c(F)cccc1Cl)NCCn1ccnc1	ZINC000450985758	DD	On-Demand	Anodyne	HMOX2	45	32
CN(C)C(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450985760	FE	On-Demand	Anodyne	EPHX2	37	47
CCN(CC)C(=O)CN(C)S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000450985763	FG	On-Demand	Anodyne	HCRTR2	0	41
COC(=O)c1ccc(F)c(CSC2CCC2)c1	ZINC000450985764	CG	On-Demand	Anodyne	QRFPR	24	46
CCCOc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1Cl	ZINC000450985765	GH	On-Demand	Anodyne	NR1I2	48	40
CCCOc1ccc(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)cc1Cl	ZINC000450985765	GH	On-Demand	Anodyne	SGK1	19	47
N#Cc1ccc(CN2CCN(S(=O)(=O)CCOCc3ccccc3)CC2)cc1	ZINC000450985769	GE	On-Demand	Mild	SIGMAR1	32	55
O=C(C1CCN(S(=O)(=O)c2sccc2Cl)CC1)N1CCCCC1	ZINC000450985771	GF	On-Demand	Anodyne	EPHX2	31	43
CCc1cccnc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985772	GE	On-Demand	Anodyne	PRTN3	44	32
CCc1cccnc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985772	GE	On-Demand	Anodyne	LUXN	0	47
CCc1cccnc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985772	GE	On-Demand	Anodyne	ADIPOR1	0	40
CCc1cccnc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985772	GE	On-Demand	Anodyne	ADIPOR2	0	40
CS(=O)(=O)c1ccc(-c2nc(CSC3CCC3)cs2)cc1	ZINC000450985773	EH	On-Demand	Anodyne	PTGS2	51	39
CS(=O)(=O)c1ccc(-c2nc(CSC3CCC3)cs2)cc1	ZINC000450985773	EH	On-Demand	Anodyne	AVPR1B	25	42
C[C@H](CNS(=O)(=O)CC1(CC#N)CC1)c1ccccc1	ZINC000450985778	CE	On-Demand	Mild	GRIA4	23	43
C[C@@H](CNS(=O)(=O)CC1(CC#N)CC1)c1ccccc1	ZINC000450985782	CE	On-Demand	Mild	GRIA4	23	43
O=C(CSC1CCC1)NCCc1cccc(Cl)c1Cl	ZINC000450985787	DH	On-Demand	Anodyne	P2RX7	23	46
CC(C)O[C@@]1(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)CCOC1	ZINC000450985788	ED	On-Demand	Anodyne	TPP2	43	30
CC(C)O[C@]1(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)CCOC1	ZINC000450985791	ED	On-Demand	Anodyne	TPP2	43	30
CC(C)O[C@]1(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)CCOC1	ZINC000450985795	ED	On-Demand	Anodyne	TPP2	43	30
CC(C)O[C@@]1(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)CCOC1	ZINC000450985797	ED	On-Demand	Anodyne	TPP2	43	30
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	ESR1	35	40
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	DRD4	15	45
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	KCNH2	17	43
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	ESR2	25	40
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	DRD5	29	45
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	LTA4H	54	52
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	HRH3	51	46
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	EBP	23	53
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	PSMB2	51	41
CC1(S(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450985805	FE	On-Demand	Anodyne	PSMB1	44	39
Cc1cc(N(C)C)cc(C)c1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450985810	EI	On-Demand	Anodyne	FFAR4	38	49
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCCCC3)CC2)cc1	ZINC000450985815	FF	On-Demand	Anodyne	MBTD1	0	46
CCOC(=O)[C@@H](NC(=O)CCCC(C)C)c1ccc(OC)c(F)c1	ZINC000450985817	EG	On-Demand	Anodyne	NOD1	56	35
CCOC(=O)[C@H](NC(=O)CCCC(C)C)c1ccc(OC)c(F)c1	ZINC000450985818	EG	On-Demand	Anodyne	NOD1	56	35
Cc1ccc(C)c(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450985819	GF	On-Demand	Anodyne	LUXN	0	42
O=S(=O)(CC1CC(F)(F)C1)N1CCN(CCOc2ccccc2)CC1	ZINC000450985827	FE	On-Demand	Anodyne	LTA4H	57	44
O=S(=O)(CC1CC(F)(F)C1)N1CCN(CCOc2ccccc2)CC1	ZINC000450985827	FE	On-Demand	Anodyne	HRH3	19	46
O=S(=O)(CC1CC(F)(F)C1)N1CCN(CCOc2ccccc2)CC1	ZINC000450985827	FE	On-Demand	Anodyne	PSMB2	48	35
O=S(=O)(CC1CC(F)(F)C1)N1CCN(CCOc2ccccc2)CC1	ZINC000450985827	FE	On-Demand	Anodyne	PSMB1	42	38
N#C[C@@H](c1ccc(F)cc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450985834	EF	On-Demand	Mild	PTAFR	22	48
N#C[C@H](c1ccc(F)cc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450985835	EF	On-Demand	Mild	PTAFR	22	48
CCOCc1nc(C)c(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)s1	ZINC000450985837	GH	On-Demand	Anodyne	GPBAR1	40	35
CCc1cccnc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450985843	GE	On-Demand	Anodyne	MTNN	80	36
CCc1cccnc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450985843	GE	On-Demand	Anodyne	LIMK2	15	41
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2cccc(C)c2)CC1	ZINC000450985845	GD	On-Demand	Anodyne	ADORA2B	46	37
COC(=O)c1ncccc1S(=O)(=O)N1CCN(Cc2cccc(C)c2)CC1	ZINC000450985845	GD	On-Demand	Anodyne	FAAH	23	44
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1	ZINC000450985846	GE	On-Demand	Anodyne	F3	57	35
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1	ZINC000450985846	GE	On-Demand	Anodyne	ITGAV	52	38
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1	ZINC000450985846	GE	On-Demand	Anodyne	CYP24A1	28	44
Cc1nn(C)cc1CC(=O)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450985847	EE	On-Demand	Anodyne	EIF2AK3	48	38
CCOc1ccc([C@@H](C)NC(=O)CSC2CCC2)cc1OC	ZINC000450985852	DH	On-Demand	Anodyne	QRFPR	46	38
CCOc1ccc([C@H](C)NC(=O)CSC2CCC2)cc1OC	ZINC000450985854	DH	On-Demand	Anodyne	QRFPR	46	38
CCOc1ccc([C@H](C)NC(=O)CSC2CCC2)cc1OC	ZINC000450985854	DH	On-Demand	Anodyne	ENPP1	51	32
CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985859	GC	On-Demand	Anodyne	MMP13	19	44
CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985859	GC	On-Demand	Anodyne	MMP9	15	44
CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985859	GC	On-Demand	Anodyne	HCRTR2	0	42
CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450985859	GC	On-Demand	Anodyne	LUXN	0	43
Cc1csc(S(=O)(=O)N2CCCc3cc(C(N)=O)ccc32)c1	ZINC000450985868	EE	On-Demand	Anodyne	CYP11B2	25	40
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)N3CCOCC3)c2)c1	ZINC000450985888	FE	On-Demand	Anodyne	LPL	32	40
CC[C@@H]1CCC[C@H]1C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450985893	DG	On-Demand	Anodyne	TPP2	45	34
CC[C@@H]1CCC[C@@H]1C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450985894	DG	On-Demand	Anodyne	TPP2	45	34
O=C(c1cccc(CSC2CCC2)c1)N1CCCCC1	ZINC000450985895	CI	On-Demand	Anodyne	PREP	46	45
O=C(c1cccc(CSC2CCC2)c1)N1CCCCC1	ZINC000450985895	CI	On-Demand	Anodyne	PARP1	15	45
O=C(c1cccc(CSC2CCC2)c1)N1CCCCC1	ZINC000450985895	CI	On-Demand	Anodyne	L3MBTL1	0	49
O=C(c1cccc(CSC2CCC2)c1)N1CCCCC1	ZINC000450985895	CI	On-Demand	Anodyne	L3MBTL3	87	49
O=C(c1cccc(CSC2CCC2)c1)N1CCCCC1	ZINC000450985895	CI	On-Demand	Anodyne	MBTD1	0	44
O=C(c1cccc(CSC2CCC2)c1)N1CCCCC1	ZINC000450985895	CI	On-Demand	Anodyne	HPGD	43	36
CC[C@@H]1CCC[C@@H]1C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450985896	DG	On-Demand	Anodyne	TPP2	45	34
CC[C@@H]1CCC[C@H]1C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450985897	DG	On-Demand	Anodyne	TPP2	45	34
CCCCOc1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450985898	FF	On-Demand	Anodyne	PRTN3	54	36
Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450985900	GF	On-Demand	Anodyne	MMP13	23	41
Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450985900	GF	On-Demand	Anodyne	ADAM17	25	41
Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450985900	GF	On-Demand	Anodyne	MMP9	19	41
Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450985900	GF	On-Demand	Anodyne	LUXN	0	42
Cc1ccncc1S(=O)(=O)NC[C@@H](C)c1ccccc1	ZINC000450985910	CE	On-Demand	Anodyne	GRIA4	23	45
Cc1ccncc1S(=O)(=O)NC[C@H](C)c1ccccc1	ZINC000450985911	CE	On-Demand	Anodyne	GRIA4	23	45
COC(=O)c1ccccc1CSC1CCC1	ZINC000450985914	BG	On-Demand	Anodyne	QRFPR	49	44
CC1CCN(Cc2csc(NC(=O)CSC3CCC3)n2)CC1	ZINC000450985915	EH	On-Demand	Anodyne	TRPC6	47	34
CC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450985916	CG	On-Demand	Anodyne	KCNK3	67	32
CC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450985916	CG	On-Demand	Anodyne	PARP10	0	46
Cc1cc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)ncc1C(N)=O	ZINC000450985923	FE	On-Demand	Anodyne	GPBAR1	50	42
Cc1cc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)ncc1C(N)=O	ZINC000450985923	FE	On-Demand	Anodyne	SCD1	27	40
Cc1cc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)ncc1C(N)=O	ZINC000450985923	FE	On-Demand	Anodyne	SCD	22	40
O=C(C1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1)N1CCCCC1	ZINC000450985924	GF	On-Demand	Anodyne	LPL	48	37
O=C(C1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1)N1CCCCC1	ZINC000450985924	GF	On-Demand	Anodyne	EPHX2	21	42
COc1cccc(-n2cc(C(=O)N3CC(C(C)(C)O)C3)nn2)c1	ZINC000450985926	DD	On-Demand	Anodyne	ESRRA	21	41
Cc1cc(-c2noc(CSC3CCC3)n2)ccc1F	ZINC000450985931	CH	On-Demand	Anodyne	TNKS2	15	41
COCCOc1cc(C)ccc1NS(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450985934	GH	On-Demand	Mild	PTGDR	36	41
COCCOc1cc(C)ccc1NS(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450985934	GH	On-Demand	Mild	PTGDR2	24	41
CC(C)(O)C1CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000450985947	DG	On-Demand	Anodyne	AMY2	42	29
Cc1ccccc1CCNS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450985969	FE	On-Demand	Anodyne	NQO2	21	45
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	CA2	25	46
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	ADRB2	32	47
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	ADRB1	23	47
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	ADRB3	28	47
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	CA1	29	46
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	MMP13	32	41
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	CA4	25	46
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	GRM4	15	40
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	MTNR1B	21	46
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	MMP2	23	41
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	MMP12	41	37
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	MMP7	17	40
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	ALPL	16	49
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	ADAMTS4	56	38
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	GPR119	29	46
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	PFK	0	44
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	LIMK2	46	38
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	UQCRB	0	40
CCOc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450985974	FG	On-Demand	Anodyne	PDS	52	36
CC(C)(O)C1CN(C(=O)COc2ccc(C#N)c(Br)c2)C1	ZINC000450985975	FD	On-Demand	Mild	TRPV4	40	32
O=S(=O)(CCC1CCCC1)NCCc1cccs1	ZINC000450985976	CF	On-Demand	Anodyne	ADAM17	0	40
CCOC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450985977	CG	On-Demand	Anodyne	MME	42	35
CCOC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450985977	CG	On-Demand	Anodyne	TIMP3	62	36
CCOC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450985977	CG	On-Demand	Anodyne	AMY2	45	32
CCOC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450985977	CG	On-Demand	Anodyne	ACE2	47	33
CCOC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450985978	CG	On-Demand	Anodyne	MME	42	35
CCOC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450985978	CG	On-Demand	Anodyne	TIMP3	62	36
CCOC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450985978	CG	On-Demand	Anodyne	AMY2	45	32
CCOC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450985978	CG	On-Demand	Anodyne	ACE2	47	33
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CSC1CCC1	ZINC000450985981	EG	On-Demand	Anodyne	P2RX7	42	57
O=C(CCN1CCCC[C@H]1c1nc(O)n[nH]1)NCC(=O)c1ccccc1	ZINC000450985989	FD	On-Demand	Anodyne	COLA	54	39
O=C(CCN1CCCC[C@H]1c1nc(O)n[nH]1)NCC(=O)c1ccccc1	ZINC000450985989	FD	On-Demand	Anodyne	CPT1A	53	39
O=C(CCN1CCCC[C@@H]1c1nc(O)n[nH]1)NCC(=O)c1ccccc1	ZINC000450985990	FD	On-Demand	Anodyne	COLA	54	39
O=C(CCN1CCCC[C@@H]1c1nc(O)n[nH]1)NCC(=O)c1ccccc1	ZINC000450985990	FD	On-Demand	Anodyne	CPT1A	53	39
CC(C)CNC(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450986113	FG	On-Demand	Anodyne	F3	74	36
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)c1	ZINC000450986126	GI	On-Demand	Anodyne	CNR2	15	51
Cc1[nH]nc2ncc(NS(=O)(=O)c3cn(C)nc3C(F)(F)F)cc12	ZINC000450986127	FD	On-Demand	Anodyne	SGK1	52	54
COC(=O)c1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986134	GG	On-Demand	Anodyne	CA2	15	40
COC(=O)c1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986134	GG	On-Demand	Anodyne	CA1	21	40
COC(=O)c1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986134	GG	On-Demand	Anodyne	KCNA5	0	42
COC(=O)c1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986134	GG	On-Demand	Anodyne	CA14	15	40
COC(=O)c1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986134	GG	On-Demand	Anodyne	PRTN3	46	33
COC(=O)c1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986134	GG	On-Demand	Anodyne	LEF	40	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)cc1	ZINC000450986135	GD	On-Demand	Anodyne	LPL	45	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)cc1	ZINC000450986135	GD	On-Demand	Anodyne	EPHX2	22	53
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)cc1	ZINC000450986135	GD	On-Demand	Anodyne	TGM2	93	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)cc1	ZINC000450986135	GD	On-Demand	Anodyne	F13A1	122	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)cc1	ZINC000450986135	GD	On-Demand	Anodyne	NAMPT	29	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)cc1	ZINC000450986135	GD	On-Demand	Anodyne	TGM6	0	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)C)CC2)cc1	ZINC000450986135	GD	On-Demand	Anodyne	DDIT3	0	40
COc1ccnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450986150	GD	On-Demand	Anodyne	MTNN	66	38
COc1ccnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450986150	GD	On-Demand	Anodyne	FFAR4	30	44
COc1ccnc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1	ZINC000450986150	GD	On-Demand	Anodyne	BRD4	0	42
CN1C[C@@H](CNC(=O)C(C)(C)C(C)(F)F)Cc2ccccc21	ZINC000450986162	DG	On-Demand	Anodyne	TPP2	44	32
CN1C[C@H](CNC(=O)C(C)(C)C(C)(F)F)Cc2ccccc21	ZINC000450986163	DG	On-Demand	Anodyne	TPP2	44	32
Cc1cccc2nc(C3CCN(C(=O)[C@@H](C)OCCc4ccccc4)CC3)oc12	ZINC000450986164	GI	On-Demand	Anodyne	SMO	43	36
Cc1cccc2nc(C3CCN(C(=O)[C@H](C)OCCc4ccccc4)CC3)oc12	ZINC000450986165	GI	On-Demand	Anodyne	SMO	43	36
Cc1cccc2nc(C3CCN(C(=O)CC[C@@H]4CCC(=O)N4)CC3)oc12	ZINC000450986178	FF	On-Demand	Anodyne	ETHR	67	36
Cc1cccc2nc(C3CCN(C(=O)CC[C@H]4CCC(=O)N4)CC3)oc12	ZINC000450986179	FF	On-Demand	Anodyne	ETHR	67	36
COc1ccc([C@H]2CCCN2S(=O)(=O)C[C@@H]2CCCCC2(F)F)cc1	ZINC000450986195	FH	On-Demand	Anodyne	MMP8	15	41
COc1ccc([C@H]2CCCN2S(=O)(=O)C[C@H]2CCCCC2(F)F)cc1	ZINC000450986197	FH	On-Demand	Anodyne	MMP8	15	41
COc1ccc([C@@H]2CCCN2S(=O)(=O)C[C@@H]2CCCCC2(F)F)cc1	ZINC000450986199	FH	On-Demand	Anodyne	MMP8	15	41
COc1ccc([C@@H]2CCCN2S(=O)(=O)C[C@H]2CCCCC2(F)F)cc1	ZINC000450986200	FH	On-Demand	Anodyne	MMP8	15	41
c1cc2c(cc1CSC1CCC1)OCCO2	ZINC000450986204	BG	On-Demand	Anodyne	TERT	0	40
CCOC(=O)c1nc(-c2ccccc2)oc1CSC1CCC1	ZINC000450986211	DI	On-Demand	Anodyne	PPARG	53	39
CCOC(=O)c1nc(-c2ccccc2)oc1CSC1CCC1	ZINC000450986211	DI	On-Demand	Anodyne	PPARA	52	38
CCOC(=O)c1nc(-c2ccccc2)oc1CSC1CCC1	ZINC000450986211	DI	On-Demand	Anodyne	PDE8B	53	34
CCOC(=O)c1nc(-c2ccccc2)oc1CSC1CCC1	ZINC000450986211	DI	On-Demand	Anodyne	VCP	41	34
CO[C@@H](CS(=O)(=O)Nc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000450986221	GG	On-Demand	Anodyne	HTR1D	24	44
CO[C@@H](CS(=O)(=O)Nc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000450986221	GG	On-Demand	Anodyne	HTR1B	23	44
CO[C@@H](CS(=O)(=O)Nc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000450986221	GG	On-Demand	Anodyne	SIGMAR1	32	42
CO[C@@H](CS(=O)(=O)Nc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000450986221	GG	On-Demand	Anodyne	LEF	16	40
CO[C@H](CS(=O)(=O)Nc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000450986222	GG	On-Demand	Anodyne	HTR1D	24	44
CO[C@H](CS(=O)(=O)Nc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000450986222	GG	On-Demand	Anodyne	HTR1B	23	44
CO[C@H](CS(=O)(=O)Nc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000450986222	GG	On-Demand	Anodyne	SIGMAR1	32	42
CO[C@H](CS(=O)(=O)Nc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000450986222	GG	On-Demand	Anodyne	LEF	16	40
CC(C)(CC#N)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450986243	FD	On-Demand	Mild	LTA4H	60	45
CC(C)(CC#N)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450986243	FD	On-Demand	Mild	HRH3	30	44
CC(C)(CC#N)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450986243	FD	On-Demand	Mild	PSMB2	50	38
CC(C)(CC#N)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450986243	FD	On-Demand	Mild	PSMB1	45	41
CC(C)(CC#N)CS(=O)(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000450986243	FD	On-Demand	Mild	MEN1	43	35
O=C(CSC1CCC1)Nc1nc(-c2ccco2)cs1	ZINC000450986248	CH	On-Demand	Anodyne	ADORA3	15	42
COCCOc1cc(C)ccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450986253	FG	On-Demand	Anodyne	CCR4	22	43
CCc1ccccc1NC(=O)CN1CCN(C(=O)CSC2CCC2)CC1	ZINC000450986254	GF	On-Demand	Anodyne	DRD4	0	40
O=C(c1ccc(NS(=O)(=O)c2sccc2Cl)cc1)N1CCCCCC1	ZINC000450986255	GI	On-Demand	Anodyne	L3MBTL3	57	38
CNC(=O)c1cccc(CSC2CCC2)c1	ZINC000450986267	BF	On-Demand	Anodyne	QRFPR	40	37
COc1cc(C)c([C@@H](C)NC(=O)CSC2CCC2)cc1OC	ZINC000450986269	DG	On-Demand	Anodyne	QRFPR	43	36
COc1cc(C)c([C@H](C)NC(=O)CSC2CCC2)cc1OC	ZINC000450986270	DG	On-Demand	Anodyne	QRFPR	43	36
O=C(CSC1CCC1)NCc1ccc(F)cc1C(F)(F)F	ZINC000450986271	DH	On-Demand	Anodyne	P2RX7	73	56
Oc1n[nH]c([C@@H]2CCCCN2CCCCc2ccccc2)n1	ZINC000450986285	DG	On-Demand	Anodyne	FKBP1A	31	40
Oc1n[nH]c([C@@H]2CCCCN2CCCCc2ccccc2)n1	ZINC000450986285	DG	On-Demand	Anodyne	CPT1A	50	39
Oc1n[nH]c([C@@H]2CCCCN2CCCCc2ccccc2)n1	ZINC000450986285	DG	On-Demand	Anodyne	PREP	45	39
Oc1n[nH]c([C@H]2CCCCN2CCCCc2ccccc2)n1	ZINC000450986286	DG	On-Demand	Anodyne	FKBP1A	31	40
Oc1n[nH]c([C@H]2CCCCN2CCCCc2ccccc2)n1	ZINC000450986286	DG	On-Demand	Anodyne	CPT1A	50	39
Oc1n[nH]c([C@H]2CCCCN2CCCCc2ccccc2)n1	ZINC000450986286	DG	On-Demand	Anodyne	PREP	45	39
CCc1cc(CC)c(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)c(CC)c1	ZINC000450986287	GF	On-Demand	Anodyne	EPHX2	34	40
O=C(CSC1CCC1)NCc1ccc(CN2CCCC2)cc1	ZINC000450986290	DG	On-Demand	Anodyne	HRH3	24	44
O=C(CSC1CCC1)NCc1ccc(CN2CCCC2)cc1	ZINC000450986290	DG	On-Demand	Anodyne	SIGMAR1	28	42
O=C(CSC1CCC1)NCc1ccc(CN2CCCC2)cc1	ZINC000450986290	DG	On-Demand	Anodyne	NPFFR1	41	34
NC(=O)[C@H](SC1CCC1)c1ccc(Br)cc1	ZINC000450986312	DG	On-Demand	Anodyne	SDH1	0	42
NC(=O)[C@@H](SC1CCC1)c1ccc(Br)cc1	ZINC000450986313	DG	On-Demand	Anodyne	SDH1	0	42
O=C(CSC1CCC1)NCC1(N2CCOCC2)CCCCC1	ZINC000450986328	EE	On-Demand	Anodyne	HCN4	52	35
COc1cc(C)nc(CSC2CCC2)c1	ZINC000450986340	BG	On-Demand	Anodyne	QRFPR	40	32
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NS(=O)(=O)c1cnc(O)s1	ZINC000450986342	GF	On-Demand	Anodyne	L3MBTL3	41	32
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NS(=O)(=O)c1cnc(O)s1	ZINC000450986342	GF	On-Demand	Anodyne	TRPC6	40	35
Cn1c(CSC2CCC2)nc2ccccc21	ZINC000450986343	BG	On-Demand	Anodyne	HRH1	0	43
Cn1c(CSC2CCC2)nc2ccccc21	ZINC000450986343	BG	On-Demand	Anodyne	GRM2	15	45
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450986346	GF	On-Demand	Anodyne	DRD4	30	43
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450986346	GF	On-Demand	Anodyne	ADORA2B	51	42
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450986346	GF	On-Demand	Anodyne	SSTR5	64	42
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450986346	GF	On-Demand	Anodyne	LSS	18	55
COc1ncc(CSC2CCC2)c(C)n1	ZINC000450986347	BF	On-Demand	Anodyne	QRFPR	41	34
COc1ncccc1CSC1CCC1	ZINC000450986352	BF	On-Demand	Anodyne	QRFPR	48	40
C[C@@H](SC1CCC1)C(=O)N1CCN(c2ccccn2)CC1	ZINC000450986363	DE	On-Demand	Anodyne	SLC6A7	0	46
C[C@H](SC1CCC1)C(=O)N1CCN(c2ccccn2)CC1	ZINC000450986364	DE	On-Demand	Anodyne	SLC6A7	0	46
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450986367	EG	On-Demand	Bother	CYP19A1	15	54
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450986367	EG	On-Demand	Bother	KCNMA1	21	45
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)cn1	ZINC000450986375	GH	On-Demand	Anodyne	AVPR2	22	43
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)cn1	ZINC000450986375	GH	On-Demand	Anodyne	AVPR1A	15	43
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)cn1	ZINC000450986375	GH	On-Demand	Anodyne	GPBAR1	40	43
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	CHRM2	28	44
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	ACE	60	36
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	DRD4	42	54
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	ACHE	35	44
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	CHRM3	37	44
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	LTA4H	22	43
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	SIGMAR1	63	52
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	CCR3	43	48
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	MCHR1	37	53
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	XIAP	34	40
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	BIRC2	99	45
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	NPFFR1	40	33
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	ADIPOR1	0	41
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986377	DG	On-Demand	Anodyne	ADIPOR2	0	41
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	CHRM2	28	44
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	ACE	60	36
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	DRD4	42	54
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	ACHE	35	44
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	CHRM3	37	44
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	LTA4H	22	43
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	SIGMAR1	63	52
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	CCR3	43	48
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	MCHR1	37	53
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	XIAP	34	40
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	BIRC2	99	45
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	NPFFR1	40	33
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	ADIPOR1	0	41
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986379	DG	On-Demand	Anodyne	ADIPOR2	0	41
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	CHRM2	28	44
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	ACE	60	36
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	DRD4	42	54
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	ACHE	35	44
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	CHRM3	37	44
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	LTA4H	22	43
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	SIGMAR1	63	52
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	CCR3	43	48
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	MCHR1	37	53
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	XIAP	34	40
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	BIRC2	99	45
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	NPFFR1	40	33
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	ADIPOR1	0	41
C[C@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986380	DG	On-Demand	Anodyne	ADIPOR2	0	41
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	CHRM2	28	44
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	ACE	60	36
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	DRD4	42	54
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	ACHE	35	44
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	CHRM3	37	44
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	LTA4H	22	43
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	SIGMAR1	63	52
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	CCR3	43	48
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	MCHR1	37	53
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	XIAP	34	40
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	BIRC2	99	45
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	NPFFR1	40	33
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	ADIPOR1	0	41
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986381	DG	On-Demand	Anodyne	ADIPOR2	0	41
NC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986388	BE	On-Demand	Anodyne	CACNA2D1	0	41
NC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986388	BE	On-Demand	Anodyne	MME	40	35
NC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986388	BE	On-Demand	Anodyne	NPFFR2	44	31
NC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986389	BE	On-Demand	Anodyne	CACNA2D1	0	41
NC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986389	BE	On-Demand	Anodyne	MME	40	35
NC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986389	BE	On-Demand	Anodyne	NPFFR2	44	31
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450986390	GG	On-Demand	Anodyne	TMPRSS11D	46	33
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450986395	GG	On-Demand	Anodyne	TMPRSS11D	46	33
O=S(=O)(CC1CC(F)(F)C1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000450986396	GF	On-Demand	Anodyne	DRD4	17	42
O=S(=O)(CC1CC(F)(F)C1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000450986396	GF	On-Demand	Anodyne	ADORA2B	26	41
O=S(=O)(CC1CC(F)(F)C1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000450986396	GF	On-Demand	Anodyne	SIGMAR1	25	52
COC(=O)[C@H](SC1CCC1)c1cccc(Cl)c1	ZINC000450986404	CH	On-Demand	Anodyne	SLC6A3	17	53
COC(=O)[C@@H](SC1CCC1)c1cccc(Cl)c1	ZINC000450986405	CH	On-Demand	Anodyne	SLC6A3	17	53
CC1CCN(C(=O)c2ccccc2NS(=O)(=O)c2sccc2Cl)CC1	ZINC000450986410	GI	On-Demand	Anodyne	CCR8	47	32
CC1CCN(C(=O)c2ccccc2NS(=O)(=O)c2sccc2Cl)CC1	ZINC000450986410	GI	On-Demand	Anodyne	TRPC6	45	40
CC1CCN(C(=O)c2ccccc2NS(=O)(=O)c2sccc2Cl)CC1	ZINC000450986410	GI	On-Demand	Anodyne	TRPC3	24	40
Cc1ccccc1CN1CCN(C(=O)CSC2CCC2)CC1	ZINC000450986412	DF	On-Demand	Anodyne	SLC6A1	49	35
CC[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986415	EC	On-Demand	Mild	ADAMTS4	47	36
CC[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986415	EC	On-Demand	Mild	LUXN	0	43
CC(C)N(C(=O)CSC1CCC1)C1CCCC1	ZINC000450986417	CG	On-Demand	Anodyne	ACE	0	40
CC[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986419	EC	On-Demand	Mild	ADAMTS4	47	36
CC[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986419	EC	On-Demand	Mild	LUXN	0	43
CC(C)(C)NC(=O)c1cccc(NS(=O)(=O)c2sccc2F)c1	ZINC000450986422	FG	On-Demand	Anodyne	KCNK3	48	34
CCN(CC#N)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986425	DD	On-Demand	Mild	COLA	50	39
Cc1cccc2nc(C3CCN(C(=O)c4ccnn4CC(F)(F)F)CC3)oc12	ZINC000450986428	GH	On-Demand	Anodyne	ETHR	64	35
O=C(CS(=O)(=O)C1CC1)NCCCCc1ccc(F)c(F)c1	ZINC000450986437	ED	On-Demand	Anodyne	CRTM	24	41
COc1cc(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)ccc1O	ZINC000450986454	EE	On-Demand	Anodyne	DRD2	35	42
COc1cc(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)ccc1O	ZINC000450986454	EE	On-Demand	Anodyne	NCE103	25	40
COc1cc(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)ccc1O	ZINC000450986454	EE	On-Demand	Anodyne	CAN2	0	40
COc1cc(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)ccc1O	ZINC000450986455	EE	On-Demand	Anodyne	DRD2	35	42
COc1cc(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)ccc1O	ZINC000450986455	EE	On-Demand	Anodyne	NCE103	25	40
COc1cc(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)ccc1O	ZINC000450986455	EE	On-Demand	Anodyne	CAN2	0	40
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986474	FG	On-Demand	Anodyne	CHRM2	15	40
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986474	FG	On-Demand	Anodyne	DRD4	27	45
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986474	FG	On-Demand	Anodyne	DRD3	0	41
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986474	FG	On-Demand	Anodyne	SIGMAR1	45	43
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986474	FG	On-Demand	Anodyne	CCR3	22	41
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986474	FG	On-Demand	Anodyne	CACNA1G	20	45
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986475	FG	On-Demand	Anodyne	CHRM2	15	40
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986475	FG	On-Demand	Anodyne	DRD4	27	45
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986475	FG	On-Demand	Anodyne	DRD3	0	41
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986475	FG	On-Demand	Anodyne	SIGMAR1	45	43
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986475	FG	On-Demand	Anodyne	CCR3	22	41
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450986475	FG	On-Demand	Anodyne	CACNA1G	20	45
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986476	FG	On-Demand	Anodyne	CHRM2	15	40
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986476	FG	On-Demand	Anodyne	DRD4	27	45
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986476	FG	On-Demand	Anodyne	DRD3	0	41
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986476	FG	On-Demand	Anodyne	SIGMAR1	45	43
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986476	FG	On-Demand	Anodyne	CCR3	22	41
O=S(=O)(C[C@@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986476	FG	On-Demand	Anodyne	CACNA1G	20	45
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986477	FG	On-Demand	Anodyne	CHRM2	15	40
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986477	FG	On-Demand	Anodyne	DRD4	27	45
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986477	FG	On-Demand	Anodyne	DRD3	0	41
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986477	FG	On-Demand	Anodyne	SIGMAR1	45	43
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986477	FG	On-Demand	Anodyne	CCR3	22	41
O=S(=O)(C[C@H]1CCCCC1(F)F)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450986477	FG	On-Demand	Anodyne	CACNA1G	20	45
CCOc1ccc(-c2nc(CN3CCCC[C@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450986478	GH	On-Demand	Anodyne	COLA	64	42
CCOc1ccc(-c2nc(CN3CCCC[C@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450986478	GH	On-Demand	Anodyne	CPT1A	63	42
CCOc1ccc(-c2nc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450986479	GH	On-Demand	Anodyne	COLA	64	42
CCOc1ccc(-c2nc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)cs2)cc1	ZINC000450986479	GH	On-Demand	Anodyne	CPT1A	63	42
CS(=O)(=O)c1ccc(OCCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450986502	FD	On-Demand	Anodyne	COLA	53	42
CS(=O)(=O)c1ccc(OCCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450986502	FD	On-Demand	Anodyne	CPT1A	52	42
CS(=O)(=O)c1ccc(OCCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450986503	FD	On-Demand	Anodyne	COLA	53	42
CS(=O)(=O)c1ccc(OCCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450986503	FD	On-Demand	Anodyne	CPT1A	52	42
C[C@@H](NS(=O)(=O)CCC1CCCC1)c1ccc(F)c(F)c1	ZINC000450986509	DH	On-Demand	Anodyne	DUT	33	44
C[C@H](NS(=O)(=O)CCC1CCCC1)c1ccc(F)c(F)c1	ZINC000450986510	DH	On-Demand	Anodyne	DUT	33	44
Cc1cccc2nc(C3CCN(C(=O)C4CC(C)(O)C4)CC3)oc12	ZINC000450986511	EG	On-Demand	Anodyne	SMO	46	38
COc1cc(CSC2CCC2)ccc1[N+](=O)[O-]	ZINC000450986514	CG	On-Demand	Bother	QRFPR	44	36
CCOC[C@H](C)CS(=O)(=O)NC[C@H](C)c1ccccc1	ZINC000450986519	CE	On-Demand	Anodyne	GRIA4	25	48
CCOC[C@@H](C)CS(=O)(=O)NC[C@H](C)c1ccccc1	ZINC000450986520	CE	On-Demand	Anodyne	GRIA4	25	48
CCOC[C@H](C)CS(=O)(=O)NC[C@@H](C)c1ccccc1	ZINC000450986521	CE	On-Demand	Anodyne	GRIA4	25	48
CCOC[C@@H](C)CS(=O)(=O)NC[C@@H](C)c1ccccc1	ZINC000450986522	CE	On-Demand	Anodyne	GRIA4	25	48
CCN(CC)C(=O)CN(C)S(=O)(=O)c1sccc1Cl	ZINC000450986523	DD	On-Demand	Anodyne	HCRTR2	0	43
COc1ccc(C#N)cc1CSC1CCC1	ZINC000450986525	BG	On-Demand	Mild	QRFPR	60	50
COc1ccc([C@@H]2CCCN2S(=O)(=O)c2sccc2Cl)cc1	ZINC000450986526	FH	On-Demand	Anodyne	MMP1	15	41
COc1ccc([C@H]2CCCN2S(=O)(=O)c2sccc2Cl)cc1	ZINC000450986527	FH	On-Demand	Anodyne	MMP1	15	41
NC(=O)COc1ccc(CNC(=O)CSC2CCC2)cc1	ZINC000450986532	DD	On-Demand	Anodyne	TPSG1	0	40
CCOC(=O)[C@H](SC1CCC1)c1ccccc1	ZINC000450986536	CH	On-Demand	Anodyne	AMY2	48	34
CCOC(=O)[C@@H](SC1CCC1)c1ccccc1	ZINC000450986537	CH	On-Demand	Anodyne	AMY2	48	34
Cc1ccccc1N1CCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000450986540	FF	On-Demand	Anodyne	AVPR2	0	45
Cc1ccccc1N1CCN(S(=O)(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000450986541	FF	On-Demand	Anodyne	AVPR2	0	45
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)Nc1cc(-n2cnnn2)ccc1F	ZINC000450986544	GC	On-Demand	Anodyne	COLA	0	41
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)Nc1cc(-n2cnnn2)ccc1F	ZINC000450986544	GC	On-Demand	Anodyne	CPT1A	19	41
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)Nc1cc(-n2cnnn2)ccc1F	ZINC000450986545	GC	On-Demand	Anodyne	COLA	0	41
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)Nc1cc(-n2cnnn2)ccc1F	ZINC000450986545	GC	On-Demand	Anodyne	CPT1A	19	41
COc1ccccc1NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450986546	ED	On-Demand	Anodyne	COLA	50	39
COc1ccccc1NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450986546	ED	On-Demand	Anodyne	CPT1A	53	37
COc1ccccc1NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450986547	ED	On-Demand	Anodyne	COLA	50	39
COc1ccccc1NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450986547	ED	On-Demand	Anodyne	CPT1A	53	37
O=C(CSC1CCC1)NCCOc1cccc(Cl)c1	ZINC000450986549	CG	On-Demand	Anodyne	HRH2	25	43
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)Nc1ccc2c(c1)OCO2	ZINC000450986557	ED	On-Demand	Anodyne	COLA	29	40
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)Nc1ccc2c(c1)OCO2	ZINC000450986557	ED	On-Demand	Anodyne	NOS2	61	36
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)Nc1ccc2c(c1)OCO2	ZINC000450986558	ED	On-Demand	Anodyne	COLA	29	40
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)Nc1ccc2c(c1)OCO2	ZINC000450986558	ED	On-Demand	Anodyne	NOS2	61	36
COC(=O)c1cc(CSC2CCC2)cc(C(=O)OC)c1	ZINC000450986564	CG	On-Demand	Anodyne	QRFPR	44	38
O=C(CSC1CCC1)Nc1cccc(CN2CCSCC2)c1	ZINC000450986565	EG	On-Demand	Anodyne	HRH2	46	40
O=C(CSC1CCC1)Nc1cccc(CN2CCSCC2)c1	ZINC000450986565	EG	On-Demand	Anodyne	CCR3	40	44
CCOC(=O)c1ccccc1NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450986571	FD	On-Demand	Anodyne	COLA	42	38
CCOC(=O)c1ccccc1NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450986571	FD	On-Demand	Anodyne	CPT1A	42	36
CCOC(=O)c1ccccc1NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450986571	FD	On-Demand	Anodyne	PARP2	42	38
CCOC(=O)c1ccccc1NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450986571	FD	On-Demand	Anodyne	PARP1	27	45
CCOC(=O)c1ccccc1NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450986572	FD	On-Demand	Anodyne	COLA	42	38
CCOC(=O)c1ccccc1NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450986572	FD	On-Demand	Anodyne	CPT1A	42	36
CCOC(=O)c1ccccc1NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450986572	FD	On-Demand	Anodyne	PARP2	42	38
CCOC(=O)c1ccccc1NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450986572	FD	On-Demand	Anodyne	PARP1	27	45
COc1cccc(CSC2CCC2)n1	ZINC000450986575	BF	On-Demand	Anodyne	QRFPR	43	38
Cc1csc(S(=O)(=O)N2CCC(C(=O)N3CCCCC3)CC2)c1	ZINC000450986589	FE	On-Demand	Anodyne	LPL	47	37
Cc1csc(S(=O)(=O)N2CCC(C(=O)N3CCCCC3)CC2)c1	ZINC000450986589	FE	On-Demand	Anodyne	EPHX2	39	43
Cc1[nH]c2ccccc2c1C(=O)CSC1CCC1	ZINC000450986591	CH	On-Demand	Anodyne	EDNRB	40	36
COc1cccc(-c2nc(CSC3CCC3)cs2)c1OC	ZINC000450986592	DJ	On-Demand	Anodyne	QRFPR	43	36
O=C(CSC1CCC1)N1CCN(Cc2ccc3c(c2)CCO3)CC1	ZINC000450986593	EF	On-Demand	Anodyne	MCHR1	18	49
COc1ccc(N(Cc2cccs2)S(=O)(=O)C2(C)CC2)cc1	ZINC000450986598	EH	On-Demand	Anodyne	BMP1	30	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)N(C)C)cc1	ZINC000450986602	EC	On-Demand	Anodyne	COLA	46	39
N#Cc1cc(F)ccc1CS(=O)(=O)N1CCC(C(=O)N2CCCCC2)CC1	ZINC000450986604	GE	On-Demand	Mild	ADAMTS4	53	33
N#Cc1cc(F)ccc1CS(=O)(=O)N1CCC(C(=O)N2CCCCC2)CC1	ZINC000450986604	GE	On-Demand	Mild	ADAMTS5	0	43
COc1ccccc1-n1cnc2cc(C(=O)N3CC(C(C)(C)O)C3)ccc21	ZINC000450986605	FF	On-Demand	Anodyne	PDGFRB	0	44
Cc1csc(S(=O)(=O)N2CCC(C(=O)N3CCOCC3)CC2)c1	ZINC000450986609	FD	On-Demand	Anodyne	LPL	45	39
Cc1csc(S(=O)(=O)N2CCC(C(=O)N3CCOCC3)CC2)c1	ZINC000450986609	FD	On-Demand	Anodyne	EPHX2	29	44
Cc1csc(S(=O)(=O)NCCc2cccs2)c1	ZINC000450986610	CF	On-Demand	Anodyne	ADAM17	0	40
Cc1sccc1C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450986643	EJ	On-Demand	Anodyne	ETHR	54	36
Cc1cccc2nc(C3CCN(C(=O)[C@@]4(C#N)C[C@H]4C)CC3)oc12	ZINC000450986654	DG	On-Demand	Mild	SMO	46	37
Cc1cccc2nc(C3CCN(C(=O)[C@]4(C#N)C[C@@H]4C)CC3)oc12	ZINC000450986655	DG	On-Demand	Mild	SMO	46	37
Cc1cccc2nc(C3CCN(C(=O)[C@@]4(C#N)C[C@@H]4C)CC3)oc12	ZINC000450986656	DG	On-Demand	Mild	SMO	46	37
Cc1cccc2nc(C3CCN(C(=O)[C@]4(C#N)C[C@H]4C)CC3)oc12	ZINC000450986657	DG	On-Demand	Mild	SMO	46	37
COCCOc1cccc(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)c1	ZINC000450986671	GG	On-Demand	Anodyne	ADCYAP1R1	43	36
COCCOc1cccc(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)c1	ZINC000450986671	GG	On-Demand	Anodyne	UQCRB	0	40
COCCOc1cccc(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)c1	ZINC000450986671	GG	On-Demand	Anodyne	PDS	42	43
O=C(NCCCCc1ccc(F)c(F)c1)c1ccc(N2CCC2)nc1	ZINC000450986675	EG	On-Demand	Anodyne	HPGDS	20	44
CC[S@@](=O)CC(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450986680	CD	On-Demand	Anodyne	TPP2	53	34
CC[S@@](=O)CC(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450986681	CD	On-Demand	Anodyne	TPP2	53	34
CC[S@](=O)CC(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450986682	CD	On-Demand	Anodyne	TPP2	53	34
CC[S@](=O)CC(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450986685	CD	On-Demand	Anodyne	TPP2	53	34
CN(C)C(=O)C1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450986694	FE	On-Demand	Anodyne	LPL	44	33
COc1cc(CC(=O)N2CC(C(C)(C)O)C2)ccc1Cl	ZINC000450986695	CE	On-Demand	Anodyne	OPRK1	39	40
COc1cc(CC(=O)N2CC(C(C)(C)O)C2)ccc1Cl	ZINC000450986695	CE	On-Demand	Anodyne	CCR1	33	42
Cc1cccc(CN2CCN(S(=O)(=O)C[C@@H]3CCCC3(F)F)CC2)c1	ZINC000450986697	FF	On-Demand	Anodyne	SIGMAR1	16	43
Cc1cccc(CN2CCN(S(=O)(=O)C[C@H]3CCCC3(F)F)CC2)c1	ZINC000450986699	FF	On-Demand	Anodyne	SIGMAR1	16	43
CC(=O)N[C@H](C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1)C(C)(C)C	ZINC000450986710	FG	On-Demand	Anodyne	SMO	41	38
O=C(CSC1CCC1)NCCOc1cccc(F)c1	ZINC000450986711	CF	On-Demand	Anodyne	CHRNA10	34	41
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2cccc(C)c2)CC1	ZINC000450986714	GE	On-Demand	Anodyne	ADORA2B	44	36
CCOc1ccncc1S(=O)(=O)N1CCN(Cc2cccc(C)c2)CC1	ZINC000450986714	GE	On-Demand	Anodyne	SSTR5	67	38
CCCC(C#N)(CCC)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986716	FG	On-Demand	Mild	IDO1	25	41
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450986720	FF	On-Demand	Anodyne	TMPRSS11D	40	32
COc1ccc([C@H]2CCCCCN2C(=O)CSC2CCC2)cc1	ZINC000450986734	EI	On-Demand	Anodyne	CPT1A	107	43
COc1ccc([C@@H]2CCCCCN2C(=O)CSC2CCC2)cc1	ZINC000450986735	EI	On-Demand	Anodyne	CPT1A	107	43
CC(C)(C)OC(=O)[C@@H]1CN(C[C@H](O)Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000450986744	FG	On-Demand	Anodyne	POL	0	41
CC(C)Oc1ncccc1NS(=O)(=O)c1sccc1F	ZINC000450986748	DF	On-Demand	Anodyne	NFKBIA	0	41
CCc1cccnc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986752	EG	On-Demand	Anodyne	ADRB2	26	43
CCc1cccnc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986752	EG	On-Demand	Anodyne	PPIA	41	46
CCc1cccnc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986752	EG	On-Demand	Anodyne	CA1	27	43
CCc1cccnc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986752	EG	On-Demand	Anodyne	GRM4	23	45
CCc1cccnc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986752	EG	On-Demand	Anodyne	LIMK2	35	40
COc1ccncc1CSC1CCC1	ZINC000450986755	BF	On-Demand	Anodyne	QRFPR	57	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	CA2	29	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	ADRB2	18	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	ADRB1	32	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	PPIA	21	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	ADRB3	33	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	TBXA2R	62	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	TBXAS1	47	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	CA1	33	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	MMP13	27	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	CA4	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	CA5A	42	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	CA14	21	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	MMP3	16	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	CA12	25	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	ADAMTS4	30	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	CA9	28	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	AKR1C3	15	58
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	IDO1	34	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	PFK	0	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	LIMK2	15	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	RORC	53	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1	ZINC000450986758	GG	On-Demand	Anodyne	LMGT2	0	45
COC(=O)c1ccc(CSC2CCC2)nc1	ZINC000450986760	BF	On-Demand	Anodyne	QRFPR	41	35
CO[C@H](CS(=O)(=O)N(C)c1ccc(C)cc1C)c1ccccc1	ZINC000450986776	EG	On-Demand	Anodyne	AOC3	17	40
CO[C@@H](CS(=O)(=O)N(C)c1ccc(C)cc1C)c1ccccc1	ZINC000450986777	EG	On-Demand	Anodyne	AOC3	17	40
COc1coc(CSC2CCC2)cc1=O	ZINC000450986780	BE	On-Demand	Anodyne	PPO2	18	58
COc1coc(CSC2CCC2)cc1=O	ZINC000450986780	BE	On-Demand	Anodyne	QRFPR	44	36
COc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc(C)cs2)cc1	ZINC000450986781	EH	On-Demand	Anodyne	MMP1	16	41
COc1ccc([C@H]2CCCN2S(=O)(=O)c2cc(C)cs2)cc1	ZINC000450986783	EH	On-Demand	Anodyne	MMP1	16	41
O=S(=O)(Nc1cccc(CCN2CCCC2)c1)c1sccc1Cl	ZINC000450986789	FH	On-Demand	Anodyne	HTR1D	20	40
O=S(=O)(NCCSC1CCC1)c1ccccc1	ZINC000450986790	CE	On-Demand	Anodyne	TBXA2R	22	50
CC(=O)Nc1cccc(CSC2CCC2)c1	ZINC000450986795	BG	On-Demand	Anodyne	QRFPR	47	40
CC(=O)Nc1cccc(CSC2CCC2)c1	ZINC000450986795	BG	On-Demand	Anodyne	NAMPT	22	45
C[C@@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2cnc(O)s2)cc1	ZINC000450986798	GF	On-Demand	Anodyne	TRPC6	15	41
C[C@@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2cnc(O)s2)cc1	ZINC000450986798	GF	On-Demand	Anodyne	TRPC3	16	41
C[C@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2cnc(O)s2)cc1	ZINC000450986800	GF	On-Demand	Anodyne	TRPC6	15	41
C[C@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2cnc(O)s2)cc1	ZINC000450986800	GF	On-Demand	Anodyne	TRPC3	16	41
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CSC1CCC1	ZINC000450986803	CI	On-Demand	Anodyne	UTS2	41	33
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CSC1CCC1	ZINC000450986804	CI	On-Demand	Anodyne	UTS2	41	33
COC(=O)c1ccsc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450986816	GF	On-Demand	Anodyne	PPIA	24	40
CC(C)C(=O)N1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450986826	FD	On-Demand	Mild	TRPV4	42	34
Cc1cnc(CCCC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)o1	ZINC000450986827	FI	On-Demand	Anodyne	ETHR	66	36
CN(CC(=O)N1CCOCC1)S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000450986833	GE	On-Demand	Anodyne	PRKDC	68	36
Cc1csc(S(=O)(=O)Nc2ccccc2NC(=O)N2CCCC2)c1	ZINC000450986836	FG	On-Demand	Anodyne	LPL	55	40
Cc1csc(S(=O)(=O)Nc2ccccc2NC(=O)N2CCCC2)c1	ZINC000450986836	FG	On-Demand	Anodyne	KCNQ2	44	33
Cc1csc(S(=O)(=O)Nc2ccccc2NC(=O)N2CCCC2)c1	ZINC000450986836	FG	On-Demand	Anodyne	LIPG	23	40
CCN(CC#N)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986850	EC	On-Demand	Mild	MMP3	15	40
CCN(CC#N)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986850	EC	On-Demand	Mild	LUXN	0	43
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1OCC(C)C	ZINC000450986855	FF	On-Demand	Anodyne	PRTN3	50	31
COCc1cccc(CSC2CCC2)c1	ZINC000450986857	BH	On-Demand	Anodyne	QRFPR	42	36
CN(Cc1ccccc1)C(=O)CSC1CCC1	ZINC000450986861	BF	On-Demand	Anodyne	HCRTR1	0	41
CN(Cc1ccccc1)C(=O)CSC1CCC1	ZINC000450986861	BF	On-Demand	Anodyne	TSPO	18	41
CN(Cc1ccccc1)C(=O)CSC1CCC1	ZINC000450986861	BF	On-Demand	Anodyne	HCRTR2	0	41
Cn1nc(C(C)(C)C)cc1NC(=O)CSC1CCC1	ZINC000450986863	CF	On-Demand	Anodyne	MAPK14	24	47
N#Cc1cccc(OCCCSC2CCC2)c1	ZINC000450986866	BH	On-Demand	Mild	CHRNA10	52	52
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCc2cccc(Cl)c2)c1	ZINC000450986869	GE	On-Demand	Anodyne	TBXA2R	43	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccs2)cc1	ZINC000450986871	FF	On-Demand	Anodyne	MMP13	0	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2cccs2)cc1	ZINC000450986871	FF	On-Demand	Anodyne	ADAM17	0	43
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)c1	ZINC000450986876	GH	On-Demand	Anodyne	LPL	50	36
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)c1	ZINC000450986876	GH	On-Demand	Anodyne	L3MBTL3	63	37
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)c1	ZINC000450986876	GH	On-Demand	Anodyne	HPGD	44	40
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)c1	ZINC000450986876	GH	On-Demand	Anodyne	SLC6A7	0	41
O=S(=O)(Nc1cccc(CCN2CCCC2)c1)c1sccc1F	ZINC000450986879	FG	On-Demand	Anodyne	HTR1D	24	42
O=S(=O)(Nc1cccc(CCN2CCCC2)c1)c1sccc1F	ZINC000450986879	FG	On-Demand	Anodyne	HTR1B	24	40
O=S(=O)(Nc1cccc(CCN2CCCC2)c1)c1sccc1F	ZINC000450986879	FG	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)c1ncccc1S(=O)(=O)NC[C@@H](C)c1ccccc1	ZINC000450986881	ED	On-Demand	Anodyne	GRIA4	23	43
COC(=O)c1ncccc1S(=O)(=O)NC[C@H](C)c1ccccc1	ZINC000450986882	ED	On-Demand	Anodyne	GRIA4	23	43
O=C(CSC1CCC1)Nc1ccc(CN2CCOCC2)cc1	ZINC000450986883	DF	On-Demand	Anodyne	LTA4H	18	40
O=C(CSC1CCC1)Nc1ccc(CN2CCOCC2)cc1	ZINC000450986883	DF	On-Demand	Anodyne	EPHX2	19	44
COc1ccnc(CSC2CCC2)c1	ZINC000450986887	BF	On-Demand	Anodyne	NOS2	0	61
COc1ccnc(CSC2CCC2)c1	ZINC000450986887	BF	On-Demand	Anodyne	QRFPR	42	34
COc1cc(C)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986888	GE	On-Demand	Anodyne	KCNA5	0	43
COc1cc(C)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986888	GE	On-Demand	Anodyne	PRTN3	55	34
COc1cc(C)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986888	GE	On-Demand	Anodyne	FFAR4	28	40
COc1cc(C)ccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450986888	GE	On-Demand	Anodyne	LUXN	0	46
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	ACE	72	38
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	MME	99	38
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	ANPEP	57	34
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	FCER2	59	36
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	CYSP_TRYCR	34	41
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	CPA1	47	36
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	TIMP3	71	41
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	MMP2	15	43
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	MMP8	15	40
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	MMP14	17	41
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	CAPN1	43	36
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	MMP9	21	41
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	CAPN2	45	31
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	ACE2	65	39
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	MMP7	17	41
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	MMP1	31	43
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	FPR1	47	31
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	POL	0	41
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	AMP1_PLAFQ	54	37
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	BIRC2	42	37
CNC(=O)[C@@H](Cc1ccccc1)SC1CCC1	ZINC000450986890	BF	On-Demand	Anodyne	BLAIMP-1	0	40
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	ACE	72	38
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	MME	99	38
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	ANPEP	57	34
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	FCER2	59	36
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	CYSP_TRYCR	34	41
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	CPA1	47	36
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	TIMP3	71	41
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	MMP2	15	43
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	MMP8	15	40
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	MMP14	17	41
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	CAPN1	43	36
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	MMP9	21	41
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	CAPN2	45	31
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	ACE2	65	39
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	MMP7	17	41
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	MMP1	31	43
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	FPR1	47	31
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	POL	0	41
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	AMP1_PLAFQ	54	37
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	BIRC2	42	37
CNC(=O)[C@H](Cc1ccccc1)SC1CCC1	ZINC000450986891	BF	On-Demand	Anodyne	BLAIMP-1	0	40
COCc1cc([N+](=O)[O-])ccc1NS(=O)(=O)CCC1CCCCC1	ZINC000450986897	FG	On-Demand	Bother	CACNA1D	41	34
COc1ccccc1OCCSC1CCC1	ZINC000450986898	BG	On-Demand	Anodyne	QRFPR	42	38
CCOc1ccncc1S(=O)(=O)NCCc1cccc(Cl)c1	ZINC000450986899	EF	On-Demand	Anodyne	Q95J97_RABIT	0	40
COC(=O)[C@H](SC1CCC1)c1ccccc1	ZINC000450986902	BG	On-Demand	Anodyne	SLC6A3	19	47
COC(=O)[C@H](SC1CCC1)c1ccccc1	ZINC000450986902	BG	On-Demand	Anodyne	AMY2	44	31
COC(=O)[C@@H](SC1CCC1)c1ccccc1	ZINC000450986903	BG	On-Demand	Anodyne	SLC6A3	19	47
COC(=O)[C@@H](SC1CCC1)c1ccccc1	ZINC000450986903	BG	On-Demand	Anodyne	AMY2	44	31
Cc1csc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)c1	ZINC000450986926	DH	On-Demand	Anodyne	GPBAR1	44	43
Cc1csc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)c1	ZINC000450986926	DH	On-Demand	Anodyne	SCD1	18	42
O=C(c1cc2cccnc2s1)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450986929	FI	On-Demand	Anodyne	GPBAR1	47	43
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	MMP13	51	42
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	ADAM17	31	42
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	MMP2	40	42
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	MMP14	29	42
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	MMP9	29	42
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	ADAMTS4	59	40
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	MMP1	23	40
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	SFRP1	69	33
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	WNT3	40	33
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	TNKS	52	33
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	LUXN	0	51
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	ADIPOR1	0	46
C[C@@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986933	GE	On-Demand	Anodyne	ADIPOR2	0	46
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	MMP13	51	42
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	ADAM17	31	42
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	MMP2	40	42
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	MMP14	29	42
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	MMP9	29	42
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	ADAMTS4	59	40
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	MMP1	23	40
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	SFRP1	69	33
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	WNT3	40	33
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	TNKS	52	33
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	LUXN	0	51
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	ADIPOR1	0	46
C[C@H](CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1ccccc1	ZINC000450986934	GE	On-Demand	Anodyne	ADIPOR2	0	46
CC(C)Oc1cccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450986948	FE	On-Demand	Anodyne	CPT1A	65	48
CC(C)Oc1cccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450986949	FE	On-Demand	Anodyne	CPT1A	65	48
CC[C@@H](CC(C)C)C(=O)NCc1ncn(Cc2cccc(F)c2)n1	ZINC000450986950	EG	On-Demand	Anodyne	ANPEP	16	44
CC[C@H](CC(C)C)C(=O)NCc1ncn(Cc2cccc(F)c2)n1	ZINC000450986951	EG	On-Demand	Anodyne	ANPEP	16	44
COCCn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450986953	FD	On-Demand	Anodyne	ADRB2	19	42
COCCn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450986953	FD	On-Demand	Anodyne	ADRB3	15	42
Cc1cccc2nc(C3CCN(C(=O)CCCC(C)C)CC3)oc12	ZINC000450986954	EJ	On-Demand	Anodyne	SMO	46	37
Cc1cccc2nc(C3CCN(C(=O)CCCC(C)C)CC3)oc12	ZINC000450986954	EJ	On-Demand	Anodyne	ETHR	71	47
Cc1ccc(C(=O)N2CCN(CC(C)(C)O)[C@H](C)C2)c(Cl)c1Cl	ZINC000450986957	FG	On-Demand	Anodyne	P2RX7	41	42
Cc1ccc(C(=O)N2CCN(CC(C)(C)O)[C@@H](C)C2)c(Cl)c1Cl	ZINC000450986958	FG	On-Demand	Anodyne	P2RX7	41	42
C[C@H]1CN(C(=O)c2cc(-c3ccccc3)nn2C)CCN1CC(C)(C)O	ZINC000450986961	FE	On-Demand	Anodyne	P2RY12	54	32
C[C@@H]1CN(C(=O)c2cc(-c3ccccc3)nn2C)CCN1CC(C)(C)O	ZINC000450986962	FE	On-Demand	Anodyne	P2RY12	54	32
CC(=O)c1cn(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)nn1	ZINC000450986963	EC	On-Demand	Anodyne	TPP2	45	32
CC(=O)c1cn(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)nn1	ZINC000450986964	EC	On-Demand	Anodyne	TPP2	45	32
COCC1(S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000450986980	FD	On-Demand	Anodyne	SIGMAR1	17	44
COCC1(S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000450986980	FD	On-Demand	Anodyne	ADAM17	16	41
COCC1(S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000450986980	FD	On-Demand	Anodyne	LSS	18	48
Cc1cccc2nc(C3CCN(C(=O)[C@@H]4C[C@H]4C(F)(F)F)CC3)oc12	ZINC000450986992	FI	On-Demand	Anodyne	ETHR	56	33
Oc1n[nH]c([C@H]2CCCCN2CCOc2cccc(Br)c2)n1	ZINC000450987014	FF	On-Demand	Anodyne	COLA	81	42
Oc1n[nH]c([C@H]2CCCCN2CCOc2cccc(Br)c2)n1	ZINC000450987014	FF	On-Demand	Anodyne	CPT1A	67	41
Oc1n[nH]c([C@@H]2CCCCN2CCOc2cccc(Br)c2)n1	ZINC000450987015	FF	On-Demand	Anodyne	COLA	81	42
Oc1n[nH]c([C@@H]2CCCCN2CCOc2cccc(Br)c2)n1	ZINC000450987015	FF	On-Demand	Anodyne	CPT1A	67	41
Cc1cnc(CCCC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)o1	ZINC000450987016	EF	On-Demand	Anodyne	TPP2	44	31
Cc1cnc(CCCC(=O)NC[C@H]2Cc3ccccc3N(C)C2)o1	ZINC000450987017	EF	On-Demand	Anodyne	TPP2	44	31
Cc1cc(C(=O)NC2CCCCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450987018	GI	On-Demand	Anodyne	CNR2	15	48
Cc1cc(C(=O)NC2CCCCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450987018	GI	On-Demand	Anodyne	MAPK14	51	39
Cc1cc(C(=O)NC2CCCCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450987018	GI	On-Demand	Anodyne	MAPK13	89	35
O=C(c1cccc(NS(=O)(=O)c2sccc2Cl)c1)N1CCOCC1	ZINC000450987024	GF	On-Demand	Anodyne	AKR1C3	0	42
CC(C)C[C@H](CO)N(C)C(=O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1	ZINC000450987037	FC	On-Demand	Bother	THRA	0	40
CC(C)C[C@H](CO)N(C)C(=O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1	ZINC000450987037	FC	On-Demand	Bother	COLA	44	32
CC(C)C[C@@H](CO)N(C)C(=O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1	ZINC000450987038	FC	On-Demand	Bother	THRA	0	40
CC(C)C[C@@H](CO)N(C)C(=O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1	ZINC000450987038	FC	On-Demand	Bother	COLA	44	32
CN(C(=O)c1ccccc1NS(=O)(=O)c1sccc1F)C1CCCCC1	ZINC000450987040	GI	On-Demand	Anodyne	PRTN3	44	32
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450987042	GG	On-Demand	Anodyne	ADRB2	19	44
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450987042	GG	On-Demand	Anodyne	GRM4	17	42
O=C(CSC1CCC1)NC[C@H]1Cc2ccccc2O1	ZINC000450987048	CE	On-Demand	Anodyne	HTR1D	0	40
O=C(CSC1CCC1)NC[C@@H]1Cc2ccccc2O1	ZINC000450987049	CE	On-Demand	Anodyne	HTR1D	0	40
Cn1c(CSC2CCC2)nnc1-c1ccc(Cl)cc1	ZINC000450987050	CH	On-Demand	Anodyne	HSD11B1	22	47
N#Cc1ccc(F)cc1CSC1CCC1	ZINC000450987057	BG	On-Demand	Mild	QRFPR	40	34
O=C(CCSC1CCC1)Nc1cccnc1	ZINC000450987070	BF	On-Demand	Anodyne	LDLR	0	41
CC(=O)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450987076	CG	On-Demand	Anodyne	QRFPR	43	37
COC(=O)Cn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450987082	GD	On-Demand	Anodyne	ADRB2	20	43
COC(=O)Cn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450987082	GD	On-Demand	Anodyne	ADRB1	15	43
COC(=O)Cn1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450987082	GD	On-Demand	Anodyne	ADRB3	15	43
CCCN(CC#N)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987084	FD	On-Demand	Mild	MMP13	23	43
CCCN(CC#N)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987084	FD	On-Demand	Mild	MMP3	17	40
CCCN(CC#N)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987084	FD	On-Demand	Mild	LUXN	0	42
COC(=O)c1ccc(CSC2CCC2)c(F)c1	ZINC000450987085	CG	On-Demand	Anodyne	QRFPR	24	43
COc1cc(C#N)ccc1CSC1CCC1	ZINC000450987087	BG	On-Demand	Mild	QRFPR	51	42
COCc1ccc(CSC2CCC2)cc1	ZINC000450987088	BH	On-Demand	Anodyne	QRFPR	44	36
COCC1(S(=O)(=O)NC[C@@H](C)c2ccccc2)CC1	ZINC000450987089	CD	On-Demand	Anodyne	GRIA4	23	46
COCC1(S(=O)(=O)NC[C@H](C)c2ccccc2)CC1	ZINC000450987090	CD	On-Demand	Anodyne	GRIA4	23	46
Cc1nc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)no1	ZINC000450987091	FD	On-Demand	Anodyne	MTNN	53	37
O=C(CSC1CCC1)N(Cc1ccccc1)C1CC1	ZINC000450987092	CG	On-Demand	Anodyne	ACE	47	37
CN(Cc1ccc(Cl)s1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450987094	GF	On-Demand	Anodyne	RORB	0	48
N#CCC1(CS(=O)(=O)N2CCN(CCOc3ccc(Cl)cc3)CC2)CC1	ZINC000450987095	GE	On-Demand	Mild	LTA4H	29	45
c1cnc2c(CSC3CCC3)cccc2c1	ZINC000450987100	BI	On-Demand	Anodyne	CCR1	0	40
CCCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450987103	DH	On-Demand	Anodyne	HRH2	39	42
CCCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450987103	DH	On-Demand	Anodyne	MTNR1A	37	40
CCCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450987103	DH	On-Demand	Anodyne	PLA2G4B	58	42
CCCCOc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450987103	DH	On-Demand	Anodyne	PDS	64	36
CCOC(=O)C[C@@H](C(F)(F)F)S(=O)(=O)NC[C@H](C)c1ccccc1	ZINC000450987106	FF	On-Demand	Anodyne	GRIA4	26	48
CCOC(=O)C[C@H](C(F)(F)F)S(=O)(=O)NC[C@@H](C)c1ccccc1	ZINC000450987107	FF	On-Demand	Anodyne	GRIA4	26	48
CCOC(=O)C[C@H](C(F)(F)F)S(=O)(=O)NC[C@H](C)c1ccccc1	ZINC000450987108	FF	On-Demand	Anodyne	GRIA4	26	48
CCOC(=O)C[C@@H](C(F)(F)F)S(=O)(=O)NC[C@@H](C)c1ccccc1	ZINC000450987109	FF	On-Demand	Anodyne	GRIA4	26	48
CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(F)c1	ZINC000450987112	GF	On-Demand	Anodyne	FOLH1	40	43
CCOC(=O)[C@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(F)c1	ZINC000450987112	GF	On-Demand	Anodyne	TRPV1	40	41
CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(F)c1	ZINC000450987113	GF	On-Demand	Anodyne	FOLH1	40	43
CCOC(=O)[C@@H](NC(=O)Cc1ccc(O)c(F)c1)c1ccc(OC)c(F)c1	ZINC000450987113	GF	On-Demand	Anodyne	TRPV1	40	41
O=C(CSC1CCC1)Nc1nc2ccccc2s1	ZINC000450987114	CH	On-Demand	Anodyne	CSNK1D	40	57
O=C(CSC1CCC1)Nc1nc2ccccc2s1	ZINC000450987114	CH	On-Demand	Anodyne	CDK5	47	43
O=C(CSC1CCC1)Nc1nc2ccccc2s1	ZINC000450987114	CH	On-Demand	Anodyne	FABK	0	43
O=C(CSC1CCC1)Nc1nc2ccccc2s1	ZINC000450987114	CH	On-Demand	Anodyne	PORCN	0	44
O=C(CSC1CCC1)Nc1nc2ccccc2s1	ZINC000450987114	CH	On-Demand	Anodyne	SLC27A1	25	49
O=C(CSC1CCC1)Nc1nc2ccccc2s1	ZINC000450987114	CH	On-Demand	Anodyne	ISPD	0	40
CCOC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987125	GF	On-Demand	Anodyne	TIMP3	72	33
CCOC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987125	GF	On-Demand	Anodyne	HLA-DRB1	43	36
CCOC(=O)[C@@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987125	GF	On-Demand	Anodyne	SOAT1	0	40
CCOC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987126	GF	On-Demand	Anodyne	TIMP3	72	33
CCOC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987126	GF	On-Demand	Anodyne	HLA-DRB1	43	36
CCOC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987126	GF	On-Demand	Anodyne	SOAT1	0	40
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987127	GF	On-Demand	Anodyne	TIMP3	72	33
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987127	GF	On-Demand	Anodyne	HLA-DRB1	43	36
CCOC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987127	GF	On-Demand	Anodyne	SOAT1	0	40
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987128	GF	On-Demand	Anodyne	TIMP3	72	33
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987128	GF	On-Demand	Anodyne	HLA-DRB1	43	36
CCOC(=O)[C@H](NC(=O)[C@@H](Cc1ccccc1)OC)c1ccc(OC)c(F)c1	ZINC000450987128	GF	On-Demand	Anodyne	SOAT1	0	40
O=C(CSC1CCC1)NCc1cccc(OCC(F)(F)F)c1	ZINC000450987133	EH	On-Demand	Anodyne	PDS	66	39
c1cncc(COc2ccc(CSC3CCC3)cc2)c1	ZINC000450987134	CI	On-Demand	Anodyne	VCP	64	42
Cc1cnc2c(c1)N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CCO2	ZINC000450987140	GF	On-Demand	Anodyne	LPL	48	32
Cc1cnc2c(c1)N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CCO2	ZINC000450987140	GF	On-Demand	Anodyne	COLA	22	47
Cc1cnc2c(c1)N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CCO2	ZINC000450987140	GF	On-Demand	Anodyne	F13A1	44	34
CCOC(=O)Cc1nnc(NS(=O)(=O)c2sccc2F)s1	ZINC000450987142	FD	On-Demand	Anodyne	CA4	41	37
COC(=O)c1ncccc1S(=O)(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000450987147	GD	On-Demand	Anodyne	PTAFR	29	42
COC(=O)c1ncccc1S(=O)(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000450987148	GD	On-Demand	Anodyne	PTAFR	29	42
CCCc1ccc(S(=O)(=O)N2CCN(S(=O)(=O)C3(C)CC3)CC2)cc1	ZINC000450987152	GD	On-Demand	Anodyne	PKM	17	42
COc1ccc(-c2nc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)no2)cc1	ZINC000450987159	FE	On-Demand	Anodyne	CPT1A	59	38
COc1ccc(-c2nc(CN3CCCC[C@H]3c3nc(O)n[nH]3)no2)cc1	ZINC000450987160	FE	On-Demand	Anodyne	CPT1A	59	38
Oc1n[nH]c([C@@H]2CCCCN2CCCCOc2ccccc2C(F)(F)F)n1	ZINC000450987165	GH	On-Demand	Anodyne	COLA	46	39
Oc1n[nH]c([C@@H]2CCCCN2CCCCOc2ccccc2C(F)(F)F)n1	ZINC000450987165	GH	On-Demand	Anodyne	CPT1A	45	39
Oc1n[nH]c([C@@H]2CCCCN2CCCCOc2ccccc2C(F)(F)F)n1	ZINC000450987165	GH	On-Demand	Anodyne	SCD1	24	40
Oc1n[nH]c([C@H]2CCCCN2CCCCOc2ccccc2C(F)(F)F)n1	ZINC000450987166	GH	On-Demand	Anodyne	COLA	46	39
Oc1n[nH]c([C@H]2CCCCN2CCCCOc2ccccc2C(F)(F)F)n1	ZINC000450987166	GH	On-Demand	Anodyne	CPT1A	45	39
Oc1n[nH]c([C@H]2CCCCN2CCCCOc2ccccc2C(F)(F)F)n1	ZINC000450987166	GH	On-Demand	Anodyne	SCD1	24	40
COC(=O)c1ncccc1S(=O)(=O)Nc1cccc(OCC(C)C)c1	ZINC000450987169	FF	On-Demand	Anodyne	GPR119	0	40
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450987180	GD	On-Demand	Anodyne	PRTN3	46	35
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450987180	GD	On-Demand	Anodyne	LUXN	0	44
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450987180	GD	On-Demand	Anodyne	ADIPOR1	0	42
CC(=O)c1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450987180	GD	On-Demand	Anodyne	ADIPOR2	0	42
CCCN(CCC)C(=O)c1ccc(NS(=O)(=O)c2cnc(O)s2)cc1	ZINC000450987184	GF	On-Demand	Anodyne	LIMK2	22	41
COC(=O)c1ccc(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1	ZINC000450987189	FE	On-Demand	Anodyne	CACNA1I	22	40
COC(=O)c1ccc(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1	ZINC000450987190	FE	On-Demand	Anodyne	CACNA1I	22	40
Cc1ccn(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)n1	ZINC000450987191	CD	On-Demand	Anodyne	TPP2	53	35
Cc1ccn(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)n1	ZINC000450987192	CD	On-Demand	Anodyne	TPP2	53	35
CC(C)CCCC(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450987205	CG	On-Demand	Anodyne	TPP2	54	35
CC(C)CCCC(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450987206	CG	On-Demand	Anodyne	TPP2	54	35
CC(C)C(=O)N1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450987209	FE	On-Demand	Anodyne	LPL	44	33
CCOc1cc(C)ccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450987210	FE	On-Demand	Anodyne	ALPL	25	40
CCCC(C#N)(CCC)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987213	GE	On-Demand	Mild	LUXN	0	44
Cc1cc2cc(S(=O)(=O)Nc3cccc(OCC(C)C)c3)ccc2[nH]c1=O	ZINC000450987220	GH	On-Demand	Anodyne	MTNN	48	33
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	CA2	49	52
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	ADRB2	19	45
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	ADRB1	17	45
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	ADRB3	18	45
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	CA1	38	52
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	CA7	18	45
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	MMP13	23	40
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	CA4	36	44
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	CA14	21	45
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	F3	41	32
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	MMP2	20	46
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	CA12	21	52
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	ITGAV	45	34
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	CA9	27	52
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	PFK	0	43
CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450987222	GF	On-Demand	Anodyne	LIMK2	51	42
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCCOc1ccccc1F	ZINC000450987223	GD	On-Demand	Anodyne	COLA	40	43
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCCOc1ccccc1F	ZINC000450987223	GD	On-Demand	Anodyne	CPT1A	38	43
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCCOc1ccccc1F	ZINC000450987224	GD	On-Demand	Anodyne	COLA	40	43
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCCOc1ccccc1F	ZINC000450987224	GD	On-Demand	Anodyne	CPT1A	38	43
COc1ccc(-c2noc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)n2)c(OC)c1	ZINC000450987234	GE	On-Demand	Anodyne	COLA	42	37
COc1ccc(-c2noc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)n2)c(OC)c1	ZINC000450987234	GE	On-Demand	Anodyne	CPT1A	42	37
COc1ccc(-c2noc(CN3CCCC[C@H]3c3nc(O)n[nH]3)n2)c(OC)c1	ZINC000450987235	GE	On-Demand	Anodyne	COLA	42	37
COc1ccc(-c2noc(CN3CCCC[C@H]3c3nc(O)n[nH]3)n2)c(OC)c1	ZINC000450987235	GE	On-Demand	Anodyne	CPT1A	42	37
O=C(c1cccc(NS(=O)(=O)c2cccc(Cl)c2O)c1)N1CCCCC1	ZINC000450987240	GG	On-Demand	Anodyne	TRY2_BOVIN	40	35
Cc1cccc(N2CCN(C(=O)CSC3CCC3)CC2)c1	ZINC000450987249	DF	On-Demand	Anodyne	CCR1	26	47
Cc1cccc(N2CCN(C(=O)CSC3CCC3)CC2)c1	ZINC000450987249	DF	On-Demand	Anodyne	SSTR1	32	41
O=[N+]([O-])c1ccccc1CSC1CCC1	ZINC000450987256	BG	On-Demand	Bother	COLA	83	35
O=[N+]([O-])c1ccccc1CSC1CCC1	ZINC000450987256	BG	On-Demand	Bother	PQSD	0	49
COC(=O)c1sccc1CSC1CCC1	ZINC000450987280	BG	On-Demand	Anodyne	QRFPR	50	42
COC(=O)c1sccc1CSC1CCC1	ZINC000450987280	BG	On-Demand	Anodyne	FAS	39	40
COc1cc(NC(=O)CCSC2CCC2)cc(OC)c1OC	ZINC000450987282	EG	On-Demand	Anodyne	QRFPR	47	39
COc1cc(NC(=O)CCSC2CCC2)cc(OC)c1OC	ZINC000450987282	EG	On-Demand	Anodyne	ENPP1	41	31
COc1ccc(CSC2CCC2)cc1	ZINC000450987283	BG	On-Demand	Anodyne	SLC18A2	24	51
COc1ccc(CSC2CCC2)cc1	ZINC000450987283	BG	On-Demand	Anodyne	QRFPR	46	38
COc1ccccc1N1CC[C@H](SC2CCC2)C1=O	ZINC000450987284	CG	On-Demand	Anodyne	HTR1A	32	43
COc1ccccc1N1CC[C@H](SC2CCC2)C1=O	ZINC000450987284	CG	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1N1CC[C@@H](SC2CCC2)C1=O	ZINC000450987285	CG	On-Demand	Anodyne	HTR1A	32	43
COc1ccccc1N1CC[C@@H](SC2CCC2)C1=O	ZINC000450987285	CG	On-Demand	Anodyne	HTR2A	17	40
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	CA2	19	43
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	ADRB2	17	46
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	ADRB1	15	46
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	CA1	27	46
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	MMP13	32	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	CA14	16	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	MMP2	20	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	PRTN3	53	36
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	CA12	15	46
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	MMP7	15	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	ADAMTS4	50	36
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	LEF	48	38
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987288	GH	On-Demand	Anodyne	P96878_MYCTU	15	46
COC(=O)c1cccc(NC(=O)CSC2CCC2)n1	ZINC000450987289	CE	On-Demand	Anodyne	FAS	46	33
Cc1ccccc1C[C@@H](C)NC(=O)CSC1CCC1	ZINC000450987293	CG	On-Demand	Anodyne	ACE	23	40
Cc1ccccc1C[C@H](C)NC(=O)CSC1CCC1	ZINC000450987294	CG	On-Demand	Anodyne	ACE	23	40
C[C@@H](SC1CCC1)C(=O)Nc1nccs1	ZINC000450987302	BF	On-Demand	Anodyne	MAP	0	48
C[C@@H](SC1CCC1)C(=O)Nc1nccs1	ZINC000450987302	BF	On-Demand	Anodyne	MAP1	124	48
C[C@@H](SC1CCC1)C(=O)Nc1nccs1	ZINC000450987302	BF	On-Demand	Anodyne	GCK	21	45
C[C@H](SC1CCC1)C(=O)Nc1nccs1	ZINC000450987303	BF	On-Demand	Anodyne	MAP	0	48
C[C@H](SC1CCC1)C(=O)Nc1nccs1	ZINC000450987303	BF	On-Demand	Anodyne	MAP1	124	48
C[C@H](SC1CCC1)C(=O)Nc1nccs1	ZINC000450987303	BF	On-Demand	Anodyne	GCK	21	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)Cc3ccccc32)cc1	ZINC000450987311	GF	On-Demand	Anodyne	AVPR2	19	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)Cc3ccccc32)cc1	ZINC000450987311	GF	On-Demand	Anodyne	TGM2	48	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCN(C)Cc3ccccc32)cc1	ZINC000450987311	GF	On-Demand	Anodyne	F13A1	80	36
CCCc1cc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)no1	ZINC000450987314	EG	On-Demand	Anodyne	GPBAR1	40	37
CCOC(=O)c1cc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)[nH]c1C	ZINC000450987316	FG	On-Demand	Anodyne	GPBAR1	41	40
O=C(COc1ccc(S(=O)(=O)NCCc2cccs2)cc1)NC1CC1	ZINC000450987321	GD	On-Demand	Anodyne	LUXN	0	42
O=C(COc1ccc(S(=O)(=O)NCCc2cccs2)cc1)NC1CC1	ZINC000450987321	GD	On-Demand	Anodyne	ADIPOR1	0	40
O=C(COc1ccc(S(=O)(=O)NCCc2cccs2)cc1)NC1CC1	ZINC000450987321	GD	On-Demand	Anodyne	ADIPOR2	0	40
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1	ZINC000450987322	FG	On-Demand	Anodyne	LPL	51	38
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)N3CCCCC3)c2)c1	ZINC000450987322	FG	On-Demand	Anodyne	HPGD	47	41
C[C@@H](CNS(=O)(=O)CCOCc1ccccc1)c1ccccc1	ZINC000450987323	EF	On-Demand	Anodyne	GRIA4	23	45
C[C@H](CNS(=O)(=O)CCOCc1ccccc1)c1ccccc1	ZINC000450987324	EF	On-Demand	Anodyne	GRIA4	23	45
CCCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1Cl	ZINC000450987325	GG	On-Demand	Anodyne	GRM4	22	40
CCCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1Cl	ZINC000450987325	GG	On-Demand	Anodyne	ALPL	28	41
COc1cncc(CSC2CCC2)c1	ZINC000450987332	BF	On-Demand	Anodyne	QRFPR	40	33
O=C(CSC1CCC1)Nc1nc2c(s1)CCC2	ZINC000450987333	CF	On-Demand	Anodyne	SLC27A1	30	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(OCC(F)F)n2)cc1	ZINC000450987338	GG	On-Demand	Anodyne	ADAMTS4	42	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccc(OCC(F)F)n2)cc1	ZINC000450987338	GG	On-Demand	Anodyne	PFK	0	40
CC(C)CNC(=O)c1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450987349	FH	On-Demand	Anodyne	F3	73	36
Cc1ccn(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)n1	ZINC000450987355	EG	On-Demand	Anodyne	ETHR	47	33
CCOc1ccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450987374	GG	On-Demand	Bother	BDKRB1	22	42
CCOc1ccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c([N+](=O)[O-])c1	ZINC000450987375	GG	On-Demand	Bother	BDKRB1	22	42
Cc1ccn2ncc(C(=O)NC[C@@H]3Cc4ccccc4N(C)C3)c2c1	ZINC000450987386	EF	On-Demand	Anodyne	ALPHA-1A	0	40
Cc1ccn2ncc(C(=O)NC[C@H]3Cc4ccccc4N(C)C3)c2c1	ZINC000450987387	EF	On-Demand	Anodyne	ALPHA-1A	0	40
CC(C)c1ncsc1C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450987388	EG	On-Demand	Anodyne	TPP2	51	31
CC(C)c1ncsc1C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450987389	EG	On-Demand	Anodyne	TPP2	51	31
CSc1cccc(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)c1	ZINC000450987393	FJ	On-Demand	Anodyne	SMO	40	36
Cc1cccc2nc(C3CCN(C(=O)Cc4ccc(O)c(F)c4)CC3)oc12	ZINC000450987399	FH	On-Demand	Anodyne	ETHR	65	37
Cc1nn(C)cc1CC(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450987404	FG	On-Demand	Anodyne	ETHR	47	37
CCCOc1ccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450987409	FE	On-Demand	Anodyne	COLA	52	42
CCCOc1ccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450987409	FE	On-Demand	Anodyne	CPT1A	51	42
CCCOc1ccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450987410	FE	On-Demand	Anodyne	COLA	52	42
CCCOc1ccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450987410	FE	On-Demand	Anodyne	CPT1A	51	42
C[C@H](c1ccccc1)N1CCN(C(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)CC1	ZINC000450987412	GD	On-Demand	Anodyne	COLA	65	39
C[C@H](c1ccccc1)N1CCN(C(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)CC1	ZINC000450987412	GD	On-Demand	Anodyne	CPT1A	64	39
C[C@@H](c1ccccc1)N1CCN(C(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)CC1	ZINC000450987413	GD	On-Demand	Anodyne	COLA	65	39
C[C@@H](c1ccccc1)N1CCN(C(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)CC1	ZINC000450987413	GD	On-Demand	Anodyne	CPT1A	64	39
C[C@H](c1ccccc1)N1CCN(C(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)CC1	ZINC000450987414	GD	On-Demand	Anodyne	COLA	65	39
C[C@H](c1ccccc1)N1CCN(C(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)CC1	ZINC000450987414	GD	On-Demand	Anodyne	CPT1A	64	39
C[C@@H](c1ccccc1)N1CCN(C(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)CC1	ZINC000450987415	GD	On-Demand	Anodyne	COLA	65	39
C[C@@H](c1ccccc1)N1CCN(C(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)CC1	ZINC000450987415	GD	On-Demand	Anodyne	CPT1A	64	39
CC(C)OCc1cccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450987425	GE	On-Demand	Anodyne	COLA	24	44
CC(C)OCc1cccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450987425	GE	On-Demand	Anodyne	CPT1A	23	44
CC(C)OCc1cccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450987426	GE	On-Demand	Anodyne	COLA	24	44
CC(C)OCc1cccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450987426	GE	On-Demand	Anodyne	CPT1A	23	44
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	CA2	20	40
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	TBXA2R	43	39
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	CA1	31	41
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	CA7	17	42
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	CA14	19	43
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	MMP2	24	43
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	ALOX15	37	45
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	CA9	28	42
Cc1ccccc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987439	FG	On-Demand	Anodyne	LEF	55	35
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCn2ccnc2)c1	ZINC000450987440	FD	On-Demand	Anodyne	TBXAS1	47	41
COC(=O)c1ncccc1S(=O)(=O)NCCc1ccccc1OC	ZINC000450987441	FD	On-Demand	Anodyne	GLMU	0	43
O=C(c1ccc(NS(=O)(=O)c2sccc2F)cc1)N1CCCCCC1	ZINC000450987442	GH	On-Demand	Anodyne	MLYCD	18	41
O=C(c1ccc(NS(=O)(=O)c2sccc2F)cc1)N1CCCCCC1	ZINC000450987442	GH	On-Demand	Anodyne	L3MBTL3	65	38
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCC(C)C)c(Cl)c2)c1	ZINC000450987444	GH	On-Demand	Anodyne	F3	42	30
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCC(C)C)c(Cl)c2)c1	ZINC000450987444	GH	On-Demand	Anodyne	MTNN	54	32
CCOc1ccncc1S(=O)(=O)NCCc1ccccc1C	ZINC000450987447	DE	On-Demand	Anodyne	Q95J97_RABIT	0	40
CC(C)(O)C1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450987449	EF	On-Demand	Anodyne	HDAC8	30	42
CC(C)(O)C1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450987449	EF	On-Demand	Anodyne	HDAC6	22	42
CC(C)(O)C1CN(C(=O)Cn2c(-c3ccccc3)nc3ccccc32)C1	ZINC000450987449	EF	On-Demand	Anodyne	IMDH_CRYPV	31	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	TBXA2R	47	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	CA1	30	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	KCNA5	0	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	CA4	26	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	MMP2	29	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	ALOX15	40	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	LEF	58	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	IDO1	40	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1	ZINC000450987450	FF	On-Demand	Anodyne	PFK	0	41
COc1cccc(Oc2ccc(NS(=O)(=O)CCCCF)cc2)c1	ZINC000450987456	FH	On-Demand	Anodyne	MTNR1A	28	50
COc1cccc(Oc2ccc(NS(=O)(=O)CCCCF)cc2)c1	ZINC000450987456	FH	On-Demand	Anodyne	MTNR1B	23	50
Cc1cccc(Cl)c1NC(=O)CSC1CCC1	ZINC000450987460	CH	On-Demand	Anodyne	LCK	34	40
COc1ccc(C(=O)N(C)C)cc1NS(=O)(=O)c1cc(C)cs1	ZINC000450987464	FF	On-Demand	Anodyne	GHSR	0	42
CCOC(=O)c1cc(S(=O)(=O)NCCn2ccnc2)cnc1C(F)F	ZINC000450987477	FD	On-Demand	Anodyne	TBXAS1	37	40
CCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987485	GI	On-Demand	Anodyne	CA2	15	42
CCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987485	GI	On-Demand	Anodyne	CA1	21	44
CCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987485	GI	On-Demand	Anodyne	PRTN3	52	37
CCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987485	GI	On-Demand	Anodyne	ADAMTS4	43	35
CCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987485	GI	On-Demand	Anodyne	CA9	15	42
CCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987485	GI	On-Demand	Anodyne	LEF	40	36
CCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987485	GI	On-Demand	Anodyne	MTCA1	15	44
CCCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C)c1	ZINC000450987485	GI	On-Demand	Anodyne	P96878_MYCTU	18	44
c1ccc2[nH]c(CSC3CCC3)nc2c1	ZINC000450987487	BG	On-Demand	Anodyne	KCNN3	40	38
COCc1ccccc1CNC(=O)CSC1CCC1	ZINC000450987488	CF	On-Demand	Anodyne	QRFPR	40	35
C[C@@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450987495	GH	On-Demand	Anodyne	TRPC6	29	43
C[C@@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450987495	GH	On-Demand	Anodyne	TRPC3	32	43
C[C@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450987496	GH	On-Demand	Anodyne	TRPC6	29	43
C[C@H]1CCCCN1C(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450987496	GH	On-Demand	Anodyne	TRPC3	32	43
COCc1cc([N+](=O)[O-])ccc1NS(=O)(=O)CCC1CCCC1	ZINC000450987509	EG	On-Demand	Bother	CACNA1D	44	34
Cc1ccccc1CCNS(=O)(=O)c1cnccc1C	ZINC000450987516	CE	On-Demand	Anodyne	Q95J97_RABIT	0	42
COc1cc(CSC2CCC2)c([N+](=O)[O-])cc1OCC(F)F	ZINC000450987518	EI	On-Demand	Bother	QRFPR	42	34
CC(=O)Nc1cccc2c1CCCN2S(=O)(=O)c1cc(C)cs1	ZINC000450987521	FG	On-Demand	Anodyne	LPL	45	36
Cc1nc2ccccn2c(=O)c1CCSC1CCC1	ZINC000450987528	CF	On-Demand	Anodyne	ADRA2A	28	46
Cc1nc2ccccn2c(=O)c1CCSC1CCC1	ZINC000450987528	CF	On-Demand	Anodyne	ADRA2B	34	46
Cc1ccc(NC(=O)Cc2nc(CSC3CCC3)cs2)cc1	ZINC000450987529	EI	On-Demand	Anodyne	QRFPR	43	39
O=S(=O)(Cc1ccc(Br)c(F)c1)NCCn1ccnc1	ZINC000450987532	FD	On-Demand	Anodyne	CYP17A1	22	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCc3ccccc3C2)cc1	ZINC000450987533	FG	On-Demand	Anodyne	APOB	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCc3ccccc3C2)cc1	ZINC000450987533	FG	On-Demand	Anodyne	MTTP	35	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCc3ccccc3C2)cc1	ZINC000450987534	FG	On-Demand	Anodyne	APOB	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCc3ccccc3C2)cc1	ZINC000450987534	FG	On-Demand	Anodyne	MTTP	35	42
CCOc1ccncc1S(=O)(=O)N[C@H]1CCc2ccccc2C1	ZINC000450987535	EE	On-Demand	Anodyne	NPY1R	41	38
CCOc1ccncc1S(=O)(=O)N[C@H]1CCc2ccccc2C1	ZINC000450987535	EE	On-Demand	Anodyne	NPY2R	40	38
CCOc1ccncc1S(=O)(=O)N[C@@H]1CCc2ccccc2C1	ZINC000450987536	EE	On-Demand	Anodyne	NPY1R	41	38
CCOc1ccncc1S(=O)(=O)N[C@@H]1CCc2ccccc2C1	ZINC000450987536	EE	On-Demand	Anodyne	NPY2R	40	38
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1	ZINC000450987600	GE	On-Demand	Anodyne	TNK2	41	35
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(OC[C@H]2CCCO2)cc1	ZINC000450987601	GE	On-Demand	Anodyne	TNK2	41	35
CCc1cccnc1NS(=O)(=O)c1cc(OC)cc(C(F)(F)F)c1	ZINC000450987602	FG	On-Demand	Anodyne	EDNRA	0	40
C=CCc1ccccc1OC[C@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450987603	FE	On-Demand	Mild	ADRB2	32	49
C=CCc1ccccc1OC[C@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450987603	FE	On-Demand	Mild	ADRB3	36	49
C=CCc1ccccc1OC[C@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450987603	FE	On-Demand	Mild	ABCB1	41	34
C=CCc1ccccc1OC[C@@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450987604	FE	On-Demand	Mild	ADRB2	32	49
C=CCc1ccccc1OC[C@@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450987604	FE	On-Demand	Mild	ADRB3	36	49
C=CCc1ccccc1OC[C@@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450987604	FE	On-Demand	Mild	ABCB1	41	34
C=CCc1ccccc1OC[C@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450987605	FE	On-Demand	Mild	ADRB2	32	49
C=CCc1ccccc1OC[C@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450987605	FE	On-Demand	Mild	ADRB3	36	49
C=CCc1ccccc1OC[C@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450987605	FE	On-Demand	Mild	ABCB1	41	34
C=CCc1ccccc1OC[C@@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450987606	FE	On-Demand	Mild	ADRB2	32	49
C=CCc1ccccc1OC[C@@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450987606	FE	On-Demand	Mild	ADRB3	36	49
C=CCc1ccccc1OC[C@@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450987606	FE	On-Demand	Mild	ABCB1	41	34
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1	ZINC000450987607	FG	On-Demand	Anodyne	KCNK3	60	37
Cc1csc(S(=O)(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1	ZINC000450987607	FG	On-Demand	Anodyne	KCNK9	46	37
C[C@H](O)CCCN[C@@H](c1c[nH]c2ccccc12)C(F)(F)F	ZINC000450987611	DH	On-Demand	Anodyne	SSTR2	44	32
C[C@H](O)CCCN[C@H](c1c[nH]c2ccccc12)C(F)(F)F	ZINC000450987612	DH	On-Demand	Anodyne	SSTR2	44	32
C[C@@H](O)CCCN[C@H](c1c[nH]c2ccccc12)C(F)(F)F	ZINC000450987613	DH	On-Demand	Anodyne	SSTR2	44	32
C[C@@H](O)CCCN[C@@H](c1c[nH]c2ccccc12)C(F)(F)F	ZINC000450987614	DH	On-Demand	Anodyne	SSTR2	44	32
N#Cc1ccc(CN2CCN(S(=O)(=O)c3sccc3Cl)CC2)cc1	ZINC000450987615	GF	On-Demand	Mild	TRPV4	16	41
N#Cc1ccc(CN2CCN(S(=O)(=O)c3sccc3Cl)CC2)cc1	ZINC000450987615	GF	On-Demand	Mild	KCNJ1	15	41
CN1C[C@@H](CNC(=O)CSC2CC2)Cc2ccccc21	ZINC000450987616	CE	On-Demand	Anodyne	TPP2	44	32
CN1C[C@H](CNC(=O)CSC2CC2)Cc2ccccc21	ZINC000450987617	CE	On-Demand	Anodyne	TPP2	44	32
CCOC(=O)[C@@H](NC(=O)c1cccc(CC)n1)c1ccc(OC)c(F)c1	ZINC000450987623	FF	On-Demand	Anodyne	PDE5A	27	42
CCOC(=O)[C@H](NC(=O)c1cccc(CC)n1)c1ccc(OC)c(F)c1	ZINC000450987624	FF	On-Demand	Anodyne	PDE5A	27	42
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccccc2OC)cc1	ZINC000450987629	GF	On-Demand	Anodyne	CA14	0	55
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccccc2OC)cc1	ZINC000450987629	GF	On-Demand	Anodyne	ACR	25	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2ccccc2OC)cc1	ZINC000450987629	GF	On-Demand	Anodyne	MBTPS1	54	37
CCOc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987634	FF	On-Demand	Anodyne	ADRB2	22	42
CCOc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987634	FF	On-Demand	Anodyne	PPIA	37	42
CCOc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987634	FF	On-Demand	Anodyne	P2RY1	52	41
CCOc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987634	FF	On-Demand	Anodyne	BDKRB1	0	46
CCOc1ncccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987634	FF	On-Demand	Anodyne	PRTN3	54	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H]2c2cccs2)cc1	ZINC000450987645	GH	On-Demand	Anodyne	TGM2	41	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H]2c2cccs2)cc1	ZINC000450987645	GH	On-Demand	Anodyne	F13A1	58	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccs2)cc1	ZINC000450987647	GH	On-Demand	Anodyne	TGM2	41	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccs2)cc1	ZINC000450987647	GH	On-Demand	Anodyne	F13A1	58	34
Clc1cccc(-c2nnc(CSC3CCC3)o2)c1	ZINC000450987655	CI	On-Demand	Anodyne	TERT	0	42
Clc1cccc(-c2nnc(CSC3CCC3)o2)c1	ZINC000450987655	CI	On-Demand	Anodyne	CYP73A16	15	48
COc1cc(CSC2CCC2)c([N+](=O)[O-])cc1F	ZINC000450987657	CH	On-Demand	Bother	QRFPR	45	38
COc1ccc([C@@H]2CCCN2S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450987661	GG	On-Demand	Anodyne	FKBP1A	25	40
COc1ccc([C@@H]2CCCN2S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450987661	GG	On-Demand	Anodyne	KCNA5	0	41
COc1ccc([C@@H]2CCCN2S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450987661	GG	On-Demand	Anodyne	MMP13	22	45
COc1ccc([C@H]2CCCN2S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450987662	GG	On-Demand	Anodyne	FKBP1A	25	40
COc1ccc([C@H]2CCCN2S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450987662	GG	On-Demand	Anodyne	KCNA5	0	41
COc1ccc([C@H]2CCCN2S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450987662	GG	On-Demand	Anodyne	MMP13	22	45
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987664	GC	On-Demand	Anodyne	EDNRB	40	34
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987664	GC	On-Demand	Anodyne	EDNRA	34	41
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987664	GC	On-Demand	Anodyne	COLA	58	41
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987664	GC	On-Demand	Anodyne	CPT1A	56	41
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987664	GC	On-Demand	Anodyne	NOS2	76	36
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987664	GC	On-Demand	Anodyne	SSTR3	52	31
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987670	GC	On-Demand	Anodyne	EDNRB	40	34
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987670	GC	On-Demand	Anodyne	EDNRA	34	41
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987670	GC	On-Demand	Anodyne	COLA	58	41
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987670	GC	On-Demand	Anodyne	CPT1A	56	41
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987670	GC	On-Demand	Anodyne	NOS2	76	36
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCOc1ccc2c(c1)OCO2	ZINC000450987670	GC	On-Demand	Anodyne	SSTR3	52	31
CC(C)(C)OC(=O)c1cccc(CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450987673	FG	On-Demand	Anodyne	COLA	44	39
CC(C)(C)OC(=O)c1cccc(CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450987673	FG	On-Demand	Anodyne	CPT1A	42	39
CC(C)(C)OC(=O)c1cccc(CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450987674	FG	On-Demand	Anodyne	COLA	44	39
CC(C)(C)OC(=O)c1cccc(CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450987674	FG	On-Demand	Anodyne	CPT1A	42	39
O=C(CSC1CCC1)NCCOc1ccc(C(F)(F)F)cc1	ZINC000450987675	EG	On-Demand	Anodyne	LTA4H	15	41
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	DRD2	22	47
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	DRD4	48	45
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	ACHE	35	42
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	HRH2	21	45
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	DRD3	30	45
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	HTR7	15	47
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	SIGMAR1	42	45
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	SSTR5	64	37
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	MMP13	17	42
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	HTR6	17	47
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	MCHR1	28	44
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	CCR8	101	40
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	SFRP1	123	38
COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450987676	GD	On-Demand	Anodyne	WNT3	81	37
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	DRD2	22	47
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	DRD4	48	45
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	ACHE	35	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	HRH2	21	45
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	DRD3	30	45
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	HTR7	15	47
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	SIGMAR1	42	45
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	SSTR5	64	37
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	MMP13	17	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	HTR6	17	47
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	MCHR1	28	44
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	CCR8	101	40
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	SFRP1	123	38
COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450987680	GD	On-Demand	Anodyne	WNT3	81	37
CC(C)Oc1ncccc1NS(=O)(=O)c1sccc1Cl	ZINC000450987681	EG	On-Demand	Anodyne	NFKBIA	0	40
Oc1n[nH]c([C@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987684	GG	On-Demand	Anodyne	ADRB2	15	40
Oc1n[nH]c([C@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987684	GG	On-Demand	Anodyne	ACOX1	76	40
Oc1n[nH]c([C@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987684	GG	On-Demand	Anodyne	PDE6D	42	32
Oc1n[nH]c([C@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987684	GG	On-Demand	Anodyne	COLA	109	43
Oc1n[nH]c([C@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987684	GG	On-Demand	Anodyne	CPT1A	105	43
Oc1n[nH]c([C@@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987689	GG	On-Demand	Anodyne	ADRB2	15	40
Oc1n[nH]c([C@@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987689	GG	On-Demand	Anodyne	ACOX1	76	40
Oc1n[nH]c([C@@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987689	GG	On-Demand	Anodyne	PDE6D	42	32
Oc1n[nH]c([C@@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987689	GG	On-Demand	Anodyne	COLA	109	43
Oc1n[nH]c([C@@H]2CCCCN2C[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987689	GG	On-Demand	Anodyne	CPT1A	105	43
Oc1n[nH]c([C@@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987690	GG	On-Demand	Anodyne	ADRB2	15	40
Oc1n[nH]c([C@@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987690	GG	On-Demand	Anodyne	ACOX1	76	40
Oc1n[nH]c([C@@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987690	GG	On-Demand	Anodyne	PDE6D	42	32
Oc1n[nH]c([C@@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987690	GG	On-Demand	Anodyne	COLA	109	43
Oc1n[nH]c([C@@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987690	GG	On-Demand	Anodyne	CPT1A	105	43
Oc1n[nH]c([C@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987692	GG	On-Demand	Anodyne	ADRB2	15	40
Oc1n[nH]c([C@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987692	GG	On-Demand	Anodyne	ACOX1	76	40
Oc1n[nH]c([C@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987692	GG	On-Demand	Anodyne	PDE6D	42	32
Oc1n[nH]c([C@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987692	GG	On-Demand	Anodyne	COLA	109	43
Oc1n[nH]c([C@H]2CCCCN2C[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000450987692	GG	On-Demand	Anodyne	CPT1A	105	43
Cc1ccccc1N1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450987693	GG	On-Demand	Mild	PAK1	40	34
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450987694	FF	On-Demand	Bother	F2RL3	44	34
COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450987695	FF	On-Demand	Bother	F2RL3	44	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncccc2C(C)C)cc1	ZINC000450987696	FH	On-Demand	Anodyne	PPIA	35	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncccc2C(C)C)cc1	ZINC000450987696	FH	On-Demand	Anodyne	GRM4	22	44
Cc1cccc2nc(C3CCN(C(=O)CC4CC(F)(F)C4)CC3)oc12	ZINC000450987704	EI	On-Demand	Anodyne	SMO	42	42
Cc1cccc2nc(C3CCN(C(=O)CC4CC(F)(F)C4)CC3)oc12	ZINC000450987704	EI	On-Demand	Anodyne	ETHR	65	35
c1ccc(Cn2cncc2CSC2CCC2)cc1	ZINC000450987707	CH	On-Demand	Anodyne	CYP11B1	19	50
c1ccc(Cn2cncc2CSC2CCC2)cc1	ZINC000450987707	CH	On-Demand	Anodyne	CYP11B2	25	50
Cc1cc(F)c(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)cc1F	ZINC000450987712	GJ	On-Demand	Anodyne	ETHR	59	37
CC(=O)c1cccc(CSC2CCC2)c1	ZINC000450987713	BH	On-Demand	Anodyne	QRFPR	42	39
COc1cc(CSC2CCC2)ccc1SC	ZINC000450987717	CI	On-Demand	Anodyne	QRFPR	46	39
Cc1ccccc1CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987719	GE	On-Demand	Anodyne	MMP13	24	40
Cc1ccccc1CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987719	GE	On-Demand	Anodyne	ADAM17	25	40
Cc1ccccc1CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987719	GE	On-Demand	Anodyne	ADAMTS4	27	40
Cc1ccccc1CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987719	GE	On-Demand	Anodyne	LUXN	0	47
Cc1ccccc1CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987719	GE	On-Demand	Anodyne	ADIPOR1	0	42
Cc1ccccc1CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987719	GE	On-Demand	Anodyne	ADIPOR2	0	42
CCN(CC)C(=O)CN(C)S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450987720	FE	On-Demand	Anodyne	HCRTR2	15	41
Cc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987725	FE	On-Demand	Anodyne	MMP13	34	41
Cc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987725	FE	On-Demand	Anodyne	ADAM17	34	41
Cc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987725	FE	On-Demand	Anodyne	PRTN3	46	33
Cc1ccccc1CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450987725	FE	On-Demand	Anodyne	ADAMTS4	26	41
CC[C@H](CC(F)(F)F)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450987727	EG	On-Demand	Anodyne	TPP2	58	38
O=C(CSC1CCC1)Nc1nc2c(s1)CCCC2	ZINC000450987728	CG	On-Demand	Anodyne	SLC27A1	31	49
CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987729	FD	On-Demand	Anodyne	HCRTR2	0	45
CC[C@@H](CC(F)(F)F)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450987735	EG	On-Demand	Anodyne	TPP2	58	38
CC[C@H](CC(F)(F)F)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450987736	EG	On-Demand	Anodyne	TPP2	58	38
CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450987737	EG	On-Demand	Anodyne	TPP2	58	38
CO[C@@H](C)CS(=O)(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450987739	FF	On-Demand	Anodyne	HTR1D	24	42
CO[C@H](C)CS(=O)(=O)Nc1cccc(CCN2CCC(C)CC2)c1	ZINC000450987740	FF	On-Demand	Anodyne	HTR1D	24	42
Cc1cccc(OCCCNC(=O)CSC2CCC2)c1	ZINC000450987741	CG	On-Demand	Anodyne	DRD4	21	49
Cc1cccc(OCCCNC(=O)CSC2CCC2)c1	ZINC000450987741	CG	On-Demand	Anodyne	HRH2	52	43
Cc1cccc(OCCCNC(=O)CSC2CCC2)c1	ZINC000450987741	CG	On-Demand	Anodyne	MTNR1B	22	40
Cc1csc(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)c1	ZINC000450987743	FE	On-Demand	Anodyne	ESR1	43	38
Cc1csc(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)c1	ZINC000450987743	FE	On-Demand	Anodyne	LTA4H	57	44
Cc1csc(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)c1	ZINC000450987743	FE	On-Demand	Anodyne	HRH3	27	46
Cc1csc(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)c1	ZINC000450987743	FE	On-Demand	Anodyne	PSMB2	49	37
Cc1csc(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)c1	ZINC000450987743	FE	On-Demand	Anodyne	PSMB1	42	38
O=C(CSC1CCC1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000450987752	EI	On-Demand	Anodyne	CDK5	58	46
Cc1csc(S(=O)(=O)N2CCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000450987762	FE	On-Demand	Mild	ADORA2B	40	35
C[C@@H](c1ccccc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450987775	DG	On-Demand	Anodyne	PTAFR	42	40
C[C@@H](c1ccccc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450987775	DG	On-Demand	Anodyne	NMUR2	0	40
C[C@@H](c1ccccc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450987775	DG	On-Demand	Anodyne	NMUR1	0	40
C[C@H](c1ccccc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450987776	DG	On-Demand	Anodyne	PTAFR	42	40
C[C@H](c1ccccc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450987776	DG	On-Demand	Anodyne	NMUR2	0	40
C[C@H](c1ccccc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450987776	DG	On-Demand	Anodyne	NMUR1	0	40
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)c1	ZINC000450987777	GH	On-Demand	Anodyne	CCR8	74	36
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)c1	ZINC000450987777	GH	On-Demand	Anodyne	SFRP1	68	38
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)c1	ZINC000450987777	GH	On-Demand	Anodyne	WNT3	45	30
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)c1	ZINC000450987777	GH	On-Demand	Anodyne	TRPC6	54	42
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)c1	ZINC000450987777	GH	On-Demand	Anodyne	TRPC3	35	42
COC(=O)c1cccc(NC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)n1	ZINC000450987780	FC	On-Demand	Anodyne	COLA	31	40
COC(=O)c1cccc(NC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)n1	ZINC000450987781	FC	On-Demand	Anodyne	COLA	31	40
CCCc1csc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450987789	GF	On-Demand	Anodyne	AVPR1B	20	41
CCCc1csc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n1	ZINC000450987789	GF	On-Demand	Anodyne	LUXN	0	42
CCOC(=O)c1oc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1C	ZINC000450987790	GF	On-Demand	Anodyne	CA2	17	45
CCOC(=O)c1oc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1C	ZINC000450987790	GF	On-Demand	Anodyne	ADRB2	18	42
CCOC(=O)c1oc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1C	ZINC000450987790	GF	On-Demand	Anodyne	ADRB3	16	42
CCOC(=O)c1oc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1C	ZINC000450987790	GF	On-Demand	Anodyne	CA1	23	42
CCOC(=O)c1oc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1C	ZINC000450987790	GF	On-Demand	Anodyne	CA14	15	42
Cc1cccc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1C	ZINC000450987792	FH	On-Demand	Anodyne	P96878_MYCTU	43	37
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)no1	ZINC000450987795	DD	On-Demand	Anodyne	PPIA	27	41
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)no1	ZINC000450987795	DD	On-Demand	Anodyne	CA1	24	43
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)no1	ZINC000450987795	DD	On-Demand	Anodyne	CA4	22	40
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)no1	ZINC000450987795	DD	On-Demand	Anodyne	MMP12	46	38
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)no1	ZINC000450987795	DD	On-Demand	Anodyne	PFK	0	45
O=C(NCCCSC1CCC1)C1CCCC1	ZINC000450987796	BF	On-Demand	Anodyne	GNAI1	0	40
O=C(NCCCSC1CCC1)C1CCCC1	ZINC000450987796	BF	On-Demand	Anodyne	GNAI3	0	40
O=C(NCCCSC1CCC1)C1CCCC1	ZINC000450987796	BF	On-Demand	Anodyne	GNAO1	0	40
O=C(NCCCSC1CCC1)C1CCCC1	ZINC000450987796	BF	On-Demand	Anodyne	TBK1	44	31
O=C(c1cncc(Cl)c1)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450987804	EH	On-Demand	Anodyne	GPBAR1	63	44
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	CA2	35	46
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	CA1	52	38
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	KCNA5	24	47
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	COLA	61	37
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	CA4	29	41
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	MMP2	32	45
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	MMP9	25	40
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	CA12	39	45
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	CA9	39	41
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	LEF	57	37
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	P96878_MYCTU	46	39
Cc1ccccc1CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987807	EG	On-Demand	Anodyne	NAMPT	22	42
CN(CCCOc1ccccc1)C(=O)CSC1CCC1	ZINC000450987813	CG	On-Demand	Anodyne	LTA4H	39	42
CN(CCCOc1ccccc1)C(=O)CSC1CCC1	ZINC000450987813	CG	On-Demand	Anodyne	AMY2	48	36
Oc1n[nH]c([C@@H]2CCCCN2CCOCCOc2ccccc2)n1	ZINC000450987829	EE	On-Demand	Anodyne	CPT1A	106	45
Oc1n[nH]c([C@H]2CCCCN2CCOCCOc2ccccc2)n1	ZINC000450987830	EE	On-Demand	Anodyne	CPT1A	106	45
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	CA2	20	46
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	ADRB2	17	44
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	ADRB1	16	44
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	ADRB3	17	44
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	CA1	27	42
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	NADE	0	44
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	MMP13	30	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	ALPL	18	43
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	ADAMTS4	41	36
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	IDO1	29	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1Cl	ZINC000450987831	GI	On-Demand	Anodyne	PFK	0	43
CCOC[C@H](C)CS(=O)(=O)N1CCN(c2ccccc2C)CC1	ZINC000450987841	EE	On-Demand	Anodyne	ABCB1	26	40
CCOC[C@@H](C)CS(=O)(=O)N1CCN(c2ccccc2C)CC1	ZINC000450987842	EE	On-Demand	Anodyne	ABCB1	26	40
C=Cc1ccc(S(=O)(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1	ZINC000450987844	EF	On-Demand	Anodyne	LIMK2	44	36
C=Cc1ccc(S(=O)(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1	ZINC000450987846	EF	On-Demand	Anodyne	LIMK2	44	36
O=C(c1ccc(N2CCC2)nc1)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450987847	FG	On-Demand	Anodyne	SCD1	39	42
O=C(c1ccc(N2CCC2)nc1)N1CCN(C2CC2)c2cc(F)ccc21	ZINC000450987847	FG	On-Demand	Anodyne	SCD	27	42
CCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)c(C)c1	ZINC000450987849	FE	On-Demand	Anodyne	PRTN3	50	33
CC[C@@H](O)CC(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450987864	CF	On-Demand	Anodyne	GRIA1	44	37
CC[C@@H](O)CC(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450987864	CF	On-Demand	Anodyne	ASAH1	40	29
CC[C@H](O)CC(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450987865	CF	On-Demand	Anodyne	GRIA1	44	37
CC[C@H](O)CC(=O)NCCCCc1ccc(F)c(F)c1	ZINC000450987865	CF	On-Demand	Anodyne	ASAH1	40	29
Cc1ccc(NC(=O)CCSC2CCC2)nc1	ZINC000450987872	CG	On-Demand	Anodyne	GCK	0	42
O=C(c1cccc(NS(=O)(=O)c2cnc(O)s2)c1)N1CCCCC1	ZINC000450987873	FE	On-Demand	Anodyne	PREP	22	40
CCc1oc(C(=O)OC)cc1CSC1CCC1	ZINC000450987877	CG	On-Demand	Anodyne	QRFPR	43	38
Cc1[nH]nc(C(F)F)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450987880	FG	On-Demand	Anodyne	LEF	42	31
CCOCc1nc(C)c(C(=O)NCc2ncn(Cc3cccc(F)c3)n2)s1	ZINC000450987887	GF	On-Demand	Anodyne	CHRM4	20	40
CCOCc1nc(C)c(C(=O)NCc2ncn(Cc3cccc(F)c3)n2)s1	ZINC000450987887	GF	On-Demand	Anodyne	SCD1	44	47
CCOCc1nc(C)c(C(=O)NCc2ncn(Cc3cccc(F)c3)n2)s1	ZINC000450987887	GF	On-Demand	Anodyne	SCD	38	47
N#Cc1cccc(S(=O)(=O)CCN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450987893	FD	On-Demand	Mild	COLA	23	45
N#Cc1cccc(S(=O)(=O)CCN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450987893	FD	On-Demand	Mild	CPT1A	23	45
N#Cc1cccc(S(=O)(=O)CCN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450987894	FD	On-Demand	Mild	COLA	23	45
N#Cc1cccc(S(=O)(=O)CCN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450987894	FD	On-Demand	Mild	CPT1A	23	45
CC(C)(O)C1CN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450987895	FD	On-Demand	Mild	AR	18	43
CC(C)(O)C1CN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)C1	ZINC000450987896	FD	On-Demand	Mild	AR	18	43
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)c1	ZINC000450987902	GI	On-Demand	Anodyne	CCR8	54	32
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)c1	ZINC000450987902	GI	On-Demand	Anodyne	L3MBTL3	52	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)c1	ZINC000450987902	GI	On-Demand	Anodyne	TRPC6	54	42
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)c1	ZINC000450987902	GI	On-Demand	Anodyne	TRPC3	35	42
CN(C)[C@H](CNS(=O)(=O)CCOCc1ccccc1)Cc1ccccc1	ZINC000450987906	GE	On-Demand	Anodyne	CAPN2	50	39
CN(C)[C@@H](CNS(=O)(=O)CCOCc1ccccc1)Cc1ccccc1	ZINC000450987907	GE	On-Demand	Anodyne	CAPN2	50	39
COCCOCCOc1ccc(CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450987913	GE	On-Demand	Anodyne	CHEK2	32	43
COCCOCCOc1ccc(CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450987913	GE	On-Demand	Anodyne	COLA	89	39
COCCOCCOc1ccc(CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450987913	GE	On-Demand	Anodyne	CPT1A	85	39
COCCOCCOc1ccc(CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450987914	GE	On-Demand	Anodyne	CHEK2	32	43
COCCOCCOc1ccc(CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450987914	GE	On-Demand	Anodyne	COLA	89	39
COCCOCCOc1ccc(CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450987914	GE	On-Demand	Anodyne	CPT1A	85	39
CNC(=O)c1ccc(CSC2CCC2)cc1	ZINC000450987917	BF	On-Demand	Anodyne	QRFPR	41	36
Oc1n[nH]c([C@H]2CCCCN2CCOc2ccc(C(F)(F)F)cc2)n1	ZINC000450987921	FG	On-Demand	Anodyne	LTA4H	23	46
Oc1n[nH]c([C@@H]2CCCCN2CCOc2ccc(C(F)(F)F)cc2)n1	ZINC000450987922	FG	On-Demand	Anodyne	LTA4H	23	46
CCOc1cc(NS(=O)(=O)c2cnc(O)s2)ccc1OC	ZINC000450987969	EE	On-Demand	Anodyne	ENPP1	48	32
CCOc1ccncc1S(=O)(=O)NC[C@@H](c1ccccc1OC)N(C)C	ZINC000450987970	GE	On-Demand	Anodyne	ALPL	27	43
CCOc1ccncc1S(=O)(=O)NC[C@H](c1ccccc1OC)N(C)C	ZINC000450987971	GE	On-Demand	Anodyne	ALPL	27	43
Cc1ccc2cc(S(=O)(=O)N3CCC(C(=O)N(C)C)CC3)ccc2c1	ZINC000450987980	FF	On-Demand	Anodyne	CHRM5	24	50
Cc1ccc2cc(S(=O)(=O)N3CCC(C(=O)N(C)C)CC3)ccc2c1	ZINC000450987980	FF	On-Demand	Anodyne	CASP3	0	43
Cc1ccc2cc(S(=O)(=O)N3CCC(C(=O)N(C)C)CC3)ccc2c1	ZINC000450987980	FF	On-Demand	Anodyne	EPHX2	40	44
Cc1ccc2cc(S(=O)(=O)N3CCC(C(=O)N(C)C)CC3)ccc2c1	ZINC000450987980	FF	On-Demand	Anodyne	AKR1C3	27	52
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450987987	FG	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450987987	FG	On-Demand	Anodyne	GRIA4	24	45
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450987987	FG	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450987987	FG	On-Demand	Anodyne	AOC3	16	40
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@H](C)c2ccccc2)cc1	ZINC000450987987	FG	On-Demand	Anodyne	TMPRSS11D	61	37
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450987988	FG	On-Demand	Anodyne	P2RY12	21	40
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450987988	FG	On-Demand	Anodyne	GRIA4	24	45
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450987988	FG	On-Demand	Anodyne	F2RL3	19	40
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450987988	FG	On-Demand	Anodyne	AOC3	16	40
CCOC(=O)c1ccc(CS(=O)(=O)NC[C@@H](C)c2ccccc2)cc1	ZINC000450987988	FG	On-Demand	Anodyne	TMPRSS11D	61	37
COc1ccc(CN2CCCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450987989	EG	On-Demand	Anodyne	DRD4	24	45
COc1ccc(CN2CCCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450987989	EG	On-Demand	Anodyne	AVPR1B	40	33
COc1ccc(CN2CCCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450987989	EG	On-Demand	Anodyne	HRH3	26	41
COc1ccc(CN2CCCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450987989	EG	On-Demand	Anodyne	SIGMAR1	27	47
COc1ccc(CN2CCCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450987989	EG	On-Demand	Anodyne	MMP13	22	40
COc1ccc(CN2CCCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450987989	EG	On-Demand	Anodyne	MGLL	0	47
COc1ccc(CN2CCCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450987989	EG	On-Demand	Anodyne	ABHD6	0	47
COc1cc(OC)c(CNC(=O)CSC2CCC2)c(OC)c1	ZINC000450987990	EF	On-Demand	Anodyne	QRFPR	43	35
COc1cc(OC)c(CNC(=O)CSC2CCC2)c(OC)c1	ZINC000450987990	EF	On-Demand	Anodyne	ACAT	0	47
Cc1cccc(CN2CCN(S(=O)(=O)C3(C)CC3)CC2)c1	ZINC000450987993	DD	On-Demand	Anodyne	DRD4	17	40
C[C@H](CNS(=O)(=O)CC1CC(F)(F)C1)c1ccccc1	ZINC000450987997	DF	On-Demand	Anodyne	GRIA4	26	48
C[C@@H](CNS(=O)(=O)CC1CC(F)(F)C1)c1ccccc1	ZINC000450987998	DF	On-Demand	Anodyne	GRIA4	26	48
Cc1ccc(C(=O)N2CC(C(C)(C)O)C2)c(Cl)c1Cl	ZINC000450988004	DG	On-Demand	Anodyne	P2RX7	33	41
CCOC(=O)C[C@H](C(F)(F)F)S(=O)(=O)NCCc1cccc(Cl)c1	ZINC000450988009	GF	On-Demand	Anodyne	PDS	41	37
CCOC(=O)C[C@@H](C(F)(F)F)S(=O)(=O)NCCc1cccc(Cl)c1	ZINC000450988010	GF	On-Demand	Anodyne	PDS	41	37
COc1cccc(OC)c1OCCCCSC1CCC1	ZINC000450988013	CI	On-Demand	Anodyne	ADRA1B	0	41
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)Nc1c(F)cccc1F	ZINC000450988021	ED	On-Demand	Anodyne	COLA	31	43
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)Nc1c(F)cccc1F	ZINC000450988021	ED	On-Demand	Anodyne	CPT1A	33	43
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)Nc1c(F)cccc1F	ZINC000450988022	ED	On-Demand	Anodyne	COLA	31	43
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)Nc1c(F)cccc1F	ZINC000450988022	ED	On-Demand	Anodyne	CPT1A	33	43
CCOC(=O)[C@@H](NC(=O)c1cc(C)c(C(N)=O)cn1)c1ccc(OC)c(F)c1	ZINC000450988023	GD	On-Demand	Anodyne	CSF1R	42	39
CCOC(=O)[C@H](NC(=O)c1cc(C)c(C(N)=O)cn1)c1ccc(OC)c(F)c1	ZINC000450988024	GD	On-Demand	Anodyne	CSF1R	42	39
Cc1ccc(CN2CCCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450988034	EG	On-Demand	Anodyne	DRD4	28	42
COc1cc(C#N)ccc1OCCSC1CCC1	ZINC000450988038	CG	On-Demand	Mild	QRFPR	40	33
CCOC(=O)CC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450988040	GD	On-Demand	Anodyne	LTA4H	52	45
CCOC(=O)CC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450988040	GD	On-Demand	Anodyne	THRB	0	40
CCOC(=O)CC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450988040	GD	On-Demand	Anodyne	HRH3	19	44
CCOC(=O)CC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450988040	GD	On-Demand	Anodyne	PSMB2	49	38
CCOC(=O)CC1(S(=O)(=O)N2CCN(CCOc3ccccc3)CC2)CC1	ZINC000450988040	GD	On-Demand	Anodyne	PSMB1	42	38
CCOC(=O)c1cc(S(=O)(=O)NCc2ccccc2C)cnc1C(F)F	ZINC000450988041	GF	On-Demand	Anodyne	LEF	40	33
COc1cc(CSC2CCC2)ccn1	ZINC000450988045	BF	On-Demand	Anodyne	QRFPR	42	34
CCOc1ccccc1NC(=O)CSC1CCC1	ZINC000450988074	CG	On-Demand	Anodyne	HCN1	46	37
CCOc1ccccc1NC(=O)CSC1CCC1	ZINC000450988074	CG	On-Demand	Anodyne	HCN4	47	37
CCS(=O)(=O)c1ccc(CN2CCCC[C@H]2CCC(=O)NC)cc1	ZINC000450988086	FE	On-Demand	Anodyne	RORC	40	31
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H]2CCC(=O)NC)cc1	ZINC000450988088	FE	On-Demand	Anodyne	RORC	40	31
CCN(c1cccc(OC)c1)S(=O)(=O)c1cnc(O)s1	ZINC000450988106	DE	On-Demand	Anodyne	HSD17B2	21	40
C[C@H](NC(=O)CSC1CCC1)c1ccc(F)cc1	ZINC000450988111	CG	On-Demand	Anodyne	SDH1	0	44
C[C@@H](NC(=O)CSC1CCC1)c1ccc(F)cc1	ZINC000450988112	CG	On-Demand	Anodyne	SDH1	0	44
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	CA2	22	46
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	ADRB2	20	46
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	ADRB1	19	46
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	ADRB3	21	46
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	CA1	26	45
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	MMP13	39	43
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	CA4	24	45
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	MMP2	29	43
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	MMP12	47	38
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	ADAMTS4	64	42
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	CA9	17	46
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	PFK	0	48
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	LIMK2	52	42
CC(C)OCc1cccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450988150	GI	On-Demand	Anodyne	UQCRB	0	42
CCOC(=O)c1ccsc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988181	GG	On-Demand	Anodyne	CA2	20	47
CCOC(=O)c1ccsc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988181	GG	On-Demand	Anodyne	CA1	27	43
CCOC(=O)c1ccsc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988181	GG	On-Demand	Anodyne	CA14	15	43
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	BMP1	119	41
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP13	53	43
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	ADAM17	28	40
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP16	0	40
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MTNR1A	37	63
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MTNR1B	38	63
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP2	38	43
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP3	30	42
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP8	37	42
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP14	16	40
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP9	48	42
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP12	42	42
CCN(c1cccc(OC)c1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988188	GH	On-Demand	Anodyne	MMP1	36	41
CN(Cc1cccs1)C(=O)CSC1CCC1	ZINC000450988190	CF	On-Demand	Anodyne	ADAM17	0	42
Cn1cnc2c1c(=O)n(CCCSC1CCC1)c(=O)n2C	ZINC000450988203	DD	On-Demand	Anodyne	CHIB1	0	65
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1sccc1Cl	ZINC000450988217	FG	On-Demand	Anodyne	BMP1	55	39
COc1ccc(CN(C)C(=O)CSC2CCC2)cc1OC	ZINC000450988219	DF	On-Demand	Anodyne	MT-ND1	25	44
COc1ccc(CN(C)C(=O)CSC2CCC2)cc1OC	ZINC000450988219	DF	On-Demand	Anodyne	QRFPR	42	35
CCN(Cc1cccc(F)c1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450988221	GF	On-Demand	Anodyne	RORC	16	43
CCN(Cc1cccc(F)c1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450988221	GF	On-Demand	Anodyne	RORB	0	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cn2)cc1	ZINC000450988223	GG	On-Demand	Anodyne	CA1	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cn2)cc1	ZINC000450988223	GG	On-Demand	Anodyne	IDO1	30	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cn2)cc1	ZINC000450988223	GG	On-Demand	Anodyne	PFK	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cn2)cc1	ZINC000450988223	GG	On-Demand	Anodyne	MTCA1	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cn2)cc1	ZINC000450988223	GG	On-Demand	Anodyne	AADAC	0	40
COc1ccc(CN(C)C(=O)CSC2CCC2)cc1	ZINC000450988229	CF	On-Demand	Anodyne	SLC18A2	18	40
C[C@@H](SC1CCC1)C(=O)N(C)C1CCCCC1	ZINC000450988230	CG	On-Demand	Anodyne	ACE	0	40
C[C@H](SC1CCC1)C(=O)N(C)C1CCCCC1	ZINC000450988232	CG	On-Demand	Anodyne	ACE	0	40
CCN(CC(=O)N1CCCCCC1)Cc1ccc(S(=O)(=O)CC)cc1	ZINC000450988233	FF	On-Demand	Anodyne	RORC	16	41
COc1cc(-c2nnc(CSC3CCC3)o2)cc(OC)c1OC	ZINC000450988234	EH	On-Demand	Anodyne	QRFPR	40	33
CCOc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988239	GH	On-Demand	Anodyne	CA2	18	46
CCOc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988239	GH	On-Demand	Anodyne	CA1	25	42
CCOc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988239	GH	On-Demand	Anodyne	MMP13	22	41
CCOc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988239	GH	On-Demand	Anodyne	CA14	15	42
CCOc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988239	GH	On-Demand	Anodyne	ALPL	15	48
CCOc1cc(C)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988239	GH	On-Demand	Anodyne	LEF	40	38
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1cc(C)cs1	ZINC000450988258	EC	On-Demand	Anodyne	BDKRB1	23	40
O=C(CSC1CCC1)NCc1ccc(OC(F)(F)F)cc1	ZINC000450988261	DG	On-Demand	Anodyne	SCN9A	0	48
O=C(CSC1CCC1)NCc1ccc(OC(F)(F)F)cc1	ZINC000450988261	DG	On-Demand	Anodyne	EPHX2	37	40
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1cc(C)cs1	ZINC000450988262	EC	On-Demand	Anodyne	BDKRB1	23	40
CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSC1CCC1	ZINC000450988264	FG	On-Demand	Anodyne	RBP4	59	35
O=C(CSC1CCC1)Nc1ccccc1Cc1ccccc1	ZINC000450988266	DJ	On-Demand	Anodyne	KCNQ2	37	45
O=C(CSC1CCC1)Nc1ccccc1Cc1ccccc1	ZINC000450988266	DJ	On-Demand	Anodyne	CCR3	17	41
O=C(CSC1CCC1)Nc1ccccc1Cc1ccccc1	ZINC000450988266	DJ	On-Demand	Anodyne	CDK5	29	41
N#CCc1ccc(S(=O)(=O)N2CCN(Cc3ccncc3)CC2)c(Cl)c1	ZINC000450988268	GE	On-Demand	Mild	ADORA2B	45	37
CC[C@]1(c2ccc(NS(=O)(=O)c3cc(C)cs3)cc2)CCC(=O)NC1=O	ZINC000450988270	GF	On-Demand	Anodyne	MGAT1	45	32
CC[C@@]1(c2ccc(NS(=O)(=O)c3cc(C)cs3)cc2)CCC(=O)NC1=O	ZINC000450988272	GF	On-Demand	Anodyne	MGAT1	45	32
CC1CCN(C(=O)c2ccc(NS(=O)(=O)c3sccc3F)cc2)CC1	ZINC000450988279	GH	On-Demand	Anodyne	L3MBTL3	67	37
CC1CCN(C(=O)c2ccc(NS(=O)(=O)c3sccc3F)cc2)CC1	ZINC000450988279	GH	On-Demand	Anodyne	TRPC6	48	42
CC1CCN(C(=O)c2ccc(NS(=O)(=O)c3sccc3F)cc2)CC1	ZINC000450988279	GH	On-Demand	Anodyne	TRPC3	26	42
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c1	ZINC000450988304	GH	On-Demand	Anodyne	L3MBTL3	71	37
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c1	ZINC000450988304	GH	On-Demand	Anodyne	TRPC6	61	49
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2)c1	ZINC000450988304	GH	On-Demand	Anodyne	TRPC3	46	49
CCOC(=O)c1ccc(CS(=O)(=O)Nc2ccc3c(c2)N(C)CC3)cc1	ZINC000450988305	FF	On-Demand	Anodyne	SRD5A2	0	40
CCOC(=O)c1ccc(CS(=O)(=O)Nc2ccc3c(c2)N(C)CC3)cc1	ZINC000450988305	FF	On-Demand	Anodyne	NOD2	33	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(CC#N)C2CCCC2)cc1	ZINC000450988314	EF	On-Demand	Mild	AVPR1B	20	49
Clc1cccc(-c2noc(CSC3CCC3)n2)c1	ZINC000450988336	CI	On-Demand	Anodyne	GRM5	28	48
CCCC(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988351	EH	On-Demand	Anodyne	F2R	0	51
CCCC(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988351	EH	On-Demand	Anodyne	HDAC10	15	43
CCCC(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988351	EH	On-Demand	Anodyne	RCE1	0	40
CCCC(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988351	EH	On-Demand	Anodyne	KCNK3	54	35
CCCC(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988351	EH	On-Demand	Anodyne	KCNK9	48	35
COc1cccc(CCCS(=O)(=O)c2cccc(Br)c2)c1	ZINC000450988352	FH	On-Demand	Anodyne	MTNR1A	15	47
COc1cccc(CCCS(=O)(=O)c2cccc(Br)c2)c1	ZINC000450988352	FH	On-Demand	Anodyne	CRTM	44	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1	ZINC000450988360	FG	On-Demand	Anodyne	F3	76	35
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1	ZINC000450988360	FG	On-Demand	Anodyne	ITGAV	48	38
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1	ZINC000450988360	FG	On-Demand	Anodyne	MTNN	41	33
Fc1ccccc1N1CCCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC000450988370	DH	On-Demand	Anodyne	ADRA1D	17	43
Fc1ccccc1N1CCCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC000450988371	DH	On-Demand	Anodyne	ADRA1D	17	43
COC(=O)c1ccc([C@H](NC(=O)c2ccc(N3CCC3)nc2)C(F)(F)F)cc1	ZINC000450988376	GG	On-Demand	Anodyne	HPGDS	33	46
O=C(CSC1CCC1)N1CCc2[nH]c3ccccc3c2C1	ZINC000450988380	DG	On-Demand	Anodyne	SSTR4	48	34
COC(=O)c1ccc([C@@H](NC(=O)c2ccc(N3CCC3)nc2)C(F)(F)F)cc1	ZINC000450988381	GG	On-Demand	Anodyne	HPGDS	33	46
COC(=O)CCCCCNS(=O)(=O)c1cnccc1C	ZINC000450988387	DD	On-Demand	Anodyne	TBXAS1	24	40
C[C@@H](SC1CCC1)C(=O)NC[C@H]1COc2ccccc2O1	ZINC000450988394	DF	On-Demand	Anodyne	HTR1A	0	42
C[C@H](SC1CCC1)C(=O)NC[C@@H]1COc2ccccc2O1	ZINC000450988395	DF	On-Demand	Anodyne	HTR1A	0	42
C[C@H](SC1CCC1)C(=O)NC[C@H]1COc2ccccc2O1	ZINC000450988396	DF	On-Demand	Anodyne	HTR1A	0	42
C[C@@H](SC1CCC1)C(=O)NC[C@@H]1COc2ccccc2O1	ZINC000450988398	DF	On-Demand	Anodyne	HTR1A	0	42
COC(=O)[C@@H](NC(=O)CS(=O)(=O)c1cccc(Br)c1)C(C)C	ZINC000450988423	GD	On-Demand	Anodyne	ADAMTS4	18	40
Cc1csc(S(=O)(=O)N2CCN(CC(C)C)CC2)c1	ZINC000450988424	DE	On-Demand	Anodyne	LPAR2	15	42
CCCCNC(=O)NC(=O)CS(=O)(=O)c1cccc(Br)c1	ZINC000450988428	GD	On-Demand	Anodyne	FBP1	15	40
CC(=O)N[C@H](C(=O)NCCN(C)C(=O)[C@@H](NC(C)=O)C(C)(C)C)C(C)(C)C	ZINC000450988464	GC	On-Demand	Anodyne	PDF	102	40
CC(=O)N[C@H](C(=O)NCCN(C)C(=O)[C@@H](NC(C)=O)C(C)(C)C)C(C)(C)C	ZINC000450988464	GC	On-Demand	Anodyne	PROTEASE	0	45
C[C@H](SC1CCC1)C(=O)Nc1ccc2c(c1)OCCO2	ZINC000450988469	CG	On-Demand	Anodyne	TRPV1	0	46
C[C@@H](SC1CCC1)C(=O)Nc1ccc2c(c1)OCCO2	ZINC000450988470	CG	On-Demand	Anodyne	TRPV1	0	46
C[C@@H]1Cc2ccccc2N1C(=O)CSC1CCC1	ZINC000450988471	CG	On-Demand	Anodyne	DRD4	32	52
C[C@@H]1Cc2ccccc2N1C(=O)CSC1CCC1	ZINC000450988471	CG	On-Demand	Anodyne	TPP2	55	34
C[C@H]1Cc2ccccc2N1C(=O)CSC1CCC1	ZINC000450988472	CG	On-Demand	Anodyne	DRD4	32	52
C[C@H]1Cc2ccccc2N1C(=O)CSC1CCC1	ZINC000450988472	CG	On-Demand	Anodyne	TPP2	55	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2noc(C3CC3)n2)cc1	ZINC000450988501	FE	On-Demand	Anodyne	MMP12	15	41
Cc1cccc(C)c1CS(=O)(=O)N(CC(F)(F)F)c1ccncc1	ZINC000450988509	FH	On-Demand	Anodyne	RORC	17	45
O=C(NCCNS(=O)(=O)c1sc2ccccc2c1Cl)C1CC1	ZINC000450988510	FE	On-Demand	Anodyne	NPY2R	19	42
O=S(=O)(NC1(C(F)(F)F)CCOCC1)c1cccc2c(Cl)ccnc12	ZINC000450988514	GG	On-Demand	Anodyne	BDKRB2	49	32
CC(=O)c1cccc(CN2CCC[C@@H]2C(F)F)c1	ZINC000450988515	CG	On-Demand	Anodyne	HRH3	0	42
COc1ccc(C2=NN(C(=O)CSC3CCC3)[C@@H](c3ccco3)C2)cc1	ZINC000450988521	FI	On-Demand	Anodyne	EGFR	23	41
COc1ccc(C2=NN(C(=O)CSC3CCC3)[C@@H](c3ccco3)C2)cc1	ZINC000450988521	FI	On-Demand	Anodyne	MAOB	23	52
COc1ccc(C2=NN(C(=O)CSC3CCC3)[C@@H](c3ccco3)C2)cc1	ZINC000450988521	FI	On-Demand	Anodyne	ERBB2	29	41
COc1ccc(C2=NN(C(=O)CSC3CCC3)[C@@H](c3ccco3)C2)cc1	ZINC000450988521	FI	On-Demand	Anodyne	TERT	0	42
COc1ccc(C2=NN(C(=O)CSC3CCC3)[C@H](c3ccco3)C2)cc1	ZINC000450988522	FI	On-Demand	Anodyne	EGFR	23	41
COc1ccc(C2=NN(C(=O)CSC3CCC3)[C@H](c3ccco3)C2)cc1	ZINC000450988522	FI	On-Demand	Anodyne	MAOB	23	52
COc1ccc(C2=NN(C(=O)CSC3CCC3)[C@H](c3ccco3)C2)cc1	ZINC000450988522	FI	On-Demand	Anodyne	ERBB2	29	41
COc1ccc(C2=NN(C(=O)CSC3CCC3)[C@H](c3ccco3)C2)cc1	ZINC000450988522	FI	On-Demand	Anodyne	TERT	0	42
CCOC(=O)c1cnc(C)c(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450988523	GF	On-Demand	Anodyne	P2RY12	26	41
CCOC(=O)c1cnc(C)c(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450988524	GF	On-Demand	Anodyne	P2RY12	26	41
O=C(CSC1CCC1)N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000450988545	GH	On-Demand	Anodyne	CXCR3	22	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnc(C(C)(C)C)nc2)cc1	ZINC000450988551	GG	On-Demand	Anodyne	CA2	18	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnc(C(C)(C)C)nc2)cc1	ZINC000450988551	GG	On-Demand	Anodyne	ADRB2	16	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnc(C(C)(C)C)nc2)cc1	ZINC000450988551	GG	On-Demand	Anodyne	CA1	20	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnc(C(C)(C)C)nc2)cc1	ZINC000450988551	GG	On-Demand	Anodyne	CA4	22	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnc(C(C)(C)C)nc2)cc1	ZINC000450988551	GG	On-Demand	Anodyne	GRM4	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnc(C(C)(C)C)nc2)cc1	ZINC000450988551	GG	On-Demand	Anodyne	CYNT	19	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cnc(C(C)(C)C)nc2)cc1	ZINC000450988551	GG	On-Demand	Anodyne	PFK	0	41
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(Br)cc1	ZINC000450988564	GH	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(Br)cc1	ZINC000450988564	GH	On-Demand	Anodyne	HTR2A	17	44
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(Br)cc1	ZINC000450988564	GH	On-Demand	Anodyne	HTR2C	18	46
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(Br)cc1	ZINC000450988564	GH	On-Demand	Anodyne	CYP2J2	55	38
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(Br)cc1	ZINC000450988565	GH	On-Demand	Anodyne	DRD4	0	40
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(Br)cc1	ZINC000450988565	GH	On-Demand	Anodyne	HTR2A	17	44
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(Br)cc1	ZINC000450988565	GH	On-Demand	Anodyne	HTR2C	18	46
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(Br)cc1	ZINC000450988565	GH	On-Demand	Anodyne	CYP2J2	55	38
CCc1ccccc1NC(=O)CNC(=O)CSC1CCC1	ZINC000450988568	DF	On-Demand	Anodyne	KCNQ2	45	35
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	HTR1A	62	44
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	DRD2	58	58
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	DRD1	23	42
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	DRD4	37	58
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	HTR2A	40	41
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	HTR2C	21	41
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	ADRA1A	26	44
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	DRD3	58	58
CCc1cc(CCCN2CCCN(c3ccccc3F)CC2)on1	ZINC000450988575	EH	On-Demand	Anodyne	HTR7	45	40
CCOC(=O)c1ccc(CS(=O)(=O)Nc2c(C)cccc2C(C)C)cc1	ZINC000450988576	GI	On-Demand	Anodyne	SOAT1	41	38
CCOC(=O)c1ccc(CS(=O)(=O)Nc2c(C)cccc2C(C)C)cc1	ZINC000450988576	GI	On-Demand	Anodyne	ACAT	0	45
CCCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)n(C)n1	ZINC000450988584	GD	On-Demand	Anodyne	LUXN	0	42
C[C@@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450988597	CH	On-Demand	Anodyne	CXCL8	45	36
C[C@@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450988597	CH	On-Demand	Anodyne	KCNQ2	59	38
C[C@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450988598	CH	On-Demand	Anodyne	CXCL8	45	36
C[C@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450988598	CH	On-Demand	Anodyne	KCNQ2	59	38
CC(C)c1ccc(OCCNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450988610	GE	On-Demand	Anodyne	COLA	47	38
CC(C)c1ccc(OCCNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450988610	GE	On-Demand	Anodyne	CPT1A	45	38
O=C(CSC1CCC1)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450988611	DG	On-Demand	Anodyne	HTR1A	23	49
O=C(CSC1CCC1)N1CCN(c2cccc(Cl)c2)CC1	ZINC000450988611	DG	On-Demand	Anodyne	SSTR1	30	51
COC(=O)C1(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450988614	DE	On-Demand	Anodyne	HTR1A	58	41
COC(=O)C1(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450988614	DE	On-Demand	Anodyne	DRD2	55	46
COC(=O)C1(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450988614	DE	On-Demand	Anodyne	DRD4	42	35
COC(=O)C1(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450988614	DE	On-Demand	Anodyne	ADRA1D	64	35
COC(=O)C1(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450988614	DE	On-Demand	Anodyne	HTR2A	32	43
COC(=O)C1(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450988614	DE	On-Demand	Anodyne	ADRA1B	44	35
COC(=O)C1(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450988614	DE	On-Demand	Anodyne	DRD3	58	39
COC(=O)C1(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450988614	DE	On-Demand	Anodyne	KCNQ2	68	38
COC(=O)c1csc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450988618	EF	On-Demand	Anodyne	HTR1A	54	39
COC(=O)c1csc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450988618	EF	On-Demand	Anodyne	DRD2	57	43
COC(=O)c1csc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450988618	EF	On-Demand	Anodyne	DRD4	40	46
COC(=O)c1csc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450988618	EF	On-Demand	Anodyne	ADRA1D	42	42
COC(=O)c1csc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450988618	EF	On-Demand	Anodyne	HTR2A	32	42
COC(=O)c1csc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450988618	EF	On-Demand	Anodyne	DRD3	52	42
COC(=O)c1csc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450988618	EF	On-Demand	Anodyne	HTR7	48	36
COC(=O)c1csc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450988618	EF	On-Demand	Anodyne	KCNQ2	50	35
CC(C)c1ccc(OCCNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450988622	GE	On-Demand	Anodyne	COLA	47	38
CC(C)c1ccc(OCCNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450988622	GE	On-Demand	Anodyne	CPT1A	45	38
COC(=O)CN(CC#N)S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450988631	ED	On-Demand	Mild	BMP1	19	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCN(C)c3ccccc32)cc1	ZINC000450988635	GG	On-Demand	Anodyne	LPL	42	32
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCN(C)c3ccccc32)cc1	ZINC000450988635	GG	On-Demand	Anodyne	TGM2	57	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCN(C)c3ccccc32)cc1	ZINC000450988635	GG	On-Demand	Anodyne	F13A1	89	39
CC(C)(C)C1=CCN(CCNC(=O)c2c[nH]c3nccc-3c2)CC1	ZINC000450988650	EF	On-Demand	Anodyne	DRD4	40	31
CC(C)(C)C1=CCN(CCNC(=O)c2c[nH]c3nccc-3c2)CC1	ZINC000450988650	EF	On-Demand	Anodyne	PLD2	57	33
CC(C)[C@H](SC1CCC1)C(=O)N(C)c1ccccc1	ZINC000450988656	CH	On-Demand	Anodyne	AMY2	45	32
CC(C)[C@@H](SC1CCC1)C(=O)N(C)c1ccccc1	ZINC000450988658	CH	On-Demand	Anodyne	AMY2	45	32
CCCN(CCC)C(=O)c1ccc(NS(=O)(=O)c2cc(C)cs2)cc1	ZINC000450988669	GI	On-Demand	Anodyne	LIMK2	25	41
O=S(=O)(c1ccc2ccccc2c1F)N1CCN(Cc2ccncc2)CC1	ZINC000450988671	GF	On-Demand	Anodyne	ADORA2B	41	35
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	HTR1A	32	47
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	DRD2	40	47
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	DRD4	45	44
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	ACHE	30	42
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	SLC6A1	69	41
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	DRD3	30	44
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	PDE4A	36	41
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	PRSS2	43	30
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	SIGMAR1	30	41
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	CCR3	49	38
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	ABCB1	0	40
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	MCHR1	28	40
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	CCR8	32	44
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	MBTPS1	41	39
COc1ccccc1O[C@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988672	EH	On-Demand	Anodyne	ACKR3	65	33
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	HTR1A	32	47
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	DRD2	40	47
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	DRD4	45	44
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	ACHE	30	42
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	SLC6A1	69	41
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	DRD3	30	44
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	PDE4A	36	41
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	PRSS2	43	30
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	SIGMAR1	30	41
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	CCR3	49	38
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	ABCB1	0	40
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	MCHR1	28	40
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	CCR8	32	44
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	MBTPS1	41	39
COc1ccccc1O[C@@H]1CCCN(Cc2cccc(C(C)=O)c2)C1	ZINC000450988674	EH	On-Demand	Anodyne	ACKR3	65	33
Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1c(C)cccc1C	ZINC000450988688	EG	On-Demand	Bother	TBXA2R	22	42
Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1c(C)cccc1C	ZINC000450988688	EG	On-Demand	Bother	NFKBIA	0	41
CCOC(=O)c1ccc(CS(=O)(=O)Nc2ncccc2C(C)C)cc1	ZINC000450988693	FG	On-Demand	Anodyne	PPIA	17	46
CCc1cccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)n1	ZINC000450988698	DF	On-Demand	Anodyne	TPP2	60	40
CCc1cccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)n1	ZINC000450988699	DF	On-Demand	Anodyne	TPP2	60	40
Oc1n[nH]c([C@H]2CCCCN2Cc2nc(COc3ccc(F)cc3)no2)n1	ZINC000450988700	FE	On-Demand	Anodyne	CPT1A	62	37
Oc1n[nH]c([C@@H]2CCCCN2Cc2nc(COc3ccc(F)cc3)no2)n1	ZINC000450988701	FE	On-Demand	Anodyne	CPT1A	62	37
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	CA2	19	40
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	SDH1	0	40
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	CA1	23	41
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	TRPV1	54	33
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	MMP13	20	40
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	GRM4	15	45
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	CA9	15	40
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	LEF	48	38
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	IDO1	29	45
CCOc1cc(F)ccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450988706	GH	On-Demand	Anodyne	MOGAT2	42	34
Cc1cccc2nc(C3CCN(C(=O)C4(C(F)(F)F)CCC4)CC3)oc12	ZINC000450988715	FJ	On-Demand	Anodyne	SMO	43	35
Cc1cccc2nc(C3CCN(C(=O)C4(C(F)(F)F)CCC4)CC3)oc12	ZINC000450988715	FJ	On-Demand	Anodyne	ETHR	53	35
COC(=O)c1ncccc1S(=O)(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000450988727	GD	On-Demand	Anodyne	KCNA5	40	34
COC(=O)c1ncccc1S(=O)(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000450988728	GD	On-Demand	Anodyne	KCNA5	40	34
CCOc1cc(NS(=O)(=O)c2cc(C)cs2)ccc1OC	ZINC000450988747	EG	On-Demand	Anodyne	GHSR	0	45
CCOc1cc(NS(=O)(=O)c2cc(C)cs2)ccc1OC	ZINC000450988747	EG	On-Demand	Anodyne	ALPL	28	40
CC1(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)CC1	ZINC000450988748	GD	On-Demand	Anodyne	PTGS2	21	42
CC1(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)CC1	ZINC000450988748	GD	On-Demand	Anodyne	PKM	45	44
O=C(c1cccc(NS(=O)(=O)c2sccc2F)c1)N1CCOCC1	ZINC000450988749	FE	On-Demand	Anodyne	EPHX2	15	52
O=C(c1cccc(NS(=O)(=O)c2sccc2F)c1)N1CCOCC1	ZINC000450988749	FE	On-Demand	Anodyne	AKR1C3	15	42
CCC(=O)CCCN1CCCC[C@@H]1c1nc(C)no1	ZINC000450988752	CF	On-Demand	Anodyne	COLA	62	39
CCC(=O)CCCN1CCCC[C@@H]1c1nc(C)no1	ZINC000450988752	CF	On-Demand	Anodyne	CPT1A	45	39
CCC(=O)CCCN1CCCC[C@H]1c1nc(C)no1	ZINC000450988753	CF	On-Demand	Anodyne	COLA	62	39
CCC(=O)CCCN1CCCC[C@H]1c1nc(C)no1	ZINC000450988753	CF	On-Demand	Anodyne	CPT1A	45	39
O=C(CSC1CCC1)NCc1cccc(Cl)c1	ZINC000450988754	CG	On-Demand	Anodyne	P2RX7	20	51
O=C(CSC1CCC1)NCc1cccc(Cl)c1	ZINC000450988754	CG	On-Demand	Anodyne	DPP7	17	43
Cc1ccc(NC(=O)CSC2CCC2)cc1Cl	ZINC000450988775	CH	On-Demand	Anodyne	EPHX2	22	43
Cc1ccc(NC(=O)CSC2CCC2)cc1Cl	ZINC000450988775	CH	On-Demand	Anodyne	MCHR1	25	40
Cc1ccc(NC(=O)CSC2CCC2)cc1Cl	ZINC000450988775	CH	On-Demand	Anodyne	QRFPR	46	40
CC(C)NC(=O)CN1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450988785	FD	On-Demand	Anodyne	AVPR1B	41	33
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450988789	FF	On-Demand	Anodyne	CA9	15	40
O=C(CSC1CCC1)N1CCCc2ccccc21	ZINC000450988798	CG	On-Demand	Anodyne	AVPR2	28	40
CCc1nc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450988803	FD	On-Demand	Anodyne	LUXN	0	44
O=C(CSC1CCC1)N1CCC(Cc2ccccc2)CC1	ZINC000450988806	DH	On-Demand	Anodyne	GRIN1	0	41
O=C(CSC1CCC1)N1CCC(Cc2ccccc2)CC1	ZINC000450988806	DH	On-Demand	Anodyne	GRIN2B	79	51
O=C(CSC1CCC1)N1CCC(Cc2ccccc2)CC1	ZINC000450988806	DH	On-Demand	Anodyne	SIGMAR1	30	45
O=C(CSC1CCC1)N1CCC(Cc2ccccc2)CC1	ZINC000450988806	DH	On-Demand	Anodyne	CCR3	51	43
O=C(CSC1CCC1)N1CCC(Cc2ccccc2)CC1	ZINC000450988806	DH	On-Demand	Anodyne	PREP	42	35
O=C(CSC1CCC1)N1CCC(Cc2ccccc2)CC1	ZINC000450988806	DH	On-Demand	Anodyne	GRIN3A	0	41
COc1ccccc1N(C(C)=O)c1nc(CSC2CCC2)cs1	ZINC000450988808	EJ	On-Demand	Anodyne	QRFPR	44	36
C[C@H](SC1CCC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450988809	CH	On-Demand	Anodyne	ACE	22	45
C[C@H](SC1CCC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450988809	CH	On-Demand	Anodyne	DRD4	27	43
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)SC1CCC1	ZINC000450988810	CH	On-Demand	Anodyne	ACE	22	45
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)SC1CCC1	ZINC000450988810	CH	On-Demand	Anodyne	DRD4	27	43
C[C@H](SC1CCC1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450988811	CH	On-Demand	Anodyne	ACE	22	45
C[C@H](SC1CCC1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000450988811	CH	On-Demand	Anodyne	DRD4	27	43
C[C@@H](SC1CCC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450988812	CH	On-Demand	Anodyne	ACE	22	45
C[C@@H](SC1CCC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000450988812	CH	On-Demand	Anodyne	DRD4	27	43
O=C(CSC1CCC1)Nc1ccccc1-c1ccccc1	ZINC000450988817	CJ	On-Demand	Anodyne	CHRM3	17	43
CCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450988820	GE	On-Demand	Anodyne	BDKRB1	0	41
CCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450988820	GE	On-Demand	Anodyne	PRTN3	60	38
C[C@@H](SC1CCC1)C(=O)Nc1ccc(F)c(F)c1	ZINC000450988821	CH	On-Demand	Anodyne	ENV	45	35
C[C@H](SC1CCC1)C(=O)Nc1ccc(F)c(F)c1	ZINC000450988822	CH	On-Demand	Anodyne	ENV	45	35
CC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1	ZINC000450988828	CF	On-Demand	Anodyne	ACHE	23	47
CC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1	ZINC000450988828	CF	On-Demand	Anodyne	SIGMAR1	39	50
CC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1	ZINC000450988828	CF	On-Demand	Anodyne	MLNR	44	34
CC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1	ZINC000450988828	CF	On-Demand	Anodyne	CACNA1I	53	35
CC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1	ZINC000450988829	CF	On-Demand	Anodyne	ACHE	23	47
CC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1	ZINC000450988829	CF	On-Demand	Anodyne	SIGMAR1	39	50
CC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1	ZINC000450988829	CF	On-Demand	Anodyne	MLNR	44	34
CC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1	ZINC000450988829	CF	On-Demand	Anodyne	CACNA1I	53	35
N#C[C@@H](c1ccccc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450988837	EF	On-Demand	Mild	PTAFR	29	53
N#C[C@H](c1ccccc1)N1CCN(C(=O)CSC2CCC2)CC1	ZINC000450988838	EF	On-Demand	Mild	PTAFR	29	53
O=C(CCSC1CCC1)Nc1ccc2c(c1)OCO2	ZINC000450988839	CG	On-Demand	Anodyne	LDLR	0	48
CCC[C@H](NS(=O)(=O)c1cccnc1C(=O)OC)c1ccccc1	ZINC000450988841	EF	On-Demand	Anodyne	KCNA5	23	41
CCC[C@@H](NS(=O)(=O)c1cccnc1C(=O)OC)c1ccccc1	ZINC000450988842	EF	On-Demand	Anodyne	KCNA5	23	41
Cc1oc(-c2ccccc2)nc1CSC1CCC1	ZINC000450988846	CI	On-Demand	Anodyne	PPARG	73	42
Cc1oc(-c2ccccc2)nc1CSC1CCC1	ZINC000450988846	CI	On-Demand	Anodyne	PPARA	77	42
Cc1oc(-c2ccccc2)nc1CSC1CCC1	ZINC000450988846	CI	On-Demand	Anodyne	PDE8B	63	38
Cc1csc(S(=O)(=O)N(CC(F)(F)F)c2ccncc2)c1	ZINC000450988854	EG	On-Demand	Anodyne	RORB	0	40
COc1ccc(C)cc1NC(=O)CNC(=O)CSC1CCC1	ZINC000450988859	DE	On-Demand	Anodyne	QRFPR	48	40
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCC(N)=O	ZINC000450988870	CC	On-Demand	Anodyne	AOC3	25	41
C[C@H](c1ccccc1)[C@H](O)CN(C)CCC(N)=O	ZINC000450988871	CC	On-Demand	Anodyne	AOC3	25	41
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCC(N)=O	ZINC000450988873	CC	On-Demand	Anodyne	AOC3	25	41
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCC(N)=O	ZINC000450988874	CC	On-Demand	Anodyne	AOC3	25	41
COc1cc(CN2CCCC[C@H]2c2nc(C)no2)ccc1Cl	ZINC000450988881	DH	On-Demand	Anodyne	SSTR5	40	36
COc1cc(CN2CCCC[C@H]2c2nc(C)no2)ccc1Cl	ZINC000450988881	DH	On-Demand	Anodyne	COLA	45	37
COc1cc(CN2CCCC[C@H]2c2nc(C)no2)ccc1Cl	ZINC000450988881	DH	On-Demand	Anodyne	CPT1A	44	37
COc1cc(CN2CCCC[C@@H]2c2nc(C)no2)ccc1Cl	ZINC000450988882	DH	On-Demand	Anodyne	SSTR5	40	36
COc1cc(CN2CCCC[C@@H]2c2nc(C)no2)ccc1Cl	ZINC000450988882	DH	On-Demand	Anodyne	COLA	45	37
COc1cc(CN2CCCC[C@@H]2c2nc(C)no2)ccc1Cl	ZINC000450988882	DH	On-Demand	Anodyne	CPT1A	44	37
CO[C@H](C)C(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988883	FF	On-Demand	Anodyne	GUAB	0	40
CO[C@H](C)C(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988883	FF	On-Demand	Anodyne	KCNK3	58	36
CO[C@H](C)C(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988883	FF	On-Demand	Anodyne	KCNK9	72	36
CO[C@@H](C)C(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988884	FF	On-Demand	Anodyne	GUAB	0	40
CO[C@@H](C)C(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988884	FF	On-Demand	Anodyne	KCNK3	58	36
CO[C@@H](C)C(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450988884	FF	On-Demand	Anodyne	KCNK9	72	36
CNC(=O)CC[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450988888	EG	On-Demand	Anodyne	DRD4	0	43
CNC(=O)CC[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450988888	EG	On-Demand	Anodyne	HTR3B	0	41
CNC(=O)CC[C@@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450988888	EG	On-Demand	Anodyne	CYP2J2	47	34
CNC(=O)CC[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450988889	EG	On-Demand	Anodyne	DRD4	0	43
CNC(=O)CC[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450988889	EG	On-Demand	Anodyne	HTR3B	0	41
CNC(=O)CC[C@H]1CCCCN1CCCC(=O)c1ccc(F)cc1	ZINC000450988889	EG	On-Demand	Anodyne	CYP2J2	47	34
O=C(CSC1CCC1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000450988898	FH	On-Demand	Anodyne	KCNQ2	26	44
O=C(CSC1CCC1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000450988898	FH	On-Demand	Anodyne	TEK	0	40
O=C(CSC1CCC1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000450988898	FH	On-Demand	Anodyne	LIPG	52	40
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	DRTS_PLAFK	22	41
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	TSHR	50	33
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	ACHE	23	41
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	PTGER2	29	44
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	PTGER1	47	35
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	PTGER4	25	44
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	HCRTR1	28	48
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	AGTR2	43	38
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	TRPV1	0	40
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	BCHE	37	43
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	MTNR1B	29	52
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	HCRTR2	32	44
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	CACNA1G	40	33
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	QRFPR	44	40
COc1cc(CNC(=O)CSC2CCC2)ccc1OCc1ccccc1	ZINC000450988899	FI	On-Demand	Anodyne	PDEB1	0	40
CN(c1c(F)cccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450988901	GE	On-Demand	Anodyne	MMP13	34	41
CN(c1c(F)cccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450988901	GE	On-Demand	Anodyne	ADAM17	41	41
CN(c1c(F)cccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450988901	GE	On-Demand	Anodyne	LUXN	0	48
CN(c1c(F)cccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450988901	GE	On-Demand	Anodyne	ADIPOR1	0	42
CN(c1c(F)cccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450988901	GE	On-Demand	Anodyne	ADIPOR2	0	42
COc1cccc(NC(=O)CN(C)C(=O)CSC2CCC2)c1	ZINC000450988906	DE	On-Demand	Anodyne	MTNR1A	35	43
COc1cccc(NC(=O)CN(C)C(=O)CSC2CCC2)c1	ZINC000450988906	DE	On-Demand	Anodyne	MTNR1B	33	43
COc1cccc(NC(=O)CN(C)C(=O)CSC2CCC2)c1	ZINC000450988906	DE	On-Demand	Anodyne	QRFPR	41	35
CC(C)[C@H](SC1CCC1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000450988907	EE	On-Demand	Anodyne	SLC6A7	0	43
CC(C)[C@@H](SC1CCC1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000450988908	EE	On-Demand	Anodyne	SLC6A7	0	43
C[C@H](SC1CCC1)C(=O)N1CCC[C@H]1c1cccs1	ZINC000450988915	CI	On-Demand	Anodyne	ADAM17	41	42
C[C@@H](SC1CCC1)C(=O)N1CCC[C@@H]1c1cccs1	ZINC000450988916	CI	On-Demand	Anodyne	ADAM17	41	42
C[C@H](SC1CCC1)C(=O)N1CCC[C@@H]1c1cccs1	ZINC000450988917	CI	On-Demand	Anodyne	ADAM17	41	42
C[C@@H](SC1CCC1)C(=O)N1CCC[C@H]1c1cccs1	ZINC000450988918	CI	On-Demand	Anodyne	ADAM17	41	42
Cc1ccc(NC(=O)[C@H](C)SC2CCC2)cc1F	ZINC000450988929	CH	On-Demand	Anodyne	ENV	44	34
Cc1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1F	ZINC000450988936	CH	On-Demand	Anodyne	ENV	44	34
C[C@@H](NC(=O)CSC1CCC1)c1cccc2ccccc12	ZINC000450988943	CI	On-Demand	Anodyne	CASR	0	40
C[C@H](NC(=O)CSC1CCC1)c1cccc2ccccc12	ZINC000450988946	CI	On-Demand	Anodyne	CASR	0	40
Cc1nc(C)n(CCCC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)n1	ZINC000450988966	GH	On-Demand	Anodyne	ETHR	64	35
C[C@H](CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1)S(C)(=O)=O	ZINC000450988972	GF	On-Demand	Anodyne	MC4R	28	43
Cc1cccc(C)c1CS(=O)(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000450988973	EG	On-Demand	Bother	COLA	56	32
N#CCC1(CS(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000450988974	FE	On-Demand	Mild	LSS	15	44
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	DRD2	15	41
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	DRD4	37	41
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	DRD3	22	40
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	SIGMAR1	36	45
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	CCR3	25	42
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	HTR6	15	41
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	TRPV4	16	41
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	CTSC	17	42
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	MCHR1	17	50
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	CCR8	55	34
N#CCc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988979	GF	On-Demand	Mild	SFRP1	60	35
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	DRD2	15	41
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	DRD4	37	41
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	DRD3	22	40
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	SIGMAR1	36	45
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	CCR3	25	42
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	HTR6	15	41
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	TRPV4	16	41
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	CTSC	17	42
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	MCHR1	17	50
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	CCR8	55	34
N#CCc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1	ZINC000450988980	GF	On-Demand	Mild	SFRP1	60	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)Oc3ncccc32)cc1	ZINC000450988981	GF	On-Demand	Anodyne	F13A1	49	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)Oc3ncccc32)cc1	ZINC000450988981	GF	On-Demand	Anodyne	NAMPT	43	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)Oc3ncccc32)cc1	ZINC000450988982	GF	On-Demand	Anodyne	F13A1	49	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)Oc3ncccc32)cc1	ZINC000450988982	GF	On-Demand	Anodyne	NAMPT	43	42
CC[C@H](C#N)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989018	DD	On-Demand	Mild	CA1	30	48
CC[C@H](C#N)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989018	DD	On-Demand	Mild	MMP2	23	42
CC[C@H](C#N)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989018	DD	On-Demand	Mild	CA12	30	42
CC[C@H](C#N)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989018	DD	On-Demand	Mild	LEF	40	38
CC[C@@H](C#N)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989019	DD	On-Demand	Mild	CA1	30	48
CC[C@@H](C#N)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989019	DD	On-Demand	Mild	MMP2	23	42
CC[C@@H](C#N)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989019	DD	On-Demand	Mild	CA12	30	42
CC[C@@H](C#N)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989019	DD	On-Demand	Mild	LEF	40	38
CCOc1cc(NS(=O)(=O)c2cc(C(F)(F)F)ccc2O)ccc1OC	ZINC000450989020	GH	On-Demand	Anodyne	UTS2R	15	42
Cc1cccc2nc(C3CCN(C(=O)C[C@@H]4CC[C@@H]5C[C@H]45)CC3)oc12	ZINC000450989023	EI	On-Demand	Anodyne	ETHR	46	32
Cc1cccc2nc(C3CCN(C(=O)C[C@@H]4CC[C@@H]5C[C@@H]45)CC3)oc12	ZINC000450989024	EI	On-Demand	Anodyne	ETHR	46	32
Cc1cccc2nc(C3CCN(C(=O)C[C@@H]4CC[C@H]5C[C@H]45)CC3)oc12	ZINC000450989025	EI	On-Demand	Anodyne	ETHR	46	32
Cc1cccc2nc(C3CCN(C(=O)C[C@@H]4CC[C@H]5C[C@@H]45)CC3)oc12	ZINC000450989026	EI	On-Demand	Anodyne	ETHR	46	32
Cc1n[nH]cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989027	DE	On-Demand	Anodyne	MTNN	40	31
COc1cccc(OCCC(=O)N2CCCC[C@H](C)C2)c1	ZINC000450989034	CG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)N2CCCC[C@H](C)C2)c1	ZINC000450989034	CG	On-Demand	Anodyne	COLA	84	36
COc1cccc(OCCC(=O)N2CCCC[C@H](C)C2)c1	ZINC000450989034	CG	On-Demand	Anodyne	RORC	50	43
COc1cccc(OCCC(=O)N2CCCC[C@@H](C)C2)c1	ZINC000450989035	CG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCC(=O)N2CCCC[C@@H](C)C2)c1	ZINC000450989035	CG	On-Demand	Anodyne	COLA	84	36
COc1cccc(OCCC(=O)N2CCCC[C@@H](C)C2)c1	ZINC000450989035	CG	On-Demand	Anodyne	RORC	50	43
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450989038	EF	On-Demand	Anodyne	ACE	43	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450989038	EF	On-Demand	Anodyne	TPP2	53	32
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450989039	EF	On-Demand	Anodyne	ACE	43	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450989039	EF	On-Demand	Anodyne	TPP2	53	32
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450989040	EF	On-Demand	Anodyne	ACE	43	37
CO[C@@H](Cc1ccccc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450989040	EF	On-Demand	Anodyne	TPP2	53	32
CO[C@H](Cc1ccccc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450989041	EF	On-Demand	Anodyne	ACE	43	37
CO[C@H](Cc1ccccc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450989041	EF	On-Demand	Anodyne	TPP2	53	32
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCOc1ccc(F)cc1	ZINC000450989044	FD	On-Demand	Anodyne	COLA	67	43
O=C(CN1CCCC[C@H]1c1nc(O)n[nH]1)NCCOc1ccc(F)cc1	ZINC000450989044	FD	On-Demand	Anodyne	CPT1A	59	42
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCOc1ccc(F)cc1	ZINC000450989045	FD	On-Demand	Anodyne	COLA	67	43
O=C(CN1CCCC[C@@H]1c1nc(O)n[nH]1)NCCOc1ccc(F)cc1	ZINC000450989045	FD	On-Demand	Anodyne	CPT1A	59	42
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450989047	GH	On-Demand	Anodyne	F2R	0	48
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450989047	GH	On-Demand	Anodyne	MTNR1B	15	46
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450989047	GH	On-Demand	Anodyne	SOAT1	31	41
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450989047	GH	On-Demand	Anodyne	HDAC6	15	40
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450989047	GH	On-Demand	Anodyne	KCNK3	49	34
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@@H](OC)c2ccccc2)c1	ZINC000450989047	GH	On-Demand	Anodyne	KCNK9	48	34
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450989048	GH	On-Demand	Anodyne	F2R	0	48
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450989048	GH	On-Demand	Anodyne	MTNR1B	15	46
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450989048	GH	On-Demand	Anodyne	SOAT1	31	41
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450989048	GH	On-Demand	Anodyne	HDAC6	15	40
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450989048	GH	On-Demand	Anodyne	KCNK3	49	34
CCCC(=O)Nc1cccc(NS(=O)(=O)C[C@H](OC)c2ccccc2)c1	ZINC000450989048	GH	On-Demand	Anodyne	KCNK9	48	34
CCCOc1ccc(Cl)cc1NS(=O)(=O)c1cnc(O)s1	ZINC000450989049	EG	On-Demand	Anodyne	CCR2	0	47
COC(=O)[C@](C)(NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(Cl)c(Cl)c1	ZINC000450989050	FE	On-Demand	Anodyne	P2RX7	39	48
COC(=O)[C@@](C)(NC(=O)[C@@H]1CCC(=O)N1C)c1ccc(Cl)c(Cl)c1	ZINC000450989051	FE	On-Demand	Anodyne	P2RX7	39	48
COC(=O)[C@](C)(NC(=O)[C@H]1CCC(=O)N1C)c1ccc(Cl)c(Cl)c1	ZINC000450989052	FE	On-Demand	Anodyne	P2RX7	39	48
COC(=O)[C@@](C)(NC(=O)[C@H]1CCC(=O)N1C)c1ccc(Cl)c(Cl)c1	ZINC000450989053	FE	On-Demand	Anodyne	P2RX7	39	48
Cc1ccc(NC(=O)CSC2CCC2)cc1F	ZINC000450989076	CG	On-Demand	Anodyne	ENV	42	32
Cc1ccc(NC(=O)CSC2CCC2)cc1F	ZINC000450989076	CG	On-Demand	Anodyne	QRFPR	45	38
O=S(=O)(Nc1noc(C2CC2)n1)c1sccc1F	ZINC000450989086	CD	On-Demand	Anodyne	ETHR	48	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H]2Cn2ccnc2)cc1	ZINC000450989098	GE	On-Demand	Anodyne	CASP3	57	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H]2Cn2ccnc2)cc1	ZINC000450989098	GE	On-Demand	Anodyne	CASP7	63	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H]2Cn2ccnc2)cc1	ZINC000450989098	GE	On-Demand	Anodyne	TGM2	42	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H]2Cn2ccnc2)cc1	ZINC000450989098	GE	On-Demand	Anodyne	F13A1	69	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H]2Cn2ccnc2)cc1	ZINC000450989098	GE	On-Demand	Anodyne	NAMPT	33	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000450989099	GE	On-Demand	Anodyne	CASP3	57	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000450989099	GE	On-Demand	Anodyne	CASP7	63	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000450989099	GE	On-Demand	Anodyne	TGM2	42	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000450989099	GE	On-Demand	Anodyne	F13A1	69	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000450989099	GE	On-Demand	Anodyne	NAMPT	33	42
CSc1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450989101	CI	On-Demand	Anodyne	CETP	0	41
CSc1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450989103	CI	On-Demand	Anodyne	CETP	0	41
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCc3ccncc32)c1	ZINC000450989106	FF	On-Demand	Anodyne	COLA	38	41
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCc3ccncc32)c1	ZINC000450989106	FF	On-Demand	Anodyne	CPT1A	42	41
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCc3ccncc32)c1	ZINC000450989106	FF	On-Demand	Anodyne	CPT2	39	41
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCc3ccncc32)c1	ZINC000450989106	FF	On-Demand	Anodyne	CPT1B	31	41
COc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450989110	CF	On-Demand	Anodyne	DRD4	43	33
COc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450989110	CF	On-Demand	Anodyne	ROCK1	38	42
COc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450989110	CF	On-Demand	Anodyne	MTNR1A	75	45
COc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450989110	CF	On-Demand	Anodyne	MTNR1B	65	45
COc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450989110	CF	On-Demand	Anodyne	ROCK2	44	41
COc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450989110	CF	On-Demand	Anodyne	QRFPR	40	34
COc1cccc(CNC(=O)CSC2CCC2)c1	ZINC000450989110	CF	On-Demand	Anodyne	PDS	42	33
COc1ccccc1NC(=O)CSC1CCC1	ZINC000450989112	CF	On-Demand	Anodyne	DEF	0	43
COc1ccccc1NC(=O)CSC1CCC1	ZINC000450989112	CF	On-Demand	Anodyne	QRFPR	49	44
COc1ccccc1NC(=O)CSC1CCC1	ZINC000450989112	CF	On-Demand	Anodyne	FAS	54	40
Cc1cc(Cl)ccc1NC(=O)CSC1CCC1	ZINC000450989115	CH	On-Demand	Anodyne	QRFPR	41	39
C[C@@H](SC1CCC1)C(=O)Nc1ccc(Br)cc1	ZINC000450989117	DI	On-Demand	Anodyne	SDH1	0	43
C[C@H](SC1CCC1)C(=O)Nc1ccc(Br)cc1	ZINC000450989118	DI	On-Demand	Anodyne	SDH1	0	43
O=C(CSC1CCC1)Nc1ccc2c(c1)CCC2	ZINC000450989119	CG	On-Demand	Anodyne	QRFPR	42	35
COc1cc(OC)c(OC)cc1CNS(=O)(=O)c1cnccc1C	ZINC000450989124	FD	On-Demand	Anodyne	GLMU	0	44
CCN(c1ccc(OC)c(OC)c1)S(=O)(=O)c1cc(C)cs1	ZINC000450989130	EG	On-Demand	Anodyne	HCRTR2	22	43
Cc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450989151	BG	On-Demand	Anodyne	FUCA1	23	44
Cc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450989151	BG	On-Demand	Anodyne	QRFPR	43	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)n2)cc1	ZINC000450989152	FF	On-Demand	Anodyne	CA14	22	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2noc(C(C)(C)C)n2)cc1	ZINC000450989152	FF	On-Demand	Anodyne	PFK	0	43
C[C@@H](CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1)S(C)(=O)=O	ZINC000450989168	GF	On-Demand	Anodyne	MC4R	28	43
O=S(=O)(c1sccc1Cl)N1CCN(Cc2ccncc2)CC1	ZINC000450989176	FE	On-Demand	Anodyne	LSS	17	58
O=C(Nc1ccccc1)C1CCN(C(=O)CSC2CCC2)CC1	ZINC000450989177	EG	On-Demand	Anodyne	EPHX2	23	41
CCc1cccc(CC)c1NC(=O)[C@@H](C)SC1CCC1	ZINC000450989182	CI	On-Demand	Anodyne	ACAT	0	42
CCOC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1	ZINC000450989197	DH	On-Demand	Anodyne	DRD2	35	49
CCOC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1	ZINC000450989197	DH	On-Demand	Anodyne	DRD1	15	50
CCOC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1	ZINC000450989197	DH	On-Demand	Anodyne	DRD4	22	52
CCOC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1	ZINC000450989197	DH	On-Demand	Anodyne	HTR2A	22	54
CCOC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1	ZINC000450989197	DH	On-Demand	Anodyne	ERG2	23	49
CCOC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1	ZINC000450989197	DH	On-Demand	Anodyne	SLC18A3	0	52
CCOC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1	ZINC000450989197	DH	On-Demand	Anodyne	CYP2J2	51	36
CCOC1CC2(CCN(CCCC(=O)c3ccc(F)cc3)C2)C1	ZINC000450989197	DH	On-Demand	Anodyne	AP2S1	0	49
O=C(CCCN1CCOC[C@@H]1CC(F)F)c1ccc(F)cc1	ZINC000450989207	DG	On-Demand	Anodyne	DRD2	28	40
O=C(CCCN1CCOC[C@@H]1CC(F)F)c1ccc(F)cc1	ZINC000450989207	DG	On-Demand	Anodyne	CYP2J2	47	35
O=C(CCCN1CCOC[C@H]1CC(F)F)c1ccc(F)cc1	ZINC000450989208	DG	On-Demand	Anodyne	DRD2	28	40
O=C(CCCN1CCOC[C@H]1CC(F)F)c1ccc(F)cc1	ZINC000450989208	DG	On-Demand	Anodyne	CYP2J2	47	35
O=C(CSC1CCC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000450989231	CF	On-Demand	Bother	NPY2R	18	41
CC(=O)c1cccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)c1	ZINC000450989248	FH	On-Demand	Mild	AR	23	41
CC(=O)c1cccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)c1	ZINC000450989248	FH	On-Demand	Mild	SIGMAR1	30	41
CC(=O)c1cccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)c1	ZINC000450989248	FH	On-Demand	Mild	SSTR5	46	35
CC(=O)c1cccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)c1	ZINC000450989248	FH	On-Demand	Mild	CCR3	46	39
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)c1	ZINC000450989251	GH	On-Demand	Anodyne	CNR2	15	48
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)c1	ZINC000450989251	GH	On-Demand	Anodyne	EPHX2	20	42
COC(=O)Cn1ncc(NC(=O)Cc2sccc2Br)c1C	ZINC000450989254	FE	On-Demand	Anodyne	FAS	40	33
COC(=O)c1ccc(CNC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450989259	DF	On-Demand	Anodyne	PROC	56	34
COC(=O)c1ccc(CNC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450989260	DF	On-Demand	Anodyne	PROC	56	34
COc1ccccc1CN(C)C(=O)CSC1CCC1	ZINC000450989266	CF	On-Demand	Anodyne	TACR1	28	42
COc1ccccc1CN(C)C(=O)CSC1CCC1	ZINC000450989266	CF	On-Demand	Anodyne	QRFPR	44	39
COc1ccccc1CN(C)C(=O)CSC1CCC1	ZINC000450989266	CF	On-Demand	Anodyne	MBTPS1	43	36
CCOc1ncccc1NS(=O)(=O)c1cc(C)cs1	ZINC000450989276	CF	On-Demand	Anodyne	NFKBIA	0	42
CCCNC(=O)c1ccc(Cl)cc1NS(=O)(=O)CCCCF	ZINC000450989279	FF	On-Demand	Anodyne	SLC6A9	48	36
Cc1ccncc1S(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450989289	FF	On-Demand	Anodyne	ADORA2B	51	43
COC(=O)c1cc(C)ccc1NS(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450989290	FG	On-Demand	Anodyne	PRTN3	44	32
C=CCOc1ccc(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)cc1	ZINC000450989324	GJ	On-Demand	Mild	ETHR	52	34
CCCC(=O)Nc1cccc(NS(=O)(=O)CCCCF)c1	ZINC000450989334	DF	On-Demand	Anodyne	F2R	0	51
O=C(CSC1CCC1)Nc1ccc(F)c(F)c1	ZINC000450989356	CG	On-Demand	Anodyne	ENV	42	34
O=C(CSC1CCC1)Nc1ccc(F)c(F)c1	ZINC000450989356	CG	On-Demand	Anodyne	QRFPR	44	39
COc1ccc(CN(C)C(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1F	ZINC000450989360	GD	On-Demand	Anodyne	AVPR1B	43	30
COc1ccc(CN(C)C(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1F	ZINC000450989362	GD	On-Demand	Anodyne	AVPR1B	43	30
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCSc3ccccc32)cc1	ZINC000450989378	GH	On-Demand	Anodyne	KCNA5	18	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCSc3ccccc32)cc1	ZINC000450989380	GH	On-Demand	Anodyne	KCNA5	18	42
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc3n[nH]cc3c2)c(OC)c1	ZINC000450989387	GF	On-Demand	Anodyne	PDGFRB	30	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2ccc3n[nH]cc3c2)c(OC)c1	ZINC000450989387	GF	On-Demand	Anodyne	MTNR1A	40	38
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc3n[nH]cc3c2)c(OC)c1	ZINC000450989388	GF	On-Demand	Anodyne	PDGFRB	30	41
COc1ccc(CNC(=O)CCN[C@H](C)c2ccc3n[nH]cc3c2)c(OC)c1	ZINC000450989388	GF	On-Demand	Anodyne	MTNR1A	40	38
COc1ccc(CCSC2CCC2)cc1	ZINC000450989394	BH	On-Demand	Anodyne	SLC18A2	44	50
C[C@@H](SC1CCC1)C(=O)Nc1ccc(Cl)cc1	ZINC000450989401	CH	On-Demand	Anodyne	GUAB	0	41
C[C@H](SC1CCC1)C(=O)Nc1ccc(Cl)cc1	ZINC000450989402	CH	On-Demand	Anodyne	GUAB	0	41
COc1cc(OC)c(OC)cc1CNS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450989409	GG	On-Demand	Anodyne	GLMU	0	43
O=S(=O)(CCC1CCCC1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000450989417	GF	On-Demand	Anodyne	NPY2R	50	39
O=C(CSC1CCC1)Nc1nc2ccc(F)cc2s1	ZINC000450989421	CH	On-Demand	Anodyne	CSNK1D	42	55
O=C(CSC1CCC1)Nc1nc2ccc(F)cc2s1	ZINC000450989421	CH	On-Demand	Anodyne	HSD17B1	0	41
O=C(CSC1CCC1)Nc1nc2ccc(F)cc2s1	ZINC000450989421	CH	On-Demand	Anodyne	CDK5	42	45
O=C(CSC1CCC1)Nc1nc2ccc(F)cc2s1	ZINC000450989421	CH	On-Demand	Anodyne	FABK	0	45
O=C(CSC1CCC1)Nc1nc2ccc(F)cc2s1	ZINC000450989421	CH	On-Demand	Anodyne	PORCN	0	46
CC1(S(=O)(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450989422	DG	On-Demand	Anodyne	SCN9A	0	41
CC1(S(=O)(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450989423	DG	On-Demand	Anodyne	SCN9A	0	41
CCCNC(=O)CNS(=O)(=O)CCC1CCCC1	ZINC000450989443	CD	On-Demand	Anodyne	BMP1	17	40
C[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989453	BG	On-Demand	Anodyne	SLC18A2	17	40
C[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989453	BG	On-Demand	Anodyne	SDH1	0	43
C[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989453	BG	On-Demand	Anodyne	KCNA5	0	40
C[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989453	BG	On-Demand	Anodyne	PRCP	15	45
C[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989453	BG	On-Demand	Anodyne	PROTEASE	0	44
C[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989453	BG	On-Demand	Anodyne	XIAP	55	36
C[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989453	BG	On-Demand	Anodyne	BIRC8	53	34
C[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989454	BG	On-Demand	Anodyne	SLC18A2	17	40
C[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989454	BG	On-Demand	Anodyne	SDH1	0	43
C[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989454	BG	On-Demand	Anodyne	KCNA5	0	40
C[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989454	BG	On-Demand	Anodyne	PRCP	15	45
C[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989454	BG	On-Demand	Anodyne	PROTEASE	0	44
C[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989454	BG	On-Demand	Anodyne	XIAP	55	36
C[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450989454	BG	On-Demand	Anodyne	BIRC8	53	34
COc1ccc([N+](=O)[O-])cc1CSC1CCC1	ZINC000450989456	CG	On-Demand	Bother	GNRHR	0	46
COc1ccc([N+](=O)[O-])cc1CSC1CCC1	ZINC000450989456	CG	On-Demand	Bother	QRFPR	58	48
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc2c(c1)OCO2	ZINC000450989457	FD	On-Demand	Anodyne	EDNRB	56	39
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc2c(c1)OCO2	ZINC000450989457	FD	On-Demand	Anodyne	BMP1	108	49
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1ccc2c(c1)OCO2	ZINC000450989457	FD	On-Demand	Anodyne	NOS2	87	34
CCOC(=O)c1cnc(C)c(NS(=O)(=O)Cc2c(C)cccc2C)c1	ZINC000450989461	FG	On-Demand	Anodyne	P2RY12	26	40
CC(=O)c1ccc(CN2CCCC[C@H]2c2nc(C)no2)cc1	ZINC000450989465	CG	On-Demand	Anodyne	COLA	92	44
CC(=O)c1ccc(CN2CCCC[C@H]2c2nc(C)no2)cc1	ZINC000450989465	CG	On-Demand	Anodyne	GRM5	0	42
CC(=O)c1ccc(CN2CCCC[C@@H]2c2nc(C)no2)cc1	ZINC000450989466	CG	On-Demand	Anodyne	COLA	92	44
CC(=O)c1ccc(CN2CCCC[C@@H]2c2nc(C)no2)cc1	ZINC000450989466	CG	On-Demand	Anodyne	GRM5	0	42
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ncccc2F)cc1	ZINC000450989473	GD	On-Demand	Anodyne	MTNN	73	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	CA2	19	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	ADRB2	18	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	ADRB1	24	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	ADRB3	17	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	TBXA2R	53	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	TBXAS1	26	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	KCNA5	0	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	MMP13	44	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	ADAM17	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	GUAB	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	MMP2	37	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	MMP3	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	MMP14	22	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	MMP9	30	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	CA12	26	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	MMP7	27	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	ADAMTS4	54	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	CA9	25	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	MMP1	19	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	LEF	40	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	IDO1	32	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	PFK	0	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	MTCA1	15	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000450989475	GG	On-Demand	Anodyne	P96878_MYCTU	18	43
Cc1cccc(OCCNS(=O)(=O)c2cnccc2C)c1	ZINC000450989478	DE	On-Demand	Anodyne	Q95J97_RABIT	0	41
COC(=O)c1ccc(CN2CCC[C@@H]2C(F)F)cc1Cl	ZINC000450989479	DG	On-Demand	Anodyne	OPRK1	27	41
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989484	GD	On-Demand	Anodyne	ADRB3	56	35
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989484	GD	On-Demand	Anodyne	KCNA5	54	37
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989484	GD	On-Demand	Anodyne	ADAMTS4	56	36
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989484	GD	On-Demand	Anodyne	NAMPT	19	41
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989484	GD	On-Demand	Anodyne	LUXN	0	42
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989485	GD	On-Demand	Anodyne	ADRB3	56	35
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989485	GD	On-Demand	Anodyne	KCNA5	54	37
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989485	GD	On-Demand	Anodyne	ADAMTS4	56	36
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989485	GD	On-Demand	Anodyne	NAMPT	19	41
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)c1cccnc1	ZINC000450989485	GD	On-Demand	Anodyne	LUXN	0	42
CC(C)(C)N(Cc1ccccc1)C(=O)CSC1CCC1	ZINC000450989493	CI	On-Demand	Anodyne	AMY2	43	30
O=C(CSC1CCC1)Nc1ccc2c(c1)OCCO2	ZINC000450989494	CF	On-Demand	Anodyne	TRPV1	0	49
Cc1nc2ccccc2n1CCCNS(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450989506	GH	On-Demand	Anodyne	ALDH3A1	41	39
CC(C)(C)NC(=O)c1ccccc1NS(=O)(=O)c1cnc(O)s1	ZINC000450989516	FE	On-Demand	Anodyne	PRTN3	51	36
C[C@H](SC1CCC1)C(=O)NCc1ccccc1Cl	ZINC000450989518	CH	On-Demand	Anodyne	SLC6A11	0	40
C[C@H](SC1CCC1)C(=O)NCc1ccccc1Cl	ZINC000450989518	CH	On-Demand	Anodyne	SLC6A12	0	44
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1Cl	ZINC000450989519	CH	On-Demand	Anodyne	SLC6A11	0	40
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1Cl	ZINC000450989519	CH	On-Demand	Anodyne	SLC6A12	0	44
COc1ccc(OC)c([C@@H](C)NC(=O)CSC2CCC2)c1	ZINC000450989522	DG	On-Demand	Anodyne	MTNR1A	40	36
COc1ccc(OC)c([C@@H](C)NC(=O)CSC2CCC2)c1	ZINC000450989522	DG	On-Demand	Anodyne	QRFPR	46	38
COc1ccc(OC)c([C@H](C)NC(=O)CSC2CCC2)c1	ZINC000450989523	DG	On-Demand	Anodyne	MTNR1A	40	36
COc1ccc(OC)c([C@H](C)NC(=O)CSC2CCC2)c1	ZINC000450989523	DG	On-Demand	Anodyne	QRFPR	46	38
O=C(CSC1CCC1)Nc1ccccc1F	ZINC000450989537	BG	On-Demand	Anodyne	KCNQ2	42	38
O=C(CSC1CCC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000450989541	DH	On-Demand	Anodyne	EPHX2	77	53
O=C(CSC1CCC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000450989541	DH	On-Demand	Anodyne	MCHR2	25	41
Fc1ccccc1N1CCCN(Cc2cn(CC3CC3)nn2)CC1	ZINC000450989552	EF	On-Demand	Anodyne	DRD4	22	41
COc1ccc(OC)c(-c2csc(NC(=O)CSC3CCC3)n2)c1	ZINC000450989556	FI	On-Demand	Anodyne	KCNQ1	0	41
COc1ccc(OC)c(-c2csc(NC(=O)CSC3CCC3)n2)c1	ZINC000450989556	FI	On-Demand	Anodyne	QRFPR	45	38
COc1ccc(OC)c(-c2csc(NC(=O)CSC3CCC3)n2)c1	ZINC000450989556	FI	On-Demand	Anodyne	ENPP1	65	32
O=C(CSC1CCC1)Nc1ccc(Cl)cn1	ZINC000450989561	CF	On-Demand	Anodyne	F10	47	32
O=C(CSC1CCC1)Nc1ccc(Cl)cn1	ZINC000450989561	CF	On-Demand	Anodyne	GCK	18	40
COC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450989568	CF	On-Demand	Anodyne	CCR3	25	40
COC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450989568	CF	On-Demand	Anodyne	HIF1A	26	48
COC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450989568	CF	On-Demand	Anodyne	QRFPR	48	44
COC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450989568	CF	On-Demand	Anodyne	ENPP1	40	30
COC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450989568	CF	On-Demand	Anodyne	KCNK3	58	35
COC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450989568	CF	On-Demand	Anodyne	KCNK9	43	33
COC(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450989568	CF	On-Demand	Anodyne	PARP10	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)cc1	ZINC000450989575	GF	On-Demand	Anodyne	BMP1	124	56
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)cc1	ZINC000450989575	GF	On-Demand	Anodyne	MMP8	23	45
COc1ccccc1Oc1ccc(NS(=O)(=O)CCCCF)cc1F	ZINC000450989581	FI	On-Demand	Anodyne	MET	35	40
CC(=O)c1cccc(S(=O)(=O)N2CCN(C(=O)CSC3CCC3)CC2)c1	ZINC000450989614	GE	On-Demand	Anodyne	AKR1C3	62	40
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](CC)c2ccc(OC)cc2)cc1	ZINC000450989617	GG	On-Demand	Anodyne	BMP1	44	36
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](CC)c2ccc(OC)cc2)cc1	ZINC000450989620	GG	On-Demand	Anodyne	BMP1	44	36
Cc1cc(C)c(NS(=O)(=O)Cc2c(C)cccc2C)c(C)c1	ZINC000450989630	DI	On-Demand	Anodyne	FFAR4	34	49
Cc1cc(C)c(NS(=O)(=O)Cc2c(C)cccc2C)c(C)c1	ZINC000450989630	DI	On-Demand	Anodyne	RAPGEF4	41	33
O=C(CSC1CCC1)NCCOc1ccc(Cl)cc1	ZINC000450989632	CG	On-Demand	Anodyne	CVIR	0	41
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC(C)C)CC3)ccc2c1	ZINC000450989633	GD	On-Demand	Anodyne	F2	18	45
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC(C)C)CC3)ccc2c1	ZINC000450989633	GD	On-Demand	Anodyne	AVPR1B	40	33
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC(C)C)CC3)ccc2c1	ZINC000450989633	GD	On-Demand	Anodyne	TRY2_BOVIN	63	45
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC(C)C)CC3)ccc2c1	ZINC000450989633	GD	On-Demand	Anodyne	PKM	34	40
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC(C)C)CC3)ccc2c1	ZINC000450989633	GD	On-Demand	Anodyne	TGM2	57	38
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC(C)C)CC3)ccc2c1	ZINC000450989633	GD	On-Demand	Anodyne	F13A1	71	38
Cc1noc([C@H]2CCCCN2CC/C=C\c2ccccc2)n1	ZINC000450989636	CI	On-Demand	Anodyne	COLA	94	43
Cc1noc([C@H]2CCCCN2CC/C=C\c2ccccc2)n1	ZINC000450989636	CI	On-Demand	Anodyne	CPT1A	76	42
Cc1noc([C@@H]2CCCCN2CC/C=C\c2ccccc2)n1	ZINC000450989642	CI	On-Demand	Anodyne	COLA	94	43
Cc1noc([C@@H]2CCCCN2CC/C=C\c2ccccc2)n1	ZINC000450989642	CI	On-Demand	Anodyne	CPT1A	76	42
Cc1noc([C@H]2CCCCN2CC/C=C/c2ccccc2)n1	ZINC000450989645	CI	On-Demand	Anodyne	COLA	94	43
Cc1noc([C@H]2CCCCN2CC/C=C/c2ccccc2)n1	ZINC000450989645	CI	On-Demand	Anodyne	CPT1A	76	42
Cc1noc([C@@H]2CCCCN2CC/C=C/c2ccccc2)n1	ZINC000450989648	CI	On-Demand	Anodyne	COLA	94	43
Cc1noc([C@@H]2CCCCN2CC/C=C/c2ccccc2)n1	ZINC000450989648	CI	On-Demand	Anodyne	CPT1A	76	42
C[C@H](CN1CCC(Oc2ccc(C#N)cc2F)CC1)S(C)(=O)=O	ZINC000450989654	ED	On-Demand	Mild	GPR119	32	43
C[C@@H](CN1CCC(Oc2ccc(C#N)cc2F)CC1)S(C)(=O)=O	ZINC000450989658	ED	On-Demand	Mild	GPR119	32	43
CCc1cc(CCCN2CCC[C@@H](Oc3ccccc3OC)C2)on1	ZINC000450989660	EH	On-Demand	Anodyne	DRD2	17	42
CCc1cc(CCCN2CCC[C@@H](Oc3ccccc3OC)C2)on1	ZINC000450989660	EH	On-Demand	Anodyne	DRD4	16	42
CCc1cc(CCCN2CCC[C@@H](Oc3ccccc3OC)C2)on1	ZINC000450989660	EH	On-Demand	Anodyne	DRD3	17	42
CCc1cc(CCCN2CCC[C@@H](Oc3ccccc3OC)C2)on1	ZINC000450989660	EH	On-Demand	Anodyne	SLC5A7	20	41
CCc1cc(CCCN2CCC[C@H](Oc3ccccc3OC)C2)on1	ZINC000450989662	EH	On-Demand	Anodyne	DRD2	17	42
CCc1cc(CCCN2CCC[C@H](Oc3ccccc3OC)C2)on1	ZINC000450989662	EH	On-Demand	Anodyne	DRD4	16	42
CCc1cc(CCCN2CCC[C@H](Oc3ccccc3OC)C2)on1	ZINC000450989662	EH	On-Demand	Anodyne	DRD3	17	42
CCc1cc(CCCN2CCC[C@H](Oc3ccccc3OC)C2)on1	ZINC000450989662	EH	On-Demand	Anodyne	SLC5A7	20	41
CCC(=O)CCCN1CCCN(c2ccccc2F)CC1	ZINC000450989664	CG	On-Demand	Anodyne	DRD1	41	46
CCC(=O)CCCN1CCCN(c2ccccc2F)CC1	ZINC000450989664	CG	On-Demand	Anodyne	SLC6A4	0	43
CCC(=O)CCCN1CCCN(c2ccccc2F)CC1	ZINC000450989664	CG	On-Demand	Anodyne	DRD3	0	41
CCC(=O)CCCN1CCCN(c2ccccc2F)CC1	ZINC000450989664	CG	On-Demand	Anodyne	CYP2J2	45	31
Nc1ncccc1CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450989678	FH	On-Demand	Anodyne	TRPV1	15	41
CN(CC(=O)Nc1ccccc1Cl)C(=O)CSC1CCC1	ZINC000450989679	EG	On-Demand	Anodyne	EPHB3	40	33
COc1cc(-c2noc(CN3CCCN(c4ccccc4F)CC3)n2)ncn1	ZINC000450989697	GE	On-Demand	Anodyne	DRD3	26	40
CNC(=O)CN(C)S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450989699	DD	On-Demand	Anodyne	MMP8	16	42
COc1ccc(NC(=O)CSC2CCC2)c(OC)c1	ZINC000450989706	CF	On-Demand	Anodyne	MTNR1A	47	38
COc1ccc(NC(=O)CSC2CCC2)c(OC)c1	ZINC000450989706	CF	On-Demand	Anodyne	QRFPR	48	40
COc1ccc(NC(=O)CSC2CCC2)c(OC)c1	ZINC000450989706	CF	On-Demand	Anodyne	ENPP1	40	30
COc1ccc(NC(=O)CSC2CCC2)c(OC)c1	ZINC000450989706	CF	On-Demand	Anodyne	ACAT	0	49
CCc1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450989709	CH	On-Demand	Anodyne	TIMP3	58	33
CCc1ccc(NC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450989710	CH	On-Demand	Anodyne	TIMP3	58	33
CO[C@H](CS(=O)(=O)Nc1ccccc1C(=O)NC(C)(C)C)c1ccccc1	ZINC000450989718	GG	On-Demand	Anodyne	PRTN3	50	38
CO[C@@H](CS(=O)(=O)Nc1ccccc1C(=O)NC(C)(C)C)c1ccccc1	ZINC000450989719	GG	On-Demand	Anodyne	PRTN3	50	38
CC1(S(=O)(=O)N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450989725	FF	On-Demand	Anodyne	ADORA2B	29	46
O=S(=O)(Nc1ccc(CN2CCOCC2)cc1)c1cc2cc(F)ccc2o1	ZINC000450989726	GG	On-Demand	Anodyne	GNRHR	15	41
COC(=O)C1(CN[C@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)CC1	ZINC000450989732	FF	On-Demand	Anodyne	SLC12A5	37	42
COC(=O)C1(CN[C@@]2(Cc3ccc(C(F)(F)F)cc3)CCOC2)CC1	ZINC000450989733	FF	On-Demand	Anodyne	SLC12A5	37	42
Cc1cccc2c1N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CC2	ZINC000450989743	FG	On-Demand	Anodyne	TGM2	54	41
Cc1cccc2c1N(S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)CC2	ZINC000450989743	FG	On-Demand	Anodyne	F13A1	84	41
CCOc1cc(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)on1	ZINC000450989749	FH	On-Demand	Anodyne	SMO	47	36
CCOc1cc(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)on1	ZINC000450989749	FH	On-Demand	Anodyne	ETHR	41	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN(C)c2ccccc2)cc1	ZINC000450989770	GG	On-Demand	Anodyne	CA2	19	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN(C)c2ccccc2)cc1	ZINC000450989770	GG	On-Demand	Anodyne	COLA	43	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN(C)c2ccccc2)cc1	ZINC000450989770	GG	On-Demand	Anodyne	MMP2	27	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN(C)c2ccccc2)cc1	ZINC000450989770	GG	On-Demand	Anodyne	MMP3	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN(C)c2ccccc2)cc1	ZINC000450989770	GG	On-Demand	Anodyne	CA9	15	46
Cc1cccc2nc(C3CCN(C(=O)CCc4ccc(C(N)=O)cc4)CC3)oc12	ZINC000450989771	GH	On-Demand	Anodyne	SMO	41	35
Cc1cccc2nc(C3CCN(C(=O)CCc4ccc(C(N)=O)cc4)CC3)oc12	ZINC000450989771	GH	On-Demand	Anodyne	ETHR	67	37
Oc1n[nH]c([C@H]2CCCCN2CCOc2ccc(Br)cc2)n1	ZINC000450989776	FF	On-Demand	Anodyne	COLA	46	38
Oc1n[nH]c([C@H]2CCCCN2CCOc2ccc(Br)cc2)n1	ZINC000450989776	FF	On-Demand	Anodyne	CPT1A	44	38
Oc1n[nH]c([C@@H]2CCCCN2CCOc2ccc(Br)cc2)n1	ZINC000450989777	FF	On-Demand	Anodyne	COLA	46	38
Oc1n[nH]c([C@@H]2CCCCN2CCOc2ccc(Br)cc2)n1	ZINC000450989777	FF	On-Demand	Anodyne	CPT1A	44	38
CNC(=O)c1ccc(CS(=O)(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1	ZINC000450989779	GD	On-Demand	Anodyne	CAPN2	44	31
CNC(=O)c1ccc(CS(=O)(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1	ZINC000450989779	GD	On-Demand	Anodyne	CTRB_BOVIN	44	31
CNC(=O)c1ccc(CS(=O)(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1	ZINC000450989779	GD	On-Demand	Anodyne	TMPRSS11D	50	35
CNC(=O)c1ccc(CS(=O)(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1	ZINC000450989780	GD	On-Demand	Anodyne	CAPN2	44	31
CNC(=O)c1ccc(CS(=O)(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1	ZINC000450989780	GD	On-Demand	Anodyne	CTRB_BOVIN	44	31
CNC(=O)c1ccc(CS(=O)(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1	ZINC000450989780	GD	On-Demand	Anodyne	TMPRSS11D	50	35
O=S(=O)(N[C@@H]1CCN(Cc2ccccc2)C1)c1sccc1Cl	ZINC000450989782	FF	On-Demand	Anodyne	DRD2	0	47
O=S(=O)(N[C@@H]1CCN(Cc2ccccc2)C1)c1sccc1Cl	ZINC000450989782	FF	On-Demand	Anodyne	DRD4	34	45
O=S(=O)(N[C@@H]1CCN(Cc2ccccc2)C1)c1sccc1Cl	ZINC000450989782	FF	On-Demand	Anodyne	DRD3	25	42
O=S(=O)(N[C@H]1CCN(Cc2ccccc2)C1)c1sccc1Cl	ZINC000450989783	FF	On-Demand	Anodyne	DRD2	0	47
O=S(=O)(N[C@H]1CCN(Cc2ccccc2)C1)c1sccc1Cl	ZINC000450989783	FF	On-Demand	Anodyne	DRD4	34	45
O=S(=O)(N[C@H]1CCN(Cc2ccccc2)C1)c1sccc1Cl	ZINC000450989783	FF	On-Demand	Anodyne	DRD3	25	42
CO[C@@H](Cc1ccccc1)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450989789	GI	On-Demand	Anodyne	SMO	47	37
CO[C@H](Cc1ccccc1)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450989790	GI	On-Demand	Anodyne	SMO	47	37
Cc1cccc2nc(C3CCN(C(=O)[C@@H]4CCC[C@H]4c4ccccc4)CC3)oc12	ZINC000450989791	GK	On-Demand	Anodyne	SMO	48	36
Cc1cccc2nc(C3CCN(C(=O)[C@@H]4CCC[C@@H]4c4ccccc4)CC3)oc12	ZINC000450989792	GK	On-Demand	Anodyne	SMO	48	36
Cc1cccc2nc(C3CCN(C(=O)[C@H]4CCC[C@@H]4c4ccccc4)CC3)oc12	ZINC000450989793	GK	On-Demand	Anodyne	SMO	48	36
Cc1cccc2nc(C3CCN(C(=O)[C@H]4CCC[C@H]4c4ccccc4)CC3)oc12	ZINC000450989794	GK	On-Demand	Anodyne	SMO	48	36
CS(=O)(=O)c1ccc2c(c1)CCCN2S(=O)(=O)c1sccc1Cl	ZINC000450989796	GF	On-Demand	Anodyne	CYP11B2	35	46
COC(=O)c1csc(CSC2CCC2)n1	ZINC000450989797	BF	On-Demand	Anodyne	QRFPR	40	34
CC(C)C(=O)N1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450989798	FE	On-Demand	Anodyne	TRY2_BOVIN	69	38
C[C@@H]1CCCCN(C(=O)c2nc3ccccc3nc2C2CC2)C1	ZINC000450989799	DH	On-Demand	Anodyne	TRPC6	43	30
C[C@H]1CCCCN(C(=O)c2nc3ccccc3nc2C2CC2)C1	ZINC000450989800	DH	On-Demand	Anodyne	TRPC6	43	30
CCOC(=O)c1sc(NS(=O)(=O)c2sccc2Cl)nc1C(C)C	ZINC000450989802	GH	On-Demand	Anodyne	DHODH	26	44
CC(C)OC[C@@H](O)CS(=O)(=O)c1cccc(Br)c1	ZINC000450989805	EE	On-Demand	Anodyne	AO-ACHE	0	42
CC(C)OC[C@H](O)CS(=O)(=O)c1cccc(Br)c1	ZINC000450989806	EE	On-Demand	Anodyne	AO-ACHE	0	42
COC(=O)c1ccc(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)cc1	ZINC000450989819	GH	On-Demand	Anodyne	SMO	47	37
COC(=O)c1ccc(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)cc1	ZINC000450989819	GH	On-Demand	Anodyne	ETHR	60	37
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1OC1CCCC1	ZINC000450989822	GF	On-Demand	Anodyne	PRTN3	50	31
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1OC1CCCC1	ZINC000450989822	GF	On-Demand	Anodyne	SCD	18	42
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N[C@H](C)c2cccnc2)c1	ZINC000450989833	FF	On-Demand	Anodyne	KCNA5	40	37
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N[C@@H](C)c2cccnc2)c1	ZINC000450989834	FF	On-Demand	Anodyne	KCNA5	40	37
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2C)c1	ZINC000450989849	GI	On-Demand	Anodyne	TRPC6	30	44
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2C)c1	ZINC000450989849	GI	On-Demand	Anodyne	TRPC3	32	44
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2C)c1	ZINC000450989850	GI	On-Demand	Anodyne	TRPC6	30	44
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2C)c1	ZINC000450989850	GI	On-Demand	Anodyne	TRPC3	32	44
CCOC(=O)c1ccc(CS(=O)(=O)Nc2ccc(C(F)(F)F)cn2)cc1	ZINC000450989851	GG	On-Demand	Anodyne	PPARD	18	40
CCOC(=O)c1ccc(CS(=O)(=O)Nc2ccc(C(F)(F)F)cn2)cc1	ZINC000450989851	GG	On-Demand	Anodyne	TRPM8	43	38
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000450989852	EI	On-Demand	Anodyne	MPL	44	47
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000450989852	EI	On-Demand	Anodyne	SPHK2	47	34
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000450989852	EI	On-Demand	Anodyne	SPHK1	41	34
CCOC(=O)c1cnc(C)c(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450989859	EF	On-Demand	Anodyne	P2RY12	25	40
C=Cc1ccc(S(=O)(=O)N2CCN(Cc3cccs3)CC2)cc1	ZINC000450989870	EF	On-Demand	Anodyne	TGM2	58	34
C=Cc1ccc(S(=O)(=O)N2CCN(Cc3cccs3)CC2)cc1	ZINC000450989870	EF	On-Demand	Anodyne	F13A1	77	39
CN(Cc1ccc(OC(F)F)cc1)C(=O)CSC1CCC1	ZINC000450989880	DH	On-Demand	Anodyne	SLC18A2	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC(F)F)cc2)cc1	ZINC000450989881	GG	On-Demand	Anodyne	CA2	22	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC(F)F)cc2)cc1	ZINC000450989881	GG	On-Demand	Anodyne	CA1	34	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC(F)F)cc2)cc1	ZINC000450989881	GG	On-Demand	Anodyne	CA14	17	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC(F)F)cc2)cc1	ZINC000450989881	GG	On-Demand	Anodyne	CA12	26	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC(F)F)cc2)cc1	ZINC000450989881	GG	On-Demand	Anodyne	ADAMTS4	53	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(OC(F)F)cc2)cc1	ZINC000450989881	GG	On-Demand	Anodyne	CA9	30	44
CSc1c[nH]nc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450989884	GD	On-Demand	Anodyne	LUXN	0	44
COc1ccc(CNC(=O)CCN(C)C[C@@H](C)OC)c(OC)c1	ZINC000450989894	DD	On-Demand	Anodyne	MTNR1A	59	45
COc1ccc(CNC(=O)CCN(C)C[C@H](C)OC)c(OC)c1	ZINC000450989895	DD	On-Demand	Anodyne	MTNR1A	59	45
COc1ccc(NC(=O)CSC2CCC2)c([N+](=O)[O-])c1	ZINC000450989896	CF	On-Demand	Bother	TAAR1	18	41
COc1ccc(NC(=O)CSC2CCC2)c([N+](=O)[O-])c1	ZINC000450989896	CF	On-Demand	Bother	AKR1C2	15	46
CO[C@H](C)CS(=O)(=O)Nc1n[nH]c(C)c1-c1ccc2c(c1)OCO2	ZINC000450989908	FD	On-Demand	Anodyne	HSP82	0	43
CO[C@@H](C)CS(=O)(=O)Nc1n[nH]c(C)c1-c1ccc2c(c1)OCO2	ZINC000450989909	FD	On-Demand	Anodyne	HSP82	0	43
Cc1ccncc1S(=O)(=O)NCCNC(=O)C1CC1	ZINC000450989917	CC	On-Demand	Anodyne	TBK1	49	32
C[C@H](SC1CCC1)C(=O)Nc1ccccc1	ZINC000450989918	BG	On-Demand	Anodyne	TIMP3	66	35
C[C@@H](SC1CCC1)C(=O)Nc1ccccc1	ZINC000450989919	BG	On-Demand	Anodyne	TIMP3	66	35
O=C(CSC1CCC1)Nc1ccc(N2CCCCC2)nc1	ZINC000450989924	DG	On-Demand	Anodyne	DGAT1	43	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CCc2ccco2)cc1	ZINC000450989929	FG	On-Demand	Anodyne	MMP2	16	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CCc2ccco2)cc1	ZINC000450989930	FG	On-Demand	Anodyne	MMP2	16	40
CCOC(=O)c1cn(C)nc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989933	GD	On-Demand	Anodyne	CA2	18	45
CCOC(=O)c1cn(C)nc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450989933	GD	On-Demand	Anodyne	CA1	24	42
C[C@@H](SC1CCC1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000450989940	DI	On-Demand	Anodyne	RBP4	66	37
C[C@H](SC1CCC1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000450989941	DI	On-Demand	Anodyne	RBP4	66	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@](C)(C#N)C(C)(C)C)cc1	ZINC000450989946	FF	On-Demand	Mild	CA2	15	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@](C)(C#N)C(C)(C)C)cc1	ZINC000450989946	FF	On-Demand	Mild	CA1	21	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@](C)(C#N)C(C)(C)C)cc1	ZINC000450989946	FF	On-Demand	Mild	MMP7	20	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@](C)(C#N)C(C)(C)C)cc1	ZINC000450989947	FF	On-Demand	Mild	CA2	15	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@](C)(C#N)C(C)(C)C)cc1	ZINC000450989947	FF	On-Demand	Mild	CA1	21	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@](C)(C#N)C(C)(C)C)cc1	ZINC000450989947	FF	On-Demand	Mild	MMP7	20	41
CCOC(=O)[C@H]1CCCCN1C(=O)CSC1CCC1	ZINC000450989948	CE	On-Demand	Anodyne	FKBP12.6	0	55
CCOC(=O)[C@@H]1CCCCN1C(=O)CSC1CCC1	ZINC000450989949	CE	On-Demand	Anodyne	FKBP12.6	0	55
CCOC1CC2(CCN(CCC(=O)NCc3ccc(OC)cc3OC)C2)C1	ZINC000450989957	GF	On-Demand	Anodyne	MTNR1A	42	39
CN(c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1cccc(C(=O)O)c1[N+](=O)[O-]	ZINC000450989958	GG	On-Demand	Bother	NR1H3	0	41
CC(C)C[C@H](NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450989960	GG	On-Demand	Anodyne	RORB	0	40
CC(C)C[C@@H](NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1)c1ccccc1	ZINC000450989961	GG	On-Demand	Anodyne	RORB	0	40
CC[C@H](SC1CCC1)C(=O)Nc1ccc(OC)cc1	ZINC000450989962	CH	On-Demand	Anodyne	MTNR1A	27	40
CC[C@@H](SC1CCC1)C(=O)Nc1ccc(OC)cc1	ZINC000450989963	CH	On-Demand	Anodyne	MTNR1A	27	40
COc1ccccc1O[C@H]1CCCN(CC[C@H](C)O)C1	ZINC000450989972	CE	On-Demand	Anodyne	HTR1A	26	41
COc1ccccc1O[C@H]1CCCN(CC[C@H](C)O)C1	ZINC000450989972	CE	On-Demand	Anodyne	SLC6A1	77	41
COc1ccccc1O[C@H]1CCCN(CC[C@H](C)O)C1	ZINC000450989972	CE	On-Demand	Anodyne	BIRC2	39	43
COc1ccccc1O[C@H]1CCCN(CC[C@@H](C)O)C1	ZINC000450989973	CE	On-Demand	Anodyne	HTR1A	26	41
COc1ccccc1O[C@H]1CCCN(CC[C@@H](C)O)C1	ZINC000450989973	CE	On-Demand	Anodyne	SLC6A1	77	41
COc1ccccc1O[C@H]1CCCN(CC[C@@H](C)O)C1	ZINC000450989973	CE	On-Demand	Anodyne	BIRC2	39	43
COc1ccccc1O[C@@H]1CCCN(CC[C@H](C)O)C1	ZINC000450989974	CE	On-Demand	Anodyne	HTR1A	26	41
COc1ccccc1O[C@@H]1CCCN(CC[C@H](C)O)C1	ZINC000450989974	CE	On-Demand	Anodyne	SLC6A1	77	41
COc1ccccc1O[C@@H]1CCCN(CC[C@H](C)O)C1	ZINC000450989974	CE	On-Demand	Anodyne	BIRC2	39	43
COc1ccccc1O[C@@H]1CCCN(CC[C@@H](C)O)C1	ZINC000450989975	CE	On-Demand	Anodyne	HTR1A	26	41
COc1ccccc1O[C@@H]1CCCN(CC[C@@H](C)O)C1	ZINC000450989975	CE	On-Demand	Anodyne	SLC6A1	77	41
COc1ccccc1O[C@@H]1CCCN(CC[C@@H](C)O)C1	ZINC000450989975	CE	On-Demand	Anodyne	BIRC2	39	43
O=C(CSC1CCC1)N1CCN(c2ccc(F)cc2)CC1	ZINC000450989979	DF	On-Demand	Anodyne	AKR1C3	0	49
NC(=O)c1cccc(CSC2CCC2)c1	ZINC000450989981	BF	On-Demand	Anodyne	KCNH2	40	39
NC(=O)c1cccc(CSC2CCC2)c1	ZINC000450989981	BF	On-Demand	Anodyne	MVFR	0	40
COC(=O)c1cc(OC)ccc1NS(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450989986	GF	On-Demand	Anodyne	AKR1C2	50	35
COC(=O)c1cc(OC)ccc1NS(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450989987	GF	On-Demand	Anodyne	AKR1C2	50	35
Cc1csc(S(=O)(=O)N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)c1	ZINC000450989998	GE	On-Demand	Anodyne	LPL	47	36
Cc1csc(S(=O)(=O)N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)c1	ZINC000450989998	GE	On-Demand	Anodyne	F13A1	64	39
c1cn(-c2ccc(CSC3CCC3)cc2)cn1	ZINC000450990006	BH	On-Demand	Anodyne	CYP2C19	18	41
O=C(CCCN1C[C@@H]2CCS(=O)(=O)[C@@H]2C1)c1ccccc1	ZINC000450990010	DD	On-Demand	Anodyne	CYP2J2	59	42
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3nc(C)ccc32)c1	ZINC000450990011	GF	On-Demand	Anodyne	COLA	36	41
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3nc(C)ccc32)c1	ZINC000450990011	GF	On-Demand	Anodyne	CPT1A	42	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3nc(C)ccc32)c1	ZINC000450990011	GF	On-Demand	Anodyne	CPT2	27	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3nc(C)ccc32)c1	ZINC000450990011	GF	On-Demand	Anodyne	CPT1B	41	37
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](COC(F)F)C1	ZINC000450990015	CF	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@H](COC(F)F)C1	ZINC000450990015	CF	On-Demand	Anodyne	SLC6A3	23	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](COC(F)F)C1	ZINC000450990016	CF	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H](COC(F)F)C1	ZINC000450990016	CF	On-Demand	Anodyne	SLC6A3	23	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](COC(F)F)C1	ZINC000450990017	CF	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@@H](COC(F)F)C1	ZINC000450990017	CF	On-Demand	Anodyne	SLC6A3	23	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](COC(F)F)C1	ZINC000450990018	CF	On-Demand	Anodyne	SLC6A1	0	41
C[C@H](c1ccccc1)[C@H](O)CN1CC[C@H](COC(F)F)C1	ZINC000450990018	CF	On-Demand	Anodyne	SLC6A3	23	41
COC(=O)c1sccc1NC(=O)CSC1CCC1	ZINC000450990019	CF	On-Demand	Anodyne	MAPK10	0	55
COC(=O)c1sccc1NC(=O)CSC1CCC1	ZINC000450990019	CF	On-Demand	Anodyne	QRFPR	40	35
COC(=O)c1sccc1NC(=O)CSC1CCC1	ZINC000450990019	CF	On-Demand	Anodyne	FAS	81	60
COCCOc1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450990023	FD	On-Demand	Anodyne	PRTN3	53	34
COCCOc1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450990023	FD	On-Demand	Anodyne	NFKBIA	0	40
Cc1cccc2nc(C3CCN(C(=O)[C@H]4CC4(F)F)CC3)oc12	ZINC000450990025	DG	On-Demand	Anodyne	SMO	41	36
Cc1cccc2nc(C3CCN(C(=O)[C@@H]4CC4(F)F)CC3)oc12	ZINC000450990026	DG	On-Demand	Anodyne	SMO	41	36
CCOc1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990029	GD	On-Demand	Anodyne	PRTN3	59	37
CCOc1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990029	GD	On-Demand	Anodyne	LUXN	0	45
CCOc1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990029	GD	On-Demand	Anodyne	ADIPOR1	0	41
CCOc1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990029	GD	On-Demand	Anodyne	ADIPOR2	0	41
CO[C@@H](CS(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1)c1ccccc1	ZINC000450990035	GG	On-Demand	Anodyne	F3	81	39
CO[C@@H](CS(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1)c1ccccc1	ZINC000450990035	GG	On-Demand	Anodyne	ITGAV	48	39
CO[C@@H](CS(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1)c1ccccc1	ZINC000450990035	GG	On-Demand	Anodyne	CYP24A1	30	42
CO[C@H](CS(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1)c1ccccc1	ZINC000450990036	GG	On-Demand	Anodyne	F3	81	39
CO[C@H](CS(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1)c1ccccc1	ZINC000450990036	GG	On-Demand	Anodyne	ITGAV	48	39
CO[C@H](CS(=O)(=O)Nc1ccc(C(=O)NCC(C)C)cc1)c1ccccc1	ZINC000450990036	GG	On-Demand	Anodyne	CYP24A1	30	42
CCOC(=O)c1sc(NS(=O)(=O)c2sccc2F)nc1C(C)C	ZINC000450990037	GG	On-Demand	Anodyne	DHODH	24	41
COC(=O)c1sccc1CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450990039	DE	On-Demand	Anodyne	COLA	37	41
COC(=O)c1sccc1CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450990039	DE	On-Demand	Anodyne	CPT1A	36	41
COC(=O)c1sccc1CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450990040	DE	On-Demand	Anodyne	COLA	37	41
COC(=O)c1sccc1CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450990040	DE	On-Demand	Anodyne	CPT1A	36	41
Cc1cccc(OCCCNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450990044	FD	On-Demand	Anodyne	HRH2	47	39
Cc1cccc(OCCCNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450990044	FD	On-Demand	Anodyne	COLA	88	40
Cc1cccc(OCCCNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)c1	ZINC000450990044	FD	On-Demand	Anodyne	CPT1A	77	40
Cc1cccc(OCCCNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450990045	FD	On-Demand	Anodyne	HRH2	47	39
Cc1cccc(OCCCNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450990045	FD	On-Demand	Anodyne	COLA	88	40
Cc1cccc(OCCCNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)c1	ZINC000450990045	FD	On-Demand	Anodyne	CPT1A	77	40
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	CASP3	45	33
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	MMP13	65	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	ADAM17	66	39
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	MMP3	65	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	MMP9	30	40
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	EPHX2	24	46
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	CASP7	50	33
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	MMP7	71	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	MMP1	72	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	LUXN	0	47
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	ADIPOR1	0	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990048	GF	On-Demand	Anodyne	ADIPOR2	0	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	CASP3	45	33
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	MMP13	65	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	ADAM17	66	39
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	MMP3	65	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	MMP9	30	40
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	EPHX2	24	46
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	CASP7	50	33
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	MMP7	71	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	MMP1	72	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	LUXN	0	47
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	ADIPOR1	0	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990049	GF	On-Demand	Anodyne	ADIPOR2	0	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	CASP3	45	33
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	MMP13	65	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	ADAM17	66	39
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	MMP3	65	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	MMP9	30	40
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	EPHX2	24	46
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	CASP7	50	33
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	MMP7	71	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	MMP1	72	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	LUXN	0	47
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	ADIPOR1	0	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1)NC1CC1	ZINC000450990050	GF	On-Demand	Anodyne	ADIPOR2	0	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	CASP3	45	33
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	MMP13	65	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	ADAM17	66	39
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	MMP3	65	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	MMP9	30	40
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	EPHX2	24	46
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	CASP7	50	33
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	MMP7	71	43
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	MMP1	72	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	LUXN	0	47
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	ADIPOR1	0	44
O=C(COc1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1)NC1CC1	ZINC000450990051	GF	On-Demand	Anodyne	ADIPOR2	0	44
CN(CCCOc1ccc(F)cc1)C(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450990057	GE	On-Demand	Anodyne	COLA	51	42
CN(CCCOc1ccc(F)cc1)C(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450990057	GE	On-Demand	Anodyne	CPT1A	49	40
CN(CCCOc1ccc(F)cc1)C(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450990058	GE	On-Demand	Anodyne	COLA	51	42
CN(CCCOc1ccc(F)cc1)C(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450990058	GE	On-Demand	Anodyne	CPT1A	49	40
COc1cc(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)ccc1Cl	ZINC000450990059	FG	On-Demand	Anodyne	DRD2	38	42
COc1cc(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)ccc1Cl	ZINC000450990059	FG	On-Demand	Anodyne	DRD4	42	39
COc1cc(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)ccc1Cl	ZINC000450990059	FG	On-Demand	Anodyne	DRD3	41	38
COc1cc(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)ccc1Cl	ZINC000450990060	FG	On-Demand	Anodyne	DRD2	38	42
COc1cc(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)ccc1Cl	ZINC000450990060	FG	On-Demand	Anodyne	DRD4	42	39
COc1cc(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)ccc1Cl	ZINC000450990060	FG	On-Demand	Anodyne	DRD3	41	38
CCC(=O)C1(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)CC1	ZINC000450990070	EH	On-Demand	Anodyne	SMO	44	36
Cc1cccc2nc(C3CCN(C(=O)c4ccc(C(C)(F)F)nc4)CC3)oc12	ZINC000450990076	GJ	On-Demand	Anodyne	ETHR	46	32
COc1ccnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450990087	GD	On-Demand	Anodyne	BRD4	0	41
COc1ccnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1	ZINC000450990087	GD	On-Demand	Anodyne	LUXN	0	47
CN1C[C@@H](CNC(=O)c2cncc(Cl)c2)Cc2ccccc21	ZINC000450990088	DF	On-Demand	Anodyne	SCN10A	39	41
CN1C[C@@H](CNC(=O)c2cncc(Cl)c2)Cc2ccccc21	ZINC000450990088	DF	On-Demand	Anodyne	CACNA1I	60	39
CN1C[C@H](CNC(=O)c2cncc(Cl)c2)Cc2ccccc21	ZINC000450990089	DF	On-Demand	Anodyne	SCN10A	39	41
CN1C[C@H](CNC(=O)c2cncc(Cl)c2)Cc2ccccc21	ZINC000450990089	DF	On-Demand	Anodyne	CACNA1I	60	39
CCCC(=O)Nc1nc2ccc(NS(=O)(=O)CCCCF)cc2s1	ZINC000450990090	FH	On-Demand	Anodyne	LDHA	40	36
CCCC(=O)Nc1nc2ccc(NS(=O)(=O)CCCCF)cc2s1	ZINC000450990090	FH	On-Demand	Anodyne	CSNK1D	38	42
N#CCCCOc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450990099	FI	On-Demand	Mild	GPR119	28	40
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	HTR1A	25	42
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	DRD2	37	41
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	DRD1	0	40
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	ADRA1A	20	40
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	DRD3	47	42
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	COLA	56	42
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	CPT1A	54	42
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	CPT2	40	34
COc1ccc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990104	GE	On-Demand	Anodyne	CACNA1I	46	36
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	HTR1A	25	42
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	DRD2	37	41
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	DRD1	0	40
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	ADRA1A	20	40
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	DRD3	47	42
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	COLA	56	42
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	CPT1A	54	42
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	CPT2	40	34
COc1ccc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)cc1S(C)(=O)=O	ZINC000450990105	GE	On-Demand	Anodyne	CACNA1I	46	36
COC(=O)CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990106	FE	On-Demand	Anodyne	CA2	15	49
COC(=O)CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990106	FE	On-Demand	Anodyne	CA1	19	42
COC(=O)CCCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990106	FE	On-Demand	Anodyne	CA14	16	42
CCOC(=O)CC1(S(=O)(=O)NC[C@H](Cc2ccccc2)N(C)C)CC1	ZINC000450990112	FD	On-Demand	Anodyne	TIMP3	63	35
CCOC(=O)CC1(S(=O)(=O)NC[C@@H](Cc2ccccc2)N(C)C)CC1	ZINC000450990113	FD	On-Demand	Anodyne	TIMP3	63	35
CC[C@@H]1C[C@H]1C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450990116	CE	On-Demand	Anodyne	TPP2	54	36
CC[C@@H]1C[C@H]1C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450990117	CE	On-Demand	Anodyne	TPP2	54	36
CC(C)OC(C)(C)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450990119	DF	On-Demand	Anodyne	TPP2	54	33
CC(C)OC(C)(C)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450990120	DF	On-Demand	Anodyne	TPP2	54	33
COc1ccc(OC)c(NC(=O)CSC2CCC2)c1	ZINC000450990126	CF	On-Demand	Anodyne	AKR1C2	44	33
COc1ccc(OC)c(NC(=O)CSC2CCC2)c1	ZINC000450990126	CF	On-Demand	Anodyne	QRFPR	50	42
COc1ccc(OC)c(NC(=O)CSC2CCC2)c1	ZINC000450990126	CF	On-Demand	Anodyne	ENPP1	51	31
O=C(CSC1CCC1)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000450990136	DI	On-Demand	Anodyne	QRFPR	46	40
O=C(CSC1CCC1)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000450990136	DI	On-Demand	Anodyne	ENPP1	48	29
O=C(COc1ccc(S(=O)(=O)NCCNC(=O)C2CC2)cc1)NC1CC1	ZINC000450990137	GC	On-Demand	Anodyne	LUXN	0	42
O=C(COc1ccc(S(=O)(=O)NCCNC(=O)C2CC2)cc1)NC1CC1	ZINC000450990137	GC	On-Demand	Anodyne	ADIPOR1	0	41
O=C(COc1ccc(S(=O)(=O)NCCNC(=O)C2CC2)cc1)NC1CC1	ZINC000450990137	GC	On-Demand	Anodyne	ADIPOR2	0	41
CCN(Cc1cccs1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450990142	EE	On-Demand	Anodyne	BMP1	33	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	OPRM1	54	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	OPRD1	46	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	OPRK1	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	MME	112	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	ANPEP	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	TACR1	34	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	PGC	49	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	CMA1	50	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	FCER2	76	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	CTSB	50	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	PAPA1_CARPA	58	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	TRY1_BOVIN	40	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	CYSP_TRYCR	55	54
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	CPA1	47	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	NPFFR2	53	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	TIMP3	71	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	CAPNS1	66	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	REN	61	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	REN1	41	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	PAM	0	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	CAPN1	91	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	MMP9	24	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	CAPN2	55	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	ACE2	88	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	FPR1	57	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	HDA106	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	SLC15A2	0	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	BLA1_STEMA	52	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	QRFPR	65	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	BRCA1	64	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990144	CF	On-Demand	Anodyne	NPFFR1	55	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	OPRM1	54	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	OPRD1	46	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	OPRK1	0	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	MME	112	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	ANPEP	62	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	TACR1	34	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	PGC	49	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	CMA1	50	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	FCER2	76	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	CTSB	50	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	PAPA1_CARPA	58	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	TRY1_BOVIN	40	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	CYSP_TRYCR	55	54
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	CPA1	47	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	NPFFR2	53	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	TIMP3	71	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	CAPNS1	66	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	REN	61	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	REN1	41	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	PAM	0	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	CAPN1	91	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	MMP9	24	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	CAPN2	55	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	ACE2	88	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	FPR1	57	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	HDA106	0	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	SLC15A2	0	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	BLA1_STEMA	52	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	QRFPR	65	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	BRCA1	64	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSC1CCC1	ZINC000450990145	CF	On-Demand	Anodyne	NPFFR1	55	32
Cc1cccc(C(C)C)c1NC(=O)CSC1CCC1	ZINC000450990158	CI	On-Demand	Anodyne	SOAT1	48	43
Cc1cccc(C(C)C)c1NC(=O)CSC1CCC1	ZINC000450990158	CI	On-Demand	Anodyne	ACAT	0	48
C[C@H](SC1CCC1)C(=O)N[C@H](C)c1ccccc1	ZINC000450990161	CH	On-Demand	Anodyne	SDH1	0	43
C[C@H](SC1CCC1)C(=O)N[C@H](C)c1ccccc1	ZINC000450990161	CH	On-Demand	Anodyne	PROTEASE	0	42
C[C@H](NC(=O)[C@@H](C)SC1CCC1)c1ccccc1	ZINC000450990162	CH	On-Demand	Anodyne	SDH1	0	43
C[C@H](NC(=O)[C@@H](C)SC1CCC1)c1ccccc1	ZINC000450990162	CH	On-Demand	Anodyne	PROTEASE	0	42
C[C@H](SC1CCC1)C(=O)N[C@@H](C)c1ccccc1	ZINC000450990163	CH	On-Demand	Anodyne	SDH1	0	43
C[C@H](SC1CCC1)C(=O)N[C@@H](C)c1ccccc1	ZINC000450990163	CH	On-Demand	Anodyne	PROTEASE	0	42
C[C@@H](SC1CCC1)C(=O)N[C@H](C)c1ccccc1	ZINC000450990164	CH	On-Demand	Anodyne	SDH1	0	43
C[C@@H](SC1CCC1)C(=O)N[C@H](C)c1ccccc1	ZINC000450990164	CH	On-Demand	Anodyne	PROTEASE	0	42
COc1ccc(OC)c(NC(=O)[C@H](C)SC2CCC2)c1	ZINC000450990165	CG	On-Demand	Anodyne	AKR1C2	40	33
COc1ccc(OC)c(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450990166	CG	On-Demand	Anodyne	AKR1C2	40	33
CC(=O)c1ccc(CN(C)CCCN(C)Cc2ccco2)cc1	ZINC000450990183	DG	On-Demand	Anodyne	LTA4H	24	41
CC(=O)c1ccccc1OCCSC1CCC1	ZINC000450990185	CH	On-Demand	Anodyne	HCN4	41	33
Cc1cccc(OCCNS(=O)(=O)CCOCc2ccccc2)c1	ZINC000450990186	EF	On-Demand	Anodyne	DRD4	15	51
COC(=O)c1cc(NC(=O)CSC2CCC2)cc(C(=O)OC)c1	ZINC000450990195	EE	On-Demand	Anodyne	QRFPR	44	37
CC(C)c1cccc(C(C)C)c1NC(=O)CSC1CCC1	ZINC000450990199	DK	On-Demand	Anodyne	SOAT1	49	45
CC(C)c1cccc(C(C)C)c1NC(=O)CSC1CCC1	ZINC000450990199	DK	On-Demand	Anodyne	ACAT	0	51
O=C(CSC1CCC1)NCc1ccccc1	ZINC000450990209	BF	On-Demand	Anodyne	SIGMAR1	20	40
O=C(CSC1CCC1)NCc1ccccc1	ZINC000450990209	BF	On-Demand	Anodyne	PREP	38	42
O=C(CSC1CCC1)NCc1ccccc1	ZINC000450990209	BF	On-Demand	Anodyne	CACNA1G	43	41
O=C(CSC1CCC1)NCc1ccccc1	ZINC000450990209	BF	On-Demand	Anodyne	PDS	40	32
CC(C)NC(=O)CN1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450990214	GD	On-Demand	Anodyne	LPL	46	36
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	HTR1A	0	40
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	SSTR2	91	38
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	OPRM1	0	45
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MME	23	41
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	EDNRA	44	44
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	TACR1	30	52
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	NQO2	22	41
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	TACR2	46	44
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	CCKAR	83	48
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	BRS3	26	48
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	NMBR	69	34
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MC3R	54	32
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MC5R	43	31
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MTNR1A	25	41
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MMP2	23	41
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MMP8	32	41
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MMP14	69	38
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	GRPR	85	34
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	ECE1	53	40
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	SSTR3	49	42
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	CCKBR	67	44
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	GHSR	65	40
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	ALOX15	24	43
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MMP9	0	54
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MC1R	67	36
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	MMP1	23	40
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	NPR	35	41
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	SLC15A2	0	46
C[C@@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990220	DH	On-Demand	Anodyne	KISS1R	56	32
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	HTR1A	0	40
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	SSTR2	91	38
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	OPRM1	0	45
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MME	23	41
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	EDNRA	44	44
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	TACR1	30	52
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	NQO2	22	41
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	TACR2	46	44
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	CCKAR	83	48
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	BRS3	26	48
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	NMBR	69	34
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MC3R	54	32
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MC5R	43	31
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MTNR1A	25	41
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MMP2	23	41
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MMP8	32	41
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MMP14	69	38
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	GRPR	85	34
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	ECE1	53	40
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	SSTR3	49	42
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	CCKBR	67	44
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	GHSR	65	40
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	ALOX15	24	43
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MMP9	0	54
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MC1R	67	36
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	MMP1	23	40
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	NPR	35	41
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	SLC15A2	0	46
C[C@H](SC1CCC1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000450990222	DH	On-Demand	Anodyne	KISS1R	56	32
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990239	FG	On-Demand	Anodyne	CA1	16	40
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990239	FG	On-Demand	Anodyne	MMP13	32	41
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990239	FG	On-Demand	Anodyne	CA14	16	45
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990239	FG	On-Demand	Anodyne	MMP2	19	42
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990239	FG	On-Demand	Anodyne	MMP12	41	38
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990239	FG	On-Demand	Anodyne	LEF	44	33
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990240	FG	On-Demand	Anodyne	CA1	16	40
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990240	FG	On-Demand	Anodyne	MMP13	32	41
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990240	FG	On-Demand	Anodyne	CA14	16	45
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990240	FG	On-Demand	Anodyne	MMP2	19	42
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990240	FG	On-Demand	Anodyne	MMP12	41	38
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)o1	ZINC000450990240	FG	On-Demand	Anodyne	LEF	44	33
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000450990241	CG	On-Demand	Anodyne	XIAP	29	43
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000450990241	CG	On-Demand	Anodyne	BIRC3	58	43
C[C@@H](SC1CCC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000450990241	CG	On-Demand	Anodyne	BIRC2	27	43
C[C@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450990242	CG	On-Demand	Anodyne	XIAP	29	43
C[C@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450990242	CG	On-Demand	Anodyne	BIRC3	58	43
C[C@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450990242	CG	On-Demand	Anodyne	BIRC2	27	43
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450990243	CG	On-Demand	Anodyne	XIAP	29	43
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450990243	CG	On-Demand	Anodyne	BIRC3	58	43
C[C@@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450990243	CG	On-Demand	Anodyne	BIRC2	27	43
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000450990244	CG	On-Demand	Anodyne	XIAP	29	43
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000450990244	CG	On-Demand	Anodyne	BIRC3	58	43
C[C@H](SC1CCC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000450990244	CG	On-Demand	Anodyne	BIRC2	27	43
C[C@@H](SC1CCC1)C(=O)Nc1nc2ccccc2s1	ZINC000450990245	CH	On-Demand	Anodyne	CSNK1D	30	46
C[C@@H](SC1CCC1)C(=O)Nc1nc2ccccc2s1	ZINC000450990245	CH	On-Demand	Anodyne	TMPRSS6	45	34
C[C@H](SC1CCC1)C(=O)Nc1nc2ccccc2s1	ZINC000450990246	CH	On-Demand	Anodyne	CSNK1D	30	46
C[C@H](SC1CCC1)C(=O)Nc1nc2ccccc2s1	ZINC000450990246	CH	On-Demand	Anodyne	TMPRSS6	45	34
C[C@@H](SC1CCC1)C(=O)Nc1ccc(N2CCCC2=O)cc1	ZINC000450990248	DG	On-Demand	Anodyne	AKR1C3	25	45
C[C@H](SC1CCC1)C(=O)Nc1ccc(N2CCCC2=O)cc1	ZINC000450990249	DG	On-Demand	Anodyne	AKR1C3	25	45
CN(C(=O)CSC1CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000450990252	CF	On-Demand	Bother	SLC27A4	51	34
C[C@H](c1ccccc1)N(C)C(=O)CSC1CCC1	ZINC000450990261	CG	On-Demand	Anodyne	OPRK1	0	43
C[C@@H](c1ccccc1)N(C)C(=O)CSC1CCC1	ZINC000450990262	CG	On-Demand	Anodyne	OPRK1	0	43
CCOc1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450990268	CH	On-Demand	Anodyne	KCNQ2	42	33
CCOc1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450990268	CH	On-Demand	Anodyne	HCN1	46	36
CCOc1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450990268	CH	On-Demand	Anodyne	HCN4	46	36
CCOc1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450990269	CH	On-Demand	Anodyne	KCNQ2	42	33
CCOc1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450990269	CH	On-Demand	Anodyne	HCN1	46	36
CCOc1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450990269	CH	On-Demand	Anodyne	HCN4	46	36
Cc1ccncc1S(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450990273	FD	On-Demand	Anodyne	CA2	22	42
Cc1ccncc1S(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450990273	FD	On-Demand	Anodyne	CA14	23	40
Cc1ccncc1S(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450990274	FD	On-Demand	Anodyne	CA2	22	42
Cc1ccncc1S(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450990274	FD	On-Demand	Anodyne	CA14	23	40
Cc1cc(C)c(NS(=O)(=O)CCC2CCCC2)c(C)c1	ZINC000450990280	CH	On-Demand	Anodyne	FFAR4	32	45
C[C@@H](c1csnn1)N1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450990281	GI	On-Demand	Anodyne	MC4R	23	42
C[C@H](c1csnn1)N1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450990282	GI	On-Demand	Anodyne	MC4R	23	42
O=C(CSC1CCC1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000450990289	EG	On-Demand	Mild	CCR2	59	38
c1csc(-c2noc(CSC3CCC3)n2)c1	ZINC000450990301	CH	On-Demand	Anodyne	ETHR	32	44
CCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1sccc1F	ZINC000450990311	FG	On-Demand	Anodyne	PRTN3	48	34
CCOc1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450990330	CH	On-Demand	Anodyne	TIMP3	57	35
Oc1n[nH]c([C@@H]2CCCCN2Cc2csc(-c3ccc(F)cc3)n2)n1	ZINC000450990331	FH	On-Demand	Anodyne	COLA	23	45
Oc1n[nH]c([C@@H]2CCCCN2Cc2csc(-c3ccc(F)cc3)n2)n1	ZINC000450990331	FH	On-Demand	Anodyne	CPT1A	24	45
CCOc1ccc(NC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450990332	CH	On-Demand	Anodyne	TIMP3	57	35
Oc1n[nH]c([C@H]2CCCCN2Cc2csc(-c3ccc(F)cc3)n2)n1	ZINC000450990333	FH	On-Demand	Anodyne	COLA	23	45
Oc1n[nH]c([C@H]2CCCCN2Cc2csc(-c3ccc(F)cc3)n2)n1	ZINC000450990333	FH	On-Demand	Anodyne	CPT1A	24	45
COC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1Cl	ZINC000450990335	EG	On-Demand	Anodyne	DRD4	31	43
COC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1Cl	ZINC000450990335	EG	On-Demand	Anodyne	DRD3	0	44
COC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1Cl	ZINC000450990335	EG	On-Demand	Anodyne	OPRK1	22	40
COC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1Cl	ZINC000450990335	EG	On-Demand	Anodyne	SIGMAR1	34	45
COC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1Cl	ZINC000450990335	EG	On-Demand	Anodyne	CCR3	58	40
COC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1Cl	ZINC000450990335	EG	On-Demand	Anodyne	MLNR	40	32
COC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1Cl	ZINC000450990335	EG	On-Demand	Anodyne	MCHR1	34	42
COC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1Cl	ZINC000450990335	EG	On-Demand	Anodyne	CACNA1I	61	38
COC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1Cl	ZINC000450990337	EG	On-Demand	Anodyne	DRD4	31	43
COC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1Cl	ZINC000450990337	EG	On-Demand	Anodyne	DRD3	0	44
COC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1Cl	ZINC000450990337	EG	On-Demand	Anodyne	OPRK1	22	40
COC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1Cl	ZINC000450990337	EG	On-Demand	Anodyne	SIGMAR1	34	45
COC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1Cl	ZINC000450990337	EG	On-Demand	Anodyne	CCR3	58	40
COC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1Cl	ZINC000450990337	EG	On-Demand	Anodyne	MLNR	40	32
COC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1Cl	ZINC000450990337	EG	On-Demand	Anodyne	MCHR1	34	42
COC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1Cl	ZINC000450990337	EG	On-Demand	Anodyne	CACNA1I	61	38
Cc1ccc(OCCCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1C	ZINC000450990348	EG	On-Demand	Anodyne	HTR3A	23	43
Cc1ccc(OCCCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1C	ZINC000450990348	EG	On-Demand	Anodyne	HRH3	28	41
Cc1ccc(OCCCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1C	ZINC000450990349	EG	On-Demand	Anodyne	HTR3A	23	43
Cc1ccc(OCCCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1C	ZINC000450990349	EG	On-Demand	Anodyne	HRH3	28	41
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCN1CC(C)(C)O	ZINC000450990372	GG	On-Demand	Anodyne	RBP4	92	39
CCSCc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450990373	GH	On-Demand	Anodyne	ADAMTS4	40	33
CCSCc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450990373	GH	On-Demand	Anodyne	PFK	0	41
N#C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C1CCCCC1	ZINC000450990376	GE	On-Demand	Mild	MMP13	27	43
N#C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C1CCCCC1	ZINC000450990376	GE	On-Demand	Mild	MMP2	23	43
N#C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C1CCCCC1	ZINC000450990376	GE	On-Demand	Mild	ADAMTS4	25	40
N#C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C1CCCCC1	ZINC000450990376	GE	On-Demand	Mild	LUXN	0	45
N#C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C1CCCCC1	ZINC000450990377	GE	On-Demand	Mild	MMP13	27	43
N#C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C1CCCCC1	ZINC000450990377	GE	On-Demand	Mild	MMP2	23	43
N#C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C1CCCCC1	ZINC000450990377	GE	On-Demand	Mild	ADAMTS4	25	40
N#C[C@H](NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C1CCCCC1	ZINC000450990377	GE	On-Demand	Mild	LUXN	0	45
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)c1	ZINC000450990378	FG	On-Demand	Anodyne	DRD4	43	36
COc1cccc([C@@H]2C[C@H]2C(=O)NC[C@H]2Cc3ccccc3N(C)C2)c1	ZINC000450990379	FG	On-Demand	Anodyne	DRD4	43	36
C[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450990381	DG	On-Demand	Anodyne	EPHX2	32	50
C[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450990381	DG	On-Demand	Anodyne	DPP7	35	41
C[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450990381	DG	On-Demand	Anodyne	MCHR1	25	44
C[C@@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450990381	DG	On-Demand	Anodyne	PRMT3	34	44
C[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450990382	DG	On-Demand	Anodyne	EPHX2	32	50
C[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450990382	DG	On-Demand	Anodyne	DPP7	35	41
C[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450990382	DG	On-Demand	Anodyne	MCHR1	25	44
C[C@H]1CCCCN(C(=O)CNC(=O)Nc2cccc(Cl)c2)C1	ZINC000450990382	DG	On-Demand	Anodyne	PRMT3	34	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990383	GH	On-Demand	Anodyne	TRPV1	64	32
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990383	GH	On-Demand	Anodyne	MMP2	19	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990383	GH	On-Demand	Anodyne	MMP12	40	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990383	GH	On-Demand	Anodyne	LEF	67	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990383	GH	On-Demand	Anodyne	IDO1	32	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990384	GH	On-Demand	Anodyne	TRPV1	64	32
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990384	GH	On-Demand	Anodyne	MMP2	19	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990384	GH	On-Demand	Anodyne	MMP12	40	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990384	GH	On-Demand	Anodyne	LEF	67	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(F)c(F)c2)cc1	ZINC000450990384	GH	On-Demand	Anodyne	IDO1	32	42
Cc1cccc(C(C)C)c1NS(=O)(=O)Cc1ccc(C(F)F)cc1	ZINC000450990395	FJ	On-Demand	Anodyne	ACAT	0	44
CSc1cccc(C(=O)N2CCN(CC(C)(C)O)[C@H](C)C2)c1	ZINC000450990403	DE	On-Demand	Anodyne	RHOA	0	40
CSc1cccc(C(=O)N2CCN(CC(C)(C)O)[C@@H](C)C2)c1	ZINC000450990404	DE	On-Demand	Anodyne	RHOA	0	40
CCOC(=O)c1cc(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)on1	ZINC000450990405	GG	On-Demand	Anodyne	SMO	47	36
C[C@H](NS(=O)(=O)C[C@H]1CCCC1(F)F)c1ccc(Br)cc1	ZINC000450990416	GH	On-Demand	Anodyne	SDH1	0	45
C[C@H](NS(=O)(=O)C[C@@H]1CCCC1(F)F)c1ccc(Br)cc1	ZINC000450990417	GH	On-Demand	Anodyne	SDH1	0	45
C[C@@H](NS(=O)(=O)C[C@@H]1CCCC1(F)F)c1ccc(Br)cc1	ZINC000450990418	GH	On-Demand	Anodyne	SDH1	0	45
C[C@@H](NS(=O)(=O)C[C@H]1CCCC1(F)F)c1ccc(Br)cc1	ZINC000450990419	GH	On-Demand	Anodyne	SDH1	0	45
C=CCC1(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)CCCC1	ZINC000450990420	FJ	On-Demand	Mild	SMO	40	39
CC(C)C(=O)NCCNS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450990424	EE	On-Demand	Anodyne	NQO2	25	43
CC(C)C(=O)NCCNS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450990424	EE	On-Demand	Anodyne	MTNR1A	22	43
CCN(C(=O)[C@@H](C)SC1CCC1)C1CCCCC1	ZINC000450990430	CH	On-Demand	Anodyne	ACE	26	47
CCN(C(=O)[C@H](C)SC1CCC1)C1CCCCC1	ZINC000450990431	CH	On-Demand	Anodyne	ACE	26	47
O=C(CCCSC1CCC1)c1ccc(F)cc1	ZINC000450990437	CI	On-Demand	Anodyne	DRD4	0	43
CN(Cc1ccc2c(c1)OCO2)S(=O)(=O)CCOCc1ccccc1	ZINC000450990451	FE	On-Demand	Anodyne	BMP1	64	49
CCN(Cc1cccs1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990456	FH	On-Demand	Anodyne	BMP1	72	42
CCN(Cc1cccs1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990456	FH	On-Demand	Anodyne	COLA	47	39
CCN(Cc1cccs1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990456	FH	On-Demand	Anodyne	CA5B	44	47
CCN(Cc1cccs1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990456	FH	On-Demand	Anodyne	CA5A	45	47
CN(Cc1ccc(F)cc1)C(=O)CSC1CCC1	ZINC000450990468	CG	On-Demand	Anodyne	HCRTR1	18	42
CN(Cc1ccc(F)cc1)C(=O)CSC1CCC1	ZINC000450990468	CG	On-Demand	Anodyne	HCRTR2	16	42
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cncc2F)c(OC)c1	ZINC000450990469	GF	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cncc2F)c(OC)c1	ZINC000450990469	GF	On-Demand	Anodyne	MTNR1A	54	38
COc1ccc(CNC(=O)CCN[C@H](C)c2c(F)cncc2F)c(OC)c1	ZINC000450990469	GF	On-Demand	Anodyne	MTNR1B	41	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cncc2F)c(OC)c1	ZINC000450990470	GF	On-Demand	Anodyne	GRIN2B	0	41
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cncc2F)c(OC)c1	ZINC000450990470	GF	On-Demand	Anodyne	MTNR1A	54	38
COc1ccc(CNC(=O)CCN[C@@H](C)c2c(F)cncc2F)c(OC)c1	ZINC000450990470	GF	On-Demand	Anodyne	MTNR1B	41	38
C=Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NC(C)C)CC2)cc1	ZINC000450990475	FD	On-Demand	Anodyne	ADORA2B	43	30
C=Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NC(C)C)CC2)cc1	ZINC000450990475	FD	On-Demand	Anodyne	TGM2	87	46
C=Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NC(C)C)CC2)cc1	ZINC000450990475	FD	On-Demand	Anodyne	F13A1	109	46
COc1cc(C(F)(F)F)cc(S(=O)(=O)N[C@@H](C)c2cccnc2)c1	ZINC000450990476	FG	On-Demand	Anodyne	CYP11B2	17	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)N[C@H](C)c2cccnc2)c1	ZINC000450990477	FG	On-Demand	Anodyne	CYP11B2	17	40
O=C(CSC1CCC1)Nc1ccc(I)cc1	ZINC000450990481	EH	On-Demand	Anodyne	QRFPR	42	35
CC[C@H]1CCC[C@H]1C(=O)N(C)CCNC(=O)[C@H]1CCC[C@H]1CC	ZINC000450990482	DG	On-Demand	Anodyne	ACE	15	40
CC[C@@H]1CCC[C@@H]1C(=O)NCCN(C)C(=O)[C@H]1CCC[C@H]1CC	ZINC000450990483	DG	On-Demand	Anodyne	ACE	15	40
CC[C@H]1CCC[C@@H]1C(=O)N(C)CCNC(=O)[C@H]1CCC[C@H]1CC	ZINC000450990484	DG	On-Demand	Anodyne	ACE	15	40
CC[C@@H]1CCC[C@@H]1C(=O)NCCN(C)C(=O)[C@@H]1CCC[C@H]1CC	ZINC000450990485	DG	On-Demand	Anodyne	ACE	15	40
Cc1ccc(NC(=O)CSC2CCC2)c(C)c1	ZINC000450990497	BH	On-Demand	Anodyne	FUCA1	19	48
COc1cc(CN[C@H](C)c2c(F)cncc2F)ccc1Cl	ZINC000450990504	DH	On-Demand	Anodyne	GRIN2B	0	41
COc1cc(CN[C@@H](C)c2c(F)cncc2F)ccc1Cl	ZINC000450990505	DH	On-Demand	Anodyne	GRIN2B	0	41
C[C@@H](SC1CCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000450990506	EI	On-Demand	Bother	AADAC	0	42
C[C@H](SC1CCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000450990507	EI	On-Demand	Bother	AADAC	0	42
O=C(COc1ccc(S(=O)(=O)Nc2noc(C3CC3)n2)cc1)NC1CC1	ZINC000450990508	GD	On-Demand	Anodyne	LUXN	0	42
CCOC(=O)CN(C(=O)CSC1CCC1)c1ccccc1	ZINC000450990510	DF	On-Demand	Anodyne	AMY2	45	32
CCCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n(C)n1	ZINC000450990526	FF	On-Demand	Anodyne	PFK	0	50
COC(=O)CCCCCNS(=O)(=O)CC1CC(F)(F)C1	ZINC000450990599	DD	On-Demand	Anodyne	EPHX2	0	43
Cc1[nH]c(C#N)cc1C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450990605	EH	On-Demand	Mild	FASN	43	38
Cc1cccc2nc(C3CCN(C(=O)C(C)(C)OC(C)C)CC3)oc12	ZINC000450990612	EI	On-Demand	Anodyne	SMO	43	39
COCCOc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450990615	EG	On-Demand	Anodyne	GPR119	26	42
COCCOc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450990615	EG	On-Demand	Anodyne	LIMK2	44	48
C[C@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450990628	DH	On-Demand	Anodyne	FKBP1A	45	36
C[C@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450990628	DH	On-Demand	Anodyne	SLC12A5	65	38
C[C@@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450990630	DH	On-Demand	Anodyne	FKBP1A	45	36
C[C@@H]1CCCCN(C(=O)C2(Cc3ccccc3)CCOCC2)C1	ZINC000450990630	DH	On-Demand	Anodyne	SLC12A5	65	38
O=C(CSC1CCC1)NCC1(c2ccccc2)CC1	ZINC000450990637	CG	On-Demand	Anodyne	ACAT	0	49
FC(F)OC[C@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450990642	EG	On-Demand	Anodyne	SIGMAR1	28	41
FC(F)OC[C@@H]1CCN(Cc2ccn(CCc3ccccc3)n2)C1	ZINC000450990643	EG	On-Demand	Anodyne	SIGMAR1	28	41
Oc1n[nH]c([C@@H]2CCCCN2C[C@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000450990648	FD	On-Demand	Anodyne	ACOX1	75	32
CNC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990652	EC	On-Demand	Anodyne	CA1	22	42
CNC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990652	EC	On-Demand	Anodyne	COLA	45	38
CNC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990652	EC	On-Demand	Anodyne	MMP8	27	41
O=C(CSC1CCC1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450990655	GD	On-Demand	Bother	F13A1	45	35
O=C(CSC1CCC1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000450990655	GD	On-Demand	Bother	AKR1C3	40	42
Oc1n[nH]c([C@H]2CCCCN2C[C@@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000450990660	FD	On-Demand	Anodyne	ACOX1	75	32
COc1ccc(CNC(=O)CCN2CC[C@@H](COC(F)F)C2)c(OC)c1	ZINC000450990661	FE	On-Demand	Anodyne	CACNA1I	51	32
COc1ccc(CNC(=O)CCN2CC[C@H](COC(F)F)C2)c(OC)c1	ZINC000450990662	FE	On-Demand	Anodyne	CACNA1I	51	32
Oc1n[nH]c([C@H]2CCCCN2C[C@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000450990666	FD	On-Demand	Anodyne	ACOX1	75	32
COC(=O)c1cccc(CN2CCN(CC(F)(F)F)C(=O)C2)c1Cl	ZINC000450990674	FE	On-Demand	Anodyne	P2RX7	35	40
Oc1n[nH]c([C@@H]2CCCCN2C[C@@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000450990675	FD	On-Demand	Anodyne	ACOX1	75	32
C[C@H](NS(=O)(=O)C[C@H]1CCCC1(F)F)c1cccc2ccccc12	ZINC000450990685	FI	On-Demand	Anodyne	CASR	28	42
C[C@@H](NS(=O)(=O)C[C@@H]1CCCC1(F)F)c1cccc2ccccc12	ZINC000450990686	FI	On-Demand	Anodyne	CASR	28	42
C[C@@H](NS(=O)(=O)C[C@H]1CCCC1(F)F)c1cccc2ccccc12	ZINC000450990687	FI	On-Demand	Anodyne	CASR	28	42
C[C@H](NS(=O)(=O)C[C@@H]1CCCC1(F)F)c1cccc2ccccc12	ZINC000450990688	FI	On-Demand	Anodyne	CASR	28	42
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)c2ccccc2C)cc1	ZINC000450990695	FG	On-Demand	Anodyne	TMPRSS11D	78	38
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C)c2ccccc2C)cc1	ZINC000450990696	FG	On-Demand	Anodyne	TMPRSS11D	78	38
CCNC(=O)c1ccc(Cl)cc1NS(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450990719	GG	On-Demand	Anodyne	CCKAR	0	40
CCNC(=O)c1ccc(Cl)cc1NS(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450990720	GG	On-Demand	Anodyne	CCKAR	0	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NC2(C(F)(F)F)CCOCC2)cc1	ZINC000450990721	GF	On-Demand	Anodyne	MMP13	28	40
Cc1noc([C@@H]2CCCCN2Cc2c(C)cccc2Cl)n1	ZINC000450990722	DI	On-Demand	Anodyne	COLA	56	38
Cc1noc([C@@H]2CCCCN2Cc2c(C)cccc2Cl)n1	ZINC000450990722	DI	On-Demand	Anodyne	CPT1A	55	38
Cc1noc([C@H]2CCCCN2Cc2c(C)cccc2Cl)n1	ZINC000450990723	DI	On-Demand	Anodyne	COLA	56	38
Cc1noc([C@H]2CCCCN2Cc2c(C)cccc2Cl)n1	ZINC000450990723	DI	On-Demand	Anodyne	CPT1A	55	38
COC(=O)c1ncccc1S(=O)(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000450990729	GD	On-Demand	Anodyne	CAPN2	43	29
COC(=O)c1ncccc1S(=O)(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000450990730	GD	On-Demand	Anodyne	CAPN2	43	29
CCCOc1ccc(C(=O)N2CCN(CC(C)(C)O)[C@@H](C)C2)c(OC)c1	ZINC000450990735	FE	On-Demand	Anodyne	OXTR	24	42
CCCOc1ccc(C(=O)N2CCN(CC(C)(C)O)[C@H](C)C2)c(OC)c1	ZINC000450990736	FE	On-Demand	Anodyne	OXTR	24	42
COC(=O)c1ccc(C)c(NC(=O)CSC2CCC2)c1	ZINC000450990743	CG	On-Demand	Anodyne	FAS	41	35
C[C@H](NC(=O)CSC1CCC1)c1ccccc1Cl	ZINC000450990744	CH	On-Demand	Anodyne	OPRL1	40	43
C[C@@H](NC(=O)CSC1CCC1)c1ccccc1Cl	ZINC000450990746	CH	On-Demand	Anodyne	OPRL1	44	43
CC(=O)c1ccc(CN2CCC[C@@H]2C(F)F)cc1	ZINC000450990747	CG	On-Demand	Anodyne	HRH3	0	40
O=S(=O)(CCCCF)Nc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000450990751	GG	On-Demand	Anodyne	MAOB	29	44
O=C(CSC1CCC1)N[C@H]1CCCc2ccccc21	ZINC000450990757	CG	On-Demand	Anodyne	BDKRB1	58	39
O=C(CSC1CCC1)N[C@H]1CCCc2ccccc21	ZINC000450990757	CG	On-Demand	Anodyne	XIAP	22	41
O=C(CSC1CCC1)N[C@H]1CCCc2ccccc21	ZINC000450990757	CG	On-Demand	Anodyne	BIRC3	28	40
O=C(CSC1CCC1)N[C@H]1CCCc2ccccc21	ZINC000450990757	CG	On-Demand	Anodyne	BIRC2	28	40
O=C(CSC1CCC1)N[C@@H]1CCCc2ccccc21	ZINC000450990758	CG	On-Demand	Anodyne	BDKRB1	58	39
O=C(CSC1CCC1)N[C@@H]1CCCc2ccccc21	ZINC000450990758	CG	On-Demand	Anodyne	XIAP	22	41
O=C(CSC1CCC1)N[C@@H]1CCCc2ccccc21	ZINC000450990758	CG	On-Demand	Anodyne	BIRC3	28	40
O=C(CSC1CCC1)N[C@@H]1CCCc2ccccc21	ZINC000450990758	CG	On-Demand	Anodyne	BIRC2	28	40
CCNC(=O)CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990762	EC	On-Demand	Anodyne	CA2	33	53
CCNC(=O)CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990762	EC	On-Demand	Anodyne	CA1	32	45
CCNC(=O)CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990762	EC	On-Demand	Anodyne	CA4	28	43
C[C@@H](SC1CCC1)C(=O)N1CCCc2ccccc21	ZINC000450990791	CH	On-Demand	Anodyne	AVPR2	39	42
CCC[C@@H]1CCC[C@@H]1C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450990794	FK	On-Demand	Anodyne	ETHR	45	32
C[C@H](SC1CCC1)C(=O)N1CCCc2ccccc21	ZINC000450990795	CH	On-Demand	Anodyne	AVPR2	39	42
CCC[C@H]1CCC[C@H]1C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450990796	FK	On-Demand	Anodyne	ETHR	45	32
CCC[C@@H]1CCC[C@H]1C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450990798	FK	On-Demand	Anodyne	ETHR	45	32
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990799	GC	On-Demand	Anodyne	MMP13	33	40
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990799	GC	On-Demand	Anodyne	ADAM17	17	40
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990799	GC	On-Demand	Anodyne	MMP9	16	40
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990799	GC	On-Demand	Anodyne	ADAMTS4	51	33
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990799	GC	On-Demand	Anodyne	LUXN	0	44
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990799	GC	On-Demand	Anodyne	ADIPOR1	0	40
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990799	GC	On-Demand	Anodyne	ADIPOR2	0	40
CCC[C@H]1CCC[C@@H]1C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450990800	FK	On-Demand	Anodyne	ETHR	45	32
C[C@H](NC(=O)CSC1CCC1)c1ccc(Cl)cc1	ZINC000450990801	CH	On-Demand	Anodyne	SDH1	0	48
C[C@H](NC(=O)CSC1CCC1)c1ccc(Cl)cc1	ZINC000450990801	CH	On-Demand	Anodyne	PRCP	24	51
C[C@H](NC(=O)CSC1CCC1)c1ccc(Cl)cc1	ZINC000450990801	CH	On-Demand	Anodyne	CCR1	42	40
C[C@@H](NC(=O)CSC1CCC1)c1ccc(Cl)cc1	ZINC000450990802	CH	On-Demand	Anodyne	SDH1	0	48
C[C@@H](NC(=O)CSC1CCC1)c1ccc(Cl)cc1	ZINC000450990802	CH	On-Demand	Anodyne	PRCP	24	51
C[C@@H](NC(=O)CSC1CCC1)c1ccc(Cl)cc1	ZINC000450990802	CH	On-Demand	Anodyne	CCR1	42	40
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCOc3ncc(C)cc32)c1	ZINC000450990807	GF	On-Demand	Anodyne	COLA	23	48
Cc1cccc(C(C)C)c1NS(=O)(=O)c1sccc1Cl	ZINC000450990808	EJ	On-Demand	Anodyne	ACAT	0	40
O=C(CSC1CCC1)Nc1ccc(C(F)(F)F)cc1	ZINC000450990822	CH	On-Demand	Anodyne	EPHX2	29	44
O=C(CSC1CCC1)Nc1ccc(C(F)(F)F)cc1	ZINC000450990822	CH	On-Demand	Anodyne	TRPM8	42	37
COc1ccc(-c2csc(NC(=O)CSC3CCC3)n2)c(OC)c1	ZINC000450990824	FI	On-Demand	Anodyne	KCNQ1	0	41
COc1ccc(-c2csc(NC(=O)CSC3CCC3)n2)c(OC)c1	ZINC000450990824	FI	On-Demand	Anodyne	QRFPR	43	36
CCc1cccc(C)c1NC(=O)CSC1CCC1	ZINC000450990826	CH	On-Demand	Anodyne	ACAT	0	40
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	ACE	56	35
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	MME	59	36
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	ANPEP	43	47
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	FCER2	23	40
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	TIMP3	57	41
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	CAPN1	22	40
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	PROC	64	36
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	POL	0	41
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	AMP1_PLAFQ	63	47
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	XIAP	24	42
C[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990828	BF	On-Demand	Anodyne	PDS	44	35
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	ACE	56	35
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	MME	59	36
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	ANPEP	43	47
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	FCER2	23	40
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	TIMP3	57	41
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	CAPN1	22	40
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	PROC	64	36
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	POL	0	41
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	AMP1_PLAFQ	63	47
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	XIAP	24	42
C[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450990829	BF	On-Demand	Anodyne	PDS	44	35
COC(=O)C1(CN2CCCC[C@@H]2c2nc(C)no2)CC1	ZINC000450990831	CD	On-Demand	Anodyne	CPT1A	47	39
COC(=O)C1(CN2CCCC[C@H]2c2nc(C)no2)CC1	ZINC000450990832	CD	On-Demand	Anodyne	COLA	63	39
COC(=O)C1(CN2CCCC[C@H]2c2nc(C)no2)CC1	ZINC000450990832	CD	On-Demand	Anodyne	CPT1A	50	39
COc1cc(CN(C)S(=O)(=O)C2(C)CC2)ccc1OCc1ccccc1	ZINC000450990839	GH	On-Demand	Anodyne	DRTS_PLAFK	25	44
COc1cc(CN(C)S(=O)(=O)C2(C)CC2)ccc1OCc1ccccc1	ZINC000450990839	GH	On-Demand	Anodyne	PTGER2	0	43
COc1cc(CN(C)S(=O)(=O)C2(C)CC2)ccc1OCc1ccccc1	ZINC000450990839	GH	On-Demand	Anodyne	PTGER4	17	43
Cc1cccc(F)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990840	GF	On-Demand	Anodyne	ADAM17	17	44
Cc1cccc(F)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990840	GF	On-Demand	Anodyne	PRTN3	45	33
Cc1cccc(F)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990840	GF	On-Demand	Anodyne	LUXN	0	50
Cc1cccc(F)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990840	GF	On-Demand	Anodyne	ADIPOR1	0	41
Cc1cccc(F)c1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990840	GF	On-Demand	Anodyne	ADIPOR2	0	41
COc1ccc(CN(C)C(=O)CSC2CCC2)cc1F	ZINC000450990850	CG	On-Demand	Anodyne	QRFPR	41	34
CN(Cc1cc(CN(C)C2(CO)CC2)cc(C(F)(F)F)c1)C1(CO)CC1	ZINC000450990851	FF	On-Demand	Anodyne	TACR1	23	41
CC[C@@H](C)Oc1cccc(NS(=O)(=O)c2cnc(O)s2)c1	ZINC000450990855	EF	On-Demand	Anodyne	GPR119	0	41
CC[C@H](C)Oc1cccc(NS(=O)(=O)c2cnc(O)s2)c1	ZINC000450990856	EF	On-Demand	Anodyne	GPR119	0	41
CCOC(=O)c1ccsc1NC(=O)CSC1CCC1	ZINC000450990865	CG	On-Demand	Anodyne	MAPK8	0	41
CCOC(=O)c1ccsc1NC(=O)CSC1CCC1	ZINC000450990865	CG	On-Demand	Anodyne	FAS	29	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(=O)Nc3ccccc32)cc1	ZINC000450990866	GF	On-Demand	Anodyne	TGM2	47	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(=O)Nc3ccccc32)cc1	ZINC000450990866	GF	On-Demand	Anodyne	F13A1	76	35
C[C@H]1CCC[C@@]1(C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450990879	DG	On-Demand	Anodyne	KCNQ1	0	41
C[C@@H]1CCC[C@]1(C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450990880	DG	On-Demand	Anodyne	KCNQ1	0	41
C[C@H]1CCC[C@]1(C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450990881	DG	On-Demand	Anodyne	KCNQ1	0	41
C[C@@H]1CCC[C@@]1(C)C(=O)NCc1noc(-c2cccc(F)c2)n1	ZINC000450990882	DG	On-Demand	Anodyne	KCNQ1	0	41
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	HTR1A	16	48
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	DRD4	22	45
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	HTR2A	24	48
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	HRH1	20	45
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	ADRA1B	16	45
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	DRD3	17	45
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	HTR7	21	42
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	SIGMAR1	17	42
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	CCR3	30	41
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	MCHR1	19	43
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	CYP2J2	58	41
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccccc3)CC2)c(F)c1	ZINC000450990883	FI	On-Demand	Mild	MEN1	46	39
CC[C@@]1(c2ccc(NS(=O)(=O)c3sccc3F)cc2)CCC(=O)NC1=O	ZINC000450990885	GF	On-Demand	Anodyne	MGAT1	45	32
CC[C@]1(c2ccc(NS(=O)(=O)c3sccc3F)cc2)CCC(=O)NC1=O	ZINC000450990886	GF	On-Demand	Anodyne	MGAT1	45	32
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	ZINC000450990891	FG	On-Demand	Anodyne	PRTN3	58	37
COCCN(CCOC)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450990896	FF	On-Demand	Anodyne	UTS2R	30	41
COCCN(CCOC)C1CCN(Cc2ccc(Cl)c(OC)c2)CC1	ZINC000450990896	FF	On-Demand	Anodyne	MCHR1	23	44
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	CA2	19	52
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	BMP1	108	42
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	CA1	27	52
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	KCNA5	31	48
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	CA7	15	46
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP13	82	50
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	ADAM17	20	41
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	CA14	18	46
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MTNR1B	18	42
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP2	64	52
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP3	55	50
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP8	44	52
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP14	22	43
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP9	52	52
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP12	60	49
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	CA12	27	46
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP7	41	49
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	ADAMTS4	53	37
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	CA9	28	46
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	MMP1	44	50
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	LEF	19	50
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	IDO1	33	48
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	P96878_MYCTU	24	41
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990898	GH	On-Demand	Anodyne	GPR88	0	40
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	CA2	19	52
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	BMP1	108	42
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	CA1	27	52
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	KCNA5	31	48
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	CA7	15	46
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP13	82	50
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	ADAM17	20	41
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	CA14	18	46
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MTNR1B	18	42
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP2	64	52
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP3	55	50
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP8	44	52
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP14	22	43
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP9	52	52
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP12	60	49
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	CA12	27	46
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP7	41	49
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	ADAMTS4	53	37
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	CA9	28	46
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	MMP1	44	50
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	LEF	19	50
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	IDO1	33	48
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	P96878_MYCTU	24	41
CC[C@@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)c1ccc(OC)cc1	ZINC000450990899	GH	On-Demand	Anodyne	GPR88	0	40
O=S(=O)(c1cnc(O)s1)N1CCCc2cc(OC(F)F)ccc21	ZINC000450990905	FF	On-Demand	Anodyne	CYP11B2	29	41
CC(C)C[C@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450990911	FF	On-Demand	Anodyne	COLA	51	39
CC(C)C[C@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450990911	FF	On-Demand	Anodyne	CPT1A	45	38
CC(C)C[C@@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450990912	FF	On-Demand	Anodyne	COLA	51	39
CC(C)C[C@@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450990912	FF	On-Demand	Anodyne	CPT1A	45	38
CC(C)C[C@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450990913	FF	On-Demand	Anodyne	COLA	51	39
CC(C)C[C@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450990913	FF	On-Demand	Anodyne	CPT1A	45	38
CC(C)C[C@@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450990914	FF	On-Demand	Anodyne	COLA	51	39
CC(C)C[C@@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450990914	FF	On-Demand	Anodyne	CPT1A	45	38
Cc1nc(C2CC2)ccc1C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450990915	EG	On-Demand	Anodyne	TPP2	43	32
Cc1nc(C2CC2)ccc1C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450990916	EG	On-Demand	Anodyne	TPP2	43	32
COc1ccc(CC(=O)NC[C@@H]2Cc3ccccc3N(C)C2)c(Cl)c1OC	ZINC000450990921	GG	On-Demand	Anodyne	DRD3	45	36
COc1ccc(CC(=O)NC[C@H]2Cc3ccccc3N(C)C2)c(Cl)c1OC	ZINC000450990922	GG	On-Demand	Anodyne	DRD3	45	36
CCCN(CCC)C(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450990923	GH	On-Demand	Anodyne	LIMK2	42	41
Cc1n[nH]cc1NS(=O)(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000450990924	FD	On-Demand	Anodyne	MTNN	81	41
CC(C)(C)[C@@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990938	GD	On-Demand	Mild	MMP13	27	43
CC(C)(C)[C@@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990938	GD	On-Demand	Mild	ADAM17	18	43
CC(C)(C)[C@@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990938	GD	On-Demand	Mild	PRTN3	44	31
CC(C)(C)[C@@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990938	GD	On-Demand	Mild	TRAR	32	40
CC(C)(C)[C@@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990938	GD	On-Demand	Mild	LUXN	0	50
CC(C)(C)[C@@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990938	GD	On-Demand	Mild	ADIPOR1	0	41
CC(C)(C)[C@@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990938	GD	On-Demand	Mild	ADIPOR2	0	41
COc1cc(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)ccc1Cl	ZINC000450990940	GJ	On-Demand	Anodyne	CCR1	26	41
COc1cc(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)ccc1Cl	ZINC000450990940	GJ	On-Demand	Anodyne	CCR3	18	41
CC(C)(C)[C@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990941	GD	On-Demand	Mild	MMP13	27	43
CC(C)(C)[C@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990941	GD	On-Demand	Mild	ADAM17	18	43
CC(C)(C)[C@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990941	GD	On-Demand	Mild	PRTN3	44	31
CC(C)(C)[C@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990941	GD	On-Demand	Mild	TRAR	32	40
CC(C)(C)[C@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990941	GD	On-Demand	Mild	LUXN	0	50
CC(C)(C)[C@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990941	GD	On-Demand	Mild	ADIPOR1	0	41
CC(C)(C)[C@](C)(C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450990941	GD	On-Demand	Mild	ADIPOR2	0	41
O=C(CSC1CCC1)NCc1ccccc1F	ZINC000450990942	CF	On-Demand	Anodyne	P2RX7	33	40
Cc1ccsc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990949	FG	On-Demand	Anodyne	BMP1	45	35
Cc1ccsc1CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450990949	FG	On-Demand	Anodyne	COLA	80	41
CCC[C@H](OC)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450990966	EH	On-Demand	Anodyne	SMO	41	36
O=C(CSC1CCC1)NCCc1ccc(F)cc1	ZINC000450990968	CF	On-Demand	Anodyne	GPBAR1	25	41
CN(CCN1CCC=C(c2ccncc2)C1)Cc1ccccc1	ZINC000450990973	DG	On-Demand	Anodyne	SIGMAR1	20	43
CCC[C@@H](OC)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450990977	EH	On-Demand	Anodyne	SMO	41	36
COC(=O)c1ccc(CSC2CCC2)o1	ZINC000450990981	BF	On-Demand	Anodyne	QRFPR	40	33
Cc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450990982	BG	On-Demand	Anodyne	CCKAR	33	43
Cc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450990982	BG	On-Demand	Anodyne	FUCA1	20	48
Cc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450990982	BG	On-Demand	Anodyne	CCKBR	39	43
Cc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450990982	BG	On-Demand	Anodyne	QRFPR	44	37
Cc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450990982	BG	On-Demand	Anodyne	KCNK3	60	42
Cc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450990982	BG	On-Demand	Anodyne	KCNK9	51	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc2c(ccn2CC(C)C)c1	ZINC000450990983	GG	On-Demand	Anodyne	NR1I2	53	36
COc1ccccc1O[C@H]1CCCN(CC2CCC(=O)CC2)C1	ZINC000450990990	DG	On-Demand	Anodyne	PDE3A	22	40
COc1ccccc1O[C@@H]1CCCN(CC2CCC(=O)CC2)C1	ZINC000450990992	DG	On-Demand	Anodyne	PDE3A	22	40
COc1ccc(Cl)cc1NC(=O)CSC1CCC1	ZINC000450990998	CH	On-Demand	Anodyne	CYSP_TRYCR	0	46
COc1ccc(Cl)cc1NC(=O)CSC1CCC1	ZINC000450990998	CH	On-Demand	Anodyne	CPT1A	46	32
COc1ccc(Cl)cc1NC(=O)CSC1CCC1	ZINC000450990998	CH	On-Demand	Anodyne	CPT2	42	33
COc1ccc(Cl)cc1NC(=O)CSC1CCC1	ZINC000450990998	CH	On-Demand	Anodyne	CPT1B	40	31
COc1ccc(Cl)cc1NC(=O)CSC1CCC1	ZINC000450990998	CH	On-Demand	Anodyne	RBP4	30	46
COc1ccc(Cl)cc1NC(=O)CSC1CCC1	ZINC000450990998	CH	On-Demand	Anodyne	QRFPR	59	49
COc1ccc(Cl)cc1NC(=O)CSC1CCC1	ZINC000450990998	CH	On-Demand	Anodyne	ENPP1	50	30
COc1ccc(Cl)cc1NC(=O)CSC1CCC1	ZINC000450990998	CH	On-Demand	Anodyne	FAS	22	42
Cc1ccc2nc(NC(=O)CSC3CCC3)sc2c1	ZINC000450991001	CH	On-Demand	Anodyne	LCK	31	48
Cc1ccc2nc(NC(=O)CSC3CCC3)sc2c1	ZINC000450991001	CH	On-Demand	Anodyne	CSNK1D	42	53
Cc1ccc2nc(NC(=O)CSC3CCC3)sc2c1	ZINC000450991001	CH	On-Demand	Anodyne	NMT1	30	41
Cc1ccc2nc(NC(=O)CSC3CCC3)sc2c1	ZINC000450991001	CH	On-Demand	Anodyne	CDK5	38	49
Cc1ccc2nc(NC(=O)CSC3CCC3)sc2c1	ZINC000450991001	CH	On-Demand	Anodyne	FABK	0	45
Cc1ccc2nc(NC(=O)CSC3CCC3)sc2c1	ZINC000450991001	CH	On-Demand	Anodyne	PORCN	0	47
COc1ccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991005	GD	On-Demand	Anodyne	HCRTR1	15	46
COc1ccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991005	GD	On-Demand	Anodyne	COLA	23	42
COc1ccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991005	GD	On-Demand	Anodyne	CPT1A	24	42
COc1ccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991005	GD	On-Demand	Anodyne	NOS2	23	46
COc1ccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991005	GD	On-Demand	Anodyne	ENPP1	49	31
COc1ccc(CNC(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991005	GD	On-Demand	Anodyne	DRTS_TRYCR	43	31
COc1ccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991007	GD	On-Demand	Anodyne	HCRTR1	15	46
COc1ccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991007	GD	On-Demand	Anodyne	COLA	23	42
COc1ccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991007	GD	On-Demand	Anodyne	CPT1A	24	42
COc1ccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991007	GD	On-Demand	Anodyne	NOS2	23	46
COc1ccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991007	GD	On-Demand	Anodyne	ENPP1	49	31
COc1ccc(CNC(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1OC	ZINC000450991007	GD	On-Demand	Anodyne	DRTS_TRYCR	43	31
COCCn1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)cn1	ZINC000450991009	GC	On-Demand	Anodyne	LUXN	0	40
CCOC(=O)c1ccsc1NS(=O)(=O)C[C@H](OC)c1ccccc1	ZINC000450991029	FG	On-Demand	Anodyne	FAS	20	42
CCOC(=O)c1ccsc1NS(=O)(=O)C[C@@H](OC)c1ccccc1	ZINC000450991031	FG	On-Demand	Anodyne	FAS	20	42
CCOC(=O)c1cc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)[nH]c1C	ZINC000450991038	FF	On-Demand	Anodyne	TPP2	52	32
CCOC(=O)c1cc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)[nH]c1C	ZINC000450991041	FF	On-Demand	Anodyne	TPP2	52	32
Cc1csc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991050	EF	On-Demand	Anodyne	DRD2	0	47
Cc1csc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991050	EF	On-Demand	Anodyne	DRD4	35	42
Cc1csc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991050	EF	On-Demand	Anodyne	ACHE	31	43
Cc1csc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991050	EF	On-Demand	Anodyne	DRD3	31	43
Cc1csc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991050	EF	On-Demand	Anodyne	SIGMAR1	51	43
Cc1csc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991050	EF	On-Demand	Anodyne	CCR3	27	46
Cc1csc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991050	EF	On-Demand	Anodyne	SFRP1	73	36
Cc1csc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991051	EF	On-Demand	Anodyne	DRD2	0	47
Cc1csc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991051	EF	On-Demand	Anodyne	DRD4	35	42
Cc1csc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991051	EF	On-Demand	Anodyne	ACHE	31	43
Cc1csc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991051	EF	On-Demand	Anodyne	DRD3	31	43
Cc1csc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991051	EF	On-Demand	Anodyne	SIGMAR1	51	43
Cc1csc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991051	EF	On-Demand	Anodyne	CCR3	27	46
Cc1csc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000450991051	EF	On-Demand	Anodyne	SFRP1	73	36
Cc1cc(C)cc(NC(=O)CSC2CCC2)c1	ZINC000450991056	BH	On-Demand	Anodyne	QRFPR	41	34
CCc1cccc(C(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)n1	ZINC000450991060	EI	On-Demand	Anodyne	SMO	47	37
C[C@@H](C(=O)NC1(C#N)CCC1)S(=O)(=O)c1cccc(Br)c1	ZINC000450991063	FE	On-Demand	Mild	CTSK	17	50
C[C@@H](C(=O)NC1(C#N)CCC1)S(=O)(=O)c1cccc(Br)c1	ZINC000450991063	FE	On-Demand	Mild	CTSS	35	50
CCCOc1cccc(CN2CC(C(=O)NC(CC)(CC)C(N)=O)C2)c1	ZINC000450991067	FE	On-Demand	Anodyne	HRH2	52	47
CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450991068	FH	On-Demand	Anodyne	COLA	36	40
CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450991068	FH	On-Demand	Anodyne	IDO1	0	40
CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450991068	FH	On-Demand	Anodyne	P96878_MYCTU	27	41
CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450991068	FH	On-Demand	Anodyne	RORC	22	42
CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450991068	FH	On-Demand	Anodyne	RORB	0	42
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991069	GD	On-Demand	Anodyne	BDKRB1	55	48
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991069	GD	On-Demand	Anodyne	MMP3	46	39
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991069	GD	On-Demand	Anodyne	CASP7	41	36
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991069	GD	On-Demand	Anodyne	MMP7	52	35
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991070	GD	On-Demand	Anodyne	BDKRB1	55	48
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991070	GD	On-Demand	Anodyne	MMP3	46	39
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991070	GD	On-Demand	Anodyne	CASP7	41	36
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991070	GD	On-Demand	Anodyne	MMP7	52	35
C[C@H](C(=O)NC1(C#N)CCC1)S(=O)(=O)c1cccc(Br)c1	ZINC000450991074	FE	On-Demand	Mild	CTSK	17	50
C[C@H](C(=O)NC1(C#N)CCC1)S(=O)(=O)c1cccc(Br)c1	ZINC000450991074	FE	On-Demand	Mild	CTSS	35	50
CC(C)NC(=O)CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450991075	GD	On-Demand	Anodyne	AVPR1B	49	33
CC(C)NC(=O)CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450991075	GD	On-Demand	Anodyne	TRY2_BOVIN	46	36
CC(C)NC(=O)CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450991075	GD	On-Demand	Anodyne	SLC27A1	44	32
CCC(CC)S(=O)(=O)c1cccc(Br)c1	ZINC000450991076	CG	On-Demand	Anodyne	Q9JN24_ECOLX	0	46
CCN(C(=O)CSC1CCC1)c1ccccc1	ZINC000450991100	BG	On-Demand	Anodyne	AMY2	45	33
CC(C)C(=O)NCCNS(=O)(=O)CCC1CCCC1	ZINC000450991115	CD	On-Demand	Anodyne	BMP1	47	38
CCc1cc(CC)c(S(=O)(=O)NCCNC(=O)C2CC2)c(CC)c1	ZINC000450991125	FE	On-Demand	Anodyne	MTNR1A	15	50
Cc1cccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450991126	GF	On-Demand	Anodyne	MTNR1B	25	44
Cc1cccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450991126	GF	On-Demand	Anodyne	ADAMTS4	49	37
Cc1cccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450991126	GF	On-Demand	Anodyne	LEF	42	35
Cc1cccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450991126	GF	On-Demand	Anodyne	IDO1	35	43
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450991130	GE	On-Demand	Anodyne	CCR8	55	33
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450991130	GE	On-Demand	Anodyne	SFRP1	59	35
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC[C@@H](O)C2)c1	ZINC000450991130	GE	On-Demand	Anodyne	WNT3	44	30
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC[C@H](O)C2)c1	ZINC000450991131	GE	On-Demand	Anodyne	CCR8	55	33
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC[C@H](O)C2)c1	ZINC000450991131	GE	On-Demand	Anodyne	SFRP1	59	35
Cc1csc(S(=O)(=O)Nc2ccccc2C(=O)N2CCC[C@H](O)C2)c1	ZINC000450991131	GE	On-Demand	Anodyne	WNT3	44	30
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1cc(C)cs1	ZINC000450991151	EF	On-Demand	Anodyne	BMP1	30	41
O=C(CSC1CCC1)NCCCc1ccccc1	ZINC000450991153	CG	On-Demand	Anodyne	SDH1	0	46
CCS(=O)(=O)c1ccc(CN2CCCC[C@H]2c2nc(C)no2)cc1	ZINC000450991158	EF	On-Demand	Anodyne	COLA	45	36
CCS(=O)(=O)c1ccc(CN2CCCC[C@@H]2c2nc(C)no2)cc1	ZINC000450991159	EF	On-Demand	Anodyne	COLA	45	36
CN(CCN1CCC[C@@H]1C(F)F)Cc1ccccc1	ZINC000450991165	CF	On-Demand	Anodyne	SIGMAR1	26	41
CNC(=O)c1ccc(CS(=O)(=O)NCCOc2cccc(C)c2)cc1	ZINC000450991166	FD	On-Demand	Anodyne	PLA2G4A	59	38
CNC(=O)CC[C@@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450991167	GE	On-Demand	Anodyne	ACKR3	65	32
CNC(=O)CC[C@H]1CCCCN1CCC(=O)NCc1ccc(OC)cc1OC	ZINC000450991168	GE	On-Demand	Anodyne	ACKR3	65	32
CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450991169	CJ	On-Demand	Anodyne	KCNQ2	50	38
CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450991169	CJ	On-Demand	Anodyne	ACAT	0	41
CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450991170	CJ	On-Demand	Anodyne	KCNQ2	50	38
CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450991170	CJ	On-Demand	Anodyne	ACAT	0	41
CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450991171	CJ	On-Demand	Anodyne	KCNQ2	50	38
CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450991171	CJ	On-Demand	Anodyne	ACAT	0	41
CC[C@H](C)c1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450991172	CJ	On-Demand	Anodyne	KCNQ2	50	38
CC[C@H](C)c1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450991172	CJ	On-Demand	Anodyne	ACAT	0	41
O=C(CSC1CCC1)Nc1ccc2c(c1)OCCCO2	ZINC000450991173	CG	On-Demand	Anodyne	QRFPR	44	36
CNC(=O)CC[C@H]1CCCCN1CCN(C)Cc1ccccc1	ZINC000450991174	DE	On-Demand	Anodyne	SLC18A2	34	40
CNC(=O)CC[C@@H]1CCCCN1CCN(C)Cc1ccccc1	ZINC000450991175	DE	On-Demand	Anodyne	SLC18A2	34	40
O=C(CSC1CCC1)NCC1CCCCC1	ZINC000450991182	BF	On-Demand	Anodyne	ADH4	0	44
CO[C@H](C)CN(C)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450991196	CE	On-Demand	Anodyne	AOC3	42	41
CO[C@H](C)CN(C)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450991197	CE	On-Demand	Anodyne	AOC3	42	41
CO[C@H](C)CN(C)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450991198	CE	On-Demand	Anodyne	AOC3	42	41
CO[C@H](C)CN(C)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450991199	CE	On-Demand	Anodyne	AOC3	42	41
Cc1csc(S(=O)(=O)N2CCN(CC(=O)NC(C)C)CC2)c1	ZINC000450991201	EC	On-Demand	Anodyne	LPL	42	34
Cc1csc(S(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)c1	ZINC000450991204	EF	On-Demand	Anodyne	BMP1	31	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(COC(C)C)cc1	ZINC000450991208	FF	On-Demand	Anodyne	ADRB2	41	40
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(COC(C)C)cc1	ZINC000450991208	FF	On-Demand	Anodyne	ADRB1	27	40
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(COC(C)C)cc1	ZINC000450991208	FF	On-Demand	Anodyne	ADRB3	42	37
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(COC(C)C)cc1	ZINC000450991208	FF	On-Demand	Anodyne	PTPRB	47	34
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(COC(C)C)cc1	ZINC000450991208	FF	On-Demand	Anodyne	ADAMTS4	40	36
O=C(CSC1CCC1)NC1CCCCC1	ZINC000450991226	BF	On-Demand	Anodyne	EPHX2	22	40
FC(F)OC[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450991229	CH	On-Demand	Anodyne	SLC6A3	18	46
FC(F)OC[C@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450991229	CH	On-Demand	Anodyne	SIGMAR1	18	46
FC(F)OC[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450991231	CH	On-Demand	Anodyne	SLC6A3	18	46
FC(F)OC[C@@H]1CCN(CC/C=C/c2ccccc2)C1	ZINC000450991231	CH	On-Demand	Anodyne	SIGMAR1	18	46
FC(F)OC[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450991232	CH	On-Demand	Anodyne	SLC6A3	18	46
FC(F)OC[C@@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450991232	CH	On-Demand	Anodyne	SIGMAR1	18	46
FC(F)OC[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450991234	CH	On-Demand	Anodyne	SLC6A3	18	46
FC(F)OC[C@H]1CCN(CC/C=C\c2ccccc2)C1	ZINC000450991234	CH	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CNC(=O)CSC1CCC1	ZINC000450991236	BF	On-Demand	Anodyne	P2RX7	37	43
Cc1ccsc1CN(C)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991238	GF	On-Demand	Anodyne	LUXN	0	41
O=C(CSC1CCC1)Nc1ccccc1C(F)(F)F	ZINC000450991251	CH	On-Demand	Anodyne	P2RX7	38	40
O=C(CSC1CCC1)Nc1ccccc1C(F)(F)F	ZINC000450991251	CH	On-Demand	Anodyne	RBP4	40	37
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H]2CCSc3ccccc32)cc1	ZINC000450991254	GH	On-Demand	Anodyne	PLG	61	36
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H]2CCSc3ccccc32)cc1	ZINC000450991254	GH	On-Demand	Anodyne	TRYP_PIG	49	33
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H]2CCSc3ccccc32)cc1	ZINC000450991256	GH	On-Demand	Anodyne	PLG	61	36
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H]2CCSc3ccccc32)cc1	ZINC000450991256	GH	On-Demand	Anodyne	TRYP_PIG	49	33
CCN(Cc1cccs1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991258	GF	On-Demand	Anodyne	BMP1	69	39
CCN(Cc1cccs1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991258	GF	On-Demand	Anodyne	LUXN	0	42
COc1ccc(CN(C)C(=O)[C@@H](C)SC2CCC2)cc1OC	ZINC000450991274	DG	On-Demand	Anodyne	MT-ND1	24	43
COc1ccc(CN(C)C(=O)[C@H](C)SC2CCC2)cc1OC	ZINC000450991275	DG	On-Demand	Anodyne	MT-ND1	24	43
CCCCOc1ccc(-c2nnc(CN3CCCC[C@H]3c3nc(O)n[nH]3)o2)cc1	ZINC000450991283	GG	On-Demand	Anodyne	COLA	51	36
CCCCOc1ccc(-c2nnc(CN3CCCC[C@H]3c3nc(O)n[nH]3)o2)cc1	ZINC000450991283	GG	On-Demand	Anodyne	CPT1A	50	36
CCCCOc1ccc(-c2nnc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)o2)cc1	ZINC000450991287	GG	On-Demand	Anodyne	COLA	51	36
CCCCOc1ccc(-c2nnc(CN3CCCC[C@@H]3c3nc(O)n[nH]3)o2)cc1	ZINC000450991287	GG	On-Demand	Anodyne	CPT1A	50	36
CC[C@H](C)Oc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)c(C)cc3c2)cc1	ZINC000450991289	GH	On-Demand	Anodyne	MGAT2	0	40
CC[C@H](C)Oc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)c(C)cc3c2)cc1	ZINC000450991289	GH	On-Demand	Anodyne	MGAT3	0	40
CC[C@H](C)Oc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)c(C)cc3c2)cc1	ZINC000450991289	GH	On-Demand	Anodyne	MGAT1	51	40
CC[C@@H](C)Oc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)c(C)cc3c2)cc1	ZINC000450991291	GH	On-Demand	Anodyne	MGAT2	0	40
CC[C@@H](C)Oc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)c(C)cc3c2)cc1	ZINC000450991291	GH	On-Demand	Anodyne	MGAT3	0	40
CC[C@@H](C)Oc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)c(C)cc3c2)cc1	ZINC000450991291	GH	On-Demand	Anodyne	MGAT1	51	40
CC[C@H](NS(=O)(=O)c1cccnc1C(=O)OC)c1ccc(OC)cc1	ZINC000450991294	FE	On-Demand	Anodyne	BMP1	57	34
CC[C@H](NS(=O)(=O)c1cccnc1C(=O)OC)c1ccc(OC)cc1	ZINC000450991294	FE	On-Demand	Anodyne	MMP2	25	41
CC[C@@H](NS(=O)(=O)c1cccnc1C(=O)OC)c1ccc(OC)cc1	ZINC000450991295	FE	On-Demand	Anodyne	BMP1	57	34
CC[C@@H](NS(=O)(=O)c1cccnc1C(=O)OC)c1ccc(OC)cc1	ZINC000450991295	FE	On-Demand	Anodyne	MMP2	25	41
O=C(CSC1CCC1)Nc1ccccc1N1CCCC1=O	ZINC000450991297	DG	On-Demand	Anodyne	KCNQ2	75	42
CCS(=O)(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1	ZINC000450991301	EF	On-Demand	Anodyne	SIGMAR1	19	40
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991302	GF	On-Demand	Anodyne	MMP13	43	40
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991302	GF	On-Demand	Anodyne	ADAMTS4	65	39
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991302	GF	On-Demand	Anodyne	LUXN	0	47
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991302	GF	On-Demand	Anodyne	ADIPOR1	0	45
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991302	GF	On-Demand	Anodyne	ADIPOR2	0	45
CCS(=O)(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)cc1	ZINC000450991307	EF	On-Demand	Anodyne	SIGMAR1	19	40
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991308	GF	On-Demand	Anodyne	MMP13	43	40
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991308	GF	On-Demand	Anodyne	ADAMTS4	65	39
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991308	GF	On-Demand	Anodyne	LUXN	0	47
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991308	GF	On-Demand	Anodyne	ADIPOR1	0	45
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991308	GF	On-Demand	Anodyne	ADIPOR2	0	45
CCN(c1ccc(OC)c(OC)c1)S(=O)(=O)c1sccc1Cl	ZINC000450991320	FH	On-Demand	Anodyne	HCRTR2	0	47
O=C(CSC1CCC1)Nc1cccc(Cl)c1Cl	ZINC000450991329	CI	On-Demand	Anodyne	KCNQ2	35	40
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)CCOCc1ccccc1	ZINC000450991340	GF	On-Demand	Anodyne	BMP1	63	48
CC1(S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000450991347	EE	On-Demand	Anodyne	DRD4	28	42
CC1(S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000450991347	EE	On-Demand	Anodyne	LSS	23	53
CC1(S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000450991347	EE	On-Demand	Anodyne	PA	27	42
CCOC(=O)c1[nH]c(C)c(C(=O)CSC2CCC2)c1C	ZINC000450991348	CG	On-Demand	Anodyne	HISB	0	40
CN(C(=O)CSC1CCC1)c1ccccc1	ZINC000450991350	BF	On-Demand	Anodyne	AMY2	44	32
O=C(CSC1CCC1)Nc1ccc(Cl)cc1	ZINC000450991351	CH	On-Demand	Anodyne	QRFPR	42	44
CC(C)C(=O)NCCNS(=O)(=O)CCC1CCCCC1	ZINC000450991352	DD	On-Demand	Anodyne	BMP1	52	35
CCNC(=O)CN(CC)S(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450991358	EE	On-Demand	Anodyne	MMP8	25	41
COC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450991360	FG	On-Demand	Anodyne	KCNA5	25	46
COC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450991360	FG	On-Demand	Anodyne	PRTN3	60	38
COC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450991360	FG	On-Demand	Anodyne	FFAR4	22	41
COC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450991360	FG	On-Demand	Anodyne	AKR1C2	44	32
CCCOc1ccc(Cl)cc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450991361	GG	On-Demand	Anodyne	CCR4	18	41
CCCOc1ccc(Cl)cc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450991361	GG	On-Demand	Anodyne	CCR2	22	42
CCCOc1ccc(Cl)cc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450991361	GG	On-Demand	Anodyne	ALPL	21	43
CCCOc1ccc(Cl)cc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450991361	GG	On-Demand	Anodyne	PTGDR2	40	37
Cc1cccc2nc(C3CCN(C(=O)[C@@H]4C[C@H]4CC(C)C)CC3)oc12	ZINC000450991370	EJ	On-Demand	Anodyne	SMO	42	36
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	CA2	31	51
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	ADRB2	33	55
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	ADRB1	25	55
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	ADRB3	32	55
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	CA1	37	46
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	CA7	17	46
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	MMP13	39	40
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	CA4	29	44
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	CA14	19	46
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	MMP2	31	43
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	MMP14	17	40
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	PTPRB	45	36
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	MMP12	43	36
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	ADAMTS4	66	43
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	CA9	26	42
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	PFK	0	43
CC(C)OCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450991371	GI	On-Demand	Anodyne	LIMK2	46	37
c1csc(-c2noc(CCCSC3CCC3)n2)c1	ZINC000450991375	CI	On-Demand	Anodyne	ETHR	31	42
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)o1	ZINC000450991379	GE	On-Demand	Anodyne	ADAMTS4	58	36
Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)o1	ZINC000450991379	GE	On-Demand	Anodyne	LUXN	0	43
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)o1	ZINC000450991380	GE	On-Demand	Anodyne	ADAMTS4	58	36
Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)o1	ZINC000450991380	GE	On-Demand	Anodyne	LUXN	0	43
CCC[C@H](OC)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450991410	CE	On-Demand	Anodyne	TPP2	62	38
CCC[C@H](OC)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450991411	CE	On-Demand	Anodyne	TPP2	62	38
CCC[C@@H](OC)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450991412	CE	On-Demand	Anodyne	TPP2	62	38
CCC[C@@H](OC)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450991413	CE	On-Demand	Anodyne	TPP2	62	38
CC(C)C(=O)N1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1	ZINC000450991419	FE	On-Demand	Anodyne	MC4R	45	39
COc1ccnc(CC(=O)N(C)[C@@H](CO)CC(C)C)c1	ZINC000450991422	CD	On-Demand	Anodyne	NOS2	15	41
COc1ccnc(CC(=O)N(C)[C@H](CO)CC(C)C)c1	ZINC000450991423	CD	On-Demand	Anodyne	NOS2	15	41
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(CC(C)(C)O)[C@H](C)C1	ZINC000450991424	FF	On-Demand	Anodyne	CACNA1B	42	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(CC(C)(C)O)[C@H](C)C1	ZINC000450991424	FF	On-Demand	Anodyne	LIPG	51	34
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1	ZINC000450991425	FF	On-Demand	Anodyne	CACNA1B	42	37
Cc1cc(C(F)(F)F)ccc1C(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1	ZINC000450991425	FF	On-Demand	Anodyne	LIPG	51	34
C[C@@H](NS(=O)(=O)C1(C)CC1)c1ccc(Br)cc1	ZINC000450991426	DF	On-Demand	Anodyne	SDH1	0	48
C[C@H](NS(=O)(=O)C1(C)CC1)c1ccc(Br)cc1	ZINC000450991427	DF	On-Demand	Anodyne	SDH1	0	48
Cc1cccc(C(C)C)c1NS(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450991428	GG	On-Demand	Anodyne	ACAT	0	42
C[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450991432	DI	On-Demand	Anodyne	COLA	90	41
C[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450991432	DI	On-Demand	Anodyne	CPT1A	84	41
C[C@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450991432	DI	On-Demand	Anodyne	RORC	24	40
C[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450991433	DI	On-Demand	Anodyne	COLA	90	41
C[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450991433	DI	On-Demand	Anodyne	CPT1A	84	41
C[C@@H]1CCCCN(C(=O)Cc2scnc2-c2ccccc2)C1	ZINC000450991433	DI	On-Demand	Anodyne	RORC	24	40
CCOC(=O)c1cc(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)on1	ZINC000450991435	ED	On-Demand	Anodyne	TPP2	55	34
CCOC(=O)c1cc(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)on1	ZINC000450991436	ED	On-Demand	Anodyne	TPP2	55	34
CC[C@H](CC(F)(F)F)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450991452	FJ	On-Demand	Anodyne	SMO	41	35
CC[C@H](CC(F)(F)F)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450991452	FJ	On-Demand	Anodyne	ETHR	64	35
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450991453	FJ	On-Demand	Anodyne	SMO	41	35
CC[C@@H](CC(F)(F)F)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450991453	FJ	On-Demand	Anodyne	ETHR	64	35
Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450991456	EH	On-Demand	Bother	NFKBIA	0	41
CCOC(=O)c1ccc(CN2CCCC[C@H]2c2nc(C)no2)nc1	ZINC000450991479	EF	On-Demand	Anodyne	COLA	100	49
CCOC(=O)c1ccc(CN2CCCC[C@H]2c2nc(C)no2)nc1	ZINC000450991479	EF	On-Demand	Anodyne	CPT1A	70	49
CCOC(=O)c1ccc(CN2CCCC[C@@H]2c2nc(C)no2)nc1	ZINC000450991480	EF	On-Demand	Anodyne	COLA	100	49
CCOC(=O)c1ccc(CN2CCCC[C@@H]2c2nc(C)no2)nc1	ZINC000450991480	EF	On-Demand	Anodyne	CPT1A	70	49
COc1ccc(CNC(=O)CCNC(C)(C)c2c(C)noc2C)c(OC)c1	ZINC000450991481	GF	On-Demand	Anodyne	PDGFRB	31	47
O=C(CSC1CCC1)NCc1ccc(F)cc1	ZINC000450991483	CF	On-Demand	Anodyne	SSTR3	17	42
O=C(CSC1CCC1)Nc1cccc(F)c1	ZINC000450991498	BG	On-Demand	Anodyne	FUCA1	20	48
O=C(CSC1CCC1)Nc1cccc(F)c1	ZINC000450991498	BG	On-Demand	Anodyne	QRFPR	40	35
O=C(CSC1CCC1)Nc1cccc(F)c1	ZINC000450991498	BG	On-Demand	Anodyne	KCNK3	15	40
CNC(=O)CC[C@@H]1CCCCN1CC/C=C/c1ccccc1	ZINC000450991524	DG	On-Demand	Anodyne	SLC6A1	27	41
CNC(=O)CC[C@H]1CCCCN1CC/C=C/c1ccccc1	ZINC000450991525	DG	On-Demand	Anodyne	SLC6A1	27	41
CNC(=O)CC[C@H]1CCCCN1CC/C=C\c1ccccc1	ZINC000450991526	DG	On-Demand	Anodyne	SLC6A1	27	41
CNC(=O)CC[C@@H]1CCCCN1CC/C=C\c1ccccc1	ZINC000450991527	DG	On-Demand	Anodyne	SLC6A1	27	41
Cc1cccc(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450991530	BH	On-Demand	Anodyne	KCNK3	63	41
Cc1cccc(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450991530	BH	On-Demand	Anodyne	KCNK9	58	41
Cc1nc(-c2cccc(NC(=O)CSC3CCC3)c2)cs1	ZINC000450991534	DI	On-Demand	Anodyne	HDAC10	23	41
Cc1nc(-c2cccc(NC(=O)CSC3CCC3)c2)cs1	ZINC000450991534	DI	On-Demand	Anodyne	HDAC2	16	41
Cc1nc(-c2cccc(NC(=O)CSC3CCC3)c2)cs1	ZINC000450991534	DI	On-Demand	Anodyne	HDAC3	31	41
Cc1nc(-c2cccc(NC(=O)CSC3CCC3)c2)cs1	ZINC000450991534	DI	On-Demand	Anodyne	KISS1R	42	36
Cc1cccc(NC(=O)[C@H](C)SC2CCC2)c1	ZINC000450991552	BH	On-Demand	Anodyne	KCNK3	63	41
Cc1cccc(NC(=O)[C@H](C)SC2CCC2)c1	ZINC000450991552	BH	On-Demand	Anodyne	KCNK9	58	41
CCOc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450991554	CG	On-Demand	Anodyne	QRFPR	42	34
CCc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)no1	ZINC000450991556	EE	On-Demand	Anodyne	MMP13	25	40
CCc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)no1	ZINC000450991556	EE	On-Demand	Anodyne	MMP12	42	42
CCc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)no1	ZINC000450991556	EE	On-Demand	Anodyne	PFK	0	42
CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)CSC2CCC2)c1	ZINC000450991561	GF	On-Demand	Anodyne	QRFPR	48	41
COc1ccccc1CNC(=O)CSC1CCC1	ZINC000450991572	CF	On-Demand	Anodyne	TACR1	32	43
COc1ccccc1CNC(=O)CSC1CCC1	ZINC000450991572	CF	On-Demand	Anodyne	GPM3	0	47
COc1ccccc1CNC(=O)CSC1CCC1	ZINC000450991572	CF	On-Demand	Anodyne	QRFPR	50	45
COc1ccccc1CNC(=O)CSC1CCC1	ZINC000450991572	CF	On-Demand	Anodyne	MBTPS1	46	36
COC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450991584	GF	On-Demand	Anodyne	PRTN3	56	35
O=C(CSC1CCC1)Nc1ccc(Br)cc1	ZINC000450991616	DH	On-Demand	Anodyne	QRFPR	40	35
CC(C)N(C(=O)CSC1CCC1)c1ccccc1	ZINC000450991618	CH	On-Demand	Anodyne	AMY2	44	30
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N2CCc3ccncc32)cc1	ZINC000450991619	GD	On-Demand	Anodyne	CYP11B1	15	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N2CCc3ccncc32)cc1	ZINC000450991619	GD	On-Demand	Anodyne	CYP11B2	35	43
O=[N+]([O-])c1cccc(F)c1CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991620	DE	On-Demand	Bother	CPT1A	25	41
O=[N+]([O-])c1cccc(F)c1CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991623	DE	On-Demand	Bother	CPT1A	25	41
COc1ccc(CNC(=O)CCN(C)CCC(N)=O)c(OC)c1	ZINC000450991628	DC	On-Demand	Anodyne	MTNR1A	64	40
COc1ccc(CNC(=O)CCN(C)CCC(N)=O)c(OC)c1	ZINC000450991628	DC	On-Demand	Anodyne	MTNR1B	50	39
CSc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450991631	CH	On-Demand	Anodyne	QRFPR	42	36
CSc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450991631	CH	On-Demand	Anodyne	ENPP1	40	31
CSc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450991631	CH	On-Demand	Anodyne	RHOA	0	40
O=C(c1ccc(NS(=O)(=O)c2sccc2Cl)cc1)N1CCOCC1	ZINC000450991634	GF	On-Demand	Anodyne	AKR1C3	0	48
Fc1ccccc1N1CCCN(CCc2cscn2)CC1	ZINC000450991643	DG	On-Demand	Anodyne	HTR1A	22	42
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1[N+](=O)[O-]	ZINC000450991648	GF	On-Demand	Bother	COLA	94	38
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)ccc1[N+](=O)[O-]	ZINC000450991648	GF	On-Demand	Bother	AADAC	0	46
CCn1c(=O)c(C(=O)CSC2CCC2)c(N)n(Cc2ccccc2)c1=O	ZINC000450991654	FE	On-Demand	Anodyne	PDE5A	19	42
C[C@H](SC1CCC1)C(=O)NCc1ccc(F)cc1	ZINC000450991664	CG	On-Demand	Anodyne	SLC6A11	0	42
C[C@H](SC1CCC1)C(=O)NCc1ccc(F)cc1	ZINC000450991664	CG	On-Demand	Anodyne	SLC6A12	0	42
C[C@@H](SC1CCC1)C(=O)NCc1ccc(F)cc1	ZINC000450991666	CG	On-Demand	Anodyne	SLC6A11	0	42
C[C@@H](SC1CCC1)C(=O)NCc1ccc(F)cc1	ZINC000450991666	CG	On-Demand	Anodyne	SLC6A12	0	42
C[C@@H]1CCc2ccccc2N1C(=O)CSC1CCC1	ZINC000450991667	CH	On-Demand	Anodyne	ACE	22	43
C[C@@H]1CCc2ccccc2N1C(=O)CSC1CCC1	ZINC000450991667	CH	On-Demand	Anodyne	DRD4	26	41
C[C@H]1CCc2ccccc2N1C(=O)CSC1CCC1	ZINC000450991668	CH	On-Demand	Anodyne	ACE	22	43
C[C@H]1CCc2ccccc2N1C(=O)CSC1CCC1	ZINC000450991668	CH	On-Demand	Anodyne	DRD4	26	41
Cc1ccc2cc(S(=O)(=O)NCCNC(=O)C(C)C)ccc2c1	ZINC000450991671	EE	On-Demand	Anodyne	LEF	44	36
O=C1CCC(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450991679	DG	On-Demand	Anodyne	HTR1A	26	45
O=C1CCC(CN2CCCN(c3ccccc3F)CC2)CC1	ZINC000450991679	DG	On-Demand	Anodyne	ADRA1B	23	45
CCOc1ccc(C(C)=O)cc1CSC1CCC1	ZINC000450991682	CI	On-Demand	Anodyne	QRFPR	53	46
Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CSC1CCC1	ZINC000450991691	EG	On-Demand	Anodyne	P2RX7	37	51
O=C(CSC1CCC1)Nc1nccs1	ZINC000450991694	BE	On-Demand	Anodyne	MAP1	129	47
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(O)CC3)cc2)c1	ZINC000450991701	GE	On-Demand	Anodyne	L3MBTL3	71	37
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(O)CC3)cc2)c1	ZINC000450991701	GE	On-Demand	Anodyne	TRPC6	50	40
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC(O)CC3)cc2)c1	ZINC000450991701	GE	On-Demand	Anodyne	TRPC3	35	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCSc3ccccc32)cc1	ZINC000450991712	GH	On-Demand	Anodyne	CPT1A	0	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCSc3ccccc32)cc1	ZINC000450991712	GH	On-Demand	Anodyne	TGM2	58	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCSc3ccccc32)cc1	ZINC000450991712	GH	On-Demand	Anodyne	F13A1	92	40
CCC[C@@H](CC(C)C)C(=O)NCc1ncn(Cc2cccc(F)c2)n1	ZINC000450991715	EH	On-Demand	Anodyne	ANPEP	15	43
CCC[C@H](CC(C)C)C(=O)NCc1ncn(Cc2cccc(F)c2)n1	ZINC000450991718	EH	On-Demand	Anodyne	ANPEP	15	43
COc1cc(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)ccc1O	ZINC000450991722	GH	On-Demand	Anodyne	SSTR5	43	35
COc1cc(CC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)ccc1O	ZINC000450991722	GH	On-Demand	Anodyne	ETHR	47	34
N#Cc1ccc(OC2CCN(C[C@H](O)Cc3ccccc3)CC2)c(F)c1	ZINC000450991724	FG	On-Demand	Mild	HRH1	22	42
N#Cc1ccc(OC2CCN(C[C@H](O)Cc3ccccc3)CC2)c(F)c1	ZINC000450991724	FG	On-Demand	Mild	VACHT_TETCF	0	43
CC(C)C[C@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991733	DF	On-Demand	Mild	SDH1	0	42
CC(C)C[C@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991733	DF	On-Demand	Mild	KLK3	62	33
CC(C)C[C@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991733	DF	On-Demand	Mild	CTSB	41	39
CC(C)C[C@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991733	DF	On-Demand	Mild	PAPA1_CARPA	43	39
CC(C)C[C@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991733	DF	On-Demand	Mild	AMP1_PLAFQ	27	41
COc1ccc(CNC(=O)[C@@H](C)SC2CCC2)cc1OC	ZINC000450991736	DF	On-Demand	Anodyne	TRPV1	24	41
COc1ccc(CNC(=O)[C@@H](C)SC2CCC2)cc1OC	ZINC000450991736	DF	On-Demand	Anodyne	MT-ND1	25	42
COc1ccc(CNC(=O)[C@@H](C)SC2CCC2)cc1OC	ZINC000450991736	DF	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1ccc(CNC(=O)[C@H](C)SC2CCC2)cc1OC	ZINC000450991737	DF	On-Demand	Anodyne	TRPV1	24	41
COc1ccc(CNC(=O)[C@H](C)SC2CCC2)cc1OC	ZINC000450991737	DF	On-Demand	Anodyne	MT-ND1	25	42
COc1ccc(CNC(=O)[C@H](C)SC2CCC2)cc1OC	ZINC000450991737	DF	On-Demand	Anodyne	DRTS_TRYCR	44	31
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)CCc2ccco2)cc1	ZINC000450991738	FF	On-Demand	Anodyne	TMPRSS11D	49	35
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C)CCc2ccco2)cc1	ZINC000450991739	FF	On-Demand	Anodyne	TMPRSS11D	49	35
CCCCCNC(=O)[C@H](C)SC1CCC1	ZINC000450991740	BF	On-Demand	Anodyne	TPP2	25	40
CCCCCNC(=O)[C@H](C)SC1CCC1	ZINC000450991740	BF	On-Demand	Anodyne	GNAI1	0	41
CCCCCNC(=O)[C@H](C)SC1CCC1	ZINC000450991740	BF	On-Demand	Anodyne	GNAI3	0	41
CCCCCNC(=O)[C@H](C)SC1CCC1	ZINC000450991740	BF	On-Demand	Anodyne	GNAO1	0	41
CC(C)C[C@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991741	DF	On-Demand	Mild	SDH1	0	42
CC(C)C[C@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991741	DF	On-Demand	Mild	KLK3	62	33
CC(C)C[C@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991741	DF	On-Demand	Mild	CTSB	41	39
CC(C)C[C@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991741	DF	On-Demand	Mild	PAPA1_CARPA	43	39
CC(C)C[C@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991741	DF	On-Demand	Mild	AMP1_PLAFQ	27	41
CCCCCNC(=O)[C@@H](C)SC1CCC1	ZINC000450991742	BF	On-Demand	Anodyne	TPP2	25	40
CCCCCNC(=O)[C@@H](C)SC1CCC1	ZINC000450991742	BF	On-Demand	Anodyne	GNAI1	0	41
CCCCCNC(=O)[C@@H](C)SC1CCC1	ZINC000450991742	BF	On-Demand	Anodyne	GNAI3	0	41
CCCCCNC(=O)[C@@H](C)SC1CCC1	ZINC000450991742	BF	On-Demand	Anodyne	GNAO1	0	41
CC(C)C[C@@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991744	DF	On-Demand	Mild	SDH1	0	42
CC(C)C[C@@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991744	DF	On-Demand	Mild	KLK3	62	33
CC(C)C[C@@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991744	DF	On-Demand	Mild	CTSB	41	39
CC(C)C[C@@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991744	DF	On-Demand	Mild	PAPA1_CARPA	43	39
CC(C)C[C@@H](CO)N(C)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000450991744	DF	On-Demand	Mild	AMP1_PLAFQ	27	41
Cc1ccccc1CNC(=O)[C@@H](C)SC1CCC1	ZINC000450991745	CG	On-Demand	Anodyne	ANPEP	15	45
Cc1ccccc1CNC(=O)[C@@H](C)SC1CCC1	ZINC000450991745	CG	On-Demand	Anodyne	P2RX7	17	44
Cc1ccccc1CNC(=O)[C@H](C)SC1CCC1	ZINC000450991746	CG	On-Demand	Anodyne	ANPEP	15	45
Cc1ccccc1CNC(=O)[C@H](C)SC1CCC1	ZINC000450991746	CG	On-Demand	Anodyne	P2RX7	17	44
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991748	DF	On-Demand	Mild	SDH1	0	42
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991748	DF	On-Demand	Mild	KLK3	62	33
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991748	DF	On-Demand	Mild	CTSB	41	39
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991748	DF	On-Demand	Mild	PAPA1_CARPA	43	39
CC(C)C[C@@H](CO)N(C)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000450991748	DF	On-Demand	Mild	AMP1_PLAFQ	27	41
COC(=O)c1occc1CSC1CCC1	ZINC000450991749	BF	On-Demand	Anodyne	QRFPR	46	38
CCS(=O)(=O)c1ccc(CN[C@H](c2c[nH]c3ccccc23)C(F)(F)F)cc1	ZINC000450991761	GI	On-Demand	Anodyne	ALOX15	27	41
CCS(=O)(=O)c1ccc(CN[C@H](c2c[nH]c3ccccc23)C(F)(F)F)cc1	ZINC000450991761	GI	On-Demand	Anodyne	RORC	43	37
CCS(=O)(=O)c1ccc(CN[C@@H](c2c[nH]c3ccccc23)C(F)(F)F)cc1	ZINC000450991762	GI	On-Demand	Anodyne	ALOX15	27	41
CCS(=O)(=O)c1ccc(CN[C@@H](c2c[nH]c3ccccc23)C(F)(F)F)cc1	ZINC000450991762	GI	On-Demand	Anodyne	RORC	43	37
Cc1ncsc1CCS(=O)(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450991782	GF	On-Demand	Anodyne	LSS	15	43
O=C(C1=C(c2ccccc2)CCC1)N1CCC(O)(Cc2ccc(F)cc2)CC1	ZINC000450991789	GI	On-Demand	Anodyne	CHRM5	29	40
O=C(CSC1CCC1)NC12CC3CC(CC(C3)C1)C2	ZINC000450991804	CG	On-Demand	Anodyne	P95276_MYCTO	0	44
COc1ccc(CNC(=O)CSC2CCC2)cc1OC	ZINC000450991814	CF	On-Demand	Anodyne	DRD2	40	33
COc1ccc(CNC(=O)CSC2CCC2)cc1OC	ZINC000450991814	CF	On-Demand	Anodyne	TRPV1	0	43
COc1ccc(CNC(=O)CSC2CCC2)cc1OC	ZINC000450991814	CF	On-Demand	Anodyne	MT-ND1	26	44
COc1ccc(CNC(=O)CSC2CCC2)cc1OC	ZINC000450991814	CF	On-Demand	Anodyne	QRFPR	48	39
COc1ccc(CNC(=O)CSC2CCC2)cc1OC	ZINC000450991814	CF	On-Demand	Anodyne	ENPP1	51	32
COc1ccc(CNC(=O)CSC2CCC2)cc1OC	ZINC000450991814	CF	On-Demand	Anodyne	DRTS_TRYCR	44	32
C[C@@H](SC1CCC1)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000450991815	CG	On-Demand	Bother	COLA	85	41
C[C@H](SC1CCC1)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000450991816	CG	On-Demand	Bother	COLA	85	41
CCC(CC)(NC(=O)C1CN(Cc2ccc(Cl)c(OC)c2)C1)C(N)=O	ZINC000450991823	FD	On-Demand	Anodyne	SSTR5	40	37
C[C@@H](SC1CCC1)C(=O)N[C@H](C)c1ccc(F)cc1	ZINC000450991827	CH	On-Demand	Anodyne	SDH1	0	44
C[C@H](SC1CCC1)C(=O)N[C@H](C)c1ccc(F)cc1	ZINC000450991828	CH	On-Demand	Anodyne	SDH1	0	44
C[C@H](SC1CCC1)C(=O)N[C@@H](C)c1ccc(F)cc1	ZINC000450991829	CH	On-Demand	Anodyne	SDH1	0	44
C[C@H](NC(=O)[C@@H](C)SC1CCC1)c1ccc(F)cc1	ZINC000450991830	CH	On-Demand	Anodyne	SDH1	0	44
CN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991842	GC	On-Demand	Anodyne	LUXN	0	40
CN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991842	GC	On-Demand	Anodyne	ADIPOR1	0	41
CN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450991842	GC	On-Demand	Anodyne	ADIPOR2	0	41
COc1cc(NC(=O)CSC2CCC2)cc(OC)c1	ZINC000450991852	CF	On-Demand	Anodyne	QRFPR	46	38
COc1cc(NC(=O)CSC2CCC2)cc(OC)c1	ZINC000450991852	CF	On-Demand	Anodyne	ENPP1	48	29
CCN(c1ccc(OC)c(OC)c1)S(=O)(=O)c1cccc(Cl)c1O	ZINC000450991854	FG	On-Demand	Anodyne	HCRTR2	19	43
CCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc(C)n1	ZINC000450991877	GD	On-Demand	Anodyne	ADAMTS4	43	33
CCc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc(C)n1	ZINC000450991877	GD	On-Demand	Anodyne	LUXN	0	43
CNC(=O)CC[C@@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450991878	DG	On-Demand	Anodyne	HRH3	23	40
CNC(=O)CC[C@@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450991878	DG	On-Demand	Anodyne	SPHK2	27	46
CNC(=O)CC[C@@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450991878	DG	On-Demand	Anodyne	BIRC2	41	40
CNC(=O)CC[C@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450991879	DG	On-Demand	Anodyne	HRH3	23	40
CNC(=O)CC[C@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450991879	DG	On-Demand	Anodyne	SPHK2	27	46
CNC(=O)CC[C@H]1CCCCN1CCc1ccc(Cl)cc1	ZINC000450991879	DG	On-Demand	Anodyne	BIRC2	41	40
CCc1ccccc1NC(=O)CSC1CCC1	ZINC000450991884	BG	On-Demand	Anodyne	KCNQ2	75	38
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cnccc1C	ZINC000450991899	DG	On-Demand	Anodyne	CA14	15	40
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cnccc1C	ZINC000450991900	DG	On-Demand	Anodyne	CA14	15	40
C[C@@H](SC1CCC1)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000450991932	CI	On-Demand	Anodyne	SDH1	0	44
C[C@@H](SC1CCC1)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000450991932	CI	On-Demand	Anodyne	PRCP	18	41
C[C@H](SC1CCC1)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000450991934	CI	On-Demand	Anodyne	SDH1	0	44
C[C@H](SC1CCC1)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000450991934	CI	On-Demand	Anodyne	PRCP	18	41
C[C@H](SC1CCC1)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000450991936	CI	On-Demand	Anodyne	SDH1	0	44
C[C@H](SC1CCC1)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000450991936	CI	On-Demand	Anodyne	PRCP	18	41
C[C@H](NC(=O)[C@@H](C)SC1CCC1)c1ccc(Cl)cc1	ZINC000450991937	CI	On-Demand	Anodyne	SDH1	0	44
C[C@H](NC(=O)[C@@H](C)SC1CCC1)c1ccc(Cl)cc1	ZINC000450991937	CI	On-Demand	Anodyne	PRCP	18	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	OPRM1	64	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	OPRD1	53	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	PGC	44	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	CMA1	59	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	CTRA_BOVIN	51	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	COLA	70	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	CPT1A	68	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	F11	50	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	CTSE	41	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	ACE2	40	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991955	FD	On-Demand	Anodyne	BRCA1	50	29
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	OPRM1	64	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	OPRD1	53	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	PGC	44	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	CMA1	59	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	CTRA_BOVIN	51	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	COLA	70	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	CPT1A	68	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	F11	50	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	CTSE	41	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	ACE2	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450991956	FD	On-Demand	Anodyne	BRCA1	50	29
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	OPRM1	64	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	OPRD1	53	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	PGC	44	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	CMA1	59	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	CTRA_BOVIN	51	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	COLA	70	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	CPT1A	68	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	F11	50	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	CTSE	41	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	ACE2	40	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991957	FD	On-Demand	Anodyne	BRCA1	50	29
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	OPRM1	64	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	OPRD1	53	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	PGC	44	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	CMA1	59	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	CTRA_BOVIN	51	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	COLA	70	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	CPT1A	68	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	F11	50	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	CTSE	41	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	ACE2	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450991961	FD	On-Demand	Anodyne	BRCA1	50	29
CN(CCN1CC[C@H](COC(F)F)C1)Cc1ccccc1	ZINC000450991962	CF	On-Demand	Anodyne	SLC6A1	0	42
CN(CCN1CC[C@H](COC(F)F)C1)Cc1ccccc1	ZINC000450991962	CF	On-Demand	Anodyne	SIGMAR1	54	40
CN(CCN1CC[C@@H](COC(F)F)C1)Cc1ccccc1	ZINC000450991963	CF	On-Demand	Anodyne	SLC6A1	0	42
CN(CCN1CC[C@@H](COC(F)F)C1)Cc1ccccc1	ZINC000450991963	CF	On-Demand	Anodyne	SIGMAR1	54	40
Cc1cc(C)c(NS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)c(C)c1	ZINC000450991970	FF	On-Demand	Anodyne	FFAR4	33	49
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)C(C)C)CC3)ccc2c1	ZINC000450991977	FF	On-Demand	Anodyne	TRY2_BOVIN	59	46
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)C(C)C)CC3)ccc2c1	ZINC000450991977	FF	On-Demand	Anodyne	PKM	34	42
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)C(C)C)CC3)ccc2c1	ZINC000450991977	FF	On-Demand	Anodyne	TGM2	54	37
Cc1ccc2cc(S(=O)(=O)N3CCN(C(=O)C(C)C)CC3)ccc2c1	ZINC000450991977	FF	On-Demand	Anodyne	F13A1	68	37
CO[C@H](C)CS(=O)(=O)c1cccc(Br)c1	ZINC000450991983	CE	On-Demand	Anodyne	AO-ACHE	0	45
COCC1(S(=O)(=O)N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000450991984	GE	On-Demand	Anodyne	ADORA2B	27	43
CO[C@@H](C)CS(=O)(=O)c1cccc(Br)c1	ZINC000450991986	CE	On-Demand	Anodyne	AO-ACHE	0	45
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991992	DG	On-Demand	Anodyne	DRD2	32	44
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991992	DG	On-Demand	Anodyne	HRH2	0	44
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991992	DG	On-Demand	Anodyne	HTR2A	33	51
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991992	DG	On-Demand	Anodyne	HTR2C	27	58
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991992	DG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991992	DG	On-Demand	Anodyne	CYP2J2	56	39
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991994	DG	On-Demand	Anodyne	DRD2	32	44
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991994	DG	On-Demand	Anodyne	HRH2	0	44
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991994	DG	On-Demand	Anodyne	HTR2A	33	51
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991994	DG	On-Demand	Anodyne	HTR2C	27	58
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991994	DG	On-Demand	Anodyne	HTR3B	0	45
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccc(F)cc1	ZINC000450991994	DG	On-Demand	Anodyne	CYP2J2	56	39
CCOc1ccc(OCCNC(=O)CSC2CCC2)cc1	ZINC000450991996	DF	On-Demand	Anodyne	NQO2	19	41
CCOC(=O)CC1(S(=O)(=O)N[C@H](C)c2ccc(Br)cc2)CC1	ZINC000450992014	GF	On-Demand	Anodyne	SDH1	0	40
CCOC(=O)CC1(S(=O)(=O)N[C@@H](C)c2ccc(Br)cc2)CC1	ZINC000450992019	GF	On-Demand	Anodyne	SDH1	0	40
COC(=O)CN(CC#N)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992036	FC	On-Demand	Mild	COLA	42	37
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	CHRM2	29	48
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	ACE	58	36
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	DRD2	26	53
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	DRD4	53	47
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	ACHE	42	51
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	DRD3	32	56
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	CHRM3	37	43
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	LTA4H	25	43
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	SIGMAR1	83	61
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	SSTR5	50	36
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	BCHE	26	44
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	CCR3	53	47
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	C3AR1	43	37
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	MCHR1	51	46
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	CACNA1G	27	50
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	CCR8	22	44
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	BIRC2	84	40
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	NPFFR1	49	34
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	ADIPOR1	0	47
C[C@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992041	EG	On-Demand	Anodyne	ADIPOR2	0	47
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	CHRM2	29	48
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	ACE	58	36
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	DRD2	26	53
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	DRD4	53	47
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	ACHE	42	51
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	DRD3	32	56
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	CHRM3	37	43
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	LTA4H	25	43
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	SIGMAR1	83	61
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	SSTR5	50	36
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	BCHE	26	44
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	CCR3	53	47
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	C3AR1	43	37
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	MCHR1	51	46
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	CACNA1G	27	50
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	CCR8	22	44
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	BIRC2	84	40
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	NPFFR1	49	34
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	ADIPOR1	0	47
C[C@@H](SC1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000450992042	EG	On-Demand	Anodyne	ADIPOR2	0	47
CC(C)c1cccc(C(C)C)c1NS(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450992048	GK	On-Demand	Mild	ACAT	0	42
CCOc1cc(NS(=O)(=O)c2cccnc2C(=O)OC)ccc1OC	ZINC000450992051	FE	On-Demand	Anodyne	GRM4	17	42
CCOc1cc(NS(=O)(=O)c2cccnc2C(=O)OC)ccc1OC	ZINC000450992051	FE	On-Demand	Anodyne	ALPL	32	45
CCOc1cc(NS(=O)(=O)c2cccnc2C(=O)OC)ccc1OC	ZINC000450992051	FE	On-Demand	Anodyne	ENPP1	58	37
O=S(=O)(CC1CC(F)(F)C1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450992071	GF	On-Demand	Anodyne	SIGMAR1	17	44
O=S(=O)(CC1CC(F)(F)C1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000450992071	GF	On-Demand	Anodyne	LSS	18	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCNC(=O)C2CC2)cc1	ZINC000450992092	FD	On-Demand	Anodyne	CA2	15	49
CC(C)CNC(=O)c1ccc(NS(=O)(=O)c2cnc(O)s2)cc1	ZINC000450992096	FE	On-Demand	Anodyne	F3	77	34
COc1ccc(C)cc1NC(=O)CSC1CCC1	ZINC000450992097	CG	On-Demand	Anodyne	ENPP1	51	31
C[C@H](SC1CCC1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000450992105	FI	On-Demand	Bother	MAOB	0	44
C[C@@H](SC1CCC1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000450992106	FI	On-Demand	Bother	MAOB	0	44
COC(=O)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450992111	CF	On-Demand	Anodyne	ACR	52	38
COC(=O)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450992111	CF	On-Demand	Anodyne	QRFPR	47	41
COc1ccc(CCNC(=O)CSC2CCC2)cc1OC	ZINC000450992123	DF	On-Demand	Anodyne	QRFPR	47	38
COc1ccc(CCNC(=O)CSC2CCC2)cc1OC	ZINC000450992123	DF	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(CCNC(=O)CSC2CCC2)cc1OC	ZINC000450992123	DF	On-Demand	Anodyne	CAN2	0	53
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cc(C(F)(F)F)ccn2)cc1	ZINC000450992129	GG	On-Demand	Anodyne	TRPM8	48	36
CCN(Cc1ccccc1)C(=O)[C@@H](C)SC1CCC1	ZINC000450992143	CH	On-Demand	Anodyne	PTGES	24	40
CCN(Cc1ccccc1)C(=O)[C@H](C)SC1CCC1	ZINC000450992144	CH	On-Demand	Anodyne	PTGES	24	40
CCOC(=O)c1c(C)[nH]c(C(=O)CSC2CCC2)c1C	ZINC000450992145	CG	On-Demand	Anodyne	HISB	0	40
CN(C)C(=O)Nc1ccccc1NS(=O)(=O)CCCCF	ZINC000450992148	DE	On-Demand	Anodyne	PSBA	0	40
CCNC(=O)CNS(=O)(=O)CCOCCN1C(=O)c2ccccc2C1=O	ZINC000450992150	GB	On-Demand	Anodyne	17HSDCL	0	40
CCNC(=O)CNS(=O)(=O)CCOCCN1C(=O)c2ccccc2C1=O	ZINC000450992150	GB	On-Demand	Anodyne	FBPC	0	40
O=C(NCCCCc1ccc(F)c(F)c1)[C@@H](O)C1CCC1	ZINC000450992158	CF	On-Demand	Anodyne	MMP2	41	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)c1	ZINC000450992159	GH	On-Demand	Anodyne	MAPK14	41	37
O=C(NCCCCc1ccc(F)c(F)c1)[C@H](O)C1CCC1	ZINC000450992160	CF	On-Demand	Anodyne	MMP2	41	34
COCCOc1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450992161	FD	On-Demand	Anodyne	GPR119	0	41
O=C(CSC1CCC1)NCCc1ccc(Cl)cc1	ZINC000450992162	CG	On-Demand	Anodyne	SLC6A1	0	46
O=C(CSC1CCC1)NCCc1ccc(Cl)cc1	ZINC000450992162	CG	On-Demand	Anodyne	GPBAR1	0	45
Cc1cccc(C)c1CS(=O)(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000450992166	GF	On-Demand	Anodyne	CYP11B2	32	41
O=C(CSC1CCC1)NC1CCCCCC1	ZINC000450992169	BG	On-Demand	Anodyne	EPHX2	22	40
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992184	GG	On-Demand	Anodyne	MC4R	59	44
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992184	GG	On-Demand	Anodyne	PRCP	57	44
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992184	GG	On-Demand	Anodyne	MC3R	54	44
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992184	GG	On-Demand	Anodyne	MC5R	38	44
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992185	GG	On-Demand	Anodyne	MC4R	59	44
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992185	GG	On-Demand	Anodyne	PRCP	57	44
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992185	GG	On-Demand	Anodyne	MC3R	54	44
C[C@@H]1CN(C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992185	GG	On-Demand	Anodyne	MC5R	38	44
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992187	GG	On-Demand	Anodyne	MC4R	59	44
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992187	GG	On-Demand	Anodyne	PRCP	57	44
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992187	GG	On-Demand	Anodyne	MC3R	54	44
C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992187	GG	On-Demand	Anodyne	MC5R	38	44
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992189	GG	On-Demand	Anodyne	MC4R	59	44
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992189	GG	On-Demand	Anodyne	PRCP	57	44
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992189	GG	On-Demand	Anodyne	MC3R	54	44
C[C@@H]1CN(C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)CCN1CC(C)(C)O	ZINC000450992189	GG	On-Demand	Anodyne	MC5R	38	44
CC(=O)c1ccc(CSC2CCC2)cc1	ZINC000450992190	BH	On-Demand	Anodyne	QRFPR	41	36
CC(C)CC(CC(C)C)C(=O)NCc1ncn(Cc2cccc(F)c2)n1	ZINC000450992192	FH	On-Demand	Anodyne	ANPEP	20	47
O=C(CSC1CCC1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000450992193	EH	On-Demand	Bother	MAOB	0	45
O=C(NCCNS(=O)(=O)Cc1c(F)cccc1Cl)C1CC1	ZINC000450992195	ED	On-Demand	Anodyne	EPHX2	17	48
COC(=O)c1ncccc1S(=O)(=O)NCc1cc(OC)c(OC)cc1OC	ZINC000450992204	GD	On-Demand	Anodyne	GLMU	0	46
CCc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450992205	BG	On-Demand	Anodyne	QRFPR	42	36
Cc1csc(S(=O)(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)c1	ZINC000450992221	FH	On-Demand	Anodyne	PTGDR	23	41
Cc1cccc2nc(C3CCN(C(=O)C(C)(C)C(C)(F)F)CC3)oc12	ZINC000450992230	FJ	On-Demand	Anodyne	ETHR	58	34
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	CA2	20	40
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	CA1	27	44
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	BDKRB1	0	50
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	GRM4	31	44
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	CA14	17	42
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	MMP2	27	41
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	PRTN3	58	35
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	CA12	16	46
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	LIMK2	38	40
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	MTCA1	17	44
COCCOc1ccccc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992233	GG	On-Demand	Anodyne	P96878_MYCTU	23	44
CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450992234	EH	On-Demand	Anodyne	OPRM1	0	40
CCN(CC)C(=O)c1cccc(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450992234	EH	On-Demand	Anodyne	OPRD1	37	43
CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)SC2CCC2)c1	ZINC000450992235	EH	On-Demand	Anodyne	OPRM1	0	40
CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)SC2CCC2)c1	ZINC000450992235	EH	On-Demand	Anodyne	OPRD1	37	43
CCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1sccc1Cl	ZINC000450992238	FH	On-Demand	Anodyne	PRTN3	47	34
CC(=O)[C@@](C)(O)CN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000450992246	DD	On-Demand	Mild	AR	26	45
CC(=O)[C@](C)(O)CN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000450992247	DD	On-Demand	Mild	AR	26	45
COc1ccc(NC(=O)[C@@H](SC2CCC2)C(C)C)cc1	ZINC000450992249	CH	On-Demand	Anodyne	PDE1B	0	41
COc1ccc(NC(=O)[C@@H](SC2CCC2)C(C)C)cc1	ZINC000450992249	CH	On-Demand	Anodyne	PDE9A	0	41
COc1ccc(NC(=O)[C@H](SC2CCC2)C(C)C)cc1	ZINC000450992250	CH	On-Demand	Anodyne	PDE1B	0	41
COc1ccc(NC(=O)[C@H](SC2CCC2)C(C)C)cc1	ZINC000450992250	CH	On-Demand	Anodyne	PDE9A	0	41
CCOC(=O)c1ccc(CN2CCC[C@@H](Oc3ccccc3OC)C2)nc1	ZINC000450992261	FG	On-Demand	Anodyne	MBTPS1	42	37
CCOC(=O)c1ccc(CN2CCC[C@H](Oc3ccccc3OC)C2)nc1	ZINC000450992262	FG	On-Demand	Anodyne	MBTPS1	42	37
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	HTR1A	68	55
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	DRD2	77	55
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	DRD1	26	46
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	DRD4	88	46
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	ACHE	16	44
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	ADRA1D	37	46
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	HTR2A	28	42
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	HTR2C	20	42
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	ADRA1A	32	46
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	ADRA1B	27	46
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	DRD3	69	46
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	HTR7	34	46
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	KCNQ2	60	39
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	FABP4	52	38
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	NPY2R	31	40
CC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450992268	EH	On-Demand	Anodyne	ABCB1	23	42
COc1cc(CSC2CCC2)c([N+](=O)[O-])cc1OC(F)F	ZINC000450992273	DH	On-Demand	Bother	QRFPR	43	35
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nc(OC)cc(OC)n2)cc1	ZINC000450992274	GD	On-Demand	Anodyne	ALS	49	43
CCOC(=O)c1ccc(CS(=O)(=O)Nc2nc(OC)cc(OC)n2)cc1	ZINC000450992274	GD	On-Demand	Anodyne	ILV2	0	44
O=C(CSC1CCC1)N1CCC(c2nc3ccccc3s2)CC1	ZINC000450992279	EI	On-Demand	Anodyne	ETHR	42	36
Cc1csc(S(=O)(=O)N2CCN(Cc3ccncc3)CC2)c1	ZINC000450992281	ED	On-Demand	Anodyne	ADORA2B	42	35
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSC1CCC1	ZINC000450992282	DE	On-Demand	Anodyne	OPRD1	62	36
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSC1CCC1	ZINC000450992282	DE	On-Demand	Anodyne	ADAM9	65	36
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSC1CCC1	ZINC000450992283	DE	On-Demand	Anodyne	OPRD1	62	36
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSC1CCC1	ZINC000450992283	DE	On-Demand	Anodyne	ADAM9	65	36
CC(=O)c1cccc(CN2CC[C@@H](COC(F)F)C2)c1	ZINC000450992285	CF	On-Demand	Anodyne	ACHE	28	44
CC(=O)c1cccc(CN2CC[C@@H](COC(F)F)C2)c1	ZINC000450992285	CF	On-Demand	Anodyne	SIGMAR1	39	42
CC(=O)c1cccc(CN2CC[C@@H](COC(F)F)C2)c1	ZINC000450992285	CF	On-Demand	Anodyne	CCR3	60	43
CC(=O)c1cccc(CN2CC[C@@H](COC(F)F)C2)c1	ZINC000450992285	CF	On-Demand	Anodyne	CACNA1I	41	41
CC(=O)c1cccc(CN2CC[C@H](COC(F)F)C2)c1	ZINC000450992286	CF	On-Demand	Anodyne	ACHE	28	44
CC(=O)c1cccc(CN2CC[C@H](COC(F)F)C2)c1	ZINC000450992286	CF	On-Demand	Anodyne	SIGMAR1	39	42
CC(=O)c1cccc(CN2CC[C@H](COC(F)F)C2)c1	ZINC000450992286	CF	On-Demand	Anodyne	CCR3	60	43
CC(=O)c1cccc(CN2CC[C@H](COC(F)F)C2)c1	ZINC000450992286	CF	On-Demand	Anodyne	CACNA1I	41	41
COc1ccc(CSC2CCC2)cc1[N+](=O)[O-]	ZINC000450992287	CG	On-Demand	Bother	QRFPR	46	38
COc1ccc(-c2noc(CN3CCCN(c4ccccc4F)CC3)n2)nn1	ZINC000450992290	GE	On-Demand	Anodyne	DRD3	28	42
C[C@@H](SC1CCC1)C(=O)Nc1cccc2ncccc12	ZINC000450992297	CH	On-Demand	Anodyne	G2YM83_BOTF4	53	35
C[C@H](SC1CCC1)C(=O)Nc1cccc2ncccc12	ZINC000450992299	CH	On-Demand	Anodyne	G2YM83_BOTF4	53	35
C[C@@H](O)CCN1CCCN(c2ccccc2F)CC1	ZINC000450992306	CE	On-Demand	Anodyne	DRD1	27	40
C[C@H](O)CCN1CCCN(c2ccccc2F)CC1	ZINC000450992308	CE	On-Demand	Anodyne	DRD1	27	40
COc1ccc(-c2nc(CSC3CCC3)cs2)c(OC)c1	ZINC000450992310	DJ	On-Demand	Anodyne	DCK	39	40
COc1ccc(-c2nc(CSC3CCC3)cs2)c(OC)c1	ZINC000450992310	DJ	On-Demand	Anodyne	QRFPR	44	37
O=[N+]([O-])c1cccc(CSC2CCC2)c1	ZINC000450992312	BG	On-Demand	Bother	CACNA1D	56	34
C[C@@H](SC1CCC1)C(=O)Nc1ccc(Cl)cn1	ZINC000450992315	CG	On-Demand	Anodyne	F10	32	45
C[C@H](SC1CCC1)C(=O)Nc1ccc(Cl)cn1	ZINC000450992317	CG	On-Demand	Anodyne	F10	32	45
CNC(=O)c1ccc(CS(=O)(=O)N[C@H](C)CCc2ccco2)cc1	ZINC000450992319	FE	On-Demand	Anodyne	TMPRSS11D	41	33
CNC(=O)c1ccc(CS(=O)(=O)N[C@@H](C)CCc2ccco2)cc1	ZINC000450992320	FE	On-Demand	Anodyne	TMPRSS11D	41	33
Cc1[nH]nc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C#N	ZINC000450992322	GD	On-Demand	Mild	LUXN	0	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOC[C@H]2C#N)cc1	ZINC000450992323	ED	On-Demand	Mild	F13A1	40	33
CCCNC(=O)CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992327	ED	On-Demand	Anodyne	CA2	25	51
CCCNC(=O)CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992327	ED	On-Demand	Anodyne	CA1	27	43
CCCNC(=O)CNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992327	ED	On-Demand	Anodyne	CA4	23	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOC[C@@H]2C#N)cc1	ZINC000450992329	ED	On-Demand	Mild	F13A1	40	33
Cc1cccc(-c2noc(CSC3CCC3)n2)c1	ZINC000450992332	CH	On-Demand	Anodyne	GRM5	22	47
CN(C)C(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450992340	CF	On-Demand	Anodyne	QRFPR	42	39
CN(C)C(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450992340	CF	On-Demand	Anodyne	KCNK3	43	35
CN(C)C(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450992340	CF	On-Demand	Anodyne	PARP10	0	40
CC(C)(C)C1=CCN(CCNC(=O)c2ccc(N3CCC3)nc2)CC1	ZINC000450992347	EF	On-Demand	Anodyne	DRD4	41	31
O=C(CSC1CCC1)Nc1cccc(Cl)c1	ZINC000450992353	CH	On-Demand	Anodyne	QRFPR	42	38
CC(C)NC(=O)CN1CCN(S(=O)(=O)c2ccc(CC#N)cc2Cl)CC1	ZINC000450992362	GD	On-Demand	Mild	AVPR1B	43	33
CNC(=O)CC[C@@H]1CCCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450992365	DG	On-Demand	Anodyne	DRD2	48	41
CNC(=O)CC[C@H]1CCCCN1Cc1ccc(Cl)c(OC)c1	ZINC000450992366	DG	On-Demand	Anodyne	DRD2	48	41
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	CA2	37	59
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	CA1	43	46
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	CA7	21	48
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	CA5B	26	40
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	CA4	32	48
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	CA5A	30	40
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	CA14	21	49
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	MMP2	26	42
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	LEF	40	35
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	IDO1	40	38
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	MTCA1	40	35
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	P96878_MYCTU	49	38
CC(C)C(=O)NCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992367	FD	On-Demand	Anodyne	NAMPT	28	44
CCOc1ccncc1S(=O)(=O)NCCOc1cccc(C)c1	ZINC000450992368	EE	On-Demand	Anodyne	Q95J97_RABIT	0	41
CC(C)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450992372	CI	On-Demand	Anodyne	QRFPR	42	37
O=C(CSC1CCC1)Nc1ccc(F)cc1Cl	ZINC000450992376	CH	On-Demand	Anodyne	P2RX7	22	41
O=C(NCCNS(=O)(=O)c1cccc2c(Cl)ccnc12)C1CC1	ZINC000450992381	FD	On-Demand	Anodyne	NPY2R	35	44
O=C(NCCNS(=O)(=O)c1cccc2c(Cl)ccnc12)C1CC1	ZINC000450992381	FD	On-Demand	Anodyne	TYK2	50	37
CCOC(=O)c1cc(S(=O)(=O)Nc2c(C)cccc2F)cnc1C(F)F	ZINC000450992383	GG	On-Demand	Anodyne	LEF	46	33
CCCNC(=O)CNS(=O)(=O)CCC1CCCCC1	ZINC000450992395	CD	On-Demand	Anodyne	BMP1	27	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)ccn2)cc1	ZINC000450992402	GG	On-Demand	Anodyne	GRM4	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)ccn2)cc1	ZINC000450992402	GG	On-Demand	Anodyne	IDO1	28	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)ccn2)cc1	ZINC000450992402	GG	On-Demand	Anodyne	PFK	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)ccn2)cc1	ZINC000450992402	GG	On-Demand	Anodyne	AADAC	0	41
COc1cc(-c2noc(CN3CCCC[C@@H]3c3nc(C)no3)n2)ncn1	ZINC000450992411	FD	On-Demand	Anodyne	COLA	43	43
COc1cc(-c2noc(CN3CCCC[C@@H]3c3nc(C)no3)n2)ncn1	ZINC000450992411	FD	On-Demand	Anodyne	CPT1A	42	43
COc1cc(-c2noc(CN3CCCC[C@H]3c3nc(C)no3)n2)ncn1	ZINC000450992415	FD	On-Demand	Anodyne	COLA	43	43
COc1cc(-c2noc(CN3CCCC[C@H]3c3nc(C)no3)n2)ncn1	ZINC000450992415	FD	On-Demand	Anodyne	CPT1A	42	43
C[C@@H](SC1CCC1)C(=O)N1CCN(C(=O)c2ccco2)CC1	ZINC000450992417	DE	On-Demand	Anodyne	L3MBTL3	43	36
C[C@H](SC1CCC1)C(=O)N1CCN(C(=O)c2ccco2)CC1	ZINC000450992418	DE	On-Demand	Anodyne	L3MBTL3	43	36
CCOCCOCc1cccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450992420	GH	On-Demand	Anodyne	LIMK2	45	38
N#Cc1ccc(CN2CCN(S(=O)(=O)c3cc4cc(F)ccc4o3)CC2)cc1	ZINC000450992423	GF	On-Demand	Mild	ADORA2B	40	36
N#Cc1ccc(CN2CCN(S(=O)(=O)c3cc4cc(F)ccc4o3)CC2)cc1	ZINC000450992423	GF	On-Demand	Mild	SIGMAR1	15	46
CCC(=O)C1(C(=O)NC[C@H]2Cc3ccccc3N(C)C2)CC1	ZINC000450992431	DE	On-Demand	Anodyne	TPP2	53	33
CCC(=O)C1(C(=O)NC[C@@H]2Cc3ccccc3N(C)C2)CC1	ZINC000450992432	DE	On-Demand	Anodyne	TPP2	53	33
Cc1c(Cl)cccc1NC(=O)CSC1CCC1	ZINC000450992437	CH	On-Demand	Anodyne	P2RX7	15	41
Fc1ccc(OCCSC2CCC2)cc1	ZINC000450992439	BG	On-Demand	Anodyne	LTA4H	20	43
CCc1cccc(CC)c1NC(=O)CSC1CCC1	ZINC000450992441	CI	On-Demand	Anodyne	ACAT	0	44
C[C@@H](NC(=O)CSC1CCC1)c1ccc2ccccc2c1	ZINC000450992445	CI	On-Demand	Anodyne	SDH1	0	51
C[C@@H](NC(=O)CSC1CCC1)c1ccc2ccccc2c1	ZINC000450992445	CI	On-Demand	Anodyne	TPH1	35	40
C[C@@H](NC(=O)CSC1CCC1)c1ccc2ccccc2c1	ZINC000450992445	CI	On-Demand	Anodyne	CAPN2	0	40
C[C@@H](NC(=O)CSC1CCC1)c1ccc2ccccc2c1	ZINC000450992445	CI	On-Demand	Anodyne	F7	18	47
C[C@H](NC(=O)CSC1CCC1)c1ccc2ccccc2c1	ZINC000450992446	CI	On-Demand	Anodyne	SDH1	0	51
C[C@H](NC(=O)CSC1CCC1)c1ccc2ccccc2c1	ZINC000450992446	CI	On-Demand	Anodyne	TPH1	35	40
C[C@H](NC(=O)CSC1CCC1)c1ccc2ccccc2c1	ZINC000450992446	CI	On-Demand	Anodyne	CAPN2	0	40
C[C@H](NC(=O)CSC1CCC1)c1ccc2ccccc2c1	ZINC000450992446	CI	On-Demand	Anodyne	F7	18	47
COc1ccccc1CCNC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450992451	FD	On-Demand	Anodyne	HTR1A	23	41
COc1ccccc1CCNC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450992451	FD	On-Demand	Anodyne	MBTPS1	54	38
COc1ccccc1CCNC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450992452	FD	On-Demand	Anodyne	HTR1A	23	41
COc1ccccc1CCNC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450992452	FD	On-Demand	Anodyne	MBTPS1	54	38
COc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450992456	EE	On-Demand	Anodyne	BMP1	49	35
COc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450992456	EE	On-Demand	Anodyne	MMP13	31	43
COc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450992456	EE	On-Demand	Anodyne	MMP12	46	38
COc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450992456	EE	On-Demand	Anodyne	IDO1	30	42
COc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c1	ZINC000450992456	EE	On-Demand	Anodyne	FFAR4	25	40
CCCOc1ccc(OCCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450992458	EF	On-Demand	Anodyne	COLA	51	41
CCCOc1ccc(OCCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450992458	EF	On-Demand	Anodyne	CPT1A	47	41
CCCOc1ccc(OCCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450992458	EF	On-Demand	Anodyne	PSMB2	45	34
CCCOc1ccc(OCCN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450992458	EF	On-Demand	Anodyne	PSMB1	40	34
CCCOc1ccc(OCCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450992459	EF	On-Demand	Anodyne	COLA	51	41
CCCOc1ccc(OCCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450992459	EF	On-Demand	Anodyne	CPT1A	47	41
CCCOc1ccc(OCCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450992459	EF	On-Demand	Anodyne	PSMB2	45	34
CCCOc1ccc(OCCN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450992459	EF	On-Demand	Anodyne	PSMB1	40	34
CCC[C@@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992460	FF	On-Demand	Anodyne	P2RY12	65	31
CCC[C@@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992460	FF	On-Demand	Anodyne	COLA	50	41
CCC[C@@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992460	FF	On-Demand	Anodyne	CPT1A	45	39
CCC[C@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992461	FF	On-Demand	Anodyne	P2RY12	65	31
CCC[C@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992461	FF	On-Demand	Anodyne	COLA	50	41
CCC[C@H](NC(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992461	FF	On-Demand	Anodyne	CPT1A	45	39
CCC[C@@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992462	FF	On-Demand	Anodyne	P2RY12	65	31
CCC[C@@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992462	FF	On-Demand	Anodyne	COLA	50	41
CCC[C@@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992462	FF	On-Demand	Anodyne	CPT1A	45	39
CCC[C@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992463	FF	On-Demand	Anodyne	P2RY12	65	31
CCC[C@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992463	FF	On-Demand	Anodyne	COLA	50	41
CCC[C@H](NC(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1)c1ccccc1	ZINC000450992463	FF	On-Demand	Anodyne	CPT1A	45	39
CC[S@@](=O)CC(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450992478	EF	On-Demand	Anodyne	ETHR	65	36
CC[S@](=O)CC(=O)N1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000450992479	EF	On-Demand	Anodyne	ETHR	65	36
CCCOc1ccc(C(=O)NCc2ncn(Cc3cccc(F)c3)n2)c(OC)c1	ZINC000450992482	GG	On-Demand	Anodyne	MET	17	43
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450992485	FF	On-Demand	Anodyne	CTSL	30	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450992485	FF	On-Demand	Anodyne	TPP2	43	31
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450992486	FF	On-Demand	Anodyne	CTSL	30	40
CC(C)C[C@H](NC(=O)C(C)(C)C)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450992486	FF	On-Demand	Anodyne	TPP2	43	31
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C#N)C2CCCCC2)cc1	ZINC000450992502	FG	On-Demand	Mild	MMP13	25	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C#N)C2CCCCC2)cc1	ZINC000450992502	FG	On-Demand	Mild	MMP2	20	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C#N)C2CCCCC2)cc1	ZINC000450992502	FG	On-Demand	Mild	LEF	30	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C#N)C2CCCCC2)cc1	ZINC000450992503	FG	On-Demand	Mild	MMP13	25	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C#N)C2CCCCC2)cc1	ZINC000450992503	FG	On-Demand	Mild	MMP2	20	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C#N)C2CCCCC2)cc1	ZINC000450992503	FG	On-Demand	Mild	LEF	30	45
COC(=O)CCCCCNS(=O)(=O)c1sccc1Cl	ZINC000450992509	EE	On-Demand	Anodyne	KAT2B	0	43
COc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ncn1	ZINC000450992514	GC	On-Demand	Anodyne	LUXN	0	44
CN(CCOc1ccc(Cl)cc1)C(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450992527	GE	On-Demand	Anodyne	COLA	59	38
CN(CCOc1ccc(Cl)cc1)C(=O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450992527	GE	On-Demand	Anodyne	CPT1A	57	38
CN(CCOc1ccc(Cl)cc1)C(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450992528	GE	On-Demand	Anodyne	COLA	59	38
CN(CCOc1ccc(Cl)cc1)C(=O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450992528	GE	On-Demand	Anodyne	CPT1A	57	38
CCOc1ccc(CN(C)C(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450992529	FE	On-Demand	Anodyne	COLA	61	38
CCOc1ccc(CN(C)C(=O)CN2CCCC[C@H]2c2nc(O)n[nH]2)cc1	ZINC000450992529	FE	On-Demand	Anodyne	CPT1A	58	38
CCOc1ccc(CN(C)C(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450992530	FE	On-Demand	Anodyne	COLA	61	38
CCOc1ccc(CN(C)C(=O)CN2CCCC[C@@H]2c2nc(O)n[nH]2)cc1	ZINC000450992530	FE	On-Demand	Anodyne	CPT1A	58	38
COC(=O)c1csc(CN2CCCC[C@@H]2c2nc(C)no2)n1	ZINC000450992531	DE	On-Demand	Anodyne	CPT1A	52	42
COC(=O)c1csc(CN2CCCC[C@H]2c2nc(C)no2)n1	ZINC000450992532	DE	On-Demand	Anodyne	CPT1A	52	42
COc1cc(CN2CCC[C@@H]2C(F)F)ccc1Cl	ZINC000450992546	CH	On-Demand	Anodyne	UTS2R	17	41
Cc1csc(S(=O)(=O)NCCNC(=O)C2CC2)c1	ZINC000450992548	CC	On-Demand	Anodyne	EPHX2	20	41
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(F)cc1	ZINC000450992550	CG	On-Demand	Anodyne	GPBAR1	0	40
C[C@H](SC1CCC1)C(=O)NCCc1ccc(F)cc1	ZINC000450992551	CG	On-Demand	Anodyne	GPBAR1	0	40
CC(C)c1ccccc1NC(=O)CSC1CCC1	ZINC000450992552	CI	On-Demand	Anodyne	KCNQ2	63	35
CC(C)c1ccccc1NC(=O)CSC1CCC1	ZINC000450992552	CI	On-Demand	Anodyne	ACAT	0	45
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450992554	GG	On-Demand	Mild	BMP1	50	36
O=C(CSC1CCC1)NCc1ccc2c(c1)OCO2	ZINC000450992574	CE	On-Demand	Anodyne	PDE5A	35	41
O=C(CSC1CCC1)NCc1ccc2c(c1)OCO2	ZINC000450992574	CE	On-Demand	Anodyne	NOS2	51	46
O=C(CSC1CCC1)NCc1ccc2c(c1)OCO2	ZINC000450992574	CE	On-Demand	Anodyne	SSTR3	75	33
CN(CCNC(=O)Cc1ccc(O)c(F)c1)C(=O)Cc1ccc(O)c(F)c1	ZINC000450992577	GD	On-Demand	Anodyne	NCE103	29	44
CN(CCNC(=O)Cc1ccc(O)c(F)c1)C(=O)Cc1ccc(O)c(F)c1	ZINC000450992577	GD	On-Demand	Anodyne	P96878_MYCTU	19	40
CN(CCNC(=O)Cc1ccc(O)c(F)c1)C(=O)Cc1ccc(O)c(F)c1	ZINC000450992577	GD	On-Demand	Anodyne	CAN2	0	44
C[C@@H](SC1CCC1)C(=O)N(C)Cc1ccccc1	ZINC000450992584	CG	On-Demand	Anodyne	TACR1	24	40
C[C@H](SC1CCC1)C(=O)N(C)Cc1ccccc1	ZINC000450992585	CG	On-Demand	Anodyne	TACR1	24	40
COc1ccc(Cl)cc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450992588	CH	On-Demand	Anodyne	CYSP_TRYCR	0	41
COc1ccc(Cl)cc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450992588	CH	On-Demand	Anodyne	RBP4	25	43
COc1ccc(Cl)cc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450992588	CH	On-Demand	Anodyne	QRFPR	49	39
COc1ccc(Cl)cc1NC(=O)[C@H](C)SC1CCC1	ZINC000450992589	CH	On-Demand	Anodyne	CYSP_TRYCR	0	41
COc1ccc(Cl)cc1NC(=O)[C@H](C)SC1CCC1	ZINC000450992589	CH	On-Demand	Anodyne	RBP4	25	43
COc1ccc(Cl)cc1NC(=O)[C@H](C)SC1CCC1	ZINC000450992589	CH	On-Demand	Anodyne	QRFPR	49	39
CN(Cc1cnn(C)c1)S(=O)(=O)Cc1ccc(Br)c(F)c1	ZINC000450992612	GE	On-Demand	Anodyne	PLA2G7	40	34
COc1ccc(-c2noc(CSC3CCC3)n2)cc1	ZINC000450992618	CH	On-Demand	Anodyne	QRFPR	40	34
COc1ccc(-c2noc(CSC3CCC3)n2)cc1	ZINC000450992618	CH	On-Demand	Anodyne	WNT3A	23	47
COc1ccc(-c2noc(CSC3CCC3)n2)cc1	ZINC000450992618	CH	On-Demand	Anodyne	AXIN2	0	52
COc1ccc(CNC(=O)CCN2CCC=C(c3ccncc3)C2)c(OC)c1	ZINC000450992621	GF	On-Demand	Anodyne	HTR7	26	43
CCCC(=O)Nc1cccc(NS(=O)(=O)c2cc(C)cs2)c1C	ZINC000450992626	FH	On-Demand	Anodyne	RCE1	0	42
COCCOc1ccc(C(F)(F)F)cc1NC(=O)CSC1CCC1	ZINC000450992628	FH	On-Demand	Anodyne	QRFPR	40	33
CCOC(=O)c1oc(N(C)S(=O)(=O)CCC2CCCCC2)nc1C	ZINC000450992629	FF	On-Demand	Anodyne	BMP1	44	40
O=C1CC[C@@H](CN2CCN(c3ccc(C(F)(F)F)cc3Cl)CC2)CCN1	ZINC000450992653	GG	On-Demand	Anodyne	LIPG	48	33
O=C1CC[C@H](CN2CCN(c3ccc(C(F)(F)F)cc3Cl)CC2)CCN1	ZINC000450992654	GG	On-Demand	Anodyne	LIPG	48	33
O=C(CSC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000450992659	CH	On-Demand	Anodyne	RHOA	0	40
O=C(CSC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000450992659	CH	On-Demand	Anodyne	TRPM4	0	40
C[C@H](NC(=O)CSC1CCC1)c1ccc(Br)cc1	ZINC000450992666	EH	On-Demand	Anodyne	SDH1	0	60
C[C@@H](NC(=O)CSC1CCC1)c1ccc(Br)cc1	ZINC000450992667	EH	On-Demand	Anodyne	SDH1	0	60
CCN(CC)C(=O)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450992672	DG	On-Demand	Anodyne	OPRD1	27	41
CCN(CC)C(=O)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450992672	DG	On-Demand	Anodyne	QRFPR	40	35
COc1cc(NC(=O)CSC2CCC2)cc(OC)c1OC	ZINC000450992674	DF	On-Demand	Anodyne	QRFPR	50	42
COc1cc(NC(=O)CSC2CCC2)cc(OC)c1OC	ZINC000450992674	DF	On-Demand	Anodyne	ENPP1	61	35
O=C(CN1CCN(S(=O)(=O)c2cc3cc(F)ccc3o2)CC1)N1CCCC1	ZINC000450992680	GD	On-Demand	Anodyne	LPL	46	35
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992693	FH	On-Demand	Anodyne	CA1	25	40
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992693	FH	On-Demand	Anodyne	MMP13	28	41
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992693	FH	On-Demand	Anodyne	MMP2	24	47
Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992693	FH	On-Demand	Anodyne	LEF	58	39
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992694	FH	On-Demand	Anodyne	CA1	25	40
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992694	FH	On-Demand	Anodyne	MMP13	28	41
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992694	FH	On-Demand	Anodyne	MMP2	24	47
Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450992694	FH	On-Demand	Anodyne	LEF	58	39
CCOC(=O)c1sc(NS(=O)(=O)c2cc(C)cs2)nc1C(C)C	ZINC000450992706	FH	On-Demand	Anodyne	DHODH	24	41
COC(=O)CCCCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450992707	EG	On-Demand	Anodyne	NPY1R	0	46
COC(=O)CCCCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450992707	EG	On-Demand	Anodyne	IAP	0	40
COC(=O)CCCCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450992707	EG	On-Demand	Anodyne	PA2A1_NAJMO	0	41
Cc1cccc(C(C)C)c1NS(=O)(=O)c1sccc1F	ZINC000450992714	DI	On-Demand	Anodyne	ACAT	0	41
Oc1n[nH]c([C@H]2CCCCN2Cc2nc(-c3cccc(Cl)c3)no2)n1	ZINC000450992721	FF	On-Demand	Anodyne	COLA	64	42
Oc1n[nH]c([C@H]2CCCCN2Cc2nc(-c3cccc(Cl)c3)no2)n1	ZINC000450992721	FF	On-Demand	Anodyne	CPT1A	49	40
Oc1n[nH]c([C@H]2CCCCN2Cc2nc(-c3cccc(Cl)c3)no2)n1	ZINC000450992721	FF	On-Demand	Anodyne	GRM5	28	51
Oc1n[nH]c([C@@H]2CCCCN2Cc2nc(-c3cccc(Cl)c3)no2)n1	ZINC000450992722	FF	On-Demand	Anodyne	COLA	64	42
Oc1n[nH]c([C@@H]2CCCCN2Cc2nc(-c3cccc(Cl)c3)no2)n1	ZINC000450992722	FF	On-Demand	Anodyne	CPT1A	49	40
Oc1n[nH]c([C@@H]2CCCCN2Cc2nc(-c3cccc(Cl)c3)no2)n1	ZINC000450992722	FF	On-Demand	Anodyne	GRM5	28	51
O=C(CSC1CCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000450992727	EF	On-Demand	Anodyne	L3MBTL1	0	43
O=C(CSC1CCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000450992727	EF	On-Demand	Anodyne	L3MBTL3	67	43
O=C(CSC1CCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000450992727	EF	On-Demand	Anodyne	MBTD1	0	43
O=S(=O)(Cc1c(F)cccc1Cl)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450992754	GG	On-Demand	Anodyne	DRD2	16	44
O=S(=O)(Cc1c(F)cccc1Cl)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450992754	GG	On-Demand	Anodyne	DRD4	39	45
O=S(=O)(Cc1c(F)cccc1Cl)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450992754	GG	On-Demand	Anodyne	ACHE	19	41
O=S(=O)(Cc1c(F)cccc1Cl)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450992754	GG	On-Demand	Anodyne	DRD3	0	40
O=S(=O)(Cc1c(F)cccc1Cl)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450992754	GG	On-Demand	Anodyne	SIGMAR1	43	53
O=S(=O)(Cc1c(F)cccc1Cl)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000450992754	GG	On-Demand	Anodyne	CCR3	24	42
O=S(=O)(Cc1c(F)cccc1Cl)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450992755	GG	On-Demand	Anodyne	DRD2	16	44
O=S(=O)(Cc1c(F)cccc1Cl)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450992755	GG	On-Demand	Anodyne	DRD4	39	45
O=S(=O)(Cc1c(F)cccc1Cl)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450992755	GG	On-Demand	Anodyne	ACHE	19	41
O=S(=O)(Cc1c(F)cccc1Cl)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450992755	GG	On-Demand	Anodyne	DRD3	0	40
O=S(=O)(Cc1c(F)cccc1Cl)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450992755	GG	On-Demand	Anodyne	SIGMAR1	43	53
O=S(=O)(Cc1c(F)cccc1Cl)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000450992755	GG	On-Demand	Anodyne	CCR3	24	42
O=c1onc(-c2ccccc2)n1C[C@@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450992758	GC	On-Demand	Anodyne	COLA	75	37
O=c1onc(-c2ccccc2)n1C[C@@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450992758	GC	On-Demand	Anodyne	CPT1A	74	37
Fc1cc(CSC2CCC2)c2ncccc2c1	ZINC000450992764	BI	On-Demand	Anodyne	QRFPR	41	35
O=c1onc(-c2ccccc2)n1C[C@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450992765	GC	On-Demand	Anodyne	COLA	75	37
O=c1onc(-c2ccccc2)n1C[C@H](O)CN1CCCC[C@H]1c1nc(O)n[nH]1	ZINC000450992765	GC	On-Demand	Anodyne	CPT1A	74	37
O=c1onc(-c2ccccc2)n1C[C@@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450992767	GC	On-Demand	Anodyne	COLA	75	37
O=c1onc(-c2ccccc2)n1C[C@@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450992767	GC	On-Demand	Anodyne	CPT1A	74	37
CCOC(=O)c1ccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)nc1	ZINC000450992769	GG	On-Demand	Mild	P2RY12	50	37
CCOC(=O)c1ccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)nc1	ZINC000450992769	GG	On-Demand	Mild	SSTR5	61	41
O=c1onc(-c2ccccc2)n1C[C@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450992770	GC	On-Demand	Anodyne	COLA	75	37
O=c1onc(-c2ccccc2)n1C[C@H](O)CN1CCCC[C@@H]1c1nc(O)n[nH]1	ZINC000450992770	GC	On-Demand	Anodyne	CPT1A	74	37
Nc1ncccc1CN1CCCN(c2ccccc2F)CC1	ZINC000450992775	DF	On-Demand	Anodyne	DRD1	0	44
Nc1ncccc1CN1CCCN(c2ccccc2F)CC1	ZINC000450992775	DF	On-Demand	Anodyne	DRD4	35	58
Nc1ncccc1CN1CCCN(c2ccccc2F)CC1	ZINC000450992775	DF	On-Demand	Anodyne	DRD3	22	45
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	HTR1A	55	43
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	DRD2	56	44
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	DRD4	37	42
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	HTR2A	31	43
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	HTR2C	29	41
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	ADRA1A	29	42
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	ADRA1B	23	40
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	DRD3	61	43
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	HTR7	43	35
COC(=O)c1coc(CN2CCCN(c3ccccc3F)CC2)n1	ZINC000450992776	EE	On-Demand	Anodyne	KCNQ2	50	35
C[C@H](SC1CCC1)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000450992777	DG	On-Demand	Anodyne	KCNQ2	23	43
C[C@H](NC(=O)[C@@H](C)SC1CCC1)c1ccc2c(c1)OCCO2	ZINC000450992778	DG	On-Demand	Anodyne	KCNQ2	23	43
C[C@H](SC1CCC1)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000450992780	DG	On-Demand	Anodyne	KCNQ2	23	43
C[C@@H](SC1CCC1)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000450992781	DG	On-Demand	Anodyne	KCNQ2	23	43
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450992786	FG	On-Demand	Anodyne	TPP2	54	32
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@H]1Cc2ccccc2N(C)C1	ZINC000450992787	FG	On-Demand	Anodyne	TPP2	54	32
C[C@H](OCc1ccc(F)cc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450992788	FG	On-Demand	Anodyne	TPP2	54	32
C[C@@H](OCc1ccc(F)cc1)C(=O)NC[C@@H]1Cc2ccccc2N(C)C1	ZINC000450992789	FG	On-Demand	Anodyne	TPP2	54	32
COC(=O)c1ccc([C@@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450992806	GD	On-Demand	Anodyne	CTSF	45	32
COC(=O)c1ccc([C@H](NC(=O)CS(=O)(=O)C2CC2)C(F)(F)F)cc1	ZINC000450992807	GD	On-Demand	Anodyne	CTSF	45	32
O=S(=O)(NCc1ccc(OC(F)F)cc1)c1ccc(C2CC2)cc1	ZINC000450992822	FH	On-Demand	Anodyne	A6YCJ1_9METZ	15	42
COc1ccc(NC(=O)CSC2CCC2)cc1Cl	ZINC000450992823	CH	On-Demand	Anodyne	CYSP_TRYCR	0	46
COc1ccc(NC(=O)CSC2CCC2)cc1Cl	ZINC000450992823	CH	On-Demand	Anodyne	QRFPR	60	52
COc1ccc(NC(=O)CSC2CCC2)cc1Cl	ZINC000450992823	CH	On-Demand	Anodyne	ENPP1	70	44
CCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc(C)n1	ZINC000450992825	FF	On-Demand	Anodyne	LEF	56	37
CCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc(C)n1	ZINC000450992825	FF	On-Demand	Anodyne	PFK	0	44
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)n1	ZINC000450992828	GI	On-Demand	Anodyne	COLA	66	41
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)n1	ZINC000450992828	GI	On-Demand	Anodyne	CPT1A	63	41
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)n1	ZINC000450992828	GI	On-Demand	Anodyne	CYP2J2	48	36
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)n1	ZINC000450992829	GI	On-Demand	Anodyne	COLA	66	41
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)n1	ZINC000450992829	GI	On-Demand	Anodyne	CPT1A	63	41
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(Br)cc2)n1	ZINC000450992829	GI	On-Demand	Anodyne	CYP2J2	48	36
CN(C)C(=O)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450992832	CF	On-Demand	Anodyne	QRFPR	41	35
CC(C)NC(=O)CN1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1	ZINC000450992849	GD	On-Demand	Anodyne	AVPR1B	45	38
CCOc1ccc(NC(=O)c2ccc(NC(=O)CSC3CCC3)cc2)cc1	ZINC000450992881	GJ	On-Demand	Anodyne	PRNP	60	42
CCOc1ccc(NC(=O)c2ccc(NC(=O)CSC3CCC3)cc2)cc1	ZINC000450992881	GJ	On-Demand	Anodyne	P4HTM	0	49
CCOc1ccc(NC(=O)c2ccc(NC(=O)CSC3CCC3)cc2)cc1	ZINC000450992881	GJ	On-Demand	Anodyne	QRFPR	40	34
CCOc1ccc(NC(=O)c2ccc(NC(=O)CSC3CCC3)cc2)cc1	ZINC000450992881	GJ	On-Demand	Anodyne	NOD2	45	48
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)c1	ZINC000450992884	GI	On-Demand	Anodyne	HPGD	17	44
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)c1	ZINC000450992884	GI	On-Demand	Anodyne	TRPC6	48	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2C)c1	ZINC000450992884	GI	On-Demand	Anodyne	TRPC3	46	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2C)c1	ZINC000450992885	GI	On-Demand	Anodyne	HPGD	17	44
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2C)c1	ZINC000450992885	GI	On-Demand	Anodyne	TRPC6	48	34
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2C)c1	ZINC000450992885	GI	On-Demand	Anodyne	TRPC3	46	34
C[C@@H](c1ccc(Oc2ccccc2)cc1)N(C)CCC(N)=O	ZINC000450992894	CG	On-Demand	Anodyne	LTA4H	29	43
C[C@@H](c1ccc(Oc2ccccc2)cc1)N(C)CCC(N)=O	ZINC000450992894	CG	On-Demand	Anodyne	ACACA	47	43
C[C@H](c1ccc(Oc2ccccc2)cc1)N(C)CCC(N)=O	ZINC000450992895	CG	On-Demand	Anodyne	LTA4H	29	43
C[C@H](c1ccc(Oc2ccccc2)cc1)N(C)CCC(N)=O	ZINC000450992895	CG	On-Demand	Anodyne	ACACA	47	43
C[C@@H]1CCC[C@@](C#N)(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450992896	GE	On-Demand	Mild	LUXN	0	44
C[C@H]1CCC[C@@](C#N)(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450992897	GE	On-Demand	Mild	LUXN	0	44
C[C@@H]1CCC[C@](C#N)(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450992898	GE	On-Demand	Mild	LUXN	0	44
C[C@H]1CCC[C@](C#N)(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)C1	ZINC000450992899	GE	On-Demand	Mild	LUXN	0	44
O=C(CCCN1CCC=C(c2ccncc2)C1)c1ccc(F)cc1	ZINC000450992902	DH	On-Demand	Anodyne	DRD2	30	45
O=C(CCCN1CCC=C(c2ccncc2)C1)c1ccc(F)cc1	ZINC000450992902	DH	On-Demand	Anodyne	DRD4	0	45
O=C(CCCN1CCC=C(c2ccncc2)C1)c1ccc(F)cc1	ZINC000450992902	DH	On-Demand	Anodyne	HTR2A	20	52
O=C(CCCN1CCC=C(c2ccncc2)C1)c1ccc(F)cc1	ZINC000450992902	DH	On-Demand	Anodyne	ERG2	20	44
O=C(CCCN1CCC=C(c2ccncc2)C1)c1ccc(F)cc1	ZINC000450992902	DH	On-Demand	Anodyne	SLC18A3	0	48
O=C(CCCN1CCC=C(c2ccncc2)C1)c1ccc(F)cc1	ZINC000450992902	DH	On-Demand	Anodyne	CYP2J2	46	33
CSc1cccc(C(=O)NCCN(C)C(=O)c2cccc(SC)c2)c1	ZINC000450992912	FH	On-Demand	Anodyne	DRD4	41	31
CCc1ccc([C@@H](C)NC(=O)CSC2CCC2)cc1	ZINC000450992916	CH	On-Demand	Anodyne	SDH1	0	43
CCc1ccc([C@H](C)NC(=O)CSC2CCC2)cc1	ZINC000450992917	CH	On-Demand	Anodyne	SDH1	0	43
Cc1csc(S(=O)(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)cc2)c1	ZINC000450992929	GI	On-Demand	Anodyne	ITK	15	40
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	CA2	33	52
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	ADRB2	16	44
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	BMP1	48	35
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	CA1	40	44
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	CA7	15	44
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	TRPV1	48	33
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	MMP13	53	42
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	CA4	28	44
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	CA14	23	42
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	MMP2	43	44
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	MMP3	25	42
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	MMP8	27	44
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	MMP9	27	44
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	MMP12	62	42
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	CA12	34	42
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	MMP7	26	42
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	ADAMTS4	48	33
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	CA9	36	42
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	MMP1	15	42
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	ALS	86	41
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	LEF	40	35
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	IDO1	35	43
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	PFK	0	40
COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450992940	GD	On-Demand	Anodyne	ILV2	0	43
CC[C@@H](C)Oc1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450992941	FF	On-Demand	Anodyne	GPR119	0	43
CC[C@H](C)Oc1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450992942	FF	On-Demand	Anodyne	GPR119	0	43
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1sccc1C	ZINC000450992944	EE	On-Demand	Anodyne	MAP1	53	35
COc1cc(OC)c(NC(=O)CSC2CCC2)cc1Cl	ZINC000450992959	DH	On-Demand	Anodyne	HTR4	63	43
COc1cc(OC)c(NC(=O)CSC2CCC2)cc1Cl	ZINC000450992959	DH	On-Demand	Anodyne	QRFPR	47	41
Cc1csc(S(=O)(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)c1	ZINC000450992964	GG	On-Demand	Anodyne	LPL	42	33
O=C(CCCN1C[C@@H]2CCS(=O)(=O)[C@@H]2C1)c1ccc(F)cc1	ZINC000450992965	ED	On-Demand	Anodyne	DRD2	29	43
O=C(CCCN1C[C@@H]2CCS(=O)(=O)[C@@H]2C1)c1ccc(F)cc1	ZINC000450992965	ED	On-Demand	Anodyne	DRD4	0	55
O=C(CCCN1C[C@@H]2CCS(=O)(=O)[C@@H]2C1)c1ccc(F)cc1	ZINC000450992965	ED	On-Demand	Anodyne	SLC18A3	0	43
O=C(CCCN1C[C@@H]2CCS(=O)(=O)[C@@H]2C1)c1ccc(F)cc1	ZINC000450992965	ED	On-Demand	Anodyne	CYP2J2	51	36
CC(C)[C@@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450992975	DH	On-Demand	Anodyne	BIRC3	53	42
CC(C)[C@@H](SC1CCC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000450992976	DH	On-Demand	Anodyne	BIRC3	53	42
CC(C)[C@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450992977	DH	On-Demand	Anodyne	XIAP	31	42
CC(C)[C@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450992977	DH	On-Demand	Anodyne	BIRC3	53	42
CC(C)[C@H](SC1CCC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000450992977	DH	On-Demand	Anodyne	BIRC2	30	42
CC(C)[C@H](SC1CCC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000450992978	DH	On-Demand	Anodyne	BIRC3	53	42
CCN(c1cccc(C)c1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450992982	GF	On-Demand	Anodyne	LUXN	0	43
CCc1ccc([C@H]2CCCN(CC[C@@H](C)O)C2)cc1	ZINC000450992988	CG	On-Demand	Anodyne	BIRC2	45	33
CCc1ccc([C@@H]2CCCN(CC[C@@H](C)O)C2)cc1	ZINC000450992989	CG	On-Demand	Anodyne	BIRC2	45	33
CCc1ccc([C@@H]2CCCN(CC[C@H](C)O)C2)cc1	ZINC000450992990	CG	On-Demand	Anodyne	BIRC2	45	33
CCc1ccc([C@H]2CCCN(CC[C@H](C)O)C2)cc1	ZINC000450992991	CG	On-Demand	Anodyne	BIRC2	45	33
C[C@@H](c1ccccc1)N(C)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450993008	FF	On-Demand	Anodyne	RORB	0	47
C[C@H](c1ccccc1)N(C)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450993009	FF	On-Demand	Anodyne	RORB	0	47
O=[N+]([O-])c1cccc(-c2noc(CSC3CCC3)n2)c1	ZINC000450993017	CG	On-Demand	Bother	GRM5	16	43
O=C(CSC1CCC1)N[C@@H]1CCOc2ccccc21	ZINC000450993019	CF	On-Demand	Anodyne	BDKRB1	23	47
O=C(CSC1CCC1)N[C@@H]1CCOc2ccccc21	ZINC000450993019	CF	On-Demand	Anodyne	LUXR	74	41
O=C(CSC1CCC1)N[C@@H]1CCOc2ccccc21	ZINC000450993019	CF	On-Demand	Anodyne	TRAR	83	41
O=C(CSC1CCC1)N[C@@H]1CCOc2ccccc21	ZINC000450993019	CF	On-Demand	Anodyne	PHZR	0	42
CCOC(=O)c1ccc(CS(=O)(=O)NCc2ccc(OC(F)F)cc2)cc1	ZINC000450993021	GG	On-Demand	Anodyne	TMPRSS11D	53	32
Cc1ccc2cc(S(=O)(=O)NCCNC(=O)C3CC3)ccc2c1	ZINC000450993032	ED	On-Demand	Anodyne	NPY2R	34	44
CCN(CC)S(=O)(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993038	FF	On-Demand	Anodyne	CA4	15	41
CN(Cc1ccc2c(c1)OCO2)S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450993045	FG	On-Demand	Anodyne	PKM	16	40
CC(=O)c1cccc(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450993052	CH	On-Demand	Anodyne	CCR3	21	40
CC(=O)c1cccc(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450993052	CH	On-Demand	Anodyne	AKR1C3	16	43
CC(=O)c1cccc(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450993052	CH	On-Demand	Anodyne	KCNK3	74	40
CC(=O)c1cccc(NC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450993052	CH	On-Demand	Anodyne	PARP10	0	40
CC(=O)c1cccc(NC(=O)[C@H](C)SC2CCC2)c1	ZINC000450993053	CH	On-Demand	Anodyne	PARP10	0	40
COCC1(S(=O)(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450993081	EG	On-Demand	Anodyne	SOAT1	22	40
COCC1(S(=O)(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000450993082	EG	On-Demand	Anodyne	SOAT1	22	40
CNC(=O)CC[C@@H]1CCCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450993094	GH	On-Demand	Anodyne	CYP2J2	47	34
CNC(=O)CC[C@H]1CCCCN1CCCC(=O)c1ccc(Br)cc1	ZINC000450993095	GH	On-Demand	Anodyne	CYP2J2	47	34
CC(=O)c1ccc(CN2CCC=C(c3ccncc3)C2)cc1	ZINC000450993096	CH	On-Demand	Anodyne	NOD2	40	34
CCOC(=O)c1cnc(C)c(NS(=O)(=O)Cc2c(F)cccc2Cl)c1	ZINC000450993098	GG	On-Demand	Anodyne	P2RY12	30	40
CCOC[C@H](C)CS(=O)(=O)N1CCN(Cc2ccc(OC)c(F)c2)CC1	ZINC000450993106	GD	On-Demand	Anodyne	SSTR5	41	34
CCOC[C@@H](C)CS(=O)(=O)N1CCN(Cc2ccc(OC)c(F)c2)CC1	ZINC000450993107	GD	On-Demand	Anodyne	SSTR5	41	34
CNC(=O)CC[C@@H]1CCCCN1C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450993109	DF	On-Demand	Anodyne	BIRC2	40	34
CNC(=O)CC[C@@H]1CCCCN1C[C@H](O)[C@H](C)c1ccccc1	ZINC000450993110	DF	On-Demand	Anodyne	BIRC2	40	34
CNC(=O)CC[C@@H]1CCCCN1C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450993111	DF	On-Demand	Anodyne	BIRC2	40	34
CNC(=O)CC[C@@H]1CCCCN1C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450993112	DF	On-Demand	Anodyne	BIRC2	40	34
COc1ccc(CNC(=O)CCN2CCCC[C@H]2c2nc(C)no2)c(OC)c1	ZINC000450993113	GF	On-Demand	Anodyne	COLA	65	42
COc1ccc(CNC(=O)CCN2CCCC[C@H]2c2nc(C)no2)c(OC)c1	ZINC000450993113	GF	On-Demand	Anodyne	CPT1A	62	42
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2c2nc(C)no2)c(OC)c1	ZINC000450993114	GF	On-Demand	Anodyne	COLA	65	42
COc1ccc(CNC(=O)CCN2CCCC[C@@H]2c2nc(C)no2)c(OC)c1	ZINC000450993114	GF	On-Demand	Anodyne	CPT1A	62	42
O=C(CSC1CCC1)Nc1cccc2ccccc12	ZINC000450993115	CI	On-Demand	Anodyne	TRPV1	37	40
O=C(CSC1CCC1)N[C@H]1CCOc2ccccc21	ZINC000450993120	CF	On-Demand	Anodyne	BDKRB1	23	47
O=C(CSC1CCC1)N[C@H]1CCOc2ccccc21	ZINC000450993120	CF	On-Demand	Anodyne	LUXR	74	41
O=C(CSC1CCC1)N[C@H]1CCOc2ccccc21	ZINC000450993120	CF	On-Demand	Anodyne	TRAR	83	41
O=C(CSC1CCC1)N[C@H]1CCOc2ccccc21	ZINC000450993120	CF	On-Demand	Anodyne	PHZR	0	42
CC(C)[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450993122	CH	On-Demand	Anodyne	XIAP	45	37
CC(C)[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450993123	CH	On-Demand	Anodyne	XIAP	45	37
COc1ccccc1O[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450993126	EF	On-Demand	Anodyne	ADRB1	18	44
COc1ccccc1O[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1	ZINC000450993127	EF	On-Demand	Anodyne	ADRB1	18	44
CCOC(=O)[C@H]1CCCN(C(=O)[C@@H](C)SC2CCC2)C1	ZINC000450993139	CE	On-Demand	Anodyne	RHODESAIN	0	46
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)SC2CCC2)C1	ZINC000450993140	CE	On-Demand	Anodyne	RHODESAIN	0	46
CCOC(=O)[C@H]1CCCN(C(=O)[C@H](C)SC2CCC2)C1	ZINC000450993141	CE	On-Demand	Anodyne	RHODESAIN	0	46
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)SC2CCC2)C1	ZINC000450993142	CE	On-Demand	Anodyne	RHODESAIN	0	46
Clc1ccc(-c2noc(CSC3CCC3)n2)cc1	ZINC000450993143	CI	On-Demand	Anodyne	TNKS2	15	45
FC(F)OC[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450993145	CG	On-Demand	Anodyne	SLC6A1	22	44
FC(F)OC[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC000450993146	CG	On-Demand	Anodyne	SLC6A1	22	44
CC(C)(C)NC(=O)c1ccccc1NS(=O)(=O)c1sccc1Cl	ZINC000450993147	FH	On-Demand	Anodyne	PRTN3	59	38
CC[C@@H](O)CC(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1	ZINC000450993149	EF	On-Demand	Anodyne	RORC	18	44
CC[C@H](O)CC(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1	ZINC000450993150	EF	On-Demand	Anodyne	RORC	18	44
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993154	GJ	On-Demand	Anodyne	OPRK1	18	41
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993154	GJ	On-Demand	Anodyne	NPY2R	48	34
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993154	GJ	On-Demand	Anodyne	PRNP	45	37
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993154	GJ	On-Demand	Anodyne	KCNK3	113	43
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993154	GJ	On-Demand	Anodyne	KCNK9	69	40
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993155	GJ	On-Demand	Anodyne	OPRK1	18	41
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993155	GJ	On-Demand	Anodyne	NPY2R	48	34
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993155	GJ	On-Demand	Anodyne	PRNP	45	37
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993155	GJ	On-Demand	Anodyne	KCNK3	113	43
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC1CCC1	ZINC000450993155	GJ	On-Demand	Anodyne	KCNK9	69	40
COc1ccccc1CCNC(=O)CSC1CCC1	ZINC000450993162	CF	On-Demand	Anodyne	NQO2	24	40
COc1ccccc1CCNC(=O)CSC1CCC1	ZINC000450993162	CF	On-Demand	Anodyne	MTNR1A	46	34
COc1ccccc1CCNC(=O)CSC1CCC1	ZINC000450993162	CF	On-Demand	Anodyne	MTNR1B	51	37
COc1ccccc1CCNC(=O)CSC1CCC1	ZINC000450993162	CF	On-Demand	Anodyne	QRFPR	49	43
COc1ccccc1CCNC(=O)CSC1CCC1	ZINC000450993162	CF	On-Demand	Anodyne	MBTPS1	48	38
COc1cc(OC)c(OC)cc1CNC(=O)CSC1CCC1	ZINC000450993164	EF	On-Demand	Anodyne	QRFPR	46	38
COC(=O)[C@@H](CC(C)C)NC(=O)CSC1CCC1	ZINC000450993169	CD	On-Demand	Anodyne	FOLH1	45	40
COC(=O)[C@@H](CC(C)C)NC(=O)CSC1CCC1	ZINC000450993169	CD	On-Demand	Anodyne	NPR	17	45
COC(=O)[C@H](CC(C)C)NC(=O)CSC1CCC1	ZINC000450993170	CD	On-Demand	Anodyne	FOLH1	45	40
COC(=O)[C@H](CC(C)C)NC(=O)CSC1CCC1	ZINC000450993170	CD	On-Demand	Anodyne	NPR	17	45
O=C(CCCN1C[C@@H]2CCS(=O)(=O)[C@@H]2C1)c1ccc(Br)cc1	ZINC000450993173	GF	On-Demand	Anodyne	HDAC8	17	40
O=C(CCCN1C[C@@H]2CCS(=O)(=O)[C@@H]2C1)c1ccc(Br)cc1	ZINC000450993173	GF	On-Demand	Anodyne	CYP2J2	51	36
COc1cc(-c2noc(CN3CCC[C@H](Oc4ccccc4OC)C3)n2)ncn1	ZINC000450993174	GF	On-Demand	Anodyne	PDE3B	46	33
COc1cc(-c2noc(CN3CCC[C@@H](Oc4ccccc4OC)C3)n2)ncn1	ZINC000450993175	GF	On-Demand	Anodyne	PDE3B	46	33
C[C@@H](SC1CCC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000450993185	EJ	On-Demand	Anodyne	TRPV1	15	43
C[C@H](SC1CCC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000450993186	EJ	On-Demand	Anodyne	TRPV1	15	43
CCS(=O)(=O)c1ccc(CN(C)C2(CO)CC2)cc1	ZINC000450993193	CD	On-Demand	Anodyne	RORC	18	40
CC(C)c1nnc(CN2CCCN(c3ccccc3F)CC2)s1	ZINC000450993199	EH	On-Demand	Anodyne	HTR1A	19	43
CC(C)c1nnc(CN2CCCN(c3ccccc3F)CC2)s1	ZINC000450993199	EH	On-Demand	Anodyne	DRD2	21	46
CC(C)c1nnc(CN2CCCN(c3ccccc3F)CC2)s1	ZINC000450993199	EH	On-Demand	Anodyne	DRD4	24	46
CC(C)c1nnc(CN2CCCN(c3ccccc3F)CC2)s1	ZINC000450993199	EH	On-Demand	Anodyne	DRD3	15	46
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000450993206	FH	On-Demand	Mild	HRH1	0	42
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000450993207	FH	On-Demand	Mild	HRH1	0	42
C[C@H](c1ccccc1)[C@H](O)CN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000450993208	FH	On-Demand	Mild	HRH1	0	42
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000450993209	FH	On-Demand	Mild	HRH1	0	42
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	HTR1A	29	40
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	DRD2	41	44
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	DRD4	53	43
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	ACHE	33	44
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	SLC6A1	73	41
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	DRD3	29	43
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	PDE4A	26	45
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	HRH3	17	46
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	SIGMAR1	38	44
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	CHEK2	19	40
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	CCR3	40	39
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	SLC18A3	19	42
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	MLNR	43	36
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	MCHR1	27	42
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	MBTPS1	58	43
COc1ccccc1O[C@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993212	EH	On-Demand	Anodyne	ACKR3	64	34
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	HTR1A	29	40
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	DRD2	41	44
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	DRD4	53	43
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	ACHE	33	44
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	SLC6A1	73	41
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	DRD3	29	43
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	PDE4A	26	45
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	HRH3	17	46
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	SIGMAR1	38	44
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	CHEK2	19	40
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	CCR3	40	39
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	SLC18A3	19	42
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	MLNR	43	36
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	MCHR1	27	42
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	MBTPS1	58	43
COc1ccccc1O[C@@H]1CCCN(Cc2ccc(C(C)=O)cc2)C1	ZINC000450993213	EH	On-Demand	Anodyne	ACKR3	64	34
CCN(C(=O)[C@@H](C)SC1CCC1)c1ccccc1	ZINC000450993233	CH	On-Demand	Anodyne	AMY2	47	34
CCN(C(=O)[C@H](C)SC1CCC1)c1ccccc1	ZINC000450993234	CH	On-Demand	Anodyne	AMY2	47	34
C[C@@H](SC1CCC1)C(=O)Nc1cccc(Cl)c1	ZINC000450993243	CH	On-Demand	Anodyne	GRM5	15	44
C[C@@H](SC1CCC1)C(=O)Nc1cccc(Cl)c1	ZINC000450993243	CH	On-Demand	Anodyne	MCHR1	17	42
C[C@@H](SC1CCC1)C(=O)Nc1cccc(Cl)c1	ZINC000450993243	CH	On-Demand	Anodyne	PSBA	0	46
C[C@H](SC1CCC1)C(=O)Nc1cccc(Cl)c1	ZINC000450993244	CH	On-Demand	Anodyne	PSBA	0	46
CCOC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)cc1	ZINC000450993249	GF	On-Demand	Anodyne	BMP1	67	40
C[C@@H](SC1CCC1)C(=O)Nc1ccc(F)cc1Cl	ZINC000450993250	CI	On-Demand	Anodyne	PYGL	26	40
C[C@H](SC1CCC1)C(=O)Nc1ccc(F)cc1Cl	ZINC000450993251	CI	On-Demand	Anodyne	PYGL	26	40
CCN(CC(=O)N1CCCCCC1)Cc1ccc(C(=O)OC)c(Cl)c1	ZINC000450993257	FG	On-Demand	Anodyne	OPRK1	27	42
COc1cc([N+](=O)[O-])ccc1NC(=O)CSC1CCC1	ZINC000450993258	CF	On-Demand	Bother	KCNMA1	24	52
COc1cc([N+](=O)[O-])ccc1NC(=O)CSC1CCC1	ZINC000450993258	CF	On-Demand	Bother	QRFPR	45	37
CC(C)C(=O)NCCNS(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450993259	ED	On-Demand	Anodyne	P2RX7	15	43
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCC[C@H]2Cn2ccnc2)c1	ZINC000450993272	GE	On-Demand	Anodyne	CASP7	48	33
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCC[C@@H]2Cn2ccnc2)c1	ZINC000450993273	GE	On-Demand	Anodyne	CASP7	48	33
O=C(NCCNS(=O)(=O)c1ccc2ccccc2c1F)C1CC1	ZINC000450993275	ED	On-Demand	Anodyne	NPY2R	63	50
O=C(NCCNS(=O)(=O)c1ccc2ccccc2c1F)C1CC1	ZINC000450993275	ED	On-Demand	Anodyne	NPY5R	26	40
CCN(Cc1ccccc1)C(=O)CSC1CCC1	ZINC000450993277	CG	On-Demand	Anodyne	PTGES	0	42
CC(C)(C)c1nc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450993278	GD	On-Demand	Anodyne	PRTN3	51	32
CC(C)(C)c1nc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)no1	ZINC000450993278	GD	On-Demand	Anodyne	LUXN	0	48
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)CCCCF	ZINC000450993283	FG	On-Demand	Anodyne	MAPK14	43	38
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)CCCCF	ZINC000450993283	FG	On-Demand	Anodyne	MAPK13	57	32
O=S(=O)(NCc1nnc2n1CCCCC2)c1sccc1Cl	ZINC000450993284	EE	On-Demand	Anodyne	HSD11B2	20	41
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	MAOA	0	43
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	MAOB	31	43
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	COLA	23	43
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	CPT1A	18	43
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	ROCK1	22	46
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	ROCK2	16	46
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	HDAC9	20	54
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	CDC25C	0	41
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	CDK5	33	40
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	TRPA1	21	49
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	VCP	31	42
O=C(CSC1CCC1)Nc1nc(-c2ccccc2)cs1	ZINC000450993295	DI	On-Demand	Anodyne	SLC12A5	22	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3ccncc32)cc1	ZINC000450993296	EE	On-Demand	Anodyne	CPT1A	24	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3ccncc32)cc1	ZINC000450993296	EE	On-Demand	Anodyne	TGM2	57	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3ccncc32)cc1	ZINC000450993296	EE	On-Demand	Anodyne	F13A1	83	38
O=C(CSC1CCC1)Nc1ccc(F)cc1F	ZINC000450993297	CG	On-Demand	Anodyne	ACAT	0	42
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993298	EH	On-Demand	Anodyne	DRD4	0	40
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993298	EH	On-Demand	Anodyne	HTR2A	19	41
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993298	EH	On-Demand	Anodyne	COLA	71	39
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993298	EH	On-Demand	Anodyne	CPT1A	68	39
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993298	EH	On-Demand	Anodyne	GRM5	0	49
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993298	EH	On-Demand	Anodyne	HTR3B	0	43
Cc1noc([C@@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993298	EH	On-Demand	Anodyne	CYP2J2	48	36
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993299	EH	On-Demand	Anodyne	DRD4	0	40
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993299	EH	On-Demand	Anodyne	HTR2A	19	41
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993299	EH	On-Demand	Anodyne	COLA	71	39
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993299	EH	On-Demand	Anodyne	CPT1A	68	39
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993299	EH	On-Demand	Anodyne	GRM5	0	49
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993299	EH	On-Demand	Anodyne	HTR3B	0	43
Cc1noc([C@H]2CCCCN2CCCC(=O)c2ccc(F)cc2)n1	ZINC000450993299	EH	On-Demand	Anodyne	CYP2J2	48	36
C[C@@H](SC1CCC1)C(=O)Nc1cccc2ccccc12	ZINC000450993304	CI	On-Demand	Anodyne	KCNQ2	45	34
C[C@H](SC1CCC1)C(=O)Nc1cccc2ccccc12	ZINC000450993305	CI	On-Demand	Anodyne	KCNQ2	45	34
CCN(C(=O)CSC1CCC1)C1CCCCC1	ZINC000450993306	CG	On-Demand	Anodyne	ADH1A	0	42
COC(=O)c1ncccc1S(=O)(=O)NCCOc1ccc(C(C)(C)C)cc1	ZINC000450993314	GF	On-Demand	Anodyne	EDNRA	15	41
COc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993322	CF	On-Demand	Anodyne	MTNR1A	38	40
COc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993322	CF	On-Demand	Anodyne	MTNR1B	31	42
COc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993322	CF	On-Demand	Anodyne	ACR	24	40
COc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993322	CF	On-Demand	Anodyne	PDE9A	0	44
COc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993322	CF	On-Demand	Anodyne	ELOVL6	0	40
COc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993322	CF	On-Demand	Anodyne	QRFPR	49	40
COc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993322	CF	On-Demand	Anodyne	ENPP1	59	34
O=C(CSC1CCC1)Nc1cccc(I)c1	ZINC000450993328	EH	On-Demand	Anodyne	QRFPR	43	37
COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450993341	GJ	On-Demand	Anodyne	PRNP	40	33
COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450993341	GJ	On-Demand	Anodyne	QRFPR	41	37
COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450993342	GJ	On-Demand	Anodyne	PRNP	40	33
COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450993342	GJ	On-Demand	Anodyne	QRFPR	41	37
Cc1noc([C@@H]2CCCCN2C[C@H](O)[C@H](C)c2ccccc2)n1	ZINC000450993345	DG	On-Demand	Anodyne	CPT1A	63	40
Cc1noc([C@@H]2CCCCN2C[C@H](O)[C@@H](C)c2ccccc2)n1	ZINC000450993346	DG	On-Demand	Anodyne	CPT1A	63	40
Cc1noc([C@@H]2CCCCN2C[C@@H](O)[C@@H](C)c2ccccc2)n1	ZINC000450993347	DG	On-Demand	Anodyne	CPT1A	63	40
Cc1noc([C@@H]2CCCCN2C[C@@H](O)[C@H](C)c2ccccc2)n1	ZINC000450993348	DG	On-Demand	Anodyne	CPT1A	63	40
Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)SC1CCC1	ZINC000450993356	CJ	On-Demand	Anodyne	ACAT	0	47
Cc1cccc(C(C)C)c1NC(=O)[C@H](C)SC1CCC1	ZINC000450993357	CJ	On-Demand	Anodyne	ACAT	0	47
Cc1cc(C)c(NC(=O)[C@@H](C)SC2CCC2)c(C)c1	ZINC000450993366	CI	On-Demand	Anodyne	PYGL	42	37
Cc1cc(C)c(NC(=O)[C@H](C)SC2CCC2)c(C)c1	ZINC000450993367	CI	On-Demand	Anodyne	PYGL	42	37
O=C(CSC1CCC1)Nc1ccccc1Cl	ZINC000450993379	CH	On-Demand	Anodyne	KCNQ2	50	45
O=C(CSC1CCC1)Nc1ccccc1Cl	ZINC000450993379	CH	On-Demand	Anodyne	EPHB3	49	36
O=C(CCCN1CCC[C@@H]1C(F)F)c1ccccc1	ZINC000450993385	CG	On-Demand	Anodyne	HTR3B	0	40
O=C(CCCN1CCC[C@@H]1C(F)F)c1ccccc1	ZINC000450993385	CG	On-Demand	Anodyne	CYP2J2	57	41
CCOC(=O)CCCNC(=O)CSC1CCC1	ZINC000450993386	CD	On-Demand	Anodyne	EPHX2	23	42
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1cc2cc(F)ccc2o1	ZINC000450993399	FC	On-Demand	Anodyne	BDKRB1	23	40
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1cc2cc(F)ccc2o1	ZINC000450993400	FC	On-Demand	Anodyne	BDKRB1	23	40
CCN(CCCC(=O)c1ccccc1)CC(=O)N1CCCCCC1	ZINC000450993404	EG	On-Demand	Anodyne	AMY2	40	37
CCN(CCCC(=O)c1ccccc1)CC(=O)N1CCCCCC1	ZINC000450993404	EG	On-Demand	Anodyne	CYP2J2	47	34
O=C(CCCN1CCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450993405	CH	On-Demand	Anodyne	DRD2	29	43
O=C(CCCN1CCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450993405	CH	On-Demand	Anodyne	HTR2A	22	47
O=C(CCCN1CCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450993405	CH	On-Demand	Anodyne	ERG2	20	43
O=C(CCCN1CCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450993405	CH	On-Demand	Anodyne	HRH3	15	45
O=C(CCCN1CCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450993405	CH	On-Demand	Anodyne	HTR3B	0	46
O=C(CCCN1CCC[C@@H]1C(F)F)c1ccc(F)cc1	ZINC000450993405	CH	On-Demand	Anodyne	CYP2J2	50	35
CCCNC(=O)CNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450993408	DD	On-Demand	Anodyne	IAP	0	45
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450993411	GD	On-Demand	Anodyne	EDNRB	46	37
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450993411	GD	On-Demand	Anodyne	EDNRA	56	41
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450993411	GD	On-Demand	Anodyne	BMP1	94	47
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450993411	GD	On-Demand	Anodyne	NOS2	84	34
O=C(CSC1CCC1)NCc1ccc(Cl)cc1	ZINC000450993414	CG	On-Demand	Anodyne	SLC6A1	34	45
COc1cc(CN2CC[C@@H](COC(F)F)C2)ccc1Cl	ZINC000450993421	DG	On-Demand	Anodyne	SSTR5	51	37
COc1cc(CN2CC[C@@H](COC(F)F)C2)ccc1Cl	ZINC000450993421	DG	On-Demand	Anodyne	CCR3	23	40
COc1cc(CN2CC[C@@H](COC(F)F)C2)ccc1Cl	ZINC000450993421	DG	On-Demand	Anodyne	UTS2R	33	43
COc1cc(CN2CC[C@H](COC(F)F)C2)ccc1Cl	ZINC000450993422	DG	On-Demand	Anodyne	SSTR5	51	37
COc1cc(CN2CC[C@H](COC(F)F)C2)ccc1Cl	ZINC000450993422	DG	On-Demand	Anodyne	CCR3	23	40
COc1cc(CN2CC[C@H](COC(F)F)C2)ccc1Cl	ZINC000450993422	DG	On-Demand	Anodyne	UTS2R	33	43
Cc1cccc(CN2CCN(C(=O)CSC3CCC3)CC2)c1	ZINC000450993428	DF	On-Demand	Anodyne	DRD4	35	48
COc1ccc(NC(=O)[C@H](C)SC2CCC2)cc1OC	ZINC000450993439	CG	On-Demand	Anodyne	STK17B	42	37
COc1ccc(NC(=O)[C@H](C)SC2CCC2)cc1OC	ZINC000450993439	CG	On-Demand	Anodyne	QRFPR	49	40
COc1ccc(NC(=O)[C@H](C)SC2CCC2)cc1OC	ZINC000450993439	CG	On-Demand	Anodyne	ENPP1	62	36
COc1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1OC	ZINC000450993440	CG	On-Demand	Anodyne	STK17B	42	37
COc1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1OC	ZINC000450993440	CG	On-Demand	Anodyne	QRFPR	49	40
COc1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1OC	ZINC000450993440	CG	On-Demand	Anodyne	ENPP1	62	36
COc1ccc([C@@H]2CCCN2C(=O)CSC2CCC2)cc1OC	ZINC000450993444	EH	On-Demand	Anodyne	QRFPR	40	33
COc1ccc([C@H]2CCCN2C(=O)CSC2CCC2)cc1OC	ZINC000450993445	EH	On-Demand	Anodyne	QRFPR	40	33
Cc1cc(N2CCCC2)ccc1NC(=O)CSC1CCC1	ZINC000450993446	DH	On-Demand	Anodyne	HRH3	0	49
Cc1ccc2c(n1)OCCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993449	GF	On-Demand	Anodyne	TGM2	36	41
Cc1ccc2c(n1)OCCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993449	GF	On-Demand	Anodyne	F13A1	46	41
CCOC(=O)c1ccc(CS(=O)(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1	ZINC000450993451	GG	On-Demand	Bother	GSTM2	22	45
CCOC(=O)c1ccc(CS(=O)(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1	ZINC000450993451	GG	On-Demand	Bother	GSTP1	15	45
CC(=O)c1cccc(NC(=O)[C@@H](SC2CCC2)C(C)C)c1	ZINC000450993460	DI	On-Demand	Anodyne	AKR1C3	15	42
CC(=O)c1cccc(NC(=O)[C@@H](SC2CCC2)C(C)C)c1	ZINC000450993460	DI	On-Demand	Anodyne	KCNK3	53	38
CC(=O)c1cccc(NC(=O)[C@H](SC2CCC2)C(C)C)c1	ZINC000450993461	DI	On-Demand	Anodyne	AKR1C3	15	42
CC(=O)c1cccc(NC(=O)[C@H](SC2CCC2)C(C)C)c1	ZINC000450993461	DI	On-Demand	Anodyne	KCNK3	53	38
COC(=O)Cn1ncc(NC(=O)CCOc2cccc(OC)c2)c1C	ZINC000450993463	ED	On-Demand	Anodyne	MTNR1A	24	42
COC(=O)Cn1ncc(NC(=O)CCOc2cccc(OC)c2)c1C	ZINC000450993463	ED	On-Demand	Anodyne	MTNR1B	26	42
COC(=O)Cn1ncc(NC(=O)CCOc2cccc(OC)c2)c1C	ZINC000450993463	ED	On-Demand	Anodyne	FAS	22	41
COC(=O)c1ncccc1S(=O)(=O)N(C)c1ccc(C(C)(C)C)cc1	ZINC000450993466	FF	On-Demand	Anodyne	NR1H3	0	42
C[C@H](SC1CCC1)C(=O)NCCc1cccs1	ZINC000450993474	CG	On-Demand	Anodyne	ADAM17	30	56
C[C@@H](SC1CCC1)C(=O)NCCc1cccs1	ZINC000450993475	CG	On-Demand	Anodyne	ADAM17	30	56
COc1ccc(NC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450993490	CG	On-Demand	Anodyne	PDE1B	0	42
COc1ccc(NC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450993490	CG	On-Demand	Anodyne	PDE9A	0	42
COc1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450993491	CG	On-Demand	Anodyne	PDE1B	0	42
COc1ccc(NC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450993491	CG	On-Demand	Anodyne	PDE9A	0	42
COc1ccc(C)cc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450993496	CH	On-Demand	Anodyne	QRFPR	40	36
COc1ccc(C)cc1NC(=O)[C@H](C)SC1CCC1	ZINC000450993497	CH	On-Demand	Anodyne	QRFPR	40	36
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	HTR1A	64	51
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	DRD2	49	55
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	DRD1	24	43
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	ADRA1D	24	47
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	HTR2A	41	39
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	ADRA1A	30	46
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	ADRA1B	26	53
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	DRD3	53	44
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	HTR7	57	38
O=[S@@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993529	FH	On-Demand	Anodyne	NOX1	43	34
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	HTR1A	64	51
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	DRD2	49	55
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	DRD1	24	43
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	ADRA1D	24	47
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	HTR2A	41	39
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	ADRA1A	30	46
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	ADRA1B	26	53
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	DRD3	53	44
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	HTR7	57	38
O=[S@](CCN1CCCN(c2ccccc2Cl)CC1)c1ccccc1	ZINC000450993530	FH	On-Demand	Anodyne	NOX1	43	34
O=S(=O)(Cc1ccc(Br)c(F)c1)NCCCN1CCCCC1	ZINC000450993533	GF	On-Demand	Anodyne	HRH3	38	40
O=S(=O)(Cc1ccc(Br)c(F)c1)NCCCN1CCCCC1	ZINC000450993533	GF	On-Demand	Anodyne	HNMT	73	34
CCc1cccc(C(=O)NCCN(C)C(=O)c2cccc(CC)n2)n1	ZINC000450993537	EE	On-Demand	Anodyne	PDE5A	23	42
Clc1ccccc1N1CCCN(Cc2nc(-c3ccoc3)no2)CC1	ZINC000450993543	FH	On-Demand	Anodyne	DRD4	15	43
CC1(C)CCCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000450993545	EH	On-Demand	Bother	CACNA1D	40	31
CCc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993551	BG	On-Demand	Anodyne	QRFPR	41	34
CCCN1Cc2cccc(NS(=O)(=O)c3ccc(C4CC4)cc3)c2C1	ZINC000450993562	FI	On-Demand	Anodyne	PRTN3	51	34
CCOC(=O)c1cc(S(=O)(=O)N[C@@H](C)c2cccnc2)cnc1C(F)F	ZINC000450993563	GF	On-Demand	Anodyne	KCNA5	40	34
CCOC(=O)c1cc(S(=O)(=O)N[C@H](C)c2cccnc2)cnc1C(F)F	ZINC000450993564	GF	On-Demand	Anodyne	KCNA5	40	34
O=c1n(CCN2CCCN(c3ccccc3Cl)CC2)nc2ccccn12	ZINC000450993577	FE	On-Demand	Anodyne	HTR1A	46	58
O=c1n(CCN2CCCN(c3ccccc3Cl)CC2)nc2ccccn12	ZINC000450993577	FE	On-Demand	Anodyne	DRD2	35	43
O=c1n(CCN2CCCN(c3ccccc3Cl)CC2)nc2ccccn12	ZINC000450993577	FE	On-Demand	Anodyne	ADRA1D	32	51
O=c1n(CCN2CCCN(c3ccccc3Cl)CC2)nc2ccccn12	ZINC000450993577	FE	On-Demand	Anodyne	HTR2A	26	48
O=c1n(CCN2CCCN(c3ccccc3Cl)CC2)nc2ccccn12	ZINC000450993577	FE	On-Demand	Anodyne	ADRA1A	24	58
O=c1n(CCN2CCCN(c3ccccc3Cl)CC2)nc2ccccn12	ZINC000450993577	FE	On-Demand	Anodyne	ADRA1B	28	58
O=c1n(CCN2CCCN(c3ccccc3Cl)CC2)nc2ccccn12	ZINC000450993577	FE	On-Demand	Anodyne	DRD3	41	40
COC(=O)c1ncccc1S(=O)(=O)N1CCc2cc(OC)ccc21	ZINC000450993578	ED	On-Demand	Anodyne	CYP11B2	43	50
COC(=O)c1ncccc1S(=O)(=O)NCCOc1cccc(C)c1	ZINC000450993581	FD	On-Demand	Anodyne	MTNR1A	15	42
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA2	111	62
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA1	91	60
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA7	62	56
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA13	34	40
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA5B	57	56
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA4	78	60
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA5A	58	56
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA14	50	41
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA12	69	55
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CA9	71	55
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CAH_METTE	23	40
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	CYNT	27	47
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	NCE103	39	51
NS(=O)(=O)c1ccc(CCNC(=O)CSC2CCC2)cc1	ZINC000450993583	ED	On-Demand	Anodyne	A6YCJ1_9METZ	27	53
CCCc1cnc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)s1	ZINC000450993584	GF	On-Demand	Anodyne	LUXN	0	42
CCOC(=O)c1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450993591	CG	On-Demand	Anodyne	ACR	43	35
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450993594	EE	On-Demand	Anodyne	MMP2	19	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000450993595	EE	On-Demand	Anodyne	MMP2	19	41
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450993596	EE	On-Demand	Anodyne	MMP2	19	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000450993597	EE	On-Demand	Anodyne	MMP2	19	41
CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450993602	GF	On-Demand	Anodyne	RORC	15	42
CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450993602	GF	On-Demand	Anodyne	LUXN	0	43
Clc1ccccc1N1CCCN(CC2CCOCC2)CC1	ZINC000450993608	DG	On-Demand	Anodyne	HTR1A	21	49
Clc1ccccc1N1CCCN(CC2CCOCC2)CC1	ZINC000450993608	DG	On-Demand	Anodyne	DRD2	20	45
Clc1ccccc1N1CCCN(CC2CCOCC2)CC1	ZINC000450993608	DG	On-Demand	Anodyne	HTR1B	18	43
Clc1ccccc1N1CCCN(CC2CCOCC2)CC1	ZINC000450993608	DG	On-Demand	Anodyne	ADRA1B	18	45
Clc1ccccc1N1CCCN(CC2CCOCC2)CC1	ZINC000450993608	DG	On-Demand	Anodyne	SIGMAR1	15	45
Cc1ccn(-c2ccccc2C(=O)N2CC[C@H](O)C(C)(C)C2)n1	ZINC000450993611	DE	On-Demand	Anodyne	AVPR2	20	41
Cc1ccn(-c2ccccc2C(=O)N2CC[C@@H](O)C(C)(C)C2)n1	ZINC000450993612	DE	On-Demand	Anodyne	AVPR2	20	41
O=C(CSC1CCC1)N1CCN(C(=O)c2ccco2)CC1	ZINC000450993615	DD	On-Demand	Anodyne	L3MBTL3	42	38
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	DRD2	38	50
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	DRD4	27	50
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	HTR2A	38	40
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	DRD3	53	40
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	KCNQ2	74	41
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	GCK	17	40
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	NOX4	42	32
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	NOX1	62	34
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	NOX5	60	34
Cc1csc(NC(=O)CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993619	FG	On-Demand	Anodyne	SLC27A1	45	43
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	CA2	24	41
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	CA1	24	41
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	TRPV1	96	36
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	CA4	27	41
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	GRM4	15	44
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	PRTN3	53	35
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	CA12	20	41
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	CA9	20	41
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	LEF	58	37
CC(C)Oc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(F)c1	ZINC000450993620	GI	On-Demand	Anodyne	IDO1	33	44
CC1(C)CCCCN(C(=O)c2ccnc(OC(F)F)c2)C1	ZINC000450993624	CG	On-Demand	Anodyne	HPGD	40	42
N#CCCn1cc(C(=O)CSC2CCC2)c2ccccc21	ZINC000450993632	CI	On-Demand	Mild	CNR1	34	43
N#CCCn1cc(C(=O)CSC2CCC2)c2ccccc21	ZINC000450993632	CI	On-Demand	Mild	CNR2	27	42
CNC(=O)Cc1noc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993636	FD	On-Demand	Anodyne	HTR1A	33	42
CNC(=O)Cc1noc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993636	FD	On-Demand	Anodyne	DRD2	45	40
CNC(=O)Cc1noc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993636	FD	On-Demand	Anodyne	DRD4	33	42
CNC(=O)Cc1noc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993636	FD	On-Demand	Anodyne	ADRA1D	15	42
CNC(=O)Cc1noc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993636	FD	On-Demand	Anodyne	ADRA1A	15	42
CNC(=O)Cc1noc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993636	FD	On-Demand	Anodyne	DRD3	61	40
CNC(=O)Cc1noc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450993636	FD	On-Demand	Anodyne	KCNQ2	53	40
CC(C)N(C)c1ccccc1CNC(=O)C1(C(F)(F)F)CCC1	ZINC000450993642	EH	On-Demand	Anodyne	SDH1	0	42
CCOCCCNC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450993647	FF	On-Demand	Anodyne	DRD2	45	41
CCOCCCNC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450993647	FF	On-Demand	Anodyne	DRD3	71	40
CCOCCCNC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450993647	FF	On-Demand	Anodyne	KCNQ2	77	39
CCOCCCNC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450993650	FF	On-Demand	Anodyne	DRD2	45	41
CCOCCCNC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450993650	FF	On-Demand	Anodyne	DRD3	71	40
CCOCCCNC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450993650	FF	On-Demand	Anodyne	KCNQ2	77	39
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@]1(O)CCCC(C)(C)C1	ZINC000450993656	EG	On-Demand	Anodyne	CTSV	43	29
Cn1nc(-c2ccccc2)cc1C(=O)NC[C@@]1(O)CCCC(C)(C)C1	ZINC000450993657	EG	On-Demand	Anodyne	CTSV	43	29
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccnc2)cc1	ZINC000450993682	EF	On-Demand	Anodyne	ADRB2	40	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccnc2)cc1	ZINC000450993682	EF	On-Demand	Anodyne	ADRB3	80	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccnc2)cc1	ZINC000450993682	EF	On-Demand	Anodyne	KCNA5	48	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C)c2cccnc2)cc1	ZINC000450993682	EF	On-Demand	Anodyne	NAMPT	58	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccnc2)cc1	ZINC000450993684	EF	On-Demand	Anodyne	ADRB2	40	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccnc2)cc1	ZINC000450993684	EF	On-Demand	Anodyne	ADRB3	80	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccnc2)cc1	ZINC000450993684	EF	On-Demand	Anodyne	KCNA5	48	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2cccnc2)cc1	ZINC000450993684	EF	On-Demand	Anodyne	NAMPT	58	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	CA2	18	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	HTR2A	17	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	HTR7	37	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	CA1	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	HRH3	25	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	HTR6	19	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	CHRNA7	36	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	HNMT	45	31
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1	ZINC000450993687	FE	On-Demand	Anodyne	CA9	16	48
COc1ccc(CNC(=O)CSC2CCC2)cc1	ZINC000450993707	CF	On-Demand	Anodyne	MMP13	33	41
COc1ccc(CNC(=O)CSC2CCC2)cc1	ZINC000450993707	CF	On-Demand	Anodyne	MTNR1A	56	36
COc1ccc(CNC(=O)CSC2CCC2)cc1	ZINC000450993707	CF	On-Demand	Anodyne	MTNR1B	41	32
COc1ccc(CNC(=O)CSC2CCC2)cc1	ZINC000450993707	CF	On-Demand	Anodyne	MMP1	33	41
COc1ccc(CNC(=O)CSC2CCC2)cc1	ZINC000450993707	CF	On-Demand	Anodyne	PROKR1	51	32
COc1ccc(CNC(=O)CSC2CCC2)cc1	ZINC000450993707	CF	On-Demand	Anodyne	KCNJ2	0	41
C[C@@H](SC1CCC1)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450993710	DJ	On-Demand	Anodyne	PANK3	0	44
C[C@H](SC1CCC1)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000450993711	DJ	On-Demand	Anodyne	PANK3	0	44
O[C@@H](COCC(F)(F)F)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450993720	FF	On-Demand	Anodyne	ABCB1	52	39
O[C@@H](COCC(F)(F)F)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450993720	FF	On-Demand	Anodyne	HSP90AB1	48	53
O[C@H](COCC(F)(F)F)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450993721	FF	On-Demand	Anodyne	ABCB1	52	39
O[C@H](COCC(F)(F)F)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450993721	FF	On-Demand	Anodyne	HSP90AB1	48	53
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	HTR1A	20	45
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	DRD2	23	45
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	DRD1	0	40
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	DRD4	30	44
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	HTR2A	17	45
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	DRD3	23	44
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	CACNA1G	23	44
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	NOX1	49	33
CCc1nc(C)c(CN2CCCN(c3ccccc3Cl)CC2)o1	ZINC000450993728	EH	On-Demand	Anodyne	NOX5	46	33
CC(C)C(C)(C)CNC(=O)Cc1ccc(OC(F)F)c(F)c1	ZINC000450993729	DH	On-Demand	Anodyne	TRPV1	0	42
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	HTR1A	46	42
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	DRD2	47	51
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	DRD4	35	42
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	ADRA1D	26	41
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	HRH1	27	41
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	ADRA1B	22	42
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	DRD3	54	45
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	KCNQ2	64	37
CC(C)(C)C(=O)N1CCC(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450993743	GI	On-Demand	Anodyne	CCR3	19	41
C=Cc1ccc(S(=O)(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)cc1	ZINC000450993744	GG	On-Demand	Anodyne	L3MBTL3	42	37
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450993762	EG	On-Demand	Bother	LTA4H	44	59
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450993762	EG	On-Demand	Bother	HRH3	43	43
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450993762	EG	On-Demand	Bother	PSMB2	47	37
O=[N+]([O-])c1ccc(OCCN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450993762	EG	On-Demand	Bother	PSMB1	42	38
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450993763	EG	On-Demand	Bother	LTA4H	44	59
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450993763	EG	On-Demand	Bother	HRH3	43	43
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450993763	EG	On-Demand	Bother	PSMB2	47	37
O=[N+]([O-])c1ccc(OCCN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450993763	EG	On-Demand	Bother	PSMB1	42	38
CC[C@H](C)c1ccccc1NC(=O)[C@H](C)N1CCC[C@H](c2ccncc2)C1	ZINC000450993764	FJ	On-Demand	Anodyne	KCNQ2	43	35
CC[C@H](C)c1ccccc1NC(=O)[C@H](C)N1CCC[C@@H](c2ccncc2)C1	ZINC000450993765	FJ	On-Demand	Anodyne	KCNQ2	43	35
CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)N1CCC[C@@H](c2ccncc2)C1	ZINC000450993766	FJ	On-Demand	Anodyne	KCNQ2	43	35
CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)N1CCC[C@H](c2ccncc2)C1	ZINC000450993767	FJ	On-Demand	Anodyne	KCNQ2	43	35
CC1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CCC(=O)CC1	ZINC000450993795	EI	On-Demand	Anodyne	CACNA1H	46	34
CC1(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)CCC(=O)CC1	ZINC000450993795	EI	On-Demand	Anodyne	CCR1	51	44
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C(=O)O)c1	ZINC000450993800	GG	On-Demand	Anodyne	CA2	16	49
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C(=O)O)c1	ZINC000450993800	GG	On-Demand	Anodyne	CA4	19	40
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C(=O)O)c1	ZINC000450993800	GG	On-Demand	Anodyne	LEF	59	38
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C(=O)O)c1	ZINC000450993800	GG	On-Demand	Anodyne	FFAR4	35	49
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)c(C(=O)O)c1	ZINC000450993800	GG	On-Demand	Anodyne	PFK	0	40
O=C(CN1CCC[C@H](c2ccncc2)C1)Nc1cccc(C(F)(F)F)c1	ZINC000450993801	FH	On-Demand	Anodyne	DRD4	22	55
O=C(CN1CCC[C@H](c2ccncc2)C1)Nc1cccc(C(F)(F)F)c1	ZINC000450993801	FH	On-Demand	Anodyne	MCHR1	43	42
O=C(CN1CCC[C@H](c2ccncc2)C1)Nc1cccc(C(F)(F)F)c1	ZINC000450993801	FH	On-Demand	Anodyne	RHOA	0	41
O=C(CN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(C(F)(F)F)c1	ZINC000450993802	FH	On-Demand	Anodyne	DRD4	22	55
O=C(CN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(C(F)(F)F)c1	ZINC000450993802	FH	On-Demand	Anodyne	MCHR1	43	42
O=C(CN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(C(F)(F)F)c1	ZINC000450993802	FH	On-Demand	Anodyne	RHOA	0	41
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)nn2)cc1	ZINC000450993804	GC	On-Demand	Anodyne	MTNN	42	37
CC(C)Oc1cccc(CNC(=O)Cn2cnc3c2C[C@H](C)[C@H](C)C3)c1	ZINC000450993813	FG	On-Demand	Anodyne	SLC6A9	20	41
CC(C)Oc1cccc(CNC(=O)Cn2cnc3c2C[C@H](C)[C@@H](C)C3)c1	ZINC000450993814	FG	On-Demand	Anodyne	SLC6A9	20	41
CC(C)Oc1cccc(CNC(=O)Cn2cnc3c2C[C@@H](C)[C@H](C)C3)c1	ZINC000450993815	FG	On-Demand	Anodyne	SLC6A9	20	41
CC(C)Oc1cccc(CNC(=O)Cn2cnc3c2C[C@@H](C)[C@@H](C)C3)c1	ZINC000450993816	FG	On-Demand	Anodyne	SLC6A9	20	41
O=C(CSC1CCC1)NCCCN1CCCC1=O	ZINC000450993825	CD	On-Demand	Anodyne	TYRO3	25	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCOc3ccccc32)cc1	ZINC000450993828	FG	On-Demand	Anodyne	CAPN2	43	32
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCOc3ccccc32)cc1	ZINC000450993829	FG	On-Demand	Anodyne	CAPN2	43	32
Cc1ccc(NC(=O)CSC2CCC2)cc1C	ZINC000450993830	BH	On-Demand	Anodyne	QRFPR	50	42
Cc1ccc(NC(=O)CSC2CCC2)cc1C	ZINC000450993830	BH	On-Demand	Anodyne	ENPP1	58	34
C[C@H](SC1CCC1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450993833	CH	On-Demand	Anodyne	P95276_MYCTO	0	42
C[C@@H](SC1CCC1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000450993834	CH	On-Demand	Anodyne	P95276_MYCTO	0	42
O=C(CSC1CCC1)Nc1ccc2c(c1)OCO2	ZINC000450993837	CF	On-Demand	Anodyne	LDLR	0	44
O=C(CSC1CCC1)Nc1ccc2c(c1)OCO2	ZINC000450993837	CF	On-Demand	Anodyne	NOS2	63	34
O=C(CSC1CCC1)Nc1ccc2c(c1)OCO2	ZINC000450993837	CF	On-Demand	Anodyne	QRFPR	46	38
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	CCR3	23	43
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	MTNR1A	54	50
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	MTNR1B	46	50
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	EPHX2	22	46
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	TAAR1	36	42
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	QRFPR	49	42
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	ENPP1	57	34
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	KCNK3	42	37
COc1cccc(NC(=O)CSC2CCC2)c1	ZINC000450993847	CF	On-Demand	Anodyne	BRPF1	0	40
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993851	GC	On-Demand	Anodyne	BDKRB1	29	43
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993851	GC	On-Demand	Anodyne	MMP3	42	37
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993851	GC	On-Demand	Anodyne	MMP7	47	34
COC(=O)C[C@H]1C(=O)NCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993851	GC	On-Demand	Anodyne	F13A1	48	33
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993852	GC	On-Demand	Anodyne	BDKRB1	29	43
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993852	GC	On-Demand	Anodyne	MMP3	42	37
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993852	GC	On-Demand	Anodyne	MMP7	47	34
COC(=O)C[C@@H]1C(=O)NCCN1S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450993852	GC	On-Demand	Anodyne	F13A1	48	33
CCN(CC)S(=O)(=O)c1cc(NC(=O)CSC2CCC2)ccc1C	ZINC000450993854	FG	On-Demand	Anodyne	QRFPR	40	34
C[C@@H](SC1CCC1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000450993856	CG	On-Demand	Bother	DDX3X	0	49
C[C@@H](SC1CCC1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000450993856	CG	On-Demand	Bother	OSIGBA0132E09-OSIGBA0108L24.11	0	42
C[C@H](SC1CCC1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000450993857	CG	On-Demand	Bother	DDX3X	0	49
C[C@H](SC1CCC1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000450993857	CG	On-Demand	Bother	OSIGBA0132E09-OSIGBA0108L24.11	0	42
COc1ccc([C@@H]2CCCN2S(=O)(=O)c2cc(C)cs2)c(OC)c1	ZINC000450993876	FH	On-Demand	Anodyne	FKBP1A	54	41
COc1ccc([C@H]2CCCN2S(=O)(=O)c2cc(C)cs2)c(OC)c1	ZINC000450993879	FH	On-Demand	Anodyne	FKBP1A	54	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(C3CC3)c3ccc(F)cc32)cn1	ZINC000450993887	GH	On-Demand	Anodyne	AVPR2	22	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(C3CC3)c3ccc(F)cc32)cn1	ZINC000450993887	GH	On-Demand	Anodyne	AVPR1A	15	41
CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCN(C3CC3)c3ccc(F)cc32)cn1	ZINC000450993887	GH	On-Demand	Anodyne	GPBAR1	40	43
CCOc1ccc(NC(=O)CSC2CCC2)cc1OCC	ZINC000450993905	DH	On-Demand	Anodyne	QRFPR	50	42
CCOc1ccc(NC(=O)CSC2CCC2)cc1OCC	ZINC000450993905	DH	On-Demand	Anodyne	ENPP1	80	39
CCOC(=O)c1ccc(CS(=O)(=O)NCCc2cccc(F)c2)cc1	ZINC000450993909	FF	On-Demand	Anodyne	NAMPT	26	41
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450993919	DE	On-Demand	Anodyne	AGTR2	15	40
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@H]1Cc2c(C)cccc2O1	ZINC000450993921	DE	On-Demand	Anodyne	AGTR2	15	40
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450993923	DE	On-Demand	Anodyne	AGTR2	15	40
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@@H]1Cc2c(C)cccc2O1	ZINC000450993925	DE	On-Demand	Anodyne	AGTR2	15	40
CCN(Cc1cccs1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450993926	FF	On-Demand	Anodyne	RORB	0	48
COc1ccc(NC(=O)CSC2CCC2)cc1OC	ZINC000450993933	CF	On-Demand	Anodyne	PDE4A	23	41
COc1ccc(NC(=O)CSC2CCC2)cc1OC	ZINC000450993933	CF	On-Demand	Anodyne	QRFPR	61	51
COc1ccc(NC(=O)CSC2CCC2)cc1OC	ZINC000450993933	CF	On-Demand	Anodyne	ENPP1	84	48
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450993947	EF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450993947	EF	On-Demand	Anodyne	OPRK1	42	43
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450993948	EF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450993948	EF	On-Demand	Anodyne	OPRK1	42	43
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450993949	EF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450993949	EF	On-Demand	Anodyne	OPRK1	42	43
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450993950	EF	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)Cc1ccc(Cl)c(OC)c1	ZINC000450993950	EF	On-Demand	Anodyne	OPRK1	42	43
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC(C)(C)C1	ZINC000450993951	CG	On-Demand	Anodyne	MME	24	44
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC(C)(C)C1	ZINC000450993951	CG	On-Demand	Anodyne	PREP	20	41
CO[C@@H](Cc1ccccc1)C(=O)N1CCCCC(C)(C)C1	ZINC000450993951	CG	On-Demand	Anodyne	SLC12A5	49	34
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC(C)(C)C1	ZINC000450993952	CG	On-Demand	Anodyne	MME	24	44
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC(C)(C)C1	ZINC000450993952	CG	On-Demand	Anodyne	PREP	20	41
CO[C@H](Cc1ccccc1)C(=O)N1CCCCC(C)(C)C1	ZINC000450993952	CG	On-Demand	Anodyne	SLC12A5	49	34
COCCOc1ccccc1NS(=O)(=O)c1cc(C(F)(F)F)ccc1O	ZINC000450993960	GG	On-Demand	Anodyne	PRTN3	50	31
COCCOc1ccccc1NS(=O)(=O)c1cc(C(F)(F)F)ccc1O	ZINC000450993960	GG	On-Demand	Anodyne	UQCRB	0	40
CCOC(=O)c1ccc(CN2CC[C@@H](COC(F)F)C2)nc1	ZINC000450993962	DE	On-Demand	Anodyne	HTR4	17	40
CCOC(=O)c1ccc(CN2CC[C@H](COC(F)F)C2)nc1	ZINC000450993963	DE	On-Demand	Anodyne	HTR4	17	40
COc1ccc(CN(C(=O)CSC2CCC2)C2CC2)cc1	ZINC000450993965	DG	On-Demand	Anodyne	ACAT	41	45
COc1ccccc1CNC(=O)[C@@H](C)SC1CCC1	ZINC000450993966	CF	On-Demand	Anodyne	TACR1	0	42
COc1ccccc1CNC(=O)[C@@H](C)SC1CCC1	ZINC000450993966	CF	On-Demand	Anodyne	QRFPR	41	37
COc1ccccc1CNC(=O)[C@@H](C)SC1CCC1	ZINC000450993966	CF	On-Demand	Anodyne	MBTPS1	42	34
COc1ccccc1CNC(=O)[C@H](C)SC1CCC1	ZINC000450993967	CF	On-Demand	Anodyne	TACR1	0	42
COc1ccccc1CNC(=O)[C@H](C)SC1CCC1	ZINC000450993967	CF	On-Demand	Anodyne	QRFPR	41	37
COc1ccccc1CNC(=O)[C@H](C)SC1CCC1	ZINC000450993967	CF	On-Demand	Anodyne	MBTPS1	42	34
CN(Cc1ccccc1N1CCCC1)S(=O)(=O)Cc1c(F)cccc1Cl	ZINC000450993974	GI	On-Demand	Anodyne	KCNQ2	70	39
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2F)CC1	ZINC000450993978	CD	On-Demand	Anodyne	DRD2	31	42
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2F)CC1	ZINC000450993978	CD	On-Demand	Anodyne	KCNQ2	59	38
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2F)CC1	ZINC000450993979	CD	On-Demand	Anodyne	DRD2	31	42
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2F)CC1	ZINC000450993979	CD	On-Demand	Anodyne	KCNQ2	59	38
O=C(CSC1CCC1)NCc1ccccc1CN1CCOCC1	ZINC000450993987	EE	On-Demand	Anodyne	CNR1	15	40
COCC1(S(=O)(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000450993991	FE	On-Demand	Anodyne	HRH3	22	41
COCC1(S(=O)(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000450993991	FE	On-Demand	Anodyne	ADAM17	15	41
O=S(=O)(NCCCOC[C@@H]1CCCO1)c1ccc2ccccc2c1F	ZINC000450993992	FF	On-Demand	Anodyne	HTR7	23	41
O=S(=O)(NCCCOC[C@H]1CCCO1)c1ccc2ccccc2c1F	ZINC000450993993	FF	On-Demand	Anodyne	HTR7	23	41
CC(C)[C@@H](C)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450993994	CE	On-Demand	Anodyne	BIRC2	50	35
CC(C)[C@H](C)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450993995	CE	On-Demand	Anodyne	BIRC2	50	35
CC(C)[C@H](C)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450993996	CE	On-Demand	Anodyne	BIRC2	50	35
CC(C)[C@@H](C)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450993997	CE	On-Demand	Anodyne	BIRC2	50	35
COC(=O)[C@H](C1CC1)N1CCCN(c2ccccc2Cl)CC1	ZINC000450994019	DF	On-Demand	Anodyne	DRD2	32	41
COC(=O)[C@H](C1CC1)N1CCCN(c2ccccc2Cl)CC1	ZINC000450994019	DF	On-Demand	Anodyne	DRD3	37	41
COC(=O)[C@H](C1CC1)N1CCCN(c2ccccc2Cl)CC1	ZINC000450994019	DF	On-Demand	Anodyne	KCNQ2	79	39
COC(=O)[C@H](C1CC1)N1CCCN(c2ccccc2Cl)CC1	ZINC000450994019	DF	On-Demand	Anodyne	NPY2R	49	37
COC(=O)[C@@H](C1CC1)N1CCCN(c2ccccc2Cl)CC1	ZINC000450994020	DF	On-Demand	Anodyne	DRD2	32	41
COC(=O)[C@@H](C1CC1)N1CCCN(c2ccccc2Cl)CC1	ZINC000450994020	DF	On-Demand	Anodyne	DRD3	37	41
COC(=O)[C@@H](C1CC1)N1CCCN(c2ccccc2Cl)CC1	ZINC000450994020	DF	On-Demand	Anodyne	KCNQ2	79	39
COC(=O)[C@@H](C1CC1)N1CCCN(c2ccccc2Cl)CC1	ZINC000450994020	DF	On-Demand	Anodyne	NPY2R	49	37
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	HTR1A	44	55
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	DRD2	45	55
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	DRD1	24	41
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	DRD4	48	45
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	ADRA1D	27	46
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	HTR2A	34	41
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	HTR2C	28	41
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	SLC6A4	15	44
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	ADRA1A	23	46
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	ADRA1B	24	46
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	DRD3	45	45
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	SLC6A9	20	42
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	SLC6A5	31	42
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	NOX1	48	33
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1-c1ccccc1	ZINC000450994021	GH	On-Demand	Anodyne	NOX5	44	33
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	ZINC000450994025	GF	On-Demand	Anodyne	LPL	52	38
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	ZINC000450994025	GF	On-Demand	Anodyne	TGM2	40	37
Cc1csc(S(=O)(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c1	ZINC000450994025	GF	On-Demand	Anodyne	F13A1	49	43
COCCOc1ccccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450994031	EG	On-Demand	Anodyne	PRTN3	57	35
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C(F)F)c(OC)c1	ZINC000450994069	EE	On-Demand	Anodyne	MTNR1A	46	35
COc1ccc(CNC(=O)CCN2CCC[C@@H]2C(F)F)c(OC)c1	ZINC000450994069	EE	On-Demand	Anodyne	ACKR3	60	30
Cc1noc([C@@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994091	DH	On-Demand	Anodyne	HRH3	38	42
Cc1noc([C@@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994091	DH	On-Demand	Anodyne	COLA	38	41
Cc1noc([C@@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994091	DH	On-Demand	Anodyne	CPT1A	37	41
Cc1noc([C@@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994091	DH	On-Demand	Anodyne	SPHK2	23	42
Cc1noc([C@@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994091	DH	On-Demand	Anodyne	SPHK1	25	42
Cc1noc([C@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994092	DH	On-Demand	Anodyne	HRH3	38	42
Cc1noc([C@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994092	DH	On-Demand	Anodyne	COLA	38	41
Cc1noc([C@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994092	DH	On-Demand	Anodyne	CPT1A	37	41
Cc1noc([C@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994092	DH	On-Demand	Anodyne	SPHK2	23	42
Cc1noc([C@H]2CCCCN2CCc2ccc(Cl)cc2)n1	ZINC000450994092	DH	On-Demand	Anodyne	SPHK1	25	42
c1csc(-c2noc(CCCN3CCC[C@H](c4ccncc4)C3)n2)c1	ZINC000450994099	FI	On-Demand	Anodyne	ETHR	37	42
c1csc(-c2noc(CCCN3CCC[C@@H](c4ccncc4)C3)n2)c1	ZINC000450994100	FI	On-Demand	Anodyne	ETHR	37	42
CC(C)N(C)c1ccccc1CNC(=O)c1ccc(C(C)(F)F)nc1	ZINC000450994101	EH	On-Demand	Anodyne	EPHX2	0	48
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	HTR1A	37	45
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	DRD2	46	44
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	DRD1	24	43
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	DRD4	74	45
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	ADRA1D	26	45
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	HTR2A	25	43
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	HTR2C	18	40
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	ADRA1A	22	50
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	DRD3	40	45
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	HTR7	23	40
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	EGLN1	0	44
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	NOX1	55	37
Cc1cccnc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994102	DH	On-Demand	Anodyne	NOX5	46	37
CC(C)N(C)c1ccccc1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450994106	GH	On-Demand	Bother	CACNA1C	48	34
CC(C)N(C)c1ccccc1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450994106	GH	On-Demand	Bother	CACNA1D	75	33
CC(C)N(C)c1ccccc1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000450994106	GH	On-Demand	Bother	COLA	91	39
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	HTR1A	73	48
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	DRD2	74	48
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	DRD1	31	45
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	DRD4	38	45
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	ADRA1D	57	57
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	HTR2A	50	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	HTR2C	40	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	SLC6A4	19	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	ADRA1A	52	60
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	ADRA1B	39	68
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	DRD3	97	48
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	HTR7	49	41
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	KCNQ2	40	38
O=C(CN1CCCN(c2ccccc2Cl)CC1)NCCCN1CCCC1=O	ZINC000450994109	GD	On-Demand	Anodyne	TYRO3	24	42
COc1cc(Cl)c(C)cc1NC(=O)CSC1CCC1	ZINC000450994124	CH	On-Demand	Anodyne	QRFPR	46	40
CCOc1ccncc1S(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994131	GD	On-Demand	Anodyne	CA2	20	60
CCOc1ccncc1S(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994131	GD	On-Demand	Anodyne	CA7	25	41
CCOc1ccncc1S(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994131	GD	On-Demand	Anodyne	CA14	30	60
CCOc1ccncc1S(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994131	GD	On-Demand	Anodyne	CA12	16	60
CCOc1ccncc1S(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994131	GD	On-Demand	Anodyne	CA9	19	60
N#Cc1ccc(OCCSC2CCC2)cc1	ZINC000450994139	BG	On-Demand	Mild	MEN1	45	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C(N)=O)cc1	ZINC000450994145	GD	On-Demand	Anodyne	ACE	17	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C(N)=O)cc1	ZINC000450994145	GD	On-Demand	Anodyne	MMP3	17	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C(N)=O)cc1	ZINC000450994145	GD	On-Demand	Anodyne	MMP8	28	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C(N)=O)cc1	ZINC000450994145	GD	On-Demand	Anodyne	TPP2	47	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C(N)=O)cc1	ZINC000450994145	GD	On-Demand	Anodyne	F13A1	62	34
C[C@@H](CN1CCCCCC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450994154	FG	On-Demand	Anodyne	LTA4H	15	44
C[C@@H](CN1CCCCCC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450994154	FG	On-Demand	Anodyne	TACR2	45	35
C[C@@H](CN1CCCCCC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450994154	FG	On-Demand	Anodyne	SLC12A5	48	34
C[C@H](CN1CCCCCC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450994158	FG	On-Demand	Anodyne	LTA4H	15	44
C[C@H](CN1CCCCCC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450994158	FG	On-Demand	Anodyne	TACR2	45	35
C[C@H](CN1CCCCCC1)NC(=O)C1(Cc2ccccc2)CCOCC1	ZINC000450994158	FG	On-Demand	Anodyne	SLC12A5	48	34
CCOc1ccncc1S(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994168	GD	On-Demand	Anodyne	CA2	20	60
CCOc1ccncc1S(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994168	GD	On-Demand	Anodyne	CA7	25	41
CCOc1ccncc1S(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994168	GD	On-Demand	Anodyne	CA14	30	60
CCOc1ccncc1S(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994168	GD	On-Demand	Anodyne	CA12	16	60
CCOc1ccncc1S(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450994168	GD	On-Demand	Anodyne	CA9	19	60
C[C@@H]1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)O1	ZINC000450994174	DG	On-Demand	Anodyne	HTR1A	23	42
C[C@@H]1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)O1	ZINC000450994174	DG	On-Demand	Anodyne	ADRA1A	27	42
CC1(C)CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@@H]1O	ZINC000450994176	DH	On-Demand	Anodyne	EPHX2	15	41
C[C@H]1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)O1	ZINC000450994179	DG	On-Demand	Anodyne	HTR1A	23	42
C[C@H]1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)O1	ZINC000450994179	DG	On-Demand	Anodyne	ADRA1A	27	42
CC1(C)CN(C(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)CC[C@H]1O	ZINC000450994181	DH	On-Demand	Anodyne	EPHX2	15	41
C[C@@H]1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)O1	ZINC000450994183	DG	On-Demand	Anodyne	HTR1A	23	42
C[C@@H]1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)O1	ZINC000450994183	DG	On-Demand	Anodyne	ADRA1A	27	42
C[C@H]1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)O1	ZINC000450994187	DG	On-Demand	Anodyne	HTR1A	23	42
C[C@H]1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)O1	ZINC000450994187	DG	On-Demand	Anodyne	ADRA1A	27	42
CCN(CC)C(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450994188	DG	On-Demand	Anodyne	OPRD1	24	42
CCN(CC)C(=O)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450994188	DG	On-Demand	Anodyne	QRFPR	41	38
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	HTR1A	36	50
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	DRD2	38	50
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	DRD4	27	48
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	HTR2A	20	40
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	SLC6A1	92	39
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	ADRA1A	15	42
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	HRH1	17	40
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	DRD3	50	43
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	OPRK1	0	45
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	KCNQ2	40	36
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	NPY2R	26	47
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	CCR3	15	41
O=C(c1ccccc1)N1CC[C@@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994189	GI	On-Demand	Anodyne	L3MBTL3	66	37
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	HTR1A	36	50
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	DRD2	38	50
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	DRD4	27	48
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	HTR2A	20	40
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	SLC6A1	92	39
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	ADRA1A	15	42
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	HRH1	17	40
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	DRD3	50	43
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	OPRK1	0	45
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	KCNQ2	40	36
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	NPY2R	26	47
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	CCR3	15	41
O=C(c1ccccc1)N1CC[C@H](CN2CCCN(c3ccccc3Cl)CC2)C1	ZINC000450994193	GI	On-Demand	Anodyne	L3MBTL3	66	37
Cc1noc([C@@H]2CCCCN2Cc2cc(Br)ccc2C)n1	ZINC000450994202	FI	On-Demand	Anodyne	COLA	46	36
Cc1noc([C@@H]2CCCCN2Cc2cc(Br)ccc2C)n1	ZINC000450994202	FI	On-Demand	Anodyne	CPT1A	46	36
COC(=O)c1ccc(F)c(CN2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)c1	ZINC000450994207	FG	On-Demand	Anodyne	SLC6A1	46	37
COC(=O)c1ccc(F)c(CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)c1	ZINC000450994209	FG	On-Demand	Anodyne	SLC6A1	46	37
Cc1noc([C@H]2CCCCN2Cc2cc(Br)ccc2C)n1	ZINC000450994219	FI	On-Demand	Anodyne	COLA	46	36
Cc1noc([C@H]2CCCCN2Cc2cc(Br)ccc2C)n1	ZINC000450994219	FI	On-Demand	Anodyne	CPT1A	46	36
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	DRD2	82	64
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	DRD1	41	48
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	DRD4	52	51
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	ADRA1D	38	56
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	HTR2A	53	40
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	HTR2C	26	47
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	ADRA1B	39	68
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	DRD3	77	54
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	HTR7	71	42
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	KCNQ2	50	41
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	SIGMAR1	28	43
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	HNMT	57	33
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	NOX4	44	34
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	NOX1	63	34
Clc1ccccc1N1CCCN(CCN2CCCCC2)CC1	ZINC000450994223	DG	On-Demand	Anodyne	NOX5	61	34
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	HTR1A	89	47
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	ADRA2A	16	45
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	DRD2	89	45
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	DRD1	42	40
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	DRD4	51	47
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	ADRA1D	57	40
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	HTR2A	69	45
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	HTR2C	47	43
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	SLC6A4	23	45
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	ADRA1A	43	39
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	ADRA1B	40	44
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	DRD3	91	46
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	HTR7	82	45
COCCCS(=O)(=O)NCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994225	GD	On-Demand	Anodyne	HTR6	22	43
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994227	FF	On-Demand	Anodyne	BMP1	80	38
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994227	FF	On-Demand	Anodyne	MMP13	28	42
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994227	FF	On-Demand	Anodyne	MMP16	0	41
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994227	FF	On-Demand	Anodyne	MMP3	23	48
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994227	FF	On-Demand	Anodyne	MMP9	25	44
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994227	FF	On-Demand	Anodyne	MMP12	23	47
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994228	FF	On-Demand	Anodyne	BMP1	80	38
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994228	FF	On-Demand	Anodyne	MMP13	28	42
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994228	FF	On-Demand	Anodyne	MMP16	0	41
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994228	FF	On-Demand	Anodyne	MMP3	23	48
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994228	FF	On-Demand	Anodyne	MMP9	25	44
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cccnc1C(=O)OC	ZINC000450994228	FF	On-Demand	Anodyne	MMP12	23	47
CC(C)[C@H](SC1CCC1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000450994231	EJ	On-Demand	Anodyne	RBP4	55	36
CC(C)[C@@H](SC1CCC1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000450994239	EJ	On-Demand	Anodyne	RBP4	55	36
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1sccc1Cl	ZINC000450994240	GI	On-Demand	Anodyne	MAPK11	33	40
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1sccc1Cl	ZINC000450994240	GI	On-Demand	Anodyne	MAPK14	45	40
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1sccc1Cl	ZINC000450994240	GI	On-Demand	Anodyne	MAPK13	41	33
CCCCCNC(=O)CSC1CCC1	ZINC000450994243	BF	On-Demand	Anodyne	EPHX2	25	43
CCCCCNC(=O)CSC1CCC1	ZINC000450994243	BF	On-Demand	Anodyne	ASAH1	62	35
COc1ccc(OC)c(CSC2CCC2)c1	ZINC000450994245	BG	On-Demand	Anodyne	QRFPR	66	55
CC(C)[C@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450994247	CJ	On-Demand	Anodyne	CXCL8	40	35
CC(C)[C@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450994247	CJ	On-Demand	Anodyne	KCNQ2	64	39
CC(C)[C@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450994247	CJ	On-Demand	Anodyne	EPHB3	45	31
CC(C)[C@@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450994254	CJ	On-Demand	Anodyne	CXCL8	40	35
CC(C)[C@@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450994254	CJ	On-Demand	Anodyne	KCNQ2	64	39
CC(C)[C@@H](SC1CCC1)C(=O)Nc1ccccc1Cl	ZINC000450994254	CJ	On-Demand	Anodyne	EPHB3	45	31
COc1ccc(NC(=O)[C@H](C)SC2CCC2)c(OC)c1	ZINC000450994279	CG	On-Demand	Anodyne	ACAT	0	41
COc1ccc(NC(=O)[C@@H](C)SC2CCC2)c(OC)c1	ZINC000450994281	CG	On-Demand	Anodyne	ACAT	0	41
O=[N+]([O-])c1ccc(CCSC2CCC2)cc1	ZINC000450994283	BG	On-Demand	Bother	LUXR	16	40
O=[N+]([O-])c1ccc(CCSC2CCC2)cc1	ZINC000450994283	BG	On-Demand	Bother	KCNJ1	26	40
COc1ccc(OCCNS(=O)(=O)c2cnccc2C)cc1	ZINC000450994291	DD	On-Demand	Anodyne	Q95J97_RABIT	0	43
CN(Cc1ccc2c(c1)OCO2)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450994311	GD	On-Demand	Anodyne	BMP1	62	37
Cc1nc2ccccc2n1CCCNS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450994313	FH	On-Demand	Anodyne	HTR7	22	42
Cc1nc2ccccc2n1CCCNS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450994313	FH	On-Demand	Anodyne	ALDH3A1	41	39
O=C(CCCSC1CCC1)c1ccccc1	ZINC000450994319	BH	On-Demand	Anodyne	CYP2J2	50	36
COc1ccc2c(c1)CCCN2C(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450994336	FG	On-Demand	Anodyne	DRD4	40	32
COc1ccc2c(c1)CCCN2C(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450994337	FG	On-Demand	Anodyne	DRD4	40	32
COc1ccc2c(c1)CCCN2C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450994338	FG	On-Demand	Anodyne	DRD4	40	32
COc1ccc2c(c1)CCCN2C(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450994339	FG	On-Demand	Anodyne	DRD4	40	32
CCN(Cc1ccccc1)C(=O)[C@H](C)N1CCC[C@@H](c2ccncc2)C1	ZINC000450994340	FH	On-Demand	Anodyne	CCR5	43	33
CCN(Cc1ccccc1)C(=O)[C@@H](C)N1CCC[C@H](c2ccncc2)C1	ZINC000450994341	FH	On-Demand	Anodyne	CCR5	43	33
CCN(Cc1ccccc1)C(=O)[C@H](C)N1CCC[C@H](c2ccncc2)C1	ZINC000450994342	FH	On-Demand	Anodyne	CCR5	43	33
CCN(Cc1ccccc1)C(=O)[C@@H](C)N1CCC[C@@H](c2ccncc2)C1	ZINC000450994343	FH	On-Demand	Anodyne	CCR5	43	33
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C#N)CC)cc1	ZINC000450994344	DD	On-Demand	Mild	TMPRSS11D	51	35
O=C(CN1CCC[C@H](c2ccncc2)C1)NCCCN1CCCC1=O	ZINC000450994345	ED	On-Demand	Anodyne	TYRO3	26	42
O=C(CN1CCC[C@@H](c2ccncc2)C1)NCCCN1CCCC1=O	ZINC000450994346	ED	On-Demand	Anodyne	TYRO3	26	42
C[C@@H]1Cc2ncn(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)c2C[C@H]1C	ZINC000450994359	FF	On-Demand	Bother	EIF2AK3	49	32
C[C@H]1Cc2c(ncn2CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1C	ZINC000450994360	FF	On-Demand	Bother	EIF2AK3	49	32
C[C@H]1Cc2ncn(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)c2C[C@H]1C	ZINC000450994361	FF	On-Demand	Bother	EIF2AK3	49	32
C[C@H]1Cc2ncn(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)c2C[C@@H]1C	ZINC000450994362	FF	On-Demand	Bother	EIF2AK3	49	32
CC(=O)N[C@H](C(=O)N(C)C[C@@H]1C[C@H](F)CN1Cc1scnc1C)C(C)(C)C	ZINC000450994373	GE	On-Demand	Anodyne	VHL	47	40
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	HTR1A	38	48
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	DRD2	45	48
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	DRD1	31	40
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	DRD4	60	48
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	ADRA1D	23	50
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	HTR2A	30	41
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	ADRA1A	22	43
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	DRD3	46	51
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	HTR7	28	42
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	NOX1	55	38
Clc1ccccc1N1CCCN(Cc2ncccn2)CC1	ZINC000450994385	DF	On-Demand	Anodyne	NOX5	46	38
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	HTR1A	29	56
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	DRD2	45	56
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	DRD1	24	41
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	DRD4	58	56
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	ADRA1D	18	44
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	DRD3	44	56
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	SIGMAR1	21	44
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	NOX4	46	39
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	NOX1	57	39
Fc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994386	DH	On-Demand	Anodyne	NOX5	52	36
CCOC(=O)c1cnc(C)c(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c1	ZINC000450994387	GE	On-Demand	Anodyne	P2RY12	41	37
COCC1=CCN(C(=O)C2=C(c3ccccc3)CCCC2)CC1	ZINC000450994391	DH	On-Demand	Anodyne	CHRM5	36	40
Cc1nc2ccccc2n1CCCNS(=O)(=O)c1sccc1Cl	ZINC000450994397	FG	On-Demand	Anodyne	ALDH3A1	40	38
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450994401	GH	On-Demand	Anodyne	MAPK11	34	40
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450994401	GH	On-Demand	Anodyne	MAPK14	53	40
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1sccc1F	ZINC000450994401	GH	On-Demand	Anodyne	MAPK13	90	35
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994404	GI	On-Demand	Anodyne	DRD1	16	46
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994404	GI	On-Demand	Anodyne	SLC18A2	40	34
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994404	GI	On-Demand	Anodyne	DPP4	0	40
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994404	GI	On-Demand	Anodyne	MTNR1A	0	43
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994404	GI	On-Demand	Anodyne	MTNR1B	32	54
COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994404	GI	On-Demand	Anodyne	HCRTR2	15	40
COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994407	GI	On-Demand	Anodyne	DRD1	16	46
COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994407	GI	On-Demand	Anodyne	SLC18A2	40	34
COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994407	GI	On-Demand	Anodyne	DPP4	0	40
COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994407	GI	On-Demand	Anodyne	MTNR1A	0	43
COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994407	GI	On-Demand	Anodyne	MTNR1B	32	54
COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)CSC1CCC1)CC2	ZINC000450994407	GI	On-Demand	Anodyne	HCRTR2	15	40
COCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994416	FD	On-Demand	Anodyne	CA2	18	49
COCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994416	FD	On-Demand	Anodyne	CA1	19	42
COCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994416	FD	On-Demand	Anodyne	MMP13	30	41
COCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994416	FD	On-Demand	Anodyne	CA14	17	42
COCCOCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994416	FD	On-Demand	Anodyne	CA9	15	49
CCc1cccc(C(=O)NC[C@@H](COC)NC(=O)c2cccc(CC)n2)n1	ZINC000450994426	FD	On-Demand	Anodyne	PDE5A	0	41
CCc1cccc(C(=O)NC[C@H](COC)NC(=O)c2cccc(CC)n2)n1	ZINC000450994427	FD	On-Demand	Anodyne	PDE5A	26	41
O=C(CSC1CCC1)Nc1c(Cl)cccc1C(F)(F)F	ZINC000450994430	DJ	On-Demand	Anodyne	P2RX7	45	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCc3ccncc32)c1	ZINC000450994439	FF	On-Demand	Anodyne	CYP11B2	45	49
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450994441	DG	On-Demand	Bother	KCNMA1	23	51
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)SC1CCC1	ZINC000450994442	DG	On-Demand	Bother	KCNMA1	23	51
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450994449	DI	On-Demand	Anodyne	MAOA	0	46
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450994449	DI	On-Demand	Anodyne	MAOB	32	46
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450994449	DI	On-Demand	Anodyne	KCNQ1	0	42
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450994449	DI	On-Demand	Anodyne	ROCK1	20	47
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450994449	DI	On-Demand	Anodyne	CAPN1	0	41
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450994449	DI	On-Demand	Anodyne	HDAC9	18	55
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450994449	DI	On-Demand	Anodyne	SPHK1	30	40
O=C(CSC1CCC1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000450994449	DI	On-Demand	Anodyne	TRPA1	21	41
C[C@@H]1Cc2ncn(CC(=O)NCc3ccc(OC(F)(F)F)cc3)c2C[C@H]1C	ZINC000450994454	GG	On-Demand	Anodyne	SCN9A	0	44
C[C@H]1Cc2c(ncn2CC(=O)NCc2ccc(OC(F)(F)F)cc2)C[C@H]1C	ZINC000450994455	GG	On-Demand	Anodyne	SCN9A	0	44
C[C@H]1Cc2ncn(CC(=O)NCc3ccc(OC(F)(F)F)cc3)c2C[C@H]1C	ZINC000450994456	GG	On-Demand	Anodyne	SCN9A	0	44
C[C@H]1Cc2ncn(CC(=O)NCc3ccc(OC(F)(F)F)cc3)c2C[C@@H]1C	ZINC000450994458	GG	On-Demand	Anodyne	SCN9A	0	44
COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2cccnc2N(C)C)c1	ZINC000450994469	GF	On-Demand	Anodyne	P2RY1	15	41
CC(=O)N1CCCc2cc(NS(=O)(=O)c3sccc3Cl)ccc21	ZINC000450994470	FH	On-Demand	Anodyne	HSD17B3	42	36
COC(=O)c1ncccc1S(=O)(=O)N1CCc2cc(C(C)(C)C)ccc21	ZINC000450994472	FF	On-Demand	Anodyne	CYP11B2	37	42
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1cnc(O)s1	ZINC000450994485	GF	On-Demand	Anodyne	MAPK11	35	41
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1cnc(O)s1	ZINC000450994485	GF	On-Demand	Anodyne	MAPK14	50	41
Cc1cc(C(=O)NC2CCCC2)ccc1NS(=O)(=O)c1cnc(O)s1	ZINC000450994485	GF	On-Demand	Anodyne	MAPK13	50	34
Cc1cc(N2CCSCC2)ccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450994489	GI	On-Demand	Anodyne	GHSR	26	42
CCOC(=O)c1cnc(C)c(NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450994500	FG	On-Demand	Anodyne	P2RY12	31	44
CCNC(=O)CNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450994525	DD	On-Demand	Anodyne	IAP	0	44
CCc1nc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)no1	ZINC000450994542	GD	On-Demand	Anodyne	MTNN	43	37
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	HTR1A	23	51
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	DRD2	22	41
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	ADRA1D	23	42
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	HTR2A	27	47
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	ADRA1A	23	40
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	HTR7	39	51
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	HRH3	40	35
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	HTR6	24	47
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCCC1	ZINC000450994545	ED	On-Demand	Anodyne	HNMT	81	40
Fc1ccc(-c2noc(CSC3CCC3)n2)cc1	ZINC000450994553	CH	On-Demand	Anodyne	TNKS2	16	45
CC1CCC(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450994555	GF	On-Demand	Anodyne	LUXN	0	46
CC1CCC(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450994555	GF	On-Demand	Anodyne	ADIPOR1	0	42
CC1CCC(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)CC1	ZINC000450994555	GF	On-Demand	Anodyne	ADIPOR2	0	42
Cc1ccc2cc(S(=O)(=O)NCCN3CCCC3)ccc2c1	ZINC000450994558	DF	On-Demand	Anodyne	HTR7	34	54
Cc1ccc2cc(S(=O)(=O)NCCN3CCCC3)ccc2c1	ZINC000450994558	DF	On-Demand	Anodyne	TRY2_BOVIN	51	36
Cc1ccc2cc(S(=O)(=O)NCCN3CCCC3)ccc2c1	ZINC000450994558	DF	On-Demand	Anodyne	NPY2R	30	42
Cc1ccc2cc(S(=O)(=O)NCCN3CCCC3)ccc2c1	ZINC000450994558	DF	On-Demand	Anodyne	HTR6	0	48
Cc1nc2ccccc2n1CCCNS(=O)(=O)CCOCc1ccccc1	ZINC000450994573	GF	On-Demand	Anodyne	PDE6D	33	44
O=S(=O)(Cc1ccc(Br)c(F)c1)NCCCN1CCCC1	ZINC000450994579	GE	On-Demand	Anodyne	HNMT	55	33
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	HTR1A	85	56
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	DRD2	69	46
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	DRD1	25	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	DRD4	50	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	ADRA1D	36	51
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	HTR2A	40	46
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	HTR2C	24	41
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	SLC6A4	16	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	ADRA1A	31	45
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	ADRA1B	27	51
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	DRD3	84	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	HTR7	64	45
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	KCNQ2	49	39
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	AKR1C3	15	43
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	NOX1	52	34
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCOCC1	ZINC000450994582	FE	On-Demand	Anodyne	NOX5	49	34
COC(=O)c1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cn1	ZINC000450994595	GD	On-Demand	Anodyne	ADRB2	18	43
CC1(C)CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@@H]1O	ZINC000450994603	FF	On-Demand	Anodyne	TRPC6	92	51
CC1(C)CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@@H]1O	ZINC000450994603	FF	On-Demand	Anodyne	TRPC3	83	51
CC1(C)CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@H]1O	ZINC000450994604	FF	On-Demand	Anodyne	TRPC6	92	51
CC1(C)CN(C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)CC[C@H]1O	ZINC000450994604	FF	On-Demand	Anodyne	TRPC3	83	51
C=Cc1ccc(S(=O)(=O)NCCCN2CCCC2)cc1	ZINC000450994613	CE	On-Demand	Anodyne	HTR2A	16	40
C=Cc1ccc(S(=O)(=O)NCCCN2CCCC2)cc1	ZINC000450994613	CE	On-Demand	Anodyne	HTR7	32	47
C=Cc1ccc(S(=O)(=O)NCCCN2CCCC2)cc1	ZINC000450994613	CE	On-Demand	Anodyne	CCR1	18	51
C=Cc1ccc(S(=O)(=O)NCCCN2CCCC2)cc1	ZINC000450994613	CE	On-Demand	Anodyne	HTR6	20	45
O=S(=O)(NCCN1CCCC1)c1cc2cc(F)ccc2o1	ZINC000450994615	DD	On-Demand	Anodyne	HTR7	28	42
CCCN(C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)[C@H]1CCCc2cccnc21	ZINC000450994623	FJ	On-Demand	Anodyne	CXCR4	73	41
CCCN(C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)[C@H]1CCCc2cccnc21	ZINC000450994623	FJ	On-Demand	Anodyne	GPR88	0	43
CCCN(C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)[C@@H]1CCCc2cccnc21	ZINC000450994624	FJ	On-Demand	Anodyne	CXCR4	74	41
CCCN(C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)[C@@H]1CCCc2cccnc21	ZINC000450994624	FJ	On-Demand	Anodyne	GPR88	0	43
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CCCO	ZINC000450994627	CD	On-Demand	Anodyne	SLC6A1	15	45
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CCCO	ZINC000450994628	CD	On-Demand	Anodyne	SLC6A1	15	45
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2Cc1cc(-c2ccccc2)on1	ZINC000450994632	FI	On-Demand	Anodyne	SLC6A1	46	37
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1cc(-c2ccccc2)on1	ZINC000450994633	FI	On-Demand	Anodyne	SLC6A1	46	37
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1nc(-c2cccc(Cl)c2)no1	ZINC000450994634	GI	On-Demand	Anodyne	GRM5	27	43
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2Cc1nc(-c2cccc(Cl)c2)no1	ZINC000450994635	GI	On-Demand	Anodyne	GRM5	27	43
CCOC(=O)c1ccc(CS(=O)(=O)NCCCN2CCCC[C@@H]2C)cc1	ZINC000450994636	GF	On-Demand	Anodyne	HRH3	63	46
CCOC(=O)c1ccc(CS(=O)(=O)NCCCN2CCCC[C@@H]2C)cc1	ZINC000450994636	GF	On-Demand	Anodyne	TMPRSS11D	41	33
CCOC(=O)c1ccc(CS(=O)(=O)NCCCN2CCCC[C@H]2C)cc1	ZINC000450994637	GF	On-Demand	Anodyne	HRH3	63	46
CCOC(=O)c1ccc(CS(=O)(=O)NCCCN2CCCC[C@H]2C)cc1	ZINC000450994637	GF	On-Demand	Anodyne	TMPRSS11D	41	33
CC(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450994650	FC	On-Demand	Anodyne	MMP13	26	44
CC(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450994650	FC	On-Demand	Anodyne	MMP2	23	48
CC(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450994650	FC	On-Demand	Anodyne	ADAMTS4	52	42
CCC[C@@H](OC)C(=O)N(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450994655	DH	On-Demand	Anodyne	CXCR4	76	40
CCC[C@@H](OC)C(=O)N(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450994656	DH	On-Demand	Anodyne	CXCR4	76	40
CCC[C@H](OC)C(=O)N(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450994657	DH	On-Demand	Anodyne	CXCR4	76	40
CCC[C@H](OC)C(=O)N(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450994659	DH	On-Demand	Anodyne	CXCR4	76	40
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	CA2	22	42
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	CA1	34	47
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	MMP13	32	42
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	CA4	29	47
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	MMP2	28	47
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	MMP9	23	47
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	MMP12	41	36
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	LEF	52	37
CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994660	ED	On-Demand	Anodyne	P96878_MYCTU	40	37
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	CA2	22	42
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	CA1	34	47
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	MMP13	32	42
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	CA4	29	47
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	MMP2	28	47
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	MMP9	23	47
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	MMP12	41	36
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	LEF	52	37
CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994661	ED	On-Demand	Anodyne	P96878_MYCTU	40	37
CC(C)NC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994662	FD	On-Demand	Anodyne	CA2	21	52
CC(C)NC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994662	FD	On-Demand	Anodyne	CA1	23	42
CC(C)NC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994662	FD	On-Demand	Anodyne	COLA	42	38
CC(C)NC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994662	FD	On-Demand	Anodyne	CA4	24	40
CC(C)NC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994662	FD	On-Demand	Anodyne	CA14	15	44
CC(C)NC(=O)CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994662	FD	On-Demand	Anodyne	MMP8	22	40
CCCN(C(=O)c1cc2ccncc2s1)[C@H]1CCCc2cccnc21	ZINC000450994663	FJ	On-Demand	Anodyne	CXCR4	76	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ncccc3NC(=O)[C@H]2C)cc1	ZINC000450994665	GE	On-Demand	Anodyne	TGM2	19	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ncccc3NC(=O)[C@H]2C)cc1	ZINC000450994665	GE	On-Demand	Anodyne	F13A1	23	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ncccc3NC(=O)[C@@H]2C)cc1	ZINC000450994666	GE	On-Demand	Anodyne	TGM2	19	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2c3ncccc3NC(=O)[C@@H]2C)cc1	ZINC000450994666	GE	On-Demand	Anodyne	F13A1	23	40
CCCN(C(=O)c1cc2ccncc2s1)[C@@H]1CCCc2cccnc21	ZINC000450994668	FJ	On-Demand	Anodyne	CXCR4	76	41
COc1cc(CC(=O)N(CC(C)C)[C@@H]2CCCc3cccnc32)ccc1O	ZINC000450994670	FH	On-Demand	Anodyne	CXCR4	71	37
COc1cc(CC(=O)N(CC(C)C)[C@H]2CCCc3cccnc32)ccc1O	ZINC000450994673	FH	On-Demand	Anodyne	CXCR4	71	37
CCCN(C(=O)Cc1cc2ccccc2c(O)n1)[C@H]1CCCc2cccnc21	ZINC000450994677	GI	On-Demand	Anodyne	CXCR4	81	44
CCCN(C(=O)Cc1cc2ccccc2c(O)n1)[C@@H]1CCCc2cccnc21	ZINC000450994679	GI	On-Demand	Anodyne	CXCR4	81	44
CCC(CC)(NC(=O)C1CN(Cc2cccc(C)n2)C1)C(N)=O	ZINC000450994680	DC	On-Demand	Anodyne	PDE8A	0	41
CCC(CC)(NC(=O)C1CN(Cc2cccc(C)n2)C1)C(N)=O	ZINC000450994680	DC	On-Demand	Anodyne	PDE8B	57	41
CCOC(=O)c1cc(S(=O)(=O)N2CCN(CCO)CC2)cnc1C(F)F	ZINC000450994681	GC	On-Demand	Anodyne	PDE5A	24	40
COc1cccc(COC[C@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)c1	ZINC000450994683	GF	On-Demand	Anodyne	SLC18A2	16	41
COc1cccc(COC[C@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)c1	ZINC000450994685	GF	On-Demand	Anodyne	SLC18A2	16	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cnn(C)c2)cc1	ZINC000450994686	FD	On-Demand	Anodyne	BMP1	51	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)Cc2cnn(C)c2)cc1	ZINC000450994686	FD	On-Demand	Anodyne	NAMPT	36	42
CCCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450994687	FG	On-Demand	Anodyne	CA2	19	42
CCCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450994687	FG	On-Demand	Anodyne	ADRB2	28	44
CCCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450994687	FG	On-Demand	Anodyne	ADRB1	19	44
CCCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450994687	FG	On-Demand	Anodyne	CA1	21	42
CCCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450994687	FG	On-Demand	Anodyne	CA4	30	42
CCCc1cnc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)s1	ZINC000450994687	FG	On-Demand	Anodyne	LEF	15	43
COc1cccc(COC[C@@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)c1	ZINC000450994688	GF	On-Demand	Anodyne	SLC18A2	16	41
COc1cccc(COC[C@@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)c1	ZINC000450994691	GF	On-Demand	Anodyne	SLC18A2	16	41
C[C@H](NC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994697	GG	On-Demand	Anodyne	CHRM1	17	40
C[C@H](NC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994697	GG	On-Demand	Anodyne	SLC6A1	32	40
C[C@H](NC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994697	GG	On-Demand	Anodyne	SLC6A3	42	40
CCOC(=O)c1ccccc1NC(=O)CSC1CCC1	ZINC000450994698	CG	On-Demand	Anodyne	FAS	31	48
C[C@@H](NC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994700	GG	On-Demand	Anodyne	CHRM1	17	40
C[C@@H](NC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994700	GG	On-Demand	Anodyne	SLC6A1	32	40
C[C@@H](NC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994700	GG	On-Demand	Anodyne	SLC6A3	42	40
FC(F)[C@H]1CCCN1CC/C=C/c1ccccc1	ZINC000450994702	CH	On-Demand	Anodyne	SLC6A1	26	44
C[C@@H](NC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994703	GG	On-Demand	Anodyne	CHRM1	17	40
C[C@@H](NC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994703	GG	On-Demand	Anodyne	SLC6A1	32	40
C[C@@H](NC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994703	GG	On-Demand	Anodyne	SLC6A3	42	40
FC(F)[C@H]1CCCN1CC/C=C\c1ccccc1	ZINC000450994704	CH	On-Demand	Anodyne	SLC6A1	26	44
C[C@H](NC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994705	GG	On-Demand	Anodyne	CHRM1	17	40
C[C@H](NC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994705	GG	On-Demand	Anodyne	SLC6A1	32	40
C[C@H](NC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccc(F)cc1	ZINC000450994705	GG	On-Demand	Anodyne	SLC6A3	42	40
CC(C)CN(C(=O)Cc1cc2ccccc2c(O)n1)[C@H]1CCCc2cccnc21	ZINC000450994706	GI	On-Demand	Anodyne	CXCR4	80	44
CC(C)CN(C(=O)Cc1cc2ccccc2c(O)n1)[C@@H]1CCCc2cccnc21	ZINC000450994707	GI	On-Demand	Anodyne	CXCR4	80	44
C=Cc1ccc(S(=O)(=O)NCCCN2CCCC[C@@H]2C)cc1	ZINC000450994708	DF	On-Demand	Anodyne	HRH3	36	53
C=Cc1ccc(S(=O)(=O)NCCCN2CCCC[C@H]2C)cc1	ZINC000450994709	DF	On-Demand	Anodyne	HRH3	36	53
CCCN(C(=O)[C@H](Cc1ccccc1)OC)[C@H]1CCCc2cccnc21	ZINC000450994712	FH	On-Demand	Anodyne	CXCR4	79	41
CCCN(C(=O)[C@H](Cc1ccccc1)OC)[C@@H]1CCCc2cccnc21	ZINC000450994713	FH	On-Demand	Anodyne	CXCR4	79	41
CCCN(C(=O)[C@@H](Cc1ccccc1)OC)[C@H]1CCCc2cccnc21	ZINC000450994714	FH	On-Demand	Anodyne	CXCR4	79	41
CCCN(C(=O)[C@@H](Cc1ccccc1)OC)[C@@H]1CCCc2cccnc21	ZINC000450994715	FH	On-Demand	Anodyne	CXCR4	79	41
CC(C)CN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCCc2cccnc21	ZINC000450994727	GJ	On-Demand	Anodyne	CXCR4	77	42
CC(C)CN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCCc2cccnc21	ZINC000450994728	GJ	On-Demand	Anodyne	CXCR4	77	42
CCN(c1ccc(OC)cc1)S(=O)(=O)c1cnc(O)s1	ZINC000450994729	DE	On-Demand	Anodyne	OXTR	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NC2CC2)cc1	ZINC000450994730	FD	On-Demand	Anodyne	CA2	15	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NC2CC2)cc1	ZINC000450994730	FD	On-Demand	Anodyne	CA7	15	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NC2CC2)cc1	ZINC000450994730	FD	On-Demand	Anodyne	CA14	17	41
C[C@H]1CCCCN1CCCNS(=O)(=O)CCOCc1ccccc1	ZINC000450994741	FE	On-Demand	Anodyne	HRH3	53	45
C[C@H]1CCCCN1CCCNS(=O)(=O)CCOCc1ccccc1	ZINC000450994741	FE	On-Demand	Anodyne	PLA2G4A	15	42
C[C@@H]1CCCCN1CCCNS(=O)(=O)CCOCc1ccccc1	ZINC000450994742	FE	On-Demand	Anodyne	HRH3	53	45
C[C@@H]1CCCCN1CCCNS(=O)(=O)CCOCc1ccccc1	ZINC000450994742	FE	On-Demand	Anodyne	PLA2G4A	15	42
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CC[S@](=O)c1ccccc1	ZINC000450994745	EF	On-Demand	Anodyne	SLC6A1	55	38
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CC[S@](=O)c1ccccc1	ZINC000450994746	EF	On-Demand	Anodyne	SLC6A1	55	38
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CC[S@@](=O)c1ccccc1	ZINC000450994747	EF	On-Demand	Anodyne	SLC6A1	55	38
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CC[S@@](=O)c1ccccc1	ZINC000450994748	EF	On-Demand	Anodyne	SLC6A1	55	38
CC(C)CN(C(=O)[C@@H](O)C1CCC1)[C@@H]1CCCc2cccnc21	ZINC000450994750	DG	On-Demand	Anodyne	CXCR4	79	43
CC(C)CN(C(=O)[C@H](O)C1CCC1)[C@H]1CCCc2cccnc21	ZINC000450994751	DG	On-Demand	Anodyne	CXCR4	79	43
CC(C)CN(C(=O)[C@H](O)C1CCC1)[C@@H]1CCCc2cccnc21	ZINC000450994752	DG	On-Demand	Anodyne	CXCR4	79	43
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	HTR1A	51	51
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	DRD2	48	55
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	DRD4	27	43
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	ADRA1D	25	49
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	HTR1B	22	43
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	HTR2A	26	49
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	ADRA1A	26	42
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	ADRA1B	23	49
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	DRD3	53	55
Clc1ccccc1N1CCCN(CCC2CCOCC2)CC1	ZINC000450994753	DH	On-Demand	Anodyne	HTR7	25	41
CC(C)OCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994754	EG	On-Demand	Anodyne	HTR1A	24	40
CC(C)OCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994754	EG	On-Demand	Anodyne	ADRA1D	22	40
CC(C)OCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994754	EG	On-Demand	Anodyne	DRD3	40	41
CC(C)OCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994754	EG	On-Demand	Anodyne	ABCB1	47	46
CC(C)OCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994754	EG	On-Demand	Anodyne	HSP90AB1	40	46
CC(C)OCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994755	EG	On-Demand	Anodyne	HTR1A	24	40
CC(C)OCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994755	EG	On-Demand	Anodyne	ADRA1D	22	40
CC(C)OCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994755	EG	On-Demand	Anodyne	DRD3	40	41
CC(C)OCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994755	EG	On-Demand	Anodyne	ABCB1	47	46
CC(C)OCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450994755	EG	On-Demand	Anodyne	HSP90AB1	40	46
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	HTR1A	73	46
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	DRD2	71	46
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	DRD4	38	46
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	ADRA1D	66	42
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	HTR2A	42	40
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	ADRA1A	53	42
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	ADRA1B	44	48
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	DRD3	81	40
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	HTR7	55	39
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	KCNQ2	79	41
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	NOX1	53	34
COC(=O)C1(CN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450994756	DF	On-Demand	Anodyne	NOX5	51	34
C[C@H]1Cc2c(ncn2Cc2nc3cc(Cl)ccc3n2C)C[C@H]1C	ZINC000450994760	EH	On-Demand	Anodyne	GRM2	15	41
C[C@H]1Cc2ncn(Cc3nc4cc(Cl)ccc4n3C)c2C[C@H]1C	ZINC000450994761	EH	On-Demand	Anodyne	GRM2	15	41
C[C@H]1Cc2ncn(Cc3nc4cc(Cl)ccc4n3C)c2C[C@@H]1C	ZINC000450994762	EH	On-Demand	Anodyne	GRM2	15	41
C[C@@H]1Cc2ncn(Cc3nc4cc(Cl)ccc4n3C)c2C[C@H]1C	ZINC000450994763	EH	On-Demand	Anodyne	GRM2	15	41
Clc1ccccc1N1CCCN(Cc2nc(C3CC3)n[nH]2)CC1	ZINC000450994770	EG	On-Demand	Anodyne	DRD4	31	41
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	HTR1A	78	43
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	DRD2	74	47
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	DRD4	53	47
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	ADRA1D	45	39
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	ADRA1A	42	42
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	ADRA1B	27	42
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	DRD3	90	42
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	HTR7	55	38
COC(=O)[C@@H](NC(=O)CN1CCCN(c2ccccc2Cl)CC1)C(C)C	ZINC000450994777	GE	On-Demand	Anodyne	KCNQ2	73	40
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	HTR1A	131	47
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	DRD2	113	49
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	DRD1	50	43
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	DRD4	72	45
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	ADRA1D	50	45
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	HTR2A	81	49
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	HTR2C	42	46
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	SLC6A4	27	49
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	ADRA1A	47	49
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	ADRA1B	33	45
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	DRD3	118	48
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	HTR7	100	47
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	SIGMAR1	26	49
Cc1nccn1CCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994778	EH	On-Demand	Anodyne	HNMT	66	36
CC(C)C(C)(C)CNC(=O)C[C@@H]1COc2ccccc2O1	ZINC000450994792	CG	On-Demand	Anodyne	HTR1A	0	43
CC(C)C(C)(C)CNC(=O)C[C@H]1COc2ccccc2O1	ZINC000450994793	CG	On-Demand	Anodyne	HTR1A	0	43
C[C@@H]1Cc2ncn(CC(=O)N[C@@H]3CCCc4ccccc43)c2C[C@H]1C	ZINC000450994813	EG	On-Demand	Anodyne	HTR3B	0	40
C[C@@H]1Cc2ncn(CC(=O)N[C@@H]3CCCc4ccccc43)c2C[C@H]1C	ZINC000450994813	EG	On-Demand	Anodyne	BIRC3	26	40
C[C@@H]1Cc2ncn(CC(=O)N[C@H]3CCCc4ccccc43)c2C[C@H]1C	ZINC000450994814	EG	On-Demand	Anodyne	HTR3B	0	40
C[C@@H]1Cc2ncn(CC(=O)N[C@H]3CCCc4ccccc43)c2C[C@H]1C	ZINC000450994814	EG	On-Demand	Anodyne	BIRC3	26	40
C[C@H]1Cc2c(ncn2CC(=O)N[C@@H]2CCCc3ccccc32)C[C@H]1C	ZINC000450994815	EG	On-Demand	Anodyne	HTR3B	0	40
C[C@H]1Cc2c(ncn2CC(=O)N[C@@H]2CCCc3ccccc32)C[C@H]1C	ZINC000450994815	EG	On-Demand	Anodyne	BIRC3	26	40
C[C@H]1Cc2c(ncn2CC(=O)N[C@H]2CCCc3ccccc32)C[C@H]1C	ZINC000450994816	EG	On-Demand	Anodyne	HTR3B	0	40
C[C@H]1Cc2c(ncn2CC(=O)N[C@H]2CCCc3ccccc32)C[C@H]1C	ZINC000450994816	EG	On-Demand	Anodyne	BIRC3	26	40
Clc1ccccc1N1CCCN(Cc2nc3cccnc3s2)CC1	ZINC000450994817	FI	On-Demand	Anodyne	HTR1A	24	42
Clc1ccccc1N1CCCN(Cc2nc3cccnc3s2)CC1	ZINC000450994817	FI	On-Demand	Anodyne	DRD2	28	46
Clc1ccccc1N1CCCN(Cc2nc3cccnc3s2)CC1	ZINC000450994817	FI	On-Demand	Anodyne	DRD1	0	42
Clc1ccccc1N1CCCN(Cc2nc3cccnc3s2)CC1	ZINC000450994817	FI	On-Demand	Anodyne	DRD4	40	51
Clc1ccccc1N1CCCN(Cc2nc3cccnc3s2)CC1	ZINC000450994817	FI	On-Demand	Anodyne	HTR2A	18	42
Clc1ccccc1N1CCCN(Cc2nc3cccnc3s2)CC1	ZINC000450994817	FI	On-Demand	Anodyne	DRD3	35	47
O=[S@](CCN1CCC[C@H](c2ccncc2)C1)c1ccccc1	ZINC000450994818	DG	On-Demand	Anodyne	SLC6A1	70	36
O=[S@@](CCN1CCC[C@H](c2ccncc2)C1)c1ccccc1	ZINC000450994819	DG	On-Demand	Anodyne	SLC6A1	70	36
O=[S@](CCN1CCC[C@@H](c2ccncc2)C1)c1ccccc1	ZINC000450994820	DG	On-Demand	Anodyne	SLC6A1	70	36
O=[S@@](CCN1CCC[C@@H](c2ccncc2)C1)c1ccccc1	ZINC000450994821	DG	On-Demand	Anodyne	SLC6A1	70	36
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	DRD4	44	34
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	HRH2	37	46
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	OPRK1	26	43
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	AVPR1B	58	46
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	HRH3	29	45
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	MTNR1A	40	41
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	MTNR1B	41	42
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	ABCB1	33	43
COc1cccc(OCCC(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000450994822	EF	On-Demand	Anodyne	PSMB2	44	33
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	DRD4	44	34
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	HRH2	37	46
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	OPRK1	26	43
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	AVPR1B	58	46
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	HRH3	29	45
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	MTNR1A	40	41
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	MTNR1B	41	42
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	ABCB1	33	43
COc1cccc(OCCC(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000450994823	EF	On-Demand	Anodyne	PSMB2	44	33
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	HTR1A	103	51
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	DRD2	94	71
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	DRD1	39	44
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	DRD4	58	45
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	ADRA1D	38	49
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	HTR2A	59	71
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	HTR2C	29	43
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	SLC6A4	22	71
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	ADRA1A	36	50
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	HRH1	22	43
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	ADRA1B	29	49
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	DRD3	91	46
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	HTR7	67	43
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	HRH3	25	52
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	SIGMAR1	47	71
Clc1ccccc1N1CCCN(CCCc2ccncc2)CC1	ZINC000450994834	EH	On-Demand	Anodyne	HNMT	84	34
Cc1ccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)c(F)c1	ZINC000450994839	EG	On-Demand	Anodyne	DRD4	0	44
Cc1ccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)c(F)c1	ZINC000450994840	EG	On-Demand	Anodyne	DRD4	0	44
C[C@H]1Cc2ncn(CC(=O)NCc3cccc(OCC(F)(F)F)c3)c2C[C@@H]1C	ZINC000450994842	GH	On-Demand	Anodyne	PDS	54	36
C[C@H]1Cc2c(ncn2CC(=O)NCc2cccc(OCC(F)(F)F)c2)C[C@H]1C	ZINC000450994843	GH	On-Demand	Anodyne	PDS	54	36
C[C@H]1Cc2ncn(CC(=O)NCc3cccc(OCC(F)(F)F)c3)c2C[C@H]1C	ZINC000450994844	GH	On-Demand	Anodyne	PDS	54	36
C[C@@H]1Cc2ncn(CC(=O)NCc3cccc(OCC(F)(F)F)c3)c2C[C@H]1C	ZINC000450994845	GH	On-Demand	Anodyne	PDS	54	36
C[C@@H]1Cc2ncn(CC(=O)NCc3ccc(Cl)cc3)c2C[C@H]1C	ZINC000450994846	EG	On-Demand	Anodyne	UL54	45	33
C[C@H]1Cc2c(ncn2CC(=O)NCc2ccc(Cl)cc2)C[C@H]1C	ZINC000450994847	EG	On-Demand	Anodyne	UL54	45	33
C[C@H]1Cc2ncn(CC(=O)NCc3ccc(Cl)cc3)c2C[C@H]1C	ZINC000450994848	EG	On-Demand	Anodyne	UL54	45	33
C[C@H]1Cc2ncn(CC(=O)NCc3ccc(Cl)cc3)c2C[C@@H]1C	ZINC000450994849	EG	On-Demand	Anodyne	UL54	45	33
Cc1cncc(-c2nc(CN3CCCN(c4ccccc4Cl)CC3)no2)c1	ZINC000450994851	GH	On-Demand	Anodyne	DRD2	15	42
COc1ccccc1O[C@@H]1CCCN(C[C@](C)(O)C(C)=O)C1	ZINC000450994859	DD	On-Demand	Anodyne	ACKR3	44	31
COc1ccccc1O[C@@H]1CCCN(C[C@@](C)(O)C(C)=O)C1	ZINC000450994860	DD	On-Demand	Anodyne	ACKR3	44	31
COc1ccccc1O[C@H]1CCCN(C[C@@](C)(O)C(C)=O)C1	ZINC000450994861	DD	On-Demand	Anodyne	ACKR3	44	31
COc1ccccc1O[C@H]1CCCN(C[C@](C)(O)C(C)=O)C1	ZINC000450994862	DD	On-Demand	Anodyne	ACKR3	44	31
O=C(CSC1CCC1)N(Cc1ccccc1)CC(F)(F)F	ZINC000450994870	DH	On-Demand	Anodyne	PTGES	15	40
C[C@@H](c1ccc(CN2CC[C@H](COC(F)F)C2)cc1)C(F)(F)F	ZINC000450994876	EI	On-Demand	Anodyne	SLC6A3	24	45
C[C@@H](c1ccc(CN2CC[C@H](COC(F)F)C2)cc1)C(F)(F)F	ZINC000450994876	EI	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1)C(F)(F)F	ZINC000450994877	EI	On-Demand	Anodyne	SLC6A3	24	45
C[C@H](c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1)C(F)(F)F	ZINC000450994877	EI	On-Demand	Anodyne	SIGMAR1	22	40
C[C@@H](c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1)C(F)(F)F	ZINC000450994878	EI	On-Demand	Anodyne	SLC6A3	24	45
C[C@@H](c1ccc(CN2CC[C@@H](COC(F)F)C2)cc1)C(F)(F)F	ZINC000450994878	EI	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](c1ccc(CN2CC[C@H](COC(F)F)C2)cc1)C(F)(F)F	ZINC000450994879	EI	On-Demand	Anodyne	SLC6A3	24	45
C[C@H](c1ccc(CN2CC[C@H](COC(F)F)C2)cc1)C(F)(F)F	ZINC000450994879	EI	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(OC(F)F)ccc21	ZINC000450994880	GF	On-Demand	Anodyne	CYP11B1	15	49
COC(=O)c1ncccc1S(=O)(=O)N1CCCc2cc(OC(F)F)ccc21	ZINC000450994880	GF	On-Demand	Anodyne	CYP11B2	38	49
Cc1cc(Cl)ccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450994892	CI	On-Demand	Anodyne	H9CNL0_SPOEX	0	42
Cc1cc(Cl)ccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450994893	CI	On-Demand	Anodyne	H9CNL0_SPOEX	0	42
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1CO	ZINC000450994895	GF	On-Demand	Anodyne	CA2	17	46
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1CO	ZINC000450994895	GF	On-Demand	Anodyne	ADRB3	15	44
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1CO	ZINC000450994895	GF	On-Demand	Anodyne	CA1	23	42
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1CO	ZINC000450994895	GF	On-Demand	Anodyne	MMP13	31	41
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1CO	ZINC000450994895	GF	On-Demand	Anodyne	ALPL	15	43
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1CO	ZINC000450994895	GF	On-Demand	Anodyne	ADAMTS4	44	34
CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1CO	ZINC000450994895	GF	On-Demand	Anodyne	LEF	15	41
CSc1ccc(NC(=O)CSC2CCC2)cc1	ZINC000450994902	CH	On-Demand	Anodyne	QRFPR	41	34
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	CA2	39	57
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	CA1	46	48
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	CA7	18	50
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	MMP13	39	45
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	CA4	39	48
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	GRM4	16	40
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	CA14	21	50
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	MMP2	33	44
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	MMP12	40	35
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	CA12	28	57
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	CA9	33	57
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	LEF	29	41
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	IDO1	42	40
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	PFK	0	43
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	P96878_MYCTU	48	38
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450994903	FI	On-Demand	Anodyne	ACAT	0	41
CC1CCN(C(=O)c2ccc(NS(=O)(=O)c3sccc3Cl)cc2)CC1	ZINC000450994907	GI	On-Demand	Anodyne	L3MBTL3	65	37
CC1CCN(C(=O)c2ccc(NS(=O)(=O)c3sccc3Cl)cc2)CC1	ZINC000450994907	GI	On-Demand	Anodyne	TRPC6	57	46
CC1CCN(C(=O)c2ccc(NS(=O)(=O)c3sccc3Cl)cc2)CC1	ZINC000450994907	GI	On-Demand	Anodyne	TRPC3	33	46
O=C1CC[C@H](CN2CCCN(c3ccccc3F)CC2)CCN1	ZINC000450994908	DE	On-Demand	Anodyne	HTR1A	15	41
O=C1CC[C@@H](CN2CCCN(c3ccccc3F)CC2)CCN1	ZINC000450994909	DE	On-Demand	Anodyne	HTR1A	15	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450994912	DD	On-Demand	Anodyne	TRPV1	0	45
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450994913	DD	On-Demand	Anodyne	TRPV1	0	45
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450994914	DD	On-Demand	Anodyne	TRPV1	0	45
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)Cc1ccc(O)c(OC)c1	ZINC000450994915	DD	On-Demand	Anodyne	TRPV1	0	45
CO[C@@H](C)CS(=O)(=O)N1CCCc2cc(C(F)(F)F)ccc21	ZINC000450994916	EF	On-Demand	Anodyne	CYP11B2	29	43
CO[C@H](C)CS(=O)(=O)N1CCCc2cc(C(F)(F)F)ccc21	ZINC000450994917	EF	On-Demand	Anodyne	CYP11B2	29	43
O=C(CSC1CCC1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450994920	GD	On-Demand	Bother	TGM2	46	38
O=C(CSC1CCC1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450994920	GD	On-Demand	Bother	F13A1	60	38
C[C@@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450994931	GE	On-Demand	Anodyne	CA2	17	42
C[C@@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450994931	GE	On-Demand	Anodyne	DUT	18	41
C[C@@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450994931	GE	On-Demand	Anodyne	CYNT	20	42
C[C@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450994932	GE	On-Demand	Anodyne	CA2	17	42
C[C@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450994932	GE	On-Demand	Anodyne	DUT	18	41
C[C@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1cccc(S(N)(=O)=O)c1	ZINC000450994932	GE	On-Demand	Anodyne	CYNT	20	42
CCCCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)c(C)c1	ZINC000450994938	GG	On-Demand	Anodyne	PLA2G4B	43	32
COc1ccc(OC)c([C@@H]2CCCN2C(=O)CSC2CCC2)c1	ZINC000450994950	EH	On-Demand	Anodyne	FKBP1A	61	40
COc1ccc(OC)c([C@@H]2CCCN2C(=O)CSC2CCC2)c1	ZINC000450994950	EH	On-Demand	Anodyne	QRFPR	42	34
COc1ccc(OC)c([C@H]2CCCN2C(=O)CSC2CCC2)c1	ZINC000450994952	EH	On-Demand	Anodyne	FKBP1A	61	40
COc1ccc(OC)c([C@H]2CCCN2C(=O)CSC2CCC2)c1	ZINC000450994952	EH	On-Demand	Anodyne	QRFPR	42	34
COC(=O)c1ncccc1S(=O)(=O)NCCCOCC1CC1	ZINC000450994953	EC	On-Demand	Anodyne	NPY2R	43	36
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	HTR1A	145	54
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	DRD2	133	60
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	DRD1	59	53
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	DRD4	68	55
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	ADRA1D	83	50
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	HTR2A	102	54
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	HTR2C	68	57
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	SLC6A4	35	54
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	HRH1	23	41
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	ADRA1B	66	52
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	DRD3	136	60
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	DRD5	35	44
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	HTR7	128	53
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	KCNQ2	79	42
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	HRH3	22	43
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	SIGMAR1	22	40
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	HTR6	29	54
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	CHRNA7	32	44
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	HNMT	47	36
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	AP2S1	0	44
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	ALPHA-1A	0	44
CC(=O)NCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450994985	DE	On-Demand	Anodyne	SMYD2	0	41
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCC1	ZINC000450994990	EC	On-Demand	Anodyne	HTR1A	25	52
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCC1	ZINC000450994990	EC	On-Demand	Anodyne	DRD2	24	42
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCC1	ZINC000450994990	EC	On-Demand	Anodyne	ADRA1D	25	42
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCC1	ZINC000450994990	EC	On-Demand	Anodyne	HTR2A	29	48
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCC1	ZINC000450994990	EC	On-Demand	Anodyne	ADRA1A	26	40
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCC1	ZINC000450994990	EC	On-Demand	Anodyne	HTR7	43	52
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCC1	ZINC000450994990	EC	On-Demand	Anodyne	HTR6	24	48
COC(=O)c1ncccc1S(=O)(=O)NCCCN1CCCC1	ZINC000450994990	EC	On-Demand	Anodyne	HNMT	69	38
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450994991	GG	On-Demand	Anodyne	MTNR1B	16	41
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450994992	GG	On-Demand	Anodyne	MTNR1B	16	41
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450994993	GG	On-Demand	Anodyne	MTNR1B	16	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)c1ccc(Oc2cccc(OC)c2)cn1	ZINC000450994994	GG	On-Demand	Anodyne	MTNR1B	16	41
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	HTR1A	57	51
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	DRD2	59	48
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	DRD1	29	41
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	DRD4	37	45
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	ADRA1D	27	46
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	HTR2A	42	40
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	HTR2C	29	40
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	ADRA1A	26	44
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	ADRA1B	27	51
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	DRD3	61	44
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	HTR7	41	38
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	NOX1	48	32
Cc1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450994997	DG	On-Demand	Anodyne	NOX5	44	32
O=S(=O)(NCCN1CCCC1)c1sc2ccccc2c1Cl	ZINC000450995015	EF	On-Demand	Anodyne	HTR6	23	43
CC(=O)N1CCC(NS(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450995016	ED	On-Demand	Anodyne	CCR8	66	38
CC(=O)N1CCC(NS(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450995016	ED	On-Demand	Anodyne	SFRP1	93	34
CC(=O)N1CCC(NS(=O)(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000450995016	ED	On-Demand	Anodyne	WNT3	74	36
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	HTR1A	125	52
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	DRD2	104	49
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	DRD1	46	39
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	DRD4	73	47
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	ADRA1D	73	45
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	HTR2A	58	43
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	HTR2C	40	41
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	ADRA1A	63	40
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	ADRA1B	46	45
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	DRD3	121	49
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	HTR4	17	43
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	HTR7	93	42
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	KCNQ2	66	38
COC(=O)CN(C)C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995017	FD	On-Demand	Anodyne	AP2S1	0	41
CC[C@@H](C)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995040	EG	On-Demand	Anodyne	DRD2	24	41
CC[C@@H](C)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995040	EG	On-Demand	Anodyne	KCNQ2	91	46
CC[C@@H](C)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995040	EG	On-Demand	Anodyne	NPY2R	55	36
CC[C@@H](C)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995040	EG	On-Demand	Anodyne	KCNQ4	0	44
CC[C@H](C)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995041	EG	On-Demand	Anodyne	DRD2	24	41
CC[C@H](C)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995041	EG	On-Demand	Anodyne	KCNQ2	91	46
CC[C@H](C)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995041	EG	On-Demand	Anodyne	NPY2R	55	36
CC[C@H](C)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995041	EG	On-Demand	Anodyne	KCNQ4	0	44
CC[C@@H](C)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995043	EG	On-Demand	Anodyne	DRD2	24	41
CC[C@@H](C)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995043	EG	On-Demand	Anodyne	KCNQ2	91	46
CC[C@@H](C)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995043	EG	On-Demand	Anodyne	NPY2R	55	36
CC[C@@H](C)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995043	EG	On-Demand	Anodyne	KCNQ4	0	44
CC[C@H](C)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995045	EG	On-Demand	Anodyne	DRD2	24	41
CC[C@H](C)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995045	EG	On-Demand	Anodyne	KCNQ2	91	46
CC[C@H](C)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995045	EG	On-Demand	Anodyne	NPY2R	55	36
CC[C@H](C)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995045	EG	On-Demand	Anodyne	KCNQ4	0	44
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	HTR1A	46	49
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	DRD2	44	47
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	DRD1	23	43
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	ADRA1D	26	45
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	ADRA1A	30	43
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	ADRA1B	30	50
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	DRD3	41	37
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	NOX4	44	34
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	NOX1	64	34
Cc1cc(C)n(CCN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995048	EG	On-Demand	Anodyne	NOX5	62	34
CC(C)CN(C(=O)[C@@H](O)C1CCC1)[C@H]1CCCc2cccnc21	ZINC000450995053	DG	On-Demand	Anodyne	CXCR4	79	43
COc1ccc(Oc2ccc(C(=O)NCC3(N(C)C)CCC3)nc2)cc1	ZINC000450995054	FG	On-Demand	Anodyne	SLC6A5	16	46
COc1ccc(OC)c([C@@H]2CCCN2S(=O)(=O)C[C@@H]2CCCC2(F)F)c1	ZINC000450995055	GH	On-Demand	Anodyne	FKBP1A	41	35
COc1ccc(OC)c([C@@H]2CCCN2S(=O)(=O)C[C@H]2CCCC2(F)F)c1	ZINC000450995056	GH	On-Demand	Anodyne	FKBP1A	41	35
COc1ccc(OC)c([C@H]2CCCN2S(=O)(=O)C[C@H]2CCCC2(F)F)c1	ZINC000450995057	GH	On-Demand	Anodyne	FKBP1A	41	35
COc1ccc(OC)c([C@H]2CCCN2S(=O)(=O)C[C@@H]2CCCC2(F)F)c1	ZINC000450995058	GH	On-Demand	Anodyne	FKBP1A	41	35
CCCN(C(=O)c1cccc(C#N)c1Br)[C@H]1CCCc2cccnc21	ZINC000450995059	GJ	On-Demand	Mild	CXCR4	74	39
CCCN(C(=O)c1cccc(C#N)c1Br)[C@@H]1CCCc2cccnc21	ZINC000450995060	GJ	On-Demand	Mild	CXCR4	74	39
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CC(=O)NCCc1ccc(F)cc1	ZINC000450995062	GF	On-Demand	Anodyne	SLC6A1	26	42
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CC(=O)NCCc1ccc(F)cc1	ZINC000450995062	GF	On-Demand	Anodyne	SLC6A3	26	42
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CC(=O)NCCc1ccc(F)cc1	ZINC000450995067	GF	On-Demand	Anodyne	SLC6A1	26	42
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CC(=O)NCCc1ccc(F)cc1	ZINC000450995067	GF	On-Demand	Anodyne	SLC6A3	26	42
CCCN1CCC(NS(=O)(=O)c2cc(OC)cc(C(F)(F)F)c2)CC1	ZINC000450995071	GF	On-Demand	Anodyne	SFRP1	103	40
CCCN1CCC(NS(=O)(=O)c2cc(OC)cc(C(F)(F)F)c2)CC1	ZINC000450995071	GF	On-Demand	Anodyne	WNT3	67	33
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CCCCCO	ZINC000450995073	CE	On-Demand	Anodyne	SLC6A1	0	42
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCCO	ZINC000450995075	CE	On-Demand	Anodyne	SLC6A1	0	42
C=Cc1ccc(S(=O)(=O)N(C)CC(=O)NC(C)(C)C)cc1	ZINC000450995079	DD	On-Demand	Anodyne	MMP8	15	41
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc2c1CCCC2	ZINC000450995080	GG	On-Demand	Anodyne	CA2	15	46
Cc1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc2c1CCCC2	ZINC000450995080	GG	On-Demand	Anodyne	PFK	0	40
CCOc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450995095	GG	On-Demand	Anodyne	SLC6A1	28	43
CCOc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450995096	GG	On-Demand	Anodyne	SLC6A1	28	43
CCOc1ccc(OC[C@@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450995098	GG	On-Demand	Anodyne	SLC6A1	28	43
CCOc1ccc(OC[C@H](O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450995099	GG	On-Demand	Anodyne	SLC6A1	28	43
O=S(=O)(CCC1CCCCC1)NCc1ccccc1CN1CCOCC1	ZINC000450995101	GF	On-Demand	Anodyne	PGA5	44	32
Cc1nc(C)n(CCCC(=O)N(CC(C)C)[C@H]2CCCc3cccnc32)n1	ZINC000450995132	FH	On-Demand	Anodyne	CXCR4	71	40
Cc1nc(C)n(CCCC(=O)N(CC(C)C)[C@@H]2CCCc3cccnc32)n1	ZINC000450995133	FH	On-Demand	Anodyne	CXCR4	71	40
CC(C)CN(C(=O)c1cc2ccncc2s1)[C@H]1CCCc2cccnc21	ZINC000450995166	FJ	On-Demand	Anodyne	CXCR4	72	41
CC(C)CN(C(=O)c1cc2ccncc2s1)[C@@H]1CCCc2cccnc21	ZINC000450995170	FJ	On-Demand	Anodyne	CXCR4	72	41
CCCN(C(=O)CCOc1cccc(OC)c1)[C@H]1CCCc2cccnc21	ZINC000450995184	FI	On-Demand	Anodyne	CXCR4	76	40
CCCN(C(=O)CCOc1cccc(OC)c1)[C@@H]1CCCc2cccnc21	ZINC000450995187	FI	On-Demand	Anodyne	CXCR4	76	40
Cc1noc([C@@H]2CCCN2CCCC(=O)c2ccc(Br)cc2)n1	ZINC000450995208	GH	On-Demand	Anodyne	CYP2J2	49	36
Cc1noc([C@H]2CCCN2CCCC(=O)c2ccc(Br)cc2)n1	ZINC000450995210	GH	On-Demand	Anodyne	CYP2J2	49	36
CN(C)C1(CNC(=O)c2ccnc(OC(F)F)c2)CCC1	ZINC000450995218	CD	On-Demand	Anodyne	SLC6A5	16	45
CCCN1CCC(NS(=O)(=O)c2sc3ccccc3c2Cl)CC1	ZINC000450995235	FH	On-Demand	Anodyne	HTR6	22	40
C[C@@H]1C[C@@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995244	DH	On-Demand	Anodyne	HTR1A	15	41
C[C@@H]1C[C@@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995244	DH	On-Demand	Anodyne	DRD2	15	46
C[C@@H]1C[C@@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995244	DH	On-Demand	Anodyne	ADRA1D	15	40
C[C@@H]1C[C@@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995244	DH	On-Demand	Anodyne	DRD3	15	40
C[C@H]1C[C@@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995245	DH	On-Demand	Anodyne	HTR1A	15	41
C[C@H]1C[C@@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995245	DH	On-Demand	Anodyne	DRD2	15	46
C[C@H]1C[C@@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995245	DH	On-Demand	Anodyne	ADRA1D	15	40
C[C@H]1C[C@@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995245	DH	On-Demand	Anodyne	DRD3	15	40
C[C@@H]1C[C@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995246	DH	On-Demand	Anodyne	HTR1A	15	41
C[C@@H]1C[C@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995246	DH	On-Demand	Anodyne	DRD2	15	46
C[C@@H]1C[C@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995246	DH	On-Demand	Anodyne	ADRA1D	15	40
C[C@@H]1C[C@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995246	DH	On-Demand	Anodyne	DRD3	15	40
C[C@H]1C[C@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995247	DH	On-Demand	Anodyne	HTR1A	15	41
C[C@H]1C[C@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995247	DH	On-Demand	Anodyne	DRD2	15	46
C[C@H]1C[C@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995247	DH	On-Demand	Anodyne	ADRA1D	15	40
C[C@H]1C[C@H](CN2CCCN(c3ccccc3Cl)CC2)CCO1	ZINC000450995247	DH	On-Demand	Anodyne	DRD3	15	40
CC(C)C(C)(C)CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450995256	CG	On-Demand	Anodyne	MMP13	0	42
C[C@@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995258	FF	On-Demand	Anodyne	HRH2	33	50
C[C@@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995258	FF	On-Demand	Anodyne	F2R	40	30
C[C@@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995258	FF	On-Demand	Anodyne	CCKBR	40	37
C[C@@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995258	FF	On-Demand	Anodyne	F7	28	40
C[C@@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995258	FF	On-Demand	Anodyne	CACNA1I	28	46
C[C@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995259	FF	On-Demand	Anodyne	HRH2	33	50
C[C@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995259	FF	On-Demand	Anodyne	F2R	40	30
C[C@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995259	FF	On-Demand	Anodyne	CCKBR	40	37
C[C@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995259	FF	On-Demand	Anodyne	F7	28	40
C[C@H](CN1CCCCCC1)NC(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450995259	FF	On-Demand	Anodyne	CACNA1I	28	46
C[C@@H](CN1CCCCCC1)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450995265	FH	On-Demand	Anodyne	OPRK1	0	40
C[C@@H](CN1CCCCCC1)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450995265	FH	On-Demand	Anodyne	P2RX3	28	42
C[C@H](CN1CCCCCC1)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450995266	FH	On-Demand	Anodyne	OPRK1	0	40
C[C@H](CN1CCCCCC1)NC(=O)Cc1scnc1-c1ccccc1	ZINC000450995266	FH	On-Demand	Anodyne	P2RX3	28	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)N=c1cc[nH]cc1	ZINC000450995276	EE	On-Demand	Anodyne	HTR1A	36	44
O=C(CN1CCCN(c2ccccc2Cl)CC1)N=c1cc[nH]cc1	ZINC000450995276	EE	On-Demand	Anodyne	DRD2	41	45
O=C(CN1CCCN(c2ccccc2Cl)CC1)N=c1cc[nH]cc1	ZINC000450995276	EE	On-Demand	Anodyne	DRD4	30	45
O=C(CN1CCCN(c2ccccc2Cl)CC1)N=c1cc[nH]cc1	ZINC000450995276	EE	On-Demand	Anodyne	KCNQ2	50	39
O=C(CN1CCCN(c2ccccc2Cl)CC1)N=c1cc[nH]cc1	ZINC000450995276	EE	On-Demand	Anodyne	NOX1	47	31
O=C(CN1CCCN(c2ccccc2Cl)CC1)N=c1cc[nH]cc1	ZINC000450995276	EE	On-Demand	Anodyne	NOX5	43	31
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)c1	ZINC000450995277	GH	On-Demand	Anodyne	DRD2	17	43
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)c1	ZINC000450995277	GH	On-Demand	Anodyne	DRD4	48	43
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)c1	ZINC000450995277	GH	On-Demand	Anodyne	DRD3	0	41
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)c1	ZINC000450995277	GH	On-Demand	Anodyne	SIGMAR1	30	45
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)c1	ZINC000450995277	GH	On-Demand	Anodyne	SSTR5	48	40
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)c1	ZINC000450995277	GH	On-Demand	Anodyne	CCR3	18	47
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)c1	ZINC000450995277	GH	On-Demand	Anodyne	CXCR3	29	46
Cc1csc(S(=O)(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)c1	ZINC000450995277	GH	On-Demand	Anodyne	MCHR1	35	43
C[C@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995282	EG	On-Demand	Anodyne	HTR1A	26	45
C[C@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995282	EG	On-Demand	Anodyne	DRD2	34	45
C[C@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995282	EG	On-Demand	Anodyne	DRD1	0	40
C[C@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995282	EG	On-Demand	Anodyne	DRD4	31	41
C[C@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995282	EG	On-Demand	Anodyne	DRD3	40	41
C[C@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995282	EG	On-Demand	Anodyne	KCNQ2	58	37
C[C@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995282	EG	On-Demand	Anodyne	NOX1	53	34
C[C@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995282	EG	On-Demand	Anodyne	NOX5	50	34
C[C@@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995283	EG	On-Demand	Anodyne	HTR1A	26	45
C[C@@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995283	EG	On-Demand	Anodyne	DRD2	34	45
C[C@@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995283	EG	On-Demand	Anodyne	DRD1	0	40
C[C@@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995283	EG	On-Demand	Anodyne	DRD4	31	41
C[C@@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995283	EG	On-Demand	Anodyne	DRD3	40	41
C[C@@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995283	EG	On-Demand	Anodyne	KCNQ2	58	37
C[C@@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995283	EG	On-Demand	Anodyne	NOX1	53	34
C[C@@](O)(CN1CCCN(c2ccccc2Cl)CC1)C(F)(F)F	ZINC000450995283	EG	On-Demand	Anodyne	NOX5	50	34
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	HTR1A	47	43
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	DRD2	48	45
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	DRD4	30	44
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	ADRA1D	31	42
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	ADRA1A	30	42
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	ADRA1B	25	48
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	DRD3	57	43
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	KCNQ2	74	41
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	NPY2R	25	40
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	NOX1	47	35
CC(=O)[C@@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995284	DE	On-Demand	Anodyne	NOX5	49	35
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	HTR1A	47	43
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	DRD2	48	45
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	DRD4	30	44
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	ADRA1D	31	42
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	ADRA1A	30	42
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	ADRA1B	25	48
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	DRD3	57	43
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	KCNQ2	74	41
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	NPY2R	25	40
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	NOX1	47	35
CC(=O)[C@](C)(O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995285	DE	On-Demand	Anodyne	NOX5	49	35
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	HTR1A	89	58
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	DRD2	67	50
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	DRD1	23	45
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	DRD4	35	43
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	ADRA1D	47	58
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	HTR2A	34	50
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	HTR2C	18	42
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	ADRA1A	36	58
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	ADRA1B	33	58
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	DRD3	70	43
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	HTR7	61	41
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	NOX4	43	33
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	NOX1	62	33
O=S1(=O)CCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995286	FD	On-Demand	Anodyne	NOX5	60	33
CCOc1ccc([C@H](C)NC(=O)Cn2cnc3c2C[C@H](C)[C@@H](C)C3)cc1OC	ZINC000450995289	GH	On-Demand	Anodyne	ENPP1	46	31
CCOc1ccc([C@H](C)NC(=O)Cn2cnc3c2C[C@@H](C)[C@H](C)C3)cc1OC	ZINC000450995290	GH	On-Demand	Anodyne	ENPP1	46	31
CCOc1ccc([C@H](C)NC(=O)Cn2cnc3c2C[C@H](C)[C@H](C)C3)cc1OC	ZINC000450995291	GH	On-Demand	Anodyne	ENPP1	46	31
CCOc1ccc([C@H](C)NC(=O)Cn2cnc3c2C[C@@H](C)[C@@H](C)C3)cc1OC	ZINC000450995292	GH	On-Demand	Anodyne	ENPP1	46	31
Cc1cccc(Cl)c1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450995293	DH	On-Demand	Anodyne	OPRK1	22	40
Cc1cccc(Cl)c1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000450995293	DH	On-Demand	Anodyne	PLD1	49	39
Cc1cccc(Cl)c1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450995294	DH	On-Demand	Anodyne	OPRK1	22	40
Cc1cccc(Cl)c1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000450995294	DH	On-Demand	Anodyne	PLD1	47	37
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	HTR1A	62	42
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	DRD2	68	51
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	DRD4	51	51
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	ADRA1D	43	40
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	HTR2A	37	40
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	HTR2C	35	40
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	SLC6A4	17	40
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	ADRA1B	19	42
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	DRD3	94	43
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	HTR7	47	39
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	KCNQ2	74	41
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	NOX1	22	40
CC(C)(C)OC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995297	GE	On-Demand	Anodyne	NOX5	25	40
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	HTR1A	55	47
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	DRD2	52	52
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	DRD1	23	44
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	DRD4	43	51
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	ADRA1D	22	45
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	HTR2C	24	41
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	ADRA1A	26	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	ADRA1B	23	49
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	DRD3	59	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	HTR7	39	40
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	KCNQ2	76	44
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	NOX4	42	33
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	NOX1	57	35
O=C(CN1CCCN(c2ccccc2Cl)CC1)N1CCCC1	ZINC000450995298	DE	On-Demand	Anodyne	NOX5	55	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)c2ncccc2F)cc1	ZINC000450995299	FF	On-Demand	Anodyne	GRM4	17	41
C[C@H]1Cc2ncn(CC(=O)Nc3ccccc3-c3ccccc3)c2C[C@H]1C	ZINC000450995304	FJ	On-Demand	Anodyne	ACAT	0	41
C[C@@H]1Cc2ncn(CC(=O)Nc3ccccc3-c3ccccc3)c2C[C@H]1C	ZINC000450995305	FJ	On-Demand	Anodyne	ACAT	0	41
C[C@H]1Cc2ncn(CC(=O)Nc3ccccc3-c3ccccc3)c2C[C@@H]1C	ZINC000450995306	FJ	On-Demand	Anodyne	ACAT	0	41
C[C@H]1Cc2c(ncn2CC(=O)Nc2ccccc2-c2ccccc2)C[C@H]1C	ZINC000450995307	FJ	On-Demand	Anodyne	ACAT	0	41
O=S(=O)(Nc1cccc(C(F)F)c1)c1ccc(C2CC2)cc1	ZINC000450995313	DI	On-Demand	Anodyne	POL	0	44
O=S(=O)(Nc1cccc(C(F)F)c1)c1ccc(C2CC2)cc1	ZINC000450995313	DI	On-Demand	Anodyne	UQCRB	0	42
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995319	DH	On-Demand	Anodyne	KCNK3	45	39
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995320	DH	On-Demand	Anodyne	KCNK3	45	39
Cc1cccc(NC(=O)[C@@H](C)N2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995321	DH	On-Demand	Anodyne	KCNK3	45	39
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995322	DH	On-Demand	Anodyne	KCNK3	45	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@](C)(C2CC2)C(F)(F)F)cc1	ZINC000450995326	GG	On-Demand	Anodyne	AADAC	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@](C)(C2CC2)C(F)(F)F)cc1	ZINC000450995327	GG	On-Demand	Anodyne	AADAC	0	41
O=[N+]([O-])c1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450995346	EF	On-Demand	Bother	HTR1A	37	45
O=[N+]([O-])c1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450995346	EF	On-Demand	Bother	DRD1	23	42
O=[N+]([O-])c1cnn(CCN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450995346	EF	On-Demand	Bother	DRD3	47	39
COC(=O)[C@@H]1CCN(S(=O)(=O)c2ccc(C3CC3)cc2)c2ccccc21	ZINC000450995347	FG	On-Demand	Anodyne	F13A1	42	32
COC(=O)[C@H]1CCN(S(=O)(=O)c2ccc(C3CC3)cc2)c2ccccc21	ZINC000450995348	FG	On-Demand	Anodyne	F13A1	42	32
COC(=O)c1ncccc1S(=O)(=O)NCc1ccccc1CN(C)C	ZINC000450995352	FD	On-Demand	Anodyne	GLMU	0	40
Cc1ccc(C#N)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450995357	GE	On-Demand	Mild	PRTN3	53	33
Cc1ccc(C#N)cc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450995357	GE	On-Demand	Mild	LUXN	0	43
CCOC(=O)c1ccc(CS(=O)(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450995358	GG	On-Demand	Anodyne	TMPRSS11D	103	36
CCOC(=O)c1ccc(CS(=O)(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450995359	GG	On-Demand	Anodyne	TMPRSS11D	103	36
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	DRD2	85	51
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	DRD1	39	40
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	DRD4	60	41
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	ADRA1D	45	45
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	HTR2A	52	44
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	HTR2C	33	44
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	SLC6A1	101	38
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	ADRA1A	48	45
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	ADRA1B	37	46
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	DRD3	92	44
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	HTR7	77	47
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	KCNQ2	57	37
C[C@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995377	EG	On-Demand	Anodyne	PRCP	45	47
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	DRD2	85	51
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	DRD1	39	40
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	DRD4	60	41
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	ADRA1D	45	45
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	HTR2A	52	44
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	HTR2C	33	44
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	SLC6A1	101	38
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	ADRA1A	48	45
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	ADRA1B	37	46
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	DRD3	92	44
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	HTR7	77	47
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	KCNQ2	57	37
C[C@@H]1CCCN1C(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450995378	EG	On-Demand	Anodyne	PRCP	45	47
O=S(=O)(Cc1c(F)cccc1Cl)NCCN1CCCC1	ZINC000450995379	DD	On-Demand	Anodyne	HNMT	43	32
CC(=O)N1CCC(NS(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450995380	EE	On-Demand	Anodyne	F10	22	43
CC(=O)N1CCC(NS(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450995380	EE	On-Demand	Anodyne	TRY2_BOVIN	57	38
CC(=O)N1CCC(NS(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450995380	EE	On-Demand	Anodyne	CCR8	45	35
CC(=O)N1CCC(NS(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450995380	EE	On-Demand	Anodyne	SFRP1	110	38
CC(=O)N1CCC(NS(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450995380	EE	On-Demand	Anodyne	WNT3	85	40
Cc1ccc2cc(S(=O)(=O)NCC(=O)NC(C)(C)C)ccc2c1	ZINC000450995396	EE	On-Demand	Anodyne	IAP	0	46
CN(C)C(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450995399	GG	On-Demand	Anodyne	HTR1A	27	40
CN(C)C(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450995399	GG	On-Demand	Anodyne	DRD2	35	41
CN(C)C(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450995399	GG	On-Demand	Anodyne	DRD1	0	40
CN(C)C(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450995399	GG	On-Demand	Anodyne	DRD4	34	42
CN(C)C(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450995399	GG	On-Demand	Anodyne	ADRA1D	20	47
CN(C)C(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450995399	GG	On-Demand	Anodyne	HTR2A	20	40
CN(C)C(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450995399	GG	On-Demand	Anodyne	ADRA1A	15	47
CN(C)C(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450995399	GG	On-Demand	Anodyne	DRD3	42	42
COc1cc(CC(=O)NC[C@@]2(O)CCCC(C)(C)C2)ccc1Cl	ZINC000450995405	EG	On-Demand	Anodyne	NCE103	25	44
COc1cc(CC(=O)NC[C@@]2(O)CCCC(C)(C)C2)ccc1Cl	ZINC000450995405	EG	On-Demand	Anodyne	CAN2	0	44
COc1cc(CC(=O)NC[C@]2(O)CCCC(C)(C)C2)ccc1Cl	ZINC000450995406	EG	On-Demand	Anodyne	NCE103	25	44
COc1cc(CC(=O)NC[C@]2(O)CCCC(C)(C)C2)ccc1Cl	ZINC000450995406	EG	On-Demand	Anodyne	CAN2	0	44
CC1(S(=O)(=O)NCCNc2ccccc2[N+](=O)[O-])CC1	ZINC000450995411	CD	On-Demand	Bother	COLA	46	32
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	HTR1A	29	44
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	DRD2	35	45
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	DRD1	24	45
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	DRD4	45	45
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	ADRA1D	17	44
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	HTR2A	17	42
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	ADRA1A	17	44
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	DRD3	36	53
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	NOX1	49	33
Cc1ncc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450995420	DH	On-Demand	Anodyne	NOX5	45	33
O=S(=O)(NCCN1CCCC1)c1sccc1Cl	ZINC000450995425	CD	On-Demand	Anodyne	CCR1	17	41
Cc1c(NC(=O)[C@H](C)SC2CCC2)cccc1[N+](=O)[O-]	ZINC000450995435	CH	On-Demand	Bother	COLA	64	43
Cc1c(NC(=O)[C@@H](C)SC2CCC2)cccc1[N+](=O)[O-]	ZINC000450995436	CH	On-Demand	Bother	COLA	64	43
COc1ccc(NC(=O)[C@@H](C)SC2CCC2)c([N+](=O)[O-])c1	ZINC000450995441	DG	On-Demand	Bother	TAAR1	18	45
COc1ccc(NC(=O)[C@H](C)SC2CCC2)c([N+](=O)[O-])c1	ZINC000450995442	DG	On-Demand	Bother	TAAR1	18	45
COc1ccc(CNC(=O)CCN(C)C2(CO)CC2)c(OC)c1	ZINC000450995444	DD	On-Demand	Anodyne	MTNR1A	54	36
CCOC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)nc1	ZINC000450995445	FG	On-Demand	Anodyne	HTR1A	38	40
CCOC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)nc1	ZINC000450995445	FG	On-Demand	Anodyne	DRD2	40	41
CCOC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)nc1	ZINC000450995445	FG	On-Demand	Anodyne	DRD1	26	40
CCOC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)nc1	ZINC000450995445	FG	On-Demand	Anodyne	ADRA1D	31	40
CCOC(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)nc1	ZINC000450995445	FG	On-Demand	Anodyne	DRD3	31	41
CCC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450995484	CE	On-Demand	Anodyne	DRD3	23	41
CCC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450995484	CE	On-Demand	Anodyne	ABCB1	58	40
CCC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450995484	CE	On-Demand	Anodyne	HSP90AB1	38	42
CCC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450995486	CE	On-Demand	Anodyne	DRD3	23	41
CCC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450995486	CE	On-Demand	Anodyne	ABCB1	58	40
CCC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450995486	CE	On-Demand	Anodyne	HSP90AB1	38	42
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	BMP1	69	39
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	MMP13	62	42
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	ADAM17	28	42
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	MMP16	0	41
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	MMP2	33	41
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	MMP3	35	44
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	MMP8	37	41
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	MMP9	57	42
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	MMP12	32	41
COC(=O)c1ncccc1S(=O)(=O)N(C)CCOc1ccc(OC)cc1	ZINC000450995488	GD	On-Demand	Anodyne	MMP1	49	42
CCOC[C@@H](C)CS(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450995492	GD	On-Demand	Anodyne	CA2	17	40
CCOC[C@@H](C)CS(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450995493	GD	On-Demand	Anodyne	CA2	17	40
CCOC[C@H](C)CS(=O)(=O)N(C)[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450995494	GD	On-Demand	Anodyne	CA2	17	40
CCOC[C@H](C)CS(=O)(=O)N(C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000450995495	GD	On-Demand	Anodyne	CA2	17	40
C[C@H](SC1CCC1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000450995496	EJ	On-Demand	Anodyne	MME	39	40
C[C@H](SC1CCC1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000450995496	EJ	On-Demand	Anodyne	KCNQ2	56	36
C[C@H](SC1CCC1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000450995496	EJ	On-Demand	Anodyne	TIMP3	65	34
C[C@@H](SC1CCC1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000450995497	EJ	On-Demand	Anodyne	MME	39	40
C[C@@H](SC1CCC1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000450995497	EJ	On-Demand	Anodyne	KCNQ2	56	36
C[C@@H](SC1CCC1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000450995497	EJ	On-Demand	Anodyne	TIMP3	65	34
C[C@@H](SC1CCC1)c1nnc(-c2cccc(Cl)c2)o1	ZINC000450995498	CJ	On-Demand	Anodyne	CYP73A16	15	46
C[C@H](SC1CCC1)c1nnc(-c2cccc(Cl)c2)o1	ZINC000450995500	CJ	On-Demand	Anodyne	CYP73A16	15	46
Fc1ccccc1N1CCCN(Cc2cnns2)CC1	ZINC000450995512	CE	On-Demand	Anodyne	DRD4	18	47
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)Nc2ncccn2)cc1	ZINC000450995546	FD	On-Demand	Anodyne	MTNN	83	40
COc1cccc(OCCC(=O)NCc2nc(N(C)C)no2)c1	ZINC000450995548	DD	On-Demand	Anodyne	MTNR1A	74	42
COc1cccc(OCCC(=O)NCc2nc(N(C)C)no2)c1	ZINC000450995548	DD	On-Demand	Anodyne	MTNR1B	53	42
COc1ccc2c(c1)CCCN2C(=O)CSC1CCC1	ZINC000450995555	CG	On-Demand	Anodyne	DRD4	41	31
CC[C@@H]1c2ccsc2CCN1C(=O)CSC1CCC1	ZINC000450995556	CH	On-Demand	Anodyne	TRPM8	17	46
CC[C@H]1c2ccsc2CCN1C(=O)CSC1CCC1	ZINC000450995557	CH	On-Demand	Anodyne	TRPM8	17	46
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450995565	GG	On-Demand	Anodyne	RORC	32	48
CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450995565	GG	On-Demand	Anodyne	RORB	0	48
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450995567	GG	On-Demand	Anodyne	RORC	32	48
CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450995567	GG	On-Demand	Anodyne	RORB	0	48
COc1ccc(CN(C2CC2)S(=O)(=O)CCC2CCCC2)cc1	ZINC000450995581	EH	On-Demand	Anodyne	AVPR1B	27	44
CCCN(C(=O)c1cc2c([nH]1)CCCC2)[C@H]1CCCc2cccnc21	ZINC000450995584	EI	On-Demand	Anodyne	CXCR4	81	42
CCCN(C(=O)c1cc2c([nH]1)CCCC2)[C@@H]1CCCc2cccnc21	ZINC000450995585	EI	On-Demand	Anodyne	CXCR4	81	42
C[C@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)C(F)(F)F	ZINC000450995586	EF	On-Demand	Anodyne	F7	28	40
C[C@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)C(F)(F)F	ZINC000450995586	EF	On-Demand	Anodyne	PSBA	0	42
C[C@@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)C(F)(F)F	ZINC000450995587	EF	On-Demand	Anodyne	F7	28	40
C[C@@H](CNC(=O)CNC(=O)Nc1cccc(Cl)c1)C(F)(F)F	ZINC000450995587	EF	On-Demand	Anodyne	PSBA	0	42
COCCCN(CCO)C(=O)[C@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450995590	GD	On-Demand	Mild	NR3C2	26	40
COCCCN(CCO)C(=O)[C@@H]1CC(=O)N(c2ccc(C#N)c(Cl)c2)C1	ZINC000450995592	GD	On-Demand	Mild	NR3C2	26	40
CC(C)CN(C(=O)c1cc2cccnc2s1)[C@H]1CCCc2cccnc21	ZINC000450995594	FJ	On-Demand	Anodyne	CXCR4	77	45
CC(C)CN(C(=O)c1cc2cccnc2s1)[C@@H]1CCCc2cccnc21	ZINC000450995597	FJ	On-Demand	Anodyne	CXCR4	77	45
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	HTR1A	62	40
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	DRD2	68	41
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	DRD4	45	40
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	ADRA1D	41	40
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	HTR2A	42	39
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	ADRA1B	27	43
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	DRD3	78	38
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	HTR7	44	36
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	KCNQ2	55	37
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	NOX1	42	33
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450995656	EF	On-Demand	Anodyne	NOX5	47	33
COC(=O)c1cccc(OCCN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995657	EG	On-Demand	Anodyne	DRD4	43	32
COC(=O)c1cccc(OCCN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995657	EG	On-Demand	Anodyne	HRH2	59	40
COC(=O)c1cccc(OCCN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995657	EG	On-Demand	Anodyne	SLC6A1	98	41
COC(=O)c1cccc(OCCN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995657	EG	On-Demand	Anodyne	LTA4H	35	40
COC(=O)c1cccc(OCCN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995657	EG	On-Demand	Anodyne	HRH3	36	40
COC(=O)c1cccc(OCCN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995657	EG	On-Demand	Anodyne	PSMB2	41	35
COC(=O)c1cccc(OCCN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450995657	EG	On-Demand	Anodyne	PSMB1	40	37
COC(=O)c1cccc(OCCN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995658	EG	On-Demand	Anodyne	DRD4	43	32
COC(=O)c1cccc(OCCN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995658	EG	On-Demand	Anodyne	HRH2	59	40
COC(=O)c1cccc(OCCN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995658	EG	On-Demand	Anodyne	SLC6A1	98	41
COC(=O)c1cccc(OCCN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995658	EG	On-Demand	Anodyne	LTA4H	35	40
COC(=O)c1cccc(OCCN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995658	EG	On-Demand	Anodyne	HRH3	36	40
COC(=O)c1cccc(OCCN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995658	EG	On-Demand	Anodyne	PSMB2	41	35
COC(=O)c1cccc(OCCN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450995658	EG	On-Demand	Anodyne	PSMB1	40	37
Cc1ccc(CNC(=O)[C@H](C)N2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450995661	EG	On-Demand	Anodyne	SLC6A11	0	46
Cc1ccc(CNC(=O)[C@H](C)N2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450995661	EG	On-Demand	Anodyne	SLC6A12	0	46
Cc1ccc(CNC(=O)[C@H](C)N2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450995664	EG	On-Demand	Anodyne	SLC6A11	0	46
Cc1ccc(CNC(=O)[C@H](C)N2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450995664	EG	On-Demand	Anodyne	SLC6A12	0	46
Cc1ccc2cc(S(=O)(=O)N[C@H](C)C3CC3)ccc2c1	ZINC000450995665	CG	On-Demand	Anodyne	F2	17	42
Cc1ccc2cc(S(=O)(=O)N[C@H](C)C3CC3)ccc2c1	ZINC000450995665	CG	On-Demand	Anodyne	MMP13	15	41
Cc1ccc2cc(S(=O)(=O)N[C@H](C)C3CC3)ccc2c1	ZINC000450995665	CG	On-Demand	Anodyne	LEF	36	41
Cc1ccc2cc(S(=O)(=O)N[C@@H](C)C3CC3)ccc2c1	ZINC000450995666	CG	On-Demand	Anodyne	F2	17	42
Cc1ccc2cc(S(=O)(=O)N[C@@H](C)C3CC3)ccc2c1	ZINC000450995666	CG	On-Demand	Anodyne	MMP13	15	41
Cc1ccc2cc(S(=O)(=O)N[C@@H](C)C3CC3)ccc2c1	ZINC000450995666	CG	On-Demand	Anodyne	LEF	36	41
COc1cccc(Oc2ccc(C(=O)NCC3(N(C)C)CCC3)nc2)c1	ZINC000450995667	FG	On-Demand	Anodyne	DRD4	40	31
COc1cccc(Oc2ccc(C(=O)NCC3(N(C)C)CCC3)nc2)c1	ZINC000450995667	FG	On-Demand	Anodyne	MTNR1B	35	40
COc1cccc(Oc2ccc(C(=O)NCC3(N(C)C)CCC3)nc2)c1	ZINC000450995667	FG	On-Demand	Anodyne	ROCK2	48	36
COc1cccc(Oc2ccc(C(=O)NCC3(N(C)C)CCC3)nc2)c1	ZINC000450995667	FG	On-Demand	Anodyne	SLC6A5	16	45
COc1ccc(CN(C2CC2)S(=O)(=O)c2sccc2Cl)cc1	ZINC000450995668	FH	On-Demand	Anodyne	AVPR1B	30	45
COc1ccc(CN(C2CC2)S(=O)(=O)c2sccc2Cl)cc1	ZINC000450995668	FH	On-Demand	Anodyne	BMP1	70	39
Cc1ccc(CNC(=O)[C@@H](C)N2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450995672	EG	On-Demand	Anodyne	SLC6A11	0	46
Cc1ccc(CNC(=O)[C@@H](C)N2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450995672	EG	On-Demand	Anodyne	SLC6A12	0	46
Cc1[nH]c(C#N)cc1C(=O)N(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450995674	EH	On-Demand	Mild	CXCR4	72	40
Cc1[nH]c(C#N)cc1C(=O)N(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450995675	EH	On-Demand	Mild	CXCR4	72	40
Cc1ccc(CNC(=O)[C@@H](C)N2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450995676	EG	On-Demand	Anodyne	SLC6A11	0	46
Cc1ccc(CNC(=O)[C@@H](C)N2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450995676	EG	On-Demand	Anodyne	SLC6A12	0	46
CCc1ncc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450995683	GD	On-Demand	Anodyne	ALPL	18	40
CCc1ncc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)cn1	ZINC000450995683	GD	On-Demand	Anodyne	MTNN	79	41
Cc1cccc(Cl)c1C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000450995699	FJ	On-Demand	Anodyne	TYK2	59	37
COCC1=CCN(C(=O)C2=C(c3ccccc3)CCC2)CC1	ZINC000450995718	CG	On-Demand	Anodyne	CHRM5	35	40
CCCN(C(=O)c1cc2cccnc2s1)[C@H]1CCCc2cccnc21	ZINC000450995732	FJ	On-Demand	Anodyne	CXCR4	80	45
CCCN(C(=O)c1cc2cccnc2s1)[C@@H]1CCCc2cccnc21	ZINC000450995733	FJ	On-Demand	Anodyne	CXCR4	80	45
O=C(CN1CCC[C@H](c2ccncc2)C1)NCC1(c2ccccc2)CC1	ZINC000450995736	EG	On-Demand	Anodyne	KCNA3	40	37
O=C(CN1CCC[C@H](c2ccncc2)C1)NCC1(c2ccccc2)CC1	ZINC000450995736	EG	On-Demand	Anodyne	ACAT	0	40
O=C(CN1CCC[C@H](c2ccncc2)C1)NCC1(c2ccccc2)CC1	ZINC000450995736	EG	On-Demand	Anodyne	NPFFR1	49	44
O=C(CN1CCC[C@@H](c2ccncc2)C1)NCC1(c2ccccc2)CC1	ZINC000450995737	EG	On-Demand	Anodyne	KCNA3	40	37
O=C(CN1CCC[C@@H](c2ccncc2)C1)NCC1(c2ccccc2)CC1	ZINC000450995737	EG	On-Demand	Anodyne	ACAT	0	40
O=C(CN1CCC[C@@H](c2ccncc2)C1)NCC1(c2ccccc2)CC1	ZINC000450995737	EG	On-Demand	Anodyne	NPFFR1	49	44
C[C@H]1Cc2c(ncn2CC(=O)N2CCC(OCc3ccccc3)CC2)C[C@H]1C	ZINC000450995739	GG	On-Demand	Anodyne	GRIN2B	34	44
C[C@@H]1Cc2ncn(CC(=O)N3CCC(OCc4ccccc4)CC3)c2C[C@H]1C	ZINC000450995740	GG	On-Demand	Anodyne	GRIN2B	34	44
C[C@H]1Cc2ncn(CC(=O)N3CCC(OCc4ccccc4)CC3)c2C[C@@H]1C	ZINC000450995741	GG	On-Demand	Anodyne	GRIN2B	34	44
C[C@H]1Cc2ncn(CC(=O)N3CCC(OCc4ccccc4)CC3)c2C[C@H]1C	ZINC000450995742	GG	On-Demand	Anodyne	GRIN2B	34	44
Cc1cccc(OC(F)F)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450995759	GH	On-Demand	Anodyne	LEF	44	34
COCC1=CCN(C(=O)C2(Cc3ccccc3)CCOCC2)CC1	ZINC000450995782	EF	On-Demand	Anodyne	SLC12A5	50	35
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cc(Cl)ccc1OC	ZINC000450995787	GE	On-Demand	Anodyne	COLA	70	38
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cc(Cl)ccc1OC	ZINC000450995787	GE	On-Demand	Anodyne	CPT1A	66	38
COC(=O)c1ncccc1S(=O)(=O)N(C)Cc1cc(Cl)ccc1OC	ZINC000450995787	GE	On-Demand	Anodyne	CPT1B	70	35
Fc1ccc(-c2nc(CN3CCC[C@H](c4ccncc4)C3)cs2)cc1	ZINC000450995791	FJ	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Fc1ccc(-c2nc(CN3CCC[C@@H](c4ccncc4)C3)cs2)cc1	ZINC000450995792	FJ	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
CC(C)N(C(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2)C1CCCC1	ZINC000450995800	DG	On-Demand	Anodyne	SCARB1	53	39
CC(C)N(C(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2)C1CCCC1	ZINC000450995801	DG	On-Demand	Anodyne	SCARB1	53	39
CC(C)N(C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2)C1CCCC1	ZINC000450995802	DG	On-Demand	Anodyne	SCARB1	53	39
CC(C)N(C(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2)C1CCCC1	ZINC000450995803	DG	On-Demand	Anodyne	SCARB1	53	39
CO[C@@H](CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995814	EH	On-Demand	Anodyne	SLC6A1	100	41
CO[C@@H](CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995814	EH	On-Demand	Anodyne	SLC6A4	24	41
CO[C@@H](CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995814	EH	On-Demand	Anodyne	SLC6A3	65	41
CO[C@H](CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995815	EH	On-Demand	Anodyne	SLC6A1	100	41
CO[C@H](CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995815	EH	On-Demand	Anodyne	SLC6A4	24	41
CO[C@H](CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995815	EH	On-Demand	Anodyne	SLC6A3	65	41
CO[C@@H](CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995816	EH	On-Demand	Anodyne	SLC6A1	100	41
CO[C@@H](CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995816	EH	On-Demand	Anodyne	SLC6A4	24	41
CO[C@@H](CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995816	EH	On-Demand	Anodyne	SLC6A3	65	41
CO[C@H](CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995817	EH	On-Demand	Anodyne	SLC6A1	100	41
CO[C@H](CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995817	EH	On-Demand	Anodyne	SLC6A4	24	41
CO[C@H](CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000450995817	EH	On-Demand	Anodyne	SLC6A3	65	41
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995845	EG	On-Demand	Anodyne	SLC6A1	70	38
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995845	EG	On-Demand	Anodyne	SLC6A3	50	39
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995845	EG	On-Demand	Anodyne	ACHP_LYMST	16	41
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995845	EG	On-Demand	Anodyne	Q8WSF8_APLCA	39	41
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995846	EG	On-Demand	Anodyne	SLC6A1	70	38
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995846	EG	On-Demand	Anodyne	SLC6A3	50	39
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995846	EG	On-Demand	Anodyne	ACHP_LYMST	16	41
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995846	EG	On-Demand	Anodyne	Q8WSF8_APLCA	39	41
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995847	EG	On-Demand	Anodyne	SLC6A1	70	38
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995847	EG	On-Demand	Anodyne	SLC6A3	50	39
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995847	EG	On-Demand	Anodyne	ACHP_LYMST	16	41
C[C@H](c1ccccc1)[C@H](O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995847	EG	On-Demand	Anodyne	Q8WSF8_APLCA	39	41
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995848	EG	On-Demand	Anodyne	SLC6A1	70	38
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995848	EG	On-Demand	Anodyne	SLC6A3	50	39
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995848	EG	On-Demand	Anodyne	ACHP_LYMST	16	41
C[C@H](c1ccccc1)[C@@H](O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995848	EG	On-Demand	Anodyne	Q8WSF8_APLCA	39	41
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCCN2CCCCC2)c1	ZINC000450995861	FD	On-Demand	Anodyne	HTR7	38	47
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCCN2CCCCC2)c1	ZINC000450995861	FD	On-Demand	Anodyne	HRH3	51	40
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCCN2CCCCC2)c1	ZINC000450995861	FD	On-Demand	Anodyne	SIGMAR1	31	43
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCCN2CCCCC2)c1	ZINC000450995861	FD	On-Demand	Anodyne	HNMT	86	35
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	HTR1A	35	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	DRD2	50	49
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	DRD4	46	46
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	ADRA1D	39	46
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	HTR2A	23	41
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	ADRA1A	33	46
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	ADRA1B	32	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	DRD3	59	49
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	HTR7	22	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	KCNQ2	54	41
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	SIGMAR1	23	44
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC1CCN(C2CC2)CC1	ZINC000450995863	GF	On-Demand	Anodyne	L3MBTL3	50	32
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	HRH2	25	42
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	HTR2A	15	43
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	HTR7	42	43
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	HRH3	67	45
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	HNMT	49	31
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	EPHX2	29	40
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	PSMB2	44	34
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	LUXN	0	43
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	ADIPOR1	0	45
O=C(COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1)NC1CC1	ZINC000450995866	GD	On-Demand	Anodyne	ADIPOR2	0	45
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450995873	GE	On-Demand	Mild	CPT2	41	37
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450995874	GE	On-Demand	Mild	CPT2	41	37
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450995875	GE	On-Demand	Mild	CPT2	41	37
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)COc1ccc(C#N)c(Br)c1	ZINC000450995876	GE	On-Demand	Mild	CPT2	41	37
COC(=O)CCOc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)cc1	ZINC000450995883	GG	On-Demand	Anodyne	LIMK2	38	48
CC1(C)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450995884	EH	On-Demand	Anodyne	MC4R	38	42
CC1(C)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450995884	EH	On-Demand	Anodyne	PRCP	62	42
CC1(C)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450995884	EH	On-Demand	Anodyne	MC3R	46	42
CC1(C)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450995884	EH	On-Demand	Anodyne	MC5R	32	42
CC1(C)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450995885	EH	On-Demand	Anodyne	MC4R	38	42
CC1(C)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450995885	EH	On-Demand	Anodyne	PRCP	62	42
CC1(C)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450995885	EH	On-Demand	Anodyne	MC3R	46	42
CC1(C)CN(C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450995885	EH	On-Demand	Anodyne	MC5R	32	42
CC1(C)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450995886	EH	On-Demand	Anodyne	MC4R	38	42
CC1(C)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450995886	EH	On-Demand	Anodyne	PRCP	62	42
CC1(C)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450995886	EH	On-Demand	Anodyne	MC3R	46	42
CC1(C)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@H]1O	ZINC000450995886	EH	On-Demand	Anodyne	MC5R	32	42
CC1(C)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450995887	EH	On-Demand	Anodyne	MC4R	38	42
CC1(C)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450995887	EH	On-Demand	Anodyne	PRCP	62	42
CC1(C)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450995887	EH	On-Demand	Anodyne	MC3R	46	42
CC1(C)CN(C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)CC[C@@H]1O	ZINC000450995887	EH	On-Demand	Anodyne	MC5R	32	42
CCc1noc(C)c1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995889	EH	On-Demand	Anodyne	HTR1A	19	43
CCc1noc(C)c1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995889	EH	On-Demand	Anodyne	DRD2	26	43
CCc1noc(C)c1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995889	EH	On-Demand	Anodyne	HTR2A	18	43
CCc1noc(C)c1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995889	EH	On-Demand	Anodyne	DRD3	29	44
CCc1noc(C)c1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995889	EH	On-Demand	Anodyne	NOX1	53	32
CCc1noc(C)c1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450995889	EH	On-Demand	Anodyne	NOX5	50	32
COCC[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995890	CG	On-Demand	Anodyne	HTR1A	29	40
COCC[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995890	CG	On-Demand	Anodyne	KCNQ2	45	35
COCC[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995891	CG	On-Demand	Anodyne	HTR1A	29	40
COCC[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450995891	CG	On-Demand	Anodyne	KCNQ2	45	35
O=S(=O)(CCOCc1ccccc1)NCCCN1CCCC1	ZINC000450995904	ED	On-Demand	Anodyne	LTA4H	28	45
O=S(=O)(CCOCc1ccccc1)NCCCN1CCCC1	ZINC000450995904	ED	On-Demand	Anodyne	SIGMAR1	26	43
O=S(=O)(CCOCc1ccccc1)NCCCN1CCCC1	ZINC000450995904	ED	On-Demand	Anodyne	HNMT	69	36
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450995932	GG	On-Demand	Anodyne	HTR1A	28	47
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450995932	GG	On-Demand	Anodyne	DRD2	39	47
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450995932	GG	On-Demand	Anodyne	DRD1	0	46
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450995932	GG	On-Demand	Anodyne	DRD4	47	44
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450995932	GG	On-Demand	Anodyne	ADRA1D	20	42
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450995932	GG	On-Demand	Anodyne	DRD3	28	46
CCS(=O)(=O)c1ccc(CN2CCCN(c3ccccc3F)CC2)cc1	ZINC000450995932	GG	On-Demand	Anodyne	HTR7	22	45
O=C(NC1CCCCC1)c1ccc(NS(=O)(=O)c2sccc2F)cc1	ZINC000450995933	GH	On-Demand	Anodyne	EPHX2	21	40
COc1cc(OC)nc(NS(=O)(=O)Cc2c(C)cccc2C)n1	ZINC000450995941	EE	On-Demand	Anodyne	ALS	81	38
COc1cc(OC)nc(NS(=O)(=O)Cc2c(C)cccc2C)n1	ZINC000450995941	EE	On-Demand	Anodyne	ILV2	0	41
Fc1ccccc1N1CCCN(Cc2cnn[nH]2)CC1	ZINC000450995942	CD	On-Demand	Anodyne	DRD4	22	48
Cc1cccc(NC(=O)[C@@H](C)SC2CCC2)c1C	ZINC000450995943	CH	On-Demand	Anodyne	NISCH	15	40
Cc1cccc(NC(=O)[C@H](C)SC2CCC2)c1C	ZINC000450995944	CH	On-Demand	Anodyne	NISCH	15	40
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	HTR1A	66	70
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	DRD2	70	70
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	DRD1	27	44
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	DRD4	79	45
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	ADRA1D	30	43
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	HTR2A	30	40
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	HTR2C	20	42
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	ADRA1A	25	50
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	ADRA1B	24	50
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	DRD3	66	50
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	CHRM3	16	42
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	HTR7	32	42
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	KCNQ2	65	39
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	FABP4	51	38
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	NPY2R	58	44
CC(=O)c1cccc(CN2CCCN(c3ccccc3F)CC2)c1	ZINC000450995954	EH	On-Demand	Anodyne	ABCB1	26	42
C[C@H](CN1CCCN(c2ccccc2F)CC1)S(C)(=O)=O	ZINC000450995956	DD	On-Demand	Anodyne	ADRA1B	16	42
C[C@H](CN1CCCN(c2ccccc2F)CC1)S(C)(=O)=O	ZINC000450995956	DD	On-Demand	Anodyne	DRD3	19	42
C[C@H](CN1CCCN(c2ccccc2F)CC1)S(C)(=O)=O	ZINC000450995956	DD	On-Demand	Anodyne	HTR7	15	43
C[C@@H](CN1CCCN(c2ccccc2F)CC1)S(C)(=O)=O	ZINC000450995957	DD	On-Demand	Anodyne	ADRA1B	16	42
C[C@@H](CN1CCCN(c2ccccc2F)CC1)S(C)(=O)=O	ZINC000450995957	DD	On-Demand	Anodyne	DRD3	19	42
C[C@@H](CN1CCCN(c2ccccc2F)CC1)S(C)(=O)=O	ZINC000450995957	DD	On-Demand	Anodyne	HTR7	15	43
CCN1CCN(Cc2ccc(NS(=O)(=O)c3cc(C)cs3)cc2)CC1	ZINC000450995966	GF	On-Demand	Anodyne	NR1I2	40	35
CC(C)(C)NC(=O)c1ccccc1NS(=O)(=O)c1sccc1F	ZINC000450995968	FG	On-Demand	Anodyne	PRTN3	60	38
COc1ccc(C(NC(=O)CSC2CCC2)c2ccc(OC)cc2)cc1	ZINC000450995971	FI	On-Demand	Anodyne	MMP13	27	40
COc1ccc(C(NC(=O)CSC2CCC2)c2ccc(OC)cc2)cc1	ZINC000450995971	FI	On-Demand	Anodyne	MMP3	27	40
COc1ccc(C(NC(=O)CSC2CCC2)c2ccc(OC)cc2)cc1	ZINC000450995971	FI	On-Demand	Anodyne	MMP1	27	40
COc1ccc(C(NC(=O)CSC2CCC2)c2ccc(OC)cc2)cc1	ZINC000450995971	FI	On-Demand	Anodyne	QRFPR	41	34
Cc1ccc(CNC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450995982	CG	On-Demand	Anodyne	SLC6A11	0	43
Cc1ccc(CNC(=O)[C@@H](C)SC2CCC2)cc1	ZINC000450995982	CG	On-Demand	Anodyne	SLC6A12	0	43
COC(=O)c1sccc1CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450995983	FG	On-Demand	Anodyne	SLC6A1	41	35
Cc1ccc(CNC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450995984	CG	On-Demand	Anodyne	SLC6A11	0	43
Cc1ccc(CNC(=O)[C@H](C)SC2CCC2)cc1	ZINC000450995984	CG	On-Demand	Anodyne	SLC6A12	0	43
COC(=O)c1sccc1CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450995987	FG	On-Demand	Anodyne	SLC6A1	41	35
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	HTR1A	15	56
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	DRD2	35	51
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	DRD1	20	46
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	DRD4	26	44
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	HRH2	0	44
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	ADRA1D	23	41
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	HTR2A	34	48
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	HTR2C	20	56
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	HRH1	20	46
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	ADRA1B	18	42
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	DRD3	15	46
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	ERG2	20	44
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	CCR3	35	43
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	SLC18A3	0	41
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	MCHR1	17	43
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	CYP2J2	53	37
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	MEN1	43	41
N#Cc1ccc(OC2CCN(CCCC(=O)c3ccc(F)cc3)CC2)c(F)c1	ZINC000450996022	GI	On-Demand	Mild	AP2S1	0	44
CCCN(C(=O)[C@@H]1C[C@H]1CC)[C@H]1CCCc2cccnc21	ZINC000450996031	CH	On-Demand	Anodyne	CXCR4	81	42
CCCN(C(=O)[C@@H]1C[C@H]1CC)[C@@H]1CCCc2cccnc21	ZINC000450996033	CH	On-Demand	Anodyne	CXCR4	81	42
CC[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996050	CG	On-Demand	Anodyne	ACE	41	34
CC[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996050	CG	On-Demand	Anodyne	MME	44	36
CC[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996050	CG	On-Demand	Anodyne	ANPEP	28	42
CC[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996050	CG	On-Demand	Anodyne	TIMP3	42	40
CC[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996050	CG	On-Demand	Anodyne	PROC	47	34
CC[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996050	CG	On-Demand	Anodyne	AMP1_PLAFQ	55	42
CC[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996050	CG	On-Demand	Anodyne	XIAP	26	40
CC[C@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996050	CG	On-Demand	Anodyne	PDS	48	39
CC[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996052	CG	On-Demand	Anodyne	ACE	41	34
CC[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996052	CG	On-Demand	Anodyne	MME	44	36
CC[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996052	CG	On-Demand	Anodyne	ANPEP	28	42
CC[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996052	CG	On-Demand	Anodyne	TIMP3	42	40
CC[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996052	CG	On-Demand	Anodyne	PROC	47	34
CC[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996052	CG	On-Demand	Anodyne	AMP1_PLAFQ	55	42
CC[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996052	CG	On-Demand	Anodyne	XIAP	26	40
CC[C@@H](SC1CCC1)C(=O)NCc1ccccc1	ZINC000450996052	CG	On-Demand	Anodyne	PDS	48	39
COCCCN1Cc2cccc(NS(=O)(=O)c3ccc(C4CC4)cc3)c2C1	ZINC000450996072	GH	On-Demand	Anodyne	HRH3	15	40
COCCCN1Cc2cccc(NS(=O)(=O)c3ccc(C4CC4)cc3)c2C1	ZINC000450996072	GH	On-Demand	Anodyne	PRTN3	50	31
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA2	27	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA1	33	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	KCNA5	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA7	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA5B	32	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA4	25	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA5A	36	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA14	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	MMP2	34	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	MMP3	16	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	MMP9	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA12	20	49
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	CA9	22	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	MCL1	0	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1	ZINC000450996076	GG	On-Demand	Anodyne	IDO1	28	40
CCCN(C(=O)[C@@H]1CCN(c2ccccc2)C1)[C@H]1CCCc2cccnc21	ZINC000450996080	FI	On-Demand	Anodyne	CXCR4	79	40
CCCN(C(=O)[C@H]1CCN(c2ccccc2)C1)[C@H]1CCCc2cccnc21	ZINC000450996083	FI	On-Demand	Anodyne	CXCR4	79	40
CCCN(C(=O)[C@H]1CCN(c2ccccc2)C1)[C@@H]1CCCc2cccnc21	ZINC000450996087	FI	On-Demand	Anodyne	CXCR4	79	40
CCCN(C(=O)[C@@H]1CCN(c2ccccc2)C1)[C@@H]1CCCc2cccnc21	ZINC000450996089	FI	On-Demand	Anodyne	CXCR4	79	40
COc1ccc(CN(C2CC2)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450996102	GG	On-Demand	Anodyne	BMP1	24	40
COc1ccc(CN(C2CC2)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450996102	GG	On-Demand	Anodyne	MMP13	16	42
COc1ccc(CN(C2CC2)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450996102	GG	On-Demand	Anodyne	MMP3	18	40
COc1ccc(CN(C2CC2)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450996102	GG	On-Demand	Anodyne	MMP9	16	42
COc1ccc(CN(C2CC2)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450996102	GG	On-Demand	Anodyne	MMP12	15	40
COc1ccc(CN(C2CC2)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450996102	GG	On-Demand	Anodyne	MMP1	15	42
CCCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@H]1CCCc2cccnc21	ZINC000450996108	FF	On-Demand	Anodyne	CXCR4	80	45
CCCN(C(=O)c1cc(C)c(C(N)=O)cn1)[C@@H]1CCCc2cccnc21	ZINC000450996112	FF	On-Demand	Anodyne	CXCR4	80	45
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(N(C)C)CCC3)cc2)c1	ZINC000450996122	GG	On-Demand	Anodyne	CHRM3	15	43
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(N(C)C)CCC3)cc2)c1	ZINC000450996122	GG	On-Demand	Anodyne	SLC6A5	17	50
Cc1cccc(CNC(=O)c2ccc(C(=O)NCC3(N(C)C)CCC3)cc2)c1	ZINC000450996122	GG	On-Demand	Anodyne	KCNK3	49	39
CCC[C@H](OC)C(=O)N(CCC)[C@@H]1CCCc2cccnc21	ZINC000450996141	DH	On-Demand	Anodyne	CXCR4	80	41
CCC[C@H](OC)C(=O)N(CCC)[C@H]1CCCc2cccnc21	ZINC000450996143	DH	On-Demand	Anodyne	CXCR4	80	41
CCC[C@@H](OC)C(=O)N(CCC)[C@@H]1CCCc2cccnc21	ZINC000450996144	DH	On-Demand	Anodyne	CXCR4	80	41
CCC[C@@H](OC)C(=O)N(CCC)[C@H]1CCCc2cccnc21	ZINC000450996146	DH	On-Demand	Anodyne	CXCR4	80	41
O=S(=O)(CCOCc1ccccc1)NCc1ccccc1CN1CCCC1	ZINC000450996166	GF	On-Demand	Anodyne	SIGMAR1	21	42
CCCN(C(=O)Cn1cc(C(C)=O)nn1)[C@H]1CCCc2cccnc21	ZINC000450996168	EE	On-Demand	Anodyne	CXCR4	77	39
CCCN(C(=O)Cn1cc(C(C)=O)nn1)[C@@H]1CCCc2cccnc21	ZINC000450996169	EE	On-Demand	Anodyne	CXCR4	77	39
CN(C)C1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CCC1	ZINC000450996178	GF	On-Demand	Anodyne	HCN1	76	37
CN(C)C1(CNC(=O)c2ccccc2-n2cc(Br)cn2)CCC1	ZINC000450996178	GF	On-Demand	Anodyne	HCN4	53	35
CC[C@H](CC(F)(F)F)C(=O)N(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450996179	FJ	On-Demand	Anodyne	CXCR4	76	41
CC[C@@H](CC(F)(F)F)C(=O)N(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450996182	FJ	On-Demand	Anodyne	CXCR4	76	41
CC[C@@H](CC(F)(F)F)C(=O)N(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450996183	FJ	On-Demand	Anodyne	CXCR4	76	41
CC[C@H](CC(F)(F)F)C(=O)N(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450996184	FJ	On-Demand	Anodyne	CXCR4	76	41
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCN1C(=O)c2ccccc2C1=O	ZINC000450996188	GG	On-Demand	Anodyne	SLC6A1	63	55
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CCCCN1C(=O)c2ccccc2C1=O	ZINC000450996188	GG	On-Demand	Anodyne	SLC6A3	37	55
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CCCCN1C(=O)c2ccccc2C1=O	ZINC000450996190	GG	On-Demand	Anodyne	SLC6A1	63	55
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CCCCN1C(=O)c2ccccc2C1=O	ZINC000450996190	GG	On-Demand	Anodyne	SLC6A3	37	55
C[C@H]1CCCCN1CCCNS(=O)(=O)c1cccc2ccoc12	ZINC000450996191	EF	On-Demand	Anodyne	HRH3	29	40
C[C@@H]1CCCCN1CCCNS(=O)(=O)c1cccc2ccoc12	ZINC000450996192	EF	On-Demand	Anodyne	HRH3	29	40
Cc1cnc(CCCC(=O)N(CC(C)C)[C@@H]2CCCc3cccnc32)o1	ZINC000450996193	FI	On-Demand	Anodyne	CXCR4	74	39
Cc1cnc(CCCC(=O)N(CC(C)C)[C@H]2CCCc3cccnc32)o1	ZINC000450996198	FI	On-Demand	Anodyne	CXCR4	74	39
CCCCOC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996225	EG	On-Demand	Anodyne	ADRB2	0	43
CCCCOC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996225	EG	On-Demand	Anodyne	DRD3	38	44
CCCCOC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996225	EG	On-Demand	Anodyne	KCNQ2	41	33
CCCCOC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996225	EG	On-Demand	Anodyne	ABCB1	57	47
CCCCOC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996225	EG	On-Demand	Anodyne	HSP90AB1	53	60
CCCCOC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996226	EG	On-Demand	Anodyne	ADRB2	0	43
CCCCOC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996226	EG	On-Demand	Anodyne	DRD3	38	44
CCCCOC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996226	EG	On-Demand	Anodyne	KCNQ2	41	33
CCCCOC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996226	EG	On-Demand	Anodyne	ABCB1	57	47
CCCCOC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996226	EG	On-Demand	Anodyne	HSP90AB1	53	60
O[C@@H]1COC[C@H]1N1CCCN(c2ccccc2Cl)CC1	ZINC000450996227	CD	On-Demand	Anodyne	SLC18A3	28	45
O[C@@H]1COC[C@@H]1N1CCCN(c2ccccc2Cl)CC1	ZINC000450996228	CD	On-Demand	Anodyne	SLC18A3	28	45
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450996238	GE	On-Demand	Anodyne	KCNA5	23	43
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450996238	GE	On-Demand	Anodyne	PRTN3	54	35
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450996238	GE	On-Demand	Anodyne	FFAR4	29	45
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450996238	GE	On-Demand	Anodyne	LUXN	0	45
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450996238	GE	On-Demand	Anodyne	ADIPOR1	0	41
COc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c(C)c1	ZINC000450996238	GE	On-Demand	Anodyne	ADIPOR2	0	41
COc1ccc(C(=O)N2CCCCC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450996254	EF	On-Demand	Anodyne	L3MBTL3	55	36
COc1ccc(C(=O)N2CCCCC(C)(C)C2)cc1S(C)(=O)=O	ZINC000450996254	EF	On-Demand	Anodyne	HPGD	26	40
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1C1CCC1	ZINC000450996256	FG	On-Demand	Anodyne	HTR1A	23	41
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1C1CCC1	ZINC000450996256	FG	On-Demand	Anodyne	DRD2	26	41
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1C1CCC1	ZINC000450996256	FG	On-Demand	Anodyne	ADRA1D	15	40
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1C1CCC1	ZINC000450996256	FG	On-Demand	Anodyne	ADRA1A	17	40
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1C1CCC1	ZINC000450996256	FG	On-Demand	Anodyne	ADRA1B	17	44
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1C1CCC1	ZINC000450996256	FG	On-Demand	Anodyne	DRD3	22	44
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nnc1C1CCC1	ZINC000450996256	FG	On-Demand	Anodyne	GRM2	17	40
Clc1ccccc1N1CCCN(CC[C@H]2CCOC2)CC1	ZINC000450996263	DG	On-Demand	Anodyne	HTR1A	25	41
Clc1ccccc1N1CCCN(CC[C@H]2CCOC2)CC1	ZINC000450996263	DG	On-Demand	Anodyne	DRD2	29	51
Clc1ccccc1N1CCCN(CC[C@H]2CCOC2)CC1	ZINC000450996263	DG	On-Demand	Anodyne	DRD3	34	51
Clc1ccccc1N1CCCN(CC[C@@H]2CCOC2)CC1	ZINC000450996264	DG	On-Demand	Anodyne	HTR1A	25	41
Clc1ccccc1N1CCCN(CC[C@@H]2CCOC2)CC1	ZINC000450996264	DG	On-Demand	Anodyne	DRD2	29	51
Clc1ccccc1N1CCCN(CC[C@@H]2CCOC2)CC1	ZINC000450996264	DG	On-Demand	Anodyne	DRD3	34	51
CCOc1ccncc1S(=O)(=O)NCCOc1ccc(OC)cc1	ZINC000450996265	FD	On-Demand	Anodyne	ALPL	25	41
CCOc1ccncc1S(=O)(=O)NCCOc1ccc(OC)cc1	ZINC000450996265	FD	On-Demand	Anodyne	Q95J97_RABIT	0	43
CCc1cccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450996270	DG	On-Demand	Anodyne	DRD4	16	55
CCc1cccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450996270	DG	On-Demand	Anodyne	SIGMAR1	15	51
CCc1cccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450996270	DG	On-Demand	Anodyne	CCR3	46	38
CCc1cccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450996270	DG	On-Demand	Anodyne	P2RY14	47	36
CCc1cccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450996270	DG	On-Demand	Anodyne	RHOA	0	46
CCc1cccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450996271	DG	On-Demand	Anodyne	DRD4	16	55
CCc1cccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450996271	DG	On-Demand	Anodyne	SIGMAR1	15	51
CCc1cccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450996271	DG	On-Demand	Anodyne	CCR3	46	38
CCc1cccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450996271	DG	On-Demand	Anodyne	P2RY14	47	36
CCc1cccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450996271	DG	On-Demand	Anodyne	RHOA	0	46
Cc1cccc(-c2noc(Cn3cnc4c3C[C@H](C)[C@@H](C)C4)n2)c1	ZINC000450996276	DH	On-Demand	Anodyne	GRM5	16	40
Cc1cccc(-c2noc(Cn3cnc4c3C[C@H](C)[C@H](C)C4)n2)c1	ZINC000450996277	DH	On-Demand	Anodyne	GRM5	16	40
Cc1cccc(-c2noc(Cn3cnc4c3C[C@@H](C)[C@@H](C)C4)n2)c1	ZINC000450996278	DH	On-Demand	Anodyne	GRM5	16	40
Cc1cccc(-c2noc(Cn3cnc4c3C[C@@H](C)[C@H](C)C4)n2)c1	ZINC000450996279	DH	On-Demand	Anodyne	GRM5	16	40
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	CA2	26	43
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	BMP1	69	39
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	CA1	48	38
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	MMP13	44	41
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	ADAM17	17	40
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	CA14	15	44
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	MMP2	29	41
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	MMP8	37	41
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	MMP9	44	41
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	CA12	38	43
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	CA9	37	43
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	MMP1	30	40
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	MTCA1	37	41
COc1cnc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nc1	ZINC000450996282	FD	On-Demand	Anodyne	P96878_MYCTU	46	41
COc1ccc(Cl)cc1CNC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450996285	FG	On-Demand	Anodyne	F2	19	46
COc1ccc(Cl)cc1CNC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450996285	FG	On-Demand	Anodyne	CPT1A	44	32
COc1ccc(Cl)cc1CNC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450996286	FG	On-Demand	Anodyne	F2	19	46
COc1ccc(Cl)cc1CNC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450996286	FG	On-Demand	Anodyne	CPT1A	44	32
COc1ccc(Cl)cc1CNC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450996287	FG	On-Demand	Anodyne	F2	19	46
COc1ccc(Cl)cc1CNC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450996287	FG	On-Demand	Anodyne	CPT1A	44	32
COc1ccc(Cl)cc1CNC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450996288	FG	On-Demand	Anodyne	F2	19	46
COc1ccc(Cl)cc1CNC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450996288	FG	On-Demand	Anodyne	CPT1A	44	32
COc1ccc(CC(=O)NCC(C)(C)C(C)C)c(Cl)c1OC	ZINC000450996289	EH	On-Demand	Anodyne	TRPV1	22	41
C[C@@H](Oc1ccccn1)C(=O)N1CCN(C2CC2)c2ccc(F)cc21	ZINC000450996298	EG	On-Demand	Anodyne	GPBAR1	40	37
C[C@H](Oc1ccccn1)C(=O)N1CCN(C2CC2)c2ccc(F)cc21	ZINC000450996299	EG	On-Demand	Anodyne	GPBAR1	40	37
N#Cc1cc(F)ccc1CS(=O)(=O)NCCN1CCCC1	ZINC000450996320	DD	On-Demand	Mild	HTR2A	18	42
CC1(C)CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@@H]1O	ZINC000450996321	FE	On-Demand	Mild	HTR1D	15	42
CC1(C)CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@@H]1O	ZINC000450996321	FE	On-Demand	Mild	HTR1B	17	42
CC1(C)CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@@H]1O	ZINC000450996321	FE	On-Demand	Mild	TRPV4	40	30
CC1(C)CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@H]1O	ZINC000450996322	FE	On-Demand	Mild	HTR1D	15	42
CC1(C)CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@H]1O	ZINC000450996322	FE	On-Demand	Mild	HTR1B	17	42
CC1(C)CN(C(=O)COc2ccc(C#N)c(Br)c2)CC[C@H]1O	ZINC000450996322	FE	On-Demand	Mild	TRPV4	40	30
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996323	EE	On-Demand	Anodyne	ACE	61	41
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996323	EE	On-Demand	Anodyne	FKBP1A	52	37
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996323	EE	On-Demand	Anodyne	SLC6A3	22	41
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996323	EE	On-Demand	Anodyne	PREP	39	40
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996323	EE	On-Demand	Anodyne	BRCA1	53	32
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996324	EE	On-Demand	Anodyne	ACE	61	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996324	EE	On-Demand	Anodyne	FKBP1A	52	37
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996324	EE	On-Demand	Anodyne	SLC6A3	22	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996324	EE	On-Demand	Anodyne	PREP	39	40
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC000450996324	EE	On-Demand	Anodyne	BRCA1	53	32
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996325	EE	On-Demand	Anodyne	ACE	61	41
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996325	EE	On-Demand	Anodyne	FKBP1A	52	37
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996325	EE	On-Demand	Anodyne	SLC6A3	22	41
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996325	EE	On-Demand	Anodyne	PREP	39	40
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996325	EE	On-Demand	Anodyne	BRCA1	53	32
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996326	EE	On-Demand	Anodyne	ACE	61	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996326	EE	On-Demand	Anodyne	FKBP1A	52	37
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996326	EE	On-Demand	Anodyne	SLC6A3	22	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996326	EE	On-Demand	Anodyne	PREP	39	40
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC000450996326	EE	On-Demand	Anodyne	BRCA1	53	32
CC1(C)CCCCN(C(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC000450996333	DH	On-Demand	Anodyne	HRH3	23	44
CC1(C)CCCCN(C(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000450996334	DH	On-Demand	Anodyne	HRH3	23	44
CC1(C)CCCCN(C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)C1	ZINC000450996345	EH	On-Demand	Anodyne	HPGD	27	40
CC(C)N(C)C(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450996347	EG	On-Demand	Anodyne	KCNQ2	70	38
CC(C)N(C)C(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450996348	EG	On-Demand	Anodyne	KCNQ2	70	38
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCN2CCCC2)c1	ZINC000450996366	FD	On-Demand	Anodyne	DRD4	43	35
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NCCN2CCCC2)c1	ZINC000450996366	FD	On-Demand	Anodyne	NPY2R	23	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	CA2	22	52
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	CA1	25	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	MMP13	23	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	CA4	21	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	CA14	15	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	MMP2	21	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	MMP14	15	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	MMP12	17	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	CA12	16	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NC(C)(C)C)cc1	ZINC000450996367	FD	On-Demand	Anodyne	CA9	17	52
CC(C)N(C)c1ccccc1CNC(=O)c1cncc(Cl)c1	ZINC000450996370	DH	On-Demand	Anodyne	SCN2A	22	54
CC(C)N(C)c1ccccc1CNC(=O)c1cncc(Cl)c1	ZINC000450996370	DH	On-Demand	Anodyne	SCN10A	53	54
CCc1cc(CC)c(S(=O)(=O)NC2CCN(C(C)=O)CC2)c(CC)c1	ZINC000450996379	FF	On-Demand	Anodyne	CCR8	44	36
CCc1cc(CC)c(S(=O)(=O)NC2CCN(C(C)=O)CC2)c(CC)c1	ZINC000450996379	FF	On-Demand	Anodyne	SFRP1	88	36
CCc1cc(CC)c(S(=O)(=O)NC2CCN(C(C)=O)CC2)c(CC)c1	ZINC000450996379	FF	On-Demand	Anodyne	WNT3	52	33
O=C(c1cncc(Cl)c1)N1CCN(C2CC2)c2ccc(F)cc21	ZINC000450996385	EH	On-Demand	Anodyne	GPBAR1	56	44
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H](O)C(C)(C)C3)cc2)c1	ZINC000450996390	GG	On-Demand	Anodyne	CHRM3	16	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H](O)C(C)(C)C3)cc2)c1	ZINC000450996390	GG	On-Demand	Anodyne	MMP13	18	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@H](O)C(C)(C)C3)cc2)c1	ZINC000450996390	GG	On-Demand	Anodyne	L3MBTL3	44	35
COc1ccccc1CCNC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450996405	GF	On-Demand	Anodyne	MBTPS1	52	36
COc1ccccc1CCNC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450996406	GF	On-Demand	Anodyne	MBTPS1	52	36
O=C(CCN1CCC[C@H](c2ccncc2)C1)NC1CCCC1	ZINC000450996409	DF	On-Demand	Anodyne	PRCP	24	42
O=C(CCN1CCC[C@H](c2ccncc2)C1)NC1CCCC1	ZINC000450996409	DF	On-Demand	Anodyne	BIRC2	45	36
O=C(CCN1CCC[C@@H](c2ccncc2)C1)NC1CCCC1	ZINC000450996412	DF	On-Demand	Anodyne	PRCP	24	42
O=C(CCN1CCC[C@@H](c2ccncc2)C1)NC1CCCC1	ZINC000450996412	DF	On-Demand	Anodyne	BIRC2	45	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2N(C)C)cc1	ZINC000450996416	FF	On-Demand	Anodyne	BDKRB1	0	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2N(C)C)cc1	ZINC000450996416	FF	On-Demand	Anodyne	GRM4	24	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2cccnc2N(C)C)cc1	ZINC000450996416	FF	On-Demand	Anodyne	PRTN3	49	31
COC[C@](C)(NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450996418	GF	On-Demand	Anodyne	CA14	15	44
COC[C@@](C)(NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450996421	GF	On-Demand	Anodyne	CA14	15	44
O=C(CN1CCC[C@H](c2ccncc2)C1)Nc1cc(F)cc(F)c1	ZINC000450996435	EG	On-Demand	Anodyne	DRD4	0	46
O=C(CN1CCC[C@@H](c2ccncc2)C1)Nc1cc(F)cc(F)c1	ZINC000450996437	EG	On-Demand	Anodyne	DRD4	0	46
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)N2CCN(CCO)CC2)c1	ZINC000450996438	GC	On-Demand	Anodyne	DRD4	40	31
Cc1csc(S(=O)(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c1	ZINC000450996439	GG	On-Demand	Anodyne	L3MBTL3	55	35
CCOC(=O)c1ccc(NC(=O)Cn2cnc3c2C[C@H](C)[C@@H](C)C3)cc1	ZINC000450996443	FG	On-Demand	Anodyne	ACR	47	33
CC(C)CN(C(=O)c1ccc(C#N)n1C)[C@H]1CCCc2cccnc21	ZINC000450996445	EG	On-Demand	Mild	CXCR4	72	39
CC(C)CN(C(=O)c1ccc(C#N)n1C)[C@@H]1CCCc2cccnc21	ZINC000450996446	EG	On-Demand	Mild	CXCR4	72	39
CCOC(=O)c1ccc(NC(=O)Cn2cnc3c2C[C@H](C)[C@H](C)C3)cc1	ZINC000450996447	FG	On-Demand	Anodyne	ACR	47	33
CCOC(=O)c1ccc(NC(=O)Cn2cnc3c2C[C@@H](C)[C@@H](C)C3)cc1	ZINC000450996449	FG	On-Demand	Anodyne	ACR	47	33
COC(=O)CCSc1ncccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450996450	GG	On-Demand	Anodyne	PRTN3	51	32
CCOC(=O)c1ccc(NC(=O)Cn2cnc3c2C[C@@H](C)[C@H](C)C3)cc1	ZINC000450996454	FG	On-Demand	Anodyne	ACR	47	33
Cc1ccnc(-c2noc(CN3CCCN(c4ccccc4Cl)CC3)n2)c1	ZINC000450996465	GH	On-Demand	Anodyne	HTR1A	22	41
Cc1ccnc(-c2noc(CN3CCCN(c4ccccc4Cl)CC3)n2)c1	ZINC000450996465	GH	On-Demand	Anodyne	DRD2	27	42
Cc1ccnc(-c2noc(CN3CCCN(c4ccccc4Cl)CC3)n2)c1	ZINC000450996465	GH	On-Demand	Anodyne	DRD4	34	42
Cc1ccnc(-c2noc(CN3CCCN(c4ccccc4Cl)CC3)n2)c1	ZINC000450996465	GH	On-Demand	Anodyne	HTR2A	15	41
Cc1ccnc(-c2noc(CN3CCCN(c4ccccc4Cl)CC3)n2)c1	ZINC000450996465	GH	On-Demand	Anodyne	DRD3	30	42
Cc1ccnc(-c2noc(CN3CCCN(c4ccccc4Cl)CC3)n2)c1	ZINC000450996465	GH	On-Demand	Anodyne	NOX1	43	33
C/C=C/c1ccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)c(OC)c1	ZINC000450996466	GH	On-Demand	Anodyne	ADRB2	0	52
C/C=C\c1ccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)c(OC)c1	ZINC000450996467	GH	On-Demand	Anodyne	ADRB2	0	52
CCN(c1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996472	GF	On-Demand	Anodyne	MMP9	20	41
CCN(c1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996472	GF	On-Demand	Anodyne	LUXN	0	48
CCN(c1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996472	GF	On-Demand	Anodyne	ADIPOR1	0	42
CCN(c1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996472	GF	On-Demand	Anodyne	ADIPOR2	0	42
C/C=C/c1ccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)c(OC)c1	ZINC000450996473	GH	On-Demand	Anodyne	ADRB2	0	52
COc1cccc(OCCC(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450996476	DF	On-Demand	Anodyne	MTNR1A	56	55
COc1cccc(OCCC(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450996476	DF	On-Demand	Anodyne	MTNR1B	56	55
COc1cccc(OCCC(=O)NC[C@H](C)C(F)(F)F)c1	ZINC000450996476	DF	On-Demand	Anodyne	PDS	50	35
COc1cccc(OCCC(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450996477	DF	On-Demand	Anodyne	MTNR1A	56	55
COc1cccc(OCCC(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450996477	DF	On-Demand	Anodyne	MTNR1B	56	55
COc1cccc(OCCC(=O)NC[C@@H](C)C(F)(F)F)c1	ZINC000450996477	DF	On-Demand	Anodyne	PDS	50	35
COc1cc(CN2CCC[C@@H]2c2nc(C)no2)ccc1Cl	ZINC000450996478	DG	On-Demand	Anodyne	SSTR5	40	36
COc1cc(CN2CCC[C@H]2c2nc(C)no2)ccc1Cl	ZINC000450996479	DG	On-Demand	Anodyne	SSTR5	40	36
C/C=C\c1ccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)c(OC)c1	ZINC000450996481	GH	On-Demand	Anodyne	ADRB2	0	52
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC2(N(C)C)CCC2)cc1	ZINC000450996482	GE	On-Demand	Anodyne	MMP2	19	47
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC2(N(C)C)CCC2)cc1	ZINC000450996482	GE	On-Demand	Anodyne	CAPN1	16	57
Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)NCC2(N(C)C)CCC2)cc1	ZINC000450996482	GE	On-Demand	Anodyne	LEF	48	34
CCOc1ccc(N(CCC#N)C(=O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450996485	GH	On-Demand	Mild	CACNA2D2	49	30
Fc1cccc(OCCSC2CCC2)c1	ZINC000450996492	BG	On-Demand	Anodyne	CHRNA10	66	48
Fc1cccc(OCCSC2CCC2)c1	ZINC000450996492	BG	On-Demand	Anodyne	VCP	16	41
CCOc1ccc(N(CCC#N)C(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450996495	GH	On-Demand	Mild	CACNA2D2	49	30
CCCN(C(=O)CCCn1nc(C)nc1C)[C@@H]1CCCc2cccnc21	ZINC000450996499	FG	On-Demand	Anodyne	CXCR4	74	40
CCCN(C(=O)CCCn1nc(C)nc1C)[C@H]1CCCc2cccnc21	ZINC000450996501	FG	On-Demand	Anodyne	CXCR4	74	40
COc1cccc(CNC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450996504	CF	On-Demand	Anodyne	ROCK1	38	41
COc1cccc(CNC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450996504	CF	On-Demand	Anodyne	MTNR1A	57	42
COc1cccc(CNC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450996504	CF	On-Demand	Anodyne	MTNR1B	47	42
COc1cccc(CNC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450996504	CF	On-Demand	Anodyne	ROCK2	48	44
COc1cccc(CNC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450996504	CF	On-Demand	Anodyne	PDS	46	34
COc1cccc(CNC(=O)[C@H](C)SC2CCC2)c1	ZINC000450996505	CF	On-Demand	Anodyne	ROCK1	38	41
COc1cccc(CNC(=O)[C@H](C)SC2CCC2)c1	ZINC000450996505	CF	On-Demand	Anodyne	MTNR1A	57	42
COc1cccc(CNC(=O)[C@H](C)SC2CCC2)c1	ZINC000450996505	CF	On-Demand	Anodyne	MTNR1B	47	42
COc1cccc(CNC(=O)[C@H](C)SC2CCC2)c1	ZINC000450996505	CF	On-Demand	Anodyne	ROCK2	48	44
COc1cccc(CNC(=O)[C@H](C)SC2CCC2)c1	ZINC000450996505	CF	On-Demand	Anodyne	PDS	46	34
Cc1[nH]nc(NS(=O)(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)c1C#N	ZINC000450996508	GD	On-Demand	Mild	MTNN	85	41
CCOc1ccc(-c2noc(CSC3CCC3)n2)cc1	ZINC000450996509	CH	On-Demand	Anodyne	WNT3A	22	46
CCOc1ccc(-c2noc(CSC3CCC3)n2)cc1	ZINC000450996509	CH	On-Demand	Anodyne	AXIN2	0	42
CO[C@@H](C)CS(=O)(=O)Nc1ncc(C2CCCCC2)s1	ZINC000450996526	DF	On-Demand	Anodyne	CDK5	41	40
CO[C@H](C)CS(=O)(=O)Nc1ncc(C2CCCCC2)s1	ZINC000450996528	DF	On-Demand	Anodyne	CDK5	41	40
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CCC1CC1	ZINC000450996530	CF	On-Demand	Anodyne	SLC6A1	39	41
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CCC1CC1	ZINC000450996531	CF	On-Demand	Anodyne	SLC6A1	39	41
CC(C)CN(C(=O)Cc1ccc(O)c(F)c1)[C@@H]1CCCc2cccnc21	ZINC000450996533	FI	On-Demand	Anodyne	CXCR4	76	39
CC(C)CN(C(=O)Cc1ccc(O)c(F)c1)[C@H]1CCCc2cccnc21	ZINC000450996534	FI	On-Demand	Anodyne	CXCR4	76	39
C[C@@H](SC1CCC1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000450996541	DG	On-Demand	Anodyne	SSTR3	50	38
C[C@@H](SC1CCC1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000450996541	DG	On-Demand	Anodyne	AKR1C3	16	46
C[C@H](SC1CCC1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000450996543	DG	On-Demand	Anodyne	SSTR3	50	38
C[C@H](SC1CCC1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000450996543	DG	On-Demand	Anodyne	AKR1C3	16	46
CCCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450996555	FE	On-Demand	Anodyne	CA1	15	40
CCCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450996555	FE	On-Demand	Anodyne	CA14	16	41
CCCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450996555	FE	On-Demand	Anodyne	TGM2	18	43
CCCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450996555	FE	On-Demand	Anodyne	F13A1	33	43
CCCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450996555	FE	On-Demand	Anodyne	CCR8	95	42
CCCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450996555	FE	On-Demand	Anodyne	SFRP1	83	39
CCCN1CCC(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450996555	FE	On-Demand	Anodyne	WNT3	49	34
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	AVPR1B	29	44
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	BMP1	113	40
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	KCNA5	0	45
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP13	70	44
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	ADAM17	46	36
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP16	0	42
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP2	37	44
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP3	54	43
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP8	39	44
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP9	66	45
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP12	31	43
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP7	41	40
COC(=O)c1ncccc1S(=O)(=O)N(Cc1ccc(OC)cc1)C1CC1	ZINC000450996556	GE	On-Demand	Anodyne	MMP1	66	45
COCCCOc1ccccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450996559	FH	On-Demand	Anodyne	PRTN3	53	32
C[C@@H](SC1CCC1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000450996561	DD	On-Demand	Anodyne	SLC6A7	0	44
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1Cl	ZINC000450996562	GG	On-Demand	Anodyne	ABCB1	44	40
C[C@H](SC1CCC1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000450996563	DD	On-Demand	Anodyne	SLC6A7	0	44
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1Cl	ZINC000450996564	GG	On-Demand	Anodyne	ABCB1	44	40
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccccc1Cl	ZINC000450996567	GG	On-Demand	Anodyne	ABCB1	44	40
Cc1cccc(OCCNC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450996569	CG	On-Demand	Anodyne	HRH2	34	40
Cc1cccc(OCCNC(=O)[C@@H](C)SC2CCC2)c1	ZINC000450996569	CG	On-Demand	Anodyne	MTNR1B	25	43
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccccc1Cl	ZINC000450996570	GG	On-Demand	Anodyne	ABCB1	44	40
Cc1cccc(OCCNC(=O)[C@H](C)SC2CCC2)c1	ZINC000450996571	CG	On-Demand	Anodyne	HRH2	34	40
Cc1cccc(OCCNC(=O)[C@H](C)SC2CCC2)c1	ZINC000450996571	CG	On-Demand	Anodyne	MTNR1B	25	43
COc1ccc(Cl)cc1CN(C)S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450996576	GH	On-Demand	Anodyne	AVPR1B	40	33
COc1ccc(Cl)cc1CN(C)S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450996581	GH	On-Demand	Anodyne	AVPR1B	40	33
Cc1ccc2cc(S(=O)(=O)NCC(=O)N(C)C)ccc2c1	ZINC000450996584	DD	On-Demand	Anodyne	IAP	0	40
N#CCN(C1CCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996585	GD	On-Demand	Mild	LUXN	0	46
N#CCN(C1CCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996585	GD	On-Demand	Mild	ADIPOR1	0	42
N#CCN(C1CCCC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996585	GD	On-Demand	Mild	ADIPOR2	0	42
C[C@@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996586	DI	On-Demand	Anodyne	LCK	21	42
C[C@@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996586	DI	On-Demand	Anodyne	CSNK1D	44	44
C[C@@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996586	DI	On-Demand	Anodyne	NMT1	35	42
C[C@@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996586	DI	On-Demand	Anodyne	PIK3CA	20	41
C[C@@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996586	DI	On-Demand	Anodyne	FABK	0	41
C[C@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996587	DI	On-Demand	Anodyne	LCK	19	41
C[C@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996587	DI	On-Demand	Anodyne	CSNK1D	36	44
C[C@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996587	DI	On-Demand	Anodyne	PIK3CA	20	41
C[C@H](SC1CCC1)C(=O)Nc1nc2ccc(F)cc2s1	ZINC000450996587	DI	On-Demand	Anodyne	FABK	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCNC(=O)c3ccccc32)cc1	ZINC000450996602	GE	On-Demand	Anodyne	TGM2	45	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCNC(=O)c3ccccc32)cc1	ZINC000450996602	GE	On-Demand	Anodyne	F13A1	74	35
COC(=O)c1oc(CSC2CCC2)cc1C	ZINC000450996609	BG	On-Demand	Anodyne	QRFPR	41	36
COc1cc(CNC(=O)CSC2CCC2)cc(OC)c1OC	ZINC000450996611	EF	On-Demand	Anodyne	DRD2	43	37
COc1cc(CNC(=O)CSC2CCC2)cc(OC)c1OC	ZINC000450996611	EF	On-Demand	Anodyne	QRFPR	44	37
CC(C)c1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450996612	CI	On-Demand	Anodyne	ACAT	0	48
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	ADRB2	15	47
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	CA1	15	44
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	MMP13	35	41
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	MMP2	17	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	MMP3	23	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	MMP8	18	41
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	MMP9	31	40
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	MMP12	20	41
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	FOLP	0	47
CCOC(=O)c1ccc(CS(=O)(=O)NCCOc2ccc(OC)cc2)cc1	ZINC000450996613	GE	On-Demand	Anodyne	MMP1	35	40
CC(C)c1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450996614	CI	On-Demand	Anodyne	ACAT	0	48
CCc1cc(O)nc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450996617	EG	On-Demand	Anodyne	HTR1A	26	41
CCc1cc(O)nc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450996617	EG	On-Demand	Anodyne	DRD2	37	42
CCc1cc(O)nc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450996617	EG	On-Demand	Anodyne	DRD1	26	40
CCc1cc(O)nc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450996617	EG	On-Demand	Anodyne	DRD4	35	40
CCc1cc(O)nc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450996617	EG	On-Demand	Anodyne	KCNQ2	51	38
CCc1cc(O)nc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450996617	EG	On-Demand	Anodyne	NOX1	47	32
CCc1cc(O)nc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450996617	EG	On-Demand	Anodyne	NOX5	43	32
O=C(CCCN1CCOC[C@@H]1CC(F)F)c1ccc(Br)cc1	ZINC000450996619	GH	On-Demand	Anodyne	CYP2J2	47	34
O=C(CCCN1CCOC[C@H]1CC(F)F)c1ccc(Br)cc1	ZINC000450996620	GH	On-Demand	Anodyne	CYP2J2	47	34
Cc1csc(C(=O)N2CCN(C3CC3)c3ccc(F)cc32)c1	ZINC000450996621	DH	On-Demand	Anodyne	GPBAR1	44	43
Cc1csc(C(=O)N2CCN(C3CC3)c3ccc(F)cc32)c1	ZINC000450996621	DH	On-Demand	Anodyne	SCD1	15	42
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996627	GC	On-Demand	Anodyne	MMP16	0	40
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996627	GC	On-Demand	Anodyne	MMP3	17	44
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996627	GC	On-Demand	Anodyne	LUXN	0	43
C[C@H](SC1CCC1)C(=O)NCc1ccc(Cl)cc1	ZINC000450996651	CH	On-Demand	Anodyne	SLC6A12	0	43
C[C@@H](SC1CCC1)C(=O)NCc1ccc(Cl)cc1	ZINC000450996652	CH	On-Demand	Anodyne	SLC6A12	0	43
Cc1c(NS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)cccc1N(C)C	ZINC000450996653	GE	On-Demand	Anodyne	NR3C1	15	47
COc1cc2c(cc1OC)CN(C(=O)CSC1CCC1)CC2	ZINC000450996659	DF	On-Demand	Anodyne	SLC18A2	40	35
COc1cc2c(cc1OC)CN(C(=O)CSC1CCC1)CC2	ZINC000450996659	DF	On-Demand	Anodyne	MTNR1B	0	40
COc1cc2c(cc1OC)CN(C(=O)CSC1CCC1)CC2	ZINC000450996659	DF	On-Demand	Anodyne	ABCB1	24	53
COc1cc2c(cc1OC)CN(C(=O)CSC1CCC1)CC2	ZINC000450996659	DF	On-Demand	Anodyne	QRFPR	43	31
CN(Cc1ccccc1N1CCCC1)S(=O)(=O)CCOCc1ccccc1	ZINC000450996670	GG	On-Demand	Anodyne	KCNQ2	65	40
CCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996671	CG	On-Demand	Anodyne	DRD3	27	43
CCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996671	CG	On-Demand	Anodyne	ABCB1	63	43
CCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996671	CG	On-Demand	Anodyne	HSP90AB1	39	45
CCC[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996671	CG	On-Demand	Anodyne	NOX1	47	31
CCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996672	CG	On-Demand	Anodyne	DRD3	27	43
CCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996672	CG	On-Demand	Anodyne	ABCB1	63	43
CCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996672	CG	On-Demand	Anodyne	HSP90AB1	39	45
CCC[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996672	CG	On-Demand	Anodyne	NOX1	47	31
C[C@H]1Cc2ncn(CC(=O)NCc3ccc(S(C)(=O)=O)cc3)c2C[C@@H]1C	ZINC000450996673	GD	On-Demand	Anodyne	NAMPT	57	36
C[C@H]1Cc2c(ncn2CC(=O)NCc2ccc(S(C)(=O)=O)cc2)C[C@H]1C	ZINC000450996674	GD	On-Demand	Anodyne	NAMPT	57	36
C[C@H]1Cc2ncn(CC(=O)NCc3ccc(S(C)(=O)=O)cc3)c2C[C@H]1C	ZINC000450996675	GD	On-Demand	Anodyne	NAMPT	57	36
C[C@@H]1Cc2ncn(CC(=O)NCc3ccc(S(C)(=O)=O)cc3)c2C[C@H]1C	ZINC000450996676	GD	On-Demand	Anodyne	NAMPT	57	36
C[C@H]1Cc2c(ncn2CC(=O)NCCCc2ccccc2)C[C@H]1C	ZINC000450996689	EG	On-Demand	Anodyne	SDH1	0	41
C[C@H]1Cc2c(ncn2CC(=O)NCCCc2ccccc2)C[C@H]1C	ZINC000450996689	EG	On-Demand	Anodyne	MTNR1B	26	40
C[C@H]1Cc2c(ncn2CC(=O)NCCCc2ccccc2)C[C@H]1C	ZINC000450996689	EG	On-Demand	Anodyne	CRTM	41	39
C[C@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@@H]1C	ZINC000450996690	EG	On-Demand	Anodyne	SDH1	0	41
C[C@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@@H]1C	ZINC000450996690	EG	On-Demand	Anodyne	MTNR1B	26	40
C[C@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@@H]1C	ZINC000450996690	EG	On-Demand	Anodyne	CRTM	41	39
C[C@@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@H]1C	ZINC000450996691	EG	On-Demand	Anodyne	SDH1	0	41
C[C@@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@H]1C	ZINC000450996691	EG	On-Demand	Anodyne	MTNR1B	26	40
C[C@@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@H]1C	ZINC000450996691	EG	On-Demand	Anodyne	CRTM	41	39
C[C@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@H]1C	ZINC000450996692	EG	On-Demand	Anodyne	SDH1	0	41
C[C@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@H]1C	ZINC000450996692	EG	On-Demand	Anodyne	MTNR1B	26	40
C[C@H]1Cc2ncn(CC(=O)NCCCc3ccccc3)c2C[C@H]1C	ZINC000450996692	EG	On-Demand	Anodyne	CRTM	41	39
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H](O)C(C)(C)C3)cc2)c1	ZINC000450996703	GG	On-Demand	Anodyne	CHRM3	16	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H](O)C(C)(C)C3)cc2)c1	ZINC000450996703	GG	On-Demand	Anodyne	MMP13	18	43
Cc1cccc(CNC(=O)c2ccc(C(=O)N3CC[C@@H](O)C(C)(C)C3)cc2)c1	ZINC000450996703	GG	On-Demand	Anodyne	L3MBTL3	44	35
Cc1nn(C)cc1CC(=O)N1CCN(C2CC2)c2ccc(F)cc21	ZINC000450996716	EE	On-Demand	Anodyne	EIF2AK3	48	38
N#Cc1ccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450996723	GG	On-Demand	Mild	HTR1A	31	55
N#Cc1ccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450996723	GG	On-Demand	Mild	DRD2	43	55
N#Cc1ccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450996723	GG	On-Demand	Mild	DRD1	19	44
N#Cc1ccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450996723	GG	On-Demand	Mild	DRD4	38	47
N#Cc1ccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450996723	GG	On-Demand	Mild	DRD3	60	41
N#Cc1ccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450996723	GG	On-Demand	Mild	HTR7	30	55
N#Cc1ccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450996723	GG	On-Demand	Mild	KCNQ2	46	42
O=S(=O)(CCC1CCCC1)NCc1ccc(CN2CCCC2)cc1	ZINC000450996730	FG	On-Demand	Anodyne	HRH3	20	43
O=S(=O)(CCC1CCCC1)NCc1ccc(CN2CCCC2)cc1	ZINC000450996730	FG	On-Demand	Anodyne	SIGMAR1	32	40
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	F2	78	46
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	PLG	21	41
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	PRSS1	17	43
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	ACE	50	43
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	ELANE	69	39
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	TACR1	21	45
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	P2RX7	43	42
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	TRY1_BOVIN	75	44
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	DPP4	16	44
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	PREP	64	51
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	XIAP	66	47
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	BRCA1	61	33
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	TMPRSS11D	81	45
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	TMPRSS2	0	40
CC(C)N(C)c1ccccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000450996735	GG	On-Demand	Anodyne	MLX	0	42
O=C(c1cnn2c1CCC2)N1CCN(C2CC2)c2ccc(F)cc21	ZINC000450996741	EF	On-Demand	Anodyne	GPBAR1	41	39
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	MMP13	27	47
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	ADAM17	16	42
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	MMP2	18	47
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	MMP14	15	47
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	PRTN3	45	31
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	ADAMTS4	20	41
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	MMP1	18	47
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	SFRP1	44	33
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	WNT3	40	31
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	TRAR	32	41
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	LUXN	0	50
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	ADIPOR1	0	41
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996755	GC	On-Demand	Anodyne	ADIPOR2	0	41
O=C1CCCCN1Cc1cccc(NS(=O)(=O)c2cccc(Cl)c2O)c1	ZINC000450996779	GG	On-Demand	Anodyne	NR1I2	45	39
O=C1CCCCN1Cc1cccc(NS(=O)(=O)c2cccc(Cl)c2O)c1	ZINC000450996779	GG	On-Demand	Anodyne	POL	0	40
O=C1CCCCN1Cc1cccc(NS(=O)(=O)c2cccc(Cl)c2O)c1	ZINC000450996779	GG	On-Demand	Anodyne	PFK	0	42
CC(C)N(C)c1ccccc1CNC(=O)c1ccc(-c2cnn(C)c2)o1	ZINC000450996787	FG	On-Demand	Anodyne	MMP13	0	43
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	HTR1A	52	42
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	DRD2	50	47
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	DRD4	43	47
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	ADRA1D	22	41
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	HTR2A	29	41
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	HTR2C	26	41
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	ADRA1A	20	41
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	DRD3	64	40
CCOC(=O)CN(C)C(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450996791	FD	On-Demand	Anodyne	KCNQ2	56	36
O=C(COc1ccc(S(=O)(=O)Nc2n[nH]c(C3CCC3)n2)cc1)NC1CC1	ZINC000450996793	GD	On-Demand	Anodyne	LUXN	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncn(C)c2C(N)=O)cc1	ZINC000450996796	FC	On-Demand	Anodyne	CA4	23	41
Cc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)c(C(C)C)n1	ZINC000450996807	DH	On-Demand	Anodyne	PLD1	44	34
Cc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)c(C(C)C)n1	ZINC000450996808	DH	On-Demand	Anodyne	PLD1	44	34
COc1cc(OC)nc(NS(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)n1	ZINC000450996818	GC	On-Demand	Anodyne	ALS	71	31
CC(C)c1cccc(NC(=O)CSC2CCC2)c1	ZINC000450996827	CI	On-Demand	Anodyne	QRFPR	41	35
O=c1c(F)cncn1CCCCc1ccc(Cl)c(Cl)c1	ZINC000450996830	DH	On-Demand	Anodyne	DNAE	69	34
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450996831	GE	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450996831	GE	On-Demand	Anodyne	OPRD1	44	33
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450996831	GE	On-Demand	Anodyne	AGTR2	61	38
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450996831	GE	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450996831	GE	On-Demand	Anodyne	CFTR	54	33
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450996831	GE	On-Demand	Anodyne	ADAM9	61	34
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450996833	GE	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450996833	GE	On-Demand	Anodyne	OPRD1	44	33
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450996833	GE	On-Demand	Anodyne	AGTR2	61	38
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450996833	GE	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450996833	GE	On-Demand	Anodyne	CFTR	54	33
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450996833	GE	On-Demand	Anodyne	ADAM9	61	34
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450996834	GE	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450996834	GE	On-Demand	Anodyne	OPRD1	44	33
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450996834	GE	On-Demand	Anodyne	AGTR2	61	38
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450996834	GE	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450996834	GE	On-Demand	Anodyne	CFTR	54	33
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450996834	GE	On-Demand	Anodyne	ADAM9	61	34
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450996836	GE	On-Demand	Anodyne	OPRM1	0	43
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450996836	GE	On-Demand	Anodyne	OPRD1	44	33
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450996836	GE	On-Demand	Anodyne	AGTR2	61	38
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450996836	GE	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450996836	GE	On-Demand	Anodyne	CFTR	54	33
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450996836	GE	On-Demand	Anodyne	ADAM9	61	34
CC(C)(C)c1ccccc1NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450996844	FI	On-Demand	Anodyne	DRD4	22	41
CC(C)(C)c1ccccc1NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450996845	FI	On-Demand	Anodyne	DRD4	22	41
CCOc1ccc(NC(=O)Cn2cnc3c2C[C@H](C)[C@H](C)C3)cc1OCC	ZINC000450996847	FH	On-Demand	Anodyne	ENPP1	60	36
CCOc1ccc(NC(=O)Cn2cnc3c2C[C@H](C)[C@@H](C)C3)cc1OCC	ZINC000450996848	FH	On-Demand	Anodyne	ENPP1	60	36
CCOc1ccc(NC(=O)Cn2cnc3c2C[C@@H](C)[C@H](C)C3)cc1OCC	ZINC000450996850	FH	On-Demand	Anodyne	ENPP1	60	36
CCOc1ccc(NC(=O)Cn2cnc3c2C[C@@H](C)[C@@H](C)C3)cc1OCC	ZINC000450996853	FH	On-Demand	Anodyne	ENPP1	60	36
CCc1ccccc1NC(=O)[C@@H](C)SC1CCC1	ZINC000450996861	CH	On-Demand	Anodyne	KCNQ2	56	36
CCc1ccccc1NC(=O)[C@H](C)SC1CCC1	ZINC000450996863	CH	On-Demand	Anodyne	KCNQ2	56	36
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccccc1	ZINC000450996869	CG	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CC[C@@H](COC(F)F)C1)c1ccccc1	ZINC000450996869	CG	On-Demand	Anodyne	SLC6A1	0	46
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccccc1	ZINC000450996871	CG	On-Demand	Anodyne	DRD4	0	46
O=C(CCCN1CC[C@H](COC(F)F)C1)c1ccccc1	ZINC000450996871	CG	On-Demand	Anodyne	SLC6A1	0	46
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1C(=O)NC(C)(C)C	ZINC000450996873	GE	On-Demand	Anodyne	BDKRB1	0	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccccc1C(=O)NC(C)(C)C	ZINC000450996873	GE	On-Demand	Anodyne	PRTN3	63	39
COc1ccc(OCCNS(=O)(=O)C2(C)CC2)cc1	ZINC000450996888	CD	On-Demand	Anodyne	MMP13	19	40
O=S(=O)(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1sccc1F	ZINC000450996889	GE	On-Demand	Anodyne	PKM	43	38
O=S(=O)(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1sccc1F	ZINC000450996889	GE	On-Demand	Anodyne	TGM2	48	37
O=S(=O)(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1sccc1F	ZINC000450996889	GE	On-Demand	Anodyne	F13A1	61	44
O=S(=O)(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1sccc1F	ZINC000450996889	GE	On-Demand	Anodyne	NAMPT	20	43
C[C@H](NC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2)c1ccc(Cl)cc1	ZINC000450996890	EH	On-Demand	Anodyne	SDH1	0	41
C[C@H](NC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2)c1ccc(Cl)cc1	ZINC000450996890	EH	On-Demand	Anodyne	PRCP	20	42
C[C@H](NC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2)c1ccc(Cl)cc1	ZINC000450996891	EH	On-Demand	Anodyne	SDH1	0	41
C[C@H](NC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2)c1ccc(Cl)cc1	ZINC000450996891	EH	On-Demand	Anodyne	PRCP	20	42
COc1cc(CSC2CCC2)ccc1OC(F)F	ZINC000450996892	CI	On-Demand	Anodyne	QRFPR	47	39
C[C@@H](SC1CCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000450996893	DI	On-Demand	Anodyne	P2RY1	65	42
C[C@@H](SC1CCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000450996893	DI	On-Demand	Anodyne	EPHX2	69	51
C[C@H](NC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2)c1ccc(Cl)cc1	ZINC000450996894	EH	On-Demand	Anodyne	SDH1	0	41
C[C@H](NC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2)c1ccc(Cl)cc1	ZINC000450996894	EH	On-Demand	Anodyne	PRCP	20	42
C[C@H](SC1CCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000450996895	DI	On-Demand	Anodyne	P2RY1	57	34
C[C@H](SC1CCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000450996895	DI	On-Demand	Anodyne	EPHX2	69	51
C[C@H](NC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2)c1ccc(Cl)cc1	ZINC000450996896	EH	On-Demand	Anodyne	SDH1	0	41
C[C@H](NC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2)c1ccc(Cl)cc1	ZINC000450996896	EH	On-Demand	Anodyne	PRCP	20	42
COc1ccc(CCNC(=O)[C@@H](C)SC2CCC2)cc1OC	ZINC000450996897	DG	On-Demand	Anodyne	CACNA1C	17	43
COc1ccc(CCNC(=O)[C@H](C)SC2CCC2)cc1OC	ZINC000450996899	DG	On-Demand	Anodyne	CACNA1C	17	43
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4ccncc4)CC3)ccc2c1	ZINC000450996900	GG	On-Demand	Anodyne	ADORA2B	51	43
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4ccncc4)CC3)ccc2c1	ZINC000450996900	GG	On-Demand	Anodyne	LSS	17	56
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4ccncc4)CC3)ccc2c1	ZINC000450996900	GG	On-Demand	Anodyne	PKM	35	40
COc1ccc(OC)c([C@@H]2CCCN2S(=O)(=O)c2cc(C)cs2)c1	ZINC000450996905	FH	On-Demand	Anodyne	FKBP1A	43	38
COc1ccc(OC)c([C@H]2CCCN2S(=O)(=O)c2cc(C)cs2)c1	ZINC000450996906	FH	On-Demand	Anodyne	FKBP1A	43	38
OC1(CN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450996910	DE	On-Demand	Anodyne	DRD2	18	43
OC1(CN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450996910	DE	On-Demand	Anodyne	ADRA1D	20	52
OC1(CN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450996910	DE	On-Demand	Anodyne	ADRA1B	19	52
C[C@@H](CCc1ccco1)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996914	GE	On-Demand	Anodyne	ADAMTS4	54	34
C[C@@H](CCc1ccco1)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996914	GE	On-Demand	Anodyne	LUXN	0	41
C[C@H](CCc1ccco1)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996915	GE	On-Demand	Anodyne	ADAMTS4	54	34
C[C@H](CCc1ccco1)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450996915	GE	On-Demand	Anodyne	LUXN	0	41
Cc1csc(S(=O)(=O)NCCCn2cnc3ccccc32)c1	ZINC000450996935	EF	On-Demand	Anodyne	NR1I2	62	43
Cc1cc(C)c(NS(=O)(=O)Cc2ccc(C(F)F)cc2)c(C)c1	ZINC000450996946	EI	On-Demand	Anodyne	FFAR4	32	47
Cc1ccncc1S(=O)(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000450996949	GD	On-Demand	Anodyne	NR1H4	16	41
Cc1ccncc1S(=O)(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000450996949	GD	On-Demand	Anodyne	EPHX2	15	45
Cc1ccncc1S(=O)(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000450996949	GD	On-Demand	Anodyne	TGM2	65	39
Cc1ccncc1S(=O)(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000450996949	GD	On-Demand	Anodyne	F13A1	79	39
Cc1ccncc1S(=O)(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000450996949	GD	On-Demand	Anodyne	SLC27A1	37	40
COc1cc(CNS(=O)(=O)C2(C)CC2)ccc1OCc1ccccc1	ZINC000450996950	FG	On-Demand	Anodyne	DRTS_PLAFK	23	45
COc1cc(CNS(=O)(=O)C2(C)CC2)ccc1OCc1ccccc1	ZINC000450996950	FG	On-Demand	Anodyne	PTGER2	0	44
COc1cc(CNS(=O)(=O)C2(C)CC2)ccc1OCc1ccccc1	ZINC000450996950	FG	On-Demand	Anodyne	PTGER4	19	44
COc1cc(CNS(=O)(=O)C2(C)CC2)ccc1OCc1ccccc1	ZINC000450996950	FG	On-Demand	Anodyne	PDEB1	0	42
CC(C)NC(=O)CNS(=O)(=O)CCC1CCCC1	ZINC000450996951	CD	On-Demand	Anodyne	BMP1	43	36
CO[C@@H](Cc1ccccc1)CN1CC[C@@H](COC(F)F)C1	ZINC000450996960	CF	On-Demand	Anodyne	SLC6A3	18	41
CO[C@@H](Cc1ccccc1)CN1CC[C@H](COC(F)F)C1	ZINC000450996963	CF	On-Demand	Anodyne	SLC6A3	18	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nn2)cc1	ZINC000450996965	GF	On-Demand	Anodyne	CA2	17	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nn2)cc1	ZINC000450996965	GF	On-Demand	Anodyne	CA1	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nn2)cc1	ZINC000450996965	GF	On-Demand	Anodyne	TRPV1	53	32
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nn2)cc1	ZINC000450996965	GF	On-Demand	Anodyne	CA4	23	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nn2)cc1	ZINC000450996965	GF	On-Demand	Anodyne	IDO1	30	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nn2)cc1	ZINC000450996965	GF	On-Demand	Anodyne	PFK	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nn2)cc1	ZINC000450996965	GF	On-Demand	Anodyne	AADAC	0	44
CO[C@H](Cc1ccccc1)CN1CC[C@@H](COC(F)F)C1	ZINC000450996966	CF	On-Demand	Anodyne	SLC6A3	18	41
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	HTR1A	49	56
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	DRD2	65	62
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	DRD4	61	53
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	ADRA1D	28	45
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	HTR2A	34	45
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	HTR2C	27	40
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	ADRA1A	22	45
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	ADRA1B	22	45
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	DRD3	59	53
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	SIGMAR1	28	45
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	NR1H2	15	40
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	NOX4	50	42
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	NOX1	77	42
CS(=O)(=O)c1cccc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450996967	GG	On-Demand	Anodyne	NOX5	74	42
COCc1ccc(CNC(=O)CN2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450996968	GF	On-Demand	Anodyne	SLC6A1	48	38
CO[C@H](Cc1ccccc1)CN1CC[C@H](COC(F)F)C1	ZINC000450996969	CF	On-Demand	Anodyne	SLC6A3	18	41
COc1cc(NC(=O)CSC2CCC2)c(OC)cc1Cl	ZINC000450996971	DH	On-Demand	Anodyne	HTR4	57	41
COc1cc(NC(=O)CSC2CCC2)c(OC)cc1Cl	ZINC000450996971	DH	On-Demand	Anodyne	QRFPR	47	41
COCc1ccc(CNC(=O)CN2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450996972	GF	On-Demand	Anodyne	SLC6A1	48	38
CCCNC(=O)c1ccc(NS(=O)(=O)c2cc(C)cs2)cc1Cl	ZINC000450996973	FH	On-Demand	Anodyne	SLC6A9	43	35
COc1ccc(CN(C2CC2)S(=O)(=O)c2ccc(CC#N)cc2Cl)cc1	ZINC000450996980	GH	On-Demand	Mild	AVPR1B	24	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	ACE	22	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	SSTR2	81	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	OPRM1	0	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	OPRD1	23	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	GHRHR	33	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MME	28	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	EDNRB	54	38
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	EDNRA	48	49
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	TACR1	40	50
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MC4R	49	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	BMP1	30	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	TACR2	55	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	CCKAR	110	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	CTSL	30	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	BRS3	26	51
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	TIMP3	26	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	NMBR	61	33
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MC3R	62	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MC5R	74	34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MMP2	24	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MMP8	37	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MMP14	24	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	GRPR	85	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	ECE1	64	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	SSTR3	53	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MMP11	75	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	CCKBR	90	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	GHSR	82	47
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MMP9	26	46
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MC1R	83	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	ADAM9	42	43
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MMP7	33	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	MMP1	0	44
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	SSSIM	27	41
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	SLC15A2	0	53
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	KISS1R	65	36
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	ERAP2	45	39
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	LASB	0	48
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	PSMB9	0	40
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450996998	EF	On-Demand	Anodyne	NRDE	0	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	ACE	22	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	SSTR2	81	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	OPRM1	0	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	OPRD1	23	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	GHRHR	33	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MME	28	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	EDNRB	54	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	EDNRA	48	49
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	TACR1	40	50
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MC4R	49	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	BMP1	30	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	TACR2	55	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	CCKAR	110	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	CTSL	30	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	BRS3	26	51
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	TIMP3	26	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	NMBR	61	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MC3R	62	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MC5R	74	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MMP2	24	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MMP8	37	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MMP14	24	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	GRPR	85	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	ECE1	64	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	SSTR3	53	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MMP11	75	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	CCKBR	90	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	GHSR	82	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MMP9	26	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MC1R	83	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	ADAM9	42	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MMP7	33	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	MMP1	0	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	NPR	33	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	SSSIM	27	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	SLC15A2	0	53
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	KISS1R	65	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	ERAP2	45	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	ERAP1	0	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	LASB	0	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	PSMB9	0	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CSC1CCC1	ZINC000450997001	EF	On-Demand	Anodyne	NRDE	0	41
CC(C)CN(C(=O)CCCC(=O)C(C)(C)C)[C@@H]1CCCc2cccnc21	ZINC000450997004	FJ	On-Demand	Anodyne	CXCR4	78	41
CC(C)CN(C(=O)CCCC(=O)C(C)(C)C)[C@H]1CCCc2cccnc21	ZINC000450997006	FJ	On-Demand	Anodyne	CXCR4	78	41
CCOC(=O)c1ccc(CS(=O)(=O)NCCN(C(C)C)C(C)C)cc1	ZINC000450997010	FE	On-Demand	Anodyne	TMPRSS11D	41	34
O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@H](O)C1CCC1	ZINC000450997014	EE	On-Demand	Anodyne	NAMPT	18	41
O=C(Nc1ccc2c(c1)CCC(=O)N2CC1CC1)[C@@H](O)C1CCC1	ZINC000450997017	EE	On-Demand	Anodyne	NAMPT	18	41
CCCN(C(=O)c1cccc(C(F)(F)F)n1)[C@H]1CCCc2cccnc21	ZINC000450997020	FI	On-Demand	Anodyne	CXCR4	79	45
CCCN(C(=O)c1cccc(C(F)(F)F)n1)[C@@H]1CCCc2cccnc21	ZINC000450997024	FI	On-Demand	Anodyne	CXCR4	79	45
CCOC1CC2(CCN(Cc3ccc(Cl)c(OC)c3)C2)C1	ZINC000450997031	DH	On-Demand	Anodyne	SSTR5	51	38
COc1ccccc1[C@@H](C)NC(=O)CSC1CCC1	ZINC000450997033	CG	On-Demand	Anodyne	HCN1	41	35
COc1ccccc1[C@H](C)NC(=O)CSC1CCC1	ZINC000450997034	CG	On-Demand	Anodyne	HCN1	41	35
O=C(NC1CCCCC1)c1ccc(NS(=O)(=O)c2sccc2Cl)cc1	ZINC000450997036	GI	On-Demand	Anodyne	EPHX2	15	41
CO[C@@H](CS(=O)(=O)N(C)c1cccc(C)c1)c1ccccc1	ZINC000450997037	DG	On-Demand	Anodyne	AOC3	20	47
CO[C@H](CS(=O)(=O)N(C)c1cccc(C)c1)c1ccccc1	ZINC000450997038	DG	On-Demand	Anodyne	AOC3	20	47
CN(C)C1(CNC(=O)[C@H]2CCN(c3ccccc3)C2)CCC1	ZINC000450997041	DE	On-Demand	Anodyne	CACNA1G	23	42
CN(C)C1(CNC(=O)[C@@H]2CCN(c3ccccc3)C2)CCC1	ZINC000450997042	DE	On-Demand	Anodyne	CACNA1G	23	42
CCCN(C(=O)c1ccc(-c2ccncc2)c(F)c1)[C@@H]1CCCc2cccnc21	ZINC000450997043	GK	On-Demand	Anodyne	CXCR4	77	40
CCC[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450997055	CH	On-Demand	Anodyne	CCR5	32	41
CCC[C@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450997055	CH	On-Demand	Anodyne	PROTEASE	0	48
CCCN(C(=O)c1ccc(-c2ccncc2)c(F)c1)[C@H]1CCCc2cccnc21	ZINC000450997057	GK	On-Demand	Anodyne	CXCR4	77	40
CCCN1CCC(NS(=O)(=O)c2cccnc2C(=O)OC)CC1	ZINC000450997074	ED	On-Demand	Anodyne	CCR8	81	40
CCCN1CCC(NS(=O)(=O)c2cccnc2C(=O)OC)CC1	ZINC000450997074	ED	On-Demand	Anodyne	SFRP1	96	42
CCCN1CCC(NS(=O)(=O)c2cccnc2C(=O)OC)CC1	ZINC000450997074	ED	On-Demand	Anodyne	WNT3	71	35
COC(=O)c1ccccc1NC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450997076	GF	On-Demand	Anodyne	SLC6A1	40	37
COC(=O)c1ccccc1NC(=O)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450997076	GF	On-Demand	Anodyne	FAS	20	43
COC(=O)c1ccccc1NC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450997077	GF	On-Demand	Anodyne	SLC6A1	40	37
COC(=O)c1ccccc1NC(=O)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450997077	GF	On-Demand	Anodyne	FAS	20	43
CCCN(C(=O)Cc1ccccc1O[C@H]1CCOC1)[C@@H]1CCCc2cccnc21	ZINC000450997083	GI	On-Demand	Anodyne	CXCR4	75	39
CCCN(C(=O)Cc1ccccc1O[C@@H]1CCOC1)[C@@H]1CCCc2cccnc21	ZINC000450997084	GI	On-Demand	Anodyne	CXCR4	75	39
CCCN(C(=O)Cc1ccccc1O[C@@H]1CCOC1)[C@H]1CCCc2cccnc21	ZINC000450997085	GI	On-Demand	Anodyne	CXCR4	75	39
CCCN(C(=O)Cc1ccccc1O[C@H]1CCOC1)[C@H]1CCCc2cccnc21	ZINC000450997086	GI	On-Demand	Anodyne	CXCR4	75	39
COc1ccc(OC)c([C@@H](C)NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450997089	FH	On-Demand	Anodyne	CASR	0	41
COc1ccc(OC)c([C@@H](C)NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450997089	FH	On-Demand	Anodyne	MMP7	23	44
COc1ccc(OC)c([C@H](C)NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450997090	FH	On-Demand	Anodyne	CASR	0	41
COc1ccc(OC)c([C@H](C)NS(=O)(=O)c2ccc(C3CC3)cc2)c1	ZINC000450997090	FH	On-Demand	Anodyne	MMP7	23	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	CA2	27	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	CA1	33	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	KCNA5	0	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	CA7	15	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	MMP13	41	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	COLA	92	39
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	CA14	15	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	MMP2	40	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	MMP9	25	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	MMP12	48	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	CA12	22	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	ADAMTS4	46	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	CA9	24	51
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	LIMK2	43	37
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1	ZINC000450997108	GF	On-Demand	Anodyne	P96878_MYCTU	47	37
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	HTR1A	68	49
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	DRD2	60	50
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	DRD1	34	47
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	DRD4	27	40
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	ADRA1D	26	45
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	HTR2A	40	40
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	SLC6A1	42	37
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	ADRA1A	36	45
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	ADRA1B	26	49
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	DRD3	61	47
Clc1ccccc1N1CCCN(CCOCC2CC2)CC1	ZINC000450997112	DG	On-Demand	Anodyne	HTR7	51	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC(=O)NCC(F)(F)F	ZINC000450997123	GE	On-Demand	Anodyne	HTR1A	24	41
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC(=O)NCC(F)(F)F	ZINC000450997123	GE	On-Demand	Anodyne	DRD2	40	48
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC(=O)NCC(F)(F)F	ZINC000450997123	GE	On-Demand	Anodyne	DRD4	35	48
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC(=O)NCC(F)(F)F	ZINC000450997123	GE	On-Demand	Anodyne	DRD3	66	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)NC(=O)NCC(F)(F)F	ZINC000450997123	GE	On-Demand	Anodyne	KCNQ2	64	41
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450997138	FG	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450997139	FG	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450997140	FG	On-Demand	Anodyne	PREP	15	41
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)c1ccc(-c2ccncc2)c(F)c1	ZINC000450997141	FG	On-Demand	Anodyne	PREP	15	41
COc1ccc(-c2nnc(CN3CCCN(c4ccccc4Cl)CC3)o2)cc1	ZINC000450997142	GI	On-Demand	Anodyne	HTR1A	40	40
COc1ccc(-c2nnc(CN3CCCN(c4ccccc4Cl)CC3)o2)cc1	ZINC000450997142	GI	On-Demand	Anodyne	DRD2	45	42
COc1ccc(-c2nnc(CN3CCCN(c4ccccc4Cl)CC3)o2)cc1	ZINC000450997142	GI	On-Demand	Anodyne	DRD1	24	41
COc1ccc(-c2nnc(CN3CCCN(c4ccccc4Cl)CC3)o2)cc1	ZINC000450997142	GI	On-Demand	Anodyne	DRD4	40	42
COc1ccc(-c2nnc(CN3CCCN(c4ccccc4Cl)CC3)o2)cc1	ZINC000450997142	GI	On-Demand	Anodyne	DRD3	51	42
COc1ccc(-c2nnc(CN3CCCN(c4ccccc4Cl)CC3)o2)cc1	ZINC000450997142	GI	On-Demand	Anodyne	HTR7	25	44
Cc1cnc(CN2CCCN(c3ccccc3Cl)CC2)cn1	ZINC000450997156	DG	On-Demand	Anodyne	HTR1A	27	43
Cc1cnc(CN2CCCN(c3ccccc3Cl)CC2)cn1	ZINC000450997156	DG	On-Demand	Anodyne	DRD2	38	43
Cc1cnc(CN2CCCN(c3ccccc3Cl)CC2)cn1	ZINC000450997156	DG	On-Demand	Anodyne	DRD3	38	42
Cc1cnc(CN2CCCN(c3ccccc3Cl)CC2)cn1	ZINC000450997156	DG	On-Demand	Anodyne	NOX1	55	38
Cc1cnc(CN2CCCN(c3ccccc3Cl)CC2)cn1	ZINC000450997156	DG	On-Demand	Anodyne	NOX5	47	38
COCC1(S(=O)(=O)NCCNc2ccccc2[N+](=O)[O-])CC1	ZINC000450997172	ED	On-Demand	Bother	COLA	46	31
COc1ccc(C(=O)NCc2ccccc2N(C)C(C)C)cc1S(C)(=O)=O	ZINC000450997174	GF	On-Demand	Anodyne	CYSLTR1	47	33
COc1ccc(C(=O)NCc2ccccc2N(C)C(C)C)cc1S(C)(=O)=O	ZINC000450997174	GF	On-Demand	Anodyne	COLA	46	35
COc1ccc(C(=O)NCc2ccccc2N(C)C(C)C)cc1S(C)(=O)=O	ZINC000450997174	GF	On-Demand	Anodyne	CPT1A	46	32
COc1ccc(C(=O)NCc2ccccc2N(C)C(C)C)cc1S(C)(=O)=O	ZINC000450997174	GF	On-Demand	Anodyne	PPARD	18	40
COc1ccc(C(=O)NCc2ccccc2N(C)C(C)C)cc1S(C)(=O)=O	ZINC000450997174	GF	On-Demand	Anodyne	CPT1B	47	32
COc1ccc(C(=O)NCc2ccccc2N(C)C(C)C)cc1S(C)(=O)=O	ZINC000450997174	GF	On-Demand	Anodyne	MT-ND1	18	41
COc1cc(C(=O)NCc2ccccc2N(C)C(C)C)c([N+](=O)[O-])cc1F	ZINC000450997178	GH	On-Demand	Bother	COLA	113	36
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	HTR1A	106	47
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	DRD2	99	47
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	DRD1	46	42
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	DRD4	69	46
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	ADRA1D	62	46
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	HTR1B	26	41
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	HTR2A	69	48
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	HTR2C	46	44
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	SLC6A1	52	35
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	SLC6A4	30	45
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	ADRA1A	52	44
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	ADRA1B	46	49
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	DRD3	93	43
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	OPRL1	0	42
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	HTR7	98	43
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	KCNQ2	77	39
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	NOX1	53	34
CCOC(=O)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997179	DF	On-Demand	Anodyne	NOX5	51	34
C=CCNC(=O)NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997185	FE	On-Demand	Mild	KCNQ2	71	39
C=CCNC(=O)NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997186	FE	On-Demand	Mild	KCNQ2	71	39
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450997191	FE	On-Demand	Anodyne	PDE4D	15	40
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450997192	FE	On-Demand	Anodyne	PDE4D	15	40
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)Cc1ccccc1O[C@@H]1CCOC1	ZINC000450997193	FE	On-Demand	Anodyne	PDE4D	15	40
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)Cc1ccccc1O[C@H]1CCOC1	ZINC000450997194	FE	On-Demand	Anodyne	PDE4D	15	40
COc1cc(CC(=O)Nc2ccc3nnc(C(C)C)n3c2)ccc1Cl	ZINC000450997199	FH	On-Demand	Anodyne	OPRK1	0	41
COc1cc(CC(=O)Nc2ccc3nnc(C(C)C)n3c2)ccc1Cl	ZINC000450997199	FH	On-Demand	Anodyne	PFK	0	41
COc1cc(CC(=O)Nc2ccc3nnc(C(C)C)n3c2)ccc1Cl	ZINC000450997199	FH	On-Demand	Anodyne	ENPP1	53	32
COc1cc(CC(=O)Nc2ccc3nnc(C(C)C)n3c2)ccc1Cl	ZINC000450997199	FH	On-Demand	Anodyne	DGAT1	0	43
CC(C)(C)c1n[nH]c(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997203	EG	On-Demand	Anodyne	DRD1	0	41
CC(C)(C)c1n[nH]c(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997203	EG	On-Demand	Anodyne	NOX1	52	32
CC(C)(C)c1n[nH]c(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997203	EG	On-Demand	Anodyne	NOX5	49	32
Cc1ccc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997204	EG	On-Demand	Anodyne	P96878_MYCTU	42	39
Cc1ccc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997204	EG	On-Demand	Anodyne	PSBA	0	43
COC(=O)c1ncccc1S(=O)(=O)Nc1cccc([C@@H](C)OC)c1	ZINC000450997206	FE	On-Demand	Anodyne	POL	21	41
COC(=O)c1ncccc1S(=O)(=O)Nc1cccc([C@H](C)OC)c1	ZINC000450997207	FE	On-Demand	Anodyne	POL	21	41
O=C(COc1ccc(S(=O)(=O)Nc2cccc(C(F)F)c2)cc1)NC1CC1	ZINC000450997233	GG	On-Demand	Anodyne	POL	0	44
O=C(COc1ccc(S(=O)(=O)Nc2cccc(C(F)F)c2)cc1)NC1CC1	ZINC000450997233	GG	On-Demand	Anodyne	GPR119	0	42
O=C(COc1ccc(S(=O)(=O)Nc2cccc(C(F)F)c2)cc1)NC1CC1	ZINC000450997233	GG	On-Demand	Anodyne	LUXN	0	44
O=C(COc1ccc(S(=O)(=O)Nc2cccc(C(F)F)c2)cc1)NC1CC1	ZINC000450997233	GG	On-Demand	Anodyne	ADIPOR1	0	40
O=C(COc1ccc(S(=O)(=O)Nc2cccc(C(F)F)c2)cc1)NC1CC1	ZINC000450997233	GG	On-Demand	Anodyne	ADIPOR2	0	40
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	HTR1A	49	48
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	DRD2	50	48
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	DRD1	0	41
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	ADRA1D	39	42
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	HTR2A	28	46
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	ADRA1B	25	46
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	DRD3	50	42
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	KCNQ2	49	35
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	NOX1	58	35
CO[C@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997234	CF	On-Demand	Anodyne	NOX5	56	35
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	HTR1A	49	48
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	DRD2	50	48
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	DRD1	0	41
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	ADRA1D	39	42
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	HTR2A	28	46
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	ADRA1B	25	46
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	DRD3	50	42
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	KCNQ2	49	35
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	NOX1	58	35
CO[C@@H](C)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997235	CF	On-Demand	Anodyne	NOX5	56	35
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	HTR1A	47	53
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	DRD2	63	57
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	DRD1	23	40
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	DRD4	72	57
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	ADRA1D	24	50
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	HTR2A	22	51
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	HTR2C	16	40
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	ADRA1A	20	50
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	ADRA1B	17	50
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	DRD3	60	57
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	HTR7	23	42
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	KCNQ2	64	41
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	HRH3	19	44
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	SIGMAR1	39	51
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	NOX4	48	40
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	NOX1	69	40
OCc1ccc(CN2CCCN(c3ccccc3Cl)CC2)cc1	ZINC000450997236	EH	On-Demand	Anodyne	NOX5	66	40
Cc1nccc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997243	DG	On-Demand	Anodyne	HTR1A	26	42
Cc1nccc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997243	DG	On-Demand	Anodyne	DRD4	50	43
Cc1nccc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997243	DG	On-Demand	Anodyne	DRD3	40	45
Cc1nccc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997243	DG	On-Demand	Anodyne	NOX4	45	39
Cc1nccc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997243	DG	On-Demand	Anodyne	NOX1	59	39
Cc1nccc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997243	DG	On-Demand	Anodyne	NOX5	52	39
Cc1cccc(N(C)S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)n1	ZINC000450997244	EF	On-Demand	Anodyne	PFK	0	42
CCN1CCN(c2cccc(NS(=O)(=O)c3sccc3Cl)c2)CC1	ZINC000450997245	GG	On-Demand	Anodyne	HTR1A	18	53
CCN1CCN(c2cccc(NS(=O)(=O)c3sccc3Cl)c2)CC1	ZINC000450997245	GG	On-Demand	Anodyne	HTR7	19	40
CCCOc1cccc(CNC(=O)Cn2cnc3c2C[C@H](C)[C@H](C)C3)c1	ZINC000450997246	FG	On-Demand	Anodyne	PDS	41	33
CCCOc1cccc(CNC(=O)Cn2cnc3c2C[C@H](C)[C@@H](C)C3)c1	ZINC000450997247	FG	On-Demand	Anodyne	PDS	41	33
CCCOc1cccc(CNC(=O)Cn2cnc3c2C[C@@H](C)[C@H](C)C3)c1	ZINC000450997248	FG	On-Demand	Anodyne	PDS	41	33
CCCOc1cccc(CNC(=O)Cn2cnc3c2C[C@@H](C)[C@@H](C)C3)c1	ZINC000450997249	FG	On-Demand	Anodyne	PDS	41	33
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450997250	DE	On-Demand	Anodyne	P2RX3	31	43
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450997250	DE	On-Demand	Anodyne	PLD1	50	39
C[C@@H](CN1CCCCCC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450997250	DE	On-Demand	Anodyne	HPGDS	24	50
C[C@H](CN1CCCCCC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450997251	DE	On-Demand	Anodyne	P2RX3	31	43
C[C@H](CN1CCCCCC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450997251	DE	On-Demand	Anodyne	PLD1	50	39
C[C@H](CN1CCCCCC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450997251	DE	On-Demand	Anodyne	HPGDS	24	50
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	HTR1A	122	51
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	DRD2	107	52
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	DRD1	50	48
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	DRD4	51	49
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	ADRA1D	61	49
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	HTR2A	80	52
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	HTR2C	50	45
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	SLC6A4	28	52
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	ADRA1A	52	49
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	ADRA1B	44	51
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	DRD3	95	47
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	HTR7	118	45
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	KCNQ2	65	38
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	HTR6	29	44
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	HNMT	40	33
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	NOX4	42	32
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	NOX1	57	32
CCS(=O)(=O)CCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997273	FG	On-Demand	Anodyne	NOX5	54	32
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N[C@H](C#N)C(C)C)cc1	ZINC000450997281	FD	On-Demand	Mild	MMP13	15	40
O[C@H](COc1c(Cl)cccc1Cl)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997282	GI	On-Demand	Anodyne	ABCB1	33	40
O[C@H](COc1c(Cl)cccc1Cl)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997283	GI	On-Demand	Anodyne	ABCB1	33	40
O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997284	GI	On-Demand	Anodyne	ABCB1	33	40
O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997285	GI	On-Demand	Anodyne	ABCB1	33	40
CC(C)[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997286	CF	On-Demand	Anodyne	HTR1A	28	40
CC(C)[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997286	CF	On-Demand	Anodyne	DRD2	37	46
CC(C)[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997286	CF	On-Demand	Anodyne	ADRA1D	27	42
CC(C)[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997286	CF	On-Demand	Anodyne	DRD3	46	42
CC(C)[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997286	CF	On-Demand	Anodyne	KCNQ2	66	38
CC(C)[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997286	CF	On-Demand	Anodyne	HSP90AB1	36	41
CC(C)[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997286	CF	On-Demand	Anodyne	NOX1	53	32
CC(C)[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997286	CF	On-Demand	Anodyne	NOX5	50	32
CC(C)[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997287	CF	On-Demand	Anodyne	HTR1A	28	40
CC(C)[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997287	CF	On-Demand	Anodyne	DRD2	37	46
CC(C)[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997287	CF	On-Demand	Anodyne	ADRA1D	27	42
CC(C)[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997287	CF	On-Demand	Anodyne	DRD3	46	42
CC(C)[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997287	CF	On-Demand	Anodyne	KCNQ2	66	38
CC(C)[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997287	CF	On-Demand	Anodyne	HSP90AB1	36	41
CC(C)[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997287	CF	On-Demand	Anodyne	NOX1	53	32
CC(C)[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450997287	CF	On-Demand	Anodyne	NOX5	50	32
FC(F)(F)Cn1ccc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450997289	FH	On-Demand	Anodyne	DRD4	23	41
CN(Cc1ccccc1N1CCCC1)S(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450997294	GH	On-Demand	Anodyne	KCNQ2	70	34
CN(Cc1ccccc1N1CCCC1)S(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450997295	GH	On-Demand	Anodyne	KCNQ2	70	34
Cc1ccc(OC[C@@H](O)CN2CCC[C@H](c3ccncc3)C2)c(C)c1	ZINC000450997296	EG	On-Demand	Anodyne	ADRB2	25	48
Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)c(C)c1	ZINC000450997297	EG	On-Demand	Anodyne	ADRB2	25	48
Cc1ccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)c(C)c1	ZINC000450997298	EG	On-Demand	Anodyne	ADRB2	25	48
Cc1ccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)c(C)c1	ZINC000450997299	EG	On-Demand	Anodyne	ADRB2	25	48
CCC[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450997303	CH	On-Demand	Anodyne	CCR5	32	41
CCC[C@@H](NC(=O)CSC1CCC1)c1ccccc1	ZINC000450997303	CH	On-Demand	Anodyne	PROTEASE	0	48
COc1cc(CCNC(=O)CSC2CCC2)ccc1OC(F)F	ZINC000450997304	EG	On-Demand	Anodyne	QRFPR	42	34
O=C(CCCN1CCN(CC(F)(F)F)C(=O)C1)c1ccc(F)cc1	ZINC000450997314	EE	On-Demand	Anodyne	DRD2	34	46
O=C(CCCN1CCN(CC(F)(F)F)C(=O)C1)c1ccc(F)cc1	ZINC000450997314	EE	On-Demand	Anodyne	ERG2	22	46
O=C(CCCN1CCN(CC(F)(F)F)C(=O)C1)c1ccc(F)cc1	ZINC000450997314	EE	On-Demand	Anodyne	CYP2J2	51	36
CCN(Cc1ccc(OC)c(OC)c1)C(=O)CSC1CCC1	ZINC000450997315	DG	On-Demand	Anodyne	QRFPR	42	34
C[C@@H](SC1CCC1)c1nc(-c2cccs2)no1	ZINC000450997316	CI	On-Demand	Anodyne	ETHR	26	42
C[C@H](SC1CCC1)c1nc(-c2cccs2)no1	ZINC000450997317	CI	On-Demand	Anodyne	ETHR	26	42
O=C(CSC1CCC1)N1CCN(c2ccccc2F)CC1	ZINC000450997318	DF	On-Demand	Anodyne	SSTR1	21	41
Cc1cccc(Cl)c1C(=O)NCc1nc(N(C)C)no1	ZINC000450997320	CE	On-Demand	Anodyne	P2RX7	15	44
COc1ccccc1O[C@H]1CCCN(CCc2cscn2)C1	ZINC000450997321	DG	On-Demand	Anodyne	SCN5A	41	35
COc1ccccc1O[C@@H]1CCCN(CCc2cscn2)C1	ZINC000450997322	DG	On-Demand	Anodyne	SCN5A	41	35
COc1ccccc1O[C@H]1CCCN(C[C@H](C)S(C)(=O)=O)C1	ZINC000450997325	ED	On-Demand	Anodyne	PDE4B	18	42
COc1ccccc1O[C@H]1CCCN(C[C@@H](C)S(C)(=O)=O)C1	ZINC000450997326	ED	On-Demand	Anodyne	PDE4B	18	42
COc1ccccc1O[C@@H]1CCCN(C[C@H](C)S(C)(=O)=O)C1	ZINC000450997327	ED	On-Demand	Anodyne	PDE4B	18	42
COc1ccccc1O[C@@H]1CCCN(C[C@@H](C)S(C)(=O)=O)C1	ZINC000450997328	ED	On-Demand	Anodyne	PDE4B	18	42
CCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1cc(C)cs1	ZINC000450997329	FG	On-Demand	Anodyne	PRTN3	46	33
O=[N+]([O-])c1cccc(OCCSC2CCC2)c1	ZINC000450997342	CG	On-Demand	Bother	ATSA	0	42
COC(=O)c1cccc(CN2CC[C@H](COC(F)F)C2)c1Cl	ZINC000450997353	EG	On-Demand	Anodyne	SIGMAR1	20	41
COC(=O)c1cccc(CN2CC[C@H](COC(F)F)C2)c1Cl	ZINC000450997353	EG	On-Demand	Anodyne	CACNA1I	41	34
COC(=O)c1cccc(CN2CC[C@@H](COC(F)F)C2)c1Cl	ZINC000450997354	EG	On-Demand	Anodyne	SIGMAR1	20	41
COC(=O)c1cccc(CN2CC[C@@H](COC(F)F)C2)c1Cl	ZINC000450997354	EG	On-Demand	Anodyne	CACNA1I	41	34
COCCOC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997358	ED	On-Demand	Anodyne	HTR1A	27	42
COCCOC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997358	ED	On-Demand	Anodyne	DRD2	33	43
COCCOC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997358	ED	On-Demand	Anodyne	DRD1	22	42
COCCOC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997358	ED	On-Demand	Anodyne	ADRA1D	24	45
COCCOC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997358	ED	On-Demand	Anodyne	DRD3	43	43
COCCOC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997358	ED	On-Demand	Anodyne	ABCB1	61	44
COCCOC[C@@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997358	ED	On-Demand	Anodyne	HSP90AB1	53	57
COCCOC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997359	ED	On-Demand	Anodyne	HTR1A	27	42
COCCOC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997359	ED	On-Demand	Anodyne	DRD2	33	43
COCCOC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997359	ED	On-Demand	Anodyne	DRD1	22	42
COCCOC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997359	ED	On-Demand	Anodyne	ADRA1D	24	45
COCCOC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997359	ED	On-Demand	Anodyne	DRD3	43	43
COCCOC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997359	ED	On-Demand	Anodyne	ABCB1	61	44
COCCOC[C@H](O)CN1CCCN(c2ccccc2F)CC1	ZINC000450997359	ED	On-Demand	Anodyne	HSP90AB1	53	57
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	DRD2	24	44
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	DRD4	55	38
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	ACHE	37	41
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	DRD3	26	48
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	LTA4H	25	40
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	VACHT_TETCF	0	45
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	SIGMAR1	74	49
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	CCR3	24	44
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	FAAH	0	50
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	MGLL	0	51
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	ABHD6	0	42
O=C(CSC1CCC1)N1CCN(Cc2ccccc2)CC1	ZINC000450997362	DF	On-Demand	Anodyne	NPFFR1	48	35
Cc1ccc([N+](=O)[O-])c(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997363	GH	On-Demand	Bother	COLA	104	39
Cc1ccc([N+](=O)[O-])c(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997363	GH	On-Demand	Bother	AADAC	0	48
N#Cc1ccc(OC2CCN(CCc3cscn3)CC2)c(F)c1	ZINC000450997365	EG	On-Demand	Mild	SCN5A	47	39
Cc1ccc(CNC(=O)CSC2CCC2)cc1F	ZINC000450997366	CG	On-Demand	Anodyne	TRPV1	16	41
Cc1cccc(OCCNC(=O)CSC2CCC2)c1	ZINC000450997367	CF	On-Demand	Anodyne	HRH2	39	40
CN(C(=O)c1ccc(NS(=O)(=O)c2sccc2F)cc1)C1CCCCC1	ZINC000450997372	GI	On-Demand	Anodyne	LIMK2	40	40
CC(C)[C@H](SC1CCC1)C(=O)N1CCc2ccccc2C1	ZINC000450997373	DH	On-Demand	Anodyne	DPP8	23	42
CC(C)[C@@H](SC1CCC1)C(=O)N1CCc2ccccc2C1	ZINC000450997374	DH	On-Demand	Anodyne	DPP8	23	42
COCCOC[C@@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450997375	GF	On-Demand	Anodyne	MC4R	23	40
COCCOC[C@@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450997375	GF	On-Demand	Anodyne	ABCB1	47	38
COCCOC[C@@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450997375	GF	On-Demand	Anodyne	HSP90AB1	46	48
COCCOC[C@@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450997375	GF	On-Demand	Anodyne	LIPG	34	43
COCCOC[C@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450997376	GF	On-Demand	Anodyne	MC4R	23	40
COCCOC[C@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450997376	GF	On-Demand	Anodyne	ABCB1	47	38
COCCOC[C@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450997376	GF	On-Demand	Anodyne	HSP90AB1	46	48
COCCOC[C@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000450997376	GF	On-Demand	Anodyne	LIPG	34	43
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	HTR1A	63	44
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	DRD2	56	49
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	ADRA1D	56	49
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	HTR2A	25	40
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	ADRA1A	48	49
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	ADRA1B	39	49
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	DRD3	63	41
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	HTR7	40	44
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	KCNQ2	93	47
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	NPY2R	38	40
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	KCNQ4	0	43
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	RBP4	28	51
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	PDE9A	0	45
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	BRD1	0	41
COc1ccccc1NC(=O)[C@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997382	GH	On-Demand	Anodyne	BRPF1	0	42
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	HTR1A	63	44
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	DRD2	56	49
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	ADRA1D	56	49
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	HTR2A	25	40
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	ADRA1A	48	49
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	ADRA1B	39	49
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	DRD3	63	41
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	HTR7	40	44
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	KCNQ2	93	47
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	NPY2R	38	40
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	KCNQ4	0	43
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	RBP4	28	51
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	PDE9A	0	45
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	BRD1	0	41
COc1ccccc1NC(=O)[C@@H](C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450997383	GH	On-Demand	Anodyne	BRPF1	0	42
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	PLG	44	31
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	GRIN2B	26	40
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	P2RX7	29	40
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	EPHX2	58	65
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	TGM2	46	43
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	CYP2C9	24	42
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	F13A1	42	34
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	NAMPT	151	46
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450997384	FE	On-Demand	Anodyne	TMPRSS11D	51	33
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450997385	EG	On-Demand	Anodyne	PREP	18	40
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450997387	EG	On-Demand	Anodyne	PREP	18	40
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000450997389	EG	On-Demand	Anodyne	PREP	18	40
CCOc1ccc(NS(=O)(=O)c2cccnc2C(=O)OC)cc1CO	ZINC000450997400	FD	On-Demand	Anodyne	ALPL	29	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)c2ccccn2)cc1	ZINC000450997420	EF	On-Demand	Anodyne	COLA	49	38
CC(C)C(=O)Nc1ccc(S(=O)(=O)N(C)c2ccccn2)cc1	ZINC000450997420	EF	On-Demand	Anodyne	GRM4	31	45
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	HTR1A	54	54
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	DRD2	54	54
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	DRD1	22	42
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	DRD4	39	48
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	ADRA1D	27	48
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	HTR1B	0	47
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	ADRA1A	31	45
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	ADRA1B	24	54
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	DRD3	51	53
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	HTR7	22	42
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	KCNQ2	71	40
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	SIGMAR1	19	54
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	NOX4	43	34
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	NOX1	59	34
CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997438	BF	On-Demand	Anodyne	NOX5	56	34
CC(C)CN(C(=O)[C@@H]1CC1(F)F)[C@H]1CCCc2cccnc21	ZINC000450997445	DH	On-Demand	Anodyne	CXCR4	79	41
CC(C)CN(C(=O)[C@H]1CC1(F)F)[C@H]1CCCc2cccnc21	ZINC000450997446	DH	On-Demand	Anodyne	CXCR4	79	41
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC4CC4)CC3)ccc2c1	ZINC000450997447	GD	On-Demand	Anodyne	TRY2_BOVIN	19	40
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC4CC4)CC3)ccc2c1	ZINC000450997447	GD	On-Demand	Anodyne	NPY2R	30	41
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC4CC4)CC3)ccc2c1	ZINC000450997447	GD	On-Demand	Anodyne	CCR4	0	41
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC4CC4)CC3)ccc2c1	ZINC000450997447	GD	On-Demand	Anodyne	NPY5R	15	41
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC4CC4)CC3)ccc2c1	ZINC000450997447	GD	On-Demand	Anodyne	EPHX2	36	48
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC4CC4)CC3)ccc2c1	ZINC000450997447	GD	On-Demand	Anodyne	TGM2	56	37
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC4CC4)CC3)ccc2c1	ZINC000450997447	GD	On-Demand	Anodyne	F13A1	47	35
Cc1ccc2cc(S(=O)(=O)N3CCN(CC(=O)NC4CC4)CC3)ccc2c1	ZINC000450997447	GD	On-Demand	Anodyne	AKR1C3	0	40
CC(C)CN(C(=O)[C@@H]1CC1(F)F)[C@@H]1CCCc2cccnc21	ZINC000450997448	DH	On-Demand	Anodyne	CXCR4	79	41
CC(C)CN(C(=O)[C@H]1CC1(F)F)[C@@H]1CCCc2cccnc21	ZINC000450997449	DH	On-Demand	Anodyne	CXCR4	79	41
CCCN(C(=O)[C@@H]1OCC[C@@H]1C)[C@H]1CCCc2cccnc21	ZINC000450997450	DG	On-Demand	Anodyne	CXCR4	79	41
CCCN(C(=O)[C@@H]1OCC[C@@H]1C)[C@@H]1CCCc2cccnc21	ZINC000450997451	DG	On-Demand	Anodyne	CXCR4	79	41
Cc1ccn2ncc(C(=O)N3CCCCC(C)(C)C3)c2c1	ZINC000450997478	CG	On-Demand	Anodyne	EPHB3	32	46
COc1cc([N+](=O)[O-])ccc1Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450997495	DG	On-Demand	Bother	SLC29A1	22	40
COc1cc([N+](=O)[O-])ccc1Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450997497	DG	On-Demand	Bother	SLC29A1	22	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	CA2	23	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	CA1	27	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	CA7	17	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	MMP13	28	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	CA4	21	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	CA14	18	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	CA12	18	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	ADAMTS4	33	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	CA9	21	50
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	LIMK2	40	36
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	MTCA1	30	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000450997498	GF	On-Demand	Anodyne	P96878_MYCTU	40	36
COc1cc([N+](=O)[O-])ccc1Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450997500	DG	On-Demand	Bother	SLC29A1	22	40
Cc1noc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997501	EF	On-Demand	Anodyne	PPIA	28	42
Cc1noc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997501	EF	On-Demand	Anodyne	EDNRA	26	43
Cc1noc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997501	EF	On-Demand	Anodyne	PFK	0	44
COc1cc([N+](=O)[O-])ccc1Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450997503	DG	On-Demand	Bother	SLC29A1	22	40
CCCN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCc2cccnc21	ZINC000450997504	GI	On-Demand	Bother	CXCR4	71	36
CCCN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCc2cccnc21	ZINC000450997507	GI	On-Demand	Bother	CXCR4	71	36
CN(C)C1(CNC(=O)COc2ccc(C#N)c(Br)c2)CCC1	ZINC000450997516	FE	On-Demand	Mild	TRPV4	40	31
CCCOc1ccc(C(=O)NCC2(N(C)C)CCC2)c(OC)c1	ZINC000450997522	DF	On-Demand	Anodyne	KCNA3	40	41
CCCOc1ccc(C(=O)NCC2(N(C)C)CCC2)c(OC)c1	ZINC000450997522	DF	On-Demand	Anodyne	HCN1	66	39
CCCOc1ccc(C(=O)NCC2(N(C)C)CCC2)c(OC)c1	ZINC000450997522	DF	On-Demand	Anodyne	HCN4	54	38
CC(C)CN(C(=O)[C@H]1CC12CCSCC2)[C@H]1CCCc2cccnc21	ZINC000450997577	FI	On-Demand	Anodyne	CXCR4	74	38
CC(C)CN(C(=O)[C@H]1CC12CCSCC2)[C@@H]1CCCc2cccnc21	ZINC000450997589	FI	On-Demand	Anodyne	CXCR4	74	38
CC(C)CN(C(=O)[C@@H]1CC12CCSCC2)[C@H]1CCCc2cccnc21	ZINC000450997592	FI	On-Demand	Anodyne	CXCR4	74	38
CC(C)CN(C(=O)[C@@H]1CC12CCSCC2)[C@@H]1CCCc2cccnc21	ZINC000450997596	FI	On-Demand	Anodyne	CXCR4	74	38
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NC2CCN(C(C)=O)CC2)c1	ZINC000450997617	GD	On-Demand	Anodyne	CCR8	84	42
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NC2CCN(C(C)=O)CC2)c1	ZINC000450997617	GD	On-Demand	Anodyne	SFRP1	97	39
COC(=O)c1cc(Cl)c(C)c(S(=O)(=O)NC2CCN(C(C)=O)CC2)c1	ZINC000450997617	GD	On-Demand	Anodyne	WNT3	75	36
Cc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1	ZINC000450997631	ED	On-Demand	Anodyne	PDE5A	22	41
Cc1ccc2cc(S(=O)(=O)N3CCN(CCO)CC3)ccc2c1	ZINC000450997631	ED	On-Demand	Anodyne	PKM	35	43
COc1ccc(CC(=O)NCC2(N(C)C)CCC2)c(Cl)c1OC	ZINC000450997656	EF	On-Demand	Anodyne	SLC6A5	17	47
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc2c(c1)OCCO2	ZINC000450997657	EG	On-Demand	Anodyne	KCNH2	17	42
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc2c(c1)OCCO2	ZINC000450997658	EG	On-Demand	Anodyne	KCNH2	17	42
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	HTR1A	116	49
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	DRD2	92	51
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	DRD1	37	45
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	DRD4	46	44
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	ADRA1D	58	49
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	HTR2A	69	51
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	HTR2C	38	44
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	SLC6A4	23	51
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	ADRA1A	51	51
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	ADRA1B	37	49
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	DRD3	93	47
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	HTR7	101	43
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	SIGMAR1	20	51
CN(C)S(=O)(=O)CCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450997665	FE	On-Demand	Anodyne	HTR6	15	41
CC(C)n1cc(CN2CCCN(c3ccccc3Cl)CC2)nn1	ZINC000450997673	EG	On-Demand	Anodyne	ADRB1	0	41
CC(C)n1cc(CN2CCCN(c3ccccc3Cl)CC2)nn1	ZINC000450997673	EG	On-Demand	Anodyne	DRD2	29	46
CC(C)n1cc(CN2CCCN(c3ccccc3Cl)CC2)nn1	ZINC000450997673	EG	On-Demand	Anodyne	DRD1	23	46
CC(C)n1cc(CN2CCCN(c3ccccc3Cl)CC2)nn1	ZINC000450997673	EG	On-Demand	Anodyne	DRD4	31	45
CC(C)n1cc(CN2CCCN(c3ccccc3Cl)CC2)nn1	ZINC000450997673	EG	On-Demand	Anodyne	DRD3	25	46
Cc1nn(-c2ccccc2)c(C)c1CNS(=O)(=O)C[C@@H]1CCCCC1(F)F	ZINC000450997688	GH	On-Demand	Anodyne	P2RX7	15	49
Fc1ccc(-c2cc(CN3CCC[C@H](c4ccncc4)C3)on2)cc1	ZINC000450997690	EI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Cc1nn(-c2ccccc2)c(C)c1CNS(=O)(=O)C[C@H]1CCCCC1(F)F	ZINC000450997691	GH	On-Demand	Anodyne	P2RX7	15	49
Fc1ccc(-c2cc(CN3CCC[C@@H](c4ccncc4)C3)on2)cc1	ZINC000450997692	EI	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	40
Cc1nn(C)cc1CC(=O)N(CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450997695	EG	On-Demand	Anodyne	CXCR4	75	39
Cc1nn(C)cc1CC(=O)N(CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450997697	EG	On-Demand	Anodyne	CXCR4	75	39
CCCN(C(=O)c1ccn(CCn2cccn2)n1)[C@H]1CCCc2cccnc21	ZINC000450997707	GG	On-Demand	Anodyne	CXCR4	75	39
CCCN(C(=O)c1ccn(CCn2cccn2)n1)[C@@H]1CCCc2cccnc21	ZINC000450997708	GG	On-Demand	Anodyne	CXCR4	75	39
Cc1csc(S(=O)(=O)Nc2cccnc2N(C)C)c1	ZINC000450997713	CE	On-Demand	Anodyne	NFKBIA	0	41
CC(C)COCCCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997717	FF	On-Demand	Anodyne	CA1	16	42
Clc1ccccc1N1CCCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450997718	EH	On-Demand	Anodyne	DRD2	21	42
Clc1ccccc1N1CCCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450997718	EH	On-Demand	Anodyne	DRD4	25	46
Clc1ccccc1N1CCCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450997718	EH	On-Demand	Anodyne	DRD3	22	46
Clc1ccccc1N1CCCN(Cc2nnc(C3CC3)s2)CC1	ZINC000450997718	EH	On-Demand	Anodyne	NOX1	43	31
C[C@H](c1ccccc1)N1CCN(C(=O)CN2CCC[C@@H](c3ccncc3)C2)CC1	ZINC000450997719	GG	On-Demand	Anodyne	PTAFR	45	44
C[C@H](c1ccccc1)N1CCN(C(=O)CN2CCC[C@@H](c3ccncc3)C2)CC1	ZINC000450997719	GG	On-Demand	Anodyne	CCR5	26	42
C[C@@H](c1ccccc1)N1CCN(C(=O)CN2CCC[C@@H](c3ccncc3)C2)CC1	ZINC000450997720	GG	On-Demand	Anodyne	PTAFR	45	44
C[C@@H](c1ccccc1)N1CCN(C(=O)CN2CCC[C@@H](c3ccncc3)C2)CC1	ZINC000450997720	GG	On-Demand	Anodyne	CCR5	26	42
C[C@H](c1ccccc1)N1CCN(C(=O)CN2CCC[C@H](c3ccncc3)C2)CC1	ZINC000450997721	GG	On-Demand	Anodyne	PTAFR	45	44
C[C@H](c1ccccc1)N1CCN(C(=O)CN2CCC[C@H](c3ccncc3)C2)CC1	ZINC000450997721	GG	On-Demand	Anodyne	CCR5	26	42
C[C@@H](c1ccccc1)N1CCN(C(=O)CN2CCC[C@H](c3ccncc3)C2)CC1	ZINC000450997722	GG	On-Demand	Anodyne	PTAFR	45	44
C[C@@H](c1ccccc1)N1CCN(C(=O)CN2CCC[C@H](c3ccncc3)C2)CC1	ZINC000450997722	GG	On-Demand	Anodyne	CCR5	26	42
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997739	GF	On-Demand	Anodyne	ABCB1	58	40
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997739	GF	On-Demand	Anodyne	ACKR3	43	34
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997740	GF	On-Demand	Anodyne	ABCB1	58	40
COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997740	GF	On-Demand	Anodyne	ACKR3	43	34
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997741	GF	On-Demand	Anodyne	ABCB1	58	40
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997741	GF	On-Demand	Anodyne	ACKR3	43	34
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997742	GF	On-Demand	Anodyne	ABCB1	58	40
COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997742	GF	On-Demand	Anodyne	ACKR3	43	34
CCOC1CC2(CCN(CCCC(=O)c3ccc(Br)cc3)C2)C1	ZINC000450997746	GI	On-Demand	Anodyne	DRD4	0	41
CCOC1CC2(CCN(CCCC(=O)c3ccc(Br)cc3)C2)C1	ZINC000450997746	GI	On-Demand	Anodyne	SLC18A3	22	41
CCOC1CC2(CCN(CCCC(=O)c3ccc(Br)cc3)C2)C1	ZINC000450997746	GI	On-Demand	Anodyne	CYP2J2	51	36
COCCN(CCOC)C1CCN(CCc2ccc(Cl)cc2)CC1	ZINC000450997762	FF	On-Demand	Anodyne	SIGMAR1	35	47
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450997766	GE	On-Demand	Anodyne	TGM2	66	39
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)CSC3CCC3)CC2)cc1	ZINC000450997766	GE	On-Demand	Anodyne	F13A1	69	39
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450997772	EH	On-Demand	Anodyne	CYSP_TRYCR	0	42
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450997772	EH	On-Demand	Anodyne	CPT1A	45	33
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450997772	EH	On-Demand	Anodyne	RBP4	30	44
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450997772	EH	On-Demand	Anodyne	ENPP1	47	34
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450997775	EH	On-Demand	Anodyne	CYSP_TRYCR	0	42
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450997775	EH	On-Demand	Anodyne	CPT1A	45	33
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450997775	EH	On-Demand	Anodyne	RBP4	30	44
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450997775	EH	On-Demand	Anodyne	ENPP1	47	34
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450997776	EH	On-Demand	Anodyne	CYSP_TRYCR	0	42
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450997776	EH	On-Demand	Anodyne	CPT1A	45	33
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450997776	EH	On-Demand	Anodyne	RBP4	30	44
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450997776	EH	On-Demand	Anodyne	ENPP1	47	34
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450997778	EH	On-Demand	Anodyne	CYSP_TRYCR	0	42
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450997778	EH	On-Demand	Anodyne	CPT1A	45	33
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450997778	EH	On-Demand	Anodyne	RBP4	30	44
COc1ccc(Cl)cc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450997778	EH	On-Demand	Anodyne	ENPP1	47	34
CCOC(=O)c1ccc(CS(=O)(=O)Nc2cccc(N(C)C)c2C)cc1	ZINC000450997785	GG	On-Demand	Anodyne	NR3C1	15	49
C[C@@H](SC1CCC1)C(=O)NCc1cccs1	ZINC000450997816	CG	On-Demand	Anodyne	ADAM17	29	46
C[C@H](SC1CCC1)C(=O)NCc1cccs1	ZINC000450997817	CG	On-Demand	Anodyne	ADAM17	29	46
Cc1ccncc1S(=O)(=O)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000450997818	GF	On-Demand	Anodyne	ADORA2B	51	49
COCCCOc1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450997830	GE	On-Demand	Anodyne	GRM4	15	45
COCCCOc1ccccc1NS(=O)(=O)c1cccnc1C(=O)OC	ZINC000450997830	GE	On-Demand	Anodyne	PRTN3	51	33
C[C@@H](SC1CCC1)C(=O)NCCc1ccccc1	ZINC000450997831	CG	On-Demand	Anodyne	POL	0	41
C[C@H](SC1CCC1)C(=O)NCCc1ccccc1	ZINC000450997832	CG	On-Demand	Anodyne	POL	0	41
CC(=O)c1ccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)cc1	ZINC000450997835	FH	On-Demand	Mild	SIGMAR1	31	40
CC(=O)c1ccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)cc1	ZINC000450997835	FH	On-Demand	Mild	SSTR5	54	35
CC(=O)c1ccc(CN2CCC(Oc3ccc(C#N)cc3F)CC2)cc1	ZINC000450997835	FH	On-Demand	Mild	MLNR	35	42
CC(C)(C)c1cnc(CSC2CCC2)o1	ZINC000450997836	BH	On-Demand	Anodyne	CDK9	23	43
CC(C)(C)c1cnc(CSC2CCC2)o1	ZINC000450997836	BH	On-Demand	Anodyne	CDK2	22	49
O=C(c1ccc(CNS(=O)(=O)c2sccc2Cl)cc1)N1CCCCC1	ZINC000450997838	GH	On-Demand	Anodyne	L3MBTL3	46	38
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)oc1C	ZINC000450997843	GF	On-Demand	Anodyne	CA2	15	45
CCOC(=O)c1nc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)oc1C	ZINC000450997843	GF	On-Demand	Anodyne	CA1	21	42
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nn1	ZINC000450997845	FD	On-Demand	Anodyne	CA2	18	40
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nn1	ZINC000450997845	FD	On-Demand	Anodyne	CA1	24	40
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nn1	ZINC000450997845	FD	On-Demand	Anodyne	CA4	19	40
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nn1	ZINC000450997845	FD	On-Demand	Anodyne	MMP2	17	40
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nn1	ZINC000450997845	FD	On-Demand	Anodyne	IDO1	33	42
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)nn1	ZINC000450997845	FD	On-Demand	Anodyne	PFK	0	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	ACE	66	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	DRD4	0	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	OPRM1	45	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	MME	65	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	CMA1	63	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	CTRA_BOVIN	61	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	TRY1_BOVIN	50	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	NPFFR2	51	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	TIMP3	42	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	F11	40	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	CAPN1	40	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	CTRC	47	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	ACE2	68	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	C5AR1	43	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	BIRC2	55	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	QRFPR	40	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	PSMB8	47	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	BRCA1	62	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997866	FF	On-Demand	Anodyne	GPR142	82	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	ACE	66	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	DRD4	0	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	OPRM1	45	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	MME	65	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	CMA1	63	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	CTRA_BOVIN	61	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	TRY1_BOVIN	50	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	NPFFR2	51	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	TIMP3	42	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	F11	40	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	CAPN1	40	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	CTRC	47	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	ACE2	68	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	C5AR1	43	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	BIRC2	55	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	QRFPR	40	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	PSMB8	47	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	BRCA1	62	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997868	FF	On-Demand	Anodyne	GPR142	82	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	ACE	66	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	DRD4	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	OPRM1	45	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	MME	65	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	CMA1	63	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	CTRA_BOVIN	61	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	TRY1_BOVIN	50	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	NPFFR2	51	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	TIMP3	42	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	F11	40	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	CAPN1	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	CTRC	47	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	ACE2	68	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	C5AR1	43	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	BIRC2	55	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	QRFPR	40	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	PSMB8	47	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	BRCA1	62	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450997869	FF	On-Demand	Anodyne	GPR142	82	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	ACE	66	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	DRD4	0	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	OPRM1	45	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	MME	65	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	CMA1	63	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	CTRA_BOVIN	61	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	TRY1_BOVIN	50	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	NPFFR2	51	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	TIMP3	42	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	F11	40	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	CAPN1	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	CTRC	47	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	ACE2	68	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	C5AR1	43	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	BIRC2	55	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	QRFPR	40	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	PSMB8	47	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	BRCA1	62	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450997870	FF	On-Demand	Anodyne	GPR142	82	37
CN(C)c1noc(CNC(=O)CNC(=O)Nc2cccc(Cl)c2)n1	ZINC000450997873	FD	On-Demand	Anodyne	PSBA	0	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)N(C)C)cc1	ZINC000450997876	EC	On-Demand	Anodyne	CA1	26	43
COc1cc(-c2noc(CSC3CCC3)n2)ccc1OC(F)F	ZINC000450997881	EI	On-Demand	Anodyne	QRFPR	43	37
COc1cc(-c2noc(CSC3CCC3)n2)ccc1OC(F)F	ZINC000450997881	EI	On-Demand	Anodyne	AXIN2	0	46
COc1cccc2c1CCCCN2S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450997883	GH	On-Demand	Mild	COLA	43	39
COc1cccc2c1CCCCN2S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450997883	GH	On-Demand	Mild	CPT1A	40	39
COc1cccc2c1CCCCN2S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450997883	GH	On-Demand	Mild	CPT1B	45	39
COc1ccc2c(c1)N(S(=O)(=O)c1ccc(CC#N)cc1Cl)CCCC2	ZINC000450997885	GH	On-Demand	Mild	COLA	0	49
COc1ccc2c(c1)N(S(=O)(=O)c1ccc(CC#N)cc1Cl)CCCC2	ZINC000450997885	GH	On-Demand	Mild	CPT1A	16	49
COc1ccc2c(c1)N(S(=O)(=O)c1ccc(CC#N)cc1Cl)CCCC2	ZINC000450997885	GH	On-Demand	Mild	CPT1B	25	49
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997887	FD	On-Demand	Anodyne	CA2	17	50
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997887	FD	On-Demand	Anodyne	CA1	15	43
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997887	FD	On-Demand	Anodyne	CA4	17	40
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997887	FD	On-Demand	Anodyne	CA14	15	44
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997887	FD	On-Demand	Anodyne	MMP2	15	41
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997887	FD	On-Demand	Anodyne	MMP8	33	41
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997887	FD	On-Demand	Anodyne	MMP9	15	41
CCNC(=O)CN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450997887	FD	On-Demand	Anodyne	MMP12	17	41
CC[C@H](NS(=O)(=O)CCOCc1ccccc1)c1ccc(OC)cc1	ZINC000450997888	FG	On-Demand	Anodyne	MMP2	15	43
CC[C@@H](NS(=O)(=O)CCOCc1ccccc1)c1ccc(OC)cc1	ZINC000450997889	FG	On-Demand	Anodyne	MMP2	15	43
Fc1ccccc1N1CCCN(Cc2ccn(CC(F)(F)F)n2)CC1	ZINC000450997893	FG	On-Demand	Anodyne	DRD4	22	44
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	CA2	27	50
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	ADRB2	49	54
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	ADRB1	28	54
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	ADRB3	64	54
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	CA1	34	43
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	CA7	17	41
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	CA4	30	43
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	CA14	17	42
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	CA12	19	46
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	CA9	22	46
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	PFK	0	42
CSCCc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450997895	GH	On-Demand	Anodyne	LIMK2	50	41
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC3(CCCC3)C2)c1	ZINC000450997898	DH	On-Demand	Anodyne	NPBWR1	55	32
O=C(Nc1cc(Br)ccn1)c1cc(F)c(N2CCOCC2)c(F)c1	ZINC000450997906	GG	On-Demand	Anodyne	MAPK10	18	41
CC(C)N(CCN1CCCCCC1)Cc1cccc(S(C)(=O)=O)c1	ZINC000450997908	FG	On-Demand	Anodyne	SIGMAR1	17	47
C[C@H]1[C@H](N2CCCC2)CCN1C[C@H](O)Cc1ccccc1	ZINC000450997912	CE	On-Demand	Anodyne	VACHT_TETCF	0	41
C[C@H]1[C@@H](N2CCCC2)CCN1C[C@H](O)Cc1ccccc1	ZINC000450997913	CE	On-Demand	Anodyne	VACHT_TETCF	0	41
CC[C@@H]1[C@H](C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450997919	DG	On-Demand	Anodyne	P2RY1	0	42
CC[C@@H]1[C@H](C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450997919	DG	On-Demand	Anodyne	EPHX2	24	52
CC[C@H]1[C@@H](C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450997920	DG	On-Demand	Anodyne	P2RY1	0	42
CC[C@H]1[C@@H](C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450997920	DG	On-Demand	Anodyne	EPHX2	24	52
CC[C@H]1[C@H](C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450997921	DG	On-Demand	Anodyne	P2RY1	0	42
CC[C@H]1[C@H](C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450997921	DG	On-Demand	Anodyne	EPHX2	24	52
CC[C@@H]1[C@@H](C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450997923	DG	On-Demand	Anodyne	P2RY1	0	42
CC[C@@H]1[C@@H](C)CCN1C(=O)CNC(=O)Nc1cccc(Cl)c1	ZINC000450997923	DG	On-Demand	Anodyne	EPHX2	24	52
Cc1ccc(C(=O)N2CC[C@@H](O)C(C)(C)C2)c(Cl)c1Cl	ZINC000450997924	DH	On-Demand	Anodyne	P2RX7	0	42
CCOC(=O)COCCN1CCC[C@H](c2ccncc2)C1	ZINC000450997926	CD	On-Demand	Anodyne	SLC6A1	54	39
CCOC(=O)COCCN1CCC[C@@H](c2ccncc2)C1	ZINC000450997927	CD	On-Demand	Anodyne	SLC6A1	54	39
Cc1ccc(C(=O)N2CC[C@H](O)C(C)(C)C2)c(Cl)c1Cl	ZINC000450997930	DH	On-Demand	Anodyne	P2RX7	0	42
N#Cc1cc(F)ccc1CS(=O)(=O)N1CCC[C@H]1c1cccnc1	ZINC000450997933	EF	On-Demand	Mild	CHRNA2	40	41
N#Cc1cc(F)ccc1CS(=O)(=O)N1CCC[C@H]1c1cccnc1	ZINC000450997933	EF	On-Demand	Mild	CRTY	0	41
N#Cc1cc(F)ccc1CS(=O)(=O)N1CCC[C@@H]1c1cccnc1	ZINC000450997937	EF	On-Demand	Mild	CHRNA2	40	41
N#Cc1cc(F)ccc1CS(=O)(=O)N1CCC[C@@H]1c1cccnc1	ZINC000450997937	EF	On-Demand	Mild	CRTY	0	41
CC1(C)CCCCN(C(=O)c2ccc(C(C)(F)F)nc2)C1	ZINC000450997938	CH	On-Demand	Anodyne	HPGD	37	41
CC(C)(CCN1CCCCCC1)NC(=O)Cc1ccc(O)c(F)c1	ZINC000450997945	EG	On-Demand	Anodyne	CAN2	0	42
CC(=O)N1CCCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450997947	EE	On-Demand	Anodyne	TRY2_BOVIN	29	40
CC(=O)N1CCCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450997947	EE	On-Demand	Anodyne	PKM	35	42
CC(=O)N1CCCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450997947	EE	On-Demand	Anodyne	TGM2	55	39
CC(=O)N1CCCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450997947	EE	On-Demand	Anodyne	F13A1	70	39
CC(=O)N1CCCN(S(=O)(=O)c2ccc3cc(C)ccc3c2)CC1	ZINC000450997947	EE	On-Demand	Anodyne	AKR1C3	28	44
COCCNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450997951	GF	On-Demand	Anodyne	PTGDR	28	40
COCCNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cc(C)cs2)c1	ZINC000450997951	GF	On-Demand	Anodyne	PTGDR2	23	40
Cc1ccc(S(=O)(=O)CCCN2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450997959	GG	On-Demand	Anodyne	SLC6A1	38	43
Cc1ccc(S(=O)(=O)CCCN2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450997959	GG	On-Demand	Anodyne	SLC6A3	22	43
Cc1ccc(S(=O)(=O)CCCN2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450997961	GG	On-Demand	Anodyne	SLC6A1	38	43
Cc1ccc(S(=O)(=O)CCCN2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)cc1	ZINC000450997961	GG	On-Demand	Anodyne	SLC6A3	22	43
CC(C)(C)c1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1O	ZINC000450998005	EH	On-Demand	Anodyne	HDAC1	28	47
CC(C)(C)c1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1O	ZINC000450998005	EH	On-Demand	Anodyne	MAPKAPK3	0	41
CC(C)(C)c1cccc(NC(=O)c2ccc(N3CCC3)nc2)c1O	ZINC000450998005	EH	On-Demand	Anodyne	HPGDS	18	42
CC(=O)Nc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998007	GG	On-Demand	Anodyne	CA2	22	51
CC(=O)Nc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998007	GG	On-Demand	Anodyne	CA1	23	40
CC(=O)Nc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998007	GG	On-Demand	Anodyne	CA4	26	44
CC(=O)Nc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998007	GG	On-Demand	Anodyne	CA12	16	40
CC(=O)Nc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998007	GG	On-Demand	Anodyne	CA9	18	51
CC(=O)Nc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998007	GG	On-Demand	Anodyne	LEF	40	34
CC(=O)Nc1ccc(C)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998007	GG	On-Demand	Anodyne	IDO1	39	48
COc1cccc(OCCC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)c1	ZINC000450998030	GD	On-Demand	Anodyne	DRD4	46	36
COc1cccc(OCCC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)c1	ZINC000450998030	GD	On-Demand	Anodyne	MTNR1A	61	46
COc1cccc(OCCC(=O)NCCN2C(=O)NC3(CCCC3)C2=O)c1	ZINC000450998030	GD	On-Demand	Anodyne	MTNR1B	59	46
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	HTR1A	33	45
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	DRD2	38	44
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	DRD1	25	43
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	DRD4	31	43
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	ADRA1D	26	45
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	HTR2A	26	44
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	ADRA1A	20	40
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	ADRA1B	21	45
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	DRD3	38	41
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	NOX4	61	40
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	NOX1	85	40
Cc1cccc2nc(CN3CCCN(c4ccccc4Cl)CC3)cc(=O)n12	ZINC000450998046	GG	On-Demand	Anodyne	NOX5	79	40
Cc1cc(C(=O)NCC(C)C)ccc1NS(=O)(=O)c1cnc(O)s1	ZINC000450998047	FE	On-Demand	Anodyne	F3	47	32
COc1cc(C(F)(F)F)cc(S(=O)(=O)NCCCN2CCCC2)c1	ZINC000450998057	FE	On-Demand	Anodyne	HTR2A	16	48
COc1cc(C(F)(F)F)cc(S(=O)(=O)NCCCN2CCCC2)c1	ZINC000450998057	FE	On-Demand	Anodyne	HTR7	41	59
COc1cc(C(F)(F)F)cc(S(=O)(=O)NCCCN2CCCC2)c1	ZINC000450998057	FE	On-Demand	Anodyne	EBP	18	40
Cc1csc(S(=O)(=O)NCCCN2CCCC2)c1	ZINC000450998058	CD	On-Demand	Anodyne	HTR2A	15	41
Cc1csc(S(=O)(=O)NCCCN2CCCC2)c1	ZINC000450998058	CD	On-Demand	Anodyne	HTR7	27	41
Cc1ccncc1S(=O)(=O)NCCCN1CCCC1	ZINC000450998059	CD	On-Demand	Anodyne	HTR7	26	42
Cc1ccncc1S(=O)(=O)NCCCN1CCCC1	ZINC000450998059	CD	On-Demand	Anodyne	HTR6	18	42
Cc1ccncc1S(=O)(=O)NCCCN1CCCC1	ZINC000450998059	CD	On-Demand	Anodyne	HNMT	64	43
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NCc2ccco2)cc1	ZINC000450998060	GD	On-Demand	Anodyne	CA2	15	47
CC(C)C(=O)Nc1ccc(S(=O)(=O)NCC(=O)NCc2ccco2)cc1	ZINC000450998060	GD	On-Demand	Anodyne	CA1	18	47
O=C(c1c[nH]c2nccc-2c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450998062	EI	On-Demand	Anodyne	CCR1	43	39
O=C(c1c[nH]c2nccc-2c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450998062	EI	On-Demand	Anodyne	FASN	40	36
O=C(c1c[nH]c2nccc-2c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450998062	EI	On-Demand	Anodyne	L3MBTL3	53	35
O=C(c1c[nH]c2nccc-2c1)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000450998062	EI	On-Demand	Anodyne	SLC6A7	0	40
O=C(CN1CCC[C@@H](c2ccncc2)C1)N[C@H](c1ccccc1)c1cccs1	ZINC000450998067	GI	On-Demand	Anodyne	PRCP	32	49
O=C(CN1CCC[C@@H](c2ccncc2)C1)N[C@H](c1ccccc1)c1cccs1	ZINC000450998067	GI	On-Demand	Anodyne	ADAM17	0	40
O=C(CN1CCC[C@@H](c2ccncc2)C1)N[C@H](c1ccccc1)c1cccs1	ZINC000450998067	GI	On-Demand	Anodyne	BIRC8	44	31
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	PLG	48	31
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	FKBP1A	15	41
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	MMP13	15	41
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	TRYP_PIG	45	31
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	MMP3	23	41
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	TGM1	15	46
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	CAPN1	21	46
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	EPHX2	46	60
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	TGM2	103	60
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	MMP7	28	41
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	CYP2C9	15	40
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	MMP1	17	41
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	F13A1	112	48
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	AKR1C3	0	40
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	NAMPT	90	53
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	TMPRSS11D	65	36
C=Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccccc3)CC2)cc1	ZINC000450998068	GG	On-Demand	Anodyne	TGM6	0	46
O=C(CN1CCC[C@H](c2ccncc2)C1)N[C@H](c1ccccc1)c1cccs1	ZINC000450998069	GI	On-Demand	Anodyne	PRCP	32	49
O=C(CN1CCC[C@H](c2ccncc2)C1)N[C@H](c1ccccc1)c1cccs1	ZINC000450998069	GI	On-Demand	Anodyne	ADAM17	0	40
O=C(CN1CCC[C@H](c2ccncc2)C1)N[C@H](c1ccccc1)c1cccs1	ZINC000450998069	GI	On-Demand	Anodyne	BIRC8	44	31
O=C(CN1CCC[C@@H](c2ccncc2)C1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450998071	GI	On-Demand	Anodyne	PRCP	32	49
O=C(CN1CCC[C@@H](c2ccncc2)C1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450998071	GI	On-Demand	Anodyne	ADAM17	0	40
O=C(CN1CCC[C@@H](c2ccncc2)C1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450998071	GI	On-Demand	Anodyne	BIRC8	44	31
O=C(CN1CCC[C@H](c2ccncc2)C1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450998072	GI	On-Demand	Anodyne	PRCP	32	49
O=C(CN1CCC[C@H](c2ccncc2)C1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450998072	GI	On-Demand	Anodyne	ADAM17	0	40
O=C(CN1CCC[C@H](c2ccncc2)C1)N[C@@H](c1ccccc1)c1cccs1	ZINC000450998072	GI	On-Demand	Anodyne	BIRC8	44	31
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998076	EI	On-Demand	Anodyne	DRD4	16	43
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998076	EI	On-Demand	Anodyne	SLC6A1	44	34
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998076	EI	On-Demand	Anodyne	PRCP	26	40
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998076	EI	On-Demand	Anodyne	BIRC2	69	33
CC(C)c1ccccc1NC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998076	EI	On-Demand	Anodyne	ACAT	0	40
CC(C)c1ccccc1NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998077	EI	On-Demand	Anodyne	DRD4	16	43
CC(C)c1ccccc1NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998077	EI	On-Demand	Anodyne	SLC6A1	44	34
CC(C)c1ccccc1NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998077	EI	On-Demand	Anodyne	PRCP	26	40
CC(C)c1ccccc1NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998077	EI	On-Demand	Anodyne	BIRC2	69	33
CC(C)c1ccccc1NC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998077	EI	On-Demand	Anodyne	ACAT	0	40
CC(C)CNS(=O)(=O)c1ccc(S(=O)(=O)N[C@@H](C#N)C(C)C)cc1	ZINC000450998087	FD	On-Demand	Mild	MMP13	15	40
O=S(=O)(NCCCN1CCCCC1)c1cc2cc(F)ccc2o1	ZINC000450998093	EF	On-Demand	Anodyne	HTR7	30	41
O=S(=O)(NCCCN1CCCCC1)c1cc2cc(F)ccc2o1	ZINC000450998093	EF	On-Demand	Anodyne	HTR6	0	42
O=S(=O)(NCCCN1CCCC1)c1cccc2ccoc12	ZINC000450998095	DE	On-Demand	Anodyne	HTR7	28	44
O=S(=O)(NCCCN1CCCC1)c1cccc2ccoc12	ZINC000450998095	DE	On-Demand	Anodyne	HTR6	23	49
O=S(=O)(NCCCN1CCCC1)c1cccc2ccoc12	ZINC000450998095	DE	On-Demand	Anodyne	HNMT	41	36
N#Cc1cccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998107	GG	On-Demand	Mild	HTR1A	37	44
N#Cc1cccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998107	GG	On-Demand	Mild	DRD2	49	45
N#Cc1cccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998107	GG	On-Demand	Mild	DRD1	21	44
N#Cc1cccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998107	GG	On-Demand	Mild	DRD4	38	45
N#Cc1cccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998107	GG	On-Demand	Mild	DRD3	64	40
N#Cc1cccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998107	GG	On-Demand	Mild	HTR7	31	44
N#Cc1cccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998107	GG	On-Demand	Mild	KCNQ2	49	42
N#Cc1cccc(CNC(=O)CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998107	GG	On-Demand	Mild	MCHR1	23	42
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	HTR1A	116	57
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	DRD2	102	50
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	DRD1	50	50
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	DRD4	78	44
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	ADRA1D	50	49
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	HTR1B	27	42
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	HTR2A	58	47
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	HTR2C	35	42
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	SLC6A4	22	45
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	ADRA1A	44	49
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	ADRA1B	33	49
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	DRD3	104	50
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	HTR4	17	42
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	HTR7	93	47
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	MC4R	40	39
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	KCNQ2	72	39
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	SIGMAR1	18	47
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	SSTR1	40	52
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	NOX1	53	34
CN1CCN(C(=O)CCN2CCCN(c3ccccc3Cl)CC2)CC1	ZINC000450998114	FE	On-Demand	Anodyne	NOX5	50	34
CC(C)(C)NC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998117	GD	On-Demand	Anodyne	HTR1A	46	42
CC(C)(C)NC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998117	GD	On-Demand	Anodyne	DRD2	53	51
CC(C)(C)NC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998117	GD	On-Demand	Anodyne	DRD4	42	51
CC(C)(C)NC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998117	GD	On-Demand	Anodyne	ADRA1D	34	40
CC(C)(C)NC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998117	GD	On-Demand	Anodyne	DRD3	77	43
CC(C)(C)NC(=O)CNC(=O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998117	GD	On-Demand	Anodyne	KCNQ2	74	41
C[C@@H](C(=O)Nc1c(F)cccc1F)N1CCCN(c2ccccc2Cl)CC1	ZINC000450998118	GI	On-Demand	Anodyne	DRD2	19	43
C[C@@H](C(=O)Nc1c(F)cccc1F)N1CCCN(c2ccccc2Cl)CC1	ZINC000450998118	GI	On-Demand	Anodyne	KCNQ2	88	44
C[C@@H](C(=O)Nc1c(F)cccc1F)N1CCCN(c2ccccc2Cl)CC1	ZINC000450998118	GI	On-Demand	Anodyne	NPY2R	85	40
Cc1csc(S(=O)(=O)N2CCC(C(=O)Nc3ccccc3O)CC2)c1	ZINC000450998119	GF	On-Demand	Anodyne	LPL	51	41
Cc1csc(S(=O)(=O)N2CCC(C(=O)Nc3ccccc3O)CC2)c1	ZINC000450998119	GF	On-Demand	Anodyne	EPHX2	47	57
Cc1csc(S(=O)(=O)N2CCC(C(=O)Nc3ccccc3O)CC2)c1	ZINC000450998119	GF	On-Demand	Anodyne	LIPG	21	41
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	HTR1A	36	47
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	DRD2	52	51
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	DRD4	71	51
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	ADRA1D	21	44
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	HTR2A	21	44
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	ADRA1A	17	44
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	DRD3	50	51
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	SIGMAR1	19	44
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	NOX4	42	41
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	NOX1	65	41
Cc1cncc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450998120	DH	On-Demand	Anodyne	NOX5	60	38
C[C@H](C(=O)Nc1c(F)cccc1F)N1CCCN(c2ccccc2Cl)CC1	ZINC000450998121	GI	On-Demand	Anodyne	DRD2	19	43
C[C@H](C(=O)Nc1c(F)cccc1F)N1CCCN(c2ccccc2Cl)CC1	ZINC000450998121	GI	On-Demand	Anodyne	KCNQ2	88	44
C[C@H](C(=O)Nc1c(F)cccc1F)N1CCCN(c2ccccc2Cl)CC1	ZINC000450998121	GI	On-Demand	Anodyne	NPY2R	85	40
CCO[C@@H](C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450998123	GJ	On-Demand	Anodyne	HTR1A	18	43
CCO[C@@H](C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450998123	GJ	On-Demand	Anodyne	DRD2	24	43
CCO[C@@H](C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450998123	GJ	On-Demand	Anodyne	DRD4	24	40
CCO[C@@H](C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450998123	GJ	On-Demand	Anodyne	DRD3	21	43
CCO[C@H](C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450998127	GJ	On-Demand	Anodyne	HTR1A	18	43
CCO[C@H](C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450998127	GJ	On-Demand	Anodyne	DRD2	24	43
CCO[C@H](C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450998127	GJ	On-Demand	Anodyne	DRD4	24	40
CCO[C@H](C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450998127	GJ	On-Demand	Anodyne	DRD3	21	43
CS(=O)(=O)c1cccc(CS(=O)(=O)N(Cc2ccccc2F)C2CC2)c1	ZINC000450998138	GF	On-Demand	Anodyne	NR1H2	16	41
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	HTR1A	58	49
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	DRD2	53	49
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	DRD1	22	43
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	DRD4	27	41
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	ADRA1D	24	49
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	HTR2A	35	43
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	ADRA1A	37	45
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	HRH1	24	42
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	ADRA1B	29	49
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	DRD3	59	47
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	HTR7	23	42
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	CHRNA9	0	40
CN1CCC[C@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998145	DG	On-Demand	Anodyne	CHRNA10	49	41
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	HTR1A	58	49
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	DRD2	53	49
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	DRD1	22	43
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	DRD4	27	41
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	ADRA1D	24	49
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	HTR2A	35	43
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	ADRA1A	37	45
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	HRH1	24	42
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	ADRA1B	29	49
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	DRD3	59	47
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	HTR7	23	42
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	CHRNA9	0	40
CN1CCC[C@@H]1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998146	DG	On-Demand	Anodyne	CHRNA10	49	41
CC(C)C(C)(C)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450998148	EG	On-Demand	Anodyne	COLA	50	32
CC(C)C(C)(C)CNC(=O)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450998148	EG	On-Demand	Anodyne	PDE8B	47	32
CC(C)C(C)(C)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450998149	EG	On-Demand	Anodyne	COLA	50	32
CC(C)C(C)(C)CNC(=O)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000450998149	EG	On-Demand	Anodyne	PDE8B	47	32
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Cl)cc1	ZINC000450998171	GG	On-Demand	Anodyne	SLC6A1	43	41
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Cl)cc1	ZINC000450998171	GG	On-Demand	Anodyne	SLC6A3	28	41
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Cl)cc1	ZINC000450998172	GG	On-Demand	Anodyne	SLC6A1	43	41
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Cl)cc1	ZINC000450998172	GG	On-Demand	Anodyne	SLC6A3	28	41
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Cl)cc1	ZINC000450998173	GG	On-Demand	Anodyne	SLC6A1	43	41
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2C[C@H](O)COc1ccc(Cl)cc1	ZINC000450998173	GG	On-Demand	Anodyne	SLC6A3	28	41
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Cl)cc1	ZINC000450998175	GG	On-Demand	Anodyne	SLC6A1	43	41
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2C[C@@H](O)COc1ccc(Cl)cc1	ZINC000450998175	GG	On-Demand	Anodyne	SLC6A3	28	41
CCCN(C(=O)c1cc(C(=O)OCC)no1)[C@H]1CCCc2cccnc21	ZINC000450998185	FG	On-Demand	Anodyne	CXCR4	80	42
CCCN(C(=O)c1cc(C(=O)OCC)no1)[C@@H]1CCCc2cccnc21	ZINC000450998186	FG	On-Demand	Anodyne	CXCR4	80	42
Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C#N	ZINC000450998212	GE	On-Demand	Mild	PRTN3	57	37
Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)c1C#N	ZINC000450998212	GE	On-Demand	Mild	LUXN	0	44
CNC(=O)c1ccc(CN(C)S(=O)(=O)CCOCc2ccccc2)cc1	ZINC000450998220	GE	On-Demand	Anodyne	LIMK2	41	37
COc1ccc(COC[C@@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998223	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
COc1ccc(COC[C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998224	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
COc1ccc(COC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998225	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
COc1ccc(COC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998226	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	43
C[C@H]1Cc2c(ncn2Cc2nc(-c3cccc(Cl)c3)no2)C[C@H]1C	ZINC000450998228	EI	On-Demand	Anodyne	GRM5	24	46
C[C@H]1Cc2ncn(Cc3nc(-c4cccc(Cl)c4)no3)c2C[C@H]1C	ZINC000450998229	EI	On-Demand	Anodyne	GRM5	24	46
C[C@H]1Cc2ncn(Cc3nc(-c4cccc(Cl)c4)no3)c2C[C@@H]1C	ZINC000450998230	EI	On-Demand	Anodyne	GRM5	24	46
C[C@@H]1Cc2ncn(Cc3nc(-c4cccc(Cl)c4)no3)c2C[C@H]1C	ZINC000450998231	EI	On-Demand	Anodyne	GRM5	24	46
CC(C)(C)OC(=O)[C@H]1C[C@H]2CC[C@H]1N2CCCF	ZINC000450998244	CF	On-Demand	Anodyne	SLC6A1	22	47
CC(C)(C)OC(=O)[C@@H]1C[C@H]2CC[C@H]1N2CCCF	ZINC000450998246	CF	On-Demand	Anodyne	SLC6A1	22	47
CCCN(C(=O)Cc1ccc(Cl)c(OC)c1)[C@@H]1CCCc2cccnc21	ZINC000450998249	FJ	On-Demand	Anodyne	CXCR4	75	40
CCCN(C(=O)Cc1ccc(Cl)c(OC)c1)[C@@H]1CCCc2cccnc21	ZINC000450998249	FJ	On-Demand	Anodyne	PDE6A	40	33
CCCN(C(=O)Cc1ccc(Cl)c(OC)c1)[C@H]1CCCc2cccnc21	ZINC000450998253	FJ	On-Demand	Anodyne	CXCR4	75	40
CCCN(C(=O)Cc1ccc(Cl)c(OC)c1)[C@H]1CCCc2cccnc21	ZINC000450998253	FJ	On-Demand	Anodyne	PDE6A	40	33
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	DRD2	68	53
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	DRD1	37	48
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	DRD4	50	42
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	ADRA1D	54	40
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	HTR2A	35	48
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	ADRA1A	46	39
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	ADRA1B	34	44
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	DRD3	53	41
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	HTR7	50	47
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	NOX1	50	42
COc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450998262	EG	On-Demand	Anodyne	NOX5	51	42
CCN(Cc1cccc(F)c1)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998270	FG	On-Demand	Anodyne	CCR5	87	39
CCN(Cc1cccc(F)c1)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998271	FG	On-Demand	Anodyne	CCR5	87	39
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Oc3ccccc3OC)C2)cc1	ZINC000450998274	GH	On-Demand	Anodyne	DRD4	23	40
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Oc3ccccc3OC)C2)cc1	ZINC000450998274	GH	On-Demand	Anodyne	AVPR1B	41	34
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Oc3ccccc3OC)C2)cc1	ZINC000450998274	GH	On-Demand	Anodyne	PDE4A	16	40
CCS(=O)(=O)c1ccc(CN2CCC[C@@H](Oc3ccccc3OC)C2)cc1	ZINC000450998274	GH	On-Demand	Anodyne	SSTR5	43	42
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Oc3ccccc3OC)C2)cc1	ZINC000450998277	GH	On-Demand	Anodyne	DRD4	23	40
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Oc3ccccc3OC)C2)cc1	ZINC000450998277	GH	On-Demand	Anodyne	AVPR1B	41	34
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Oc3ccccc3OC)C2)cc1	ZINC000450998277	GH	On-Demand	Anodyne	PDE4A	16	40
CCS(=O)(=O)c1ccc(CN2CCC[C@H](Oc3ccccc3OC)C2)cc1	ZINC000450998277	GH	On-Demand	Anodyne	SSTR5	43	42
CCCCOc1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450998279	FF	On-Demand	Anodyne	PLA2G4B	41	37
CCCCOc1cccc(NS(=O)(=O)c2cccnc2C(=O)OC)c1	ZINC000450998279	FF	On-Demand	Anodyne	GPR119	0	42
COCCCN(CCO)C(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450998298	GF	On-Demand	Anodyne	CYP2D6	15	40
COCCCN(CCO)C(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21	ZINC000450998299	GF	On-Demand	Anodyne	CYP2D6	15	40
CCCN(C(=O)CSC1CC1)[C@H]1CCCc2cccnc21	ZINC000450998301	DH	On-Demand	Anodyne	CXCR4	83	42
CCCN(C(=O)CSC1CC1)[C@@H]1CCCc2cccnc21	ZINC000450998303	DH	On-Demand	Anodyne	CXCR4	83	42
CC(C)N(CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450998305	GD	On-Demand	Anodyne	MMP13	34	40
CC(C)N(CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450998305	GD	On-Demand	Anodyne	ADAM17	17	40
CC(C)N(CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450998305	GD	On-Demand	Anodyne	MMP9	18	40
CC(C)N(CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450998305	GD	On-Demand	Anodyne	ADAMTS4	57	34
CC(C)N(CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450998305	GD	On-Demand	Anodyne	LUXN	0	47
CC(C)N(CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450998305	GD	On-Demand	Anodyne	ADIPOR1	0	40
CC(C)N(CCNS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1)C(C)C	ZINC000450998305	GD	On-Demand	Anodyne	ADIPOR2	0	40
CCOC(=O)c1ccc(CS(=O)(=O)Nc2c(C)cc(C)cc2C)cc1	ZINC000450998320	FH	On-Demand	Anodyne	FFAR4	31	45
CCOc1ccncc1S(=O)(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000450998322	GD	On-Demand	Anodyne	GNRHR	0	45
CCOc1ccncc1S(=O)(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000450998322	GD	On-Demand	Anodyne	SSTR5	69	39
CCCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@@H]1CCCc2cccnc21	ZINC000450998350	FH	On-Demand	Anodyne	CXCR4	73	40
CCCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)[C@H]1CCCc2cccnc21	ZINC000450998352	FH	On-Demand	Anodyne	CXCR4	73	40
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA2	112	58
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA1	90	58
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA7	60	58
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA5B	34	49
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA4	87	56
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA5A	33	49
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA14	56	45
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA12	69	50
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CA9	65	48
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	CYNT	43	49
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	NCE103	36	45
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	MTCA1	28	40
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	P96878_MYCTU	40	40
C[C@@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998367	ED	On-Demand	Anodyne	A6YCJ1_9METZ	26	52
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA2	112	58
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA1	90	58
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA7	60	58
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA5B	34	49
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA4	87	56
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA5A	33	49
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA14	56	45
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA12	69	50
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CA9	65	48
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	CYNT	43	49
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	NCE103	36	45
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	MTCA1	28	40
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	P96878_MYCTU	40	40
C[C@H](SC1CCC1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000450998368	ED	On-Demand	Anodyne	A6YCJ1_9METZ	26	52
C[C@@H](SC1CCC1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000450998382	DF	On-Demand	Anodyne	NOS2	38	40
C[C@@H](SC1CCC1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000450998382	DF	On-Demand	Anodyne	SSTR3	54	30
C[C@H](SC1CCC1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000450998383	DF	On-Demand	Anodyne	NOS2	38	40
C[C@H](SC1CCC1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000450998383	DF	On-Demand	Anodyne	SSTR3	54	30
CCOc1ccc(C#N)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998384	GG	On-Demand	Mild	CA1	17	42
CCOc1ccc(C#N)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998384	GG	On-Demand	Mild	MMP13	25	42
CCOc1ccc(C#N)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998384	GG	On-Demand	Mild	MMP2	15	42
CCOc1ccc(C#N)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998384	GG	On-Demand	Mild	ADAMTS4	34	41
CCOc1ccc(C#N)cc1NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998384	GG	On-Demand	Mild	IDO1	0	43
COCCCOc1ccccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450998385	FG	On-Demand	Anodyne	CCR4	23	42
COc1ccc2c(c1)CCCCN2S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450998389	GH	On-Demand	Mild	CYP11B2	23	46
COc1ccc2c(c1)CCCCN2S(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450998389	GH	On-Demand	Mild	CPT1B	25	42
CC(C)[C@H](SC1CCC1)C(=O)Nc1ccccc1F	ZINC000450998390	CI	On-Demand	Anodyne	KCNQ2	47	39
CC(C)[C@@H](SC1CCC1)C(=O)Nc1ccccc1F	ZINC000450998391	CI	On-Demand	Anodyne	KCNQ2	47	39
CC(C)N(C(=O)Cn1cncc(F)c1=O)C1CCCC1	ZINC000450998425	CD	On-Demand	Anodyne	SCARB1	49	39
Cc1cc2c(cc1S(=O)(=O)Nc1ccccc1S(=O)(=O)N(C)C)OCO2	ZINC000450998440	GD	On-Demand	Anodyne	EDNRA	15	42
COC(=O)c1cccc(-c2nc(CN3CCC[C@H](c4ccncc4)C3)cs2)c1	ZINC000450998460	GI	On-Demand	Anodyne	ROCK2	22	40
COC(=O)c1cccc(-c2nc(CN3CCC[C@@H](c4ccncc4)C3)cs2)c1	ZINC000450998461	GI	On-Demand	Anodyne	ROCK2	22	40
COc1cccc(NC(=O)CN(C)C(=O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450998462	GE	On-Demand	Anodyne	CCR3	26	44
COc1cccc(NC(=O)CN(C)C(=O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450998462	GE	On-Demand	Anodyne	MTNR1B	21	40
COc1cccc(NC(=O)CN(C)C(=O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450998463	GE	On-Demand	Anodyne	CCR3	26	44
COc1cccc(NC(=O)CN(C)C(=O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450998463	GE	On-Demand	Anodyne	MTNR1B	21	40
N#Cc1ccc(OCC(=O)NCCN2CCCOCC2)cc1Br	ZINC000450998470	GD	On-Demand	Mild	DRD4	43	33
CCN(C(=O)CN1CCC[C@@H](c2ccncc2)C1)[C@@H](C)c1ccc(F)cc1	ZINC000450998471	FI	On-Demand	Anodyne	CCR5	59	33
CCN(C(=O)CN1CCC[C@H](c2ccncc2)C1)[C@@H](C)c1ccc(F)cc1	ZINC000450998472	FI	On-Demand	Anodyne	CCR5	59	33
CCN(C(=O)CN1CCC[C@H](c2ccncc2)C1)[C@H](C)c1ccc(F)cc1	ZINC000450998473	FI	On-Demand	Anodyne	CCR5	59	33
CCN(C(=O)CN1CCC[C@@H](c2ccncc2)C1)[C@H](C)c1ccc(F)cc1	ZINC000450998474	FI	On-Demand	Anodyne	CCR5	59	33
Cn1c(CN2CCC[C@@H](c3ccncc3)C2)nnc1-c1ccccc1	ZINC000450998475	EG	On-Demand	Anodyne	SLC6A1	69	37
Cn1c(CN2CCC[C@H](c3ccncc3)C2)nnc1-c1ccccc1	ZINC000450998476	EG	On-Demand	Anodyne	SLC6A1	69	37
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	HTR1A	23	42
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	CNR1	0	43
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	SLC6A1	97	35
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	DRD3	22	42
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	CASR	47	35
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	MMP2	0	41
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	PLD2	42	43
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	CYP2J2	43	30
O=C(NCCN1CCCOCC1)[C@H]1CCN(c2ccccc2)C1	ZINC000450998478	DD	On-Demand	Anodyne	HPGDS	23	40
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	HTR1A	23	42
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	CNR1	0	43
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	SLC6A1	97	35
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	DRD3	22	42
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	CASR	47	35
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	MMP2	0	41
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	PLD2	42	43
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	CYP2J2	43	30
O=C(NCCN1CCCOCC1)[C@@H]1CCN(c2ccccc2)C1	ZINC000450998479	DD	On-Demand	Anodyne	HPGDS	23	40
CCCCCc1nnc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)s1	ZINC000450998490	FG	On-Demand	Anodyne	GLS	0	45
CCCCCc1nnc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)s1	ZINC000450998491	FG	On-Demand	Anodyne	GLS	0	45
Fc1ccccc1CCN1CCC[C@H](c2ccncc2)C1	ZINC000450998492	CH	On-Demand	Anodyne	SLC6A1	47	40
Fc1ccccc1CCN1CCC[C@H](c2ccncc2)C1	ZINC000450998492	CH	On-Demand	Anodyne	BIRC2	25	44
Fc1ccccc1CCN1CCC[C@@H](c2ccncc2)C1	ZINC000450998493	CH	On-Demand	Anodyne	SLC6A1	47	40
Fc1ccccc1CCN1CCC[C@@H](c2ccncc2)C1	ZINC000450998493	CH	On-Demand	Anodyne	BIRC2	25	44
CS(=O)(=O)N1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2O)CC1	ZINC000450998494	GC	On-Demand	Anodyne	CACNA1B	25	41
O=C(Cn1cncc(F)c1=O)N1CCN(c2ccccc2F)CC1	ZINC000450998495	EC	On-Demand	Anodyne	PLA2G7	32	41
CCCOc1ccc(CNC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998498	FG	On-Demand	Anodyne	HRH3	45	39
CCCOc1ccc(CNC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998499	FG	On-Demand	Anodyne	HRH3	45	39
CC(C)OC(=O)CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998500	FD	On-Demand	Anodyne	CA2	20	51
CC(C)OC(=O)CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998500	FD	On-Demand	Anodyne	CA1	24	43
CC(C)OC(=O)CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998500	FD	On-Demand	Anodyne	CA4	15	43
CC(C)OC(=O)CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998500	FD	On-Demand	Anodyne	CA14	15	43
CC(C)OC(=O)CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998500	FD	On-Demand	Anodyne	MMP2	21	40
CC(C)OC(=O)CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998500	FD	On-Demand	Anodyne	CA9	17	51
Cc1cccc(C)c1OCCNC(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998501	FG	On-Demand	Anodyne	SLC6A1	48	32
Cc1cccc(C)c1OCCNC(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998502	FG	On-Demand	Anodyne	SLC6A1	48	32
COc1cccc(-n2cc(C(=O)NC(C)(C)CCN3CCCCCC3)nn2)c1	ZINC000450998511	GG	On-Demand	Anodyne	DRD4	51	38
COc1cccc(-n2cc(C(=O)NC(C)(C)CCN3CCCCCC3)nn2)c1	ZINC000450998511	GG	On-Demand	Anodyne	DRD3	17	46
COc1cccc(-n2cc(C(=O)NC(C)(C)CCN3CCCCCC3)nn2)c1	ZINC000450998511	GG	On-Demand	Anodyne	AVPR1B	26	40
COc1cccc(-n2cc(C(=O)NC(C)(C)CCN3CCCCCC3)nn2)c1	ZINC000450998511	GG	On-Demand	Anodyne	CHRNA7	17	44
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450998512	FF	On-Demand	Anodyne	CA1	29	49
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450998512	FF	On-Demand	Anodyne	CA4	29	41
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450998512	FF	On-Demand	Anodyne	MMP2	30	43
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450998512	FF	On-Demand	Anodyne	MMP7	23	42
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450998512	FF	On-Demand	Anodyne	ADAMTS4	50	38
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450998512	FF	On-Demand	Anodyne	LEF	58	41
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450998512	FF	On-Demand	Anodyne	IDO1	31	41
CC[C@H](NS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1)C(F)(F)F	ZINC000450998512	FF	On-Demand	Anodyne	AADAC	0	42
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)c1	ZINC000450998514	GH	On-Demand	Anodyne	CHRNA2	43	45
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)c1	ZINC000450998514	GH	On-Demand	Anodyne	CASP3	54	41
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)c1	ZINC000450998514	GH	On-Demand	Anodyne	CASP7	38	41
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)c1	ZINC000450998514	GH	On-Demand	Anodyne	CRTY	0	45
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)c1	ZINC000450998515	GH	On-Demand	Anodyne	CHRNA2	43	45
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)c1	ZINC000450998515	GH	On-Demand	Anodyne	CASP3	54	41
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)c1	ZINC000450998515	GH	On-Demand	Anodyne	CASP7	38	41
COc1cc(C(F)(F)F)cc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)c1	ZINC000450998515	GH	On-Demand	Anodyne	CRTY	0	45
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	CA2	20	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	CA1	26	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	HTR6	15	46
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	COLA	50	35
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	GRM4	22	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	MMP2	20	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	PRTN3	55	34
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	CA12	17	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	CA9	17	48
CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000450998521	GG	On-Demand	Anodyne	LIMK2	47	39
Cc1cc(OCc2cccc(F)c2)ccc1NS(=O)(=O)CCCCF	ZINC000450998523	FI	On-Demand	Anodyne	MAOB	31	46
Cc1cc(OCc2cccc(F)c2)ccc1NS(=O)(=O)CCCCF	ZINC000450998523	FI	On-Demand	Anodyne	FFAR1	42	40
COC(=O)c1ccc2c(c1)CCCN2S(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450998525	GG	On-Demand	Anodyne	SRD5A1	42	47
COC(=O)c1ccc2c(c1)CCCN2S(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450998525	GG	On-Demand	Anodyne	CNR1	52	32
COC(=O)c1ccc2c(c1)CCCN2S(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450998525	GG	On-Demand	Anodyne	SRD5A2	24	45
COC(=O)c1ccc2c(c1)CCCN2S(=O)(=O)c1ccc2c(c1)CCCC2=O	ZINC000450998525	GG	On-Demand	Anodyne	CYP11B2	29	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998526	GH	On-Demand	Anodyne	MMP13	45	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998526	GH	On-Demand	Anodyne	CA4	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998526	GH	On-Demand	Anodyne	CA14	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998526	GH	On-Demand	Anodyne	MMP2	38	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998526	GH	On-Demand	Anodyne	MMP9	21	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998526	GH	On-Demand	Anodyne	LEF	56	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998526	GH	On-Demand	Anodyne	AADAC	0	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998529	GH	On-Demand	Anodyne	MMP13	45	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998529	GH	On-Demand	Anodyne	CA4	18	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998529	GH	On-Demand	Anodyne	CA14	15	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998529	GH	On-Demand	Anodyne	MMP2	38	42
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998529	GH	On-Demand	Anodyne	MMP9	21	41
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998529	GH	On-Demand	Anodyne	LEF	56	44
CC(C)C(=O)Nc1ccc(S(=O)(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1	ZINC000450998529	GH	On-Demand	Anodyne	AADAC	0	41
CC1(CN2CCCN(c3ccccc3Cl)CC2)COC1	ZINC000450998532	CF	On-Demand	Anodyne	DRD3	22	41
CC1(CN2CCCN(c3ccccc3Cl)CC2)COC1	ZINC000450998532	CF	On-Demand	Anodyne	KCNQ2	40	37
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc(CC#N)cc1Cl	ZINC000450998545	ED	On-Demand	Mild	CAN2	0	45
C=Cc1ccc(S(=O)(=O)NCCN2CCCC2)cc1	ZINC000450998559	CD	On-Demand	Anodyne	HTR7	22	45
OC[C@H]1CC[C@H](CO)N1Cc1ccn(CCc2ccccc2)n1	ZINC000450998560	DD	On-Demand	Anodyne	SLC18A2	47	40
Cc1cc(C(=O)NCC(C)C)ccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450998569	GH	On-Demand	Anodyne	F3	53	32
Cc1cc(C(=O)NCC(C)C)ccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450998569	GH	On-Demand	Anodyne	PTGDR	23	44
Cc1cc(C(=O)NCC(C)C)ccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450998569	GH	On-Demand	Anodyne	ITGAV	53	43
Cc1cc(C(=O)NCC(C)C)ccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450998569	GH	On-Demand	Anodyne	PTGDR2	19	44
Cc1ncsc1CCS(=O)(=O)NCCCN1CCCCC1	ZINC000450998584	ED	On-Demand	Anodyne	HNMT	54	33
CCOC(=O)c1cc(C(=O)NCc2ccccc2N(C)C(C)C)on1	ZINC000450998588	EF	On-Demand	Anodyne	NPR	48	32
COc1ccc(C)cc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998589	GG	On-Demand	Anodyne	TBXA2R	33	43
COc1ccc(C)cc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998589	GG	On-Demand	Anodyne	CA1	20	44
COc1ccc(C)cc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998589	GG	On-Demand	Anodyne	CA14	19	42
COc1ccc(C)cc1CCNS(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450998589	GG	On-Demand	Anodyne	IAP	0	40
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)CCCC(=O)C1CC1	ZINC000450998597	CD	On-Demand	Anodyne	PREP	15	40
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)CCCC(=O)C1CC1	ZINC000450998598	CD	On-Demand	Anodyne	PREP	15	40
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)CCCC(=O)C1CC1	ZINC000450998600	CD	On-Demand	Anodyne	PREP	15	40
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)CCCC(=O)C1CC1	ZINC000450998602	CD	On-Demand	Anodyne	PREP	15	40
Cc1cc(C(=O)NCC(C)C)ccc1NS(=O)(=O)c1cccc2ccoc12	ZINC000450998607	GH	On-Demand	Anodyne	ITGAV	67	40
Cc1cc(C(=O)NCC(C)C)ccc1NS(=O)(=O)c1cccc2ccoc12	ZINC000450998607	GH	On-Demand	Anodyne	ITGA2	0	40
COC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)CCCC3=O)cc1C	ZINC000450998614	FG	On-Demand	Anodyne	PKM	45	44
COc1cccc(-n2cc(C(=O)N3CCCCC(C)(C)C3)nn2)c1	ZINC000450998617	EF	On-Demand	Anodyne	CCKAR	22	40
CC(C)(C)NC(=O)CNS(=O)(=O)c1ccc2ccccc2c1F	ZINC000450998619	EE	On-Demand	Anodyne	KCNJ11	51	34
Cc1cc(C(=O)N2CCCC2)ccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450998621	GG	On-Demand	Anodyne	L3MBTL3	40	33
Cc1cc(C(=O)N2CCCC2)ccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450998621	GG	On-Demand	Anodyne	HPGD	42	36
CC(C)N(C)c1ccccc1CNC(=O)CCc1ccc(C(N)=O)cc1	ZINC000450998623	FF	On-Demand	Anodyne	FURIN	42	32
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc2nnc(C(C)C)n2c1	ZINC000450998638	FI	On-Demand	Anodyne	SORT1	15	40
Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc2nnc(C(C)C)n2c1	ZINC000450998638	FI	On-Demand	Anodyne	MTTP	49	33
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	ACE	21	48
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	TYR	15	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	SSTR2	27	43
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	GNRHR	0	43
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	GHRHR	30	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MME	27	47
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	EDNRB	55	39
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	EDNRA	43	43
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	TACR1	27	54
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MC4R	42	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	CCKAR	99	42
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	CTSL	31	43
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	BRS3	26	50
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	TIMP3	15	52
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	NMBR	29	51
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MC3R	60	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MC5R	59	36
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MMP2	27	46
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MMP8	43	46
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	GRIA1	20	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MMP14	24	47
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	GRPR	77	39
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	ECE1	62	45
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	LNPEP	27	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	SSTR3	28	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MMP11	74	38
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	CCKBR	79	43
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	GHSR	78	46
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MMP9	26	52
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MC1R	76	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	ADAM9	45	46
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	AKT1	42	35
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MMP7	15	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	MMP1	22	46
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	NPR	34	47
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	ADAM12	15	46
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	SSSIM	27	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	SLC15A2	0	58
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	KISS1R	71	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	ERAP2	46	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	ERAP1	0	41
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	LASB	0	52
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	NRDE	0	40
CNS(=O)(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC	ZINC000450998649	FB	On-Demand	Anodyne	IL1RN	0	40
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	HTR1A	84	50
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	DRD2	76	52
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	DRD1	38	47
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	DRD4	55	47
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	ADRA1D	35	45
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	HTR2A	46	39
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	HTR2C	30	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	ADRA1A	40	45
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	ADRA1B	30	52
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	DRD3	85	46
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	HTR7	75	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	KCNQ2	67	42
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	NOX4	43	33
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	NOX1	58	36
O=C(CCN1CCCN(c2ccccc2Cl)CC1)N1CCCCC1	ZINC000450998650	EG	On-Demand	Anodyne	NOX5	56	36
COCCOc1ncccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450998651	EF	On-Demand	Anodyne	PRTN3	55	35
CC(C)(CC#N)CS(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450998674	GE	On-Demand	Mild	EPHX2	43	55
CC(C)(CC#N)CS(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450998674	GE	On-Demand	Mild	CACNA1G	40	41
CC(C)(CC#N)CS(=O)(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000450998674	GE	On-Demand	Mild	TMPRSS11D	47	34
CC(C)(CCN1CCCCCC1)NC(=O)c1cn(CC2CC2)nn1	ZINC000450998675	EE	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)NC(=O)CNS(=O)(=O)CCOCc1ccccc1	ZINC000450998677	ED	On-Demand	Anodyne	MMP12	15	49
Clc1cnc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450998686	EI	On-Demand	Anodyne	HTR1A	29	46
Clc1cnc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450998686	EI	On-Demand	Anodyne	DRD2	37	50
Clc1cnc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450998686	EI	On-Demand	Anodyne	DRD4	40	50
Clc1cnc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450998686	EI	On-Demand	Anodyne	ADRA1D	17	46
Clc1cnc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450998686	EI	On-Demand	Anodyne	ADRA1A	15	46
Clc1cnc(CN2CCCN(c3ccccc3Cl)CC2)s1	ZINC000450998686	EI	On-Demand	Anodyne	DRD3	40	50
C[C@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998687	EF	On-Demand	Anodyne	HTR1A	32	49
C[C@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998687	EF	On-Demand	Anodyne	DRD2	27	46
C[C@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998687	EF	On-Demand	Anodyne	ADRA1D	22	43
C[C@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998687	EF	On-Demand	Anodyne	ADRA1B	22	49
C[C@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998687	EF	On-Demand	Anodyne	DRD3	29	42
C[C@@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998688	EF	On-Demand	Anodyne	HTR1A	32	49
C[C@@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998688	EF	On-Demand	Anodyne	DRD2	27	46
C[C@@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998688	EF	On-Demand	Anodyne	ADRA1D	22	43
C[C@@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998688	EF	On-Demand	Anodyne	ADRA1B	22	49
C[C@@H]1COCCN1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998688	EF	On-Demand	Anodyne	DRD3	29	42
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)c1	ZINC000450998695	GG	On-Demand	Anodyne	MMP9	15	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)c1	ZINC000450998695	GG	On-Demand	Anodyne	NR1I2	20	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)c1	ZINC000450998695	GG	On-Demand	Anodyne	NR1H2	27	46
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)c1	ZINC000450998696	GG	On-Demand	Anodyne	MMP9	15	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)c1	ZINC000450998696	GG	On-Demand	Anodyne	NR1I2	20	40
COc1cc(C(F)(F)F)cc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)c1	ZINC000450998696	GG	On-Demand	Anodyne	NR1H2	27	46
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	HTR1A	73	48
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	DRD2	73	52
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	DRD1	39	43
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	DRD4	34	42
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	ADRA1D	28	50
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	HTR2A	47	41
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	HTR2C	19	50
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	SLC6A4	17	52
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	ADRA1A	38	44
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	ADRA1B	30	50
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	DRD3	72	44
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	HTR7	64	43
C=CCOCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998731	DG	On-Demand	Mild	HRH3	48	42
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	HTR1A	61	50
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	DRD2	64	51
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	DRD1	35	47
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	DRD4	31	41
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	ADRA1D	24	52
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	HTR2A	36	40
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	SLC6A4	15	51
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	ADRA1A	30	46
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	ADRA1B	26	52
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	DRD3	67	44
C=CCOCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450998745	CG	On-Demand	Mild	HTR7	52	40
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3sccc3[C@H]2C)cc1	ZINC000450998746	GH	On-Demand	Anodyne	F13A1	49	33
CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCc3sccc3[C@@H]2C)cc1	ZINC000450998747	GH	On-Demand	Anodyne	F13A1	49	33
CN(C)C[C@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1ccccc1	ZINC000450998765	EG	On-Demand	Anodyne	BDKRB1	22	42
CN(C)C[C@@H](NS(=O)(=O)c1ccc(C2CC2)cc1)c1ccccc1	ZINC000450998766	EG	On-Demand	Anodyne	BDKRB1	22	42
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450998780	GE	On-Demand	Anodyne	EPHX2	46	60
Cc1ccncc1S(=O)(=O)N1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000450998780	GE	On-Demand	Anodyne	CCR8	52	34
CC[C@H]1c2ccsc2CCN1C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998787	FH	On-Demand	Anodyne	TRPM8	16	40
CC[C@@H]1c2ccsc2CCN1C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998788	FH	On-Demand	Anodyne	TRPM8	16	40
CC[C@H]1c2ccsc2CCN1C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998789	FH	On-Demand	Anodyne	TRPM8	16	40
CC[C@@H]1c2ccsc2CCN1C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998790	FH	On-Demand	Anodyne	TRPM8	16	40
CCc1ccc([C@@H](C)NC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998791	FH	On-Demand	Anodyne	PRCP	22	42
CCc1ccc([C@@H](C)NC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998791	FH	On-Demand	Anodyne	BIRC2	50	33
CCc1ccc([C@H](C)NC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998792	FH	On-Demand	Anodyne	PRCP	22	42
CCc1ccc([C@H](C)NC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998792	FH	On-Demand	Anodyne	BIRC2	50	33
CCc1ccc([C@@H](C)NC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998793	FH	On-Demand	Anodyne	PRCP	22	42
CCc1ccc([C@@H](C)NC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998793	FH	On-Demand	Anodyne	BIRC2	50	33
CCc1ccc([C@H](C)NC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998794	FH	On-Demand	Anodyne	PRCP	22	42
CCc1ccc([C@H](C)NC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998794	FH	On-Demand	Anodyne	BIRC2	50	33
CCN(C[C@H]1COc2ccccc2O1)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998797	GF	On-Demand	Anodyne	ADRA2B	22	41
CCN(C[C@H]1COc2ccccc2O1)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998797	GF	On-Demand	Anodyne	ADRA2C	17	41
CCN(C[C@H]1COc2ccccc2O1)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998798	GF	On-Demand	Anodyne	ADRA2B	22	41
CCN(C[C@H]1COc2ccccc2O1)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998798	GF	On-Demand	Anodyne	ADRA2C	17	41
CCN(C[C@@H]1COc2ccccc2O1)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998799	GF	On-Demand	Anodyne	ADRA2B	22	41
CCN(C[C@@H]1COc2ccccc2O1)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998799	GF	On-Demand	Anodyne	ADRA2C	17	41
CCN(C[C@@H]1COc2ccccc2O1)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998800	GF	On-Demand	Anodyne	ADRA2B	22	41
CCN(C[C@@H]1COc2ccccc2O1)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998800	GF	On-Demand	Anodyne	ADRA2C	17	41
CCN(CC)Cc1cccc(NS(=O)(=O)c2sccc2Cl)c1	ZINC000450998891	FI	On-Demand	Anodyne	NR1I2	43	34
N#C[C@@H](c1ccccc1)N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450998892	GF	On-Demand	Mild	PTAFR	40	41
N#C[C@H](c1ccccc1)N1CCN(S(=O)(=O)c2sccc2Cl)CC1	ZINC000450998893	GF	On-Demand	Mild	PTAFR	40	41
Cc1ccc(CC(=O)NCCN2CCCOCC2)c(Br)c1	ZINC000450998899	FE	On-Demand	Anodyne	MMP2	20	40
Cc1ccc(CC(=O)NCCN2CCCOCC2)c(Br)c1	ZINC000450998899	FE	On-Demand	Anodyne	EPHX2	16	40
Cc1ccc(CC(=O)NCCN2CCCOCC2)c(Br)c1	ZINC000450998899	FE	On-Demand	Anodyne	HPGDS	24	43
COC(=O)C[C@@H](NS(=O)(=O)C1(C)CC1)c1ccccc1	ZINC000450998900	CD	On-Demand	Anodyne	KCNA5	34	42
COC(=O)C[C@H](NS(=O)(=O)C1(C)CC1)c1ccccc1	ZINC000450998901	CD	On-Demand	Anodyne	KCNA5	34	42
Cc1ccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1C	ZINC000450998902	DH	On-Demand	Anodyne	DRD4	22	47
Cc1ccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1C	ZINC000450998902	DH	On-Demand	Anodyne	ENPP1	40	32
Cc1ccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1C	ZINC000450998903	DH	On-Demand	Anodyne	DRD4	22	47
Cc1ccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1C	ZINC000450998903	DH	On-Demand	Anodyne	ENPP1	40	32
COCCOCCOc1ccc(CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998905	FH	On-Demand	Anodyne	HRH3	32	42
COCCOCCOc1ccc(CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998906	FH	On-Demand	Anodyne	HRH3	32	42
O=C(Cc1cc2ccccc2s1)NCCc1ccc(OCC(F)(F)F)nc1	ZINC000450998907	GI	On-Demand	Anodyne	SCN9A	0	47
O=C(CCN1CCC[C@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998908	EH	On-Demand	Anodyne	DRD4	0	46
O=C(CCN1CCC[C@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998908	EH	On-Demand	Anodyne	SLC6A1	53	40
O=C(CCN1CCC[C@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998908	EH	On-Demand	Anodyne	PRCP	32	46
O=C(CCN1CCC[C@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998908	EH	On-Demand	Anodyne	CCR3	21	40
O=C(CCN1CCC[C@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998908	EH	On-Demand	Anodyne	GRM5	17	44
O=C(CCN1CCC[C@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998908	EH	On-Demand	Anodyne	MCHR1	57	43
O=C(CCN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998909	EH	On-Demand	Anodyne	DRD4	0	46
O=C(CCN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998909	EH	On-Demand	Anodyne	SLC6A1	53	40
O=C(CCN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998909	EH	On-Demand	Anodyne	PRCP	32	46
O=C(CCN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998909	EH	On-Demand	Anodyne	CCR3	21	40
O=C(CCN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998909	EH	On-Demand	Anodyne	GRM5	17	44
O=C(CCN1CCC[C@@H](c2ccncc2)C1)Nc1cccc(Cl)c1	ZINC000450998909	EH	On-Demand	Anodyne	MCHR1	57	43
O=S(=O)(Nc1cccc(CN2CCOCC2)c1)c1cc2cc(F)ccc2o1	ZINC000450998921	GG	On-Demand	Anodyne	CCR3	15	42
Cc1ccc(C(=O)NCCN2CCCOCC2)c2c1CCC2	ZINC000450998922	DD	On-Demand	Anodyne	CNR1	27	45
Cc1ccc(C(=O)NCCN2CCCOCC2)c2c1CCC2	ZINC000450998922	DD	On-Demand	Anodyne	DRD4	45	37
Cc1ccc(C(=O)NCCN2CCCOCC2)c2c1CCC2	ZINC000450998922	DD	On-Demand	Anodyne	PTGDS	45	39
Cc1ccc(C(=O)NCCN2CCCOCC2)c2c1CCC2	ZINC000450998922	DD	On-Demand	Anodyne	PLD2	46	33
Cc1ccc(C(=O)NCCN2CCCOCC2)c2c1CCC2	ZINC000450998922	DD	On-Demand	Anodyne	HPGDS	27	48
COc1cccc(-n2cc(C(=O)NCC(C)(C)C(C)C)nn2)c1	ZINC000450998941	DF	On-Demand	Anodyne	DRD4	44	34
COc1cccc(-n2cc(C(=O)NCC(C)(C)C(C)C)nn2)c1	ZINC000450998941	DF	On-Demand	Anodyne	ESRRA	22	42
CSc1ccc(NC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450998946	EH	On-Demand	Anodyne	DRD4	0	42
CSc1ccc(NC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450998947	EH	On-Demand	Anodyne	DRD4	0	42
CC(C)Oc1cccc(CNC(=O)Cn2cncc(F)c2=O)c1	ZINC000450998953	DD	On-Demand	Anodyne	NR5A1	29	42
CN1CCC[C@@H]1CCN1CCC[C@H](c2ccncc2)C1	ZINC000450998966	CF	On-Demand	Anodyne	CHRNA10	51	38
CN1CCC[C@@H]1CCN1CCC[C@@H](c2ccncc2)C1	ZINC000450998967	CF	On-Demand	Anodyne	CHRNA10	51	38
CN1CCC[C@H]1CCN1CCC[C@H](c2ccncc2)C1	ZINC000450998968	CF	On-Demand	Anodyne	CHRNA10	51	38
CN1CCC[C@H]1CCN1CCC[C@@H](c2ccncc2)C1	ZINC000450998973	CF	On-Demand	Anodyne	CHRNA10	51	38
COCCc1ccc(S(=O)(=O)Nc2ccccc2S(=O)(=O)N(C)C)cc1	ZINC000450998974	GD	On-Demand	Anodyne	PRTN3	59	35
COCCc1ccc(S(=O)(=O)Nc2ccccc2S(=O)(=O)N(C)C)cc1	ZINC000450998974	GD	On-Demand	Anodyne	LIMK2	39	43
CCNC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450998980	GD	On-Demand	Anodyne	EPHX2	22	46
CCNC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450998980	GD	On-Demand	Anodyne	TGM2	88	51
CCNC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450998980	GD	On-Demand	Anodyne	F13A1	114	51
CCNC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450998980	GD	On-Demand	Anodyne	NAMPT	51	44
CCNC(=O)N1CCN(S(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000450998980	GD	On-Demand	Anodyne	TGM6	0	41
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998984	FI	On-Demand	Anodyne	OPRK1	0	40
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998984	FI	On-Demand	Anodyne	PRCP	28	43
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998984	FI	On-Demand	Anodyne	CCR1	34	42
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998986	FI	On-Demand	Anodyne	OPRK1	0	40
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998986	FI	On-Demand	Anodyne	PRCP	28	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450998986	FI	On-Demand	Anodyne	CCR1	34	42
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998989	FI	On-Demand	Anodyne	OPRK1	0	40
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998989	FI	On-Demand	Anodyne	PRCP	28	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998989	FI	On-Demand	Anodyne	CCR1	34	42
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998990	FI	On-Demand	Anodyne	OPRK1	0	40
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998990	FI	On-Demand	Anodyne	PRCP	28	43
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450998990	FI	On-Demand	Anodyne	CCR1	34	42
N#C[C@@H](c1ccccc1)N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450998994	GE	On-Demand	Mild	PTAFR	42	43
N#C[C@H](c1ccccc1)N1CCN(S(=O)(=O)CCOCc2ccccc2)CC1	ZINC000450998996	GE	On-Demand	Mild	PTAFR	42	43
Cn1c(CN2CCC[C@H](c3ccncc3)C2)nc2ccc(Br)cc21	ZINC000450998997	GI	On-Demand	Anodyne	GRM2	25	48
Cn1c(CN2CCC[C@@H](c3ccncc3)C2)nc2ccc(Br)cc21	ZINC000450998999	GI	On-Demand	Anodyne	GRM2	25	48
O=S(=O)(Cc1c(F)cccc1Cl)N1CCN(c2cccc(O)c2)CC1	ZINC000450999008	GF	On-Demand	Anodyne	ME1	0	41
CCc1ccc(CN(C)C(=O)Cn2cncc(F)c2=O)cc1	ZINC000450999009	DD	On-Demand	Anodyne	PLA2G7	55	40
CCOc1ccc(S(=O)(=O)Nc2ccccc2S(=O)(=O)N(C)C)c(C)c1	ZINC000450999014	GE	On-Demand	Anodyne	PRTN3	44	34
COc1ccc(CN2CCN(S(=O)(=O)C3(C)CC3)CC2)c(OC)c1OC	ZINC000450999015	GD	On-Demand	Anodyne	SLC9A1	66	40
N#CC1(CCCN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450999022	FH	On-Demand	Mild	HTR1A	35	48
N#CC1(CCCN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450999022	FH	On-Demand	Mild	DRD2	25	46
N#CC1(CCCN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450999022	FH	On-Demand	Mild	ADRA1D	23	48
N#CC1(CCCN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450999022	FH	On-Demand	Mild	HTR2A	23	40
N#CC1(CCCN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450999022	FH	On-Demand	Mild	ADRA1A	23	42
N#CC1(CCCN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450999022	FH	On-Demand	Mild	ADRA1B	23	48
N#CC1(CCCN2CCCN(c3ccccc3Cl)CC2)CCOCC1	ZINC000450999022	FH	On-Demand	Mild	DRD3	33	40
Cc1cccc(Cl)c1C(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1	ZINC000450999023	GG	On-Demand	Anodyne	CALCA	0	42
CCOc1ccc(OC[C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450999024	FG	On-Demand	Anodyne	ACOX1	63	33
CCOc1ccc(OC[C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450999024	FG	On-Demand	Anodyne	CYP2D6	23	41
CCOc1ccc(OC[C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450999024	FG	On-Demand	Anodyne	CACNA2D2	49	31
CCOc1ccc(OC[C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450999024	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCOc1ccc(OC[C@@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450999025	FG	On-Demand	Anodyne	ACOX1	63	33
CCOc1ccc(OC[C@@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450999025	FG	On-Demand	Anodyne	CYP2D6	23	41
CCOc1ccc(OC[C@@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450999025	FG	On-Demand	Anodyne	CACNA2D2	49	31
CCOc1ccc(OC[C@@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450999025	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCOc1ccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450999026	FG	On-Demand	Anodyne	ACOX1	63	33
CCOc1ccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450999026	FG	On-Demand	Anodyne	CYP2D6	23	41
CCOc1ccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450999026	FG	On-Demand	Anodyne	CACNA2D2	49	31
CCOc1ccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000450999026	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CCOc1ccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450999027	FG	On-Demand	Anodyne	ACOX1	63	33
CCOc1ccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450999027	FG	On-Demand	Anodyne	CYP2D6	23	41
CCOc1ccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450999027	FG	On-Demand	Anodyne	CACNA2D2	49	31
CCOc1ccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000450999027	FG	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
CC1(S(=O)(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000450999028	DF	On-Demand	Anodyne	HRH3	17	46
CCn1cc(CCN2CCCN(c3ccccc3Cl)CC2)cn1	ZINC000450999029	EG	On-Demand	Anodyne	HTR1A	39	44
CCn1cc(CCN2CCCN(c3ccccc3Cl)CC2)cn1	ZINC000450999029	EG	On-Demand	Anodyne	DRD2	48	56
CCn1cc(CCN2CCCN(c3ccccc3Cl)CC2)cn1	ZINC000450999029	EG	On-Demand	Anodyne	DRD3	50	43
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	HTR1A	29	47
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	DRD2	36	50
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	DRD1	28	50
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	DRD4	55	50
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	ADRA1D	22	47
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	HTR2A	17	42
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	ADRA1A	17	47
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	ADRA1B	15	47
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	DRD3	35	50
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	HTR7	19	44
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	NOX4	40	38
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	NOX1	51	38
Cc1ccncc1CN1CCCN(c2ccccc2Cl)CC1	ZINC000450999035	DH	On-Demand	Anodyne	NOX5	47	36
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	HTR1A	50	45
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	DRD2	42	51
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	DRD4	28	40
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	ADRA1D	22	45
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	HTR1D	41	31
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	HTR2A	30	51
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	HTR2C	20	40
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	SLC6A4	17	46
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	ADRA1A	21	45
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	ADRA1B	22	45
Cc1noc(C)c1CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999039	EH	On-Demand	Anodyne	DRD3	45	42
Cc1ccn2ncc(C(=O)NC[C@@]3(O)CCCC(C)(C)C3)c2c1	ZINC000450999045	DF	On-Demand	Anodyne	EPHB3	34	48
Cc1ccn2ncc(C(=O)NC[C@]3(O)CCCC(C)(C)C3)c2c1	ZINC000450999046	DF	On-Demand	Anodyne	EPHB3	34	48
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	HTR1A	81	47
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	DRD2	87	48
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	DRD1	45	36
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	DRD4	56	43
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	ADRA1D	60	41
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	HTR2A	44	39
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	ADRA1A	43	41
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	ADRA1B	38	44
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	DRD3	87	41
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	HTR7	59	38
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	KCNQ2	68	37
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	NOX1	49	33
COC(=O)c1coc(CN2CCCN(c3ccccc3Cl)CC2)c1	ZINC000450999047	EG	On-Demand	Anodyne	NOX5	50	33
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	MMP13	46	44
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	ADAM17	15	44
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	MMP2	35	40
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	MMP3	21	40
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	MMP8	21	41
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	MMP14	19	41
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	MMP9	20	44
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	ADAMTS4	67	40
CC(C)[C@@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999060	FD	On-Demand	Mild	LUXN	0	43
O=S(=O)(NCCN1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450999063	EE	On-Demand	Anodyne	HRP1_PLAFA	40	33
O=S(=O)(NCCN1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450999063	EE	On-Demand	Anodyne	HTR7	24	51
O=S(=O)(NCCN1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450999063	EE	On-Demand	Anodyne	HTR6	25	51
O=S(=O)(NCCN1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450999063	EE	On-Demand	Anodyne	HNMT	81	41
COc1cc(C#N)ccc1Oc1ccc(NS(=O)(=O)CCCCF)cc1	ZINC000450999067	GH	On-Demand	Mild	ESRRA	20	41
Cc1nnc(CN2CCCN(c3ccccc3Cl)CC2)n1C1CC1	ZINC000450999083	EG	On-Demand	Anodyne	DRD2	24	40
Cc1nnc(CN2CCCN(c3ccccc3Cl)CC2)n1C1CC1	ZINC000450999083	EG	On-Demand	Anodyne	DRD1	0	41
Cc1nnc(CN2CCCN(c3ccccc3Cl)CC2)n1C1CC1	ZINC000450999083	EG	On-Demand	Anodyne	DRD4	36	42
Cc1nnc(CN2CCCN(c3ccccc3Cl)CC2)n1C1CC1	ZINC000450999083	EG	On-Demand	Anodyne	DRD3	24	43
Cc1nnc(CN2CCCN(c3ccccc3Cl)CC2)n1C1CC1	ZINC000450999083	EG	On-Demand	Anodyne	NOX1	47	31
Cc1nnc(CN2CCCN(c3ccccc3Cl)CC2)n1C1CC1	ZINC000450999083	EG	On-Demand	Anodyne	NOX5	43	31
CC(C)C(C)(C)CNC(=O)c1cncc(Cl)c1	ZINC000450999087	CG	On-Demand	Anodyne	CACNA1I	44	36
Cc1cccc(Cl)c1C(=O)NCCN1C(=O)NC2(CCCC2)C1=O	ZINC000450999088	EE	On-Demand	Anodyne	DRD4	41	33
COc1cccc(-n2cc(C(=O)NCc3ccccc3N(C)C(C)C)nn2)c1	ZINC000450999089	GG	On-Demand	Anodyne	DRD4	41	32
COc1cccc(-n2cc(C(=O)NCc3ccccc3N(C)C(C)C)nn2)c1	ZINC000450999089	GG	On-Demand	Anodyne	ESRRA	23	40
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999106	GH	On-Demand	Anodyne	ACOX1	57	36
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999106	GH	On-Demand	Anodyne	CYP2D6	0	47
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999106	GH	On-Demand	Anodyne	CHRNA10	19	44
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999106	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999106	GH	On-Demand	Anodyne	PDS	41	36
Cc1cc(C(=O)Nc2ccccc2CCN(C)C)nn1C(C)C	ZINC000450999107	DG	On-Demand	Anodyne	KCNQ2	44	33
CCOC(=O)c1cnn(C)c1NS(=O)(=O)c1sccc1Cl	ZINC000450999108	EE	On-Demand	Anodyne	ILV2	0	41
Clc1ccccc1N1CCCN(Cc2cn3ccsc3n2)CC1	ZINC000450999112	EH	On-Demand	Anodyne	HTR1A	16	50
Clc1ccccc1N1CCCN(Cc2cn3ccsc3n2)CC1	ZINC000450999112	EH	On-Demand	Anodyne	DRD2	24	50
Clc1ccccc1N1CCCN(Cc2cn3ccsc3n2)CC1	ZINC000450999112	EH	On-Demand	Anodyne	DRD1	0	45
Clc1ccccc1N1CCCN(Cc2cn3ccsc3n2)CC1	ZINC000450999112	EH	On-Demand	Anodyne	DRD4	29	45
Clc1ccccc1N1CCCN(Cc2cn3ccsc3n2)CC1	ZINC000450999112	EH	On-Demand	Anodyne	DRD3	27	50
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999114	GH	On-Demand	Anodyne	ACOX1	57	36
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999114	GH	On-Demand	Anodyne	CYP2D6	0	47
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999114	GH	On-Demand	Anodyne	CHRNA10	19	44
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999114	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999114	GH	On-Demand	Anodyne	PDS	41	36
CC(C)(CCN1CCCCCC1)NC(=O)c1ccnn1CC(F)(F)F	ZINC000450999117	FG	On-Demand	Anodyne	HNMT	40	31
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999123	GH	On-Demand	Anodyne	ACOX1	57	36
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999123	GH	On-Demand	Anodyne	CYP2D6	0	47
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999123	GH	On-Demand	Anodyne	CHRNA10	19	44
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999123	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
O[C@@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999123	GH	On-Demand	Anodyne	PDS	41	36
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999126	GH	On-Demand	Anodyne	ACOX1	57	36
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999126	GH	On-Demand	Anodyne	CYP2D6	0	47
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999126	GH	On-Demand	Anodyne	CHRNA10	19	44
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999126	GH	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999126	GH	On-Demand	Anodyne	PDS	41	36
CC1(C)CCCCN(C(=O)CCc2ccc(C(N)=O)cc2)C1	ZINC000450999127	DF	On-Demand	Anodyne	GPBAR1	21	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@H]1CCOc2ccccc21	ZINC000450999148	GG	On-Demand	Anodyne	HTR1A	32	51
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@H]1CCOc2ccccc21	ZINC000450999148	GG	On-Demand	Anodyne	DRD2	32	51
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@H]1CCOc2ccccc21	ZINC000450999148	GG	On-Demand	Anodyne	DRD4	27	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@H]1CCOc2ccccc21	ZINC000450999148	GG	On-Demand	Anodyne	HTR1B	17	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@H]1CCOc2ccccc21	ZINC000450999148	GG	On-Demand	Anodyne	DRD3	46	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@H]1CCOc2ccccc21	ZINC000450999148	GG	On-Demand	Anodyne	HTR7	21	51
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@H]1CCOc2ccccc21	ZINC000450999148	GG	On-Demand	Anodyne	BDKRB1	35	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@H]1CCOc2ccccc21	ZINC000450999148	GG	On-Demand	Anodyne	TRAR	46	33
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450999150	GG	On-Demand	Anodyne	HTR1A	32	51
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450999150	GG	On-Demand	Anodyne	DRD2	32	51
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450999150	GG	On-Demand	Anodyne	DRD4	27	43
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450999150	GG	On-Demand	Anodyne	HTR1B	17	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450999150	GG	On-Demand	Anodyne	DRD3	46	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450999150	GG	On-Demand	Anodyne	HTR7	21	51
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450999150	GG	On-Demand	Anodyne	BDKRB1	35	42
O=C(CN1CCCN(c2ccccc2Cl)CC1)N[C@@H]1CCOc2ccccc21	ZINC000450999150	GG	On-Demand	Anodyne	TRAR	46	33
COc1cnc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450999169	GC	On-Demand	Anodyne	BMP1	51	39
COc1cnc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450999169	GC	On-Demand	Anodyne	MMP13	61	39
COc1cnc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450999169	GC	On-Demand	Anodyne	MMP3	49	42
COc1cnc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450999169	GC	On-Demand	Anodyne	MMP9	54	39
COc1cnc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450999169	GC	On-Demand	Anodyne	MMP1	52	39
COc1cnc(N(C)S(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)nc1	ZINC000450999169	GC	On-Demand	Anodyne	LUXN	0	43
CCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450999174	FE	On-Demand	Anodyne	DRD2	28	40
CCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450999174	FE	On-Demand	Anodyne	HTR2A	18	47
CCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450999174	FE	On-Demand	Anodyne	ERG2	19	40
CCS(=O)(=O)N1CCN(CCCC(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000450999174	FE	On-Demand	Anodyne	CYP2J2	49	36
Cc1ccc2cc(S(=O)(=O)NCCCN3CCCC3)ccc2c1	ZINC000450999177	EF	On-Demand	Anodyne	HTR7	42	59
Cc1ccc2cc(S(=O)(=O)NCCCN3CCCC3)ccc2c1	ZINC000450999177	EF	On-Demand	Anodyne	HTR6	26	53
CNC(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450999187	GF	On-Demand	Anodyne	HTR1A	34	42
CNC(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450999187	GF	On-Demand	Anodyne	DRD2	42	40
CNC(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450999187	GF	On-Demand	Anodyne	DRD4	37	44
CNC(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450999187	GF	On-Demand	Anodyne	ADRA1D	18	47
CNC(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450999187	GF	On-Demand	Anodyne	HTR2A	26	40
CNC(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450999187	GF	On-Demand	Anodyne	ADRA1A	17	47
CNC(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450999187	GF	On-Demand	Anodyne	DRD3	52	38
CNC(=O)Cc1nc(CN2CCCN(c3ccccc3Cl)CC2)cs1	ZINC000450999187	GF	On-Demand	Anodyne	KCNQ2	63	40
CS(=O)(=O)c1cccc(CS(=O)(=O)NCCc2cccc(F)c2)c1	ZINC000450999190	FD	On-Demand	Anodyne	TBXA2R	26	40
O=C(CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1)NC1CC1	ZINC000450999193	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1)NC1CC1	ZINC000450999193	GD	On-Demand	Anodyne	NPY2R	57	39
O=C(CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1)NC1CC1	ZINC000450999193	GD	On-Demand	Anodyne	EPHX2	21	47
O=C(CN1CCN(S(=O)(=O)c2ccc3ccccc3c2F)CC1)NC1CC1	ZINC000450999193	GD	On-Demand	Anodyne	CCR8	56	35
COC(=O)c1ccc(CC(=O)N2CCCC3(CCCC3)C2)cc1	ZINC000450999201	DG	On-Demand	Anodyne	GPR183	0	40
N#CC1(CN2CCCN(c3ccccc3Cl)CC2)CCC1	ZINC000450999207	DH	On-Demand	Mild	DRD2	16	44
N#CC1(CN2CCCN(c3ccccc3Cl)CC2)CCC1	ZINC000450999207	DH	On-Demand	Mild	ADRA1D	21	50
N#CC1(CN2CCCN(c3ccccc3Cl)CC2)CCC1	ZINC000450999207	DH	On-Demand	Mild	ADRA1B	20	50
N#CC1(CN2CCCN(c3ccccc3Cl)CC2)CCC1	ZINC000450999207	DH	On-Demand	Mild	DRD3	20	41
COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450999210	FG	On-Demand	Anodyne	COLA	40	35
COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450999211	FG	On-Demand	Anodyne	COLA	40	35
COC(=O)[C@H]1C[C@H](C)CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450999213	FG	On-Demand	Anodyne	COLA	40	35
COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)Cc1scnc1-c1ccccc1	ZINC000450999216	FG	On-Demand	Anodyne	COLA	40	35
C[C@H]1Cc2c(ncn2CC(=O)N2CCCC[C@H]2C)C[C@H]1C	ZINC000450999219	CF	On-Demand	Anodyne	COLA	50	34
C[C@H]1CCCCN1C(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450999223	CF	On-Demand	Anodyne	COLA	50	34
C[C@@H]1Cc2ncn(CC(=O)N3CCCC[C@H]3C)c2C[C@H]1C	ZINC000450999225	CF	On-Demand	Anodyne	COLA	50	34
C[C@H]1Cc2c(ncn2CC(=O)N2CCCC[C@@H]2C)C[C@H]1C	ZINC000450999229	CF	On-Demand	Anodyne	COLA	50	34
CSc1cccc(C(=O)Nc2ccccc2CCN(C)C)c1	ZINC000450999244	DH	On-Demand	Anodyne	KCNK3	49	33
Cc1ccn(-c2ccccc2C(=O)N2CCCC3(CCCC3)C2)n1	ZINC000450999247	DH	On-Demand	Anodyne	AVPR2	19	42
NC(=O)CCSc1ccccc1NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000450999256	GG	On-Demand	Anodyne	PRTN3	51	32
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(CCSC)cc1	ZINC000450999267	FF	On-Demand	Anodyne	ADRB2	46	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(CCSC)cc1	ZINC000450999267	FF	On-Demand	Anodyne	ADRB1	30	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(CCSC)cc1	ZINC000450999267	FF	On-Demand	Anodyne	ADRB3	49	42
COC(=O)c1ncccc1S(=O)(=O)Nc1ccc(CCSC)cc1	ZINC000450999267	FF	On-Demand	Anodyne	PTPRB	51	35
CN(C)c1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999270	GD	On-Demand	Anodyne	PRTN3	58	36
CN(C)c1ncccc1NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999270	GD	On-Demand	Anodyne	LUXN	0	45
COCCOCCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450999277	EE	On-Demand	Anodyne	HTR7	15	41
COCCOCCCNS(=O)(=O)c1ccc2cc(C)ccc2c1	ZINC000450999277	EE	On-Demand	Anodyne	NPY1R	20	42
CN(C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)ns1	ZINC000450999281	FF	On-Demand	Anodyne	DRD2	23	41
CN(C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)ns1	ZINC000450999281	FF	On-Demand	Anodyne	DRD1	0	40
CN(C)c1nc(CN2CCCN(c3ccccc3Cl)CC2)ns1	ZINC000450999281	FF	On-Demand	Anodyne	DRD4	22	44
C[C@H](c1ccccc1)[C@H](O)CN1[C@@H](CO)CC[C@@H]1CO	ZINC000450999285	CC	On-Demand	Anodyne	SLC18A2	78	44
C[C@@H](c1ccccc1)[C@H](O)CN1[C@@H](CO)CC[C@@H]1CO	ZINC000450999286	CC	On-Demand	Anodyne	SLC18A2	78	44
C[C@H](c1ccccc1)[C@@H](O)CN1[C@@H](CO)CC[C@@H]1CO	ZINC000450999288	CC	On-Demand	Anodyne	SLC18A2	78	44
C[C@@H](c1ccccc1)[C@@H](O)CN1[C@@H](CO)CC[C@@H]1CO	ZINC000450999289	CC	On-Demand	Anodyne	SLC18A2	78	44
O=C(CC1(O)CCC1)N[C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000450999311	CF	On-Demand	Anodyne	GRIN2B	24	40
O=C(CC1(O)CCC1)N[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000450999312	CF	On-Demand	Anodyne	GRIN2B	24	40
O=C(CC1(O)CCC1)N[C@@H]1CC[C@H](Cc2ccccc2)C1	ZINC000450999313	CF	On-Demand	Anodyne	GRIN2B	24	40
O=C(CC1(O)CCC1)N[C@@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000450999314	CF	On-Demand	Anodyne	GRIN2B	24	40
O=C(CN1CCC[C@H](c2ccncc2)C1)NCCC1CCCCC1	ZINC000450999346	EG	On-Demand	Anodyne	BMP1	41	35
O=C(CN1CCC[C@@H](c2ccncc2)C1)NCCC1CCCCC1	ZINC000450999347	EG	On-Demand	Anodyne	BMP1	41	35
COc1cc(CC(=O)N2C[C@H](C)O[C@H](C)[C@H]2C)ccc1Cl	ZINC000450999352	DF	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2C[C@H](C)O[C@H](C)[C@H]2C)ccc1Cl	ZINC000450999352	DF	On-Demand	Anodyne	SELL	0	41
COc1cc(CC(=O)N2C[C@H](C)O[C@H](C)[C@@H]2C)ccc1Cl	ZINC000450999353	DF	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2C[C@H](C)O[C@H](C)[C@@H]2C)ccc1Cl	ZINC000450999353	DF	On-Demand	Anodyne	SELL	0	41
COc1cc(CC(=O)N2C[C@H](C)O[C@@H](C)[C@@H]2C)ccc1Cl	ZINC000450999354	DF	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2C[C@H](C)O[C@@H](C)[C@@H]2C)ccc1Cl	ZINC000450999354	DF	On-Demand	Anodyne	SELL	0	41
COc1cc(CC(=O)N2C[C@H](C)O[C@@H](C)[C@H]2C)ccc1Cl	ZINC000450999355	DF	On-Demand	Anodyne	OPRK1	37	40
COc1cc(CC(=O)N2C[C@H](C)O[C@@H](C)[C@H]2C)ccc1Cl	ZINC000450999355	DF	On-Demand	Anodyne	SELL	0	41
Cc1ccc2cc(S(=O)(=O)Nc3cccc(CN4CCOCC4)c3)ccc2c1	ZINC000450999368	GH	On-Demand	Anodyne	TRY2_BOVIN	71	41
Cc1ccc2cc(S(=O)(=O)Nc3cccc(CN4CCOCC4)c3)ccc2c1	ZINC000450999368	GH	On-Demand	Anodyne	HTR6	20	48
Cc1ccc2cc(S(=O)(=O)Nc3cccc(CN4CCOCC4)c3)ccc2c1	ZINC000450999368	GH	On-Demand	Anodyne	BDKRB1	20	43
Cc1ccc2cc(S(=O)(=O)Nc3cccc(CN4CCOCC4)c3)ccc2c1	ZINC000450999368	GH	On-Demand	Anodyne	MLNR	15	43
Cc1ccc2cc(S(=O)(=O)Nc3cccc(CN4CCOCC4)c3)ccc2c1	ZINC000450999368	GH	On-Demand	Anodyne	NR1I2	29	40
CC(C)(C)c1cccc(OCCn2cncc(F)c2=O)c1	ZINC000450999386	CF	On-Demand	Anodyne	GALR3	49	32
COC(=O)c1cc2cc(CN3CCC[C@H](c4ccncc4)C3)ccc2o1	ZINC000450999398	FH	On-Demand	Anodyne	HRH3	16	40
COC(=O)c1cc2cc(CN3CCC[C@H](c4ccncc4)C3)ccc2o1	ZINC000450999398	FH	On-Demand	Anodyne	SSTR5	63	39
COC(=O)c1cc2cc(CN3CCC[C@@H](c4ccncc4)C3)ccc2o1	ZINC000450999399	FH	On-Demand	Anodyne	HRH3	16	40
COC(=O)c1cc2cc(CN3CCC[C@@H](c4ccncc4)C3)ccc2o1	ZINC000450999399	FH	On-Demand	Anodyne	SSTR5	63	39
O=[N+]([O-])c1ccc2oc(CN3CCCN(c4ccccc4Cl)CC3)nc2c1	ZINC000450999416	GI	On-Demand	Bother	HTR1A	17	42
O=[N+]([O-])c1ccc2oc(CN3CCCN(c4ccccc4Cl)CC3)nc2c1	ZINC000450999416	GI	On-Demand	Bother	DRD4	19	41
O=C(c1cnn(-c2ccncc2)c1)N1CCN(C2CC2)c2ccc(F)cc21	ZINC000450999441	FG	On-Demand	Anodyne	GPBAR1	44	42
O=S(=O)(c1sccc1Cl)N(Cc1ccc(F)cc1)C1CC1	ZINC000450999476	EH	On-Demand	Anodyne	AVPR1B	0	40
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4ccccn4)CC3)ccc2c1	ZINC000450999499	GG	On-Demand	Anodyne	PDE5A	25	40
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4ccccn4)CC3)ccc2c1	ZINC000450999499	GG	On-Demand	Anodyne	ADORA2B	43	36
Cc1ccc2cc(S(=O)(=O)N3CCN(Cc4ccccn4)CC3)ccc2c1	ZINC000450999499	GG	On-Demand	Anodyne	PKM	35	43
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	HTR1A	91	48
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	DRD2	58	44
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	DRD4	41	49
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	ADRA1D	42	48
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	HTR1D	55	35
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	HTR1B	55	36
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	HTR2A	41	44
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	HTR2C	21	41
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	SLC6A4	20	41
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	ADRA1A	35	48
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	ADRA1B	34	48
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	DRD3	48	43
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	HTR7	68	53
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	GRM2	20	50
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	HIF1A	25	48
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	NOX4	45	38
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	NOX1	59	35
Cn1c(CN2CCCN(c3ccccc3Cl)CC2)nc2ccccc2c1=O	ZINC000450999511	GG	On-Demand	Anodyne	NOX5	56	35
CC(C)(CCN1CCCCCC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450999544	EG	On-Demand	Anodyne	HNMT	44	31
CC(C)(CCN1CCCCCC1)NC(=O)c1ccc(N2CCC2)nc1	ZINC000450999544	EG	On-Demand	Anodyne	HPGDS	31	53
O=S(=O)(NCCN1CCCC1)c1ccc2ccccc2c1F	ZINC000450999547	DE	On-Demand	Anodyne	HTR2A	25	41
O=S(=O)(NCCN1CCCC1)c1ccc2ccccc2c1F	ZINC000450999547	DE	On-Demand	Anodyne	HTR7	26	41
O=S(=O)(NCCN1CCCC1)c1ccc2ccccc2c1F	ZINC000450999547	DE	On-Demand	Anodyne	HTR6	29	46
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999555	EG	On-Demand	Anodyne	ACE	62	42
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999555	EG	On-Demand	Anodyne	MME	24	42
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999555	EG	On-Demand	Anodyne	ADAM17	31	45
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999555	EG	On-Demand	Anodyne	C3AR1	44	33
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999555	EG	On-Demand	Anodyne	ACE2	27	42
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999555	EG	On-Demand	Anodyne	XIAP	30	42
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999555	EG	On-Demand	Anodyne	GPBAR1	23	43
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999555	EG	On-Demand	Anodyne	BIRC2	64	38
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999556	EG	On-Demand	Anodyne	ACE	62	42
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999556	EG	On-Demand	Anodyne	MME	24	42
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999556	EG	On-Demand	Anodyne	ADAM17	31	45
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999556	EG	On-Demand	Anodyne	C3AR1	44	33
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999556	EG	On-Demand	Anodyne	ACE2	27	42
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999556	EG	On-Demand	Anodyne	XIAP	30	42
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999556	EG	On-Demand	Anodyne	GPBAR1	23	43
C[C@@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999556	EG	On-Demand	Anodyne	BIRC2	64	38
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999557	EG	On-Demand	Anodyne	ACE	62	42
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999557	EG	On-Demand	Anodyne	MME	24	42
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999557	EG	On-Demand	Anodyne	ADAM17	31	45
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999557	EG	On-Demand	Anodyne	C3AR1	44	33
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999557	EG	On-Demand	Anodyne	ACE2	27	42
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999557	EG	On-Demand	Anodyne	XIAP	30	42
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999557	EG	On-Demand	Anodyne	GPBAR1	23	43
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@H](c2ccncc2)C1	ZINC000450999557	EG	On-Demand	Anodyne	BIRC2	64	38
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999560	EG	On-Demand	Anodyne	ACE	62	42
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999560	EG	On-Demand	Anodyne	MME	24	42
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999560	EG	On-Demand	Anodyne	ADAM17	31	45
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999560	EG	On-Demand	Anodyne	C3AR1	44	33
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999560	EG	On-Demand	Anodyne	ACE2	27	42
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999560	EG	On-Demand	Anodyne	XIAP	30	42
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999560	EG	On-Demand	Anodyne	GPBAR1	23	43
C[C@H](C(=O)NCCc1ccccc1)N1CCC[C@@H](c2ccncc2)C1	ZINC000450999560	EG	On-Demand	Anodyne	BIRC2	64	38
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	HTR1A	47	40
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	DRD2	49	42
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	DRD1	20	42
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	DRD4	42	42
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	ADRA1D	22	43
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	HTR2A	31	42
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	HTR2C	26	44
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	ADRA1A	21	43
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	DRD3	53	42
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	KCNQ2	42	35
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	NOX1	47	33
CCOC(=O)c1csc(CN2CCCN(c3ccccc3Cl)CC2)n1	ZINC000450999571	GH	On-Demand	Anodyne	NOX5	43	33
O=C(CNS(=O)(=O)CCC1CCCCC1)NCc1ccco1	ZINC000450999577	ED	On-Demand	Anodyne	BMP1	46	39
Cc1csc(S(=O)(=O)Nc2ccc3c(c2)CCCC(=O)N3)c1	ZINC000450999580	EG	On-Demand	Anodyne	PKM	60	54
O=S(=O)(NCCCN1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450999609	FF	On-Demand	Anodyne	HTR7	23	40
O=S(=O)(NCCCN1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450999609	FF	On-Demand	Anodyne	HTR6	28	57
O=S(=O)(NCCCN1CCCC1)c1cccc2c(Cl)ccnc12	ZINC000450999609	FF	On-Demand	Anodyne	HNMT	87	46
COC(=O)c1ncccc1S(=O)(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000450999614	GF	On-Demand	Anodyne	MMP13	37	42
COC(=O)c1ncccc1S(=O)(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000450999614	GF	On-Demand	Anodyne	MMP2	26	42
COC(=O)c1ncccc1S(=O)(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000450999614	GF	On-Demand	Anodyne	MMP3	20	42
COC(=O)c1ncccc1S(=O)(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000450999614	GF	On-Demand	Anodyne	MMP8	25	42
COC(=O)c1ncccc1S(=O)(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000450999614	GF	On-Demand	Anodyne	MMP9	28	42
COC(=O)c1ncccc1S(=O)(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000450999614	GF	On-Demand	Anodyne	MMP1	23	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000450999616	GF	On-Demand	Anodyne	MMP13	37	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000450999616	GF	On-Demand	Anodyne	MMP2	26	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000450999616	GF	On-Demand	Anodyne	MMP3	20	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000450999616	GF	On-Demand	Anodyne	MMP8	25	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000450999616	GF	On-Demand	Anodyne	MMP9	28	42
COC(=O)c1ncccc1S(=O)(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000450999616	GF	On-Demand	Anodyne	MMP1	23	42
C[C@@H](C(=O)NC(C)(C)C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450999623	EG	On-Demand	Anodyne	KCNQ2	84	43
C[C@H](C(=O)NC(C)(C)C)N1CCCN(c2ccccc2Cl)CC1	ZINC000450999624	EG	On-Demand	Anodyne	KCNQ2	84	43
CO[C@H](CS(=O)(=O)N1c2ccccc2C[C@H]1C(N)=O)c1ccccc1	ZINC000450999629	FD	On-Demand	Anodyne	AGTR2	45	33
CO[C@H](CS(=O)(=O)N1c2ccccc2C[C@H]1C(N)=O)c1ccccc1	ZINC000450999629	FD	On-Demand	Anodyne	TPP2	47	37
CO[C@@H](CS(=O)(=O)N1c2ccccc2C[C@H]1C(N)=O)c1ccccc1	ZINC000450999632	FD	On-Demand	Anodyne	AGTR2	45	33
CO[C@@H](CS(=O)(=O)N1c2ccccc2C[C@H]1C(N)=O)c1ccccc1	ZINC000450999632	FD	On-Demand	Anodyne	TPP2	47	37
Clc1ccccc1N1CCCN(Cc2nc(C3CCCC3)no2)CC1	ZINC000450999646	FI	On-Demand	Anodyne	HTR1A	18	41
Clc1ccccc1N1CCCN(Cc2nc(C3CCCC3)no2)CC1	ZINC000450999646	FI	On-Demand	Anodyne	DRD2	23	43
Clc1ccccc1N1CCCN(Cc2nc(C3CCCC3)no2)CC1	ZINC000450999646	FI	On-Demand	Anodyne	DRD4	22	44
Clc1ccccc1N1CCCN(Cc2nc(C3CCCC3)no2)CC1	ZINC000450999646	FI	On-Demand	Anodyne	DRD3	28	44
O=C(CSC1CC1)Nc1cc(Br)ccn1	ZINC000450999651	CF	On-Demand	Anodyne	TYK2	51	37
CC(=O)Nc1ccc(NS(=O)(=O)CCCCF)c(Cl)c1	ZINC000450999655	DF	On-Demand	Anodyne	IDO1	22	40
N#Cc1cccc(COc2ccc(NS(=O)(=O)CCCCF)cc2)c1	ZINC000450999657	FH	On-Demand	Mild	MAOB	20	46
C[C@H]1CCc2ccccc2N1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450999685	GF	On-Demand	Anodyne	AVPR1B	48	33
C[C@H]1CCc2ccccc2N1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450999685	GF	On-Demand	Anodyne	GLMU	0	41
C[C@@H]1CCc2ccccc2N1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450999686	GF	On-Demand	Anodyne	AVPR1B	48	33
C[C@@H]1CCc2ccccc2N1S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450999686	GF	On-Demand	Anodyne	GLMU	0	41
Cc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1F	ZINC000450999690	GF	On-Demand	Anodyne	PKM	21	43
Cc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1F	ZINC000450999690	GF	On-Demand	Anodyne	MCHR1	18	42
Cc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1F	ZINC000450999690	GF	On-Demand	Anodyne	LEF	66	42
Cc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1F	ZINC000450999690	GF	On-Demand	Anodyne	GPR119	0	41
Cc1cc(NS(=O)(=O)c2ccc(OCC(=O)NC3CC3)cc2)ccc1F	ZINC000450999690	GF	On-Demand	Anodyne	LUXN	0	44
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc2ccccc2c1F	ZINC000450999691	FF	On-Demand	Anodyne	MMP7	35	43
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc2ccccc2c1F	ZINC000450999691	FF	On-Demand	Anodyne	CCR8	40	33
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc2ccccc2c1F	ZINC000450999691	FF	On-Demand	Anodyne	MIP	0	40
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc2ccccc2c1F	ZINC000450999692	FF	On-Demand	Anodyne	MMP7	35	43
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc2ccccc2c1F	ZINC000450999692	FF	On-Demand	Anodyne	CCR8	40	33
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc2ccccc2c1F	ZINC000450999692	FF	On-Demand	Anodyne	MIP	0	40
C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999693	FI	On-Demand	Anodyne	PRCP	29	44
C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999693	FI	On-Demand	Anodyne	CCR1	31	43
C[C@H](NC(=O)[C@H](C)N1CCC[C@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999693	FI	On-Demand	Anodyne	ADAM17	0	42
C[C@H](NC(=O)[C@@H](C)N1CCC[C@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999697	FI	On-Demand	Anodyne	PRCP	29	44
C[C@H](NC(=O)[C@@H](C)N1CCC[C@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999697	FI	On-Demand	Anodyne	CCR1	31	43
C[C@H](NC(=O)[C@@H](C)N1CCC[C@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999697	FI	On-Demand	Anodyne	ADAM17	0	42
C[C@H](NC(=O)[C@@H](C)N1CCC[C@@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999701	FI	On-Demand	Anodyne	PRCP	29	44
C[C@H](NC(=O)[C@@H](C)N1CCC[C@@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999701	FI	On-Demand	Anodyne	CCR1	31	43
C[C@H](NC(=O)[C@@H](C)N1CCC[C@@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999701	FI	On-Demand	Anodyne	ADAM17	0	42
C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999703	FI	On-Demand	Anodyne	PRCP	29	44
C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999703	FI	On-Demand	Anodyne	CCR1	31	43
C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](c2ccncc2)C1)c1ccc(Cl)cc1	ZINC000450999703	FI	On-Demand	Anodyne	ADAM17	0	42
O=C(CCN1CCC[C@H](c2ccncc2)C1)N1CCCc2ccccc21	ZINC000450999705	EH	On-Demand	Anodyne	SLC6A1	61	33
O=C(CCN1CCC[C@H](c2ccncc2)C1)N1CCCc2ccccc21	ZINC000450999705	EH	On-Demand	Anodyne	HTR7	17	49
O=C(CCN1CCC[C@@H](c2ccncc2)C1)N1CCCc2ccccc21	ZINC000450999707	EH	On-Demand	Anodyne	SLC6A1	61	33
O=C(CCN1CCC[C@@H](c2ccncc2)C1)N1CCCc2ccccc21	ZINC000450999707	EH	On-Demand	Anodyne	HTR7	17	49
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	HTR1A	54	42
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	DRD2	55	46
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	DRD4	38	45
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	ADRA1D	32	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	HTR2A	40	40
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	HTR2C	29	40
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	SLC6A4	15	40
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	HRH1	15	45
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	ADRA1B	24	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	DRD3	66	44
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	HTR7	61	42
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	KCNQ2	69	42
O=C(CCN1CCCN(c2ccccc2Cl)CC1)Nc1cccnc1	ZINC000450999714	FG	On-Demand	Anodyne	CHRNA7	36	50
CC(C)c1ccccc1NC(=O)Cn1cnc2c1C[C@H](C)[C@H](C)C2	ZINC000450999738	EI	On-Demand	Anodyne	ACAT	0	41
CC(C)c1ccccc1NC(=O)Cn1cnc2c1C[C@H](C)[C@@H](C)C2	ZINC000450999739	EI	On-Demand	Anodyne	ACAT	0	41
CC(C)c1ccccc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@H](C)C2	ZINC000450999740	EI	On-Demand	Anodyne	ACAT	0	41
CC(C)c1ccccc1NC(=O)Cn1cnc2c1C[C@@H](C)[C@@H](C)C2	ZINC000450999741	EI	On-Demand	Anodyne	ACAT	0	41
CCOC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450999742	GF	On-Demand	Anodyne	ACOX1	65	36
CCOC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450999742	GF	On-Demand	Anodyne	ABCB1	51	47
CCOC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450999743	GF	On-Demand	Anodyne	ACOX1	65	36
CCOC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450999743	GF	On-Demand	Anodyne	ABCB1	51	47
CCOC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450999744	GF	On-Demand	Anodyne	ACOX1	65	36
CCOC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450999744	GF	On-Demand	Anodyne	ABCB1	51	47
CCOC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450999745	GF	On-Demand	Anodyne	ACOX1	65	36
CCOC(=O)c1cccc(OC[C@H](O)CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450999745	GF	On-Demand	Anodyne	ABCB1	51	47
COc1ccccc1COC[C@H](O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999748	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COc1ccccc1COC[C@@H](O)CN1CCC[C@H](c2ccncc2)C1	ZINC000450999749	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COc1ccccc1COC[C@@H](O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999750	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COc1ccccc1COC[C@H](O)CN1CCC[C@@H](c2ccncc2)C1	ZINC000450999751	FF	On-Demand	Anodyne	Q8MMZ8_EIMTE	0	42
COc1ccc(CNC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1OC	ZINC000450999752	FF	On-Demand	Anodyne	SSTR5	40	36
COc1ccc(CNC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1OC	ZINC000450999752	FF	On-Demand	Anodyne	NOS2	45	35
COc1ccc(CNC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1OC	ZINC000450999752	FF	On-Demand	Anodyne	ENPP1	51	32
COc1ccc(CNC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1OC	ZINC000450999753	FF	On-Demand	Anodyne	SSTR5	40	36
COc1ccc(CNC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1OC	ZINC000450999753	FF	On-Demand	Anodyne	NOS2	45	35
COc1ccc(CNC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1OC	ZINC000450999753	FF	On-Demand	Anodyne	ENPP1	51	32
C[C@H](CN1CCCCCC1)NC(=O)c1c(Cl)cc(F)cc1Br	ZINC000450999754	GI	On-Demand	Anodyne	P2RX3	28	40
C[C@H](CN1CCCCCC1)NC(=O)c1c(Cl)cc(F)cc1Br	ZINC000450999754	GI	On-Demand	Anodyne	PLD1	52	39
C[C@@H](CN1CCCCCC1)NC(=O)c1c(Cl)cc(F)cc1Br	ZINC000450999755	GI	On-Demand	Anodyne	P2RX3	28	40
C[C@@H](CN1CCCCCC1)NC(=O)c1c(Cl)cc(F)cc1Br	ZINC000450999755	GI	On-Demand	Anodyne	PLD1	52	39
Cc1nc(C2CC2)ccc1C(=O)N1CCN(C2CC2)c2ccc(F)cc21	ZINC000450999760	FI	On-Demand	Anodyne	GPBAR1	45	42
O=C(NCCN1CCCOCC1)c1ccsc1Br	ZINC000450999791	ED	On-Demand	Anodyne	HPGDS	24	42
CNC(=O)c1cccc(CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450999792	DF	On-Demand	Anodyne	BDKRB1	27	42
CNC(=O)c1cccc(CN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000450999792	DF	On-Demand	Anodyne	MCHR1	26	42
CNC(=O)c1cccc(CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450999793	DF	On-Demand	Anodyne	BDKRB1	27	42
CNC(=O)c1cccc(CN2CCC[C@H](c3ccncc3)C2)c1	ZINC000450999793	DF	On-Demand	Anodyne	MCHR1	26	42
Cc1csc(S(=O)(=O)N2CCN(c3cccc(O)c3)CC2)c1	ZINC000450999799	EE	On-Demand	Anodyne	GCKR	18	41
CC1(S(=O)(=O)NCCCOc2ccccc2)CC1	ZINC000450999801	CD	On-Demand	Anodyne	DRD4	20	44
CN([C@](C)(C#N)C1CC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999819	GD	On-Demand	Mild	LUXN	0	47
CN([C@@](C)(C#N)C1CC1)S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999820	GD	On-Demand	Mild	LUXN	0	47
O=C(CCN1CCC[C@H](c2ccncc2)C1)NCC(=O)c1ccccc1	ZINC000450999821	FF	On-Demand	Anodyne	SLC6A1	100	40
O=C(CCN1CCC[C@H](c2ccncc2)C1)NCC(=O)c1ccccc1	ZINC000450999821	FF	On-Demand	Anodyne	PRCP	26	44
O=C(CCN1CCC[C@@H](c2ccncc2)C1)NCC(=O)c1ccccc1	ZINC000450999822	FF	On-Demand	Anodyne	SLC6A1	100	40
O=C(CCN1CCC[C@@H](c2ccncc2)C1)NCC(=O)c1ccccc1	ZINC000450999822	FF	On-Demand	Anodyne	PRCP	26	44
CN(CCN1CCC[C@@H](c2ccncc2)C1)c1ccccc1	ZINC000450999838	CG	On-Demand	Anodyne	SLC6A1	71	38
CN(CCN1CCC[C@H](c2ccncc2)C1)c1ccccc1	ZINC000450999839	CG	On-Demand	Anodyne	SLC6A1	71	38
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(CSC)c1	ZINC000450999849	DI	On-Demand	Anodyne	CARM1	49	36
CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(CSC)c1	ZINC000450999849	DI	On-Demand	Anodyne	PDS	68	37
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(CSC)c1	ZINC000450999850	DI	On-Demand	Anodyne	CARM1	49	36
CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(CSC)c1	ZINC000450999850	DI	On-Demand	Anodyne	PDS	68	37
N#C[C@@H](c1ccccc1)N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450999851	GG	On-Demand	Mild	PTAFR	42	40
N#C[C@H](c1ccccc1)N1CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1	ZINC000450999852	GG	On-Demand	Mild	PTAFR	42	40
N#C[C@@H](c1ccccc1)N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450999853	GG	On-Demand	Mild	PTAFR	42	40
N#C[C@H](c1ccccc1)N1CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1	ZINC000450999854	GG	On-Demand	Mild	PTAFR	42	40
O=C(NCCN1CCCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450999864	DD	On-Demand	Anodyne	PLD2	66	37
O=C(NCCN1CCCOCC1)c1ccc(C(F)(F)F)[nH]1	ZINC000450999864	DD	On-Demand	Anodyne	HPGDS	24	41
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	MMP13	48	38
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	COLA	42	42
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	CYP11B2	30	45
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	CPT1A	49	42
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	CPT2	37	42
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	MTNR1B	21	44
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	MMP3	45	44
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	MMP8	36	44
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	MMP9	40	38
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	TGM2	47	34
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	CPT1B	41	42
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	MMP7	52	37
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	MMP1	42	38
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	F13A1	72	38
COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000450999870	FG	On-Demand	Anodyne	ELOVL6	0	40
Cc1cc(N2CCSCC2)ccc1NS(=O)(=O)c1cccc(Cl)c1O	ZINC000450999875	GH	On-Demand	Anodyne	GHSR	0	41
CC[C@H](F)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450999877	CF	On-Demand	Anodyne	SLC6A1	44	34
CC[C@H](F)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450999878	CF	On-Demand	Anodyne	SLC6A1	44	34
CC[C@@H](F)CN1[C@H]2CC[C@H]1[C@@H](C(=O)OC(C)(C)C)C2	ZINC000450999879	CF	On-Demand	Anodyne	SLC6A1	44	34
CC[C@@H](F)CN1[C@H]2CC[C@H]1[C@H](C(=O)OC(C)(C)C)C2	ZINC000450999880	CF	On-Demand	Anodyne	SLC6A1	44	34
CC1(C)CN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC[C@@H]1O	ZINC000450999885	GE	On-Demand	Mild	AR	30	43
CC1(C)CN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC[C@@H]1O	ZINC000450999886	GE	On-Demand	Mild	AR	30	43
CC1(C)CN(C(=O)[C@@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC[C@H]1O	ZINC000450999887	GE	On-Demand	Mild	AR	30	43
CC1(C)CN(C(=O)[C@H]2CC(=O)N(c3ccc(C#N)c(Cl)c3)C2)CC[C@H]1O	ZINC000450999888	GE	On-Demand	Mild	AR	30	43
CCOC(=O)c1cc(S(=O)(=O)NCCCN2CCCC2)cnc1C(F)F	ZINC000450999894	GD	On-Demand	Anodyne	HTR7	29	40
FCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999895	CG	On-Demand	Anodyne	DRD1	40	44
FCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999895	CG	On-Demand	Anodyne	HTR1B	0	43
FCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999895	CG	On-Demand	Anodyne	DRD3	0	40
CCC(CC)Oc1ccc(C(=O)N2CC[C@H](O)C(C)(C)C2)cc1	ZINC000450999901	DG	On-Demand	Anodyne	L3MBTL3	55	35
CCC(CC)Oc1ccc(C(=O)N2CC[C@@H](O)C(C)(C)C2)cc1	ZINC000450999902	DG	On-Demand	Anodyne	L3MBTL3	55	35
Clc1ccccc1N1CCCN(Cc2csc(-c3ncccn3)n2)CC1	ZINC000450999906	GH	On-Demand	Anodyne	HTR1A	25	47
Clc1ccccc1N1CCCN(Cc2csc(-c3ncccn3)n2)CC1	ZINC000450999906	GH	On-Demand	Anodyne	DRD2	32	47
Clc1ccccc1N1CCCN(Cc2csc(-c3ncccn3)n2)CC1	ZINC000450999906	GH	On-Demand	Anodyne	DRD1	0	50
Clc1ccccc1N1CCCN(Cc2csc(-c3ncccn3)n2)CC1	ZINC000450999906	GH	On-Demand	Anodyne	DRD4	48	50
Clc1ccccc1N1CCCN(Cc2csc(-c3ncccn3)n2)CC1	ZINC000450999906	GH	On-Demand	Anodyne	DRD3	35	49
CC1(S(=O)(=O)NCCCN2CCCC2)CC1	ZINC000450999921	BC	On-Demand	Anodyne	EBP	16	44
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	CA2	24	49
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	ADRB2	16	48
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	ADRB1	24	48
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	ADRB3	24	48
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	BMP1	89	39
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	CA1	31	40
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	KCNA5	26	51
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	CA7	16	41
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP13	88	47
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	ADAM17	40	41
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	CA14	17	42
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MTNR1A	35	40
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MTNR1B	29	47
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP2	70	49
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP3	58	47
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP8	49	49
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP14	28	47
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP9	60	50
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP12	54	47
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	CA12	27	49
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP10	15	50
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP7	47	50
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	ADAMTS4	61	39
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	CA9	30	49
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	MMP1	51	47
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	LEF	18	47
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	IDO1	34	48
COc1ccc(OCCNS(=O)(=O)c2ccc(NC(=O)C(C)C)cc2)cc1	ZINC000450999928	GF	On-Demand	Anodyne	P96878_MYCTU	18	44
COc1ccc(CCNC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1OC	ZINC000450999929	GF	On-Demand	Anodyne	HCRTR1	17	43
COc1ccc(CCNC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1OC	ZINC000450999929	GF	On-Demand	Anodyne	SSTR5	42	37
COc1ccc(CCNC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1OC	ZINC000450999929	GF	On-Demand	Anodyne	ENPP1	49	31
COc1ccc(CCNC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1OC	ZINC000450999930	GF	On-Demand	Anodyne	HCRTR1	17	43
COc1ccc(CCNC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1OC	ZINC000450999930	GF	On-Demand	Anodyne	SSTR5	42	37
COc1ccc(CCNC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1OC	ZINC000450999930	GF	On-Demand	Anodyne	ENPP1	49	31
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	HTR1A	111	55
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	DRD2	108	60
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	DRD1	51	51
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	DRD4	54	50
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	ADRA1D	48	52
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	HTR2A	71	44
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	HTR2C	38	47
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	SLC6A4	27	60
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	HRH1	23	43
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	ADRA1B	38	55
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	DRD3	95	51
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	DRD5	39	40
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	HTR7	103	45
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	KCNQ2	56	39
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	HNMT	49	32
FCCCCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999949	CH	On-Demand	Anodyne	NOX1	42	31
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	HTR1A	68	55
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	DRD2	60	55
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	DRD1	24	43
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	DRD4	34	45
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	ADRA1D	31	55
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	HTR1B	0	45
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	HTR2A	32	55
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	HTR2C	16	42
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	ADRA1A	28	46
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	ADRA1B	24	55
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	DRD3	64	47
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	HTR7	44	40
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	NOX1	42	31
FC(F)(F)CCN1CCCN(c2ccccc2Cl)CC1	ZINC000450999955	DH	On-Demand	Anodyne	NOX5	43	31
CC(=O)N1CCC(NS(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450999956	FE	On-Demand	Anodyne	CCR8	131	55
CC(=O)N1CCC(NS(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450999956	FE	On-Demand	Anodyne	SFRP1	147	45
CC(=O)N1CCC(NS(=O)(=O)c2ccc3ccccc3c2F)CC1	ZINC000450999956	FE	On-Demand	Anodyne	WNT3	100	45
C[C@@H]1Cc2ncn(CC(=O)Nc3c(Cl)cccc3C(F)(F)F)c2C[C@H]1C	ZINC000450999960	GJ	On-Demand	Anodyne	P2RX7	45	36
C[C@H]1Cc2c(ncn2CC(=O)Nc2c(Cl)cccc2C(F)(F)F)C[C@H]1C	ZINC000450999961	GJ	On-Demand	Anodyne	P2RX7	45	36
C[C@H]1Cc2ncn(CC(=O)Nc3c(Cl)cccc3C(F)(F)F)c2C[C@@H]1C	ZINC000450999962	GJ	On-Demand	Anodyne	P2RX7	45	36
C[C@H]1Cc2ncn(CC(=O)Nc3c(Cl)cccc3C(F)(F)F)c2C[C@H]1C	ZINC000450999963	GJ	On-Demand	Anodyne	P2RX7	45	36
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	FKBP1A	60	49
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	MMP13	89	54
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	UL80	16	42
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	CCR4	0	42
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	BDKRB1	20	41
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	ADAM17	75	43
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	CAPNS1	15	41
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	MMP2	43	42
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	MMP3	85	54
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	MMP8	34	44
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	MMP9	44	45
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	EPHX2	30	49
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	MMP7	87	54
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	MMP1	92	54
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	AKR1C3	0	40
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	LUXN	0	50
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	ADIPOR1	0	45
COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999980	GD	On-Demand	Anodyne	ADIPOR2	0	45
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	FKBP1A	60	49
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	MMP13	89	54
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	UL80	16	42
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	CCR4	0	42
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	BDKRB1	20	41
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	ADAM17	75	43
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	CAPNS1	15	41
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	MMP2	43	42
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	MMP3	85	54
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	MMP8	34	44
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	MMP9	44	45
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	EPHX2	30	49
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	MMP7	87	54
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	MMP1	92	54
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	AKR1C3	0	40
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	LUXN	0	50
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	ADIPOR1	0	45
COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999982	GD	On-Demand	Anodyne	ADIPOR2	0	45
Cc1csc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)c1	ZINC000450999985	DF	On-Demand	Anodyne	CHRNA2	49	50
Cc1csc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)c1	ZINC000450999985	DF	On-Demand	Anodyne	CRTY	0	50
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	MMP13	46	44
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	ADAM17	15	44
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	MMP2	35	40
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	MMP3	21	40
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	MMP8	21	41
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	MMP14	19	41
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	MMP9	20	44
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	ADAMTS4	67	40
CC(C)[C@H](C#N)NS(=O)(=O)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000450999987	FD	On-Demand	Mild	LUXN	0	43
Cc1ccc2c(c1)CCCN2S(=O)(=O)Cc1cccc(S(C)(=O)=O)c1	ZINC000450999991	GF	On-Demand	Anodyne	CYP11B2	32	46
Cc1csc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)c1	ZINC000450999995	DF	On-Demand	Anodyne	CHRNA2	49	50
Cc1csc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)c1	ZINC000450999995	DF	On-Demand	Anodyne	CRTY	0	50
N#CCc1ccc(S(=O)(=O)NCCCN2CCCCC2)c(Cl)c1	ZINC000450999996	FF	On-Demand	Mild	CCR1	18	49
N#CCc1ccc(S(=O)(=O)NCCCN2CCCCC2)c(Cl)c1	ZINC000450999996	FF	On-Demand	Mild	HNMT	57	36